C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)/C=C/c1ccc(C(N)=O)cc1	ZINC000819000028	GD	On-Demand	Anodyne	TMPRSS11D	55	32
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1	ZINC000819000029	GD	On-Demand	Anodyne	TMPRSS11D	55	32
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H]1CCCN1C(=O)/C=C/c1ccc(C(N)=O)cc1	ZINC000819000030	GD	On-Demand	Anodyne	TMPRSS11D	55	32
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)/C=C\c1ccc(C(N)=O)cc1	ZINC000819000031	GD	On-Demand	Anodyne	TMPRSS11D	55	32
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@@]2(O)CCC[C@H]2C)cc1OC	ZINC000819000032	HG	On-Demand	Anodyne	DRD3	15	40
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@@]2(O)CCC[C@H]2C)cc1OC	ZINC000819000032	HG	On-Demand	Anodyne	KCNA3	54	47
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@@]2(O)CCC[C@H]2C)cc1OC	ZINC000819000032	HG	On-Demand	Anodyne	HCN1	54	37
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@@]2(O)CCC[C@H]2C)cc1OC	ZINC000819000032	HG	On-Demand	Anodyne	HCN4	51	35
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@@]2(O)CCC[C@H]2C)cc1OC	ZINC000819000032	HG	On-Demand	Anodyne	KCNK3	45	40
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@]2(O)CCC[C@H]2C)cc1OC	ZINC000819000033	HG	On-Demand	Anodyne	DRD3	15	40
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@]2(O)CCC[C@H]2C)cc1OC	ZINC000819000033	HG	On-Demand	Anodyne	KCNA3	54	47
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@]2(O)CCC[C@H]2C)cc1OC	ZINC000819000033	HG	On-Demand	Anodyne	HCN1	54	37
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@]2(O)CCC[C@H]2C)cc1OC	ZINC000819000033	HG	On-Demand	Anodyne	HCN4	51	35
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@]2(O)CCC[C@H]2C)cc1OC	ZINC000819000033	HG	On-Demand	Anodyne	KCNK3	45	40
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@]2(O)CCC[C@@H]2C)cc1OC	ZINC000819000034	HG	On-Demand	Anodyne	DRD3	15	40
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@]2(O)CCC[C@@H]2C)cc1OC	ZINC000819000034	HG	On-Demand	Anodyne	KCNA3	54	47
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@]2(O)CCC[C@@H]2C)cc1OC	ZINC000819000034	HG	On-Demand	Anodyne	HCN1	54	37
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@]2(O)CCC[C@@H]2C)cc1OC	ZINC000819000034	HG	On-Demand	Anodyne	HCN4	51	35
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@]2(O)CCC[C@@H]2C)cc1OC	ZINC000819000034	HG	On-Demand	Anodyne	KCNK3	45	40
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@@]2(O)CCC[C@@H]2C)cc1OC	ZINC000819000035	HG	On-Demand	Anodyne	DRD3	15	40
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@@]2(O)CCC[C@@H]2C)cc1OC	ZINC000819000035	HG	On-Demand	Anodyne	KCNA3	54	47
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@@]2(O)CCC[C@@H]2C)cc1OC	ZINC000819000035	HG	On-Demand	Anodyne	HCN1	54	37
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@@]2(O)CCC[C@@H]2C)cc1OC	ZINC000819000035	HG	On-Demand	Anodyne	HCN4	51	35
COc1cc(NC(=O)c2ccccc2)c(C(=O)NC[C@@]2(O)CCC[C@@H]2C)cc1OC	ZINC000819000035	HG	On-Demand	Anodyne	KCNK3	45	40
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccccc1COc1cccc(C=O)c1	ZINC000819000044	FG	On-Demand	Anodyne	KCNA3	42	33
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccccc1COc1cccc(C=O)c1	ZINC000819000044	FG	On-Demand	Anodyne	HCN1	52	33
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccccc1COc1cccc(C=O)c1	ZINC000819000044	FG	On-Demand	Anodyne	HCN4	49	33
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccccc1COc1cccc(C=O)c1	ZINC000819000045	FG	On-Demand	Anodyne	KCNA3	42	33
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccccc1COc1cccc(C=O)c1	ZINC000819000045	FG	On-Demand	Anodyne	HCN1	52	33
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccccc1COc1cccc(C=O)c1	ZINC000819000045	FG	On-Demand	Anodyne	HCN4	49	33
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccccc1COc1cccc(C=O)c1	ZINC000819000047	FG	On-Demand	Anodyne	KCNA3	42	33
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccccc1COc1cccc(C=O)c1	ZINC000819000047	FG	On-Demand	Anodyne	HCN1	52	33
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccccc1COc1cccc(C=O)c1	ZINC000819000047	FG	On-Demand	Anodyne	HCN4	49	33
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819000073	IF	On-Demand	Bother	CACNA1D	52	33
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819000074	IF	On-Demand	Bother	CACNA1D	52	33
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819000075	IF	On-Demand	Bother	CACNA1D	52	33
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccsc1NC(=O)c1ccccc1Cl	ZINC000819000076	GH	On-Demand	Anodyne	P2RX7	19	44
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccsc1NC(=O)c1ccccc1Cl	ZINC000819000076	GH	On-Demand	Anodyne	KCNA3	41	36
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccsc1NC(=O)c1ccccc1Cl	ZINC000819000076	GH	On-Demand	Anodyne	HCN1	50	31
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccsc1NC(=O)c1ccccc1Cl	ZINC000819000076	GH	On-Demand	Anodyne	HCN4	48	31
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccsc1NC(=O)c1ccccc1Cl	ZINC000819000077	GH	On-Demand	Anodyne	P2RX7	19	44
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccsc1NC(=O)c1ccccc1Cl	ZINC000819000077	GH	On-Demand	Anodyne	KCNA3	41	36
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccsc1NC(=O)c1ccccc1Cl	ZINC000819000077	GH	On-Demand	Anodyne	HCN1	50	31
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccsc1NC(=O)c1ccccc1Cl	ZINC000819000077	GH	On-Demand	Anodyne	HCN4	48	31
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccsc1NC(=O)c1ccccc1Cl	ZINC000819000079	GH	On-Demand	Anodyne	P2RX7	19	44
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccsc1NC(=O)c1ccccc1Cl	ZINC000819000079	GH	On-Demand	Anodyne	KCNA3	41	36
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccsc1NC(=O)c1ccccc1Cl	ZINC000819000079	GH	On-Demand	Anodyne	HCN1	50	31
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccsc1NC(=O)c1ccccc1Cl	ZINC000819000079	GH	On-Demand	Anodyne	HCN4	48	31
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819000080	GH	On-Demand	Anodyne	F10	36	46
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819000080	GH	On-Demand	Anodyne	KCNA3	42	38
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819000080	GH	On-Demand	Anodyne	HCN1	50	32
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819000080	GH	On-Demand	Anodyne	HCN4	48	32
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819000080	GH	On-Demand	Anodyne	G2YM83_BOTF4	52	33
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819000082	GH	On-Demand	Anodyne	F10	36	46
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819000082	GH	On-Demand	Anodyne	KCNA3	42	38
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819000082	GH	On-Demand	Anodyne	HCN1	50	32
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819000082	GH	On-Demand	Anodyne	HCN4	48	32
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819000082	GH	On-Demand	Anodyne	G2YM83_BOTF4	52	33
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819000085	GH	On-Demand	Anodyne	F10	36	46
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819000085	GH	On-Demand	Anodyne	KCNA3	42	38
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819000085	GH	On-Demand	Anodyne	HCN1	50	32
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819000085	GH	On-Demand	Anodyne	HCN4	48	32
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819000085	GH	On-Demand	Anodyne	G2YM83_BOTF4	52	33
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819000103	GE	On-Demand	Anodyne	CNR2	16	45
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819000103	GE	On-Demand	Anodyne	SLC6A9	51	38
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819000103	GE	On-Demand	Anodyne	CACNA1I	52	32
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819000104	GE	On-Demand	Anodyne	CNR2	16	45
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819000104	GE	On-Demand	Anodyne	SLC6A9	51	38
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819000104	GE	On-Demand	Anodyne	CACNA1I	52	32
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819000105	GE	On-Demand	Anodyne	CNR2	16	45
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819000105	GE	On-Demand	Anodyne	SLC6A9	51	38
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819000105	GE	On-Demand	Anodyne	CACNA1I	52	32
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	CELA1	19	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	ELANE	24	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	CTSD	15	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	CTRA_BOVIN	42	31
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	CASP3	18	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	BMP1	26	56
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	KLK3	73	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	CTSB	74	47
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	PAPA1_CARPA	83	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	CYSP_TRYCR	54	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	NTSR1	57	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	NTSR2	46	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	CTSK	48	53
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	CTSL	56	47
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	PGA	25	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	TIMP3	58	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	CAPNS1	67	39
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	REN	29	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	CTSS	28	47
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	CAPN1	89	53
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	CASP1	28	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	CAPN2	145	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	CASP6	15	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	CASP9	39	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	POLG_HCV1	17	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	NPR	81	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	GAG-PRO	45	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	CASP10	35	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	PSMB5	50	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819000122	GF	On-Demand	Anodyne	Q6PRC7_IXORI	16	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	CELA1	19	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	ELANE	24	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	CTSD	15	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	CTRA_BOVIN	42	31
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	CASP3	18	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	BMP1	26	56
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	KLK3	73	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	CTSB	74	47
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	PAPA1_CARPA	83	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	CYSP_TRYCR	54	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	NTSR1	57	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	NTSR2	46	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	CTSK	48	53
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	CTSL	56	47
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	PGA	25	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	TIMP3	58	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	CAPNS1	67	39
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	REN	29	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	CTSS	28	47
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	CAPN1	89	53
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	CASP1	28	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	CAPN2	145	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	CASP6	15	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	CASP9	39	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	POLG_HCV1	17	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	NPR	81	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	GAG-PRO	45	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	CASP10	35	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	PSMB5	50	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819000123	GF	On-Demand	Anodyne	Q6PRC7_IXORI	16	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	CELA1	19	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	ELANE	24	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	CTSD	15	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	CTRA_BOVIN	42	31
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	CASP3	18	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	BMP1	26	56
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	KLK3	73	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	CTSB	74	47
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	PAPA1_CARPA	83	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	CYSP_TRYCR	54	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	NTSR1	57	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	NTSR2	46	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	CTSK	48	53
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	CTSL	56	47
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	PGA	25	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	TIMP3	58	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	CAPNS1	67	39
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	REN	29	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	CTSS	28	47
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	CAPN1	89	53
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	CASP1	28	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	CAPN2	145	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	CASP6	15	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	CASP9	39	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	POLG_HCV1	17	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	NPR	81	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	GAG-PRO	45	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	CASP10	35	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	PSMB5	50	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819000124	GF	On-Demand	Anodyne	Q6PRC7_IXORI	16	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	CELA1	19	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	ELANE	24	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	CTSD	15	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	CTRA_BOVIN	42	31
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	CASP3	18	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	BMP1	26	56
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	KLK3	73	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	CTSB	74	47
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	PAPA1_CARPA	83	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	CYSP_TRYCR	54	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	NTSR1	57	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	NTSR2	46	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	CTSK	48	53
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	CTSL	56	47
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	PGA	25	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	TIMP3	58	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	CAPNS1	67	39
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	REN	29	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	CTSS	28	47
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	CAPN1	89	53
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	CASP1	28	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	CAPN2	145	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	CASP6	15	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	CASP9	39	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	POLG_HCV1	17	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	NPR	81	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	GAG-PRO	45	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	CASP10	35	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	PSMB5	50	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819000125	GF	On-Demand	Anodyne	Q6PRC7_IXORI	16	41
C[C@H]1CCC[C@@]1(O)CNC(=O)c1cc(-c2ccco2)nc2ccccc12	ZINC000819000146	FH	On-Demand	Anodyne	TACR3	16	50
C[C@H]1CCC[C@]1(O)CNC(=O)c1cc(-c2ccco2)nc2ccccc12	ZINC000819000147	FH	On-Demand	Anodyne	TACR3	16	50
C[C@@H]1CCC[C@]1(O)CNC(=O)c1cc(-c2ccco2)nc2ccccc12	ZINC000819000150	FH	On-Demand	Anodyne	TACR3	16	50
Cc1nc(NC2CC2)sc1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819000153	EF	On-Demand	Anodyne	SCD1	20	46
C[C@@H]1CCC[C@]1(O)CNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000819000182	HE	On-Demand	Anodyne	SLC6A9	66	40
C[C@H]1CCC[C@@]1(O)CNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000819000188	HE	On-Demand	Anodyne	SLC6A9	66	40
C[C@H]1CCC[C@]1(O)CNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000819000189	HE	On-Demand	Anodyne	SLC6A9	66	40
Cc1nc(N2CCOCC2)ccc1NC(=O)C(=O)NCC(=O)O	ZINC000819000197	DB	On-Demand	Anodyne	DGAT1	26	41
Cc1nc(NC(=O)NCC(=O)O)sc1-c1ccccc1	ZINC000819000203	CE	On-Demand	Anodyne	PIK3CG	25	50
Cc1nc(NC(=O)NCC(=O)O)sc1-c1ccccc1	ZINC000819000203	CE	On-Demand	Anodyne	PI4KB	44	48
Cc1nc(NC2CC2)sc1C(=O)NCCCC(=O)O	ZINC000819000206	CD	On-Demand	Anodyne	SCD1	15	40
Cc1nc(N2CCOCC2)ccc1NC(=O)N(C)CCC(=O)O	ZINC000819000209	DD	On-Demand	Anodyne	CASR	46	37
Cc1nc(NC2CC2)sc1C(=O)NCCC(=O)O	ZINC000819000213	CD	On-Demand	Anodyne	SCD1	18	42
Cc1nc(NC2CC2)sc1C(=O)NCCC(=O)O	ZINC000819000213	CD	On-Demand	Anodyne	SCD	15	40
Cc1nc(N2CCOCC2)ccc1NC(=O)NCC(=O)O	ZINC000819000216	CC	On-Demand	Anodyne	PIK3CA	29	41
Cc1nc(N2CCOCC2)ccc1NC(=O)NCC(=O)O	ZINC000819000216	CC	On-Demand	Anodyne	MTOR	48	41
Cc1nc(N2CCOCC2)ccc1NC(=O)NCC(=O)O	ZINC000819000216	CC	On-Demand	Anodyne	PIK3CG	25	41
Cc1nc(N2CCOCC2)ccc1NC(=O)NCC(=O)O	ZINC000819000216	CC	On-Demand	Anodyne	PIK3CB	50	37
Cc1nc(N2CCOCC2)ccc1NC(=O)NCC(=O)O	ZINC000819000216	CC	On-Demand	Anodyne	DGAT1	26	41
Cc1nc(NC2CC2)sc1C(=O)NCC(=O)O	ZINC000819000219	CC	On-Demand	Anodyne	SCD1	19	43
Cc1nc(NC(=O)NCCC(=O)O)sc1-c1ccccc1	ZINC000819000228	DF	On-Demand	Anodyne	PIK3CG	26	59
Cc1nc(NC(=O)NCCC(=O)O)sc1-c1ccccc1	ZINC000819000228	DF	On-Demand	Anodyne	PI4KB	44	54
C[C@H]1CCC[C@@]1(O)CNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819000289	ED	On-Demand	Anodyne	L3MBTL3	43	34
C[C@H]1CCC[C@@]1(O)CNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819000289	ED	On-Demand	Anodyne	NAMPT	20	41
C[C@@H]1CCC[C@]1(O)CNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819000290	ED	On-Demand	Anodyne	L3MBTL3	43	34
C[C@@H]1CCC[C@]1(O)CNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819000290	ED	On-Demand	Anodyne	NAMPT	20	41
C[C@H]1CCC[C@]1(O)CNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819000291	ED	On-Demand	Anodyne	L3MBTL3	43	34
C[C@H]1CCC[C@]1(O)CNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819000291	ED	On-Demand	Anodyne	NAMPT	20	41
C[C@H]1CCC[C@@]1(O)CNC(=O)C1=NOC2(CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819000325	GE	On-Demand	Anodyne	GPR119	17	49
C[C@@H]1CCC[C@]1(O)CNC(=O)C1=NOC2(CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819000326	GE	On-Demand	Anodyne	GPR119	17	49
C[C@H]1CCC[C@]1(O)CNC(=O)C1=NOC2(CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819000327	GE	On-Demand	Anodyne	GPR119	17	49
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819000352	CE	On-Demand	Anodyne	ACE	44	39
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819000352	CE	On-Demand	Anodyne	MME	77	39
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819000352	CE	On-Demand	Anodyne	TIMP3	75	36
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819000355	CE	On-Demand	Anodyne	ACE	44	39
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819000355	CE	On-Demand	Anodyne	MME	77	39
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819000355	CE	On-Demand	Anodyne	TIMP3	75	36
Cc1cc(C(=O)NC[C@@]2(O)CCC[C@@H]2C)c(C)n1Cc1ccccc1	ZINC000819000384	EG	On-Demand	Anodyne	KCNA3	44	37
Cc1cc(C(=O)NC[C@@]2(O)CCC[C@@H]2C)c(C)n1Cc1ccccc1	ZINC000819000384	EG	On-Demand	Anodyne	HCN1	52	32
Cc1cc(C(=O)NC[C@@]2(O)CCC[C@@H]2C)c(C)n1Cc1ccccc1	ZINC000819000384	EG	On-Demand	Anodyne	HCN4	48	32
Cc1cc(C(=O)NC[C@@]2(O)CCC[C@H]2C)c(C)n1Cc1ccccc1	ZINC000819000386	EG	On-Demand	Anodyne	KCNA3	44	37
Cc1cc(C(=O)NC[C@@]2(O)CCC[C@H]2C)c(C)n1Cc1ccccc1	ZINC000819000386	EG	On-Demand	Anodyne	HCN1	52	32
Cc1cc(C(=O)NC[C@@]2(O)CCC[C@H]2C)c(C)n1Cc1ccccc1	ZINC000819000386	EG	On-Demand	Anodyne	HCN4	48	32
C[C@@H]1CCC[C@]1(O)CNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819000408	GE	On-Demand	Anodyne	SLC6A9	68	40
C[C@H]1CCC[C@]1(O)CNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819000409	GE	On-Demand	Anodyne	SLC6A9	68	40
C[C@H]1CCC[C@@]1(O)CNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819000411	GE	On-Demand	Anodyne	SLC6A9	68	40
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccc2c(c1)CCCN2C(=O)OC(C)(C)C	ZINC000819000429	GH	On-Demand	Anodyne	GPR119	15	40
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccc2c(c1)CCCN2C(=O)OC(C)(C)C	ZINC000819000430	GH	On-Demand	Anodyne	GPR119	15	40
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccc2c(c1)CCCN2C(=O)OC(C)(C)C	ZINC000819000431	GH	On-Demand	Anodyne	GPR119	15	40
C[C@@H]1CCC[C@]1(O)CNC(=O)CC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819000522	GH	On-Demand	Anodyne	REN	37	40
C[C@@H]1CCC[C@]1(O)CNC(=O)CC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819000522	GH	On-Demand	Anodyne	FPR1	42	36
C[C@@H]1CCC[C@]1(O)CNC(=O)CC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819000523	GH	On-Demand	Anodyne	REN	37	40
C[C@@H]1CCC[C@]1(O)CNC(=O)CC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819000523	GH	On-Demand	Anodyne	FPR1	42	36
Cc1cccc(C(=O)NC[C@]2(O)CCC[C@H]2C)c1NC(=O)c1ccccc1F	ZINC000819000542	GH	On-Demand	Anodyne	KCNA3	41	34
Cc1cccc(C(=O)NC[C@]2(O)CCC[C@H]2C)c1NC(=O)c1ccccc1F	ZINC000819000542	GH	On-Demand	Anodyne	HCN1	42	31
Cc1cccc(C(=O)NC[C@]2(O)CCC[C@H]2C)c1NC(=O)c1ccccc1F	ZINC000819000542	GH	On-Demand	Anodyne	HCN4	40	31
Cc1cccc(C(=O)NC[C@]2(O)CCC[C@@H]2C)c1NC(=O)c1ccccc1F	ZINC000819000544	GH	On-Demand	Anodyne	KCNA3	41	34
Cc1cccc(C(=O)NC[C@]2(O)CCC[C@@H]2C)c1NC(=O)c1ccccc1F	ZINC000819000544	GH	On-Demand	Anodyne	HCN1	42	31
Cc1cccc(C(=O)NC[C@]2(O)CCC[C@@H]2C)c1NC(=O)c1ccccc1F	ZINC000819000544	GH	On-Demand	Anodyne	HCN4	40	31
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	F2	74	45
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	PRSS1	22	43
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	ACE	38	46
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	FKBP1A	58	49
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	OPRM1	30	40
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	OPRD1	17	40
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	CELA1	34	54
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	ELANE	39	44
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	CMA1	33	40
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	CTRA_BOVIN	66	36
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	TRY1_BOVIN	84	40
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	NTSR1	47	34
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	CTSG	45	36
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	HLA-A	48	34
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	PREP	78	54
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	CELA2A	54	36
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	LGMN	93	52
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	CTRC	17	40
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	ACE2	22	43
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	KLK5	27	46
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	XIAP	44	44
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	BRCA1	65	35
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	SLC12A5	75	41
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000554	FE	On-Demand	Anodyne	TMPRSS11D	71	40
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	F2	74	45
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	PRSS1	22	43
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	ACE	38	46
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	FKBP1A	58	49
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	OPRM1	30	40
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	OPRD1	17	40
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	CELA1	34	54
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	ELANE	39	44
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	CMA1	33	40
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	CTRA_BOVIN	66	36
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	TRY1_BOVIN	84	40
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	NTSR1	47	34
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	CTSG	45	36
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	HLA-A	48	34
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	PREP	78	54
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	CELA2A	54	36
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	LGMN	93	52
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	CTRC	17	40
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	ACE2	22	43
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	KLK5	27	46
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	XIAP	44	44
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	BRCA1	65	35
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	SLC12A5	75	41
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000556	FE	On-Demand	Anodyne	TMPRSS11D	71	40
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	F2	74	45
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	PRSS1	22	43
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	ACE	38	46
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	FKBP1A	58	49
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	OPRM1	30	40
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	OPRD1	17	40
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	CELA1	34	54
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	ELANE	39	44
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	CMA1	33	40
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	CTRA_BOVIN	66	36
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	TRY1_BOVIN	84	40
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	NTSR1	47	34
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	CTSG	45	36
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	HLA-A	48	34
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	PREP	78	54
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	CELA2A	54	36
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	LGMN	93	52
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	CTRC	17	40
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	ACE2	22	43
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	KLK5	27	46
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	XIAP	44	44
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	BRCA1	65	35
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	SLC12A5	75	41
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819000557	FE	On-Demand	Anodyne	TMPRSS11D	71	40
C[C@@H]1CCC[C@]1(O)CNC(=O)C(C)(C)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819000567	HH	On-Demand	Anodyne	FPR1	40	36
C[C@@H]1CCC[C@]1(O)CNC(=O)C(C)(C)[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819000568	HH	On-Demand	Anodyne	FPR1	40	36
C[C@H]1CCC[C@]1(O)CNC(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819000595	FH	On-Demand	Anodyne	ACACB	15	57
C[C@H]1CCC[C@]1(O)CNC(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819000595	FH	On-Demand	Anodyne	TACR3	20	50
C[C@H]1CCC[C@]1(O)CNC(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819000595	FH	On-Demand	Anodyne	MT-CO2	47	38
C[C@H]1CCC[C@@]1(O)CNC(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819000596	FH	On-Demand	Anodyne	ACACB	15	57
C[C@H]1CCC[C@@]1(O)CNC(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819000596	FH	On-Demand	Anodyne	TACR3	20	50
C[C@H]1CCC[C@@]1(O)CNC(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819000596	FH	On-Demand	Anodyne	MT-CO2	47	38
C[C@@H]1CCC[C@]1(O)CNC(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819000597	FH	On-Demand	Anodyne	ACACB	15	57
C[C@@H]1CCC[C@]1(O)CNC(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819000597	FH	On-Demand	Anodyne	TACR3	20	50
C[C@@H]1CCC[C@]1(O)CNC(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819000597	FH	On-Demand	Anodyne	MT-CO2	47	38
C/C(=C/C(=O)NC[C@]1(O)CCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1	ZINC000819000622	DF	On-Demand	Bother	NMBR	47	31
C/C(=C\C(=O)NC[C@]1(O)CCC[C@H]1C)c1ccc([N+](=O)[O-])cc1	ZINC000819000623	DF	On-Demand	Bother	NMBR	47	31
C/C(=C/C(=O)NC[C@]1(O)CCC[C@H]1C)c1ccc([N+](=O)[O-])cc1	ZINC000819000624	DF	On-Demand	Bother	NMBR	47	31
C/C(=C\C(=O)NC[C@]1(O)CCC[C@@H]1C)c1ccc([N+](=O)[O-])cc1	ZINC000819000625	DF	On-Demand	Bother	NMBR	47	31
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000670	ID	On-Demand	Anodyne	ACE	15	42
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000670	ID	On-Demand	Anodyne	CTRA_BOVIN	41	32
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000670	ID	On-Demand	Anodyne	KLK3	82	37
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000670	ID	On-Demand	Anodyne	CTSB	70	42
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000670	ID	On-Demand	Anodyne	PAPA1_CARPA	64	38
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000670	ID	On-Demand	Anodyne	CYSP_TRYCR	57	42
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000670	ID	On-Demand	Anodyne	CTSK	55	49
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000670	ID	On-Demand	Anodyne	CTSL	52	42
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000670	ID	On-Demand	Anodyne	CAPNS1	66	38
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000670	ID	On-Demand	Anodyne	CTSS	37	49
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000670	ID	On-Demand	Anodyne	CAPN1	95	46
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000670	ID	On-Demand	Anodyne	CASP1	23	40
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000670	ID	On-Demand	Anodyne	CAPN2	140	46
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000670	ID	On-Demand	Anodyne	NPR	74	39
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000670	ID	On-Demand	Anodyne	PSMB5	41	41
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000672	ID	On-Demand	Anodyne	ACE	15	42
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000672	ID	On-Demand	Anodyne	CTRA_BOVIN	41	32
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000672	ID	On-Demand	Anodyne	KLK3	82	37
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000672	ID	On-Demand	Anodyne	CTSB	70	42
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000672	ID	On-Demand	Anodyne	PAPA1_CARPA	64	38
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000672	ID	On-Demand	Anodyne	CYSP_TRYCR	57	42
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000672	ID	On-Demand	Anodyne	CTSK	55	49
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000672	ID	On-Demand	Anodyne	CTSL	52	42
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000672	ID	On-Demand	Anodyne	CAPNS1	66	38
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000672	ID	On-Demand	Anodyne	CTSS	37	49
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000672	ID	On-Demand	Anodyne	CAPN1	95	46
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000672	ID	On-Demand	Anodyne	CASP1	23	40
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000672	ID	On-Demand	Anodyne	CAPN2	140	46
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000672	ID	On-Demand	Anodyne	NPR	74	39
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819000672	ID	On-Demand	Anodyne	PSMB5	41	41
C[C@H]1CCC[C@@]1(O)CNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819000679	GD	On-Demand	Anodyne	GRIN2B	23	43
C[C@H]1CCC[C@@]1(O)CNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819000679	GD	On-Demand	Anodyne	PREP	26	40
C[C@H]1CCC[C@@]1(O)CNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819000679	GD	On-Demand	Anodyne	SLC12A5	69	39
C[C@@H]1CCC[C@]1(O)CNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819000680	GD	On-Demand	Anodyne	GRIN2B	23	43
C[C@@H]1CCC[C@]1(O)CNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819000680	GD	On-Demand	Anodyne	PREP	26	40
C[C@@H]1CCC[C@]1(O)CNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819000680	GD	On-Demand	Anodyne	SLC12A5	69	39
C[C@H]1CCC[C@]1(O)CNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819000681	GD	On-Demand	Anodyne	GRIN2B	23	43
C[C@H]1CCC[C@]1(O)CNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819000681	GD	On-Demand	Anodyne	PREP	26	40
C[C@H]1CCC[C@]1(O)CNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819000681	GD	On-Demand	Anodyne	SLC12A5	69	39
C[C@H]1CCC[C@]1(O)CNC(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	ZINC000819000683	IE	On-Demand	Anodyne	BMP1	42	37
C[C@H]1CCC[C@@]1(O)CNC(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	ZINC000819000684	IE	On-Demand	Anodyne	BMP1	42	37
C[C@@H]1CCC[C@]1(O)CNC(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	ZINC000819000685	IE	On-Demand	Anodyne	BMP1	42	37
C[C@H]1CCC[C@@]1(O)CNC(=O)c1cccc(Cl)c1O	ZINC000819000766	CE	On-Demand	Anodyne	P2RX7	26	46
C[C@H]1CCC[C@@]1(O)CNC(=O)c1cccc(Cl)c1O	ZINC000819000766	CE	On-Demand	Anodyne	KCNA3	44	35
C[C@H]1CCC[C@@]1(O)CNC(=O)c1cccc(Cl)c1O	ZINC000819000766	CE	On-Demand	Anodyne	HCN1	53	33
C[C@H]1CCC[C@@]1(O)CNC(=O)c1cccc(Cl)c1O	ZINC000819000766	CE	On-Demand	Anodyne	HCN4	50	33
C[C@@H]1CCC[C@]1(O)CNC(=O)c1cccc(Cl)c1O	ZINC000819000767	CE	On-Demand	Anodyne	P2RX7	26	46
C[C@@H]1CCC[C@]1(O)CNC(=O)c1cccc(Cl)c1O	ZINC000819000767	CE	On-Demand	Anodyne	KCNA3	44	35
C[C@@H]1CCC[C@]1(O)CNC(=O)c1cccc(Cl)c1O	ZINC000819000767	CE	On-Demand	Anodyne	HCN1	53	33
C[C@@H]1CCC[C@]1(O)CNC(=O)c1cccc(Cl)c1O	ZINC000819000767	CE	On-Demand	Anodyne	HCN4	50	33
C[C@H]1CCC[C@]1(O)CNC(=O)c1cccc(Cl)c1O	ZINC000819000768	CE	On-Demand	Anodyne	P2RX7	26	46
C[C@H]1CCC[C@]1(O)CNC(=O)c1cccc(Cl)c1O	ZINC000819000768	CE	On-Demand	Anodyne	KCNA3	44	35
C[C@H]1CCC[C@]1(O)CNC(=O)c1cccc(Cl)c1O	ZINC000819000768	CE	On-Demand	Anodyne	HCN1	53	33
C[C@H]1CCC[C@]1(O)CNC(=O)c1cccc(Cl)c1O	ZINC000819000768	CE	On-Demand	Anodyne	HCN4	50	33
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H]1CCCN1C(=O)C(F)(F)F	ZINC000819000774	DD	On-Demand	Anodyne	CELA1	43	34
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCCN1C(=O)C(F)(F)F	ZINC000819000777	DD	On-Demand	Anodyne	CELA1	43	34
C[C@H]1CCC[C@]1(O)CNC(=O)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl	ZINC000819000791	HF	On-Demand	Anodyne	SLC6A9	42	35
C[C@H]1CCC[C@@]1(O)CNC(=O)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl	ZINC000819000792	HF	On-Demand	Anodyne	SLC6A9	42	35
C[C@@H]1CCC[C@]1(O)CNC(=O)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl	ZINC000819000793	HF	On-Demand	Anodyne	SLC6A9	42	35
CO[C@@H](C)CCNC[C@H](O)c1ccc(Br)cc1	ZINC000819000862	DE	On-Demand	Anodyne	ADRB2	17	54
CO[C@@H](C)CCNC[C@@H](O)c1ccc(Br)cc1	ZINC000819000863	DE	On-Demand	Anodyne	ADRB2	17	54
CO[C@@H](C)CCNC[C@H](O)c1cccc2ccccc12	ZINC000819000875	CF	On-Demand	Anodyne	ADRB2	18	40
O=[N+]([O-])c1cccc([C@H](O)CNCCn2cncn2)c1	ZINC000819000877	CC	On-Demand	Bother	ADRB3	50	46
O=[N+]([O-])c1cccc([C@@H](O)CNCCn2cncn2)c1	ZINC000819000878	CC	On-Demand	Bother	ADRB3	50	46
O=C(NCCCc1ccccc1)C(F)=C1CCC1	ZINC000819000889	BG	On-Demand	Anodyne	AMP1_PLAFQ	23	44
O=C(NCCCc1ccccc1)C(F)=C1CCC1	ZINC000819000889	BG	On-Demand	Anodyne	CRTM	36	41
O=C(NCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819000909	CG	On-Demand	Anodyne	ACHE	30	41
O=C(NCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819000909	CG	On-Demand	Anodyne	TACR1	16	49
O=C(NCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819000909	CG	On-Demand	Anodyne	CCKAR	22	46
O=C(NCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819000909	CG	On-Demand	Anodyne	BCHE	19	45
O=C(NCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819000909	CG	On-Demand	Anodyne	MPO	50	43
O=C(NCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819000909	CG	On-Demand	Anodyne	BRS3	29	45
O=C(NCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819000909	CG	On-Demand	Anodyne	NMBR	66	32
O=C(NCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819000909	CG	On-Demand	Anodyne	MC5R	37	41
O=C(NCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819000909	CG	On-Demand	Anodyne	GRPR	49	31
O=C(NCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819000909	CG	On-Demand	Anodyne	SSTR3	19	42
O=C(NCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819000909	CG	On-Demand	Anodyne	MMP9	15	64
O=C(NCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819000909	CG	On-Demand	Anodyne	SSSIM	26	40
COc1ccc(N2CC[C@H](CNC(=O)[C@H]3CC[C@H](C(=O)O)O3)C2)cc1	ZINC000819000932	ED	On-Demand	Clean	CACNA1I	47	31
COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3CC[C@@H](C(=O)O)O3)C2)cc1	ZINC000819000933	ED	On-Demand	Clean	CACNA1I	47	31
COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3CC[C@H](C(=O)O)O3)C2)cc1	ZINC000819000934	ED	On-Demand	Clean	CACNA1I	47	31
COc1ccc(N2CC[C@H](CNC(=O)[C@H]3CC[C@@H](C(=O)O)O3)C2)cc1	ZINC000819000935	ED	On-Demand	Clean	CACNA1I	47	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(OC)c(OC)c1)C2	ZINC000819000944	FE	On-Demand	Anodyne	MT-ND1	19	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(OC)c(OC)c1)C2	ZINC000819000945	FE	On-Demand	Anodyne	MT-ND1	19	41
O=C(/C=C/[C@@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000950	FD	On-Demand	Reactive	HTR1A	38	46
O=C(/C=C/[C@@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000950	FD	On-Demand	Reactive	DRD2	22	43
O=C(/C=C/[C@@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000950	FD	On-Demand	Reactive	HTR2A	21	43
O=C(/C=C/[C@@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000950	FD	On-Demand	Reactive	DRD3	26	40
O=C(/C=C/[C@@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000950	FD	On-Demand	Reactive	HTR7	58	43
O=C(/C=C\[C@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000951	FD	On-Demand	Reactive	HTR1A	38	46
O=C(/C=C\[C@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000951	FD	On-Demand	Reactive	DRD2	22	43
O=C(/C=C\[C@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000951	FD	On-Demand	Reactive	HTR2A	21	43
O=C(/C=C\[C@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000951	FD	On-Demand	Reactive	DRD3	26	40
O=C(/C=C\[C@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000951	FD	On-Demand	Reactive	HTR7	58	43
O=C(/C=C/[C@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000952	FD	On-Demand	Reactive	HTR1A	38	46
O=C(/C=C/[C@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000952	FD	On-Demand	Reactive	DRD2	22	43
O=C(/C=C/[C@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000952	FD	On-Demand	Reactive	HTR2A	21	43
O=C(/C=C/[C@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000952	FD	On-Demand	Reactive	DRD3	26	40
O=C(/C=C/[C@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000952	FD	On-Demand	Reactive	HTR7	58	43
O=C(/C=C\[C@@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000953	FD	On-Demand	Reactive	HTR1A	38	46
O=C(/C=C\[C@@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000953	FD	On-Demand	Reactive	DRD2	22	43
O=C(/C=C\[C@@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000953	FD	On-Demand	Reactive	HTR2A	21	43
O=C(/C=C\[C@@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000953	FD	On-Demand	Reactive	DRD3	26	40
O=C(/C=C\[C@@H]1CCCO1)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819000953	FD	On-Demand	Reactive	HTR7	58	43
CO[C@@H](C)CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819000958	CF	On-Demand	Anodyne	ADRB1	20	44
CO[C@@H](C)CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819000959	CF	On-Demand	Anodyne	ADRB1	20	44
CO[C@@H](C)CCNC[C@@H](O)c1ccc(C)cc1	ZINC000819000960	BE	On-Demand	Anodyne	ADRB2	20	53
CO[C@@H](C)CCNC[C@H](O)c1ccc(C)cc1	ZINC000819000961	BE	On-Demand	Anodyne	ADRB2	20	53
O=C(/C=C\[C@@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000968	CF	On-Demand	Anodyne	CCKAR	31	43
O=C(/C=C\[C@@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000968	CF	On-Demand	Anodyne	BCHE	16	43
O=C(/C=C\[C@@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000968	CF	On-Demand	Anodyne	NMBR	53	41
O=C(/C=C\[C@@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000968	CF	On-Demand	Anodyne	MC5R	33	41
O=C(/C=C\[C@@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000968	CF	On-Demand	Anodyne	CCKBR	46	43
O=C(/C=C\[C@@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000968	CF	On-Demand	Anodyne	CCR2	15	42
O=C(/C=C/[C@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000969	CF	On-Demand	Anodyne	CCKAR	31	43
O=C(/C=C/[C@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000969	CF	On-Demand	Anodyne	BCHE	16	43
O=C(/C=C/[C@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000969	CF	On-Demand	Anodyne	NMBR	53	41
O=C(/C=C/[C@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000969	CF	On-Demand	Anodyne	MC5R	33	41
O=C(/C=C/[C@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000969	CF	On-Demand	Anodyne	CCKBR	46	43
O=C(/C=C/[C@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000969	CF	On-Demand	Anodyne	CCR2	15	42
O=C(/C=C/[C@@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000970	CF	On-Demand	Anodyne	CCKAR	31	43
O=C(/C=C/[C@@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000970	CF	On-Demand	Anodyne	BCHE	16	43
O=C(/C=C/[C@@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000970	CF	On-Demand	Anodyne	NMBR	53	41
O=C(/C=C/[C@@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000970	CF	On-Demand	Anodyne	MC5R	33	41
O=C(/C=C/[C@@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000970	CF	On-Demand	Anodyne	CCKBR	46	43
O=C(/C=C/[C@@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000970	CF	On-Demand	Anodyne	CCR2	15	42
O=C(/C=C\[C@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000971	CF	On-Demand	Anodyne	CCKAR	31	43
O=C(/C=C\[C@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000971	CF	On-Demand	Anodyne	BCHE	16	43
O=C(/C=C\[C@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000971	CF	On-Demand	Anodyne	NMBR	53	41
O=C(/C=C\[C@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000971	CF	On-Demand	Anodyne	MC5R	33	41
O=C(/C=C\[C@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000971	CF	On-Demand	Anodyne	CCKBR	46	43
O=C(/C=C\[C@H]1CCCO1)NCCc1c[nH]c2ccccc12	ZINC000819000971	CF	On-Demand	Anodyne	CCR2	15	42
O=C(CCNC[C@H](O)c1ccccc1)N1CCN(c2ncccn2)CC1	ZINC000819000972	FC	On-Demand	Anodyne	ADRB3	56	39
O=C(CCNC[C@H](O)c1ccccc1)N1CCN(c2ncccn2)CC1	ZINC000819000972	FC	On-Demand	Anodyne	PTAFR	31	42
O=C(CCNC[C@@H](O)c1ccccc1)N1CCN(c2ncccn2)CC1	ZINC000819000973	FC	On-Demand	Anodyne	ADRB3	56	39
O=C(CCNC[C@@H](O)c1ccccc1)N1CCN(c2ncccn2)CC1	ZINC000819000973	FC	On-Demand	Anodyne	PTAFR	31	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ncccn3)CC1)C2	ZINC000819000987	FC	On-Demand	Anodyne	SSTR1	30	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ncccn3)CC1)C2	ZINC000819000988	FC	On-Demand	Anodyne	SSTR1	30	43
COCCc1ccc(OC[C@@H](O)CNCc2ncc(Cl)n2C)cc1	ZINC000819001009	FD	On-Demand	Anodyne	ADRB2	42	56
COCCc1ccc(OC[C@@H](O)CNCc2ncc(Cl)n2C)cc1	ZINC000819001009	FD	On-Demand	Anodyne	ADRB1	69	56
COCCc1ccc(OC[C@@H](O)CNCc2ncc(Cl)n2C)cc1	ZINC000819001009	FD	On-Demand	Anodyne	GRIN1	26	42
COCCc1ccc(OC[C@@H](O)CNCc2ncc(Cl)n2C)cc1	ZINC000819001009	FD	On-Demand	Anodyne	ADRB3	48	46
COCCc1ccc(OC[C@H](O)CNCc2ncc(Cl)n2C)cc1	ZINC000819001010	FD	On-Demand	Anodyne	ADRB2	42	56
COCCc1ccc(OC[C@H](O)CNCc2ncc(Cl)n2C)cc1	ZINC000819001010	FD	On-Demand	Anodyne	ADRB1	69	56
COCCc1ccc(OC[C@H](O)CNCc2ncc(Cl)n2C)cc1	ZINC000819001010	FD	On-Demand	Anodyne	GRIN1	26	42
COCCc1ccc(OC[C@H](O)CNCc2ncc(Cl)n2C)cc1	ZINC000819001010	FD	On-Demand	Anodyne	ADRB3	48	46
O=C(CCNC[C@H](O)c1ccc(F)cc1)N1CCN(c2ncccn2)CC1	ZINC000819001034	FC	On-Demand	Anodyne	P2RX3	17	41
O=C(CCNC[C@@H](O)c1ccc(F)cc1)N1CCN(c2ncccn2)CC1	ZINC000819001035	FC	On-Demand	Anodyne	P2RX3	17	41
COc1ccccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819001102	FF	On-Demand	Mild	PAPA1_CARPA	62	56
COc1ccccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819001102	FF	On-Demand	Mild	CCKAR	53	40
COc1ccccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819001102	FF	On-Demand	Mild	CTSK	24	50
COc1ccccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819001102	FF	On-Demand	Mild	CTSL	26	56
COc1ccccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819001102	FF	On-Demand	Mild	CTSS	23	56
COc1ccccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819001102	FF	On-Demand	Mild	FPR1	46	40
COc1ccccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819001103	FF	On-Demand	Mild	PAPA1_CARPA	62	56
COc1ccccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819001103	FF	On-Demand	Mild	CCKAR	53	40
COc1ccccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819001103	FF	On-Demand	Mild	CTSK	24	50
COc1ccccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819001103	FF	On-Demand	Mild	CTSL	26	56
COc1ccccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819001103	FF	On-Demand	Mild	CTSS	23	56
COc1ccccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819001103	FF	On-Demand	Mild	FPR1	46	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccccc12	ZINC000819001109	EF	On-Demand	Anodyne	SSTR2	69	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccccc12	ZINC000819001109	EF	On-Demand	Anodyne	TACR1	19	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccccc12	ZINC000819001109	EF	On-Demand	Anodyne	NQO2	17	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccccc12	ZINC000819001109	EF	On-Demand	Anodyne	CCKAR	108	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccccc12	ZINC000819001109	EF	On-Demand	Anodyne	CTSL	18	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccccc12	ZINC000819001109	EF	On-Demand	Anodyne	BCHE	15	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccccc12	ZINC000819001109	EF	On-Demand	Anodyne	BRS3	25	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccccc12	ZINC000819001109	EF	On-Demand	Anodyne	NMBR	84	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccccc12	ZINC000819001109	EF	On-Demand	Anodyne	MTNR1A	20	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccccc12	ZINC000819001109	EF	On-Demand	Anodyne	GRPR	42	32
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccccc12	ZINC000819001109	EF	On-Demand	Anodyne	SSTR3	17	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccccc12	ZINC000819001109	EF	On-Demand	Anodyne	CCKBR	91	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccccc12	ZINC000819001109	EF	On-Demand	Anodyne	GHSR	48	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccccc12	ZINC000819001109	EF	On-Demand	Anodyne	MMP9	15	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccccc12	ZINC000819001109	EF	On-Demand	Anodyne	FPR1	15	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccccc13)C2	ZINC000819001128	FF	On-Demand	Anodyne	TACR1	30	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccccc13)C2	ZINC000819001128	FF	On-Demand	Anodyne	CCKAR	63	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccccc13)C2	ZINC000819001128	FF	On-Demand	Anodyne	NMBR	58	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccccc13)C2	ZINC000819001128	FF	On-Demand	Anodyne	MC5R	35	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccccc13)C2	ZINC000819001128	FF	On-Demand	Anodyne	MTNR1A	23	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccccc13)C2	ZINC000819001128	FF	On-Demand	Anodyne	GRPR	60	30
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccccc13)C2	ZINC000819001128	FF	On-Demand	Anodyne	CCKBR	76	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccccc13)C2	ZINC000819001128	FF	On-Demand	Anodyne	GHSR	52	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccccc13)C2	ZINC000819001129	FF	On-Demand	Anodyne	TACR1	30	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccccc13)C2	ZINC000819001129	FF	On-Demand	Anodyne	CCKAR	63	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccccc13)C2	ZINC000819001129	FF	On-Demand	Anodyne	NMBR	58	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccccc13)C2	ZINC000819001129	FF	On-Demand	Anodyne	MC5R	35	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccccc13)C2	ZINC000819001129	FF	On-Demand	Anodyne	MTNR1A	23	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccccc13)C2	ZINC000819001129	FF	On-Demand	Anodyne	GRPR	60	30
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccccc13)C2	ZINC000819001129	FF	On-Demand	Anodyne	CCKBR	76	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccccc13)C2	ZINC000819001129	FF	On-Demand	Anodyne	GHSR	52	36
O=C(NCCCNC[C@H](O)c1ccccc1)c1ccc(Br)cc1	ZINC000819001134	GF	On-Demand	Anodyne	ADRB3	47	44
O=C(NCCCNC[C@@H](O)c1ccccc1)c1ccc(Br)cc1	ZINC000819001135	GF	On-Demand	Anodyne	ADRB3	47	44
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H](c2ccccc2)[C@@H]2CCCO2)cc1	ZINC000819001151	GF	On-Demand	Anodyne	ADRB3	23	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H](c2ccccc2)[C@H]2CCCO2)cc1	ZINC000819001152	GF	On-Demand	Anodyne	ADRB3	23	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@H](c2ccccc2)[C@@H]2CCCO2)cc1	ZINC000819001153	GF	On-Demand	Anodyne	ADRB3	23	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@H](c2ccccc2)[C@H]2CCCO2)cc1	ZINC000819001154	GF	On-Demand	Anodyne	ADRB3	23	41
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)c(OC)c1	ZINC000819001157	CE	On-Demand	Anodyne	CYP1B1	17	49
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)c(OC)c1	ZINC000819001158	CE	On-Demand	Anodyne	CYP1B1	17	49
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)c(OC)c1	ZINC000819001159	CE	On-Demand	Anodyne	CYP1B1	17	49
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)c(OC)c1	ZINC000819001160	CE	On-Demand	Anodyne	CYP1B1	17	49
O=C(NCCCNC[C@H](O)c1cccnc1)c1ccc(Br)cc1	ZINC000819001171	GE	On-Demand	Anodyne	ADRB2	25	57
O=C(NCCCNC[C@H](O)c1cccnc1)c1ccc(Br)cc1	ZINC000819001171	GE	On-Demand	Anodyne	ADRB1	32	43
O=C(NCCCNC[C@H](O)c1cccnc1)c1ccc(Br)cc1	ZINC000819001171	GE	On-Demand	Anodyne	ADRB3	105	57
O=C(NCCCNC[C@H](O)c1cccnc1)c1ccc(Br)cc1	ZINC000819001171	GE	On-Demand	Anodyne	KCNA5	17	41
O=C(NCCCNC[C@@H](O)c1cccnc1)c1ccc(Br)cc1	ZINC000819001172	GE	On-Demand	Anodyne	ADRB2	25	57
O=C(NCCCNC[C@@H](O)c1cccnc1)c1ccc(Br)cc1	ZINC000819001172	GE	On-Demand	Anodyne	ADRB1	32	43
O=C(NCCCNC[C@@H](O)c1cccnc1)c1ccc(Br)cc1	ZINC000819001172	GE	On-Demand	Anodyne	ADRB3	105	57
O=C(NCCCNC[C@@H](O)c1cccnc1)c1ccc(Br)cc1	ZINC000819001172	GE	On-Demand	Anodyne	KCNA5	17	41
O=C(NCCCNC[C@H](O)c1ccc(F)cc1)c1ccc(Br)cc1	ZINC000819001173	GG	On-Demand	Anodyne	FOLH1	19	43
O=C(NCCCNC[C@@H](O)c1ccc(F)cc1)c1ccc(Br)cc1	ZINC000819001174	GG	On-Demand	Anodyne	FOLH1	19	43
O=C(/C=C\[C@H]1CCCO1)NCCc1ccc(Cl)cc1Cl	ZINC000819001183	DG	On-Demand	Anodyne	MC5R	20	42
O=C(/C=C/[C@@H]1CCCO1)NCCc1ccc(Cl)cc1Cl	ZINC000819001184	DG	On-Demand	Anodyne	MC5R	20	42
O=C(/C=C\[C@@H]1CCCO1)NCCc1ccc(Cl)cc1Cl	ZINC000819001185	DG	On-Demand	Anodyne	MC5R	20	42
O=C(/C=C/[C@H]1CCCO1)NCCc1ccc(Cl)cc1Cl	ZINC000819001186	DG	On-Demand	Anodyne	MC5R	20	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ccccn3)CC1)C2	ZINC000819001187	FD	On-Demand	Anodyne	SSTR1	47	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ccccn3)CC1)C2	ZINC000819001187	FD	On-Demand	Anodyne	NPBWR1	64	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ccccn3)CC1)C2	ZINC000819001188	FD	On-Demand	Anodyne	SSTR1	47	49
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ccccn3)CC1)C2	ZINC000819001188	FD	On-Demand	Anodyne	NPBWR1	64	34
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(Cl)cc1Cl	ZINC000819001197	DG	On-Demand	Anodyne	P2RX7	45	44
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(Cl)cc1Cl	ZINC000819001197	DG	On-Demand	Anodyne	EPHX2	19	47
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(Cl)cc1Cl	ZINC000819001198	DG	On-Demand	Anodyne	P2RX7	45	44
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(Cl)cc1Cl	ZINC000819001198	DG	On-Demand	Anodyne	EPHX2	19	47
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(Cl)cc1Cl	ZINC000819001199	DG	On-Demand	Anodyne	P2RX7	45	44
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(Cl)cc1Cl	ZINC000819001199	DG	On-Demand	Anodyne	EPHX2	19	47
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(Cl)cc1Cl	ZINC000819001200	DG	On-Demand	Anodyne	P2RX7	45	44
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(Cl)cc1Cl	ZINC000819001200	DG	On-Demand	Anodyne	EPHX2	19	47
O=C(CCNC[C@H](O)c1ccc(Cl)cc1)N1CCN(c2ncccn2)CC1	ZINC000819001211	GD	On-Demand	Anodyne	MC4R	22	40
O=C(CCNC[C@H](O)c1ccc(Cl)cc1)N1CCN(c2ncccn2)CC1	ZINC000819001211	GD	On-Demand	Anodyne	AKT3	61	39
COc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(OC)c1	ZINC000819001238	GG	On-Demand	Mild	PAPA1_CARPA	45	46
O=C(CCc1cccc(OC(F)F)c1)NNC(=O)C1CC1	ZINC000819001262	CD	On-Demand	Reactive	MTNR1A	15	40
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819001267	GF	On-Demand	Anodyne	ADRB2	28	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819001267	GF	On-Demand	Anodyne	ADRB1	31	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819001267	GF	On-Demand	Anodyne	ADRB3	29	40
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819001268	GF	On-Demand	Anodyne	ADRB2	28	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819001268	GF	On-Demand	Anodyne	ADRB1	31	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819001268	GF	On-Demand	Anodyne	ADRB3	29	40
COC(=O)N1CCC[C@H](NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819001269	GF	On-Demand	Anodyne	ADRB2	28	41
COC(=O)N1CCC[C@H](NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819001269	GF	On-Demand	Anodyne	ADRB1	31	41
COC(=O)N1CCC[C@H](NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819001269	GF	On-Demand	Anodyne	ADRB3	29	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819001270	GF	On-Demand	Anodyne	ADRB2	28	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819001270	GF	On-Demand	Anodyne	ADRB1	31	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819001270	GF	On-Demand	Anodyne	ADRB3	29	40
COC(=O)N1CCC[C@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819001272	FD	On-Demand	Mild	ITGA4	49	33
COC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819001273	FD	On-Demand	Mild	ITGA4	49	33
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccccc1C(F)(F)F	ZINC000819001280	GI	On-Demand	Anodyne	PDS	83	39
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccccc1C(F)(F)F	ZINC000819001281	GI	On-Demand	Anodyne	PDS	83	39
COC(=O)N1CCC[C@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819001282	GF	On-Demand	Anodyne	ADRB2	23	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819001282	GF	On-Demand	Anodyne	ADRB1	23	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819001282	GF	On-Demand	Anodyne	SLC6A3	35	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819001282	GF	On-Demand	Anodyne	ABCB1	15	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819001283	GF	On-Demand	Anodyne	ADRB2	23	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819001283	GF	On-Demand	Anodyne	ADRB1	23	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819001283	GF	On-Demand	Anodyne	SLC6A3	35	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819001283	GF	On-Demand	Anodyne	ABCB1	15	40
COC(=O)N1CCC[C@@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819001284	GF	On-Demand	Anodyne	ADRB2	23	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819001284	GF	On-Demand	Anodyne	ADRB1	23	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819001284	GF	On-Demand	Anodyne	SLC6A3	35	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819001284	GF	On-Demand	Anodyne	ABCB1	15	40
COC(=O)N1CCC[C@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819001285	GF	On-Demand	Anodyne	ADRB2	23	41
COC(=O)N1CCC[C@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819001285	GF	On-Demand	Anodyne	ADRB1	23	41
COC(=O)N1CCC[C@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819001285	GF	On-Demand	Anodyne	SLC6A3	35	41
COC(=O)N1CCC[C@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819001285	GF	On-Demand	Anodyne	ABCB1	15	40
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819001294	FD	On-Demand	Anodyne	ADRB2	48	56
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819001294	FD	On-Demand	Anodyne	ADRB1	81	56
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819001294	FD	On-Demand	Anodyne	ADRB3	59	46
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819001294	FD	On-Demand	Anodyne	ACOX1	42	35
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819001295	FD	On-Demand	Anodyne	ADRB2	48	56
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819001295	FD	On-Demand	Anodyne	ADRB1	81	56
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819001295	FD	On-Demand	Anodyne	ADRB3	59	46
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819001295	FD	On-Demand	Anodyne	ACOX1	42	35
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819001296	FD	On-Demand	Anodyne	ADRB2	48	56
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819001296	FD	On-Demand	Anodyne	ADRB1	81	56
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819001296	FD	On-Demand	Anodyne	ADRB3	59	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819001296	FD	On-Demand	Anodyne	ACOX1	42	35
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819001297	FD	On-Demand	Anodyne	ADRB2	48	56
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819001297	FD	On-Demand	Anodyne	ADRB1	81	56
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819001297	FD	On-Demand	Anodyne	ADRB3	59	46
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819001297	FD	On-Demand	Anodyne	ACOX1	42	35
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001306	ED	On-Demand	Anodyne	ADRB2	35	70
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001306	ED	On-Demand	Anodyne	ADRB1	35	70
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001306	ED	On-Demand	Anodyne	HTR1A	17	70
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001306	ED	On-Demand	Anodyne	SLC6A4	20	43
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001306	ED	On-Demand	Anodyne	ADRB3	29	57
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001306	ED	On-Demand	Anodyne	ABCB1	16	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001307	ED	On-Demand	Anodyne	ADRB2	35	70
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001307	ED	On-Demand	Anodyne	ADRB1	35	70
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001307	ED	On-Demand	Anodyne	HTR1A	17	70
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001307	ED	On-Demand	Anodyne	SLC6A4	20	43
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001307	ED	On-Demand	Anodyne	ADRB3	29	57
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001307	ED	On-Demand	Anodyne	ABCB1	16	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001308	ED	On-Demand	Anodyne	ADRB2	35	70
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001308	ED	On-Demand	Anodyne	ADRB1	35	70
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001308	ED	On-Demand	Anodyne	HTR1A	17	70
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001308	ED	On-Demand	Anodyne	SLC6A4	20	43
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001308	ED	On-Demand	Anodyne	ADRB3	29	57
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001308	ED	On-Demand	Anodyne	ABCB1	16	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001309	ED	On-Demand	Anodyne	ADRB2	35	70
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001309	ED	On-Demand	Anodyne	ADRB1	35	70
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001309	ED	On-Demand	Anodyne	HTR1A	17	70
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001309	ED	On-Demand	Anodyne	SLC6A4	20	43
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001309	ED	On-Demand	Anodyne	ADRB3	29	57
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819001309	ED	On-Demand	Anodyne	ABCB1	16	42
COC(=O)N1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819001310	DE	On-Demand	Anodyne	ADRB2	25	44
COC(=O)N1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819001310	DE	On-Demand	Anodyne	ADRB1	49	51
COC(=O)N1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819001310	DE	On-Demand	Anodyne	SLC6A3	15	48
COC(=O)N1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819001310	DE	On-Demand	Anodyne	ADRB3	73	52
COC(=O)N1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819001310	DE	On-Demand	Anodyne	IGF1R	30	42
COC(=O)N1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819001310	DE	On-Demand	Anodyne	CYP3A4	54	42
COC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819001311	DE	On-Demand	Anodyne	ADRB2	25	44
COC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819001311	DE	On-Demand	Anodyne	ADRB1	49	51
COC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819001311	DE	On-Demand	Anodyne	SLC6A3	15	48
COC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819001311	DE	On-Demand	Anodyne	ADRB3	73	52
COC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819001311	DE	On-Demand	Anodyne	IGF1R	30	42
COC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819001311	DE	On-Demand	Anodyne	CYP3A4	54	42
COC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819001312	DE	On-Demand	Anodyne	ADRB2	25	44
COC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819001312	DE	On-Demand	Anodyne	ADRB1	49	51
COC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819001312	DE	On-Demand	Anodyne	SLC6A3	15	48
COC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819001312	DE	On-Demand	Anodyne	ADRB3	73	52
COC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819001312	DE	On-Demand	Anodyne	IGF1R	30	42
COC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819001312	DE	On-Demand	Anodyne	CYP3A4	54	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819001313	DE	On-Demand	Anodyne	ADRB2	25	44
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819001313	DE	On-Demand	Anodyne	ADRB1	49	51
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819001313	DE	On-Demand	Anodyne	SLC6A3	15	48
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819001313	DE	On-Demand	Anodyne	ADRB3	73	52
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819001313	DE	On-Demand	Anodyne	IGF1R	30	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819001313	DE	On-Demand	Anodyne	CYP3A4	54	42
CC(=O)Nc1cccc(CC(=O)NNC(=O)C2CC2)c1	ZINC000819001314	CC	On-Demand	Reactive	SIGMAR1	17	42
CC(=O)Nc1cccc(CC(=O)NNC(=O)C2CC2)c1	ZINC000819001314	CC	On-Demand	Reactive	MTNR1A	20	40
CC(=O)Nc1cccc(CC(=O)NNC(=O)C2CC2)c1	ZINC000819001314	CC	On-Demand	Reactive	MTNR1B	17	40
CC(=O)Nc1cccc(CC(=O)NNC(=O)C2CC2)c1	ZINC000819001314	CC	On-Demand	Reactive	TYK2	49	38
CS(=O)(=O)c1ccc([C@@H](O)CNCc2cccc(OCC(F)F)c2)cc1	ZINC000819001315	GF	On-Demand	Anodyne	ADRB3	52	38
CS(=O)(=O)c1ccc([C@@H](O)CNCc2cccc(OCC(F)F)c2)cc1	ZINC000819001315	GF	On-Demand	Anodyne	PDS	76	37
CS(=O)(=O)c1ccc([C@H](O)CNCc2cccc(OCC(F)F)c2)cc1	ZINC000819001316	GF	On-Demand	Anodyne	ADRB3	52	38
CS(=O)(=O)c1ccc([C@H](O)CNCc2cccc(OCC(F)F)c2)cc1	ZINC000819001316	GF	On-Demand	Anodyne	PDS	76	37
O=C(/C=C/[C@H]1CCCO1)N1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000819001341	FG	On-Demand	Anodyne	ITGAL	75	37
O=C(/C=C/[C@H]1CCCO1)N1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000819001341	FG	On-Demand	Anodyne	SERPINE1	24	41
O=C(/C=C/[C@H]1CCCO1)N1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000819001341	FG	On-Demand	Anodyne	CCR2	29	46
O=C(/C=C/[C@@H]1CCCO1)N1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000819001342	FG	On-Demand	Anodyne	ITGAL	75	37
O=C(/C=C/[C@@H]1CCCO1)N1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000819001342	FG	On-Demand	Anodyne	SERPINE1	24	41
O=C(/C=C/[C@@H]1CCCO1)N1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000819001342	FG	On-Demand	Anodyne	CCR2	29	46
O=C(/C=C\[C@H]1CCCO1)N1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000819001343	FG	On-Demand	Anodyne	ITGAL	75	37
O=C(/C=C\[C@H]1CCCO1)N1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000819001343	FG	On-Demand	Anodyne	SERPINE1	24	41
O=C(/C=C\[C@H]1CCCO1)N1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000819001343	FG	On-Demand	Anodyne	CCR2	29	46
CO[C@@H](C)CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819001401	CD	On-Demand	Bother	CACNA1C	48	38
CO[C@@H](C)CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819001401	CD	On-Demand	Bother	ADRB3	52	37
CO[C@@H](C)CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819001401	CD	On-Demand	Bother	CACNA1D	74	38
CO[C@@H](C)CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819001402	CD	On-Demand	Bother	CACNA1C	48	38
CO[C@@H](C)CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819001402	CD	On-Demand	Bother	ADRB3	52	37
CO[C@@H](C)CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819001402	CD	On-Demand	Bother	CACNA1D	74	38
COc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1Cl	ZINC000819001423	GH	On-Demand	Mild	PAPA1_CARPA	44	45
O=C(N[C@H]1CCCc2ccccc21)C(F)=C1CCC1	ZINC000819001443	CH	On-Demand	Anodyne	KCNN3	15	40
O=C(N[C@H]1CCCc2ccccc21)C(F)=C1CCC1	ZINC000819001443	CH	On-Demand	Anodyne	XIAP	22	41
O=C(N[C@H]1CCCc2ccccc21)C(F)=C1CCC1	ZINC000819001443	CH	On-Demand	Anodyne	BIRC3	28	42
O=C(N[C@H]1CCCc2ccccc21)C(F)=C1CCC1	ZINC000819001443	CH	On-Demand	Anodyne	BIRC2	28	42
O=C(/C=C\[C@@H]1CCCO1)N1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000819001444	FG	On-Demand	Anodyne	ITGAL	75	37
O=C(/C=C\[C@@H]1CCCO1)N1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000819001444	FG	On-Demand	Anodyne	SERPINE1	24	41
O=C(/C=C\[C@@H]1CCCO1)N1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000819001444	FG	On-Demand	Anodyne	CCR2	29	46
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1cccc(Cl)c1	ZINC000819001445	EH	On-Demand	Anodyne	ADRB2	31	42
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1cccc(Cl)c1	ZINC000819001445	EH	On-Demand	Anodyne	ADRB1	48	50
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1cccc(Cl)c1	ZINC000819001445	EH	On-Demand	Anodyne	ADRB3	53	50
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1cccc(Cl)c1	ZINC000819001445	EH	On-Demand	Anodyne	PDS	83	43
O[C@H](CNCc1cccc(OCC(F)F)c1)c1cccc(Cl)c1	ZINC000819001446	EH	On-Demand	Anodyne	ADRB2	31	42
O[C@H](CNCc1cccc(OCC(F)F)c1)c1cccc(Cl)c1	ZINC000819001446	EH	On-Demand	Anodyne	ADRB1	48	50
O[C@H](CNCc1cccc(OCC(F)F)c1)c1cccc(Cl)c1	ZINC000819001446	EH	On-Demand	Anodyne	ADRB3	53	50
O[C@H](CNCc1cccc(OCC(F)F)c1)c1cccc(Cl)c1	ZINC000819001446	EH	On-Demand	Anodyne	PDS	83	43
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)c(F)c1	ZINC000819001451	EG	On-Demand	Anodyne	ADRB1	19	41
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)c(F)c1	ZINC000819001451	EG	On-Demand	Anodyne	ADRB3	19	41
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)c(F)c1	ZINC000819001451	EG	On-Demand	Anodyne	PDS	76	40
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)c(F)c1	ZINC000819001452	EG	On-Demand	Anodyne	ADRB1	19	41
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)c(F)c1	ZINC000819001452	EG	On-Demand	Anodyne	ADRB3	19	41
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)c(F)c1	ZINC000819001452	EG	On-Demand	Anodyne	PDS	76	40
COC(=O)N1CCC[C@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819001468	FF	On-Demand	Anodyne	CACNA1B	40	32
COC(=O)N1CCC[C@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819001468	FF	On-Demand	Anodyne	CCR3	18	41
COC(=O)N1CCC[C@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819001468	FF	On-Demand	Anodyne	CCR2	79	45
COC(=O)N1CCC[C@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819001468	FF	On-Demand	Anodyne	EPHX2	31	48
COC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819001469	FF	On-Demand	Anodyne	CACNA1B	40	32
COC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819001469	FF	On-Demand	Anodyne	CCR3	18	41
COC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819001469	FF	On-Demand	Anodyne	CCR2	79	45
COC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819001469	FF	On-Demand	Anodyne	EPHX2	31	48
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(Cl)cc3)CC2)cc1	ZINC000819001479	GG	On-Demand	Clean	ADRB2	41	52
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(Cl)cc3)CC2)cc1	ZINC000819001479	GG	On-Demand	Clean	ADRB1	53	47
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(Cl)cc3)CC2)cc1	ZINC000819001479	GG	On-Demand	Clean	ADRB3	49	57
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(Cl)cc3)CC2)cc1	ZINC000819001479	GG	On-Demand	Clean	EBP	18	42
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(Cl)cc3)CC2)cc1	ZINC000819001481	GG	On-Demand	Clean	ADRB2	41	52
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(Cl)cc3)CC2)cc1	ZINC000819001481	GG	On-Demand	Clean	ADRB1	53	47
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(Cl)cc3)CC2)cc1	ZINC000819001481	GG	On-Demand	Clean	ADRB3	49	57
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(Cl)cc3)CC2)cc1	ZINC000819001481	GG	On-Demand	Clean	EBP	18	42
COc1ccc(N2CCC(NC[C@H](O)COCc3ccccc3F)CC2)cc1	ZINC000819001487	GF	On-Demand	Clean	ADRB2	22	44
COc1ccc(N2CCC(NC[C@H](O)COCc3ccccc3F)CC2)cc1	ZINC000819001487	GF	On-Demand	Clean	ADRB1	19	41
COc1ccc(N2CCC(NC[C@H](O)COCc3ccccc3F)CC2)cc1	ZINC000819001487	GF	On-Demand	Clean	ADRB3	27	46
COc1ccc(N2CCC(NC[C@@H](O)COCc3ccccc3F)CC2)cc1	ZINC000819001488	GF	On-Demand	Clean	ADRB2	22	44
COc1ccc(N2CCC(NC[C@@H](O)COCc3ccccc3F)CC2)cc1	ZINC000819001488	GF	On-Demand	Clean	ADRB1	19	41
COc1ccc(N2CCC(NC[C@@H](O)COCc3ccccc3F)CC2)cc1	ZINC000819001488	GF	On-Demand	Clean	ADRB3	27	46
NC(=O)c1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819001490	CD	On-Demand	Anodyne	ADRB2	75	69
NC(=O)c1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819001490	CD	On-Demand	Anodyne	ADRB1	89	65
NC(=O)c1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819001490	CD	On-Demand	Anodyne	ADRB3	179	69
NC(=O)c1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819001490	CD	On-Demand	Anodyne	KCNA5	17	40
NC(=O)c1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819001491	CD	On-Demand	Anodyne	ADRB2	75	69
NC(=O)c1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819001491	CD	On-Demand	Anodyne	ADRB1	89	65
NC(=O)c1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819001491	CD	On-Demand	Anodyne	ADRB3	179	69
NC(=O)c1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819001491	CD	On-Demand	Anodyne	KCNA5	17	40
COc1ccc(N2CCC(NC[C@@H](O)[C@@H](C)c3ccccc3)CC2)cc1	ZINC000819001492	FG	On-Demand	Clean	ADRB2	20	43
COc1ccc(N2CCC(NC[C@@H](O)[C@@H](C)c3ccccc3)CC2)cc1	ZINC000819001492	FG	On-Demand	Clean	ADRB3	30	43
COc1ccc(N2CCC(NC[C@H](O)[C@@H](C)c3ccccc3)CC2)cc1	ZINC000819001497	FG	On-Demand	Clean	ADRB2	20	43
COc1ccc(N2CCC(NC[C@H](O)[C@@H](C)c3ccccc3)CC2)cc1	ZINC000819001497	FG	On-Demand	Clean	ADRB3	30	43
COc1ccc(N2CCC(NC[C@@H](O)[C@H](C)c3ccccc3)CC2)cc1	ZINC000819001498	FG	On-Demand	Clean	ADRB2	20	43
COc1ccc(N2CCC(NC[C@@H](O)[C@H](C)c3ccccc3)CC2)cc1	ZINC000819001498	FG	On-Demand	Clean	ADRB3	30	43
COc1ccc(N2CCC(NC[C@H](O)[C@H](C)c3ccccc3)CC2)cc1	ZINC000819001499	FG	On-Demand	Clean	ADRB2	20	43
COc1ccc(N2CCC(NC[C@H](O)[C@H](C)c3ccccc3)CC2)cc1	ZINC000819001499	FG	On-Demand	Clean	ADRB3	30	43
O=C(CNC[C@H](O)c1cccc2ccccc12)N1CCc2ccccc2C1	ZINC000819001501	FG	On-Demand	Anodyne	DPP8	25	46
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819001507	FC	On-Demand	Anodyne	ADRB3	33	45
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819001507	FC	On-Demand	Anodyne	GPR119	54	39
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819001508	FC	On-Demand	Anodyne	ADRB3	33	45
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819001508	FC	On-Demand	Anodyne	GPR119	54	39
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819001509	FC	On-Demand	Anodyne	ADRB3	33	45
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819001509	FC	On-Demand	Anodyne	GPR119	54	39
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819001510	FC	On-Demand	Anodyne	ADRB3	33	45
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819001510	FC	On-Demand	Anodyne	GPR119	54	39
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819001513	FE	On-Demand	Anodyne	CCR2	50	35
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819001513	FE	On-Demand	Anodyne	MCHR1	25	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819001513	FE	On-Demand	Anodyne	BIRC2	19	41
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819001514	FE	On-Demand	Anodyne	CCR2	50	35
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819001514	FE	On-Demand	Anodyne	MCHR1	25	42
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819001514	FE	On-Demand	Anodyne	BIRC2	19	41
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819001515	FE	On-Demand	Anodyne	CCR2	50	35
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819001515	FE	On-Demand	Anodyne	MCHR1	25	42
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819001515	FE	On-Demand	Anodyne	BIRC2	19	41
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819001516	FE	On-Demand	Anodyne	CCR2	50	35
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819001516	FE	On-Demand	Anodyne	MCHR1	25	42
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819001516	FE	On-Demand	Anodyne	BIRC2	19	41
C=C(C)C(C)(C)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1	ZINC000819001517	EE	On-Demand	Reactive	TUBB1	44	36
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819001518	GF	On-Demand	Anodyne	ADRB2	20	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819001518	GF	On-Demand	Anodyne	ADRB1	27	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819001518	GF	On-Demand	Anodyne	CCR1	44	37
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819001519	GF	On-Demand	Anodyne	ADRB2	20	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819001519	GF	On-Demand	Anodyne	ADRB1	27	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819001519	GF	On-Demand	Anodyne	CCR1	44	37
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819001520	GF	On-Demand	Anodyne	ADRB2	20	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819001520	GF	On-Demand	Anodyne	ADRB1	27	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819001520	GF	On-Demand	Anodyne	CCR1	44	37
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819001521	GF	On-Demand	Anodyne	ADRB2	20	41
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819001521	GF	On-Demand	Anodyne	ADRB1	27	41
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819001521	GF	On-Demand	Anodyne	CCR1	44	37
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccccc1Cl	ZINC000819001522	EH	On-Demand	Anodyne	ADRB2	22	40
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccccc1Cl	ZINC000819001522	EH	On-Demand	Anodyne	ADRB1	25	40
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccccc1Cl	ZINC000819001522	EH	On-Demand	Anodyne	PDS	92	43
Cc1c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cccc1[N+](=O)[O-]	ZINC000819001523	GG	On-Demand	Mild	PAPA1_CARPA	42	42
Cc1c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cccc1[N+](=O)[O-]	ZINC000819001523	GG	On-Demand	Mild	CCKAR	19	41
Cc1c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cccc1[N+](=O)[O-]	ZINC000819001524	GG	On-Demand	Mild	PAPA1_CARPA	42	42
Cc1c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cccc1[N+](=O)[O-]	ZINC000819001524	GG	On-Demand	Mild	CCKAR	19	41
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819001532	FE	On-Demand	Anodyne	EPHX2	43	40
O=C(N[C@@H]1CCCc2ccccc21)C(F)=C1CCC1	ZINC000819001533	CH	On-Demand	Anodyne	KCNN3	15	40
O=C(N[C@@H]1CCCc2ccccc21)C(F)=C1CCC1	ZINC000819001533	CH	On-Demand	Anodyne	XIAP	22	41
O=C(N[C@@H]1CCCc2ccccc21)C(F)=C1CCC1	ZINC000819001533	CH	On-Demand	Anodyne	BIRC3	28	42
O=C(N[C@@H]1CCCc2ccccc21)C(F)=C1CCC1	ZINC000819001533	CH	On-Demand	Anodyne	BIRC2	28	42
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccccc1	ZINC000819001534	DG	On-Demand	Anodyne	ADRB2	36	41
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccccc1	ZINC000819001534	DG	On-Demand	Anodyne	ADRB1	57	39
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccccc1	ZINC000819001534	DG	On-Demand	Anodyne	ADRB3	53	40
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccccc1	ZINC000819001534	DG	On-Demand	Anodyne	PDS	88	42
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccccc1	ZINC000819001535	DG	On-Demand	Anodyne	ADRB2	36	41
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccccc1	ZINC000819001535	DG	On-Demand	Anodyne	ADRB1	57	39
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccccc1	ZINC000819001535	DG	On-Demand	Anodyne	ADRB3	53	40
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccccc1	ZINC000819001535	DG	On-Demand	Anodyne	PDS	88	42
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819001554	FE	On-Demand	Anodyne	EPHX2	43	40
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819001556	FE	On-Demand	Anodyne	EPHX2	43	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819001557	FE	On-Demand	Anodyne	EPHX2	43	40
O=[N+]([O-])c1ccc([C@@H](O)CNCc2cccc(OCC(F)F)c2)cc1	ZINC000819001563	FG	On-Demand	Bother	PDS	54	43
O=[N+]([O-])c1ccc([C@H](O)CNCc2cccc(OCC(F)F)c2)cc1	ZINC000819001564	FG	On-Demand	Bother	PDS	54	43
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1c(F)cccc1F	ZINC000819001567	EG	On-Demand	Anodyne	PDS	64	39
O[C@H](CNCc1cccc(OCC(F)F)c1)c1c(F)cccc1F	ZINC000819001568	EG	On-Demand	Anodyne	PDS	64	39
C=C(Cl)CSc1nc(C)c(CC(=O)Nc2cc(OC)ccc2OC)s1	ZINC000819001584	GI	On-Demand	Mild	ENPP1	54	30
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc(C(N)=O)c1	ZINC000819001605	DE	On-Demand	Anodyne	ADRB2	66	47
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc(C(N)=O)c1	ZINC000819001605	DE	On-Demand	Anodyne	ADRB1	55	41
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc(C(N)=O)c1	ZINC000819001605	DE	On-Demand	Anodyne	ADRB3	48	41
NC(=O)c1cccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819001610	FF	On-Demand	Anodyne	ADRB2	62	42
NC(=O)c1cccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819001610	FF	On-Demand	Anodyne	ADRB1	65	48
NC(=O)c1cccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819001610	FF	On-Demand	Anodyne	ADRB3	96	51
NC(=O)c1cccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819001612	FF	On-Demand	Anodyne	ADRB2	62	42
NC(=O)c1cccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819001612	FF	On-Demand	Anodyne	ADRB1	65	48
NC(=O)c1cccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819001612	FF	On-Demand	Anodyne	ADRB3	96	51
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)CN1CCOCC1	ZINC000819001624	GD	On-Demand	Clean	ADRB3	21	42
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)CN1CCOCC1	ZINC000819001627	GD	On-Demand	Clean	ADRB3	21	42
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(Cl)cc1	ZINC000819001631	EH	On-Demand	Anodyne	ADRB1	33	42
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(Cl)cc1	ZINC000819001631	EH	On-Demand	Anodyne	ADRB3	27	42
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(Cl)cc1	ZINC000819001631	EH	On-Demand	Anodyne	PDS	81	39
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)cc1F	ZINC000819001636	EG	On-Demand	Anodyne	ADRB2	18	43
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)cc1F	ZINC000819001636	EG	On-Demand	Anodyne	ADRB1	19	43
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)cc1F	ZINC000819001636	EG	On-Demand	Anodyne	PDS	64	40
O=C(CNC[C@@H](O)c1cccc(F)c1)N1CCc2ccccc2C1	ZINC000819001651	EE	On-Demand	Anodyne	DPP8	26	45
C#CCNC(=O)CCNCCCNC(=O)c1ccc(Br)cc1	ZINC000819001652	FD	On-Demand	Mild	HDAC9	17	46
O=C(CNC[C@H](O)c1cccc(F)c1)N1CCc2ccccc2C1	ZINC000819001653	EE	On-Demand	Anodyne	DPP8	26	45
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)COc1ccccc1	ZINC000819001655	GG	On-Demand	Clean	ADRB2	41	54
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)COc1ccccc1	ZINC000819001655	GG	On-Demand	Clean	ADRB1	59	54
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)COc1ccccc1	ZINC000819001655	GG	On-Demand	Clean	ADRB3	53	63
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)COc1ccccc1	ZINC000819001655	GG	On-Demand	Clean	ABCB1	19	42
O=C(CCNC[C@H](O)c1cccnc1)N1CCN(c2ncccn2)CC1	ZINC000819001657	FC	On-Demand	Anodyne	ADRB2	26	45
O=C(CCNC[C@H](O)c1cccnc1)N1CCN(c2ncccn2)CC1	ZINC000819001657	FC	On-Demand	Anodyne	ADRB1	31	45
O=C(CCNC[C@H](O)c1cccnc1)N1CCN(c2ncccn2)CC1	ZINC000819001657	FC	On-Demand	Anodyne	ADRB3	103	48
O=C(CCNC[C@H](O)c1cccnc1)N1CCN(c2ncccn2)CC1	ZINC000819001657	FC	On-Demand	Anodyne	PTAFR	31	46
O=C(CCNC[C@H](O)c1cccnc1)N1CCN(c2ncccn2)CC1	ZINC000819001657	FC	On-Demand	Anodyne	C3AR1	40	38
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)COc1ccccc1	ZINC000819001658	GG	On-Demand	Clean	ADRB2	41	54
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)COc1ccccc1	ZINC000819001658	GG	On-Demand	Clean	ADRB1	59	54
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)COc1ccccc1	ZINC000819001658	GG	On-Demand	Clean	ADRB3	53	63
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)COc1ccccc1	ZINC000819001658	GG	On-Demand	Clean	ABCB1	19	42
O=C(CNC[C@@H](O)c1ccccc1F)N1CCc2ccccc2C1	ZINC000819001659	EE	On-Demand	Anodyne	DPP8	25	47
O=C(CNC[C@H](O)c1ccccc1F)N1CCc2ccccc2C1	ZINC000819001660	EE	On-Demand	Anodyne	DPP8	25	47
CC(C)(C)[C@@H](O)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000819001661	EG	On-Demand	Clean	ADRB3	18	40
O=C(CCNC[C@@H](O)c1cccnc1)N1CCN(c2ncccn2)CC1	ZINC000819001662	FC	On-Demand	Anodyne	ADRB2	26	45
O=C(CCNC[C@@H](O)c1cccnc1)N1CCN(c2ncccn2)CC1	ZINC000819001662	FC	On-Demand	Anodyne	ADRB1	31	45
O=C(CCNC[C@@H](O)c1cccnc1)N1CCN(c2ncccn2)CC1	ZINC000819001662	FC	On-Demand	Anodyne	ADRB3	103	48
O=C(CCNC[C@@H](O)c1cccnc1)N1CCN(c2ncccn2)CC1	ZINC000819001662	FC	On-Demand	Anodyne	PTAFR	31	46
O=C(CCNC[C@@H](O)c1cccnc1)N1CCN(c2ncccn2)CC1	ZINC000819001662	FC	On-Demand	Anodyne	C3AR1	40	38
O=C(NCCCNC[C@H](O)c1cccc(F)c1)c1ccc(Br)cc1	ZINC000819001669	GG	On-Demand	Anodyne	ADRB1	26	41
O=C(NCCCNC[C@H](O)c1cccc(F)c1)c1ccc(Br)cc1	ZINC000819001669	GG	On-Demand	Anodyne	ADRB3	32	41
O=C(NCCCNC[C@H](O)c1cccc(F)c1)c1ccc(Br)cc1	ZINC000819001669	GG	On-Demand	Anodyne	PLD2	15	40
O=C(NCCCNC[C@@H](O)c1cccc(F)c1)c1ccc(Br)cc1	ZINC000819001671	GG	On-Demand	Anodyne	ADRB1	26	41
O=C(NCCCNC[C@@H](O)c1cccc(F)c1)c1ccc(Br)cc1	ZINC000819001671	GG	On-Demand	Anodyne	ADRB3	32	41
O=C(NCCCNC[C@@H](O)c1cccc(F)c1)c1ccc(Br)cc1	ZINC000819001671	GG	On-Demand	Anodyne	PLD2	15	40
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccnc1	ZINC000819001677	FF	On-Demand	Clean	ADRB3	76	61
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccnc1	ZINC000819001679	FF	On-Demand	Clean	ADRB3	76	61
CO[C@@H](C)CCNC[C@H](O)c1ccc(F)cc1C	ZINC000819001681	CE	On-Demand	Anodyne	LEF	46	33
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(C#N)cc3)CC2)cc1	ZINC000819001682	GF	On-Demand	Mild	ADRB2	38	51
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(C#N)cc3)CC2)cc1	ZINC000819001682	GF	On-Demand	Mild	ADRB1	45	46
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(C#N)cc3)CC2)cc1	ZINC000819001682	GF	On-Demand	Mild	ADRB3	41	56
CO[C@@H](C)CCNC[C@@H](O)c1ccc(F)cc1C	ZINC000819001684	CE	On-Demand	Anodyne	LEF	46	33
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(C#N)cc3)CC2)cc1	ZINC000819001689	GF	On-Demand	Mild	ADRB2	38	51
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(C#N)cc3)CC2)cc1	ZINC000819001689	GF	On-Demand	Mild	ADRB1	45	46
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(C#N)cc3)CC2)cc1	ZINC000819001689	GF	On-Demand	Mild	ADRB3	41	56
O=C(CCNC[C@H](O)c1cccc(Cl)c1)N1CCN(c2ncccn2)CC1	ZINC000819001696	GD	On-Demand	Anodyne	ADRB1	38	47
O=C(CCNC[C@H](O)c1cccc(Cl)c1)N1CCN(c2ncccn2)CC1	ZINC000819001696	GD	On-Demand	Anodyne	ADRB3	60	47
O=C(CCNC[C@H](O)c1cccc(Cl)c1)N1CCN(c2ncccn2)CC1	ZINC000819001696	GD	On-Demand	Anodyne	IGF1R	27	41
O=C(CCNC[C@H](O)c1cccc(Cl)c1)N1CCN(c2ncccn2)CC1	ZINC000819001696	GD	On-Demand	Anodyne	CYP3A4	47	36
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cc(F)ccc1F	ZINC000819001697	GH	On-Demand	Clean	ADRB3	21	43
O=C(CCNC[C@@H](O)c1cccc(Cl)c1)N1CCN(c2ncccn2)CC1	ZINC000819001698	GD	On-Demand	Anodyne	ADRB1	38	47
O=C(CCNC[C@@H](O)c1cccc(Cl)c1)N1CCN(c2ncccn2)CC1	ZINC000819001698	GD	On-Demand	Anodyne	ADRB3	60	47
O=C(CCNC[C@@H](O)c1cccc(Cl)c1)N1CCN(c2ncccn2)CC1	ZINC000819001698	GD	On-Demand	Anodyne	IGF1R	27	41
O=C(CCNC[C@@H](O)c1cccc(Cl)c1)N1CCN(c2ncccn2)CC1	ZINC000819001698	GD	On-Demand	Anodyne	CYP3A4	47	36
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cc(F)ccc1F	ZINC000819001701	GH	On-Demand	Clean	ADRB3	21	43
COc1ccc(N2CCC(NCCC(=O)Nc3cc(F)cc(F)c3)CC2)cc1	ZINC000819001702	GH	On-Demand	Clean	MCHR1	31	42
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccccc1F	ZINC000819001712	CE	On-Demand	Reactive	ECR	23	44
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccccc1F	ZINC000819001712	CE	On-Demand	Reactive	E3UJZ5_SPOLI	15	44
COc1ccc(N2CCC(NC[C@H](O)COc3cc(C)cc(C)c3)CC2)cc1	ZINC000819001717	GG	On-Demand	Clean	ADRB2	41	50
COc1ccc(N2CCC(NC[C@H](O)COc3cc(C)cc(C)c3)CC2)cc1	ZINC000819001717	GG	On-Demand	Clean	ADRB1	44	47
COc1ccc(N2CCC(NC[C@H](O)COc3cc(C)cc(C)c3)CC2)cc1	ZINC000819001717	GG	On-Demand	Clean	ADRB3	42	55
COc1ccc(N2CCC(NC[C@@H](O)COc3cc(C)cc(C)c3)CC2)cc1	ZINC000819001718	GG	On-Demand	Clean	ADRB2	41	50
COc1ccc(N2CCC(NC[C@@H](O)COc3cc(C)cc(C)c3)CC2)cc1	ZINC000819001718	GG	On-Demand	Clean	ADRB1	44	47
COc1ccc(N2CCC(NC[C@@H](O)COc3cc(C)cc(C)c3)CC2)cc1	ZINC000819001718	GG	On-Demand	Clean	ADRB3	42	55
COc1ccc(N2CCC(NCCC(=O)Nc3ccc(N(C)C)cc3)CC2)cc1	ZINC000819001728	GG	On-Demand	Clean	MTNR1B	15	41
COc1ccc(N2CCC(NCCC(=O)Nc3ccc(N(C)C)cc3)CC2)cc1	ZINC000819001728	GG	On-Demand	Clean	MCHR1	21	49
COc1ccc(N2CCC(NC[C@H](O)COc3ccccc3C)CC2)cc1	ZINC000819001731	FG	On-Demand	Clean	ADRB2	53	54
COc1ccc(N2CCC(NC[C@H](O)COc3ccccc3C)CC2)cc1	ZINC000819001731	FG	On-Demand	Clean	ADRB1	49	54
COc1ccc(N2CCC(NC[C@H](O)COc3ccccc3C)CC2)cc1	ZINC000819001731	FG	On-Demand	Clean	ADRB3	44	51
COc1ccc(N2CCC(NC[C@H](O)COc3ccccc3C)CC2)cc1	ZINC000819001731	FG	On-Demand	Clean	ABCB1	59	43
COc1ccc(N2CCC(NC[C@@H](O)COc3ccccc3C)CC2)cc1	ZINC000819001732	FG	On-Demand	Clean	ADRB2	53	54
COc1ccc(N2CCC(NC[C@@H](O)COc3ccccc3C)CC2)cc1	ZINC000819001732	FG	On-Demand	Clean	ADRB1	49	54
COc1ccc(N2CCC(NC[C@@H](O)COc3ccccc3C)CC2)cc1	ZINC000819001732	FG	On-Demand	Clean	ADRB3	44	51
COc1ccc(N2CCC(NC[C@@H](O)COc3ccccc3C)CC2)cc1	ZINC000819001732	FG	On-Demand	Clean	ABCB1	59	43
COC[C@@H](O)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000819001735	ED	On-Demand	Clean	ADRB2	19	41
COC[C@@H](O)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000819001735	ED	On-Demand	Clean	ADRB1	22	41
COC[C@@H](O)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000819001735	ED	On-Demand	Clean	ADRB3	28	48
COc1ccc(N2CCC(NC[C@H](O)c3cccc4ccccc34)CC2)cc1	ZINC000819001742	GI	On-Demand	Clean	ADRB2	23	40
COc1ccc(N2CCC(NC[C@H](O)c3cccc4ccccc34)CC2)cc1	ZINC000819001742	GI	On-Demand	Clean	ADRB1	21	40
COc1ccc(N2CCC(NC[C@H](O)c3cccc4ccccc34)CC2)cc1	ZINC000819001742	GI	On-Demand	Clean	ADRB3	35	43
CC(C)(C)N1CC[C@H](OC(=O)c2cc(-c3ccccn3)nc3ccccc23)C1=O	ZINC000819001746	GH	On-Demand	Anodyne	METAP1	49	44
CC(C)(C)N1CC[C@H](OC(=O)c2cc(-c3ccccn3)nc3ccccc23)C1=O	ZINC000819001746	GH	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)N1CC[C@@H](OC(=O)c2cc(-c3ccccn3)nc3ccccc23)C1=O	ZINC000819001747	GH	On-Demand	Anodyne	METAP1	49	44
CC(C)(C)N1CC[C@@H](OC(=O)c2cc(-c3ccccn3)nc3ccccc23)C1=O	ZINC000819001747	GH	On-Demand	Anodyne	ACACB	15	41
O=C(CNC[C@@H](O)c1ccc(F)cc1Cl)N1CCc2ccccc2C1	ZINC000819001754	FF	On-Demand	Anodyne	DPP8	21	42
O=C(CNC[C@H](O)c1ccc(F)cc1Cl)N1CCc2ccccc2C1	ZINC000819001755	FF	On-Demand	Anodyne	DPP8	21	42
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccccc1F	ZINC000819001762	GH	On-Demand	Clean	ADRB3	23	42
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccccc1F	ZINC000819001763	GH	On-Demand	Clean	ADRB3	23	42
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(C)cc3)CC2)cc1	ZINC000819001764	FG	On-Demand	Clean	ADRB2	46	53
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(C)cc3)CC2)cc1	ZINC000819001764	FG	On-Demand	Clean	ADRB1	51	50
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(C)cc3)CC2)cc1	ZINC000819001764	FG	On-Demand	Clean	ADRB3	47	58
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(C)cc3)CC2)cc1	ZINC000819001765	FG	On-Demand	Clean	ADRB2	46	53
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(C)cc3)CC2)cc1	ZINC000819001765	FG	On-Demand	Clean	ADRB1	51	50
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(C)cc3)CC2)cc1	ZINC000819001765	FG	On-Demand	Clean	ADRB3	47	58
COc1ccc(N2CCC(NCCC(=O)Nc3cccc(Cl)c3)CC2)cc1	ZINC000819001766	GH	On-Demand	Clean	HTR1A	18	56
COc1ccc(N2CCC(NCCC(=O)Nc3cccc(Cl)c3)CC2)cc1	ZINC000819001766	GH	On-Demand	Clean	DRD4	46	41
COc1ccc(N2CCC(NCCC(=O)Nc3cccc(Cl)c3)CC2)cc1	ZINC000819001766	GH	On-Demand	Clean	DRD3	15	42
COc1ccc(N2CCC(NCCC(=O)Nc3cccc(Cl)c3)CC2)cc1	ZINC000819001766	GH	On-Demand	Clean	F10	16	43
COc1ccc(N2CCC(NCCC(=O)Nc3cccc(Cl)c3)CC2)cc1	ZINC000819001766	GH	On-Demand	Clean	NPY1R	30	48
COc1ccc(N2CCC(NCCC(=O)Nc3cccc(Cl)c3)CC2)cc1	ZINC000819001766	GH	On-Demand	Clean	MTNR1A	23	43
COc1ccc(N2CCC(NCCC(=O)Nc3cccc(Cl)c3)CC2)cc1	ZINC000819001766	GH	On-Demand	Clean	MTNR1B	21	43
COc1ccc(N2CCC(NCCC(=O)Nc3cccc(Cl)c3)CC2)cc1	ZINC000819001766	GH	On-Demand	Clean	MCHR1	47	49
COc1ccc(N2CCC(NC[C@H](O)CCC(C)C)CC2)cc1	ZINC000819001767	DG	On-Demand	Clean	ADRB2	22	43
COc1ccc(N2CCC(NC[C@H](O)CCC(C)C)CC2)cc1	ZINC000819001767	DG	On-Demand	Clean	ADRB1	17	41
COc1ccc(N2CCC(NC[C@H](O)CCC(C)C)CC2)cc1	ZINC000819001767	DG	On-Demand	Clean	ADRB3	28	47
COc1ccc(N2CCC(NC[C@@H](O)CCC(C)C)CC2)cc1	ZINC000819001768	DG	On-Demand	Clean	ADRB2	22	43
COc1ccc(N2CCC(NC[C@@H](O)CCC(C)C)CC2)cc1	ZINC000819001768	DG	On-Demand	Clean	ADRB1	17	41
COc1ccc(N2CCC(NC[C@@H](O)CCC(C)C)CC2)cc1	ZINC000819001768	DG	On-Demand	Clean	ADRB3	28	47
CCOC(=O)CC[C@H](O)CNC1CCN(c2ccc(OC)cc2)CC1	ZINC000819001769	FD	On-Demand	Clean	ADRB3	25	44
CCOC(=O)CC[C@@H](O)CNC1CCN(c2ccc(OC)cc2)CC1	ZINC000819001770	FD	On-Demand	Clean	ADRB3	25	44
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(Cl)cc1	ZINC000819001772	GI	On-Demand	Clean	ADRB1	17	42
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(Cl)cc1	ZINC000819001772	GI	On-Demand	Clean	ADRB3	33	44
COc1ccc(N2CCC(NC[C@@H](O)CN(C)C3CC3)CC2)cc1	ZINC000819001773	ED	On-Demand	Clean	ADRB2	17	43
COc1ccc(N2CCC(NC[C@@H](O)CN(C)C3CC3)CC2)cc1	ZINC000819001773	ED	On-Demand	Clean	ADRB3	25	45
COc1ccc(N2CCC(NC[C@H](O)CN(C)C3CC3)CC2)cc1	ZINC000819001774	ED	On-Demand	Clean	ADRB2	17	43
COc1ccc(N2CCC(NC[C@H](O)CN(C)C3CC3)CC2)cc1	ZINC000819001774	ED	On-Demand	Clean	ADRB3	25	45
O=C(CNC[C@H](O)c1c(F)cccc1F)N1CCc2ccccc2C1	ZINC000819001775	EE	On-Demand	Anodyne	DPP8	26	47
O=C(CNC[C@@H](O)c1c(F)cccc1F)N1CCc2ccccc2C1	ZINC000819001776	EE	On-Demand	Anodyne	DPP8	26	47
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(F)c1	ZINC000819001778	GH	On-Demand	Clean	ADRB2	16	44
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(F)c1	ZINC000819001778	GH	On-Demand	Clean	ADRB1	19	40
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(F)c1	ZINC000819001778	GH	On-Demand	Clean	ADRB3	37	49
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(F)c1	ZINC000819001779	GH	On-Demand	Clean	ADRB2	16	44
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(F)c1	ZINC000819001779	GH	On-Demand	Clean	ADRB1	19	40
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(F)c1	ZINC000819001779	GH	On-Demand	Clean	ADRB3	37	49
O=C(CNC[C@H](O)c1ccccc1Cl)N1CCc2ccccc2C1	ZINC000819001783	EF	On-Demand	Anodyne	DPP8	22	47
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)cc1F	ZINC000819001787	EG	On-Demand	Anodyne	ADRB2	18	43
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)cc1F	ZINC000819001787	EG	On-Demand	Anodyne	ADRB1	19	43
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)cc1F	ZINC000819001787	EG	On-Demand	Anodyne	PDS	64	40
N#Cc1ccc([C@@H](O)CNC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1	ZINC000819001808	GG	On-Demand	Mild	ADRB3	22	42
N#Cc1ccc([C@H](O)CNC2CCN(c3ccc(OC(F)F)cc3)CC2)cc1	ZINC000819001812	GG	On-Demand	Mild	ADRB3	22	42
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccccc1Cl	ZINC000819001815	GI	On-Demand	Clean	ADRB1	15	41
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccccc1Cl	ZINC000819001815	GI	On-Demand	Clean	ADRB3	27	43
CON(C)C(=O)CCNCc1ccccc1NS(=O)(=O)c1ccccc1	ZINC000819001824	GD	On-Demand	Anodyne	PRTN3	56	35
CON(C)C(=O)CCNCc1ccccc1NS(=O)(=O)c1ccccc1	ZINC000819001824	GD	On-Demand	Anodyne	LIMK2	27	41
O=C(CCNCCn1cncn1)Nc1ccccc1F	ZINC000819001839	CD	On-Demand	Anodyne	HIS3	46	37
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccccc1F	ZINC000819001843	EG	On-Demand	Anodyne	ADRB2	16	45
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccccc1F	ZINC000819001843	EG	On-Demand	Anodyne	PDS	82	40
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccccc1F	ZINC000819001847	EG	On-Demand	Anodyne	ADRB2	16	45
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccccc1F	ZINC000819001847	EG	On-Demand	Anodyne	PDS	82	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2cccc(C(N)=O)c2)CC1	ZINC000819001849	GD	On-Demand	Anodyne	ST14	92	35
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2cccc(C(N)=O)c2)CC1	ZINC000819001849	GD	On-Demand	Anodyne	GPR119	39	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2cccc(C(N)=O)c2)CC1	ZINC000819001852	GD	On-Demand	Anodyne	ST14	92	35
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2cccc(C(N)=O)c2)CC1	ZINC000819001852	GD	On-Demand	Anodyne	GPR119	39	49
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)C1	ZINC000819001867	GD	On-Demand	Anodyne	ADRB3	30	40
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)C1	ZINC000819001867	GD	On-Demand	Anodyne	ACOX1	45	34
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)C1	ZINC000819001871	GD	On-Demand	Anodyne	ADRB3	30	40
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)C1	ZINC000819001871	GD	On-Demand	Anodyne	ACOX1	45	34
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)C1	ZINC000819001874	GD	On-Demand	Anodyne	ADRB3	30	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)C1	ZINC000819001874	GD	On-Demand	Anodyne	ACOX1	45	34
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)C1	ZINC000819001876	GD	On-Demand	Anodyne	ADRB3	30	40
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)C1	ZINC000819001876	GD	On-Demand	Anodyne	ACOX1	45	34
COC(=O)N1CCC[C@H](NC[C@@](C)(O)c2ccc(Br)cc2F)C1	ZINC000819001879	GF	On-Demand	Anodyne	SFRP1	40	32
O=C(Nc1ccccc1N1CCCCC1)C(F)=C1CCC1	ZINC000819001881	CI	On-Demand	Anodyne	KCNQ2	98	52
COC(=O)N1CCC[C@H](NC[C@](C)(O)c2ccc(Br)cc2F)C1	ZINC000819001882	GF	On-Demand	Anodyne	SFRP1	40	32
COC(=O)N1CCC[C@@H](NC[C@@](C)(O)c2ccc(Br)cc2F)C1	ZINC000819001884	GF	On-Demand	Anodyne	SFRP1	40	32
COC(=O)N1CCC[C@@H](NC[C@](C)(O)c2ccc(Br)cc2F)C1	ZINC000819001887	GF	On-Demand	Anodyne	SFRP1	40	32
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C)cc2C)C1	ZINC000819001889	ED	On-Demand	Anodyne	ADRB2	27	43
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C)cc2C)C1	ZINC000819001889	ED	On-Demand	Anodyne	ADRB1	20	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C)cc2C)C1	ZINC000819001893	ED	On-Demand	Anodyne	ADRB2	27	43
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C)cc2C)C1	ZINC000819001893	ED	On-Demand	Anodyne	ADRB1	20	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCCc3ccccc31)C2	ZINC000819001894	EG	On-Demand	Anodyne	XIAP	29	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCCc3ccccc31)C2	ZINC000819001894	EG	On-Demand	Anodyne	BIRC3	43	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCCc3ccccc31)C2	ZINC000819001894	EG	On-Demand	Anodyne	BIRC2	54	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C)cc2C)C1	ZINC000819001896	ED	On-Demand	Anodyne	ADRB2	27	43
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C)cc2C)C1	ZINC000819001896	ED	On-Demand	Anodyne	ADRB1	20	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCCc3ccccc31)C2	ZINC000819001897	EG	On-Demand	Anodyne	XIAP	29	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCCc3ccccc31)C2	ZINC000819001897	EG	On-Demand	Anodyne	BIRC3	43	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCCc3ccccc31)C2	ZINC000819001897	EG	On-Demand	Anodyne	BIRC2	54	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C)cc2C)C1	ZINC000819001899	ED	On-Demand	Anodyne	ADRB2	27	43
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C)cc2C)C1	ZINC000819001899	ED	On-Demand	Anodyne	ADRB1	20	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCCc3ccccc31)C2	ZINC000819001900	EG	On-Demand	Anodyne	XIAP	29	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCCc3ccccc31)C2	ZINC000819001900	EG	On-Demand	Anodyne	BIRC3	43	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCCc3ccccc31)C2	ZINC000819001900	EG	On-Demand	Anodyne	BIRC2	54	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819001903	ED	On-Demand	Anodyne	ADRB2	44	49
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819001903	ED	On-Demand	Anodyne	ADRB1	47	49
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819001903	ED	On-Demand	Anodyne	ADRB3	32	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819001903	ED	On-Demand	Anodyne	ABCB1	48	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCCc3ccccc31)C2	ZINC000819001904	EG	On-Demand	Anodyne	XIAP	29	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCCc3ccccc31)C2	ZINC000819001904	EG	On-Demand	Anodyne	BIRC3	43	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCCc3ccccc31)C2	ZINC000819001904	EG	On-Demand	Anodyne	BIRC2	54	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819001906	ED	On-Demand	Anodyne	ADRB2	44	49
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819001906	ED	On-Demand	Anodyne	ADRB1	47	49
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819001906	ED	On-Demand	Anodyne	ADRB3	32	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819001906	ED	On-Demand	Anodyne	ABCB1	48	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(OC)c(Cl)c1)C2	ZINC000819001907	FG	On-Demand	Anodyne	GRM4	16	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819001908	ED	On-Demand	Anodyne	ADRB2	44	49
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819001908	ED	On-Demand	Anodyne	ADRB1	47	49
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819001908	ED	On-Demand	Anodyne	ADRB3	32	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819001908	ED	On-Demand	Anodyne	ABCB1	48	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(OC)c(Cl)c1)C2	ZINC000819001910	FG	On-Demand	Anodyne	GRM4	16	41
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819001911	ED	On-Demand	Anodyne	ADRB2	44	49
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819001911	ED	On-Demand	Anodyne	ADRB1	47	49
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819001911	ED	On-Demand	Anodyne	ADRB3	32	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819001911	ED	On-Demand	Anodyne	ABCB1	48	45
COc1ccc(N2CCC(NC[C@H](O)COc3cccc4[nH]ccc34)CC2)cc1	ZINC000819001920	GG	On-Demand	Clean	ADRB2	41	69
COc1ccc(N2CCC(NC[C@H](O)COc3cccc4[nH]ccc34)CC2)cc1	ZINC000819001920	GG	On-Demand	Clean	ADRB1	41	69
COc1ccc(N2CCC(NC[C@H](O)COc3cccc4[nH]ccc34)CC2)cc1	ZINC000819001920	GG	On-Demand	Clean	HTR1A	20	69
COc1ccc(N2CCC(NC[C@H](O)COc3cccc4[nH]ccc34)CC2)cc1	ZINC000819001920	GG	On-Demand	Clean	SLC6A4	20	45
COc1ccc(N2CCC(NC[C@H](O)COc3cccc4[nH]ccc34)CC2)cc1	ZINC000819001920	GG	On-Demand	Clean	ADRB3	44	55
COc1ccc(N2CCC(NC[C@@H](O)COc3cccc4[nH]ccc34)CC2)cc1	ZINC000819001922	GG	On-Demand	Clean	ADRB2	41	69
COc1ccc(N2CCC(NC[C@@H](O)COc3cccc4[nH]ccc34)CC2)cc1	ZINC000819001922	GG	On-Demand	Clean	ADRB1	41	69
COc1ccc(N2CCC(NC[C@@H](O)COc3cccc4[nH]ccc34)CC2)cc1	ZINC000819001922	GG	On-Demand	Clean	HTR1A	20	69
COc1ccc(N2CCC(NC[C@@H](O)COc3cccc4[nH]ccc34)CC2)cc1	ZINC000819001922	GG	On-Demand	Clean	SLC6A4	20	45
COc1ccc(N2CCC(NC[C@@H](O)COc3cccc4[nH]ccc34)CC2)cc1	ZINC000819001922	GG	On-Demand	Clean	ADRB3	44	55
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(C)cc3C)CC2)cc1	ZINC000819001924	GG	On-Demand	Clean	ADRB2	34	45
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(C)cc3C)CC2)cc1	ZINC000819001924	GG	On-Demand	Clean	ADRB1	29	45
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(C)cc3C)CC2)cc1	ZINC000819001924	GG	On-Demand	Clean	ADRB3	34	49
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(C)cc3C)CC2)cc1	ZINC000819001927	GG	On-Demand	Clean	ADRB2	34	45
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(C)cc3C)CC2)cc1	ZINC000819001927	GG	On-Demand	Clean	ADRB1	29	45
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(C)cc3C)CC2)cc1	ZINC000819001927	GG	On-Demand	Clean	ADRB3	34	49
C[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)S(C)(=O)=O	ZINC000819001933	FE	On-Demand	Clean	ADRB3	18	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819001936	GE	On-Demand	Anodyne	ADRB2	39	40
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819001936	GE	On-Demand	Anodyne	ADRB1	56	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819001936	GE	On-Demand	Anodyne	ADRB3	41	47
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819001938	GE	On-Demand	Anodyne	ADRB2	39	40
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819001938	GE	On-Demand	Anodyne	ADRB1	56	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819001938	GE	On-Demand	Anodyne	ADRB3	41	47
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819001940	GE	On-Demand	Anodyne	ADRB2	39	40
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819001940	GE	On-Demand	Anodyne	ADRB1	56	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819001940	GE	On-Demand	Anodyne	ADRB3	41	47
CS(=O)(=O)c1ccc([C@@H](O)CNCC(=O)N2CCc3ccccc3C2)cc1	ZINC000819001943	GD	On-Demand	Anodyne	DPP8	18	44
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819001945	GE	On-Demand	Anodyne	ADRB2	39	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819001945	GE	On-Demand	Anodyne	ADRB1	56	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819001945	GE	On-Demand	Anodyne	ADRB3	41	47
CS(=O)(=O)c1ccc([C@H](O)CNCC(=O)N2CCc3ccccc3C2)cc1	ZINC000819001947	GD	On-Demand	Anodyne	DPP8	18	44
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819001951	DD	On-Demand	Mild	ADRB3	21	48
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819001954	DD	On-Demand	Mild	ADRB3	21	48
CC(C)(C)N1CC[C@H](OC(=O)c2cc(-c3cccnc3)nc3ccccc23)C1=O	ZINC000819001955	GH	On-Demand	Anodyne	ACACB	15	44
CC(C)(C)N1CC[C@H](OC(=O)c2cc(-c3cccnc3)nc3ccccc23)C1=O	ZINC000819001955	GH	On-Demand	Anodyne	TACR3	18	40
CC(C)(C)N1CC[C@H](OC(=O)c2cc(-c3cccnc3)nc3ccccc23)C1=O	ZINC000819001955	GH	On-Demand	Anodyne	MT-CO2	46	38
O[C@H](CNCCn1cncn1)c1cccc(Cl)c1	ZINC000819001956	CD	On-Demand	Anodyne	ADRB2	40	38
O[C@H](CNCCn1cncn1)c1cccc(Cl)c1	ZINC000819001956	CD	On-Demand	Anodyne	ADRB1	49	48
O[C@H](CNCCn1cncn1)c1cccc(Cl)c1	ZINC000819001956	CD	On-Demand	Anodyne	ADRB3	78	48
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819001957	DD	On-Demand	Mild	ADRB3	21	48
O[C@@H](CNCCn1cncn1)c1cccc(Cl)c1	ZINC000819001958	CD	On-Demand	Anodyne	ADRB2	40	38
O[C@@H](CNCCn1cncn1)c1cccc(Cl)c1	ZINC000819001958	CD	On-Demand	Anodyne	ADRB1	49	48
O[C@@H](CNCCn1cncn1)c1cccc(Cl)c1	ZINC000819001958	CD	On-Demand	Anodyne	ADRB3	78	48
CC(C)(C)N1CC[C@@H](OC(=O)c2cc(-c3cccnc3)nc3ccccc23)C1=O	ZINC000819001959	GH	On-Demand	Anodyne	ACACB	15	44
CC(C)(C)N1CC[C@@H](OC(=O)c2cc(-c3cccnc3)nc3ccccc23)C1=O	ZINC000819001959	GH	On-Demand	Anodyne	TACR3	18	40
CC(C)(C)N1CC[C@@H](OC(=O)c2cc(-c3cccnc3)nc3ccccc23)C1=O	ZINC000819001959	GH	On-Demand	Anodyne	MT-CO2	46	38
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819001961	DD	On-Demand	Mild	ADRB3	21	48
CON(C)C(=O)CCNCc1cccc(OCC(F)F)c1	ZINC000819001984	DD	On-Demand	Anodyne	DPP7	15	43
CON(C)C(=O)CCNCc1cccc(OCC(F)F)c1	ZINC000819001984	DD	On-Demand	Anodyne	PDS	86	39
COC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819002001	DD	On-Demand	Bother	CACNA1C	54	38
COC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819002001	DD	On-Demand	Bother	CACNA1D	80	36
COC(=O)N1CCC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819002003	DD	On-Demand	Bother	CACNA1C	54	38
COC(=O)N1CCC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819002003	DD	On-Demand	Bother	CACNA1D	80	36
COC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819002005	DD	On-Demand	Bother	CACNA1C	54	38
COC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819002005	DD	On-Demand	Bother	CACNA1D	80	36
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819002007	DD	On-Demand	Bother	CACNA1C	54	38
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819002007	DD	On-Demand	Bother	CACNA1D	80	36
CO[C@@H](C)CCNC[C@@H](O)c1cccnc1	ZINC000819002008	BD	On-Demand	Anodyne	ADRB2	33	50
CO[C@@H](C)CCNC[C@@H](O)c1cccnc1	ZINC000819002008	BD	On-Demand	Anodyne	ADRB1	42	50
CO[C@@H](C)CCNC[C@@H](O)c1cccnc1	ZINC000819002008	BD	On-Demand	Anodyne	ADRB3	117	50
CO[C@@H](C)CCNC[C@@H](O)c1cccnc1	ZINC000819002008	BD	On-Demand	Anodyne	KCNA5	21	40
CO[C@@H](C)CCNC[C@H](O)c1cccnc1	ZINC000819002009	BD	On-Demand	Anodyne	ADRB2	33	50
CO[C@@H](C)CCNC[C@H](O)c1cccnc1	ZINC000819002009	BD	On-Demand	Anodyne	ADRB1	42	50
CO[C@@H](C)CCNC[C@H](O)c1cccnc1	ZINC000819002009	BD	On-Demand	Anodyne	ADRB3	117	50
CO[C@@H](C)CCNC[C@H](O)c1cccnc1	ZINC000819002009	BD	On-Demand	Anodyne	KCNA5	21	40
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1Cl	ZINC000819002021	CG	On-Demand	Anodyne	GRM4	15	43
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1Cl	ZINC000819002022	CG	On-Demand	Anodyne	GRM4	15	43
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1Cl	ZINC000819002024	CG	On-Demand	Anodyne	GRM4	15	43
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1Cl	ZINC000819002026	CG	On-Demand	Anodyne	GRM4	15	43
COc1ccc(OC)c([C@H](O)CNCCc2csc(C(C)C)n2)c1	ZINC000819002037	FG	On-Demand	Anodyne	ADRB2	19	46
COC(=O)N1CCC[C@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819002038	DD	On-Demand	Anodyne	EPHX2	22	40
COC(=O)N1CCC[C@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819002038	DD	On-Demand	Anodyne	CCR8	51	34
COC(=O)N1CCC[C@@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819002039	DD	On-Demand	Anodyne	EPHX2	22	40
COC(=O)N1CCC[C@@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819002039	DD	On-Demand	Anodyne	CCR8	51	34
O=C(CNC[C@@H](O)c1ccccc1C(F)(F)F)N1CCc2ccccc2C1	ZINC000819002046	GF	On-Demand	Anodyne	DPP8	18	45
O=C(CNC[C@H](O)c1ccccc1C(F)(F)F)N1CCc2ccccc2C1	ZINC000819002047	GF	On-Demand	Anodyne	DPP8	18	45
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)CC(F)(F)F	ZINC000819002050	FG	On-Demand	Clean	ADRB3	22	44
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)CC(F)(F)F	ZINC000819002051	FG	On-Demand	Clean	ADRB3	22	44
O[C@@H](CCc1ccccc1)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000819002059	GH	On-Demand	Clean	SLC18A2	16	40
O[C@@H](CCc1ccccc1)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000819002059	GH	On-Demand	Clean	ADRB3	28	49
O[C@H](CCc1ccccc1)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000819002060	GH	On-Demand	Clean	SLC18A2	16	40
O[C@H](CCc1ccccc1)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000819002060	GH	On-Demand	Clean	ADRB3	28	49
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)CC1CCCC1	ZINC000819002063	FH	On-Demand	Clean	ADRB1	19	41
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)CC1CCCC1	ZINC000819002063	FH	On-Demand	Clean	ADRB3	23	45
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)CC1CCCC1	ZINC000819002064	FH	On-Demand	Clean	ADRB1	19	41
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)CC1CCCC1	ZINC000819002064	FH	On-Demand	Clean	ADRB3	23	45
NC(=O)c1cccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819002069	FF	On-Demand	Anodyne	ADRB2	75	43
NC(=O)c1cccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819002069	FF	On-Demand	Anodyne	ADRB1	82	46
NC(=O)c1cccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819002069	FF	On-Demand	Anodyne	GRIN2B	16	42
NC(=O)c1cccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819002069	FF	On-Demand	Anodyne	ADRB3	103	51
NC(=O)c1cccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819002070	FF	On-Demand	Anodyne	ADRB2	75	43
NC(=O)c1cccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819002070	FF	On-Demand	Anodyne	ADRB1	82	46
NC(=O)c1cccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819002070	FF	On-Demand	Anodyne	GRIN2B	16	42
NC(=O)c1cccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819002070	FF	On-Demand	Anodyne	ADRB3	103	51
COc1ccc(N2CCC(NC[C@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000819002087	FF	On-Demand	Mild	ADRB2	18	43
COc1ccc(N2CCC(NC[C@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000819002087	FF	On-Demand	Mild	ADRB1	16	41
COc1ccc(N2CCC(NC[C@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000819002087	FF	On-Demand	Mild	ADRB3	31	44
COc1ccc(N2CCC(NC[C@@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000819002088	FF	On-Demand	Mild	ADRB2	18	43
COc1ccc(N2CCC(NC[C@@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000819002088	FF	On-Demand	Mild	ADRB1	16	41
COc1ccc(N2CCC(NC[C@@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000819002088	FF	On-Demand	Mild	ADRB3	31	44
COc1ccc(N2CCC(NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)CC2)cc1	ZINC000819002106	GE	On-Demand	Clean	ADRB3	23	42
COc1ccc(N2CCC(NC[C@H](O)CN(C)C(=O)OC(C)(C)C)CC2)cc1	ZINC000819002107	GE	On-Demand	Clean	ADRB3	23	42
COc1ccc(N2CCC(NC[C@H](O)COc3cccc(C(C)=O)c3)CC2)cc1	ZINC000819002111	GF	On-Demand	Clean	ADRB2	40	49
COc1ccc(N2CCC(NC[C@H](O)COc3cccc(C(C)=O)c3)CC2)cc1	ZINC000819002111	GF	On-Demand	Clean	ADRB1	54	49
COc1ccc(N2CCC(NC[C@H](O)COc3cccc(C(C)=O)c3)CC2)cc1	ZINC000819002111	GF	On-Demand	Clean	DRD4	48	40
COc1ccc(N2CCC(NC[C@H](O)COc3cccc(C(C)=O)c3)CC2)cc1	ZINC000819002111	GF	On-Demand	Clean	ADRB3	53	52
COc1ccc(N2CCC(NC[C@H](O)COc3cccc(C(C)=O)c3)CC2)cc1	ZINC000819002111	GF	On-Demand	Clean	ACOX1	50	34
COc1ccc(N2CCC(NC[C@H](O)COc3cccc(C(C)=O)c3)CC2)cc1	ZINC000819002111	GF	On-Demand	Clean	ABCB1	39	47
COc1ccc(N2CCC(NC[C@@H](O)COc3cccc(C(C)=O)c3)CC2)cc1	ZINC000819002114	GF	On-Demand	Clean	ADRB2	40	49
COc1ccc(N2CCC(NC[C@@H](O)COc3cccc(C(C)=O)c3)CC2)cc1	ZINC000819002114	GF	On-Demand	Clean	ADRB1	54	49
COc1ccc(N2CCC(NC[C@@H](O)COc3cccc(C(C)=O)c3)CC2)cc1	ZINC000819002114	GF	On-Demand	Clean	DRD4	48	40
COc1ccc(N2CCC(NC[C@@H](O)COc3cccc(C(C)=O)c3)CC2)cc1	ZINC000819002114	GF	On-Demand	Clean	ADRB3	53	52
COc1ccc(N2CCC(NC[C@@H](O)COc3cccc(C(C)=O)c3)CC2)cc1	ZINC000819002114	GF	On-Demand	Clean	ACOX1	50	34
COc1ccc(N2CCC(NC[C@@H](O)COc3cccc(C(C)=O)c3)CC2)cc1	ZINC000819002114	GF	On-Demand	Clean	ABCB1	39	47
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002117	FD	On-Demand	Anodyne	ADRB2	45	45
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002117	FD	On-Demand	Anodyne	ADRB1	67	42
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002117	FD	On-Demand	Anodyne	ADRB3	51	47
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002120	FD	On-Demand	Anodyne	ADRB2	45	45
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002120	FD	On-Demand	Anodyne	ADRB1	67	42
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002120	FD	On-Demand	Anodyne	ADRB3	51	47
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002122	FD	On-Demand	Anodyne	ADRB2	45	45
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002122	FD	On-Demand	Anodyne	ADRB1	67	42
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002122	FD	On-Demand	Anodyne	ADRB3	51	47
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002124	FD	On-Demand	Anodyne	ADRB2	45	45
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002124	FD	On-Demand	Anodyne	ADRB1	67	42
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002124	FD	On-Demand	Anodyne	ADRB3	51	47
COc1ccc(N2CCC(NCCC(=O)Nc3ccc(Cl)cc3)CC2)cc1	ZINC000819002127	GH	On-Demand	Clean	DRD4	24	41
COc1ccc(N2CCC(NCCC(=O)Nc3ccc(Cl)cc3)CC2)cc1	ZINC000819002127	GH	On-Demand	Clean	F10	21	40
COc1ccc(N2CCC(NCCC(=O)Nc3ccc(Cl)cc3)CC2)cc1	ZINC000819002127	GH	On-Demand	Clean	EPHX2	24	44
COc1ccc(N2CCC(NCCC(=O)Nc3ccc(Cl)cc3)CC2)cc1	ZINC000819002127	GH	On-Demand	Clean	MCHR1	31	48
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002143	FD	On-Demand	Anodyne	ADRB2	45	43
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002143	FD	On-Demand	Anodyne	ADRB1	61	43
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002143	FD	On-Demand	Anodyne	ADRB3	43	48
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002145	FD	On-Demand	Anodyne	ADRB2	45	43
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002145	FD	On-Demand	Anodyne	ADRB1	61	43
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002145	FD	On-Demand	Anodyne	ADRB3	43	48
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002147	FD	On-Demand	Anodyne	ADRB2	45	43
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002147	FD	On-Demand	Anodyne	ADRB1	61	43
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002147	FD	On-Demand	Anodyne	ADRB3	43	48
COc1ccc(N2CCC(NC[C@H](O)c3ccc(F)cc3Cl)CC2)cc1	ZINC000819002148	GH	On-Demand	Clean	ADRB3	27	40
CCOc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002149	FD	On-Demand	Anodyne	ADRB2	45	43
CCOc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002149	FD	On-Demand	Anodyne	ADRB1	61	43
CCOc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002149	FD	On-Demand	Anodyne	ADRB3	43	48
COc1ccc(N2CCC(NC[C@@H](O)c3ccc(F)cc3Cl)CC2)cc1	ZINC000819002150	GH	On-Demand	Clean	ADRB3	27	40
Cc1ccccc1C1(CNC[C@H](O)c2cccnc2)CC1	ZINC000819002158	CF	On-Demand	Anodyne	ADRB2	18	40
Cc1ccccc1C1(CNC[C@H](O)c2cccnc2)CC1	ZINC000819002158	CF	On-Demand	Anodyne	ADRB1	20	40
Cc1ccccc1C1(CNC[C@H](O)c2cccnc2)CC1	ZINC000819002158	CF	On-Demand	Anodyne	ADRB3	81	47
Cc1ccccc1C1(CNC[C@H](O)c2cccnc2)CC1	ZINC000819002158	CF	On-Demand	Anodyne	SCD	15	41
Cc1ccccc1C1(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819002160	CF	On-Demand	Anodyne	ADRB2	18	40
Cc1ccccc1C1(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819002160	CF	On-Demand	Anodyne	ADRB1	20	40
Cc1ccccc1C1(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819002160	CF	On-Demand	Anodyne	ADRB3	81	47
Cc1ccccc1C1(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819002160	CF	On-Demand	Anodyne	SCD	15	41
O=C(CNC[C@H](O)c1cccnc1)N1CCc2ccccc2C1	ZINC000819002165	DD	On-Demand	Anodyne	ADRB2	21	42
O=C(CNC[C@H](O)c1cccnc1)N1CCc2ccccc2C1	ZINC000819002165	DD	On-Demand	Anodyne	ADRB1	23	40
O=C(CNC[C@H](O)c1cccnc1)N1CCc2ccccc2C1	ZINC000819002165	DD	On-Demand	Anodyne	ADRB3	89	45
O=C(CNC[C@H](O)c1cccnc1)N1CCc2ccccc2C1	ZINC000819002165	DD	On-Demand	Anodyne	PTAFR	22	49
O=C(CNC[C@H](O)c1cccnc1)N1CCc2ccccc2C1	ZINC000819002165	DD	On-Demand	Anodyne	DPP8	18	45
O=C(CNC[C@@H](O)c1cccnc1)N1CCc2ccccc2C1	ZINC000819002167	DD	On-Demand	Anodyne	ADRB2	21	42
O=C(CNC[C@@H](O)c1cccnc1)N1CCc2ccccc2C1	ZINC000819002167	DD	On-Demand	Anodyne	ADRB1	23	40
O=C(CNC[C@@H](O)c1cccnc1)N1CCc2ccccc2C1	ZINC000819002167	DD	On-Demand	Anodyne	ADRB3	89	45
O=C(CNC[C@@H](O)c1cccnc1)N1CCc2ccccc2C1	ZINC000819002167	DD	On-Demand	Anodyne	PTAFR	22	49
O=C(CNC[C@@H](O)c1cccnc1)N1CCc2ccccc2C1	ZINC000819002167	DD	On-Demand	Anodyne	DPP8	18	45
O[C@H](CN[C@H](c1ccccc1)[C@@H]1CCCO1)c1cccc(Cl)c1	ZINC000819002189	EH	On-Demand	Anodyne	ADRB1	29	44
O[C@H](CN[C@H](c1ccccc1)[C@@H]1CCCO1)c1cccc(Cl)c1	ZINC000819002189	EH	On-Demand	Anodyne	ADRB3	45	44
O[C@H](CN[C@H](c1ccccc1)[C@H]1CCCO1)c1cccc(Cl)c1	ZINC000819002191	EH	On-Demand	Anodyne	ADRB1	29	44
O[C@H](CN[C@H](c1ccccc1)[C@H]1CCCO1)c1cccc(Cl)c1	ZINC000819002191	EH	On-Demand	Anodyne	ADRB3	45	44
O[C@H](CN[C@@H](c1ccccc1)[C@H]1CCCO1)c1cccc(Cl)c1	ZINC000819002193	EH	On-Demand	Anodyne	ADRB1	29	44
O[C@H](CN[C@@H](c1ccccc1)[C@H]1CCCO1)c1cccc(Cl)c1	ZINC000819002193	EH	On-Demand	Anodyne	ADRB3	45	44
O[C@H](CN[C@@H](c1ccccc1)[C@@H]1CCCO1)c1cccc(Cl)c1	ZINC000819002196	EH	On-Demand	Anodyne	ADRB1	29	44
O[C@H](CN[C@@H](c1ccccc1)[C@@H]1CCCO1)c1cccc(Cl)c1	ZINC000819002196	EH	On-Demand	Anodyne	ADRB3	45	44
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819002217	EF	On-Demand	Anodyne	CNR1	16	44
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819002219	EF	On-Demand	Anodyne	CNR1	16	44
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819002221	EF	On-Demand	Anodyne	CNR1	16	44
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819002223	EF	On-Demand	Anodyne	CNR1	16	44
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819002235	FD	On-Demand	Bother	ADRB2	33	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819002235	FD	On-Demand	Bother	ADRB1	29	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819002235	FD	On-Demand	Bother	ADRB3	24	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819002235	FD	On-Demand	Bother	ABCB1	32	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1ccc(Cl)cc1)C2	ZINC000819002236	FF	On-Demand	Anodyne	SLC6A3	16	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1ccc(Cl)cc1)C2	ZINC000819002236	FF	On-Demand	Anodyne	GPBAR1	15	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819002237	FD	On-Demand	Bother	ADRB2	33	46
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819002237	FD	On-Demand	Bother	ADRB1	29	46
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819002237	FD	On-Demand	Bother	ADRB3	24	40
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819002237	FD	On-Demand	Bother	ABCB1	32	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1ccc(Cl)cc1)C2	ZINC000819002238	FF	On-Demand	Anodyne	SLC6A3	16	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1ccc(Cl)cc1)C2	ZINC000819002238	FF	On-Demand	Anodyne	GPBAR1	15	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819002239	FD	On-Demand	Bother	ADRB2	33	46
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819002239	FD	On-Demand	Bother	ADRB1	29	46
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819002239	FD	On-Demand	Bother	ADRB3	24	40
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819002239	FD	On-Demand	Bother	ABCB1	32	43
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819002240	FD	On-Demand	Bother	ADRB2	33	46
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819002240	FD	On-Demand	Bother	ADRB1	29	46
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819002240	FD	On-Demand	Bother	ADRB3	24	40
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819002240	FD	On-Demand	Bother	ABCB1	32	43
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002254	FD	On-Demand	Bother	ADRB1	34	40
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002254	FD	On-Demand	Bother	CACNA1C	42	33
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002254	FD	On-Demand	Bother	ADRB3	28	40
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002254	FD	On-Demand	Bother	ACOX1	44	32
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002254	FD	On-Demand	Bother	CACNA1D	63	33
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002256	FD	On-Demand	Bother	ADRB1	34	40
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002256	FD	On-Demand	Bother	CACNA1C	42	33
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002256	FD	On-Demand	Bother	ADRB3	28	40
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002256	FD	On-Demand	Bother	ACOX1	44	32
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002256	FD	On-Demand	Bother	CACNA1D	63	33
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002258	FD	On-Demand	Bother	ADRB1	34	40
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002258	FD	On-Demand	Bother	CACNA1C	42	33
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002258	FD	On-Demand	Bother	ADRB3	28	40
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002258	FD	On-Demand	Bother	ACOX1	44	32
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002258	FD	On-Demand	Bother	CACNA1D	63	33
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002260	FD	On-Demand	Bother	ADRB1	34	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002260	FD	On-Demand	Bother	CACNA1C	42	33
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002260	FD	On-Demand	Bother	ADRB3	28	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002260	FD	On-Demand	Bother	ACOX1	44	32
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819002260	FD	On-Demand	Bother	CACNA1D	63	33
O=C(NNC(=O)C1CC1)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819002270	FE	On-Demand	Reactive	CNR1	58	36
COC(=O)N1CCC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819002277	CD	On-Demand	Anodyne	ADRB3	43	39
COC(=O)N1CCC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819002277	CD	On-Demand	Anodyne	CCR5	33	43
COC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819002279	CD	On-Demand	Anodyne	ADRB3	43	39
COC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819002279	CD	On-Demand	Anodyne	CCR5	33	43
CON(C)C(=O)CCNCCCNC(=O)c1ccc(Br)cc1	ZINC000819002280	FD	On-Demand	Anodyne	HDAC9	15	40
COC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819002281	CD	On-Demand	Anodyne	ADRB3	43	39
COC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819002281	CD	On-Demand	Anodyne	CCR5	33	43
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819002283	CD	On-Demand	Anodyne	ADRB3	43	39
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819002283	CD	On-Demand	Anodyne	CCR5	33	43
COc1ccc(OCC(F)(F)C(F)F)c(C(=O)NNC(=O)C2CC2)c1	ZINC000819002295	FE	On-Demand	Reactive	MTNR1A	25	40
COc1ccc(OCC(F)(F)C(F)F)c(C(=O)NNC(=O)C2CC2)c1	ZINC000819002295	FE	On-Demand	Reactive	MTNR1B	25	40
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819002301	ED	On-Demand	Anodyne	ADRB2	47	43
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819002301	ED	On-Demand	Anodyne	ADRB1	65	43
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819002301	ED	On-Demand	Anodyne	ADRB3	48	47
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819002301	ED	On-Demand	Anodyne	ACOX1	40	37
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819002303	ED	On-Demand	Anodyne	ADRB2	47	43
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819002303	ED	On-Demand	Anodyne	ADRB1	65	43
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819002303	ED	On-Demand	Anodyne	ADRB3	48	47
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819002303	ED	On-Demand	Anodyne	ACOX1	40	37
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819002305	ED	On-Demand	Anodyne	ADRB2	47	43
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819002305	ED	On-Demand	Anodyne	ADRB1	65	43
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819002305	ED	On-Demand	Anodyne	ADRB3	48	47
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819002305	ED	On-Demand	Anodyne	ACOX1	40	37
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819002309	ED	On-Demand	Anodyne	ADRB2	47	43
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819002309	ED	On-Demand	Anodyne	ADRB1	65	43
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819002309	ED	On-Demand	Anodyne	ADRB3	48	47
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819002309	ED	On-Demand	Anodyne	ACOX1	40	37
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1cc(F)ccc1F	ZINC000819002311	EG	On-Demand	Anodyne	ADRB1	17	41
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1cc(F)ccc1F	ZINC000819002311	EG	On-Demand	Anodyne	PDS	78	42
O[C@H](CNCc1cccc(OCC(F)F)c1)c1cc(F)ccc1F	ZINC000819002313	EG	On-Demand	Anodyne	ADRB1	17	41
O[C@H](CNCc1cccc(OCC(F)F)c1)c1cc(F)ccc1F	ZINC000819002313	EG	On-Demand	Anodyne	PDS	78	42
CO[C@@H](C)CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819002322	DF	On-Demand	Anodyne	ADRB2	21	41
CO[C@@H](C)CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819002322	DF	On-Demand	Anodyne	ADRB3	23	45
CO[C@@H](C)CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819002323	DF	On-Demand	Anodyne	ADRB2	21	41
CO[C@@H](C)CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819002323	DF	On-Demand	Anodyne	ADRB3	23	45
O[C@H](CNCCn1cncn1)c1ccc(Cl)c(F)c1	ZINC000819002326	CD	On-Demand	Anodyne	ADRB3	15	42
O[C@@H](CNCCn1cncn1)c1ccc(Cl)c(F)c1	ZINC000819002327	CD	On-Demand	Anodyne	ADRB3	15	42
CON(C)C(=O)CCNC[C@@H]1CCN(c2cc(Cl)ccc2C)C1	ZINC000819002339	EE	On-Demand	Anodyne	CACNA1I	41	32
CON(C)C(=O)CCNC[C@H]1CCN(c2cc(Cl)ccc2C)C1	ZINC000819002340	EE	On-Demand	Anodyne	CACNA1I	41	32
O=C(CCNC[C@H](O)c1cccc(F)c1)N1CCN(c2ncccn2)CC1	ZINC000819002341	FC	On-Demand	Anodyne	ADRB1	18	40
O=C(CCNC[C@H](O)c1cccc(F)c1)N1CCN(c2ncccn2)CC1	ZINC000819002341	FC	On-Demand	Anodyne	ADRB3	32	40
O=C(CCNC[C@@H](O)c1cccc(F)c1)N1CCN(c2ncccn2)CC1	ZINC000819002342	FC	On-Demand	Anodyne	ADRB1	18	40
O=C(CCNC[C@@H](O)c1cccc(F)c1)N1CCN(c2ncccn2)CC1	ZINC000819002342	FC	On-Demand	Anodyne	ADRB3	32	40
COc1ccc(N2CCC(NC[C@@H](O)CN(C)Cc3ccccc3)CC2)cc1	ZINC000819002356	GF	On-Demand	Clean	ADRB2	20	44
COc1ccc(N2CCC(NC[C@@H](O)CN(C)Cc3ccccc3)CC2)cc1	ZINC000819002356	GF	On-Demand	Clean	ADRB1	16	40
COc1ccc(N2CCC(NC[C@@H](O)CN(C)Cc3ccccc3)CC2)cc1	ZINC000819002356	GF	On-Demand	Clean	ADRB3	28	45
COc1ccc(N2CCC(NC[C@H](O)CN(C)Cc3ccccc3)CC2)cc1	ZINC000819002357	GF	On-Demand	Clean	ADRB2	20	44
COc1ccc(N2CCC(NC[C@H](O)CN(C)Cc3ccccc3)CC2)cc1	ZINC000819002357	GF	On-Demand	Clean	ADRB1	16	40
COc1ccc(N2CCC(NC[C@H](O)CN(C)Cc3ccccc3)CC2)cc1	ZINC000819002357	GF	On-Demand	Clean	ADRB3	28	45
NC(=O)c1cccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819002365	FF	On-Demand	Anodyne	ADRB2	68	43
NC(=O)c1cccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819002365	FF	On-Demand	Anodyne	ADRB1	62	45
NC(=O)c1cccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819002365	FF	On-Demand	Anodyne	ADRB3	85	47
NC(=O)c1cccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819002366	FF	On-Demand	Anodyne	ADRB2	68	43
NC(=O)c1cccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819002366	FF	On-Demand	Anodyne	ADRB1	62	45
NC(=O)c1cccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819002366	FF	On-Demand	Anodyne	ADRB3	85	47
O=C(CNC[C@@H](O)c1ccccc1Br)N1CCc2ccccc2C1	ZINC000819002369	GF	On-Demand	Anodyne	DPP8	21	47
O=C(CNC[C@H](O)c1ccccc1Br)N1CCc2ccccc2C1	ZINC000819002370	GF	On-Demand	Anodyne	DPP8	21	47
Cc1cc(F)ccc1[C@@H](O)CNCC(=O)N1CCc2ccccc2C1	ZINC000819002380	EE	On-Demand	Anodyne	DPP8	21	42
COc1ccc(N2CCC(NC[C@H](O)COC(C)C)CC2)cc1	ZINC000819002387	DE	On-Demand	Clean	ADRB2	28	48
COc1ccc(N2CCC(NC[C@H](O)COC(C)C)CC2)cc1	ZINC000819002387	DE	On-Demand	Clean	ADRB1	25	44
COc1ccc(N2CCC(NC[C@H](O)COC(C)C)CC2)cc1	ZINC000819002387	DE	On-Demand	Clean	ADRB3	30	50
COc1ccc(N2CCC(NC[C@@H](O)COC(C)C)CC2)cc1	ZINC000819002388	DE	On-Demand	Clean	ADRB2	28	48
COc1ccc(N2CCC(NC[C@@H](O)COC(C)C)CC2)cc1	ZINC000819002388	DE	On-Demand	Clean	ADRB1	25	44
COc1ccc(N2CCC(NC[C@@H](O)COC(C)C)CC2)cc1	ZINC000819002388	DE	On-Demand	Clean	ADRB3	30	50
Cc1ccccc1[C@@H](O)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000819002389	GH	On-Demand	Clean	ADRB3	25	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCC(=O)N1CCc2ccccc2C1	ZINC000819002391	GD	On-Demand	Anodyne	PREP	25	53
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCC(=O)N1CCc2ccccc2C1	ZINC000819002391	GD	On-Demand	Anodyne	DPP8	15	44
CC(C)(C)OC(=O)NC[C@](C)(O)CNCC(=O)N1CCc2ccccc2C1	ZINC000819002392	GD	On-Demand	Anodyne	PREP	25	53
CC(C)(C)OC(=O)NC[C@](C)(O)CNCC(=O)N1CCc2ccccc2C1	ZINC000819002392	GD	On-Demand	Anodyne	DPP8	15	44
O=C1CCCN1C[C@@H](O)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000819002406	GD	On-Demand	Clean	ADRB3	18	44
O=C1CCCN1C[C@H](O)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000819002407	GD	On-Demand	Clean	ADRB3	18	44
O=C(CNC[C@@H](O)c1ccc(C(F)(F)F)cc1)N1CCc2ccccc2C1	ZINC000819002412	GF	On-Demand	Anodyne	DPP8	20	45
O=C(CNC[C@@H](O)c1ccc(C(F)(F)F)cc1)N1CCc2ccccc2C1	ZINC000819002412	GF	On-Demand	Anodyne	TRPM8	42	40
O=C(CNC[C@H](O)c1ccc(C(F)(F)F)cc1)N1CCc2ccccc2C1	ZINC000819002413	GF	On-Demand	Anodyne	DPP8	20	45
O=C(CNC[C@H](O)c1ccc(C(F)(F)F)cc1)N1CCc2ccccc2C1	ZINC000819002413	GF	On-Demand	Anodyne	TRPM8	42	40
COc1ccc(N2CCC(NCCC(=O)Nc3cc(C)on3)CC2)cc1	ZINC000819002415	FF	On-Demand	Clean	PDK1	42	35
COc1ccc(N2CCC(NC[C@H](O)COc3cc(C)ccc3C)CC2)cc1	ZINC000819002416	GG	On-Demand	Clean	ADRB2	37	45
COc1ccc(N2CCC(NC[C@H](O)COc3cc(C)ccc3C)CC2)cc1	ZINC000819002416	GG	On-Demand	Clean	ADRB1	33	45
COc1ccc(N2CCC(NC[C@H](O)COc3cc(C)ccc3C)CC2)cc1	ZINC000819002416	GG	On-Demand	Clean	ADRB3	37	49
COc1ccc(N2CCC(NC[C@@H](O)COc3cc(C)ccc3C)CC2)cc1	ZINC000819002417	GG	On-Demand	Clean	ADRB2	37	45
COc1ccc(N2CCC(NC[C@@H](O)COc3cc(C)ccc3C)CC2)cc1	ZINC000819002417	GG	On-Demand	Clean	ADRB1	33	45
COc1ccc(N2CCC(NC[C@@H](O)COc3cc(C)ccc3C)CC2)cc1	ZINC000819002417	GG	On-Demand	Clean	ADRB3	37	49
CC(=O)c1ccc(N2CCN(C(=O)c3cnc4cc(C)nn4c3C)CC2)c(F)c1	ZINC000819002418	GF	On-Demand	Anodyne	NPY2R	57	37
CC(=O)c1ccc(N2CCN(C(=O)c3cnc4cc(C)nn4c3C)CC2)c(F)c1	ZINC000819002418	GF	On-Demand	Anodyne	SLC6A9	33	50
CC(=O)c1ccc(N2CCN(C(=O)c3cnn(-c4cccc(C(F)(F)F)c4)c3C)CC2)c(F)c1	ZINC000819002426	JJ	On-Demand	Anodyne	NPY2R	29	42
CC(=O)c1ccc(N2CCN(C(=O)c3cnn(-c4cccc(C(F)(F)F)c4)c3C)CC2)c(F)c1	ZINC000819002426	JJ	On-Demand	Anodyne	SLC6A9	41	46
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)COCc1ccco1	ZINC000819002435	GG	On-Demand	Clean	ADRB3	19	44
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)COCc1ccco1	ZINC000819002436	GG	On-Demand	Clean	ADRB3	19	44
COc1ccc(N2CCC(NC[C@H](O)CCOC(C)C)CC2)cc1	ZINC000819002437	EE	On-Demand	Clean	ADRB2	19	41
COc1ccc(N2CCC(NC[C@H](O)CCOC(C)C)CC2)cc1	ZINC000819002437	EE	On-Demand	Clean	ADRB3	25	45
COc1ccc(N2CCC(NC[C@@H](O)CCOC(C)C)CC2)cc1	ZINC000819002438	EE	On-Demand	Clean	ADRB2	19	41
COc1ccc(N2CCC(NC[C@@H](O)CCOC(C)C)CC2)cc1	ZINC000819002438	EE	On-Demand	Clean	ADRB3	25	45
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1cccnc1	ZINC000819002458	DF	On-Demand	Anodyne	ADRB2	31	43
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1cccnc1	ZINC000819002458	DF	On-Demand	Anodyne	ADRB1	38	50
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1cccnc1	ZINC000819002458	DF	On-Demand	Anodyne	ADRB3	100	50
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1cccnc1	ZINC000819002458	DF	On-Demand	Anodyne	PDS	53	35
O[C@H](CNCc1cccc(OCC(F)F)c1)c1cccnc1	ZINC000819002460	DF	On-Demand	Anodyne	ADRB2	31	43
O[C@H](CNCc1cccc(OCC(F)F)c1)c1cccnc1	ZINC000819002460	DF	On-Demand	Anodyne	ADRB1	38	50
O[C@H](CNCc1cccc(OCC(F)F)c1)c1cccnc1	ZINC000819002460	DF	On-Demand	Anodyne	ADRB3	100	50
O[C@H](CNCc1cccc(OCC(F)F)c1)c1cccnc1	ZINC000819002460	DF	On-Demand	Anodyne	PDS	53	35
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002461	FE	On-Demand	Reactive	HTR1A	69	48
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002461	FE	On-Demand	Reactive	DRD2	39	47
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002461	FE	On-Demand	Reactive	DRD4	31	40
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002461	FE	On-Demand	Reactive	HTR2A	38	44
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002461	FE	On-Demand	Reactive	DRD3	39	47
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002461	FE	On-Demand	Reactive	HTR7	82	44
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002461	FE	On-Demand	Reactive	SIGMAR1	16	42
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002463	FE	On-Demand	Reactive	HTR1A	69	48
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002463	FE	On-Demand	Reactive	DRD2	39	47
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002463	FE	On-Demand	Reactive	DRD4	31	40
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002463	FE	On-Demand	Reactive	HTR2A	38	44
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002463	FE	On-Demand	Reactive	DRD3	39	47
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002463	FE	On-Demand	Reactive	HTR7	82	44
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002463	FE	On-Demand	Reactive	SIGMAR1	16	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000819002466	FD	On-Demand	Anodyne	ADRB2	41	45
COC(=O)N1CCC[C@H](NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000819002466	FD	On-Demand	Anodyne	ADRB1	40	45
COC(=O)N1CCC[C@H](NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000819002466	FD	On-Demand	Anodyne	ADRB3	31	44
COC(=O)N1CCC[C@H](NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000819002466	FD	On-Demand	Anodyne	ABCB1	26	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000819002468	FD	On-Demand	Anodyne	ADRB2	41	45
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000819002468	FD	On-Demand	Anodyne	ADRB1	40	45
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000819002468	FD	On-Demand	Anodyne	ADRB3	31	44
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000819002468	FD	On-Demand	Anodyne	ABCB1	26	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000819002470	FD	On-Demand	Anodyne	ADRB2	41	45
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000819002470	FD	On-Demand	Anodyne	ADRB1	40	45
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000819002470	FD	On-Demand	Anodyne	ADRB3	31	44
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000819002470	FD	On-Demand	Anodyne	ABCB1	26	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000819002473	FD	On-Demand	Anodyne	ADRB2	41	45
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000819002473	FD	On-Demand	Anodyne	ADRB1	40	45
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000819002473	FD	On-Demand	Anodyne	ADRB3	31	44
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000819002473	FD	On-Demand	Anodyne	ABCB1	26	42
O[C@H](CNCCn1cncn1)c1ccc(OC(F)(F)F)cc1	ZINC000819002477	DD	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CNCCn1cncn1)c1ccc(OC(F)(F)F)cc1	ZINC000819002477	DD	On-Demand	Anodyne	ADRB3	22	45
O[C@@H](CNCCn1cncn1)c1ccc(OC(F)(F)F)cc1	ZINC000819002478	DD	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CNCCn1cncn1)c1ccc(OC(F)(F)F)cc1	ZINC000819002478	DD	On-Demand	Anodyne	ADRB3	22	45
COc1ccc(OC)c([C@H](O)CNCCc2coc(-c3ccc(C)cc3)n2)c1	ZINC000819002500	GH	On-Demand	Anodyne	ADRB2	19	44
COC(=O)N1CCC[C@H](NC[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000819002505	DD	On-Demand	Anodyne	SLC6A3	15	40
COC(=O)N1CCC[C@H](NC[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000819002505	DD	On-Demand	Anodyne	DPP4	19	40
COC(=O)N1CCC[C@H](NC[C@H](O)[C@@H](C)c2ccccc2)C1	ZINC000819002505	DD	On-Demand	Anodyne	BIRC2	33	43
COC(=O)N1CCC[C@H](NC[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000819002507	DD	On-Demand	Anodyne	SLC6A3	15	40
COC(=O)N1CCC[C@H](NC[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000819002507	DD	On-Demand	Anodyne	DPP4	19	40
COC(=O)N1CCC[C@H](NC[C@@H](O)[C@@H](C)c2ccccc2)C1	ZINC000819002507	DD	On-Demand	Anodyne	BIRC2	33	43
COC(=O)N1CCC[C@H](NC[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000819002509	DD	On-Demand	Anodyne	SLC6A3	15	40
COC(=O)N1CCC[C@H](NC[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000819002509	DD	On-Demand	Anodyne	DPP4	19	40
COC(=O)N1CCC[C@H](NC[C@H](O)[C@H](C)c2ccccc2)C1	ZINC000819002509	DD	On-Demand	Anodyne	BIRC2	33	43
COC(=O)N1CCC[C@H](NC[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000819002511	DD	On-Demand	Anodyne	SLC6A3	15	40
COC(=O)N1CCC[C@H](NC[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000819002511	DD	On-Demand	Anodyne	DPP4	19	40
COC(=O)N1CCC[C@H](NC[C@@H](O)[C@H](C)c2ccccc2)C1	ZINC000819002511	DD	On-Demand	Anodyne	BIRC2	33	43
O=[N+]([O-])c1cccc([C@@H](O)CNCc2cccc(OCC(F)F)c2)c1	ZINC000819002514	FG	On-Demand	Bother	ADRB1	21	40
O=[N+]([O-])c1cccc([C@@H](O)CNCc2cccc(OCC(F)F)c2)c1	ZINC000819002514	FG	On-Demand	Bother	ADRB3	23	40
O=[N+]([O-])c1cccc([C@@H](O)CNCc2cccc(OCC(F)F)c2)c1	ZINC000819002514	FG	On-Demand	Bother	ACR	15	42
O=[N+]([O-])c1cccc([C@@H](O)CNCc2cccc(OCC(F)F)c2)c1	ZINC000819002514	FG	On-Demand	Bother	PDS	54	47
O=[N+]([O-])c1cccc([C@H](O)CNCc2cccc(OCC(F)F)c2)c1	ZINC000819002515	FG	On-Demand	Bother	ADRB1	21	40
O=[N+]([O-])c1cccc([C@H](O)CNCc2cccc(OCC(F)F)c2)c1	ZINC000819002515	FG	On-Demand	Bother	ADRB3	23	40
O=[N+]([O-])c1cccc([C@H](O)CNCc2cccc(OCC(F)F)c2)c1	ZINC000819002515	FG	On-Demand	Bother	ACR	15	42
O=[N+]([O-])c1cccc([C@H](O)CNCc2cccc(OCC(F)F)c2)c1	ZINC000819002515	FG	On-Demand	Bother	PDS	54	47
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819002519	FE	On-Demand	Anodyne	ADRB2	52	53
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819002519	FE	On-Demand	Anodyne	ADRB1	49	53
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819002519	FE	On-Demand	Anodyne	ADRB3	35	53
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819002519	FE	On-Demand	Anodyne	CYP2D6	20	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819002519	FE	On-Demand	Anodyne	ABCB1	52	45
C[C@@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)n1cccn1	ZINC000819002520	GD	On-Demand	Reactive	HTR1A	76	46
C[C@@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)n1cccn1	ZINC000819002520	GD	On-Demand	Reactive	DRD2	51	41
C[C@@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)n1cccn1	ZINC000819002520	GD	On-Demand	Reactive	DRD4	60	43
C[C@@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)n1cccn1	ZINC000819002520	GD	On-Demand	Reactive	HTR2A	35	41
C[C@@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)n1cccn1	ZINC000819002520	GD	On-Demand	Reactive	ADRA1A	21	42
C[C@@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)n1cccn1	ZINC000819002520	GD	On-Demand	Reactive	DRD3	56	41
C[C@@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)n1cccn1	ZINC000819002520	GD	On-Demand	Reactive	HTR7	86	45
C[C@@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)n1cccn1	ZINC000819002520	GD	On-Demand	Reactive	PRNP	41	35
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819002521	FE	On-Demand	Anodyne	ADRB2	52	53
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819002521	FE	On-Demand	Anodyne	ADRB1	49	53
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819002521	FE	On-Demand	Anodyne	ADRB3	35	53
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819002521	FE	On-Demand	Anodyne	CYP2D6	20	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819002521	FE	On-Demand	Anodyne	ABCB1	52	45
C[C@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)n1cccn1	ZINC000819002522	GD	On-Demand	Reactive	HTR1A	76	46
C[C@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)n1cccn1	ZINC000819002522	GD	On-Demand	Reactive	DRD2	51	41
C[C@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)n1cccn1	ZINC000819002522	GD	On-Demand	Reactive	DRD4	60	43
C[C@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)n1cccn1	ZINC000819002522	GD	On-Demand	Reactive	HTR2A	35	41
C[C@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)n1cccn1	ZINC000819002522	GD	On-Demand	Reactive	ADRA1A	21	42
C[C@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)n1cccn1	ZINC000819002522	GD	On-Demand	Reactive	DRD3	56	41
C[C@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)n1cccn1	ZINC000819002522	GD	On-Demand	Reactive	HTR7	86	45
C[C@H](CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)n1cccn1	ZINC000819002522	GD	On-Demand	Reactive	PRNP	41	35
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819002526	FE	On-Demand	Anodyne	ADRB2	52	53
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819002526	FE	On-Demand	Anodyne	ADRB1	49	53
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819002526	FE	On-Demand	Anodyne	ADRB3	35	53
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819002526	FE	On-Demand	Anodyne	CYP2D6	20	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819002526	FE	On-Demand	Anodyne	ABCB1	52	45
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819002528	FE	On-Demand	Anodyne	ADRB2	52	53
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819002528	FE	On-Demand	Anodyne	ADRB1	49	53
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819002528	FE	On-Demand	Anodyne	ADRB3	35	53
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819002528	FE	On-Demand	Anodyne	CYP2D6	20	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819002528	FE	On-Demand	Anodyne	ABCB1	52	45
O[C@H](CN[C@H](c1ccccc1)[C@@H]1CCCO1)c1cccnc1	ZINC000819002536	CF	On-Demand	Anodyne	ADRB1	19	44
O[C@H](CN[C@H](c1ccccc1)[C@@H]1CCCO1)c1cccnc1	ZINC000819002536	CF	On-Demand	Anodyne	ADRB3	67	44
O[C@H](CN[C@@H](c1ccccc1)[C@H]1CCCO1)c1cccnc1	ZINC000819002538	CF	On-Demand	Anodyne	ADRB1	19	44
O[C@H](CN[C@@H](c1ccccc1)[C@H]1CCCO1)c1cccnc1	ZINC000819002538	CF	On-Demand	Anodyne	ADRB3	67	44
O[C@H](CN[C@H](c1ccccc1)[C@H]1CCCO1)c1cccnc1	ZINC000819002540	CF	On-Demand	Anodyne	ADRB1	19	44
O[C@H](CN[C@H](c1ccccc1)[C@H]1CCCO1)c1cccnc1	ZINC000819002540	CF	On-Demand	Anodyne	ADRB3	67	44
O[C@H](CN[C@@H](c1ccccc1)[C@@H]1CCCO1)c1cccnc1	ZINC000819002541	CF	On-Demand	Anodyne	ADRB1	19	44
O[C@H](CN[C@@H](c1ccccc1)[C@@H]1CCCO1)c1cccnc1	ZINC000819002541	CF	On-Demand	Anodyne	ADRB3	67	44
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)cn1	ZINC000819002551	EF	On-Demand	Anodyne	PDS	45	38
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)cn1	ZINC000819002552	EF	On-Demand	Anodyne	PDS	45	38
COC(=O)N1CCC[C@@H](NC[C@H](O)CN2CCc3ccccc3C2)C1	ZINC000819002568	ED	On-Demand	Anodyne	NOD2	40	35
O=C(/C=C/[C@H]1CCCO1)Nc1ccccc1N1CCCCC1	ZINC000819002569	DG	On-Demand	Anodyne	KCNQ2	83	45
COC(=O)N1CCC[C@@H](NC[C@@H](O)CN2CCc3ccccc3C2)C1	ZINC000819002570	ED	On-Demand	Anodyne	NOD2	40	35
O=C(/C=C\[C@H]1CCCO1)Nc1ccccc1N1CCCCC1	ZINC000819002571	DG	On-Demand	Anodyne	KCNQ2	83	45
COC(=O)N1CCC[C@H](NC[C@H](O)CN2CCc3ccccc3C2)C1	ZINC000819002572	ED	On-Demand	Anodyne	NOD2	40	35
O=C(/C=C/[C@@H]1CCCO1)Nc1ccccc1N1CCCCC1	ZINC000819002573	DG	On-Demand	Anodyne	KCNQ2	83	45
COC(=O)N1CCC[C@H](NC[C@@H](O)CN2CCc3ccccc3C2)C1	ZINC000819002574	ED	On-Demand	Anodyne	NOD2	40	35
O=C(/C=C\[C@@H]1CCCO1)Nc1ccccc1N1CCCCC1	ZINC000819002575	DG	On-Demand	Anodyne	KCNQ2	83	45
COC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819002576	FD	On-Demand	Anodyne	ADRB1	36	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819002576	FD	On-Demand	Anodyne	ADRB3	29	47
COC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819002578	FD	On-Demand	Anodyne	ADRB1	36	42
COC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819002578	FD	On-Demand	Anodyne	ADRB3	29	47
COC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819002579	FD	On-Demand	Anodyne	ADRB1	36	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819002579	FD	On-Demand	Anodyne	ADRB3	29	47
COC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819002580	FD	On-Demand	Anodyne	ADRB1	36	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819002580	FD	On-Demand	Anodyne	ADRB3	29	47
COC(=O)N1CCC[C@@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819002586	GD	On-Demand	Anodyne	GPR119	28	40
C=CCCn1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)nn1	ZINC000819002587	GC	On-Demand	Reactive	HTR1A	25	42
C=CCCn1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)nn1	ZINC000819002587	GC	On-Demand	Reactive	HTR2A	16	40
C=CCCn1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)nn1	ZINC000819002587	GC	On-Demand	Reactive	DRD3	20	40
C=CCCn1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)nn1	ZINC000819002587	GC	On-Demand	Reactive	HTR7	37	40
COC(=O)N1CCC[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819002588	GD	On-Demand	Anodyne	GPR119	28	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819002589	GD	On-Demand	Anodyne	GPR119	28	40
COC(=O)N1CCC[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819002590	GD	On-Demand	Anodyne	GPR119	28	40
O=C(/C=C/[C@H]1CCCO1)NCCCc1ccccc1	ZINC000819002614	CE	On-Demand	Anodyne	FKBP1A	17	41
O=C(/C=C/[C@H]1CCCO1)NCCCc1ccccc1	ZINC000819002614	CE	On-Demand	Anodyne	CRTM	25	41
O=C(/C=C\[C@H]1CCCO1)NCCCc1ccccc1	ZINC000819002615	CE	On-Demand	Anodyne	FKBP1A	17	41
O=C(/C=C\[C@H]1CCCO1)NCCCc1ccccc1	ZINC000819002615	CE	On-Demand	Anodyne	CRTM	25	41
O=C(/C=C/[C@@H]1CCCO1)NCCCc1ccccc1	ZINC000819002616	CE	On-Demand	Anodyne	FKBP1A	17	41
O=C(/C=C/[C@@H]1CCCO1)NCCCc1ccccc1	ZINC000819002616	CE	On-Demand	Anodyne	CRTM	25	41
O=C(/C=C\[C@@H]1CCCO1)NCCCc1ccccc1	ZINC000819002618	CE	On-Demand	Anodyne	FKBP1A	17	41
O=C(/C=C\[C@@H]1CCCO1)NCCCc1ccccc1	ZINC000819002618	CE	On-Demand	Anodyne	CRTM	25	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccccc1N1CCCCC1)C2	ZINC000819002619	FG	On-Demand	Anodyne	KCNQ2	82	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccccc1N1CCCCC1)C2	ZINC000819002622	FG	On-Demand	Anodyne	KCNQ2	82	46
O=C(Cc1ccc(-n2cnnc2)cc1)NNC(=O)C1CC1	ZINC000819002630	CC	On-Demand	Reactive	HTR1D	52	38
O=C(Cc1ccc(-n2cnnc2)cc1)NNC(=O)C1CC1	ZINC000819002630	CC	On-Demand	Reactive	HTR1B	44	38
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cc(C)cc(C)c2)C1	ZINC000819002631	ED	On-Demand	Anodyne	ADRB2	28	50
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cc(C)cc(C)c2)C1	ZINC000819002631	ED	On-Demand	Anodyne	ADRB3	24	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cc(C)cc(C)c2)C1	ZINC000819002631	ED	On-Demand	Anodyne	ACOX1	43	32
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cc(C)cc(C)c2)C1	ZINC000819002632	ED	On-Demand	Anodyne	ADRB2	28	50
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cc(C)cc(C)c2)C1	ZINC000819002632	ED	On-Demand	Anodyne	ADRB3	24	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cc(C)cc(C)c2)C1	ZINC000819002632	ED	On-Demand	Anodyne	ACOX1	43	32
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cc(C)cc(C)c2)C1	ZINC000819002633	ED	On-Demand	Anodyne	ADRB2	28	50
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cc(C)cc(C)c2)C1	ZINC000819002633	ED	On-Demand	Anodyne	ADRB3	24	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cc(C)cc(C)c2)C1	ZINC000819002633	ED	On-Demand	Anodyne	ACOX1	43	32
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cc(C)cc(C)c2)C1	ZINC000819002634	ED	On-Demand	Anodyne	ADRB2	28	50
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cc(C)cc(C)c2)C1	ZINC000819002634	ED	On-Demand	Anodyne	ADRB3	24	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cc(C)cc(C)c2)C1	ZINC000819002634	ED	On-Demand	Anodyne	ACOX1	43	32
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819002635	DD	On-Demand	Anodyne	ADRB2	61	48
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819002635	DD	On-Demand	Anodyne	ADRB1	82	46
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819002635	DD	On-Demand	Anodyne	ADRB3	68	46
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819002635	DD	On-Demand	Anodyne	ACOX1	46	34
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819002635	DD	On-Demand	Anodyne	CPT1A	31	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819002635	DD	On-Demand	Anodyne	ABCB1	44	44
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819002635	DD	On-Demand	Anodyne	BIRC2	20	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819002636	DD	On-Demand	Anodyne	ADRB2	61	48
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819002636	DD	On-Demand	Anodyne	ADRB1	82	46
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819002636	DD	On-Demand	Anodyne	ADRB3	68	46
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819002636	DD	On-Demand	Anodyne	ACOX1	46	34
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819002636	DD	On-Demand	Anodyne	CPT1A	31	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819002636	DD	On-Demand	Anodyne	ABCB1	44	44
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819002636	DD	On-Demand	Anodyne	BIRC2	20	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819002637	DD	On-Demand	Anodyne	ADRB2	61	48
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819002637	DD	On-Demand	Anodyne	ADRB1	82	46
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819002637	DD	On-Demand	Anodyne	ADRB3	68	46
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819002637	DD	On-Demand	Anodyne	ACOX1	46	34
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819002637	DD	On-Demand	Anodyne	CPT1A	31	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819002637	DD	On-Demand	Anodyne	ABCB1	44	44
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819002637	DD	On-Demand	Anodyne	BIRC2	20	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819002638	DD	On-Demand	Anodyne	ADRB2	61	48
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819002638	DD	On-Demand	Anodyne	ADRB1	82	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819002638	DD	On-Demand	Anodyne	ADRB3	68	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819002638	DD	On-Demand	Anodyne	ACOX1	46	34
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819002638	DD	On-Demand	Anodyne	CPT1A	31	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819002638	DD	On-Demand	Anodyne	ABCB1	44	44
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819002638	DD	On-Demand	Anodyne	BIRC2	20	41
COCCc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002641	FD	On-Demand	Anodyne	ADRB2	51	55
COCCc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002641	FD	On-Demand	Anodyne	ADRB1	82	55
COCCc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002641	FD	On-Demand	Anodyne	ADRB3	61	45
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002642	FD	On-Demand	Anodyne	ADRB2	51	55
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002642	FD	On-Demand	Anodyne	ADRB1	82	55
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002642	FD	On-Demand	Anodyne	ADRB3	61	45
COCCc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002643	FD	On-Demand	Anodyne	ADRB2	51	55
COCCc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002643	FD	On-Demand	Anodyne	ADRB1	82	55
COCCc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002643	FD	On-Demand	Anodyne	ADRB3	61	45
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819002654	GH	On-Demand	Mild	PAPA1_CARPA	38	42
Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819002655	GH	On-Demand	Mild	PAPA1_CARPA	38	42
C[C@@H]1CCCCN1C(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819002660	GF	On-Demand	Anodyne	PREP	16	40
C[C@H]1CCCCN1C(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819002661	GF	On-Demand	Anodyne	PREP	16	40
C[C@@H]1CCCCN1C(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819002662	GF	On-Demand	Anodyne	PREP	16	40
C[C@H]1CCCCN1C(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819002663	GF	On-Demand	Anodyne	PREP	16	40
COc1ccc(N2CCC(NC[C@H](O)CN3CCN(C)CC3)CC2)cc1	ZINC000819002672	FC	On-Demand	Clean	ADRB2	18	43
COc1ccc(N2CCC(NC[C@H](O)CN3CCN(C)CC3)CC2)cc1	ZINC000819002672	FC	On-Demand	Clean	ADRB1	16	43
COc1ccc(N2CCC(NC[C@H](O)CN3CCN(C)CC3)CC2)cc1	ZINC000819002672	FC	On-Demand	Clean	ADRB3	23	44
COc1ccc(N2CCC(NC[C@@H](O)CN3CCN(C)CC3)CC2)cc1	ZINC000819002673	FC	On-Demand	Clean	ADRB2	18	43
COc1ccc(N2CCC(NC[C@@H](O)CN3CCN(C)CC3)CC2)cc1	ZINC000819002673	FC	On-Demand	Clean	ADRB1	16	43
COc1ccc(N2CCC(NC[C@@H](O)CN3CCN(C)CC3)CC2)cc1	ZINC000819002673	FC	On-Demand	Clean	ADRB3	23	44
COc1ccc(N2CCC(NC[C@H](O)Cn3cccn3)CC2)cc1	ZINC000819002678	ED	On-Demand	Clean	ADRB2	17	43
COc1ccc(N2CCC(NC[C@H](O)Cn3cccn3)CC2)cc1	ZINC000819002678	ED	On-Demand	Clean	ADRB3	24	43
COc1ccc(N2CCC(NC[C@@H](O)Cn3cccn3)CC2)cc1	ZINC000819002679	ED	On-Demand	Clean	ADRB2	17	43
COc1ccc(N2CCC(NC[C@@H](O)Cn3cccn3)CC2)cc1	ZINC000819002679	ED	On-Demand	Clean	ADRB3	24	43
COc1ccc(N2CCC(NC[C@@H](O)Cc3ccc4ccccc4c3)CC2)cc1	ZINC000819002680	GI	On-Demand	Clean	ADRB2	31	43
COc1ccc(N2CCC(NC[C@@H](O)Cc3ccc4ccccc4c3)CC2)cc1	ZINC000819002680	GI	On-Demand	Clean	ADRB1	22	41
COc1ccc(N2CCC(NC[C@@H](O)Cc3ccc4ccccc4c3)CC2)cc1	ZINC000819002680	GI	On-Demand	Clean	ADRB3	35	46
COc1ccc(N2CCC(NC[C@@H](O)Cc3ccc4ccccc4c3)CC2)cc1	ZINC000819002680	GI	On-Demand	Clean	CASR	39	40
COc1ccc(N2CCC(NC[C@H](O)Cc3ccc4ccccc4c3)CC2)cc1	ZINC000819002681	GI	On-Demand	Clean	ADRB2	31	43
COc1ccc(N2CCC(NC[C@H](O)Cc3ccc4ccccc4c3)CC2)cc1	ZINC000819002681	GI	On-Demand	Clean	ADRB1	22	41
COc1ccc(N2CCC(NC[C@H](O)Cc3ccc4ccccc4c3)CC2)cc1	ZINC000819002681	GI	On-Demand	Clean	ADRB3	35	46
COc1ccc(N2CCC(NC[C@H](O)Cc3ccc4ccccc4c3)CC2)cc1	ZINC000819002681	GI	On-Demand	Clean	CASR	39	40
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(F)cc1F	ZINC000819002682	GH	On-Demand	Clean	ADRB3	23	43
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(F)cc1F	ZINC000819002683	GH	On-Demand	Clean	ADRB3	23	43
CC(C)(C)N1CC[C@@H](OC(=O)c2cccnc2)C1=O	ZINC000819002685	CD	On-Demand	Anodyne	GLRA1	31	52
CC(C)(C)N1CC[C@H](OC(=O)c2cccnc2)C1=O	ZINC000819002686	CD	On-Demand	Anodyne	GLRA1	31	52
COc1ccc(N2CCC(NC[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)cc1	ZINC000819002688	FF	On-Demand	Clean	ADRB2	17	43
COc1ccc(N2CCC(NC[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)cc1	ZINC000819002688	FF	On-Demand	Clean	ADRB1	21	41
COc1ccc(N2CCC(NC[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)cc1	ZINC000819002688	FF	On-Demand	Clean	ADRB3	42	46
COc1ccc(N2CCC(NC[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)cc1	ZINC000819002688	FF	On-Demand	Clean	CACNA1D	40	36
COc1ccc(N2CCC(NC[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)cc1	ZINC000819002688	FF	On-Demand	Clean	CYP3A4	45	35
COc1ccc(N2CCC(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)cc1	ZINC000819002689	FF	On-Demand	Clean	ADRB2	17	43
COc1ccc(N2CCC(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)cc1	ZINC000819002689	FF	On-Demand	Clean	ADRB1	21	41
COc1ccc(N2CCC(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)cc1	ZINC000819002689	FF	On-Demand	Clean	ADRB3	42	46
COc1ccc(N2CCC(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)cc1	ZINC000819002689	FF	On-Demand	Clean	CACNA1D	40	36
COc1ccc(N2CCC(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)cc1	ZINC000819002689	FF	On-Demand	Clean	CYP3A4	45	35
Cc1ccccc1[C@@H](O)CNCCc1cccc(C(N)=O)c1	ZINC000819002720	CD	On-Demand	Anodyne	ADRB2	83	48
Cc1ccccc1[C@@H](O)CNCCc1cccc(C(N)=O)c1	ZINC000819002720	CD	On-Demand	Anodyne	ADRB1	73	43
Cc1ccccc1[C@@H](O)CNCCc1cccc(C(N)=O)c1	ZINC000819002720	CD	On-Demand	Anodyne	ADRB3	69	44
N#Cc1ccc([C@@H](O)CNCC(=O)N2CCc3ccccc3C2)cc1	ZINC000819002724	ED	On-Demand	Mild	DPP8	22	45
C=C(C)C(C)(C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002727	FD	On-Demand	Reactive	HTR1A	56	50
C=C(C)C(C)(C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002727	FD	On-Demand	Reactive	DRD2	34	47
C=C(C)C(C)(C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002727	FD	On-Demand	Reactive	DRD4	29	41
C=C(C)C(C)(C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002727	FD	On-Demand	Reactive	HTR2A	32	45
C=C(C)C(C)(C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002727	FD	On-Demand	Reactive	DRD3	37	47
C=C(C)C(C)(C)C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819002727	FD	On-Demand	Reactive	HTR7	74	44
N#Cc1ccc([C@H](O)CNCC(=O)N2CCc3ccccc3C2)cc1	ZINC000819002728	ED	On-Demand	Mild	DPP8	22	45
CO[C@@H](C)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819002729	CE	On-Demand	Anodyne	ADRB2	55	45
CO[C@@H](C)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819002729	CE	On-Demand	Anodyne	ADRB1	63	50
CO[C@@H](C)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819002729	CE	On-Demand	Anodyne	ADRB3	81	50
CO[C@@H](C)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819002731	CE	On-Demand	Anodyne	ADRB2	55	45
CO[C@@H](C)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819002731	CE	On-Demand	Anodyne	ADRB1	63	50
CO[C@@H](C)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819002731	CE	On-Demand	Anodyne	ADRB3	81	50
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(F)=C1CCC1	ZINC000819002736	FD	On-Demand	Reactive	HTR1A	61	50
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(F)=C1CCC1	ZINC000819002736	FD	On-Demand	Reactive	DRD2	37	48
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(F)=C1CCC1	ZINC000819002736	FD	On-Demand	Reactive	HTR2A	34	45
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(F)=C1CCC1	ZINC000819002736	FD	On-Demand	Reactive	DRD3	39	40
O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C(F)=C1CCC1	ZINC000819002736	FD	On-Demand	Reactive	HTR7	81	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(Cl)cc1Cl)C2	ZINC000819002737	FG	On-Demand	Anodyne	P2RX7	103	51
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(Cl)cc1Cl)C2	ZINC000819002737	FG	On-Demand	Anodyne	EPHX2	19	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(Cl)cc1Cl)C2	ZINC000819002738	FG	On-Demand	Anodyne	P2RX7	103	51
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(Cl)cc1Cl)C2	ZINC000819002738	FG	On-Demand	Anodyne	EPHX2	19	46
O=C(C(F)=C1CCC1)N1CCN(c2ccccn2)CC1	ZINC000819002739	CE	On-Demand	Anodyne	DRD4	25	40
CON(C)C(=O)CCNCC(=O)N1CCc2ccccc2C1	ZINC000819002740	DC	On-Demand	Anodyne	DPP8	23	46
Cc1cc(OCc2cccc(C#N)c2)ccc1N[C@H]1CCN(C(C)(C)C)C1=O	ZINC000819002746	GI	On-Demand	Mild	MAOB	27	45
Cc1cc(OCc2cccc(C#N)c2)ccc1N[C@@H]1CCN(C(C)(C)C)C1=O	ZINC000819002749	GI	On-Demand	Mild	MAOB	27	45
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(Cl)c1	ZINC000819002756	GI	On-Demand	Clean	ADRB2	23	43
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(Cl)c1	ZINC000819002756	GI	On-Demand	Clean	ADRB1	45	46
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(Cl)c1	ZINC000819002756	GI	On-Demand	Clean	ADRB3	72	48
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(Cl)c1	ZINC000819002756	GI	On-Demand	Clean	IGF1R	30	43
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(Cl)c1	ZINC000819002756	GI	On-Demand	Clean	CYP3A4	55	43
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(Cl)c1	ZINC000819002757	GI	On-Demand	Clean	ADRB2	23	43
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(Cl)c1	ZINC000819002757	GI	On-Demand	Clean	ADRB1	45	46
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(Cl)c1	ZINC000819002757	GI	On-Demand	Clean	ADRB3	72	48
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(Cl)c1	ZINC000819002757	GI	On-Demand	Clean	IGF1R	30	43
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1cccc(Cl)c1	ZINC000819002757	GI	On-Demand	Clean	CYP3A4	55	43
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000819002799	DI	On-Demand	Anodyne	RAF1	25	43
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000819002800	DI	On-Demand	Anodyne	RAF1	25	43
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000819002801	DI	On-Demand	Anodyne	RAF1	25	43
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000819002802	DI	On-Demand	Anodyne	RAF1	25	43
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)C1CCCCC1	ZINC000819002894	FH	On-Demand	Clean	ADRB3	17	40
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)C1CCCCC1	ZINC000819002895	FH	On-Demand	Clean	ADRB3	17	40
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002898	FD	On-Demand	Anodyne	ADRB2	51	55
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002898	FD	On-Demand	Anodyne	ADRB1	82	55
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)cc1	ZINC000819002898	FD	On-Demand	Anodyne	ADRB3	61	45
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(CC#N)cc3)CC2)cc1	ZINC000819002910	GF	On-Demand	Mild	ADRB2	40	49
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(CC#N)cc3)CC2)cc1	ZINC000819002910	GF	On-Demand	Mild	ADRB1	48	45
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(CC#N)cc3)CC2)cc1	ZINC000819002910	GF	On-Demand	Mild	ADRB3	44	57
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(CC#N)cc3)CC2)cc1	ZINC000819002913	GF	On-Demand	Mild	ADRB2	40	49
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(CC#N)cc3)CC2)cc1	ZINC000819002913	GF	On-Demand	Mild	ADRB1	48	45
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(CC#N)cc3)CC2)cc1	ZINC000819002913	GF	On-Demand	Mild	ADRB3	44	57
O=C(CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)N1CCc2ccccc2C1	ZINC000819002915	GF	On-Demand	Anodyne	ADRB3	16	40
O=C(CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)N1CCc2ccccc2C1	ZINC000819002915	GF	On-Demand	Anodyne	DPP8	19	42
O=C(CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)N1CCc2ccccc2C1	ZINC000819002915	GF	On-Demand	Anodyne	NOD2	34	46
O=C(CNC[C@H](O)c1ccc(OC(F)(F)F)cc1)N1CCc2ccccc2C1	ZINC000819002916	GF	On-Demand	Anodyne	ADRB3	16	40
O=C(CNC[C@H](O)c1ccc(OC(F)(F)F)cc1)N1CCc2ccccc2C1	ZINC000819002916	GF	On-Demand	Anodyne	DPP8	19	42
O=C(CNC[C@H](O)c1ccc(OC(F)(F)F)cc1)N1CCc2ccccc2C1	ZINC000819002916	GF	On-Demand	Anodyne	NOD2	34	46
CC(=O)c1ccc(N2CCN(C(=O)Cc3nc(-c4ccccc4)oc3C)CC2)c(F)c1	ZINC000819002919	HH	On-Demand	Anodyne	PPARG	75	40
CC(=O)c1ccc(N2CCN(C(=O)Cc3nc(-c4ccccc4)oc3C)CC2)c(F)c1	ZINC000819002919	HH	On-Demand	Anodyne	PPARA	81	40
CC(=O)c1ccc(N2CCN(C(=O)Cc3nc(-c4ccccc4)oc3C)CC2)c(F)c1	ZINC000819002919	HH	On-Demand	Anodyne	NPY2R	80	38
CC(=O)c1ccc(N2CCN(C(=O)Cc3nc(-c4ccccc4)oc3C)CC2)c(F)c1	ZINC000819002919	HH	On-Demand	Anodyne	SLC6A9	20	50
CC(=O)c1ccc(N2CCN(C(=O)Cc3nc(-c4ccccc4)oc3C)CC2)c(F)c1	ZINC000819002919	HH	On-Demand	Anodyne	PDE8B	60	36
NC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819002925	DD	On-Demand	Anodyne	ADRB2	33	43
NC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819002925	DD	On-Demand	Anodyne	ADRB1	43	42
NC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819002925	DD	On-Demand	Anodyne	ADRB3	66	43
NC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819002927	DD	On-Demand	Anodyne	ADRB2	33	43
NC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819002927	DD	On-Demand	Anodyne	ADRB1	43	42
NC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819002927	DD	On-Demand	Anodyne	ADRB3	66	43
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2C)C1	ZINC000819002930	DD	On-Demand	Anodyne	ADRB2	49	51
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2C)C1	ZINC000819002930	DD	On-Demand	Anodyne	ADRB1	46	50
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2C)C1	ZINC000819002930	DD	On-Demand	Anodyne	ADRB3	32	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2C)C1	ZINC000819002930	DD	On-Demand	Anodyne	ABCB1	65	46
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2C)C1	ZINC000819002930	DD	On-Demand	Anodyne	CCR8	50	36
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2C)C1	ZINC000819002931	DD	On-Demand	Anodyne	ADRB2	49	51
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2C)C1	ZINC000819002931	DD	On-Demand	Anodyne	ADRB1	46	50
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2C)C1	ZINC000819002931	DD	On-Demand	Anodyne	ADRB3	32	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2C)C1	ZINC000819002931	DD	On-Demand	Anodyne	ABCB1	65	46
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2C)C1	ZINC000819002931	DD	On-Demand	Anodyne	CCR8	50	36
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2C)C1	ZINC000819002935	DD	On-Demand	Anodyne	ADRB2	49	51
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2C)C1	ZINC000819002935	DD	On-Demand	Anodyne	ADRB1	46	50
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2C)C1	ZINC000819002935	DD	On-Demand	Anodyne	ADRB3	32	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2C)C1	ZINC000819002935	DD	On-Demand	Anodyne	ABCB1	65	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2C)C1	ZINC000819002935	DD	On-Demand	Anodyne	CCR8	50	36
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2C)C1	ZINC000819002938	DD	On-Demand	Anodyne	ADRB2	49	51
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2C)C1	ZINC000819002938	DD	On-Demand	Anodyne	ADRB1	46	50
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2C)C1	ZINC000819002938	DD	On-Demand	Anodyne	ADRB3	32	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2C)C1	ZINC000819002938	DD	On-Demand	Anodyne	ABCB1	65	46
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2C)C1	ZINC000819002938	DD	On-Demand	Anodyne	CCR8	50	36
COC(=O)N1CCC[C@H](NCCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000819002947	EE	On-Demand	Anodyne	EPHX2	29	42
COC(=O)N1CCC[C@H](NCCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000819002947	EE	On-Demand	Anodyne	MCHR1	15	41
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(F)cc1	ZINC000819002948	GH	On-Demand	Clean	ADRB1	15	40
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(F)cc1	ZINC000819002948	GH	On-Demand	Clean	SLC6A3	15	42
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(F)cc1	ZINC000819002948	GH	On-Demand	Clean	ADRB3	29	44
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(F)cc1	ZINC000819002949	GH	On-Demand	Clean	ADRB1	15	40
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(F)cc1	ZINC000819002949	GH	On-Demand	Clean	SLC6A3	15	42
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(F)cc1	ZINC000819002949	GH	On-Demand	Clean	ADRB3	29	44
COc1ccc(N2CCC(NC[C@@H](O)c3cc4ccccc4o3)CC2)cc1	ZINC000819002950	FH	On-Demand	Clean	ADRB2	18	41
COc1ccc(N2CCC(NC[C@@H](O)c3cc4ccccc4o3)CC2)cc1	ZINC000819002950	FH	On-Demand	Clean	ADRB3	28	41
COC(=O)N1CCC[C@@H](NCCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000819002951	EE	On-Demand	Anodyne	EPHX2	29	42
COC(=O)N1CCC[C@@H](NCCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000819002951	EE	On-Demand	Anodyne	MCHR1	15	41
O=C(CNC[C@H](O)c1ccc(F)cn1)N1CCc2ccccc2C1	ZINC000819002977	ED	On-Demand	Anodyne	DPP8	19	43
O=C(CNC[C@@H](O)c1ccc(F)cn1)N1CCc2ccccc2C1	ZINC000819002979	ED	On-Demand	Anodyne	DPP8	19	43
CC(C)(C)N1CC[C@@H](OC(=O)c2cccc(S(N)(=O)=O)c2)C1=O	ZINC000819002980	EC	On-Demand	Anodyne	AKR1C3	47	37
CC(C)(C)N1CC[C@H](OC(=O)c2cccc(S(N)(=O)=O)c2)C1=O	ZINC000819002982	EC	On-Demand	Anodyne	AKR1C3	47	37
COC[C@@H](C)OC[C@H](O)CNC1CCN(c2ccc(OC)cc2)CC1	ZINC000819002984	FD	On-Demand	Clean	ADRB2	22	44
COC[C@@H](C)OC[C@H](O)CNC1CCN(c2ccc(OC)cc2)CC1	ZINC000819002984	FD	On-Demand	Clean	ADRB1	21	42
COC[C@@H](C)OC[C@H](O)CNC1CCN(c2ccc(OC)cc2)CC1	ZINC000819002984	FD	On-Demand	Clean	ADRB3	27	48
COC[C@@H](C)OC[C@@H](O)CNC1CCN(c2ccc(OC)cc2)CC1	ZINC000819002987	FD	On-Demand	Clean	ADRB2	22	44
COC[C@@H](C)OC[C@@H](O)CNC1CCN(c2ccc(OC)cc2)CC1	ZINC000819002987	FD	On-Demand	Clean	ADRB1	21	42
COC[C@@H](C)OC[C@@H](O)CNC1CCN(c2ccc(OC)cc2)CC1	ZINC000819002987	FD	On-Demand	Clean	ADRB3	27	48
Cc1ccccc1C1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819002995	EG	On-Demand	Bother	CACNA1D	53	34
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819002996	GF	On-Demand	Anodyne	ADRB2	56	46
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819002996	GF	On-Demand	Anodyne	ADRB1	84	44
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819002996	GF	On-Demand	Anodyne	ADRB3	70	46
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819002996	GF	On-Demand	Anodyne	ACOX1	53	40
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819002996	GF	On-Demand	Anodyne	ABCB1	30	41
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819002996	GF	On-Demand	Anodyne	BIRC2	22	41
Cc1ccccc1C1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819002997	EG	On-Demand	Bother	CACNA1D	53	34
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819002999	GF	On-Demand	Anodyne	ADRB2	56	46
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819002999	GF	On-Demand	Anodyne	ADRB1	84	44
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819002999	GF	On-Demand	Anodyne	ADRB3	70	46
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819002999	GF	On-Demand	Anodyne	ACOX1	53	40
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819002999	GF	On-Demand	Anodyne	ABCB1	30	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819002999	GF	On-Demand	Anodyne	BIRC2	22	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819003001	GF	On-Demand	Anodyne	ADRB2	56	46
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819003001	GF	On-Demand	Anodyne	ADRB1	84	44
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819003001	GF	On-Demand	Anodyne	ADRB3	70	46
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819003001	GF	On-Demand	Anodyne	ACOX1	53	40
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819003001	GF	On-Demand	Anodyne	ABCB1	30	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819003001	GF	On-Demand	Anodyne	BIRC2	22	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819003002	GF	On-Demand	Anodyne	ADRB2	56	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819003002	GF	On-Demand	Anodyne	ADRB1	84	44
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819003002	GF	On-Demand	Anodyne	ADRB3	70	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819003002	GF	On-Demand	Anodyne	ACOX1	53	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819003002	GF	On-Demand	Anodyne	ABCB1	30	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819003002	GF	On-Demand	Anodyne	BIRC2	22	41
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819003007	GE	On-Demand	Anodyne	ADRB2	33	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819003007	GE	On-Demand	Anodyne	ADRB1	44	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819003007	GE	On-Demand	Anodyne	ADRB3	36	40
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819003007	GE	On-Demand	Anodyne	ACOX1	46	33
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819003008	GE	On-Demand	Anodyne	ADRB2	33	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819003008	GE	On-Demand	Anodyne	ADRB1	44	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819003008	GE	On-Demand	Anodyne	ADRB3	36	40
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819003008	GE	On-Demand	Anodyne	ACOX1	46	33
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819003009	GE	On-Demand	Anodyne	ADRB2	33	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819003009	GE	On-Demand	Anodyne	ADRB1	44	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819003009	GE	On-Demand	Anodyne	ADRB3	36	40
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819003009	GE	On-Demand	Anodyne	ACOX1	46	33
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819003010	GE	On-Demand	Anodyne	ADRB2	33	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819003010	GE	On-Demand	Anodyne	ADRB1	44	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819003010	GE	On-Demand	Anodyne	ADRB3	36	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819003010	GE	On-Demand	Anodyne	ACOX1	46	33
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003013	FD	On-Demand	Anodyne	ADRB2	32	43
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003013	FD	On-Demand	Anodyne	ADRB1	46	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003013	FD	On-Demand	Anodyne	ADRB3	37	43
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003013	FD	On-Demand	Anodyne	ACOX1	50	33
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003013	FD	On-Demand	Anodyne	CCR3	17	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003013	FD	On-Demand	Anodyne	ABCB1	25	46
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003015	FD	On-Demand	Anodyne	ADRB2	32	43
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003015	FD	On-Demand	Anodyne	ADRB1	46	41
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003015	FD	On-Demand	Anodyne	ADRB3	37	43
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003015	FD	On-Demand	Anodyne	ACOX1	50	33
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003015	FD	On-Demand	Anodyne	CCR3	17	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003015	FD	On-Demand	Anodyne	ABCB1	25	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003018	FD	On-Demand	Anodyne	ADRB2	32	43
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003018	FD	On-Demand	Anodyne	ADRB1	46	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003018	FD	On-Demand	Anodyne	ADRB3	37	43
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003018	FD	On-Demand	Anodyne	ACOX1	50	33
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003018	FD	On-Demand	Anodyne	CCR3	17	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003018	FD	On-Demand	Anodyne	ABCB1	25	46
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003021	FD	On-Demand	Anodyne	ADRB2	32	43
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003021	FD	On-Demand	Anodyne	ADRB1	46	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003021	FD	On-Demand	Anodyne	ADRB3	37	43
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003021	FD	On-Demand	Anodyne	ACOX1	50	33
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003021	FD	On-Demand	Anodyne	CCR3	17	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819003021	FD	On-Demand	Anodyne	ABCB1	25	46
COc1ccc(N2CCC(NCCC(=O)Nc3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000819003023	GG	On-Demand	Clean	NPY1R	15	40
CCOC[C@H](O)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000819003033	EE	On-Demand	Clean	ADRB2	18	40
CCOC[C@H](O)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000819003033	EE	On-Demand	Clean	ADRB1	19	40
CCOC[C@H](O)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000819003033	EE	On-Demand	Clean	ADRB3	26	47
O=C(Nc1cc(C(F)(F)F)ccc1N1CCOCC1)C(F)=C1CCC1	ZINC000819003049	FH	On-Demand	Anodyne	TEK	17	42
COc1cc(C(=O)NNC(=O)c2cc(C)ccc2C2CC2)cc(OC)c1OC	ZINC000819003050	GF	On-Demand	Reactive	TUBB1	42	34
O=C(CNC[C@H](O)c1ccc(Cl)cc1)N1CCc2ccccc2C1	ZINC000819003085	EF	On-Demand	Anodyne	DPP8	23	47
O=C(CNC[C@H](O)c1ccc(Cl)cc1)N1CCc2ccccc2C1	ZINC000819003085	EF	On-Demand	Anodyne	NOD1	15	42
CC[C@H](O)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000819003086	DF	On-Demand	Clean	ADRB3	25	46
CC[C@@H](O)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000819003087	DF	On-Demand	Clean	ADRB3	25	46
O=C(CNC[C@@H](O)c1cc(F)ccc1F)N1CCc2ccccc2C1	ZINC000819003088	EE	On-Demand	Anodyne	DPP8	26	44
O=C(CNC[C@H](O)c1cc(F)ccc1F)N1CCc2ccccc2C1	ZINC000819003089	EE	On-Demand	Anodyne	DPP8	26	44
COCc1cc(Cl)ccc1N[C@@H](C)C(=O)Nc1cccnc1Cl	ZINC000819003090	FH	On-Demand	Anodyne	G2YM83_BOTF4	63	31
COCc1cc(Cl)ccc1N[C@H](C)C(=O)Nc1cccnc1Cl	ZINC000819003091	FH	On-Demand	Anodyne	G2YM83_BOTF4	63	31
COc1ccc(N2CCC(NC[C@H](O)CSC)CC2)cc1	ZINC000819003092	DD	On-Demand	Clean	ADRB2	19	43
COc1ccc(N2CCC(NC[C@H](O)CSC)CC2)cc1	ZINC000819003092	DD	On-Demand	Clean	ADRB3	26	47
COc1ccc(N2CCC(NC[C@@H](O)CSC)CC2)cc1	ZINC000819003093	DD	On-Demand	Clean	ADRB2	19	43
COc1ccc(N2CCC(NC[C@@H](O)CSC)CC2)cc1	ZINC000819003093	DD	On-Demand	Clean	ADRB3	26	47
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1c(F)cccc1F	ZINC000819003094	GH	On-Demand	Clean	ADRB3	22	42
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1c(F)cccc1F	ZINC000819003095	GH	On-Demand	Clean	ADRB3	22	42
COc1ccc(N2CCC(NCCC(=O)Nc3cccnc3)CC2)cc1	ZINC000819003100	FF	On-Demand	Clean	CHRNA7	35	42
COc1ccc(N2CCC(NCCC(=O)Nc3cccnc3)CC2)cc1	ZINC000819003100	FF	On-Demand	Clean	C3AR1	30	42
COc1ccc(N2CCC(NCCC(=O)Nc3cccnc3)CC2)cc1	ZINC000819003100	FF	On-Demand	Clean	MCHR1	17	40
COc1ccc(OC)c([C@H](O)CNCCc2cccc(C(N)=O)c2)c1	ZINC000819003102	ED	On-Demand	Anodyne	ADRB2	73	49
COc1ccc(OC)c([C@H](O)CNCCc2cccc(C(N)=O)c2)c1	ZINC000819003102	ED	On-Demand	Anodyne	ADRB1	78	50
COc1ccc(OC)c([C@H](O)CNCCc2cccc(C(N)=O)c2)c1	ZINC000819003102	ED	On-Demand	Anodyne	ADRB3	68	50
COc1ccc(OC)c([C@H](O)CNCCc2cccc(C(N)=O)c2)c1	ZINC000819003102	ED	On-Demand	Anodyne	MTNR1A	50	44
COc1ccc(OC)c([C@H](O)CNCCc2cccc(C(N)=O)c2)c1	ZINC000819003102	ED	On-Demand	Anodyne	MTNR1B	48	38
COc1ccc(N2CCC(NC[C@@H](O)CC(F)(F)F)CC2)cc1	ZINC000819003110	EF	On-Demand	Clean	ADRB2	18	42
COc1ccc(N2CCC(NC[C@@H](O)CC(F)(F)F)CC2)cc1	ZINC000819003110	EF	On-Demand	Clean	ADRB3	25	48
COc1ccc(N2CCC(NC[C@H](O)CC(F)(F)F)CC2)cc1	ZINC000819003111	EF	On-Demand	Clean	ADRB2	18	42
COc1ccc(N2CCC(NC[C@H](O)CC(F)(F)F)CC2)cc1	ZINC000819003111	EF	On-Demand	Clean	ADRB3	25	48
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)Cc1ccccc1	ZINC000819003112	GG	On-Demand	Clean	ADRB3	28	49
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)Cc1ccccc1	ZINC000819003113	GG	On-Demand	Clean	ADRB3	28	49
COc1ccc(N2CCC(NC[C@@H](O)Cc3ccc(F)cc3)CC2)cc1	ZINC000819003116	FF	On-Demand	Clean	ADRB2	25	40
COc1ccc(N2CCC(NC[C@@H](O)Cc3ccc(F)cc3)CC2)cc1	ZINC000819003116	FF	On-Demand	Clean	ADRB1	23	41
COc1ccc(N2CCC(NC[C@@H](O)Cc3ccc(F)cc3)CC2)cc1	ZINC000819003116	FF	On-Demand	Clean	ADRB3	33	46
COc1ccc(N2CCC(NC[C@H](O)Cc3ccc(F)cc3)CC2)cc1	ZINC000819003117	FF	On-Demand	Clean	ADRB2	25	40
COc1ccc(N2CCC(NC[C@H](O)Cc3ccc(F)cc3)CC2)cc1	ZINC000819003117	FF	On-Demand	Clean	ADRB1	23	41
COc1ccc(N2CCC(NC[C@H](O)Cc3ccc(F)cc3)CC2)cc1	ZINC000819003117	FF	On-Demand	Clean	ADRB3	33	46
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc(C(N)=O)c2)cc1	ZINC000819003118	FD	On-Demand	Anodyne	ADRB2	85	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc(C(N)=O)c2)cc1	ZINC000819003118	FD	On-Demand	Anodyne	ADRB1	83	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc(C(N)=O)c2)cc1	ZINC000819003118	FD	On-Demand	Anodyne	ADRB3	159	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc(C(N)=O)c2)cc1	ZINC000819003118	FD	On-Demand	Anodyne	TRY2_BOVIN	91	35
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc(C(N)=O)c2)cc1	ZINC000819003119	FD	On-Demand	Anodyne	ADRB2	85	43
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc(C(N)=O)c2)cc1	ZINC000819003119	FD	On-Demand	Anodyne	ADRB1	83	44
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc(C(N)=O)c2)cc1	ZINC000819003119	FD	On-Demand	Anodyne	ADRB3	159	44
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc(C(N)=O)c2)cc1	ZINC000819003119	FD	On-Demand	Anodyne	TRY2_BOVIN	91	35
O=C(CNC[C@@H](O)c1ccc(Br)cc1)N1CCc2ccccc2C1	ZINC000819003124	GF	On-Demand	Anodyne	DPP8	22	47
O=C(CNC[C@H](O)c1ccc(Br)cc1)N1CCc2ccccc2C1	ZINC000819003125	GF	On-Demand	Anodyne	DPP8	22	47
O=C(CNC[C@@H](O)c1ccc(Cl)c(F)c1)N1CCc2ccccc2C1	ZINC000819003126	FF	On-Demand	Anodyne	MAPK1	41	36
O=C(CNC[C@@H](O)c1ccc(Cl)c(F)c1)N1CCc2ccccc2C1	ZINC000819003126	FF	On-Demand	Anodyne	DPP8	21	42
O=C(CNC[C@H](O)c1ccc(Cl)c(F)c1)N1CCc2ccccc2C1	ZINC000819003127	FF	On-Demand	Anodyne	MAPK1	41	36
O=C(CNC[C@H](O)c1ccc(Cl)c(F)c1)N1CCc2ccccc2C1	ZINC000819003127	FF	On-Demand	Anodyne	DPP8	21	42
CC(=O)Nc1cccc(CC(=O)NNC(=O)COc2cc(C)ccc2C(C)C)c1	ZINC000819003131	GF	On-Demand	Reactive	KCNK3	55	38
CC(=O)Nc1cccc(CC(=O)NNC(=O)COc2cc(C)ccc2C(C)C)c1	ZINC000819003131	GF	On-Demand	Reactive	KCNK9	59	38
O=C(CNC[C@H](O)C1CC1)N1CCc2ccccc2C1	ZINC000819003143	CC	On-Demand	Anodyne	DPP8	29	50
O=C(CNC[C@@H](O)C1CC1)N1CCc2ccccc2C1	ZINC000819003145	CC	On-Demand	Anodyne	DPP8	29	50
COc1ccc(N2CCC(NC[C@@H](O)COC3CCOCC3)CC2)cc1	ZINC000819003161	FD	On-Demand	Clean	ADRB2	23	45
COc1ccc(N2CCC(NC[C@@H](O)COC3CCOCC3)CC2)cc1	ZINC000819003161	FD	On-Demand	Clean	ADRB1	24	41
COc1ccc(N2CCC(NC[C@@H](O)COC3CCOCC3)CC2)cc1	ZINC000819003161	FD	On-Demand	Clean	ADRB3	31	47
COc1ccc(N2CCC(NC[C@H](O)COC3CCOCC3)CC2)cc1	ZINC000819003163	FD	On-Demand	Clean	ADRB2	23	45
COc1ccc(N2CCC(NC[C@H](O)COC3CCOCC3)CC2)cc1	ZINC000819003163	FD	On-Demand	Clean	ADRB1	24	41
COc1ccc(N2CCC(NC[C@H](O)COC3CCOCC3)CC2)cc1	ZINC000819003163	FD	On-Demand	Clean	ADRB3	31	47
COc1ccc(N2CCC(NC[C@@H](O)CC3CCCC3)CC2)cc1	ZINC000819003170	EG	On-Demand	Clean	ADRB2	22	44
COc1ccc(N2CCC(NC[C@@H](O)CC3CCCC3)CC2)cc1	ZINC000819003170	EG	On-Demand	Clean	ADRB1	23	40
COc1ccc(N2CCC(NC[C@@H](O)CC3CCCC3)CC2)cc1	ZINC000819003170	EG	On-Demand	Clean	ADRB3	28	48
COc1ccc(N2CCC(NC[C@H](O)CC3CCCC3)CC2)cc1	ZINC000819003171	EG	On-Demand	Clean	ADRB2	22	44
COc1ccc(N2CCC(NC[C@H](O)CC3CCCC3)CC2)cc1	ZINC000819003171	EG	On-Demand	Clean	ADRB1	23	40
COc1ccc(N2CCC(NC[C@H](O)CC3CCCC3)CC2)cc1	ZINC000819003171	EG	On-Demand	Clean	ADRB3	28	48
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)Cn1cccn1	ZINC000819003197	FE	On-Demand	Clean	ADRB3	22	43
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)Cn1cccn1	ZINC000819003201	FE	On-Demand	Clean	ADRB3	22	43
NC(=O)c1cccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819003203	FF	On-Demand	Anodyne	ADRB2	56	46
NC(=O)c1cccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819003203	FF	On-Demand	Anodyne	ADRB1	55	44
NC(=O)c1cccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819003203	FF	On-Demand	Anodyne	ADRB3	60	46
NC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819003205	FF	On-Demand	Anodyne	ADRB2	56	46
NC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819003205	FF	On-Demand	Anodyne	ADRB1	55	44
NC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819003205	FF	On-Demand	Anodyne	ADRB3	60	46
COc1cccc([S@@](=O)CC(=O)NNC(=O)C2CC2)c1	ZINC000819003213	CC	On-Demand	Reactive	DRD4	42	32
COc1cccc([S@@](=O)CC(=O)NNC(=O)C2CC2)c1	ZINC000819003213	CC	On-Demand	Reactive	MTNR1A	49	48
COc1cccc([S@@](=O)CC(=O)NNC(=O)C2CC2)c1	ZINC000819003213	CC	On-Demand	Reactive	MTNR1B	49	48
COc1ccc(N2CCC(NC[C@@H](O)Cc3cccc(Cl)c3)CC2)cc1	ZINC000819003219	FH	On-Demand	Clean	ADRB2	26	40
COc1ccc(N2CCC(NC[C@@H](O)Cc3cccc(Cl)c3)CC2)cc1	ZINC000819003219	FH	On-Demand	Clean	ADRB1	29	40
COc1ccc(N2CCC(NC[C@@H](O)Cc3cccc(Cl)c3)CC2)cc1	ZINC000819003219	FH	On-Demand	Clean	ADRB3	46	46
COc1ccc(N2CCN(C(=O)Cc3nsc4ccccc34)CC2)cc1	ZINC000819003240	FG	On-Demand	Clean	HTR1A	33	47
COc1ccc(N2CCN(C(=O)Cc3nsc4ccccc34)CC2)cc1	ZINC000819003240	FG	On-Demand	Clean	DRD2	25	47
COc1ccc(N2CCN(C(=O)Cc3nsc4ccccc34)CC2)cc1	ZINC000819003240	FG	On-Demand	Clean	SSTR1	37	40
COc1ccc(N2CCN(C(=O)Cc3nsc4ccccc34)CC2)cc1	ZINC000819003240	FG	On-Demand	Clean	CASP7	18	42
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(Br)oc1C	ZINC000819003242	GF	On-Demand	Reactive	HCN1	50	35
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(Br)oc1C	ZINC000819003242	GF	On-Demand	Reactive	HCN4	41	32
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819003243	FE	On-Demand	Anodyne	SLC6A1	111	42
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819003244	FE	On-Demand	Anodyne	SLC6A1	111	42
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819003245	FE	On-Demand	Anodyne	SLC6A1	111	42
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819003246	FE	On-Demand	Anodyne	SLC6A1	111	42
CC(C)c1nn(-c2ccccc2)cc1C(=O)NNC(=O)NC1CCCCC1	ZINC000819003249	FG	On-Demand	Reactive	EPHX2	19	41
N#Cc1ccc([C@H](O)CNCCCN2CCC[C@H](C(N)=O)C2)cc1	ZINC000819003256	EC	On-Demand	Mild	SLC6A1	81	37
N#Cc1ccc([C@H](O)CNCCCN2CCC[C@@H](C(N)=O)C2)cc1	ZINC000819003257	EC	On-Demand	Mild	SLC6A1	81	37
N#Cc1ccc([C@@H](O)CNCCCN2CCC[C@H](C(N)=O)C2)cc1	ZINC000819003258	EC	On-Demand	Mild	SLC6A1	81	37
N#Cc1ccc([C@@H](O)CNCCCN2CCC[C@@H](C(N)=O)C2)cc1	ZINC000819003259	EC	On-Demand	Mild	SLC6A1	81	37
COc1ccc(N2CCN(C(=O)Cc3ccc(-n4cnnc4)cc3)CC2)cc1	ZINC000819003262	GE	On-Demand	Clean	MMP13	26	40
COc1ccc(N2CCN(C(=O)Cc3ccc(-n4cnnc4)cc3)CC2)cc1	ZINC000819003262	GE	On-Demand	Clean	CCR1	21	42
COc1ccc(N2CCN(C(=O)Cc3ccc(-n4cnnc4)cc3)CC2)cc1	ZINC000819003262	GE	On-Demand	Clean	MMP3	26	40
COc1ccc(N2CCN(C(=O)Cc3ccc(-n4cnnc4)cc3)CC2)cc1	ZINC000819003262	GE	On-Demand	Clean	KCNJ1	63	42
CS(=O)(=O)c1ccc([C@H](O)CNCCCN2CCC[C@H](C(N)=O)C2)cc1	ZINC000819003263	GC	On-Demand	Anodyne	SLC6A1	105	37
CS(=O)(=O)c1ccc([C@H](O)CNCCCN2CCC[C@@H](C(N)=O)C2)cc1	ZINC000819003264	GC	On-Demand	Anodyne	SLC6A1	105	37
CS(=O)(=O)c1ccc([C@@H](O)CNCCCN2CCC[C@H](C(N)=O)C2)cc1	ZINC000819003265	GC	On-Demand	Anodyne	SLC6A1	105	37
CS(=O)(=O)c1ccc([C@@H](O)CNCCCN2CCC[C@@H](C(N)=O)C2)cc1	ZINC000819003266	GC	On-Demand	Anodyne	SLC6A1	105	37
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819003270	ED	On-Demand	Anodyne	SLC6A1	131	42
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819003271	ED	On-Demand	Anodyne	SLC6A1	131	42
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819003272	ED	On-Demand	Anodyne	SLC6A1	131	42
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819003273	ED	On-Demand	Anodyne	SLC6A1	131	42
C=C(C)C(C)(C)C(=O)NNC(=O)COc1ccc(Br)cc1	ZINC000819003276	FF	On-Demand	Reactive	TRAR	21	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819003285	FD	On-Demand	Anodyne	ADRB2	36	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819003285	FD	On-Demand	Anodyne	ADRB1	52	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819003285	FD	On-Demand	Anodyne	ADRB3	39	46
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819003286	FD	On-Demand	Anodyne	ADRB2	36	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819003286	FD	On-Demand	Anodyne	ADRB1	52	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819003286	FD	On-Demand	Anodyne	ADRB3	39	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819003287	FD	On-Demand	Anodyne	ADRB2	36	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819003287	FD	On-Demand	Anodyne	ADRB1	52	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819003287	FD	On-Demand	Anodyne	ADRB3	39	46
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819003288	FD	On-Demand	Anodyne	ADRB2	36	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819003288	FD	On-Demand	Anodyne	ADRB1	52	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819003288	FD	On-Demand	Anodyne	ADRB3	39	46
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819003289	EF	On-Demand	Anodyne	ADRB3	22	48
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819003289	EF	On-Demand	Anodyne	CCR2	53	37
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819003289	EF	On-Demand	Anodyne	MCHR1	22	42
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819003289	EF	On-Demand	Anodyne	LIPG	45	34
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819003290	EF	On-Demand	Anodyne	ADRB3	22	48
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819003290	EF	On-Demand	Anodyne	CCR2	53	37
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819003290	EF	On-Demand	Anodyne	MCHR1	22	42
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819003290	EF	On-Demand	Anodyne	LIPG	45	34
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819003291	EF	On-Demand	Anodyne	ADRB3	22	48
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819003291	EF	On-Demand	Anodyne	CCR2	53	37
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819003291	EF	On-Demand	Anodyne	MCHR1	22	42
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819003291	EF	On-Demand	Anodyne	LIPG	45	34
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819003292	EF	On-Demand	Anodyne	ADRB3	22	48
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819003292	EF	On-Demand	Anodyne	CCR2	53	37
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819003292	EF	On-Demand	Anodyne	MCHR1	22	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819003292	EF	On-Demand	Anodyne	LIPG	45	34
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCCC1	ZINC000819003293	FI	On-Demand	Anodyne	KCNQ2	22	40
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCCC1	ZINC000819003293	FI	On-Demand	Anodyne	TEK	18	44
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCCC1	ZINC000819003293	FI	On-Demand	Anodyne	LIPG	47	33
O=C(/C=C/[C@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCCC1	ZINC000819003294	FI	On-Demand	Anodyne	KCNQ2	22	40
O=C(/C=C/[C@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCCC1	ZINC000819003294	FI	On-Demand	Anodyne	TEK	18	44
O=C(/C=C/[C@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCCC1	ZINC000819003294	FI	On-Demand	Anodyne	LIPG	47	33
O=C(/C=C\[C@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCCC1	ZINC000819003295	FI	On-Demand	Anodyne	KCNQ2	22	40
O=C(/C=C\[C@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCCC1	ZINC000819003295	FI	On-Demand	Anodyne	TEK	18	44
O=C(/C=C\[C@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCCC1	ZINC000819003295	FI	On-Demand	Anodyne	LIPG	47	33
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCCC1	ZINC000819003296	FI	On-Demand	Anodyne	KCNQ2	22	40
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCCC1	ZINC000819003296	FI	On-Demand	Anodyne	TEK	18	44
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCCC1	ZINC000819003296	FI	On-Demand	Anodyne	LIPG	47	33
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cc(C)ccc2C)C1	ZINC000819003308	ED	On-Demand	Anodyne	ADRB2	30	43
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cc(C)ccc2C)C1	ZINC000819003308	ED	On-Demand	Anodyne	ADRB1	25	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cc(C)ccc2C)C1	ZINC000819003309	ED	On-Demand	Anodyne	ADRB2	30	43
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cc(C)ccc2C)C1	ZINC000819003309	ED	On-Demand	Anodyne	ADRB1	25	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cc(C)ccc2C)C1	ZINC000819003310	ED	On-Demand	Anodyne	ADRB2	30	43
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cc(C)ccc2C)C1	ZINC000819003310	ED	On-Demand	Anodyne	ADRB1	25	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cc(C)ccc2C)C1	ZINC000819003311	ED	On-Demand	Anodyne	ADRB2	30	43
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cc(C)ccc2C)C1	ZINC000819003311	ED	On-Demand	Anodyne	ADRB1	25	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819003320	CD	On-Demand	Anodyne	ACE	65	39
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819003320	CD	On-Demand	Anodyne	SLC6A3	16	44
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819003320	CD	On-Demand	Anodyne	MME	53	39
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819003320	CD	On-Demand	Anodyne	PREP	44	38
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819003320	CD	On-Demand	Anodyne	REN	49	36
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819003320	CD	On-Demand	Anodyne	ABCB1	28	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819003320	CD	On-Demand	Anodyne	BIRC2	31	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819003320	CD	On-Demand	Anodyne	BRCA1	46	33
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819003321	CD	On-Demand	Anodyne	ACE	65	39
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819003321	CD	On-Demand	Anodyne	SLC6A3	16	44
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819003321	CD	On-Demand	Anodyne	MME	53	39
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819003321	CD	On-Demand	Anodyne	PREP	44	38
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819003321	CD	On-Demand	Anodyne	REN	49	36
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819003321	CD	On-Demand	Anodyne	ABCB1	28	42
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819003321	CD	On-Demand	Anodyne	BIRC2	31	46
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819003321	CD	On-Demand	Anodyne	BRCA1	46	33
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819003322	CD	On-Demand	Anodyne	ACE	65	39
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819003322	CD	On-Demand	Anodyne	SLC6A3	16	44
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819003322	CD	On-Demand	Anodyne	MME	53	39
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819003322	CD	On-Demand	Anodyne	PREP	44	38
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819003322	CD	On-Demand	Anodyne	REN	49	36
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819003322	CD	On-Demand	Anodyne	ABCB1	28	42
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819003322	CD	On-Demand	Anodyne	BIRC2	31	46
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819003322	CD	On-Demand	Anodyne	BRCA1	46	33
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819003323	CD	On-Demand	Anodyne	ACE	65	39
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819003323	CD	On-Demand	Anodyne	SLC6A3	16	44
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819003323	CD	On-Demand	Anodyne	MME	53	39
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819003323	CD	On-Demand	Anodyne	PREP	44	38
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819003323	CD	On-Demand	Anodyne	REN	49	36
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819003323	CD	On-Demand	Anodyne	ABCB1	28	42
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819003323	CD	On-Demand	Anodyne	BIRC2	31	46
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819003323	CD	On-Demand	Anodyne	BRCA1	46	33
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1cccc(C(F)(F)F)c1	ZINC000819003328	GI	On-Demand	Anodyne	PDS	80	45
O[C@H](CNCc1cccc(OCC(F)F)c1)c1cccc(C(F)(F)F)c1	ZINC000819003329	GI	On-Demand	Anodyne	PDS	80	45
COC(=O)N1CCC[C@@H](NC[C@@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819003330	FC	On-Demand	Anodyne	BIRC2	20	40
COC(=O)N1CCC[C@@H](NC[C@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819003331	FC	On-Demand	Anodyne	BIRC2	20	40
COC(=O)N1CCC[C@H](NC[C@@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819003332	FC	On-Demand	Anodyne	BIRC2	20	40
COC(=O)N1CCC[C@H](NC[C@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819003333	FC	On-Demand	Anodyne	BIRC2	20	40
COC(=O)N1CCC[C@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000819003335	GF	On-Demand	Anodyne	CYNT	33	40
COC(=O)N1CCC[C@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000819003335	GF	On-Demand	Anodyne	SFRP1	61	33
COC(=O)N1CCC[C@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000819003335	GF	On-Demand	Anodyne	WNT3	55	33
COC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000819003336	GF	On-Demand	Anodyne	CYNT	33	40
COC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000819003336	GF	On-Demand	Anodyne	SFRP1	61	33
COC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000819003336	GF	On-Demand	Anodyne	WNT3	55	33
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819003337	ED	On-Demand	Mild	ADRB1	51	43
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819003337	ED	On-Demand	Mild	ADRB3	35	46
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819003338	ED	On-Demand	Mild	ADRB1	51	43
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819003338	ED	On-Demand	Mild	ADRB3	35	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819003339	ED	On-Demand	Mild	ADRB1	51	43
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819003339	ED	On-Demand	Mild	ADRB3	35	46
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819003340	ED	On-Demand	Mild	ADRB1	51	43
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819003340	ED	On-Demand	Mild	ADRB3	35	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819003347	ED	On-Demand	Anodyne	ADRB2	44	49
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819003347	ED	On-Demand	Anodyne	ADRB1	47	49
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819003347	ED	On-Demand	Anodyne	ADRB3	31	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819003347	ED	On-Demand	Anodyne	ABCB1	46	45
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819003348	ED	On-Demand	Anodyne	ADRB2	44	49
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819003348	ED	On-Demand	Anodyne	ADRB1	47	49
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819003348	ED	On-Demand	Anodyne	ADRB3	31	46
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819003348	ED	On-Demand	Anodyne	ABCB1	46	45
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819003349	ED	On-Demand	Anodyne	ADRB2	44	49
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819003349	ED	On-Demand	Anodyne	ADRB1	47	49
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819003349	ED	On-Demand	Anodyne	ADRB3	31	46
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819003349	ED	On-Demand	Anodyne	ABCB1	46	45
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819003350	ED	On-Demand	Anodyne	ADRB2	44	49
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819003350	ED	On-Demand	Anodyne	ADRB1	47	49
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819003350	ED	On-Demand	Anodyne	ADRB3	31	46
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819003350	ED	On-Demand	Anodyne	ABCB1	46	45
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003361	GE	On-Demand	Anodyne	ADRB2	40	48
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003361	GE	On-Demand	Anodyne	ADRB1	38	48
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003361	GE	On-Demand	Anodyne	ADRB3	28	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003361	GE	On-Demand	Anodyne	ABCB1	44	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003361	GE	On-Demand	Anodyne	RBP4	85	36
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003361	GE	On-Demand	Anodyne	SFRP1	115	35
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003361	GE	On-Demand	Anodyne	SCD	29	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003361	GE	On-Demand	Anodyne	WNT3	80	35
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003362	GE	On-Demand	Anodyne	ADRB2	40	48
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003362	GE	On-Demand	Anodyne	ADRB1	38	48
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003362	GE	On-Demand	Anodyne	ADRB3	28	40
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003362	GE	On-Demand	Anodyne	ABCB1	44	46
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003362	GE	On-Demand	Anodyne	RBP4	85	36
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003362	GE	On-Demand	Anodyne	SFRP1	115	35
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003362	GE	On-Demand	Anodyne	SCD	29	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003362	GE	On-Demand	Anodyne	WNT3	80	35
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003363	GE	On-Demand	Anodyne	ADRB2	40	48
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003363	GE	On-Demand	Anodyne	ADRB1	38	48
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003363	GE	On-Demand	Anodyne	ADRB3	28	40
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003363	GE	On-Demand	Anodyne	ABCB1	44	46
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003363	GE	On-Demand	Anodyne	RBP4	85	36
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003363	GE	On-Demand	Anodyne	SFRP1	115	35
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003363	GE	On-Demand	Anodyne	SCD	29	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003363	GE	On-Demand	Anodyne	WNT3	80	35
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003364	GE	On-Demand	Anodyne	ADRB2	40	48
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003364	GE	On-Demand	Anodyne	ADRB1	38	48
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003364	GE	On-Demand	Anodyne	ADRB3	28	40
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003364	GE	On-Demand	Anodyne	ABCB1	44	46
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003364	GE	On-Demand	Anodyne	RBP4	85	36
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003364	GE	On-Demand	Anodyne	SFRP1	115	35
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003364	GE	On-Demand	Anodyne	SCD	29	41
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819003364	GE	On-Demand	Anodyne	WNT3	80	35
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003365	EF	On-Demand	Anodyne	F2	21	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003365	EF	On-Demand	Anodyne	TRY2_BOVIN	68	38
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003365	EF	On-Demand	Anodyne	TRY1_BOVIN	16	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003365	EF	On-Demand	Anodyne	DPP7	24	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003365	EF	On-Demand	Anodyne	MCHR1	17	41
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003366	EF	On-Demand	Anodyne	F2	21	41
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003366	EF	On-Demand	Anodyne	TRY2_BOVIN	68	38
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003366	EF	On-Demand	Anodyne	TRY1_BOVIN	16	41
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003366	EF	On-Demand	Anodyne	DPP7	24	42
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003366	EF	On-Demand	Anodyne	MCHR1	17	41
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003367	EF	On-Demand	Anodyne	F2	21	41
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003367	EF	On-Demand	Anodyne	TRY2_BOVIN	68	38
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003367	EF	On-Demand	Anodyne	TRY1_BOVIN	16	41
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003367	EF	On-Demand	Anodyne	DPP7	24	42
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003367	EF	On-Demand	Anodyne	MCHR1	17	41
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003368	EF	On-Demand	Anodyne	F2	21	41
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003368	EF	On-Demand	Anodyne	TRY2_BOVIN	68	38
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003368	EF	On-Demand	Anodyne	TRY1_BOVIN	16	41
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003368	EF	On-Demand	Anodyne	DPP7	24	42
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819003368	EF	On-Demand	Anodyne	MCHR1	17	41
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003369	GE	On-Demand	Anodyne	ADRB2	30	40
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003369	GE	On-Demand	Anodyne	ADRB1	41	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003369	GE	On-Demand	Anodyne	ACOX1	52	32
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003369	GE	On-Demand	Anodyne	CACNA1B	40	35
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003369	GE	On-Demand	Anodyne	CCR2	97	38
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003369	GE	On-Demand	Anodyne	CHRNA10	23	46
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003369	GE	On-Demand	Anodyne	PDS	51	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003370	GE	On-Demand	Anodyne	ADRB2	30	40
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003370	GE	On-Demand	Anodyne	ADRB1	41	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003370	GE	On-Demand	Anodyne	ACOX1	52	32
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003370	GE	On-Demand	Anodyne	CACNA1B	40	35
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003370	GE	On-Demand	Anodyne	CCR2	97	38
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003370	GE	On-Demand	Anodyne	CHRNA10	23	46
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003370	GE	On-Demand	Anodyne	PDS	51	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003371	GE	On-Demand	Anodyne	ADRB2	30	40
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003371	GE	On-Demand	Anodyne	ADRB1	41	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003371	GE	On-Demand	Anodyne	ACOX1	52	32
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003371	GE	On-Demand	Anodyne	CACNA1B	40	35
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003371	GE	On-Demand	Anodyne	CCR2	97	38
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003371	GE	On-Demand	Anodyne	CHRNA10	23	46
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003371	GE	On-Demand	Anodyne	PDS	51	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003372	GE	On-Demand	Anodyne	ADRB2	30	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003372	GE	On-Demand	Anodyne	ADRB1	41	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003372	GE	On-Demand	Anodyne	ACOX1	52	32
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003372	GE	On-Demand	Anodyne	CACNA1B	40	35
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003372	GE	On-Demand	Anodyne	CCR2	97	38
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003372	GE	On-Demand	Anodyne	CHRNA10	23	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819003372	GE	On-Demand	Anodyne	PDS	51	41
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1cccc(Br)c1	ZINC000819003375	GH	On-Demand	Anodyne	PDS	68	43
O[C@H](CNCc1cccc(OCC(F)F)c1)c1cccc(Br)c1	ZINC000819003376	GH	On-Demand	Anodyne	PDS	68	43
COc1ccc(N2CCC(NC[C@H](O)Cc3cccc(Cl)c3)CC2)cc1	ZINC000819003383	FH	On-Demand	Clean	ADRB2	26	40
COc1ccc(N2CCC(NC[C@H](O)Cc3cccc(Cl)c3)CC2)cc1	ZINC000819003383	FH	On-Demand	Clean	ADRB1	29	40
COc1ccc(N2CCC(NC[C@H](O)Cc3cccc(Cl)c3)CC2)cc1	ZINC000819003383	FH	On-Demand	Clean	ADRB3	46	46
NC(=O)c1cccc(CCNC[C@@H](O)C2CC2)c1	ZINC000819003388	BC	On-Demand	Anodyne	ADRB2	33	42
NC(=O)c1cccc(CCNC[C@@H](O)C2CC2)c1	ZINC000819003388	BC	On-Demand	Anodyne	ADRB1	39	40
NC(=O)c1cccc(CCNC[C@@H](O)C2CC2)c1	ZINC000819003388	BC	On-Demand	Anodyne	ADRB3	37	41
NC(=O)c1cccc(CCNC[C@H](O)C2CC2)c1	ZINC000819003389	BC	On-Demand	Anodyne	ADRB2	33	42
NC(=O)c1cccc(CCNC[C@H](O)C2CC2)c1	ZINC000819003389	BC	On-Demand	Anodyne	ADRB1	39	40
NC(=O)c1cccc(CCNC[C@H](O)C2CC2)c1	ZINC000819003389	BC	On-Demand	Anodyne	ADRB3	37	41
CN(CCC#N)C[C@@H](O)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000819003390	GE	On-Demand	Mild	ADRB3	15	41
CN(CCC#N)C[C@H](O)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000819003391	GE	On-Demand	Mild	ADRB3	15	41
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)Cc1ccc(F)cc1	ZINC000819003394	GH	On-Demand	Clean	ADRB2	16	40
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)Cc1ccc(F)cc1	ZINC000819003394	GH	On-Demand	Clean	ADRB1	15	42
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)Cc1ccc(F)cc1	ZINC000819003394	GH	On-Demand	Clean	ADRB3	25	48
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)Cc1ccc(F)cc1	ZINC000819003395	GH	On-Demand	Clean	ADRB2	16	40
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)Cc1ccc(F)cc1	ZINC000819003395	GH	On-Demand	Clean	ADRB1	15	42
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)Cc1ccc(F)cc1	ZINC000819003395	GH	On-Demand	Clean	ADRB3	25	48
COCc1cc(Cl)ccc1N[C@H](C)C(=O)c1ccc2c(c1)CCN2C(C)=O	ZINC000819003397	GI	On-Demand	Anodyne	HSD17B3	42	41
COCc1cc(Cl)ccc1N[C@@H](C)C(=O)c1ccc2c(c1)CCN2C(C)=O	ZINC000819003398	GI	On-Demand	Anodyne	HSD17B3	42	41
COc1ccc(N2CCC(NC[C@@H](O)COc3ccccc3Cl)CC2)cc1	ZINC000819003399	GG	On-Demand	Clean	ADRB2	49	53
COc1ccc(N2CCC(NC[C@@H](O)COc3ccccc3Cl)CC2)cc1	ZINC000819003399	GG	On-Demand	Clean	ADRB1	49	53
COc1ccc(N2CCC(NC[C@@H](O)COc3ccccc3Cl)CC2)cc1	ZINC000819003399	GG	On-Demand	Clean	ADRB3	44	53
COc1ccc(N2CCC(NC[C@@H](O)COc3ccccc3Cl)CC2)cc1	ZINC000819003399	GG	On-Demand	Clean	ABCB1	44	43
COc1ccc(N2CCC(NC[C@H](O)COc3ccccc3Cl)CC2)cc1	ZINC000819003400	GG	On-Demand	Clean	ADRB2	49	53
COc1ccc(N2CCC(NC[C@H](O)COc3ccccc3Cl)CC2)cc1	ZINC000819003400	GG	On-Demand	Clean	ADRB1	49	53
COc1ccc(N2CCC(NC[C@H](O)COc3ccccc3Cl)CC2)cc1	ZINC000819003400	GG	On-Demand	Clean	ADRB3	44	53
COc1ccc(N2CCC(NC[C@H](O)COc3ccccc3Cl)CC2)cc1	ZINC000819003400	GG	On-Demand	Clean	ABCB1	44	43
COc1ccc(N2CCC(NC[C@H](O)CCNC(=O)OC(C)(C)C)CC2)cc1	ZINC000819003407	GF	On-Demand	Clean	ADRB3	26	43
COc1ccc(N2CCC(NC[C@@H](O)CCNC(=O)OC(C)(C)C)CC2)cc1	ZINC000819003408	GF	On-Demand	Clean	ADRB3	26	43
O=C(CNC[C@@H](O)c1ccccc1)N1CCc2ccccc2C1	ZINC000819003409	DD	On-Demand	Anodyne	DPP8	28	51
O=C(CNC[C@H](O)c1ccccc1)N1CCc2ccccc2C1	ZINC000819003410	DD	On-Demand	Anodyne	DPP8	28	51
COCc1cc(Cl)ccc1N[C@H](C)C(=O)NNC(=O)c1cccc(C)c1	ZINC000819003416	GG	On-Demand	Reactive	CTSL	20	41
COCc1cc(Cl)ccc1N[C@H](C)C(=O)NNC(=O)c1cccc(C)c1	ZINC000819003416	GG	On-Demand	Reactive	KCNK3	56	41
COCc1cc(Cl)ccc1N[C@H](C)C(=O)NNC(=O)c1cccc(C)c1	ZINC000819003416	GG	On-Demand	Reactive	KCNK9	43	41
COCc1cc(Cl)ccc1N[C@@H](C)C(=O)NNC(=O)c1cccc(C)c1	ZINC000819003417	GG	On-Demand	Reactive	CTSL	20	41
COCc1cc(Cl)ccc1N[C@@H](C)C(=O)NNC(=O)c1cccc(C)c1	ZINC000819003417	GG	On-Demand	Reactive	KCNK3	56	41
COCc1cc(Cl)ccc1N[C@@H](C)C(=O)NNC(=O)c1cccc(C)c1	ZINC000819003417	GG	On-Demand	Reactive	KCNK9	43	41
COc1ccc(N2CCC(NC[C@@H](O)COc3ccccc3F)CC2)cc1	ZINC000819003424	FF	On-Demand	Clean	ADRB2	48	53
COc1ccc(N2CCC(NC[C@@H](O)COc3ccccc3F)CC2)cc1	ZINC000819003424	FF	On-Demand	Clean	ADRB1	49	53
COc1ccc(N2CCC(NC[C@@H](O)COc3ccccc3F)CC2)cc1	ZINC000819003424	FF	On-Demand	Clean	ADRB3	44	53
COc1ccc(N2CCC(NC[C@@H](O)COc3ccccc3F)CC2)cc1	ZINC000819003424	FF	On-Demand	Clean	ABCB1	35	43
COc1ccc(N2CCC(NC[C@H](O)COc3ccccc3F)CC2)cc1	ZINC000819003425	FF	On-Demand	Clean	ADRB2	48	53
COc1ccc(N2CCC(NC[C@H](O)COc3ccccc3F)CC2)cc1	ZINC000819003425	FF	On-Demand	Clean	ADRB1	49	53
COc1ccc(N2CCC(NC[C@H](O)COc3ccccc3F)CC2)cc1	ZINC000819003425	FF	On-Demand	Clean	ADRB3	44	53
COc1ccc(N2CCC(NC[C@H](O)COc3ccccc3F)CC2)cc1	ZINC000819003425	FF	On-Demand	Clean	ABCB1	35	43
O=C(CNC[C@@H](O)c1cccc(Br)c1)N1CCc2ccccc2C1	ZINC000819003428	GF	On-Demand	Anodyne	DPP8	22	45
O=C(CNC[C@H](O)c1cccc(Br)c1)N1CCc2ccccc2C1	ZINC000819003429	GF	On-Demand	Anodyne	DPP8	22	45
CN(C[C@@H](O)CNC1CCN(c2ccc(OC(F)F)cc2)CC1)C1CC1	ZINC000819003434	FE	On-Demand	Clean	ADRB3	23	42
CN(C[C@H](O)CNC1CCN(c2ccc(OC(F)F)cc2)CC1)C1CC1	ZINC000819003435	FE	On-Demand	Clean	ADRB3	23	42
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCc2ccccc2C1	ZINC000819003440	EF	On-Demand	Anodyne	ADRB1	36	45
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCc2ccccc2C1	ZINC000819003440	EF	On-Demand	Anodyne	ADRB3	58	45
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCc2ccccc2C1	ZINC000819003440	EF	On-Demand	Anodyne	DPP8	23	45
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCc2ccccc2C1	ZINC000819003441	EF	On-Demand	Anodyne	ADRB1	36	45
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCc2ccccc2C1	ZINC000819003441	EF	On-Demand	Anodyne	ADRB3	58	45
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCc2ccccc2C1	ZINC000819003441	EF	On-Demand	Anodyne	DPP8	23	45
COc1ccc(N2CCC(NC[C@@H](O)COc3c(C)ccc(C)c3C)CC2)cc1	ZINC000819003442	GH	On-Demand	Clean	ADRB2	31	46
COc1ccc(N2CCC(NC[C@@H](O)COc3c(C)ccc(C)c3C)CC2)cc1	ZINC000819003442	GH	On-Demand	Clean	ADRB1	32	45
COc1ccc(N2CCC(NC[C@@H](O)COc3c(C)ccc(C)c3C)CC2)cc1	ZINC000819003442	GH	On-Demand	Clean	ADRB3	34	50
COc1ccc(N2CCC(NC[C@H](O)COc3c(C)ccc(C)c3C)CC2)cc1	ZINC000819003443	GH	On-Demand	Clean	ADRB2	31	46
COc1ccc(N2CCC(NC[C@H](O)COc3c(C)ccc(C)c3C)CC2)cc1	ZINC000819003443	GH	On-Demand	Clean	ADRB1	32	45
COc1ccc(N2CCC(NC[C@H](O)COc3c(C)ccc(C)c3C)CC2)cc1	ZINC000819003443	GH	On-Demand	Clean	ADRB3	34	50
CC(C)(C)N1CC[C@H](OC(=O)c2cc(-c3ccncc3)nc3ccccc23)C1=O	ZINC000819003451	GH	On-Demand	Anodyne	PRS	46	42
CC(C)(C)N1CC[C@H](OC(=O)c2cc(-c3ccncc3)nc3ccccc23)C1=O	ZINC000819003451	GH	On-Demand	Anodyne	ACACB	15	53
CC(C)(C)N1CC[C@H](OC(=O)c2cc(-c3ccncc3)nc3ccccc23)C1=O	ZINC000819003451	GH	On-Demand	Anodyne	TACR3	16	42
CC(C)(C)N1CC[C@H](OC(=O)c2cc(-c3ccncc3)nc3ccccc23)C1=O	ZINC000819003451	GH	On-Demand	Anodyne	MT-CO2	49	41
CC(C)(C)N1CC[C@@H](OC(=O)c2cc(-c3ccncc3)nc3ccccc23)C1=O	ZINC000819003452	GH	On-Demand	Anodyne	PRS	46	42
CC(C)(C)N1CC[C@@H](OC(=O)c2cc(-c3ccncc3)nc3ccccc23)C1=O	ZINC000819003452	GH	On-Demand	Anodyne	ACACB	15	53
CC(C)(C)N1CC[C@@H](OC(=O)c2cc(-c3ccncc3)nc3ccccc23)C1=O	ZINC000819003452	GH	On-Demand	Anodyne	TACR3	16	42
CC(C)(C)N1CC[C@@H](OC(=O)c2cc(-c3ccncc3)nc3ccccc23)C1=O	ZINC000819003452	GH	On-Demand	Anodyne	MT-CO2	49	41
O=C(CNC[C@@H](O)c1cc2ccccc2o1)N1CCc2ccccc2C1	ZINC000819003455	FF	On-Demand	Anodyne	DPP8	19	44
COc1ccc(N2CCC(NC[C@@H](O)COCc3ccco3)CC2)cc1	ZINC000819003458	FE	On-Demand	Clean	ADRB2	19	44
COc1ccc(N2CCC(NC[C@@H](O)COCc3ccco3)CC2)cc1	ZINC000819003458	FE	On-Demand	Clean	ADRB1	15	40
COc1ccc(N2CCC(NC[C@@H](O)COCc3ccco3)CC2)cc1	ZINC000819003458	FE	On-Demand	Clean	ADRB3	25	46
COc1ccc(N2CCC(NC[C@H](O)COCc3ccco3)CC2)cc1	ZINC000819003459	FE	On-Demand	Clean	ADRB2	19	44
COc1ccc(N2CCC(NC[C@H](O)COCc3ccco3)CC2)cc1	ZINC000819003459	FE	On-Demand	Clean	ADRB1	15	40
COc1ccc(N2CCC(NC[C@H](O)COCc3ccco3)CC2)cc1	ZINC000819003459	FE	On-Demand	Clean	ADRB3	25	46
CN(C)c1ccc(NC(=O)CCNCC(=O)N2CCc3ccccc3C2)cc1	ZINC000819003466	GE	On-Demand	Anodyne	NOD2	42	36
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819003467	ED	On-Demand	Anodyne	SLC6A1	136	38
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819003469	ED	On-Demand	Anodyne	SLC6A1	136	38
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(F)c(F)c1	ZINC000819003479	GH	On-Demand	Clean	ADRB1	15	42
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(F)c(F)c1	ZINC000819003479	GH	On-Demand	Clean	ADRB3	34	46
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(F)c(F)c1	ZINC000819003481	GH	On-Demand	Clean	ADRB1	15	42
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccc(F)c(F)c1	ZINC000819003481	GH	On-Demand	Clean	ADRB3	34	46
CC[C@@H](NC[C@H](O)c1cccnc1)c1nnc2n1CCCCC2	ZINC000819003492	DE	On-Demand	Anodyne	ADRB1	18	41
CC[C@@H](NC[C@H](O)c1cccnc1)c1nnc2n1CCCCC2	ZINC000819003492	DE	On-Demand	Anodyne	ADRB3	59	41
CC[C@@H](NC[C@@H](O)c1cccnc1)c1nnc2n1CCCCC2	ZINC000819003495	DE	On-Demand	Anodyne	ADRB1	18	41
CC[C@@H](NC[C@@H](O)c1cccnc1)c1nnc2n1CCCCC2	ZINC000819003495	DE	On-Demand	Anodyne	ADRB3	59	41
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccccc2F)C1	ZINC000819003499	DD	On-Demand	Anodyne	SLC6A1	157	42
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccccc2F)C1	ZINC000819003500	DD	On-Demand	Anodyne	SLC6A1	157	42
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccccc2F)C1	ZINC000819003502	DD	On-Demand	Anodyne	SLC6A1	157	42
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccccc2F)C1	ZINC000819003504	DD	On-Demand	Anodyne	SLC6A1	157	42
C=CCCn1cc(C(=O)NNC(=O)COc2ccccc2OCC)nn1	ZINC000819003511	FD	On-Demand	Reactive	HCN1	53	35
C=CCCn1cc(C(=O)NNC(=O)COc2ccccc2OCC)nn1	ZINC000819003511	FD	On-Demand	Reactive	HCN4	40	31
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003522	FD	On-Demand	Anodyne	SLC6A1	142	42
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003522	FD	On-Demand	Anodyne	RBP4	48	33
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003522	FD	On-Demand	Anodyne	SFRP1	83	39
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003522	FD	On-Demand	Anodyne	WNT3	54	35
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003523	FD	On-Demand	Anodyne	SLC6A1	142	42
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003523	FD	On-Demand	Anodyne	RBP4	48	33
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003523	FD	On-Demand	Anodyne	SFRP1	83	39
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003523	FD	On-Demand	Anodyne	WNT3	54	35
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003524	FD	On-Demand	Anodyne	SLC6A1	142	42
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003524	FD	On-Demand	Anodyne	RBP4	48	33
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003524	FD	On-Demand	Anodyne	SFRP1	83	39
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003524	FD	On-Demand	Anodyne	WNT3	54	35
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003525	FD	On-Demand	Anodyne	SLC6A1	142	42
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003525	FD	On-Demand	Anodyne	RBP4	48	33
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003525	FD	On-Demand	Anodyne	SFRP1	83	39
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003525	FD	On-Demand	Anodyne	WNT3	54	35
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819003536	FD	On-Demand	Anodyne	SLC6A1	124	44
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819003537	FD	On-Demand	Anodyne	SLC6A1	124	44
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819003538	FD	On-Demand	Anodyne	SLC6A1	124	44
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819003539	FD	On-Demand	Anodyne	SLC6A1	124	44
O=C(Cc1ccc(-n2cnnc2)cc1)NNC(=O)NC1CCCCC1	ZINC000819003540	ED	On-Demand	Reactive	EPHX2	26	43
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)COc1ccc(Br)cc1	ZINC000819003566	FF	On-Demand	Reactive	ADAM17	20	40
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)COc1ccc(Br)cc1	ZINC000819003566	FF	On-Demand	Reactive	TRAR	43	49
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)COc1ccc(Br)cc1	ZINC000819003568	FF	On-Demand	Reactive	ADAM17	20	40
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)COc1ccc(Br)cc1	ZINC000819003568	FF	On-Demand	Reactive	TRAR	43	49
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003589	ED	On-Demand	Anodyne	ADRB2	41	40
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003589	ED	On-Demand	Anodyne	ADRB1	65	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003589	ED	On-Demand	Anodyne	ADRB3	52	47
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003589	ED	On-Demand	Anodyne	CCR1	43	34
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003589	ED	On-Demand	Anodyne	EBP	18	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003590	ED	On-Demand	Anodyne	ADRB2	41	40
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003590	ED	On-Demand	Anodyne	ADRB1	65	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003590	ED	On-Demand	Anodyne	ADRB3	52	47
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003590	ED	On-Demand	Anodyne	CCR1	43	34
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003590	ED	On-Demand	Anodyne	EBP	18	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003591	ED	On-Demand	Anodyne	ADRB2	41	40
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003591	ED	On-Demand	Anodyne	ADRB1	65	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003591	ED	On-Demand	Anodyne	ADRB3	52	47
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003591	ED	On-Demand	Anodyne	CCR1	43	34
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003591	ED	On-Demand	Anodyne	EBP	18	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003592	ED	On-Demand	Anodyne	ADRB2	41	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003592	ED	On-Demand	Anodyne	ADRB1	65	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003592	ED	On-Demand	Anodyne	ADRB3	52	47
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003592	ED	On-Demand	Anodyne	CCR1	43	34
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819003592	ED	On-Demand	Anodyne	EBP	18	41
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819003593	CD	On-Demand	Anodyne	CHRM1	21	45
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819003593	CD	On-Demand	Anodyne	SLC6A3	29	44
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819003593	CD	On-Demand	Anodyne	CHRM3	16	40
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819003593	CD	On-Demand	Anodyne	ADRB3	53	39
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819003593	CD	On-Demand	Anodyne	BIRC2	27	43
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819003593	CD	On-Demand	Anodyne	Q8WSF8_APLCA	33	40
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819003594	CD	On-Demand	Anodyne	CHRM1	21	45
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819003594	CD	On-Demand	Anodyne	SLC6A3	29	44
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819003594	CD	On-Demand	Anodyne	CHRM3	16	40
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819003594	CD	On-Demand	Anodyne	ADRB3	53	39
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819003594	CD	On-Demand	Anodyne	BIRC2	27	43
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819003594	CD	On-Demand	Anodyne	Q8WSF8_APLCA	33	40
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819003595	CD	On-Demand	Anodyne	CHRM1	21	45
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819003595	CD	On-Demand	Anodyne	SLC6A3	29	44
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819003595	CD	On-Demand	Anodyne	CHRM3	16	40
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819003595	CD	On-Demand	Anodyne	ADRB3	53	39
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819003595	CD	On-Demand	Anodyne	BIRC2	27	43
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819003595	CD	On-Demand	Anodyne	Q8WSF8_APLCA	33	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819003596	CD	On-Demand	Anodyne	CHRM1	21	45
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819003596	CD	On-Demand	Anodyne	SLC6A3	29	44
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819003596	CD	On-Demand	Anodyne	CHRM3	16	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819003596	CD	On-Demand	Anodyne	ADRB3	53	39
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819003596	CD	On-Demand	Anodyne	BIRC2	27	43
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819003596	CD	On-Demand	Anodyne	Q8WSF8_APLCA	33	40
COC(=O)N1CCC[C@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819003597	FE	On-Demand	Anodyne	ADRB1	23	41
COC(=O)N1CCC[C@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819003597	FE	On-Demand	Anodyne	ADRB3	40	42
COC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819003598	FE	On-Demand	Anodyne	ADRB1	23	41
COC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819003598	FE	On-Demand	Anodyne	ADRB3	40	42
COC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819003599	FE	On-Demand	Anodyne	ADRB1	23	41
COC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819003599	FE	On-Demand	Anodyne	ADRB3	40	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819003600	FE	On-Demand	Anodyne	ADRB1	23	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819003600	FE	On-Demand	Anodyne	ADRB3	40	42
COC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819003601	ED	On-Demand	Anodyne	SFRP1	40	32
COC(=O)N1CCC[C@H](NCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819003602	ED	On-Demand	Anodyne	SFRP1	40	32
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2c(C)cccc2C)C1	ZINC000819003603	ED	On-Demand	Anodyne	ADRB2	33	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2c(C)cccc2C)C1	ZINC000819003603	ED	On-Demand	Anodyne	ADRB1	32	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2c(C)cccc2C)C1	ZINC000819003603	ED	On-Demand	Anodyne	CCR8	56	36
COC(=O)N1CCC[C@H](NC[C@H](O)COc2c(C)cccc2C)C1	ZINC000819003604	ED	On-Demand	Anodyne	ADRB2	33	41
COC(=O)N1CCC[C@H](NC[C@H](O)COc2c(C)cccc2C)C1	ZINC000819003604	ED	On-Demand	Anodyne	ADRB1	32	41
COC(=O)N1CCC[C@H](NC[C@H](O)COc2c(C)cccc2C)C1	ZINC000819003604	ED	On-Demand	Anodyne	CCR8	56	36
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2c(C)cccc2C)C1	ZINC000819003605	ED	On-Demand	Anodyne	ADRB2	33	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2c(C)cccc2C)C1	ZINC000819003605	ED	On-Demand	Anodyne	ADRB1	32	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2c(C)cccc2C)C1	ZINC000819003605	ED	On-Demand	Anodyne	CCR8	56	36
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2c(C)cccc2C)C1	ZINC000819003606	ED	On-Demand	Anodyne	ADRB2	33	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2c(C)cccc2C)C1	ZINC000819003606	ED	On-Demand	Anodyne	ADRB1	32	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2c(C)cccc2C)C1	ZINC000819003606	ED	On-Demand	Anodyne	CCR8	56	36
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(C)c2)C1	ZINC000819003607	DD	On-Demand	Anodyne	ADRB2	41	54
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(C)c2)C1	ZINC000819003607	DD	On-Demand	Anodyne	ADRB1	52	54
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(C)c2)C1	ZINC000819003607	DD	On-Demand	Anodyne	ADRB3	42	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc(C)c2)C1	ZINC000819003607	DD	On-Demand	Anodyne	ACOX1	53	36
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(C)c2)C1	ZINC000819003608	DD	On-Demand	Anodyne	ADRB2	41	54
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(C)c2)C1	ZINC000819003608	DD	On-Demand	Anodyne	ADRB1	52	54
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(C)c2)C1	ZINC000819003608	DD	On-Demand	Anodyne	ADRB3	42	41
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc(C)c2)C1	ZINC000819003608	DD	On-Demand	Anodyne	ACOX1	53	36
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(C)c2)C1	ZINC000819003609	DD	On-Demand	Anodyne	ADRB2	41	54
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(C)c2)C1	ZINC000819003609	DD	On-Demand	Anodyne	ADRB1	52	54
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(C)c2)C1	ZINC000819003609	DD	On-Demand	Anodyne	ADRB3	42	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc(C)c2)C1	ZINC000819003609	DD	On-Demand	Anodyne	ACOX1	53	36
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(C)c2)C1	ZINC000819003610	DD	On-Demand	Anodyne	ADRB2	41	54
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(C)c2)C1	ZINC000819003610	DD	On-Demand	Anodyne	ADRB1	52	54
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(C)c2)C1	ZINC000819003610	DD	On-Demand	Anodyne	ADRB3	42	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc(C)c2)C1	ZINC000819003610	DD	On-Demand	Anodyne	ACOX1	53	36
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C)cc2)C1	ZINC000819003615	DD	On-Demand	Anodyne	ADRB2	44	49
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C)cc2)C1	ZINC000819003615	DD	On-Demand	Anodyne	ADRB1	61	43
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C)cc2)C1	ZINC000819003615	DD	On-Demand	Anodyne	ADRB3	44	48
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C)cc2)C1	ZINC000819003615	DD	On-Demand	Anodyne	ACOX1	51	35
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C)cc2)C1	ZINC000819003616	DD	On-Demand	Anodyne	ADRB2	44	49
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C)cc2)C1	ZINC000819003616	DD	On-Demand	Anodyne	ADRB1	61	43
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C)cc2)C1	ZINC000819003616	DD	On-Demand	Anodyne	ADRB3	44	48
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C)cc2)C1	ZINC000819003616	DD	On-Demand	Anodyne	ACOX1	51	35
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C)cc2)C1	ZINC000819003617	DD	On-Demand	Anodyne	ADRB2	44	49
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C)cc2)C1	ZINC000819003617	DD	On-Demand	Anodyne	ADRB1	61	43
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C)cc2)C1	ZINC000819003617	DD	On-Demand	Anodyne	ADRB3	44	48
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C)cc2)C1	ZINC000819003617	DD	On-Demand	Anodyne	ACOX1	51	35
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C)cc2)C1	ZINC000819003618	DD	On-Demand	Anodyne	ADRB2	44	49
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C)cc2)C1	ZINC000819003618	DD	On-Demand	Anodyne	ADRB1	61	43
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C)cc2)C1	ZINC000819003618	DD	On-Demand	Anodyne	ADRB3	44	48
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C)cc2)C1	ZINC000819003618	DD	On-Demand	Anodyne	ACOX1	51	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccc(F)cc1	ZINC000819003629	DE	On-Demand	Anodyne	PAPA1_CARPA	27	45
COC(=O)N1CCC[C@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819003630	EE	On-Demand	Anodyne	GRM5	18	41
COC(=O)N1CCC[C@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819003630	EE	On-Demand	Anodyne	EPHX2	18	47
COC(=O)N1CCC[C@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819003630	EE	On-Demand	Anodyne	MCHR1	34	42
COC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819003631	EE	On-Demand	Anodyne	GRM5	18	41
COC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819003631	EE	On-Demand	Anodyne	EPHX2	18	47
COC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819003631	EE	On-Demand	Anodyne	MCHR1	34	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003636	EF	On-Demand	Anodyne	RBP4	87	37
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003636	EF	On-Demand	Anodyne	SFRP1	118	36
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003636	EF	On-Demand	Anodyne	WNT3	82	36
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003637	EF	On-Demand	Anodyne	RBP4	87	37
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003637	EF	On-Demand	Anodyne	SFRP1	118	36
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003637	EF	On-Demand	Anodyne	WNT3	82	36
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003638	EF	On-Demand	Anodyne	RBP4	87	37
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003638	EF	On-Demand	Anodyne	SFRP1	118	36
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003638	EF	On-Demand	Anodyne	WNT3	82	36
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003639	EF	On-Demand	Anodyne	RBP4	87	37
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003639	EF	On-Demand	Anodyne	SFRP1	118	36
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819003639	EF	On-Demand	Anodyne	WNT3	82	36
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819003654	FF	On-Demand	Anodyne	ADRB2	39	40
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819003654	FF	On-Demand	Anodyne	ADRB1	54	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819003654	FF	On-Demand	Anodyne	ADRB3	38	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819003655	FF	On-Demand	Anodyne	ADRB2	39	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819003655	FF	On-Demand	Anodyne	ADRB1	54	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819003655	FF	On-Demand	Anodyne	ADRB3	38	46
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819003656	FF	On-Demand	Anodyne	ADRB2	39	40
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819003656	FF	On-Demand	Anodyne	ADRB1	54	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819003656	FF	On-Demand	Anodyne	ADRB3	38	46
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819003657	FF	On-Demand	Anodyne	ADRB2	39	40
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819003657	FF	On-Demand	Anodyne	ADRB1	54	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819003657	FF	On-Demand	Anodyne	ADRB3	38	46
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819003658	ED	On-Demand	Mild	ADRB2	41	38
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819003658	ED	On-Demand	Mild	ADRB1	65	44
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819003658	ED	On-Demand	Mild	ADRB3	48	44
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819003658	ED	On-Demand	Mild	LGMN	50	35
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819003659	ED	On-Demand	Mild	ADRB2	41	38
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819003659	ED	On-Demand	Mild	ADRB1	65	44
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819003659	ED	On-Demand	Mild	ADRB3	48	44
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819003659	ED	On-Demand	Mild	LGMN	50	35
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819003660	ED	On-Demand	Mild	ADRB2	41	38
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819003660	ED	On-Demand	Mild	ADRB1	65	44
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819003660	ED	On-Demand	Mild	ADRB3	48	44
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819003660	ED	On-Demand	Mild	LGMN	50	35
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819003661	ED	On-Demand	Mild	ADRB2	41	38
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819003661	ED	On-Demand	Mild	ADRB1	65	44
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819003661	ED	On-Demand	Mild	ADRB3	48	44
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819003661	ED	On-Demand	Mild	LGMN	50	35
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819003662	FE	On-Demand	Anodyne	RBP4	85	36
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819003662	FE	On-Demand	Anodyne	SFRP1	117	35
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819003662	FE	On-Demand	Anodyne	WNT3	83	35
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819003663	FE	On-Demand	Anodyne	RBP4	85	36
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819003663	FE	On-Demand	Anodyne	SFRP1	117	35
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819003663	FE	On-Demand	Anodyne	WNT3	83	35
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819003664	FE	On-Demand	Anodyne	RBP4	85	36
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819003664	FE	On-Demand	Anodyne	SFRP1	117	35
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819003664	FE	On-Demand	Anodyne	WNT3	83	35
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819003665	FE	On-Demand	Anodyne	RBP4	85	36
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819003665	FE	On-Demand	Anodyne	SFRP1	117	35
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819003665	FE	On-Demand	Anodyne	WNT3	83	35
O[C@H](CNCc1cccc(OCC(F)F)c1)C1CC1	ZINC000819003667	CE	On-Demand	Anodyne	PDS	61	37
O[C@@H](CNCc1cccc(OCC(F)F)c1)C1CC1	ZINC000819003668	CE	On-Demand	Anodyne	PDS	61	37
O[C@H](CNCc1cccc(OCC(F)F)c1)c1cc2ccccc2o1	ZINC000819003669	EH	On-Demand	Anodyne	PDS	54	36
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819003673	EE	On-Demand	Anodyne	ADRB3	30	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819003673	EE	On-Demand	Anodyne	MAPK1	48	37
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819003674	EE	On-Demand	Anodyne	ADRB3	30	40
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819003674	EE	On-Demand	Anodyne	MAPK1	48	37
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819003675	EE	On-Demand	Anodyne	ADRB3	30	40
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819003675	EE	On-Demand	Anodyne	MAPK1	48	37
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819003676	EE	On-Demand	Anodyne	ADRB3	30	40
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819003676	EE	On-Demand	Anodyne	MAPK1	48	37
COC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819003677	EF	On-Demand	Anodyne	CCR8	48	35
COC(=O)N1CCC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819003678	EF	On-Demand	Anodyne	CCR8	48	35
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1cccc(F)c1	ZINC000819003680	EG	On-Demand	Anodyne	ADRB1	24	40
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1cccc(F)c1	ZINC000819003680	EG	On-Demand	Anodyne	ADRB3	25	40
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1cccc(F)c1	ZINC000819003680	EG	On-Demand	Anodyne	PDS	61	43
O[C@H](CNCc1cccc(OCC(F)F)c1)c1cccc(F)c1	ZINC000819003681	EG	On-Demand	Anodyne	ADRB1	24	40
O[C@H](CNCc1cccc(OCC(F)F)c1)c1cccc(F)c1	ZINC000819003681	EG	On-Demand	Anodyne	ADRB3	25	40
O[C@H](CNCc1cccc(OCC(F)F)c1)c1cccc(F)c1	ZINC000819003681	EG	On-Demand	Anodyne	PDS	61	43
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccccc1	ZINC000819003698	FH	On-Demand	Clean	ADRB2	20	43
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccccc1	ZINC000819003698	FH	On-Demand	Clean	ADRB1	27	41
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccccc1	ZINC000819003698	FH	On-Demand	Clean	ADRB3	47	46
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccccc1	ZINC000819003699	FH	On-Demand	Clean	ADRB2	20	43
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccccc1	ZINC000819003699	FH	On-Demand	Clean	ADRB1	27	41
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)c1ccccc1	ZINC000819003699	FH	On-Demand	Clean	ADRB3	47	46
CCOc1ccccc1OCC(=O)NNC(=O)/C=C\[C@H]1CCCO1	ZINC000819003704	ED	On-Demand	Reactive	HCN1	40	31
CCOc1ccccc1OCC(=O)NNC(=O)/C=C\[C@H]1CCCO1	ZINC000819003704	ED	On-Demand	Reactive	HCN4	40	31
CCOc1ccccc1OCC(=O)NNC(=O)/C=C/[C@@H]1CCCO1	ZINC000819003705	ED	On-Demand	Reactive	HCN1	40	31
CCOc1ccccc1OCC(=O)NNC(=O)/C=C/[C@@H]1CCCO1	ZINC000819003705	ED	On-Demand	Reactive	HCN4	40	31
CCOc1ccccc1OCC(=O)NNC(=O)/C=C/[C@H]1CCCO1	ZINC000819003706	ED	On-Demand	Reactive	HCN1	40	31
CCOc1ccccc1OCC(=O)NNC(=O)/C=C/[C@H]1CCCO1	ZINC000819003706	ED	On-Demand	Reactive	HCN4	40	31
CCOc1ccccc1OCC(=O)NNC(=O)/C=C\[C@@H]1CCCO1	ZINC000819003707	ED	On-Demand	Reactive	HCN1	40	31
CCOc1ccccc1OCC(=O)NNC(=O)/C=C\[C@@H]1CCCO1	ZINC000819003707	ED	On-Demand	Reactive	HCN4	40	31
COc1ccc(N2CCC(NCCC(=O)Nc3cccc(F)c3)CC2)cc1	ZINC000819003711	FG	On-Demand	Clean	NPY1R	29	43
COc1ccc(N2CCC(NCCC(=O)Nc3cccc(F)c3)CC2)cc1	ZINC000819003711	FG	On-Demand	Clean	CCR3	47	41
COc1ccc(N2CCC(NCCC(=O)Nc3cccc(F)c3)CC2)cc1	ZINC000819003711	FG	On-Demand	Clean	MTNR1A	21	43
COc1ccc(N2CCC(NCCC(=O)Nc3cccc(F)c3)CC2)cc1	ZINC000819003711	FG	On-Demand	Clean	MTNR1B	19	43
COc1ccc(N2CCC(NCCC(=O)Nc3cccc(F)c3)CC2)cc1	ZINC000819003711	FG	On-Demand	Clean	MCHR1	39	40
CON(C)C(=O)CCNCCCN1CCC[C@@H](C(N)=O)C1	ZINC000819003722	DB	On-Demand	Anodyne	SLC6A1	64	34
CON(C)C(=O)CCNCCCN1CCC[C@H](C(N)=O)C1	ZINC000819003724	DB	On-Demand	Anodyne	SLC6A1	64	34
COc1ccc(N2CCC(NC[C@@H](O)COCc3cccs3)CC2)cc1	ZINC000819003725	GF	On-Demand	Clean	ADRB2	23	48
COc1ccc(N2CCC(NC[C@@H](O)COCc3cccs3)CC2)cc1	ZINC000819003725	GF	On-Demand	Clean	ADRB1	20	46
COc1ccc(N2CCC(NC[C@@H](O)COCc3cccs3)CC2)cc1	ZINC000819003725	GF	On-Demand	Clean	ADRB3	29	48
COc1ccc(N2CCC(NC[C@H](O)COCc3cccs3)CC2)cc1	ZINC000819003729	GF	On-Demand	Clean	ADRB2	23	48
COc1ccc(N2CCC(NC[C@H](O)COCc3cccs3)CC2)cc1	ZINC000819003729	GF	On-Demand	Clean	ADRB1	20	46
COc1ccc(N2CCC(NC[C@H](O)COCc3cccs3)CC2)cc1	ZINC000819003729	GF	On-Demand	Clean	ADRB3	29	48
O=C(CNC[C@@H](O)c1ccc(Cl)cc1Cl)N1CCc2ccccc2C1	ZINC000819003730	GG	On-Demand	Anodyne	DPP8	17	44
O=C(CNC[C@H](O)c1ccc(Cl)cc1Cl)N1CCc2ccccc2C1	ZINC000819003731	GG	On-Demand	Anodyne	DPP8	17	44
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)C1CC1	ZINC000819003733	EF	On-Demand	Clean	ADRB3	17	41
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)C1CC1	ZINC000819003734	EF	On-Demand	Clean	ADRB3	17	41
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000819003753	GF	On-Demand	Clean	ADRB2	43	50
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000819003753	GF	On-Demand	Clean	ADRB1	55	45
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000819003753	GF	On-Demand	Clean	ADRB3	51	57
COc1ccc(N2CCC(NC[C@H](O)COc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000819003753	GF	On-Demand	Clean	ABCB1	29	44
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000819003755	GF	On-Demand	Clean	ADRB2	43	50
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000819003755	GF	On-Demand	Clean	ADRB1	55	45
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000819003755	GF	On-Demand	Clean	ADRB3	51	57
COc1ccc(N2CCC(NC[C@@H](O)COc3ccc(C(C)=O)cc3)CC2)cc1	ZINC000819003755	GF	On-Demand	Clean	ABCB1	29	44
Cc1ccccc1[C@@H](O)CNCC(=O)N1CCc2ccccc2C1	ZINC000819003767	DE	On-Demand	Anodyne	DPP8	22	47
CC(=O)Nc1cccc(CC(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	ZINC000819003774	FE	On-Demand	Reactive	TSHR	41	31
CC(=O)Nc1cccc(CC(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	ZINC000819003774	FE	On-Demand	Reactive	KCNK3	60	35
CC(=O)Nc1cccc(CC(=O)NNC(=O)COc2cc(C)cc(C)c2)c1	ZINC000819003774	FE	On-Demand	Reactive	KCNK9	48	34
O=C(CNC[C@@H](O)c1cccc(C(F)(F)F)c1)N1CCc2ccccc2C1	ZINC000819003787	GF	On-Demand	Anodyne	CCR2	57	38
O=C(CNC[C@@H](O)c1cccc(C(F)(F)F)c1)N1CCc2ccccc2C1	ZINC000819003787	GF	On-Demand	Anodyne	DPP8	18	42
O=C(CNC[C@H](O)c1cccc(C(F)(F)F)c1)N1CCc2ccccc2C1	ZINC000819003788	GF	On-Demand	Anodyne	CCR2	57	38
O=C(CNC[C@H](O)c1cccc(C(F)(F)F)c1)N1CCc2ccccc2C1	ZINC000819003788	GF	On-Demand	Anodyne	DPP8	18	42
COc1ccc(N2CCC(NC[C@@H](O)CN(C)CCC#N)CC2)cc1	ZINC000819003791	ED	On-Demand	Mild	ADRB3	19	41
COc1ccc(N2CCC(NC[C@H](O)CN(C)CCC#N)CC2)cc1	ZINC000819003793	ED	On-Demand	Mild	ADRB3	19	41
COc1ccc(N2CCC(NC[C@H](O)Cn3cc([N+](=O)[O-])cn3)CC2)cc1	ZINC000819003798	GD	On-Demand	Clean	ADRB3	22	42
COc1ccc(N2CCC(NC[C@@H](O)Cn3cc([N+](=O)[O-])cn3)CC2)cc1	ZINC000819003800	GD	On-Demand	Clean	ADRB3	22	42
Cc1ccccc1C1(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819003806	GH	On-Demand	Anodyne	GPR119	35	46
COc1ccc(N2CC[C@H](CNc3ncnc4ccccc34)C2)cc1	ZINC000819003807	EH	On-Demand	Clean	PDE3A	44	40
COc1ccc(N2CC[C@H](CNc3ncnc4ccccc34)C2)cc1	ZINC000819003807	EH	On-Demand	Clean	PDE3B	48	40
Cc1cc(F)ccc1[C@@H](O)CNCCCN1CCC[C@@H](C(N)=O)C1	ZINC000819003808	ED	On-Demand	Anodyne	SLC6A1	145	43
Cc1cc(F)ccc1[C@@H](O)CNCCCN1CCC[C@@H](C(N)=O)C1	ZINC000819003808	ED	On-Demand	Anodyne	CCR3	41	37
Cc1ccccc1C1(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819003810	GH	On-Demand	Anodyne	GPR119	35	46
Cc1cc(F)ccc1[C@@H](O)CNCCCN1CCC[C@H](C(N)=O)C1	ZINC000819003813	ED	On-Demand	Anodyne	SLC6A1	145	43
Cc1cc(F)ccc1[C@@H](O)CNCCCN1CCC[C@H](C(N)=O)C1	ZINC000819003813	ED	On-Demand	Anodyne	CCR3	41	37
O[C@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)C(F)(F)F	ZINC000819003862	FF	On-Demand	Clean	ADRB3	19	41
O[C@@H](CNC1CCN(c2ccc(OC(F)F)cc2)CC1)C(F)(F)F	ZINC000819003863	FF	On-Demand	Clean	ADRB3	19	41
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCC[C@@H]1C	ZINC000819003867	EE	On-Demand	Reactive	HCN1	45	35
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCC[C@@H]1C	ZINC000819003867	EE	On-Demand	Reactive	HCN4	43	35
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCC[C@H]1C	ZINC000819003868	EE	On-Demand	Reactive	HCN1	45	35
CCOc1ccccc1OCC(=O)NNC(=O)[C@H]1CCCC[C@H]1C	ZINC000819003868	EE	On-Demand	Reactive	HCN4	43	35
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCC[C@@H]1C	ZINC000819003869	EE	On-Demand	Reactive	HCN1	45	35
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCC[C@@H]1C	ZINC000819003869	EE	On-Demand	Reactive	HCN4	43	35
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCC[C@H]1C	ZINC000819003870	EE	On-Demand	Reactive	HCN1	45	35
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCC[C@H]1C	ZINC000819003870	EE	On-Demand	Reactive	HCN4	43	35
CCOc1ccccc1OCC(=O)NNC(=O)C[C@@H](C)n1cccn1	ZINC000819003871	ED	On-Demand	Reactive	HCN1	52	33
CCOc1ccccc1OCC(=O)NNC(=O)C[C@@H](C)n1cccn1	ZINC000819003871	ED	On-Demand	Reactive	HCN4	47	33
CCOc1ccccc1OCC(=O)NNC(=O)C[C@H](C)n1cccn1	ZINC000819003872	ED	On-Demand	Reactive	HCN1	52	33
CCOc1ccccc1OCC(=O)NNC(=O)C[C@H](C)n1cccn1	ZINC000819003872	ED	On-Demand	Reactive	HCN4	47	33
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccc(F)cn2)C1	ZINC000819003875	DC	On-Demand	Anodyne	SLC6A1	104	36
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819003876	DC	On-Demand	Anodyne	SLC6A1	104	36
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819003877	DC	On-Demand	Anodyne	SLC6A1	104	36
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccc(F)cn2)C1	ZINC000819003878	DC	On-Demand	Anodyne	SLC6A1	104	36
COC(=O)N1CCC[C@@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819003885	DD	On-Demand	Anodyne	ACE	71	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819003885	DD	On-Demand	Anodyne	FKBP1A	44	37
COC(=O)N1CCC[C@@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819003885	DD	On-Demand	Anodyne	SLC6A3	16	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819003885	DD	On-Demand	Anodyne	MME	25	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819003885	DD	On-Demand	Anodyne	PREP	68	39
COC(=O)N1CCC[C@@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819003885	DD	On-Demand	Anodyne	REN	33	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819003885	DD	On-Demand	Anodyne	ABCB1	48	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819003885	DD	On-Demand	Anodyne	ACE2	33	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819003885	DD	On-Demand	Anodyne	BIRC2	50	47
COC(=O)N1CCC[C@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819003886	DD	On-Demand	Anodyne	ACE	71	40
COC(=O)N1CCC[C@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819003886	DD	On-Demand	Anodyne	FKBP1A	44	37
COC(=O)N1CCC[C@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819003886	DD	On-Demand	Anodyne	SLC6A3	16	40
COC(=O)N1CCC[C@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819003886	DD	On-Demand	Anodyne	MME	25	40
COC(=O)N1CCC[C@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819003886	DD	On-Demand	Anodyne	PREP	68	39
COC(=O)N1CCC[C@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819003886	DD	On-Demand	Anodyne	REN	33	40
COC(=O)N1CCC[C@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819003886	DD	On-Demand	Anodyne	ABCB1	48	46
COC(=O)N1CCC[C@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819003886	DD	On-Demand	Anodyne	ACE2	33	40
COC(=O)N1CCC[C@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819003886	DD	On-Demand	Anodyne	BIRC2	50	47
COC(=O)N1CCC[C@@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819003887	DD	On-Demand	Anodyne	ACE	71	40
COC(=O)N1CCC[C@@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819003887	DD	On-Demand	Anodyne	FKBP1A	44	37
COC(=O)N1CCC[C@@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819003887	DD	On-Demand	Anodyne	SLC6A3	16	40
COC(=O)N1CCC[C@@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819003887	DD	On-Demand	Anodyne	MME	25	40
COC(=O)N1CCC[C@@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819003887	DD	On-Demand	Anodyne	PREP	68	39
COC(=O)N1CCC[C@@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819003887	DD	On-Demand	Anodyne	REN	33	40
COC(=O)N1CCC[C@@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819003887	DD	On-Demand	Anodyne	ABCB1	48	46
COC(=O)N1CCC[C@@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819003887	DD	On-Demand	Anodyne	ACE2	33	40
COC(=O)N1CCC[C@@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819003887	DD	On-Demand	Anodyne	BIRC2	50	47
COC(=O)N1CCC[C@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819003888	DD	On-Demand	Anodyne	ACE	71	40
COC(=O)N1CCC[C@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819003888	DD	On-Demand	Anodyne	FKBP1A	44	37
COC(=O)N1CCC[C@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819003888	DD	On-Demand	Anodyne	SLC6A3	16	40
COC(=O)N1CCC[C@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819003888	DD	On-Demand	Anodyne	MME	25	40
COC(=O)N1CCC[C@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819003888	DD	On-Demand	Anodyne	PREP	68	39
COC(=O)N1CCC[C@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819003888	DD	On-Demand	Anodyne	REN	33	40
COC(=O)N1CCC[C@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819003888	DD	On-Demand	Anodyne	ABCB1	48	46
COC(=O)N1CCC[C@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819003888	DD	On-Demand	Anodyne	ACE2	33	40
COC(=O)N1CCC[C@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819003888	DD	On-Demand	Anodyne	BIRC2	50	47
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(Br)cc1	ZINC000819003890	GH	On-Demand	Anodyne	PDS	71	39
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccc(Br)cc1	ZINC000819003891	GH	On-Demand	Anodyne	PDS	71	39
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819003892	CD	On-Demand	Anodyne	SLC6A3	33	43
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819003893	CD	On-Demand	Anodyne	SLC6A3	33	43
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819003894	CD	On-Demand	Anodyne	SLC6A3	33	43
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819003895	CD	On-Demand	Anodyne	SLC6A3	33	43
C[C@@H]1[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCC[C@H]1C	ZINC000819003901	FH	On-Demand	Mild	PAPA1_CARPA	37	46
C[C@@H]1[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCC[C@H]1C	ZINC000819003903	FH	On-Demand	Mild	PAPA1_CARPA	37	46
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003910	GF	On-Demand	Anodyne	ADRB2	37	40
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003910	GF	On-Demand	Anodyne	ADRB1	52	39
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003910	GF	On-Demand	Anodyne	HRH1	29	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003910	GF	On-Demand	Anodyne	GRIN1	23	40
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003910	GF	On-Demand	Anodyne	ADRB3	45	46
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003910	GF	On-Demand	Anodyne	ACOX1	65	35
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003910	GF	On-Demand	Anodyne	CCR3	39	50
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003911	GF	On-Demand	Anodyne	ADRB2	37	40
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003911	GF	On-Demand	Anodyne	ADRB1	52	39
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003911	GF	On-Demand	Anodyne	HRH1	29	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003911	GF	On-Demand	Anodyne	GRIN1	23	40
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003911	GF	On-Demand	Anodyne	ADRB3	45	46
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003911	GF	On-Demand	Anodyne	ACOX1	65	35
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003911	GF	On-Demand	Anodyne	CCR3	39	50
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003912	GF	On-Demand	Anodyne	ADRB2	37	40
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003912	GF	On-Demand	Anodyne	ADRB1	52	39
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003912	GF	On-Demand	Anodyne	HRH1	29	41
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003912	GF	On-Demand	Anodyne	GRIN1	23	40
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003912	GF	On-Demand	Anodyne	ADRB3	45	46
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003912	GF	On-Demand	Anodyne	ACOX1	65	35
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003912	GF	On-Demand	Anodyne	CCR3	39	50
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003913	GF	On-Demand	Anodyne	ADRB2	37	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003913	GF	On-Demand	Anodyne	ADRB1	52	39
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003913	GF	On-Demand	Anodyne	HRH1	29	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003913	GF	On-Demand	Anodyne	GRIN1	23	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003913	GF	On-Demand	Anodyne	ADRB3	45	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003913	GF	On-Demand	Anodyne	ACOX1	65	35
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819003913	GF	On-Demand	Anodyne	CCR3	39	50
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819003926	GD	On-Demand	Anodyne	ADRB2	48	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819003926	GD	On-Demand	Anodyne	ADRB1	77	49
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819003926	GD	On-Demand	Anodyne	ADRB3	60	44
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819003926	GD	On-Demand	Anodyne	ABCB1	28	43
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819003927	GD	On-Demand	Anodyne	ADRB2	48	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819003927	GD	On-Demand	Anodyne	ADRB1	77	49
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819003927	GD	On-Demand	Anodyne	ADRB3	60	44
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819003927	GD	On-Demand	Anodyne	ABCB1	28	43
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819003928	GD	On-Demand	Anodyne	ADRB2	48	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819003928	GD	On-Demand	Anodyne	ADRB1	77	49
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819003928	GD	On-Demand	Anodyne	ADRB3	60	44
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819003928	GD	On-Demand	Anodyne	ABCB1	28	43
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819003929	GD	On-Demand	Anodyne	ADRB2	48	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819003929	GD	On-Demand	Anodyne	ADRB1	77	49
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819003929	GD	On-Demand	Anodyne	ADRB3	60	44
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819003929	GD	On-Demand	Anodyne	ABCB1	28	43
COC(=O)N1CCC[C@H](NCCC(=O)Nc2cccc(F)c2)C1	ZINC000819003930	DD	On-Demand	Anodyne	CCR3	56	41
COC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccc(F)c2)C1	ZINC000819003931	DD	On-Demand	Anodyne	CCR3	56	41
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(SC)cc2)C1	ZINC000819003932	FD	On-Demand	Anodyne	ADRB1	52	41
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(SC)cc2)C1	ZINC000819003932	FD	On-Demand	Anodyne	ADRB3	40	46
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(SC)cc2)C1	ZINC000819003933	FD	On-Demand	Anodyne	ADRB1	52	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(SC)cc2)C1	ZINC000819003933	FD	On-Demand	Anodyne	ADRB3	40	46
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(SC)cc2)C1	ZINC000819003934	FD	On-Demand	Anodyne	ADRB1	52	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(SC)cc2)C1	ZINC000819003934	FD	On-Demand	Anodyne	ADRB3	40	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(SC)cc2)C1	ZINC000819003935	FD	On-Demand	Anodyne	ADRB1	52	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(SC)cc2)C1	ZINC000819003935	FD	On-Demand	Anodyne	ADRB3	40	46
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(F)cc1	ZINC000819003945	BE	On-Demand	Anodyne	SSTR3	18	41
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(F)cc1	ZINC000819003946	BE	On-Demand	Anodyne	SSTR3	18	41
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(F)cc1	ZINC000819003947	BE	On-Demand	Anodyne	SSTR3	18	41
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(F)cc1	ZINC000819003948	BE	On-Demand	Anodyne	SSTR3	18	41
O=C(/C=C\[C@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	ZINC000819003960	FG	On-Demand	Anodyne	TEK	17	40
O=C(/C=C\[C@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	ZINC000819003960	FG	On-Demand	Anodyne	LIPG	45	37
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	ZINC000819003961	FG	On-Demand	Anodyne	TEK	17	40
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	ZINC000819003961	FG	On-Demand	Anodyne	LIPG	45	37
O=C(/C=C/[C@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	ZINC000819003962	FG	On-Demand	Anodyne	TEK	17	40
O=C(/C=C/[C@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	ZINC000819003962	FG	On-Demand	Anodyne	LIPG	45	37
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	ZINC000819003963	FG	On-Demand	Anodyne	TEK	17	40
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCOCC1	ZINC000819003963	FG	On-Demand	Anodyne	LIPG	45	37
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(Cl)c(F)c1	ZINC000819003970	FH	On-Demand	Anodyne	ADRB1	22	41
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(Cl)c(F)c1	ZINC000819003970	FH	On-Demand	Anodyne	ADRB3	20	41
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(Cl)c(F)c1	ZINC000819003970	FH	On-Demand	Anodyne	PDS	77	38
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccc(Cl)c(F)c1	ZINC000819003971	FH	On-Demand	Anodyne	ADRB1	22	41
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccc(Cl)c(F)c1	ZINC000819003971	FH	On-Demand	Anodyne	ADRB3	20	41
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccc(Cl)c(F)c1	ZINC000819003971	FH	On-Demand	Anodyne	PDS	77	38
COc1ccc(N2CC[C@H](CNc3ncnc4oc(C)c(C)c34)C2)cc1	ZINC000819003991	FH	On-Demand	Clean	TNK2	43	43
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cccc3ccccc23)C1	ZINC000819004001	FE	On-Demand	Anodyne	ADRB2	21	44
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cccc3ccccc23)C1	ZINC000819004001	FE	On-Demand	Anodyne	SLC6A1	141	40
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cccc3ccccc23)C1	ZINC000819004002	FE	On-Demand	Anodyne	ADRB2	21	44
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cccc3ccccc23)C1	ZINC000819004002	FE	On-Demand	Anodyne	SLC6A1	141	40
COc1ccc(N2CCN(C(=O)C[C@H](C)n3cccn3)CC2)cc1	ZINC000819004004	EE	On-Demand	Clean	SSTR1	43	35
COc1ccc(N2CCN(C(=O)C[C@@H](C)n3cccn3)CC2)cc1	ZINC000819004005	EE	On-Demand	Clean	SSTR1	43	35
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)C2CC2)C1	ZINC000819004019	CB	On-Demand	Anodyne	SLC6A1	44	35
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)C2CC2)C1	ZINC000819004020	CB	On-Demand	Anodyne	SLC6A1	44	35
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)C2CC2)C1	ZINC000819004021	CB	On-Demand	Anodyne	SLC6A1	44	35
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)C2CC2)C1	ZINC000819004022	CB	On-Demand	Anodyne	SLC6A1	44	35
C=CCNC(=S)NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819004059	FD	On-Demand	Reactive	PAPA1_CARPA	40	48
C=CCNC(=S)NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819004060	FD	On-Demand	Reactive	PAPA1_CARPA	40	48
COc1cccc([S@@](=O)CC(=O)NNC(=O)NC2CCCCC2)c1	ZINC000819004061	FD	On-Demand	Reactive	FAAH	23	42
COc1cccc([S@@](=O)CC(=O)NNC(=O)NC2CCCCC2)c1	ZINC000819004061	FD	On-Demand	Reactive	EPHX2	19	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ccc(OC)cc3)CC1)C2	ZINC000819004065	GE	On-Demand	Clean	SSTR1	75	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ccc(OC)cc3)CC1)C2	ZINC000819004065	GE	On-Demand	Clean	ADAM10	37	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ccc(OC)cc3)CC1)C2	ZINC000819004065	GE	On-Demand	Clean	NPBWR1	83	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ccc(OC)cc3)CC1)C2	ZINC000819004066	GE	On-Demand	Clean	SSTR1	75	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ccc(OC)cc3)CC1)C2	ZINC000819004066	GE	On-Demand	Clean	ADAM10	37	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ccc(OC)cc3)CC1)C2	ZINC000819004066	GE	On-Demand	Clean	NPBWR1	83	37
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(C)ccc1C1CC1	ZINC000819004072	FG	On-Demand	Reactive	HCN1	56	35
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(C)ccc1C1CC1	ZINC000819004072	FG	On-Demand	Reactive	HCN4	45	35
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(C)ccc1C1CC1	ZINC000819004072	FG	On-Demand	Reactive	KCNK3	40	42
CCOc1ccccc1OCC(=O)NNC(=O)c1cc(C)ccc1C1CC1	ZINC000819004072	FG	On-Demand	Reactive	KCNK9	34	42
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819004079	GD	On-Demand	Anodyne	SLC6A1	111	37
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819004080	GD	On-Demand	Anodyne	SLC6A1	111	37
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819004081	GD	On-Demand	Anodyne	SLC6A1	111	37
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819004082	GD	On-Demand	Anodyne	SLC6A1	111	37
COC(=O)N1CCC[C@H](NCCC(=O)Nc2cccc(Br)c2)C1	ZINC000819004085	GF	On-Demand	Anodyne	EGFR	20	40
COC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccc(Br)c2)C1	ZINC000819004086	GF	On-Demand	Anodyne	EGFR	20	40
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819004100	CD	On-Demand	Anodyne	ADRB3	27	47
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819004101	CD	On-Demand	Anodyne	ADRB3	27	47
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819004102	CD	On-Demand	Anodyne	ADRB3	27	47
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819004103	CD	On-Demand	Anodyne	ADRB3	27	47
C/C=C\c1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC)C2)c(OC)c1	ZINC000819004108	GE	On-Demand	Anodyne	ACKR3	47	33
C/C=C/c1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC)C2)c(OC)c1	ZINC000819004109	GE	On-Demand	Anodyne	ACKR3	47	33
C/C=C\c1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)c(OC)c1	ZINC000819004110	GE	On-Demand	Anodyne	ACKR3	47	33
C/C=C/c1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)c(OC)c1	ZINC000819004111	GE	On-Demand	Anodyne	ACKR3	47	33
COC[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819004117	DD	On-Demand	Mild	PAPA1_CARPA	46	55
COC[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819004117	DD	On-Demand	Mild	CTSK	18	52
COC[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819004117	DD	On-Demand	Mild	FPR1	40	39
COC[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819004118	DD	On-Demand	Mild	PAPA1_CARPA	46	55
COC[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819004118	DD	On-Demand	Mild	CTSK	18	52
COC[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819004118	DD	On-Demand	Mild	FPR1	40	39
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819004119	FE	On-Demand	Anodyne	BIRC2	24	40
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819004120	FE	On-Demand	Anodyne	BIRC2	24	40
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819004121	FE	On-Demand	Anodyne	BIRC2	24	40
COC(=O)N1CCC[C@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819004122	FE	On-Demand	Anodyne	BIRC2	24	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819004123	GF	On-Demand	Anodyne	ADRB2	20	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819004123	GF	On-Demand	Anodyne	ADRB1	23	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819004123	GF	On-Demand	Anodyne	ADRB3	27	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819004123	GF	On-Demand	Anodyne	CCR1	46	37
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819004124	GF	On-Demand	Anodyne	ADRB2	20	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819004124	GF	On-Demand	Anodyne	ADRB1	23	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819004124	GF	On-Demand	Anodyne	ADRB3	27	40
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819004124	GF	On-Demand	Anodyne	CCR1	46	37
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819004125	GF	On-Demand	Anodyne	ADRB2	20	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819004125	GF	On-Demand	Anodyne	ADRB1	23	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819004125	GF	On-Demand	Anodyne	ADRB3	27	40
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819004125	GF	On-Demand	Anodyne	CCR1	46	37
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819004126	GF	On-Demand	Anodyne	ADRB2	20	41
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819004126	GF	On-Demand	Anodyne	ADRB1	23	41
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819004126	GF	On-Demand	Anodyne	ADRB3	27	40
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819004126	GF	On-Demand	Anodyne	CCR1	46	37
Cc1ccccc1[C@@H](O)CNCc1cccc(OCC(F)F)c1	ZINC000819004155	DG	On-Demand	Anodyne	PDS	85	40
COC(=O)N1CCC[C@@H](NCCC(=O)Nc2cc(OC)c(Cl)cc2OC)C1	ZINC000819004162	GF	On-Demand	Anodyne	HTR4	54	39
COC(=O)N1CCC[C@H](NCCC(=O)Nc2cc(OC)c(Cl)cc2OC)C1	ZINC000819004163	GF	On-Demand	Anodyne	HTR4	54	39
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cc(C)ccc2Cl)C1	ZINC000819004164	FE	On-Demand	Anodyne	ADRB2	22	42
COC(=O)N1CCC[C@H](NC[C@H](O)COc2cc(C)ccc2Cl)C1	ZINC000819004164	FE	On-Demand	Anodyne	ADRB1	17	40
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cc(C)ccc2Cl)C1	ZINC000819004165	FE	On-Demand	Anodyne	ADRB2	22	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2cc(C)ccc2Cl)C1	ZINC000819004165	FE	On-Demand	Anodyne	ADRB1	17	40
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cc(C)ccc2Cl)C1	ZINC000819004166	FE	On-Demand	Anodyne	ADRB2	22	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2cc(C)ccc2Cl)C1	ZINC000819004166	FE	On-Demand	Anodyne	ADRB1	17	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cc(C)ccc2Cl)C1	ZINC000819004167	FE	On-Demand	Anodyne	ADRB2	22	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cc(C)ccc2Cl)C1	ZINC000819004167	FE	On-Demand	Anodyne	ADRB1	17	40
COC(=O)N1CCC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004168	EF	On-Demand	Anodyne	ADRB1	20	40
COC(=O)N1CCC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004168	EF	On-Demand	Anodyne	ADRB3	33	40
COC(=O)N1CCC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004168	EF	On-Demand	Anodyne	TACR1	40	37
COC(=O)N1CCC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004168	EF	On-Demand	Anodyne	CACNA1B	43	34
COC(=O)N1CCC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004168	EF	On-Demand	Anodyne	CCR2	124	40
COC(=O)N1CCC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004168	EF	On-Demand	Anodyne	LIPG	46	34
COC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004169	EF	On-Demand	Anodyne	ADRB1	20	40
COC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004169	EF	On-Demand	Anodyne	ADRB3	33	40
COC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004169	EF	On-Demand	Anodyne	TACR1	40	37
COC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004169	EF	On-Demand	Anodyne	CACNA1B	43	34
COC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004169	EF	On-Demand	Anodyne	CCR2	124	40
COC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004169	EF	On-Demand	Anodyne	LIPG	46	34
COC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004170	EF	On-Demand	Anodyne	ADRB1	20	40
COC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004170	EF	On-Demand	Anodyne	ADRB3	33	40
COC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004170	EF	On-Demand	Anodyne	TACR1	40	37
COC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004170	EF	On-Demand	Anodyne	CACNA1B	43	34
COC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004170	EF	On-Demand	Anodyne	CCR2	124	40
COC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004170	EF	On-Demand	Anodyne	LIPG	46	34
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004171	EF	On-Demand	Anodyne	ADRB1	20	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004171	EF	On-Demand	Anodyne	ADRB3	33	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004171	EF	On-Demand	Anodyne	TACR1	40	37
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004171	EF	On-Demand	Anodyne	CACNA1B	43	34
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004171	EF	On-Demand	Anodyne	CCR2	124	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004171	EF	On-Demand	Anodyne	LIPG	46	34
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccccc1Br	ZINC000819004172	GH	On-Demand	Anodyne	PDS	81	38
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccccc1Br	ZINC000819004173	GH	On-Demand	Anodyne	PDS	81	38
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)cc1Cl	ZINC000819004174	FH	On-Demand	Anodyne	ADRB1	16	40
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)cc1Cl	ZINC000819004174	FH	On-Demand	Anodyne	PDS	71	39
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)cc1Cl	ZINC000819004175	FH	On-Demand	Anodyne	ADRB1	16	40
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)cc1Cl	ZINC000819004175	FH	On-Demand	Anodyne	PDS	71	39
COC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819004176	DD	On-Demand	Anodyne	ADRB2	26	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819004176	DD	On-Demand	Anodyne	ADRB1	31	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819004176	DD	On-Demand	Anodyne	PREP	42	40
COC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819004176	DD	On-Demand	Anodyne	ABCB1	28	44
COC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819004176	DD	On-Demand	Anodyne	BIRC2	23	47
COC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819004177	DD	On-Demand	Anodyne	ADRB2	26	41
COC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819004177	DD	On-Demand	Anodyne	ADRB1	31	41
COC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819004177	DD	On-Demand	Anodyne	PREP	42	40
COC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819004177	DD	On-Demand	Anodyne	ABCB1	28	44
COC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819004177	DD	On-Demand	Anodyne	BIRC2	23	47
COC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819004178	DD	On-Demand	Anodyne	ADRB2	26	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819004178	DD	On-Demand	Anodyne	ADRB1	31	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819004178	DD	On-Demand	Anodyne	PREP	42	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819004178	DD	On-Demand	Anodyne	ABCB1	28	44
COC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819004178	DD	On-Demand	Anodyne	BIRC2	23	47
COC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819004179	DD	On-Demand	Anodyne	ADRB2	26	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819004179	DD	On-Demand	Anodyne	ADRB1	31	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819004179	DD	On-Demand	Anodyne	PREP	42	40
COC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819004179	DD	On-Demand	Anodyne	ABCB1	28	44
COC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819004179	DD	On-Demand	Anodyne	BIRC2	23	47
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccccc2)C1	ZINC000819004232	DC	On-Demand	Anodyne	ADRB2	30	41
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccccc2)C1	ZINC000819004232	DC	On-Demand	Anodyne	ADRB1	28	40
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccccc2)C1	ZINC000819004232	DC	On-Demand	Anodyne	SLC6A1	170	49
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccccc2)C1	ZINC000819004232	DC	On-Demand	Anodyne	ADRB3	52	40
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccccc2)C1	ZINC000819004233	DC	On-Demand	Anodyne	ADRB2	30	41
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccccc2)C1	ZINC000819004233	DC	On-Demand	Anodyne	ADRB1	28	40
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccccc2)C1	ZINC000819004233	DC	On-Demand	Anodyne	SLC6A1	170	49
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccccc2)C1	ZINC000819004233	DC	On-Demand	Anodyne	ADRB3	52	40
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccccc2)C1	ZINC000819004234	DC	On-Demand	Anodyne	ADRB2	30	41
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccccc2)C1	ZINC000819004234	DC	On-Demand	Anodyne	ADRB1	28	40
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccccc2)C1	ZINC000819004234	DC	On-Demand	Anodyne	SLC6A1	170	49
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccccc2)C1	ZINC000819004234	DC	On-Demand	Anodyne	ADRB3	52	40
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccccc2)C1	ZINC000819004235	DC	On-Demand	Anodyne	ADRB2	30	41
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccccc2)C1	ZINC000819004235	DC	On-Demand	Anodyne	ADRB1	28	40
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccccc2)C1	ZINC000819004235	DC	On-Demand	Anodyne	SLC6A1	170	49
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccccc2)C1	ZINC000819004235	DC	On-Demand	Anodyne	ADRB3	52	40
CN(C)c1ccc(NC(=O)CCNCCCN2CCC[C@H](C(N)=O)C2)cc1	ZINC000819004236	GD	On-Demand	Anodyne	SLC6A1	103	39
CN(C)c1ccc(NC(=O)CCNCCCN2CCC[C@H](C(N)=O)C2)cc1	ZINC000819004236	GD	On-Demand	Anodyne	CHRNA7	18	41
CN(C)c1ccc(NC(=O)CCNCCCN2CCC[C@@H](C(N)=O)C2)cc1	ZINC000819004237	GD	On-Demand	Anodyne	SLC6A1	103	39
CN(C)c1ccc(NC(=O)CCNCCCN2CCC[C@@H](C(N)=O)C2)cc1	ZINC000819004237	GD	On-Demand	Anodyne	CHRNA7	18	41
C=CCC1(C(=O)NNC(=O)COc2ccccc2OCC)CCOCC1	ZINC000819004240	FD	On-Demand	Reactive	HCN1	48	38
C=CCCn1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819004243	ED	On-Demand	Mild	CCKAR	34	46
O=C(NNC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F)NC1CCCCC1	ZINC000819004244	FG	On-Demand	Reactive	EPHX2	23	47
O=C(Cc1nsc2ccccc12)NNC(=O)NC1CCCCC1	ZINC000819004255	EF	On-Demand	Reactive	EPHX2	20	41
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819004258	GD	On-Demand	Anodyne	SLC6A1	140	40
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819004258	GD	On-Demand	Anodyne	ADRB3	42	35
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819004259	GD	On-Demand	Anodyne	SLC6A1	140	40
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819004259	GD	On-Demand	Anodyne	ADRB3	42	35
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cccc(Br)c2)C1	ZINC000819004260	GD	On-Demand	Anodyne	SLC6A1	140	40
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cccc(Br)c2)C1	ZINC000819004260	GD	On-Demand	Anodyne	ADRB3	42	35
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cccc(Br)c2)C1	ZINC000819004261	GD	On-Demand	Anodyne	SLC6A1	140	40
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cccc(Br)c2)C1	ZINC000819004261	GD	On-Demand	Anodyne	ADRB3	42	35
COc1ccc(N2CCN(C(=O)CCc3cccc(OC(F)F)c3)CC2)cc1	ZINC000819004275	GH	On-Demand	Clean	HTR1A	16	47
COc1ccc(N2CCN(C(=O)CCc3cccc(OC(F)F)c3)CC2)cc1	ZINC000819004275	GH	On-Demand	Clean	DRD4	45	38
COc1ccc(N2CCN(C(=O)CCc3cccc(OC(F)F)c3)CC2)cc1	ZINC000819004275	GH	On-Demand	Clean	PLA2G4A	20	41
COc1ccc(N2CCN(C(=O)CCc3cccc(OC(F)F)c3)CC2)cc1	ZINC000819004275	GH	On-Demand	Clean	C3AR1	31	42
COc1ccc(N2CCN(C(=O)CCc3cccc(OC(F)F)c3)CC2)cc1	ZINC000819004275	GH	On-Demand	Clean	SSTR1	45	44
COc1ccc(N2CCN(C(=O)CCc3cccc(OC(F)F)c3)CC2)cc1	ZINC000819004275	GH	On-Demand	Clean	ABCB1	29	41
COc1ccc(N2CC[C@H](CNc3ncnc4oc(C)c(C(C)=O)c34)C2)cc1	ZINC000819004280	GH	On-Demand	Clean	TNK2	49	42
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819004288	ED	On-Demand	Anodyne	SLC6A1	133	41
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819004289	ED	On-Demand	Anodyne	SLC6A1	133	41
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccccc2Br)C1	ZINC000819004291	GD	On-Demand	Anodyne	SLC6A1	141	41
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccccc2Br)C1	ZINC000819004292	GD	On-Demand	Anodyne	SLC6A1	141	41
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccccc2Br)C1	ZINC000819004293	GD	On-Demand	Anodyne	SLC6A1	141	41
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccccc2Br)C1	ZINC000819004294	GD	On-Demand	Anodyne	SLC6A1	141	41
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819004302	FD	On-Demand	Anodyne	ADRB2	24	40
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819004302	FD	On-Demand	Anodyne	SLC6A1	117	37
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819004303	FD	On-Demand	Anodyne	ADRB2	24	40
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819004303	FD	On-Demand	Anodyne	SLC6A1	117	37
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819004304	FD	On-Demand	Anodyne	ADRB2	24	40
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819004304	FD	On-Demand	Anodyne	SLC6A1	117	37
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819004305	FD	On-Demand	Anodyne	ADRB2	24	40
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819004305	FD	On-Demand	Anodyne	SLC6A1	117	37
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819004318	DE	On-Demand	Anodyne	ADRB1	18	45
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819004318	DE	On-Demand	Anodyne	SLC6A3	27	40
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819004318	DE	On-Demand	Anodyne	ADRB3	31	47
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819004318	DE	On-Demand	Anodyne	AKT2	21	40
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819004318	DE	On-Demand	Anodyne	AKT3	45	40
COC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819004318	DE	On-Demand	Anodyne	AKT1	17	40
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819004319	DE	On-Demand	Anodyne	ADRB1	18	45
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819004319	DE	On-Demand	Anodyne	SLC6A3	27	40
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819004319	DE	On-Demand	Anodyne	ADRB3	31	47
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819004319	DE	On-Demand	Anodyne	AKT2	21	40
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819004319	DE	On-Demand	Anodyne	AKT3	45	40
COC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819004319	DE	On-Demand	Anodyne	AKT1	17	40
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)cc1	ZINC000819004329	EG	On-Demand	Anodyne	ADRB2	20	40
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)cc1	ZINC000819004329	EG	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)cc1	ZINC000819004329	EG	On-Demand	Anodyne	PDS	58	41
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)cc1	ZINC000819004330	EG	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)cc1	ZINC000819004330	EG	On-Demand	Anodyne	ADRB1	20	40
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccc(F)cc1	ZINC000819004330	EG	On-Demand	Anodyne	PDS	58	41
COC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819004332	ED	On-Demand	Anodyne	CCR8	56	36
COC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819004332	ED	On-Demand	Anodyne	SFRP1	115	36
COC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819004332	ED	On-Demand	Anodyne	WNT3	81	36
COC(=O)N1CCC[C@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819004333	ED	On-Demand	Anodyne	CCR8	56	36
COC(=O)N1CCC[C@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819004333	ED	On-Demand	Anodyne	SFRP1	115	36
COC(=O)N1CCC[C@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819004333	ED	On-Demand	Anodyne	WNT3	81	36
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004342	FE	On-Demand	Anodyne	ADRB2	50	53
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004342	FE	On-Demand	Anodyne	ADRB1	62	44
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004342	FE	On-Demand	Anodyne	ADRB3	49	45
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004342	FE	On-Demand	Anodyne	CASR	39	41
COC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004342	FE	On-Demand	Anodyne	ACOX1	56	40
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004343	FE	On-Demand	Anodyne	ADRB2	50	53
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004343	FE	On-Demand	Anodyne	ADRB1	62	44
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004343	FE	On-Demand	Anodyne	ADRB3	49	45
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004343	FE	On-Demand	Anodyne	CASR	39	41
COC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004343	FE	On-Demand	Anodyne	ACOX1	56	40
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004344	FE	On-Demand	Anodyne	ADRB2	50	53
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004344	FE	On-Demand	Anodyne	ADRB1	62	44
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004344	FE	On-Demand	Anodyne	ADRB3	49	45
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004344	FE	On-Demand	Anodyne	CASR	39	41
COC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004344	FE	On-Demand	Anodyne	ACOX1	56	40
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004345	FE	On-Demand	Anodyne	ADRB2	50	53
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004345	FE	On-Demand	Anodyne	ADRB1	62	44
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004345	FE	On-Demand	Anodyne	ADRB3	49	45
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004345	FE	On-Demand	Anodyne	CASR	39	41
COC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819004345	FE	On-Demand	Anodyne	ACOX1	56	40
O[C@@H](CNCc1cccc(OCC(F)F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819004354	GI	On-Demand	Anodyne	PDS	76	42
O[C@H](CNCc1cccc(OCC(F)F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819004355	GI	On-Demand	Anodyne	PDS	76	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2OC)C1	ZINC000819004360	FD	On-Demand	Anodyne	ADRB2	24	43
COC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2OC)C1	ZINC000819004360	FD	On-Demand	Anodyne	ADRB1	22	43
COC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2OC)C1	ZINC000819004360	FD	On-Demand	Anodyne	BIRC2	16	42
COC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2OC)C1	ZINC000819004360	FD	On-Demand	Anodyne	MBTPS1	51	33
COC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2OC)C1	ZINC000819004361	FD	On-Demand	Anodyne	ADRB2	24	43
COC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2OC)C1	ZINC000819004361	FD	On-Demand	Anodyne	ADRB1	22	43
COC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2OC)C1	ZINC000819004361	FD	On-Demand	Anodyne	BIRC2	16	42
COC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2OC)C1	ZINC000819004361	FD	On-Demand	Anodyne	MBTPS1	51	33
COC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2OC)C1	ZINC000819004362	FD	On-Demand	Anodyne	ADRB2	24	43
COC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2OC)C1	ZINC000819004362	FD	On-Demand	Anodyne	ADRB1	22	43
COC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2OC)C1	ZINC000819004362	FD	On-Demand	Anodyne	BIRC2	16	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2OC)C1	ZINC000819004362	FD	On-Demand	Anodyne	MBTPS1	51	33
COC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2OC)C1	ZINC000819004363	FD	On-Demand	Anodyne	ADRB2	24	43
COC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2OC)C1	ZINC000819004363	FD	On-Demand	Anodyne	ADRB1	22	43
COC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2OC)C1	ZINC000819004363	FD	On-Demand	Anodyne	BIRC2	16	42
COC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2OC)C1	ZINC000819004363	FD	On-Demand	Anodyne	MBTPS1	51	33
N#Cc1ccc([C@@H](O)CNCc2cccc(OCC(F)F)c2)cc1	ZINC000819004364	EG	On-Demand	Mild	PDS	43	41
N#Cc1ccc([C@H](O)CNCc2cccc(OCC(F)F)c2)cc1	ZINC000819004365	EG	On-Demand	Mild	PDS	43	41
COC(=O)N1CCC[C@H](NC[C@@H](O)CN(C)Cc2ccccc2)C1	ZINC000819004371	ED	On-Demand	Anodyne	BIRC2	21	42
COC(=O)N1CCC[C@@H](NC[C@@H](O)CN(C)Cc2ccccc2)C1	ZINC000819004372	ED	On-Demand	Anodyne	BIRC2	21	42
COC(=O)N1CCC[C@H](NC[C@H](O)CN(C)Cc2ccccc2)C1	ZINC000819004373	ED	On-Demand	Anodyne	BIRC2	21	42
COC(=O)N1CCC[C@@H](NC[C@H](O)CN(C)Cc2ccccc2)C1	ZINC000819004374	ED	On-Demand	Anodyne	BIRC2	21	42
COC(=O)N1CCC[C@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819004376	FD	On-Demand	Mild	MMP13	20	40
COC(=O)N1CCC[C@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819004376	FD	On-Demand	Mild	ADAM17	23	40
COC(=O)N1CCC[C@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819004376	FD	On-Demand	Mild	DPP4	15	40
COC(=O)N1CCC[C@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819004376	FD	On-Demand	Mild	MMP1	16	40
COC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819004377	FD	On-Demand	Mild	MMP13	20	40
COC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819004377	FD	On-Demand	Mild	ADAM17	23	40
COC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819004377	FD	On-Demand	Mild	DPP4	15	40
COC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819004377	FD	On-Demand	Mild	MMP1	16	40
C=CCc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC)C2)c(OC)c1	ZINC000819004381	GD	On-Demand	Mild	ADRB2	15	46
C=CCc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC)C2)c(OC)c1	ZINC000819004381	GD	On-Demand	Mild	ADRB1	17	46
C=CCc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)c(OC)c1	ZINC000819004382	GD	On-Demand	Mild	ADRB2	15	46
C=CCc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)c(OC)c1	ZINC000819004382	GD	On-Demand	Mild	ADRB1	17	46
C=CCc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC)C2)c(OC)c1	ZINC000819004383	GD	On-Demand	Mild	ADRB2	15	46
C=CCc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC)C2)c(OC)c1	ZINC000819004383	GD	On-Demand	Mild	ADRB1	17	46
C=CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)c(OC)c1	ZINC000819004384	GD	On-Demand	Mild	ADRB2	15	46
C=CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC)C2)c(OC)c1	ZINC000819004384	GD	On-Demand	Mild	ADRB1	17	46
COC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819004399	DD	On-Demand	Anodyne	CCR3	56	38
COC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819004400	DD	On-Demand	Anodyne	CCR3	56	38
COC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819004401	DD	On-Demand	Anodyne	CCR3	56	38
COC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819004402	DD	On-Demand	Anodyne	CCR3	56	38
CCn1c(S)nc2cc(C(=O)N(CCC(=O)OC)Cc3ccccc3)ccc2c1=O	ZINC000819004410	IF	On-Demand	Anodyne	KIF11	20	47
CCOc1ccccc1OCC(=O)NNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819004417	GD	On-Demand	Reactive	TSHR	48	31
CCOc1ccccc1OCC(=O)NNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819004417	GD	On-Demand	Reactive	PPIA	40	42
CCOc1ccccc1OCC(=O)NNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819004417	GD	On-Demand	Reactive	KCNK3	56	47
CCOc1ccccc1OCC(=O)NNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819004417	GD	On-Demand	Reactive	KCNK9	60	47
CC(=O)Nc1cccc(CC(=O)NNC(=O)COc2cc(C)ccc2C)c1	ZINC000819004419	FE	On-Demand	Reactive	KCNK3	72	36
CC(=O)Nc1cccc(CC(=O)NNC(=O)COc2cc(C)ccc2C)c1	ZINC000819004419	FE	On-Demand	Reactive	KCNK9	64	35
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819004425	DD	On-Demand	Anodyne	SLC6A1	146	44
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819004425	DD	On-Demand	Anodyne	CCR3	41	38
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819004425	DD	On-Demand	Anodyne	LEF	19	41
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819004426	DD	On-Demand	Anodyne	SLC6A1	146	44
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819004426	DD	On-Demand	Anodyne	CCR3	41	38
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819004426	DD	On-Demand	Anodyne	LEF	19	41
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819004427	DD	On-Demand	Anodyne	SLC6A1	146	44
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819004427	DD	On-Demand	Anodyne	CCR3	41	38
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819004427	DD	On-Demand	Anodyne	LEF	19	41
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819004428	DD	On-Demand	Anodyne	SLC6A1	146	44
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819004428	DD	On-Demand	Anodyne	CCR3	41	38
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819004428	DD	On-Demand	Anodyne	LEF	19	41
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004433	FD	On-Demand	Anodyne	SLC6A1	126	39
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004433	FD	On-Demand	Anodyne	CCR2	41	36
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004434	FD	On-Demand	Anodyne	SLC6A1	126	39
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004434	FD	On-Demand	Anodyne	CCR2	41	36
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004435	FD	On-Demand	Anodyne	SLC6A1	126	39
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004435	FD	On-Demand	Anodyne	CCR2	41	36
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004436	FD	On-Demand	Anodyne	SLC6A1	126	39
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819004436	FD	On-Demand	Anodyne	CCR2	41	36
CC[C@@H](NC[C@H](O)c1cccc(Cl)c1)c1nnc2n1CCCCC2	ZINC000819004439	EG	On-Demand	Anodyne	ADRB1	24	41
CC[C@@H](NC[C@H](O)c1cccc(Cl)c1)c1nnc2n1CCCCC2	ZINC000819004439	EG	On-Demand	Anodyne	ADRB3	38	41
CC[C@@H](NC[C@H](O)c1cccc(Cl)c1)c1nnc2n1CCCCC2	ZINC000819004439	EG	On-Demand	Anodyne	CYP3A4	46	35
CC[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1nnc2n1CCCCC2	ZINC000819004441	EG	On-Demand	Anodyne	ADRB1	24	41
CC[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1nnc2n1CCCCC2	ZINC000819004441	EG	On-Demand	Anodyne	ADRB3	38	41
CC[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1nnc2n1CCCCC2	ZINC000819004441	EG	On-Demand	Anodyne	CYP3A4	46	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1ccc(F)cc1	ZINC000819004448	DE	On-Demand	Anodyne	PAPA1_CARPA	23	43
CCOc1ccccc1OCC(=O)NNC(=O)C(F)=C1CCC1	ZINC000819004456	DE	On-Demand	Reactive	HCN1	49	33
CCOc1ccccc1OCC(=O)NNC(=O)C(F)=C1CCC1	ZINC000819004456	DE	On-Demand	Reactive	HCN4	41	32
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819004461	FD	On-Demand	Anodyne	SLC6A1	115	38
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819004462	FD	On-Demand	Anodyne	SLC6A1	115	38
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819004463	FD	On-Demand	Anodyne	SLC6A1	115	38
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819004464	FD	On-Demand	Anodyne	SLC6A1	115	38
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2c(F)cccc2F)C1	ZINC000819004471	ED	On-Demand	Anodyne	SLC6A1	155	43
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819004472	ED	On-Demand	Anodyne	SLC6A1	155	43
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819004473	ED	On-Demand	Anodyne	SLC6A1	155	43
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2c(F)cccc2F)C1	ZINC000819004474	ED	On-Demand	Anodyne	SLC6A1	155	43
O=C(/C=C/[C@H]1CCCO1)NNC(=O)COc1ccc(Br)cc1	ZINC000819004475	FD	On-Demand	Reactive	TRAR	42	47
O=C(/C=C/[C@@H]1CCCO1)NNC(=O)COc1ccc(Br)cc1	ZINC000819004476	FD	On-Demand	Reactive	TRAR	42	47
O=C(/C=C\[C@@H]1CCCO1)NNC(=O)COc1ccc(Br)cc1	ZINC000819004477	FD	On-Demand	Reactive	TRAR	42	47
O=C(/C=C\[C@H]1CCCO1)NNC(=O)COc1ccc(Br)cc1	ZINC000819004478	FD	On-Demand	Reactive	TRAR	42	47
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819004486	FC	On-Demand	Bother	SLC6A1	64	36
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819004487	FC	On-Demand	Bother	SLC6A1	64	36
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819004488	FC	On-Demand	Bother	SLC6A1	64	36
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819004489	FC	On-Demand	Bother	SLC6A1	64	36
COc1ccc(N2CC[C@H](CNc3ncnc4ccncc34)C2)cc1	ZINC000819004492	EF	On-Demand	Clean	PDE3B	45	38
O[C@@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1c(F)cccc1F	ZINC000819004518	GG	On-Demand	Anodyne	ADRB1	19	40
O[C@@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1c(F)cccc1F	ZINC000819004518	GG	On-Demand	Anodyne	ADRB3	26	40
O[C@@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1c(F)cccc1F	ZINC000819004519	GG	On-Demand	Anodyne	ADRB1	19	40
O[C@@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1c(F)cccc1F	ZINC000819004519	GG	On-Demand	Anodyne	ADRB3	26	40
O[C@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1c(F)cccc1F	ZINC000819004520	GG	On-Demand	Anodyne	ADRB1	19	40
O[C@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1c(F)cccc1F	ZINC000819004520	GG	On-Demand	Anodyne	ADRB3	26	40
O[C@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1c(F)cccc1F	ZINC000819004521	GG	On-Demand	Anodyne	ADRB1	19	40
O[C@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1c(F)cccc1F	ZINC000819004521	GG	On-Demand	Anodyne	ADRB3	26	40
COc1cccc([S@@](=O)CC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	ZINC000819004525	GE	On-Demand	Reactive	EPHX2	18	43
CN(CCNC[C@H](O)c1ccc(Cl)cc1)C(=O)OC(C)(C)C	ZINC000819004526	EF	On-Demand	Anodyne	ADRB1	21	40
CN(CCNC[C@H](O)c1ccc(Cl)cc1)C(=O)OC(C)(C)C	ZINC000819004526	EF	On-Demand	Anodyne	ADRB3	28	40
CN(CCNC[C@H](O)c1ccc(Cl)cc1)C(=O)OC(C)(C)C	ZINC000819004526	EF	On-Demand	Anodyne	UTS2	42	33
Cc1ccccc1[C@@H](O)CNC1CCN(C(=O)CC(F)(F)F)CC1	ZINC000819004546	EF	On-Demand	Anodyne	EPHX2	19	45
Cc1ccccc1[C@@H](O)CNC1CCN(C(=O)CC(F)(F)F)CC1	ZINC000819004546	EF	On-Demand	Anodyne	CCR8	87	38
Cc1ccccc1[C@@H](O)CNC1CCN(C(=O)CC(F)(F)F)CC1	ZINC000819004546	EF	On-Demand	Anodyne	SFRP1	64	37
Cc1ccccc1[C@@H](O)CNC1CCN(C(=O)CC(F)(F)F)CC1	ZINC000819004546	EF	On-Demand	Anodyne	WNT3	44	37
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cn3c(n2)CCCC3)CC1	ZINC000819004548	GE	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cn3c(n2)CCCC3)CC1	ZINC000819004549	GE	On-Demand	Anodyne	GPR119	39	42
O[C@@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(F)cc1	ZINC000819004563	GG	On-Demand	Anodyne	ADRB1	26	40
O[C@@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(F)cc1	ZINC000819004563	GG	On-Demand	Anodyne	ADRB3	39	40
O[C@@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(F)cc1	ZINC000819004564	GG	On-Demand	Anodyne	ADRB1	26	40
O[C@@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(F)cc1	ZINC000819004564	GG	On-Demand	Anodyne	ADRB3	39	40
O[C@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(F)cc1	ZINC000819004565	GG	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(F)cc1	ZINC000819004565	GG	On-Demand	Anodyne	ADRB3	39	40
O[C@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(F)cc1	ZINC000819004566	GG	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(F)cc1	ZINC000819004566	GG	On-Demand	Anodyne	ADRB3	39	40
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)NC1CCCCC1	ZINC000819004600	CE	On-Demand	Reactive	EPHX2	17	52
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)NC1CCCCC1	ZINC000819004603	CE	On-Demand	Reactive	EPHX2	17	52
O[C@H](CNCCc1ccc(I)s1)c1ccccc1	ZINC000819004604	FG	On-Demand	Anodyne	ADRB2	38	53
O[C@H](CNCCc1ccc(I)s1)c1ccccc1	ZINC000819004604	FG	On-Demand	Anodyne	ADRB1	49	41
O[C@H](CNCCc1ccc(I)s1)c1ccccc1	ZINC000819004604	FG	On-Demand	Anodyne	ADRB3	85	45
O[C@@H](CNCCc1ccc(I)s1)c1ccccc1	ZINC000819004606	FG	On-Demand	Anodyne	ADRB2	38	53
O[C@@H](CNCCc1ccc(I)s1)c1ccccc1	ZINC000819004606	FG	On-Demand	Anodyne	ADRB1	49	41
O[C@@H](CNCCc1ccc(I)s1)c1ccccc1	ZINC000819004606	FG	On-Demand	Anodyne	ADRB3	85	45
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccc(Cl)cc2Cl)CC1	ZINC000819004609	GH	On-Demand	Anodyne	EPHX2	19	44
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccc(Cl)cc2Cl)CC1	ZINC000819004611	GH	On-Demand	Anodyne	EPHX2	19	44
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819004624	ED	On-Demand	Anodyne	SLC6A1	133	40
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819004625	ED	On-Demand	Anodyne	SLC6A1	133	40
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819004627	ED	On-Demand	Anodyne	SLC6A1	133	40
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819004629	ED	On-Demand	Anodyne	SLC6A1	133	40
CN(CCNC[C@H](O)COc1ccc(Cl)cc1)C(=O)OC(C)(C)C	ZINC000819004642	FF	On-Demand	Anodyne	ADRB2	49	43
CN(CCNC[C@H](O)COc1ccc(Cl)cc1)C(=O)OC(C)(C)C	ZINC000819004642	FF	On-Demand	Anodyne	ADRB1	77	46
CN(CCNC[C@H](O)COc1ccc(Cl)cc1)C(=O)OC(C)(C)C	ZINC000819004642	FF	On-Demand	Anodyne	GRIN1	25	48
CN(CCNC[C@H](O)COc1ccc(Cl)cc1)C(=O)OC(C)(C)C	ZINC000819004642	FF	On-Demand	Anodyne	ADRB3	48	43
CN(CCNC[C@@H](O)COc1ccc(Cl)cc1)C(=O)OC(C)(C)C	ZINC000819004644	FF	On-Demand	Anodyne	ADRB2	49	43
CN(CCNC[C@@H](O)COc1ccc(Cl)cc1)C(=O)OC(C)(C)C	ZINC000819004644	FF	On-Demand	Anodyne	ADRB1	77	46
CN(CCNC[C@@H](O)COc1ccc(Cl)cc1)C(=O)OC(C)(C)C	ZINC000819004644	FF	On-Demand	Anodyne	GRIN1	25	48
CN(CCNC[C@@H](O)COc1ccc(Cl)cc1)C(=O)OC(C)(C)C	ZINC000819004644	FF	On-Demand	Anodyne	ADRB3	48	43
O=C(NNC(=O)c1cc(-c2ccc3ccccc3c2)[nH]n1)NC1CCCCC1	ZINC000819004655	GH	On-Demand	Reactive	FAAH	21	45
O=C(NNC(=O)c1cc(-c2ccc3ccccc3c2)[nH]n1)NC1CCCCC1	ZINC000819004655	GH	On-Demand	Reactive	EPHX2	16	40
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cccnc2)C1	ZINC000819004660	DC	On-Demand	Anodyne	ADRB2	33	42
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cccnc2)C1	ZINC000819004660	DC	On-Demand	Anodyne	ADRB1	27	44
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cccnc2)C1	ZINC000819004660	DC	On-Demand	Anodyne	SLC6A1	114	40
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cccnc2)C1	ZINC000819004660	DC	On-Demand	Anodyne	ADRB3	102	48
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cccnc2)C1	ZINC000819004661	DC	On-Demand	Anodyne	ADRB2	33	42
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cccnc2)C1	ZINC000819004661	DC	On-Demand	Anodyne	ADRB1	27	44
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cccnc2)C1	ZINC000819004661	DC	On-Demand	Anodyne	SLC6A1	114	40
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cccnc2)C1	ZINC000819004661	DC	On-Demand	Anodyne	ADRB3	102	48
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2cccnc2)C1	ZINC000819004662	DC	On-Demand	Anodyne	ADRB2	33	42
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2cccnc2)C1	ZINC000819004662	DC	On-Demand	Anodyne	ADRB1	27	44
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2cccnc2)C1	ZINC000819004662	DC	On-Demand	Anodyne	SLC6A1	114	40
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2cccnc2)C1	ZINC000819004662	DC	On-Demand	Anodyne	ADRB3	102	48
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2cccnc2)C1	ZINC000819004663	DC	On-Demand	Anodyne	ADRB2	33	42
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2cccnc2)C1	ZINC000819004663	DC	On-Demand	Anodyne	ADRB1	27	44
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2cccnc2)C1	ZINC000819004663	DC	On-Demand	Anodyne	SLC6A1	114	40
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2cccnc2)C1	ZINC000819004663	DC	On-Demand	Anodyne	ADRB3	102	48
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819004664	DD	On-Demand	Anodyne	SLC6A1	152	50
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819004664	DD	On-Demand	Anodyne	ADRB3	41	38
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819004665	DD	On-Demand	Anodyne	SLC6A1	152	50
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819004665	DD	On-Demand	Anodyne	ADRB3	41	38
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cccc(F)c2)C1	ZINC000819004666	DD	On-Demand	Anodyne	SLC6A1	152	50
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cccc(F)c2)C1	ZINC000819004666	DD	On-Demand	Anodyne	ADRB3	41	38
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cccc(F)c2)C1	ZINC000819004667	DD	On-Demand	Anodyne	SLC6A1	152	50
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cccc(F)c2)C1	ZINC000819004667	DD	On-Demand	Anodyne	ADRB3	41	38
CC(=O)Nc1cccc(CC(=O)NNC(=O)NC2CCCCC2)c1	ZINC000819004679	ED	On-Demand	Reactive	PPIA	19	40
CC(=O)Nc1cccc(CC(=O)NNC(=O)NC2CCCCC2)c1	ZINC000819004679	ED	On-Demand	Reactive	FAAH	22	48
CC(=O)Nc1cccc(CC(=O)NNC(=O)NC2CCCCC2)c1	ZINC000819004679	ED	On-Demand	Reactive	EPHX2	42	53
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819004687	FF	On-Demand	Clean	HTR1A	23	47
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819004687	FF	On-Demand	Clean	TSHR	42	32
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819004687	FF	On-Demand	Clean	DRD4	47	39
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819004687	FF	On-Demand	Clean	HTR1D	35	41
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819004687	FF	On-Demand	Clean	HTR1B	35	44
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819004687	FF	On-Demand	Clean	DRD3	15	40
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819004687	FF	On-Demand	Clean	HTR7	17	41
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819004687	FF	On-Demand	Clean	BMP1	15	40
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819004687	FF	On-Demand	Clean	MMP13	29	42
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819004687	FF	On-Demand	Clean	MTNR1A	58	40
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819004687	FF	On-Demand	Clean	MTNR1B	60	40
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819004687	FF	On-Demand	Clean	MMP3	26	42
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819004687	FF	On-Demand	Clean	MMP9	27	42
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819004687	FF	On-Demand	Clean	MMP1	29	42
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819004687	FF	On-Demand	Clean	MCHR1	20	40
C=CCC1(C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCOCC1	ZINC000819004700	EF	On-Demand	Mild	MMP13	24	47
C=CCC1(C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCOCC1	ZINC000819004700	EF	On-Demand	Mild	MMP3	16	47
C=CCC1(C(=O)N2CCN(c3ccc(OC)cc3)CC2)CCOCC1	ZINC000819004700	EF	On-Demand	Mild	MMP9	15	40
Cc1nc2cc(NC(=O)N3CCC(C(=O)O)CC3)ccc2o1	ZINC000819004719	DE	On-Demand	Anodyne	PDGFRB	40	37
Cc1nc2cc(NC(=O)N3CCC(C(=O)O)CC3)ccc2o1	ZINC000819004719	DE	On-Demand	Anodyne	EPHX2	17	51
Cc1nc2cc(NC(=O)N3CCC(C(=O)O)CC3)ccc2o1	ZINC000819004719	DE	On-Demand	Anodyne	MCHR1	22	44
Cc1nc2cc(NC(=O)N(C)CCC(=O)O)ccc2o1	ZINC000819004725	CE	On-Demand	Anodyne	HPSE	50	34
Cc1nc2cc(NC(=O)N3CC[C@@H](C(=O)O)C3)ccc2o1	ZINC000819004729	CE	On-Demand	Anodyne	EPHX2	17	50
Cc1nc2cc(NC(=O)N3CC[C@@H](C(=O)O)C3)ccc2o1	ZINC000819004729	CE	On-Demand	Anodyne	MCHR1	20	42
Cc1nc2cc(NC(=O)N3CC[C@H](C(=O)O)C3)ccc2o1	ZINC000819004730	CE	On-Demand	Anodyne	EPHX2	17	50
Cc1nc2cc(NC(=O)N3CC[C@H](C(=O)O)C3)ccc2o1	ZINC000819004730	CE	On-Demand	Anodyne	MCHR1	20	42
Cc1nc2cc(NC(=O)NC(C)(C)CCC(=O)O)ccc2o1	ZINC000819004734	DF	On-Demand	Anodyne	HPSE	47	33
Cc1nc2cc(NC(=O)NC(C)(C)CCC(=O)O)ccc2o1	ZINC000819004734	DF	On-Demand	Anodyne	IMDH_CRYPV	48	36
Cc1nc2cc(NC(=O)NCc3ccc(C(=O)O)cc3)ccc2o1	ZINC000819004735	EG	On-Demand	Anodyne	ROCK2	15	41
Cc1nc2cc(NC(=O)NCc3ccc(C(=O)O)cc3)ccc2o1	ZINC000819004735	EG	On-Demand	Anodyne	HPSE	55	33
Cc1nc2cc(NC(=O)NCc3ccc(C(=O)O)cc3)ccc2o1	ZINC000819004735	EG	On-Demand	Anodyne	AGPAT2	32	40
Cc1nc2cc(NC(=O)NCc3ccc(C(=O)O)cc3)ccc2o1	ZINC000819004735	EG	On-Demand	Anodyne	PRMT3	49	40
Cc1nc(S)sc1CC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819004736	DE	On-Demand	Anodyne	P2RX7	16	41
Cc1nc(S)sc1CC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819004736	DE	On-Demand	Anodyne	SCD1	16	42
Cc1nc2cc(NC(=O)NCCCC(=O)O)ccc2o1	ZINC000819004795	CE	On-Demand	Anodyne	AGPAT2	33	42
Cc1nc2cc(NC(=O)NCCCC(=O)O)ccc2o1	ZINC000819004795	CE	On-Demand	Anodyne	QPCT	17	52
Cc1nc2cc(NC(=O)NCCCCCC(=O)O)ccc2o1	ZINC000819004796	DF	On-Demand	Anodyne	AGPAT2	30	40
CCOc1ccccc1OCC(=O)NNC(=O)C1(c2ccc(C)cc2)CCC1	ZINC000819004814	GG	On-Demand	Reactive	HCN1	50	34
CCOc1ccccc1OCC(=O)NNC(=O)C1(c2ccc(C)cc2)CCC1	ZINC000819004814	GG	On-Demand	Reactive	HCN4	43	33
CC(=O)Nc1cccc(CC(=O)NNC(=O)CN2CCCc3ccccc32)c1	ZINC000819004828	GD	On-Demand	Reactive	AVPR2	34	45
C#CCNC(=O)CCNCc1cccc(CS(N)(=O)=O)c1	ZINC000819004832	DB	On-Demand	Mild	CA2	17	41
C#CCNC(=O)CCNCc1cccc(CS(N)(=O)=O)c1	ZINC000819004832	DB	On-Demand	Mild	CA1	16	41
CN(CCNC[C@H](O)COc1cccc2[nH]ccc12)C(=O)OC(C)(C)C	ZINC000819004834	FE	On-Demand	Anodyne	ADRB2	25	58
CN(CCNC[C@H](O)COc1cccc2[nH]ccc12)C(=O)OC(C)(C)C	ZINC000819004834	FE	On-Demand	Anodyne	ADRB1	62	58
CN(CCNC[C@H](O)COc1cccc2[nH]ccc12)C(=O)OC(C)(C)C	ZINC000819004834	FE	On-Demand	Anodyne	ADRB3	16	58
CN(CCNC[C@H](O)COc1cccc2[nH]ccc12)C(=O)OC(C)(C)C	ZINC000819004834	FE	On-Demand	Anodyne	CYP2D6	19	44
CN(CCNC[C@@H](O)COc1cccc2[nH]ccc12)C(=O)OC(C)(C)C	ZINC000819004836	FE	On-Demand	Anodyne	ADRB2	25	58
CN(CCNC[C@@H](O)COc1cccc2[nH]ccc12)C(=O)OC(C)(C)C	ZINC000819004836	FE	On-Demand	Anodyne	ADRB1	62	58
CN(CCNC[C@@H](O)COc1cccc2[nH]ccc12)C(=O)OC(C)(C)C	ZINC000819004836	FE	On-Demand	Anodyne	ADRB3	16	58
CN(CCNC[C@@H](O)COc1cccc2[nH]ccc12)C(=O)OC(C)(C)C	ZINC000819004836	FE	On-Demand	Anodyne	CYP2D6	19	44
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819004849	GD	On-Demand	Anodyne	SLC6A1	115	38
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819004851	GD	On-Demand	Anodyne	SLC6A1	115	38
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819004853	GD	On-Demand	Anodyne	SLC6A1	115	38
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819004855	GD	On-Demand	Anodyne	SLC6A1	115	38
O[C@@H](CNCc1cn2c(n1)CCCC2)c1ccc(Cl)cc1Cl	ZINC000819004860	EG	On-Demand	Anodyne	CNR1	51	31
O[C@H](CNCc1cn2c(n1)CCCC2)c1ccc(Cl)cc1Cl	ZINC000819004863	EG	On-Demand	Anodyne	CNR1	51	31
Cc1cc(F)ccc1[C@@H](O)CNCCc1c(C)[nH]c2ccccc12	ZINC000819004865	EH	On-Demand	Anodyne	ADRB2	51	36
Cc1cc(F)ccc1[C@@H](O)CNCCc1c(C)[nH]c2ccccc12	ZINC000819004865	EH	On-Demand	Anodyne	GNRHR	36	48
O[C@H](CNCCc1ccc(I)s1)c1cccnc1	ZINC000819004871	FF	On-Demand	Anodyne	ADRB2	37	52
O[C@H](CNCCc1ccc(I)s1)c1cccnc1	ZINC000819004871	FF	On-Demand	Anodyne	ADRB1	43	49
O[C@H](CNCCc1ccc(I)s1)c1cccnc1	ZINC000819004871	FF	On-Demand	Anodyne	ADRB3	133	53
O[C@@H](CNCCc1ccc(I)s1)c1cccnc1	ZINC000819004879	FF	On-Demand	Anodyne	ADRB2	37	52
O[C@@H](CNCCc1ccc(I)s1)c1cccnc1	ZINC000819004879	FF	On-Demand	Anodyne	ADRB1	43	49
O[C@@H](CNCCc1ccc(I)s1)c1cccnc1	ZINC000819004879	FF	On-Demand	Anodyne	ADRB3	133	53
O[C@@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1ccccc1	ZINC000819004881	FG	On-Demand	Anodyne	ADRB1	34	43
O[C@@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1ccccc1	ZINC000819004881	FG	On-Demand	Anodyne	ADRB3	54	43
O[C@@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1ccccc1	ZINC000819004883	FG	On-Demand	Anodyne	ADRB1	34	43
O[C@@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1ccccc1	ZINC000819004883	FG	On-Demand	Anodyne	ADRB3	54	43
O[C@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1ccccc1	ZINC000819004885	FG	On-Demand	Anodyne	ADRB1	34	43
O[C@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1ccccc1	ZINC000819004885	FG	On-Demand	Anodyne	ADRB3	54	43
O[C@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1ccccc1	ZINC000819004887	FG	On-Demand	Anodyne	ADRB1	34	43
O[C@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1ccccc1	ZINC000819004887	FG	On-Demand	Anodyne	ADRB3	54	43
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819004897	FF	On-Demand	Anodyne	EPHX2	18	45
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819004897	FF	On-Demand	Anodyne	SFRP1	89	37
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819004897	FF	On-Demand	Anodyne	WNT3	55	37
O[C@@H](CNCc1cn2c(n1)CCCC2)c1cccnc1	ZINC000819004905	CD	On-Demand	Anodyne	ADRB2	22	42
O[C@@H](CNCc1cn2c(n1)CCCC2)c1cccnc1	ZINC000819004905	CD	On-Demand	Anodyne	ADRB1	24	40
O[C@@H](CNCc1cn2c(n1)CCCC2)c1cccnc1	ZINC000819004905	CD	On-Demand	Anodyne	ADRB3	94	46
O[C@H](CNCc1cn2c(n1)CCCC2)c1cccnc1	ZINC000819004907	CD	On-Demand	Anodyne	ADRB2	22	42
O[C@H](CNCc1cn2c(n1)CCCC2)c1cccnc1	ZINC000819004907	CD	On-Demand	Anodyne	ADRB1	24	40
O[C@H](CNCc1cn2c(n1)CCCC2)c1cccnc1	ZINC000819004907	CD	On-Demand	Anodyne	ADRB3	94	46
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccccc2Cl)C1	ZINC000819004908	ED	On-Demand	Anodyne	SLC6A1	158	42
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccccc2Cl)C1	ZINC000819004908	ED	On-Demand	Anodyne	DRD3	16	42
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccccc2Cl)C1	ZINC000819004908	ED	On-Demand	Anodyne	OPRL1	32	40
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccccc2Cl)C1	ZINC000819004910	ED	On-Demand	Anodyne	SLC6A1	158	42
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccccc2Cl)C1	ZINC000819004910	ED	On-Demand	Anodyne	DRD3	16	42
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccccc2Cl)C1	ZINC000819004910	ED	On-Demand	Anodyne	OPRL1	32	40
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819004912	FF	On-Demand	Anodyne	ADRB3	25	48
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819004912	FF	On-Demand	Anodyne	EPHX2	18	47
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])c1ccc(F)cc1	ZINC000819004931	EI	On-Demand	Bother	COLA	79	39
C=CCC1(C(=O)NNC(=O)COc2ccc(Br)cc2)CCOCC1	ZINC000819004932	GE	On-Demand	Reactive	TRAR	38	43
COc1cccc([S@@](=O)CC(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	ZINC000819004955	GD	On-Demand	Reactive	MTNR1A	39	40
COc1cccc([S@@](=O)CC(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	ZINC000819004955	GD	On-Demand	Reactive	MTNR1B	39	40
O[C@@H](CNCc1cn2c(n1)CCCC2)c1cccc(Cl)c1	ZINC000819004956	DF	On-Demand	Anodyne	ADRB1	29	44
O[C@@H](CNCc1cn2c(n1)CCCC2)c1cccc(Cl)c1	ZINC000819004956	DF	On-Demand	Anodyne	ADRB3	46	44
O[C@@H](CNCc1cn2c(n1)CCCC2)c1cccc(Cl)c1	ZINC000819004956	DF	On-Demand	Anodyne	CYP3A4	45	34
O[C@H](CNCc1cn2c(n1)CCCC2)c1cccc(Cl)c1	ZINC000819004958	DF	On-Demand	Anodyne	ADRB1	29	44
O[C@H](CNCc1cn2c(n1)CCCC2)c1cccc(Cl)c1	ZINC000819004958	DF	On-Demand	Anodyne	ADRB3	46	44
O[C@H](CNCc1cn2c(n1)CCCC2)c1cccc(Cl)c1	ZINC000819004958	DF	On-Demand	Anodyne	CYP3A4	45	34
O[C@H](CNCCc1ccc(I)s1)c1ccc(F)cc1	ZINC000819004967	GG	On-Demand	Anodyne	ADRB2	23	44
COc1ccc(OC)c([C@H](O)CNCCCN2CCC[C@@H](C(N)=O)C2)c1	ZINC000819004969	FC	On-Demand	Anodyne	SLC6A1	109	37
COc1ccc(OC)c([C@H](O)CNCCCN2CCC[C@H](C(N)=O)C2)c1	ZINC000819004970	FC	On-Demand	Anodyne	SLC6A1	109	37
O[C@@H](CNCCc1ccc(I)s1)c1ccc(F)cc1	ZINC000819004971	GG	On-Demand	Anodyne	ADRB2	23	44
O=C(Cc1ccc(-n2cnnc2)cc1)NNC(=O)CC12CC3CC(CC(C3)C1)C2	ZINC000819004973	GF	On-Demand	Reactive	BOTA	29	43
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819004999	FE	On-Demand	Anodyne	ADRB2	42	38
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819004999	FE	On-Demand	Anodyne	ADRB1	27	45
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819005000	FE	On-Demand	Anodyne	ADRB2	42	38
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819005000	FE	On-Demand	Anodyne	ADRB1	27	45
O=C(CCc1cccc(OC(F)F)c1)NNC(=O)NC1CCCCC1	ZINC000819005019	FF	On-Demand	Reactive	HRH2	18	44
O=C(CCc1cccc(OC(F)F)c1)NNC(=O)NC1CCCCC1	ZINC000819005019	FF	On-Demand	Reactive	FAAH	25	48
O=C(CCc1cccc(OC(F)F)c1)NNC(=O)NC1CCCCC1	ZINC000819005019	FF	On-Demand	Reactive	EPHX2	24	43
C#CCNC(=O)CCNCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000819005048	FD	On-Demand	Mild	ROCK2	28	47
C#CCNC(=O)CCNCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000819005048	FD	On-Demand	Mild	NAMPT	48	37
CC(=O)Nc1cccc(CC(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	ZINC000819005060	FE	On-Demand	Reactive	TSHR	59	34
CC(=O)Nc1cccc(CC(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	ZINC000819005060	FE	On-Demand	Reactive	MAOB	19	49
CC(=O)Nc1cccc(CC(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	ZINC000819005060	FE	On-Demand	Reactive	DRTS_LEIMA	16	41
CC(=O)Nc1cccc(CC(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	ZINC000819005060	FE	On-Demand	Reactive	MTNR1A	41	38
CC(=O)Nc1cccc(CC(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	ZINC000819005060	FE	On-Demand	Reactive	MTNR1B	41	37
CC(=O)Nc1cccc(CC(=O)NNC(=O)COc2ccc(C)c(C)c2)c1	ZINC000819005060	FE	On-Demand	Reactive	FFAR1	45	37
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005062	GF	On-Demand	Anodyne	LPL	40	40
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005062	GF	On-Demand	Anodyne	CPT1A	59	39
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005062	GF	On-Demand	Anodyne	CPT2	49	39
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005062	GF	On-Demand	Anodyne	EPHX2	21	40
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005062	GF	On-Demand	Anodyne	CPT1B	53	36
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005062	GF	On-Demand	Anodyne	F13A1	47	41
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005062	GF	On-Demand	Anodyne	LIPG	18	40
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005064	GF	On-Demand	Anodyne	LPL	40	40
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005064	GF	On-Demand	Anodyne	CPT1A	59	39
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005064	GF	On-Demand	Anodyne	CPT2	49	39
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005064	GF	On-Demand	Anodyne	EPHX2	21	40
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005064	GF	On-Demand	Anodyne	CPT1B	53	36
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005064	GF	On-Demand	Anodyne	F13A1	47	41
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005064	GF	On-Demand	Anodyne	LIPG	18	40
Cc1ccccc1[C@@H](O)CNCCCN1CCC[C@H](C(N)=O)C1	ZINC000819005065	DD	On-Demand	Anodyne	ADRB2	18	41
Cc1ccccc1[C@@H](O)CNCCCN1CCC[C@H](C(N)=O)C1	ZINC000819005065	DD	On-Demand	Anodyne	SLC6A1	157	52
Cc1ccccc1[C@@H](O)CNCCCN1CCC[C@@H](C(N)=O)C1	ZINC000819005066	DD	On-Demand	Anodyne	ADRB2	18	41
Cc1ccccc1[C@@H](O)CNCCCN1CCC[C@@H](C(N)=O)C1	ZINC000819005066	DD	On-Demand	Anodyne	SLC6A1	157	52
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005067	GF	On-Demand	Anodyne	LPL	40	40
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005067	GF	On-Demand	Anodyne	CPT1A	59	39
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005067	GF	On-Demand	Anodyne	CPT2	49	39
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005067	GF	On-Demand	Anodyne	EPHX2	21	40
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005067	GF	On-Demand	Anodyne	CPT1B	53	36
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005067	GF	On-Demand	Anodyne	F13A1	47	41
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005067	GF	On-Demand	Anodyne	LIPG	18	40
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005069	GF	On-Demand	Anodyne	LPL	40	40
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005069	GF	On-Demand	Anodyne	CPT1A	59	39
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005069	GF	On-Demand	Anodyne	CPT2	49	39
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005069	GF	On-Demand	Anodyne	EPHX2	21	40
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005069	GF	On-Demand	Anodyne	CPT1B	53	36
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005069	GF	On-Demand	Anodyne	F13A1	47	41
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1S(=O)(=O)N1CCCCC1	ZINC000819005069	GF	On-Demand	Anodyne	LIPG	18	40
O[C@@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(F)c(F)c1	ZINC000819005082	GG	On-Demand	Anodyne	ADRB1	27	43
O[C@@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(F)c(F)c1	ZINC000819005082	GG	On-Demand	Anodyne	ADRB3	40	43
O[C@@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(F)c(F)c1	ZINC000819005084	GG	On-Demand	Anodyne	ADRB1	27	43
O[C@@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(F)c(F)c1	ZINC000819005084	GG	On-Demand	Anodyne	ADRB3	40	43
O[C@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(F)c(F)c1	ZINC000819005086	GG	On-Demand	Anodyne	ADRB1	27	43
O[C@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(F)c(F)c1	ZINC000819005086	GG	On-Demand	Anodyne	ADRB3	40	43
O[C@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(F)c(F)c1	ZINC000819005088	GG	On-Demand	Anodyne	ADRB1	27	43
O[C@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(F)c(F)c1	ZINC000819005088	GG	On-Demand	Anodyne	ADRB3	40	43
CCn1c(=O)c2ccccc2n(CC(=O)N(CCC(=O)OC)Cc2ccccc2)c1=O	ZINC000819005089	HD	On-Demand	Anodyne	TSPO	24	43
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819005094	GE	On-Demand	Anodyne	ADRB2	40	35
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819005094	GE	On-Demand	Anodyne	ADRB1	16	44
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819005095	GE	On-Demand	Anodyne	ADRB2	40	35
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819005095	GE	On-Demand	Anodyne	ADRB1	16	44
N#Cc1ccc([C@@H](O)CNC2CCN(C(=O)CC(F)(F)F)CC2)cc1	ZINC000819005097	FE	On-Demand	Mild	ADRB3	15	50
N#Cc1ccc([C@H](O)CNC2CCN(C(=O)CC(F)(F)F)CC2)cc1	ZINC000819005098	FE	On-Demand	Mild	ADRB3	15	50
O[C@H](CNCCc1ccc(I)s1)c1cccc(F)c1	ZINC000819005105	GG	On-Demand	Anodyne	ADRB1	27	47
O[C@H](CNCCc1ccc(I)s1)c1cccc(F)c1	ZINC000819005105	GG	On-Demand	Anodyne	ADRB3	61	47
O[C@@H](CNCCc1ccc(I)s1)c1cccc(F)c1	ZINC000819005107	GG	On-Demand	Anodyne	ADRB1	27	47
O[C@@H](CNCCc1ccc(I)s1)c1cccc(F)c1	ZINC000819005107	GG	On-Demand	Anodyne	ADRB3	61	47
CCOc1ccccc1OCC(=O)NNC(=O)c1cc2c(cn1)OCCO2	ZINC000819005112	FD	On-Demand	Reactive	HCN1	51	34
CCOc1ccccc1OCC(=O)NNC(=O)c1cc2c(cn1)OCCO2	ZINC000819005112	FD	On-Demand	Reactive	HCN4	42	32
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819005113	DC	On-Demand	Anodyne	ADRB2	38	45
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819005113	DC	On-Demand	Anodyne	ADRB1	39	44
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819005113	DC	On-Demand	Anodyne	ADRB3	109	46
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819005115	DC	On-Demand	Anodyne	ADRB2	38	45
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819005115	DC	On-Demand	Anodyne	ADRB1	39	44
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819005115	DC	On-Demand	Anodyne	ADRB3	109	46
CN(CCNC[C@@H](O)COc1ccccc1Cl)C(=O)OC(C)(C)C	ZINC000819005116	FF	On-Demand	Anodyne	ADRB2	40	57
CN(CCNC[C@@H](O)COc1ccccc1Cl)C(=O)OC(C)(C)C	ZINC000819005116	FF	On-Demand	Anodyne	ADRB1	63	38
CN(CCNC[C@@H](O)COc1ccccc1Cl)C(=O)OC(C)(C)C	ZINC000819005116	FF	On-Demand	Anodyne	ADRB3	26	41
CN(CCNC[C@@H](O)COc1ccccc1Cl)C(=O)OC(C)(C)C	ZINC000819005116	FF	On-Demand	Anodyne	ABCB1	33	42
CN(CCNC[C@H](O)COc1ccccc1Cl)C(=O)OC(C)(C)C	ZINC000819005118	FF	On-Demand	Anodyne	ADRB2	40	57
CN(CCNC[C@H](O)COc1ccccc1Cl)C(=O)OC(C)(C)C	ZINC000819005118	FF	On-Demand	Anodyne	ADRB1	63	38
CN(CCNC[C@H](O)COc1ccccc1Cl)C(=O)OC(C)(C)C	ZINC000819005118	FF	On-Demand	Anodyne	ADRB3	26	41
CN(CCNC[C@H](O)COc1ccccc1Cl)C(=O)OC(C)(C)C	ZINC000819005118	FF	On-Demand	Anodyne	ABCB1	33	42
C[C@H](CC(=O)NNC(=O)CSc1ccc(Cl)cc1)n1cccn1	ZINC000819005133	FE	On-Demand	Reactive	FAS	44	37
C[C@@H](CC(=O)NNC(=O)CSc1ccc(Cl)cc1)n1cccn1	ZINC000819005134	FE	On-Demand	Reactive	FAS	44	37
CN(CCNC[C@@H](O)COc1ccc2ccccc2c1)C(=O)OC(C)(C)C	ZINC000819005140	FG	On-Demand	Anodyne	ADRB2	55	55
CN(CCNC[C@@H](O)COc1ccc2ccccc2c1)C(=O)OC(C)(C)C	ZINC000819005140	FG	On-Demand	Anodyne	ADRB1	78	45
CN(CCNC[C@@H](O)COc1ccc2ccccc2c1)C(=O)OC(C)(C)C	ZINC000819005140	FG	On-Demand	Anodyne	GRIN1	15	40
CN(CCNC[C@@H](O)COc1ccc2ccccc2c1)C(=O)OC(C)(C)C	ZINC000819005140	FG	On-Demand	Anodyne	ADRB3	48	45
CN(CCNC[C@@H](O)COc1ccc2ccccc2c1)C(=O)OC(C)(C)C	ZINC000819005140	FG	On-Demand	Anodyne	CASR	44	39
CN(CCNC[C@@H](O)COc1ccc2ccccc2c1)C(=O)OC(C)(C)C	ZINC000819005140	FG	On-Demand	Anodyne	ACOX1	45	36
CN(CCNC[C@@H](O)COc1ccc2ccccc2c1)C(=O)OC(C)(C)C	ZINC000819005140	FG	On-Demand	Anodyne	CYP2D6	19	46
CN(CCNC[C@@H](O)COc1ccc2ccccc2c1)C(=O)OC(C)(C)C	ZINC000819005140	FG	On-Demand	Anodyne	ABCB1	28	43
CN(CCNC[C@H](O)COc1ccc2ccccc2c1)C(=O)OC(C)(C)C	ZINC000819005142	FG	On-Demand	Anodyne	ADRB2	55	55
CN(CCNC[C@H](O)COc1ccc2ccccc2c1)C(=O)OC(C)(C)C	ZINC000819005142	FG	On-Demand	Anodyne	ADRB1	78	45
CN(CCNC[C@H](O)COc1ccc2ccccc2c1)C(=O)OC(C)(C)C	ZINC000819005142	FG	On-Demand	Anodyne	GRIN1	15	40
CN(CCNC[C@H](O)COc1ccc2ccccc2c1)C(=O)OC(C)(C)C	ZINC000819005142	FG	On-Demand	Anodyne	ADRB3	48	45
CN(CCNC[C@H](O)COc1ccc2ccccc2c1)C(=O)OC(C)(C)C	ZINC000819005142	FG	On-Demand	Anodyne	CASR	44	39
CN(CCNC[C@H](O)COc1ccc2ccccc2c1)C(=O)OC(C)(C)C	ZINC000819005142	FG	On-Demand	Anodyne	ACOX1	45	36
CN(CCNC[C@H](O)COc1ccc2ccccc2c1)C(=O)OC(C)(C)C	ZINC000819005142	FG	On-Demand	Anodyne	CYP2D6	19	46
CN(CCNC[C@H](O)COc1ccc2ccccc2c1)C(=O)OC(C)(C)C	ZINC000819005142	FG	On-Demand	Anodyne	ABCB1	28	43
COc1ccc(OC)c([C@H](O)CNC2CCN(C(=O)CC(F)(F)F)CC2)c1	ZINC000819005157	GE	On-Demand	Anodyne	EPHX2	22	41
CON(C)C(=O)CCNCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000819005166	FD	On-Demand	Anodyne	ROCK2	34	51
O=C(/C=C/[C@@H]1CCCO1)NNC(=O)COc1ccc(OCc2ccccc2)cc1	ZINC000819005192	GF	On-Demand	Reactive	LTA4H	19	40
O=C(/C=C/[C@@H]1CCCO1)NNC(=O)COc1ccc(OCc2ccccc2)cc1	ZINC000819005192	GF	On-Demand	Reactive	ADAM17	17	42
O=C(/C=C/[C@@H]1CCCO1)NNC(=O)COc1ccc(OCc2ccccc2)cc1	ZINC000819005192	GF	On-Demand	Reactive	NAAA	15	44
O=C(/C=C\[C@H]1CCCO1)NNC(=O)COc1ccc(OCc2ccccc2)cc1	ZINC000819005193	GF	On-Demand	Reactive	LTA4H	19	40
O=C(/C=C\[C@H]1CCCO1)NNC(=O)COc1ccc(OCc2ccccc2)cc1	ZINC000819005193	GF	On-Demand	Reactive	ADAM17	17	42
O=C(/C=C\[C@H]1CCCO1)NNC(=O)COc1ccc(OCc2ccccc2)cc1	ZINC000819005193	GF	On-Demand	Reactive	NAAA	15	44
O=C(/C=C/[C@H]1CCCO1)NNC(=O)COc1ccc(OCc2ccccc2)cc1	ZINC000819005194	GF	On-Demand	Reactive	LTA4H	19	40
O=C(/C=C/[C@H]1CCCO1)NNC(=O)COc1ccc(OCc2ccccc2)cc1	ZINC000819005194	GF	On-Demand	Reactive	ADAM17	17	42
O=C(/C=C/[C@H]1CCCO1)NNC(=O)COc1ccc(OCc2ccccc2)cc1	ZINC000819005194	GF	On-Demand	Reactive	NAAA	15	44
O=C(/C=C\[C@@H]1CCCO1)NNC(=O)COc1ccc(OCc2ccccc2)cc1	ZINC000819005195	GF	On-Demand	Reactive	LTA4H	19	40
O=C(/C=C\[C@@H]1CCCO1)NNC(=O)COc1ccc(OCc2ccccc2)cc1	ZINC000819005195	GF	On-Demand	Reactive	ADAM17	17	42
O=C(/C=C\[C@@H]1CCCO1)NNC(=O)COc1ccc(OCc2ccccc2)cc1	ZINC000819005195	GF	On-Demand	Reactive	NAAA	15	44
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCO[C@@H]1C(C)C	ZINC000819005216	FE	On-Demand	Reactive	HCN1	43	32
CCOc1ccccc1OCC(=O)NNC(=O)[C@@H]1CCCO[C@@H]1C(C)C	ZINC000819005216	FE	On-Demand	Reactive	HCN4	40	31
O=C(COc1ccc(Br)cc1)NNC(=O)C(F)=C1CCC1	ZINC000819005224	FE	On-Demand	Reactive	TRAR	27	43
COc1ccc(N2CCN(C(=O)C[S@@](=O)c3cccc(OC)c3)CC2)cc1	ZINC000819005229	GE	On-Demand	Clean	HTR1A	15	44
COc1ccc(N2CCN(C(=O)C[S@@](=O)c3cccc(OC)c3)CC2)cc1	ZINC000819005229	GE	On-Demand	Clean	DRD4	50	42
COc1ccc(N2CCN(C(=O)C[S@@](=O)c3cccc(OC)c3)CC2)cc1	ZINC000819005229	GE	On-Demand	Clean	CCKAR	27	41
COc1ccc(N2CCN(C(=O)C[S@@](=O)c3cccc(OC)c3)CC2)cc1	ZINC000819005229	GE	On-Demand	Clean	MTNR1B	27	43
COc1ccc(N2CCN(C(=O)C[S@@](=O)c3cccc(OC)c3)CC2)cc1	ZINC000819005229	GE	On-Demand	Clean	SSTR1	44	35
COc1ccc(N2CCN(C(=O)C[S@](=O)c3cccc(OC)c3)CC2)cc1	ZINC000819005230	GE	On-Demand	Clean	HTR1A	15	44
COc1ccc(N2CCN(C(=O)C[S@](=O)c3cccc(OC)c3)CC2)cc1	ZINC000819005230	GE	On-Demand	Clean	DRD4	50	42
COc1ccc(N2CCN(C(=O)C[S@](=O)c3cccc(OC)c3)CC2)cc1	ZINC000819005230	GE	On-Demand	Clean	CCKAR	27	41
COc1ccc(N2CCN(C(=O)C[S@](=O)c3cccc(OC)c3)CC2)cc1	ZINC000819005230	GE	On-Demand	Clean	MTNR1B	27	43
COc1ccc(N2CCN(C(=O)C[S@](=O)c3cccc(OC)c3)CC2)cc1	ZINC000819005230	GE	On-Demand	Clean	SSTR1	44	35
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819005231	ED	On-Demand	Anodyne	ADRB2	45	38
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819005231	ED	On-Demand	Anodyne	ADRB1	57	45
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819005231	ED	On-Demand	Anodyne	HTR2A	15	42
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819005231	ED	On-Demand	Anodyne	SLC6A1	141	42
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819005231	ED	On-Demand	Anodyne	ADRB3	70	45
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819005231	ED	On-Demand	Anodyne	CYP3A4	41	32
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819005232	ED	On-Demand	Anodyne	ADRB2	45	38
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819005232	ED	On-Demand	Anodyne	ADRB1	57	45
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819005232	ED	On-Demand	Anodyne	HTR2A	15	42
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819005232	ED	On-Demand	Anodyne	SLC6A1	141	42
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819005232	ED	On-Demand	Anodyne	ADRB3	70	45
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819005232	ED	On-Demand	Anodyne	CYP3A4	41	32
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819005233	ED	On-Demand	Anodyne	ADRB2	45	38
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819005233	ED	On-Demand	Anodyne	ADRB1	57	45
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819005233	ED	On-Demand	Anodyne	HTR2A	15	42
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819005233	ED	On-Demand	Anodyne	SLC6A1	141	42
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819005233	ED	On-Demand	Anodyne	ADRB3	70	45
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819005233	ED	On-Demand	Anodyne	CYP3A4	41	32
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819005234	ED	On-Demand	Anodyne	ADRB2	45	38
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819005234	ED	On-Demand	Anodyne	ADRB1	57	45
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819005234	ED	On-Demand	Anodyne	HTR2A	15	42
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819005234	ED	On-Demand	Anodyne	SLC6A1	141	42
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819005234	ED	On-Demand	Anodyne	ADRB3	70	45
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819005234	ED	On-Demand	Anodyne	CYP3A4	41	32
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819005242	ED	On-Demand	Anodyne	SLC6A1	130	42
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819005243	ED	On-Demand	Anodyne	SLC6A1	130	42
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819005244	ED	On-Demand	Anodyne	SLC6A1	130	42
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819005245	ED	On-Demand	Anodyne	SLC6A1	130	42
NC(=O)[C@@H]1CCCN(CCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819005246	FC	On-Demand	Bother	SLC6A1	89	38
NC(=O)[C@H]1CCCN(CCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819005247	FC	On-Demand	Bother	SLC6A1	89	38
NC(=O)[C@H]1CCCN(CCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819005248	FC	On-Demand	Bother	SLC6A1	89	38
NC(=O)[C@@H]1CCCN(CCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819005249	FC	On-Demand	Bother	SLC6A1	89	38
COc1ccc(OC)c([C@H](O)CNCCCc2cnn(C)c2)c1	ZINC000819005260	DD	On-Demand	Anodyne	ADRB2	20	45
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819005265	FD	On-Demand	Anodyne	ADRB2	63	39
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819005265	FD	On-Demand	Anodyne	ADRB1	58	50
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819005265	FD	On-Demand	Anodyne	ADRB3	67	48
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819005266	FD	On-Demand	Anodyne	ADRB2	63	39
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819005266	FD	On-Demand	Anodyne	ADRB1	58	50
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819005266	FD	On-Demand	Anodyne	ADRB3	67	48
Cc1ccccc1[C@@H](O)CNC[C@H](c1cccc(Cl)c1)N1CCOCC1	ZINC000819005294	FG	On-Demand	Anodyne	ADRB1	21	41
Cc1ccccc1[C@@H](O)CNC[C@H](c1cccc(Cl)c1)N1CCOCC1	ZINC000819005294	FG	On-Demand	Anodyne	ADRB3	30	41
Cc1ccccc1[C@@H](O)CNC[C@H](c1cccc(Cl)c1)N1CCOCC1	ZINC000819005294	FG	On-Demand	Anodyne	CYP3A4	41	36
Cc1ccccc1[C@@H](O)CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1	ZINC000819005295	FG	On-Demand	Anodyne	ADRB1	21	41
Cc1ccccc1[C@@H](O)CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1	ZINC000819005295	FG	On-Demand	Anodyne	ADRB3	30	41
Cc1ccccc1[C@@H](O)CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1	ZINC000819005295	FG	On-Demand	Anodyne	CYP3A4	41	36
C[C@@H](CC(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2)n1cccn1	ZINC000819005302	EF	On-Demand	Reactive	BOTA	18	41
C[C@H](CC(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2)n1cccn1	ZINC000819005303	EF	On-Demand	Reactive	BOTA	18	41
CN(CCNCCC(=O)Nc1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000819005308	FE	On-Demand	Bother	COLA	64	36
O[C@@H](CNCC1(c2ccc(Cl)cc2)CCC1)c1cccnc1	ZINC000819005327	DG	On-Demand	Anodyne	ADRB3	85	49
O[C@H](CNCC1(c2ccc(Cl)cc2)CCC1)c1cccnc1	ZINC000819005328	DG	On-Demand	Anodyne	ADRB3	85	49
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819005335	FF	On-Demand	Anodyne	ADRB3	25	40
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819005335	FF	On-Demand	Anodyne	EPHX2	19	48
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819005335	FF	On-Demand	Anodyne	WNT3	46	33
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819005336	FF	On-Demand	Anodyne	ADRB3	25	40
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819005336	FF	On-Demand	Anodyne	EPHX2	19	48
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819005336	FF	On-Demand	Anodyne	WNT3	46	33
O[C@@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(F)c1	ZINC000819005337	GG	On-Demand	Anodyne	ADRB1	26	42
O[C@@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(F)c1	ZINC000819005337	GG	On-Demand	Anodyne	ADRB3	40	42
O[C@@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(F)c1	ZINC000819005338	GG	On-Demand	Anodyne	ADRB1	26	42
O[C@@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(F)c1	ZINC000819005338	GG	On-Demand	Anodyne	ADRB3	40	42
O[C@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(F)c1	ZINC000819005339	GG	On-Demand	Anodyne	ADRB1	26	42
O[C@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(F)c1	ZINC000819005339	GG	On-Demand	Anodyne	ADRB3	40	42
O[C@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(F)c1	ZINC000819005340	GG	On-Demand	Anodyne	ADRB1	26	42
O[C@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(F)c1	ZINC000819005340	GG	On-Demand	Anodyne	ADRB3	40	42
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819005341	EE	On-Demand	Anodyne	ADRB3	20	40
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819005341	EE	On-Demand	Anodyne	EPHX2	20	47
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819005342	EE	On-Demand	Anodyne	ADRB3	20	40
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819005342	EE	On-Demand	Anodyne	EPHX2	20	47
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819005343	FD	On-Demand	Anodyne	ADRB2	52	36
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819005343	FD	On-Demand	Anodyne	ADRB1	39	46
CN(CCNC[C@@H](O)c1cccnc1)C(=O)OC(C)(C)C	ZINC000819005344	CD	On-Demand	Anodyne	ADRB2	24	44
CN(CCNC[C@@H](O)c1cccnc1)C(=O)OC(C)(C)C	ZINC000819005344	CD	On-Demand	Anodyne	ADRB1	37	45
CN(CCNC[C@@H](O)c1cccnc1)C(=O)OC(C)(C)C	ZINC000819005344	CD	On-Demand	Anodyne	ADRB3	111	50
CN(CCNC[C@H](O)c1cccnc1)C(=O)OC(C)(C)C	ZINC000819005345	CD	On-Demand	Anodyne	ADRB2	24	44
CN(CCNC[C@H](O)c1cccnc1)C(=O)OC(C)(C)C	ZINC000819005345	CD	On-Demand	Anodyne	ADRB1	37	45
CN(CCNC[C@H](O)c1cccnc1)C(=O)OC(C)(C)C	ZINC000819005345	CD	On-Demand	Anodyne	ADRB3	111	50
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccccc2Cl)c1	ZINC000819005354	FD	On-Demand	Anodyne	ADRB2	42	43
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccccc2Cl)c1	ZINC000819005354	FD	On-Demand	Anodyne	ADRB1	23	43
O[C@@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(Cl)c1	ZINC000819005360	GH	On-Demand	Anodyne	ADRB1	30	45
O[C@@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(Cl)c1	ZINC000819005360	GH	On-Demand	Anodyne	ADRB3	44	45
O[C@@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(Cl)c1	ZINC000819005360	GH	On-Demand	Anodyne	IGF1R	27	40
O[C@@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(Cl)c1	ZINC000819005360	GH	On-Demand	Anodyne	CYP3A4	46	37
O[C@@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(Cl)c1	ZINC000819005361	GH	On-Demand	Anodyne	ADRB1	30	45
O[C@@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(Cl)c1	ZINC000819005361	GH	On-Demand	Anodyne	ADRB3	44	45
O[C@@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(Cl)c1	ZINC000819005361	GH	On-Demand	Anodyne	IGF1R	27	40
O[C@@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(Cl)c1	ZINC000819005361	GH	On-Demand	Anodyne	CYP3A4	46	37
O[C@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(Cl)c1	ZINC000819005362	GH	On-Demand	Anodyne	ADRB1	30	45
O[C@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(Cl)c1	ZINC000819005362	GH	On-Demand	Anodyne	ADRB3	44	45
O[C@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(Cl)c1	ZINC000819005362	GH	On-Demand	Anodyne	IGF1R	27	40
O[C@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(Cl)c1	ZINC000819005362	GH	On-Demand	Anodyne	CYP3A4	46	37
O[C@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(Cl)c1	ZINC000819005363	GH	On-Demand	Anodyne	ADRB1	30	45
O[C@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(Cl)c1	ZINC000819005363	GH	On-Demand	Anodyne	ADRB3	44	45
O[C@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(Cl)c1	ZINC000819005363	GH	On-Demand	Anodyne	IGF1R	27	40
O[C@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1cccc(Cl)c1	ZINC000819005363	GH	On-Demand	Anodyne	CYP3A4	46	37
C=C(C)C(C)(C)C(=O)NNC(=O)c1cccc(Cl)c1	ZINC000819005379	CF	On-Demand	Reactive	ABAT	26	43
C=C(C)C(C)(C)C(=O)NNC(=O)c1cccc(Cl)c1	ZINC000819005379	CF	On-Demand	Reactive	ECR	24	45
C=C(C)C(C)(C)C(=O)NNC(=O)c1cccc(Cl)c1	ZINC000819005379	CF	On-Demand	Reactive	KCNK3	22	44
C=C(C)C(C)(C)C(=O)NNC(=O)c1cccc(Cl)c1	ZINC000819005379	CF	On-Demand	Reactive	KCNK9	15	44
O[C@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)C1CC1	ZINC000819005380	DE	On-Demand	Anodyne	MAPK1	41	41
O[C@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)C1CC1	ZINC000819005381	DE	On-Demand	Anodyne	MAPK1	41	41
O[C@@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)C1CC1	ZINC000819005382	DE	On-Demand	Anodyne	MAPK1	41	41
O[C@@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)C1CC1	ZINC000819005383	DE	On-Demand	Anodyne	MAPK1	41	41
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2c(F)cccc2F)CC1	ZINC000819005385	FF	On-Demand	Anodyne	EPHX2	18	47
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2c(F)cccc2F)CC1	ZINC000819005386	FF	On-Demand	Anodyne	EPHX2	18	47
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819005387	GF	On-Demand	Anodyne	ADRB2	33	40
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819005387	GF	On-Demand	Anodyne	ADRB1	29	40
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819005388	GF	On-Demand	Anodyne	ADRB2	33	40
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819005388	GF	On-Demand	Anodyne	ADRB1	29	40
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819005389	FE	On-Demand	Anodyne	ADRB2	31	40
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819005389	FE	On-Demand	Anodyne	ADRB1	18	40
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819005390	FE	On-Demand	Anodyne	ADRB2	31	40
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819005390	FE	On-Demand	Anodyne	ADRB1	18	40
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819005391	GG	On-Demand	Anodyne	EPHX2	22	47
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819005391	GG	On-Demand	Anodyne	RBP4	62	38
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819005391	GG	On-Demand	Anodyne	SFRP1	124	41
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819005391	GG	On-Demand	Anodyne	SCD	19	42
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819005391	GG	On-Demand	Anodyne	WNT3	85	41
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819005392	GG	On-Demand	Anodyne	EPHX2	22	47
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819005392	GG	On-Demand	Anodyne	RBP4	62	38
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819005392	GG	On-Demand	Anodyne	SFRP1	124	41
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819005392	GG	On-Demand	Anodyne	SCD	19	42
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819005392	GG	On-Demand	Anodyne	WNT3	85	41
O=C(NCc1ccncc1)Nc1cccc(CNC[C@@H](O)C2CC2)c1	ZINC000819005403	EE	On-Demand	Anodyne	ROCK1	15	41
O=C(NCc1ccncc1)Nc1cccc(CNC[C@@H](O)C2CC2)c1	ZINC000819005403	EE	On-Demand	Anodyne	ROCK2	25	47
O=C(NCc1ccncc1)Nc1cccc(CNC[C@@H](O)C2CC2)c1	ZINC000819005403	EE	On-Demand	Anodyne	PRMT3	25	40
O=C(NCc1ccncc1)Nc1cccc(CNC[C@@H](O)C2CC2)c1	ZINC000819005403	EE	On-Demand	Anodyne	NAMPT	43	39
O=C(NCc1ccncc1)Nc1cccc(CNC[C@H](O)C2CC2)c1	ZINC000819005404	EE	On-Demand	Anodyne	ROCK1	15	41
O=C(NCc1ccncc1)Nc1cccc(CNC[C@H](O)C2CC2)c1	ZINC000819005404	EE	On-Demand	Anodyne	ROCK2	25	47
O=C(NCc1ccncc1)Nc1cccc(CNC[C@H](O)C2CC2)c1	ZINC000819005404	EE	On-Demand	Anodyne	PRMT3	25	40
O=C(NCc1ccncc1)Nc1cccc(CNC[C@H](O)C2CC2)c1	ZINC000819005404	EE	On-Demand	Anodyne	NAMPT	43	39
O=C(CCc1cccc(OC(F)F)c1)NNC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819005414	GH	On-Demand	Reactive	EPHX2	18	47
O[C@@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(Cl)cc1	ZINC000819005417	GH	On-Demand	Anodyne	ADRB1	29	40
O[C@@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(Cl)cc1	ZINC000819005417	GH	On-Demand	Anodyne	ADRB3	43	40
O[C@@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(Cl)cc1	ZINC000819005418	GH	On-Demand	Anodyne	ADRB1	29	40
O[C@@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1ccc(Cl)cc1	ZINC000819005418	GH	On-Demand	Anodyne	ADRB3	43	40
Cc1cc(F)ccc1[C@@H](O)CNC1CCN(C(=O)CC(F)(F)F)CC1	ZINC000819005424	FF	On-Demand	Anodyne	EPHX2	15	43
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1cccc(Cl)c1	ZINC000819005443	CF	On-Demand	Reactive	KCNK3	20	41
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1cccc(Cl)c1	ZINC000819005444	CF	On-Demand	Reactive	KCNK3	20	41
CC(=O)Nc1cccc(CC(=O)NNC(=O)C23CC4CC(CC(C4)C2)C3)c1	ZINC000819005446	FF	On-Demand	Reactive	EPHX2	43	44
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2F)CC1	ZINC000819005487	EE	On-Demand	Anodyne	EPHX2	16	46
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2F)CC1	ZINC000819005487	EE	On-Demand	Anodyne	SFRP1	54	36
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2F)CC1	ZINC000819005488	EE	On-Demand	Anodyne	EPHX2	16	46
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2F)CC1	ZINC000819005488	EE	On-Demand	Anodyne	SFRP1	54	36
CN(CCNC[C@@H](O)COc1c(Cl)cccc1Cl)C(=O)OC(C)(C)C	ZINC000819005489	GG	On-Demand	Anodyne	ADRB2	28	43
CN(CCNC[C@@H](O)COc1c(Cl)cccc1Cl)C(=O)OC(C)(C)C	ZINC000819005489	GG	On-Demand	Anodyne	ADRB1	40	37
CN(CCNC[C@H](O)COc1c(Cl)cccc1Cl)C(=O)OC(C)(C)C	ZINC000819005490	GG	On-Demand	Anodyne	ADRB2	28	43
CN(CCNC[C@H](O)COc1c(Cl)cccc1Cl)C(=O)OC(C)(C)C	ZINC000819005490	GG	On-Demand	Anodyne	ADRB1	40	37
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1S(=O)(=O)N1CCOCC1	ZINC000819005500	GD	On-Demand	Anodyne	CPT1A	52	37
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1S(=O)(=O)N1CCOCC1	ZINC000819005500	GD	On-Demand	Anodyne	CPT2	47	36
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1S(=O)(=O)N1CCOCC1	ZINC000819005500	GD	On-Demand	Anodyne	F13A1	40	41
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1S(=O)(=O)N1CCOCC1	ZINC000819005501	GD	On-Demand	Anodyne	CPT1A	52	37
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1S(=O)(=O)N1CCOCC1	ZINC000819005501	GD	On-Demand	Anodyne	CPT2	47	36
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1S(=O)(=O)N1CCOCC1	ZINC000819005501	GD	On-Demand	Anodyne	F13A1	40	41
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1S(=O)(=O)N1CCOCC1	ZINC000819005502	GD	On-Demand	Anodyne	CPT1A	52	37
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1S(=O)(=O)N1CCOCC1	ZINC000819005502	GD	On-Demand	Anodyne	CPT2	47	36
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1S(=O)(=O)N1CCOCC1	ZINC000819005502	GD	On-Demand	Anodyne	F13A1	40	41
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1S(=O)(=O)N1CCOCC1	ZINC000819005503	GD	On-Demand	Anodyne	CPT1A	52	37
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1S(=O)(=O)N1CCOCC1	ZINC000819005503	GD	On-Demand	Anodyne	CPT2	47	36
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1S(=O)(=O)N1CCOCC1	ZINC000819005503	GD	On-Demand	Anodyne	F13A1	40	41
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819005504	FD	On-Demand	Bother	ADRB1	18	43
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819005505	FD	On-Demand	Bother	ADRB1	18	43
O[C@@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1cccnc1	ZINC000819005525	FE	On-Demand	Anodyne	ADRB1	42	40
O[C@@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1cccnc1	ZINC000819005525	FE	On-Demand	Anodyne	ADRB3	104	40
O[C@@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1cccnc1	ZINC000819005526	FE	On-Demand	Anodyne	ADRB1	42	40
O[C@@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1cccnc1	ZINC000819005526	FE	On-Demand	Anodyne	ADRB3	104	40
O[C@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1cccnc1	ZINC000819005527	FE	On-Demand	Anodyne	ADRB1	42	40
O[C@H](CNC[C@@H](c1cccc(Cl)c1)N1CCOCC1)c1cccnc1	ZINC000819005527	FE	On-Demand	Anodyne	ADRB3	104	40
O[C@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1cccnc1	ZINC000819005528	FE	On-Demand	Anodyne	ADRB1	42	40
O[C@H](CNC[C@H](c1cccc(Cl)c1)N1CCOCC1)c1cccnc1	ZINC000819005528	FE	On-Demand	Anodyne	ADRB3	104	40
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819005531	DD	On-Demand	Anodyne	ADRB2	56	40
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819005531	DD	On-Demand	Anodyne	ADRB1	46	46
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819005531	DD	On-Demand	Anodyne	ADRB3	66	38
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819005532	DD	On-Demand	Anodyne	ADRB2	56	40
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819005532	DD	On-Demand	Anodyne	ADRB1	46	46
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819005532	DD	On-Demand	Anodyne	ADRB3	66	38
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819005535	FF	On-Demand	Anodyne	ADRB1	37	47
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819005535	FF	On-Demand	Anodyne	ADRB3	58	52
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819005535	FF	On-Demand	Anodyne	C3AR1	25	41
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819005535	FF	On-Demand	Anodyne	EPHX2	22	46
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819005535	FF	On-Demand	Anodyne	CYP3A4	49	38
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819005536	FF	On-Demand	Anodyne	ADRB1	37	47
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819005536	FF	On-Demand	Anodyne	ADRB3	58	52
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819005536	FF	On-Demand	Anodyne	C3AR1	25	41
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819005536	FF	On-Demand	Anodyne	EPHX2	22	46
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819005536	FF	On-Demand	Anodyne	CYP3A4	49	38
CN(CCNC[C@H](O)c1cccc(Br)c1)C(=O)OC(C)(C)C	ZINC000819005540	FF	On-Demand	Anodyne	ADRB3	42	40
CN(CCNC[C@@H](O)c1cccc(Br)c1)C(=O)OC(C)(C)C	ZINC000819005541	FF	On-Demand	Anodyne	ADRB3	42	40
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819005542	GG	On-Demand	Anodyne	ADRB3	16	51
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819005542	GG	On-Demand	Anodyne	EPHX2	24	59
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819005542	GG	On-Demand	Anodyne	LIPG	44	33
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819005543	GG	On-Demand	Anodyne	ADRB3	16	51
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819005543	GG	On-Demand	Anodyne	EPHX2	24	59
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819005543	GG	On-Demand	Anodyne	LIPG	44	33
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819005553	FD	On-Demand	Bother	ADRB1	15	44
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819005554	FD	On-Demand	Bother	ADRB1	15	44
Cc1ccccc1[C@@H](O)CNCCc1c(C)[nH]c2ccccc12	ZINC000819005555	DH	On-Demand	Anodyne	ADRB2	51	35
Cc1ccccc1[C@@H](O)CNCCc1c(C)[nH]c2ccccc12	ZINC000819005555	DH	On-Demand	Anodyne	GNRHR	29	45
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819005559	GG	On-Demand	Anodyne	ADRB3	24	41
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819005559	GG	On-Demand	Anodyne	EPHX2	18	45
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819005560	GG	On-Demand	Anodyne	ADRB3	24	41
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819005560	GG	On-Demand	Anodyne	EPHX2	18	45
CCOc1ccccc1C(F)(F)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819005565	EF	On-Demand	Anodyne	HCN1	55	38
CCOc1ccccc1C(F)(F)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819005565	EF	On-Demand	Anodyne	HCN4	48	38
CCOc1ccccc1C(F)(F)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819005566	EF	On-Demand	Anodyne	HCN1	55	38
CCOc1ccccc1C(F)(F)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819005566	EF	On-Demand	Anodyne	HCN4	48	38
CCOc1ccccc1C(F)(F)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819005567	EF	On-Demand	Anodyne	HCN1	55	38
CCOc1ccccc1C(F)(F)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819005567	EF	On-Demand	Anodyne	HCN4	48	38
CCOc1ccccc1C(F)(F)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819005568	EF	On-Demand	Anodyne	HCN1	55	38
CCOc1ccccc1C(F)(F)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819005568	EF	On-Demand	Anodyne	HCN4	48	38
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CC(C3CCCCC3)C2)C1	ZINC000819005573	FH	On-Demand	Anodyne	PREP	18	50
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CC(C3CCCCC3)C2)C1	ZINC000819005573	FH	On-Demand	Anodyne	GPR119	19	40
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CC(C3CCCCC3)C2)C1	ZINC000819005574	FH	On-Demand	Anodyne	PREP	18	50
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CC(C3CCCCC3)C2)C1	ZINC000819005574	FH	On-Demand	Anodyne	GPR119	19	40
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1CC(C2CCCCC2)C1	ZINC000819005587	FH	On-Demand	Anodyne	CTSD	15	41
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1CC(C2CCCCC2)C1	ZINC000819005587	FH	On-Demand	Anodyne	CTSK	18	47
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1CC(C2CCCCC2)C1	ZINC000819005587	FH	On-Demand	Anodyne	ECE1	25	41
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1CC(C2CCCCC2)C1	ZINC000819005587	FH	On-Demand	Anodyne	REN	47	45
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1CC(C2CCCCC2)C1	ZINC000819005587	FH	On-Demand	Anodyne	POLG_HCV1	29	48
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1CC(C2CCCCC2)C1	ZINC000819005587	FH	On-Demand	Anodyne	FPR1	38	42
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1CC(C2CCCCC2)C1	ZINC000819005588	FH	On-Demand	Anodyne	CTSD	15	41
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1CC(C2CCCCC2)C1	ZINC000819005588	FH	On-Demand	Anodyne	CTSK	18	47
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1CC(C2CCCCC2)C1	ZINC000819005588	FH	On-Demand	Anodyne	ECE1	25	41
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1CC(C2CCCCC2)C1	ZINC000819005588	FH	On-Demand	Anodyne	REN	47	45
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1CC(C2CCCCC2)C1	ZINC000819005588	FH	On-Demand	Anodyne	POLG_HCV1	29	48
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1CC(C2CCCCC2)C1	ZINC000819005588	FH	On-Demand	Anodyne	FPR1	38	42
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000819005600	IH	On-Demand	Bother	NMBR	47	31
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000819005600	IH	On-Demand	Bother	KCNMA1	19	40
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000819005600	IH	On-Demand	Bother	WDR5	20	40
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000819005602	IH	On-Demand	Bother	NMBR	47	31
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000819005602	IH	On-Demand	Bother	KCNMA1	19	40
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000819005602	IH	On-Demand	Bother	WDR5	20	40
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000819005603	IH	On-Demand	Bother	NMBR	47	31
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000819005603	IH	On-Demand	Bother	KCNMA1	19	40
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000819005603	IH	On-Demand	Bother	WDR5	20	40
O=C([C@@H]1CCCN1C(=O)OCC(F)(F)F)N1CC(C2CCCCC2)C1	ZINC000819005613	FG	On-Demand	Anodyne	PREP	51	45
O=C([C@H]1CCCN1C(=O)OCC(F)(F)F)N1CC(C2CCCCC2)C1	ZINC000819005614	FG	On-Demand	Anodyne	PREP	51	45
O=C(c1ccnc(C(F)(F)F)c1)N1CC(C2CCCCC2)C1	ZINC000819005615	DH	On-Demand	Anodyne	L3MBTL3	39	41
O=C(c1ccc[n+]([O-])c1)N1CC(C2CCCCC2)C1	ZINC000819005617	CD	On-Demand	Anodyne	L3MBTL3	35	40
O=C(c1ccc(C2SCCCS2)cc1)N1CC(C2CCCCC2)C1	ZINC000819005618	FK	On-Demand	Anodyne	L3MBTL3	53	46
C#Cc1ccc(C(=O)N2CC(C3CCCCC3)C2)cn1	ZINC000819005662	CF	On-Demand	Mild	L3MBTL3	61	45
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819005665	GE	On-Demand	Bother	C3AR1	21	42
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819005666	GE	On-Demand	Bother	C3AR1	21	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc3nc(C)sc3c1)C2	ZINC000819005675	FG	On-Demand	Anodyne	ACOX1	46	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc3nc(C)sc3c1)C2	ZINC000819005676	FG	On-Demand	Anodyne	ACOX1	46	35
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2cccc(F)c2)CC1	ZINC000819005710	EE	On-Demand	Anodyne	EPHX2	19	47
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819005711	EE	On-Demand	Anodyne	EPHX2	19	47
CN(CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)C(=O)OC(C)(C)C	ZINC000819005716	GG	On-Demand	Anodyne	ADRB3	19	49
CN(CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)C(=O)OC(C)(C)C	ZINC000819005717	GG	On-Demand	Anodyne	ADRB3	19	49
CN(CCNC[C@@H](O)COc1ccc2c(c1)OCO2)C(=O)OC(C)(C)C	ZINC000819005718	FD	On-Demand	Anodyne	ADRB1	48	38
CN(CCNC[C@H](O)COc1ccc2c(c1)OCO2)C(=O)OC(C)(C)C	ZINC000819005719	FD	On-Demand	Anodyne	ADRB1	48	38
CON(C)C(=O)CCNCCc1c(C)[nH]c2ccccc12	ZINC000819005724	CE	On-Demand	Anodyne	GNRHR	39	43
CON(C)C(=O)CCNCCc1c(C)[nH]c2ccccc12	ZINC000819005724	CE	On-Demand	Anodyne	HDAC7	15	51
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819005727	GG	On-Demand	Anodyne	ADRB3	25	41
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819005727	GG	On-Demand	Anodyne	CACNA1B	41	34
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819005727	GG	On-Demand	Anodyne	CCR2	58	42
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819005727	GG	On-Demand	Anodyne	EPHX2	23	53
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819005727	GG	On-Demand	Anodyne	LIPG	48	33
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819005727	GG	On-Demand	Anodyne	SFRP1	61	36
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819005727	GG	On-Demand	Anodyne	WNT3	42	36
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819005728	GG	On-Demand	Anodyne	ADRB3	25	41
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819005728	GG	On-Demand	Anodyne	CACNA1B	41	34
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819005728	GG	On-Demand	Anodyne	CCR2	58	42
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819005728	GG	On-Demand	Anodyne	EPHX2	23	53
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819005728	GG	On-Demand	Anodyne	LIPG	48	33
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819005728	GG	On-Demand	Anodyne	SFRP1	61	36
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819005728	GG	On-Demand	Anodyne	WNT3	42	36
CC(=O)Nc1cccc(CC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	ZINC000819005734	GF	On-Demand	Reactive	P2RX7	21	46
CC(=O)Nc1cccc(CC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	ZINC000819005734	GF	On-Demand	Reactive	EPHX2	45	48
CC(=O)Nc1cccc(CC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	ZINC000819005734	GF	On-Demand	Reactive	HIF1A	17	40
CC(=O)Nc1cccc(CC(=O)NNC(=O)CC23CC4CC(CC(C4)C2)C3)c1	ZINC000819005734	GF	On-Demand	Reactive	BOTA	29	41
CN(CCNC[C@H](O)COc1cccc2ccccc12)C(=O)OC(C)(C)C	ZINC000819005735	FG	On-Demand	Anodyne	ADRB2	43	61
CN(CCNC[C@H](O)COc1cccc2ccccc12)C(=O)OC(C)(C)C	ZINC000819005735	FG	On-Demand	Anodyne	ADRB1	67	38
CN(CCNC[C@H](O)COc1cccc2ccccc12)C(=O)OC(C)(C)C	ZINC000819005735	FG	On-Demand	Anodyne	ADRB3	29	54
CN(CCNC[C@H](O)COc1cccc2ccccc12)C(=O)OC(C)(C)C	ZINC000819005735	FG	On-Demand	Anodyne	CASR	40	36
CN(CCNC[C@H](O)COc1cccc2ccccc12)C(=O)OC(C)(C)C	ZINC000819005735	FG	On-Demand	Anodyne	CYP2D6	24	47
CN(CCNC[C@H](O)COc1cccc2ccccc12)C(=O)OC(C)(C)C	ZINC000819005735	FG	On-Demand	Anodyne	ABCB1	37	46
CN(CCNC[C@@H](O)COc1cccc2ccccc12)C(=O)OC(C)(C)C	ZINC000819005736	FG	On-Demand	Anodyne	ADRB2	43	61
CN(CCNC[C@@H](O)COc1cccc2ccccc12)C(=O)OC(C)(C)C	ZINC000819005736	FG	On-Demand	Anodyne	ADRB1	67	38
CN(CCNC[C@@H](O)COc1cccc2ccccc12)C(=O)OC(C)(C)C	ZINC000819005736	FG	On-Demand	Anodyne	ADRB3	29	54
CN(CCNC[C@@H](O)COc1cccc2ccccc12)C(=O)OC(C)(C)C	ZINC000819005736	FG	On-Demand	Anodyne	CASR	40	36
CN(CCNC[C@@H](O)COc1cccc2ccccc12)C(=O)OC(C)(C)C	ZINC000819005736	FG	On-Demand	Anodyne	CYP2D6	24	47
CN(CCNC[C@@H](O)COc1cccc2ccccc12)C(=O)OC(C)(C)C	ZINC000819005736	FG	On-Demand	Anodyne	ABCB1	37	46
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2cc3ccccc3o2)CC1	ZINC000819005741	FF	On-Demand	Anodyne	SFRP1	85	37
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2cc3ccccc3o2)CC1	ZINC000819005741	FF	On-Demand	Anodyne	WNT3	59	37
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819005748	GG	On-Demand	Anodyne	CCR8	70	38
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819005748	GG	On-Demand	Anodyne	SFRP1	46	35
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819005754	EE	On-Demand	Anodyne	ADRB1	21	41
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819005754	EE	On-Demand	Anodyne	ADRB3	38	41
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819005754	EE	On-Demand	Anodyne	EPHX2	22	48
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819005754	EE	On-Demand	Anodyne	CCR8	49	38
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819005754	EE	On-Demand	Anodyne	SFRP1	113	40
O=C(CC(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819005754	EE	On-Demand	Anodyne	WNT3	78	39
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819005755	EE	On-Demand	Anodyne	ADRB1	21	41
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819005755	EE	On-Demand	Anodyne	ADRB3	38	41
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819005755	EE	On-Demand	Anodyne	EPHX2	22	48
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819005755	EE	On-Demand	Anodyne	CCR8	49	38
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819005755	EE	On-Demand	Anodyne	SFRP1	113	40
O=C(CC(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819005755	EE	On-Demand	Anodyne	WNT3	78	39
CN(CCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)C(=O)OC(C)(C)C	ZINC000819005756	GD	On-Demand	Anodyne	ADRB1	40	40
CN(CCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)C(=O)OC(C)(C)C	ZINC000819005757	GD	On-Demand	Anodyne	ADRB1	40	40
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CC(C2CCCCC2)C1	ZINC000819005781	GF	On-Demand	Anodyne	SFRP1	120	41
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CC(C2CCCCC2)C1	ZINC000819005781	GF	On-Demand	Anodyne	WNT3	79	34
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@@]2(O)CCC[C@@H]2C)c1	ZINC000819005789	FH	On-Demand	Anodyne	KCNA3	40	37
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@@]2(O)CCC[C@@H]2C)c1	ZINC000819005789	FH	On-Demand	Anodyne	HCN1	46	31
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@@]2(O)CCC[C@@H]2C)c1	ZINC000819005789	FH	On-Demand	Anodyne	HCN4	40	31
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@@]2(O)CCC[C@@H]2C)c1	ZINC000819005789	FH	On-Demand	Anodyne	KCNK3	83	43
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@@]2(O)CCC[C@@H]2C)c1	ZINC000819005789	FH	On-Demand	Anodyne	KCNK9	52	43
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@]2(O)CCC[C@@H]2C)c1	ZINC000819005790	FH	On-Demand	Anodyne	KCNA3	40	37
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@]2(O)CCC[C@@H]2C)c1	ZINC000819005790	FH	On-Demand	Anodyne	HCN1	46	31
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@]2(O)CCC[C@@H]2C)c1	ZINC000819005790	FH	On-Demand	Anodyne	HCN4	40	31
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@]2(O)CCC[C@@H]2C)c1	ZINC000819005790	FH	On-Demand	Anodyne	KCNK3	83	43
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@]2(O)CCC[C@@H]2C)c1	ZINC000819005790	FH	On-Demand	Anodyne	KCNK9	52	43
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@]2(O)CCC[C@H]2C)c1	ZINC000819005791	FH	On-Demand	Anodyne	KCNA3	40	37
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@]2(O)CCC[C@H]2C)c1	ZINC000819005791	FH	On-Demand	Anodyne	HCN1	46	31
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@]2(O)CCC[C@H]2C)c1	ZINC000819005791	FH	On-Demand	Anodyne	HCN4	40	31
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@]2(O)CCC[C@H]2C)c1	ZINC000819005791	FH	On-Demand	Anodyne	KCNK3	83	43
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@]2(O)CCC[C@H]2C)c1	ZINC000819005791	FH	On-Demand	Anodyne	KCNK9	52	43
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@@]2(O)CCC[C@H]2C)c1	ZINC000819005792	FH	On-Demand	Anodyne	KCNA3	40	37
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@@]2(O)CCC[C@H]2C)c1	ZINC000819005792	FH	On-Demand	Anodyne	HCN1	46	31
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@@]2(O)CCC[C@H]2C)c1	ZINC000819005792	FH	On-Demand	Anodyne	HCN4	40	31
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@@]2(O)CCC[C@H]2C)c1	ZINC000819005792	FH	On-Demand	Anodyne	KCNK3	83	43
Cc1cccc(C(=O)Nc2ccccc2C(=O)NC[C@@]2(O)CCC[C@H]2C)c1	ZINC000819005792	FH	On-Demand	Anodyne	KCNK9	52	43
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCC[C@@H](C)C2)c1	ZINC000819005795	IG	On-Demand	Anodyne	SLC6A9	40	40
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCC[C@@H](C)C2)c1	ZINC000819005795	IG	On-Demand	Anodyne	CACNA1I	48	36
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCC[C@@H](C)C2)c1	ZINC000819005796	IG	On-Demand	Anodyne	SLC6A9	40	40
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCC[C@@H](C)C2)c1	ZINC000819005796	IG	On-Demand	Anodyne	CACNA1I	48	36
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	ACE	20	42
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	SSTR2	81	45
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	GHRHR	28	42
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	MME	26	43
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	EDNRB	39	41
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	EDNRA	39	58
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	TACR1	35	55
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	PGC	52	33
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	MC4R	45	40
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	PAPA1_CARPA	42	42
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	CCKAR	149	54
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	CTSL	24	51
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	PGA	25	50
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	BRS3	29	43
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	TIMP3	32	40
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	NMBR	91	42
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	MC3R	61	35
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	MC5R	66	33
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	MMP2	26	43
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	MMP8	36	42
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	GRPR	111	35
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	ECE1	70	49
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	REN	72	50
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	REN1	35	50
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	SSTR3	19	48
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	MMP11	82	37
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	CCKBR	119	54
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	GHSR	61	45
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	MMP9	26	43
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	MC1R	92	40
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	MMP1	23	42
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	FPR1	53	55
C[C@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005803	HG	On-Demand	Anodyne	KISS1R	72	34
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	ACE	20	42
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	SSTR2	81	45
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	GHRHR	28	42
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	MME	26	43
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	EDNRB	39	41
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	EDNRA	39	58
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	TACR1	35	55
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	PGC	52	33
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	MC4R	45	40
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	PAPA1_CARPA	42	42
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	CCKAR	149	54
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	CTSL	24	51
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	PGA	25	50
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	BRS3	29	43
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	TIMP3	32	40
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	NMBR	91	42
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	MC3R	61	35
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	MC5R	66	33
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	MMP2	26	43
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	MMP8	36	42
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	GRPR	111	35
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	ECE1	70	49
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	REN	72	50
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	REN1	35	50
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	SSTR3	19	48
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	MMP11	82	37
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	CCKBR	119	54
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	GHSR	61	45
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	MMP9	26	43
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	MC1R	92	40
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	MMP1	23	42
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	FPR1	53	55
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005804	HG	On-Demand	Anodyne	KISS1R	72	34
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	ACE	20	42
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	SSTR2	81	45
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	GHRHR	28	42
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	MME	26	43
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	EDNRB	39	41
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	EDNRA	39	58
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	TACR1	35	55
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	PGC	52	33
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	MC4R	45	40
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	PAPA1_CARPA	42	42
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	CCKAR	149	54
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	CTSL	24	51
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	PGA	25	50
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	BRS3	29	43
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	TIMP3	32	40
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	NMBR	91	42
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	MC3R	61	35
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	MC5R	66	33
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	MMP2	26	43
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	MMP8	36	42
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	GRPR	111	35
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	ECE1	70	49
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	REN	72	50
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	REN1	35	50
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	SSTR3	19	48
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	MMP11	82	37
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	CCKBR	119	54
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	GHSR	61	45
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	MMP9	26	43
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	MC1R	92	40
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	MMP1	23	42
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	FPR1	53	55
C[C@@H]1CCC[C@]1(O)CNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819005805	HG	On-Demand	Anodyne	KISS1R	72	34
O=C(N/C(=C\c1cccnc1)C(=O)N1CC(C2CCCCC2)C1)c1ccccc1	ZINC000819005809	GH	On-Demand	Anodyne	C3AR1	31	42
O=C(N/C(=C/c1cccnc1)C(=O)N1CC(C2CCCCC2)C1)c1ccccc1	ZINC000819005810	GH	On-Demand	Anodyne	C3AR1	31	42
O=C([C@@H]1C[C@H]1c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819005817	CH	On-Demand	Anodyne	CCR5	27	44
O=C([C@@H]1C[C@H]1c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819005817	CH	On-Demand	Anodyne	PREP	18	53
O=C([C@@H]1C[C@H]1c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819005817	CH	On-Demand	Anodyne	SMO	15	41
CC(C)(C)OC(=O)N1CCC(C(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819005826	FH	On-Demand	Anodyne	GPR119	37	46
O=C(c1c(O)cccc1Cl)N1CC(C2CCCCC2)C1	ZINC000819005848	CH	On-Demand	Anodyne	L3MBTL3	46	38
CO/C(=C/c1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819005857	CH	On-Demand	Anodyne	TLR4	27	44
CO/C(=C\c1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819005858	CH	On-Demand	Anodyne	TLR4	27	44
CN(CCNC[C@@H](O)CN1CCc2ccccc2C1)C(=O)OC(C)(C)C	ZINC000819005866	FD	On-Demand	Anodyne	NOD2	40	34
CN(CCNC[C@H](O)CN1CCc2ccccc2C1)C(=O)OC(C)(C)C	ZINC000819005867	FD	On-Demand	Anodyne	NOD2	40	34
Cc1ccc(OC[C@@H](O)CNCCN(C)C(=O)OC(C)(C)C)c(C)c1	ZINC000819005868	FE	On-Demand	Anodyne	ADRB2	23	44
Cc1ccc(OC[C@@H](O)CNCCN(C)C(=O)OC(C)(C)C)c(C)c1	ZINC000819005868	FE	On-Demand	Anodyne	ADRB1	42	34
Cc1ccc(OC[C@H](O)CNCCN(C)C(=O)OC(C)(C)C)c(C)c1	ZINC000819005869	FE	On-Demand	Anodyne	ADRB2	23	44
Cc1ccc(OC[C@H](O)CNCCN(C)C(=O)OC(C)(C)C)c(C)c1	ZINC000819005869	FE	On-Demand	Anodyne	ADRB1	42	34
COc1ccc(OC)c([C@H](O)CNCCc2c(C)[nH]c3ccccc23)c1	ZINC000819005882	FG	On-Demand	Anodyne	ADRB2	48	49
COc1ccc(OC)c([C@H](O)CNCCc2c(C)[nH]c3ccccc23)c1	ZINC000819005882	FG	On-Demand	Anodyne	GNRHR	24	46
O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N1CC(C2CCCCC2)C1	ZINC000819005904	GH	On-Demand	Anodyne	SFRP1	46	36
O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N1CC(C2CCCCC2)C1	ZINC000819005904	GH	On-Demand	Anodyne	L3MBTL3	58	46
Cc1c(C(=O)N2CC(C3CCCCC3)C2)nnn1C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819005917	IH	On-Demand	Anodyne	GPR119	19	41
COc1cccc(C(=O)NC[C@@]2(O)CCC[C@@H]2C)n1	ZINC000819005920	CD	On-Demand	Anodyne	KCNA3	40	33
COc1cccc(C(=O)NC[C@]2(O)CCC[C@@H]2C)n1	ZINC000819005921	CD	On-Demand	Anodyne	KCNA3	40	33
COc1cccc(C(=O)NC[C@]2(O)CCC[C@H]2C)n1	ZINC000819005922	CD	On-Demand	Anodyne	KCNA3	40	33
COc1cccc(C(=O)NC[C@@]2(O)CCC[C@H]2C)n1	ZINC000819005923	CD	On-Demand	Anodyne	KCNA3	40	33
CC(C)(C)OC(=O)NCc1ccc(C(=O)N2CC(C3CCCCC3)C2)cc1	ZINC000819005949	FI	On-Demand	Anodyne	CACNA1B	15	42
C[C@H]1CCC[C@]1(O)CNC(=O)[C@@H]1CCC(=O)N1C	ZINC000819005961	CC	On-Demand	Anodyne	P2RX7	29	47
C[C@H]1CCC[C@@]1(O)CNC(=O)[C@@H]1CCC(=O)N1C	ZINC000819005962	CC	On-Demand	Anodyne	P2RX7	29	47
CC(C)(C)OC(=O)N1CCc2cc(C(=O)N3CC(C4CCCCC4)C3)ccc21	ZINC000819005968	GJ	On-Demand	Anodyne	GPR119	22	46
CC(C)(C)OC(=O)N1CCC(n2cccc2C(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819005971	HJ	On-Demand	Anodyne	GPR119	37	45
C[C@H](Sc1nc2ccccc2s1)C(=O)NC[C@]1(O)CCC[C@H]1C	ZINC000819005976	FG	On-Demand	Anodyne	TMPRSS6	44	32
C[C@H](Sc1nc2ccccc2s1)C(=O)NC[C@]1(O)CCC[C@@H]1C	ZINC000819005977	FG	On-Demand	Anodyne	TMPRSS6	44	32
C[C@H](Sc1nc2ccccc2s1)C(=O)NC[C@@]1(O)CCC[C@H]1C	ZINC000819005978	FG	On-Demand	Anodyne	TMPRSS6	44	32
C[C@H](Sc1nc2ccccc2s1)C(=O)NC[C@@]1(O)CCC[C@@H]1C	ZINC000819005979	FG	On-Demand	Anodyne	TMPRSS6	44	32
O=C(c1csc(COc2ccc(F)cc2)n1)N1CC(C2CCCCC2)C1	ZINC000819005980	FJ	On-Demand	Anodyne	ALOX5	15	41
O=C(NCCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819005987	FI	On-Demand	Anodyne	ACE	28	49
O=C(NCCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819005987	FI	On-Demand	Anodyne	KLK3	50	34
O=C(NCCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819005987	FI	On-Demand	Anodyne	CTSB	45	42
O=C(NCCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819005987	FI	On-Demand	Anodyne	CYSP_TRYCR	43	41
O=C(NCCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819005987	FI	On-Demand	Anodyne	CTSK	33	42
O=C(NCCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819005987	FI	On-Demand	Anodyne	CTSL	42	42
O=C(NCCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819005987	FI	On-Demand	Anodyne	PREP	66	58
O=C(NCCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819005987	FI	On-Demand	Anodyne	CAPNS1	52	32
O=C(NCCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819005987	FI	On-Demand	Anodyne	CAPN1	58	40
O=C(NCCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819005987	FI	On-Demand	Anodyne	CAPN2	102	40
O=C(NCCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819005987	FI	On-Demand	Anodyne	TGM2	41	47
O=C(NCCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819005987	FI	On-Demand	Anodyne	KLK5	39	41
O=C(NCCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819005987	FI	On-Demand	Anodyne	NPR	64	40
O=C(NCCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819005987	FI	On-Demand	Anodyne	F13A1	25	40
O=C(NCCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819005987	FI	On-Demand	Anodyne	SLC12A5	52	36
O=C(NCCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819005987	FI	On-Demand	Anodyne	TMPRSS11D	22	40
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006002	FH	On-Demand	Anodyne	ACE	27	40
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006002	FH	On-Demand	Anodyne	CPT1A	29	42
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006002	FH	On-Demand	Anodyne	CPT2	48	40
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006002	FH	On-Demand	Anodyne	PREP	140	71
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006002	FH	On-Demand	Anodyne	SFRP1	51	45
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006002	FH	On-Demand	Anodyne	WNT3	58	45
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006002	FH	On-Demand	Anodyne	L3MBTL3	66	41
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006003	FH	On-Demand	Anodyne	ACE	27	40
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006003	FH	On-Demand	Anodyne	CPT1A	29	42
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006003	FH	On-Demand	Anodyne	CPT2	48	40
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006003	FH	On-Demand	Anodyne	PREP	140	71
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006003	FH	On-Demand	Anodyne	SFRP1	51	45
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006003	FH	On-Demand	Anodyne	WNT3	58	45
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006003	FH	On-Demand	Anodyne	L3MBTL3	66	41
COC(=O)N[C@@H](CC(C)C)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006015	DF	On-Demand	Anodyne	CTSK	16	44
COC(=O)N[C@@H](CC(C)C)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006015	DF	On-Demand	Anodyne	CAPN1	23	42
COC(=O)N[C@H](CC(C)C)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006016	DF	On-Demand	Anodyne	CTSK	16	44
COC(=O)N[C@H](CC(C)C)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006016	DF	On-Demand	Anodyne	CAPN1	23	42
O=C([C@@H](O)c1cccc(C(F)(F)F)c1)N1CC(C2CCCCC2)C1	ZINC000819006017	EH	On-Demand	Anodyne	CACNA1B	41	39
O=C([C@@H](O)c1cccc(C(F)(F)F)c1)N1CC(C2CCCCC2)C1	ZINC000819006017	EH	On-Demand	Anodyne	LIPG	45	34
O=C([C@H](O)c1cccc(C(F)(F)F)c1)N1CC(C2CCCCC2)C1	ZINC000819006018	EH	On-Demand	Anodyne	CACNA1B	41	39
O=C([C@H](O)c1cccc(C(F)(F)F)c1)N1CC(C2CCCCC2)C1	ZINC000819006018	EH	On-Demand	Anodyne	LIPG	45	34
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006021	DI	On-Demand	Anodyne	MC4R	32	40
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006021	DI	On-Demand	Anodyne	DPP4	15	44
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006021	DI	On-Demand	Anodyne	MC3R	23	40
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006021	DI	On-Demand	Anodyne	MC5R	28	40
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006025	EI	On-Demand	Bother	SLC27A4	43	35
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006026	EI	On-Demand	Bother	SLC27A4	43	35
C#CCNS(=O)(=O)c1ccc(C(=O)N2CC(C3CCCCC3)C2)cc1	ZINC000819006041	FE	On-Demand	Mild	L3MBTL3	54	42
O=C(c1cc(Cl)c(Cl)[nH]1)N1CC(C2CCCCC2)C1	ZINC000819006048	DH	On-Demand	Anodyne	HRH4	19	44
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006051	FE	On-Demand	Anodyne	CTSK	19	45
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccccc1N(C)C(=O)c1cccs1	ZINC000819006061	FG	On-Demand	Anodyne	HCN1	62	34
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccccc1N(C)C(=O)c1cccs1	ZINC000819006061	FG	On-Demand	Anodyne	HCN4	51	34
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccccc1N(C)C(=O)c1cccs1	ZINC000819006062	FG	On-Demand	Anodyne	HCN1	62	34
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccccc1N(C)C(=O)c1cccs1	ZINC000819006062	FG	On-Demand	Anodyne	HCN4	51	34
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccccc1N(C)C(=O)c1cccs1	ZINC000819006063	FG	On-Demand	Anodyne	HCN1	62	34
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccccc1N(C)C(=O)c1cccs1	ZINC000819006063	FG	On-Demand	Anodyne	HCN4	51	34
O=C(Cn1cccc(C(F)(F)F)c1=O)N1CC(C2CCCCC2)C1	ZINC000819006084	EF	On-Demand	Anodyne	RBP4	58	35
C[C@@H](CC(=O)N1CC(C2CCCCC2)C1)NC(=O)OC(C)(C)C	ZINC000819006088	DG	On-Demand	Anodyne	CTSD	16	41
C[C@@H](CC(=O)N1CC(C2CCCCC2)C1)NC(=O)OC(C)(C)C	ZINC000819006088	DG	On-Demand	Anodyne	CTSK	18	48
C[C@@H](CC(=O)N1CC(C2CCCCC2)C1)NC(=O)OC(C)(C)C	ZINC000819006088	DG	On-Demand	Anodyne	ECE1	32	41
C[C@@H](CC(=O)N1CC(C2CCCCC2)C1)NC(=O)OC(C)(C)C	ZINC000819006088	DG	On-Demand	Anodyne	REN	22	40
CCOC(=O)N[C@H](C(=O)N1CC(C2CCCCC2)C1)C(C)C	ZINC000819006092	DF	On-Demand	Anodyne	ELANE	23	40
CCOC(=O)N[C@H](C(=O)N1CC(C2CCCCC2)C1)C(C)C	ZINC000819006092	DF	On-Demand	Anodyne	HLA-DRB1	31	42
CCOC(=O)N[C@@H](C(=O)N1CC(C2CCCCC2)C1)C(C)C	ZINC000819006093	DF	On-Demand	Anodyne	ELANE	23	40
CCOC(=O)N[C@@H](C(=O)N1CC(C2CCCCC2)C1)C(C)C	ZINC000819006093	DF	On-Demand	Anodyne	HLA-DRB1	31	42
O=C(c1ccc(C2SCCS2)cc1)N1CC(C2CCCCC2)C1	ZINC000819006095	EJ	On-Demand	Anodyne	L3MBTL3	61	47
O=C(c1cc(-c2cccnc2)nc2ccccc12)N1CC(C2CCCCC2)C1	ZINC000819006103	FJ	On-Demand	Anodyne	PRS	15	40
O=C(c1cc(-c2cccnc2)nc2ccccc12)N1CC(C2CCCCC2)C1	ZINC000819006103	FJ	On-Demand	Anodyne	TACR3	18	40
CN(CC(=O)N1CC(C2CCCCC2)C1)C1=NS(=O)(=O)c2ccccc21	ZINC000819006137	GE	On-Demand	Anodyne	KCNA3	34	40
COc1ccc2c(C)c(CCC(=O)N3CC(C4CCCCC4)C3)c(=O)oc2c1	ZINC000819006138	GI	On-Demand	Anodyne	MAOB	35	46
COc1ccc2c(C)c(CCC(=O)N3CC(C4CCCCC4)C3)c(=O)oc2c1	ZINC000819006138	GI	On-Demand	Anodyne	NQO1	30	45
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006145	DG	On-Demand	Anodyne	CTSD	16	42
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006145	DG	On-Demand	Anodyne	CTSK	21	47
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006145	DG	On-Demand	Anodyne	ECE1	30	42
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006145	DG	On-Demand	Anodyne	REN	37	42
O=C(N[C@]1(C(=O)N2CC(C3CCCCC3)C2)CCOC1)OCc1ccccc1	ZINC000819006147	GG	On-Demand	Anodyne	CTSB	18	40
O=C(N[C@]1(C(=O)N2CC(C3CCCCC3)C2)CCOC1)OCc1ccccc1	ZINC000819006147	GG	On-Demand	Anodyne	CTSK	24	45
O=C(N[C@]1(C(=O)N2CC(C3CCCCC3)C2)CCOC1)OCc1ccccc1	ZINC000819006147	GG	On-Demand	Anodyne	CTSL	28	40
O=C(N[C@]1(C(=O)N2CC(C3CCCCC3)C2)CCOC1)OCc1ccccc1	ZINC000819006147	GG	On-Demand	Anodyne	CAPNS1	42	32
O=C(N[C@]1(C(=O)N2CC(C3CCCCC3)C2)CCOC1)OCc1ccccc1	ZINC000819006147	GG	On-Demand	Anodyne	CAPN2	52	35
O=C(N[C@]1(C(=O)N2CC(C3CCCCC3)C2)CCOC1)OCc1ccccc1	ZINC000819006147	GG	On-Demand	Anodyne	SLC12A5	63	37
O=C(N[C@@]1(C(=O)N2CC(C3CCCCC3)C2)CCOC1)OCc1ccccc1	ZINC000819006148	GG	On-Demand	Anodyne	CTSB	18	40
O=C(N[C@@]1(C(=O)N2CC(C3CCCCC3)C2)CCOC1)OCc1ccccc1	ZINC000819006148	GG	On-Demand	Anodyne	CTSK	24	45
O=C(N[C@@]1(C(=O)N2CC(C3CCCCC3)C2)CCOC1)OCc1ccccc1	ZINC000819006148	GG	On-Demand	Anodyne	CTSL	28	40
O=C(N[C@@]1(C(=O)N2CC(C3CCCCC3)C2)CCOC1)OCc1ccccc1	ZINC000819006148	GG	On-Demand	Anodyne	CAPNS1	42	32
O=C(N[C@@]1(C(=O)N2CC(C3CCCCC3)C2)CCOC1)OCc1ccccc1	ZINC000819006148	GG	On-Demand	Anodyne	CAPN2	52	35
O=C(N[C@@]1(C(=O)N2CC(C3CCCCC3)C2)CCOC1)OCc1ccccc1	ZINC000819006148	GG	On-Demand	Anodyne	SLC12A5	63	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	F2	29	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	PLG	25	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	ACE	56	54
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	GHRHR	57	32
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	P2RY12	102	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	ELANE	23	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	TACR1	15	49
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	CTRA_BOVIN	66	36
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	CASP3	17	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	KLK3	94	50
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	CTSB	72	49
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	PAPA1_CARPA	79	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	TRY1_BOVIN	43	36
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	CYSP_TRYCR	62	48
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	CTSG	46	36
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	CTSK	53	53
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	CTSL	54	53
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	NPFFR2	42	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	PREP	43	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	AMY2	42	29
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	CAPNS1	70	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	CELA2A	55	36
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	REN	44	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	LGMN	71	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	MMP11	59	32
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	TGM1	26	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	CTSS	34	49
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	CAPN1	93	53
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	CASP1	26	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	CAPN2	147	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	PLAU	17	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	TGM2	43	52
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	KLK5	40	35
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	TPSAB1	40	36
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	NPR	70	34
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	PSMB5	39	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	SLC12A5	40	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006151	HF	On-Demand	Anodyne	Q9NAW4_PLAFA	36	41
O=C(c1cc(OCc2ccccc2)ccn1)N1CC(C2CCCCC2)C1	ZINC000819006158	FI	On-Demand	Anodyne	FAAH	17	41
O=C(Nc1cc2ccccc2cc1C(=O)N1CC(C2CCCCC2)C1)C1CC1	ZINC000819006175	GJ	On-Demand	Anodyne	NMT1	25	41
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)OC(C)(C)C	ZINC000819006177	EG	On-Demand	Anodyne	KCNA3	47	39
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)OC(C)(C)C	ZINC000819006177	EG	On-Demand	Anodyne	HCN1	63	33
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)OC(C)(C)C	ZINC000819006177	EG	On-Demand	Anodyne	HCN4	51	33
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccccc1NC(=O)OC(C)(C)C	ZINC000819006178	EG	On-Demand	Anodyne	KCNA3	47	39
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccccc1NC(=O)OC(C)(C)C	ZINC000819006178	EG	On-Demand	Anodyne	HCN1	63	33
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccccc1NC(=O)OC(C)(C)C	ZINC000819006178	EG	On-Demand	Anodyne	HCN4	51	33
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)OC(C)(C)C	ZINC000819006179	EG	On-Demand	Anodyne	KCNA3	47	39
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)OC(C)(C)C	ZINC000819006179	EG	On-Demand	Anodyne	HCN1	63	33
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccccc1NC(=O)OC(C)(C)C	ZINC000819006179	EG	On-Demand	Anodyne	HCN4	51	33
CC(C)(C)OC(=O)N1CC(CC(=O)N2CC(C3CCCCC3)C2)C1	ZINC000819006191	EG	On-Demand	Anodyne	GPR119	20	40
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006197	FH	On-Demand	Anodyne	FPR1	20	42
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006198	FH	On-Demand	Anodyne	FPR1	20	42
O=C(CN1C(=O)COc2ccc(Cl)cc21)N1CC(C2CCCCC2)C1	ZINC000819006200	FG	On-Demand	Anodyne	UTS2R	18	43
CC(C)(C)OC(=O)N1CCC(=CC(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819006207	FH	On-Demand	Anodyne	GPR119	27	42
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1CC(C2CCCCC2)C1	ZINC000819006208	GG	On-Demand	Anodyne	CCR8	57	36
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1CC(C2CCCCC2)C1	ZINC000819006208	GG	On-Demand	Anodyne	SFRP1	67	33
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl)N1CC(C2CCCCC2)C1	ZINC000819006220	HI	On-Demand	Anodyne	EPHX2	21	41
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl)N1CC(C2CCCCC2)C1	ZINC000819006220	HI	On-Demand	Anodyne	TGM2	24	41
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl)N1CC(C2CCCCC2)C1	ZINC000819006220	HI	On-Demand	Anodyne	F13A1	28	41
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl)N1CC(C2CCCCC2)C1	ZINC000819006220	HI	On-Demand	Anodyne	AKR1C3	27	42
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl)N1CC(C2CCCCC2)C1	ZINC000819006220	HI	On-Demand	Anodyne	L3MBTL3	39	42
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006221	EH	On-Demand	Anodyne	PAPA1_CARPA	26	46
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006221	EH	On-Demand	Anodyne	CTSK	25	46
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006221	EH	On-Demand	Anodyne	REN	34	41
N#Cc1cccc(OCC(=O)N2CC(C3CCCCC3)C2)c1	ZINC000819006232	CF	On-Demand	Mild	CPT1A	114	48
N#Cc1cccc(OCC(=O)N2CC(C3CCCCC3)C2)c1	ZINC000819006232	CF	On-Demand	Mild	CPT2	48	40
N#Cc1cccc(OCC(=O)N2CC(C3CCCCC3)C2)c1	ZINC000819006232	CF	On-Demand	Mild	CHRNA10	51	47
CN(C)S(=O)(=O)c1cc(C(=O)N2CC(C3CCCCC3)C2)ccc1Br	ZINC000819006310	IG	On-Demand	Anodyne	L3MBTL3	46	38
O=C(c1cc(S(=O)(=O)NC2CC2)ccc1Br)N1CC(C2CCCCC2)C1	ZINC000819006313	IH	On-Demand	Anodyne	SFRP1	69	34
CN(CC(=O)N1CC(C2CCCCC2)C1)C(=O)OCc1ccccc1	ZINC000819006314	EG	On-Demand	Anodyne	CTSK	19	43
CN(CC(=O)N1CC(C2CCCCC2)C1)C(=O)OCc1ccccc1	ZINC000819006314	EG	On-Demand	Anodyne	CCR5	34	42
CN(CC(=O)N1CC(C2CCCCC2)C1)C(=O)OCc1ccccc1	ZINC000819006314	EG	On-Demand	Anodyne	PREP	45	39
CN(CC(=O)N1CC(C2CCCCC2)C1)C(=O)OCc1ccccc1	ZINC000819006314	EG	On-Demand	Anodyne	AMY2	49	35
CN(CC(=O)N1CC(C2CCCCC2)C1)C(=O)OCc1ccccc1	ZINC000819006314	EG	On-Demand	Anodyne	SLC12A5	78	40
O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006324	GF	On-Demand	Anodyne	ACE	20	44
O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006324	GF	On-Demand	Anodyne	CELA1	20	47
O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006324	GF	On-Demand	Anodyne	PREP	76	55
O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006324	GF	On-Demand	Anodyne	LGMN	57	39
O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006324	GF	On-Demand	Anodyne	TGM2	23	40
O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006324	GF	On-Demand	Anodyne	KLK5	23	42
O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006324	GF	On-Demand	Anodyne	F13A1	27	40
O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006324	GF	On-Demand	Anodyne	SLC12A5	63	38
O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006324	GF	On-Demand	Anodyne	Q9NAW4_PLAFA	44	52
O=C(c1cccc(C2OCCO2)c1)N1CC(C2CCCCC2)C1	ZINC000819006329	DG	On-Demand	Anodyne	L3MBTL3	70	45
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CC(C2CCCCC2)C1	ZINC000819006336	DG	On-Demand	Anodyne	PREP	19	60
O=C(c1ccc(S(F)(F)(F)(F)F)cc1)N1CC(C2CCCCC2)C1	ZINC000819006338	FK	On-Demand	Reactive	L3MBTL3	67	50
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC(C3CCCCC3)C2)C1	ZINC000819006342	EG	On-Demand	Anodyne	GPR119	31	43
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC(C3CCCCC3)C2)C1	ZINC000819006343	EG	On-Demand	Anodyne	GPR119	31	43
COC(=O)N[C@@H](C(=O)N1CC(C2CCCCC2)C1)C(C)C	ZINC000819006348	CE	On-Demand	Anodyne	ELANE	15	44
NS(=O)(=O)c1cc(C(=O)N2CC(C3CCCCC3)C2)ccc1F	ZINC000819006349	EE	On-Demand	Anodyne	L3MBTL3	44	39
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)N3CC(C4CCCCC4)C3)nn2)CC1	ZINC000819006357	HH	On-Demand	Anodyne	GPR119	43	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	PLG	24	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	ACE	101	51
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	GHRHR	44	31
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CELA1	40	51
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	ELANE	44	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	MME	57	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	TACR1	17	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CTSD	27	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CMA1	23	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CTRA_BOVIN	64	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CASP3	18	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	KLK3	94	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CTSB	80	49
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	PAPA1_CARPA	82	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	TRY1_BOVIN	43	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CYSP_TRYCR	63	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CTSG	44	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CTSK	68	53
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CTSL	60	53
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CCR1	15	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CCR5	19	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	PGA	25	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	PREP	39	59
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	AMY2	44	30
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CAPNS1	86	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	MMP3	20	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	HLA-DRB1	46	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CELA2A	53	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	REN	82	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	MMP11	44	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CTSS	42	53
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CAPN1	106	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CASP1	30	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CTRC	17	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CAPN2	156	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	ACE2	44	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	PLAU	20	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	CASP9	30	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	TGM2	41	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	DPP7	45	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	KLK5	41	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	TPSAB1	24	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	FPR1	42	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	NPR	86	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	XIAP	50	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	PSMB5	50	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	BIRC2	44	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	BIRC8	41	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	Q6PRC7_IXORI	48	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	SLC12A5	69	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819006358	EG	On-Demand	Anodyne	Q9NAW4_PLAFA	35	41
O=C(c1ccc(-n2ccnc2S)cc1)N1CC(C2CCCCC2)C1	ZINC000819006362	EH	On-Demand	Anodyne	L3MBTL3	54	41
O=C(c1ccc(SC(F)F)cc1)N1CC(C2CCCCC2)C1	ZINC000819006363	EJ	On-Demand	Anodyne	L3MBTL3	53	46
C[C@@H]1CCC[C@]1(O)CNC(=O)c1ccc(N2CCOCC2)nc1	ZINC000819006369	DD	On-Demand	Anodyne	HPGDS	25	49
C[C@H]1CCC[C@]1(O)CNC(=O)c1ccc(N2CCOCC2)nc1	ZINC000819006370	DD	On-Demand	Anodyne	HPGDS	25	49
C[C@H]1CCC[C@@]1(O)CNC(=O)c1ccc(N2CCOCC2)nc1	ZINC000819006371	DD	On-Demand	Anodyne	HPGDS	25	49
CC(C)(C)OC(=O)N1CCC(CCC(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819006385	GI	On-Demand	Anodyne	GPR119	31	43
O=C(c1cc([N+](=O)[O-])ccc1N1CCOCC1)N1CC(C2CCCCC2)C1	ZINC000819006392	FG	On-Demand	Bother	SLC6A9	23	60
O=C(/C=C/c1ccc2ccccc2n1)N1CC(C2CCCCC2)C1	ZINC000819006416	DI	On-Demand	Anodyne	ALOX5	18	42
O=C(/C=C\c1ccc2ccccc2n1)N1CC(C2CCCCC2)C1	ZINC000819006417	DI	On-Demand	Anodyne	ALOX5	18	42
O=C(OCc1ccccc1)N1CCC(C(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819006420	GI	On-Demand	Anodyne	CELA1	19	45
O=C(OCc1ccccc1)N1CCC(C(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819006420	GI	On-Demand	Anodyne	GRIN2B	38	50
O=C(OCc1ccccc1)N1CCC(C(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819006420	GI	On-Demand	Anodyne	CCR5	26	47
O=C(OCc1ccccc1)N1CCC(C(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819006420	GI	On-Demand	Anodyne	PREP	70	53
O=C(OCc1ccccc1)N1CCC(C(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819006420	GI	On-Demand	Anodyne	TGM2	46	47
O=C(OCc1ccccc1)N1CCC(C(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819006420	GI	On-Demand	Anodyne	DPP7	45	38
O=C(OCc1ccccc1)N1CCC(C(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819006420	GI	On-Demand	Anodyne	KLK5	22	40
O=C(OCc1ccccc1)N1CCC(C(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819006420	GI	On-Demand	Anodyne	F13A1	55	47
O=C(OCc1ccccc1)N1CCC(C(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819006420	GI	On-Demand	Anodyne	SLC12A5	74	44
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CC(C3CCCCC3)C2)C1	ZINC000819006436	FH	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CC(C3CCCCC3)C2)C1	ZINC000819006437	FH	On-Demand	Anodyne	GPR119	29	40
CCCCSCC(=O)N1CC(C2CCCCC2)C1	ZINC000819006440	CH	On-Demand	Anodyne	CES1	16	40
CCCCSCC(=O)N1CC(C2CCCCC2)C1	ZINC000819006440	CH	On-Demand	Anodyne	EST1_PIG	46	40
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CC(C2CCCCC2)C1	ZINC000819006441	HI	On-Demand	Anodyne	CNR1	15	53
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CC(C2CCCCC2)C1	ZINC000819006441	HI	On-Demand	Anodyne	CNR2	21	84
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CC(C2CCCCC2)C1	ZINC000819006441	HI	On-Demand	Anodyne	EPHX2	31	43
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CC(C2CCCCC2)C1	ZINC000819006441	HI	On-Demand	Anodyne	L3MBTL3	78	45
COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CC(C4CCCCC4)C3)CC2)cc1	ZINC000819006445	HF	On-Demand	Clean	SSTR1	41	35
COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CC(C4CCCCC4)C3)CC2)cc1	ZINC000819006446	HF	On-Demand	Clean	SSTR1	41	35
O=C(c1cc(-c2ccncc2)nc2ccccc12)N1CC(C2CCCCC2)C1	ZINC000819006449	FJ	On-Demand	Anodyne	PRS	32	44
O=C(c1cc(-c2ccncc2)nc2ccccc12)N1CC(C2CCCCC2)C1	ZINC000819006449	FJ	On-Demand	Anodyne	TACR3	17	41
O=C(c1cc(-c2ccncc2)nc2ccccc12)N1CC(C2CCCCC2)C1	ZINC000819006449	FJ	On-Demand	Anodyne	MT-CO2	47	41
O=C(c1ccc(-n2cccc2)nc1)N1CC(C2CCCCC2)C1	ZINC000819006468	DH	On-Demand	Anodyne	L3MBTL3	34	40
O=C([C@@H](O)c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006470	CF	On-Demand	Anodyne	CCR5	15	44
O=C([C@H](O)c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819006471	CF	On-Demand	Anodyne	CCR5	15	44
O=C(/C=C\[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819006485	GD	On-Demand	Bother	TGM2	42	38
O=C(/C=C\[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819006485	GD	On-Demand	Bother	F13A1	45	38
O=C(/C=C\[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819006486	GD	On-Demand	Bother	TGM2	42	38
O=C(/C=C\[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819006486	GD	On-Demand	Bother	F13A1	45	38
O=C(/C=C/[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819006487	GD	On-Demand	Bother	TGM2	42	38
O=C(/C=C/[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819006487	GD	On-Demand	Bother	F13A1	45	38
O=C(/C=C/[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819006488	GD	On-Demand	Bother	TGM2	42	38
O=C(/C=C/[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819006488	GD	On-Demand	Bother	F13A1	45	38
O=C(C(F)=C1CCC1)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819006489	GD	On-Demand	Bother	TGM2	43	37
O=C(C(F)=C1CCC1)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819006489	GD	On-Demand	Bother	F13A1	53	37
O=C(C(F)=C1CCC1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819006490	FE	On-Demand	Anodyne	PKM	33	44
O=C(C(F)=C1CCC1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819006490	FE	On-Demand	Anodyne	TGM2	67	42
O=C(C(F)=C1CCC1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819006490	FE	On-Demand	Anodyne	F13A1	70	42
CCC[C@@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1CCc2sccc2C1	ZINC000819006493	GH	On-Demand	Anodyne	ADRB1	28	40
CCC[C@@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1CCc2sccc2C1	ZINC000819006493	GH	On-Demand	Anodyne	ADRB3	42	40
CCC[C@@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1CCc2sccc2C1	ZINC000819006493	GH	On-Demand	Anodyne	CYP3A4	43	32
CCC[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C(=O)N1CCc2sccc2C1	ZINC000819006494	GH	On-Demand	Anodyne	ADRB1	28	40
CCC[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C(=O)N1CCc2sccc2C1	ZINC000819006494	GH	On-Demand	Anodyne	ADRB3	42	40
CCC[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C(=O)N1CCc2sccc2C1	ZINC000819006494	GH	On-Demand	Anodyne	CYP3A4	43	32
CCC[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1CCc2sccc2C1	ZINC000819006495	GH	On-Demand	Anodyne	ADRB1	28	40
CCC[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1CCc2sccc2C1	ZINC000819006495	GH	On-Demand	Anodyne	ADRB3	42	40
CCC[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1CCc2sccc2C1	ZINC000819006495	GH	On-Demand	Anodyne	CYP3A4	43	32
CCC[C@H](NC[C@@H](O)c1cccc(Cl)c1)C(=O)N1CCc2sccc2C1	ZINC000819006496	GH	On-Demand	Anodyne	ADRB1	28	40
CCC[C@H](NC[C@@H](O)c1cccc(Cl)c1)C(=O)N1CCc2sccc2C1	ZINC000819006496	GH	On-Demand	Anodyne	ADRB3	42	40
CCC[C@H](NC[C@@H](O)c1cccc(Cl)c1)C(=O)N1CCc2sccc2C1	ZINC000819006496	GH	On-Demand	Anodyne	CYP3A4	43	32
COC[C@@H](NC[C@](C)(O)c1ccc(Br)cc1F)c1ccccc1	ZINC000819006509	GH	On-Demand	Anodyne	MAN1B1	46	33
COC[C@@H](NC[C@@](C)(O)c1ccc(Br)cc1F)c1ccccc1	ZINC000819006510	GH	On-Demand	Anodyne	MAN1B1	46	33
COC[C@H](NC[C@](C)(O)c1ccc(Br)cc1F)c1ccccc1	ZINC000819006511	GH	On-Demand	Anodyne	MAN1B1	46	33
COC[C@H](NC[C@@](C)(O)c1ccc(Br)cc1F)c1ccccc1	ZINC000819006512	GH	On-Demand	Anodyne	MAN1B1	46	33
O[C@@H](CNCCCc1nc2c(s1)CCCC2)c1ccccc1	ZINC000819006531	DG	On-Demand	Anodyne	ADRB2	27	43
O[C@@H](CNCCCc1nc2c(s1)CCCC2)c1ccccc1	ZINC000819006531	DG	On-Demand	Anodyne	ADRB3	67	39
O[C@H](CNCCCc1nc2c(s1)CCCC2)c1ccccc1	ZINC000819006532	DG	On-Demand	Anodyne	ADRB2	27	43
O[C@H](CNCCCc1nc2c(s1)CCCC2)c1ccccc1	ZINC000819006532	DG	On-Demand	Anodyne	ADRB3	67	39
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	ACE	51	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	OPRM1	46	45
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	OPRD1	38	45
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	GHRHR	47	31
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	MME	56	42
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	CMA1	47	41
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	CTRA_BOVIN	51	32
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	TRY1_BOVIN	55	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	CYSP_TRYCR	46	35
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	CTSG	41	32
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	NPFFR2	55	33
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	TIMP3	78	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	MC3R	19	42
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	CAPNS1	69	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	CELA2A	58	32
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	CAPN1	52	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	CTRC	28	41
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	ACE2	56	32
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	MMP1	16	42
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	FPR1	40	32
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	CTRB_BOVIN	46	34
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006556	FD	On-Demand	Anodyne	BRCA1	51	31
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	ACE	51	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	OPRM1	46	45
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	OPRD1	38	45
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	GHRHR	47	31
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	MME	56	42
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	CMA1	47	41
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	CTRA_BOVIN	51	32
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	TRY1_BOVIN	55	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	CYSP_TRYCR	46	35
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	CTSG	41	32
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	NPFFR2	55	33
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	TIMP3	78	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	MC3R	19	42
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	CAPNS1	69	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	CELA2A	58	32
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	CAPN1	52	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	CTRC	28	41
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	ACE2	56	32
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	MMP1	16	42
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	FPR1	40	32
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	CTRB_BOVIN	46	34
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819006557	FD	On-Demand	Anodyne	BRCA1	51	31
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819006558	ED	On-Demand	Anodyne	ADRB2	53	37
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819006558	ED	On-Demand	Anodyne	ADRB1	25	46
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819006558	ED	On-Demand	Anodyne	ADRB3	30	40
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819006559	ED	On-Demand	Anodyne	ADRB2	53	37
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819006559	ED	On-Demand	Anodyne	ADRB1	25	46
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819006559	ED	On-Demand	Anodyne	ADRB3	30	40
Cc1ccccc1[C@@H](O)CNCc1cccc(CS(N)(=O)=O)c1	ZINC000819006571	ED	On-Demand	Anodyne	ADRB2	43	37
Cc1ccccc1[C@@H](O)CNCc1cccc(CS(N)(=O)=O)c1	ZINC000819006571	ED	On-Demand	Anodyne	ADRB1	20	43
O[C@@H](CNCCCc1nc2c(s1)CCCC2)c1cccc(Br)c1	ZINC000819006575	GI	On-Demand	Anodyne	ADRB3	40	35
O[C@H](CNCCCc1nc2c(s1)CCCC2)c1cccc(Br)c1	ZINC000819006576	GI	On-Demand	Anodyne	ADRB3	40	35
O=C(/C=C\[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819006617	FD	On-Demand	Anodyne	PKM	34	44
O=C(/C=C\[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819006617	FD	On-Demand	Anodyne	TGM2	63	40
O=C(/C=C\[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819006617	FD	On-Demand	Anodyne	F13A1	62	40
O=C(/C=C\[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819006618	FD	On-Demand	Anodyne	PKM	34	44
O=C(/C=C\[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819006618	FD	On-Demand	Anodyne	TGM2	63	40
O=C(/C=C\[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819006618	FD	On-Demand	Anodyne	F13A1	62	40
O=C(/C=C/[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819006619	FD	On-Demand	Anodyne	PKM	34	44
O=C(/C=C/[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819006619	FD	On-Demand	Anodyne	TGM2	63	40
O=C(/C=C/[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819006619	FD	On-Demand	Anodyne	F13A1	62	40
O=C(/C=C/[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819006620	FD	On-Demand	Anodyne	PKM	34	44
O=C(/C=C/[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819006620	FD	On-Demand	Anodyne	TGM2	63	40
O=C(/C=C/[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819006620	FD	On-Demand	Anodyne	F13A1	62	40
O=C(/C=C\[C@H]1CCCO1)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819006631	GD	On-Demand	Bother	AKR1C3	41	42
O=C(/C=C/[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819006632	GD	On-Demand	Bother	AKR1C3	41	42
O=C(/C=C/[C@H]1CCCO1)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819006633	GD	On-Demand	Bother	AKR1C3	41	42
O=C(/C=C\[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819006634	GD	On-Demand	Bother	AKR1C3	41	42
O=C(C(F)=C1CCC1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819006639	ED	On-Demand	Anodyne	PKM	31	40
O=C(C(F)=C1CCC1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819006639	ED	On-Demand	Anodyne	TGM2	60	38
O=C(C(F)=C1CCC1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819006639	ED	On-Demand	Anodyne	F13A1	77	38
O=C(C(F)=C1CCC1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819006639	ED	On-Demand	Anodyne	AKR1C3	56	39
O=C(/C=C\[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819006640	GD	On-Demand	Anodyne	APP	43	36
O=C(/C=C\[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819006640	GD	On-Demand	Anodyne	PKM	26	44
O=C(/C=C\[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819006640	GD	On-Demand	Anodyne	TGM2	60	40
O=C(/C=C\[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819006640	GD	On-Demand	Anodyne	F13A1	58	40
O=C(/C=C\[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819006641	GD	On-Demand	Anodyne	APP	43	36
O=C(/C=C\[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819006641	GD	On-Demand	Anodyne	PKM	26	44
O=C(/C=C\[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819006641	GD	On-Demand	Anodyne	TGM2	60	40
O=C(/C=C\[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819006641	GD	On-Demand	Anodyne	F13A1	58	40
O=C(/C=C/[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819006642	GD	On-Demand	Anodyne	APP	43	36
O=C(/C=C/[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819006642	GD	On-Demand	Anodyne	PKM	26	44
O=C(/C=C/[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819006642	GD	On-Demand	Anodyne	TGM2	60	40
O=C(/C=C/[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819006642	GD	On-Demand	Anodyne	F13A1	58	40
O=C(/C=C/[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819006643	GD	On-Demand	Anodyne	APP	43	36
O=C(/C=C/[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819006643	GD	On-Demand	Anodyne	PKM	26	44
O=C(/C=C/[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819006643	GD	On-Demand	Anodyne	TGM2	60	40
O=C(/C=C/[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819006643	GD	On-Demand	Anodyne	F13A1	58	40
C=C(Cl)CSc1nc(C)c(CC(=O)NCc2cccc(OC)c2)s1	ZINC000819006660	GI	On-Demand	Mild	MMP13	29	41
C=C(Cl)CSc1nc(C)c(CC(=O)NCc2cccc(OC)c2)s1	ZINC000819006660	GI	On-Demand	Mild	CSNK1D	15	41
C=C(Cl)CSc1nc(C)c(CC(=O)NCc2cccc(OC)c2)s1	ZINC000819006660	GI	On-Demand	Mild	ROCK1	30	43
C=C(Cl)CSc1nc(C)c(CC(=O)NCc2cccc(OC)c2)s1	ZINC000819006660	GI	On-Demand	Mild	ROCK2	31	43
C=C(Cl)CSc1nc(C)c(CC(=O)NCc2cccc(OC)c2)s1	ZINC000819006660	GI	On-Demand	Mild	SCD1	21	41
C=C(Cl)CSc1nc(C)c(CC(=O)NCc2cccc(OC)c2)s1	ZINC000819006660	GI	On-Demand	Mild	SCD	23	41
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819006661	GE	On-Demand	Anodyne	ADRB1	21	44
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819006662	GE	On-Demand	Anodyne	ADRB1	21	44
CC(C)n1nccc1NC(=O)[C@@H](C)OC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819006673	GG	On-Demand	Bother	GSTM2	57	35
CC(C)n1nccc1NC(=O)[C@@H](C)OC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819006673	GG	On-Demand	Bother	COLA	92	37
CC(C)n1nccc1NC(=O)[C@H](C)OC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819006674	GG	On-Demand	Bother	GSTM2	57	35
CC(C)n1nccc1NC(=O)[C@H](C)OC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819006674	GG	On-Demand	Bother	COLA	92	37
COC[C@@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819006710	GF	On-Demand	Anodyne	GPR119	44	48
COC[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819006711	GF	On-Demand	Anodyne	GPR119	44	48
COC[C@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819006712	GF	On-Demand	Anodyne	GPR119	44	48
COC[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819006713	GF	On-Demand	Anodyne	GPR119	44	48
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	ACE	57	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	OPRM1	29	41
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	OPRD1	22	41
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	MME	123	50
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	ANPEP	61	35
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	TACR1	19	42
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	CTRA_BOVIN	22	42
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	FCER2	70	34
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	CTSB	62	42
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	PAPA1_CARPA	74	44
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	CYSP_TRYCR	56	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	CTSK	31	44
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	CTSL	59	44
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	PGA	22	41
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	NPFFR2	42	32
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	TIMP3	81	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	CAPNS1	73	47
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	MMP3	19	46
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	MMP8	15	40
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	HLA-DRB1	58	36
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	CTSS	29	44
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	CAPN1	98	42
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	MMP9	18	40
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	CAPN2	84	39
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	ACE2	78	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	MMP1	24	49
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	FPR1	65	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	CTRB_BOVIN	47	35
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	NPR	28	48
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	PSMB8	46	36
COC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819006721	CE	On-Demand	Anodyne	NPFFR1	54	31
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	ACE	21	48
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	SSTR2	33	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	OPRM1	15	45
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	GHRHR	27	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	MME	29	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	EDNRB	51	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	EDNRA	36	45
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	TACR1	37	51
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	MC4R	50	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	CCKAR	127	48
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	CTSL	24	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	BRS3	30	47
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	NMBR	74	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	MC3R	68	38
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	MC5R	70	38
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	MMP2	29	49
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	MMP8	37	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	MMP14	26	44
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	GRPR	103	38
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	ECE1	68	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	SSTR3	24	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	MMP11	97	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	CCKBR	102	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	GHSR	71	44
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	MMP9	28	48
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	MC1R	99	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	AKT1	40	39
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	MMP7	15	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	MMP1	23	44
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	NPR	30	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	SSSIM	26	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	KISS1R	76	36
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)C(F)=C1CCC1	ZINC000819006722	EF	On-Demand	Anodyne	ERAP2	44	38
COc1ccc(Nc2nc(COC(=O)CSc3ccccc3[N+](=O)[O-])cs2)cc1	ZINC000819006723	IJ	On-Demand	Bother	TRPC6	21	42
O=C(C(F)=C1CCC1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819006735	DF	On-Demand	Bother	SSTR1	43	42
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	F2	15	45
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	OPRM1	26	43
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	OPRD1	22	43
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	CELA1	24	43
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	MME	67	43
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	ANPEP	46	34
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	TACR1	21	48
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	CTSD	23	43
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	PGC	62	43
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	CMA1	40	45
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	CTRA_BOVIN	39	45
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	FCER2	40	31
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	CTSB	48	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	PAPA1_CARPA	82	54
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	CYSP_TRYCR	54	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	CCKAR	65	45
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	CTSK	40	50
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	CTSL	49	54
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	CACNA1B	34	41
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	PGA	38	43
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	TIMP3	78	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	TACR3	18	44
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	CAPNS1	63	41
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	HLA-DRB1	37	43
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	CELA2A	49	32
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	REN	89	49
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	REN1	28	44
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	CCKBR	25	40
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	CTSS	27	54
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	CAPN1	88	43
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	CAPN2	58	39
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	ACE2	46	34
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	KLK5	33	41
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	MMP1	18	44
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	FPR1	69	47
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	CTRB_BOVIN	52	48
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	NPR	20	43
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819006740	FD	On-Demand	Anodyne	Q9NAW4_PLAFA	34	42
CC(=O)Nc1cccc(CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1	ZINC000819006742	GE	On-Demand	Bother	HTR1D	21	41
CC(=O)Nc1cccc(CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1	ZINC000819006742	GE	On-Demand	Bother	SSTR1	59	49
CC(=O)Nc1cccc(CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1	ZINC000819006742	GE	On-Demand	Bother	WDR5	31	40
CC(=O)Nc1cccc(CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1	ZINC000819006742	GE	On-Demand	Bother	KCNJ1	24	43
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccccc2F)c1	ZINC000819006751	ED	On-Demand	Anodyne	ADRB2	29	42
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccccc2F)c1	ZINC000819006752	ED	On-Demand	Anodyne	ADRB2	29	42
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819006764	ED	On-Demand	Anodyne	ADRB2	43	36
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819006764	ED	On-Demand	Anodyne	ADRB1	28	46
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819006764	ED	On-Demand	Anodyne	ADRB3	40	39
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819006765	ED	On-Demand	Anodyne	ADRB2	43	36
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819006765	ED	On-Demand	Anodyne	ADRB1	28	46
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819006765	ED	On-Demand	Anodyne	ADRB3	40	39
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2nc3c(s2)CCCC3)c1	ZINC000819006781	FG	On-Demand	Bother	ADRB3	50	34
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2nc3c(s2)CCCC3)c1	ZINC000819006782	FG	On-Demand	Bother	ADRB3	50	34
O=C(c1cc2c(cn1)OCCO2)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819006823	FD	On-Demand	Bother	CCKAR	16	41
O=C(c1cc2c(cn1)OCCO2)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819006823	FD	On-Demand	Bother	SSTR1	44	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2nc3c(s2)CCCC3)cc1	ZINC000819006849	GF	On-Demand	Anodyne	ADRB2	20	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2nc3c(s2)CCCC3)cc1	ZINC000819006849	GF	On-Demand	Anodyne	ADRB3	62	37
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2nc3c(s2)CCCC3)cc1	ZINC000819006850	GF	On-Demand	Anodyne	ADRB2	20	42
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2nc3c(s2)CCCC3)cc1	ZINC000819006850	GF	On-Demand	Anodyne	ADRB3	62	37
O=C(/C=C\[C@H]1CCCO1)N1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1	ZINC000819006883	GD	On-Demand	Anodyne	AKR1C3	53	39
O=C(/C=C/[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1	ZINC000819006884	GD	On-Demand	Anodyne	AKR1C3	53	39
O=C(/C=C/[C@H]1CCCO1)N1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1	ZINC000819006885	GD	On-Demand	Anodyne	AKR1C3	53	39
O=C(/C=C\[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1	ZINC000819006886	GD	On-Demand	Anodyne	AKR1C3	53	39
C[C@@H](CNCc1cccc(C(=O)OCc2ccccc2)c1)S(C)(=O)=O	ZINC000819006897	FF	On-Demand	Anodyne	CTSB	46	38
C[C@@H](CNCc1cccc(C(=O)OCc2ccccc2)c1)S(C)(=O)=O	ZINC000819006897	FF	On-Demand	Anodyne	TRY2_BOVIN	80	35
C[C@@H](CNCc1cccc(C(=O)OCc2ccccc2)c1)S(C)(=O)=O	ZINC000819006897	FF	On-Demand	Anodyne	CAPNS1	60	31
C[C@@H](CNCc1cccc(C(=O)OCc2ccccc2)c1)S(C)(=O)=O	ZINC000819006897	FF	On-Demand	Anodyne	CAPN1	62	35
C[C@@H](CNCc1cccc(C(=O)OCc2ccccc2)c1)S(C)(=O)=O	ZINC000819006897	FF	On-Demand	Anodyne	CAPN2	86	35
C[C@@H](CNCc1cccc(C(=O)OCc2ccccc2)c1)S(C)(=O)=O	ZINC000819006897	FF	On-Demand	Anodyne	ADAMTS4	22	40
C[C@@H](CNCc1cccc(C(=O)OCc2ccccc2)c1)S(C)(=O)=O	ZINC000819006897	FF	On-Demand	Anodyne	NPR	47	33
C[C@H](CNCc1cccc(C(=O)OCc2ccccc2)c1)S(C)(=O)=O	ZINC000819006898	FF	On-Demand	Anodyne	CTSB	46	38
C[C@H](CNCc1cccc(C(=O)OCc2ccccc2)c1)S(C)(=O)=O	ZINC000819006898	FF	On-Demand	Anodyne	TRY2_BOVIN	80	35
C[C@H](CNCc1cccc(C(=O)OCc2ccccc2)c1)S(C)(=O)=O	ZINC000819006898	FF	On-Demand	Anodyne	CAPNS1	60	31
C[C@H](CNCc1cccc(C(=O)OCc2ccccc2)c1)S(C)(=O)=O	ZINC000819006898	FF	On-Demand	Anodyne	CAPN1	62	35
C[C@H](CNCc1cccc(C(=O)OCc2ccccc2)c1)S(C)(=O)=O	ZINC000819006898	FF	On-Demand	Anodyne	CAPN2	86	35
C[C@H](CNCc1cccc(C(=O)OCc2ccccc2)c1)S(C)(=O)=O	ZINC000819006898	FF	On-Demand	Anodyne	ADAMTS4	22	40
C[C@H](CNCc1cccc(C(=O)OCc2ccccc2)c1)S(C)(=O)=O	ZINC000819006898	FF	On-Demand	Anodyne	NPR	47	33
O=C(C(F)=C1CCC1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819006929	FF	On-Demand	Anodyne	PKM	32	43
O=C(C(F)=C1CCC1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819006929	FF	On-Demand	Anodyne	TGM2	57	39
O=C(C(F)=C1CCC1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819006929	FF	On-Demand	Anodyne	F13A1	63	39
C=CCC1(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCOCC1	ZINC000819006944	FF	On-Demand	Mild	SSTR1	41	45
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819006951	FD	On-Demand	Anodyne	ADRB2	46	37
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819006951	FD	On-Demand	Anodyne	ADRB1	24	47
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819006952	FD	On-Demand	Anodyne	ADRB2	46	37
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819006952	FD	On-Demand	Anodyne	ADRB1	24	47
O=C(OCc1ccccc1)c1cccc(CNC[C@H](O)CN2CCCC2=O)c1	ZINC000819006963	GE	On-Demand	Anodyne	BACE1	23	40
O=C(OCc1ccccc1)c1cccc(CNC[C@@H](O)CN2CCCC2=O)c1	ZINC000819006964	GE	On-Demand	Anodyne	BACE1	23	40
C=CCC1(C(=O)Nc2ccc(C(=O)OCCC)cc2)CCOCC1	ZINC000819006991	EH	On-Demand	Mild	ACR	57	38
COc1ccc(OC)c([C@H](O)CNCCCc2nc3c(s2)CCCC3)c1	ZINC000819007008	GG	On-Demand	Anodyne	ADRB2	20	43
C=C(C)C(C)(C)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819007023	DF	On-Demand	Mild	SLC6A9	16	42
C=C(C)C(C)(C)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819007023	DF	On-Demand	Mild	SSTR1	47	45
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819007063	GE	On-Demand	Anodyne	ADRB2	43	36
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819007063	GE	On-Demand	Anodyne	ADRB1	28	46
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819007064	GE	On-Demand	Anodyne	ADRB2	43	36
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819007064	GE	On-Demand	Anodyne	ADRB1	28	46
O=C(/C=C/[C@H]1CCCO1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819007105	ED	On-Demand	Bother	SSTR1	45	43
O=C(/C=C\[C@@H]1CCCO1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819007107	ED	On-Demand	Bother	SSTR1	45	43
O=C(/C=C/[C@@H]1CCCO1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819007109	ED	On-Demand	Bother	SSTR1	45	43
O=C(/C=C\[C@H]1CCCO1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819007111	ED	On-Demand	Bother	SSTR1	45	43
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819007116	GE	On-Demand	Anodyne	ADRB2	23	40
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819007118	GE	On-Demand	Anodyne	ADRB2	23	40
CCC[C@H](NC[C@@H](O)c1cccnc1)C(=O)N1CCc2sccc2C1	ZINC000819007127	FF	On-Demand	Anodyne	ADRB1	20	40
CCC[C@H](NC[C@@H](O)c1cccnc1)C(=O)N1CCc2sccc2C1	ZINC000819007127	FF	On-Demand	Anodyne	ADRB3	77	40
CCC[C@@H](NC[C@@H](O)c1cccnc1)C(=O)N1CCc2sccc2C1	ZINC000819007130	FF	On-Demand	Anodyne	ADRB1	20	40
CCC[C@@H](NC[C@@H](O)c1cccnc1)C(=O)N1CCc2sccc2C1	ZINC000819007130	FF	On-Demand	Anodyne	ADRB3	77	40
CCC[C@H](NC[C@H](O)c1cccnc1)C(=O)N1CCc2sccc2C1	ZINC000819007132	FF	On-Demand	Anodyne	ADRB1	20	40
CCC[C@H](NC[C@H](O)c1cccnc1)C(=O)N1CCc2sccc2C1	ZINC000819007132	FF	On-Demand	Anodyne	ADRB3	77	40
CCC[C@@H](NC[C@H](O)c1cccnc1)C(=O)N1CCc2sccc2C1	ZINC000819007134	FF	On-Demand	Anodyne	ADRB1	20	40
CCC[C@@H](NC[C@H](O)c1cccnc1)C(=O)N1CCc2sccc2C1	ZINC000819007134	FF	On-Demand	Anodyne	ADRB3	77	40
COc1ccc(OC)c([C@H](O)CNC2CCN(C(=O)c3ccc(C)cc3)CC2)c1	ZINC000819007135	GF	On-Demand	Anodyne	ADRB3	26	40
COc1ccc(OC)c([C@H](O)CNC2CCN(C(=O)c3ccc(C)cc3)CC2)c1	ZINC000819007135	GF	On-Demand	Anodyne	L3MBTL3	45	32
COC(=O)c1ccc(C)c(NC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819007151	DI	On-Demand	Anodyne	MAPK11	31	43
COC(=O)c1ccc(C)c(NC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819007151	DI	On-Demand	Anodyne	MAPK14	28	43
COC(=O)c1ccc(C)c(NC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819007151	DI	On-Demand	Anodyne	KCNK3	42	34
O[C@@H](CNCCCc1nc2c(s1)CCCC2)c1cccnc1	ZINC000819007159	DF	On-Demand	Anodyne	ADRB2	29	47
O[C@@H](CNCCCc1nc2c(s1)CCCC2)c1cccnc1	ZINC000819007159	DF	On-Demand	Anodyne	ADRB1	29	43
O[C@@H](CNCCCc1nc2c(s1)CCCC2)c1cccnc1	ZINC000819007159	DF	On-Demand	Anodyne	ADRB3	110	47
O[C@H](CNCCCc1nc2c(s1)CCCC2)c1cccnc1	ZINC000819007161	DF	On-Demand	Anodyne	ADRB2	29	47
O[C@H](CNCCCc1nc2c(s1)CCCC2)c1cccnc1	ZINC000819007161	DF	On-Demand	Anodyne	ADRB1	29	43
O[C@H](CNCCCc1nc2c(s1)CCCC2)c1cccnc1	ZINC000819007161	DF	On-Demand	Anodyne	ADRB3	110	47
Cc1ccc(COc2ccc(C[C@H](C)NC[C@H](O)c3cccnc3)cc2)cc1	ZINC000819007184	GI	On-Demand	Anodyne	ADRB2	49	51
Cc1ccc(COc2ccc(C[C@H](C)NC[C@H](O)c3cccnc3)cc2)cc1	ZINC000819007184	GI	On-Demand	Anodyne	ADRB1	47	63
Cc1ccc(COc2ccc(C[C@H](C)NC[C@H](O)c3cccnc3)cc2)cc1	ZINC000819007184	GI	On-Demand	Anodyne	ADRB3	101	63
Cc1ccc(COc2ccc(C[C@@H](C)NC[C@H](O)c3cccnc3)cc2)cc1	ZINC000819007186	GI	On-Demand	Anodyne	ADRB2	49	51
Cc1ccc(COc2ccc(C[C@@H](C)NC[C@H](O)c3cccnc3)cc2)cc1	ZINC000819007186	GI	On-Demand	Anodyne	ADRB1	47	63
Cc1ccc(COc2ccc(C[C@@H](C)NC[C@H](O)c3cccnc3)cc2)cc1	ZINC000819007186	GI	On-Demand	Anodyne	ADRB3	101	63
Cc1ccc(COc2ccc(C[C@@H](C)NC[C@@H](O)c3cccnc3)cc2)cc1	ZINC000819007187	GI	On-Demand	Anodyne	ADRB2	49	51
Cc1ccc(COc2ccc(C[C@@H](C)NC[C@@H](O)c3cccnc3)cc2)cc1	ZINC000819007187	GI	On-Demand	Anodyne	ADRB1	47	63
Cc1ccc(COc2ccc(C[C@@H](C)NC[C@@H](O)c3cccnc3)cc2)cc1	ZINC000819007187	GI	On-Demand	Anodyne	ADRB3	101	63
Cc1ccc(COc2ccc(C[C@H](C)NC[C@@H](O)c3cccnc3)cc2)cc1	ZINC000819007189	GI	On-Demand	Anodyne	ADRB2	49	51
Cc1ccc(COc2ccc(C[C@H](C)NC[C@@H](O)c3cccnc3)cc2)cc1	ZINC000819007189	GI	On-Demand	Anodyne	ADRB1	47	63
Cc1ccc(COc2ccc(C[C@H](C)NC[C@@H](O)c3cccnc3)cc2)cc1	ZINC000819007189	GI	On-Demand	Anodyne	ADRB3	101	63
COC(=O)c1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819007190	CE	On-Demand	Anodyne	HIF1A	16	48
COC(=O)c1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819007190	CE	On-Demand	Anodyne	KCNK3	67	34
COC(=O)c1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819007191	CE	On-Demand	Anodyne	HIF1A	16	48
COC(=O)c1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819007191	CE	On-Demand	Anodyne	KCNK3	67	34
COC(=O)c1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819007193	CE	On-Demand	Anodyne	HIF1A	16	48
COC(=O)c1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819007193	CE	On-Demand	Anodyne	KCNK3	67	34
COC(=O)c1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819007195	CE	On-Demand	Anodyne	HIF1A	16	48
COC(=O)c1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819007195	CE	On-Demand	Anodyne	KCNK3	67	34
C=C(C)C(C)(C)C(=O)NCC(=O)OCc1ccccc1	ZINC000819007196	CE	On-Demand	Mild	CTSK	18	40
C=C(C)C(C)(C)C(=O)NCC(=O)OCc1ccccc1	ZINC000819007196	CE	On-Demand	Mild	CTSL	16	40
C=C(C)C(C)(C)C(=O)NCC(=O)OCc1ccccc1	ZINC000819007196	CE	On-Demand	Mild	CAPNS1	48	32
C=C(C)C(C)(C)C(=O)NCC(=O)OCc1ccccc1	ZINC000819007196	CE	On-Demand	Mild	CAPN1	44	36
C=C(C)C(C)(C)C(=O)NCC(=O)OCc1ccccc1	ZINC000819007196	CE	On-Demand	Mild	CAPN2	64	37
C=C(C)C(C)(C)C(=O)NCC(=O)OCc1ccccc1	ZINC000819007196	CE	On-Demand	Mild	NPR	64	35
C=C(C)C(C)(C)C(=O)NCC(=O)OCc1ccccc1	ZINC000819007196	CE	On-Demand	Mild	SLC12A5	52	33
C[C@@H]1CCCC[C@@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819007240	EG	On-Demand	Bother	SSTR1	61	48
C[C@@H]1CCCC[C@@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819007240	EG	On-Demand	Bother	SSTR3	23	48
C[C@@H]1CCCC[C@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819007242	EG	On-Demand	Bother	SSTR1	61	48
C[C@@H]1CCCC[C@H]1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819007242	EG	On-Demand	Bother	SSTR3	23	48
CC(C)(C)OC(=O)N(CCNC[C@H](O)c1ccccc1)C1CC1	ZINC000819007262	DF	On-Demand	Anodyne	ADRB2	20	40
CC(C)(C)OC(=O)N(CCNC[C@H](O)c1ccccc1)C1CC1	ZINC000819007262	DF	On-Demand	Anodyne	ADRB3	57	46
CC(C)(C)OC(=O)N(CCNC[C@H](O)c1ccccc1)C1CC1	ZINC000819007262	DF	On-Demand	Anodyne	AMY2	46	31
CC(C)(C)OC(=O)N(CCNC[C@@H](O)c1ccccc1)C1CC1	ZINC000819007264	DF	On-Demand	Anodyne	ADRB2	20	40
CC(C)(C)OC(=O)N(CCNC[C@@H](O)c1ccccc1)C1CC1	ZINC000819007264	DF	On-Demand	Anodyne	ADRB3	57	46
CC(C)(C)OC(=O)N(CCNC[C@@H](O)c1ccccc1)C1CC1	ZINC000819007264	DF	On-Demand	Anodyne	AMY2	46	31
CC(C)(C)OC(=O)N(CCNC[C@@H](O)Cc1ccccc1)C1CC1	ZINC000819007276	EF	On-Demand	Anodyne	MME	52	34
CC(C)(C)OC(=O)N(CCNC[C@@H](O)Cc1ccccc1)C1CC1	ZINC000819007276	EF	On-Demand	Anodyne	PGC	54	34
CC(C)(C)OC(=O)N(CCNC[C@@H](O)Cc1ccccc1)C1CC1	ZINC000819007276	EF	On-Demand	Anodyne	PAPA1_CARPA	35	41
CC(C)(C)OC(=O)N(CCNC[C@@H](O)Cc1ccccc1)C1CC1	ZINC000819007276	EF	On-Demand	Anodyne	AMY2	44	30
CC(C)(C)OC(=O)N(CCNC[C@@H](O)Cc1ccccc1)C1CC1	ZINC000819007276	EF	On-Demand	Anodyne	REN	59	41
CC(C)(C)OC(=O)N(CCNC[C@@H](O)Cc1ccccc1)C1CC1	ZINC000819007276	EF	On-Demand	Anodyne	FPR1	50	38
CC(C)(C)OC(=O)N(CCNC[C@H](O)Cc1ccccc1)C1CC1	ZINC000819007277	EF	On-Demand	Anodyne	MME	52	34
CC(C)(C)OC(=O)N(CCNC[C@H](O)Cc1ccccc1)C1CC1	ZINC000819007277	EF	On-Demand	Anodyne	PGC	54	34
CC(C)(C)OC(=O)N(CCNC[C@H](O)Cc1ccccc1)C1CC1	ZINC000819007277	EF	On-Demand	Anodyne	PAPA1_CARPA	35	41
CC(C)(C)OC(=O)N(CCNC[C@H](O)Cc1ccccc1)C1CC1	ZINC000819007277	EF	On-Demand	Anodyne	AMY2	44	30
CC(C)(C)OC(=O)N(CCNC[C@H](O)Cc1ccccc1)C1CC1	ZINC000819007277	EF	On-Demand	Anodyne	REN	59	41
CC(C)(C)OC(=O)N(CCNC[C@H](O)Cc1ccccc1)C1CC1	ZINC000819007277	EF	On-Demand	Anodyne	FPR1	50	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccc(C(F)(F)F)c1)C2	ZINC000819007287	FG	On-Demand	Anodyne	TACR1	25	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccc(C(F)(F)F)c1)C2	ZINC000819007287	FG	On-Demand	Anodyne	CCR2	128	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccc(C(F)(F)F)c1)C2	ZINC000819007287	FG	On-Demand	Anodyne	PDS	46	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccc(C(F)(F)F)c1)C2	ZINC000819007288	FG	On-Demand	Anodyne	TACR1	25	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccc(C(F)(F)F)c1)C2	ZINC000819007288	FG	On-Demand	Anodyne	CCR2	128	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccc(C(F)(F)F)c1)C2	ZINC000819007288	FG	On-Demand	Anodyne	PDS	46	38
CC(=O)Nc1cccc(CC(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)c1	ZINC000819007291	GG	On-Demand	Reactive	TSHR	40	30
CC(=O)Nc1cccc(CC(=O)NNC(=O)c2ccc(OCCC(C)C)cc2)c1	ZINC000819007291	GG	On-Demand	Reactive	KCNK3	50	33
O[C@@H](CNCCCc1nc2c(s1)CCCC2)c1cccc(Cl)c1	ZINC000819007296	FH	On-Demand	Anodyne	ADRB2	50	36
O[C@@H](CNCCCc1nc2c(s1)CCCC2)c1cccc(Cl)c1	ZINC000819007296	FH	On-Demand	Anodyne	ADRB1	55	45
O[C@@H](CNCCCc1nc2c(s1)CCCC2)c1cccc(Cl)c1	ZINC000819007296	FH	On-Demand	Anodyne	ADRB3	70	46
O[C@H](CNCCCc1nc2c(s1)CCCC2)c1cccc(Cl)c1	ZINC000819007300	FH	On-Demand	Anodyne	ADRB2	50	36
O[C@H](CNCCCc1nc2c(s1)CCCC2)c1cccc(Cl)c1	ZINC000819007300	FH	On-Demand	Anodyne	ADRB1	55	45
O[C@H](CNCCCc1nc2c(s1)CCCC2)c1cccc(Cl)c1	ZINC000819007300	FH	On-Demand	Anodyne	ADRB3	70	46
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819007301	GE	On-Demand	Reactive	MMP3	19	41
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819007301	GE	On-Demand	Reactive	EPHX2	27	49
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819007301	GE	On-Demand	Reactive	TGM2	59	40
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819007301	GE	On-Demand	Reactive	MMP1	22	41
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819007301	GE	On-Demand	Reactive	F13A1	49	40
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819007301	GE	On-Demand	Reactive	L3MBTL3	44	48
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819007303	GE	On-Demand	Reactive	MMP3	19	41
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819007303	GE	On-Demand	Reactive	EPHX2	27	49
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819007303	GE	On-Demand	Reactive	TGM2	59	40
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819007303	GE	On-Demand	Reactive	MMP1	22	41
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819007303	GE	On-Demand	Reactive	F13A1	49	40
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819007303	GE	On-Demand	Reactive	L3MBTL3	44	48
O=C(Cc1nsc2ccccc12)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819007310	GG	On-Demand	Bother	HTR1A	19	44
O=C(Cc1nsc2ccccc12)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819007310	GG	On-Demand	Bother	DRD2	21	44
O=C(Cc1nsc2ccccc12)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819007310	GG	On-Demand	Bother	SSTR1	54	53
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccccc1F	ZINC000819007311	DE	On-Demand	Anodyne	PAPA1_CARPA	28	47
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007318	GH	On-Demand	Anodyne	KCNK3	45	39
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007319	GH	On-Demand	Anodyne	KCNK3	45	39
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007321	GH	On-Demand	Anodyne	KCNK3	45	39
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007323	GH	On-Demand	Anodyne	KCNK3	45	39
COc1cccc([S@@](=O)CC(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)c1	ZINC000819007340	GF	On-Demand	Reactive	MT-ND1	23	42
O[C@@H](CNCCCc1nc2c(s1)CCCC2)c1cccc(F)c1	ZINC000819007373	EG	On-Demand	Anodyne	ADRB3	42	39
O[C@H](CNCCCc1nc2c(s1)CCCC2)c1cccc(F)c1	ZINC000819007375	EG	On-Demand	Anodyne	ADRB3	42	39
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819007376	GE	On-Demand	Anodyne	ADRB2	49	37
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819007376	GE	On-Demand	Anodyne	ADRB1	22	47
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819007378	GE	On-Demand	Anodyne	ADRB2	49	37
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819007378	GE	On-Demand	Anodyne	ADRB1	22	47
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007381	FD	On-Demand	Anodyne	ACE	48	36
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007381	FD	On-Demand	Anodyne	OPRM1	36	43
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007381	FD	On-Demand	Anodyne	OPRD1	28	43
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007381	FD	On-Demand	Anodyne	MME	57	45
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007381	FD	On-Demand	Anodyne	TACR1	26	40
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007381	FD	On-Demand	Anodyne	CMA1	43	40
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007381	FD	On-Demand	Anodyne	CTRA_BOVIN	51	36
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007381	FD	On-Demand	Anodyne	TRY1_BOVIN	49	35
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007381	FD	On-Demand	Anodyne	CYSP_TRYCR	45	34
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007381	FD	On-Demand	Anodyne	NPFFR2	54	32
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007381	FD	On-Demand	Anodyne	TIMP3	79	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007381	FD	On-Demand	Anodyne	CAPNS1	65	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007381	FD	On-Demand	Anodyne	CELA2A	49	31
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007381	FD	On-Demand	Anodyne	CAPN1	62	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007381	FD	On-Demand	Anodyne	CTRC	15	40
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007381	FD	On-Demand	Anodyne	ACE2	48	33
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007381	FD	On-Demand	Anodyne	MMP1	15	40
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007381	FD	On-Demand	Anodyne	CTRB_BOVIN	44	32
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007384	FD	On-Demand	Anodyne	ACE	48	36
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007384	FD	On-Demand	Anodyne	OPRM1	36	43
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007384	FD	On-Demand	Anodyne	OPRD1	28	43
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007384	FD	On-Demand	Anodyne	MME	57	45
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007384	FD	On-Demand	Anodyne	TACR1	26	40
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007384	FD	On-Demand	Anodyne	CMA1	43	40
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007384	FD	On-Demand	Anodyne	CTRA_BOVIN	51	36
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007384	FD	On-Demand	Anodyne	TRY1_BOVIN	49	35
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007384	FD	On-Demand	Anodyne	CYSP_TRYCR	45	34
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007384	FD	On-Demand	Anodyne	NPFFR2	54	32
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007384	FD	On-Demand	Anodyne	TIMP3	79	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007384	FD	On-Demand	Anodyne	CAPNS1	65	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007384	FD	On-Demand	Anodyne	CELA2A	49	31
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007384	FD	On-Demand	Anodyne	CAPN1	62	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007384	FD	On-Demand	Anodyne	CTRC	15	40
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007384	FD	On-Demand	Anodyne	ACE2	48	33
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007384	FD	On-Demand	Anodyne	MMP1	15	40
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819007384	FD	On-Demand	Anodyne	CTRB_BOVIN	44	32
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819007393	GE	On-Demand	Bother	SSTR1	47	50
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819007393	GE	On-Demand	Bother	KCNJ1	89	62
C=CCCn1cc(C(=O)NCC(=O)OCc2ccccc2)nn1	ZINC000819007394	DD	On-Demand	Mild	NPR	46	32
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	ACE	20	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	SSTR2	51	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	GHRHR	27	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	MME	27	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	EDNRB	55	39
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	EDNRA	38	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	TACR1	35	50
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	MC4R	42	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	CCKAR	121	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	NMBR	56	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	MC3R	61	34
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	MC5R	65	32
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	MMP2	26	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	MMP8	33	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	GRPR	66	33
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	ECE1	62	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	MMP11	74	36
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	CCKBR	105	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	GHSR	70	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	MMP9	24	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	MC1R	88	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	NPR	27	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	KISS1R	65	33
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007397	EE	On-Demand	Anodyne	ERAP2	42	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	ACE	20	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	SSTR2	51	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	GHRHR	27	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	MME	27	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	EDNRB	55	39
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	EDNRA	38	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	TACR1	35	50
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	MC4R	42	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	CCKAR	121	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	NMBR	56	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	MC3R	61	34
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	MC5R	65	32
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	MMP2	26	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	MMP8	33	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	GRPR	66	33
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	ECE1	62	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	MMP11	74	36
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	CCKBR	105	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	GHSR	70	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	MMP9	24	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	MC1R	88	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	NPR	27	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	KISS1R	65	33
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007399	EE	On-Demand	Anodyne	ERAP2	42	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	ACE	20	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	SSTR2	51	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	GHRHR	27	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	MME	27	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	EDNRB	55	39
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	EDNRA	38	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	TACR1	35	50
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	MC4R	42	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	CCKAR	121	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	NMBR	56	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	MC3R	61	34
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	MC5R	65	32
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	MMP2	26	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	MMP8	33	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	GRPR	66	33
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	ECE1	62	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	MMP11	74	36
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	CCKBR	105	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	GHSR	70	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	MMP9	24	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	MC1R	88	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	NPR	27	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	KISS1R	65	33
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007401	EE	On-Demand	Anodyne	ERAP2	42	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	ACE	20	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	SSTR2	51	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	GHRHR	27	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	MME	27	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	EDNRB	55	39
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	EDNRA	38	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	TACR1	35	50
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	MC4R	42	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	CCKAR	121	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	NMBR	56	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	MC3R	61	34
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	MC5R	65	32
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	MMP2	26	43
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	MMP8	33	41
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	GRPR	66	33
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	ECE1	62	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	MMP11	74	36
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	CCKBR	105	40
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	GHSR	70	46
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	MMP9	24	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	MC1R	88	37
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	NPR	27	42
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	KISS1R	65	33
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007402	EE	On-Demand	Anodyne	ERAP2	42	37
O=C(C(F)=C1CCC1)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819007403	GD	On-Demand	Bother	AKR1C3	53	45
O=C(CCc1cccc(OC(F)F)c1)NCC(=O)OCc1ccccc1	ZINC000819007421	FG	On-Demand	Anodyne	PLA2G4A	26	41
O=C(CCc1cccc(OC(F)F)c1)NCC(=O)OCc1ccccc1	ZINC000819007421	FG	On-Demand	Anodyne	FFAR1	29	41
O=C(CCc1cccc(OC(F)F)c1)NCC(=O)OCc1ccccc1	ZINC000819007421	FG	On-Demand	Anodyne	CRTM	47	37
O=C(CCc1cccc(OC(F)F)c1)NCC(=O)OCc1ccccc1	ZINC000819007421	FG	On-Demand	Anodyne	PDS	45	37
O=C(/C=C\[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819007427	FD	On-Demand	Anodyne	PKM	28	42
O=C(/C=C\[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819007427	FD	On-Demand	Anodyne	TGM2	74	39
O=C(/C=C\[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819007427	FD	On-Demand	Anodyne	F13A1	79	39
O=C(/C=C\[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819007427	FD	On-Demand	Anodyne	AKR1C3	44	36
O[C@@H](CNCC1(c2ccccc2)CCCCCC1)c1cccnc1	ZINC000819007428	DH	On-Demand	Anodyne	ADRB2	20	42
O[C@@H](CNCC1(c2ccccc2)CCCCCC1)c1cccnc1	ZINC000819007428	DH	On-Demand	Anodyne	ADRB1	21	40
O[C@@H](CNCC1(c2ccccc2)CCCCCC1)c1cccnc1	ZINC000819007428	DH	On-Demand	Anodyne	ADRB3	87	45
O=C(/C=C/[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819007429	FD	On-Demand	Anodyne	PKM	28	42
O=C(/C=C/[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819007429	FD	On-Demand	Anodyne	TGM2	74	39
O=C(/C=C/[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819007429	FD	On-Demand	Anodyne	F13A1	79	39
O=C(/C=C/[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819007429	FD	On-Demand	Anodyne	AKR1C3	44	36
O=C(/C=C\[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819007430	FD	On-Demand	Anodyne	PKM	28	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819007430	FD	On-Demand	Anodyne	TGM2	74	39
O=C(/C=C\[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819007430	FD	On-Demand	Anodyne	F13A1	79	39
O=C(/C=C\[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819007430	FD	On-Demand	Anodyne	AKR1C3	44	36
O[C@H](CNCC1(c2ccccc2)CCCCCC1)c1cccnc1	ZINC000819007431	DH	On-Demand	Anodyne	ADRB2	20	42
O[C@H](CNCC1(c2ccccc2)CCCCCC1)c1cccnc1	ZINC000819007431	DH	On-Demand	Anodyne	ADRB1	21	40
O[C@H](CNCC1(c2ccccc2)CCCCCC1)c1cccnc1	ZINC000819007431	DH	On-Demand	Anodyne	ADRB3	87	45
O=C(/C=C/[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819007432	FD	On-Demand	Anodyne	PKM	28	42
O=C(/C=C/[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819007432	FD	On-Demand	Anodyne	TGM2	74	39
O=C(/C=C/[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819007432	FD	On-Demand	Anodyne	F13A1	79	39
O=C(/C=C/[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819007432	FD	On-Demand	Anodyne	AKR1C3	44	36
O=C(NC[C@@H]1COc2ccccc2O1)C(F)=C1CCC1	ZINC000819007433	CE	On-Demand	Anodyne	ADRA2B	16	40
O=C(NC[C@H]1COc2ccccc2O1)C(F)=C1CCC1	ZINC000819007435	CE	On-Demand	Anodyne	ADRA2B	16	40
Cc1ccc(COc2ccc(C[C@@H](C)NC[C@@H](O)c3ccc(F)cn3)cc2)cc1	ZINC000819007453	GI	On-Demand	Anodyne	ADRB2	18	47
Cc1ccc(COc2ccc(C[C@@H](C)NC[C@@H](O)c3ccc(F)cn3)cc2)cc1	ZINC000819007453	GI	On-Demand	Anodyne	ADRB1	17	46
Cc1ccc(COc2ccc(C[C@@H](C)NC[C@H](O)c3ccc(F)cn3)cc2)cc1	ZINC000819007456	GI	On-Demand	Anodyne	ADRB2	18	47
Cc1ccc(COc2ccc(C[C@@H](C)NC[C@H](O)c3ccc(F)cn3)cc2)cc1	ZINC000819007456	GI	On-Demand	Anodyne	ADRB1	17	46
Cc1ccc(COc2ccc(C[C@H](C)NC[C@@H](O)c3ccc(F)cn3)cc2)cc1	ZINC000819007458	GI	On-Demand	Anodyne	ADRB2	18	47
Cc1ccc(COc2ccc(C[C@H](C)NC[C@@H](O)c3ccc(F)cn3)cc2)cc1	ZINC000819007458	GI	On-Demand	Anodyne	ADRB1	17	46
Cc1ccc(COc2ccc(C[C@H](C)NC[C@H](O)c3ccc(F)cn3)cc2)cc1	ZINC000819007460	GI	On-Demand	Anodyne	ADRB2	18	47
Cc1ccc(COc2ccc(C[C@H](C)NC[C@H](O)c3ccc(F)cn3)cc2)cc1	ZINC000819007460	GI	On-Demand	Anodyne	ADRB1	17	46
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007461	DD	On-Demand	Anodyne	OPRM1	21	42
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007461	DD	On-Demand	Anodyne	MME	57	42
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007461	DD	On-Demand	Anodyne	CTRA_BOVIN	41	40
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007461	DD	On-Demand	Anodyne	CTSB	41	35
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007461	DD	On-Demand	Anodyne	PAPA1_CARPA	43	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007461	DD	On-Demand	Anodyne	CYSP_TRYCR	45	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007461	DD	On-Demand	Anodyne	TIMP3	81	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007461	DD	On-Demand	Anodyne	CAPNS1	72	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007461	DD	On-Demand	Anodyne	REN	66	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007461	DD	On-Demand	Anodyne	CAPN1	77	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007461	DD	On-Demand	Anodyne	CAPN2	43	36
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007461	DD	On-Demand	Anodyne	ACE2	59	34
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007461	DD	On-Demand	Anodyne	CTRB_BOVIN	45	32
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819007461	DD	On-Demand	Anodyne	BRCA1	44	31
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007462	DD	On-Demand	Anodyne	OPRM1	21	42
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007462	DD	On-Demand	Anodyne	MME	57	42
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007462	DD	On-Demand	Anodyne	CTRA_BOVIN	41	40
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007462	DD	On-Demand	Anodyne	CTSB	41	35
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007462	DD	On-Demand	Anodyne	PAPA1_CARPA	43	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007462	DD	On-Demand	Anodyne	CYSP_TRYCR	45	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007462	DD	On-Demand	Anodyne	TIMP3	81	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007462	DD	On-Demand	Anodyne	CAPNS1	72	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007462	DD	On-Demand	Anodyne	REN	66	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007462	DD	On-Demand	Anodyne	CAPN1	77	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007462	DD	On-Demand	Anodyne	CAPN2	43	36
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007462	DD	On-Demand	Anodyne	ACE2	59	34
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007462	DD	On-Demand	Anodyne	CTRB_BOVIN	45	32
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819007462	DD	On-Demand	Anodyne	BRCA1	44	31
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007463	DD	On-Demand	Anodyne	OPRM1	21	42
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007463	DD	On-Demand	Anodyne	MME	57	42
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007463	DD	On-Demand	Anodyne	CTRA_BOVIN	41	40
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007463	DD	On-Demand	Anodyne	CTSB	41	35
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007463	DD	On-Demand	Anodyne	PAPA1_CARPA	43	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007463	DD	On-Demand	Anodyne	CYSP_TRYCR	45	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007463	DD	On-Demand	Anodyne	TIMP3	81	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007463	DD	On-Demand	Anodyne	CAPNS1	72	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007463	DD	On-Demand	Anodyne	REN	66	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007463	DD	On-Demand	Anodyne	CAPN1	77	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007463	DD	On-Demand	Anodyne	CAPN2	43	36
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007463	DD	On-Demand	Anodyne	ACE2	59	34
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007463	DD	On-Demand	Anodyne	CTRB_BOVIN	45	32
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819007463	DD	On-Demand	Anodyne	BRCA1	44	31
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007464	DD	On-Demand	Anodyne	OPRM1	21	42
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007464	DD	On-Demand	Anodyne	MME	57	42
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007464	DD	On-Demand	Anodyne	CTRA_BOVIN	41	40
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007464	DD	On-Demand	Anodyne	CTSB	41	35
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007464	DD	On-Demand	Anodyne	PAPA1_CARPA	43	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007464	DD	On-Demand	Anodyne	CYSP_TRYCR	45	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007464	DD	On-Demand	Anodyne	TIMP3	81	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007464	DD	On-Demand	Anodyne	CAPNS1	72	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007464	DD	On-Demand	Anodyne	REN	66	37
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007464	DD	On-Demand	Anodyne	CAPN1	77	38
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007464	DD	On-Demand	Anodyne	CAPN2	43	36
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007464	DD	On-Demand	Anodyne	ACE2	59	34
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007464	DD	On-Demand	Anodyne	CTRB_BOVIN	45	32
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819007464	DD	On-Demand	Anodyne	BRCA1	44	31
C=CCCn1cc(C(=O)Nc2ccc(C(=O)OCCC)cc2)nn1	ZINC000819007466	EF	On-Demand	Mild	ACR	52	35
C=CCCn1cc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)nn1	ZINC000819007477	FD	On-Demand	Mild	SSTR1	39	41
COC(=O)C1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819007485	FD	On-Demand	Mild	PAPA1_CARPA	36	44
COC(=O)C1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819007486	FD	On-Demand	Mild	PAPA1_CARPA	36	44
C[C@@H](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)n1cccn1	ZINC000819007491	EE	On-Demand	Bother	SSTR1	62	52
COC(=O)c1ccc(C)c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819007495	GG	On-Demand	Mild	PAPA1_CARPA	46	45
COC(=O)c1ccc(C)c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819007496	GG	On-Demand	Mild	PAPA1_CARPA	46	45
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819007497	FD	On-Demand	Anodyne	ADRB2	31	40
NS(=O)(=O)Cc1cccc(CNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819007497	FD	On-Demand	Anodyne	ADRB1	17	43
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819007498	FD	On-Demand	Anodyne	ADRB2	31	40
NS(=O)(=O)Cc1cccc(CNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819007498	FD	On-Demand	Anodyne	ADRB1	17	43
CN(C)S(=O)(=O)c1cc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])ccc1Cl	ZINC000819007520	JF	On-Demand	Bother	COLA	86	41
O=C(CNC(=O)C(F)=C1CCC1)OCc1ccccc1	ZINC000819007528	CE	On-Demand	Anodyne	CAPNS1	42	31
O=C(CNC(=O)C(F)=C1CCC1)OCc1ccccc1	ZINC000819007528	CE	On-Demand	Anodyne	CAPN2	55	33
O=C(CNC(=O)C(F)=C1CCC1)OCc1ccccc1	ZINC000819007528	CE	On-Demand	Anodyne	SLC12A5	52	34
O=C(OCc1ccccc1)c1cccc(CNC[C@H](O)CN2CCOCC2)c1	ZINC000819007535	GD	On-Demand	Anodyne	CASR	45	51
O=C(OCc1ccccc1)c1cccc(CNC[C@H](O)CN2CCOCC2)c1	ZINC000819007535	GD	On-Demand	Anodyne	ABCB1	48	40
O=C(OCc1ccccc1)c1cccc(CNC[C@@H](O)CN2CCOCC2)c1	ZINC000819007536	GD	On-Demand	Anodyne	CASR	45	51
O=C(OCc1ccccc1)c1cccc(CNC[C@@H](O)CN2CCOCC2)c1	ZINC000819007536	GD	On-Demand	Anodyne	ABCB1	48	40
COc1cc2c(cc1OC)CN(C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)CC2	ZINC000819007539	GF	On-Demand	Anodyne	ABCB1	17	43
CC[C@H](C)N(C)CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819007543	FE	On-Demand	Anodyne	GPR119	29	44
CC[C@H](C)N(C)CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819007545	FE	On-Demand	Anodyne	GPR119	29	44
O=C(Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)C(F)=C1CCC1	ZINC000819007567	FE	On-Demand	Anodyne	NR1H4	18	42
O=C(Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)C(F)=C1CCC1	ZINC000819007567	FE	On-Demand	Anodyne	EPHX2	19	41
CC(C)(C)OC(=O)N(CCNC[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000819007579	FF	On-Demand	Bother	SLC27A4	48	31
CC(C)(C)OC(=O)N(CCNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000819007581	FF	On-Demand	Bother	SLC27A4	48	31
CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819007599	GE	On-Demand	Reactive	TSHR	55	32
CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819007602	GE	On-Demand	Reactive	TSHR	55	32
COC(=O)c1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819007611	CF	On-Demand	Anodyne	KCNK3	104	37
COC(=O)c1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819007611	CF	On-Demand	Anodyne	KCNK9	68	35
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(C(F)(F)F)c1	ZINC000819007617	CG	On-Demand	Anodyne	CCR2	85	39
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(C(F)(F)F)c1	ZINC000819007618	CG	On-Demand	Anodyne	CCR2	85	39
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(C(F)(F)F)c1	ZINC000819007619	CG	On-Demand	Anodyne	CCR2	85	39
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(C(F)(F)F)c1	ZINC000819007620	CG	On-Demand	Anodyne	CCR2	85	39
CC(C)(C)OC(=O)N(CCNC[C@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819007623	FG	On-Demand	Anodyne	ADRB2	41	38
CC(C)(C)OC(=O)N(CCNC[C@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819007623	FG	On-Demand	Anodyne	ADRB1	59	47
CC(C)(C)OC(=O)N(CCNC[C@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819007623	FG	On-Demand	Anodyne	ADRB3	72	47
CC(C)(C)OC(=O)N(CCNC[C@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819007623	FG	On-Demand	Anodyne	CYP3A4	45	34
CC(C)(C)OC(=O)N(CCNC[C@@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819007624	FG	On-Demand	Anodyne	ADRB2	41	38
CC(C)(C)OC(=O)N(CCNC[C@@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819007624	FG	On-Demand	Anodyne	ADRB1	59	47
CC(C)(C)OC(=O)N(CCNC[C@@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819007624	FG	On-Demand	Anodyne	ADRB3	72	47
CC(C)(C)OC(=O)N(CCNC[C@@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819007624	FG	On-Demand	Anodyne	CYP3A4	45	34
C[C@H](CC(=O)NCC(=O)OCc1ccccc1)n1cccn1	ZINC000819007625	DD	On-Demand	Anodyne	CAPNS1	52	32
C[C@H](CC(=O)NCC(=O)OCc1ccccc1)n1cccn1	ZINC000819007625	DD	On-Demand	Anodyne	CAPN1	53	35
C[C@H](CC(=O)NCC(=O)OCc1ccccc1)n1cccn1	ZINC000819007625	DD	On-Demand	Anodyne	CAPN2	79	34
C[C@H](CC(=O)NCC(=O)OCc1ccccc1)n1cccn1	ZINC000819007625	DD	On-Demand	Anodyne	NPR	66	34
C[C@H](CC(=O)NCC(=O)OCc1ccccc1)n1cccn1	ZINC000819007625	DD	On-Demand	Anodyne	SLC12A5	44	35
C[C@@H](CC(=O)NCC(=O)OCc1ccccc1)n1cccn1	ZINC000819007627	DD	On-Demand	Anodyne	CAPNS1	52	32
C[C@@H](CC(=O)NCC(=O)OCc1ccccc1)n1cccn1	ZINC000819007627	DD	On-Demand	Anodyne	CAPN1	53	35
C[C@@H](CC(=O)NCC(=O)OCc1ccccc1)n1cccn1	ZINC000819007627	DD	On-Demand	Anodyne	CAPN2	79	34
C[C@@H](CC(=O)NCC(=O)OCc1ccccc1)n1cccn1	ZINC000819007627	DD	On-Demand	Anodyne	NPR	66	34
C[C@@H](CC(=O)NCC(=O)OCc1ccccc1)n1cccn1	ZINC000819007627	DD	On-Demand	Anodyne	SLC12A5	44	35
CC(C)n1nc(C(=O)NNC(=O)[C@H]2CCCC[C@@H]2C)c2ccccc2c1=O	ZINC000819007638	FF	On-Demand	Reactive	HTR4	22	40
CC(C)n1nc(C(=O)NNC(=O)[C@H]2CCCC[C@H]2C)c2ccccc2c1=O	ZINC000819007639	FF	On-Demand	Reactive	HTR4	22	40
CC(C)n1nc(C(=O)NNC(=O)[C@@H]2CCCC[C@@H]2C)c2ccccc2c1=O	ZINC000819007643	FF	On-Demand	Reactive	HTR4	22	40
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819007648	FD	On-Demand	Reactive	CA2	18	50
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819007648	FD	On-Demand	Reactive	CA6	20	50
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819007648	FD	On-Demand	Reactive	CA1	17	49
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819007648	FD	On-Demand	Reactive	CA7	20	50
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819007648	FD	On-Demand	Reactive	CA13	33	50
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819007648	FD	On-Demand	Reactive	CA4	18	50
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819007649	FD	On-Demand	Reactive	CA2	18	50
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819007649	FD	On-Demand	Reactive	CA6	20	50
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819007649	FD	On-Demand	Reactive	CA1	17	49
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819007649	FD	On-Demand	Reactive	CA7	20	50
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819007649	FD	On-Demand	Reactive	CA13	33	50
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819007649	FD	On-Demand	Reactive	CA4	18	50
O[C@@H](CNCc1ccc2c(c1)OCCCO2)c1cccc(Cl)c1	ZINC000819007682	EG	On-Demand	Anodyne	ADRB1	30	44
O[C@@H](CNCc1ccc2c(c1)OCCCO2)c1cccc(Cl)c1	ZINC000819007682	EG	On-Demand	Anodyne	ADRB3	43	45
O[C@H](CNCc1ccc2c(c1)OCCCO2)c1cccc(Cl)c1	ZINC000819007683	EG	On-Demand	Anodyne	ADRB1	30	44
O[C@H](CNCc1ccc2c(c1)OCCCO2)c1cccc(Cl)c1	ZINC000819007683	EG	On-Demand	Anodyne	ADRB3	43	45
CC(C)n1nc(C(=O)NNC(=O)[C@@H]2CCCC[C@H]2C)c2ccccc2c1=O	ZINC000819007714	FF	On-Demand	Reactive	HTR4	22	40
COC[C@@H](O)CNCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000819007716	EE	On-Demand	Anodyne	CAPN1	41	33
COC[C@@H](O)CNCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000819007716	EE	On-Demand	Anodyne	CAPN2	56	32
COC[C@@H](O)CNCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000819007716	EE	On-Demand	Anodyne	PDS	42	39
C[C@@H]1CCCC[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007721	CF	On-Demand	Anodyne	FKBP1A	29	42
C[C@@H]1CCCC[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007721	CF	On-Demand	Anodyne	CTSK	37	44
C[C@@H]1CCCC[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007721	CF	On-Demand	Anodyne	PREP	26	40
C[C@@H]1CCCC[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007721	CF	On-Demand	Anodyne	AMY2	45	31
C[C@@H]1CCCC[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007721	CF	On-Demand	Anodyne	CAPN2	60	35
C[C@@H]1CCCC[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007721	CF	On-Demand	Anodyne	NPR	53	32
C[C@@H]1CCCC[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007721	CF	On-Demand	Anodyne	SLC12A5	66	36
C[C@@H]1CCCC[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007721	CF	On-Demand	Anodyne	Q9NAW4_PLAFA	23	40
C[C@@H]1CCCC[C@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007723	CF	On-Demand	Anodyne	FKBP1A	29	42
C[C@@H]1CCCC[C@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007723	CF	On-Demand	Anodyne	CTSK	37	44
C[C@@H]1CCCC[C@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007723	CF	On-Demand	Anodyne	PREP	26	40
C[C@@H]1CCCC[C@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007723	CF	On-Demand	Anodyne	AMY2	45	31
C[C@@H]1CCCC[C@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007723	CF	On-Demand	Anodyne	CAPN2	60	35
C[C@@H]1CCCC[C@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007723	CF	On-Demand	Anodyne	NPR	53	32
C[C@@H]1CCCC[C@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007723	CF	On-Demand	Anodyne	SLC12A5	66	36
C[C@@H]1CCCC[C@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007723	CF	On-Demand	Anodyne	Q9NAW4_PLAFA	23	40
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819007746	GD	On-Demand	Anodyne	F13A1	40	37
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819007747	GD	On-Demand	Anodyne	F13A1	40	37
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819007749	GD	On-Demand	Anodyne	F13A1	40	37
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819007750	GD	On-Demand	Anodyne	F13A1	40	37
O[C@@H](CNCC1(c2cccc(C(F)(F)F)c2)CC1)c1cccnc1	ZINC000819007762	EG	On-Demand	Anodyne	ADRB2	18	42
O[C@@H](CNCC1(c2cccc(C(F)(F)F)c2)CC1)c1cccnc1	ZINC000819007762	EG	On-Demand	Anodyne	ADRB1	19	40
O[C@@H](CNCC1(c2cccc(C(F)(F)F)c2)CC1)c1cccnc1	ZINC000819007762	EG	On-Demand	Anodyne	ADRB3	68	42
O[C@H](CNCC1(c2cccc(C(F)(F)F)c2)CC1)c1cccnc1	ZINC000819007763	EG	On-Demand	Anodyne	ADRB2	18	42
O[C@H](CNCC1(c2cccc(C(F)(F)F)c2)CC1)c1cccnc1	ZINC000819007763	EG	On-Demand	Anodyne	ADRB1	19	40
O[C@H](CNCC1(c2cccc(C(F)(F)F)c2)CC1)c1cccnc1	ZINC000819007763	EG	On-Demand	Anodyne	ADRB3	68	42
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007774	DF	On-Demand	Reactive	ACE	15	40
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007774	DF	On-Demand	Reactive	SSTR2	42	32
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007774	DF	On-Demand	Reactive	EDNRA	18	40
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007774	DF	On-Demand	Reactive	TACR1	33	40
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007774	DF	On-Demand	Reactive	CCKAR	56	44
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007774	DF	On-Demand	Reactive	BRS3	25	42
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007774	DF	On-Demand	Reactive	NMBR	63	43
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007774	DF	On-Demand	Reactive	MMP2	22	41
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007774	DF	On-Demand	Reactive	ECE1	46	36
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007774	DF	On-Demand	Reactive	SSTR3	28	51
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007774	DF	On-Demand	Reactive	CCKBR	65	43
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007774	DF	On-Demand	Reactive	GHSR	45	40
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007774	DF	On-Demand	Reactive	MMP9	20	41
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007775	DF	On-Demand	Reactive	ACE	15	40
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007775	DF	On-Demand	Reactive	SSTR2	42	32
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007775	DF	On-Demand	Reactive	EDNRA	18	40
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007775	DF	On-Demand	Reactive	TACR1	33	40
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007775	DF	On-Demand	Reactive	CCKAR	56	44
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007775	DF	On-Demand	Reactive	BRS3	25	42
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007775	DF	On-Demand	Reactive	NMBR	63	43
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007775	DF	On-Demand	Reactive	MMP2	22	41
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007775	DF	On-Demand	Reactive	ECE1	46	36
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007775	DF	On-Demand	Reactive	SSTR3	28	51
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007775	DF	On-Demand	Reactive	CCKBR	65	43
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007775	DF	On-Demand	Reactive	GHSR	45	40
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819007775	DF	On-Demand	Reactive	MMP9	20	41
CC(C)(C)OC(=O)N(CCNC[C@H](O)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000819007787	FF	On-Demand	Bother	CACNA1D	42	33
CC(C)(C)OC(=O)N(CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000819007789	FF	On-Demand	Bother	CACNA1D	42	33
C[C@H](CC(=O)NNC(=O)c1ccc(C(C)(C)C)cc1)n1cccn1	ZINC000819007823	EF	On-Demand	Reactive	MAP3K5	56	35
C[C@@H](CC(=O)NNC(=O)c1ccc(C(C)(C)C)cc1)n1cccn1	ZINC000819007826	EF	On-Demand	Reactive	MAP3K5	56	35
COCCCOc1cccc(N2C(=O)CN(Cc3ccccc3O)C2=O)c1	ZINC000819007829	FF	On-Demand	Clean	GALR3	41	32
COc1ccc(OC)c([C@H](O)CNCCCc2nc(C)no2)c1	ZINC000819007840	DD	On-Demand	Anodyne	ADRB2	19	43
CC(C)(C)OC(=O)N(CCNC[C@H](O)c1cccnc1)C1CC1	ZINC000819007845	DE	On-Demand	Anodyne	ADRB2	24	42
CC(C)(C)OC(=O)N(CCNC[C@H](O)c1cccnc1)C1CC1	ZINC000819007845	DE	On-Demand	Anodyne	ADRB1	33	42
CC(C)(C)OC(=O)N(CCNC[C@H](O)c1cccnc1)C1CC1	ZINC000819007845	DE	On-Demand	Anodyne	ADRB3	105	48
CC(C)(C)OC(=O)N(CCNC[C@@H](O)c1cccnc1)C1CC1	ZINC000819007846	DE	On-Demand	Anodyne	ADRB2	24	42
CC(C)(C)OC(=O)N(CCNC[C@@H](O)c1cccnc1)C1CC1	ZINC000819007846	DE	On-Demand	Anodyne	ADRB1	33	42
CC(C)(C)OC(=O)N(CCNC[C@@H](O)c1cccnc1)C1CC1	ZINC000819007846	DE	On-Demand	Anodyne	ADRB3	105	48
COc1ccc(CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819007859	GG	On-Demand	Mild	CTSB	28	42
COc1ccc(CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819007859	GG	On-Demand	Mild	PAPA1_CARPA	56	48
COc1ccc(CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819007859	GG	On-Demand	Mild	CTSK	16	42
COc1ccc(CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819007859	GG	On-Demand	Mild	CTSL	15	48
COc1ccc(CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819007864	GG	On-Demand	Mild	CTSB	28	42
COc1ccc(CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819007864	GG	On-Demand	Mild	PAPA1_CARPA	56	48
COc1ccc(CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819007864	GG	On-Demand	Mild	CTSK	16	42
COc1ccc(CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819007864	GG	On-Demand	Mild	CTSL	15	48
N#Cc1ccc(N2CCC(NC[C@@H](O)c3ccc(C(F)(F)F)cc3)CC2)nc1	ZINC000819007874	GG	On-Demand	Mild	ADRB3	17	41
N#Cc1ccc(N2CCC(NC[C@H](O)c3ccc(C(F)(F)F)cc3)CC2)nc1	ZINC000819007876	GG	On-Demand	Mild	ADRB3	17	41
COC(=O)c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819007877	GF	On-Demand	Mild	PAPA1_CARPA	52	48
COC(=O)c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819007877	GF	On-Demand	Mild	CCKAR	22	46
COC(=O)c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819007877	GF	On-Demand	Mild	CTSL	22	48
COC(=O)c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819007877	GF	On-Demand	Mild	CTSS	19	49
COC(=O)c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819007879	GF	On-Demand	Mild	PAPA1_CARPA	52	48
COC(=O)c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819007879	GF	On-Demand	Mild	CCKAR	22	46
COC(=O)c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819007879	GF	On-Demand	Mild	CTSL	22	48
COC(=O)c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819007879	GF	On-Demand	Mild	CTSS	19	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007884	ED	On-Demand	Anodyne	CMA1	19	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007884	ED	On-Demand	Anodyne	CTRA_BOVIN	16	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007884	ED	On-Demand	Anodyne	PAPA1_CARPA	43	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007884	ED	On-Demand	Anodyne	CTSK	32	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007884	ED	On-Demand	Anodyne	CTSL	32	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007884	ED	On-Demand	Anodyne	CTSS	23	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007884	ED	On-Demand	Anodyne	CAPN2	58	31
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007884	ED	On-Demand	Anodyne	KLK5	25	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007884	ED	On-Demand	Anodyne	FPR1	45	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC(=O)OCc1ccccc1	ZINC000819007884	ED	On-Demand	Anodyne	NPR	49	33
O[C@@H](CNCc1ccc2c(c1)OCCCO2)c1cccnc1	ZINC000819007886	DE	On-Demand	Anodyne	ADRB2	23	42
O[C@@H](CNCc1ccc2c(c1)OCCCO2)c1cccnc1	ZINC000819007886	DE	On-Demand	Anodyne	ADRB1	24	42
O[C@@H](CNCc1ccc2c(c1)OCCCO2)c1cccnc1	ZINC000819007886	DE	On-Demand	Anodyne	ADRB3	95	43
O[C@H](CNCc1ccc2c(c1)OCCCO2)c1cccnc1	ZINC000819007888	DE	On-Demand	Anodyne	ADRB2	23	42
O[C@H](CNCc1ccc2c(c1)OCCCO2)c1cccnc1	ZINC000819007888	DE	On-Demand	Anodyne	ADRB1	24	42
O[C@H](CNCc1ccc2c(c1)OCCCO2)c1cccnc1	ZINC000819007888	DE	On-Demand	Anodyne	ADRB3	95	43
CC(=O)Nc1cccc(CC(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)c1	ZINC000819007889	FF	On-Demand	Reactive	TRPV1	27	40
CC(=O)Nc1cccc(CC(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)c1	ZINC000819007889	FF	On-Demand	Reactive	NR1H4	19	58
CC(=O)Nc1cccc(CC(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)c1	ZINC000819007889	FF	On-Demand	Reactive	KCNK3	94	49
CC(=O)Nc1cccc(CC(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)c1	ZINC000819007889	FF	On-Demand	Reactive	KCNK9	56	35
CC[C@H](C)N(C)CCNC[C@@H](O)c1cccnc1	ZINC000819007891	CD	On-Demand	Anodyne	ADRB2	28	47
CC[C@H](C)N(C)CCNC[C@@H](O)c1cccnc1	ZINC000819007891	CD	On-Demand	Anodyne	ADRB1	32	47
CC[C@H](C)N(C)CCNC[C@@H](O)c1cccnc1	ZINC000819007891	CD	On-Demand	Anodyne	ADRB3	105	52
CC[C@H](C)N(C)CCNC[C@H](O)c1cccnc1	ZINC000819007893	CD	On-Demand	Anodyne	ADRB2	28	47
CC[C@H](C)N(C)CCNC[C@H](O)c1cccnc1	ZINC000819007893	CD	On-Demand	Anodyne	ADRB1	32	47
CC[C@H](C)N(C)CCNC[C@H](O)c1cccnc1	ZINC000819007893	CD	On-Demand	Anodyne	ADRB3	105	52
O=C(CSc1ccccc1[N+](=O)[O-])OCCOc1cccc(Cl)c1	ZINC000819007911	FH	On-Demand	Bother	PDS	49	38
C=C(Cl)CSc1nc(C)c(CC(=O)N(C)Cc2cccc(OC)c2)s1	ZINC000819007921	GJ	On-Demand	Mild	HSD17B2	23	45
Cc1ccccc1[C@@H](O)CNC1CCN(c2ccc(C#N)cn2)CC1	ZINC000819007951	EF	On-Demand	Mild	ADRB3	15	41
COc1cc2c(cc1OC)CN(C(=O)C(F)=C1CCC1)CC2	ZINC000819007969	DF	On-Demand	Anodyne	ABCB1	19	47
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC1CCN(c2ccc(C#N)cn2)CC1	ZINC000819007982	GD	On-Demand	Mild	GPR119	19	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNC1CCN(c2ccc(C#N)cn2)CC1	ZINC000819007983	GD	On-Demand	Mild	GPR119	19	41
N#Cc1ccc(N2CCC(NC[C@@H](O)c3cccc(F)c3)CC2)nc1	ZINC000819007996	EE	On-Demand	Mild	SCD1	15	42
N#Cc1ccc(N2CCC(NC[C@@H](O)c3cccc(F)c3)CC2)nc1	ZINC000819007996	EE	On-Demand	Mild	SCD	22	42
N#Cc1ccc(N2CCC(NC[C@H](O)c3cccc(F)c3)CC2)nc1	ZINC000819007998	EE	On-Demand	Mild	SCD1	15	42
N#Cc1ccc(N2CCC(NC[C@H](O)c3cccc(F)c3)CC2)nc1	ZINC000819007998	EE	On-Demand	Mild	SCD	22	42
CC(C)(C)OC(=O)N(CCNC[C@H](O)c1cccc(F)c1)C1CC1	ZINC000819008009	EF	On-Demand	Anodyne	ADRB1	30	42
CC(C)(C)OC(=O)N(CCNC[C@H](O)c1cccc(F)c1)C1CC1	ZINC000819008009	EF	On-Demand	Anodyne	ADRB3	45	42
CC(C)(C)OC(=O)N(CCNC[C@@H](O)c1cccc(F)c1)C1CC1	ZINC000819008010	EF	On-Demand	Anodyne	ADRB1	30	42
CC(C)(C)OC(=O)N(CCNC[C@@H](O)c1cccc(F)c1)C1CC1	ZINC000819008010	EF	On-Demand	Anodyne	ADRB3	45	42
N#Cc1ccc([C@@H](O)CNCc2ccc3c(c2)OCCCO3)cc1	ZINC000819008027	DF	On-Demand	Mild	GSK3A	17	43
N#Cc1ccc([C@H](O)CNCc2ccc3c(c2)OCCCO3)cc1	ZINC000819008031	DF	On-Demand	Mild	GSK3A	17	43
COCC(=O)N1CCc2cc(N3C(=O)CN(Cc4ccccc4O)C3=O)ccc21	ZINC000819008043	GD	On-Demand	Clean	EIF2AK3	41	32
N#Cc1ccc([C@@H](O)CNC2CCN(c3ccc(C#N)cn3)CC2)cc1	ZINC000819008048	EE	On-Demand	Mild	ADRB3	25	45
N#Cc1ccc([C@H](O)CNC2CCN(c3ccc(C#N)cn3)CC2)cc1	ZINC000819008051	EE	On-Demand	Mild	ADRB3	25	45
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819008067	GD	On-Demand	Reactive	TGM2	68	38
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819008067	GD	On-Demand	Reactive	F13A1	60	43
CC(C)(C)OC(=O)N(CCNCCS(=O)(=O)c1ccccc1)C1CC1	ZINC000819008078	FE	On-Demand	Anodyne	SFRP1	41	34
CON(C)C(=O)CCNCc1cccc(C(=O)NCCN(C)C)c1	ZINC000819008086	EC	On-Demand	Anodyne	DRD4	43	33
COC(=O)c1cccc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819008092	EE	On-Demand	Anodyne	KCNK3	50	34
CC[C@H](C)N(C)CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819008099	DF	On-Demand	Anodyne	ADRB2	18	42
CC[C@H](C)N(C)CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819008099	DF	On-Demand	Anodyne	ADRB1	15	42
CC[C@H](C)N(C)CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819008100	DF	On-Demand	Anodyne	ADRB2	18	42
CC[C@H](C)N(C)CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819008100	DF	On-Demand	Anodyne	ADRB1	15	42
CC[C@H](C)N(C)CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819008106	EF	On-Demand	Anodyne	ADRB3	18	42
CC[C@H](C)N(C)CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819008107	EF	On-Demand	Anodyne	ADRB3	18	42
O=C1N/C(=N/C2CCCC2)S/C1=C\c1ccc2c(c1)OC(F)(F)O2	ZINC000819008125	FH	On-Demand	Mild	HPGD	59	38
O=C1N/C(=N/C2CCCC2)S/C1=C/c1ccc2c(c1)OC(F)(F)O2	ZINC000819008126	FH	On-Demand	Mild	HPGD	59	38
N#Cc1ccc(N2CCC(NC[C@H](O)c3cccnc3)CC2)nc1	ZINC000819008131	DD	On-Demand	Mild	ADRB3	50	51
N#Cc1ccc(N2CCC(NC[C@H](O)c3cccnc3)CC2)nc1	ZINC000819008131	DD	On-Demand	Mild	SCD	21	40
N#Cc1ccc(N2CCC(NC[C@@H](O)c3cccnc3)CC2)nc1	ZINC000819008132	DD	On-Demand	Mild	ADRB3	50	51
N#Cc1ccc(N2CCC(NC[C@@H](O)c3cccnc3)CC2)nc1	ZINC000819008132	DD	On-Demand	Mild	SCD	21	40
N#Cc1ccc(N2CCC(NC[C@@H](O)c3ccc(F)cc3)CC2)nc1	ZINC000819008135	EE	On-Demand	Mild	ADRB3	21	40
N#Cc1ccc(N2CCC(NC[C@H](O)c3ccc(F)cc3)CC2)nc1	ZINC000819008136	EE	On-Demand	Mild	ADRB3	21	40
N#Cc1ccc(N2CCC(NC[C@H](O)c3cccc4ccccc34)CC2)nc1	ZINC000819008141	FG	On-Demand	Mild	ADRB3	17	40
N#Cc1ccc(N2CCC(NC[C@H](O)c3cccc4ccccc34)CC2)nc1	ZINC000819008141	FG	On-Demand	Mild	SMO	15	45
CN(C)CCCOc1ccc(N2C(=O)CN(Cc3ccccc3O)C2=O)cc1	ZINC000819008156	GF	On-Demand	Clean	ESRRG	45	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NNC(=O)Cc1c[nH]c3ccccc13)C2	ZINC000819008157	GD	On-Demand	Reactive	CCKAR	57	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NNC(=O)Cc1c[nH]c3ccccc13)C2	ZINC000819008157	GD	On-Demand	Reactive	NMBR	43	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NNC(=O)Cc1c[nH]c3ccccc13)C2	ZINC000819008157	GD	On-Demand	Reactive	CCKBR	76	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NNC(=O)Cc1c[nH]c3ccccc13)C2	ZINC000819008157	GD	On-Demand	Reactive	GHSR	49	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NNC(=O)Cc1c[nH]c3ccccc13)C2	ZINC000819008158	GD	On-Demand	Reactive	CCKAR	57	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NNC(=O)Cc1c[nH]c3ccccc13)C2	ZINC000819008158	GD	On-Demand	Reactive	NMBR	43	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NNC(=O)Cc1c[nH]c3ccccc13)C2	ZINC000819008158	GD	On-Demand	Reactive	CCKBR	76	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NNC(=O)Cc1c[nH]c3ccccc13)C2	ZINC000819008158	GD	On-Demand	Reactive	GHSR	49	34
CS(=O)(=O)c1ccc([C@H](O)CNCC2(c3ccc(Cl)cc3)CC2)cc1	ZINC000819008175	GG	On-Demand	Anodyne	PTGS2	15	42
CS(=O)(=O)c1ccc([C@@H](O)CNCC2(c3ccc(Cl)cc3)CC2)cc1	ZINC000819008176	GG	On-Demand	Anodyne	PTGS2	15	42
Cc1nc(N2CCOCC2)ccc1N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819008192	GD	On-Demand	Clean	PIK3CD	36	40
Cc1nc(N2CCOCC2)ccc1N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819008192	GD	On-Demand	Clean	PIK3CB	67	40
C=C(C)C(C)(C)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008206	CE	On-Demand	Reactive	EDNRB	18	40
C=C(C)C(C)(C)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008206	CE	On-Demand	Reactive	TACR1	26	41
C=C(C)C(C)(C)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008206	CE	On-Demand	Reactive	CCKAR	49	41
C=C(C)C(C)(C)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008206	CE	On-Demand	Reactive	BRS3	25	44
C=C(C)C(C)(C)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008206	CE	On-Demand	Reactive	NMBR	85	35
C=C(C)C(C)(C)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008206	CE	On-Demand	Reactive	GRPR	52	34
C=C(C)C(C)(C)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008206	CE	On-Demand	Reactive	ECE1	45	39
C=C(C)C(C)(C)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008206	CE	On-Demand	Reactive	MMP11	40	31
C=C(C)C(C)(C)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008206	CE	On-Demand	Reactive	CCKBR	71	39
C=C(C)C(C)(C)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008206	CE	On-Demand	Reactive	GHSR	47	43
C=C(C)C(C)(C)C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008206	CE	On-Demand	Reactive	MMP9	19	43
CC[C@H](C)N(C)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819008268	CF	On-Demand	Anodyne	ADRB2	48	40
CC[C@H](C)N(C)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819008268	CF	On-Demand	Anodyne	ADRB1	54	48
CC[C@H](C)N(C)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819008268	CF	On-Demand	Anodyne	ADRB3	66	50
CC[C@H](C)N(C)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819008269	CF	On-Demand	Anodyne	ADRB2	48	40
CC[C@H](C)N(C)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819008269	CF	On-Demand	Anodyne	ADRB1	54	48
CC[C@H](C)N(C)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819008269	CF	On-Demand	Anodyne	ADRB3	66	50
CON(C)C(=O)CCNC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000819008273	ED	On-Demand	Anodyne	L3MBTL3	64	39
O=C(CCc1cccc(OC(F)F)c1)NNC(=O)c1cc2c(s1)CCC2	ZINC000819008282	GG	On-Demand	Reactive	VIPR1	22	40
O=C(OCc1ccccc1)c1cccc(CNC[C@H](O)C(F)(F)F)c1	ZINC000819008284	FG	On-Demand	Anodyne	CTSD	16	41
O=C(OCc1ccccc1)c1cccc(CNC[C@H](O)C(F)(F)F)c1	ZINC000819008284	FG	On-Demand	Anodyne	BACE1	25	41
O=C(OCc1ccccc1)c1cccc(CNC[C@@H](O)C(F)(F)F)c1	ZINC000819008285	FG	On-Demand	Anodyne	CTSD	16	41
O=C(OCc1ccccc1)c1cccc(CNC[C@@H](O)C(F)(F)F)c1	ZINC000819008285	FG	On-Demand	Anodyne	BACE1	25	41
CC(C)n1nc(C(=O)NNC(=O)/C=C\[C@H]2CCCO2)c2ccccc2c1=O	ZINC000819008300	FD	On-Demand	Reactive	HTR4	22	41
CC(C)n1nc(C(=O)NNC(=O)/C=C/[C@@H]2CCCO2)c2ccccc2c1=O	ZINC000819008301	FD	On-Demand	Reactive	HTR4	22	41
CC(C)n1nc(C(=O)NNC(=O)/C=C/[C@H]2CCCO2)c2ccccc2c1=O	ZINC000819008302	FD	On-Demand	Reactive	HTR4	22	41
CC(C)n1nc(C(=O)NNC(=O)/C=C\[C@@H]2CCCO2)c2ccccc2c1=O	ZINC000819008303	FD	On-Demand	Reactive	HTR4	22	41
CC[C@H](C)N(C)CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819008306	CD	On-Demand	Bother	ADRB3	41	36
CC[C@H](C)N(C)CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819008307	CD	On-Demand	Bother	ADRB3	41	36
N#Cc1ccc(N2CCC(NC[C@H](O)c3ccccc3Cl)CC2)nc1	ZINC000819008347	FF	On-Demand	Mild	OPRL1	19	44
N#Cc1ccc(N2CCC(NC[C@H](O)c3ccccc3Cl)CC2)nc1	ZINC000819008347	FF	On-Demand	Mild	ADRB3	16	40
N#Cc1ccc(N2CCC(NC[C@@H](O)c3ccc([N+](=O)[O-])cc3)CC2)nc1	ZINC000819008349	FE	On-Demand	Mild	ADRB3	18	42
N#Cc1ccc(N2CCC(NC[C@H](O)c3ccc([N+](=O)[O-])cc3)CC2)nc1	ZINC000819008350	FE	On-Demand	Mild	ADRB3	18	42
N#Cc1ccc(N2CCC(NC[C@@H](O)c3cccc(Cl)c3)CC2)nc1	ZINC000819008383	FF	On-Demand	Mild	ADRB2	18	41
N#Cc1ccc(N2CCC(NC[C@@H](O)c3cccc(Cl)c3)CC2)nc1	ZINC000819008383	FF	On-Demand	Mild	ADRB1	40	44
N#Cc1ccc(N2CCC(NC[C@@H](O)c3cccc(Cl)c3)CC2)nc1	ZINC000819008383	FF	On-Demand	Mild	ADRB3	62	44
N#Cc1ccc(N2CCC(NC[C@@H](O)c3cccc(Cl)c3)CC2)nc1	ZINC000819008383	FF	On-Demand	Mild	IGF1R	28	40
N#Cc1ccc(N2CCC(NC[C@@H](O)c3cccc(Cl)c3)CC2)nc1	ZINC000819008383	FF	On-Demand	Mild	CYP3A4	50	40
N#Cc1ccc(N2CCC(NC[C@H](O)c3cccc(Cl)c3)CC2)nc1	ZINC000819008384	FF	On-Demand	Mild	ADRB2	18	41
N#Cc1ccc(N2CCC(NC[C@H](O)c3cccc(Cl)c3)CC2)nc1	ZINC000819008384	FF	On-Demand	Mild	ADRB1	40	44
N#Cc1ccc(N2CCC(NC[C@H](O)c3cccc(Cl)c3)CC2)nc1	ZINC000819008384	FF	On-Demand	Mild	ADRB3	62	44
N#Cc1ccc(N2CCC(NC[C@H](O)c3cccc(Cl)c3)CC2)nc1	ZINC000819008384	FF	On-Demand	Mild	IGF1R	28	40
N#Cc1ccc(N2CCC(NC[C@H](O)c3cccc(Cl)c3)CC2)nc1	ZINC000819008384	FF	On-Demand	Mild	CYP3A4	50	40
N#Cc1ccc(N2CCC(NC[C@H](O)c3ccc(Cl)cc3)CC2)nc1	ZINC000819008421	FF	On-Demand	Mild	ADRB3	28	40
CC[C@@H](O)CNCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000819008426	DF	On-Demand	Anodyne	CTSB	56	40
CC[C@@H](O)CNCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000819008426	DF	On-Demand	Anodyne	CAPNS1	51	31
CC[C@@H](O)CNCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000819008426	DF	On-Demand	Anodyne	CAPN1	59	38
CC[C@@H](O)CNCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000819008426	DF	On-Demand	Anodyne	CAPN2	100	37
CC[C@@H](O)CNCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000819008426	DF	On-Demand	Anodyne	BACE1	36	40
CC[C@@H](O)CNCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000819008426	DF	On-Demand	Anodyne	NPR	45	35
CC[C@@H](O)CNCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000819008426	DF	On-Demand	Anodyne	PDS	74	43
CC[C@H](O)CNCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000819008430	DF	On-Demand	Anodyne	CTSB	56	40
CC[C@H](O)CNCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000819008430	DF	On-Demand	Anodyne	CAPNS1	51	31
CC[C@H](O)CNCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000819008430	DF	On-Demand	Anodyne	CAPN1	59	38
CC[C@H](O)CNCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000819008430	DF	On-Demand	Anodyne	CAPN2	100	37
CC[C@H](O)CNCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000819008430	DF	On-Demand	Anodyne	BACE1	36	40
CC[C@H](O)CNCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000819008430	DF	On-Demand	Anodyne	NPR	45	35
CC[C@H](O)CNCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000819008430	DF	On-Demand	Anodyne	PDS	74	43
O=C(C(F)=C1CCC1)N1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1	ZINC000819008444	FF	On-Demand	Anodyne	AKR1C3	58	45
CC(C)(C)OC(=O)N(CCNC[C@@H](O)Cc1ccc(F)cc1)C1CC1	ZINC000819008454	FF	On-Demand	Anodyne	PAPA1_CARPA	18	41
CC(C)(C)OC(=O)N(CCNC[C@H](O)Cc1ccc(F)cc1)C1CC1	ZINC000819008455	FF	On-Demand	Anodyne	PAPA1_CARPA	18	41
O[C@@H](CNCC1(c2ccc(Cl)cc2)CC1)c1ccccc1	ZINC000819008461	DH	On-Demand	Anodyne	CCR1	15	40
O[C@H](CNCC1(c2ccc(Cl)cc2)CC1)c1ccccc1	ZINC000819008462	DH	On-Demand	Anodyne	CCR1	15	40
O=C(NCc1cccc(C(F)(F)F)c1)C(F)=C1CCC1	ZINC000819008481	CH	On-Demand	Anodyne	TACR1	18	40
O=C(NCc1cccc(C(F)(F)F)c1)C(F)=C1CCC1	ZINC000819008481	CH	On-Demand	Anodyne	CCR2	51	39
O=C(NCc1cccc(C(F)(F)F)c1)C(F)=C1CCC1	ZINC000819008481	CH	On-Demand	Anodyne	PDS	53	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cc(Cl)c(OC)cc1OC)C2	ZINC000819008515	GG	On-Demand	Anodyne	HTR4	25	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cc(Cl)c(OC)cc1OC)C2	ZINC000819008517	GG	On-Demand	Anodyne	HTR4	25	41
C=CCC1(C(=O)NCC(=O)OCc2ccccc2)CCOCC1	ZINC000819008527	DE	On-Demand	Mild	SLC12A5	51	32
CC[C@H](C)N(C)CCNC[C@@H](O)c1ccc(C)cc1	ZINC000819008532	CE	On-Demand	Anodyne	ADRB2	15	50
CC[C@H](C)N(C)CCNC[C@H](O)c1ccc(C)cc1	ZINC000819008534	CE	On-Demand	Anodyne	ADRB2	15	50
O=C(OCc1ccccc1)c1cccc(CNCC2(O)CCC2)c1	ZINC000819008539	EG	On-Demand	Anodyne	SLC12A5	67	36
C=CCC1(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CCOCC1	ZINC000819008541	GE	On-Demand	Reactive	HTR4	20	41
C=CCCn1cc(C(=O)NNC(=O)c2ccc(C(C)(C)C)cc2)nn1	ZINC000819008571	EE	On-Demand	Reactive	MAP3K5	45	34
O[C@@H](CNCC1(c2cccc(C(F)(F)F)c2)CC1)c1ccccc1	ZINC000819008642	EI	On-Demand	Anodyne	TACR1	26	44
O[C@H](CNCC1(c2cccc(C(F)(F)F)c2)CC1)c1ccccc1	ZINC000819008643	EI	On-Demand	Anodyne	TACR1	26	44
O=C(/C=C/[C@@H]1CCCO1)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008644	DD	On-Demand	Reactive	CCKAR	27	40
O=C(/C=C/[C@@H]1CCCO1)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008644	DD	On-Demand	Reactive	CCKBR	40	36
O=C(/C=C\[C@H]1CCCO1)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008645	DD	On-Demand	Reactive	CCKAR	27	40
O=C(/C=C\[C@H]1CCCO1)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008645	DD	On-Demand	Reactive	CCKBR	40	36
O=C(/C=C/[C@H]1CCCO1)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008646	DD	On-Demand	Reactive	CCKAR	27	40
O=C(/C=C/[C@H]1CCCO1)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008646	DD	On-Demand	Reactive	CCKBR	40	36
O=C(/C=C\[C@@H]1CCCO1)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008647	DD	On-Demand	Reactive	CCKAR	27	40
O=C(/C=C\[C@@H]1CCCO1)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008647	DD	On-Demand	Reactive	CCKBR	40	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008669	FD	On-Demand	Reactive	SSTR2	62	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008669	FD	On-Demand	Reactive	TACR1	27	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008669	FD	On-Demand	Reactive	CCKAR	108	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008669	FD	On-Demand	Reactive	CTSL	19	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008669	FD	On-Demand	Reactive	NMBR	82	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008669	FD	On-Demand	Reactive	GRPR	40	31
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008669	FD	On-Demand	Reactive	ECE1	37	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008669	FD	On-Demand	Reactive	SSTR3	19	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008669	FD	On-Demand	Reactive	CCKBR	93	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008669	FD	On-Demand	Reactive	GHSR	41	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819008669	FD	On-Demand	Reactive	FPR1	19	44
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819008678	FD	On-Demand	Reactive	CA2	34	54
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819008678	FD	On-Demand	Reactive	CA6	24	44
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819008678	FD	On-Demand	Reactive	CA1	25	54
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819008678	FD	On-Demand	Reactive	CA7	25	44
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819008678	FD	On-Demand	Reactive	CA13	40	44
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819008678	FD	On-Demand	Reactive	CA4	27	54
O=C(COc1ccc(F)cc1)NNC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819008679	GF	On-Demand	Reactive	TRAR	29	40
N#Cc1ccc(N2CCC(NC[C@@H](O)c3ccccc3)CC2)nc1	ZINC000819008690	DE	On-Demand	Mild	ADRB2	18	42
N#Cc1ccc(N2CCC(NC[C@@H](O)c3ccccc3)CC2)nc1	ZINC000819008690	DE	On-Demand	Mild	ADRB1	21	42
N#Cc1ccc(N2CCC(NC[C@@H](O)c3ccccc3)CC2)nc1	ZINC000819008690	DE	On-Demand	Mild	ADRB3	34	42
N#Cc1ccc(N2CCC(NC[C@@H](O)c3ccccc3)CC2)nc1	ZINC000819008690	DE	On-Demand	Mild	SCD1	17	43
N#Cc1ccc(N2CCC(NC[C@H](O)c3ccccc3)CC2)nc1	ZINC000819008691	DE	On-Demand	Mild	ADRB2	18	42
N#Cc1ccc(N2CCC(NC[C@H](O)c3ccccc3)CC2)nc1	ZINC000819008691	DE	On-Demand	Mild	ADRB1	21	42
N#Cc1ccc(N2CCC(NC[C@H](O)c3ccccc3)CC2)nc1	ZINC000819008691	DE	On-Demand	Mild	ADRB3	34	42
N#Cc1ccc(N2CCC(NC[C@H](O)c3ccccc3)CC2)nc1	ZINC000819008691	DE	On-Demand	Mild	SCD1	17	43
CC(=O)Nc1cccc(CC(=O)NNC(=O)C(C)C)c1	ZINC000819008981	CC	On-Demand	Reactive	KCNK3	51	34
O=C(CCCc1ccsc1)N1CC(C2CCCCC2)C1	ZINC000819009039	CI	On-Demand	Anodyne	PREP	29	40
CC(=O)N(c1ccc(NC(=O)[C@H]2Cc3ccccc3CN2C(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819009046	IJ	On-Demand	Anodyne	OPRD1	52	36
CC(=O)N(c1ccc(NC(=O)[C@H]2Cc3ccccc3CN2C(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819009046	IJ	On-Demand	Anodyne	HDAC8	18	50
CC(=O)N(c1ccc(NC(=O)[C@H]2Cc3ccccc3CN2C(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819009046	IJ	On-Demand	Anodyne	CFTR	82	48
CC(=O)N(c1ccc(NC(=O)[C@H]2Cc3ccccc3CN2C(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819009046	IJ	On-Demand	Anodyne	ADAM9	41	33
CC(C)(C)OC(=O)N1CCC[C@@H]1CCC(=O)N1CC(C2CCCCC2)C1	ZINC000819009051	FI	On-Demand	Anodyne	PREP	16	44
CC(C)(C)OC(=O)N1CCC[C@H]1CCC(=O)N1CC(C2CCCCC2)C1	ZINC000819009052	FI	On-Demand	Anodyne	PREP	16	44
O=C(c1cccnc1)N1CCC(C(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819009056	FF	On-Demand	Anodyne	SLC18A3	15	48
O=C(c1cccnc1)N1CCC(C(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819009056	FF	On-Demand	Anodyne	L3MBTL3	84	40
O=C(c1cccnc1)N1CCC(C(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819009056	FF	On-Demand	Anodyne	NAMPT	19	43
CC(=O)N(c1ccc(NC(=O)c2cccc(F)n2)cc1)C1CC1	ZINC000819009063	DF	On-Demand	Anodyne	GRM4	28	45
O=C(c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1)N1CC(C2CCCCC2)C1	ZINC000819009064	HH	On-Demand	Anodyne	L3MBTL3	41	41
CC(=O)N(c1ccc(NC(=O)c2c(Cl)ccc(Cl)c2Cl)cc1)C1CC1	ZINC000819009067	GK	On-Demand	Anodyne	TYK2	57	38
O=C(c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)N1CC(C2CCCCC2)C1	ZINC000819009071	HH	On-Demand	Anodyne	CNR2	19	67
O=C(c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)N1CC(C2CCCCC2)C1	ZINC000819009071	HH	On-Demand	Anodyne	EPHX2	25	44
O=C(c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)N1CC(C2CCCCC2)C1	ZINC000819009071	HH	On-Demand	Anodyne	L3MBTL3	71	43
CC(C)(C)OC(=O)N1CCC(SCC(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819009076	GI	On-Demand	Anodyne	GPR119	30	44
CCCNC(=O)c1cccc(N2C(=O)CN(Cc3ccccc3O)C2=O)c1	ZINC000819009092	FF	On-Demand	Clean	DRD4	41	32
O=C(c1cccc(N2C(=O)CN(Cc3ccccc3O)C2=O)c1)N1CCCCC1	ZINC000819009112	GF	On-Demand	Clean	HPGD	43	43
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccc(CC)cc1	ZINC000819009116	CF	On-Demand	Reactive	ECR	28	44
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccc(CC)cc1	ZINC000819009116	CF	On-Demand	Reactive	E3UJZ5_SPOLI	26	44
COc1cccc([C@H](O)C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)c1	ZINC000819009121	FF	On-Demand	Anodyne	MTNR1A	24	48
COc1cccc([C@H](O)C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)c1	ZINC000819009121	FF	On-Demand	Anodyne	MTNR1B	30	48
O=C([C@@H](F)Cc1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819009129	CH	On-Demand	Anodyne	ACE	80	43
O=C([C@@H](F)Cc1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819009129	CH	On-Demand	Anodyne	MME	59	43
O=C([C@H](F)Cc1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819009130	CH	On-Demand	Anodyne	ACE	80	43
O=C([C@H](F)Cc1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819009130	CH	On-Demand	Anodyne	MME	59	43
O=C(c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)N1CC(C2CCCCC2)C1	ZINC000819009144	HE	On-Demand	Anodyne	CNR2	20	67
O=C(c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)N1CC(C2CCCCC2)C1	ZINC000819009144	HE	On-Demand	Anodyne	L3MBTL3	42	38
CC(C)(C)OC(=O)N1CCC(C(=O)N2CC(C3CCCCC3)C2)(n2cccn2)CC1	ZINC000819009154	HH	On-Demand	Anodyne	GPR119	18	44
CC(=O)c1ccc(OC[C@@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009192	EF	On-Demand	Anodyne	ADRB2	53	47
CC(=O)c1ccc(OC[C@@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009192	EF	On-Demand	Anodyne	ADRB1	86	47
CC(=O)c1ccc(OC[C@@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009192	EF	On-Demand	Anodyne	ADRB3	52	47
CC(=O)c1ccc(OC[C@@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009192	EF	On-Demand	Anodyne	ABCB1	18	62
CC(=O)c1ccc(OC[C@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009193	EF	On-Demand	Anodyne	ADRB2	53	47
CC(=O)c1ccc(OC[C@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009193	EF	On-Demand	Anodyne	ADRB1	86	47
CC(=O)c1ccc(OC[C@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009193	EF	On-Demand	Anodyne	ADRB3	52	47
CC(=O)c1ccc(OC[C@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009193	EF	On-Demand	Anodyne	ABCB1	18	62
CC(=O)N1CCc2cc(N3C(=O)CN(Cc4ccccc4O)C3=O)ccc21	ZINC000819009220	FE	On-Demand	Clean	HSD17B3	52	37
CC(=O)N(c1ccc(NC(=O)c2ccc(-c3nnc(S)o3)cc2)cc1)C1CC1	ZINC000819009224	GH	On-Demand	Anodyne	PRNP	45	37
CC(=O)N(c1ccc(NC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)cc1)C1CC1	ZINC000819009235	IE	On-Demand	Anodyne	KCNA3	31	46
C#CCNS(=O)(=O)c1cccc(C(=O)N2CC(C3CCCCC3)C2)c1	ZINC000819009238	FE	On-Demand	Mild	AKR1C3	46	35
C#CCNS(=O)(=O)c1cccc(C(=O)N2CC(C3CCCCC3)C2)c1	ZINC000819009238	FE	On-Demand	Mild	SFRP1	56	36
O=C(COc1ccc(C2SCCCS2)cc1)N1CC(C2CCCCC2)C1	ZINC000819009247	GJ	On-Demand	Anodyne	CPT1A	45	33
CCC(=O)c1cc(C(=O)N2CC(C3CCCCC3)C2)ccc1F	ZINC000819009249	DI	On-Demand	Anodyne	L3MBTL3	60	38
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	ACE	15	41
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	CELA1	19	40
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	ELANE	41	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	LTA4H	15	42
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	CTRA_BOVIN	21	48
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	CASP3	29	49
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	BMP1	20	43
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	KLK3	74	37
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	CTSB	72	49
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	PAPA1_CARPA	83	43
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	CYSP_TRYCR	47	38
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	CTSK	43	48
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	CTSL	47	48
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	PGA	27	47
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	TIMP3	56	36
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	CAPNS1	69	40
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	HLA-DRB1	41	36
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	CTSS	24	48
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	CAPN1	91	49
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	CASP1	36	49
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	CAPN2	140	49
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	PLAU	27	42
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	CASP6	24	49
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	CASP9	50	49
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	NPR	75	42
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	CASP10	36	40
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	PSMB5	46	39
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)C1CC1	ZINC000819009253	HI	On-Demand	Anodyne	Q6PRC7_IXORI	28	42
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)C(C)(C)C)cc1)C1CC1	ZINC000819009263	GI	On-Demand	Anodyne	AVPR2	17	40
CC(=O)N(c1ccc(NC(=O)c2cc3ccccc3cc2NC(=O)C2CC2)cc1)C1CC1	ZINC000819009274	IJ	On-Demand	Anodyne	NR2E3	65	42
O=C(/C=C/c1ccc(O)cc1)N1CC(C2CCCCC2)C1	ZINC000819009280	CG	On-Demand	Anodyne	F3	25	45
O=C(/C=C\c1ccc(O)cc1)N1CC(C2CCCCC2)C1	ZINC000819009281	CG	On-Demand	Anodyne	F3	25	45
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)cc1)C1CC1	ZINC000819009282	HH	On-Demand	Anodyne	CPT1A	60	37
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)cc1)C1CC1	ZINC000819009282	HH	On-Demand	Anodyne	CPT2	42	35
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)cc1)C1CC1	ZINC000819009282	HH	On-Demand	Anodyne	CPT1B	40	34
CC(=O)N(c1ccc(NC(=O)c2cc3ccccc3cc2NC(=O)C(C)C)cc1)C1CC1	ZINC000819009284	IK	On-Demand	Anodyne	PYGL	40	40
O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CC(C2CCCCC2)C1	ZINC000819009285	FI	On-Demand	Bother	SLC6A9	21	58
C#CCOc1ccc(C(=O)N2CC(C3CCCCC3)C2)cc1	ZINC000819009288	CG	On-Demand	Mild	L3MBTL3	66	46
CC(C)(C)OC(=O)N1CCC(CC(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819009303	FI	On-Demand	Anodyne	GPR119	34	43
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1CC(C2CCCCC2)C1	ZINC000819009308	GF	On-Demand	Anodyne	F2	26	47
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1CC(C2CCCCC2)C1	ZINC000819009308	GF	On-Demand	Anodyne	PREP	26	50
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1CC(C2CCCCC2)C1	ZINC000819009308	GF	On-Demand	Anodyne	LGMN	54	34
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1CC(C2CCCCC2)C1	ZINC000819009312	GF	On-Demand	Anodyne	F2	26	47
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1CC(C2CCCCC2)C1	ZINC000819009312	GF	On-Demand	Anodyne	PREP	26	50
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1CC(C2CCCCC2)C1	ZINC000819009312	GF	On-Demand	Anodyne	LGMN	54	34
O=C(c1cc(-c2ccccn2)nc2ccccc12)N1CC(C2CCCCC2)C1	ZINC000819009314	FJ	On-Demand	Anodyne	METAP1	49	42
CC(=O)Nc1ccc(OC[C@@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009331	EF	On-Demand	Anodyne	ADRB2	58	62
CC(=O)Nc1ccc(OC[C@@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009331	EF	On-Demand	Anodyne	ADRB1	99	62
CC(=O)Nc1ccc(OC[C@@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009331	EF	On-Demand	Anodyne	GRIN1	22	44
CC(=O)Nc1ccc(OC[C@@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009331	EF	On-Demand	Anodyne	ADRB3	62	62
CC(=O)Nc1ccc(OC[C@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009332	EF	On-Demand	Anodyne	ADRB2	58	62
CC(=O)Nc1ccc(OC[C@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009332	EF	On-Demand	Anodyne	ADRB1	99	62
CC(=O)Nc1ccc(OC[C@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009332	EF	On-Demand	Anodyne	GRIN1	22	44
CC(=O)Nc1ccc(OC[C@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009332	EF	On-Demand	Anodyne	ADRB3	62	62
O=C(c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O)N1CC(C2CCCCC2)C1	ZINC000819009338	GF	On-Demand	Anodyne	L3MBTL3	41	36
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)N2CC(C3CCCCC3)C2)cc1	ZINC000819009367	HF	On-Demand	Anodyne	PREP	59	42
C[C@@H](OC[C@@H](O)CNCCSC(C)(C)C)c1ccc(Cl)cc1	ZINC000819009393	EH	On-Demand	Anodyne	CASR	22	43
C[C@@H](OC[C@H](O)CNCCSC(C)(C)C)c1ccc(Cl)cc1	ZINC000819009394	EH	On-Demand	Anodyne	CASR	22	43
COc1cccc([S@@](=O)CC(=O)NNC(=O)C(C)C)c1	ZINC000819009398	CC	On-Demand	Reactive	MTNR1A	42	43
COc1cccc([S@@](=O)CC(=O)NNC(=O)C(C)C)c1	ZINC000819009398	CC	On-Demand	Reactive	MTNR1B	40	44
CC(=O)N1CCCc2cc(N3C(=O)CN(Cc4ccccc4O)C3=O)ccc21	ZINC000819009414	GF	On-Demand	Clean	HSD17B3	49	36
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)N2CC(C3CCCCC3)C2)cc1	ZINC000819009423	HF	On-Demand	Anodyne	PREP	59	42
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)N2CC(C3CCCCC3)C2)cc1	ZINC000819009424	HF	On-Demand	Anodyne	PREP	59	42
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)N2CC(C3CCCCC3)C2)cc1	ZINC000819009425	HF	On-Demand	Anodyne	PREP	59	42
O=C(c1ccc(-n2ccc(C(F)(F)F)n2)cc1)N1CC(C2CCCCC2)C1	ZINC000819009433	GJ	On-Demand	Anodyne	L3MBTL3	32	40
CC(=O)N(c1ccc(NC(=O)[C@H](C)c2ccc(C(F)(F)F)cc2)cc1)C1CC1	ZINC000819009434	GJ	On-Demand	Anodyne	EPHX2	24	42
CC(=O)N(c1ccc(NC(=O)[C@@H](C)c2ccc(C(F)(F)F)cc2)cc1)C1CC1	ZINC000819009435	GJ	On-Demand	Anodyne	EPHX2	24	42
O=C(Nc1ccc(C(=O)N2CC(C3CCCCC3)C2)cc1)OCC(F)(F)F	ZINC000819009447	GI	On-Demand	Anodyne	L3MBTL3	40	40
CC(=O)N(c1ccc(NC(=O)c2ccc(C(N)=S)cc2)cc1)C1CC1	ZINC000819009448	FG	On-Demand	Anodyne	PPO2	23	47
O=C([C@H]1CC(c2ccccc2)=NO1)N1CC(C2CCCCC2)C1	ZINC000819009464	DG	On-Demand	Anodyne	LUCI_PHOPY	46	37
O=C([C@@H]1CC(c2ccccc2)=NO1)N1CC(C2CCCCC2)C1	ZINC000819009465	DG	On-Demand	Anodyne	LUCI_PHOPY	46	37
CN(CCC(=O)N1CC(C2CCCCC2)C1)C(=O)OCc1ccccc1	ZINC000819009477	FH	On-Demand	Anodyne	ACE	23	40
CN(CCC(=O)N1CC(C2CCCCC2)C1)C(=O)OCc1ccccc1	ZINC000819009477	FH	On-Demand	Anodyne	CTSK	17	44
CN(CCC(=O)N1CC(C2CCCCC2)C1)C(=O)OCc1ccccc1	ZINC000819009477	FH	On-Demand	Anodyne	CCR5	22	41
CN(CCC(=O)N1CC(C2CCCCC2)C1)C(=O)OCc1ccccc1	ZINC000819009477	FH	On-Demand	Anodyne	PREP	47	38
CN(CCC(=O)N1CC(C2CCCCC2)C1)C(=O)OCc1ccccc1	ZINC000819009477	FH	On-Demand	Anodyne	AMY2	48	34
CN(CCC(=O)N1CC(C2CCCCC2)C1)C(=O)OCc1ccccc1	ZINC000819009477	FH	On-Demand	Anodyne	NPR	49	32
CN(CCC(=O)N1CC(C2CCCCC2)C1)C(=O)OCc1ccccc1	ZINC000819009477	FH	On-Demand	Anodyne	SLC12A5	67	38
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC(C3CCCCC3)C2)C(F)(F)C1	ZINC000819009551	GH	On-Demand	Anodyne	GPR119	22	41
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC(C3CCCCC3)C2)C(F)(F)C1	ZINC000819009553	GH	On-Demand	Anodyne	GPR119	22	41
O=C(/C=C\c1ccc2c(c1)OCO2)N1CC(C2CCCCC2)C1	ZINC000819009569	DG	On-Demand	Anodyne	ITGAL	24	42
O=C(/C=C\c1ccc2c(c1)OCO2)N1CC(C2CCCCC2)C1	ZINC000819009569	DG	On-Demand	Anodyne	DYRK2	53	35
O=C(/C=C/c1ccc2c(c1)OCO2)N1CC(C2CCCCC2)C1	ZINC000819009573	DG	On-Demand	Anodyne	ITGAL	24	42
O=C(/C=C/c1ccc2c(c1)OCO2)N1CC(C2CCCCC2)C1	ZINC000819009573	DG	On-Demand	Anodyne	DYRK2	53	35
CC(=O)N(c1ccc(NC(=O)/C(C#N)=C/c2ccc(F)cc2)cc1)C1CC1	ZINC000819009722	FH	On-Demand	Reactive	CA12	16	44
CC(=O)N(c1ccc(NC(=O)/C(C#N)=C\c2ccc(F)cc2)cc1)C1CC1	ZINC000819009723	FH	On-Demand	Reactive	CA12	16	44
CC(=O)N(c1ccc(NC(=O)COc2cccc(C#N)c2)cc1)C1CC1	ZINC000819009725	EG	On-Demand	Mild	ADORA2B	38	41
CC(=O)N(c1ccc(NC(=O)COc2cccc(C#N)c2)cc1)C1CC1	ZINC000819009725	EG	On-Demand	Mild	MCHR1	47	46
CC(=O)N(c1ccc(NC(=O)COc2cccc(C#N)c2)cc1)C1CC1	ZINC000819009725	EG	On-Demand	Mild	ETHR	15	51
CC(=O)N(c1ccc(NC(=O)COc2cccc(C#N)c2)cc1)C1CC1	ZINC000819009725	EG	On-Demand	Mild	PFKFB3	55	36
O=C([C@H](O)c1ccccc1Cl)N1CC(C2CCCCC2)C1	ZINC000819009726	DG	On-Demand	Anodyne	OPRL1	34	44
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)ccc1F	ZINC000819009739	IH	On-Demand	Anodyne	CPT1A	52	35
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)ccc1F	ZINC000819009739	IH	On-Demand	Anodyne	CPT1B	46	33
CCCCCCC(=O)N1CC(C2CCCCC2)C1	ZINC000819009740	CH	On-Demand	Anodyne	LASR	40	33
CCCCCCC(=O)N1CC(C2CCCCC2)C1	ZINC000819009740	CH	On-Demand	Anodyne	CQSS	55	35
O=C(c1ccc(N2CCOCC2)nc1)N1CC(C2CCCCC2)C1	ZINC000819009743	EF	On-Demand	Anodyne	ADK	18	40
O=C(c1ccc(N2CCOCC2)nc1)N1CC(C2CCCCC2)C1	ZINC000819009743	EF	On-Demand	Anodyne	HPGDS	15	46
O=C(c1ccc(N2CCOCC2)nc1)N1CC(C2CCCCC2)C1	ZINC000819009743	EF	On-Demand	Anodyne	L3MBTL3	40	40
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819009745	DJ	On-Demand	Mild	HDAC10	28	44
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819009745	DJ	On-Demand	Mild	HDAC2	20	44
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819009745	DJ	On-Demand	Mild	HDAC3	24	43
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819009745	DJ	On-Demand	Mild	HDAC6	22	40
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819009745	DJ	On-Demand	Mild	HDAC11	15	44
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819009745	DJ	On-Demand	Mild	ENPP2	36	50
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819009745	DJ	On-Demand	Mild	LUXR	30	40
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819009745	DJ	On-Demand	Mild	LASR	61	40
O=C1CCCCN1Cc1ccc(C(=O)N2CC(C3CCCCC3)C2)cc1	ZINC000819009749	FH	On-Demand	Anodyne	L3MBTL3	76	47
CC(=O)N(c1ccc(NC(=O)C[C@@H](O)c2ccc(OCc3ccccc3)cc2)cc1)C1CC1	ZINC000819009752	IJ	On-Demand	Anodyne	TSHR	43	32
CC(=O)N(c1ccc(NC(=O)C[C@@H](O)c2ccc(OCc3ccccc3)cc2)cc1)C1CC1	ZINC000819009752	IJ	On-Demand	Anodyne	LTA4H	42	51
CC(=O)N(c1ccc(NC(=O)C[C@@H](O)c2ccc(OCc3ccccc3)cc2)cc1)C1CC1	ZINC000819009752	IJ	On-Demand	Anodyne	ADAM17	20	46
CC(=O)N(c1ccc(NC(=O)C[C@H](O)c2ccc(OCc3ccccc3)cc2)cc1)C1CC1	ZINC000819009753	IJ	On-Demand	Anodyne	TSHR	43	32
CC(=O)N(c1ccc(NC(=O)C[C@H](O)c2ccc(OCc3ccccc3)cc2)cc1)C1CC1	ZINC000819009753	IJ	On-Demand	Anodyne	LTA4H	42	51
CC(=O)N(c1ccc(NC(=O)C[C@H](O)c2ccc(OCc3ccccc3)cc2)cc1)C1CC1	ZINC000819009753	IJ	On-Demand	Anodyne	ADAM17	20	46
O=C(C1CCN(S(=O)(=O)c2cccnc2Cl)CC1)N1CC(C2CCCCC2)C1	ZINC000819009754	IG	On-Demand	Anodyne	EPHX2	29	44
CC(=O)N(c1ccc(NC(=O)CCCCCC(C)C)cc1)C1CC1	ZINC000819009757	EJ	On-Demand	Anodyne	HDAC8	18	41
CC(=O)N(c1ccc(NC(=O)CCCCCC(C)C)cc1)C1CC1	ZINC000819009757	EJ	On-Demand	Anodyne	HDAC10	38	41
CC(=O)N(c1ccc(NC(=O)CCCCCC(C)C)cc1)C1CC1	ZINC000819009757	EJ	On-Demand	Anodyne	HDAC2	27	41
CC(=O)N(c1ccc(NC(=O)CCCCCC(C)C)cc1)C1CC1	ZINC000819009757	EJ	On-Demand	Anodyne	HDAC11	31	41
CCOC(=O)Nc1ccc(C(=O)N2CC(C3CCCCC3)C2)cc1	ZINC000819009767	EH	On-Demand	Anodyne	ACR	40	33
CCOC(=O)Nc1ccc(C(=O)N2CC(C3CCCCC3)C2)cc1	ZINC000819009767	EH	On-Demand	Anodyne	L3MBTL3	54	42
O=C(c1ccc(S(=O)(=O)N2CCCC2)o1)N1CC(C2CCCCC2)C1	ZINC000819009769	FF	On-Demand	Anodyne	LPL	41	38
O=C(c1ccc(S(=O)(=O)N2CCCC2)o1)N1CC(C2CCCCC2)C1	ZINC000819009769	FF	On-Demand	Anodyne	L3MBTL3	22	43
O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CC(C2CCCCC2)C1	ZINC000819009771	DH	On-Demand	Bother	L3MBTL3	47	45
O=C([C@@H](F)c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819009772	CH	On-Demand	Anodyne	CCR5	20	45
O=C([C@H](F)c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819009773	CH	On-Demand	Anodyne	CCR5	20	45
O=C(c1cc(Cl)nc(Cl)c1)N1CC(C2CCCCC2)C1	ZINC000819009777	DI	On-Demand	Anodyne	L3MBTL3	31	40
CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N1CC(C2CCCCC2)C1	ZINC000819009779	FD	On-Demand	Anodyne	CTSK	16	45
CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N1CC(C2CCCCC2)C1	ZINC000819009779	FD	On-Demand	Anodyne	REN	34	41
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)cc1)C1CC1	ZINC000819009780	IG	On-Demand	Anodyne	CPT1A	61	36
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)cc1)C1CC1	ZINC000819009780	IG	On-Demand	Anodyne	CPT2	40	34
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)cc1)C1CC1	ZINC000819009780	IG	On-Demand	Anodyne	SFRP1	47	35
CC(C)(C)OC(=O)N1CCC(OCC(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819009786	GG	On-Demand	Anodyne	GPR119	33	43
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CC(C2CCCCC2)C1	ZINC000819009788	HH	On-Demand	Anodyne	CNR1	15	53
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CC(C2CCCCC2)C1	ZINC000819009788	HH	On-Demand	Anodyne	CNR2	21	84
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CC(C2CCCCC2)C1	ZINC000819009788	HH	On-Demand	Anodyne	EPHX2	31	43
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CC(C2CCCCC2)C1	ZINC000819009788	HH	On-Demand	Anodyne	L3MBTL3	78	45
CC(C)(C)OC(=O)N1CCC(C(F)(F)C(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819009800	HI	On-Demand	Anodyne	GPR119	28	43
CSc1ccc(OC[C@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009818	EG	On-Demand	Anodyne	ADRB2	49	46
CSc1ccc(OC[C@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009818	EG	On-Demand	Anodyne	ADRB1	69	46
CSc1ccc(OC[C@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009818	EG	On-Demand	Anodyne	ADRB3	42	46
CSc1ccc(OC[C@@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009823	EG	On-Demand	Anodyne	ADRB2	49	46
CSc1ccc(OC[C@@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009823	EG	On-Demand	Anodyne	ADRB1	69	46
CSc1ccc(OC[C@@H](O)CNCCSC(C)(C)C)cc1	ZINC000819009823	EG	On-Demand	Anodyne	ADRB3	42	46
O=C(/C=C\c1cccc(F)c1)N1CC(C2CCCCC2)C1	ZINC000819009827	CH	On-Demand	Anodyne	NR1H4	17	41
O=C(/C=C/c1cccc(F)c1)N1CC(C2CCCCC2)C1	ZINC000819009828	CH	On-Demand	Anodyne	NR1H4	17	41
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1CC(C2CCCCC2)C1	ZINC000819009838	EF	On-Demand	Anodyne	PREP	45	41
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1CC(C2CCCCC2)C1	ZINC000819009839	EF	On-Demand	Anodyne	PREP	45	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCSC(C)(C)C)CC1	ZINC000819009849	FG	On-Demand	Anodyne	GPR119	28	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCSC(C)(C)C)CC1	ZINC000819009850	FG	On-Demand	Anodyne	GPR119	28	42
CC(=O)c1cccc(OC[C@@H](O)CNCCSC(C)(C)C)c1	ZINC000819009864	EF	On-Demand	Anodyne	ADRB2	48	48
CC(=O)c1cccc(OC[C@@H](O)CNCCSC(C)(C)C)c1	ZINC000819009864	EF	On-Demand	Anodyne	ADRB1	77	43
CC(=O)c1cccc(OC[C@@H](O)CNCCSC(C)(C)C)c1	ZINC000819009864	EF	On-Demand	Anodyne	ADRB3	45	43
CC(=O)c1cccc(OC[C@@H](O)CNCCSC(C)(C)C)c1	ZINC000819009864	EF	On-Demand	Anodyne	CASR	40	36
CC(=O)c1cccc(OC[C@@H](O)CNCCSC(C)(C)C)c1	ZINC000819009864	EF	On-Demand	Anodyne	ABCB1	22	49
CC(=O)c1cccc(OC[C@@H](O)CNCCSC(C)(C)C)c1	ZINC000819009864	EF	On-Demand	Anodyne	PDS	65	37
CC(=O)c1cccc(OC[C@H](O)CNCCSC(C)(C)C)c1	ZINC000819009865	EF	On-Demand	Anodyne	ADRB2	48	48
CC(=O)c1cccc(OC[C@H](O)CNCCSC(C)(C)C)c1	ZINC000819009865	EF	On-Demand	Anodyne	ADRB1	77	43
CC(=O)c1cccc(OC[C@H](O)CNCCSC(C)(C)C)c1	ZINC000819009865	EF	On-Demand	Anodyne	ADRB3	45	43
CC(=O)c1cccc(OC[C@H](O)CNCCSC(C)(C)C)c1	ZINC000819009865	EF	On-Demand	Anodyne	CASR	40	36
CC(=O)c1cccc(OC[C@H](O)CNCCSC(C)(C)C)c1	ZINC000819009865	EF	On-Demand	Anodyne	ABCB1	22	49
CC(=O)c1cccc(OC[C@H](O)CNCCSC(C)(C)C)c1	ZINC000819009865	EF	On-Demand	Anodyne	PDS	65	37
O=C(c1cc(S(=O)(=O)N2CCC2)ccc1Cl)N1CC(C2CCCCC2)C1	ZINC000819009924	GG	On-Demand	Anodyne	TGM2	22	41
O=C(c1cc(S(=O)(=O)N2CCC2)ccc1Cl)N1CC(C2CCCCC2)C1	ZINC000819009924	GG	On-Demand	Anodyne	F13A1	26	41
O=C(c1cc(S(=O)(=O)N2CCC2)ccc1Cl)N1CC(C2CCCCC2)C1	ZINC000819009924	GG	On-Demand	Anodyne	AKR1C3	26	40
CC(=O)N(c1ccc(NC(=O)c2cccc(CNC(=O)OC(C)(C)C)c2)cc1)C1CC1	ZINC000819009929	HI	On-Demand	Anodyne	GCGR	46	33
CC(=O)N(c1ccc(NC(=O)c2cccc(CNC(=O)OC(C)(C)C)c2)cc1)C1CC1	ZINC000819009929	HI	On-Demand	Anodyne	ROCK2	15	43
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819009930	II	On-Demand	Anodyne	GRIN2B	20	41
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819009930	II	On-Demand	Anodyne	CCR5	26	42
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819009930	II	On-Demand	Anodyne	PREP	34	44
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819009930	II	On-Demand	Anodyne	AMY2	42	29
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819009930	II	On-Demand	Anodyne	LGMN	47	36
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819009930	II	On-Demand	Anodyne	TGM2	47	43
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819009930	II	On-Demand	Anodyne	F13A1	59	43
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819009930	II	On-Demand	Anodyne	SLC12A5	65	36
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819009931	II	On-Demand	Anodyne	GRIN2B	20	41
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819009931	II	On-Demand	Anodyne	CCR5	26	42
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819009931	II	On-Demand	Anodyne	PREP	34	44
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819009931	II	On-Demand	Anodyne	AMY2	42	29
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819009931	II	On-Demand	Anodyne	LGMN	47	36
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819009931	II	On-Demand	Anodyne	TGM2	47	43
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819009931	II	On-Demand	Anodyne	F13A1	59	43
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819009931	II	On-Demand	Anodyne	SLC12A5	65	36
CC(=O)N(c1ccc(NC(=O)c2ccc(CS(=O)(=O)C(F)F)cc2)cc1)C1CC1	ZINC000819009936	HH	On-Demand	Anodyne	GIPR	50	34
O=C(NCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819009948	FH	On-Demand	Anodyne	F2	15	40
O=C(NCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819009948	FH	On-Demand	Anodyne	ACE	31	47
O=C(NCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819009948	FH	On-Demand	Anodyne	KLK3	53	34
O=C(NCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819009948	FH	On-Demand	Anodyne	CTSB	43	42
O=C(NCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819009948	FH	On-Demand	Anodyne	CTSK	35	42
O=C(NCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819009948	FH	On-Demand	Anodyne	CTSL	42	42
O=C(NCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819009948	FH	On-Demand	Anodyne	PREP	70	54
O=C(NCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819009948	FH	On-Demand	Anodyne	CAPNS1	57	33
O=C(NCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819009948	FH	On-Demand	Anodyne	CAPN1	58	43
O=C(NCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819009948	FH	On-Demand	Anodyne	CAPN2	102	43
O=C(NCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819009948	FH	On-Demand	Anodyne	TGM2	41	45
O=C(NCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819009948	FH	On-Demand	Anodyne	KLK5	39	40
O=C(NCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819009948	FH	On-Demand	Anodyne	NPR	65	39
O=C(NCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819009948	FH	On-Demand	Anodyne	F13A1	25	41
O=C(NCCCC(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819009948	FH	On-Demand	Anodyne	SLC12A5	59	39
CN(C)CCOc1cccc(N2C(=O)CN(Cc3ccccc3O)C2=O)c1	ZINC000819009957	FE	On-Demand	Clean	ESRRG	43	32
CN(C)CCOc1cccc(N2C(=O)CN(Cc3ccccc3O)C2=O)c1	ZINC000819009957	FE	On-Demand	Clean	GALR3	54	43
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2C(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819009965	GI	On-Demand	Anodyne	GPR119	29	47
CCc1ccc(C(=O)NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819009972	GF	On-Demand	Reactive	PAPA1_CARPA	57	49
CCc1ccc(C(=O)NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819009972	GF	On-Demand	Reactive	CTSK	29	44
CCc1ccc(C(=O)NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819009972	GF	On-Demand	Reactive	CTSL	18	49
CCc1ccc(C(=O)NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819009972	GF	On-Demand	Reactive	CTSS	15	54
CCc1ccc(C(=O)NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819009972	GF	On-Demand	Reactive	FPR1	46	42
CCc1ccc(C(=O)NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819009972	GF	On-Demand	Reactive	CTRB_BOVIN	58	34
CC(C)(C)OC(=O)N1CCC[C@@H](n2cnc(C(=O)N3CC(C4CCCCC4)C3)n2)C1	ZINC000819009978	HH	On-Demand	Anodyne	GPR119	21	41
CC(C)(C)OC(=O)N1CCC[C@H](n2cnc(C(=O)N3CC(C4CCCCC4)C3)n2)C1	ZINC000819009979	HH	On-Demand	Anodyne	GPR119	21	41
CC(C)(C)OC(=O)N1CCC[C@H](CC(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819009999	GI	On-Demand	Anodyne	GPR119	31	41
CC(C)(C)OC(=O)N1CCC[C@@H](CC(=O)N2CC(C3CCCCC3)C2)CC1	ZINC000819010001	GI	On-Demand	Anodyne	GPR119	31	41
O[C@@H](CNCC1(c2ccc(Cl)cc2)CC1)c1cccnc1	ZINC000819010024	DG	On-Demand	Anodyne	ADRB3	82	48
O=C(c1cc(S(=O)(=O)N2CCCC2)ccc1Cl)N1CC(C2CCCCC2)C1	ZINC000819010026	HH	On-Demand	Anodyne	EPHX2	21	41
O=C(c1cc(S(=O)(=O)N2CCCC2)ccc1Cl)N1CC(C2CCCCC2)C1	ZINC000819010026	HH	On-Demand	Anodyne	TGM2	24	41
O=C(c1cc(S(=O)(=O)N2CCCC2)ccc1Cl)N1CC(C2CCCCC2)C1	ZINC000819010026	HH	On-Demand	Anodyne	F13A1	28	41
O=C(c1cc(S(=O)(=O)N2CCCC2)ccc1Cl)N1CC(C2CCCCC2)C1	ZINC000819010026	HH	On-Demand	Anodyne	AKR1C3	27	42
O=C(c1cc(S(=O)(=O)N2CCCC2)ccc1Cl)N1CC(C2CCCCC2)C1	ZINC000819010026	HH	On-Demand	Anodyne	L3MBTL3	39	42
O[C@H](CNCC1(c2ccc(Cl)cc2)CC1)c1cccnc1	ZINC000819010028	DG	On-Demand	Anodyne	ADRB3	82	48
CC(C)(C)OC(=O)N1CC[C@H](c2cc(C(=O)N3CC(C4CCCCC4)C3)n[nH]2)C1	ZINC000819010040	HH	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CC[C@@H](c2cc(C(=O)N3CC(C4CCCCC4)C3)n[nH]2)C1	ZINC000819010042	HH	On-Demand	Anodyne	GPR119	29	41
O=C(Nc1ccccc1C(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819010057	GK	On-Demand	Anodyne	ACE	25	42
O=C(Nc1ccccc1C(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819010057	GK	On-Demand	Anodyne	CTSB	30	42
O=C(Nc1ccccc1C(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819010057	GK	On-Demand	Anodyne	CYSP_TRYCR	40	39
O=C(Nc1ccccc1C(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819010057	GK	On-Demand	Anodyne	CTSK	30	42
O=C(Nc1ccccc1C(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819010057	GK	On-Demand	Anodyne	CTSL	39	42
O=C(Nc1ccccc1C(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819010057	GK	On-Demand	Anodyne	PREP	30	41
O=C(Nc1ccccc1C(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819010057	GK	On-Demand	Anodyne	CAPNS1	51	31
O=C(Nc1ccccc1C(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819010057	GK	On-Demand	Anodyne	CAPN1	41	39
O=C(Nc1ccccc1C(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819010057	GK	On-Demand	Anodyne	CAPN2	63	37
O=C(Nc1ccccc1C(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819010057	GK	On-Demand	Anodyne	TGM2	34	41
O=C(Nc1ccccc1C(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819010057	GK	On-Demand	Anodyne	NPR	47	33
O=C(Nc1ccccc1C(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819010057	GK	On-Demand	Anodyne	F13A1	28	41
O=C(Nc1ccccc1C(=O)N1CC(C2CCCCC2)C1)OCc1ccccc1	ZINC000819010057	GK	On-Demand	Anodyne	SLC12A5	59	37
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819010060	HH	On-Demand	Anodyne	PAPA1_CARPA	33	47
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819010060	HH	On-Demand	Anodyne	FPR1	45	44
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819010062	HH	On-Demand	Anodyne	PAPA1_CARPA	33	47
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819010062	HH	On-Demand	Anodyne	FPR1	45	44
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)N3CC(C4CCCCC4)C3)cc2C1	ZINC000819010073	GJ	On-Demand	Anodyne	GPR119	23	42
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)N3CC(C4CCCCC4)C3)cc2C1	ZINC000819010073	GJ	On-Demand	Anodyne	L3MBTL3	42	38
O=C(c1cc([N+](=O)[O-])ccc1N1CCCC1)N1CC(C2CCCCC2)C1	ZINC000819010086	FH	On-Demand	Bother	SLC6A9	21	58
C#CCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819010087	DH	On-Demand	Mild	HDAC10	20	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)N1CC(C2CCCCC2)C1	ZINC000819010088	HF	On-Demand	Anodyne	F2	17	44
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)N1CC(C2CCCCC2)C1	ZINC000819010088	HF	On-Demand	Anodyne	PREP	22	48
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)N1CC(C2CCCCC2)C1	ZINC000819010088	HF	On-Demand	Anodyne	LGMN	40	33
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)N1CC(C2CCCCC2)C1	ZINC000819010091	HF	On-Demand	Anodyne	F2	17	44
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)N1CC(C2CCCCC2)C1	ZINC000819010091	HF	On-Demand	Anodyne	PREP	22	48
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)N1CC(C2CCCCC2)C1	ZINC000819010091	HF	On-Demand	Anodyne	LGMN	40	33
O=C(c1ccc(F)c(S(=O)(=O)N2CCCC2)c1)N1CC(C2CCCCC2)C1	ZINC000819010095	GG	On-Demand	Anodyne	CNR2	19	67
O=C(c1ccc(F)c(S(=O)(=O)N2CCCC2)c1)N1CC(C2CCCCC2)C1	ZINC000819010095	GG	On-Demand	Anodyne	EPHX2	25	44
O=C(c1ccc(F)c(S(=O)(=O)N2CCCC2)c1)N1CC(C2CCCCC2)C1	ZINC000819010095	GG	On-Demand	Anodyne	L3MBTL3	71	43
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000819010096	DH	On-Demand	Anodyne	SLC1A1	23	43
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000819010096	DH	On-Demand	Anodyne	SLC1A3	27	43
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000819010096	DH	On-Demand	Anodyne	SLC1A2	21	43
O=C(/C=C\[C@H]1CCCO1)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000819010098	DH	On-Demand	Anodyne	SLC1A1	23	43
O=C(/C=C\[C@H]1CCCO1)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000819010098	DH	On-Demand	Anodyne	SLC1A3	27	43
O=C(/C=C\[C@H]1CCCO1)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000819010098	DH	On-Demand	Anodyne	SLC1A2	21	43
O=C(/C=C/[C@H]1CCCO1)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000819010099	DH	On-Demand	Anodyne	SLC1A1	23	43
O=C(/C=C/[C@H]1CCCO1)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000819010099	DH	On-Demand	Anodyne	SLC1A3	27	43
O=C(/C=C/[C@H]1CCCO1)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000819010099	DH	On-Demand	Anodyne	SLC1A2	21	43
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000819010100	DH	On-Demand	Anodyne	SLC1A1	23	43
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000819010100	DH	On-Demand	Anodyne	SLC1A3	27	43
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000819010100	DH	On-Demand	Anodyne	SLC1A2	21	43
CCCOc1cccc(N2C(=O)CN(Cc3ccccc3O)C2=O)c1	ZINC000819010102	EG	On-Demand	Clean	GALR3	46	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cccc(OC)c3)CC1)C2	ZINC000819010133	GE	On-Demand	Anodyne	DRD4	43	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cccc(OC)c3)CC1)C2	ZINC000819010133	GE	On-Demand	Anodyne	SSTR1	80	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cccc(OC)c3)CC1)C2	ZINC000819010133	GE	On-Demand	Anodyne	ADAM10	40	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cccc(OC)c3)CC1)C2	ZINC000819010133	GE	On-Demand	Anodyne	NPBWR1	69	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cccc(OC)c3)CC1)C2	ZINC000819010134	GE	On-Demand	Anodyne	DRD4	43	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cccc(OC)c3)CC1)C2	ZINC000819010134	GE	On-Demand	Anodyne	SSTR1	80	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cccc(OC)c3)CC1)C2	ZINC000819010134	GE	On-Demand	Anodyne	ADAM10	40	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cccc(OC)c3)CC1)C2	ZINC000819010134	GE	On-Demand	Anodyne	NPBWR1	69	33
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)C1CC1	ZINC000819010159	CE	On-Demand	Anodyne	ADRB1	34	42
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)C1CC1	ZINC000819010159	CE	On-Demand	Anodyne	ADRB3	50	42
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)C1CC1	ZINC000819010159	CE	On-Demand	Anodyne	CYP3A4	43	38
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)C1CC1	ZINC000819010160	CE	On-Demand	Anodyne	ADRB1	34	42
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)C1CC1	ZINC000819010160	CE	On-Demand	Anodyne	ADRB3	50	42
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)C1CC1	ZINC000819010160	CE	On-Demand	Anodyne	CYP3A4	43	38
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)C1CC1	ZINC000819010161	CE	On-Demand	Anodyne	ADRB1	34	42
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)C1CC1	ZINC000819010161	CE	On-Demand	Anodyne	ADRB3	50	42
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)C1CC1	ZINC000819010161	CE	On-Demand	Anodyne	CYP3A4	43	38
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)C1CC1	ZINC000819010162	CE	On-Demand	Anodyne	ADRB1	34	42
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)C1CC1	ZINC000819010162	CE	On-Demand	Anodyne	ADRB3	50	42
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)C1CC1	ZINC000819010162	CE	On-Demand	Anodyne	CYP3A4	43	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)Cc1ccc(OC)c(OC)c1)C2	ZINC000819010163	GF	On-Demand	Anodyne	MT-ND1	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)Cc1ccc(OC)c(OC)c1)C2	ZINC000819010164	GF	On-Demand	Anodyne	MT-ND1	17	40
NS(=O)(=O)c1ccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])cc1	ZINC000819010171	ID	On-Demand	Bother	CA2	88	48
NS(=O)(=O)c1ccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])cc1	ZINC000819010171	ID	On-Demand	Bother	CA1	76	47
NS(=O)(=O)c1ccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])cc1	ZINC000819010171	ID	On-Demand	Bother	CA7	37	47
NS(=O)(=O)c1ccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])cc1	ZINC000819010171	ID	On-Demand	Bother	COLA	79	37
NS(=O)(=O)c1ccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])cc1	ZINC000819010171	ID	On-Demand	Bother	CA13	18	41
NS(=O)(=O)c1ccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])cc1	ZINC000819010171	ID	On-Demand	Bother	CA5B	45	47
NS(=O)(=O)c1ccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])cc1	ZINC000819010171	ID	On-Demand	Bother	CA4	73	45
NS(=O)(=O)c1ccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])cc1	ZINC000819010171	ID	On-Demand	Bother	CA5A	52	47
NS(=O)(=O)c1ccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])cc1	ZINC000819010171	ID	On-Demand	Bother	CA14	28	47
NS(=O)(=O)c1ccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])cc1	ZINC000819010171	ID	On-Demand	Bother	CA12	55	48
NS(=O)(=O)c1ccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])cc1	ZINC000819010171	ID	On-Demand	Bother	CA9	54	48
NS(=O)(=O)c1ccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])cc1	ZINC000819010171	ID	On-Demand	Bother	MTCA1	47	42
NS(=O)(=O)c1ccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])cc1	ZINC000819010171	ID	On-Demand	Bother	P96878_MYCTU	59	42
C=C(C)C(C)(C)C(=O)N(C)CC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000819010197	FF	On-Demand	Mild	MTOR	54	37
C=C(C)C(C)(C)C(=O)N(C)CC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000819010197	FF	On-Demand	Mild	STAT6	56	34
COc1cc(NC(=O)c2c[nH]nc2[C@H]2CCCNC2)ccc1N	ZINC000819010205	DD	On-Demand	Anodyne	ENPP1	49	31
COc1cc(NC(=O)c2c[nH]nc2[C@@H]2CCCNC2)ccc1N	ZINC000819010206	DD	On-Demand	Anodyne	ENPP1	49	31
O=C(Cc1cccs1)Nc1nc(CC(=O)N2CC(C3CCCCC3)C2)cs1	ZINC000819010225	HH	On-Demand	Anodyne	ETHR	22	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	F2	25	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	PLG	24	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	ACE	65	50
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	GHRHR	58	33
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	P2RY12	181	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	CELA1	30	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	ELANE	28	46
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	CTSD	16	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	CMA1	15	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	CTRA_BOVIN	67	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	CASP3	17	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	KLK3	90	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	CTSB	75	49
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	PAPA1_CARPA	78	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	TRY1_BOVIN	44	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	CYSP_TRYCR	62	47
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	CTSG	45	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	CTSK	62	54
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	CTSL	59	54
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	CACNA1B	43	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	PREP	38	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	AMY2	47	32
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	CAPNS1	72	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	CELA2A	55	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	REN	77	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	MMP11	59	33
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	TGM1	24	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	CTSS	44	54
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	CAPN1	100	48
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	CASP1	26	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	CAPN2	151	46
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	PLAU	18	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	TGM2	40	51
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	KLK5	40	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	TPSAB1	45	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	KLK1	21	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	NPR	80	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	PSMB5	44	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	SLC12A5	61	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010226	GG	On-Demand	Anodyne	Q9NAW4_PLAFA	35	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	F2	25	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	PLG	24	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	ACE	65	50
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	GHRHR	58	33
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	P2RY12	181	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	CELA1	30	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	ELANE	28	46
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	CTSD	16	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	CMA1	15	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	CTRA_BOVIN	67	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	CASP3	17	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	KLK3	90	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	CTSB	75	49
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	PAPA1_CARPA	78	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	TRY1_BOVIN	44	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	CYSP_TRYCR	62	47
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	CTSG	45	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	CTSK	62	54
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	CTSL	59	54
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	CACNA1B	43	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	PREP	38	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	AMY2	47	32
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	CAPNS1	72	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	CELA2A	55	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	REN	77	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	MMP11	59	33
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	TGM1	24	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	CTSS	44	54
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	CAPN1	100	48
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	CASP1	26	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	CAPN2	151	46
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	PLAU	18	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	TGM2	40	51
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	KLK5	40	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	TPSAB1	45	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	KLK1	21	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	NPR	80	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	PSMB5	44	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	SLC12A5	61	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010227	GG	On-Demand	Anodyne	Q9NAW4_PLAFA	35	40
CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)N1CC(C2CCCCC2)C1	ZINC000819010234	FG	On-Demand	Anodyne	PREP	23	46
CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)N1CC(C2CCCCC2)C1	ZINC000819010235	FG	On-Demand	Anodyne	PREP	23	46
CC(=O)N(c1ccc(NC(=O)[C@]2(C)CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819010240	II	On-Demand	Anodyne	TGM2	29	43
CC(=O)N(c1ccc(NC(=O)[C@]2(C)CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819010240	II	On-Demand	Anodyne	F13A1	47	43
CC(=O)N(c1ccc(NC(=O)[C@]2(C)CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819010240	II	On-Demand	Anodyne	SLC12A5	69	36
CC(=O)N(c1ccc(NC(=O)[C@@]2(C)CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819010241	II	On-Demand	Anodyne	TGM2	29	43
CC(=O)N(c1ccc(NC(=O)[C@@]2(C)CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819010241	II	On-Demand	Anodyne	F13A1	47	43
CC(=O)N(c1ccc(NC(=O)[C@@]2(C)CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819010241	II	On-Demand	Anodyne	SLC12A5	69	36
CN(C)S(=O)(=O)c1cc(C(=O)N2CC(C3CCCCC3)C2)ccc1Cl	ZINC000819010243	GG	On-Demand	Anodyne	L3MBTL3	44	38
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CC(C2CCCCC2)C1	ZINC000819010247	EG	On-Demand	Anodyne	PREP	56	71
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CC(C2CCCCC2)C1	ZINC000819010247	EG	On-Demand	Anodyne	SFRP1	28	41
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CC(C2CCCCC2)C1	ZINC000819010247	EG	On-Demand	Anodyne	WNT3	33	41
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CC(C2CCCCC2)C1	ZINC000819010248	EG	On-Demand	Anodyne	PREP	56	71
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CC(C2CCCCC2)C1	ZINC000819010248	EG	On-Demand	Anodyne	SFRP1	28	41
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CC(C2CCCCC2)C1	ZINC000819010248	EG	On-Demand	Anodyne	WNT3	33	41
N#CCOc1ccc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819010255	GG	On-Demand	Mild	ADRB2	39	43
N#CCOc1ccc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819010255	GG	On-Demand	Mild	ADRB1	62	43
N#CCOc1ccc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819010255	GG	On-Demand	Mild	GRIN1	31	48
N#CCOc1ccc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819010255	GG	On-Demand	Mild	ADRB3	40	45
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819010259	GG	On-Demand	Mild	ADRB2	39	43
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819010259	GG	On-Demand	Mild	ADRB1	62	43
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819010259	GG	On-Demand	Mild	GRIN1	31	48
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819010259	GG	On-Demand	Mild	ADRB3	40	45
N#CCOc1ccc(CNC[C@H](O)COc2cccc(Br)c2)cc1	ZINC000819010264	GF	On-Demand	Mild	ADRB2	39	42
N#CCOc1ccc(CNC[C@H](O)COc2cccc(Br)c2)cc1	ZINC000819010264	GF	On-Demand	Mild	ADRB1	61	42
N#CCOc1ccc(CNC[C@H](O)COc2cccc(Br)c2)cc1	ZINC000819010264	GF	On-Demand	Mild	ADRB3	39	42
N#CCOc1ccc(CNC[C@H](O)COc2cccc(Br)c2)cc1	ZINC000819010264	GF	On-Demand	Mild	PDS	40	41
N#CCOc1ccc(CNC[C@@H](O)COc2cccc(Br)c2)cc1	ZINC000819010267	GF	On-Demand	Mild	ADRB2	39	42
N#CCOc1ccc(CNC[C@@H](O)COc2cccc(Br)c2)cc1	ZINC000819010267	GF	On-Demand	Mild	ADRB1	61	42
N#CCOc1ccc(CNC[C@@H](O)COc2cccc(Br)c2)cc1	ZINC000819010267	GF	On-Demand	Mild	ADRB3	39	42
N#CCOc1ccc(CNC[C@@H](O)COc2cccc(Br)c2)cc1	ZINC000819010267	GF	On-Demand	Mild	PDS	40	41
CN(C)CCOc1cccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819010275	FE	On-Demand	Bother	ACR	16	40
CN(C)CCOc1cccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819010277	FE	On-Demand	Bother	ACR	16	40
O=C(/C=C\c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819010281	CH	On-Demand	Anodyne	F3	18	43
O=C(/C=C/c1ccccc1)N1CC(C2CCCCC2)C1	ZINC000819010282	CH	On-Demand	Anodyne	F3	18	43
CN(C)CCOc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819010300	FE	On-Demand	Bother	ADRB1	28	41
CN(C)CCOc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819010300	FE	On-Demand	Bother	CACNA1D	52	35
CN(C)CCOc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819010303	FE	On-Demand	Bother	ADRB1	28	41
CN(C)CCOc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819010303	FE	On-Demand	Bother	CACNA1D	52	35
CN(C)CCOc1cccc(CNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819010308	EF	On-Demand	Anodyne	ADRB2	18	40
CN(C)CCOc1cccc(CNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819010308	EF	On-Demand	Anodyne	ADRB1	20	40
CN(C)CCOc1cccc(CNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819010308	EF	On-Demand	Anodyne	BACE1	18	40
CN(C)CCOc1cccc(CNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819010310	EF	On-Demand	Anodyne	ADRB2	18	40
CN(C)CCOc1cccc(CNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819010310	EF	On-Demand	Anodyne	ADRB1	20	40
CN(C)CCOc1cccc(CNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819010310	EF	On-Demand	Anodyne	BACE1	18	40
O=C(c1cc(=O)c2ccccc2o1)N1CC(C2CCCCC2)C1	ZINC000819010313	DG	On-Demand	Anodyne	TNKS	26	41
CON(C)C(=O)CCNCc1ccc(OCCN(C)C)cc1	ZINC000819010316	DD	On-Demand	Anodyne	LTA4H	23	44
CON(C)C(=O)CCNCc1ccc(OCCN(C)C)cc1	ZINC000819010316	DD	On-Demand	Anodyne	LPAR2	15	40
CON(C)C(=O)CCNCc1ccc(OCCN(C)C)cc1	ZINC000819010316	DD	On-Demand	Anodyne	ESRRG	47	34
N#CCOc1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819010324	EF	On-Demand	Mild	ADRB2	42	47
N#CCOc1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819010324	EF	On-Demand	Mild	ADRB1	68	42
N#CCOc1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819010324	EF	On-Demand	Mild	ADRB3	36	42
N#CCOc1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819010324	EF	On-Demand	Mild	CASR	45	46
N#CCOc1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819010324	EF	On-Demand	Mild	CYP2D6	18	46
N#CCOc1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819010327	EF	On-Demand	Mild	ADRB2	42	47
N#CCOc1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819010327	EF	On-Demand	Mild	ADRB1	68	42
N#CCOc1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819010327	EF	On-Demand	Mild	ADRB3	36	42
N#CCOc1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819010327	EF	On-Demand	Mild	CASR	45	46
N#CCOc1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819010327	EF	On-Demand	Mild	CYP2D6	18	46
CC(C)(C)OC(=O)N1CCC(C(=O)N2CC(C3CCCCC3)C2)(S(C)(=O)=O)CC1	ZINC000819010328	IF	On-Demand	Anodyne	GPR119	29	42
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CC(C2CCCCC2)C1	ZINC000819010334	DG	On-Demand	Anodyne	REN	24	40
O=C(CSc1ccccc1[N+](=O)[O-])OCCOc1ccccc1	ZINC000819010338	EG	On-Demand	Bother	GSTM2	43	33
CC(=O)N(c1ccc(NC(=O)[C@@](C)(O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819010348	HI	On-Demand	Anodyne	NPY2R	27	41
CC(=O)N(c1ccc(NC(=O)[C@@](C)(O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819010348	HI	On-Demand	Anodyne	CACNA1B	46	34
CC(=O)N(c1ccc(NC(=O)[C@@](C)(O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819010348	HI	On-Demand	Anodyne	EPHX2	15	40
CC(=O)N(c1ccc(NC(=O)[C@](C)(O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819010349	HI	On-Demand	Anodyne	NPY2R	27	41
CC(=O)N(c1ccc(NC(=O)[C@](C)(O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819010349	HI	On-Demand	Anodyne	CACNA1B	46	34
CC(=O)N(c1ccc(NC(=O)[C@](C)(O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819010349	HI	On-Demand	Anodyne	EPHX2	15	40
Cc1ccccc1CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819010357	FH	On-Demand	Mild	CTSB	37	40
Cc1ccccc1CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819010357	FH	On-Demand	Mild	PAPA1_CARPA	61	48
Cc1ccccc1CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819010357	FH	On-Demand	Mild	CCKAR	41	39
Cc1ccccc1CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819010357	FH	On-Demand	Mild	CTSK	19	42
Cc1ccccc1CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819010357	FH	On-Demand	Mild	CTSL	18	48
Cc1ccccc1CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819010357	FH	On-Demand	Mild	CTSS	15	48
Cc1ccccc1CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819010357	FH	On-Demand	Mild	FPR1	45	38
Cc1ccccc1CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819010359	FH	On-Demand	Mild	CTSB	37	40
Cc1ccccc1CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819010359	FH	On-Demand	Mild	PAPA1_CARPA	61	48
Cc1ccccc1CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819010359	FH	On-Demand	Mild	CCKAR	41	39
Cc1ccccc1CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819010359	FH	On-Demand	Mild	CTSK	19	42
Cc1ccccc1CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819010359	FH	On-Demand	Mild	CTSL	18	48
Cc1ccccc1CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819010359	FH	On-Demand	Mild	CTSS	15	48
Cc1ccccc1CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819010359	FH	On-Demand	Mild	FPR1	45	38
CC(=O)N(c1ccc(NC(=O)[C@H](CNC(=O)OC(C)(C)C)c2ccccc2)cc1)C1CC1	ZINC000819010362	II	On-Demand	Anodyne	AMY2	43	30
CC(=O)N(c1ccc(NC(=O)[C@@H](CNC(=O)OC(C)(C)C)c2ccccc2)cc1)C1CC1	ZINC000819010365	II	On-Demand	Anodyne	AMY2	43	30
N#CCOc1ccc(CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819010370	EF	On-Demand	Mild	ADRB1	25	42
N#CCOc1ccc(CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819010370	EF	On-Demand	Mild	MAOB	29	47
N#CCOc1ccc(CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819010370	EF	On-Demand	Mild	ADRB3	24	42
N#CCOc1ccc(CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819010372	EF	On-Demand	Mild	ADRB1	25	42
N#CCOc1ccc(CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819010372	EF	On-Demand	Mild	MAOB	29	47
N#CCOc1ccc(CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819010372	EF	On-Demand	Mild	ADRB3	24	42
CCOc1ccccc1CCNC[C@H](O)c1ccc(F)cc1F	ZINC000819010373	DG	On-Demand	Anodyne	ADRB2	51	45
CCOc1ccccc1CCNC[C@H](O)c1ccc(F)cc1F	ZINC000819010373	DG	On-Demand	Anodyne	ADRB1	43	45
CCOc1ccccc1CCNC[C@@H](O)c1ccc(F)cc1F	ZINC000819010374	DG	On-Demand	Anodyne	ADRB2	51	45
CCOc1ccccc1CCNC[C@@H](O)c1ccc(F)cc1F	ZINC000819010374	DG	On-Demand	Anodyne	ADRB1	43	45
CC(=O)N(c1ccc(NC(=O)c2ccc(-c3cc(F)c(F)c(F)c3)cc2)cc1)C1CC1	ZINC000819010379	HK	On-Demand	Anodyne	PRNP	59	42
CC(=O)N(c1ccc(NC(=O)c2ccc(-c3cc(F)c(F)c(F)c3)cc2)cc1)C1CC1	ZINC000819010379	HK	On-Demand	Anodyne	MCHR1	23	44
CCOc1ccccc1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819010381	DG	On-Demand	Anodyne	ADRB2	59	43
CCOc1ccccc1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819010381	DG	On-Demand	Anodyne	ADRB1	55	48
CCOc1ccccc1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819010381	DG	On-Demand	Anodyne	ADRB3	71	48
CSc1ccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819010382	FF	On-Demand	Mild	ADRB2	37	44
CSc1ccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819010382	FF	On-Demand	Mild	ADRB1	57	44
CSc1ccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819010382	FF	On-Demand	Mild	ADRB3	35	43
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC(C3CCCCC3)C2)C[C@H]2C[C@H]21	ZINC000819010383	EG	On-Demand	Anodyne	PREP	15	67
CSc1ccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819010385	FF	On-Demand	Mild	ADRB2	37	44
CSc1ccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819010385	FF	On-Demand	Mild	ADRB1	57	44
CSc1ccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819010385	FF	On-Demand	Mild	ADRB3	35	43
CCOc1ccccc1CCNC[C@@H](O)c1ccc(F)cc1C	ZINC000819010386	DG	On-Demand	Anodyne	ADRB2	45	45
CCOc1ccccc1CCNC[C@@H](O)c1ccc(F)cc1C	ZINC000819010386	DG	On-Demand	Anodyne	ADRB1	33	45
Cc1ccc(N2CCCC2)c(C(=O)N2CC(C3CCCCC3)C2)c1	ZINC000819010388	EI	On-Demand	Anodyne	HCRTR1	55	37
Cc1ccc(N2CCCC2)c(C(=O)N2CC(C3CCCCC3)C2)c1	ZINC000819010388	EI	On-Demand	Anodyne	SLC6A9	17	43
CCOc1ccccc1CCNC[C@H](O)c1ccc(F)cc1C	ZINC000819010389	DG	On-Demand	Anodyne	ADRB2	45	45
CCOc1ccccc1CCNC[C@H](O)c1ccc(F)cc1C	ZINC000819010389	DG	On-Demand	Anodyne	ADRB1	33	45
O=C(c1ccc2nc(S)oc2c1)N1CC(C2CCCCC2)C1	ZINC000819010395	DH	On-Demand	Anodyne	L3MBTL3	40	38
CN(C)CCOc1ccc(CNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819010396	FG	On-Demand	Anodyne	ESRRG	46	34
N#CCOc1ccc(CNC[C@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819010403	GG	On-Demand	Mild	ADRB2	34	41
N#CCOc1ccc(CNC[C@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819010403	GG	On-Demand	Mild	ADRB1	55	41
N#CCOc1ccc(CNC[C@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819010403	GG	On-Demand	Mild	ADRB3	33	41
N#CCOc1ccc(CNC[C@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819010403	GG	On-Demand	Mild	CASR	30	40
O=C(c1cc2occc2[nH]1)N1CC(C2CCCCC2)C1	ZINC000819010405	CG	On-Demand	Anodyne	HRH4	21	44
N#CCOc1ccc(CNC[C@@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819010406	GG	On-Demand	Mild	ADRB2	34	41
N#CCOc1ccc(CNC[C@@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819010406	GG	On-Demand	Mild	ADRB1	55	41
N#CCOc1ccc(CNC[C@@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819010406	GG	On-Demand	Mild	ADRB3	33	41
N#CCOc1ccc(CNC[C@@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819010406	GG	On-Demand	Mild	CASR	30	40
C/C(=C/C(=O)N1CC(C2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1	ZINC000819010409	EI	On-Demand	Bother	SLC27A4	43	35
C/C(=C\C(=O)N1CC(C2CCCCC2)C1)c1ccc([N+](=O)[O-])cc1	ZINC000819010411	EI	On-Demand	Bother	SLC27A4	43	35
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)N(C)C1CC1	ZINC000819010426	CD	On-Demand	Bother	CACNA1D	45	33
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)N(C)C1CC1	ZINC000819010427	CD	On-Demand	Bother	CACNA1D	45	33
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)N(C)C1CC1	ZINC000819010428	CD	On-Demand	Bother	CACNA1D	45	33
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)N(C)C1CC1	ZINC000819010429	CD	On-Demand	Bother	CACNA1D	45	33
CN(C)C1(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCCCC1	ZINC000819010454	GF	On-Demand	Mild	PAPA1_CARPA	44	50
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000819010461	GF	On-Demand	Anodyne	EPHX2	28	43
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000819010461	GF	On-Demand	Anodyne	F13A1	54	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2C[C@H]2c2ccccc2)cc1)C1CC1	ZINC000819010462	EH	On-Demand	Anodyne	NAMPT	22	46
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000819010463	GF	On-Demand	Anodyne	EPHX2	28	43
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000819010463	GF	On-Demand	Anodyne	F13A1	54	40
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000819010464	GF	On-Demand	Anodyne	EPHX2	28	43
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000819010464	GF	On-Demand	Anodyne	F13A1	54	40
O=C(c1ccc(-n2cnc3ccccc32)nc1)N1CC(C2CCCCC2)C1	ZINC000819010465	FI	On-Demand	Anodyne	HPGD	50	43
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000819010466	GF	On-Demand	Anodyne	EPHX2	28	43
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000819010466	GF	On-Demand	Anodyne	F13A1	54	40
COc1ccc(CN(C)C(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)cc1OC	ZINC000819010509	FF	On-Demand	Anodyne	MT-ND1	19	45
C=C(C)C(C)(C)C(=O)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1	ZINC000819010518	GJ	On-Demand	Mild	CHRM2	22	49
C=C(C)C(C)(C)C(=O)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1	ZINC000819010518	GJ	On-Demand	Mild	CHRM1	26	49
C=C(C)C(C)(C)C(=O)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1	ZINC000819010518	GJ	On-Demand	Mild	CHRM3	34	49
C=C(C)C(C)(C)C(=O)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1	ZINC000819010518	GJ	On-Demand	Mild	NPY2R	40	50
C=C(C)C(C)(C)C(=O)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1	ZINC000819010518	GJ	On-Demand	Mild	AMY2	44	32
C=C(C)C(C)(C)C(=O)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1	ZINC000819010518	GJ	On-Demand	Mild	CYP2J2	64	47
C=C(C)C(C)(C)C(=O)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1	ZINC000819010518	GJ	On-Demand	Mild	LYPLA2	24	43
N#CCOc1ccc(CNC[C@@H](O)CC2CCCC2)cc1	ZINC000819010547	CF	On-Demand	Mild	ADRB1	36	43
N#CCOc1ccc(CNC[C@H](O)CC2CCCC2)cc1	ZINC000819010548	CF	On-Demand	Mild	ADRB1	36	43
CCOc1ccccc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819010555	DH	On-Demand	Anodyne	ADRB2	88	45
CCOc1ccccc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819010555	DH	On-Demand	Anodyne	ADRB1	91	52
CCOc1ccccc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819010555	DH	On-Demand	Anodyne	ADRB3	97	57
CCOc1ccccc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819010556	DH	On-Demand	Anodyne	ADRB2	88	45
CCOc1ccccc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819010556	DH	On-Demand	Anodyne	ADRB1	91	52
CCOc1ccccc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819010556	DH	On-Demand	Anodyne	ADRB3	97	57
N#CCOc1ccc(CNC[C@H](O)COCc2cccs2)cc1	ZINC000819010557	EE	On-Demand	Mild	ADRB2	21	40
N#CCOc1ccc(CNC[C@H](O)COCc2cccs2)cc1	ZINC000819010557	EE	On-Demand	Mild	ADRB1	39	44
N#CCOc1ccc(CNC[C@H](O)COCc2cccs2)cc1	ZINC000819010557	EE	On-Demand	Mild	ADRB3	23	44
N#CCOc1ccc(CNC[C@@H](O)COCc2cccs2)cc1	ZINC000819010558	EE	On-Demand	Mild	ADRB2	21	40
N#CCOc1ccc(CNC[C@@H](O)COCc2cccs2)cc1	ZINC000819010558	EE	On-Demand	Mild	ADRB1	39	44
N#CCOc1ccc(CNC[C@@H](O)COCc2cccs2)cc1	ZINC000819010558	EE	On-Demand	Mild	ADRB3	23	44
O=C(/C=C\[C@H]1CCCO1)N1CCN(S(=O)(=O)c2c(F)cccc2F)CC1	ZINC000819010565	GD	On-Demand	Anodyne	PKM	34	51
O=C(/C=C\[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2c(F)cccc2F)CC1	ZINC000819010566	GD	On-Demand	Anodyne	PKM	34	51
O=C(/C=C/[C@H]1CCCO1)N1CCN(S(=O)(=O)c2c(F)cccc2F)CC1	ZINC000819010567	GD	On-Demand	Anodyne	PKM	34	51
O=C(/C=C/[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2c(F)cccc2F)CC1	ZINC000819010568	GD	On-Demand	Anodyne	PKM	34	51
N#Cc1ccc([C@@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010579	DH	On-Demand	Mild	ADRB2	73	53
N#Cc1ccc([C@@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010579	DH	On-Demand	Mild	ADRB1	68	53
N#Cc1ccc([C@@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010579	DH	On-Demand	Mild	ADRB3	74	53
N#Cc1ccc([C@@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010579	DH	On-Demand	Mild	S1PR2	19	43
N#Cc1ccc([C@@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010579	DH	On-Demand	Mild	CTRB_BOVIN	48	35
N#Cc1ccc([C@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010583	DH	On-Demand	Mild	ADRB2	73	53
N#Cc1ccc([C@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010583	DH	On-Demand	Mild	ADRB1	68	53
N#Cc1ccc([C@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010583	DH	On-Demand	Mild	ADRB3	74	53
N#Cc1ccc([C@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010583	DH	On-Demand	Mild	S1PR2	19	43
N#Cc1ccc([C@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010583	DH	On-Demand	Mild	CTRB_BOVIN	48	35
CN(C)CCOc1cccc(CNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819010608	FF	On-Demand	Anodyne	ADRB2	16	40
CN(C)CCOc1cccc(CNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819010610	FF	On-Demand	Anodyne	ADRB2	16	40
CCOc1ccccc1CCNC[C@@H](O)c1ccc(C)cc1	ZINC000819010615	CG	On-Demand	Anodyne	ADRB2	60	43
CCOc1ccccc1CCNC[C@@H](O)c1ccc(C)cc1	ZINC000819010615	CG	On-Demand	Anodyne	ADRB1	55	43
CCOc1ccccc1CCNC[C@@H](O)c1ccc(C)cc1	ZINC000819010615	CG	On-Demand	Anodyne	ADRB3	60	40
CCOc1ccccc1CCNC[C@H](O)c1ccc(C)cc1	ZINC000819010617	CG	On-Demand	Anodyne	ADRB2	60	43
CCOc1ccccc1CCNC[C@H](O)c1ccc(C)cc1	ZINC000819010617	CG	On-Demand	Anodyne	ADRB1	55	43
CCOc1ccccc1CCNC[C@H](O)c1ccc(C)cc1	ZINC000819010617	CG	On-Demand	Anodyne	ADRB3	60	40
CCOc1ccccc1CCNC[C@H](O)c1cccnc1	ZINC000819010627	CE	On-Demand	Anodyne	ADRB2	61	48
CCOc1ccccc1CCNC[C@H](O)c1cccnc1	ZINC000819010627	CE	On-Demand	Anodyne	ADRB1	65	48
CCOc1ccccc1CCNC[C@H](O)c1cccnc1	ZINC000819010627	CE	On-Demand	Anodyne	ADRB3	146	52
CCOc1ccccc1CCNC[C@@H](O)c1cccnc1	ZINC000819010629	CE	On-Demand	Anodyne	ADRB2	61	48
CCOc1ccccc1CCNC[C@@H](O)c1cccnc1	ZINC000819010629	CE	On-Demand	Anodyne	ADRB1	65	48
CCOc1ccccc1CCNC[C@@H](O)c1cccnc1	ZINC000819010629	CE	On-Demand	Anodyne	ADRB3	146	52
N#CCOc1ccc(CNC[C@H](O)CCc2ccccc2)cc1	ZINC000819010651	DF	On-Demand	Mild	ADRB2	26	43
N#CCOc1ccc(CNC[C@H](O)CCc2ccccc2)cc1	ZINC000819010651	DF	On-Demand	Mild	ADRB1	45	43
N#CCOc1ccc(CNC[C@H](O)CCc2ccccc2)cc1	ZINC000819010651	DF	On-Demand	Mild	ADRB3	34	43
N#CCOc1ccc(CNC[C@@H](O)CCc2ccccc2)cc1	ZINC000819010652	DF	On-Demand	Mild	ADRB2	26	43
N#CCOc1ccc(CNC[C@@H](O)CCc2ccccc2)cc1	ZINC000819010652	DF	On-Demand	Mild	ADRB1	45	43
N#CCOc1ccc(CNC[C@@H](O)CCc2ccccc2)cc1	ZINC000819010652	DF	On-Demand	Mild	ADRB3	34	43
COc1ccc(CN(C)C(=O)C(F)=C2CCC2)cc1OC	ZINC000819010656	CG	On-Demand	Anodyne	MT-ND1	19	48
O=C(COC(=O)CSc1ccccc1[N+](=O)[O-])Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819010666	II	On-Demand	Bother	ROCK1	20	40
O[C@H](CNCCCCCc1ccccc1)c1ccc(F)cn1	ZINC000819010671	DG	On-Demand	Anodyne	ADRB2	41	44
O[C@H](CNCCCCCc1ccccc1)c1ccc(F)cn1	ZINC000819010671	DG	On-Demand	Anodyne	ADRB1	41	44
O[C@H](CNCCCCCc1ccccc1)c1ccc(F)cn1	ZINC000819010671	DG	On-Demand	Anodyne	ADRB3	55	44
CON(C)C(=O)CCN[C@@H](CN1CCN(C)CC1)c1ccccc1	ZINC000819010672	EC	On-Demand	Anodyne	OPRK1	26	40
O[C@@H](CNCCCCCc1ccccc1)c1ccc(F)cn1	ZINC000819010673	DG	On-Demand	Anodyne	ADRB2	41	44
O[C@@H](CNCCCCCc1ccccc1)c1ccc(F)cn1	ZINC000819010673	DG	On-Demand	Anodyne	ADRB1	41	44
O[C@@H](CNCCCCCc1ccccc1)c1ccc(F)cn1	ZINC000819010673	DG	On-Demand	Anodyne	ADRB3	55	44
CON(C)C(=O)CCN[C@H](CN1CCN(C)CC1)c1ccccc1	ZINC000819010674	EC	On-Demand	Anodyne	OPRK1	26	40
C[C@@H](CC(=O)N(C)CC(=O)Nc1ccc(N2CCOCC2)cc1)n1cccn1	ZINC000819010676	GD	On-Demand	Anodyne	PRNP	42	35
C[C@@H](CC(=O)N(C)CC(=O)Nc1ccc(N2CCOCC2)cc1)n1cccn1	ZINC000819010676	GD	On-Demand	Anodyne	MTOR	53	36
C[C@@H](CC(=O)N(C)CC(=O)Nc1ccc(N2CCOCC2)cc1)n1cccn1	ZINC000819010676	GD	On-Demand	Anodyne	STAT6	51	31
Nc1ccc(NC(=O)[C@@H]2COCCN2)cc1	ZINC000819010678	BC	On-Demand	Clean	PFKFB3	60	34
Nc1ccc(NC(=O)[C@H]2COCCN2)cc1	ZINC000819010680	BC	On-Demand	Clean	PFKFB3	60	34
O[C@H](CNCCCCCc1ccccc1)c1cccnc1	ZINC000819010682	CG	On-Demand	Anodyne	ADRB2	82	63
O[C@H](CNCCCCCc1ccccc1)c1cccnc1	ZINC000819010682	CG	On-Demand	Anodyne	ADRB1	93	52
O[C@H](CNCCCCCc1ccccc1)c1cccnc1	ZINC000819010682	CG	On-Demand	Anodyne	ADRB3	178	63
O[C@H](CNCCCCCc1ccccc1)c1cccnc1	ZINC000819010682	CG	On-Demand	Anodyne	TBXAS1	34	44
O[C@H](CNCCCCCc1ccccc1)c1cccnc1	ZINC000819010682	CG	On-Demand	Anodyne	PTAFR	26	46
O[C@H](CNCCCCCc1ccccc1)c1cccnc1	ZINC000819010682	CG	On-Demand	Anodyne	KCNA5	20	43
O[C@H](CNCCCCCc1ccccc1)c1cccnc1	ZINC000819010682	CG	On-Demand	Anodyne	FAAH	42	39
O[C@H](CNCCCCCc1ccccc1)c1cccnc1	ZINC000819010682	CG	On-Demand	Anodyne	S1PR2	17	43
O[C@H](CNCCCCCc1ccccc1)c1cccnc1	ZINC000819010682	CG	On-Demand	Anodyne	CES1	50	39
O[C@@H](CNCCCCCc1ccccc1)c1cccnc1	ZINC000819010684	CG	On-Demand	Anodyne	ADRB2	82	63
O[C@@H](CNCCCCCc1ccccc1)c1cccnc1	ZINC000819010684	CG	On-Demand	Anodyne	ADRB1	93	52
O[C@@H](CNCCCCCc1ccccc1)c1cccnc1	ZINC000819010684	CG	On-Demand	Anodyne	ADRB3	178	63
O[C@@H](CNCCCCCc1ccccc1)c1cccnc1	ZINC000819010684	CG	On-Demand	Anodyne	TBXAS1	34	44
O[C@@H](CNCCCCCc1ccccc1)c1cccnc1	ZINC000819010684	CG	On-Demand	Anodyne	PTAFR	26	46
O[C@@H](CNCCCCCc1ccccc1)c1cccnc1	ZINC000819010684	CG	On-Demand	Anodyne	KCNA5	20	43
O[C@@H](CNCCCCCc1ccccc1)c1cccnc1	ZINC000819010684	CG	On-Demand	Anodyne	FAAH	42	39
O[C@@H](CNCCCCCc1ccccc1)c1cccnc1	ZINC000819010684	CG	On-Demand	Anodyne	S1PR2	17	43
O[C@@H](CNCCCCCc1ccccc1)c1cccnc1	ZINC000819010684	CG	On-Demand	Anodyne	CES1	50	39
NS(=O)(=O)c1cccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])c1	ZINC000819010688	ID	On-Demand	Bother	CA2	51	52
NS(=O)(=O)c1cccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])c1	ZINC000819010688	ID	On-Demand	Bother	CA1	43	52
NS(=O)(=O)c1cccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])c1	ZINC000819010688	ID	On-Demand	Bother	COLA	69	39
NS(=O)(=O)c1cccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])c1	ZINC000819010688	ID	On-Demand	Bother	CA5B	48	37
NS(=O)(=O)c1cccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])c1	ZINC000819010688	ID	On-Demand	Bother	CA4	49	49
NS(=O)(=O)c1cccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])c1	ZINC000819010688	ID	On-Demand	Bother	CA5A	55	37
NS(=O)(=O)c1cccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])c1	ZINC000819010688	ID	On-Demand	Bother	CA12	25	52
NS(=O)(=O)c1cccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])c1	ZINC000819010688	ID	On-Demand	Bother	CA9	31	42
NS(=O)(=O)c1cccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])c1	ZINC000819010688	ID	On-Demand	Bother	MTCA1	21	42
NS(=O)(=O)c1cccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])c1	ZINC000819010688	ID	On-Demand	Bother	P96878_MYCTU	24	42
CCOc1ccccc1CCNC[C@H](O)c1c(F)cccc1F	ZINC000819010691	DG	On-Demand	Anodyne	ADRB2	25	42
CCOc1ccccc1CCNC[C@H](O)c1c(F)cccc1F	ZINC000819010691	DG	On-Demand	Anodyne	ADRB1	23	42
CCOc1ccccc1CCNC[C@@H](O)c1c(F)cccc1F	ZINC000819010693	DG	On-Demand	Anodyne	ADRB2	25	42
CCOc1ccccc1CCNC[C@@H](O)c1c(F)cccc1F	ZINC000819010693	DG	On-Demand	Anodyne	ADRB1	23	42
C[C@@H]1CCCC[C@@H]1C(=O)N(C)CC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000819010709	FF	On-Demand	Anodyne	MTOR	77	39
C[C@@H]1CCCC[C@H]1C(=O)N(C)CC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000819010712	FF	On-Demand	Anodyne	MTOR	77	39
CN(C)CCOc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819010764	DE	On-Demand	Anodyne	ADRB2	33	41
CN(C)CCOc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819010764	DE	On-Demand	Anodyne	ADRB1	48	43
CN(C)CCOc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819010764	DE	On-Demand	Anodyne	ADRB3	49	47
CN(C)CCOc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819010764	DE	On-Demand	Anodyne	LTA4H	35	55
CN(C)CCOc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819010764	DE	On-Demand	Anodyne	ESRRG	55	41
CN(C)CCOc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819010766	DE	On-Demand	Anodyne	ADRB2	33	41
CN(C)CCOc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819010766	DE	On-Demand	Anodyne	ADRB1	48	43
CN(C)CCOc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819010766	DE	On-Demand	Anodyne	ADRB3	49	47
CN(C)CCOc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819010766	DE	On-Demand	Anodyne	LTA4H	35	55
CN(C)CCOc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819010766	DE	On-Demand	Anodyne	ESRRG	55	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)Cc1ccc(Cl)cc1)C2	ZINC000819010767	FG	On-Demand	Anodyne	CCR1	16	45
N#CCOc1ccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819010768	FE	On-Demand	Mild	ADRB2	37	44
N#CCOc1ccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819010768	FE	On-Demand	Mild	ADRB1	60	41
N#CCOc1ccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819010768	FE	On-Demand	Mild	ADRB3	35	44
N#CCOc1ccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819010768	FE	On-Demand	Mild	CASR	42	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)Cc1ccc(Cl)cc1)C2	ZINC000819010769	FG	On-Demand	Anodyne	CCR1	16	45
N#CCOc1ccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819010771	FE	On-Demand	Mild	ADRB2	37	44
N#CCOc1ccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819010771	FE	On-Demand	Mild	ADRB1	60	41
N#CCOc1ccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819010771	FE	On-Demand	Mild	ADRB3	35	44
N#CCOc1ccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819010771	FE	On-Demand	Mild	CASR	42	39
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010782	FG	On-Demand	Anodyne	ADRB2	103	60
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010782	FG	On-Demand	Anodyne	ADRB1	94	51
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010782	FG	On-Demand	Anodyne	ADRB3	166	51
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010782	FG	On-Demand	Anodyne	S1PR3	18	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010782	FG	On-Demand	Anodyne	S1PR2	29	44
CS(=O)(=O)c1ccc([C@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010784	FG	On-Demand	Anodyne	ADRB2	103	60
CS(=O)(=O)c1ccc([C@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010784	FG	On-Demand	Anodyne	ADRB1	94	51
CS(=O)(=O)c1ccc([C@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010784	FG	On-Demand	Anodyne	ADRB3	166	51
CS(=O)(=O)c1ccc([C@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010784	FG	On-Demand	Anodyne	S1PR3	18	44
CS(=O)(=O)c1ccc([C@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819010784	FG	On-Demand	Anodyne	S1PR2	29	44
O=C(COC(=O)CSc1ccccc1[N+](=O)[O-])Nc1ccc2nc(O)[nH]c2c1	ZINC000819010785	HE	On-Demand	Bother	ENPP1	69	33
CN(C)CCOc1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819010786	DE	On-Demand	Anodyne	ADRB2	28	43
CN(C)CCOc1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819010786	DE	On-Demand	Anodyne	ADRB1	40	39
CN(C)CCOc1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819010786	DE	On-Demand	Anodyne	ADRB3	46	40
CN(C)CCOc1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819010786	DE	On-Demand	Anodyne	ESRRG	46	34
CN(C)CCOc1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819010786	DE	On-Demand	Anodyne	PDS	54	35
CN(C)CCOc1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819010787	DE	On-Demand	Anodyne	ADRB2	28	43
CN(C)CCOc1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819010787	DE	On-Demand	Anodyne	ADRB1	40	39
CN(C)CCOc1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819010787	DE	On-Demand	Anodyne	ADRB3	46	40
CN(C)CCOc1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819010787	DE	On-Demand	Anodyne	ESRRG	46	34
CN(C)CCOc1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819010787	DE	On-Demand	Anodyne	PDS	54	35
CCOc1ccccc1CCNC[C@H](O)c1ccccc1	ZINC000819010800	CF	On-Demand	Anodyne	ADRB2	72	49
CCOc1ccccc1CCNC[C@H](O)c1ccccc1	ZINC000819010800	CF	On-Demand	Anodyne	ADRB1	80	45
CCOc1ccccc1CCNC[C@H](O)c1ccccc1	ZINC000819010800	CF	On-Demand	Anodyne	ADRB3	97	50
CCOc1ccccc1CCNC[C@H](O)c1ccccc1	ZINC000819010800	CF	On-Demand	Anodyne	ABCB1	16	42
CCOc1ccccc1CCNC[C@@H](O)c1ccccc1	ZINC000819010802	CF	On-Demand	Anodyne	ADRB2	72	49
CCOc1ccccc1CCNC[C@@H](O)c1ccccc1	ZINC000819010802	CF	On-Demand	Anodyne	ADRB1	80	45
CCOc1ccccc1CCNC[C@@H](O)c1ccccc1	ZINC000819010802	CF	On-Demand	Anodyne	ADRB3	97	50
CCOc1ccccc1CCNC[C@@H](O)c1ccccc1	ZINC000819010802	CF	On-Demand	Anodyne	ABCB1	16	42
N#CCOc1ccc(CNC[C@H](O)COC2CCOCC2)cc1	ZINC000819010810	DD	On-Demand	Mild	ADRB1	31	42
N#CCOc1ccc(CNC[C@@H](O)COC2CCOCC2)cc1	ZINC000819010814	DD	On-Demand	Mild	ADRB1	31	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(OCC#N)cc2)CC1	ZINC000819010820	GF	On-Demand	Mild	GPR119	54	52
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(OCC#N)cc2)CC1	ZINC000819010823	GF	On-Demand	Mild	GPR119	54	52
N#CCOc1ccc(CNC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819010828	EF	On-Demand	Mild	ADRB2	40	46
N#CCOc1ccc(CNC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819010828	EF	On-Demand	Mild	ADRB1	70	46
N#CCOc1ccc(CNC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819010828	EF	On-Demand	Mild	GRIN1	20	48
N#CCOc1ccc(CNC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819010828	EF	On-Demand	Mild	ADRB3	44	46
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819010830	EF	On-Demand	Mild	ADRB2	40	46
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819010830	EF	On-Demand	Mild	ADRB1	70	46
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819010830	EF	On-Demand	Mild	GRIN1	20	48
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819010830	EF	On-Demand	Mild	ADRB3	44	46
N#CCOc1ccc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819010838	GH	On-Demand	Mild	RAF1	18	43
N#CCOc1ccc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819010838	GH	On-Demand	Mild	PDS	40	37
O[C@@H](CNCCCCCc1ccccc1)C1CC1	ZINC000819010840	BF	On-Demand	Anodyne	ADRB2	39	46
O[C@@H](CNCCCCCc1ccccc1)C1CC1	ZINC000819010840	BF	On-Demand	Anodyne	ADRB1	36	46
O[C@@H](CNCCCCCc1ccccc1)C1CC1	ZINC000819010840	BF	On-Demand	Anodyne	SLC18A2	40	39
O[C@@H](CNCCCCCc1ccccc1)C1CC1	ZINC000819010840	BF	On-Demand	Anodyne	ADRB3	31	46
O[C@@H](CNCCCCCc1ccccc1)C1CC1	ZINC000819010840	BF	On-Demand	Anodyne	SIGMAR1	20	57
O[C@@H](CNCCCCCc1ccccc1)C1CC1	ZINC000819010840	BF	On-Demand	Anodyne	S1PR2	27	51
O=C(Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)C(F)=C1CCC1	ZINC000819010841	FG	On-Demand	Anodyne	EPHX2	20	41
O[C@H](CNCCCCCc1ccccc1)C1CC1	ZINC000819010842	BF	On-Demand	Anodyne	ADRB2	39	46
O[C@H](CNCCCCCc1ccccc1)C1CC1	ZINC000819010842	BF	On-Demand	Anodyne	ADRB1	36	46
O[C@H](CNCCCCCc1ccccc1)C1CC1	ZINC000819010842	BF	On-Demand	Anodyne	SLC18A2	40	39
O[C@H](CNCCCCCc1ccccc1)C1CC1	ZINC000819010842	BF	On-Demand	Anodyne	ADRB3	31	46
O[C@H](CNCCCCCc1ccccc1)C1CC1	ZINC000819010842	BF	On-Demand	Anodyne	SIGMAR1	20	57
O[C@H](CNCCCCCc1ccccc1)C1CC1	ZINC000819010842	BF	On-Demand	Anodyne	S1PR2	27	51
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCc2ccc(OCC#N)cc2)CC1	ZINC000819010848	GF	On-Demand	Mild	ADAM17	19	45
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCc2ccc(OCC#N)cc2)CC1	ZINC000819010848	GF	On-Demand	Mild	GPR119	26	50
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCc2ccc(OCC#N)cc2)CC1	ZINC000819010850	GF	On-Demand	Mild	ADAM17	19	45
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCc2ccc(OCC#N)cc2)CC1	ZINC000819010850	GF	On-Demand	Mild	GPR119	26	50
CCOc1ccccc1CCNC[C@@H](O)c1ccc(C#N)cc1	ZINC000819010868	DF	On-Demand	Mild	ADRB2	42	41
CCOc1ccccc1CCNC[C@@H](O)c1ccc(C#N)cc1	ZINC000819010868	DF	On-Demand	Mild	ADRB1	41	32
CCOc1ccccc1CCNC[C@H](O)c1ccc(C#N)cc1	ZINC000819010872	DF	On-Demand	Mild	ADRB2	42	41
CCOc1ccccc1CCNC[C@H](O)c1ccc(C#N)cc1	ZINC000819010872	DF	On-Demand	Mild	ADRB1	41	32
N#CCOc1ccc(CNC[C@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819010876	GG	On-Demand	Mild	ADRB2	25	40
N#CCOc1ccc(CNC[C@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819010876	GG	On-Demand	Mild	ADRB1	43	38
N#CCOc1ccc(CNC[C@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819010876	GG	On-Demand	Mild	CASR	41	38
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819010878	GG	On-Demand	Mild	ADRB2	25	40
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819010878	GG	On-Demand	Mild	ADRB1	43	38
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819010878	GG	On-Demand	Mild	CASR	41	38
N#CCOc1ccc(CNC[C@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819010886	GG	On-Demand	Mild	ADRB1	45	38
N#CCOc1ccc(CNC[C@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819010886	GG	On-Demand	Mild	CASR	40	38
N#CCOc1ccc(CNC[C@@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819010888	GG	On-Demand	Mild	ADRB1	45	38
N#CCOc1ccc(CNC[C@@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819010888	GG	On-Demand	Mild	CASR	40	38
CCOc1ccccc1CCNC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819010898	EF	On-Demand	Bother	ADRB2	43	42
CCOc1ccccc1CCNC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819010898	EF	On-Demand	Bother	ADRB1	42	42
CCOc1ccccc1CCNC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819010898	EF	On-Demand	Bother	ADRB3	54	39
CCOc1ccccc1CCNC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819010900	EF	On-Demand	Bother	ADRB2	43	42
CCOc1ccccc1CCNC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819010900	EF	On-Demand	Bother	ADRB1	42	42
CCOc1ccccc1CCNC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819010900	EF	On-Demand	Bother	ADRB3	54	39
CCOc1ccccc1CCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819010917	DG	On-Demand	Anodyne	ADRB2	56	42
CCOc1ccccc1CCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819010917	DG	On-Demand	Anodyne	ADRB1	48	41
CCOc1ccccc1CCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819010917	DG	On-Demand	Anodyne	ADRB3	62	38
CCOc1ccccc1CCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819010919	DG	On-Demand	Anodyne	ADRB2	56	42
CCOc1ccccc1CCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819010919	DG	On-Demand	Anodyne	ADRB1	48	41
CCOc1ccccc1CCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819010919	DG	On-Demand	Anodyne	ADRB3	62	38
CN(C)CCOc1ccc(CNC[C@H](O)c2ccc(Br)cc2)cc1	ZINC000819010928	GG	On-Demand	Anodyne	ADRB2	17	42
CN(C)CCOc1ccc(CNC[C@H](O)c2ccc(Br)cc2)cc1	ZINC000819010928	GG	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1ccc(CNC[C@@H](O)c2ccc(Br)cc2)cc1	ZINC000819010929	GG	On-Demand	Anodyne	ADRB2	17	42
CN(C)CCOc1ccc(CNC[C@@H](O)c2ccc(Br)cc2)cc1	ZINC000819010929	GG	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1cccc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819010936	GD	On-Demand	Anodyne	ADRB3	39	41
CN(C)CCOc1cccc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819010938	GD	On-Demand	Anodyne	ADRB3	39	41
CN(C)CCOc1cccc(CNC[C@H](O)c2ccccc2Cl)c1	ZINC000819010948	EG	On-Demand	Anodyne	PDS	48	37
CCOc1ccccc1CCNC[C@@H](O)c1ccccc1C	ZINC000819010950	CG	On-Demand	Anodyne	ADRB2	43	44
CCOc1ccccc1CCNC[C@@H](O)c1ccccc1C	ZINC000819010950	CG	On-Demand	Anodyne	ADRB1	34	44
CCOc1ccccc1CCNC[C@H](O)c1ccccc1C	ZINC000819010952	CG	On-Demand	Anodyne	ADRB2	43	44
CCOc1ccccc1CCNC[C@H](O)c1ccccc1C	ZINC000819010952	CG	On-Demand	Anodyne	ADRB1	34	44
Cc1nn(C)cc1[C@@H](C)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819010959	FE	On-Demand	Anodyne	GPR119	38	44
Cc1nn(C)cc1[C@@H](C)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819010960	FE	On-Demand	Anodyne	GPR119	38	44
Cc1nn(C)cc1[C@H](C)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819010961	FE	On-Demand	Anodyne	GPR119	38	44
Cc1nn(C)cc1[C@H](C)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819010962	FE	On-Demand	Anodyne	GPR119	38	44
CCOc1ccccc1CCNC[C@H](O)c1ccccc1Br	ZINC000819010963	FH	On-Demand	Anodyne	ADRB2	30	43
CCOc1ccccc1CCNC[C@H](O)c1ccccc1Br	ZINC000819010963	FH	On-Demand	Anodyne	ADRB1	26	43
CCOc1ccccc1CCNC[C@@H](O)c1ccccc1Br	ZINC000819010965	FH	On-Demand	Anodyne	ADRB2	30	43
CCOc1ccccc1CCNC[C@@H](O)c1ccccc1Br	ZINC000819010965	FH	On-Demand	Anodyne	ADRB1	26	43
CCOc1ccccc1CCNC[C@H](O)c1ccc(F)cc1Cl	ZINC000819010974	EH	On-Demand	Anodyne	ADRB2	40	44
CCOc1ccccc1CCNC[C@H](O)c1ccc(F)cc1Cl	ZINC000819010974	EH	On-Demand	Anodyne	ADRB1	42	44
CCOc1ccccc1CCNC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819010975	EH	On-Demand	Anodyne	ADRB2	40	44
CCOc1ccccc1CCNC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819010975	EH	On-Demand	Anodyne	ADRB1	42	44
O=C(C(F)=C1CCC1)N1CCN(S(=O)(=O)c2c(F)cccc2F)CC1	ZINC000819010979	FE	On-Demand	Anodyne	PKM	32	59
O=C(/C=C\[C@@H]1CCCO1)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1	ZINC000819011018	GH	On-Demand	Anodyne	CHRM3	16	43
O=C(/C=C\[C@@H]1CCCO1)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1	ZINC000819011018	GH	On-Demand	Anodyne	NPY2R	35	45
O=C(/C=C\[C@@H]1CCCO1)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1	ZINC000819011018	GH	On-Demand	Anodyne	CYP2J2	59	42
O=C(/C=C\[C@H]1CCCO1)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1	ZINC000819011020	GH	On-Demand	Anodyne	CHRM3	16	43
O=C(/C=C\[C@H]1CCCO1)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1	ZINC000819011020	GH	On-Demand	Anodyne	NPY2R	35	45
O=C(/C=C\[C@H]1CCCO1)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1	ZINC000819011020	GH	On-Demand	Anodyne	CYP2J2	59	42
O=C(/C=C/[C@H]1CCCO1)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1	ZINC000819011022	GH	On-Demand	Anodyne	CHRM3	16	43
O=C(/C=C/[C@H]1CCCO1)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1	ZINC000819011022	GH	On-Demand	Anodyne	NPY2R	35	45
O=C(/C=C/[C@H]1CCCO1)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1	ZINC000819011022	GH	On-Demand	Anodyne	CYP2J2	59	42
O=C(/C=C/[C@@H]1CCCO1)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1	ZINC000819011024	GH	On-Demand	Anodyne	CHRM3	16	43
O=C(/C=C/[C@@H]1CCCO1)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1	ZINC000819011024	GH	On-Demand	Anodyne	NPY2R	35	45
O=C(/C=C/[C@@H]1CCCO1)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1	ZINC000819011024	GH	On-Demand	Anodyne	CYP2J2	59	42
CN(C)CCOc1cccc(CNC[C@H](O)c2cccc3ccccc23)c1	ZINC000819011033	FH	On-Demand	Anodyne	ESRRG	43	32
CN(C)CCOc1cccc(CNC[C@H](O)c2cccc3ccccc23)c1	ZINC000819011033	FH	On-Demand	Anodyne	PDS	47	34
C[C@@H](CC(=O)N(C)CC(=O)Nc1ccccc1Cl)n1cccn1	ZINC000819011034	EF	On-Demand	Anodyne	EPHB3	51	39
O=C(/C=C\[C@H]1CCCO1)N1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1	ZINC000819011058	GG	On-Demand	Anodyne	CXCR3	15	40
O=C(/C=C/[C@H]1CCCO1)N1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1	ZINC000819011060	GG	On-Demand	Anodyne	CXCR3	15	40
O=C(/C=C/[C@@H]1CCCO1)N1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1	ZINC000819011062	GG	On-Demand	Anodyne	CXCR3	15	40
O=C(/C=C\[C@@H]1CCCO1)N1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1	ZINC000819011063	GG	On-Demand	Anodyne	CXCR3	15	40
O=C(COC(=O)CSc1ccccc1[N+](=O)[O-])NNC(=O)c1ccccc1	ZINC000819011070	GD	On-Demand	Reactive	GSTM2	41	39
CCOc1ccccc1CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819011074	EH	On-Demand	Anodyne	ADRB2	51	43
CCOc1ccccc1CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819011074	EH	On-Demand	Anodyne	ADRB1	45	39
CCOc1ccccc1CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819011074	EH	On-Demand	Anodyne	ADRB3	52	38
CCOc1ccccc1CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819011075	EH	On-Demand	Anodyne	ADRB2	51	43
CCOc1ccccc1CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819011075	EH	On-Demand	Anodyne	ADRB1	45	39
CCOc1ccccc1CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819011075	EH	On-Demand	Anodyne	ADRB3	52	38
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCCc2ccccc2)c1	ZINC000819011076	EH	On-Demand	Bother	ADRB2	78	51
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCCc2ccccc2)c1	ZINC000819011076	EH	On-Demand	Bother	ADRB1	81	51
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCCc2ccccc2)c1	ZINC000819011076	EH	On-Demand	Bother	ADRB3	116	51
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCCc2ccccc2)c1	ZINC000819011076	EH	On-Demand	Bother	CACNA1D	21	40
O=[N+]([O-])c1cccc([C@H](O)CNCCCCCc2ccccc2)c1	ZINC000819011078	EH	On-Demand	Bother	ADRB2	78	51
O=[N+]([O-])c1cccc([C@H](O)CNCCCCCc2ccccc2)c1	ZINC000819011078	EH	On-Demand	Bother	ADRB1	81	51
O=[N+]([O-])c1cccc([C@H](O)CNCCCCCc2ccccc2)c1	ZINC000819011078	EH	On-Demand	Bother	ADRB3	116	51
O=[N+]([O-])c1cccc([C@H](O)CNCCCCCc2ccccc2)c1	ZINC000819011078	EH	On-Demand	Bother	CACNA1D	21	40
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H](CN1CCCCC1)c1ccccc1	ZINC000819011080	GG	On-Demand	Anodyne	OPRK1	15	40
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H](CN1CCCCC1)c1ccccc1	ZINC000819011080	GG	On-Demand	Anodyne	KCNQ2	40	34
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H](CN1CCCCC1)c1ccccc1	ZINC000819011082	GG	On-Demand	Anodyne	OPRK1	15	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H](CN1CCCCC1)c1ccccc1	ZINC000819011082	GG	On-Demand	Anodyne	KCNQ2	40	34
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H](CN1CCCCC1)c1ccccc1	ZINC000819011083	GG	On-Demand	Anodyne	OPRK1	15	40
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H](CN1CCCCC1)c1ccccc1	ZINC000819011083	GG	On-Demand	Anodyne	KCNQ2	40	34
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H](CN1CCCCC1)c1ccccc1	ZINC000819011084	GG	On-Demand	Anodyne	OPRK1	15	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H](CN1CCCCC1)c1ccccc1	ZINC000819011084	GG	On-Demand	Anodyne	KCNQ2	40	34
CCOc1ccccc1CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819011091	GG	On-Demand	Anodyne	GPR119	46	50
CCOc1ccccc1CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819011093	GG	On-Demand	Anodyne	GPR119	46	50
CC(C)c1ccc(S(=O)(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1	ZINC000819011104	GE	On-Demand	Anodyne	TGM2	60	38
CC(C)c1ccc(S(=O)(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1	ZINC000819011104	GE	On-Demand	Anodyne	F13A1	51	38
CC(C)c1ccc(S(=O)(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1	ZINC000819011106	GE	On-Demand	Anodyne	TGM2	60	38
CC(C)c1ccc(S(=O)(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1	ZINC000819011106	GE	On-Demand	Anodyne	F13A1	51	38
CC(C)c1ccc(S(=O)(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1	ZINC000819011109	GE	On-Demand	Anodyne	TGM2	60	38
CC(C)c1ccc(S(=O)(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1	ZINC000819011109	GE	On-Demand	Anodyne	F13A1	51	38
CC(C)c1ccc(S(=O)(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1	ZINC000819011111	GE	On-Demand	Anodyne	TGM2	60	38
CC(C)c1ccc(S(=O)(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1	ZINC000819011111	GE	On-Demand	Anodyne	F13A1	51	38
CCOc1ccccc1CCNC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819011170	GG	On-Demand	Anodyne	HCN1	62	36
CCOc1ccccc1CCNC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819011170	GG	On-Demand	Anodyne	HCN4	46	36
CCOc1ccccc1CCNC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819011171	GG	On-Demand	Anodyne	HCN1	62	36
CCOc1ccccc1CCNC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819011171	GG	On-Demand	Anodyne	HCN4	46	36
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011172	FE	On-Demand	Mild	ADRB2	51	60
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011172	FE	On-Demand	Mild	ADRB1	91	60
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011172	FE	On-Demand	Mild	GRIN1	28	42
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011172	FE	On-Demand	Mild	ADRB3	56	60
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011174	FE	On-Demand	Mild	ADRB2	51	60
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011174	FE	On-Demand	Mild	ADRB1	91	60
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011174	FE	On-Demand	Mild	GRIN1	28	42
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011174	FE	On-Demand	Mild	ADRB3	56	60
Cc1csc([C@H](C)NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000819011175	FG	On-Demand	Anodyne	GPR119	38	42
Cc1csc([C@H](C)NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000819011180	FG	On-Demand	Anodyne	GPR119	38	42
CN(C)CCOc1cccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819011185	GG	On-Demand	Anodyne	GALR3	49	40
CN(C)CCOc1cccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819011185	GG	On-Demand	Anodyne	PDS	48	42
CN(C)CCOc1cccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819011187	GG	On-Demand	Anodyne	GALR3	49	40
CN(C)CCOc1cccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819011187	GG	On-Demand	Anodyne	PDS	48	42
N#CCOc1ccc(CNC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819011191	ED	On-Demand	Mild	ADRB2	39	47
N#CCOc1ccc(CNC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819011191	ED	On-Demand	Mild	ADRB1	69	47
N#CCOc1ccc(CNC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819011191	ED	On-Demand	Mild	ADRB3	40	47
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819011196	ED	On-Demand	Mild	ADRB2	39	47
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819011196	ED	On-Demand	Mild	ADRB1	69	47
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819011196	ED	On-Demand	Mild	ADRB3	40	47
NCCOc1cccc(NC(=O)[C@H]2COCCN2)c1	ZINC000819011208	CB	On-Demand	Anodyne	EPHX2	21	45
NCCOc1cccc(NC(=O)[C@@H]2COCCN2)c1	ZINC000819011210	CB	On-Demand	Anodyne	EPHX2	21	45
CCOc1ccccc1CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819011219	DH	On-Demand	Anodyne	ADRB2	55	42
CCOc1ccccc1CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819011219	DH	On-Demand	Anodyne	ADRB1	53	43
CCOc1ccccc1CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819011219	DH	On-Demand	Anodyne	ADRB3	58	39
CN(C)CCOc1ccc(CNC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819011221	EE	On-Demand	Mild	ESRRG	44	36
CN(C)CCOc1ccc(CNC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819011223	EE	On-Demand	Mild	ESRRG	44	36
CN(C)CCOc1ccc(CNC[C@H](O)c2cccc3ccccc23)cc1	ZINC000819011224	FH	On-Demand	Anodyne	LTA4H	17	46
CN(C)CCOc1ccc(CNC[C@H](O)c2cccc3ccccc23)cc1	ZINC000819011224	FH	On-Demand	Anodyne	ESRRG	51	38
C=CCCn1cc(C(=O)N(C)CC(=O)Nc2ccccc2Cl)nn1	ZINC000819011225	EE	On-Demand	Mild	EPHB3	43	35
NCCc1ccc(CNC(=O)[C@H]2COCCN2)cc1	ZINC000819011244	CB	On-Demand	Anodyne	SPHK1	25	40
NCCc1ccc(CNC(=O)[C@@H]2COCCN2)cc1	ZINC000819011245	CB	On-Demand	Anodyne	SPHK1	25	40
C[C@H](CNC[C@@H](O)c1cccnc1)N(C)C1CC1	ZINC000819011253	BD	On-Demand	Anodyne	ADRB2	20	43
C[C@H](CNC[C@@H](O)c1cccnc1)N(C)C1CC1	ZINC000819011253	BD	On-Demand	Anodyne	ADRB1	22	43
C[C@H](CNC[C@@H](O)c1cccnc1)N(C)C1CC1	ZINC000819011253	BD	On-Demand	Anodyne	ADRB3	89	50
C[C@@H](CNC[C@H](O)c1cccnc1)N(C)C1CC1	ZINC000819011254	BD	On-Demand	Anodyne	ADRB2	20	43
C[C@@H](CNC[C@H](O)c1cccnc1)N(C)C1CC1	ZINC000819011254	BD	On-Demand	Anodyne	ADRB1	22	43
C[C@@H](CNC[C@H](O)c1cccnc1)N(C)C1CC1	ZINC000819011254	BD	On-Demand	Anodyne	ADRB3	89	50
C[C@H](CNC[C@H](O)c1cccnc1)N(C)C1CC1	ZINC000819011256	BD	On-Demand	Anodyne	ADRB2	20	43
C[C@H](CNC[C@H](O)c1cccnc1)N(C)C1CC1	ZINC000819011256	BD	On-Demand	Anodyne	ADRB1	22	43
C[C@H](CNC[C@H](O)c1cccnc1)N(C)C1CC1	ZINC000819011256	BD	On-Demand	Anodyne	ADRB3	89	50
C[C@@H](CNC[C@@H](O)c1cccnc1)N(C)C1CC1	ZINC000819011258	BD	On-Demand	Anodyne	ADRB2	20	43
C[C@@H](CNC[C@@H](O)c1cccnc1)N(C)C1CC1	ZINC000819011258	BD	On-Demand	Anodyne	ADRB1	22	43
C[C@@H](CNC[C@@H](O)c1cccnc1)N(C)C1CC1	ZINC000819011258	BD	On-Demand	Anodyne	ADRB3	89	50
CC(=O)Nc1cccc(CC(=O)NNC(=O)Cn2nc(C)cc2C)c1	ZINC000819011259	EC	On-Demand	Reactive	FPR2	15	45
N#CCOc1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819011262	FE	On-Demand	Mild	ADRB2	35	51
N#CCOc1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819011262	FE	On-Demand	Mild	ADRB1	62	51
N#CCOc1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819011262	FE	On-Demand	Mild	ADRB3	40	51
N#CCOc1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819011262	FE	On-Demand	Mild	ACR	16	41
N#CCOc1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819011262	FE	On-Demand	Mild	PDS	28	46
N#CCOc1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819011264	FE	On-Demand	Mild	ADRB2	35	51
N#CCOc1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819011264	FE	On-Demand	Mild	ADRB1	62	51
N#CCOc1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819011264	FE	On-Demand	Mild	ADRB3	40	51
N#CCOc1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819011264	FE	On-Demand	Mild	ACR	16	41
N#CCOc1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819011264	FE	On-Demand	Mild	PDS	28	46
N#CCOc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819011266	CD	On-Demand	Mild	ADRB2	34	48
N#CCOc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819011266	CD	On-Demand	Mild	ADRB1	37	48
N#CCOc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819011266	CD	On-Demand	Mild	ADRB3	105	50
N#CCOc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819011272	CD	On-Demand	Mild	ADRB2	34	48
N#CCOc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819011272	CD	On-Demand	Mild	ADRB1	37	48
N#CCOc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819011272	CD	On-Demand	Mild	ADRB3	105	50
CN(C)CCOc1cccc(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819011282	GG	On-Demand	Anodyne	PDS	44	38
CN(C)CCOc1cccc(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819011283	GG	On-Demand	Anodyne	PDS	44	38
CCOc1ccccc1CCNC[C@H](O)c1cccc(Br)c1	ZINC000819011285	FH	On-Demand	Anodyne	ADRB2	57	43
CCOc1ccccc1CCNC[C@H](O)c1cccc(Br)c1	ZINC000819011285	FH	On-Demand	Anodyne	ADRB1	54	43
CCOc1ccccc1CCNC[C@H](O)c1cccc(Br)c1	ZINC000819011285	FH	On-Demand	Anodyne	ADRB3	66	42
CCOc1ccccc1CCNC[C@@H](O)c1cccc(Br)c1	ZINC000819011287	FH	On-Demand	Anodyne	ADRB2	57	43
CCOc1ccccc1CCNC[C@@H](O)c1cccc(Br)c1	ZINC000819011287	FH	On-Demand	Anodyne	ADRB1	54	43
CCOc1ccccc1CCNC[C@@H](O)c1cccc(Br)c1	ZINC000819011287	FH	On-Demand	Anodyne	ADRB3	66	42
CON(C)C(=O)CCNCCCCCc1ccccc1	ZINC000819011288	CE	On-Demand	Anodyne	TPR	16	41
CON(C)C(=O)CCNCCCCCc1ccccc1	ZINC000819011288	CE	On-Demand	Anodyne	SIGMAR1	18	55
CON(C)C(=O)CCNCCCCCc1ccccc1	ZINC000819011288	CE	On-Demand	Anodyne	S1PR3	20	50
CON(C)C(=O)CCNCCCCCc1ccccc1	ZINC000819011288	CE	On-Demand	Anodyne	FAAH	76	43
CON(C)C(=O)CCNCCCCCc1ccccc1	ZINC000819011288	CE	On-Demand	Anodyne	S1PR2	29	50
CON(C)C(=O)CCNCCCCCc1ccccc1	ZINC000819011288	CE	On-Demand	Anodyne	CES1	69	41
CON(C)C(=O)CCNCCCCCc1ccccc1	ZINC000819011288	CE	On-Demand	Anodyne	AMP1_PLAFQ	21	40
CON(C)C(=O)CCNCCCCCc1ccccc1	ZINC000819011288	CE	On-Demand	Anodyne	CES1D	55	35
N#CCOc1ccc(CNC[C@H](O)COc2ccc(Br)cc2)cc1	ZINC000819011293	GF	On-Demand	Mild	ADRB2	37	46
N#CCOc1ccc(CNC[C@H](O)COc2ccc(Br)cc2)cc1	ZINC000819011293	GF	On-Demand	Mild	ADRB1	63	46
N#CCOc1ccc(CNC[C@H](O)COc2ccc(Br)cc2)cc1	ZINC000819011293	GF	On-Demand	Mild	ADRB3	39	46
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(Br)cc2)cc1	ZINC000819011294	GF	On-Demand	Mild	ADRB2	37	46
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(Br)cc2)cc1	ZINC000819011294	GF	On-Demand	Mild	ADRB1	63	46
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(Br)cc2)cc1	ZINC000819011294	GF	On-Demand	Mild	ADRB3	39	46
COc1nc(C)cc(C)c1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819011295	EE	On-Demand	Bother	CACNA1C	54	37
COc1nc(C)cc(C)c1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819011295	EE	On-Demand	Bother	CACNA1D	84	36
COc1nc(C)cc(C)c1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819011296	EE	On-Demand	Bother	CACNA1C	54	37
COc1nc(C)cc(C)c1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819011296	EE	On-Demand	Bother	CACNA1D	84	36
CCOc1ccccc1CCNC[C@H](O)c1ccc(F)cc1	ZINC000819011297	DG	On-Demand	Anodyne	ADRB2	63	45
CCOc1ccccc1CCNC[C@H](O)c1ccc(F)cc1	ZINC000819011297	DG	On-Demand	Anodyne	ADRB1	53	45
CCOc1ccccc1CCNC[C@H](O)c1ccc(F)cc1	ZINC000819011297	DG	On-Demand	Anodyne	ADRB3	56	42
CCOc1ccccc1CCNC[C@@H](O)c1ccc(F)cc1	ZINC000819011298	DG	On-Demand	Anodyne	ADRB2	63	45
CCOc1ccccc1CCNC[C@@H](O)c1ccc(F)cc1	ZINC000819011298	DG	On-Demand	Anodyne	ADRB1	53	45
CCOc1ccccc1CCNC[C@@H](O)c1ccc(F)cc1	ZINC000819011298	DG	On-Demand	Anodyne	ADRB3	56	42
CCOc1ccccc1CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819011329	FE	On-Demand	Anodyne	ADRB2	74	43
CCOc1ccccc1CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819011329	FE	On-Demand	Anodyne	ADRB1	62	42
CCOc1ccccc1CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819011329	FE	On-Demand	Anodyne	ADRB3	113	41
CCOc1ccccc1CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819011330	FE	On-Demand	Anodyne	ADRB2	74	43
CCOc1ccccc1CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819011330	FE	On-Demand	Anodyne	ADRB1	62	42
CCOc1ccccc1CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819011330	FE	On-Demand	Anodyne	ADRB3	113	41
N#CCOc1ccc(CNC[C@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819011331	GG	On-Demand	Mild	ADRB2	38	42
N#CCOc1ccc(CNC[C@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819011331	GG	On-Demand	Mild	ADRB1	69	41
N#CCOc1ccc(CNC[C@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819011331	GG	On-Demand	Mild	ADRB3	32	42
N#CCOc1ccc(CNC[C@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819011331	GG	On-Demand	Mild	CASR	43	41
N#CCOc1ccc(CNC[C@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819011331	GG	On-Demand	Mild	CYP2D6	17	41
N#CCOc1ccc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819011332	GG	On-Demand	Mild	ADRB2	38	42
N#CCOc1ccc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819011332	GG	On-Demand	Mild	ADRB1	69	41
N#CCOc1ccc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819011332	GG	On-Demand	Mild	ADRB3	32	42
N#CCOc1ccc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819011332	GG	On-Demand	Mild	CASR	43	41
N#CCOc1ccc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819011332	GG	On-Demand	Mild	CYP2D6	17	41
CN(Cc1ccc(Cl)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819011350	GH	On-Demand	Mild	CTSB	28	43
CN(Cc1ccc(Cl)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819011350	GH	On-Demand	Mild	PAPA1_CARPA	55	45
CN(Cc1ccc(Cl)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819011350	GH	On-Demand	Mild	CTSK	16	41
CN(Cc1ccc(Cl)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819011350	GH	On-Demand	Mild	FPR1	38	43
CN(Cc1ccc(Cl)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819011351	GH	On-Demand	Mild	CTSB	28	43
CN(Cc1ccc(Cl)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819011351	GH	On-Demand	Mild	PAPA1_CARPA	55	45
CN(Cc1ccc(Cl)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819011351	GH	On-Demand	Mild	CTSK	16	41
CN(Cc1ccc(Cl)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819011351	GH	On-Demand	Mild	FPR1	38	43
C=CCCn1cc(C(=O)N(C)CC(=O)Nc2ccc(N3CCOCC3)cc2)nn1	ZINC000819011361	GD	On-Demand	Mild	STAT6	51	31
N#CCOc1ccc(CNC[C@@H](O)CO[C@@H]2CCCc3ccccc32)cc1	ZINC000819011435	FG	On-Demand	Mild	ADRB1	45	36
N#CCOc1ccc(CNC[C@@H](O)CO[C@H]2CCCc3ccccc32)cc1	ZINC000819011436	FG	On-Demand	Mild	ADRB1	45	36
N#CCOc1ccc(CNC[C@H](O)CO[C@@H]2CCCc3ccccc32)cc1	ZINC000819011437	FG	On-Demand	Mild	ADRB1	45	36
N#CCOc1ccc(CNC[C@H](O)CO[C@H]2CCCc3ccccc32)cc1	ZINC000819011438	FG	On-Demand	Mild	ADRB1	45	36
CN(C)CCOc1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819011439	EG	On-Demand	Anodyne	ADRB2	31	42
CN(C)CCOc1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819011439	EG	On-Demand	Anodyne	ADRB1	50	49
CN(C)CCOc1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819011439	EG	On-Demand	Anodyne	ADRB3	58	49
CN(C)CCOc1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819011440	EG	On-Demand	Anodyne	ADRB2	31	42
CN(C)CCOc1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819011440	EG	On-Demand	Anodyne	ADRB1	50	49
CN(C)CCOc1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819011440	EG	On-Demand	Anodyne	ADRB3	58	49
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)c1	ZINC000819011443	FE	On-Demand	Mild	ADRB2	49	43
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)c1	ZINC000819011443	FE	On-Demand	Mild	ADRB1	84	43
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)c1	ZINC000819011443	FE	On-Demand	Mild	ADRB3	52	43
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)c1	ZINC000819011443	FE	On-Demand	Mild	CASR	41	36
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)c1	ZINC000819011443	FE	On-Demand	Mild	ABCB1	25	47
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)c1	ZINC000819011443	FE	On-Demand	Mild	PDS	57	39
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)c1	ZINC000819011444	FE	On-Demand	Mild	ADRB2	49	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)c1	ZINC000819011444	FE	On-Demand	Mild	ADRB1	84	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)c1	ZINC000819011444	FE	On-Demand	Mild	ADRB3	52	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)c1	ZINC000819011444	FE	On-Demand	Mild	CASR	41	36
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)c1	ZINC000819011444	FE	On-Demand	Mild	ABCB1	25	47
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)c1	ZINC000819011444	FE	On-Demand	Mild	PDS	57	39
CN(C)CCOc1ccc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819011446	GD	On-Demand	Anodyne	ADRB2	21	40
CN(C)CCOc1ccc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819011446	GD	On-Demand	Anodyne	ADRB3	31	40
CN(C)CCOc1ccc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819011447	GD	On-Demand	Anodyne	ADRB2	21	40
CN(C)CCOc1ccc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819011447	GD	On-Demand	Anodyne	ADRB3	31	40
CCOc1ccccc1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819011455	EF	On-Demand	Bother	ADRB2	51	42
CCOc1ccccc1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819011455	EF	On-Demand	Bother	ADRB1	55	42
CCOc1ccccc1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819011455	EF	On-Demand	Bother	CACNA1C	45	35
CCOc1ccccc1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819011455	EF	On-Demand	Bother	ADRB3	74	39
CCOc1ccccc1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819011455	EF	On-Demand	Bother	CACNA1D	68	35
CCOc1ccccc1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819011456	EF	On-Demand	Bother	ADRB2	51	42
CCOc1ccccc1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819011456	EF	On-Demand	Bother	ADRB1	55	42
CCOc1ccccc1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819011456	EF	On-Demand	Bother	CACNA1C	45	35
CCOc1ccccc1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819011456	EF	On-Demand	Bother	ADRB3	74	39
CCOc1ccccc1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819011456	EF	On-Demand	Bother	CACNA1D	68	35
CCOc1ccccc1CCNC[C@H](O)c1ccc(Br)cc1	ZINC000819011458	FH	On-Demand	Anodyne	ADRB2	49	45
CCOc1ccccc1CCNC[C@H](O)c1ccc(Br)cc1	ZINC000819011458	FH	On-Demand	Anodyne	ADRB1	38	42
CCOc1ccccc1CCNC[C@H](O)c1ccc(Br)cc1	ZINC000819011458	FH	On-Demand	Anodyne	ADRB3	42	37
CCOc1ccccc1CCNC[C@@H](O)c1ccc(Br)cc1	ZINC000819011459	FH	On-Demand	Anodyne	ADRB2	49	45
CCOc1ccccc1CCNC[C@@H](O)c1ccc(Br)cc1	ZINC000819011459	FH	On-Demand	Anodyne	ADRB1	38	42
CCOc1ccccc1CCNC[C@@H](O)c1ccc(Br)cc1	ZINC000819011459	FH	On-Demand	Anodyne	ADRB3	42	37
CCOc1ccccc1CCNC[C@H](O)c1ccccc1Cl	ZINC000819011470	DH	On-Demand	Anodyne	ADRB2	38	43
CCOc1ccccc1CCNC[C@H](O)c1ccccc1Cl	ZINC000819011470	DH	On-Demand	Anodyne	ADRB1	42	43
CN(C)CCOc1cccc(CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819011479	EG	On-Demand	Anodyne	UTS2	45	35
CCOc1ccccc1CCNC[C@H](O)c1cc(F)ccc1F	ZINC000819011502	DG	On-Demand	Anodyne	ADRB2	32	43
CCOc1ccccc1CCNC[C@H](O)c1cc(F)ccc1F	ZINC000819011502	DG	On-Demand	Anodyne	ADRB1	36	43
CCOc1ccccc1CCNC[C@@H](O)c1cc(F)ccc1F	ZINC000819011503	DG	On-Demand	Anodyne	ADRB2	32	43
CCOc1ccccc1CCNC[C@@H](O)c1cc(F)ccc1F	ZINC000819011503	DG	On-Demand	Anodyne	ADRB1	36	43
Cc1ccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011514	EE	On-Demand	Mild	ADRB2	47	52
Cc1ccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011514	EE	On-Demand	Mild	ADRB1	68	47
Cc1ccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011514	EE	On-Demand	Mild	ADRB3	42	46
Cc1ccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011515	EE	On-Demand	Mild	ADRB2	47	52
Cc1ccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011515	EE	On-Demand	Mild	ADRB1	68	47
Cc1ccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011515	EE	On-Demand	Mild	ADRB3	42	46
CN(C)CCOc1cccc(CNCCS(C)(=O)=O)c1	ZINC000819011516	DC	On-Demand	Anodyne	SQLE	42	34
CN(C)CCOc1cccc(CNCC2(O)CCCCC2)c1	ZINC000819011517	DE	On-Demand	Anodyne	ESRRG	43	32
CN(C)CCOc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819011521	DD	On-Demand	Anodyne	ADRB2	26	46
CN(C)CCOc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819011521	DD	On-Demand	Anodyne	ADRB1	36	46
CN(C)CCOc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819011521	DD	On-Demand	Anodyne	ADRB3	95	51
CN(C)CCOc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819011522	DD	On-Demand	Anodyne	ADRB2	26	46
CN(C)CCOc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819011522	DD	On-Demand	Anodyne	ADRB1	36	46
CN(C)CCOc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819011522	DD	On-Demand	Anodyne	ADRB3	95	51
CCOc1ccccc1CCNC[C@H](O)C1CC1	ZINC000819011526	BD	On-Demand	Anodyne	ADRB2	20	42
CCOc1ccccc1CCNC[C@@H](O)C1CC1	ZINC000819011527	BD	On-Demand	Anodyne	ADRB2	20	42
COc1ccc(-c2csc(NC(=O)COC(=O)CSc3ccccc3[N+](=O)[O-])n2)cc1	ZINC000819011584	JI	On-Demand	Bother	ROCK1	21	42
CC(C)c1ccc(CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819011588	GI	On-Demand	Mild	CTSB	32	42
CC(C)c1ccc(CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819011588	GI	On-Demand	Mild	PAPA1_CARPA	54	44
CC(C)c1ccc(CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819011588	GI	On-Demand	Mild	CTSK	19	42
CC(C)c1ccc(CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819011588	GI	On-Demand	Mild	FPR1	45	37
CC(C)c1ccc(CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819011589	GI	On-Demand	Mild	CTSB	32	42
CC(C)c1ccc(CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819011589	GI	On-Demand	Mild	PAPA1_CARPA	54	44
CC(C)c1ccc(CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819011589	GI	On-Demand	Mild	CTSK	19	42
CC(C)c1ccc(CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819011589	GI	On-Demand	Mild	FPR1	45	37
O=C(/C=C\[C@H]1CCCO1)NCC1(N2CCCCC2)CCCCC1	ZINC000819011590	DG	On-Demand	Anodyne	HCN1	53	33
O=C(/C=C\[C@H]1CCCO1)NCC1(N2CCCCC2)CCCCC1	ZINC000819011590	DG	On-Demand	Anodyne	HCN4	51	33
O=C(/C=C/[C@@H]1CCCO1)NCC1(N2CCCCC2)CCCCC1	ZINC000819011591	DG	On-Demand	Anodyne	HCN1	53	33
O=C(/C=C/[C@@H]1CCCO1)NCC1(N2CCCCC2)CCCCC1	ZINC000819011591	DG	On-Demand	Anodyne	HCN4	51	33
O=C(/C=C\[C@@H]1CCCO1)NCC1(N2CCCCC2)CCCCC1	ZINC000819011592	DG	On-Demand	Anodyne	HCN1	53	33
O=C(/C=C\[C@@H]1CCCO1)NCC1(N2CCCCC2)CCCCC1	ZINC000819011592	DG	On-Demand	Anodyne	HCN4	51	33
O=C(/C=C/[C@H]1CCCO1)NCC1(N2CCCCC2)CCCCC1	ZINC000819011593	DG	On-Demand	Anodyne	HCN1	53	33
O=C(/C=C/[C@H]1CCCO1)NCC1(N2CCCCC2)CCCCC1	ZINC000819011593	DG	On-Demand	Anodyne	HCN4	51	33
C[C@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)N(C)C1CC1	ZINC000819011606	FE	On-Demand	Anodyne	GPR119	29	43
C[C@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)N(C)C1CC1	ZINC000819011607	FE	On-Demand	Anodyne	GPR119	29	43
C[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)N(C)C1CC1	ZINC000819011608	FE	On-Demand	Anodyne	GPR119	29	43
C[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)N(C)C1CC1	ZINC000819011609	FE	On-Demand	Anodyne	GPR119	29	43
CN(C)CCOc1cccc(CNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819011629	GG	On-Demand	Anodyne	NR1H3	20	40
CN(C)CCOc1cccc(CNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819011629	GG	On-Demand	Anodyne	NR1H2	17	40
CN(C)CCOc1cccc(CNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819011629	GG	On-Demand	Anodyne	PDS	45	35
CN(C)CCOc1cccc(CNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819011630	GG	On-Demand	Anodyne	NR1H3	20	40
CN(C)CCOc1cccc(CNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819011630	GG	On-Demand	Anodyne	NR1H2	17	40
CN(C)CCOc1cccc(CNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819011630	GG	On-Demand	Anodyne	PDS	45	35
CN(C[C@@H](O)CN[C@@H](CN1CCCCC1)c1ccccc1)C(=O)OC(C)(C)C	ZINC000819011633	GG	On-Demand	Anodyne	OPRK1	21	40
CN(C[C@H](O)CN[C@@H](CN1CCCCC1)c1ccccc1)C(=O)OC(C)(C)C	ZINC000819011634	GG	On-Demand	Anodyne	OPRK1	21	40
CN(C[C@@H](O)CN[C@H](CN1CCCCC1)c1ccccc1)C(=O)OC(C)(C)C	ZINC000819011635	GG	On-Demand	Anodyne	OPRK1	21	40
CN(C[C@H](O)CN[C@H](CN1CCCCC1)c1ccccc1)C(=O)OC(C)(C)C	ZINC000819011636	GG	On-Demand	Anodyne	OPRK1	21	40
CN(C)CCOc1ccc(CNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819011642	FF	On-Demand	Anodyne	ESRRG	42	31
CN(C)CCOc1ccc(CNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819011643	FF	On-Demand	Anodyne	ESRRG	42	31
CON(C)C(=O)CCNCc1cccc(OCCN(C)C)c1	ZINC000819011646	DD	On-Demand	Anodyne	ROCK2	16	40
N#CCOc1ccc(CNC[C@H](O)COCc2ccccc2Cl)cc1	ZINC000819011658	FF	On-Demand	Mild	ADRB1	36	46
N#CCOc1ccc(CNC[C@H](O)COCc2ccccc2Cl)cc1	ZINC000819011658	FF	On-Demand	Mild	ADRB3	24	46
N#CCOc1ccc(CNC[C@@H](O)COCc2ccccc2Cl)cc1	ZINC000819011659	FF	On-Demand	Mild	ADRB1	36	46
N#CCOc1ccc(CNC[C@@H](O)COCc2ccccc2Cl)cc1	ZINC000819011659	FF	On-Demand	Mild	ADRB3	24	46
CN(C)CCOc1cccc(CNC[C@@H](O)c2cc3ccccc3o2)c1	ZINC000819011666	FG	On-Demand	Anodyne	PPARA	18	40
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011671	FD	On-Demand	Mild	CTSF	49	33
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011672	FD	On-Demand	Mild	CTSF	49	33
CN(CCOc1ccccc1)C(=O)C(F)=C1CCC1	ZINC000819011673	CF	On-Demand	Anodyne	FDPS	15	40
CN(CCOc1ccccc1)C(=O)C(F)=C1CCC1	ZINC000819011673	CF	On-Demand	Anodyne	LTA4H	32	44
CN(CCOc1ccccc1)C(=O)C(F)=C1CCC1	ZINC000819011673	CF	On-Demand	Anodyne	ESRRG	43	33
COc1nc(C)cc(C)c1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819011676	GF	On-Demand	Anodyne	GPR119	46	44
COc1nc(C)cc(C)c1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819011677	GF	On-Demand	Anodyne	GPR119	46	44
O=[N+]([O-])c1ccc([C@@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819011695	EH	On-Demand	Bother	ADRB2	80	51
O=[N+]([O-])c1ccc([C@@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819011695	EH	On-Demand	Bother	ADRB1	74	51
O=[N+]([O-])c1ccc([C@@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819011695	EH	On-Demand	Bother	ADRB3	92	51
O=[N+]([O-])c1ccc([C@@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819011695	EH	On-Demand	Bother	SIGMAR1	15	48
O=[N+]([O-])c1ccc([C@@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819011695	EH	On-Demand	Bother	S1PR2	23	44
O=[N+]([O-])c1ccc([C@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819011696	EH	On-Demand	Bother	ADRB2	80	51
O=[N+]([O-])c1ccc([C@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819011696	EH	On-Demand	Bother	ADRB1	74	51
O=[N+]([O-])c1ccc([C@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819011696	EH	On-Demand	Bother	ADRB3	92	51
O=[N+]([O-])c1ccc([C@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819011696	EH	On-Demand	Bother	SIGMAR1	15	48
O=[N+]([O-])c1ccc([C@H](O)CNCCCCCc2ccccc2)cc1	ZINC000819011696	EH	On-Demand	Bother	S1PR2	23	44
COc1nc(C)cc(C)c1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819011701	DG	On-Demand	Anodyne	ADRB1	30	43
COc1nc(C)cc(C)c1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819011701	DG	On-Demand	Anodyne	ADRB3	45	43
COc1nc(C)cc(C)c1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819011701	DG	On-Demand	Anodyne	CYP3A4	43	34
COc1nc(C)cc(C)c1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819011702	DG	On-Demand	Anodyne	ADRB1	30	43
COc1nc(C)cc(C)c1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819011702	DG	On-Demand	Anodyne	ADRB3	45	43
COc1nc(C)cc(C)c1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819011702	DG	On-Demand	Anodyne	CYP3A4	43	34
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011703	FE	On-Demand	Mild	ADRB2	46	45
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011703	FE	On-Demand	Mild	ADRB1	79	45
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011703	FE	On-Demand	Mild	ADRB3	47	45
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011703	FE	On-Demand	Mild	ABCB1	16	54
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011704	FE	On-Demand	Mild	ADRB2	46	45
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011704	FE	On-Demand	Mild	ADRB1	79	45
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011704	FE	On-Demand	Mild	ADRB3	47	45
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)cc1	ZINC000819011704	FE	On-Demand	Mild	ABCB1	16	54
N#CCOc1ccc(CNC[C@H](O)COc2ccccc2F)cc1	ZINC000819011705	EE	On-Demand	Mild	ADRB2	40	41
N#CCOc1ccc(CNC[C@H](O)COc2ccccc2F)cc1	ZINC000819011705	EE	On-Demand	Mild	ADRB1	67	45
N#CCOc1ccc(CNC[C@H](O)COc2ccccc2F)cc1	ZINC000819011705	EE	On-Demand	Mild	ADRB3	35	41
N#CCOc1ccc(CNC[C@H](O)COc2ccccc2F)cc1	ZINC000819011705	EE	On-Demand	Mild	CASR	42	40
N#CCOc1ccc(CNC[C@H](O)COc2ccccc2F)cc1	ZINC000819011705	EE	On-Demand	Mild	CYP2D6	17	40
N#CCOc1ccc(CNC[C@@H](O)COc2ccccc2F)cc1	ZINC000819011706	EE	On-Demand	Mild	ADRB2	40	41
N#CCOc1ccc(CNC[C@@H](O)COc2ccccc2F)cc1	ZINC000819011706	EE	On-Demand	Mild	ADRB1	67	45
N#CCOc1ccc(CNC[C@@H](O)COc2ccccc2F)cc1	ZINC000819011706	EE	On-Demand	Mild	ADRB3	35	41
N#CCOc1ccc(CNC[C@@H](O)COc2ccccc2F)cc1	ZINC000819011706	EE	On-Demand	Mild	CASR	42	40
N#CCOc1ccc(CNC[C@@H](O)COc2ccccc2F)cc1	ZINC000819011706	EE	On-Demand	Mild	CYP2D6	17	40
Cc1ccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)c(C)c1	ZINC000819011713	EF	On-Demand	Mild	ADRB2	34	43
Cc1ccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)c(C)c1	ZINC000819011713	EF	On-Demand	Mild	ADRB1	44	43
Cc1ccc(OC[C@H](O)CNCc2ccc(OCC#N)cc2)c(C)c1	ZINC000819011713	EF	On-Demand	Mild	CASR	41	37
Cc1ccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)c(C)c1	ZINC000819011714	EF	On-Demand	Mild	ADRB2	34	43
Cc1ccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)c(C)c1	ZINC000819011714	EF	On-Demand	Mild	ADRB1	44	43
Cc1ccc(OC[C@@H](O)CNCc2ccc(OCC#N)cc2)c(C)c1	ZINC000819011714	EF	On-Demand	Mild	CASR	41	37
O=C(CSc1ccccc1[N+](=O)[O-])OCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819011715	JE	On-Demand	Bother	SSTR1	49	51
N#CCOc1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819011804	CE	On-Demand	Mild	ADRB2	27	40
N#CCOc1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819011804	CE	On-Demand	Mild	ADRB1	37	40
N#CCOc1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819011804	CE	On-Demand	Mild	ADRB3	31	40
N#CCOc1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819011805	CE	On-Demand	Mild	ADRB2	27	40
N#CCOc1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819011805	CE	On-Demand	Mild	ADRB1	37	40
N#CCOc1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819011805	CE	On-Demand	Mild	ADRB3	31	40
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819011806	FE	On-Demand	Mild	ADRB2	39	47
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819011806	FE	On-Demand	Mild	ADRB1	65	47
N#CCOc1ccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819011806	FE	On-Demand	Mild	ADRB3	41	47
N#CCOc1ccc(CNC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819011807	FE	On-Demand	Mild	ADRB2	39	47
N#CCOc1ccc(CNC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819011807	FE	On-Demand	Mild	ADRB1	65	47
N#CCOc1ccc(CNC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819011807	FE	On-Demand	Mild	ADRB3	41	47
N#CCOc1ccc(CNC[C@@H](O)COCc2ccccc2)cc1	ZINC000819011822	EE	On-Demand	Mild	ADRB2	29	41
N#CCOc1ccc(CNC[C@@H](O)COCc2ccccc2)cc1	ZINC000819011822	EE	On-Demand	Mild	ADRB1	52	41
N#CCOc1ccc(CNC[C@@H](O)COCc2ccccc2)cc1	ZINC000819011822	EE	On-Demand	Mild	ADRB3	33	41
N#CCOc1ccc(CNC[C@H](O)COCc2ccccc2)cc1	ZINC000819011823	EE	On-Demand	Mild	ADRB2	29	41
N#CCOc1ccc(CNC[C@H](O)COCc2ccccc2)cc1	ZINC000819011823	EE	On-Demand	Mild	ADRB1	52	41
N#CCOc1ccc(CNC[C@H](O)COCc2ccccc2)cc1	ZINC000819011823	EE	On-Demand	Mild	ADRB3	33	41
CCOc1ccccc1CCNC[C@@H](O)c1cc2ccccc2o1	ZINC000819011824	EH	On-Demand	Anodyne	ADRB2	25	43
CCOc1ccccc1CCNC[C@@H](O)c1cc2ccccc2o1	ZINC000819011824	EH	On-Demand	Anodyne	ADRB1	15	43
CCOc1ccccc1CCNC[C@H](O)c1ccccc1F	ZINC000819011829	DG	On-Demand	Anodyne	ADRB2	32	43
CCOc1ccccc1CCNC[C@H](O)c1ccccc1F	ZINC000819011829	DG	On-Demand	Anodyne	ADRB1	30	43
CCOc1ccccc1CCNC[C@@H](O)c1ccccc1F	ZINC000819011830	DG	On-Demand	Anodyne	ADRB2	32	43
CCOc1ccccc1CCNC[C@@H](O)c1ccccc1F	ZINC000819011830	DG	On-Demand	Anodyne	ADRB1	30	43
N#CCOc1ccc(CNC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819011835	FF	On-Demand	Mild	ADRB2	30	55
N#CCOc1ccc(CNC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819011835	FF	On-Demand	Mild	ADRB1	64	55
N#CCOc1ccc(CNC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819011835	FF	On-Demand	Mild	ADRB3	25	55
N#CCOc1ccc(CNC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819011836	FF	On-Demand	Mild	ADRB2	30	55
N#CCOc1ccc(CNC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819011836	FF	On-Demand	Mild	ADRB1	64	55
N#CCOc1ccc(CNC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819011836	FF	On-Demand	Mild	ADRB3	25	55
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])c1ccccc1	ZINC000819011847	DH	On-Demand	Bother	GSTM2	55	33
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])c1ccccc1	ZINC000819011847	DH	On-Demand	Bother	COLA	101	40
N#CCOc1ccc(CNC[C@@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819011859	FF	On-Demand	Mild	ADRB2	18	40
N#CCOc1ccc(CNC[C@@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819011859	FF	On-Demand	Mild	ADRB1	34	41
N#CCOc1ccc(CNC[C@@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819011859	FF	On-Demand	Mild	ADRB3	22	40
N#CCOc1ccc(CNC[C@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819011860	FF	On-Demand	Mild	ADRB2	18	40
N#CCOc1ccc(CNC[C@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819011860	FF	On-Demand	Mild	ADRB1	34	41
N#CCOc1ccc(CNC[C@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819011860	FF	On-Demand	Mild	ADRB3	22	40
CN(C)CCOc1cccc(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819011866	FE	On-Demand	Bother	ACR	18	41
CN(C)CCOc1cccc(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819011867	FE	On-Demand	Bother	ACR	18	41
COc1nc(C)cc(C)c1CNC[C@H](O)c1cccnc1	ZINC000819011876	CD	On-Demand	Anodyne	ADRB2	20	43
COc1nc(C)cc(C)c1CNC[C@H](O)c1cccnc1	ZINC000819011876	CD	On-Demand	Anodyne	ADRB1	23	43
COc1nc(C)cc(C)c1CNC[C@H](O)c1cccnc1	ZINC000819011876	CD	On-Demand	Anodyne	ADRB3	83	43
COc1nc(C)cc(C)c1CNC[C@@H](O)c1cccnc1	ZINC000819011877	CD	On-Demand	Anodyne	ADRB2	20	43
COc1nc(C)cc(C)c1CNC[C@@H](O)c1cccnc1	ZINC000819011877	CD	On-Demand	Anodyne	ADRB1	23	43
COc1nc(C)cc(C)c1CNC[C@@H](O)c1cccnc1	ZINC000819011877	CD	On-Demand	Anodyne	ADRB3	83	43
Cc1csc([C@H](C)NC[C@@H](O)c2cccnc2)n1	ZINC000819011884	CE	On-Demand	Anodyne	ADRB2	21	45
Cc1csc([C@H](C)NC[C@@H](O)c2cccnc2)n1	ZINC000819011884	CE	On-Demand	Anodyne	ADRB1	23	45
Cc1csc([C@H](C)NC[C@@H](O)c2cccnc2)n1	ZINC000819011884	CE	On-Demand	Anodyne	ADRB3	75	49
Cc1csc([C@H](C)NC[C@H](O)c2cccnc2)n1	ZINC000819011885	CE	On-Demand	Anodyne	ADRB2	21	45
Cc1csc([C@H](C)NC[C@H](O)c2cccnc2)n1	ZINC000819011885	CE	On-Demand	Anodyne	ADRB1	23	45
Cc1csc([C@H](C)NC[C@H](O)c2cccnc2)n1	ZINC000819011885	CE	On-Demand	Anodyne	ADRB3	75	49
CCOc1ccccc1CCNC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819011889	EF	On-Demand	Anodyne	ADRB2	48	50
CCOc1ccccc1CCNC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819011889	EF	On-Demand	Anodyne	ADRB1	42	45
CCOc1ccccc1CCNC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819011889	EF	On-Demand	Anodyne	MTNR1A	40	45
CCOc1ccccc1CCNC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819011889	EF	On-Demand	Anodyne	MTNR1B	26	45
CCOc1ccccc1CCNC[C@H](O)c1cc(OC)ccc1OC	ZINC000819011890	EF	On-Demand	Anodyne	ADRB2	48	50
CCOc1ccccc1CCNC[C@H](O)c1cc(OC)ccc1OC	ZINC000819011890	EF	On-Demand	Anodyne	ADRB1	42	45
CCOc1ccccc1CCNC[C@H](O)c1cc(OC)ccc1OC	ZINC000819011890	EF	On-Demand	Anodyne	MTNR1A	40	45
CCOc1ccccc1CCNC[C@H](O)c1cc(OC)ccc1OC	ZINC000819011890	EF	On-Demand	Anodyne	MTNR1B	26	45
CC(=O)Nc1ccc(OC[C@@H](O)CNCCCN2CCOC2=O)cc1	ZINC000819012057	FC	On-Demand	Anodyne	ADRB2	47	53
CC(=O)Nc1ccc(OC[C@@H](O)CNCCCN2CCOC2=O)cc1	ZINC000819012057	FC	On-Demand	Anodyne	ADRB1	85	53
CC(=O)Nc1ccc(OC[C@@H](O)CNCCCN2CCOC2=O)cc1	ZINC000819012057	FC	On-Demand	Anodyne	GRIN1	28	44
CC(=O)Nc1ccc(OC[C@@H](O)CNCCCN2CCOC2=O)cc1	ZINC000819012057	FC	On-Demand	Anodyne	ADRB3	62	53
CC(=O)Nc1ccc(OC[C@H](O)CNCCCN2CCOC2=O)cc1	ZINC000819012058	FC	On-Demand	Anodyne	ADRB2	47	53
CC(=O)Nc1ccc(OC[C@H](O)CNCCCN2CCOC2=O)cc1	ZINC000819012058	FC	On-Demand	Anodyne	ADRB1	85	53
CC(=O)Nc1ccc(OC[C@H](O)CNCCCN2CCOC2=O)cc1	ZINC000819012058	FC	On-Demand	Anodyne	GRIN1	28	44
CC(=O)Nc1ccc(OC[C@H](O)CNCCCN2CCOC2=O)cc1	ZINC000819012058	FC	On-Demand	Anodyne	ADRB3	62	53
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)Cc1ccc(Cl)cc1	ZINC000819012102	DF	On-Demand	Reactive	AVPR1A	27	42
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)Cc1ccc(Cl)cc1	ZINC000819012102	DF	On-Demand	Reactive	P2RX7	19	42
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)Cc1ccc(Cl)cc1	ZINC000819012104	DF	On-Demand	Reactive	AVPR1A	27	42
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)Cc1ccc(Cl)cc1	ZINC000819012104	DF	On-Demand	Reactive	P2RX7	19	42
COc1cc(C(=O)NNC(=O)Cc2cccc(NC(C)=O)c2)ccc1OC(C)C	ZINC000819012127	GE	On-Demand	Reactive	TSHR	68	34
COc1cc(C(=O)NNC(=O)Cc2cccc(NC(C)=O)c2)ccc1OC(C)C	ZINC000819012127	GE	On-Demand	Reactive	CPT1A	45	31
COc1cc(C(=O)NNC(=O)Cc2cccc(NC(C)=O)c2)ccc1OC(C)C	ZINC000819012127	GE	On-Demand	Reactive	FLT4	21	40
COc1cc(C(=O)NNC(=O)Cc2cccc(NC(C)=O)c2)ccc1OC(C)C	ZINC000819012127	GE	On-Demand	Reactive	ENPP1	68	32
COc1cc(C(=O)NNC(=O)Cc2cccc(NC(C)=O)c2)ccc1OC(C)C	ZINC000819012127	GE	On-Demand	Reactive	KCNK3	99	41
COc1cc(C(=O)NNC(=O)Cc2cccc(NC(C)=O)c2)ccc1OC(C)C	ZINC000819012127	GE	On-Demand	Reactive	KCNK9	76	39
CCc1noc(-c2ccc(CCNC[C@H](O)c3cccnc3)cc2)n1	ZINC000819012132	EF	On-Demand	Anodyne	ADRB2	51	55
CCc1noc(-c2ccc(CCNC[C@H](O)c3cccnc3)cc2)n1	ZINC000819012132	EF	On-Demand	Anodyne	ADRB1	62	51
CCc1noc(-c2ccc(CCNC[C@H](O)c3cccnc3)cc2)n1	ZINC000819012132	EF	On-Demand	Anodyne	ADRB3	170	66
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cccnc3)cc2)n1	ZINC000819012133	EF	On-Demand	Anodyne	ADRB2	51	55
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cccnc3)cc2)n1	ZINC000819012133	EF	On-Demand	Anodyne	ADRB1	62	51
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cccnc3)cc2)n1	ZINC000819012133	EF	On-Demand	Anodyne	ADRB3	170	66
O=C(CSc1ccccc1[N+](=O)[O-])OCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819012152	JD	On-Demand	Bother	TGM2	46	35
O=C(CSc1ccccc1[N+](=O)[O-])OCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819012152	JD	On-Demand	Bother	F13A1	65	40
CN(Cc1ccc(F)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819012184	FG	On-Demand	Mild	CTSB	28	43
CN(Cc1ccc(F)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819012184	FG	On-Demand	Mild	PAPA1_CARPA	56	57
CN(Cc1ccc(F)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819012184	FG	On-Demand	Mild	CTSK	21	41
CN(Cc1ccc(F)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819012185	FG	On-Demand	Mild	CTSB	28	43
CN(Cc1ccc(F)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819012185	FG	On-Demand	Mild	PAPA1_CARPA	56	57
CN(Cc1ccc(F)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819012185	FG	On-Demand	Mild	CTSK	21	41
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2)n1	ZINC000819012188	GG	On-Demand	Bother	ADRB2	43	44
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2)n1	ZINC000819012188	GG	On-Demand	Bother	ADRB1	55	45
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2)n1	ZINC000819012188	GG	On-Demand	Bother	ADRB3	143	50
CCc1noc(-c2ccc(CCNC[C@H](O)c3cccc([N+](=O)[O-])c3)cc2)n1	ZINC000819012189	GG	On-Demand	Bother	ADRB2	43	44
CCc1noc(-c2ccc(CCNC[C@H](O)c3cccc([N+](=O)[O-])c3)cc2)n1	ZINC000819012189	GG	On-Demand	Bother	ADRB1	55	45
CCc1noc(-c2ccc(CCNC[C@H](O)c3cccc([N+](=O)[O-])c3)cc2)n1	ZINC000819012189	GG	On-Demand	Bother	ADRB3	143	50
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccccc1Cl	ZINC000819012196	CG	On-Demand	Anodyne	KCNQ2	21	40
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccccc1Cl	ZINC000819012197	CG	On-Demand	Anodyne	KCNQ2	21	40
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccccc1Cl	ZINC000819012198	CG	On-Demand	Anodyne	KCNQ2	21	40
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccccc1Cl	ZINC000819012199	CG	On-Demand	Anodyne	KCNQ2	21	40
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819012229	CD	On-Demand	Anodyne	ADRB2	15	42
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819012229	CD	On-Demand	Anodyne	ADRB1	43	50
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819012229	CD	On-Demand	Anodyne	ADRB3	61	50
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819012229	CD	On-Demand	Anodyne	KCNQ2	19	41
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819012229	CD	On-Demand	Anodyne	DPP7	46	45
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819012229	CD	On-Demand	Anodyne	CYP3A4	48	36
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819012230	CD	On-Demand	Anodyne	ADRB2	15	42
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819012230	CD	On-Demand	Anodyne	ADRB1	43	50
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819012230	CD	On-Demand	Anodyne	ADRB3	61	50
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819012230	CD	On-Demand	Anodyne	KCNQ2	19	41
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819012230	CD	On-Demand	Anodyne	DPP7	46	45
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819012230	CD	On-Demand	Anodyne	CYP3A4	48	36
COC[C@@H](O)CNCc1ccccc1OCC(=O)OC	ZINC000819012236	CC	On-Demand	Anodyne	ADRB2	30	50
COC[C@@H](O)CNCc1ccccc1OCC(=O)OC	ZINC000819012236	CC	On-Demand	Anodyne	ADRB1	51	35
COC[C@@H](O)CNCc1ccccc1OCC(=O)OC	ZINC000819012236	CC	On-Demand	Anodyne	ADRB3	15	40
O=C(CCNCCCN1CCOC1=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819012252	GG	On-Demand	Anodyne	LTA4H	53	44
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)c1ccc(Cl)cc1	ZINC000819012257	GI	On-Demand	Bother	COLA	62	37
Cc1ncc(Cl)c(C(=O)N(CC(=O)O)c2ccc3c(c2)OCO3)n1	ZINC000819012266	ED	On-Demand	Anodyne	NOS2	50	31
Cc1nccc(C(=O)N(CC(=O)O)c2ccc3c(c2)OCO3)n1	ZINC000819012277	DD	On-Demand	Anodyne	NOS2	77	34
O=C(CNC[C@H](O)c1ccccc1C(F)(F)F)N1CCCCC1	ZINC000819012284	EE	On-Demand	Anodyne	RBP4	57	34
O=C(CNC[C@H](O)c1ccccc1C(F)(F)F)N1CCCCC1	ZINC000819012284	EE	On-Demand	Anodyne	SFRP1	67	38
O=C(CNC[C@H](O)c1ccccc1C(F)(F)F)N1CCCCC1	ZINC000819012284	EE	On-Demand	Anodyne	WNT3	55	38
O=C(CNC[C@@H](O)c1ccccc1C(F)(F)F)N1CCCCC1	ZINC000819012286	EE	On-Demand	Anodyne	RBP4	57	34
O=C(CNC[C@@H](O)c1ccccc1C(F)(F)F)N1CCCCC1	ZINC000819012286	EE	On-Demand	Anodyne	SFRP1	67	38
O=C(CNC[C@@H](O)c1ccccc1C(F)(F)F)N1CCCCC1	ZINC000819012286	EE	On-Demand	Anodyne	WNT3	55	38
Cc1ncc(CO)c(/C=N/Cc2ccc(C(=O)O)cc2)c1O	ZINC000819012340	DD	On-Demand	Mild	P2RX1	16	40
Cc1ncc(CO)c(/C=N\Cc2ccc(C(=O)O)cc2)c1O	ZINC000819012341	DD	On-Demand	Mild	P2RX1	16	40
Cc1ncc(CN(C)CCC(=O)O)cn1	ZINC000819012350	BC	On-Demand	Anodyne	LTA4H	17	43
Cc1ncc(NC(=O)C(=O)N[C@H](CC(C)C)C(=O)O)cn1	ZINC000819012367	CC	On-Demand	Anodyne	MME	21	44
Cc1ncc(NC(=O)C(=O)N[C@H](CC(C)C)C(=O)O)cn1	ZINC000819012367	CC	On-Demand	Anodyne	ANPEP	27	41
Cc1ncc(NC(=O)C(=O)N[C@H](CC(C)C)C(=O)O)cn1	ZINC000819012367	CC	On-Demand	Anodyne	RNPEP	21	40
Cc1ncc(NC(=O)C(=O)N[C@H](CC(C)C)C(=O)O)cn1	ZINC000819012367	CC	On-Demand	Anodyne	CAPNS1	44	37
Cc1ncc(NC(=O)C(=O)N[C@H](CC(C)C)C(=O)O)cn1	ZINC000819012367	CC	On-Demand	Anodyne	LAP3	15	40
Cc1ncc(NC(=O)C(=O)N[C@H](CC(C)C)C(=O)O)cn1	ZINC000819012367	CC	On-Demand	Anodyne	FPR1	64	41
O=C(/C=C/[C@H]1CCCO1)NCC1(N2CCOCC2)CCCCC1	ZINC000819012389	DD	On-Demand	Anodyne	HCN1	52	32
O=C(/C=C/[C@H]1CCCO1)NCC1(N2CCOCC2)CCCCC1	ZINC000819012389	DD	On-Demand	Anodyne	HCN4	50	32
O=C(/C=C/[C@@H]1CCCO1)NCC1(N2CCOCC2)CCCCC1	ZINC000819012391	DD	On-Demand	Anodyne	HCN1	52	32
O=C(/C=C/[C@@H]1CCCO1)NCC1(N2CCOCC2)CCCCC1	ZINC000819012391	DD	On-Demand	Anodyne	HCN4	50	32
O=C(/C=C\[C@H]1CCCO1)NCC1(N2CCOCC2)CCCCC1	ZINC000819012392	DD	On-Demand	Anodyne	HCN1	52	32
O=C(/C=C\[C@H]1CCCO1)NCC1(N2CCOCC2)CCCCC1	ZINC000819012392	DD	On-Demand	Anodyne	HCN4	50	32
O=C(/C=C\[C@@H]1CCCO1)NCC1(N2CCOCC2)CCCCC1	ZINC000819012394	DD	On-Demand	Anodyne	HCN1	52	32
O=C(/C=C\[C@@H]1CCCO1)NCC1(N2CCOCC2)CCCCC1	ZINC000819012394	DD	On-Demand	Anodyne	HCN4	50	32
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccccc3C)cc2)n1	ZINC000819012422	FG	On-Demand	Anodyne	ADRB1	43	39
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccccc3C)cc2)n1	ZINC000819012422	FG	On-Demand	Anodyne	ADRB3	95	46
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccccc3C)cc2)n1	ZINC000819012423	FG	On-Demand	Anodyne	ADRB1	43	39
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccccc3C)cc2)n1	ZINC000819012423	FG	On-Demand	Anodyne	ADRB3	95	46
CCC[C@@H](Cc1ccccc1)NCCC(=O)N(C)OC	ZINC000819012428	CE	On-Demand	Anodyne	MME	65	39
CCC[C@@H](Cc1ccccc1)NCCC(=O)N(C)OC	ZINC000819012428	CE	On-Demand	Anodyne	CAPNS1	44	34
CCC[C@H](Cc1ccccc1)NCCC(=O)N(C)OC	ZINC000819012429	CE	On-Demand	Anodyne	MME	65	39
CCC[C@H](Cc1ccccc1)NCCC(=O)N(C)OC	ZINC000819012429	CE	On-Demand	Anodyne	CAPNS1	44	34
CCCOc1ccc(C(=O)NNC(=O)c2cc(C)ccc2C2CC2)cc1OC	ZINC000819012454	GH	On-Demand	Reactive	PPARD	16	43
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc(F)c(F)c3)cc2)n1	ZINC000819012455	FG	On-Demand	Anodyne	ADRB2	39	45
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc(F)c(F)c3)cc2)n1	ZINC000819012455	FG	On-Demand	Anodyne	ADRB1	42	45
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc(F)c(F)c3)cc2)n1	ZINC000819012455	FG	On-Demand	Anodyne	ADRB3	118	58
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(F)c(F)c3)cc2)n1	ZINC000819012456	FG	On-Demand	Anodyne	ADRB2	39	45
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(F)c(F)c3)cc2)n1	ZINC000819012456	FG	On-Demand	Anodyne	ADRB1	42	45
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(F)c(F)c3)cc2)n1	ZINC000819012456	FG	On-Demand	Anodyne	ADRB3	118	58
CN(Cc1ccc(F)cc1)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819012468	DF	On-Demand	Anodyne	PAPA1_CARPA	18	41
Cc1oc(-c2ccccc2)nc1CC(=O)N1CCc2cc(S(=O)(=O)N(C)C)ccc21	ZINC000819012470	IG	On-Demand	Anodyne	PPARG	72	41
Cc1oc(-c2ccccc2)nc1CC(=O)N1CCc2cc(S(=O)(=O)N(C)C)ccc21	ZINC000819012470	IG	On-Demand	Anodyne	PPARA	74	41
Cc1oc(-c2ccccc2)nc1CC(=O)N1CCc2cc(S(=O)(=O)N(C)C)ccc21	ZINC000819012470	IG	On-Demand	Anodyne	PDE8B	57	33
Cc1oc(-c2ccccc2)nc1CC(=O)N1CCc2cc(S(=O)(=O)N(C)C)ccc21	ZINC000819012470	IG	On-Demand	Anodyne	EIF2AK3	71	35
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cccc(Cl)c3)cc2)n1	ZINC000819012473	FH	On-Demand	Anodyne	ADRB2	60	43
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cccc(Cl)c3)cc2)n1	ZINC000819012473	FH	On-Demand	Anodyne	ADRB1	79	57
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cccc(Cl)c3)cc2)n1	ZINC000819012473	FH	On-Demand	Anodyne	ADRB3	164	57
CCc1noc(-c2ccc(CCNC[C@H](O)c3cccc(Cl)c3)cc2)n1	ZINC000819012474	FH	On-Demand	Anodyne	ADRB2	60	43
CCc1noc(-c2ccc(CCNC[C@H](O)c3cccc(Cl)c3)cc2)n1	ZINC000819012474	FH	On-Demand	Anodyne	ADRB1	79	57
CCc1noc(-c2ccc(CCNC[C@H](O)c3cccc(Cl)c3)cc2)n1	ZINC000819012474	FH	On-Demand	Anodyne	ADRB3	164	57
CN(CCOc1cccc(CNC[C@@H](O)c2cccnc2)c1)C1CCOCC1	ZINC000819012480	GE	On-Demand	Anodyne	ADRB2	16	41
CN(CCOc1cccc(CNC[C@@H](O)c2cccnc2)c1)C1CCOCC1	ZINC000819012480	GE	On-Demand	Anodyne	ADRB1	22	42
CN(CCOc1cccc(CNC[C@@H](O)c2cccnc2)c1)C1CCOCC1	ZINC000819012480	GE	On-Demand	Anodyne	ADRB3	65	44
CN(CCOc1cccc(CNC[C@H](O)c2cccnc2)c1)C1CCOCC1	ZINC000819012481	GE	On-Demand	Anodyne	ADRB2	16	41
CN(CCOc1cccc(CNC[C@H](O)c2cccnc2)c1)C1CCOCC1	ZINC000819012481	GE	On-Demand	Anodyne	ADRB1	22	42
CN(CCOc1cccc(CNC[C@H](O)c2cccnc2)c1)C1CCOCC1	ZINC000819012481	GE	On-Demand	Anodyne	ADRB3	65	44
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)C(F)=C1CCC1	ZINC000819012482	DI	On-Demand	Anodyne	OPRK1	20	42
Cc1ncc2c(n1)CCC[C@H]2NC(=O)Nc1ccccc1CC(=O)O	ZINC000819012495	EF	On-Demand	Anodyne	TRPV1	23	40
Cc1ncc(CNCCCCCC(=O)O)cn1	ZINC000819012496	BD	On-Demand	Anodyne	LPAR2	58	38
Cc1ncc(CNCCCCCC(=O)O)cn1	ZINC000819012496	BD	On-Demand	Anodyne	S1PR2	64	38
Cc1ncc(CNCCCCCC(=O)O)cn1	ZINC000819012496	BD	On-Demand	Anodyne	LEF	41	31
Cc1ncc(CN2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)s1	ZINC000819012503	FE	On-Demand	Anodyne	FAAH	24	40
Cc1ncc(CN2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)s1	ZINC000819012503	FE	On-Demand	Anodyne	MGEA5	38	44
Cc1ncc(NC(=O)C(=O)N[C@@H](C(=O)O)C(C)C)cn1	ZINC000819012507	CB	On-Demand	Anodyne	DGAT1	17	41
Cc1ncc(NC(=O)C(=O)N[C@H](C(=O)O)C(C)C)cn1	ZINC000819012508	CB	On-Demand	Anodyne	DGAT1	17	41
Cc1ncc(CNc2cccc(CC(=O)O)c2)n1-c1ccccc1	ZINC000819012524	DG	On-Demand	Anodyne	NR1H3	18	44
Cc1ncc(CNc2cccc(CC(=O)O)c2)n1-c1ccccc1	ZINC000819012524	DG	On-Demand	Anodyne	NR1H2	32	44
Cc1ncc(CNCCCC(=O)O)cn1	ZINC000819012525	BC	On-Demand	Anodyne	LPAR2	41	35
Cc1ncc(CNCCCC(=O)O)cn1	ZINC000819012525	BC	On-Demand	Anodyne	S1PR2	42	35
Cc1ncc(CNc2cccc(CC(=O)O)c2)cn1	ZINC000819012526	CE	On-Demand	Anodyne	NR1H3	24	50
Cc1ncc(CNc2cccc(CC(=O)O)c2)cn1	ZINC000819012526	CE	On-Demand	Anodyne	NR1H2	40	50
Cc1ncc(CNc2cccc(CC(=O)O)c2)cn1	ZINC000819012526	CE	On-Demand	Anodyne	FFAR1	37	40
Cc1ncc(CNc2cccc(CC(=O)O)c2)cn1	ZINC000819012526	CE	On-Demand	Anodyne	HAO2	51	37
Cc1nccc(-c2cccc(NC(=O)C(=O)NCc3ccc(C(=O)O)cc3)c2)n1	ZINC000819012529	GE	On-Demand	Anodyne	NR1H3	16	41
Cc1nccc(-c2cccc(NC(=O)C(=O)NCc3ccc(C(=O)O)cc3)c2)n1	ZINC000819012529	GE	On-Demand	Anodyne	PTPN11	54	33
Cc1nccc(-c2cccc(NC(=O)C(=O)NCc3ccc(C(=O)O)cc3)c2)n1	ZINC000819012529	GE	On-Demand	Anodyne	CAMK2D	28	42
Cc1ncsc1-c1nc2ccccc2n1CC(=O)OCC(=O)O	ZINC000819012534	EE	On-Demand	Anodyne	PDE6D	48	34
Cc1ncsc1-c1nc2ccccc2n1CC(=O)OCC(=O)O	ZINC000819012534	EE	On-Demand	Anodyne	IMDH_CRYPV	38	42
Cc1nccc(-c2cccc(NC(=O)C(=O)N[C@H](C)C(=O)O)c2)n1	ZINC000819012547	EC	On-Demand	Anodyne	PTPN11	49	32
Cc1nccc(-c2cccc(NC(=O)C(=O)N[C@@H](C)C(=O)O)c2)n1	ZINC000819012548	EC	On-Demand	Anodyne	PTPN11	49	32
O=C(CNC[C@H](O)c1ccc(Cl)cc1Cl)N1CCCCC1	ZINC000819012577	EF	On-Demand	Anodyne	CNR1	50	30
O=C(CNC[C@H](O)c1ccc(Cl)cc1Cl)N1CCCCC1	ZINC000819012577	EF	On-Demand	Anodyne	DPP7	42	40
O=C(CNC[C@@H](O)c1ccc(Cl)cc1Cl)N1CCCCC1	ZINC000819012578	EF	On-Demand	Anodyne	CNR1	50	30
O=C(CNC[C@@H](O)c1ccc(Cl)cc1Cl)N1CCCCC1	ZINC000819012578	EF	On-Demand	Anodyne	DPP7	42	40
O=C(CCNCCCN1CCOC1=O)Nc1cccc(C(F)(F)F)c1	ZINC000819012611	FE	On-Demand	Anodyne	EPHX2	18	44
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(Cl)c1	ZINC000819012625	CG	On-Demand	Anodyne	KCNQ2	52	41
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(Cl)c1	ZINC000819012626	CG	On-Demand	Anodyne	KCNQ2	52	41
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(Cl)c1	ZINC000819012627	CG	On-Demand	Anodyne	KCNQ2	52	41
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(Cl)c1	ZINC000819012628	CG	On-Demand	Anodyne	KCNQ2	52	41
O=C1OCCN1CCCNC[C@@H](O)c1cccnc1	ZINC000819012644	CC	On-Demand	Anodyne	ADRB2	28	47
O=C1OCCN1CCCNC[C@@H](O)c1cccnc1	ZINC000819012644	CC	On-Demand	Anodyne	ADRB1	29	47
O=C1OCCN1CCCNC[C@@H](O)c1cccnc1	ZINC000819012644	CC	On-Demand	Anodyne	ADRB3	106	48
O=C1OCCN1CCCNC[C@H](O)c1cccnc1	ZINC000819012646	CC	On-Demand	Anodyne	ADRB2	28	47
O=C1OCCN1CCCNC[C@H](O)c1cccnc1	ZINC000819012646	CC	On-Demand	Anodyne	ADRB1	29	47
O=C1OCCN1CCCNC[C@H](O)c1cccnc1	ZINC000819012646	CC	On-Demand	Anodyne	ADRB3	106	48
O=C1OCCN1CCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819012650	FD	On-Demand	Anodyne	ADRB2	24	40
O=C1OCCN1CCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819012650	FD	On-Demand	Anodyne	ADRB1	48	36
O=C1OCCN1CCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819012652	FD	On-Demand	Anodyne	ADRB2	24	40
O=C1OCCN1CCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819012652	FD	On-Demand	Anodyne	ADRB1	48	36
O=C(CNC[C@H](O)c1ccc(OC(F)(F)F)cc1)N1CCCCC1	ZINC000819012663	EE	On-Demand	Anodyne	EPHX2	44	41
CC(C)(C)NC(=O)CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819012671	EF	On-Demand	Anodyne	ADRB3	31	50
CC(C)(C)NC(=O)CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819012672	EF	On-Demand	Anodyne	ADRB3	31	50
O=C(CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)N1CCCCC1	ZINC000819012679	EE	On-Demand	Anodyne	EPHX2	44	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)Cc1ccc(C(F)(F)F)cc1)C2	ZINC000819012684	GH	On-Demand	Anodyne	TACR1	21	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)Cc1ccc(C(F)(F)F)cc1)C2	ZINC000819012686	GH	On-Demand	Anodyne	TACR1	21	41
COc1cc(C(=O)NNC(=O)C[C@@H](C)n2cccn2)ccc1OC(C)C	ZINC000819012712	FE	On-Demand	Reactive	ENPP1	63	34
COc1cc(C(=O)NNC(=O)C[C@H](C)n2cccn2)ccc1OC(C)C	ZINC000819012713	FE	On-Demand	Reactive	ENPP1	63	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cc(OC)c(Cl)cc1OC)C2	ZINC000819012716	GG	On-Demand	Anodyne	HTR4	17	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cc(OC)c(Cl)cc1OC)C2	ZINC000819012717	GG	On-Demand	Anodyne	HTR4	17	41
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(C#N)cc3)cc2)n1	ZINC000819012720	FG	On-Demand	Mild	ADRB3	105	46
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc(C#N)cc3)cc2)n1	ZINC000819012721	FG	On-Demand	Mild	ADRB3	105	46
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2ccccc2)CC1	ZINC000819012722	DE	On-Demand	Anodyne	L3MBTL3	59	36
O=C(/C=C\[C@H]1CCCO1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000819012739	GF	On-Demand	Bother	SERPINE1	17	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000819012739	GF	On-Demand	Bother	SLC6A9	16	45
O=C(/C=C\[C@@H]1CCCO1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000819012740	GF	On-Demand	Bother	SERPINE1	17	42
O=C(/C=C\[C@@H]1CCCO1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000819012740	GF	On-Demand	Bother	SLC6A9	16	45
O=C(/C=C/[C@H]1CCCO1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000819012741	GF	On-Demand	Bother	SERPINE1	17	42
O=C(/C=C/[C@H]1CCCO1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000819012741	GF	On-Demand	Bother	SLC6A9	16	45
O=C(/C=C/[C@@H]1CCCO1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000819012742	GF	On-Demand	Bother	SERPINE1	17	42
O=C(/C=C/[C@@H]1CCCO1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000819012742	GF	On-Demand	Bother	SLC6A9	16	45
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(F)cc3C)cc2)n1	ZINC000819012758	FH	On-Demand	Anodyne	ADRB3	66	49
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc(F)cc3C)cc2)n1	ZINC000819012759	FH	On-Demand	Anodyne	ADRB3	66	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc3c(c1)OCCO3)C2	ZINC000819012814	FD	On-Demand	Anodyne	NOS2	83	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc3c(c1)OCCO3)C2	ZINC000819012815	FD	On-Demand	Anodyne	NOS2	83	36
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cc4ccccc4o3)cc2)n1	ZINC000819012859	GH	On-Demand	Anodyne	ADRB3	93	45
CC(C)(C)NC(=O)CCNC[C@@H](O)c1cccnc1	ZINC000819012881	CD	On-Demand	Anodyne	ADRB2	33	48
CC(C)(C)NC(=O)CCNC[C@@H](O)c1cccnc1	ZINC000819012881	CD	On-Demand	Anodyne	ADRB1	45	48
CC(C)(C)NC(=O)CCNC[C@@H](O)c1cccnc1	ZINC000819012881	CD	On-Demand	Anodyne	ADRB3	124	48
CC(C)(C)NC(=O)CCNC[C@H](O)c1cccnc1	ZINC000819012883	CD	On-Demand	Anodyne	ADRB2	33	48
CC(C)(C)NC(=O)CCNC[C@H](O)c1cccnc1	ZINC000819012883	CD	On-Demand	Anodyne	ADRB1	45	48
CC(C)(C)NC(=O)CCNC[C@H](O)c1cccnc1	ZINC000819012883	CD	On-Demand	Anodyne	ADRB3	124	48
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc(Cl)c(F)c3)cc2)n1	ZINC000819012885	GH	On-Demand	Anodyne	ADRB1	40	45
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc(Cl)c(F)c3)cc2)n1	ZINC000819012885	GH	On-Demand	Anodyne	ADRB3	106	50
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(Cl)c(F)c3)cc2)n1	ZINC000819012886	GH	On-Demand	Anodyne	ADRB1	40	45
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(Cl)c(F)c3)cc2)n1	ZINC000819012886	GH	On-Demand	Anodyne	ADRB3	106	50
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccccc2)CC1	ZINC000819012904	DD	On-Demand	Anodyne	PREP	18	40
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccccc2)CC1	ZINC000819012904	DD	On-Demand	Anodyne	L3MBTL3	81	41
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccccc2)CC1	ZINC000819012905	DD	On-Demand	Anodyne	PREP	18	40
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccccc2)CC1	ZINC000819012905	DD	On-Demand	Anodyne	L3MBTL3	81	41
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccccc2)CC1	ZINC000819012906	DD	On-Demand	Anodyne	PREP	18	40
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccccc2)CC1	ZINC000819012906	DD	On-Demand	Anodyne	L3MBTL3	81	41
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccccc2)CC1	ZINC000819012907	DD	On-Demand	Anodyne	PREP	18	40
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccccc2)CC1	ZINC000819012907	DD	On-Demand	Anodyne	L3MBTL3	81	41
CCc1noc(-c2ccc(CCNCCS(C)(=O)=O)cc2)n1	ZINC000819012916	DD	On-Demand	Anodyne	ADRB3	15	40
CCc1noc(-c2ccc(CCNC[C@H](O)c3cc(C)cc(C)c3)cc2)n1	ZINC000819012923	FH	On-Demand	Anodyne	ADRB2	39	44
CCc1noc(-c2ccc(CCNC[C@H](O)c3cc(C)cc(C)c3)cc2)n1	ZINC000819012923	FH	On-Demand	Anodyne	ADRB1	43	41
CCc1noc(-c2ccc(CCNC[C@H](O)c3cc(C)cc(C)c3)cc2)n1	ZINC000819012923	FH	On-Demand	Anodyne	ADRB3	117	48
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cc(C)cc(C)c3)cc2)n1	ZINC000819012924	FH	On-Demand	Anodyne	ADRB2	39	44
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cc(C)cc(C)c3)cc2)n1	ZINC000819012924	FH	On-Demand	Anodyne	ADRB1	43	41
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cc(C)cc(C)c3)cc2)n1	ZINC000819012924	FH	On-Demand	Anodyne	ADRB3	117	48
CC(=O)N1CCN(CCOc2ccc(CCNCCS(C)(=O)=O)cc2)CC1	ZINC000819012933	GC	On-Demand	Anodyne	ADRB1	21	42
CC(=O)N1CCN(CCOc2ccc(CCNCCS(C)(=O)=O)cc2)CC1	ZINC000819012933	GC	On-Demand	Anodyne	ADRB3	18	42
CC(=O)N1CCN(CCOc2ccc(CCNCCS(C)(=O)=O)cc2)CC1	ZINC000819012933	GC	On-Demand	Anodyne	LTA4H	50	43
CC(=O)N1CCN(CCOc2ccc(CCNCCS(C)(=O)=O)cc2)CC1	ZINC000819012933	GC	On-Demand	Anodyne	HRH3	33	41
CC(=O)N1CCN(CCOc2ccc(CCNCCS(C)(=O)=O)cc2)CC1	ZINC000819012933	GC	On-Demand	Anodyne	PSMB1	42	39
CCc1noc(-c2ccc(CCNC[C@H](O)c3c(F)cccc3F)cc2)n1	ZINC000819012948	FG	On-Demand	Anodyne	ADRB2	24	41
CCc1noc(-c2ccc(CCNC[C@H](O)c3c(F)cccc3F)cc2)n1	ZINC000819012948	FG	On-Demand	Anodyne	ADRB1	31	40
CCc1noc(-c2ccc(CCNC[C@H](O)c3c(F)cccc3F)cc2)n1	ZINC000819012948	FG	On-Demand	Anodyne	ADRB3	91	49
CCc1noc(-c2ccc(CCNC[C@@H](O)c3c(F)cccc3F)cc2)n1	ZINC000819012949	FG	On-Demand	Anodyne	ADRB2	24	41
CCc1noc(-c2ccc(CCNC[C@@H](O)c3c(F)cccc3F)cc2)n1	ZINC000819012949	FG	On-Demand	Anodyne	ADRB1	31	40
CCc1noc(-c2ccc(CCNC[C@@H](O)c3c(F)cccc3F)cc2)n1	ZINC000819012949	FG	On-Demand	Anodyne	ADRB3	91	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCN2CCOC2=O)CC1	ZINC000819012983	FD	On-Demand	Anodyne	GPR119	31	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCN2CCOC2=O)CC1	ZINC000819012984	FD	On-Demand	Anodyne	GPR119	31	42
O=C(CNC[C@H](O)c1ccccc1Br)N1CCCCC1	ZINC000819012985	EE	On-Demand	Anodyne	DPP7	42	36
O=C(CNC[C@@H](O)c1ccccc1Br)N1CCCCC1	ZINC000819012986	EE	On-Demand	Anodyne	DPP7	42	36
O=C(COC(=O)CSc1ccccc1[N+](=O)[O-])NOCc1ccccc1	ZINC000819013010	GE	On-Demand	Bother	GSTM2	42	45
O=C(COC(=O)CSc1ccccc1[N+](=O)[O-])NOCc1ccccc1	ZINC000819013010	GE	On-Demand	Bother	GSTP1	31	45
O=C(NCc1ccc2c(c1)OCCO2)C(F)=C1CCC1	ZINC000819013022	CE	On-Demand	Anodyne	NOS2	66	32
COc1ccccc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013074	GG	On-Demand	Mild	PAPA1_CARPA	60	51
COc1ccccc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013074	GG	On-Demand	Mild	CCKAR	47	38
COc1ccccc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013074	GG	On-Demand	Mild	CTSK	30	47
COc1ccccc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013074	GG	On-Demand	Mild	CTSL	21	51
COc1ccccc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013074	GG	On-Demand	Mild	CTSS	19	51
COc1ccccc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013074	GG	On-Demand	Mild	CAPN1	15	41
COc1ccccc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013074	GG	On-Demand	Mild	FPR1	52	44
COc1ccccc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013076	GG	On-Demand	Mild	PAPA1_CARPA	60	51
COc1ccccc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013076	GG	On-Demand	Mild	CCKAR	47	38
COc1ccccc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013076	GG	On-Demand	Mild	CTSK	30	47
COc1ccccc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013076	GG	On-Demand	Mild	CTSL	21	51
COc1ccccc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013076	GG	On-Demand	Mild	CTSS	19	51
COc1ccccc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013076	GG	On-Demand	Mild	CAPN1	15	41
COc1ccccc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013076	GG	On-Demand	Mild	FPR1	52	44
CCCOc1ccc(C(=O)NNC(=O)C[C@@H](C)n2cccn2)cc1OC	ZINC000819013100	FE	On-Demand	Reactive	ENPP1	54	32
CCCOc1ccc(C(=O)NNC(=O)C[C@H](C)n2cccn2)cc1OC	ZINC000819013101	FE	On-Demand	Reactive	ENPP1	54	32
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)Cc1ccc(F)cc1	ZINC000819013103	FD	On-Demand	Reactive	PAPA1_CARPA	22	42
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cccc(F)c3)cc2)n1	ZINC000819013107	FG	On-Demand	Anodyne	ADRB2	45	49
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cccc(F)c3)cc2)n1	ZINC000819013107	FG	On-Demand	Anodyne	ADRB1	55	53
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cccc(F)c3)cc2)n1	ZINC000819013107	FG	On-Demand	Anodyne	ADRB3	141	55
CCc1noc(-c2ccc(CCNC[C@H](O)c3cccc(F)c3)cc2)n1	ZINC000819013108	FG	On-Demand	Anodyne	ADRB2	45	49
CCc1noc(-c2ccc(CCNC[C@H](O)c3cccc(F)c3)cc2)n1	ZINC000819013108	FG	On-Demand	Anodyne	ADRB1	55	53
CCc1noc(-c2ccc(CCNC[C@H](O)c3cccc(F)c3)cc2)n1	ZINC000819013108	FG	On-Demand	Anodyne	ADRB3	141	55
CCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819013125	FG	On-Demand	Anodyne	ADRB3	38	57
CCC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819013126	FG	On-Demand	Anodyne	ADRB3	38	57
CCC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819013127	FG	On-Demand	Anodyne	ADRB3	38	57
CCC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819013128	FG	On-Demand	Anodyne	ADRB3	38	57
CCC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819013130	DH	On-Demand	Mild	CTRB_BOVIN	55	39
CCC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819013131	DH	On-Demand	Mild	CTRB_BOVIN	55	39
CCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819013132	DH	On-Demand	Mild	CTRB_BOVIN	55	39
CCC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819013133	DH	On-Demand	Mild	CTRB_BOVIN	55	39
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)Cc1cnn(-c2ccccc2)c1	ZINC000819013157	HE	On-Demand	Anodyne	EIF2AK3	71	40
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc([N+](=O)[O-])cc3)cc2)n1	ZINC000819013162	GG	On-Demand	Bother	ADRB2	38	42
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc([N+](=O)[O-])cc3)cc2)n1	ZINC000819013162	GG	On-Demand	Bother	ADRB1	41	42
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc([N+](=O)[O-])cc3)cc2)n1	ZINC000819013162	GG	On-Demand	Bother	ADRB3	120	49
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc([N+](=O)[O-])cc3)cc2)n1	ZINC000819013163	GG	On-Demand	Bother	ADRB2	38	42
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc([N+](=O)[O-])cc3)cc2)n1	ZINC000819013163	GG	On-Demand	Bother	ADRB1	41	42
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc([N+](=O)[O-])cc3)cc2)n1	ZINC000819013163	GG	On-Demand	Bother	ADRB3	120	49
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000819013166	HE	On-Demand	Bother	COLA	84	34
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccccc3F)cc2)n1	ZINC000819013177	FG	On-Demand	Anodyne	ADRB2	35	40
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccccc3F)cc2)n1	ZINC000819013177	FG	On-Demand	Anodyne	ADRB1	40	39
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccccc3F)cc2)n1	ZINC000819013177	FG	On-Demand	Anodyne	ADRB3	97	49
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccccc3F)cc2)n1	ZINC000819013178	FG	On-Demand	Anodyne	ADRB2	35	40
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccccc3F)cc2)n1	ZINC000819013178	FG	On-Demand	Anodyne	ADRB1	40	39
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccccc3F)cc2)n1	ZINC000819013178	FG	On-Demand	Anodyne	ADRB3	97	49
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccccc3)cc2)n1	ZINC000819013179	EG	On-Demand	Anodyne	ADRB2	60	52
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccccc3)cc2)n1	ZINC000819013179	EG	On-Demand	Anodyne	ADRB1	78	52
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccccc3)cc2)n1	ZINC000819013179	EG	On-Demand	Anodyne	ADRB3	158	53
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccccc3)cc2)n1	ZINC000819013180	EG	On-Demand	Anodyne	ADRB2	60	52
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccccc3)cc2)n1	ZINC000819013180	EG	On-Demand	Anodyne	ADRB1	78	52
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccccc3)cc2)n1	ZINC000819013180	EG	On-Demand	Anodyne	ADRB3	158	53
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc(F)cc3Cl)cc2)n1	ZINC000819013181	GH	On-Demand	Anodyne	ADRB3	67	48
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(F)cc3Cl)cc2)n1	ZINC000819013182	GH	On-Demand	Anodyne	ADRB3	67	48
O=C(CNC[C@H](O)c1cccc2ccccc12)N1CCCCC1	ZINC000819013187	DE	On-Demand	Anodyne	PREP	19	43
O=C(CNC[C@H](O)c1cccc2ccccc12)N1CCCCC1	ZINC000819013187	DE	On-Demand	Anodyne	DPP7	43	44
Cc1ccccc1[C@@H](O)CNCC(=O)N1CCCCC1	ZINC000819013202	CD	On-Demand	Anodyne	PREP	16	41
Cc1ccccc1[C@@H](O)CNCC(=O)N1CCCCC1	ZINC000819013202	CD	On-Demand	Anodyne	DPP7	49	36
O=C1OCCN1CCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819013210	FD	On-Demand	Anodyne	ADRB1	43	41
O=C1OCCN1CCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819013210	FD	On-Demand	Anodyne	PDS	43	37
O=C1OCCN1CCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819013211	FD	On-Demand	Anodyne	ADRB1	43	41
O=C1OCCN1CCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819013211	FD	On-Demand	Anodyne	PDS	43	37
O=C(CSc1ccccc1[N+](=O)[O-])OCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2	ZINC000819013236	JG	On-Demand	Bother	CPT1A	42	38
O=C(CSc1ccccc1[N+](=O)[O-])OCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2	ZINC000819013238	JG	On-Demand	Bother	CPT1A	42	38
O=C(CSc1ccccc1[N+](=O)[O-])OCc1cc2c(cc1Br)OCCO2	ZINC000819013240	IH	On-Demand	Bother	COLA	62	36
CC(C)(C)NC(=O)CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819013313	FD	On-Demand	Anodyne	GPR119	27	42
CC(C)(C)NC(=O)CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819013314	FD	On-Demand	Anodyne	GPR119	27	42
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(Cl)cc3)cc2)n1	ZINC000819013315	FH	On-Demand	Anodyne	ADRB2	41	44
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(Cl)cc3)cc2)n1	ZINC000819013315	FH	On-Demand	Anodyne	ADRB1	48	49
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(Cl)cc3)cc2)n1	ZINC000819013315	FH	On-Demand	Anodyne	ADRB3	124	50
O=C(CNC[C@@H](O)c1cccnc1)N1CCCCC1	ZINC000819013318	CC	On-Demand	Anodyne	ADRB2	23	44
O=C(CNC[C@@H](O)c1cccnc1)N1CCCCC1	ZINC000819013318	CC	On-Demand	Anodyne	ADRB1	28	44
O=C(CNC[C@@H](O)c1cccnc1)N1CCCCC1	ZINC000819013318	CC	On-Demand	Anodyne	ADRB3	103	53
O=C(CNC[C@@H](O)c1cccnc1)N1CCCCC1	ZINC000819013318	CC	On-Demand	Anodyne	PTAFR	26	54
O=C(CNC[C@@H](O)c1cccnc1)N1CCCCC1	ZINC000819013318	CC	On-Demand	Anodyne	KCNA5	19	41
O=C(CNC[C@@H](O)c1cccnc1)N1CCCCC1	ZINC000819013318	CC	On-Demand	Anodyne	C3AR1	46	42
O=C(CNC[C@H](O)c1cccnc1)N1CCCCC1	ZINC000819013320	CC	On-Demand	Anodyne	ADRB2	23	44
O=C(CNC[C@H](O)c1cccnc1)N1CCCCC1	ZINC000819013320	CC	On-Demand	Anodyne	ADRB1	28	44
O=C(CNC[C@H](O)c1cccnc1)N1CCCCC1	ZINC000819013320	CC	On-Demand	Anodyne	ADRB3	103	53
O=C(CNC[C@H](O)c1cccnc1)N1CCCCC1	ZINC000819013320	CC	On-Demand	Anodyne	PTAFR	26	54
O=C(CNC[C@H](O)c1cccnc1)N1CCCCC1	ZINC000819013320	CC	On-Demand	Anodyne	KCNA5	19	41
O=C(CNC[C@H](O)c1cccnc1)N1CCCCC1	ZINC000819013320	CC	On-Demand	Anodyne	C3AR1	46	42
CN(CCOc1ccc(Br)cc1)C(=O)/C=C\[C@@H]1CCCO1	ZINC000819013332	FG	On-Demand	Anodyne	SHC	52	40
CN(CCOc1ccc(Br)cc1)C(=O)/C=C\[C@@H]1CCCO1	ZINC000819013332	FG	On-Demand	Anodyne	LSS	39	45
CN(CCOc1ccc(Br)cc1)C(=O)/C=C/[C@H]1CCCO1	ZINC000819013334	FG	On-Demand	Anodyne	SHC	52	40
CN(CCOc1ccc(Br)cc1)C(=O)/C=C/[C@H]1CCCO1	ZINC000819013334	FG	On-Demand	Anodyne	LSS	39	45
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)NC[C@H](C)c1ccccc1	ZINC000819013356	HH	On-Demand	Bother	COLA	106	42
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(-c2ccccc2)cc1	ZINC000819013369	DI	On-Demand	Anodyne	KCNQ2	40	38
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(-c2ccccc2)cc1	ZINC000819013369	DI	On-Demand	Anodyne	ACACA	16	40
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(-c2ccccc2)cc1	ZINC000819013370	DI	On-Demand	Anodyne	KCNQ2	40	38
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(-c2ccccc2)cc1	ZINC000819013370	DI	On-Demand	Anodyne	ACACA	16	40
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(-c2ccccc2)cc1	ZINC000819013371	DI	On-Demand	Anodyne	KCNQ2	40	38
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(-c2ccccc2)cc1	ZINC000819013371	DI	On-Demand	Anodyne	ACACA	16	40
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(-c2ccccc2)cc1	ZINC000819013372	DI	On-Demand	Anodyne	KCNQ2	40	38
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(-c2ccccc2)cc1	ZINC000819013372	DI	On-Demand	Anodyne	ACACA	16	40
C=CCC1(C(=O)NNC(=O)c2ccc(Cl)cc2Cl)CCOCC1	ZINC000819013380	FG	On-Demand	Reactive	SLC6A9	51	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(=O)N2CCCCC2)CC1	ZINC000819013388	FD	On-Demand	Anodyne	GPR119	30	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(=O)N2CCCCC2)CC1	ZINC000819013390	FD	On-Demand	Anodyne	GPR119	30	44
O=C(CSc1ccccc1[N+](=O)[O-])OCCN1C(=O)c2ccccc2S1(=O)=O	ZINC000819013409	HE	On-Demand	Bother	ELANE	21	43
O=C1OCCN1CCCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000819013422	FD	On-Demand	Anodyne	ADRB2	35	45
O=C1OCCN1CCCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000819013422	FD	On-Demand	Anodyne	ADRB1	63	45
O=C1OCCN1CCCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000819013422	FD	On-Demand	Anodyne	ADRB3	44	43
O=C1OCCN1CCCNC[C@H](O)COc1ccc(Br)cc1	ZINC000819013423	FD	On-Demand	Anodyne	ADRB2	35	45
O=C1OCCN1CCCNC[C@H](O)COc1ccc(Br)cc1	ZINC000819013423	FD	On-Demand	Anodyne	ADRB1	63	45
O=C1OCCN1CCCNC[C@H](O)COc1ccc(Br)cc1	ZINC000819013423	FD	On-Demand	Anodyne	ADRB3	44	43
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1	ZINC000819013454	FD	On-Demand	Anodyne	F13A1	44	33
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1	ZINC000819013455	FD	On-Demand	Anodyne	F13A1	44	33
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1	ZINC000819013456	FD	On-Demand	Anodyne	F13A1	44	33
COC[C@H](C)NS(=O)(=O)c1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1	ZINC000819013457	FD	On-Demand	Anodyne	F13A1	44	33
CC(=O)N1CCN(C(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])CC1	ZINC000819013475	GC	On-Demand	Bother	COLA	57	37
CN(CCOc1ccc(Br)cc1)C(=O)/C=C\[C@H]1CCCO1	ZINC000819013486	FG	On-Demand	Anodyne	SHC	52	40
CN(CCOc1ccc(Br)cc1)C(=O)/C=C\[C@H]1CCCO1	ZINC000819013486	FG	On-Demand	Anodyne	LSS	39	45
CN(CCOc1ccc(Br)cc1)C(=O)/C=C/[C@@H]1CCCO1	ZINC000819013487	FG	On-Demand	Anodyne	SHC	52	40
CN(CCOc1ccc(Br)cc1)C(=O)/C=C/[C@@H]1CCCO1	ZINC000819013487	FG	On-Demand	Anodyne	LSS	39	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(C(=O)c2ccccc2)CC1	ZINC000819013494	FD	On-Demand	Anodyne	NPY2R	24	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(C(=O)c2ccccc2)CC1	ZINC000819013494	FD	On-Demand	Anodyne	PREP	17	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(C(=O)c2ccccc2)CC1	ZINC000819013494	FD	On-Demand	Anodyne	EPHX2	18	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1(N3CCOCC3)CCCCC1)C2	ZINC000819013497	GE	On-Demand	Anodyne	HCN1	52	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1(N3CCOCC3)CCCCC1)C2	ZINC000819013497	GE	On-Demand	Anodyne	HCN4	50	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1(N3CCOCC3)CCCCC1)C2	ZINC000819013498	GE	On-Demand	Anodyne	HCN1	52	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1(N3CCOCC3)CCCCC1)C2	ZINC000819013498	GE	On-Demand	Anodyne	HCN4	50	32
CCCOc1ccc(C(=O)NNC(=O)Cc2cccc(NC(C)=O)c2)cc1OC	ZINC000819013499	GE	On-Demand	Reactive	TSHR	68	33
CCCOc1ccc(C(=O)NNC(=O)Cc2cccc(NC(C)=O)c2)cc1OC	ZINC000819013499	GE	On-Demand	Reactive	FLT4	24	40
CCCOc1ccc(C(=O)NNC(=O)Cc2cccc(NC(C)=O)c2)cc1OC	ZINC000819013499	GE	On-Demand	Reactive	ENPP1	55	30
CCCOc1ccc(C(=O)NNC(=O)Cc2cccc(NC(C)=O)c2)cc1OC	ZINC000819013499	GE	On-Demand	Reactive	KCNK3	59	39
CCCOc1ccc(C(=O)NNC(=O)Cc2cccc(NC(C)=O)c2)cc1OC	ZINC000819013499	GE	On-Demand	Reactive	KCNK9	51	39
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc(F)cc3F)cc2)n1	ZINC000819013504	FG	On-Demand	Anodyne	ADRB1	32	40
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc(F)cc3F)cc2)n1	ZINC000819013504	FG	On-Demand	Anodyne	ADRB3	76	49
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(F)cc3F)cc2)n1	ZINC000819013505	FG	On-Demand	Anodyne	ADRB1	32	40
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(F)cc3F)cc2)n1	ZINC000819013505	FG	On-Demand	Anodyne	ADRB3	76	49
COc1cc(C(=O)NNC(=O)c2cc(C)ccc2C2CC2)ccc1OC(C)C	ZINC000819013506	GH	On-Demand	Reactive	KCNK3	47	38
COc1cc(C(=O)NNC(=O)c2cc(C)ccc2C2CC2)ccc1OC(C)C	ZINC000819013506	GH	On-Demand	Reactive	KCNK9	44	38
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccc(OCCCC)c(OC)c1	ZINC000819013509	EG	On-Demand	Reactive	PLA2G4B	42	46
O=C(NCC1(N2CCOCC2)CCCCC1)C(F)=C1CCC1	ZINC000819013533	DF	On-Demand	Anodyne	HCN1	57	35
O=C(NCC1(N2CCOCC2)CCCCC1)C(F)=C1CCC1	ZINC000819013533	DF	On-Demand	Anodyne	HCN4	53	34
CCC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819013547	EH	On-Demand	Bother	ADRB1	20	43
CCC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819013547	EH	On-Demand	Bother	ADRB3	40	36
CCC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819013548	EH	On-Demand	Bother	ADRB1	20	43
CCC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819013548	EH	On-Demand	Bother	ADRB3	40	36
CCC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819013549	EH	On-Demand	Bother	ADRB1	20	43
CCC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819013549	EH	On-Demand	Bother	ADRB3	40	36
CCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819013550	EH	On-Demand	Bother	ADRB1	20	43
CCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819013550	EH	On-Demand	Bother	ADRB3	40	36
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(F)cn3)cc2)n1	ZINC000819013565	FF	On-Demand	Anodyne	ADRB3	81	52
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc(F)cn3)cc2)n1	ZINC000819013566	FF	On-Demand	Anodyne	ADRB3	81	52
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccccc3Cl)cc2)n1	ZINC000819013582	FH	On-Demand	Anodyne	ADRB1	46	40
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccccc3Cl)cc2)n1	ZINC000819013582	FH	On-Demand	Anodyne	ADRB3	97	45
C[C@@H](NC(C)(C)CNC[C@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819013595	EH	On-Demand	Anodyne	ADRB1	20	41
C[C@@H](NC(C)(C)CNC[C@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819013595	EH	On-Demand	Anodyne	ADRB3	30	41
C[C@@H](NC(C)(C)CNC[C@@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819013596	EH	On-Demand	Anodyne	ADRB1	20	41
C[C@@H](NC(C)(C)CNC[C@@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819013596	EH	On-Demand	Anodyne	ADRB3	30	41
C[C@H](NC(C)(C)CNC[C@@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819013597	EH	On-Demand	Anodyne	ADRB1	20	41
C[C@H](NC(C)(C)CNC[C@@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819013597	EH	On-Demand	Anodyne	ADRB3	30	41
C[C@H](NC(C)(C)CNC[C@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819013598	EH	On-Demand	Anodyne	ADRB1	20	41
C[C@H](NC(C)(C)CNC[C@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819013598	EH	On-Demand	Anodyne	ADRB3	30	41
Cc1ccccc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013620	FH	On-Demand	Mild	PAPA1_CARPA	59	49
Cc1ccccc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013620	FH	On-Demand	Mild	CCKAR	41	37
Cc1ccccc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013620	FH	On-Demand	Mild	CTSK	30	46
Cc1ccccc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013620	FH	On-Demand	Mild	CTSL	21	49
Cc1ccccc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013620	FH	On-Demand	Mild	CTSS	19	49
Cc1ccccc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013620	FH	On-Demand	Mild	FPR1	53	45
Cc1ccccc1[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013621	FH	On-Demand	Mild	PAPA1_CARPA	59	49
Cc1ccccc1[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013621	FH	On-Demand	Mild	CCKAR	41	37
Cc1ccccc1[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013621	FH	On-Demand	Mild	CTSK	30	46
Cc1ccccc1[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013621	FH	On-Demand	Mild	CTSL	21	49
Cc1ccccc1[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013621	FH	On-Demand	Mild	CTSS	19	49
Cc1ccccc1[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013621	FH	On-Demand	Mild	FPR1	53	45
Cc1ccccc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013622	FH	On-Demand	Mild	PAPA1_CARPA	59	49
Cc1ccccc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013622	FH	On-Demand	Mild	CCKAR	41	37
Cc1ccccc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013622	FH	On-Demand	Mild	CTSK	30	46
Cc1ccccc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013622	FH	On-Demand	Mild	CTSL	21	49
Cc1ccccc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013622	FH	On-Demand	Mild	CTSS	19	49
Cc1ccccc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013622	FH	On-Demand	Mild	FPR1	53	45
Cc1ccccc1[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013623	FH	On-Demand	Mild	PAPA1_CARPA	59	49
Cc1ccccc1[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013623	FH	On-Demand	Mild	CCKAR	41	37
Cc1ccccc1[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013623	FH	On-Demand	Mild	CTSK	30	46
Cc1ccccc1[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013623	FH	On-Demand	Mild	CTSL	21	49
Cc1ccccc1[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013623	FH	On-Demand	Mild	CTSS	19	49
Cc1ccccc1[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819013623	FH	On-Demand	Mild	FPR1	53	45
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc(F)cc3)cc2)n1	ZINC000819013695	FG	On-Demand	Anodyne	ADRB2	45	44
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc(F)cc3)cc2)n1	ZINC000819013695	FG	On-Demand	Anodyne	ADRB1	43	42
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc(F)cc3)cc2)n1	ZINC000819013695	FG	On-Demand	Anodyne	ADRB3	119	58
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(F)cc3)cc2)n1	ZINC000819013696	FG	On-Demand	Anodyne	ADRB2	45	44
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(F)cc3)cc2)n1	ZINC000819013696	FG	On-Demand	Anodyne	ADRB1	43	42
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(F)cc3)cc2)n1	ZINC000819013696	FG	On-Demand	Anodyne	ADRB3	119	58
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(C)cc3)cc2)n1	ZINC000819013701	FG	On-Demand	Anodyne	ADRB2	44	45
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(C)cc3)cc2)n1	ZINC000819013701	FG	On-Demand	Anodyne	ADRB1	45	42
CCc1noc(-c2ccc(CCNC[C@H](O)c3ccc(C)cc3)cc2)n1	ZINC000819013701	FG	On-Demand	Anodyne	ADRB3	120	49
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc(C)cc3)cc2)n1	ZINC000819013702	FG	On-Demand	Anodyne	ADRB2	44	45
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc(C)cc3)cc2)n1	ZINC000819013702	FG	On-Demand	Anodyne	ADRB1	45	42
CCc1noc(-c2ccc(CCNC[C@@H](O)c3ccc(C)cc3)cc2)n1	ZINC000819013702	FG	On-Demand	Anodyne	ADRB3	120	49
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cc(F)ccc3F)cc2)n1	ZINC000819013717	FG	On-Demand	Anodyne	ADRB1	28	40
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cc(F)ccc3F)cc2)n1	ZINC000819013717	FG	On-Demand	Anodyne	ADRB3	76	49
CCc1noc(-c2ccc(CCNC[C@H](O)c3cc(F)ccc3F)cc2)n1	ZINC000819013719	FG	On-Demand	Anodyne	ADRB1	28	40
CCc1noc(-c2ccc(CCNC[C@H](O)c3cc(F)ccc3F)cc2)n1	ZINC000819013719	FG	On-Demand	Anodyne	ADRB3	76	49
CCc1noc(-c2ccc(CCNCCS(=O)(=O)CC)cc2)n1	ZINC000819013721	ED	On-Demand	Anodyne	ADRB3	17	41
CCc1noc(-c2ccc(CCNC[C@H](O)C3CC3)cc2)n1	ZINC000819013722	DE	On-Demand	Anodyne	ADRB3	46	42
CCc1noc(-c2ccc(CCNC[C@@H](O)C3CC3)cc2)n1	ZINC000819013731	DE	On-Demand	Anodyne	ADRB3	46	42
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)CNC(=O)Nc1ccccc1	ZINC000819013748	HD	On-Demand	Anodyne	AVPR2	17	40
CN(C)S(=O)(=O)c1ccc2c(c1)CCN2C(=O)CNC(=O)Nc1ccccc1	ZINC000819013748	HD	On-Demand	Anodyne	LPL	41	40
CC(=O)N1CCN(CCOc2ccc(CCNC[C@H](O)C3CC3)cc2)CC1	ZINC000819013749	GD	On-Demand	Anodyne	ADRB2	34	42
CC(=O)N1CCN(CCOc2ccc(CCNC[C@H](O)C3CC3)cc2)CC1	ZINC000819013749	GD	On-Demand	Anodyne	ADRB1	74	47
CC(=O)N1CCN(CCOc2ccc(CCNC[C@H](O)C3CC3)cc2)CC1	ZINC000819013749	GD	On-Demand	Anodyne	ADRB3	60	47
CC(=O)N1CCN(CCOc2ccc(CCNC[C@H](O)C3CC3)cc2)CC1	ZINC000819013749	GD	On-Demand	Anodyne	LTA4H	57	45
CC(=O)N1CCN(CCOc2ccc(CCNC[C@H](O)C3CC3)cc2)CC1	ZINC000819013749	GD	On-Demand	Anodyne	HRH3	42	42
CC(=O)N1CCN(CCOc2ccc(CCNC[C@H](O)C3CC3)cc2)CC1	ZINC000819013749	GD	On-Demand	Anodyne	PSMB1	41	37
CC(=O)N1CCN(CCOc2ccc(CCNC[C@@H](O)C3CC3)cc2)CC1	ZINC000819013750	GD	On-Demand	Anodyne	ADRB2	34	42
CC(=O)N1CCN(CCOc2ccc(CCNC[C@@H](O)C3CC3)cc2)CC1	ZINC000819013750	GD	On-Demand	Anodyne	ADRB1	74	47
CC(=O)N1CCN(CCOc2ccc(CCNC[C@@H](O)C3CC3)cc2)CC1	ZINC000819013750	GD	On-Demand	Anodyne	ADRB3	60	47
CC(=O)N1CCN(CCOc2ccc(CCNC[C@@H](O)C3CC3)cc2)CC1	ZINC000819013750	GD	On-Demand	Anodyne	LTA4H	57	45
CC(=O)N1CCN(CCOc2ccc(CCNC[C@@H](O)C3CC3)cc2)CC1	ZINC000819013750	GD	On-Demand	Anodyne	HRH3	42	42
CC(=O)N1CCN(CCOc2ccc(CCNC[C@@H](O)C3CC3)cc2)CC1	ZINC000819013750	GD	On-Demand	Anodyne	PSMB1	41	37
C=C(C)C(C)(C)C(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	ZINC000819013774	EG	On-Demand	Reactive	SCD1	17	43
C=C(C)C(C)(C)C(=O)NNC(=O)c1sc(-c2ccccc2)nc1C	ZINC000819013774	EG	On-Demand	Reactive	HPGDS	15	51
CCc1noc(-c2ccc(CCNC[C@H](O)c3cc(OC)ccc3OC)cc2)n1	ZINC000819013786	GG	On-Demand	Anodyne	ADRB2	37	49
CCc1noc(-c2ccc(CCNC[C@H](O)c3cc(OC)ccc3OC)cc2)n1	ZINC000819013786	GG	On-Demand	Anodyne	ADRB1	47	41
CCc1noc(-c2ccc(CCNC[C@H](O)c3cc(OC)ccc3OC)cc2)n1	ZINC000819013786	GG	On-Demand	Anodyne	ADRB3	73	43
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cc(OC)ccc3OC)cc2)n1	ZINC000819013787	GG	On-Demand	Anodyne	ADRB2	37	49
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cc(OC)ccc3OC)cc2)n1	ZINC000819013787	GG	On-Demand	Anodyne	ADRB1	47	41
CCc1noc(-c2ccc(CCNC[C@@H](O)c3cc(OC)ccc3OC)cc2)n1	ZINC000819013787	GG	On-Demand	Anodyne	ADRB3	73	43
O=C1OCCN1CCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819013802	FE	On-Demand	Anodyne	ADRB2	32	41
O=C1OCCN1CCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819013802	FE	On-Demand	Anodyne	ADRB1	57	41
O=C1OCCN1CCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819013802	FE	On-Demand	Anodyne	GRIN1	31	50
O=C1OCCN1CCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819013802	FE	On-Demand	Anodyne	ADRB3	43	42
O=C1OCCN1CCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819013803	FE	On-Demand	Anodyne	ADRB2	32	41
O=C1OCCN1CCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819013803	FE	On-Demand	Anodyne	ADRB1	57	41
O=C1OCCN1CCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819013803	FE	On-Demand	Anodyne	GRIN1	31	50
O=C1OCCN1CCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819013803	FE	On-Demand	Anodyne	ADRB3	43	42
Cc1ccccc1[C@H](C)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819013814	CF	On-Demand	Anodyne	UL26	57	33
Cc1ccccc1[C@H](C)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819013814	CF	On-Demand	Anodyne	SCAF_EBVB9	54	33
Cc1ccccc1[C@H](C)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819013815	CF	On-Demand	Anodyne	UL26	57	33
Cc1ccccc1[C@H](C)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819013815	CF	On-Demand	Anodyne	SCAF_EBVB9	54	33
Cc1ccccc1[C@H](C)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819013816	CF	On-Demand	Anodyne	UL26	57	33
Cc1ccccc1[C@H](C)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819013816	CF	On-Demand	Anodyne	SCAF_EBVB9	54	33
Cc1ccccc1[C@H](C)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819013817	CF	On-Demand	Anodyne	UL26	57	33
Cc1ccccc1[C@H](C)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819013817	CF	On-Demand	Anodyne	SCAF_EBVB9	54	33
O=C1OCCN1CCCNC[C@@H](O)COc1cccc(Br)c1	ZINC000819013827	FD	On-Demand	Anodyne	ADRB2	31	40
O=C1OCCN1CCCNC[C@@H](O)COc1cccc(Br)c1	ZINC000819013827	FD	On-Demand	Anodyne	ADRB1	51	39
O=C1OCCN1CCCNC[C@H](O)COc1cccc(Br)c1	ZINC000819013828	FD	On-Demand	Anodyne	ADRB2	31	40
O=C1OCCN1CCCNC[C@H](O)COc1cccc(Br)c1	ZINC000819013828	FD	On-Demand	Anodyne	ADRB1	51	39
O[C@@H](CNC1CC(c2ccccc2)C1)c1ccc(F)cn1	ZINC000819013857	CF	On-Demand	Anodyne	SLC18A3	15	40
O[C@H](CNC1CC(c2ccccc2)C1)c1ccc(F)cn1	ZINC000819013858	CF	On-Demand	Anodyne	SLC18A3	15	40
O[C@@H](CNC1CC(c2ccccc2)C1)c1ccc(Br)cc1	ZINC000819013886	EI	On-Demand	Anodyne	SLC18A3	18	59
O[C@H](CNC1CC(c2ccccc2)C1)c1ccc(Br)cc1	ZINC000819013887	EI	On-Demand	Anodyne	SLC18A3	18	59
CC(=O)N(c1ccc(NC(=O)/C(=C/c2ccco2)NC(=O)c2ccccc2)cc1)C1CC1	ZINC000819013898	II	On-Demand	Anodyne	ADAM12	34	42
CC(=O)N(c1ccc(NC(=O)/C(=C\c2ccco2)NC(=O)c2ccccc2)cc1)C1CC1	ZINC000819013899	II	On-Demand	Anodyne	ADAM12	34	42
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccsc2)cc1)C1CC1	ZINC000819013905	HJ	On-Demand	Anodyne	AVPR2	23	40
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccsc2)cc1)C1CC1	ZINC000819013905	HJ	On-Demand	Anodyne	KCNK3	22	42
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	CASP3	21	44
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	KLK3	82	44
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	CTSB	63	42
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	PAPA1_CARPA	60	40
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	CYSP_TRYCR	55	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	CTSK	43	45
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	CTSL	49	43
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	TIMP3	68	39
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	HDAC8	16	45
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	CAPNS1	70	42
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	MMP3	22	48
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	HDAC2	22	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	LGMN	47	37
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	MMP11	53	32
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	CTSS	24	43
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	CAPN1	85	43
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	CASP1	25	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	CAPN2	137	42
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	PLAU	24	42
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	CASP6	20	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	CASP9	38	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	NPR	68	36
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	PSMB5	38	40
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	KDM1A	15	52
CC(=O)N(c1ccc(NC(=O)[C@H](CC(N)=O)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819013910	IE	On-Demand	Anodyne	Q9NAW4_PLAFA	35	40
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccccc2Cl)cc1)C1CC1	ZINC000819013911	FJ	On-Demand	Anodyne	KCNQ2	20	41
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccccc2Cl)cc1)C1CC1	ZINC000819013912	FJ	On-Demand	Anodyne	KCNQ2	20	41
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819013935	GG	On-Demand	Anodyne	TIMP3	48	35
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819013935	GG	On-Demand	Anodyne	FPR1	40	35
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)cc1)C1CC1	ZINC000819013941	IK	On-Demand	Anodyne	AVPR2	46	42
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)cc1)C1CC1	ZINC000819013941	IK	On-Demand	Anodyne	F10	51	56
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)cc1)C1CC1	ZINC000819013941	IK	On-Demand	Anodyne	PRNP	42	39
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)cc1)C1CC1	ZINC000819013941	IK	On-Demand	Anodyne	NR1H4	19	47
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)cc1)C1CC1	ZINC000819013941	IK	On-Demand	Anodyne	HDAC1	16	44
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)cc1)C1CC1	ZINC000819013941	IK	On-Demand	Anodyne	NR2E3	63	36
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)cc1)C1CC1	ZINC000819013941	IK	On-Demand	Anodyne	SMO	20	43
CC(=O)N(c1ccc(NC(=O)c2ccccc2N(C)C(=O)C2CC2)cc1)C1CC1	ZINC000819013954	GH	On-Demand	Anodyne	NR2E3	53	35
C#CCN1CCC[C@H]1C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819013961	EE	On-Demand	Mild	HSD11B1	41	32
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2CC(c3ccccc3)C2)CC1	ZINC000819013978	FH	On-Demand	Anodyne	CCR8	28	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2CC(c3ccccc3)C2)CC1	ZINC000819013978	FH	On-Demand	Anodyne	GPR119	45	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2CC(c3ccccc3)C2)CC1	ZINC000819013980	FH	On-Demand	Anodyne	CCR8	28	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2CC(c3ccccc3)C2)CC1	ZINC000819013980	FH	On-Demand	Anodyne	GPR119	45	51
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)cc1)C1CC1	ZINC000819014003	HK	On-Demand	Anodyne	METAP1	44	37
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)cc1)C1CC1	ZINC000819014003	HK	On-Demand	Anodyne	PRNP	45	35
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)cc1)C1CC1	ZINC000819014003	HK	On-Demand	Anodyne	TACR3	16	41
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)cc1)C1CC1	ZINC000819014003	HK	On-Demand	Anodyne	NR2E3	51	32
CC(=O)N(c1ccc(NC(=O)[C@H](F)c2ccc(C(F)(F)F)cc2)cc1)C1CC1	ZINC000819014007	GJ	On-Demand	Anodyne	EPHX2	23	41
CC(=O)N(c1ccc(NC(=O)[C@@H](F)c2ccc(C(F)(F)F)cc2)cc1)C1CC1	ZINC000819014014	GJ	On-Demand	Anodyne	EPHX2	23	41
CC(=O)N(c1ccc(NC(=O)[C@]2(NC(=O)OCc3ccccc3)CCOC2)cc1)C1CC1	ZINC000819014015	IG	On-Demand	Anodyne	SLC12A5	57	32
CC(=O)N(c1ccc(NC(=O)[C@@]2(NC(=O)OCc3ccccc3)CCOC2)cc1)C1CC1	ZINC000819014016	IG	On-Demand	Anodyne	SLC12A5	57	32
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1)C1CC1	ZINC000819014019	HF	On-Demand	Anodyne	CPT1A	57	36
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1)C1CC1	ZINC000819014019	HF	On-Demand	Anodyne	CPT2	41	35
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1)C1CC1	ZINC000819014019	HF	On-Demand	Anodyne	CPT1B	42	35
CC(=O)N(c1ccc(NC(=O)/C(C)=C/c2ccc([N+](=O)[O-])cc2)cc1)C1CC1	ZINC000819014032	GI	On-Demand	Bother	SLC27A4	42	32
CC(=O)N(c1ccc(NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)cc1)C1CC1	ZINC000819014035	GI	On-Demand	Bother	SLC27A4	42	32
O=C(CCNCCCN1CCOC1=O)Nc1cccc(Br)c1	ZINC000819014039	FE	On-Demand	Anodyne	EGFR	17	41
CC(C)c1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014044	GJ	On-Demand	Mild	PAPA1_CARPA	51	48
CC(C)c1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014044	GJ	On-Demand	Mild	CTSK	42	48
CC(C)c1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014044	GJ	On-Demand	Mild	CTSL	21	47
CC(C)c1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014044	GJ	On-Demand	Mild	CTSS	20	52
CC(C)c1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014044	GJ	On-Demand	Mild	FPR1	49	43
CC(=O)N(c1ccc(NC(=O)c2cccc(I)c2O)cc1)C1CC1	ZINC000819014045	IH	On-Demand	Anodyne	Q25615_ONCVO	69	40
CC(C)c1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014046	GJ	On-Demand	Mild	PAPA1_CARPA	51	48
CC(C)c1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014046	GJ	On-Demand	Mild	CTSK	42	48
CC(C)c1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014046	GJ	On-Demand	Mild	CTSL	21	47
CC(C)c1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014046	GJ	On-Demand	Mild	CTSS	20	52
CC(C)c1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014046	GJ	On-Demand	Mild	FPR1	49	43
CC(C)c1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014048	GJ	On-Demand	Mild	PAPA1_CARPA	51	48
CC(C)c1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014048	GJ	On-Demand	Mild	CTSK	42	48
CC(C)c1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014048	GJ	On-Demand	Mild	CTSL	21	47
CC(C)c1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014048	GJ	On-Demand	Mild	CTSS	20	52
CC(C)c1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014048	GJ	On-Demand	Mild	FPR1	49	43
CC(C)c1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014050	GJ	On-Demand	Mild	PAPA1_CARPA	51	48
CC(C)c1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014050	GJ	On-Demand	Mild	CTSK	42	48
CC(C)c1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014050	GJ	On-Demand	Mild	CTSL	21	47
CC(C)c1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014050	GJ	On-Demand	Mild	CTSS	20	52
CC(C)c1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819014050	GJ	On-Demand	Mild	FPR1	49	43
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819014061	GE	On-Demand	Anodyne	TGM2	53	37
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819014061	GE	On-Demand	Anodyne	F13A1	60	37
O=C(/C=C\[C@H]1CCCO1)Nc1cccc2cccnc12	ZINC000819014078	CF	On-Demand	Anodyne	WNT3	15	42
O=C(/C=C/[C@H]1CCCO1)Nc1cccc2cccnc12	ZINC000819014079	CF	On-Demand	Anodyne	WNT3	15	42
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc2cccnc12	ZINC000819014080	CF	On-Demand	Anodyne	WNT3	15	42
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc2cccnc12	ZINC000819014081	CF	On-Demand	Anodyne	WNT3	15	42
CS(=O)(=O)c1ccc([C@H](O)CNC2CC(c3ccccc3)C2)cc1	ZINC000819014090	EF	On-Demand	Anodyne	ADRB3	34	40
CS(=O)(=O)c1ccc([C@@H](O)CNC2CC(c3ccccc3)C2)cc1	ZINC000819014091	EF	On-Demand	Anodyne	ADRB3	34	40
CC(=O)N(c1ccc(NC(=O)c2ccc(CNC(=O)OC(C)(C)C)cc2)cc1)C1CC1	ZINC000819014093	HI	On-Demand	Anodyne	GCGR	46	34
CC(=O)N(c1ccc(NC(=O)c2ccc(CNC(=O)OC(C)(C)C)cc2)cc1)C1CC1	ZINC000819014093	HI	On-Demand	Anodyne	GIPR	57	41
CC(=O)N(c1ccc(NC(=O)c2ccc(S(=O)(=O)C(F)(F)F)cc2)cc1)C1CC1	ZINC000819014108	IH	On-Demand	Anodyne	GIPR	44	34
CC(=O)N(c1ccc(NC(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)cc1)C1CC1	ZINC000819014110	IH	On-Demand	Anodyne	TGM2	45	36
CC(=O)N(c1ccc(NC(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)cc1)C1CC1	ZINC000819014110	IH	On-Demand	Anodyne	F13A1	60	39
CC(=O)N(c1ccc(NC(=O)C(C)(C)N2CCN(C(=O)OC(C)(C)C)CC2)cc1)C1CC1	ZINC000819014112	IG	On-Demand	Anodyne	F13A1	18	41
CC(=O)N(c1ccc(NC(=O)C(C)(C)N2CCN(C(=O)OC(C)(C)C)CC2)cc1)C1CC1	ZINC000819014112	IG	On-Demand	Anodyne	GPR119	34	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CSCN2C(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014121	HG	On-Demand	Anodyne	CACNA1B	15	40
CC(=O)N(c1ccc(NC(=O)[C@H]2CSCN2C(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014123	HG	On-Demand	Anodyne	CACNA1B	15	40
CC(=O)N(c1ccc(NC(=O)c2cnc(Cl)c(Cl)c2)cc1)C1CC1	ZINC000819014125	FI	On-Demand	Anodyne	TYK2	51	39
C=CC(=O)NCc1ccc(C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)cc1	ZINC000819014138	GG	On-Demand	Anodyne	GIPR	56	35
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	ACE	22	45
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	OPRM1	25	40
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	OPRD1	25	40
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	ELANE	31	41
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	CTSD	18	43
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	FCER2	57	33
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	CASP3	24	49
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	BMP1	19	42
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	KLK3	103	48
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	CTSB	84	52
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	PAPA1_CARPA	87	49
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	CYSP_TRYCR	62	47
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	CTSK	71	56
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	CTSL	66	51
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	PGA	32	41
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	TIMP3	82	41
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	HDAC8	17	45
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	CAPNS1	92	52
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	MMP2	24	45
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	MMP3	48	51
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	HLA-DRB1	78	36
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	HDAC2	23	41
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	REN	43	41
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	MMP11	54	36
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	CTSS	36	54
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	CAPN1	124	55
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	MMP9	20	41
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	CASP1	29	45
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	CAPN2	191	51
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	PLAU	21	40
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	CASP9	43	39
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	TGM2	33	40
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	MMP1	28	45
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	FPR1	78	41
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	NPR	95	46
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	PSMB5	55	52
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	KDM1A	15	52
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014144	II	On-Demand	Anodyne	Q9NAW4_PLAFA	35	40
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	ACE	22	45
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	OPRM1	25	40
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	OPRD1	25	40
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	ELANE	31	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	CTSD	18	43
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	FCER2	57	33
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	CASP3	24	49
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	BMP1	19	42
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	KLK3	103	48
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	CTSB	84	52
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	PAPA1_CARPA	87	49
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	CYSP_TRYCR	62	47
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	CTSK	71	56
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	CTSL	66	51
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	PGA	32	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	TIMP3	82	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	HDAC8	17	45
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	CAPNS1	92	52
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	MMP2	24	45
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	MMP3	48	51
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	HLA-DRB1	78	36
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	HDAC2	23	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	REN	43	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	MMP11	54	36
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	CTSS	36	54
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	CAPN1	124	55
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	MMP9	20	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	CASP1	29	45
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	CAPN2	191	51
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	PLAU	21	40
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	CASP9	43	39
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	TGM2	33	40
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	MMP1	28	45
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	FPR1	78	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	NPR	95	46
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	PSMB5	55	52
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	KDM1A	15	52
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014147	II	On-Demand	Anodyne	Q9NAW4_PLAFA	35	40
C=CCNS(=O)(=O)c1cc(C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)ccc1F	ZINC000819014152	IG	On-Demand	Mild	CPT1A	44	34
CC(=O)N(c1ccc(NC(=O)c2ccnc(F)c2)cc1)C1CC1	ZINC000819014163	DF	On-Demand	Anodyne	TYK2	45	35
CCN(CC)C(=O)COC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819014177	EE	On-Demand	Bother	GSTM2	40	34
CCN(CC)C(=O)COC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819014177	EE	On-Demand	Bother	COLA	73	38
CC(=O)N(c1ccc(NC(=O)c2cc(Cl)ncc2Cl)cc1)C1CC1	ZINC000819014180	FI	On-Demand	Anodyne	TYK2	60	35
CC(=O)N(c1ccc(NC(=O)c2cc(Cl)ncc2Cl)cc1)C1CC1	ZINC000819014180	FI	On-Demand	Anodyne	NR2E3	65	37
C[C@H](NC(C)(C)CNC[C@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819014200	EG	On-Demand	Mild	CTRB_BOVIN	45	31
CC(=O)N(c1ccc(NC(=O)c2nn(C)c(=O)c3ccccc23)cc1)C1CC1	ZINC000819014201	GF	On-Demand	Anodyne	IMDH_CRYPV	26	41
CC(=O)N(c1ccc(NC(=O)c2cc3ccccc3c(Cl)n2)cc1)C1CC1	ZINC000819014202	GJ	On-Demand	Anodyne	NR2E3	52	33
C[C@H](NC(C)(C)CNC[C@@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819014203	EG	On-Demand	Mild	CTRB_BOVIN	45	31
C[C@@H](NC(C)(C)CNC[C@@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819014204	EG	On-Demand	Mild	CTRB_BOVIN	45	31
C[C@@H](NC(C)(C)CNC[C@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819014205	EG	On-Demand	Mild	CTRB_BOVIN	45	31
CC(=O)N(c1ccc(NC(=O)c2ccccc2OCC(C)C)cc1)C1CC1	ZINC000819014218	FI	On-Demand	Anodyne	HCN1	47	32
CC(=O)N(c1ccc(NC(=O)c2ccccc2OCC(C)C)cc1)C1CC1	ZINC000819014218	FI	On-Demand	Anodyne	KCNK3	54	39
CC(=O)N(c1ccc(NC(=O)c2ccccc2OCC(C)C)cc1)C1CC1	ZINC000819014218	FI	On-Demand	Anodyne	KCNK9	51	39
CC(=O)N(c1ccc(NC(=O)Cn2c(S)nnc2-c2ccc(Cl)cc2)cc1)C1CC1	ZINC000819014229	II	On-Demand	Anodyne	IMDH_CRYPV	17	46
Cc1ccc2c(c1C)OC[C@H]2NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819014236	GG	On-Demand	Anodyne	GPR119	40	42
Cc1ccc2c(c1C)OC[C@@H]2NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819014239	GG	On-Demand	Anodyne	GPR119	40	42
Cc1ccc2c(c1C)OC[C@@H]2NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819014241	GG	On-Demand	Anodyne	GPR119	40	42
CC(=O)N(c1ccc(NC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)cc1)C1CC1	ZINC000819014242	IH	On-Demand	Anodyne	GPR119	38	41
Cc1ccc2c(c1C)OC[C@H]2NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819014243	GG	On-Demand	Anodyne	GPR119	40	42
CC(=O)N(c1ccc(NC(=O)c2cc(Cl)c3c(c2)OCCO3)cc1)C1CC1	ZINC000819014257	GH	On-Demand	Anodyne	CPT1A	21	40
CC(=O)N(c1ccc(NC(=O)[C@@H](C)Cc2ccc(F)cc2)cc1)C1CC1	ZINC000819014263	FI	On-Demand	Anodyne	F2R	27	41
CC(=O)N(c1ccc(NC(=O)[C@@H](C)Cc2ccc(F)cc2)cc1)C1CC1	ZINC000819014263	FI	On-Demand	Anodyne	TIMP3	45	40
CC(=O)N(c1ccc(NC(=O)[C@@H](C)Cc2ccc(F)cc2)cc1)C1CC1	ZINC000819014263	FI	On-Demand	Anodyne	NPY5R	15	40
CC(=O)N(c1ccc(NC(=O)[C@H](C)Cc2ccc(F)cc2)cc1)C1CC1	ZINC000819014265	FI	On-Demand	Anodyne	F2R	27	41
CC(=O)N(c1ccc(NC(=O)[C@H](C)Cc2ccc(F)cc2)cc1)C1CC1	ZINC000819014265	FI	On-Demand	Anodyne	TIMP3	45	40
CC(=O)N(c1ccc(NC(=O)[C@H](C)Cc2ccc(F)cc2)cc1)C1CC1	ZINC000819014265	FI	On-Demand	Anodyne	NPY5R	15	40
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccco3)nc3ccccc23)cc1)C1CC1	ZINC000819014273	HK	On-Demand	Anodyne	TACR3	15	50
CC(=O)N(c1ccc(NC(=O)c2cc3ccccc3oc2=O)cc1)C1CC1	ZINC000819014279	FH	On-Demand	Anodyne	MAOB	17	63
CC(=O)N(c1ccc(NC(=O)C=C2CCN(C(=O)OC(C)(C)C)CC2)cc1)C1CC1	ZINC000819014288	HI	On-Demand	Anodyne	TGM2	15	43
CC(=O)N(c1ccc(NC(=O)C=C2CCN(C(=O)OC(C)(C)C)CC2)cc1)C1CC1	ZINC000819014288	HI	On-Demand	Anodyne	F13A1	24	43
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)cc1)C1CC1	ZINC000819014292	HH	On-Demand	Anodyne	F2	15	42
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)cc1)C1CC1	ZINC000819014292	HH	On-Demand	Anodyne	UL80	23	40
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)cc1)C1CC1	ZINC000819014292	HH	On-Demand	Anodyne	PREP	38	46
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)cc1)C1CC1	ZINC000819014292	HH	On-Demand	Anodyne	CFTR	69	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc2cccnc12	ZINC000819014294	EG	On-Demand	Anodyne	WNT3	18	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc2cccnc12	ZINC000819014294	EG	On-Demand	Anodyne	G2YM83_BOTF4	45	34
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(COc2ccccc2)o1	ZINC000819014305	FG	On-Demand	Reactive	ADAM17	25	43
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1ccc(COc2ccccc2)o1	ZINC000819014306	FG	On-Demand	Reactive	ADAM17	25	43
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1)C1CC1	ZINC000819014315	HH	On-Demand	Anodyne	F2	15	42
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1)C1CC1	ZINC000819014315	HH	On-Demand	Anodyne	UL80	23	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1)C1CC1	ZINC000819014315	HH	On-Demand	Anodyne	PREP	38	46
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1)C1CC1	ZINC000819014315	HH	On-Demand	Anodyne	CFTR	69	44
CC(=O)N(c1ccc(NC(=O)c2ccc(C)c(-n3cccc3)c2)cc1)C1CC1	ZINC000819014320	FJ	On-Demand	Anodyne	ABL1	43	36
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCCS3(=O)=O)cc2Cl)cc1)C1CC1	ZINC000819014323	IH	On-Demand	Anodyne	CDK1	16	41
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCCS3(=O)=O)cc2Cl)cc1)C1CC1	ZINC000819014323	IH	On-Demand	Anodyne	NR2E3	53	35
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)C1CC1	ZINC000819014324	HF	On-Demand	Anodyne	CA2	24	62
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)C1CC1	ZINC000819014324	HF	On-Demand	Anodyne	CA6	17	43
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)C1CC1	ZINC000819014324	HF	On-Demand	Anodyne	CA1	23	62
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)C1CC1	ZINC000819014324	HF	On-Demand	Anodyne	CA7	25	43
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)C1CC1	ZINC000819014324	HF	On-Demand	Anodyne	CPT1A	56	36
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)C1CC1	ZINC000819014324	HF	On-Demand	Anodyne	CPT2	41	35
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)C1CC1	ZINC000819014324	HF	On-Demand	Anodyne	CA13	29	43
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)C1CC1	ZINC000819014324	HF	On-Demand	Anodyne	CA4	21	62
CC(=O)N(c1ccc(NC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)cc1)C1CC1	ZINC000819014325	HG	On-Demand	Anodyne	PRNP	40	37
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)cc1)C1CC1	ZINC000819014328	IF	On-Demand	Anodyne	CA2	27	40
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)cc1)C1CC1	ZINC000819014328	IF	On-Demand	Anodyne	CA4	25	40
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)cc1)C1CC1	ZINC000819014328	IF	On-Demand	Anodyne	CA9	24	40
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)C1CC1	ZINC000819014342	GE	On-Demand	Anodyne	CA2	56	45
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)C1CC1	ZINC000819014342	GE	On-Demand	Anodyne	CA1	49	45
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)C1CC1	ZINC000819014342	GE	On-Demand	Anodyne	CA4	52	45
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)C1CC1	ZINC000819014342	GE	On-Demand	Anodyne	CA12	40	42
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)C1CC1	ZINC000819014342	GE	On-Demand	Anodyne	CA9	40	45
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)C1CC1	ZINC000819014342	GE	On-Demand	Anodyne	MTCA1	44	39
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)C1CC1	ZINC000819014342	GE	On-Demand	Anodyne	P96878_MYCTU	55	39
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(NC(=O)OC(C)(C)C)c2)cc1)C1CC1	ZINC000819014368	IJ	On-Demand	Anodyne	CPT1A	45	33
CC(=O)N(c1ccc(NC(=O)Cc2cc(C(F)(F)F)cc(Cl)n2)cc1)C1CC1	ZINC000819014374	HI	On-Demand	Anodyne	MCHR1	15	41
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1	ZINC000819014423	GD	On-Demand	Anodyne	TGM2	64	40
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1	ZINC000819014423	GD	On-Demand	Anodyne	F13A1	59	40
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1	ZINC000819014424	GD	On-Demand	Anodyne	TGM2	64	40
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1	ZINC000819014424	GD	On-Demand	Anodyne	F13A1	59	40
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1	ZINC000819014426	GD	On-Demand	Anodyne	TGM2	64	40
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1	ZINC000819014426	GD	On-Demand	Anodyne	F13A1	59	40
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1	ZINC000819014428	GD	On-Demand	Anodyne	TGM2	64	40
CC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1	ZINC000819014428	GD	On-Demand	Anodyne	F13A1	59	40
CC(=O)N(c1ccc(NC(=O)c2ccnc(Cl)c2)cc1)C1CC1	ZINC000819014431	EH	On-Demand	Anodyne	TYK2	64	40
C[C@@H](NC(C)(C)CNC[C@H](O)c1ccccc1)c1ccccc1	ZINC000819014452	DG	On-Demand	Anodyne	ADRB2	15	43
C[C@@H](NC(C)(C)CNC[C@H](O)c1ccccc1)c1ccccc1	ZINC000819014452	DG	On-Demand	Anodyne	AOC3	15	45
C[C@H](NC(C)(C)CNC[C@H](O)c1ccccc1)c1ccccc1	ZINC000819014453	DG	On-Demand	Anodyne	ADRB2	15	43
C[C@H](NC(C)(C)CNC[C@H](O)c1ccccc1)c1ccccc1	ZINC000819014453	DG	On-Demand	Anodyne	AOC3	15	45
C[C@H](NC(C)(C)CNC[C@@H](O)c1ccccc1)c1ccccc1	ZINC000819014455	DG	On-Demand	Anodyne	ADRB2	15	43
C[C@H](NC(C)(C)CNC[C@@H](O)c1ccccc1)c1ccccc1	ZINC000819014455	DG	On-Demand	Anodyne	AOC3	15	45
C[C@@H](NC(C)(C)CNC[C@@H](O)c1ccccc1)c1ccccc1	ZINC000819014457	DG	On-Demand	Anodyne	ADRB2	15	43
C[C@@H](NC(C)(C)CNC[C@@H](O)c1ccccc1)c1ccccc1	ZINC000819014457	DG	On-Demand	Anodyne	AOC3	15	45
CC(=O)N(c1ccc(NC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014459	HH	On-Demand	Anodyne	REN	28	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014459	HH	On-Demand	Anodyne	POLG_HCV1	25	43
CC(=O)N(c1ccc(NC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014459	HH	On-Demand	Anodyne	FPR1	44	37
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014460	HH	On-Demand	Anodyne	REN	28	41
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014460	HH	On-Demand	Anodyne	POLG_HCV1	25	43
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014460	HH	On-Demand	Anodyne	FPR1	44	37
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1)C1CC1	ZINC000819014464	HH	On-Demand	Anodyne	EPHX2	26	40
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1)C1CC1	ZINC000819014464	HH	On-Demand	Anodyne	GPR119	38	44
CC(=O)N(c1ccc(NC(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)cc1)C1CC1	ZINC000819014465	IH	On-Demand	Anodyne	P2RX7	15	45
CC(=O)N(c1ccc(NC(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)cc1)C1CC1	ZINC000819014466	IH	On-Demand	Anodyne	P2RX7	15	45
CC(=O)N(c1ccc(NC(=O)[C@]2(F)CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819014488	IH	On-Demand	Anodyne	TGM2	28	41
CC(=O)N(c1ccc(NC(=O)[C@]2(F)CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819014488	IH	On-Demand	Anodyne	F13A1	45	41
CC(=O)N(c1ccc(NC(=O)[C@]2(F)CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819014488	IH	On-Demand	Anodyne	SLC12A5	69	36
CC(=O)N(c1ccc(NC(=O)[C@@]2(F)CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819014489	IH	On-Demand	Anodyne	TGM2	28	41
CC(=O)N(c1ccc(NC(=O)[C@@]2(F)CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819014489	IH	On-Demand	Anodyne	F13A1	45	41
CC(=O)N(c1ccc(NC(=O)[C@@]2(F)CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819014489	IH	On-Demand	Anodyne	SLC12A5	69	36
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(Cl)c(Cl)c1	ZINC000819014496	DH	On-Demand	Anodyne	KCNQ2	50	44
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(Cl)c(Cl)c1	ZINC000819014497	DH	On-Demand	Anodyne	KCNQ2	50	44
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(Cl)c(Cl)c1	ZINC000819014498	DH	On-Demand	Anodyne	KCNQ2	50	44
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(Cl)c(Cl)c1	ZINC000819014499	DH	On-Demand	Anodyne	KCNQ2	50	44
CC(=O)N(c1ccc(NC(=O)COc2ccc3c(c2)CCC3)cc1)C1CC1	ZINC000819014512	FH	On-Demand	Anodyne	HDAC8	18	41
CC(=O)N(c1ccc(NC(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)C1CC1	ZINC000819014537	HH	On-Demand	Anodyne	EPHX2	15	41
CC(=O)N(c1ccc(NC(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)C1CC1	ZINC000819014537	HH	On-Demand	Anodyne	GPR119	35	43
CC(=O)N(c1ccc(NC(=O)C[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)C1CC1	ZINC000819014538	HH	On-Demand	Anodyne	EPHX2	15	41
CC(=O)N(c1ccc(NC(=O)C[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)C1CC1	ZINC000819014538	HH	On-Demand	Anodyne	GPR119	35	43
CCn1nnc(C)c1/C=C/C(=O)c1ccc(OC)cc1Cl	ZINC000819014590	DG	On-Demand	Mild	CYSP_PLAFA	56	47
CCn1nnc(C)c1/C=C\C(=O)c1ccc(OC)cc1Cl	ZINC000819014591	DG	On-Demand	Mild	CYSP_PLAFA	56	47
CC(=O)N(c1ccc(NC(=O)c2cc(S(C)(=O)=O)ccc2Cl)cc1)C1CC1	ZINC000819014592	HH	On-Demand	Anodyne	SHH	25	42
CC(=O)N(c1ccc(NC(=O)c2cc(S(C)(=O)=O)ccc2Cl)cc1)C1CC1	ZINC000819014592	HH	On-Demand	Anodyne	SMO	15	48
CC(=O)N(c1ccc(NC(=O)c2ccccc2COc2cccc(C=O)c2)cc1)C1CC1	ZINC000819014594	IJ	On-Demand	Anodyne	OPRL1	17	44
CC(=O)N(c1ccc(NC(=O)[C@H](OC2CCCC2)c2ccccc2)cc1)C1CC1	ZINC000819014623	GJ	On-Demand	Anodyne	TIMP3	40	34
CC(=O)N(c1ccc(NC(=O)[C@H](OC2CCCC2)c2ccccc2)cc1)C1CC1	ZINC000819014623	GJ	On-Demand	Anodyne	AMY2	44	30
CC(=O)N(c1ccc(NC(=O)[C@@H](OC2CCCC2)c2ccccc2)cc1)C1CC1	ZINC000819014625	GJ	On-Demand	Anodyne	TIMP3	40	34
CC(=O)N(c1ccc(NC(=O)[C@@H](OC2CCCC2)c2ccccc2)cc1)C1CC1	ZINC000819014625	GJ	On-Demand	Anodyne	AMY2	44	30
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	CELA1	18	43
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	MME	55	36
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	TACR1	15	46
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	CTSD	15	42
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	PGC	65	41
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	CMA1	38	45
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	CTRA_BOVIN	28	45
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	FCER2	66	35
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	PAPA1_CARPA	77	54
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	CYSP_TRYCR	57	39
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	CCKAR	61	44
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	CTSK	28	54
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	CTSL	45	54
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	CACNA1B	52	36
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	PGA	33	41
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	TIMP3	97	47
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	HDAC8	22	54
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	TACR3	18	45
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	CAPNS1	56	36
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	HLA-DRB1	38	43
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	REN	94	51
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	REN1	27	42
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	CTSS	21	54
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	CAPN1	44	45
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	MMP9	16	47
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	CAPN2	44	38
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	ACE2	54	33
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	FPR1	79	49
CC(=O)N(c1ccc(NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014629	II	On-Demand	Anodyne	CTRB_BOVIN	20	40
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	CELA1	18	43
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	MME	55	36
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	TACR1	15	46
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	CTSD	15	42
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	PGC	65	41
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	CMA1	38	45
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	CTRA_BOVIN	28	45
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	FCER2	66	35
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	PAPA1_CARPA	77	54
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	CYSP_TRYCR	57	39
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	CCKAR	61	44
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	CTSK	28	54
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	CTSL	45	54
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	CACNA1B	52	36
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	PGA	33	41
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	TIMP3	97	47
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	HDAC8	22	54
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	TACR3	18	45
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	CAPNS1	56	36
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	HLA-DRB1	38	43
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	REN	94	51
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	REN1	27	42
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	CTSS	21	54
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	CAPN1	44	45
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	MMP9	16	47
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	CAPN2	44	38
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	ACE2	54	33
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	FPR1	79	49
CC(=O)N(c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014631	II	On-Demand	Anodyne	CTRB_BOVIN	20	40
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014640	HH	On-Demand	Anodyne	LTA4H	27	44
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014640	HH	On-Demand	Anodyne	HDAC2	21	44
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014640	HH	On-Demand	Anodyne	CAPN1	34	42
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014640	HH	On-Demand	Anodyne	CAPN2	57	42
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014640	HH	On-Demand	Anodyne	TGM2	34	40
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014640	HH	On-Demand	Anodyne	NPR	61	36
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014640	HH	On-Demand	Anodyne	F13A1	31	40
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014640	HH	On-Demand	Anodyne	KDM1A	17	41
C[C@@H](NC(C)(C)CNCCC(=O)Nc1ccc(N(C)C)cc1)c1ccccc1	ZINC000819014648	GH	On-Demand	Anodyne	NPY5R	26	41
CCCCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819014649	EJ	On-Demand	Mild	HDAC10	28	44
CCCCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819014649	EJ	On-Demand	Mild	HDAC2	20	44
CCCCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819014649	EJ	On-Demand	Mild	HDAC3	24	43
CCCCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819014649	EJ	On-Demand	Mild	HDAC6	22	40
CCCCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819014649	EJ	On-Demand	Mild	HDAC11	15	44
CCCCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819014649	EJ	On-Demand	Mild	ENPP2	36	50
CCCCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819014649	EJ	On-Demand	Mild	LUXR	30	40
CCCCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819014649	EJ	On-Demand	Mild	LASR	61	40
C[C@H](NC(C)(C)CNCCC(=O)Nc1ccc(N(C)C)cc1)c1ccccc1	ZINC000819014650	GH	On-Demand	Anodyne	NPY5R	26	41
CC(=O)N(c1ccc(NC(=O)c2ccc3c(c2)CCN3C(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014656	IJ	On-Demand	Anodyne	AVPR2	32	41
CC(=O)N(c1ccc(NC(=O)c2ccc3c(c2)CCN3C(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014656	IJ	On-Demand	Anodyne	CPT1A	40	38
CC(=O)N(c1ccc(NC(=O)c2ccc3c(c2)CCN3C(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014656	IJ	On-Demand	Anodyne	GPR119	17	41
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)C1CC1	ZINC000819014660	HJ	On-Demand	Anodyne	AVPR2	43	43
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)C1CC1	ZINC000819014660	HJ	On-Demand	Anodyne	PRNP	48	40
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)C1CC1	ZINC000819014660	HJ	On-Demand	Anodyne	ABCB1B	30	42
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)C1CC1	ZINC000819014660	HJ	On-Demand	Anodyne	NR1H4	19	49
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)C1CC1	ZINC000819014660	HJ	On-Demand	Anodyne	NR2E3	53	38
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)C1CC1	ZINC000819014660	HJ	On-Demand	Anodyne	SMO	21	47
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)C1CC1	ZINC000819014660	HJ	On-Demand	Anodyne	KCNK3	76	41
CC(=O)N(c1ccc(NC(=O)c2ccnc(CNC(=O)OC(C)(C)C)c2)cc1)C1CC1	ZINC000819014661	HH	On-Demand	Anodyne	GCGR	45	31
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819014668	HI	On-Demand	Anodyne	CTSD	21	41
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819014668	HI	On-Demand	Anodyne	ECE1	39	41
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819014668	HI	On-Demand	Anodyne	REN	17	40
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819014670	HI	On-Demand	Anodyne	CTSD	21	41
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819014670	HI	On-Demand	Anodyne	ECE1	39	41
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819014670	HI	On-Demand	Anodyne	REN	17	40
CC(=O)N(c1ccc(NC(=O)c2cccc(NS(=O)(=O)C(F)(F)F)c2)cc1)C1CC1	ZINC000819014686	IH	On-Demand	Anodyne	UL80	41	38
CC(=O)N(c1ccc(NC(=O)c2cccc(NS(=O)(=O)C(F)(F)F)c2)cc1)C1CC1	ZINC000819014686	IH	On-Demand	Anodyne	TAAR1	37	40
CC(=O)N(c1ccc(NC(=O)c2cccc(NS(=O)(=O)C(F)(F)F)c2)cc1)C1CC1	ZINC000819014686	IH	On-Demand	Anodyne	KCNK3	95	42
CC(=O)N(c1ccc(NC(=O)c2cccc(NS(=O)(=O)C(F)(F)F)c2)cc1)C1CC1	ZINC000819014686	IH	On-Demand	Anodyne	KCNK9	49	36
COc1ccc2c(C)c(CCC(=O)Nc3ccc(N(C(C)=O)C4CC4)cc3)c(=O)oc2c1	ZINC000819014689	II	On-Demand	Anodyne	MAOB	29	42
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccccc1C	ZINC000819014699	CE	On-Demand	Reactive	ECR	31	43
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccccc1C	ZINC000819014699	CE	On-Demand	Reactive	CCR8	45	34
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccccc1C	ZINC000819014699	CE	On-Demand	Reactive	E3UJZ5_SPOLI	20	43
O=[N+]([O-])c1cccc([C@@H](O)CNC2CC(c3ccccc3)C2)c1	ZINC000819014701	DG	On-Demand	Bother	CACNA1C	63	41
O=[N+]([O-])c1cccc([C@@H](O)CNC2CC(c3ccccc3)C2)c1	ZINC000819014701	DG	On-Demand	Bother	CACNA1D	92	41
O=[N+]([O-])c1cccc([C@H](O)CNC2CC(c3ccccc3)C2)c1	ZINC000819014702	DG	On-Demand	Bother	CACNA1C	63	41
O=[N+]([O-])c1cccc([C@H](O)CNC2CC(c3ccccc3)C2)c1	ZINC000819014702	DG	On-Demand	Bother	CACNA1D	92	41
COc1ccccc1[C@H](CNC(=O)/C=C\[C@@H]1CCCO1)N1CCCC1	ZINC000819014709	EF	On-Demand	Anodyne	ACKR3	41	30
COc1ccccc1[C@H](CNC(=O)/C=C/[C@@H]1CCCO1)N1CCCC1	ZINC000819014710	EF	On-Demand	Anodyne	ACKR3	41	30
COc1ccccc1[C@H](CNC(=O)/C=C/[C@H]1CCCO1)N1CCCC1	ZINC000819014711	EF	On-Demand	Anodyne	ACKR3	41	30
COc1ccccc1[C@H](CNC(=O)/C=C\[C@H]1CCCO1)N1CCCC1	ZINC000819014712	EF	On-Demand	Anodyne	ACKR3	41	30
CC(=O)N(c1ccc(NC(=O)c2ccc(-n3cccc3)nc2)cc1)C1CC1	ZINC000819014769	FH	On-Demand	Anodyne	PRNP	44	36
CC(=O)N(c1ccc(NC(=O)Cn2c(S)nnc2-c2cccs2)cc1)C1CC1	ZINC000819014770	HG	On-Demand	Anodyne	IMDH_CRYPV	15	44
Cc1ccc2c(c1C)OC[C@H]2NC[C@H](O)c1cccnc1	ZINC000819014772	CE	On-Demand	Anodyne	ADRB3	59	38
Cc1ccc2c(c1C)OC[C@@H]2NC[C@H](O)c1cccnc1	ZINC000819014775	CE	On-Demand	Anodyne	ADRB3	59	38
Cc1ccc2c(c1C)OC[C@H]2NC[C@@H](O)c1cccnc1	ZINC000819014777	CE	On-Demand	Anodyne	ADRB3	59	38
Cc1ccc2c(c1C)OC[C@@H]2NC[C@@H](O)c1cccnc1	ZINC000819014779	CE	On-Demand	Anodyne	ADRB3	59	38
CC(=O)N(c1ccc(NC(=O)c2c(O)cccc2Cl)cc1)C1CC1	ZINC000819014782	EH	On-Demand	Anodyne	TYK2	72	45
CC(=O)N(c1ccc(NC(=O)c2c(O)cccc2Cl)cc1)C1CC1	ZINC000819014782	EH	On-Demand	Anodyne	NR2E3	52	33
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc2ccccc2c1	ZINC000819014811	CH	On-Demand	Anodyne	KCNQ2	52	41
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc2ccccc2c1	ZINC000819014812	CH	On-Demand	Anodyne	KCNQ2	52	41
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc2ccccc2c1	ZINC000819014814	CH	On-Demand	Anodyne	KCNQ2	52	41
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc2ccccc2c1	ZINC000819014815	CH	On-Demand	Anodyne	KCNQ2	52	41
CC(=O)N(c1ccc(NC(=O)CCN2CCOCC2)cc1)C1CC1	ZINC000819014817	ED	On-Demand	Anodyne	MTOR	45	34
CC(=O)N(c1ccc(NC(=O)CCN2CCOCC2)cc1)C1CC1	ZINC000819014817	ED	On-Demand	Anodyne	EPHX2	27	41
CC(=O)N(c1ccc(NC(=O)/C(C#N)=C/c2ccc(O)cc2)cc1)C1CC1	ZINC000819014830	FG	On-Demand	Reactive	CA12	17	55
CC(=O)N(c1ccc(NC(=O)/C(C#N)=C\c2ccc(O)cc2)cc1)C1CC1	ZINC000819014833	FG	On-Demand	Reactive	CA12	17	55
CC(=O)N(c1ccc(NC(=O)c2cc(Cl)nc3ccccc23)cc1)C1CC1	ZINC000819014837	GJ	On-Demand	Anodyne	NR2E3	69	38
CC(=O)N(c1ccc(NC(=O)c2ccc(-n3ccc(C(F)(F)F)n3)cc2)cc1)C1CC1	ZINC000819014841	IJ	On-Demand	Anodyne	PRNP	40	33
CC(=O)N(c1ccc(NC(=O)c2ccc3c(c2)CCN3C)cc1)C1CC1	ZINC000819014847	EG	On-Demand	Anodyne	HTR1F	31	43
CC(=O)N(c1ccc(NC(=O)c2ccnc(-n3ccnc3)c2)cc1)C1CC1	ZINC000819014848	FG	On-Demand	Anodyne	NOS2	66	32
CN(C)C(=O)C1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819014851	GD	On-Demand	Mild	PAPA1_CARPA	30	40
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014853	II	On-Demand	Anodyne	F2	41	48
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014853	II	On-Demand	Anodyne	ACE	28	43
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014853	II	On-Demand	Anodyne	FKBP1A	57	46
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014853	II	On-Demand	Anodyne	OPRM1	34	40
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014853	II	On-Demand	Anodyne	CELA1	26	48
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014853	II	On-Demand	Anodyne	ELANE	36	43
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014853	II	On-Demand	Anodyne	CTRA_BOVIN	59	32
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014853	II	On-Demand	Anodyne	TRY1_BOVIN	52	33
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014853	II	On-Demand	Anodyne	CTSG	41	32
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014853	II	On-Demand	Anodyne	PREP	61	48
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014853	II	On-Demand	Anodyne	CELA2A	49	32
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014853	II	On-Demand	Anodyne	LGMN	96	49
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014853	II	On-Demand	Anodyne	CFTR	59	38
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014853	II	On-Demand	Anodyne	KLK5	25	43
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014853	II	On-Demand	Anodyne	XIAP	41	39
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014853	II	On-Demand	Anodyne	F13A1	44	38
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014853	II	On-Demand	Anodyne	BRCA1	43	31
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014853	II	On-Demand	Anodyne	SLC12A5	76	39
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014853	II	On-Demand	Anodyne	TMPRSS11D	51	35
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014854	II	On-Demand	Anodyne	F2	41	48
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014854	II	On-Demand	Anodyne	ACE	28	43
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014854	II	On-Demand	Anodyne	FKBP1A	57	46
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014854	II	On-Demand	Anodyne	OPRM1	34	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014854	II	On-Demand	Anodyne	CELA1	26	48
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014854	II	On-Demand	Anodyne	ELANE	36	43
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014854	II	On-Demand	Anodyne	CTRA_BOVIN	59	32
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014854	II	On-Demand	Anodyne	TRY1_BOVIN	52	33
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014854	II	On-Demand	Anodyne	CTSG	41	32
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014854	II	On-Demand	Anodyne	PREP	61	48
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014854	II	On-Demand	Anodyne	CELA2A	49	32
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014854	II	On-Demand	Anodyne	LGMN	96	49
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014854	II	On-Demand	Anodyne	CFTR	59	38
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014854	II	On-Demand	Anodyne	KLK5	25	43
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014854	II	On-Demand	Anodyne	XIAP	41	39
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014854	II	On-Demand	Anodyne	F13A1	44	38
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014854	II	On-Demand	Anodyne	BRCA1	43	31
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014854	II	On-Demand	Anodyne	SLC12A5	76	39
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819014854	II	On-Demand	Anodyne	TMPRSS11D	51	35
CN(C)C(=O)C1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819014855	GD	On-Demand	Mild	PAPA1_CARPA	30	40
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc2ccccc12	ZINC000819014857	FI	On-Demand	Anodyne	DRD4	23	47
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc2ccccc12	ZINC000819014857	FI	On-Demand	Anodyne	ACHE	19	41
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc2ccccc12	ZINC000819014857	FI	On-Demand	Anodyne	HTR1D	20	43
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc2ccccc12	ZINC000819014857	FI	On-Demand	Anodyne	HTR1B	16	43
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc2ccccc12	ZINC000819014857	FI	On-Demand	Anodyne	SLC6A3	15	43
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc2ccccc12	ZINC000819014857	FI	On-Demand	Anodyne	HTR4	28	47
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc2ccccc12	ZINC000819014857	FI	On-Demand	Anodyne	SIGMAR1	37	47
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc2ccccc12	ZINC000819014858	FI	On-Demand	Anodyne	DRD4	23	47
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc2ccccc12	ZINC000819014858	FI	On-Demand	Anodyne	ACHE	19	41
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc2ccccc12	ZINC000819014858	FI	On-Demand	Anodyne	HTR1D	20	43
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc2ccccc12	ZINC000819014858	FI	On-Demand	Anodyne	HTR1B	16	43
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc2ccccc12	ZINC000819014858	FI	On-Demand	Anodyne	SLC6A3	15	43
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc2ccccc12	ZINC000819014858	FI	On-Demand	Anodyne	HTR4	28	47
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc2ccccc12	ZINC000819014858	FI	On-Demand	Anodyne	SIGMAR1	37	47
CC(=O)N(c1ccc(NC(=O)c2cccc3c2CCCN3C(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014864	IK	On-Demand	Anodyne	AVPR2	71	42
CC(=O)N(c1ccc(NC(=O)c2cccc3c2CCCN3C(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819014864	IK	On-Demand	Anodyne	AVPR1A	36	42
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014865	CD	On-Demand	Anodyne	DRD4	17	41
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014865	CD	On-Demand	Anodyne	ACHE	20	45
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014865	CD	On-Demand	Anodyne	HTR1D	15	43
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014865	CD	On-Demand	Anodyne	SLC6A3	15	49
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014865	CD	On-Demand	Anodyne	HTR4	16	43
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014865	CD	On-Demand	Anodyne	GRIN2B	28	40
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014865	CD	On-Demand	Anodyne	SIGMAR1	47	50
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014865	CD	On-Demand	Anodyne	BIRC2	29	42
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014866	CD	On-Demand	Anodyne	DRD4	17	41
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014866	CD	On-Demand	Anodyne	ACHE	20	45
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014866	CD	On-Demand	Anodyne	HTR1D	15	43
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014866	CD	On-Demand	Anodyne	SLC6A3	15	49
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014866	CD	On-Demand	Anodyne	HTR4	16	43
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014866	CD	On-Demand	Anodyne	GRIN2B	28	40
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014866	CD	On-Demand	Anodyne	SIGMAR1	47	50
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014866	CD	On-Demand	Anodyne	BIRC2	29	42
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014868	CD	On-Demand	Anodyne	DRD4	17	41
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014868	CD	On-Demand	Anodyne	ACHE	20	45
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014868	CD	On-Demand	Anodyne	HTR1D	15	43
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014868	CD	On-Demand	Anodyne	SLC6A3	15	49
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014868	CD	On-Demand	Anodyne	HTR4	16	43
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014868	CD	On-Demand	Anodyne	GRIN2B	28	40
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014868	CD	On-Demand	Anodyne	SIGMAR1	47	50
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014868	CD	On-Demand	Anodyne	BIRC2	29	42
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014870	CD	On-Demand	Anodyne	DRD4	17	41
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014870	CD	On-Demand	Anodyne	ACHE	20	45
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014870	CD	On-Demand	Anodyne	HTR1D	15	43
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014870	CD	On-Demand	Anodyne	SLC6A3	15	49
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014870	CD	On-Demand	Anodyne	HTR4	16	43
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014870	CD	On-Demand	Anodyne	GRIN2B	28	40
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014870	CD	On-Demand	Anodyne	SIGMAR1	47	50
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)C1CC1	ZINC000819014870	CD	On-Demand	Anodyne	BIRC2	29	42
CC(=O)N(c1ccc(NC(=O)c2ccnc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819014873	FH	On-Demand	Anodyne	TRPV1	19	42
CCOC(=O)N1CCC(NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819014882	FF	On-Demand	Anodyne	P2RY12	52	34
CCOC(=O)N1CCC(NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819014882	FF	On-Demand	Anodyne	GRIN2B	32	42
CCOC(=O)N1CCC(NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819014882	FF	On-Demand	Anodyne	C3AR1	41	41
CCOC(=O)N1CCC(NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819014882	FF	On-Demand	Anodyne	FAAH	17	42
CCOC(=O)N1CCC(NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819014882	FF	On-Demand	Anodyne	CCR8	34	41
N#Cc1ccc(CN2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819014888	DF	On-Demand	Mild	KCNJ1	16	40
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014895	FG	On-Demand	Anodyne	HTR2A	21	50
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014895	FG	On-Demand	Anodyne	SLC6A3	23	50
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014895	FG	On-Demand	Anodyne	HTR4	15	42
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014895	FG	On-Demand	Anodyne	SIGMAR1	35	53
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014895	FG	On-Demand	Anodyne	CCR3	50	42
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014897	FG	On-Demand	Anodyne	HTR2A	21	50
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014897	FG	On-Demand	Anodyne	SLC6A3	23	50
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014897	FG	On-Demand	Anodyne	HTR4	15	42
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014897	FG	On-Demand	Anodyne	SIGMAR1	35	53
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014897	FG	On-Demand	Anodyne	CCR3	50	42
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014898	FG	On-Demand	Anodyne	HTR2A	21	50
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014898	FG	On-Demand	Anodyne	SLC6A3	23	50
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014898	FG	On-Demand	Anodyne	HTR4	15	42
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014898	FG	On-Demand	Anodyne	SIGMAR1	35	53
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014898	FG	On-Demand	Anodyne	CCR3	50	42
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014900	FG	On-Demand	Anodyne	HTR2A	21	50
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014900	FG	On-Demand	Anodyne	SLC6A3	23	50
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014900	FG	On-Demand	Anodyne	HTR4	15	42
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014900	FG	On-Demand	Anodyne	SIGMAR1	35	53
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1F	ZINC000819014900	FG	On-Demand	Anodyne	CCR3	50	42
CC(=O)N(c1ccc(NC(=O)c2cc(Br)ncc2Cl)cc1)C1CC1	ZINC000819014906	HI	On-Demand	Anodyne	TYK2	50	34
CC(=O)N(c1ccc(NC(=O)c2cc(Br)ncc2Cl)cc1)C1CC1	ZINC000819014906	HI	On-Demand	Anodyne	NR2E3	66	37
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(C)(=O)=O)c2)cc1)C1CC1	ZINC000819014910	GF	On-Demand	Anodyne	CPT1A	61	37
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(C)(=O)=O)c2)cc1)C1CC1	ZINC000819014910	GF	On-Demand	Anodyne	CPT2	42	35
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(C)(=O)=O)c2)cc1)C1CC1	ZINC000819014910	GF	On-Demand	Anodyne	CPT1B	42	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1)C2	ZINC000819014916	GH	On-Demand	Anodyne	CCR2	64	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)c1cccc(C(F)(F)F)c1)C2	ZINC000819014918	GH	On-Demand	Anodyne	CCR2	64	36
CC(=O)N(c1ccc(NC(=O)c2ccc(CNC(=O)C=C(C)C)cc2)cc1)C1CC1	ZINC000819014920	HI	On-Demand	Anodyne	GIPR	56	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)c1cccc(C(F)(F)F)c1)C2	ZINC000819014921	GH	On-Demand	Anodyne	CCR2	64	36
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(N)(=O)=O)c2)cc1)C1CC1	ZINC000819014922	GE	On-Demand	Anodyne	CA2	16	45
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(N)(=O)=O)c2)cc1)C1CC1	ZINC000819014922	GE	On-Demand	Anodyne	CPT1A	59	37
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(N)(=O)=O)c2)cc1)C1CC1	ZINC000819014922	GE	On-Demand	Anodyne	CPT2	41	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1)C2	ZINC000819014923	GH	On-Demand	Anodyne	CCR2	64	36
CC(=O)N(c1ccc(NC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)cc1)C1CC1	ZINC000819014924	HG	On-Demand	Anodyne	RORC	39	40
CCOC(=O)N1CCC(NC(=O)C2(c3ccc(C)cc3)CCC2)CC1	ZINC000819014925	EG	On-Demand	Anodyne	GRIN2B	17	41
CCOC(=O)N1CCC(NC(=O)C2(c3ccc(C)cc3)CCC2)CC1	ZINC000819014925	EG	On-Demand	Anodyne	EPHX2	27	44
CCOC(=O)N1CCC(NC(=O)C2(c3ccc(C)cc3)CCC2)CC1	ZINC000819014925	EG	On-Demand	Anodyne	CCR8	35	42
CC(=O)N(c1ccc(NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)cc1)C1CC1	ZINC000819014926	HI	On-Demand	Anodyne	EPHX2	20	44
CC(=O)N(c1ccc(NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)cc1)C1CC1	ZINC000819014926	HI	On-Demand	Anodyne	F13A1	18	40
CC(=O)N(c1ccc(NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)cc1)C1CC1	ZINC000819014926	HI	On-Demand	Anodyne	GPR119	45	46
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)cc1)C1CC1	ZINC000819014928	HK	On-Demand	Anodyne	TACR3	25	47
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)cc1)C1CC1	ZINC000819014928	HK	On-Demand	Anodyne	CYP2C9	17	67
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)cc1)C1CC1	ZINC000819014928	HK	On-Demand	Anodyne	NR2E3	64	35
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)cc1)C1CC1	ZINC000819014928	HK	On-Demand	Anodyne	MT-CO2	44	41
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014947	FH	On-Demand	Anodyne	ADRB2	47	39
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014947	FH	On-Demand	Anodyne	ADRB1	55	48
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014947	FH	On-Demand	Anodyne	DRD4	22	41
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014947	FH	On-Demand	Anodyne	HTR1D	15	41
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014947	FH	On-Demand	Anodyne	SLC6A3	28	44
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014947	FH	On-Demand	Anodyne	HTR4	15	42
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014947	FH	On-Demand	Anodyne	ADRB3	67	48
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014947	FH	On-Demand	Anodyne	SIGMAR1	36	46
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014947	FH	On-Demand	Anodyne	CCR5	20	45
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014948	FH	On-Demand	Anodyne	ADRB2	47	39
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014948	FH	On-Demand	Anodyne	ADRB1	55	48
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014948	FH	On-Demand	Anodyne	DRD4	22	41
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014948	FH	On-Demand	Anodyne	HTR1D	15	41
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014948	FH	On-Demand	Anodyne	SLC6A3	28	44
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014948	FH	On-Demand	Anodyne	HTR4	15	42
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014948	FH	On-Demand	Anodyne	ADRB3	67	48
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014948	FH	On-Demand	Anodyne	SIGMAR1	36	46
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014948	FH	On-Demand	Anodyne	CCR5	20	45
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014949	FH	On-Demand	Anodyne	ADRB2	47	39
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014949	FH	On-Demand	Anodyne	ADRB1	55	48
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014949	FH	On-Demand	Anodyne	DRD4	22	41
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014949	FH	On-Demand	Anodyne	HTR1D	15	41
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014949	FH	On-Demand	Anodyne	SLC6A3	28	44
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014949	FH	On-Demand	Anodyne	HTR4	15	42
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014949	FH	On-Demand	Anodyne	ADRB3	67	48
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014949	FH	On-Demand	Anodyne	SIGMAR1	36	46
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014949	FH	On-Demand	Anodyne	CCR5	20	45
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014950	FH	On-Demand	Anodyne	ADRB2	47	39
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014950	FH	On-Demand	Anodyne	ADRB1	55	48
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014950	FH	On-Demand	Anodyne	DRD4	22	41
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014950	FH	On-Demand	Anodyne	HTR1D	15	41
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014950	FH	On-Demand	Anodyne	SLC6A3	28	44
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014950	FH	On-Demand	Anodyne	HTR4	15	42
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014950	FH	On-Demand	Anodyne	ADRB3	67	48
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014950	FH	On-Demand	Anodyne	SIGMAR1	36	46
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819014950	FH	On-Demand	Anodyne	CCR5	20	45
CCOC(=O)N1CCC(NC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819014951	FD	On-Demand	Anodyne	GRIN2B	24	40
CCOC(=O)N1CCC(NC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819014951	FD	On-Demand	Anodyne	EPHX2	23	45
CCOC(=O)N1CCC(NC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819014951	FD	On-Demand	Anodyne	CCR8	24	41
CCOC(=O)N1CCC(NC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819014951	FD	On-Demand	Anodyne	GPR119	17	41
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1c(F)cccc1F	ZINC000819014964	FG	On-Demand	Anodyne	DRD4	16	40
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1c(F)cccc1F	ZINC000819014964	FG	On-Demand	Anodyne	SLC6A3	19	47
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1c(F)cccc1F	ZINC000819014964	FG	On-Demand	Anodyne	HTR4	18	42
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1c(F)cccc1F	ZINC000819014964	FG	On-Demand	Anodyne	SIGMAR1	36	51
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1c(F)cccc1F	ZINC000819014965	FG	On-Demand	Anodyne	DRD4	16	40
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1c(F)cccc1F	ZINC000819014965	FG	On-Demand	Anodyne	SLC6A3	19	47
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1c(F)cccc1F	ZINC000819014965	FG	On-Demand	Anodyne	HTR4	18	42
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1c(F)cccc1F	ZINC000819014965	FG	On-Demand	Anodyne	SIGMAR1	36	51
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1c(F)cccc1F	ZINC000819014966	FG	On-Demand	Anodyne	DRD4	16	40
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1c(F)cccc1F	ZINC000819014966	FG	On-Demand	Anodyne	SLC6A3	19	47
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1c(F)cccc1F	ZINC000819014966	FG	On-Demand	Anodyne	HTR4	18	42
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1c(F)cccc1F	ZINC000819014966	FG	On-Demand	Anodyne	SIGMAR1	36	51
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1c(F)cccc1F	ZINC000819014967	FG	On-Demand	Anodyne	DRD4	16	40
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1c(F)cccc1F	ZINC000819014967	FG	On-Demand	Anodyne	SLC6A3	19	47
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1c(F)cccc1F	ZINC000819014967	FG	On-Demand	Anodyne	HTR4	18	42
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1c(F)cccc1F	ZINC000819014967	FG	On-Demand	Anodyne	SIGMAR1	36	51
CN(C)CCCOc1ccc(CNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819014973	FG	On-Demand	Anodyne	ADRB2	20	43
CN(C)CCCOc1ccc(CNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819014973	FG	On-Demand	Anodyne	LTA4H	23	41
CN(C)CCCOc1ccc(CNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819014973	FG	On-Demand	Anodyne	ESRRG	45	34
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014978	EF	On-Demand	Anodyne	DRD4	38	46
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014978	EF	On-Demand	Anodyne	SIGMAR1	22	43
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014978	EF	On-Demand	Anodyne	CCR1	18	44
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014978	EF	On-Demand	Anodyne	LSS	17	45
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014978	EF	On-Demand	Anodyne	FAAH	17	47
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014979	EF	On-Demand	Anodyne	DRD4	38	46
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014979	EF	On-Demand	Anodyne	SIGMAR1	22	43
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014979	EF	On-Demand	Anodyne	CCR1	18	44
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014979	EF	On-Demand	Anodyne	LSS	17	45
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014979	EF	On-Demand	Anodyne	FAAH	17	47
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014980	EF	On-Demand	Anodyne	DRD4	38	46
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014980	EF	On-Demand	Anodyne	SIGMAR1	22	43
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014980	EF	On-Demand	Anodyne	CCR1	18	44
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014980	EF	On-Demand	Anodyne	LSS	17	45
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014980	EF	On-Demand	Anodyne	FAAH	17	47
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014981	EF	On-Demand	Anodyne	DRD4	38	46
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014981	EF	On-Demand	Anodyne	SIGMAR1	22	43
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014981	EF	On-Demand	Anodyne	CCR1	18	44
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014981	EF	On-Demand	Anodyne	LSS	17	45
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819014981	EF	On-Demand	Anodyne	FAAH	17	47
C[C@@H](NC(C)(C)CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819015006	DF	On-Demand	Anodyne	ADRB2	24	43
C[C@@H](NC(C)(C)CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819015006	DF	On-Demand	Anodyne	ADRB1	24	46
C[C@@H](NC(C)(C)CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819015006	DF	On-Demand	Anodyne	ADRB3	91	46
C[C@@H](NC(C)(C)CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819015006	DF	On-Demand	Anodyne	KCNA5	22	40
C[C@H](NC(C)(C)CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819015007	DF	On-Demand	Anodyne	ADRB2	24	43
C[C@H](NC(C)(C)CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819015007	DF	On-Demand	Anodyne	ADRB1	24	46
C[C@H](NC(C)(C)CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819015007	DF	On-Demand	Anodyne	ADRB3	91	46
C[C@H](NC(C)(C)CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819015007	DF	On-Demand	Anodyne	KCNA5	22	40
C[C@@H](NC(C)(C)CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819015008	DF	On-Demand	Anodyne	ADRB2	24	43
C[C@@H](NC(C)(C)CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819015008	DF	On-Demand	Anodyne	ADRB1	24	46
C[C@@H](NC(C)(C)CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819015008	DF	On-Demand	Anodyne	ADRB3	91	46
C[C@@H](NC(C)(C)CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819015008	DF	On-Demand	Anodyne	KCNA5	22	40
C[C@H](NC(C)(C)CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819015009	DF	On-Demand	Anodyne	ADRB2	24	43
C[C@H](NC(C)(C)CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819015009	DF	On-Demand	Anodyne	ADRB1	24	46
C[C@H](NC(C)(C)CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819015009	DF	On-Demand	Anodyne	ADRB3	91	46
C[C@H](NC(C)(C)CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819015009	DF	On-Demand	Anodyne	KCNA5	22	40
Cc1ccc2c(c1C)OC[C@@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819015018	DH	On-Demand	Anodyne	ADRB3	40	42
Cc1ccc2c(c1C)OC[C@@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819015018	DH	On-Demand	Anodyne	CYP3A4	45	35
Cc1ccc2c(c1C)OC[C@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819015019	DH	On-Demand	Anodyne	ADRB3	40	42
Cc1ccc2c(c1C)OC[C@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819015019	DH	On-Demand	Anodyne	CYP3A4	45	35
Cc1ccc2c(c1C)OC[C@@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819015020	DH	On-Demand	Anodyne	ADRB3	40	42
Cc1ccc2c(c1C)OC[C@@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819015020	DH	On-Demand	Anodyne	CYP3A4	45	35
Cc1ccc2c(c1C)OC[C@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819015021	DH	On-Demand	Anodyne	ADRB3	40	42
Cc1ccc2c(c1C)OC[C@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819015021	DH	On-Demand	Anodyne	CYP3A4	45	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)c1ccc(Br)cc1)C2	ZINC000819015031	GG	On-Demand	Anodyne	PRCP	17	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)c1ccc(Br)cc1)C2	ZINC000819015032	GG	On-Demand	Anodyne	PRCP	17	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)c1ccc(Br)cc1)C2	ZINC000819015033	GG	On-Demand	Anodyne	PRCP	17	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)c1ccc(Br)cc1)C2	ZINC000819015034	GG	On-Demand	Anodyne	PRCP	17	43
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(Cl)cc1Cl	ZINC000819015043	EH	On-Demand	Reactive	P2RX7	15	41
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1ccc(Cl)cc1Cl	ZINC000819015044	EH	On-Demand	Reactive	P2RX7	15	41
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015073	GF	On-Demand	Anodyne	ADRB2	24	43
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015073	GF	On-Demand	Anodyne	DRD2	20	43
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015073	GF	On-Demand	Anodyne	DRD4	29	46
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015073	GF	On-Demand	Anodyne	ACHE	21	45
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015073	GF	On-Demand	Anodyne	HTR1D	18	41
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015073	GF	On-Demand	Anodyne	HTR1B	15	41
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015073	GF	On-Demand	Anodyne	DRD3	15	43
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015073	GF	On-Demand	Anodyne	SLC6A3	15	41
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015073	GF	On-Demand	Anodyne	KCNH2	15	43
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015073	GF	On-Demand	Anodyne	HTR4	20	44
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015073	GF	On-Demand	Anodyne	SIGMAR1	40	45
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015073	GF	On-Demand	Anodyne	BCHE	16	45
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015073	GF	On-Demand	Anodyne	CCR3	27	42
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015073	GF	On-Demand	Anodyne	ABCB1	42	37
O[C@H](CNC1CC(c2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015076	DH	On-Demand	Anodyne	SLC18A3	18	40
O[C@@H](CNC1CC(c2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015079	DH	On-Demand	Anodyne	SLC18A3	18	40
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015080	GF	On-Demand	Anodyne	ADRB2	24	43
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015080	GF	On-Demand	Anodyne	DRD2	20	43
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015080	GF	On-Demand	Anodyne	DRD4	29	46
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015080	GF	On-Demand	Anodyne	ACHE	21	45
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015080	GF	On-Demand	Anodyne	HTR1D	18	41
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015080	GF	On-Demand	Anodyne	HTR1B	15	41
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015080	GF	On-Demand	Anodyne	DRD3	15	43
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015080	GF	On-Demand	Anodyne	SLC6A3	15	41
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015080	GF	On-Demand	Anodyne	KCNH2	15	43
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015080	GF	On-Demand	Anodyne	HTR4	20	44
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015080	GF	On-Demand	Anodyne	SIGMAR1	40	45
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015080	GF	On-Demand	Anodyne	BCHE	16	45
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015080	GF	On-Demand	Anodyne	CCR3	27	42
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015080	GF	On-Demand	Anodyne	ABCB1	42	37
CC(=O)N(c1ccc(NC(=O)c2ccc(-n3c(C)cnc3O)cc2)cc1)C1CC1	ZINC000819015126	GH	On-Demand	Anodyne	PRNP	47	33
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819015145	GH	On-Demand	Anodyne	ADRB2	23	42
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819015145	GH	On-Demand	Anodyne	SLC6A3	33	50
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819015145	GH	On-Demand	Anodyne	SIGMAR1	32	51
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819015145	GH	On-Demand	Anodyne	PRCP	17	40
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819015146	GH	On-Demand	Anodyne	ADRB2	23	42
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819015146	GH	On-Demand	Anodyne	SLC6A3	33	50
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819015146	GH	On-Demand	Anodyne	SIGMAR1	32	51
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819015146	GH	On-Demand	Anodyne	PRCP	17	40
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819015148	GH	On-Demand	Anodyne	ADRB2	23	42
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819015148	GH	On-Demand	Anodyne	SLC6A3	33	50
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819015148	GH	On-Demand	Anodyne	SIGMAR1	32	51
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819015148	GH	On-Demand	Anodyne	PRCP	17	40
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819015151	GH	On-Demand	Anodyne	ADRB2	23	42
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819015151	GH	On-Demand	Anodyne	SLC6A3	33	50
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819015151	GH	On-Demand	Anodyne	SIGMAR1	32	51
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819015151	GH	On-Demand	Anodyne	PRCP	17	40
Cc1cc(F)ccc1[C@@H](O)CNCCc1c[nH]c2cccc(C)c12	ZINC000819015154	EH	On-Demand	Anodyne	ADRB2	19	40
Cc1cc(F)ccc1[C@@H](O)CNCCc1c[nH]c2cccc(C)c12	ZINC000819015154	EH	On-Demand	Anodyne	ADRB1	15	40
Cc1cc(F)ccc1[C@@H](O)CNCCc1c[nH]c2cccc(C)c12	ZINC000819015154	EH	On-Demand	Anodyne	MPO	65	43
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)cc1)C1CC1	ZINC000819015171	HG	On-Demand	Anodyne	ELANE	46	39
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)cc1)C1CC1	ZINC000819015171	HG	On-Demand	Anodyne	LGMN	92	38
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)cc1)C1CC1	ZINC000819015174	HG	On-Demand	Anodyne	ELANE	46	39
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)cc1)C1CC1	ZINC000819015174	HG	On-Demand	Anodyne	LGMN	92	38
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015175	FG	On-Demand	Anodyne	HTR2A	15	50
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015175	FG	On-Demand	Anodyne	SLC6A3	25	50
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015175	FG	On-Demand	Anodyne	HTR4	15	42
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015175	FG	On-Demand	Anodyne	SIGMAR1	37	53
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015175	FG	On-Demand	Anodyne	CCR3	47	44
CC(=O)N(c1ccc(NC(=O)C[C@H](C)C2CCN(C(=O)OC(C)(C)C)CC2)cc1)C1CC1	ZINC000819015177	IJ	On-Demand	Anodyne	GPR119	37	46
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015178	FG	On-Demand	Anodyne	HTR2A	15	50
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015178	FG	On-Demand	Anodyne	SLC6A3	25	50
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015178	FG	On-Demand	Anodyne	HTR4	15	42
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015178	FG	On-Demand	Anodyne	SIGMAR1	37	53
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015178	FG	On-Demand	Anodyne	CCR3	47	44
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015180	FG	On-Demand	Anodyne	HTR2A	15	50
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015180	FG	On-Demand	Anodyne	SLC6A3	25	50
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015180	FG	On-Demand	Anodyne	HTR4	15	42
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015180	FG	On-Demand	Anodyne	SIGMAR1	37	53
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015180	FG	On-Demand	Anodyne	CCR3	47	44
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015182	FG	On-Demand	Anodyne	HTR2A	15	50
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015182	FG	On-Demand	Anodyne	SLC6A3	25	50
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015182	FG	On-Demand	Anodyne	HTR4	15	42
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015182	FG	On-Demand	Anodyne	SIGMAR1	37	53
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cc(F)ccc1F	ZINC000819015182	FG	On-Demand	Anodyne	CCR3	47	44
CC(=O)N(c1ccc(NC(=O)C[C@@H](C)C2CCN(C(=O)OC(C)(C)C)CC2)cc1)C1CC1	ZINC000819015183	IJ	On-Demand	Anodyne	GPR119	37	46
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccc3c(c2)OCO3)cc1)C1CC1	ZINC000819015187	FH	On-Demand	Anodyne	DYRK2	64	35
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccc3c(c2)OCO3)cc1)C1CC1	ZINC000819015190	FH	On-Demand	Anodyne	DYRK2	64	35
CC(=O)N(c1ccc(NC(=O)c2cccc(C)c2NC(=O)c2ccncc2)cc1)C1CC1	ZINC000819015194	II	On-Demand	Anodyne	SHH	44	40
CC(=O)N(c1ccc(NC(=O)c2cccc(C)c2NC(=O)c2ccncc2)cc1)C1CC1	ZINC000819015194	II	On-Demand	Anodyne	KCNK3	64	41
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819015196	GH	On-Demand	Anodyne	ADRB2	16	40
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819015196	GH	On-Demand	Anodyne	SLC6A3	19	44
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819015196	GH	On-Demand	Anodyne	SIGMAR1	20	48
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819015196	GH	On-Demand	Anodyne	CCR2	41	40
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819015197	GH	On-Demand	Anodyne	ADRB2	16	40
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819015197	GH	On-Demand	Anodyne	SLC6A3	19	44
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819015197	GH	On-Demand	Anodyne	SIGMAR1	20	48
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819015197	GH	On-Demand	Anodyne	CCR2	41	40
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819015198	GH	On-Demand	Anodyne	ADRB2	16	40
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819015198	GH	On-Demand	Anodyne	SLC6A3	19	44
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819015198	GH	On-Demand	Anodyne	SIGMAR1	20	48
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819015198	GH	On-Demand	Anodyne	CCR2	41	40
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819015199	GH	On-Demand	Anodyne	ADRB2	16	40
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819015199	GH	On-Demand	Anodyne	SLC6A3	19	44
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819015199	GH	On-Demand	Anodyne	SIGMAR1	20	48
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819015199	GH	On-Demand	Anodyne	CCR2	41	40
CC(=O)N(c1ccc(NC(=O)c2ccnc(Cl)c2F)cc1)C1CC1	ZINC000819015200	EH	On-Demand	Anodyne	TYK2	53	35
CC(=O)N(c1ccc(NC(=O)c2ccnc(Cl)c2F)cc1)C1CC1	ZINC000819015200	EH	On-Demand	Anodyne	G2YM83_BOTF4	45	32
O[C@H](CN[C@H]1CCN(c2ccc(Br)cc2)C1)c1cccnc1	ZINC000819015201	FF	On-Demand	Anodyne	ADRB3	60	57
O[C@H](CN[C@@H]1CCN(c2ccc(Br)cc2)C1)c1cccnc1	ZINC000819015202	FF	On-Demand	Anodyne	ADRB3	60	57
O[C@@H](CN[C@H]1CCN(c2ccc(Br)cc2)C1)c1cccnc1	ZINC000819015203	FF	On-Demand	Anodyne	ADRB3	60	57
O[C@@H](CN[C@@H]1CCN(c2ccc(Br)cc2)C1)c1cccnc1	ZINC000819015204	FF	On-Demand	Anodyne	ADRB3	60	57
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819015210	FG	On-Demand	Anodyne	HTR1D	17	40
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819015210	FG	On-Demand	Anodyne	HTR4	16	43
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819015210	FG	On-Demand	Anodyne	SIGMAR1	31	52
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819015210	FG	On-Demand	Anodyne	CCR3	52	39
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819015214	FG	On-Demand	Anodyne	HTR1D	17	40
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819015214	FG	On-Demand	Anodyne	HTR4	16	43
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819015214	FG	On-Demand	Anodyne	SIGMAR1	31	52
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819015214	FG	On-Demand	Anodyne	CCR3	52	39
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819015233	FH	On-Demand	Anodyne	DRD4	24	44
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819015233	FH	On-Demand	Anodyne	ACHE	19	40
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819015233	FH	On-Demand	Anodyne	SLC6A4	16	53
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819015233	FH	On-Demand	Anodyne	SLC6A3	36	53
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819015233	FH	On-Demand	Anodyne	GRIN2B	20	43
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819015233	FH	On-Demand	Anodyne	SIGMAR1	45	54
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819015233	FH	On-Demand	Anodyne	PRCP	18	41
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819015233	FH	On-Demand	Anodyne	GRIN2C	15	43
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819015234	HI	On-Demand	Anodyne	PAPA1_CARPA	36	40
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819015234	HI	On-Demand	Anodyne	CTSK	28	45
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819015234	HI	On-Demand	Anodyne	TIMP3	47	34
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819015234	HI	On-Demand	Anodyne	REN	47	45
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819015234	HI	On-Demand	Anodyne	CAPN1	34	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819015234	HI	On-Demand	Anodyne	POLG_HCV1	23	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819015234	HI	On-Demand	Anodyne	FPR1	58	44
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819015235	FH	On-Demand	Anodyne	DRD4	24	44
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819015235	FH	On-Demand	Anodyne	ACHE	19	40
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819015235	FH	On-Demand	Anodyne	SLC6A4	16	53
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819015235	FH	On-Demand	Anodyne	SLC6A3	36	53
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819015235	FH	On-Demand	Anodyne	GRIN2B	20	43
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819015235	FH	On-Demand	Anodyne	SIGMAR1	45	54
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819015235	FH	On-Demand	Anodyne	PRCP	18	41
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819015235	FH	On-Demand	Anodyne	GRIN2C	15	43
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	F2	55	49
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	ACE	35	45
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	FKBP1A	55	43
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	OPRM1	36	42
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	OPRD1	23	41
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	CELA1	27	50
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	ELANE	45	45
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	TACR1	15	40
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	CTRA_BOVIN	62	34
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	TRY1_BOVIN	68	36
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	CTSG	43	34
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	PREP	70	50
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	CELA2A	51	34
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	LGMN	102	51
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	CFTR	59	38
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	ACE2	22	40
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	KLK5	26	45
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	XIAP	45	41
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	F13A1	42	38
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	BRCA1	60	33
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	SLC12A5	76	39
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015251	HH	On-Demand	Anodyne	TMPRSS11D	61	36
COc1cccc(C2=NO[C@H](C(=O)Nc3ccc(N(C(C)=O)C4CC4)cc3)C2)c1	ZINC000819015261	GG	On-Demand	Anodyne	MTNR1B	19	45
COc1cccc(C2=NO[C@H](C(=O)Nc3ccc(N(C(C)=O)C4CC4)cc3)C2)c1	ZINC000819015261	GG	On-Demand	Anodyne	ROCK2	16	40
COc1cccc(C2=NO[C@H](C(=O)Nc3ccc(N(C(C)=O)C4CC4)cc3)C2)c1	ZINC000819015261	GG	On-Demand	Anodyne	LUCI_PHOPY	16	41
COc1cccc(C2=NO[C@@H](C(=O)Nc3ccc(N(C(C)=O)C4CC4)cc3)C2)c1	ZINC000819015263	GG	On-Demand	Anodyne	MTNR1B	19	45
COc1cccc(C2=NO[C@@H](C(=O)Nc3ccc(N(C(C)=O)C4CC4)cc3)C2)c1	ZINC000819015263	GG	On-Demand	Anodyne	ROCK2	16	40
COc1cccc(C2=NO[C@@H](C(=O)Nc3ccc(N(C(C)=O)C4CC4)cc3)C2)c1	ZINC000819015263	GG	On-Demand	Anodyne	LUCI_PHOPY	16	41
CC(=O)N(c1ccc(NC(=O)c2ccc(C)nc2Cl)cc1)C1CC1	ZINC000819015267	EH	On-Demand	Anodyne	NR2E3	44	32
CC(=O)N(c1ccc(NC(=O)c2cccc(-c3cnn(C)c3)c2)cc1)C1CC1	ZINC000819015282	FH	On-Demand	Anodyne	PRNP	44	33
CC(=O)N(c1ccc(NC(=O)c2cccc(-c3cnn(C)c3)c2)cc1)C1CC1	ZINC000819015282	FH	On-Demand	Anodyne	KCNK3	47	34
CC(=O)N(c1ccc(NC(=O)c2cccnc2F)cc1)C1CC1	ZINC000819015286	DF	On-Demand	Anodyne	G2YM83_BOTF4	47	34
CCc1ccc(C(=O)Nc2sccc2C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)cc1	ZINC000819015289	IK	On-Demand	Anodyne	GIPR	49	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)c1ccc(Cl)cc1)C2	ZINC000819015309	FG	On-Demand	Anodyne	PRCP	20	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)c1ccc(Cl)cc1)C2	ZINC000819015310	FG	On-Demand	Anodyne	PRCP	20	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)c1ccc(Cl)cc1)C2	ZINC000819015311	FG	On-Demand	Anodyne	PRCP	20	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)c1ccc(Cl)cc1)C2	ZINC000819015312	FG	On-Demand	Anodyne	PRCP	20	43
COc1ccc(OC)c([C@H](O)CNCCc2ccc(OC)c(F)c2)c1	ZINC000819015316	EF	On-Demand	Anodyne	ADRB2	65	56
COc1ccc(OC)c([C@H](O)CNCCc2ccc(OC)c(F)c2)c1	ZINC000819015316	EF	On-Demand	Anodyne	ADRB1	75	46
COc1ccc(OC)c([C@H](O)CNCCc2ccc(OC)c(F)c2)c1	ZINC000819015316	EF	On-Demand	Anodyne	ADRB3	58	45
O[C@H](CNC1CC(c2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819015325	DI	On-Demand	Anodyne	SLC18A3	19	41
O[C@@H](CNC1CC(c2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819015326	DI	On-Demand	Anodyne	SLC18A3	19	41
O=C1OCCN1CCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819015327	FF	On-Demand	Anodyne	ADRB2	62	44
O=C1OCCN1CCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819015327	FF	On-Demand	Anodyne	ADRB1	90	44
O=C1OCCN1CCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819015327	FF	On-Demand	Anodyne	ADRB3	72	44
O=C1OCCN1CCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819015328	FF	On-Demand	Anodyne	ADRB2	62	44
O=C1OCCN1CCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819015328	FF	On-Demand	Anodyne	ADRB1	90	44
O=C1OCCN1CCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819015328	FF	On-Demand	Anodyne	ADRB3	72	44
O[C@H](CNC1CC(c2ccccc2)C1)c1ccc(F)cc1F	ZINC000819015331	DH	On-Demand	Anodyne	SLC18A3	18	40
O[C@@H](CNC1CC(c2ccccc2)C1)c1ccc(F)cc1F	ZINC000819015332	DH	On-Demand	Anodyne	SLC18A3	18	40
CC(=O)N(c1ccc(NC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)cc1)C1CC1	ZINC000819015347	IG	On-Demand	Anodyne	CCR8	43	31
CC(=O)N(c1ccc(NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015348	IF	On-Demand	Anodyne	CFTR	48	36
CC(=O)N(c1ccc(NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015348	IF	On-Demand	Anodyne	SLC12A5	54	33
CC(=O)N(c1ccc(NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015348	IF	On-Demand	Anodyne	Q9NAW4_PLAFA	43	52
CC(=O)N(c1ccc(NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819015348	IF	On-Demand	Anodyne	VHL	41	32
CC(=O)N(c1ccc(NC(=O)c2ccc(-n3ccnc3S)cc2)cc1)C1CC1	ZINC000819015349	GH	On-Demand	Anodyne	PRNP	54	37
CC(=O)N(c1ccc(NC(=O)/C(=C/c2cccnc2)NC(=O)c2ccccc2)cc1)C1CC1	ZINC000819015351	II	On-Demand	Anodyne	NAMPT	19	41
CC(=O)N(c1ccc(NC(=O)/C(=C\c2cccnc2)NC(=O)c2ccccc2)cc1)C1CC1	ZINC000819015353	II	On-Demand	Anodyne	NAMPT	19	41
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015354	FG	On-Demand	Mild	PAPA1_CARPA	75	57
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015354	FG	On-Demand	Mild	CCKAR	47	37
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015354	FG	On-Demand	Mild	CTSK	61	54
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015354	FG	On-Demand	Mild	CTSL	46	57
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015354	FG	On-Demand	Mild	TACR3	18	41
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015354	FG	On-Demand	Mild	REN	46	39
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015354	FG	On-Demand	Mild	CTSS	40	57
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015354	FG	On-Demand	Mild	CAPN1	23	46
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015354	FG	On-Demand	Mild	CAPN2	42	39
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015354	FG	On-Demand	Mild	FPR1	53	45
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015354	FG	On-Demand	Mild	CTRB_BOVIN	45	37
CC(=O)N(c1ccc(NC(=O)c2c(-c3ccc(F)cc3)noc2C)cc1)C1CC1	ZINC000819015355	GJ	On-Demand	Anodyne	GPBAR1	19	48
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015361	FG	On-Demand	Mild	PAPA1_CARPA	75	57
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015361	FG	On-Demand	Mild	CCKAR	47	37
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015361	FG	On-Demand	Mild	CTSK	61	54
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015361	FG	On-Demand	Mild	CTSL	46	57
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015361	FG	On-Demand	Mild	TACR3	18	41
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015361	FG	On-Demand	Mild	REN	46	39
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015361	FG	On-Demand	Mild	CTSS	40	57
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015361	FG	On-Demand	Mild	CAPN1	23	46
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015361	FG	On-Demand	Mild	CAPN2	42	39
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015361	FG	On-Demand	Mild	FPR1	53	45
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819015361	FG	On-Demand	Mild	CTRB_BOVIN	45	37
CC(=O)N(c1ccc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cc1)C1CC1	ZINC000819015365	FI	On-Demand	Bother	TAAR1	26	42
CC(C)(C)OC(=O)NCCCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819015373	FG	On-Demand	Anodyne	ADRB2	23	41
CC(C)(C)OC(=O)NCCCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819015373	FG	On-Demand	Anodyne	ADRB1	31	41
CC(C)(C)OC(=O)NCCCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819015373	FG	On-Demand	Anodyne	ADRB3	28	41
CC(C)(C)OC(=O)NCCCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819015373	FG	On-Demand	Anodyne	CASR	43	38
CC(C)(C)OC(=O)NCCCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819015373	FG	On-Demand	Anodyne	PAPA1_CARPA	30	53
CC(C)(C)OC(=O)NCCCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819015373	FG	On-Demand	Anodyne	REN	15	40
CC(C)(C)OC(=O)NCCCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819015375	FG	On-Demand	Anodyne	ADRB2	23	41
CC(C)(C)OC(=O)NCCCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819015375	FG	On-Demand	Anodyne	ADRB1	31	41
CC(C)(C)OC(=O)NCCCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819015375	FG	On-Demand	Anodyne	ADRB3	28	41
CC(C)(C)OC(=O)NCCCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819015375	FG	On-Demand	Anodyne	CASR	43	38
CC(C)(C)OC(=O)NCCCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819015375	FG	On-Demand	Anodyne	PAPA1_CARPA	30	53
CC(C)(C)OC(=O)NCCCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819015375	FG	On-Demand	Anodyne	REN	15	40
CC(C)(C)OC(=O)NCCCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819015377	FD	On-Demand	Anodyne	ADRB2	25	44
CC(C)(C)OC(=O)NCCCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819015377	FD	On-Demand	Anodyne	ADRB3	41	37
CC(C)(C)OC(=O)NCCCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819015379	FD	On-Demand	Anodyne	ADRB2	25	44
CC(C)(C)OC(=O)NCCCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819015379	FD	On-Demand	Anodyne	ADRB3	41	37
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cn1	ZINC000819015380	EE	On-Demand	Anodyne	SLC6A3	18	49
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cn1	ZINC000819015380	EE	On-Demand	Anodyne	HTR4	15	41
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cn1	ZINC000819015380	EE	On-Demand	Anodyne	SIGMAR1	26	52
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cn1	ZINC000819015380	EE	On-Demand	Anodyne	CCR3	23	41
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cn1	ZINC000819015381	EE	On-Demand	Anodyne	SLC6A3	18	49
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cn1	ZINC000819015381	EE	On-Demand	Anodyne	HTR4	15	41
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cn1	ZINC000819015381	EE	On-Demand	Anodyne	SIGMAR1	26	52
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cn1	ZINC000819015381	EE	On-Demand	Anodyne	CCR3	23	41
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cn1	ZINC000819015383	EE	On-Demand	Anodyne	SLC6A3	18	49
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cn1	ZINC000819015383	EE	On-Demand	Anodyne	HTR4	15	41
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cn1	ZINC000819015383	EE	On-Demand	Anodyne	SIGMAR1	26	52
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cn1	ZINC000819015383	EE	On-Demand	Anodyne	CCR3	23	41
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cn1	ZINC000819015384	EE	On-Demand	Anodyne	SLC6A3	18	49
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cn1	ZINC000819015384	EE	On-Demand	Anodyne	HTR4	15	41
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cn1	ZINC000819015384	EE	On-Demand	Anodyne	SIGMAR1	26	52
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cn1	ZINC000819015384	EE	On-Demand	Anodyne	CCR3	23	41
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccs1	ZINC000819015390	CF	On-Demand	Anodyne	UL26	54	34
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccs1	ZINC000819015390	CF	On-Demand	Anodyne	SCAF_EBVB9	54	34
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccs1	ZINC000819015392	CF	On-Demand	Anodyne	UL26	54	34
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccs1	ZINC000819015392	CF	On-Demand	Anodyne	SCAF_EBVB9	54	34
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccs1	ZINC000819015393	CF	On-Demand	Anodyne	UL26	54	34
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccs1	ZINC000819015393	CF	On-Demand	Anodyne	SCAF_EBVB9	54	34
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccs1	ZINC000819015395	CF	On-Demand	Anodyne	UL26	54	34
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccs1	ZINC000819015395	CF	On-Demand	Anodyne	SCAF_EBVB9	54	34
CC(=O)N(c1ccc(NC(=O)COc2ccc3c(C)cc(=O)oc3c2)cc1)C1CC1	ZINC000819015398	HH	On-Demand	Anodyne	MAOA	66	57
CC(=O)N(c1ccc(NC(=O)COc2ccc3c(C)cc(=O)oc3c2)cc1)C1CC1	ZINC000819015398	HH	On-Demand	Anodyne	MAOB	40	57
CC(=O)N(c1ccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)cc1)C1CC1	ZINC000819015400	HK	On-Demand	Anodyne	TACR3	32	46
CC(=O)N(c1ccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)cc1)C1CC1	ZINC000819015400	HK	On-Demand	Anodyne	NR2E3	59	33
O[C@@H](CN[C@@H]1CCN(c2ccc(Br)cc2)C1)c1cccc(F)c1	ZINC000819015404	GG	On-Demand	Anodyne	ADRB3	20	44
O[C@H](CN[C@H]1CCN(c2ccc(Br)cc2)C1)c1cccc(F)c1	ZINC000819015405	GG	On-Demand	Anodyne	ADRB3	20	44
O[C@H](CN[C@@H]1CCN(c2ccc(Br)cc2)C1)c1cccc(F)c1	ZINC000819015406	GG	On-Demand	Anodyne	ADRB3	20	44
O[C@@H](CN[C@H]1CCN(c2ccc(Br)cc2)C1)c1cccc(F)c1	ZINC000819015407	GG	On-Demand	Anodyne	ADRB3	20	44
CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)C1	ZINC000819015412	IG	On-Demand	Anodyne	CFTR	56	39
CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)C1	ZINC000819015414	IG	On-Demand	Anodyne	CFTR	56	39
CC(=O)N(c1ccc(NC(=O)c2cc(OCc3ccccc3)ccn2)cc1)C1CC1	ZINC000819015416	HI	On-Demand	Anodyne	TSHR	45	34
CC(=O)N(c1ccc(NC(=O)c2cc(OCc3ccccc3)ccn2)cc1)C1CC1	ZINC000819015416	HI	On-Demand	Anodyne	ADAM17	16	40
CC(=O)N(c1ccc(NC(=O)c2cc(OCc3ccccc3)ccn2)cc1)C1CC1	ZINC000819015416	HI	On-Demand	Anodyne	RAF1	55	40
CC(=O)N(c1ccc(NC(=O)c2cc(OCc3ccccc3)ccn2)cc1)C1CC1	ZINC000819015416	HI	On-Demand	Anodyne	GRM4	47	35
CC(=O)N(c1ccc(NC(=O)c2ccc(SC(F)(F)F)cc2)cc1)C1CC1	ZINC000819015426	GK	On-Demand	Anodyne	GIPR	46	42
NC(=O)c1ccc(CNC(=O)C(F)=C2CCC2)cc1	ZINC000819015427	CD	On-Demand	Anodyne	PROC	43	32
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)n(C)c1	ZINC000819015428	IF	On-Demand	Anodyne	HRAS	47	32
CC(=O)N(c1ccc(NC(=O)CCC2CCN(C(=O)OC(C)(C)C)CC2)cc1)C1CC1	ZINC000819015430	IJ	On-Demand	Anodyne	F13A1	17	40
CC(=O)N(c1ccc(NC(=O)CCC2CCN(C(=O)OC(C)(C)C)CC2)cc1)C1CC1	ZINC000819015430	IJ	On-Demand	Anodyne	GPR119	43	48
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015436	DF	On-Demand	Anodyne	ADRB2	24	43
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015436	DF	On-Demand	Anodyne	DRD4	18	41
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015436	DF	On-Demand	Anodyne	ACHE	22	45
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015436	DF	On-Demand	Anodyne	HTR1D	16	43
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015436	DF	On-Demand	Anodyne	OPRM1	16	40
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015436	DF	On-Demand	Anodyne	SLC6A3	37	51
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015436	DF	On-Demand	Anodyne	HTR4	18	45
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015436	DF	On-Demand	Anodyne	GRIN2B	29	44
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015436	DF	On-Demand	Anodyne	SIGMAR1	48	56
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015437	DF	On-Demand	Anodyne	ADRB2	24	43
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015437	DF	On-Demand	Anodyne	DRD4	18	41
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015437	DF	On-Demand	Anodyne	ACHE	22	45
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015437	DF	On-Demand	Anodyne	HTR1D	16	43
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015437	DF	On-Demand	Anodyne	OPRM1	16	40
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015437	DF	On-Demand	Anodyne	SLC6A3	37	51
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015437	DF	On-Demand	Anodyne	HTR4	18	45
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015437	DF	On-Demand	Anodyne	GRIN2B	29	44
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015437	DF	On-Demand	Anodyne	SIGMAR1	48	56
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015438	DF	On-Demand	Anodyne	ADRB2	24	43
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015438	DF	On-Demand	Anodyne	DRD4	18	41
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015438	DF	On-Demand	Anodyne	ACHE	22	45
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015438	DF	On-Demand	Anodyne	HTR1D	16	43
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015438	DF	On-Demand	Anodyne	OPRM1	16	40
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015438	DF	On-Demand	Anodyne	SLC6A3	37	51
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015438	DF	On-Demand	Anodyne	HTR4	18	45
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015438	DF	On-Demand	Anodyne	GRIN2B	29	44
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015438	DF	On-Demand	Anodyne	SIGMAR1	48	56
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015439	DF	On-Demand	Anodyne	ADRB2	24	43
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015439	DF	On-Demand	Anodyne	DRD4	18	41
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015439	DF	On-Demand	Anodyne	ACHE	22	45
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015439	DF	On-Demand	Anodyne	HTR1D	16	43
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015439	DF	On-Demand	Anodyne	OPRM1	16	40
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015439	DF	On-Demand	Anodyne	SLC6A3	37	51
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015439	DF	On-Demand	Anodyne	HTR4	18	45
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015439	DF	On-Demand	Anodyne	GRIN2B	29	44
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1	ZINC000819015439	DF	On-Demand	Anodyne	SIGMAR1	48	56
CC(=O)CCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819015440	EI	On-Demand	Anodyne	HDAC10	29	45
CC(=O)CCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819015440	EI	On-Demand	Anodyne	HDAC1	15	45
CC(=O)CCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819015440	EI	On-Demand	Anodyne	HDAC2	21	45
CC(=O)CCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819015440	EI	On-Demand	Anodyne	HDAC3	23	43
CC(=O)CCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819015440	EI	On-Demand	Anodyne	HDAC6	21	40
CC(=O)CCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819015440	EI	On-Demand	Anodyne	HDAC11	17	45
CC(=O)CCCCCCC(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819015440	EI	On-Demand	Anodyne	ENPP2	28	40
CCCc1ccc(NC(=O)C[C@@H](C)n2cccn2)cc1	ZINC000819015441	CG	On-Demand	Anodyne	ADRB3	18	44
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccccc2F)cc1)C1CC1	ZINC000819015442	EH	On-Demand	Anodyne	KCNQ2	40	37
CCCc1ccc(NC(=O)C[C@H](C)n2cccn2)cc1	ZINC000819015443	CG	On-Demand	Anodyne	ADRB3	18	44
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccccc2F)cc1)C1CC1	ZINC000819015448	EH	On-Demand	Anodyne	KCNQ2	40	37
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3cccc(C)c23)c1	ZINC000819015453	FG	On-Demand	Anodyne	ADRB2	19	45
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3cccc(C)c23)c1	ZINC000819015453	FG	On-Demand	Anodyne	ADRB3	21	45
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3cccc(C)c23)c1	ZINC000819015453	FG	On-Demand	Anodyne	MTNR1A	15	41
CCCc1ccc(S(=O)(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1	ZINC000819015455	GE	On-Demand	Anodyne	TGM2	71	37
CCCc1ccc(S(=O)(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1	ZINC000819015455	GE	On-Demand	Anodyne	F13A1	64	37
CCCc1ccc(S(=O)(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1	ZINC000819015457	GE	On-Demand	Anodyne	TGM2	71	37
CCCc1ccc(S(=O)(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1	ZINC000819015457	GE	On-Demand	Anodyne	F13A1	64	37
CCCc1ccc(S(=O)(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1	ZINC000819015459	GE	On-Demand	Anodyne	TGM2	71	37
CCCc1ccc(S(=O)(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1	ZINC000819015459	GE	On-Demand	Anodyne	F13A1	64	37
CCCc1ccc(S(=O)(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1	ZINC000819015461	GE	On-Demand	Anodyne	TGM2	71	37
CCCc1ccc(S(=O)(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1	ZINC000819015461	GE	On-Demand	Anodyne	F13A1	64	37
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1)C1CC1	ZINC000819015475	II	On-Demand	Anodyne	GRIN2B	25	46
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1)C1CC1	ZINC000819015475	II	On-Demand	Anodyne	LTA4H	18	41
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1)C1CC1	ZINC000819015475	II	On-Demand	Anodyne	PREP	25	40
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1)C1CC1	ZINC000819015475	II	On-Demand	Anodyne	TGM2	42	46
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1)C1CC1	ZINC000819015475	II	On-Demand	Anodyne	F13A1	62	46
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1)C1CC1	ZINC000819015475	II	On-Demand	Anodyne	SLC12A5	62	36
CCCc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1	ZINC000819015476	CG	On-Demand	Anodyne	SPHK1	17	41
CCCc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1	ZINC000819015478	CG	On-Demand	Anodyne	SPHK1	17	41
CCCc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1	ZINC000819015479	CG	On-Demand	Anodyne	SPHK1	17	41
CCCc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1	ZINC000819015481	CG	On-Demand	Anodyne	SPHK1	17	41
CC(=O)N(c1ccc(NC(=O)c2cc(F)cc3nc(S)[nH]c23)cc1)C1CC1	ZINC000819015496	GH	On-Demand	Anodyne	NR2E3	52	32
CC(=O)N(c1ccc(NC(=O)c2cccc(C3OCCO3)c2)cc1)C1CC1	ZINC000819015500	FG	On-Demand	Anodyne	KCNK3	71	36
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000819015512	II	On-Demand	Bother	COLA	46	34
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000819015512	II	On-Demand	Bother	ROCK1	20	43
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000819015512	II	On-Demand	Bother	SLC12A5	16	42
CN(C)CCCOc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819015529	EF	On-Demand	Anodyne	ADRB2	34	41
CN(C)CCCOc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819015529	EF	On-Demand	Anodyne	ADRB1	47	44
CN(C)CCCOc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819015529	EF	On-Demand	Anodyne	ADRB3	48	46
CN(C)CCCOc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819015529	EF	On-Demand	Anodyne	LTA4H	37	48
CN(C)CCCOc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819015529	EF	On-Demand	Anodyne	ESRRG	50	36
CN(C)CCCOc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819015530	EF	On-Demand	Anodyne	ADRB2	34	41
CN(C)CCCOc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819015530	EF	On-Demand	Anodyne	ADRB1	47	44
CN(C)CCCOc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819015530	EF	On-Demand	Anodyne	ADRB3	48	46
CN(C)CCCOc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819015530	EF	On-Demand	Anodyne	LTA4H	37	48
CN(C)CCCOc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819015530	EF	On-Demand	Anodyne	ESRRG	50	36
Cc1ccccc1[C@@H](O)CNCCc1c[nH]c2cccc(C)c12	ZINC000819015535	DH	On-Demand	Anodyne	ADRB2	28	40
CC(C)(C)OC(=O)NCCCNC[C@H](O)c1ccc(Br)cc1	ZINC000819015537	FF	On-Demand	Anodyne	PAPA1_CARPA	23	41
CC(C)(C)OC(=O)NCCCNC[C@@H](O)c1ccc(Br)cc1	ZINC000819015538	FF	On-Demand	Anodyne	PAPA1_CARPA	23	41
CCOC(=O)N1CCC(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819015546	GE	On-Demand	Mild	PAPA1_CARPA	36	47
CCOC(=O)N1CCC(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819015546	GE	On-Demand	Mild	CTSK	16	46
CCOC(=O)N1CCC(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819015547	GE	On-Demand	Mild	PAPA1_CARPA	36	47
CCOC(=O)N1CCC(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819015547	GE	On-Demand	Mild	CTSK	16	46
CN(C)CCCOc1ccc(CNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819015558	FH	On-Demand	Anodyne	ESRRG	41	30
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1F	ZINC000819015561	EG	On-Demand	Anodyne	SLC6A3	20	48
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1F	ZINC000819015561	EG	On-Demand	Anodyne	HTR4	19	45
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1F	ZINC000819015561	EG	On-Demand	Anodyne	SIGMAR1	39	52
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1F	ZINC000819015562	EG	On-Demand	Anodyne	SLC6A3	20	48
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1F	ZINC000819015562	EG	On-Demand	Anodyne	HTR4	19	45
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1F	ZINC000819015562	EG	On-Demand	Anodyne	SIGMAR1	39	52
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1F	ZINC000819015563	EG	On-Demand	Anodyne	SLC6A3	20	48
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1F	ZINC000819015563	EG	On-Demand	Anodyne	HTR4	19	45
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1F	ZINC000819015563	EG	On-Demand	Anodyne	SIGMAR1	39	52
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1F	ZINC000819015564	EG	On-Demand	Anodyne	SLC6A3	20	48
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1F	ZINC000819015564	EG	On-Demand	Anodyne	HTR4	19	45
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1F	ZINC000819015564	EG	On-Demand	Anodyne	SIGMAR1	39	52
CCOC(=O)N1CCC(NC(=O)c2c(C)ccc(Br)c2OC)CC1	ZINC000819015565	GG	On-Demand	Anodyne	DRD2	31	41
CCOC(=O)N1CCC(NC(=O)c2c(C)ccc(Br)c2OC)CC1	ZINC000819015565	GG	On-Demand	Anodyne	DRD3	15	42
CCOC(=O)N1CCC(NC(=O)c2c(C)ccc(Br)c2OC)CC1	ZINC000819015565	GG	On-Demand	Anodyne	CCR8	44	46
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015571	EG	On-Demand	Anodyne	ADRB2	25	42
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015571	EG	On-Demand	Anodyne	ADRB1	25	41
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015571	EG	On-Demand	Anodyne	SLC6A2	17	51
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015571	EG	On-Demand	Anodyne	HTR1D	15	41
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015571	EG	On-Demand	Anodyne	SLC6A4	17	51
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015571	EG	On-Demand	Anodyne	SLC6A3	32	51
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015571	EG	On-Demand	Anodyne	ADRB3	35	41
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015571	EG	On-Demand	Anodyne	SIGMAR1	34	53
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015571	EG	On-Demand	Anodyne	CCR3	41	38
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015572	EG	On-Demand	Anodyne	ADRB2	25	42
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015572	EG	On-Demand	Anodyne	ADRB1	25	41
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015572	EG	On-Demand	Anodyne	SLC6A2	17	51
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015572	EG	On-Demand	Anodyne	HTR1D	15	41
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015572	EG	On-Demand	Anodyne	SLC6A4	17	51
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015572	EG	On-Demand	Anodyne	SLC6A3	32	51
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015572	EG	On-Demand	Anodyne	ADRB3	35	41
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015572	EG	On-Demand	Anodyne	SIGMAR1	34	53
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015572	EG	On-Demand	Anodyne	CCR3	41	38
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015573	EG	On-Demand	Anodyne	ADRB2	25	42
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015573	EG	On-Demand	Anodyne	ADRB1	25	41
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015573	EG	On-Demand	Anodyne	SLC6A2	17	51
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015573	EG	On-Demand	Anodyne	HTR1D	15	41
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015573	EG	On-Demand	Anodyne	SLC6A4	17	51
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015573	EG	On-Demand	Anodyne	SLC6A3	32	51
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015573	EG	On-Demand	Anodyne	ADRB3	35	41
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015573	EG	On-Demand	Anodyne	SIGMAR1	34	53
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015573	EG	On-Demand	Anodyne	CCR3	41	38
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015574	EG	On-Demand	Anodyne	ADRB2	25	42
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015574	EG	On-Demand	Anodyne	ADRB1	25	41
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015574	EG	On-Demand	Anodyne	SLC6A2	17	51
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015574	EG	On-Demand	Anodyne	HTR1D	15	41
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015574	EG	On-Demand	Anodyne	SLC6A4	17	51
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015574	EG	On-Demand	Anodyne	SLC6A3	32	51
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015574	EG	On-Demand	Anodyne	ADRB3	35	41
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015574	EG	On-Demand	Anodyne	SIGMAR1	34	53
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccc(F)c1	ZINC000819015574	EG	On-Demand	Anodyne	CCR3	41	38
C[C@@H]1CCCCN1C(=O)COC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819015594	FF	On-Demand	Bother	CPT1A	71	39
C[C@@H]1CCCCN1C(=O)COC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819015594	FF	On-Demand	Bother	CPT2	40	32
C[C@H]1CCCCN1C(=O)COC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819015595	FF	On-Demand	Bother	CPT1A	71	39
C[C@H]1CCCCN1C(=O)COC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819015595	FF	On-Demand	Bother	CPT2	40	32
CCCc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819015597	FI	On-Demand	Mild	PAPA1_CARPA	53	51
CCCc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819015597	FI	On-Demand	Mild	CTSK	28	43
CCCc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819015597	FI	On-Demand	Mild	HDAC8	15	44
CCCc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819015597	FI	On-Demand	Mild	MMP2	15	41
CCCc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819015597	FI	On-Demand	Mild	MMP3	34	41
CCCc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819015597	FI	On-Demand	Mild	FPR1	44	39
CCCc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819015598	FI	On-Demand	Mild	PAPA1_CARPA	53	51
CCCc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819015598	FI	On-Demand	Mild	CTSK	28	43
CCCc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819015598	FI	On-Demand	Mild	HDAC8	15	44
CCCc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819015598	FI	On-Demand	Mild	MMP2	15	41
CCCc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819015598	FI	On-Demand	Mild	MMP3	34	41
CCCc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819015598	FI	On-Demand	Mild	FPR1	44	39
CCCc1ccc(NC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819015608	DH	On-Demand	Anodyne	INHA	23	42
CCCc1ccc(NC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819015608	DH	On-Demand	Anodyne	CA5B	31	40
CCCc1ccc(NC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819015608	DH	On-Demand	Anodyne	CA5A	36	40
CCCc1ccc(NC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819015608	DH	On-Demand	Anodyne	MTNR1A	22	44
CCCc1ccc(NC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819015608	DH	On-Demand	Anodyne	MTNR1B	26	44
CCCc1ccc(NC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819015608	DH	On-Demand	Anodyne	RORC	54	43
CCOC(=O)N1CCC(NC(=O)c2cnc(OC)c(Br)c2)CC1	ZINC000819015640	GE	On-Demand	Anodyne	P2RY12	43	33
CCOC(=O)N1CCC(NC(=O)c2cnc(OC)c(Br)c2)CC1	ZINC000819015640	GE	On-Demand	Anodyne	SSTR5	54	45
CCOC(=O)N1CCC(NC(=O)c2cnc(OC)c(Br)c2)CC1	ZINC000819015640	GE	On-Demand	Anodyne	MCHR1	16	40
CCOC(=O)N1CCC(NC(=O)c2cnc(OC)c(Br)c2)CC1	ZINC000819015640	GE	On-Demand	Anodyne	CCR8	21	42
CCOC(=O)N1CCC(NC(=O)c2cnc(OC)c(Br)c2)CC1	ZINC000819015640	GE	On-Demand	Anodyne	HPGDS	33	41
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015655	EG	On-Demand	Anodyne	DRD2	15	69
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015655	EG	On-Demand	Anodyne	DRD4	18	40
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015655	EG	On-Demand	Anodyne	HTR1D	17	42
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015655	EG	On-Demand	Anodyne	HTR2A	18	62
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015655	EG	On-Demand	Anodyne	SLC6A4	25	56
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015655	EG	On-Demand	Anodyne	SLC6A3	58	61
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015655	EG	On-Demand	Anodyne	KCNH2	15	48
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015655	EG	On-Demand	Anodyne	HTR4	16	42
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015655	EG	On-Demand	Anodyne	GRIN2B	23	43
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015655	EG	On-Demand	Anodyne	SIGMAR1	45	69
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015655	EG	On-Demand	Anodyne	CCR3	47	44
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015655	EG	On-Demand	Anodyne	GRIN2C	18	43
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015655	EG	On-Demand	Anodyne	CACNA1G	29	41
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015656	EG	On-Demand	Anodyne	DRD2	15	69
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015656	EG	On-Demand	Anodyne	DRD4	18	40
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015656	EG	On-Demand	Anodyne	HTR1D	17	42
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015656	EG	On-Demand	Anodyne	HTR2A	18	62
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015656	EG	On-Demand	Anodyne	SLC6A4	25	56
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015656	EG	On-Demand	Anodyne	SLC6A3	58	61
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015656	EG	On-Demand	Anodyne	KCNH2	15	48
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015656	EG	On-Demand	Anodyne	HTR4	16	42
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015656	EG	On-Demand	Anodyne	GRIN2B	23	43
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015656	EG	On-Demand	Anodyne	SIGMAR1	45	69
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015656	EG	On-Demand	Anodyne	CCR3	47	44
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015656	EG	On-Demand	Anodyne	GRIN2C	18	43
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015656	EG	On-Demand	Anodyne	CACNA1G	29	41
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015657	EG	On-Demand	Anodyne	DRD2	15	69
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015657	EG	On-Demand	Anodyne	DRD4	18	40
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015657	EG	On-Demand	Anodyne	HTR1D	17	42
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015657	EG	On-Demand	Anodyne	HTR2A	18	62
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015657	EG	On-Demand	Anodyne	SLC6A4	25	56
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015657	EG	On-Demand	Anodyne	SLC6A3	58	61
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015657	EG	On-Demand	Anodyne	KCNH2	15	48
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015657	EG	On-Demand	Anodyne	HTR4	16	42
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015657	EG	On-Demand	Anodyne	GRIN2B	23	43
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015657	EG	On-Demand	Anodyne	SIGMAR1	45	69
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015657	EG	On-Demand	Anodyne	CCR3	47	44
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015657	EG	On-Demand	Anodyne	GRIN2C	18	43
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015657	EG	On-Demand	Anodyne	CACNA1G	29	41
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015658	EG	On-Demand	Anodyne	DRD2	15	69
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015658	EG	On-Demand	Anodyne	DRD4	18	40
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015658	EG	On-Demand	Anodyne	HTR1D	17	42
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015658	EG	On-Demand	Anodyne	HTR2A	18	62
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015658	EG	On-Demand	Anodyne	SLC6A4	25	56
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015658	EG	On-Demand	Anodyne	SLC6A3	58	61
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015658	EG	On-Demand	Anodyne	KCNH2	15	48
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015658	EG	On-Demand	Anodyne	HTR4	16	42
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015658	EG	On-Demand	Anodyne	GRIN2B	23	43
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015658	EG	On-Demand	Anodyne	SIGMAR1	45	69
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015658	EG	On-Demand	Anodyne	CCR3	47	44
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015658	EG	On-Demand	Anodyne	GRIN2C	18	43
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1	ZINC000819015658	EG	On-Demand	Anodyne	CACNA1G	29	41
CON(C)C(=O)CCNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819015663	DD	On-Demand	Anodyne	DRD2	20	44
CON(C)C(=O)CCNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819015663	DD	On-Demand	Anodyne	DRD4	30	42
CON(C)C(=O)CCNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819015663	DD	On-Demand	Anodyne	ACHE	39	43
CON(C)C(=O)CCNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819015663	DD	On-Demand	Anodyne	HTR1D	16	45
CON(C)C(=O)CCNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819015663	DD	On-Demand	Anodyne	HTR2A	15	44
CON(C)C(=O)CCNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819015663	DD	On-Demand	Anodyne	OPRM1	25	49
CON(C)C(=O)CCNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819015663	DD	On-Demand	Anodyne	OPRD1	22	47
CON(C)C(=O)CCNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819015663	DD	On-Demand	Anodyne	OPRK1	19	47
CON(C)C(=O)CCNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819015663	DD	On-Demand	Anodyne	SLC6A3	17	44
CON(C)C(=O)CCNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819015663	DD	On-Demand	Anodyne	HTR4	42	44
CON(C)C(=O)CCNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819015663	DD	On-Demand	Anodyne	LTA4H	16	45
CON(C)C(=O)CCNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819015663	DD	On-Demand	Anodyne	SIGMAR1	54	44
CON(C)C(=O)CCNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819015663	DD	On-Demand	Anodyne	BCHE	15	43
CON(C)C(=O)CCNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819015663	DD	On-Demand	Anodyne	BIRC2	36	41
CON(C)C(=O)CCNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819015664	DD	On-Demand	Anodyne	DRD2	20	44
CON(C)C(=O)CCNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819015664	DD	On-Demand	Anodyne	DRD4	30	42
CON(C)C(=O)CCNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819015664	DD	On-Demand	Anodyne	ACHE	39	43
CON(C)C(=O)CCNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819015664	DD	On-Demand	Anodyne	HTR1D	16	45
CON(C)C(=O)CCNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819015664	DD	On-Demand	Anodyne	HTR2A	15	44
CON(C)C(=O)CCNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819015664	DD	On-Demand	Anodyne	OPRM1	25	49
CON(C)C(=O)CCNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819015664	DD	On-Demand	Anodyne	OPRD1	22	47
CON(C)C(=O)CCNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819015664	DD	On-Demand	Anodyne	OPRK1	19	47
CON(C)C(=O)CCNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819015664	DD	On-Demand	Anodyne	SLC6A3	17	44
CON(C)C(=O)CCNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819015664	DD	On-Demand	Anodyne	HTR4	42	44
CON(C)C(=O)CCNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819015664	DD	On-Demand	Anodyne	LTA4H	16	45
CON(C)C(=O)CCNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819015664	DD	On-Demand	Anodyne	SIGMAR1	54	44
CON(C)C(=O)CCNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819015664	DD	On-Demand	Anodyne	BCHE	15	43
CON(C)C(=O)CCNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819015664	DD	On-Demand	Anodyne	BIRC2	36	41
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015665	FF	On-Demand	Bother	KCNH2	16	40
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015665	FF	On-Demand	Bother	SIGMAR1	21	48
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015666	FF	On-Demand	Bother	KCNH2	16	40
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015666	FF	On-Demand	Bother	SIGMAR1	21	48
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015667	FF	On-Demand	Bother	KCNH2	16	40
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015667	FF	On-Demand	Bother	SIGMAR1	21	48
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015668	FF	On-Demand	Bother	KCNH2	16	40
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)c1	ZINC000819015668	FF	On-Demand	Bother	SIGMAR1	21	48
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1Cl	ZINC000819015688	FH	On-Demand	Anodyne	DRD4	23	41
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1Cl	ZINC000819015688	FH	On-Demand	Anodyne	ACHE	25	41
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1Cl	ZINC000819015688	FH	On-Demand	Anodyne	OPRM1	16	45
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1Cl	ZINC000819015688	FH	On-Demand	Anodyne	SLC6A3	19	46
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1Cl	ZINC000819015688	FH	On-Demand	Anodyne	HTR4	17	45
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1Cl	ZINC000819015688	FH	On-Demand	Anodyne	SIGMAR1	48	47
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1Cl	ZINC000819015689	FH	On-Demand	Anodyne	DRD4	23	41
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1Cl	ZINC000819015689	FH	On-Demand	Anodyne	ACHE	25	41
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1Cl	ZINC000819015689	FH	On-Demand	Anodyne	OPRM1	16	45
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1Cl	ZINC000819015689	FH	On-Demand	Anodyne	SLC6A3	19	46
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1Cl	ZINC000819015689	FH	On-Demand	Anodyne	HTR4	17	45
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1Cl	ZINC000819015689	FH	On-Demand	Anodyne	SIGMAR1	48	47
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(C)cc1	ZINC000819015706	FI	On-Demand	Mild	PAPA1_CARPA	47	48
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(C)cc1	ZINC000819015706	FI	On-Demand	Mild	CTSK	22	43
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(C)cc1	ZINC000819015706	FI	On-Demand	Mild	FPR1	43	39
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(C)cc1	ZINC000819015707	FI	On-Demand	Mild	PAPA1_CARPA	47	48
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(C)cc1	ZINC000819015707	FI	On-Demand	Mild	CTSK	22	43
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(C)cc1	ZINC000819015707	FI	On-Demand	Mild	FPR1	43	39
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(C)cc1	ZINC000819015708	FI	On-Demand	Mild	PAPA1_CARPA	47	48
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(C)cc1	ZINC000819015708	FI	On-Demand	Mild	CTSK	22	43
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(C)cc1	ZINC000819015708	FI	On-Demand	Mild	FPR1	43	39
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(C)cc1	ZINC000819015709	FI	On-Demand	Mild	PAPA1_CARPA	47	48
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(C)cc1	ZINC000819015709	FI	On-Demand	Mild	CTSK	22	43
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(C)cc1	ZINC000819015709	FI	On-Demand	Mild	FPR1	43	39
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015764	EE	On-Demand	Anodyne	ADRB2	30	46
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015764	EE	On-Demand	Anodyne	ADRB1	33	43
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015764	EE	On-Demand	Anodyne	HTR1D	15	44
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015764	EE	On-Demand	Anodyne	SLC6A3	18	46
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015764	EE	On-Demand	Anodyne	GRIN2B	24	40
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015764	EE	On-Demand	Anodyne	ADRB3	106	48
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015764	EE	On-Demand	Anodyne	SIGMAR1	21	48
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015765	EE	On-Demand	Anodyne	ADRB2	30	46
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015765	EE	On-Demand	Anodyne	ADRB1	33	43
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015765	EE	On-Demand	Anodyne	HTR1D	15	44
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015765	EE	On-Demand	Anodyne	SLC6A3	18	46
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015765	EE	On-Demand	Anodyne	GRIN2B	24	40
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015765	EE	On-Demand	Anodyne	ADRB3	106	48
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015765	EE	On-Demand	Anodyne	SIGMAR1	21	48
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015766	EE	On-Demand	Anodyne	ADRB2	30	46
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015766	EE	On-Demand	Anodyne	ADRB1	33	43
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015766	EE	On-Demand	Anodyne	HTR1D	15	44
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015766	EE	On-Demand	Anodyne	SLC6A3	18	46
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015766	EE	On-Demand	Anodyne	GRIN2B	24	40
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015766	EE	On-Demand	Anodyne	ADRB3	106	48
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015766	EE	On-Demand	Anodyne	SIGMAR1	21	48
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015768	EE	On-Demand	Anodyne	ADRB2	30	46
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015768	EE	On-Demand	Anodyne	ADRB1	33	43
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015768	EE	On-Demand	Anodyne	HTR1D	15	44
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015768	EE	On-Demand	Anodyne	SLC6A3	18	46
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015768	EE	On-Demand	Anodyne	GRIN2B	24	40
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015768	EE	On-Demand	Anodyne	ADRB3	106	48
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cccnc1	ZINC000819015768	EE	On-Demand	Anodyne	SIGMAR1	21	48
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(C(F)(F)F)c1	ZINC000819015779	DH	On-Demand	Anodyne	KCNQ2	50	35
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(C(F)(F)F)c1	ZINC000819015782	DH	On-Demand	Anodyne	KCNQ2	50	35
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(C(F)(F)F)c1	ZINC000819015785	DH	On-Demand	Anodyne	KCNQ2	50	35
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(C(F)(F)F)c1	ZINC000819015788	DH	On-Demand	Anodyne	KCNQ2	50	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ccccc3C)CC1)C2	ZINC000819015795	FF	On-Demand	Anodyne	SSTR1	47	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ccccc3C)CC1)C2	ZINC000819015800	FF	On-Demand	Anodyne	SSTR1	47	36
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819015804	GH	On-Demand	Anodyne	SLC6A3	23	51
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819015804	GH	On-Demand	Anodyne	HTR4	15	41
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819015804	GH	On-Demand	Anodyne	SIGMAR1	38	52
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819015804	GH	On-Demand	Anodyne	CCR3	47	39
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819015807	GH	On-Demand	Anodyne	SLC6A3	23	51
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819015807	GH	On-Demand	Anodyne	HTR4	15	41
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819015807	GH	On-Demand	Anodyne	SIGMAR1	38	52
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819015807	GH	On-Demand	Anodyne	CCR3	47	39
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819015809	GH	On-Demand	Anodyne	SLC6A3	23	51
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819015809	GH	On-Demand	Anodyne	HTR4	15	41
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819015809	GH	On-Demand	Anodyne	SIGMAR1	38	52
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819015809	GH	On-Demand	Anodyne	CCR3	47	39
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819015812	GH	On-Demand	Anodyne	SLC6A3	23	51
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819015812	GH	On-Demand	Anodyne	HTR4	15	41
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819015812	GH	On-Demand	Anodyne	SIGMAR1	38	52
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819015812	GH	On-Demand	Anodyne	CCR3	47	39
NC(=O)C1CCN(c2ncccc2CNC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819015820	FD	On-Demand	Anodyne	SCD	21	43
NC(=O)C1CCN(c2ncccc2CNC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819015821	FD	On-Demand	Anodyne	SCD	21	43
NC(=O)c1ccc(CNC(=O)/C=C/[C@@H]2CCCO2)cc1	ZINC000819015843	CD	On-Demand	Anodyne	PROC	43	32
NC(=O)c1ccc(CNC(=O)/C=C\[C@H]2CCCO2)cc1	ZINC000819015846	CD	On-Demand	Anodyne	PROC	43	32
NC(=O)c1ccc(CNC(=O)/C=C/[C@H]2CCCO2)cc1	ZINC000819015848	CD	On-Demand	Anodyne	PROC	43	32
NC(=O)c1ccc(CNC(=O)/C=C\[C@@H]2CCCO2)cc1	ZINC000819015851	CD	On-Demand	Anodyne	PROC	43	32
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819015852	EE	On-Demand	Bother	ADRB2	75	52
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819015852	EE	On-Demand	Bother	ADRB1	90	52
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819015852	EE	On-Demand	Bother	ADRB3	157	52
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819015852	EE	On-Demand	Bother	MMP8	19	44
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819015852	EE	On-Demand	Bother	MMP1	17	44
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819015853	EE	On-Demand	Bother	ADRB2	75	52
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819015853	EE	On-Demand	Bother	ADRB1	90	52
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819015853	EE	On-Demand	Bother	ADRB3	157	52
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819015853	EE	On-Demand	Bother	MMP8	19	44
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819015853	EE	On-Demand	Bother	MMP1	17	44
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015860	EF	On-Demand	Anodyne	DRD2	15	47
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015860	EF	On-Demand	Anodyne	DRD4	35	45
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015860	EF	On-Demand	Anodyne	ACHE	21	43
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015860	EF	On-Demand	Anodyne	SIGMAR1	29	49
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015860	EF	On-Demand	Anodyne	FAAH	27	53
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015860	EF	On-Demand	Anodyne	MCHR1	22	41
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015861	EF	On-Demand	Anodyne	DRD2	15	47
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015861	EF	On-Demand	Anodyne	DRD4	35	45
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015861	EF	On-Demand	Anodyne	ACHE	21	43
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015861	EF	On-Demand	Anodyne	SIGMAR1	29	49
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015861	EF	On-Demand	Anodyne	FAAH	27	53
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015861	EF	On-Demand	Anodyne	MCHR1	22	41
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015863	EF	On-Demand	Anodyne	DRD2	15	47
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015863	EF	On-Demand	Anodyne	DRD4	35	45
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015863	EF	On-Demand	Anodyne	ACHE	21	43
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015863	EF	On-Demand	Anodyne	SIGMAR1	29	49
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015863	EF	On-Demand	Anodyne	FAAH	27	53
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015863	EF	On-Demand	Anodyne	MCHR1	22	41
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015864	EF	On-Demand	Anodyne	DRD2	15	47
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015864	EF	On-Demand	Anodyne	DRD4	35	45
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015864	EF	On-Demand	Anodyne	ACHE	21	43
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015864	EF	On-Demand	Anodyne	SIGMAR1	29	49
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015864	EF	On-Demand	Anodyne	FAAH	27	53
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819015864	EF	On-Demand	Anodyne	MCHR1	22	41
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819015872	FH	On-Demand	Anodyne	ADRB2	88	48
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819015872	FH	On-Demand	Anodyne	ADRB1	109	47
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819015872	FH	On-Demand	Anodyne	ADRB3	160	47
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819015873	FH	On-Demand	Anodyne	ADRB2	88	48
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819015873	FH	On-Demand	Anodyne	ADRB1	109	47
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819015873	FH	On-Demand	Anodyne	ADRB3	160	47
NC(=O)C1CCC(NC[C@H](O)c2ccc(F)c(Br)c2)CC1	ZINC000819015884	FE	On-Demand	Anodyne	ADRB3	24	42
NC(=O)C1CCC(NC[C@@H](O)c2ccc(F)c(Br)c2)CC1	ZINC000819015885	FE	On-Demand	Anodyne	ADRB3	24	42
O=C(NCCc1cccs1)C(F)=C1CCC1	ZINC000819015901	BF	On-Demand	Anodyne	CA5B	28	40
Cc1ccccc1CNC(=O)C(F)=C1CCC1	ZINC000819015908	BG	On-Demand	Anodyne	P2RX7	20	44
CCOC(=O)N1CCC(NC(=O)c2cc(Br)c(C)s2)CC1	ZINC000819015912	GG	On-Demand	Anodyne	CCR8	24	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(C)(C)c2ccc(F)cc2)CC1	ZINC000819015935	GH	On-Demand	Anodyne	GPR119	51	52
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(C)(C)c2ccc(F)cc2)CC1	ZINC000819015936	GH	On-Demand	Anodyne	GPR119	51	52
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819015959	EF	On-Demand	Anodyne	ADRB2	92	50
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819015959	EF	On-Demand	Anodyne	ADRB1	110	49
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819015959	EF	On-Demand	Anodyne	ADRB3	183	49
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819015960	EF	On-Demand	Anodyne	ADRB2	92	50
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819015960	EF	On-Demand	Anodyne	ADRB1	110	49
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819015960	EF	On-Demand	Anodyne	ADRB3	183	49
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819015961	DF	On-Demand	Anodyne	ADRB2	90	50
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819015961	DF	On-Demand	Anodyne	ADRB1	114	50
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819015961	DF	On-Demand	Anodyne	ADRB3	158	50
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccccc2F)cc1	ZINC000819015962	DF	On-Demand	Anodyne	ADRB2	90	50
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccccc2F)cc1	ZINC000819015962	DF	On-Demand	Anodyne	ADRB1	114	50
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccccc2F)cc1	ZINC000819015962	DF	On-Demand	Anodyne	ADRB3	158	50
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)N(C)Cc1ccccc1	ZINC000819015964	GG	On-Demand	Bother	COLA	103	41
Cc1ccccc1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819015976	FG	On-Demand	Mild	PAPA1_CARPA	72	54
Cc1ccccc1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819015976	FG	On-Demand	Mild	CCKAR	51	40
Cc1ccccc1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819015976	FG	On-Demand	Mild	CTSK	27	48
Cc1ccccc1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819015976	FG	On-Demand	Mild	CTSL	35	54
Cc1ccccc1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819015976	FG	On-Demand	Mild	TACR3	15	42
Cc1ccccc1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819015976	FG	On-Demand	Mild	CCKBR	17	40
Cc1ccccc1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819015976	FG	On-Demand	Mild	CTSS	22	55
Cc1ccccc1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819015976	FG	On-Demand	Mild	FPR1	47	42
Cc1ccccc1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819015977	FG	On-Demand	Mild	PAPA1_CARPA	72	54
Cc1ccccc1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819015977	FG	On-Demand	Mild	CCKAR	51	40
Cc1ccccc1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819015977	FG	On-Demand	Mild	CTSK	27	48
Cc1ccccc1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819015977	FG	On-Demand	Mild	CTSL	35	54
Cc1ccccc1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819015977	FG	On-Demand	Mild	TACR3	15	42
Cc1ccccc1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819015977	FG	On-Demand	Mild	CCKBR	17	40
Cc1ccccc1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819015977	FG	On-Demand	Mild	CTSS	22	55
Cc1ccccc1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819015977	FG	On-Demand	Mild	FPR1	47	42
COc1ccc(OC)c([C@H](O)CNCCCCC#N)c1	ZINC000819015982	CE	On-Demand	Mild	ADRB2	20	47
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819015983	EE	On-Demand	Bother	ADRB2	86	51
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819015983	EE	On-Demand	Bother	ADRB1	108	51
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819015983	EE	On-Demand	Bother	CACNA1C	43	35
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819015983	EE	On-Demand	Bother	ADRB3	182	51
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819015983	EE	On-Demand	Bother	CACNA1D	73	35
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819015984	EE	On-Demand	Bother	ADRB2	86	51
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819015984	EE	On-Demand	Bother	ADRB1	108	51
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819015984	EE	On-Demand	Bother	CACNA1C	43	35
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819015984	EE	On-Demand	Bother	ADRB3	182	51
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819015984	EE	On-Demand	Bother	CACNA1D	73	35
CC(C)c1ccc([C@H](CNC[C@@H](O)c2cccnc2)NC(=O)OC(C)(C)C)cc1	ZINC000819015991	GI	On-Demand	Anodyne	ADRB2	18	40
CC(C)c1ccc([C@H](CNC[C@@H](O)c2cccnc2)NC(=O)OC(C)(C)C)cc1	ZINC000819015991	GI	On-Demand	Anodyne	ADRB1	23	42
CC(C)c1ccc([C@H](CNC[C@@H](O)c2cccnc2)NC(=O)OC(C)(C)C)cc1	ZINC000819015991	GI	On-Demand	Anodyne	ADRB3	82	46
CC(C)c1ccc([C@@H](CNC[C@@H](O)c2cccnc2)NC(=O)OC(C)(C)C)cc1	ZINC000819015992	GI	On-Demand	Anodyne	ADRB2	18	40
CC(C)c1ccc([C@@H](CNC[C@@H](O)c2cccnc2)NC(=O)OC(C)(C)C)cc1	ZINC000819015992	GI	On-Demand	Anodyne	ADRB1	23	42
CC(C)c1ccc([C@@H](CNC[C@@H](O)c2cccnc2)NC(=O)OC(C)(C)C)cc1	ZINC000819015992	GI	On-Demand	Anodyne	ADRB3	82	46
CC(C)c1ccc([C@@H](CNC[C@H](O)c2cccnc2)NC(=O)OC(C)(C)C)cc1	ZINC000819015993	GI	On-Demand	Anodyne	ADRB2	18	40
CC(C)c1ccc([C@@H](CNC[C@H](O)c2cccnc2)NC(=O)OC(C)(C)C)cc1	ZINC000819015993	GI	On-Demand	Anodyne	ADRB1	23	42
CC(C)c1ccc([C@@H](CNC[C@H](O)c2cccnc2)NC(=O)OC(C)(C)C)cc1	ZINC000819015993	GI	On-Demand	Anodyne	ADRB3	82	46
CC(C)c1ccc([C@H](CNC[C@H](O)c2cccnc2)NC(=O)OC(C)(C)C)cc1	ZINC000819015994	GI	On-Demand	Anodyne	ADRB2	18	40
CC(C)c1ccc([C@H](CNC[C@H](O)c2cccnc2)NC(=O)OC(C)(C)C)cc1	ZINC000819015994	GI	On-Demand	Anodyne	ADRB1	23	42
CC(C)c1ccc([C@H](CNC[C@H](O)c2cccnc2)NC(=O)OC(C)(C)C)cc1	ZINC000819015994	GI	On-Demand	Anodyne	ADRB3	82	46
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccnc2)cc1	ZINC000819016001	CD	On-Demand	Anodyne	ADRB2	94	74
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccnc2)cc1	ZINC000819016001	CD	On-Demand	Anodyne	ADRB1	118	66
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccnc2)cc1	ZINC000819016001	CD	On-Demand	Anodyne	ADRB3	234	76
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccnc2)cc1	ZINC000819016001	CD	On-Demand	Anodyne	KCNA5	18	42
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccnc2)cc1	ZINC000819016001	CD	On-Demand	Anodyne	CYP51A1	16	40
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccnc2)cc1	ZINC000819016002	CD	On-Demand	Anodyne	ADRB2	94	74
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccnc2)cc1	ZINC000819016002	CD	On-Demand	Anodyne	ADRB1	118	66
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccnc2)cc1	ZINC000819016002	CD	On-Demand	Anodyne	ADRB3	234	76
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccnc2)cc1	ZINC000819016002	CD	On-Demand	Anodyne	KCNA5	18	42
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccnc2)cc1	ZINC000819016002	CD	On-Demand	Anodyne	CYP51A1	16	40
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccccc2C)cc1	ZINC000819016003	DF	On-Demand	Anodyne	ADRB2	95	51
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccccc2C)cc1	ZINC000819016003	DF	On-Demand	Anodyne	ADRB1	114	51
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccccc2C)cc1	ZINC000819016003	DF	On-Demand	Anodyne	ADRB3	152	54
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccccc2C)cc1	ZINC000819016004	DF	On-Demand	Anodyne	ADRB2	95	51
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccccc2C)cc1	ZINC000819016004	DF	On-Demand	Anodyne	ADRB1	114	51
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccccc2C)cc1	ZINC000819016004	DF	On-Demand	Anodyne	ADRB3	152	54
CC(=O)Nc1ccc(CCNC[C@](C)(O)CNC(=O)OC(C)(C)C)cc1	ZINC000819016014	FE	On-Demand	Anodyne	ADRB1	15	42
CC(=O)Nc1ccc(CCNC[C@](C)(O)CNC(=O)OC(C)(C)C)cc1	ZINC000819016014	FE	On-Demand	Anodyne	ADRB3	17	42
CC(=O)Nc1ccc(CCNC[C@@](C)(O)CNC(=O)OC(C)(C)C)cc1	ZINC000819016015	FE	On-Demand	Anodyne	ADRB1	15	42
CC(=O)Nc1ccc(CCNC[C@@](C)(O)CNC(=O)OC(C)(C)C)cc1	ZINC000819016015	FE	On-Demand	Anodyne	ADRB3	17	42
Cc1ccccc1CNC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819016024	DF	On-Demand	Anodyne	P2RX7	25	44
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1cc(Cl)ccc1Cl	ZINC000819016029	IJ	On-Demand	Bother	COLA	99	41
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819016030	DF	On-Demand	Anodyne	ADRB2	98	56
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819016030	DF	On-Demand	Anodyne	ADRB1	113	52
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819016030	DF	On-Demand	Anodyne	ADRB3	178	52
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819016030	DF	On-Demand	Anodyne	LEF	43	43
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819016031	DF	On-Demand	Anodyne	ADRB2	98	56
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819016031	DF	On-Demand	Anodyne	ADRB1	113	52
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819016031	DF	On-Demand	Anodyne	ADRB3	178	52
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819016031	DF	On-Demand	Anodyne	LEF	43	43
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819016034	GD	On-Demand	Anodyne	CA2	21	49
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819016034	GD	On-Demand	Anodyne	ADRB2	93	50
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819016034	GD	On-Demand	Anodyne	ADRB1	102	51
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819016034	GD	On-Demand	Anodyne	ADRB3	194	54
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819016034	GD	On-Demand	Anodyne	CA1	23	49
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819016034	GD	On-Demand	Anodyne	CA4	15	49
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819016034	GD	On-Demand	Anodyne	CA12	17	43
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819016034	GD	On-Demand	Anodyne	CA9	17	43
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819016034	GD	On-Demand	Anodyne	AOC3	22	44
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819016035	GD	On-Demand	Anodyne	CA2	21	49
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819016035	GD	On-Demand	Anodyne	ADRB2	93	50
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819016035	GD	On-Demand	Anodyne	ADRB1	102	51
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819016035	GD	On-Demand	Anodyne	ADRB3	194	54
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819016035	GD	On-Demand	Anodyne	CA1	23	49
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819016035	GD	On-Demand	Anodyne	CA4	15	49
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819016035	GD	On-Demand	Anodyne	CA12	17	43
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819016035	GD	On-Demand	Anodyne	CA9	17	43
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819016035	GD	On-Demand	Anodyne	AOC3	22	44
C#CCNC(=O)CCNCCCOc1ccccc1OC	ZINC000819016041	CD	On-Demand	Mild	HTR1A	20	47
C#CCNC(=O)CCNCCCOc1ccccc1OC	ZINC000819016041	CD	On-Demand	Mild	ADRA1D	22	47
C#CCNC(=O)CCNCCCOc1ccccc1OC	ZINC000819016041	CD	On-Demand	Mild	ADRA1A	15	47
C#CCNC(=O)CCNCCCOc1ccccc1OC	ZINC000819016041	CD	On-Demand	Mild	ADRA1B	15	47
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016043	GH	On-Demand	Anodyne	SLC6A3	24	48
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016043	GH	On-Demand	Anodyne	GRIN2B	17	41
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016043	GH	On-Demand	Anodyne	SIGMAR1	23	58
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016043	GH	On-Demand	Anodyne	MCHR1	18	43
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016043	GH	On-Demand	Anodyne	BIRC2	26	41
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016045	GH	On-Demand	Anodyne	SLC6A3	24	48
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016045	GH	On-Demand	Anodyne	GRIN2B	17	41
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016045	GH	On-Demand	Anodyne	SIGMAR1	23	58
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016045	GH	On-Demand	Anodyne	MCHR1	18	43
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016045	GH	On-Demand	Anodyne	BIRC2	26	41
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016046	GH	On-Demand	Anodyne	SLC6A3	24	48
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016046	GH	On-Demand	Anodyne	GRIN2B	17	41
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016046	GH	On-Demand	Anodyne	SIGMAR1	23	58
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016046	GH	On-Demand	Anodyne	MCHR1	18	43
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016046	GH	On-Demand	Anodyne	BIRC2	26	41
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016047	GH	On-Demand	Anodyne	SLC6A3	24	48
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016047	GH	On-Demand	Anodyne	GRIN2B	17	41
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016047	GH	On-Demand	Anodyne	SIGMAR1	23	58
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016047	GH	On-Demand	Anodyne	MCHR1	18	43
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819016047	GH	On-Demand	Anodyne	BIRC2	26	41
O[C@H](CN[C@H]1CCN(c2ccc(Br)cc2)C1)c1ccc(F)c(F)c1	ZINC000819016076	GH	On-Demand	Anodyne	ADRB3	18	43
O[C@@H](CN[C@@H]1CCN(c2ccc(Br)cc2)C1)c1ccc(F)c(F)c1	ZINC000819016077	GH	On-Demand	Anodyne	ADRB3	18	43
O[C@@H](CN[C@H]1CCN(c2ccc(Br)cc2)C1)c1ccc(F)c(F)c1	ZINC000819016078	GH	On-Demand	Anodyne	ADRB3	18	43
O[C@H](CN[C@@H]1CCN(c2ccc(Br)cc2)C1)c1ccc(F)c(F)c1	ZINC000819016079	GH	On-Demand	Anodyne	ADRB3	18	43
CCOC(=O)N1CCC(NC(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819016081	FD	On-Demand	Anodyne	DRD4	40	32
CCOC(=O)N1CCC(NC(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819016081	FD	On-Demand	Anodyne	MTNR1A	26	48
CCOC(=O)N1CCC(NC(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819016081	FD	On-Demand	Anodyne	MTNR1B	33	48
CCOC(=O)N1CCC(NC(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819016081	FD	On-Demand	Anodyne	EPHX2	19	41
CCOC(=O)N1CCC(NC(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819016081	FD	On-Demand	Anodyne	CCR8	27	40
CCOC(=O)N1CCC(NC(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819016082	FD	On-Demand	Anodyne	DRD4	40	32
CCOC(=O)N1CCC(NC(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819016082	FD	On-Demand	Anodyne	MTNR1A	26	48
CCOC(=O)N1CCC(NC(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819016082	FD	On-Demand	Anodyne	MTNR1B	33	48
CCOC(=O)N1CCC(NC(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819016082	FD	On-Demand	Anodyne	EPHX2	19	41
CCOC(=O)N1CCC(NC(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819016082	FD	On-Demand	Anodyne	CCR8	27	40
CN(C)CCCOc1ccc(CNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819016086	FG	On-Demand	Anodyne	LEF	61	38
CN(C)CCCOc1ccc(CNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819016087	FG	On-Demand	Anodyne	LEF	61	38
N#Cc1ccc(CN2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1	ZINC000819016088	ED	On-Demand	Mild	MLNR	22	43
N#Cc1ccc(CN2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1	ZINC000819016089	ED	On-Demand	Mild	MLNR	22	43
N#Cc1ccc(CN2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1	ZINC000819016090	ED	On-Demand	Mild	MLNR	22	43
N#Cc1ccc(CN2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1	ZINC000819016091	ED	On-Demand	Mild	MLNR	22	43
Cc1ccccc1[C@@H](O)CNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819016104	EG	On-Demand	Anodyne	ACHE	17	44
Cc1ccccc1[C@@H](O)CNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819016104	EG	On-Demand	Anodyne	HTR1D	15	41
Cc1ccccc1[C@@H](O)CNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819016104	EG	On-Demand	Anodyne	OPRM1	15	40
Cc1ccccc1[C@@H](O)CNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819016104	EG	On-Demand	Anodyne	SLC6A3	15	43
Cc1ccccc1[C@@H](O)CNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819016104	EG	On-Demand	Anodyne	HTR4	21	47
Cc1ccccc1[C@@H](O)CNC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819016104	EG	On-Demand	Anodyne	SIGMAR1	34	47
Cc1ccccc1[C@@H](O)CNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819016106	EG	On-Demand	Anodyne	ACHE	17	44
Cc1ccccc1[C@@H](O)CNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819016106	EG	On-Demand	Anodyne	HTR1D	15	41
Cc1ccccc1[C@@H](O)CNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819016106	EG	On-Demand	Anodyne	OPRM1	15	40
Cc1ccccc1[C@@H](O)CNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819016106	EG	On-Demand	Anodyne	SLC6A3	15	43
Cc1ccccc1[C@@H](O)CNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819016106	EG	On-Demand	Anodyne	HTR4	21	47
Cc1ccccc1[C@@H](O)CNC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819016106	EG	On-Demand	Anodyne	SIGMAR1	34	47
COc1cccc([C@H](CNC(=O)/C=C\[C@H]2CCCO2)N2CCCC2)c1	ZINC000819016120	EF	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](CNC(=O)/C=C/[C@H]2CCCO2)N2CCCC2)c1	ZINC000819016121	EF	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](CNC(=O)/C=C/[C@@H]2CCCO2)N2CCCC2)c1	ZINC000819016122	EF	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](CNC(=O)/C=C\[C@@H]2CCCO2)N2CCCC2)c1	ZINC000819016123	EF	On-Demand	Anodyne	DRD4	42	32
Cc1oc(-c2ccccc2)nc1CC(=O)NCCCOc1ccccc1F	ZINC000819016145	FH	On-Demand	Anodyne	PPARG	94	45
Cc1oc(-c2ccccc2)nc1CC(=O)NCCCOc1ccccc1F	ZINC000819016145	FH	On-Demand	Anodyne	PPARA	102	45
Cc1oc(-c2ccccc2)nc1CC(=O)NCCCOc1ccccc1F	ZINC000819016145	FH	On-Demand	Anodyne	PDE8B	62	36
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819016146	DF	On-Demand	Anodyne	ADRB2	105	52
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819016146	DF	On-Demand	Anodyne	ADRB1	125	58
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819016146	DF	On-Demand	Anodyne	ADRB3	199	58
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819016147	DF	On-Demand	Anodyne	ADRB2	105	52
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819016147	DF	On-Demand	Anodyne	ADRB1	125	58
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819016147	DF	On-Demand	Anodyne	ADRB3	199	58
NC(=O)C1CCN(c2ncccc2CNC[C@H](O)c2ccccc2Cl)CC1	ZINC000819016156	GE	On-Demand	Anodyne	OPRL1	39	40
NC(=O)C1CCN(c2ncccc2CNCC2(O)CCCCC2)CC1	ZINC000819016163	ED	On-Demand	Anodyne	SCN10A	15	41
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819016173	EG	On-Demand	Anodyne	ADRB2	92	50
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819016173	EG	On-Demand	Anodyne	ADRB1	116	50
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819016173	EG	On-Demand	Anodyne	ADRB3	152	50
CC(=O)Nc1ccc(CCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819016176	EF	On-Demand	Anodyne	ADRB2	78	51
CC(=O)Nc1ccc(CCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819016176	EF	On-Demand	Anodyne	ADRB1	98	51
CC(=O)Nc1ccc(CCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819016176	EF	On-Demand	Anodyne	ADRB3	155	51
CC(=O)Nc1ccc(CCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819016177	EF	On-Demand	Anodyne	ADRB2	78	51
CC(=O)Nc1ccc(CCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819016177	EF	On-Demand	Anodyne	ADRB1	98	51
CC(=O)Nc1ccc(CCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819016177	EF	On-Demand	Anodyne	ADRB3	155	51
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1c(Cl)cc(Cl)cc1Cl	ZINC000819016186	JK	On-Demand	Bother	COLA	96	37
N#CCCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819016191	CF	On-Demand	Mild	ADRB2	27	42
N#CCCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819016191	CF	On-Demand	Mild	ADRB1	25	42
N#CCCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819016191	CF	On-Demand	Mild	ADRB3	23	42
N#CCCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819016192	CF	On-Demand	Mild	ADRB2	27	42
N#CCCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819016192	CF	On-Demand	Mild	ADRB1	25	42
N#CCCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819016192	CF	On-Demand	Mild	ADRB3	23	42
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(Br)cc2)cc1	ZINC000819016200	GG	On-Demand	Anodyne	ADRB2	87	55
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(Br)cc2)cc1	ZINC000819016200	GG	On-Demand	Anodyne	ADRB1	100	52
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(Br)cc2)cc1	ZINC000819016200	GG	On-Demand	Anodyne	ADRB3	167	52
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(Br)cc2)cc1	ZINC000819016201	GG	On-Demand	Anodyne	ADRB2	87	55
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(Br)cc2)cc1	ZINC000819016201	GG	On-Demand	Anodyne	ADRB1	100	52
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(Br)cc2)cc1	ZINC000819016201	GG	On-Demand	Anodyne	ADRB3	167	52
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2CCC(C(N)=O)CC2)CC1	ZINC000819016203	FD	On-Demand	Anodyne	GPR119	29	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2CCC(C(N)=O)CC2)CC1	ZINC000819016204	FD	On-Demand	Anodyne	GPR119	29	42
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819016205	EF	On-Demand	Anodyne	ADRB2	75	48
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819016205	EF	On-Demand	Anodyne	ADRB1	100	48
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819016205	EF	On-Demand	Anodyne	ADRB3	133	48
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819016205	EF	On-Demand	Anodyne	LEF	64	38
CC(=O)Nc1ccc(CCNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819016206	EF	On-Demand	Anodyne	ADRB2	75	48
CC(=O)Nc1ccc(CCNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819016206	EF	On-Demand	Anodyne	ADRB1	100	48
CC(=O)Nc1ccc(CCNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819016206	EF	On-Demand	Anodyne	ADRB3	133	48
CC(=O)Nc1ccc(CCNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819016206	EF	On-Demand	Anodyne	LEF	64	38
NC(=O)C1CCN(c2ncccc2CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819016215	GE	On-Demand	Anodyne	SCN2A	18	44
NC(=O)C1CCN(c2ncccc2CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819016215	GE	On-Demand	Anodyne	AKT3	58	35
NC(=O)C1CCN(c2ncccc2CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819016215	GE	On-Demand	Anodyne	SCN10A	27	44
NC(=O)C1CCC(NC[C@@H](O)c2cc3ccccc3o2)CC1	ZINC000819016216	DE	On-Demand	Anodyne	VCP	31	42
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)N1CCc2ccccc2C1	ZINC000819016218	HG	On-Demand	Bother	DPP8	22	42
CON(C)C(=O)CCNCCc1ccc(NC(C)=O)cc1	ZINC000819016221	CD	On-Demand	Anodyne	ADRB1	19	45
CON(C)C(=O)CCNCCc1ccc(NC(C)=O)cc1	ZINC000819016221	CD	On-Demand	Anodyne	ADRB3	23	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3cccc(C)c3)CC1)C2	ZINC000819016222	GF	On-Demand	Anodyne	DRD4	22	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3cccc(C)c3)CC1)C2	ZINC000819016222	GF	On-Demand	Anodyne	SIGMAR1	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3cccc(C)c3)CC1)C2	ZINC000819016222	GF	On-Demand	Anodyne	FAAH	19	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3cccc(C)c3)CC1)C2	ZINC000819016223	GF	On-Demand	Anodyne	DRD4	22	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3cccc(C)c3)CC1)C2	ZINC000819016223	GF	On-Demand	Anodyne	SIGMAR1	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3cccc(C)c3)CC1)C2	ZINC000819016223	GF	On-Demand	Anodyne	FAAH	19	42
Cc1ccccc1CNC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819016228	GG	On-Demand	Anodyne	SSTR2	40	33
Cc1ccccc1CNC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819016228	GG	On-Demand	Anodyne	PREP	17	42
Cc1ccccc1CNC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819016229	GG	On-Demand	Anodyne	SSTR2	40	33
Cc1ccccc1CNC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819016229	GG	On-Demand	Anodyne	PREP	17	42
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819016232	GG	On-Demand	Anodyne	ADRB2	96	55
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819016232	GG	On-Demand	Anodyne	ADRB1	118	55
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819016232	GG	On-Demand	Anodyne	GCGR	26	46
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819016232	GG	On-Demand	Anodyne	ADRB3	187	59
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819016232	GG	On-Demand	Anodyne	P2RY1	47	34
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819016232	GG	On-Demand	Anodyne	EPHX2	49	38
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819016232	GG	On-Demand	Anodyne	GIPR	23	40
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819016233	GG	On-Demand	Anodyne	ADRB2	96	55
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819016233	GG	On-Demand	Anodyne	ADRB1	118	55
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819016233	GG	On-Demand	Anodyne	GCGR	26	46
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819016233	GG	On-Demand	Anodyne	ADRB3	187	59
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819016233	GG	On-Demand	Anodyne	P2RY1	47	34
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819016233	GG	On-Demand	Anodyne	EPHX2	49	38
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819016233	GG	On-Demand	Anodyne	GIPR	23	40
COc1cccc([C@H](CNC(=O)C(F)=C2CCC2)N2CCCC2)c1	ZINC000819016246	EG	On-Demand	Anodyne	DRD4	46	35
CCOC(=O)N1CCC(NC(=O)c2cn(-c3ccccc3)nc2C(C)C)CC1	ZINC000819016283	GG	On-Demand	Anodyne	CNR1	16	46
CCOC(=O)N1CCC(NC(=O)c2cn(-c3ccccc3)nc2C(C)C)CC1	ZINC000819016283	GG	On-Demand	Anodyne	P2RY12	127	41
CCOC(=O)N1CCC(NC(=O)c2cn(-c3ccccc3)nc2C(C)C)CC1	ZINC000819016283	GG	On-Demand	Anodyne	CCR8	45	47
CCOC(=O)N1CCC(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819016289	GH	On-Demand	Anodyne	DRD4	18	45
CCOC(=O)N1CCC(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819016289	GH	On-Demand	Anodyne	HTR4	16	40
CCOC(=O)N1CCC(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819016289	GH	On-Demand	Anodyne	P2RY12	211	41
CCOC(=O)N1CCC(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819016289	GH	On-Demand	Anodyne	SSTR5	43	36
CCOC(=O)N1CCC(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819016289	GH	On-Demand	Anodyne	EPHX2	16	44
CCOC(=O)N1CCC(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819016289	GH	On-Demand	Anodyne	MCHR1	17	45
CCOC(=O)N1CCC(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819016289	GH	On-Demand	Anodyne	CCR8	38	43
O=[N+]([O-])c1ccc([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016290	FF	On-Demand	Bother	SLC6A3	16	44
O=[N+]([O-])c1ccc([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016290	FF	On-Demand	Bother	KCNH2	15	44
O=[N+]([O-])c1ccc([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016290	FF	On-Demand	Bother	SIGMAR1	24	49
O=[N+]([O-])c1ccc([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016290	FF	On-Demand	Bother	BIRC2	21	42
O=[N+]([O-])c1ccc([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016290	FF	On-Demand	Bother	KCNJ1	30	44
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016291	FF	On-Demand	Bother	SLC6A3	16	44
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016291	FF	On-Demand	Bother	KCNH2	15	44
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016291	FF	On-Demand	Bother	SIGMAR1	24	49
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016291	FF	On-Demand	Bother	BIRC2	21	42
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016291	FF	On-Demand	Bother	KCNJ1	30	44
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016292	FF	On-Demand	Bother	SLC6A3	16	44
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016292	FF	On-Demand	Bother	KCNH2	15	44
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016292	FF	On-Demand	Bother	SIGMAR1	24	49
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016292	FF	On-Demand	Bother	BIRC2	21	42
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016292	FF	On-Demand	Bother	KCNJ1	30	44
O=[N+]([O-])c1ccc([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016293	FF	On-Demand	Bother	SLC6A3	16	44
O=[N+]([O-])c1ccc([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016293	FF	On-Demand	Bother	KCNH2	15	44
O=[N+]([O-])c1ccc([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016293	FF	On-Demand	Bother	SIGMAR1	24	49
O=[N+]([O-])c1ccc([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016293	FF	On-Demand	Bother	BIRC2	21	42
O=[N+]([O-])c1ccc([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016293	FF	On-Demand	Bother	KCNJ1	30	44
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(F)c(F)c1	ZINC000819016296	CF	On-Demand	Anodyne	KCNQ2	53	41
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(F)c(F)c1	ZINC000819016297	CF	On-Demand	Anodyne	KCNQ2	53	41
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(F)c(F)c1	ZINC000819016298	CF	On-Demand	Anodyne	KCNQ2	53	41
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(F)c(F)c1	ZINC000819016299	CF	On-Demand	Anodyne	KCNQ2	53	41
O[C@@H](CN[C@@H]1CCN(c2ccc(Br)cc2)C1)c1ccccc1	ZINC000819016310	FG	On-Demand	Anodyne	ADRB3	28	42
O[C@H](CN[C@H]1CCN(c2ccc(Br)cc2)C1)c1ccccc1	ZINC000819016311	FG	On-Demand	Anodyne	ADRB3	28	42
O[C@H](CN[C@@H]1CCN(c2ccc(Br)cc2)C1)c1ccccc1	ZINC000819016312	FG	On-Demand	Anodyne	ADRB3	28	42
O[C@@H](CN[C@H]1CCN(c2ccc(Br)cc2)C1)c1ccccc1	ZINC000819016313	FG	On-Demand	Anodyne	ADRB3	28	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3ccc(C#N)cc3)CC1)C2	ZINC000819016316	GE	On-Demand	Mild	MLNR	30	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3ccc(C#N)cc3)CC1)C2	ZINC000819016317	GE	On-Demand	Mild	MLNR	30	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000819016328	GE	On-Demand	Mild	MLNR	21	41
CCOC(=O)N1CCC(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819016331	FD	On-Demand	Anodyne	EPHX2	15	42
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819016335	FH	On-Demand	Anodyne	DRD4	19	40
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819016335	FH	On-Demand	Anodyne	ACHE	24	43
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819016335	FH	On-Demand	Anodyne	HTR1D	15	41
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819016335	FH	On-Demand	Anodyne	SIGMAR1	36	47
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819016336	FH	On-Demand	Anodyne	DRD4	19	40
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819016336	FH	On-Demand	Anodyne	ACHE	24	43
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819016336	FH	On-Demand	Anodyne	HTR1D	15	41
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819016336	FH	On-Demand	Anodyne	SIGMAR1	36	47
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(C)cc2)cc1	ZINC000819016349	DF	On-Demand	Anodyne	ADRB2	94	57
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(C)cc2)cc1	ZINC000819016349	DF	On-Demand	Anodyne	ADRB1	110	53
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(C)cc2)cc1	ZINC000819016349	DF	On-Demand	Anodyne	ADRB3	180	54
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(C)cc2)cc1	ZINC000819016350	DF	On-Demand	Anodyne	ADRB2	94	57
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(C)cc2)cc1	ZINC000819016350	DF	On-Demand	Anodyne	ADRB1	110	53
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(C)cc2)cc1	ZINC000819016350	DF	On-Demand	Anodyne	ADRB3	180	54
CC(C)(C)OC(=O)NCCCNCCC(=O)Nc1cccc(Cl)c1	ZINC000819016357	FG	On-Demand	Anodyne	HDAC10	15	44
OC1(CNC[C@@H]2CCN(CCc3ccccc3)C2)CCCCC1	ZINC000819016359	DF	On-Demand	Anodyne	ACHE	18	43
OC1(CNC[C@@H]2CCN(CCc3ccccc3)C2)CCCCC1	ZINC000819016359	DF	On-Demand	Anodyne	OPRM1	20	43
OC1(CNC[C@@H]2CCN(CCc3ccccc3)C2)CCCCC1	ZINC000819016359	DF	On-Demand	Anodyne	OPRK1	15	43
OC1(CNC[C@@H]2CCN(CCc3ccccc3)C2)CCCCC1	ZINC000819016359	DF	On-Demand	Anodyne	HTR4	15	40
OC1(CNC[C@@H]2CCN(CCc3ccccc3)C2)CCCCC1	ZINC000819016359	DF	On-Demand	Anodyne	SIGMAR1	46	45
OC1(CNC[C@@H]2CCN(CCc3ccccc3)C2)CCCCC1	ZINC000819016359	DF	On-Demand	Anodyne	BIRC2	27	40
OC1(CNC[C@H]2CCN(CCc3ccccc3)C2)CCCCC1	ZINC000819016365	DF	On-Demand	Anodyne	ACHE	18	43
OC1(CNC[C@H]2CCN(CCc3ccccc3)C2)CCCCC1	ZINC000819016365	DF	On-Demand	Anodyne	OPRM1	20	43
OC1(CNC[C@H]2CCN(CCc3ccccc3)C2)CCCCC1	ZINC000819016365	DF	On-Demand	Anodyne	OPRK1	15	43
OC1(CNC[C@H]2CCN(CCc3ccccc3)C2)CCCCC1	ZINC000819016365	DF	On-Demand	Anodyne	HTR4	15	40
OC1(CNC[C@H]2CCN(CCc3ccccc3)C2)CCCCC1	ZINC000819016365	DF	On-Demand	Anodyne	SIGMAR1	46	45
OC1(CNC[C@H]2CCN(CCc3ccccc3)C2)CCCCC1	ZINC000819016365	DF	On-Demand	Anodyne	BIRC2	27	40
CON(C)C(=O)CCNCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000819016386	GG	On-Demand	Anodyne	CYP19A1	19	42
CON(C)C(=O)CCNCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000819016386	GG	On-Demand	Anodyne	CYP11B1	48	47
CON(C)C(=O)CCNCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000819016386	GG	On-Demand	Anodyne	TBXAS1	32	41
CON(C)C(=O)CCNCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000819016386	GG	On-Demand	Anodyne	CYP11B2	23	47
CCCc1ccc(NC(=O)[C@@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)cc1	ZINC000819016400	EG	On-Demand	Anodyne	CFTR	43	32
CCCc1ccc(NC(=O)[C@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)cc1	ZINC000819016402	EG	On-Demand	Anodyne	CFTR	43	32
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819016409	GH	On-Demand	Anodyne	SLC6A3	18	45
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819016409	GH	On-Demand	Anodyne	HTR4	17	43
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819016409	GH	On-Demand	Anodyne	SIGMAR1	26	47
NC(=O)C1CCC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819016410	DD	On-Demand	Bother	CACNA1C	47	36
NC(=O)C1CCC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819016410	DD	On-Demand	Bother	ADRB3	25	41
NC(=O)C1CCC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819016410	DD	On-Demand	Bother	CACNA1D	73	34
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819016411	GH	On-Demand	Anodyne	SLC6A3	18	45
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819016411	GH	On-Demand	Anodyne	HTR4	17	43
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819016411	GH	On-Demand	Anodyne	SIGMAR1	26	47
NC(=O)C1CCC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819016412	DD	On-Demand	Bother	CACNA1C	47	36
NC(=O)C1CCC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819016412	DD	On-Demand	Bother	ADRB3	25	41
NC(=O)C1CCC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819016412	DD	On-Demand	Bother	CACNA1D	73	34
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819016413	GH	On-Demand	Anodyne	SLC6A3	18	45
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819016413	GH	On-Demand	Anodyne	HTR4	17	43
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819016413	GH	On-Demand	Anodyne	SIGMAR1	26	47
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819016416	GH	On-Demand	Anodyne	SLC6A3	18	45
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819016416	GH	On-Demand	Anodyne	HTR4	17	43
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819016416	GH	On-Demand	Anodyne	SIGMAR1	26	47
CC(C)c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819016423	FI	On-Demand	Mild	PAPA1_CARPA	45	45
CC(C)c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819016423	FI	On-Demand	Mild	CTSK	24	44
CC(C)c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819016423	FI	On-Demand	Mild	CTSL	16	45
CC(C)c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819016423	FI	On-Demand	Mild	CTSS	15	47
CC(C)c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819016423	FI	On-Demand	Mild	FPR1	46	40
CC(C)c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819016425	FI	On-Demand	Mild	PAPA1_CARPA	45	45
CC(C)c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819016425	FI	On-Demand	Mild	CTSK	24	44
CC(C)c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819016425	FI	On-Demand	Mild	CTSL	16	45
CC(C)c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819016425	FI	On-Demand	Mild	CTSS	15	47
CC(C)c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819016425	FI	On-Demand	Mild	FPR1	46	40
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819016434	EF	On-Demand	Anodyne	ADRB2	85	51
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819016434	EF	On-Demand	Anodyne	ADRB1	107	51
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819016434	EF	On-Demand	Anodyne	ADRB3	135	51
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819016434	EF	On-Demand	Anodyne	LEF	49	38
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819016436	EF	On-Demand	Anodyne	ADRB2	85	51
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819016436	EF	On-Demand	Anodyne	ADRB1	107	51
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819016436	EF	On-Demand	Anodyne	ADRB3	135	51
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819016436	EF	On-Demand	Anodyne	LEF	49	38
NC(=O)C1CCC(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819016438	EE	On-Demand	Anodyne	ADRB3	24	40
NC(=O)C1CCC(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819016440	EE	On-Demand	Anodyne	ADRB3	24	40
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)c(F)c1	ZINC000819016445	FG	On-Demand	Anodyne	SLC6A4	15	49
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)c(F)c1	ZINC000819016445	FG	On-Demand	Anodyne	SLC6A3	35	50
O[C@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)c(F)c1	ZINC000819016445	FG	On-Demand	Anodyne	SIGMAR1	30	53
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)c(F)c1	ZINC000819016447	FG	On-Demand	Anodyne	SLC6A4	15	49
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)c(F)c1	ZINC000819016447	FG	On-Demand	Anodyne	SLC6A3	35	50
O[C@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)c(F)c1	ZINC000819016447	FG	On-Demand	Anodyne	SIGMAR1	30	53
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)c(F)c1	ZINC000819016449	FG	On-Demand	Anodyne	SLC6A4	15	49
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)c(F)c1	ZINC000819016449	FG	On-Demand	Anodyne	SLC6A3	35	50
O[C@@H](CNC[C@H]1CCN(CCc2ccccc2)C1)c1ccc(F)c(F)c1	ZINC000819016449	FG	On-Demand	Anodyne	SIGMAR1	30	53
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)c(F)c1	ZINC000819016451	FG	On-Demand	Anodyne	SLC6A4	15	49
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)c(F)c1	ZINC000819016451	FG	On-Demand	Anodyne	SLC6A3	35	50
O[C@@H](CNC[C@@H]1CCN(CCc2ccccc2)C1)c1ccc(F)c(F)c1	ZINC000819016451	FG	On-Demand	Anodyne	SIGMAR1	30	53
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819016457	FH	On-Demand	Anodyne	ADRB2	81	48
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819016457	FH	On-Demand	Anodyne	ADRB1	109	51
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819016457	FH	On-Demand	Anodyne	ADRB3	128	51
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819016459	FH	On-Demand	Anodyne	ADRB2	81	48
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819016459	FH	On-Demand	Anodyne	ADRB1	109	51
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819016459	FH	On-Demand	Anodyne	ADRB3	128	51
N#Cc1ccc([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016469	EF	On-Demand	Mild	SLC6A3	18	45
N#Cc1ccc([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016469	EF	On-Demand	Mild	SIGMAR1	25	51
N#Cc1ccc([C@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016469	EF	On-Demand	Mild	CCR3	16	40
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819016474	DE	On-Demand	Anodyne	ADRB2	65	50
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819016474	DE	On-Demand	Anodyne	ADRB1	87	50
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819016474	DE	On-Demand	Anodyne	ADRB3	153	50
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819016475	DE	On-Demand	Anodyne	ADRB2	65	50
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819016475	DE	On-Demand	Anodyne	ADRB1	87	50
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819016475	DE	On-Demand	Anodyne	ADRB3	153	50
N#Cc1ccc([C@@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016478	EF	On-Demand	Mild	SLC6A3	18	45
N#Cc1ccc([C@@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016478	EF	On-Demand	Mild	SIGMAR1	25	51
N#Cc1ccc([C@@H](O)CNC[C@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016478	EF	On-Demand	Mild	CCR3	16	40
N#Cc1ccc([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016480	EF	On-Demand	Mild	SLC6A3	18	45
N#Cc1ccc([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016480	EF	On-Demand	Mild	SIGMAR1	25	51
N#Cc1ccc([C@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016480	EF	On-Demand	Mild	CCR3	16	40
N#Cc1ccc([C@@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016482	EF	On-Demand	Mild	SLC6A3	18	45
N#Cc1ccc([C@@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016482	EF	On-Demand	Mild	SIGMAR1	25	51
N#Cc1ccc([C@@H](O)CNC[C@@H]2CCN(CCc3ccccc3)C2)cc1	ZINC000819016482	EF	On-Demand	Mild	CCR3	16	40
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819016487	EG	On-Demand	Anodyne	ADRB2	129	52
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819016487	EG	On-Demand	Anodyne	ADRB1	157	71
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819016487	EG	On-Demand	Anodyne	ADRB3	231	71
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819016488	EG	On-Demand	Anodyne	ADRB2	129	52
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819016488	EG	On-Demand	Anodyne	ADRB1	157	71
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819016488	EG	On-Demand	Anodyne	ADRB3	231	71
N#CCCCCNC[C@@H](O)c1cccc(F)c1	ZINC000819016492	BE	On-Demand	Mild	ADRB1	37	44
N#CCCCCNC[C@@H](O)c1cccc(F)c1	ZINC000819016492	BE	On-Demand	Mild	ADRB3	40	44
N#CCCCCNC[C@H](O)c1cccc(F)c1	ZINC000819016493	BE	On-Demand	Mild	ADRB1	37	44
N#CCCCCNC[C@H](O)c1cccc(F)c1	ZINC000819016493	BE	On-Demand	Mild	ADRB3	40	44
CC(=O)Nc1ccc(CCNC[C@H](O)C2CC2)cc1	ZINC000819016500	CD	On-Demand	Anodyne	ADRB2	52	54
CC(=O)Nc1ccc(CCNC[C@H](O)C2CC2)cc1	ZINC000819016500	CD	On-Demand	Anodyne	ADRB1	79	54
CC(=O)Nc1ccc(CCNC[C@H](O)C2CC2)cc1	ZINC000819016500	CD	On-Demand	Anodyne	ADRB3	110	54
CC(=O)Nc1ccc(CCNC[C@@H](O)C2CC2)cc1	ZINC000819016501	CD	On-Demand	Anodyne	ADRB2	52	54
CC(=O)Nc1ccc(CCNC[C@@H](O)C2CC2)cc1	ZINC000819016501	CD	On-Demand	Anodyne	ADRB1	79	54
CC(=O)Nc1ccc(CCNC[C@@H](O)C2CC2)cc1	ZINC000819016501	CD	On-Demand	Anodyne	ADRB3	110	54
N#CCCCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819016518	CD	On-Demand	Mild	ADRB3	41	37
N#CCCCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819016519	CD	On-Demand	Mild	ADRB3	41	37
O=C(/C=C\[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	ZINC000819016520	GD	On-Demand	Anodyne	AKR1C3	51	35
O=C(/C=C/[C@@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	ZINC000819016521	GD	On-Demand	Anodyne	AKR1C3	51	35
O=C(/C=C/[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	ZINC000819016522	GD	On-Demand	Anodyne	AKR1C3	51	35
O=C(/C=C\[C@H]1CCCO1)N1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	ZINC000819016523	GD	On-Demand	Anodyne	AKR1C3	51	35
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccccc2Br)cc1	ZINC000819016527	GG	On-Demand	Anodyne	ADRB2	90	50
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccccc2Br)cc1	ZINC000819016527	GG	On-Demand	Anodyne	ADRB1	109	50
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccccc2Br)cc1	ZINC000819016527	GG	On-Demand	Anodyne	ADRB3	161	50
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccccc2Br)cc1	ZINC000819016528	GG	On-Demand	Anodyne	ADRB2	90	50
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccccc2Br)cc1	ZINC000819016528	GG	On-Demand	Anodyne	ADRB1	109	50
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccccc2Br)cc1	ZINC000819016528	GG	On-Demand	Anodyne	ADRB3	161	50
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819016529	FG	On-Demand	Anodyne	ADRB2	85	48
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819016529	FG	On-Demand	Anodyne	ADRB1	101	49
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819016529	FG	On-Demand	Anodyne	GRIN1	15	47
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819016529	FG	On-Demand	Anodyne	ADRB3	170	49
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819016529	FG	On-Demand	Anodyne	ENV	40	34
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819016529	FG	On-Demand	Anodyne	IDO1	15	43
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819016530	FG	On-Demand	Anodyne	ADRB2	85	48
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819016530	FG	On-Demand	Anodyne	ADRB1	101	49
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819016530	FG	On-Demand	Anodyne	GRIN1	15	47
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819016530	FG	On-Demand	Anodyne	ADRB3	170	49
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819016530	FG	On-Demand	Anodyne	ENV	40	34
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819016530	FG	On-Demand	Anodyne	IDO1	15	43
N#CCCCCNC[C@@H](O)c1cccnc1	ZINC000819016531	BD	On-Demand	Mild	ADRB2	30	48
N#CCCCCNC[C@@H](O)c1cccnc1	ZINC000819016531	BD	On-Demand	Mild	ADRB1	38	48
N#CCCCCNC[C@@H](O)c1cccnc1	ZINC000819016531	BD	On-Demand	Mild	ADRB3	113	48
N#CCCCCNC[C@H](O)c1cccnc1	ZINC000819016532	BD	On-Demand	Mild	ADRB2	30	48
N#CCCCCNC[C@H](O)c1cccnc1	ZINC000819016532	BD	On-Demand	Mild	ADRB1	38	48
N#CCCCCNC[C@H](O)c1cccnc1	ZINC000819016532	BD	On-Demand	Mild	ADRB3	113	48
CC(=O)Nc1ccc(CCNCCC(=O)Nc2ccc(N(C)C)cc2)cc1	ZINC000819016534	FF	On-Demand	Anodyne	ADRB1	16	42
CC(=O)Nc1ccc(CCNCCC(=O)Nc2ccc(N(C)C)cc2)cc1	ZINC000819016534	FF	On-Demand	Anodyne	ADRB3	24	42
O=C(C(F)=C1CCC1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016535	DF	On-Demand	Anodyne	ESR1	62	36
O=C(C(F)=C1CCC1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016535	DF	On-Demand	Anodyne	ESR2	45	36
O=C(C(F)=C1CCC1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016535	DF	On-Demand	Anodyne	LTA4H	69	52
O=C(C(F)=C1CCC1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016535	DF	On-Demand	Anodyne	HRH3	43	51
O=C(C(F)=C1CCC1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016535	DF	On-Demand	Anodyne	PSMB2	44	41
O=C(C(F)=C1CCC1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016535	DF	On-Demand	Anodyne	PSMB1	49	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1ccccc1F	ZINC000819016543	DE	On-Demand	Anodyne	NQO2	21	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1ccccc1F	ZINC000819016543	DE	On-Demand	Anodyne	PAPA1_CARPA	28	46
O=C(CSc1ccccc1[N+](=O)[O-])OCc1cc(=O)oc2cc(O)ccc12	ZINC000819016548	GG	On-Demand	Bother	HSD17B3	37	49
C[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2ccccc21	ZINC000819016560	FH	On-Demand	Mild	GHRHR	48	35
C[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2ccccc21	ZINC000819016560	FH	On-Demand	Mild	PAPA1_CARPA	40	44
C[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2ccccc21	ZINC000819016560	FH	On-Demand	Mild	CTSK	17	40
C[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2ccccc21	ZINC000819016560	FH	On-Demand	Mild	PREP	15	43
C[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2ccccc21	ZINC000819016560	FH	On-Demand	Mild	FPR1	42	35
CC(=O)Nc1ccc(CCNC[C@H](O)CN(C)C(=O)OC(C)(C)C)cc1	ZINC000819016577	FE	On-Demand	Anodyne	ADRB2	38	53
CC(=O)Nc1ccc(CCNC[C@H](O)CN(C)C(=O)OC(C)(C)C)cc1	ZINC000819016577	FE	On-Demand	Anodyne	ADRB1	61	53
CC(=O)Nc1ccc(CCNC[C@H](O)CN(C)C(=O)OC(C)(C)C)cc1	ZINC000819016577	FE	On-Demand	Anodyne	ADRB3	75	53
CC(=O)Nc1ccc(CCNC[C@@H](O)CN(C)C(=O)OC(C)(C)C)cc1	ZINC000819016578	FE	On-Demand	Anodyne	ADRB2	38	53
CC(=O)Nc1ccc(CCNC[C@@H](O)CN(C)C(=O)OC(C)(C)C)cc1	ZINC000819016578	FE	On-Demand	Anodyne	ADRB1	61	53
CC(=O)Nc1ccc(CCNC[C@@H](O)CN(C)C(=O)OC(C)(C)C)cc1	ZINC000819016578	FE	On-Demand	Anodyne	ADRB3	75	53
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016579	ED	On-Demand	Anodyne	ESR1	55	37
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016579	ED	On-Demand	Anodyne	SLC6A1	45	35
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016579	ED	On-Demand	Anodyne	ESR2	41	39
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016579	ED	On-Demand	Anodyne	LTA4H	65	44
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016579	ED	On-Demand	Anodyne	HRH3	52	44
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016579	ED	On-Demand	Anodyne	CPT1A	49	33
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016579	ED	On-Demand	Anodyne	CYP2J2	43	30
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016579	ED	On-Demand	Anodyne	PSMB2	43	42
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016579	ED	On-Demand	Anodyne	PSMB1	47	44
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016580	ED	On-Demand	Anodyne	ESR1	55	37
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016580	ED	On-Demand	Anodyne	SLC6A1	45	35
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016580	ED	On-Demand	Anodyne	ESR2	41	39
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016580	ED	On-Demand	Anodyne	LTA4H	65	44
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016580	ED	On-Demand	Anodyne	HRH3	52	44
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016580	ED	On-Demand	Anodyne	CPT1A	49	33
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016580	ED	On-Demand	Anodyne	CYP2J2	43	30
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016580	ED	On-Demand	Anodyne	PSMB2	43	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016580	ED	On-Demand	Anodyne	PSMB1	47	44
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016581	ED	On-Demand	Anodyne	ESR1	55	37
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016581	ED	On-Demand	Anodyne	SLC6A1	45	35
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016581	ED	On-Demand	Anodyne	ESR2	41	39
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016581	ED	On-Demand	Anodyne	LTA4H	65	44
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016581	ED	On-Demand	Anodyne	HRH3	52	44
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016581	ED	On-Demand	Anodyne	CPT1A	49	33
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016581	ED	On-Demand	Anodyne	CYP2J2	43	30
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016581	ED	On-Demand	Anodyne	PSMB2	43	42
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016581	ED	On-Demand	Anodyne	PSMB1	47	44
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016582	ED	On-Demand	Anodyne	ESR1	55	37
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016582	ED	On-Demand	Anodyne	SLC6A1	45	35
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016582	ED	On-Demand	Anodyne	ESR2	41	39
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016582	ED	On-Demand	Anodyne	LTA4H	65	44
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016582	ED	On-Demand	Anodyne	HRH3	52	44
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016582	ED	On-Demand	Anodyne	CPT1A	49	33
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016582	ED	On-Demand	Anodyne	CYP2J2	43	30
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016582	ED	On-Demand	Anodyne	PSMB2	43	42
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCOc2ccccc2)CC1	ZINC000819016582	ED	On-Demand	Anodyne	PSMB1	47	44
CN(Cc1ccc(Cl)s1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819016602	GH	On-Demand	Mild	PAPA1_CARPA	44	41
CN(Cc1ccc(Cl)s1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819016603	GH	On-Demand	Mild	PAPA1_CARPA	44	41
NC(=O)C1CCN(c2ncccc2CNC[C@@H](O)c2ccccc2)CC1	ZINC000819016649	FD	On-Demand	Anodyne	ADRB3	53	38
NC(=O)C1CCN(c2ncccc2CNC[C@@H](O)c2ccccc2)CC1	ZINC000819016649	FD	On-Demand	Anodyne	SCD1	15	43
NC(=O)C1CCN(c2ncccc2CNC[C@@H](O)c2ccccc2)CC1	ZINC000819016649	FD	On-Demand	Anodyne	SCD	31	43
NC(=O)C1CCN(c2ncccc2CNC[C@H](O)c2ccccc2)CC1	ZINC000819016650	FD	On-Demand	Anodyne	ADRB3	53	38
NC(=O)C1CCN(c2ncccc2CNC[C@H](O)c2ccccc2)CC1	ZINC000819016650	FD	On-Demand	Anodyne	SCD1	15	43
NC(=O)C1CCN(c2ncccc2CNC[C@H](O)c2ccccc2)CC1	ZINC000819016650	FD	On-Demand	Anodyne	SCD	31	43
N#CCCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819016653	CF	On-Demand	Mild	ADRB2	51	43
N#CCCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819016653	CF	On-Demand	Mild	ADRB1	59	51
N#CCCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819016653	CF	On-Demand	Mild	ADRB3	67	51
N#CCCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819016654	CF	On-Demand	Mild	ADRB2	51	43
N#CCCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819016654	CF	On-Demand	Mild	ADRB1	59	51
N#CCCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819016654	CF	On-Demand	Mild	ADRB3	67	51
CC(C)c1ccc([C@H](CNCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819016656	EH	On-Demand	Mild	PAPA1_CARPA	39	41
CC(C)c1ccc([C@@H](CNCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819016657	EH	On-Demand	Mild	PAPA1_CARPA	39	41
Cc1ccccc1[C@@H](O)CNCc1cccnc1N1CCC(C(N)=O)CC1	ZINC000819016664	FD	On-Demand	Anodyne	SCD	17	40
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819016671	GG	On-Demand	Anodyne	ADRB2	83	48
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819016671	GG	On-Demand	Anodyne	ADRB1	97	47
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819016671	GG	On-Demand	Anodyne	ADRB3	163	47
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819016671	GG	On-Demand	Anodyne	LEF	47	35
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819016671	GG	On-Demand	Anodyne	IDO1	15	43
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819016672	GG	On-Demand	Anodyne	ADRB2	83	48
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819016672	GG	On-Demand	Anodyne	ADRB1	97	47
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819016672	GG	On-Demand	Anodyne	ADRB3	163	47
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819016672	GG	On-Demand	Anodyne	LEF	47	35
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819016672	GG	On-Demand	Anodyne	IDO1	15	43
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)cc2C)cc1	ZINC000819016689	EF	On-Demand	Anodyne	ADRB2	77	47
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)cc2C)cc1	ZINC000819016689	EF	On-Demand	Anodyne	ADRB1	96	47
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)cc2C)cc1	ZINC000819016689	EF	On-Demand	Anodyne	ADRB3	124	47
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)cc2C)cc1	ZINC000819016689	EF	On-Demand	Anodyne	LEF	69	42
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)cc2C)cc1	ZINC000819016690	EF	On-Demand	Anodyne	ADRB2	77	47
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)cc2C)cc1	ZINC000819016690	EF	On-Demand	Anodyne	ADRB1	96	47
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)cc2C)cc1	ZINC000819016690	EF	On-Demand	Anodyne	ADRB3	124	47
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)cc2C)cc1	ZINC000819016690	EF	On-Demand	Anodyne	LEF	69	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1nc(-c3ccccc3)cs1)C2	ZINC000819016718	FH	On-Demand	Anodyne	ROCK1	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1nc(-c3ccccc3)cs1)C2	ZINC000819016721	FH	On-Demand	Anodyne	ROCK1	20	40
NC(=O)C1CCN(c2ncccc2CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819016722	FD	On-Demand	Anodyne	SCD	15	45
NC(=O)C1CCN(c2ncccc2CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819016725	FD	On-Demand	Anodyne	SCD	15	45
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(OCCN(C)C)cc1	ZINC000819016752	FF	On-Demand	Anodyne	ADRB2	60	44
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(OCCN(C)C)cc1	ZINC000819016752	FF	On-Demand	Anodyne	ADRB1	78	44
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(OCCN(C)C)cc1	ZINC000819016752	FF	On-Demand	Anodyne	ADRB3	66	39
CC(=O)Nc1ccc(CCNCCS(C)(=O)=O)cc1	ZINC000819016753	CC	On-Demand	Anodyne	CA2	19	52
CC(=O)Nc1ccc(CCNCCS(C)(=O)=O)cc1	ZINC000819016753	CC	On-Demand	Anodyne	ADRB2	19	46
CC(=O)Nc1ccc(CCNCCS(C)(=O)=O)cc1	ZINC000819016753	CC	On-Demand	Anodyne	ADRB1	31	46
CC(=O)Nc1ccc(CCNCCS(C)(=O)=O)cc1	ZINC000819016753	CC	On-Demand	Anodyne	ADRB3	49	46
CC(=O)Nc1ccc(CCNCCS(C)(=O)=O)cc1	ZINC000819016753	CC	On-Demand	Anodyne	CA1	21	52
CC(=O)Nc1ccc(CCNCCS(C)(=O)=O)cc1	ZINC000819016753	CC	On-Demand	Anodyne	CA12	16	44
CC(=O)Nc1ccc(CCNCCS(C)(=O)=O)cc1	ZINC000819016753	CC	On-Demand	Anodyne	CA9	17	44
CC(=O)Nc1ccc(CCNCCS(C)(=O)=O)cc1	ZINC000819016753	CC	On-Demand	Anodyne	RORC	16	40
N#CCCCCNC[C@@H](O)c1ccc(F)cc1	ZINC000819016756	BE	On-Demand	Mild	ADRB2	21	40
N#CCCCCNC[C@H](O)c1ccc(F)cc1	ZINC000819016757	BE	On-Demand	Mild	ADRB2	21	40
CN(C)CCOc1ccc(CCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819016777	FF	On-Demand	Anodyne	ADRB2	64	43
CN(C)CCOc1ccc(CCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819016777	FF	On-Demand	Anodyne	ADRB1	92	45
CN(C)CCOc1ccc(CCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819016777	FF	On-Demand	Anodyne	ADRB3	93	44
CN(C)CCOc1ccc(CCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819016777	FF	On-Demand	Anodyne	ESRRG	45	34
CN(C)CCOc1ccc(CCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819016778	FF	On-Demand	Anodyne	ADRB2	64	43
CN(C)CCOc1ccc(CCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819016778	FF	On-Demand	Anodyne	ADRB1	92	45
CN(C)CCOc1ccc(CCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819016778	FF	On-Demand	Anodyne	ADRB3	93	44
CN(C)CCOc1ccc(CCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819016778	FF	On-Demand	Anodyne	ESRRG	45	34
CON(C)C(=O)CCNCCOc1cccc(NC(C)=O)c1	ZINC000819016779	DD	On-Demand	Anodyne	MTNR1A	33	46
CON(C)C(=O)CCNCCOc1cccc(NC(C)=O)c1	ZINC000819016779	DD	On-Demand	Anodyne	MTNR1B	35	46
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)N(C)C1CCCCC1	ZINC000819016784	GG	On-Demand	Bother	COLA	42	35
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2)c1	ZINC000819016803	DE	On-Demand	Anodyne	ADRB2	71	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2)c1	ZINC000819016803	DE	On-Demand	Anodyne	ADRB1	106	52
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2)c1	ZINC000819016803	DE	On-Demand	Anodyne	DRD4	16	42
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2)c1	ZINC000819016803	DE	On-Demand	Anodyne	ADRB3	133	52
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2)c1	ZINC000819016803	DE	On-Demand	Anodyne	MTNR1A	30	44
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2)c1	ZINC000819016803	DE	On-Demand	Anodyne	MTNR1B	31	44
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2)c1	ZINC000819016803	DE	On-Demand	Anodyne	EPHX2	20	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2)c1	ZINC000819016803	DE	On-Demand	Anodyne	KCNK3	54	36
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2)c1	ZINC000819016803	DE	On-Demand	Anodyne	KCNK9	48	33
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2)c1	ZINC000819016803	DE	On-Demand	Anodyne	PDS	53	35
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2)c1	ZINC000819016804	DE	On-Demand	Anodyne	ADRB2	71	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2)c1	ZINC000819016804	DE	On-Demand	Anodyne	ADRB1	106	52
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2)c1	ZINC000819016804	DE	On-Demand	Anodyne	DRD4	16	42
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2)c1	ZINC000819016804	DE	On-Demand	Anodyne	ADRB3	133	52
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2)c1	ZINC000819016804	DE	On-Demand	Anodyne	MTNR1A	30	44
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2)c1	ZINC000819016804	DE	On-Demand	Anodyne	MTNR1B	31	44
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2)c1	ZINC000819016804	DE	On-Demand	Anodyne	EPHX2	20	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2)c1	ZINC000819016804	DE	On-Demand	Anodyne	KCNK3	54	36
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2)c1	ZINC000819016804	DE	On-Demand	Anodyne	KCNK9	48	33
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2)c1	ZINC000819016804	DE	On-Demand	Anodyne	PDS	53	35
Cc1ncsc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819016823	CE	On-Demand	Bother	CACNA1D	57	33
Cc1ncsc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819016824	CE	On-Demand	Bother	CACNA1D	57	33
O=C(CN1CCN(C(=O)C(F)=C2CCC2)CC1)Nc1ccccc1C(F)(F)F	ZINC000819016829	GG	On-Demand	Anodyne	RBP4	80	39
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819016842	DE	On-Demand	Mild	ADRB2	78	52
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819016842	DE	On-Demand	Mild	ADRB1	97	52
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819016842	DE	On-Demand	Mild	ADRB3	157	52
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819016843	DE	On-Demand	Mild	ADRB2	78	52
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819016843	DE	On-Demand	Mild	ADRB1	97	52
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819016843	DE	On-Demand	Mild	ADRB3	157	52
NC(=O)C1CCC(NC[C@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819016846	DE	On-Demand	Anodyne	ADRB3	26	44
NC(=O)C1CCC(NC[C@@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819016847	DE	On-Demand	Anodyne	ADRB3	26	44
N#CCCCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819016858	DF	On-Demand	Mild	ADRB3	22	42
N#CCCCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819016859	DF	On-Demand	Mild	ADRB3	22	42
N#CCCCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819016872	CF	On-Demand	Mild	ADRB2	22	43
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016879	FF	On-Demand	Anodyne	ESR1	63	34
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016879	FF	On-Demand	Anodyne	ESR2	44	36
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016879	FF	On-Demand	Anodyne	LTA4H	61	47
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016879	FF	On-Demand	Anodyne	HRH3	54	47
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016879	FF	On-Demand	Anodyne	EBP	17	48
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016879	FF	On-Demand	Anodyne	PSMB2	40	39
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016879	FF	On-Demand	Anodyne	PSMB1	44	39
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016880	FF	On-Demand	Anodyne	ESR1	63	34
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016880	FF	On-Demand	Anodyne	ESR2	44	36
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016880	FF	On-Demand	Anodyne	LTA4H	61	47
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016880	FF	On-Demand	Anodyne	HRH3	54	47
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016880	FF	On-Demand	Anodyne	EBP	17	48
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016880	FF	On-Demand	Anodyne	PSMB2	40	39
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016880	FF	On-Demand	Anodyne	PSMB1	44	39
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016881	FF	On-Demand	Anodyne	ESR1	63	34
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016881	FF	On-Demand	Anodyne	ESR2	44	36
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016881	FF	On-Demand	Anodyne	LTA4H	61	47
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016881	FF	On-Demand	Anodyne	HRH3	54	47
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016881	FF	On-Demand	Anodyne	EBP	17	48
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016881	FF	On-Demand	Anodyne	PSMB2	40	39
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016881	FF	On-Demand	Anodyne	PSMB1	44	39
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016882	FF	On-Demand	Anodyne	ESR1	63	34
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016882	FF	On-Demand	Anodyne	ESR2	44	36
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016882	FF	On-Demand	Anodyne	LTA4H	61	47
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016882	FF	On-Demand	Anodyne	HRH3	54	47
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016882	FF	On-Demand	Anodyne	EBP	17	48
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016882	FF	On-Demand	Anodyne	PSMB2	40	39
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819016882	FF	On-Demand	Anodyne	PSMB1	44	39
NC(=O)C1CCN(c2ncccc2CNC[C@@H](O)c2ccccc2F)CC1	ZINC000819016883	FD	On-Demand	Anodyne	SCD	19	44
NC(=O)C1CCN(c2ncccc2CNC[C@H](O)c2ccccc2F)CC1	ZINC000819016884	FD	On-Demand	Anodyne	SCD	19	44
NC(=O)C1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819016887	CE	On-Demand	Anodyne	ADRB2	15	43
NC(=O)C1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819016887	CE	On-Demand	Anodyne	ADRB1	45	50
NC(=O)C1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819016887	CE	On-Demand	Anodyne	ADRB3	64	55
NC(=O)C1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819016887	CE	On-Demand	Anodyne	CYP3A4	49	39
NC(=O)C1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819016888	CE	On-Demand	Anodyne	ADRB2	15	43
NC(=O)C1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819016888	CE	On-Demand	Anodyne	ADRB1	45	50
NC(=O)C1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819016888	CE	On-Demand	Anodyne	ADRB3	64	55
NC(=O)C1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819016888	CE	On-Demand	Anodyne	CYP3A4	49	39
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819016889	FH	On-Demand	Anodyne	ADRB2	91	49
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819016889	FH	On-Demand	Anodyne	ADRB1	110	53
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819016889	FH	On-Demand	Anodyne	ADRB3	186	53
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819016890	FH	On-Demand	Anodyne	ADRB2	91	49
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819016890	FH	On-Demand	Anodyne	ADRB1	110	53
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819016890	FH	On-Demand	Anodyne	ADRB3	186	53
NC(=O)C1CCC(NC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819016908	EE	On-Demand	Anodyne	SFRP1	51	36
NC(=O)C1CCC(NC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819016909	EE	On-Demand	Anodyne	SFRP1	51	36
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819016917	FG	On-Demand	Anodyne	ADRB2	75	47
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819016917	FG	On-Demand	Anodyne	ADRB1	98	47
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819016917	FG	On-Demand	Anodyne	ADRB3	118	47
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819016918	FG	On-Demand	Anodyne	ADRB2	75	47
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819016918	FG	On-Demand	Anodyne	ADRB1	98	47
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819016918	FG	On-Demand	Anodyne	ADRB3	118	47
COc1ccc(OC)c([C@H](O)CNCCc2ccc(NC(C)=O)cc2)c1	ZINC000819016929	FF	On-Demand	Anodyne	ADRB2	92	61
COc1ccc(OC)c([C@H](O)CNCCc2ccc(NC(C)=O)cc2)c1	ZINC000819016929	FF	On-Demand	Anodyne	ADRB1	117	53
COc1ccc(OC)c([C@H](O)CNCCc2ccc(NC(C)=O)cc2)c1	ZINC000819016929	FF	On-Demand	Anodyne	TSHR	61	34
COc1ccc(OC)c([C@H](O)CNCCc2ccc(NC(C)=O)cc2)c1	ZINC000819016929	FF	On-Demand	Anodyne	INHA	15	40
COc1ccc(OC)c([C@H](O)CNCCc2ccc(NC(C)=O)cc2)c1	ZINC000819016929	FF	On-Demand	Anodyne	ADRB3	133	53
COc1ccc(OC)c([C@H](O)CNCCc2ccc(NC(C)=O)cc2)c1	ZINC000819016929	FF	On-Demand	Anodyne	MTNR1A	65	44
COc1ccc(OC)c([C@H](O)CNCCc2ccc(NC(C)=O)cc2)c1	ZINC000819016929	FF	On-Demand	Anodyne	MTNR1B	64	43
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc2ccccc2o1	ZINC000819016942	GE	On-Demand	Anodyne	HTR1A	59	52
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc2ccccc2o1	ZINC000819016942	GE	On-Demand	Anodyne	DRD2	57	45
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc2ccccc2o1	ZINC000819016942	GE	On-Demand	Anodyne	DRD4	38	43
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc2ccccc2o1	ZINC000819016942	GE	On-Demand	Anodyne	HTR2A	36	47
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc2ccccc2o1	ZINC000819016942	GE	On-Demand	Anodyne	ADRA1A	17	43
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc2ccccc2o1	ZINC000819016942	GE	On-Demand	Anodyne	DRD3	72	47
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc2ccccc2o1	ZINC000819016942	GE	On-Demand	Anodyne	HTR7	44	43
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819016972	FE	On-Demand	Mild	ADRB2	63	47
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819016972	FE	On-Demand	Mild	ADRB1	85	43
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819016972	FE	On-Demand	Mild	ADRB3	93	47
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819016976	FE	On-Demand	Mild	ADRB2	63	47
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819016976	FE	On-Demand	Mild	ADRB1	85	43
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819016976	FE	On-Demand	Mild	ADRB3	93	47
COc1ccc(CN(C)C(=O)CCc2cccc(OC(F)F)c2)cc1F	ZINC000819016982	FI	On-Demand	Anodyne	HSD17B2	17	40
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1Cl	ZINC000819016990	GE	On-Demand	Anodyne	HTR1A	79	54
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1Cl	ZINC000819016990	GE	On-Demand	Anodyne	DRD2	75	47
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1Cl	ZINC000819016990	GE	On-Demand	Anodyne	DRD1	20	44
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1Cl	ZINC000819016990	GE	On-Demand	Anodyne	DRD4	52	44
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1Cl	ZINC000819016990	GE	On-Demand	Anodyne	ADRA1D	17	42
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1Cl	ZINC000819016990	GE	On-Demand	Anodyne	HTR2A	59	44
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1Cl	ZINC000819016990	GE	On-Demand	Anodyne	HTR2C	31	43
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1Cl	ZINC000819016990	GE	On-Demand	Anodyne	ADRA1A	23	47
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1Cl	ZINC000819016990	GE	On-Demand	Anodyne	DRD3	86	47
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1Cl	ZINC000819016990	GE	On-Demand	Anodyne	HTR7	56	44
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1Cl	ZINC000819016990	GE	On-Demand	Anodyne	HNMT	50	35
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819016998	FF	On-Demand	Anodyne	ADRB2	49	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819016998	FF	On-Demand	Anodyne	ADRB1	64	45
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819016998	FF	On-Demand	Anodyne	ADRB3	81	45
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819016998	FF	On-Demand	Anodyne	MTNR1A	18	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819016998	FF	On-Demand	Anodyne	MTNR1B	18	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819016998	FF	On-Demand	Anodyne	EPHX2	17	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819017000	FF	On-Demand	Anodyne	ADRB2	49	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819017000	FF	On-Demand	Anodyne	ADRB1	64	45
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819017000	FF	On-Demand	Anodyne	ADRB3	81	45
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819017000	FF	On-Demand	Anodyne	MTNR1A	18	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819017000	FF	On-Demand	Anodyne	MTNR1B	18	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819017000	FF	On-Demand	Anodyne	EPHX2	17	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819017015	FD	On-Demand	Reactive	CCKAR	57	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819017015	FD	On-Demand	Reactive	CCKBR	47	37
CCC(CC)CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819017017	CF	On-Demand	Bother	CACNA1D	61	34
CCC(CC)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819017018	CF	On-Demand	Bother	CACNA1D	61	34
CC(C)(C)CCCCNC[C@H](O)c1cccnc1	ZINC000819017028	CF	On-Demand	Anodyne	ADRB2	32	49
CC(C)(C)CCCCNC[C@H](O)c1cccnc1	ZINC000819017028	CF	On-Demand	Anodyne	ADRB1	43	48
CC(C)(C)CCCCNC[C@H](O)c1cccnc1	ZINC000819017028	CF	On-Demand	Anodyne	ADRB3	119	49
CC(C)(C)CCCCNC[C@@H](O)c1cccnc1	ZINC000819017030	CF	On-Demand	Anodyne	ADRB2	32	49
CC(C)(C)CCCCNC[C@@H](O)c1cccnc1	ZINC000819017030	CF	On-Demand	Anodyne	ADRB1	43	48
CC(C)(C)CCCCNC[C@@H](O)c1cccnc1	ZINC000819017030	CF	On-Demand	Anodyne	ADRB3	119	49
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccccc2F)cc1	ZINC000819017031	EF	On-Demand	Anodyne	ADRB2	73	45
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccccc2F)cc1	ZINC000819017031	EF	On-Demand	Anodyne	ADRB1	101	43
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccccc2F)cc1	ZINC000819017031	EF	On-Demand	Anodyne	ADRB3	91	45
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccccc2F)cc1	ZINC000819017031	EF	On-Demand	Anodyne	LTA4H	19	45
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccccc2F)cc1	ZINC000819017031	EF	On-Demand	Anodyne	ESRRG	47	35
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819017033	EF	On-Demand	Anodyne	ADRB2	73	45
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819017033	EF	On-Demand	Anodyne	ADRB1	101	43
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819017033	EF	On-Demand	Anodyne	ADRB3	91	45
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819017033	EF	On-Demand	Anodyne	LTA4H	19	45
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819017033	EF	On-Demand	Anodyne	ESRRG	47	35
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCN(C)CC2)cc1	ZINC000819017039	DF	On-Demand	Mild	LCK	18	41
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCN(C)CC2)cc1	ZINC000819017039	DF	On-Demand	Mild	PRNP	42	51
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCN(C)CC2)cc1	ZINC000819017039	DF	On-Demand	Mild	FLT3	15	40
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCN(C)CC2)cc1	ZINC000819017039	DF	On-Demand	Mild	AURKA	15	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819017043	GG	On-Demand	Anodyne	ADRB1	52	42
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819017043	GG	On-Demand	Anodyne	ADRB3	46	42
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819017043	GG	On-Demand	Anodyne	TAAR1	22	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819017043	GG	On-Demand	Anodyne	KCNK3	49	44
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819017043	GG	On-Demand	Anodyne	KCNK9	43	44
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819017043	GG	On-Demand	Anodyne	PDS	49	37
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819017045	GG	On-Demand	Anodyne	ADRB1	52	42
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819017045	GG	On-Demand	Anodyne	ADRB3	46	42
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819017045	GG	On-Demand	Anodyne	TAAR1	22	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819017045	GG	On-Demand	Anodyne	KCNK3	49	44
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819017045	GG	On-Demand	Anodyne	KCNK9	43	44
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819017045	GG	On-Demand	Anodyne	PDS	49	37
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCc2cc(F)ccc2F)CC1	ZINC000819017066	FG	On-Demand	Anodyne	DPP4	17	45
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCc2cc(F)ccc2F)CC1	ZINC000819017066	FG	On-Demand	Anodyne	GPR119	41	56
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCc2cc(F)ccc2F)CC1	ZINC000819017068	FG	On-Demand	Anodyne	DPP4	17	45
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCc2cc(F)ccc2F)CC1	ZINC000819017068	FG	On-Demand	Anodyne	GPR119	41	56
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819017069	EG	On-Demand	Anodyne	ADRB2	47	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819017069	EG	On-Demand	Anodyne	ADRB1	75	49
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819017069	EG	On-Demand	Anodyne	DRD4	15	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819017069	EG	On-Demand	Anodyne	ADRB3	89	49
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819017069	EG	On-Demand	Anodyne	MTNR1A	23	42
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819017069	EG	On-Demand	Anodyne	MTNR1B	22	42
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819017069	EG	On-Demand	Anodyne	EPHX2	19	42
COc1ccc(OC)c([C@H](O)CNCCOc2cccc(NC(C)=O)c2)c1	ZINC000819017073	FE	On-Demand	Anodyne	ADRB2	35	45
COc1ccc(OC)c([C@H](O)CNCCOc2cccc(NC(C)=O)c2)c1	ZINC000819017073	FE	On-Demand	Anodyne	ADRB1	53	45
COc1ccc(OC)c([C@H](O)CNCCOc2cccc(NC(C)=O)c2)c1	ZINC000819017073	FE	On-Demand	Anodyne	TSHR	40	29
COc1ccc(OC)c([C@H](O)CNCCOc2cccc(NC(C)=O)c2)c1	ZINC000819017073	FE	On-Demand	Anodyne	ADRB3	43	41
COc1ccc(OC)c([C@H](O)CNCCOc2cccc(NC(C)=O)c2)c1	ZINC000819017073	FE	On-Demand	Anodyne	MTNR1A	65	49
COc1ccc(OC)c([C@H](O)CNCCOc2cccc(NC(C)=O)c2)c1	ZINC000819017073	FE	On-Demand	Anodyne	MTNR1B	70	49
COc1ccc(OC)c([C@H](O)CNCCOc2cccc(NC(C)=O)c2)c1	ZINC000819017073	FE	On-Demand	Anodyne	KCNK3	49	39
COc1ccc(OC)c([C@H](O)CNCCOc2cccc(NC(C)=O)c2)c1	ZINC000819017073	FE	On-Demand	Anodyne	KCNK9	42	39
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cn1	ZINC000819017079	FD	On-Demand	Anodyne	HTR1A	45	52
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cn1	ZINC000819017079	FD	On-Demand	Anodyne	DRD2	40	52
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cn1	ZINC000819017079	FD	On-Demand	Anodyne	DRD4	31	52
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cn1	ZINC000819017079	FD	On-Demand	Anodyne	HTR2A	23	52
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cn1	ZINC000819017079	FD	On-Demand	Anodyne	ADRA1A	16	40
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cn1	ZINC000819017079	FD	On-Demand	Anodyne	DRD3	41	52
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cn1	ZINC000819017079	FD	On-Demand	Anodyne	HTR7	32	40
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cn1	ZINC000819017080	FD	On-Demand	Anodyne	HTR1A	45	52
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cn1	ZINC000819017080	FD	On-Demand	Anodyne	DRD2	40	52
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cn1	ZINC000819017080	FD	On-Demand	Anodyne	DRD4	31	52
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cn1	ZINC000819017080	FD	On-Demand	Anodyne	HTR2A	23	52
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cn1	ZINC000819017080	FD	On-Demand	Anodyne	ADRA1A	16	40
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cn1	ZINC000819017080	FD	On-Demand	Anodyne	DRD3	41	52
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cn1	ZINC000819017080	FD	On-Demand	Anodyne	HTR7	32	40
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCN(CC)CC2)cc1	ZINC000819017082	DG	On-Demand	Mild	PRNP	49	53
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)NC1CCCCC1	ZINC000819017083	FG	On-Demand	Bother	COLA	104	38
CON(C)C(=O)CCNCCCCN1CCN(c2ncccn2)CC1	ZINC000819017091	FC	On-Demand	Anodyne	HTR1A	73	51
CON(C)C(=O)CCNCCCCN1CCN(c2ncccn2)CC1	ZINC000819017091	FC	On-Demand	Anodyne	DRD2	59	47
CON(C)C(=O)CCNCCCCN1CCN(c2ncccn2)CC1	ZINC000819017091	FC	On-Demand	Anodyne	DRD4	49	46
CON(C)C(=O)CCNCCCCN1CCN(c2ncccn2)CC1	ZINC000819017091	FC	On-Demand	Anodyne	ADRA1D	32	40
CON(C)C(=O)CCNCCCCN1CCN(c2ncccn2)CC1	ZINC000819017091	FC	On-Demand	Anodyne	HTR2A	28	46
CON(C)C(=O)CCNCCCCN1CCN(c2ncccn2)CC1	ZINC000819017091	FC	On-Demand	Anodyne	ADRA1A	30	40
CON(C)C(=O)CCNCCCCN1CCN(c2ncccn2)CC1	ZINC000819017091	FC	On-Demand	Anodyne	DRD3	71	46
CON(C)C(=O)CCNCCCCN1CCN(c2ncccn2)CC1	ZINC000819017091	FC	On-Demand	Anodyne	HTR7	51	42
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017093	FG	On-Demand	Anodyne	ITGAL	49	34
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017093	FG	On-Demand	Anodyne	SIGMAR1	17	48
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017093	FG	On-Demand	Anodyne	CACNA1B	24	42
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017093	FG	On-Demand	Anodyne	FAAH	16	55
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017093	FG	On-Demand	Anodyne	CCR2	42	39
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017095	FG	On-Demand	Anodyne	ITGAL	49	34
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017095	FG	On-Demand	Anodyne	SIGMAR1	17	48
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017095	FG	On-Demand	Anodyne	CACNA1B	24	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017095	FG	On-Demand	Anodyne	FAAH	16	55
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017095	FG	On-Demand	Anodyne	CCR2	42	39
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017097	FG	On-Demand	Anodyne	ITGAL	49	34
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017097	FG	On-Demand	Anodyne	SIGMAR1	17	48
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017097	FG	On-Demand	Anodyne	CACNA1B	24	42
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017097	FG	On-Demand	Anodyne	FAAH	16	55
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017097	FG	On-Demand	Anodyne	CCR2	42	39
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017099	FG	On-Demand	Anodyne	ITGAL	49	34
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017099	FG	On-Demand	Anodyne	SIGMAR1	17	48
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017099	FG	On-Demand	Anodyne	CACNA1B	24	42
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017099	FG	On-Demand	Anodyne	FAAH	16	55
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819017099	FG	On-Demand	Anodyne	CCR2	42	39
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819017101	FG	On-Demand	Anodyne	ADRB2	79	43
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819017101	FG	On-Demand	Anodyne	ADRB1	109	48
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819017101	FG	On-Demand	Anodyne	ADRB3	91	45
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819017101	FG	On-Demand	Anodyne	LTA4H	17	45
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819017101	FG	On-Demand	Anodyne	ESRRG	48	35
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cc(F)ccc2F)CC1	ZINC000819017107	FG	On-Demand	Anodyne	DPP4	27	56
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cc(F)ccc2F)CC1	ZINC000819017107	FG	On-Demand	Anodyne	GPR119	62	74
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cc(F)ccc2F)CC1	ZINC000819017109	FG	On-Demand	Anodyne	DPP4	27	56
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cc(F)ccc2F)CC1	ZINC000819017109	FG	On-Demand	Anodyne	GPR119	62	74
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccnc1	ZINC000819017121	FD	On-Demand	Anodyne	ADRB2	32	45
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccnc1	ZINC000819017121	FD	On-Demand	Anodyne	ADRB1	32	45
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccnc1	ZINC000819017121	FD	On-Demand	Anodyne	HTR1A	45	52
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccnc1	ZINC000819017121	FD	On-Demand	Anodyne	DRD2	37	44
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccnc1	ZINC000819017121	FD	On-Demand	Anodyne	DRD4	24	44
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccnc1	ZINC000819017121	FD	On-Demand	Anodyne	HTR2A	22	44
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccnc1	ZINC000819017121	FD	On-Demand	Anodyne	DRD3	37	47
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccnc1	ZINC000819017121	FD	On-Demand	Anodyne	ADRB3	103	45
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccnc1	ZINC000819017121	FD	On-Demand	Anodyne	HTR7	20	44
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccnc1	ZINC000819017123	FD	On-Demand	Anodyne	ADRB2	32	45
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccnc1	ZINC000819017123	FD	On-Demand	Anodyne	ADRB1	32	45
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccnc1	ZINC000819017123	FD	On-Demand	Anodyne	HTR1A	45	52
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccnc1	ZINC000819017123	FD	On-Demand	Anodyne	DRD2	37	44
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccnc1	ZINC000819017123	FD	On-Demand	Anodyne	DRD4	24	44
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccnc1	ZINC000819017123	FD	On-Demand	Anodyne	HTR2A	22	44
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccnc1	ZINC000819017123	FD	On-Demand	Anodyne	DRD3	37	47
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccnc1	ZINC000819017123	FD	On-Demand	Anodyne	ADRB3	103	45
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccnc1	ZINC000819017123	FD	On-Demand	Anodyne	HTR7	20	44
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)N1CCCc2ccccc21	ZINC000819017125	HH	On-Demand	Bother	AVPR2	29	45
CN(CCNC[C@H](O)c1cccnc1)C1CCCC1	ZINC000819017130	CD	On-Demand	Anodyne	ADRB2	26	43
CN(CCNC[C@H](O)c1cccnc1)C1CCCC1	ZINC000819017130	CD	On-Demand	Anodyne	ADRB1	31	48
CN(CCNC[C@H](O)c1cccnc1)C1CCCC1	ZINC000819017130	CD	On-Demand	Anodyne	ADRB3	108	62
CN(CCNC[C@@H](O)c1cccnc1)C1CCCC1	ZINC000819017132	CD	On-Demand	Anodyne	ADRB2	26	43
CN(CCNC[C@@H](O)c1cccnc1)C1CCCC1	ZINC000819017132	CD	On-Demand	Anodyne	ADRB1	31	48
CN(CCNC[C@@H](O)c1cccnc1)C1CCCC1	ZINC000819017132	CD	On-Demand	Anodyne	ADRB3	108	62
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819017141	FH	On-Demand	Anodyne	ADRB2	78	50
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819017141	FH	On-Demand	Anodyne	ADRB1	91	49
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819017141	FH	On-Demand	Anodyne	ADRB3	161	49
CC(=O)Nc1ccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819017141	FH	On-Demand	Anodyne	EPHX2	18	42
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819017142	FH	On-Demand	Anodyne	ADRB2	78	50
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819017142	FH	On-Demand	Anodyne	ADRB1	91	49
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819017142	FH	On-Demand	Anodyne	ADRB3	161	49
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819017142	FH	On-Demand	Anodyne	EPHX2	18	42
NC(=O)C1CCN(c2ncccc2CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819017144	GE	On-Demand	Anodyne	ADRB1	45	43
NC(=O)C1CCN(c2ncccc2CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819017144	GE	On-Demand	Anodyne	ADRB3	67	43
NC(=O)C1CCN(c2ncccc2CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819017144	GE	On-Demand	Anodyne	SCN2A	17	41
NC(=O)C1CCN(c2ncccc2CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819017144	GE	On-Demand	Anodyne	SCN10A	18	41
NC(=O)C1CCN(c2ncccc2CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819017144	GE	On-Demand	Anodyne	CYP3A4	49	36
NC(=O)C1CCN(c2ncccc2CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819017145	GE	On-Demand	Anodyne	ADRB1	45	43
NC(=O)C1CCN(c2ncccc2CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819017145	GE	On-Demand	Anodyne	ADRB3	67	43
NC(=O)C1CCN(c2ncccc2CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819017145	GE	On-Demand	Anodyne	SCN2A	17	41
NC(=O)C1CCN(c2ncccc2CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819017145	GE	On-Demand	Anodyne	SCN10A	18	41
NC(=O)C1CCN(c2ncccc2CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819017145	GE	On-Demand	Anodyne	CYP3A4	49	36
CC(C)c1ccc([C@H](CNC[C@@H](C)O)NC(=O)OC(C)(C)C)cc1	ZINC000819017158	EG	On-Demand	Anodyne	CTSK	15	43
CC(C)c1ccc([C@@H](CNC[C@@H](C)O)NC(=O)OC(C)(C)C)cc1	ZINC000819017159	EG	On-Demand	Anodyne	CTSK	15	43
CC(C)c1ccc([C@@H](CNC[C@H](C)O)NC(=O)OC(C)(C)C)cc1	ZINC000819017160	EG	On-Demand	Anodyne	CTSK	15	43
CC(C)c1ccc([C@H](CNC[C@H](C)O)NC(=O)OC(C)(C)C)cc1	ZINC000819017161	EG	On-Demand	Anodyne	CTSK	15	43
CC(=O)Nc1ccc(CCNC[C@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819017164	EG	On-Demand	Anodyne	ADRB2	92	52
CC(=O)Nc1ccc(CCNC[C@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819017164	EG	On-Demand	Anodyne	ADRB1	105	52
CC(=O)Nc1ccc(CCNC[C@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819017164	EG	On-Demand	Anodyne	GNRHR	50	34
CC(=O)Nc1ccc(CCNC[C@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819017164	EG	On-Demand	Anodyne	ADRB3	174	53
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819017165	EG	On-Demand	Anodyne	ADRB2	92	52
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819017165	EG	On-Demand	Anodyne	ADRB1	105	52
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819017165	EG	On-Demand	Anodyne	GNRHR	50	34
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819017165	EG	On-Demand	Anodyne	ADRB3	174	53
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819017176	EG	On-Demand	Anodyne	ADRB2	76	47
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819017176	EG	On-Demand	Anodyne	ADRB1	91	47
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819017176	EG	On-Demand	Anodyne	ADRB3	142	47
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@H]1C	ZINC000819017184	HH	On-Demand	Bother	DRD4	19	41
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)N1c2ccccc2C[C@H]1C	ZINC000819017184	HH	On-Demand	Bother	TPP2	55	35
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(Br)cc1	ZINC000819017185	II	On-Demand	Bother	COLA	115	41
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819017187	EG	On-Demand	Anodyne	ADRB2	94	56
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819017187	EG	On-Demand	Anodyne	ADRB1	115	54
CC(=O)Nc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819017187	EG	On-Demand	Anodyne	ADRB3	182	54
O[C@H](CNCc1ccccc1-c1ccc(Cn2ccnc2)cc1)C1CC1	ZINC000819017188	EG	On-Demand	Anodyne	CYP19A1	20	42
O[C@H](CNCc1ccccc1-c1ccc(Cn2ccnc2)cc1)C1CC1	ZINC000819017188	EG	On-Demand	Anodyne	CYP11B1	52	51
O[C@H](CNCc1ccccc1-c1ccc(Cn2ccnc2)cc1)C1CC1	ZINC000819017188	EG	On-Demand	Anodyne	TBXAS1	15	42
O[C@H](CNCc1ccccc1-c1ccc(Cn2ccnc2)cc1)C1CC1	ZINC000819017188	EG	On-Demand	Anodyne	CYP11B2	25	51
O[C@@H](CNCc1ccccc1-c1ccc(Cn2ccnc2)cc1)C1CC1	ZINC000819017189	EG	On-Demand	Anodyne	CYP19A1	20	42
O[C@@H](CNCc1ccccc1-c1ccc(Cn2ccnc2)cc1)C1CC1	ZINC000819017189	EG	On-Demand	Anodyne	CYP11B1	52	51
O[C@@H](CNCc1ccccc1-c1ccc(Cn2ccnc2)cc1)C1CC1	ZINC000819017189	EG	On-Demand	Anodyne	TBXAS1	15	42
O[C@@H](CNCc1ccccc1-c1ccc(Cn2ccnc2)cc1)C1CC1	ZINC000819017189	EG	On-Demand	Anodyne	CYP11B2	25	51
CN(Cc1ccc2ccccc2c1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819017195	GI	On-Demand	Mild	CTSB	41	42
CN(Cc1ccc2ccccc2c1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819017195	GI	On-Demand	Mild	PAPA1_CARPA	58	60
CN(Cc1ccc2ccccc2c1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819017195	GI	On-Demand	Mild	CTSL	16	60
CN(Cc1ccc2ccccc2c1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819017195	GI	On-Demand	Mild	FPR1	44	37
CN(Cc1ccc2ccccc2c1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819017196	GI	On-Demand	Mild	CTSB	41	42
CN(Cc1ccc2ccccc2c1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819017196	GI	On-Demand	Mild	PAPA1_CARPA	58	60
CN(Cc1ccc2ccccc2c1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819017196	GI	On-Demand	Mild	CTSL	16	60
CN(Cc1ccc2ccccc2c1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819017196	GI	On-Demand	Mild	FPR1	44	37
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819017200	GG	On-Demand	Anodyne	ADRB2	102	52
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819017200	GG	On-Demand	Anodyne	ADRB1	121	53
CC(=O)Nc1ccc(CCNC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819017200	GG	On-Demand	Anodyne	ADRB3	195	53
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819017201	GG	On-Demand	Anodyne	ADRB2	102	52
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819017201	GG	On-Demand	Anodyne	ADRB1	121	53
CC(=O)Nc1ccc(CCNC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819017201	GG	On-Demand	Anodyne	ADRB3	195	53
CN(Cc1ccc2c(c1)OCO2)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819017211	GF	On-Demand	Mild	BMP1	58	43
CN(Cc1ccc2c(c1)OCO2)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819017211	GF	On-Demand	Mild	PAPA1_CARPA	47	41
CN(Cc1ccc2c(c1)OCO2)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819017212	GF	On-Demand	Mild	BMP1	58	43
CN(Cc1ccc2c(c1)OCO2)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819017212	GF	On-Demand	Mild	PAPA1_CARPA	47	41
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(N(C)C)cc1	ZINC000819017236	HG	On-Demand	Bother	COLA	112	39
C=CCCn1cc(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2)nn1	ZINC000819017257	FE	On-Demand	Mild	PRNP	49	52
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)c1ccc(Br)cc1	ZINC000819017264	HI	On-Demand	Bother	COLA	81	38
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)NC(c1ccccc1)c1ccccc1	ZINC000819017265	JJ	On-Demand	Bother	COLA	110	40
C=CCC1(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2)CCOCC1	ZINC000819017274	FG	On-Demand	Mild	PRNP	45	49
C=CCC1(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2)CCOCC1	ZINC000819017274	FG	On-Demand	Mild	MTOR	19	40
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCN(C)CC2)cc1	ZINC000819017295	DG	On-Demand	Anodyne	HTR1B	16	43
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCN(C)CC2)cc1	ZINC000819017295	DG	On-Demand	Anodyne	LCK	18	43
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCN(C)CC2)cc1	ZINC000819017295	DG	On-Demand	Anodyne	PRNP	40	48
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCN(C)CC2)cc1	ZINC000819017295	DG	On-Demand	Anodyne	MTOR	26	44
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCN(C)CC2)cc1	ZINC000819017295	DG	On-Demand	Anodyne	HCK	18	43
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCN(C)CC2)cc1	ZINC000819017295	DG	On-Demand	Anodyne	FLT3	15	40
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCN(C)CC2)cc1	ZINC000819017295	DG	On-Demand	Anodyne	CSF1R	15	40
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCN(C)CC2)cc1	ZINC000819017298	DG	On-Demand	Anodyne	HTR1B	16	43
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCN(C)CC2)cc1	ZINC000819017298	DG	On-Demand	Anodyne	LCK	18	43
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCN(C)CC2)cc1	ZINC000819017298	DG	On-Demand	Anodyne	PRNP	40	48
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCN(C)CC2)cc1	ZINC000819017298	DG	On-Demand	Anodyne	MTOR	26	44
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCN(C)CC2)cc1	ZINC000819017298	DG	On-Demand	Anodyne	HCK	18	43
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCN(C)CC2)cc1	ZINC000819017298	DG	On-Demand	Anodyne	FLT3	15	40
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCN(C)CC2)cc1	ZINC000819017298	DG	On-Demand	Anodyne	CSF1R	15	40
CCN(Cc1cccs1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819017299	FH	On-Demand	Mild	PAPA1_CARPA	46	56
CCN(Cc1cccs1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819017299	FH	On-Demand	Mild	CTSK	20	44
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000819017301	ID	On-Demand	Bother	CA2	67	46
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000819017301	ID	On-Demand	Bother	CA1	58	45
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000819017301	ID	On-Demand	Bother	CA7	30	46
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000819017301	ID	On-Demand	Bother	COLA	117	43
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000819017301	ID	On-Demand	Bother	CA4	49	42
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000819017301	ID	On-Demand	Bother	CA14	27	46
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000819017301	ID	On-Demand	Bother	CA12	46	42
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000819017301	ID	On-Demand	Bother	CA9	46	46
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000819017301	ID	On-Demand	Bother	MTCA1	45	40
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000819017301	ID	On-Demand	Bother	P96878_MYCTU	57	41
CCN(Cc1cccs1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819017302	FH	On-Demand	Mild	PAPA1_CARPA	46	56
CCN(Cc1cccs1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819017302	FH	On-Demand	Mild	CTSK	20	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(OC(F)F)cc1)C2	ZINC000819017303	FF	On-Demand	Anodyne	VHL	48	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(OC(F)F)cc1)C2	ZINC000819017305	FF	On-Demand	Anodyne	VHL	48	32
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1F	ZINC000819017321	GD	On-Demand	Anodyne	HTR1A	59	52
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1F	ZINC000819017321	GD	On-Demand	Anodyne	DRD2	57	52
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1F	ZINC000819017321	GD	On-Demand	Anodyne	DRD1	17	52
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1F	ZINC000819017321	GD	On-Demand	Anodyne	DRD4	44	52
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1F	ZINC000819017321	GD	On-Demand	Anodyne	HTR2A	45	52
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1F	ZINC000819017321	GD	On-Demand	Anodyne	ADRA1A	30	42
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1F	ZINC000819017321	GD	On-Demand	Anodyne	DRD3	58	52
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1F	ZINC000819017321	GD	On-Demand	Anodyne	HTR7	51	40
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1F	ZINC000819017321	GD	On-Demand	Anodyne	P2RX3	17	41
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1F	ZINC000819017325	GD	On-Demand	Anodyne	HTR1A	59	52
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1F	ZINC000819017325	GD	On-Demand	Anodyne	DRD2	57	52
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1F	ZINC000819017325	GD	On-Demand	Anodyne	DRD1	17	52
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1F	ZINC000819017325	GD	On-Demand	Anodyne	DRD4	44	52
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1F	ZINC000819017325	GD	On-Demand	Anodyne	HTR2A	45	52
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1F	ZINC000819017325	GD	On-Demand	Anodyne	ADRA1A	30	42
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1F	ZINC000819017325	GD	On-Demand	Anodyne	DRD3	58	52
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1F	ZINC000819017325	GD	On-Demand	Anodyne	HTR7	51	40
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cc(F)ccc1F	ZINC000819017325	GD	On-Demand	Anodyne	P2RX3	17	41
Cc1ncsc1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819017330	FF	On-Demand	Anodyne	GPR119	50	44
Cc1ncsc1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819017332	FF	On-Demand	Anodyne	GPR119	50	44
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819017341	GG	On-Demand	Anodyne	ADRB2	55	43
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819017341	GG	On-Demand	Anodyne	ADRB1	78	45
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819017341	GG	On-Demand	Anodyne	GRIN1	21	41
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819017341	GG	On-Demand	Anodyne	ADRB3	64	41
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819017342	GG	On-Demand	Anodyne	ADRB2	55	43
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819017342	GG	On-Demand	Anodyne	ADRB1	78	45
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819017342	GG	On-Demand	Anodyne	GRIN1	21	41
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819017342	GG	On-Demand	Anodyne	ADRB3	64	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819017347	FF	On-Demand	Anodyne	ADRB1	49	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819017347	FF	On-Demand	Anodyne	ADRB3	38	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819017347	FF	On-Demand	Anodyne	MTNR1A	20	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819017347	FF	On-Demand	Anodyne	MTNR1B	18	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819017349	FF	On-Demand	Anodyne	ADRB1	49	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819017349	FF	On-Demand	Anodyne	ADRB3	38	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819017349	FF	On-Demand	Anodyne	MTNR1A	20	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819017349	FF	On-Demand	Anodyne	MTNR1B	18	40
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017359	FD	On-Demand	Anodyne	HTR1A	75	56
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017359	FD	On-Demand	Anodyne	DRD2	71	49
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017359	FD	On-Demand	Anodyne	DRD1	16	49
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017359	FD	On-Demand	Anodyne	DRD4	55	49
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017359	FD	On-Demand	Anodyne	ADRA1D	18	42
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017359	FD	On-Demand	Anodyne	HTR2A	50	49
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017359	FD	On-Demand	Anodyne	HTR2C	24	43
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017359	FD	On-Demand	Anodyne	ADRA1A	23	49
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017359	FD	On-Demand	Anodyne	DRD3	77	50
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017359	FD	On-Demand	Anodyne	HTR7	54	44
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017359	FD	On-Demand	Anodyne	P2RX3	17	40
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017362	FD	On-Demand	Anodyne	HTR1A	75	56
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017362	FD	On-Demand	Anodyne	DRD2	71	49
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017362	FD	On-Demand	Anodyne	DRD1	16	49
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017362	FD	On-Demand	Anodyne	DRD4	55	49
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017362	FD	On-Demand	Anodyne	ADRA1D	18	42
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017362	FD	On-Demand	Anodyne	HTR2A	50	49
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017362	FD	On-Demand	Anodyne	HTR2C	24	43
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017362	FD	On-Demand	Anodyne	ADRA1A	23	49
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017362	FD	On-Demand	Anodyne	DRD3	77	50
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017362	FD	On-Demand	Anodyne	HTR7	54	44
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1F	ZINC000819017362	FD	On-Demand	Anodyne	P2RX3	17	40
CN(C)CCOc1ccc(CCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819017370	FG	On-Demand	Anodyne	ADRB2	103	55
CN(C)CCOc1ccc(CCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819017370	FG	On-Demand	Anodyne	ADRB1	143	68
CN(C)CCOc1ccc(CCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819017370	FG	On-Demand	Anodyne	GRIN1	20	44
CN(C)CCOc1ccc(CCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819017370	FG	On-Demand	Anodyne	ADRB3	177	64
CN(C)CCOc1ccc(CCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819017370	FG	On-Demand	Anodyne	ESRRG	45	33
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819017372	FG	On-Demand	Anodyne	ADRB2	103	55
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819017372	FG	On-Demand	Anodyne	ADRB1	143	68
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819017372	FG	On-Demand	Anodyne	GRIN1	20	44
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819017372	FG	On-Demand	Anodyne	ADRB3	177	64
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819017372	FG	On-Demand	Anodyne	ESRRG	45	33
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819017392	FF	On-Demand	Anodyne	ADRB2	72	48
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819017392	FF	On-Demand	Anodyne	ADRB1	96	49
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819017392	FF	On-Demand	Anodyne	ADRB3	116	45
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819017393	FF	On-Demand	Anodyne	ADRB2	72	48
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819017393	FF	On-Demand	Anodyne	ADRB1	96	49
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819017393	FF	On-Demand	Anodyne	ADRB3	116	45
CC(=O)Nc1cccc(OCCNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819017394	GF	On-Demand	Anodyne	MTNR1A	28	45
CC(=O)Nc1cccc(OCCNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819017394	GF	On-Demand	Anodyne	MTNR1B	31	45
CC(=O)Nc1cccc(OCCNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819017394	GF	On-Demand	Anodyne	EPHX2	16	43
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819017398	EF	On-Demand	Anodyne	ADRB2	76	48
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819017398	EF	On-Demand	Anodyne	ADRB1	99	45
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819017398	EF	On-Demand	Anodyne	ADRB3	116	49
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819017398	EF	On-Demand	Anodyne	ESRRG	43	32
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819017399	EF	On-Demand	Anodyne	ADRB2	76	48
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819017399	EF	On-Demand	Anodyne	ADRB1	99	45
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819017399	EF	On-Demand	Anodyne	ADRB3	116	49
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819017399	EF	On-Demand	Anodyne	ESRRG	43	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCOc3ccccc31)C2	ZINC000819017411	EE	On-Demand	Anodyne	XIAP	19	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCOc3ccccc31)C2	ZINC000819017411	EE	On-Demand	Anodyne	BIRC3	41	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCOc3ccccc31)C2	ZINC000819017411	EE	On-Demand	Anodyne	BIRC2	24	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCOc3ccccc31)C2	ZINC000819017412	EE	On-Demand	Anodyne	XIAP	19	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCOc3ccccc31)C2	ZINC000819017412	EE	On-Demand	Anodyne	BIRC3	41	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCOc3ccccc31)C2	ZINC000819017412	EE	On-Demand	Anodyne	BIRC2	24	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCOc3ccccc31)C2	ZINC000819017413	EE	On-Demand	Anodyne	XIAP	19	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCOc3ccccc31)C2	ZINC000819017413	EE	On-Demand	Anodyne	BIRC3	41	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCOc3ccccc31)C2	ZINC000819017413	EE	On-Demand	Anodyne	BIRC2	24	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCOc3ccccc31)C2	ZINC000819017414	EE	On-Demand	Anodyne	XIAP	19	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCOc3ccccc31)C2	ZINC000819017414	EE	On-Demand	Anodyne	BIRC3	41	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCOc3ccccc31)C2	ZINC000819017414	EE	On-Demand	Anodyne	BIRC2	24	42
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000819017501	HH	On-Demand	Bother	CNR2	17	43
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000819017501	HH	On-Demand	Bother	COLA	68	37
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000819017501	HH	On-Demand	Bother	EPHX2	56	41
COc1ccc(CN(C)C(=O)Cc2cccc(NC(C)=O)c2)cc1F	ZINC000819017509	EF	On-Demand	Anodyne	TSHR	54	34
CN(Cc1ccc2c(c1)OCO2)C(=O)C(F)=C1CCC1	ZINC000819017521	CF	On-Demand	Anodyne	BMP1	45	36
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819017564	DE	On-Demand	Anodyne	PIK3CA	17	41
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819017564	DE	On-Demand	Anodyne	MTOR	29	41
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819017566	DE	On-Demand	Anodyne	PIK3CA	17	41
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819017566	DE	On-Demand	Anodyne	MTOR	29	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819017567	DE	On-Demand	Anodyne	PIK3CA	17	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819017567	DE	On-Demand	Anodyne	MTOR	29	41
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819017568	DE	On-Demand	Anodyne	PIK3CA	17	41
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819017568	DE	On-Demand	Anodyne	MTOR	29	41
COc1ccc(CN(C)C(=O)c2cc(Br)c(C)s2)cc1F	ZINC000819017601	FI	On-Demand	Anodyne	HSD17B2	30	44
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819017607	EG	On-Demand	Anodyne	ADRB2	66	46
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819017607	EG	On-Demand	Anodyne	ADRB1	94	59
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819017607	EG	On-Demand	Anodyne	DRD4	15	44
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819017607	EG	On-Demand	Anodyne	HRH2	17	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819017607	EG	On-Demand	Anodyne	ADRB3	121	59
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819017607	EG	On-Demand	Anodyne	MTNR1A	22	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819017607	EG	On-Demand	Anodyne	MTNR1B	20	41
CN(CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C1CCCC1	ZINC000819017609	FE	On-Demand	Anodyne	GPR119	30	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819017610	EG	On-Demand	Anodyne	ADRB2	66	46
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819017610	EG	On-Demand	Anodyne	ADRB1	94	59
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819017610	EG	On-Demand	Anodyne	DRD4	15	44
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819017610	EG	On-Demand	Anodyne	HRH2	17	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819017610	EG	On-Demand	Anodyne	ADRB3	121	59
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819017610	EG	On-Demand	Anodyne	MTNR1A	22	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819017610	EG	On-Demand	Anodyne	MTNR1B	20	41
C=CCC1(C(=O)Nc2ccc(N3CCN(C)CC3)cc2)CCOCC1	ZINC000819017649	EF	On-Demand	Mild	PRNP	39	46
C=CCC1(C(=O)Nc2ccc(N3CCN(C)CC3)cc2)CCOCC1	ZINC000819017649	EF	On-Demand	Mild	MTOR	29	41
C=CCC1(C(=O)Nc2ccc(N3CCN(C)CC3)cc2)CCOCC1	ZINC000819017649	EF	On-Demand	Mild	STAT6	60	36
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)N(C)c1ccccc1	ZINC000819017652	FG	On-Demand	Bother	COLA	87	38
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccccc2)cc1	ZINC000819017654	EE	On-Demand	Anodyne	ADRB2	102	56
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccccc2)cc1	ZINC000819017654	EE	On-Demand	Anodyne	ADRB1	132	53
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccccc2)cc1	ZINC000819017654	EE	On-Demand	Anodyne	ADRB3	175	63
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccccc2)cc1	ZINC000819017654	EE	On-Demand	Anodyne	LTA4H	29	52
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccccc2)cc1	ZINC000819017654	EE	On-Demand	Anodyne	ESRRG	53	40
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccccc2)cc1	ZINC000819017654	EE	On-Demand	Anodyne	TAAR1	15	45
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccccc2)cc1	ZINC000819017655	EE	On-Demand	Anodyne	ADRB2	102	56
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccccc2)cc1	ZINC000819017655	EE	On-Demand	Anodyne	ADRB1	132	53
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccccc2)cc1	ZINC000819017655	EE	On-Demand	Anodyne	ADRB3	175	63
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccccc2)cc1	ZINC000819017655	EE	On-Demand	Anodyne	LTA4H	29	52
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccccc2)cc1	ZINC000819017655	EE	On-Demand	Anodyne	ESRRG	53	40
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccccc2)cc1	ZINC000819017655	EE	On-Demand	Anodyne	TAAR1	15	45
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819017656	EE	On-Demand	Anodyne	ADRB2	49	40
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819017656	EE	On-Demand	Anodyne	ADRB1	67	40
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819017656	EE	On-Demand	Anodyne	ADRB3	80	40
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819017657	EE	On-Demand	Anodyne	ADRB2	49	40
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819017657	EE	On-Demand	Anodyne	ADRB1	67	40
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819017657	EE	On-Demand	Anodyne	ADRB3	80	40
CN(C)CCOc1ccc(CCNC[C@H](O)c2cccnc2)cc1	ZINC000819017658	ED	On-Demand	Anodyne	ADRB2	87	55
CN(C)CCOc1ccc(CCNC[C@H](O)c2cccnc2)cc1	ZINC000819017658	ED	On-Demand	Anodyne	ADRB1	115	55
CN(C)CCOc1ccc(CCNC[C@H](O)c2cccnc2)cc1	ZINC000819017658	ED	On-Demand	Anodyne	ADRB3	201	63
CN(C)CCOc1ccc(CCNC[C@H](O)c2cccnc2)cc1	ZINC000819017658	ED	On-Demand	Anodyne	CYP51A1	16	40
CN(C)CCOc1ccc(CCNC[C@H](O)c2cccnc2)cc1	ZINC000819017658	ED	On-Demand	Anodyne	ESRRG	43	32
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cccnc2)cc1	ZINC000819017659	ED	On-Demand	Anodyne	ADRB2	87	55
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cccnc2)cc1	ZINC000819017659	ED	On-Demand	Anodyne	ADRB1	115	55
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cccnc2)cc1	ZINC000819017659	ED	On-Demand	Anodyne	ADRB3	201	63
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cccnc2)cc1	ZINC000819017659	ED	On-Demand	Anodyne	CYP51A1	16	40
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cccnc2)cc1	ZINC000819017659	ED	On-Demand	Anodyne	ESRRG	43	32
CC(=O)Nc1cccc(OCCNCCS(C)(=O)=O)c1	ZINC000819017664	DC	On-Demand	Anodyne	DRD4	18	42
CC(=O)Nc1cccc(OCCNCCS(C)(=O)=O)c1	ZINC000819017664	DC	On-Demand	Anodyne	DRTS_LEIMA	16	40
CC(=O)Nc1cccc(OCCNCCS(C)(=O)=O)c1	ZINC000819017664	DC	On-Demand	Anodyne	MTNR1A	35	47
CC(=O)Nc1cccc(OCCNCCS(C)(=O)=O)c1	ZINC000819017664	DC	On-Demand	Anodyne	MTNR1B	33	47
CC(=O)Nc1cccc(OCCNCCS(C)(=O)=O)c1	ZINC000819017664	DC	On-Demand	Anodyne	EPHX2	18	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819017677	EE	On-Demand	Anodyne	ADRB2	45	42
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819017677	EE	On-Demand	Anodyne	ADRB1	66	46
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819017677	EE	On-Demand	Anodyne	ADRB3	92	46
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819017677	EE	On-Demand	Anodyne	MTNR1A	21	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819017677	EE	On-Demand	Anodyne	MTNR1B	21	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819017678	EE	On-Demand	Anodyne	ADRB2	45	42
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819017678	EE	On-Demand	Anodyne	ADRB1	66	46
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819017678	EE	On-Demand	Anodyne	ADRB3	92	46
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819017678	EE	On-Demand	Anodyne	MTNR1A	21	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819017678	EE	On-Demand	Anodyne	MTNR1B	21	41
O=C(CN1CCN(C(=O)C(F)=C2CCC2)CC1)Nc1ccccc1Cl	ZINC000819017691	FF	On-Demand	Anodyne	KCNQ2	56	42
C=CCCn1cc(C(=O)Nc2ccc(N3CCN(C)CC3)cc2)nn1	ZINC000819017702	ED	On-Demand	Mild	LCK	15	42
C=CCCn1cc(C(=O)Nc2ccc(N3CCN(C)CC3)cc2)nn1	ZINC000819017702	ED	On-Demand	Mild	PRNP	44	48
C=CCCn1cc(C(=O)Nc2ccc(N3CCN(C)CC3)cc2)nn1	ZINC000819017702	ED	On-Demand	Mild	FLT3	17	40
CN(CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C1CCCC1	ZINC000819017707	FE	On-Demand	Anodyne	GPR119	30	41
C=C(C)C(C)(C)C(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819017713	CF	On-Demand	Reactive	CFTR	37	44
CN(CCNC[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000819017721	DE	On-Demand	Bother	ADRB3	45	38
CN(CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000819017722	DE	On-Demand	Bother	ADRB3	45	38
COc1ccc(OC)c([C@H](O)CNCCCOc2ccccc2C)c1	ZINC000819017723	EG	On-Demand	Anodyne	ADRB2	37	44
COc1ccc(OC)c([C@H](O)CNCCCOc2ccccc2C)c1	ZINC000819017723	EG	On-Demand	Anodyne	ADRB1	34	40
COc1ccc(OC)c([C@H](O)CNCCCOc2ccccc2C)c1	ZINC000819017723	EG	On-Demand	Anodyne	DRD4	17	42
COc1ccc(OC)c([C@H](O)CNCCCOc2ccccc2C)c1	ZINC000819017723	EG	On-Demand	Anodyne	ADRB3	23	40
CC(=O)N1CCc2cc(NC(=O)C(F)=C3CCC3)ccc21	ZINC000819017727	CF	On-Demand	Anodyne	HSD17B3	47	35
CCCCNC(=O)CN1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819017770	GC	On-Demand	Anodyne	KCNJ1	64	42
COc1ccc(CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819017779	GG	On-Demand	Mild	PAPA1_CARPA	51	46
COc1ccc(CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819017780	GG	On-Demand	Mild	PAPA1_CARPA	51	46
CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)OC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819017781	HJ	On-Demand	Bother	COLA	93	37
CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)OC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819017783	HJ	On-Demand	Bother	COLA	93	37
CN(C)C1(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCCCCC1	ZINC000819017790	GG	On-Demand	Mild	PAPA1_CARPA	44	50
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc2ccccc12	ZINC000819017793	HI	On-Demand	Bother	COLA	109	51
CCCCNC(=O)CN1CCN(C(=O)c2cnc3cc(OC)ccn23)CC1	ZINC000819017798	FD	On-Demand	Anodyne	DRD4	40	31
CN(Cc1ccc2c(c1)OCO2)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819017801	EE	On-Demand	Anodyne	BMP1	51	41
CN(Cc1ccc2c(c1)OCO2)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819017801	EE	On-Demand	Anodyne	LUXR	21	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819017815	GD	On-Demand	Anodyne	ADRB2	56	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819017815	GD	On-Demand	Anodyne	ADRB1	70	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819017815	GD	On-Demand	Anodyne	ADRB3	119	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819017815	GD	On-Demand	Anodyne	MTNR1A	23	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819017815	GD	On-Demand	Anodyne	MTNR1B	22	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819017816	GD	On-Demand	Anodyne	ADRB2	56	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819017816	GD	On-Demand	Anodyne	ADRB1	70	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819017816	GD	On-Demand	Anodyne	ADRB3	119	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819017816	GD	On-Demand	Anodyne	MTNR1A	23	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819017816	GD	On-Demand	Anodyne	MTNR1B	22	40
Cc1cc(F)ccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819017842	GE	On-Demand	Anodyne	HTR1A	64	50
Cc1cc(F)ccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819017842	GE	On-Demand	Anodyne	DRD2	61	50
Cc1cc(F)ccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819017842	GE	On-Demand	Anodyne	DRD1	15	50
Cc1cc(F)ccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819017842	GE	On-Demand	Anodyne	DRD4	45	50
Cc1cc(F)ccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819017842	GE	On-Demand	Anodyne	HTR2A	49	50
Cc1cc(F)ccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819017842	GE	On-Demand	Anodyne	ADRA1A	31	41
Cc1cc(F)ccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819017842	GE	On-Demand	Anodyne	DRD3	62	50
Cc1cc(F)ccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819017842	GE	On-Demand	Anodyne	HTR7	46	39
Cc1cc(F)ccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819017842	GE	On-Demand	Anodyne	P2RX3	18	42
Cc1cc(F)ccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819017842	GE	On-Demand	Anodyne	POLC	15	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819017844	FE	On-Demand	Bother	ADRB2	25	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819017844	FE	On-Demand	Bother	ADRB1	46	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819017844	FE	On-Demand	Bother	ADRB3	53	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819017844	FE	On-Demand	Bother	TAAR1	21	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819017845	FE	On-Demand	Bother	ADRB2	25	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819017845	FE	On-Demand	Bother	ADRB1	46	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819017845	FE	On-Demand	Bother	ADRB3	53	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819017845	FE	On-Demand	Bother	TAAR1	21	41
Cc1ncsc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819017848	GG	On-Demand	Anodyne	CTSD	71	42
Cc1ncsc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819017848	GG	On-Demand	Anodyne	PGC	54	37
Cc1ncsc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819017848	GG	On-Demand	Anodyne	PAPA1_CARPA	29	42
Cc1ncsc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819017848	GG	On-Demand	Anodyne	BACE2	46	38
Cc1ncsc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819017848	GG	On-Demand	Anodyne	REN	74	45
Cc1ncsc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819017848	GG	On-Demand	Anodyne	REN1	20	43
Cc1ncsc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819017848	GG	On-Demand	Anodyne	BACE1	77	43
Cc1ncsc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819017848	GG	On-Demand	Anodyne	FPR1	47	40
Cc1ncsc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819017848	GG	On-Demand	Anodyne	PLM2_PLAFA	41	34
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017849	FD	On-Demand	Anodyne	HTR1A	64	60
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017849	FD	On-Demand	Anodyne	DRD2	60	58
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017849	FD	On-Demand	Anodyne	DRD1	18	58
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017849	FD	On-Demand	Anodyne	DRD4	42	58
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017849	FD	On-Demand	Anodyne	ADRA1D	16	40
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017849	FD	On-Demand	Anodyne	HTR2A	40	60
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017849	FD	On-Demand	Anodyne	HTR2C	15	41
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017849	FD	On-Demand	Anodyne	SLC6A4	19	40
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017849	FD	On-Demand	Anodyne	ADRA1A	22	42
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017849	FD	On-Demand	Anodyne	DRD3	60	58
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017849	FD	On-Demand	Anodyne	SLC6A3	28	40
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017849	FD	On-Demand	Anodyne	HTR7	42	44
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017849	FD	On-Demand	Anodyne	P2RX3	18	43
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017849	FD	On-Demand	Anodyne	SIGMAR1	15	73
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017850	FD	On-Demand	Anodyne	HTR1A	64	60
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017850	FD	On-Demand	Anodyne	DRD2	60	58
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017850	FD	On-Demand	Anodyne	DRD1	18	58
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017850	FD	On-Demand	Anodyne	DRD4	42	58
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017850	FD	On-Demand	Anodyne	ADRA1D	16	40
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017850	FD	On-Demand	Anodyne	HTR2A	40	60
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017850	FD	On-Demand	Anodyne	HTR2C	15	41
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017850	FD	On-Demand	Anodyne	SLC6A4	19	40
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017850	FD	On-Demand	Anodyne	ADRA1A	22	42
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017850	FD	On-Demand	Anodyne	DRD3	60	58
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017850	FD	On-Demand	Anodyne	SLC6A3	28	40
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017850	FD	On-Demand	Anodyne	HTR7	42	44
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017850	FD	On-Demand	Anodyne	P2RX3	18	43
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1	ZINC000819017850	FD	On-Demand	Anodyne	SIGMAR1	15	73
CN(C)CCOc1ccc(CCNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819017860	FF	On-Demand	Anodyne	ADRB2	55	42
CN(C)CCOc1ccc(CCNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819017860	FF	On-Demand	Anodyne	ADRB1	81	44
CN(C)CCOc1ccc(CCNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819017860	FF	On-Demand	Anodyne	ADRB3	72	41
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819017861	FF	On-Demand	Anodyne	ADRB2	55	42
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819017861	FF	On-Demand	Anodyne	ADRB1	81	44
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819017861	FF	On-Demand	Anodyne	ADRB3	72	41
CN(C)CCOc1ccc(CCNCCS(C)(=O)=O)cc1	ZINC000819017864	DC	On-Demand	Anodyne	LTA4H	18	47
CN(C)CCOc1ccc(CCNCCS(C)(=O)=O)cc1	ZINC000819017864	DC	On-Demand	Anodyne	ESRRG	43	33
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819017865	GG	On-Demand	Anodyne	ADRB2	40	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819017865	GG	On-Demand	Anodyne	ADRB1	64	48
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819017865	GG	On-Demand	Anodyne	ADRB3	87	48
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819017865	GG	On-Demand	Anodyne	MTNR1A	21	44
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819017865	GG	On-Demand	Anodyne	MTNR1B	21	44
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819017866	GG	On-Demand	Anodyne	ADRB2	40	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819017866	GG	On-Demand	Anodyne	ADRB1	64	48
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819017866	GG	On-Demand	Anodyne	ADRB3	87	48
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819017866	GG	On-Demand	Anodyne	MTNR1A	21	44
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819017866	GG	On-Demand	Anodyne	MTNR1B	21	44
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819017880	FG	On-Demand	Anodyne	ADRB2	28	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819017880	FG	On-Demand	Anodyne	ADRB1	50	42
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819017880	FG	On-Demand	Anodyne	ADRB3	37	42
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819017881	FG	On-Demand	Anodyne	ADRB2	28	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819017881	FG	On-Demand	Anodyne	ADRB1	50	42
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819017881	FG	On-Demand	Anodyne	ADRB3	37	42
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)c(F)c1	ZINC000819017889	GD	On-Demand	Anodyne	HTR1A	46	48
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)c(F)c1	ZINC000819017889	GD	On-Demand	Anodyne	DRD2	41	47
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)c(F)c1	ZINC000819017889	GD	On-Demand	Anodyne	DRD4	33	47
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)c(F)c1	ZINC000819017889	GD	On-Demand	Anodyne	HTR2A	32	47
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)c(F)c1	ZINC000819017889	GD	On-Demand	Anodyne	DRD3	45	47
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)c(F)c1	ZINC000819017889	GD	On-Demand	Anodyne	HTR7	33	40
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)c(F)c1	ZINC000819017889	GD	On-Demand	Anodyne	ABCC1	73	34
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)c(F)c1	ZINC000819017890	GD	On-Demand	Anodyne	HTR1A	46	48
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)c(F)c1	ZINC000819017890	GD	On-Demand	Anodyne	DRD2	41	47
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)c(F)c1	ZINC000819017890	GD	On-Demand	Anodyne	DRD4	33	47
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)c(F)c1	ZINC000819017890	GD	On-Demand	Anodyne	HTR2A	32	47
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)c(F)c1	ZINC000819017890	GD	On-Demand	Anodyne	DRD3	45	47
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)c(F)c1	ZINC000819017890	GD	On-Demand	Anodyne	HTR7	33	40
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)c(F)c1	ZINC000819017890	GD	On-Demand	Anodyne	ABCC1	73	34
CN(CCNC[C@H](O)c1cccc(Cl)c1)C1CCCC1	ZINC000819017908	CF	On-Demand	Anodyne	ADRB1	52	49
CN(CCNC[C@H](O)c1cccc(Cl)c1)C1CCCC1	ZINC000819017908	CF	On-Demand	Anodyne	ADRB3	69	49
CN(CCNC[C@@H](O)c1cccc(Cl)c1)C1CCCC1	ZINC000819017909	CF	On-Demand	Anodyne	ADRB1	52	49
CN(CCNC[C@@H](O)c1cccc(Cl)c1)C1CCCC1	ZINC000819017909	CF	On-Demand	Anodyne	ADRB3	69	49
O=C(N[C@@H]1CCOc2ccccc21)C(F)=C1CCC1	ZINC000819017916	CG	On-Demand	Anodyne	BIRC3	42	37
O=C(N[C@@H]1CCOc2ccccc21)C(F)=C1CCC1	ZINC000819017916	CG	On-Demand	Anodyne	LUXR	45	33
O=C(N[C@H]1CCOc2ccccc21)C(F)=C1CCC1	ZINC000819017917	CG	On-Demand	Anodyne	BIRC3	42	37
O=C(N[C@H]1CCOc2ccccc21)C(F)=C1CCC1	ZINC000819017917	CG	On-Demand	Anodyne	LUXR	45	33
Cc1cccc(C(C)C)c1NC(=O)[C@H](C)OC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819017923	HJ	On-Demand	Bother	COLA	83	36
Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819017924	HJ	On-Demand	Bother	COLA	83	36
CN(CCNC[C@H](O)c1ccc(Cl)c(F)c1)C1CCCC1	ZINC000819017943	DF	On-Demand	Anodyne	ADRB1	15	40
CN(CCNC[C@@H](O)c1ccc(Cl)c(F)c1)C1CCCC1	ZINC000819017944	DF	On-Demand	Anodyne	ADRB1	15	40
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819017975	FD	On-Demand	Anodyne	TGM2	42	38
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819017975	FD	On-Demand	Anodyne	F13A1	43	34
O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819017975	FD	On-Demand	Anodyne	NAMPT	69	51
Cc1cccc2c1CC[C@@H]2NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819017989	FH	On-Demand	Anodyne	GPR119	37	48
Cc1cccc2c1CC[C@H]2NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819017990	FH	On-Demand	Anodyne	GPR119	37	48
Cc1cccc2c1CC[C@@H]2NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819017991	FH	On-Demand	Anodyne	GPR119	37	48
Cc1cccc2c1CC[C@H]2NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819017992	FH	On-Demand	Anodyne	GPR119	37	48
CNC(=O)CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819018016	FE	On-Demand	Anodyne	CTSK	17	52
CNC(=O)CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819018016	FE	On-Demand	Anodyne	ECE1	23	41
CNC(=O)CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819018016	FE	On-Demand	Anodyne	REN	50	45
CNC(=O)CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819018017	FE	On-Demand	Anodyne	CTSK	17	52
CNC(=O)CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819018017	FE	On-Demand	Anodyne	ECE1	23	41
CNC(=O)CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819018017	FE	On-Demand	Anodyne	REN	50	45
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819018024	GG	On-Demand	Anodyne	ADRB2	31	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819018024	GG	On-Demand	Anodyne	ADRB1	54	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819018024	GG	On-Demand	Anodyne	ADRB3	42	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819018024	GG	On-Demand	Anodyne	MTNR1A	22	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819018024	GG	On-Demand	Anodyne	MTNR1B	19	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819018024	GG	On-Demand	Anodyne	KCNK3	41	34
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2Br)c1	ZINC000819018025	GG	On-Demand	Anodyne	ADRB2	31	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2Br)c1	ZINC000819018025	GG	On-Demand	Anodyne	ADRB1	54	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2Br)c1	ZINC000819018025	GG	On-Demand	Anodyne	ADRB3	42	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2Br)c1	ZINC000819018025	GG	On-Demand	Anodyne	MTNR1A	22	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2Br)c1	ZINC000819018025	GG	On-Demand	Anodyne	MTNR1B	19	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2Br)c1	ZINC000819018025	GG	On-Demand	Anodyne	KCNK3	41	34
CN(C)CCOc1ccc(CCNC[C@H](O)C2CC2)cc1	ZINC000819018028	CD	On-Demand	Anodyne	ADRB2	40	44
CN(C)CCOc1ccc(CCNC[C@H](O)C2CC2)cc1	ZINC000819018028	CD	On-Demand	Anodyne	ADRB1	69	44
CN(C)CCOc1ccc(CCNC[C@H](O)C2CC2)cc1	ZINC000819018028	CD	On-Demand	Anodyne	ADRB3	53	44
CN(C)CCOc1ccc(CCNC[C@H](O)C2CC2)cc1	ZINC000819018028	CD	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1ccc(CCNC[C@@H](O)C2CC2)cc1	ZINC000819018029	CD	On-Demand	Anodyne	ADRB2	40	44
CN(C)CCOc1ccc(CCNC[C@@H](O)C2CC2)cc1	ZINC000819018029	CD	On-Demand	Anodyne	ADRB1	69	44
CN(C)CCOc1ccc(CCNC[C@@H](O)C2CC2)cc1	ZINC000819018029	CD	On-Demand	Anodyne	ADRB3	53	44
CN(C)CCOc1ccc(CCNC[C@@H](O)C2CC2)cc1	ZINC000819018029	CD	On-Demand	Anodyne	ESRRG	44	33
Cc1ccccc1[C@@H](O)CNCCc1ccc(OCCN(C)C)cc1	ZINC000819018031	EF	On-Demand	Anodyne	ADRB2	81	44
Cc1ccccc1[C@@H](O)CNCCc1ccc(OCCN(C)C)cc1	ZINC000819018031	EF	On-Demand	Anodyne	ADRB1	105	44
Cc1ccccc1[C@@H](O)CNCCc1ccc(OCCN(C)C)cc1	ZINC000819018031	EF	On-Demand	Anodyne	ADRB3	93	46
Cc1ccccc1[C@@H](O)CNCCc1ccc(OCCN(C)C)cc1	ZINC000819018031	EF	On-Demand	Anodyne	LTA4H	18	46
Cc1ccccc1[C@@H](O)CNCCc1ccc(OCCN(C)C)cc1	ZINC000819018031	EF	On-Demand	Anodyne	ESRRG	48	35
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2F)c1	ZINC000819018036	EE	On-Demand	Anodyne	ADRB2	33	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2F)c1	ZINC000819018036	EE	On-Demand	Anodyne	ADRB1	60	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2F)c1	ZINC000819018036	EE	On-Demand	Anodyne	ADRB3	42	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2F)c1	ZINC000819018036	EE	On-Demand	Anodyne	MTNR1A	22	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2F)c1	ZINC000819018036	EE	On-Demand	Anodyne	MTNR1B	20	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2F)c1	ZINC000819018036	EE	On-Demand	Anodyne	KCNK3	42	34
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2F)c1	ZINC000819018036	EE	On-Demand	Anodyne	KCNK9	45	34
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2F)c1	ZINC000819018037	EE	On-Demand	Anodyne	ADRB2	33	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2F)c1	ZINC000819018037	EE	On-Demand	Anodyne	ADRB1	60	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2F)c1	ZINC000819018037	EE	On-Demand	Anodyne	ADRB3	42	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2F)c1	ZINC000819018037	EE	On-Demand	Anodyne	MTNR1A	22	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2F)c1	ZINC000819018037	EE	On-Demand	Anodyne	MTNR1B	20	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2F)c1	ZINC000819018037	EE	On-Demand	Anodyne	KCNK3	42	34
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2F)c1	ZINC000819018037	EE	On-Demand	Anodyne	KCNK9	45	34
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018039	GE	On-Demand	Anodyne	HTR1A	19	52
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018039	GE	On-Demand	Anodyne	DRD4	52	44
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018039	GE	On-Demand	Anodyne	HTR1D	18	49
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018039	GE	On-Demand	Anodyne	HTR1B	29	49
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018039	GE	On-Demand	Anodyne	LCK	29	41
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018039	GE	On-Demand	Anodyne	PRNP	39	43
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018039	GE	On-Demand	Anodyne	JAK2	17	46
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018039	GE	On-Demand	Anodyne	MTNR1A	23	43
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018039	GE	On-Demand	Anodyne	MTNR1B	30	43
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018039	GE	On-Demand	Anodyne	HCK	21	41
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018039	GE	On-Demand	Anodyne	ACR	32	43
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018039	GE	On-Demand	Anodyne	FLT3	18	40
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018039	GE	On-Demand	Anodyne	TAAR1	22	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819018043	GG	On-Demand	Anodyne	ADRB1	53	46
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819018043	GG	On-Demand	Anodyne	ADRB3	76	46
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819018043	GG	On-Demand	Anodyne	EPHX2	22	45
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819018043	GG	On-Demand	Anodyne	PDS	45	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819018044	GG	On-Demand	Anodyne	ADRB1	53	46
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819018044	GG	On-Demand	Anodyne	ADRB3	76	46
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819018044	GG	On-Demand	Anodyne	EPHX2	22	45
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819018044	GG	On-Demand	Anodyne	PDS	45	43
CCC[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccn1	ZINC000819018054	GH	On-Demand	Anodyne	GRIN2B	20	41
CCC[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccn1	ZINC000819018054	GH	On-Demand	Anodyne	GPR119	52	48
CCC[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccn1	ZINC000819018055	GH	On-Demand	Anodyne	GRIN2B	20	41
CCC[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccn1	ZINC000819018055	GH	On-Demand	Anodyne	GPR119	52	48
CCC[C@@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccn1	ZINC000819018056	GH	On-Demand	Anodyne	GRIN2B	20	41
CCC[C@@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccn1	ZINC000819018056	GH	On-Demand	Anodyne	GPR119	52	48
CCC[C@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccn1	ZINC000819018057	GH	On-Demand	Anodyne	GRIN2B	20	41
CCC[C@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccn1	ZINC000819018057	GH	On-Demand	Anodyne	GPR119	52	48
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018058	GE	On-Demand	Anodyne	ADRB1	49	48
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018058	GE	On-Demand	Anodyne	HTR1A	67	51
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018058	GE	On-Demand	Anodyne	DRD2	58	44
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018058	GE	On-Demand	Anodyne	DRD1	15	42
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018058	GE	On-Demand	Anodyne	DRD4	44	43
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018058	GE	On-Demand	Anodyne	HTR2A	56	44
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018058	GE	On-Demand	Anodyne	HTR2C	26	41
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018058	GE	On-Demand	Anodyne	ADRA1A	20	41
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018058	GE	On-Demand	Anodyne	DRD3	65	46
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018058	GE	On-Demand	Anodyne	ADRB3	62	48
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018058	GE	On-Demand	Anodyne	IGF1R	24	40
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018058	GE	On-Demand	Anodyne	HRP1_PLAFA	82	37
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018058	GE	On-Demand	Anodyne	HTR7	45	43
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018059	GE	On-Demand	Anodyne	ADRB1	49	48
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018059	GE	On-Demand	Anodyne	HTR1A	67	51
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018059	GE	On-Demand	Anodyne	DRD2	58	44
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018059	GE	On-Demand	Anodyne	DRD1	15	42
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018059	GE	On-Demand	Anodyne	DRD4	44	43
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018059	GE	On-Demand	Anodyne	HTR2A	56	44
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018059	GE	On-Demand	Anodyne	HTR2C	26	41
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018059	GE	On-Demand	Anodyne	ADRA1A	20	41
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018059	GE	On-Demand	Anodyne	DRD3	65	46
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018059	GE	On-Demand	Anodyne	ADRB3	62	48
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018059	GE	On-Demand	Anodyne	IGF1R	24	40
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018059	GE	On-Demand	Anodyne	HRP1_PLAFA	82	37
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(Cl)c1	ZINC000819018059	GE	On-Demand	Anodyne	HTR7	45	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819018060	GH	On-Demand	Anodyne	ADRB1	58	47
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819018060	GH	On-Demand	Anodyne	HRH2	17	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819018060	GH	On-Demand	Anodyne	ADRB3	49	47
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819018060	GH	On-Demand	Anodyne	MTNR1A	18	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819018060	GH	On-Demand	Anodyne	MTNR1B	16	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819018061	GH	On-Demand	Anodyne	ADRB1	58	47
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819018061	GH	On-Demand	Anodyne	HRH2	17	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819018061	GH	On-Demand	Anodyne	ADRB3	49	47
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819018061	GH	On-Demand	Anodyne	MTNR1A	18	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819018061	GH	On-Demand	Anodyne	MTNR1B	16	40
O=[N+]([O-])c1cccc([C@H](O)CNCc2n[nH]cc2Br)c1	ZINC000819018072	ED	On-Demand	Bother	CACNA1C	42	35
O=[N+]([O-])c1cccc([C@H](O)CNCc2n[nH]cc2Br)c1	ZINC000819018072	ED	On-Demand	Bother	CACNA1D	63	34
O=[N+]([O-])c1cccc([C@@H](O)CNCc2n[nH]cc2Br)c1	ZINC000819018073	ED	On-Demand	Bother	CACNA1C	42	35
O=[N+]([O-])c1cccc([C@@H](O)CNCc2n[nH]cc2Br)c1	ZINC000819018073	ED	On-Demand	Bother	CACNA1D	63	34
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819018074	GG	On-Demand	Anodyne	ADRB2	50	39
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819018074	GG	On-Demand	Anodyne	ADRB1	70	44
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819018074	GG	On-Demand	Anodyne	ADRB3	85	44
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819018074	GG	On-Demand	Anodyne	EPHX2	35	46
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819018074	GG	On-Demand	Anodyne	SHH	40	33
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819018075	GG	On-Demand	Anodyne	ADRB2	50	39
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819018075	GG	On-Demand	Anodyne	ADRB1	70	44
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819018075	GG	On-Demand	Anodyne	ADRB3	85	44
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819018075	GG	On-Demand	Anodyne	EPHX2	35	46
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819018075	GG	On-Demand	Anodyne	SHH	40	33
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018082	FF	On-Demand	Anodyne	HTR1A	19	58
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018082	FF	On-Demand	Anodyne	HTR1D	31	42
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018082	FF	On-Demand	Anodyne	HTR1B	45	42
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018082	FF	On-Demand	Anodyne	LCK	23	46
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018082	FF	On-Demand	Anodyne	NPY2R	15	41
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018082	FF	On-Demand	Anodyne	PRNP	47	48
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018082	FF	On-Demand	Anodyne	KDR	15	42
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018082	FF	On-Demand	Anodyne	FLT3	21	43
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCN(C)CC3)cc2)c1	ZINC000819018082	FF	On-Demand	Anodyne	AURKA	18	42
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018084	FD	On-Demand	Anodyne	ADRB1	26	41
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018084	FD	On-Demand	Anodyne	HTR1A	56	50
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018084	FD	On-Demand	Anodyne	DRD2	48	49
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018084	FD	On-Demand	Anodyne	DRD4	34	49
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018084	FD	On-Demand	Anodyne	HTR2A	43	49
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018084	FD	On-Demand	Anodyne	HTR2C	17	42
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018084	FD	On-Demand	Anodyne	SLC6A4	15	43
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018084	FD	On-Demand	Anodyne	ADRA1A	18	41
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018084	FD	On-Demand	Anodyne	DRD3	53	49
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018084	FD	On-Demand	Anodyne	ADRB3	34	41
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018084	FD	On-Demand	Anodyne	HTR7	43	42
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018084	FD	On-Demand	Anodyne	P2RX3	16	40
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018085	FD	On-Demand	Anodyne	ADRB1	26	41
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018085	FD	On-Demand	Anodyne	HTR1A	56	50
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018085	FD	On-Demand	Anodyne	DRD2	48	49
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018085	FD	On-Demand	Anodyne	DRD4	34	49
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018085	FD	On-Demand	Anodyne	HTR2A	43	49
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018085	FD	On-Demand	Anodyne	HTR2C	17	42
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018085	FD	On-Demand	Anodyne	SLC6A4	15	43
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018085	FD	On-Demand	Anodyne	ADRA1A	18	41
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018085	FD	On-Demand	Anodyne	DRD3	53	49
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018085	FD	On-Demand	Anodyne	ADRB3	34	41
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018085	FD	On-Demand	Anodyne	HTR7	43	42
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1cccc(F)c1	ZINC000819018085	FD	On-Demand	Anodyne	P2RX3	16	40
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819018088	FF	On-Demand	Anodyne	ADRB2	63	44
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819018088	FF	On-Demand	Anodyne	ADRB1	87	44
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819018088	FF	On-Demand	Anodyne	ADRB3	74	42
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819018088	FF	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819018089	FF	On-Demand	Anodyne	ADRB2	63	44
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819018089	FF	On-Demand	Anodyne	ADRB1	87	44
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819018089	FF	On-Demand	Anodyne	ADRB3	74	42
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819018089	FF	On-Demand	Anodyne	ESRRG	44	33
Cc1ccccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819018100	FE	On-Demand	Anodyne	HTR1A	86	54
Cc1ccccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819018100	FE	On-Demand	Anodyne	DRD2	71	49
Cc1ccccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819018100	FE	On-Demand	Anodyne	DRD4	54	44
Cc1ccccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819018100	FE	On-Demand	Anodyne	ADRA1D	23	42
Cc1ccccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819018100	FE	On-Demand	Anodyne	HTR2A	54	44
Cc1ccccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819018100	FE	On-Demand	Anodyne	HTR2C	31	43
Cc1ccccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819018100	FE	On-Demand	Anodyne	ADRA1A	28	49
Cc1ccccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819018100	FE	On-Demand	Anodyne	DRD3	75	44
Cc1ccccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819018100	FE	On-Demand	Anodyne	HTR7	58	44
Cc1ccccc1[C@@H](O)CNCCCCN1CCN(c2ncccn2)CC1	ZINC000819018100	FE	On-Demand	Anodyne	HNMT	48	37
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819018127	CF	On-Demand	Reactive	CFTR	34	41
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819018130	CF	On-Demand	Reactive	CFTR	34	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)Cc1ccc3c(c1)OCO3)C2	ZINC000819018133	FE	On-Demand	Anodyne	BMP1	66	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)Cc1ccc3c(c1)OCO3)C2	ZINC000819018133	FE	On-Demand	Anodyne	NOS2	41	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)Cc1ccc3c(c1)OCO3)C2	ZINC000819018134	FE	On-Demand	Anodyne	BMP1	66	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)Cc1ccc3c(c1)OCO3)C2	ZINC000819018134	FE	On-Demand	Anodyne	NOS2	41	33
CCCCNC(=O)CN1CCN(C(=O)Cc2nsc3ccccc23)CC1	ZINC000819018190	FD	On-Demand	Anodyne	HTR1A	20	45
CCCCNC(=O)CN1CCN(C(=O)Cc2nsc3ccccc23)CC1	ZINC000819018190	FD	On-Demand	Anodyne	DRD2	26	43
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819018208	FG	On-Demand	Anodyne	ADRB2	57	43
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819018208	FG	On-Demand	Anodyne	ADRB1	79	41
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819018208	FG	On-Demand	Anodyne	ADRB3	82	42
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819018208	FG	On-Demand	Anodyne	ESRRG	44	33
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819018213	EF	On-Demand	Anodyne	ADRB1	46	39
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819018213	EF	On-Demand	Anodyne	MTNR1A	18	42
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819018213	EF	On-Demand	Anodyne	MTNR1B	16	42
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819018214	EF	On-Demand	Anodyne	ADRB1	46	39
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819018214	EF	On-Demand	Anodyne	MTNR1A	18	42
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819018214	EF	On-Demand	Anodyne	MTNR1B	16	42
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1F	ZINC000819018219	GD	On-Demand	Anodyne	HTR1A	64	54
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1F	ZINC000819018219	GD	On-Demand	Anodyne	DRD2	59	49
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1F	ZINC000819018219	GD	On-Demand	Anodyne	DRD1	15	49
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1F	ZINC000819018219	GD	On-Demand	Anodyne	DRD4	44	49
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1F	ZINC000819018219	GD	On-Demand	Anodyne	HTR2A	49	49
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1F	ZINC000819018219	GD	On-Demand	Anodyne	HTR2C	24	41
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1F	ZINC000819018219	GD	On-Demand	Anodyne	ADRA1A	18	47
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1F	ZINC000819018219	GD	On-Demand	Anodyne	DRD3	65	49
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1F	ZINC000819018219	GD	On-Demand	Anodyne	HTR7	45	42
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1F	ZINC000819018220	GD	On-Demand	Anodyne	HTR1A	64	54
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1F	ZINC000819018220	GD	On-Demand	Anodyne	DRD2	59	49
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1F	ZINC000819018220	GD	On-Demand	Anodyne	DRD1	15	49
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1F	ZINC000819018220	GD	On-Demand	Anodyne	DRD4	44	49
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1F	ZINC000819018220	GD	On-Demand	Anodyne	HTR2A	49	49
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1F	ZINC000819018220	GD	On-Demand	Anodyne	HTR2C	24	41
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1F	ZINC000819018220	GD	On-Demand	Anodyne	ADRA1A	18	47
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1F	ZINC000819018220	GD	On-Demand	Anodyne	DRD3	65	49
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1c(F)cccc1F	ZINC000819018220	GD	On-Demand	Anodyne	HTR7	45	42
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819018227	FF	On-Demand	Anodyne	ADRB2	31	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819018227	FF	On-Demand	Anodyne	ADRB1	54	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819018227	FF	On-Demand	Anodyne	ADRB3	39	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819018227	FF	On-Demand	Anodyne	MTNR1A	20	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819018227	FF	On-Demand	Anodyne	MTNR1B	18	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819018227	FF	On-Demand	Anodyne	EPHX2	18	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819018228	FF	On-Demand	Anodyne	ADRB2	31	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819018228	FF	On-Demand	Anodyne	ADRB1	54	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819018228	FF	On-Demand	Anodyne	ADRB3	39	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819018228	FF	On-Demand	Anodyne	MTNR1A	20	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819018228	FF	On-Demand	Anodyne	MTNR1B	18	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819018228	FF	On-Demand	Anodyne	EPHX2	18	41
N#Cc1ccc([C@@H](O)CNCCCCN2CCN(c3ncccn3)CC2)cc1	ZINC000819018249	GD	On-Demand	Mild	HTR1A	34	50
N#Cc1ccc([C@@H](O)CNCCCCN2CCN(c3ncccn3)CC2)cc1	ZINC000819018249	GD	On-Demand	Mild	DRD2	30	44
N#Cc1ccc([C@@H](O)CNCCCCN2CCN(c3ncccn3)CC2)cc1	ZINC000819018249	GD	On-Demand	Mild	DRD4	19	44
N#Cc1ccc([C@@H](O)CNCCCCN2CCN(c3ncccn3)CC2)cc1	ZINC000819018249	GD	On-Demand	Mild	HTR2A	15	48
N#Cc1ccc([C@@H](O)CNCCCCN2CCN(c3ncccn3)CC2)cc1	ZINC000819018249	GD	On-Demand	Mild	DRD3	28	44
N#Cc1ccc([C@H](O)CNCCCCN2CCN(c3ncccn3)CC2)cc1	ZINC000819018250	GD	On-Demand	Mild	HTR1A	34	50
N#Cc1ccc([C@H](O)CNCCCCN2CCN(c3ncccn3)CC2)cc1	ZINC000819018250	GD	On-Demand	Mild	DRD2	30	44
N#Cc1ccc([C@H](O)CNCCCCN2CCN(c3ncccn3)CC2)cc1	ZINC000819018250	GD	On-Demand	Mild	DRD4	19	44
N#Cc1ccc([C@H](O)CNCCCCN2CCN(c3ncccn3)CC2)cc1	ZINC000819018250	GD	On-Demand	Mild	HTR2A	15	48
N#Cc1ccc([C@H](O)CNCCCCN2CCN(c3ncccn3)CC2)cc1	ZINC000819018250	GD	On-Demand	Mild	DRD3	28	44
CN(C[C@H](O)CN[C@@H](c1ccccc1)C1CCC1)C(=O)OC(C)(C)C	ZINC000819018261	EG	On-Demand	Anodyne	AMY2	44	30
CN(C[C@H](O)CN[C@H](c1ccccc1)C1CCC1)C(=O)OC(C)(C)C	ZINC000819018262	EG	On-Demand	Anodyne	AMY2	44	30
CN(C[C@@H](O)CN[C@@H](c1ccccc1)C1CCC1)C(=O)OC(C)(C)C	ZINC000819018263	EG	On-Demand	Anodyne	AMY2	44	30
CN(C[C@@H](O)CN[C@H](c1ccccc1)C1CCC1)C(=O)OC(C)(C)C	ZINC000819018264	EG	On-Demand	Anodyne	AMY2	44	30
CN(C)CCOc1ccc(CCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819018268	EF	On-Demand	Anodyne	ADRB2	85	48
CN(C)CCOc1ccc(CCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819018268	EF	On-Demand	Anodyne	ADRB1	111	53
CN(C)CCOc1ccc(CCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819018268	EF	On-Demand	Anodyne	ADRB3	152	51
CN(C)CCOc1ccc(CCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819018268	EF	On-Demand	Anodyne	ESRRG	43	32
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819018269	EF	On-Demand	Anodyne	ADRB2	85	48
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819018269	EF	On-Demand	Anodyne	ADRB1	111	53
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819018269	EF	On-Demand	Anodyne	ADRB3	152	51
CN(C)CCOc1ccc(CCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819018269	EF	On-Demand	Anodyne	ESRRG	43	32
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	ZINC000819018280	GD	On-Demand	Anodyne	HTR1A	56	52
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	ZINC000819018280	GD	On-Demand	Anodyne	DRD2	54	52
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	ZINC000819018280	GD	On-Demand	Anodyne	DRD1	16	52
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	ZINC000819018280	GD	On-Demand	Anodyne	DRD4	41	52
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	ZINC000819018280	GD	On-Demand	Anodyne	HTR2A	42	52
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	ZINC000819018280	GD	On-Demand	Anodyne	ADRA1A	24	42
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	ZINC000819018280	GD	On-Demand	Anodyne	DRD3	56	52
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	ZINC000819018280	GD	On-Demand	Anodyne	HTR7	46	40
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	ZINC000819018280	GD	On-Demand	Anodyne	P2RX3	17	41
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	ZINC000819018281	GD	On-Demand	Anodyne	HTR1A	56	52
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	ZINC000819018281	GD	On-Demand	Anodyne	DRD2	54	52
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	ZINC000819018281	GD	On-Demand	Anodyne	DRD1	16	52
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	ZINC000819018281	GD	On-Demand	Anodyne	DRD4	41	52
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	ZINC000819018281	GD	On-Demand	Anodyne	HTR2A	42	52
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	ZINC000819018281	GD	On-Demand	Anodyne	ADRA1A	24	42
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	ZINC000819018281	GD	On-Demand	Anodyne	DRD3	56	52
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	ZINC000819018281	GD	On-Demand	Anodyne	HTR7	46	40
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(F)cc1F	ZINC000819018281	GD	On-Demand	Anodyne	P2RX3	17	41
CC(C)(C)CCCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819018286	CG	On-Demand	Bother	ADRB1	40	38
CC(C)(C)CCCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819018286	CG	On-Demand	Bother	ADRB3	49	38
CC(C)(C)CCCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819018287	CG	On-Demand	Bother	ADRB1	40	38
CC(C)(C)CCCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819018287	CG	On-Demand	Bother	ADRB3	49	38
CC(=O)Nc1cccc(OCCNC[C@H](O)C2CC2)c1	ZINC000819018295	CD	On-Demand	Anodyne	ADRB2	17	45
CC(=O)Nc1cccc(OCCNC[C@H](O)C2CC2)c1	ZINC000819018295	CD	On-Demand	Anodyne	ADRB1	41	45
CC(=O)Nc1cccc(OCCNC[C@H](O)C2CC2)c1	ZINC000819018295	CD	On-Demand	Anodyne	MTNR1A	33	43
CC(=O)Nc1cccc(OCCNC[C@H](O)C2CC2)c1	ZINC000819018295	CD	On-Demand	Anodyne	MTNR1B	28	43
CC(=O)Nc1cccc(OCCNC[C@H](O)C2CC2)c1	ZINC000819018295	CD	On-Demand	Anodyne	EPHX2	23	42
CC(=O)Nc1cccc(OCCNC[C@H](O)C2CC2)c1	ZINC000819018295	CD	On-Demand	Anodyne	KCNK3	40	33
CC(=O)Nc1cccc(OCCNC[C@@H](O)C2CC2)c1	ZINC000819018296	CD	On-Demand	Anodyne	ADRB2	17	45
CC(=O)Nc1cccc(OCCNC[C@@H](O)C2CC2)c1	ZINC000819018296	CD	On-Demand	Anodyne	ADRB1	41	45
CC(=O)Nc1cccc(OCCNC[C@@H](O)C2CC2)c1	ZINC000819018296	CD	On-Demand	Anodyne	MTNR1A	33	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)C2CC2)c1	ZINC000819018296	CD	On-Demand	Anodyne	MTNR1B	28	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)C2CC2)c1	ZINC000819018296	CD	On-Demand	Anodyne	EPHX2	23	42
CC(=O)Nc1cccc(OCCNC[C@@H](O)C2CC2)c1	ZINC000819018296	CD	On-Demand	Anodyne	KCNK3	40	33
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccnc2)c1	ZINC000819018299	DD	On-Demand	Anodyne	ADRB2	50	55
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccnc2)c1	ZINC000819018299	DD	On-Demand	Anodyne	ADRB1	78	55
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccnc2)c1	ZINC000819018299	DD	On-Demand	Anodyne	ADRB3	155	61
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccnc2)c1	ZINC000819018299	DD	On-Demand	Anodyne	MTNR1A	19	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccnc2)c1	ZINC000819018299	DD	On-Demand	Anodyne	MTNR1B	18	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccnc2)c1	ZINC000819018300	DD	On-Demand	Anodyne	ADRB2	50	55
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccnc2)c1	ZINC000819018300	DD	On-Demand	Anodyne	ADRB1	78	55
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccnc2)c1	ZINC000819018300	DD	On-Demand	Anodyne	ADRB3	155	61
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccnc2)c1	ZINC000819018300	DD	On-Demand	Anodyne	MTNR1A	19	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccnc2)c1	ZINC000819018300	DD	On-Demand	Anodyne	MTNR1B	18	40
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819018313	GD	On-Demand	Anodyne	TGM2	72	43
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819018313	GD	On-Demand	Anodyne	F13A1	65	35
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819018313	GD	On-Demand	Anodyne	NAMPT	67	49
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819018314	GD	On-Demand	Anodyne	TGM2	72	43
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819018314	GD	On-Demand	Anodyne	F13A1	65	35
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819018314	GD	On-Demand	Anodyne	NAMPT	67	49
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819018315	GD	On-Demand	Anodyne	TGM2	72	43
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819018315	GD	On-Demand	Anodyne	F13A1	65	35
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819018315	GD	On-Demand	Anodyne	NAMPT	67	49
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819018316	GD	On-Demand	Anodyne	TGM2	72	43
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819018316	GD	On-Demand	Anodyne	F13A1	65	35
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819018316	GD	On-Demand	Anodyne	NAMPT	67	49
C=C(Cl)CSc1nc(C)c(CC(=O)N[C@H]2CCOc3ccccc32)s1	ZINC000819018340	GI	On-Demand	Mild	BDKRB1	21	40
C=C(Cl)CSc1nc(C)c(CC(=O)N[C@@H]2CCOc3ccccc32)s1	ZINC000819018341	GI	On-Demand	Mild	BDKRB1	21	40
O=C(CN1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1)Nc1ccc(F)cc1	ZINC000819018429	FD	On-Demand	Anodyne	WNT3A	46	38
O=C(CN1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1)Nc1ccc(F)cc1	ZINC000819018430	FD	On-Demand	Anodyne	WNT3A	46	38
O=C(CN1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1)Nc1ccc(F)cc1	ZINC000819018431	FD	On-Demand	Anodyne	WNT3A	46	38
O=C(CN1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1)Nc1ccc(F)cc1	ZINC000819018432	FD	On-Demand	Anodyne	WNT3A	46	38
O=C(Nc1ccc2nc(N3CCOCC3)sc2c1)C(F)=C1CCC1	ZINC000819018433	EG	On-Demand	Anodyne	PIK3CD	15	42
O=C(Nc1ccc2nc(N3CCOCC3)sc2c1)C(F)=C1CCC1	ZINC000819018433	EG	On-Demand	Anodyne	PIK3CB	19	42
O[C@H](CNCc1n[nH]cc1Br)c1cccc(Cl)c1	ZINC000819018434	EF	On-Demand	Anodyne	ADRB1	33	43
O[C@H](CNCc1n[nH]cc1Br)c1cccc(Cl)c1	ZINC000819018434	EF	On-Demand	Anodyne	ADRB3	46	47
O[C@@H](CNCc1n[nH]cc1Br)c1cccc(Cl)c1	ZINC000819018435	EF	On-Demand	Anodyne	ADRB1	33	43
O[C@@H](CNCc1n[nH]cc1Br)c1cccc(Cl)c1	ZINC000819018435	EF	On-Demand	Anodyne	ADRB3	46	47
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819018436	EF	On-Demand	Anodyne	ADRB2	34	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819018436	EF	On-Demand	Anodyne	ADRB1	56	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819018436	EF	On-Demand	Anodyne	DRD4	16	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819018436	EF	On-Demand	Anodyne	ADRB3	67	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819018436	EF	On-Demand	Anodyne	MTNR1A	24	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819018436	EF	On-Demand	Anodyne	MTNR1B	23	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819018437	EF	On-Demand	Anodyne	ADRB2	34	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819018437	EF	On-Demand	Anodyne	ADRB1	56	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819018437	EF	On-Demand	Anodyne	DRD4	16	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819018437	EF	On-Demand	Anodyne	ADRB3	67	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819018437	EF	On-Demand	Anodyne	MTNR1A	24	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819018437	EF	On-Demand	Anodyne	MTNR1B	23	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819018438	ED	On-Demand	Anodyne	ADRB3	40	39
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819018438	ED	On-Demand	Anodyne	MTNR1A	17	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819018438	ED	On-Demand	Anodyne	MTNR1B	16	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819018439	ED	On-Demand	Anodyne	ADRB3	40	39
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819018439	ED	On-Demand	Anodyne	MTNR1A	17	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819018439	ED	On-Demand	Anodyne	MTNR1B	16	40
O=C(CN1CCN(C(=O)C(F)=C2CCC2)CC1)Nc1ccc(F)cc1	ZINC000819018462	EE	On-Demand	Anodyne	SLC27A1	56	41
CCC[C@@H](NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)c1ccccn1	ZINC000819018464	GH	On-Demand	Anodyne	GPR119	22	40
CCC[C@H](NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)c1ccccn1	ZINC000819018467	GH	On-Demand	Anodyne	GPR119	22	40
CCC[C@@H](NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)c1ccccn1	ZINC000819018469	GH	On-Demand	Anodyne	GPR119	22	40
CCC[C@H](NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)c1ccccn1	ZINC000819018471	GH	On-Demand	Anodyne	GPR119	22	40
CCCCNC(=O)CN1CCN(C(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819018473	GE	On-Demand	Anodyne	HRH2	35	43
CCCCNC(=O)CN1CCN(C(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819018473	GE	On-Demand	Anodyne	MTNR1A	18	43
CCCCNC(=O)CN1CCN(C(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819018473	GE	On-Demand	Anodyne	MTNR1B	17	43
CCCCNC(=O)CN1CCN(C(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819018493	GC	On-Demand	Anodyne	DRD4	47	37
CCCCNC(=O)CN1CCN(C(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819018493	GC	On-Demand	Anodyne	MTNR1A	38	41
CCCCNC(=O)CN1CCN(C(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819018493	GC	On-Demand	Anodyne	MTNR1B	40	41
CCCCNC(=O)CN1CCN(C(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819018494	GC	On-Demand	Anodyne	DRD4	47	37
CCCCNC(=O)CN1CCN(C(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819018494	GC	On-Demand	Anodyne	MTNR1A	38	41
CCCCNC(=O)CN1CCN(C(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819018494	GC	On-Demand	Anodyne	MTNR1B	40	41
O=C(Nc1ccc(CN2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819018503	DF	On-Demand	Anodyne	EPHX2	24	41
O=C(Nc1ccc(CN2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819018503	DF	On-Demand	Anodyne	NOD2	41	34
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819018525	FG	On-Demand	Anodyne	ADRB2	74	47
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819018525	FG	On-Demand	Anodyne	ADRB1	104	52
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819018525	FG	On-Demand	Anodyne	ADRB3	116	49
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819018525	FG	On-Demand	Anodyne	ESRRG	43	32
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819018525	FG	On-Demand	Anodyne	UTS2	42	35
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccnc1	ZINC000819018530	BD	On-Demand	Anodyne	KCNQ2	51	41
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccnc1	ZINC000819018530	BD	On-Demand	Anodyne	KCNA5	20	42
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccnc1	ZINC000819018530	BD	On-Demand	Anodyne	UL26	72	33
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccnc1	ZINC000819018530	BD	On-Demand	Anodyne	SCAF_EBVB9	66	32
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccnc1	ZINC000819018531	BD	On-Demand	Anodyne	KCNQ2	51	41
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccnc1	ZINC000819018531	BD	On-Demand	Anodyne	KCNA5	20	42
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccnc1	ZINC000819018531	BD	On-Demand	Anodyne	UL26	72	33
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccnc1	ZINC000819018531	BD	On-Demand	Anodyne	SCAF_EBVB9	66	32
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccnc1	ZINC000819018532	BD	On-Demand	Anodyne	KCNQ2	51	41
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccnc1	ZINC000819018532	BD	On-Demand	Anodyne	KCNA5	20	42
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccnc1	ZINC000819018532	BD	On-Demand	Anodyne	UL26	72	33
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccnc1	ZINC000819018532	BD	On-Demand	Anodyne	SCAF_EBVB9	66	32
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccnc1	ZINC000819018533	BD	On-Demand	Anodyne	KCNQ2	51	41
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccnc1	ZINC000819018533	BD	On-Demand	Anodyne	KCNA5	20	42
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccnc1	ZINC000819018533	BD	On-Demand	Anodyne	UL26	72	33
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccnc1	ZINC000819018533	BD	On-Demand	Anodyne	SCAF_EBVB9	66	32
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819018588	EF	On-Demand	Anodyne	ADRB2	52	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819018588	EF	On-Demand	Anodyne	ADRB1	71	46
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819018588	EF	On-Demand	Anodyne	DRD4	19	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819018588	EF	On-Demand	Anodyne	ADRB3	84	46
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819018588	EF	On-Demand	Anodyne	MTNR1A	24	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819018588	EF	On-Demand	Anodyne	MTNR1B	23	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819018589	EF	On-Demand	Anodyne	ADRB2	52	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819018589	EF	On-Demand	Anodyne	ADRB1	71	46
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819018589	EF	On-Demand	Anodyne	DRD4	19	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819018589	EF	On-Demand	Anodyne	ADRB3	84	46
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819018589	EF	On-Demand	Anodyne	MTNR1A	24	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819018589	EF	On-Demand	Anodyne	MTNR1B	23	43
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1	ZINC000819018594	GE	On-Demand	Anodyne	HTR1A	61	53
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1	ZINC000819018594	GE	On-Demand	Anodyne	DRD2	55	44
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1	ZINC000819018594	GE	On-Demand	Anodyne	DRD1	15	44
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1	ZINC000819018594	GE	On-Demand	Anodyne	DRD4	49	44
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1	ZINC000819018594	GE	On-Demand	Anodyne	ADRA1D	15	40
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1	ZINC000819018594	GE	On-Demand	Anodyne	HTR2A	45	47
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1	ZINC000819018594	GE	On-Demand	Anodyne	HTR2C	18	41
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1	ZINC000819018594	GE	On-Demand	Anodyne	ADRA1A	20	40
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1	ZINC000819018594	GE	On-Demand	Anodyne	DRD3	56	45
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1	ZINC000819018594	GE	On-Demand	Anodyne	HRP1_PLAFA	67	36
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1	ZINC000819018594	GE	On-Demand	Anodyne	HTR7	39	42
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccc(Cl)cc1	ZINC000819018594	GE	On-Demand	Anodyne	AKT3	43	35
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819018596	GG	On-Demand	Anodyne	ADRB2	43	39
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819018596	GG	On-Demand	Anodyne	ADRB1	62	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819018596	GG	On-Demand	Anodyne	ADRB3	70	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819018596	GG	On-Demand	Anodyne	MTNR1A	24	42
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819018596	GG	On-Demand	Anodyne	MTNR1B	22	42
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819018597	GG	On-Demand	Anodyne	ADRB2	43	39
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819018597	GG	On-Demand	Anodyne	ADRB1	62	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819018597	GG	On-Demand	Anodyne	ADRB3	70	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819018597	GG	On-Demand	Anodyne	MTNR1A	24	42
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819018597	GG	On-Demand	Anodyne	MTNR1B	22	42
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819018604	GG	On-Demand	Anodyne	ADRB1	51	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819018604	GG	On-Demand	Anodyne	HRH2	17	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819018604	GG	On-Demand	Anodyne	ADRB3	66	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819018604	GG	On-Demand	Anodyne	MTNR1A	19	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819018604	GG	On-Demand	Anodyne	MTNR1B	18	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819018604	GG	On-Demand	Anodyne	EPHX2	25	45
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819018604	GG	On-Demand	Anodyne	PDS	41	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819018605	GG	On-Demand	Anodyne	ADRB1	51	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819018605	GG	On-Demand	Anodyne	HRH2	17	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819018605	GG	On-Demand	Anodyne	ADRB3	66	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819018605	GG	On-Demand	Anodyne	MTNR1A	19	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819018605	GG	On-Demand	Anodyne	MTNR1B	18	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819018605	GG	On-Demand	Anodyne	EPHX2	25	45
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819018605	GG	On-Demand	Anodyne	PDS	41	40
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc2c(c1)OCCO2	ZINC000819018606	DE	On-Demand	Anodyne	KCNQ2	45	50
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc2c(c1)OCCO2	ZINC000819018607	DE	On-Demand	Anodyne	KCNQ2	45	50
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc2c(c1)OCCO2	ZINC000819018608	DE	On-Demand	Anodyne	KCNQ2	45	50
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc2c(c1)OCCO2	ZINC000819018609	DE	On-Demand	Anodyne	KCNQ2	45	50
OC1(CNCCCCN2CCN(c3ncccn3)CC2)CCCCC1	ZINC000819018610	ED	On-Demand	Anodyne	HTR1A	40	52
OC1(CNCCCCN2CCN(c3ncccn3)CC2)CCCCC1	ZINC000819018610	ED	On-Demand	Anodyne	DRD2	35	52
OC1(CNCCCCN2CCN(c3ncccn3)CC2)CCCCC1	ZINC000819018610	ED	On-Demand	Anodyne	DRD4	17	44
OC1(CNCCCCN2CCN(c3ncccn3)CC2)CCCCC1	ZINC000819018610	ED	On-Demand	Anodyne	HTR2A	17	52
OC1(CNCCCCN2CCN(c3ncccn3)CC2)CCCCC1	ZINC000819018610	ED	On-Demand	Anodyne	DRD3	29	52
OC1(CNCCCCN2CCN(c3ncccn3)CC2)CCCCC1	ZINC000819018610	ED	On-Demand	Anodyne	HTR7	15	42
OC1(CNCCCCN2CCN(c3ncccn3)CC2)CCCCC1	ZINC000819018610	ED	On-Demand	Anodyne	HNMT	43	35
CCC[C@@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccccn1	ZINC000819018612	EF	On-Demand	Anodyne	ADRB3	17	44
CCC[C@H](NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccccn1	ZINC000819018613	EF	On-Demand	Anodyne	ADRB3	17	44
CCC[C@@H](NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccccn1	ZINC000819018614	EF	On-Demand	Anodyne	ADRB3	17	44
CCC[C@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccccn1	ZINC000819018615	EF	On-Demand	Anodyne	ADRB3	17	44
O[C@H](CNCc1n[nH]cc1Br)c1cccnc1	ZINC000819018626	CD	On-Demand	Anodyne	ADRB2	21	47
O[C@H](CNCc1n[nH]cc1Br)c1cccnc1	ZINC000819018626	CD	On-Demand	Anodyne	ADRB1	23	47
O[C@H](CNCc1n[nH]cc1Br)c1cccnc1	ZINC000819018626	CD	On-Demand	Anodyne	ADRB3	87	47
O[C@@H](CNCc1n[nH]cc1Br)c1cccnc1	ZINC000819018627	CD	On-Demand	Anodyne	ADRB2	21	47
O[C@@H](CNCc1n[nH]cc1Br)c1cccnc1	ZINC000819018627	CD	On-Demand	Anodyne	ADRB1	23	47
O[C@@H](CNCc1n[nH]cc1Br)c1cccnc1	ZINC000819018627	CD	On-Demand	Anodyne	ADRB3	87	47
CN(C)CCOc1ccc(CCNC[C@H](O)c2cccc3ccccc23)cc1	ZINC000819018628	GH	On-Demand	Anodyne	ADRB2	82	43
CN(C)CCOc1ccc(CCNC[C@H](O)c2cccc3ccccc23)cc1	ZINC000819018628	GH	On-Demand	Anodyne	ADRB1	106	45
CN(C)CCOc1ccc(CCNC[C@H](O)c2cccc3ccccc23)cc1	ZINC000819018628	GH	On-Demand	Anodyne	ADRB3	96	44
CN(C)CCOc1ccc(CCNC[C@H](O)c2cccc3ccccc23)cc1	ZINC000819018628	GH	On-Demand	Anodyne	LTA4H	15	44
CN(C)CCOc1ccc(CCNC[C@H](O)c2cccc3ccccc23)cc1	ZINC000819018628	GH	On-Demand	Anodyne	ESRRG	49	37
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819018629	GG	On-Demand	Anodyne	ADRB2	62	47
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819018629	GG	On-Demand	Anodyne	ADRB1	86	49
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819018629	GG	On-Demand	Anodyne	GRIN1	24	48
CN(C)CCOc1ccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819018629	GG	On-Demand	Anodyne	ADRB3	97	46
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819018630	GG	On-Demand	Anodyne	ADRB2	62	47
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819018630	GG	On-Demand	Anodyne	ADRB1	86	49
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819018630	GG	On-Demand	Anodyne	GRIN1	24	48
CN(C)CCOc1ccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819018630	GG	On-Demand	Anodyne	ADRB3	97	46
CC(=O)Nc1cccc(OCCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819018631	FF	On-Demand	Anodyne	ADRB1	46	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819018631	FF	On-Demand	Anodyne	MTNR1A	26	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819018631	FF	On-Demand	Anodyne	MTNR1B	23	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819018632	FF	On-Demand	Anodyne	ADRB1	46	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819018632	FF	On-Demand	Anodyne	MTNR1A	26	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819018632	FF	On-Demand	Anodyne	MTNR1B	23	43
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018653	FD	On-Demand	Anodyne	HTR1A	88	66
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018653	FD	On-Demand	Anodyne	DRD2	75	49
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018653	FD	On-Demand	Anodyne	DRD4	55	49
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018653	FD	On-Demand	Anodyne	ADRA1D	20	44
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018653	FD	On-Demand	Anodyne	HTR2A	52	49
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018653	FD	On-Demand	Anodyne	HTR2C	22	47
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018653	FD	On-Demand	Anodyne	SLC6A4	15	41
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018653	FD	On-Demand	Anodyne	ADRA1A	24	47
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018653	FD	On-Demand	Anodyne	DRD3	81	50
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018653	FD	On-Demand	Anodyne	ADRB3	57	38
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018653	FD	On-Demand	Anodyne	HTR7	64	49
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018653	FD	On-Demand	Anodyne	SIGMAR1	16	58
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018654	FD	On-Demand	Anodyne	HTR1A	88	66
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018654	FD	On-Demand	Anodyne	DRD2	75	49
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018654	FD	On-Demand	Anodyne	DRD4	55	49
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018654	FD	On-Demand	Anodyne	ADRA1D	20	44
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018654	FD	On-Demand	Anodyne	HTR2A	52	49
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018654	FD	On-Demand	Anodyne	HTR2C	22	47
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018654	FD	On-Demand	Anodyne	SLC6A4	15	41
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018654	FD	On-Demand	Anodyne	ADRA1A	24	47
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018654	FD	On-Demand	Anodyne	DRD3	81	50
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018654	FD	On-Demand	Anodyne	ADRB3	57	38
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018654	FD	On-Demand	Anodyne	HTR7	64	49
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)c1ccccc1	ZINC000819018654	FD	On-Demand	Anodyne	SIGMAR1	16	58
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819018655	EG	On-Demand	Anodyne	ADRB2	39	42
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819018655	EG	On-Demand	Anodyne	ADRB1	66	44
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819018655	EG	On-Demand	Anodyne	DRD4	15	44
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819018655	EG	On-Demand	Anodyne	ADRB3	52	44
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819018655	EG	On-Demand	Anodyne	MTNR1A	22	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819018655	EG	On-Demand	Anodyne	MTNR1B	19	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819018655	EG	On-Demand	Anodyne	KCNK3	46	34
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819018655	EG	On-Demand	Anodyne	KCNK9	40	34
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819018664	FG	On-Demand	Anodyne	ADRB2	41	39
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819018664	FG	On-Demand	Anodyne	ADRB1	60	45
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819018664	FG	On-Demand	Anodyne	ADRB3	70	45
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819018665	FG	On-Demand	Anodyne	ADRB2	41	39
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819018665	FG	On-Demand	Anodyne	ADRB1	60	45
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819018665	FG	On-Demand	Anodyne	ADRB3	70	45
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819018676	EE	On-Demand	Anodyne	ADRB2	55	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819018676	EE	On-Demand	Anodyne	ADRB1	75	44
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819018676	EE	On-Demand	Anodyne	ADRB3	90	44
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819018676	EE	On-Demand	Anodyne	MTNR1A	25	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819018676	EE	On-Demand	Anodyne	MTNR1B	24	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819018676	EE	On-Demand	Anodyne	EPHX2	19	42
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819018677	EE	On-Demand	Anodyne	ADRB2	55	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819018677	EE	On-Demand	Anodyne	ADRB1	75	44
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819018677	EE	On-Demand	Anodyne	ADRB3	90	44
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819018677	EE	On-Demand	Anodyne	MTNR1A	25	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819018677	EE	On-Demand	Anodyne	MTNR1B	24	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819018677	EE	On-Demand	Anodyne	EPHX2	19	42
CC(C)(C)CCCCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819018685	EF	On-Demand	Anodyne	ADRB2	28	48
CC(C)(C)CCCCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819018685	EF	On-Demand	Anodyne	ADRB3	49	38
CC(C)(C)CCCCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819018686	EF	On-Demand	Anodyne	ADRB2	28	48
CC(C)(C)CCCCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819018686	EF	On-Demand	Anodyne	ADRB3	49	38
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)C1CC1	ZINC000819018697	DC	On-Demand	Anodyne	HTR1A	43	54
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)C1CC1	ZINC000819018697	DC	On-Demand	Anodyne	DRD2	35	50
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)C1CC1	ZINC000819018697	DC	On-Demand	Anodyne	DRD4	19	46
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)C1CC1	ZINC000819018697	DC	On-Demand	Anodyne	HTR2A	19	44
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)C1CC1	ZINC000819018697	DC	On-Demand	Anodyne	DRD3	33	46
O[C@@H](CNCCCCN1CCN(c2ncccn2)CC1)C1CC1	ZINC000819018697	DC	On-Demand	Anodyne	HTR7	15	42
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)C1CC1	ZINC000819018698	DC	On-Demand	Anodyne	HTR1A	43	54
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)C1CC1	ZINC000819018698	DC	On-Demand	Anodyne	DRD2	35	50
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)C1CC1	ZINC000819018698	DC	On-Demand	Anodyne	DRD4	19	46
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)C1CC1	ZINC000819018698	DC	On-Demand	Anodyne	HTR2A	19	44
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)C1CC1	ZINC000819018698	DC	On-Demand	Anodyne	DRD3	33	46
O[C@H](CNCCCCN1CCN(c2ncccn2)CC1)C1CC1	ZINC000819018698	DC	On-Demand	Anodyne	HTR7	15	42
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2C)c1	ZINC000819018714	EF	On-Demand	Anodyne	ADRB2	40	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2C)c1	ZINC000819018714	EF	On-Demand	Anodyne	ADRB1	62	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2C)c1	ZINC000819018714	EF	On-Demand	Anodyne	DRD4	15	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2C)c1	ZINC000819018714	EF	On-Demand	Anodyne	ADRB3	47	41
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2C)c1	ZINC000819018714	EF	On-Demand	Anodyne	MTNR1A	24	42
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2C)c1	ZINC000819018714	EF	On-Demand	Anodyne	MTNR1B	21	42
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2C)c1	ZINC000819018714	EF	On-Demand	Anodyne	KCNK3	51	35
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccccc2C)c1	ZINC000819018714	EF	On-Demand	Anodyne	KCNK9	58	34
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2C)c1	ZINC000819018715	EF	On-Demand	Anodyne	ADRB2	40	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2C)c1	ZINC000819018715	EF	On-Demand	Anodyne	ADRB1	62	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2C)c1	ZINC000819018715	EF	On-Demand	Anodyne	DRD4	15	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2C)c1	ZINC000819018715	EF	On-Demand	Anodyne	ADRB3	47	41
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2C)c1	ZINC000819018715	EF	On-Demand	Anodyne	MTNR1A	24	42
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2C)c1	ZINC000819018715	EF	On-Demand	Anodyne	MTNR1B	21	42
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2C)c1	ZINC000819018715	EF	On-Demand	Anodyne	KCNK3	51	35
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccccc2C)c1	ZINC000819018715	EF	On-Demand	Anodyne	KCNK9	58	34
Cc1nn(-c2ccc(F)cc2)c(Cl)c1CNCCC(=O)O	ZINC000819018717	DF	On-Demand	Anodyne	P2RX7	36	46
Cc1nn(-c2ccccc2)cc1CCCNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819018718	GG	On-Demand	Anodyne	FURIN	45	32
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819018719	FE	On-Demand	Anodyne	MME	19	43
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819018719	FE	On-Demand	Anodyne	ANPEP	30	40
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819018719	FE	On-Demand	Anodyne	RNPEP	21	40
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819018719	FE	On-Demand	Anodyne	CAPNS1	49	36
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819018719	FE	On-Demand	Anodyne	CAPN1	52	40
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819018719	FE	On-Demand	Anodyne	CAPN2	74	33
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819018719	FE	On-Demand	Anodyne	FPR1	82	38
Cc1nn(-c2ccccc2)c(C)c1NC(=O)C(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819018719	FE	On-Demand	Anodyne	NPR	42	35
Cc1nn(-c2ccc(Cl)c(Cl)c2)c(NC(=O)N[C@H](C)C(=O)O)c1C	ZINC000819018723	FG	On-Demand	Anodyne	RPA1	75	40
Cc1nn(-c2ccc(Cl)c(Cl)c2)c(NC(=O)N[C@@H](C)C(=O)O)c1C	ZINC000819018724	FG	On-Demand	Anodyne	RPA1	75	40
Cc1nn(-c2ccccc2)c(C)c1CNc1cccc(CC(=O)O)c1	ZINC000819018728	EH	On-Demand	Anodyne	P2RX7	23	54
Cc1nn(-c2ccccc2)c(C)c1CNc1cccc(CC(=O)O)c1	ZINC000819018728	EH	On-Demand	Anodyne	NR1H2	18	40
Cc1nn(-c2ccccc2)c(C)c1NC(=O)NCC(=O)O	ZINC000819018730	CD	On-Demand	Anodyne	P2RX7	15	62
Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@@H](C)N1CC[C@H](C(=O)O)C1	ZINC000819018734	FE	On-Demand	Anodyne	SLC6A1	40	33
Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)N1CC[C@H](C(=O)O)C1	ZINC000819018735	FE	On-Demand	Anodyne	SLC6A1	40	33
Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@@H](C)N1CC[C@@H](C(=O)O)C1	ZINC000819018736	FE	On-Demand	Anodyne	SLC6A1	40	33
Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)N1CC[C@@H](C(=O)O)C1	ZINC000819018737	FE	On-Demand	Anodyne	SLC6A1	40	33
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)Nc1ccccc1CC(=O)O	ZINC000819018744	GG	On-Demand	Anodyne	P2RX7	32	58
Cc1nn(-c2ccc(Cl)c(Cl)c2)c(NC(=O)NCC(=O)O)c1C	ZINC000819018747	FG	On-Demand	Anodyne	P2RX7	18	42
Cc1nn(-c2ccc(Cl)c(Cl)c2)c(NC(=O)NCC(=O)O)c1C	ZINC000819018747	FG	On-Demand	Anodyne	RPA1	98	40
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)Nc1ccccc1CC(=O)O	ZINC000819018748	FH	On-Demand	Anodyne	CXCL8	31	42
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)Nc1ccccc1CC(=O)O	ZINC000819018748	FH	On-Demand	Anodyne	P2RX7	17	47
Cc1nn(-c2ccccc2)cc1CNc1cccc(CC(=O)O)c1	ZINC000819018751	DG	On-Demand	Anodyne	NR1H2	23	43
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H](C(=O)O)C(C)C	ZINC000819018752	EF	On-Demand	Anodyne	FPR1	25	42
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@@H](C(=O)O)C(C)C	ZINC000819018753	EF	On-Demand	Anodyne	FPR1	25	42
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN(C)[C@@H](C)C(=O)O	ZINC000819018754	ED	On-Demand	Anodyne	P2RX7	28	58
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN(C)[C@H](C)C(=O)O	ZINC000819018755	ED	On-Demand	Anodyne	P2RX7	28	58
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819018758	FD	On-Demand	Anodyne	SLC6A1	105	38
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819018758	FD	On-Demand	Anodyne	P2RX7	26	56
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819018759	FD	On-Demand	Anodyne	SLC6A1	105	38
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819018759	FD	On-Demand	Anodyne	P2RX7	26	56
Cc1nn(-c2ccccc2)c(C)c1NC(=O)CCN1CC[C@H](C(=O)O)C1	ZINC000819018760	FE	On-Demand	Anodyne	SLC6A1	158	41
Cc1nn(-c2ccccc2)c(C)c1NC(=O)CCN1CC[C@@H](C(=O)O)C1	ZINC000819018761	FE	On-Demand	Anodyne	SLC6A1	158	41
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN(C)CCC(=O)O	ZINC000819018762	ED	On-Demand	Anodyne	P2RX7	34	62
Cc1nn(-c2ccccc2)c(Cl)c1C[S@](=O)Cc1ccc(C(=O)O)cc1	ZINC000819018765	GH	On-Demand	Anodyne	RPA1	43	33
Cc1nn(-c2ccccc2)c(Cl)c1C[S@@](=O)Cc1ccc(C(=O)O)cc1	ZINC000819018766	GH	On-Demand	Anodyne	RPA1	43	33
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN1CCC[C@@H](CC(=O)O)C1	ZINC000819018774	GE	On-Demand	Anodyne	P2RX7	20	51
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)CN1CCC[C@H](CC(=O)O)C1	ZINC000819018775	GE	On-Demand	Anodyne	P2RX7	20	51
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819018777	EG	On-Demand	Anodyne	MME	23	43
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819018777	EG	On-Demand	Anodyne	ANPEP	38	45
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819018777	EG	On-Demand	Anodyne	RNPEP	22	40
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819018777	EG	On-Demand	Anodyne	CTSB	19	40
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819018777	EG	On-Demand	Anodyne	CTSK	20	40
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819018777	EG	On-Demand	Anodyne	CAPN1	44	40
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819018777	EG	On-Demand	Anodyne	CAPN2	45	33
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819018777	EG	On-Demand	Anodyne	LAP3	15	40
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819018777	EG	On-Demand	Anodyne	FPR1	86	46
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819018777	EG	On-Demand	Anodyne	NPR	48	36
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819018777	EG	On-Demand	Anodyne	AMP1_PLAFQ	15	40
Cc1nn(-c2ccccc2)c(C)c1NC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819018782	FH	On-Demand	Anodyne	P2RX7	15	60
Cc1nn(-c2ccccc2)c(C)c1NC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819018782	FH	On-Demand	Anodyne	RPA1	50	35
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N1CCC[C@H]1C(=O)O	ZINC000819018783	EF	On-Demand	Anodyne	ACE	55	41
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N1CCC[C@H]1C(=O)O	ZINC000819018783	EF	On-Demand	Anodyne	FKBP1A	21	40
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N1CCC[C@H]1C(=O)O	ZINC000819018783	EF	On-Demand	Anodyne	MME	15	40
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N1CCC[C@H]1C(=O)O	ZINC000819018783	EF	On-Demand	Anodyne	PREP	62	38
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N1CCC[C@@H]1C(=O)O	ZINC000819018784	EF	On-Demand	Anodyne	ACE	55	41
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N1CCC[C@@H]1C(=O)O	ZINC000819018784	EF	On-Demand	Anodyne	FKBP1A	21	40
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N1CCC[C@@H]1C(=O)O	ZINC000819018784	EF	On-Demand	Anodyne	MME	15	40
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N1CCC[C@@H]1C(=O)O	ZINC000819018784	EF	On-Demand	Anodyne	PREP	62	38
Cc1ncsc1CNc1cccc(CC(=O)O)c1	ZINC000819018795	CF	On-Demand	Anodyne	NR1H3	19	45
Cc1ncsc1CNc1cccc(CC(=O)O)c1	ZINC000819018795	CF	On-Demand	Anodyne	NR1H2	33	45
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819018796	GG	On-Demand	Anodyne	P2RX7	27	56
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819018796	GG	On-Demand	Anodyne	RPA1	50	35
Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819018799	ED	On-Demand	Anodyne	DRD4	17	42
Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819018799	ED	On-Demand	Anodyne	SLC6A1	123	40
Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819018800	ED	On-Demand	Anodyne	DRD4	17	42
Cc1nn(-c2ccccc2)c(C)c1NC(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819018800	ED	On-Demand	Anodyne	SLC6A1	123	40
Cc1nn(-c2ccc(F)cc2)c(C)c1CNc1cccc(CC(=O)O)c1	ZINC000819018807	FH	On-Demand	Anodyne	P2RX7	32	48
Cc1nn(-c2ccc(F)cc2)c(C)c1CNc1cccc(CC(=O)O)c1	ZINC000819018807	FH	On-Demand	Anodyne	PTGDR2	23	46
Cc1nn(-c2ccc(F)cc2)c(C)c1CNc1cccc(CC(=O)O)c1	ZINC000819018807	FH	On-Demand	Anodyne	HAO2	72	36
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819018821	FE	On-Demand	Bother	ADRB2	27	45
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819018821	FE	On-Demand	Bother	ADRB1	50	45
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819018821	FE	On-Demand	Bother	ADRB3	68	45
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819018821	FE	On-Demand	Bother	CACNA1D	46	35
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819018822	FE	On-Demand	Bother	ADRB2	27	45
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819018822	FE	On-Demand	Bother	ADRB1	50	45
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819018822	FE	On-Demand	Bother	ADRB3	68	45
CC(=O)Nc1cccc(OCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819018822	FE	On-Demand	Bother	CACNA1D	46	35
CCC[C@@H](NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccccn1	ZINC000819018833	GF	On-Demand	Clean	HTR2A	15	43
CCC[C@H](NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccccn1	ZINC000819018834	GF	On-Demand	Clean	HTR2A	15	43
CCC[C@@H](NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccccn1	ZINC000819018835	GF	On-Demand	Clean	HTR2A	15	43
CCC[C@H](NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccccn1	ZINC000819018836	GF	On-Demand	Clean	HTR2A	15	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(N3CCN(C)CC3)cc1)C2	ZINC000819018849	GE	On-Demand	Anodyne	PRNP	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(N3CCN(C)CC3)cc1)C2	ZINC000819018849	GE	On-Demand	Anodyne	MTOR	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(N3CCN(C)CC3)cc1)C2	ZINC000819018850	GE	On-Demand	Anodyne	PRNP	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(N3CCN(C)CC3)cc1)C2	ZINC000819018850	GE	On-Demand	Anodyne	MTOR	17	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819018851	EE	On-Demand	Mild	ADRB2	36	42
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819018851	EE	On-Demand	Mild	ADRB1	64	45
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819018851	EE	On-Demand	Mild	ADRB3	60	43
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819018851	EE	On-Demand	Mild	MTNR1A	19	40
CC(=O)Nc1cccc(OCCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819018851	EE	On-Demand	Mild	MTNR1B	19	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819018852	EE	On-Demand	Mild	ADRB2	36	42
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819018852	EE	On-Demand	Mild	ADRB1	64	45
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819018852	EE	On-Demand	Mild	ADRB3	60	43
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819018852	EE	On-Demand	Mild	MTNR1A	19	40
CC(=O)Nc1cccc(OCCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819018852	EE	On-Demand	Mild	MTNR1B	19	40
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2ccccc2)cs1	ZINC000819018905	DG	On-Demand	Anodyne	MAOB	16	42
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2ccccc2)cs1	ZINC000819018905	DG	On-Demand	Anodyne	ROCK1	20	44
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2ccccc2)cs1	ZINC000819018906	DG	On-Demand	Anodyne	MAOB	16	42
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2ccccc2)cs1	ZINC000819018906	DG	On-Demand	Anodyne	ROCK1	20	44
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2ccccc2)cs1	ZINC000819018907	DG	On-Demand	Anodyne	MAOB	16	42
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2ccccc2)cs1	ZINC000819018907	DG	On-Demand	Anodyne	ROCK1	20	44
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2ccccc2)cs1	ZINC000819018908	DG	On-Demand	Anodyne	MAOB	16	42
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2ccccc2)cs1	ZINC000819018908	DG	On-Demand	Anodyne	ROCK1	20	44
CC(=O)[C@H](OC(=O)CSc1ccccc1[N+](=O)[O-])c1ccccc1	ZINC000819018958	EH	On-Demand	Bother	COLA	51	37
CC(=O)[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])c1ccccc1	ZINC000819018959	EH	On-Demand	Bother	COLA	51	37
C[C@@H]1CCCCN1CCCNC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819018992	EE	On-Demand	Anodyne	HRH3	18	44
C[C@H]1CCCCN1CCCNC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819018993	EE	On-Demand	Anodyne	HRH3	18	44
C[C@H](NC[C@H](O)c1ccc(OC(F)(F)F)cc1)[C@H](C)N1CCOCC1	ZINC000819019002	FE	On-Demand	Anodyne	CTSS	16	42
C[C@H](NC[C@H](O)c1ccc(OC(F)(F)F)cc1)[C@@H](C)N1CCOCC1	ZINC000819019003	FE	On-Demand	Anodyne	CTSS	16	42
CC(=O)N(c1ccc(NC(=O)c2ccc(C)c(C#N)c2)cc1)C1CC1	ZINC000819019026	EH	On-Demand	Mild	ABL1	46	38
CC(=O)N(c1ccc(NC(=O)c2ccc(C)c(C#N)c2)cc1)C1CC1	ZINC000819019026	EH	On-Demand	Mild	DDR1	52	39
O=C(c1cc(Br)cnc1Cl)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019032	HJ	On-Demand	Anodyne	GPBAR1	64	44
O=C(c1cc(Br)cnc1Cl)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019042	HJ	On-Demand	Anodyne	GPBAR1	64	44
O=C([C@@H]1C[C@H]1c1ccccc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019045	EI	On-Demand	Anodyne	CCR5	29	42
O=C([C@@H]1C[C@H]1c1ccccc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019052	EI	On-Demand	Anodyne	CCR5	29	42
NC(=S)c1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1	ZINC000819019053	FG	On-Demand	Anodyne	AVPR2	56	43
NC(=S)c1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1	ZINC000819019053	FG	On-Demand	Anodyne	L3MBTL3	65	36
NC(=S)c1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1	ZINC000819019055	FG	On-Demand	Anodyne	AVPR2	56	43
NC(=S)c1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1	ZINC000819019055	FG	On-Demand	Anodyne	L3MBTL3	65	36
CCOC(=O)N1CCC(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)CC1	ZINC000819019067	FG	On-Demand	Anodyne	CHRM4	16	43
CCOC(=O)N1CCC(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)CC1	ZINC000819019067	FG	On-Demand	Anodyne	GPBAR1	41	37
CCOC(=O)N1CCC(C(=O)N2C[C@H]3CCCCN3c3ccccc32)CC1	ZINC000819019069	FG	On-Demand	Anodyne	CHRM4	16	43
CCOC(=O)N1CCC(C(=O)N2C[C@H]3CCCCN3c3ccccc32)CC1	ZINC000819019069	FG	On-Demand	Anodyne	GPBAR1	41	37
CC(=O)N(c1ccc(NC(=O)c2ccc3c(c2)-c2ccccc2C3)cc1)C1CC1	ZINC000819019078	GK	On-Demand	Anodyne	KCNK3	42	37
COc1ccc2c(C)c(CCC(=O)N3C[C@H]4CCCCN4c4ccccc43)c(=O)oc2c1	ZINC000819019111	II	On-Demand	Anodyne	MAOB	28	40
C[C@@H](Cc1ccccc1)NC(=S)NCCCCS(C)(=O)=O	ZINC000819019113	ED	On-Demand	Anodyne	MME	45	47
C[C@@H](Cc1ccccc1)NC(=S)NCCCCS(C)(=O)=O	ZINC000819019113	ED	On-Demand	Anodyne	CAPN2	45	33
C[C@@H](Cc1ccccc1)NC(=S)NCCCCS(C)(=O)=O	ZINC000819019113	ED	On-Demand	Anodyne	NPFFR1	44	31
COc1ccc2c(C)c(CCC(=O)N3C[C@@H]4CCCCN4c4ccccc43)c(=O)oc2c1	ZINC000819019115	II	On-Demand	Anodyne	MAOB	28	40
C[C@H](NC[C@H](O)c1ccccc1)[C@H](C)N1CCOCC1	ZINC000819019119	CD	On-Demand	Anodyne	ADRB3	25	42
C[C@H](NC[C@H](O)c1ccccc1)[C@@H](C)N1CCOCC1	ZINC000819019121	CD	On-Demand	Anodyne	ADRB3	25	42
C#CCNS(=O)(=O)c1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1	ZINC000819019126	HF	On-Demand	Mild	AVPR2	50	36
C#CCNS(=O)(=O)c1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1	ZINC000819019126	HF	On-Demand	Mild	SFRP1	79	33
C#CCNS(=O)(=O)c1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1	ZINC000819019126	HF	On-Demand	Mild	WNT3	54	33
C#CCNS(=O)(=O)c1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1	ZINC000819019129	HF	On-Demand	Mild	AVPR2	50	36
C#CCNS(=O)(=O)c1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1	ZINC000819019129	HF	On-Demand	Mild	SFRP1	79	33
C#CCNS(=O)(=O)c1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1	ZINC000819019129	HF	On-Demand	Mild	WNT3	54	33
CC(=O)N(c1ccc(NC(=O)C(O)(c2ccccc2)c2ccccc2)cc1)C1CC1	ZINC000819019131	HI	On-Demand	Anodyne	CHRM2	15	42
CC(=O)N(c1ccc(NC(=O)C(O)(c2ccccc2)c2ccccc2)cc1)C1CC1	ZINC000819019131	HI	On-Demand	Anodyne	CHRM3	18	42
CC(=O)N(c1ccc(NC(=O)C(O)(c2ccccc2)c2ccccc2)cc1)C1CC1	ZINC000819019131	HI	On-Demand	Anodyne	NPY2R	57	40
CC(=O)N(c1ccc(NC(=O)C(O)(c2ccccc2)c2ccccc2)cc1)C1CC1	ZINC000819019131	HI	On-Demand	Anodyne	AMY2	45	31
CC(=O)N(c1ccc(NC(=O)c2ccc(NC(=O)OCC(F)(F)F)cc2)cc1)C1CC1	ZINC000819019171	IJ	On-Demand	Anodyne	GIPR	45	36
CC(=O)N(c1ccc(NC(=O)c2cccc(Cl)c2O)cc1)C1CC1	ZINC000819019173	EH	On-Demand	Anodyne	TYK2	45	35
CC(=O)N(c1ccc(NC(=O)c2cccc(Cl)c2O)cc1)C1CC1	ZINC000819019173	EH	On-Demand	Anodyne	NR2E3	67	37
CC(=O)N(c1ccc(NC(=O)c2cccc(Cl)c2O)cc1)C1CC1	ZINC000819019173	EH	On-Demand	Anodyne	SMO	21	43
CC(=O)N(c1ccc(NC(=O)[C@H]2c3ccccc3CCN2C(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819019183	IJ	On-Demand	Anodyne	GHSR	17	46
CC(=O)N(c1ccc(NC(=O)[C@@H]2c3ccccc3CCN2C(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819019184	IJ	On-Demand	Anodyne	GHSR	17	46
CC(=O)N(c1ccc(NC(=O)c2ccc(CN3CCCCC3=O)cc2)cc1)C1CC1	ZINC000819019185	HH	On-Demand	Anodyne	GIPR	47	31
CC(=O)N(c1ccc(NC(=O)c2ccc(CN3CCCCC3=O)cc2)cc1)C1CC1	ZINC000819019185	HH	On-Demand	Anodyne	NOD2	47	39
CC(=O)N(c1ccc(NC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2Cl)cc1)C1CC1	ZINC000819019200	IK	On-Demand	Anodyne	NR2E3	60	33
CC(=O)N(c1ccc(NC(=O)CCCCNC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819019203	GH	On-Demand	Anodyne	HDAC8	16	42
CC(=O)N(c1ccc(NC(=O)CCCCNC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819019203	GH	On-Demand	Anodyne	HDAC10	18	42
O=C(c1cc(Cl)c(Cl)[nH]1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019208	FI	On-Demand	Anodyne	GPBAR1	37	40
O=C(c1cc(Cl)c(Cl)[nH]1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019209	FI	On-Demand	Anodyne	GPBAR1	37	40
C=CCn1cc(CNC(=S)Nc2ccc(C)c(C)c2)nn1	ZINC000819019217	DF	On-Demand	Mild	QPCT	47	37
CC(C)c1cccc(C(C)C)c1NC(=S)NCCCCS(C)(=O)=O	ZINC000819019236	FI	On-Demand	Anodyne	SOAT1	56	50
C=CCn1cc(CNC(=S)NC2CCN(Cc3ccccc3)CC2)nn1	ZINC000819019256	FE	On-Demand	Mild	DRD4	28	42
C=CCn1cc(CNC(=S)NC2CCN(Cc3ccccc3)CC2)nn1	ZINC000819019256	FE	On-Demand	Mild	ACHE	22	41
C=CCn1cc(CNC(=S)NC2CCN(Cc3ccccc3)CC2)nn1	ZINC000819019256	FE	On-Demand	Mild	SIGMAR1	32	45
C=CCn1cc(CNC(=S)NC2CCN(Cc3ccccc3)CC2)nn1	ZINC000819019256	FE	On-Demand	Mild	MCHR1	17	40
S=C(NC[C@@H]1C[C@H]1C1CCC1)Nc1ccc2c(c1)OCCCO2	ZINC000819019276	EH	On-Demand	Anodyne	QPCT	17	41
CC(C)c1cccc(NC(=S)NCCCCS(C)(=O)=O)c1	ZINC000819019283	EF	On-Demand	Anodyne	QPCT	49	34
O=C(c1ccc(S(F)(F)(F)(F)F)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019318	HK	On-Demand	Reactive	AVPR2	64	41
O=C(c1ccc(S(F)(F)(F)(F)F)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019318	HK	On-Demand	Reactive	AVPR1A	39	40
O=C(c1ccc(S(F)(F)(F)(F)F)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019318	HK	On-Demand	Reactive	GPBAR1	25	42
O=C(c1ccc(S(F)(F)(F)(F)F)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019318	HK	On-Demand	Reactive	L3MBTL3	68	37
O=C(c1ccc(S(F)(F)(F)(F)F)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019319	HK	On-Demand	Reactive	AVPR2	64	41
O=C(c1ccc(S(F)(F)(F)(F)F)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019319	HK	On-Demand	Reactive	AVPR1A	39	40
O=C(c1ccc(S(F)(F)(F)(F)F)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019319	HK	On-Demand	Reactive	GPBAR1	25	42
O=C(c1ccc(S(F)(F)(F)(F)F)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019319	HK	On-Demand	Reactive	L3MBTL3	68	37
CC(=O)N(c1ccc(NC(=O)c2csc(-c3ccccn3)n2)cc1)C1CC1	ZINC000819019320	GH	On-Demand	Anodyne	GRM4	59	39
O=C(Nc1ccc(O)c(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1)OCC(F)(F)F	ZINC000819019325	IJ	On-Demand	Anodyne	AVPR2	54	34
O=C(Nc1ccc(O)c(C(=O)N2C[C@H]3CCCCN3c3ccccc32)c1)OCC(F)(F)F	ZINC000819019326	IJ	On-Demand	Anodyne	AVPR2	54	34
O=C(c1ccc(-n2cccc2)nc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019340	FH	On-Demand	Anodyne	AVPR2	26	43
O=C(c1ccc(-n2cccc2)nc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019341	FH	On-Demand	Anodyne	AVPR2	26	43
CC(=O)N(c1ccc(NC(=O)Cn2c(SC(F)F)nc3ccccc32)cc1)C1CC1	ZINC000819019350	IJ	On-Demand	Anodyne	IMDH_CRYPV	35	42
O=C(c1ccc(C2SCCCS2)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019363	HK	On-Demand	Anodyne	AVPR2	56	38
O=C(c1ccc(C2SCCCS2)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019364	HK	On-Demand	Anodyne	AVPR2	56	38
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)cc1)C1CC1	ZINC000819019365	IG	On-Demand	Anodyne	CPT1A	70	38
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)cc1)C1CC1	ZINC000819019365	IG	On-Demand	Anodyne	CPT2	49	38
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)cc1)C1CC1	ZINC000819019365	IG	On-Demand	Anodyne	EPHX2	21	40
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)cc1)C1CC1	ZINC000819019365	IG	On-Demand	Anodyne	CPT1B	43	37
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)cc1)C1CC1	ZINC000819019365	IG	On-Demand	Anodyne	TAAR1	26	40
O=C1O[C@@H](c2ccccc2)Cc2cc(C(=O)N3C[C@H]4CCCCN4c4ccccc43)ccc21	ZINC000819019380	IK	On-Demand	Anodyne	AVPR2	40	37
O=C1O[C@@H](c2ccccc2)Cc2cc(C(=O)N3C[C@@H]4CCCCN4c4ccccc43)ccc21	ZINC000819019381	IK	On-Demand	Anodyne	AVPR2	40	37
O=C1O[C@H](c2ccccc2)Cc2cc(C(=O)N3C[C@H]4CCCCN4c4ccccc43)ccc21	ZINC000819019382	IK	On-Demand	Anodyne	AVPR2	40	37
O=C1O[C@H](c2ccccc2)Cc2cc(C(=O)N3C[C@@H]4CCCCN4c4ccccc43)ccc21	ZINC000819019383	IK	On-Demand	Anodyne	AVPR2	40	37
CC(=O)N(c1ccc(NC(=O)[C@H]2CC(=O)N(C3CCCC3)C2)cc1)C1CC1	ZINC000819019387	FF	On-Demand	Anodyne	INHA	25	55
CC(=O)N(c1ccc(NC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)cc1)C1CC1	ZINC000819019388	FF	On-Demand	Anodyne	INHA	25	55
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019392	FG	On-Demand	Anodyne	FPR1	41	36
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019394	FG	On-Demand	Anodyne	FPR1	41	36
O=C(c1ccc[n+]([O-])c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019402	DE	On-Demand	Anodyne	GPBAR1	18	40
O=C(c1ccc[n+]([O-])c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019403	DE	On-Demand	Anodyne	GPBAR1	18	40
CC(=O)N(c1ccc(NC(=O)c2ccc(-n3cnc4ccccc43)nc2)cc1)C1CC1	ZINC000819019404	HI	On-Demand	Anodyne	LCK	20	40
C=C[C@@H]1OCC[C@H]1CNC(=S)Nc1ccc(Cl)c(Cl)c1	ZINC000819019427	EH	On-Demand	Mild	TMK	25	40
C#Cc1cccc(NC(=S)NCCCCS(C)(=O)=O)c1	ZINC000819019443	DD	On-Demand	Mild	QPCT	44	33
C=CCn1cc(CNC(=S)Nc2ccc3c(c2)OCCCO3)nn1	ZINC000819019455	EE	On-Demand	Mild	QPCT	18	43
COc1ccc(N2CC[C@H](CNC(=S)Nc3ccc(C(N)=O)cc3)C2)cc1	ZINC000819019536	GF	On-Demand	Clean	F10	20	45
COc1ccc(N2CC[C@H](CNC(=S)Nc3ccc(C(N)=O)cc3)C2)cc1	ZINC000819019536	GF	On-Demand	Clean	CCR3	21	40
COc1ccc(N2CC[C@H](CNC(=S)Nc3ccc(C(N)=O)cc3)C2)cc1	ZINC000819019536	GF	On-Demand	Clean	ACR	46	41
COc1ccc(N2CC[C@H](CNC(=S)NCc3ccccc3)C2)cc1	ZINC000819019538	FG	On-Demand	Clean	GRIN2B	18	41
COc1ccc(N2CC[C@H](CNC(=S)NCc3ccccc3)C2)cc1	ZINC000819019538	FG	On-Demand	Clean	SIGMAR1	17	41
COc1ccc(N2CC[C@H](CNC(=S)NCc3ccccc3)C2)cc1	ZINC000819019538	FG	On-Demand	Clean	MMP13	21	43
COc1ccc(N2CC[C@H](CNC(=S)NCc3ccccc3)C2)cc1	ZINC000819019538	FG	On-Demand	Clean	MMP3	18	45
COc1ccc(N2CC[C@H](CNC(=S)NCc3ccccc3)C2)cc1	ZINC000819019538	FG	On-Demand	Clean	MMP9	15	45
COc1ccc(N2CC[C@H](CNC(=S)NCc3ccccc3)C2)cc1	ZINC000819019538	FG	On-Demand	Clean	MMP7	19	45
COc1ccc(N2CC[C@H](CNC(=S)NCc3ccccc3)C2)cc1	ZINC000819019538	FG	On-Demand	Clean	MMP1	18	45
S=C(NC[C@@H]1C[C@H]1C1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000819019541	FH	On-Demand	Anodyne	DRD4	33	46
S=C(NC[C@@H]1C[C@H]1C1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000819019541	FH	On-Demand	Anodyne	ACHE	31	44
S=C(NC[C@@H]1C[C@H]1C1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000819019541	FH	On-Demand	Anodyne	SIGMAR1	46	50
S=C(NC[C@@H]1C[C@H]1C1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000819019541	FH	On-Demand	Anodyne	MCHR1	17	44
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)[C@H](C)N1CCOCC1	ZINC000819019542	GD	On-Demand	Anodyne	GPR119	25	42
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](C)N1CCOCC1	ZINC000819019543	GD	On-Demand	Anodyne	GPR119	25	42
COc1ccc(N2CC[C@H](CNC(=S)NCCCN3CCOCC3)C2)cc1	ZINC000819019569	GD	On-Demand	Clean	DRD3	21	40
COc1ccc(N2CC[C@H](CNC(=S)NCCCN3CCOCC3)C2)cc1	ZINC000819019569	GD	On-Demand	Clean	AVPR1B	20	40
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819019570	GE	On-Demand	Anodyne	TGM2	75	43
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819019570	GE	On-Demand	Anodyne	F13A1	70	41
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819019570	GE	On-Demand	Anodyne	NAMPT	74	48
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819019571	GE	On-Demand	Anodyne	TGM2	75	43
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819019571	GE	On-Demand	Anodyne	F13A1	70	41
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819019571	GE	On-Demand	Anodyne	NAMPT	74	48
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819019572	GE	On-Demand	Anodyne	TGM2	75	43
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819019572	GE	On-Demand	Anodyne	F13A1	70	41
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819019572	GE	On-Demand	Anodyne	NAMPT	74	48
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819019573	GE	On-Demand	Anodyne	TGM2	75	43
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819019573	GE	On-Demand	Anodyne	F13A1	70	41
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819019573	GE	On-Demand	Anodyne	NAMPT	74	48
CCN1CCC[C@H]1CNC(=S)NC[C@H]1CCN(c2ccc(OC)cc2)C1	ZINC000819019575	GE	On-Demand	Clean	DRD2	32	41
CCN1CCC[C@@H]1CNC(=S)NC[C@@H]1CCN(c2ccc(OC)cc2)C1	ZINC000819019576	GE	On-Demand	Clean	DRD2	32	41
CCN1CCC[C@@H]1CNC(=S)NC[C@H]1CCN(c2ccc(OC)cc2)C1	ZINC000819019578	GE	On-Demand	Clean	DRD2	32	41
CCN1CCC[C@H]1CNC(=S)NC[C@@H]1CCN(c2ccc(OC)cc2)C1	ZINC000819019580	GE	On-Demand	Clean	DRD2	32	41
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@H](C)N1CCOCC1	ZINC000819019593	DE	On-Demand	Anodyne	ADRB1	30	47
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@H](C)N1CCOCC1	ZINC000819019593	DE	On-Demand	Anodyne	ADRB3	48	47
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@H](C)N1CCOCC1	ZINC000819019593	DE	On-Demand	Anodyne	IGF1R	29	43
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@H](C)N1CCOCC1	ZINC000819019593	DE	On-Demand	Anodyne	CYP3A4	49	39
CC(=O)N(c1ccc(NC(=O)c2cccnc2Cl)cc1)C1CC1	ZINC000819019594	EH	On-Demand	Anodyne	GRM4	47	38
CC(=O)N(c1ccc(NC(=O)c2cccnc2Cl)cc1)C1CC1	ZINC000819019594	EH	On-Demand	Anodyne	TYK2	47	34
CC(=O)N(c1ccc(NC(=O)c2cccnc2Cl)cc1)C1CC1	ZINC000819019594	EH	On-Demand	Anodyne	NR2E3	61	35
CC(=O)N(c1ccc(NC(=O)c2cccnc2Cl)cc1)C1CC1	ZINC000819019594	EH	On-Demand	Anodyne	G2YM83_BOTF4	89	47
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@@H](C)N1CCOCC1	ZINC000819019595	DE	On-Demand	Anodyne	ADRB1	30	47
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@@H](C)N1CCOCC1	ZINC000819019595	DE	On-Demand	Anodyne	ADRB3	48	47
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@@H](C)N1CCOCC1	ZINC000819019595	DE	On-Demand	Anodyne	IGF1R	29	43
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@@H](C)N1CCOCC1	ZINC000819019595	DE	On-Demand	Anodyne	CYP3A4	49	39
CC(=O)N(c1ccc(NC(=O)[C@@H]2C[C@H]2C2CCN(C(=O)OC(C)(C)C)CC2)cc1)C1CC1	ZINC000819019614	II	On-Demand	Anodyne	F13A1	18	41
CC(=O)N(c1ccc(NC(=O)[C@@H]2C[C@H]2C2CCN(C(=O)OC(C)(C)C)CC2)cc1)C1CC1	ZINC000819019614	II	On-Demand	Anodyne	GPR119	31	44
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)c3cccnc3)CC2)cc1)C1CC1	ZINC000819019635	HG	On-Demand	Anodyne	MTOR	18	40
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)c3cccnc3)CC2)cc1)C1CC1	ZINC000819019635	HG	On-Demand	Anodyne	EPHX2	17	46
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)c3cccnc3)CC2)cc1)C1CC1	ZINC000819019635	HG	On-Demand	Anodyne	NAMPT	41	41
CC(=O)N(c1ccc(NC(=O)C[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)cc1)C1CC1	ZINC000819019637	IJ	On-Demand	Anodyne	AMY2	43	29
CC(=O)N(c1ccc(NC(=O)C[C@H](NC(=O)OC(C)(C)C)c2ccccc2)cc1)C1CC1	ZINC000819019641	IJ	On-Demand	Anodyne	AMY2	43	29
CC(=O)N(c1ccc(NC(=O)CN(C(=O)OC(C)(C)C)c2ccccc2)cc1)C1CC1	ZINC000819019661	HJ	On-Demand	Anodyne	LTA4H	22	40
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019669	GF	On-Demand	Anodyne	PGC	46	37
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019669	GF	On-Demand	Anodyne	CCKAR	20	42
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019669	GF	On-Demand	Anodyne	CTSK	15	41
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019669	GF	On-Demand	Anodyne	CACNA1B	21	41
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019669	GF	On-Demand	Anodyne	REN	56	38
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019669	GF	On-Demand	Anodyne	FPR1	46	39
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019670	GF	On-Demand	Anodyne	PGC	46	37
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019670	GF	On-Demand	Anodyne	CCKAR	20	42
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019670	GF	On-Demand	Anodyne	CTSK	15	41
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019670	GF	On-Demand	Anodyne	CACNA1B	21	41
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019670	GF	On-Demand	Anodyne	REN	56	38
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019670	GF	On-Demand	Anodyne	FPR1	46	39
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019671	GF	On-Demand	Anodyne	PGC	46	37
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019671	GF	On-Demand	Anodyne	CCKAR	20	42
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019671	GF	On-Demand	Anodyne	CTSK	15	41
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019671	GF	On-Demand	Anodyne	CACNA1B	21	41
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019671	GF	On-Demand	Anodyne	REN	56	38
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819019671	GF	On-Demand	Anodyne	FPR1	46	39
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(OC(F)F)cc1	ZINC000819019672	IH	On-Demand	Bother	COLA	79	37
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019673	GF	On-Demand	Anodyne	PGC	46	37
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019673	GF	On-Demand	Anodyne	CCKAR	20	42
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019673	GF	On-Demand	Anodyne	CTSK	15	41
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019673	GF	On-Demand	Anodyne	CACNA1B	21	41
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019673	GF	On-Demand	Anodyne	REN	56	38
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819019673	GF	On-Demand	Anodyne	FPR1	46	39
CC(=O)N(c1ccc(NC(=O)c2cc(C)n(-c3ccccn3)c2C)cc1)C1CC1	ZINC000819019674	GI	On-Demand	Clean	GRM4	47	38
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1)C1CC1	ZINC000819019711	FH	On-Demand	Bother	SLC27A4	48	32
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1)C1CC1	ZINC000819019713	FH	On-Demand	Bother	SLC27A4	48	32
CC(=O)N(c1ccc(NC(=O)c2cccc(NS(C)(=O)=O)c2)cc1)C1CC1	ZINC000819019741	GF	On-Demand	Anodyne	NR3C2	17	41
CC(=O)N(c1ccc(NC(=O)c2cccc(NS(C)(=O)=O)c2)cc1)C1CC1	ZINC000819019741	GF	On-Demand	Anodyne	KCNK3	94	39
CC(=O)N(c1ccc(NC(=O)c2cccc(NS(C)(=O)=O)c2)cc1)C1CC1	ZINC000819019741	GF	On-Demand	Anodyne	KCNK9	46	38
O=C(NCCCCC(=O)N1C[C@@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819019747	HI	On-Demand	Anodyne	PREP	56	56
O=C(NCCCCC(=O)N1C[C@@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819019747	HI	On-Demand	Anodyne	TGM2	26	42
O=C(NCCCCC(=O)N1C[C@@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819019747	HI	On-Demand	Anodyne	SLC12A5	40	35
O=C(NCCCCC(=O)N1C[C@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819019750	HI	On-Demand	Anodyne	PREP	56	56
O=C(NCCCCC(=O)N1C[C@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819019750	HI	On-Demand	Anodyne	TGM2	26	42
O=C(NCCCCC(=O)N1C[C@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819019750	HI	On-Demand	Anodyne	SLC12A5	40	35
CC(=O)N(c1ccc(NC(=O)CSC2CCN(C(=O)OC(C)(C)C)CC2)cc1)C1CC1	ZINC000819019768	II	On-Demand	Anodyne	GPR119	42	44
C[C@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](C)N1CCOCC1	ZINC000819019777	DD	On-Demand	Bother	KCNJ1	16	42
C[C@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H](C)N1CCOCC1	ZINC000819019778	DD	On-Demand	Bother	KCNJ1	16	42
C=C[C@@H]1OCC[C@H]1CNC(=S)Nc1ccc2c(c1)OCCO2	ZINC000819019785	DE	On-Demand	Mild	QPCT	16	42
C=C[C@@H]1OCC[C@H]1CNC(=S)NCc1ccc(S(N)(=O)=O)cc1	ZINC000819019788	FC	On-Demand	Mild	CA2	39	46
C=C[C@@H]1OCC[C@H]1CNC(=S)NCc1ccc(S(N)(=O)=O)cc1	ZINC000819019788	FC	On-Demand	Mild	CA1	37	46
C=C[C@@H]1OCC[C@H]1CNC(=S)NCc1ccc(S(N)(=O)=O)cc1	ZINC000819019788	FC	On-Demand	Mild	CA4	24	40
C=C[C@@H]1OCC[C@H]1CNC(=S)NCc1ccc(S(N)(=O)=O)cc1	ZINC000819019788	FC	On-Demand	Mild	CA14	28	40
C=C[C@@H]1OCC[C@H]1CNC(=S)NCc1ccc(S(N)(=O)=O)cc1	ZINC000819019788	FC	On-Demand	Mild	CA12	30	43
C=C[C@@H]1OCC[C@H]1CNC(=S)NCc1ccc(S(N)(=O)=O)cc1	ZINC000819019788	FC	On-Demand	Mild	CA9	32	46
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)NCCc1ccc(F)cc1	ZINC000819019913	HG	On-Demand	Bother	COLA	79	39
CC(=O)N(c1ccc(NC(=O)CCCCN2CCCC2)cc1)C1CC1	ZINC000819019948	EG	On-Demand	Anodyne	CHRNA7	23	56
CC(=O)N(c1ccc(NC(=O)CCCCN2CCCC2)cc1)C1CC1	ZINC000819019948	EG	On-Demand	Anodyne	CYP2J2	44	31
O=Cc1cccc(OCC(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1	ZINC000819019950	FG	On-Demand	Anodyne	CPT1A	119	39
O=Cc1cccc(OCC(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1	ZINC000819019950	FG	On-Demand	Anodyne	CPT2	47	36
O=Cc1cccc(OCC(=O)N2C[C@H]3CCCCN3c3ccccc32)c1	ZINC000819019954	FG	On-Demand	Anodyne	CPT1A	119	39
O=Cc1cccc(OCC(=O)N2C[C@H]3CCCCN3c3ccccc32)c1	ZINC000819019954	FG	On-Demand	Anodyne	CPT2	47	36
N#Cc1cccc(OCC(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1	ZINC000819019961	EG	On-Demand	Mild	CPT1A	123	47
N#Cc1cccc(OCC(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1	ZINC000819019961	EG	On-Demand	Mild	CPT2	48	38
N#Cc1cccc(OCC(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1	ZINC000819019961	EG	On-Demand	Mild	CHRNA10	20	44
N#Cc1cccc(OCC(=O)N2C[C@H]3CCCCN3c3ccccc32)c1	ZINC000819019966	EG	On-Demand	Mild	CPT1A	123	47
N#Cc1cccc(OCC(=O)N2C[C@H]3CCCCN3c3ccccc32)c1	ZINC000819019966	EG	On-Demand	Mild	CPT2	48	38
N#Cc1cccc(OCC(=O)N2C[C@H]3CCCCN3c3ccccc32)c1	ZINC000819019966	EG	On-Demand	Mild	CHRNA10	20	44
CCOc1ccccc1C(F)(F)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819019975	GI	On-Demand	Anodyne	KCNK3	30	42
CCOc1ccccc1C(F)(F)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819019975	GI	On-Demand	Anodyne	KCNK9	28	42
COc1ccc(OC)c([C@H](O)CNCC2CCN(C(C)=O)CC2)c1	ZINC000819020010	ED	On-Demand	Anodyne	ADRB2	16	41
COc1ccc(OC)c([C@H](O)CNCC2CCN(C(C)=O)CC2)c1	ZINC000819020010	ED	On-Demand	Anodyne	CCR3	18	40
COc1ccc(OC)c([C@H](O)CNCC2CCN(C(C)=O)CC2)c1	ZINC000819020010	ED	On-Demand	Anodyne	MTNR1A	40	42
COc1ccc(OC)c([C@H](O)CNCC2CCN(C(C)=O)CC2)c1	ZINC000819020010	ED	On-Demand	Anodyne	MTNR1B	42	40
Cc1ccc(NC(=S)NCCCCS(C)(=O)=O)cc1F	ZINC000819020028	DE	On-Demand	Anodyne	QPCT	55	39
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)C1CC1	ZINC000819020043	IK	On-Demand	Anodyne	AVPR2	33	43
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)C1CC1	ZINC000819020043	IK	On-Demand	Anodyne	NR1H4	17	47
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)C1CC1	ZINC000819020043	IK	On-Demand	Anodyne	NR2E3	45	33
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)C1CC1	ZINC000819020043	IK	On-Demand	Anodyne	KCNK3	113	49
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)C1CC1	ZINC000819020043	IK	On-Demand	Anodyne	KCNK9	65	49
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2C[C@H]3CCCCN3c3ccccc32)C1	ZINC000819020049	GH	On-Demand	Anodyne	SFRP1	38	45
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2C[C@H]3CCCCN3c3ccccc32)C1	ZINC000819020049	GH	On-Demand	Anodyne	WNT3	44	36
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2C[C@@H]3CCCCN3c3ccccc32)C1	ZINC000819020050	GH	On-Demand	Anodyne	SFRP1	38	45
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2C[C@@H]3CCCCN3c3ccccc32)C1	ZINC000819020050	GH	On-Demand	Anodyne	WNT3	44	36
CC(=O)N(c1ccc(NC(=O)/C=C(\C)c2ccccc2Cl)cc1)C1CC1	ZINC000819020060	FJ	On-Demand	Anodyne	NR2E3	51	33
CC(=O)N(c1ccc(NC(=O)/C=C(/C)c2ccccc2Cl)cc1)C1CC1	ZINC000819020061	FJ	On-Demand	Anodyne	NR2E3	51	33
O=C(Cc1ccc(Cl)cn1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020062	EH	On-Demand	Anodyne	GPBAR1	51	41
O=C(Cc1ccc(Cl)cn1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020065	EH	On-Demand	Anodyne	GPBAR1	51	41
CC(=O)N(c1ccc(NC(=O)/C=C(/C)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819020067	HK	On-Demand	Anodyne	CCR2	54	41
CC(=O)N(c1ccc(NC(=O)/C=C(/C)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819020067	HK	On-Demand	Anodyne	IMDH_CRYPV	45	37
CC(=O)N(c1ccc(NC(=O)/C=C(\C)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819020068	HK	On-Demand	Anodyne	CCR2	54	41
CC(=O)N(c1ccc(NC(=O)/C=C(\C)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819020068	HK	On-Demand	Anodyne	IMDH_CRYPV	45	37
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)C1CC1	ZINC000819020069	GF	On-Demand	Anodyne	PIK3CA	47	40
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)C1CC1	ZINC000819020069	GF	On-Demand	Anodyne	PRNP	48	39
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)C1CC1	ZINC000819020069	GF	On-Demand	Anodyne	MTOR	96	41
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)C1CC1	ZINC000819020069	GF	On-Demand	Anodyne	PIK3CG	38	40
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)C1CC1	ZINC000819020069	GF	On-Demand	Anodyne	PIK3CB	15	40
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)C1CC1	ZINC000819020069	GF	On-Demand	Anodyne	DGAT1	47	45
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)C1CC1	ZINC000819020069	GF	On-Demand	Anodyne	HPGDS	17	48
CC(=O)N(c1ccc(NC(=O)COc2ccc(-c3ccccc3)cc2)cc1)C1CC1	ZINC000819020071	HJ	On-Demand	Anodyne	LTA4H	44	42
CC(=O)N(c1ccc(NC(=O)COc2ccc(-c3ccccc3)cc2)cc1)C1CC1	ZINC000819020071	HJ	On-Demand	Anodyne	ADORA2A	16	46
CC(=O)N(c1ccc(NC(=O)COc2ccc(-c3ccccc3)cc2)cc1)C1CC1	ZINC000819020071	HJ	On-Demand	Anodyne	ADORA2B	50	46
CC(=O)N(c1ccc(NC(=O)COc2ccc(-c3ccccc3)cc2)cc1)C1CC1	ZINC000819020071	HJ	On-Demand	Anodyne	MCHR1	23	41
CC(C)n1ncc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1N	ZINC000819020088	EG	On-Demand	Anodyne	GPBAR1	46	39
CC(C)n1ncc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)c1N	ZINC000819020089	EG	On-Demand	Anodyne	GPBAR1	46	39
Cc1cc(-n2c(C)cc(C(=O)N3C[C@H]4CCCCN4c4ccccc43)c2C)no1	ZINC000819020091	GI	On-Demand	Anodyne	GPBAR1	39	41
Cc1cc(-n2c(C)cc(C(=O)N3C[C@@H]4CCCCN4c4ccccc43)c2C)no1	ZINC000819020092	GI	On-Demand	Anodyne	GPBAR1	39	41
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccc(Cl)cc2)cc1)C1CC1	ZINC000819020093	FJ	On-Demand	Anodyne	MCHR1	17	50
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccc(Cl)cc2)cc1)C1CC1	ZINC000819020094	FJ	On-Demand	Anodyne	MCHR1	17	50
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N(C)C)c2)cc1)C1CC1	ZINC000819020105	IG	On-Demand	Anodyne	CPT1A	55	36
C=CCn1cc(CNC(=S)Nc2ccc(C(=O)OCC)cc2)nn1	ZINC000819020123	EE	On-Demand	Mild	ACR	44	33
C=CCn1cc(CNC(=S)Nc2ccc3c(c2)OCCO3)nn1	ZINC000819020148	ED	On-Demand	Mild	QPCT	20	46
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccccc1	ZINC000819020194	FF	On-Demand	Anodyne	CA1	15	50
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccccc1	ZINC000819020194	FF	On-Demand	Anodyne	HDAC8	18	64
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccccc1	ZINC000819020194	FF	On-Demand	Anodyne	CA5B	18	46
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccccc1	ZINC000819020194	FF	On-Demand	Anodyne	CA5A	15	48
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccccc1	ZINC000819020194	FF	On-Demand	Anodyne	MTNR1A	25	40
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccccc1	ZINC000819020194	FF	On-Demand	Anodyne	MTNR1B	25	40
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccccc1	ZINC000819020194	FF	On-Demand	Anodyne	MMP2	15	47
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccccc1	ZINC000819020194	FF	On-Demand	Anodyne	MMP3	20	42
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccccc1	ZINC000819020194	FF	On-Demand	Anodyne	HDAC1	16	57
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccccc1	ZINC000819020194	FF	On-Demand	Anodyne	HDAC2	15	66
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccccc1	ZINC000819020194	FF	On-Demand	Anodyne	FAAH	59	38
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccccc1	ZINC000819020194	FF	On-Demand	Anodyne	CES1	63	39
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccccc1	ZINC000819020194	FF	On-Demand	Anodyne	AMP1_PLAFQ	28	43
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccccc1	ZINC000819020194	FF	On-Demand	Anodyne	CRTM	38	42
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccccc1	ZINC000819020194	FF	On-Demand	Anodyne	CES1D	43	30
CC[C@@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1nc(C)cs1	ZINC000819020209	GH	On-Demand	Anodyne	GPR119	32	40
CC(=O)N(c1ccc(NC(=O)Cn2c(S)nc3ccccc3c2=O)cc1)C1CC1	ZINC000819020210	HF	On-Demand	Anodyne	IMDH_CRYPV	53	39
CC[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1nc(C)cs1	ZINC000819020215	GH	On-Demand	Anodyne	GPR119	32	40
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccccc1F	ZINC000819020219	FG	On-Demand	Anodyne	AMP1_PLAFQ	25	40
O=C(CCCc1ccccc1)NCCNC(=S)Nc1cccc(Cl)c1	ZINC000819020222	GH	On-Demand	Anodyne	ADRB1	15	45
O=C(CCCc1ccccc1)NCCNC(=S)Nc1cccc(Cl)c1	ZINC000819020222	GH	On-Demand	Anodyne	PPIA	28	42
O=C(CCCc1ccccc1)NCCNC(=S)Nc1cccc(Cl)c1	ZINC000819020222	GH	On-Demand	Anodyne	HDAC8	15	45
O=C(CCCc1ccccc1)NCCNC(=S)Nc1cccc(Cl)c1	ZINC000819020222	GH	On-Demand	Anodyne	MTNR1A	17	40
O=C(CCCc1ccccc1)NCCNC(=S)Nc1cccc(Cl)c1	ZINC000819020222	GH	On-Demand	Anodyne	MTNR1B	17	40
O=C(CCCc1ccccc1)NCCNC(=S)Nc1cccc(Cl)c1	ZINC000819020222	GH	On-Demand	Anodyne	HDAC1	15	45
O=C(CCCc1ccccc1)NCCNC(=S)Nc1cccc(Cl)c1	ZINC000819020222	GH	On-Demand	Anodyne	HDAC2	17	46
O=C(CCCc1ccccc1)NCCNC(=S)Nc1cccc(Cl)c1	ZINC000819020222	GH	On-Demand	Anodyne	SLC6A5	16	42
O=C(CCCc1ccccc1)NCCNC(=S)Nc1cccc(Cl)c1	ZINC000819020222	GH	On-Demand	Anodyne	CRTM	40	40
O=C(CCCc1ccccc1)NCCNC(=S)Nc1cccc(Cl)c1	ZINC000819020222	GH	On-Demand	Anodyne	KCNK3	22	40
CCCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020229	DD	On-Demand	Anodyne	ANPEP	15	43
CCCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020229	DD	On-Demand	Anodyne	HDAC8	15	52
CCCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020229	DD	On-Demand	Anodyne	MTNR1A	36	45
CCCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020229	DD	On-Demand	Anodyne	MTNR1B	36	45
CCCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020229	DD	On-Demand	Anodyne	MMP3	23	43
CCCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020229	DD	On-Demand	Anodyne	FAAH	46	38
CCCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020229	DD	On-Demand	Anodyne	S1PR2	29	40
CCCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020229	DD	On-Demand	Anodyne	CES1	44	36
CCCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020229	DD	On-Demand	Anodyne	AMP1_PLAFQ	28	41
CCCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020229	DD	On-Demand	Anodyne	CRTM	43	42
CCCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020229	DD	On-Demand	Anodyne	CES1D	43	30
C[C@@H](CC(=O)N1C[C@@H]2CCCCN2c2ccccc21)NC(=O)OC(C)(C)C	ZINC000819020244	FH	On-Demand	Anodyne	CCKAR	17	40
C[C@@H](CC(=O)N1C[C@H]2CCCCN2c2ccccc21)NC(=O)OC(C)(C)C	ZINC000819020250	FH	On-Demand	Anodyne	CCKAR	17	40
C=C[C@@H]1OCC[C@H]1CNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000819020260	FF	On-Demand	Mild	DRD4	29	43
C=C[C@@H]1OCC[C@H]1CNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000819020260	FF	On-Demand	Mild	ACHE	23	45
C=C[C@@H]1OCC[C@H]1CNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000819020260	FF	On-Demand	Mild	SIGMAR1	39	46
C=C[C@@H]1OCC[C@H]1CNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000819020260	FF	On-Demand	Mild	MCHR1	15	41
C[C@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1ccccc1	ZINC000819020270	FG	On-Demand	Anodyne	ANPEP	19	43
C[C@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1ccccc1	ZINC000819020270	FG	On-Demand	Anodyne	MMP2	18	45
C[C@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1ccccc1	ZINC000819020270	FG	On-Demand	Anodyne	MMP3	34	45
C[C@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1ccccc1	ZINC000819020270	FG	On-Demand	Anodyne	FAAH	31	40
C[C@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1ccccc1	ZINC000819020270	FG	On-Demand	Anodyne	CAPN1	36	40
C[C@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1ccccc1	ZINC000819020270	FG	On-Demand	Anodyne	CASP1	24	46
C[C@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1ccccc1	ZINC000819020270	FG	On-Demand	Anodyne	CAPN2	46	37
C[C@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1ccccc1	ZINC000819020270	FG	On-Demand	Anodyne	AMP1_PLAFQ	25	43
C[C@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1ccccc1	ZINC000819020270	FG	On-Demand	Anodyne	CES1D	43	30
C[C@@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1ccccc1	ZINC000819020272	FG	On-Demand	Anodyne	ANPEP	19	43
C[C@@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1ccccc1	ZINC000819020272	FG	On-Demand	Anodyne	MMP2	18	45
C[C@@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1ccccc1	ZINC000819020272	FG	On-Demand	Anodyne	MMP3	34	45
C[C@@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1ccccc1	ZINC000819020272	FG	On-Demand	Anodyne	FAAH	31	40
C[C@@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1ccccc1	ZINC000819020272	FG	On-Demand	Anodyne	CAPN1	36	40
C[C@@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1ccccc1	ZINC000819020272	FG	On-Demand	Anodyne	CASP1	24	46
C[C@@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1ccccc1	ZINC000819020272	FG	On-Demand	Anodyne	CAPN2	46	37
C[C@@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1ccccc1	ZINC000819020272	FG	On-Demand	Anodyne	AMP1_PLAFQ	25	43
C[C@@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1ccccc1	ZINC000819020272	FG	On-Demand	Anodyne	CES1D	43	30
CCC(=O)Nc1ccccc1C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819020275	FH	On-Demand	Anodyne	NR2E3	44	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(N(C)C)cc1)C2	ZINC000819020278	EE	On-Demand	Clean	VHL	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(N(C)C)cc1)C2	ZINC000819020279	EE	On-Demand	Clean	VHL	40	31
CC(=O)Nc1ccc(NC(=S)NC[C@H](CC(C)C)C(=O)OC(C)(C)C)cc1	ZINC000819020293	GH	On-Demand	Anodyne	CA1	15	41
CC(=O)Nc1ccc(NC(=S)NC[C@@H](CC(C)C)C(=O)OC(C)(C)C)cc1	ZINC000819020295	GH	On-Demand	Anodyne	CA1	15	41
CC(=O)N(c1ccc(NC(=O)C[C@H](O)c2cc(Cl)cc(Cl)c2)cc1)C1CC1	ZINC000819020298	HJ	On-Demand	Anodyne	SLC1A2	43	34
CC(=O)N(c1ccc(NC(=O)C[C@@H](O)c2cc(Cl)cc(Cl)c2)cc1)C1CC1	ZINC000819020300	HJ	On-Demand	Anodyne	SLC1A2	43	34
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccccc1	ZINC000819020302	EG	On-Demand	Anodyne	HDAC8	27	53
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccccc1	ZINC000819020302	EG	On-Demand	Anodyne	HDAC10	28	44
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccccc1	ZINC000819020302	EG	On-Demand	Anodyne	CA5A	15	52
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccccc1	ZINC000819020302	EG	On-Demand	Anodyne	MMP3	26	49
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccccc1	ZINC000819020302	EG	On-Demand	Anodyne	HDAC1	21	54
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccccc1	ZINC000819020302	EG	On-Demand	Anodyne	HDAC2	26	55
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccccc1	ZINC000819020302	EG	On-Demand	Anodyne	HDAC3	21	44
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccccc1	ZINC000819020302	EG	On-Demand	Anodyne	HDAC6	25	44
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccccc1	ZINC000819020302	EG	On-Demand	Anodyne	FAAH	51	37
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccccc1	ZINC000819020302	EG	On-Demand	Anodyne	CES1	55	37
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccccc1	ZINC000819020302	EG	On-Demand	Anodyne	HDAC11	20	44
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccccc1	ZINC000819020302	EG	On-Demand	Anodyne	AMP1_PLAFQ	24	41
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccccc1	ZINC000819020302	EG	On-Demand	Anodyne	CRTM	33	40
CCn1c(CNC(=O)[C@H]2CCCC[C@@H]2C)nc2ccccc21	ZINC000819020305	CG	On-Demand	Anodyne	PDE6D	45	33
CCn1c(CNC(=O)[C@H]2CCCC[C@H]2C)nc2ccccc21	ZINC000819020306	CG	On-Demand	Anodyne	PDE6D	45	33
CC(=O)N(c1ccc(NC(=O)c2cc(S(=O)(=O)NC(C)C)ccc2F)cc1)C1CC1	ZINC000819020307	IG	On-Demand	Anodyne	LEF	28	40
CCn1c(CNC(=O)[C@@H]2CCCC[C@@H]2C)nc2ccccc21	ZINC000819020308	CG	On-Demand	Anodyne	PDE6D	45	33
CCn1c(CNC(=O)[C@@H]2CCCC[C@H]2C)nc2ccccc21	ZINC000819020310	CG	On-Demand	Anodyne	PDE6D	45	33
COCCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020311	DD	On-Demand	Anodyne	FAAH	43	38
COCCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020311	DD	On-Demand	Anodyne	CES1	41	36
COCCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020311	DD	On-Demand	Anodyne	CRTM	47	40
CC(=O)N(c1ccc(NC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2)cc1)C1CC1	ZINC000819020312	HJ	On-Demand	Anodyne	GCGR	43	30
CC(=O)N(c1ccc(NC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2)cc1)C1CC1	ZINC000819020312	HJ	On-Demand	Anodyne	GIPR	42	34
O=C(CCCc1ccccc1)NCCNC(=S)NC(C1CC1)C1CC1	ZINC000819020317	FF	On-Demand	Anodyne	PREP	41	41
O=C(CCCc1ccccc1)NCCNC(=S)NC(C1CC1)C1CC1	ZINC000819020317	FF	On-Demand	Anodyne	MMP2	72	37
O=C(CCCc1ccccc1)NCCNC(=S)NC(C1CC1)C1CC1	ZINC000819020317	FF	On-Demand	Anodyne	MMP3	27	42
COc1ccc(CNC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020320	GF	On-Demand	Anodyne	ANPEP	15	48
COc1ccc(CNC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020320	GF	On-Demand	Anodyne	BMP1	34	51
COc1ccc(CNC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020320	GF	On-Demand	Anodyne	MMP13	25	40
COc1ccc(CNC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020320	GF	On-Demand	Anodyne	HDAC8	17	44
COc1ccc(CNC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020320	GF	On-Demand	Anodyne	MTNR1A	72	43
COc1ccc(CNC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020320	GF	On-Demand	Anodyne	MTNR1B	65	43
COc1ccc(CNC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020320	GF	On-Demand	Anodyne	MMP2	16	41
COc1ccc(CNC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020320	GF	On-Demand	Anodyne	MMP3	28	42
COc1ccc(CNC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020320	GF	On-Demand	Anodyne	FURIN	40	32
COc1ccc(CNC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020320	GF	On-Demand	Anodyne	SLC6A5	17	44
COc1ccc(CNC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020320	GF	On-Demand	Anodyne	MMP9	17	42
COc1ccc(CNC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020320	GF	On-Demand	Anodyne	CA9	18	41
COc1ccc(CNC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020320	GF	On-Demand	Anodyne	MMP1	19	42
COc1ccc(CNC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020320	GF	On-Demand	Anodyne	AMP1_PLAFQ	46	36
COc1ccc(CNC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020320	GF	On-Demand	Anodyne	SUCNR1	25	41
COc1ccc(CNC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020320	GF	On-Demand	Anodyne	PDS	42	36
O=C(c1ccc(N2CCCS2(=O)=O)cc1Cl)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020332	IH	On-Demand	Anodyne	AVPR2	64	46
C=C[C@@H]1OCC[C@H]1CNC(=S)Nc1c(C(C)C)cccc1C(C)C	ZINC000819020336	EJ	On-Demand	Mild	SOAT1	35	41
C[C@@H](NC[C@@H](O)c1ccccc1)[C@@H](C)N1CCOCC1	ZINC000819020344	CD	On-Demand	Anodyne	ADRB3	25	42
C[C@@H]([C@@H](C)NC[C@@H](O)c1ccccc1)N1CCOCC1	ZINC000819020345	CD	On-Demand	Anodyne	ADRB3	25	42
C[C@@H]([C@@H](C)NC[C@H](O)c1ccccc1)N1CCOCC1	ZINC000819020347	CD	On-Demand	Anodyne	ADRB3	25	42
O=C(c1ccc(N2CCCS2(=O)=O)cc1Cl)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020349	IH	On-Demand	Anodyne	AVPR2	64	46
CC(=O)N(c1ccc(NC(=O)CCN(C)C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819020355	HH	On-Demand	Anodyne	LTA4H	32	41
CC(=O)N(c1ccc(NC(=O)CCN(C)C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819020355	HH	On-Demand	Anodyne	AMY2	44	31
CC(=O)N(c1ccc(NC(=O)CCN(C)C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819020355	HH	On-Demand	Anodyne	F13A1	28	44
C[C@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1cccs1	ZINC000819020371	GG	On-Demand	Anodyne	MMP3	19	41
C[C@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1cccs1	ZINC000819020371	GG	On-Demand	Anodyne	CASP1	18	42
C[C@@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1cccs1	ZINC000819020372	GG	On-Demand	Anodyne	MMP3	19	41
C[C@@H](NC(=S)NCCNC(=O)CCCc1ccccc1)c1cccs1	ZINC000819020372	GG	On-Demand	Anodyne	CASP1	18	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	PLG	22	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	ACE	69	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	CELA1	32	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	ELANE	37	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	MME	25	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	CTRA_BOVIN	65	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	KLK3	75	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	CTSB	63	49
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	PAPA1_CARPA	67	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	TRY1_BOVIN	43	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	CYSP_TRYCR	54	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	CTSG	45	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	CTSK	49	49
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	CTSL	50	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	PREP	33	55
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	CAPNS1	71	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	CELA2A	53	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	CTSS	26	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	CAPN1	79	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	CASP1	25	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	CAPN2	125	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	PLAU	20	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	TGM2	32	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	NPR	65	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	XIAP	46	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	PSMB5	40	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	BIRC2	40	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	BIRC8	41	31
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	Q6PRC7_IXORI	37	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020373	GH	On-Demand	Anodyne	SLC12A5	64	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	PLG	22	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	ACE	69	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	CELA1	32	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	ELANE	37	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	MME	25	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	CTRA_BOVIN	65	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	KLK3	75	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	CTSB	63	49
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	PAPA1_CARPA	67	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	TRY1_BOVIN	43	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	CYSP_TRYCR	54	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	CTSG	45	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	CTSK	49	49
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	CTSL	50	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	PREP	33	55
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	CAPNS1	71	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	CELA2A	53	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	CTSS	26	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	CAPN1	79	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	CASP1	25	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	CAPN2	125	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	PLAU	20	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	TGM2	32	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	NPR	65	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	XIAP	46	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	PSMB5	40	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	BIRC2	40	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	BIRC8	41	31
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	Q6PRC7_IXORI	37	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020376	GH	On-Demand	Anodyne	SLC12A5	64	36
Cc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)c(Cl)n1	ZINC000819020386	EI	On-Demand	Anodyne	AVPR2	53	41
Cc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)c(Cl)n1	ZINC000819020386	EI	On-Demand	Anodyne	GPBAR1	60	42
CC(=O)N(c1ccc(NC(=O)c2ccc3c(c2)CN(C(=O)OC(C)(C)C)C3)cc1)C1CC1	ZINC000819020405	IJ	On-Demand	Anodyne	GCGR	46	34
CCn1c(CNC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)nc2ccccc21	ZINC000819020406	GI	On-Demand	Anodyne	PDE6D	55	33
CC(C)(C)OC(=O)NCCCCCC(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020407	HI	On-Demand	Anodyne	DRD2	17	46
CC(C)(C)NC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020408	DE	On-Demand	Anodyne	MMP3	23	42
CC(C)(C)NC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020408	DE	On-Demand	Anodyne	CES1	40	38
CC(C)(C)NC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020408	DE	On-Demand	Anodyne	AMP1_PLAFQ	24	40
CC(C)(C)OC(=O)NCCCCCC(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020414	HI	On-Demand	Anodyne	DRD2	17	46
CC(=O)N(c1ccc(NC(=O)c2cc(=O)c3ccc(F)cc3o2)cc1)C1CC1	ZINC000819020422	GH	On-Demand	Anodyne	KCNH2	16	56
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)N2C[C@H]3CCCCN3c3ccccc32)C1=O	ZINC000819020423	IF	On-Demand	Anodyne	HTR1A	17	41
COc1ccccc1[C@@]1(C)NC(=O)N(CC(=O)N2C[C@@H]3CCCCN3c3ccccc32)C1=O	ZINC000819020427	IF	On-Demand	Anodyne	HTR1A	17	41
CC(=O)N(c1ccc(NC(=O)c2cnc(Cl)c3ccccc23)cc1)C1CC1	ZINC000819020429	GJ	On-Demand	Anodyne	NR2E3	59	33
CC(=O)N(c1ccc(NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1)C1CC1	ZINC000819020434	HJ	On-Demand	Anodyne	GCGR	43	31
CC(=O)N(c1ccc(NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1)C1CC1	ZINC000819020434	HJ	On-Demand	Anodyne	RAF1	17	41
CC(=O)N(c1ccc(NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1)C1CC1	ZINC000819020434	HJ	On-Demand	Anodyne	TAAR1	47	40
CC(=O)N(c1ccc(NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1)C1CC1	ZINC000819020434	HJ	On-Demand	Anodyne	KCNK3	102	40
CC(=O)N(c1ccc(NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1)C1CC1	ZINC000819020434	HJ	On-Demand	Anodyne	KCNK9	57	38
CC(=O)N(c1ccc(NC(=O)CC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)C1CC1	ZINC000819020438	HI	On-Demand	Anodyne	GPR119	32	44
CC(=O)N(c1ccc(NC(=O)CC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)C1CC1	ZINC000819020439	HI	On-Demand	Anodyne	GPR119	32	44
COc1ccc(N2CC[C@H](CNC(=S)NCCc3ccc(F)cc3)C2)cc1	ZINC000819020453	GG	On-Demand	Clean	GPBAR1	19	41
NS(=O)(=O)c1ccc(CNC(=S)NC[C@@H]2C[C@H]2C2CCC2)cc1	ZINC000819020475	FD	On-Demand	Anodyne	CA2	52	47
NS(=O)(=O)c1ccc(CNC(=S)NC[C@@H]2C[C@H]2C2CCC2)cc1	ZINC000819020475	FD	On-Demand	Anodyne	CA1	49	47
NS(=O)(=O)c1ccc(CNC(=S)NC[C@@H]2C[C@H]2C2CCC2)cc1	ZINC000819020475	FD	On-Demand	Anodyne	CA7	25	42
NS(=O)(=O)c1ccc(CNC(=S)NC[C@@H]2C[C@H]2C2CCC2)cc1	ZINC000819020475	FD	On-Demand	Anodyne	CA5B	28	41
NS(=O)(=O)c1ccc(CNC(=S)NC[C@@H]2C[C@H]2C2CCC2)cc1	ZINC000819020475	FD	On-Demand	Anodyne	CA4	38	43
NS(=O)(=O)c1ccc(CNC(=S)NC[C@@H]2C[C@H]2C2CCC2)cc1	ZINC000819020475	FD	On-Demand	Anodyne	CA5A	28	41
NS(=O)(=O)c1ccc(CNC(=S)NC[C@@H]2C[C@H]2C2CCC2)cc1	ZINC000819020475	FD	On-Demand	Anodyne	CA14	31	41
NS(=O)(=O)c1ccc(CNC(=S)NC[C@@H]2C[C@H]2C2CCC2)cc1	ZINC000819020475	FD	On-Demand	Anodyne	CA12	36	44
NS(=O)(=O)c1ccc(CNC(=S)NC[C@@H]2C[C@H]2C2CCC2)cc1	ZINC000819020475	FD	On-Demand	Anodyne	CA9	38	47
O[C@@H](CNCC1(N2CCCC2)CCOCC1)c1ccccc1C(F)(F)F	ZINC000819020489	FF	On-Demand	Anodyne	HCN1	47	38
O[C@H](CNCC1(N2CCCC2)CCOCC1)c1ccccc1C(F)(F)F	ZINC000819020490	FF	On-Demand	Anodyne	HCN1	47	38
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCCCC3)cc2)c1	ZINC000819020497	GH	On-Demand	Anodyne	DRD4	49	40
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCCCC3)cc2)c1	ZINC000819020497	GH	On-Demand	Anodyne	KCNQ2	20	41
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCCCC3)cc2)c1	ZINC000819020497	GH	On-Demand	Anodyne	PRNP	40	33
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCCCC3)cc2)c1	ZINC000819020497	GH	On-Demand	Anodyne	MTNR1A	24	44
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCCCC3)cc2)c1	ZINC000819020497	GH	On-Demand	Anodyne	MTNR1B	31	44
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCCCC3)cc2)c1	ZINC000819020497	GH	On-Demand	Anodyne	GALR2	43	40
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCCCC3)cc2)c1	ZINC000819020497	GH	On-Demand	Anodyne	ACR	27	42
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCCCC3)cc2)c1	ZINC000819020497	GH	On-Demand	Anodyne	TAAR1	32	41
C[C@@H]([C@@H](C)NCCC(=O)Nc1ccc(N(C)C)cc1)N1CCOCC1	ZINC000819020500	ED	On-Demand	Anodyne	MTOR	16	40
C[C@@H](NCCC(=O)Nc1ccc(N(C)C)cc1)[C@@H](C)N1CCOCC1	ZINC000819020502	ED	On-Demand	Anodyne	MTOR	16	40
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)NC(C)C)c2)cc1)C1CC1	ZINC000819020518	IG	On-Demand	Anodyne	CPT1A	52	35
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)NC(C)C)c2)cc1)C1CC1	ZINC000819020518	IG	On-Demand	Anodyne	CPT2	40	33
CC(=O)N(c1ccc(NC(=O)/C=C(\C)c2ccc([N+](=O)[O-])cc2)cc1)C1CC1	ZINC000819020521	GI	On-Demand	Bother	SLC27A4	42	32
CC(=O)N(c1ccc(NC(=O)/C=C(/C)c2ccc([N+](=O)[O-])cc2)cc1)C1CC1	ZINC000819020522	GI	On-Demand	Bother	SLC27A4	42	32
Cn1c(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc(Cl)c1Cl	ZINC000819020523	FI	On-Demand	Anodyne	GPBAR1	54	42
Cn1c(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc(Cl)c1Cl	ZINC000819020524	FI	On-Demand	Anodyne	GPBAR1	54	42
CC(C)(C)OC(=O)NCc1cccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1	ZINC000819020531	HJ	On-Demand	Anodyne	AVPR2	36	40
CC(C)(C)OC(=O)NCc1cccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1	ZINC000819020531	HJ	On-Demand	Anodyne	PREP	20	40
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccc(Cl)nc1	ZINC000819020534	GG	On-Demand	Anodyne	FAAH	48	37
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccc(Cl)nc1	ZINC000819020534	GG	On-Demand	Anodyne	CES1	41	33
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccc(Cl)nc1	ZINC000819020534	GG	On-Demand	Anodyne	CES1D	44	30
O=C(CCCc1ccccc1)NCCNC(=S)NC1CCC1	ZINC000819020535	DE	On-Demand	Anodyne	GRIN2B	16	41
O=C(CCCc1ccccc1)NCCNC(=S)NC1CCC1	ZINC000819020535	DE	On-Demand	Anodyne	SIGMAR1	19	42
O=C(CCCc1ccccc1)NCCNC(=S)NC1CCC1	ZINC000819020535	DE	On-Demand	Anodyne	PREP	47	39
O=C(CCCc1ccccc1)NCCNC(=S)NC1CCC1	ZINC000819020535	DE	On-Demand	Anodyne	EPHX2	15	64
CC(C)(C)OC(=O)NCc1cccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)c1	ZINC000819020537	HJ	On-Demand	Anodyne	AVPR2	36	40
CC(C)(C)OC(=O)NCc1cccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)c1	ZINC000819020537	HJ	On-Demand	Anodyne	PREP	20	40
Cc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1C	ZINC000819020542	FH	On-Demand	Anodyne	LDHA	25	43
Cc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1C	ZINC000819020542	FH	On-Demand	Anodyne	HDAC8	17	46
Cc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1C	ZINC000819020542	FH	On-Demand	Anodyne	MTNR1A	22	41
Cc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1C	ZINC000819020542	FH	On-Demand	Anodyne	MTNR1B	24	41
Cc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1C	ZINC000819020542	FH	On-Demand	Anodyne	MMP3	17	42
Cc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1C	ZINC000819020542	FH	On-Demand	Anodyne	HDAC2	16	47
Cc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1C	ZINC000819020542	FH	On-Demand	Anodyne	QPCT	53	35
CC(=O)OCC(C)(C)CC(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020543	EG	On-Demand	Anodyne	GPBAR1	40	36
CC(=O)OCC(C)(C)CC(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020546	EG	On-Demand	Anodyne	GPBAR1	40	36
O=C(c1ccc(CS(=O)(=O)C(F)F)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020550	HH	On-Demand	Anodyne	AVPR2	45	38
O=C(c1ccc(CS(=O)(=O)C(F)F)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020553	HH	On-Demand	Anodyne	AVPR2	45	38
CC(C)c1ccc(NC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819020559	EF	On-Demand	Anodyne	CA1	17	44
CC(C)c1ccc(NC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819020559	EF	On-Demand	Anodyne	QPCT	49	38
CC(=O)N(c1ccc(NC(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)cc1)C1CC1	ZINC000819020568	II	On-Demand	Anodyne	PRNP	51	46
CC(=O)N(c1ccc(NC(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)cc1)C1CC1	ZINC000819020568	II	On-Demand	Anodyne	MCHR1	15	45
CC(=O)N(c1ccc(NC(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)cc1)C1CC1	ZINC000819020568	II	On-Demand	Anodyne	GIPR	49	34
Cc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1F	ZINC000819020569	FH	On-Demand	Anodyne	LDHA	24	41
C=CCNS(=O)(=O)c1cc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)ccc1F	ZINC000819020584	IG	On-Demand	Mild	AVPR2	46	35
C=CCNS(=O)(=O)c1cc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)ccc1F	ZINC000819020587	IG	On-Demand	Mild	AVPR2	46	35
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccc2c(c1)OCO2	ZINC000819020589	GF	On-Demand	Anodyne	NOS2	82	35
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccc2c(c1)OCO2	ZINC000819020589	GF	On-Demand	Anodyne	QPCT	19	48
CC(=O)N(c1ccc(NC(=O)c2cc(C(F)(F)F)cc(Cl)n2)cc1)C1CC1	ZINC000819020595	GJ	On-Demand	Anodyne	ATF1	54	37
CC(=O)N(c1ccc(NC(=O)c2cc(C(F)(F)F)cc(Cl)n2)cc1)C1CC1	ZINC000819020595	GJ	On-Demand	Anodyne	NFKB1	50	37
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)cc1)C1CC1	ZINC000819020614	GF	On-Demand	Anodyne	ELANE	46	43
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)C(F)(F)F)cc1)C1CC1	ZINC000819020618	GF	On-Demand	Anodyne	ELANE	46	43
CC(=O)N(c1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cc1)C1CC1	ZINC000819020631	HF	On-Demand	Anodyne	LPL	52	42
CC(=O)N(c1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cc1)C1CC1	ZINC000819020631	HF	On-Demand	Anodyne	NPY2R	16	41
CC(=O)N(c1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cc1)C1CC1	ZINC000819020631	HF	On-Demand	Anodyne	LIPG	21	42
CN1CCC[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819020639	ED	On-Demand	Anodyne	GPR119	31	40
CN1CCC[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819020642	ED	On-Demand	Anodyne	GPR119	31	40
NC(=O)c1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020644	GE	On-Demand	Anodyne	CA1	17	48
NC(=O)c1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020644	GE	On-Demand	Anodyne	HDAC8	19	46
NC(=O)c1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020644	GE	On-Demand	Anodyne	MMP3	15	44
NC(=O)c1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020644	GE	On-Demand	Anodyne	HDAC1	15	46
NC(=O)c1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020644	GE	On-Demand	Anodyne	HDAC2	18	47
NC(=O)c1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020644	GE	On-Demand	Anodyne	PPO2	20	41
CC(=O)N(c1ccc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])cc1)C1CC1	ZINC000819020654	FI	On-Demand	Bother	NR2E3	61	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC(=S)Nc1cccc(NC(C)=O)c1)C2	ZINC000819020655	GF	On-Demand	Anodyne	CCR3	17	43
CC(=O)N(c1ccc(NC(=O)c2cc(C)ccc2N2CCCC2)cc1)C1CC1	ZINC000819020667	GI	On-Demand	Anodyne	TAAR1	24	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC(=S)Nc1cccc(OC)c1)C2	ZINC000819020684	FF	On-Demand	Anodyne	CCR3	21	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC(=S)Nc1cccc(OC)c1)C2	ZINC000819020684	FF	On-Demand	Anodyne	EPHX2	15	41
C#CCOc1ccc(C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)cc1	ZINC000819020695	EG	On-Demand	Mild	GCGR	44	31
Cc1sc(Cl)nc1C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020696	EI	On-Demand	Anodyne	GPBAR1	40	37
Cc1sc(Cl)nc1C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020697	EI	On-Demand	Anodyne	GPBAR1	40	37
CC(=O)N(c1ccc(NC(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819020706	HH	On-Demand	Anodyne	GRIN2B	27	45
CC(=O)N(c1ccc(NC(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819020706	HH	On-Demand	Anodyne	CCR5	23	40
CC(=O)N(c1ccc(NC(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819020706	HH	On-Demand	Anodyne	TGM2	42	46
CC(=O)N(c1ccc(NC(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819020706	HH	On-Demand	Anodyne	F13A1	60	46
CC(=O)N(c1ccc(NC(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819020706	HH	On-Demand	Anodyne	SLC12A5	58	36
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819020707	HH	On-Demand	Anodyne	GRIN2B	27	45
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819020707	HH	On-Demand	Anodyne	CCR5	23	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819020707	HH	On-Demand	Anodyne	TGM2	42	46
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819020707	HH	On-Demand	Anodyne	F13A1	60	46
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)C1CC1	ZINC000819020707	HH	On-Demand	Anodyne	SLC12A5	58	36
CC(=O)N(c1ccc(NC(=O)c2ccc(NC(=O)OC(C)(C)C)c(C)c2)cc1)C1CC1	ZINC000819020712	HK	On-Demand	Anodyne	GCGR	43	30
CCN(CC)S(=O)(=O)c1cc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)ccc1F	ZINC000819020714	IH	On-Demand	Anodyne	AVPR2	40	35
CCN(CC)S(=O)(=O)c1cc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)ccc1F	ZINC000819020715	IH	On-Demand	Anodyne	AVPR2	40	35
O[C@@H](CNCC1(N2CCCC2)CCOCC1)c1ccccc1Cl	ZINC000819020730	EF	On-Demand	Anodyne	HCN1	57	40
O[C@@H](CNCC1(N2CCCC2)CCOCC1)c1ccccc1Cl	ZINC000819020730	EF	On-Demand	Anodyne	HCN4	48	31
COc1cc(CNC(=O)/C=C/[C@H]2CCCO2)ccc1OCc1ccccc1	ZINC000819020731	FH	On-Demand	Anodyne	MTNR1B	16	47
COc1cc(CNC(=O)/C=C\[C@H]2CCCO2)ccc1OCc1ccccc1	ZINC000819020732	FH	On-Demand	Anodyne	MTNR1B	16	47
COc1cc(CNC(=O)/C=C/[C@@H]2CCCO2)ccc1OCc1ccccc1	ZINC000819020733	FH	On-Demand	Anodyne	MTNR1B	16	47
COc1cc(CNC(=O)/C=C\[C@@H]2CCCO2)ccc1OCc1ccccc1	ZINC000819020734	FH	On-Demand	Anodyne	MTNR1B	16	47
Cc1ccccc1[C@@H](O)CNCC1(N2CCCC2)CCOCC1	ZINC000819020738	DE	On-Demand	Anodyne	HCN1	60	41
Cc1ccccc1[C@@H](O)CNCC1(N2CCCC2)CCOCC1	ZINC000819020738	DE	On-Demand	Anodyne	HCN4	50	32
C=CCC1(C(=O)Nc2ccc(N3CCCCCC3)cc2)CCOCC1	ZINC000819020759	EI	On-Demand	Mild	STAT6	51	32
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C(F)=C1CCC1	ZINC000819020763	FF	On-Demand	Anodyne	TGM2	53	37
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C(F)=C1CCC1	ZINC000819020763	FF	On-Demand	Anodyne	F13A1	56	41
O=C(NCc1ccc(S(=O)(=O)N2CCCCC2)cc1)C(F)=C1CCC1	ZINC000819020763	FF	On-Demand	Anodyne	NAMPT	77	54
COc1ccc(N2CC[C@H](CNC(=S)Nc3ccc4c(c3)OCCO4)C2)cc1	ZINC000819020771	GG	On-Demand	Clean	QPCT	27	41
COc1ccc(N2CC[C@H](CNC(=S)Nc3cccc(Cl)c3)C2)cc1	ZINC000819020786	GI	On-Demand	Clean	MCHR1	15	45
COc1ccc(N2CC[C@H](CNC(=S)Nc3cccc(NC(C)=O)c3)C2)cc1	ZINC000819020810	GG	On-Demand	Clean	DRD4	42	34
COc1ccc(N2CC[C@H](CNC(=S)Nc3cccc(NC(C)=O)c3)C2)cc1	ZINC000819020810	GG	On-Demand	Clean	CCR3	45	41
COc1ccc(N2CC[C@H](CNC(=S)Nc3cccc(NC(C)=O)c3)C2)cc1	ZINC000819020810	GG	On-Demand	Clean	MTNR1A	42	39
COc1ccc(N2CC[C@H](CNC(=S)Nc3cccc(NC(C)=O)c3)C2)cc1	ZINC000819020810	GG	On-Demand	Clean	MCHR1	31	44
S=C(NCCc1cccnc1)NC[C@@H]1C[C@H]1C1CCC1	ZINC000819020816	CF	On-Demand	Anodyne	NAMPT	21	40
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1cccnc1	ZINC000819020821	FE	On-Demand	Anodyne	ADRB3	18	42
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1cccnc1	ZINC000819020821	FE	On-Demand	Anodyne	TBXA2R	22	40
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1cccnc1	ZINC000819020821	FE	On-Demand	Anodyne	TBXAS1	84	50
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1cccnc1	ZINC000819020821	FE	On-Demand	Anodyne	PTAFR	38	58
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1cccnc1	ZINC000819020821	FE	On-Demand	Anodyne	FAAH	55	39
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1cccnc1	ZINC000819020821	FE	On-Demand	Anodyne	CES1	65	39
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1cccnc1	ZINC000819020821	FE	On-Demand	Anodyne	NAMPT	41	43
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1cccnc1	ZINC000819020821	FE	On-Demand	Anodyne	CES1D	43	30
CC(=O)c1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020822	GG	On-Demand	Anodyne	HDAC8	20	46
CC(=O)c1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020822	GG	On-Demand	Anodyne	MMP3	17	44
CC(=O)c1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020822	GG	On-Demand	Anodyne	HDAC1	15	46
CC(=O)c1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020822	GG	On-Demand	Anodyne	HDAC2	18	47
CC(=O)c1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020822	GG	On-Demand	Anodyne	PPO2	20	41
O=C(CCCc1ccccc1)NCCNC(=S)NC1CCCCC1	ZINC000819020825	EF	On-Demand	Anodyne	HRH2	16	40
O=C(CCCc1ccccc1)NCCNC(=S)NC1CCCCC1	ZINC000819020825	EF	On-Demand	Anodyne	GRIN2B	16	40
O=C(CCCc1ccccc1)NCCNC(=S)NC1CCCCC1	ZINC000819020825	EF	On-Demand	Anodyne	CNR2	15	41
O=C(CCCc1ccccc1)NCCNC(=S)NC1CCCCC1	ZINC000819020825	EF	On-Demand	Anodyne	SIGMAR1	18	41
O=C(CCCc1ccccc1)NCCNC(=S)NC1CCCCC1	ZINC000819020825	EF	On-Demand	Anodyne	PREP	46	38
O=C(CCCc1ccccc1)NCCNC(=S)NC1CCCCC1	ZINC000819020825	EF	On-Demand	Anodyne	MMP2	53	35
O=C(CCCc1ccccc1)NCCNC(=S)NC1CCCCC1	ZINC000819020825	EF	On-Demand	Anodyne	MMP3	19	42
O=C(CCCc1ccccc1)NCCNC(=S)NC1CCCCC1	ZINC000819020825	EF	On-Demand	Anodyne	FAAH	35	40
O=C(CCCc1ccccc1)NCCNC(=S)NC1CCCCC1	ZINC000819020825	EF	On-Demand	Anodyne	EPHX2	22	70
O=C(CCCc1ccccc1)NCCNC(=S)NCC(F)(F)F	ZINC000819020827	EE	On-Demand	Anodyne	CES1	33	43
O=C(CCCc1ccccc1)NCCNC(=S)NCC(F)(F)F	ZINC000819020827	EE	On-Demand	Anodyne	AMP1_PLAFQ	25	43
CNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020830	CD	On-Demand	Anodyne	HDAC8	15	53
CNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020830	CD	On-Demand	Anodyne	MTNR1A	31	41
CNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020830	CD	On-Demand	Anodyne	MTNR1B	31	41
CNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020830	CD	On-Demand	Anodyne	MMP2	17	42
CNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020830	CD	On-Demand	Anodyne	MMP3	26	43
CNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020830	CD	On-Demand	Anodyne	FAAH	55	39
CNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020830	CD	On-Demand	Anodyne	CES1	56	37
CNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020830	CD	On-Demand	Anodyne	AMP1_PLAFQ	26	42
CNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020830	CD	On-Demand	Anodyne	NAAA	24	40
CNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020830	CD	On-Demand	Anodyne	CRTM	38	40
CNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020830	CD	On-Demand	Anodyne	CES1D	45	32
N#Cc1ccccc1NC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020844	FF	On-Demand	Mild	ADRB1	40	31
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCc2ccc(C#N)cc2F)CC1	ZINC000819020850	GF	On-Demand	Mild	GPR119	32	41
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCc2ccc(C#N)cc2F)CC1	ZINC000819020851	GF	On-Demand	Mild	GPR119	32	41
CN(Cc1ccsc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819020852	FG	On-Demand	Mild	CTSB	32	40
CN(Cc1ccsc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819020852	FG	On-Demand	Mild	PAPA1_CARPA	55	58
CN(Cc1ccsc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819020852	FG	On-Demand	Mild	CTSK	16	40
CN(Cc1ccsc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819020853	FG	On-Demand	Mild	CTSB	32	40
CN(Cc1ccsc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819020853	FG	On-Demand	Mild	PAPA1_CARPA	55	58
CN(Cc1ccsc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819020853	FG	On-Demand	Mild	CTSK	16	40
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020857	GH	On-Demand	Bother	CPT1A	64	38
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020857	GH	On-Demand	Bother	CPT2	42	35
CN1CCC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819020860	BC	On-Demand	Anodyne	ADRB1	26	40
CN1CCC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819020860	BC	On-Demand	Anodyne	ADRB3	86	48
CN1CCC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819020861	BC	On-Demand	Anodyne	ADRB1	26	40
CN1CCC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819020861	BC	On-Demand	Anodyne	ADRB3	86	48
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020862	GH	On-Demand	Bother	CPT1A	64	38
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020862	GH	On-Demand	Bother	CPT2	42	35
COc1cccc([S@@](=O)CC(=O)Nc2cccc(C3SCCS3)c2)c1	ZINC000819020866	GH	On-Demand	Anodyne	MTNR1A	20	41
COc1cccc([S@@](=O)CC(=O)Nc2cccc(C3SCCS3)c2)c1	ZINC000819020866	GH	On-Demand	Anodyne	MTNR1B	25	42
CC(=O)N(c1ccc(NC(=O)c2cccnc2Br)cc1)C1CC1	ZINC000819020876	FH	On-Demand	Anodyne	G2YM83_BOTF4	46	33
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020879	IG	On-Demand	Anodyne	ADRA1D	22	42
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020879	IG	On-Demand	Anodyne	ADRA1A	15	42
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020879	IG	On-Demand	Anodyne	ADRA1B	18	41
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020879	IG	On-Demand	Anodyne	CCR8	79	38
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020879	IG	On-Demand	Anodyne	SFRP1	138	42
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819020879	IG	On-Demand	Anodyne	WNT3	92	39
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020881	IG	On-Demand	Anodyne	ADRA1D	22	42
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020881	IG	On-Demand	Anodyne	ADRA1A	15	42
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020881	IG	On-Demand	Anodyne	ADRA1B	18	41
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020881	IG	On-Demand	Anodyne	CCR8	79	38
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020881	IG	On-Demand	Anodyne	SFRP1	138	42
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819020881	IG	On-Demand	Anodyne	WNT3	92	39
COC(=O)Nc1cc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc(C(F)(F)F)c1	ZINC000819020882	IJ	On-Demand	Anodyne	AVPR2	52	37
COC(=O)Nc1cc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc(C(F)(F)F)c1	ZINC000819020884	IJ	On-Demand	Anodyne	AVPR2	52	37
Cc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020885	FG	On-Demand	Anodyne	LDHA	23	40
Cc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020885	FG	On-Demand	Anodyne	HDAC8	20	48
Cc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020885	FG	On-Demand	Anodyne	HDAC10	22	44
Cc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020885	FG	On-Demand	Anodyne	MMP3	25	45
Cc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020885	FG	On-Demand	Anodyne	HDAC1	17	48
Cc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020885	FG	On-Demand	Anodyne	HDAC2	21	49
Cc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020885	FG	On-Demand	Anodyne	HDAC3	16	45
Cc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819020885	FG	On-Demand	Anodyne	HDAC11	15	44
O=C(CCCc1ccccc1)NCCNC(=S)NCc1ccccc1	ZINC000819020913	FF	On-Demand	Anodyne	HDAC8	15	53
O=C(CCCc1ccccc1)NCCNC(=S)NCc1ccccc1	ZINC000819020913	FF	On-Demand	Anodyne	CA5A	15	49
O=C(CCCc1ccccc1)NCCNC(=S)NCc1ccccc1	ZINC000819020913	FF	On-Demand	Anodyne	HDAC1	15	54
O=C(CCCc1ccccc1)NCCNC(=S)NCc1ccccc1	ZINC000819020913	FF	On-Demand	Anodyne	FAAH	48	39
O=C(CCCc1ccccc1)NCCNC(=S)NCc1ccccc1	ZINC000819020913	FF	On-Demand	Anodyne	CES1	54	37
O=C(CCCc1ccccc1)NCCNC(=S)NCc1ccccc1	ZINC000819020913	FF	On-Demand	Anodyne	AMP1_PLAFQ	44	41
O=C(CCCc1ccccc1)NCCNC(=S)NCc1ccccc1	ZINC000819020913	FF	On-Demand	Anodyne	CRTM	33	40
O=C(CCCc1ccccc1)NCCNC(=S)NCc1ccccc1	ZINC000819020913	FF	On-Demand	Anodyne	SUCNR1	23	40
COc1ccccc1/C(C)=C/C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819020929	FI	On-Demand	Anodyne	KCNA3	41	38
COc1ccccc1/C(C)=C\C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819020930	FI	On-Demand	Anodyne	KCNA3	41	38
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccc(Cl)cc1	ZINC000819020933	GH	On-Demand	Anodyne	LTA4H	15	40
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccc(Cl)cc1	ZINC000819020933	GH	On-Demand	Anodyne	HDAC8	18	48
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccc(Cl)cc1	ZINC000819020933	GH	On-Demand	Anodyne	MMP3	15	43
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccc(Cl)cc1	ZINC000819020933	GH	On-Demand	Anodyne	HDAC2	18	49
CCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020954	CD	On-Demand	Anodyne	HDAC8	15	52
CCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020954	CD	On-Demand	Anodyne	MTNR1A	32	42
CCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020954	CD	On-Demand	Anodyne	MTNR1B	33	42
CCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020954	CD	On-Demand	Anodyne	MMP3	22	44
CCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020954	CD	On-Demand	Anodyne	FAAH	47	38
CCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020954	CD	On-Demand	Anodyne	CES1	45	36
CCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020954	CD	On-Demand	Anodyne	AMP1_PLAFQ	34	44
CCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819020954	CD	On-Demand	Anodyne	CES1D	43	30
CCn1c(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc21	ZINC000819020956	GG	On-Demand	Mild	PAPA1_CARPA	49	47
CCn1c(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc21	ZINC000819020956	GG	On-Demand	Mild	SCN10A	24	45
CCn1c(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc21	ZINC000819020956	GG	On-Demand	Mild	FPR1	42	36
CCn1c(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc21	ZINC000819020959	GG	On-Demand	Mild	PAPA1_CARPA	49	47
CCn1c(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc21	ZINC000819020959	GG	On-Demand	Mild	SCN10A	24	45
CCn1c(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc21	ZINC000819020959	GG	On-Demand	Mild	FPR1	42	36
Cc1ccc(NC(=S)NCCCCS(C)(=O)=O)cc1C	ZINC000819020961	DE	On-Demand	Anodyne	QPCT	67	43
CC(=O)N(c1ccc(NC(=O)c2ccc(OC(F)(F)Cl)cc2)cc1)C1CC1	ZINC000819020986	GJ	On-Demand	Anodyne	GCGR	41	37
CC(=O)N(c1ccc(NC(=O)c2ccc(OC(F)(F)Cl)cc2)cc1)C1CC1	ZINC000819020986	GJ	On-Demand	Anodyne	RAF1	19	41
CC(=O)N(c1ccc(NC(=O)c2ccc(OC(F)(F)Cl)cc2)cc1)C1CC1	ZINC000819020986	GJ	On-Demand	Anodyne	EPHX2	44	41
CC(=O)N(c1ccc(NC(=O)c2ccc(OC(F)(F)Cl)cc2)cc1)C1CC1	ZINC000819020986	GJ	On-Demand	Anodyne	GIPR	48	42
CC(=O)N(c1ccc(NC(=O)c2ccc(OC(F)(F)Cl)cc2)cc1)C1CC1	ZINC000819020986	GJ	On-Demand	Anodyne	SHH	46	34
CC(=O)N(c1ccc(NC(=O)c2ccc(OC(F)(F)Cl)cc2)cc1)C1CC1	ZINC000819020986	GJ	On-Demand	Anodyne	NOD2	40	40
CC(=O)N(c1ccc(NC(=O)c2cccnc2S)cc1)C1CC1	ZINC000819020987	EG	On-Demand	Anodyne	NR2E3	51	33
CC(=O)N(c1ccc(NC(=O)c2cccnc2S)cc1)C1CC1	ZINC000819020987	EG	On-Demand	Anodyne	G2YM83_BOTF4	48	35
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2C[C@@H]3CCCCN3c3ccccc32)C1	ZINC000819021003	GI	On-Demand	Anodyne	SFRP1	28	43
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2C[C@H]3CCCCN3c3ccccc32)C1	ZINC000819021004	GI	On-Demand	Anodyne	SFRP1	28	43
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819021008	HI	On-Demand	Anodyne	PAPA1_CARPA	36	40
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819021008	HI	On-Demand	Anodyne	CTSK	28	45
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819021008	HI	On-Demand	Anodyne	TIMP3	47	34
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819021008	HI	On-Demand	Anodyne	REN	47	45
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819021008	HI	On-Demand	Anodyne	CAPN1	34	41
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819021008	HI	On-Demand	Anodyne	POLG_HCV1	23	41
CC(=O)N(c1ccc(NC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819021008	HI	On-Demand	Anodyne	FPR1	58	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	ACE	18	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	ELANE	28	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	NPR1	42	33
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	CTRA_BOVIN	18	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	CASP3	17	49
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	BMP1	25	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	KLK3	73	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	CTSB	70	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	PAPA1_CARPA	81	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	CYSP_TRYCR	45	38
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	CTSK	46	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	CTSL	54	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	TIMP3	64	37
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	AMY2	45	32
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	CAPNS1	68	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	CTSS	25	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	CAPN1	89	50
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	CASP1	25	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	CAPN2	141	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	CASP6	20	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	CASP9	39	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	NPR	75	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	PSMB5	49	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(N(C(C)=O)C2CC2)cc1	ZINC000819021010	II	On-Demand	Anodyne	Q6PRC7_IXORI	24	44
COc1ccc(N2CC[C@H](CNC(=S)Nc3ccc(F)cc3)C2)cc1	ZINC000819021029	FH	On-Demand	Clean	CCR3	29	41
O[C@@H](CNCC1(N2CCCC2)CCOCC1)c1cccnc1	ZINC000819021042	DD	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNCC1(N2CCCC2)CCOCC1)c1cccnc1	ZINC000819021042	DD	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CNCC1(N2CCCC2)CCOCC1)c1cccnc1	ZINC000819021042	DD	On-Demand	Anodyne	ADRB3	84	44
O[C@H](CNCC1(N2CCCC2)CCOCC1)c1cccnc1	ZINC000819021043	DD	On-Demand	Anodyne	ADRB2	19	40
O[C@H](CNCC1(N2CCCC2)CCOCC1)c1cccnc1	ZINC000819021043	DD	On-Demand	Anodyne	ADRB1	20	40
O[C@H](CNCC1(N2CCCC2)CCOCC1)c1cccnc1	ZINC000819021043	DD	On-Demand	Anodyne	ADRB3	84	44
COc1ccc(N2CC[C@H](CNC(=S)Nc3ccc4c(c3)OCO4)C2)cc1	ZINC000819021050	GG	On-Demand	Clean	EDNRB	72	42
COc1ccc(N2CC[C@H](CNC(=S)Nc3ccc4c(c3)OCO4)C2)cc1	ZINC000819021050	GG	On-Demand	Clean	EDNRA	62	43
COc1ccc(N2CC[C@H](CNC(=S)Nc3ccc4c(c3)OCO4)C2)cc1	ZINC000819021050	GG	On-Demand	Clean	BMP1	53	39
COc1ccc(N2CC[C@H](CNC(=S)Nc3ccc4c(c3)OCO4)C2)cc1	ZINC000819021050	GG	On-Demand	Clean	NOS2	40	31
COc1ccc(N2CC[C@H](CNC(=S)Nc3ccc4c(c3)OCO4)C2)cc1	ZINC000819021050	GG	On-Demand	Clean	QPCT	21	41
O[C@@H](CNCC1(N2CCCC2)CCOCC1)c1cccc(Cl)c1	ZINC000819021060	EF	On-Demand	Anodyne	ADRB1	26	41
O[C@@H](CNCC1(N2CCCC2)CCOCC1)c1cccc(Cl)c1	ZINC000819021060	EF	On-Demand	Anodyne	ADRB3	40	41
O[C@H](CNCC1(N2CCCC2)CCOCC1)c1cccc(Cl)c1	ZINC000819021061	EF	On-Demand	Anodyne	ADRB1	26	41
O[C@H](CNCC1(N2CCCC2)CCOCC1)c1cccc(Cl)c1	ZINC000819021061	EF	On-Demand	Anodyne	ADRB3	40	41
COc1ccc(N2CC[C@H](CNC(=S)NCCc3ccccc3)C2)cc1	ZINC000819021089	FG	On-Demand	Clean	SIGMAR1	15	40
COc1ccc(N2CC[C@H](CNC(=S)NCCc3ccccc3)C2)cc1	ZINC000819021089	FG	On-Demand	Clean	MMP3	16	44
Cc1ccc(NC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819021134	DE	On-Demand	Anodyne	CA2	15	45
Cc1ccc(NC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819021134	DE	On-Demand	Anodyne	PPIA	20	41
Cc1ccc(NC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819021134	DE	On-Demand	Anodyne	CA1	22	47
Cc1ccc(NC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819021134	DE	On-Demand	Anodyne	CA12	15	44
Cc1ccc(NC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819021134	DE	On-Demand	Anodyne	CA9	16	45
Cc1ccc(NC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819021134	DE	On-Demand	Anodyne	QPCT	56	40
O=C(CCCc1ccccc1)NCCNC(=S)NCc1ccon1	ZINC000819021139	ED	On-Demand	Anodyne	FAAH	49	38
O=C(CCCc1ccccc1)NCCNC(=S)NCc1ccon1	ZINC000819021139	ED	On-Demand	Anodyne	CES1	57	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC(=S)Nc1ccc3c(c1)OCCO3)C2	ZINC000819021142	GF	On-Demand	Anodyne	QPCT	15	40
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccc(F)cc1	ZINC000819021147	GF	On-Demand	Anodyne	CA1	15	47
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccc(F)cc1	ZINC000819021147	GF	On-Demand	Anodyne	CA5B	17	43
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccc(F)cc1	ZINC000819021147	GF	On-Demand	Anodyne	CA5A	15	46
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccc(F)cc1	ZINC000819021147	GF	On-Demand	Anodyne	CRTM	23	40
C=CCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819021151	DD	On-Demand	Mild	FAAH	31	42
C=CCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819021151	DD	On-Demand	Mild	CRTM	28	40
CS(=O)(=O)NCCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819021161	GC	On-Demand	Anodyne	CA5B	20	40
CS(=O)(=O)NCCNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819021161	GC	On-Demand	Anodyne	CA5A	18	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	F2	55	49
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	ACE	35	45
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	FKBP1A	55	43
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	OPRM1	36	42
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	OPRD1	23	41
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	CELA1	27	50
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	ELANE	45	45
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	TACR1	15	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	CTRA_BOVIN	62	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	TRY1_BOVIN	68	36
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	CTSG	43	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	PREP	70	50
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	CELA2A	51	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	LGMN	102	51
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	CFTR	59	38
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	ACE2	22	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	KLK5	26	45
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	XIAP	45	41
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	F13A1	42	38
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	BRCA1	60	33
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	SLC12A5	76	39
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021179	HH	On-Demand	Anodyne	TMPRSS11D	61	36
CC(=O)Nc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819021187	GG	On-Demand	Anodyne	CA1	15	46
CC(=O)Nc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819021187	GG	On-Demand	Anodyne	HDAC8	20	49
CC(=O)Nc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819021187	GG	On-Demand	Anodyne	MMP3	25	46
CC(=O)Nc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819021187	GG	On-Demand	Anodyne	HDAC1	17	49
CC(=O)Nc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819021187	GG	On-Demand	Anodyne	HDAC2	21	50
CC(=O)Nc1ccc(NC(=S)NCCNC(=O)CCCc2ccccc2)cc1	ZINC000819021187	GG	On-Demand	Anodyne	HDAC6	18	50
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021188	FG	On-Demand	Anodyne	PREP	31	45
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021188	FG	On-Demand	Anodyne	SFRP1	26	40
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021188	FG	On-Demand	Anodyne	WNT3	43	40
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021189	FG	On-Demand	Anodyne	PREP	31	45
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021189	FG	On-Demand	Anodyne	SFRP1	26	40
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021189	FG	On-Demand	Anodyne	WNT3	43	40
CC(=O)N(c1ccc(NC(=O)c2cc(Cl)nc(Cl)c2)cc1)C1CC1	ZINC000819021211	FI	On-Demand	Anodyne	NR2E3	44	32
O=C(c1ccc(SC(F)F)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021212	FK	On-Demand	Anodyne	AVPR2	41	40
O=C(c1ccc(SC(F)F)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021216	FK	On-Demand	Anodyne	AVPR2	41	40
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccc(F)cc1	ZINC000819021237	FG	On-Demand	Anodyne	HDAC8	19	48
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccc(F)cc1	ZINC000819021237	FG	On-Demand	Anodyne	HDAC1	15	48
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccc(F)cc1	ZINC000819021237	FG	On-Demand	Anodyne	HDAC2	20	49
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccc(F)cc1	ZINC000819021237	FG	On-Demand	Anodyne	HDAC3	15	44
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021249	IK	On-Demand	Anodyne	NPR	58	34
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)OCc2ccccc2)cc1)C1CC1	ZINC000819021249	IK	On-Demand	Anodyne	KDM1A	15	45
O=C(C[C@@H](O)c1ccc(Cl)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021255	FI	On-Demand	Anodyne	GPBAR1	42	39
O=C(C[C@H](O)c1ccc(Cl)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021256	FI	On-Demand	Anodyne	GPBAR1	42	39
O=C(C[C@H](O)c1ccc(Cl)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021257	FI	On-Demand	Anodyne	GPBAR1	42	39
O=C(C[C@@H](O)c1ccc(Cl)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021258	FI	On-Demand	Anodyne	GPBAR1	42	39
CC(=O)N(c1ccc(NC(=O)c2ccc(C)cn2)cc1)C1CC1	ZINC000819021270	DG	On-Demand	Anodyne	FLT3	25	44
CCCc1ccc(N2C[C@@H](C(=O)Nc3ccc(N(C(C)=O)C4CC4)cc3)CC2=O)cc1	ZINC000819021273	HI	On-Demand	Anodyne	CFTR	45	34
CCCc1ccc(N2C[C@H](C(=O)Nc3ccc(N(C(C)=O)C4CC4)cc3)CC2=O)cc1	ZINC000819021274	HI	On-Demand	Anodyne	CFTR	45	34
CC(=O)N(c1ccc(NC(=O)C[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1)C1CC1	ZINC000819021282	IJ	On-Demand	Anodyne	GPR119	38	44
CC(=O)N(c1ccc(NC(=O)C[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1)C1CC1	ZINC000819021283	IJ	On-Demand	Anodyne	GPR119	38	44
O=C(c1cccc(O)c1O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021284	DG	On-Demand	Clean	AVPR2	40	36
O=C(c1cccc(O)c1O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021285	DG	On-Demand	Clean	AVPR2	40	36
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)cc1	ZINC000819021286	GI	On-Demand	Anodyne	PRNP	50	36
CC[C@@H](C)c1ccc(C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)cc1	ZINC000819021288	FJ	On-Demand	Anodyne	SCN2A	19	44
CC[C@@H](C)c1ccc(C(=O)Nc2ccc(N(C(C)=O)C3CC3)cc2)cc1	ZINC000819021288	FJ	On-Demand	Anodyne	PRNP	50	35
CC(=O)N(c1ccc(NC(=O)C(C)(C)C2CCCCC2)cc1)C1CC1	ZINC000819021291	EJ	On-Demand	Anodyne	AMY2	45	31
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021300	HH	On-Demand	Anodyne	CCKAR	18	40
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021300	HH	On-Demand	Anodyne	REN	58	40
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021300	HH	On-Demand	Anodyne	POLG_HCV1	28	41
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021300	HH	On-Demand	Anodyne	FPR1	45	40
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021301	HH	On-Demand	Anodyne	CCKAR	18	40
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021301	HH	On-Demand	Anodyne	REN	58	40
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021301	HH	On-Demand	Anodyne	POLG_HCV1	28	41
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021301	HH	On-Demand	Anodyne	FPR1	45	40
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021302	HH	On-Demand	Anodyne	CCKAR	18	40
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021302	HH	On-Demand	Anodyne	REN	58	40
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021302	HH	On-Demand	Anodyne	POLG_HCV1	28	41
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021302	HH	On-Demand	Anodyne	FPR1	45	40
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021303	HH	On-Demand	Anodyne	CCKAR	18	40
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021303	HH	On-Demand	Anodyne	REN	58	40
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021303	HH	On-Demand	Anodyne	POLG_HCV1	28	41
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021303	HH	On-Demand	Anodyne	FPR1	45	40
O[C@@H](CNCC1(N2CCCC2)CCOCC1)c1ccccc1	ZINC000819021317	DD	On-Demand	Anodyne	HCN1	49	39
O[C@H](CNCC1(N2CCCC2)CCOCC1)c1ccccc1	ZINC000819021318	DD	On-Demand	Anodyne	HCN1	49	39
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCCCC3)cc2)c1	ZINC000819021326	FI	On-Demand	Anodyne	KCNQ2	54	45
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCCCC3)cc2)c1	ZINC000819021326	FI	On-Demand	Anodyne	PRNP	43	37
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCCCC3)cc2)c1	ZINC000819021326	FI	On-Demand	Anodyne	TAAR1	24	41
C[C@H](NC[C@H](O)c1cccnc1)[C@@H](C)N1CCOCC1	ZINC000819021327	CC	On-Demand	Anodyne	ADRB2	18	40
C[C@H](NC[C@H](O)c1cccnc1)[C@@H](C)N1CCOCC1	ZINC000819021327	CC	On-Demand	Anodyne	ADRB1	21	47
C[C@H](NC[C@H](O)c1cccnc1)[C@@H](C)N1CCOCC1	ZINC000819021327	CC	On-Demand	Anodyne	ADRB3	65	47
C[C@H](NC[C@H](O)c1cccnc1)[C@@H](C)N1CCOCC1	ZINC000819021327	CC	On-Demand	Anodyne	KCNA5	17	45
C[C@H](NC[C@H](O)c1cccnc1)[C@H](C)N1CCOCC1	ZINC000819021330	CC	On-Demand	Anodyne	ADRB2	18	40
C[C@H](NC[C@H](O)c1cccnc1)[C@H](C)N1CCOCC1	ZINC000819021330	CC	On-Demand	Anodyne	ADRB1	21	47
C[C@H](NC[C@H](O)c1cccnc1)[C@H](C)N1CCOCC1	ZINC000819021330	CC	On-Demand	Anodyne	ADRB3	65	47
C[C@H](NC[C@H](O)c1cccnc1)[C@H](C)N1CCOCC1	ZINC000819021330	CC	On-Demand	Anodyne	KCNA5	17	45
COc1ccc(N2CC[C@H](CNC(=S)Nc3ccccc3)C2)cc1	ZINC000819021334	EH	On-Demand	Clean	CCR3	20	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2nc(C(C)(C)C)cs2)CC1	ZINC000819021337	GH	On-Demand	Anodyne	GPR119	47	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2nc(C(C)(C)C)cs2)CC1	ZINC000819021338	GH	On-Demand	Anodyne	GPR119	47	43
O[C@@H](CNCC1(N2CCCC2)CCOCC1)c1ccccc1Br	ZINC000819021348	GF	On-Demand	Anodyne	HCN1	48	39
O[C@H](CNCC1(N2CCCC2)CCOCC1)c1ccccc1Br	ZINC000819021349	GF	On-Demand	Anodyne	HCN1	48	39
COc1ccc(N2CC[C@H](CNC(=S)Nc3ccc(NC(C)=O)cc3)C2)cc1	ZINC000819021384	GG	On-Demand	Clean	TSHR	41	31
COc1ccc(N2CC[C@H](CNC(=S)Nc3ccc(NC(C)=O)cc3)C2)cc1	ZINC000819021384	GG	On-Demand	Clean	CCR3	15	41
COc1ccc(OC)c([C@H](O)CNCC2(N3CCCC3)CCOCC2)c1	ZINC000819021388	FD	On-Demand	Anodyne	HCN1	50	38
C[C@@](O)(CC(=O)N1C[C@@H]2CCCCN2c2ccccc21)c1ccccc1	ZINC000819021430	FH	On-Demand	Anodyne	CHRM3	54	39
C[C@@](O)(CC(=O)N1C[C@@H]2CCCCN2c2ccccc21)c1ccccc1	ZINC000819021430	FH	On-Demand	Anodyne	AMY2	44	30
C[C@@](O)(CC(=O)N1C[C@@H]2CCCCN2c2ccccc21)c1ccccc1	ZINC000819021430	FH	On-Demand	Anodyne	CYP2J2	45	33
C[C@@](O)(CC(=O)N1C[C@H]2CCCCN2c2ccccc21)c1ccccc1	ZINC000819021431	FH	On-Demand	Anodyne	CHRM3	54	39
C[C@@](O)(CC(=O)N1C[C@H]2CCCCN2c2ccccc21)c1ccccc1	ZINC000819021431	FH	On-Demand	Anodyne	AMY2	44	30
C[C@@](O)(CC(=O)N1C[C@H]2CCCCN2c2ccccc21)c1ccccc1	ZINC000819021431	FH	On-Demand	Anodyne	CYP2J2	45	33
O=C(c1ccc(-n2ccnc2S)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021432	GI	On-Demand	Anodyne	AVPR2	42	41
O=C(c1ccc(-n2ccnc2S)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021432	GI	On-Demand	Anodyne	L3MBTL3	42	33
O=C(c1ccc(-n2ccnc2S)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021433	GI	On-Demand	Anodyne	AVPR2	42	41
O=C(c1ccc(-n2ccnc2S)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021433	GI	On-Demand	Anodyne	L3MBTL3	42	33
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)NC(C)(C)C)c2)cc1)C1CC1	ZINC000819021440	IH	On-Demand	Anodyne	CPT1A	60	38
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)NC(C)(C)C)c2)cc1)C1CC1	ZINC000819021440	IH	On-Demand	Anodyne	CPT2	42	35
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)NC(C)(C)C)c2)cc1)C1CC1	ZINC000819021440	IH	On-Demand	Anodyne	CPT1B	40	35
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(C#N)cc2F)CC1	ZINC000819021441	GF	On-Demand	Mild	GPR119	54	54
CC(=O)N(c1ccc(NC(=O)[C@@H](F)Cc2ccccc2)cc1)C1CC1	ZINC000819021442	EH	On-Demand	Anodyne	MME	46	39
CC(=O)N(c1ccc(NC(=O)[C@@H](F)Cc2ccccc2)cc1)C1CC1	ZINC000819021442	EH	On-Demand	Anodyne	TIMP3	76	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(C#N)cc2F)CC1	ZINC000819021443	GF	On-Demand	Mild	GPR119	54	54
CC(=O)N(c1ccc(NC(=O)[C@H](F)Cc2ccccc2)cc1)C1CC1	ZINC000819021444	EH	On-Demand	Anodyne	MME	46	39
CC(=O)N(c1ccc(NC(=O)[C@H](F)Cc2ccccc2)cc1)C1CC1	ZINC000819021444	EH	On-Demand	Anodyne	TIMP3	76	40
O=C(c1cnc(Cl)c(Cl)c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021453	FI	On-Demand	Anodyne	AVPR2	48	37
O=C(c1cnc(Cl)c(Cl)c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021453	FI	On-Demand	Anodyne	CXCR3	29	40
O=C(c1cnc(Cl)c(Cl)c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819021453	FI	On-Demand	Anodyne	GPBAR1	65	46
O=C(c1cnc(Cl)c(Cl)c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021456	FI	On-Demand	Anodyne	AVPR2	48	37
O=C(c1cnc(Cl)c(Cl)c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021456	FI	On-Demand	Anodyne	CXCR3	29	40
O=C(c1cnc(Cl)c(Cl)c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819021456	FI	On-Demand	Anodyne	GPBAR1	65	46
Cc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1NC(=O)OC(C)(C)C	ZINC000819021457	HK	On-Demand	Anodyne	AVPR2	74	41
CC(=O)N(c1ccc(NC(=O)c2ncccn2)cc1)C1CC1	ZINC000819021462	CE	On-Demand	Anodyne	TRPV1	22	40
CC(=O)N(c1ccc(NC(=O)c2ncccn2)cc1)C1CC1	ZINC000819021462	CE	On-Demand	Anodyne	TYK2	49	35
CC(=O)N(c1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)C1CC1	ZINC000819021470	FK	On-Demand	Anodyne	FSHR	36	41
CC(=O)N(c1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)C1CC1	ZINC000819021470	FK	On-Demand	Anodyne	AVPR2	39	40
CC(=O)N(c1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)C1CC1	ZINC000819021470	FK	On-Demand	Anodyne	TRPV1	17	44
CC(=O)N(c1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)C1CC1	ZINC000819021470	FK	On-Demand	Anodyne	PRNP	74	60
CC(=O)N(c1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)C1CC1	ZINC000819021470	FK	On-Demand	Anodyne	MCHR1	22	56
CC(=O)N(c1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)C1CC1	ZINC000819021470	FK	On-Demand	Anodyne	DGAT1	40	40
CC(=O)N(c1ccc(NC(=O)c2ccc(-c3ccccc3)cc2)cc1)C1CC1	ZINC000819021470	FK	On-Demand	Anodyne	KCNK3	57	44
CC(=O)N(c1ccc(NC(=O)COc2ccc3ccc(=O)oc3c2)cc1)C1CC1	ZINC000819021473	GG	On-Demand	Anodyne	MAOA	33	40
CC(=O)N(c1ccc(NC(=O)COc2ccc3ccc(=O)oc3c2)cc1)C1CC1	ZINC000819021473	GG	On-Demand	Anodyne	MAOB	15	40
CC(=O)N(c1ccc(NC(=O)c2ccc3c(c2)CCCN3C(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819021482	IK	On-Demand	Anodyne	AVPR2	40	44
CC(=O)N(c1ccc(NC(=O)c2ccc3c(c2)CCCN3C(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819021482	IK	On-Demand	Anodyne	CPT1A	40	39
CC(=O)N(c1ccc(NC(=O)CNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819021495	IF	On-Demand	Anodyne	F2	23	49
CC(=O)N(c1ccc(NC(=O)CNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819021495	IF	On-Demand	Anodyne	LGMN	43	34
CC(=O)N(c1ccc(NC(=O)CNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819021498	IF	On-Demand	Anodyne	F2	23	49
CC(=O)N(c1ccc(NC(=O)CNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)cc1)C1CC1	ZINC000819021498	IF	On-Demand	Anodyne	LGMN	43	34
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1cccs1	ZINC000819021506	GF	On-Demand	Anodyne	CA5B	36	45
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1cccs1	ZINC000819021506	GF	On-Demand	Anodyne	CES1	43	38
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1cccs1	ZINC000819021506	GF	On-Demand	Anodyne	PTPRF	18	40
CCn1c(CNC(=O)c2cc(Br)oc2C)nc2ccccc21	ZINC000819021518	FH	On-Demand	Anodyne	PYGM	22	40
O=C(CCCc1ccccc1)NCCNC(=S)N[C@H]1CCOc2ccccc21	ZINC000819021519	GG	On-Demand	Anodyne	LUXR	67	38
O=C(CCCc1ccccc1)NCCNC(=S)N[C@H]1CCOc2ccccc21	ZINC000819021519	GG	On-Demand	Anodyne	TRAR	50	39
O=C(CCCc1ccccc1)NCCNC(=S)N[C@H]1CCOc2ccccc21	ZINC000819021519	GG	On-Demand	Anodyne	LASR	48	39
O=C(CCCc1ccccc1)NCCNC(=S)N[C@@H]1CCOc2ccccc21	ZINC000819021520	GG	On-Demand	Anodyne	LUXR	67	38
O=C(CCCc1ccccc1)NCCNC(=S)N[C@@H]1CCOc2ccccc21	ZINC000819021520	GG	On-Demand	Anodyne	TRAR	50	39
O=C(CCCc1ccccc1)NCCNC(=S)N[C@@H]1CCOc2ccccc21	ZINC000819021520	GG	On-Demand	Anodyne	LASR	48	39
CCN1CCC[C@@H]1CNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819021535	GE	On-Demand	Anodyne	DRD2	38	42
CCN1CCC[C@@H]1CNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819021535	GE	On-Demand	Anodyne	PREP	57	41
CCN1CCC[C@H]1CNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819021536	GE	On-Demand	Anodyne	DRD2	38	42
CCN1CCC[C@H]1CNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819021536	GE	On-Demand	Anodyne	PREP	57	41
COC[C@H](C)NC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819021537	ED	On-Demand	Anodyne	MMP3	30	43
COC[C@H](C)NC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819021537	ED	On-Demand	Anodyne	CASP1	15	41
COC[C@H](C)NC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819021537	ED	On-Demand	Anodyne	AMP1_PLAFQ	24	40
COC[C@@H](C)NC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819021538	ED	On-Demand	Anodyne	MMP3	30	43
COC[C@@H](C)NC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819021538	ED	On-Demand	Anodyne	CASP1	15	41
COC[C@@H](C)NC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819021538	ED	On-Demand	Anodyne	AMP1_PLAFQ	24	40
COc1cccc([S@@](=O)CC(=O)NCc2ccc(N(C)C)cc2)c1	ZINC000819021539	EE	On-Demand	Clean	MTNR1A	47	42
COc1cccc([S@@](=O)CC(=O)NCc2ccc(N(C)C)cc2)c1	ZINC000819021539	EE	On-Demand	Clean	MTNR1B	44	42
COc1cccc([S@@](=O)CC(=O)NCc2ccc(N(C)C)cc2)c1	ZINC000819021539	EE	On-Demand	Clean	ROCK2	21	42
CCn1c(CNC(=O)[C@@H]2CCCO[C@@H]2C(C)C)nc2ccccc21	ZINC000819021541	EG	On-Demand	Anodyne	ADAM17	17	41
NC(=O)CNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819021569	DC	On-Demand	Anodyne	FAAH	40	42
NC(=O)CNC(=S)NCCNC(=O)CCCc1ccccc1	ZINC000819021569	DC	On-Demand	Anodyne	CES1	43	35
O[C@@H](CNCC1(N2CCCC2)CCOCC1)c1ccccc1F	ZINC000819021571	DE	On-Demand	Anodyne	HCN1	48	39
O[C@H](CNCC1(N2CCCC2)CCOCC1)c1ccccc1F	ZINC000819021572	DE	On-Demand	Anodyne	HCN1	48	39
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCCCCC2)cc1	ZINC000819021605	GH	On-Demand	Anodyne	HTR1D	16	44
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCCCCC2)cc1	ZINC000819021605	GH	On-Demand	Anodyne	KCNQ2	26	42
O[C@@H](CNCC1(N2CCCC2)CCOCC1)c1cccc2ccccc12	ZINC000819021622	FG	On-Demand	Anodyne	HCN1	47	39
CN1CCC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819021627	CE	On-Demand	Anodyne	OPRL1	47	39
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccc2c(c1)OCCO2	ZINC000819021647	GF	On-Demand	Anodyne	QPCT	22	48
CC(=O)Nc1cccc(NC(=S)NCCNC(=O)CCCc2ccccc2)c1	ZINC000819021661	GG	On-Demand	Anodyne	PTGIR	15	42
CC(=O)Nc1cccc(NC(=S)NCCNC(=O)CCCc2ccccc2)c1	ZINC000819021661	GG	On-Demand	Anodyne	HDAC8	18	46
CC(=O)Nc1cccc(NC(=S)NCCNC(=O)CCCc2ccccc2)c1	ZINC000819021661	GG	On-Demand	Anodyne	MTNR1A	36	41
CC(=O)Nc1cccc(NC(=S)NCCNC(=O)CCCc2ccccc2)c1	ZINC000819021661	GG	On-Demand	Anodyne	MTNR1B	38	41
CC(=O)Nc1cccc(NC(=S)NCCNC(=O)CCCc2ccccc2)c1	ZINC000819021661	GG	On-Demand	Anodyne	MMP3	17	44
CC(=O)Nc1cccc(NC(=S)NCCNC(=O)CCCc2ccccc2)c1	ZINC000819021661	GG	On-Demand	Anodyne	HDAC1	15	46
CC(=O)Nc1cccc(NC(=S)NCCNC(=O)CCCc2ccccc2)c1	ZINC000819021661	GG	On-Demand	Anodyne	HDAC2	19	47
CC(=O)Nc1cccc(NC(=S)NCCNC(=O)CCCc2ccccc2)c1	ZINC000819021661	GG	On-Demand	Anodyne	HDAC3	15	41
CC(=O)Nc1cccc(NC(=S)NCCNC(=O)CCCc2ccccc2)c1	ZINC000819021661	GG	On-Demand	Anodyne	KCNK3	54	34
CN1CCC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819021670	CF	On-Demand	Anodyne	CHRNA10	25	40
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N(C)C)cc2)c1	ZINC000819021674	EF	On-Demand	Clean	PTGIR	15	43
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N(C)C)cc2)c1	ZINC000819021674	EF	On-Demand	Clean	KCNK3	39	48
CC(=O)Nc1cccc(NC(=S)NC[C@H](CC(C)C)C(=O)OC(C)(C)C)c1	ZINC000819021681	GH	On-Demand	Anodyne	FPR1	43	34
CC(=O)Nc1cccc(NC(=S)NC[C@@H](CC(C)C)C(=O)OC(C)(C)C)c1	ZINC000819021683	GH	On-Demand	Anodyne	FPR1	43	34
CN(C)S(=O)(=O)c1cccc(NC(=S)NCCCCS(C)(=O)=O)c1	ZINC000819021702	GD	On-Demand	Anodyne	QPCT	44	33
CCn1c(CNC(=O)Cc2cccc(NC(C)=O)c2)nc2ccccc21	ZINC000819021727	FF	On-Demand	Anodyne	MCHR1	24	43
COc1ccc(N2CC[C@H](CNC(=S)Nc3ccc4ccccc4c3)C2)cc1	ZINC000819021728	GJ	On-Demand	Clean	MCHR1	15	43
S=C(NC[C@@H]1C[C@H]1C1CCC1)Nc1ccc2c(c1)OCCO2	ZINC000819021730	DG	On-Demand	Anodyne	QPCT	17	43
CN(Cc1ccsc1)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819021759	DF	On-Demand	Anodyne	PAPA1_CARPA	16	44
O=C(CCCc1ccccc1)NCCNC(=S)NCCN1CCOCC1	ZINC000819021766	GC	On-Demand	Anodyne	CASR	40	37
O=C(CCCc1ccccc1)NCCNC(=S)NCCN1CCOCC1	ZINC000819021766	GC	On-Demand	Anodyne	TACR2	15	40
O=C(CCCc1ccccc1)NCCNC(=S)NCCN1CCOCC1	ZINC000819021766	GC	On-Demand	Anodyne	SIGMAR1	31	42
O=C(CCCc1ccccc1)NCCNC(=S)NCCN1CCOCC1	ZINC000819021766	GC	On-Demand	Anodyne	MMP2	38	42
O=C(CCCc1ccccc1)NCCNC(=S)NCCN1CCOCC1	ZINC000819021766	GC	On-Demand	Anodyne	FAAH	30	40
O=C(CCCc1ccccc1)NCCNC(=S)NCCN1CCOCC1	ZINC000819021766	GC	On-Demand	Anodyne	EPHX2	23	48
O=C(CCCc1ccccc1)NCCNC(=S)NCCN1CCOCC1	ZINC000819021766	GC	On-Demand	Anodyne	CYP2J2	45	34
O=C(CCCc1ccccc1)NCCNC(=S)NCCN1CCOCC1	ZINC000819021766	GC	On-Demand	Anodyne	HPGDS	23	41
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2cccc3ccccc23)CC1	ZINC000819021842	FG	On-Demand	Anodyne	Q6PRC7_IXORI	45	33
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2cccc3ccccc23)CC1	ZINC000819021845	FG	On-Demand	Anodyne	Q6PRC7_IXORI	45	33
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2cccc3ccccc23)CC1	ZINC000819021847	FG	On-Demand	Anodyne	Q6PRC7_IXORI	45	33
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2cccc3ccccc23)CC1	ZINC000819021849	FG	On-Demand	Anodyne	Q6PRC7_IXORI	45	33
O=C(CCCc1ccccc1)NCCNC(=S)NCc1cccs1	ZINC000819021861	FF	On-Demand	Anodyne	CA5B	24	41
O=C(CCCc1ccccc1)NCCNC(=S)NCc1cccs1	ZINC000819021861	FF	On-Demand	Anodyne	CES1	44	37
CCn1c(CNC(=O)CCc2cccc(OC(F)F)c2)nc2ccccc21	ZINC000819021878	FH	On-Demand	Anodyne	PLA2G4A	28	42
O=C(CCCc1ccccc1)NCCNC(=S)NC1CC1	ZINC000819021894	DD	On-Demand	Anodyne	GRIN2B	15	45
O=C(CCCc1ccccc1)NCCNC(=S)NC1CC1	ZINC000819021894	DD	On-Demand	Anodyne	SIGMAR1	21	43
O=C(CCCc1ccccc1)NCCNC(=S)NC1CC1	ZINC000819021894	DD	On-Demand	Anodyne	PREP	41	38
C[C@@H]([C@@H](C)NC[C@H](O)c1ccccc1Cl)N1CCOCC1	ZINC000819021903	DE	On-Demand	Anodyne	OPRL1	21	41
C[C@H](NC[C@H](O)c1ccccc1Cl)[C@H](C)N1CCOCC1	ZINC000819021906	DE	On-Demand	Anodyne	OPRL1	21	41
C[C@H](NC[C@H](O)c1ccccc1Cl)[C@@H](C)N1CCOCC1	ZINC000819021909	DE	On-Demand	Anodyne	OPRL1	21	41
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccccn1	ZINC000819021936	FE	On-Demand	Anodyne	FAAH	65	38
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccccn1	ZINC000819021936	FE	On-Demand	Anodyne	CES1	64	38
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccccn1	ZINC000819021936	FE	On-Demand	Anodyne	SUCNR1	36	40
O=C(CCCc1ccccc1)NCCNC(=S)NCCc1ccccn1	ZINC000819021936	FE	On-Demand	Anodyne	CES1D	43	30
COc1ccc(N2CC[C@H](CNC(=S)NCCN3CCOCC3)C2)cc1	ZINC000819021973	GD	On-Demand	Clean	DRD4	45	37
COc1ccc(N2CC[C@H](CNC(=S)NCCc3cccnc3)C2)cc1	ZINC000819021975	FF	On-Demand	Clean	CHRNA7	34	44
COc1ccc(N2CC[C@H](CNC(=S)NCCc3cccnc3)C2)cc1	ZINC000819021975	FF	On-Demand	Clean	C3AR1	29	42
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(-n2cncn2)cc1	ZINC000819021988	DE	On-Demand	Anodyne	KCNQ2	19	44
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(-n2cncn2)cc1	ZINC000819021989	DE	On-Demand	Anodyne	KCNQ2	19	44
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(-n2cncn2)cc1	ZINC000819021990	DE	On-Demand	Anodyne	KCNQ2	19	44
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(-n2cncn2)cc1	ZINC000819021991	DE	On-Demand	Anodyne	KCNQ2	19	44
COc1ccc(N2CC[C@H](CNC(=S)Nc3ccc(OC)c(F)c3)C2)cc1	ZINC000819022031	GH	On-Demand	Clean	MET	47	37
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccc(F)cc1F	ZINC000819022039	GG	On-Demand	Anodyne	CA5B	20	40
O=C(CCCc1ccccc1)NCCNC(=S)Nc1ccc(F)cc1F	ZINC000819022039	GG	On-Demand	Anodyne	CA5A	23	40
CN1CCC(CNC(=S)NCCNC(=O)CCCc2ccccc2)CC1	ZINC000819022046	GD	On-Demand	Anodyne	ACHE	25	40
CN1CCC(CNC(=S)NCCNC(=O)CCCc2ccccc2)CC1	ZINC000819022046	GD	On-Demand	Anodyne	OPRM1	16	40
CN1CCC(CNC(=S)NCCNC(=O)CCCc2ccccc2)CC1	ZINC000819022046	GD	On-Demand	Anodyne	SLC6A3	18	41
CN1CCC(CNC(=S)NCCNC(=O)CCCc2ccccc2)CC1	ZINC000819022046	GD	On-Demand	Anodyne	SIGMAR1	28	41
CN1CCC(CNC(=S)NCCNC(=O)CCCc2ccccc2)CC1	ZINC000819022046	GD	On-Demand	Anodyne	CCR3	19	40
CN1CCC(CNC(=S)NCCNC(=O)CCCc2ccccc2)CC1	ZINC000819022046	GD	On-Demand	Anodyne	PREP	52	40
CN1CCC(CNC(=S)NCCNC(=O)CCCc2ccccc2)CC1	ZINC000819022046	GD	On-Demand	Anodyne	MMP2	50	31
CN1CCC(CNC(=S)NCCNC(=O)CCCc2ccccc2)CC1	ZINC000819022046	GD	On-Demand	Anodyne	CACNA1I	51	35
CC(=O)c1ccc(NC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819022047	EE	On-Demand	Anodyne	CA2	16	45
CC(=O)c1ccc(NC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819022047	EE	On-Demand	Anodyne	CA1	23	47
CC(=O)c1ccc(NC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819022047	EE	On-Demand	Anodyne	CA12	15	45
CC(=O)c1ccc(NC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819022047	EE	On-Demand	Anodyne	CA9	19	45
CC(=O)c1ccc(NC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819022047	EE	On-Demand	Anodyne	QPCT	51	38
CC(=O)c1ccc(NC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819022047	EE	On-Demand	Anodyne	P96878_MYCTU	18	45
COc1ccc(CNC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819022050	ED	On-Demand	Anodyne	BMP1	41	50
COc1ccc(CNC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819022050	ED	On-Demand	Anodyne	TRPV1	22	43
COc1ccc(CNC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819022050	ED	On-Demand	Anodyne	MMP13	15	40
COc1ccc(CNC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819022050	ED	On-Demand	Anodyne	CA9	16	44
COc1ccc(CNC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819022050	ED	On-Demand	Anodyne	QPCT	15	42
COc1ccc(CNC(=S)NCCCCS(C)(=O)=O)cc1	ZINC000819022050	ED	On-Demand	Anodyne	PROKR1	47	31
COC(=O)c1cnc([C@@H](C)NC(=S)Nc2cccc(C(F)(F)F)c2)s1	ZINC000819022079	GH	On-Demand	Anodyne	BRAF	32	43
COC(=O)c1cnc([C@H](C)NC(=S)Nc2cccc(C(F)(F)F)c2)s1	ZINC000819022080	GH	On-Demand	Anodyne	BRAF	32	43
N#C[C@H]1CC[C@@H](NC(=S)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	ZINC000819022096	GD	On-Demand	Mild	TGM2	56	39
N#C[C@H]1CC[C@@H](NC(=S)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	ZINC000819022096	GD	On-Demand	Mild	F13A1	77	39
N#C[C@H]1CC[C@@H](NC(=S)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	ZINC000819022096	GD	On-Demand	Mild	MERTK	31	42
N#C[C@H]1CC[C@@H](NC(=S)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1	ZINC000819022096	GD	On-Demand	Mild	NAMPT	20	42
O=C(CSc1ccccc1[N+](=O)[O-])OC/C=C/c1ccccc1	ZINC000819022111	EH	On-Demand	Bother	COLA	40	36
O=C(CSc1ccccc1[N+](=O)[O-])OC/C=C\c1ccccc1	ZINC000819022112	EH	On-Demand	Bother	COLA	40	36
COCC(C)(C)N1CCN(C(=S)Nc2ccc(F)c(Cl)c2)CC1	ZINC000819022113	FG	On-Demand	Anodyne	NPY2R	43	39
C=CCN1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819022125	CD	On-Demand	Mild	ADRB1	20	42
C=CCN1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819022125	CD	On-Demand	Mild	SIGMAR1	15	44
C=CCN1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819022125	CD	On-Demand	Mild	CACNA1S	23	41
C=CCN1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819022126	CD	On-Demand	Mild	ADRB1	20	42
C=CCN1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819022126	CD	On-Demand	Mild	SIGMAR1	15	44
C=CCN1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819022126	CD	On-Demand	Mild	CACNA1S	23	41
O=C(NCCc1ccc2c(c1)OCO2)C(F)=C1CCC1	ZINC000819022134	CE	On-Demand	Anodyne	NOS2	75	41
CC(=O)Nc1cccc(NC(=S)N[C@@H]2CC[C@H](C#N)C2)c1	ZINC000819022147	DF	On-Demand	Mild	CSNK2A1	36	42
COC(=O)c1cnc([C@H](C)NC(=S)NCC2CCN(C)CC2)s1	ZINC000819022150	FD	On-Demand	Anodyne	CACNA1I	41	31
COC(=O)c1cnc([C@@H](C)NC(=S)NCC2CCN(C)CC2)s1	ZINC000819022151	FD	On-Demand	Anodyne	CACNA1I	41	31
N#C[C@H]1CC[C@@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1	ZINC000819022153	EC	On-Demand	Mild	CA2	52	56
N#C[C@H]1CC[C@@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1	ZINC000819022153	EC	On-Demand	Mild	CA1	48	56
N#C[C@H]1CC[C@@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1	ZINC000819022153	EC	On-Demand	Mild	CA7	28	41
N#C[C@H]1CC[C@@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1	ZINC000819022153	EC	On-Demand	Mild	CA5B	24	40
N#C[C@H]1CC[C@@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1	ZINC000819022153	EC	On-Demand	Mild	CA4	34	45
N#C[C@H]1CC[C@@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1	ZINC000819022153	EC	On-Demand	Mild	CA5A	24	40
N#C[C@H]1CC[C@@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1	ZINC000819022153	EC	On-Demand	Mild	CA14	40	46
N#C[C@H]1CC[C@@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1	ZINC000819022153	EC	On-Demand	Mild	CA12	42	50
N#C[C@H]1CC[C@@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1	ZINC000819022153	EC	On-Demand	Mild	CA9	41	56
COC(=O)c1cnc([C@@H](C)NC(=S)Nc2cccc(OC)c2)s1	ZINC000819022157	FF	On-Demand	Anodyne	MTNR1B	20	40
COC(=O)c1cnc([C@H](C)NC(=S)Nc2cccc(OC)c2)s1	ZINC000819022158	FF	On-Demand	Anodyne	MTNR1B	20	40
COCC(C)(C)N1CCN(C(=S)Nc2ccc(OC(C)C)cc2)CC1	ZINC000819022169	FG	On-Demand	Anodyne	NPY2R	17	43
COc1cc(CNC(=O)C(F)=C2CCC2)ccc1OC(F)F	ZINC000819022222	DG	On-Demand	Anodyne	MT-ND1	23	41
COCC(C)(C)N1CCN(C(=S)Nc2ccc(C(N)=O)cc2)CC1	ZINC000819022239	FD	On-Demand	Anodyne	NPY2R	31	42
COCC(C)(C)N1CCN(C(=S)Nc2ccc(C(N)=O)cc2)CC1	ZINC000819022239	FD	On-Demand	Anodyne	ACR	50	36
COC(=O)c1cnc([C@@H](C)NC(=S)Nc2c(C)cccc2C)s1	ZINC000819022351	EH	On-Demand	Anodyne	LCK	17	41
COC(=O)c1cnc([C@H](C)NC(=S)Nc2c(C)cccc2C)s1	ZINC000819022352	EH	On-Demand	Anodyne	LCK	17	41
C=CCN1CCC(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819022357	FE	On-Demand	Mild	GPR119	22	41
C=CCN1CCC(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819022358	FE	On-Demand	Mild	GPR119	22	41
O=C(/C=C\[C@@H]1CCCO1)NCCc1ccc2c(c1)OCO2	ZINC000819022362	CD	On-Demand	Anodyne	NOS2	40	41
O=C(/C=C/[C@@H]1CCCO1)NCCc1ccc2c(c1)OCO2	ZINC000819022363	CD	On-Demand	Anodyne	NOS2	40	41
O=C(/C=C/[C@H]1CCCO1)NCCc1ccc2c(c1)OCO2	ZINC000819022364	CD	On-Demand	Anodyne	NOS2	40	41
O=C(/C=C\[C@H]1CCCO1)NCCc1ccc2c(c1)OCO2	ZINC000819022365	CD	On-Demand	Anodyne	NOS2	40	41
COC(=O)c1cnc([C@H](C)NC(=S)Nc2cccc(C)c2)s1	ZINC000819022366	EG	On-Demand	Anodyne	KCNK3	58	38
COC(=O)c1cnc([C@H](C)NC(=S)Nc2cccc(C)c2)s1	ZINC000819022366	EG	On-Demand	Anodyne	KCNK9	49	34
COC(=O)c1cnc([C@@H](C)NC(=S)Nc2cccc(C)c2)s1	ZINC000819022367	EG	On-Demand	Anodyne	KCNK3	58	38
COC(=O)c1cnc([C@@H](C)NC(=S)Nc2cccc(C)c2)s1	ZINC000819022367	EG	On-Demand	Anodyne	KCNK9	49	34
COCC(C)(C)N1CCN(C(=S)Nc2cc(Cl)ccc2OC)CC1	ZINC000819022374	FG	On-Demand	Anodyne	RBP4	19	45
N#C[C@H]1CC[C@@H](NC(=S)Nc2ccc(OC(F)(F)F)cc2)C1	ZINC000819022381	EH	On-Demand	Mild	EPHX2	45	49
CCN1CCC[C@@H]1CNC(=S)N[C@H](C)c1ncc(C(=O)OC)s1	ZINC000819022393	FD	On-Demand	Anodyne	DRD2	32	40
CCN1CCC[C@@H]1CNC(=S)N[C@@H](C)c1ncc(C(=O)OC)s1	ZINC000819022396	FD	On-Demand	Anodyne	DRD2	32	40
COCC(C)(C)N1CCN(C(=S)Nc2cccc(OC)c2)CC1	ZINC000819022424	EE	On-Demand	Anodyne	NPY2R	25	40
C=CCN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819022430	CF	On-Demand	Mild	ADRB1	36	44
C=CCN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819022430	CF	On-Demand	Mild	ADRB3	55	50
C=CCN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819022430	CF	On-Demand	Mild	CYP3A4	46	39
C=CCN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819022431	CF	On-Demand	Mild	ADRB1	36	44
C=CCN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819022431	CF	On-Demand	Mild	ADRB3	55	50
C=CCN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819022431	CF	On-Demand	Mild	CYP3A4	46	39
COCC(C)(C)N1CCN(C(=S)Nc2ccc(OC)cc2)CC1	ZINC000819022432	EE	On-Demand	Anodyne	NPY2R	23	43
C=CCC1(C(=O)NNC(=O)c2cn(C)c3ccccc23)CCOCC1	ZINC000819022443	EE	On-Demand	Reactive	CNR1	17	41
C=CCC1(C(=O)NNC(=O)c2cn(C)c3ccccc23)CCOCC1	ZINC000819022443	EE	On-Demand	Reactive	CNR2	22	41
COC(=O)c1cnc([C@@H](C)NC(=S)Nc2ccc(OC)c(F)c2)s1	ZINC000819022459	FG	On-Demand	Anodyne	KDR	18	47
COC(=O)c1cnc([C@@H](C)NC(=S)Nc2ccc(OC)c(F)c2)s1	ZINC000819022459	FG	On-Demand	Anodyne	MET	68	41
COC(=O)c1cnc([C@H](C)NC(=S)Nc2ccc(OC)c(F)c2)s1	ZINC000819022460	FG	On-Demand	Anodyne	KDR	18	47
COC(=O)c1cnc([C@H](C)NC(=S)Nc2ccc(OC)c(F)c2)s1	ZINC000819022460	FG	On-Demand	Anodyne	MET	68	41
COC(=O)c1cnc([C@H](C)NC(=S)NC23CC4CC(CC(C4)C2)C3)s1	ZINC000819022485	GG	On-Demand	Anodyne	EPHX2	43	40
COC(=O)c1cnc([C@@H](C)NC(=S)NC23CC4CC(CC(C4)C2)C3)s1	ZINC000819022486	GG	On-Demand	Anodyne	EPHX2	43	40
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc(S(=O)(=O)N(C)C)c1	ZINC000819022491	JF	On-Demand	Bother	COLA	122	46
COC(=O)c1cnc([C@H](C)NC(=S)NCc2ccccc2)s1	ZINC000819022505	EF	On-Demand	Anodyne	PDS	49	34
COC(=O)c1cnc([C@@H](C)NC(=S)NCc2ccccc2)s1	ZINC000819022506	EF	On-Demand	Anodyne	PDS	49	34
C=CCN1CCC(NC[C@H](O)c2ccc(C)cc2)CC1	ZINC000819022518	CE	On-Demand	Mild	ADRB3	15	47
C=CCN1CCC(NC[C@@H](O)c2ccc(C)cc2)CC1	ZINC000819022519	CE	On-Demand	Mild	ADRB3	15	47
COCC(C)(C)N1CCN(C(=S)Nc2cccc(NC(C)=O)c2)CC1	ZINC000819022520	FE	On-Demand	Anodyne	NPY2R	35	41
COCC(C)(C)N1CCN(C(=S)Nc2ccccc2)CC1	ZINC000819022521	DE	On-Demand	Anodyne	NPY2R	35	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1ccc3c(c1)OCO3)C2	ZINC000819022551	FD	On-Demand	Anodyne	BMP1	57	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1ccc3c(c1)OCO3)C2	ZINC000819022551	FD	On-Demand	Anodyne	NOS2	89	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1ccc3c(c1)OCO3)C2	ZINC000819022552	FD	On-Demand	Anodyne	BMP1	57	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1ccc3c(c1)OCO3)C2	ZINC000819022552	FD	On-Demand	Anodyne	NOS2	89	40
N#C[C@H]1CC[C@@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819022576	EF	On-Demand	Mild	DRD4	37	49
N#C[C@H]1CC[C@@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819022576	EF	On-Demand	Mild	ACHE	36	44
N#C[C@H]1CC[C@@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819022576	EF	On-Demand	Mild	CHRM3	15	43
N#C[C@H]1CC[C@@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819022576	EF	On-Demand	Mild	SIGMAR1	54	53
N#C[C@H]1CC[C@@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819022576	EF	On-Demand	Mild	MCHR1	22	46
COCC(C)(C)N1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000819022579	GG	On-Demand	Anodyne	NPY2R	39	41
COCC(C)(C)N1CCN(C(=S)Nc2ccc(C#N)c(Cl)c2)CC1	ZINC000819022607	FF	On-Demand	Mild	NPY2R	36	42
COC(=O)c1cnc([C@@H](C)NC(=S)Nc2ccc(OC)c(Cl)c2)s1	ZINC000819022624	GH	On-Demand	Anodyne	GRM4	24	49
COC(=O)c1cnc([C@@H](C)NC(=S)Nc2ccc(OC)c(Cl)c2)s1	ZINC000819022624	GH	On-Demand	Anodyne	CSF1R	15	40
COC(=O)c1cnc([C@H](C)NC(=S)Nc2ccc(OC)c(Cl)c2)s1	ZINC000819022625	GH	On-Demand	Anodyne	GRM4	24	49
COC(=O)c1cnc([C@H](C)NC(=S)Nc2ccc(OC)c(Cl)c2)s1	ZINC000819022625	GH	On-Demand	Anodyne	CSF1R	15	40
COCC(C)(C)N1CCN(C(=S)Nc2ccc(OC(F)F)cc2)CC1	ZINC000819022627	FG	On-Demand	Anodyne	NPY2R	17	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1ccc2c(c1)OCO2	ZINC000819022692	ED	On-Demand	Anodyne	BMP1	32	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1ccc2c(c1)OCO2	ZINC000819022692	ED	On-Demand	Anodyne	NOS2	53	41
N#C[C@H]1CC[C@@H](NC(=S)NC23CC4CC(CC(C4)C2)C3)C1	ZINC000819022703	DG	On-Demand	Mild	EPHX2	35	41
N#C[C@H]1CC[C@@H](NC(=S)Nc2cccc(OC(F)(F)F)c2)C1	ZINC000819022750	EH	On-Demand	Mild	EPHX2	21	41
C=CCN1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819022781	CD	On-Demand	Mild	ADRB1	23	40
C=CCN1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819022781	CD	On-Demand	Mild	ADRB3	64	50
C=CCN1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819022782	CD	On-Demand	Mild	ADRB1	23	40
C=CCN1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819022782	CD	On-Demand	Mild	ADRB3	64	50
CCN1CCC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819022811	CD	On-Demand	Anodyne	BIRC2	21	40
CCN1CCC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819022812	CD	On-Demand	Anodyne	BIRC2	21	40
CCN1CCC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819022813	CD	On-Demand	Anodyne	BIRC2	21	40
CCN1CCC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819022814	CD	On-Demand	Anodyne	BIRC2	21	40
COc1ccc(CNC(=S)NCCC(C)(C)C(=O)OC(C)(C)C)cc1	ZINC000819022817	FG	On-Demand	Anodyne	TRPV1	25	41
COc1ccc(CNC(=S)NCCC(C)(C)C(=O)OC(C)(C)C)cc1	ZINC000819022817	FG	On-Demand	Anodyne	PROKR1	61	34
CN1CCC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819022826	CD	On-Demand	Anodyne	CHRNA10	28	40
CN1CCC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819022828	CD	On-Demand	Anodyne	CHRNA10	28	40
CCN1CCC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819022830	DF	On-Demand	Anodyne	CCR2	55	40
CCN1CCC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819022831	DF	On-Demand	Anodyne	CCR2	55	40
CCN1CCC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819022832	DF	On-Demand	Anodyne	CCR2	55	40
CCN1CCC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819022833	DF	On-Demand	Anodyne	CCR2	55	40
CCN1CCC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022849	GF	On-Demand	Anodyne	CELA1	18	41
CCN1CCC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022849	GF	On-Demand	Anodyne	CTSD	127	47
CCN1CCC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022849	GF	On-Demand	Anodyne	PGC	74	39
CCN1CCC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022849	GF	On-Demand	Anodyne	CMA1	35	43
CCN1CCC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022849	GF	On-Demand	Anodyne	TRY1_BOVIN	22	40
CCN1CCC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022849	GF	On-Demand	Anodyne	CCKAR	23	43
CCN1CCC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022849	GF	On-Demand	Anodyne	CTSK	17	42
CCN1CCC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022849	GF	On-Demand	Anodyne	PGA	41	39
CCN1CCC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022849	GF	On-Demand	Anodyne	BACE2	59	44
CCN1CCC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022849	GF	On-Demand	Anodyne	REN	132	46
CCN1CCC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022849	GF	On-Demand	Anodyne	REN1	61	42
CCN1CCC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022849	GF	On-Demand	Anodyne	CTSE	49	39
CCN1CCC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022849	GF	On-Demand	Anodyne	BACE1	101	47
CCN1CCC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022849	GF	On-Demand	Anodyne	PGA5	45	33
CCN1CCC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022849	GF	On-Demand	Anodyne	FPR1	49	40
CCN1CCC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022849	GF	On-Demand	Anodyne	PLM1_PLAFA	34	45
CCN1CCC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022849	GF	On-Demand	Anodyne	PLM2_PLAFA	47	36
CCN1CCC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022849	GF	On-Demand	Anodyne	BIRC2	37	40
CCN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022850	GF	On-Demand	Anodyne	CELA1	18	41
CCN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022850	GF	On-Demand	Anodyne	CTSD	127	47
CCN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022850	GF	On-Demand	Anodyne	PGC	74	39
CCN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022850	GF	On-Demand	Anodyne	CMA1	35	43
CCN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022850	GF	On-Demand	Anodyne	TRY1_BOVIN	22	40
CCN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022850	GF	On-Demand	Anodyne	CCKAR	23	43
CCN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022850	GF	On-Demand	Anodyne	CTSK	17	42
CCN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022850	GF	On-Demand	Anodyne	PGA	41	39
CCN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022850	GF	On-Demand	Anodyne	BACE2	59	44
CCN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022850	GF	On-Demand	Anodyne	REN	132	46
CCN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022850	GF	On-Demand	Anodyne	REN1	61	42
CCN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022850	GF	On-Demand	Anodyne	CTSE	49	39
CCN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022850	GF	On-Demand	Anodyne	BACE1	101	47
CCN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022850	GF	On-Demand	Anodyne	PGA5	45	33
CCN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022850	GF	On-Demand	Anodyne	FPR1	49	40
CCN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022850	GF	On-Demand	Anodyne	PLM1_PLAFA	34	45
CCN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022850	GF	On-Demand	Anodyne	PLM2_PLAFA	47	36
CCN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819022850	GF	On-Demand	Anodyne	BIRC2	37	40
CCN1CCC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819022851	CE	On-Demand	Anodyne	OPRL1	44	38
CCN1CCC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819022852	CE	On-Demand	Anodyne	OPRL1	44	38
CCN1CCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819022891	BD	On-Demand	Anodyne	SLC6A3	15	46
CCN1CCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819022891	BD	On-Demand	Anodyne	BIRC2	30	41
CCN1CCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819022892	BD	On-Demand	Anodyne	SLC6A3	15	46
CCN1CCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819022892	BD	On-Demand	Anodyne	BIRC2	30	41
CCN1CCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819022893	BD	On-Demand	Anodyne	SLC6A3	15	46
CCN1CCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819022893	BD	On-Demand	Anodyne	BIRC2	30	41
CCN1CCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819022894	BD	On-Demand	Anodyne	SLC6A3	15	46
CCN1CCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819022894	BD	On-Demand	Anodyne	BIRC2	30	41
CCN1CCC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819022897	DF	On-Demand	Anodyne	SFRP1	41	33
CCN1CCC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819022898	DF	On-Demand	Anodyne	SFRP1	41	33
CCN1CCC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819022899	DF	On-Demand	Anodyne	SFRP1	41	33
CCN1CCC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819022900	DF	On-Demand	Anodyne	SFRP1	41	33
CN1CCC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819022926	DE	On-Demand	Anodyne	CCR2	53	38
CN1CCC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819022926	DE	On-Demand	Anodyne	CHRNA10	22	45
CN1CCC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819022929	DE	On-Demand	Anodyne	CCR2	53	38
CN1CCC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819022929	DE	On-Demand	Anodyne	CHRNA10	22	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCN2C(=O)CCC2=O)CC1	ZINC000819022932	GD	On-Demand	Anodyne	GPR119	35	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCN2C(=O)CCC2=O)CC1	ZINC000819022934	GD	On-Demand	Anodyne	GPR119	35	42
CCN1CCC[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819022942	FE	On-Demand	Anodyne	GPR119	26	40
CCN1CCC[C@@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819022944	FE	On-Demand	Anodyne	GPR119	26	40
CCN1CCC[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819022946	FE	On-Demand	Anodyne	GPR119	26	40
CCN1CCC[C@@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819022947	FE	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)C(C)(C)CCNC(=S)NCc1ccccc1	ZINC000819023043	EG	On-Demand	Anodyne	TRPV1	15	41
CC(C)(C)OC(=O)C(C)(C)CCNC(=S)NCc1ccccc1	ZINC000819023043	EG	On-Demand	Anodyne	PDS	45	34
CN1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819023046	CE	On-Demand	Anodyne	ADRB1	39	49
CN1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819023046	CE	On-Demand	Anodyne	SLC6A3	15	42
CN1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819023046	CE	On-Demand	Anodyne	ADRB3	58	50
CN1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819023046	CE	On-Demand	Anodyne	IGF1R	28	40
CN1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819023046	CE	On-Demand	Anodyne	CHRNA10	31	42
CN1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819023046	CE	On-Demand	Anodyne	CYP3A4	49	38
CN1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819023048	CE	On-Demand	Anodyne	ADRB1	39	49
CN1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819023048	CE	On-Demand	Anodyne	SLC6A3	15	42
CN1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819023048	CE	On-Demand	Anodyne	ADRB3	58	50
CN1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819023048	CE	On-Demand	Anodyne	IGF1R	28	40
CN1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819023048	CE	On-Demand	Anodyne	CHRNA10	31	42
CN1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819023048	CE	On-Demand	Anodyne	CYP3A4	49	38
S=C(NC1CCN(Cc2ccccc2)CC1)N1CCC[C@H](n2ccnn2)C1	ZINC000819023081	GE	On-Demand	Anodyne	DRD4	33	48
S=C(NC1CCN(Cc2ccccc2)CC1)N1CCC[C@H](n2ccnn2)C1	ZINC000819023081	GE	On-Demand	Anodyne	ACHE	22	40
S=C(NC1CCN(Cc2ccccc2)CC1)N1CCC[C@H](n2ccnn2)C1	ZINC000819023081	GE	On-Demand	Anodyne	SIGMAR1	35	46
S=C(NC1CCN(Cc2ccccc2)CC1)N1CCC[C@H](n2ccnn2)C1	ZINC000819023081	GE	On-Demand	Anodyne	CCR3	16	40
S=C(NC1CCN(Cc2ccccc2)CC1)N1CCC[C@@H](n2ccnn2)C1	ZINC000819023082	GE	On-Demand	Anodyne	DRD4	33	48
S=C(NC1CCN(Cc2ccccc2)CC1)N1CCC[C@@H](n2ccnn2)C1	ZINC000819023082	GE	On-Demand	Anodyne	ACHE	22	40
S=C(NC1CCN(Cc2ccccc2)CC1)N1CCC[C@@H](n2ccnn2)C1	ZINC000819023082	GE	On-Demand	Anodyne	SIGMAR1	35	46
S=C(NC1CCN(Cc2ccccc2)CC1)N1CCC[C@@H](n2ccnn2)C1	ZINC000819023082	GE	On-Demand	Anodyne	CCR3	16	40
S=C(NCCc1ccc2c(c1)OCCO2)N1CCC[C@H](n2ccnn2)C1	ZINC000819023112	FD	On-Demand	Anodyne	NOS2	51	39
S=C(NCCc1ccc2c(c1)OCCO2)N1CCC[C@@H](n2ccnn2)C1	ZINC000819023113	FD	On-Demand	Anodyne	NOS2	51	39
C[C@H](NC(=S)N1CCC[C@@H](n2ccnn2)C1)c1ccccc1	ZINC000819023118	DF	On-Demand	Anodyne	BIRC8	45	35
C[C@@H](NC(=S)N1CCC[C@H](n2ccnn2)C1)c1ccccc1	ZINC000819023119	DF	On-Demand	Anodyne	BIRC8	45	35
C[C@@H](NC(=S)N1CCC[C@@H](n2ccnn2)C1)c1ccccc1	ZINC000819023120	DF	On-Demand	Anodyne	BIRC8	45	35
C[C@H](NC(=S)N1CCC[C@H](n2ccnn2)C1)c1ccccc1	ZINC000819023121	DF	On-Demand	Anodyne	BIRC8	45	35
CC[C@H](C)NC(=S)N1C[C@H](c2ccc(Br)cc2)[C@@H](C(=O)OC)C1	ZINC000819023146	GG	On-Demand	Anodyne	SLC6A4	24	43
CC[C@H](C)NC(=S)N1C[C@H](c2ccc(Br)cc2)[C@@H](C(=O)OC)C1	ZINC000819023146	GG	On-Demand	Anodyne	SLC6A3	42	43
CCCNC(=S)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000819023164	DE	On-Demand	Anodyne	SIGMAR1	15	41
S=C(Nc1ccc(Cl)nc1)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000819023165	FH	On-Demand	Anodyne	ADK	15	49
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819023176	FD	On-Demand	Anodyne	ADRB3	38	43
CC(C)(C)OC(=O)C(C)(C)CCNC(=S)Nc1ccccc1C#N	ZINC000819023177	EH	On-Demand	Mild	ADRB1	40	32
CCN1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819023178	CD	On-Demand	Anodyne	SLC6A3	24	45
CCN1CCC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819023179	CD	On-Demand	Anodyne	SLC6A3	24	45
CCN1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819023180	CD	On-Demand	Anodyne	SLC6A3	24	45
CCN1CCC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819023181	CD	On-Demand	Anodyne	SLC6A3	24	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1c(C)nn(-c3ccccc3)c1C)C2	ZINC000819023186	GF	On-Demand	Anodyne	P2RX7	18	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1c(C)nn(-c3ccccc3)c1C)C2	ZINC000819023187	GF	On-Demand	Anodyne	P2RX7	18	48
O=C1CCC(=O)N1CCCNC[C@@H](O)c1ccccc1	ZINC000819023192	CC	On-Demand	Anodyne	ADRB2	39	44
O=C1CCC(=O)N1CCCNC[C@@H](O)c1ccccc1	ZINC000819023192	CC	On-Demand	Anodyne	ADRB3	66	40
O=C1CCC(=O)N1CCCNC[C@H](O)c1ccccc1	ZINC000819023193	CC	On-Demand	Anodyne	ADRB2	39	44
O=C1CCC(=O)N1CCCNC[C@H](O)c1ccccc1	ZINC000819023193	CC	On-Demand	Anodyne	ADRB3	66	40
CCN1CCC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819023218	BD	On-Demand	Anodyne	ADRB3	74	46
CCN1CCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819023219	BD	On-Demand	Anodyne	ADRB3	74	46
CCN1CCC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819023220	BD	On-Demand	Anodyne	ADRB3	74	46
CCN1CCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819023221	BD	On-Demand	Anodyne	ADRB3	74	46
CCN1CCC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819023222	ED	On-Demand	Anodyne	ADRB3	20	46
CCN1CCC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819023223	ED	On-Demand	Anodyne	ADRB3	20	46
CCN1CCC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819023224	ED	On-Demand	Anodyne	ADRB3	20	46
CCN1CCC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819023225	ED	On-Demand	Anodyne	ADRB3	20	46
CC(C)(C)OC(=O)C(C)(C)CCNC(=S)Nc1ccc2c(c1)OCO2	ZINC000819023240	FG	On-Demand	Anodyne	QPCT	35	50
CCN1CCC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819023241	CE	On-Demand	Anodyne	ADRB3	20	43
CCN1CCC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819023242	CE	On-Demand	Anodyne	ADRB3	20	43
CC(C)(C)OC(=O)C(C)(C)CCNC(=S)Nc1ccc(C(N)=O)cc1	ZINC000819023262	FF	On-Demand	Anodyne	ACR	44	34
CN1CCC[C@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819023265	DE	On-Demand	Anodyne	ADRB3	17	40
CN1CCC[C@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819023266	DE	On-Demand	Anodyne	ADRB3	17	40
O=C1CCC(=O)N1CCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819023273	DC	On-Demand	Bother	ADRB3	42	34
O=C1CCC(=O)N1CCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819023274	DC	On-Demand	Bother	ADRB3	42	34
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819023277	FD	On-Demand	Anodyne	ADRB3	38	43
COC(=O)[C@@H]1CN(C(=S)NC(C)C)C[C@H]1c1ccc(Br)cc1	ZINC000819023312	GF	On-Demand	Anodyne	SLC6A4	27	46
COC(=O)[C@@H]1CN(C(=S)NC(C)C)C[C@H]1c1ccc(Br)cc1	ZINC000819023312	GF	On-Demand	Anodyne	SLC6A3	47	46
CC(=O)c1ccc(NC(=S)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000819023374	GH	On-Demand	Anodyne	LTA4H	24	40
CC(=O)c1ccc(NC(=S)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000819023374	GH	On-Demand	Anodyne	ADK	15	44
CC(=O)c1ccc(NC(=S)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000819023374	GH	On-Demand	Anodyne	NPY2R	28	42
CC(=O)c1ccc(NC(=S)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000819023374	GH	On-Demand	Anodyne	NOD2	40	34
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819023415	FI	On-Demand	Anodyne	TSHR	52	30
CCN1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819023416	CE	On-Demand	Anodyne	ADRB1	37	47
CCN1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819023416	CE	On-Demand	Anodyne	ADRB3	55	49
CCN1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819023416	CE	On-Demand	Anodyne	IGF1R	28	40
CCN1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819023416	CE	On-Demand	Anodyne	CYP3A4	48	37
CCN1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819023418	CE	On-Demand	Anodyne	ADRB1	37	47
CCN1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819023418	CE	On-Demand	Anodyne	ADRB3	55	49
CCN1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819023418	CE	On-Demand	Anodyne	IGF1R	28	40
CCN1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819023418	CE	On-Demand	Anodyne	CYP3A4	48	37
CCN1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819023419	CE	On-Demand	Anodyne	ADRB1	37	47
CCN1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819023419	CE	On-Demand	Anodyne	ADRB3	55	49
CCN1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819023419	CE	On-Demand	Anodyne	IGF1R	28	40
CCN1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819023419	CE	On-Demand	Anodyne	CYP3A4	48	37
CCN1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819023421	CE	On-Demand	Anodyne	ADRB1	37	47
CCN1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819023421	CE	On-Demand	Anodyne	ADRB3	55	49
CCN1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819023421	CE	On-Demand	Anodyne	IGF1R	28	40
CCN1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819023421	CE	On-Demand	Anodyne	CYP3A4	48	37
CCN1CCC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819023427	CD	On-Demand	Bother	BIRC2	17	42
CCN1CCC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819023428	CD	On-Demand	Bother	BIRC2	17	42
CCN1CCC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819023429	CD	On-Demand	Bother	BIRC2	17	42
CCN1CCC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819023430	CD	On-Demand	Bother	BIRC2	17	42
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	CELA1	23	43
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	CTSD	125	46
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	PGC	83	43
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	CMA1	39	44
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	CTRA_BOVIN	40	31
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	PAPA1_CARPA	28	40
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	CCKAR	27	44
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	CTSK	17	44
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	CTSL	22	40
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	CACNA1B	41	40
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	PGA	45	43
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	BACE2	59	44
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	CELA2A	47	31
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	REN	159	49
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	REN1	68	43
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	CTSE	58	43
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	BACE1	95	46
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	PGA5	54	32
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	FPR1	50	43
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	PLM1_PLAFA	35	46
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819023461	GE	On-Demand	Anodyne	PLM2_PLAFA	49	37
CC(C)(C)OC(=O)C(C)(C)CCNC(=S)Nc1ccc2c(c1)OCCCO2	ZINC000819023478	GH	On-Demand	Anodyne	QPCT	36	47
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)C(F)=C1CCC1	ZINC000819023500	DH	On-Demand	Anodyne	P2RX7	24	54
CCC(CC)(CNC(=S)Nc1ccc(C(N)=O)cc1)C(=O)OC(C)(C)C	ZINC000819023506	GG	On-Demand	Anodyne	ACR	43	34
Cc1nn(C)c(Cl)c1S(=O)(=O)Nc1ccccc1CC(=O)O	ZINC000819023507	ED	On-Demand	Anodyne	CXCL8	31	43
O=C1CCC(=O)N1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819023508	DD	On-Demand	Anodyne	ADRB2	56	39
O=C1CCC(=O)N1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819023508	DD	On-Demand	Anodyne	ADRB1	60	48
O=C1CCC(=O)N1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819023508	DD	On-Demand	Anodyne	ADRB3	81	48
O=C1CCC(=O)N1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819023510	DD	On-Demand	Anodyne	ADRB2	56	39
O=C1CCC(=O)N1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819023510	DD	On-Demand	Anodyne	ADRB1	60	48
O=C1CCC(=O)N1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819023510	DD	On-Demand	Anodyne	ADRB3	81	48
CC(C)(C)OC(=O)C(C)(C)CCNC(=S)NCCc1cccnc1	ZINC000819023511	FF	On-Demand	Anodyne	PTAFR	33	41
Cc1nn(C)c(Cl)c1[C@@H]1CCCN1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819023549	GG	On-Demand	Anodyne	P2RY14	44	34
Cc1nn(C)c(Cl)c1[C@H]1CCCN1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819023550	GG	On-Demand	Anodyne	P2RY14	44	34
S=C(NC1CCC1)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000819023593	DF	On-Demand	Anodyne	ADK	15	43
S=C(NC1CCC1)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000819023593	DF	On-Demand	Anodyne	SIGMAR1	26	40
Cc1nn(C)c(Cl)c1S(=O)(=O)NCc1ccc(C(=O)O)cc1	ZINC000819023608	ED	On-Demand	Anodyne	NMT1	40	37
Cc1nn(C)c(Cl)c1S(=O)(=O)NCc1ccc(C(=O)O)cc1	ZINC000819023608	ED	On-Demand	Anodyne	RPA1	42	37
O=C(Nc1ccc(S(=O)(=O)NCC(F)(F)F)cc1)C(F)=C1CCC1	ZINC000819023648	FF	On-Demand	Anodyne	CA2	20	40
O=C(Nc1ccc(S(=O)(=O)NCC(F)(F)F)cc1)C(F)=C1CCC1	ZINC000819023648	FF	On-Demand	Anodyne	CA4	18	40
Cc1nn(C)c(Cl)c1[C@@H]1CCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819023655	GG	On-Demand	Anodyne	F2	23	41
Cc1nn(C)c(Cl)c1[C@@H]1CCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819023655	GG	On-Demand	Anodyne	TMPRSS11D	61	34
Cc1nn(C)c(Cl)c1[C@H]1CCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819023657	GG	On-Demand	Anodyne	F2	23	41
Cc1nn(C)c(Cl)c1[C@H]1CCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819023657	GG	On-Demand	Anodyne	TMPRSS11D	61	34
C=C(C)CN1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819023662	CD	On-Demand	Mild	ADRB3	66	49
C=C(C)CN1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819023663	CD	On-Demand	Mild	ADRB3	66	49
O=C(Nc1ccccc1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819023668	EF	On-Demand	Anodyne	EPHX2	25	43
O=C(Nc1ccccc1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819023670	EF	On-Demand	Anodyne	EPHX2	25	43
O=C(Nc1ccccc1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819023672	EF	On-Demand	Anodyne	EPHX2	25	43
O=C(Nc1ccccc1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819023674	EF	On-Demand	Anodyne	EPHX2	25	43
CC(=O)Nc1ccc(NC(=S)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000819023683	GH	On-Demand	Anodyne	TSHR	50	33
CC(=O)Nc1ccc(NC(=S)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000819023683	GH	On-Demand	Anodyne	ADK	15	45
CC(=O)Nc1ccc(NC(=S)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000819023683	GH	On-Demand	Anodyne	SIGMAR1	28	45
CC(=O)Nc1ccc(NC(=S)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000819023683	GH	On-Demand	Anodyne	NPY2R	30	41
S=C(NC[C@@H]1CCCO1)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000819023693	EE	On-Demand	Anodyne	TNK2	42	38
S=C(NC[C@H]1CCCO1)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000819023694	EE	On-Demand	Anodyne	TNK2	42	38
CNC(=S)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000819023711	CD	On-Demand	Anodyne	ADK	15	43
CNC(=S)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000819023711	CD	On-Demand	Anodyne	SIGMAR1	27	40
CN1CCC(CNC(=S)NCCC(C)(C)C(=O)OC(C)(C)C)CC1	ZINC000819023718	FF	On-Demand	Anodyne	CACNA1I	46	34
CN1CCC[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819023747	CD	On-Demand	Anodyne	CHRNA10	47	38
CN1CCC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819023748	CD	On-Demand	Anodyne	CHRNA10	47	38
CN1CCC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819023759	CD	On-Demand	Anodyne	CHRNA10	52	44
CN1CCC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819023761	CD	On-Demand	Anodyne	CHRNA10	52	44
CN1CCC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819023787	CE	On-Demand	Anodyne	SLC6A3	27	41
CN1CCC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819023787	CE	On-Demand	Anodyne	ADRB3	21	44
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819023793	GG	On-Demand	Anodyne	P2RX7	15	48
CCN1CCC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819023810	DF	On-Demand	Anodyne	BIRC2	20	41
CCN1CCC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819023811	DF	On-Demand	Anodyne	BIRC2	20	41
CCN1CCC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819023812	DF	On-Demand	Anodyne	BIRC2	20	41
CCN1CCC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819023813	DF	On-Demand	Anodyne	BIRC2	20	41
C=CCNC(=S)N1C[C@@H](C(=O)OC)[C@H](c2ccc(Br)cc2)C1	ZINC000819023822	GF	On-Demand	Mild	SLC6A4	21	42
C=CCNC(=S)N1C[C@@H](C(=O)OC)[C@H](c2ccc(Br)cc2)C1	ZINC000819023822	GF	On-Demand	Mild	SLC6A3	35	42
S=C(NCCc1cccnc1)N1CCC[C@H](n2ccnn2)C1	ZINC000819023825	DD	On-Demand	Anodyne	NAMPT	27	41
S=C(NCCc1cccnc1)N1CCC[C@@H](n2ccnn2)C1	ZINC000819023826	DD	On-Demand	Anodyne	NAMPT	27	41
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@@H](n3ccnn3)C2)cc1	ZINC000819023890	GC	On-Demand	Anodyne	CA2	34	41
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@@H](n3ccnn3)C2)cc1	ZINC000819023890	GC	On-Demand	Anodyne	CA1	34	41
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@@H](n3ccnn3)C2)cc1	ZINC000819023890	GC	On-Demand	Anodyne	CA9	30	41
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@@H](n3ccnn3)C2)cc1	ZINC000819023890	GC	On-Demand	Anodyne	NAMPT	52	38
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@H](n3ccnn3)C2)cc1	ZINC000819023892	GC	On-Demand	Anodyne	CA2	34	41
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@H](n3ccnn3)C2)cc1	ZINC000819023892	GC	On-Demand	Anodyne	CA1	34	41
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@H](n3ccnn3)C2)cc1	ZINC000819023892	GC	On-Demand	Anodyne	CA9	30	41
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@H](n3ccnn3)C2)cc1	ZINC000819023892	GC	On-Demand	Anodyne	NAMPT	52	38
C=CCN1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819023903	CF	On-Demand	Mild	ADRB3	21	46
CC1CCN(c2ccc(NC(=O)Cc3ccc(-n4cnnc4)cc3)cc2)CC1	ZINC000819023914	GH	On-Demand	Anodyne	HTR1D	28	43
CC1CCN(c2ccc(NC(=O)Cc3ccc(-n4cnnc4)cc3)cc2)CC1	ZINC000819023914	GH	On-Demand	Anodyne	HTR1B	25	43
O=C1CCC(=O)N1CCCNC[C@@H](O)c1cccnc1	ZINC000819023917	CC	On-Demand	Anodyne	ADRB2	31	51
O=C1CCC(=O)N1CCCNC[C@@H](O)c1cccnc1	ZINC000819023917	CC	On-Demand	Anodyne	ADRB1	32	44
O=C1CCC(=O)N1CCCNC[C@@H](O)c1cccnc1	ZINC000819023917	CC	On-Demand	Anodyne	ADRB3	115	51
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCn1c(C)nc3ccccc31)C2	ZINC000819023920	FE	On-Demand	Anodyne	PDE6D	21	40
O=C1CCC(=O)N1CCCNC[C@H](O)c1cccnc1	ZINC000819023921	CC	On-Demand	Anodyne	ADRB2	31	51
O=C1CCC(=O)N1CCCNC[C@H](O)c1cccnc1	ZINC000819023921	CC	On-Demand	Anodyne	ADRB1	32	44
O=C1CCC(=O)N1CCCNC[C@H](O)c1cccnc1	ZINC000819023921	CC	On-Demand	Anodyne	ADRB3	115	51
CN1CCC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819023923	CD	On-Demand	Anodyne	SLC6A3	35	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCn1c(C)nc3ccccc31)C2	ZINC000819023924	FE	On-Demand	Anodyne	PDE6D	21	40
CN1CCC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819023926	CD	On-Demand	Anodyne	SLC6A3	35	46
CC(C)(C)OC(=O)C(C)(C)CCNC(=S)Nc1ccc([N+](=O)[O-])cc1	ZINC000819023962	FH	On-Demand	Bother	NMBR	53	31
CCN1CCC[C@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819023964	EF	On-Demand	Anodyne	ADRB3	15	41
COC(=O)[C@@H]1CN(C(=S)NCC(C)C)C[C@H]1c1ccc(Br)cc1	ZINC000819023967	GG	On-Demand	Anodyne	SLC6A4	27	44
COC(=O)[C@@H]1CN(C(=S)NCC(C)C)C[C@H]1c1ccc(Br)cc1	ZINC000819023967	GG	On-Demand	Anodyne	SLC6A3	44	44
CCN1CCC[C@@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819023968	EF	On-Demand	Anodyne	ADRB3	15	41
CCN1CCC[C@@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819023971	EF	On-Demand	Anodyne	ADRB3	15	41
CCN1CCC[C@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819023973	EF	On-Demand	Anodyne	ADRB3	15	41
C=CCN1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819023996	CE	On-Demand	Mild	SLC6A3	27	48
C=CCN1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819023999	CE	On-Demand	Mild	SLC6A3	27	48
CN1CCC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819024001	DC	On-Demand	Anodyne	ADRB3	27	45
C=C(C)CN1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819024002	CE	On-Demand	Mild	ADRB1	17	40
C=C(C)CN1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819024002	CE	On-Demand	Mild	SLC6A3	15	46
C=C(C)CN1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819024002	CE	On-Demand	Mild	SIGMAR1	15	46
C=C(C)CN1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819024004	CE	On-Demand	Mild	ADRB1	17	40
C=C(C)CN1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819024004	CE	On-Demand	Mild	SLC6A3	15	46
C=C(C)CN1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819024004	CE	On-Demand	Mild	SIGMAR1	15	46
CN1CCC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819024008	DC	On-Demand	Anodyne	ADRB3	27	45
CN1CCC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819024011	DE	On-Demand	Anodyne	SFRP1	60	34
CN1CCC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819024011	DE	On-Demand	Anodyne	WNT3	45	32
CN1CCC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819024015	DE	On-Demand	Anodyne	SFRP1	60	34
CN1CCC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819024015	DE	On-Demand	Anodyne	WNT3	45	32
CC(C)(C)OC(=O)C(C)(C)CCNC(=S)Nc1ccc2c(c1)OCCO2	ZINC000819024045	GH	On-Demand	Anodyne	QPCT	36	50
Cc1ccc(NC(=S)NCCC(C)(C)C(=O)OC(C)(C)C)cc1	ZINC000819024048	EI	On-Demand	Anodyne	PTPRB	18	40
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819024052	GH	On-Demand	Anodyne	DRD4	46	39
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819024052	GH	On-Demand	Anodyne	MTNR1A	18	42
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819024052	GH	On-Demand	Anodyne	MTNR1B	26	42
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819024052	GH	On-Demand	Anodyne	ACR	26	40
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819024052	GH	On-Demand	Anodyne	TAAR1	18	43
O=C(Nc1ccccc1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819024189	DG	On-Demand	Anodyne	EPHX2	28	46
F[C@@]1(c2ccccc2)C[C@@H]1NC(=S)NCCCN1CCOCC1	ZINC000819024219	ED	On-Demand	Anodyne	EPHX2	17	40
F[C@@]1(c2ccccc2)C[C@H]1NC(=S)NCCCN1CCOCC1	ZINC000819024220	ED	On-Demand	Anodyne	EPHX2	17	40
F[C@]1(c2ccccc2)C[C@@H]1NC(=S)NCCCN1CCOCC1	ZINC000819024221	ED	On-Demand	Anodyne	EPHX2	17	40
F[C@]1(c2ccccc2)C[C@H]1NC(=S)NCCCN1CCOCC1	ZINC000819024222	ED	On-Demand	Anodyne	EPHX2	17	40
C=C(C)CN1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819024252	CE	On-Demand	Mild	SLC6A3	23	45
C=C(C)CN1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819024258	CE	On-Demand	Mild	SLC6A3	23	45
S=C(NCCc1cccnc1)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000819024271	FF	On-Demand	Anodyne	CHRNA7	46	39
C=CCN1CCC(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819024280	ED	On-Demand	Mild	ADRB3	21	41
C=CCN1CCC(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819024281	ED	On-Demand	Mild	ADRB3	21	41
O=C1CCC(=O)N1CCCNC[C@@H](O)c1cccc(F)c1	ZINC000819024305	CC	On-Demand	Anodyne	ADRB1	32	41
O=C1CCC(=O)N1CCCNC[C@@H](O)c1cccc(F)c1	ZINC000819024305	CC	On-Demand	Anodyne	ADRB3	52	41
O=C1CCC(=O)N1CCCNC[C@H](O)c1cccc(F)c1	ZINC000819024306	CC	On-Demand	Anodyne	ADRB1	32	41
O=C1CCC(=O)N1CCCNC[C@H](O)c1cccc(F)c1	ZINC000819024306	CC	On-Demand	Anodyne	ADRB3	52	41
COC(=O)[C@@H]1CN(C(=S)NC(C)(C)C)C[C@H]1c1ccc(Br)cc1	ZINC000819024334	GG	On-Demand	Anodyne	SLC6A4	24	45
COC(=O)[C@@H]1CN(C(=S)NC(C)(C)C)C[C@H]1c1ccc(Br)cc1	ZINC000819024334	GG	On-Demand	Anodyne	SLC6A3	39	45
CNC(=S)N1C[C@H](c2ccc(Br)cc2)[C@@H](C(=O)OC)C1	ZINC000819024337	FE	On-Demand	Anodyne	SLC6A4	30	47
CNC(=S)N1C[C@H](c2ccc(Br)cc2)[C@@H](C(=O)OC)C1	ZINC000819024337	FE	On-Demand	Anodyne	SLC6A3	50	47
C=C(C)CN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819024341	DG	On-Demand	Mild	ADRB1	34	43
C=C(C)CN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819024341	DG	On-Demand	Mild	ADRB3	53	47
C=C(C)CN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819024341	DG	On-Demand	Mild	CYP3A4	48	39
C=C(C)CN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819024343	DG	On-Demand	Mild	ADRB1	34	43
C=C(C)CN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819024343	DG	On-Demand	Mild	ADRB3	53	47
C=C(C)CN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819024343	DG	On-Demand	Mild	CYP3A4	48	39
S=C(NC1CC1)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000819024370	DE	On-Demand	Anodyne	SIGMAR1	28	40
C=C(C)CN1CCC(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819024400	GF	On-Demand	Mild	GPR119	22	41
C=C(C)CN1CCC(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819024401	GF	On-Demand	Mild	GPR119	22	41
COC(=O)[C@@H]1CN(C(=S)NC2CC2)C[C@H]1c1ccc(Br)cc1	ZINC000819024404	GF	On-Demand	Anodyne	SLC6A4	33	47
COC(=O)[C@@H]1CN(C(=S)NC2CC2)C[C@H]1c1ccc(Br)cc1	ZINC000819024404	GF	On-Demand	Anodyne	SLC6A3	53	47
Fc1ccc(CCNC(=S)N2CCC[C@H](n3ccnn3)C2)cc1	ZINC000819024409	EE	On-Demand	Anodyne	GPBAR1	15	42
Fc1ccc(CCNC(=S)N2CCC[C@@H](n3ccnn3)C2)cc1	ZINC000819024410	EE	On-Demand	Anodyne	GPBAR1	15	42
O=C(c1cc(Cl)ncc1Br)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819024426	HJ	On-Demand	Anodyne	GPBAR1	62	44
O=C(c1cc(Cl)ncc1Br)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819024428	HJ	On-Demand	Anodyne	GPBAR1	62	44
N#Cc1cccc(OCC(=O)Nc2ccc(C3CCC3)cn2)c1	ZINC000819024431	DG	On-Demand	Mild	CPT1A	62	41
N#Cc1cccc(OCC(=O)Nc2ccc(C3CCC3)cn2)c1	ZINC000819024431	DG	On-Demand	Mild	CHRNA10	26	45
O=C(CCCCN1CCCC1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819024433	EH	On-Demand	Anodyne	HTR1A	33	43
O=C(CCCCN1CCCC1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819024433	EH	On-Demand	Anodyne	SLC6A1	56	39
O=C(CCCCN1CCCC1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819024433	EH	On-Demand	Anodyne	HTR7	48	40
O=C(CCCCN1CCCC1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819024433	EH	On-Demand	Anodyne	CYP2J2	43	30
O=C(CCCCN1CCCC1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819024437	EH	On-Demand	Anodyne	HTR1A	33	43
O=C(CCCCN1CCCC1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819024437	EH	On-Demand	Anodyne	SLC6A1	56	39
O=C(CCCCN1CCCC1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819024437	EH	On-Demand	Anodyne	HTR7	48	40
O=C(CCCCN1CCCC1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819024437	EH	On-Demand	Anodyne	CYP2J2	43	30
C=C(C)CNC(=S)N1C[C@@H](C(=O)OC)[C@H](c2ccc(Br)cc2)C1	ZINC000819024444	GG	On-Demand	Mild	SLC6A4	22	42
C=C(C)CNC(=S)N1C[C@@H](C(=O)OC)[C@H](c2ccc(Br)cc2)C1	ZINC000819024444	GG	On-Demand	Mild	SLC6A3	35	42
O=C(c1ccc(-n2cnc3ccccc32)nc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819024455	HI	On-Demand	Anodyne	HPGD	42	36
O=C(c1ccc(-n2cnc3ccccc32)nc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819024461	HI	On-Demand	Anodyne	HPGD	42	36
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccccc2)cc1	ZINC000819024484	ED	On-Demand	Anodyne	ADRB2	66	46
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccccc2)cc1	ZINC000819024484	ED	On-Demand	Anodyne	ADRB1	92	55
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccccc2)cc1	ZINC000819024484	ED	On-Demand	Anodyne	DRD4	18	42
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccccc2)cc1	ZINC000819024484	ED	On-Demand	Anodyne	ADRB3	147	55
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccccc2)cc1	ZINC000819024485	ED	On-Demand	Anodyne	ADRB2	66	46
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccccc2)cc1	ZINC000819024485	ED	On-Demand	Anodyne	ADRB1	92	55
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccccc2)cc1	ZINC000819024485	ED	On-Demand	Anodyne	DRD4	18	42
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccccc2)cc1	ZINC000819024485	ED	On-Demand	Anodyne	ADRB3	147	55
CC(=O)Nc1cccc(NC(=S)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c1	ZINC000819024520	GH	On-Demand	Anodyne	SIGMAR1	27	46
CC(=O)Nc1cccc(NC(=S)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c1	ZINC000819024520	GH	On-Demand	Anodyne	NPY2R	27	40
O=[N+]([O-])c1ccc(NC(=S)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000819024532	GG	On-Demand	Bother	SIGMAR1	15	46
O=C(c1cccnc1Br)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819024549	FH	On-Demand	Anodyne	GPBAR1	44	41
O=C(c1cccnc1Br)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819024552	FH	On-Demand	Anodyne	GPBAR1	44	41
CC(C)(C)OC(=O)N1CCC(CC(=O)N2C[C@@H]3CCCCN3c3ccccc32)CC1	ZINC000819024564	HI	On-Demand	Anodyne	GPR119	42	41
CC(C)(C)OC(=O)N1CCC(CC(=O)N2C[C@@H]3CCCCN3c3ccccc32)CC1	ZINC000819024564	HI	On-Demand	Anodyne	SFRP1	21	45
CC(C)(C)OC(=O)N1CCC(CC(=O)N2C[C@H]3CCCCN3c3ccccc32)CC1	ZINC000819024566	HI	On-Demand	Anodyne	GPR119	42	41
CC(C)(C)OC(=O)N1CCC(CC(=O)N2C[C@H]3CCCCN3c3ccccc32)CC1	ZINC000819024566	HI	On-Demand	Anodyne	SFRP1	21	45
NS(=O)(=O)c1cc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)ccc1F	ZINC000819024568	GE	On-Demand	Anodyne	GPBAR1	26	45
NS(=O)(=O)c1cc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)ccc1F	ZINC000819024570	GE	On-Demand	Anodyne	GPBAR1	26	45
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819024590	FE	On-Demand	Anodyne	ADRB2	40	43
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819024590	FE	On-Demand	Anodyne	ADRB1	52	42
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819024590	FE	On-Demand	Anodyne	GRIN1	16	44
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819024590	FE	On-Demand	Anodyne	ADRB3	49	42
COc1ccc2c(C)c(CCC(=O)Nc3ccc(C4CCC4)cn3)c(=O)oc2c1	ZINC000819024591	GI	On-Demand	Anodyne	MAOB	37	43
COc1ccc2c(C)c(CCC(=O)Nc3ccc(C4CCC4)cn3)c(=O)oc2c1	ZINC000819024591	GI	On-Demand	Anodyne	NQO1	17	42
O=C(c1ccnc(Br)c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819024600	FH	On-Demand	Anodyne	L3MBTL3	42	35
O=C(c1ccnc(Br)c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819024604	FH	On-Demand	Anodyne	L3MBTL3	42	35
O=C(c1csc(-c2ccccn2)n1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819024607	GI	On-Demand	Anodyne	CPT1A	16	45
O=C(c1csc(-c2ccccn2)n1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819024613	GI	On-Demand	Anodyne	CPT1A	16	45
C=CCN1CCC(NC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819024620	EF	On-Demand	Mild	ADRB3	18	40
C=CCN1CCC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819024621	EF	On-Demand	Mild	ADRB3	18	40
CC(C)(C)C(=O)Nc1ccccc1C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819024628	FJ	On-Demand	Anodyne	F10	21	41
CC(C)(C)C(=O)Nc1ccccc1C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819024628	FJ	On-Demand	Anodyne	G2YM83_BOTF4	66	33
O=C1CCC(=O)N1CCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819024643	FD	On-Demand	Anodyne	ADRB3	24	41
O=C1CCC(=O)N1CCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819024647	FD	On-Demand	Anodyne	ADRB3	24	41
CC(C)(C)OC(=O)N1CC[C@@H](CCC(=O)N2C[C@@H]3CCCCN3c3ccccc32)C1	ZINC000819024650	HI	On-Demand	Anodyne	GPR119	30	42
CC(C)(C)OC(=O)N1CC[C@H](CCC(=O)N2C[C@@H]3CCCCN3c3ccccc32)C1	ZINC000819024652	HI	On-Demand	Anodyne	GPR119	30	42
CC(C)(C)OC(=O)N1CC[C@H](CCC(=O)N2C[C@H]3CCCCN3c3ccccc32)C1	ZINC000819024653	HI	On-Demand	Anodyne	GPR119	30	42
CC(C)(C)OC(=O)N1CC[C@@H](CCC(=O)N2C[C@H]3CCCCN3c3ccccc32)C1	ZINC000819024654	HI	On-Demand	Anodyne	GPR119	30	42
Cc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)nc1	ZINC000819024673	DG	On-Demand	Anodyne	GPBAR1	48	44
O=S(=O)(c1ccc(NC(=S)N[C@H]2CC23CC3)cc1)N1CCOCC1	ZINC000819024720	FD	On-Demand	Anodyne	TGM2	56	38
O=S(=O)(c1ccc(NC(=S)N[C@H]2CC23CC3)cc1)N1CCOCC1	ZINC000819024720	FD	On-Demand	Anodyne	F13A1	73	39
O=S(=O)(c1ccc(NC(=S)N[C@H]2CC23CC3)cc1)N1CCOCC1	ZINC000819024720	FD	On-Demand	Anodyne	MERTK	31	41
O=S(=O)(c1ccc(NC(=S)N[C@H]2CC23CC3)cc1)N1CCOCC1	ZINC000819024720	FD	On-Demand	Anodyne	NAMPT	28	45
O=S(=O)(c1ccc(NC(=S)N[C@@H]2CC23CC3)cc1)N1CCOCC1	ZINC000819024721	FD	On-Demand	Anodyne	TGM2	56	38
O=S(=O)(c1ccc(NC(=S)N[C@@H]2CC23CC3)cc1)N1CCOCC1	ZINC000819024721	FD	On-Demand	Anodyne	F13A1	73	39
O=S(=O)(c1ccc(NC(=S)N[C@@H]2CC23CC3)cc1)N1CCOCC1	ZINC000819024721	FD	On-Demand	Anodyne	MERTK	31	41
O=S(=O)(c1ccc(NC(=S)N[C@@H]2CC23CC3)cc1)N1CCOCC1	ZINC000819024721	FD	On-Demand	Anodyne	NAMPT	28	45
S=C(N[C@H]1CC12CC2)NC12CC3CC(CC(C3)C1)C2	ZINC000819024730	CF	On-Demand	Anodyne	EPHX2	44	47
S=C(N[C@@H]1CC12CC2)NC12CC3CC(CC(C3)C1)C2	ZINC000819024731	CF	On-Demand	Anodyne	EPHX2	44	47
O=C(C(F)=C1CCC1)N1CCN(S(=O)(=O)c2ccc(F)cc2F)CC1	ZINC000819024732	FE	On-Demand	Anodyne	PKM	15	47
O=C(C(F)=C1CCC1)N1CCN(S(=O)(=O)c2ccc(F)cc2F)CC1	ZINC000819024732	FE	On-Demand	Anodyne	F13A1	21	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(C(=O)Nc2ccccc2)CC1	ZINC000819024740	GF	On-Demand	Anodyne	EPHX2	39	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(C(=O)Nc2ccccc2)CC1	ZINC000819024740	GF	On-Demand	Anodyne	SFRP1	53	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(C(=O)Nc2ccccc2)CC1	ZINC000819024740	GF	On-Demand	Anodyne	WNT3	51	35
C=C(C)CN1CCC(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819024749	FD	On-Demand	Mild	ADRB3	19	41
C=C(C)CN1CCC(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819024750	FD	On-Demand	Mild	ADRB3	19	41
FC(F)(F)Oc1ccc(NC(=S)N2CCC[C@@H](n3ccnn3)C2)cc1	ZINC000819024768	FG	On-Demand	Anodyne	EPHX2	51	43
FC(F)(F)Oc1ccc(NC(=S)N2CCC[C@H](n3ccnn3)C2)cc1	ZINC000819024769	FG	On-Demand	Anodyne	EPHX2	51	43
NC(=O)c1ccc(NC(=S)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000819024797	GF	On-Demand	Anodyne	LTA4H	23	40
NC(=O)c1ccc(NC(=S)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000819024797	GF	On-Demand	Anodyne	ADK	15	44
NC(=O)c1ccc(NC(=S)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000819024797	GF	On-Demand	Anodyne	SIGMAR1	18	41
NC(=O)c1ccc(NC(=S)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000819024797	GF	On-Demand	Anodyne	NPY2R	26	41
NC(=O)c1ccc(NC(=S)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000819024797	GF	On-Demand	Anodyne	F13A1	40	36
CCNC(=S)N1C[C@H](c2ccc(Br)cc2)[C@@H](C(=O)OC)C1	ZINC000819024828	FF	On-Demand	Anodyne	SLC6A4	27	45
CCNC(=S)N1C[C@H](c2ccc(Br)cc2)[C@@H](C(=O)OC)C1	ZINC000819024828	FF	On-Demand	Anodyne	SLC6A3	44	45
O=C(Nc1ccc(C2CCC2)cn1)c1c(Cl)ccc(Cl)c1Cl	ZINC000819024836	FK	On-Demand	Anodyne	TYK2	56	36
Cn1ncc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)c1I	ZINC000819024846	HG	On-Demand	Anodyne	GPBAR1	49	39
Cn1ncc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1I	ZINC000819024847	HG	On-Demand	Anodyne	GPBAR1	49	39
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)N3C[C@@H]4CCCCN4c4ccccc43)cc2C1	ZINC000819024848	IJ	On-Demand	Anodyne	AVPR2	41	38
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)N3C[C@H]4CCCCN4c4ccccc43)cc2C1	ZINC000819024849	IJ	On-Demand	Anodyne	AVPR2	41	38
CCOC(Cn1ncc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1N)OCC	ZINC000819024850	HF	On-Demand	Anodyne	GPBAR1	49	39
CCOC(Cn1ncc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)c1N)OCC	ZINC000819024851	HF	On-Demand	Anodyne	GPBAR1	49	39
Cn1cc(-c2cccc(C(=O)Nc3ccc(C4CCC4)cn3)c2)cn1	ZINC000819024856	EI	On-Demand	Anodyne	HTR1F	50	39
Cn1cc(-c2cccc(C(=O)Nc3ccc(C4CCC4)cn3)c2)cn1	ZINC000819024856	EI	On-Demand	Anodyne	LUCI_LUCLA	35	42
Cn1cc(-c2cccc(C(=O)Nc3ccc(C4CCC4)cn3)c2)cn1	ZINC000819024856	EI	On-Demand	Anodyne	TYRO3	24	42
O=C(CCc1cncc2ccccc12)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819024863	FJ	On-Demand	Anodyne	GPBAR1	38	41
O=C(CCc1cncc2ccccc12)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819024864	FJ	On-Demand	Anodyne	GPBAR1	38	41
O=C(c1cnn(Cc2ccccc2)c1Cl)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819024882	HJ	On-Demand	Anodyne	GPBAR1	48	40
O=C(c1cnn(Cc2ccccc2)c1Cl)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819024883	HJ	On-Demand	Anodyne	GPBAR1	48	40
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)Nc2ccc(C3CCC3)cn2)C1	ZINC000819024892	EH	On-Demand	Anodyne	GPR119	48	41
O=C(COc1ccc(C2SCCCS2)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819024898	IK	On-Demand	Anodyne	CPT1A	106	37
O=C(COc1ccc(C2SCCCS2)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819024898	IK	On-Demand	Anodyne	CPT2	44	33
O=C(COc1ccc(C2SCCCS2)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819024899	IK	On-Demand	Anodyne	CPT1A	106	37
O=C(COc1ccc(C2SCCCS2)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819024899	IK	On-Demand	Anodyne	CPT2	44	33
O=C(CCCCNC(=O)OCc1ccccc1)Nc1ccc(C2CCC2)cn1	ZINC000819024900	GI	On-Demand	Anodyne	CAPN2	44	38
O=C(CCCCNC(=O)OCc1ccccc1)Nc1ccc(C2CCC2)cn1	ZINC000819024900	GI	On-Demand	Anodyne	TGM2	30	41
O=C(CCCCNC(=O)OCc1ccccc1)Nc1ccc(C2CCC2)cn1	ZINC000819024900	GI	On-Demand	Anodyne	KLK5	38	40
O=C(c1ccc2nc(S)oc2c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819024903	FI	On-Demand	Anodyne	GPBAR1	31	40
O=C(c1ccc2nc(S)oc2c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819024904	FI	On-Demand	Anodyne	GPBAR1	31	40
CCOC(=O)N1CCC[C@H](C(=O)N2C[C@H]3CCCCN3c3ccccc32)C1	ZINC000819024913	FG	On-Demand	Anodyne	CHRM4	16	42
CCOC(=O)N1CCC[C@H](C(=O)N2C[C@H]3CCCCN3c3ccccc32)C1	ZINC000819024913	FG	On-Demand	Anodyne	PREP	42	40
CCOC(=O)N1CCC[C@@H](C(=O)N2C[C@H]3CCCCN3c3ccccc32)C1	ZINC000819024914	FG	On-Demand	Anodyne	CHRM4	16	42
CCOC(=O)N1CCC[C@@H](C(=O)N2C[C@H]3CCCCN3c3ccccc32)C1	ZINC000819024914	FG	On-Demand	Anodyne	PREP	42	40
CCOC(=O)N1CCC[C@H](C(=O)N2C[C@@H]3CCCCN3c3ccccc32)C1	ZINC000819024915	FG	On-Demand	Anodyne	CHRM4	16	42
CCOC(=O)N1CCC[C@H](C(=O)N2C[C@@H]3CCCCN3c3ccccc32)C1	ZINC000819024915	FG	On-Demand	Anodyne	PREP	42	40
CCOC(=O)N1CCC[C@@H](C(=O)N2C[C@@H]3CCCCN3c3ccccc32)C1	ZINC000819024916	FG	On-Demand	Anodyne	CHRM4	16	42
CCOC(=O)N1CCC[C@@H](C(=O)N2C[C@@H]3CCCCN3c3ccccc32)C1	ZINC000819024916	FG	On-Demand	Anodyne	PREP	42	40
O=C(c1cc(Cl)ncc1Cl)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819024919	FI	On-Demand	Anodyne	AVPR2	46	39
O=C(c1cc(Cl)ncc1Cl)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819024919	FI	On-Demand	Anodyne	GPBAR1	68	48
O=C(c1cc(Cl)ncc1Cl)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819024920	FI	On-Demand	Anodyne	AVPR2	46	39
O=C(c1cc(Cl)ncc1Cl)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819024920	FI	On-Demand	Anodyne	GPBAR1	68	48
S=C(Nc1ccc2c(c1)OCCO2)N[C@@H]1CC12CC2	ZINC000819024994	CE	On-Demand	Anodyne	QPCT	15	40
S=C(Nc1ccc2c(c1)OCCO2)N[C@H]1CC12CC2	ZINC000819024995	CE	On-Demand	Anodyne	QPCT	15	40
Fc1ccc(NC(=S)N[C@H]2CC23CC3)cc1Cl	ZINC000819025024	CG	On-Demand	Anodyne	ENV	42	38
Fc1ccc(NC(=S)N[C@@H]2CC23CC3)cc1Cl	ZINC000819025025	CG	On-Demand	Anodyne	ENV	42	38
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2cccnc2)cc1	ZINC000819025053	ED	On-Demand	Anodyne	ADRB2	55	62
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2cccnc2)cc1	ZINC000819025053	ED	On-Demand	Anodyne	ADRB1	67	62
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2cccnc2)cc1	ZINC000819025053	ED	On-Demand	Anodyne	ADRB3	163	71
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819025054	ED	On-Demand	Anodyne	ADRB2	55	62
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819025054	ED	On-Demand	Anodyne	ADRB1	67	62
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819025054	ED	On-Demand	Anodyne	ADRB3	163	71
CCNC(=S)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000819025072	CE	On-Demand	Anodyne	SIGMAR1	21	40
CCCNC(=S)N1C[C@H](c2ccc(Br)cc2)[C@@H](C(=O)OC)C1	ZINC000819025096	GF	On-Demand	Anodyne	SLC6A4	25	43
CCCNC(=S)N1C[C@H](c2ccc(Br)cc2)[C@@H](C(=O)OC)C1	ZINC000819025096	GF	On-Demand	Anodyne	SLC6A3	40	43
C#CCNC(=S)N1C[C@@H](C(=O)OC)[C@H](c2ccc(Br)cc2)C1	ZINC000819025101	GE	On-Demand	Mild	SLC6A4	22	42
C#CCNC(=S)N1C[C@@H](C(=O)OC)[C@H](c2ccc(Br)cc2)C1	ZINC000819025101	GE	On-Demand	Mild	SLC6A3	35	42
CC(=O)Nc1cccc(NC(=S)NN(C)C2CC2)c1	ZINC000819025128	CD	On-Demand	Anodyne	PPIA	15	40
CC(=O)Nc1cccc(NC(=S)NN(C)C2CC2)c1	ZINC000819025128	CD	On-Demand	Anodyne	KCNK3	91	40
CC(=O)Nc1cccc(NC(=S)NN(C)C2CC2)c1	ZINC000819025128	CD	On-Demand	Anodyne	KCNK9	52	35
C=C(C)CN1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819025143	DG	On-Demand	Mild	ADRB3	21	43
C=C(C)CN1CCC(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819025153	FG	On-Demand	Mild	EPHX2	24	42
C=C(C)CN1CCC(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819025155	FG	On-Demand	Mild	EPHX2	24	42
CC[C@H](C)NC(=S)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000819025157	DF	On-Demand	Anodyne	SIGMAR1	24	44
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)Nc2ccc(C3CCC3)cn2)C1	ZINC000819025197	FH	On-Demand	Anodyne	GPR119	51	44
O=C(c1cccnc1)N1CCC(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)CC1	ZINC000819025216	HG	On-Demand	Anodyne	SLC18A3	15	46
O=C(c1cccnc1)N1CCC(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)CC1	ZINC000819025216	HG	On-Demand	Anodyne	GPBAR1	44	40
O=C(c1cccnc1)N1CCC(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)CC1	ZINC000819025216	HG	On-Demand	Anodyne	L3MBTL3	76	38
O=C(c1cccnc1)N1CCC(C(=O)N2C[C@H]3CCCCN3c3ccccc32)CC1	ZINC000819025217	HG	On-Demand	Anodyne	SLC18A3	15	46
O=C(c1cccnc1)N1CCC(C(=O)N2C[C@H]3CCCCN3c3ccccc32)CC1	ZINC000819025217	HG	On-Demand	Anodyne	GPBAR1	44	40
O=C(c1cccnc1)N1CCC(C(=O)N2C[C@H]3CCCCN3c3ccccc32)CC1	ZINC000819025217	HG	On-Demand	Anodyne	L3MBTL3	76	38
Cc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1C#N	ZINC000819025229	EH	On-Demand	Mild	AVPR2	64	37
Cc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1C#N	ZINC000819025229	EH	On-Demand	Mild	L3MBTL3	41	32
O=C(Nc1ccc(C2CCC2)cn1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000819025233	FG	On-Demand	Anodyne	NPY5R	15	41
O=C(Nc1ccc(C2CCC2)cn1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000819025234	FG	On-Demand	Anodyne	NPY5R	15	41
CS(=O)(=O)Nc1cccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1	ZINC000819025253	GG	On-Demand	Anodyne	AVPR2	61	37
CS(=O)(=O)Nc1cccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)c1	ZINC000819025254	GG	On-Demand	Anodyne	AVPR2	61	37
Nc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1[N+](=O)[O-]	ZINC000819025263	FG	On-Demand	Bother	AVPR2	27	40
Nc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1[N+](=O)[O-]	ZINC000819025263	FG	On-Demand	Bother	GPBAR1	15	41
Nc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1[N+](=O)[O-]	ZINC000819025263	FG	On-Demand	Bother	L3MBTL3	30	42
Nc1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1[N+](=O)[O-]	ZINC000819025264	FG	On-Demand	Bother	AVPR2	27	40
Nc1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1[N+](=O)[O-]	ZINC000819025264	FG	On-Demand	Bother	GPBAR1	15	41
Nc1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1[N+](=O)[O-]	ZINC000819025264	FG	On-Demand	Bother	L3MBTL3	30	42
O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025266	FI	On-Demand	Bother	AVPR2	47	40
O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025266	FI	On-Demand	Bother	L3MBTL3	26	40
O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025267	FI	On-Demand	Bother	AVPR2	47	40
O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025267	FI	On-Demand	Bother	L3MBTL3	26	40
CC(C)(C)OC(=O)NCCCCC(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025268	GI	On-Demand	Anodyne	DRD2	17	45
CC(C)(C)OC(=O)NCCCCC(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025268	GI	On-Demand	Anodyne	PREP	15	54
CC(C)(C)OC(=O)NCCCCC(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025269	GI	On-Demand	Anodyne	DRD2	17	45
CC(C)(C)OC(=O)NCCCCC(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025269	GI	On-Demand	Anodyne	PREP	15	54
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)ccc1F	ZINC000819025277	IH	On-Demand	Anodyne	AVPR2	51	34
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)ccc1F	ZINC000819025277	IH	On-Demand	Anodyne	SFRP1	76	35
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)ccc1F	ZINC000819025277	IH	On-Demand	Anodyne	WNT3	58	33
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)ccc1F	ZINC000819025278	IH	On-Demand	Anodyne	AVPR2	51	34
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)ccc1F	ZINC000819025278	IH	On-Demand	Anodyne	SFRP1	76	35
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)ccc1F	ZINC000819025278	IH	On-Demand	Anodyne	WNT3	58	33
O=C(Nc1ccc(C2CCC2)cn1)c1cccc(O)c1O	ZINC000819025279	CG	On-Demand	Clean	G2YM83_BOTF4	57	32
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025280	FH	On-Demand	Anodyne	CCKAR	18	41
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025280	FH	On-Demand	Anodyne	CTSK	20	43
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025280	FH	On-Demand	Anodyne	REN	51	38
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025280	FH	On-Demand	Anodyne	FPR1	44	38
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025281	FH	On-Demand	Anodyne	CCKAR	18	41
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025281	FH	On-Demand	Anodyne	CTSK	20	43
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025281	FH	On-Demand	Anodyne	REN	51	38
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025281	FH	On-Demand	Anodyne	FPR1	44	38
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CC23CC3)cc1	ZINC000819025366	DC	On-Demand	Anodyne	CA2	78	62
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CC23CC3)cc1	ZINC000819025366	DC	On-Demand	Anodyne	CA1	71	62
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CC23CC3)cc1	ZINC000819025366	DC	On-Demand	Anodyne	CA7	47	45
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CC23CC3)cc1	ZINC000819025366	DC	On-Demand	Anodyne	CA5B	37	44
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CC23CC3)cc1	ZINC000819025366	DC	On-Demand	Anodyne	CA4	50	47
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CC23CC3)cc1	ZINC000819025366	DC	On-Demand	Anodyne	CA5A	37	44
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CC23CC3)cc1	ZINC000819025366	DC	On-Demand	Anodyne	CA14	48	52
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CC23CC3)cc1	ZINC000819025366	DC	On-Demand	Anodyne	CA12	59	52
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CC23CC3)cc1	ZINC000819025366	DC	On-Demand	Anodyne	CA9	62	62
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CC23CC3)cc1	ZINC000819025366	DC	On-Demand	Anodyne	CYNT	25	42
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CC23CC3)cc1	ZINC000819025366	DC	On-Demand	Anodyne	P96878_MYCTU	22	42
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2CC23CC3)cc1	ZINC000819025367	DC	On-Demand	Anodyne	CA2	78	62
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2CC23CC3)cc1	ZINC000819025367	DC	On-Demand	Anodyne	CA1	71	62
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2CC23CC3)cc1	ZINC000819025367	DC	On-Demand	Anodyne	CA7	47	45
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2CC23CC3)cc1	ZINC000819025367	DC	On-Demand	Anodyne	CA5B	37	44
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2CC23CC3)cc1	ZINC000819025367	DC	On-Demand	Anodyne	CA4	50	47
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2CC23CC3)cc1	ZINC000819025367	DC	On-Demand	Anodyne	CA5A	37	44
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2CC23CC3)cc1	ZINC000819025367	DC	On-Demand	Anodyne	CA14	48	52
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2CC23CC3)cc1	ZINC000819025367	DC	On-Demand	Anodyne	CA12	59	52
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2CC23CC3)cc1	ZINC000819025367	DC	On-Demand	Anodyne	CA9	62	62
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2CC23CC3)cc1	ZINC000819025367	DC	On-Demand	Anodyne	CYNT	25	42
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2CC23CC3)cc1	ZINC000819025367	DC	On-Demand	Anodyne	P96878_MYCTU	22	42
CC(=O)Nc1cccc(NC(=S)N[C@@H]2CC23CC3)c1	ZINC000819025372	CE	On-Demand	Anodyne	KCNK3	59	33
CC(=O)Nc1cccc(NC(=S)N[C@H]2CC23CC3)c1	ZINC000819025373	CE	On-Demand	Anodyne	KCNK3	59	33
CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1	ZINC000819025400	HF	On-Demand	Clean	AVPR2	50	36
CS(=O)(=O)Nc1ccc(O)c(C(=O)N2C[C@H]3CCCCN3c3ccccc32)c1	ZINC000819025401	HF	On-Demand	Clean	AVPR2	50	36
NS(=O)(=O)c1cc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)ccc1Cl	ZINC000819025402	HG	On-Demand	Anodyne	AVPR2	48	37
NS(=O)(=O)c1cc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)ccc1Cl	ZINC000819025402	HG	On-Demand	Anodyne	CA6	17	51
NS(=O)(=O)c1cc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)ccc1Cl	ZINC000819025402	HG	On-Demand	Anodyne	CA7	17	51
NS(=O)(=O)c1cc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)ccc1Cl	ZINC000819025402	HG	On-Demand	Anodyne	CA13	32	51
NS(=O)(=O)c1cc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)ccc1Cl	ZINC000819025402	HG	On-Demand	Anodyne	GPBAR1	31	43
NS(=O)(=O)c1cc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)ccc1Cl	ZINC000819025403	HG	On-Demand	Anodyne	AVPR2	48	37
NS(=O)(=O)c1cc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)ccc1Cl	ZINC000819025403	HG	On-Demand	Anodyne	CA6	17	51
NS(=O)(=O)c1cc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)ccc1Cl	ZINC000819025403	HG	On-Demand	Anodyne	CA7	17	51
NS(=O)(=O)c1cc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)ccc1Cl	ZINC000819025403	HG	On-Demand	Anodyne	CA13	32	51
NS(=O)(=O)c1cc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)ccc1Cl	ZINC000819025403	HG	On-Demand	Anodyne	GPBAR1	31	43
O=C(Cc1csc(-c2nc[nH]n2)n1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025413	GF	On-Demand	Anodyne	CPT1A	66	37
O=C(Cc1csc(-c2nc[nH]n2)n1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025414	GF	On-Demand	Anodyne	CPT1A	66	37
O=C(Nc1ccc(C2CCC2)cn1)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	ZINC000819025421	GG	On-Demand	Anodyne	CCR8	62	39
O=C(c1cccc(Cl)c1O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025428	EI	On-Demand	Anodyne	AVPR2	56	39
O=C(c1cccc(Cl)c1O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025428	EI	On-Demand	Anodyne	GPBAR1	51	43
O=C(c1cccc(Cl)c1O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025429	EI	On-Demand	Anodyne	AVPR2	56	39
O=C(c1cccc(Cl)c1O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025429	EI	On-Demand	Anodyne	GPBAR1	51	43
COC(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025440	BF	On-Demand	Anodyne	KCNQ2	52	35
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)Nc2ccc(C3CCC3)cn2)C1	ZINC000819025450	FH	On-Demand	Anodyne	GPR119	42	39
O=C(c1cc(-c2ccccn2)nc2ccccc12)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025482	HK	On-Demand	Anodyne	METAP1	49	42
O=C(c1cc(-c2ccccn2)nc2ccccc12)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025482	HK	On-Demand	Anodyne	GPBAR1	41	42
O=C(c1cc(-c2ccccn2)nc2ccccc12)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025483	HK	On-Demand	Anodyne	METAP1	49	42
O=C(c1cc(-c2ccccn2)nc2ccccc12)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025483	HK	On-Demand	Anodyne	GPBAR1	41	42
O=C(Nc1ccc(C2CCC2)cn1)c1cc[n+]([O-])cc1	ZINC000819025484	CE	On-Demand	Anodyne	LUCI_LUCLA	35	43
S=C(NCCc1cccnc1)N[C@@H]1C[C@H]1C1CCC1	ZINC000819025491	CE	On-Demand	Anodyne	CHRNA7	41	36
S=C(NCCc1cccnc1)N[C@@H]1C[C@H]1C1CCC1	ZINC000819025491	CE	On-Demand	Anodyne	NAMPT	26	41
FC(F)(F)Oc1ccc(NC(=S)N[C@H]2CC23CC3)cc1	ZINC000819025545	DG	On-Demand	Anodyne	EPHX2	56	48
FC(F)(F)Oc1ccc(NC(=S)N[C@@H]2CC23CC3)cc1	ZINC000819025546	DG	On-Demand	Anodyne	EPHX2	56	48
O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025591	HH	On-Demand	Anodyne	AVPR2	41	38
O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025591	HH	On-Demand	Anodyne	SFRP1	116	37
O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025591	HH	On-Demand	Anodyne	WNT3	80	37
O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025591	HH	On-Demand	Anodyne	L3MBTL3	44	36
O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025592	HH	On-Demand	Anodyne	AVPR2	41	38
O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025592	HH	On-Demand	Anodyne	SFRP1	116	37
O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025592	HH	On-Demand	Anodyne	WNT3	80	37
O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025592	HH	On-Demand	Anodyne	L3MBTL3	44	36
O=C(c1ccc(N2CCOCC2)nc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025602	GF	On-Demand	Anodyne	HPGDS	18	43
O=C(c1ccc(N2CCOCC2)nc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025603	GF	On-Demand	Anodyne	HPGDS	18	43
N#Cc1ccc([C@H](O)C(=O)Nc2ccc(C3CCC3)cn2)cc1	ZINC000819025616	DF	On-Demand	Mild	FASN	40	37
N#Cc1ccc([C@@H](O)C(=O)Nc2ccc(C3CCC3)cn2)cc1	ZINC000819025617	DF	On-Demand	Mild	FASN	40	37
O=C(Nc1ccc(C2CCC2)cn1)c1cc(Br)cnc1Cl	ZINC000819025634	FI	On-Demand	Anodyne	G2YM83_BOTF4	51	34
O=C(c1nc(Cl)ccc1Cl)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025640	FI	On-Demand	Anodyne	GPBAR1	45	41
O=C(c1nc(Cl)ccc1Cl)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025641	FI	On-Demand	Anodyne	GPBAR1	45	41
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2C[C@H]3CCCCN3c3ccccc32)C1	ZINC000819025646	GH	On-Demand	Anodyne	SFRP1	38	45
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2C[C@H]3CCCCN3c3ccccc32)C1	ZINC000819025646	GH	On-Demand	Anodyne	WNT3	44	36
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2C[C@@H]3CCCCN3c3ccccc32)C1	ZINC000819025647	GH	On-Demand	Anodyne	SFRP1	38	45
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2C[C@@H]3CCCCN3c3ccccc32)C1	ZINC000819025647	GH	On-Demand	Anodyne	WNT3	44	36
O=C(COc1ccc2ccc(=O)oc2c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025652	GH	On-Demand	Anodyne	CPT1A	109	37
O=C(COc1ccc2ccc(=O)oc2c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025652	GH	On-Demand	Anodyne	CPT2	43	33
O=C(COc1ccc2ccc(=O)oc2c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025653	GH	On-Demand	Anodyne	CPT1A	109	37
O=C(COc1ccc2ccc(=O)oc2c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025653	GH	On-Demand	Anodyne	CPT2	43	33
O=C(NCC(=O)N1C[C@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819025658	GG	On-Demand	Anodyne	ACE	15	42
O=C(NCC(=O)N1C[C@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819025658	GG	On-Demand	Anodyne	FKBP1A	24	41
O=C(NCC(=O)N1C[C@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819025658	GG	On-Demand	Anodyne	CTSB	23	42
O=C(NCC(=O)N1C[C@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819025658	GG	On-Demand	Anodyne	CTSK	25	42
O=C(NCC(=O)N1C[C@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819025658	GG	On-Demand	Anodyne	CTSL	31	42
O=C(NCC(=O)N1C[C@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819025658	GG	On-Demand	Anodyne	PREP	42	52
O=C(NCC(=O)N1C[C@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819025658	GG	On-Demand	Anodyne	NPR	53	32
O=C(NCC(=O)N1C[C@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819025658	GG	On-Demand	Anodyne	SLC12A5	60	38
O=C(NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819025659	GG	On-Demand	Anodyne	ACE	15	42
O=C(NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819025659	GG	On-Demand	Anodyne	FKBP1A	24	41
O=C(NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819025659	GG	On-Demand	Anodyne	CTSB	23	42
O=C(NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819025659	GG	On-Demand	Anodyne	CTSK	25	42
O=C(NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819025659	GG	On-Demand	Anodyne	CTSL	31	42
O=C(NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819025659	GG	On-Demand	Anodyne	PREP	42	52
O=C(NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819025659	GG	On-Demand	Anodyne	NPR	53	32
O=C(NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819025659	GG	On-Demand	Anodyne	SLC12A5	60	38
O=C(c1cc(Cl)cs1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025660	EI	On-Demand	Anodyne	GPBAR1	40	41
O=C(c1cc(Cl)cs1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025661	EI	On-Demand	Anodyne	GPBAR1	40	41
CC(=O)CCCCCCC(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025676	EI	On-Demand	Anodyne	PREP	26	43
CC(=O)CCCCCCC(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025677	EI	On-Demand	Anodyne	PREP	26	43
O=C(Nc1ccc(C2CCC2)cn1)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000819025678	EI	On-Demand	Bother	F10	50	32
O=C(Nc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1)OCC(F)(F)F	ZINC000819025682	IJ	On-Demand	Anodyne	AVPR2	107	47
O=C(Nc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1)OCC(F)(F)F	ZINC000819025682	IJ	On-Demand	Anodyne	AVPR1A	55	43
O=C(Nc1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1)OCC(F)(F)F	ZINC000819025683	IJ	On-Demand	Anodyne	AVPR2	107	47
O=C(Nc1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1)OCC(F)(F)F	ZINC000819025683	IJ	On-Demand	Anodyne	AVPR1A	55	43
O=C1CCC(=O)N1CCCNC[C@@H](O)c1cccc(Br)c1	ZINC000819025740	FD	On-Demand	Anodyne	ADRB3	52	37
O=C1CCC(=O)N1CCCNC[C@H](O)c1cccc(Br)c1	ZINC000819025741	FD	On-Demand	Anodyne	ADRB3	52	37
O=C(CCc1nc(O)c2cnn(-c3ccccc3)c2n1)Nc1ccc(C2CCC2)cn1	ZINC000819025792	HH	On-Demand	Anodyne	HCAR2	22	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025794	IF	On-Demand	Anodyne	F2	40	39
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025794	IF	On-Demand	Anodyne	FKBP1A	31	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025794	IF	On-Demand	Anodyne	PREP	55	41
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025794	IF	On-Demand	Anodyne	LGMN	55	34
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025794	IF	On-Demand	Anodyne	WNT3	52	39
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025794	IF	On-Demand	Anodyne	TMPRSS11D	41	37
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025795	IF	On-Demand	Anodyne	F2	40	39
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025795	IF	On-Demand	Anodyne	FKBP1A	31	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025795	IF	On-Demand	Anodyne	PREP	55	41
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025795	IF	On-Demand	Anodyne	LGMN	55	34
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025795	IF	On-Demand	Anodyne	WNT3	52	39
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025795	IF	On-Demand	Anodyne	TMPRSS11D	41	37
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025796	IF	On-Demand	Anodyne	F2	40	39
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025796	IF	On-Demand	Anodyne	FKBP1A	31	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025796	IF	On-Demand	Anodyne	PREP	55	41
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025796	IF	On-Demand	Anodyne	LGMN	55	34
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025796	IF	On-Demand	Anodyne	WNT3	52	39
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025796	IF	On-Demand	Anodyne	TMPRSS11D	41	37
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025797	IF	On-Demand	Anodyne	F2	40	39
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025797	IF	On-Demand	Anodyne	FKBP1A	31	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025797	IF	On-Demand	Anodyne	PREP	55	41
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025797	IF	On-Demand	Anodyne	LGMN	55	34
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025797	IF	On-Demand	Anodyne	WNT3	52	39
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025797	IF	On-Demand	Anodyne	TMPRSS11D	41	37
O=C1CCCCN1Cc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1	ZINC000819025798	HI	On-Demand	Anodyne	AVPR2	79	43
O=C1CCCCN1Cc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1	ZINC000819025798	HI	On-Demand	Anodyne	AVPR1A	37	42
O=C1CCCCN1Cc1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1	ZINC000819025799	HI	On-Demand	Anodyne	AVPR2	79	43
O=C1CCCCN1Cc1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1	ZINC000819025799	HI	On-Demand	Anodyne	AVPR1A	37	42
O=C(c1cc(Cl)nc(Cl)c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025811	FI	On-Demand	Anodyne	AVPR2	42	37
O=C(c1cc(Cl)nc(Cl)c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025811	FI	On-Demand	Anodyne	GPBAR1	45	43
O=C(c1cc(Cl)nc(Cl)c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025812	FI	On-Demand	Anodyne	AVPR2	42	37
O=C(c1cc(Cl)nc(Cl)c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025812	FI	On-Demand	Anodyne	GPBAR1	45	43
O=C(c1ccc(C2SCCS2)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025813	GK	On-Demand	Anodyne	AVPR2	61	38
O=C(c1ccc(C2SCCS2)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025813	GK	On-Demand	Anodyne	GPBAR1	20	40
O=C(c1ccc(C2SCCS2)cc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025813	GK	On-Demand	Anodyne	L3MBTL3	44	34
O=C(c1ccc(C2SCCS2)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025814	GK	On-Demand	Anodyne	AVPR2	61	38
O=C(c1ccc(C2SCCS2)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025814	GK	On-Demand	Anodyne	GPBAR1	20	40
O=C(c1ccc(C2SCCS2)cc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025814	GK	On-Demand	Anodyne	L3MBTL3	44	34
O=C(CC1OCCCO1)Nc1ccc(C2CCC2)cn1	ZINC000819025815	CE	On-Demand	Anodyne	CDK5	44	38
CN(CC(=O)N1C[C@@H]2CCCCN2c2ccccc21)C(=O)OCc1ccccc1	ZINC000819025821	GH	On-Demand	Anodyne	SLC12A5	72	37
CN(CC(=O)N1C[C@H]2CCCCN2c2ccccc21)C(=O)OCc1ccccc1	ZINC000819025822	GH	On-Demand	Anodyne	SLC12A5	72	37
CCC(=O)c1cc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)ccc1F	ZINC000819025835	FI	On-Demand	Anodyne	AVPR2	71	37
CCC(=O)c1cc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)ccc1F	ZINC000819025835	FI	On-Demand	Anodyne	GPBAR1	44	49
CCC(=O)c1cc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)ccc1F	ZINC000819025836	FI	On-Demand	Anodyne	AVPR2	71	37
CCC(=O)c1cc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)ccc1F	ZINC000819025836	FI	On-Demand	Anodyne	GPBAR1	44	49
COc1ccc(-c2nnc(S)n2CC(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1	ZINC000819025837	IH	On-Demand	Anodyne	CPT1A	43	39
COc1ccc(-c2nnc(S)n2CC(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1	ZINC000819025838	IH	On-Demand	Anodyne	CPT1A	43	39
C[C@@](O)(C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1C(F)(F)F	ZINC000819025845	FI	On-Demand	Anodyne	RBP4	60	33
C[C@@](O)(C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1C(F)(F)F	ZINC000819025845	FI	On-Demand	Anodyne	SFRP1	67	31
C[C@@](O)(C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1C(F)(F)F	ZINC000819025845	FI	On-Demand	Anodyne	WNT3	57	31
CN(CCCC(=O)Nc1ccc(C2CCC2)cn1)C1=NS(=O)(=O)c2ccccc21	ZINC000819025846	HG	On-Demand	Anodyne	KCNA3	29	47
CC(C)(C)OC(=O)N[C@@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1	ZINC000819025872	GJ	On-Demand	Anodyne	REN	53	36
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025880	FH	On-Demand	Anodyne	ACE	17	40
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025882	FH	On-Demand	Anodyne	ACE	17	40
O=C(c1cc(S(=O)(=O)N2CCC2)ccc1Cl)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025883	IH	On-Demand	Anodyne	AKR1C3	26	41
O=C(c1cc(S(=O)(=O)N2CCC2)ccc1Cl)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819025883	IH	On-Demand	Anodyne	GPBAR1	55	42
O=C(c1cc(S(=O)(=O)N2CCC2)ccc1Cl)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025884	IH	On-Demand	Anodyne	AKR1C3	26	41
O=C(c1cc(S(=O)(=O)N2CCC2)ccc1Cl)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819025884	IH	On-Demand	Anodyne	GPBAR1	55	42
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@@H]1C[C@H]1C1CCC1	ZINC000819025906	EG	On-Demand	Anodyne	DRD4	35	49
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@@H]1C[C@H]1C1CCC1	ZINC000819025906	EG	On-Demand	Anodyne	ACHE	37	45
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@@H]1C[C@H]1C1CCC1	ZINC000819025906	EG	On-Demand	Anodyne	CHRM3	15	46
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@@H]1C[C@H]1C1CCC1	ZINC000819025906	EG	On-Demand	Anodyne	SIGMAR1	54	53
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@@H]1C[C@H]1C1CCC1	ZINC000819025906	EG	On-Demand	Anodyne	MCHR1	21	43
O=S(=O)(c1ccc(NC(=S)N[C@@H]2C[C@H]2C2CCC2)cc1)N1CCOCC1	ZINC000819025915	GE	On-Demand	Anodyne	TGM2	59	43
O=S(=O)(c1ccc(NC(=S)N[C@@H]2C[C@H]2C2CCC2)cc1)N1CCOCC1	ZINC000819025915	GE	On-Demand	Anodyne	F13A1	79	43
O=S(=O)(c1ccc(NC(=S)N[C@@H]2C[C@H]2C2CCC2)cc1)N1CCOCC1	ZINC000819025915	GE	On-Demand	Anodyne	MERTK	30	41
O=S(=O)(c1ccc(NC(=S)N[C@@H]2C[C@H]2C2CCC2)cc1)N1CCOCC1	ZINC000819025915	GE	On-Demand	Anodyne	NAMPT	25	44
FC(F)(F)c1cccc(CNC(=S)N[C@@H]2CC23CC3)c1	ZINC000819025929	DG	On-Demand	Anodyne	CCR2	42	38
FC(F)(F)c1cccc(CNC(=S)N[C@H]2CC23CC3)c1	ZINC000819025930	DG	On-Demand	Anodyne	CCR2	42	38
CC(C)c1cccc(C(C)C)c1NC(=S)N[C@H]1CC12CC2	ZINC000819025945	DJ	On-Demand	Anodyne	SOAT1	29	41
CC(C)c1cccc(C(C)C)c1NC(=S)N[C@@H]1CC12CC2	ZINC000819025946	DJ	On-Demand	Anodyne	SOAT1	29	41
COc1ccc(OC)c([C@H](O)CNCCCN2C(=O)CCC2=O)c1	ZINC000819025968	EC	On-Demand	Anodyne	ADRB2	24	43
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1CC12CC2	ZINC000819025977	DF	On-Demand	Anodyne	CHRM2	17	47
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1CC12CC2	ZINC000819025977	DF	On-Demand	Anodyne	DRD4	43	51
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1CC12CC2	ZINC000819025977	DF	On-Demand	Anodyne	ACHE	41	45
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1CC12CC2	ZINC000819025977	DF	On-Demand	Anodyne	CHRM3	21	47
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1CC12CC2	ZINC000819025977	DF	On-Demand	Anodyne	SIGMAR1	75	55
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1CC12CC2	ZINC000819025977	DF	On-Demand	Anodyne	MCHR1	23	45
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@@H]1CC12CC2	ZINC000819025978	DF	On-Demand	Anodyne	CHRM2	17	47
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@@H]1CC12CC2	ZINC000819025978	DF	On-Demand	Anodyne	DRD4	43	51
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@@H]1CC12CC2	ZINC000819025978	DF	On-Demand	Anodyne	ACHE	41	45
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@@H]1CC12CC2	ZINC000819025978	DF	On-Demand	Anodyne	CHRM3	21	47
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@@H]1CC12CC2	ZINC000819025978	DF	On-Demand	Anodyne	SIGMAR1	75	55
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@@H]1CC12CC2	ZINC000819025978	DF	On-Demand	Anodyne	MCHR1	23	45
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2C[C@H]2C2CCC2)cc1	ZINC000819025990	ED	On-Demand	Anodyne	CA2	59	53
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2C[C@H]2C2CCC2)cc1	ZINC000819025990	ED	On-Demand	Anodyne	CA1	56	53
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2C[C@H]2C2CCC2)cc1	ZINC000819025990	ED	On-Demand	Anodyne	CA7	33	42
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2C[C@H]2C2CCC2)cc1	ZINC000819025990	ED	On-Demand	Anodyne	CA5B	29	42
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2C[C@H]2C2CCC2)cc1	ZINC000819025990	ED	On-Demand	Anodyne	CA4	40	44
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2C[C@H]2C2CCC2)cc1	ZINC000819025990	ED	On-Demand	Anodyne	CA5A	29	42
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2C[C@H]2C2CCC2)cc1	ZINC000819025990	ED	On-Demand	Anodyne	CA14	39	45
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2C[C@H]2C2CCC2)cc1	ZINC000819025990	ED	On-Demand	Anodyne	CA12	44	49
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2C[C@H]2C2CCC2)cc1	ZINC000819025990	ED	On-Demand	Anodyne	CA9	46	53
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2C[C@H]2C2CCC2)cc1	ZINC000819025990	ED	On-Demand	Anodyne	NAMPT	22	41
O=C(c1cc(O)c2ccsc2c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026021	FJ	On-Demand	Anodyne	GPBAR1	17	41
O=C(c1cc(O)c2ccsc2c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026022	FJ	On-Demand	Anodyne	GPBAR1	17	41
O=C(Nc1ccc(C2CCC2)cn1)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000819026025	GH	On-Demand	Anodyne	P2RX7	18	46
O=C(Nc1ccc(C2CCC2)cn1)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000819026026	GH	On-Demand	Anodyne	P2RX7	18	46
O=C(c1cc(C(F)(F)F)cnc1Cl)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026052	GJ	On-Demand	Anodyne	GPBAR1	55	42
O=C(c1cc(C(F)(F)F)cnc1Cl)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026052	GJ	On-Demand	Anodyne	LIPG	40	37
O=C(c1cc(C(F)(F)F)cnc1Cl)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026053	GJ	On-Demand	Anodyne	GPBAR1	55	42
O=C(c1cc(C(F)(F)F)cnc1Cl)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026053	GJ	On-Demand	Anodyne	LIPG	40	37
O=C(Nc1ccc(C2CCC2)cn1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000819026054	II	On-Demand	Anodyne	F10	29	40
O=C(Nc1ccc(C2CCC2)cn1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000819026054	II	On-Demand	Anodyne	NAMPT	43	40
O=C([C@@H](F)c1ccccc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026073	DI	On-Demand	Anodyne	KCNQ2	17	43
O=C([C@@H](F)c1ccccc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026074	DI	On-Demand	Anodyne	KCNQ2	17	43
O=C([C@H](F)c1ccccc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026075	DI	On-Demand	Anodyne	KCNQ2	17	43
O=C([C@H](F)c1ccccc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026076	DI	On-Demand	Anodyne	KCNQ2	17	43
O=C(c1cc(Cl)cc(Cl)n1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026081	FI	On-Demand	Anodyne	GPBAR1	43	40
O=C(c1cc(Cl)cc(Cl)n1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026082	FI	On-Demand	Anodyne	GPBAR1	43	40
O=C(CCCc1ccsc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026088	EI	On-Demand	Anodyne	PREP	42	38
O=C(CCCc1ccsc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026089	EI	On-Demand	Anodyne	PREP	42	38
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1	ZINC000819026092	IH	On-Demand	Anodyne	GPBAR1	57	42
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)N2C[C@H]3CCCCN3c3ccccc32)c1	ZINC000819026093	IH	On-Demand	Anodyne	GPBAR1	57	42
CC(C)(C)OC(=O)N1CC(CC(=O)Nc2ccc(C3CCC3)cn2)C1	ZINC000819026094	EH	On-Demand	Anodyne	GPR119	41	40
O=C([C@@H](F)Cc1ccccc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026095	EH	On-Demand	Anodyne	ACE	47	36
O=C([C@H](F)Cc1ccccc1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026096	EH	On-Demand	Anodyne	ACE	47	36
O=C([C@@H](F)Cc1ccccc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026097	EH	On-Demand	Anodyne	ACE	47	36
O=C([C@H](F)Cc1ccccc1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026098	EH	On-Demand	Anodyne	ACE	47	36
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819026157	GD	On-Demand	Bother	ADRB2	33	41
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819026157	GD	On-Demand	Bother	ADRB1	56	46
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819026157	GD	On-Demand	Bother	ADRB3	84	46
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819026158	GD	On-Demand	Bother	ADRB2	33	41
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819026158	GD	On-Demand	Bother	ADRB1	56	46
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819026158	GD	On-Demand	Bother	ADRB3	84	46
O=C(Nc1ccc(C2CCC2)cn1)[C@H]1CCCN1C(=O)OCC(F)(F)F	ZINC000819026180	FG	On-Demand	Anodyne	LGMN	70	38
O=C(Nc1ccc(C2CCC2)cn1)[C@@H]1CCCN1C(=O)OCC(F)(F)F	ZINC000819026181	FG	On-Demand	Anodyne	LGMN	70	38
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819026183	FD	On-Demand	Anodyne	ADRB2	40	43
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819026183	FD	On-Demand	Anodyne	ADRB1	49	44
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819026183	FD	On-Demand	Anodyne	DRD4	15	45
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819026183	FD	On-Demand	Anodyne	PTGS2	34	40
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819026183	FD	On-Demand	Anodyne	ADRB3	76	46
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819026184	FD	On-Demand	Anodyne	ADRB2	40	43
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819026184	FD	On-Demand	Anodyne	ADRB1	49	44
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819026184	FD	On-Demand	Anodyne	DRD4	15	45
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819026184	FD	On-Demand	Anodyne	PTGS2	34	40
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819026184	FD	On-Demand	Anodyne	ADRB3	76	46
CN(C)S(=O)(=O)c1cc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)ccc1F	ZINC000819026208	HG	On-Demand	Anodyne	AVPR2	42	35
CN(C)S(=O)(=O)c1cc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)ccc1F	ZINC000819026210	HG	On-Demand	Anodyne	AVPR2	42	35
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819026212	GH	On-Demand	Anodyne	PAPA1_CARPA	31	46
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819026212	GH	On-Demand	Anodyne	REN	48	38
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819026212	GH	On-Demand	Anodyne	FPR1	41	44
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819026213	GH	On-Demand	Anodyne	PAPA1_CARPA	31	46
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819026213	GH	On-Demand	Anodyne	REN	48	38
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819026213	GH	On-Demand	Anodyne	FPR1	41	44
O=C(c1cc(C2CC2)cnc1Cl)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026220	FJ	On-Demand	Anodyne	GPBAR1	62	43
O=C(c1cc(C2CC2)cnc1Cl)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026223	FJ	On-Demand	Anodyne	GPBAR1	62	43
O=Cc1ccc(OCC(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1	ZINC000819026229	FG	On-Demand	Anodyne	CPT1A	118	40
O=Cc1ccc(OCC(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1	ZINC000819026229	FG	On-Demand	Anodyne	CPT2	47	36
O=Cc1ccc(OCC(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1	ZINC000819026230	FG	On-Demand	Anodyne	CPT1A	118	40
O=Cc1ccc(OCC(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1	ZINC000819026230	FG	On-Demand	Anodyne	CPT2	47	36
O=C(c1cccc(C2OCCO2)c1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026231	FH	On-Demand	Anodyne	L3MBTL3	56	42
O=C(c1cccc(C2OCCO2)c1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026232	FH	On-Demand	Anodyne	L3MBTL3	56	42
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819026242	FE	On-Demand	Anodyne	ADRB1	40	40
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819026242	FE	On-Demand	Anodyne	ADRB3	39	43
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819026244	FE	On-Demand	Anodyne	ADRB1	40	40
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819026244	FE	On-Demand	Anodyne	ADRB3	39	43
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819026255	FD	On-Demand	Mild	ADRB2	24	41
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819026255	FD	On-Demand	Mild	ADRB1	33	42
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819026255	FD	On-Demand	Mild	ADRB3	46	45
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819026255	FD	On-Demand	Mild	CTSF	53	35
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819026255	FD	On-Demand	Mild	LOX1.1	28	41
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819026255	FD	On-Demand	Mild	O49150_SOLTU	32	41
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819026257	FD	On-Demand	Mild	ADRB2	24	41
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819026257	FD	On-Demand	Mild	ADRB1	33	42
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819026257	FD	On-Demand	Mild	ADRB3	46	45
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819026257	FD	On-Demand	Mild	CTSF	53	35
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819026257	FD	On-Demand	Mild	LOX1.1	28	41
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819026257	FD	On-Demand	Mild	O49150_SOLTU	32	41
CC(C)(C)OC(=O)NCc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1	ZINC000819026260	HJ	On-Demand	Anodyne	AVPR2	68	42
CC(C)(C)OC(=O)NCc1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1	ZINC000819026261	HJ	On-Demand	Anodyne	AVPR2	68	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	F2	24	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	PLG	22	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	ACE	45	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	P2RY12	71	33
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	ELANE	24	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	CTRA_BOVIN	67	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	KLK3	77	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	CTSB	57	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	PAPA1_CARPA	52	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	TRY1_BOVIN	44	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	CYSP_TRYCR	54	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	CTSG	45	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	CTSK	43	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	CTSL	49	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	PREP	25	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	CAPNS1	66	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	CELA2A	56	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	MMP11	46	31
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	CTSS	25	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	CAPN1	78	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	CAPN2	120	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	PLAU	18	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	TGM2	28	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	KLK1	20	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	NPR	60	32
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026262	IH	On-Demand	Anodyne	SLC12A5	49	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	F2	24	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	PLG	22	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	ACE	45	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	P2RY12	71	33
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	ELANE	24	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	CTRA_BOVIN	67	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	KLK3	77	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	CTSB	57	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	PAPA1_CARPA	52	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	TRY1_BOVIN	44	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	CYSP_TRYCR	54	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	CTSG	45	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	CTSK	43	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	CTSL	49	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	PREP	25	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	CAPNS1	66	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	CELA2A	56	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	MMP11	46	31
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	CTSS	25	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	CAPN1	78	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	CAPN2	120	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	PLAU	18	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	TGM2	28	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	KLK1	20	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	NPR	60	32
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026263	IH	On-Demand	Anodyne	SLC12A5	49	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	F2	24	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	PLG	22	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	ACE	45	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	P2RY12	71	33
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	ELANE	24	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	CTRA_BOVIN	67	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	KLK3	77	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	CTSB	57	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	PAPA1_CARPA	52	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	TRY1_BOVIN	44	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	CYSP_TRYCR	54	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	CTSG	45	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	CTSK	43	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	CTSL	49	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	PREP	25	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	CAPNS1	66	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	CELA2A	56	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	MMP11	46	31
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	CTSS	25	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	CAPN1	78	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	CAPN2	120	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	PLAU	18	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	TGM2	28	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	KLK1	20	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	NPR	60	32
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026264	IH	On-Demand	Anodyne	SLC12A5	49	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	F2	24	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	PLG	22	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	ACE	45	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	P2RY12	71	33
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	ELANE	24	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	CTRA_BOVIN	67	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	KLK3	77	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	CTSB	57	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	PAPA1_CARPA	52	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	TRY1_BOVIN	44	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	CYSP_TRYCR	54	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	CTSG	45	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	CTSK	43	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	CTSL	49	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	PREP	25	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	CAPNS1	66	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	CELA2A	56	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	MMP11	46	31
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	CTSS	25	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	CAPN1	78	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	CAPN2	120	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	PLAU	18	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	TGM2	28	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	KLK1	20	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	NPR	60	32
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026265	IH	On-Demand	Anodyne	SLC12A5	49	35
COC(=O)Nc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1	ZINC000819026283	FH	On-Demand	Anodyne	AVPR2	133	49
COC(=O)Nc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1	ZINC000819026283	FH	On-Demand	Anodyne	AVPR1A	72	47
COC(=O)Nc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1	ZINC000819026283	FH	On-Demand	Anodyne	L3MBTL3	46	35
COC(=O)Nc1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1	ZINC000819026284	FH	On-Demand	Anodyne	AVPR2	133	49
COC(=O)Nc1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1	ZINC000819026284	FH	On-Demand	Anodyne	AVPR1A	72	47
COC(=O)Nc1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1	ZINC000819026284	FH	On-Demand	Anodyne	L3MBTL3	46	35
CC(C)(C)OC(=O)N1CCC(C(=O)N2C[C@H]3CCCCN3c3ccccc32)CC1	ZINC000819026299	GI	On-Demand	Anodyne	GPR119	45	42
CC(C)(C)OC(=O)N1CCC(C(=O)N2C[C@H]3CCCCN3c3ccccc32)CC1	ZINC000819026299	GI	On-Demand	Anodyne	SFRP1	23	42
CC(C)(C)OC(=O)N1CCC(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)CC1	ZINC000819026300	GI	On-Demand	Anodyne	GPR119	45	42
CC(C)(C)OC(=O)N1CCC(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)CC1	ZINC000819026300	GI	On-Demand	Anodyne	SFRP1	23	42
O=C(c1cnc(Cl)c2ccccc12)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026301	GJ	On-Demand	Anodyne	GPBAR1	59	43
O=C(c1cnc(Cl)c2ccccc12)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026302	GJ	On-Demand	Anodyne	GPBAR1	59	43
COc1ccc(C)cc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819026313	GH	On-Demand	Mild	PAPA1_CARPA	44	44
COc1ccc(C)cc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819026313	GH	On-Demand	Mild	FPR1	45	38
COc1ccc(C)cc1[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819026314	GH	On-Demand	Mild	PAPA1_CARPA	44	44
COc1ccc(C)cc1[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819026314	GH	On-Demand	Mild	FPR1	45	38
COc1ccc(C)cc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819026315	GH	On-Demand	Mild	PAPA1_CARPA	44	44
COc1ccc(C)cc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819026315	GH	On-Demand	Mild	FPR1	45	38
COc1ccc(C)cc1[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819026316	GH	On-Demand	Mild	PAPA1_CARPA	44	44
COc1ccc(C)cc1[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819026316	GH	On-Demand	Mild	FPR1	45	38
O=C(NNC(=S)NCCc1cccnc1)[C@H]1CCCS1	ZINC000819026318	DD	On-Demand	Reactive	NAMPT	37	43
O=C(NNC(=S)NCCc1cccnc1)[C@@H]1CCCS1	ZINC000819026319	DD	On-Demand	Reactive	NAMPT	37	43
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819026339	FE	On-Demand	Anodyne	ADRB2	71	52
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819026339	FE	On-Demand	Anodyne	ADRB1	98	60
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819026339	FE	On-Demand	Anodyne	DRD4	17	43
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819026339	FE	On-Demand	Anodyne	ADRB3	139	60
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819026339	FE	On-Demand	Anodyne	PLA2G4A	41	35
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819026340	FE	On-Demand	Anodyne	ADRB2	71	52
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819026340	FE	On-Demand	Anodyne	ADRB1	98	60
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819026340	FE	On-Demand	Anodyne	DRD4	17	43
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819026340	FE	On-Demand	Anodyne	ADRB3	139	60
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819026340	FE	On-Demand	Anodyne	PLA2G4A	41	35
Cn1cc([C@@H]2OCC[C@H]2NC(=S)Nc2ccccc2Cl)cn1	ZINC000819026346	EF	On-Demand	Anodyne	EPHB3	49	35
O=C(NCCCN1CCCCC1)C(F)=C1CCC1	ZINC000819026347	CE	On-Demand	Anodyne	CHRNA7	15	42
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819026348	FE	On-Demand	Anodyne	ADRB2	42	43
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819026348	FE	On-Demand	Anodyne	ADRB1	59	45
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819026348	FE	On-Demand	Anodyne	DRD4	17	43
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819026348	FE	On-Demand	Anodyne	PTGS2	16	40
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819026348	FE	On-Demand	Anodyne	ADRB3	81	46
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@@H]1CCCS1	ZINC000819026355	DE	On-Demand	Reactive	ACE	50	39
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@@H]1CCCS1	ZINC000819026355	DE	On-Demand	Reactive	MME	70	39
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@@H]1CCCS1	ZINC000819026355	DE	On-Demand	Reactive	CAPNS1	57	37
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@@H]1CCCS1	ZINC000819026355	DE	On-Demand	Reactive	CAPN1	45	36
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@@H]1CCCS1	ZINC000819026355	DE	On-Demand	Reactive	ACE2	59	33
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@H]1CCCS1	ZINC000819026357	DE	On-Demand	Reactive	ACE	50	39
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@H]1CCCS1	ZINC000819026357	DE	On-Demand	Reactive	MME	70	39
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@H]1CCCS1	ZINC000819026357	DE	On-Demand	Reactive	CAPNS1	57	37
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@H]1CCCS1	ZINC000819026357	DE	On-Demand	Reactive	CAPN1	45	36
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@H]1CCCS1	ZINC000819026357	DE	On-Demand	Reactive	ACE2	59	33
CC(=O)[C@@H](C)OC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819026379	CE	On-Demand	Bother	COLA	102	40
CC(=O)[C@H](C)OC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819026380	CE	On-Demand	Bother	COLA	102	40
CNS(=O)(=O)c1ccc(Cl)c(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1	ZINC000819026409	HG	On-Demand	Anodyne	AVPR2	49	40
CNS(=O)(=O)c1ccc(Cl)c(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1	ZINC000819026409	HG	On-Demand	Anodyne	GPBAR1	62	44
CNS(=O)(=O)c1ccc(Cl)c(C(=O)N2C[C@H]3CCCCN3c3ccccc32)c1	ZINC000819026410	HG	On-Demand	Anodyne	AVPR2	49	40
CNS(=O)(=O)c1ccc(Cl)c(C(=O)N2C[C@H]3CCCCN3c3ccccc32)c1	ZINC000819026410	HG	On-Demand	Anodyne	GPBAR1	62	44
Cc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)c(Br)n1	ZINC000819026420	GI	On-Demand	Anodyne	GPBAR1	47	38
O=C(Nc1ccc(C2CCC2)cn1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000819026422	HF	On-Demand	Anodyne	TGM2	19	41
O=C(Nc1ccc(C2CCC2)cn1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000819026422	HF	On-Demand	Anodyne	MERTK	33	43
O=C(Nc1ccc(C2CCC2)cn1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000819026422	HF	On-Demand	Anodyne	NAMPT	39	40
COc1ccc(N2CCN(C(=O)/C=C\C(=O)Nc3ccc(C4CCC4)cn3)CC2)cc1	ZINC000819026425	HG	On-Demand	Clean	NPBWR1	69	32
COc1ccc(N2CCN(C(=O)/C=C/C(=O)Nc3ccc(C4CCC4)cn3)CC2)cc1	ZINC000819026426	HG	On-Demand	Clean	NPBWR1	69	32
O=C([C@@H]1CC(=O)N(C2CCCC2)C1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026435	FG	On-Demand	Anodyne	INHA	24	47
O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026436	FG	On-Demand	Anodyne	INHA	24	47
O=C([C@@H]1CC(=O)N(C2CCCC2)C1)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026437	FG	On-Demand	Anodyne	INHA	24	47
O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026438	FG	On-Demand	Anodyne	INHA	24	47
Cn1cc([C@@H]2OCC[C@H]2NC(=S)Nc2ccc3c(c2)OCCCO3)cn1	ZINC000819026495	FE	On-Demand	Anodyne	QPCT	20	43
CCOC(=O)Nc1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1	ZINC000819026499	GI	On-Demand	Anodyne	AVPR2	130	47
CCOC(=O)Nc1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)cc1	ZINC000819026499	GI	On-Demand	Anodyne	AVPR1A	71	47
CCOC(=O)Nc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1	ZINC000819026501	GI	On-Demand	Anodyne	AVPR2	130	47
CCOC(=O)Nc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)cc1	ZINC000819026501	GI	On-Demand	Anodyne	AVPR1A	71	47
CC(C)(C)OC(=O)NCc1cccc(C(=O)Nc2ccc(C3CCC3)cn2)c1	ZINC000819026512	GJ	On-Demand	Anodyne	ROCK2	15	40
CC(C)(C)OC(=O)N1CCc2cc(C(=O)N3C[C@@H]4CCCCN4c4ccccc43)ccc21	ZINC000819026529	IK	On-Demand	Anodyne	AVPR2	58	41
CC(C)(C)OC(=O)N1CCc2cc(C(=O)N3C[C@H]4CCCCN4c4ccccc43)ccc21	ZINC000819026531	IK	On-Demand	Anodyne	AVPR2	58	41
C[C@@H]1CCN(C(=S)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)[C@H](C)C1	ZINC000819026532	GF	On-Demand	Anodyne	TGM2	62	43
C[C@@H]1CCN(C(=S)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)[C@H](C)C1	ZINC000819026532	GF	On-Demand	Anodyne	F13A1	86	43
C[C@@H]1CCN(C(=S)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)[C@H](C)C1	ZINC000819026532	GF	On-Demand	Anodyne	MERTK	31	42
C[C@@H]1CCN(C(=S)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)[C@H](C)C1	ZINC000819026532	GF	On-Demand	Anodyne	NAMPT	28	46
COC(=O)Nc1cc(C(=O)Nc2ccc(C3CCC3)cn2)cc(C(F)(F)F)c1	ZINC000819026549	GJ	On-Demand	Anodyne	ATF1	42	37
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2C[C@@H]3CCCCN3c3ccccc32)C1	ZINC000819026550	GI	On-Demand	Anodyne	SFRP1	28	43
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2C[C@H]3CCCCN3c3ccccc32)C1	ZINC000819026551	GI	On-Demand	Anodyne	SFRP1	28	43
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819026552	FD	On-Demand	Anodyne	ADRB2	53	42
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819026552	FD	On-Demand	Anodyne	ADRB1	70	46
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819026552	FD	On-Demand	Anodyne	ADRB3	118	48
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819026554	FD	On-Demand	Anodyne	ADRB2	53	42
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819026554	FD	On-Demand	Anodyne	ADRB1	70	46
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819026554	FD	On-Demand	Anodyne	ADRB3	118	48
Cc1ccc(NC(=S)N[C@@H]2CCO[C@H]2c2cnn(C)c2)cc1C	ZINC000819026572	EF	On-Demand	Anodyne	QPCT	40	37
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819026645	FE	On-Demand	Anodyne	ADRB2	45	45
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819026645	FE	On-Demand	Anodyne	ADRB1	54	43
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819026645	FE	On-Demand	Anodyne	ADRB3	85	44
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819026646	FE	On-Demand	Anodyne	ADRB2	45	45
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819026646	FE	On-Demand	Anodyne	ADRB1	54	43
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819026646	FE	On-Demand	Anodyne	ADRB3	85	44
O=C(NNC(=S)NCCc1ccc(Cl)cc1Cl)[C@H]1CCCS1	ZINC000819026650	GF	On-Demand	Reactive	P2RX7	30	42
O=C(NNC(=S)NCCc1ccc(Cl)cc1Cl)[C@H]1CCCS1	ZINC000819026650	GF	On-Demand	Reactive	MC5R	18	40
O=C(NNC(=S)NCCc1ccc(Cl)cc1Cl)[C@@H]1CCCS1	ZINC000819026651	GF	On-Demand	Reactive	P2RX7	30	42
O=C(NNC(=S)NCCc1ccc(Cl)cc1Cl)[C@@H]1CCCS1	ZINC000819026651	GF	On-Demand	Reactive	MC5R	18	40
O=C(c1cc(Br)ncc1Cl)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026703	HJ	On-Demand	Anodyne	GPBAR1	65	46
O=C(c1cc(Br)ncc1Cl)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026704	HJ	On-Demand	Anodyne	GPBAR1	65	46
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccccc2F)cc1	ZINC000819026715	FD	On-Demand	Anodyne	ADRB2	35	42
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccccc2F)cc1	ZINC000819026715	FD	On-Demand	Anodyne	ADRB1	46	42
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccccc2F)cc1	ZINC000819026715	FD	On-Demand	Anodyne	ADRB3	43	42
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819026716	FD	On-Demand	Anodyne	ADRB2	35	42
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819026716	FD	On-Demand	Anodyne	ADRB1	46	42
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819026716	FD	On-Demand	Anodyne	ADRB3	43	42
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819026718	GF	On-Demand	Anodyne	ADRB2	40	43
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819026718	GF	On-Demand	Anodyne	ADRB1	48	43
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819026718	GF	On-Demand	Anodyne	GRIN1	23	47
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819026718	GF	On-Demand	Anodyne	ADRB3	73	43
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819026719	GF	On-Demand	Anodyne	ADRB2	40	43
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819026719	GF	On-Demand	Anodyne	ADRB1	48	43
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819026719	GF	On-Demand	Anodyne	GRIN1	23	47
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819026719	GF	On-Demand	Anodyne	ADRB3	73	43
C[C@@H]1CCN(C(=S)Nc2ccc3c(c2)OCO3)[C@H](C)C1	ZINC000819026737	CG	On-Demand	Anodyne	TRPC6	27	42
C[C@@H]1CCN(C(=S)Nc2ccc3c(c2)OCO3)[C@H](C)C1	ZINC000819026737	CG	On-Demand	Anodyne	TRPC3	30	42
Cn1cc([C@@H]2OCC[C@H]2NC(=S)NCCc2cccnc2)cn1	ZINC000819026739	ED	On-Demand	Anodyne	CHRNA7	42	34
CN(C)S(=O)(=O)c1cc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)ccc1Cl	ZINC000819026761	IH	On-Demand	Anodyne	AVPR2	53	39
CN(C)S(=O)(=O)c1cc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)ccc1Cl	ZINC000819026761	IH	On-Demand	Anodyne	GPBAR1	31	41
CN(C)S(=O)(=O)c1cc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)ccc1Cl	ZINC000819026762	IH	On-Demand	Anodyne	AVPR2	53	39
CN(C)S(=O)(=O)c1cc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)ccc1Cl	ZINC000819026762	IH	On-Demand	Anodyne	GPBAR1	31	41
C#CCNS(=O)(=O)c1cccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)c1	ZINC000819026769	HF	On-Demand	Mild	SFRP1	82	35
C#CCNS(=O)(=O)c1cccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)c1	ZINC000819026769	HF	On-Demand	Mild	WNT3	57	33
C#CCNS(=O)(=O)c1cccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1	ZINC000819026770	HF	On-Demand	Mild	SFRP1	82	35
C#CCNS(=O)(=O)c1cccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)c1	ZINC000819026770	HF	On-Demand	Mild	WNT3	57	33
CC(C)(C)OC(=O)NCCCC(=O)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026780	FH	On-Demand	Anodyne	PREP	18	50
CC(C)(C)OC(=O)NCCCC(=O)N1C[C@H]2CCCCN2c2ccccc21	ZINC000819026781	FH	On-Demand	Anodyne	PREP	18	50
Cc1cc(OCC(=O)N2C[C@@H]3CCCCN3c3ccccc32)no1	ZINC000819026789	EF	On-Demand	Anodyne	CPT1A	104	45
Cc1cc(OCC(=O)N2C[C@@H]3CCCCN3c3ccccc32)no1	ZINC000819026789	EF	On-Demand	Anodyne	GPBAR1	40	38
Cc1cc(OCC(=O)N2C[C@H]3CCCCN3c3ccccc32)no1	ZINC000819026790	EF	On-Demand	Anodyne	CPT1A	104	45
Cc1cc(OCC(=O)N2C[C@H]3CCCCN3c3ccccc32)no1	ZINC000819026790	EF	On-Demand	Anodyne	GPBAR1	40	38
O=C(c1nc(Cl)ccc1F)N1C[C@@H]2CCCCN2c2ccccc21	ZINC000819026801	EH	On-Demand	Anodyne	GPBAR1	44	40
NC(=S)c1ccc(C(=O)Nc2ccc(C3CCC3)cn2)cc1	ZINC000819026827	DG	On-Demand	Anodyne	F10	27	41
NC(=S)c1ccc(C(=O)Nc2ccc(C3CCC3)cn2)cc1	ZINC000819026827	DG	On-Demand	Anodyne	LUCI_LUCLA	33	40
O=C(NCCCC(=O)N1C[C@@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819026832	HI	On-Demand	Anodyne	ACE	15	44
O=C(NCCCC(=O)N1C[C@@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819026832	HI	On-Demand	Anodyne	PREP	61	52
O=C(NCCCC(=O)N1C[C@@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819026832	HI	On-Demand	Anodyne	TGM2	27	41
O=C(NCCCC(=O)N1C[C@@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819026832	HI	On-Demand	Anodyne	SLC12A5	40	36
O=C(NCCCC(=O)N1C[C@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819026833	HI	On-Demand	Anodyne	ACE	15	44
O=C(NCCCC(=O)N1C[C@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819026833	HI	On-Demand	Anodyne	PREP	61	52
O=C(NCCCC(=O)N1C[C@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819026833	HI	On-Demand	Anodyne	TGM2	27	41
O=C(NCCCC(=O)N1C[C@H]2CCCCN2c2ccccc21)OCc1ccccc1	ZINC000819026833	HI	On-Demand	Anodyne	SLC12A5	40	36
C[C@@H]1CCN(C(=S)NCc2ccc(S(N)(=O)=O)cc2)[C@H](C)C1	ZINC000819026845	ED	On-Demand	Anodyne	CA2	72	47
C[C@@H]1CCN(C(=S)NCc2ccc(S(N)(=O)=O)cc2)[C@H](C)C1	ZINC000819026845	ED	On-Demand	Anodyne	CA1	66	47
C[C@@H]1CCN(C(=S)NCc2ccc(S(N)(=O)=O)cc2)[C@H](C)C1	ZINC000819026845	ED	On-Demand	Anodyne	CA7	39	44
C[C@@H]1CCN(C(=S)NCc2ccc(S(N)(=O)=O)cc2)[C@H](C)C1	ZINC000819026845	ED	On-Demand	Anodyne	CA5B	31	43
C[C@@H]1CCN(C(=S)NCc2ccc(S(N)(=O)=O)cc2)[C@H](C)C1	ZINC000819026845	ED	On-Demand	Anodyne	CA4	46	43
C[C@@H]1CCN(C(=S)NCc2ccc(S(N)(=O)=O)cc2)[C@H](C)C1	ZINC000819026845	ED	On-Demand	Anodyne	CA5A	29	43
C[C@@H]1CCN(C(=S)NCc2ccc(S(N)(=O)=O)cc2)[C@H](C)C1	ZINC000819026845	ED	On-Demand	Anodyne	CA14	35	44
C[C@@H]1CCN(C(=S)NCc2ccc(S(N)(=O)=O)cc2)[C@H](C)C1	ZINC000819026845	ED	On-Demand	Anodyne	CA12	50	42
C[C@@H]1CCN(C(=S)NCc2ccc(S(N)(=O)=O)cc2)[C@H](C)C1	ZINC000819026845	ED	On-Demand	Anodyne	CA9	58	47
C[C@@H]1CCN(C(=S)NCc2ccc(S(N)(=O)=O)cc2)[C@H](C)C1	ZINC000819026845	ED	On-Demand	Anodyne	CYNT	22	41
C[C@H](NC(=S)NNC(=O)[C@H]1CCCS1)c1ccccc1	ZINC000819026865	DE	On-Demand	Reactive	BIRC8	45	33
C[C@H](NC(=S)NNC(=O)[C@@H]1CCCS1)c1ccccc1	ZINC000819026866	DE	On-Demand	Reactive	BIRC8	45	33
C[C@@H](NC(=S)NNC(=O)[C@@H]1CCCS1)c1ccccc1	ZINC000819026868	DE	On-Demand	Reactive	BIRC8	45	33
C[C@@H](NC(=S)NNC(=O)[C@H]1CCCS1)c1ccccc1	ZINC000819026869	DE	On-Demand	Reactive	BIRC8	45	33
O=C(Nc1ccc(C2CCC2)cn1)[C@@H]1C[C@H]1c1ccccc1	ZINC000819026878	CI	On-Demand	Anodyne	NAMPT	21	42
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819026883	GF	On-Demand	Anodyne	ADRB1	30	40
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819026883	GF	On-Demand	Anodyne	ADRB3	37	40
C[C@@H]1CCN(C(=S)NCCc2cccnc2)[C@H](C)C1	ZINC000819026887	CF	On-Demand	Anodyne	CHRNA7	44	36
C[C@@H]1CCN(C(=S)NCCc2cccnc2)[C@H](C)C1	ZINC000819026887	CF	On-Demand	Anodyne	NAMPT	23	40
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCS1	ZINC000819026888	GE	On-Demand	Reactive	CHRM2	15	47
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCS1	ZINC000819026888	GE	On-Demand	Reactive	DRD4	39	53
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCS1	ZINC000819026888	GE	On-Demand	Reactive	ACHE	35	46
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCS1	ZINC000819026888	GE	On-Demand	Reactive	CHRM3	18	47
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCS1	ZINC000819026888	GE	On-Demand	Reactive	SIGMAR1	47	54
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCS1	ZINC000819026888	GE	On-Demand	Reactive	CCR3	25	43
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCS1	ZINC000819026888	GE	On-Demand	Reactive	MCHR1	29	44
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCS1	ZINC000819026888	GE	On-Demand	Reactive	CACNA1G	16	43
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@H]1CCCS1	ZINC000819026889	GE	On-Demand	Reactive	CHRM2	15	47
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@H]1CCCS1	ZINC000819026889	GE	On-Demand	Reactive	DRD4	39	53
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@H]1CCCS1	ZINC000819026889	GE	On-Demand	Reactive	ACHE	35	46
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@H]1CCCS1	ZINC000819026889	GE	On-Demand	Reactive	CHRM3	18	47
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@H]1CCCS1	ZINC000819026889	GE	On-Demand	Reactive	SIGMAR1	47	54
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@H]1CCCS1	ZINC000819026889	GE	On-Demand	Reactive	CCR3	25	43
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@H]1CCCS1	ZINC000819026889	GE	On-Demand	Reactive	MCHR1	29	44
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@H]1CCCS1	ZINC000819026889	GE	On-Demand	Reactive	CACNA1G	16	43
Cc1ccccc1[C@@H](O)CNCCOc1ccc(S(C)(=O)=O)cc1	ZINC000819026891	EE	On-Demand	Anodyne	ADRB2	40	43
Cc1ccccc1[C@@H](O)CNCCOc1ccc(S(C)(=O)=O)cc1	ZINC000819026891	EE	On-Demand	Anodyne	ADRB1	48	43
Cc1ccccc1[C@@H](O)CNCCOc1ccc(S(C)(=O)=O)cc1	ZINC000819026891	EE	On-Demand	Anodyne	DRD4	17	40
Cc1ccccc1[C@@H](O)CNCCOc1ccc(S(C)(=O)=O)cc1	ZINC000819026891	EE	On-Demand	Anodyne	ADRB3	44	43
O=C(NCc1ccccc1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819026931	EE	On-Demand	Anodyne	PREP	19	43
O=C(NCc1ccccc1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819026931	EE	On-Demand	Anodyne	EPHX2	34	49
O=C(NCc1ccccc1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819026931	EE	On-Demand	Anodyne	TMPRSS11D	59	34
O=C(NCc1ccccc1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819026932	EE	On-Demand	Anodyne	PREP	19	43
O=C(NCc1ccccc1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819026932	EE	On-Demand	Anodyne	EPHX2	34	49
O=C(NCc1ccccc1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819026932	EE	On-Demand	Anodyne	TMPRSS11D	59	34
O=C(NCc1ccccc1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819026933	EE	On-Demand	Anodyne	PREP	19	43
O=C(NCc1ccccc1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819026933	EE	On-Demand	Anodyne	EPHX2	34	49
O=C(NCc1ccccc1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819026933	EE	On-Demand	Anodyne	TMPRSS11D	59	34
O=C(NCc1ccccc1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819026934	EE	On-Demand	Anodyne	PREP	19	43
O=C(NCc1ccccc1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819026934	EE	On-Demand	Anodyne	EPHX2	34	49
O=C(NCc1ccccc1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819026934	EE	On-Demand	Anodyne	TMPRSS11D	59	34
Cn1cc([C@@H]2OCC[C@H]2NC(=S)Nc2ccc3c(c2)OCCO3)cn1	ZINC000819026957	FE	On-Demand	Anodyne	QPCT	23	46
O=C(CNC(=O)Nc1ccccc1)Nc1nnc(C2CCCCC2)s1	ZINC000819026977	FG	On-Demand	Anodyne	CDK5	47	43
O=C(CNC(=O)Nc1ccccc1)Nc1nnc(C2CCCCC2)s1	ZINC000819026977	FG	On-Demand	Anodyne	PRMT3	42	38
Cn1cc([C@@H]2OCC[C@H]2NC(=S)NC2CCN(Cc3ccccc3)CC2)cn1	ZINC000819026992	GE	On-Demand	Anodyne	DRD4	37	42
Cn1cc([C@@H]2OCC[C@H]2NC(=S)NC2CCN(Cc3ccccc3)CC2)cn1	ZINC000819026992	GE	On-Demand	Anodyne	ACHE	32	43
Cn1cc([C@@H]2OCC[C@H]2NC(=S)NC2CCN(Cc3ccccc3)CC2)cn1	ZINC000819026992	GE	On-Demand	Anodyne	SIGMAR1	40	45
Cn1cc([C@@H]2OCC[C@H]2NC(=S)NC2CCN(Cc3ccccc3)CC2)cn1	ZINC000819026992	GE	On-Demand	Anodyne	MCHR1	24	40
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCS2)cc1	ZINC000819026995	FC	On-Demand	Reactive	CA2	65	45
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCS2)cc1	ZINC000819026995	FC	On-Demand	Reactive	CA1	58	45
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCS2)cc1	ZINC000819026995	FC	On-Demand	Reactive	CA7	33	43
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCS2)cc1	ZINC000819026995	FC	On-Demand	Reactive	CA5B	33	42
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCS2)cc1	ZINC000819026995	FC	On-Demand	Reactive	CA4	49	44
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCS2)cc1	ZINC000819026995	FC	On-Demand	Reactive	CA5A	34	42
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCS2)cc1	ZINC000819026995	FC	On-Demand	Reactive	CA14	44	43
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCS2)cc1	ZINC000819026995	FC	On-Demand	Reactive	CA12	49	42
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCS2)cc1	ZINC000819026995	FC	On-Demand	Reactive	CA9	50	45
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCS2)cc1	ZINC000819026995	FC	On-Demand	Reactive	CYNT	18	40
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCS2)cc1	ZINC000819026995	FC	On-Demand	Reactive	MTCA1	30	40
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCS2)cc1	ZINC000819026995	FC	On-Demand	Reactive	P96878_MYCTU	37	40
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCS2)cc1	ZINC000819026996	FC	On-Demand	Reactive	CA2	65	45
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCS2)cc1	ZINC000819026996	FC	On-Demand	Reactive	CA1	58	45
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCS2)cc1	ZINC000819026996	FC	On-Demand	Reactive	CA7	33	43
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCS2)cc1	ZINC000819026996	FC	On-Demand	Reactive	CA5B	33	42
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCS2)cc1	ZINC000819026996	FC	On-Demand	Reactive	CA4	49	44
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCS2)cc1	ZINC000819026996	FC	On-Demand	Reactive	CA5A	34	42
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCS2)cc1	ZINC000819026996	FC	On-Demand	Reactive	CA14	44	43
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCS2)cc1	ZINC000819026996	FC	On-Demand	Reactive	CA12	49	42
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCS2)cc1	ZINC000819026996	FC	On-Demand	Reactive	CA9	50	45
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCS2)cc1	ZINC000819026996	FC	On-Demand	Reactive	CYNT	18	40
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCS2)cc1	ZINC000819026996	FC	On-Demand	Reactive	MTCA1	30	40
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCS2)cc1	ZINC000819026996	FC	On-Demand	Reactive	P96878_MYCTU	37	40
O=C(NNC(=S)Nc1ccc(OC(F)(F)F)cc1)[C@@H]1CCCS1	ZINC000819026997	FF	On-Demand	Reactive	P2RY1	45	40
O=C(NNC(=S)Nc1ccc(OC(F)(F)F)cc1)[C@@H]1CCCS1	ZINC000819026997	FF	On-Demand	Reactive	EPHX2	55	50
O=C(NNC(=S)Nc1ccc(OC(F)(F)F)cc1)[C@H]1CCCS1	ZINC000819026998	FF	On-Demand	Reactive	P2RY1	45	40
O=C(NNC(=S)Nc1ccc(OC(F)(F)F)cc1)[C@H]1CCCS1	ZINC000819026998	FF	On-Demand	Reactive	EPHX2	55	50
O=C(NCc1ccccc1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819026999	EF	On-Demand	Anodyne	PREP	24	49
O=C(NCc1ccccc1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819026999	EF	On-Demand	Anodyne	EPHX2	29	49
O=C(NCc1ccccc1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819026999	EF	On-Demand	Anodyne	CACNA1G	47	40
O=C(NCc1ccccc1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819026999	EF	On-Demand	Anodyne	TMPRSS11D	58	32
Cn1cc([C@@H]2OCC[C@H]2NC(=S)NC23CC4CC(CC(C4)C2)C3)cn1	ZINC000819027000	FF	On-Demand	Anodyne	EPHX2	35	47
O=C(NNC(=S)NC12CC3CC(CC(C3)C1)C2)[C@@H]1CCCS1	ZINC000819027059	EE	On-Demand	Reactive	EPHX2	62	46
O=C(NNC(=S)NC12CC3CC(CC(C3)C1)C2)[C@H]1CCCS1	ZINC000819027060	EE	On-Demand	Reactive	EPHX2	62	46
Cc1cc(F)ccc1[C@@H](O)CNCCOc1ccc(S(C)(=O)=O)cc1	ZINC000819027079	FE	On-Demand	Anodyne	ADRB2	28	40
Cn1cc([C@@H]2OCC[C@H]2NC(=S)Nc2ccc(OC(F)(F)F)cc2)cn1	ZINC000819027088	GG	On-Demand	Anodyne	EPHX2	47	41
COc1ccc(OC)c([C@H](O)CNCCOc2ccc(S(C)(=O)=O)cc2)c1	ZINC000819027115	GD	On-Demand	Anodyne	ADRB2	32	43
COc1ccc(OC)c([C@H](O)CNCCOc2ccc(S(C)(=O)=O)cc2)c1	ZINC000819027115	GD	On-Demand	Anodyne	ADRB1	38	41
COc1ccc(OC)c([C@H](O)CNCCOc2ccc(S(C)(=O)=O)cc2)c1	ZINC000819027115	GD	On-Demand	Anodyne	ADRB3	41	41
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819027123	GD	On-Demand	Bother	ADRB2	22	41
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819027123	GD	On-Demand	Bother	ADRB1	33	44
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819027123	GD	On-Demand	Bother	ADRB3	44	44
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819027124	GD	On-Demand	Bother	ADRB2	22	41
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819027124	GD	On-Demand	Bother	ADRB1	33	44
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819027124	GD	On-Demand	Bother	ADRB3	44	44
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819027133	FE	On-Demand	Anodyne	ADRB2	32	40
CS(=O)(=O)c1ccc(OCCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819027133	FE	On-Demand	Anodyne	ADRB1	42	39
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819027134	FE	On-Demand	Anodyne	ADRB2	32	40
CS(=O)(=O)c1ccc(OCCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819027134	FE	On-Demand	Anodyne	ADRB1	42	39
O=C(NNC(=S)NCc1cccc(C(F)(F)F)c1)[C@H]1CCCS1	ZINC000819027138	FF	On-Demand	Reactive	CCR2	46	37
O=C(NNC(=S)NCc1cccc(C(F)(F)F)c1)[C@@H]1CCCS1	ZINC000819027139	FF	On-Demand	Reactive	CCR2	46	37
COc1ccc(OC)c([C@H](O)CNCC(C)(C)c2ccc(OC)c(OC)c2)c1	ZINC000819027140	GG	On-Demand	Anodyne	MT-ND1	24	40
Fc1ccc(Cl)c(Cn2cc(NC(=S)NC[C@@H]3CCCO3)cn2)c1	ZINC000819027164	FG	On-Demand	Anodyne	PANC	58	42
Fc1ccc(Cl)c(Cn2cc(NC(=S)NC[C@H]3CCCO3)cn2)c1	ZINC000819027165	FG	On-Demand	Anodyne	PANC	58	42
COc1ccc(OC)c([C@H](O)CNCCOc2ccccc2C(F)(F)F)c1	ZINC000819027168	GG	On-Demand	Anodyne	ADRB2	23	42
COc1ccc(OC)c([C@H](O)CNCCOc2ccccc2C(F)(F)F)c1	ZINC000819027168	GG	On-Demand	Anodyne	ADRB1	26	41
COc1ccc(OC)c([C@H](O)CNCCOc2ccccc2C(F)(F)F)c1	ZINC000819027168	GG	On-Demand	Anodyne	ADRB3	19	41
O[C@@H](CNCCOc1ccc(F)cc1F)c1cccnc1	ZINC000819027177	CE	On-Demand	Anodyne	ADRB2	30	52
O[C@@H](CNCCOc1ccc(F)cc1F)c1cccnc1	ZINC000819027177	CE	On-Demand	Anodyne	ADRB1	40	52
O[C@@H](CNCCOc1ccc(F)cc1F)c1cccnc1	ZINC000819027177	CE	On-Demand	Anodyne	ADRB3	108	54
O[C@@H](CNCCOc1ccc(F)cc1F)c1cccnc1	ZINC000819027177	CE	On-Demand	Anodyne	NMT1	35	47
O[C@H](CNCCOc1ccc(F)cc1F)c1cccnc1	ZINC000819027178	CE	On-Demand	Anodyne	ADRB2	30	52
O[C@H](CNCCOc1ccc(F)cc1F)c1cccnc1	ZINC000819027178	CE	On-Demand	Anodyne	ADRB1	40	52
O[C@H](CNCCOc1ccc(F)cc1F)c1cccnc1	ZINC000819027178	CE	On-Demand	Anodyne	ADRB3	108	54
O[C@H](CNCCOc1ccc(F)cc1F)c1cccnc1	ZINC000819027178	CE	On-Demand	Anodyne	NMT1	35	47
CN1C(=O)NCC12CCN(C(=S)NC13CC4CC(CC(C4)C1)C3)CC2	ZINC000819027189	FE	On-Demand	Anodyne	EPHX2	35	40
CSCCNC(=S)Nc1cnn(Cc2cc(F)ccc2Cl)c1	ZINC000819027207	FG	On-Demand	Anodyne	PANC	49	37
CN1C(=O)NCC12CCN(C(=S)Nc1cccc(OC(F)(F)F)c1)CC2	ZINC000819027215	GF	On-Demand	Anodyne	TAAR1	25	41
CCN1CCC[C@@H]1CNC(=S)Nc1cnn(Cc2cc(F)ccc2Cl)c1	ZINC000819027221	GG	On-Demand	Anodyne	PANC	54	39
CN1C(=O)NCC12CCN(C(=S)Nc1ccc3c(c1)OCO3)CC2	ZINC000819027244	ED	On-Demand	Anodyne	DYRK2	59	35
CC(C)(C)NC(=S)Nc1cnn(Cc2cc(F)ccc2Cl)c1	ZINC000819027285	EH	On-Demand	Anodyne	PANC	55	43
O=C(C(F)=C1CCC1)N1CCN(Cc2ccncc2)CC1	ZINC000819027286	CE	On-Demand	Anodyne	FAAH	17	40
Fc1ccc(Cl)c(Cn2cc(NC(=S)NC3CCC3)cn2)c1	ZINC000819027294	EH	On-Demand	Anodyne	PANC	52	40
Fc1ccc(Cl)c(Cn2cc(NC(=S)NC3CCOCC3)cn2)c1	ZINC000819027315	FG	On-Demand	Anodyne	PANC	53	40
CCN1CCC[C@@H]1CNC(=S)Nc1ccc(Cl)cc1COC	ZINC000819027330	EG	On-Demand	Anodyne	DRD2	33	44
CN1C(=O)NCC12CCN(C(=S)Nc1ccc(OC(F)(F)F)cc1)CC2	ZINC000819027332	GF	On-Demand	Anodyne	P2RY1	55	40
CN1C(=O)NCC12CCN(C(=S)Nc1ccc(OC(F)(F)F)cc1)CC2	ZINC000819027332	GF	On-Demand	Anodyne	MMP2	22	40
CN1C(=O)NCC12CCN(C(=S)Nc1ccc(OC(F)(F)F)cc1)CC2	ZINC000819027332	GF	On-Demand	Anodyne	MMP14	16	40
CN1C(=O)NCC12CCN(C(=S)Nc1ccc(OC(F)(F)F)cc1)CC2	ZINC000819027332	GF	On-Demand	Anodyne	MMP9	17	40
CN1C(=O)NCC12CCN(C(=S)Nc1ccc(OC(F)(F)F)cc1)CC2	ZINC000819027332	GF	On-Demand	Anodyne	EPHX2	57	46
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(F)cc2F)cc1	ZINC000819027341	FE	On-Demand	Anodyne	ADRB2	21	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(F)cc2F)cc1	ZINC000819027341	FE	On-Demand	Anodyne	PTGS2	24	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(F)cc2F)cc1	ZINC000819027341	FE	On-Demand	Anodyne	ADRB3	47	39
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(F)cc2F)cc1	ZINC000819027342	FE	On-Demand	Anodyne	ADRB2	21	42
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(F)cc2F)cc1	ZINC000819027342	FE	On-Demand	Anodyne	PTGS2	24	40
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(F)cc2F)cc1	ZINC000819027342	FE	On-Demand	Anodyne	ADRB3	47	39
Fc1ccc(Cl)c(Cn2cc(NC(=S)NC3CC3)cn2)c1	ZINC000819027344	DG	On-Demand	Anodyne	PANC	53	41
CCCNC(=S)Nc1cnn(Cc2cc(F)ccc2Cl)c1	ZINC000819027345	EG	On-Demand	Anodyne	PANC	51	38
C=C(C)C(C)(C)C(=O)NOCc1ccccc1	ZINC000819027346	BF	On-Demand	Mild	CAPNS1	47	36
C=C(C)C(C)(C)C(=O)NOCc1ccccc1	ZINC000819027346	BF	On-Demand	Mild	NPR	42	32
C=C(C)C(C)(C)C(=O)NOCc1ccccc1	ZINC000819027346	BF	On-Demand	Mild	SLC12A5	45	33
CC(C)(C)C(=O)COC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819027349	DF	On-Demand	Bother	GSTM2	61	36
CC(C)(C)C(=O)COC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819027349	DF	On-Demand	Bother	COLA	71	38
C[C@@H](c1cccc(C#N)c1)N(C)C(=S)NCCc1ccccc1	ZINC000819027392	DH	On-Demand	Mild	PTGES	15	40
C[C@H](c1cccc(C#N)c1)N(C)C(=S)NCCc1ccccc1	ZINC000819027395	DH	On-Demand	Mild	PTGES	15	40
Fc1ccc(Cl)c(Cn2cc(NC(=S)NC[C@H]3CCOC3)cn2)c1	ZINC000819027412	FG	On-Demand	Anodyne	PANC	53	39
Fc1ccc(Cl)c(Cn2cc(NC(=S)NC[C@@H]3CCOC3)cn2)c1	ZINC000819027416	FG	On-Demand	Anodyne	PANC	53	39
CCNC(=O)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819027421	EC	On-Demand	Mild	PAPA1_CARPA	48	60
CCNC(=O)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819027421	EC	On-Demand	Mild	CTSK	19	54
CCNC(=O)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819027422	EC	On-Demand	Mild	PAPA1_CARPA	48	60
CCNC(=O)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819027422	EC	On-Demand	Mild	CTSK	19	54
CC(=O)COC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819027423	CD	On-Demand	Bother	GSTM2	40	34
CC(=O)COC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819027423	CD	On-Demand	Bother	COLA	74	39
CCOCCCNC(=S)Nc1cccc(Cc2nc3ccccc3[nH]2)c1	ZINC000819027427	FH	On-Demand	Anodyne	QPCT	41	35
CN1C(=O)NCC12CCN(C(=S)Nc1ccc(Oc3ccccc3)cc1)CC2	ZINC000819027428	GH	On-Demand	Anodyne	PDGFRB	18	43
CN1C(=O)NCC12CCN(C(=S)Nc1ccc(Oc3ccccc3)cc1)CC2	ZINC000819027428	GH	On-Demand	Anodyne	NPY2R	24	41
Fc1ccc(Cl)c(Cn2cc(NC(=S)NCCN3CCOCC3)cn2)c1	ZINC000819027433	GE	On-Demand	Anodyne	EPHX2	16	43
Fc1ccc(Cl)c(Cn2cc(NC(=S)NCCN3CCOCC3)cn2)c1	ZINC000819027433	GE	On-Demand	Anodyne	PANC	51	37
COCc1cc(Cl)ccc1NC(=S)NC12CC3CC(CC(C3)C1)C2	ZINC000819027450	FJ	On-Demand	Anodyne	EPHX2	66	41
CC(C)(C)NC(=S)Nc1cccc(Cc2nc3ccccc3[nH]2)c1	ZINC000819027461	EI	On-Demand	Anodyne	ALKBH3	56	38
O[C@@H](CNCCOc1ccccc1C(F)(F)F)c1ccccc1	ZINC000819027464	EG	On-Demand	Anodyne	ADRB2	20	47
O[C@@H](CNCCOc1ccccc1C(F)(F)F)c1ccccc1	ZINC000819027464	EG	On-Demand	Anodyne	ADRB1	35	47
O[C@@H](CNCCOc1ccccc1C(F)(F)F)c1ccccc1	ZINC000819027464	EG	On-Demand	Anodyne	ADRB3	44	44
O[C@H](CNCCOc1ccccc1C(F)(F)F)c1ccccc1	ZINC000819027466	EG	On-Demand	Anodyne	ADRB2	20	47
O[C@H](CNCCOc1ccccc1C(F)(F)F)c1ccccc1	ZINC000819027466	EG	On-Demand	Anodyne	ADRB1	35	47
O[C@H](CNCCOc1ccccc1C(F)(F)F)c1ccccc1	ZINC000819027466	EG	On-Demand	Anodyne	ADRB3	44	44
O=C(CSc1ccccc1[N+](=O)[O-])O[C@@H]1CCOC1=O	ZINC000819027470	CD	On-Demand	Bother	TRAR	47	40
O=C(CSc1ccccc1[N+](=O)[O-])O[C@H]1CCOC1=O	ZINC000819027471	CD	On-Demand	Bother	TRAR	47	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1cccc(F)c1	ZINC000819027486	DE	On-Demand	Anodyne	PAPA1_CARPA	25	47
COCc1cc(Cl)ccc1NC(=S)NCCCN1CCOCC1	ZINC000819027495	FE	On-Demand	Anodyne	HRP1_PLAFA	63	35
COCc1cc(Cl)ccc1NC(=S)NCCCN1CCOCC1	ZINC000819027495	FE	On-Demand	Anodyne	EPHX2	21	42
O=C(NCc1ccc(CN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819027530	DG	On-Demand	Anodyne	HRH3	22	46
O=C(NCc1ccc(CN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819027530	DG	On-Demand	Anodyne	SIGMAR1	17	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000819027532	FF	On-Demand	Anodyne	HRH2	17	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000819027532	FF	On-Demand	Anodyne	HRH3	20	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000819027532	FF	On-Demand	Anodyne	SIGMAR1	16	46
O[C@@H](CNCCOc1ccc(F)cc1F)c1ccccc1	ZINC000819027663	CF	On-Demand	Anodyne	ADRB2	25	45
O[C@@H](CNCCOc1ccc(F)cc1F)c1ccccc1	ZINC000819027663	CF	On-Demand	Anodyne	ADRB1	43	48
O[C@@H](CNCCOc1ccc(F)cc1F)c1ccccc1	ZINC000819027663	CF	On-Demand	Anodyne	ADRB3	51	45
O[C@H](CNCCOc1ccc(F)cc1F)c1ccccc1	ZINC000819027664	CF	On-Demand	Anodyne	ADRB2	25	45
O[C@H](CNCCOc1ccc(F)cc1F)c1ccccc1	ZINC000819027664	CF	On-Demand	Anodyne	ADRB1	43	48
O[C@H](CNCCOc1ccc(F)cc1F)c1ccccc1	ZINC000819027664	CF	On-Demand	Anodyne	ADRB3	51	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NOCc1ccccc1	ZINC000819027676	DE	On-Demand	Anodyne	PAPA1_CARPA	34	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NOCc1ccccc1	ZINC000819027676	DE	On-Demand	Anodyne	CTSK	28	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NOCc1ccccc1	ZINC000819027676	DE	On-Demand	Anodyne	CTSL	28	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NOCc1ccccc1	ZINC000819027676	DE	On-Demand	Anodyne	CTSS	16	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NOCc1ccccc1	ZINC000819027676	DE	On-Demand	Anodyne	KLK5	23	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NOCc1ccccc1	ZINC000819027676	DE	On-Demand	Anodyne	FPR1	47	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NOCc1ccccc1	ZINC000819027676	DE	On-Demand	Anodyne	NAAA	45	38
CN(C)CC(C)(C)CNC(=S)Nc1cnn(Cc2cc(F)ccc2Cl)c1	ZINC000819027680	GH	On-Demand	Anodyne	PANC	52	38
O[C@@H](CNCCOc1ccccc1C(F)(F)F)c1cccc(F)c1	ZINC000819027681	EH	On-Demand	Anodyne	ADRB1	34	42
O[C@@H](CNCCOc1ccccc1C(F)(F)F)c1cccc(F)c1	ZINC000819027681	EH	On-Demand	Anodyne	ADRB3	40	42
O[C@H](CNCCOc1ccccc1C(F)(F)F)c1cccc(F)c1	ZINC000819027682	EH	On-Demand	Anodyne	ADRB1	34	42
O[C@H](CNCCOc1ccccc1C(F)(F)F)c1cccc(F)c1	ZINC000819027682	EH	On-Demand	Anodyne	ADRB3	40	42
CN1CCC(CNC(=S)Nc2cnn(Cc3cc(F)ccc3Cl)c2)CC1	ZINC000819027690	GG	On-Demand	Anodyne	PANC	56	40
COC(=O)CCCNC(=S)Nc1cnn(Cc2cc(F)ccc2Cl)c1	ZINC000819027717	GF	On-Demand	Anodyne	PANC	54	39
CN1C(=O)NCC12CCN(C(=S)NCc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000819027752	GC	On-Demand	Anodyne	CA2	51	46
CN1C(=O)NCC12CCN(C(=S)NCc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000819027752	GC	On-Demand	Anodyne	CA1	53	46
CN1C(=O)NCC12CCN(C(=S)NCc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000819027752	GC	On-Demand	Anodyne	CA7	23	44
CN1C(=O)NCC12CCN(C(=S)NCc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000819027752	GC	On-Demand	Anodyne	CA4	33	42
CN1C(=O)NCC12CCN(C(=S)NCc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000819027752	GC	On-Demand	Anodyne	CA14	19	44
CN1C(=O)NCC12CCN(C(=S)NCc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000819027752	GC	On-Demand	Anodyne	CA12	33	41
CN1C(=O)NCC12CCN(C(=S)NCc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000819027752	GC	On-Demand	Anodyne	CA9	39	46
COCc1cc(Cl)ccc1NC(=S)NCCc1cccnc1	ZINC000819027758	EG	On-Demand	Anodyne	TBXAS1	21	41
O[C@@H](CNCCOc1ccc(F)cc1F)c1cccc(F)c1	ZINC000819027774	DF	On-Demand	Anodyne	ADRB1	37	44
O[C@@H](CNCCOc1ccc(F)cc1F)c1cccc(F)c1	ZINC000819027774	DF	On-Demand	Anodyne	ADRB3	42	44
O[C@H](CNCCOc1ccc(F)cc1F)c1cccc(F)c1	ZINC000819027775	DF	On-Demand	Anodyne	ADRB1	37	44
O[C@H](CNCCOc1ccc(F)cc1F)c1cccc(F)c1	ZINC000819027775	DF	On-Demand	Anodyne	ADRB3	42	44
CCOCCCNC(=S)Nc1cnn(Cc2cc(F)ccc2Cl)c1	ZINC000819027778	FG	On-Demand	Anodyne	PANC	55	40
O[C@@H](CNCCOc1ccccc1C(F)(F)F)c1ccc(F)cc1	ZINC000819027779	EH	On-Demand	Anodyne	ADRB2	15	42
O[C@@H](CNCCOc1ccccc1C(F)(F)F)c1ccc(F)cc1	ZINC000819027779	EH	On-Demand	Anodyne	ADRB1	21	41
O[C@@H](CNCCOc1ccccc1C(F)(F)F)c1ccc(F)cc1	ZINC000819027779	EH	On-Demand	Anodyne	ADRB3	21	41
O[C@H](CNCCOc1ccccc1C(F)(F)F)c1ccc(F)cc1	ZINC000819027780	EH	On-Demand	Anodyne	ADRB2	15	42
O[C@H](CNCCOc1ccccc1C(F)(F)F)c1ccc(F)cc1	ZINC000819027780	EH	On-Demand	Anodyne	ADRB1	21	41
O[C@H](CNCCOc1ccccc1C(F)(F)F)c1ccc(F)cc1	ZINC000819027780	EH	On-Demand	Anodyne	ADRB3	21	41
O[C@@H](CNCCOc1ccc(F)cc1F)c1ccc(Cl)cc1	ZINC000819027808	EG	On-Demand	Anodyne	ADRB1	30	40
O[C@@H](CNCCOc1ccc(F)cc1F)c1ccc(Cl)cc1	ZINC000819027808	EG	On-Demand	Anodyne	ADRB3	30	40
CN1C(=O)NCC12CCN(C(=S)Nc1ccccc1Cl)CC2	ZINC000819027810	EF	On-Demand	Anodyne	EPHB3	41	31
COCCNC(=S)Nc1cnn(Cc2cc(F)ccc2Cl)c1	ZINC000819027824	EF	On-Demand	Anodyne	P2RX7	17	40
COCCNC(=S)Nc1cnn(Cc2cc(F)ccc2Cl)c1	ZINC000819027824	EF	On-Demand	Anodyne	PANC	54	40
C=CCC1(C(=O)NOCc2ccccc2)CCOCC1	ZINC000819027825	CF	On-Demand	Mild	SLC12A5	44	32
COCc1cc(Cl)ccc1NC(=S)NCC1CCN(C)CC1	ZINC000819027846	EG	On-Demand	Anodyne	CACNA1I	56	35
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ccc(F)cc2F)c1	ZINC000819027848	EF	On-Demand	Bother	ADRB1	29	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ccc(F)cc2F)c1	ZINC000819027848	EF	On-Demand	Bother	ADRB3	33	41
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ccc(F)cc2F)c1	ZINC000819027849	EF	On-Demand	Bother	ADRB1	29	41
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ccc(F)cc2F)c1	ZINC000819027849	EF	On-Demand	Bother	ADRB3	33	41
COCCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027853	GH	On-Demand	Anodyne	DRD2	24	54
COCCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027853	GH	On-Demand	Anodyne	DRD4	56	44
COCCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027853	GH	On-Demand	Anodyne	ACHE	49	57
COCCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027853	GH	On-Demand	Anodyne	HRH2	39	41
COCCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027853	GH	On-Demand	Anodyne	DRD3	21	44
COCCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027853	GH	On-Demand	Anodyne	SIGMAR1	51	48
COCCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027853	GH	On-Demand	Anodyne	NPY1R	33	48
COCCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027853	GH	On-Demand	Anodyne	CCR3	46	42
COCCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027853	GH	On-Demand	Anodyne	MCHR1	49	54
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1cccc(Br)c1	ZINC000819027859	FG	On-Demand	Anodyne	ADRB2	20	42
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1cccc(Br)c1	ZINC000819027859	FG	On-Demand	Anodyne	ADRB1	37	44
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1cccc(Br)c1	ZINC000819027859	FG	On-Demand	Anodyne	ADRB3	44	44
O[C@H](CNCCOc1ccc(F)c(F)c1)c1cccc(Br)c1	ZINC000819027861	FG	On-Demand	Anodyne	ADRB2	20	42
O[C@H](CNCCOc1ccc(F)c(F)c1)c1cccc(Br)c1	ZINC000819027861	FG	On-Demand	Anodyne	ADRB1	37	44
O[C@H](CNCCOc1ccc(F)c(F)c1)c1cccc(Br)c1	ZINC000819027861	FG	On-Demand	Anodyne	ADRB3	44	44
O=C1CCCCN1CCCNC[C@H](O)c1ccccc1F	ZINC000819027877	CD	On-Demand	Anodyne	TYRO3	18	40
O=C1CCCCN1CCCNC[C@@H](O)c1ccccc1F	ZINC000819027879	CD	On-Demand	Anodyne	TYRO3	18	40
O[C@@H](CNCCOc1ccc(F)cc1F)c1ccc(OC(F)(F)F)cc1	ZINC000819027897	GH	On-Demand	Anodyne	ADRB1	21	40
O[C@@H](CNCCOc1ccc(F)cc1F)c1ccc(OC(F)(F)F)cc1	ZINC000819027897	GH	On-Demand	Anodyne	ADRB3	24	40
CCN1CCC[C@@H]1CNC(=S)NC(C)(C)c1nocc1C(=O)OC	ZINC000819027898	FD	On-Demand	Anodyne	DRD2	32	41
CCN1CCC[C@H]1CNC(=S)NC(C)(C)c1nocc1C(=O)OC	ZINC000819027899	FD	On-Demand	Anodyne	DRD2	32	41
O[C@H](CNCCOc1ccc(F)cc1F)c1ccc(OC(F)(F)F)cc1	ZINC000819027900	GH	On-Demand	Anodyne	ADRB1	21	40
O[C@H](CNCCOc1ccc(F)cc1F)c1ccc(OC(F)(F)F)cc1	ZINC000819027900	GH	On-Demand	Anodyne	ADRB3	24	40
CN(C)CCCNC(=S)Nc1cnn(Cc2cc(F)ccc2Cl)c1	ZINC000819027902	FF	On-Demand	Anodyne	QPCT	41	35
O=C(NOCc1ccccc1)C(F)=C1CCC1	ZINC000819027906	BF	On-Demand	Anodyne	SLC12A5	45	34
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000819027947	DF	On-Demand	Anodyne	ADRB1	31	42
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000819027947	DF	On-Demand	Anodyne	DRD4	17	49
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000819027947	DF	On-Demand	Anodyne	ADRB3	31	42
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000819027948	DF	On-Demand	Anodyne	ADRB1	31	42
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000819027948	DF	On-Demand	Anodyne	DRD4	17	49
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000819027948	DF	On-Demand	Anodyne	ADRB3	31	42
CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027950	EH	On-Demand	Anodyne	DRD2	27	60
CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027950	EH	On-Demand	Anodyne	DRD4	63	49
CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027950	EH	On-Demand	Anodyne	ACHE	47	55
CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027950	EH	On-Demand	Anodyne	DRD3	20	49
CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027950	EH	On-Demand	Anodyne	SIGMAR1	67	53
CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027950	EH	On-Demand	Anodyne	NPY1R	31	42
CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027950	EH	On-Demand	Anodyne	CCR3	40	42
CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027950	EH	On-Demand	Anodyne	CCR5	23	44
CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027950	EH	On-Demand	Anodyne	SLC18A3	45	42
CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027950	EH	On-Demand	Anodyne	MCHR1	51	57
CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819027950	EH	On-Demand	Anodyne	MGEA5	28	43
COc1ccc(OC)c([C@H](O)CNCCOc2ccc(F)cc2F)c1	ZINC000819027961	FF	On-Demand	Anodyne	ADRB2	15	44
Cc1ccccc1[C@@H](O)CNCCOc1ccc(F)cc1F	ZINC000819027979	DF	On-Demand	Anodyne	ADRB2	15	42
O=C(CSc1ccccc1[N+](=O)[O-])OCc1ccc(F)cc1	ZINC000819027990	DH	On-Demand	Bother	GSTM2	41	36
CON(C)C(=O)CCNCCn1c(=O)oc2ccccc21	ZINC000819027991	CC	On-Demand	Anodyne	TSPO	18	50
O=C1CCCCN1CCCNC[C@H](O)c1cccc(Br)c1	ZINC000819028004	FE	On-Demand	Anodyne	ADRB3	73	44
O=C1CCCCN1CCCNC[C@@H](O)c1cccc(Br)c1	ZINC000819028006	FE	On-Demand	Anodyne	ADRB3	73	44
COc1ccc(OCC(F)(F)C(F)F)c(C(=O)NOCc2ccccc2)c1	ZINC000819028015	GH	On-Demand	Anodyne	MTNR1A	15	40
COc1ccc(OCC(F)(F)C(F)F)c(C(=O)NOCc2ccccc2)c1	ZINC000819028015	GH	On-Demand	Anodyne	MTNR1B	18	40
CN1C(=O)NCC12CCN(C(=S)Nc1ccc3c(c1)OCCO3)CC2	ZINC000819028017	FD	On-Demand	Anodyne	QPCT	16	41
Fc1ccc(Cl)c(Cn2cc(NC(=S)NC[C@@H]3CCCCO3)cn2)c1	ZINC000819028023	GH	On-Demand	Anodyne	PANC	57	41
Fc1ccc(Cl)c(Cn2cc(NC(=S)NC[C@H]3CCCCO3)cn2)c1	ZINC000819028025	GH	On-Demand	Anodyne	PANC	57	41
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(Br)cc1	ZINC000819028026	FG	On-Demand	Anodyne	ADRB2	18	40
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(Br)cc1	ZINC000819028026	FG	On-Demand	Anodyne	ADRB1	24	41
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(Br)cc1	ZINC000819028026	FG	On-Demand	Anodyne	ADRB3	25	41
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccc(Br)cc1	ZINC000819028028	FG	On-Demand	Anodyne	ADRB2	18	40
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccc(Br)cc1	ZINC000819028028	FG	On-Demand	Anodyne	ADRB1	24	41
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccc(Br)cc1	ZINC000819028028	FG	On-Demand	Anodyne	ADRB3	25	41
O=c1oc2ccccc2n1CCNC[C@H](O)c1cccnc1	ZINC000819028110	CD	On-Demand	Anodyne	ADRB2	25	45
O=c1oc2ccccc2n1CCNC[C@H](O)c1cccnc1	ZINC000819028110	CD	On-Demand	Anodyne	ADRB1	27	48
O=c1oc2ccccc2n1CCNC[C@H](O)c1cccnc1	ZINC000819028110	CD	On-Demand	Anodyne	ADRB3	103	49
O=c1oc2ccccc2n1CCNC[C@@H](O)c1cccnc1	ZINC000819028112	CD	On-Demand	Anodyne	ADRB2	25	45
O=c1oc2ccccc2n1CCNC[C@@H](O)c1cccnc1	ZINC000819028112	CD	On-Demand	Anodyne	ADRB1	27	48
O=c1oc2ccccc2n1CCNC[C@@H](O)c1cccnc1	ZINC000819028112	CD	On-Demand	Anodyne	ADRB3	103	49
C[C@H](CC(=O)NOCc1ccccc1)n1cccn1	ZINC000819028147	CE	On-Demand	Anodyne	CAPNS1	52	37
C[C@H](CC(=O)NOCc1ccccc1)n1cccn1	ZINC000819028147	CE	On-Demand	Anodyne	CAPN1	49	37
C[C@H](CC(=O)NOCc1ccccc1)n1cccn1	ZINC000819028147	CE	On-Demand	Anodyne	CAPN2	60	32
C[C@H](CC(=O)NOCc1ccccc1)n1cccn1	ZINC000819028147	CE	On-Demand	Anodyne	NPR	52	32
C[C@@H](CC(=O)NOCc1ccccc1)n1cccn1	ZINC000819028148	CE	On-Demand	Anodyne	CAPNS1	52	37
C[C@@H](CC(=O)NOCc1ccccc1)n1cccn1	ZINC000819028148	CE	On-Demand	Anodyne	CAPN1	49	37
C[C@@H](CC(=O)NOCc1ccccc1)n1cccn1	ZINC000819028148	CE	On-Demand	Anodyne	CAPN2	60	32
C[C@@H](CC(=O)NOCc1ccccc1)n1cccn1	ZINC000819028148	CE	On-Demand	Anodyne	NPR	52	32
O[C@@H](CNCCOc1ccc(F)cc1F)c1ccc(F)cc1	ZINC000819028152	DF	On-Demand	Anodyne	ADRB2	23	40
O[C@@H](CNCCOc1ccc(F)cc1F)c1ccc(F)cc1	ZINC000819028152	DF	On-Demand	Anodyne	ADRB1	22	40
O[C@@H](CNCCOc1ccc(F)cc1F)c1ccc(F)cc1	ZINC000819028152	DF	On-Demand	Anodyne	ADRB3	22	40
O[C@H](CNCCOc1ccc(F)cc1F)c1ccc(F)cc1	ZINC000819028153	DF	On-Demand	Anodyne	ADRB2	23	40
O[C@H](CNCCOc1ccc(F)cc1F)c1ccc(F)cc1	ZINC000819028153	DF	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CNCCOc1ccc(F)cc1F)c1ccc(F)cc1	ZINC000819028153	DF	On-Demand	Anodyne	ADRB3	22	40
CN1C(=O)NCC12CCN(C(=S)NCc1cccc(C(F)(F)F)c1)CC2	ZINC000819028154	GF	On-Demand	Anodyne	CCR2	64	36
CCOCCNC(=S)Nc1cnn(Cc2cc(F)ccc2Cl)c1	ZINC000819028156	FG	On-Demand	Anodyne	PANC	50	37
COCc1cc(Cl)ccc1NC(=S)NCCN1CCOCC1	ZINC000819028175	EE	On-Demand	Anodyne	DRD4	41	35
COCc1cc(Cl)ccc1NC(=S)NCCN1CCOCC1	ZINC000819028175	EE	On-Demand	Anodyne	EPHX2	18	45
C[C@@H](Cc1ccccc1)NC(=S)N(C)CCCN1C(=O)c2ccccc2C1=O	ZINC000819028182	GG	On-Demand	Anodyne	MMP9	15	44
Cc1cc(F)ccc1[C@@H](O)CNCCn1c(=O)oc2ccccc21	ZINC000819028189	EE	On-Demand	Anodyne	MIF	15	40
O[C@@H](CNCCOc1ccc(F)cc1F)c1cccc(Cl)c1	ZINC000819028193	EG	On-Demand	Anodyne	ADRB2	40	39
O[C@@H](CNCCOc1ccc(F)cc1F)c1cccc(Cl)c1	ZINC000819028193	EG	On-Demand	Anodyne	ADRB1	59	52
O[C@@H](CNCCOc1ccc(F)cc1F)c1cccc(Cl)c1	ZINC000819028193	EG	On-Demand	Anodyne	ADRB3	67	52
O[C@H](CNCCOc1ccc(F)cc1F)c1cccc(Cl)c1	ZINC000819028194	EG	On-Demand	Anodyne	ADRB2	40	39
O[C@H](CNCCOc1ccc(F)cc1F)c1cccc(Cl)c1	ZINC000819028194	EG	On-Demand	Anodyne	ADRB1	59	52
O[C@H](CNCCOc1ccc(F)cc1F)c1cccc(Cl)c1	ZINC000819028194	EG	On-Demand	Anodyne	ADRB3	67	52
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000819028203	EG	On-Demand	Anodyne	ADRB2	25	40
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000819028203	EG	On-Demand	Anodyne	ADRB1	38	43
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000819028203	EG	On-Demand	Anodyne	DRD4	18	49
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000819028203	EG	On-Demand	Anodyne	ADRB3	40	43
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1Br	ZINC000819028204	FG	On-Demand	Anodyne	ADRB1	23	40
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1Br	ZINC000819028204	FG	On-Demand	Anodyne	DRD4	17	40
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1Br	ZINC000819028206	FG	On-Demand	Anodyne	ADRB1	23	40
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1Br	ZINC000819028206	FG	On-Demand	Anodyne	DRD4	17	40
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1F	ZINC000819028207	DF	On-Demand	Anodyne	ADRB2	18	44
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1F	ZINC000819028207	DF	On-Demand	Anodyne	ADRB1	30	44
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1F	ZINC000819028207	DF	On-Demand	Anodyne	DRD4	18	43
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1F	ZINC000819028207	DF	On-Demand	Anodyne	ADRB3	23	41
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1F	ZINC000819028208	DF	On-Demand	Anodyne	ADRB2	18	44
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1F	ZINC000819028208	DF	On-Demand	Anodyne	ADRB1	30	44
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1F	ZINC000819028208	DF	On-Demand	Anodyne	DRD4	18	43
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1F	ZINC000819028208	DF	On-Demand	Anodyne	ADRB3	23	41
O=C1CCCCN1CCCNC[C@H](O)c1cccc(F)c1	ZINC000819028212	CD	On-Demand	Anodyne	ADRB1	36	42
O=C1CCCCN1CCCNC[C@H](O)c1cccc(F)c1	ZINC000819028212	CD	On-Demand	Anodyne	ADRB3	80	42
O=C1CCCCN1CCCNC[C@@H](O)c1cccc(F)c1	ZINC000819028214	CD	On-Demand	Anodyne	ADRB1	36	42
O=C1CCCCN1CCCNC[C@@H](O)c1cccc(F)c1	ZINC000819028214	CD	On-Demand	Anodyne	ADRB3	80	42
O=C1CCCCN1CCCNC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819028231	EG	On-Demand	Anodyne	TYRO3	18	41
O=C1CCCCN1CCCNC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819028232	EG	On-Demand	Anodyne	TYRO3	18	41
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(F)cc1F	ZINC000819028234	EF	On-Demand	Anodyne	DRD4	15	44
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccc(F)cc1F	ZINC000819028236	EF	On-Demand	Anodyne	DRD4	15	44
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(F)c(F)c1	ZINC000819028244	EF	On-Demand	Anodyne	ADRB2	32	40
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(F)c(F)c1	ZINC000819028244	EF	On-Demand	Anodyne	ADRB1	39	42
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(F)c(F)c1	ZINC000819028244	EF	On-Demand	Anodyne	DRD4	17	41
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(F)c(F)c1	ZINC000819028244	EF	On-Demand	Anodyne	ADRB3	41	42
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccc(F)c(F)c1	ZINC000819028246	EF	On-Demand	Anodyne	ADRB2	32	40
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccc(F)c(F)c1	ZINC000819028246	EF	On-Demand	Anodyne	ADRB1	39	42
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccc(F)c(F)c1	ZINC000819028246	EF	On-Demand	Anodyne	DRD4	17	41
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccc(F)c(F)c1	ZINC000819028246	EF	On-Demand	Anodyne	ADRB3	41	42
Cn1cccc1C(=O)NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819028254	FD	On-Demand	Reactive	PAPA1_CARPA	46	45
Cn1cccc1C(=O)NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819028254	FD	On-Demand	Reactive	CTSK	18	41
Cn1cccc1C(=O)NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819028254	FD	On-Demand	Reactive	CTSL	16	45
Cn1cccc1C(=O)NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819028254	FD	On-Demand	Reactive	FPR1	41	37
Cn1cccc1C(=O)NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819028255	FD	On-Demand	Reactive	PAPA1_CARPA	46	45
Cn1cccc1C(=O)NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819028255	FD	On-Demand	Reactive	CTSK	18	41
Cn1cccc1C(=O)NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819028255	FD	On-Demand	Reactive	CTSL	16	45
Cn1cccc1C(=O)NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819028255	FD	On-Demand	Reactive	FPR1	41	37
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1c(F)cccc1F	ZINC000819028256	EF	On-Demand	Anodyne	ADRB1	25	41
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1c(F)cccc1F	ZINC000819028256	EF	On-Demand	Anodyne	DRD4	17	40
O[C@H](CNCCOc1ccc(F)c(F)c1)c1c(F)cccc1F	ZINC000819028258	EF	On-Demand	Anodyne	ADRB1	25	41
O[C@H](CNCCOc1ccc(F)c(F)c1)c1c(F)cccc1F	ZINC000819028258	EF	On-Demand	Anodyne	DRD4	17	40
Cc1cc(F)ccc1[C@@H](O)CNCCCN1CCCCC1=O	ZINC000819028281	DE	On-Demand	Anodyne	LEF	57	34
O=C(C(F)=C1CCC1)N1CCN(Cc2ccc3c(c2)OCCO3)CC1	ZINC000819028287	EF	On-Demand	Anodyne	MCHR1	22	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(F)c(F)c2)cc1	ZINC000819028322	FE	On-Demand	Anodyne	ADRB2	32	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(F)c(F)c2)cc1	ZINC000819028322	FE	On-Demand	Anodyne	ADRB1	39	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(F)c(F)c2)cc1	ZINC000819028322	FE	On-Demand	Anodyne	ADRB3	70	42
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(F)c(F)c2)cc1	ZINC000819028324	FE	On-Demand	Anodyne	ADRB2	32	43
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(F)c(F)c2)cc1	ZINC000819028324	FE	On-Demand	Anodyne	ADRB1	39	42
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(F)c(F)c2)cc1	ZINC000819028324	FE	On-Demand	Anodyne	ADRB3	70	42
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1cccnc1	ZINC000819028357	CE	On-Demand	Anodyne	ADRB2	35	61
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1cccnc1	ZINC000819028357	CE	On-Demand	Anodyne	ADRB1	48	61
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1cccnc1	ZINC000819028357	CE	On-Demand	Anodyne	ADRB3	119	64
O[C@H](CNCCOc1ccc(F)c(F)c1)c1cccnc1	ZINC000819028358	CE	On-Demand	Anodyne	ADRB2	35	61
O[C@H](CNCCOc1ccc(F)c(F)c1)c1cccnc1	ZINC000819028358	CE	On-Demand	Anodyne	ADRB1	48	61
O[C@H](CNCCOc1ccc(F)c(F)c1)c1cccnc1	ZINC000819028358	CE	On-Demand	Anodyne	ADRB3	119	64
COc1cccc([S@@](=O)CC(=O)NNC(=O)C(=O)NC(C)C)c1	ZINC000819028365	EB	On-Demand	Reactive	MTNR1A	30	40
COc1cccc([S@@](=O)CC(=O)NNC(=O)C(=O)NC(C)C)c1	ZINC000819028365	EB	On-Demand	Reactive	MTNR1B	31	40
C[C@H](c1cccc(C#N)c1)N(C)C(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000819028391	GI	On-Demand	Mild	DRD4	34	44
C[C@H](c1cccc(C#N)c1)N(C)C(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000819028391	GI	On-Demand	Mild	ACHE	32	40
C[C@H](c1cccc(C#N)c1)N(C)C(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000819028391	GI	On-Demand	Mild	SIGMAR1	36	46
C[C@H](c1cccc(C#N)c1)N(C)C(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000819028391	GI	On-Demand	Mild	CCR3	22	43
C[C@H](c1cccc(C#N)c1)N(C)C(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000819028391	GI	On-Demand	Mild	MLNR	17	44
C[C@H](c1cccc(C#N)c1)N(C)C(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000819028391	GI	On-Demand	Mild	MCHR1	36	46
O=C1CCCCN1CCCNC[C@H](O)c1cccnc1	ZINC000819028392	CD	On-Demand	Anodyne	ADRB2	33	52
O=C1CCCCN1CCCNC[C@H](O)c1cccnc1	ZINC000819028392	CD	On-Demand	Anodyne	ADRB1	36	52
O=C1CCCCN1CCCNC[C@H](O)c1cccnc1	ZINC000819028392	CD	On-Demand	Anodyne	ADRB3	130	57
C[C@@H](c1cccc(C#N)c1)N(C)C(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000819028393	GI	On-Demand	Mild	DRD4	34	44
C[C@@H](c1cccc(C#N)c1)N(C)C(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000819028393	GI	On-Demand	Mild	ACHE	32	40
C[C@@H](c1cccc(C#N)c1)N(C)C(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000819028393	GI	On-Demand	Mild	SIGMAR1	36	46
C[C@@H](c1cccc(C#N)c1)N(C)C(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000819028393	GI	On-Demand	Mild	CCR3	22	43
C[C@@H](c1cccc(C#N)c1)N(C)C(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000819028393	GI	On-Demand	Mild	MLNR	17	44
C[C@@H](c1cccc(C#N)c1)N(C)C(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000819028393	GI	On-Demand	Mild	MCHR1	36	46
O=C1CCCCN1CCCNC[C@@H](O)c1cccnc1	ZINC000819028394	CD	On-Demand	Anodyne	ADRB2	33	52
O=C1CCCCN1CCCNC[C@@H](O)c1cccnc1	ZINC000819028394	CD	On-Demand	Anodyne	ADRB1	36	52
O=C1CCCCN1CCCNC[C@@H](O)c1cccnc1	ZINC000819028394	CD	On-Demand	Anodyne	ADRB3	130	57
CN1CCC(CNC(=S)Nc2cc(Cl)ccc2OC(F)F)CC1	ZINC000819028409	FH	On-Demand	Anodyne	CACNA1I	57	37
CN1C(=O)CC[C@@H](NC(=S)NC23CC4CC(CC(C4)C2)C3)C1=O	ZINC000819028447	ED	On-Demand	Anodyne	EPHX2	54	38
CN1C(=O)CC[C@H](NC(=S)NC23CC4CC(CC(C4)C2)C3)C1=O	ZINC000819028449	ED	On-Demand	Anodyne	EPHX2	54	38
Cc1cc(F)ccc1[C@@H](O)CNCCOc1ccc(F)c(F)c1	ZINC000819028452	EG	On-Demand	Anodyne	DRD4	15	41
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1	ZINC000819028470	CF	On-Demand	Anodyne	ADRB2	34	45
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1	ZINC000819028470	CF	On-Demand	Anodyne	ADRB1	54	52
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1	ZINC000819028470	CF	On-Demand	Anodyne	DRD4	19	43
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1	ZINC000819028470	CF	On-Demand	Anodyne	ADRB3	64	52
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1	ZINC000819028472	CF	On-Demand	Anodyne	ADRB2	34	45
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1	ZINC000819028472	CF	On-Demand	Anodyne	ADRB1	54	52
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1	ZINC000819028472	CF	On-Demand	Anodyne	DRD4	19	43
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1	ZINC000819028472	CF	On-Demand	Anodyne	ADRB3	64	52
O=C1CCCCN1CCCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819028490	DD	On-Demand	Anodyne	ADRB3	43	40
O=C1CCCCN1CCCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819028492	DD	On-Demand	Anodyne	ADRB3	43	40
CN1C(=O)CC[C@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028508	FD	On-Demand	Anodyne	CHRM2	15	43
CN1C(=O)CC[C@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028508	FD	On-Demand	Anodyne	CHRM1	17	43
CN1C(=O)CC[C@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028508	FD	On-Demand	Anodyne	DRD2	20	48
CN1C(=O)CC[C@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028508	FD	On-Demand	Anodyne	DRD4	49	49
CN1C(=O)CC[C@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028508	FD	On-Demand	Anodyne	ACHE	43	42
CN1C(=O)CC[C@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028508	FD	On-Demand	Anodyne	DRD3	15	48
CN1C(=O)CC[C@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028508	FD	On-Demand	Anodyne	CHRM3	19	43
CN1C(=O)CC[C@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028508	FD	On-Demand	Anodyne	SIGMAR1	59	52
CN1C(=O)CC[C@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028508	FD	On-Demand	Anodyne	SLC6A5	19	40
CN1C(=O)CC[C@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028508	FD	On-Demand	Anodyne	MCHR1	39	45
CN1C(=O)CC[C@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028508	FD	On-Demand	Anodyne	CACNA1G	19	40
CN1C(=O)CC[C@@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028511	FD	On-Demand	Anodyne	CHRM2	15	43
CN1C(=O)CC[C@@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028511	FD	On-Demand	Anodyne	CHRM1	17	43
CN1C(=O)CC[C@@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028511	FD	On-Demand	Anodyne	DRD2	20	48
CN1C(=O)CC[C@@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028511	FD	On-Demand	Anodyne	DRD4	49	49
CN1C(=O)CC[C@@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028511	FD	On-Demand	Anodyne	ACHE	43	42
CN1C(=O)CC[C@@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028511	FD	On-Demand	Anodyne	DRD3	15	48
CN1C(=O)CC[C@@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028511	FD	On-Demand	Anodyne	CHRM3	19	43
CN1C(=O)CC[C@@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028511	FD	On-Demand	Anodyne	SIGMAR1	59	52
CN1C(=O)CC[C@@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028511	FD	On-Demand	Anodyne	SLC6A5	19	40
CN1C(=O)CC[C@@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028511	FD	On-Demand	Anodyne	MCHR1	39	45
CN1C(=O)CC[C@@H](NC(=S)NC2CCN(Cc3ccccc3)CC2)C1=O	ZINC000819028511	FD	On-Demand	Anodyne	CACNA1G	19	40
COC(=O)CCCNC(=S)Nc1cccc(Cc2nc3ccccc3[nH]2)c1	ZINC000819028515	GG	On-Demand	Anodyne	QPCT	43	35
O=C1CCCCN1CCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819028517	DE	On-Demand	Anodyne	ADRB3	41	43
COc1ccc(OC)c([C@H](O)CNCCCN2CCCCC2=O)c1	ZINC000819028531	ED	On-Demand	Anodyne	ADRB2	23	44
COc1ccc(OC)c([C@H](O)CNCCCN2CCCCC2=O)c1	ZINC000819028531	ED	On-Demand	Anodyne	TYRO3	17	40
C[C@@H](c1cccc(C#N)c1)N(C)C(=S)N[C@H](C)Cc1ccccc1	ZINC000819028540	EI	On-Demand	Mild	CTRB_BOVIN	43	30
C[C@@H](c1cccc(C#N)c1)N(C)C(=S)N[C@H](C)Cc1ccccc1	ZINC000819028540	EI	On-Demand	Mild	PTGES	17	42
C[C@@H](Cc1ccccc1)NC(=S)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000819028543	EI	On-Demand	Mild	CTRB_BOVIN	43	30
C[C@@H](Cc1ccccc1)NC(=S)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000819028543	EI	On-Demand	Mild	PTGES	17	42
C[C@@H](Cc1ccccc1)NC(=S)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000819028546	EI	On-Demand	Mild	CTRB_BOVIN	43	30
C[C@@H](Cc1ccccc1)NC(=S)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000819028546	EI	On-Demand	Mild	PTGES	17	42
O[C@H](CNCCOc1ccc(F)c(F)c1)C1CC1	ZINC000819028552	CD	On-Demand	Anodyne	DRD4	15	40
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(CN2CCCC2)cc1	ZINC000819028554	DF	On-Demand	Anodyne	HRH3	19	40
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(CN2CCCC2)cc1	ZINC000819028554	DF	On-Demand	Anodyne	SIGMAR1	18	44
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(CN2CCCC2)cc1	ZINC000819028556	DF	On-Demand	Anodyne	HRH3	19	40
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(CN2CCCC2)cc1	ZINC000819028556	DF	On-Demand	Anodyne	SIGMAR1	18	44
O[C@@H](CNCCOc1ccc(F)c(F)c1)C1CC1	ZINC000819028557	CD	On-Demand	Anodyne	DRD4	15	40
CC[C@@H]1CCCCN1C(=O)COC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819028559	FG	On-Demand	Bother	CPT1A	54	38
CC[C@@H]1CCCCN1C(=O)COC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819028559	FG	On-Demand	Bother	CPT2	40	33
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(CN2CCCC2)cc1	ZINC000819028560	DF	On-Demand	Anodyne	HRH3	19	40
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(CN2CCCC2)cc1	ZINC000819028560	DF	On-Demand	Anodyne	SIGMAR1	18	44
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(CN2CCCC2)cc1	ZINC000819028561	DF	On-Demand	Anodyne	HRH3	19	40
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(CN2CCCC2)cc1	ZINC000819028561	DF	On-Demand	Anodyne	SIGMAR1	18	44
CC[C@H]1CCCCN1C(=O)COC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819028562	FG	On-Demand	Bother	CPT1A	54	38
CC[C@H]1CCCCN1C(=O)COC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819028562	FG	On-Demand	Bother	CPT2	40	33
CN1C[C@@H]2CCCN(C(=S)NCCc3ccc(F)cc3)[C@@H]2C1	ZINC000819028588	DE	On-Demand	Anodyne	CCR3	25	40
CN1C[C@@H]2CCCN(C(=S)NCCc3ccc(F)cc3)[C@@H]2C1	ZINC000819028588	DE	On-Demand	Anodyne	GPBAR1	20	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(CN3CCCC3)cc1)C2	ZINC000819028612	GF	On-Demand	Anodyne	HRH3	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(CN3CCCC3)cc1)C2	ZINC000819028612	GF	On-Demand	Anodyne	SIGMAR1	17	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(CN3CCCC3)cc1)C2	ZINC000819028615	GF	On-Demand	Anodyne	HRH3	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(CN3CCCC3)cc1)C2	ZINC000819028615	GF	On-Demand	Anodyne	SIGMAR1	17	45
COC[C@@H](C)NC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028629	GI	On-Demand	Anodyne	DRD2	19	57
COC[C@@H](C)NC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028629	GI	On-Demand	Anodyne	DRD4	42	43
COC[C@@H](C)NC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028629	GI	On-Demand	Anodyne	ACHE	38	48
COC[C@@H](C)NC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028629	GI	On-Demand	Anodyne	SIGMAR1	46	46
COC[C@@H](C)NC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028629	GI	On-Demand	Anodyne	NPY1R	29	41
COC[C@@H](C)NC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028629	GI	On-Demand	Anodyne	MCHR1	39	57
COC[C@H](C)NC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028639	GI	On-Demand	Anodyne	DRD2	19	57
COC[C@H](C)NC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028639	GI	On-Demand	Anodyne	DRD4	42	43
COC[C@H](C)NC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028639	GI	On-Demand	Anodyne	ACHE	38	48
COC[C@H](C)NC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028639	GI	On-Demand	Anodyne	SIGMAR1	46	46
COC[C@H](C)NC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028639	GI	On-Demand	Anodyne	NPY1R	29	41
COC[C@H](C)NC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028639	GI	On-Demand	Anodyne	MCHR1	39	57
N#Cc1ccc([C@@H](O)CNCCOc2ccccc2C(F)(F)F)cc1	ZINC000819028658	FG	On-Demand	Mild	ADRB1	42	33
N#Cc1ccc([C@H](O)CNCCOc2ccccc2C(F)(F)F)cc1	ZINC000819028661	FG	On-Demand	Mild	ADRB1	42	33
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1Cl	ZINC000819028662	EG	On-Demand	Anodyne	ADRB2	18	42
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1Cl	ZINC000819028662	EG	On-Demand	Anodyne	ADRB1	37	41
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1Cl	ZINC000819028662	EG	On-Demand	Anodyne	DRD4	18	46
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1Cl	ZINC000819028662	EG	On-Demand	Anodyne	ADRB3	30	41
Cn1cc([C@@H]2OCC[C@H]2NC(=S)NCc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000819028675	GC	On-Demand	Anodyne	CA2	46	53
Cn1cc([C@@H]2OCC[C@H]2NC(=S)NCc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000819028675	GC	On-Demand	Anodyne	CA1	44	53
Cn1cc([C@@H]2OCC[C@H]2NC(=S)NCc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000819028675	GC	On-Demand	Anodyne	CA4	25	42
Cn1cc([C@@H]2OCC[C@H]2NC(=S)NCc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000819028675	GC	On-Demand	Anodyne	CA14	38	45
Cn1cc([C@@H]2OCC[C@H]2NC(=S)NCc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000819028675	GC	On-Demand	Anodyne	CA12	39	46
Cn1cc([C@@H]2OCC[C@H]2NC(=S)NCc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000819028675	GC	On-Demand	Anodyne	CA9	41	53
Cn1cc([C@@H]2OCC[C@H]2NC(=S)NCc2ccc(S(N)(=O)=O)cc2)cn1	ZINC000819028675	GC	On-Demand	Anodyne	NAMPT	56	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2CC(C)(c3ccccc3)C2)CC1	ZINC000819028722	GH	On-Demand	Anodyne	CCR8	25	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2CC(C)(c3ccccc3)C2)CC1	ZINC000819028722	GH	On-Demand	Anodyne	GPR119	37	47
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2CC(C)(c3ccccc3)C2)CC1	ZINC000819028722	GH	On-Demand	Anodyne	SFRP1	35	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2CC(C)(c3ccccc3)C2)CC1	ZINC000819028723	GH	On-Demand	Anodyne	CCR8	25	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2CC(C)(c3ccccc3)C2)CC1	ZINC000819028723	GH	On-Demand	Anodyne	GPR119	37	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2CC(C)(c3ccccc3)C2)CC1	ZINC000819028723	GH	On-Demand	Anodyne	SFRP1	35	40
C[C@@H](c1cccc(C#N)c1)N(C)C(=S)NCCCN1CCOCC1	ZINC000819028729	EE	On-Demand	Mild	CASR	37	45
C[C@H](c1cccc(C#N)c1)N(C)C(=S)NCCCN1CCOCC1	ZINC000819028730	EE	On-Demand	Mild	CASR	37	45
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ccccc2C(F)(F)F)c1	ZINC000819028732	FG	On-Demand	Bother	ADRB1	31	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ccccc2C(F)(F)F)c1	ZINC000819028732	FG	On-Demand	Bother	ADRB3	37	41
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ccccc2C(F)(F)F)c1	ZINC000819028733	FG	On-Demand	Bother	ADRB1	31	41
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ccccc2C(F)(F)F)c1	ZINC000819028733	FG	On-Demand	Bother	ADRB3	37	41
C[C@@H](c1cccc(C#N)c1)N(C)C(=S)NC12CC3CC(CC(C3)C1)C2	ZINC000819028740	FI	On-Demand	Mild	EPHX2	18	40
C[C@H](c1cccc(C#N)c1)N(C)C(=S)NC12CC3CC(CC(C3)C1)C2	ZINC000819028741	FI	On-Demand	Mild	EPHX2	18	40
S=C(NCCN1CCOCC1)Nc1cccc(Cc2nc3ccccc3[nH]2)c1	ZINC000819028777	GF	On-Demand	Anodyne	CASR	33	44
S=C(NCCN1CCOCC1)Nc1cccc(Cc2nc3ccccc3[nH]2)c1	ZINC000819028777	GF	On-Demand	Anodyne	EPHX2	15	41
O=C(CSc1ccccc1[N+](=O)[O-])OCc1ccccc1Cl	ZINC000819028796	EI	On-Demand	Bother	COLA	87	39
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2ccc3c(c2)OCCO3)CC1	ZINC000819028807	FD	On-Demand	Anodyne	MCHR1	27	43
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2ccc3c(c2)OCCO3)CC1	ZINC000819028808	FD	On-Demand	Anodyne	MCHR1	27	43
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2ccc3c(c2)OCCO3)CC1	ZINC000819028809	FD	On-Demand	Anodyne	MCHR1	27	43
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2ccc3c(c2)OCCO3)CC1	ZINC000819028810	FD	On-Demand	Anodyne	MCHR1	27	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ccncc3)CC1)C2	ZINC000819028814	FD	On-Demand	Anodyne	SSTR1	46	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ccncc3)CC1)C2	ZINC000819028814	FD	On-Demand	Anodyne	ADAM10	37	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ccncc3)CC1)C2	ZINC000819028814	FD	On-Demand	Anodyne	NPBWR1	46	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ccncc3)CC1)C2	ZINC000819028815	FD	On-Demand	Anodyne	SSTR1	46	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ccncc3)CC1)C2	ZINC000819028815	FD	On-Demand	Anodyne	ADAM10	37	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ccncc3)CC1)C2	ZINC000819028815	FD	On-Demand	Anodyne	NPBWR1	46	32
CCOCCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028829	GI	On-Demand	Anodyne	DRD2	18	52
CCOCCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028829	GI	On-Demand	Anodyne	DRD4	41	43
CCOCCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028829	GI	On-Demand	Anodyne	ACHE	44	55
CCOCCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028829	GI	On-Demand	Anodyne	HRH2	42	39
CCOCCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028829	GI	On-Demand	Anodyne	DRD3	15	43
CCOCCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028829	GI	On-Demand	Anodyne	SIGMAR1	45	48
CCOCCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028829	GI	On-Demand	Anodyne	NPY1R	29	45
CCOCCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028829	GI	On-Demand	Anodyne	MCHR1	39	52
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819028832	FH	On-Demand	Anodyne	ADRB2	16	40
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819028832	FH	On-Demand	Anodyne	ADRB1	35	43
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819028832	FH	On-Demand	Anodyne	ADRB3	40	43
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819028832	FH	On-Demand	Anodyne	PDS	40	36
O[C@H](CNCCOc1ccc(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819028833	FH	On-Demand	Anodyne	ADRB2	16	40
O[C@H](CNCCOc1ccc(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819028833	FH	On-Demand	Anodyne	ADRB1	35	43
O[C@H](CNCCOc1ccc(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819028833	FH	On-Demand	Anodyne	ADRB3	40	43
O[C@H](CNCCOc1ccc(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819028833	FH	On-Demand	Anodyne	PDS	40	36
NC(=O)CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028841	GF	On-Demand	Anodyne	DRD2	21	55
NC(=O)CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028841	GF	On-Demand	Anodyne	DRD4	50	48
NC(=O)CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028841	GF	On-Demand	Anodyne	ACHE	46	53
NC(=O)CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028841	GF	On-Demand	Anodyne	DRD3	15	47
NC(=O)CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028841	GF	On-Demand	Anodyne	SIGMAR1	51	49
NC(=O)CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028841	GF	On-Demand	Anodyne	NPY1R	30	45
NC(=O)CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028841	GF	On-Demand	Anodyne	CCR3	54	43
NC(=O)CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028841	GF	On-Demand	Anodyne	NPFFR2	41	42
NC(=O)CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028841	GF	On-Demand	Anodyne	SLC18A3	40	39
NC(=O)CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028841	GF	On-Demand	Anodyne	MCHR1	47	55
NC(=O)CNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819028841	GF	On-Demand	Anodyne	NPFFR1	51	42
O=C1CCCCN1CCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819028842	FF	On-Demand	Anodyne	ADRB3	42	40
O=C1CCCCN1CCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819028843	FF	On-Demand	Anodyne	ADRB3	42	40
FC(F)Oc1ccc(Cl)cc1NC(=S)NCCN1CCOCC1	ZINC000819028863	FF	On-Demand	Anodyne	EPHX2	17	45
C[C@H](NC(=S)N1CCC[C@H]2CN(C)C[C@H]21)c1ccccc1	ZINC000819028924	DF	On-Demand	Anodyne	XIAP	48	38
C[C@H](NC(=S)N1CCC[C@H]2CN(C)C[C@H]21)c1ccccc1	ZINC000819028924	DF	On-Demand	Anodyne	BIRC8	48	35
C[C@@H](NC(=S)N1CCC[C@H]2CN(C)C[C@H]21)c1ccccc1	ZINC000819028925	DF	On-Demand	Anodyne	XIAP	48	38
C[C@@H](NC(=S)N1CCC[C@H]2CN(C)C[C@H]21)c1ccccc1	ZINC000819028925	DF	On-Demand	Anodyne	BIRC8	48	35
C[C@H](NC(=S)N[C@@H]1CCC(=O)N(C)C1=O)c1ccccc1	ZINC000819028930	DD	On-Demand	Anodyne	BIRC8	59	37
C[C@H](NC(=S)N[C@H]1CCC(=O)N(C)C1=O)c1ccccc1	ZINC000819028931	DD	On-Demand	Anodyne	BIRC8	59	37
C[C@@H](NC(=S)N[C@H]1CCC(=O)N(C)C1=O)c1ccccc1	ZINC000819028932	DD	On-Demand	Anodyne	BIRC8	59	37
C[C@@H](NC(=S)N[C@@H]1CCC(=O)N(C)C1=O)c1ccccc1	ZINC000819028933	DD	On-Demand	Anodyne	BIRC8	59	37
O[C@@H](CNCC1(c2ccccc2Cl)CCOCC1)c1cccc(Cl)c1	ZINC000819028953	GI	On-Demand	Anodyne	ADRB1	27	42
O[C@@H](CNCC1(c2ccccc2Cl)CCOCC1)c1cccc(Cl)c1	ZINC000819028953	GI	On-Demand	Anodyne	ADRB3	40	42
O[C@H](CNCC1(c2ccccc2Cl)CCOCC1)c1cccc(Cl)c1	ZINC000819028954	GI	On-Demand	Anodyne	ADRB1	27	42
O[C@H](CNCC1(c2ccccc2Cl)CCOCC1)c1cccc(Cl)c1	ZINC000819028954	GI	On-Demand	Anodyne	ADRB3	40	42
COCCNC(=S)Nc1ccc(Cl)c(I)c1	ZINC000819028977	FF	On-Demand	Anodyne	QPCT	40	37
CN1C(=O)CC[C@@H](NC(=S)NCc2ccccc2)C1=O	ZINC000819028984	CC	On-Demand	Anodyne	ACE	32	43
CN1C(=O)CC[C@@H](NC(=S)NCc2ccccc2)C1=O	ZINC000819028984	CC	On-Demand	Anodyne	MME	22	43
CN1C(=O)CC[C@@H](NC(=S)NCc2ccccc2)C1=O	ZINC000819028984	CC	On-Demand	Anodyne	SSTR4	40	33
CN1C(=O)CC[C@@H](NC(=S)NCc2ccccc2)C1=O	ZINC000819028984	CC	On-Demand	Anodyne	P2RX7	18	46
CN1C(=O)CC[C@H](NC(=S)NCc2ccccc2)C1=O	ZINC000819028985	CC	On-Demand	Anodyne	ACE	32	43
CN1C(=O)CC[C@H](NC(=S)NCc2ccccc2)C1=O	ZINC000819028985	CC	On-Demand	Anodyne	MME	22	43
CN1C(=O)CC[C@H](NC(=S)NCc2ccccc2)C1=O	ZINC000819028985	CC	On-Demand	Anodyne	SSTR4	40	33
CN1C(=O)CC[C@H](NC(=S)NCc2ccccc2)C1=O	ZINC000819028985	CC	On-Demand	Anodyne	P2RX7	18	46
O=C(CSc1ccccc1[N+](=O)[O-])OCC1CCCCC1	ZINC000819028987	DH	On-Demand	Bother	GSTM2	20	40
O=C(CSc1ccccc1[N+](=O)[O-])OCC1CCCCC1	ZINC000819028987	DH	On-Demand	Bother	AMY2	43	30
CCN1CCC[C@@H]1CNC(=S)Nc1cc(Cl)ccc1OC(F)F	ZINC000819028988	FH	On-Demand	Anodyne	DRD2	33	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOC1	ZINC000819029005	FE	On-Demand	Anodyne	CTSD	117	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOC1	ZINC000819029005	FE	On-Demand	Anodyne	PGC	73	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOC1	ZINC000819029005	FE	On-Demand	Anodyne	CMA1	30	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOC1	ZINC000819029005	FE	On-Demand	Anodyne	CTRA_BOVIN	15	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOC1	ZINC000819029005	FE	On-Demand	Anodyne	PAPA1_CARPA	29	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOC1	ZINC000819029005	FE	On-Demand	Anodyne	BACE2	49	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOC1	ZINC000819029005	FE	On-Demand	Anodyne	REN	113	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOC1	ZINC000819029005	FE	On-Demand	Anodyne	REN1	31	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOC1	ZINC000819029005	FE	On-Demand	Anodyne	CTSE	43	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOC1	ZINC000819029005	FE	On-Demand	Anodyne	BACE1	83	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOC1	ZINC000819029005	FE	On-Demand	Anodyne	FPR1	50	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOC1	ZINC000819029005	FE	On-Demand	Anodyne	PLM1_PLAFA	33	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOC1	ZINC000819029006	FE	On-Demand	Anodyne	CTSD	117	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOC1	ZINC000819029006	FE	On-Demand	Anodyne	PGC	73	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOC1	ZINC000819029006	FE	On-Demand	Anodyne	CMA1	30	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOC1	ZINC000819029006	FE	On-Demand	Anodyne	CTRA_BOVIN	15	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOC1	ZINC000819029006	FE	On-Demand	Anodyne	PAPA1_CARPA	29	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOC1	ZINC000819029006	FE	On-Demand	Anodyne	BACE2	49	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOC1	ZINC000819029006	FE	On-Demand	Anodyne	REN	113	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOC1	ZINC000819029006	FE	On-Demand	Anodyne	REN1	31	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOC1	ZINC000819029006	FE	On-Demand	Anodyne	CTSE	43	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOC1	ZINC000819029006	FE	On-Demand	Anodyne	BACE1	83	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOC1	ZINC000819029006	FE	On-Demand	Anodyne	FPR1	50	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOC1	ZINC000819029006	FE	On-Demand	Anodyne	PLM1_PLAFA	33	41
CN(C)CCCNC(=S)Nc1cccc(Cc2nc3ccccc3[nH]2)c1	ZINC000819029015	FG	On-Demand	Anodyne	QPCT	48	36
CN(C)CCCNC(=S)Nc1cccc(Cc2nc3ccccc3[nH]2)c1	ZINC000819029015	FG	On-Demand	Anodyne	ALKBH3	40	36
O[C@@H](CNCCOc1ccccc1C(F)(F)F)c1cccnc1	ZINC000819029033	EF	On-Demand	Anodyne	ADRB2	29	55
O[C@@H](CNCCOc1ccccc1C(F)(F)F)c1cccnc1	ZINC000819029033	EF	On-Demand	Anodyne	ADRB1	38	58
O[C@@H](CNCCOc1ccccc1C(F)(F)F)c1cccnc1	ZINC000819029033	EF	On-Demand	Anodyne	ADRB3	108	58
O[C@H](CNCCOc1ccccc1C(F)(F)F)c1cccnc1	ZINC000819029034	EF	On-Demand	Anodyne	ADRB2	29	55
O[C@H](CNCCOc1ccccc1C(F)(F)F)c1cccnc1	ZINC000819029034	EF	On-Demand	Anodyne	ADRB1	38	58
O[C@H](CNCCOc1ccccc1C(F)(F)F)c1cccnc1	ZINC000819029034	EF	On-Demand	Anodyne	ADRB3	108	58
O=C(CSc1ccccc1[N+](=O)[O-])OCc1ccc(Cl)cc1	ZINC000819029080	EI	On-Demand	Bother	GSTM2	41	36
CN(CC(=O)N1CCOCC1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819029083	GC	On-Demand	Mild	PAPA1_CARPA	31	40
CN(CC(=O)N1CCOCC1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819029084	GC	On-Demand	Mild	PAPA1_CARPA	31	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCN2CCCCC2=O)CC1	ZINC000819029107	GD	On-Demand	Anodyne	GPR119	28	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCN2CCCCC2=O)CC1	ZINC000819029108	GD	On-Demand	Anodyne	GPR119	28	42
O=C1CCCCN1CCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819029147	DD	On-Demand	Bother	ADRB3	61	37
O=C1CCCCN1CCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819029148	DD	On-Demand	Bother	ADRB3	61	37
O=C1CCCCN1CCCNC[C@H](O)c1ccc(Br)cc1	ZINC000819029191	FE	On-Demand	Anodyne	ADRB2	20	41
O=C1CCCCN1CCCNC[C@@H](O)c1ccc(Br)cc1	ZINC000819029192	FE	On-Demand	Anodyne	ADRB2	20	41
O=C1CCCCN1CCCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819029196	EF	On-Demand	Anodyne	ADRB3	56	42
O=C1CCCCN1CCCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819029198	EF	On-Demand	Anodyne	ADRB3	56	42
C[C@@H](c1cccc(C#N)c1)N(C)C(=S)NCCN1CCOCC1	ZINC000819029199	ED	On-Demand	Mild	CASR	42	46
C[C@H](c1cccc(C#N)c1)N(C)C(=S)NCCN1CCOCC1	ZINC000819029203	ED	On-Demand	Mild	CASR	42	46
C#CCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819029205	FH	On-Demand	Mild	DRD2	19	56
C#CCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819029205	FH	On-Demand	Mild	DRD4	46	46
C#CCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819029205	FH	On-Demand	Mild	ACHE	44	54
C#CCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819029205	FH	On-Demand	Mild	DRD3	16	43
C#CCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819029205	FH	On-Demand	Mild	SIGMAR1	49	49
C#CCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819029205	FH	On-Demand	Mild	NPY1R	16	43
C#CCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819029205	FH	On-Demand	Mild	CCR3	34	41
C#CCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819029205	FH	On-Demand	Mild	MCHR1	39	53
O=C(CSc1ccccc1[N+](=O)[O-])OCc1ccccc1F	ZINC000819029215	DH	On-Demand	Bother	COLA	91	39
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819029218	FH	On-Demand	Anodyne	ADRB1	21	41
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819029218	FH	On-Demand	Anodyne	ADRB3	25	41
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819029220	FH	On-Demand	Anodyne	ADRB1	21	41
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819029220	FH	On-Demand	Anodyne	ADRB3	25	41
CN1C(=O)CC[C@@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000819029247	FB	On-Demand	Anodyne	CA2	62	54
CN1C(=O)CC[C@@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000819029247	FB	On-Demand	Anodyne	CA1	56	54
CN1C(=O)CC[C@@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000819029247	FB	On-Demand	Anodyne	CA7	33	42
CN1C(=O)CC[C@@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000819029247	FB	On-Demand	Anodyne	CA4	33	43
CN1C(=O)CC[C@@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000819029247	FB	On-Demand	Anodyne	CA14	44	45
CN1C(=O)CC[C@@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000819029247	FB	On-Demand	Anodyne	CA12	49	46
CN1C(=O)CC[C@@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000819029247	FB	On-Demand	Anodyne	CA9	51	54
CN1C(=O)CC[C@@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000819029247	FB	On-Demand	Anodyne	CYNT	18	41
CN1C(=O)CC[C@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000819029248	FB	On-Demand	Anodyne	CA2	62	54
CN1C(=O)CC[C@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000819029248	FB	On-Demand	Anodyne	CA1	56	54
CN1C(=O)CC[C@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000819029248	FB	On-Demand	Anodyne	CA7	33	42
CN1C(=O)CC[C@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000819029248	FB	On-Demand	Anodyne	CA4	33	43
CN1C(=O)CC[C@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000819029248	FB	On-Demand	Anodyne	CA14	44	45
CN1C(=O)CC[C@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000819029248	FB	On-Demand	Anodyne	CA12	49	46
CN1C(=O)CC[C@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000819029248	FB	On-Demand	Anodyne	CA9	51	54
CN1C(=O)CC[C@H](NC(=S)NCc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000819029248	FB	On-Demand	Anodyne	CYNT	18	41
CN1C(=O)CC[C@H](NC(=S)Nc2cccc(Br)c2)C1=O	ZINC000819029279	FD	On-Demand	Anodyne	CCKAR	25	41
CN1C(=O)CC[C@H](NC(=S)Nc2cccc(Br)c2)C1=O	ZINC000819029279	FD	On-Demand	Anodyne	CCKBR	36	41
CN1C(=O)CC[C@@H](NC(=S)Nc2cccc(Br)c2)C1=O	ZINC000819029280	FD	On-Demand	Anodyne	CCKAR	25	41
CN1C(=O)CC[C@@H](NC(=S)Nc2cccc(Br)c2)C1=O	ZINC000819029280	FD	On-Demand	Anodyne	CCKBR	36	41
CN1C(=O)CC[C@@H](NC(=S)NCCc2cccnc2)C1=O	ZINC000819029289	DC	On-Demand	Anodyne	CHRNA7	43	36
CN1C(=O)CC[C@H](NC(=S)NCCc2cccnc2)C1=O	ZINC000819029290	DC	On-Demand	Anodyne	CHRNA7	43	36
COc1ccc(N2CCN(C(=O)COC(=O)CSc3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000819029298	IF	On-Demand	Clean	SSTR1	41	42
NS(=O)(=O)c1ccc(NC(=O)C2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819029323	GD	On-Demand	Anodyne	CA2	53	44
NS(=O)(=O)c1ccc(NC(=O)C2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819029323	GD	On-Demand	Anodyne	CA1	47	44
NS(=O)(=O)c1ccc(NC(=O)C2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819029323	GD	On-Demand	Anodyne	CA4	44	43
NS(=O)(=O)c1ccc(NC(=O)C2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819029323	GD	On-Demand	Anodyne	EPHX2	27	42
NS(=O)(=O)c1ccc(NC(=O)C2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819029323	GD	On-Demand	Anodyne	CA12	40	36
NS(=O)(=O)c1ccc(NC(=O)C2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819029323	GD	On-Demand	Anodyne	CA9	39	44
NS(=O)(=O)c1ccc(NC(=O)C2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819029323	GD	On-Demand	Anodyne	MTCA1	47	44
NS(=O)(=O)c1ccc(NC(=O)C2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819029323	GD	On-Demand	Anodyne	P96878_MYCTU	59	44
Cn1cc([C@@H]2OCC[C@H]2NC(=S)Nc2ccc3c(c2)OCO3)cn1	ZINC000819029327	ED	On-Demand	Anodyne	QPCT	19	46
CON(C)C(=O)CCNCCOc1ccc(F)c(F)c1	ZINC000819029359	CD	On-Demand	Anodyne	DRD4	17	40
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1cccc(F)c1	ZINC000819029362	DF	On-Demand	Anodyne	ADRB2	26	41
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1cccc(F)c1	ZINC000819029362	DF	On-Demand	Anodyne	ADRB1	41	45
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1cccc(F)c1	ZINC000819029362	DF	On-Demand	Anodyne	DRD4	17	40
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1cccc(F)c1	ZINC000819029362	DF	On-Demand	Anodyne	ADRB3	48	45
O[C@H](CNCCOc1ccc(F)c(F)c1)c1cccc(F)c1	ZINC000819029363	DF	On-Demand	Anodyne	ADRB2	26	41
O[C@H](CNCCOc1ccc(F)c(F)c1)c1cccc(F)c1	ZINC000819029363	DF	On-Demand	Anodyne	ADRB1	41	45
O[C@H](CNCCOc1ccc(F)c(F)c1)c1cccc(F)c1	ZINC000819029363	DF	On-Demand	Anodyne	DRD4	17	40
O[C@H](CNCCOc1ccc(F)c(F)c1)c1cccc(F)c1	ZINC000819029363	DF	On-Demand	Anodyne	ADRB3	48	45
O=C1CCCCN1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819029388	DE	On-Demand	Anodyne	ADRB2	60	39
O=C1CCCCN1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819029388	DE	On-Demand	Anodyne	ADRB1	65	50
O=C1CCCCN1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819029388	DE	On-Demand	Anodyne	ADRB3	103	50
O=C1CCCCN1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819029388	DE	On-Demand	Anodyne	TYRO3	19	42
O=C1CCCCN1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819029389	DE	On-Demand	Anodyne	ADRB2	60	39
O=C1CCCCN1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819029389	DE	On-Demand	Anodyne	ADRB1	65	50
O=C1CCCCN1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819029389	DE	On-Demand	Anodyne	ADRB3	103	50
O=C1CCCCN1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819029389	DE	On-Demand	Anodyne	TYRO3	19	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCOc2ccc(F)c(F)c2)cc1	ZINC000819029390	EF	On-Demand	Bother	ADRB1	22	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCOc2ccc(F)c(F)c2)cc1	ZINC000819029390	EF	On-Demand	Bother	ADRB3	25	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCOc2ccc(F)c(F)c2)cc1	ZINC000819029390	EF	On-Demand	Bother	ACR	15	40
O=[N+]([O-])c1ccc([C@H](O)CNCCOc2ccc(F)c(F)c2)cc1	ZINC000819029391	EF	On-Demand	Bother	ADRB1	22	42
O=[N+]([O-])c1ccc([C@H](O)CNCCOc2ccc(F)c(F)c2)cc1	ZINC000819029391	EF	On-Demand	Bother	ADRB3	25	42
O=[N+]([O-])c1ccc([C@H](O)CNCCOc2ccc(F)c(F)c2)cc1	ZINC000819029391	EF	On-Demand	Bother	ACR	15	40
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819029392	EG	On-Demand	Anodyne	ADRB2	21	40
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819029392	EG	On-Demand	Anodyne	ADRB1	32	43
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819029392	EG	On-Demand	Anodyne	ADRB3	34	43
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819029393	EG	On-Demand	Anodyne	ADRB2	21	40
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819029393	EG	On-Demand	Anodyne	ADRB1	32	43
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819029393	EG	On-Demand	Anodyne	ADRB3	34	43
CCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819029437	FI	On-Demand	Anodyne	DRD2	26	59
CCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819029437	FI	On-Demand	Anodyne	DRD4	56	48
CCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819029437	FI	On-Demand	Anodyne	ACHE	49	57
CCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819029437	FI	On-Demand	Anodyne	DRD3	20	45
CCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819029437	FI	On-Demand	Anodyne	SIGMAR1	65	55
CCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819029437	FI	On-Demand	Anodyne	NPY1R	26	43
CCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819029437	FI	On-Demand	Anodyne	CCR3	39	41
CCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819029437	FI	On-Demand	Anodyne	CCR5	19	44
CCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819029437	FI	On-Demand	Anodyne	SLC18A3	44	41
CCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819029437	FI	On-Demand	Anodyne	MCHR1	45	56
CCNC(=S)Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1	ZINC000819029437	FI	On-Demand	Anodyne	MGEA5	26	40
CN1C[C@@H]2CCCN(C(=S)NCCc3ccccc3)[C@@H]2C1	ZINC000819029445	DE	On-Demand	Anodyne	SIGMAR1	15	40
CN1C[C@@H]2CCCN(C(=S)NCCc3ccccc3)[C@@H]2C1	ZINC000819029445	DE	On-Demand	Anodyne	PREP	46	34
CN1C[C@@H]2CCCN(C(=S)NC3CCN(Cc4ccccc4)CC3)[C@@H]2C1	ZINC000819029453	FF	On-Demand	Anodyne	DRD2	19	46
CN1C[C@@H]2CCCN(C(=S)NC3CCN(Cc4ccccc4)CC3)[C@@H]2C1	ZINC000819029453	FF	On-Demand	Anodyne	DRD4	46	46
CN1C[C@@H]2CCCN(C(=S)NC3CCN(Cc4ccccc4)CC3)[C@@H]2C1	ZINC000819029453	FF	On-Demand	Anodyne	ACHE	40	43
CN1C[C@@H]2CCCN(C(=S)NC3CCN(Cc4ccccc4)CC3)[C@@H]2C1	ZINC000819029453	FF	On-Demand	Anodyne	DRD3	15	46
CN1C[C@@H]2CCCN(C(=S)NC3CCN(Cc4ccccc4)CC3)[C@@H]2C1	ZINC000819029453	FF	On-Demand	Anodyne	CHRM3	15	44
CN1C[C@@H]2CCCN(C(=S)NC3CCN(Cc4ccccc4)CC3)[C@@H]2C1	ZINC000819029453	FF	On-Demand	Anodyne	SIGMAR1	57	50
CN1C[C@@H]2CCCN(C(=S)NC3CCN(Cc4ccccc4)CC3)[C@@H]2C1	ZINC000819029453	FF	On-Demand	Anodyne	CCR3	20	41
CN1C[C@@H]2CCCN(C(=S)NC3CCN(Cc4ccccc4)CC3)[C@@H]2C1	ZINC000819029453	FF	On-Demand	Anodyne	MCHR1	31	46
CN1C(=O)CC[C@@H](NC(=S)NCCc2ccc(Cl)cc2Cl)C1=O	ZINC000819029455	FE	On-Demand	Anodyne	CNR1	16	40
CN1C(=O)CC[C@@H](NC(=S)NCCc2ccc(Cl)cc2Cl)C1=O	ZINC000819029455	FE	On-Demand	Anodyne	P2RX7	54	50
CN1C(=O)CC[C@@H](NC(=S)NCCc2ccc(Cl)cc2Cl)C1=O	ZINC000819029455	FE	On-Demand	Anodyne	MC5R	19	42
CN1C(=O)CC[C@H](NC(=S)NCCc2ccc(Cl)cc2Cl)C1=O	ZINC000819029456	FE	On-Demand	Anodyne	CNR1	16	40
CN1C(=O)CC[C@H](NC(=S)NCCc2ccc(Cl)cc2Cl)C1=O	ZINC000819029456	FE	On-Demand	Anodyne	P2RX7	54	50
CN1C(=O)CC[C@H](NC(=S)NCCc2ccc(Cl)cc2Cl)C1=O	ZINC000819029456	FE	On-Demand	Anodyne	MC5R	19	42
CN1C(=O)CC[C@@H](NC(=S)NCc2cccc(C(F)(F)F)c2)C1=O	ZINC000819029488	FD	On-Demand	Anodyne	P2RX7	20	54
CN1C(=O)CC[C@@H](NC(=S)NCc2cccc(C(F)(F)F)c2)C1=O	ZINC000819029488	FD	On-Demand	Anodyne	CCR2	75	39
CN1C(=O)CC[C@H](NC(=S)NCc2cccc(C(F)(F)F)c2)C1=O	ZINC000819029489	FD	On-Demand	Anodyne	P2RX7	20	54
CN1C(=O)CC[C@H](NC(=S)NCc2cccc(C(F)(F)F)c2)C1=O	ZINC000819029489	FD	On-Demand	Anodyne	CCR2	75	39
C[C@@H](Cc1ccccc1)NC(=S)N1CCC[C@H]2CN(C)C[C@H]21	ZINC000819029493	DF	On-Demand	Anodyne	ACE	44	41
C[C@@H](Cc1ccccc1)NC(=S)N1CCC[C@H]2CN(C)C[C@H]21	ZINC000819029493	DF	On-Demand	Anodyne	MME	23	41
C[C@@H](Cc1ccccc1)NC(=S)N1CCC[C@H]2CN(C)C[C@H]21	ZINC000819029493	DF	On-Demand	Anodyne	XIAP	42	40
C[C@@H](Cc1ccccc1)NC(=S)N1CCC[C@H]2CN(C)C[C@H]21	ZINC000819029493	DF	On-Demand	Anodyne	BIRC2	36	40
C[C@@H](Cc1ccccc1)NC(=S)N1CCC[C@H]2CN(C)C[C@H]21	ZINC000819029493	DF	On-Demand	Anodyne	BRCA1	44	31
C#Cc1cccc(NC(=S)N[C@@H]2CCC(=O)N(C)C2=O)c1	ZINC000819029504	DD	On-Demand	Mild	CCKBR	19	44
C#Cc1cccc(NC(=S)N[C@H]2CCC(=O)N(C)C2=O)c1	ZINC000819029505	DD	On-Demand	Mild	CCKBR	19	44
CN1C(=O)CC[C@H](NC(=S)Nc2cccc(Cl)c2)C1=O	ZINC000819029507	DD	On-Demand	Anodyne	CCKAR	28	41
CN1C(=O)CC[C@H](NC(=S)Nc2cccc(Cl)c2)C1=O	ZINC000819029507	DD	On-Demand	Anodyne	CCKBR	38	41
CN1C(=O)CC[C@@H](NC(=S)Nc2cccc(Cl)c2)C1=O	ZINC000819029508	DD	On-Demand	Anodyne	CCKAR	28	41
CN1C(=O)CC[C@@H](NC(=S)Nc2cccc(Cl)c2)C1=O	ZINC000819029508	DD	On-Demand	Anodyne	CCKBR	38	41
CN1C(=O)CC[C@H](NC(=S)Nc2cccc(C(F)(F)F)c2)C1=O	ZINC000819029535	EE	On-Demand	Anodyne	CCKAR	21	44
CN1C(=O)CC[C@H](NC(=S)Nc2cccc(C(F)(F)F)c2)C1=O	ZINC000819029535	EE	On-Demand	Anodyne	CCKBR	27	44
CN1C(=O)CC[C@H](NC(=S)Nc2cccc(C(F)(F)F)c2)C1=O	ZINC000819029535	EE	On-Demand	Anodyne	EPHX2	20	48
CN1C(=O)CC[C@@H](NC(=S)Nc2cccc(C(F)(F)F)c2)C1=O	ZINC000819029536	EE	On-Demand	Anodyne	CCKAR	21	44
CN1C(=O)CC[C@@H](NC(=S)Nc2cccc(C(F)(F)F)c2)C1=O	ZINC000819029536	EE	On-Demand	Anodyne	CCKBR	27	44
CN1C(=O)CC[C@@H](NC(=S)Nc2cccc(C(F)(F)F)c2)C1=O	ZINC000819029536	EE	On-Demand	Anodyne	EPHX2	20	48
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819029548	FH	On-Demand	Anodyne	ADRB1	24	40
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819029548	FH	On-Demand	Anodyne	ADRB3	22	40
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819029549	FH	On-Demand	Anodyne	ADRB1	24	40
O[C@H](CNCCOc1ccc(F)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819029549	FH	On-Demand	Anodyne	ADRB3	22	40
O=C1CCCCN1CCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819029552	EF	On-Demand	Anodyne	ADRB3	36	40
O=C1CCCCN1CCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819029553	EF	On-Demand	Anodyne	ADRB3	36	40
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1cc(F)ccc1F	ZINC000819029554	EF	On-Demand	Anodyne	DRD4	15	45
O[C@H](CNCCOc1ccc(F)c(F)c1)c1cc(F)ccc1F	ZINC000819029555	EF	On-Demand	Anodyne	DRD4	15	45
O=C1CCCCN1CCCNC[C@H](O)c1ccccc1	ZINC000819029566	CD	On-Demand	Anodyne	ADRB2	39	45
O=C1CCCCN1CCCNC[C@H](O)c1ccccc1	ZINC000819029566	CD	On-Demand	Anodyne	ADRB1	40	39
O=C1CCCCN1CCCNC[C@H](O)c1ccccc1	ZINC000819029566	CD	On-Demand	Anodyne	ADRB3	93	43
O=C1CCCCN1CCCNC[C@@H](O)c1ccccc1	ZINC000819029567	CD	On-Demand	Anodyne	ADRB2	39	45
O=C1CCCCN1CCCNC[C@@H](O)c1ccccc1	ZINC000819029567	CD	On-Demand	Anodyne	ADRB1	40	39
O=C1CCCCN1CCCNC[C@@H](O)c1ccccc1	ZINC000819029567	CD	On-Demand	Anodyne	ADRB3	93	43
O=C1CCCCN1CCCNC[C@H](O)c1ccccc1Cl	ZINC000819029575	DE	On-Demand	Anodyne	OPRL1	17	42
O=C1CCCCN1CCCNC[C@H](O)c1ccccc1Cl	ZINC000819029575	DE	On-Demand	Anodyne	TYRO3	18	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ccc(F)c(F)c2)c1	ZINC000819029582	EF	On-Demand	Bother	ADRB1	36	45
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ccc(F)c(F)c2)c1	ZINC000819029582	EF	On-Demand	Bother	ADRB3	44	45
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ccc(F)c(F)c2)c1	ZINC000819029583	EF	On-Demand	Bother	ADRB1	36	45
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ccc(F)c(F)c2)c1	ZINC000819029583	EF	On-Demand	Bother	ADRB3	44	45
S=C(Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1)NC1CC1	ZINC000819029588	FJ	On-Demand	Anodyne	DRD2	22	59
S=C(Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1)NC1CC1	ZINC000819029588	FJ	On-Demand	Anodyne	DRD4	53	57
S=C(Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1)NC1CC1	ZINC000819029588	FJ	On-Demand	Anodyne	ACHE	41	54
S=C(Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1)NC1CC1	ZINC000819029588	FJ	On-Demand	Anodyne	DRD3	19	57
S=C(Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1)NC1CC1	ZINC000819029588	FJ	On-Demand	Anodyne	CHRM3	15	40
S=C(Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1)NC1CC1	ZINC000819029588	FJ	On-Demand	Anodyne	SIGMAR1	56	49
S=C(Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1)NC1CC1	ZINC000819029588	FJ	On-Demand	Anodyne	NPY1R	22	41
S=C(Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1)NC1CC1	ZINC000819029588	FJ	On-Demand	Anodyne	CCR3	38	41
S=C(Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1)NC1CC1	ZINC000819029588	FJ	On-Demand	Anodyne	SLC18A3	42	41
S=C(Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1)NC1CC1	ZINC000819029588	FJ	On-Demand	Anodyne	CXCR3	15	40
S=C(Nc1cccc(C2CCN(Cc3ccccc3)CC2)c1)NC1CC1	ZINC000819029588	FJ	On-Demand	Anodyne	MCHR1	53	53
COc1ccc(OC)c([C@H](O)CNCCOc2ccc(F)c(F)c2)c1	ZINC000819029608	FF	On-Demand	Anodyne	ADRB2	19	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCCN2CCCCC2=O)cc1	ZINC000819029627	FD	On-Demand	Anodyne	ADRB2	31	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCCN2CCCCC2=O)cc1	ZINC000819029627	FD	On-Demand	Anodyne	ADRB1	18	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCCN2CCCCC2=O)cc1	ZINC000819029627	FD	On-Demand	Anodyne	ADRB3	64	41
CS(=O)(=O)c1ccc([C@H](O)CNCCCN2CCCCC2=O)cc1	ZINC000819029628	FD	On-Demand	Anodyne	ADRB2	31	42
CS(=O)(=O)c1ccc([C@H](O)CNCCCN2CCCCC2=O)cc1	ZINC000819029628	FD	On-Demand	Anodyne	ADRB1	18	40
CS(=O)(=O)c1ccc([C@H](O)CNCCCN2CCCCC2=O)cc1	ZINC000819029628	FD	On-Demand	Anodyne	ADRB3	64	41
O=c1oc2ccccc2n1CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819029642	GF	On-Demand	Anodyne	ADRB3	18	44
O=c1oc2ccccc2n1CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819029643	GF	On-Demand	Anodyne	ADRB3	18	44
Cc1nn(C)cc1[C@@H]1CCCN1C(=O)Nc1ccccc1CC(=O)O	ZINC000819029650	EF	On-Demand	Anodyne	KCNQ2	50	33
Cc1nn(C)cc1[C@H]1CCCN1C(=O)Nc1ccccc1CC(=O)O	ZINC000819029651	EF	On-Demand	Anodyne	KCNQ2	50	33
Cc1nn(C)c2ncc(C(=O)N(CC(=O)O)c3ccc4c(c3)OCO4)cc12	ZINC000819029685	FD	On-Demand	Anodyne	NOS2	47	34
CN1C[C@@H]2CCCN(C(=S)NCCc3cccnc3)[C@@H]2C1	ZINC000819029733	DD	On-Demand	Anodyne	CHRNA7	43	34
CN1C[C@@H]2CCCN(C(=S)NCCc3cccnc3)[C@@H]2C1	ZINC000819029733	DD	On-Demand	Anodyne	NAMPT	22	40
CSCCNC(=S)Nc1ccc(Cl)c(I)c1	ZINC000819029735	GH	On-Demand	Anodyne	QPCT	41	33
Cc1nn(C)c2nc(Cl)c(CN3CCC[C@H](CC(=O)O)C3)cc12	ZINC000819029796	EF	On-Demand	Anodyne	Q8MHZ5_SHEEP	51	35
CN1C[C@@H]2CCCN(C(=S)Nc3ccc(OC(F)(F)F)cc3)[C@@H]2C1	ZINC000819029797	FG	On-Demand	Anodyne	EPHX2	49	42
Cc1nn(C)c2nc(Cl)c(CN3CCC[C@@H](CC(=O)O)C3)cc12	ZINC000819029798	EF	On-Demand	Anodyne	Q8MHZ5_SHEEP	51	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(c2ccncc2)CC1	ZINC000819029821	ED	On-Demand	Anodyne	GPR119	16	41
CN1C(=O)CC[C@@H](NC(=S)Nc2ccc3c(c2)OCO3)C1=O	ZINC000819029826	DC	On-Demand	Anodyne	NPY1R	18	44
CN1C(=O)CC[C@@H](NC(=S)Nc2ccc3c(c2)OCO3)C1=O	ZINC000819029826	DC	On-Demand	Anodyne	DYRK2	49	36
CN1C(=O)CC[C@H](NC(=S)Nc2ccc3c(c2)OCO3)C1=O	ZINC000819029827	DC	On-Demand	Anodyne	NPY1R	18	44
CN1C(=O)CC[C@H](NC(=S)Nc2ccc3c(c2)OCO3)C1=O	ZINC000819029827	DC	On-Demand	Anodyne	DYRK2	49	36
Cc1ccccc1COC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819029832	DH	On-Demand	Bother	GSTM2	51	36
Cc1ccccc1COC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819029832	DH	On-Demand	Bother	COLA	110	41
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1cccc(Cl)c1	ZINC000819029836	EG	On-Demand	Anodyne	ADRB2	46	43
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1cccc(Cl)c1	ZINC000819029836	EG	On-Demand	Anodyne	ADRB1	67	56
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1cccc(Cl)c1	ZINC000819029836	EG	On-Demand	Anodyne	DRD4	18	46
O[C@@H](CNCCOc1ccc(F)c(F)c1)c1cccc(Cl)c1	ZINC000819029836	EG	On-Demand	Anodyne	ADRB3	76	56
O[C@H](CNCCOc1ccc(F)c(F)c1)c1cccc(Cl)c1	ZINC000819029838	EG	On-Demand	Anodyne	ADRB2	46	43
O[C@H](CNCCOc1ccc(F)c(F)c1)c1cccc(Cl)c1	ZINC000819029838	EG	On-Demand	Anodyne	ADRB1	67	56
O[C@H](CNCCOc1ccc(F)c(F)c1)c1cccc(Cl)c1	ZINC000819029838	EG	On-Demand	Anodyne	DRD4	18	46
O[C@H](CNCCOc1ccc(F)c(F)c1)c1cccc(Cl)c1	ZINC000819029838	EG	On-Demand	Anodyne	ADRB3	76	56
COc1ccc(CNC(=S)N[C@@H]2CCC(=O)N(C)C2=O)cc1	ZINC000819029879	DC	On-Demand	Anodyne	PROKR1	42	31
COc1ccc(CNC(=S)N[C@H]2CCC(=O)N(C)C2=O)cc1	ZINC000819029880	DC	On-Demand	Anodyne	PROKR1	42	31
Cn1cc([C@@H]2OCC[C@H]2NC(=S)NCc2cccc(C(F)(F)F)c2)cn1	ZINC000819029881	GF	On-Demand	Anodyne	CCR2	53	38
CN1C[C@@H]2CCCN(C(=S)N[C@H]3CCOc4ccccc43)[C@@H]2C1	ZINC000819029887	EE	On-Demand	Anodyne	XIAP	20	40
CN1C[C@@H]2CCCN(C(=S)N[C@H]3CCOc4ccccc43)[C@@H]2C1	ZINC000819029887	EE	On-Demand	Anodyne	BIRC3	35	40
CN1C[C@@H]2CCCN(C(=S)N[C@H]3CCOc4ccccc43)[C@@H]2C1	ZINC000819029887	EE	On-Demand	Anodyne	BIRC2	20	40
Cc1ccccc1[C@@H](O)CNCCOc1ccc(F)c(F)c1	ZINC000819029888	DF	On-Demand	Anodyne	ADRB2	22	40
Cc1ccccc1[C@@H](O)CNCCOc1ccc(F)c(F)c1	ZINC000819029888	DF	On-Demand	Anodyne	ADRB1	29	42
Cc1ccccc1[C@@H](O)CNCCOc1ccc(F)c(F)c1	ZINC000819029888	DF	On-Demand	Anodyne	DRD4	19	43
Cc1ccccc1[C@@H](O)CNCCOc1ccc(F)c(F)c1	ZINC000819029888	DF	On-Demand	Anodyne	ADRB3	23	42
CN1C[C@@H]2CCCN(C(=S)N[C@@H]3CCOc4ccccc43)[C@@H]2C1	ZINC000819029890	EE	On-Demand	Anodyne	XIAP	20	40
CN1C[C@@H]2CCCN(C(=S)N[C@@H]3CCOc4ccccc43)[C@@H]2C1	ZINC000819029890	EE	On-Demand	Anodyne	BIRC3	35	40
CN1C[C@@H]2CCCN(C(=S)N[C@@H]3CCOc4ccccc43)[C@@H]2C1	ZINC000819029890	EE	On-Demand	Anodyne	BIRC2	20	40
CN1C(=O)CC[C@@H](NC(=S)Nc2ccc3c(c2)CCC3)C1=O	ZINC000819029915	DD	On-Demand	Anodyne	NPY1R	23	43
CN1C(=O)CC[C@H](NC(=S)Nc2ccc3c(c2)CCC3)C1=O	ZINC000819029916	DD	On-Demand	Anodyne	NPY1R	23	43
Cc1nn(C)c2nc(Cl)c(CN3CC[C@@H](C(=O)O)C3)cc12	ZINC000819029920	DD	On-Demand	Anodyne	SLC6A1	106	36
Cc1nn(C)c2nc(Cl)c(CN3CC[C@H](C(=O)O)C3)cc12	ZINC000819029921	DD	On-Demand	Anodyne	SLC6A1	106	36
CN1C(=O)CC[C@@H](NC(=S)NCc2ccc(OC(F)(F)F)cc2)C1=O	ZINC000819029925	GD	On-Demand	Anodyne	HCRTR1	15	40
CN1C(=O)CC[C@@H](NC(=S)NCc2ccc(OC(F)(F)F)cc2)C1=O	ZINC000819029925	GD	On-Demand	Anodyne	HCRTR2	15	40
CN1C(=O)CC[C@H](NC(=S)NCc2ccc(OC(F)(F)F)cc2)C1=O	ZINC000819029926	GD	On-Demand	Anodyne	HCRTR1	15	40
CN1C(=O)CC[C@H](NC(=S)NCc2ccc(OC(F)(F)F)cc2)C1=O	ZINC000819029926	GD	On-Demand	Anodyne	HCRTR2	15	40
Cc1nn(C)c2sc(C(=O)N(CC(=O)O)c3ccc4c(c3)OCO4)cc12	ZINC000819029932	FE	On-Demand	Anodyne	NOS2	56	33
Cc1nn(C)cc1[C@@H]1CCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819029933	EE	On-Demand	Anodyne	F2	15	40
Cc1nn(C)cc1[C@@H]1CCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819029933	EE	On-Demand	Anodyne	TMPRSS11D	56	33
Cc1nn(C)cc1[C@H]1CCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819029935	EE	On-Demand	Anodyne	F2	15	40
Cc1nn(C)cc1[C@H]1CCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819029935	EE	On-Demand	Anodyne	TMPRSS11D	56	33
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(S(N)(=O)=O)c1	ZINC000819030006	DD	On-Demand	Anodyne	KCNQ2	48	34
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(S(N)(=O)=O)c1	ZINC000819030007	DD	On-Demand	Anodyne	KCNQ2	48	34
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(S(N)(=O)=O)c1	ZINC000819030009	DD	On-Demand	Anodyne	KCNQ2	48	34
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(S(N)(=O)=O)c1	ZINC000819030011	DD	On-Demand	Anodyne	KCNQ2	48	34
CN1C[C@@H]2CCCN(C(=S)NCc3ccccc3)[C@@H]2C1	ZINC000819030021	CE	On-Demand	Anodyne	PREP	35	41
CN1C[C@@H]2CCCN(C(=S)NCc3ccccc3)[C@@H]2C1	ZINC000819030021	CE	On-Demand	Anodyne	TMPRSS11D	48	33
Cc1nn(C)c2ncc(NC(=O)N[C@H](CC(C)C)C(=O)O)cc12	ZINC000819030036	DD	On-Demand	Anodyne	ANPEP	19	40
Cc1nn(C)c2ncc(NC(=O)N[C@H](CC(C)C)C(=O)O)cc12	ZINC000819030036	DD	On-Demand	Anodyne	FPR1	28	40
Cc1nn(C)cc1[C@@H]1CCCN1C(=O)NCCCCCC(=O)O	ZINC000819030048	DE	On-Demand	Anodyne	ASAH1	53	31
Cc1nn(C)cc1[C@H]1CCCN1C(=O)NCCCCCC(=O)O	ZINC000819030049	DE	On-Demand	Anodyne	ASAH1	53	31
Cc1nn(C)c2ncc(CN3CC[C@@H](C(=O)O)C3)cc12	ZINC000819030103	CD	On-Demand	Anodyne	SLC6A1	104	34
Cc1nn(C)c2ncc(CN3CC[C@@H](C(=O)O)C3)cc12	ZINC000819030103	CD	On-Demand	Anodyne	S1PR1	15	44
Cc1nn(C)c2ncc(CN3CC[C@H](C(=O)O)C3)cc12	ZINC000819030104	CD	On-Demand	Anodyne	SLC6A1	104	34
Cc1nn(C)c2ncc(CN3CC[C@H](C(=O)O)C3)cc12	ZINC000819030104	CD	On-Demand	Anodyne	S1PR1	15	44
Cc1nn(C)cc1[C@@H]1CCCN1C(=O)C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819030105	FD	On-Demand	Anodyne	CMA1	21	40
Cc1nn(C)cc1[C@H]1CCCN1C(=O)C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819030106	FD	On-Demand	Anodyne	CMA1	21	40
FC(F)Oc1ccc(Cl)cc1NC(=S)NCCCN1CCOCC1	ZINC000819030126	GF	On-Demand	Anodyne	HRP1_PLAFA	53	33
FC(F)Oc1ccc(Cl)cc1NC(=S)NCCCN1CCOCC1	ZINC000819030126	GF	On-Demand	Anodyne	EPHX2	20	44
CN1C(=O)CC[C@@H](NC(=S)NCCc2ccccc2)C1=O	ZINC000819030138	DC	On-Demand	Anodyne	ACE	32	42
CN1C(=O)CC[C@@H](NC(=S)NCCc2ccccc2)C1=O	ZINC000819030138	DC	On-Demand	Anodyne	MME	19	42
CN1C(=O)CC[C@H](NC(=S)NCCc2ccccc2)C1=O	ZINC000819030139	DC	On-Demand	Anodyne	ACE	32	42
CN1C(=O)CC[C@H](NC(=S)NCCc2ccccc2)C1=O	ZINC000819030139	DC	On-Demand	Anodyne	MME	19	42
C[C@@H](Cc1ccccc1)NC(=S)N[C@H]1CCC(=O)N(C)C1=O	ZINC000819030147	DD	On-Demand	Anodyne	ACE	56	47
C[C@@H](Cc1ccccc1)NC(=S)N[C@H]1CCC(=O)N(C)C1=O	ZINC000819030147	DD	On-Demand	Anodyne	MME	53	47
C[C@@H](Cc1ccccc1)NC(=S)N[C@@H]1CCC(=O)N(C)C1=O	ZINC000819030149	DD	On-Demand	Anodyne	ACE	56	47
C[C@@H](Cc1ccccc1)NC(=S)N[C@@H]1CCC(=O)N(C)C1=O	ZINC000819030149	DD	On-Demand	Anodyne	MME	53	47
CN1C[C@@H]2CCCN(C(=S)NCc3ccc(S(N)(=O)=O)cc3)[C@@H]2C1	ZINC000819030155	FC	On-Demand	Anodyne	CA2	49	44
CN1C[C@@H]2CCCN(C(=S)NCc3ccc(S(N)(=O)=O)cc3)[C@@H]2C1	ZINC000819030155	FC	On-Demand	Anodyne	CA1	49	44
CN1C[C@@H]2CCCN(C(=S)NCc3ccc(S(N)(=O)=O)cc3)[C@@H]2C1	ZINC000819030155	FC	On-Demand	Anodyne	CA7	28	41
CN1C[C@@H]2CCCN(C(=S)NCc3ccc(S(N)(=O)=O)cc3)[C@@H]2C1	ZINC000819030155	FC	On-Demand	Anodyne	CA4	33	44
CN1C[C@@H]2CCCN(C(=S)NCc3ccc(S(N)(=O)=O)cc3)[C@@H]2C1	ZINC000819030155	FC	On-Demand	Anodyne	CA14	22	41
CN1C[C@@H]2CCCN(C(=S)NCc3ccc(S(N)(=O)=O)cc3)[C@@H]2C1	ZINC000819030155	FC	On-Demand	Anodyne	CA9	37	44
CC(=O)Nc1cccc(NC(=S)N[C@@H]2CCC(=O)N(C)C2=O)c1	ZINC000819030156	ED	On-Demand	Anodyne	CCKAR	31	41
CC(=O)Nc1cccc(NC(=S)N[C@@H]2CCC(=O)N(C)C2=O)c1	ZINC000819030156	ED	On-Demand	Anodyne	CCKBR	48	39
CC(=O)Nc1cccc(NC(=S)N[C@H]2CCC(=O)N(C)C2=O)c1	ZINC000819030157	ED	On-Demand	Anodyne	CCKAR	31	41
CC(=O)Nc1cccc(NC(=S)N[C@H]2CCC(=O)N(C)C2=O)c1	ZINC000819030157	ED	On-Demand	Anodyne	CCKBR	48	39
CN1C[C@@H]2CCCN(C(=S)Nc3ccc4c(c3)OCCO4)[C@@H]2C1	ZINC000819030184	EE	On-Demand	Anodyne	QPCT	16	41
CN1C(=O)CC[C@H](NC(=S)Nc2ccc(OC(F)(F)F)cc2)C1=O	ZINC000819030194	FE	On-Demand	Anodyne	P2RY1	47	37
CN1C(=O)CC[C@H](NC(=S)Nc2ccc(OC(F)(F)F)cc2)C1=O	ZINC000819030194	FE	On-Demand	Anodyne	EPHX2	67	47
CN1C(=O)CC[C@@H](NC(=S)Nc2ccc(OC(F)(F)F)cc2)C1=O	ZINC000819030195	FE	On-Demand	Anodyne	P2RY1	47	37
CN1C(=O)CC[C@@H](NC(=S)Nc2ccc(OC(F)(F)F)cc2)C1=O	ZINC000819030195	FE	On-Demand	Anodyne	EPHX2	67	47
CN1C(=O)CC[C@@H](NC(=S)Nc2ccc3c(c2)OCCCO3)C1=O	ZINC000819030204	ED	On-Demand	Anodyne	NPY1R	23	44
CN1C(=O)CC[C@H](NC(=S)Nc2ccc3c(c2)OCCCO3)C1=O	ZINC000819030205	ED	On-Demand	Anodyne	NPY1R	23	44
CN1C(=O)CC[C@H](NC(=S)Nc2ccc3c(c2)OCCO3)C1=O	ZINC000819030215	EC	On-Demand	Anodyne	NPY1R	18	44
CN1C(=O)CC[C@H](NC(=S)Nc2ccc3c(c2)OCCO3)C1=O	ZINC000819030215	EC	On-Demand	Anodyne	QPCT	16	42
CN1C(=O)CC[C@@H](NC(=S)Nc2ccc3c(c2)OCCO3)C1=O	ZINC000819030216	EC	On-Demand	Anodyne	NPY1R	18	44
CN1C(=O)CC[C@@H](NC(=S)Nc2ccc3c(c2)OCCO3)C1=O	ZINC000819030216	EC	On-Demand	Anodyne	QPCT	16	42
O[C@H](CNCC1(c2ccccc2Cl)CCOCC1)c1cccnc1	ZINC000819030223	EG	On-Demand	Anodyne	ADRB3	78	40
O[C@H](CNCC1(c2ccccc2Cl)CCOCC1)c1cccnc1	ZINC000819030223	EG	On-Demand	Anodyne	SCD	15	40
O[C@@H](CNCC1(c2ccccc2Cl)CCOCC1)c1cccnc1	ZINC000819030224	EG	On-Demand	Anodyne	ADRB3	78	40
O[C@@H](CNCC1(c2ccccc2Cl)CCOCC1)c1cccnc1	ZINC000819030224	EG	On-Demand	Anodyne	SCD	15	40
O=C(Nc1ccc(C2CCC2)cn1)c1c(O)cccc1Cl	ZINC000819030260	DH	On-Demand	Anodyne	TYK2	65	43
O=C(Nc1ccc(C2CCC2)cn1)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819030269	GK	On-Demand	Anodyne	PRS	25	40
O=C(Nc1ccc(C2CCC2)cn1)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819030269	GK	On-Demand	Anodyne	TACR3	19	47
CC(C)(C)OC(=O)N1CCN(CCC(=O)Nc2ccc(C3CCC3)cn2)CC1	ZINC000819030276	GG	On-Demand	Anodyne	GPR119	48	40
O=C(Nc1ccc(C2CCC2)cn1)c1cc(C(F)(F)F)cnc1Cl	ZINC000819030281	FJ	On-Demand	Anodyne	ATF1	40	35
O=C(Nc1ccc(C2CCC2)cn1)c1ccc(-n2ccnc2S)cc1	ZINC000819030285	FI	On-Demand	Anodyne	F10	36	41
O=C(Nc1ccc(C2CCC2)cn1)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	ZINC000819030286	IG	On-Demand	Anodyne	EPHX2	35	43
CCC(=O)Nc1ccccc1C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030297	DH	On-Demand	Anodyne	F10	29	43
CCC(=O)Nc1ccccc1C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030297	DH	On-Demand	Anodyne	CDK5	41	36
CCC(=O)Nc1ccccc1C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030297	DH	On-Demand	Anodyne	G2YM83_BOTF4	68	34
O=C(N[C@@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030306	HJ	On-Demand	Anodyne	ACE	22	41
O=C(N[C@@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030306	HJ	On-Demand	Anodyne	CTSB	53	38
O=C(N[C@@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030306	HJ	On-Demand	Anodyne	CYSP_TRYCR	49	39
O=C(N[C@@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030306	HJ	On-Demand	Anodyne	CTSK	36	43
O=C(N[C@@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030306	HJ	On-Demand	Anodyne	CTSL	43	37
O=C(N[C@@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030306	HJ	On-Demand	Anodyne	CAPNS1	59	33
O=C(N[C@@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030306	HJ	On-Demand	Anodyne	CAPN1	72	40
O=C(N[C@@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030306	HJ	On-Demand	Anodyne	CASP1	24	42
O=C(N[C@@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030306	HJ	On-Demand	Anodyne	CAPN2	124	38
O=C(N[C@@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030306	HJ	On-Demand	Anodyne	NPR	54	32
O=C(N[C@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030307	HJ	On-Demand	Anodyne	ACE	22	41
O=C(N[C@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030307	HJ	On-Demand	Anodyne	CTSB	53	38
O=C(N[C@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030307	HJ	On-Demand	Anodyne	CYSP_TRYCR	49	39
O=C(N[C@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030307	HJ	On-Demand	Anodyne	CTSK	36	43
O=C(N[C@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030307	HJ	On-Demand	Anodyne	CTSL	43	37
O=C(N[C@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030307	HJ	On-Demand	Anodyne	CAPNS1	59	33
O=C(N[C@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030307	HJ	On-Demand	Anodyne	CAPN1	72	40
O=C(N[C@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030307	HJ	On-Demand	Anodyne	CASP1	24	42
O=C(N[C@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030307	HJ	On-Demand	Anodyne	CAPN2	124	38
O=C(N[C@H](C(=O)Nc1ccc(C2CCC2)cn1)c1ccccc1)OCc1ccccc1	ZINC000819030307	HJ	On-Demand	Anodyne	NPR	54	32
CC(C)(C)OC(=O)N1CC[C@H](C(=O)Nc2ccc(C3CCC3)cn2)C1	ZINC000819030311	EH	On-Demand	Anodyne	GPR119	48	41
O=C(Nc1ccc(C2CCC2)cn1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819030313	HH	On-Demand	Anodyne	EPHX2	20	40
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030317	EH	On-Demand	Anodyne	REN	63	38
COc1cccc(C2=NO[C@@H](C(=O)Nc3ccc(C4CCC4)cn3)C2)c1	ZINC000819030323	FG	On-Demand	Anodyne	LUCI_PHOPY	16	41
COc1cccc(C2=NO[C@H](C(=O)Nc3ccc(C4CCC4)cn3)C2)c1	ZINC000819030324	FG	On-Demand	Anodyne	LUCI_PHOPY	16	41
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C3CCC3)cn2)c1	ZINC000819030325	HG	On-Demand	Anodyne	F10	45	29
COc1ccc(-c2nnc(S)n2CC(=O)Nc2ccc(C3CCC3)cn2)cc1	ZINC000819030339	GH	On-Demand	Anodyne	AVPR1B	41	36
O=C(Nc1cc(F)ccc1C(=O)Nc1ccc(C2CCC2)cn1)c1ccoc1	ZINC000819030342	GJ	On-Demand	Anodyne	F10	29	40
O=C(Nc1ccc(C2CCC2)cn1)c1cccnc1SC(F)(F)F	ZINC000819030343	FJ	On-Demand	Anodyne	G2YM83_BOTF4	51	32
O=C(Nc1ccc(C2CCC2)cn1)c1cccnc1S	ZINC000819030354	CG	On-Demand	Anodyne	G2YM83_BOTF4	70	37
O=C(Nc1ccc(C2CCC2)cn1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819030357	II	On-Demand	Anodyne	F10	33	40
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)Nc2ccc(C3CCC3)cn2)C1	ZINC000819030359	FH	On-Demand	Anodyne	GPR119	51	44
O=C(Nc1ccc(C2CCC2)cn1)c1cc(S(=O)(=O)C2CCCC2)ccc1F	ZINC000819030363	HI	On-Demand	Anodyne	GCK	18	41
O=C(Nc1ccc(C2CCC2)cn1)c1cnc(Cl)c(Cl)c1	ZINC000819030371	DI	On-Demand	Anodyne	LUCI_LUCLA	40	42
CC(C)(C)OC(=O)N1CC(OCC(=O)Nc2ccc(C3CCC3)cn2)C1	ZINC000819030374	FF	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CCC(SCC(=O)Nc2ccc(C3CCC3)cn2)CC1	ZINC000819030378	HI	On-Demand	Anodyne	GPR119	53	45
O=C(Nc1ccc(C2CCC2)cn1)c1ccc(N2CCCS2(=O)=O)cc1Cl	ZINC000819030381	HH	On-Demand	Anodyne	CDK1	16	41
CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030391	FH	On-Demand	Anodyne	CACNA1B	19	42
CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030392	FH	On-Demand	Anodyne	CACNA1B	19	42
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030400	FH	On-Demand	Anodyne	REN	66	40
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030400	FH	On-Demand	Anodyne	POLG_HCV1	29	42
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030400	FH	On-Demand	Anodyne	FPR1	40	39
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030401	FH	On-Demand	Anodyne	REN	66	40
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030401	FH	On-Demand	Anodyne	POLG_HCV1	29	42
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030401	FH	On-Demand	Anodyne	FPR1	40	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	ACE	27	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	ELANE	27	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	CTRA_BOVIN	49	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	CASP3	15	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	KLK3	83	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	CTSB	66	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	PAPA1_CARPA	73	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	CYSP_TRYCR	55	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	CTSK	51	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	CTSL	52	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	TIMP3	61	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	CAPNS1	66	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	CELA2A	42	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	HDAC1	15	48
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	HDAC2	23	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	REN	50	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	MMP11	47	32
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	CTSS	31	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	CAPN1	83	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	CAPN2	137	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	TPSAB1	46	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030404	GH	On-Demand	Anodyne	NPR	66	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	ACE	27	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	ELANE	27	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	CTRA_BOVIN	49	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	CASP3	15	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	KLK3	83	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	CTSB	66	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	PAPA1_CARPA	73	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	CYSP_TRYCR	55	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	CTSK	51	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	CTSL	52	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	TIMP3	61	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	CAPNS1	66	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	CELA2A	42	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	HDAC1	15	48
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	HDAC2	23	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	REN	50	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	MMP11	47	32
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	CTSS	31	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	CAPN1	83	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	CAPN2	137	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	TPSAB1	46	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030405	GH	On-Demand	Anodyne	NPR	66	34
O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)Nc1ccc(C2CCC2)cn1	ZINC000819030412	GI	On-Demand	Anodyne	IMDH_CRYPV	15	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	ACE	37	49
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	ELANE	27	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	CTRA_BOVIN	62	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	KLK3	88	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	CTSB	60	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	PAPA1_CARPA	62	36
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	CYSP_TRYCR	56	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	CTSG	42	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	CTSK	45	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	CTSL	48	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	NPFFR2	42	36
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	CAPNS1	62	35
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	CELA2A	51	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	HDAC2	19	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	MMP11	52	32
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	TGM1	23	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	CAPN1	79	49
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	CAPN2	131	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	TGM2	29	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030416	HF	On-Demand	Anodyne	NPR	46	30
C[C@@H]1C[C@H]1C(=O)Nc1ccc(F)cc1C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030442	FI	On-Demand	Anodyne	F10	27	42
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(C3CCC3)cn2)cc1OC	ZINC000819030450	IJ	On-Demand	Anodyne	F10	45	41
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(C3CCC3)cn2)cc1OC	ZINC000819030450	IJ	On-Demand	Anodyne	ABCB1B	24	40
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(C3CCC3)cn2)cc1OC	ZINC000819030450	IJ	On-Demand	Anodyne	ABCB1	15	43
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(C3CCC3)cn2)cc1OC	ZINC000819030450	IJ	On-Demand	Anodyne	GCK	26	42
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(C3CCC3)cn2)cc1OC	ZINC000819030450	IJ	On-Demand	Anodyne	LUCI_LUCLA	46	47
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(C3CCC3)cn2)cc1OC	ZINC000819030450	IJ	On-Demand	Anodyne	ABCG2	30	40
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2ccc(C3CCC3)cn2)cc1OC	ZINC000819030450	IJ	On-Demand	Anodyne	KCNK3	41	41
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)Nc2ccc(C3CCC3)cn2)C1	ZINC000819030454	FH	On-Demand	Anodyne	GPR119	42	39
CC(C)(C)OC(=O)N1CCC(=CC(=O)Nc2ccc(C3CCC3)cn2)CC1	ZINC000819030457	FI	On-Demand	Anodyne	GPR119	42	38
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ccc(C3CCC3)cn2)cc1	ZINC000819030469	GJ	On-Demand	Anodyne	F10	25	41
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2ccc(C3CCC3)cn2)cc1	ZINC000819030469	GJ	On-Demand	Anodyne	GIPR	42	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	ACE	40	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	CELA1	21	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	ELANE	33	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	CTRA_BOVIN	41	31
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	CASP3	18	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	KLK3	77	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	CTSB	66	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	PAPA1_CARPA	72	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	CYSP_TRYCR	54	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	CTSK	44	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	CTSL	47	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	PGA	21	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	PREP	20	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	CAPNS1	66	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	HLA-DRB1	41	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	CELA2A	40	31
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	REN	46	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	CTSS	29	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	CAPN1	84	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	CASP1	31	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	CAPN2	139	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	PLAU	18	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	TPSAB1	21	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	NPR	72	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	NAAA	24	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030494	FH	On-Demand	Anodyne	PSMB5	46	39
O=C(CCn1c(S)nc2ccccc2c1=O)Nc1ccc(C2CCC2)cn1	ZINC000819030500	GG	On-Demand	Anodyne	TNKS	49	30
O=C(Nc1ccc(C2CCC2)cn1)c1cc(Cl)cc(Cl)c1[N+](=O)[O-]	ZINC000819030502	FJ	On-Demand	Bother	F10	49	31
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030504	EH	On-Demand	Anodyne	PAPA1_CARPA	34	43
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030504	EH	On-Demand	Anodyne	REN	59	37
O=C(CCN1CCOCC1)Nc1ccc(C2CCC2)cn1	ZINC000819030506	CE	On-Demand	Anodyne	CNR2	15	40
O=C(CCN1CCOCC1)Nc1ccc(C2CCC2)cn1	ZINC000819030506	CE	On-Demand	Anodyne	EPHX2	20	46
O=C(Nc1ccc(C2CCC2)cn1)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819030507	HH	On-Demand	Anodyne	TGM2	38	40
O=C(Nc1ccc(C2CCC2)cn1)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819030507	HH	On-Demand	Anodyne	NAMPT	42	38
O=C(Nc1ccc(C2CCC2)cn1)c1ccc(C2SCCCS2)cc1	ZINC000819030520	FK	On-Demand	Anodyne	LUCI_LUCLA	34	41
O=C(Nc1ccc(C2CCC2)cn1)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1	ZINC000819030521	IH	On-Demand	Anodyne	TNK2	21	40
O=C(Nc1ccc(C2CCC2)cn1)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1	ZINC000819030522	IH	On-Demand	Anodyne	TNK2	21	40
N=C1NC(=O)[C@H](CC(=O)Nc2ccc(C3CCC3)cn2)S1	ZINC000819030528	DD	On-Demand	Anodyne	CDK5	40	36
N=C1NC(=O)[C@@H](CC(=O)Nc2ccc(C3CCC3)cn2)S1	ZINC000819030529	DD	On-Demand	Anodyne	CDK5	40	36
O=C(Nc1ccc(C2CCC2)cn1)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	ZINC000819030539	HG	On-Demand	Anodyne	CCR8	60	37
O=C(Nc1ccc(C2CCC2)cn1)c1ccnc(Cl)c1I	ZINC000819030542	HI	On-Demand	Anodyne	G2YM83_BOTF4	61	34
O=C(Nc1ccc(C2CCC2)cn1)C1(O)CCSCC1	ZINC000819030543	CF	On-Demand	Anodyne	CDK5	41	32
O=C(Nc1ccc(C2CCC2)cn1)c1ccn(-c2ccccc2Cl)n1	ZINC000819030547	FI	On-Demand	Anodyne	EPHB3	43	39
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030550	FJ	On-Demand	Anodyne	FPR1	20	40
C#Cc1ccccc1CC(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030554	CH	On-Demand	Mild	CDK5	40	42
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)Nc2ccc(C3CCC3)cn2)C1	ZINC000819030555	GH	On-Demand	Anodyne	GPR119	39	40
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)Nc2ccc(C3CCC3)cn2)C1	ZINC000819030556	GH	On-Demand	Anodyne	GPR119	39	40
O=C(Nc1ccc(C2CCC2)cn1)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl	ZINC000819030561	II	On-Demand	Anodyne	CCR8	56	35
O=C(Nc1ccccc1C(=O)Nc1ccc(C2CCC2)cn1)c1ccsc1	ZINC000819030566	GJ	On-Demand	Anodyne	F10	31	47
O=C(Nc1ccccc1C(=O)Nc1ccc(C2CCC2)cn1)c1ccsc1	ZINC000819030566	GJ	On-Demand	Anodyne	G2YM83_BOTF4	51	33
O=C(Cc1csc(NC(=O)Cc2cccs2)n1)Nc1ccc(C2CCC2)cn1	ZINC000819030569	HI	On-Demand	Anodyne	CDK5	37	40
CC(C)(C)OC(=O)N1CCC(C(=O)Nc2ccc(C3CCC3)cn2)CC1	ZINC000819030571	FH	On-Demand	Anodyne	GPR119	53	44
O=C(Cc1ccccc1CO)Nc1ccc(C2CCC2)cn1	ZINC000819030578	CG	On-Demand	Anodyne	CDK5	54	45
O=C(/C=C\c1ccc2c(c1)OCO2)Nc1ccc(C2CCC2)cn1	ZINC000819030579	DH	On-Demand	Anodyne	DYRK2	49	38
O=C(/C=C/c1ccc2c(c1)OCO2)Nc1ccc(C2CCC2)cn1	ZINC000819030580	DH	On-Demand	Anodyne	DYRK2	49	38
CCOC(=O)N1CCC[C@H](C(=O)Nc2ccc(C3CCC3)cn2)C1	ZINC000819030586	EG	On-Demand	Anodyne	P2RY12	19	40
CCOC(=O)N1CCC[C@@H](C(=O)Nc2ccc(C3CCC3)cn2)C1	ZINC000819030587	EG	On-Demand	Anodyne	P2RY12	19	40
O=C(Nc1ccc(C2CCC2)cn1)c1ncccn1	ZINC000819030588	CE	On-Demand	Anodyne	CDK5	41	35
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030591	EH	On-Demand	Anodyne	PREP	32	48
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030591	EH	On-Demand	Anodyne	LGMN	45	33
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030592	EH	On-Demand	Anodyne	PREP	32	48
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030592	EH	On-Demand	Anodyne	LGMN	45	33
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)Nc3ccc(C4CCC4)cn3)nn2)CC1	ZINC000819030595	IH	On-Demand	Anodyne	GPR119	41	38
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030605	EG	On-Demand	Anodyne	REN	40	35
Cc1cccc(C(=O)Nc2ccc(C3CCC3)cn2)c1NC(=O)c1ccncc1	ZINC000819030610	GJ	On-Demand	Anodyne	SHH	39	41
O=C(Nc1ccc(C2CCC2)cn1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819030619	GG	On-Demand	Anodyne	CELA1	18	40
O=C(Nc1ccc(C2CCC2)cn1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819030619	GG	On-Demand	Anodyne	PREP	40	42
O=C(Nc1ccc(C2CCC2)cn1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819030619	GG	On-Demand	Anodyne	LGMN	50	38
O=C(Nc1ccc(C2CCC2)cn1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819030619	GG	On-Demand	Anodyne	SLC12A5	45	34
O=C(Nc1ccc(C2CCC2)cn1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819030619	GG	On-Demand	Anodyne	Q9NAW4_PLAFA	43	51
O=C(Nc1ccc(C2CCC2)cn1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819030619	GG	On-Demand	Anodyne	VHL	52	36
O=C(Nc1ccc(C2CCC2)cn1)c1cc(Cl)nc2ccccc12	ZINC000819030622	EJ	On-Demand	Anodyne	TACR3	15	43
O=C(Cc1cccnc1Br)Nc1ccc(C2CCC2)cn1	ZINC000819030630	EH	On-Demand	Anodyne	CDK5	47	41
CC(C)(C)OC(=O)N1CCC(CC(=O)Nc2ccc(C3CCC3)cn2)CC1	ZINC000819030632	FI	On-Demand	Anodyne	GPR119	61	48
NS(=O)(=O)c1cc(C(=O)Nc2ccc(C3CCC3)cn2)ccc1F	ZINC000819030635	EE	On-Demand	Anodyne	F10	35	44
N#CCc1ccccc1CC(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030652	DH	On-Demand	Mild	CDK5	41	42
O=C(Nc1ccc(C2CCC2)cn1)[C@@H]1CC(c2cccc(F)c2)=NO1	ZINC000819030653	EH	On-Demand	Anodyne	NPY5R	17	40
O=C(Nc1ccc(C2CCC2)cn1)[C@H]1CC(c2cccc(F)c2)=NO1	ZINC000819030654	EH	On-Demand	Anodyne	NPY5R	17	40
O=C(Nc1ccc(C2CCC2)cn1)c1cc2ccccc2oc1=O	ZINC000819030656	DH	On-Demand	Anodyne	MAOB	16	58
O=C(Nc1ccc(C2CCC2)cn1)c1c[nH]c2cccc(F)c12	ZINC000819030668	DI	On-Demand	Anodyne	HTR1F	55	39
O=C(Nc1ccc(C2CCC2)cn1)c1c[nH]c2cccc(F)c12	ZINC000819030668	DI	On-Demand	Anodyne	CDK5	31	40
O=C(Nc1ccc(C2CCC2)cn1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819030669	FH	On-Demand	Anodyne	CPT1A	92	36
O=C(Nc1ccc(C2CCC2)cn1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819030669	FH	On-Demand	Anodyne	CPT2	42	36
O=C(Nc1ccc(C2CCC2)cn1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819030669	FH	On-Demand	Anodyne	PREP	69	50
O=C(Nc1ccc(C2CCC2)cn1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819030669	FH	On-Demand	Anodyne	TMPRSS11D	42	31
O=C(Nc1ccc(C2CCC2)cn1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819030670	FH	On-Demand	Anodyne	CPT1A	92	36
O=C(Nc1ccc(C2CCC2)cn1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819030670	FH	On-Demand	Anodyne	CPT2	42	36
O=C(Nc1ccc(C2CCC2)cn1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819030670	FH	On-Demand	Anodyne	PREP	69	50
O=C(Nc1ccc(C2CCC2)cn1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819030670	FH	On-Demand	Anodyne	TMPRSS11D	42	31
O=C(Nc1ccc(C2CCC2)cn1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000819030677	HI	On-Demand	Anodyne	F10	31	40
O=C(Nc1ccc(C2CCC2)cn1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000819030677	HI	On-Demand	Anodyne	TGM2	40	40
O=C(Nc1ccc(C2CCC2)cn1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000819030677	HI	On-Demand	Anodyne	NAMPT	45	39
O=C(Nc1ccc(C2CCC2)cn1)c1nc(Br)sc1C1CC1	ZINC000819030683	GJ	On-Demand	Anodyne	CDK5	45	35
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)Nc1ccc(C3CCC3)cn1)=NO2	ZINC000819030702	HH	On-Demand	Anodyne	GPR119	32	52
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C3CCC3)cn2)c1	ZINC000819030725	GH	On-Demand	Anodyne	F10	32	40
CC(C)(C)OC(=O)N1CCC(OCC(=O)Nc2ccc(C3CCC3)cn2)CC1	ZINC000819030732	GH	On-Demand	Anodyne	GPR119	57	48
O=C(CCc1cncc2ccccc12)Nc1ccc(C2CCC2)cn1	ZINC000819030733	EI	On-Demand	Anodyne	CDK5	41	45
O=C(Nc1ccc(C2CCC2)cn1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819030738	HF	On-Demand	Anodyne	F10	26	40
O=C(Nc1ccc(C2CCC2)cn1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819030738	HF	On-Demand	Anodyne	CNR2	17	46
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030741	GI	On-Demand	Anodyne	GPR119	41	38
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2C(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030742	GI	On-Demand	Anodyne	GPR119	41	38
O=Cc1cn(CC(=O)Nc2ccc(C3CCC3)cn2)c2ccccc12	ZINC000819030743	EH	On-Demand	Anodyne	CDK5	34	46
COc1ccc(CNC(=S)N2Cc3nnc(C)n3C[C@@H]2C(N)=O)cc1	ZINC000819030746	FC	On-Demand	Anodyne	PROKR1	55	33
COc1ccc(CNC(=S)N2Cc3nnc(C)n3C[C@H]2C(N)=O)cc1	ZINC000819030747	FC	On-Demand	Anodyne	PROKR1	55	33
Cc1nc(S)sc1CC(=O)Nc1ccc(C2CCC2)cn1	ZINC000819030757	DH	On-Demand	Anodyne	CDK5	46	39
O[C@@H](CN[C@@H]1CCN(c2ccccc2)C1)c1ccc(Br)cc1	ZINC000819030758	FG	On-Demand	Anodyne	ADRB3	24	42
O[C@@H](CN[C@@H]1CCN(c2ccccc2)C1)c1ccc(Br)cc1	ZINC000819030758	FG	On-Demand	Anodyne	SLC18A3	15	45
O[C@H](CN[C@H]1CCN(c2ccccc2)C1)c1ccc(Br)cc1	ZINC000819030760	FG	On-Demand	Anodyne	ADRB3	24	42
O[C@H](CN[C@H]1CCN(c2ccccc2)C1)c1ccc(Br)cc1	ZINC000819030760	FG	On-Demand	Anodyne	SLC18A3	15	45
O[C@H](CN[C@@H]1CCN(c2ccccc2)C1)c1ccc(Br)cc1	ZINC000819030762	FG	On-Demand	Anodyne	ADRB3	24	42
O[C@H](CN[C@@H]1CCN(c2ccccc2)C1)c1ccc(Br)cc1	ZINC000819030762	FG	On-Demand	Anodyne	SLC18A3	15	45
O[C@@H](CN[C@H]1CCN(c2ccccc2)C1)c1ccc(Br)cc1	ZINC000819030764	FG	On-Demand	Anodyne	ADRB3	24	42
O[C@@H](CN[C@H]1CCN(c2ccccc2)C1)c1ccc(Br)cc1	ZINC000819030764	FG	On-Demand	Anodyne	SLC18A3	15	45
O=Cc1cccc(OCCC(=O)Nc2ccc(C3CCC3)cn2)c1	ZINC000819030767	DH	On-Demand	Anodyne	CDK5	40	35
O=C(Nc1ccc(C2CCC2)cn1)c1ccccc1NC(=O)C1CC1	ZINC000819030774	EH	On-Demand	Anodyne	F10	21	44
O=C(Nc1ccc(C2CCC2)cn1)c1ccccc1NC(=O)C1CC1	ZINC000819030774	EH	On-Demand	Anodyne	G2YM83_BOTF4	58	32
O=C(CCCNC(=O)OCc1ccccc1)Nc1ccc(C2CCC2)cn1	ZINC000819030821	FH	On-Demand	Anodyne	CAPN1	23	41
O=C(CCCNC(=O)OCc1ccccc1)Nc1ccc(C2CCC2)cn1	ZINC000819030821	FH	On-Demand	Anodyne	CAPN2	48	41
O=C(CCCNC(=O)OCc1ccccc1)Nc1ccc(C2CCC2)cn1	ZINC000819030821	FH	On-Demand	Anodyne	TGM2	30	40
O=C(CCCNC(=O)OCc1ccccc1)Nc1ccc(C2CCC2)cn1	ZINC000819030821	FH	On-Demand	Anodyne	KDM1A	17	40
O=C(Nc1ccc(C2CCC2)cn1)c1cccc(C2OCCO2)c1	ZINC000819030822	DH	On-Demand	Anodyne	LUCI_LUCLA	40	40
O=C(Nc1ccc(C2CCC2)cn1)c1cc(Cl)nc(Cl)c1	ZINC000819030845	DI	On-Demand	Anodyne	GRM5	16	40
O=C(Nc1ccc(C2CCC2)cn1)c1cc(Cl)nc(Cl)c1	ZINC000819030845	DI	On-Demand	Anodyne	LUCI_LUCLA	41	40
CS(=O)(=O)Nc1cccc(C(=O)Nc2ccc(C3CCC3)cn2)c1	ZINC000819030861	EF	On-Demand	Anodyne	KCNK3	76	34
O=C(Nc1ccc(C2CCC2)cn1)c1cc(-c2cccnc2)nc2ccccc12	ZINC000819030885	GK	On-Demand	Anodyne	TACR3	23	46
O=C(Nc1ccc(C2CCC2)cn1)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	ZINC000819030887	IG	On-Demand	Anodyne	MERTK	34	44
O=C(Nc1ccc(C2CCC2)cn1)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	ZINC000819030887	IG	On-Demand	Anodyne	NAMPT	46	41
O=C(Nc1ccc(C2CCC2)cn1)c1cccnc1-n1cccn1	ZINC000819030888	DG	On-Demand	Anodyne	PIM1	40	35
O=C(Nc1ccc(C2CCC2)cn1)c1cccnc1-n1cccn1	ZINC000819030888	DG	On-Demand	Anodyne	G2YM83_BOTF4	58	34
O=C(Nc1ccc(C2CCC2)cn1)c1cccnc1S(=O)(=O)C(F)(F)F	ZINC000819030890	GG	On-Demand	Anodyne	G2YM83_BOTF4	59	33
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030893	GF	On-Demand	Anodyne	P2RY12	43	32
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030893	GF	On-Demand	Anodyne	CCR8	53	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030893	GF	On-Demand	Anodyne	GPR119	44	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030893	GF	On-Demand	Anodyne	SFRP1	59	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030893	GF	On-Demand	Anodyne	WNT3	43	35
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030896	GF	On-Demand	Anodyne	P2RY12	43	32
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030896	GF	On-Demand	Anodyne	CCR8	53	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030896	GF	On-Demand	Anodyne	GPR119	44	47
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030896	GF	On-Demand	Anodyne	SFRP1	59	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030896	GF	On-Demand	Anodyne	WNT3	43	35
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030898	GF	On-Demand	Anodyne	P2RY12	43	32
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030898	GF	On-Demand	Anodyne	CCR8	53	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030898	GF	On-Demand	Anodyne	GPR119	44	47
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030898	GF	On-Demand	Anodyne	SFRP1	59	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030898	GF	On-Demand	Anodyne	WNT3	43	35
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030900	GF	On-Demand	Anodyne	P2RY12	43	32
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030900	GF	On-Demand	Anodyne	CCR8	53	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030900	GF	On-Demand	Anodyne	GPR119	44	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030900	GF	On-Demand	Anodyne	SFRP1	59	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000819030900	GF	On-Demand	Anodyne	WNT3	43	35
O=C1CC[C@@H](C(=O)Nc2ccc(C3CCC3)cn2)CCN1	ZINC000819030908	CE	On-Demand	Anodyne	NPY5R	22	42
O=C1CC[C@H](C(=O)Nc2ccc(C3CCC3)cn2)CCN1	ZINC000819030909	CE	On-Demand	Anodyne	NPY5R	22	42
O=C(Cn1cccc(C(F)(F)F)c1=O)Nc1ccc(C2CCC2)cn1	ZINC000819030932	FG	On-Demand	Anodyne	CDK5	26	41
O=C(Cn1cccc(C(F)(F)F)c1=O)Nc1ccc(C2CCC2)cn1	ZINC000819030932	FG	On-Demand	Anodyne	RBP4	46	33
O=C(Nc1ccc(C2CCC2)cn1)c1ccc(S(=O)(=O)N2CCCC2)o1	ZINC000819030933	GF	On-Demand	Anodyne	NAMPT	43	39
COC(=O)C1CCC(NC[C@H](O)c2ccc(C#N)cc2)CC1	ZINC000819030966	DD	On-Demand	Mild	ADRB3	18	49
COC(=O)C1CCC(NC[C@@H](O)c2ccc(C#N)cc2)CC1	ZINC000819030967	DD	On-Demand	Mild	ADRB3	18	49
C[S@](=O)CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819030970	EC	On-Demand	Anodyne	GPR119	28	42
C[S@@](=O)CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819030971	EC	On-Demand	Anodyne	GPR119	28	42
C[S@@](=O)CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819030972	EC	On-Demand	Anodyne	GPR119	28	42
C[S@](=O)CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819030973	EC	On-Demand	Anodyne	GPR119	28	42
CSc1ccc(OC[C@@H](O)CNCC[S@@](C)=O)cc1	ZINC000819030976	DD	On-Demand	Anodyne	ADRB2	49	46
CSc1ccc(OC[C@@H](O)CNCC[S@@](C)=O)cc1	ZINC000819030976	DD	On-Demand	Anodyne	ADRB1	75	46
CSc1ccc(OC[C@@H](O)CNCC[S@@](C)=O)cc1	ZINC000819030976	DD	On-Demand	Anodyne	ADRB3	46	46
CSc1ccc(OC[C@H](O)CNCC[S@@](C)=O)cc1	ZINC000819030977	DD	On-Demand	Anodyne	ADRB2	49	46
CSc1ccc(OC[C@H](O)CNCC[S@@](C)=O)cc1	ZINC000819030977	DD	On-Demand	Anodyne	ADRB1	75	46
CSc1ccc(OC[C@H](O)CNCC[S@@](C)=O)cc1	ZINC000819030977	DD	On-Demand	Anodyne	ADRB3	46	46
CSc1ccc(OC[C@@H](O)CNCC[S@](C)=O)cc1	ZINC000819030978	DD	On-Demand	Anodyne	ADRB2	49	46
CSc1ccc(OC[C@@H](O)CNCC[S@](C)=O)cc1	ZINC000819030978	DD	On-Demand	Anodyne	ADRB1	75	46
CSc1ccc(OC[C@@H](O)CNCC[S@](C)=O)cc1	ZINC000819030978	DD	On-Demand	Anodyne	ADRB3	46	46
CSc1ccc(OC[C@H](O)CNCC[S@](C)=O)cc1	ZINC000819030979	DD	On-Demand	Anodyne	ADRB2	49	46
CSc1ccc(OC[C@H](O)CNCC[S@](C)=O)cc1	ZINC000819030979	DD	On-Demand	Anodyne	ADRB1	75	46
CSc1ccc(OC[C@H](O)CNCC[S@](C)=O)cc1	ZINC000819030979	DD	On-Demand	Anodyne	ADRB3	46	46
C[S@](=O)CCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819030984	CD	On-Demand	Anodyne	ADRB2	26	43
C[S@](=O)CCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819030984	CD	On-Demand	Anodyne	ADRB1	26	41
C[S@](=O)CCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819030984	CD	On-Demand	Anodyne	ADRB3	28	41
C[S@@](=O)CCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819030985	CD	On-Demand	Anodyne	ADRB2	26	43
C[S@@](=O)CCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819030985	CD	On-Demand	Anodyne	ADRB1	26	41
C[S@@](=O)CCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819030985	CD	On-Demand	Anodyne	ADRB3	28	41
C[S@@](=O)CCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819030986	CD	On-Demand	Anodyne	ADRB2	26	43
C[S@@](=O)CCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819030986	CD	On-Demand	Anodyne	ADRB1	26	41
C[S@@](=O)CCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819030986	CD	On-Demand	Anodyne	ADRB3	28	41
C[S@](=O)CCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819030987	CD	On-Demand	Anodyne	ADRB2	26	43
C[S@](=O)CCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819030987	CD	On-Demand	Anodyne	ADRB1	26	41
C[S@](=O)CCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819030987	CD	On-Demand	Anodyne	ADRB3	28	41
C[C@@H]1CCCC[C@H]1C(=O)N(C)Cc1nc(O)c2ccccc2n1	ZINC000819030993	DG	On-Demand	Anodyne	TNKS	40	30
C[C@@H]1CCCC[C@@H]1C(=O)N(C)Cc1nc(O)c2ccccc2n1	ZINC000819030994	DG	On-Demand	Anodyne	TNKS	40	30
O[C@@H](CN[C@@H]1CCN(c2ccccc2)C1)c1ccccc1	ZINC000819031030	CF	On-Demand	Anodyne	ADRB3	35	42
O[C@H](CN[C@H]1CCN(c2ccccc2)C1)c1ccccc1	ZINC000819031031	CF	On-Demand	Anodyne	ADRB3	35	42
O[C@H](CN[C@@H]1CCN(c2ccccc2)C1)c1ccccc1	ZINC000819031032	CF	On-Demand	Anodyne	ADRB3	35	42
O[C@@H](CN[C@H]1CCN(c2ccccc2)C1)c1ccccc1	ZINC000819031033	CF	On-Demand	Anodyne	ADRB3	35	42
C[S@](=O)CCNCCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000819031052	CC	On-Demand	Bother	COLA	45	35
C[S@@](=O)CCNCCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000819031053	CC	On-Demand	Bother	COLA	45	35
O=C(NC1=NCCS1)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819031054	FF	On-Demand	Anodyne	CNR1	53	32
C[S@@](=O)CCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819031063	EC	On-Demand	Anodyne	ADRB1	53	40
C[S@@](=O)CCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819031063	EC	On-Demand	Anodyne	ADRB3	33	42
C[S@](=O)CCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819031064	EC	On-Demand	Anodyne	ADRB1	53	40
C[S@](=O)CCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819031064	EC	On-Demand	Anodyne	ADRB3	33	42
C[S@@](=O)CCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819031065	EC	On-Demand	Anodyne	ADRB1	53	40
C[S@@](=O)CCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819031065	EC	On-Demand	Anodyne	ADRB3	33	42
C[S@](=O)CCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819031066	EC	On-Demand	Anodyne	ADRB1	53	40
C[S@](=O)CCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819031066	EC	On-Demand	Anodyne	ADRB3	33	42
COC(=O)C1CCC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819031143	DD	On-Demand	Bother	CACNA1C	60	42
COC(=O)C1CCC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819031143	DD	On-Demand	Bother	CACNA1D	89	37
COC(=O)C1CCC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819031144	DD	On-Demand	Bother	CACNA1C	60	42
COC(=O)C1CCC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819031144	DD	On-Demand	Bother	CACNA1D	89	37
C[S@](=O)CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819031154	CD	On-Demand	Anodyne	ADRB2	16	43
C[S@](=O)CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819031154	CD	On-Demand	Anodyne	ADRB1	31	41
C[S@](=O)CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819031154	CD	On-Demand	Anodyne	ADRB3	28	40
C[S@](=O)CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819031155	CD	On-Demand	Anodyne	ADRB2	16	43
C[S@](=O)CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819031155	CD	On-Demand	Anodyne	ADRB1	31	41
C[S@](=O)CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819031155	CD	On-Demand	Anodyne	ADRB3	28	40
C[S@@](=O)CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819031156	CD	On-Demand	Anodyne	ADRB2	16	43
C[S@@](=O)CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819031156	CD	On-Demand	Anodyne	ADRB1	31	41
C[S@@](=O)CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819031156	CD	On-Demand	Anodyne	ADRB3	28	40
C[S@@](=O)CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819031157	CD	On-Demand	Anodyne	ADRB2	16	43
C[S@@](=O)CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819031157	CD	On-Demand	Anodyne	ADRB1	31	41
C[S@@](=O)CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819031157	CD	On-Demand	Anodyne	ADRB3	28	40
C[S@](=O)CCNCCC(=O)Nc1cccnc1	ZINC000819031161	CC	On-Demand	Anodyne	NAMPT	18	41
C[S@@](=O)CCNCCC(=O)Nc1cccnc1	ZINC000819031162	CC	On-Demand	Anodyne	NAMPT	18	41
COC(=O)C1CCC(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819031171	GE	On-Demand	Anodyne	GPR119	28	42
COC(=O)C1CCC(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819031172	GE	On-Demand	Anodyne	GPR119	28	42
C=C(C)C(C)(C)C(=O)N(C)Cc1nc(O)c2ccccc2n1	ZINC000819031184	CF	On-Demand	Mild	TSPO	30	40
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000819031229	DE	On-Demand	Mild	ADRB3	22	48
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000819031230	DE	On-Demand	Mild	ADRB3	22	48
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000819031231	DE	On-Demand	Mild	ADRB3	22	48
N#Cc1ccc([C@H](O)CN[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000819031232	DE	On-Demand	Mild	ADRB3	22	48
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@H]2CCc3ccc(F)cc32)CC1	ZINC000819031262	GH	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@@H]2CCc3ccc(F)cc32)CC1	ZINC000819031263	GH	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@H]2CCc3ccc(F)cc32)CC1	ZINC000819031264	GH	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@@H]2CCc3ccc(F)cc32)CC1	ZINC000819031265	GH	On-Demand	Anodyne	GPR119	31	40
CN(C)c1ccc([C@@H]2CCCN2C(=S)NCCc2ccccc2)nn1	ZINC000819031304	FF	On-Demand	Anodyne	PREP	55	35
CN(C)c1ccc([C@H]2CCCN2C(=S)NCCc2ccccc2)nn1	ZINC000819031305	FF	On-Demand	Anodyne	PREP	55	35
CCN(Cc1nc(O)c2ccccc2n1)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819031310	GF	On-Demand	Anodyne	TNKS	45	30
CN(C)c1ccc([C@@H]2CCCN2C(=S)Nc2ccc3c(c2)OCO3)nn1	ZINC000819031330	FF	On-Demand	Anodyne	TRPC6	40	42
CN(C)c1ccc([C@@H]2CCCN2C(=S)Nc2ccc3c(c2)OCO3)nn1	ZINC000819031330	FF	On-Demand	Anodyne	TRPC3	38	42
CN(C)c1ccc([C@H]2CCCN2C(=S)Nc2ccc3c(c2)OCO3)nn1	ZINC000819031331	FF	On-Demand	Anodyne	TRPC6	40	42
CN(C)c1ccc([C@H]2CCCN2C(=S)Nc2ccc3c(c2)OCO3)nn1	ZINC000819031331	FF	On-Demand	Anodyne	TRPC3	38	42
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031332	EG	On-Demand	Anodyne	DRD4	45	50
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031332	EG	On-Demand	Anodyne	SIGMAR1	27	53
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031332	EG	On-Demand	Anodyne	SSTR5	46	36
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031332	EG	On-Demand	Anodyne	CCR3	26	41
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031332	EG	On-Demand	Anodyne	CXCR3	34	41
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031332	EG	On-Demand	Anodyne	MCHR1	50	48
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031333	EG	On-Demand	Anodyne	DRD4	45	50
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031333	EG	On-Demand	Anodyne	SIGMAR1	27	53
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031333	EG	On-Demand	Anodyne	SSTR5	46	36
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031333	EG	On-Demand	Anodyne	CCR3	26	41
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031333	EG	On-Demand	Anodyne	CXCR3	34	41
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031333	EG	On-Demand	Anodyne	MCHR1	50	48
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031334	EG	On-Demand	Anodyne	DRD4	45	50
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031334	EG	On-Demand	Anodyne	SIGMAR1	27	53
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031334	EG	On-Demand	Anodyne	SSTR5	46	36
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031334	EG	On-Demand	Anodyne	CCR3	26	41
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031334	EG	On-Demand	Anodyne	CXCR3	34	41
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031334	EG	On-Demand	Anodyne	MCHR1	50	48
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031335	EG	On-Demand	Anodyne	DRD4	45	50
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031335	EG	On-Demand	Anodyne	SIGMAR1	27	53
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031335	EG	On-Demand	Anodyne	SSTR5	46	36
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031335	EG	On-Demand	Anodyne	CCR3	26	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031335	EG	On-Demand	Anodyne	CXCR3	34	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819031335	EG	On-Demand	Anodyne	MCHR1	50	48
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@H]1CCN(c2ccccc2)C1	ZINC000819031386	FD	On-Demand	Anodyne	CCR8	48	38
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@H]1CCN(c2ccccc2)C1	ZINC000819031386	FD	On-Demand	Anodyne	SFRP1	84	37
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@H]1CCN(c2ccccc2)C1	ZINC000819031386	FD	On-Demand	Anodyne	WNT3	52	33
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@@H]1CCN(c2ccccc2)C1	ZINC000819031387	FD	On-Demand	Anodyne	CCR8	48	38
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@@H]1CCN(c2ccccc2)C1	ZINC000819031387	FD	On-Demand	Anodyne	SFRP1	84	37
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@@H]1CCN(c2ccccc2)C1	ZINC000819031387	FD	On-Demand	Anodyne	WNT3	52	33
O[C@@H](CN[C@@H]1CCN(c2ccccc2)C1)c1ccccc1Cl	ZINC000819031404	DG	On-Demand	Anodyne	OPRL1	41	40
O[C@@H](CN[C@@H]1CCN(c2ccccc2)C1)c1ccccc1Cl	ZINC000819031404	DG	On-Demand	Anodyne	ADRB3	23	48
O[C@@H](CN[C@H]1CCN(c2ccccc2)C1)c1ccccc1Cl	ZINC000819031405	DG	On-Demand	Anodyne	OPRL1	41	40
O[C@@H](CN[C@H]1CCN(c2ccccc2)C1)c1ccccc1Cl	ZINC000819031405	DG	On-Demand	Anodyne	ADRB3	23	48
CN(C)c1ccc([C@@H]2CCCN2C(=S)Nc2cccc(Cl)c2)nn1	ZINC000819031427	FH	On-Demand	Anodyne	GRM5	15	43
CN(C)c1ccc([C@H]2CCCN2C(=S)Nc2cccc(Cl)c2)nn1	ZINC000819031428	FH	On-Demand	Anodyne	GRM5	15	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)Cc1nc(O)c3ccccc3n1)C2	ZINC000819031457	GE	On-Demand	Anodyne	TNKS	57	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)Cc1nc(O)c3ccccc3n1)C2	ZINC000819031458	GE	On-Demand	Anodyne	TNKS	57	33
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819031461	EH	On-Demand	Anodyne	DRD4	46	52
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819031461	EH	On-Demand	Anodyne	KCNH2	15	40
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819031461	EH	On-Demand	Anodyne	CHRM3	17	42
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819031461	EH	On-Demand	Anodyne	SIGMAR1	36	58
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819031461	EH	On-Demand	Anodyne	SSTR5	47	37
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819031461	EH	On-Demand	Anodyne	CCR1	22	45
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819031461	EH	On-Demand	Anodyne	CCR3	32	45
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819031461	EH	On-Demand	Anodyne	CXCR3	45	45
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819031461	EH	On-Demand	Anodyne	MCHR1	54	50
O=C(NC1CCN(Cc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819031461	EH	On-Demand	Anodyne	CACNA1G	26	41
CON(C)C(=O)CCN[C@H]1CCN(c2ccccc2)C1	ZINC000819031473	CD	On-Demand	Anodyne	NPY1R	24	42
COC(=O)C1CCC(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819031512	FD	On-Demand	Anodyne	ADRB3	30	42
COC(=O)C1CCC(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819031513	FD	On-Demand	Anodyne	ADRB3	30	42
CN(C)c1ccc([C@@H]2CCCN2C(=S)NCc2ccccc2)nn1	ZINC000819031552	EF	On-Demand	Anodyne	PREP	49	41
CN(C)c1ccc([C@H]2CCCN2C(=S)NCc2ccccc2)nn1	ZINC000819031553	EF	On-Demand	Anodyne	PREP	49	41
CCN(Cc1nc(O)c2ccccc2n1)C(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819031563	GF	On-Demand	Anodyne	TNKS	51	33
CCN(Cc1nc(O)c2ccccc2n1)C(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819031564	GF	On-Demand	Anodyne	TNKS	51	33
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCc3ccc(F)cc32)CC1	ZINC000819031565	GG	On-Demand	Anodyne	GPR119	42	52
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCc3ccc(F)cc32)CC1	ZINC000819031566	GG	On-Demand	Anodyne	GPR119	42	52
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCc3ccc(F)cc32)CC1	ZINC000819031567	GG	On-Demand	Anodyne	GPR119	42	52
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCc3ccc(F)cc32)CC1	ZINC000819031568	GG	On-Demand	Anodyne	GPR119	42	52
O=C(COC(=O)CSc1ccccc1[N+](=O)[O-])Nc1ccc(N2CCOCC2)cc1	ZINC000819031571	IF	On-Demand	Bother	STAT6	45	43
CCN(Cc1nc(O)c2ccccc2n1)C(=O)C(F)=C1CCC1	ZINC000819031616	DG	On-Demand	Anodyne	TSPO	36	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000819031639	FD	On-Demand	Anodyne	ADRB1	20	45
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000819031639	FD	On-Demand	Anodyne	ADRB3	38	49
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000819031639	FD	On-Demand	Anodyne	CCR5	21	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000819031640	FD	On-Demand	Anodyne	ADRB1	20	45
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000819031640	FD	On-Demand	Anodyne	ADRB3	38	49
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000819031640	FD	On-Demand	Anodyne	CCR5	21	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000819031641	FD	On-Demand	Anodyne	ADRB1	20	45
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000819031641	FD	On-Demand	Anodyne	ADRB3	38	49
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3ccccc3)C2)cc1	ZINC000819031641	FD	On-Demand	Anodyne	CCR5	21	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000819031642	FD	On-Demand	Anodyne	ADRB1	20	45
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000819031642	FD	On-Demand	Anodyne	ADRB3	38	49
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3ccccc3)C2)cc1	ZINC000819031642	FD	On-Demand	Anodyne	CCR5	21	40
O[C@H](CN[C@H]1CCN(c2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819031699	EG	On-Demand	Anodyne	ADRB3	20	42
O[C@@H](CN[C@@H]1CCN(c2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819031700	EG	On-Demand	Anodyne	ADRB3	20	42
O[C@@H](CN[C@H]1CCN(c2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819031701	EG	On-Demand	Anodyne	ADRB3	20	42
O[C@H](CN[C@@H]1CCN(c2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819031702	EG	On-Demand	Anodyne	ADRB3	20	42
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000819031796	GG	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000819031797	GG	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@H]2CCN(c3ccccc3)C2)CC1	ZINC000819031798	GG	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@@H]2CCN(c3ccccc3)C2)CC1	ZINC000819031799	GG	On-Demand	Anodyne	GPR119	32	42
O[C@H](CN[C@H]1CCN(c2ccccc2)C1)c1ccc(F)c(Br)c1	ZINC000819031804	GG	On-Demand	Anodyne	ADRB3	27	40
O[C@@H](CN[C@@H]1CCN(c2ccccc2)C1)c1ccc(F)c(Br)c1	ZINC000819031805	GG	On-Demand	Anodyne	ADRB3	27	40
O[C@@H](CN[C@H]1CCN(c2ccccc2)C1)c1ccc(F)c(Br)c1	ZINC000819031806	GG	On-Demand	Anodyne	ADRB3	27	40
O[C@H](CN[C@@H]1CCN(c2ccccc2)C1)c1ccc(F)c(Br)c1	ZINC000819031807	GG	On-Demand	Anodyne	ADRB3	27	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819031867	GH	On-Demand	Anodyne	CACNA1I	57	33
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819031867	GH	On-Demand	Anodyne	GPR119	38	45
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819031868	GH	On-Demand	Anodyne	CACNA1I	57	33
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819031868	GH	On-Demand	Anodyne	GPR119	38	45
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819031869	GH	On-Demand	Anodyne	CACNA1I	57	33
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819031869	GH	On-Demand	Anodyne	GPR119	38	45
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819031870	GH	On-Demand	Anodyne	CACNA1I	57	33
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819031870	GH	On-Demand	Anodyne	GPR119	38	45
N#Cc1ccc([C@H](O)CNCC2CCN(Cc3ccccc3Cl)CC2)cc1	ZINC000819031896	GH	On-Demand	Mild	SIGMAR1	19	48
N#Cc1ccc([C@H](O)CNCC2CCN(Cc3ccccc3Cl)CC2)cc1	ZINC000819031896	GH	On-Demand	Mild	CCR3	20	42
N#Cc1ccc([C@@H](O)CNCC2CCN(Cc3ccccc3Cl)CC2)cc1	ZINC000819031897	GH	On-Demand	Mild	SIGMAR1	19	48
N#Cc1ccc([C@@H](O)CNCC2CCN(Cc3ccccc3Cl)CC2)cc1	ZINC000819031897	GH	On-Demand	Mild	CCR3	20	42
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819031904	GH	On-Demand	Anodyne	LIPG	55	41
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819031905	GH	On-Demand	Anodyne	LIPG	55	41
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819031906	GH	On-Demand	Anodyne	LIPG	55	41
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819031907	GH	On-Demand	Anodyne	LIPG	55	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819031927	FH	On-Demand	Anodyne	ADRB1	57	46
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819031927	FH	On-Demand	Anodyne	ADRB3	74	46
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819031927	FH	On-Demand	Anodyne	CYP3A4	50	35
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819031927	FH	On-Demand	Anodyne	CACNA1I	51	39
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819031927	FH	On-Demand	Anodyne	GPR119	35	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819031928	FH	On-Demand	Anodyne	ADRB1	57	46
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819031928	FH	On-Demand	Anodyne	ADRB3	74	46
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819031928	FH	On-Demand	Anodyne	CYP3A4	50	35
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819031928	FH	On-Demand	Anodyne	CACNA1I	51	39
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819031928	FH	On-Demand	Anodyne	GPR119	35	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819031929	FH	On-Demand	Anodyne	ADRB1	57	46
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819031929	FH	On-Demand	Anodyne	ADRB3	74	46
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819031929	FH	On-Demand	Anodyne	CYP3A4	50	35
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819031929	FH	On-Demand	Anodyne	CACNA1I	51	39
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819031929	FH	On-Demand	Anodyne	GPR119	35	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819031930	FH	On-Demand	Anodyne	ADRB1	57	46
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819031930	FH	On-Demand	Anodyne	ADRB3	74	46
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819031930	FH	On-Demand	Anodyne	CYP3A4	50	35
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819031930	FH	On-Demand	Anodyne	CACNA1I	51	39
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819031930	FH	On-Demand	Anodyne	GPR119	35	42
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccc(F)c(F)c1	ZINC000819031941	GI	On-Demand	Anodyne	SLC6A3	28	48
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccc(F)c(F)c1	ZINC000819031941	GI	On-Demand	Anodyne	SIGMAR1	24	43
C[S@](=O)CCNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819031956	ED	On-Demand	Anodyne	CYNT	46	53
C[S@@](=O)CCNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819031957	ED	On-Demand	Anodyne	CYNT	46	53
C[S@](=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819031958	DD	On-Demand	Anodyne	ADRB2	67	60
C[S@](=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819031958	DD	On-Demand	Anodyne	ADRB1	88	48
C[S@](=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819031958	DD	On-Demand	Anodyne	ADRB3	55	48
C[S@](=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819031958	DD	On-Demand	Anodyne	CASR	42	38
C[S@](=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819031958	DD	On-Demand	Anodyne	CYP2D6	18	44
C[S@](=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819031958	DD	On-Demand	Anodyne	ABCB1	21	46
C[S@@](=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819031959	DD	On-Demand	Anodyne	ADRB2	67	60
C[S@@](=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819031959	DD	On-Demand	Anodyne	ADRB1	88	48
C[S@@](=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819031959	DD	On-Demand	Anodyne	ADRB3	55	48
C[S@@](=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819031959	DD	On-Demand	Anodyne	CASR	42	38
C[S@@](=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819031959	DD	On-Demand	Anodyne	CYP2D6	18	44
C[S@@](=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819031959	DD	On-Demand	Anodyne	ABCB1	21	46
C[S@](=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819031960	DD	On-Demand	Anodyne	ADRB2	67	60
C[S@](=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819031960	DD	On-Demand	Anodyne	ADRB1	88	48
C[S@](=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819031960	DD	On-Demand	Anodyne	ADRB3	55	48
C[S@](=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819031960	DD	On-Demand	Anodyne	CASR	42	38
C[S@](=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819031960	DD	On-Demand	Anodyne	CYP2D6	18	44
C[S@](=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819031960	DD	On-Demand	Anodyne	ABCB1	21	46
C[S@@](=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819031961	DD	On-Demand	Anodyne	ADRB2	67	60
C[S@@](=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819031961	DD	On-Demand	Anodyne	ADRB1	88	48
C[S@@](=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819031961	DD	On-Demand	Anodyne	ADRB3	55	48
C[S@@](=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819031961	DD	On-Demand	Anodyne	CASR	42	38
C[S@@](=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819031961	DD	On-Demand	Anodyne	CYP2D6	18	44
C[S@@](=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819031961	DD	On-Demand	Anodyne	ABCB1	21	46
O=C(COC(=O)CSc1ccccc1[N+](=O)[O-])Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000819031962	JD	On-Demand	Bother	F13A1	43	41
CON(C)C(=O)CCNCCc1ccc(OCC(C)C)cc1	ZINC000819031969	DE	On-Demand	Anodyne	ADRB2	32	42
CON(C)C(=O)CCNCCc1ccc(OCC(C)C)cc1	ZINC000819031969	DE	On-Demand	Anodyne	ADRB1	52	42
CON(C)C(=O)CCNCCc1ccc(OCC(C)C)cc1	ZINC000819031969	DE	On-Demand	Anodyne	ADRB3	42	43
C[S@@](=O)CCNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819031972	EE	On-Demand	Anodyne	ADRB2	71	56
C[S@@](=O)CCNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819031972	EE	On-Demand	Anodyne	ADRB1	106	56
C[S@@](=O)CCNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819031972	EE	On-Demand	Anodyne	ADRB3	70	56
C[S@@](=O)CCNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819031972	EE	On-Demand	Anodyne	ABCB1	22	52
C[S@](=O)CCNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819031973	EE	On-Demand	Anodyne	ADRB2	71	56
C[S@](=O)CCNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819031973	EE	On-Demand	Anodyne	ADRB1	106	56
C[S@](=O)CCNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819031973	EE	On-Demand	Anodyne	ADRB3	70	56
C[S@](=O)CCNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819031973	EE	On-Demand	Anodyne	ABCB1	22	52
C[S@](=O)CCNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819031974	EE	On-Demand	Anodyne	ADRB2	71	56
C[S@](=O)CCNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819031974	EE	On-Demand	Anodyne	ADRB1	106	56
C[S@](=O)CCNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819031974	EE	On-Demand	Anodyne	ADRB3	70	56
C[S@](=O)CCNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819031974	EE	On-Demand	Anodyne	ABCB1	22	52
C[S@@](=O)CCNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819031975	EE	On-Demand	Anodyne	ADRB2	71	56
C[S@@](=O)CCNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819031975	EE	On-Demand	Anodyne	ADRB1	106	56
C[S@@](=O)CCNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819031975	EE	On-Demand	Anodyne	ADRB3	70	56
C[S@@](=O)CCNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819031975	EE	On-Demand	Anodyne	ABCB1	22	52
CCN1CCC[C@@H]1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819031990	FE	On-Demand	Mild	PAPA1_CARPA	39	50
CCN1CCC[C@H]1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819031991	FE	On-Demand	Mild	PAPA1_CARPA	39	50
CCN1CCC[C@@H]1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819031992	FE	On-Demand	Mild	PAPA1_CARPA	39	50
CCN1CCC[C@H]1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819031993	FE	On-Demand	Mild	PAPA1_CARPA	39	50
COc1cccc(OC)c1OC[C@H](O)CNCC[S@](C)=O	ZINC000819031998	DC	On-Demand	Anodyne	ADRB2	51	50
COc1cccc(OC)c1OC[C@H](O)CNCC[S@](C)=O	ZINC000819031998	DC	On-Demand	Anodyne	ADRB1	65	47
COc1cccc(OC)c1OC[C@H](O)CNCC[S@](C)=O	ZINC000819031998	DC	On-Demand	Anodyne	ADRB3	33	40
COc1cccc(OC)c1OC[C@@H](O)CNCC[S@](C)=O	ZINC000819031999	DC	On-Demand	Anodyne	ADRB2	51	50
COc1cccc(OC)c1OC[C@@H](O)CNCC[S@](C)=O	ZINC000819031999	DC	On-Demand	Anodyne	ADRB1	65	47
COc1cccc(OC)c1OC[C@@H](O)CNCC[S@](C)=O	ZINC000819031999	DC	On-Demand	Anodyne	ADRB3	33	40
COc1cccc(OC)c1OC[C@@H](O)CNCC[S@@](C)=O	ZINC000819032000	DC	On-Demand	Anodyne	ADRB2	51	50
COc1cccc(OC)c1OC[C@@H](O)CNCC[S@@](C)=O	ZINC000819032000	DC	On-Demand	Anodyne	ADRB1	65	47
COc1cccc(OC)c1OC[C@@H](O)CNCC[S@@](C)=O	ZINC000819032000	DC	On-Demand	Anodyne	ADRB3	33	40
COc1cccc(OC)c1OC[C@H](O)CNCC[S@@](C)=O	ZINC000819032001	DC	On-Demand	Anodyne	ADRB2	51	50
COc1cccc(OC)c1OC[C@H](O)CNCC[S@@](C)=O	ZINC000819032001	DC	On-Demand	Anodyne	ADRB1	65	47
COc1cccc(OC)c1OC[C@H](O)CNCC[S@@](C)=O	ZINC000819032001	DC	On-Demand	Anodyne	ADRB3	33	40
C[S@@](=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819032006	DD	On-Demand	Anodyne	ADRB2	59	67
C[S@@](=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819032006	DD	On-Demand	Anodyne	ADRB1	77	60
C[S@@](=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819032006	DD	On-Demand	Anodyne	ADRB3	39	60
C[S@@](=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819032006	DD	On-Demand	Anodyne	CASR	40	36
C[S@@](=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819032006	DD	On-Demand	Anodyne	CYP2D6	23	51
C[S@@](=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819032006	DD	On-Demand	Anodyne	ABCB1	28	47
C[S@](=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819032007	DD	On-Demand	Anodyne	ADRB2	59	67
C[S@](=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819032007	DD	On-Demand	Anodyne	ADRB1	77	60
C[S@](=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819032007	DD	On-Demand	Anodyne	ADRB3	39	60
C[S@](=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819032007	DD	On-Demand	Anodyne	CASR	40	36
C[S@](=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819032007	DD	On-Demand	Anodyne	CYP2D6	23	51
C[S@](=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819032007	DD	On-Demand	Anodyne	ABCB1	28	47
C[S@@](=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819032008	DD	On-Demand	Anodyne	ADRB2	59	67
C[S@@](=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819032008	DD	On-Demand	Anodyne	ADRB1	77	60
C[S@@](=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819032008	DD	On-Demand	Anodyne	ADRB3	39	60
C[S@@](=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819032008	DD	On-Demand	Anodyne	CASR	40	36
C[S@@](=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819032008	DD	On-Demand	Anodyne	CYP2D6	23	51
C[S@@](=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819032008	DD	On-Demand	Anodyne	ABCB1	28	47
C[S@](=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819032009	DD	On-Demand	Anodyne	ADRB2	59	67
C[S@](=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819032009	DD	On-Demand	Anodyne	ADRB1	77	60
C[S@](=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819032009	DD	On-Demand	Anodyne	ADRB3	39	60
C[S@](=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819032009	DD	On-Demand	Anodyne	CASR	40	36
C[S@](=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819032009	DD	On-Demand	Anodyne	CYP2D6	23	51
C[S@](=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819032009	DD	On-Demand	Anodyne	ABCB1	28	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=S)Nc1cc(Cl)ccc1OC)C2	ZINC000819032010	GG	On-Demand	Anodyne	RBP4	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=S)Nc1cc(Cl)ccc1OC)C2	ZINC000819032011	GG	On-Demand	Anodyne	RBP4	20	40
FC1(F)Oc2ccc(NC(=S)N[C@H]3C[C@@H]4C[C@@H]4C3)cc2O1	ZINC000819032012	DG	On-Demand	Anodyne	KIT	23	42
FC1(F)Oc2ccc(NC(=S)N[C@H]3C[C@@H]4C[C@@H]4C3)cc2O1	ZINC000819032012	DG	On-Demand	Anodyne	BRAF	19	42
FC1(F)Oc2ccc(NC(=S)NC3C[C@H]4C[C@@H]4C3)cc2O1	ZINC000819032013	DG	On-Demand	Anodyne	KIT	23	42
FC1(F)Oc2ccc(NC(=S)NC3C[C@H]4C[C@@H]4C3)cc2O1	ZINC000819032013	DG	On-Demand	Anodyne	BRAF	19	42
FC1(F)Oc2ccc(NC(=S)NC3C[C@@H]4C[C@H]4C3)cc2O1	ZINC000819032014	DG	On-Demand	Anodyne	KIT	23	42
FC1(F)Oc2ccc(NC(=S)NC3C[C@@H]4C[C@H]4C3)cc2O1	ZINC000819032014	DG	On-Demand	Anodyne	BRAF	19	42
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccc(F)c(F)c1	ZINC000819032042	GI	On-Demand	Anodyne	SLC6A3	28	48
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccc(F)c(F)c1	ZINC000819032042	GI	On-Demand	Anodyne	SIGMAR1	24	43
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccc(F)cc3F)C2)cc1	ZINC000819032046	GE	On-Demand	Anodyne	ADRB3	20	42
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3ccc(F)cc3F)C2)cc1	ZINC000819032047	GE	On-Demand	Anodyne	ADRB3	20	42
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3ccc(F)cc3F)C2)cc1	ZINC000819032048	GE	On-Demand	Anodyne	ADRB3	20	42
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3ccc(F)cc3F)C2)cc1	ZINC000819032049	GE	On-Demand	Anodyne	ADRB3	20	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](c1cccc(OC)c1)N(C)C)C2	ZINC000819032060	GE	On-Demand	Anodyne	MTNR1A	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](c1cccc(OC)c1)N(C)C)C2	ZINC000819032060	GE	On-Demand	Anodyne	MTNR1B	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](c1cccc(OC)c1)N(C)C)C2	ZINC000819032061	GE	On-Demand	Anodyne	MTNR1A	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](c1cccc(OC)c1)N(C)C)C2	ZINC000819032061	GE	On-Demand	Anodyne	MTNR1B	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](c1cccc(OC)c1)N(C)C)C2	ZINC000819032062	GE	On-Demand	Anodyne	MTNR1A	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](c1cccc(OC)c1)N(C)C)C2	ZINC000819032062	GE	On-Demand	Anodyne	MTNR1B	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](c1cccc(OC)c1)N(C)C)C2	ZINC000819032063	GE	On-Demand	Anodyne	MTNR1A	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](c1cccc(OC)c1)N(C)C)C2	ZINC000819032063	GE	On-Demand	Anodyne	MTNR1B	21	40
S=C(NCCc1cccnc1)N[C@@H]1CCC[C@H](C2CC2)C1	ZINC000819032068	DG	On-Demand	Anodyne	CHRNA7	42	36
S=C(NCCc1cccnc1)N[C@@H]1CCC[C@H](C2CC2)C1	ZINC000819032068	DG	On-Demand	Anodyne	NAMPT	26	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032069	GG	On-Demand	Anodyne	PTGER2	16	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032069	GG	On-Demand	Anodyne	PTGER4	23	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032069	GG	On-Demand	Anodyne	ST14	63	38
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032069	GG	On-Demand	Anodyne	CACNA1I	51	38
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032069	GG	On-Demand	Anodyne	GPR119	35	43
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032070	GG	On-Demand	Anodyne	PTGER2	16	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032070	GG	On-Demand	Anodyne	PTGER4	23	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032070	GG	On-Demand	Anodyne	ST14	63	38
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032070	GG	On-Demand	Anodyne	CACNA1I	51	38
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032070	GG	On-Demand	Anodyne	GPR119	35	43
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032071	GG	On-Demand	Anodyne	PTGER2	16	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032071	GG	On-Demand	Anodyne	PTGER4	23	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032071	GG	On-Demand	Anodyne	ST14	63	38
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032071	GG	On-Demand	Anodyne	CACNA1I	51	38
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032071	GG	On-Demand	Anodyne	GPR119	35	43
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032072	GG	On-Demand	Anodyne	PTGER2	16	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032072	GG	On-Demand	Anodyne	PTGER4	23	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032072	GG	On-Demand	Anodyne	ST14	63	38
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032072	GG	On-Demand	Anodyne	CACNA1I	51	38
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819032072	GG	On-Demand	Anodyne	GPR119	35	43
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2ccccc2Cl)C1	ZINC000819032117	FH	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2ccccc2Cl)C1	ZINC000819032117	FH	On-Demand	Anodyne	GPR119	35	43
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2ccccc2Cl)C1	ZINC000819032117	FH	On-Demand	Anodyne	SFRP1	21	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2ccccc2Cl)C1	ZINC000819032118	FH	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2ccccc2Cl)C1	ZINC000819032118	FH	On-Demand	Anodyne	GPR119	35	43
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2ccccc2Cl)C1	ZINC000819032118	FH	On-Demand	Anodyne	SFRP1	21	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2cccnc2)C1	ZINC000819032135	EE	On-Demand	Anodyne	ADRB2	23	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2cccnc2)C1	ZINC000819032135	EE	On-Demand	Anodyne	ADRB1	35	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2cccnc2)C1	ZINC000819032135	EE	On-Demand	Anodyne	ADRB3	109	45
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2cccnc2)C1	ZINC000819032135	EE	On-Demand	Anodyne	GPR119	44	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2cccnc2)C1	ZINC000819032136	EE	On-Demand	Anodyne	ADRB2	23	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2cccnc2)C1	ZINC000819032136	EE	On-Demand	Anodyne	ADRB1	35	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2cccnc2)C1	ZINC000819032136	EE	On-Demand	Anodyne	ADRB3	109	45
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2cccnc2)C1	ZINC000819032136	EE	On-Demand	Anodyne	GPR119	44	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2cccnc2)C1	ZINC000819032137	EE	On-Demand	Anodyne	ADRB2	23	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2cccnc2)C1	ZINC000819032137	EE	On-Demand	Anodyne	ADRB1	35	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2cccnc2)C1	ZINC000819032137	EE	On-Demand	Anodyne	ADRB3	109	45
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2cccnc2)C1	ZINC000819032137	EE	On-Demand	Anodyne	GPR119	44	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2cccnc2)C1	ZINC000819032138	EE	On-Demand	Anodyne	ADRB2	23	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2cccnc2)C1	ZINC000819032138	EE	On-Demand	Anodyne	ADRB1	35	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2cccnc2)C1	ZINC000819032138	EE	On-Demand	Anodyne	ADRB3	109	45
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2cccnc2)C1	ZINC000819032138	EE	On-Demand	Anodyne	GPR119	44	41
C[S@@](=O)CCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819032157	DC	On-Demand	Bother	ADRB2	40	52
C[S@@](=O)CCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819032157	DC	On-Demand	Bother	ADRB1	63	52
C[S@@](=O)CCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819032157	DC	On-Demand	Bother	ADRB3	37	52
C[S@](=O)CCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819032158	DC	On-Demand	Bother	ADRB2	40	52
C[S@](=O)CCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819032158	DC	On-Demand	Bother	ADRB1	63	52
C[S@](=O)CCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819032158	DC	On-Demand	Bother	ADRB3	37	52
C[S@@](=O)CCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819032159	DC	On-Demand	Bother	ADRB2	40	52
C[S@@](=O)CCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819032159	DC	On-Demand	Bother	ADRB1	63	52
C[S@@](=O)CCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819032159	DC	On-Demand	Bother	ADRB3	37	52
C[S@](=O)CCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819032160	DC	On-Demand	Bother	ADRB2	40	52
C[S@](=O)CCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819032160	DC	On-Demand	Bother	ADRB1	63	52
C[S@](=O)CCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819032160	DC	On-Demand	Bother	ADRB3	37	52
O=C(COC(=O)CSc1ccccc1[N+](=O)[O-])Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819032178	JG	On-Demand	Bother	COLA	40	34
O=C(COC(=O)CSc1ccccc1[N+](=O)[O-])Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819032178	JG	On-Demand	Bother	TGM2	69	40
O=C(COC(=O)CSc1ccccc1[N+](=O)[O-])Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819032178	JG	On-Demand	Bother	F13A1	94	42
O=C(COC(=O)CSc1ccccc1[N+](=O)[O-])Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819032178	JG	On-Demand	Bother	NAMPT	30	46
C=C(Cl)CSc1nc(C)c(CC(=O)NC[C@H]2CCCN2CC)s1	ZINC000819032212	FG	On-Demand	Mild	DRD2	31	40
C=C(Cl)CSc1nc(C)c(CC(=O)NC[C@@H]2CCCN2CC)s1	ZINC000819032213	FG	On-Demand	Mild	DRD2	31	40
C/C=C/c1ccc(OC[C@H](O)CNCC[S@](C)=O)c(OC)c1	ZINC000819032214	ED	On-Demand	Anodyne	ADRB2	22	65
C/C=C/c1ccc(OC[C@H](O)CNCC[S@](C)=O)c(OC)c1	ZINC000819032214	ED	On-Demand	Anodyne	ADRB1	22	65
C/C=C\c1ccc(OC[C@H](O)CNCC[S@](C)=O)c(OC)c1	ZINC000819032215	ED	On-Demand	Anodyne	ADRB2	22	65
C/C=C\c1ccc(OC[C@H](O)CNCC[S@](C)=O)c(OC)c1	ZINC000819032215	ED	On-Demand	Anodyne	ADRB1	22	65
C/C=C/c1ccc(OC[C@H](O)CNCC[S@@](C)=O)c(OC)c1	ZINC000819032216	ED	On-Demand	Anodyne	ADRB2	22	65
C/C=C/c1ccc(OC[C@H](O)CNCC[S@@](C)=O)c(OC)c1	ZINC000819032216	ED	On-Demand	Anodyne	ADRB1	22	65
C/C=C\c1ccc(OC[C@H](O)CNCC[S@@](C)=O)c(OC)c1	ZINC000819032217	ED	On-Demand	Anodyne	ADRB2	22	65
C/C=C\c1ccc(OC[C@H](O)CNCC[S@@](C)=O)c(OC)c1	ZINC000819032217	ED	On-Demand	Anodyne	ADRB1	22	65
CCN1CCC(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819032218	FE	On-Demand	Mild	PAPA1_CARPA	38	49
CCN1CCC(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819032218	FE	On-Demand	Mild	CTSK	17	48
CCN1CCC(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819032219	FE	On-Demand	Mild	PAPA1_CARPA	38	49
CCN1CCC(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819032219	FE	On-Demand	Mild	CTSK	17	48
C[S@@](=O)CCNC[C@@H](O)COC(c1ccccc1)c1ccccc1	ZINC000819032233	EE	On-Demand	Anodyne	CASR	20	46
C[S@](=O)CCNC[C@@H](O)COC(c1ccccc1)c1ccccc1	ZINC000819032234	EE	On-Demand	Anodyne	CASR	20	46
C[S@@](=O)CCNC[C@H](O)COC(c1ccccc1)c1ccccc1	ZINC000819032235	EE	On-Demand	Anodyne	CASR	20	46
C[S@](=O)CCNC[C@H](O)COC(c1ccccc1)c1ccccc1	ZINC000819032236	EE	On-Demand	Anodyne	CASR	20	46
C[S@](=O)CCNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819032237	DE	On-Demand	Anodyne	LCK	25	40
C[S@](=O)CCNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819032237	DE	On-Demand	Anodyne	BTK	18	40
C[S@](=O)CCNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819032237	DE	On-Demand	Anodyne	KCNK3	26	43
C[S@@](=O)CCNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819032238	DE	On-Demand	Anodyne	LCK	25	40
C[S@@](=O)CCNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819032238	DE	On-Demand	Anodyne	BTK	18	40
C[S@@](=O)CCNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819032238	DE	On-Demand	Anodyne	KCNK3	26	43
CCNC(=S)NCc1cc(O[C@H]2CCN(C(=O)OC(C)(C)C)C2)ccn1	ZINC000819032241	GE	On-Demand	Anodyne	GPR119	45	39
O=C(NCCCN1CCCCCC1)C(F)=C1CCC1	ZINC000819032246	CF	On-Demand	Anodyne	CHRNA7	15	42
N#CCN1CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819032269	CD	On-Demand	Mild	OPRL1	33	44
Cc1c(F)cccc1NC(=O)CCNCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819032270	GH	On-Demand	Anodyne	GPR119	45	44
Cc1c(F)cccc1NC(=O)CCNCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819032272	GH	On-Demand	Anodyne	GPR119	45	44
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2F)C1)c1ccccc1	ZINC000819032281	DF	On-Demand	Anodyne	NPY2R	61	38
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2F)C1)c1ccccc1	ZINC000819032283	DF	On-Demand	Anodyne	NPY2R	61	38
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2F)C1)c1ccccc1	ZINC000819032285	DF	On-Demand	Anodyne	NPY2R	61	38
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2F)C1)c1ccccc1	ZINC000819032286	DF	On-Demand	Anodyne	NPY2R	61	38
O=S(=O)(CCNC[C@H](O)c1cccc(C(F)(F)F)c1)N1CCSCC1	ZINC000819032305	GD	On-Demand	Anodyne	ADRB3	42	39
O=S(=O)(CCNC[C@H](O)c1cccc(C(F)(F)F)c1)N1CCSCC1	ZINC000819032305	GD	On-Demand	Anodyne	CACNA1B	43	30
O=S(=O)(CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)N1CCSCC1	ZINC000819032306	GD	On-Demand	Anodyne	ADRB3	42	39
O=S(=O)(CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)N1CCSCC1	ZINC000819032306	GD	On-Demand	Anodyne	CACNA1B	43	30
O=C(NC[C@H]1CN(Cc2ccccc2)CCO1)C(F)=C1CCC1	ZINC000819032321	DE	On-Demand	Anodyne	DRD4	28	50
O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)C(F)=C1CCC1	ZINC000819032322	DE	On-Demand	Anodyne	DRD4	28	50
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2ccccc2F)C1	ZINC000819032350	FG	On-Demand	Anodyne	GPR119	45	49
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2ccccc2F)C1	ZINC000819032350	FG	On-Demand	Anodyne	SFRP1	17	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2ccccc2F)C1	ZINC000819032351	FG	On-Demand	Anodyne	GPR119	45	49
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2ccccc2F)C1	ZINC000819032351	FG	On-Demand	Anodyne	SFRP1	17	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2ccccc2F)C1	ZINC000819032352	FG	On-Demand	Anodyne	GPR119	45	49
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2ccccc2F)C1	ZINC000819032352	FG	On-Demand	Anodyne	SFRP1	17	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2ccccc2F)C1	ZINC000819032353	FG	On-Demand	Anodyne	GPR119	45	49
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2ccccc2F)C1	ZINC000819032353	FG	On-Demand	Anodyne	SFRP1	17	40
CCNC(=S)NCc1cc(O[C@@H]2CCN(C(=O)OC(C)(C)C)C2)ccn1	ZINC000819032358	GE	On-Demand	Anodyne	GPR119	45	39
CC(=O)c1ccc(NC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819032369	CF	On-Demand	Anodyne	EPHX2	24	47
CC(=O)c1ccc(NC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819032371	CF	On-Demand	Anodyne	EPHX2	24	47
CC(=O)c1ccc(NC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819032373	CF	On-Demand	Anodyne	EPHX2	24	47
FC(F)(F)c1cccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)c1	ZINC000819032393	DG	On-Demand	Anodyne	CCR2	47	42
FC(F)(F)c1cccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000819032394	DG	On-Demand	Anodyne	CCR2	47	42
FC(F)(F)c1cccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)c1	ZINC000819032395	DG	On-Demand	Anodyne	CCR2	47	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)CC2CCCC2)C1	ZINC000819032401	EG	On-Demand	Anodyne	GPR119	26	40
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(CN2CCOCC2)cc1	ZINC000819032403	ED	On-Demand	Anodyne	SIGMAR1	15	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)CC2CCCC2)C1	ZINC000819032404	EG	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)CC2CCCC2)C1	ZINC000819032405	EG	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)CC2CCCC2)C1	ZINC000819032406	EG	On-Demand	Anodyne	GPR119	26	40
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(CN2CCOCC2)cc1	ZINC000819032407	ED	On-Demand	Anodyne	SIGMAR1	15	40
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(CN2CCOCC2)cc1	ZINC000819032411	ED	On-Demand	Anodyne	SIGMAR1	15	40
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2F)C1)c1ccc(Cl)cc1	ZINC000819032412	FH	On-Demand	Anodyne	ADRB3	22	44
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2F)C1)c1ccc(Cl)cc1	ZINC000819032413	FH	On-Demand	Anodyne	ADRB3	22	44
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(CN2CCOCC2)cc1	ZINC000819032414	ED	On-Demand	Anodyne	SIGMAR1	15	40
CCN1CCC[C@@H]1CNC(=S)N[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819032439	FD	On-Demand	Anodyne	DRD2	33	43
CCN1CCC[C@@H]1CNC(=S)N[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819032441	FD	On-Demand	Anodyne	DRD2	33	43
CNC(=S)NCc1cc(O[C@H]2CCN(C(=O)OC(C)(C)C)C2)ccn1	ZINC000819032453	FE	On-Demand	Anodyne	GPR119	43	39
CNC(=S)NCc1cc(O[C@@H]2CCN(C(=O)OC(C)(C)C)C2)ccn1	ZINC000819032454	FE	On-Demand	Anodyne	GPR119	43	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=S)N[C@@H](C)Cc1ccccc1)C2	ZINC000819032455	FF	On-Demand	Anodyne	ACE	41	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=S)N[C@@H](C)Cc1ccccc1)C2	ZINC000819032455	FF	On-Demand	Anodyne	XIAP	15	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=S)N[C@@H](C)Cc1ccccc1)C2	ZINC000819032455	FF	On-Demand	Anodyne	BIRC2	20	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=S)N[C@H](C)Cc1ccccc1)C2	ZINC000819032457	FF	On-Demand	Anodyne	ACE	41	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=S)N[C@H](C)Cc1ccccc1)C2	ZINC000819032457	FF	On-Demand	Anodyne	XIAP	15	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=S)N[C@H](C)Cc1ccccc1)C2	ZINC000819032457	FF	On-Demand	Anodyne	BIRC2	20	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=S)N[C@@H](C)Cc1ccccc1)C2	ZINC000819032459	FF	On-Demand	Anodyne	ACE	41	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=S)N[C@@H](C)Cc1ccccc1)C2	ZINC000819032459	FF	On-Demand	Anodyne	XIAP	15	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=S)N[C@@H](C)Cc1ccccc1)C2	ZINC000819032459	FF	On-Demand	Anodyne	BIRC2	20	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=S)N[C@H](C)Cc1ccccc1)C2	ZINC000819032461	FF	On-Demand	Anodyne	ACE	41	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=S)N[C@H](C)Cc1ccccc1)C2	ZINC000819032461	FF	On-Demand	Anodyne	XIAP	15	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=S)N[C@H](C)Cc1ccccc1)C2	ZINC000819032461	FF	On-Demand	Anodyne	BIRC2	20	44
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccc(F)cc1	ZINC000819032478	GI	On-Demand	Anodyne	SLC6A4	20	59
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccc(F)cc1	ZINC000819032478	GI	On-Demand	Anodyne	SLC6A3	50	59
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccc(F)cc1	ZINC000819032478	GI	On-Demand	Anodyne	SIGMAR1	35	56
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccc(F)cc1	ZINC000819032478	GI	On-Demand	Anodyne	CCR3	49	44
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccc(F)cc1	ZINC000819032478	GI	On-Demand	Anodyne	CACNA1G	41	39
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccc(F)cc1	ZINC000819032480	GI	On-Demand	Anodyne	SLC6A4	20	59
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccc(F)cc1	ZINC000819032480	GI	On-Demand	Anodyne	SLC6A3	50	59
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccc(F)cc1	ZINC000819032480	GI	On-Demand	Anodyne	SIGMAR1	35	56
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccc(F)cc1	ZINC000819032480	GI	On-Demand	Anodyne	CCR3	49	44
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccc(F)cc1	ZINC000819032480	GI	On-Demand	Anodyne	CACNA1G	41	39
CCOc1ccc(OC[C@@H](O)CNCC[S@@](C)=O)cc1	ZINC000819032503	DC	On-Demand	Anodyne	ADRB2	59	50
CCOc1ccc(OC[C@@H](O)CNCC[S@@](C)=O)cc1	ZINC000819032503	DC	On-Demand	Anodyne	ADRB1	85	49
CCOc1ccc(OC[C@@H](O)CNCC[S@@](C)=O)cc1	ZINC000819032503	DC	On-Demand	Anodyne	GRIN1	15	43
CCOc1ccc(OC[C@@H](O)CNCC[S@@](C)=O)cc1	ZINC000819032503	DC	On-Demand	Anodyne	ADRB3	53	49
CCOc1ccc(OC[C@H](O)CNCC[S@@](C)=O)cc1	ZINC000819032504	DC	On-Demand	Anodyne	ADRB2	59	50
CCOc1ccc(OC[C@H](O)CNCC[S@@](C)=O)cc1	ZINC000819032504	DC	On-Demand	Anodyne	ADRB1	85	49
CCOc1ccc(OC[C@H](O)CNCC[S@@](C)=O)cc1	ZINC000819032504	DC	On-Demand	Anodyne	GRIN1	15	43
CCOc1ccc(OC[C@H](O)CNCC[S@@](C)=O)cc1	ZINC000819032504	DC	On-Demand	Anodyne	ADRB3	53	49
CCOc1ccc(OC[C@H](O)CNCC[S@](C)=O)cc1	ZINC000819032505	DC	On-Demand	Anodyne	ADRB2	59	50
CCOc1ccc(OC[C@H](O)CNCC[S@](C)=O)cc1	ZINC000819032505	DC	On-Demand	Anodyne	ADRB1	85	49
CCOc1ccc(OC[C@H](O)CNCC[S@](C)=O)cc1	ZINC000819032505	DC	On-Demand	Anodyne	GRIN1	15	43
CCOc1ccc(OC[C@H](O)CNCC[S@](C)=O)cc1	ZINC000819032505	DC	On-Demand	Anodyne	ADRB3	53	49
CCOc1ccc(OC[C@@H](O)CNCC[S@](C)=O)cc1	ZINC000819032506	DC	On-Demand	Anodyne	ADRB2	59	50
CCOc1ccc(OC[C@@H](O)CNCC[S@](C)=O)cc1	ZINC000819032506	DC	On-Demand	Anodyne	ADRB1	85	49
CCOc1ccc(OC[C@@H](O)CNCC[S@](C)=O)cc1	ZINC000819032506	DC	On-Demand	Anodyne	GRIN1	15	43
CCOc1ccc(OC[C@@H](O)CNCC[S@](C)=O)cc1	ZINC000819032506	DC	On-Demand	Anodyne	ADRB3	53	49
C[S@@](=O)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819032511	CD	On-Demand	Anodyne	ADRB2	61	42
C[S@@](=O)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819032511	CD	On-Demand	Anodyne	ADRB1	67	53
C[S@@](=O)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819032511	CD	On-Demand	Anodyne	ADRB3	79	53
C[S@](=O)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819032512	CD	On-Demand	Anodyne	ADRB2	61	42
C[S@](=O)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819032512	CD	On-Demand	Anodyne	ADRB1	67	53
C[S@](=O)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819032512	CD	On-Demand	Anodyne	ADRB3	79	53
C[S@@](=O)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819032513	CD	On-Demand	Anodyne	ADRB2	61	42
C[S@@](=O)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819032513	CD	On-Demand	Anodyne	ADRB1	67	53
C[S@@](=O)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819032513	CD	On-Demand	Anodyne	ADRB3	79	53
C[S@](=O)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819032514	CD	On-Demand	Anodyne	ADRB2	61	42
C[S@](=O)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819032514	CD	On-Demand	Anodyne	ADRB1	67	53
C[S@](=O)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819032514	CD	On-Demand	Anodyne	ADRB3	79	53
C[S@@](=O)CCNC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819032528	CC	On-Demand	Anodyne	NOD2	40	34
C[S@@](=O)CCNC[C@H](O)CN1CCc2ccccc2C1	ZINC000819032529	CC	On-Demand	Anodyne	NOD2	40	34
C[S@](=O)CCNC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819032530	CC	On-Demand	Anodyne	NOD2	40	34
C[S@](=O)CCNC[C@H](O)CN1CCc2ccccc2C1	ZINC000819032531	CC	On-Demand	Anodyne	NOD2	40	34
C[S@@](=O)CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819032532	CC	On-Demand	Anodyne	ADRB2	36	63
C[S@@](=O)CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819032532	CC	On-Demand	Anodyne	ADRB1	67	63
C[S@@](=O)CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819032532	CC	On-Demand	Anodyne	ADRB3	24	63
C[S@@](=O)CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819032532	CC	On-Demand	Anodyne	CYP2D6	18	47
C[S@](=O)CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819032533	CC	On-Demand	Anodyne	ADRB2	36	63
C[S@](=O)CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819032533	CC	On-Demand	Anodyne	ADRB1	67	63
C[S@](=O)CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819032533	CC	On-Demand	Anodyne	ADRB3	24	63
C[S@](=O)CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819032533	CC	On-Demand	Anodyne	CYP2D6	18	47
C[S@@](=O)CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819032534	CC	On-Demand	Anodyne	ADRB2	36	63
C[S@@](=O)CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819032534	CC	On-Demand	Anodyne	ADRB1	67	63
C[S@@](=O)CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819032534	CC	On-Demand	Anodyne	ADRB3	24	63
C[S@@](=O)CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819032534	CC	On-Demand	Anodyne	CYP2D6	18	47
C[S@](=O)CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819032535	CC	On-Demand	Anodyne	ADRB2	36	63
C[S@](=O)CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819032535	CC	On-Demand	Anodyne	ADRB1	67	63
C[S@](=O)CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819032535	CC	On-Demand	Anodyne	ADRB3	24	63
C[S@](=O)CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819032535	CC	On-Demand	Anodyne	CYP2D6	18	47
C[S@](=O)CCNC[C@@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819032539	GE	On-Demand	Anodyne	SLC6A3	24	42
C[S@@](=O)CCNC[C@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819032540	GE	On-Demand	Anodyne	SLC6A3	24	42
C[S@](=O)CCNC[C@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819032541	GE	On-Demand	Anodyne	SLC6A3	24	42
COc1ccc(OC)c([C@H](O)CNCCc2c(C)noc2C)c1	ZINC000819032559	DE	On-Demand	Anodyne	ADRB2	16	46
C=CCC1(C(=O)Oc2cccc(NC(C)=O)c2)CCOCC1	ZINC000819032560	DF	On-Demand	Mild	LIMK2	22	42
O[C@@H](CNCCCc1c[nH]c2ccccc12)C1CC1	ZINC000819032573	CE	On-Demand	Anodyne	HTR1D	41	35
O[C@@H](CNCCCc1c[nH]c2ccccc12)C1CC1	ZINC000819032573	CE	On-Demand	Anodyne	HTR1B	34	43
O[C@@H](CNCCCc1c[nH]c2ccccc12)C1CC1	ZINC000819032573	CE	On-Demand	Anodyne	MPO	63	43
O[C@@H](CNCCCc1c[nH]c2ccccc12)C1CC1	ZINC000819032573	CE	On-Demand	Anodyne	MMP9	15	43
O[C@H](CNCCCc1c[nH]c2ccccc12)C1CC1	ZINC000819032574	CE	On-Demand	Anodyne	HTR1D	41	35
O[C@H](CNCCCc1c[nH]c2ccccc12)C1CC1	ZINC000819032574	CE	On-Demand	Anodyne	HTR1B	34	43
O[C@H](CNCCCc1c[nH]c2ccccc12)C1CC1	ZINC000819032574	CE	On-Demand	Anodyne	MPO	63	43
O[C@H](CNCCCc1c[nH]c2ccccc12)C1CC1	ZINC000819032574	CE	On-Demand	Anodyne	MMP9	15	43
C=C(C)C(C)(C)C(=O)Oc1ccc(NC(C)=O)cc1	ZINC000819032575	CG	On-Demand	Mild	ACR	42	43
CN(C)c1ccc(NC(=O)CCNCCCc2c[nH]c3ccccc23)cc1	ZINC000819032589	FH	On-Demand	Anodyne	MPO	48	39
CN(C)c1ccc(NC(=O)CCNCCCc2c[nH]c3ccccc23)cc1	ZINC000819032589	FH	On-Demand	Anodyne	NMBR	57	39
CN(C)c1ccc(NC(=O)CCNCCCc2c[nH]c3ccccc23)cc1	ZINC000819032589	FH	On-Demand	Anodyne	GRIA1	19	43
CN(C)c1ccc(NC(=O)CCNCCCc2c[nH]c3ccccc23)cc1	ZINC000819032589	FH	On-Demand	Anodyne	HDAC1	15	51
CN(C)c1ccc(NC(=O)CCNCCCc2c[nH]c3ccccc23)cc1	ZINC000819032589	FH	On-Demand	Anodyne	MMP9	16	42
O[C@H](CNC1CCC1)c1ccc(F)c(Br)c1	ZINC000819032590	CF	On-Demand	Anodyne	ADRB3	24	40
O[C@@H](CNC1CCC1)c1ccc(F)c(Br)c1	ZINC000819032591	CF	On-Demand	Anodyne	ADRB3	24	40
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cccnc1	ZINC000819032595	CF	On-Demand	Anodyne	ADRB2	49	46
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cccnc1	ZINC000819032595	CF	On-Demand	Anodyne	ADRB1	44	43
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cccnc1	ZINC000819032595	CF	On-Demand	Anodyne	ADRB3	117	58
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cccnc1	ZINC000819032595	CF	On-Demand	Anodyne	MPO	45	41
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cccnc1	ZINC000819032595	CF	On-Demand	Anodyne	BRS3	19	43
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cccnc1	ZINC000819032596	CF	On-Demand	Anodyne	ADRB2	49	46
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cccnc1	ZINC000819032596	CF	On-Demand	Anodyne	ADRB1	44	43
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cccnc1	ZINC000819032596	CF	On-Demand	Anodyne	ADRB3	117	58
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cccnc1	ZINC000819032596	CF	On-Demand	Anodyne	MPO	45	41
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cccnc1	ZINC000819032596	CF	On-Demand	Anodyne	BRS3	19	43
O=C(COC(=O)CSc1ccccc1[N+](=O)[O-])Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000819032599	JF	On-Demand	Bother	F13A1	55	43
CON(C)C(=O)CCNCCCc1c[nH]c2ccccc12	ZINC000819032623	CE	On-Demand	Anodyne	HTR1D	23	40
CON(C)C(=O)CCNCCCc1c[nH]c2ccccc12	ZINC000819032623	CE	On-Demand	Anodyne	HTR1B	21	40
CON(C)C(=O)CCNCCCc1c[nH]c2ccccc12	ZINC000819032623	CE	On-Demand	Anodyne	TACR1	26	40
CON(C)C(=O)CCNCCCc1c[nH]c2ccccc12	ZINC000819032623	CE	On-Demand	Anodyne	CCKAR	56	40
CON(C)C(=O)CCNCCCc1c[nH]c2ccccc12	ZINC000819032623	CE	On-Demand	Anodyne	MPO	62	41
CON(C)C(=O)CCNCCCc1c[nH]c2ccccc12	ZINC000819032623	CE	On-Demand	Anodyne	NMBR	21	42
CON(C)C(=O)CCNCCCc1c[nH]c2ccccc12	ZINC000819032623	CE	On-Demand	Anodyne	GRIA1	19	43
CON(C)C(=O)CCNCCCc1c[nH]c2ccccc12	ZINC000819032623	CE	On-Demand	Anodyne	CCKBR	54	36
CON(C)C(=O)CCNCCCc1c[nH]c2ccccc12	ZINC000819032623	CE	On-Demand	Anodyne	GHSR	42	36
CON(C)C(=O)CCNCCCc1c[nH]c2ccccc12	ZINC000819032623	CE	On-Demand	Anodyne	ALOX15	15	42
CON(C)C(=O)CCNCCCc1c[nH]c2ccccc12	ZINC000819032623	CE	On-Demand	Anodyne	MMP9	16	45
CON(C)C(=O)CCNCCCc1c[nH]c2ccccc12	ZINC000819032623	CE	On-Demand	Anodyne	MC1R	21	40
COc1cc(C)ccc1OC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819032624	FG	On-Demand	Mild	PAPA1_CARPA	44	44
COc1cc(C)ccc1OC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819032625	FG	On-Demand	Mild	PAPA1_CARPA	44	44
O[C@H](CN[C@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1cccnc1	ZINC000819032641	FH	On-Demand	Anodyne	ADRB3	63	38
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032644	ED	On-Demand	Anodyne	HTR1A	19	51
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032644	ED	On-Demand	Anodyne	DRD2	28	40
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032644	ED	On-Demand	Anodyne	DRD4	44	40
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032644	ED	On-Demand	Anodyne	ACHE	41	43
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032644	ED	On-Demand	Anodyne	DRD3	30	44
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032644	ED	On-Demand	Anodyne	SIGMAR1	62	48
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032644	ED	On-Demand	Anodyne	PLD1	52	35
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032644	ED	On-Demand	Anodyne	PLD2	51	35
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032644	ED	On-Demand	Anodyne	CYP2J2	44	31
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032645	ED	On-Demand	Anodyne	HTR1A	19	51
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032645	ED	On-Demand	Anodyne	DRD2	28	40
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032645	ED	On-Demand	Anodyne	DRD4	44	40
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032645	ED	On-Demand	Anodyne	ACHE	41	43
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032645	ED	On-Demand	Anodyne	DRD3	30	44
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032645	ED	On-Demand	Anodyne	SIGMAR1	62	48
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032645	ED	On-Demand	Anodyne	PLD1	52	35
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032645	ED	On-Demand	Anodyne	PLD2	51	35
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032645	ED	On-Demand	Anodyne	CYP2J2	44	31
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032646	ED	On-Demand	Anodyne	HTR1A	19	51
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032646	ED	On-Demand	Anodyne	DRD2	28	40
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032646	ED	On-Demand	Anodyne	DRD4	44	40
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032646	ED	On-Demand	Anodyne	ACHE	41	43
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032646	ED	On-Demand	Anodyne	DRD3	30	44
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032646	ED	On-Demand	Anodyne	SIGMAR1	62	48
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032646	ED	On-Demand	Anodyne	PLD1	52	35
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032646	ED	On-Demand	Anodyne	PLD2	51	35
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032646	ED	On-Demand	Anodyne	CYP2J2	44	31
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032647	ED	On-Demand	Anodyne	HTR1A	19	51
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032647	ED	On-Demand	Anodyne	DRD2	28	40
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032647	ED	On-Demand	Anodyne	DRD4	44	40
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032647	ED	On-Demand	Anodyne	ACHE	41	43
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032647	ED	On-Demand	Anodyne	DRD3	30	44
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032647	ED	On-Demand	Anodyne	SIGMAR1	62	48
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032647	ED	On-Demand	Anodyne	PLD1	52	35
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032647	ED	On-Demand	Anodyne	PLD2	51	35
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(Cc2ccccc2)CC1	ZINC000819032647	ED	On-Demand	Anodyne	CYP2J2	44	31
CC(=O)c1ccc(NC(=S)N[C@@H]2CCC[C@H](C3CC3)C2)cc1	ZINC000819032651	DI	On-Demand	Anodyne	EPHX2	20	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)C2CCCCC2)C1	ZINC000819032676	EG	On-Demand	Anodyne	GPR119	26	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)C2CCCCC2)C1	ZINC000819032677	EG	On-Demand	Anodyne	GPR119	26	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)C2CCCCC2)C1	ZINC000819032678	EG	On-Demand	Anodyne	GPR119	26	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)C2CCCCC2)C1	ZINC000819032679	EG	On-Demand	Anodyne	GPR119	26	42
COc1ccc(OCC(F)(F)C(F)F)c(C(=O)Nc2cc(C)on2)c1	ZINC000819032690	FH	On-Demand	Anodyne	LUCI_LUCLA	16	42
CN(C)[C@@H](CNC(=O)C(F)=C1CCC1)Cc1ccccc1	ZINC000819032698	CF	On-Demand	Anodyne	MME	42	34
C[S@@](=O)CCNC[C@@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819032718	GE	On-Demand	Anodyne	SLC6A3	24	42
Fc1ccc(NC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1Cl	ZINC000819032747	CH	On-Demand	Anodyne	ENV	41	35
Fc1ccc(NC(=S)NC2C[C@H]3C[C@@H]3C2)cc1Cl	ZINC000819032750	CH	On-Demand	Anodyne	ENV	41	35
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819032751	GG	On-Demand	Anodyne	ADRB2	30	50
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819032751	GG	On-Demand	Anodyne	ADRB1	55	38
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819032751	GG	On-Demand	Anodyne	ADRB3	29	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819032751	GG	On-Demand	Anodyne	ABCB1	40	46
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819032751	GG	On-Demand	Anodyne	GPR119	33	41
Fc1ccc(NC(=S)NC2C[C@@H]3C[C@H]3C2)cc1Cl	ZINC000819032752	CH	On-Demand	Anodyne	ENV	41	35
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819032755	GG	On-Demand	Anodyne	ADRB2	30	50
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819032755	GG	On-Demand	Anodyne	ADRB1	55	38
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819032755	GG	On-Demand	Anodyne	ADRB3	29	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819032755	GG	On-Demand	Anodyne	ABCB1	40	46
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819032755	GG	On-Demand	Anodyne	GPR119	33	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819032756	GG	On-Demand	Anodyne	ADRB2	30	50
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819032756	GG	On-Demand	Anodyne	ADRB1	55	38
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819032756	GG	On-Demand	Anodyne	ADRB3	29	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819032756	GG	On-Demand	Anodyne	ABCB1	40	46
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819032756	GG	On-Demand	Anodyne	GPR119	33	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819032758	GG	On-Demand	Anodyne	ADRB2	30	50
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819032758	GG	On-Demand	Anodyne	ADRB1	55	38
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819032758	GG	On-Demand	Anodyne	ADRB3	29	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819032758	GG	On-Demand	Anodyne	ABCB1	40	46
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819032758	GG	On-Demand	Anodyne	GPR119	33	41
FC(F)(F)Oc1cccc(NC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000819032763	DH	On-Demand	Anodyne	EPHX2	26	40
FC(F)(F)Oc1cccc(NC(=S)NC2C[C@@H]3C[C@H]3C2)c1	ZINC000819032765	DH	On-Demand	Anodyne	EPHX2	26	40
FC(F)(F)Oc1cccc(NC(=S)NC2C[C@H]3C[C@@H]3C2)c1	ZINC000819032767	DH	On-Demand	Anodyne	EPHX2	26	40
CC(C)(C)OC(=O)N1CC[C@H](CCNCCC(=O)Nc2cc(F)cc(F)c2)C1	ZINC000819032790	GH	On-Demand	Anodyne	GPR119	37	47
CCN1CCC[C@@H]1CNC(=O)/C=C/[C@@H]1CCCO1	ZINC000819032791	CD	On-Demand	Anodyne	DRD2	32	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNCCC(=O)Nc2cc(F)cc(F)c2)C1	ZINC000819032792	GH	On-Demand	Anodyne	GPR119	37	47
CCN1CCC[C@@H]1CNC(=O)/C=C\[C@H]1CCCO1	ZINC000819032793	CD	On-Demand	Anodyne	DRD2	32	42
CCN1CCC[C@@H]1CNC(=O)/C=C/[C@H]1CCCO1	ZINC000819032795	CD	On-Demand	Anodyne	DRD2	32	42
CCN1CCC[C@@H]1CNC(=O)/C=C\[C@@H]1CCCO1	ZINC000819032796	CD	On-Demand	Anodyne	DRD2	32	42
CCN1CCC[C@@H]1CNC(=O)C(F)=C1CCC1	ZINC000819032805	BD	On-Demand	Anodyne	DRD2	35	47
CCN1CCC[C@H]1CNC(=O)C(F)=C1CCC1	ZINC000819032806	BD	On-Demand	Anodyne	DRD2	35	47
CC(C)CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819032807	FE	On-Demand	Mild	PAPA1_CARPA	34	42
CC(C)CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819032811	FE	On-Demand	Mild	PAPA1_CARPA	34	42
CC(C)(C)OC(=O)N1CC[C@H](CCNCCC(=O)Nc2cccc(F)c2)C1	ZINC000819032816	GG	On-Demand	Anodyne	CCR3	43	43
CC(C)(C)OC(=O)N1CC[C@H](CCNCCC(=O)Nc2cccc(F)c2)C1	ZINC000819032816	GG	On-Demand	Anodyne	GPR119	39	47
CC(C)(C)OC(=O)N1CC[C@@H](CCNCCC(=O)Nc2cccc(F)c2)C1	ZINC000819032818	GG	On-Demand	Anodyne	CCR3	43	43
CC(C)(C)OC(=O)N1CC[C@@H](CCNCCC(=O)Nc2cccc(F)c2)C1	ZINC000819032818	GG	On-Demand	Anodyne	GPR119	39	47
N#Cc1ccc([C@H](O)CNCCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819032825	GG	On-Demand	Mild	HTR1A	59	52
N#Cc1ccc([C@H](O)CNCCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819032825	GG	On-Demand	Mild	DRD2	41	52
N#Cc1ccc([C@H](O)CNCCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819032825	GG	On-Demand	Mild	DRD4	42	35
N#Cc1ccc([C@H](O)CNCCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819032825	GG	On-Demand	Mild	HTR2A	54	52
N#Cc1ccc([C@H](O)CNCCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819032825	GG	On-Demand	Mild	HTR2C	26	51
N#Cc1ccc([C@H](O)CNCCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819032825	GG	On-Demand	Mild	SLC6A4	16	47
N#Cc1ccc([C@H](O)CNCCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819032825	GG	On-Demand	Mild	ADRA1A	16	41
N#Cc1ccc([C@H](O)CNCCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819032825	GG	On-Demand	Mild	DRD3	54	45
N#Cc1ccc([C@H](O)CNCCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819032825	GG	On-Demand	Mild	HTR7	59	46
N#Cc1ccc([C@@H](O)CNCCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819032827	GG	On-Demand	Mild	HTR1A	59	52
N#Cc1ccc([C@@H](O)CNCCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819032827	GG	On-Demand	Mild	DRD2	41	52
N#Cc1ccc([C@@H](O)CNCCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819032827	GG	On-Demand	Mild	DRD4	42	35
N#Cc1ccc([C@@H](O)CNCCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819032827	GG	On-Demand	Mild	HTR2A	54	52
N#Cc1ccc([C@@H](O)CNCCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819032827	GG	On-Demand	Mild	HTR2C	26	51
N#Cc1ccc([C@@H](O)CNCCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819032827	GG	On-Demand	Mild	SLC6A4	16	47
N#Cc1ccc([C@@H](O)CNCCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819032827	GG	On-Demand	Mild	ADRA1A	16	41
N#Cc1ccc([C@@H](O)CNCCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819032827	GG	On-Demand	Mild	DRD3	54	45
N#Cc1ccc([C@@H](O)CNCCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819032827	GG	On-Demand	Mild	HTR7	59	46
N#Cc1ccc(NC(=S)N2CC[C@@]3(C[C@H](O)c4ccccc4O3)C2)cc1Cl	ZINC000819032842	GH	On-Demand	Mild	TRPM8	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=S)NC13CC4CC(CC(C4)C1)C3)C2	ZINC000819032847	GG	On-Demand	Anodyne	EPHX2	46	39
N#Cc1ccc(NC(=S)N2CC[C@]3(C[C@H](O)c4ccccc4O3)C2)cc1Cl	ZINC000819032848	GH	On-Demand	Mild	TRPM8	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=S)NC13CC4CC(CC(C4)C1)C3)C2	ZINC000819032849	GG	On-Demand	Anodyne	EPHX2	46	39
N#Cc1ccc(NC(=S)N2CC[C@]3(C[C@@H](O)c4ccccc4O3)C2)cc1Cl	ZINC000819032850	GH	On-Demand	Mild	TRPM8	21	40
C[S@@](=O)CCNCCC(=O)Nc1cccc(Br)c1	ZINC000819032851	ED	On-Demand	Anodyne	EGFR	36	44
C[S@@](=O)CCNCCC(=O)Nc1cccc(Br)c1	ZINC000819032851	ED	On-Demand	Anodyne	HDAC10	26	45
C[S@@](=O)CCNCCC(=O)Nc1cccc(Br)c1	ZINC000819032851	ED	On-Demand	Anodyne	HDAC2	15	45
N#Cc1ccc(NC(=S)N2CC[C@@]3(C[C@@H](O)c4ccccc4O3)C2)cc1Cl	ZINC000819032852	GH	On-Demand	Mild	TRPM8	21	40
C[S@](=O)CCNCCC(=O)Nc1cccc(Br)c1	ZINC000819032853	ED	On-Demand	Anodyne	EGFR	36	44
C[S@](=O)CCNCCC(=O)Nc1cccc(Br)c1	ZINC000819032853	ED	On-Demand	Anodyne	HDAC10	26	45
C[S@](=O)CCNCCC(=O)Nc1cccc(Br)c1	ZINC000819032853	ED	On-Demand	Anodyne	HDAC2	15	45
COc1cccc([S@@](=O)CC(=O)NC[C@@H]2COc3ccccc3C2)c1	ZINC000819032857	FE	On-Demand	Anodyne	MTNR1A	25	54
COc1cccc([S@@](=O)CC(=O)NC[C@H]2COc3ccccc3C2)c1	ZINC000819032858	FE	On-Demand	Anodyne	MTNR1A	25	54
CC(=O)c1cccc(OC[C@@H](O)CNCC[S@](C)=O)c1	ZINC000819032885	CC	On-Demand	Anodyne	ADRB2	51	50
CC(=O)c1cccc(OC[C@@H](O)CNCC[S@](C)=O)c1	ZINC000819032885	CC	On-Demand	Anodyne	ADRB1	79	44
CC(=O)c1cccc(OC[C@@H](O)CNCC[S@](C)=O)c1	ZINC000819032885	CC	On-Demand	Anodyne	ADRB3	47	44
CC(=O)c1cccc(OC[C@@H](O)CNCC[S@](C)=O)c1	ZINC000819032885	CC	On-Demand	Anodyne	ABCB1	24	52
CC(=O)c1cccc(OC[C@@H](O)CNCC[S@](C)=O)c1	ZINC000819032885	CC	On-Demand	Anodyne	PDS	44	36
CC(=O)c1cccc(OC[C@@H](O)CNCC[S@@](C)=O)c1	ZINC000819032887	CC	On-Demand	Anodyne	ADRB2	51	50
CC(=O)c1cccc(OC[C@@H](O)CNCC[S@@](C)=O)c1	ZINC000819032887	CC	On-Demand	Anodyne	ADRB1	79	44
CC(=O)c1cccc(OC[C@@H](O)CNCC[S@@](C)=O)c1	ZINC000819032887	CC	On-Demand	Anodyne	ADRB3	47	44
CC(=O)c1cccc(OC[C@@H](O)CNCC[S@@](C)=O)c1	ZINC000819032887	CC	On-Demand	Anodyne	ABCB1	24	52
CC(=O)c1cccc(OC[C@@H](O)CNCC[S@@](C)=O)c1	ZINC000819032887	CC	On-Demand	Anodyne	PDS	44	36
CC(=O)c1cccc(OC[C@H](O)CNCC[S@](C)=O)c1	ZINC000819032888	CC	On-Demand	Anodyne	ADRB2	51	50
CC(=O)c1cccc(OC[C@H](O)CNCC[S@](C)=O)c1	ZINC000819032888	CC	On-Demand	Anodyne	ADRB1	79	44
CC(=O)c1cccc(OC[C@H](O)CNCC[S@](C)=O)c1	ZINC000819032888	CC	On-Demand	Anodyne	ADRB3	47	44
CC(=O)c1cccc(OC[C@H](O)CNCC[S@](C)=O)c1	ZINC000819032888	CC	On-Demand	Anodyne	ABCB1	24	52
CC(=O)c1cccc(OC[C@H](O)CNCC[S@](C)=O)c1	ZINC000819032888	CC	On-Demand	Anodyne	PDS	44	36
CC(=O)c1cccc(OC[C@H](O)CNCC[S@@](C)=O)c1	ZINC000819032890	CC	On-Demand	Anodyne	ADRB2	51	50
CC(=O)c1cccc(OC[C@H](O)CNCC[S@@](C)=O)c1	ZINC000819032890	CC	On-Demand	Anodyne	ADRB1	79	44
CC(=O)c1cccc(OC[C@H](O)CNCC[S@@](C)=O)c1	ZINC000819032890	CC	On-Demand	Anodyne	ADRB3	47	44
CC(=O)c1cccc(OC[C@H](O)CNCC[S@@](C)=O)c1	ZINC000819032890	CC	On-Demand	Anodyne	ABCB1	24	52
CC(=O)c1cccc(OC[C@H](O)CNCC[S@@](C)=O)c1	ZINC000819032890	CC	On-Demand	Anodyne	PDS	44	36
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819032895	FF	On-Demand	Mild	GPR119	36	45
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819032897	FF	On-Demand	Mild	GPR119	36	45
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819032899	FF	On-Demand	Mild	GPR119	36	45
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819032900	FF	On-Demand	Mild	GPR119	36	45
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819032917	GF	On-Demand	Bother	GPR119	37	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819032918	GF	On-Demand	Bother	GPR119	37	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819032919	GF	On-Demand	Bother	GPR119	37	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819032920	GF	On-Demand	Bother	GPR119	37	40
Cc1ccc(OC[C@@H](O)CNCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819032939	GF	On-Demand	Anodyne	ADRB2	42	43
Cc1ccc(OC[C@@H](O)CNCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819032939	GF	On-Demand	Anodyne	ADRB1	68	45
Cc1ccc(OC[C@@H](O)CNCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819032939	GF	On-Demand	Anodyne	ADRB3	45	43
Cc1ccc(OC[C@@H](O)CNCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819032939	GF	On-Demand	Anodyne	ABCB1	17	40
Cc1ccc(OC[C@@H](O)CNCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819032939	GF	On-Demand	Anodyne	GPR119	44	43
Cc1ccc(OC[C@H](O)CNCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819032940	GF	On-Demand	Anodyne	ADRB2	42	43
Cc1ccc(OC[C@H](O)CNCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819032940	GF	On-Demand	Anodyne	ADRB1	68	45
Cc1ccc(OC[C@H](O)CNCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819032940	GF	On-Demand	Anodyne	ADRB3	45	43
Cc1ccc(OC[C@H](O)CNCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819032940	GF	On-Demand	Anodyne	ABCB1	17	40
Cc1ccc(OC[C@H](O)CNCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819032940	GF	On-Demand	Anodyne	GPR119	44	43
Cc1ccc(OC[C@@H](O)CNCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819032941	GF	On-Demand	Anodyne	ADRB2	42	43
Cc1ccc(OC[C@@H](O)CNCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819032941	GF	On-Demand	Anodyne	ADRB1	68	45
Cc1ccc(OC[C@@H](O)CNCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819032941	GF	On-Demand	Anodyne	ADRB3	45	43
Cc1ccc(OC[C@@H](O)CNCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819032941	GF	On-Demand	Anodyne	ABCB1	17	40
Cc1ccc(OC[C@@H](O)CNCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819032941	GF	On-Demand	Anodyne	GPR119	44	43
O[C@H](CN[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1cccnc1	ZINC000819032942	FH	On-Demand	Anodyne	ADRB3	63	38
O[C@@H](CN[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1cccnc1	ZINC000819032943	FH	On-Demand	Anodyne	ADRB3	63	38
O[C@@H](CN[C@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1cccnc1	ZINC000819032944	FH	On-Demand	Anodyne	ADRB3	63	38
Cc1noc(C)c1CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819032945	EG	On-Demand	Anodyne	ADRB3	17	43
Cc1noc(C)c1CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819032946	EG	On-Demand	Anodyne	ADRB3	17	43
Cc1noc(C)c1CCNC[C@H](O)c1cccc(Br)c1	ZINC000819032951	EF	On-Demand	Anodyne	ADRB3	49	36
Cc1noc(C)c1CCNC[C@@H](O)c1cccc(Br)c1	ZINC000819032952	EF	On-Demand	Anodyne	ADRB3	49	36
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1Cl	ZINC000819032963	EI	On-Demand	Anodyne	ADRB2	45	38
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1Cl	ZINC000819032963	EI	On-Demand	Anodyne	ADRB1	29	44
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1Cl	ZINC000819032963	EI	On-Demand	Anodyne	ADRB3	19	61
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1Cl	ZINC000819032963	EI	On-Demand	Anodyne	MPO	68	43
O[C@@H]1C[C@]2(CCN(C(=S)Nc3ccc(F)c(Cl)c3)C2)Oc2ccccc21	ZINC000819032975	GI	On-Demand	Anodyne	TRPM8	25	43
O[C@H]1C[C@]2(CCN(C(=S)Nc3ccc(F)c(Cl)c3)C2)Oc2ccccc21	ZINC000819032976	GI	On-Demand	Anodyne	TRPM8	25	43
O[C@H]1C[C@@]2(CCN(C(=S)Nc3ccc(F)c(Cl)c3)C2)Oc2ccccc21	ZINC000819032977	GI	On-Demand	Anodyne	TRPM8	25	43
O[C@@H]1C[C@@]2(CCN(C(=S)Nc3ccc(F)c(Cl)c3)C2)Oc2ccccc21	ZINC000819032978	GI	On-Demand	Anodyne	TRPM8	25	43
N#Cc1ccc(S(=O)(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1	ZINC000819032986	GD	On-Demand	Mild	TGM2	42	38
N#Cc1ccc(S(=O)(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1	ZINC000819032986	GD	On-Demand	Mild	F13A1	45	38
N#Cc1ccc(S(=O)(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1	ZINC000819032987	GD	On-Demand	Mild	TGM2	42	38
N#Cc1ccc(S(=O)(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1	ZINC000819032987	GD	On-Demand	Mild	F13A1	45	38
N#Cc1ccc(S(=O)(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1	ZINC000819032988	GD	On-Demand	Mild	TGM2	42	38
N#Cc1ccc(S(=O)(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1	ZINC000819032988	GD	On-Demand	Mild	F13A1	45	38
N#Cc1ccc(S(=O)(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1	ZINC000819032989	GD	On-Demand	Mild	TGM2	42	38
N#Cc1ccc(S(=O)(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1	ZINC000819032989	GD	On-Demand	Mild	F13A1	45	38
O=C(NCc1ccc(CN2CCCCC2)cc1)C(F)=C1CCC1	ZINC000819032990	DH	On-Demand	Anodyne	HRH3	25	48
O=C(NCc1ccc(CN2CCCCC2)cc1)C(F)=C1CCC1	ZINC000819032990	DH	On-Demand	Anodyne	SIGMAR1	16	44
CC(=O)Nc1cccc(OC(=O)[C@H]2CCCC[C@H]2C)c1	ZINC000819033000	CG	On-Demand	Anodyne	FAAH	17	45
CC(=O)Nc1cccc(OC(=O)[C@H]2CCCC[C@H]2C)c1	ZINC000819033000	CG	On-Demand	Anodyne	KCNK3	48	35
CC(=O)Nc1cccc(OC(=O)[C@H]2CCCC[C@H]2C)c1	ZINC000819033000	CG	On-Demand	Anodyne	KCNK9	49	35
CC(=O)Nc1cccc(OC(=O)[C@@H]2CCCC[C@H]2C)c1	ZINC000819033001	CG	On-Demand	Anodyne	FAAH	17	45
CC(=O)Nc1cccc(OC(=O)[C@@H]2CCCC[C@H]2C)c1	ZINC000819033001	CG	On-Demand	Anodyne	KCNK3	48	35
CC(=O)Nc1cccc(OC(=O)[C@@H]2CCCC[C@H]2C)c1	ZINC000819033001	CG	On-Demand	Anodyne	KCNK9	49	35
CC(=O)Nc1cccc(OC(=O)[C@H]2CCCC[C@@H]2C)c1	ZINC000819033002	CG	On-Demand	Anodyne	FAAH	17	45
CC(=O)Nc1cccc(OC(=O)[C@H]2CCCC[C@@H]2C)c1	ZINC000819033002	CG	On-Demand	Anodyne	KCNK3	48	35
CC(=O)Nc1cccc(OC(=O)[C@H]2CCCC[C@@H]2C)c1	ZINC000819033002	CG	On-Demand	Anodyne	KCNK9	49	35
CC(=O)Nc1cccc(OC(=O)[C@@H]2CCCC[C@@H]2C)c1	ZINC000819033003	CG	On-Demand	Anodyne	FAAH	17	45
CC(=O)Nc1cccc(OC(=O)[C@@H]2CCCC[C@@H]2C)c1	ZINC000819033003	CG	On-Demand	Anodyne	KCNK3	48	35
CC(=O)Nc1cccc(OC(=O)[C@@H]2CCCC[C@@H]2C)c1	ZINC000819033003	CG	On-Demand	Anodyne	KCNK9	49	35
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccc(F)cn1	ZINC000819033064	GG	On-Demand	Anodyne	SIGMAR1	22	41
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccc(F)cn1	ZINC000819033065	GG	On-Demand	Anodyne	SIGMAR1	22	41
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CCC[C@H](C3CC3)C2)cc1	ZINC000819033080	FE	On-Demand	Anodyne	CA2	66	58
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CCC[C@H](C3CC3)C2)cc1	ZINC000819033080	FE	On-Demand	Anodyne	CA1	62	58
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CCC[C@H](C3CC3)C2)cc1	ZINC000819033080	FE	On-Demand	Anodyne	CA7	40	42
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CCC[C@H](C3CC3)C2)cc1	ZINC000819033080	FE	On-Demand	Anodyne	CA5B	32	42
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CCC[C@H](C3CC3)C2)cc1	ZINC000819033080	FE	On-Demand	Anodyne	CA4	42	44
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CCC[C@H](C3CC3)C2)cc1	ZINC000819033080	FE	On-Demand	Anodyne	CA5A	29	42
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CCC[C@H](C3CC3)C2)cc1	ZINC000819033080	FE	On-Demand	Anodyne	CA14	48	48
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CCC[C@H](C3CC3)C2)cc1	ZINC000819033080	FE	On-Demand	Anodyne	CA12	52	52
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CCC[C@H](C3CC3)C2)cc1	ZINC000819033080	FE	On-Demand	Anodyne	CA9	53	58
NS(=O)(=O)c1ccc(CNC(=S)N[C@@H]2CCC[C@H](C3CC3)C2)cc1	ZINC000819033080	FE	On-Demand	Anodyne	NAMPT	20	41
COc1cccc([C@H](CNC(=O)C(F)=C2CCC2)N(C)C)c1	ZINC000819033086	DF	On-Demand	Anodyne	DRD4	41	31
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)CN2CCCC2=O)C1	ZINC000819033088	FD	On-Demand	Anodyne	GPR119	27	44
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)CN2CCCC2=O)C1	ZINC000819033089	FD	On-Demand	Anodyne	GPR119	27	44
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)CN2CCCC2=O)C1	ZINC000819033090	FD	On-Demand	Anodyne	GPR119	27	44
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)CN2CCCC2=O)C1	ZINC000819033091	FD	On-Demand	Anodyne	GPR119	27	44
CN(C)[C@@H](CNC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1cccc(F)c1	ZINC000819033095	FE	On-Demand	Anodyne	PAPA1_CARPA	18	40
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccccc1	ZINC000819033101	FH	On-Demand	Anodyne	DRD4	17	45
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccccc1	ZINC000819033101	FH	On-Demand	Anodyne	ACHE	34	40
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccccc1	ZINC000819033101	FH	On-Demand	Anodyne	SLC6A3	32	55
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccccc1	ZINC000819033101	FH	On-Demand	Anodyne	SIGMAR1	37	48
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccccc1	ZINC000819033101	FH	On-Demand	Anodyne	CCR3	29	41
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccccc1	ZINC000819033102	FH	On-Demand	Anodyne	DRD4	17	45
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccccc1	ZINC000819033102	FH	On-Demand	Anodyne	ACHE	34	40
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccccc1	ZINC000819033102	FH	On-Demand	Anodyne	SLC6A3	32	55
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccccc1	ZINC000819033102	FH	On-Demand	Anodyne	SIGMAR1	37	48
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccccc1	ZINC000819033102	FH	On-Demand	Anodyne	CCR3	29	41
CC[C@H](O)CNCc1ccc(N2CCN(CC)CC2)c(F)c1	ZINC000819033139	DD	On-Demand	Clean	NPY2R	48	34
CC[C@@H](O)CNCc1ccc(N2CCN(CC)CC2)c(F)c1	ZINC000819033140	DD	On-Demand	Clean	NPY2R	48	34
C[S@](=O)CCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819033148	CC	On-Demand	Mild	ADRB2	53	49
C[S@](=O)CCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819033148	CC	On-Demand	Mild	ADRB1	84	49
C[S@](=O)CCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819033148	CC	On-Demand	Mild	GRIN1	15	44
C[S@](=O)CCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819033148	CC	On-Demand	Mild	ADRB3	51	49
C[S@@](=O)CCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819033149	CC	On-Demand	Mild	ADRB2	53	49
C[S@@](=O)CCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819033149	CC	On-Demand	Mild	ADRB1	84	49
C[S@@](=O)CCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819033149	CC	On-Demand	Mild	GRIN1	15	44
C[S@@](=O)CCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819033149	CC	On-Demand	Mild	ADRB3	51	49
C[S@](=O)CCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819033150	CC	On-Demand	Mild	ADRB2	53	49
C[S@](=O)CCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819033150	CC	On-Demand	Mild	ADRB1	84	49
C[S@](=O)CCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819033150	CC	On-Demand	Mild	GRIN1	15	44
C[S@](=O)CCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819033150	CC	On-Demand	Mild	ADRB3	51	49
C[S@@](=O)CCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819033151	CC	On-Demand	Mild	ADRB2	53	49
C[S@@](=O)CCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819033151	CC	On-Demand	Mild	ADRB1	84	49
C[S@@](=O)CCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819033151	CC	On-Demand	Mild	GRIN1	15	44
C[S@@](=O)CCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819033151	CC	On-Demand	Mild	ADRB3	51	49
COc1ccccc1COC[C@@H](O)CNCC[S@](C)=O	ZINC000819033152	DC	On-Demand	Anodyne	ADRB2	27	41
COc1ccccc1COC[C@@H](O)CNCC[S@](C)=O	ZINC000819033152	DC	On-Demand	Anodyne	ADRB3	15	44
COc1ccccc1COC[C@@H](O)CNCC[S@@](C)=O	ZINC000819033153	DC	On-Demand	Anodyne	ADRB2	27	41
COc1ccccc1COC[C@@H](O)CNCC[S@@](C)=O	ZINC000819033153	DC	On-Demand	Anodyne	ADRB3	15	44
COc1ccccc1COC[C@H](O)CNCC[S@](C)=O	ZINC000819033154	DC	On-Demand	Anodyne	ADRB2	27	41
COc1ccccc1COC[C@H](O)CNCC[S@](C)=O	ZINC000819033154	DC	On-Demand	Anodyne	ADRB3	15	44
COc1ccccc1COC[C@H](O)CNCC[S@@](C)=O	ZINC000819033155	DC	On-Demand	Anodyne	ADRB2	27	41
COc1ccccc1COC[C@H](O)CNCC[S@@](C)=O	ZINC000819033155	DC	On-Demand	Anodyne	ADRB3	15	44
C[S@@](=O)CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819033170	CD	On-Demand	Anodyne	ADRB2	17	42
C[S@@](=O)CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819033170	CD	On-Demand	Anodyne	ADRB1	18	42
C[S@](=O)CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819033171	CD	On-Demand	Anodyne	ADRB2	17	42
C[S@](=O)CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819033171	CD	On-Demand	Anodyne	ADRB1	18	42
C[S@](=O)CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819033172	CD	On-Demand	Anodyne	ADRB2	17	42
C[S@](=O)CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819033172	CD	On-Demand	Anodyne	ADRB1	18	42
C[S@@](=O)CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819033173	CD	On-Demand	Anodyne	ADRB2	17	42
C[S@@](=O)CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819033173	CD	On-Demand	Anodyne	ADRB1	18	42
S=C(NCCc1cccnc1)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819033174	CD	On-Demand	Anodyne	CHRNA7	43	37
S=C(NCCc1cccnc1)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819033174	CD	On-Demand	Anodyne	NAMPT	34	43
S=C(NCCc1cccnc1)NC1C[C@@H]2C[C@H]2C1	ZINC000819033175	CD	On-Demand	Anodyne	CHRNA7	43	37
S=C(NCCc1cccnc1)NC1C[C@@H]2C[C@H]2C1	ZINC000819033175	CD	On-Demand	Anodyne	NAMPT	34	43
S=C(NCCc1cccnc1)NC1C[C@H]2C[C@@H]2C1	ZINC000819033176	CD	On-Demand	Anodyne	CHRNA7	43	37
S=C(NCCc1cccnc1)NC1C[C@H]2C[C@@H]2C1	ZINC000819033176	CD	On-Demand	Anodyne	NAMPT	34	43
C[S@@](=O)CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819033200	DC	On-Demand	Bother	ADRB2	42	46
C[S@@](=O)CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819033200	DC	On-Demand	Bother	ADRB1	62	40
C[S@@](=O)CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819033200	DC	On-Demand	Bother	ADRB3	29	43
C[S@](=O)CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819033201	DC	On-Demand	Bother	ADRB2	42	46
C[S@](=O)CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819033201	DC	On-Demand	Bother	ADRB1	62	40
C[S@](=O)CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819033201	DC	On-Demand	Bother	ADRB3	29	43
C[S@](=O)CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819033202	DC	On-Demand	Bother	ADRB2	42	46
C[S@](=O)CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819033202	DC	On-Demand	Bother	ADRB1	62	40
C[S@](=O)CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819033202	DC	On-Demand	Bother	ADRB3	29	43
C[S@@](=O)CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819033203	DC	On-Demand	Bother	ADRB2	42	46
C[S@@](=O)CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819033203	DC	On-Demand	Bother	ADRB1	62	40
C[S@@](=O)CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819033203	DC	On-Demand	Bother	ADRB3	29	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=S)Nc1cccc(C(F)(F)F)c1)C2	ZINC000819033210	GH	On-Demand	Anodyne	CCR2	62	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=S)Nc1cccc(C(F)(F)F)c1)C2	ZINC000819033211	GH	On-Demand	Anodyne	CCR2	62	35
CCN1CCC[C@@H]1CNC(=S)NC1C[C@@H]2C[C@H]2C1	ZINC000819033232	CD	On-Demand	Anodyne	DRD2	32	41
CCN1CCC[C@@H]1CNC(=S)NC1C[C@H]2C[C@@H]2C1	ZINC000819033233	CD	On-Demand	Anodyne	DRD2	32	41
CCN1CCC[C@@H]1CNC(=S)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819033235	CD	On-Demand	Anodyne	DRD2	32	41
Cc1ccc(OC[C@H](O)CNCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819033242	GF	On-Demand	Anodyne	ADRB2	42	43
Cc1ccc(OC[C@H](O)CNCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819033242	GF	On-Demand	Anodyne	ADRB1	68	45
Cc1ccc(OC[C@H](O)CNCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819033242	GF	On-Demand	Anodyne	ADRB3	45	43
Cc1ccc(OC[C@H](O)CNCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819033242	GF	On-Demand	Anodyne	ABCB1	17	40
Cc1ccc(OC[C@H](O)CNCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819033242	GF	On-Demand	Anodyne	GPR119	44	43
Cc1ccc(NC(=S)N[C@H]2CCCCN(Cc3nc(C)no3)C2=O)c(C)c1	ZINC000819033256	GF	On-Demand	Anodyne	F10	15	50
Cc1ccc(NC(=S)N[C@@H]2CCCCN(Cc3nc(C)no3)C2=O)c(C)c1	ZINC000819033257	GF	On-Demand	Anodyne	F10	15	50
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)N1CCSCC1	ZINC000819033291	FD	On-Demand	Anodyne	ADRB1	56	48
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)N1CCSCC1	ZINC000819033291	FD	On-Demand	Anodyne	ADRB3	82	54
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)N1CCSCC1	ZINC000819033292	FD	On-Demand	Anodyne	ADRB1	56	48
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)N1CCSCC1	ZINC000819033292	FD	On-Demand	Anodyne	ADRB3	82	54
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819033305	FG	On-Demand	Anodyne	CACNA1I	45	32
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819033305	FG	On-Demand	Anodyne	GPR119	45	50
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819033306	FG	On-Demand	Anodyne	CACNA1I	45	32
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819033306	FG	On-Demand	Anodyne	GPR119	45	50
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819033307	FG	On-Demand	Anodyne	CACNA1I	45	32
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819033307	FG	On-Demand	Anodyne	GPR119	45	50
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819033308	FG	On-Demand	Anodyne	CACNA1I	45	32
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819033308	FG	On-Demand	Anodyne	GPR119	45	50
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)CCc2ccccc2)C1	ZINC000819033317	FG	On-Demand	Anodyne	ACE	45	36
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)CCc2ccccc2)C1	ZINC000819033317	FG	On-Demand	Anodyne	ACHE	22	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)CCc2ccccc2)C1	ZINC000819033317	FG	On-Demand	Anodyne	GHRHR	61	35
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)CCc2ccccc2)C1	ZINC000819033317	FG	On-Demand	Anodyne	GRIN2B	49	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)CCc2ccccc2)C1	ZINC000819033317	FG	On-Demand	Anodyne	MMP3	17	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)CCc2ccccc2)C1	ZINC000819033317	FG	On-Demand	Anodyne	REN	52	37
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)CCc2ccccc2)C1	ZINC000819033317	FG	On-Demand	Anodyne	FPR1	40	35
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)CCc2ccccc2)C1	ZINC000819033317	FG	On-Demand	Anodyne	GPR119	41	43
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)CCc2ccccc2)C1	ZINC000819033317	FG	On-Demand	Anodyne	SFRP1	19	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)CCc2ccccc2)C1	ZINC000819033318	FG	On-Demand	Anodyne	ACE	45	36
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)CCc2ccccc2)C1	ZINC000819033318	FG	On-Demand	Anodyne	ACHE	22	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)CCc2ccccc2)C1	ZINC000819033318	FG	On-Demand	Anodyne	GHRHR	61	35
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)CCc2ccccc2)C1	ZINC000819033318	FG	On-Demand	Anodyne	GRIN2B	49	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)CCc2ccccc2)C1	ZINC000819033318	FG	On-Demand	Anodyne	MMP3	17	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)CCc2ccccc2)C1	ZINC000819033318	FG	On-Demand	Anodyne	REN	52	37
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)CCc2ccccc2)C1	ZINC000819033318	FG	On-Demand	Anodyne	FPR1	40	35
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)CCc2ccccc2)C1	ZINC000819033318	FG	On-Demand	Anodyne	GPR119	41	43
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)CCc2ccccc2)C1	ZINC000819033318	FG	On-Demand	Anodyne	SFRP1	19	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)CCc2ccccc2)C1	ZINC000819033319	FG	On-Demand	Anodyne	ACE	45	36
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)CCc2ccccc2)C1	ZINC000819033319	FG	On-Demand	Anodyne	ACHE	22	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)CCc2ccccc2)C1	ZINC000819033319	FG	On-Demand	Anodyne	GHRHR	61	35
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)CCc2ccccc2)C1	ZINC000819033319	FG	On-Demand	Anodyne	GRIN2B	49	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)CCc2ccccc2)C1	ZINC000819033319	FG	On-Demand	Anodyne	MMP3	17	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)CCc2ccccc2)C1	ZINC000819033319	FG	On-Demand	Anodyne	REN	52	37
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)CCc2ccccc2)C1	ZINC000819033319	FG	On-Demand	Anodyne	FPR1	40	35
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)CCc2ccccc2)C1	ZINC000819033319	FG	On-Demand	Anodyne	GPR119	41	43
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)CCc2ccccc2)C1	ZINC000819033319	FG	On-Demand	Anodyne	SFRP1	19	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)CCc2ccccc2)C1	ZINC000819033321	FG	On-Demand	Anodyne	ACE	45	36
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)CCc2ccccc2)C1	ZINC000819033321	FG	On-Demand	Anodyne	ACHE	22	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)CCc2ccccc2)C1	ZINC000819033321	FG	On-Demand	Anodyne	GHRHR	61	35
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)CCc2ccccc2)C1	ZINC000819033321	FG	On-Demand	Anodyne	GRIN2B	49	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)CCc2ccccc2)C1	ZINC000819033321	FG	On-Demand	Anodyne	MMP3	17	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)CCc2ccccc2)C1	ZINC000819033321	FG	On-Demand	Anodyne	REN	52	37
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)CCc2ccccc2)C1	ZINC000819033321	FG	On-Demand	Anodyne	FPR1	40	35
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)CCc2ccccc2)C1	ZINC000819033321	FG	On-Demand	Anodyne	GPR119	41	43
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)CCc2ccccc2)C1	ZINC000819033321	FG	On-Demand	Anodyne	SFRP1	19	40
O=S(=O)(CCNC[C@H](O)c1ccccc1)N1CCSCC1	ZINC000819033328	EC	On-Demand	Anodyne	ADRB2	23	41
O=S(=O)(CCNC[C@H](O)c1ccccc1)N1CCSCC1	ZINC000819033328	EC	On-Demand	Anodyne	ADRB3	71	40
O=S(=O)(CCNC[C@@H](O)c1ccccc1)N1CCSCC1	ZINC000819033330	EC	On-Demand	Anodyne	ADRB2	23	41
O=S(=O)(CCNC[C@@H](O)c1ccccc1)N1CCSCC1	ZINC000819033330	EC	On-Demand	Anodyne	ADRB3	71	40
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033332	GF	On-Demand	Anodyne	HTR1A	78	52
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033332	GF	On-Demand	Anodyne	DRD2	57	50
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033332	GF	On-Demand	Anodyne	DRD1	19	45
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033332	GF	On-Demand	Anodyne	DRD4	41	41
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033332	GF	On-Demand	Anodyne	ADRA1D	15	42
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033332	GF	On-Demand	Anodyne	HTR2A	76	50
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033332	GF	On-Demand	Anodyne	HTR2C	35	45
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033332	GF	On-Demand	Anodyne	SLC6A4	20	45
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033332	GF	On-Demand	Anodyne	ADRA1A	23	42
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033332	GF	On-Demand	Anodyne	DRD3	64	49
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033332	GF	On-Demand	Anodyne	HRP1_PLAFA	57	34
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033332	GF	On-Demand	Anodyne	HTR7	93	47
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033332	GF	On-Demand	Anodyne	HTR6	15	47
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033333	GF	On-Demand	Anodyne	HTR1A	78	52
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033333	GF	On-Demand	Anodyne	DRD2	57	50
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033333	GF	On-Demand	Anodyne	DRD1	19	45
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033333	GF	On-Demand	Anodyne	DRD4	41	41
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033333	GF	On-Demand	Anodyne	ADRA1D	15	42
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033333	GF	On-Demand	Anodyne	HTR2A	76	50
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033333	GF	On-Demand	Anodyne	HTR2C	35	45
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033333	GF	On-Demand	Anodyne	SLC6A4	20	45
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033333	GF	On-Demand	Anodyne	ADRA1A	23	42
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033333	GF	On-Demand	Anodyne	DRD3	64	49
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033333	GF	On-Demand	Anodyne	HRP1_PLAFA	57	34
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033333	GF	On-Demand	Anodyne	HTR7	93	47
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819033333	GF	On-Demand	Anodyne	HTR6	15	47
CC(=O)c1ccc(NC(=S)N2CC[C@@]3(C[C@H](O)c4ccccc4O3)C2)cc1	ZINC000819033357	GH	On-Demand	Anodyne	TRPM8	27	43
CC(=O)c1ccc(NC(=S)N2CC[C@]3(C[C@@H](O)c4ccccc4O3)C2)cc1	ZINC000819033359	GH	On-Demand	Anodyne	TRPM8	27	43
CC(=O)c1ccc(NC(=S)N2CC[C@]3(C[C@H](O)c4ccccc4O3)C2)cc1	ZINC000819033363	GH	On-Demand	Anodyne	TRPM8	27	43
CC(C)(C)OC(=O)N1CC[C@H](CCNCCC(=O)Nc2ccccc2F)C1	ZINC000819033364	GG	On-Demand	Anodyne	GPR119	44	46
CC(C)(C)OC(=O)N1CC[C@@H](CCNCCC(=O)Nc2ccccc2F)C1	ZINC000819033366	GG	On-Demand	Anodyne	GPR119	44	46
CC(=O)c1ccc(NC(=S)N2CC[C@@]3(C[C@@H](O)c4ccccc4O3)C2)cc1	ZINC000819033367	GH	On-Demand	Anodyne	TRPM8	27	43
CN(C[C@@H](O)CN[C@@H]1CCN(c2ccc(F)cc2F)C1)C(=O)OC(C)(C)C	ZINC000819033369	GE	On-Demand	Anodyne	NPY2R	48	35
CN(C[C@@H](O)CN[C@H]1CCN(c2ccc(F)cc2F)C1)C(=O)OC(C)(C)C	ZINC000819033371	GE	On-Demand	Anodyne	NPY2R	48	35
CN(C[C@H](O)CN[C@@H]1CCN(c2ccc(F)cc2F)C1)C(=O)OC(C)(C)C	ZINC000819033372	GE	On-Demand	Anodyne	NPY2R	48	35
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)C1CC1	ZINC000819033377	DF	On-Demand	Anodyne	ACHE	23	40
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)C1CC1	ZINC000819033377	DF	On-Demand	Anodyne	SIGMAR1	31	47
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)C1CC1	ZINC000819033378	DF	On-Demand	Anodyne	ACHE	23	40
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)C1CC1	ZINC000819033378	DF	On-Demand	Anodyne	SIGMAR1	31	47
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccccc1F	ZINC000819033400	GI	On-Demand	Anodyne	SIGMAR1	28	42
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1ccccc1F	ZINC000819033402	GI	On-Demand	Anodyne	SIGMAR1	28	42
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1	ZINC000819033414	DH	On-Demand	Anodyne	ADRB2	57	44
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1	ZINC000819033414	DH	On-Demand	Anodyne	ADRB1	32	42
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1	ZINC000819033414	DH	On-Demand	Anodyne	SLC6A4	17	52
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1	ZINC000819033414	DH	On-Demand	Anodyne	ADRB3	33	59
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1	ZINC000819033414	DH	On-Demand	Anodyne	MPO	114	52
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1	ZINC000819033415	DH	On-Demand	Anodyne	ADRB2	57	44
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1	ZINC000819033415	DH	On-Demand	Anodyne	ADRB1	32	42
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1	ZINC000819033415	DH	On-Demand	Anodyne	SLC6A4	17	52
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1	ZINC000819033415	DH	On-Demand	Anodyne	ADRB3	33	59
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1	ZINC000819033415	DH	On-Demand	Anodyne	MPO	114	52
O[C@@H]1C[C@]2(CCN(C(=S)Nc3cccc(Cl)c3)C2)Oc2ccccc21	ZINC000819033474	FH	On-Demand	Anodyne	TRPM8	22	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819033479	FH	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819033479	FH	On-Demand	Anodyne	GPR119	34	42
O[C@H]1C[C@]2(CCN(C(=S)Nc3cccc(Cl)c3)C2)Oc2ccccc21	ZINC000819033481	FH	On-Demand	Anodyne	TRPM8	22	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819033482	FH	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819033482	FH	On-Demand	Anodyne	GPR119	34	42
O[C@H]1C[C@@]2(CCN(C(=S)Nc3cccc(Cl)c3)C2)Oc2ccccc21	ZINC000819033484	FH	On-Demand	Anodyne	TRPM8	22	41
O[C@@H]1C[C@@]2(CCN(C(=S)Nc3cccc(Cl)c3)C2)Oc2ccccc21	ZINC000819033485	FH	On-Demand	Anodyne	TRPM8	22	41
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819033488	ED	On-Demand	Anodyne	CA2	114	65
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819033488	ED	On-Demand	Anodyne	CA6	20	40
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819033488	ED	On-Demand	Anodyne	CA1	96	65
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819033488	ED	On-Demand	Anodyne	CA7	71	48
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819033488	ED	On-Demand	Anodyne	CA13	23	40
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819033488	ED	On-Demand	Anodyne	CA5B	39	47
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819033488	ED	On-Demand	Anodyne	CA4	68	50
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819033488	ED	On-Demand	Anodyne	CA5A	42	47
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819033488	ED	On-Demand	Anodyne	CA14	81	58
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819033488	ED	On-Demand	Anodyne	CA12	87	58
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819033488	ED	On-Demand	Anodyne	CA9	89	65
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819033488	ED	On-Demand	Anodyne	CAH_METTE	25	40
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819033488	ED	On-Demand	Anodyne	CYNT	31	44
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819033488	ED	On-Demand	Anodyne	NCE103	22	43
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819033488	ED	On-Demand	Anodyne	CA15	16	40
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819033488	ED	On-Demand	Anodyne	MTCA1	31	42
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819033488	ED	On-Demand	Anodyne	P96878_MYCTU	38	42
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819033488	ED	On-Demand	Anodyne	NAMPT	21	45
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819033488	ED	On-Demand	Anodyne	A6YCJ1_9METZ	24	40
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819033492	ED	On-Demand	Anodyne	CA2	114	65
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819033492	ED	On-Demand	Anodyne	CA6	20	40
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819033492	ED	On-Demand	Anodyne	CA1	96	65
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819033492	ED	On-Demand	Anodyne	CA7	71	48
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819033492	ED	On-Demand	Anodyne	CA13	23	40
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819033492	ED	On-Demand	Anodyne	CA5B	39	47
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819033492	ED	On-Demand	Anodyne	CA4	68	50
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819033492	ED	On-Demand	Anodyne	CA5A	42	47
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819033492	ED	On-Demand	Anodyne	CA14	81	58
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819033492	ED	On-Demand	Anodyne	CA12	87	58
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819033492	ED	On-Demand	Anodyne	CA9	89	65
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819033492	ED	On-Demand	Anodyne	CAH_METTE	25	40
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819033492	ED	On-Demand	Anodyne	CYNT	31	44
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819033492	ED	On-Demand	Anodyne	NCE103	22	43
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819033492	ED	On-Demand	Anodyne	CA15	16	40
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819033492	ED	On-Demand	Anodyne	MTCA1	31	42
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819033492	ED	On-Demand	Anodyne	P96878_MYCTU	38	42
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819033492	ED	On-Demand	Anodyne	NAMPT	21	45
NS(=O)(=O)c1ccc(CNC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819033492	ED	On-Demand	Anodyne	A6YCJ1_9METZ	24	40
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819033494	ED	On-Demand	Anodyne	CA2	114	65
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819033494	ED	On-Demand	Anodyne	CA6	20	40
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819033494	ED	On-Demand	Anodyne	CA1	96	65
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819033494	ED	On-Demand	Anodyne	CA7	71	48
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819033494	ED	On-Demand	Anodyne	CA13	23	40
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819033494	ED	On-Demand	Anodyne	CA5B	39	47
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819033494	ED	On-Demand	Anodyne	CA4	68	50
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819033494	ED	On-Demand	Anodyne	CA5A	42	47
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819033494	ED	On-Demand	Anodyne	CA14	81	58
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819033494	ED	On-Demand	Anodyne	CA12	87	58
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819033494	ED	On-Demand	Anodyne	CA9	89	65
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819033494	ED	On-Demand	Anodyne	CAH_METTE	25	40
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819033494	ED	On-Demand	Anodyne	CYNT	31	44
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819033494	ED	On-Demand	Anodyne	NCE103	22	43
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819033494	ED	On-Demand	Anodyne	CA15	16	40
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819033494	ED	On-Demand	Anodyne	MTCA1	31	42
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819033494	ED	On-Demand	Anodyne	P96878_MYCTU	38	42
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819033494	ED	On-Demand	Anodyne	NAMPT	21	45
NS(=O)(=O)c1ccc(CNC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819033494	ED	On-Demand	Anodyne	A6YCJ1_9METZ	24	40
O=C(/C=C\[C@@H]1CCCO1)Nc1nc2ccccc2s1	ZINC000819033532	CF	On-Demand	Anodyne	LCK	16	42
O=C(/C=C\[C@@H]1CCCO1)Nc1nc2ccccc2s1	ZINC000819033532	CF	On-Demand	Anodyne	CSNK1D	22	44
O=C(/C=C\[C@H]1CCCO1)Nc1nc2ccccc2s1	ZINC000819033534	CF	On-Demand	Anodyne	LCK	16	42
O=C(/C=C\[C@H]1CCCO1)Nc1nc2ccccc2s1	ZINC000819033534	CF	On-Demand	Anodyne	CSNK1D	22	44
O=C(CSc1ccccc1[N+](=O)[O-])OCc1ccccc1Br	ZINC000819033542	GI	On-Demand	Bother	COLA	109	41
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1cccc(F)c1	ZINC000819033557	GI	On-Demand	Anodyne	SLC6A3	24	53
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1cccc(F)c1	ZINC000819033557	GI	On-Demand	Anodyne	SIGMAR1	24	43
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1cccc(F)c1	ZINC000819033557	GI	On-Demand	Anodyne	CCR3	45	38
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1cccc(F)c1	ZINC000819033558	GI	On-Demand	Anodyne	SLC6A3	24	53
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1cccc(F)c1	ZINC000819033558	GI	On-Demand	Anodyne	SIGMAR1	24	43
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1cccc(F)c1	ZINC000819033558	GI	On-Demand	Anodyne	CCR3	45	38
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819033568	FG	On-Demand	Anodyne	GPR119	44	44
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819033569	FG	On-Demand	Anodyne	GPR119	44	44
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819033570	FG	On-Demand	Anodyne	GPR119	44	44
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819033571	FG	On-Demand	Anodyne	GPR119	44	44
N#CCN1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819033579	CD	On-Demand	Mild	SLC6A3	22	46
N#CCN1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819033580	CD	On-Demand	Mild	SLC6A3	22	46
O=C(NCc1ccc(CN2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819033586	DF	On-Demand	Anodyne	DPOL_VZVD	24	42
COc1ccc(OC)c([C@H](O)CNCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819033601	GF	On-Demand	Anodyne	GPR119	35	43
COc1ccc(OC)c([C@H](O)CNCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819033602	GF	On-Demand	Anodyne	GPR119	35	43
Cc1cc(F)ccc1[C@@H](O)CNCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819033607	FG	On-Demand	Anodyne	GPR119	41	45
Cc1cc(F)ccc1[C@@H](O)CNCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819033608	FG	On-Demand	Anodyne	GPR119	41	45
Cc1ccc(OC[C@@H](O)CNCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819033622	GG	On-Demand	Anodyne	GPR119	36	40
Cc1ccc(OC[C@@H](O)CNCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819033623	GG	On-Demand	Anodyne	GPR119	36	40
Cc1ccc(OC[C@H](O)CNCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819033624	GG	On-Demand	Anodyne	GPR119	36	40
Cc1ccc(OC[C@H](O)CNCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819033625	GG	On-Demand	Anodyne	GPR119	36	40
N#CCN1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819033638	CD	On-Demand	Mild	ADRB3	22	44
CC(C)(C)OC(=O)N1CC[C@@H](CCNCCS(C)(=O)=O)C1	ZINC000819033639	DD	On-Demand	Anodyne	GPR119	45	43
CC(C)(C)OC(=O)N1CC[C@H](CCNCCS(C)(=O)=O)C1	ZINC000819033640	DD	On-Demand	Anodyne	GPR119	45	43
C=C(C)C(C)(C)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819033641	FF	On-Demand	Mild	HTR1A	88	51
C=C(C)C(C)(C)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819033641	FF	On-Demand	Mild	DRD2	69	47
C=C(C)C(C)(C)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819033641	FF	On-Demand	Mild	DRD1	16	42
C=C(C)C(C)(C)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819033641	FF	On-Demand	Mild	DRD4	53	45
C=C(C)C(C)(C)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819033641	FF	On-Demand	Mild	ADRA1D	39	43
C=C(C)C(C)(C)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819033641	FF	On-Demand	Mild	HTR2A	62	51
C=C(C)C(C)(C)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819033641	FF	On-Demand	Mild	HTR2C	40	46
C=C(C)C(C)(C)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819033641	FF	On-Demand	Mild	SLC6A4	19	46
C=C(C)C(C)(C)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819033641	FF	On-Demand	Mild	ADRA1A	47	41
C=C(C)C(C)(C)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819033641	FF	On-Demand	Mild	ADRA1B	23	43
C=C(C)C(C)(C)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819033641	FF	On-Demand	Mild	DRD3	98	49
C=C(C)C(C)(C)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819033641	FF	On-Demand	Mild	HRP1_PLAFA	25	41
C=C(C)C(C)(C)C(=O)NCCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819033641	FF	On-Demand	Mild	HTR7	92	51
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033658	FF	On-Demand	Anodyne	ADRB2	42	42
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033658	FF	On-Demand	Anodyne	ADRB1	53	43
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033658	FF	On-Demand	Anodyne	HTR1A	68	52
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033658	FF	On-Demand	Anodyne	DRD2	48	52
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033658	FF	On-Demand	Anodyne	DRD4	42	35
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033658	FF	On-Demand	Anodyne	HTR2A	65	52
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033658	FF	On-Demand	Anodyne	HTR2C	33	47
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033658	FF	On-Demand	Anodyne	SLC6A4	17	47
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033658	FF	On-Demand	Anodyne	ADRA1A	20	43
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033658	FF	On-Demand	Anodyne	DRD3	59	48
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033658	FF	On-Demand	Anodyne	ADRB3	126	45
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033658	FF	On-Demand	Anodyne	IGF1R	22	41
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033658	FF	On-Demand	Anodyne	HRP1_PLAFA	72	35
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033658	FF	On-Demand	Anodyne	HTR7	74	49
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033659	FF	On-Demand	Anodyne	ADRB2	42	42
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033659	FF	On-Demand	Anodyne	ADRB1	53	43
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033659	FF	On-Demand	Anodyne	HTR1A	68	52
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033659	FF	On-Demand	Anodyne	DRD2	48	52
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033659	FF	On-Demand	Anodyne	DRD4	42	35
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033659	FF	On-Demand	Anodyne	HTR2A	65	52
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033659	FF	On-Demand	Anodyne	HTR2C	33	47
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033659	FF	On-Demand	Anodyne	SLC6A4	17	47
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033659	FF	On-Demand	Anodyne	ADRA1A	20	43
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033659	FF	On-Demand	Anodyne	DRD3	59	48
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033659	FF	On-Demand	Anodyne	ADRB3	126	45
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033659	FF	On-Demand	Anodyne	IGF1R	22	41
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033659	FF	On-Demand	Anodyne	HRP1_PLAFA	72	35
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819033659	FF	On-Demand	Anodyne	HTR7	74	49
COc1cccc([C@H](CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)N(C)C)c1	ZINC000819033671	GE	On-Demand	Anodyne	MTNR1A	21	41
COc1cccc([C@H](CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)N(C)C)c1	ZINC000819033671	GE	On-Demand	Anodyne	MTNR1B	20	41
O=C(/C=C/[C@@H]1CCCO1)Nc1nc2ccccc2s1	ZINC000819033675	CF	On-Demand	Anodyne	LCK	16	42
O=C(/C=C/[C@@H]1CCCO1)Nc1nc2ccccc2s1	ZINC000819033675	CF	On-Demand	Anodyne	CSNK1D	22	44
O=C(/C=C/[C@H]1CCCO1)Nc1nc2ccccc2s1	ZINC000819033678	CF	On-Demand	Anodyne	LCK	16	42
O=C(/C=C/[C@H]1CCCO1)Nc1nc2ccccc2s1	ZINC000819033678	CF	On-Demand	Anodyne	CSNK1D	22	44
O[C@@H]1C[C@]2(CCN(C(=S)Nc3ccccc3)C2)Oc2ccccc21	ZINC000819033683	EG	On-Demand	Anodyne	TRPM8	21	41
O[C@H]1C[C@]2(CCN(C(=S)Nc3ccccc3)C2)Oc2ccccc21	ZINC000819033686	EG	On-Demand	Anodyne	TRPM8	21	41
O[C@H]1C[C@@]2(CCN(C(=S)Nc3ccccc3)C2)Oc2ccccc21	ZINC000819033688	EG	On-Demand	Anodyne	TRPM8	21	41
O[C@@H]1C[C@@]2(CCN(C(=S)Nc3ccccc3)C2)Oc2ccccc21	ZINC000819033691	EG	On-Demand	Anodyne	TRPM8	21	41
O=C(CSc1ccccc1[N+](=O)[O-])OCc1cnc(-c2ccccc2)s1	ZINC000819033696	GJ	On-Demand	Bother	GSTM2	47	36
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2F)C1)c1cccc(Cl)c1	ZINC000819033705	FH	On-Demand	Anodyne	ADRB1	30	41
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2F)C1)c1cccc(Cl)c1	ZINC000819033705	FH	On-Demand	Anodyne	ADRB3	50	44
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2F)C1)c1cccc(Cl)c1	ZINC000819033705	FH	On-Demand	Anodyne	CYP3A4	47	38
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2F)C1)c1cccc(Cl)c1	ZINC000819033707	FH	On-Demand	Anodyne	ADRB1	30	41
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2F)C1)c1cccc(Cl)c1	ZINC000819033707	FH	On-Demand	Anodyne	ADRB3	50	44
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2F)C1)c1cccc(Cl)c1	ZINC000819033707	FH	On-Demand	Anodyne	CYP3A4	47	38
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2F)C1)c1cccc(Cl)c1	ZINC000819033710	FH	On-Demand	Anodyne	ADRB1	30	41
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2F)C1)c1cccc(Cl)c1	ZINC000819033710	FH	On-Demand	Anodyne	ADRB3	50	44
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2F)C1)c1cccc(Cl)c1	ZINC000819033710	FH	On-Demand	Anodyne	CYP3A4	47	38
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2F)C1)c1cccc(Cl)c1	ZINC000819033712	FH	On-Demand	Anodyne	ADRB1	30	41
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2F)C1)c1cccc(Cl)c1	ZINC000819033712	FH	On-Demand	Anodyne	ADRB3	50	44
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2F)C1)c1cccc(Cl)c1	ZINC000819033712	FH	On-Demand	Anodyne	CYP3A4	47	38
O=C(Nc1nc2c(s1)CCC2)C(F)=C1CCC1	ZINC000819033718	CF	On-Demand	Anodyne	SLC27A1	33	44
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819033723	GH	On-Demand	Anodyne	LIPG	54	40
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819033725	GH	On-Demand	Anodyne	LIPG	54	40
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819033727	GH	On-Demand	Anodyne	LIPG	54	40
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819033728	GH	On-Demand	Anodyne	LIPG	54	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819033767	FF	On-Demand	Anodyne	CCR3	33	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819033767	FF	On-Demand	Anodyne	GPR119	48	44
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819033769	FF	On-Demand	Anodyne	CCR3	33	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819033769	FF	On-Demand	Anodyne	GPR119	48	44
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819033771	FF	On-Demand	Anodyne	CCR3	33	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819033771	FF	On-Demand	Anodyne	GPR119	48	44
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819033773	FF	On-Demand	Anodyne	CCR3	33	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819033773	FF	On-Demand	Anodyne	GPR119	48	44
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2F)C1)c1cccnc1	ZINC000819033774	DE	On-Demand	Anodyne	ADRB3	50	49
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2F)C1)c1cccnc1	ZINC000819033776	DE	On-Demand	Anodyne	ADRB3	50	49
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2F)C1)c1cccnc1	ZINC000819033778	DE	On-Demand	Anodyne	ADRB3	50	49
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2F)C1)c1cccnc1	ZINC000819033779	DE	On-Demand	Anodyne	ADRB3	50	49
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)NCCN3CCCC3)nn2)C1	ZINC000819033821	GD	On-Demand	Anodyne	DRD4	40	32
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)NCCN3CCCC3)nn2)C1	ZINC000819033823	GD	On-Demand	Anodyne	DRD4	40	32
O=[N+]([O-])c1cccc([C@H](O)CNC2CCC2)c1	ZINC000819033824	BD	On-Demand	Bother	ADRB3	30	42
O=[N+]([O-])c1cccc([C@H](O)CNC2CCC2)c1	ZINC000819033824	BD	On-Demand	Bother	CACNA1D	47	35
CC[C@@H](O)CNCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819033874	CD	On-Demand	Anodyne	GPR119	32	43
CC[C@@H](O)CNCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819033875	CD	On-Demand	Anodyne	GPR119	32	43
C#Cc1cccc(NC(=S)N[C@H]2CCCCN(Cc3nc(C)no3)C2=O)c1	ZINC000819033890	GE	On-Demand	Mild	F10	15	58
C#Cc1cccc(NC(=S)N[C@@H]2CCCCN(Cc3nc(C)no3)C2=O)c1	ZINC000819033893	GE	On-Demand	Mild	F10	15	58
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033905	EE	On-Demand	Anodyne	HTR1A	83	59
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033905	EE	On-Demand	Anodyne	DRD2	66	58
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033905	EE	On-Demand	Anodyne	DRD4	43	36
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033905	EE	On-Demand	Anodyne	ADRA1D	18	45
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033905	EE	On-Demand	Anodyne	HTR2A	76	58
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033905	EE	On-Demand	Anodyne	HTR2C	37	48
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033905	EE	On-Demand	Anodyne	SLC6A4	19	52
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033905	EE	On-Demand	Anodyne	ADRA1A	26	50
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033905	EE	On-Demand	Anodyne	ADRA1B	19	45
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033905	EE	On-Demand	Anodyne	DRD3	82	48
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033905	EE	On-Demand	Anodyne	HRP1_PLAFA	70	40
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033905	EE	On-Demand	Anodyne	HTR7	88	50
O[C@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033905	EE	On-Demand	Anodyne	HTR6	15	50
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033907	EE	On-Demand	Anodyne	HTR1A	83	59
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033907	EE	On-Demand	Anodyne	DRD2	66	58
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033907	EE	On-Demand	Anodyne	DRD4	43	36
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033907	EE	On-Demand	Anodyne	ADRA1D	18	45
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033907	EE	On-Demand	Anodyne	HTR2A	76	58
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033907	EE	On-Demand	Anodyne	HTR2C	37	48
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033907	EE	On-Demand	Anodyne	SLC6A4	19	52
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033907	EE	On-Demand	Anodyne	ADRA1A	26	50
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033907	EE	On-Demand	Anodyne	ADRA1B	19	45
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033907	EE	On-Demand	Anodyne	DRD3	82	48
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033907	EE	On-Demand	Anodyne	HRP1_PLAFA	70	40
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033907	EE	On-Demand	Anodyne	HTR7	88	50
O[C@@H](CNCCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819033907	EE	On-Demand	Anodyne	HTR6	15	50
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819033910	GH	On-Demand	Anodyne	GPR119	43	45
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819033912	GH	On-Demand	Anodyne	GPR119	43	45
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819033914	GH	On-Demand	Anodyne	GPR119	43	45
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819033915	GH	On-Demand	Anodyne	GPR119	43	45
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccccc2F)C1	ZINC000819033916	GF	On-Demand	Anodyne	ADRB2	30	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccccc2F)C1	ZINC000819033916	GF	On-Demand	Anodyne	ADRB1	58	39
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccccc2F)C1	ZINC000819033916	GF	On-Demand	Anodyne	ADRB3	28	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccccc2F)C1	ZINC000819033916	GF	On-Demand	Anodyne	ABCB1	34	46
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccccc2F)C1	ZINC000819033916	GF	On-Demand	Anodyne	GPR119	43	48
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccccc2F)C1	ZINC000819033917	GF	On-Demand	Anodyne	ADRB2	30	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccccc2F)C1	ZINC000819033917	GF	On-Demand	Anodyne	ADRB1	58	39
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccccc2F)C1	ZINC000819033917	GF	On-Demand	Anodyne	ADRB3	28	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccccc2F)C1	ZINC000819033917	GF	On-Demand	Anodyne	ABCB1	34	46
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccccc2F)C1	ZINC000819033917	GF	On-Demand	Anodyne	GPR119	43	48
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccccc2F)C1	ZINC000819033919	GF	On-Demand	Anodyne	ADRB2	30	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccccc2F)C1	ZINC000819033919	GF	On-Demand	Anodyne	ADRB1	58	39
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccccc2F)C1	ZINC000819033919	GF	On-Demand	Anodyne	ADRB3	28	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccccc2F)C1	ZINC000819033919	GF	On-Demand	Anodyne	ABCB1	34	46
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccccc2F)C1	ZINC000819033919	GF	On-Demand	Anodyne	GPR119	43	48
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccccc2F)C1	ZINC000819033921	GF	On-Demand	Anodyne	ADRB2	30	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccccc2F)C1	ZINC000819033921	GF	On-Demand	Anodyne	ADRB1	58	39
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccccc2F)C1	ZINC000819033921	GF	On-Demand	Anodyne	ADRB3	28	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccccc2F)C1	ZINC000819033921	GF	On-Demand	Anodyne	ABCB1	34	46
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccccc2F)C1	ZINC000819033921	GF	On-Demand	Anodyne	GPR119	43	48
N#CCN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819033923	CD	On-Demand	Mild	ADRB1	35	46
N#CCN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819033923	CD	On-Demand	Mild	ADRB3	55	48
N#CCN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819033923	CD	On-Demand	Mild	IGF1R	28	46
N#CCN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819033923	CD	On-Demand	Mild	CYP3A4	48	39
N#CCN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819033924	CD	On-Demand	Mild	ADRB1	35	46
N#CCN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819033924	CD	On-Demand	Mild	ADRB3	55	48
N#CCN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819033924	CD	On-Demand	Mild	IGF1R	28	46
N#CCN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819033924	CD	On-Demand	Mild	CYP3A4	48	39
O=[N+]([O-])c1cccc([C@@H](O)CNCCS(=O)(=O)N2CCSCC2)c1	ZINC000819033937	GC	On-Demand	Bother	ADRB3	41	31
O=[N+]([O-])c1cccc([C@H](O)CNCCS(=O)(=O)N2CCSCC2)c1	ZINC000819033938	GC	On-Demand	Bother	ADRB3	41	31
CON(C)C(=O)CCNCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819033958	FF	On-Demand	Anodyne	DRD4	27	48
CON(C)C(=O)CCNCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819033958	FF	On-Demand	Anodyne	ACHE	40	44
CON(C)C(=O)CCNCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819033958	FF	On-Demand	Anodyne	HTR4	45	38
CON(C)C(=O)CCNCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819033958	FF	On-Demand	Anodyne	SIGMAR1	37	47
CON(C)C(=O)CCNCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819033958	FF	On-Demand	Anodyne	CCR3	37	41
CON(C)C(=O)CCNCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819033958	FF	On-Demand	Anodyne	CACNA1I	51	36
C#CCNC(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819033977	FD	On-Demand	Mild	HTR1A	101	57
C#CCNC(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819033977	FD	On-Demand	Mild	DRD2	82	57
C#CCNC(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819033977	FD	On-Demand	Mild	DRD1	21	48
C#CCNC(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819033977	FD	On-Demand	Mild	DRD4	49	40
C#CCNC(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819033977	FD	On-Demand	Mild	ADRA1D	35	43
C#CCNC(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819033977	FD	On-Demand	Mild	HTR2A	80	57
C#CCNC(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819033977	FD	On-Demand	Mild	HTR2C	46	51
C#CCNC(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819033977	FD	On-Demand	Mild	SLC6A4	23	51
C#CCNC(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819033977	FD	On-Demand	Mild	ADRA1A	43	46
C#CCNC(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819033977	FD	On-Demand	Mild	ADRA1B	27	43
C#CCNC(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819033977	FD	On-Demand	Mild	DRD3	108	49
C#CCNC(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819033977	FD	On-Demand	Mild	HTR4	15	41
C#CCNC(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819033977	FD	On-Demand	Mild	HRP1_PLAFA	55	40
C#CCNC(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819033977	FD	On-Demand	Mild	HTR7	119	51
C#CCNC(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819033977	FD	On-Demand	Mild	CACNA1G	15	53
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccccc2)C1	ZINC000819033999	FF	On-Demand	Anodyne	ADRB2	58	45
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccccc2)C1	ZINC000819033999	FF	On-Demand	Anodyne	ADRB1	92	45
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccccc2)C1	ZINC000819033999	FF	On-Demand	Anodyne	ADRB3	64	45
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccccc2)C1	ZINC000819033999	FF	On-Demand	Anodyne	ABCB1	34	45
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccccc2)C1	ZINC000819033999	FF	On-Demand	Anodyne	GPR119	45	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccccc2)C1	ZINC000819033999	FF	On-Demand	Anodyne	SFRP1	17	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccccc2)C1	ZINC000819034000	FF	On-Demand	Anodyne	ADRB2	58	45
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccccc2)C1	ZINC000819034000	FF	On-Demand	Anodyne	ADRB1	92	45
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccccc2)C1	ZINC000819034000	FF	On-Demand	Anodyne	ADRB3	64	45
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccccc2)C1	ZINC000819034000	FF	On-Demand	Anodyne	ABCB1	34	45
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccccc2)C1	ZINC000819034000	FF	On-Demand	Anodyne	GPR119	45	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccccc2)C1	ZINC000819034000	FF	On-Demand	Anodyne	SFRP1	17	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccccc2)C1	ZINC000819034001	FF	On-Demand	Anodyne	ADRB2	58	45
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccccc2)C1	ZINC000819034001	FF	On-Demand	Anodyne	ADRB1	92	45
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccccc2)C1	ZINC000819034001	FF	On-Demand	Anodyne	ADRB3	64	45
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccccc2)C1	ZINC000819034001	FF	On-Demand	Anodyne	ABCB1	34	45
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccccc2)C1	ZINC000819034001	FF	On-Demand	Anodyne	GPR119	45	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccccc2)C1	ZINC000819034001	FF	On-Demand	Anodyne	SFRP1	17	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccccc2)C1	ZINC000819034002	FF	On-Demand	Anodyne	ADRB2	58	45
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccccc2)C1	ZINC000819034002	FF	On-Demand	Anodyne	ADRB1	92	45
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccccc2)C1	ZINC000819034002	FF	On-Demand	Anodyne	ADRB3	64	45
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccccc2)C1	ZINC000819034002	FF	On-Demand	Anodyne	ABCB1	34	45
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccccc2)C1	ZINC000819034002	FF	On-Demand	Anodyne	GPR119	45	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccccc2)C1	ZINC000819034002	FF	On-Demand	Anodyne	SFRP1	17	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2cccc3ccccc23)C1	ZINC000819034013	GI	On-Demand	Anodyne	SSTR2	40	34
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2cccc3ccccc23)C1	ZINC000819034013	GI	On-Demand	Anodyne	GPR119	35	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2cccc3ccccc23)C1	ZINC000819034020	GI	On-Demand	Anodyne	SSTR2	40	34
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2cccc3ccccc23)C1	ZINC000819034020	GI	On-Demand	Anodyne	GPR119	35	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819034047	FG	On-Demand	Anodyne	GPR119	45	48
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819034048	FG	On-Demand	Anodyne	GPR119	45	48
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819034049	FG	On-Demand	Anodyne	GPR119	45	48
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819034050	FG	On-Demand	Anodyne	GPR119	45	48
O=[N+]([O-])c1ccc(NC(=S)N2CC[C@]3(C[C@@H](O)c4ccccc4O3)C2)cc1	ZINC000819034070	GG	On-Demand	Bother	TRPM8	22	40
O=[N+]([O-])c1ccc(NC(=S)N2CC[C@]3(C[C@H](O)c4ccccc4O3)C2)cc1	ZINC000819034072	GG	On-Demand	Bother	TRPM8	22	40
O=[N+]([O-])c1ccc(NC(=S)N2CC[C@@]3(C[C@H](O)c4ccccc4O3)C2)cc1	ZINC000819034074	GG	On-Demand	Bother	TRPM8	22	40
O=[N+]([O-])c1ccc(NC(=S)N2CC[C@@]3(C[C@@H](O)c4ccccc4O3)C2)cc1	ZINC000819034076	GG	On-Demand	Bother	TRPM8	22	40
CC(=O)Nc1ccc(OC(=O)[C@H]2CCCC[C@H]2C)cc1	ZINC000819034082	CG	On-Demand	Anodyne	EPHX2	17	42
CC(=O)Nc1ccc(OC(=O)[C@@H]2CCCC[C@H]2C)cc1	ZINC000819034083	CG	On-Demand	Anodyne	EPHX2	17	42
CC(=O)Nc1ccc(OC(=O)[C@H]2CCCC[C@@H]2C)cc1	ZINC000819034084	CG	On-Demand	Anodyne	EPHX2	17	42
CC(=O)Nc1ccc(OC(=O)[C@@H]2CCCC[C@@H]2C)cc1	ZINC000819034085	CG	On-Demand	Anodyne	EPHX2	17	42
CC(=O)Nc1ccc(OC(=O)C(F)=C2CCC2)cc1	ZINC000819034086	CF	On-Demand	Anodyne	ACR	43	40
Cc1noc(C)c1CCNC[C@H](O)c1cccnc1	ZINC000819034100	CD	On-Demand	Anodyne	ADRB2	31	46
Cc1noc(C)c1CCNC[C@H](O)c1cccnc1	ZINC000819034100	CD	On-Demand	Anodyne	ADRB1	37	49
Cc1noc(C)c1CCNC[C@H](O)c1cccnc1	ZINC000819034100	CD	On-Demand	Anodyne	ADRB3	118	49
Cc1noc(C)c1CCNC[C@@H](O)c1cccnc1	ZINC000819034101	CD	On-Demand	Anodyne	ADRB2	31	46
Cc1noc(C)c1CCNC[C@@H](O)c1cccnc1	ZINC000819034101	CD	On-Demand	Anodyne	ADRB1	37	49
Cc1noc(C)c1CCNC[C@@H](O)c1cccnc1	ZINC000819034101	CD	On-Demand	Anodyne	ADRB3	118	49
Cc1noc(C)c1CCNC[C@H](O)c1ccccc1	ZINC000819034133	CE	On-Demand	Anodyne	ADRB2	33	48
Cc1noc(C)c1CCNC[C@H](O)c1ccccc1	ZINC000819034133	CE	On-Demand	Anodyne	ADRB1	41	40
Cc1noc(C)c1CCNC[C@H](O)c1ccccc1	ZINC000819034133	CE	On-Demand	Anodyne	ADRB3	86	44
Cc1noc(C)c1CCNC[C@@H](O)c1ccccc1	ZINC000819034134	CE	On-Demand	Anodyne	ADRB2	33	48
Cc1noc(C)c1CCNC[C@@H](O)c1ccccc1	ZINC000819034134	CE	On-Demand	Anodyne	ADRB1	41	40
Cc1noc(C)c1CCNC[C@@H](O)c1ccccc1	ZINC000819034134	CE	On-Demand	Anodyne	ADRB3	86	44
O=C(Oc1ccc(-n2cnnn2)cc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819034157	FG	On-Demand	Anodyne	KCNJ1	42	33
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2F)C1)c1ccccc1C(F)(F)F	ZINC000819034169	GH	On-Demand	Anodyne	LIPG	42	34
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2F)C1)c1ccccc1C(F)(F)F	ZINC000819034170	GH	On-Demand	Anodyne	LIPG	42	34
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2F)C1)c1ccccc1C(F)(F)F	ZINC000819034171	GH	On-Demand	Anodyne	LIPG	42	34
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2F)C1)c1ccccc1C(F)(F)F	ZINC000819034172	GH	On-Demand	Anodyne	LIPG	42	34
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)C2CC2)C1	ZINC000819034203	CD	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)C2CC2)C1	ZINC000819034204	CD	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)C2CC2)C1	ZINC000819034205	CD	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)C2CC2)C1	ZINC000819034206	CD	On-Demand	Anodyne	GPR119	30	41
C[C@H]1c2ccsc2CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819034232	GH	On-Demand	Mild	PAPA1_CARPA	35	40
C[C@H]1c2ccsc2CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819034235	GH	On-Demand	Mild	PAPA1_CARPA	35	40
CC(C)(C)OC(=O)N1CC[C@H](CCNCCC(=O)Nc2cccnc2)C1	ZINC000819034236	FF	On-Demand	Anodyne	GRIN2B	17	45
CC(C)(C)OC(=O)N1CC[C@H](CCNCCC(=O)Nc2cccnc2)C1	ZINC000819034236	FF	On-Demand	Anodyne	GPR119	40	41
CC(C)(C)OC(=O)N1CC[C@H](CCNCCC(=O)Nc2cccnc2)C1	ZINC000819034236	FF	On-Demand	Anodyne	NAMPT	20	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNCCC(=O)Nc2cccnc2)C1	ZINC000819034237	FF	On-Demand	Anodyne	GRIN2B	17	45
CC(C)(C)OC(=O)N1CC[C@@H](CCNCCC(=O)Nc2cccnc2)C1	ZINC000819034237	FF	On-Demand	Anodyne	GPR119	40	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNCCC(=O)Nc2cccnc2)C1	ZINC000819034237	FF	On-Demand	Anodyne	NAMPT	20	40
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CCN(c2ccc(F)cc2F)C1	ZINC000819034248	GE	On-Demand	Anodyne	NPY2R	47	35
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CCN(c2ccc(F)cc2F)C1	ZINC000819034248	GE	On-Demand	Anodyne	LIPG	41	35
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CCN(c2ccc(F)cc2F)C1	ZINC000819034248	GE	On-Demand	Anodyne	GPR119	20	41
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CCN(c2ccc(F)cc2F)C1	ZINC000819034249	GE	On-Demand	Anodyne	NPY2R	47	35
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CCN(c2ccc(F)cc2F)C1	ZINC000819034249	GE	On-Demand	Anodyne	LIPG	41	35
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CCN(c2ccc(F)cc2F)C1	ZINC000819034249	GE	On-Demand	Anodyne	GPR119	20	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1CCN(c2ccc(F)cc2F)C1	ZINC000819034250	GE	On-Demand	Anodyne	NPY2R	47	35
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1CCN(c2ccc(F)cc2F)C1	ZINC000819034250	GE	On-Demand	Anodyne	LIPG	41	35
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1CCN(c2ccc(F)cc2F)C1	ZINC000819034250	GE	On-Demand	Anodyne	GPR119	20	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H]1CCN(c2ccc(F)cc2F)C1	ZINC000819034251	GE	On-Demand	Anodyne	NPY2R	47	35
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H]1CCN(c2ccc(F)cc2F)C1	ZINC000819034251	GE	On-Demand	Anodyne	LIPG	41	35
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H]1CCN(c2ccc(F)cc2F)C1	ZINC000819034251	GE	On-Demand	Anodyne	GPR119	20	41
CC(=O)Nc1ccc(NC(=S)N[C@@H]2CCC[C@H](C3CC3)C2)cc1	ZINC000819034252	EH	On-Demand	Anodyne	EPHX2	25	42
CC(=O)Nc1cccc(NC(=S)N[C@@H]2CCC[C@H](C3CC3)C2)c1	ZINC000819034284	EH	On-Demand	Anodyne	KCNK3	48	36
CC(=O)Nc1cccc(NC(=S)N[C@@H]2CCC[C@H](C3CC3)C2)c1	ZINC000819034284	EH	On-Demand	Anodyne	KCNK9	42	32
O=C(NCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819034285	EE	On-Demand	Anodyne	HTR1A	26	53
O=C(NCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819034285	EE	On-Demand	Anodyne	DRD2	32	41
O=C(NCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819034285	EE	On-Demand	Anodyne	DRD4	51	40
O=C(NCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819034285	EE	On-Demand	Anodyne	ACHE	35	43
O=C(NCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819034285	EE	On-Demand	Anodyne	HTR2A	16	46
O=C(NCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819034285	EE	On-Demand	Anodyne	DRD3	35	45
O=C(NCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819034285	EE	On-Demand	Anodyne	SIGMAR1	69	53
O=C(NCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819034285	EE	On-Demand	Anodyne	NPFFR1	44	39
S=C(Nc1ccc2c(c1)OCCCO2)NC1C[C@H]2C[C@@H]2C1	ZINC000819034286	DF	On-Demand	Anodyne	QPCT	15	40
S=C(Nc1ccc2c(c1)OCCCO2)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819034287	DF	On-Demand	Anodyne	QPCT	15	40
S=C(Nc1ccc2c(c1)OCCCO2)NC1C[C@@H]2C[C@H]2C1	ZINC000819034288	DF	On-Demand	Anodyne	QPCT	15	40
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1cccnc1	ZINC000819034294	FG	On-Demand	Anodyne	ADRB3	73	40
O[C@@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1cccnc1	ZINC000819034294	FG	On-Demand	Anodyne	SIGMAR1	15	43
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1cccnc1	ZINC000819034295	FG	On-Demand	Anodyne	ADRB3	73	40
O[C@H](CNCC1CCN(Cc2ccccc2Cl)CC1)c1cccnc1	ZINC000819034295	FG	On-Demand	Anodyne	SIGMAR1	15	43
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2ccc(F)cn2)C1	ZINC000819034298	FE	On-Demand	Anodyne	GPR119	53	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2ccc(F)cn2)C1	ZINC000819034299	FE	On-Demand	Anodyne	GPR119	53	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819034300	FE	On-Demand	Anodyne	GPR119	53	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819034301	FE	On-Demand	Anodyne	GPR119	53	41
FC(F)(F)Oc1ccc(NC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000819034305	DH	On-Demand	Anodyne	EPHX2	65	54
FC(F)(F)Oc1ccc(NC(=S)NC2C[C@@H]3C[C@H]3C2)cc1	ZINC000819034306	DH	On-Demand	Anodyne	EPHX2	65	54
FC(F)(F)Oc1ccc(NC(=S)NC2C[C@H]3C[C@@H]3C2)cc1	ZINC000819034307	DH	On-Demand	Anodyne	EPHX2	65	54
O=C(COC(=O)CSc1ccccc1[N+](=O)[O-])Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819034312	JD	On-Demand	Bother	TGM2	64	38
O=C(COC(=O)CSc1ccccc1[N+](=O)[O-])Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819034312	JD	On-Demand	Bother	F13A1	87	39
O=C(COC(=O)CSc1ccccc1[N+](=O)[O-])Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819034312	JD	On-Demand	Bother	NAMPT	22	42
CC(C)(C)OC(=O)N1CC[C@H](Oc2ccnc(CNC(=S)NC3CC3)c2)C1	ZINC000819034323	GF	On-Demand	Anodyne	GPR119	42	39
CC(C)(C)OC(=O)N1CC[C@@H](Oc2ccnc(CNC(=S)NC3CC3)c2)C1	ZINC000819034324	GF	On-Demand	Anodyne	GPR119	42	39
C[S@@](=O)CCNC[C@H](O)COc1ccc(Cl)cc1Br	ZINC000819034330	FD	On-Demand	Anodyne	ADRB2	26	43
C[S@](=O)CCNC[C@@H](O)COc1ccc(Cl)cc1Br	ZINC000819034331	FD	On-Demand	Anodyne	ADRB2	26	43
C[S@@](=O)CCNC[C@@H](O)COc1ccc(Cl)cc1Br	ZINC000819034332	FD	On-Demand	Anodyne	ADRB2	26	43
C[S@](=O)CCNC[C@H](O)COc1ccc(Cl)cc1Br	ZINC000819034334	FD	On-Demand	Anodyne	ADRB2	26	43
Cc1noc(C)c1CCNC[C@H](O)c1cccc(F)c1	ZINC000819034354	CE	On-Demand	Anodyne	ADRB1	24	43
Cc1noc(C)c1CCNC[C@H](O)c1cccc(F)c1	ZINC000819034354	CE	On-Demand	Anodyne	ADRB3	58	43
Cc1noc(C)c1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819034356	CE	On-Demand	Anodyne	ADRB1	24	43
Cc1noc(C)c1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819034356	CE	On-Demand	Anodyne	ADRB3	58	43
CC(C)c1ccc(NC(=S)N2CC[C@@]3(C[C@@H](O)c4ccccc4O3)C2)cc1	ZINC000819034397	GI	On-Demand	Anodyne	TRPM8	22	41
CC(C)c1ccc(NC(=S)N2CC[C@]3(C[C@@H](O)c4ccccc4O3)C2)cc1	ZINC000819034407	GI	On-Demand	Anodyne	TRPM8	22	41
CC(C)c1ccc(NC(=S)N2CC[C@@]3(C[C@H](O)c4ccccc4O3)C2)cc1	ZINC000819034409	GI	On-Demand	Anodyne	TRPM8	22	41
CC(C)c1ccc(NC(=S)N2CC[C@]3(C[C@H](O)c4ccccc4O3)C2)cc1	ZINC000819034412	GI	On-Demand	Anodyne	TRPM8	22	41
O[C@@H](CNC1CCC1)c1cccc2ccccc12	ZINC000819034419	BG	On-Demand	Anodyne	ADRB2	18	42
O[C@@H](CNC1CCC1)c1cccc2ccccc12	ZINC000819034419	BG	On-Demand	Anodyne	ADRB1	16	42
NC(=O)c1ccc(NC(=S)N2CC[C@]3(C[C@H](O)c4ccccc4O3)C2)cc1	ZINC000819034421	GE	On-Demand	Anodyne	TRPM8	27	43
NC(=O)c1ccc(NC(=S)N2CC[C@@]3(C[C@H](O)c4ccccc4O3)C2)cc1	ZINC000819034422	GE	On-Demand	Anodyne	TRPM8	27	43
NC(=O)c1ccc(NC(=S)N2CC[C@@]3(C[C@@H](O)c4ccccc4O3)C2)cc1	ZINC000819034423	GE	On-Demand	Anodyne	TRPM8	27	43
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(CN2CCCCC2)cc1	ZINC000819034424	EG	On-Demand	Anodyne	HRH3	24	42
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(CN2CCCCC2)cc1	ZINC000819034424	EG	On-Demand	Anodyne	SIGMAR1	17	44
NC(=O)c1ccc(NC(=S)N2CC[C@]3(C[C@@H](O)c4ccccc4O3)C2)cc1	ZINC000819034426	GE	On-Demand	Anodyne	TRPM8	27	43
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(CN2CCCCC2)cc1	ZINC000819034427	EG	On-Demand	Anodyne	HRH3	24	42
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(CN2CCCCC2)cc1	ZINC000819034427	EG	On-Demand	Anodyne	SIGMAR1	17	44
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(CN2CCCCC2)cc1	ZINC000819034428	EG	On-Demand	Anodyne	HRH3	24	42
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(CN2CCCCC2)cc1	ZINC000819034428	EG	On-Demand	Anodyne	SIGMAR1	17	44
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(CN2CCCCC2)cc1	ZINC000819034430	EG	On-Demand	Anodyne	HRH3	24	42
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(CN2CCCCC2)cc1	ZINC000819034430	EG	On-Demand	Anodyne	SIGMAR1	17	44
Cc1ccc(NC(=S)N2CC[C@@]3(C[C@H](O)c4ccccc4O3)C2)cc1F	ZINC000819034432	FH	On-Demand	Anodyne	TRPM8	21	42
C[S@@](=O)CCNC[C@H](O)CCc1ccccc1	ZINC000819034433	CC	On-Demand	Anodyne	ADRB2	37	40
C[S@@](=O)CCNC[C@H](O)CCc1ccccc1	ZINC000819034433	CC	On-Demand	Anodyne	ADRB1	40	40
C[S@@](=O)CCNC[C@H](O)CCc1ccccc1	ZINC000819034433	CC	On-Demand	Anodyne	ADRB3	33	40
C[S@@](=O)CCNC[C@H](O)CCc1ccccc1	ZINC000819034433	CC	On-Demand	Anodyne	MME	28	41
C[S@@](=O)CCNC[C@H](O)CCc1ccccc1	ZINC000819034433	CC	On-Demand	Anodyne	ABCB1	15	41
Cc1ccc(NC(=S)N2CC[C@]3(C[C@H](O)c4ccccc4O3)C2)cc1F	ZINC000819034435	FH	On-Demand	Anodyne	TRPM8	21	42
C[S@](=O)CCNC[C@H](O)CCc1ccccc1	ZINC000819034437	CC	On-Demand	Anodyne	ADRB2	37	40
C[S@](=O)CCNC[C@H](O)CCc1ccccc1	ZINC000819034437	CC	On-Demand	Anodyne	ADRB1	40	40
C[S@](=O)CCNC[C@H](O)CCc1ccccc1	ZINC000819034437	CC	On-Demand	Anodyne	ADRB3	33	40
C[S@](=O)CCNC[C@H](O)CCc1ccccc1	ZINC000819034437	CC	On-Demand	Anodyne	MME	28	41
C[S@](=O)CCNC[C@H](O)CCc1ccccc1	ZINC000819034437	CC	On-Demand	Anodyne	ABCB1	15	41
Cc1ccc(NC(=S)N2CC[C@]3(C[C@@H](O)c4ccccc4O3)C2)cc1F	ZINC000819034439	FH	On-Demand	Anodyne	TRPM8	21	42
Cc1ccc(NC(=S)N2CC[C@@]3(C[C@@H](O)c4ccccc4O3)C2)cc1F	ZINC000819034441	FH	On-Demand	Anodyne	TRPM8	21	42
C[S@](=O)CCNC[C@@H](O)CCc1ccccc1	ZINC000819034443	CC	On-Demand	Anodyne	ADRB2	37	40
C[S@](=O)CCNC[C@@H](O)CCc1ccccc1	ZINC000819034443	CC	On-Demand	Anodyne	ADRB1	40	40
C[S@](=O)CCNC[C@@H](O)CCc1ccccc1	ZINC000819034443	CC	On-Demand	Anodyne	ADRB3	33	40
C[S@](=O)CCNC[C@@H](O)CCc1ccccc1	ZINC000819034443	CC	On-Demand	Anodyne	MME	28	41
C[S@](=O)CCNC[C@@H](O)CCc1ccccc1	ZINC000819034443	CC	On-Demand	Anodyne	ABCB1	15	41
O[C@H]1C[C@@]2(CCN(C(=S)Nc3ccc(Cl)nc3)C2)Oc2ccccc21	ZINC000819034449	GG	On-Demand	Anodyne	TRPM8	21	40
C[S@@](=O)CCNC[C@@H](O)CCc1ccccc1	ZINC000819034450	CC	On-Demand	Anodyne	ADRB2	37	40
C[S@@](=O)CCNC[C@@H](O)CCc1ccccc1	ZINC000819034450	CC	On-Demand	Anodyne	ADRB1	40	40
C[S@@](=O)CCNC[C@@H](O)CCc1ccccc1	ZINC000819034450	CC	On-Demand	Anodyne	ADRB3	33	40
C[S@@](=O)CCNC[C@@H](O)CCc1ccccc1	ZINC000819034450	CC	On-Demand	Anodyne	MME	28	41
C[S@@](=O)CCNC[C@@H](O)CCc1ccccc1	ZINC000819034450	CC	On-Demand	Anodyne	ABCB1	15	41
O[C@@H]1C[C@]2(CCN(C(=S)Nc3ccc(Cl)nc3)C2)Oc2ccccc21	ZINC000819034452	GG	On-Demand	Anodyne	TRPM8	21	40
O[C@H]1C[C@]2(CCN(C(=S)Nc3ccc(Cl)nc3)C2)Oc2ccccc21	ZINC000819034455	GG	On-Demand	Anodyne	TRPM8	21	40
O[C@@H]1C[C@@]2(CCN(C(=S)Nc3ccc(Cl)nc3)C2)Oc2ccccc21	ZINC000819034458	GG	On-Demand	Anodyne	TRPM8	21	40
C[S@@](=O)CCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819034493	DD	On-Demand	Anodyne	ADRB2	57	47
C[S@@](=O)CCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819034493	DD	On-Demand	Anodyne	ADRB1	82	47
C[S@@](=O)CCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819034493	DD	On-Demand	Anodyne	ADRB3	49	47
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1Br	ZINC000819034497	FI	On-Demand	Anodyne	HTR1B	21	42
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1Br	ZINC000819034497	FI	On-Demand	Anodyne	ADRB3	15	55
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1Br	ZINC000819034497	FI	On-Demand	Anodyne	MPO	68	43
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1Br	ZINC000819034497	FI	On-Demand	Anodyne	MMP9	15	44
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1Br	ZINC000819034498	FI	On-Demand	Anodyne	HTR1B	21	42
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1Br	ZINC000819034498	FI	On-Demand	Anodyne	ADRB3	15	55
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1Br	ZINC000819034498	FI	On-Demand	Anodyne	MPO	68	43
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1Br	ZINC000819034498	FI	On-Demand	Anodyne	MMP9	15	44
C[S@](=O)CCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819034500	DD	On-Demand	Anodyne	ADRB2	57	47
C[S@](=O)CCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819034500	DD	On-Demand	Anodyne	ADRB1	82	47
C[S@](=O)CCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819034500	DD	On-Demand	Anodyne	ADRB3	49	47
C[S@@](=O)CCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819034505	DD	On-Demand	Anodyne	ADRB2	57	47
C[S@@](=O)CCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819034505	DD	On-Demand	Anodyne	ADRB1	82	47
C[S@@](=O)CCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819034505	DD	On-Demand	Anodyne	ADRB3	49	47
C[S@](=O)CCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819034511	DD	On-Demand	Anodyne	ADRB2	57	47
C[S@](=O)CCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819034511	DD	On-Demand	Anodyne	ADRB1	82	47
C[S@](=O)CCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819034511	DD	On-Demand	Anodyne	ADRB3	49	47
Cc1noc(C)c1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819034512	DE	On-Demand	Bother	ADRB3	58	38
Cc1noc(C)c1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819034512	DE	On-Demand	Bother	CACNA1D	48	34
Cc1noc(C)c1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819034516	DE	On-Demand	Bother	ADRB3	58	38
Cc1noc(C)c1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819034516	DE	On-Demand	Bother	CACNA1D	48	34
CC(=O)Nc1ccc(OC(=O)[C@H]2C[C@@H]2c2ccc(C)cc2)cc1	ZINC000819034543	DH	On-Demand	Anodyne	SLC6A3	18	46
CC(=O)Nc1ccc(OC(=O)[C@H]2C[C@@H]2c2ccc(C)cc2)cc1	ZINC000819034543	DH	On-Demand	Anodyne	ACR	32	41
CC(=O)Nc1ccc(OC(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)cc1	ZINC000819034545	DH	On-Demand	Anodyne	SLC6A3	18	46
CC(=O)Nc1ccc(OC(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)cc1	ZINC000819034545	DH	On-Demand	Anodyne	ACR	32	41
CC(=O)Nc1ccc(OC(=O)[C@H]2C[C@H]2c2ccc(C)cc2)cc1	ZINC000819034547	DH	On-Demand	Anodyne	SLC6A3	18	46
CC(=O)Nc1ccc(OC(=O)[C@H]2C[C@H]2c2ccc(C)cc2)cc1	ZINC000819034547	DH	On-Demand	Anodyne	ACR	32	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2CCN(CC#N)CC2)CC1	ZINC000819034548	FD	On-Demand	Mild	GPR119	26	41
CC(=O)Nc1ccc(OC(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)cc1	ZINC000819034549	DH	On-Demand	Anodyne	SLC6A3	18	46
CC(=O)Nc1ccc(OC(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)cc1	ZINC000819034549	DH	On-Demand	Anodyne	ACR	32	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2CCN(CC#N)CC2)CC1	ZINC000819034550	FD	On-Demand	Mild	GPR119	26	41
CC(C)(C)OC(=O)N1CC[C@H](CCNCCS(=O)(=O)c2ccccc2)C1	ZINC000819034552	GF	On-Demand	Anodyne	CCR8	46	43
CC(C)(C)OC(=O)N1CC[C@H](CCNCCS(=O)(=O)c2ccccc2)C1	ZINC000819034552	GF	On-Demand	Anodyne	GPR119	53	43
CC(C)(C)OC(=O)N1CC[C@H](CCNCCS(=O)(=O)c2ccccc2)C1	ZINC000819034552	GF	On-Demand	Anodyne	SFRP1	120	48
CC(C)(C)OC(=O)N1CC[C@H](CCNCCS(=O)(=O)c2ccccc2)C1	ZINC000819034552	GF	On-Demand	Anodyne	WNT3	83	39
CC(C)(C)OC(=O)N1CC[C@@H](CCNCCS(=O)(=O)c2ccccc2)C1	ZINC000819034554	GF	On-Demand	Anodyne	CCR8	46	43
CC(C)(C)OC(=O)N1CC[C@@H](CCNCCS(=O)(=O)c2ccccc2)C1	ZINC000819034554	GF	On-Demand	Anodyne	GPR119	53	43
CC(C)(C)OC(=O)N1CC[C@@H](CCNCCS(=O)(=O)c2ccccc2)C1	ZINC000819034554	GF	On-Demand	Anodyne	SFRP1	120	48
CC(C)(C)OC(=O)N1CC[C@@H](CCNCCS(=O)(=O)c2ccccc2)C1	ZINC000819034554	GF	On-Demand	Anodyne	WNT3	83	39
O=S(=O)(CCNC[C@H](O)c1cccc(F)c1)N1CCSCC1	ZINC000819034567	EC	On-Demand	Anodyne	ADRB1	28	41
O=S(=O)(CCNC[C@H](O)c1cccc(F)c1)N1CCSCC1	ZINC000819034567	EC	On-Demand	Anodyne	ADRB3	52	41
O=S(=O)(CCNC[C@@H](O)c1cccc(F)c1)N1CCSCC1	ZINC000819034569	EC	On-Demand	Anodyne	ADRB1	28	41
O=S(=O)(CCNC[C@@H](O)c1cccc(F)c1)N1CCSCC1	ZINC000819034569	EC	On-Demand	Anodyne	ADRB3	52	41
COC(=O)c1ccc(OC[C@H](O)CNCC[S@](C)=O)cc1	ZINC000819034578	DC	On-Demand	Anodyne	ADRB2	56	53
COC(=O)c1ccc(OC[C@H](O)CNCC[S@](C)=O)cc1	ZINC000819034578	DC	On-Demand	Anodyne	ADRB1	90	53
COC(=O)c1ccc(OC[C@H](O)CNCC[S@](C)=O)cc1	ZINC000819034578	DC	On-Demand	Anodyne	ADRB3	56	53
COC(=O)c1ccc(OC[C@H](O)CNCC[S@](C)=O)cc1	ZINC000819034578	DC	On-Demand	Anodyne	ABCB1	17	52
COC(=O)c1ccc(OC[C@@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034579	DC	On-Demand	Anodyne	ADRB2	56	53
COC(=O)c1ccc(OC[C@@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034579	DC	On-Demand	Anodyne	ADRB1	90	53
COC(=O)c1ccc(OC[C@@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034579	DC	On-Demand	Anodyne	ADRB3	56	53
COC(=O)c1ccc(OC[C@@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034579	DC	On-Demand	Anodyne	ABCB1	17	52
COC(=O)c1ccc(OC[C@@H](O)CNCC[S@](C)=O)cc1	ZINC000819034580	DC	On-Demand	Anodyne	ADRB2	56	53
COC(=O)c1ccc(OC[C@@H](O)CNCC[S@](C)=O)cc1	ZINC000819034580	DC	On-Demand	Anodyne	ADRB1	90	53
COC(=O)c1ccc(OC[C@@H](O)CNCC[S@](C)=O)cc1	ZINC000819034580	DC	On-Demand	Anodyne	ADRB3	56	53
COC(=O)c1ccc(OC[C@@H](O)CNCC[S@](C)=O)cc1	ZINC000819034580	DC	On-Demand	Anodyne	ABCB1	17	52
COC(=O)c1ccc(OC[C@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034581	DC	On-Demand	Anodyne	ADRB2	56	53
COC(=O)c1ccc(OC[C@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034581	DC	On-Demand	Anodyne	ADRB1	90	53
COC(=O)c1ccc(OC[C@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034581	DC	On-Demand	Anodyne	ADRB3	56	53
COC(=O)c1ccc(OC[C@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034581	DC	On-Demand	Anodyne	ABCB1	17	52
C[S@@](=O)CCNC[C@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034589	GF	On-Demand	Anodyne	ADRB2	62	48
C[S@@](=O)CCNC[C@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034589	GF	On-Demand	Anodyne	ADRB1	89	49
C[S@@](=O)CCNC[C@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034589	GF	On-Demand	Anodyne	ADRB3	54	49
C[S@@](=O)CCNC[C@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034589	GF	On-Demand	Anodyne	CYP2D6	15	41
C[S@@](=O)CCNC[C@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034589	GF	On-Demand	Anodyne	ABCB1	17	48
C[S@](=O)CCNC[C@@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034590	GF	On-Demand	Anodyne	ADRB2	62	48
C[S@](=O)CCNC[C@@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034590	GF	On-Demand	Anodyne	ADRB1	89	49
C[S@](=O)CCNC[C@@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034590	GF	On-Demand	Anodyne	ADRB3	54	49
C[S@](=O)CCNC[C@@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034590	GF	On-Demand	Anodyne	CYP2D6	15	41
C[S@](=O)CCNC[C@@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034590	GF	On-Demand	Anodyne	ABCB1	17	48
C[S@@](=O)CCNC[C@@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034591	GF	On-Demand	Anodyne	ADRB2	62	48
C[S@@](=O)CCNC[C@@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034591	GF	On-Demand	Anodyne	ADRB1	89	49
C[S@@](=O)CCNC[C@@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034591	GF	On-Demand	Anodyne	ADRB3	54	49
C[S@@](=O)CCNC[C@@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034591	GF	On-Demand	Anodyne	CYP2D6	15	41
C[S@@](=O)CCNC[C@@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034591	GF	On-Demand	Anodyne	ABCB1	17	48
C[S@](=O)CCNC[C@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034592	GF	On-Demand	Anodyne	ADRB2	62	48
C[S@](=O)CCNC[C@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034592	GF	On-Demand	Anodyne	ADRB1	89	49
C[S@](=O)CCNC[C@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034592	GF	On-Demand	Anodyne	ADRB3	54	49
C[S@](=O)CCNC[C@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034592	GF	On-Demand	Anodyne	CYP2D6	15	41
C[S@](=O)CCNC[C@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819034592	GF	On-Demand	Anodyne	ABCB1	17	48
S=C(NC1C[C@@H]2C[C@H]2C1)NC12CC3CC(CC(C3)C1)C2	ZINC000819034596	CG	On-Demand	Anodyne	EPHX2	71	48
S=C(N[C@H]1C[C@@H]2C[C@@H]2C1)NC12CC3CC(CC(C3)C1)C2	ZINC000819034597	CG	On-Demand	Anodyne	EPHX2	71	48
CSc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819034602	FH	On-Demand	Mild	PAPA1_CARPA	47	50
CSc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819034602	FH	On-Demand	Mild	CTSK	21	50
CSc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819034602	FH	On-Demand	Mild	FPR1	51	41
CSc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819034603	FH	On-Demand	Mild	PAPA1_CARPA	47	50
CSc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819034603	FH	On-Demand	Mild	CTSK	21	50
CSc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819034603	FH	On-Demand	Mild	FPR1	51	41
CC(=O)Nc1ccc(OC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819034605	GG	On-Demand	Mild	PAPA1_CARPA	45	43
CC(=O)Nc1ccc(OC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819034605	GG	On-Demand	Mild	CTSK	21	42
CC(=O)Nc1ccc(OC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819034606	GG	On-Demand	Mild	PAPA1_CARPA	45	43
CC(=O)Nc1ccc(OC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819034606	GG	On-Demand	Mild	CTSK	21	42
COC(=O)N1C[C@H]2C=C[C@H]1[C@H](C(=O)Oc1ccc3c(C)cc(=O)oc3c1)C2	ZINC000819034629	FF	On-Demand	Anodyne	MAOA	55	44
C[C@@H]1CCCC[C@@H]1C(=O)NCc1ccc(N2CCCC2=O)cc1	ZINC000819034667	DG	On-Demand	Anodyne	P2RX7	29	41
C[C@@H]1CCCC[C@H]1C(=O)NCc1ccc(N2CCCC2=O)cc1	ZINC000819034668	DG	On-Demand	Anodyne	P2RX7	29	41
O[C@H]1C[C@@]2(CCN(C(=S)NCCc3ccccc3)C2)Oc2ccccc21	ZINC000819034672	FG	On-Demand	Anodyne	GHRHR	41	33
O[C@@H]1C[C@]2(CCN(C(=S)NCCc3ccccc3)C2)Oc2ccccc21	ZINC000819034673	FG	On-Demand	Anodyne	GHRHR	41	33
O[C@H]1C[C@]2(CCN(C(=S)NCCc3ccccc3)C2)Oc2ccccc21	ZINC000819034674	FG	On-Demand	Anodyne	GHRHR	41	33
O[C@@H]1C[C@@]2(CCN(C(=S)NCCc3ccccc3)C2)Oc2ccccc21	ZINC000819034675	FG	On-Demand	Anodyne	GHRHR	41	33
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cccc(Br)c1	ZINC000819034683	FI	On-Demand	Anodyne	ADRB2	59	41
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cccc(Br)c1	ZINC000819034683	FI	On-Demand	Anodyne	ADRB1	44	48
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cccc(Br)c1	ZINC000819034683	FI	On-Demand	Anodyne	ADRB3	53	67
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cccc(Br)c1	ZINC000819034683	FI	On-Demand	Anodyne	MPO	77	43
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cccc(Br)c1	ZINC000819034684	FI	On-Demand	Anodyne	ADRB2	59	41
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cccc(Br)c1	ZINC000819034684	FI	On-Demand	Anodyne	ADRB1	44	48
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cccc(Br)c1	ZINC000819034684	FI	On-Demand	Anodyne	ADRB3	53	67
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cccc(Br)c1	ZINC000819034684	FI	On-Demand	Anodyne	MPO	77	43
CCCc1cc(=O)oc2cc(OC(=O)c3cc4c(cn3)OCCO4)ccc12	ZINC000819034685	FG	On-Demand	Anodyne	MAOA	48	37
CCCc1cc(=O)oc2cc(OC(=O)c3cc4c(cn3)OCCO4)ccc12	ZINC000819034685	FG	On-Demand	Anodyne	MAOB	29	43
CCCc1cc(=O)oc2cc(OC(=O)c3cc4c(cn3)OCCO4)ccc12	ZINC000819034685	FG	On-Demand	Anodyne	HSD17B3	15	47
C=CCC1(C(=O)Oc2ccc3c(CCC)cc(=O)oc3c2)CCOCC1	ZINC000819034687	FI	On-Demand	Mild	HSD17B3	19	49
S=C(NC1C[C@H]2C[C@@H]2C1)NC12CC3CC(CC(C3)C1)C2	ZINC000819034692	CG	On-Demand	Anodyne	EPHX2	71	48
CC(=O)Nc1cccc(NC(=S)NC2C[C@H]3C[C@@H]3C2)c1	ZINC000819034737	CF	On-Demand	Anodyne	PPIA	15	41
CC(=O)Nc1cccc(NC(=S)NC2C[C@H]3C[C@@H]3C2)c1	ZINC000819034737	CF	On-Demand	Anodyne	EPHX2	15	46
CC(=O)Nc1cccc(NC(=S)NC2C[C@H]3C[C@@H]3C2)c1	ZINC000819034737	CF	On-Demand	Anodyne	KCNK3	96	36
CC(=O)Nc1cccc(NC(=S)NC2C[C@H]3C[C@@H]3C2)c1	ZINC000819034737	CF	On-Demand	Anodyne	KCNK9	62	36
CC(=O)Nc1cccc(NC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000819034738	CF	On-Demand	Anodyne	PPIA	15	41
CC(=O)Nc1cccc(NC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000819034738	CF	On-Demand	Anodyne	EPHX2	15	46
CC(=O)Nc1cccc(NC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000819034738	CF	On-Demand	Anodyne	KCNK3	96	36
CC(=O)Nc1cccc(NC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000819034738	CF	On-Demand	Anodyne	KCNK9	62	36
CC(=O)Nc1cccc(NC(=S)NC2C[C@@H]3C[C@H]3C2)c1	ZINC000819034739	CF	On-Demand	Anodyne	PPIA	15	41
CC(=O)Nc1cccc(NC(=S)NC2C[C@@H]3C[C@H]3C2)c1	ZINC000819034739	CF	On-Demand	Anodyne	EPHX2	15	46
CC(=O)Nc1cccc(NC(=S)NC2C[C@@H]3C[C@H]3C2)c1	ZINC000819034739	CF	On-Demand	Anodyne	KCNK3	96	36
CC(=O)Nc1cccc(NC(=S)NC2C[C@@H]3C[C@H]3C2)c1	ZINC000819034739	CF	On-Demand	Anodyne	KCNK9	62	36
S=C(Nc1ccc2c(c1)OCCO2)NC1C[C@H]2C[C@@H]2C1	ZINC000819034751	CF	On-Demand	Anodyne	QPCT	16	43
S=C(Nc1ccc2c(c1)OCCO2)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819034752	CF	On-Demand	Anodyne	QPCT	16	43
S=C(Nc1ccc2c(c1)OCCO2)NC1C[C@@H]2C[C@H]2C1	ZINC000819034753	CF	On-Demand	Anodyne	QPCT	16	43
CC(=O)c1ccc(OC[C@@H](O)CNCC[S@](C)=O)cc1	ZINC000819034756	CC	On-Demand	Anodyne	ADRB2	51	48
CC(=O)c1ccc(OC[C@@H](O)CNCC[S@](C)=O)cc1	ZINC000819034756	CC	On-Demand	Anodyne	ADRB1	84	48
CC(=O)c1ccc(OC[C@@H](O)CNCC[S@](C)=O)cc1	ZINC000819034756	CC	On-Demand	Anodyne	ADRB3	50	48
CC(=O)c1ccc(OC[C@@H](O)CNCC[S@](C)=O)cc1	ZINC000819034756	CC	On-Demand	Anodyne	ABCB1	19	64
CC(=O)c1ccc(OC[C@@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034758	CC	On-Demand	Anodyne	ADRB2	51	48
CC(=O)c1ccc(OC[C@@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034758	CC	On-Demand	Anodyne	ADRB1	84	48
CC(=O)c1ccc(OC[C@@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034758	CC	On-Demand	Anodyne	ADRB3	50	48
CC(=O)c1ccc(OC[C@@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034758	CC	On-Demand	Anodyne	ABCB1	19	64
CC(=O)c1ccc(OC[C@H](O)CNCC[S@](C)=O)cc1	ZINC000819034759	CC	On-Demand	Anodyne	ADRB2	51	48
CC(=O)c1ccc(OC[C@H](O)CNCC[S@](C)=O)cc1	ZINC000819034759	CC	On-Demand	Anodyne	ADRB1	84	48
CC(=O)c1ccc(OC[C@H](O)CNCC[S@](C)=O)cc1	ZINC000819034759	CC	On-Demand	Anodyne	ADRB3	50	48
CC(=O)c1ccc(OC[C@H](O)CNCC[S@](C)=O)cc1	ZINC000819034759	CC	On-Demand	Anodyne	ABCB1	19	64
CC(=O)c1ccc(OC[C@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034761	CC	On-Demand	Anodyne	ADRB2	51	48
CC(=O)c1ccc(OC[C@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034761	CC	On-Demand	Anodyne	ADRB1	84	48
CC(=O)c1ccc(OC[C@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034761	CC	On-Demand	Anodyne	ADRB3	50	48
CC(=O)c1ccc(OC[C@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034761	CC	On-Demand	Anodyne	ABCB1	19	64
C[S@@](=O)CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819034809	EE	On-Demand	Anodyne	ADRB2	75	52
C[S@@](=O)CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819034809	EE	On-Demand	Anodyne	ADRB1	111	53
C[S@@](=O)CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819034809	EE	On-Demand	Anodyne	ADRB3	77	53
C[S@@](=O)CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819034809	EE	On-Demand	Anodyne	ABCB1	19	52
C[S@](=O)CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819034810	EE	On-Demand	Anodyne	ADRB2	75	52
C[S@](=O)CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819034810	EE	On-Demand	Anodyne	ADRB1	111	53
C[S@](=O)CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819034810	EE	On-Demand	Anodyne	ADRB3	77	53
C[S@](=O)CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819034810	EE	On-Demand	Anodyne	ABCB1	19	52
C[S@](=O)CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819034812	EE	On-Demand	Anodyne	ADRB2	75	52
C[S@](=O)CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819034812	EE	On-Demand	Anodyne	ADRB1	111	53
C[S@](=O)CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819034812	EE	On-Demand	Anodyne	ADRB3	77	53
C[S@](=O)CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819034812	EE	On-Demand	Anodyne	ABCB1	19	52
C[S@@](=O)CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819034814	EE	On-Demand	Anodyne	ADRB2	75	52
C[S@@](=O)CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819034814	EE	On-Demand	Anodyne	ADRB1	111	53
C[S@@](=O)CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819034814	EE	On-Demand	Anodyne	ADRB3	77	53
C[S@@](=O)CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819034814	EE	On-Demand	Anodyne	ABCB1	19	52
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819034816	EF	On-Demand	Anodyne	CHRM2	17	49
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819034816	EF	On-Demand	Anodyne	CHRM1	15	49
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819034816	EF	On-Demand	Anodyne	DRD2	21	57
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819034816	EF	On-Demand	Anodyne	DRD4	54	57
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819034816	EF	On-Demand	Anodyne	ACHE	50	51
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819034816	EF	On-Demand	Anodyne	DRD3	17	57
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819034816	EF	On-Demand	Anodyne	CHRM3	22	49
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819034816	EF	On-Demand	Anodyne	LTA4H	19	41
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819034816	EF	On-Demand	Anodyne	SIGMAR1	84	62
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819034816	EF	On-Demand	Anodyne	SSTR5	45	35
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819034816	EF	On-Demand	Anodyne	CCR3	23	46
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819034816	EF	On-Demand	Anodyne	CXCR3	19	41
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819034816	EF	On-Demand	Anodyne	MCHR1	41	49
S=C(NC1CCN(Cc2ccccc2)CC1)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819034816	EF	On-Demand	Anodyne	CACNA1G	15	45
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@@H]2C[C@H]2C1	ZINC000819034818	EF	On-Demand	Anodyne	CHRM2	17	49
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@@H]2C[C@H]2C1	ZINC000819034818	EF	On-Demand	Anodyne	CHRM1	15	49
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@@H]2C[C@H]2C1	ZINC000819034818	EF	On-Demand	Anodyne	DRD2	21	57
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@@H]2C[C@H]2C1	ZINC000819034818	EF	On-Demand	Anodyne	DRD4	54	57
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@@H]2C[C@H]2C1	ZINC000819034818	EF	On-Demand	Anodyne	ACHE	50	51
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@@H]2C[C@H]2C1	ZINC000819034818	EF	On-Demand	Anodyne	DRD3	17	57
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@@H]2C[C@H]2C1	ZINC000819034818	EF	On-Demand	Anodyne	CHRM3	22	49
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@@H]2C[C@H]2C1	ZINC000819034818	EF	On-Demand	Anodyne	LTA4H	19	41
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@@H]2C[C@H]2C1	ZINC000819034818	EF	On-Demand	Anodyne	SIGMAR1	84	62
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@@H]2C[C@H]2C1	ZINC000819034818	EF	On-Demand	Anodyne	SSTR5	45	35
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@@H]2C[C@H]2C1	ZINC000819034818	EF	On-Demand	Anodyne	CCR3	23	46
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@@H]2C[C@H]2C1	ZINC000819034818	EF	On-Demand	Anodyne	CXCR3	19	41
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@@H]2C[C@H]2C1	ZINC000819034818	EF	On-Demand	Anodyne	MCHR1	41	49
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@@H]2C[C@H]2C1	ZINC000819034818	EF	On-Demand	Anodyne	CACNA1G	15	45
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@H]2C[C@@H]2C1	ZINC000819034820	EF	On-Demand	Anodyne	CHRM2	17	49
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@H]2C[C@@H]2C1	ZINC000819034820	EF	On-Demand	Anodyne	CHRM1	15	49
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@H]2C[C@@H]2C1	ZINC000819034820	EF	On-Demand	Anodyne	DRD2	21	57
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@H]2C[C@@H]2C1	ZINC000819034820	EF	On-Demand	Anodyne	DRD4	54	57
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@H]2C[C@@H]2C1	ZINC000819034820	EF	On-Demand	Anodyne	ACHE	50	51
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@H]2C[C@@H]2C1	ZINC000819034820	EF	On-Demand	Anodyne	DRD3	17	57
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@H]2C[C@@H]2C1	ZINC000819034820	EF	On-Demand	Anodyne	CHRM3	22	49
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@H]2C[C@@H]2C1	ZINC000819034820	EF	On-Demand	Anodyne	LTA4H	19	41
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@H]2C[C@@H]2C1	ZINC000819034820	EF	On-Demand	Anodyne	SIGMAR1	84	62
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@H]2C[C@@H]2C1	ZINC000819034820	EF	On-Demand	Anodyne	SSTR5	45	35
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@H]2C[C@@H]2C1	ZINC000819034820	EF	On-Demand	Anodyne	CCR3	23	46
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@H]2C[C@@H]2C1	ZINC000819034820	EF	On-Demand	Anodyne	CXCR3	19	41
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@H]2C[C@@H]2C1	ZINC000819034820	EF	On-Demand	Anodyne	MCHR1	41	49
S=C(NC1CCN(Cc2ccccc2)CC1)NC1C[C@H]2C[C@@H]2C1	ZINC000819034820	EF	On-Demand	Anodyne	CACNA1G	15	45
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819034854	GF	On-Demand	Bother	ADRB3	42	33
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819034854	GF	On-Demand	Bother	GPR119	35	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819034855	GF	On-Demand	Bother	ADRB3	42	33
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819034855	GF	On-Demand	Bother	GPR119	35	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819034856	GF	On-Demand	Bother	ADRB3	42	33
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819034856	GF	On-Demand	Bother	GPR119	35	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819034857	GF	On-Demand	Bother	ADRB3	42	33
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819034857	GF	On-Demand	Bother	GPR119	35	40
COc1ccc(OCCNC(=O)C(F)=C2CCC2)cc1	ZINC000819034862	CF	On-Demand	Anodyne	MTNR1A	38	43
COc1ccc(OCCNC(=O)C(F)=C2CCC2)cc1	ZINC000819034862	CF	On-Demand	Anodyne	MTNR1B	30	43
CC(C)(C)OC(=O)N1CC[C@H](CCNCC2(O)CCCCC2)C1	ZINC000819034871	EF	On-Demand	Anodyne	GPR119	27	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNCC2(O)CCCCC2)C1	ZINC000819034872	EF	On-Demand	Anodyne	GPR119	27	42
Cc1cc(F)ccc1[C@@H](O)CNCCCc1c[nH]c2ccccc12	ZINC000819034898	EH	On-Demand	Anodyne	ADRB2	60	39
Cc1cc(F)ccc1[C@@H](O)CNCCCc1c[nH]c2ccccc12	ZINC000819034898	EH	On-Demand	Anodyne	ADRB1	36	40
Cc1cc(F)ccc1[C@@H](O)CNCCCc1c[nH]c2ccccc12	ZINC000819034898	EH	On-Demand	Anodyne	SLC6A4	21	51
Cc1cc(F)ccc1[C@@H](O)CNCCCc1c[nH]c2ccccc12	ZINC000819034898	EH	On-Demand	Anodyne	ADRB3	21	52
Cc1cc(F)ccc1[C@@H](O)CNCCCc1c[nH]c2ccccc12	ZINC000819034898	EH	On-Demand	Anodyne	MPO	108	52
Cc1noc(C)c1CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819034904	FE	On-Demand	Anodyne	GPR119	36	41
Cc1noc(C)c1CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819034905	FE	On-Demand	Anodyne	GPR119	36	41
O[C@@H]1C[C@]2(CCN(C(=S)Nc3ccccc3Cl)C2)Oc2ccccc21	ZINC000819034912	FH	On-Demand	Anodyne	TRPM8	21	43
O[C@H]1C[C@]2(CCN(C(=S)Nc3ccccc3Cl)C2)Oc2ccccc21	ZINC000819034913	FH	On-Demand	Anodyne	TRPM8	21	43
O[C@H]1C[C@@]2(CCN(C(=S)Nc3ccccc3Cl)C2)Oc2ccccc21	ZINC000819034914	FH	On-Demand	Anodyne	TRPM8	21	43
O[C@@H]1C[C@@]2(CCN(C(=S)Nc3ccccc3Cl)C2)Oc2ccccc21	ZINC000819034915	FH	On-Demand	Anodyne	TRPM8	21	43
CCCNC(=S)NCc1cc(O[C@H]2CCN(C(=O)OC(C)(C)C)C2)ccn1	ZINC000819034919	GF	On-Demand	Anodyne	GPR119	40	38
CCCNC(=S)NCc1cc(O[C@@H]2CCN(C(=O)OC(C)(C)C)C2)ccn1	ZINC000819034920	GF	On-Demand	Anodyne	GPR119	40	38
Cc1ccc(NC(=S)N2CC[C@@]3(C[C@H](O)c4ccccc4O3)C2)cc1	ZINC000819034945	FH	On-Demand	Anodyne	TRPM8	23	41
CN(C)S(=O)(=O)c1cccc(NC(=O)COC(=O)CSc2ccccc2[N+](=O)[O-])c1	ZINC000819034947	JE	On-Demand	Bother	COLA	107	44
FC(F)(F)c1cccc(NC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000819034948	DH	On-Demand	Anodyne	EPHX2	15	55
FC(F)(F)c1cccc(NC(=S)NC2C[C@@H]3C[C@H]3C2)c1	ZINC000819034949	DH	On-Demand	Anodyne	EPHX2	15	55
FC(F)(F)c1cccc(NC(=S)NC2C[C@H]3C[C@@H]3C2)c1	ZINC000819034950	DH	On-Demand	Anodyne	EPHX2	15	55
Cc1ccc(NC(=S)N2CC[C@]3(C[C@H](O)c4ccccc4O3)C2)cc1	ZINC000819034952	FH	On-Demand	Anodyne	TRPM8	23	41
Cc1ccc(NC(=S)N2CC[C@]3(C[C@@H](O)c4ccccc4O3)C2)cc1	ZINC000819034954	FH	On-Demand	Anodyne	TRPM8	23	41
Cc1ccc(NC(=S)N2CC[C@@]3(C[C@@H](O)c4ccccc4O3)C2)cc1	ZINC000819034957	FH	On-Demand	Anodyne	TRPM8	23	41
C=CCC1(C(=O)Oc2ccc3c(C)cc(=O)oc3c2)CCOCC1	ZINC000819034959	EG	On-Demand	Mild	MAOA	59	46
C=CCC1(C(=O)Oc2ccc3c(C)cc(=O)oc3c2)CCOCC1	ZINC000819034959	EG	On-Demand	Mild	MAOB	32	46
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(C(F)(F)F)cc1	ZINC000819034975	FI	On-Demand	Anodyne	ADRB2	45	38
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(C(F)(F)F)cc1	ZINC000819034975	FI	On-Demand	Anodyne	ADRB3	27	55
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(C(F)(F)F)cc1	ZINC000819034975	FI	On-Demand	Anodyne	MPO	59	41
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(C(F)(F)F)cc1	ZINC000819034975	FI	On-Demand	Anodyne	SSTR3	18	42
CC(=O)Nc1ccc(OC[C@H](O)CNCC[S@](C)=O)cc1	ZINC000819034977	DC	On-Demand	Anodyne	ADRB2	57	65
CC(=O)Nc1ccc(OC[C@H](O)CNCC[S@](C)=O)cc1	ZINC000819034977	DC	On-Demand	Anodyne	ADRB1	98	65
CC(=O)Nc1ccc(OC[C@H](O)CNCC[S@](C)=O)cc1	ZINC000819034977	DC	On-Demand	Anodyne	GRIN1	24	45
CC(=O)Nc1ccc(OC[C@H](O)CNCC[S@](C)=O)cc1	ZINC000819034977	DC	On-Demand	Anodyne	ADRB3	60	65
CC(=O)Nc1ccc(OC[C@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034978	DC	On-Demand	Anodyne	ADRB2	57	65
CC(=O)Nc1ccc(OC[C@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034978	DC	On-Demand	Anodyne	ADRB1	98	65
CC(=O)Nc1ccc(OC[C@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034978	DC	On-Demand	Anodyne	GRIN1	24	45
CC(=O)Nc1ccc(OC[C@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034978	DC	On-Demand	Anodyne	ADRB3	60	65
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034979	DC	On-Demand	Anodyne	ADRB2	57	65
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034979	DC	On-Demand	Anodyne	ADRB1	98	65
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034979	DC	On-Demand	Anodyne	GRIN1	24	45
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[S@@](C)=O)cc1	ZINC000819034979	DC	On-Demand	Anodyne	ADRB3	60	65
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(C(F)(F)F)cc1	ZINC000819034980	FI	On-Demand	Anodyne	ADRB2	45	38
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(C(F)(F)F)cc1	ZINC000819034980	FI	On-Demand	Anodyne	ADRB3	27	55
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(C(F)(F)F)cc1	ZINC000819034980	FI	On-Demand	Anodyne	MPO	59	41
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(C(F)(F)F)cc1	ZINC000819034980	FI	On-Demand	Anodyne	SSTR3	18	42
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[S@](C)=O)cc1	ZINC000819034981	DC	On-Demand	Anodyne	ADRB2	57	65
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[S@](C)=O)cc1	ZINC000819034981	DC	On-Demand	Anodyne	ADRB1	98	65
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[S@](C)=O)cc1	ZINC000819034981	DC	On-Demand	Anodyne	GRIN1	24	45
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[S@](C)=O)cc1	ZINC000819034981	DC	On-Demand	Anodyne	ADRB3	60	65
C[S@@](=O)CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819035009	DD	On-Demand	Anodyne	ADRB3	29	47
C[S@](=O)CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819035011	DD	On-Demand	Anodyne	ADRB3	29	47
C[S@@](=O)CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819035013	DD	On-Demand	Anodyne	ADRB3	29	47
C[S@](=O)CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819035015	DD	On-Demand	Anodyne	ADRB3	29	47
N#Cc1ccc(S(=O)(=O)N2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819035035	FD	On-Demand	Mild	TGM2	43	37
N#Cc1ccc(S(=O)(=O)N2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819035035	FD	On-Demand	Mild	F13A1	53	37
CC(=O)Nc1ccc(OC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)cc1	ZINC000819035041	FI	On-Demand	Anodyne	EPHX2	53	38
CC(=O)Nc1ccc(OC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)cc1	ZINC000819035041	FI	On-Demand	Anodyne	ACR	43	37
C[S@](=O)CCNCCC(=O)Nc1ccccc1	ZINC000819035043	CC	On-Demand	Anodyne	LTA4H	27	42
C[S@](=O)CCNCCC(=O)Nc1ccccc1	ZINC000819035043	CC	On-Demand	Anodyne	HDAC10	22	48
C[S@](=O)CCNCCC(=O)Nc1ccccc1	ZINC000819035043	CC	On-Demand	Anodyne	HDAC2	18	48
C[S@](=O)CCNCCC(=O)Nc1ccccc1	ZINC000819035043	CC	On-Demand	Anodyne	HDAC3	18	48
C[S@](=O)CCNCCC(=O)Nc1ccccc1	ZINC000819035043	CC	On-Demand	Anodyne	HDAC6	16	48
C[S@@](=O)CCNCCC(=O)Nc1ccccc1	ZINC000819035045	CC	On-Demand	Anodyne	LTA4H	27	42
C[S@@](=O)CCNCCC(=O)Nc1ccccc1	ZINC000819035045	CC	On-Demand	Anodyne	HDAC10	22	48
C[S@@](=O)CCNCCC(=O)Nc1ccccc1	ZINC000819035045	CC	On-Demand	Anodyne	HDAC2	18	48
C[S@@](=O)CCNCCC(=O)Nc1ccccc1	ZINC000819035045	CC	On-Demand	Anodyne	HDAC3	18	48
C[S@@](=O)CCNCCC(=O)Nc1ccccc1	ZINC000819035045	CC	On-Demand	Anodyne	HDAC6	16	48
C[S@](=O)CCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819035046	EF	On-Demand	Anodyne	LTA4H	60	53
C[S@](=O)CCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819035046	EF	On-Demand	Anodyne	CA1	25	41
C[S@](=O)CCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819035046	EF	On-Demand	Anodyne	MTNR1B	16	49
C[S@](=O)CCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819035046	EF	On-Demand	Anodyne	NPY5R	26	43
C[S@](=O)CCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819035046	EF	On-Demand	Anodyne	ACR	40	37
C[S@](=O)CCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819035046	EF	On-Demand	Anodyne	F13A1	15	40
C[S@@](=O)CCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819035048	EF	On-Demand	Anodyne	LTA4H	60	53
C[S@@](=O)CCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819035048	EF	On-Demand	Anodyne	CA1	25	41
C[S@@](=O)CCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819035048	EF	On-Demand	Anodyne	MTNR1B	16	49
C[S@@](=O)CCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819035048	EF	On-Demand	Anodyne	NPY5R	26	43
C[S@@](=O)CCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819035048	EF	On-Demand	Anodyne	ACR	40	37
C[S@@](=O)CCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819035048	EF	On-Demand	Anodyne	F13A1	15	40
CCCc1cc(=O)oc2cc(OC(=O)C[C@@H](C)n3cccn3)ccc12	ZINC000819035065	EG	On-Demand	Anodyne	CYP19A1	16	45
CCCc1cc(=O)oc2cc(OC(=O)C[C@@H](C)n3cccn3)ccc12	ZINC000819035065	EG	On-Demand	Anodyne	CYP11B1	19	44
CCCc1cc(=O)oc2cc(OC(=O)C[C@@H](C)n3cccn3)ccc12	ZINC000819035065	EG	On-Demand	Anodyne	HSD17B3	20	48
CCCc1cc(=O)oc2cc(OC(=O)C[C@H](C)n3cccn3)ccc12	ZINC000819035066	EG	On-Demand	Anodyne	CYP19A1	16	45
CCCc1cc(=O)oc2cc(OC(=O)C[C@H](C)n3cccn3)ccc12	ZINC000819035066	EG	On-Demand	Anodyne	CYP11B1	19	44
CCCc1cc(=O)oc2cc(OC(=O)C[C@H](C)n3cccn3)ccc12	ZINC000819035066	EG	On-Demand	Anodyne	HSD17B3	20	48
O=C(CCc1cccc(OC(F)F)c1)NCc1ccc(N2CCCC2=O)cc1	ZINC000819035081	GH	On-Demand	Anodyne	PLA2G4A	27	42
CC(=O)Nc1ccc(NC(=S)N2CC[C@@]3(C[C@H](O)c4ccccc4O3)C2)cc1	ZINC000819035088	GG	On-Demand	Anodyne	TRPM8	28	44
CC(=O)Nc1ccc(NC(=S)N2CC[C@]3(C[C@@H](O)c4ccccc4O3)C2)cc1	ZINC000819035090	GG	On-Demand	Anodyne	TRPM8	28	44
CC(=O)Nc1ccc(NC(=S)N2CC[C@]3(C[C@H](O)c4ccccc4O3)C2)cc1	ZINC000819035092	GG	On-Demand	Anodyne	TRPM8	28	44
CC(=O)Nc1ccc(NC(=S)N2CC[C@@]3(C[C@@H](O)c4ccccc4O3)C2)cc1	ZINC000819035095	GG	On-Demand	Anodyne	TRPM8	28	44
CC(=O)Nc1ccc(OC(=O)C[C@@H](C)n2cccn2)cc1	ZINC000819035098	CE	On-Demand	Anodyne	ACR	43	35
CC(=O)Nc1ccc(OC(=O)C[C@H](C)n2cccn2)cc1	ZINC000819035100	CE	On-Demand	Anodyne	ACR	43	35
O=C(Nc1nc2c(s1)CCCC2)C(F)=C1CCC1	ZINC000819035101	CG	On-Demand	Anodyne	SLC27A1	34	43
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1Cl	ZINC000819035116	EI	On-Demand	Anodyne	ADRB2	50	36
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1Cl	ZINC000819035116	EI	On-Demand	Anodyne	ADRB1	30	42
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1Cl	ZINC000819035116	EI	On-Demand	Anodyne	SLC6A4	17	51
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1Cl	ZINC000819035116	EI	On-Demand	Anodyne	ADRB3	17	58
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1Cl	ZINC000819035116	EI	On-Demand	Anodyne	MPO	106	51
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1Cl	ZINC000819035118	EI	On-Demand	Anodyne	ADRB2	50	36
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1Cl	ZINC000819035118	EI	On-Demand	Anodyne	ADRB1	30	42
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1Cl	ZINC000819035118	EI	On-Demand	Anodyne	SLC6A4	17	51
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1Cl	ZINC000819035118	EI	On-Demand	Anodyne	ADRB3	17	58
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1Cl	ZINC000819035118	EI	On-Demand	Anodyne	MPO	106	51
CC(=O)Nc1cccc(CC(=O)NC[C@H]2COc3ccccc3C2)c1	ZINC000819035152	EF	On-Demand	Anodyne	MTNR1A	15	48
CC(=O)Nc1cccc(CC(=O)NC[C@@H]2COc3ccccc3C2)c1	ZINC000819035153	EF	On-Demand	Anodyne	MTNR1A	15	48
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819035154	GF	On-Demand	Mild	ADRB2	29	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819035154	GF	On-Demand	Mild	ADRB1	65	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819035154	GF	On-Demand	Mild	ADRB3	36	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819035154	GF	On-Demand	Mild	GPR119	42	47
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819035155	GF	On-Demand	Mild	ADRB2	29	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819035155	GF	On-Demand	Mild	ADRB1	65	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819035155	GF	On-Demand	Mild	ADRB3	36	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819035155	GF	On-Demand	Mild	GPR119	42	47
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819035156	GF	On-Demand	Mild	ADRB2	29	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819035156	GF	On-Demand	Mild	ADRB1	65	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819035156	GF	On-Demand	Mild	ADRB3	36	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819035156	GF	On-Demand	Mild	GPR119	42	47
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819035157	GF	On-Demand	Mild	ADRB2	29	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819035157	GF	On-Demand	Mild	ADRB1	65	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819035157	GF	On-Demand	Mild	ADRB3	36	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819035157	GF	On-Demand	Mild	GPR119	42	47
O=C(N[C@@H](CN1CCOCC1)c1ccccc1)C(F)=C1CCC1	ZINC000819035166	DF	On-Demand	Anodyne	CASR	50	36
O=C(N[C@H](CN1CCOCC1)c1ccccc1)C(F)=C1CCC1	ZINC000819035167	DF	On-Demand	Anodyne	CASR	50	36
O=S(=O)(CCNC[C@@H](O)c1cccnc1)N1CCSCC1	ZINC000819035179	EC	On-Demand	Anodyne	ADRB2	29	45
O=S(=O)(CCNC[C@@H](O)c1cccnc1)N1CCSCC1	ZINC000819035179	EC	On-Demand	Anodyne	ADRB1	33	45
O=S(=O)(CCNC[C@@H](O)c1cccnc1)N1CCSCC1	ZINC000819035179	EC	On-Demand	Anodyne	ADRB3	116	54
O=S(=O)(CCNC[C@H](O)c1cccnc1)N1CCSCC1	ZINC000819035180	EC	On-Demand	Anodyne	ADRB2	29	45
O=S(=O)(CCNC[C@H](O)c1cccnc1)N1CCSCC1	ZINC000819035180	EC	On-Demand	Anodyne	ADRB1	33	45
O=S(=O)(CCNC[C@H](O)c1cccnc1)N1CCSCC1	ZINC000819035180	EC	On-Demand	Anodyne	ADRB3	116	54
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819035181	GF	On-Demand	Anodyne	ADRB2	41	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819035181	GF	On-Demand	Anodyne	ADRB1	73	46
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819035181	GF	On-Demand	Anodyne	ADRB3	47	46
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819035181	GF	On-Demand	Anodyne	GPR119	47	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819035182	GF	On-Demand	Anodyne	ADRB2	41	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819035182	GF	On-Demand	Anodyne	ADRB1	73	46
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819035182	GF	On-Demand	Anodyne	ADRB3	47	46
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819035182	GF	On-Demand	Anodyne	GPR119	47	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819035183	GF	On-Demand	Anodyne	ADRB2	41	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819035183	GF	On-Demand	Anodyne	ADRB1	73	46
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819035183	GF	On-Demand	Anodyne	ADRB3	47	46
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819035183	GF	On-Demand	Anodyne	GPR119	47	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819035184	GF	On-Demand	Anodyne	ADRB2	41	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819035184	GF	On-Demand	Anodyne	ADRB1	73	46
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819035184	GF	On-Demand	Anodyne	ADRB3	47	46
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819035184	GF	On-Demand	Anodyne	GPR119	47	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819035191	FH	On-Demand	Anodyne	ADRB3	40	39
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819035191	FH	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819035191	FH	On-Demand	Anodyne	GPR119	41	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819035192	FH	On-Demand	Anodyne	ADRB3	40	39
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819035192	FH	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819035192	FH	On-Demand	Anodyne	GPR119	41	42
CC(C)c1cccc(C(C)C)c1NC(=S)NC1C[C@@H]2C[C@H]2C1	ZINC000819035237	DK	On-Demand	Anodyne	SOAT1	41	43
CC(C)c1cccc(C(C)C)c1NC(=S)N[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819035238	DK	On-Demand	Anodyne	SOAT1	41	43
CC(C)c1cccc(C(C)C)c1NC(=S)NC1C[C@H]2C[C@@H]2C1	ZINC000819035239	DK	On-Demand	Anodyne	SOAT1	41	43
C[S@@](=O)CCNC[C@@H](O)Cc1ccccc1	ZINC000819035248	BC	On-Demand	Anodyne	MME	52	37
C[S@](=O)CCNC[C@@H](O)Cc1ccccc1	ZINC000819035249	BC	On-Demand	Anodyne	MME	52	37
C[S@@](=O)CCNC[C@H](O)Cc1ccccc1	ZINC000819035250	BC	On-Demand	Anodyne	MME	52	37
C[S@](=O)CCNC[C@H](O)Cc1ccccc1	ZINC000819035251	BC	On-Demand	Anodyne	MME	52	37
C[S@](=O)CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819035284	ED	On-Demand	Anodyne	ADRB2	47	47
C[S@](=O)CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819035284	ED	On-Demand	Anodyne	ADRB1	68	45
C[S@](=O)CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819035284	ED	On-Demand	Anodyne	ADRB3	37	41
C[S@](=O)CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819035284	ED	On-Demand	Anodyne	PDS	55	44
C[S@](=O)CCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819035285	ED	On-Demand	Anodyne	ADRB2	47	47
C[S@](=O)CCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819035285	ED	On-Demand	Anodyne	ADRB1	68	45
C[S@](=O)CCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819035285	ED	On-Demand	Anodyne	ADRB3	37	41
C[S@](=O)CCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819035285	ED	On-Demand	Anodyne	PDS	55	44
C[S@@](=O)CCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819035286	ED	On-Demand	Anodyne	ADRB2	47	47
C[S@@](=O)CCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819035286	ED	On-Demand	Anodyne	ADRB1	68	45
C[S@@](=O)CCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819035286	ED	On-Demand	Anodyne	ADRB3	37	41
C[S@@](=O)CCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819035286	ED	On-Demand	Anodyne	PDS	55	44
C[S@@](=O)CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819035287	ED	On-Demand	Anodyne	ADRB2	47	47
C[S@@](=O)CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819035287	ED	On-Demand	Anodyne	ADRB1	68	45
C[S@@](=O)CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819035287	ED	On-Demand	Anodyne	ADRB3	37	41
C[S@@](=O)CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819035287	ED	On-Demand	Anodyne	PDS	55	44
CC(=O)Nc1ccc(OC(=O)C2(c3ccc(C)cc3)CCC2)cc1	ZINC000819035301	DH	On-Demand	Anodyne	ACR	32	41
O=[N+]([O-])c1ccc([C@@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819035314	EG	On-Demand	Bother	ADRB2	44	38
O=[N+]([O-])c1ccc([C@@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819035314	EG	On-Demand	Bother	ADRB3	30	53
O=[N+]([O-])c1ccc([C@@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819035314	EG	On-Demand	Bother	NMBR	66	36
O=[N+]([O-])c1ccc([C@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819035315	EG	On-Demand	Bother	ADRB2	44	38
O=[N+]([O-])c1ccc([C@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819035315	EG	On-Demand	Bother	ADRB3	30	53
O=[N+]([O-])c1ccc([C@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819035315	EG	On-Demand	Bother	NMBR	66	36
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819035331	EG	On-Demand	Bother	ADRB2	54	38
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819035331	EG	On-Demand	Bother	ADRB1	44	45
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819035331	EG	On-Demand	Bother	ADRB3	56	61
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819035331	EG	On-Demand	Bother	MPO	45	38
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819035331	EG	On-Demand	Bother	NMBR	61	35
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819035332	EG	On-Demand	Bother	ADRB2	54	38
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819035332	EG	On-Demand	Bother	ADRB1	44	45
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819035332	EG	On-Demand	Bother	ADRB3	56	61
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819035332	EG	On-Demand	Bother	MPO	45	38
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819035332	EG	On-Demand	Bother	NMBR	61	35
CC(=O)Nc1cccc(OC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)c1	ZINC000819035341	FI	On-Demand	Anodyne	EPHX2	28	41
CC(=O)Nc1cccc(OC(=O)[C@H]2C[C@@H]2c2ccc(C)cc2)c1	ZINC000819035359	DH	On-Demand	Anodyne	SLC6A3	17	46
CC(=O)Nc1cccc(OC(=O)[C@H]2C[C@@H]2c2ccc(C)cc2)c1	ZINC000819035359	DH	On-Demand	Anodyne	KCNK3	54	38
CC(=O)Nc1cccc(OC(=O)[C@H]2C[C@@H]2c2ccc(C)cc2)c1	ZINC000819035359	DH	On-Demand	Anodyne	KCNK9	56	33
CC(=O)Nc1cccc(OC(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)c1	ZINC000819035360	DH	On-Demand	Anodyne	SLC6A3	17	46
CC(=O)Nc1cccc(OC(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)c1	ZINC000819035360	DH	On-Demand	Anodyne	KCNK3	54	38
CC(=O)Nc1cccc(OC(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)c1	ZINC000819035360	DH	On-Demand	Anodyne	KCNK9	56	33
CC(=O)Nc1cccc(OC(=O)[C@H]2C[C@H]2c2ccc(C)cc2)c1	ZINC000819035361	DH	On-Demand	Anodyne	SLC6A3	17	46
CC(=O)Nc1cccc(OC(=O)[C@H]2C[C@H]2c2ccc(C)cc2)c1	ZINC000819035361	DH	On-Demand	Anodyne	KCNK3	54	38
CC(=O)Nc1cccc(OC(=O)[C@H]2C[C@H]2c2ccc(C)cc2)c1	ZINC000819035361	DH	On-Demand	Anodyne	KCNK9	56	33
CC(=O)Nc1cccc(OC(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)c1	ZINC000819035362	DH	On-Demand	Anodyne	SLC6A3	17	46
CC(=O)Nc1cccc(OC(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)c1	ZINC000819035362	DH	On-Demand	Anodyne	KCNK3	54	38
CC(=O)Nc1cccc(OC(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)c1	ZINC000819035362	DH	On-Demand	Anodyne	KCNK9	56	33
O=C(CSc1ccccc1[N+](=O)[O-])OCC(=O)c1cccc(C(F)(F)F)c1	ZINC000819035382	GI	On-Demand	Bother	COLA	18	41
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cn1	ZINC000819035387	DF	On-Demand	Anodyne	MPO	92	49
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cn1	ZINC000819035388	DF	On-Demand	Anodyne	MPO	92	49
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Oc1ccc3c(C)cc(=O)oc3c1)C2	ZINC000819035389	FF	On-Demand	Anodyne	MAOA	58	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Oc1ccc3c(C)cc(=O)oc3c1)C2	ZINC000819035389	FF	On-Demand	Anodyne	MAOB	18	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Oc1ccc3c(C)cc(=O)oc3c1)C2	ZINC000819035390	FF	On-Demand	Anodyne	MAOA	58	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Oc1ccc3c(C)cc(=O)oc3c1)C2	ZINC000819035390	FF	On-Demand	Anodyne	MAOB	18	46
N#Cc1ccc([C@@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819035398	DG	On-Demand	Mild	ADRB2	44	38
N#Cc1ccc([C@@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819035398	DG	On-Demand	Mild	SLC6A4	15	44
N#Cc1ccc([C@@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819035398	DG	On-Demand	Mild	ADRB3	25	55
N#Cc1ccc([C@@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819035398	DG	On-Demand	Mild	MPO	48	39
N#Cc1ccc([C@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819035400	DG	On-Demand	Mild	ADRB2	44	38
N#Cc1ccc([C@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819035400	DG	On-Demand	Mild	SLC6A4	15	44
N#Cc1ccc([C@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819035400	DG	On-Demand	Mild	ADRB3	25	55
N#Cc1ccc([C@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819035400	DG	On-Demand	Mild	MPO	48	39
Cc1ccc(NC(=S)N[C@H]2CCCCN(Cc3nc(C)no3)C2=O)cc1	ZINC000819035407	FF	On-Demand	Anodyne	F10	16	54
Cc1ccc(NC(=S)N[C@@H]2CCCCN(Cc3nc(C)no3)C2=O)cc1	ZINC000819035408	FF	On-Demand	Anodyne	F10	16	54
C=CCCn1cc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819035413	GD	On-Demand	Mild	HTR1A	62	53
C=CCCn1cc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819035413	GD	On-Demand	Mild	DRD2	57	56
C=CCCn1cc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819035413	GD	On-Demand	Mild	DRD1	15	56
C=CCCn1cc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819035413	GD	On-Demand	Mild	DRD4	52	43
C=CCCn1cc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819035413	GD	On-Demand	Mild	ADRA1D	24	42
C=CCCn1cc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819035413	GD	On-Demand	Mild	HTR2A	47	53
C=CCCn1cc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819035413	GD	On-Demand	Mild	HTR2C	36	49
C=CCCn1cc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819035413	GD	On-Demand	Mild	SLC6A4	16	49
C=CCCn1cc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819035413	GD	On-Demand	Mild	ADRA1A	34	43
C=CCCn1cc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819035413	GD	On-Demand	Mild	DRD3	94	56
C=CCCn1cc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819035413	GD	On-Demand	Mild	HRP1_PLAFA	16	40
C=CCCn1cc(C(=O)NCCCN2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819035413	GD	On-Demand	Mild	HTR7	56	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819035414	GD	On-Demand	Anodyne	DRD4	32	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819035415	GD	On-Demand	Anodyne	DRD4	32	46
CC(C)(C)OC(=O)N1CC[C@H](CCNCCC(=O)Nc2ccccc2)C1	ZINC000819035418	FG	On-Demand	Anodyne	CCR8	38	42
CC(C)(C)OC(=O)N1CC[C@H](CCNCCC(=O)Nc2ccccc2)C1	ZINC000819035418	FG	On-Demand	Anodyne	GPR119	37	45
CC(C)(C)OC(=O)N1CC[C@H](CCNCCC(=O)Nc2ccccc2)C1	ZINC000819035418	FG	On-Demand	Anodyne	SFRP1	25	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNCCC(=O)Nc2ccccc2)C1	ZINC000819035419	FG	On-Demand	Anodyne	CCR8	38	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNCCC(=O)Nc2ccccc2)C1	ZINC000819035419	FG	On-Demand	Anodyne	GPR119	37	45
CC(C)(C)OC(=O)N1CC[C@@H](CCNCCC(=O)Nc2ccccc2)C1	ZINC000819035419	FG	On-Demand	Anodyne	SFRP1	25	41
CC(C)(C)OC(=O)N1CC[C@H](CCNCC2(O)CCS(=O)(=O)CC2)C1	ZINC000819035475	GD	On-Demand	Anodyne	GPR119	24	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNCC2(O)CCS(=O)(=O)CC2)C1	ZINC000819035476	GD	On-Demand	Anodyne	GPR119	24	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819035493	FG	On-Demand	Anodyne	GPR119	45	44
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819035494	FG	On-Demand	Anodyne	GPR119	45	44
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819035495	FG	On-Demand	Anodyne	GPR119	45	44
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819035496	FG	On-Demand	Anodyne	GPR119	45	44
Cc1ccc(F)c(NC(=S)N[C@H]2CCCCN(Cc3nc(C)no3)C2=O)c1	ZINC000819035497	GF	On-Demand	Anodyne	F10	16	49
C[S@@](=O)CCNC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819035499	DC	On-Demand	Anodyne	ADRB2	39	40
C[S@@](=O)CCNC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819035499	DC	On-Demand	Anodyne	ADRB1	63	40
C[S@@](=O)CCNC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819035499	DC	On-Demand	Anodyne	ADRB3	41	40
C[S@](=O)CCNC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819035500	DC	On-Demand	Anodyne	ADRB2	39	40
C[S@](=O)CCNC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819035500	DC	On-Demand	Anodyne	ADRB1	63	40
C[S@](=O)CCNC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819035500	DC	On-Demand	Anodyne	ADRB3	41	40
C[S@](=O)CCNC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819035501	DC	On-Demand	Anodyne	ADRB2	39	40
C[S@](=O)CCNC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819035501	DC	On-Demand	Anodyne	ADRB1	63	40
C[S@](=O)CCNC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819035501	DC	On-Demand	Anodyne	ADRB3	41	40
C[S@@](=O)CCNC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819035502	DC	On-Demand	Anodyne	ADRB2	39	40
C[S@@](=O)CCNC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819035502	DC	On-Demand	Anodyne	ADRB1	63	40
C[S@@](=O)CCNC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819035502	DC	On-Demand	Anodyne	ADRB3	41	40
O=S(=O)(c1ccc(NC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1)N1CCOCC1	ZINC000819035505	GD	On-Demand	Anodyne	EPHX2	18	53
O=S(=O)(c1ccc(NC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1)N1CCOCC1	ZINC000819035505	GD	On-Demand	Anodyne	TGM2	68	42
O=S(=O)(c1ccc(NC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1)N1CCOCC1	ZINC000819035505	GD	On-Demand	Anodyne	F13A1	85	42
O=S(=O)(c1ccc(NC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1)N1CCOCC1	ZINC000819035505	GD	On-Demand	Anodyne	MERTK	32	43
O=S(=O)(c1ccc(NC(=S)N[C@H]2C[C@@H]3C[C@@H]3C2)cc1)N1CCOCC1	ZINC000819035505	GD	On-Demand	Anodyne	NAMPT	29	48
O=S(=O)(c1ccc(NC(=S)NC2C[C@H]3C[C@@H]3C2)cc1)N1CCOCC1	ZINC000819035506	GD	On-Demand	Anodyne	EPHX2	18	53
O=S(=O)(c1ccc(NC(=S)NC2C[C@H]3C[C@@H]3C2)cc1)N1CCOCC1	ZINC000819035506	GD	On-Demand	Anodyne	TGM2	68	42
O=S(=O)(c1ccc(NC(=S)NC2C[C@H]3C[C@@H]3C2)cc1)N1CCOCC1	ZINC000819035506	GD	On-Demand	Anodyne	F13A1	85	42
O=S(=O)(c1ccc(NC(=S)NC2C[C@H]3C[C@@H]3C2)cc1)N1CCOCC1	ZINC000819035506	GD	On-Demand	Anodyne	MERTK	32	43
O=S(=O)(c1ccc(NC(=S)NC2C[C@H]3C[C@@H]3C2)cc1)N1CCOCC1	ZINC000819035506	GD	On-Demand	Anodyne	NAMPT	29	48
O=S(=O)(c1ccc(NC(=S)NC2C[C@@H]3C[C@H]3C2)cc1)N1CCOCC1	ZINC000819035507	GD	On-Demand	Anodyne	EPHX2	18	53
O=S(=O)(c1ccc(NC(=S)NC2C[C@@H]3C[C@H]3C2)cc1)N1CCOCC1	ZINC000819035507	GD	On-Demand	Anodyne	TGM2	68	42
O=S(=O)(c1ccc(NC(=S)NC2C[C@@H]3C[C@H]3C2)cc1)N1CCOCC1	ZINC000819035507	GD	On-Demand	Anodyne	F13A1	85	42
O=S(=O)(c1ccc(NC(=S)NC2C[C@@H]3C[C@H]3C2)cc1)N1CCOCC1	ZINC000819035507	GD	On-Demand	Anodyne	MERTK	32	43
O=S(=O)(c1ccc(NC(=S)NC2C[C@@H]3C[C@H]3C2)cc1)N1CCOCC1	ZINC000819035507	GD	On-Demand	Anodyne	NAMPT	29	48
C[S@@](=O)CCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819035524	ED	On-Demand	Anodyne	ADRB2	46	47
C[S@@](=O)CCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819035524	ED	On-Demand	Anodyne	ADRB1	69	40
C[S@@](=O)CCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819035524	ED	On-Demand	Anodyne	ADRB3	30	45
C[S@@](=O)CCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819035524	ED	On-Demand	Anodyne	ABCB1	21	46
C[S@](=O)CCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819035525	ED	On-Demand	Anodyne	ADRB2	46	47
C[S@](=O)CCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819035525	ED	On-Demand	Anodyne	ADRB1	69	40
C[S@](=O)CCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819035525	ED	On-Demand	Anodyne	ADRB3	30	45
C[S@](=O)CCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819035525	ED	On-Demand	Anodyne	ABCB1	21	46
C[S@@](=O)CCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819035526	ED	On-Demand	Anodyne	ADRB2	46	47
C[S@@](=O)CCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819035526	ED	On-Demand	Anodyne	ADRB1	69	40
C[S@@](=O)CCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819035526	ED	On-Demand	Anodyne	ADRB3	30	45
C[S@@](=O)CCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819035526	ED	On-Demand	Anodyne	ABCB1	21	46
C[S@](=O)CCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819035527	ED	On-Demand	Anodyne	ADRB2	46	47
C[S@](=O)CCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819035527	ED	On-Demand	Anodyne	ADRB1	69	40
C[S@](=O)CCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819035527	ED	On-Demand	Anodyne	ADRB3	30	45
C[S@](=O)CCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819035527	ED	On-Demand	Anodyne	ABCB1	21	46
Cc1cc(OC[C@H](O)CNCC[S@](C)=O)c(C(C)C)cc1Cl	ZINC000819035538	EE	On-Demand	Anodyne	ADRB2	20	42
Cc1cc(OC[C@H](O)CNCC[S@@](C)=O)c(C(C)C)cc1Cl	ZINC000819035539	EE	On-Demand	Anodyne	ADRB2	20	42
Cc1cc(OC[C@@H](O)CNCC[S@@](C)=O)c(C(C)C)cc1Cl	ZINC000819035540	EE	On-Demand	Anodyne	ADRB2	20	42
Cc1cc(OC[C@@H](O)CNCC[S@](C)=O)c(C(C)C)cc1Cl	ZINC000819035541	EE	On-Demand	Anodyne	ADRB2	20	42
C#CCNC(=S)NCc1cc(O[C@H]2CCN(C(=O)OC(C)(C)C)C2)ccn1	ZINC000819035561	GE	On-Demand	Mild	GPR119	40	38
C#CCNC(=S)NCc1cc(O[C@@H]2CCN(C(=O)OC(C)(C)C)C2)ccn1	ZINC000819035562	GE	On-Demand	Mild	GPR119	40	38
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Cl)c(F)c1	ZINC000819035582	EI	On-Demand	Anodyne	ADRB2	56	42
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Cl)c(F)c1	ZINC000819035582	EI	On-Demand	Anodyne	ADRB1	36	46
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Cl)c(F)c1	ZINC000819035582	EI	On-Demand	Anodyne	ADRB3	37	63
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Cl)c(F)c1	ZINC000819035582	EI	On-Demand	Anodyne	MPO	91	44
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Cl)c(F)c1	ZINC000819035583	EI	On-Demand	Anodyne	ADRB2	56	42
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Cl)c(F)c1	ZINC000819035583	EI	On-Demand	Anodyne	ADRB1	36	46
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Cl)c(F)c1	ZINC000819035583	EI	On-Demand	Anodyne	ADRB3	37	63
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Cl)c(F)c1	ZINC000819035583	EI	On-Demand	Anodyne	MPO	91	44
CN(C[C@@H](O)CNCCCc1c[nH]c2ccccc12)C(=O)OC(C)(C)C	ZINC000819035597	FF	On-Demand	Anodyne	SSTR2	69	39
CN(C[C@@H](O)CNCCCc1c[nH]c2ccccc12)C(=O)OC(C)(C)C	ZINC000819035597	FF	On-Demand	Anodyne	EDNRA	17	42
CN(C[C@@H](O)CNCCCc1c[nH]c2ccccc12)C(=O)OC(C)(C)C	ZINC000819035597	FF	On-Demand	Anodyne	TACR1	24	42
CN(C[C@@H](O)CNCCCc1c[nH]c2ccccc12)C(=O)OC(C)(C)C	ZINC000819035597	FF	On-Demand	Anodyne	CCKAR	105	39
CN(C[C@@H](O)CNCCCc1c[nH]c2ccccc12)C(=O)OC(C)(C)C	ZINC000819035597	FF	On-Demand	Anodyne	CTSL	22	43
CN(C[C@@H](O)CNCCCc1c[nH]c2ccccc12)C(=O)OC(C)(C)C	ZINC000819035597	FF	On-Demand	Anodyne	NMBR	36	41
CN(C[C@@H](O)CNCCCc1c[nH]c2ccccc12)C(=O)OC(C)(C)C	ZINC000819035597	FF	On-Demand	Anodyne	MMP11	46	32
CN(C[C@@H](O)CNCCCc1c[nH]c2ccccc12)C(=O)OC(C)(C)C	ZINC000819035597	FF	On-Demand	Anodyne	CCKBR	82	41
CN(C[C@@H](O)CNCCCc1c[nH]c2ccccc12)C(=O)OC(C)(C)C	ZINC000819035597	FF	On-Demand	Anodyne	GHSR	47	41
CN(C[C@H](O)CNCCCc1c[nH]c2ccccc12)C(=O)OC(C)(C)C	ZINC000819035598	FF	On-Demand	Anodyne	SSTR2	69	39
CN(C[C@H](O)CNCCCc1c[nH]c2ccccc12)C(=O)OC(C)(C)C	ZINC000819035598	FF	On-Demand	Anodyne	EDNRA	17	42
CN(C[C@H](O)CNCCCc1c[nH]c2ccccc12)C(=O)OC(C)(C)C	ZINC000819035598	FF	On-Demand	Anodyne	TACR1	24	42
CN(C[C@H](O)CNCCCc1c[nH]c2ccccc12)C(=O)OC(C)(C)C	ZINC000819035598	FF	On-Demand	Anodyne	CCKAR	105	39
CN(C[C@H](O)CNCCCc1c[nH]c2ccccc12)C(=O)OC(C)(C)C	ZINC000819035598	FF	On-Demand	Anodyne	CTSL	22	43
CN(C[C@H](O)CNCCCc1c[nH]c2ccccc12)C(=O)OC(C)(C)C	ZINC000819035598	FF	On-Demand	Anodyne	NMBR	36	41
CN(C[C@H](O)CNCCCc1c[nH]c2ccccc12)C(=O)OC(C)(C)C	ZINC000819035598	FF	On-Demand	Anodyne	MMP11	46	32
CN(C[C@H](O)CNCCCc1c[nH]c2ccccc12)C(=O)OC(C)(C)C	ZINC000819035598	FF	On-Demand	Anodyne	CCKBR	82	41
CN(C[C@H](O)CNCCCc1c[nH]c2ccccc12)C(=O)OC(C)(C)C	ZINC000819035598	FF	On-Demand	Anodyne	GHSR	47	41
Cc1noc(C)c1CCNC[C@H](O)c1ccc(F)cc1Cl	ZINC000819035607	DF	On-Demand	Anodyne	P2RX7	20	51
Cc1noc(C)c1CCNC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819035608	DF	On-Demand	Anodyne	P2RX7	20	51
C=C(C)C(C)(C)C(=O)Oc1cccc(NC(C)=O)c1	ZINC000819035615	CG	On-Demand	Mild	MTNR1B	15	47
C=C(C)C(C)(C)C(=O)Oc1cccc(NC(C)=O)c1	ZINC000819035615	CG	On-Demand	Mild	KCNK3	64	36
C=C(C)C(C)(C)C(=O)Oc1cccc(NC(C)=O)c1	ZINC000819035615	CG	On-Demand	Mild	KCNK9	62	35
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000819035630	CG	On-Demand	Anodyne	ADRB2	64	43
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000819035630	CG	On-Demand	Anodyne	ADRB1	49	47
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000819035630	CG	On-Demand	Anodyne	HTR1B	24	45
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000819035630	CG	On-Demand	Anodyne	ADRB3	61	66
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000819035630	CG	On-Demand	Anodyne	TPR	20	47
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000819035630	CG	On-Demand	Anodyne	MPO	82	46
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000819035630	CG	On-Demand	Anodyne	BRS3	25	40
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000819035630	CG	On-Demand	Anodyne	MMP9	15	45
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000819035631	CG	On-Demand	Anodyne	ADRB2	64	43
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000819035631	CG	On-Demand	Anodyne	ADRB1	49	47
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000819035631	CG	On-Demand	Anodyne	HTR1B	24	45
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000819035631	CG	On-Demand	Anodyne	ADRB3	61	66
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000819035631	CG	On-Demand	Anodyne	TPR	20	47
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000819035631	CG	On-Demand	Anodyne	MPO	82	46
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000819035631	CG	On-Demand	Anodyne	BRS3	25	40
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000819035631	CG	On-Demand	Anodyne	MMP9	15	45
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035635	FF	On-Demand	Anodyne	SSTR2	54	38
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035635	FF	On-Demand	Anodyne	EDNRA	18	46
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035635	FF	On-Demand	Anodyne	TACR1	15	47
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035635	FF	On-Demand	Anodyne	CCKAR	106	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035635	FF	On-Demand	Anodyne	CTSL	22	48
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035635	FF	On-Demand	Anodyne	MPO	46	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035635	FF	On-Demand	Anodyne	NMBR	70	33
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035635	FF	On-Demand	Anodyne	GRPR	73	31
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035635	FF	On-Demand	Anodyne	ECE1	30	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035635	FF	On-Demand	Anodyne	MMP11	43	32
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035635	FF	On-Demand	Anodyne	CCKBR	88	45
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035635	FF	On-Demand	Anodyne	GHSR	40	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035635	FF	On-Demand	Anodyne	MMP9	16	46
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035636	FF	On-Demand	Anodyne	SSTR2	54	38
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035636	FF	On-Demand	Anodyne	EDNRA	18	46
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035636	FF	On-Demand	Anodyne	TACR1	15	47
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035636	FF	On-Demand	Anodyne	CCKAR	106	42
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035636	FF	On-Demand	Anodyne	CTSL	22	48
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035636	FF	On-Demand	Anodyne	MPO	46	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035636	FF	On-Demand	Anodyne	NMBR	70	33
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035636	FF	On-Demand	Anodyne	GRPR	73	31
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035636	FF	On-Demand	Anodyne	ECE1	30	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035636	FF	On-Demand	Anodyne	MMP11	43	32
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035636	FF	On-Demand	Anodyne	CCKBR	88	45
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035636	FF	On-Demand	Anodyne	GHSR	40	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCCc1c[nH]c2ccccc12	ZINC000819035636	FF	On-Demand	Anodyne	MMP9	16	46
CC(=O)Nc1cccc(OC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819035641	GG	On-Demand	Mild	PAPA1_CARPA	45	43
CC(=O)Nc1cccc(OC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819035642	GG	On-Demand	Mild	PAPA1_CARPA	45	43
CC(=O)Nc1cccc(OC(=O)C2(c3ccc(C)cc3)CCC2)c1	ZINC000819035649	DH	On-Demand	Anodyne	KCNK3	51	35
CC(=O)Nc1cccc(OC(=O)C2(c3ccc(C)cc3)CCC2)c1	ZINC000819035649	DH	On-Demand	Anodyne	KCNK9	56	33
O=C(NCc1ccc(N2CCCC2=O)cc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819035665	GI	On-Demand	Anodyne	P2RX7	26	42
Cc1noc(C)c1CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819035670	ED	On-Demand	Anodyne	ADRB3	69	37
Cc1noc(C)c1CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819035671	ED	On-Demand	Anodyne	ADRB3	69	37
Cc1noc(C)c1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819035672	CF	On-Demand	Anodyne	ADRB1	53	49
Cc1noc(C)c1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819035672	CF	On-Demand	Anodyne	ADRB3	80	49
Cc1noc(C)c1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819035673	CF	On-Demand	Anodyne	ADRB1	53	49
Cc1noc(C)c1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819035673	CF	On-Demand	Anodyne	ADRB3	80	49
O[C@@H]1C[C@]2(CCN(C(=S)Nc3ccc(Cl)cc3)C2)Oc2ccccc21	ZINC000819035674	FH	On-Demand	Anodyne	TRPM8	26	45
O[C@H]1C[C@]2(CCN(C(=S)Nc3ccc(Cl)cc3)C2)Oc2ccccc21	ZINC000819035675	FH	On-Demand	Anodyne	TRPM8	26	45
O[C@H]1C[C@@]2(CCN(C(=S)Nc3ccc(Cl)cc3)C2)Oc2ccccc21	ZINC000819035676	FH	On-Demand	Anodyne	TRPM8	26	45
O[C@@H]1C[C@@]2(CCN(C(=S)Nc3ccc(Cl)cc3)C2)Oc2ccccc21	ZINC000819035677	FH	On-Demand	Anodyne	TRPM8	26	45
Cc1ccc(F)c(NC(=S)N[C@@H]2CCCCN(Cc3nc(C)no3)C2=O)c1	ZINC000819035680	GF	On-Demand	Anodyne	F10	16	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(CN3CCCCC3)cc1)C2	ZINC000819035684	GG	On-Demand	Anodyne	HRH3	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(CN3CCCCC3)cc1)C2	ZINC000819035684	GG	On-Demand	Anodyne	SIGMAR1	17	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(CN3CCCCC3)cc1)C2	ZINC000819035687	GG	On-Demand	Anodyne	HRH3	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(CN3CCCCC3)cc1)C2	ZINC000819035687	GG	On-Demand	Anodyne	SIGMAR1	17	44
O[C@@H]1C[C@]2(CCN(C(=S)Nc3ccccc3F)C2)Oc2ccccc21	ZINC000819035698	FG	On-Demand	Anodyne	TRPM8	22	42
O[C@H]1C[C@]2(CCN(C(=S)Nc3ccccc3F)C2)Oc2ccccc21	ZINC000819035700	FG	On-Demand	Anodyne	TRPM8	22	42
O[C@H]1C[C@@]2(CCN(C(=S)Nc3ccccc3F)C2)Oc2ccccc21	ZINC000819035703	FG	On-Demand	Anodyne	TRPM8	22	42
O[C@@H]1C[C@@]2(CCN(C(=S)Nc3ccccc3F)C2)Oc2ccccc21	ZINC000819035704	FG	On-Demand	Anodyne	TRPM8	22	42
Cc1cc(C)c2nc(NC(=O)/C=C/[C@H]3CCCO3)sc2c1	ZINC000819035714	DH	On-Demand	Anodyne	LCK	18	42
Cc1cc(C)c2nc(NC(=O)/C=C\[C@@H]3CCCO3)sc2c1	ZINC000819035716	DH	On-Demand	Anodyne	LCK	18	42
Cc1cc(C)c2nc(NC(=O)/C=C\[C@H]3CCCO3)sc2c1	ZINC000819035717	DH	On-Demand	Anodyne	LCK	18	42
Cc1cc(C)c2nc(NC(=O)/C=C/[C@@H]3CCCO3)sc2c1	ZINC000819035719	DH	On-Demand	Anodyne	LCK	18	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819035721	GG	On-Demand	Anodyne	ADRB2	36	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819035721	GG	On-Demand	Anodyne	ADRB1	69	44
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819035721	GG	On-Demand	Anodyne	ADRB3	45	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819035721	GG	On-Demand	Anodyne	GPR119	43	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819035722	GG	On-Demand	Anodyne	ADRB2	36	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819035722	GG	On-Demand	Anodyne	ADRB1	69	44
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819035722	GG	On-Demand	Anodyne	ADRB3	45	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819035722	GG	On-Demand	Anodyne	GPR119	43	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819035723	GG	On-Demand	Anodyne	ADRB2	36	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819035723	GG	On-Demand	Anodyne	ADRB1	69	44
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819035723	GG	On-Demand	Anodyne	ADRB3	45	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819035723	GG	On-Demand	Anodyne	GPR119	43	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819035725	GG	On-Demand	Anodyne	ADRB2	36	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819035725	GG	On-Demand	Anodyne	ADRB1	69	44
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819035725	GG	On-Demand	Anodyne	ADRB3	45	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819035725	GG	On-Demand	Anodyne	GPR119	43	41
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Cl)cc1	ZINC000819035733	EI	On-Demand	Anodyne	ADRB2	61	43
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Cl)cc1	ZINC000819035733	EI	On-Demand	Anodyne	ADRB1	43	48
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Cl)cc1	ZINC000819035733	EI	On-Demand	Anodyne	ADRB3	41	67
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Cl)cc1	ZINC000819035733	EI	On-Demand	Anodyne	MPO	65	41
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Cl)cc1	ZINC000819035733	EI	On-Demand	Anodyne	BRS3	23	41
CC(=O)Nc1cccc(OC(=O)C[C@@H](C)n2cccn2)c1	ZINC000819035748	CE	On-Demand	Anodyne	KCNK3	42	34
CC(=O)Nc1cccc(OC(=O)C[C@H](C)n2cccn2)c1	ZINC000819035750	CE	On-Demand	Anodyne	KCNK3	42	34
CC(=O)Nc1cccc(NC(=S)N2CC[C@@]3(C[C@H](O)c4ccccc4O3)C2)c1	ZINC000819035752	GG	On-Demand	Anodyne	TRPM8	24	41
CC(=O)Nc1cccc(NC(=S)N2CC[C@]3(C[C@@H](O)c4ccccc4O3)C2)c1	ZINC000819035754	GG	On-Demand	Anodyne	TRPM8	24	41
CC(=O)Nc1cccc(NC(=S)N2CC[C@]3(C[C@H](O)c4ccccc4O3)C2)c1	ZINC000819035757	GG	On-Demand	Anodyne	TRPM8	24	41
CC(=O)Nc1cccc(NC(=S)N2CC[C@@]3(C[C@@H](O)c4ccccc4O3)C2)c1	ZINC000819035760	GG	On-Demand	Anodyne	TRPM8	24	41
CC(=O)Nc1cccc(OC(=O)C(F)=C2CCC2)c1	ZINC000819035775	CF	On-Demand	Anodyne	MTNR1B	18	47
CC(=O)Nc1cccc(OC(=O)C(F)=C2CCC2)c1	ZINC000819035775	CF	On-Demand	Anodyne	TAAR1	38	40
CC(=O)Nc1cccc(OC(=O)C(F)=C2CCC2)c1	ZINC000819035775	CF	On-Demand	Anodyne	KCNK3	49	35
CC(=O)Nc1cccc(OC(=O)C(F)=C2CCC2)c1	ZINC000819035775	CF	On-Demand	Anodyne	KCNK9	51	33
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2c(F)cccc2F)C1	ZINC000819035777	FG	On-Demand	Anodyne	GPR119	46	49
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2c(F)cccc2F)C1	ZINC000819035779	FG	On-Demand	Anodyne	GPR119	46	49
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819035781	FG	On-Demand	Anodyne	GPR119	46	49
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819035782	FG	On-Demand	Anodyne	GPR119	46	49
O[C@H]1C[C@@]2(CCN(C(=S)NCCc3cccnc3)C2)Oc2ccccc21	ZINC000819035794	FE	On-Demand	Anodyne	SCD	40	40
O[C@H]1C[C@]2(CCN(C(=S)NCCc3cccnc3)C2)Oc2ccccc21	ZINC000819035797	FE	On-Demand	Anodyne	SCD	40	40
O[C@@H]1C[C@]2(CCN(C(=S)NCCc3cccnc3)C2)Oc2ccccc21	ZINC000819035799	FE	On-Demand	Anodyne	SCD	40	40
O[C@@H]1C[C@@]2(CCN(C(=S)NCCc3cccnc3)C2)Oc2ccccc21	ZINC000819035801	FE	On-Demand	Anodyne	SCD	40	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2cccc(F)c2)C1	ZINC000819035837	FG	On-Demand	Anodyne	ADRB1	32	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2cccc(F)c2)C1	ZINC000819035837	FG	On-Demand	Anodyne	ADRB3	49	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@H](O)c2cccc(F)c2)C1	ZINC000819035837	FG	On-Demand	Anodyne	GPR119	42	50
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819035838	FG	On-Demand	Anodyne	ADRB1	32	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819035838	FG	On-Demand	Anodyne	ADRB3	49	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819035838	FG	On-Demand	Anodyne	GPR119	42	50
Cc1nnc(-c2cccc(NC(=O)C(=O)NCc3ccc(C(=O)O)cc3)c2)o1	ZINC000819035841	GD	On-Demand	Anodyne	PTPN11	62	34
Cc1nnc(-c2cccc(NC(=O)C(=O)NCc3ccc(C(=O)O)cc3)c2)o1	ZINC000819035841	GD	On-Demand	Anodyne	CTSV	28	41
Cc1nnc(-c2cccc(NCc3ccc(C(=O)O)cc3)c2)n1C	ZINC000819035842	DG	On-Demand	Anodyne	UL80	20	41
Cc1nnc(-c2cccc(NCc3ccc(C(=O)O)cc3)c2)n1C	ZINC000819035842	DG	On-Demand	Anodyne	NR1H3	18	46
Cc1nnc(-c2cccc(NCc3ccc(C(=O)O)cc3)c2)n1C	ZINC000819035842	DG	On-Demand	Anodyne	NR1H2	30	42
Cc1nnc(-c2cccc(C(=O)NCCCCCC(=O)O)c2)o1	ZINC000819035843	DE	On-Demand	Anodyne	TBXA2R	19	40
Cc1nnc(-c2cccc(C(=O)NCCCCCC(=O)O)c2)o1	ZINC000819035843	DE	On-Demand	Anodyne	TBXAS1	25	40
Cc1nnc(-c2cccc(C(=O)NCCCCCC(=O)O)c2)o1	ZINC000819035843	DE	On-Demand	Anodyne	CTSV	33	40
Cc1nnc(-c2ccccc2C(=O)Nc2cccc(CC(=O)O)c2)o1	ZINC000819035846	EF	On-Demand	Anodyne	KCNK3	106	41
Cc1nnc(-c2ccccc2C(=O)Nc2cccc(CC(=O)O)c2)o1	ZINC000819035846	EF	On-Demand	Anodyne	KCNK9	76	38
Cc1nnc(CN(C)CC(=O)N2CC[C@H](C(=O)O)C2)n1C	ZINC000819035848	CB	On-Demand	Anodyne	SLC6A1	63	33
Cc1nnc(CN(C)CC(=O)N2CC[C@@H](C(=O)O)C2)n1C	ZINC000819035849	CB	On-Demand	Anodyne	SLC6A1	63	33
Cc1nnc(-c2cccc(C(=O)NC3(C(=O)O)CCCC3)c2)o1	ZINC000819035854	DE	On-Demand	Anodyne	NTSR2	16	41
Cc1nnc(-c2cccc(C(=O)NC3(C(=O)O)CCCC3)c2)o1	ZINC000819035854	DE	On-Demand	Anodyne	CTSK	16	42
Cc1nnc(SCC(=O)N2CCC[C@@H]2C(=O)O)n1Cc1ccccc1	ZINC000819035855	FD	On-Demand	Anodyne	ACE	62	46
Cc1nnc(SCC(=O)N2CCC[C@@H]2C(=O)O)n1Cc1ccccc1	ZINC000819035855	FD	On-Demand	Anodyne	FKBP1A	42	38
Cc1nnc(SCC(=O)N2CCC[C@@H]2C(=O)O)n1Cc1ccccc1	ZINC000819035855	FD	On-Demand	Anodyne	MME	18	41
Cc1nnc(SCC(=O)N2CCC[C@@H]2C(=O)O)n1Cc1ccccc1	ZINC000819035855	FD	On-Demand	Anodyne	TRY1_BOVIN	43	33
Cc1nnc(SCC(=O)N2CCC[C@@H]2C(=O)O)n1Cc1ccccc1	ZINC000819035855	FD	On-Demand	Anodyne	PREP	93	42
Cc1nnc(SCC(=O)N2CCC[C@@H]2C(=O)O)n1Cc1ccccc1	ZINC000819035855	FD	On-Demand	Anodyne	HCRTR2	18	42
Cc1nnc(SCC(=O)N2CCC[C@@H]2C(=O)O)n1Cc1ccccc1	ZINC000819035855	FD	On-Demand	Anodyne	TMPRSS11D	52	33
Cc1nnc(-c2cccc(NC(=O)Nc3cccc(CC(=O)O)c3)c2)n1C	ZINC000819035858	FG	On-Demand	Anodyne	HTR1D	22	40
Cc1nnc(-c2cccc(NC(=O)Nc3cccc(CC(=O)O)c3)c2)n1C	ZINC000819035858	FG	On-Demand	Anodyne	HTR1B	18	40
Cc1nnc(-c2cccc(NC(=O)Nc3cccc(CC(=O)O)c3)c2)n1C	ZINC000819035858	FG	On-Demand	Anodyne	CCKAR	30	48
Cc1nnc(-c2cccc(NC(=O)Nc3cccc(CC(=O)O)c3)c2)n1C	ZINC000819035858	FG	On-Demand	Anodyne	KDR	20	40
Cc1nnc(-c2cccc(NC(=O)Nc3cccc(CC(=O)O)c3)c2)n1C	ZINC000819035858	FG	On-Demand	Anodyne	CCKBR	45	48
Cc1nnc(-c2cccc(NC(=O)C(=O)N3CCO[C@@H](C(=O)O)C3)c2)o1	ZINC000819035862	FC	On-Demand	Anodyne	PTPN11	44	32
Cc1nnc(-c2cccc(NC(=O)C(=O)N3CCO[C@H](C(=O)O)C3)c2)o1	ZINC000819035863	FC	On-Demand	Anodyne	PTPN11	44	32
Cc1nnc(-c2cccc(NC(=O)C(=O)N3CCC[C@H](CC(=O)O)C3)c2)o1	ZINC000819035864	FD	On-Demand	Anodyne	CCR3	47	40
Cc1nnc(-c2cccc(NC(=O)C(=O)N3CCC[C@H](CC(=O)O)C3)c2)o1	ZINC000819035864	FD	On-Demand	Anodyne	PTPN11	48	31
Cc1nnc(-c2cccc(NC(=O)C(=O)N3CCC[C@@H](CC(=O)O)C3)c2)o1	ZINC000819035865	FD	On-Demand	Anodyne	CCR3	47	40
Cc1nnc(-c2cccc(NC(=O)C(=O)N3CCC[C@@H](CC(=O)O)C3)c2)o1	ZINC000819035865	FD	On-Demand	Anodyne	PTPN11	48	31
Cc1nnc(-c2cccc(NC(=O)Nc3ccccc3CC(=O)O)c2)n1C	ZINC000819035866	FG	On-Demand	Anodyne	LPL	40	35
Cc1nnc(-c2cccc(NC(=O)Nc3ccccc3CC(=O)O)c2)n1C	ZINC000819035866	FG	On-Demand	Anodyne	CCR3	37	40
Cc1nnc(-c2cccc(NC(=O)Nc3ccccc3CC(=O)O)c2)n1C	ZINC000819035866	FG	On-Demand	Anodyne	KDR	22	42
Cc1nnc(-c2cccc(NC(=O)Nc3ccccc3CC(=O)O)c2)n1C	ZINC000819035866	FG	On-Demand	Anodyne	CCKBR	50	39
Cc1nnc(-c2cccc(C(=O)NC(C)(C)CCC(=O)O)c2)o1	ZINC000819035870	DE	On-Demand	Anodyne	CTSV	32	40
Cc1nc(SCCC(=O)N2CCC[C@@H]2C(=O)O)n[nH]1	ZINC000819035883	CC	On-Demand	Anodyne	ACE	44	47
Cc1nc(SCCC(=O)N2CCC[C@H]2C(=O)O)n[nH]1	ZINC000819035884	CC	On-Demand	Anodyne	ACE	44	47
Cc1nnc(-c2cccc(C(=O)N[C@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035890	DE	On-Demand	Anodyne	MME	23	40
Cc1nnc(-c2cccc(C(=O)N[C@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035890	DE	On-Demand	Anodyne	CTSK	38	45
Cc1nnc(-c2cccc(C(=O)N[C@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035890	DE	On-Demand	Anodyne	CTSL	38	45
Cc1nnc(-c2cccc(C(=O)N[C@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035890	DE	On-Demand	Anodyne	C3AR1	37	40
Cc1nnc(-c2cccc(C(=O)N[C@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035890	DE	On-Demand	Anodyne	CTSS	30	45
Cc1nnc(-c2cccc(C(=O)N[C@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035890	DE	On-Demand	Anodyne	CAPN1	22	40
Cc1nnc(-c2cccc(C(=O)N[C@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035890	DE	On-Demand	Anodyne	CTSV	35	43
Cc1nnc(-c2cccc(C(=O)N[C@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035890	DE	On-Demand	Anodyne	FPR1	46	37
Cc1nnc(-c2cccc(C(=O)N[C@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035890	DE	On-Demand	Anodyne	NPR	61	36
Cc1nnc(-c2cccc(C(=O)N[C@@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035891	DE	On-Demand	Anodyne	MME	23	40
Cc1nnc(-c2cccc(C(=O)N[C@@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035891	DE	On-Demand	Anodyne	CTSK	38	45
Cc1nnc(-c2cccc(C(=O)N[C@@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035891	DE	On-Demand	Anodyne	CTSL	38	45
Cc1nnc(-c2cccc(C(=O)N[C@@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035891	DE	On-Demand	Anodyne	C3AR1	37	40
Cc1nnc(-c2cccc(C(=O)N[C@@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035891	DE	On-Demand	Anodyne	CTSS	30	45
Cc1nnc(-c2cccc(C(=O)N[C@@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035891	DE	On-Demand	Anodyne	CAPN1	22	40
Cc1nnc(-c2cccc(C(=O)N[C@@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035891	DE	On-Demand	Anodyne	CTSV	35	43
Cc1nnc(-c2cccc(C(=O)N[C@@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035891	DE	On-Demand	Anodyne	FPR1	46	37
Cc1nnc(-c2cccc(C(=O)N[C@@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035891	DE	On-Demand	Anodyne	NPR	61	36
Cc1nnc(-c2cccc(NC(=O)C(=O)N[C@@H](C(=O)O)C(C)C)c2)o1	ZINC000819035892	ED	On-Demand	Anodyne	PTPN11	60	34
Cc1nnc(-c2cccc(NC(=O)C(=O)N[C@@H](C(=O)O)C(C)C)c2)o1	ZINC000819035892	ED	On-Demand	Anodyne	CTSV	27	40
Cc1nnc(-c2cccc(NC(=O)C(=O)N[C@H](C(=O)O)C(C)C)c2)o1	ZINC000819035893	ED	On-Demand	Anodyne	PTPN11	60	34
Cc1nnc(-c2cccc(NC(=O)C(=O)N[C@H](C(=O)O)C(C)C)c2)o1	ZINC000819035893	ED	On-Demand	Anodyne	CTSV	27	40
Cc1nnc(-c2cccc(NC(=O)C(=O)N3CC[C@@H](C(=O)O)C3)c2)o1	ZINC000819035897	EC	On-Demand	Anodyne	PTPN11	59	33
Cc1nnc(-c2cccc(NC(=O)C(=O)N3CC[C@H](C(=O)O)C3)c2)o1	ZINC000819035898	EC	On-Demand	Anodyne	PTPN11	59	33
Cc1nnc(-c2cccc(NC(=O)C(=O)NCCCC(=O)O)c2)o1	ZINC000819035899	EC	On-Demand	Anodyne	PTPN11	60	33
Cc1nc(SCCC(=O)NCc2ccc(C(=O)O)cc2)n[nH]1	ZINC000819035904	DD	On-Demand	Anodyne	TNKS	55	32
Cc1nc(SCCC(=O)N[C@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035909	ED	On-Demand	Anodyne	ACE	49	51
Cc1nc(SCCC(=O)N[C@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035909	ED	On-Demand	Anodyne	MME	120	43
Cc1nc(SCCC(=O)N[C@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035909	ED	On-Demand	Anodyne	ANPEP	49	37
Cc1nc(SCCC(=O)N[C@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035909	ED	On-Demand	Anodyne	CMA1	25	41
Cc1nc(SCCC(=O)N[C@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035909	ED	On-Demand	Anodyne	FCER2	72	31
Cc1nc(SCCC(=O)N[C@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035909	ED	On-Demand	Anodyne	CYSP_TRYCR	41	33
Cc1nc(SCCC(=O)N[C@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035909	ED	On-Demand	Anodyne	CPA1	49	39
Cc1nc(SCCC(=O)N[C@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035909	ED	On-Demand	Anodyne	NPFFR2	43	34
Cc1nc(SCCC(=O)N[C@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035909	ED	On-Demand	Anodyne	C3AR1	52	34
Cc1nc(SCCC(=O)N[C@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035909	ED	On-Demand	Anodyne	NAALAD2	29	42
Cc1nc(SCCC(=O)N[C@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035909	ED	On-Demand	Anodyne	ECE1	45	37
Cc1nc(SCCC(=O)N[C@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035909	ED	On-Demand	Anodyne	F11	54	35
Cc1nc(SCCC(=O)N[C@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035909	ED	On-Demand	Anodyne	CAPN1	32	41
Cc1nc(SCCC(=O)N[C@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035909	ED	On-Demand	Anodyne	ACE2	88	42
Cc1nc(SCCC(=O)N[C@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035909	ED	On-Demand	Anodyne	FPR1	73	38
Cc1nc(SCCC(=O)N[C@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035909	ED	On-Demand	Anodyne	BLA1_STEMA	84	48
Cc1nc(SCCC(=O)N[C@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035909	ED	On-Demand	Anodyne	NPFFR1	49	34
Cc1nc(SCCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035910	ED	On-Demand	Anodyne	ACE	49	51
Cc1nc(SCCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035910	ED	On-Demand	Anodyne	MME	120	43
Cc1nc(SCCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035910	ED	On-Demand	Anodyne	ANPEP	49	37
Cc1nc(SCCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035910	ED	On-Demand	Anodyne	CMA1	25	41
Cc1nc(SCCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035910	ED	On-Demand	Anodyne	FCER2	72	31
Cc1nc(SCCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035910	ED	On-Demand	Anodyne	CYSP_TRYCR	41	33
Cc1nc(SCCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035910	ED	On-Demand	Anodyne	CPA1	49	39
Cc1nc(SCCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035910	ED	On-Demand	Anodyne	NPFFR2	43	34
Cc1nc(SCCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035910	ED	On-Demand	Anodyne	C3AR1	52	34
Cc1nc(SCCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035910	ED	On-Demand	Anodyne	NAALAD2	29	42
Cc1nc(SCCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035910	ED	On-Demand	Anodyne	ECE1	45	37
Cc1nc(SCCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035910	ED	On-Demand	Anodyne	F11	54	35
Cc1nc(SCCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035910	ED	On-Demand	Anodyne	CAPN1	32	41
Cc1nc(SCCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035910	ED	On-Demand	Anodyne	ACE2	88	42
Cc1nc(SCCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035910	ED	On-Demand	Anodyne	FPR1	73	38
Cc1nc(SCCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035910	ED	On-Demand	Anodyne	BLA1_STEMA	84	48
Cc1nc(SCCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)n[nH]1	ZINC000819035910	ED	On-Demand	Anodyne	NPFFR1	49	34
Cc1nnc(-c2cccc(NC(=O)C(=O)N[C@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035916	FD	On-Demand	Anodyne	MME	21	41
Cc1nnc(-c2cccc(NC(=O)C(=O)N[C@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035916	FD	On-Demand	Anodyne	ANPEP	25	42
Cc1nnc(-c2cccc(NC(=O)C(=O)N[C@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035916	FD	On-Demand	Anodyne	PTPN11	59	33
Cc1nnc(-c2cccc(NC(=O)C(=O)N[C@H](CC(C)C)C(=O)O)c2)o1	ZINC000819035916	FD	On-Demand	Anodyne	FPR1	53	44
Cc1nnc(-c2ccccc2C(=O)N2CC[C@H](C(=O)O)C2)o1	ZINC000819035922	DD	On-Demand	Anodyne	SLC6A1	84	37
Cc1nnc(-c2ccccc2C(=O)N2CC[C@@H](C(=O)O)C2)o1	ZINC000819035923	DD	On-Demand	Anodyne	SLC6A1	84	37
Cc1nnc(-c2cccc(C(=O)N3CCC[C@@H]3C(=O)O)c2)o1	ZINC000819035935	DD	On-Demand	Anodyne	ACE	49	40
Cc1nnc(-c2cccc(C(=O)N3CCC[C@@H]3C(=O)O)c2)o1	ZINC000819035935	DD	On-Demand	Anodyne	PREP	48	47
Cc1nnc(-c2cccc(C(=O)N3CCC[C@H]3C(=O)O)c2)o1	ZINC000819035936	DD	On-Demand	Anodyne	ACE	49	40
Cc1nnc(-c2cccc(C(=O)N3CCC[C@H]3C(=O)O)c2)o1	ZINC000819035936	DD	On-Demand	Anodyne	PREP	48	47
Cc1nnc(-c2ccccc2C(=O)N2CCC(C(=O)O)CC2)o1	ZINC000819035937	DD	On-Demand	Anodyne	SLC6A1	44	34
Cc1nnc(-c2ccccc2C(=O)N2CCC(C(=O)O)CC2)o1	ZINC000819035937	DD	On-Demand	Anodyne	L3MBTL3	51	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819035939	FG	On-Demand	Anodyne	ADRB1	32	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819035939	FG	On-Demand	Anodyne	ADRB3	49	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819035939	FG	On-Demand	Anodyne	GPR119	42	50
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2cccc(F)c2)C1	ZINC000819035940	FG	On-Demand	Anodyne	ADRB1	32	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2cccc(F)c2)C1	ZINC000819035940	FG	On-Demand	Anodyne	ADRB3	49	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC[C@H](O)c2cccc(F)c2)C1	ZINC000819035940	FG	On-Demand	Anodyne	GPR119	42	50
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819036020	ED	On-Demand	Anodyne	DRD4	31	47
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819036020	ED	On-Demand	Anodyne	PDE8B	16	40
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819036021	ED	On-Demand	Anodyne	DRD4	31	47
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819036021	ED	On-Demand	Anodyne	PDE8B	16	40
O=C(/C=C\[C@@H]1CCCO1)NC[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819036022	ED	On-Demand	Anodyne	DRD4	31	47
O=C(/C=C\[C@@H]1CCCO1)NC[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819036022	ED	On-Demand	Anodyne	PDE8B	16	40
O=C(/C=C/[C@@H]1CCCO1)NC[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819036023	ED	On-Demand	Anodyne	DRD4	31	47
O=C(/C=C/[C@@H]1CCCO1)NC[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819036023	ED	On-Demand	Anodyne	PDE8B	16	40
CON(C)C(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819036026	FD	On-Demand	Anodyne	HTR1A	109	57
CON(C)C(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819036026	FD	On-Demand	Anodyne	DRD2	87	57
CON(C)C(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819036026	FD	On-Demand	Anodyne	DRD1	23	44
CON(C)C(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819036026	FD	On-Demand	Anodyne	DRD4	54	53
CON(C)C(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819036026	FD	On-Demand	Anodyne	ADRA1D	45	47
CON(C)C(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819036026	FD	On-Demand	Anodyne	HTR2A	85	57
CON(C)C(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819036026	FD	On-Demand	Anodyne	HTR2C	46	50
CON(C)C(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819036026	FD	On-Demand	Anodyne	SLC6A4	22	49
CON(C)C(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819036026	FD	On-Demand	Anodyne	ADRA1A	52	47
CON(C)C(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819036026	FD	On-Demand	Anodyne	ADRA1B	34	47
CON(C)C(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819036026	FD	On-Demand	Anodyne	DRD3	109	51
CON(C)C(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819036026	FD	On-Demand	Anodyne	HTR4	26	45
CON(C)C(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819036026	FD	On-Demand	Anodyne	HRP1_PLAFA	63	35
CON(C)C(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819036026	FD	On-Demand	Anodyne	HTR7	121	49
CON(C)C(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819036026	FD	On-Demand	Anodyne	NPY1R	15	40
CON(C)C(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819036026	FD	On-Demand	Anodyne	HTR6	16	49
CON(C)C(=O)CCNCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819036026	FD	On-Demand	Anodyne	CACNA1G	24	51
Cc1nnc(SCC(=O)N(C)CCC(=O)O)n1Cc1ccccc1	ZINC000819036034	ED	On-Demand	Anodyne	PLA2G2A	40	35
Cc1nnc(CN(C)CC(=O)N2CCC[C@H]2C(=O)O)n1C	ZINC000819036036	CB	On-Demand	Anodyne	ACE	47	41
Cc1nnc(CN(C)CC(=O)N2CCC[C@@H]2C(=O)O)n1C	ZINC000819036037	CB	On-Demand	Anodyne	ACE	47	41
Cc1nnc(-c2cccc(NC(=O)C(=O)N3CCC(C(=O)O)CC3)c2)o1	ZINC000819036048	FD	On-Demand	Anodyne	PTPN11	63	36
Cc1nnc(-c2cccc(C(=O)Nc3cccc(CC(=O)O)c3)c2)o1	ZINC000819036051	EF	On-Demand	Anodyne	ROCK1	23	40
Cc1nnc(-c2cccc(C(=O)Nc3cccc(CC(=O)O)c3)c2)o1	ZINC000819036051	EF	On-Demand	Anodyne	ROCK2	35	48
Cc1nnc(-c2cccc(C(=O)Nc3cccc(CC(=O)O)c3)c2)o1	ZINC000819036051	EF	On-Demand	Anodyne	CTSV	29	40
Cc1nnc(-c2cccc(C(=O)Nc3cccc(CC(=O)O)c3)c2)o1	ZINC000819036051	EF	On-Demand	Anodyne	KCNK3	110	43
Cc1nnc(-c2cccc(C(=O)Nc3cccc(CC(=O)O)c3)c2)o1	ZINC000819036051	EF	On-Demand	Anodyne	KCNK9	57	43
Cc1nnc(-c2cccc(C(=O)N[C@@H](C(=O)O)C(C)C)c2)o1	ZINC000819036052	DD	On-Demand	Anodyne	CTSV	34	42
Cc1nnc(-c2cccc(C(=O)N[C@@H](C(=O)O)C(C)C)c2)o1	ZINC000819036052	DD	On-Demand	Anodyne	DGAT1	18	40
Cc1nnc(-c2cccc(C(=O)N[C@H](C(=O)O)C(C)C)c2)o1	ZINC000819036053	DD	On-Demand	Anodyne	CTSV	34	42
Cc1nnc(-c2cccc(C(=O)N[C@H](C(=O)O)C(C)C)c2)o1	ZINC000819036053	DD	On-Demand	Anodyne	DGAT1	18	40
Cc1nnc(-c2cccc(NC(=O)C(=O)N[C@H](C)C(=O)O)c2)o1	ZINC000819036056	DC	On-Demand	Anodyne	PTPN11	61	35
Cc1nnc(-c2cccc(NC(=O)C(=O)N[C@@H](C)C(=O)O)c2)o1	ZINC000819036057	DC	On-Demand	Anodyne	PTPN11	61	35
Cc1nnc(-c2cccc(C(=O)N3CC[C@@H](C(=O)O)C3)c2)o1	ZINC000819036062	DD	On-Demand	Anodyne	L3MBTL3	42	39
Cc1nnc(-c2cccc(C(=O)N3CC[C@H](C(=O)O)C3)c2)o1	ZINC000819036063	DD	On-Demand	Anodyne	L3MBTL3	42	39
Cc1nnc(SCC(=O)N[C@H](C(=O)O)C(C)C)n1Cc1ccccc1	ZINC000819036073	FD	On-Demand	Anodyne	ELANE	44	35
Cc1nnc(SCC(=O)N[C@@H](C(=O)O)C(C)C)n1Cc1ccccc1	ZINC000819036074	FD	On-Demand	Anodyne	ELANE	44	35
Cc1nnc(-c2ccccc2C(=O)NCc2ccc(C(=O)O)cc2)o1	ZINC000819036078	EF	On-Demand	Anodyne	AGTR1	25	40
Cc1nnc(-c2ccccc2C(=O)NCc2ccc(C(=O)O)cc2)o1	ZINC000819036078	EF	On-Demand	Anodyne	MTTP	28	42
Cc1nnc(-c2cccc(NC(=O)C(=O)NCCC(=O)O)c2)o1	ZINC000819036089	DC	On-Demand	Anodyne	PTPN11	61	34
Cc1nnc(SCC(=O)N2CC[C@H](C(=O)O)C2)n1Cc1ccccc1	ZINC000819036100	FD	On-Demand	Anodyne	SLC6A1	40	32
Cc1nnc(SCC(=O)N2CC[C@H](C(=O)O)C2)n1Cc1ccccc1	ZINC000819036100	FD	On-Demand	Anodyne	PDE6D	42	40
Cc1nnc(SCC(=O)N2CC[C@@H](C(=O)O)C2)n1Cc1ccccc1	ZINC000819036101	FD	On-Demand	Anodyne	SLC6A1	40	32
Cc1nnc(SCC(=O)N2CC[C@@H](C(=O)O)C2)n1Cc1ccccc1	ZINC000819036101	FD	On-Demand	Anodyne	PDE6D	42	40
Cc1nnc(S(=O)(=O)Cc2ccc(C(=O)O)cc2)n1Cc1ccccc1	ZINC000819036113	FE	On-Demand	Anodyne	PLA2G2A	45	35
Cc1nnc(S(=O)(=O)Cc2ccc(C(=O)O)cc2)n1Cc1ccccc1	ZINC000819036113	FE	On-Demand	Anodyne	TMPRSS11D	57	32
Cc1nnc(-c2cccc(NC(=O)C(=O)NCC(=O)O)c2)o1	ZINC000819036125	DC	On-Demand	Anodyne	PTPN11	63	35
Cc1nnc(-c2cccc(NC(=O)C(=O)NCC(=O)O)c2)o1	ZINC000819036125	DC	On-Demand	Anodyne	CTSV	27	40
Cc1nnc(-c2cccc(C(=O)OCC(=O)O)c2)o1	ZINC000819036126	CD	On-Demand	Anodyne	ALOX15	37	40
Cc1nc(SCCC(=O)N[C@H](C(=O)O)c2ccccc2)n[nH]1	ZINC000819036137	DD	On-Demand	Anodyne	GSTP1	16	40
Cc1nnc(-c2cccc(C(=O)Nc3ccccc3CC(=O)O)c2)o1	ZINC000819036143	EF	On-Demand	Anodyne	HDAC1	17	42
Cc1nnc(-c2cccc(C(=O)Nc3ccccc3CC(=O)O)c2)o1	ZINC000819036143	EF	On-Demand	Anodyne	KCNK3	77	36
Cc1nnc(-c2ccccc2C(=O)N[C@H](CC(C)C)C(=O)O)o1	ZINC000819036154	DE	On-Demand	Anodyne	MME	24	44
Cc1nnc(-c2ccccc2C(=O)N[C@H](CC(C)C)C(=O)O)o1	ZINC000819036154	DE	On-Demand	Anodyne	ANPEP	26	40
Cc1nnc(-c2ccccc2C(=O)N[C@H](CC(C)C)C(=O)O)o1	ZINC000819036154	DE	On-Demand	Anodyne	RNPEP	15	40
Cc1nnc(-c2ccccc2C(=O)N[C@H](CC(C)C)C(=O)O)o1	ZINC000819036154	DE	On-Demand	Anodyne	CTSK	28	41
Cc1nnc(-c2ccccc2C(=O)N[C@H](CC(C)C)C(=O)O)o1	ZINC000819036154	DE	On-Demand	Anodyne	CTSL	22	41
Cc1nnc(-c2ccccc2C(=O)N[C@H](CC(C)C)C(=O)O)o1	ZINC000819036154	DE	On-Demand	Anodyne	CTSS	16	41
Cc1nnc(-c2ccccc2C(=O)N[C@H](CC(C)C)C(=O)O)o1	ZINC000819036154	DE	On-Demand	Anodyne	CAPN1	52	40
Cc1nnc(-c2ccccc2C(=O)N[C@H](CC(C)C)C(=O)O)o1	ZINC000819036154	DE	On-Demand	Anodyne	CAPN2	59	35
Cc1nnc(-c2ccccc2C(=O)N[C@H](CC(C)C)C(=O)O)o1	ZINC000819036154	DE	On-Demand	Anodyne	FPR1	65	40
Cc1nnc(-c2ccccc2C(=O)N[C@H](CC(C)C)C(=O)O)o1	ZINC000819036154	DE	On-Demand	Anodyne	NPR	82	40
O=C(Nc1ccc(C2CCC2)cn1)c1cc(=O)c2ccc(F)cc2o1	ZINC000819036167	EH	On-Demand	Anodyne	KCNH2	15	46
O=Cc1cc(C(=O)Nc2ccc(C3CCC3)cn2)cs1	ZINC000819036191	CG	On-Demand	Anodyne	CDK5	47	36
CC(C)(C)OC(=O)N1CCC(C(=O)Nc2ccc(C3CCC3)cn2)(S(C)(=O)=O)CC1	ZINC000819036212	IG	On-Demand	Anodyne	GPR119	55	42
COC(=O)N[C@H](CC(C)C)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819036237	EE	On-Demand	Anodyne	RIR1_HHV11	60	33
COC(=O)N[C@H](CC(C)C)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819036238	EE	On-Demand	Anodyne	RIR1_HHV11	60	33
CCOc1ccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)Nc3cc(C(C)C)no3)c2)cc1	ZINC000819036239	JJ	On-Demand	Anodyne	MGAT1	48	35
O=C(Nc1ccc(C2CCC2)cn1)[C@H]1CC(=O)N(C2CCCC2)C1	ZINC000819036258	EG	On-Demand	Anodyne	INHA	24	51
O=C(Nc1ccc(C2CCC2)cn1)[C@@H]1CC(=O)N(C2CCCC2)C1	ZINC000819036259	EG	On-Demand	Anodyne	INHA	24	51
CCCCCCCCCC(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819036272	DI	On-Demand	Mild	CQSS	52	34
CCCCCCCCCC(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819036273	DI	On-Demand	Mild	CQSS	52	34
CCCCSCC(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819036275	CF	On-Demand	Anodyne	EST1_PIG	40	34
CCCCSCC(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819036276	CF	On-Demand	Anodyne	EST1_PIG	40	34
COCCCn1c(S)nc2cc(C(=O)Nc3ccc(C4CCC4)cn3)ccc2c1=O	ZINC000819036300	HH	On-Demand	Anodyne	ITK	17	41
CC(C)c1cc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCCCC3)c2)on1	ZINC000819036313	GG	On-Demand	Anodyne	CPT1A	53	36
CC(C)c1cc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCCCC3)c2)on1	ZINC000819036313	GG	On-Demand	Anodyne	CPT2	43	33
CC(C)c1cc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCCCC3)c2)on1	ZINC000819036313	GG	On-Demand	Anodyne	CPT1B	44	36
CC(C)c1cc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCCCC3)c2)on1	ZINC000819036313	GG	On-Demand	Anodyne	RPS6KA3	28	52
CC(C)c1cc(NC(=O)c2ccc(F)c(S(=O)(=O)N3CCCCC3)c2)on1	ZINC000819036313	GG	On-Demand	Anodyne	TAAR1	17	59
O=C(Nc1ccc(C2CCC2)cn1)c1cnc(Cl)c2ccccc12	ZINC000819036329	EJ	On-Demand	Anodyne	G2YM83_BOTF4	58	32
O=C(Nc1ccc(C2CCC2)cn1)c1cc(C(F)(F)F)cc(Cl)n1	ZINC000819036340	FJ	On-Demand	Anodyne	ATF1	55	37
O=C(Nc1ccc(C2CCC2)cn1)c1cc(C(F)(F)F)cc(Cl)n1	ZINC000819036340	FJ	On-Demand	Anodyne	NFKB1	50	37
CC(C)c1cc(NC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)on1	ZINC000819036364	EG	On-Demand	Anodyne	SLC5A7	22	40
COCc1cc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)ccc1F	ZINC000819036370	FH	On-Demand	Anodyne	GRIN2B	16	42
COCc1cc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)ccc1F	ZINC000819036371	FH	On-Demand	Anodyne	GRIN2B	16	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819036378	FF	On-Demand	Anodyne	ADRB2	63	49
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819036378	FF	On-Demand	Anodyne	ADRB1	43	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819036378	FF	On-Demand	Anodyne	ADRB3	75	53
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819036378	FF	On-Demand	Anodyne	MPO	46	38
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819036378	FF	On-Demand	Anodyne	MMP2	17	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819036378	FF	On-Demand	Anodyne	ALOX15	22	50
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819036379	FF	On-Demand	Anodyne	ADRB2	63	49
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819036379	FF	On-Demand	Anodyne	ADRB1	43	42
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819036379	FF	On-Demand	Anodyne	ADRB3	75	53
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819036379	FF	On-Demand	Anodyne	MPO	46	38
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819036379	FF	On-Demand	Anodyne	MMP2	17	40
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2c[nH]c3ccccc23)cc1	ZINC000819036379	FF	On-Demand	Anodyne	ALOX15	22	50
CCCOc1ccc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	ZINC000819036380	GF	On-Demand	Anodyne	GPR119	53	44
CCCOc1ccc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	ZINC000819036381	GF	On-Demand	Anodyne	GPR119	53	44
O=C(NNC(=S)NCCc1ccc(F)cc1)[C@@H]1CCCOC1	ZINC000819036414	ED	On-Demand	Reactive	GPBAR1	21	42
O=C(NNC(=S)NCCc1ccc(F)cc1)[C@H]1CCCOC1	ZINC000819036416	ED	On-Demand	Reactive	GPBAR1	21	42
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1C(F)(F)F	ZINC000819036433	FI	On-Demand	Anodyne	TPR	15	44
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1C(F)(F)F	ZINC000819036433	FI	On-Demand	Anodyne	MPO	76	43
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1C(F)(F)F	ZINC000819036435	FI	On-Demand	Anodyne	TPR	15	44
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1C(F)(F)F	ZINC000819036435	FI	On-Demand	Anodyne	MPO	76	43
O=C(/C=C/c1ccccc1)Nc1ccc(C2CCC2)cn1	ZINC000819036458	CI	On-Demand	Anodyne	MMP2	15	47
O=C(/C=C/c1ccccc1)Nc1ccc(C2CCC2)cn1	ZINC000819036458	CI	On-Demand	Anodyne	HDAC6	23	43
O=C(/C=C\c1ccccc1)Nc1ccc(C2CCC2)cn1	ZINC000819036459	CI	On-Demand	Anodyne	MMP2	15	47
O=C(/C=C\c1ccccc1)Nc1ccc(C2CCC2)cn1	ZINC000819036459	CI	On-Demand	Anodyne	HDAC6	23	43
O=C(NNC(=S)Nc1ccc(Oc2ccccc2)cc1)[C@H]1CCCOC1	ZINC000819036478	FG	On-Demand	Reactive	LTA4H	41	43
O=C(NNC(=S)Nc1ccc(Oc2ccccc2)cc1)[C@H]1CCCOC1	ZINC000819036478	FG	On-Demand	Reactive	F13A1	22	43
O=C(NNC(=S)Nc1ccc(Oc2ccccc2)cc1)[C@@H]1CCCOC1	ZINC000819036479	FG	On-Demand	Reactive	LTA4H	41	43
O=C(NNC(=S)Nc1ccc(Oc2ccccc2)cc1)[C@@H]1CCCOC1	ZINC000819036479	FG	On-Demand	Reactive	F13A1	22	43
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)Nc1ccc(C2CCC2)cn1	ZINC000819036501	HF	On-Demand	Anodyne	F2	35	42
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)Nc1ccc(C2CCC2)cn1	ZINC000819036501	HF	On-Demand	Anodyne	PREP	34	43
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)Nc1ccc(C2CCC2)cn1	ZINC000819036501	HF	On-Demand	Anodyne	LGMN	40	33
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)Nc1ccc(C2CCC2)cn1	ZINC000819036502	HF	On-Demand	Anodyne	F2	35	42
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)Nc1ccc(C2CCC2)cn1	ZINC000819036502	HF	On-Demand	Anodyne	PREP	34	43
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)Nc1ccc(C2CCC2)cn1	ZINC000819036502	HF	On-Demand	Anodyne	LGMN	40	33
COc1ccc2c(C)c(CCC(=O)N3CCC[C@@](CO)(C(C)C)C3)c(=O)oc2c1	ZINC000819036522	HG	On-Demand	Anodyne	MAOB	29	41
COc1ccc2c(C)c(CCC(=O)N3CCC[C@@](CO)(C(C)C)C3)c(=O)oc2c1	ZINC000819036522	HG	On-Demand	Anodyne	NQO1	23	42
COc1ccc2c(C)c(CCC(=O)N3CCC[C@](CO)(C(C)C)C3)c(=O)oc2c1	ZINC000819036523	HG	On-Demand	Anodyne	MAOB	29	41
COc1ccc2c(C)c(CCC(=O)N3CCC[C@](CO)(C(C)C)C3)c(=O)oc2c1	ZINC000819036523	HG	On-Demand	Anodyne	NQO1	23	42
O=C(CCCCN1CCCC1)Nc1ccc(C2CCC2)cn1	ZINC000819036536	DH	On-Demand	Anodyne	HRH3	27	44
O=C(CCCCN1CCCC1)Nc1ccc(C2CCC2)cn1	ZINC000819036536	DH	On-Demand	Anodyne	CHRNA7	21	49
O=C(NNC(=S)Nc1cccc(Br)c1)[C@@H]1CC(=O)N(C2CC2)C1	ZINC000819036568	GD	On-Demand	Reactive	INHA	22	70
O=C(NNC(=S)Nc1cccc(Br)c1)[C@H]1CC(=O)N(C2CC2)C1	ZINC000819036569	GD	On-Demand	Reactive	INHA	22	70
COCc1cc(CNC[C@H](O)c2ccc(F)cc2)ccc1F	ZINC000819036570	DF	On-Demand	Anodyne	ADRB2	24	40
COCc1cc(CNC[C@H](O)c2ccc(F)cc2)ccc1F	ZINC000819036570	DF	On-Demand	Anodyne	LEF	39	40
COCc1cc(CNC[C@@H](O)c2ccc(F)cc2)ccc1F	ZINC000819036571	DF	On-Demand	Anodyne	ADRB2	24	40
COCc1cc(CNC[C@@H](O)c2ccc(F)cc2)ccc1F	ZINC000819036571	DF	On-Demand	Anodyne	LEF	39	40
CC(=O)N1CCN(C(=O)CCNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819036598	FD	On-Demand	Anodyne	ADRB2	41	41
CC(=O)N1CCN(C(=O)CCNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819036598	FD	On-Demand	Anodyne	ADRB1	56	52
CC(=O)N1CCN(C(=O)CCNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819036598	FD	On-Demand	Anodyne	ADRB3	74	52
CC(=O)N1CCN(C(=O)CCNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819036598	FD	On-Demand	Anodyne	IGF1R	28	44
CC(=O)N1CCN(C(=O)CCNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819036598	FD	On-Demand	Anodyne	CYP3A4	48	40
CC(=O)N1CCN(C(=O)CCNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819036599	FD	On-Demand	Anodyne	ADRB2	41	41
CC(=O)N1CCN(C(=O)CCNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819036599	FD	On-Demand	Anodyne	ADRB1	56	52
CC(=O)N1CCN(C(=O)CCNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819036599	FD	On-Demand	Anodyne	ADRB3	74	52
CC(=O)N1CCN(C(=O)CCNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819036599	FD	On-Demand	Anodyne	IGF1R	28	44
CC(=O)N1CCN(C(=O)CCNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819036599	FD	On-Demand	Anodyne	CYP3A4	48	40
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cccc(F)c1	ZINC000819036600	DH	On-Demand	Anodyne	ADRB2	61	41
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cccc(F)c1	ZINC000819036600	DH	On-Demand	Anodyne	ADRB1	45	48
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cccc(F)c1	ZINC000819036600	DH	On-Demand	Anodyne	SLC6A4	20	51
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cccc(F)c1	ZINC000819036600	DH	On-Demand	Anodyne	ADRB3	55	67
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cccc(F)c1	ZINC000819036600	DH	On-Demand	Anodyne	MPO	113	51
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cccc(F)c1	ZINC000819036601	DH	On-Demand	Anodyne	ADRB2	61	41
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cccc(F)c1	ZINC000819036601	DH	On-Demand	Anodyne	ADRB1	45	48
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cccc(F)c1	ZINC000819036601	DH	On-Demand	Anodyne	SLC6A4	20	51
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cccc(F)c1	ZINC000819036601	DH	On-Demand	Anodyne	ADRB3	55	67
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cccc(F)c1	ZINC000819036601	DH	On-Demand	Anodyne	MPO	113	51
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000819036607	GD	On-Demand	Reactive	DRD2	15	50
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000819036607	GD	On-Demand	Reactive	DRD4	41	50
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000819036607	GD	On-Demand	Reactive	ACHE	38	51
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000819036607	GD	On-Demand	Reactive	CHRM3	18	47
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000819036607	GD	On-Demand	Reactive	SIGMAR1	53	55
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000819036607	GD	On-Demand	Reactive	CCR3	23	43
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000819036607	GD	On-Demand	Reactive	MCHR1	36	44
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@H]1CCCOC1	ZINC000819036607	GD	On-Demand	Reactive	CACNA1G	26	43
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000819036608	GD	On-Demand	Reactive	DRD2	15	50
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000819036608	GD	On-Demand	Reactive	DRD4	41	50
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000819036608	GD	On-Demand	Reactive	ACHE	38	51
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000819036608	GD	On-Demand	Reactive	CHRM3	18	47
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000819036608	GD	On-Demand	Reactive	SIGMAR1	53	55
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000819036608	GD	On-Demand	Reactive	CCR3	23	43
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000819036608	GD	On-Demand	Reactive	MCHR1	36	44
O=C(NNC(=S)NC1CCN(Cc2ccccc2)CC1)[C@@H]1CCCOC1	ZINC000819036608	GD	On-Demand	Reactive	CACNA1G	26	43
COCc1cc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1F	ZINC000819036609	GG	On-Demand	Anodyne	GPR119	48	57
COCc1cc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1F	ZINC000819036610	GG	On-Demand	Anodyne	GPR119	48	57
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1F	ZINC000819036611	DH	On-Demand	Anodyne	ADRB3	15	55
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1F	ZINC000819036611	DH	On-Demand	Anodyne	TPR	15	47
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1F	ZINC000819036611	DH	On-Demand	Anodyne	MPO	99	46
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1F	ZINC000819036611	DH	On-Demand	Anodyne	GRIA1	15	40
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1F	ZINC000819036612	DH	On-Demand	Anodyne	ADRB3	15	55
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1F	ZINC000819036612	DH	On-Demand	Anodyne	TPR	15	47
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1F	ZINC000819036612	DH	On-Demand	Anodyne	MPO	99	46
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccccc1F	ZINC000819036612	DH	On-Demand	Anodyne	GRIA1	15	40
O[C@H](CNCCCc1c[nH]c2ccccc12)c1c(F)cccc1F	ZINC000819036625	EH	On-Demand	Anodyne	ADRB3	15	55
O[C@H](CNCCCc1c[nH]c2ccccc12)c1c(F)cccc1F	ZINC000819036625	EH	On-Demand	Anodyne	MPO	101	46
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1c(F)cccc1F	ZINC000819036626	EH	On-Demand	Anodyne	ADRB3	15	55
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1c(F)cccc1F	ZINC000819036626	EH	On-Demand	Anodyne	MPO	101	46
COCc1cc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1F	ZINC000819036633	FE	On-Demand	Anodyne	ADRB3	24	41
COCc1cc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1F	ZINC000819036634	FE	On-Demand	Anodyne	ADRB3	24	41
COc1ccc(OC)c([C@H](O)CNCCC(=O)N2CCN(C(C)=O)CC2)c1	ZINC000819036638	GC	On-Demand	Anodyne	ADRB2	17	44
COc1ccc(OC)c([C@H](O)CNCCC(=O)N2CCN(C(C)=O)CC2)c1	ZINC000819036638	GC	On-Demand	Anodyne	MTNR1A	37	41
O=C(NNC(=S)NCCc1ccc(Cl)cc1Cl)[C@@H]1CCCOC1	ZINC000819036646	GE	On-Demand	Reactive	P2RX7	30	41
O=C(NNC(=S)NCCc1ccc(Cl)cc1Cl)[C@@H]1CCCOC1	ZINC000819036646	GE	On-Demand	Reactive	EPHX2	17	46
O=C(NNC(=S)NCCc1ccc(Cl)cc1Cl)[C@H]1CCCOC1	ZINC000819036647	GE	On-Demand	Reactive	P2RX7	30	41
O=C(NNC(=S)NCCc1ccc(Cl)cc1Cl)[C@H]1CCCOC1	ZINC000819036647	GE	On-Demand	Reactive	EPHX2	17	46
Cc1ccccc1[C@@H](O)CNCCCc1c[nH]c2ccccc12	ZINC000819036648	DH	On-Demand	Anodyne	ADRB2	55	41
Cc1ccccc1[C@@H](O)CNCCCc1c[nH]c2ccccc12	ZINC000819036648	DH	On-Demand	Anodyne	ADRB1	34	41
Cc1ccccc1[C@@H](O)CNCCCc1c[nH]c2ccccc12	ZINC000819036648	DH	On-Demand	Anodyne	ADRB3	21	55
Cc1ccccc1[C@@H](O)CNCCCc1c[nH]c2ccccc12	ZINC000819036648	DH	On-Demand	Anodyne	MPO	54	42
Cc1ccccc1[C@@H](O)CNCCCc1c[nH]c2ccccc12	ZINC000819036648	DH	On-Demand	Anodyne	BRS3	25	40
Cc1ccccc1[C@@H](O)CNCCCc1c[nH]c2ccccc12	ZINC000819036648	DH	On-Demand	Anodyne	NMBR	30	41
C=C(C)C(C)(C)C(=O)Oc1ccccc1	ZINC000819036656	BG	On-Demand	Mild	PRTN3	55	37
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@@H]1CCCOC1	ZINC000819036660	DD	On-Demand	Reactive	MME	51	38
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@@H]1CCCOC1	ZINC000819036660	DD	On-Demand	Reactive	CAPN1	44	37
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@H]1CCCOC1	ZINC000819036661	DD	On-Demand	Reactive	MME	51	38
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@H]1CCCOC1	ZINC000819036661	DD	On-Demand	Reactive	CAPN1	44	37
O=C(COc1ccc2ccc(=O)oc2c1)Nc1ccc(C2CCC2)cn1	ZINC000819036695	FG	On-Demand	Anodyne	MAOA	42	41
O=C(COc1ccc2ccc(=O)oc2c1)Nc1ccc(C2CCC2)cn1	ZINC000819036695	FG	On-Demand	Anodyne	MAOB	16	41
COCc1cc(CNC[C@H](O)c2cc(F)ccc2F)ccc1F	ZINC000819036736	EG	On-Demand	Anodyne	LEF	43	36
COCc1cc(CNC[C@@H](O)c2cc(F)ccc2F)ccc1F	ZINC000819036737	EG	On-Demand	Anodyne	LEF	43	36
O=C(Nc1ccc(C2CCC2)cn1)c1cnn(-c2ncccc2Cl)c1C(F)(F)Cl	ZINC000819036753	IK	On-Demand	Anodyne	GCK	15	40
CC(=O)N1CCN(C(=O)CCNC[C@H](O)c2cccc(Br)c2)CC1	ZINC000819036754	GD	On-Demand	Anodyne	ADRB3	43	38
CC(=O)N1CCN(C(=O)CCNC[C@@H](O)c2cccc(Br)c2)CC1	ZINC000819036755	GD	On-Demand	Anodyne	ADRB3	43	38
O=C(NNC(=S)NCCc1cccnc1)[C@@H]1CCCOC1	ZINC000819036761	DC	On-Demand	Reactive	CHRNA7	43	36
O=C(NNC(=S)NCCc1cccnc1)[C@@H]1CCCOC1	ZINC000819036761	DC	On-Demand	Reactive	NAMPT	43	44
O=C(NNC(=S)NCCc1cccnc1)[C@H]1CCCOC1	ZINC000819036762	DC	On-Demand	Reactive	CHRNA7	43	36
O=C(NNC(=S)NCCc1cccnc1)[C@H]1CCCOC1	ZINC000819036762	DC	On-Demand	Reactive	NAMPT	43	44
CC(C)c1cccc(C(C)C)c1NC(=S)NNC(=O)[C@H]1CCCOC1	ZINC000819036767	FH	On-Demand	Reactive	SOAT1	40	40
CC(C)c1cccc(C(C)C)c1NC(=S)NNC(=O)[C@@H]1CCCOC1	ZINC000819036768	FH	On-Demand	Reactive	SOAT1	40	40
O=C(Nc1ccccc1C(=O)Nc1ccc(C2CCC2)cn1)OCc1ccccc1	ZINC000819036771	HK	On-Demand	Anodyne	F10	17	42
O=C(Nc1ccccc1C(=O)Nc1ccc(C2CCC2)cn1)OCc1ccccc1	ZINC000819036771	HK	On-Demand	Anodyne	ELANE	19	42
O=C(Nc1ccc(C2CCC2)cn1)c1cc(Cl)cs1	ZINC000819036778	CI	On-Demand	Anodyne	F10	47	30
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)Oc3ccccc3)nn2)C1	ZINC000819036779	FG	On-Demand	Anodyne	PREP	23	41
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)Oc3ccccc3)nn2)C1	ZINC000819036780	FG	On-Demand	Anodyne	PREP	23	41
CC(=O)N1CCN(C(=O)CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819036807	FC	On-Demand	Bother	SSTR1	16	41
CC(=O)N1CCN(C(=O)CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819036809	FC	On-Demand	Bother	SSTR1	16	41
O=C(NNC(=S)Nc1cccc(C(F)(F)F)c1)[C@@H]1CCCOC1	ZINC000819036813	EE	On-Demand	Reactive	EPHX2	16	47
O=C(NNC(=S)Nc1cccc(C(F)(F)F)c1)[C@H]1CCCOC1	ZINC000819036815	EE	On-Demand	Reactive	EPHX2	16	47
COCc1cc(CNC[C@H](O)c2ccc(Cl)cc2)ccc1F	ZINC000819036830	DG	On-Demand	Anodyne	ADRB2	23	40
COCc1cc(CNCCC(=O)Nc2ccc(N(C)C)cc2)ccc1F	ZINC000819036831	FG	On-Demand	Anodyne	LEF	44	33
O=C(NNC(=S)Nc1ccc(OC(F)(F)F)cc1)[C@@H]1CCCOC1	ZINC000819036843	FE	On-Demand	Reactive	P2RY1	31	40
O=C(NNC(=S)Nc1ccc(OC(F)(F)F)cc1)[C@@H]1CCCOC1	ZINC000819036843	FE	On-Demand	Reactive	CTSS	17	45
O=C(NNC(=S)Nc1ccc(OC(F)(F)F)cc1)[C@@H]1CCCOC1	ZINC000819036843	FE	On-Demand	Reactive	EPHX2	59	46
O=C(NNC(=S)Nc1ccc(OC(F)(F)F)cc1)[C@H]1CCCOC1	ZINC000819036845	FE	On-Demand	Reactive	P2RY1	31	40
O=C(NNC(=S)Nc1ccc(OC(F)(F)F)cc1)[C@H]1CCCOC1	ZINC000819036845	FE	On-Demand	Reactive	CTSS	17	45
O=C(NNC(=S)Nc1ccc(OC(F)(F)F)cc1)[C@H]1CCCOC1	ZINC000819036845	FE	On-Demand	Reactive	EPHX2	59	46
COCc1cc(CNC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)ccc1F	ZINC000819036847	GG	On-Demand	Anodyne	GPR119	29	41
COCc1cc(CNC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)ccc1F	ZINC000819036849	GG	On-Demand	Anodyne	GPR119	29	41
CSc1ccc(OC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819036873	FH	On-Demand	Mild	PAPA1_CARPA	45	46
CSc1ccc(OC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819036873	FH	On-Demand	Mild	CTSK	22	46
CSc1ccc(OC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819036873	FH	On-Demand	Mild	FPR1	43	39
CSc1ccc(OC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819036874	FH	On-Demand	Mild	PAPA1_CARPA	45	46
CSc1ccc(OC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819036874	FH	On-Demand	Mild	CTSK	22	46
CSc1ccc(OC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819036874	FH	On-Demand	Mild	FPR1	43	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Oc1ccc(Cl)cc1)C2	ZINC000819036887	DG	On-Demand	Anodyne	SLC6A3	24	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Oc1ccc(Cl)cc1)C2	ZINC000819036888	DG	On-Demand	Anodyne	SLC6A3	24	45
O=C(NNC(=S)NCc1cccc(C(F)(F)F)c1)[C@@H]1CCCOC1	ZINC000819036898	FE	On-Demand	Reactive	CCR2	52	42
O=C(NNC(=S)NCc1cccc(C(F)(F)F)c1)[C@H]1CCCOC1	ZINC000819036899	FE	On-Demand	Reactive	CCR2	52	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3ccsc3)CC1)C2	ZINC000819036912	GE	On-Demand	Anodyne	NPBWR1	82	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3ccsc3)CC1)C2	ZINC000819036913	GE	On-Demand	Anodyne	NPBWR1	82	33
CC(=O)N1CCN(C(=O)CCNC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819036918	GD	On-Demand	Anodyne	RBP4	47	35
CC(=O)N1CCN(C(=O)CCNC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819036919	GD	On-Demand	Anodyne	RBP4	47	35
COCc1cc(CNC[C@H](O)c2cccc(F)c2)ccc1F	ZINC000819036935	DF	On-Demand	Anodyne	ADRB1	29	42
COCc1cc(CNC[C@H](O)c2cccc(F)c2)ccc1F	ZINC000819036935	DF	On-Demand	Anodyne	ADRB3	35	42
COCc1cc(CNC[C@@H](O)c2cccc(F)c2)ccc1F	ZINC000819036936	DF	On-Demand	Anodyne	ADRB1	29	42
COCc1cc(CNC[C@@H](O)c2cccc(F)c2)ccc1F	ZINC000819036936	DF	On-Demand	Anodyne	ADRB3	35	42
CCCOc1ccc(CNC[C@H](O)c2cccnc2)cn1	ZINC000819036937	CE	On-Demand	Anodyne	ADRB2	25	45
CCCOc1ccc(CNC[C@H](O)c2cccnc2)cn1	ZINC000819036937	CE	On-Demand	Anodyne	ADRB1	30	49
CCCOc1ccc(CNC[C@H](O)c2cccnc2)cn1	ZINC000819036937	CE	On-Demand	Anodyne	ADRB3	99	49
CCCOc1ccc(CNC[C@@H](O)c2cccnc2)cn1	ZINC000819036938	CE	On-Demand	Anodyne	ADRB2	25	45
CCCOc1ccc(CNC[C@@H](O)c2cccnc2)cn1	ZINC000819036938	CE	On-Demand	Anodyne	ADRB1	30	49
CCCOc1ccc(CNC[C@@H](O)c2cccnc2)cn1	ZINC000819036938	CE	On-Demand	Anodyne	ADRB3	99	49
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Br)cc1	ZINC000819036941	FI	On-Demand	Anodyne	ADRB2	52	40
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Br)cc1	ZINC000819036941	FI	On-Demand	Anodyne	ADRB1	29	41
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Br)cc1	ZINC000819036941	FI	On-Demand	Anodyne	HTR1B	20	42
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Br)cc1	ZINC000819036941	FI	On-Demand	Anodyne	ADRB3	28	58
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Br)cc1	ZINC000819036941	FI	On-Demand	Anodyne	MPO	75	43
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Br)cc1	ZINC000819036941	FI	On-Demand	Anodyne	GHSR	15	40
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Br)cc1	ZINC000819036942	FI	On-Demand	Anodyne	ADRB2	52	40
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Br)cc1	ZINC000819036942	FI	On-Demand	Anodyne	ADRB1	29	41
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Br)cc1	ZINC000819036942	FI	On-Demand	Anodyne	HTR1B	20	42
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Br)cc1	ZINC000819036942	FI	On-Demand	Anodyne	ADRB3	28	58
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Br)cc1	ZINC000819036942	FI	On-Demand	Anodyne	MPO	75	43
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(Br)cc1	ZINC000819036942	FI	On-Demand	Anodyne	GHSR	15	40
O=C(NNC(=S)Nc1cccc(OC(F)(F)F)c1)[C@@H]1CCCOC1	ZINC000819036947	FE	On-Demand	Reactive	TAAR1	23	44
O=C(NNC(=S)Nc1cccc(OC(F)(F)F)c1)[C@H]1CCCOC1	ZINC000819036948	FE	On-Demand	Reactive	TAAR1	23	44
O=C(Cc1ccc(F)cn1)Nc1ccc(C2CCC2)cn1	ZINC000819036991	CG	On-Demand	Anodyne	CDK5	34	40
O=C(CC1OCCO1)Nc1ccc(C2CCC2)cn1	ZINC000819037029	CE	On-Demand	Anodyne	CDK5	48	38
CC(C)(C)OC(=O)N1CC[C@H](CCC(=O)Nc2ccc(C3CCC3)cn2)C1	ZINC000819037035	FI	On-Demand	Anodyne	GPR119	48	43
CC(C)(C)OC(=O)N1CC[C@@H](CCC(=O)Nc2ccc(C3CCC3)cn2)C1	ZINC000819037036	FI	On-Demand	Anodyne	GPR119	48	43
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819037064	FF	On-Demand	Anodyne	PAPA1_CARPA	24	44
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819037065	FF	On-Demand	Anodyne	PAPA1_CARPA	24	44
COCc1cc(CNC[C@H](O)c2cccnc2)ccc1F	ZINC000819037071	CE	On-Demand	Anodyne	ADRB2	27	41
COCc1cc(CNC[C@H](O)c2cccnc2)ccc1F	ZINC000819037071	CE	On-Demand	Anodyne	ADRB1	32	46
COCc1cc(CNC[C@H](O)c2cccnc2)ccc1F	ZINC000819037071	CE	On-Demand	Anodyne	ADRB3	100	46
COCc1cc(CNC[C@@H](O)c2cccnc2)ccc1F	ZINC000819037072	CE	On-Demand	Anodyne	ADRB2	27	41
COCc1cc(CNC[C@@H](O)c2cccnc2)ccc1F	ZINC000819037072	CE	On-Demand	Anodyne	ADRB1	32	46
COCc1cc(CNC[C@@H](O)c2cccnc2)ccc1F	ZINC000819037072	CE	On-Demand	Anodyne	ADRB3	100	46
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)c(F)c1	ZINC000819037077	EH	On-Demand	Anodyne	ADRB2	57	42
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)c(F)c1	ZINC000819037077	EH	On-Demand	Anodyne	ADRB1	33	46
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)c(F)c1	ZINC000819037077	EH	On-Demand	Anodyne	HTR1B	16	42
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)c(F)c1	ZINC000819037077	EH	On-Demand	Anodyne	ADRB3	38	64
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)c(F)c1	ZINC000819037077	EH	On-Demand	Anodyne	MPO	101	46
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)c(F)c1	ZINC000819037078	EH	On-Demand	Anodyne	ADRB2	57	42
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)c(F)c1	ZINC000819037078	EH	On-Demand	Anodyne	ADRB1	33	46
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)c(F)c1	ZINC000819037078	EH	On-Demand	Anodyne	HTR1B	16	42
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)c(F)c1	ZINC000819037078	EH	On-Demand	Anodyne	ADRB3	38	64
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)c(F)c1	ZINC000819037078	EH	On-Demand	Anodyne	MPO	101	46
C=CCC1(C(=O)Oc2cccc([N+](=O)[O-])c2)CCOCC1	ZINC000819037085	CF	On-Demand	Mild	CACNA1D	51	37
C[C@H]1CCC[C@H](C)N1CCNC[C@@H](O)c1ccccc1	ZINC000819037095	CF	On-Demand	Anodyne	ADRB2	32	46
C[C@H]1CCC[C@H](C)N1CCNC[C@@H](O)c1ccccc1	ZINC000819037095	CF	On-Demand	Anodyne	ADRB1	27	42
C[C@H]1CCC[C@H](C)N1CCNC[C@@H](O)c1ccccc1	ZINC000819037095	CF	On-Demand	Anodyne	SLC6A3	19	45
C[C@H]1CCC[C@H](C)N1CCNC[C@@H](O)c1ccccc1	ZINC000819037095	CF	On-Demand	Anodyne	SLC18A2	40	43
C[C@H]1CCC[C@H](C)N1CCNC[C@@H](O)c1ccccc1	ZINC000819037095	CF	On-Demand	Anodyne	ADRB3	60	42
C[C@H]1CCC[C@H](C)N1CCNC[C@@H](O)c1ccccc1	ZINC000819037095	CF	On-Demand	Anodyne	ACHP_LYMST	17	43
C[C@H]1CCC[C@H](C)N1CCNC[C@@H](O)c1ccccc1	ZINC000819037095	CF	On-Demand	Anodyne	Q8WSF8_APLCA	32	43
C[C@H]1CCC[C@H](C)N1CCNC[C@H](O)c1ccccc1	ZINC000819037096	CF	On-Demand	Anodyne	ADRB2	32	46
C[C@H]1CCC[C@H](C)N1CCNC[C@H](O)c1ccccc1	ZINC000819037096	CF	On-Demand	Anodyne	ADRB1	27	42
C[C@H]1CCC[C@H](C)N1CCNC[C@H](O)c1ccccc1	ZINC000819037096	CF	On-Demand	Anodyne	SLC6A3	19	45
C[C@H]1CCC[C@H](C)N1CCNC[C@H](O)c1ccccc1	ZINC000819037096	CF	On-Demand	Anodyne	SLC18A2	40	43
C[C@H]1CCC[C@H](C)N1CCNC[C@H](O)c1ccccc1	ZINC000819037096	CF	On-Demand	Anodyne	ADRB3	60	42
C[C@H]1CCC[C@H](C)N1CCNC[C@H](O)c1ccccc1	ZINC000819037096	CF	On-Demand	Anodyne	ACHP_LYMST	17	43
C[C@H]1CCC[C@H](C)N1CCNC[C@H](O)c1ccccc1	ZINC000819037096	CF	On-Demand	Anodyne	Q8WSF8_APLCA	32	43
CN1CC[C@@H](CC(=O)NNC(=S)Nc2cccc(Cl)c2)C1	ZINC000819037099	ED	On-Demand	Reactive	MCHR1	23	42
O=C(NNC(=S)Nc1cccc(Cl)c1)[C@@H]1CC(=O)N(C2CC2)C1	ZINC000819037101	FD	On-Demand	Reactive	INHA	23	54
O=C(NNC(=S)Nc1cccc(Cl)c1)[C@H]1CC(=O)N(C2CC2)C1	ZINC000819037102	FD	On-Demand	Reactive	INHA	23	54
CC(=O)N1CCN(C(=O)CCNC[C@H](O)c2ccc(Cl)cc2Cl)CC1	ZINC000819037103	GD	On-Demand	Anodyne	MC4R	42	38
CC(=O)N1CCN(C(=O)CCNC[C@@H](O)c2ccc(Cl)cc2Cl)CC1	ZINC000819037104	GD	On-Demand	Anodyne	MC4R	42	38
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCOC2)cc1	ZINC000819037110	FB	On-Demand	Reactive	CA2	65	47
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCOC2)cc1	ZINC000819037110	FB	On-Demand	Reactive	CA1	59	47
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCOC2)cc1	ZINC000819037110	FB	On-Demand	Reactive	CA7	33	42
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCOC2)cc1	ZINC000819037110	FB	On-Demand	Reactive	CA5B	29	41
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCOC2)cc1	ZINC000819037110	FB	On-Demand	Reactive	CA4	46	47
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCOC2)cc1	ZINC000819037110	FB	On-Demand	Reactive	CA5A	29	41
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCOC2)cc1	ZINC000819037110	FB	On-Demand	Reactive	CA14	43	43
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCOC2)cc1	ZINC000819037110	FB	On-Demand	Reactive	CA12	48	44
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCOC2)cc1	ZINC000819037110	FB	On-Demand	Reactive	CA9	51	44
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@@H]2CCCOC2)cc1	ZINC000819037110	FB	On-Demand	Reactive	NAMPT	41	40
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCOC2)cc1	ZINC000819037111	FB	On-Demand	Reactive	CA2	65	47
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCOC2)cc1	ZINC000819037111	FB	On-Demand	Reactive	CA1	59	47
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCOC2)cc1	ZINC000819037111	FB	On-Demand	Reactive	CA7	33	42
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCOC2)cc1	ZINC000819037111	FB	On-Demand	Reactive	CA5B	29	41
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCOC2)cc1	ZINC000819037111	FB	On-Demand	Reactive	CA4	46	47
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCOC2)cc1	ZINC000819037111	FB	On-Demand	Reactive	CA5A	29	41
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCOC2)cc1	ZINC000819037111	FB	On-Demand	Reactive	CA14	43	43
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCOC2)cc1	ZINC000819037111	FB	On-Demand	Reactive	CA12	48	44
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCOC2)cc1	ZINC000819037111	FB	On-Demand	Reactive	CA9	51	44
NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)[C@H]2CCCOC2)cc1	ZINC000819037111	FB	On-Demand	Reactive	NAMPT	41	40
COCc1cc(CNC[C@H](O)c2ccccc2)ccc1F	ZINC000819037112	CF	On-Demand	Anodyne	ADRB3	48	39
COCc1cc(CNC[C@@H](O)c2ccccc2)ccc1F	ZINC000819037113	CF	On-Demand	Anodyne	ADRB3	48	39
O=C(NNC(=S)NCc1ccc(OC(F)(F)F)cc1)[C@@H]1CCCOC1	ZINC000819037114	GE	On-Demand	Reactive	CTSS	15	42
O=C(NNC(=S)NCc1ccc(OC(F)(F)F)cc1)[C@H]1CCCOC1	ZINC000819037115	GE	On-Demand	Reactive	CTSS	15	42
Cc1nc([C@@H](C)NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cs1	ZINC000819037120	FG	On-Demand	Anodyne	GPR119	38	44
Cc1nc([C@@H](C)NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cs1	ZINC000819037121	FG	On-Demand	Anodyne	GPR119	38	44
CC(=O)N1CCN(C(=O)CCNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819037128	EC	On-Demand	Anodyne	ADRB1	25	46
CC(=O)N1CCN(C(=O)CCNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819037128	EC	On-Demand	Anodyne	ADRB3	40	46
CC(=O)N1CCN(C(=O)CCNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819037129	EC	On-Demand	Anodyne	ADRB1	25	46
CC(=O)N1CCN(C(=O)CCNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819037129	EC	On-Demand	Anodyne	ADRB3	40	46
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1F	ZINC000819037144	EH	On-Demand	Anodyne	ADRB2	68	38
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1F	ZINC000819037144	EH	On-Demand	Anodyne	ADRB1	38	41
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1F	ZINC000819037144	EH	On-Demand	Anodyne	HTR1A	16	49
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1F	ZINC000819037144	EH	On-Demand	Anodyne	HTR1B	18	41
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1F	ZINC000819037144	EH	On-Demand	Anodyne	SLC6A4	22	56
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1F	ZINC000819037144	EH	On-Demand	Anodyne	ADRB3	23	57
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1F	ZINC000819037144	EH	On-Demand	Anodyne	MPO	115	56
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1F	ZINC000819037145	EH	On-Demand	Anodyne	ADRB2	68	38
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1F	ZINC000819037145	EH	On-Demand	Anodyne	ADRB1	38	41
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1F	ZINC000819037145	EH	On-Demand	Anodyne	HTR1A	16	49
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1F	ZINC000819037145	EH	On-Demand	Anodyne	HTR1B	18	41
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1F	ZINC000819037145	EH	On-Demand	Anodyne	SLC6A4	22	56
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1F	ZINC000819037145	EH	On-Demand	Anodyne	ADRB3	23	57
O[C@H](CNCCCc1c[nH]c2ccccc12)c1ccc(F)cc1F	ZINC000819037145	EH	On-Demand	Anodyne	MPO	115	56
O=C(Nc1ccccc1C(=O)Nc1ccc(C2CCC2)cn1)c1cccs1	ZINC000819037228	GJ	On-Demand	Anodyne	F10	26	43
O=C(Nc1ccccc1C(=O)Nc1ccc(C2CCC2)cn1)c1cccs1	ZINC000819037228	GJ	On-Demand	Anodyne	G2YM83_BOTF4	50	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Oc1cccc(C(F)(F)F)c1)C2	ZINC000819037255	FG	On-Demand	Anodyne	CCR2	61	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Oc1cccc(C(F)(F)F)c1)C2	ZINC000819037255	FG	On-Demand	Anodyne	PDS	40	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Oc1cccc(C(F)(F)F)c1)C2	ZINC000819037257	FG	On-Demand	Anodyne	CCR2	61	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Oc1cccc(C(F)(F)F)c1)C2	ZINC000819037257	FG	On-Demand	Anodyne	PDS	40	36
CCN1CCC[C@@H]1CNC(=S)NNC(=O)[C@H]1CCCOC1	ZINC000819037263	DC	On-Demand	Reactive	DRD2	28	41
CCN1CCC[C@@H]1CNC(=S)NNC(=O)[C@@H]1CCCOC1	ZINC000819037265	DC	On-Demand	Reactive	DRD2	28	41
COCc1cc(CNC[C@H](O)c2ccc(F)cc2F)ccc1F	ZINC000819037272	EG	On-Demand	Anodyne	LEF	43	35
COCc1cc(CNC[C@@H](O)c2ccc(F)cc2F)ccc1F	ZINC000819037273	EG	On-Demand	Anodyne	LEF	43	35
Cc1ccc(N2CCCC2)c(C(=O)Nc2ccc(C3CCC3)cn2)c1	ZINC000819037279	EJ	On-Demand	Anodyne	HCRTR1	45	32
O=C(Cc1cnn(-c2ccccc2)n1)Nc1ccc(C2CCC2)cn1	ZINC000819037281	EG	On-Demand	Anodyne	CDK5	28	41
C[C@H](NC(=S)NNC(=O)[C@@H]1CCCOC1)c1ccc(Br)cc1	ZINC000819037294	GE	On-Demand	Reactive	PRCP	16	43
C[C@H](NC(=S)NNC(=O)[C@H]1CCCOC1)c1ccc(Br)cc1	ZINC000819037295	GE	On-Demand	Reactive	PRCP	16	43
C[C@@H](NC(=S)NNC(=O)[C@H]1CCCOC1)c1ccc(Br)cc1	ZINC000819037296	GE	On-Demand	Reactive	PRCP	16	43
C[C@@H](NC(=S)NNC(=O)[C@@H]1CCCOC1)c1ccc(Br)cc1	ZINC000819037297	GE	On-Demand	Reactive	PRCP	16	43
CC(=O)N1CCN(C(=O)CCNC[C@H](O)c2ccccc2)CC1	ZINC000819037314	DC	On-Demand	Anodyne	ADRB2	22	45
CC(=O)N1CCN(C(=O)CCNC[C@H](O)c2ccccc2)CC1	ZINC000819037314	DC	On-Demand	Anodyne	ADRB1	35	41
CC(=O)N1CCN(C(=O)CCNC[C@H](O)c2ccccc2)CC1	ZINC000819037314	DC	On-Demand	Anodyne	ADRB3	61	44
CC(=O)N1CCN(C(=O)CCNC[C@H](O)c2ccccc2)CC1	ZINC000819037314	DC	On-Demand	Anodyne	PTAFR	24	41
CC(=O)N1CCN(C(=O)CCNC[C@@H](O)c2ccccc2)CC1	ZINC000819037315	DC	On-Demand	Anodyne	ADRB2	22	45
CC(=O)N1CCN(C(=O)CCNC[C@@H](O)c2ccccc2)CC1	ZINC000819037315	DC	On-Demand	Anodyne	ADRB1	35	41
CC(=O)N1CCN(C(=O)CCNC[C@@H](O)c2ccccc2)CC1	ZINC000819037315	DC	On-Demand	Anodyne	ADRB3	61	44
CC(=O)N1CCN(C(=O)CCNC[C@@H](O)c2ccccc2)CC1	ZINC000819037315	DC	On-Demand	Anodyne	PTAFR	24	41
COCc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1F	ZINC000819037334	EF	On-Demand	Bother	CACNA1C	50	42
COCc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1F	ZINC000819037334	EF	On-Demand	Bother	CACNA1D	79	42
COCc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1F	ZINC000819037335	EF	On-Demand	Bother	CACNA1C	50	42
COCc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1F	ZINC000819037335	EF	On-Demand	Bother	CACNA1D	79	42
Cc1ccc(F)c(NC(=S)NNC(=O)[C@H]2CC(=O)N(C3CC3)C2)c1	ZINC000819037338	FD	On-Demand	Reactive	INHA	19	50
Cc1ccc(F)c(NC(=S)NNC(=O)[C@@H]2CC(=O)N(C3CC3)C2)c1	ZINC000819037339	FD	On-Demand	Reactive	INHA	19	50
C[C@H]1CCC[C@H](C)N1CCNC[C@H](O)c1ccccc1Cl	ZINC000819037342	DG	On-Demand	Anodyne	OPRL1	41	39
O=C(NNC(=S)NCCc1cccs1)[C@H]1CC(=O)N(C2CC2)C1	ZINC000819037349	FC	On-Demand	Reactive	INHA	18	40
O=C(NNC(=S)NCCc1cccs1)[C@@H]1CC(=O)N(C2CC2)C1	ZINC000819037350	FC	On-Demand	Reactive	INHA	18	40
CC(=O)N1CCN(C(=O)CCNC[C@H](O)c2ccccc2Cl)CC1	ZINC000819037363	FD	On-Demand	Anodyne	FDFT1	27	40
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819037385	FG	On-Demand	Anodyne	ADRB2	68	49
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819037385	FG	On-Demand	Anodyne	ADRB1	44	41
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819037385	FG	On-Demand	Anodyne	HTR1A	17	56
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819037385	FG	On-Demand	Anodyne	HTR1D	21	41
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819037385	FG	On-Demand	Anodyne	ADRB3	31	52
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819037385	FG	On-Demand	Anodyne	TACR1	17	40
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819037385	FG	On-Demand	Anodyne	MPO	47	39
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819037385	FG	On-Demand	Anodyne	BRS3	25	40
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819037385	FG	On-Demand	Anodyne	NMBR	23	41
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819037385	FG	On-Demand	Anodyne	MTNR1A	30	44
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819037385	FG	On-Demand	Anodyne	MTNR1B	24	44
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819037385	FG	On-Demand	Anodyne	MMP2	16	40
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819037385	FG	On-Demand	Anodyne	GRPR	43	31
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccccc23)c1	ZINC000819037385	FG	On-Demand	Anodyne	GHSR	56	44
COCc1cc(CNCCC(=O)N(C)OC)ccc1F	ZINC000819037395	CD	On-Demand	Anodyne	LEF	52	35
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cccc(C(F)(F)F)c1	ZINC000819037412	FI	On-Demand	Anodyne	ADRB2	51	39
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cccc(C(F)(F)F)c1	ZINC000819037412	FI	On-Demand	Anodyne	ADRB1	36	46
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cccc(C(F)(F)F)c1	ZINC000819037412	FI	On-Demand	Anodyne	ADRB3	44	63
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cccc(C(F)(F)F)c1	ZINC000819037412	FI	On-Demand	Anodyne	TACR1	15	42
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cccc(C(F)(F)F)c1	ZINC000819037412	FI	On-Demand	Anodyne	MPO	74	41
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cccc(C(F)(F)F)c1	ZINC000819037413	FI	On-Demand	Anodyne	ADRB2	51	39
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cccc(C(F)(F)F)c1	ZINC000819037413	FI	On-Demand	Anodyne	ADRB1	36	46
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cccc(C(F)(F)F)c1	ZINC000819037413	FI	On-Demand	Anodyne	ADRB3	44	63
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cccc(C(F)(F)F)c1	ZINC000819037413	FI	On-Demand	Anodyne	TACR1	15	42
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cccc(C(F)(F)F)c1	ZINC000819037413	FI	On-Demand	Anodyne	MPO	74	41
CC(=O)N1CCN(C(=O)CCNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819037435	FD	On-Demand	Anodyne	ADRB1	22	42
CC(=O)N1CCN(C(=O)CCNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819037435	FD	On-Demand	Anodyne	ADRB3	34	42
CC(C)(C)NC(=S)NNC(=O)[C@@H]1CC(=O)N(C2CC2)C1	ZINC000819037441	CC	On-Demand	Reactive	INHA	18	42
CC(C)(C)NC(=S)NNC(=O)[C@H]1CC(=O)N(C2CC2)C1	ZINC000819037442	CC	On-Demand	Reactive	INHA	18	42
CCCOc1ccc(CNC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cn1	ZINC000819037452	GG	On-Demand	Anodyne	GPR119	23	40
CCCOc1ccc(CNC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cn1	ZINC000819037453	GG	On-Demand	Anodyne	GPR119	23	40
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1ccc(C2CCC2)cn1	ZINC000819037526	DH	On-Demand	Bother	SLC27A4	43	33
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1ccc(C2CCC2)cn1	ZINC000819037527	DH	On-Demand	Bother	SLC27A4	43	33
COC(=O)N[C@@H](C(=O)N1CCC[C@](CO)(C(C)C)C1)C(C)C	ZINC000819037534	DD	On-Demand	Anodyne	CCR1	50	36
COC(=O)N[C@@H](C(=O)N1CCC[C@@](CO)(C(C)C)C1)C(C)C	ZINC000819037535	DD	On-Demand	Anodyne	CCR1	50	36
CC(C)c1cc(NC(=O)c2cc3ccccc3oc2=O)on1	ZINC000819037564	CG	On-Demand	Anodyne	MAOB	19	63
O=C(NNC(=S)NCC1CCC1)[C@H]1CC(=O)N(C2CC2)C1	ZINC000819037573	DC	On-Demand	Reactive	INHA	18	41
O=C(NNC(=S)NCC1CCC1)[C@@H]1CC(=O)N(C2CC2)C1	ZINC000819037574	DC	On-Demand	Reactive	INHA	18	41
CC(=O)N1CCN(C(=O)CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819037588	FC	On-Demand	Bother	SSTR1	18	43
CC(=O)N1CCN(C(=O)CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819037589	FC	On-Demand	Bother	SSTR1	18	43
COCc1cc(CNC[C@@H](O)c2ccccc2C)ccc1F	ZINC000819037592	DG	On-Demand	Anodyne	LEF	50	35
COCc1cc(CNC[C@H](O)c2ccccc2C)ccc1F	ZINC000819037593	DG	On-Demand	Anodyne	LEF	50	35
C#Cc1cccc(NC(=S)NNC(=O)[C@@H]2CC(=O)N(C3CC3)C2)c1	ZINC000819037621	EC	On-Demand	Reactive	INHA	21	52
C#Cc1cccc(NC(=S)NNC(=O)[C@H]2CC(=O)N(C3CC3)C2)c1	ZINC000819037622	EC	On-Demand	Reactive	INHA	21	52
COCc1cc(CNC[C@H](O)c2cccc(Cl)c2)ccc1F	ZINC000819037625	DG	On-Demand	Anodyne	ADRB2	37	42
COCc1cc(CNC[C@H](O)c2cccc(Cl)c2)ccc1F	ZINC000819037625	DG	On-Demand	Anodyne	ADRB1	43	47
COCc1cc(CNC[C@H](O)c2cccc(Cl)c2)ccc1F	ZINC000819037625	DG	On-Demand	Anodyne	ADRB3	54	47
COCc1cc(CNC[C@@H](O)c2cccc(Cl)c2)ccc1F	ZINC000819037626	DG	On-Demand	Anodyne	ADRB2	37	42
COCc1cc(CNC[C@@H](O)c2cccc(Cl)c2)ccc1F	ZINC000819037626	DG	On-Demand	Anodyne	ADRB1	43	47
COCc1cc(CNC[C@@H](O)c2cccc(Cl)c2)ccc1F	ZINC000819037626	DG	On-Demand	Anodyne	ADRB3	54	47
COCc1cc(CNC[C@@H](O)c2ccc(F)cc2C)ccc1F	ZINC000819037654	DG	On-Demand	Anodyne	LEF	60	38
COCc1cc(CNC[C@H](O)c2ccc(F)cc2C)ccc1F	ZINC000819037655	DG	On-Demand	Anodyne	LEF	60	38
Cc1ccc(NC(=S)NNC(=O)[C@@H]2CC(=O)N(C3CC3)C2)cc1C	ZINC000819037663	ED	On-Demand	Reactive	INHA	21	50
Cc1ccc(NC(=S)NNC(=O)[C@H]2CC(=O)N(C3CC3)C2)cc1C	ZINC000819037664	ED	On-Demand	Reactive	INHA	21	50
O=C(Nc1ccc(C2CCC2)cn1)[C@@H](F)Cc1ccccc1	ZINC000819037689	CH	On-Demand	Anodyne	ACE	46	37
O=C(Nc1ccc(C2CCC2)cn1)[C@@H](F)Cc1ccccc1	ZINC000819037689	CH	On-Demand	Anodyne	MME	48	38
O=C(Nc1ccc(C2CCC2)cn1)[C@@H](F)Cc1ccccc1	ZINC000819037689	CH	On-Demand	Anodyne	TIMP3	54	36
O=C(Nc1ccc(C2CCC2)cn1)[C@@H](F)Cc1ccccc1	ZINC000819037689	CH	On-Demand	Anodyne	CDK5	33	41
O=C(Nc1ccc(C2CCC2)cn1)[C@@H](F)Cc1ccccc1	ZINC000819037689	CH	On-Demand	Anodyne	GPR142	43	32
O=C(Nc1ccc(C2CCC2)cn1)[C@H](F)Cc1ccccc1	ZINC000819037690	CH	On-Demand	Anodyne	ACE	46	37
O=C(Nc1ccc(C2CCC2)cn1)[C@H](F)Cc1ccccc1	ZINC000819037690	CH	On-Demand	Anodyne	MME	48	38
O=C(Nc1ccc(C2CCC2)cn1)[C@H](F)Cc1ccccc1	ZINC000819037690	CH	On-Demand	Anodyne	TIMP3	54	36
O=C(Nc1ccc(C2CCC2)cn1)[C@H](F)Cc1ccccc1	ZINC000819037690	CH	On-Demand	Anodyne	CDK5	33	41
O=C(Nc1ccc(C2CCC2)cn1)[C@H](F)Cc1ccccc1	ZINC000819037690	CH	On-Demand	Anodyne	GPR142	43	32
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)Nc1ccc(C2CCC2)cn1	ZINC000819037737	HG	On-Demand	Anodyne	F2	28	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)Nc1ccc(C2CCC2)cn1	ZINC000819037737	HG	On-Demand	Anodyne	PREP	24	42
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)Nc1ccc(C2CCC2)cn1	ZINC000819037740	HG	On-Demand	Anodyne	F2	28	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)Nc1ccc(C2CCC2)cn1	ZINC000819037740	HG	On-Demand	Anodyne	PREP	24	42
COc1ccc2c(C)c(CCC(=O)Nc3cc(C(C)C)no3)c(=O)oc2c1	ZINC000819037742	FH	On-Demand	Anodyne	MAOA	15	46
COc1ccc2c(C)c(CCC(=O)Nc3cc(C(C)C)no3)c(=O)oc2c1	ZINC000819037742	FH	On-Demand	Anodyne	MAOB	37	46
COc1ccc2c(C)c(CCC(=O)Nc3cc(C(C)C)no3)c(=O)oc2c1	ZINC000819037742	FH	On-Demand	Anodyne	NQO1	30	45
O=C(Nc1ccc(C2CCC2)cn1)c1ccc(CN2CCCCC2=O)cc1	ZINC000819037757	FI	On-Demand	Anodyne	KLKB1	16	42
O=C(Nc1ccc(C2CCC2)cn1)c1ccc(CN2CCCCC2=O)cc1	ZINC000819037757	FI	On-Demand	Anodyne	F10	33	46
CCCOc1ccc(CNC[C@H](O)c2ccccc2)cn1	ZINC000819037758	CF	On-Demand	Anodyne	ADRB2	15	40
CCCOc1ccc(CNC[C@H](O)c2ccccc2)cn1	ZINC000819037758	CF	On-Demand	Anodyne	ADRB1	27	44
CCCOc1ccc(CNC[C@H](O)c2ccccc2)cn1	ZINC000819037758	CF	On-Demand	Anodyne	ADRB3	44	39
CCCOc1ccc(CNC[C@@H](O)c2ccccc2)cn1	ZINC000819037760	CF	On-Demand	Anodyne	ADRB2	15	40
CCCOc1ccc(CNC[C@@H](O)c2ccccc2)cn1	ZINC000819037760	CF	On-Demand	Anodyne	ADRB1	27	44
CCCOc1ccc(CNC[C@@H](O)c2ccccc2)cn1	ZINC000819037760	CF	On-Demand	Anodyne	ADRB3	44	39
COc1ccc(OC)c([C@H](O)CNCCN2[C@H](C)CCC[C@H]2C)c1	ZINC000819037768	EF	On-Demand	Anodyne	ADRB2	15	45
COc1ccc(OC)c([C@H](O)CNCCN2[C@@H](C)CCC[C@@H]2C)c1	ZINC000819037770	EF	On-Demand	Anodyne	ADRB2	15	45
COc1ccc(OC)c([C@H](O)CNCCN2[C@@H](C)CCC[C@H]2C)c1	ZINC000819037772	EF	On-Demand	Anodyne	ADRB2	15	45
O=C(Nc1ccc(C2CCC2)cn1)c1ccc(N2CCOCC2)nc1	ZINC000819037773	EF	On-Demand	Anodyne	HDAC1	19	40
O=C(Nc1ccc(C2CCC2)cn1)c1ccc(N2CCOCC2)nc1	ZINC000819037773	EF	On-Demand	Anodyne	FASN	25	43
O=C(Nc1ccc(C2CCC2)cn1)c1ccc(N2CCOCC2)nc1	ZINC000819037773	EF	On-Demand	Anodyne	DGAT1	21	40
O=C(Nc1ccc(C2CCC2)cn1)c1ccc(N2CCOCC2)nc1	ZINC000819037773	EF	On-Demand	Anodyne	HPGDS	17	49
Cc1ccccc1[C@@H](O)CNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819037774	GG	On-Demand	Anodyne	CYNT	36	44
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cc(F)ccc1F	ZINC000819037825	EH	On-Demand	Anodyne	ADRB1	26	41
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cc(F)ccc1F	ZINC000819037825	EH	On-Demand	Anodyne	HTR1A	16	49
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cc(F)ccc1F	ZINC000819037825	EH	On-Demand	Anodyne	HTR1B	15	41
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cc(F)ccc1F	ZINC000819037825	EH	On-Demand	Anodyne	SLC6A4	22	53
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cc(F)ccc1F	ZINC000819037825	EH	On-Demand	Anodyne	ADRB3	18	57
O[C@@H](CNCCCc1c[nH]c2ccccc12)c1cc(F)ccc1F	ZINC000819037825	EH	On-Demand	Anodyne	MPO	114	53
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cc(F)ccc1F	ZINC000819037826	EH	On-Demand	Anodyne	ADRB1	26	41
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cc(F)ccc1F	ZINC000819037826	EH	On-Demand	Anodyne	HTR1A	16	49
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cc(F)ccc1F	ZINC000819037826	EH	On-Demand	Anodyne	HTR1B	15	41
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cc(F)ccc1F	ZINC000819037826	EH	On-Demand	Anodyne	SLC6A4	22	53
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cc(F)ccc1F	ZINC000819037826	EH	On-Demand	Anodyne	ADRB3	18	57
O[C@H](CNCCCc1c[nH]c2ccccc12)c1cc(F)ccc1F	ZINC000819037826	EH	On-Demand	Anodyne	MPO	114	53
COCc1cc(CNC[C@H](O)c2ccc(F)cc2Cl)ccc1F	ZINC000819037835	EH	On-Demand	Anodyne	LEF	41	35
COCc1cc(CNC[C@@H](O)c2ccc(F)cc2Cl)ccc1F	ZINC000819037836	EH	On-Demand	Anodyne	LEF	41	35
C=CCC1(C(=O)Oc2ccc(-c3ccc(C#N)cc3)cc2)CCOCC1	ZINC000819037862	EJ	On-Demand	Mild	CTSC	27	45
C[C@H](NC(=S)NNC(=O)[C@H]1CCCOC1)c1ccccc1	ZINC000819037873	DD	On-Demand	Reactive	BIRC8	54	32
C[C@@H](NC(=S)NNC(=O)[C@@H]1CCCOC1)c1ccccc1	ZINC000819037874	DD	On-Demand	Reactive	BIRC8	54	32
C[C@H](NC(=S)NNC(=O)[C@@H]1CCCOC1)c1ccccc1	ZINC000819037875	DD	On-Demand	Reactive	BIRC8	54	32
C[C@@H](NC(=S)NNC(=O)[C@H]1CCCOC1)c1ccccc1	ZINC000819037876	DD	On-Demand	Reactive	BIRC8	54	32
O=C(NNC(=S)NC12CC3CC(CC(C3)C1)C2)[C@@H]1CCCOC1	ZINC000819037883	ED	On-Demand	Reactive	EPHX2	52	45
O=C(NNC(=S)NC12CC3CC(CC(C3)C1)C2)[C@H]1CCCOC1	ZINC000819037884	ED	On-Demand	Reactive	EPHX2	52	45
Cc1ccc(NC(=S)NNC(=O)[C@@H]2CC(=O)N(C3CC3)C2)c(C)c1	ZINC000819037901	ED	On-Demand	Reactive	INHA	19	49
Cc1ccc(NC(=S)NNC(=O)[C@H]2CC(=O)N(C3CC3)C2)c(C)c1	ZINC000819037902	ED	On-Demand	Reactive	INHA	19	49
C[C@]1(C(=O)Nc2ccc(C3CCC3)cn2)Cc2ccccc2C(=O)O1	ZINC000819037934	EG	On-Demand	Anodyne	NPY5R	16	41
O=C(CCCCCn1c(S)nc2ccccc2c1=O)Nc1ccc(C2CCC2)cn1	ZINC000819037975	HJ	On-Demand	Anodyne	TNKS	40	31
CCCCCCCC(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819038027	CH	On-Demand	Mild	CQSS	52	34
CCCCCCCC(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819038028	CH	On-Demand	Mild	CQSS	52	34
O=C(Nc1ccc(C2CCC2)cn1)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819038045	FG	On-Demand	Anodyne	L3MBTL3	65	37
O=C(Nc1ccc(C2CCC2)cn1)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819038045	FG	On-Demand	Anodyne	NAMPT	18	42
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038113	GF	On-Demand	Anodyne	ADRB2	27	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038113	GF	On-Demand	Anodyne	ADRB1	50	39
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038113	GF	On-Demand	Anodyne	ABCB1	15	45
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038114	GF	On-Demand	Anodyne	ADRB2	27	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038114	GF	On-Demand	Anodyne	ADRB1	50	39
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038114	GF	On-Demand	Anodyne	ABCB1	15	45
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038115	GF	On-Demand	Anodyne	ADRB2	27	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038115	GF	On-Demand	Anodyne	ADRB1	50	39
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038115	GF	On-Demand	Anodyne	ABCB1	15	45
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038116	GF	On-Demand	Anodyne	ADRB2	27	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038116	GF	On-Demand	Anodyne	ADRB1	50	39
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038116	GF	On-Demand	Anodyne	ABCB1	15	45
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)c1ccc(F)cc1F	ZINC000819038158	FF	On-Demand	Anodyne	GPR119	16	42
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)c1ccc(F)cc1F	ZINC000819038159	FF	On-Demand	Anodyne	GPR119	16	42
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)c1ccc(F)cc1F	ZINC000819038160	FF	On-Demand	Anodyne	GPR119	16	42
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)c1ccc(F)cc1F	ZINC000819038161	FF	On-Demand	Anodyne	GPR119	16	42
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819038162	GE	On-Demand	Mild	ADRB1	47	38
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819038162	GE	On-Demand	Mild	DPP4	16	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819038163	GE	On-Demand	Mild	ADRB1	47	38
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819038163	GE	On-Demand	Mild	DPP4	16	40
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819038164	GE	On-Demand	Mild	ADRB1	47	38
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819038164	GE	On-Demand	Mild	DPP4	16	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819038165	GE	On-Demand	Mild	ADRB1	47	38
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819038165	GE	On-Demand	Mild	DPP4	16	40
CC(C)(C)OC(=O)N1CCC[C@H]1CNCCC(=O)Nc1cccc(F)c1	ZINC000819038171	FG	On-Demand	Anodyne	CCR3	29	44
CC(C)(C)OC(=O)N1CCC[C@@H]1CNCCC(=O)Nc1cccc(F)c1	ZINC000819038172	FG	On-Demand	Anodyne	CCR3	29	44
CC(C)(C)OC(=O)N1CCC[C@H]1CNCCS(=O)(=O)c1ccc(C#N)cn1	ZINC000819038192	GD	On-Demand	Mild	DPP4	15	42
CC(C)(C)OC(=O)N1CCC[C@@H]1CNCCS(=O)(=O)c1ccc(C#N)cn1	ZINC000819038193	GD	On-Demand	Mild	DPP4	15	42
O=C(COC(=O)CSc1ccccc1[N+](=O)[O-])Nc1ccccc1Br	ZINC000819038196	IH	On-Demand	Bother	COLA	47	36
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)c1cc2ccccc2o1	ZINC000819038198	FG	On-Demand	Anodyne	WNT3	51	37
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)c1cc2ccccc2o1	ZINC000819038199	FG	On-Demand	Anodyne	WNT3	51	37
CN(CC(=O)NC1CC1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819038262	FD	On-Demand	Mild	PAPA1_CARPA	33	41
CN(CC(=O)NC1CC1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819038263	FD	On-Demand	Mild	PAPA1_CARPA	33	41
CCN(Cc1ccc(OC)c(OC)c1)C(=O)C(F)=C1CCC1	ZINC000819038285	DG	On-Demand	Anodyne	MT-ND1	18	42
CCCOc1ccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)cn1	ZINC000819038305	FH	On-Demand	Anodyne	PDS	41	34
CCCOc1ccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)cn1	ZINC000819038306	FH	On-Demand	Anodyne	PDS	41	34
CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc2c(cn1)OCCO2	ZINC000819038336	FD	On-Demand	Clean	EPHB4	51	33
CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc2c(cn1)OCCO2	ZINC000819038336	FD	On-Demand	Clean	STAT6	52	33
COc1ccc(OC)c([C@H](O)CNCC2(N3CCC(OC)CC3)CCCC2)c1	ZINC000819038375	GF	On-Demand	Anodyne	HCN1	58	38
COc1ccc(OC)c([C@H](O)CNCC2(N3CCC(OC)CC3)CCCC2)c1	ZINC000819038375	GF	On-Demand	Anodyne	HCN4	55	38
CCCOc1ccc(CNC[C@H](O)c2cccc(Br)c2)cn1	ZINC000819038382	FG	On-Demand	Anodyne	ADRB1	17	40
CCCOc1ccc(CNC[C@H](O)c2cccc(Br)c2)cn1	ZINC000819038382	FG	On-Demand	Anodyne	ADRB3	22	40
CCCOc1ccc(CNC[C@@H](O)c2cccc(Br)c2)cn1	ZINC000819038383	FG	On-Demand	Anodyne	ADRB1	17	40
CCCOc1ccc(CNC[C@@H](O)c2cccc(Br)c2)cn1	ZINC000819038383	FG	On-Demand	Anodyne	ADRB3	22	40
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819038388	FF	On-Demand	Anodyne	WNT3	52	38
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819038389	FF	On-Demand	Anodyne	WNT3	52	38
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819038390	FF	On-Demand	Anodyne	WNT3	52	38
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819038391	FF	On-Demand	Anodyne	WNT3	52	38
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819038392	GE	On-Demand	Mild	ADRB1	58	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819038392	GE	On-Demand	Mild	ADRB3	40	39
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819038393	GE	On-Demand	Mild	ADRB1	58	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819038393	GE	On-Demand	Mild	ADRB3	40	39
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819038394	GE	On-Demand	Mild	ADRB1	58	40
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819038394	GE	On-Demand	Mild	ADRB3	40	39
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819038395	GE	On-Demand	Mild	ADRB1	58	40
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819038395	GE	On-Demand	Mild	ADRB3	40	39
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccccc1C(=O)NC[C@H]1CCCO1	ZINC000819038445	EG	On-Demand	Anodyne	PDE8B	16	40
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccccc1C(=O)NC[C@H]1CCCO1	ZINC000819038446	EG	On-Demand	Anodyne	PDE8B	16	40
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccccc1C(=O)NC[C@@H]1CCCO1	ZINC000819038447	EG	On-Demand	Anodyne	PDE8B	16	40
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccccc1C(=O)NC[C@@H]1CCCO1	ZINC000819038448	EG	On-Demand	Anodyne	PDE8B	16	40
O[C@@H](CN[C@H]1CCN(CC2CC2)C1)c1ccccc1C(F)(F)F	ZINC000819038465	EF	On-Demand	Anodyne	RBP4	46	32
O[C@@H](CN[C@H]1CCN(CC2CC2)C1)c1ccccc1C(F)(F)F	ZINC000819038465	EF	On-Demand	Anodyne	SFRP1	74	36
O[C@@H](CN[C@@H]1CCN(CC2CC2)C1)c1ccccc1C(F)(F)F	ZINC000819038466	EF	On-Demand	Anodyne	RBP4	46	32
O[C@@H](CN[C@@H]1CCN(CC2CC2)C1)c1ccccc1C(F)(F)F	ZINC000819038466	EF	On-Demand	Anodyne	SFRP1	74	36
O[C@H](CN[C@@H]1CCN(CC2CC2)C1)c1ccccc1C(F)(F)F	ZINC000819038467	EF	On-Demand	Anodyne	RBP4	46	32
O[C@H](CN[C@@H]1CCN(CC2CC2)C1)c1ccccc1C(F)(F)F	ZINC000819038467	EF	On-Demand	Anodyne	SFRP1	74	36
O[C@H](CN[C@H]1CCN(CC2CC2)C1)c1ccccc1C(F)(F)F	ZINC000819038468	EF	On-Demand	Anodyne	RBP4	46	32
O[C@H](CN[C@H]1CCN(CC2CC2)C1)c1ccccc1C(F)(F)F	ZINC000819038468	EF	On-Demand	Anodyne	SFRP1	74	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)Cc1ccccc1N1CCCC1)C2	ZINC000819038472	GG	On-Demand	Anodyne	KCNQ2	67	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)Cc1ccccc1N1CCCC1)C2	ZINC000819038473	GG	On-Demand	Anodyne	KCNQ2	67	36
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819038480	GH	On-Demand	Clean	ADRB2	42	40
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819038480	GH	On-Demand	Clean	ADRB1	74	41
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819038480	GH	On-Demand	Clean	ADRB3	57	43
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819038480	GH	On-Demand	Clean	ABCB1	22	48
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819038481	GH	On-Demand	Clean	ADRB2	42	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819038481	GH	On-Demand	Clean	ADRB1	74	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819038481	GH	On-Demand	Clean	ADRB3	57	43
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819038481	GH	On-Demand	Clean	ABCB1	22	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(C(F)(F)F)cc1)C2	ZINC000819038517	FH	On-Demand	Anodyne	EPHX2	30	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(C(F)(F)F)cc1)C2	ZINC000819038517	FH	On-Demand	Anodyne	TRPM8	41	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(C(F)(F)F)cc1)C2	ZINC000819038518	FH	On-Demand	Anodyne	EPHX2	30	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(C(F)(F)F)cc1)C2	ZINC000819038518	FH	On-Demand	Anodyne	TRPM8	41	35
C=CCCn1cc(C(=O)Oc2ccc(C(=O)OCC)cc2)nn1	ZINC000819038519	DE	On-Demand	Mild	ACR	63	46
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819038520	GE	On-Demand	Anodyne	GPR119	42	46
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819038520	GE	On-Demand	Anodyne	WNT3	52	38
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819038521	GE	On-Demand	Anodyne	GPR119	42	46
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819038521	GE	On-Demand	Anodyne	WNT3	52	38
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819038522	GE	On-Demand	Anodyne	GPR119	42	46
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819038522	GE	On-Demand	Anodyne	WNT3	52	38
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819038523	GE	On-Demand	Anodyne	GPR119	42	46
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819038523	GE	On-Demand	Anodyne	WNT3	52	38
Cc1ccc(OC[C@H](O)CNC[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038542	FF	On-Demand	Anodyne	ADRB2	39	47
Cc1ccc(OC[C@H](O)CNC[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038542	FF	On-Demand	Anodyne	ADRB1	58	44
Cc1ccc(OC[C@H](O)CNC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038543	FF	On-Demand	Anodyne	ADRB2	39	47
Cc1ccc(OC[C@H](O)CNC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038543	FF	On-Demand	Anodyne	ADRB1	58	44
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038544	FF	On-Demand	Anodyne	ADRB2	39	47
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038544	FF	On-Demand	Anodyne	ADRB1	58	44
Cc1ccc(OC[C@@H](O)CNC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038545	FF	On-Demand	Anodyne	ADRB2	39	47
Cc1ccc(OC[C@@H](O)CNC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038545	FF	On-Demand	Anodyne	ADRB1	58	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H]2CCCNC2=O)CC1	ZINC000819038555	FD	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H]2CCCNC2=O)CC1	ZINC000819038556	FD	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2CCCNC2=O)CC1	ZINC000819038557	FD	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2CCCNC2=O)CC1	ZINC000819038558	FD	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cocn2)CC1	ZINC000819038572	ED	On-Demand	Anodyne	GPR119	49	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cocn2)CC1	ZINC000819038573	ED	On-Demand	Anodyne	GPR119	49	45
CSc1ccc(OC[C@@H](O)CNC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038594	GG	On-Demand	Anodyne	ADRB1	49	38
CSc1ccc(OC[C@@H](O)CNC[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038595	GG	On-Demand	Anodyne	ADRB1	49	38
CSc1ccc(OC[C@H](O)CNC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038596	GG	On-Demand	Anodyne	ADRB1	49	38
CSc1ccc(OC[C@H](O)CNC[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000819038597	GG	On-Demand	Anodyne	ADRB1	49	38
CN(CC(=O)NC(C)(C)C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819038618	FD	On-Demand	Mild	PAPA1_CARPA	37	44
CN(CC(=O)NC(C)(C)C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819038619	FD	On-Demand	Mild	PAPA1_CARPA	37	44
COc1cccc(C2(CNC[C@H](O)c3cccc([N+](=O)[O-])c3)CCCC2)c1	ZINC000819038650	FH	On-Demand	Bother	CACNA1D	40	33
COc1cccc(C2(CNC[C@H](O)c3cccc([N+](=O)[O-])c3)CCCC2)c1	ZINC000819038650	FH	On-Demand	Bother	NMBR	41	33
COc1cccc(C2(CNC[C@@H](O)c3cccc([N+](=O)[O-])c3)CCCC2)c1	ZINC000819038651	FH	On-Demand	Bother	CACNA1D	40	33
COc1cccc(C2(CNC[C@@H](O)c3cccc([N+](=O)[O-])c3)CCCC2)c1	ZINC000819038651	FH	On-Demand	Bother	NMBR	41	33
CCO[C@@]1(C(=O)NNC(=S)Nc2ccc(OC(F)(F)F)cc2)CCOC1	ZINC000819038653	GE	On-Demand	Reactive	MMP13	24	42
CCO[C@@]1(C(=O)NNC(=S)Nc2ccc(OC(F)(F)F)cc2)CCOC1	ZINC000819038653	GE	On-Demand	Reactive	P2RY1	57	38
CCO[C@@]1(C(=O)NNC(=S)Nc2ccc(OC(F)(F)F)cc2)CCOC1	ZINC000819038653	GE	On-Demand	Reactive	MMP2	26	42
CCO[C@@]1(C(=O)NNC(=S)Nc2ccc(OC(F)(F)F)cc2)CCOC1	ZINC000819038653	GE	On-Demand	Reactive	EPHX2	55	41
O[C@@H](CN[C@@H]1CCN(CC2CC2)C1)c1ccc(F)cc1	ZINC000819038667	CD	On-Demand	Anodyne	SLC6A3	40	46
O[C@@H](CN[C@H]1CCN(CC2CC2)C1)c1ccc(F)cc1	ZINC000819038668	CD	On-Demand	Anodyne	SLC6A3	40	46
O[C@H](CN[C@@H]1CCN(CC2CC2)C1)c1ccc(F)cc1	ZINC000819038669	CD	On-Demand	Anodyne	SLC6A3	40	46
O[C@H](CN[C@H]1CCN(CC2CC2)C1)c1ccc(F)cc1	ZINC000819038670	CD	On-Demand	Anodyne	SLC6A3	40	46
CCO[C@@]1(C(=O)NNC(=S)Nc2cccc(OC)c2)CCOC1	ZINC000819038677	ED	On-Demand	Reactive	MTNR1B	25	40
Cc1ccc(NC(=S)NNC(=O)[C@H]2CCN(C)[C@@H](C)C2)c(C)c1	ZINC000819038760	EE	On-Demand	Reactive	EPHX2	22	40
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(F)(F)F)cc1	ZINC000819038761	CG	On-Demand	Anodyne	TRPV1	21	46
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(F)(F)F)cc1	ZINC000819038761	CG	On-Demand	Anodyne	EPHX2	29	44
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(F)(F)F)cc1	ZINC000819038762	CG	On-Demand	Anodyne	TRPV1	21	46
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(F)(F)F)cc1	ZINC000819038762	CG	On-Demand	Anodyne	EPHX2	29	44
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(F)(F)F)cc1	ZINC000819038763	CG	On-Demand	Anodyne	TRPV1	21	46
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(F)(F)F)cc1	ZINC000819038763	CG	On-Demand	Anodyne	EPHX2	29	44
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(F)(F)F)cc1	ZINC000819038764	CG	On-Demand	Anodyne	TRPV1	21	46
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(F)(F)F)cc1	ZINC000819038764	CG	On-Demand	Anodyne	EPHX2	29	44
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)c1cc(F)ccc1F	ZINC000819038767	FF	On-Demand	Anodyne	GPR119	17	44
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)c1cc(F)ccc1F	ZINC000819038768	FF	On-Demand	Anodyne	GPR119	17	44
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)c1cc(F)ccc1F	ZINC000819038769	FF	On-Demand	Anodyne	GPR119	17	44
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)c1cc(F)ccc1F	ZINC000819038770	FF	On-Demand	Anodyne	GPR119	17	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cocn1	ZINC000819038773	FE	On-Demand	Anodyne	CTSD	85	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cocn1	ZINC000819038773	FE	On-Demand	Anodyne	PGC	57	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cocn1	ZINC000819038773	FE	On-Demand	Anodyne	PAPA1_CARPA	31	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cocn1	ZINC000819038773	FE	On-Demand	Anodyne	BACE2	43	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cocn1	ZINC000819038773	FE	On-Demand	Anodyne	REN	82	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cocn1	ZINC000819038773	FE	On-Demand	Anodyne	REN1	29	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cocn1	ZINC000819038773	FE	On-Demand	Anodyne	BACE1	84	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cocn1	ZINC000819038773	FE	On-Demand	Anodyne	FPR1	48	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cocn1	ZINC000819038773	FE	On-Demand	Anodyne	PLM2_PLAFA	43	34
CCCOc1ccc(CNC[C@H](O)c2cccc(F)c2)cn1	ZINC000819038794	DF	On-Demand	Anodyne	ADRB1	21	41
CCCOc1ccc(CNC[C@H](O)c2cccc(F)c2)cn1	ZINC000819038794	DF	On-Demand	Anodyne	ADRB3	27	41
CCCOc1ccc(CNC[C@@H](O)c2cccc(F)c2)cn1	ZINC000819038795	DF	On-Demand	Anodyne	ADRB1	21	41
CCCOc1ccc(CNC[C@@H](O)c2cccc(F)c2)cn1	ZINC000819038795	DF	On-Demand	Anodyne	ADRB3	27	41
C=C(C)C(C)(C)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1	ZINC000819038884	DG	On-Demand	Mild	STAT6	51	33
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(CC3CC3)C2)cc1	ZINC000819038885	ED	On-Demand	Anodyne	ADRB3	20	42
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(CC3CC3)C2)cc1	ZINC000819038886	ED	On-Demand	Anodyne	ADRB3	20	42
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(CC3CC3)C2)cc1	ZINC000819038887	ED	On-Demand	Anodyne	ADRB3	20	42
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(CC3CC3)C2)cc1	ZINC000819038888	ED	On-Demand	Anodyne	ADRB3	20	42
CC(=O)Nc1cccc(CC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1	ZINC000819038890	GF	On-Demand	Clean	EPHB4	56	36
CC(=O)Nc1cccc(CC(=O)N(C)Cc2ccc(N3CCOCC3)cc2)c1	ZINC000819038890	GF	On-Demand	Clean	STAT6	48	35
CCO[C@@]1(C(=O)NNC(=S)Nc2ccc(F)c(Cl)c2)CCOC1	ZINC000819038897	FD	On-Demand	Reactive	ERBB4	40	34
CCO[C@@]1(C(=O)NNC(=S)Nc2cccc(C)c2)CCOC1	ZINC000819038899	DD	On-Demand	Reactive	KCNK3	49	34
CCO[C@@]1(C(=O)NNC(=S)Nc2cccc(C)c2)CCOC1	ZINC000819038899	DD	On-Demand	Reactive	KCNK9	44	34
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COCc1ccccc1	ZINC000819038919	FF	On-Demand	Anodyne	PREP	50	38
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COCc1ccccc1	ZINC000819038919	FF	On-Demand	Anodyne	BRCA1	46	33
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COCc1ccccc1	ZINC000819038920	FF	On-Demand	Anodyne	PREP	50	38
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COCc1ccccc1	ZINC000819038920	FF	On-Demand	Anodyne	BRCA1	46	33
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)COCc1ccccc1	ZINC000819038921	FF	On-Demand	Anodyne	PREP	50	38
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)COCc1ccccc1	ZINC000819038921	FF	On-Demand	Anodyne	BRCA1	46	33
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)COCc1ccccc1	ZINC000819038922	FF	On-Demand	Anodyne	PREP	50	38
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)COCc1ccccc1	ZINC000819038922	FF	On-Demand	Anodyne	BRCA1	46	33
C=CCC1(C(=O)Oc2ccc(NC(=O)c3ccccc3)cc2)CCOCC1	ZINC000819038961	FI	On-Demand	Mild	PRNP	57	36
C=CCC1(C(=O)Oc2ccc(NC(=O)c3ccccc3)cc2)CCOCC1	ZINC000819038961	FI	On-Demand	Mild	KCNK3	41	34
CCN(Cc1ccc(OC)c(OC)c1)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819038974	GF	On-Demand	Anodyne	MT-ND1	19	40
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819038982	GH	On-Demand	Clean	ADRB1	69	38
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819038982	GH	On-Demand	Clean	ADRB3	54	44
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819038982	GH	On-Demand	Clean	ABCB1	31	49
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819038982	GH	On-Demand	Clean	PDS	42	34
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819038983	GH	On-Demand	Clean	ADRB1	69	38
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819038983	GH	On-Demand	Clean	ADRB3	54	44
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819038983	GH	On-Demand	Clean	ABCB1	31	49
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819038983	GH	On-Demand	Clean	PDS	42	34
CC(C)(C)OC(=O)N1CCC[C@@H]1CNCCS(=O)(=O)c1ccccc1	ZINC000819039009	FE	On-Demand	Anodyne	SFRP1	106	43
CC(C)(C)OC(=O)N1CCC[C@@H]1CNCCS(=O)(=O)c1ccccc1	ZINC000819039009	FE	On-Demand	Anodyne	WNT3	81	43
CCO[C@@]1(C(=O)NNC(=S)N[C@H](C)Cc2ccccc2)CCOC1	ZINC000819039014	FD	On-Demand	Reactive	TIMP3	76	35
CCO[C@@]1(C(=O)NNC(=S)N[C@H](C)Cc2ccccc2)CCOC1	ZINC000819039014	FD	On-Demand	Reactive	CAPNS1	65	32
CCO[C@@]1(C(=O)NNC(=S)N[C@H](C)Cc2ccccc2)CCOC1	ZINC000819039014	FD	On-Demand	Reactive	CAPN1	52	34
CCO[C@@]1(C(=O)NNC(=S)N[C@H](C)Cc2ccccc2)CCOC1	ZINC000819039014	FD	On-Demand	Reactive	CAPN2	46	34
CCO[C@@]1(C(=O)NNC(=S)N[C@@H](C)Cc2ccccc2)CCOC1	ZINC000819039016	FD	On-Demand	Reactive	TIMP3	76	35
CCO[C@@]1(C(=O)NNC(=S)N[C@@H](C)Cc2ccccc2)CCOC1	ZINC000819039016	FD	On-Demand	Reactive	CAPNS1	65	32
CCO[C@@]1(C(=O)NNC(=S)N[C@@H](C)Cc2ccccc2)CCOC1	ZINC000819039016	FD	On-Demand	Reactive	CAPN1	52	34
CCO[C@@]1(C(=O)NNC(=S)N[C@@H](C)Cc2ccccc2)CCOC1	ZINC000819039016	FD	On-Demand	Reactive	CAPN2	46	34
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)c1ccccc1Cl	ZINC000819039019	FG	On-Demand	Anodyne	OPRL1	23	41
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)c1ccccc1Cl	ZINC000819039019	FG	On-Demand	Anodyne	WNT3	41	37
CCO[C@@]1(C(=O)NNC(=S)Nc2c(C(C)C)cccc2C(C)C)CCOC1	ZINC000819039025	GG	On-Demand	Reactive	SOAT1	48	40
CCO[C@@]1(C(=O)NNC(=S)NC23CC4CC(CC(C4)C2)C3)CCOC1	ZINC000819039035	FD	On-Demand	Reactive	EPHX2	45	38
O=C(CSc1ccccc1[N+](=O)[O-])OCc1c(F)c(F)c(F)c(F)c1F	ZINC000819039058	GI	On-Demand	Bother	GSTM2	49	33
COc1ccc([C@@H]2CCCN2C(=O)C(F)=C2CCC2)c(OC)c1	ZINC000819039079	DH	On-Demand	Anodyne	FKBP1A	48	39
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819039122	FG	On-Demand	Anodyne	ADRB1	44	44
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819039122	FG	On-Demand	Anodyne	ADRB3	64	44
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819039122	FG	On-Demand	Anodyne	CYP3A4	47	34
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819039124	FG	On-Demand	Anodyne	ADRB1	44	44
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819039124	FG	On-Demand	Anodyne	ADRB3	64	44
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819039124	FG	On-Demand	Anodyne	CYP3A4	47	34
O[C@@H](CN[C@@H]1CCN(CC2CC2)C1)c1ccc(Cl)cc1	ZINC000819039125	CE	On-Demand	Anodyne	ADRB3	19	46
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)c1c(F)cccc1F	ZINC000819039126	FF	On-Demand	Anodyne	GPR119	20	43
O[C@@H](CN[C@H]1CCN(CC2CC2)C1)c1ccc(Cl)cc1	ZINC000819039127	CE	On-Demand	Anodyne	ADRB3	19	46
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)c1c(F)cccc1F	ZINC000819039128	FF	On-Demand	Anodyne	GPR119	20	43
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)c1c(F)cccc1F	ZINC000819039130	FF	On-Demand	Anodyne	GPR119	20	43
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)c1c(F)cccc1F	ZINC000819039132	FF	On-Demand	Anodyne	GPR119	20	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CN(C)C)c1ccccc1)C2	ZINC000819039134	FE	On-Demand	Anodyne	PAK4	42	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CN(C)C)c1ccccc1)C2	ZINC000819039135	FE	On-Demand	Anodyne	PAK4	42	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CN(C)C)c1ccccc1)C2	ZINC000819039136	FE	On-Demand	Anodyne	PAK4	42	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CN(C)C)c1ccccc1)C2	ZINC000819039139	FE	On-Demand	Anodyne	PAK4	42	34
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@H](O)c3cccnc3)c2)C1	ZINC000819039144	FD	On-Demand	Anodyne	ADRB1	23	42
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@H](O)c3cccnc3)c2)C1	ZINC000819039144	FD	On-Demand	Anodyne	ADRB3	85	42
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@H](O)c3cccnc3)c2)C1	ZINC000819039151	FD	On-Demand	Anodyne	ADRB1	23	42
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@H](O)c3cccnc3)c2)C1	ZINC000819039151	FD	On-Demand	Anodyne	ADRB3	85	42
O[C@@H](CN[C@@H]1CCN(CC2CC2)C1)c1ccccc1	ZINC000819039153	CD	On-Demand	Anodyne	SLC6A3	26	47
O[C@@H](CN[C@@H]1CCN(CC2CC2)C1)c1ccccc1	ZINC000819039153	CD	On-Demand	Anodyne	SIGMAR1	25	42
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3cccnc3)c2)C1	ZINC000819039155	FD	On-Demand	Anodyne	ADRB1	23	42
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3cccnc3)c2)C1	ZINC000819039155	FD	On-Demand	Anodyne	ADRB3	85	42
O[C@@H](CN[C@H]1CCN(CC2CC2)C1)c1ccccc1	ZINC000819039156	CD	On-Demand	Anodyne	SLC6A3	26	47
O[C@@H](CN[C@H]1CCN(CC2CC2)C1)c1ccccc1	ZINC000819039156	CD	On-Demand	Anodyne	SIGMAR1	25	42
O[C@H](CN[C@@H]1CCN(CC2CC2)C1)c1ccccc1	ZINC000819039158	CD	On-Demand	Anodyne	SLC6A3	26	47
O[C@H](CN[C@@H]1CCN(CC2CC2)C1)c1ccccc1	ZINC000819039158	CD	On-Demand	Anodyne	SIGMAR1	25	42
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3cccnc3)c2)C1	ZINC000819039159	FD	On-Demand	Anodyne	ADRB1	23	42
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3cccnc3)c2)C1	ZINC000819039159	FD	On-Demand	Anodyne	ADRB3	85	42
O[C@H](CN[C@H]1CCN(CC2CC2)C1)c1ccccc1	ZINC000819039161	CD	On-Demand	Anodyne	SLC6A3	26	47
O[C@H](CN[C@H]1CCN(CC2CC2)C1)c1ccccc1	ZINC000819039161	CD	On-Demand	Anodyne	SIGMAR1	25	42
COc1ccc(OC)c([C@H]2CCCN2C(=O)C(F)=C2CCC2)c1	ZINC000819039173	DH	On-Demand	Anodyne	FKBP1A	44	40
COc1ccc(OC)c([C@H]2CCCN2C(=O)C(F)=C2CCC2)c1	ZINC000819039173	DH	On-Demand	Anodyne	MTNR1B	22	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCNC1=O	ZINC000819039246	GD	On-Demand	Anodyne	CTSD	85	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCNC1=O	ZINC000819039246	GD	On-Demand	Anodyne	PGC	62	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCNC1=O	ZINC000819039246	GD	On-Demand	Anodyne	PAPA1_CARPA	28	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCNC1=O	ZINC000819039246	GD	On-Demand	Anodyne	BACE2	49	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCNC1=O	ZINC000819039246	GD	On-Demand	Anodyne	REN	92	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCNC1=O	ZINC000819039246	GD	On-Demand	Anodyne	REN1	28	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCNC1=O	ZINC000819039246	GD	On-Demand	Anodyne	BACE1	75	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCNC1=O	ZINC000819039246	GD	On-Demand	Anodyne	FPR1	48	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCNC1=O	ZINC000819039246	GD	On-Demand	Anodyne	PLM1_PLAFA	26	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCNC1=O	ZINC000819039247	GD	On-Demand	Anodyne	CTSD	85	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCNC1=O	ZINC000819039247	GD	On-Demand	Anodyne	PGC	62	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCNC1=O	ZINC000819039247	GD	On-Demand	Anodyne	PAPA1_CARPA	28	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCNC1=O	ZINC000819039247	GD	On-Demand	Anodyne	BACE2	49	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCNC1=O	ZINC000819039247	GD	On-Demand	Anodyne	REN	92	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCNC1=O	ZINC000819039247	GD	On-Demand	Anodyne	REN1	28	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCNC1=O	ZINC000819039247	GD	On-Demand	Anodyne	BACE1	75	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCNC1=O	ZINC000819039247	GD	On-Demand	Anodyne	FPR1	48	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCNC1=O	ZINC000819039247	GD	On-Demand	Anodyne	PLM1_PLAFA	26	40
O=C1NCCC[C@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819039249	CD	On-Demand	Anodyne	ADRB1	35	41
O=C1NCCC[C@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819039249	CD	On-Demand	Anodyne	ADRB3	45	41
O=C1NCCC[C@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819039249	CD	On-Demand	Anodyne	CYP3A4	45	34
O=C1NCCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819039252	CD	On-Demand	Anodyne	ADRB1	35	41
O=C1NCCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819039252	CD	On-Demand	Anodyne	ADRB3	45	41
O=C1NCCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819039252	CD	On-Demand	Anodyne	CYP3A4	45	34
O=C1NCCC[C@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819039255	CD	On-Demand	Anodyne	ADRB1	35	41
O=C1NCCC[C@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819039255	CD	On-Demand	Anodyne	ADRB3	45	41
O=C1NCCC[C@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819039255	CD	On-Demand	Anodyne	CYP3A4	45	34
O=C1NCCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819039258	CD	On-Demand	Anodyne	ADRB1	35	41
O=C1NCCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819039258	CD	On-Demand	Anodyne	ADRB3	45	41
O=C1NCCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819039258	CD	On-Demand	Anodyne	CYP3A4	45	34
COc1cc2c(cc1OC)CN(C(=O)CCCNCC1(O)CCCCC1)CC2	ZINC000819039259	GF	On-Demand	Anodyne	ABCB1	16	46
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1ccc(F)cc1	ZINC000819039268	FF	On-Demand	Anodyne	ADRB1	58	43
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1ccc(F)cc1	ZINC000819039268	FF	On-Demand	Anodyne	ADRB3	40	40
CC(=O)Nc1cccc(CC(=O)N(C)Cc2ccc(N3CCCCC3)cc2)c1	ZINC000819039269	GH	On-Demand	Clean	OPRK1	18	47
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1ccc(F)cc1	ZINC000819039270	FF	On-Demand	Anodyne	ADRB1	58	43
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1ccc(F)cc1	ZINC000819039270	FF	On-Demand	Anodyne	ADRB3	40	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCN(CC3CC3)C2)CC1	ZINC000819039272	FE	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCN(CC3CC3)C2)CC1	ZINC000819039275	FE	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCN(CC3CC3)C2)CC1	ZINC000819039278	FE	On-Demand	Anodyne	GPR119	26	41
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3ccc(F)cn3)c2)C1	ZINC000819039294	GD	On-Demand	Anodyne	SLC6A1	47	35
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@H](O)c3ccc(F)cn3)c2)C1	ZINC000819039297	GD	On-Demand	Anodyne	SLC6A1	47	35
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@H](O)c3ccc(F)cn3)c2)C1	ZINC000819039301	GD	On-Demand	Anodyne	SLC6A1	47	35
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3ccc(F)cn3)c2)C1	ZINC000819039304	GD	On-Demand	Anodyne	SLC6A1	47	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819039307	FE	On-Demand	Anodyne	CHRM2	18	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819039307	FE	On-Demand	Anodyne	CHRM1	17	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819039307	FE	On-Demand	Anodyne	DRD2	22	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819039307	FE	On-Demand	Anodyne	DRD4	53	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819039307	FE	On-Demand	Anodyne	ACHE	41	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819039307	FE	On-Demand	Anodyne	DRD3	18	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819039307	FE	On-Demand	Anodyne	CHRM3	26	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819039307	FE	On-Demand	Anodyne	LTA4H	25	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819039307	FE	On-Demand	Anodyne	SIGMAR1	47	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819039307	FE	On-Demand	Anodyne	SSTR5	40	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819039307	FE	On-Demand	Anodyne	CCKAR	15	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819039307	FE	On-Demand	Anodyne	CACNA1B	17	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819039307	FE	On-Demand	Anodyne	CCR3	30	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819039307	FE	On-Demand	Anodyne	UTS2R	20	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819039307	FE	On-Demand	Anodyne	CCR2	16	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819039307	FE	On-Demand	Anodyne	FPR1	41	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819039307	FE	On-Demand	Anodyne	MCHR1	30	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819039307	FE	On-Demand	Anodyne	CACNA1G	25	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819039307	FE	On-Demand	Anodyne	BIRC2	32	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819039310	FE	On-Demand	Anodyne	CHRM2	18	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819039310	FE	On-Demand	Anodyne	CHRM1	17	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819039310	FE	On-Demand	Anodyne	DRD2	22	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819039310	FE	On-Demand	Anodyne	DRD4	53	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819039310	FE	On-Demand	Anodyne	ACHE	41	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819039310	FE	On-Demand	Anodyne	DRD3	18	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819039310	FE	On-Demand	Anodyne	CHRM3	26	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819039310	FE	On-Demand	Anodyne	LTA4H	25	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819039310	FE	On-Demand	Anodyne	SIGMAR1	47	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819039310	FE	On-Demand	Anodyne	SSTR5	40	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819039310	FE	On-Demand	Anodyne	CCKAR	15	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819039310	FE	On-Demand	Anodyne	CACNA1B	17	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819039310	FE	On-Demand	Anodyne	CCR3	30	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819039310	FE	On-Demand	Anodyne	UTS2R	20	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819039310	FE	On-Demand	Anodyne	CCR2	16	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819039310	FE	On-Demand	Anodyne	FPR1	41	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819039310	FE	On-Demand	Anodyne	MCHR1	30	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819039310	FE	On-Demand	Anodyne	CACNA1G	25	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819039310	FE	On-Demand	Anodyne	BIRC2	32	41
C#CCNC(=O)CCNCc1cccc(CN2CCC[C@@H](C(N)=O)C2)c1	ZINC000819039352	FC	On-Demand	Mild	SLC6A1	49	32
C#CCNC(=O)CCNCc1cccc(CN2CCC[C@H](C(N)=O)C2)c1	ZINC000819039354	FC	On-Demand	Mild	SLC6A1	49	32
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3ccccc3F)c2)C1	ZINC000819039379	GE	On-Demand	Anodyne	SLC6A1	104	39
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3ccccc3F)c2)C1	ZINC000819039379	GE	On-Demand	Anodyne	SIGMAR1	20	40
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@H](O)c3ccccc3F)c2)C1	ZINC000819039381	GE	On-Demand	Anodyne	SLC6A1	104	39
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@H](O)c3ccccc3F)c2)C1	ZINC000819039381	GE	On-Demand	Anodyne	SIGMAR1	20	40
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@H](O)c3ccccc3F)c2)C1	ZINC000819039383	GE	On-Demand	Anodyne	SLC6A1	104	39
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@H](O)c3ccccc3F)c2)C1	ZINC000819039383	GE	On-Demand	Anodyne	SIGMAR1	20	40
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3ccccc3F)c2)C1	ZINC000819039386	GE	On-Demand	Anodyne	SLC6A1	104	39
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3ccccc3F)c2)C1	ZINC000819039386	GE	On-Demand	Anodyne	SIGMAR1	20	40
CN(Cc1ccc(N2CCCCC2)cc1)C(=O)Cc1nsc2ccccc12	ZINC000819039412	GI	On-Demand	Clean	HTR1A	17	41
CN(Cc1ccc(N2CCCCC2)cc1)C(=O)Cc1nsc2ccccc12	ZINC000819039412	GI	On-Demand	Clean	DRD2	19	41
O[C@@H](CN[C@H]1CCN(CC2CC2)C1)c1ccccc1Cl	ZINC000819039442	CE	On-Demand	Anodyne	SIGMAR1	17	44
O[C@@H](CN[C@@H]1CCN(CC2CC2)C1)c1ccccc1Cl	ZINC000819039443	CE	On-Demand	Anodyne	SIGMAR1	17	44
COc1cccc(C2(CNC[C@H](O)c3ccc([N+](=O)[O-])cc3)CCCC2)c1	ZINC000819039448	FH	On-Demand	Bother	NMBR	51	36
COc1cccc(C2(CNC[C@@H](O)c3ccc([N+](=O)[O-])cc3)CCCC2)c1	ZINC000819039449	FH	On-Demand	Bother	NMBR	51	36
N#Cc1ccc([C@H](O)CNCc2cccc(CN3CCC[C@H](C(N)=O)C3)c2)cc1	ZINC000819039608	GE	On-Demand	Mild	DPP7	18	44
N#Cc1ccc([C@H](O)CNCc2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)cc1	ZINC000819039612	GE	On-Demand	Mild	DPP7	18	44
N#Cc1ccc([C@@H](O)CNCc2cccc(CN3CCC[C@H](C(N)=O)C3)c2)cc1	ZINC000819039613	GE	On-Demand	Mild	DPP7	18	44
N#Cc1ccc([C@@H](O)CNCc2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)cc1	ZINC000819039616	GE	On-Demand	Mild	DPP7	18	44
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@H](O)C1CC1)CC2	ZINC000819039623	FD	On-Demand	Anodyne	SLC18A2	46	31
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@H](O)C1CC1)CC2	ZINC000819039623	FD	On-Demand	Anodyne	ABCB1	17	46
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1ccccc1F	ZINC000819039624	FF	On-Demand	Anodyne	ADRB1	52	36
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1ccccc1F	ZINC000819039624	FF	On-Demand	Anodyne	ADRB3	19	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1ccccc1F	ZINC000819039624	FF	On-Demand	Anodyne	ABCB1	34	41
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@@H](O)C1CC1)CC2	ZINC000819039625	FD	On-Demand	Anodyne	SLC18A2	46	31
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@@H](O)C1CC1)CC2	ZINC000819039625	FD	On-Demand	Anodyne	ABCB1	17	46
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)COc1ccccc1F	ZINC000819039626	FF	On-Demand	Anodyne	ADRB1	52	36
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)COc1ccccc1F	ZINC000819039626	FF	On-Demand	Anodyne	ADRB3	19	40
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)COc1ccccc1F	ZINC000819039626	FF	On-Demand	Anodyne	ABCB1	34	41
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1ccccc1F	ZINC000819039629	FF	On-Demand	Anodyne	ADRB1	52	36
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1ccccc1F	ZINC000819039629	FF	On-Demand	Anodyne	ADRB3	19	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1ccccc1F	ZINC000819039629	FF	On-Demand	Anodyne	ABCB1	34	41
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)COc1ccccc1F	ZINC000819039631	FF	On-Demand	Anodyne	ADRB1	52	36
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)COc1ccccc1F	ZINC000819039631	FF	On-Demand	Anodyne	ADRB3	19	40
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)COc1ccccc1F	ZINC000819039631	FF	On-Demand	Anodyne	ABCB1	34	41
C=CCC1(C(=O)Oc2ccc(C(=O)OCC)cc2)CCOCC1	ZINC000819039652	DG	On-Demand	Mild	ACR	38	43
COc1cccc([S@@](=O)CC(=O)Oc2ccc(N3CCCC3=O)cc2)c1	ZINC000819039663	FF	On-Demand	Anodyne	DRD4	41	33
CCOc1ccccc1COC(=O)CSc1ccccc1[N+](=O)[O-]	ZINC000819039669	EH	On-Demand	Bother	COLA	89	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccnn1Cc1ccccc1	ZINC000819039675	FF	On-Demand	Anodyne	FPR1	43	35
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1ccccc1	ZINC000819039699	FE	On-Demand	Anodyne	ADRB2	53	45
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1ccccc1	ZINC000819039699	FE	On-Demand	Anodyne	ADRB1	78	43
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1ccccc1	ZINC000819039699	FE	On-Demand	Anodyne	ADRB3	57	43
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1ccccc1	ZINC000819039699	FE	On-Demand	Anodyne	CPT1A	83	35
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1ccccc1	ZINC000819039699	FE	On-Demand	Anodyne	AMY2	44	31
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1ccccc1	ZINC000819039699	FE	On-Demand	Anodyne	WNT3	51	37
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1ccccc1	ZINC000819039700	FE	On-Demand	Anodyne	ADRB2	53	45
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1ccccc1	ZINC000819039700	FE	On-Demand	Anodyne	ADRB1	78	43
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1ccccc1	ZINC000819039700	FE	On-Demand	Anodyne	ADRB3	57	43
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1ccccc1	ZINC000819039700	FE	On-Demand	Anodyne	CPT1A	83	35
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1ccccc1	ZINC000819039700	FE	On-Demand	Anodyne	AMY2	44	31
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1ccccc1	ZINC000819039700	FE	On-Demand	Anodyne	WNT3	51	37
O[C@@H](CN[C@@H]1CCN(CC2CC2)C1)c1cccnc1	ZINC000819039769	CD	On-Demand	Anodyne	ADRB3	59	49
O[C@@H](CN[C@H]1CCN(CC2CC2)C1)c1cccnc1	ZINC000819039770	CD	On-Demand	Anodyne	ADRB3	59	49
O[C@H](CN[C@@H]1CCN(CC2CC2)C1)c1cccnc1	ZINC000819039771	CD	On-Demand	Anodyne	ADRB3	59	49
O[C@H](CN[C@H]1CCN(CC2CC2)C1)c1cccnc1	ZINC000819039772	CD	On-Demand	Anodyne	ADRB3	59	49
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@H](O)c1cccnc1)CC2	ZINC000819039785	GE	On-Demand	Anodyne	ADRB2	28	41
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@H](O)c1cccnc1)CC2	ZINC000819039785	GE	On-Demand	Anodyne	ADRB1	34	48
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@H](O)c1cccnc1)CC2	ZINC000819039785	GE	On-Demand	Anodyne	ADRB3	103	48
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@H](O)c1cccnc1)CC2	ZINC000819039785	GE	On-Demand	Anodyne	PTAFR	19	41
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@H](O)c1cccnc1)CC2	ZINC000819039785	GE	On-Demand	Anodyne	ABCB1	20	43
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@H](O)c1cccnc1)CC2	ZINC000819039785	GE	On-Demand	Anodyne	HCRTR2	15	53
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@@H](O)c1cccnc1)CC2	ZINC000819039786	GE	On-Demand	Anodyne	ADRB2	28	41
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@@H](O)c1cccnc1)CC2	ZINC000819039786	GE	On-Demand	Anodyne	ADRB1	34	48
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@@H](O)c1cccnc1)CC2	ZINC000819039786	GE	On-Demand	Anodyne	ADRB3	103	48
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@@H](O)c1cccnc1)CC2	ZINC000819039786	GE	On-Demand	Anodyne	PTAFR	19	41
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@@H](O)c1cccnc1)CC2	ZINC000819039786	GE	On-Demand	Anodyne	ABCB1	20	43
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@@H](O)c1cccnc1)CC2	ZINC000819039786	GE	On-Demand	Anodyne	HCRTR2	15	53
CON(C)C(=O)CCNCc1ccc(N2CCC(C)CC2)cc1	ZINC000819039796	DE	On-Demand	Clean	DPP7	23	41
O[C@@H](CN[C@@H]1CCN(CC2CC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819039828	EF	On-Demand	Anodyne	ADRB3	15	40
O[C@@H](CN[C@@H]1CCN(CC2CC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819039828	EF	On-Demand	Anodyne	CCR2	40	41
O[C@@H](CN[C@H]1CCN(CC2CC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819039829	EF	On-Demand	Anodyne	ADRB3	15	40
O[C@@H](CN[C@H]1CCN(CC2CC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819039829	EF	On-Demand	Anodyne	CCR2	40	41
O[C@H](CN[C@@H]1CCN(CC2CC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819039830	EF	On-Demand	Anodyne	ADRB3	15	40
O[C@H](CN[C@@H]1CCN(CC2CC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819039830	EF	On-Demand	Anodyne	CCR2	40	41
O[C@H](CN[C@H]1CCN(CC2CC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819039831	EF	On-Demand	Anodyne	ADRB3	15	40
O[C@H](CN[C@H]1CCN(CC2CC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819039831	EF	On-Demand	Anodyne	CCR2	40	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccccc1N1CCCC1=O	ZINC000819039839	FF	On-Demand	Anodyne	KCNQ2	65	38
O[C@@H](CNCCOCC1CC1)c1cccc(Cl)c1	ZINC000819039870	CE	On-Demand	Anodyne	ADRB2	52	44
O[C@@H](CNCCOCC1CC1)c1cccc(Cl)c1	ZINC000819039870	CE	On-Demand	Anodyne	ADRB1	66	48
O[C@@H](CNCCOCC1CC1)c1cccc(Cl)c1	ZINC000819039870	CE	On-Demand	Anodyne	ADRB3	70	48
O[C@@H](CNCCOCC1CC1)c1cccc(Cl)c1	ZINC000819039870	CE	On-Demand	Anodyne	CYP3A4	42	33
O[C@H](CNCCOCC1CC1)c1cccc(Cl)c1	ZINC000819039872	CE	On-Demand	Anodyne	ADRB2	52	44
O[C@H](CNCCOCC1CC1)c1cccc(Cl)c1	ZINC000819039872	CE	On-Demand	Anodyne	ADRB1	66	48
O[C@H](CNCCOCC1CC1)c1cccc(Cl)c1	ZINC000819039872	CE	On-Demand	Anodyne	ADRB3	70	48
O[C@H](CNCCOCC1CC1)c1cccc(Cl)c1	ZINC000819039872	CE	On-Demand	Anodyne	CYP3A4	42	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccccc1-c1ccccc1)C2	ZINC000819039893	FI	On-Demand	Anodyne	CHRM3	15	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccccc1-c1ccccc1)C2	ZINC000819039910	FI	On-Demand	Anodyne	CHRM3	15	45
O[C@@H](CN[C@H]1CCN(CC2CC2)C1)c1ccc(F)c(F)c1	ZINC000819039928	CE	On-Demand	Anodyne	ADRB3	18	40
O[C@@H](CN[C@@H]1CCN(CC2CC2)C1)c1ccc(F)c(F)c1	ZINC000819039931	CE	On-Demand	Anodyne	ADRB3	18	40
O[C@H](CN[C@@H]1CCN(CC2CC2)C1)c1ccc(F)c(F)c1	ZINC000819039934	CE	On-Demand	Anodyne	ADRB3	18	40
Cc1nc2cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc2o1	ZINC000819039935	FH	On-Demand	Mild	PAPA1_CARPA	38	40
O[C@H](CN[C@H]1CCN(CC2CC2)C1)c1ccc(F)c(F)c1	ZINC000819039937	CE	On-Demand	Anodyne	ADRB3	18	40
Cc1nc2cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc2o1	ZINC000819039939	FH	On-Demand	Mild	PAPA1_CARPA	38	40
COc1cccc(C2(CNC[C@H](O)c3cccnc3)CCCC2)c1	ZINC000819039971	EG	On-Demand	Anodyne	ADRB1	24	43
COc1cccc(C2(CNC[C@H](O)c3cccnc3)CCCC2)c1	ZINC000819039971	EG	On-Demand	Anodyne	ADRB3	83	43
COc1cccc(C2(CNC[C@@H](O)c3cccnc3)CCCC2)c1	ZINC000819039973	EG	On-Demand	Anodyne	ADRB1	24	43
COc1cccc(C2(CNC[C@@H](O)c3cccnc3)CCCC2)c1	ZINC000819039973	EG	On-Demand	Anodyne	ADRB3	83	43
O=C1NCCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819040013	BC	On-Demand	Anodyne	ADRB2	21	40
O=C1NCCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819040013	BC	On-Demand	Anodyne	ADRB1	22	42
O=C1NCCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819040013	BC	On-Demand	Anodyne	ADRB3	93	43
O=C1NCCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819040014	BC	On-Demand	Anodyne	ADRB2	21	40
O=C1NCCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819040014	BC	On-Demand	Anodyne	ADRB1	22	42
O=C1NCCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819040014	BC	On-Demand	Anodyne	ADRB3	93	43
O=C1NCCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819040015	BC	On-Demand	Anodyne	ADRB2	21	40
O=C1NCCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819040015	BC	On-Demand	Anodyne	ADRB1	22	42
O=C1NCCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819040015	BC	On-Demand	Anodyne	ADRB3	93	43
O=C1NCCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819040017	BC	On-Demand	Anodyne	ADRB2	21	40
O=C1NCCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819040017	BC	On-Demand	Anodyne	ADRB1	22	42
O=C1NCCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819040017	BC	On-Demand	Anodyne	ADRB3	93	43
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040024	DE	On-Demand	Anodyne	CHRM2	17	42
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040024	DE	On-Demand	Anodyne	DRD4	48	54
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040024	DE	On-Demand	Anodyne	ACHE	30	46
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040024	DE	On-Demand	Anodyne	CHRM3	22	42
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040024	DE	On-Demand	Anodyne	SIGMAR1	44	55
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040024	DE	On-Demand	Anodyne	CCR3	33	51
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040024	DE	On-Demand	Anodyne	UTS2R	19	40
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040024	DE	On-Demand	Anodyne	CCR2	18	44
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040024	DE	On-Demand	Anodyne	MCHR1	23	52
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040024	DE	On-Demand	Anodyne	BIRC2	20	41
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040025	DE	On-Demand	Anodyne	CHRM2	17	42
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040025	DE	On-Demand	Anodyne	DRD4	48	54
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040025	DE	On-Demand	Anodyne	ACHE	30	46
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040025	DE	On-Demand	Anodyne	CHRM3	22	42
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040025	DE	On-Demand	Anodyne	SIGMAR1	44	55
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040025	DE	On-Demand	Anodyne	CCR3	33	51
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040025	DE	On-Demand	Anodyne	UTS2R	19	40
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040025	DE	On-Demand	Anodyne	CCR2	18	44
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040025	DE	On-Demand	Anodyne	MCHR1	23	52
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040025	DE	On-Demand	Anodyne	BIRC2	20	41
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040026	DE	On-Demand	Anodyne	CHRM2	17	42
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040026	DE	On-Demand	Anodyne	DRD4	48	54
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040026	DE	On-Demand	Anodyne	ACHE	30	46
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040026	DE	On-Demand	Anodyne	CHRM3	22	42
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040026	DE	On-Demand	Anodyne	SIGMAR1	44	55
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040026	DE	On-Demand	Anodyne	CCR3	33	51
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040026	DE	On-Demand	Anodyne	UTS2R	19	40
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040026	DE	On-Demand	Anodyne	CCR2	18	44
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040026	DE	On-Demand	Anodyne	MCHR1	23	52
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000819040026	DE	On-Demand	Anodyne	BIRC2	20	41
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040027	DE	On-Demand	Anodyne	CHRM2	17	42
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040027	DE	On-Demand	Anodyne	DRD4	48	54
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040027	DE	On-Demand	Anodyne	ACHE	30	46
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040027	DE	On-Demand	Anodyne	CHRM3	22	42
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040027	DE	On-Demand	Anodyne	SIGMAR1	44	55
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040027	DE	On-Demand	Anodyne	CCR3	33	51
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040027	DE	On-Demand	Anodyne	UTS2R	19	40
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040027	DE	On-Demand	Anodyne	CCR2	18	44
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040027	DE	On-Demand	Anodyne	MCHR1	23	52
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819040027	DE	On-Demand	Anodyne	BIRC2	20	41
COc1cc2c(cc1OC)CN(C(=O)CCCNCCS(C)(=O)=O)CC2	ZINC000819040033	GD	On-Demand	Anodyne	ABCB1	18	48
O=C(/C=C/[C@H]1CCCO1)Nc1nccs1	ZINC000819040037	BD	On-Demand	Anodyne	MAP1	92	41
O=C(/C=C/[C@@H]1CCCO1)Nc1nccs1	ZINC000819040040	BD	On-Demand	Anodyne	MAP1	92	41
O=C(/C=C\[C@H]1CCCO1)Nc1nccs1	ZINC000819040042	BD	On-Demand	Anodyne	MAP1	92	41
O=C(/C=C\[C@@H]1CCCO1)Nc1nccs1	ZINC000819040043	BD	On-Demand	Anodyne	MAP1	92	41
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)c1ccc(Cl)cc1	ZINC000819040056	FG	On-Demand	Anodyne	ADRB3	26	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819040057	GF	On-Demand	Anodyne	ADRB2	23	54
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819040057	GF	On-Demand	Anodyne	ADRB1	30	54
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819040057	GF	On-Demand	Anodyne	HTR1A	15	54
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819040057	GF	On-Demand	Anodyne	SSTR2	40	35
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819040057	GF	On-Demand	Anodyne	SLC6A4	19	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819040057	GF	On-Demand	Anodyne	ADRB3	19	54
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819040058	GF	On-Demand	Anodyne	ADRB2	23	54
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819040058	GF	On-Demand	Anodyne	ADRB1	30	54
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819040058	GF	On-Demand	Anodyne	HTR1A	15	54
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819040058	GF	On-Demand	Anodyne	SSTR2	40	35
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819040058	GF	On-Demand	Anodyne	SLC6A4	19	40
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819040058	GF	On-Demand	Anodyne	ADRB3	19	54
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819040059	GF	On-Demand	Anodyne	ADRB2	23	54
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819040059	GF	On-Demand	Anodyne	ADRB1	30	54
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819040059	GF	On-Demand	Anodyne	HTR1A	15	54
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819040059	GF	On-Demand	Anodyne	SSTR2	40	35
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819040059	GF	On-Demand	Anodyne	SLC6A4	19	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819040059	GF	On-Demand	Anodyne	ADRB3	19	54
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819040060	GF	On-Demand	Anodyne	ADRB2	23	54
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819040060	GF	On-Demand	Anodyne	ADRB1	30	54
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819040060	GF	On-Demand	Anodyne	HTR1A	15	54
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819040060	GF	On-Demand	Anodyne	SSTR2	40	35
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819040060	GF	On-Demand	Anodyne	SLC6A4	19	40
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819040060	GF	On-Demand	Anodyne	ADRB3	19	54
C=CCC1(C(=O)Oc2ccc(NC(=O)c3ccccc3OC)cc2)CCOCC1	ZINC000819040068	GI	On-Demand	Mild	KCNA3	46	41
C=CCC1(C(=O)Oc2ccc(NC(=O)c3ccccc3OC)cc2)CCOCC1	ZINC000819040068	GI	On-Demand	Mild	KCNK3	55	44
C=CCC1(C(=O)Oc2ccc(NC(=O)c3ccccc3OC)cc2)CCOCC1	ZINC000819040068	GI	On-Demand	Mild	KCNK9	50	44
O=C(CSc1ccccc1[N+](=O)[O-])OCc1cccc(C(F)(F)F)c1	ZINC000819040074	FI	On-Demand	Bother	COLA	15	41
O=C(CSc1ccccc1[N+](=O)[O-])OCc1cccc(C(F)(F)F)c1	ZINC000819040074	FI	On-Demand	Bother	PDS	43	36
CC(C)(C)OC(=O)N1CCC[C@H]1CNCCS(=O)(=O)c1ccc(F)cc1	ZINC000819040077	GF	On-Demand	Anodyne	WNT3	53	38
CC(C)(C)OC(=O)N1CCC[C@@H]1CNCCS(=O)(=O)c1ccc(F)cc1	ZINC000819040078	GF	On-Demand	Anodyne	WNT3	53	38
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)Cc1ccc(F)cc1	ZINC000819040115	FF	On-Demand	Anodyne	MC4R	15	45
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)Cc1ccc(F)cc1	ZINC000819040118	FF	On-Demand	Anodyne	MC4R	15	45
CO[C@@]1(C(=O)NNC(=S)Nc2cccc(C)c2)CCOC1	ZINC000819040119	DD	On-Demand	Reactive	KCNK3	59	37
CO[C@@]1(C(=O)NNC(=S)Nc2cccc(C)c2)CCOC1	ZINC000819040119	DD	On-Demand	Reactive	KCNK9	46	37
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819040121	FF	On-Demand	Anodyne	MC4R	15	45
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819040125	FF	On-Demand	Anodyne	MC4R	15	45
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1ccccc1Cl	ZINC000819040126	GG	On-Demand	Anodyne	ADRB2	28	46
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1ccccc1Cl	ZINC000819040126	GG	On-Demand	Anodyne	ADRB1	42	37
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)COc1ccccc1Cl	ZINC000819040126	GG	On-Demand	Anodyne	ABCB1	39	41
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)COc1ccccc1Cl	ZINC000819040127	GG	On-Demand	Anodyne	ADRB2	28	46
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)COc1ccccc1Cl	ZINC000819040127	GG	On-Demand	Anodyne	ADRB1	42	37
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)COc1ccccc1Cl	ZINC000819040127	GG	On-Demand	Anodyne	ABCB1	39	41
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1ccccc1Cl	ZINC000819040129	GG	On-Demand	Anodyne	ADRB2	28	46
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1ccccc1Cl	ZINC000819040129	GG	On-Demand	Anodyne	ADRB1	42	37
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)COc1ccccc1Cl	ZINC000819040129	GG	On-Demand	Anodyne	ABCB1	39	41
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)COc1ccccc1Cl	ZINC000819040132	GG	On-Demand	Anodyne	ADRB2	28	46
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)COc1ccccc1Cl	ZINC000819040132	GG	On-Demand	Anodyne	ADRB1	42	37
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)COc1ccccc1Cl	ZINC000819040132	GG	On-Demand	Anodyne	ABCB1	39	41
CC(=O)c1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819040135	FG	On-Demand	Mild	PAPA1_CARPA	51	47
CC(=O)c1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819040135	FG	On-Demand	Mild	CCKAR	18	42
CC(=O)c1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819040135	FG	On-Demand	Mild	CTSK	19	45
CC(=O)c1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819040135	FG	On-Demand	Mild	FPR1	43	38
CC(=O)c1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819040137	FG	On-Demand	Mild	PAPA1_CARPA	51	47
CC(=O)c1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819040137	FG	On-Demand	Mild	CCKAR	18	42
CC(=O)c1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819040137	FG	On-Demand	Mild	CTSK	19	45
CC(=O)c1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819040137	FG	On-Demand	Mild	FPR1	43	38
COc1ccc(OC)c([C@H](O)CNCCc2ccc(Br)cc2F)c1	ZINC000819040145	GG	On-Demand	Anodyne	ADRB2	21	49
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCC2CC2)c1	ZINC000819040156	CD	On-Demand	Bother	ADRB1	42	37
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCC2CC2)c1	ZINC000819040156	CD	On-Demand	Bother	CACNA1C	31	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCC2CC2)c1	ZINC000819040156	CD	On-Demand	Bother	ADRB3	43	37
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCC2CC2)c1	ZINC000819040156	CD	On-Demand	Bother	CACNA1D	43	40
O=[N+]([O-])c1cccc([C@H](O)CNCCOCC2CC2)c1	ZINC000819040158	CD	On-Demand	Bother	ADRB1	42	37
O=[N+]([O-])c1cccc([C@H](O)CNCCOCC2CC2)c1	ZINC000819040158	CD	On-Demand	Bother	CACNA1C	31	40
O=[N+]([O-])c1cccc([C@H](O)CNCCOCC2CC2)c1	ZINC000819040158	CD	On-Demand	Bother	ADRB3	43	37
O=[N+]([O-])c1cccc([C@H](O)CNCCOCC2CC2)c1	ZINC000819040158	CD	On-Demand	Bother	CACNA1D	43	40
C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819040163	GD	On-Demand	Anodyne	CA2	18	42
C#CCNC(=O)CCNCc1ccc(N2CCC(C)CC2)cc1	ZINC000819040195	DE	On-Demand	Mild	DPP7	28	41
CCOC(=O)CC[C@H](O)CNCc1ccc(N2CCC(C)CC2)cc1	ZINC000819040260	EF	On-Demand	Clean	DPP7	25	44
CCOC(=O)CC[C@@H](O)CNCc1ccc(N2CCC(C)CC2)cc1	ZINC000819040261	EF	On-Demand	Clean	DPP7	25	44
O=C(Nc1ccccc1N1CCCC1=O)C(F)=C1CCC1	ZINC000819040269	CG	On-Demand	Anodyne	KCNQ2	65	37
O[C@@H](CN[C@H]1CCN(CC2CC2)C1)c1ccc(Cl)c(F)c1	ZINC000819040277	DF	On-Demand	Anodyne	ADRB3	19	41
O[C@@H](CN[C@@H]1CCN(CC2CC2)C1)c1ccc(Cl)c(F)c1	ZINC000819040278	DF	On-Demand	Anodyne	ADRB3	19	41
O[C@H](CN[C@@H]1CCN(CC2CC2)C1)c1ccc(Cl)c(F)c1	ZINC000819040279	DF	On-Demand	Anodyne	ADRB3	19	41
O[C@H](CN[C@H]1CCN(CC2CC2)C1)c1ccc(Cl)c(F)c1	ZINC000819040280	DF	On-Demand	Anodyne	ADRB3	19	41
COc1cccc(C2(CNCCC(=O)N(C)OC)CCCC2)c1	ZINC000819040284	DF	On-Demand	Anodyne	DRD4	40	31
O[C@@H](CN[C@@H]1CCN(CC2CC2)C1)c1cccc(Cl)c1	ZINC000819040310	CE	On-Demand	Anodyne	ADRB1	34	44
O[C@@H](CN[C@@H]1CCN(CC2CC2)C1)c1cccc(Cl)c1	ZINC000819040310	CE	On-Demand	Anodyne	ADRB3	52	50
O[C@@H](CN[C@@H]1CCN(CC2CC2)C1)c1cccc(Cl)c1	ZINC000819040310	CE	On-Demand	Anodyne	CYP3A4	46	37
O[C@@H](CN[C@H]1CCN(CC2CC2)C1)c1cccc(Cl)c1	ZINC000819040311	CE	On-Demand	Anodyne	ADRB1	34	44
O[C@@H](CN[C@H]1CCN(CC2CC2)C1)c1cccc(Cl)c1	ZINC000819040311	CE	On-Demand	Anodyne	ADRB3	52	50
O[C@@H](CN[C@H]1CCN(CC2CC2)C1)c1cccc(Cl)c1	ZINC000819040311	CE	On-Demand	Anodyne	CYP3A4	46	37
O[C@H](CN[C@@H]1CCN(CC2CC2)C1)c1cccc(Cl)c1	ZINC000819040312	CE	On-Demand	Anodyne	ADRB1	34	44
O[C@H](CN[C@@H]1CCN(CC2CC2)C1)c1cccc(Cl)c1	ZINC000819040312	CE	On-Demand	Anodyne	ADRB3	52	50
O[C@H](CN[C@@H]1CCN(CC2CC2)C1)c1cccc(Cl)c1	ZINC000819040312	CE	On-Demand	Anodyne	CYP3A4	46	37
O[C@H](CN[C@H]1CCN(CC2CC2)C1)c1cccc(Cl)c1	ZINC000819040313	CE	On-Demand	Anodyne	ADRB1	34	44
O[C@H](CN[C@H]1CCN(CC2CC2)C1)c1cccc(Cl)c1	ZINC000819040313	CE	On-Demand	Anodyne	ADRB3	52	50
O[C@H](CN[C@H]1CCN(CC2CC2)C1)c1cccc(Cl)c1	ZINC000819040313	CE	On-Demand	Anodyne	CYP3A4	46	37
O=C(NNC(=S)Nc1cccc(Cl)c1)[C@@H]1CCCO[C@H]1c1ccccc1	ZINC000819040316	GH	On-Demand	Reactive	F13A1	15	41
CC(C)(C)OC(=O)N1CCC[C@H]1CNCCS(=O)(=O)c1cccc(C#N)c1	ZINC000819040341	GE	On-Demand	Mild	WNT3	41	37
CC(C)(C)OC(=O)N1CCC[C@@H]1CNCCS(=O)(=O)c1cccc(C#N)c1	ZINC000819040343	GE	On-Demand	Mild	WNT3	41	37
CCCOc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819040352	EF	On-Demand	Bother	ADRB1	19	41
CCCOc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819040352	EF	On-Demand	Bother	ADRB3	29	41
CCCOc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819040352	EF	On-Demand	Bother	CACNA1D	58	33
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@H](O)c3cccc(F)c3)c2)C1	ZINC000819040353	GE	On-Demand	Anodyne	SLC6A1	78	43
CCCOc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819040354	EF	On-Demand	Bother	ADRB1	19	41
CCCOc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819040354	EF	On-Demand	Bother	ADRB3	29	41
CCCOc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819040354	EF	On-Demand	Bother	CACNA1D	58	33
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@H](O)c3cccc(F)c3)c2)C1	ZINC000819040355	GE	On-Demand	Anodyne	SLC6A1	78	43
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3cccc(F)c3)c2)C1	ZINC000819040357	GE	On-Demand	Anodyne	SLC6A1	78	43
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3cccc(F)c3)c2)C1	ZINC000819040359	GE	On-Demand	Anodyne	SLC6A1	78	43
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)CCc1ccccc1	ZINC000819040365	EF	On-Demand	Anodyne	ACE	59	44
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)CCc1ccccc1	ZINC000819040365	EF	On-Demand	Anodyne	FKBP1A	52	43
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)CCc1ccccc1	ZINC000819040365	EF	On-Demand	Anodyne	OPRM1	15	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)CCc1ccccc1	ZINC000819040365	EF	On-Demand	Anodyne	GHRHR	41	31
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)CCc1ccccc1	ZINC000819040365	EF	On-Demand	Anodyne	SLC18A2	46	38
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)CCc1ccccc1	ZINC000819040365	EF	On-Demand	Anodyne	MME	15	44
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)CCc1ccccc1	ZINC000819040365	EF	On-Demand	Anodyne	PREP	72	38
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)CCc1ccccc1	ZINC000819040365	EF	On-Demand	Anodyne	REN	52	41
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)CCc1ccccc1	ZINC000819040365	EF	On-Demand	Anodyne	ACE2	27	41
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)CCc1ccccc1	ZINC000819040365	EF	On-Demand	Anodyne	WNT3	41	37
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)CCc1ccccc1	ZINC000819040365	EF	On-Demand	Anodyne	BRCA1	46	34
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)CCc1ccccc1	ZINC000819040367	EF	On-Demand	Anodyne	ACE	59	44
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)CCc1ccccc1	ZINC000819040367	EF	On-Demand	Anodyne	FKBP1A	52	43
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)CCc1ccccc1	ZINC000819040367	EF	On-Demand	Anodyne	OPRM1	15	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)CCc1ccccc1	ZINC000819040367	EF	On-Demand	Anodyne	GHRHR	41	31
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)CCc1ccccc1	ZINC000819040367	EF	On-Demand	Anodyne	SLC18A2	46	38
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)CCc1ccccc1	ZINC000819040367	EF	On-Demand	Anodyne	MME	15	44
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)CCc1ccccc1	ZINC000819040367	EF	On-Demand	Anodyne	PREP	72	38
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)CCc1ccccc1	ZINC000819040367	EF	On-Demand	Anodyne	REN	52	41
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)CCc1ccccc1	ZINC000819040367	EF	On-Demand	Anodyne	ACE2	27	41
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)CCc1ccccc1	ZINC000819040367	EF	On-Demand	Anodyne	WNT3	41	37
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)CCc1ccccc1	ZINC000819040367	EF	On-Demand	Anodyne	BRCA1	46	34
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)Nc3ccc(C#N)cc3)nn2)C1	ZINC000819040369	GF	On-Demand	Mild	GPR119	20	41
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)Nc3ccc(C#N)cc3)nn2)C1	ZINC000819040371	GF	On-Demand	Mild	GPR119	20	41
O[C@@H](CNCCc1ccc(Br)cc1F)COCc1ccccc1	ZINC000819040380	GG	On-Demand	Anodyne	ADRB2	33	42
O[C@@H](CNCCc1ccc(Br)cc1F)COCc1ccccc1	ZINC000819040380	GG	On-Demand	Anodyne	ADRB1	49	42
O[C@@H](CNCCc1ccc(Br)cc1F)COCc1ccccc1	ZINC000819040380	GG	On-Demand	Anodyne	ADRB3	39	42
CCCOc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cn1	ZINC000819040381	DG	On-Demand	Anodyne	ADRB2	23	42
CCCOc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cn1	ZINC000819040381	DG	On-Demand	Anodyne	ADRB1	43	52
CCCOc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cn1	ZINC000819040381	DG	On-Demand	Anodyne	ADRB3	58	52
O[C@H](CNCCc1ccc(Br)cc1F)COCc1ccccc1	ZINC000819040382	GG	On-Demand	Anodyne	ADRB2	33	42
O[C@H](CNCCc1ccc(Br)cc1F)COCc1ccccc1	ZINC000819040382	GG	On-Demand	Anodyne	ADRB1	49	42
O[C@H](CNCCc1ccc(Br)cc1F)COCc1ccccc1	ZINC000819040382	GG	On-Demand	Anodyne	ADRB3	39	42
CCCOc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cn1	ZINC000819040383	DG	On-Demand	Anodyne	ADRB2	23	42
CCCOc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cn1	ZINC000819040383	DG	On-Demand	Anodyne	ADRB1	43	52
CCCOc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cn1	ZINC000819040383	DG	On-Demand	Anodyne	ADRB3	58	52
O[C@H](CNCCOCC1CC1)c1cccnc1	ZINC000819040385	BD	On-Demand	Anodyne	ADRB2	30	51
O[C@H](CNCCOCC1CC1)c1cccnc1	ZINC000819040385	BD	On-Demand	Anodyne	ADRB1	40	51
O[C@H](CNCCOCC1CC1)c1cccnc1	ZINC000819040385	BD	On-Demand	Anodyne	ADRB3	108	53
O[C@@H](CNCCOCC1CC1)c1cccnc1	ZINC000819040386	BD	On-Demand	Anodyne	ADRB2	30	51
O[C@@H](CNCCOCC1CC1)c1cccnc1	ZINC000819040386	BD	On-Demand	Anodyne	ADRB1	40	51
O[C@@H](CNCCOCC1CC1)c1cccnc1	ZINC000819040386	BD	On-Demand	Anodyne	ADRB3	108	53
NC(=O)c1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819040402	CD	On-Demand	Anodyne	KCNK3	54	36
NC(=O)c1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819040404	CD	On-Demand	Anodyne	KCNK3	54	36
NC(=O)c1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819040406	CD	On-Demand	Anodyne	KCNK3	54	36
NC(=O)c1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819040408	CD	On-Demand	Anodyne	KCNK3	54	36
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819040413	GF	On-Demand	Anodyne	ADRB2	20	42
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819040413	GF	On-Demand	Anodyne	ABCB1	21	47
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819040415	GF	On-Demand	Anodyne	ADRB2	20	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819040415	GF	On-Demand	Anodyne	ABCB1	21	47
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819040416	GF	On-Demand	Anodyne	ADRB2	20	42
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819040416	GF	On-Demand	Anodyne	ABCB1	21	47
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819040418	GF	On-Demand	Anodyne	ADRB2	20	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819040418	GF	On-Demand	Anodyne	ABCB1	21	47
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819040438	DE	On-Demand	Anodyne	ADRB1	26	41
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819040438	DE	On-Demand	Anodyne	ADRB3	93	43
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819040439	DE	On-Demand	Anodyne	ADRB1	26	41
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819040439	DE	On-Demand	Anodyne	ADRB3	93	43
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819040441	DE	On-Demand	Anodyne	ADRB1	26	41
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819040441	DE	On-Demand	Anodyne	ADRB3	93	43
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819040443	DE	On-Demand	Anodyne	ADRB1	26	41
CC(C)(C)OC(=O)N1CCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819040443	DE	On-Demand	Anodyne	ADRB3	93	43
O[C@@H](CNCCc1ccc(Br)cc1F)COc1ccccc1	ZINC000819040474	FG	On-Demand	Anodyne	ADRB2	64	56
O[C@@H](CNCCc1ccc(Br)cc1F)COc1ccccc1	ZINC000819040474	FG	On-Demand	Anodyne	ADRB1	100	56
O[C@@H](CNCCc1ccc(Br)cc1F)COc1ccccc1	ZINC000819040474	FG	On-Demand	Anodyne	GRIN1	20	58
O[C@@H](CNCCc1ccc(Br)cc1F)COc1ccccc1	ZINC000819040474	FG	On-Demand	Anodyne	ADRB3	67	56
O[C@H](CNCCc1ccc(Br)cc1F)COc1ccccc1	ZINC000819040476	FG	On-Demand	Anodyne	ADRB2	64	56
O[C@H](CNCCc1ccc(Br)cc1F)COc1ccccc1	ZINC000819040476	FG	On-Demand	Anodyne	ADRB1	100	56
O[C@H](CNCCc1ccc(Br)cc1F)COc1ccccc1	ZINC000819040476	FG	On-Demand	Anodyne	GRIN1	20	58
O[C@H](CNCCc1ccc(Br)cc1F)COc1ccccc1	ZINC000819040476	FG	On-Demand	Anodyne	ADRB3	67	56
COc1cc2c(cc1OC)CN(C(=O)CCCNCCC(=O)N(C)OC)CC2	ZINC000819040478	GD	On-Demand	Anodyne	ABCB1	18	48
CS(=O)(=O)c1ccc([C@@H](O)CNCC2CCC(c3ccccc3)CC2)cc1	ZINC000819040480	GH	On-Demand	Anodyne	ADRB2	18	40
CS(=O)(=O)c1ccc([C@@H](O)CNCC2CCC(c3ccccc3)CC2)cc1	ZINC000819040480	GH	On-Demand	Anodyne	ADRB1	15	40
CS(=O)(=O)c1ccc([C@@H](O)CNCC2CCC(c3ccccc3)CC2)cc1	ZINC000819040480	GH	On-Demand	Anodyne	ADRB3	38	40
CS(=O)(=O)c1ccc([C@H](O)CNCC2CCC(c3ccccc3)CC2)cc1	ZINC000819040483	GH	On-Demand	Anodyne	ADRB2	18	40
CS(=O)(=O)c1ccc([C@H](O)CNCC2CCC(c3ccccc3)CC2)cc1	ZINC000819040483	GH	On-Demand	Anodyne	ADRB1	15	40
CS(=O)(=O)c1ccc([C@H](O)CNCC2CCC(c3ccccc3)CC2)cc1	ZINC000819040483	GH	On-Demand	Anodyne	ADRB3	38	40
O[C@@H](CNCCc1ccc(Br)cc1F)c1cccc(F)c1	ZINC000819040512	FH	On-Demand	Anodyne	ADRB2	28	45
O[C@@H](CNCCc1ccc(Br)cc1F)c1cccc(F)c1	ZINC000819040512	FH	On-Demand	Anodyne	ADRB1	26	43
O[C@@H](CNCCc1ccc(Br)cc1F)c1cccc(F)c1	ZINC000819040512	FH	On-Demand	Anodyne	ADRB3	54	43
O[C@H](CNCCc1ccc(Br)cc1F)c1cccc(F)c1	ZINC000819040513	FH	On-Demand	Anodyne	ADRB2	28	45
O[C@H](CNCCc1ccc(Br)cc1F)c1cccc(F)c1	ZINC000819040513	FH	On-Demand	Anodyne	ADRB1	26	43
O[C@H](CNCCc1ccc(Br)cc1F)c1cccc(F)c1	ZINC000819040513	FH	On-Demand	Anodyne	ADRB3	54	43
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@H](O)c3ccc(F)cc3)c2)C1	ZINC000819040520	GE	On-Demand	Anodyne	SLC6A1	81	43
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@H](O)c3ccc(F)cc3)c2)C1	ZINC000819040520	GE	On-Demand	Anodyne	CCR3	61	39
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@H](O)c3ccc(F)cc3)c2)C1	ZINC000819040521	GE	On-Demand	Anodyne	SLC6A1	81	43
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@H](O)c3ccc(F)cc3)c2)C1	ZINC000819040521	GE	On-Demand	Anodyne	CCR3	61	39
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3ccc(F)cc3)c2)C1	ZINC000819040522	GE	On-Demand	Anodyne	SLC6A1	81	43
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3ccc(F)cc3)c2)C1	ZINC000819040522	GE	On-Demand	Anodyne	CCR3	61	39
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3ccc(F)cc3)c2)C1	ZINC000819040523	GE	On-Demand	Anodyne	SLC6A1	81	43
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3ccc(F)cc3)c2)C1	ZINC000819040523	GE	On-Demand	Anodyne	CCR3	61	39
O[C@@H](CNCCOCC1CC1)c1ccc(Cl)c(F)c1	ZINC000819040559	CF	On-Demand	Anodyne	ADRB2	31	42
O[C@@H](CNCCOCC1CC1)c1ccc(Cl)c(F)c1	ZINC000819040559	CF	On-Demand	Anodyne	ADRB1	29	42
O[C@@H](CNCCOCC1CC1)c1ccc(Cl)c(F)c1	ZINC000819040559	CF	On-Demand	Anodyne	ADRB3	24	42
O[C@H](CNCCOCC1CC1)c1ccc(Cl)c(F)c1	ZINC000819040560	CF	On-Demand	Anodyne	ADRB2	31	42
O[C@H](CNCCOCC1CC1)c1ccc(Cl)c(F)c1	ZINC000819040560	CF	On-Demand	Anodyne	ADRB1	29	42
O[C@H](CNCCOCC1CC1)c1ccc(Cl)c(F)c1	ZINC000819040560	CF	On-Demand	Anodyne	ADRB3	24	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1Cc3ccccc3C[C@H]1C(N)=O)C2	ZINC000819040562	FD	On-Demand	Anodyne	OPRD1	42	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1Cc3ccccc3C[C@H]1C(N)=O)C2	ZINC000819040562	FD	On-Demand	Anodyne	CFTR	51	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1Cc3ccccc3C[C@H]1C(N)=O)C2	ZINC000819040562	FD	On-Demand	Anodyne	ADAM9	40	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1Cc3ccccc3C[C@H]1C(N)=O)C2	ZINC000819040563	FD	On-Demand	Anodyne	OPRD1	42	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1Cc3ccccc3C[C@H]1C(N)=O)C2	ZINC000819040563	FD	On-Demand	Anodyne	CFTR	51	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1Cc3ccccc3C[C@H]1C(N)=O)C2	ZINC000819040563	FD	On-Demand	Anodyne	ADAM9	40	32
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCN2C(=O)CNC2=O)CC1	ZINC000819040576	GC	On-Demand	Anodyne	GPR119	28	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCN2C(=O)CNC2=O)CC1	ZINC000819040577	GC	On-Demand	Anodyne	GPR119	28	40
COC[C@@H](O)CNCCc1ccc(Br)cc1F	ZINC000819040580	DD	On-Demand	Anodyne	ADRB1	42	38
COC[C@@H](O)CNCCc1ccc(Br)cc1F	ZINC000819040580	DD	On-Demand	Anodyne	ADRB3	29	40
C=C(Cl)CSc1nc(C)c(CC(=O)Nc2nccs2)s1	ZINC000819040585	EH	On-Demand	Mild	MAP1	101	36
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@H](O)C3CC3)c2)C1	ZINC000819040602	ED	On-Demand	Anodyne	SLC6A1	85	33
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@@H](O)C3CC3)c2)C1	ZINC000819040603	ED	On-Demand	Anodyne	SLC6A1	85	33
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@H](O)C3CC3)c2)C1	ZINC000819040604	ED	On-Demand	Anodyne	SLC6A1	85	33
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@@H](O)C3CC3)c2)C1	ZINC000819040605	ED	On-Demand	Anodyne	SLC6A1	85	33
CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819040607	GG	On-Demand	Mild	CTSB	33	45
CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819040607	GG	On-Demand	Mild	PAPA1_CARPA	55	45
CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819040607	GG	On-Demand	Mild	CTSK	18	41
CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819040608	GG	On-Demand	Mild	CTSB	33	45
CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819040608	GG	On-Demand	Mild	PAPA1_CARPA	55	45
CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819040608	GG	On-Demand	Mild	CTSK	18	41
O[C@@H](CNCCc1ccc(Br)cc1F)c1ccccc1F	ZINC000819040630	FH	On-Demand	Anodyne	ADRB2	19	42
O[C@H](CNCCc1ccc(Br)cc1F)c1ccccc1F	ZINC000819040631	FH	On-Demand	Anodyne	ADRB2	19	42
O[C@@H](CNCCc1ccc(Br)cc1F)c1ccc(F)c(F)c1	ZINC000819040632	FH	On-Demand	Anodyne	ADRB2	27	49
O[C@H](CNCCc1ccc(Br)cc1F)c1ccc(F)c(F)c1	ZINC000819040633	FH	On-Demand	Anodyne	ADRB2	27	49
O=C(CSc1ccccc1[N+](=O)[O-])OCc1ccccc1C(F)(F)F	ZINC000819040635	FI	On-Demand	Bother	COLA	65	37
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@H](O)c1ccccc1)CC2	ZINC000819040636	GF	On-Demand	Anodyne	ADRB1	29	40
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@H](O)c1ccccc1)CC2	ZINC000819040636	GF	On-Demand	Anodyne	ADRB3	53	40
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@H](O)c1ccccc1)CC2	ZINC000819040636	GF	On-Demand	Anodyne	ABCB1B	55	38
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@H](O)c1ccccc1)CC2	ZINC000819040636	GF	On-Demand	Anodyne	MTNR1B	15	47
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@H](O)c1ccccc1)CC2	ZINC000819040636	GF	On-Demand	Anodyne	ABCB1	23	47
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@H](O)c1ccccc1)CC2	ZINC000819040636	GF	On-Demand	Anodyne	HCRTR2	16	58
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@@H](O)c1ccccc1)CC2	ZINC000819040637	GF	On-Demand	Anodyne	ADRB1	29	40
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@@H](O)c1ccccc1)CC2	ZINC000819040637	GF	On-Demand	Anodyne	ADRB3	53	40
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@@H](O)c1ccccc1)CC2	ZINC000819040637	GF	On-Demand	Anodyne	ABCB1B	55	38
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@@H](O)c1ccccc1)CC2	ZINC000819040637	GF	On-Demand	Anodyne	MTNR1B	15	47
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@@H](O)c1ccccc1)CC2	ZINC000819040637	GF	On-Demand	Anodyne	ABCB1	23	47
COc1cc2c(cc1OC)CN(C(=O)CCCNC[C@@H](O)c1ccccc1)CC2	ZINC000819040637	GF	On-Demand	Anodyne	HCRTR2	16	58
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000819040646	GE	On-Demand	Anodyne	EPHX2	37	52
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000819040646	GE	On-Demand	Anodyne	SFRP1	70	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000819040646	GE	On-Demand	Anodyne	L3MBTL3	46	33
O=C(C1CCC1)N(CCCNC[C@@H](O)c1cccc(F)c1)C1CC1	ZINC000819040647	EF	On-Demand	Anodyne	ADRB1	34	41
O=C(C1CCC1)N(CCCNC[C@@H](O)c1cccc(F)c1)C1CC1	ZINC000819040647	EF	On-Demand	Anodyne	ADRB3	43	41
O=C(C1CCC1)N(CCCNC[C@H](O)c1cccc(F)c1)C1CC1	ZINC000819040648	EF	On-Demand	Anodyne	ADRB1	34	41
O=C(C1CCC1)N(CCCNC[C@H](O)c1cccc(F)c1)C1CC1	ZINC000819040648	EF	On-Demand	Anodyne	ADRB3	43	41
O=[S@](CCNC[C@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040653	FE	On-Demand	Anodyne	ADRB2	66	55
O=[S@](CCNC[C@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040653	FE	On-Demand	Anodyne	ADRB1	104	55
O=[S@](CCNC[C@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040653	FE	On-Demand	Anodyne	GRIN1	15	50
O=[S@](CCNC[C@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040653	FE	On-Demand	Anodyne	ADRB3	63	55
O=[S@](CCNC[C@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040653	FE	On-Demand	Anodyne	ABCB1	26	49
O=[S@](CCNC[C@@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040654	FE	On-Demand	Anodyne	ADRB2	66	55
O=[S@](CCNC[C@@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040654	FE	On-Demand	Anodyne	ADRB1	104	55
O=[S@](CCNC[C@@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040654	FE	On-Demand	Anodyne	GRIN1	15	50
O=[S@](CCNC[C@@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040654	FE	On-Demand	Anodyne	ADRB3	63	55
O=[S@](CCNC[C@@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040654	FE	On-Demand	Anodyne	ABCB1	26	49
O=[S@@](CCNC[C@@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040655	FE	On-Demand	Anodyne	ADRB2	66	55
O=[S@@](CCNC[C@@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040655	FE	On-Demand	Anodyne	ADRB1	104	55
O=[S@@](CCNC[C@@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040655	FE	On-Demand	Anodyne	GRIN1	15	50
O=[S@@](CCNC[C@@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040655	FE	On-Demand	Anodyne	ADRB3	63	55
O=[S@@](CCNC[C@@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040655	FE	On-Demand	Anodyne	ABCB1	26	49
O=[S@@](CCNC[C@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040656	FE	On-Demand	Anodyne	ADRB2	66	55
O=[S@@](CCNC[C@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040656	FE	On-Demand	Anodyne	ADRB1	104	55
O=[S@@](CCNC[C@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040656	FE	On-Demand	Anodyne	GRIN1	15	50
O=[S@@](CCNC[C@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040656	FE	On-Demand	Anodyne	ADRB3	63	55
O=[S@@](CCNC[C@H](O)COc1ccc(F)cc1)Cc1ccccc1	ZINC000819040656	FE	On-Demand	Anodyne	ABCB1	26	49
CON(C)C(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819040674	FF	On-Demand	Anodyne	DRD4	39	43
CON(C)C(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819040674	FF	On-Demand	Anodyne	ACHE	25	41
CON(C)C(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819040674	FF	On-Demand	Anodyne	HRH1	20	46
CON(C)C(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819040674	FF	On-Demand	Anodyne	OPRK1	26	42
CON(C)C(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819040674	FF	On-Demand	Anodyne	KCNH2	15	41
CON(C)C(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819040674	FF	On-Demand	Anodyne	TACR2	30	42
CON(C)C(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819040674	FF	On-Demand	Anodyne	SIGMAR1	39	53
CON(C)C(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819040674	FF	On-Demand	Anodyne	SSTR5	88	46
CON(C)C(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819040674	FF	On-Demand	Anodyne	CCR3	51	46
CON(C)C(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819040674	FF	On-Demand	Anodyne	UTS2R	31	49
CON(C)C(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819040674	FF	On-Demand	Anodyne	PDK1	49	39
CON(C)C(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819040674	FF	On-Demand	Anodyne	MCHR1	61	57
CON(C)C(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819040674	FF	On-Demand	Anodyne	CACNA1G	23	40
O=C(C(F)=C1CCC1)N1CCN(CCCc2nc(-c3cccs3)no2)CC1	ZINC000819040682	GG	On-Demand	Anodyne	ETHR	42	42
O=[S@](CCNC[C@H](O)c1ccc(F)cc1F)Cc1ccccc1	ZINC000819040683	EF	On-Demand	Anodyne	ADRB2	42	40
O=[S@](CCNC[C@H](O)c1ccc(F)cc1F)Cc1ccccc1	ZINC000819040683	EF	On-Demand	Anodyne	ADRB1	30	40
O=[S@@](CCNC[C@@H](O)c1ccc(F)cc1F)Cc1ccccc1	ZINC000819040684	EF	On-Demand	Anodyne	ADRB2	42	40
O=[S@@](CCNC[C@@H](O)c1ccc(F)cc1F)Cc1ccccc1	ZINC000819040684	EF	On-Demand	Anodyne	ADRB1	30	40
O=[S@@](CCNC[C@H](O)c1ccc(F)cc1F)Cc1ccccc1	ZINC000819040685	EF	On-Demand	Anodyne	ADRB2	42	40
O=[S@@](CCNC[C@H](O)c1ccc(F)cc1F)Cc1ccccc1	ZINC000819040685	EF	On-Demand	Anodyne	ADRB1	30	40
O=[S@](CCNC[C@@H](O)c1ccc(F)cc1F)Cc1ccccc1	ZINC000819040686	EF	On-Demand	Anodyne	ADRB2	42	40
O=[S@](CCNC[C@@H](O)c1ccc(F)cc1F)Cc1ccccc1	ZINC000819040686	EF	On-Demand	Anodyne	ADRB1	30	40
NC(=O)c1cn([C@@H]2CCN(C(=S)Nc3ccccc3Cl)C2)nn1	ZINC000819040707	FD	On-Demand	Anodyne	EPHB3	53	32
NC(=O)c1cn([C@H]2CCN(C(=S)Nc3ccccc3Cl)C2)nn1	ZINC000819040708	FD	On-Demand	Anodyne	EPHB3	53	32
CC(=O)c1ccc(N2CCN(C(=O)[C@H]3CCCO[C@H]3C(C)C)CC2)c(F)c1	ZINC000819040709	GG	On-Demand	Anodyne	MC4R	44	41
CC(=O)c1ccc(N2CCN(C(=O)[C@H]3CCCO[C@H]3C(C)C)CC2)c(F)c1	ZINC000819040709	GG	On-Demand	Anodyne	NPY2R	40	36
CC(=O)c1ccc(N2CCN(C(=O)[C@H]3CCCO[C@H]3C(C)C)CC2)c(F)c1	ZINC000819040709	GG	On-Demand	Anodyne	SLC6A9	25	46
O=[S@](CCNC[C@H](O)Cc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819040710	FG	On-Demand	Anodyne	ADRB2	22	40
O=[S@](CCNC[C@@H](O)Cc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819040711	FG	On-Demand	Anodyne	ADRB2	22	40
O=[S@@](CCNC[C@H](O)Cc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819040712	FG	On-Demand	Anodyne	ADRB2	22	40
O=[S@@](CCNC[C@@H](O)Cc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819040713	FG	On-Demand	Anodyne	ADRB2	22	40
O=[S@](CCNC[C@H](O)c1cc(F)ccc1F)Cc1ccccc1	ZINC000819040714	EF	On-Demand	Anodyne	ADRB1	25	40
O=[S@@](CCNC[C@@H](O)c1cc(F)ccc1F)Cc1ccccc1	ZINC000819040715	EF	On-Demand	Anodyne	ADRB1	25	40
O=[S@@](CCNC[C@H](O)c1cc(F)ccc1F)Cc1ccccc1	ZINC000819040716	EF	On-Demand	Anodyne	ADRB1	25	40
O=[S@](CCNC[C@@H](O)c1cc(F)ccc1F)Cc1ccccc1	ZINC000819040717	EF	On-Demand	Anodyne	ADRB1	25	40
O=[S@](CCNC[C@@H](O)Cc1ccc(F)cc1)Cc1ccccc1	ZINC000819040733	EE	On-Demand	Anodyne	ADRB2	15	42
O=[S@](CCNC[C@@H](O)Cc1ccc(F)cc1)Cc1ccccc1	ZINC000819040733	EE	On-Demand	Anodyne	ADRB1	20	42
O=[S@](CCNC[C@@H](O)Cc1ccc(F)cc1)Cc1ccccc1	ZINC000819040733	EE	On-Demand	Anodyne	ADRB3	16	42
O=[S@@](CCNC[C@H](O)Cc1ccc(F)cc1)Cc1ccccc1	ZINC000819040734	EE	On-Demand	Anodyne	ADRB2	15	42
O=[S@@](CCNC[C@H](O)Cc1ccc(F)cc1)Cc1ccccc1	ZINC000819040734	EE	On-Demand	Anodyne	ADRB1	20	42
O=[S@@](CCNC[C@H](O)Cc1ccc(F)cc1)Cc1ccccc1	ZINC000819040734	EE	On-Demand	Anodyne	ADRB3	16	42
O=[S@@](CCNC[C@@H](O)Cc1ccc(F)cc1)Cc1ccccc1	ZINC000819040735	EE	On-Demand	Anodyne	ADRB2	15	42
O=[S@@](CCNC[C@@H](O)Cc1ccc(F)cc1)Cc1ccccc1	ZINC000819040735	EE	On-Demand	Anodyne	ADRB1	20	42
O=[S@@](CCNC[C@@H](O)Cc1ccc(F)cc1)Cc1ccccc1	ZINC000819040735	EE	On-Demand	Anodyne	ADRB3	16	42
O=[S@](CCNC[C@H](O)Cc1ccc(F)cc1)Cc1ccccc1	ZINC000819040736	EE	On-Demand	Anodyne	ADRB2	15	42
O=[S@](CCNC[C@H](O)Cc1ccc(F)cc1)Cc1ccccc1	ZINC000819040736	EE	On-Demand	Anodyne	ADRB1	20	42
O=[S@](CCNC[C@H](O)Cc1ccc(F)cc1)Cc1ccccc1	ZINC000819040736	EE	On-Demand	Anodyne	ADRB3	16	42
CON(C)C(=O)CCNCc1cccc(CN2CCC[C@H](C(N)=O)C2)c1	ZINC000819040888	FC	On-Demand	Anodyne	SLC6A1	100	33
CON(C)C(=O)CCNCc1cccc(CN2CCC[C@H](C(N)=O)C2)c1	ZINC000819040888	FC	On-Demand	Anodyne	MBTPS1	21	40
CON(C)C(=O)CCNCc1cccc(CN2CCC[C@@H](C(N)=O)C2)c1	ZINC000819040891	FC	On-Demand	Anodyne	SLC6A1	100	33
CON(C)C(=O)CCNCc1cccc(CN2CCC[C@@H](C(N)=O)C2)c1	ZINC000819040891	FC	On-Demand	Anodyne	MBTPS1	21	40
O[C@@H](CNCCc1ccc(Br)cc1F)c1ccccc1	ZINC000819040911	EG	On-Demand	Anodyne	ADRB2	37	48
O[C@@H](CNCCc1ccc(Br)cc1F)c1ccccc1	ZINC000819040911	EG	On-Demand	Anodyne	ADRB1	42	42
O[C@@H](CNCCc1ccc(Br)cc1F)c1ccccc1	ZINC000819040911	EG	On-Demand	Anodyne	ADRB3	82	44
O[C@H](CNCCc1ccc(Br)cc1F)c1ccccc1	ZINC000819040913	EG	On-Demand	Anodyne	ADRB2	37	48
O[C@H](CNCCc1ccc(Br)cc1F)c1ccccc1	ZINC000819040913	EG	On-Demand	Anodyne	ADRB1	42	42
O[C@H](CNCCc1ccc(Br)cc1F)c1ccccc1	ZINC000819040913	EG	On-Demand	Anodyne	ADRB3	82	44
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)Nc3nccs3)nn2)C1	ZINC000819040927	GF	On-Demand	Anodyne	MAP1	105	38
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)Nc3nccs3)nn2)C1	ZINC000819040928	GF	On-Demand	Anodyne	MAP1	105	38
COc1cccc([S@](=O)CC(=O)N(C)Cc2ccc(N(C)C)cc2)c1	ZINC000819040929	FF	On-Demand	Clean	HSD17B2	24	41
COc1cccc([S@@](=O)CC(=O)N(C)Cc2ccc(N(C)C)cc2)c1	ZINC000819040930	FF	On-Demand	Clean	HSD17B2	24	41
O[C@@H](CNCCc1ccc(Br)cc1F)c1ccc(F)cc1	ZINC000819040940	FH	On-Demand	Anodyne	ADRB2	25	47
O[C@H](CNCCc1ccc(Br)cc1F)c1ccc(F)cc1	ZINC000819040941	FH	On-Demand	Anodyne	ADRB2	25	47
O[C@@H](CNCCc1ccc(Br)cc1F)COCc1cccs1	ZINC000819040952	GG	On-Demand	Anodyne	ADRB1	20	42
O[C@@H](CNCCc1ccc(Br)cc1F)COCc1cccs1	ZINC000819040952	GG	On-Demand	Anodyne	ADRB3	16	42
O[C@H](CNCCc1ccc(Br)cc1F)COCc1cccs1	ZINC000819040953	GG	On-Demand	Anodyne	ADRB1	20	42
O[C@H](CNCCc1ccc(Br)cc1F)COCc1cccs1	ZINC000819040953	GG	On-Demand	Anodyne	ADRB3	16	42
N#Cc1ccc(OC[C@@H](O)CNCCc2ccc(Br)cc2F)cc1	ZINC000819040975	GG	On-Demand	Mild	ADRB2	41	46
N#Cc1ccc(OC[C@@H](O)CNCCc2ccc(Br)cc2F)cc1	ZINC000819040975	GG	On-Demand	Mild	ADRB1	75	46
N#Cc1ccc(OC[C@@H](O)CNCCc2ccc(Br)cc2F)cc1	ZINC000819040975	GG	On-Demand	Mild	GRIN1	15	50
N#Cc1ccc(OC[C@@H](O)CNCCc2ccc(Br)cc2F)cc1	ZINC000819040975	GG	On-Demand	Mild	ADRB3	42	46
N#Cc1ccc(OC[C@H](O)CNCCc2ccc(Br)cc2F)cc1	ZINC000819040979	GG	On-Demand	Mild	ADRB2	41	46
N#Cc1ccc(OC[C@H](O)CNCCc2ccc(Br)cc2F)cc1	ZINC000819040979	GG	On-Demand	Mild	ADRB1	75	46
N#Cc1ccc(OC[C@H](O)CNCCc2ccc(Br)cc2F)cc1	ZINC000819040979	GG	On-Demand	Mild	GRIN1	15	50
N#Cc1ccc(OC[C@H](O)CNCCc2ccc(Br)cc2F)cc1	ZINC000819040979	GG	On-Demand	Mild	ADRB3	42	46
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000819040990	EE	On-Demand	Anodyne	EPHX2	24	51
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000819040990	EE	On-Demand	Anodyne	L3MBTL3	81	38
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000819040991	EE	On-Demand	Anodyne	EPHX2	24	51
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000819040991	EE	On-Demand	Anodyne	L3MBTL3	81	38
O=C(/C=C/[C@H]1CCCO1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000819040993	EE	On-Demand	Anodyne	EPHX2	24	51
O=C(/C=C/[C@H]1CCCO1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000819040993	EE	On-Demand	Anodyne	L3MBTL3	81	38
O=C(/C=C\[C@H]1CCCO1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000819040994	EE	On-Demand	Anodyne	EPHX2	24	51
O=C(/C=C\[C@H]1CCCO1)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000819040994	EE	On-Demand	Anodyne	L3MBTL3	81	38
O=[S@](CCNC[C@@H](O)c1ccccc1)Cc1ccccc1	ZINC000819040996	DE	On-Demand	Anodyne	ADRB2	43	39
O=[S@](CCNC[C@@H](O)c1ccccc1)Cc1ccccc1	ZINC000819040996	DE	On-Demand	Anodyne	ADRB1	51	39
O=[S@](CCNC[C@@H](O)c1ccccc1)Cc1ccccc1	ZINC000819040996	DE	On-Demand	Anodyne	ADRB3	72	44
O=[S@](CCNC[C@H](O)c1ccccc1)Cc1ccccc1	ZINC000819040997	DE	On-Demand	Anodyne	ADRB2	43	39
O=[S@](CCNC[C@H](O)c1ccccc1)Cc1ccccc1	ZINC000819040997	DE	On-Demand	Anodyne	ADRB1	51	39
O=[S@](CCNC[C@H](O)c1ccccc1)Cc1ccccc1	ZINC000819040997	DE	On-Demand	Anodyne	ADRB3	72	44
O=[S@@](CCNC[C@@H](O)c1ccccc1)Cc1ccccc1	ZINC000819040999	DE	On-Demand	Anodyne	ADRB2	43	39
O=[S@@](CCNC[C@@H](O)c1ccccc1)Cc1ccccc1	ZINC000819040999	DE	On-Demand	Anodyne	ADRB1	51	39
O=[S@@](CCNC[C@@H](O)c1ccccc1)Cc1ccccc1	ZINC000819040999	DE	On-Demand	Anodyne	ADRB3	72	44
O=[S@@](CCNC[C@H](O)c1ccccc1)Cc1ccccc1	ZINC000819041000	DE	On-Demand	Anodyne	ADRB2	43	39
O=[S@@](CCNC[C@H](O)c1ccccc1)Cc1ccccc1	ZINC000819041000	DE	On-Demand	Anodyne	ADRB1	51	39
O=[S@@](CCNC[C@H](O)c1ccccc1)Cc1ccccc1	ZINC000819041000	DE	On-Demand	Anodyne	ADRB3	72	44
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(Br)cc2F)c1	ZINC000819041010	GG	On-Demand	Bother	ADRB2	22	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(Br)cc2F)c1	ZINC000819041010	GG	On-Demand	Bother	ADRB1	27	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(Br)cc2F)c1	ZINC000819041010	GG	On-Demand	Bother	ADRB3	54	41
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(Br)cc2F)c1	ZINC000819041013	GG	On-Demand	Bother	ADRB2	22	40
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(Br)cc2F)c1	ZINC000819041013	GG	On-Demand	Bother	ADRB1	27	41
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(Br)cc2F)c1	ZINC000819041013	GG	On-Demand	Bother	ADRB3	54	41
O=[S@](CCNC[C@H](O)c1ccc(Cl)cc1)Cc1ccccc1	ZINC000819041035	EF	On-Demand	Anodyne	ADRB2	37	42
O=[S@](CCNC[C@H](O)c1ccc(Cl)cc1)Cc1ccccc1	ZINC000819041035	EF	On-Demand	Anodyne	ADRB1	43	42
O=[S@](CCNC[C@H](O)c1ccc(Cl)cc1)Cc1ccccc1	ZINC000819041035	EF	On-Demand	Anodyne	ADRB3	45	40
O=[S@@](CCNC[C@H](O)c1ccc(Cl)cc1)Cc1ccccc1	ZINC000819041037	EF	On-Demand	Anodyne	ADRB2	37	42
O=[S@@](CCNC[C@H](O)c1ccc(Cl)cc1)Cc1ccccc1	ZINC000819041037	EF	On-Demand	Anodyne	ADRB1	43	42
O=[S@@](CCNC[C@H](O)c1ccc(Cl)cc1)Cc1ccccc1	ZINC000819041037	EF	On-Demand	Anodyne	ADRB3	45	40
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1Cc1ccccc1	ZINC000819041052	EH	On-Demand	Anodyne	TSHR	62	33
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1Cc1ccccc1	ZINC000819041052	EH	On-Demand	Anodyne	QRFPR	45	43
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1Cc1ccccc1	ZINC000819041053	EH	On-Demand	Anodyne	TSHR	62	33
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1Cc1ccccc1	ZINC000819041053	EH	On-Demand	Anodyne	QRFPR	45	43
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1Cc1ccccc1	ZINC000819041054	EH	On-Demand	Anodyne	TSHR	62	33
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1Cc1ccccc1	ZINC000819041054	EH	On-Demand	Anodyne	QRFPR	45	43
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1Cc1ccccc1	ZINC000819041055	EH	On-Demand	Anodyne	TSHR	62	33
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1Cc1ccccc1	ZINC000819041055	EH	On-Demand	Anodyne	QRFPR	45	43
O=[S@@](CCNC[C@H](O)COc1ccccc1F)Cc1ccccc1	ZINC000819041058	FE	On-Demand	Anodyne	ADRB2	42	46
O=[S@@](CCNC[C@H](O)COc1ccccc1F)Cc1ccccc1	ZINC000819041058	FE	On-Demand	Anodyne	ADRB1	67	46
O=[S@@](CCNC[C@H](O)COc1ccccc1F)Cc1ccccc1	ZINC000819041058	FE	On-Demand	Anodyne	ADRB3	37	46
O=[S@@](CCNC[C@H](O)COc1ccccc1F)Cc1ccccc1	ZINC000819041058	FE	On-Demand	Anodyne	ABCB1	34	46
O=[S@@](CCNC[C@@H](O)COc1ccccc1F)Cc1ccccc1	ZINC000819041059	FE	On-Demand	Anodyne	ADRB2	42	46
O=[S@@](CCNC[C@@H](O)COc1ccccc1F)Cc1ccccc1	ZINC000819041059	FE	On-Demand	Anodyne	ADRB1	67	46
O=[S@@](CCNC[C@@H](O)COc1ccccc1F)Cc1ccccc1	ZINC000819041059	FE	On-Demand	Anodyne	ADRB3	37	46
O=[S@@](CCNC[C@@H](O)COc1ccccc1F)Cc1ccccc1	ZINC000819041059	FE	On-Demand	Anodyne	ABCB1	34	46
O=[S@](CCNC[C@H](O)COc1ccccc1F)Cc1ccccc1	ZINC000819041060	FE	On-Demand	Anodyne	ADRB2	42	46
O=[S@](CCNC[C@H](O)COc1ccccc1F)Cc1ccccc1	ZINC000819041060	FE	On-Demand	Anodyne	ADRB1	67	46
O=[S@](CCNC[C@H](O)COc1ccccc1F)Cc1ccccc1	ZINC000819041060	FE	On-Demand	Anodyne	ADRB3	37	46
O=[S@](CCNC[C@H](O)COc1ccccc1F)Cc1ccccc1	ZINC000819041060	FE	On-Demand	Anodyne	ABCB1	34	46
O=[S@](CCNC[C@@H](O)COc1ccccc1F)Cc1ccccc1	ZINC000819041061	FE	On-Demand	Anodyne	ADRB2	42	46
O=[S@](CCNC[C@@H](O)COc1ccccc1F)Cc1ccccc1	ZINC000819041061	FE	On-Demand	Anodyne	ADRB1	67	46
O=[S@](CCNC[C@@H](O)COc1ccccc1F)Cc1ccccc1	ZINC000819041061	FE	On-Demand	Anodyne	ADRB3	37	46
O=[S@](CCNC[C@@H](O)COc1ccccc1F)Cc1ccccc1	ZINC000819041061	FE	On-Demand	Anodyne	ABCB1	34	46
CC(=O)c1ccc(N2CCN(C(=O)C(F)=C3CCC3)CC2)c(F)c1	ZINC000819041062	EG	On-Demand	Anodyne	NPY2R	52	38
CC(=O)c1ccc(N2CCN(C(=O)C(F)=C3CCC3)CC2)c(F)c1	ZINC000819041062	EG	On-Demand	Anodyne	SLC6A9	25	51
O=C(CCNCC[S@](=O)Cc1ccccc1)Nc1cccc(F)c1	ZINC000819041080	EF	On-Demand	Anodyne	KCNK3	20	40
O=C(CCNCC[S@@](=O)Cc1ccccc1)Nc1cccc(F)c1	ZINC000819041081	EF	On-Demand	Anodyne	KCNK3	20	40
O=[S@](CCNC[C@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041095	GG	On-Demand	Anodyne	ADRB2	50	59
O=[S@](CCNC[C@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041095	GG	On-Demand	Anodyne	ADRB1	68	52
O=[S@](CCNC[C@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041095	GG	On-Demand	Anodyne	ADRB3	40	52
O=[S@](CCNC[C@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041095	GG	On-Demand	Anodyne	CYP2D6	15	43
O=[S@](CCNC[C@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041095	GG	On-Demand	Anodyne	ABCB1	36	46
O=[S@@](CCNC[C@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041096	GG	On-Demand	Anodyne	ADRB2	50	59
O=[S@@](CCNC[C@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041096	GG	On-Demand	Anodyne	ADRB1	68	52
O=[S@@](CCNC[C@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041096	GG	On-Demand	Anodyne	ADRB3	40	52
O=[S@@](CCNC[C@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041096	GG	On-Demand	Anodyne	CYP2D6	15	43
O=[S@@](CCNC[C@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041096	GG	On-Demand	Anodyne	ABCB1	36	46
Cc1noc(C)c1CNC(=O)C(=O)Nc1ccccc1CC(=O)O	ZINC000819041139	ED	On-Demand	Anodyne	P2RX7	17	53
Cc1noc(C)c1CCNC(=O)Nc1ccccc1CC(=O)O	ZINC000819041175	DE	On-Demand	Anodyne	P2RX7	15	49
CC(C)(C)OC(=O)N1CCC[C@H](CCNC[C@H](O)c2c(F)cccc2F)C1	ZINC000819041214	GH	On-Demand	Anodyne	GPR119	36	46
CC(C)(C)OC(=O)N1CCC[C@H](CCNC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819041216	GH	On-Demand	Anodyne	GPR119	36	46
CC(C)(C)OC(=O)N1CCC[C@@H](CCNC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819041217	GH	On-Demand	Anodyne	GPR119	36	46
CC(C)(C)OC(=O)N1CCC[C@@H](CCNC[C@H](O)c2c(F)cccc2F)C1	ZINC000819041218	GH	On-Demand	Anodyne	GPR119	36	46
CC(=O)c1ccc(N2CCN(C(=O)c3cc4c(cn3)OCCO4)CC2)c(F)c1	ZINC000819041235	GE	On-Demand	Anodyne	NPY2R	62	39
CC(=O)c1ccc(N2CCN(C(=O)c3cc4c(cn3)OCCO4)CC2)c(F)c1	ZINC000819041235	GE	On-Demand	Anodyne	SLC6A9	29	52
N#C[C@H](c1ccc(F)cc1)N1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819041259	EE	On-Demand	Mild	PTAFR	26	41
N#C[C@H](c1ccc(F)cc1)N1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819041260	EE	On-Demand	Mild	PTAFR	26	41
N#C[C@H](c1ccc(F)cc1)N1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819041261	EE	On-Demand	Mild	PTAFR	26	41
N#C[C@H](c1ccc(F)cc1)N1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819041262	EE	On-Demand	Mild	PTAFR	26	41
C=CCc1cc(C(=O)OC)cc(OC)c1OC(=O)Cc1nc(-c2ccccc2)oc1C	ZINC000819041266	HI	On-Demand	Mild	PPARG	79	41
C=CCc1cc(C(=O)OC)cc(OC)c1OC(=O)Cc1nc(-c2ccccc2)oc1C	ZINC000819041266	HI	On-Demand	Mild	PPARA	85	41
C=CCc1cc(C(=O)OC)cc(OC)c1OC(=O)Cc1nc(-c2ccccc2)oc1C	ZINC000819041266	HI	On-Demand	Mild	PDE8B	58	36
Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)N(C)[C@H](C)C(=O)O	ZINC000819041268	GH	On-Demand	Anodyne	NR1H4	62	36
Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)N(C)[C@@H](C)C(=O)O	ZINC000819041273	GH	On-Demand	Anodyne	NR1H4	62	36
CC(=O)c1ccc(N2CCN(C(=O)c3coc4c(C)cccc34)CC2)c(F)c1	ZINC000819041295	GI	On-Demand	Anodyne	NPY2R	44	41
CC(=O)c1ccc(N2CCN(C(=O)c3coc4c(C)cccc34)CC2)c(F)c1	ZINC000819041295	GI	On-Demand	Anodyne	SLC6A9	31	52
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)C(F)=C1CCC1	ZINC000819041296	EG	On-Demand	Anodyne	MLYCD	19	43
O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)C(F)=C1CCC1	ZINC000819041296	EG	On-Demand	Anodyne	L3MBTL3	68	40
NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819041343	EC	On-Demand	Anodyne	OPRD1	23	41
NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819041343	EC	On-Demand	Anodyne	CFTR	59	38
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3ccccc3)c2)C1	ZINC000819041344	FE	On-Demand	Anodyne	SLC6A1	135	39
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3ccccc3)c2)C1	ZINC000819041344	FE	On-Demand	Anodyne	BACE1	20	40
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3ccccc3)c2)C1	ZINC000819041345	FE	On-Demand	Anodyne	SLC6A1	135	39
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@@H](O)c3ccccc3)c2)C1	ZINC000819041345	FE	On-Demand	Anodyne	BACE1	20	40
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@H](O)c3ccccc3)c2)C1	ZINC000819041346	FE	On-Demand	Anodyne	SLC6A1	135	39
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC[C@H](O)c3ccccc3)c2)C1	ZINC000819041346	FE	On-Demand	Anodyne	BACE1	20	40
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@H](O)c3ccccc3)c2)C1	ZINC000819041347	FE	On-Demand	Anodyne	SLC6A1	135	39
NC(=O)[C@H]1CCCN(Cc2cccc(CNC[C@H](O)c3ccccc3)c2)C1	ZINC000819041347	FE	On-Demand	Anodyne	BACE1	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041355	FE	On-Demand	Anodyne	CHRM1	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041355	FE	On-Demand	Anodyne	DRD2	15	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041355	FE	On-Demand	Anodyne	DRD4	41	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041355	FE	On-Demand	Anodyne	ACHE	36	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041355	FE	On-Demand	Anodyne	DRD3	15	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041355	FE	On-Demand	Anodyne	CHRM3	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041355	FE	On-Demand	Anodyne	SIGMAR1	42	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041355	FE	On-Demand	Anodyne	CCR3	28	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041355	FE	On-Demand	Anodyne	UTS2R	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041355	FE	On-Demand	Anodyne	SLC18A3	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041355	FE	On-Demand	Anodyne	CCR2	19	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041355	FE	On-Demand	Anodyne	MCHR1	29	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041355	FE	On-Demand	Anodyne	BIRC2	33	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041356	FE	On-Demand	Anodyne	CHRM1	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041356	FE	On-Demand	Anodyne	DRD2	15	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041356	FE	On-Demand	Anodyne	DRD4	41	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041356	FE	On-Demand	Anodyne	ACHE	36	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041356	FE	On-Demand	Anodyne	DRD3	15	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041356	FE	On-Demand	Anodyne	CHRM3	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041356	FE	On-Demand	Anodyne	SIGMAR1	42	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041356	FE	On-Demand	Anodyne	CCR3	28	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041356	FE	On-Demand	Anodyne	UTS2R	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041356	FE	On-Demand	Anodyne	SLC18A3	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041356	FE	On-Demand	Anodyne	CCR2	19	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041356	FE	On-Demand	Anodyne	MCHR1	29	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041356	FE	On-Demand	Anodyne	BIRC2	33	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041357	FE	On-Demand	Anodyne	CHRM1	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041357	FE	On-Demand	Anodyne	DRD2	15	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041357	FE	On-Demand	Anodyne	DRD4	41	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041357	FE	On-Demand	Anodyne	ACHE	36	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041357	FE	On-Demand	Anodyne	DRD3	15	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041357	FE	On-Demand	Anodyne	CHRM3	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041357	FE	On-Demand	Anodyne	SIGMAR1	42	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041357	FE	On-Demand	Anodyne	CCR3	28	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041357	FE	On-Demand	Anodyne	UTS2R	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041357	FE	On-Demand	Anodyne	SLC18A3	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041357	FE	On-Demand	Anodyne	CCR2	19	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041357	FE	On-Demand	Anodyne	MCHR1	29	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041357	FE	On-Demand	Anodyne	BIRC2	33	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041358	FE	On-Demand	Anodyne	CHRM1	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041358	FE	On-Demand	Anodyne	DRD2	15	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041358	FE	On-Demand	Anodyne	DRD4	41	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041358	FE	On-Demand	Anodyne	ACHE	36	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041358	FE	On-Demand	Anodyne	DRD3	15	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041358	FE	On-Demand	Anodyne	CHRM3	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041358	FE	On-Demand	Anodyne	SIGMAR1	42	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041358	FE	On-Demand	Anodyne	CCR3	28	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041358	FE	On-Demand	Anodyne	UTS2R	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041358	FE	On-Demand	Anodyne	SLC18A3	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041358	FE	On-Demand	Anodyne	CCR2	19	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041358	FE	On-Demand	Anodyne	MCHR1	29	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819041358	FE	On-Demand	Anodyne	BIRC2	33	41
O=[S@@](CCNC[C@@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041369	GG	On-Demand	Anodyne	ADRB2	50	59
O=[S@@](CCNC[C@@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041369	GG	On-Demand	Anodyne	ADRB1	68	52
O=[S@@](CCNC[C@@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041369	GG	On-Demand	Anodyne	ADRB3	40	52
O=[S@@](CCNC[C@@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041369	GG	On-Demand	Anodyne	CYP2D6	15	43
O=[S@@](CCNC[C@@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041369	GG	On-Demand	Anodyne	ABCB1	36	46
O=[S@](CCNC[C@@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041371	GG	On-Demand	Anodyne	ADRB2	50	59
O=[S@](CCNC[C@@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041371	GG	On-Demand	Anodyne	ADRB1	68	52
O=[S@](CCNC[C@@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041371	GG	On-Demand	Anodyne	ADRB3	40	52
O=[S@](CCNC[C@@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041371	GG	On-Demand	Anodyne	CYP2D6	15	43
O=[S@](CCNC[C@@H](O)COc1cccc2ccccc12)Cc1ccccc1	ZINC000819041371	GG	On-Demand	Anodyne	ABCB1	36	46
O=C(CCNCC[S@](=O)Cc1ccccc1)Nc1ccc(Cl)cc1	ZINC000819041395	FG	On-Demand	Anodyne	LTA4H	24	40
O=C(CCNCC[S@@](=O)Cc1ccccc1)Nc1ccc(Cl)cc1	ZINC000819041396	FG	On-Demand	Anodyne	LTA4H	24	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(C(F)(F)F)cc1)C2	ZINC000819041397	FG	On-Demand	Anodyne	CCR2	53	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(C(F)(F)F)cc1)C2	ZINC000819041399	FG	On-Demand	Anodyne	CCR2	53	36
O[C@@H](CNCCc1ccc(Br)cc1F)COc1ccccc1F	ZINC000819041413	GG	On-Demand	Anodyne	ADRB2	48	44
O[C@@H](CNCCc1ccc(Br)cc1F)COc1ccccc1F	ZINC000819041413	GG	On-Demand	Anodyne	ADRB1	72	43
O[C@@H](CNCCc1ccc(Br)cc1F)COc1ccccc1F	ZINC000819041413	GG	On-Demand	Anodyne	ADRB3	41	43
NC(=O)c1cn([C@@H]2CCN(C(=S)Nc3ccccc3)C2)nn1	ZINC000819041414	DD	On-Demand	Anodyne	NPY2R	24	40
O[C@H](CNCCc1ccc(Br)cc1F)COc1ccccc1F	ZINC000819041415	GG	On-Demand	Anodyne	ADRB2	48	44
O[C@H](CNCCc1ccc(Br)cc1F)COc1ccccc1F	ZINC000819041415	GG	On-Demand	Anodyne	ADRB1	72	43
O[C@H](CNCCc1ccc(Br)cc1F)COc1ccccc1F	ZINC000819041415	GG	On-Demand	Anodyne	ADRB3	41	43
NC(=O)c1cn([C@H]2CCN(C(=S)Nc3ccccc3)C2)nn1	ZINC000819041416	DD	On-Demand	Anodyne	NPY2R	24	40
O=C(NC1CCN(C(=O)c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819041430	DF	On-Demand	Anodyne	EPHX2	33	55
O=C(NC1CCN(C(=O)c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819041430	DF	On-Demand	Anodyne	SFRP1	37	41
O=C(NC1CCN(C(=O)c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819041430	DF	On-Demand	Anodyne	L3MBTL3	90	40
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccc(F)c1	ZINC000819041431	GI	On-Demand	Anodyne	DRD4	23	41
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccc(F)c1	ZINC000819041431	GI	On-Demand	Anodyne	HRH1	18	54
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccc(F)c1	ZINC000819041431	GI	On-Demand	Anodyne	SLC6A3	15	45
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccc(F)c1	ZINC000819041431	GI	On-Demand	Anodyne	SIGMAR1	36	50
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccc(F)c1	ZINC000819041431	GI	On-Demand	Anodyne	SSTR5	59	38
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccc(F)c1	ZINC000819041431	GI	On-Demand	Anodyne	CCR3	65	54
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccc(F)c1	ZINC000819041431	GI	On-Demand	Anodyne	MCHR1	42	46
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccc(F)c1	ZINC000819041431	GI	On-Demand	Anodyne	CACNA1G	24	43
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccc(F)c1	ZINC000819041432	GI	On-Demand	Anodyne	DRD4	23	41
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccc(F)c1	ZINC000819041432	GI	On-Demand	Anodyne	HRH1	18	54
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccc(F)c1	ZINC000819041432	GI	On-Demand	Anodyne	SLC6A3	15	45
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccc(F)c1	ZINC000819041432	GI	On-Demand	Anodyne	SIGMAR1	36	50
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccc(F)c1	ZINC000819041432	GI	On-Demand	Anodyne	SSTR5	59	38
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccc(F)c1	ZINC000819041432	GI	On-Demand	Anodyne	CCR3	65	54
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccc(F)c1	ZINC000819041432	GI	On-Demand	Anodyne	MCHR1	42	46
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccc(F)c1	ZINC000819041432	GI	On-Demand	Anodyne	CACNA1G	24	43
O=[S@](CCNC[C@H](O)c1cccc(F)c1)Cc1ccccc1	ZINC000819041443	DE	On-Demand	Anodyne	ADRB1	43	45
O=[S@](CCNC[C@H](O)c1cccc(F)c1)Cc1ccccc1	ZINC000819041443	DE	On-Demand	Anodyne	ADRB3	64	45
O=[S@@](CCNC[C@H](O)c1cccc(F)c1)Cc1ccccc1	ZINC000819041444	DE	On-Demand	Anodyne	ADRB1	43	45
O=[S@@](CCNC[C@H](O)c1cccc(F)c1)Cc1ccccc1	ZINC000819041444	DE	On-Demand	Anodyne	ADRB3	64	45
O=[S@](CCNC[C@@H](O)c1cccc(F)c1)Cc1ccccc1	ZINC000819041447	DE	On-Demand	Anodyne	ADRB1	43	45
O=[S@](CCNC[C@@H](O)c1cccc(F)c1)Cc1ccccc1	ZINC000819041447	DE	On-Demand	Anodyne	ADRB3	64	45
O=[S@@](CCNC[C@@H](O)c1cccc(F)c1)Cc1ccccc1	ZINC000819041448	DE	On-Demand	Anodyne	ADRB1	43	45
O=[S@@](CCNC[C@@H](O)c1cccc(F)c1)Cc1ccccc1	ZINC000819041448	DE	On-Demand	Anodyne	ADRB3	64	45
O=C(CCNCC[S@@](=O)Cc1ccccc1)Nc1cccnc1	ZINC000819041462	ED	On-Demand	Anodyne	HDAC3	15	49
O=C(CCNCC[S@@](=O)Cc1ccccc1)Nc1cccnc1	ZINC000819041462	ED	On-Demand	Anodyne	NAMPT	29	45
O=C(CCNCC[S@](=O)Cc1ccccc1)Nc1cccnc1	ZINC000819041464	ED	On-Demand	Anodyne	HDAC3	15	49
O=C(CCNCC[S@](=O)Cc1ccccc1)Nc1cccnc1	ZINC000819041464	ED	On-Demand	Anodyne	NAMPT	29	45
O=[S@](CCNC[C@H](O)c1ccccc1Cl)Cc1ccccc1	ZINC000819041472	EF	On-Demand	Anodyne	ADRB1	30	42
O=[S@@](CCNC[C@H](O)c1ccccc1Cl)Cc1ccccc1	ZINC000819041473	EF	On-Demand	Anodyne	ADRB1	30	42
NC(=O)[C@@H]1Cc2ccccc2CN1C(=O)C(F)=C1CCC1	ZINC000819041479	CD	On-Demand	Anodyne	OPRD1	30	41
O=C(C1CCC1)N(CCCNC[C@@H](O)c1ccccc1)C1CC1	ZINC000819041490	DE	On-Demand	Anodyne	ADRB1	27	41
O=C(C1CCC1)N(CCCNC[C@@H](O)c1ccccc1)C1CC1	ZINC000819041490	DE	On-Demand	Anodyne	ADRB3	42	41
O=C(C1CCC1)N(CCCNC[C@H](O)c1ccccc1)C1CC1	ZINC000819041491	DE	On-Demand	Anodyne	ADRB1	27	41
O=C(C1CCC1)N(CCCNC[C@H](O)c1ccccc1)C1CC1	ZINC000819041491	DE	On-Demand	Anodyne	ADRB3	42	41
CC(C)(C)OC(=O)N1CCC[C@H](CCNC[C@H](O)c2ccc(F)cn2)C1	ZINC000819041522	FF	On-Demand	Anodyne	GPR119	43	38
CC(C)(C)OC(=O)N1CCC[C@H](CCNC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819041525	FF	On-Demand	Anodyne	GPR119	43	38
CC(C)(C)OC(=O)N1CCC[C@@H](CCNC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819041526	FF	On-Demand	Anodyne	GPR119	43	38
CC(C)(C)OC(=O)N1CCC[C@@H](CCNC[C@H](O)c2ccc(F)cn2)C1	ZINC000819041527	FF	On-Demand	Anodyne	GPR119	43	38
CC(C)(C)OC(=O)N1CCC[C@H](CCNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819041536	FG	On-Demand	Anodyne	ADRB1	28	41
CC(C)(C)OC(=O)N1CCC[C@H](CCNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819041536	FG	On-Demand	Anodyne	ADRB3	48	41
CC(C)(C)OC(=O)N1CCC[C@H](CCNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819041536	FG	On-Demand	Anodyne	GPR119	29	47
CC(C)(C)OC(=O)N1CCC[C@@H](CCNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819041537	FG	On-Demand	Anodyne	ADRB1	28	41
CC(C)(C)OC(=O)N1CCC[C@@H](CCNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819041537	FG	On-Demand	Anodyne	ADRB3	48	41
CC(C)(C)OC(=O)N1CCC[C@@H](CCNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819041537	FG	On-Demand	Anodyne	GPR119	29	47
CC(C)(C)OC(=O)N1CCC[C@H](CCNC[C@H](O)c2cccc(F)c2)C1	ZINC000819041538	FG	On-Demand	Anodyne	ADRB1	28	41
CC(C)(C)OC(=O)N1CCC[C@H](CCNC[C@H](O)c2cccc(F)c2)C1	ZINC000819041538	FG	On-Demand	Anodyne	ADRB3	48	41
CC(C)(C)OC(=O)N1CCC[C@H](CCNC[C@H](O)c2cccc(F)c2)C1	ZINC000819041538	FG	On-Demand	Anodyne	GPR119	29	47
CC(C)(C)OC(=O)N1CCC[C@@H](CCNC[C@H](O)c2cccc(F)c2)C1	ZINC000819041539	FG	On-Demand	Anodyne	ADRB1	28	41
CC(C)(C)OC(=O)N1CCC[C@@H](CCNC[C@H](O)c2cccc(F)c2)C1	ZINC000819041539	FG	On-Demand	Anodyne	ADRB3	48	41
CC(C)(C)OC(=O)N1CCC[C@@H](CCNC[C@H](O)c2cccc(F)c2)C1	ZINC000819041539	FG	On-Demand	Anodyne	GPR119	29	47
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000819041576	EF	On-Demand	Anodyne	L3MBTL3	74	40
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000819041577	EF	On-Demand	Anodyne	L3MBTL3	74	40
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000819041578	EF	On-Demand	Anodyne	L3MBTL3	74	40
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(C(=O)N2CCCCC2)cc1	ZINC000819041579	EF	On-Demand	Anodyne	L3MBTL3	74	40
CCNS(=O)(=O)CCNC[C@H](O)COCc1ccccc1	ZINC000819041609	DC	On-Demand	Anodyne	ADRB2	39	44
CCNS(=O)(=O)CCNC[C@H](O)COCc1ccccc1	ZINC000819041609	DC	On-Demand	Anodyne	ADRB1	47	44
CCNS(=O)(=O)CCNC[C@H](O)COCc1ccccc1	ZINC000819041609	DC	On-Demand	Anodyne	ADRB3	38	44
CCNS(=O)(=O)CCNC[C@H](O)COCc1ccccc1	ZINC000819041609	DC	On-Demand	Anodyne	CAPN1	20	42
CCNS(=O)(=O)CCNC[C@H](O)COCc1ccccc1	ZINC000819041609	DC	On-Demand	Anodyne	CAPN2	43	42
CCNS(=O)(=O)CCNC[C@@H](O)COCc1ccccc1	ZINC000819041610	DC	On-Demand	Anodyne	ADRB2	39	44
CCNS(=O)(=O)CCNC[C@@H](O)COCc1ccccc1	ZINC000819041610	DC	On-Demand	Anodyne	ADRB1	47	44
CCNS(=O)(=O)CCNC[C@@H](O)COCc1ccccc1	ZINC000819041610	DC	On-Demand	Anodyne	ADRB3	38	44
CCNS(=O)(=O)CCNC[C@@H](O)COCc1ccccc1	ZINC000819041610	DC	On-Demand	Anodyne	CAPN1	20	42
CCNS(=O)(=O)CCNC[C@@H](O)COCc1ccccc1	ZINC000819041610	DC	On-Demand	Anodyne	CAPN2	43	42
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819041611	FC	On-Demand	Anodyne	ADRB2	45	45
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819041611	FC	On-Demand	Anodyne	ADRB1	66	38
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819041611	FC	On-Demand	Anodyne	ADRB3	31	44
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819041611	FC	On-Demand	Anodyne	ABCB1	17	45
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819041612	FC	On-Demand	Anodyne	ADRB2	45	45
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819041612	FC	On-Demand	Anodyne	ADRB1	66	38
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819041612	FC	On-Demand	Anodyne	ADRB3	31	44
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819041612	FC	On-Demand	Anodyne	ABCB1	17	45
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819041613	EC	On-Demand	Anodyne	ADRB2	51	48
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819041613	EC	On-Demand	Anodyne	ADRB1	84	48
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819041613	EC	On-Demand	Anodyne	GRIN1	17	45
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819041613	EC	On-Demand	Anodyne	ADRB3	50	48
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819041614	EC	On-Demand	Anodyne	ADRB2	51	48
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819041614	EC	On-Demand	Anodyne	ADRB1	84	48
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819041614	EC	On-Demand	Anodyne	GRIN1	17	45
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819041614	EC	On-Demand	Anodyne	ADRB3	50	48
C[C@@H](NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(N)=O	ZINC000819041628	FF	On-Demand	Anodyne	CTSK	18	53
C[C@@H](NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(N)=O	ZINC000819041628	FF	On-Demand	Anodyne	CACNA1B	18	40
C[C@@H](NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(N)=O	ZINC000819041628	FF	On-Demand	Anodyne	ECE1	22	42
C[C@@H](NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(N)=O	ZINC000819041628	FF	On-Demand	Anodyne	REN	52	44
C[C@@H](NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(N)=O	ZINC000819041629	FF	On-Demand	Anodyne	CTSK	18	53
C[C@@H](NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(N)=O	ZINC000819041629	FF	On-Demand	Anodyne	CACNA1B	18	40
C[C@@H](NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(N)=O	ZINC000819041629	FF	On-Demand	Anodyne	ECE1	22	42
C[C@@H](NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(N)=O	ZINC000819041629	FF	On-Demand	Anodyne	REN	52	44
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819041631	GE	On-Demand	Anodyne	CCR5	29	40
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819041631	GE	On-Demand	Anodyne	SFRP1	83	42
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819041631	GE	On-Demand	Anodyne	WNT3	42	36
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819041632	GE	On-Demand	Anodyne	CCR5	29	40
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819041632	GE	On-Demand	Anodyne	SFRP1	83	42
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819041632	GE	On-Demand	Anodyne	WNT3	42	36
CCNS(=O)(=O)CCNCCC(=O)Nc1ccccc1	ZINC000819041635	CC	On-Demand	Anodyne	HDAC10	19	45
CCNS(=O)(=O)CCNCCC(=O)Nc1ccccc1	ZINC000819041635	CC	On-Demand	Anodyne	HDAC2	16	45
CCNS(=O)(=O)CCNCCC(=O)Nc1ccccc1	ZINC000819041635	CC	On-Demand	Anodyne	HDAC3	15	45
CCNS(=O)(=O)CCNCCC(=O)Nc1ccccc1	ZINC000819041635	CC	On-Demand	Anodyne	HDAC6	16	45
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819041657	FB	On-Demand	Anodyne	ADRB2	56	60
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819041657	FB	On-Demand	Anodyne	ADRB1	93	60
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819041657	FB	On-Demand	Anodyne	GRIN1	30	51
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819041657	FB	On-Demand	Anodyne	ADRB3	61	60
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819041658	FB	On-Demand	Anodyne	ADRB2	56	60
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819041658	FB	On-Demand	Anodyne	ADRB1	93	60
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819041658	FB	On-Demand	Anodyne	GRIN1	30	51
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819041658	FB	On-Demand	Anodyne	ADRB3	61	60
CCNS(=O)(=O)CCNC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819041663	FD	On-Demand	Anodyne	ADRB2	35	46
CCNS(=O)(=O)CCNC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819041663	FD	On-Demand	Anodyne	ADRB1	40	42
CCNS(=O)(=O)CCNC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819041663	FD	On-Demand	Anodyne	GRIN1	20	45
CCNS(=O)(=O)CCNC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819041664	FD	On-Demand	Anodyne	ADRB2	35	46
CCNS(=O)(=O)CCNC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819041664	FD	On-Demand	Anodyne	ADRB1	40	42
CCNS(=O)(=O)CCNC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819041664	FD	On-Demand	Anodyne	GRIN1	20	45
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819041671	DD	On-Demand	Anodyne	ADRB2	15	40
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819041671	DD	On-Demand	Anodyne	ADRB1	19	40
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819041671	DD	On-Demand	Anodyne	SLC6A3	21	42
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819041671	DD	On-Demand	Anodyne	ADRB3	40	39
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819041671	DD	On-Demand	Anodyne	SIGMAR1	21	42
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819041671	DD	On-Demand	Anodyne	PRCP	20	44
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819041671	DD	On-Demand	Anodyne	CCR5	50	44
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819041672	DD	On-Demand	Anodyne	ADRB2	15	40
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819041672	DD	On-Demand	Anodyne	ADRB1	19	40
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819041672	DD	On-Demand	Anodyne	SLC6A3	21	42
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819041672	DD	On-Demand	Anodyne	ADRB3	40	39
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819041672	DD	On-Demand	Anodyne	SIGMAR1	21	42
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819041672	DD	On-Demand	Anodyne	PRCP	20	44
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819041672	DD	On-Demand	Anodyne	CCR5	50	44
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccc(Br)cc2F)cc1	ZINC000819041674	GG	On-Demand	Bother	ADRB2	15	42
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccc(Br)cc2F)cc1	ZINC000819041676	GG	On-Demand	Bother	ADRB2	15	42
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819041698	EC	On-Demand	Anodyne	ADRB2	36	62
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819041698	EC	On-Demand	Anodyne	ADRB1	64	62
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819041698	EC	On-Demand	Anodyne	ADRB3	26	62
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819041701	EC	On-Demand	Anodyne	ADRB2	36	62
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819041701	EC	On-Demand	Anodyne	ADRB1	64	62
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819041701	EC	On-Demand	Anodyne	ADRB3	26	62
CCNS(=O)(=O)CCNC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819041702	EC	On-Demand	Anodyne	ADRB2	20	45
CCNS(=O)(=O)CCNC[C@H](O)c1cc(OC)ccc1OC	ZINC000819041705	EC	On-Demand	Anodyne	ADRB2	20	45
CCOc1ccc(C(=O)N2CCC(NC(=O)/C=C/[C@@H]3CCCO3)CC2)cc1	ZINC000819041719	FF	On-Demand	Anodyne	L3MBTL3	53	35
CCOc1ccc(C(=O)N2CCC(NC(=O)/C=C\[C@H]3CCCO3)CC2)cc1	ZINC000819041721	FF	On-Demand	Anodyne	L3MBTL3	53	35
CCOc1ccc(C(=O)N2CCC(NC(=O)/C=C\[C@@H]3CCCO3)CC2)cc1	ZINC000819041723	FF	On-Demand	Anodyne	L3MBTL3	53	35
CCOc1ccc(C(=O)N2CCC(NC(=O)/C=C/[C@H]3CCCO3)CC2)cc1	ZINC000819041725	FF	On-Demand	Anodyne	L3MBTL3	53	35
CCNS(=O)(=O)CCNCCC(=O)Nc1cccnc1	ZINC000819041731	DB	On-Demand	Anodyne	TBXAS1	20	41
CCNS(=O)(=O)CCNCCC(=O)Nc1cccnc1	ZINC000819041731	DB	On-Demand	Anodyne	NAMPT	30	40
CCCCN1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819041740	CD	On-Demand	Anodyne	ADRB2	25	40
CCCCN1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819041740	CD	On-Demand	Anodyne	ADRB1	26	40
CCCCN1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819041740	CD	On-Demand	Anodyne	ADRB3	78	51
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC(c1ccccc1)c1ccccc1)C2	ZINC000819041742	GH	On-Demand	Anodyne	SLC6A3	15	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC(c1ccccc1)c1ccccc1)C2	ZINC000819041742	GH	On-Demand	Anodyne	XIAP	54	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC(c1ccccc1)c1ccccc1)C2	ZINC000819041742	GH	On-Demand	Anodyne	BIRC8	58	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC(c1ccccc1)c1ccccc1)C2	ZINC000819041743	GH	On-Demand	Anodyne	SLC6A3	15	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC(c1ccccc1)c1ccccc1)C2	ZINC000819041743	GH	On-Demand	Anodyne	XIAP	54	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC(c1ccccc1)c1ccccc1)C2	ZINC000819041743	GH	On-Demand	Anodyne	BIRC8	58	34
CCCCN1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819041745	CD	On-Demand	Anodyne	ADRB2	25	40
CCCCN1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819041745	CD	On-Demand	Anodyne	ADRB1	26	40
CCCCN1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819041745	CD	On-Demand	Anodyne	ADRB3	78	51
O=C(N[C@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041748	CF	On-Demand	Anodyne	CHRM2	20	46
O=C(N[C@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041748	CF	On-Demand	Anodyne	CHRM1	18	46
O=C(N[C@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041748	CF	On-Demand	Anodyne	DRD2	21	57
O=C(N[C@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041748	CF	On-Demand	Anodyne	DRD4	51	57
O=C(N[C@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041748	CF	On-Demand	Anodyne	ACHE	38	43
O=C(N[C@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041748	CF	On-Demand	Anodyne	DRD3	17	49
O=C(N[C@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041748	CF	On-Demand	Anodyne	CHRM3	27	46
O=C(N[C@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041748	CF	On-Demand	Anodyne	LTA4H	23	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041748	CF	On-Demand	Anodyne	SIGMAR1	61	53
O=C(N[C@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041748	CF	On-Demand	Anodyne	CCR3	42	52
O=C(N[C@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041748	CF	On-Demand	Anodyne	UTS2R	20	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041748	CF	On-Demand	Anodyne	SLC18A3	25	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041748	CF	On-Demand	Anodyne	CCR2	19	48
O=C(N[C@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041748	CF	On-Demand	Anodyne	MCHR1	33	54
O=C(N[C@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041748	CF	On-Demand	Anodyne	CACNA1G	24	47
O=C(N[C@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041748	CF	On-Demand	Anodyne	BIRC2	47	47
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041749	CF	On-Demand	Anodyne	CHRM2	20	46
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041749	CF	On-Demand	Anodyne	CHRM1	18	46
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041749	CF	On-Demand	Anodyne	DRD2	21	57
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041749	CF	On-Demand	Anodyne	DRD4	51	57
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041749	CF	On-Demand	Anodyne	ACHE	38	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041749	CF	On-Demand	Anodyne	DRD3	17	49
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041749	CF	On-Demand	Anodyne	CHRM3	27	46
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041749	CF	On-Demand	Anodyne	LTA4H	23	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041749	CF	On-Demand	Anodyne	SIGMAR1	61	53
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041749	CF	On-Demand	Anodyne	CCR3	42	52
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041749	CF	On-Demand	Anodyne	UTS2R	20	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041749	CF	On-Demand	Anodyne	SLC18A3	25	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041749	CF	On-Demand	Anodyne	CCR2	19	48
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041749	CF	On-Demand	Anodyne	MCHR1	33	54
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041749	CF	On-Demand	Anodyne	CACNA1G	24	47
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819041749	CF	On-Demand	Anodyne	BIRC2	47	47
Cc1ccccc1[C@@H](O)CNCCCN1C(=O)CNC1=O	ZINC000819041759	CC	On-Demand	Anodyne	ADRB2	24	42
C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)C(F)=C1CCC1	ZINC000819041760	EE	On-Demand	Anodyne	CA9	15	40
C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)C(F)=C1CCC1	ZINC000819041760	EE	On-Demand	Anodyne	P96878_MYCTU	30	40
O=C(/C=C\[C@@H]1CCCO1)Nc1nc2ccccc2[nH]1	ZINC000819041768	CE	On-Demand	Anodyne	KCNN3	39	41
O=C(/C=C\[C@H]1CCCO1)Nc1nc2ccccc2[nH]1	ZINC000819041769	CE	On-Demand	Anodyne	KCNN3	39	41
O=C(/C=C/[C@@H]1CCCO1)Nc1nc2ccccc2[nH]1	ZINC000819041770	CE	On-Demand	Anodyne	KCNN3	39	41
O=C(/C=C/[C@H]1CCCO1)Nc1nc2ccccc2[nH]1	ZINC000819041771	CE	On-Demand	Anodyne	KCNN3	39	41
O=C(Nc1nccs1)C(F)=C1CCC1	ZINC000819041777	BE	On-Demand	Anodyne	MAP1	126	42
C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])c1ccccc1Cl	ZINC000819041778	FJ	On-Demand	Bother	COLA	65	37
CN(Cc1ccc(N(C)C)cc1)C(=O)CCc1cccc(OC(F)F)c1	ZINC000819041794	FH	On-Demand	Clean	CRTM	50	40
O[C@@H](CNCCOCC1CC1)c1ccc(OC(F)(F)F)cc1	ZINC000819041796	DF	On-Demand	Anodyne	ADRB3	19	40
O[C@H](CNCCOCC1CC1)c1ccc(OC(F)(F)F)cc1	ZINC000819041797	DF	On-Demand	Anodyne	ADRB3	19	40
C=CCCn1cc(C(=O)N2CCN(c3ccc(C(C)=O)cc3F)CC2)nn1	ZINC000819041820	FE	On-Demand	Mild	SLC6A9	23	44
N#C[C@@H](c1ccc(F)cc1)N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819041864	EF	On-Demand	Mild	PTAFR	29	41
N#C[C@H](c1ccc(F)cc1)N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819041865	EF	On-Demand	Mild	PTAFR	29	41
COc1ccc(OC)c([C@H](O)CNCCc2sc(C)nc2C)c1	ZINC000819041877	EF	On-Demand	Anodyne	ADRB2	18	47
CS(=O)(=O)c1ccc([C@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819041887	GD	On-Demand	Anodyne	ADRB2	39	40
CS(=O)(=O)c1ccc([C@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819041887	GD	On-Demand	Anodyne	ADRB3	76	45
CS(=O)(=O)c1ccc([C@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819041889	GD	On-Demand	Anodyne	ADRB2	39	40
CS(=O)(=O)c1ccc([C@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819041889	GD	On-Demand	Anodyne	ADRB3	76	45
CS(=O)(=O)c1ccc([C@@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819041891	GD	On-Demand	Anodyne	ADRB2	39	40
CS(=O)(=O)c1ccc([C@@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819041891	GD	On-Demand	Anodyne	ADRB3	76	45
CS(=O)(=O)c1ccc([C@@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819041893	GD	On-Demand	Anodyne	ADRB2	39	40
CS(=O)(=O)c1ccc([C@@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819041893	GD	On-Demand	Anodyne	ADRB3	76	45
CS(=O)(=O)c1ccc([C@@H](O)CNCCCN(C(=O)C2CCC2)C2CC2)cc1	ZINC000819041909	GD	On-Demand	Anodyne	ADRB2	19	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCCN(C(=O)C2CCC2)C2CC2)cc1	ZINC000819041909	GD	On-Demand	Anodyne	CCR5	18	40
CS(=O)(=O)c1ccc([C@H](O)CNCCCN(C(=O)C2CCC2)C2CC2)cc1	ZINC000819041912	GD	On-Demand	Anodyne	ADRB2	19	41
CS(=O)(=O)c1ccc([C@H](O)CNCCCN(C(=O)C2CCC2)C2CC2)cc1	ZINC000819041912	GD	On-Demand	Anodyne	CCR5	18	40
O=[S@](CCNC[C@H](O)c1ccc(F)c(F)c1)Cc1ccccc1	ZINC000819041914	EF	On-Demand	Anodyne	ADRB1	36	40
O=[S@](CCNC[C@H](O)c1ccc(F)c(F)c1)Cc1ccccc1	ZINC000819041914	EF	On-Demand	Anodyne	ADRB3	55	40
O=[S@@](CCNC[C@@H](O)c1ccc(F)c(F)c1)Cc1ccccc1	ZINC000819041916	EF	On-Demand	Anodyne	ADRB1	36	40
O=[S@@](CCNC[C@@H](O)c1ccc(F)c(F)c1)Cc1ccccc1	ZINC000819041916	EF	On-Demand	Anodyne	ADRB3	55	40
O=[S@@](CCNC[C@H](O)c1ccc(F)c(F)c1)Cc1ccccc1	ZINC000819041917	EF	On-Demand	Anodyne	ADRB1	36	40
O=[S@@](CCNC[C@H](O)c1ccc(F)c(F)c1)Cc1ccccc1	ZINC000819041917	EF	On-Demand	Anodyne	ADRB3	55	40
O=[S@](CCNC[C@@H](O)c1ccc(F)c(F)c1)Cc1ccccc1	ZINC000819041919	EF	On-Demand	Anodyne	ADRB1	36	40
O=[S@](CCNC[C@@H](O)c1ccc(F)c(F)c1)Cc1ccccc1	ZINC000819041919	EF	On-Demand	Anodyne	ADRB3	55	40
NC(=O)c1cn([C@@H]2CCN(C(=S)NCc3ccccc3)C2)nn1	ZINC000819041921	EC	On-Demand	Anodyne	PREP	32	40
NC(=O)c1cn([C@@H]2CCN(C(=S)NCc3ccccc3)C2)nn1	ZINC000819041921	EC	On-Demand	Anodyne	TMPRSS11D	43	33
CC(=O)Nc1cccc(CC(=O)N2CCN(c3ccc(C(C)=O)cc3F)CC2)c1	ZINC000819041924	GF	On-Demand	Anodyne	HTR1D	25	41
CC(=O)Nc1cccc(CC(=O)N2CCN(c3ccc(C(C)=O)cc3F)CC2)c1	ZINC000819041924	GF	On-Demand	Anodyne	HTR1B	29	41
CC(=O)Nc1cccc(CC(=O)N2CCN(c3ccc(C(C)=O)cc3F)CC2)c1	ZINC000819041924	GF	On-Demand	Anodyne	NPY2R	104	43
CC(=O)Nc1cccc(CC(=O)N2CCN(c3ccc(C(C)=O)cc3F)CC2)c1	ZINC000819041924	GF	On-Demand	Anodyne	SLC6A9	24	49
CC(=O)Nc1cccc(CC(=O)N2CCN(c3ccc(C(C)=O)cc3F)CC2)c1	ZINC000819041924	GF	On-Demand	Anodyne	TAAR1	36	43
NC(=O)c1cn([C@H]2CCN(C(=S)NCc3ccccc3)C2)nn1	ZINC000819041925	EC	On-Demand	Anodyne	PREP	32	40
NC(=O)c1cn([C@H]2CCN(C(=S)NCc3ccccc3)C2)nn1	ZINC000819041925	EC	On-Demand	Anodyne	TMPRSS11D	43	33
O=C(CCNCC[S@@](=O)Cc1ccccc1)Nc1cccc(C(F)(F)F)c1	ZINC000819041926	GH	On-Demand	Anodyne	HDAC10	18	52
O=C(CCNCC[S@@](=O)Cc1ccccc1)Nc1cccc(C(F)(F)F)c1	ZINC000819041926	GH	On-Demand	Anodyne	HDAC6	15	52
O=C(CCNCC[S@@](=O)Cc1ccccc1)Nc1cccc(C(F)(F)F)c1	ZINC000819041926	GH	On-Demand	Anodyne	KCNK3	19	44
O=C(CCNCC[S@@](=O)Cc1ccccc1)Nc1cccc(C(F)(F)F)c1	ZINC000819041926	GH	On-Demand	Anodyne	PDS	37	40
O=C(CCNCC[S@](=O)Cc1ccccc1)Nc1cccc(C(F)(F)F)c1	ZINC000819041928	GH	On-Demand	Anodyne	HDAC10	18	52
O=C(CCNCC[S@](=O)Cc1ccccc1)Nc1cccc(C(F)(F)F)c1	ZINC000819041928	GH	On-Demand	Anodyne	HDAC6	15	52
O=C(CCNCC[S@](=O)Cc1ccccc1)Nc1cccc(C(F)(F)F)c1	ZINC000819041928	GH	On-Demand	Anodyne	KCNK3	19	44
O=C(CCNCC[S@](=O)Cc1ccccc1)Nc1cccc(C(F)(F)F)c1	ZINC000819041928	GH	On-Demand	Anodyne	PDS	37	40
O=[S@@](CCNC[C@H](O)COc1ccccc1Cl)Cc1ccccc1	ZINC000819041937	FF	On-Demand	Anodyne	ADRB2	44	55
O=[S@@](CCNC[C@H](O)COc1ccccc1Cl)Cc1ccccc1	ZINC000819041937	FF	On-Demand	Anodyne	ADRB1	67	46
O=[S@@](CCNC[C@H](O)COc1ccccc1Cl)Cc1ccccc1	ZINC000819041937	FF	On-Demand	Anodyne	ADRB3	39	46
O=[S@@](CCNC[C@H](O)COc1ccccc1Cl)Cc1ccccc1	ZINC000819041937	FF	On-Demand	Anodyne	ABCB1	38	46
O=[S@@](CCNC[C@@H](O)COc1ccccc1Cl)Cc1ccccc1	ZINC000819041939	FF	On-Demand	Anodyne	ADRB2	44	55
O=[S@@](CCNC[C@@H](O)COc1ccccc1Cl)Cc1ccccc1	ZINC000819041939	FF	On-Demand	Anodyne	ADRB1	67	46
O=[S@@](CCNC[C@@H](O)COc1ccccc1Cl)Cc1ccccc1	ZINC000819041939	FF	On-Demand	Anodyne	ADRB3	39	46
O=[S@@](CCNC[C@@H](O)COc1ccccc1Cl)Cc1ccccc1	ZINC000819041939	FF	On-Demand	Anodyne	ABCB1	38	46
O=[S@](CCNC[C@H](O)COc1ccccc1Cl)Cc1ccccc1	ZINC000819041940	FF	On-Demand	Anodyne	ADRB2	44	55
O=[S@](CCNC[C@H](O)COc1ccccc1Cl)Cc1ccccc1	ZINC000819041940	FF	On-Demand	Anodyne	ADRB1	67	46
O=[S@](CCNC[C@H](O)COc1ccccc1Cl)Cc1ccccc1	ZINC000819041940	FF	On-Demand	Anodyne	ADRB3	39	46
O=[S@](CCNC[C@H](O)COc1ccccc1Cl)Cc1ccccc1	ZINC000819041940	FF	On-Demand	Anodyne	ABCB1	38	46
O=[S@](CCNC[C@@H](O)COc1ccccc1Cl)Cc1ccccc1	ZINC000819041942	FF	On-Demand	Anodyne	ADRB2	44	55
O=[S@](CCNC[C@@H](O)COc1ccccc1Cl)Cc1ccccc1	ZINC000819041942	FF	On-Demand	Anodyne	ADRB1	67	46
O=[S@](CCNC[C@@H](O)COc1ccccc1Cl)Cc1ccccc1	ZINC000819041942	FF	On-Demand	Anodyne	ADRB3	39	46
O=[S@](CCNC[C@@H](O)COc1ccccc1Cl)Cc1ccccc1	ZINC000819041942	FF	On-Demand	Anodyne	ABCB1	38	46
CC(=O)Nc1cccc(CC(=O)NCCCOc2cccc(C)c2)c1	ZINC000819041963	EG	On-Demand	Anodyne	DRD4	18	47
CC(=O)Nc1cccc(CC(=O)NCCCOc2cccc(C)c2)c1	ZINC000819041963	EG	On-Demand	Anodyne	HRH2	55	46
CC(=O)Nc1cccc(CC(=O)NCCCOc2cccc(C)c2)c1	ZINC000819041963	EG	On-Demand	Anodyne	DRTS_LEIMA	15	40
CC(=O)Nc1cccc(CC(=O)NCCCOc2cccc(C)c2)c1	ZINC000819041963	EG	On-Demand	Anodyne	MTNR1A	54	46
CC(=O)Nc1cccc(CC(=O)NCCCOc2cccc(C)c2)c1	ZINC000819041963	EG	On-Demand	Anodyne	MTNR1B	53	46
CC(=O)Nc1cccc(CC(=O)NCCCOc2cccc(C)c2)c1	ZINC000819041963	EG	On-Demand	Anodyne	FAAH	15	40
CC(=O)Nc1cccc(CC(=O)NCCCOc2cccc(C)c2)c1	ZINC000819041963	EG	On-Demand	Anodyne	EPHX2	18	41
CC(=O)Nc1cccc(CC(=O)NCCCOc2cccc(C)c2)c1	ZINC000819041963	EG	On-Demand	Anodyne	CRTM	43	37
CC(=O)Nc1cccc(CC(=O)NCCCOc2cccc(C)c2)c1	ZINC000819041963	EG	On-Demand	Anodyne	KCNK3	72	41
CC(=O)Nc1cccc(CC(=O)NCCCOc2cccc(C)c2)c1	ZINC000819041963	EG	On-Demand	Anodyne	KCNK9	58	39
CC(=O)Nc1cccc(CC(=O)NCCCOc2cccc(C)c2)c1	ZINC000819041963	EG	On-Demand	Anodyne	PDS	41	40
COc1ccc(OC)c([C@H](O)CNCC[S@](=O)Cc2ccccc2)c1	ZINC000819041981	FE	On-Demand	Anodyne	ADRB2	48	44
COc1ccc(OC)c([C@H](O)CNCC[S@](=O)Cc2ccccc2)c1	ZINC000819041981	FE	On-Demand	Anodyne	ADRB1	47	41
COc1ccc(OC)c([C@H](O)CNCC[S@](=O)Cc2ccccc2)c1	ZINC000819041981	FE	On-Demand	Anodyne	ADRB3	34	41
COc1ccc(OC)c([C@H](O)CNCC[S@](=O)Cc2ccccc2)c1	ZINC000819041981	FE	On-Demand	Anodyne	MTNR1A	16	41
COc1ccc(OC)c([C@H](O)CNCC[S@@](=O)Cc2ccccc2)c1	ZINC000819041982	FE	On-Demand	Anodyne	ADRB2	48	44
COc1ccc(OC)c([C@H](O)CNCC[S@@](=O)Cc2ccccc2)c1	ZINC000819041982	FE	On-Demand	Anodyne	ADRB1	47	41
COc1ccc(OC)c([C@H](O)CNCC[S@@](=O)Cc2ccccc2)c1	ZINC000819041982	FE	On-Demand	Anodyne	ADRB3	34	41
COc1ccc(OC)c([C@H](O)CNCC[S@@](=O)Cc2ccccc2)c1	ZINC000819041982	FE	On-Demand	Anodyne	MTNR1A	16	41
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041998	GI	On-Demand	Anodyne	DRD4	20	50
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041998	GI	On-Demand	Anodyne	HRH1	24	55
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041998	GI	On-Demand	Anodyne	SLC6A3	29	47
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041998	GI	On-Demand	Anodyne	KCNH2	19	50
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041998	GI	On-Demand	Anodyne	ADRB3	19	41
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041998	GI	On-Demand	Anodyne	SIGMAR1	43	50
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041998	GI	On-Demand	Anodyne	SSTR5	62	39
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041998	GI	On-Demand	Anodyne	CCR3	70	55
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041998	GI	On-Demand	Anodyne	MCHR1	44	46
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041998	GI	On-Demand	Anodyne	CACNA1G	28	50
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041999	GI	On-Demand	Anodyne	DRD4	20	50
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041999	GI	On-Demand	Anodyne	HRH1	24	55
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041999	GI	On-Demand	Anodyne	SLC6A3	29	47
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041999	GI	On-Demand	Anodyne	KCNH2	19	50
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041999	GI	On-Demand	Anodyne	ADRB3	19	41
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041999	GI	On-Demand	Anodyne	SIGMAR1	43	50
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041999	GI	On-Demand	Anodyne	SSTR5	62	39
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041999	GI	On-Demand	Anodyne	CCR3	70	55
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041999	GI	On-Demand	Anodyne	MCHR1	44	46
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819041999	GI	On-Demand	Anodyne	CACNA1G	28	50
CN(CC(=O)N1CCCC1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042000	FD	On-Demand	Mild	PAPA1_CARPA	33	42
CN(CC(=O)N1CCCC1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042001	FD	On-Demand	Mild	PAPA1_CARPA	33	42
O=[S@](CCNC[C@@H](O)Cc1cccc(Cl)c1)Cc1ccccc1	ZINC000819042008	FF	On-Demand	Anodyne	ADRB2	19	45
O=[S@](CCNC[C@@H](O)Cc1cccc(Cl)c1)Cc1ccccc1	ZINC000819042008	FF	On-Demand	Anodyne	ADRB1	36	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1Cc2ccccc2C[C@H]1C(N)=O	ZINC000819042016	FD	On-Demand	Anodyne	OPRD1	34	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1Cc2ccccc2C[C@H]1C(N)=O	ZINC000819042016	FD	On-Demand	Anodyne	CFTR	55	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1Cc2ccccc2C[C@H]1C(N)=O	ZINC000819042016	FD	On-Demand	Anodyne	ADAM9	56	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1nc3ccc(OC)cc3s1)C2	ZINC000819042031	GG	On-Demand	Anodyne	CSNK1D	48	52
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1nc3ccc(OC)cc3s1)C2	ZINC000819042031	GG	On-Demand	Anodyne	PIK3CA	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1nc3ccc(OC)cc3s1)C2	ZINC000819042032	GG	On-Demand	Anodyne	CSNK1D	48	52
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1nc3ccc(OC)cc3s1)C2	ZINC000819042032	GG	On-Demand	Anodyne	PIK3CA	16	40
COc1ccc(OC)c([C@H](O)CNCCCN2C(=O)CNC2=O)c1	ZINC000819042041	EC	On-Demand	Anodyne	ADRB2	22	41
O[C@@H](CNCCOCC1CC1)c1cccc2ccccc12	ZINC000819042054	CF	On-Demand	Anodyne	ADRB2	29	41
O[C@@H](CNCCOCC1CC1)c1cccc2ccccc12	ZINC000819042054	CF	On-Demand	Anodyne	ADRB1	23	41
Cc1ccccc1[C@@H](O)CNCc1cccc(CN2CCC[C@@H](C(N)=O)C2)c1	ZINC000819042057	GF	On-Demand	Anodyne	SLC6A1	107	42
Cc1ccccc1[C@@H](O)CNCc1cccc(CN2CCC[C@H](C(N)=O)C2)c1	ZINC000819042060	GF	On-Demand	Anodyne	SLC6A1	107	42
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1C	ZINC000819042062	DC	On-Demand	Anodyne	ADRB2	53	62
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1C	ZINC000819042062	DC	On-Demand	Anodyne	ADRB1	65	44
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1C	ZINC000819042062	DC	On-Demand	Anodyne	ADRB3	38	44
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1C	ZINC000819042062	DC	On-Demand	Anodyne	ABCB1	34	45
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1C	ZINC000819042064	DC	On-Demand	Anodyne	ADRB2	53	62
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1C	ZINC000819042064	DC	On-Demand	Anodyne	ADRB1	65	44
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1C	ZINC000819042064	DC	On-Demand	Anodyne	ADRB3	38	44
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1C	ZINC000819042064	DC	On-Demand	Anodyne	ABCB1	34	45
CCNS(=O)(=O)CCNC[C@H](O)COc1cc(C)ccc1C	ZINC000819042065	EC	On-Demand	Anodyne	ADRB2	40	48
CCNS(=O)(=O)CCNC[C@H](O)COc1cc(C)ccc1C	ZINC000819042065	EC	On-Demand	Anodyne	ADRB1	55	37
CCNS(=O)(=O)CCNC[C@@H](O)COc1cc(C)ccc1C	ZINC000819042068	EC	On-Demand	Anodyne	ADRB2	40	48
CCNS(=O)(=O)CCNC[C@@H](O)COc1cc(C)ccc1C	ZINC000819042068	EC	On-Demand	Anodyne	ADRB1	55	37
Cc1ccccc1[C@@H](O)CNCCc1nc(-c2ccc(Cl)cc2)no1	ZINC000819042073	FH	On-Demand	Anodyne	ADRB3	27	42
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819042108	EC	On-Demand	Anodyne	ADRB2	49	49
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819042108	EC	On-Demand	Anodyne	ADRB1	75	42
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819042108	EC	On-Demand	Anodyne	ADRB3	47	42
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819042108	EC	On-Demand	Anodyne	ABCB1	21	48
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819042108	EC	On-Demand	Anodyne	PDS	44	36
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819042109	EC	On-Demand	Anodyne	ADRB2	49	49
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819042109	EC	On-Demand	Anodyne	ADRB1	75	42
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819042109	EC	On-Demand	Anodyne	ADRB3	47	42
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819042109	EC	On-Demand	Anodyne	ABCB1	21	48
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819042109	EC	On-Demand	Anodyne	PDS	44	36
O=C(/C=C/[C@@H]1CCCO1)N1CCC(OCc2ccccc2)CC1	ZINC000819042114	DF	On-Demand	Anodyne	GRIN2B	23	45
O=C(/C=C\[C@@H]1CCCO1)N1CCC(OCc2ccccc2)CC1	ZINC000819042115	DF	On-Demand	Anodyne	GRIN2B	23	45
O=C(/C=C/[C@H]1CCCO1)N1CCC(OCc2ccccc2)CC1	ZINC000819042116	DF	On-Demand	Anodyne	GRIN2B	23	45
O=C(/C=C\[C@H]1CCCO1)N1CCC(OCc2ccccc2)CC1	ZINC000819042117	DF	On-Demand	Anodyne	GRIN2B	23	45
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819042126	FD	On-Demand	Anodyne	ADRB2	62	58
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819042126	FD	On-Demand	Anodyne	ADRB1	82	45
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819042126	FD	On-Demand	Anodyne	GRIN1	18	44
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819042126	FD	On-Demand	Anodyne	ADRB3	55	48
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819042126	FD	On-Demand	Anodyne	CASR	40	36
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819042127	FD	On-Demand	Anodyne	ADRB2	62	58
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819042127	FD	On-Demand	Anodyne	ADRB1	82	45
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819042127	FD	On-Demand	Anodyne	GRIN1	18	44
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819042127	FD	On-Demand	Anodyne	ADRB3	55	48
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819042127	FD	On-Demand	Anodyne	CASR	40	36
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819042140	EC	On-Demand	Mild	ADRB2	52	51
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819042140	EC	On-Demand	Mild	ADRB1	82	51
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819042140	EC	On-Demand	Mild	GRIN1	25	47
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819042140	EC	On-Demand	Mild	ADRB3	53	51
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819042141	EC	On-Demand	Mild	ADRB2	52	51
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819042141	EC	On-Demand	Mild	ADRB1	82	51
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819042141	EC	On-Demand	Mild	GRIN1	25	47
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819042141	EC	On-Demand	Mild	ADRB3	53	51
CCCCN1CCC(NC[C@H](O)c2ccccc2F)CC1	ZINC000819042144	CF	On-Demand	Anodyne	CHRM3	15	40
CCCCN1CCC(NC[C@H](O)c2ccccc2F)CC1	ZINC000819042144	CF	On-Demand	Anodyne	SIGMAR1	17	46
CCCCN1CCC(NC[C@@H](O)c2ccccc2F)CC1	ZINC000819042145	CF	On-Demand	Anodyne	CHRM3	15	40
CCCCN1CCC(NC[C@@H](O)c2ccccc2F)CC1	ZINC000819042145	CF	On-Demand	Anodyne	SIGMAR1	17	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(OCc2ccccc2)CC1	ZINC000819042150	FG	On-Demand	Anodyne	GRIN2B	28	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(OCc2ccccc2)CC1	ZINC000819042150	FG	On-Demand	Anodyne	CCKAR	21	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(OCc2ccccc2)CC1	ZINC000819042150	FG	On-Demand	Anodyne	CTSK	18	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(OCc2ccccc2)CC1	ZINC000819042150	FG	On-Demand	Anodyne	EPHX2	19	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(OCc2ccccc2)CC1	ZINC000819042150	FG	On-Demand	Anodyne	KLK5	31	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(OCc2ccccc2)CC1	ZINC000819042150	FG	On-Demand	Anodyne	FPR1	45	36
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819042151	EC	On-Demand	Anodyne	ADRB2	52	50
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819042151	EC	On-Demand	Anodyne	ADRB1	83	50
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819042151	EC	On-Demand	Anodyne	GRIN1	30	57
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819042151	EC	On-Demand	Anodyne	ADRB3	54	50
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819042152	EC	On-Demand	Anodyne	ADRB2	52	50
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819042152	EC	On-Demand	Anodyne	ADRB1	83	50
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819042152	EC	On-Demand	Anodyne	GRIN1	30	57
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819042152	EC	On-Demand	Anodyne	ADRB3	54	50
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(C)c1	ZINC000819042153	DC	On-Demand	Anodyne	ADRB2	54	63
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(C)c1	ZINC000819042153	DC	On-Demand	Anodyne	ADRB1	73	58
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(C)c1	ZINC000819042153	DC	On-Demand	Anodyne	ADRB3	50	45
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(C)c1	ZINC000819042153	DC	On-Demand	Anodyne	PDS	33	40
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(C)c1	ZINC000819042154	DC	On-Demand	Anodyne	ADRB2	54	63
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(C)c1	ZINC000819042154	DC	On-Demand	Anodyne	ADRB1	73	58
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(C)c1	ZINC000819042154	DC	On-Demand	Anodyne	ADRB3	50	45
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(C)c1	ZINC000819042154	DC	On-Demand	Anodyne	PDS	33	40
CCCCN1CCC(NC[C@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819042155	EG	On-Demand	Anodyne	ADRB3	22	41
CCCCN1CCC(NC[C@@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819042156	EG	On-Demand	Anodyne	ADRB3	22	41
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819042165	FD	On-Demand	Anodyne	SLC6A3	15	42
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819042165	FD	On-Demand	Anodyne	ADRB3	24	44
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819042165	FD	On-Demand	Anodyne	PRCP	26	44
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819042165	FD	On-Demand	Anodyne	CCR5	15	42
CC(=O)c1ccc(N2CCN(C(=O)[C@H]3CCCC[C@H]3C)CC2)c(F)c1	ZINC000819042225	EH	On-Demand	Anodyne	NPY2R	47	39
CC(=O)c1ccc(N2CCN(C(=O)[C@H]3CCCC[C@H]3C)CC2)c(F)c1	ZINC000819042225	EH	On-Demand	Anodyne	SLC6A9	25	50
CC(=O)c1ccc(N2CCN(C(=O)[C@@H]3CCCC[C@H]3C)CC2)c(F)c1	ZINC000819042226	EH	On-Demand	Anodyne	NPY2R	47	39
CC(=O)c1ccc(N2CCN(C(=O)[C@@H]3CCCC[C@H]3C)CC2)c(F)c1	ZINC000819042226	EH	On-Demand	Anodyne	SLC6A9	25	50
CC(=O)c1ccc(N2CCN(C(=O)[C@@H]3CCCC[C@@H]3C)CC2)c(F)c1	ZINC000819042227	EH	On-Demand	Anodyne	NPY2R	47	39
CC(=O)c1ccc(N2CCN(C(=O)[C@@H]3CCCC[C@@H]3C)CC2)c(F)c1	ZINC000819042227	EH	On-Demand	Anodyne	SLC6A9	25	50
CC(=O)c1ccc(N2CCN(C(=O)[C@H]3CCCC[C@@H]3C)CC2)c(F)c1	ZINC000819042228	EH	On-Demand	Anodyne	NPY2R	47	39
CC(=O)c1ccc(N2CCN(C(=O)[C@H]3CCCC[C@@H]3C)CC2)c(F)c1	ZINC000819042228	EH	On-Demand	Anodyne	SLC6A9	25	50
O=[S@@](CCNC[C@H](O)Cc1cccc(Cl)c1)Cc1ccccc1	ZINC000819042266	FF	On-Demand	Anodyne	ADRB2	19	45
O=[S@@](CCNC[C@H](O)Cc1cccc(Cl)c1)Cc1ccccc1	ZINC000819042266	FF	On-Demand	Anodyne	ADRB1	36	45
O=[S@@](CCNC[C@@H](O)Cc1cccc(Cl)c1)Cc1ccccc1	ZINC000819042267	FF	On-Demand	Anodyne	ADRB2	19	45
O=[S@@](CCNC[C@@H](O)Cc1cccc(Cl)c1)Cc1ccccc1	ZINC000819042267	FF	On-Demand	Anodyne	ADRB1	36	45
O=[S@](CCNC[C@H](O)Cc1cccc(Cl)c1)Cc1ccccc1	ZINC000819042268	FF	On-Demand	Anodyne	ADRB2	19	45
O=[S@](CCNC[C@H](O)Cc1cccc(Cl)c1)Cc1ccccc1	ZINC000819042268	FF	On-Demand	Anodyne	ADRB1	36	45
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(C(F)(F)F)cc1	ZINC000819042269	CG	On-Demand	Anodyne	LUXR	15	40
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(C(F)(F)F)cc1	ZINC000819042270	CG	On-Demand	Anodyne	LUXR	15	40
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(C(F)(F)F)cc1	ZINC000819042271	CG	On-Demand	Anodyne	LUXR	15	40
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(C(F)(F)F)cc1	ZINC000819042272	CG	On-Demand	Anodyne	LUXR	15	40
C=C(C)C(C)(C)C(=O)N1CCN(c2ccc(C(C)=O)cc2F)CC1	ZINC000819042277	EG	On-Demand	Mild	NPY2R	61	44
C=C(C)C(C)(C)C(=O)N1CCN(c2ccc(C(C)=O)cc2F)CC1	ZINC000819042277	EG	On-Demand	Mild	SLC6A9	28	50
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccnc1	ZINC000819042278	GH	On-Demand	Anodyne	ADRB1	31	41
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccnc1	ZINC000819042278	GH	On-Demand	Anodyne	DRD4	16	41
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccnc1	ZINC000819042278	GH	On-Demand	Anodyne	HRH1	15	54
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccnc1	ZINC000819042278	GH	On-Demand	Anodyne	ADRB3	87	51
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccnc1	ZINC000819042278	GH	On-Demand	Anodyne	SIGMAR1	27	50
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccnc1	ZINC000819042278	GH	On-Demand	Anodyne	SSTR5	66	39
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccnc1	ZINC000819042278	GH	On-Demand	Anodyne	CCR3	37	54
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccnc1	ZINC000819042278	GH	On-Demand	Anodyne	CYP51A1	16	45
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccnc1	ZINC000819042278	GH	On-Demand	Anodyne	MCHR1	30	46
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccnc1	ZINC000819042279	GH	On-Demand	Anodyne	ADRB1	31	41
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccnc1	ZINC000819042279	GH	On-Demand	Anodyne	DRD4	16	41
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccnc1	ZINC000819042279	GH	On-Demand	Anodyne	HRH1	15	54
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccnc1	ZINC000819042279	GH	On-Demand	Anodyne	ADRB3	87	51
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccnc1	ZINC000819042279	GH	On-Demand	Anodyne	SIGMAR1	27	50
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccnc1	ZINC000819042279	GH	On-Demand	Anodyne	SSTR5	66	39
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccnc1	ZINC000819042279	GH	On-Demand	Anodyne	CCR3	37	54
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccnc1	ZINC000819042279	GH	On-Demand	Anodyne	CYP51A1	16	45
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1cccnc1	ZINC000819042279	GH	On-Demand	Anodyne	MCHR1	30	46
O=[S@](CCNC[C@H](O)c1ccc(Cl)c(F)c1)Cc1ccccc1	ZINC000819042302	FG	On-Demand	Anodyne	ADRB1	34	41
O=[S@](CCNC[C@H](O)c1ccc(Cl)c(F)c1)Cc1ccccc1	ZINC000819042302	FG	On-Demand	Anodyne	ADRB3	44	41
CCNS(=O)(=O)CCNCCC(=O)Nc1cccc(Br)c1	ZINC000819042303	GD	On-Demand	Anodyne	EGFR	22	43
CCNS(=O)(=O)CCNCCC(=O)Nc1cccc(Br)c1	ZINC000819042303	GD	On-Demand	Anodyne	HDAC2	15	43
O=[S@@](CCNC[C@@H](O)c1ccc(Cl)c(F)c1)Cc1ccccc1	ZINC000819042304	FG	On-Demand	Anodyne	ADRB1	34	41
O=[S@@](CCNC[C@@H](O)c1ccc(Cl)c(F)c1)Cc1ccccc1	ZINC000819042304	FG	On-Demand	Anodyne	ADRB3	44	41
CC(=O)Nc1cccc(CC(=O)N2CC=C(c3ccc(C)cc3)CC2)c1	ZINC000819042305	EH	On-Demand	Anodyne	P2RY14	47	41
O=[S@@](CCNC[C@H](O)c1ccc(Cl)c(F)c1)Cc1ccccc1	ZINC000819042306	FG	On-Demand	Anodyne	ADRB1	34	41
O=[S@@](CCNC[C@H](O)c1ccc(Cl)c(F)c1)Cc1ccccc1	ZINC000819042306	FG	On-Demand	Anodyne	ADRB3	44	41
O=[S@](CCNC[C@@H](O)c1ccc(Cl)c(F)c1)Cc1ccccc1	ZINC000819042308	FG	On-Demand	Anodyne	ADRB1	34	41
O=[S@](CCNC[C@@H](O)c1ccc(Cl)c(F)c1)Cc1ccccc1	ZINC000819042308	FG	On-Demand	Anodyne	ADRB3	44	41
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819042322	GD	On-Demand	Anodyne	ADRB2	66	49
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819042322	GD	On-Demand	Anodyne	ADRB1	101	49
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819042322	GD	On-Demand	Anodyne	GRIN1	21	48
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819042322	GD	On-Demand	Anodyne	ADRB3	74	49
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819042322	GD	On-Demand	Anodyne	ABCB1	16	48
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819042323	GD	On-Demand	Anodyne	ADRB2	66	49
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819042323	GD	On-Demand	Anodyne	ADRB1	101	49
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819042323	GD	On-Demand	Anodyne	GRIN1	21	48
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819042323	GD	On-Demand	Anodyne	ADRB3	74	49
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819042323	GD	On-Demand	Anodyne	ABCB1	16	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(-c3csc(C)n3)cc1)C2	ZINC000819042331	GH	On-Demand	Anodyne	VHL	65	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(-c3csc(C)n3)cc1)C2	ZINC000819042332	GH	On-Demand	Anodyne	VHL	65	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cccc(C)c3)CC1)C2	ZINC000819042334	FF	On-Demand	Anodyne	SSTR1	67	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cccc(C)c3)CC1)C2	ZINC000819042334	FF	On-Demand	Anodyne	ADAM10	40	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cccc(C)c3)CC1)C2	ZINC000819042335	FF	On-Demand	Anodyne	SSTR1	67	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cccc(C)c3)CC1)C2	ZINC000819042335	FF	On-Demand	Anodyne	ADAM10	40	43
CCNS(=O)(=O)CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819042339	DC	On-Demand	Anodyne	ADRB2	15	43
CCNS(=O)(=O)CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819042339	DC	On-Demand	Anodyne	ADRB1	29	41
CCNS(=O)(=O)CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819042339	DC	On-Demand	Anodyne	ADRB3	29	44
CCNS(=O)(=O)CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819042341	DC	On-Demand	Anodyne	ADRB2	15	43
CCNS(=O)(=O)CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819042341	DC	On-Demand	Anodyne	ADRB1	29	41
CCNS(=O)(=O)CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819042341	DC	On-Demand	Anodyne	ADRB3	29	44
O=[S@](CCNC[C@@H](O)c1ccc(C(F)(F)F)cc1)Cc1ccccc1	ZINC000819042342	FG	On-Demand	Anodyne	ADRB3	27	41
O=[S@@](CCNC[C@H](O)c1ccc(C(F)(F)F)cc1)Cc1ccccc1	ZINC000819042344	FG	On-Demand	Anodyne	ADRB3	27	41
CCNS(=O)(=O)CCNC[C@H](O)COc1c(C)ccc(C)c1C	ZINC000819042345	EC	On-Demand	Anodyne	ADRB2	34	41
CCNS(=O)(=O)CCNC[C@H](O)COc1c(C)ccc(C)c1C	ZINC000819042345	EC	On-Demand	Anodyne	ADRB1	32	41
CCNS(=O)(=O)CCNC[C@H](O)COc1c(C)ccc(C)c1C	ZINC000819042345	EC	On-Demand	Anodyne	ADRB3	21	41
O=[S@@](CCNC[C@@H](O)c1ccc(C(F)(F)F)cc1)Cc1ccccc1	ZINC000819042346	FG	On-Demand	Anodyne	ADRB3	27	41
O=[S@](CCNC[C@H](O)c1ccc(C(F)(F)F)cc1)Cc1ccccc1	ZINC000819042347	FG	On-Demand	Anodyne	ADRB3	27	41
CCNS(=O)(=O)CCNC[C@@H](O)COc1c(C)ccc(C)c1C	ZINC000819042352	EC	On-Demand	Anodyne	ADRB2	34	41
CCNS(=O)(=O)CCNC[C@@H](O)COc1c(C)ccc(C)c1C	ZINC000819042352	EC	On-Demand	Anodyne	ADRB1	32	41
CCNS(=O)(=O)CCNC[C@@H](O)COc1c(C)ccc(C)c1C	ZINC000819042352	EC	On-Demand	Anodyne	ADRB3	21	41
CC(=O)Nc1cccc(CC(=O)NCCCOc2ccccc2F)c1	ZINC000819042365	EF	On-Demand	Anodyne	PTGIR	17	42
CC(=O)Nc1cccc(CC(=O)NCCCOc2ccccc2F)c1	ZINC000819042365	EF	On-Demand	Anodyne	MTNR1A	34	40
CC(=O)Nc1cccc(CC(=O)NCCCOc2ccccc2F)c1	ZINC000819042365	EF	On-Demand	Anodyne	MTNR1B	36	41
CC(=O)Nc1cccc(CC(=O)NCCCOc2ccccc2F)c1	ZINC000819042365	EF	On-Demand	Anodyne	KCNK3	62	37
CC(=O)Nc1cccc(CC(=O)NCCCOc2ccccc2F)c1	ZINC000819042365	EF	On-Demand	Anodyne	KCNK9	61	37
O=[N+]([O-])c1ccc([C@@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819042367	EE	On-Demand	Bother	ADRB2	16	40
O=[N+]([O-])c1ccc([C@@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819042367	EE	On-Demand	Bother	ADRB1	17	40
O=[N+]([O-])c1ccc([C@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819042368	EE	On-Demand	Bother	ADRB2	16	40
O=[N+]([O-])c1ccc([C@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819042368	EE	On-Demand	Bother	ADRB1	17	40
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819042369	DC	On-Demand	Anodyne	ADRB2	59	50
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819042369	DC	On-Demand	Anodyne	ADRB1	88	50
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819042369	DC	On-Demand	Anodyne	GRIN1	23	57
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819042369	DC	On-Demand	Anodyne	ADRB3	55	50
O=[N+]([O-])c1ccc([C@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819042370	EE	On-Demand	Bother	ADRB2	16	40
O=[N+]([O-])c1ccc([C@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819042370	EE	On-Demand	Bother	ADRB1	17	40
O=[N+]([O-])c1ccc([C@@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819042371	EE	On-Demand	Bother	ADRB2	16	40
O=[N+]([O-])c1ccc([C@@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819042371	EE	On-Demand	Bother	ADRB1	17	40
N#Cc1ccc([C@@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819042372	EE	On-Demand	Mild	ADRB3	21	42
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(F)cc1	ZINC000819042373	DC	On-Demand	Anodyne	ADRB2	59	50
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(F)cc1	ZINC000819042373	DC	On-Demand	Anodyne	ADRB1	88	50
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(F)cc1	ZINC000819042373	DC	On-Demand	Anodyne	GRIN1	23	57
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(F)cc1	ZINC000819042373	DC	On-Demand	Anodyne	ADRB3	55	50
N#Cc1ccc([C@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819042379	EE	On-Demand	Mild	ADRB3	21	42
N#Cc1ccc([C@@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819042380	EE	On-Demand	Mild	ADRB3	21	42
N#Cc1ccc([C@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819042382	EE	On-Demand	Mild	ADRB3	21	42
CCCCN1CCC(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819042384	GF	On-Demand	Anodyne	GPR119	25	41
COC[C@@H](O)CNCC[S@@](=O)Cc1ccccc1	ZINC000819042388	CC	On-Demand	Anodyne	ADRB2	44	41
COC[C@@H](O)CNCC[S@@](=O)Cc1ccccc1	ZINC000819042388	CC	On-Demand	Anodyne	ADRB1	55	41
COC[C@@H](O)CNCC[S@@](=O)Cc1ccccc1	ZINC000819042388	CC	On-Demand	Anodyne	ADRB3	33	41
CCCCN1CCC(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819042389	GF	On-Demand	Anodyne	GPR119	25	41
COC[C@@H](O)CNCC[S@](=O)Cc1ccccc1	ZINC000819042390	CC	On-Demand	Anodyne	ADRB2	44	41
COC[C@@H](O)CNCC[S@](=O)Cc1ccccc1	ZINC000819042390	CC	On-Demand	Anodyne	ADRB1	55	41
COC[C@@H](O)CNCC[S@](=O)Cc1ccccc1	ZINC000819042390	CC	On-Demand	Anodyne	ADRB3	33	41
C=C(C)C(C)(C)C(=O)NCCCOc1cccc(C)c1	ZINC000819042394	CG	On-Demand	Mild	MTNR1A	32	46
C=C(C)C(C)(C)C(=O)NCCCOc1cccc(C)c1	ZINC000819042394	CG	On-Demand	Mild	MTNR1B	27	46
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042397	GI	On-Demand	Anodyne	DRD2	17	41
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042397	GI	On-Demand	Anodyne	DRD4	50	43
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042397	GI	On-Demand	Anodyne	HRH1	27	56
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042397	GI	On-Demand	Anodyne	SLC6A3	29	54
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042397	GI	On-Demand	Anodyne	ADRB3	49	38
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042397	GI	On-Demand	Anodyne	LTA4H	17	40
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042397	GI	On-Demand	Anodyne	TACR2	23	44
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042397	GI	On-Demand	Anodyne	SIGMAR1	55	60
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042397	GI	On-Demand	Anodyne	SSTR5	69	43
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042397	GI	On-Demand	Anodyne	CCR3	58	56
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042397	GI	On-Demand	Anodyne	UTS2R	20	44
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042397	GI	On-Demand	Anodyne	CCR2	17	40
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042397	GI	On-Demand	Anodyne	MCHR1	43	55
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042397	GI	On-Demand	Anodyne	CACNA1G	19	41
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042410	GI	On-Demand	Anodyne	DRD2	17	41
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042410	GI	On-Demand	Anodyne	DRD4	50	43
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042410	GI	On-Demand	Anodyne	HRH1	27	56
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042410	GI	On-Demand	Anodyne	SLC6A3	29	54
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042410	GI	On-Demand	Anodyne	ADRB3	49	38
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042410	GI	On-Demand	Anodyne	LTA4H	17	40
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042410	GI	On-Demand	Anodyne	TACR2	23	44
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042410	GI	On-Demand	Anodyne	SIGMAR1	55	60
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042410	GI	On-Demand	Anodyne	SSTR5	69	43
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042410	GI	On-Demand	Anodyne	CCR3	58	56
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042410	GI	On-Demand	Anodyne	UTS2R	20	44
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042410	GI	On-Demand	Anodyne	CCR2	17	40
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042410	GI	On-Demand	Anodyne	MCHR1	43	55
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1	ZINC000819042410	GI	On-Demand	Anodyne	CACNA1G	19	41
C#CCNC(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819042411	FF	On-Demand	Mild	DRD4	34	43
C#CCNC(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819042411	FF	On-Demand	Mild	TACR2	18	43
C#CCNC(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819042411	FF	On-Demand	Mild	SIGMAR1	36	55
C#CCNC(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819042411	FF	On-Demand	Mild	SSTR5	84	44
C#CCNC(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819042411	FF	On-Demand	Mild	CCR3	34	48
C#CCNC(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819042411	FF	On-Demand	Mild	UTS2R	21	43
C#CCNC(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819042411	FF	On-Demand	Mild	MCHR1	50	52
C#CCNC(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819042411	FF	On-Demand	Mild	CACNA1G	28	45
C#CCNC(=O)CCNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819042411	FF	On-Demand	Mild	CACNA1I	40	39
O=[S@](CCNC[C@H](O)CCc1ccccc1)Cc1ccccc1	ZINC000819042427	EF	On-Demand	Anodyne	ANPEP	41	38
O=[S@@](CCNC[C@@H](O)CCc1ccccc1)Cc1ccccc1	ZINC000819042428	EF	On-Demand	Anodyne	ANPEP	41	38
O=[S@](CCNC[C@@H](O)CCc1ccccc1)Cc1ccccc1	ZINC000819042429	EF	On-Demand	Anodyne	ANPEP	41	38
O=[S@@](CCNC[C@H](O)CCc1ccccc1)Cc1ccccc1	ZINC000819042430	EF	On-Demand	Anodyne	ANPEP	41	38
O=[S@](CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)Cc1ccccc1	ZINC000819042431	GG	On-Demand	Anodyne	ADRB2	45	40
O=[S@](CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)Cc1ccccc1	ZINC000819042431	GG	On-Demand	Anodyne	ADRB1	49	37
O=[S@](CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)Cc1ccccc1	ZINC000819042431	GG	On-Demand	Anodyne	ADRB3	52	50
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819042432	GE	On-Demand	Anodyne	CCR5	31	43
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819042432	GE	On-Demand	Anodyne	CCR2	64	39
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819042434	GE	On-Demand	Anodyne	CCR5	31	43
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819042434	GE	On-Demand	Anodyne	CCR2	64	39
CCCCN1CCC(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819042442	FD	On-Demand	Anodyne	ADRB3	26	48
CCCCN1CCC(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819042442	FD	On-Demand	Anodyne	CCR5	29	42
CCCCN1CCC(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819042444	FD	On-Demand	Anodyne	ADRB3	26	48
CCCCN1CCC(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819042444	FD	On-Demand	Anodyne	CCR5	29	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(C(=O)NC3CC3)c1)C2	ZINC000819042451	FE	On-Demand	Anodyne	EPHX2	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(C(=O)NC3CC3)c1)C2	ZINC000819042451	FE	On-Demand	Anodyne	KCNK3	46	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(C(=O)NC3CC3)c1)C2	ZINC000819042454	FE	On-Demand	Anodyne	EPHX2	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(C(=O)NC3CC3)c1)C2	ZINC000819042454	FE	On-Demand	Anodyne	KCNK3	46	34
CCNS(=O)(=O)CCNC[C@H](O)COc1c(C)cccc1C	ZINC000819042459	EC	On-Demand	Anodyne	ADRB2	43	46
CCNS(=O)(=O)CCNC[C@H](O)COc1c(C)cccc1C	ZINC000819042459	EC	On-Demand	Anodyne	ADRB1	51	41
CCNS(=O)(=O)CCNC[C@H](O)COc1c(C)cccc1C	ZINC000819042459	EC	On-Demand	Anodyne	ADRB3	31	41
CCNS(=O)(=O)CCNC[C@@H](O)COc1c(C)cccc1C	ZINC000819042461	EC	On-Demand	Anodyne	ADRB2	43	46
CCNS(=O)(=O)CCNC[C@@H](O)COc1c(C)cccc1C	ZINC000819042461	EC	On-Demand	Anodyne	ADRB1	51	41
CCNS(=O)(=O)CCNC[C@@H](O)COc1c(C)cccc1C	ZINC000819042461	EC	On-Demand	Anodyne	ADRB3	31	41
CCNS(=O)(=O)CCNC[C@H](O)Cc1ccccc1	ZINC000819042467	CC	On-Demand	Anodyne	MME	53	41
CCNS(=O)(=O)CCNC[C@@H](O)Cc1ccccc1	ZINC000819042469	CC	On-Demand	Anodyne	MME	53	41
O=C(NCCCOc1ccccc1)C(F)=C1CCC1	ZINC000819042474	CF	On-Demand	Anodyne	HRH2	27	40
CCNS(=O)(=O)CCNC[C@@H](O)COCc1ccccc1F	ZINC000819042486	EC	On-Demand	Anodyne	ADRB1	21	41
CCNS(=O)(=O)CCNC[C@H](O)COCc1ccccc1F	ZINC000819042487	EC	On-Demand	Anodyne	ADRB1	21	41
CCNS(=O)(=O)CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819042514	GC	On-Demand	Anodyne	GPR119	36	45
CCNS(=O)(=O)CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819042516	GC	On-Demand	Anodyne	GPR119	36	45
CN(C)C(=O)c1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819042537	GF	On-Demand	Mild	PAPA1_CARPA	52	47
CN(C)C(=O)c1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819042537	GF	On-Demand	Mild	CTSK	21	45
CN(C)C(=O)c1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819042539	GF	On-Demand	Mild	PAPA1_CARPA	52	47
CN(C)C(=O)c1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819042539	GF	On-Demand	Mild	CTSK	21	45
N#C[C@@H](c1ccccc1)N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819042566	DF	On-Demand	Mild	PTAFR	43	51
N#C[C@H](c1ccccc1)N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819042567	DF	On-Demand	Mild	PTAFR	43	51
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000819042590	FD	On-Demand	Anodyne	ADRB2	35	46
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000819042590	FD	On-Demand	Anodyne	ADRB1	40	40
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000819042592	FD	On-Demand	Anodyne	ADRB2	35	46
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000819042592	FD	On-Demand	Anodyne	ADRB1	40	40
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819042599	FE	On-Demand	Anodyne	DRD4	17	41
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819042599	FE	On-Demand	Anodyne	HTR4	41	35
CCCCN1CCC(NC[C@@H](O)c2ccc(C)cc2)CC1	ZINC000819042601	CF	On-Demand	Anodyne	ADRB3	17	44
CCCCN1CCC(NC[C@H](O)c2ccc(C)cc2)CC1	ZINC000819042603	CF	On-Demand	Anodyne	ADRB3	17	44
Cn1cccc1[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042611	FG	On-Demand	Mild	F2	21	43
Cn1cccc1[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042611	FG	On-Demand	Mild	CELA1	24	43
Cn1cccc1[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042611	FG	On-Demand	Mild	CMA1	33	41
Cn1cccc1[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042611	FG	On-Demand	Mild	PRCP	15	48
Cn1cccc1[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042611	FG	On-Demand	Mild	TRY1_BOVIN	39	43
Cn1cccc1[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042611	FG	On-Demand	Mild	PREP	18	41
Cn1cccc1[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042611	FG	On-Demand	Mild	LGMN	57	33
O=[S@@](CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)Cc1ccccc1	ZINC000819042612	GG	On-Demand	Anodyne	ADRB2	45	40
O=[S@@](CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)Cc1ccccc1	ZINC000819042612	GG	On-Demand	Anodyne	ADRB1	49	37
O=[S@@](CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)Cc1ccccc1	ZINC000819042612	GG	On-Demand	Anodyne	ADRB3	52	50
O=[S@@](CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)Cc1ccccc1	ZINC000819042614	GG	On-Demand	Anodyne	ADRB2	45	40
O=[S@@](CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)Cc1ccccc1	ZINC000819042614	GG	On-Demand	Anodyne	ADRB1	49	37
O=[S@@](CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)Cc1ccccc1	ZINC000819042614	GG	On-Demand	Anodyne	ADRB3	52	50
O=[S@](CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)Cc1ccccc1	ZINC000819042615	GG	On-Demand	Anodyne	ADRB2	45	40
O=[S@](CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)Cc1ccccc1	ZINC000819042615	GG	On-Demand	Anodyne	ADRB1	49	37
O=[S@](CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)Cc1ccccc1	ZINC000819042615	GG	On-Demand	Anodyne	ADRB3	52	50
CC(=O)c1ccc(N2CCN(C(=O)C[C@H](C)n3cccn3)CC2)c(F)c1	ZINC000819042616	FF	On-Demand	Anodyne	NPY2R	82	36
CC(=O)c1ccc(N2CCN(C(=O)C[C@H](C)n3cccn3)CC2)c(F)c1	ZINC000819042616	FF	On-Demand	Anodyne	SLC6A9	24	45
CC(=O)c1ccc(N2CCN(C(=O)C[C@@H](C)n3cccn3)CC2)c(F)c1	ZINC000819042617	FF	On-Demand	Anodyne	NPY2R	82	36
CC(=O)c1ccc(N2CCN(C(=O)C[C@@H](C)n3cccn3)CC2)c(F)c1	ZINC000819042617	FF	On-Demand	Anodyne	SLC6A9	24	45
CCCCN1CCC(NC[C@H](O)c2ccc(Cl)cc2Cl)CC1	ZINC000819042620	EH	On-Demand	Anodyne	HTR4	36	40
CCCCN1CCC(NC[C@H](O)c2ccc(Cl)cc2Cl)CC1	ZINC000819042620	EH	On-Demand	Anodyne	ADRB3	16	40
CCCCN1CCC(NC[C@@H](O)c2ccc(Cl)cc2Cl)CC1	ZINC000819042621	EH	On-Demand	Anodyne	HTR4	36	40
CCCCN1CCC(NC[C@@H](O)c2ccc(Cl)cc2Cl)CC1	ZINC000819042621	EH	On-Demand	Anodyne	ADRB3	16	40
CCNS(=O)(=O)CCNCCC(=O)Nc1cccc(F)c1	ZINC000819042623	DC	On-Demand	Anodyne	HDAC3	17	40
CCNS(=O)(=O)CCNC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819042624	FD	On-Demand	Anodyne	ADRB2	44	46
CCNS(=O)(=O)CCNC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819042624	FD	On-Demand	Anodyne	ADRB1	50	42
CCNS(=O)(=O)CCNC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819042624	FD	On-Demand	Anodyne	ADRB3	33	40
CCNS(=O)(=O)CCNC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819042625	FD	On-Demand	Anodyne	ADRB2	44	46
CCNS(=O)(=O)CCNC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819042625	FD	On-Demand	Anodyne	ADRB1	50	42
CCNS(=O)(=O)CCNC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819042625	FD	On-Demand	Anodyne	ADRB3	33	40
Cn1cccc1[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042627	FG	On-Demand	Mild	F2	21	43
Cn1cccc1[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042627	FG	On-Demand	Mild	CELA1	24	43
Cn1cccc1[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042627	FG	On-Demand	Mild	CMA1	33	41
Cn1cccc1[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042627	FG	On-Demand	Mild	PRCP	15	48
Cn1cccc1[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042627	FG	On-Demand	Mild	TRY1_BOVIN	39	43
Cn1cccc1[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042627	FG	On-Demand	Mild	PREP	18	41
Cn1cccc1[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042627	FG	On-Demand	Mild	LGMN	57	33
Cn1cccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042628	FG	On-Demand	Mild	F2	21	43
Cn1cccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042628	FG	On-Demand	Mild	CELA1	24	43
Cn1cccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042628	FG	On-Demand	Mild	CMA1	33	41
Cn1cccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042628	FG	On-Demand	Mild	PRCP	15	48
Cn1cccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042628	FG	On-Demand	Mild	TRY1_BOVIN	39	43
Cn1cccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042628	FG	On-Demand	Mild	PREP	18	41
Cn1cccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042628	FG	On-Demand	Mild	LGMN	57	33
Cn1cccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042629	FG	On-Demand	Mild	F2	21	43
Cn1cccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042629	FG	On-Demand	Mild	CELA1	24	43
Cn1cccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042629	FG	On-Demand	Mild	CMA1	33	41
Cn1cccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042629	FG	On-Demand	Mild	PRCP	15	48
Cn1cccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042629	FG	On-Demand	Mild	TRY1_BOVIN	39	43
Cn1cccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042629	FG	On-Demand	Mild	PREP	18	41
Cn1cccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819042629	FG	On-Demand	Mild	LGMN	57	33
Cc1ccc(OC[C@H](O)CNCC[S@](=O)Cc2ccccc2)c(C)c1	ZINC000819042636	FF	On-Demand	Anodyne	ADRB2	41	47
Cc1ccc(OC[C@H](O)CNCC[S@](=O)Cc2ccccc2)c(C)c1	ZINC000819042636	FF	On-Demand	Anodyne	ADRB1	55	43
Cc1ccc(OC[C@H](O)CNCC[S@](=O)Cc2ccccc2)c(C)c1	ZINC000819042636	FF	On-Demand	Anodyne	ADRB3	32	43
Cc1ccc(OC[C@H](O)CNCC[S@](=O)Cc2ccccc2)c(C)c1	ZINC000819042636	FF	On-Demand	Anodyne	ABCB1	37	43
Cc1ccc(OC[C@@H](O)CNCC[S@](=O)Cc2ccccc2)c(C)c1	ZINC000819042638	FF	On-Demand	Anodyne	ADRB2	41	47
Cc1ccc(OC[C@@H](O)CNCC[S@](=O)Cc2ccccc2)c(C)c1	ZINC000819042638	FF	On-Demand	Anodyne	ADRB1	55	43
Cc1ccc(OC[C@@H](O)CNCC[S@](=O)Cc2ccccc2)c(C)c1	ZINC000819042638	FF	On-Demand	Anodyne	ADRB3	32	43
Cc1ccc(OC[C@@H](O)CNCC[S@](=O)Cc2ccccc2)c(C)c1	ZINC000819042638	FF	On-Demand	Anodyne	ABCB1	37	43
Cc1ccc(OC[C@H](O)CNCC[S@@](=O)Cc2ccccc2)c(C)c1	ZINC000819042641	FF	On-Demand	Anodyne	ADRB2	41	47
Cc1ccc(OC[C@H](O)CNCC[S@@](=O)Cc2ccccc2)c(C)c1	ZINC000819042641	FF	On-Demand	Anodyne	ADRB1	55	43
Cc1ccc(OC[C@H](O)CNCC[S@@](=O)Cc2ccccc2)c(C)c1	ZINC000819042641	FF	On-Demand	Anodyne	ADRB3	32	43
Cc1ccc(OC[C@H](O)CNCC[S@@](=O)Cc2ccccc2)c(C)c1	ZINC000819042641	FF	On-Demand	Anodyne	ABCB1	37	43
Cc1ccc(OC[C@@H](O)CNCC[S@@](=O)Cc2ccccc2)c(C)c1	ZINC000819042644	FF	On-Demand	Anodyne	ADRB2	41	47
Cc1ccc(OC[C@@H](O)CNCC[S@@](=O)Cc2ccccc2)c(C)c1	ZINC000819042644	FF	On-Demand	Anodyne	ADRB1	55	43
Cc1ccc(OC[C@@H](O)CNCC[S@@](=O)Cc2ccccc2)c(C)c1	ZINC000819042644	FF	On-Demand	Anodyne	ADRB3	32	43
Cc1ccc(OC[C@@H](O)CNCC[S@@](=O)Cc2ccccc2)c(C)c1	ZINC000819042644	FF	On-Demand	Anodyne	ABCB1	37	43
CC(=O)c1ccc(N2CCN(C(=O)[C@H]3C[C@H]3c3ccc(C)cc3)CC2)c(F)c1	ZINC000819042651	GH	On-Demand	Anodyne	MC4R	47	45
CC(=O)c1ccc(N2CCN(C(=O)[C@H]3C[C@H]3c3ccc(C)cc3)CC2)c(F)c1	ZINC000819042651	GH	On-Demand	Anodyne	SLC6A9	21	45
CC(=O)c1ccc(N2CCN(C(=O)[C@H]3C[C@@H]3c3ccc(C)cc3)CC2)c(F)c1	ZINC000819042658	GH	On-Demand	Anodyne	MC4R	47	45
CC(=O)c1ccc(N2CCN(C(=O)[C@H]3C[C@@H]3c3ccc(C)cc3)CC2)c(F)c1	ZINC000819042658	GH	On-Demand	Anodyne	SLC6A9	21	45
CC(=O)c1ccc(N2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(C)cc3)CC2)c(F)c1	ZINC000819042660	GH	On-Demand	Anodyne	MC4R	47	45
CC(=O)c1ccc(N2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(C)cc3)CC2)c(F)c1	ZINC000819042660	GH	On-Demand	Anodyne	SLC6A9	21	45
CC(=O)c1ccc(N2CCN(C(=O)[C@@H]3C[C@@H]3c3ccc(C)cc3)CC2)c(F)c1	ZINC000819042662	GH	On-Demand	Anodyne	MC4R	47	45
CC(=O)c1ccc(N2CCN(C(=O)[C@@H]3C[C@@H]3c3ccc(C)cc3)CC2)c(F)c1	ZINC000819042662	GH	On-Demand	Anodyne	SLC6A9	21	45
O=[S@](CCNC[C@H](O)c1ccc(F)cc1Cl)Cc1ccccc1	ZINC000819042670	FG	On-Demand	Anodyne	ADRB1	33	42
O=[S@@](CCNC[C@@H](O)c1ccc(F)cc1Cl)Cc1ccccc1	ZINC000819042672	FG	On-Demand	Anodyne	ADRB1	33	42
O=[S@@](CCNC[C@H](O)c1ccc(F)cc1Cl)Cc1ccccc1	ZINC000819042674	FG	On-Demand	Anodyne	ADRB1	33	42
O=[S@](CCNC[C@@H](O)c1ccc(F)cc1Cl)Cc1ccccc1	ZINC000819042677	FG	On-Demand	Anodyne	ADRB1	33	42
CCCCN1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819042689	DG	On-Demand	Anodyne	ADRB3	23	43
O=[S@@](CCNC[C@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042690	GG	On-Demand	Anodyne	ADRB2	59	52
O=[S@@](CCNC[C@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042690	GG	On-Demand	Anodyne	ADRB1	85	47
O=[S@@](CCNC[C@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042690	GG	On-Demand	Anodyne	ADRB3	56	48
O=[S@@](CCNC[C@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042690	GG	On-Demand	Anodyne	CASR	40	36
O=[S@@](CCNC[C@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042690	GG	On-Demand	Anodyne	ABCB1	23	46
O=[S@@](CCNC[C@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042690	GG	On-Demand	Anodyne	PDS	41	33
O=[S@](CCNC[C@@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042693	GG	On-Demand	Anodyne	ADRB2	59	52
O=[S@](CCNC[C@@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042693	GG	On-Demand	Anodyne	ADRB1	85	47
O=[S@](CCNC[C@@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042693	GG	On-Demand	Anodyne	ADRB3	56	48
O=[S@](CCNC[C@@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042693	GG	On-Demand	Anodyne	CASR	40	36
O=[S@](CCNC[C@@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042693	GG	On-Demand	Anodyne	ABCB1	23	46
O=[S@](CCNC[C@@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042693	GG	On-Demand	Anodyne	PDS	41	33
O=[S@](CCNC[C@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042695	GG	On-Demand	Anodyne	ADRB2	59	52
O=[S@](CCNC[C@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042695	GG	On-Demand	Anodyne	ADRB1	85	47
O=[S@](CCNC[C@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042695	GG	On-Demand	Anodyne	ADRB3	56	48
O=[S@](CCNC[C@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042695	GG	On-Demand	Anodyne	CASR	40	36
O=[S@](CCNC[C@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042695	GG	On-Demand	Anodyne	ABCB1	23	46
O=[S@](CCNC[C@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042695	GG	On-Demand	Anodyne	PDS	41	33
O=[S@@](CCNC[C@@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042699	GG	On-Demand	Anodyne	ADRB2	59	52
O=[S@@](CCNC[C@@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042699	GG	On-Demand	Anodyne	ADRB1	85	47
O=[S@@](CCNC[C@@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042699	GG	On-Demand	Anodyne	ADRB3	56	48
O=[S@@](CCNC[C@@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042699	GG	On-Demand	Anodyne	CASR	40	36
O=[S@@](CCNC[C@@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042699	GG	On-Demand	Anodyne	ABCB1	23	46
O=[S@@](CCNC[C@@H](O)COc1ccc2ccccc2c1)Cc1ccccc1	ZINC000819042699	GG	On-Demand	Anodyne	PDS	41	33
CCNS(=O)(=O)CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819042700	DD	On-Demand	Anodyne	ADRB3	27	41
CCNS(=O)(=O)CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819042703	DD	On-Demand	Anodyne	ADRB3	27	41
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819042729	FD	On-Demand	Bother	CCR5	15	45
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819042732	FD	On-Demand	Bother	CCR5	15	45
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C)cc1	ZINC000819042741	DC	On-Demand	Anodyne	ADRB2	56	54
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C)cc1	ZINC000819042741	DC	On-Demand	Anodyne	ADRB1	80	51
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C)cc1	ZINC000819042741	DC	On-Demand	Anodyne	GRIN1	20	47
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C)cc1	ZINC000819042741	DC	On-Demand	Anodyne	ADRB3	50	51
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C)cc1	ZINC000819042743	DC	On-Demand	Anodyne	ADRB2	56	54
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C)cc1	ZINC000819042743	DC	On-Demand	Anodyne	ADRB1	80	51
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C)cc1	ZINC000819042743	DC	On-Demand	Anodyne	GRIN1	20	47
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C)cc1	ZINC000819042743	DC	On-Demand	Anodyne	ADRB3	50	51
O=[N+]([O-])c1cccc([C@@H](O)CNCC[S@@](=O)Cc2ccccc2)c1	ZINC000819042775	EE	On-Demand	Bother	ADRB2	22	40
O=[N+]([O-])c1cccc([C@@H](O)CNCC[S@@](=O)Cc2ccccc2)c1	ZINC000819042775	EE	On-Demand	Bother	ADRB1	34	40
O=[N+]([O-])c1cccc([C@@H](O)CNCC[S@@](=O)Cc2ccccc2)c1	ZINC000819042775	EE	On-Demand	Bother	ADRB3	47	35
CCNS(=O)(=O)CCNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819042776	GD	On-Demand	Anodyne	CYNT	45	52
O=[N+]([O-])c1cccc([C@H](O)CNCC[S@@](=O)Cc2ccccc2)c1	ZINC000819042777	EE	On-Demand	Bother	ADRB2	22	40
O=[N+]([O-])c1cccc([C@H](O)CNCC[S@@](=O)Cc2ccccc2)c1	ZINC000819042777	EE	On-Demand	Bother	ADRB1	34	40
O=[N+]([O-])c1cccc([C@H](O)CNCC[S@@](=O)Cc2ccccc2)c1	ZINC000819042777	EE	On-Demand	Bother	ADRB3	47	35
O=[N+]([O-])c1cccc([C@H](O)CNCC[S@](=O)Cc2ccccc2)c1	ZINC000819042779	EE	On-Demand	Bother	ADRB2	22	40
O=[N+]([O-])c1cccc([C@H](O)CNCC[S@](=O)Cc2ccccc2)c1	ZINC000819042779	EE	On-Demand	Bother	ADRB1	34	40
O=[N+]([O-])c1cccc([C@H](O)CNCC[S@](=O)Cc2ccccc2)c1	ZINC000819042779	EE	On-Demand	Bother	ADRB3	47	35
O=[N+]([O-])c1cccc([C@@H](O)CNCC[S@](=O)Cc2ccccc2)c1	ZINC000819042782	EE	On-Demand	Bother	ADRB2	22	40
O=[N+]([O-])c1cccc([C@@H](O)CNCC[S@](=O)Cc2ccccc2)c1	ZINC000819042782	EE	On-Demand	Bother	ADRB1	34	40
O=[N+]([O-])c1cccc([C@@H](O)CNCC[S@](=O)Cc2ccccc2)c1	ZINC000819042782	EE	On-Demand	Bother	ADRB3	47	35
Cc1cc(F)ccc1[C@@H](O)CNCC[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819042789	GH	On-Demand	Anodyne	GPR119	29	42
Cc1cc(F)ccc1[C@@H](O)CNCC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819042790	GH	On-Demand	Anodyne	GPR119	29	42
Cc1ccc(OC[C@@H](O)CNCC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819042797	GG	On-Demand	Anodyne	ADRB2	39	44
Cc1ccc(OC[C@@H](O)CNCC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819042797	GG	On-Demand	Anodyne	ADRB1	64	45
Cc1ccc(OC[C@@H](O)CNCC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819042797	GG	On-Demand	Anodyne	ADRB3	41	43
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1	ZINC000819042811	DB	On-Demand	Anodyne	ADRB2	72	56
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1	ZINC000819042811	DB	On-Demand	Anodyne	ADRB1	101	53
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1	ZINC000819042811	DB	On-Demand	Anodyne	GRIN1	20	47
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1	ZINC000819042811	DB	On-Demand	Anodyne	ADRB3	68	53
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1	ZINC000819042811	DB	On-Demand	Anodyne	ABCB1	19	49
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1	ZINC000819042811	DB	On-Demand	Anodyne	PDS	41	36
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1	ZINC000819042813	DB	On-Demand	Anodyne	ADRB2	72	56
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1	ZINC000819042813	DB	On-Demand	Anodyne	ADRB1	101	53
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1	ZINC000819042813	DB	On-Demand	Anodyne	GRIN1	20	47
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1	ZINC000819042813	DB	On-Demand	Anodyne	ADRB3	68	53
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1	ZINC000819042813	DB	On-Demand	Anodyne	ABCB1	19	49
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1	ZINC000819042813	DB	On-Demand	Anodyne	PDS	41	36
CCCCN1CCC(NC[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000819042815	EF	On-Demand	Anodyne	DRD2	20	41
CCCCN1CCC(NC[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000819042815	EF	On-Demand	Anodyne	DRD3	23	41
CCCCN1CCC(NC[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000819042815	EF	On-Demand	Anodyne	HTR4	50	43
CCCCN1CCC(NC[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000819042815	EF	On-Demand	Anodyne	SIGMAR1	19	49
CCCCN1CCC(NC[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000819042815	EF	On-Demand	Anodyne	EBP	44	36
CCCCN1CCC(NC[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000819042815	EF	On-Demand	Anodyne	EHMT2	53	30
CCCCN1CCC(NC[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000819042817	EF	On-Demand	Anodyne	DRD2	20	41
CCCCN1CCC(NC[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000819042817	EF	On-Demand	Anodyne	DRD3	23	41
CCCCN1CCC(NC[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000819042817	EF	On-Demand	Anodyne	HTR4	50	43
CCCCN1CCC(NC[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000819042817	EF	On-Demand	Anodyne	SIGMAR1	19	49
CCCCN1CCC(NC[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000819042817	EF	On-Demand	Anodyne	EBP	44	36
CCCCN1CCC(NC[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000819042817	EF	On-Demand	Anodyne	EHMT2	53	30
O=[S@](CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)Cc1ccccc1	ZINC000819042822	FG	On-Demand	Anodyne	ADRB3	46	39
O=[S@@](CCNC[C@H](O)c1cccc(C(F)(F)F)c1)Cc1ccccc1	ZINC000819042823	FG	On-Demand	Anodyne	ADRB3	46	39
O=[S@@](CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)Cc1ccccc1	ZINC000819042825	FG	On-Demand	Anodyne	ADRB3	46	39
O=[S@](CCNC[C@H](O)c1cccc(C(F)(F)F)c1)Cc1ccccc1	ZINC000819042827	FG	On-Demand	Anodyne	ADRB3	46	39
Cc1cc(F)ccc1[C@@H](O)CNCCc1nc(-c2ccc(Cl)cc2)no1	ZINC000819042833	GH	On-Demand	Anodyne	ADRB3	23	40
CCNS(=O)(=O)CCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819042838	ED	On-Demand	Anodyne	ADRB2	26	42
CCNS(=O)(=O)CCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819042839	ED	On-Demand	Anodyne	ADRB2	26	42
O=C(CCNCC[S@](=O)Cc1ccccc1)Nc1cccc(Cl)c1	ZINC000819042843	FG	On-Demand	Anodyne	KCNK3	24	40
O=C(CCNCC[S@@](=O)Cc1ccccc1)Nc1cccc(Cl)c1	ZINC000819042845	FG	On-Demand	Anodyne	KCNK3	24	40
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819042850	FD	On-Demand	Anodyne	ADRB2	54	49
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819042850	FD	On-Demand	Anodyne	ADRB1	74	49
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819042850	FD	On-Demand	Anodyne	GRIN1	18	45
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819042850	FD	On-Demand	Anodyne	ADRB3	48	49
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819042852	FD	On-Demand	Anodyne	ADRB2	54	49
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819042852	FD	On-Demand	Anodyne	ADRB1	74	49
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819042852	FD	On-Demand	Anodyne	GRIN1	18	45
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819042852	FD	On-Demand	Anodyne	ADRB3	48	49
CCNS(=O)(=O)CCNC[C@@H](O)CCc1ccccc1	ZINC000819042860	DC	On-Demand	Anodyne	ADRB2	35	41
CCNS(=O)(=O)CCNC[C@@H](O)CCc1ccccc1	ZINC000819042860	DC	On-Demand	Anodyne	ADRB1	39	41
CCNS(=O)(=O)CCNC[C@@H](O)CCc1ccccc1	ZINC000819042860	DC	On-Demand	Anodyne	ADRB3	43	41
CCNS(=O)(=O)CCNC[C@H](O)CCc1ccccc1	ZINC000819042861	DC	On-Demand	Anodyne	ADRB2	35	41
CCNS(=O)(=O)CCNC[C@H](O)CCc1ccccc1	ZINC000819042861	DC	On-Demand	Anodyne	ADRB1	39	41
CCNS(=O)(=O)CCNC[C@H](O)CCc1ccccc1	ZINC000819042861	DC	On-Demand	Anodyne	ADRB3	43	41
Cc1ccc(OC[C@@H](O)CNCC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819042866	GG	On-Demand	Anodyne	ADRB2	39	44
Cc1ccc(OC[C@@H](O)CNCC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819042866	GG	On-Demand	Anodyne	ADRB1	64	45
Cc1ccc(OC[C@@H](O)CNCC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819042866	GG	On-Demand	Anodyne	ADRB3	41	43
Cc1ccc(OC[C@H](O)CNCC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819042871	GG	On-Demand	Anodyne	ADRB2	39	44
Cc1ccc(OC[C@H](O)CNCC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819042871	GG	On-Demand	Anodyne	ADRB1	64	45
Cc1ccc(OC[C@H](O)CNCC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819042871	GG	On-Demand	Anodyne	ADRB3	41	43
Cc1ccc(OC[C@H](O)CNCC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819042874	GG	On-Demand	Anodyne	ADRB2	39	44
Cc1ccc(OC[C@H](O)CNCC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819042874	GG	On-Demand	Anodyne	ADRB1	64	45
Cc1ccc(OC[C@H](O)CNCC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819042874	GG	On-Demand	Anodyne	ADRB3	41	43
NC(=O)c1cn([C@@H]2CCN(C(=S)NCc3cccc(C(F)(F)F)c3)C2)nn1	ZINC000819042877	GD	On-Demand	Anodyne	CCR2	78	36
NC(=O)c1cn([C@H]2CCN(C(=S)NCc3cccc(C(F)(F)F)c3)C2)nn1	ZINC000819042880	GD	On-Demand	Anodyne	CCR2	78	36
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819042884	FD	On-Demand	Anodyne	ADRB2	57	62
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819042884	FD	On-Demand	Anodyne	ADRB1	68	58
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819042884	FD	On-Demand	Anodyne	ADRB3	41	58
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819042884	FD	On-Demand	Anodyne	CYP2D6	21	45
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819042884	FD	On-Demand	Anodyne	ABCB1	21	44
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819042886	FD	On-Demand	Anodyne	ADRB2	57	62
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819042886	FD	On-Demand	Anodyne	ADRB1	68	58
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819042886	FD	On-Demand	Anodyne	ADRB3	41	58
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819042886	FD	On-Demand	Anodyne	CYP2D6	21	45
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819042886	FD	On-Demand	Anodyne	ABCB1	21	44
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819042893	FD	On-Demand	Anodyne	ADRB1	36	46
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819042893	FD	On-Demand	Anodyne	ADRB3	57	48
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819042893	FD	On-Demand	Anodyne	IGF1R	30	40
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819042893	FD	On-Demand	Anodyne	CCR5	35	41
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819042893	FD	On-Demand	Anodyne	CYP3A4	50	40
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819042895	FD	On-Demand	Anodyne	ADRB1	36	46
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819042895	FD	On-Demand	Anodyne	ADRB3	57	48
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819042895	FD	On-Demand	Anodyne	IGF1R	30	40
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819042895	FD	On-Demand	Anodyne	CCR5	35	41
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819042895	FD	On-Demand	Anodyne	CYP3A4	50	40
O=C(C(F)=C1CCC1)N1CCC(OCc2ccccc2)CC1	ZINC000819042898	DH	On-Demand	Anodyne	GRIN2B	37	47
O=C(C(F)=C1CCC1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819042906	FE	On-Demand	Anodyne	PKM	29	42
O=C(C(F)=C1CCC1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819042906	FE	On-Demand	Anodyne	TGM2	50	40
O=C(C(F)=C1CCC1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819042906	FE	On-Demand	Anodyne	F13A1	59	40
CCNS(=O)(=O)CCNC[C@H](O)COc1cc(C)cc(C)c1	ZINC000819042917	EC	On-Demand	Anodyne	ADRB2	42	54
CCNS(=O)(=O)CCNC[C@H](O)COc1cc(C)cc(C)c1	ZINC000819042917	EC	On-Demand	Anodyne	ADRB1	52	46
CCNS(=O)(=O)CCNC[C@H](O)COc1cc(C)cc(C)c1	ZINC000819042917	EC	On-Demand	Anodyne	ADRB3	35	46
CCNS(=O)(=O)CCNC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000819042919	EC	On-Demand	Anodyne	ADRB2	42	54
CCNS(=O)(=O)CCNC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000819042919	EC	On-Demand	Anodyne	ADRB1	52	46
CCNS(=O)(=O)CCNC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000819042919	EC	On-Demand	Anodyne	ADRB3	35	46
O=[S@](CCNC[C@H](O)c1ccc(Cl)cc1Cl)Cc1ccccc1	ZINC000819042943	FH	On-Demand	Anodyne	ADRB2	40	48
O=[S@](CCNC[C@H](O)c1ccc(Cl)cc1Cl)Cc1ccccc1	ZINC000819042943	FH	On-Demand	Anodyne	ADRB1	41	48
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819042945	FD	On-Demand	Anodyne	OPRL1	40	38
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819042945	FD	On-Demand	Anodyne	ADRB3	18	46
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819042945	FD	On-Demand	Anodyne	SIGMAR1	18	45
O=[S@@](CCNC[C@@H](O)c1ccc(Cl)cc1Cl)Cc1ccccc1	ZINC000819042946	FH	On-Demand	Anodyne	ADRB2	40	48
O=[S@@](CCNC[C@@H](O)c1ccc(Cl)cc1Cl)Cc1ccccc1	ZINC000819042946	FH	On-Demand	Anodyne	ADRB1	41	48
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819042947	FD	On-Demand	Anodyne	ADRB2	35	44
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819042947	FD	On-Demand	Anodyne	VDR	22	43
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819042949	FD	On-Demand	Anodyne	ADRB2	35	44
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819042949	FD	On-Demand	Anodyne	VDR	22	43
O=[S@@](CCNC[C@H](O)c1ccc(Cl)cc1Cl)Cc1ccccc1	ZINC000819042955	FH	On-Demand	Anodyne	ADRB2	40	48
O=[S@@](CCNC[C@H](O)c1ccc(Cl)cc1Cl)Cc1ccccc1	ZINC000819042955	FH	On-Demand	Anodyne	ADRB1	41	48
O=[S@](CCNC[C@@H](O)c1ccc(Cl)cc1Cl)Cc1ccccc1	ZINC000819042958	FH	On-Demand	Anodyne	ADRB2	40	48
O=[S@](CCNC[C@@H](O)c1ccc(Cl)cc1Cl)Cc1ccccc1	ZINC000819042958	FH	On-Demand	Anodyne	ADRB1	41	48
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819042966	EB	On-Demand	Mild	ADRB2	48	48
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819042966	EB	On-Demand	Mild	ADRB1	77	48
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819042966	EB	On-Demand	Mild	GRIN1	16	45
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819042966	EB	On-Demand	Mild	ADRB3	44	48
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819042973	EB	On-Demand	Mild	ADRB2	48	48
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819042973	EB	On-Demand	Mild	ADRB1	77	48
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819042973	EB	On-Demand	Mild	GRIN1	16	45
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819042973	EB	On-Demand	Mild	ADRB3	44	48
O=[S@](CCNC[C@H](O)c1cccc(Cl)c1)Cc1ccccc1	ZINC000819043002	EF	On-Demand	Anodyne	ADRB2	75	46
O=[S@](CCNC[C@H](O)c1cccc(Cl)c1)Cc1ccccc1	ZINC000819043002	EF	On-Demand	Anodyne	ADRB1	77	54
O=[S@](CCNC[C@H](O)c1cccc(Cl)c1)Cc1ccccc1	ZINC000819043002	EF	On-Demand	Anodyne	ADRB3	92	54
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819043003	FE	On-Demand	Anodyne	MAPK14	22	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819043003	FE	On-Demand	Anodyne	EPHX2	17	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819043003	FE	On-Demand	Anodyne	KCNK3	79	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819043003	FE	On-Demand	Anodyne	KCNK9	44	35
O=[S@@](CCNC[C@H](O)c1cccc(Cl)c1)Cc1ccccc1	ZINC000819043005	EF	On-Demand	Anodyne	ADRB2	75	46
O=[S@@](CCNC[C@H](O)c1cccc(Cl)c1)Cc1ccccc1	ZINC000819043005	EF	On-Demand	Anodyne	ADRB1	77	54
O=[S@@](CCNC[C@H](O)c1cccc(Cl)c1)Cc1ccccc1	ZINC000819043005	EF	On-Demand	Anodyne	ADRB3	92	54
O=[S@](CCNC[C@@H](O)c1cccc(Cl)c1)Cc1ccccc1	ZINC000819043006	EF	On-Demand	Anodyne	ADRB2	75	46
O=[S@](CCNC[C@@H](O)c1cccc(Cl)c1)Cc1ccccc1	ZINC000819043006	EF	On-Demand	Anodyne	ADRB1	77	54
O=[S@](CCNC[C@@H](O)c1cccc(Cl)c1)Cc1ccccc1	ZINC000819043006	EF	On-Demand	Anodyne	ADRB3	92	54
O=[S@@](CCNC[C@@H](O)c1cccc(Cl)c1)Cc1ccccc1	ZINC000819043010	EF	On-Demand	Anodyne	ADRB2	75	46
O=[S@@](CCNC[C@@H](O)c1cccc(Cl)c1)Cc1ccccc1	ZINC000819043010	EF	On-Demand	Anodyne	ADRB1	77	54
O=[S@@](CCNC[C@@H](O)c1cccc(Cl)c1)Cc1ccccc1	ZINC000819043010	EF	On-Demand	Anodyne	ADRB3	92	54
CCNS(=O)(=O)CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819043014	FD	On-Demand	Anodyne	ADRB3	34	44
CCNS(=O)(=O)CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819043016	FD	On-Demand	Anodyne	ADRB3	34	44
O=[S@](CCNC[C@H](O)c1cccc(Br)c1)Cc1ccccc1	ZINC000819043018	GG	On-Demand	Anodyne	ADRB1	42	39
O=[S@](CCNC[C@H](O)c1cccc(Br)c1)Cc1ccccc1	ZINC000819043018	GG	On-Demand	Anodyne	ADRB3	59	39
O=[S@@](CCNC[C@H](O)c1cccc(Br)c1)Cc1ccccc1	ZINC000819043020	GG	On-Demand	Anodyne	ADRB1	42	39
O=[S@@](CCNC[C@H](O)c1cccc(Br)c1)Cc1ccccc1	ZINC000819043020	GG	On-Demand	Anodyne	ADRB3	59	39
O=[S@](CCNC[C@@H](O)c1cccc(Br)c1)Cc1ccccc1	ZINC000819043022	GG	On-Demand	Anodyne	ADRB1	42	39
O=[S@](CCNC[C@@H](O)c1cccc(Br)c1)Cc1ccccc1	ZINC000819043022	GG	On-Demand	Anodyne	ADRB3	59	39
O=[S@@](CCNC[C@@H](O)c1cccc(Br)c1)Cc1ccccc1	ZINC000819043024	GG	On-Demand	Anodyne	ADRB1	42	39
O=[S@@](CCNC[C@@H](O)c1cccc(Br)c1)Cc1ccccc1	ZINC000819043024	GG	On-Demand	Anodyne	ADRB3	59	39
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1F	ZINC000819043044	DC	On-Demand	Anodyne	ADRB2	49	47
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1F	ZINC000819043044	DC	On-Demand	Anodyne	ADRB1	66	44
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1F	ZINC000819043044	DC	On-Demand	Anodyne	ADRB3	36	44
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1F	ZINC000819043044	DC	On-Demand	Anodyne	ABCB1	18	44
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1F	ZINC000819043047	DC	On-Demand	Anodyne	ADRB2	49	47
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1F	ZINC000819043047	DC	On-Demand	Anodyne	ADRB1	66	44
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1F	ZINC000819043047	DC	On-Demand	Anodyne	ADRB3	36	44
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1F	ZINC000819043047	DC	On-Demand	Anodyne	ABCB1	18	44
CCNS(=O)(=O)CCNC[C@@H](O)COCc1ccccc1Cl	ZINC000819043070	FC	On-Demand	Anodyne	ADRB2	20	41
O=C(/C=C\[C@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819043072	GD	On-Demand	Anodyne	PKM	32	42
O=C(/C=C\[C@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819043072	GD	On-Demand	Anodyne	TGM2	46	39
O=C(/C=C\[C@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819043072	GD	On-Demand	Anodyne	F13A1	52	39
CCNS(=O)(=O)CCNC[C@H](O)COCc1ccccc1Cl	ZINC000819043073	FC	On-Demand	Anodyne	ADRB2	20	41
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819043076	GD	On-Demand	Anodyne	PKM	32	42
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819043076	GD	On-Demand	Anodyne	TGM2	46	39
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819043076	GD	On-Demand	Anodyne	F13A1	52	39
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819043078	GD	On-Demand	Anodyne	PKM	32	42
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819043078	GD	On-Demand	Anodyne	TGM2	46	39
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819043078	GD	On-Demand	Anodyne	F13A1	52	39
O=C(/C=C/[C@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819043082	GD	On-Demand	Anodyne	PKM	32	42
O=C(/C=C/[C@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819043082	GD	On-Demand	Anodyne	TGM2	46	39
O=C(/C=C/[C@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819043082	GD	On-Demand	Anodyne	F13A1	52	39
CCCCN1CCC(NC[C@@H](O)c2cc3ccccc3o2)CC1	ZINC000819043088	DG	On-Demand	Anodyne	HTR4	44	36
CCCCN1CCC(NC[C@@H](O)c2cc3ccccc3o2)CC1	ZINC000819043088	DG	On-Demand	Anodyne	SIGMAR1	20	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(OCc3ccccc3)CC1)C2	ZINC000819043091	GG	On-Demand	Anodyne	GRIN2B	21	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(OCc3ccccc3)CC1)C2	ZINC000819043095	GG	On-Demand	Anodyne	GRIN2B	21	41
CCCCN1CCC(NC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819043105	EH	On-Demand	Anodyne	SFRP1	30	40
CCCCN1CCC(NC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819043108	EH	On-Demand	Anodyne	SFRP1	30	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1c1nc3ccccc3[nH]1)C2	ZINC000819043115	GG	On-Demand	Anodyne	PRCP	54	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H]1c1nc3ccccc3[nH]1)C2	ZINC000819043118	GG	On-Demand	Anodyne	PRCP	54	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1c1nc3ccccc3[nH]1)C2	ZINC000819043120	GG	On-Demand	Anodyne	PRCP	54	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H]1c1nc3ccccc3[nH]1)C2	ZINC000819043123	GG	On-Demand	Anodyne	PRCP	54	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1c1nc2ccccc2[nH]1	ZINC000819043125	FG	On-Demand	Anodyne	PRCP	57	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1c1nc2ccccc2[nH]1	ZINC000819043127	FG	On-Demand	Anodyne	PRCP	57	48
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819043129	ED	On-Demand	Anodyne	SLC6A3	31	41
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819043129	ED	On-Demand	Anodyne	ADRB3	19	40
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819043129	ED	On-Demand	Anodyne	CCR5	19	42
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819043131	ED	On-Demand	Anodyne	SLC6A3	31	41
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819043131	ED	On-Demand	Anodyne	ADRB3	19	40
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819043131	ED	On-Demand	Anodyne	CCR5	19	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cccc(O)c3)CC1)C2	ZINC000819043132	FD	On-Demand	Anodyne	SSTR1	69	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cccc(O)c3)CC1)C2	ZINC000819043132	FD	On-Demand	Anodyne	ADAM10	39	43
CCCCN1CCC(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819043133	FG	On-Demand	Anodyne	ADRB3	21	43
CCCCN1CCC(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819043133	FG	On-Demand	Anodyne	EPHX2	27	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cccc(O)c3)CC1)C2	ZINC000819043134	FD	On-Demand	Anodyne	SSTR1	69	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cccc(O)c3)CC1)C2	ZINC000819043134	FD	On-Demand	Anodyne	ADAM10	39	43
CCCCN1CCC(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819043135	FG	On-Demand	Anodyne	ADRB3	21	43
CCCCN1CCC(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819043135	FG	On-Demand	Anodyne	EPHX2	27	42
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccc(Br)cc2)CC1	ZINC000819043137	GE	On-Demand	Anodyne	ADRB3	15	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN([C@@H](C#N)c2ccccc2)CC1	ZINC000819043143	GE	On-Demand	Mild	PTAFR	43	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN([C@H](C#N)c2ccccc2)CC1	ZINC000819043144	GE	On-Demand	Mild	PTAFR	43	51
O=C(Nc1cccc(C(=O)NC2CC2)c1)C(F)=C1CCC1	ZINC000819043148	CF	On-Demand	Anodyne	MAPK14	29	41
O=C(Nc1cccc(C(=O)NC2CC2)c1)C(F)=C1CCC1	ZINC000819043148	CF	On-Demand	Anodyne	KCNK3	87	38
O=C(Nc1cccc(C(=O)NC2CC2)c1)C(F)=C1CCC1	ZINC000819043148	CF	On-Demand	Anodyne	KCNK9	41	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN([C@H](C#N)c3ccccc3)CC1)C2	ZINC000819043149	GE	On-Demand	Mild	PTAFR	41	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN([C@@H](C#N)c3ccccc3)CC1)C2	ZINC000819043150	GE	On-Demand	Mild	PTAFR	41	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN([C@H](C#N)c3ccccc3)CC1)C2	ZINC000819043151	GE	On-Demand	Mild	PTAFR	41	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN([C@@H](C#N)c3ccccc3)CC1)C2	ZINC000819043152	GE	On-Demand	Mild	PTAFR	41	42
N#C[C@H](c1ccccc1)N1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819043155	EE	On-Demand	Mild	PTAFR	41	52
N#C[C@H](c1ccccc1)N1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819043156	EE	On-Demand	Mild	PTAFR	41	52
N#C[C@H](c1ccccc1)N1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819043157	EE	On-Demand	Mild	PTAFR	41	52
N#C[C@H](c1ccccc1)N1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819043158	EE	On-Demand	Mild	PTAFR	41	52
O=C(/C=C/[C@H]1CCCO1)N1CCN(c2cccc(O)c2)CC1	ZINC000819043166	DD	On-Demand	Anodyne	ITGAL	50	32
O=C(/C=C/[C@@H]1CCCO1)N1CCN(c2cccc(O)c2)CC1	ZINC000819043167	DD	On-Demand	Anodyne	ITGAL	50	32
O=C(/C=C\[C@H]1CCCO1)N1CCN(c2cccc(O)c2)CC1	ZINC000819043168	DD	On-Demand	Anodyne	ITGAL	50	32
O=C(/C=C\[C@@H]1CCCO1)N1CCN(c2cccc(O)c2)CC1	ZINC000819043169	DD	On-Demand	Anodyne	ITGAL	50	32
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2ccc(Br)cc2)CC1	ZINC000819043196	GE	On-Demand	Anodyne	ADRB3	15	40
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819043207	EB	On-Demand	Bother	ADRB2	41	44
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819043207	EB	On-Demand	Bother	ADRB1	60	38
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819043207	EB	On-Demand	Bother	ADRB3	31	41
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819043207	EB	On-Demand	Bother	COLA	78	33
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819043208	EB	On-Demand	Bother	ADRB2	41	44
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819043208	EB	On-Demand	Bother	ADRB1	60	38
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819043208	EB	On-Demand	Bother	ADRB3	31	41
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819043208	EB	On-Demand	Bother	COLA	78	33
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C)cc1C	ZINC000819043210	EC	On-Demand	Anodyne	ADRB2	37	47
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(C)cc1C	ZINC000819043210	EC	On-Demand	Anodyne	ADRB1	42	36
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C)cc1C	ZINC000819043212	EC	On-Demand	Anodyne	ADRB2	37	47
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(C)cc1C	ZINC000819043212	EC	On-Demand	Anodyne	ADRB1	42	36
CCNS(=O)(=O)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819043246	DC	On-Demand	Anodyne	ADRB2	42	39
CCNS(=O)(=O)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819043246	DC	On-Demand	Anodyne	ADRB1	59	49
CCNS(=O)(=O)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819043246	DC	On-Demand	Anodyne	ADRB3	84	53
CCNS(=O)(=O)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819043248	DC	On-Demand	Anodyne	ADRB2	42	39
CCNS(=O)(=O)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819043248	DC	On-Demand	Anodyne	ADRB1	59	49
CCNS(=O)(=O)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819043248	DC	On-Demand	Anodyne	ADRB3	84	53
CCNS(=O)(=O)CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819043262	DC	On-Demand	Bother	ADRB3	45	37
CCNS(=O)(=O)CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819043262	DC	On-Demand	Bother	CACNA1D	46	32
CCNS(=O)(=O)CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819043264	DC	On-Demand	Bother	ADRB3	45	37
CCNS(=O)(=O)CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819043264	DC	On-Demand	Bother	CACNA1D	46	32
CCCCN1CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819043269	DG	On-Demand	Anodyne	OPRL1	44	37
CCCCN1CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819043269	DG	On-Demand	Anodyne	HTR4	50	39
CCCCN1CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819043269	DG	On-Demand	Anodyne	CHRM3	16	40
CCCCN1CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819043269	DG	On-Demand	Anodyne	SIGMAR1	23	48
CCNS(=O)(=O)CCNC[C@@H](O)c1ccccc1	ZINC000819043322	CC	On-Demand	Anodyne	ADRB2	29	45
CCNS(=O)(=O)CCNC[C@@H](O)c1ccccc1	ZINC000819043322	CC	On-Demand	Anodyne	ADRB1	41	40
CCNS(=O)(=O)CCNC[C@@H](O)c1ccccc1	ZINC000819043322	CC	On-Demand	Anodyne	ADRB3	86	43
CCNS(=O)(=O)CCNC[C@H](O)c1ccccc1	ZINC000819043324	CC	On-Demand	Anodyne	ADRB2	29	45
CCNS(=O)(=O)CCNC[C@H](O)c1ccccc1	ZINC000819043324	CC	On-Demand	Anodyne	ADRB1	41	40
CCNS(=O)(=O)CCNC[C@H](O)c1ccccc1	ZINC000819043324	CC	On-Demand	Anodyne	ADRB3	86	43
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819043348	FD	On-Demand	Bother	CCR5	21	42
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819043349	FD	On-Demand	Bother	CCR5	21	42
CCCCN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819043360	DG	On-Demand	Anodyne	ADRB1	37	45
CCCCN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819043360	DG	On-Demand	Anodyne	ADRB3	56	47
CCCCN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819043360	DG	On-Demand	Anodyne	IGF1R	29	42
CCCCN1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819043360	DG	On-Demand	Anodyne	CYP3A4	48	39
CCCCN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819043361	DG	On-Demand	Anodyne	ADRB1	37	45
CCCCN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819043361	DG	On-Demand	Anodyne	ADRB3	56	47
CCCCN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819043361	DG	On-Demand	Anodyne	IGF1R	29	42
CCCCN1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819043361	DG	On-Demand	Anodyne	CYP3A4	48	39
CCOC[C@H](O)CNCC[S@@](=O)Cc1ccccc1	ZINC000819043373	CC	On-Demand	Anodyne	ADRB2	35	42
CCOC[C@H](O)CNCC[S@@](=O)Cc1ccccc1	ZINC000819043373	CC	On-Demand	Anodyne	ADRB1	39	42
CCOC[C@H](O)CNCC[S@@](=O)Cc1ccccc1	ZINC000819043373	CC	On-Demand	Anodyne	ADRB3	23	42
CCOC[C@H](O)CNCC[S@](=O)Cc1ccccc1	ZINC000819043375	CC	On-Demand	Anodyne	ADRB2	35	42
CCOC[C@H](O)CNCC[S@](=O)Cc1ccccc1	ZINC000819043375	CC	On-Demand	Anodyne	ADRB1	39	42
CCOC[C@H](O)CNCC[S@](=O)Cc1ccccc1	ZINC000819043375	CC	On-Demand	Anodyne	ADRB3	23	42
NC(=O)c1cn([C@H]2CCN(C(=S)NC34CC5CC(CC(C5)C3)C4)C2)nn1	ZINC000819043398	FD	On-Demand	Anodyne	EPHX2	70	41
NC(=O)c1cn([C@@H]2CCN(C(=S)NC34CC5CC(CC(C5)C3)C4)C2)nn1	ZINC000819043399	FD	On-Demand	Anodyne	EPHX2	70	41
Cc1c(NC(=O)[C@H](C)OC(=O)Cn2cnc3sccc3c2=O)c(=O)n(-c2ccccc2)n1C	ZINC000819043407	JD	On-Demand	Anodyne	FPR2	47	39
Cc1c(NC(=O)[C@@H](C)OC(=O)Cn2cnc3sccc3c2=O)c(=O)n(-c2ccccc2)n1C	ZINC000819043408	JD	On-Demand	Anodyne	FPR2	47	39
O=[S@](CCNC[C@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043409	FF	On-Demand	Anodyne	ADRB2	57	55
O=[S@](CCNC[C@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043409	FF	On-Demand	Anodyne	ADRB1	99	55
O=[S@](CCNC[C@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043409	FF	On-Demand	Anodyne	GRIN1	20	50
O=[S@](CCNC[C@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043409	FF	On-Demand	Anodyne	ADRB3	64	55
O=[S@](CCNC[C@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043409	FF	On-Demand	Anodyne	ABCB1	20	49
O=[S@](CCNC[C@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043409	FF	On-Demand	Anodyne	PDS	40	33
O=[S@](CCNC[C@@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043410	FF	On-Demand	Anodyne	ADRB2	57	55
O=[S@](CCNC[C@@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043410	FF	On-Demand	Anodyne	ADRB1	99	55
O=[S@](CCNC[C@@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043410	FF	On-Demand	Anodyne	GRIN1	20	50
O=[S@](CCNC[C@@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043410	FF	On-Demand	Anodyne	ADRB3	64	55
O=[S@](CCNC[C@@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043410	FF	On-Demand	Anodyne	ABCB1	20	49
O=[S@](CCNC[C@@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043410	FF	On-Demand	Anodyne	PDS	40	33
O=[S@@](CCNC[C@@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043411	FF	On-Demand	Anodyne	ADRB2	57	55
O=[S@@](CCNC[C@@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043411	FF	On-Demand	Anodyne	ADRB1	99	55
O=[S@@](CCNC[C@@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043411	FF	On-Demand	Anodyne	GRIN1	20	50
O=[S@@](CCNC[C@@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043411	FF	On-Demand	Anodyne	ADRB3	64	55
O=[S@@](CCNC[C@@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043411	FF	On-Demand	Anodyne	ABCB1	20	49
O=[S@@](CCNC[C@@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043411	FF	On-Demand	Anodyne	PDS	40	33
O=[S@@](CCNC[C@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043412	FF	On-Demand	Anodyne	ADRB2	57	55
O=[S@@](CCNC[C@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043412	FF	On-Demand	Anodyne	ADRB1	99	55
O=[S@@](CCNC[C@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043412	FF	On-Demand	Anodyne	GRIN1	20	50
O=[S@@](CCNC[C@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043412	FF	On-Demand	Anodyne	ADRB3	64	55
O=[S@@](CCNC[C@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043412	FF	On-Demand	Anodyne	ABCB1	20	49
O=[S@@](CCNC[C@H](O)COc1ccc(Cl)cc1)Cc1ccccc1	ZINC000819043412	FF	On-Demand	Anodyne	PDS	40	33
O=C(C(F)=C1CCC1)N1CCC[C@@H]1c1cccnc1	ZINC000819043450	CG	On-Demand	Anodyne	CHRNA7	23	52
O=C(C(F)=C1CCC1)N1CCC[C@@H]1c1cccnc1	ZINC000819043450	CG	On-Demand	Anodyne	ACHP_LYMST	20	52
O=C(C(F)=C1CCC1)N1CCC[C@H]1c1cccnc1	ZINC000819043451	CG	On-Demand	Anodyne	CHRNA7	23	52
O=C(C(F)=C1CCC1)N1CCC[C@H]1c1cccnc1	ZINC000819043451	CG	On-Demand	Anodyne	ACHP_LYMST	20	52
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819043563	DE	On-Demand	Anodyne	KCNK3	75	36
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819043564	HH	On-Demand	Anodyne	FPR1	42	34
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819043565	DE	On-Demand	Anodyne	KCNK3	75	36
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819043566	DE	On-Demand	Anodyne	KCNK3	75	36
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819043568	DE	On-Demand	Anodyne	KCNK3	75	36
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819043571	HH	On-Demand	Anodyne	FPR1	42	34
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H]2CCOc3ccccc32)CC1	ZINC000819043661	GG	On-Demand	Anodyne	GPR119	34	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2CCOc3ccccc32)CC1	ZINC000819043662	GG	On-Demand	Anodyne	GPR119	34	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H]2CCOc3ccccc32)CC1	ZINC000819043663	GG	On-Demand	Anodyne	GPR119	34	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2CCOc3ccccc32)CC1	ZINC000819043664	GG	On-Demand	Anodyne	GPR119	34	45
CCNS(=O)(=O)CCNC[C@H](O)COc1cc(C)c(Cl)cc1C(C)C	ZINC000819043670	GE	On-Demand	Anodyne	ADRB2	23	42
CCNS(=O)(=O)CCNC[C@@H](O)COc1cc(C)c(Cl)cc1C(C)C	ZINC000819043671	GE	On-Demand	Anodyne	ADRB2	23	42
CCNS(=O)(=O)CCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819043677	GE	On-Demand	Anodyne	LTA4H	52	49
CCNS(=O)(=O)CCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819043677	GE	On-Demand	Anodyne	CA1	34	43
CCNS(=O)(=O)CCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819043677	GE	On-Demand	Anodyne	MTNR1B	15	47
CCNS(=O)(=O)CCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819043677	GE	On-Demand	Anodyne	MMP2	16	48
CCNS(=O)(=O)CCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819043677	GE	On-Demand	Anodyne	NPY5R	21	40
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(CC)c1	ZINC000819043678	EC	On-Demand	Anodyne	ADRB2	61	48
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(CC)c1	ZINC000819043678	EC	On-Demand	Anodyne	ADRB1	90	47
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(CC)c1	ZINC000819043678	EC	On-Demand	Anodyne	GRIN1	19	48
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(CC)c1	ZINC000819043678	EC	On-Demand	Anodyne	ADRB3	63	47
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(CC)c1	ZINC000819043678	EC	On-Demand	Anodyne	ABCB1	15	43
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(CC)c1	ZINC000819043678	EC	On-Demand	Anodyne	PDS	63	33
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(CC)c1	ZINC000819043679	EC	On-Demand	Anodyne	ADRB2	61	48
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(CC)c1	ZINC000819043679	EC	On-Demand	Anodyne	ADRB1	90	47
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(CC)c1	ZINC000819043679	EC	On-Demand	Anodyne	GRIN1	19	48
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(CC)c1	ZINC000819043679	EC	On-Demand	Anodyne	ADRB3	63	47
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(CC)c1	ZINC000819043679	EC	On-Demand	Anodyne	ABCB1	15	43
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(CC)c1	ZINC000819043679	EC	On-Demand	Anodyne	PDS	63	33
CCNS(=O)(=O)CCNC[C@H](O)COCc1ccc(Cl)cc1	ZINC000819043680	FC	On-Demand	Anodyne	ADRB2	25	42
CCNS(=O)(=O)CCNC[C@H](O)COCc1ccc(Cl)cc1	ZINC000819043680	FC	On-Demand	Anodyne	ADRB1	32	42
CCNS(=O)(=O)CCNC[C@H](O)COCc1ccc(Cl)cc1	ZINC000819043680	FC	On-Demand	Anodyne	ADRB3	27	42
CCNS(=O)(=O)CCNC[C@@H](O)COCc1ccc(Cl)cc1	ZINC000819043681	FC	On-Demand	Anodyne	ADRB2	25	42
CCNS(=O)(=O)CCNC[C@@H](O)COCc1ccc(Cl)cc1	ZINC000819043681	FC	On-Demand	Anodyne	ADRB1	32	42
CCNS(=O)(=O)CCNC[C@@H](O)COCc1ccc(Cl)cc1	ZINC000819043681	FC	On-Demand	Anodyne	ADRB3	27	42
COc1ccc(OC)c([C@H](O)CNC2CCN(CCC(=O)N(C)C)CC2)c1	ZINC000819043686	GD	On-Demand	Anodyne	HTR4	40	34
CCCCN1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819043688	CF	On-Demand	Anodyne	CHRM1	15	48
CCCCN1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819043688	CF	On-Demand	Anodyne	DRD2	15	45
CCCCN1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819043688	CF	On-Demand	Anodyne	HTR2A	17	49
CCCCN1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819043688	CF	On-Demand	Anodyne	SLC6A4	17	46
CCCCN1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819043688	CF	On-Demand	Anodyne	SLC6A3	47	48
CCCCN1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819043688	CF	On-Demand	Anodyne	ADRB3	17	40
CCCCN1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819043688	CF	On-Demand	Anodyne	SIGMAR1	18	45
CCCCN1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819043689	CF	On-Demand	Anodyne	CHRM1	15	48
CCCCN1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819043689	CF	On-Demand	Anodyne	DRD2	15	45
CCCCN1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819043689	CF	On-Demand	Anodyne	HTR2A	17	49
CCCCN1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819043689	CF	On-Demand	Anodyne	SLC6A4	17	46
CCCCN1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819043689	CF	On-Demand	Anodyne	SLC6A3	47	48
CCCCN1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819043689	CF	On-Demand	Anodyne	ADRB3	17	40
CCCCN1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819043689	CF	On-Demand	Anodyne	SIGMAR1	18	45
CCOc1ccc(C(=O)N2CCC(NC(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819043691	FG	On-Demand	Anodyne	SSTR5	41	35
CCOc1ccc(C(=O)N2CCC(NC(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819043691	FG	On-Demand	Anodyne	SLC6A5	33	41
CCOc1ccc(C(=O)N2CCC(NC(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819043691	FG	On-Demand	Anodyne	EPHX2	34	42
CCOc1ccc(C(=O)N2CCC(NC(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819043691	FG	On-Demand	Anodyne	L3MBTL3	70	36
CCCCN1CCC(NC[C@@H](O)c2ccccc2C)CC1	ZINC000819043695	CF	On-Demand	Anodyne	HTR4	43	37
CCCCN1CCC(NC[C@@H](O)c2ccccc2C)CC1	ZINC000819043695	CF	On-Demand	Anodyne	CHRM3	15	40
CCCCN1CCC(NC[C@H](O)c2ccccc2C)CC1	ZINC000819043696	CF	On-Demand	Anodyne	HTR4	43	37
CCCCN1CCC(NC[C@H](O)c2ccccc2C)CC1	ZINC000819043696	CF	On-Demand	Anodyne	CHRM3	15	40
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819043710	GE	On-Demand	Anodyne	ADRB3	15	47
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819043710	GE	On-Demand	Anodyne	CCR5	22	45
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819043710	GE	On-Demand	Anodyne	SLC6A5	31	42
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819043711	GE	On-Demand	Anodyne	ADRB3	15	47
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819043711	GE	On-Demand	Anodyne	CCR5	22	45
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819043711	GE	On-Demand	Anodyne	SLC6A5	31	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(-c3nn[nH]n3)c1)C2	ZINC000819043716	FD	On-Demand	Anodyne	CCKBR	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(-c3nn[nH]n3)c1)C2	ZINC000819043717	FD	On-Demand	Anodyne	CCKBR	15	40
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(Br)c1	ZINC000819043721	GC	On-Demand	Anodyne	ADRB2	48	48
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(Br)c1	ZINC000819043721	GC	On-Demand	Anodyne	ADRB1	68	43
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(Br)c1	ZINC000819043721	GC	On-Demand	Anodyne	ADRB3	44	42
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(Br)c1	ZINC000819043721	GC	On-Demand	Anodyne	PDS	50	41
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(Br)c1	ZINC000819043722	GC	On-Demand	Anodyne	ADRB2	48	48
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(Br)c1	ZINC000819043722	GC	On-Demand	Anodyne	ADRB1	68	43
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(Br)c1	ZINC000819043722	GC	On-Demand	Anodyne	ADRB3	44	42
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(Br)c1	ZINC000819043722	GC	On-Demand	Anodyne	PDS	50	41
CCNS(=O)(=O)CCNC[C@@H](O)c1cccc(Br)c1	ZINC000819043731	FD	On-Demand	Anodyne	ADRB3	52	39
CCNS(=O)(=O)CCNC[C@H](O)c1cccc(Br)c1	ZINC000819043732	FD	On-Demand	Anodyne	ADRB3	52	39
CN(C)C(=O)CCN1CCC(NC[C@H](O)c2cccc(F)c2)CC1	ZINC000819043742	ED	On-Demand	Anodyne	CCR5	37	41
CN(C)C(=O)CCN1CCC(NC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819043743	ED	On-Demand	Anodyne	CCR5	37	41
CCCCN1CCC(NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819043744	EH	On-Demand	Anodyne	ADRB2	17	42
CCCCN1CCC(NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819043744	EH	On-Demand	Anodyne	DRD4	15	43
CCCCN1CCC(NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819043744	EH	On-Demand	Anodyne	HTR4	63	40
CCCCN1CCC(NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819043744	EH	On-Demand	Anodyne	SIGMAR1	15	53
CCNS(=O)(=O)CCNC[C@@H](O)c1cccc(F)c1	ZINC000819043753	CC	On-Demand	Anodyne	ADRB1	31	43
CCNS(=O)(=O)CCNC[C@@H](O)c1cccc(F)c1	ZINC000819043753	CC	On-Demand	Anodyne	ADRB3	58	43
CCNS(=O)(=O)CCNC[C@H](O)c1cccc(F)c1	ZINC000819043754	CC	On-Demand	Anodyne	ADRB1	31	43
CCNS(=O)(=O)CCNC[C@H](O)c1cccc(F)c1	ZINC000819043754	CC	On-Demand	Anodyne	ADRB3	58	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC=C(c3ccc(O)cc3)CC1)C2	ZINC000819043758	FF	On-Demand	Anodyne	ADAM10	34	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC=C(c3ccc(O)cc3)CC1)C2	ZINC000819043759	FF	On-Demand	Anodyne	ADAM10	34	43
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(SC)cc1	ZINC000819043763	EC	On-Demand	Anodyne	ADRB2	48	48
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(SC)cc1	ZINC000819043763	EC	On-Demand	Anodyne	ADRB1	72	48
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(SC)cc1	ZINC000819043763	EC	On-Demand	Anodyne	GRIN1	18	45
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(SC)cc1	ZINC000819043763	EC	On-Demand	Anodyne	ADRB3	46	48
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(SC)cc1	ZINC000819043764	EC	On-Demand	Anodyne	ADRB2	48	48
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(SC)cc1	ZINC000819043764	EC	On-Demand	Anodyne	ADRB1	72	48
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(SC)cc1	ZINC000819043764	EC	On-Demand	Anodyne	GRIN1	18	45
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(SC)cc1	ZINC000819043764	EC	On-Demand	Anodyne	ADRB3	46	48
O=C(C(F)=C1CCC1)N1CCC[C@H]1c1nc2ccccc2[nH]1	ZINC000819043765	CH	On-Demand	Anodyne	PRCP	59	42
O=C(C(F)=C1CCC1)N1CCC[C@@H]1c1nc2ccccc2[nH]1	ZINC000819043766	CH	On-Demand	Anodyne	PRCP	59	42
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)C1CC1	ZINC000819043770	EG	On-Demand	Anodyne	DRD4	20	42
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)C1CC1	ZINC000819043770	EG	On-Demand	Anodyne	SIGMAR1	39	55
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)C1CC1	ZINC000819043770	EG	On-Demand	Anodyne	SSTR5	59	39
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)C1CC1	ZINC000819043770	EG	On-Demand	Anodyne	CCR3	33	59
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)C1CC1	ZINC000819043770	EG	On-Demand	Anodyne	UTS2R	18	40
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)C1CC1	ZINC000819043770	EG	On-Demand	Anodyne	MCHR1	35	50
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)C1CC1	ZINC000819043771	EG	On-Demand	Anodyne	DRD4	20	42
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)C1CC1	ZINC000819043771	EG	On-Demand	Anodyne	SIGMAR1	39	55
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)C1CC1	ZINC000819043771	EG	On-Demand	Anodyne	SSTR5	59	39
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)C1CC1	ZINC000819043771	EG	On-Demand	Anodyne	CCR3	33	59
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)C1CC1	ZINC000819043771	EG	On-Demand	Anodyne	UTS2R	18	40
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)C1CC1	ZINC000819043771	EG	On-Demand	Anodyne	MCHR1	35	50
CCOC(=O)C1CCC(O)(CNCC[S@](=O)Cc2ccccc2)CC1	ZINC000819043772	FE	On-Demand	Anodyne	TIMP3	52	32
CCOC(=O)C1CCC(O)(CNCC[S@@](=O)Cc2ccccc2)CC1	ZINC000819043773	FE	On-Demand	Anodyne	TIMP3	52	32
NC(=O)c1cn([C@@H]2CCN(C(=S)Nc3cccc(C(F)(F)F)c3)C2)nn1	ZINC000819043788	GE	On-Demand	Anodyne	NPY2R	25	43
NC(=O)c1cn([C@@H]2CCN(C(=S)Nc3cccc(C(F)(F)F)c3)C2)nn1	ZINC000819043788	GE	On-Demand	Anodyne	CCR2	31	41
NC(=O)c1cn([C@@H]2CCN(C(=S)Nc3cccc(C(F)(F)F)c3)C2)nn1	ZINC000819043788	GE	On-Demand	Anodyne	EPHX2	16	48
NC(=O)c1cn([C@H]2CCN(C(=S)Nc3cccc(C(F)(F)F)c3)C2)nn1	ZINC000819043789	GE	On-Demand	Anodyne	NPY2R	25	43
NC(=O)c1cn([C@H]2CCN(C(=S)Nc3cccc(C(F)(F)F)c3)C2)nn1	ZINC000819043789	GE	On-Demand	Anodyne	CCR2	31	41
NC(=O)c1cn([C@H]2CCN(C(=S)Nc3cccc(C(F)(F)F)c3)C2)nn1	ZINC000819043789	GE	On-Demand	Anodyne	EPHX2	16	48
NC(=O)c1cn([C@H]2CCN(C(=S)Nc3ccc4c(c3)OCO4)C2)nn1	ZINC000819043790	FC	On-Demand	Anodyne	TRPC6	27	41
NC(=O)c1cn([C@H]2CCN(C(=S)Nc3ccc4c(c3)OCO4)C2)nn1	ZINC000819043790	FC	On-Demand	Anodyne	TRPC3	29	41
NC(=O)c1cn([C@@H]2CCN(C(=S)Nc3ccc4c(c3)OCO4)C2)nn1	ZINC000819043791	FC	On-Demand	Anodyne	TRPC6	27	41
NC(=O)c1cn([C@@H]2CCN(C(=S)Nc3ccc4c(c3)OCO4)C2)nn1	ZINC000819043791	FC	On-Demand	Anodyne	TRPC3	29	41
O=C(C1CCC1)N(CCCNC[C@@H](O)c1cccc(Br)c1)C1CC1	ZINC000819043799	GG	On-Demand	Anodyne	ADRB3	44	37
O=C(C1CCC1)N(CCCNC[C@H](O)c1cccc(Br)c1)C1CC1	ZINC000819043801	GG	On-Demand	Anodyne	ADRB3	44	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(C(=O)c3ccccc3)CC1)C2	ZINC000819043802	GE	On-Demand	Anodyne	EPHX2	22	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(C(=O)c3ccccc3)CC1)C2	ZINC000819043802	GE	On-Demand	Anodyne	SFRP1	40	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(C(=O)c3ccccc3)CC1)C2	ZINC000819043803	GE	On-Demand	Anodyne	EPHX2	22	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(C(=O)c3ccccc3)CC1)C2	ZINC000819043803	GE	On-Demand	Anodyne	SFRP1	40	37
O=[S@](CCNC[C@H](O)c1ccc(F)cc1)Cc1ccccc1	ZINC000819043818	DE	On-Demand	Anodyne	ADRB2	42	39
O=[S@@](CCNC[C@H](O)c1ccc(F)cc1)Cc1ccccc1	ZINC000819043819	DE	On-Demand	Anodyne	ADRB2	42	39
O=[S@](CCNC[C@@H](O)c1ccc(F)cc1)Cc1ccccc1	ZINC000819043820	DE	On-Demand	Anodyne	ADRB2	42	39
O=[S@@](CCNC[C@@H](O)c1ccc(F)cc1)Cc1ccccc1	ZINC000819043821	DE	On-Demand	Anodyne	ADRB2	42	39
N#Cc1ccc(OC[C@@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819043824	FD	On-Demand	Mild	ADRB2	51	45
N#Cc1ccc(OC[C@@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819043824	FD	On-Demand	Mild	ADRB1	86	47
N#Cc1ccc(OC[C@@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819043824	FD	On-Demand	Mild	ADRB3	52	47
N#Cc1ccc(OC[C@@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819043824	FD	On-Demand	Mild	ABCB1	16	48
N#Cc1ccc(OC[C@@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819043825	FD	On-Demand	Mild	ADRB2	51	45
N#Cc1ccc(OC[C@@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819043825	FD	On-Demand	Mild	ADRB1	86	47
N#Cc1ccc(OC[C@@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819043825	FD	On-Demand	Mild	ADRB3	52	47
N#Cc1ccc(OC[C@@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819043825	FD	On-Demand	Mild	ABCB1	16	48
N#Cc1ccc(OC[C@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819043826	FD	On-Demand	Mild	ADRB2	51	45
N#Cc1ccc(OC[C@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819043826	FD	On-Demand	Mild	ADRB1	86	47
N#Cc1ccc(OC[C@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819043826	FD	On-Demand	Mild	ADRB3	52	47
N#Cc1ccc(OC[C@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819043826	FD	On-Demand	Mild	ABCB1	16	48
N#Cc1ccc(OC[C@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819043827	FD	On-Demand	Mild	ADRB2	51	45
N#Cc1ccc(OC[C@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819043827	FD	On-Demand	Mild	ADRB1	86	47
N#Cc1ccc(OC[C@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819043827	FD	On-Demand	Mild	ADRB3	52	47
N#Cc1ccc(OC[C@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819043827	FD	On-Demand	Mild	ABCB1	16	48
NC(=O)c1cn([C@@H]2CCN(C(=S)Nc3ccc4c(c3)OC(F)(F)O4)C2)nn1	ZINC000819043849	GD	On-Demand	Anodyne	KIT	21	44
NC(=O)c1cn([C@@H]2CCN(C(=S)Nc3ccc4c(c3)OC(F)(F)O4)C2)nn1	ZINC000819043849	GD	On-Demand	Anodyne	BRAF	18	44
NC(=O)c1cn([C@H]2CCN(C(=S)Nc3ccc4c(c3)OC(F)(F)O4)C2)nn1	ZINC000819043850	GD	On-Demand	Anodyne	KIT	21	44
NC(=O)c1cn([C@H]2CCN(C(=S)Nc3ccc4c(c3)OC(F)(F)O4)C2)nn1	ZINC000819043850	GD	On-Demand	Anodyne	BRAF	18	44
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H]1c1nc2ccccc2[nH]1	ZINC000819043968	DF	On-Demand	Anodyne	PRCP	59	42
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H]1c1nc2ccccc2[nH]1	ZINC000819043969	DF	On-Demand	Anodyne	PRCP	59	42
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H]1c1nc2ccccc2[nH]1	ZINC000819043970	DF	On-Demand	Anodyne	PRCP	59	42
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H]1c1nc2ccccc2[nH]1	ZINC000819043971	DF	On-Demand	Anodyne	PRCP	59	42
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819043975	FC	On-Demand	Anodyne	ADRB2	45	46
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819043975	FC	On-Demand	Anodyne	ADRB1	62	43
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819043975	FC	On-Demand	Anodyne	ADRB3	38	41
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819043975	FC	On-Demand	Anodyne	PDS	54	44
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819043976	FC	On-Demand	Anodyne	ADRB2	45	46
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819043976	FC	On-Demand	Anodyne	ADRB1	62	43
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819043976	FC	On-Demand	Anodyne	ADRB3	38	41
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819043976	FC	On-Demand	Anodyne	PDS	54	44
CCCCN1CCC(NC[C@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819043982	EH	On-Demand	Anodyne	MCHR1	15	41
CCCCN1CCC(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819043983	EH	On-Demand	Anodyne	MCHR1	15	41
C[C@@H](c1ccc(F)cc1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819043988	GH	On-Demand	Mild	PAPA1_CARPA	51	52
C[C@@H](c1ccc(F)cc1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819043988	GH	On-Demand	Mild	CTSK	28	43
C[C@@H](c1ccc(F)cc1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819043988	GH	On-Demand	Mild	CTSS	15	52
C[C@@H](c1ccc(F)cc1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819043989	GH	On-Demand	Mild	PAPA1_CARPA	51	52
C[C@@H](c1ccc(F)cc1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819043989	GH	On-Demand	Mild	CTSK	28	43
C[C@@H](c1ccc(F)cc1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819043989	GH	On-Demand	Mild	CTSS	15	52
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819043992	FD	On-Demand	Anodyne	ADRB2	50	46
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819043992	FD	On-Demand	Anodyne	ADRB1	73	46
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819043992	FD	On-Demand	Anodyne	GRIN1	34	59
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819043992	FD	On-Demand	Anodyne	ADRB3	49	48
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819043993	FD	On-Demand	Anodyne	ADRB2	50	46
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819043993	FD	On-Demand	Anodyne	ADRB1	73	46
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819043993	FD	On-Demand	Anodyne	GRIN1	34	59
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819043993	FD	On-Demand	Anodyne	ADRB3	49	48
CCCCN1CCC(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819043997	DE	On-Demand	Bother	KCNJ1	22	40
CCCCN1CCC(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819043998	DE	On-Demand	Bother	KCNJ1	22	40
CCNS(=O)(=O)CCNCCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000819044005	EC	On-Demand	Bother	COLA	102	35
COc1cccc([S@](=O)CC(=O)N2CC=C(c3ccc(C)cc3)CC2)c1	ZINC000819044006	FG	On-Demand	Anodyne	DRD4	42	38
COc1cccc([S@](=O)CC(=O)N2CC=C(c3ccc(C)cc3)CC2)c1	ZINC000819044006	FG	On-Demand	Anodyne	ADAM10	15	40
COc1cccc([S@@](=O)CC(=O)N2CC=C(c3ccc(C)cc3)CC2)c1	ZINC000819044007	FG	On-Demand	Anodyne	DRD4	42	38
COc1cccc([S@@](=O)CC(=O)N2CC=C(c3ccc(C)cc3)CC2)c1	ZINC000819044007	FG	On-Demand	Anodyne	ADAM10	15	40
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819044010	FB	On-Demand	Anodyne	ADRB2	34	40
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819044010	FB	On-Demand	Anodyne	ADRB1	51	41
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819044010	FB	On-Demand	Anodyne	ADRB3	31	41
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819044011	FB	On-Demand	Anodyne	ADRB2	34	40
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819044011	FB	On-Demand	Anodyne	ADRB1	51	41
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819044011	FB	On-Demand	Anodyne	ADRB3	31	41
CCNS(=O)(=O)CCNC[C@H](O)Cc1ccc(F)cc1	ZINC000819044017	DC	On-Demand	Anodyne	LEF	41	33
CCNS(=O)(=O)CCNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819044018	DC	On-Demand	Anodyne	LEF	41	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC=C(c3ccc(C)cc3)CC1)C2	ZINC000819044025	FG	On-Demand	Anodyne	ADAM10	36	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC=C(c3ccc(C)cc3)CC1)C2	ZINC000819044026	FG	On-Demand	Anodyne	ADAM10	36	44
CCNS(=O)(=O)CCNC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819044035	FC	On-Demand	Anodyne	ADRB2	34	48
CCNS(=O)(=O)CCNC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819044035	FC	On-Demand	Anodyne	ADRB1	34	42
CCNS(=O)(=O)CCNC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819044035	FC	On-Demand	Anodyne	GRIN1	18	45
CCNS(=O)(=O)CCNC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819044036	FC	On-Demand	Anodyne	ADRB2	34	48
CCNS(=O)(=O)CCNC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819044036	FC	On-Demand	Anodyne	ADRB1	34	42
CCNS(=O)(=O)CCNC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819044036	FC	On-Demand	Anodyne	GRIN1	18	45
CCNS(=O)(=O)CCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819044043	ED	On-Demand	Anodyne	ADRB3	46	38
CCNS(=O)(=O)CCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819044044	ED	On-Demand	Anodyne	ADRB3	46	38
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000819044045	GC	On-Demand	Anodyne	ADRB2	50	50
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000819044045	GC	On-Demand	Anodyne	ADRB1	76	50
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000819044045	GC	On-Demand	Anodyne	GRIN1	20	46
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000819044045	GC	On-Demand	Anodyne	ADRB3	47	50
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(Br)cc1	ZINC000819044046	GC	On-Demand	Anodyne	ADRB2	50	50
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(Br)cc1	ZINC000819044046	GC	On-Demand	Anodyne	ADRB1	76	50
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(Br)cc1	ZINC000819044046	GC	On-Demand	Anodyne	GRIN1	20	46
CCNS(=O)(=O)CCNC[C@H](O)COc1ccc(Br)cc1	ZINC000819044046	GC	On-Demand	Anodyne	ADRB3	47	50
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1Cl	ZINC000819044063	EC	On-Demand	Anodyne	ADRB2	52	61
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1Cl	ZINC000819044063	EC	On-Demand	Anodyne	ADRB1	68	46
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1Cl	ZINC000819044063	EC	On-Demand	Anodyne	ADRB3	40	44
CCNS(=O)(=O)CCNC[C@@H](O)COc1ccccc1Cl	ZINC000819044063	EC	On-Demand	Anodyne	ABCB1	21	44
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1Cl	ZINC000819044064	EC	On-Demand	Anodyne	ADRB2	52	61
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1Cl	ZINC000819044064	EC	On-Demand	Anodyne	ADRB1	68	46
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1Cl	ZINC000819044064	EC	On-Demand	Anodyne	ADRB3	40	44
CCNS(=O)(=O)CCNC[C@H](O)COc1ccccc1Cl	ZINC000819044064	EC	On-Demand	Anodyne	ABCB1	21	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cc(S(N)(=O)=O)ccc1OC)C2	ZINC000819044065	GD	On-Demand	Anodyne	CA2	22	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cc(S(N)(=O)=O)ccc1OC)C2	ZINC000819044065	GD	On-Demand	Anodyne	CA7	29	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cc(S(N)(=O)=O)ccc1OC)C2	ZINC000819044065	GD	On-Demand	Anodyne	CA4	25	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cc(S(N)(=O)=O)ccc1OC)C2	ZINC000819044066	GD	On-Demand	Anodyne	CA2	22	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cc(S(N)(=O)=O)ccc1OC)C2	ZINC000819044066	GD	On-Demand	Anodyne	CA7	29	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cc(S(N)(=O)=O)ccc1OC)C2	ZINC000819044066	GD	On-Demand	Anodyne	CA4	25	42
CCNS(=O)(=O)CCNC[C@@H](O)COc1cc(F)cc(Br)c1	ZINC000819044074	GC	On-Demand	Anodyne	ADRB2	29	40
CCNS(=O)(=O)CCNC[C@@H](O)COc1cc(F)cc(Br)c1	ZINC000819044074	GC	On-Demand	Anodyne	ADRB1	33	40
CCNS(=O)(=O)CCNC[C@@H](O)COc1cc(F)cc(Br)c1	ZINC000819044074	GC	On-Demand	Anodyne	ADRB3	22	40
CCNS(=O)(=O)CCNC[C@H](O)COc1cc(F)cc(Br)c1	ZINC000819044076	GC	On-Demand	Anodyne	ADRB2	29	40
CCNS(=O)(=O)CCNC[C@H](O)COc1cc(F)cc(Br)c1	ZINC000819044076	GC	On-Demand	Anodyne	ADRB1	33	40
CCNS(=O)(=O)CCNC[C@H](O)COc1cc(F)cc(Br)c1	ZINC000819044076	GC	On-Demand	Anodyne	ADRB3	22	40
COc1cccc(C2=NO[C@H](C(=O)N3CCC[C@@](CO)(C(C)C)C3)C2)c1	ZINC000819044087	FE	On-Demand	Anodyne	LUCI_PHOPY	23	43
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819044090	EB	On-Demand	Bother	ADRB2	42	49
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819044090	EB	On-Demand	Bother	ADRB1	57	49
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819044090	EB	On-Demand	Bother	ADRB3	38	49
CCNS(=O)(=O)CCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819044090	EB	On-Demand	Bother	CACNA1D	46	32
COc1cccc(C2=NO[C@H](C(=O)N3CCC[C@](CO)(C(C)C)C3)C2)c1	ZINC000819044091	FE	On-Demand	Anodyne	LUCI_PHOPY	23	43
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819044092	EB	On-Demand	Bother	ADRB2	42	49
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819044092	EB	On-Demand	Bother	ADRB1	57	49
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819044092	EB	On-Demand	Bother	ADRB3	38	49
CCNS(=O)(=O)CCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819044092	EB	On-Demand	Bother	CACNA1D	46	32
COc1cccc(C2=NO[C@@H](C(=O)N3CCC[C@](CO)(C(C)C)C3)C2)c1	ZINC000819044093	FE	On-Demand	Anodyne	LUCI_PHOPY	23	43
COc1cccc(C2=NO[C@@H](C(=O)N3CCC[C@@](CO)(C(C)C)C3)C2)c1	ZINC000819044095	FE	On-Demand	Anodyne	LUCI_PHOPY	23	43
O=C(C1CCC1)N(CCCNC[C@H](O)c1cccnc1)C1CC1	ZINC000819044189	DD	On-Demand	Anodyne	ADRB2	23	46
O=C(C1CCC1)N(CCCNC[C@H](O)c1cccnc1)C1CC1	ZINC000819044189	DD	On-Demand	Anodyne	ADRB1	31	47
O=C(C1CCC1)N(CCCNC[C@H](O)c1cccnc1)C1CC1	ZINC000819044189	DD	On-Demand	Anodyne	ADRB3	107	51
O=C(C1CCC1)N(CCCNC[C@@H](O)c1cccnc1)C1CC1	ZINC000819044190	DD	On-Demand	Anodyne	ADRB2	23	46
O=C(C1CCC1)N(CCCNC[C@@H](O)c1cccnc1)C1CC1	ZINC000819044190	DD	On-Demand	Anodyne	ADRB1	31	47
O=C(C1CCC1)N(CCCNC[C@@H](O)c1cccnc1)C1CC1	ZINC000819044190	DD	On-Demand	Anodyne	ADRB3	107	51
NC(=O)c1cn([C@@H]2CCN(C(=S)Nc3ccc(F)c(Cl)c3)C2)nn1	ZINC000819044191	FD	On-Demand	Anodyne	MCHR1	16	40
NC(=O)c1cn([C@H]2CCN(C(=S)Nc3ccc(F)c(Cl)c3)C2)nn1	ZINC000819044193	FD	On-Demand	Anodyne	MCHR1	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC=C(c3ccc(F)cc3)CC1)C2	ZINC000819044199	FG	On-Demand	Anodyne	ADAM10	33	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC=C(c3ccc(F)cc3)CC1)C2	ZINC000819044201	FG	On-Demand	Anodyne	ADAM10	33	43
O=[S@](CCNC[C@H](O)COc1cccc2[nH]ccc12)Cc1ccccc1	ZINC000819044204	FE	On-Demand	Anodyne	ADRB2	36	55
O=[S@](CCNC[C@H](O)COc1cccc2[nH]ccc12)Cc1ccccc1	ZINC000819044204	FE	On-Demand	Anodyne	ADRB1	65	55
O=[S@](CCNC[C@H](O)COc1cccc2[nH]ccc12)Cc1ccccc1	ZINC000819044204	FE	On-Demand	Anodyne	ADRB3	33	55
O=[S@](CCNC[C@H](O)COc1cccc2[nH]ccc12)Cc1ccccc1	ZINC000819044204	FE	On-Demand	Anodyne	ABCB1	20	41
O=[S@@](CCNC[C@H](O)COc1cccc2[nH]ccc12)Cc1ccccc1	ZINC000819044206	FE	On-Demand	Anodyne	ADRB2	36	55
O=[S@@](CCNC[C@H](O)COc1cccc2[nH]ccc12)Cc1ccccc1	ZINC000819044206	FE	On-Demand	Anodyne	ADRB1	65	55
O=[S@@](CCNC[C@H](O)COc1cccc2[nH]ccc12)Cc1ccccc1	ZINC000819044206	FE	On-Demand	Anodyne	ADRB3	33	55
O=[S@@](CCNC[C@H](O)COc1cccc2[nH]ccc12)Cc1ccccc1	ZINC000819044206	FE	On-Demand	Anodyne	ABCB1	20	41
O=[S@@](CCNC[C@@H](O)COc1cccc2[nH]ccc12)Cc1ccccc1	ZINC000819044208	FE	On-Demand	Anodyne	ADRB2	36	55
O=[S@@](CCNC[C@@H](O)COc1cccc2[nH]ccc12)Cc1ccccc1	ZINC000819044208	FE	On-Demand	Anodyne	ADRB1	65	55
O=[S@@](CCNC[C@@H](O)COc1cccc2[nH]ccc12)Cc1ccccc1	ZINC000819044208	FE	On-Demand	Anodyne	ADRB3	33	55
O=[S@@](CCNC[C@@H](O)COc1cccc2[nH]ccc12)Cc1ccccc1	ZINC000819044208	FE	On-Demand	Anodyne	ABCB1	20	41
O=[S@](CCNC[C@@H](O)COc1cccc2[nH]ccc12)Cc1ccccc1	ZINC000819044211	FE	On-Demand	Anodyne	ADRB2	36	55
O=[S@](CCNC[C@@H](O)COc1cccc2[nH]ccc12)Cc1ccccc1	ZINC000819044211	FE	On-Demand	Anodyne	ADRB1	65	55
O=[S@](CCNC[C@@H](O)COc1cccc2[nH]ccc12)Cc1ccccc1	ZINC000819044211	FE	On-Demand	Anodyne	ADRB3	33	55
O=[S@](CCNC[C@@H](O)COc1cccc2[nH]ccc12)Cc1ccccc1	ZINC000819044211	FE	On-Demand	Anodyne	ABCB1	20	41
O=[S@](CCNC[C@@H](O)COc1ccc2c(c1)OCO2)Cc1ccccc1	ZINC000819044213	GD	On-Demand	Anodyne	ADRB2	42	41
O=[S@](CCNC[C@@H](O)COc1ccc2c(c1)OCO2)Cc1ccccc1	ZINC000819044213	GD	On-Demand	Anodyne	ADRB1	67	41
O=[S@](CCNC[C@@H](O)COc1ccc2c(c1)OCO2)Cc1ccccc1	ZINC000819044213	GD	On-Demand	Anodyne	ADRB3	48	41
O=[S@](CCNC[C@@H](O)COc1ccc2c(c1)OCO2)Cc1ccccc1	ZINC000819044213	GD	On-Demand	Anodyne	ABCB1	20	42
O=[S@@](CCNC[C@@H](O)COc1ccc2c(c1)OCO2)Cc1ccccc1	ZINC000819044214	GD	On-Demand	Anodyne	ADRB2	42	41
O=[S@@](CCNC[C@@H](O)COc1ccc2c(c1)OCO2)Cc1ccccc1	ZINC000819044214	GD	On-Demand	Anodyne	ADRB1	67	41
O=[S@@](CCNC[C@@H](O)COc1ccc2c(c1)OCO2)Cc1ccccc1	ZINC000819044214	GD	On-Demand	Anodyne	ADRB3	48	41
O=[S@@](CCNC[C@@H](O)COc1ccc2c(c1)OCO2)Cc1ccccc1	ZINC000819044214	GD	On-Demand	Anodyne	ABCB1	20	42
O=[S@@](CCNC[C@H](O)COc1ccc2c(c1)OCO2)Cc1ccccc1	ZINC000819044215	GD	On-Demand	Anodyne	ADRB2	42	41
O=[S@@](CCNC[C@H](O)COc1ccc2c(c1)OCO2)Cc1ccccc1	ZINC000819044215	GD	On-Demand	Anodyne	ADRB1	67	41
O=[S@@](CCNC[C@H](O)COc1ccc2c(c1)OCO2)Cc1ccccc1	ZINC000819044215	GD	On-Demand	Anodyne	ADRB3	48	41
O=[S@@](CCNC[C@H](O)COc1ccc2c(c1)OCO2)Cc1ccccc1	ZINC000819044215	GD	On-Demand	Anodyne	ABCB1	20	42
O=[S@](CCNC[C@H](O)COc1ccc2c(c1)OCO2)Cc1ccccc1	ZINC000819044216	GD	On-Demand	Anodyne	ADRB2	42	41
O=[S@](CCNC[C@H](O)COc1ccc2c(c1)OCO2)Cc1ccccc1	ZINC000819044216	GD	On-Demand	Anodyne	ADRB1	67	41
O=[S@](CCNC[C@H](O)COc1ccc2c(c1)OCO2)Cc1ccccc1	ZINC000819044216	GD	On-Demand	Anodyne	ADRB3	48	41
O=[S@](CCNC[C@H](O)COc1ccc2c(c1)OCO2)Cc1ccccc1	ZINC000819044216	GD	On-Demand	Anodyne	ABCB1	20	42
O=[S@](CCNC[C@H](O)c1cccnc1)Cc1ccccc1	ZINC000819044217	DD	On-Demand	Anodyne	ADRB2	39	54
O=[S@](CCNC[C@H](O)c1cccnc1)Cc1ccccc1	ZINC000819044217	DD	On-Demand	Anodyne	ADRB1	50	48
O=[S@](CCNC[C@H](O)c1cccnc1)Cc1ccccc1	ZINC000819044217	DD	On-Demand	Anodyne	ADRB3	133	51
O=[S@](CCNC[C@H](O)c1cccnc1)Cc1ccccc1	ZINC000819044217	DD	On-Demand	Anodyne	PTAFR	15	40
O=[S@@](CCNC[C@@H](O)c1cccnc1)Cc1ccccc1	ZINC000819044218	DD	On-Demand	Anodyne	ADRB2	39	54
O=[S@@](CCNC[C@@H](O)c1cccnc1)Cc1ccccc1	ZINC000819044218	DD	On-Demand	Anodyne	ADRB1	50	48
O=[S@@](CCNC[C@@H](O)c1cccnc1)Cc1ccccc1	ZINC000819044218	DD	On-Demand	Anodyne	ADRB3	133	51
O=[S@@](CCNC[C@@H](O)c1cccnc1)Cc1ccccc1	ZINC000819044218	DD	On-Demand	Anodyne	PTAFR	15	40
O=[S@](CCNC[C@@H](O)c1cccnc1)Cc1ccccc1	ZINC000819044219	DD	On-Demand	Anodyne	ADRB2	39	54
O=[S@](CCNC[C@@H](O)c1cccnc1)Cc1ccccc1	ZINC000819044219	DD	On-Demand	Anodyne	ADRB1	50	48
O=[S@](CCNC[C@@H](O)c1cccnc1)Cc1ccccc1	ZINC000819044219	DD	On-Demand	Anodyne	ADRB3	133	51
O=[S@](CCNC[C@@H](O)c1cccnc1)Cc1ccccc1	ZINC000819044219	DD	On-Demand	Anodyne	PTAFR	15	40
O=[S@@](CCNC[C@H](O)c1cccnc1)Cc1ccccc1	ZINC000819044220	DD	On-Demand	Anodyne	ADRB2	39	54
O=[S@@](CCNC[C@H](O)c1cccnc1)Cc1ccccc1	ZINC000819044220	DD	On-Demand	Anodyne	ADRB1	50	48
O=[S@@](CCNC[C@H](O)c1cccnc1)Cc1ccccc1	ZINC000819044220	DD	On-Demand	Anodyne	ADRB3	133	51
O=[S@@](CCNC[C@H](O)c1cccnc1)Cc1ccccc1	ZINC000819044220	DD	On-Demand	Anodyne	PTAFR	15	40
O=C(CCNCC[S@@](=O)Cc1ccccc1)Nc1ccccc1	ZINC000819044229	EF	On-Demand	Anodyne	LTA4H	23	40
O=C(CCNCC[S@@](=O)Cc1ccccc1)Nc1ccccc1	ZINC000819044229	EF	On-Demand	Anodyne	HDAC10	19	44
O=C(CCNCC[S@@](=O)Cc1ccccc1)Nc1ccccc1	ZINC000819044229	EF	On-Demand	Anodyne	HDAC2	16	44
O=C(CCNCC[S@@](=O)Cc1ccccc1)Nc1ccccc1	ZINC000819044229	EF	On-Demand	Anodyne	HDAC3	16	44
O=C(CCNCC[S@@](=O)Cc1ccccc1)Nc1ccccc1	ZINC000819044229	EF	On-Demand	Anodyne	HDAC6	15	44
O=C(CCNCC[S@](=O)Cc1ccccc1)Nc1ccccc1	ZINC000819044230	EF	On-Demand	Anodyne	LTA4H	23	40
O=C(CCNCC[S@](=O)Cc1ccccc1)Nc1ccccc1	ZINC000819044230	EF	On-Demand	Anodyne	HDAC10	19	44
O=C(CCNCC[S@](=O)Cc1ccccc1)Nc1ccccc1	ZINC000819044230	EF	On-Demand	Anodyne	HDAC2	16	44
O=C(CCNCC[S@](=O)Cc1ccccc1)Nc1ccccc1	ZINC000819044230	EF	On-Demand	Anodyne	HDAC3	16	44
O=C(CCNCC[S@](=O)Cc1ccccc1)Nc1ccccc1	ZINC000819044230	EF	On-Demand	Anodyne	HDAC6	15	44
CC(=O)c1ccc(N2CCN(C(=O)Cc3nsc4ccccc34)CC2)c(F)c1	ZINC000819044233	GH	On-Demand	Anodyne	NPY2R	74	38
CC(=O)c1ccc(N2CCN(C(=O)Cc3nsc4ccccc34)CC2)c(F)c1	ZINC000819044233	GH	On-Demand	Anodyne	SLC6A9	22	46
C=CCC1(C(=O)N2CCN(c3ccc(C(C)=O)cc3F)CC2)CCOCC1	ZINC000819044234	FG	On-Demand	Mild	SLC6A9	31	52
COc1ccc(CNC(=S)N2CC[C@@H](n3cc(C(N)=O)nn3)C2)cc1	ZINC000819044253	FC	On-Demand	Anodyne	MMP3	15	47
COc1ccc(CNC(=S)N2CC[C@@H](n3cc(C(N)=O)nn3)C2)cc1	ZINC000819044253	FC	On-Demand	Anodyne	MMP9	17	47
COc1ccc(CNC(=S)N2CC[C@@H](n3cc(C(N)=O)nn3)C2)cc1	ZINC000819044253	FC	On-Demand	Anodyne	MMP7	21	47
COc1ccc(CNC(=S)N2CC[C@@H](n3cc(C(N)=O)nn3)C2)cc1	ZINC000819044253	FC	On-Demand	Anodyne	MMP1	18	47
COc1ccc(CNC(=S)N2CC[C@@H](n3cc(C(N)=O)nn3)C2)cc1	ZINC000819044253	FC	On-Demand	Anodyne	PROKR1	46	31
COc1ccc(CNC(=S)N2CC[C@H](n3cc(C(N)=O)nn3)C2)cc1	ZINC000819044254	FC	On-Demand	Anodyne	MMP3	15	47
COc1ccc(CNC(=S)N2CC[C@H](n3cc(C(N)=O)nn3)C2)cc1	ZINC000819044254	FC	On-Demand	Anodyne	MMP9	17	47
COc1ccc(CNC(=S)N2CC[C@H](n3cc(C(N)=O)nn3)C2)cc1	ZINC000819044254	FC	On-Demand	Anodyne	MMP7	21	47
COc1ccc(CNC(=S)N2CC[C@H](n3cc(C(N)=O)nn3)C2)cc1	ZINC000819044254	FC	On-Demand	Anodyne	MMP1	18	47
COc1ccc(CNC(=S)N2CC[C@H](n3cc(C(N)=O)nn3)C2)cc1	ZINC000819044254	FC	On-Demand	Anodyne	PROKR1	46	31
O=[S@@](CCNC[C@H](O)CN1CCOCC1)Cc1ccccc1	ZINC000819044255	EC	On-Demand	Anodyne	ABCB1	30	41
O=[S@](CCNC[C@H](O)CN1CCOCC1)Cc1ccccc1	ZINC000819044256	EC	On-Demand	Anodyne	ABCB1	30	41
O=[S@](CCNC[C@@H](O)CN1CCOCC1)Cc1ccccc1	ZINC000819044257	EC	On-Demand	Anodyne	ABCB1	30	41
O=[S@@](CCNC[C@@H](O)CN1CCOCC1)Cc1ccccc1	ZINC000819044258	EC	On-Demand	Anodyne	ABCB1	30	41
Cc1ccc(OC[C@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819044274	EE	On-Demand	Anodyne	ADRB2	66	55
Cc1ccc(OC[C@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819044274	EE	On-Demand	Anodyne	ADRB1	99	55
Cc1ccc(OC[C@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819044274	EE	On-Demand	Anodyne	ADRB3	64	55
Cc1ccc(OC[C@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819044274	EE	On-Demand	Anodyne	ABCB1	31	49
Cc1ccc(OC[C@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819044275	EE	On-Demand	Anodyne	ADRB2	66	55
Cc1ccc(OC[C@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819044275	EE	On-Demand	Anodyne	ADRB1	99	55
Cc1ccc(OC[C@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819044275	EE	On-Demand	Anodyne	ADRB3	64	55
Cc1ccc(OC[C@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819044275	EE	On-Demand	Anodyne	ABCB1	31	49
Cc1ccc(OC[C@@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819044276	EE	On-Demand	Anodyne	ADRB2	66	55
Cc1ccc(OC[C@@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819044276	EE	On-Demand	Anodyne	ADRB1	99	55
Cc1ccc(OC[C@@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819044276	EE	On-Demand	Anodyne	ADRB3	64	55
Cc1ccc(OC[C@@H](O)CNCC[S@@](=O)Cc2ccccc2)cc1	ZINC000819044276	EE	On-Demand	Anodyne	ABCB1	31	49
Cc1ccc(OC[C@@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819044277	EE	On-Demand	Anodyne	ADRB2	66	55
Cc1ccc(OC[C@@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819044277	EE	On-Demand	Anodyne	ADRB1	99	55
Cc1ccc(OC[C@@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819044277	EE	On-Demand	Anodyne	ADRB3	64	55
Cc1ccc(OC[C@@H](O)CNCC[S@](=O)Cc2ccccc2)cc1	ZINC000819044277	EE	On-Demand	Anodyne	ABCB1	31	49
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819044286	FG	On-Demand	Anodyne	MLNR	17	42
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819044286	FG	On-Demand	Anodyne	SLC6A5	29	41
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819044287	FG	On-Demand	Anodyne	MLNR	17	42
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819044287	FG	On-Demand	Anodyne	SLC6A5	29	41
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819044288	FG	On-Demand	Anodyne	MLNR	17	42
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819044288	FG	On-Demand	Anodyne	SLC6A5	29	41
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819044289	FG	On-Demand	Anodyne	MLNR	17	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819044289	FG	On-Demand	Anodyne	SLC6A5	29	41
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1F	ZINC000819044424	GI	On-Demand	Anodyne	DRD4	39	41
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1F	ZINC000819044424	GI	On-Demand	Anodyne	HRH1	21	54
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1F	ZINC000819044424	GI	On-Demand	Anodyne	SIGMAR1	44	54
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1F	ZINC000819044424	GI	On-Demand	Anodyne	SSTR5	64	41
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1F	ZINC000819044424	GI	On-Demand	Anodyne	CCR3	59	54
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1F	ZINC000819044424	GI	On-Demand	Anodyne	UTS2R	17	41
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1F	ZINC000819044424	GI	On-Demand	Anodyne	CCR2	15	40
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1F	ZINC000819044424	GI	On-Demand	Anodyne	MCHR1	43	50
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1F	ZINC000819044424	GI	On-Demand	Anodyne	CACNA1G	21	42
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1F	ZINC000819044425	GI	On-Demand	Anodyne	DRD4	39	41
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1F	ZINC000819044425	GI	On-Demand	Anodyne	HRH1	21	54
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1F	ZINC000819044425	GI	On-Demand	Anodyne	SIGMAR1	44	54
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1F	ZINC000819044425	GI	On-Demand	Anodyne	SSTR5	64	41
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1F	ZINC000819044425	GI	On-Demand	Anodyne	CCR3	59	54
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1F	ZINC000819044425	GI	On-Demand	Anodyne	UTS2R	17	41
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1F	ZINC000819044425	GI	On-Demand	Anodyne	CCR2	15	40
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1F	ZINC000819044425	GI	On-Demand	Anodyne	MCHR1	43	50
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccccc1F	ZINC000819044425	GI	On-Demand	Anodyne	CACNA1G	21	42
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819044453	GH	On-Demand	Anodyne	HRH1	15	54
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819044453	GH	On-Demand	Anodyne	SIGMAR1	30	47
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819044453	GH	On-Demand	Anodyne	SSTR5	69	40
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819044453	GH	On-Demand	Anodyne	CCR3	49	54
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819044453	GH	On-Demand	Anodyne	MCHR1	34	43
O[C@@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819044453	GH	On-Demand	Anodyne	CACNA1G	22	47
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819044454	GH	On-Demand	Anodyne	HRH1	15	54
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819044454	GH	On-Demand	Anodyne	SIGMAR1	30	47
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819044454	GH	On-Demand	Anodyne	SSTR5	69	40
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819044454	GH	On-Demand	Anodyne	CCR3	49	54
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819044454	GH	On-Demand	Anodyne	MCHR1	34	43
O[C@H](CNC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819044454	GH	On-Demand	Anodyne	CACNA1G	22	47
O=C(C1CCC1)N(CCCNC[C@@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819044455	FG	On-Demand	Anodyne	ADRB2	45	39
O=C(C1CCC1)N(CCCNC[C@@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819044455	FG	On-Demand	Anodyne	ADRB1	58	48
O=C(C1CCC1)N(CCCNC[C@@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819044455	FG	On-Demand	Anodyne	ADRB3	69	48
O=C(C1CCC1)N(CCCNC[C@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819044456	FG	On-Demand	Anodyne	ADRB2	45	39
O=C(C1CCC1)N(CCCNC[C@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819044456	FG	On-Demand	Anodyne	ADRB1	58	48
O=C(C1CCC1)N(CCCNC[C@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819044456	FG	On-Demand	Anodyne	ADRB3	69	48
CC(=O)c1ccc(N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c(F)c1	ZINC000819044459	EE	On-Demand	Anodyne	SLC6A9	25	51
CC(=O)c1ccc(N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c(F)c1	ZINC000819044460	EE	On-Demand	Anodyne	SLC6A9	25	51
CC(=O)c1ccc(N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c(F)c1	ZINC000819044461	EE	On-Demand	Anodyne	SLC6A9	25	51
CC(=O)c1ccc(N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c(F)c1	ZINC000819044462	EE	On-Demand	Anodyne	SLC6A9	25	51
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	GHRHR	58	33
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	ELANE	34	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	CMA1	15	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	CTRA_BOVIN	64	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	BMP1	22	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	KLK3	78	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	CTSB	63	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	PAPA1_CARPA	80	39
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	CYSP_TRYCR	49	39
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	CTSG	43	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	CTSK	52	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	CTSL	48	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	CCR1	29	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	PGA	21	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	PREP	18	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	CAPNS1	63	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	CELA2A	52	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	CTSS	20	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	CAPN1	75	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	CASP1	25	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	CAPN2	120	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	CASP9	32	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	TGM2	22	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	NPR	58	38
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	CASP10	35	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	PSMB5	47	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819044558	HH	On-Demand	Anodyne	SLC12A5	70	38
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	GHRHR	58	33
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	ELANE	34	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	CMA1	15	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	CTRA_BOVIN	64	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	BMP1	22	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	KLK3	78	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	CTSB	63	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	PAPA1_CARPA	80	39
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	CYSP_TRYCR	49	39
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	CTSG	43	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	CTSK	52	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	CTSL	48	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	CCR1	29	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	PGA	21	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	PREP	18	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	CAPNS1	63	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	CELA2A	52	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	CTSS	20	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	CAPN1	75	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	CASP1	25	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	CAPN2	120	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	CASP9	32	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	TGM2	22	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	NPR	58	38
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	CASP10	35	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	PSMB5	47	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819044559	HH	On-Demand	Anodyne	SLC12A5	70	38
CC(C)c1ccc2cc(C(=O)N3CCC[C@](CO)(C(C)C)C3)[nH]c2c1	ZINC000819044658	EI	On-Demand	Anodyne	HRH4	21	41
CC(C)c1ccc2cc(C(=O)N3CCC[C@@](CO)(C(C)C)C3)[nH]c2c1	ZINC000819044659	EI	On-Demand	Anodyne	HRH4	21	41
CCCCCCCCC(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045008	CH	On-Demand	Mild	CQSS	52	34
CCCCCCCCC(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045009	CH	On-Demand	Mild	CQSS	52	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	ACE	19	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	GHRHR	64	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	P2RY12	152	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	CTRA_BOVIN	65	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	KLK3	88	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	CTSB	63	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	PAPA1_CARPA	72	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	CYSP_TRYCR	55	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	CTSG	44	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	CTSK	62	47
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	CTSL	50	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	PREP	19	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	CAPNS1	66	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	CELA2A	54	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	MMP11	41	31
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	CTSS	21	47
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	CAPN1	81	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	CAPN2	127	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	TGM2	29	49
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	TPSAB1	44	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	NPR	70	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045178	HF	On-Demand	Anodyne	SLC12A5	64	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	ACE	19	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	GHRHR	64	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	P2RY12	152	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	CTRA_BOVIN	65	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	KLK3	88	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	CTSB	63	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	PAPA1_CARPA	72	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	CYSP_TRYCR	55	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	CTSG	44	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	CTSK	62	47
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	CTSL	50	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	PREP	19	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	CAPNS1	66	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	CELA2A	54	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	MMP11	41	31
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	CTSS	21	47
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	CAPN1	81	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	CAPN2	127	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	TGM2	29	49
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	TPSAB1	44	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	NPR	70	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045179	HF	On-Demand	Anodyne	SLC12A5	64	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	ACE	19	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	GHRHR	64	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	P2RY12	152	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	CTRA_BOVIN	65	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	KLK3	88	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	CTSB	63	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	PAPA1_CARPA	72	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	CYSP_TRYCR	55	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	CTSG	44	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	CTSK	62	47
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	CTSL	50	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	PREP	19	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	CAPNS1	66	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	CELA2A	54	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	MMP11	41	31
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	CTSS	21	47
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	CAPN1	81	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	CAPN2	127	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	TGM2	29	49
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	TPSAB1	44	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	NPR	70	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045180	HF	On-Demand	Anodyne	SLC12A5	64	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	ACE	19	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	GHRHR	64	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	P2RY12	152	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	CTRA_BOVIN	65	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	KLK3	88	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	CTSB	63	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	PAPA1_CARPA	72	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	CYSP_TRYCR	55	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	CTSG	44	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	CTSK	62	47
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	CTSL	50	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	PREP	19	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	CAPNS1	66	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	CELA2A	54	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	MMP11	41	31
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	CTSS	21	47
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	CAPN1	81	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	CAPN2	127	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	TGM2	29	49
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	TPSAB1	44	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	NPR	70	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045181	HF	On-Demand	Anodyne	SLC12A5	64	39
CCCCCCC(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819045252	CG	On-Demand	Anodyne	CQSS	52	34
CCCCCCC(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819045253	CG	On-Demand	Anodyne	CQSS	52	34
Cc1noc(C2CCC(NC(=O)Nc3ccccc3CC(=O)O)CC2)n1	ZINC000819045256	FF	On-Demand	Anodyne	EPHX2	16	46
Cc1noc(C2CCC(NC(=O)N3CC[C@H](C(=O)O)C3)CC2)n1	ZINC000819045259	DD	On-Demand	Anodyne	SMO	39	48
Cc1noc(C2CCC(NC(=O)N3CC[C@H](C(=O)O)C3)CC2)n1	ZINC000819045259	DD	On-Demand	Anodyne	ETHR	52	36
Cc1noc(C2CCC(NC(=O)N3CC[C@@H](C(=O)O)C3)CC2)n1	ZINC000819045260	DD	On-Demand	Anodyne	SMO	39	48
Cc1noc(C2CCC(NC(=O)N3CC[C@@H](C(=O)O)C3)CC2)n1	ZINC000819045260	DD	On-Demand	Anodyne	ETHR	52	36
Cc1noc(C2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)n1	ZINC000819045272	EE	On-Demand	Anodyne	RBP4	40	40
Cc1noc(C2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)n1	ZINC000819045272	EE	On-Demand	Anodyne	SMO	52	55
Cc1noc(C2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)n1	ZINC000819045272	EE	On-Demand	Anodyne	ETHR	66	42
Cc1noc(C2CCN(C(=O)C(=O)Nc3ccccc3CC(=O)O)CC2)n1	ZINC000819045275	FD	On-Demand	Anodyne	SMO	40	44
Cc1noc(C2CCN(C(=O)C(=O)Nc3ccccc3CC(=O)O)CC2)n1	ZINC000819045275	FD	On-Demand	Anodyne	ETHR	65	41
Cc1noc(C2CCC(NC(=O)N3CCO[C@@H](C(=O)O)C3)CC2)n1	ZINC000819045278	EC	On-Demand	Anodyne	SMO	33	46
Cc1noc(C2CCC(NC(=O)N3CCO[C@@H](C(=O)O)C3)CC2)n1	ZINC000819045278	EC	On-Demand	Anodyne	ETHR	45	34
Cc1noc(C2CCC(NC(=O)N3CCO[C@H](C(=O)O)C3)CC2)n1	ZINC000819045279	EC	On-Demand	Anodyne	SMO	33	46
Cc1noc(C2CCC(NC(=O)N3CCO[C@H](C(=O)O)C3)CC2)n1	ZINC000819045279	EC	On-Demand	Anodyne	ETHR	45	34
Cc1nonc1C(=O)N[C@H](CC(C)C)C(=O)O	ZINC000819045291	BC	On-Demand	Anodyne	LAP3	15	41
Cc1noc(CCCC(=O)OCc2ccc(C(=O)O)cc2)n1	ZINC000819045303	DE	On-Demand	Anodyne	TPSAB1	41	33
Cc1noc(C2CCN(C(=O)NCCCCCC(=O)O)CC2)n1	ZINC000819045335	DD	On-Demand	Anodyne	ETHR	63	37
Cc1noc(C2CCC(NC(=O)N3CCC(C(=O)O)CC3)CC2)n1	ZINC000819045337	ED	On-Demand	Anodyne	SMO	37	47
Cc1noc(C2CCC(NC(=O)N3CCC(C(=O)O)CC3)CC2)n1	ZINC000819045337	ED	On-Demand	Anodyne	ETHR	41	33
Cc1noc(C2CCC(NC(=O)Nc3cccc(CC(=O)O)c3)CC2)n1	ZINC000819045342	FF	On-Demand	Anodyne	NPY1R	29	44
Cc1noc(C2CCC(NC(=O)Nc3cccc(CC(=O)O)c3)CC2)n1	ZINC000819045342	FF	On-Demand	Anodyne	CCKBR	22	41
Cc1noc(C2CCC(NC(=O)Nc3cccc(CC(=O)O)c3)CC2)n1	ZINC000819045342	FF	On-Demand	Anodyne	EPHX2	22	41
Cc1noc(C2CCN(C(=O)C(=O)Nc3cccc(CC(=O)O)c3)CC2)n1	ZINC000819045344	FD	On-Demand	Anodyne	SMO	36	41
Cc1noc(C2CCN(C(=O)C(=O)Nc3cccc(CC(=O)O)c3)CC2)n1	ZINC000819045344	FD	On-Demand	Anodyne	ETHR	62	37
Cc1noc(C2CCN(C(=O)NCCC(=O)O)CC2)n1	ZINC000819045346	CC	On-Demand	Anodyne	SMO	39	42
Cc1noc(C2CCN(C(=O)NCCC(=O)O)CC2)n1	ZINC000819045346	CC	On-Demand	Anodyne	ETHR	66	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(NC(=O)c3ccccc3)CC1)C2	ZINC000819045379	GE	On-Demand	Anodyne	SFRP1	50	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(NC(=O)c3ccccc3)CC1)C2	ZINC000819045379	GE	On-Demand	Anodyne	WNT3	50	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(NC(=O)c3ccccc3)CC1)C2	ZINC000819045380	GE	On-Demand	Anodyne	SFRP1	50	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(NC(=O)c3ccccc3)CC1)C2	ZINC000819045380	GE	On-Demand	Anodyne	WNT3	50	32
CCOc1ccc([C@@H](C)NC(=O)C(F)=C2CCC2)cc1	ZINC000819045404	CH	On-Demand	Anodyne	ACACA	27	44
CCOc1ccc([C@@H](C)NC(=O)C(F)=C2CCC2)cc1	ZINC000819045404	CH	On-Demand	Anodyne	ACACB	29	55
O=C1[C@@H](NC[C@H](O)c2ccccc2Cl)CCN1c1ccccc1	ZINC000819045406	EF	On-Demand	Anodyne	OPRL1	49	40
O=C1[C@H](NC[C@H](O)c2ccccc2Cl)CCN1c1ccccc1	ZINC000819045407	EF	On-Demand	Anodyne	OPRL1	49	40
Cc1ccc(OC[C@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c(C)c1	ZINC000819045439	GD	On-Demand	Anodyne	ADRB2	25	49
Cc1ccc(OC[C@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c(C)c1	ZINC000819045439	GD	On-Demand	Anodyne	ADRB1	19	49
Cc1ccc(OC[C@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c(C)c1	ZINC000819045439	GD	On-Demand	Anodyne	ADRB3	25	42
Cc1ccc(OC[C@@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c(C)c1	ZINC000819045440	GD	On-Demand	Anodyne	ADRB2	25	49
Cc1ccc(OC[C@@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c(C)c1	ZINC000819045440	GD	On-Demand	Anodyne	ADRB1	19	49
Cc1ccc(OC[C@@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c(C)c1	ZINC000819045440	GD	On-Demand	Anodyne	ADRB3	25	42
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819045441	FG	On-Demand	Bother	ADRB2	15	40
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819045441	FG	On-Demand	Bother	ADRB1	37	44
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819045441	FG	On-Demand	Bother	ADRB3	40	44
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819045441	FG	On-Demand	Bother	ACR	16	42
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819045442	FG	On-Demand	Bother	ADRB2	15	40
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819045442	FG	On-Demand	Bother	ADRB1	37	44
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819045442	FG	On-Demand	Bother	ADRB3	40	44
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819045442	FG	On-Demand	Bother	ACR	16	42
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819045448	EE	On-Demand	Bother	ADRB2	28	44
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819045448	EE	On-Demand	Bother	ADRB1	50	48
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819045448	EE	On-Demand	Bother	ADRB3	53	48
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819045448	EE	On-Demand	Bother	ACR	21	46
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819045449	EE	On-Demand	Bother	ADRB2	28	44
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819045449	EE	On-Demand	Bother	ADRB1	50	48
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819045449	EE	On-Demand	Bother	ADRB3	53	48
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819045449	EE	On-Demand	Bother	ACR	21	46
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819045454	GD	On-Demand	Bother	ADRB2	22	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819045454	GD	On-Demand	Bother	ADRB1	33	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819045454	GD	On-Demand	Bother	ADRB3	44	44
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819045455	GD	On-Demand	Bother	ADRB2	22	41
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819045455	GD	On-Demand	Bother	ADRB1	33	44
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819045455	GD	On-Demand	Bother	ADRB3	44	44
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)cc1	ZINC000819045479	FC	On-Demand	Bother	ADRB1	23	40
O=[N+]([O-])c1ccc(OCCNC[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1	ZINC000819045480	FC	On-Demand	Bother	ADRB1	23	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000819045497	GE	On-Demand	Anodyne	DRD4	16	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000819045497	GE	On-Demand	Anodyne	CCR8	32	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000819045497	GE	On-Demand	Anodyne	SFRP1	93	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000819045497	GE	On-Demand	Anodyne	WNT3	74	35
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819045500	DE	On-Demand	Bother	ADRB1	26	44
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819045500	DE	On-Demand	Bother	ADRB3	24	44
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819045501	DE	On-Demand	Bother	ADRB1	26	44
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819045501	DE	On-Demand	Bother	ADRB3	24	44
Cc1ccccc1[C@@H](O)CNCCOc1ccc([N+](=O)[O-])cc1	ZINC000819045502	DF	On-Demand	Bother	ADRB2	18	42
Cc1ccccc1[C@@H](O)CNCCOc1ccc([N+](=O)[O-])cc1	ZINC000819045502	DF	On-Demand	Bother	ADRB1	30	45
Cc1ccccc1[C@@H](O)CNCCOc1ccc([N+](=O)[O-])cc1	ZINC000819045502	DF	On-Demand	Bother	ADRB3	22	45
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819045514	FG	On-Demand	Bother	ADRB1	23	43
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819045514	FG	On-Demand	Bother	ADRB3	19	43
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819045515	FG	On-Demand	Bother	ADRB1	23	43
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819045515	FG	On-Demand	Bother	ADRB3	19	43
CCOc1ccc([C@H](C)NC(=O)/C=C/[C@@H]2CCCO2)cc1	ZINC000819045522	CF	On-Demand	Anodyne	ACACA	24	41
CCOc1ccc([C@H](C)NC(=O)/C=C/[C@@H]2CCCO2)cc1	ZINC000819045522	CF	On-Demand	Anodyne	ACACB	25	46
CCOc1ccc([C@H](C)NC(=O)/C=C\[C@@H]2CCCO2)cc1	ZINC000819045523	CF	On-Demand	Anodyne	ACACA	24	41
CCOc1ccc([C@H](C)NC(=O)/C=C\[C@@H]2CCCO2)cc1	ZINC000819045523	CF	On-Demand	Anodyne	ACACB	25	46
CCOc1ccc([C@H](C)NC(=O)/C=C\[C@H]2CCCO2)cc1	ZINC000819045524	CF	On-Demand	Anodyne	ACACA	24	41
CCOc1ccc([C@H](C)NC(=O)/C=C\[C@H]2CCCO2)cc1	ZINC000819045524	CF	On-Demand	Anodyne	ACACB	25	46
CCOc1ccc([C@H](C)NC(=O)/C=C/[C@H]2CCCO2)cc1	ZINC000819045525	CF	On-Demand	Anodyne	ACACA	24	41
CCOc1ccc([C@H](C)NC(=O)/C=C/[C@H]2CCCO2)cc1	ZINC000819045525	CF	On-Demand	Anodyne	ACACB	25	46
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)c1	ZINC000819045526	GH	On-Demand	Anodyne	KCNQ2	27	42
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)c1	ZINC000819045526	GH	On-Demand	Anodyne	NPY2R	51	48
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)c1	ZINC000819045526	GH	On-Demand	Anodyne	IMDH_CRYPV	35	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(NS(C)(=O)=O)CC1	ZINC000819045537	FC	On-Demand	Anodyne	SFRP1	75	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(NS(C)(=O)=O)CC1	ZINC000819045537	FC	On-Demand	Anodyne	WNT3	71	36
O=C(COC(=O)Cn1cnc2sccc2c1=O)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819045538	IF	On-Demand	Anodyne	TRPA1	15	46
CON(C)C(=O)CCNC[C@H]1CCc2ccccc21	ZINC000819045563	CD	On-Demand	Anodyne	MTNR1A	20	41
CON(C)C(=O)CCNC[C@H]1CCc2ccccc21	ZINC000819045563	CD	On-Demand	Anodyne	MTNR1B	23	41
CON(C)C(=O)CCNC[C@@H]1CCc2ccccc21	ZINC000819045564	CD	On-Demand	Anodyne	MTNR1A	20	41
CON(C)C(=O)CCNC[C@@H]1CCc2ccccc21	ZINC000819045564	CD	On-Demand	Anodyne	MTNR1B	23	41
O=C(NCCCNC[C@H](O)c1cccc(Cl)c1)c1ccc(F)cc1	ZINC000819045572	FF	On-Demand	Anodyne	ADRB2	47	37
O=C(NCCCNC[C@H](O)c1cccc(Cl)c1)c1ccc(F)cc1	ZINC000819045572	FF	On-Demand	Anodyne	ADRB1	60	53
O=C(NCCCNC[C@H](O)c1cccc(Cl)c1)c1ccc(F)cc1	ZINC000819045572	FF	On-Demand	Anodyne	DRD3	20	44
O=C(NCCCNC[C@H](O)c1cccc(Cl)c1)c1ccc(F)cc1	ZINC000819045572	FF	On-Demand	Anodyne	FOLH1	21	40
O=C(NCCCNC[C@H](O)c1cccc(Cl)c1)c1ccc(F)cc1	ZINC000819045572	FF	On-Demand	Anodyne	ADRB3	71	53
O=C(NCCCNC[C@H](O)c1cccc(Cl)c1)c1ccc(F)cc1	ZINC000819045572	FF	On-Demand	Anodyne	PLD2	30	41
O=C(NCCCNC[C@H](O)c1cccc(Cl)c1)c1ccc(F)cc1	ZINC000819045572	FF	On-Demand	Anodyne	ALPL	42	37
O=C(NCCCNC[C@@H](O)c1cccc(Cl)c1)c1ccc(F)cc1	ZINC000819045573	FF	On-Demand	Anodyne	ADRB2	47	37
O=C(NCCCNC[C@@H](O)c1cccc(Cl)c1)c1ccc(F)cc1	ZINC000819045573	FF	On-Demand	Anodyne	ADRB1	60	53
O=C(NCCCNC[C@@H](O)c1cccc(Cl)c1)c1ccc(F)cc1	ZINC000819045573	FF	On-Demand	Anodyne	DRD3	20	44
O=C(NCCCNC[C@@H](O)c1cccc(Cl)c1)c1ccc(F)cc1	ZINC000819045573	FF	On-Demand	Anodyne	FOLH1	21	40
O=C(NCCCNC[C@@H](O)c1cccc(Cl)c1)c1ccc(F)cc1	ZINC000819045573	FF	On-Demand	Anodyne	ADRB3	71	53
O=C(NCCCNC[C@@H](O)c1cccc(Cl)c1)c1ccc(F)cc1	ZINC000819045573	FF	On-Demand	Anodyne	PLD2	30	41
O=C(NCCCNC[C@@H](O)c1cccc(Cl)c1)c1ccc(F)cc1	ZINC000819045573	FF	On-Demand	Anodyne	ALPL	42	37
Cn1nnnc1-c1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819045578	CE	On-Demand	Anodyne	CCR3	89	45
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1Cl	ZINC000819045579	FG	On-Demand	Anodyne	ADRB1	31	40
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1Cl	ZINC000819045579	FG	On-Demand	Anodyne	ADRB3	47	43
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1Cl	ZINC000819045579	FG	On-Demand	Anodyne	KCNQ2	22	40
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1Cl	ZINC000819045579	FG	On-Demand	Anodyne	CYP3A4	48	36
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1Cl	ZINC000819045580	FG	On-Demand	Anodyne	ADRB1	31	40
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1Cl	ZINC000819045580	FG	On-Demand	Anodyne	ADRB3	47	43
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1Cl	ZINC000819045580	FG	On-Demand	Anodyne	KCNQ2	22	40
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1Cl	ZINC000819045580	FG	On-Demand	Anodyne	CYP3A4	48	36
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1Cl	ZINC000819045581	FG	On-Demand	Anodyne	ADRB1	31	40
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1Cl	ZINC000819045581	FG	On-Demand	Anodyne	ADRB3	47	43
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1Cl	ZINC000819045581	FG	On-Demand	Anodyne	KCNQ2	22	40
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1Cl	ZINC000819045581	FG	On-Demand	Anodyne	CYP3A4	48	36
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1Cl	ZINC000819045582	FG	On-Demand	Anodyne	ADRB1	31	40
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1Cl	ZINC000819045582	FG	On-Demand	Anodyne	ADRB3	47	43
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1Cl	ZINC000819045582	FG	On-Demand	Anodyne	KCNQ2	22	40
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1Cl	ZINC000819045582	FG	On-Demand	Anodyne	CYP3A4	48	36
O=C1[C@@H](NC[C@@H](O)c2cc(F)ccc2F)CCN1c1ccccc1Cl	ZINC000819045585	FG	On-Demand	Anodyne	P2RX7	32	44
O=C1[C@H](NC[C@@H](O)c2cc(F)ccc2F)CCN1c1ccccc1Cl	ZINC000819045586	FG	On-Demand	Anodyne	P2RX7	32	44
O=C1[C@@H](NC[C@H](O)c2cc(F)ccc2F)CCN1c1ccccc1Cl	ZINC000819045587	FG	On-Demand	Anodyne	P2RX7	32	44
O=C1[C@H](NC[C@H](O)c2cc(F)ccc2F)CCN1c1ccccc1Cl	ZINC000819045588	FG	On-Demand	Anodyne	P2RX7	32	44
Cc1cc(F)ccc1[C@@H](O)CNCCCNC(=O)c1ccc(F)cc1	ZINC000819045592	EF	On-Demand	Anodyne	FOLH1	25	42
Cc1cc(F)ccc1[C@@H](O)CNCCCNC(=O)c1ccc(F)cc1	ZINC000819045592	EF	On-Demand	Anodyne	LEF	84	37
O=C(NC1CCN(C(=O)Nc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819045599	EG	On-Demand	Anodyne	EPHX2	59	46
O=C(CCc1cccc(OC(F)F)c1)N1CCCCCCC1	ZINC000819045600	DI	On-Demand	Anodyne	PLA2G4A	19	40
O=C(CCc1cccc(OC(F)F)c1)N1CCCCCCC1	ZINC000819045600	DI	On-Demand	Anodyne	C3AR1	41	40
O=C(CCc1cccc(OC(F)F)c1)N1CCCCCCC1	ZINC000819045600	DI	On-Demand	Anodyne	PREP	34	40
O=C(CCc1cccc(OC(F)F)c1)N1CCCCCCC1	ZINC000819045600	DI	On-Demand	Anodyne	DPP7	34	41
COC(=O)C1CCN(C(=O)COC(=O)Cn2cnc3sccc3c2=O)CC1	ZINC000819045613	GC	On-Demand	Anodyne	PTR1	49	35
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(C(=O)Nc2ccccc2)CC1	ZINC000819045633	EF	On-Demand	Anodyne	EPHX2	46	43
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(C(=O)Nc2ccccc2)CC1	ZINC000819045633	EF	On-Demand	Anodyne	SMO	20	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(C(=O)Nc2ccccc2)CC1	ZINC000819045634	EF	On-Demand	Anodyne	EPHX2	46	43
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(C(=O)Nc2ccccc2)CC1	ZINC000819045634	EF	On-Demand	Anodyne	SMO	20	41
O=C(/C=C/[C@H]1CCCO1)NC1CCN(C(=O)Nc2ccccc2)CC1	ZINC000819045635	EF	On-Demand	Anodyne	EPHX2	46	43
O=C(/C=C/[C@H]1CCCO1)NC1CCN(C(=O)Nc2ccccc2)CC1	ZINC000819045635	EF	On-Demand	Anodyne	SMO	20	41
O=C(/C=C\[C@H]1CCCO1)NC1CCN(C(=O)Nc2ccccc2)CC1	ZINC000819045636	EF	On-Demand	Anodyne	EPHX2	46	43
O=C(/C=C\[C@H]1CCCO1)NC1CCN(C(=O)Nc2ccccc2)CC1	ZINC000819045636	EF	On-Demand	Anodyne	SMO	20	41
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2)CCN1c1ccccc1Cl	ZINC000819045642	EF	On-Demand	Anodyne	P2RX7	19	42
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2)CCN1c1ccccc1Cl	ZINC000819045643	EF	On-Demand	Anodyne	P2RX7	19	42
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2)CCN1c1ccccc1Cl	ZINC000819045644	EF	On-Demand	Anodyne	P2RX7	19	42
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2)CCN1c1ccccc1Cl	ZINC000819045645	EF	On-Demand	Anodyne	P2RX7	19	42
CN(C)c1ccc(NC(=O)CCNCCCNC(=O)c2cccc(F)c2)cc1	ZINC000819045650	GF	On-Demand	Anodyne	KCNK3	31	42
CN(C)c1ccc(NC(=O)CCNCCCNC(=O)c2cccc(F)c2)cc1	ZINC000819045650	GF	On-Demand	Anodyne	KCNK9	22	41
O=C(c1coc(=O)c2ccccc12)N1CCCCCCC1	ZINC000819045651	CG	On-Demand	Anodyne	NPSR1	15	40
O=C(c1coc(=O)c2ccccc12)N1CCCCCCC1	ZINC000819045651	CG	On-Demand	Anodyne	L3MBTL3	48	49
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1nc2ccccc2n1C(F)F	ZINC000819045671	EG	On-Demand	Anodyne	PDE6D	59	35
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1nc2ccccc2n1C(F)F	ZINC000819045672	EG	On-Demand	Anodyne	PDE6D	59	35
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1nc2ccccc2n1C(F)F	ZINC000819045673	EG	On-Demand	Anodyne	PDE6D	59	35
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1nc2ccccc2n1C(F)F	ZINC000819045674	EG	On-Demand	Anodyne	PDE6D	59	35
COc1ccc(-c2csc(NC(=O)COC(=O)Cn3cnc4sccc4c3=O)n2)cc1	ZINC000819045698	JF	On-Demand	Anodyne	TRPA1	15	49
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819045699	EF	On-Demand	Bother	ADRB1	24	40
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819045699	EF	On-Demand	Bother	ADRB3	16	40
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819045699	EF	On-Demand	Bother	ACR	15	44
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819045700	EF	On-Demand	Bother	ADRB1	24	40
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819045700	EF	On-Demand	Bother	ADRB3	16	40
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819045700	EF	On-Demand	Bother	ACR	15	44
COc1ccc2cc(CNC(=O)C(F)=C3CCC3)ccc2c1	ZINC000819045705	CH	On-Demand	Anodyne	MTNR1A	61	36
COc1ccc2cc(CNC(=O)C(F)=C3CCC3)ccc2c1	ZINC000819045705	CH	On-Demand	Anodyne	MTNR1B	50	36
COc1ccc2cc(CNC(=O)C(F)=C3CCC3)ccc2c1	ZINC000819045705	CH	On-Demand	Anodyne	CA9	15	40
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819045706	FG	On-Demand	Bother	ADRB1	18	42
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819045706	FG	On-Demand	Bother	ADRB3	21	42
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819045707	FG	On-Demand	Bother	ADRB1	18	42
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819045707	FG	On-Demand	Bother	ADRB3	21	42
O[C@@H](CNC[C@@H]1CCCCN1Cc1cccc(Cl)c1)c1cccnc1	ZINC000819045715	FG	On-Demand	Anodyne	ADRB1	37	41
O[C@@H](CNC[C@@H]1CCCCN1Cc1cccc(Cl)c1)c1cccnc1	ZINC000819045715	FG	On-Demand	Anodyne	ADRB3	97	41
O[C@@H](CNC[C@H]1CCCCN1Cc1cccc(Cl)c1)c1cccnc1	ZINC000819045716	FG	On-Demand	Anodyne	ADRB1	37	41
O[C@@H](CNC[C@H]1CCCCN1Cc1cccc(Cl)c1)c1cccnc1	ZINC000819045716	FG	On-Demand	Anodyne	ADRB3	97	41
O[C@H](CNC[C@@H]1CCCCN1Cc1cccc(Cl)c1)c1cccnc1	ZINC000819045717	FG	On-Demand	Anodyne	ADRB1	37	41
O[C@H](CNC[C@@H]1CCCCN1Cc1cccc(Cl)c1)c1cccnc1	ZINC000819045717	FG	On-Demand	Anodyne	ADRB3	97	41
O[C@H](CNC[C@H]1CCCCN1Cc1cccc(Cl)c1)c1cccnc1	ZINC000819045718	FG	On-Demand	Anodyne	ADRB1	37	41
O[C@H](CNC[C@H]1CCCCN1Cc1cccc(Cl)c1)c1cccnc1	ZINC000819045718	FG	On-Demand	Anodyne	ADRB3	97	41
O=C(C(F)=C1CCC1)N1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000819045726	FE	On-Demand	Anodyne	CCR8	70	32
O=C(C(F)=C1CCC1)N1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000819045726	FE	On-Demand	Anodyne	SFRP1	122	37
O=C(C(F)=C1CCC1)N1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000819045726	FE	On-Demand	Anodyne	WNT3	84	36
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccc(Br)cc2)cc1	ZINC000819045749	GG	On-Demand	Bother	ADRB1	22	44
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccc(Br)cc2)cc1	ZINC000819045749	GG	On-Demand	Bother	ADRB3	21	44
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccc(Br)cc2)cc1	ZINC000819045750	GG	On-Demand	Bother	ADRB1	22	44
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccc(Br)cc2)cc1	ZINC000819045750	GG	On-Demand	Bother	ADRB3	21	44
Cc1cc(F)ccc1[C@@H](O)CNCCOc1ccc([N+](=O)[O-])cc1	ZINC000819045759	EF	On-Demand	Bother	ADRB1	21	40
Cc1cc(F)ccc1[C@@H](O)CNCCOc1ccc([N+](=O)[O-])cc1	ZINC000819045759	EF	On-Demand	Bother	ADRB3	15	40
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)CCN1c1ccccc1Cl	ZINC000819045767	GH	On-Demand	Anodyne	P2RX7	39	47
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)CCN1c1ccccc1Cl	ZINC000819045768	GH	On-Demand	Anodyne	P2RX7	39	47
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)CCN1c1ccccc1Cl	ZINC000819045769	GH	On-Demand	Anodyne	P2RX7	39	47
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2Cl)CCN1c1ccccc1Cl	ZINC000819045770	GH	On-Demand	Anodyne	P2RX7	39	47
O=C(NCCCNC[C@H](O)c1cccc(C(F)(F)F)c1)c1cccc(F)c1	ZINC000819045771	GG	On-Demand	Anodyne	CCR2	78	45
O=C(NCCCNC[C@H](O)c1cccc(C(F)(F)F)c1)c1cccc(F)c1	ZINC000819045771	GG	On-Demand	Anodyne	KCNK3	15	40
O=C(NCCCNC[C@@H](O)c1cccc(C(F)(F)F)c1)c1cccc(F)c1	ZINC000819045772	GG	On-Demand	Anodyne	CCR2	78	45
O=C(NCCCNC[C@@H](O)c1cccc(C(F)(F)F)c1)c1cccc(F)c1	ZINC000819045772	GG	On-Demand	Anodyne	KCNK3	15	40
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(NC(=O)CN2CCOCC2)cc1	ZINC000819045776	FD	On-Demand	Anodyne	MTOR	44	33
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(NC(=O)CN2CCOCC2)cc1	ZINC000819045777	FD	On-Demand	Anodyne	MTOR	44	33
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(NC(=O)CN2CCOCC2)cc1	ZINC000819045778	FD	On-Demand	Anodyne	MTOR	44	33
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(NC(=O)CN2CCOCC2)cc1	ZINC000819045779	FD	On-Demand	Anodyne	MTOR	44	33
O=C1C[C@@H](C(=O)NNC(=S)Nc2cccc(OC(F)(F)F)c2)CN1	ZINC000819045783	FD	On-Demand	Reactive	TAAR1	24	45
O=C1C[C@H](C(=O)NNC(=S)Nc2cccc(OC(F)(F)F)c2)CN1	ZINC000819045784	FD	On-Demand	Reactive	TAAR1	24	45
CC[C@H]1CCCN(C(C)(C)CNC[C@@H](O)c2cccnc2)C1	ZINC000819045794	DF	On-Demand	Anodyne	ADRB2	17	40
CC[C@H]1CCCN(C(C)(C)CNC[C@@H](O)c2cccnc2)C1	ZINC000819045794	DF	On-Demand	Anodyne	ADRB3	76	42
CC[C@@H]1CCCN(C(C)(C)CNC[C@@H](O)c2cccnc2)C1	ZINC000819045795	DF	On-Demand	Anodyne	ADRB2	17	40
CC[C@@H]1CCCN(C(C)(C)CNC[C@@H](O)c2cccnc2)C1	ZINC000819045795	DF	On-Demand	Anodyne	ADRB3	76	42
CC[C@H]1CCCN(C(C)(C)CNC[C@H](O)c2cccnc2)C1	ZINC000819045796	DF	On-Demand	Anodyne	ADRB2	17	40
CC[C@H]1CCCN(C(C)(C)CNC[C@H](O)c2cccnc2)C1	ZINC000819045796	DF	On-Demand	Anodyne	ADRB3	76	42
CC[C@@H]1CCCN(C(C)(C)CNC[C@H](O)c2cccnc2)C1	ZINC000819045797	DF	On-Demand	Anodyne	ADRB2	17	40
CC[C@@H]1CCCN(C(C)(C)CNC[C@H](O)c2cccnc2)C1	ZINC000819045797	DF	On-Demand	Anodyne	ADRB3	76	42
O=C(CN1CCOCC1)Nc1ccc(NC(=O)C(F)=C2CCC2)cc1	ZINC000819045808	EE	On-Demand	Anodyne	EPHX2	24	41
Cn1nnnc1-c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819045813	GE	On-Demand	Mild	PAPA1_CARPA	38	40
Cn1nnnc1-c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819045813	GE	On-Demand	Mild	CCR3	77	43
Cn1nnnc1-c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819045813	GE	On-Demand	Mild	CTSV	41	32
Cn1nnnc1-c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819045829	GE	On-Demand	Mild	PAPA1_CARPA	38	40
Cn1nnnc1-c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819045829	GE	On-Demand	Mild	CCR3	77	43
Cn1nnnc1-c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819045829	GE	On-Demand	Mild	CTSV	41	32
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)cc1	ZINC000819045832	GC	On-Demand	Anodyne	ADRB2	35	45
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)cc1	ZINC000819045832	GC	On-Demand	Anodyne	ADRB1	50	45
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)cc1	ZINC000819045832	GC	On-Demand	Anodyne	ADRB3	43	51
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)cc1	ZINC000819045834	GC	On-Demand	Anodyne	ADRB2	35	45
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)cc1	ZINC000819045834	GC	On-Demand	Anodyne	ADRB1	50	45
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)cc1	ZINC000819045834	GC	On-Demand	Anodyne	ADRB3	43	51
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819045844	DH	On-Demand	Anodyne	HTR1D	21	44
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819045844	DH	On-Demand	Anodyne	HTR1B	18	44
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819045844	DH	On-Demand	Anodyne	HTR1F	68	38
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819045844	DH	On-Demand	Anodyne	CCR2	36	57
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819045845	DH	On-Demand	Anodyne	HTR1D	21	44
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819045845	DH	On-Demand	Anodyne	HTR1B	18	44
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819045845	DH	On-Demand	Anodyne	HTR1F	68	38
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819045845	DH	On-Demand	Anodyne	CCR2	36	57
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819045847	DH	On-Demand	Anodyne	HTR1D	21	44
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819045847	DH	On-Demand	Anodyne	HTR1B	18	44
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819045847	DH	On-Demand	Anodyne	HTR1F	68	38
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819045847	DH	On-Demand	Anodyne	CCR2	36	57
O[C@@H](CNCC1(Sc2ccccc2)CC1)c1cccnc1	ZINC000819045848	DG	On-Demand	Anodyne	ADRB2	19	42
O[C@@H](CNCC1(Sc2ccccc2)CC1)c1cccnc1	ZINC000819045848	DG	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CNCC1(Sc2ccccc2)CC1)c1cccnc1	ZINC000819045848	DG	On-Demand	Anodyne	ADRB3	81	44
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819045849	DH	On-Demand	Anodyne	HTR1D	21	44
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819045849	DH	On-Demand	Anodyne	HTR1B	18	44
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819045849	DH	On-Demand	Anodyne	HTR1F	68	38
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819045849	DH	On-Demand	Anodyne	CCR2	36	57
O[C@H](CNCC1(Sc2ccccc2)CC1)c1cccnc1	ZINC000819045850	DG	On-Demand	Anodyne	ADRB2	19	42
O[C@H](CNCC1(Sc2ccccc2)CC1)c1cccnc1	ZINC000819045850	DG	On-Demand	Anodyne	ADRB1	20	40
O[C@H](CNCC1(Sc2ccccc2)CC1)c1cccnc1	ZINC000819045850	DG	On-Demand	Anodyne	ADRB3	81	44
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccnc2)cc1	ZINC000819045854	DD	On-Demand	Bother	ADRB2	34	62
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccnc2)cc1	ZINC000819045854	DD	On-Demand	Bother	ADRB1	48	62
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccnc2)cc1	ZINC000819045854	DD	On-Demand	Bother	ADRB3	118	64
O=C(NCCCNC[C@H](O)c1ccc(Cl)c(F)c1)c1cccc(F)c1	ZINC000819045855	FG	On-Demand	Anodyne	ADRB1	29	40
O=C(NCCCNC[C@H](O)c1ccc(Cl)c(F)c1)c1cccc(F)c1	ZINC000819045855	FG	On-Demand	Anodyne	ADRB3	29	40
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819045856	DD	On-Demand	Bother	ADRB2	34	62
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819045856	DD	On-Demand	Bother	ADRB1	48	62
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819045856	DD	On-Demand	Bother	ADRB3	118	64
O=C(NCCCNC[C@@H](O)c1ccc(Cl)c(F)c1)c1cccc(F)c1	ZINC000819045857	FG	On-Demand	Anodyne	ADRB1	29	40
O=C(NCCCNC[C@@H](O)c1ccc(Cl)c(F)c1)c1cccc(F)c1	ZINC000819045857	FG	On-Demand	Anodyne	ADRB3	29	40
CC(=O)Nc1cccc(CC(=O)N2CCCCCCC2)c1	ZINC000819045859	CF	On-Demand	Anodyne	HTR1D	20	40
CC(=O)Nc1cccc(CC(=O)N2CCCCCCC2)c1	ZINC000819045859	CF	On-Demand	Anodyne	HTR1B	17	40
CC(=O)Nc1cccc(CC(=O)N2CCCCCCC2)c1	ZINC000819045859	CF	On-Demand	Anodyne	OPRK1	22	44
CC(=O)Nc1cccc(CC(=O)N2CCCCCCC2)c1	ZINC000819045859	CF	On-Demand	Anodyne	PREP	21	43
CC(=O)Nc1cccc(CC(=O)N2CCCCCCC2)c1	ZINC000819045859	CF	On-Demand	Anodyne	CCKBR	15	41
CC(=O)Nc1cccc(CC(=O)N2CCCCCCC2)c1	ZINC000819045859	CF	On-Demand	Anodyne	DPP7	53	36
CC(=O)Nc1cccc(CC(=O)N2CCCCCCC2)c1	ZINC000819045859	CF	On-Demand	Anodyne	TAAR1	26	40
CC(=O)Nc1cccc(CC(=O)N2CCCCCCC2)c1	ZINC000819045859	CF	On-Demand	Anodyne	P2RY14	45	34
O=C1C[C@@H](C(=O)NNC(=S)Nc2ccc3c(c2)OCO3)CN1	ZINC000819045860	DB	On-Demand	Reactive	DYRK2	45	34
O=C1C[C@H](C(=O)NNC(=S)Nc2ccc3c(c2)OCO3)CN1	ZINC000819045862	DB	On-Demand	Reactive	DYRK2	45	34
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819045863	EF	On-Demand	Bother	ADRB2	46	45
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819045863	EF	On-Demand	Bother	ADRB1	73	60
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819045863	EF	On-Demand	Bother	DRD4	15	43
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819045863	EF	On-Demand	Bother	ADRB3	78	60
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819045863	EF	On-Demand	Bother	ACR	17	44
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819045865	EF	On-Demand	Bother	ADRB2	46	45
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819045865	EF	On-Demand	Bother	ADRB1	73	60
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819045865	EF	On-Demand	Bother	DRD4	15	43
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819045865	EF	On-Demand	Bother	ADRB3	78	60
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819045865	EF	On-Demand	Bother	ACR	17	44
O=C(NCCCNC[C@H](O)c1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000819045885	FF	On-Demand	Anodyne	CES2	15	44
O=C(NCCCNC[C@@H](O)c1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000819045887	FF	On-Demand	Anodyne	CES2	15	44
O=C(Nc1ccc(N2CCCC2=O)c(Cl)c1)c1cc2c(cn1)OCCO2	ZINC000819045888	FF	On-Demand	Anodyne	NPY2R	45	36
O=C(Nc1ccc(N2CCCC2=O)c(Cl)c1)c1cc2c(cn1)OCCO2	ZINC000819045888	FF	On-Demand	Anodyne	GRM4	45	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000819045902	FF	On-Demand	Anodyne	SSTR2	48	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000819045902	FF	On-Demand	Anodyne	SSTR4	56	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000819045902	FF	On-Demand	Anodyne	SSTR5	41	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000819045902	FF	On-Demand	Anodyne	SSTR1	20	40
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccccc2Br)cc1	ZINC000819045935	GG	On-Demand	Bother	ADRB1	24	42
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccccc2Br)cc1	ZINC000819045935	GG	On-Demand	Bother	ADRB3	18	42
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cn2cnc3sccc3c2=O)cc1	ZINC000819045939	JC	On-Demand	Anodyne	CA2	49	45
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cn2cnc3sccc3c2=O)cc1	ZINC000819045939	JC	On-Demand	Anodyne	CA1	45	45
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cn2cnc3sccc3c2=O)cc1	ZINC000819045939	JC	On-Demand	Anodyne	CA7	32	45
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cn2cnc3sccc3c2=O)cc1	ZINC000819045939	JC	On-Demand	Anodyne	CA5B	32	45
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cn2cnc3sccc3c2=O)cc1	ZINC000819045939	JC	On-Demand	Anodyne	CA4	32	45
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cn2cnc3sccc3c2=O)cc1	ZINC000819045939	JC	On-Demand	Anodyne	CA5A	31	44
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cn2cnc3sccc3c2=O)cc1	ZINC000819045939	JC	On-Demand	Anodyne	CA12	33	45
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cn2cnc3sccc3c2=O)cc1	ZINC000819045939	JC	On-Demand	Anodyne	CA9	38	45
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cn2cnc3sccc3c2=O)cc1	ZINC000819045939	JC	On-Demand	Anodyne	A6YCJ1_9METZ	15	43
O[C@@H](CNCCCc1cccc(F)c1)c1cccc(Cl)c1	ZINC000819045981	DH	On-Demand	Anodyne	ADRB2	72	44
O[C@@H](CNCCCc1cccc(F)c1)c1cccc(Cl)c1	ZINC000819045981	DH	On-Demand	Anodyne	ADRB1	69	55
O[C@@H](CNCCCc1cccc(F)c1)c1cccc(Cl)c1	ZINC000819045981	DH	On-Demand	Anodyne	ADRB3	80	55
O[C@H](CNCCCc1cccc(F)c1)c1cccc(Cl)c1	ZINC000819045982	DH	On-Demand	Anodyne	ADRB2	72	44
O[C@H](CNCCCc1cccc(F)c1)c1cccc(Cl)c1	ZINC000819045982	DH	On-Demand	Anodyne	ADRB1	69	55
O[C@H](CNCCCc1cccc(F)c1)c1cccc(Cl)c1	ZINC000819045982	DH	On-Demand	Anodyne	ADRB3	80	55
Cc1ccccc1[C@@H](O)CNCCCc1cccc(F)c1	ZINC000819045985	CG	On-Demand	Anodyne	ADRB2	71	41
Cc1ccccc1[C@@H](O)CNCCCc1cccc(F)c1	ZINC000819045985	CG	On-Demand	Anodyne	ADRB1	49	41
Cc1ccccc1[C@@H](O)CNCCCc1cccc(F)c1	ZINC000819045985	CG	On-Demand	Anodyne	LEF	37	40
O=C(NCCCNC[C@H](O)c1cccc(Cl)c1)c1cccc(F)c1	ZINC000819045989	FF	On-Demand	Anodyne	ADRB2	41	37
O=C(NCCCNC[C@H](O)c1cccc(Cl)c1)c1cccc(F)c1	ZINC000819045989	FF	On-Demand	Anodyne	ADRB1	56	51
O=C(NCCCNC[C@H](O)c1cccc(Cl)c1)c1cccc(F)c1	ZINC000819045989	FF	On-Demand	Anodyne	ADRB3	66	51
O=C(NCCCNC[C@@H](O)c1cccc(Cl)c1)c1cccc(F)c1	ZINC000819045991	FF	On-Demand	Anodyne	ADRB2	41	37
O=C(NCCCNC[C@@H](O)c1cccc(Cl)c1)c1cccc(F)c1	ZINC000819045991	FF	On-Demand	Anodyne	ADRB1	56	51
O=C(NCCCNC[C@@H](O)c1cccc(Cl)c1)c1cccc(F)c1	ZINC000819045991	FF	On-Demand	Anodyne	ADRB3	66	51
C[C@H](CNC[C@@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045992	CE	On-Demand	Anodyne	ADRB2	29	47
C[C@H](CNC[C@@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045992	CE	On-Demand	Anodyne	ADRB1	29	45
C[C@H](CNC[C@@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045992	CE	On-Demand	Anodyne	ADRB3	99	48
C[C@H](CNC[C@@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045992	CE	On-Demand	Anodyne	KCNA5	25	40
C[C@H](CNC[C@@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045992	CE	On-Demand	Anodyne	CYP51A1	16	40
C[C@@H](CNC[C@@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045994	CE	On-Demand	Anodyne	ADRB2	29	47
C[C@@H](CNC[C@@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045994	CE	On-Demand	Anodyne	ADRB1	29	45
C[C@@H](CNC[C@@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045994	CE	On-Demand	Anodyne	ADRB3	99	48
C[C@@H](CNC[C@@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045994	CE	On-Demand	Anodyne	KCNA5	25	40
C[C@@H](CNC[C@@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045994	CE	On-Demand	Anodyne	CYP51A1	16	40
C[C@H](CNC[C@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045996	CE	On-Demand	Anodyne	ADRB2	29	47
C[C@H](CNC[C@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045996	CE	On-Demand	Anodyne	ADRB1	29	45
C[C@H](CNC[C@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045996	CE	On-Demand	Anodyne	ADRB3	99	48
C[C@H](CNC[C@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045996	CE	On-Demand	Anodyne	KCNA5	25	40
C[C@H](CNC[C@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045996	CE	On-Demand	Anodyne	CYP51A1	16	40
C[C@@H](CNC[C@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045998	CE	On-Demand	Anodyne	ADRB2	29	47
C[C@@H](CNC[C@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045998	CE	On-Demand	Anodyne	ADRB1	29	45
C[C@@H](CNC[C@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045998	CE	On-Demand	Anodyne	ADRB3	99	48
C[C@@H](CNC[C@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045998	CE	On-Demand	Anodyne	KCNA5	25	40
C[C@@H](CNC[C@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819045998	CE	On-Demand	Anodyne	CYP51A1	16	40
CCN(CC)S(=O)(=O)N1CCN(C(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819046014	GD	On-Demand	Anodyne	INHA	44	33
CCN(CC)S(=O)(=O)N1CCN(C(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819046014	GD	On-Demand	Anodyne	PARP1	15	40
CON(C)C(=O)CCNCCCNC(=O)c1cccc(F)c1	ZINC000819046015	DC	On-Demand	Anodyne	DRD4	44	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCc3[nH]c4ccccc4c3C1)C2	ZINC000819046017	FF	On-Demand	Anodyne	SSTR4	44	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCc3[nH]c4ccccc4c3C1)C2	ZINC000819046017	FF	On-Demand	Anodyne	SSTR1	17	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCc3[nH]c4ccccc4c3C1)C2	ZINC000819046019	FF	On-Demand	Anodyne	SSTR4	44	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCc3[nH]c4ccccc4c3C1)C2	ZINC000819046019	FF	On-Demand	Anodyne	SSTR1	17	43
O[C@@H](CNCCCc1cccc(F)c1)c1ccc(Cl)cc1	ZINC000819046023	DH	On-Demand	Anodyne	ADRB2	65	43
O[C@@H](CNCCCc1cccc(F)c1)c1ccc(Cl)cc1	ZINC000819046023	DH	On-Demand	Anodyne	ADRB1	57	46
O[C@@H](CNCCCc1cccc(F)c1)c1ccc(Cl)cc1	ZINC000819046023	DH	On-Demand	Anodyne	ADRB3	54	46
O=C(NCCCNC[C@H](O)c1ccc(Cl)c(F)c1)c1ccc(F)cc1	ZINC000819046037	FG	On-Demand	Anodyne	ALPL	47	39
O=C(NCCCNC[C@@H](O)c1ccc(Cl)c(F)c1)c1ccc(F)cc1	ZINC000819046039	FG	On-Demand	Anodyne	ALPL	47	39
N#Cc1ccc([C@H](O)CNCCCNC(=O)c2ccc(F)cc2)cc1	ZINC000819046045	EE	On-Demand	Mild	CTRB_BOVIN	44	30
N#Cc1ccc([C@@H](O)CNCCCNC(=O)c2ccc(F)cc2)cc1	ZINC000819046047	EE	On-Demand	Mild	CTRB_BOVIN	44	30
O=C(NCCCNC[C@H](O)c1ccc(Cl)cc1)c1cccc(F)c1	ZINC000819046065	FF	On-Demand	Anodyne	ADRB1	36	42
O=C(NCCCNC[C@H](O)c1ccc(Cl)cc1)c1cccc(F)c1	ZINC000819046065	FF	On-Demand	Anodyne	ADRB3	36	42
O=C(NCCCNC[C@H](O)c1ccc(Cl)cc1)c1cccc(F)c1	ZINC000819046065	FF	On-Demand	Anodyne	KCNK3	15	40
COc1ccc(OC)c([C@H](O)CNCCCNC(=O)c2cccc(F)c2)c1	ZINC000819046079	GE	On-Demand	Anodyne	ADRB2	17	40
COc1ccc(OC)c([C@H](O)CNCCCNC(=O)c2cccc(F)c2)c1	ZINC000819046079	GE	On-Demand	Anodyne	DRD2	15	44
COc1ccc(OC)c([C@H](O)CNCCCNC(=O)c2cccc(F)c2)c1	ZINC000819046079	GE	On-Demand	Anodyne	DRD4	48	36
COc1ccc(OC)c([C@H](O)CNCCCNC(=O)c2cccc(F)c2)c1	ZINC000819046079	GE	On-Demand	Anodyne	DRD3	32	44
COc1ccc(OC)c([C@H](O)CNCCCNC(=O)c2cccc(F)c2)c1	ZINC000819046079	GE	On-Demand	Anodyne	MTNR1A	32	43
O[C@@H](CNC[C@H]1CCc2ccccc21)c1cccnc1	ZINC000819046083	CE	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNC[C@H]1CCc2ccccc21)c1cccnc1	ZINC000819046083	CE	On-Demand	Anodyne	ADRB1	21	40
O[C@@H](CNC[C@H]1CCc2ccccc21)c1cccnc1	ZINC000819046083	CE	On-Demand	Anodyne	ADRB3	85	44
O[C@H](CNC[C@H]1CCc2ccccc21)c1cccnc1	ZINC000819046085	CE	On-Demand	Anodyne	ADRB2	19	40
O[C@H](CNC[C@H]1CCc2ccccc21)c1cccnc1	ZINC000819046085	CE	On-Demand	Anodyne	ADRB1	21	40
O[C@H](CNC[C@H]1CCc2ccccc21)c1cccnc1	ZINC000819046085	CE	On-Demand	Anodyne	ADRB3	85	44
O[C@H](CNC[C@@H]1CCc2ccccc21)c1cccnc1	ZINC000819046087	CE	On-Demand	Anodyne	ADRB2	19	40
O[C@H](CNC[C@@H]1CCc2ccccc21)c1cccnc1	ZINC000819046087	CE	On-Demand	Anodyne	ADRB1	21	40
O[C@H](CNC[C@@H]1CCc2ccccc21)c1cccnc1	ZINC000819046087	CE	On-Demand	Anodyne	ADRB3	85	44
O[C@@H](CNC[C@@H]1CCc2ccccc21)c1cccnc1	ZINC000819046088	CE	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNC[C@@H]1CCc2ccccc21)c1cccnc1	ZINC000819046088	CE	On-Demand	Anodyne	ADRB1	21	40
O[C@@H](CNC[C@@H]1CCc2ccccc21)c1cccnc1	ZINC000819046088	CE	On-Demand	Anodyne	ADRB3	85	44
O=C(NCCCNC[C@@H](O)c1cc2ccccc2o1)c1ccc(F)cc1	ZINC000819046089	FG	On-Demand	Anodyne	BCHE	20	40
Cc1ccccc1[C@@H](O)CNCCCNC(=O)c1cccc(F)c1	ZINC000819046095	EF	On-Demand	Anodyne	LEF	40	36
Cc1ccccc1[C@@H](O)CNCCCNC(=O)c1cccc(F)c1	ZINC000819046095	EF	On-Demand	Anodyne	CTSA	49	37
Cc1ccccc1[C@@H](O)CNCCCNC(=O)c1cccc(F)c1	ZINC000819046095	EF	On-Demand	Anodyne	KCNK3	45	42
Cc1ccccc1[C@@H](O)CNCCCNC(=O)c1cccc(F)c1	ZINC000819046095	EF	On-Demand	Anodyne	KCNK9	36	42
O=C(C(F)=C1CCC1)N1CCCN(Cc2ccccc2)CC1	ZINC000819046108	DG	On-Demand	Anodyne	DRD4	30	42
O=C(C(F)=C1CCC1)N1CCCN(Cc2ccccc2)CC1	ZINC000819046108	DG	On-Demand	Anodyne	FABP4	30	40
O=C(C(F)=C1CCC1)N1CCCN(Cc2ccccc2)CC1	ZINC000819046108	DG	On-Demand	Anodyne	SIGMAR1	60	46
O=C(C(F)=C1CCC1)N1CCCN(Cc2ccccc2)CC1	ZINC000819046108	DG	On-Demand	Anodyne	FAAH	22	45
O=C(Cc1nsc2ccccc12)N1CCCCCCC1	ZINC000819046116	CH	On-Demand	Anodyne	HTR1A	18	46
O=C(Cc1nsc2ccccc12)N1CCCCCCC1	ZINC000819046116	CH	On-Demand	Anodyne	DRD2	22	46
Cc1cc(F)ccc1[C@@H](O)CNCCCNC(=O)c1cccc(F)c1	ZINC000819046118	EF	On-Demand	Anodyne	LEF	44	36
Cc1cc(F)ccc1[C@@H](O)CNCCCNC(=O)c1cccc(F)c1	ZINC000819046118	EF	On-Demand	Anodyne	KCNK3	32	42
Cc1cc(F)ccc1[C@@H](O)CNCCCNC(=O)c1cccc(F)c1	ZINC000819046118	EF	On-Demand	Anodyne	KCNK9	31	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2CCc3ccccc32)CC1	ZINC000819046119	FG	On-Demand	Anodyne	GPR119	39	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H]2CCc3ccccc32)CC1	ZINC000819046120	FG	On-Demand	Anodyne	GPR119	39	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H]2CCc3ccccc32)CC1	ZINC000819046122	FG	On-Demand	Anodyne	GPR119	39	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2CCc3ccccc32)CC1	ZINC000819046125	FG	On-Demand	Anodyne	GPR119	39	46
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCN1c1ccccc1Cl	ZINC000819046127	EF	On-Demand	Anodyne	BIRC8	42	29
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCN1c1ccccc1Cl	ZINC000819046128	EF	On-Demand	Anodyne	BIRC8	42	29
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCN1c1ccccc1Cl	ZINC000819046129	EF	On-Demand	Anodyne	BIRC8	42	29
O=C1[C@H](NC[C@H](O)c2ccccc2)CCN1c1ccccc1Cl	ZINC000819046130	EF	On-Demand	Anodyne	BIRC8	42	29
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@H]1CNC(=O)C1	ZINC000819046150	DC	On-Demand	Reactive	MME	54	36
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@H]1CNC(=O)C1	ZINC000819046150	DC	On-Demand	Reactive	CAPNS1	43	34
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@H]1CNC(=O)C1	ZINC000819046150	DC	On-Demand	Reactive	CAPN1	40	36
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@@H]1CNC(=O)C1	ZINC000819046151	DC	On-Demand	Reactive	MME	54	36
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@@H]1CNC(=O)C1	ZINC000819046151	DC	On-Demand	Reactive	CAPNS1	43	34
C[C@@H](Cc1ccccc1)NC(=S)NNC(=O)[C@@H]1CNC(=O)C1	ZINC000819046151	DC	On-Demand	Reactive	CAPN1	40	36
O=C(NCC1(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819046170	CG	On-Demand	Anodyne	KCNA3	47	43
Cc1ccccc1[C@@H](O)CNC1CCN(CCS(C)(=O)=O)CC1	ZINC000819046190	ED	On-Demand	Anodyne	CCR8	50	32
COc1ccc(OC)c([C@H](O)CNCCOc2ccc([N+](=O)[O-])cc2)c1	ZINC000819046211	FE	On-Demand	Bother	ADRB2	21	42
COc1ccc(OC)c([C@H](O)CNCCOc2ccc([N+](=O)[O-])cc2)c1	ZINC000819046211	FE	On-Demand	Bother	ADRB1	30	43
COc1ccc(OC)c([C@H](O)CNCCOc2ccc([N+](=O)[O-])cc2)c1	ZINC000819046211	FE	On-Demand	Bother	ADRB3	21	43
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819046222	GG	On-Demand	Bother	ADRB1	23	42
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819046222	GG	On-Demand	Bother	ADRB3	24	42
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819046223	GG	On-Demand	Bother	ADRB1	23	42
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819046223	GG	On-Demand	Bother	ADRB3	24	42
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1	ZINC000819046224	EF	On-Demand	Anodyne	ADRB1	38	43
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1	ZINC000819046224	EF	On-Demand	Anodyne	ADRB3	59	46
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1	ZINC000819046224	EF	On-Demand	Anodyne	CYP3A4	51	39
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1	ZINC000819046225	EF	On-Demand	Anodyne	ADRB1	38	43
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1	ZINC000819046225	EF	On-Demand	Anodyne	ADRB3	59	46
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1	ZINC000819046225	EF	On-Demand	Anodyne	CYP3A4	51	39
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1	ZINC000819046226	EF	On-Demand	Anodyne	ADRB1	38	43
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1	ZINC000819046226	EF	On-Demand	Anodyne	ADRB3	59	46
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1	ZINC000819046226	EF	On-Demand	Anodyne	CYP3A4	51	39
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1	ZINC000819046227	EF	On-Demand	Anodyne	ADRB1	38	43
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1	ZINC000819046227	EF	On-Demand	Anodyne	ADRB3	59	46
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1	ZINC000819046227	EF	On-Demand	Anodyne	CYP3A4	51	39
O=C(/C=C\[C@H]1CCCO1)N1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000819046244	FD	On-Demand	Anodyne	CCR8	66	33
O=C(/C=C\[C@H]1CCCO1)N1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000819046244	FD	On-Demand	Anodyne	SFRP1	64	34
O=C(/C=C\[C@H]1CCCO1)N1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000819046244	FD	On-Demand	Anodyne	WNT3	40	32
O=C(/C=C/[C@@H]1CCCO1)N1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000819046245	FD	On-Demand	Anodyne	CCR8	66	33
O=C(/C=C/[C@@H]1CCCO1)N1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000819046245	FD	On-Demand	Anodyne	SFRP1	64	34
O=C(/C=C/[C@@H]1CCCO1)N1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000819046245	FD	On-Demand	Anodyne	WNT3	40	32
O=C(/C=C\[C@@H]1CCCO1)N1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000819046246	FD	On-Demand	Anodyne	CCR8	66	33
O=C(/C=C\[C@@H]1CCCO1)N1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000819046246	FD	On-Demand	Anodyne	SFRP1	64	34
O=C(/C=C\[C@@H]1CCCO1)N1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000819046246	FD	On-Demand	Anodyne	WNT3	40	32
O=C(/C=C/[C@H]1CCCO1)N1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000819046247	FD	On-Demand	Anodyne	CCR8	66	33
O=C(/C=C/[C@H]1CCCO1)N1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000819046247	FD	On-Demand	Anodyne	SFRP1	64	34
O=C(/C=C/[C@H]1CCCO1)N1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000819046247	FD	On-Demand	Anodyne	WNT3	40	32
O=C(NCCCNC[C@H](O)c1ccccc1F)c1ccc(F)cc1	ZINC000819046270	EE	On-Demand	Anodyne	DRD3	22	43
O=C(NCCCNC[C@H](O)c1ccccc1F)c1ccc(F)cc1	ZINC000819046270	EE	On-Demand	Anodyne	FOLH1	26	44
O=C(NCCCNC[C@H](O)c1ccccc1F)c1ccc(F)cc1	ZINC000819046270	EE	On-Demand	Anodyne	BCHE	21	41
O=C(NCCCNC[C@@H](O)c1ccccc1F)c1ccc(F)cc1	ZINC000819046271	EE	On-Demand	Anodyne	DRD3	22	43
O=C(NCCCNC[C@@H](O)c1ccccc1F)c1ccc(F)cc1	ZINC000819046271	EE	On-Demand	Anodyne	FOLH1	26	44
O=C(NCCCNC[C@@H](O)c1ccccc1F)c1ccc(F)cc1	ZINC000819046271	EE	On-Demand	Anodyne	BCHE	21	41
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)N3CCCCCCC3)nn2)C1	ZINC000819046278	GG	On-Demand	Anodyne	PREP	19	40
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)N3CCCCCCC3)nn2)C1	ZINC000819046279	GG	On-Demand	Anodyne	PREP	19	40
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)N(C)Cc1ccccc1	ZINC000819046294	EF	On-Demand	Bother	ADRB3	48	36
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)N(C)Cc1ccccc1	ZINC000819046295	EF	On-Demand	Bother	ADRB3	48	36
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)N(C)Cc1ccccc1	ZINC000819046296	EF	On-Demand	Bother	ADRB3	48	36
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)N(C)Cc1ccccc1	ZINC000819046297	EF	On-Demand	Bother	ADRB3	48	36
O=C(NCCCNC[C@H](O)C1CC1)c1ccc(F)cc1	ZINC000819046306	CD	On-Demand	Anodyne	FOLH1	20	42
O=C(NCCCNC[C@H](O)C1CC1)c1ccc(F)cc1	ZINC000819046306	CD	On-Demand	Anodyne	BCHE	20	40
O=C(NCCCNC[C@@H](O)C1CC1)c1ccc(F)cc1	ZINC000819046307	CD	On-Demand	Anodyne	FOLH1	20	42
O=C(NCCCNC[C@@H](O)C1CC1)c1ccc(F)cc1	ZINC000819046307	CD	On-Demand	Anodyne	BCHE	20	40
O=C(NCCCNC[C@H](O)c1c(F)cccc1F)c1ccc(F)cc1	ZINC000819046308	FF	On-Demand	Anodyne	FOLH1	22	42
O=C(NCCCNC[C@H](O)c1c(F)cccc1F)c1ccc(F)cc1	ZINC000819046308	FF	On-Demand	Anodyne	BCHE	20	40
O=C(NCCCNC[C@@H](O)c1c(F)cccc1F)c1ccc(F)cc1	ZINC000819046309	FF	On-Demand	Anodyne	FOLH1	22	42
O=C(NCCCNC[C@@H](O)c1c(F)cccc1F)c1ccc(F)cc1	ZINC000819046309	FF	On-Demand	Anodyne	BCHE	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3nc4ccccc4[nH]3)CC1)C2	ZINC000819046312	GG	On-Demand	Anodyne	SMO	24	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3nc4ccccc4[nH]3)CC1)C2	ZINC000819046313	GG	On-Demand	Anodyne	SMO	24	41
Cn1nnnc1-c1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819046318	CD	On-Demand	Anodyne	CCR3	85	44
Cn1nnnc1-c1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819046319	CD	On-Demand	Anodyne	CCR3	85	44
Cn1nnnc1-c1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819046320	CD	On-Demand	Anodyne	CCR3	85	44
Cn1nnnc1-c1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819046321	CD	On-Demand	Anodyne	CCR3	85	44
O=C(NCCCNC[C@H](O)c1ccccc1Cl)c1cccc(F)c1	ZINC000819046359	FF	On-Demand	Anodyne	DRD3	27	40
O=C(NCCCNC[C@H](O)c1ccccc1Cl)c1cccc(F)c1	ZINC000819046359	FF	On-Demand	Anodyne	ECR	18	45
O=C(NCCCNC[C@H](O)c1ccccc1Cl)c1cccc(F)c1	ZINC000819046359	FF	On-Demand	Anodyne	KCNK3	22	42
Cc1ccc(OC[C@@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)cc1	ZINC000819046442	FC	On-Demand	Anodyne	ADRB2	43	48
Cc1ccc(OC[C@@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)cc1	ZINC000819046442	FC	On-Demand	Anodyne	ADRB1	53	48
Cc1ccc(OC[C@@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)cc1	ZINC000819046442	FC	On-Demand	Anodyne	ADRB3	43	53
Cc1ccc(OC[C@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)cc1	ZINC000819046443	FC	On-Demand	Anodyne	ADRB2	43	48
Cc1ccc(OC[C@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)cc1	ZINC000819046443	FC	On-Demand	Anodyne	ADRB1	53	48
Cc1ccc(OC[C@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)cc1	ZINC000819046443	FC	On-Demand	Anodyne	ADRB3	43	53
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819046447	EF	On-Demand	Bother	ADRB1	36	45
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819046447	EF	On-Demand	Bother	ADRB3	35	45
O=C(/C=C/[C@@H]1CCCO1)NCC1(c2ccccc2)CCCC1	ZINC000819046471	CG	On-Demand	Anodyne	KCNA3	48	41
O=C(/C=C\[C@@H]1CCCO1)NCC1(c2ccccc2)CCCC1	ZINC000819046475	CG	On-Demand	Anodyne	KCNA3	48	41
O=C(/C=C\[C@H]1CCCO1)NCC1(c2ccccc2)CCCC1	ZINC000819046477	CG	On-Demand	Anodyne	KCNA3	48	41
O=C(/C=C/[C@H]1CCCO1)NCC1(c2ccccc2)CCCC1	ZINC000819046479	CG	On-Demand	Anodyne	KCNA3	48	41
O[C@H](CNC[C@H]1CCc2ccccc21)c1cccc(Cl)c1	ZINC000819046482	DH	On-Demand	Anodyne	ADRB1	33	43
O[C@H](CNC[C@H]1CCc2ccccc21)c1cccc(Cl)c1	ZINC000819046482	DH	On-Demand	Anodyne	ADRB3	49	44
O[C@H](CNC[C@@H]1CCc2ccccc21)c1cccc(Cl)c1	ZINC000819046484	DH	On-Demand	Anodyne	ADRB1	33	43
O[C@H](CNC[C@@H]1CCc2ccccc21)c1cccc(Cl)c1	ZINC000819046484	DH	On-Demand	Anodyne	ADRB3	49	44
O[C@@H](CNC[C@H]1CCc2ccccc21)c1cccc(Cl)c1	ZINC000819046486	DH	On-Demand	Anodyne	ADRB1	33	43
O[C@@H](CNC[C@H]1CCc2ccccc21)c1cccc(Cl)c1	ZINC000819046486	DH	On-Demand	Anodyne	ADRB3	49	44
O[C@@H](CNC[C@@H]1CCc2ccccc21)c1cccc(Cl)c1	ZINC000819046488	DH	On-Demand	Anodyne	ADRB1	33	43
O[C@@H](CNC[C@@H]1CCc2ccccc21)c1cccc(Cl)c1	ZINC000819046488	DH	On-Demand	Anodyne	ADRB3	49	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3c[nH]c4ccccc34)CC1)C2	ZINC000819046501	GH	On-Demand	Anodyne	HTR1D	19	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3c[nH]c4ccccc34)CC1)C2	ZINC000819046501	GH	On-Demand	Anodyne	HTR1B	17	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3c[nH]c4ccccc34)CC1)C2	ZINC000819046501	GH	On-Demand	Anodyne	HTR1F	58	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3c[nH]c4ccccc34)CC1)C2	ZINC000819046501	GH	On-Demand	Anodyne	CCR2	25	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3c[nH]c4ccccc34)CC1)C2	ZINC000819046504	GH	On-Demand	Anodyne	HTR1D	19	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3c[nH]c4ccccc34)CC1)C2	ZINC000819046504	GH	On-Demand	Anodyne	HTR1B	17	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3c[nH]c4ccccc34)CC1)C2	ZINC000819046504	GH	On-Demand	Anodyne	HTR1F	58	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3c[nH]c4ccccc34)CC1)C2	ZINC000819046504	GH	On-Demand	Anodyne	CCR2	25	42
O=C(NCCCNC[C@H](O)c1ccc(F)cc1Cl)c1ccc(F)cc1	ZINC000819046506	FG	On-Demand	Anodyne	FOLH1	23	42
O=C(NCCCNC[C@H](O)c1ccc(F)cc1Cl)c1ccc(F)cc1	ZINC000819046506	FG	On-Demand	Anodyne	ALPL	40	35
O=C(NCCCNC[C@@H](O)c1ccc(F)cc1Cl)c1ccc(F)cc1	ZINC000819046508	FG	On-Demand	Anodyne	FOLH1	23	42
O=C(NCCCNC[C@@H](O)c1ccc(F)cc1Cl)c1ccc(F)cc1	ZINC000819046508	FG	On-Demand	Anodyne	ALPL	40	35
COc1ccc(OC)c([C@H](O)CNC2CCN(CC(=O)N(C)C)CC2)c1	ZINC000819046529	FC	On-Demand	Anodyne	MCHR1	17	41
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2)CCN1c1ccccc1	ZINC000819046535	DE	On-Demand	Anodyne	SLC6A3	25	46
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2)CCN1c1ccccc1	ZINC000819046537	DE	On-Demand	Anodyne	SLC6A3	25	46
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2)CCN1c1ccccc1	ZINC000819046539	DE	On-Demand	Anodyne	SLC6A3	25	46
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2)CCN1c1ccccc1	ZINC000819046541	DE	On-Demand	Anodyne	SLC6A3	25	46
CON(C)C(=O)CCNC[C@@H]1CCCCN1Cc1cccc(Cl)c1	ZINC000819046543	FF	On-Demand	Anodyne	DRD2	30	40
CON(C)C(=O)CCNC[C@H]1CCCCN1Cc1cccc(Cl)c1	ZINC000819046544	FF	On-Demand	Anodyne	DRD2	30	40
O=C(C(F)=C1CCC1)N1CCC[C@H]1c1ccccc1	ZINC000819046557	CH	On-Demand	Anodyne	PREP	48	35
O=C(C(F)=C1CCC1)N1CCC[C@@H]1c1ccccc1	ZINC000819046559	CH	On-Demand	Anodyne	PREP	48	35
O=C(NCCCNC[C@H](O)c1cc(F)ccc1F)c1ccc(F)cc1	ZINC000819046564	FF	On-Demand	Anodyne	FOLH1	25	43
O=C(NCCCNC[C@H](O)c1cc(F)ccc1F)c1ccc(F)cc1	ZINC000819046564	FF	On-Demand	Anodyne	LEF	45	36
O=C(NCCCNC[C@@H](O)c1cc(F)ccc1F)c1ccc(F)cc1	ZINC000819046566	FF	On-Demand	Anodyne	FOLH1	25	43
O=C(NCCCNC[C@@H](O)c1cc(F)ccc1F)c1ccc(F)cc1	ZINC000819046566	FF	On-Demand	Anodyne	LEF	45	36
COc1ccc(-c2noc(CN3CCN(C(=O)/C=C/[C@@H]4CCCO4)CC3)n2)cc1	ZINC000819046568	GE	On-Demand	Anodyne	HRH3	19	40
COc1ccc(-c2noc(CN3CCN(C(=O)/C=C/[C@@H]4CCCO4)CC3)n2)cc1	ZINC000819046568	GE	On-Demand	Anodyne	PDK1	41	34
COc1ccc(-c2noc(CN3CCN(C(=O)/C=C\[C@H]4CCCO4)CC3)n2)cc1	ZINC000819046570	GE	On-Demand	Anodyne	HRH3	19	40
COc1ccc(-c2noc(CN3CCN(C(=O)/C=C\[C@H]4CCCO4)CC3)n2)cc1	ZINC000819046570	GE	On-Demand	Anodyne	PDK1	41	34
COc1ccc(-c2noc(CN3CCN(C(=O)/C=C/[C@H]4CCCO4)CC3)n2)cc1	ZINC000819046571	GE	On-Demand	Anodyne	HRH3	19	40
COc1ccc(-c2noc(CN3CCN(C(=O)/C=C/[C@H]4CCCO4)CC3)n2)cc1	ZINC000819046571	GE	On-Demand	Anodyne	PDK1	41	34
COc1ccc(-c2noc(CN3CCN(C(=O)/C=C\[C@@H]4CCCO4)CC3)n2)cc1	ZINC000819046573	GE	On-Demand	Anodyne	HRH3	19	40
COc1ccc(-c2noc(CN3CCN(C(=O)/C=C\[C@@H]4CCCO4)CC3)n2)cc1	ZINC000819046573	GE	On-Demand	Anodyne	PDK1	41	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccccc1OC(F)F)C2	ZINC000819046586	FF	On-Demand	Anodyne	P2RX7	41	43
O=C(NC1CCN(C(=O)C(F)=C2CCC2)CC1)c1ccccc1	ZINC000819046587	DF	On-Demand	Anodyne	DRD4	18	44
O=C(NC1CCN(C(=O)C(F)=C2CCC2)CC1)c1ccccc1	ZINC000819046587	DF	On-Demand	Anodyne	SIGMAR1	16	44
O=C(NC1CCN(C(=O)C(F)=C2CCC2)CC1)c1ccccc1	ZINC000819046587	DF	On-Demand	Anodyne	EPHX2	31	40
O=C(NC1CCN(C(=O)C(F)=C2CCC2)CC1)c1ccccc1	ZINC000819046587	DF	On-Demand	Anodyne	SFRP1	60	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccccc1OC(F)F)C2	ZINC000819046588	FF	On-Demand	Anodyne	P2RX7	41	43
O=C(NCCCNC[C@H](O)c1ccccc1C(F)(F)F)c1ccc(F)cc1	ZINC000819046590	GG	On-Demand	Anodyne	FOLH1	19	40
O=C(NCCCNC[C@@H](O)c1ccccc1C(F)(F)F)c1ccc(F)cc1	ZINC000819046592	GG	On-Demand	Anodyne	FOLH1	19	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(c2nccs2)CC1	ZINC000819046618	FD	On-Demand	Anodyne	NPBWR1	65	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(-c3nnnn3C)c1)C2	ZINC000819046625	FD	On-Demand	Anodyne	CCR3	74	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(-c3nnnn3C)c1)C2	ZINC000819046626	FD	On-Demand	Anodyne	CCR3	74	41
O=C1[C@@H](NC[C@@H](O)c2cccc(F)c2)CCN1c1ccccc1Cl	ZINC000819046631	EF	On-Demand	Anodyne	P2RX7	26	42
O=C1[C@H](NC[C@@H](O)c2cccc(F)c2)CCN1c1ccccc1Cl	ZINC000819046632	EF	On-Demand	Anodyne	P2RX7	26	42
O=C1[C@@H](NC[C@H](O)c2cccc(F)c2)CCN1c1ccccc1Cl	ZINC000819046633	EF	On-Demand	Anodyne	P2RX7	26	42
O=C1[C@H](NC[C@H](O)c2cccc(F)c2)CCN1c1ccccc1Cl	ZINC000819046634	EF	On-Demand	Anodyne	P2RX7	26	42
O=C1C[C@@H](C(=O)NNC(=S)Nc2ccc(OC(F)(F)F)cc2)CN1	ZINC000819046664	FD	On-Demand	Reactive	P2RY1	41	37
O=C1C[C@@H](C(=O)NNC(=S)Nc2ccc(OC(F)(F)F)cc2)CN1	ZINC000819046664	FD	On-Demand	Reactive	EPHX2	55	43
O=C1C[C@H](C(=O)NNC(=S)Nc2ccc(OC(F)(F)F)cc2)CN1	ZINC000819046665	FD	On-Demand	Reactive	P2RY1	41	37
O=C1C[C@H](C(=O)NNC(=S)Nc2ccc(OC(F)(F)F)cc2)CN1	ZINC000819046665	FD	On-Demand	Reactive	EPHX2	55	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(Cn3cncn3)cc1)C2	ZINC000819046674	GD	On-Demand	Anodyne	HIS3	43	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(Cn3cncn3)cc1)C2	ZINC000819046675	GD	On-Demand	Anodyne	HIS3	43	31
C[C@H](C#N)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819046730	BD	On-Demand	Mild	CACNA1D	54	34
C[C@H](C#N)CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819046733	BD	On-Demand	Mild	CACNA1D	54	34
CCOc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)cc1	ZINC000819046750	FF	On-Demand	Anodyne	ACACA	16	40
CCOc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)cc1	ZINC000819046750	FF	On-Demand	Anodyne	ACACB	18	43
CCOc1ccc([C@@H](C)NC(=O)[C@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)cc1	ZINC000819046752	FF	On-Demand	Anodyne	ACACA	16	40
CCOc1ccc([C@@H](C)NC(=O)[C@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)cc1	ZINC000819046752	FF	On-Demand	Anodyne	ACACB	18	43
O=C(/C=C\[C@@H]1CCCO1)N1CCC(CCc2ccccc2)CC1	ZINC000819046758	DH	On-Demand	Anodyne	ACHE	26	40
O=C(/C=C\[C@@H]1CCCO1)N1CCC(CCc2ccccc2)CC1	ZINC000819046758	DH	On-Demand	Anodyne	SLC18A2	43	36
O=C(/C=C\[C@@H]1CCCO1)N1CCC(CCc2ccccc2)CC1	ZINC000819046758	DH	On-Demand	Anodyne	GRIN2B	34	46
O=C(/C=C/[C@H]1CCCO1)N1CCC(CCc2ccccc2)CC1	ZINC000819046759	DH	On-Demand	Anodyne	ACHE	26	40
O=C(/C=C/[C@H]1CCCO1)N1CCC(CCc2ccccc2)CC1	ZINC000819046759	DH	On-Demand	Anodyne	SLC18A2	43	36
O=C(/C=C/[C@H]1CCCO1)N1CCC(CCc2ccccc2)CC1	ZINC000819046759	DH	On-Demand	Anodyne	GRIN2B	34	46
O=C(/C=C\[C@H]1CCCO1)N1CCC(CCc2ccccc2)CC1	ZINC000819046760	DH	On-Demand	Anodyne	ACHE	26	40
O=C(/C=C\[C@H]1CCCO1)N1CCC(CCc2ccccc2)CC1	ZINC000819046760	DH	On-Demand	Anodyne	SLC18A2	43	36
O=C(/C=C\[C@H]1CCCO1)N1CCC(CCc2ccccc2)CC1	ZINC000819046760	DH	On-Demand	Anodyne	GRIN2B	34	46
O=C(/C=C/[C@@H]1CCCO1)N1CCC(CCc2ccccc2)CC1	ZINC000819046761	DH	On-Demand	Anodyne	ACHE	26	40
O=C(/C=C/[C@@H]1CCCO1)N1CCC(CCc2ccccc2)CC1	ZINC000819046761	DH	On-Demand	Anodyne	SLC18A2	43	36
O=C(/C=C/[C@@H]1CCCO1)N1CCC(CCc2ccccc2)CC1	ZINC000819046761	DH	On-Demand	Anodyne	GRIN2B	34	46
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819046774	FG	On-Demand	Bother	ADRB1	28	43
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819046774	FG	On-Demand	Bother	ADRB3	29	43
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819046775	FG	On-Demand	Bother	ADRB1	28	43
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819046775	FG	On-Demand	Bother	ADRB3	29	43
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCOc2ccccc2Cl)CC1	ZINC000819046802	FF	On-Demand	Anodyne	SLC6A1	44	36
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCOc2ccccc2Cl)CC1	ZINC000819046803	FF	On-Demand	Anodyne	SLC6A1	44	36
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCOc2ccccc2Cl)CC1	ZINC000819046804	FF	On-Demand	Anodyne	SLC6A1	44	36
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCOc2ccccc2Cl)CC1	ZINC000819046805	FF	On-Demand	Anodyne	SLC6A1	44	36
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccccc2F)cc1	ZINC000819046806	DE	On-Demand	Bother	ADRB1	29	42
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccccc2F)cc1	ZINC000819046806	DE	On-Demand	Bother	ADRB3	19	42
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819046807	DE	On-Demand	Bother	ADRB1	29	42
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819046807	DE	On-Demand	Bother	ADRB3	19	42
O=C1[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1c1ccccc1	ZINC000819046808	EF	On-Demand	Anodyne	ADRB3	22	42
O=C1[C@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1c1ccccc1	ZINC000819046809	EF	On-Demand	Anodyne	ADRB3	22	42
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)CCN1c1ccccc1	ZINC000819046812	EF	On-Demand	Anodyne	P2RX7	34	46
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)CCN1c1ccccc1	ZINC000819046813	EF	On-Demand	Anodyne	P2RX7	34	46
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)CCN1c1ccccc1	ZINC000819046814	EF	On-Demand	Anodyne	P2RX7	34	46
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2Cl)CCN1c1ccccc1	ZINC000819046815	EF	On-Demand	Anodyne	P2RX7	34	46
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819046823	EF	On-Demand	Bother	ADRB2	17	42
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819046823	EF	On-Demand	Bother	ADRB1	32	42
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819046823	EF	On-Demand	Bother	ADRB3	24	42
NS(=O)(=O)c1ccc(NC(=O)COC(=O)Cn2cnc3sccc3c2=O)cc1	ZINC000819046824	HC	On-Demand	Anodyne	CA2	41	41
NS(=O)(=O)c1ccc(NC(=O)COC(=O)Cn2cnc3sccc3c2=O)cc1	ZINC000819046824	HC	On-Demand	Anodyne	CA1	43	41
NS(=O)(=O)c1ccc(NC(=O)COC(=O)Cn2cnc3sccc3c2=O)cc1	ZINC000819046824	HC	On-Demand	Anodyne	CA7	18	41
NS(=O)(=O)c1ccc(NC(=O)COC(=O)Cn2cnc3sccc3c2=O)cc1	ZINC000819046824	HC	On-Demand	Anodyne	CA5B	42	41
NS(=O)(=O)c1ccc(NC(=O)COC(=O)Cn2cnc3sccc3c2=O)cc1	ZINC000819046824	HC	On-Demand	Anodyne	CA4	36	40
NS(=O)(=O)c1ccc(NC(=O)COC(=O)Cn2cnc3sccc3c2=O)cc1	ZINC000819046824	HC	On-Demand	Anodyne	CA5A	43	41
NS(=O)(=O)c1ccc(NC(=O)COC(=O)Cn2cnc3sccc3c2=O)cc1	ZINC000819046824	HC	On-Demand	Anodyne	P96878_MYCTU	49	35
CCOc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819046826	FG	On-Demand	Anodyne	ACACA	19	42
CCOc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819046826	FG	On-Demand	Anodyne	ACACB	21	43
CCOc1ccc([C@@H](C)NC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819046830	FG	On-Demand	Anodyne	ACACA	19	42
CCOc1ccc([C@@H](C)NC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819046830	FG	On-Demand	Anodyne	ACACB	21	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCc1nc3ccccc3[nH]1)C2	ZINC000819046851	FE	On-Demand	Anodyne	OPRD1	18	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCc1nc3ccccc3[nH]1)C2	ZINC000819046852	FE	On-Demand	Anodyne	OPRD1	18	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000819046880	GG	On-Demand	Anodyne	NPY2R	47	38
O=C(NCCCNC[C@H](O)c1ccc(Cl)cc1Cl)c1ccc(F)cc1	ZINC000819046883	GH	On-Demand	Anodyne	FOLH1	19	40
O=C(NCCCNC[C@H](O)c1ccc(Cl)cc1Cl)c1ccc(F)cc1	ZINC000819046883	GH	On-Demand	Anodyne	ALPL	57	42
O=C(NCCCNC[C@@H](O)c1ccc(Cl)cc1Cl)c1ccc(F)cc1	ZINC000819046886	GH	On-Demand	Anodyne	FOLH1	19	40
O=C(NCCCNC[C@@H](O)c1ccc(Cl)cc1Cl)c1ccc(F)cc1	ZINC000819046886	GH	On-Demand	Anodyne	ALPL	57	42
O=C(NCCCNC[C@H](O)c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819046891	EE	On-Demand	Anodyne	FOLH1	27	47
O=C(NCCCNC[C@@H](O)c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819046893	EE	On-Demand	Anodyne	FOLH1	27	47
O=C(NCCCNC[C@H](O)c1cccc(C(F)(F)F)c1)c1ccc(F)cc1	ZINC000819046895	GG	On-Demand	Anodyne	ADRB1	27	40
O=C(NCCCNC[C@H](O)c1cccc(C(F)(F)F)c1)c1ccc(F)cc1	ZINC000819046895	GG	On-Demand	Anodyne	ADRB3	33	40
O=C(NCCCNC[C@H](O)c1cccc(C(F)(F)F)c1)c1ccc(F)cc1	ZINC000819046895	GG	On-Demand	Anodyne	CCR2	50	39
O=C(NCCCNC[C@@H](O)c1cccc(C(F)(F)F)c1)c1ccc(F)cc1	ZINC000819046897	GG	On-Demand	Anodyne	ADRB1	27	40
O=C(NCCCNC[C@@H](O)c1cccc(C(F)(F)F)c1)c1ccc(F)cc1	ZINC000819046897	GG	On-Demand	Anodyne	ADRB3	33	40
O=C(NCCCNC[C@@H](O)c1cccc(C(F)(F)F)c1)c1ccc(F)cc1	ZINC000819046897	GG	On-Demand	Anodyne	CCR2	50	39
O=C(NCCCNC[C@H](O)c1cccc(F)c1)c1cccc(F)c1	ZINC000819046967	EE	On-Demand	Anodyne	ADRB1	40	44
O=C(NCCCNC[C@H](O)c1cccc(F)c1)c1cccc(F)c1	ZINC000819046967	EE	On-Demand	Anodyne	ADRB3	46	44
O=C(NCCCNC[C@@H](O)c1cccc(F)c1)c1cccc(F)c1	ZINC000819046969	EE	On-Demand	Anodyne	ADRB1	40	44
O=C(NCCCNC[C@@H](O)c1cccc(F)c1)c1cccc(F)c1	ZINC000819046969	EE	On-Demand	Anodyne	ADRB3	46	44
O=C(NCCCNC[C@H](O)c1ccccc1Br)c1ccc(F)cc1	ZINC000819046971	GG	On-Demand	Anodyne	FOLH1	25	42
O=C(NCCCNC[C@@H](O)c1ccccc1Br)c1ccc(F)cc1	ZINC000819046973	GG	On-Demand	Anodyne	FOLH1	25	42
Cn1nnnc1-c1cccc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819046975	FD	On-Demand	Anodyne	CCR3	79	42
O=C1C[C@H](C(=O)NNC(=S)NCCc2cccnc2)CN1	ZINC000819046979	DB	On-Demand	Reactive	NAMPT	37	43
O=C1C[C@@H](C(=O)NNC(=S)NCCc2cccnc2)CN1	ZINC000819046980	DB	On-Demand	Reactive	NAMPT	37	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1(c3ccccc3)CCC1)C2	ZINC000819046981	FG	On-Demand	Anodyne	KCNA3	50	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1(c3ccccc3)CCC1)C2	ZINC000819046983	FG	On-Demand	Anodyne	KCNA3	50	41
O=C(NCCCNC[C@H](O)c1ccc(C(F)(F)F)cc1)c1ccc(F)cc1	ZINC000819046986	GG	On-Demand	Anodyne	FOLH1	15	42
O=C(NCCCNC[C@H](O)c1ccc(C(F)(F)F)cc1)c1ccc(F)cc1	ZINC000819046986	GG	On-Demand	Anodyne	GIPR	41	38
O=C(NCCCNC[C@@H](O)c1ccc(C(F)(F)F)cc1)c1ccc(F)cc1	ZINC000819046987	GG	On-Demand	Anodyne	FOLH1	15	42
O=C(NCCCNC[C@@H](O)c1ccc(C(F)(F)F)cc1)c1ccc(F)cc1	ZINC000819046987	GG	On-Demand	Anodyne	GIPR	41	38
O=C(c1ccccc1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819046988	DH	On-Demand	Anodyne	SLC18A3	54	48
O=C(c1ccccc1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819046988	DH	On-Demand	Anodyne	L3MBTL3	58	36
O=C(NCCCNC[C@H](O)c1ccccc1Cl)c1ccc(F)cc1	ZINC000819047012	FF	On-Demand	Anodyne	DRD3	28	48
O=C(NCCCNC[C@H](O)c1ccccc1Cl)c1ccc(F)cc1	ZINC000819047012	FF	On-Demand	Anodyne	FOLH1	27	42
C[C@H](CNCCC(=O)Nc1ccc(N(C)C)cc1)N(C)Cc1ccccc1	ZINC000819047017	FG	On-Demand	Anodyne	LTA4H	39	40
C[C@@H](CNCCC(=O)Nc1ccc(N(C)C)cc1)N(C)Cc1ccccc1	ZINC000819047018	FG	On-Demand	Anodyne	LTA4H	39	40
O=C(CN1CCCC[C@@H](O)C1=O)NNC(=S)Nc1cccc(Cl)c1	ZINC000819047021	FD	On-Demand	Reactive	F10	17	51
O=C(CN1CCCC[C@H](O)C1=O)NNC(=S)Nc1cccc(Cl)c1	ZINC000819047022	FD	On-Demand	Reactive	F10	17	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(c2nc3ccccc3[nH]2)CC1	ZINC000819047027	GG	On-Demand	Anodyne	PRCP	15	40
O=C(NCCCNC[C@@H](O)c1cc2ccccc2o1)c1cccc(F)c1	ZINC000819047034	FG	On-Demand	Anodyne	KCNJ11	28	41
COc1ccc(-n2cnnc2SCC(=O)Nc2ccnn2Cc2ccc(OC)cc2OC)cc1	ZINC000819047043	JG	On-Demand	Anodyne	ENPP1	67	33
C[C@H](C#N)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819047104	BE	On-Demand	Mild	ADRB2	21	47
C[C@H](C#N)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819047104	BE	On-Demand	Mild	ADRB1	39	45
C[C@H](C#N)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819047104	BE	On-Demand	Mild	ADRB3	55	46
C[C@H](C#N)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819047107	BE	On-Demand	Mild	ADRB2	21	47
C[C@H](C#N)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819047107	BE	On-Demand	Mild	ADRB1	39	45
C[C@H](C#N)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819047107	BE	On-Demand	Mild	ADRB3	55	46
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(Cl)cc1	ZINC000819047109	GI	On-Demand	Mild	PAPA1_CARPA	44	47
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(Cl)cc1	ZINC000819047109	GI	On-Demand	Mild	CTSK	19	43
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(Cl)cc1	ZINC000819047109	GI	On-Demand	Mild	FPR1	43	43
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(Cl)cc1	ZINC000819047110	GI	On-Demand	Mild	PAPA1_CARPA	44	47
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(Cl)cc1	ZINC000819047110	GI	On-Demand	Mild	CTSK	19	43
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(Cl)cc1	ZINC000819047110	GI	On-Demand	Mild	FPR1	43	43
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(Cl)cc1	ZINC000819047111	GI	On-Demand	Mild	PAPA1_CARPA	44	47
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(Cl)cc1	ZINC000819047111	GI	On-Demand	Mild	CTSK	19	43
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(Cl)cc1	ZINC000819047111	GI	On-Demand	Mild	FPR1	43	43
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(Cl)cc1	ZINC000819047112	GI	On-Demand	Mild	PAPA1_CARPA	44	47
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(Cl)cc1	ZINC000819047112	GI	On-Demand	Mild	CTSK	19	43
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(Cl)cc1	ZINC000819047112	GI	On-Demand	Mild	FPR1	43	43
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819047161	GG	On-Demand	Bother	ADRB1	24	41
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819047161	GG	On-Demand	Bother	ADRB3	24	41
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819047162	GG	On-Demand	Bother	ADRB1	24	41
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819047162	GG	On-Demand	Bother	ADRB3	24	41
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c1	ZINC000819047165	GC	On-Demand	Anodyne	ADRB2	30	45
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c1	ZINC000819047165	GC	On-Demand	Anodyne	ADRB1	38	45
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c1	ZINC000819047165	GC	On-Demand	Anodyne	DRD4	40	31
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c1	ZINC000819047165	GC	On-Demand	Anodyne	ADRB3	43	45
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c1	ZINC000819047165	GC	On-Demand	Anodyne	ACOX1	44	32
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c1	ZINC000819047165	GC	On-Demand	Anodyne	CCR3	25	47
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c1	ZINC000819047165	GC	On-Demand	Anodyne	ABCB1	23	46
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c1	ZINC000819047167	GC	On-Demand	Anodyne	ADRB2	30	45
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c1	ZINC000819047167	GC	On-Demand	Anodyne	ADRB1	38	45
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c1	ZINC000819047167	GC	On-Demand	Anodyne	DRD4	40	31
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c1	ZINC000819047167	GC	On-Demand	Anodyne	ADRB3	43	45
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c1	ZINC000819047167	GC	On-Demand	Anodyne	ACOX1	44	32
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c1	ZINC000819047167	GC	On-Demand	Anodyne	CCR3	25	47
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c1	ZINC000819047167	GC	On-Demand	Anodyne	ABCB1	23	46
O[C@H](CNCCOC[C@H]1CCOC1)c1cccnc1	ZINC000819047187	CC	On-Demand	Anodyne	ADRB2	22	47
O[C@H](CNCCOC[C@H]1CCOC1)c1cccnc1	ZINC000819047187	CC	On-Demand	Anodyne	ADRB1	25	47
O[C@H](CNCCOC[C@H]1CCOC1)c1cccnc1	ZINC000819047187	CC	On-Demand	Anodyne	ADRB3	91	49
O[C@@H](CNCCOC[C@H]1CCOC1)c1cccnc1	ZINC000819047189	CC	On-Demand	Anodyne	ADRB2	22	47
O[C@@H](CNCCOC[C@H]1CCOC1)c1cccnc1	ZINC000819047189	CC	On-Demand	Anodyne	ADRB1	25	47
O[C@@H](CNCCOC[C@H]1CCOC1)c1cccnc1	ZINC000819047189	CC	On-Demand	Anodyne	ADRB3	91	49
O[C@@H](CNCCOC[C@@H]1CCOC1)c1cccnc1	ZINC000819047190	CC	On-Demand	Anodyne	ADRB2	22	47
O[C@@H](CNCCOC[C@@H]1CCOC1)c1cccnc1	ZINC000819047190	CC	On-Demand	Anodyne	ADRB1	25	47
O[C@@H](CNCCOC[C@@H]1CCOC1)c1cccnc1	ZINC000819047190	CC	On-Demand	Anodyne	ADRB3	91	49
O[C@H](CNCCOC[C@@H]1CCOC1)c1cccnc1	ZINC000819047192	CC	On-Demand	Anodyne	ADRB2	22	47
O[C@H](CNCCOC[C@@H]1CCOC1)c1cccnc1	ZINC000819047192	CC	On-Demand	Anodyne	ADRB1	25	47
O[C@H](CNCCOC[C@@H]1CCOC1)c1cccnc1	ZINC000819047192	CC	On-Demand	Anodyne	ADRB3	91	49
Cc1cc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1F	ZINC000819047196	FG	On-Demand	Mild	PAPA1_CARPA	56	53
Cc1cc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1F	ZINC000819047196	FG	On-Demand	Mild	CTSL	21	53
Cc1cc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1F	ZINC000819047196	FG	On-Demand	Mild	FURIN	47	31
Cc1cc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1F	ZINC000819047196	FG	On-Demand	Mild	CTSS	16	53
Cc1cc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1F	ZINC000819047196	FG	On-Demand	Mild	FPR1	43	39
Cc1cc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1F	ZINC000819047196	FG	On-Demand	Mild	LEF	87	42
Cc1cc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1F	ZINC000819047198	FG	On-Demand	Mild	PAPA1_CARPA	56	53
Cc1cc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1F	ZINC000819047198	FG	On-Demand	Mild	CTSL	21	53
Cc1cc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1F	ZINC000819047198	FG	On-Demand	Mild	FURIN	47	31
Cc1cc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1F	ZINC000819047198	FG	On-Demand	Mild	CTSS	16	53
Cc1cc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1F	ZINC000819047198	FG	On-Demand	Mild	FPR1	43	39
Cc1cc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1F	ZINC000819047198	FG	On-Demand	Mild	LEF	87	42
O=C(/C=C/[C@@H]1CCCO1)NCC1(c2ccccc2)CCC1	ZINC000819047200	CF	On-Demand	Anodyne	KCNA3	48	41
O=C(/C=C\[C@@H]1CCCO1)NCC1(c2ccccc2)CCC1	ZINC000819047201	CF	On-Demand	Anodyne	KCNA3	48	41
O=C(/C=C\[C@H]1CCCO1)NCC1(c2ccccc2)CCC1	ZINC000819047203	CF	On-Demand	Anodyne	KCNA3	48	41
O=C(/C=C/[C@H]1CCCO1)NCC1(c2ccccc2)CCC1	ZINC000819047204	CF	On-Demand	Anodyne	KCNA3	48	41
O=C1[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)CCN1c1ccccc1Cl	ZINC000819047240	GH	On-Demand	Anodyne	KCNQ2	17	42
O=C1[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)CCN1c1ccccc1Cl	ZINC000819047244	GH	On-Demand	Anodyne	KCNQ2	17	42
O=C1[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)CCN1c1ccccc1Cl	ZINC000819047245	GH	On-Demand	Anodyne	KCNQ2	17	42
O=C1[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)CCN1c1ccccc1Cl	ZINC000819047247	GH	On-Demand	Anodyne	KCNQ2	17	42
O=C(NCCCNC[C@H](O)c1ccc(F)cc1)c1cccc(F)c1	ZINC000819047256	EE	On-Demand	Anodyne	CES2	18	44
O=C(NCCCNC[C@@H](O)c1ccc(F)cc1)c1cccc(F)c1	ZINC000819047257	EE	On-Demand	Anodyne	CES2	18	44
O=C(NCCCNC[C@H](O)c1ccc(Cl)cc1)c1ccc(F)cc1	ZINC000819047276	FF	On-Demand	Anodyne	GCGR	25	40
O=C(NCCCNC[C@H](O)c1ccc(Cl)cc1)c1ccc(F)cc1	ZINC000819047276	FF	On-Demand	Anodyne	FOLH1	19	43
O=C(NCCCNC[C@H](O)c1ccc(Cl)cc1)c1ccc(F)cc1	ZINC000819047276	FF	On-Demand	Anodyne	ALPL	40	34
O=C(NCCCNC[C@H](O)c1ccc(Cl)cc1)c1ccc(F)cc1	ZINC000819047276	FF	On-Demand	Anodyne	UTS2	42	34
NC(=O)c1ccc(N2CCCC2)c(NC(=O)C(F)=C2CCC2)c1	ZINC000819047277	DF	On-Demand	Anodyne	KCNQ2	63	34
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2F)CCN1c1ccccc1Cl	ZINC000819047284	FG	On-Demand	Anodyne	P2RX7	31	44
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2F)CCN1c1ccccc1Cl	ZINC000819047286	FG	On-Demand	Anodyne	P2RX7	31	44
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2F)CCN1c1ccccc1Cl	ZINC000819047287	FG	On-Demand	Anodyne	P2RX7	31	44
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819047288	GG	On-Demand	Bother	ADRB2	22	42
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819047288	GG	On-Demand	Bother	ADRB1	45	46
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819047288	GG	On-Demand	Bother	ADRB3	46	46
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819047288	GG	On-Demand	Bother	ACR	17	44
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2F)CCN1c1ccccc1Cl	ZINC000819047289	FG	On-Demand	Anodyne	P2RX7	31	44
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819047291	GG	On-Demand	Bother	ADRB2	22	42
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819047291	GG	On-Demand	Bother	ADRB1	45	46
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819047291	GG	On-Demand	Bother	ADRB3	46	46
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819047291	GG	On-Demand	Bother	ACR	17	44
O=C(NCCCNC[C@H](O)C1CC1)c1cccc(F)c1	ZINC000819047302	CD	On-Demand	Anodyne	KCNK3	20	43
O=C(NCCCNC[C@@H](O)C1CC1)c1cccc(F)c1	ZINC000819047303	CD	On-Demand	Anodyne	KCNK3	20	43
Cc1ccccc1[C@@H](O)CNCCCNC(=O)c1ccc(F)cc1	ZINC000819047306	EF	On-Demand	Anodyne	DRD3	19	43
Cc1ccccc1[C@@H](O)CNCCCNC(=O)c1ccc(F)cc1	ZINC000819047306	EF	On-Demand	Anodyne	FOLH1	26	42
Cc1ccccc1[C@@H](O)CNCCCNC(=O)c1ccc(F)cc1	ZINC000819047306	EF	On-Demand	Anodyne	BCHE	21	42
Cc1ccccc1[C@@H](O)CNCCCNC(=O)c1ccc(F)cc1	ZINC000819047306	EF	On-Demand	Anodyne	LEF	56	35
Cc1ccccc1[C@@H](O)CNCCCNC(=O)c1ccc(F)cc1	ZINC000819047306	EF	On-Demand	Anodyne	CTSA	48	36
O=C(NCCCNC[C@H](O)c1cccnc1)c1ccc(F)cc1	ZINC000819047313	DD	On-Demand	Anodyne	ADRB2	26	57
O=C(NCCCNC[C@H](O)c1cccnc1)c1ccc(F)cc1	ZINC000819047313	DD	On-Demand	Anodyne	ADRB1	35	46
O=C(NCCCNC[C@H](O)c1cccnc1)c1ccc(F)cc1	ZINC000819047313	DD	On-Demand	Anodyne	ADRB3	109	57
O=C(NCCCNC[C@H](O)c1cccnc1)c1ccc(F)cc1	ZINC000819047313	DD	On-Demand	Anodyne	PTAFR	17	44
O=C(NCCCNC[C@H](O)c1cccnc1)c1ccc(F)cc1	ZINC000819047313	DD	On-Demand	Anodyne	KCNA5	15	41
O=C(NCCCNC[C@H](O)c1cccnc1)c1ccc(F)cc1	ZINC000819047313	DD	On-Demand	Anodyne	CYP24A1	24	41
O=C(NCCCNC[C@H](O)c1cccnc1)c1ccc(F)cc1	ZINC000819047313	DD	On-Demand	Anodyne	CYP27B1	27	41
O=C(NCCCNC[C@@H](O)c1cccnc1)c1ccc(F)cc1	ZINC000819047314	DD	On-Demand	Anodyne	ADRB2	26	57
O=C(NCCCNC[C@@H](O)c1cccnc1)c1ccc(F)cc1	ZINC000819047314	DD	On-Demand	Anodyne	ADRB1	35	46
O=C(NCCCNC[C@@H](O)c1cccnc1)c1ccc(F)cc1	ZINC000819047314	DD	On-Demand	Anodyne	ADRB3	109	57
O=C(NCCCNC[C@@H](O)c1cccnc1)c1ccc(F)cc1	ZINC000819047314	DD	On-Demand	Anodyne	PTAFR	17	44
O=C(NCCCNC[C@@H](O)c1cccnc1)c1ccc(F)cc1	ZINC000819047314	DD	On-Demand	Anodyne	KCNA5	15	41
O=C(NCCCNC[C@@H](O)c1cccnc1)c1ccc(F)cc1	ZINC000819047314	DD	On-Demand	Anodyne	CYP24A1	24	41
O=C(NCCCNC[C@@H](O)c1cccnc1)c1ccc(F)cc1	ZINC000819047314	DD	On-Demand	Anodyne	CYP27B1	27	41
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)Cc1ccccc1	ZINC000819047315	EG	On-Demand	Anodyne	ADRB2	48	43
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)Cc1ccccc1	ZINC000819047315	EG	On-Demand	Anodyne	ADRB1	52	46
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)Cc1ccccc1	ZINC000819047315	EG	On-Demand	Anodyne	ADRB3	65	48
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)Cc1ccccc1	ZINC000819047317	EG	On-Demand	Anodyne	ADRB2	48	43
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)Cc1ccccc1	ZINC000819047317	EG	On-Demand	Anodyne	ADRB1	52	46
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)Cc1ccccc1	ZINC000819047317	EG	On-Demand	Anodyne	ADRB3	65	48
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)Cc1ccccc1	ZINC000819047318	EG	On-Demand	Anodyne	ADRB2	48	43
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)Cc1ccccc1	ZINC000819047318	EG	On-Demand	Anodyne	ADRB1	52	46
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)Cc1ccccc1	ZINC000819047318	EG	On-Demand	Anodyne	ADRB3	65	48
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)Cc1ccccc1	ZINC000819047320	EG	On-Demand	Anodyne	ADRB2	48	43
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)Cc1ccccc1	ZINC000819047320	EG	On-Demand	Anodyne	ADRB1	52	46
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)Cc1ccccc1	ZINC000819047320	EG	On-Demand	Anodyne	ADRB3	65	48
O=C(NCCCNC[C@H](O)c1ccc(F)cc1F)c1ccc(F)cc1	ZINC000819047325	FF	On-Demand	Anodyne	FOLH1	26	43
O=C(NCCCNC[C@H](O)c1ccc(F)cc1F)c1ccc(F)cc1	ZINC000819047325	FF	On-Demand	Anodyne	LEF	42	34
O=C(NCCCNC[C@@H](O)c1ccc(F)cc1F)c1ccc(F)cc1	ZINC000819047326	FF	On-Demand	Anodyne	FOLH1	26	43
O=C(NCCCNC[C@@H](O)c1ccc(F)cc1F)c1ccc(F)cc1	ZINC000819047326	FF	On-Demand	Anodyne	LEF	42	34
O=C1[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)CCN1c1ccccc1	ZINC000819047336	FG	On-Demand	Anodyne	RBP4	51	36
O=C1[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)CCN1c1ccccc1	ZINC000819047337	FG	On-Demand	Anodyne	RBP4	51	36
O=C1[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)CCN1c1ccccc1	ZINC000819047338	FG	On-Demand	Anodyne	RBP4	51	36
O=C1[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)CCN1c1ccccc1	ZINC000819047339	FG	On-Demand	Anodyne	RBP4	51	36
C[C@H](C#N)CNC[C@H](O)c1cccnc1	ZINC000819047348	BC	On-Demand	Mild	ADRB2	26	45
C[C@H](C#N)CNC[C@H](O)c1cccnc1	ZINC000819047348	BC	On-Demand	Mild	ADRB1	27	45
C[C@H](C#N)CNC[C@H](O)c1cccnc1	ZINC000819047348	BC	On-Demand	Mild	ADRB3	94	45
C[C@H](C#N)CNC[C@H](O)c1cccnc1	ZINC000819047348	BC	On-Demand	Mild	PTAFR	15	40
C[C@H](C#N)CNC[C@@H](O)c1cccnc1	ZINC000819047349	BC	On-Demand	Mild	ADRB2	26	45
C[C@H](C#N)CNC[C@@H](O)c1cccnc1	ZINC000819047349	BC	On-Demand	Mild	ADRB1	27	45
C[C@H](C#N)CNC[C@@H](O)c1cccnc1	ZINC000819047349	BC	On-Demand	Mild	ADRB3	94	45
C[C@H](C#N)CNC[C@@H](O)c1cccnc1	ZINC000819047349	BC	On-Demand	Mild	PTAFR	15	40
O=C1C[C@H](C(=O)NNC(=S)Nc2ccc(Cl)c(Cl)c2)CN1	ZINC000819047399	ED	On-Demand	Reactive	TYK2	61	37
O=C1C[C@@H](C(=O)NNC(=S)Nc2ccc(Cl)c(Cl)c2)CN1	ZINC000819047400	ED	On-Demand	Reactive	TYK2	61	37
CS(=O)(=O)c1ccc([C@H](O)CNCCCNC(=O)c2ccc(F)cc2)cc1	ZINC000819047450	GD	On-Demand	Anodyne	ADRB2	18	41
CS(=O)(=O)c1ccc([C@H](O)CNCCCNC(=O)c2ccc(F)cc2)cc1	ZINC000819047450	GD	On-Demand	Anodyne	PTGS2	25	40
CS(=O)(=O)c1ccc([C@H](O)CNCCCNC(=O)c2ccc(F)cc2)cc1	ZINC000819047450	GD	On-Demand	Anodyne	LOX1.1	28	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCCNC(=O)c2ccc(F)cc2)cc1	ZINC000819047451	GD	On-Demand	Anodyne	ADRB2	18	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCCNC(=O)c2ccc(F)cc2)cc1	ZINC000819047451	GD	On-Demand	Anodyne	PTGS2	25	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCCNC(=O)c2ccc(F)cc2)cc1	ZINC000819047451	GD	On-Demand	Anodyne	LOX1.1	28	40
O=C(NCCCNC[C@H](O)c1ccc(F)c(F)c1)c1cccc(F)c1	ZINC000819047466	FF	On-Demand	Anodyne	ADRB1	34	40
O=C(NCCCNC[C@H](O)c1ccc(F)c(F)c1)c1cccc(F)c1	ZINC000819047466	FF	On-Demand	Anodyne	ADRB3	37	40
O=C(NCCCNC[C@@H](O)c1ccc(F)c(F)c1)c1cccc(F)c1	ZINC000819047467	FF	On-Demand	Anodyne	ADRB1	34	40
O=C(NCCCNC[C@@H](O)c1ccc(F)c(F)c1)c1cccc(F)c1	ZINC000819047467	FF	On-Demand	Anodyne	ADRB3	37	40
O=C(NCCCNC[C@H](O)c1cccc(F)c1)c1ccc(F)cc1	ZINC000819047468	EE	On-Demand	Anodyne	ADRB1	40	43
O=C(NCCCNC[C@H](O)c1cccc(F)c1)c1ccc(F)cc1	ZINC000819047468	EE	On-Demand	Anodyne	FOLH1	15	40
O=C(NCCCNC[C@H](O)c1cccc(F)c1)c1ccc(F)cc1	ZINC000819047468	EE	On-Demand	Anodyne	ADRB3	51	43
O=C(NCCCNC[C@H](O)c1cccc(F)c1)c1ccc(F)cc1	ZINC000819047468	EE	On-Demand	Anodyne	CES2	15	46
O=C(NCCCNC[C@@H](O)c1cccc(F)c1)c1ccc(F)cc1	ZINC000819047469	EE	On-Demand	Anodyne	ADRB1	40	43
O=C(NCCCNC[C@@H](O)c1cccc(F)c1)c1ccc(F)cc1	ZINC000819047469	EE	On-Demand	Anodyne	FOLH1	15	40
O=C(NCCCNC[C@@H](O)c1cccc(F)c1)c1ccc(F)cc1	ZINC000819047469	EE	On-Demand	Anodyne	ADRB3	51	43
O=C(NCCCNC[C@@H](O)c1cccc(F)c1)c1ccc(F)cc1	ZINC000819047469	EE	On-Demand	Anodyne	CES2	15	46
O=C(c1ccccc1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819047474	DF	On-Demand	Anodyne	ITGAL	43	36
O=C(c1ccccc1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819047474	DF	On-Demand	Anodyne	SLC18A3	41	43
O=C(c1ccccc1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819047474	DF	On-Demand	Anodyne	L3MBTL3	48	35
O=C(c1ccccc1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819047475	DF	On-Demand	Anodyne	ITGAL	43	36
O=C(c1ccccc1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819047475	DF	On-Demand	Anodyne	SLC18A3	41	43
O=C(c1ccccc1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819047475	DF	On-Demand	Anodyne	L3MBTL3	48	35
O=C(c1ccccc1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819047476	DF	On-Demand	Anodyne	ITGAL	43	36
O=C(c1ccccc1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819047476	DF	On-Demand	Anodyne	SLC18A3	41	43
O=C(c1ccccc1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819047476	DF	On-Demand	Anodyne	L3MBTL3	48	35
O=C(c1ccccc1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819047478	DF	On-Demand	Anodyne	ITGAL	43	36
O=C(c1ccccc1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819047478	DF	On-Demand	Anodyne	SLC18A3	41	43
O=C(c1ccccc1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819047478	DF	On-Demand	Anodyne	L3MBTL3	48	35
O=C(NCCCNC[C@H](O)c1cccnc1)c1cccc(F)c1	ZINC000819047481	DD	On-Demand	Anodyne	ADRB2	27	56
O=C(NCCCNC[C@H](O)c1cccnc1)c1cccc(F)c1	ZINC000819047481	DD	On-Demand	Anodyne	ADRB1	39	49
O=C(NCCCNC[C@H](O)c1cccnc1)c1cccc(F)c1	ZINC000819047481	DD	On-Demand	Anodyne	ADRB3	113	56
O=C(NCCCNC[C@H](O)c1cccnc1)c1cccc(F)c1	ZINC000819047481	DD	On-Demand	Anodyne	TBXAS1	18	41
O=C(NCCCNC[C@H](O)c1cccnc1)c1cccc(F)c1	ZINC000819047481	DD	On-Demand	Anodyne	PTAFR	15	44
O=C(NCCCNC[C@H](O)c1cccnc1)c1cccc(F)c1	ZINC000819047481	DD	On-Demand	Anodyne	KCNA5	18	42
O=C(NCCCNC[C@@H](O)c1cccnc1)c1cccc(F)c1	ZINC000819047483	DD	On-Demand	Anodyne	ADRB2	27	56
O=C(NCCCNC[C@@H](O)c1cccnc1)c1cccc(F)c1	ZINC000819047483	DD	On-Demand	Anodyne	ADRB1	39	49
O=C(NCCCNC[C@@H](O)c1cccnc1)c1cccc(F)c1	ZINC000819047483	DD	On-Demand	Anodyne	ADRB3	113	56
O=C(NCCCNC[C@@H](O)c1cccnc1)c1cccc(F)c1	ZINC000819047483	DD	On-Demand	Anodyne	TBXAS1	18	41
O=C(NCCCNC[C@@H](O)c1cccnc1)c1cccc(F)c1	ZINC000819047483	DD	On-Demand	Anodyne	PTAFR	15	44
O=C(NCCCNC[C@@H](O)c1cccnc1)c1cccc(F)c1	ZINC000819047483	DD	On-Demand	Anodyne	KCNA5	18	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(C(=O)c2ccccc2)CC1	ZINC000819047490	FG	On-Demand	Anodyne	SLC18A3	44	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(C(=O)c2ccccc2)CC1	ZINC000819047490	FG	On-Demand	Anodyne	SFRP1	72	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(C(=O)c2ccccc2)CC1	ZINC000819047490	FG	On-Demand	Anodyne	WNT3	62	34
CS(=O)(=O)c1ccc([C@H](O)CNCCCNC(=O)c2cccc(F)c2)cc1	ZINC000819047497	GD	On-Demand	Anodyne	ADRB2	31	41
CS(=O)(=O)c1ccc([C@H](O)CNCCCNC(=O)c2cccc(F)c2)cc1	ZINC000819047497	GD	On-Demand	Anodyne	ADRB3	54	39
CS(=O)(=O)c1ccc([C@@H](O)CNCCCNC(=O)c2cccc(F)c2)cc1	ZINC000819047499	GD	On-Demand	Anodyne	ADRB2	31	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCCNC(=O)c2cccc(F)c2)cc1	ZINC000819047499	GD	On-Demand	Anodyne	ADRB3	54	39
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1ccccc1	ZINC000819047502	CD	On-Demand	Anodyne	ADRB2	16	42
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1ccccc1	ZINC000819047502	CD	On-Demand	Anodyne	ADRB1	23	41
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1ccccc1	ZINC000819047502	CD	On-Demand	Anodyne	ADRB3	74	46
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1ccccc1	ZINC000819047504	CD	On-Demand	Anodyne	ADRB2	16	42
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1ccccc1	ZINC000819047504	CD	On-Demand	Anodyne	ADRB1	23	41
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1ccccc1	ZINC000819047504	CD	On-Demand	Anodyne	ADRB3	74	46
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1ccccc1	ZINC000819047506	CD	On-Demand	Anodyne	ADRB2	16	42
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1ccccc1	ZINC000819047506	CD	On-Demand	Anodyne	ADRB1	23	41
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1ccccc1	ZINC000819047506	CD	On-Demand	Anodyne	ADRB3	74	46
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1ccccc1	ZINC000819047508	CD	On-Demand	Anodyne	ADRB2	16	42
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1ccccc1	ZINC000819047508	CD	On-Demand	Anodyne	ADRB1	23	41
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1ccccc1	ZINC000819047508	CD	On-Demand	Anodyne	ADRB3	74	46
C[C@@H](CNC[C@@H](O)c1cccnc1)Sc1ccc(Br)cc1	ZINC000819047522	FH	On-Demand	Anodyne	ADRB2	23	41
C[C@@H](CNC[C@@H](O)c1cccnc1)Sc1ccc(Br)cc1	ZINC000819047522	FH	On-Demand	Anodyne	ADRB1	23	41
C[C@@H](CNC[C@@H](O)c1cccnc1)Sc1ccc(Br)cc1	ZINC000819047522	FH	On-Demand	Anodyne	ADRB3	90	50
C[C@@H](CNC[C@H](O)c1cccnc1)Sc1ccc(Br)cc1	ZINC000819047524	FH	On-Demand	Anodyne	ADRB2	23	41
C[C@@H](CNC[C@H](O)c1cccnc1)Sc1ccc(Br)cc1	ZINC000819047524	FH	On-Demand	Anodyne	ADRB1	23	41
C[C@@H](CNC[C@H](O)c1cccnc1)Sc1ccc(Br)cc1	ZINC000819047524	FH	On-Demand	Anodyne	ADRB3	90	50
C[C@H](CNC[C@@H](O)c1cccnc1)Sc1ccc(Br)cc1	ZINC000819047526	FH	On-Demand	Anodyne	ADRB2	23	41
C[C@H](CNC[C@@H](O)c1cccnc1)Sc1ccc(Br)cc1	ZINC000819047526	FH	On-Demand	Anodyne	ADRB1	23	41
C[C@H](CNC[C@@H](O)c1cccnc1)Sc1ccc(Br)cc1	ZINC000819047526	FH	On-Demand	Anodyne	ADRB3	90	50
C[C@H](CNC[C@H](O)c1cccnc1)Sc1ccc(Br)cc1	ZINC000819047527	FH	On-Demand	Anodyne	ADRB2	23	41
C[C@H](CNC[C@H](O)c1cccnc1)Sc1ccc(Br)cc1	ZINC000819047527	FH	On-Demand	Anodyne	ADRB1	23	41
C[C@H](CNC[C@H](O)c1cccnc1)Sc1ccc(Br)cc1	ZINC000819047527	FH	On-Demand	Anodyne	ADRB3	90	50
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000819047543	DI	On-Demand	Mild	NPY2R	57	44
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2nc3ccccc3[nH]2)CC1	ZINC000819047563	EG	On-Demand	Anodyne	HTR2B	15	58
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2nc3ccccc3[nH]2)CC1	ZINC000819047563	EG	On-Demand	Anodyne	SMO	39	42
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2nc3ccccc3[nH]2)CC1	ZINC000819047565	EG	On-Demand	Anodyne	HTR2B	15	58
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2nc3ccccc3[nH]2)CC1	ZINC000819047565	EG	On-Demand	Anodyne	SMO	39	42
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2nc3ccccc3[nH]2)CC1	ZINC000819047566	EG	On-Demand	Anodyne	HTR2B	15	58
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2nc3ccccc3[nH]2)CC1	ZINC000819047566	EG	On-Demand	Anodyne	SMO	39	42
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2nc3ccccc3[nH]2)CC1	ZINC000819047567	EG	On-Demand	Anodyne	HTR2B	15	58
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2nc3ccccc3[nH]2)CC1	ZINC000819047567	EG	On-Demand	Anodyne	SMO	39	42
O[C@H](CNCC1(Sc2ccccc2)CCCC1)c1cccnc1	ZINC000819047576	EH	On-Demand	Anodyne	ADRB2	19	41
O[C@H](CNCC1(Sc2ccccc2)CCCC1)c1cccnc1	ZINC000819047576	EH	On-Demand	Anodyne	ADRB3	83	44
O[C@@H](CNCC1(Sc2ccccc2)CCCC1)c1cccnc1	ZINC000819047578	EH	On-Demand	Anodyne	ADRB2	19	41
O[C@@H](CNCC1(Sc2ccccc2)CCCC1)c1cccnc1	ZINC000819047578	EH	On-Demand	Anodyne	ADRB3	83	44
O[C@@H](CNCCOC[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819047588	CE	On-Demand	Anodyne	ADRB1	50	43
O[C@@H](CNCCOC[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819047588	CE	On-Demand	Anodyne	ADRB3	56	43
O[C@@H](CNCCOC[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819047588	CE	On-Demand	Anodyne	CYP3A4	49	35
O[C@H](CNCCOC[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819047590	CE	On-Demand	Anodyne	ADRB1	50	43
O[C@H](CNCCOC[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819047590	CE	On-Demand	Anodyne	ADRB3	56	43
O[C@H](CNCCOC[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819047590	CE	On-Demand	Anodyne	CYP3A4	49	35
O[C@H](CNCCOC[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819047591	CE	On-Demand	Anodyne	ADRB1	50	43
O[C@H](CNCCOC[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819047591	CE	On-Demand	Anodyne	ADRB3	56	43
O[C@H](CNCCOC[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819047591	CE	On-Demand	Anodyne	CYP3A4	49	35
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCCCCCC1	ZINC000819047592	CF	On-Demand	Anodyne	HTR1B	24	40
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCCCCCC1	ZINC000819047592	CF	On-Demand	Anodyne	KCNJ1	67	46
O[C@@H](CNCCOC[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819047593	CE	On-Demand	Anodyne	ADRB1	50	43
O[C@@H](CNCCOC[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819047593	CE	On-Demand	Anodyne	ADRB3	56	43
O[C@@H](CNCCOC[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819047593	CE	On-Demand	Anodyne	CYP3A4	49	35
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819047600	EF	On-Demand	Bother	ADRB1	32	43
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819047600	EF	On-Demand	Bother	ADRB3	34	43
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819047601	EF	On-Demand	Bother	ADRB1	32	43
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819047601	EF	On-Demand	Bother	ADRB3	34	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(C(=O)c3ccccc3)CC1)C2	ZINC000819047613	GF	On-Demand	Anodyne	SLC18A3	48	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(C(=O)c3ccccc3)CC1)C2	ZINC000819047616	GF	On-Demand	Anodyne	SLC18A3	48	46
O=C(NCCCNC[C@H](O)c1ccccc1)c1cccc(F)c1	ZINC000819047618	DE	On-Demand	Anodyne	ADRB1	43	41
O=C(NCCCNC[C@H](O)c1ccccc1)c1cccc(F)c1	ZINC000819047618	DE	On-Demand	Anodyne	ADRB3	55	45
O=C(NCCCNC[C@H](O)c1ccccc1)c1cccc(F)c1	ZINC000819047618	DE	On-Demand	Anodyne	KCNK3	42	48
O=C(NCCCNC[C@H](O)c1ccccc1)c1cccc(F)c1	ZINC000819047618	DE	On-Demand	Anodyne	KCNK9	18	40
O=C(NCCCNC[C@@H](O)c1ccccc1)c1cccc(F)c1	ZINC000819047619	DE	On-Demand	Anodyne	ADRB1	43	41
O=C(NCCCNC[C@@H](O)c1ccccc1)c1cccc(F)c1	ZINC000819047619	DE	On-Demand	Anodyne	ADRB3	55	45
O=C(NCCCNC[C@@H](O)c1ccccc1)c1cccc(F)c1	ZINC000819047619	DE	On-Demand	Anodyne	KCNK3	42	48
O=C(NCCCNC[C@@H](O)c1ccccc1)c1cccc(F)c1	ZINC000819047619	DE	On-Demand	Anodyne	KCNK9	18	40
O=C(Nc1cccc(S(=O)(=O)NC2CC2)c1)C(F)=C1CCC1	ZINC000819047623	DE	On-Demand	Anodyne	SFRP1	93	34
O=C(Nc1cccc(S(=O)(=O)NC2CC2)c1)C(F)=C1CCC1	ZINC000819047623	DE	On-Demand	Anodyne	WNT3	63	34
O=C1C[C@H](C(=O)NNC(=S)Nc2ccc(F)c(Cl)c2)CN1	ZINC000819047628	EC	On-Demand	Reactive	TYK2	48	33
O=C1C[C@@H](C(=O)NNC(=S)Nc2ccc(F)c(Cl)c2)CN1	ZINC000819047631	EC	On-Demand	Reactive	TYK2	48	33
O=C(/C=C\[C@@H]1CCCO1)NCC1(c2ccccc2)CC1	ZINC000819047644	CF	On-Demand	Anodyne	KCNA3	48	40
O=C(/C=C/[C@@H]1CCCO1)NCC1(c2ccccc2)CC1	ZINC000819047647	CF	On-Demand	Anodyne	KCNA3	48	40
O=C(/C=C\[C@H]1CCCO1)NCC1(c2ccccc2)CC1	ZINC000819047649	CF	On-Demand	Anodyne	KCNA3	48	40
O=C(/C=C/[C@H]1CCCO1)NCC1(c2ccccc2)CC1	ZINC000819047650	CF	On-Demand	Anodyne	KCNA3	48	40
O=C(NC1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1)c1ccccc1	ZINC000819047671	EE	On-Demand	Anodyne	DRD4	15	43
O=C(NC1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1)c1ccccc1	ZINC000819047671	EE	On-Demand	Anodyne	EPHX2	30	42
O=C(NC1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1)c1ccccc1	ZINC000819047673	EE	On-Demand	Anodyne	DRD4	15	43
O=C(NC1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1)c1ccccc1	ZINC000819047673	EE	On-Demand	Anodyne	EPHX2	30	42
O=C(NC1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1)c1ccccc1	ZINC000819047675	EE	On-Demand	Anodyne	DRD4	15	43
O=C(NC1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1)c1ccccc1	ZINC000819047675	EE	On-Demand	Anodyne	EPHX2	30	42
O=C(NC1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1)c1ccccc1	ZINC000819047677	EE	On-Demand	Anodyne	DRD4	15	43
O=C(NC1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1)c1ccccc1	ZINC000819047677	EE	On-Demand	Anodyne	EPHX2	30	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	ZINC000819047686	GD	On-Demand	Anodyne	SFRP1	113	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1	ZINC000819047686	GD	On-Demand	Anodyne	WNT3	70	34
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819047688	DE	On-Demand	Bother	ADRB2	23	40
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819047688	DE	On-Demand	Bother	ADRB1	47	46
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819047688	DE	On-Demand	Bother	ADRB3	47	46
O=[N+]([O-])c1ccc(OCCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819047688	DE	On-Demand	Bother	ACR	17	44
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819047694	DE	On-Demand	Bother	ADRB2	23	40
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819047694	DE	On-Demand	Bother	ADRB1	47	46
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819047694	DE	On-Demand	Bother	ADRB3	47	46
O=[N+]([O-])c1ccc(OCCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819047694	DE	On-Demand	Bother	ACR	17	44
CS(=O)(=O)NC1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819047754	CC	On-Demand	Anodyne	SFRP1	62	31
CS(=O)(=O)NC1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819047754	CC	On-Demand	Anodyne	WNT3	53	31
O=C1C[C@@H](C(=O)NNC(=S)NC23CC4CC(CC(C4)C2)C3)CN1	ZINC000819047788	EC	On-Demand	Reactive	EPHX2	41	40
O=C1C[C@H](C(=O)NNC(=S)NC23CC4CC(CC(C4)C2)C3)CN1	ZINC000819047791	EC	On-Demand	Reactive	EPHX2	41	40
O=C1C[C@@H](C(=O)NNC(=S)NCCc2ccc(Cl)cc2Cl)CN1	ZINC000819047793	GD	On-Demand	Reactive	P2RX7	33	45
O=C1C[C@H](C(=O)NNC(=S)NCCc2ccc(Cl)cc2Cl)CN1	ZINC000819047796	GD	On-Demand	Reactive	P2RX7	33	45
O=C1C[C@@H](C(=O)NNC(=S)Nc2ccccc2Cl)CN1	ZINC000819047814	DC	On-Demand	Reactive	EPHB3	40	31
O=C1C[C@H](C(=O)NNC(=S)Nc2ccccc2Cl)CN1	ZINC000819047815	DC	On-Demand	Reactive	EPHB3	40	31
O=C(Nc1ccc(N2CCCC2=O)c(Cl)c1)C(F)=C1CCC1	ZINC000819047843	DH	On-Demand	Anodyne	NPY2R	44	36
N#Cc1ccc(CN2CCCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1	ZINC000819047852	EE	On-Demand	Mild	MLNR	16	41
O=C1C[C@H](C(=O)NNC(=S)Nc2ccc3c(c2)OC(F)(F)O3)CN1	ZINC000819047853	FC	On-Demand	Reactive	KIT	23	40
O=C1C[C@H](C(=O)NNC(=S)Nc2ccc3c(c2)OC(F)(F)O3)CN1	ZINC000819047853	FC	On-Demand	Reactive	BRAF	20	40
O=C1C[C@@H](C(=O)NNC(=S)Nc2ccc3c(c2)OC(F)(F)O3)CN1	ZINC000819047854	FC	On-Demand	Reactive	KIT	23	40
O=C1C[C@@H](C(=O)NNC(=S)Nc2ccc3c(c2)OC(F)(F)O3)CN1	ZINC000819047854	FC	On-Demand	Reactive	BRAF	20	40
N#Cc1ccc(CN2CCCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1	ZINC000819047855	EE	On-Demand	Mild	MLNR	16	41
N#Cc1ccc(CN2CCCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1	ZINC000819047858	EE	On-Demand	Mild	MLNR	16	41
N#Cc1ccc(CN2CCCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1	ZINC000819047861	EE	On-Demand	Mild	MLNR	16	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCOc3ccc(F)cc32)CC1	ZINC000819047863	GG	On-Demand	Anodyne	CTSD	15	47
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCOc3ccc(F)cc32)CC1	ZINC000819047863	GG	On-Demand	Anodyne	GPR119	37	50
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCOc3ccc(F)cc32)CC1	ZINC000819047866	GG	On-Demand	Anodyne	CTSD	15	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCOc3ccc(F)cc32)CC1	ZINC000819047866	GG	On-Demand	Anodyne	GPR119	37	50
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCOc3ccc(F)cc32)CC1	ZINC000819047869	GG	On-Demand	Anodyne	CTSD	15	47
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCOc3ccc(F)cc32)CC1	ZINC000819047869	GG	On-Demand	Anodyne	GPR119	37	50
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCOc3ccc(F)cc32)CC1	ZINC000819047873	GG	On-Demand	Anodyne	CTSD	15	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCOc3ccc(F)cc32)CC1	ZINC000819047873	GG	On-Demand	Anodyne	GPR119	37	50
Cc1ccc(NC(=S)NNC(=O)CN2CCCC[C@H](O)C2=O)cc1C	ZINC000819047913	FC	On-Demand	Reactive	F10	15	49
Cc1ccc(NC(=S)NNC(=O)CN2CCCC[C@@H](O)C2=O)cc1C	ZINC000819047915	FC	On-Demand	Reactive	F10	15	49
O=C(NCCCNC[C@H](O)c1ccccc1C(F)(F)F)c1cccc(F)c1	ZINC000819047916	GG	On-Demand	Anodyne	KCNJ11	29	41
O=C(NCCCNC[C@H](O)c1ccccc1C(F)(F)F)c1cccc(F)c1	ZINC000819047916	GG	On-Demand	Anodyne	KCNK3	28	40
O=C(NCCCNC[C@@H](O)c1ccccc1C(F)(F)F)c1cccc(F)c1	ZINC000819047920	GG	On-Demand	Anodyne	KCNJ11	29	41
O=C(NCCCNC[C@@H](O)c1ccccc1C(F)(F)F)c1cccc(F)c1	ZINC000819047920	GG	On-Demand	Anodyne	KCNK3	28	40
O=C(NCCCNC[C@H](O)c1ccc(Br)cc1)c1ccc(F)cc1	ZINC000819047921	GG	On-Demand	Anodyne	FOLH1	19	43
O=C(NCCCNC[C@@H](O)c1ccc(Br)cc1)c1ccc(F)cc1	ZINC000819047923	GG	On-Demand	Anodyne	FOLH1	19	43
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1ccccc1Cl	ZINC000819047936	EE	On-Demand	Anodyne	ADRB3	57	42
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1ccccc1Cl	ZINC000819047938	EE	On-Demand	Anodyne	ADRB3	57	42
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1ccccc1Cl	ZINC000819047941	EE	On-Demand	Anodyne	ADRB3	57	42
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1ccccc1Cl	ZINC000819047942	EE	On-Demand	Anodyne	ADRB3	57	42
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCCc2cccc(F)c2)CC1	ZINC000819047943	GH	On-Demand	Anodyne	GPR119	17	47
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCCc2cccc(F)c2)CC1	ZINC000819047946	GH	On-Demand	Anodyne	GPR119	17	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3nccs3)CC1)C2	ZINC000819047950	FD	On-Demand	Anodyne	NPBWR1	58	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3nccs3)CC1)C2	ZINC000819047952	FD	On-Demand	Anodyne	NPBWR1	58	45
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819047961	GG	On-Demand	Anodyne	MCHR1	17	40
O=C(/C=C\[C@H]1CCCO1)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819047962	GG	On-Demand	Anodyne	MCHR1	17	40
O=C(/C=C/[C@H]1CCCO1)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819047963	GG	On-Demand	Anodyne	MCHR1	17	40
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819047964	GG	On-Demand	Anodyne	MCHR1	17	40
O=C(NCCCNC[C@H](O)c1ccc(C(F)(F)F)cc1)c1cccc(F)c1	ZINC000819047965	GG	On-Demand	Anodyne	CCR2	52	39
O=C(NCCCNC[C@H](O)c1ccc(C(F)(F)F)cc1)c1cccc(F)c1	ZINC000819047965	GG	On-Demand	Anodyne	KCNK3	19	41
O=C(NCCCNC[C@@H](O)c1ccc(C(F)(F)F)cc1)c1cccc(F)c1	ZINC000819047966	GG	On-Demand	Anodyne	CCR2	52	39
O=C(NCCCNC[C@@H](O)c1ccc(C(F)(F)F)cc1)c1cccc(F)c1	ZINC000819047966	GG	On-Demand	Anodyne	KCNK3	19	41
N#Cc1ccc([C@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047971	GH	On-Demand	Mild	ADRB2	41	44
N#Cc1ccc([C@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047971	GH	On-Demand	Mild	ACHE	18	50
N#Cc1ccc([C@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047971	GH	On-Demand	Mild	SLC6A3	16	41
N#Cc1ccc([C@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047971	GH	On-Demand	Mild	CHRM3	20	44
N#Cc1ccc([C@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047971	GH	On-Demand	Mild	GRIN2B	55	50
N#Cc1ccc([C@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047971	GH	On-Demand	Mild	SIGMAR1	28	48
N#Cc1ccc([C@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047971	GH	On-Demand	Mild	CCR3	47	55
N#Cc1ccc([C@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047971	GH	On-Demand	Mild	GRIN2C	26	44
N#Cc1ccc([C@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047971	GH	On-Demand	Mild	CYP2J2	42	30
N#Cc1ccc([C@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047971	GH	On-Demand	Mild	MEN1	40	39
N#Cc1ccc([C@@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047974	GH	On-Demand	Mild	ADRB2	41	44
N#Cc1ccc([C@@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047974	GH	On-Demand	Mild	ACHE	18	50
N#Cc1ccc([C@@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047974	GH	On-Demand	Mild	SLC6A3	16	41
N#Cc1ccc([C@@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047974	GH	On-Demand	Mild	CHRM3	20	44
N#Cc1ccc([C@@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047974	GH	On-Demand	Mild	GRIN2B	55	50
N#Cc1ccc([C@@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047974	GH	On-Demand	Mild	SIGMAR1	28	48
N#Cc1ccc([C@@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047974	GH	On-Demand	Mild	CCR3	47	55
N#Cc1ccc([C@@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047974	GH	On-Demand	Mild	GRIN2C	26	44
N#Cc1ccc([C@@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047974	GH	On-Demand	Mild	CYP2J2	42	30
N#Cc1ccc([C@@H](O)CNCCCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC000819047974	GH	On-Demand	Mild	MEN1	40	39
O[C@@H](CNCCCc1cccc(F)c1)c1ccc(F)cc1F	ZINC000819047975	DG	On-Demand	Anodyne	ADRB2	71	42
O[C@@H](CNCCCc1cccc(F)c1)c1ccc(F)cc1F	ZINC000819047975	DG	On-Demand	Anodyne	ADRB1	50	42
O[C@@H](CNCCCc1cccc(F)c1)c1ccc(F)cc1F	ZINC000819047975	DG	On-Demand	Anodyne	ADRB3	30	40
O[C@H](CNCCCc1cccc(F)c1)c1ccc(F)cc1F	ZINC000819047978	DG	On-Demand	Anodyne	ADRB2	71	42
O[C@H](CNCCCc1cccc(F)c1)c1ccc(F)cc1F	ZINC000819047978	DG	On-Demand	Anodyne	ADRB1	50	42
O[C@H](CNCCCc1cccc(F)c1)c1ccc(F)cc1F	ZINC000819047978	DG	On-Demand	Anodyne	ADRB3	30	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)c1nc3ccccc3[nH]1)C2	ZINC000819048020	FF	On-Demand	Anodyne	OPRD1	17	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)c1nc3ccccc3[nH]1)C2	ZINC000819048025	FF	On-Demand	Anodyne	OPRD1	17	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)c1nc3ccccc3[nH]1)C2	ZINC000819048029	FF	On-Demand	Anodyne	OPRD1	17	43
O=C(C(F)=C1CCC1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819048032	DI	On-Demand	Anodyne	HTR1D	22	43
O=C(C(F)=C1CCC1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819048032	DI	On-Demand	Anodyne	HTR1B	19	43
O=C(C(F)=C1CCC1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819048032	DI	On-Demand	Anodyne	HTR1F	67	39
O=C(C(F)=C1CCC1)N1CCC(c2c[nH]c3ccccc23)CC1	ZINC000819048032	DI	On-Demand	Anodyne	CCR2	31	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)c1nc3ccccc3[nH]1)C2	ZINC000819048033	FF	On-Demand	Anodyne	OPRD1	17	43
O=C(NCCCNC[C@H](O)c1ccc(Cl)cc1Cl)c1cccc(F)c1	ZINC000819048041	GH	On-Demand	Anodyne	ADRB1	28	40
O=C(NCCCNC[C@H](O)c1ccc(Cl)cc1Cl)c1cccc(F)c1	ZINC000819048041	GH	On-Demand	Anodyne	ADRB3	21	40
O=C(NCCCNC[C@@H](O)c1ccc(Cl)cc1Cl)c1cccc(F)c1	ZINC000819048042	GH	On-Demand	Anodyne	ADRB1	28	40
O=C(NCCCNC[C@@H](O)c1ccc(Cl)cc1Cl)c1cccc(F)c1	ZINC000819048042	GH	On-Demand	Anodyne	ADRB3	21	40
O=C(C(F)=C1CCC1)N1CCc2[nH]c3ccccc3c2C1	ZINC000819048051	CG	On-Demand	Anodyne	DRD5	20	41
O=C(NCCCNC[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000819048055	DE	On-Demand	Anodyne	ADRB2	25	44
O=C(NCCCNC[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000819048055	DE	On-Demand	Anodyne	ADRB1	39	40
O=C(NCCCNC[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000819048055	DE	On-Demand	Anodyne	FOLH1	31	47
O=C(NCCCNC[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000819048055	DE	On-Demand	Anodyne	ADRB3	54	40
O=C(NCCCNC[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000819048055	DE	On-Demand	Anodyne	BCHE	22	44
O=C(NCCCNC[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000819048055	DE	On-Demand	Anodyne	CYP24A1	25	43
O=C(NCCCNC[C@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000819048055	DE	On-Demand	Anodyne	CYP27B1	28	43
O=C(NCCCNC[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000819048056	DE	On-Demand	Anodyne	ADRB2	25	44
O=C(NCCCNC[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000819048056	DE	On-Demand	Anodyne	ADRB1	39	40
O=C(NCCCNC[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000819048056	DE	On-Demand	Anodyne	FOLH1	31	47
O=C(NCCCNC[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000819048056	DE	On-Demand	Anodyne	ADRB3	54	40
O=C(NCCCNC[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000819048056	DE	On-Demand	Anodyne	BCHE	22	44
O=C(NCCCNC[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000819048056	DE	On-Demand	Anodyne	CYP24A1	25	43
O=C(NCCCNC[C@@H](O)c1ccccc1)c1ccc(F)cc1	ZINC000819048056	DE	On-Demand	Anodyne	CYP27B1	28	43
O=C(NCCCNC[C@H](O)c1ccccc1F)c1cccc(F)c1	ZINC000819048060	EE	On-Demand	Anodyne	KCNK3	17	44
O=C(NCCCNC[C@@H](O)c1ccccc1F)c1cccc(F)c1	ZINC000819048061	EE	On-Demand	Anodyne	KCNK3	17	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ncccc3C#N)CC1)C2	ZINC000819048069	GD	On-Demand	Mild	SSTR1	67	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ncccc3C#N)CC1)C2	ZINC000819048070	GD	On-Demand	Mild	SSTR1	67	41
COc1ccc(OC)c([C@H](O)CNCCCNC(=O)c2ccc(F)cc2)c1	ZINC000819048080	GE	On-Demand	Anodyne	ADRB2	18	41
COc1ccc(OC)c([C@H](O)CNCCCNC(=O)c2ccc(F)cc2)c1	ZINC000819048080	GE	On-Demand	Anodyne	DRD2	18	45
COc1ccc(OC)c([C@H](O)CNCCCNC(=O)c2ccc(F)cc2)c1	ZINC000819048080	GE	On-Demand	Anodyne	DRD3	35	45
COc1ccc(OC)c([C@H](O)CNCCCNC(=O)c2ccc(F)cc2)c1	ZINC000819048080	GE	On-Demand	Anodyne	MTNR1A	26	40
COc1ccc(OC)c([C@H](O)CNCCCNC(=O)c2ccc(F)cc2)c1	ZINC000819048080	GE	On-Demand	Anodyne	MTNR1B	25	40
COc1ccc(OC)c([C@H](O)CNCCCNC(=O)c2ccc(F)cc2)c1	ZINC000819048080	GE	On-Demand	Anodyne	MT-ND1	18	41
COc1ccc(OC)c([C@H](O)CNCCCNC(=O)c2ccc(F)cc2)c1	ZINC000819048080	GE	On-Demand	Anodyne	LEF	46	33
FC1(F)Oc2ccc(NC(=S)NC[C@@H]3CCCO[C@H]3c3cc[nH]n3)cc2O1	ZINC000819048095	GG	On-Demand	Anodyne	KIT	24	43
FC1(F)Oc2ccc(NC(=S)NC[C@@H]3CCCO[C@H]3c3cc[nH]n3)cc2O1	ZINC000819048095	GG	On-Demand	Anodyne	BRAF	21	43
O=C1C[C@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048097	GC	On-Demand	Reactive	CHRM2	15	44
O=C1C[C@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048097	GC	On-Demand	Reactive	DRD2	17	50
O=C1C[C@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048097	GC	On-Demand	Reactive	DRD4	49	48
O=C1C[C@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048097	GC	On-Demand	Reactive	ACHE	39	44
O=C1C[C@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048097	GC	On-Demand	Reactive	DRD3	15	50
O=C1C[C@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048097	GC	On-Demand	Reactive	CHRM3	19	44
O=C1C[C@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048097	GC	On-Demand	Reactive	SIGMAR1	52	54
O=C1C[C@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048097	GC	On-Demand	Reactive	SSTR5	43	36
O=C1C[C@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048097	GC	On-Demand	Reactive	CCR3	19	42
O=C1C[C@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048097	GC	On-Demand	Reactive	MCHR1	33	44
O=C1C[C@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048097	GC	On-Demand	Reactive	CACNA1G	27	43
O=C1C[C@@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048098	GC	On-Demand	Reactive	CHRM2	15	44
O=C1C[C@@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048098	GC	On-Demand	Reactive	DRD2	17	50
O=C1C[C@@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048098	GC	On-Demand	Reactive	DRD4	49	48
O=C1C[C@@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048098	GC	On-Demand	Reactive	ACHE	39	44
O=C1C[C@@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048098	GC	On-Demand	Reactive	DRD3	15	50
O=C1C[C@@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048098	GC	On-Demand	Reactive	CHRM3	19	44
O=C1C[C@@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048098	GC	On-Demand	Reactive	SIGMAR1	52	54
O=C1C[C@@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048098	GC	On-Demand	Reactive	SSTR5	43	36
O=C1C[C@@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048098	GC	On-Demand	Reactive	CCR3	19	42
O=C1C[C@@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048098	GC	On-Demand	Reactive	MCHR1	33	44
O=C1C[C@@H](C(=O)NNC(=S)NC2CCN(Cc3ccccc3)CC2)CN1	ZINC000819048098	GC	On-Demand	Reactive	CACNA1G	27	43
S=C(NC[C@@H]1CCCO[C@H]1c1cc[nH]n1)Nc1ccc2c(c1)OCCO2	ZINC000819048103	FF	On-Demand	Anodyne	QPCT	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC=C(c3c[nH]c4ccccc34)CC1)C2	ZINC000819048112	GH	On-Demand	Anodyne	ADAM10	29	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC=C(c3c[nH]c4ccccc34)CC1)C2	ZINC000819048113	GH	On-Demand	Anodyne	ADAM10	29	40
C[C@H](NC(=S)NNC(=O)[C@H]1CNC(=O)C1)c1ccccc1	ZINC000819048166	DC	On-Demand	Reactive	BIRC8	54	33
C[C@@H](NC(=S)NNC(=O)[C@@H]1CNC(=O)C1)c1ccccc1	ZINC000819048167	DC	On-Demand	Reactive	BIRC8	54	33
C[C@@H](NC(=S)NNC(=O)[C@H]1CNC(=O)C1)c1ccccc1	ZINC000819048168	DC	On-Demand	Reactive	BIRC8	54	33
C[C@H](NC(=S)NNC(=O)[C@@H]1CNC(=O)C1)c1ccccc1	ZINC000819048169	DC	On-Demand	Reactive	BIRC8	54	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCN(Cc3ccccc3)CC1)C2	ZINC000819048192	GF	On-Demand	Anodyne	ACHE	35	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCN(Cc3ccccc3)CC1)C2	ZINC000819048192	GF	On-Demand	Anodyne	SIGMAR1	44	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCN(Cc3ccccc3)CC1)C2	ZINC000819048192	GF	On-Demand	Anodyne	PREP	51	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCN(Cc3ccccc3)CC1)C2	ZINC000819048194	GF	On-Demand	Anodyne	ACHE	35	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCN(Cc3ccccc3)CC1)C2	ZINC000819048194	GF	On-Demand	Anodyne	SIGMAR1	44	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCN(Cc3ccccc3)CC1)C2	ZINC000819048194	GF	On-Demand	Anodyne	PREP	51	38
O[C@@H](CNCCCc1cccc(F)c1)c1ccccc1	ZINC000819048200	CG	On-Demand	Anodyne	ADRB2	80	44
O[C@@H](CNCCCc1cccc(F)c1)c1ccccc1	ZINC000819048200	CG	On-Demand	Anodyne	ADRB1	72	44
O[C@@H](CNCCCc1cccc(F)c1)c1ccccc1	ZINC000819048200	CG	On-Demand	Anodyne	ADRB3	90	44
O[C@H](CNCCCc1cccc(F)c1)c1ccccc1	ZINC000819048202	CG	On-Demand	Anodyne	ADRB2	80	44
O[C@H](CNCCCc1cccc(F)c1)c1ccccc1	ZINC000819048202	CG	On-Demand	Anodyne	ADRB1	72	44
O[C@H](CNCCCc1cccc(F)c1)c1ccccc1	ZINC000819048202	CG	On-Demand	Anodyne	ADRB3	90	44
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048229	DE	On-Demand	Anodyne	DRD2	18	41
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048229	DE	On-Demand	Anodyne	DRD4	42	41
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048229	DE	On-Demand	Anodyne	ACHE	33	42
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048229	DE	On-Demand	Anodyne	HRH3	15	44
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048229	DE	On-Demand	Anodyne	SIGMAR1	64	41
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048229	DE	On-Demand	Anodyne	FAAH	21	41
O=C(/C=C\[C@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048231	DE	On-Demand	Anodyne	DRD2	18	41
O=C(/C=C\[C@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048231	DE	On-Demand	Anodyne	DRD4	42	41
O=C(/C=C\[C@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048231	DE	On-Demand	Anodyne	ACHE	33	42
O=C(/C=C\[C@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048231	DE	On-Demand	Anodyne	HRH3	15	44
O=C(/C=C\[C@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048231	DE	On-Demand	Anodyne	SIGMAR1	64	41
O=C(/C=C\[C@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048231	DE	On-Demand	Anodyne	FAAH	21	41
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048233	DE	On-Demand	Anodyne	DRD2	18	41
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048233	DE	On-Demand	Anodyne	DRD4	42	41
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048233	DE	On-Demand	Anodyne	ACHE	33	42
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048233	DE	On-Demand	Anodyne	HRH3	15	44
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048233	DE	On-Demand	Anodyne	SIGMAR1	64	41
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048233	DE	On-Demand	Anodyne	FAAH	21	41
O=C(/C=C/[C@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048235	DE	On-Demand	Anodyne	DRD2	18	41
O=C(/C=C/[C@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048235	DE	On-Demand	Anodyne	DRD4	42	41
O=C(/C=C/[C@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048235	DE	On-Demand	Anodyne	ACHE	33	42
O=C(/C=C/[C@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048235	DE	On-Demand	Anodyne	HRH3	15	44
O=C(/C=C/[C@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048235	DE	On-Demand	Anodyne	SIGMAR1	64	41
O=C(/C=C/[C@H]1CCCO1)N1CCCN(Cc2ccccc2)CC1	ZINC000819048235	DE	On-Demand	Anodyne	FAAH	21	41
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2cccc(F)c2)cc1	ZINC000819048237	FE	On-Demand	Anodyne	ADRB2	72	44
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2cccc(F)c2)cc1	ZINC000819048237	FE	On-Demand	Anodyne	ADRB1	62	44
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2cccc(F)c2)cc1	ZINC000819048237	FE	On-Demand	Anodyne	ADRB3	116	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2cccc(F)c2)cc1	ZINC000819048240	FE	On-Demand	Anodyne	ADRB2	72	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2cccc(F)c2)cc1	ZINC000819048240	FE	On-Demand	Anodyne	ADRB1	62	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2cccc(F)c2)cc1	ZINC000819048240	FE	On-Demand	Anodyne	ADRB3	116	44
O[C@@H](CNCCCc1cccc(F)c1)c1cccnc1	ZINC000819048270	CE	On-Demand	Anodyne	ADRB2	60	55
O[C@@H](CNCCCc1cccc(F)c1)c1cccnc1	ZINC000819048270	CE	On-Demand	Anodyne	ADRB1	67	56
O[C@@H](CNCCCc1cccc(F)c1)c1cccnc1	ZINC000819048270	CE	On-Demand	Anodyne	ADRB3	140	56
O[C@H](CNCCCc1cccc(F)c1)c1cccnc1	ZINC000819048271	CE	On-Demand	Anodyne	ADRB2	60	55
O[C@H](CNCCCc1cccc(F)c1)c1cccnc1	ZINC000819048271	CE	On-Demand	Anodyne	ADRB1	67	56
O[C@H](CNCCCc1cccc(F)c1)c1cccnc1	ZINC000819048271	CE	On-Demand	Anodyne	ADRB3	140	56
O=C(NCCCCc1ccccc1)C(F)=C1CCC1	ZINC000819048291	CH	On-Demand	Anodyne	SIGMAR1	19	43
O=C(NCCCCc1ccccc1)C(F)=C1CCC1	ZINC000819048291	CH	On-Demand	Anodyne	SCN2A	17	40
O=C(NCCCCc1ccccc1)C(F)=C1CCC1	ZINC000819048291	CH	On-Demand	Anodyne	FAAH	33	42
O=C(NCCCCc1ccccc1)C(F)=C1CCC1	ZINC000819048291	CH	On-Demand	Anodyne	CES1	45	39
O=C(NCCCCc1ccccc1)C(F)=C1CCC1	ZINC000819048291	CH	On-Demand	Anodyne	AMP1_PLAFQ	24	49
O=C(NCCCCc1ccccc1)C(F)=C1CCC1	ZINC000819048291	CH	On-Demand	Anodyne	CRTM	34	40
C[C@H](C#N)CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819048292	CC	On-Demand	Mild	CTSF	55	36
C[C@H](C#N)CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819048294	CC	On-Demand	Mild	CTSF	55	36
Cc1cc(F)ccc1[C@@H](O)CNCCCc1cccc(F)c1	ZINC000819048304	DH	On-Demand	Anodyne	ADRB2	70	41
Cc1cc(F)ccc1[C@@H](O)CNCCCc1cccc(F)c1	ZINC000819048304	DH	On-Demand	Anodyne	ADRB1	49	41
Cc1cc(F)ccc1[C@@H](O)CNCCCc1cccc(F)c1	ZINC000819048304	DH	On-Demand	Anodyne	LEF	42	40
S=C(NC[C@@H]1CCCO[C@H]1c1cc[nH]n1)Nc1ccc(Cl)c(Cl)c1	ZINC000819048411	GI	On-Demand	Anodyne	TMK	26	40
O=C(Nc1ccc(S(=O)(=O)NC2CC2)cc1)C(F)=C1CCC1	ZINC000819048415	DE	On-Demand	Anodyne	CA2	15	41
O=C(Nc1ccc(S(=O)(=O)NC2CC2)cc1)C(F)=C1CCC1	ZINC000819048415	DE	On-Demand	Anodyne	CA1	15	41
O=C(Nc1ccc(S(=O)(=O)NC2CC2)cc1)C(F)=C1CCC1	ZINC000819048415	DE	On-Demand	Anodyne	CA9	16	41
O=C(Nc1ccc(S(=O)(=O)NC2CC2)cc1)C(F)=C1CCC1	ZINC000819048415	DE	On-Demand	Anodyne	MTCA1	29	41
O=C(Nc1ccc(S(=O)(=O)NC2CC2)cc1)C(F)=C1CCC1	ZINC000819048415	DE	On-Demand	Anodyne	P96878_MYCTU	33	41
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cn1	ZINC000819048416	FE	On-Demand	Mild	PAPA1_CARPA	57	52
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cn1	ZINC000819048416	FE	On-Demand	Mild	CTSL	19	52
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cn1	ZINC000819048416	FE	On-Demand	Mild	FURIN	47	32
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cn1	ZINC000819048416	FE	On-Demand	Mild	CTSS	17	53
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cn1	ZINC000819048416	FE	On-Demand	Mild	FPR1	42	37
C[C@H](C#N)CNC[C@@H](O)c1cccc(F)c1	ZINC000819048485	BD	On-Demand	Mild	ADRB1	17	42
C[C@H](C#N)CNC[C@@H](O)c1cccc(F)c1	ZINC000819048485	BD	On-Demand	Mild	ADRB3	24	42
C[C@H](C#N)CNC[C@H](O)c1cccc(F)c1	ZINC000819048488	BD	On-Demand	Mild	ADRB1	17	42
C[C@H](C#N)CNC[C@H](O)c1cccc(F)c1	ZINC000819048488	BD	On-Demand	Mild	ADRB3	24	42
O[C@@H](CNCCCc1cccc(F)c1)c1ccc(F)cc1	ZINC000819048513	CG	On-Demand	Anodyne	ADRB2	81	45
O[C@@H](CNCCCc1cccc(F)c1)c1ccc(F)cc1	ZINC000819048513	CG	On-Demand	Anodyne	ADRB1	57	42
O[C@@H](CNCCCc1cccc(F)c1)c1ccc(F)cc1	ZINC000819048513	CG	On-Demand	Anodyne	ADRB3	55	42
O[C@H](CNCCCc1cccc(F)c1)c1ccc(F)cc1	ZINC000819048514	CG	On-Demand	Anodyne	ADRB2	81	45
O[C@H](CNCCCc1cccc(F)c1)c1ccc(F)cc1	ZINC000819048514	CG	On-Demand	Anodyne	ADRB1	57	42
O[C@H](CNCCCc1cccc(F)c1)c1ccc(F)cc1	ZINC000819048514	CG	On-Demand	Anodyne	ADRB3	55	42
O=S(=O)(CCNC[C@H](O)c1cccc(Br)c1)NCC1CCC1	ZINC000819048520	GD	On-Demand	Anodyne	ADRB3	57	38
O=S(=O)(CCNC[C@@H](O)c1cccc(Br)c1)NCC1CCC1	ZINC000819048521	GD	On-Demand	Anodyne	ADRB3	57	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCCc1ccccc1)C2	ZINC000819048525	EF	On-Demand	Anodyne	FKBP1A	33	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCCc1ccccc1)C2	ZINC000819048525	EF	On-Demand	Anodyne	SLC6A3	18	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCCc1ccccc1)C2	ZINC000819048525	EF	On-Demand	Anodyne	SCN2A	17	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCCc1ccccc1)C2	ZINC000819048526	EF	On-Demand	Anodyne	FKBP1A	33	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCCc1ccccc1)C2	ZINC000819048526	EF	On-Demand	Anodyne	SLC6A3	18	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCCc1ccccc1)C2	ZINC000819048526	EF	On-Demand	Anodyne	SCN2A	17	42
C=CCC1(C(=O)NNC(=O)c2ccc(Cl)cc2OC)CCOCC1	ZINC000819048568	FE	On-Demand	Reactive	F10	48	31
O=S(=O)(CCNC[C@H](O)c1cccc(F)c1)NCC1CCC1	ZINC000819048574	ED	On-Demand	Anodyne	ADRB1	35	40
O=S(=O)(CCNC[C@H](O)c1cccc(F)c1)NCC1CCC1	ZINC000819048574	ED	On-Demand	Anodyne	ADRB3	62	40
O=S(=O)(CCNC[C@@H](O)c1cccc(F)c1)NCC1CCC1	ZINC000819048575	ED	On-Demand	Anodyne	ADRB1	35	40
O=S(=O)(CCNC[C@@H](O)c1cccc(F)c1)NCC1CCC1	ZINC000819048575	ED	On-Demand	Anodyne	ADRB3	62	40
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048583	EG	On-Demand	Anodyne	DRD2	15	47
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048583	EG	On-Demand	Anodyne	DRD4	16	45
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048583	EG	On-Demand	Anodyne	ACHE	35	57
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048583	EG	On-Demand	Anodyne	HTR2A	15	57
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048583	EG	On-Demand	Anodyne	SLC6A3	15	40
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048583	EG	On-Demand	Anodyne	GRIN2B	71	46
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048583	EG	On-Demand	Anodyne	SIGMAR1	53	57
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048583	EG	On-Demand	Anodyne	BCHE	19	57
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048583	EG	On-Demand	Anodyne	CCR3	47	59
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048583	EG	On-Demand	Anodyne	CCR5	17	44
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048583	EG	On-Demand	Anodyne	GRIN2C	26	42
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048583	EG	On-Demand	Anodyne	CYP2J2	45	31
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048584	EG	On-Demand	Anodyne	DRD2	15	47
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048584	EG	On-Demand	Anodyne	DRD4	16	45
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048584	EG	On-Demand	Anodyne	ACHE	35	57
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048584	EG	On-Demand	Anodyne	HTR2A	15	57
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048584	EG	On-Demand	Anodyne	SLC6A3	15	40
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048584	EG	On-Demand	Anodyne	GRIN2B	71	46
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048584	EG	On-Demand	Anodyne	SIGMAR1	53	57
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048584	EG	On-Demand	Anodyne	BCHE	19	57
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048584	EG	On-Demand	Anodyne	CCR3	47	59
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048584	EG	On-Demand	Anodyne	CCR5	17	44
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048584	EG	On-Demand	Anodyne	GRIN2C	26	42
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)C1CC1	ZINC000819048584	EG	On-Demand	Anodyne	CYP2J2	45	31
C[C@@H](CC(=O)N1CCc2cc(S(=O)(=O)N(C)C)ccc21)n1cccn1	ZINC000819048586	FD	On-Demand	Anodyne	EIF2AK3	54	33
COc1ccc(OC)c([C@H](O)CNCCS(=O)(=O)NCC2CCC2)c1	ZINC000819048589	FD	On-Demand	Anodyne	ADRB1	18	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCS(=O)(=O)NCC2CCC2)c1	ZINC000819048634	FC	On-Demand	Bother	ADRB3	48	37
O=[N+]([O-])c1cccc([C@@H](O)CNCCS(=O)(=O)NCC2CCC2)c1	ZINC000819048634	FC	On-Demand	Bother	CACNA1D	56	35
O=[N+]([O-])c1cccc([C@H](O)CNCCS(=O)(=O)NCC2CCC2)c1	ZINC000819048635	FC	On-Demand	Bother	ADRB3	48	37
O=[N+]([O-])c1cccc([C@H](O)CNCCS(=O)(=O)NCC2CCC2)c1	ZINC000819048635	FC	On-Demand	Bother	CACNA1D	56	35
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048640	DE	On-Demand	Anodyne	HTR2A	15	49
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048640	DE	On-Demand	Anodyne	OPRM1	16	43
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048640	DE	On-Demand	Anodyne	SIGMAR1	54	45
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048640	DE	On-Demand	Anodyne	CYP2J2	46	34
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048640	DE	On-Demand	Anodyne	KCNJ1	52	32
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048641	DE	On-Demand	Anodyne	HTR2A	15	49
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048641	DE	On-Demand	Anodyne	OPRM1	16	43
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048641	DE	On-Demand	Anodyne	SIGMAR1	54	45
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048641	DE	On-Demand	Anodyne	CYP2J2	46	34
O=C(/C=C\[C@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048641	DE	On-Demand	Anodyne	KCNJ1	52	32
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048642	DE	On-Demand	Anodyne	HTR2A	15	49
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048642	DE	On-Demand	Anodyne	OPRM1	16	43
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048642	DE	On-Demand	Anodyne	SIGMAR1	54	45
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048642	DE	On-Demand	Anodyne	CYP2J2	46	34
O=C(/C=C/[C@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048642	DE	On-Demand	Anodyne	KCNJ1	52	32
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048643	DE	On-Demand	Anodyne	HTR2A	15	49
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048643	DE	On-Demand	Anodyne	OPRM1	16	43
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048643	DE	On-Demand	Anodyne	SIGMAR1	54	45
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048643	DE	On-Demand	Anodyne	CYP2J2	46	34
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CCc2ccccc2)CC1	ZINC000819048643	DE	On-Demand	Anodyne	KCNJ1	52	32
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCOc3ccc(F)cc32)c1	ZINC000819048652	EF	On-Demand	Bother	LUXR	17	42
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCOc3ccc(F)cc32)c1	ZINC000819048653	EF	On-Demand	Bother	LUXR	17	42
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCOc3ccc(F)cc32)c1	ZINC000819048654	EF	On-Demand	Bother	LUXR	17	42
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCOc3ccc(F)cc32)c1	ZINC000819048655	EF	On-Demand	Bother	LUXR	17	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCc2cccc(F)c2)CC1	ZINC000819048657	GG	On-Demand	Anodyne	GPR119	43	63
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCc2cccc(F)c2)CC1	ZINC000819048658	GG	On-Demand	Anodyne	GPR119	43	63
COc1ccc(OC)c([C@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c1	ZINC000819048677	GC	On-Demand	Anodyne	HTR4	41	38
COc1ccc(OC)c([C@H](O)CNC2CCN(CCS(C)(=O)=O)CC2)c1	ZINC000819048677	GC	On-Demand	Anodyne	ADRB3	23	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(NC(C)=O)cc1)C2	ZINC000819048725	FE	On-Demand	Anodyne	VHL	58	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(NC(C)=O)cc1)C2	ZINC000819048726	FE	On-Demand	Anodyne	VHL	58	33
Cc1ccc(OC[C@H](O)CNCCN/C(O)=C2\N=CC=CC2=O)c(C)c1	ZINC000819048728	FD	On-Demand	Mild	ADRB1	46	36
Cc1ccc(OC[C@@H](O)CNCCN/C(O)=C2/N=CC=CC2=O)c(C)c1	ZINC000819048729	FD	On-Demand	Mild	ADRB1	46	36
Cc1ccc(OC[C@@H](O)CNCCN/C(O)=C2\N=CC=CC2=O)c(C)c1	ZINC000819048730	FD	On-Demand	Mild	ADRB1	46	36
Cc1ccc(OC[C@H](O)CNCCN/C(O)=C2/N=CC=CC2=O)c(C)c1	ZINC000819048731	FD	On-Demand	Mild	ADRB1	46	36
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(F)=C1CCC1	ZINC000819048747	DF	On-Demand	Anodyne	MLYCD	18	42
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)C(F)=C1CCC1	ZINC000819048747	DF	On-Demand	Anodyne	L3MBTL3	71	40
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCCC2)c(C)c1	ZINC000819048756	CI	On-Demand	Mild	KCNQ2	51	31
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCCC2)c(C)c1	ZINC000819048756	CI	On-Demand	Mild	NPY2R	54	50
O[C@H](CNCCCCCN1CCCCC1)c1cccc(Br)c1	ZINC000819048775	FH	On-Demand	Anodyne	ADRB2	37	40
O[C@H](CNCCCCCN1CCCCC1)c1cccc(Br)c1	ZINC000819048775	FH	On-Demand	Anodyne	ADRB1	43	39
O[C@H](CNCCCCCN1CCCCC1)c1cccc(Br)c1	ZINC000819048775	FH	On-Demand	Anodyne	ADRB3	54	42
O[C@H](CNCCCCCN1CCCCC1)c1cccc(Br)c1	ZINC000819048775	FH	On-Demand	Anodyne	HRH3	17	40
O[C@H](CNCCCCCN1CCCCC1)c1cccc(Br)c1	ZINC000819048775	FH	On-Demand	Anodyne	HNMT	55	36
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(Br)c1	ZINC000819048776	FH	On-Demand	Anodyne	ADRB2	37	40
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(Br)c1	ZINC000819048776	FH	On-Demand	Anodyne	ADRB1	43	39
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(Br)c1	ZINC000819048776	FH	On-Demand	Anodyne	ADRB3	54	42
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(Br)c1	ZINC000819048776	FH	On-Demand	Anodyne	HRH3	17	40
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(Br)c1	ZINC000819048776	FH	On-Demand	Anodyne	HNMT	55	36
NC(=O)CN1CCC(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819048791	GD	On-Demand	Anodyne	DRD4	34	48
NC(=O)CN1CCC(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819048791	GD	On-Demand	Anodyne	SIGMAR1	15	41
NC(=O)CN1CCC(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819048791	GD	On-Demand	Anodyne	CCR3	21	43
NC(=O)CN1CCC(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819048791	GD	On-Demand	Anodyne	MCHR1	23	47
NC(=O)COc1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819048796	CD	On-Demand	Anodyne	EPHX2	15	40
NC(=O)COc1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819048797	CD	On-Demand	Anodyne	EPHX2	15	40
NC(=O)COc1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819048798	CD	On-Demand	Anodyne	EPHX2	15	40
NC(=O)COc1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819048799	CD	On-Demand	Anodyne	EPHX2	15	40
COC(=O)c1cc(NC(=O)C[C@H](C)n2cccn2)ccc1F	ZINC000819048806	DE	On-Demand	Anodyne	SLC1A1	42	34
COC(=O)c1cc(NC(=O)C[C@H](C)n2cccn2)ccc1F	ZINC000819048806	DE	On-Demand	Anodyne	SLC1A3	45	33
COC(=O)c1cc(NC(=O)C[C@H](C)n2cccn2)ccc1F	ZINC000819048806	DE	On-Demand	Anodyne	SLC1A2	67	36
COC(=O)c1cc(NC(=O)C[C@H](C)n2cccn2)ccc1F	ZINC000819048806	DE	On-Demand	Anodyne	ENPP1	67	33
COC(=O)c1cc(NC(=O)C[C@@H](C)n2cccn2)ccc1F	ZINC000819048807	DE	On-Demand	Anodyne	SLC1A1	42	34
COC(=O)c1cc(NC(=O)C[C@@H](C)n2cccn2)ccc1F	ZINC000819048807	DE	On-Demand	Anodyne	SLC1A3	45	33
COC(=O)c1cc(NC(=O)C[C@@H](C)n2cccn2)ccc1F	ZINC000819048807	DE	On-Demand	Anodyne	SLC1A2	67	36
COC(=O)c1cc(NC(=O)C[C@@H](C)n2cccn2)ccc1F	ZINC000819048807	DE	On-Demand	Anodyne	ENPP1	67	33
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819048825	FF	On-Demand	Anodyne	PTGER4	19	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819048825	FF	On-Demand	Anodyne	EPHX2	17	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819048825	FF	On-Demand	Anodyne	GPR119	31	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819048826	FF	On-Demand	Anodyne	PTGER4	19	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819048826	FF	On-Demand	Anodyne	EPHX2	17	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819048826	FF	On-Demand	Anodyne	GPR119	31	45
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819048827	FF	On-Demand	Anodyne	PTGER4	19	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819048827	FF	On-Demand	Anodyne	EPHX2	17	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819048827	FF	On-Demand	Anodyne	GPR119	31	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819048828	FF	On-Demand	Anodyne	PTGER4	19	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819048828	FF	On-Demand	Anodyne	EPHX2	17	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819048828	FF	On-Demand	Anodyne	GPR119	31	45
CCN1CCCC[C@@H]1CNC[C@H](O)c1cccc(Br)c1	ZINC000819048864	EF	On-Demand	Anodyne	DRD2	27	41
CCN1CCCC[C@@H]1CNC[C@@H](O)c1cccc(Br)c1	ZINC000819048866	EF	On-Demand	Anodyne	DRD2	27	41
COc1ccc(OC)c([C@H](O)CNCCCCN2C(=O)c3ccccc3C2=O)c1	ZINC000819048869	GE	On-Demand	Anodyne	ADRB2	45	42
COc1ccc(OC)c([C@H](O)CNCCCCN2C(=O)c3ccccc3C2=O)c1	ZINC000819048869	GE	On-Demand	Anodyne	HTR1A	15	56
COc1ccc(OC)c([C@H](O)CNCCCCN2C(=O)c3ccccc3C2=O)c1	ZINC000819048869	GE	On-Demand	Anodyne	DRD3	15	42
COc1ccc(OC)c([C@H](O)CNCCCCN2C(=O)c3ccccc3C2=O)c1	ZINC000819048869	GE	On-Demand	Anodyne	MTNR1A	33	40
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2cc(F)cc(F)c2)C1	ZINC000819048878	FF	On-Demand	Anodyne	GPR119	34	42
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2cc(F)cc(F)c2)C1	ZINC000819048881	FF	On-Demand	Anodyne	GPR119	34	42
CCc1cccc2c(CCNC[C@@H](O)c3ccc(F)cn3)c[nH]c12	ZINC000819048885	EG	On-Demand	Anodyne	ADRB2	18	41
CCc1cccc2c(CCNC[C@@H](O)c3ccc(F)cn3)c[nH]c12	ZINC000819048885	EG	On-Demand	Anodyne	ADRB1	16	41
CCc1cccc2c(CCNC[C@@H](O)c3ccc(F)cn3)c[nH]c12	ZINC000819048885	EG	On-Demand	Anodyne	ADRB3	28	46
CCc1cccc2c(CCNC[C@@H](O)c3ccc(F)cn3)c[nH]c12	ZINC000819048885	EG	On-Demand	Anodyne	MPO	48	37
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819048887	GE	On-Demand	Mild	ADRB2	32	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819048887	GE	On-Demand	Mild	ADRB1	53	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819048887	GE	On-Demand	Mild	ADRB3	40	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819048887	GE	On-Demand	Mild	GPR119	39	42
CCc1cccc2c(CCNC[C@H](O)c3ccc(F)cn3)c[nH]c12	ZINC000819048888	EG	On-Demand	Anodyne	ADRB2	18	41
CCc1cccc2c(CCNC[C@H](O)c3ccc(F)cn3)c[nH]c12	ZINC000819048888	EG	On-Demand	Anodyne	ADRB1	16	41
CCc1cccc2c(CCNC[C@H](O)c3ccc(F)cn3)c[nH]c12	ZINC000819048888	EG	On-Demand	Anodyne	ADRB3	28	46
CCc1cccc2c(CCNC[C@H](O)c3ccc(F)cn3)c[nH]c12	ZINC000819048888	EG	On-Demand	Anodyne	MPO	48	37
O=C(Nc1ccc(N2CCCCC2)nc1)C(F)=C1CCC1	ZINC000819048889	CG	On-Demand	Anodyne	DGAT1	40	44
O=C(Nc1ccc(N2CCCCC2)nc1)C(F)=C1CCC1	ZINC000819048889	CG	On-Demand	Anodyne	SLC27A1	38	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819048892	GE	On-Demand	Mild	ADRB2	32	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819048892	GE	On-Demand	Mild	ADRB1	53	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819048892	GE	On-Demand	Mild	ADRB3	40	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819048892	GE	On-Demand	Mild	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819048894	GE	On-Demand	Mild	ADRB2	32	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819048894	GE	On-Demand	Mild	ADRB1	53	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819048894	GE	On-Demand	Mild	ADRB3	40	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819048894	GE	On-Demand	Mild	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819048896	GE	On-Demand	Mild	ADRB2	32	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819048896	GE	On-Demand	Mild	ADRB1	53	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819048896	GE	On-Demand	Mild	ADRB3	40	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819048896	GE	On-Demand	Mild	GPR119	39	42
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1Cl	ZINC000819048913	DH	On-Demand	Anodyne	ADRB2	22	40
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1Cl	ZINC000819048913	DH	On-Demand	Anodyne	CHRM3	19	40
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1Cl	ZINC000819048913	DH	On-Demand	Anodyne	HRH3	33	41
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1Cl	ZINC000819048913	DH	On-Demand	Anodyne	SIGMAR1	26	43
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1Cl	ZINC000819048913	DH	On-Demand	Anodyne	BCHE	16	40
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1Cl	ZINC000819048913	DH	On-Demand	Anodyne	CHRNA7	19	43
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1Cl	ZINC000819048913	DH	On-Demand	Anodyne	HNMT	85	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819048923	GD	On-Demand	Anodyne	EPHX2	15	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819048923	GD	On-Demand	Anodyne	CCR8	54	34
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819048923	GD	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819048925	GD	On-Demand	Anodyne	EPHX2	15	43
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819048925	GD	On-Demand	Anodyne	CCR8	54	34
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819048925	GD	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819048927	GD	On-Demand	Anodyne	EPHX2	15	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819048927	GD	On-Demand	Anodyne	CCR8	54	34
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819048927	GD	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819048930	GD	On-Demand	Anodyne	EPHX2	15	43
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819048930	GD	On-Demand	Anodyne	CCR8	54	34
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819048930	GD	On-Demand	Anodyne	GPR119	36	42
CCc1cccc2c(CCNC[C@H](O)c3ccc([N+](=O)[O-])cc3)c[nH]c12	ZINC000819048941	FH	On-Demand	Bother	ADRB2	36	45
CCc1cccc2c(CCNC[C@H](O)c3ccc([N+](=O)[O-])cc3)c[nH]c12	ZINC000819048941	FH	On-Demand	Bother	ADRB1	29	45
CCc1cccc2c(CCNC[C@H](O)c3ccc([N+](=O)[O-])cc3)c[nH]c12	ZINC000819048941	FH	On-Demand	Bother	ADRB3	46	47
CCc1cccc2c(CCNC[C@@H](O)c3ccc([N+](=O)[O-])cc3)c[nH]c12	ZINC000819048944	FH	On-Demand	Bother	ADRB2	36	45
CCc1cccc2c(CCNC[C@@H](O)c3ccc([N+](=O)[O-])cc3)c[nH]c12	ZINC000819048944	FH	On-Demand	Bother	ADRB1	29	45
CCc1cccc2c(CCNC[C@@H](O)c3ccc([N+](=O)[O-])cc3)c[nH]c12	ZINC000819048944	FH	On-Demand	Bother	ADRB3	46	47
COc1cccc([S@@](=O)CC(=O)NC2CCN(CC(N)=O)CC2)c1	ZINC000819048946	FB	On-Demand	Anodyne	DRD4	41	31
COc1cccc([S@@](=O)CC(=O)NC2CCN(CC(N)=O)CC2)c1	ZINC000819048946	FB	On-Demand	Anodyne	MTNR1A	20	45
COc1cccc([S@@](=O)CC(=O)NC2CCN(CC(N)=O)CC2)c1	ZINC000819048946	FB	On-Demand	Anodyne	MTNR1B	25	45
COc1cccc([S@@](=O)CC(=O)NC2CCN(CC(N)=O)CC2)c1	ZINC000819048946	FB	On-Demand	Anodyne	MCHR1	19	44
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(Cl)cc1	ZINC000819048951	DH	On-Demand	Anodyne	ADRB2	32	41
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(Cl)cc1	ZINC000819048951	DH	On-Demand	Anodyne	ADRB1	34	40
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(Cl)cc1	ZINC000819048951	DH	On-Demand	Anodyne	DRD3	18	46
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(Cl)cc1	ZINC000819048951	DH	On-Demand	Anodyne	ADRB3	35	40
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(Cl)cc1	ZINC000819048951	DH	On-Demand	Anodyne	HRH3	25	44
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(Cl)cc1	ZINC000819048951	DH	On-Demand	Anodyne	CHRNA7	15	49
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(Cl)cc1	ZINC000819048951	DH	On-Demand	Anodyne	HNMT	65	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819048954	FE	On-Demand	Anodyne	ADRB2	36	49
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819048954	FE	On-Demand	Anodyne	ADRB3	28	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819048954	FE	On-Demand	Anodyne	ABCB1	44	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819048954	FE	On-Demand	Anodyne	GPR119	45	51
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819048954	FE	On-Demand	Anodyne	SFRP1	51	39
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819048954	FE	On-Demand	Anodyne	WNT3	42	35
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819048956	FE	On-Demand	Anodyne	ADRB2	36	49
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819048956	FE	On-Demand	Anodyne	ADRB3	28	46
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819048956	FE	On-Demand	Anodyne	ABCB1	44	46
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819048956	FE	On-Demand	Anodyne	GPR119	45	51
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819048956	FE	On-Demand	Anodyne	SFRP1	51	39
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819048956	FE	On-Demand	Anodyne	WNT3	42	35
COC(=O)c1cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1F	ZINC000819048959	GG	On-Demand	Mild	PAPA1_CARPA	44	47
COC(=O)c1cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1F	ZINC000819048960	GG	On-Demand	Mild	PAPA1_CARPA	44	47
CON(C)C(=O)CCNCCCCCN1CCCCC1	ZINC000819048961	CD	On-Demand	Anodyne	PAOX	41	43
CC(=O)Nc1cccc(CC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000819048962	GF	On-Demand	Anodyne	AVPR2	33	41
CC(=O)Nc1cccc(CC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000819048962	GF	On-Demand	Anodyne	PTGIR	15	43
CC(=O)Nc1cccc(CC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000819048962	GF	On-Demand	Anodyne	NPY2R	20	41
CC(=O)Nc1cccc(CC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000819048962	GF	On-Demand	Anodyne	PREP	16	47
CC(=O)Nc1cccc(CC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000819048962	GF	On-Demand	Anodyne	TAAR1	30	41
CC(=O)Nc1cccc(CC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000819048962	GF	On-Demand	Anodyne	P2RY14	42	32
CC(=O)Nc1cccc(CC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000819048962	GF	On-Demand	Anodyne	L3MBTL3	70	38
CC(=O)Nc1cccc(CC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC000819048962	GF	On-Demand	Anodyne	NAMPT	24	48
O[C@H](CNCCCCCN1CCCCC1)c1ccc(Br)cc1	ZINC000819048976	FH	On-Demand	Anodyne	HRH3	19	44
O[C@H](CNCCCCCN1CCCCC1)c1ccc(Br)cc1	ZINC000819048976	FH	On-Demand	Anodyne	HNMT	51	36
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(Br)cc1	ZINC000819048977	FH	On-Demand	Anodyne	HRH3	19	44
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(Br)cc1	ZINC000819048977	FH	On-Demand	Anodyne	HNMT	51	36
O=C(Cc1ccc(-n2cnnc2)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819048982	GE	On-Demand	Anodyne	L3MBTL3	56	37
O=C(Cc1ccc(-n2cnnc2)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819048982	GE	On-Demand	Anodyne	NAMPT	21	43
O=C(Cc1ccc(-n2cnnc2)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819048982	GE	On-Demand	Anodyne	RPA1	42	32
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)c(C)c2)c1	ZINC000819048988	FG	On-Demand	Anodyne	DRD4	45	36
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)c(C)c2)c1	ZINC000819048988	FG	On-Demand	Anodyne	KCNQ2	51	42
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)c(C)c2)c1	ZINC000819048988	FG	On-Demand	Anodyne	NPY2R	43	40
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)c(C)c2)c1	ZINC000819048988	FG	On-Demand	Anodyne	MTNR1B	25	40
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)c(C)c2)c1	ZINC000819048988	FG	On-Demand	Anodyne	GALR2	25	41
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)c(C)c2)c1	ZINC000819048988	FG	On-Demand	Anodyne	TAAR1	46	46
CCc1cccc2c(CCNC[C@H](O)c3ccc(C#N)cc3)c[nH]c12	ZINC000819048991	EG	On-Demand	Mild	ADRB2	41	45
CCc1cccc2c(CCNC[C@H](O)c3ccc(C#N)cc3)c[nH]c12	ZINC000819048991	EG	On-Demand	Mild	ADRB1	32	45
CCc1cccc2c(CCNC[C@H](O)c3ccc(C#N)cc3)c[nH]c12	ZINC000819048991	EG	On-Demand	Mild	ADRB3	40	48
CCc1cccc2c(CCNC[C@@H](O)c3ccc(C#N)cc3)c[nH]c12	ZINC000819048992	EG	On-Demand	Mild	ADRB2	41	45
CCc1cccc2c(CCNC[C@@H](O)c3ccc(C#N)cc3)c[nH]c12	ZINC000819048992	EG	On-Demand	Mild	ADRB1	32	45
CCc1cccc2c(CCNC[C@@H](O)c3ccc(C#N)cc3)c[nH]c12	ZINC000819048992	EG	On-Demand	Mild	ADRB3	40	48
CCc1cccc2c(CCNC[C@H](O)c3ccc(F)cc3F)c[nH]c12	ZINC000819048993	EH	On-Demand	Anodyne	ADRB2	57	46
CCc1cccc2c(CCNC[C@H](O)c3ccc(F)cc3F)c[nH]c12	ZINC000819048993	EH	On-Demand	Anodyne	ADRB1	50	46
CCc1cccc2c(CCNC[C@H](O)c3ccc(F)cc3F)c[nH]c12	ZINC000819048993	EH	On-Demand	Anodyne	ADRB3	39	51
CCc1cccc2c(CCNC[C@H](O)c3ccc(F)cc3F)c[nH]c12	ZINC000819048993	EH	On-Demand	Anodyne	MPO	86	42
CCc1cccc2c(CCNC[C@@H](O)c3ccc(F)cc3F)c[nH]c12	ZINC000819048994	EH	On-Demand	Anodyne	ADRB2	57	46
CCc1cccc2c(CCNC[C@@H](O)c3ccc(F)cc3F)c[nH]c12	ZINC000819048994	EH	On-Demand	Anodyne	ADRB1	50	46
CCc1cccc2c(CCNC[C@@H](O)c3ccc(F)cc3F)c[nH]c12	ZINC000819048994	EH	On-Demand	Anodyne	ADRB3	39	51
CCc1cccc2c(CCNC[C@@H](O)c3ccc(F)cc3F)c[nH]c12	ZINC000819048994	EH	On-Demand	Anodyne	MPO	86	42
CCc1cccc2c(CCNC[C@@H](O)c3c(F)cccc3F)c[nH]c12	ZINC000819049001	EH	On-Demand	Anodyne	ADRB2	23	44
CCc1cccc2c(CCNC[C@@H](O)c3c(F)cccc3F)c[nH]c12	ZINC000819049001	EH	On-Demand	Anodyne	ADRB1	23	44
CCc1cccc2c(CCNC[C@@H](O)c3c(F)cccc3F)c[nH]c12	ZINC000819049001	EH	On-Demand	Anodyne	ADRB3	28	48
CCc1cccc2c(CCNC[C@@H](O)c3c(F)cccc3F)c[nH]c12	ZINC000819049001	EH	On-Demand	Anodyne	MPO	38	41
CCc1cccc2c(CCNC[C@H](O)c3c(F)cccc3F)c[nH]c12	ZINC000819049002	EH	On-Demand	Anodyne	ADRB2	23	44
CCc1cccc2c(CCNC[C@H](O)c3c(F)cccc3F)c[nH]c12	ZINC000819049002	EH	On-Demand	Anodyne	ADRB1	23	44
CCc1cccc2c(CCNC[C@H](O)c3c(F)cccc3F)c[nH]c12	ZINC000819049002	EH	On-Demand	Anodyne	ADRB3	28	48
CCc1cccc2c(CCNC[C@H](O)c3c(F)cccc3F)c[nH]c12	ZINC000819049002	EH	On-Demand	Anodyne	MPO	38	41
O=C(/C=C\[C@@H]1CCCO1)NCCCCc1ccccc1	ZINC000819049029	CF	On-Demand	Anodyne	FKBP1A	15	42
O=C(/C=C\[C@@H]1CCCO1)NCCCCc1ccccc1	ZINC000819049029	CF	On-Demand	Anodyne	AMP1_PLAFQ	20	40
O=C(/C=C/[C@H]1CCCO1)NCCCCc1ccccc1	ZINC000819049030	CF	On-Demand	Anodyne	FKBP1A	15	42
O=C(/C=C/[C@H]1CCCO1)NCCCCc1ccccc1	ZINC000819049030	CF	On-Demand	Anodyne	AMP1_PLAFQ	20	40
O=C(/C=C/[C@@H]1CCCO1)NCCCCc1ccccc1	ZINC000819049031	CF	On-Demand	Anodyne	FKBP1A	15	42
O=C(/C=C/[C@@H]1CCCO1)NCCCCc1ccccc1	ZINC000819049031	CF	On-Demand	Anodyne	AMP1_PLAFQ	20	40
O=C(/C=C\[C@H]1CCCO1)NCCCCc1ccccc1	ZINC000819049032	CF	On-Demand	Anodyne	FKBP1A	15	42
O=C(/C=C\[C@H]1CCCO1)NCCCCc1ccccc1	ZINC000819049032	CF	On-Demand	Anodyne	AMP1_PLAFQ	20	40
CON(C)C(=O)CCNCCCc1cccc(F)c1	ZINC000819049034	CD	On-Demand	Anodyne	NOS1	15	40
CON(C)C(=O)CCNCCCc1cccc(F)c1	ZINC000819049034	CD	On-Demand	Anodyne	CRTM	44	34
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2cccc(F)c2)c1	ZINC000819049048	DF	On-Demand	Bother	ADRB2	47	38
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2cccc(F)c2)c1	ZINC000819049048	DF	On-Demand	Bother	ADRB1	45	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2cccc(F)c2)c1	ZINC000819049048	DF	On-Demand	Bother	ADRB3	57	43
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2cccc(F)c2)c1	ZINC000819049049	DF	On-Demand	Bother	ADRB2	47	38
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2cccc(F)c2)c1	ZINC000819049049	DF	On-Demand	Bother	ADRB1	45	42
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2cccc(F)c2)c1	ZINC000819049049	DF	On-Demand	Bother	ADRB3	57	43
O[C@@H](CNCCCc1cccc(F)c1)c1cccc(F)c1	ZINC000819049072	CG	On-Demand	Anodyne	ADRB2	68	42
O[C@@H](CNCCCc1cccc(F)c1)c1cccc(F)c1	ZINC000819049072	CG	On-Demand	Anodyne	ADRB1	57	47
O[C@@H](CNCCCc1cccc(F)c1)c1cccc(F)c1	ZINC000819049072	CG	On-Demand	Anodyne	ADRB3	73	47
O[C@@H](CNCCCc1cccc(F)c1)c1cccc(F)c1	ZINC000819049072	CG	On-Demand	Anodyne	NOS1	15	44
O[C@H](CNCCCc1cccc(F)c1)c1cccc(F)c1	ZINC000819049073	CG	On-Demand	Anodyne	ADRB2	68	42
O[C@H](CNCCCc1cccc(F)c1)c1cccc(F)c1	ZINC000819049073	CG	On-Demand	Anodyne	ADRB1	57	47
O[C@H](CNCCCc1cccc(F)c1)c1cccc(F)c1	ZINC000819049073	CG	On-Demand	Anodyne	ADRB3	73	47
O[C@H](CNCCCc1cccc(F)c1)c1cccc(F)c1	ZINC000819049073	CG	On-Demand	Anodyne	NOS1	15	44
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@@H]2CCOc3ccc(F)cc32)CC1	ZINC000819049075	GG	On-Demand	Anodyne	GPR119	26	45
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@H]2CCOc3ccc(F)cc32)CC1	ZINC000819049076	GG	On-Demand	Anodyne	GPR119	26	45
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@@H]2CCOc3ccc(F)cc32)CC1	ZINC000819049077	GG	On-Demand	Anodyne	GPR119	26	45
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@H]2CCOc3ccc(F)cc32)CC1	ZINC000819049078	GG	On-Demand	Anodyne	GPR119	26	45
NC(=O)Nc1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819049120	CD	On-Demand	Anodyne	KCNK3	66	36
NC(=O)Nc1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819049121	CD	On-Demand	Anodyne	KCNK3	66	36
NC(=O)Nc1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819049122	CD	On-Demand	Anodyne	KCNK3	66	36
NC(=O)Nc1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819049123	CD	On-Demand	Anodyne	KCNK3	66	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(N2CCCCC2)nc1	ZINC000819049151	FF	On-Demand	Anodyne	DGAT1	39	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819049153	FE	On-Demand	Anodyne	ADRB2	36	49
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819049153	FE	On-Demand	Anodyne	ADRB3	28	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819049153	FE	On-Demand	Anodyne	ABCB1	44	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819049153	FE	On-Demand	Anodyne	GPR119	45	51
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819049153	FE	On-Demand	Anodyne	SFRP1	51	39
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819049153	FE	On-Demand	Anodyne	WNT3	42	35
COc1ccc(OC)c([C@H](O)CNCCc2ccc(C)nc2)c1	ZINC000819049154	DE	On-Demand	Anodyne	ADRB2	58	54
COc1ccc(OC)c([C@H](O)CNCCc2ccc(C)nc2)c1	ZINC000819049154	DE	On-Demand	Anodyne	ADRB1	67	43
COc1ccc(OC)c([C@H](O)CNCCc2ccc(C)nc2)c1	ZINC000819049154	DE	On-Demand	Anodyne	ADRB3	76	43
COC(=O)c1cc(NC(=O)C(F)=C2CCC2)ccc1F	ZINC000819049155	CF	On-Demand	Anodyne	DHODH	23	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819049156	FE	On-Demand	Anodyne	ADRB2	36	49
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819049156	FE	On-Demand	Anodyne	ADRB3	28	46
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819049156	FE	On-Demand	Anodyne	ABCB1	44	46
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819049156	FE	On-Demand	Anodyne	GPR119	45	51
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819049156	FE	On-Demand	Anodyne	SFRP1	51	39
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819049156	FE	On-Demand	Anodyne	WNT3	42	35
CC(C)(C)OC(=O)N1CCN(C(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819049173	FE	On-Demand	Anodyne	GPR119	41	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1csc(-c2ccccc2)n1	ZINC000819049178	FG	On-Demand	Anodyne	PDE8B	45	32
O[C@H](CNCCCCCN1CCCCC1)c1ccc(C(F)(F)F)cc1	ZINC000819049181	FH	On-Demand	Anodyne	HRH3	15	47
O[C@H](CNCCCCCN1CCCCC1)c1ccc(C(F)(F)F)cc1	ZINC000819049181	FH	On-Demand	Anodyne	HNMT	41	34
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(C(F)(F)F)cc1	ZINC000819049183	FH	On-Demand	Anodyne	HRH3	15	47
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(C(F)(F)F)cc1	ZINC000819049183	FH	On-Demand	Anodyne	HNMT	41	34
CCc1cccc2c(CCNC[C@H](O)CN(C)C(=O)OC(C)(C)C)c[nH]c12	ZINC000819049190	GG	On-Demand	Anodyne	ADRB3	19	40
CCc1cccc2c(CCNC[C@@H](O)CN(C)C(=O)OC(C)(C)C)c[nH]c12	ZINC000819049192	GG	On-Demand	Anodyne	ADRB3	19	40
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1Br	ZINC000819049201	FH	On-Demand	Anodyne	HRH3	27	40
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1Br	ZINC000819049201	FH	On-Demand	Anodyne	CHRNA7	16	43
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1Br	ZINC000819049201	FH	On-Demand	Anodyne	HNMT	77	40
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1Br	ZINC000819049202	FH	On-Demand	Anodyne	HRH3	27	40
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1Br	ZINC000819049202	FH	On-Demand	Anodyne	CHRNA7	16	43
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1Br	ZINC000819049202	FH	On-Demand	Anodyne	HNMT	77	40
CC(=O)Nc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819049204	GF	On-Demand	Mild	PAPA1_CARPA	59	52
CC(=O)Nc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819049204	GF	On-Demand	Mild	CTSK	21	47
CC(=O)Nc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819049204	GF	On-Demand	Mild	CTSL	15	52
CC(=O)Nc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819049204	GF	On-Demand	Mild	FURIN	52	36
CC(=O)Nc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819049204	GF	On-Demand	Mild	FPR1	44	38
CC(=O)Nc1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819049205	GF	On-Demand	Mild	PAPA1_CARPA	59	52
CC(=O)Nc1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819049205	GF	On-Demand	Mild	CTSK	21	47
CC(=O)Nc1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819049205	GF	On-Demand	Mild	CTSL	15	52
CC(=O)Nc1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819049205	GF	On-Demand	Mild	FURIN	52	36
CC(=O)Nc1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819049205	GF	On-Demand	Mild	FPR1	44	38
NC(=O)CN1CCC(NC(=O)Cc2noc3ccc(Br)cc23)CC1	ZINC000819049209	GD	On-Demand	Anodyne	SIGMAR1	15	45
NC(=O)CN1CCC(NC(=O)Cc2noc3ccc(Br)cc23)CC1	ZINC000819049209	GD	On-Demand	Anodyne	MCHR1	17	43
CCc1cccc2c(CCNC[C@H](O)c3ccccc3F)c[nH]c12	ZINC000819049211	EH	On-Demand	Anodyne	ADRB2	44	45
CCc1cccc2c(CCNC[C@H](O)c3ccccc3F)c[nH]c12	ZINC000819049211	EH	On-Demand	Anodyne	ADRB1	34	44
CCc1cccc2c(CCNC[C@H](O)c3ccccc3F)c[nH]c12	ZINC000819049211	EH	On-Demand	Anodyne	ADRB3	30	47
CCc1cccc2c(CCNC[C@H](O)c3ccccc3F)c[nH]c12	ZINC000819049211	EH	On-Demand	Anodyne	MPO	33	42
CCc1cccc2c(CCNC[C@@H](O)c3ccccc3F)c[nH]c12	ZINC000819049213	EH	On-Demand	Anodyne	ADRB2	44	45
CCc1cccc2c(CCNC[C@@H](O)c3ccccc3F)c[nH]c12	ZINC000819049213	EH	On-Demand	Anodyne	ADRB1	34	44
CCc1cccc2c(CCNC[C@@H](O)c3ccccc3F)c[nH]c12	ZINC000819049213	EH	On-Demand	Anodyne	ADRB3	30	47
CCc1cccc2c(CCNC[C@@H](O)c3ccccc3F)c[nH]c12	ZINC000819049213	EH	On-Demand	Anodyne	MPO	33	42
CCc1cccc2c(CCNC[C@H](O)c3cc(F)ccc3F)c[nH]c12	ZINC000819049219	EH	On-Demand	Anodyne	ADRB2	43	44
CCc1cccc2c(CCNC[C@H](O)c3cc(F)ccc3F)c[nH]c12	ZINC000819049219	EH	On-Demand	Anodyne	ADRB1	40	44
CCc1cccc2c(CCNC[C@H](O)c3cc(F)ccc3F)c[nH]c12	ZINC000819049219	EH	On-Demand	Anodyne	ADRB3	37	51
CCc1cccc2c(CCNC[C@H](O)c3cc(F)ccc3F)c[nH]c12	ZINC000819049219	EH	On-Demand	Anodyne	MPO	85	39
CCc1cccc2c(CCNC[C@@H](O)c3cc(F)ccc3F)c[nH]c12	ZINC000819049220	EH	On-Demand	Anodyne	ADRB2	43	44
CCc1cccc2c(CCNC[C@@H](O)c3cc(F)ccc3F)c[nH]c12	ZINC000819049220	EH	On-Demand	Anodyne	ADRB1	40	44
CCc1cccc2c(CCNC[C@@H](O)c3cc(F)ccc3F)c[nH]c12	ZINC000819049220	EH	On-Demand	Anodyne	ADRB3	37	51
CCc1cccc2c(CCNC[C@@H](O)c3cc(F)ccc3F)c[nH]c12	ZINC000819049220	EH	On-Demand	Anodyne	MPO	85	39
N#Cc1ccc([C@@H](O)CNCCCCCN2CCCCC2)cc1	ZINC000819049223	DF	On-Demand	Mild	ADRB2	21	40
N#Cc1ccc([C@@H](O)CNCCCCCN2CCCCC2)cc1	ZINC000819049223	DF	On-Demand	Mild	HRH3	24	51
N#Cc1ccc([C@@H](O)CNCCCCCN2CCCCC2)cc1	ZINC000819049223	DF	On-Demand	Mild	HNMT	41	34
N#Cc1ccc([C@H](O)CNCCCCCN2CCCCC2)cc1	ZINC000819049225	DF	On-Demand	Mild	ADRB2	21	40
N#Cc1ccc([C@H](O)CNCCCCCN2CCCCC2)cc1	ZINC000819049225	DF	On-Demand	Mild	HRH3	24	51
N#Cc1ccc([C@H](O)CNCCCCCN2CCCCC2)cc1	ZINC000819049225	DF	On-Demand	Mild	HNMT	41	34
CCc1cccc2c(CCNC[C@H](O)c3ccc(F)cc3)c[nH]c12	ZINC000819049244	EH	On-Demand	Anodyne	ADRB2	58	44
CCc1cccc2c(CCNC[C@H](O)c3ccc(F)cc3)c[nH]c12	ZINC000819049244	EH	On-Demand	Anodyne	ADRB1	46	49
CCc1cccc2c(CCNC[C@H](O)c3ccc(F)cc3)c[nH]c12	ZINC000819049244	EH	On-Demand	Anodyne	ADRB3	62	54
CCc1cccc2c(CCNC[C@H](O)c3ccc(F)cc3)c[nH]c12	ZINC000819049244	EH	On-Demand	Anodyne	MPO	68	41
CCc1cccc2c(CCNC[C@@H](O)c3ccc(F)cc3)c[nH]c12	ZINC000819049246	EH	On-Demand	Anodyne	ADRB2	58	44
CCc1cccc2c(CCNC[C@@H](O)c3ccc(F)cc3)c[nH]c12	ZINC000819049246	EH	On-Demand	Anodyne	ADRB1	46	49
CCc1cccc2c(CCNC[C@@H](O)c3ccc(F)cc3)c[nH]c12	ZINC000819049246	EH	On-Demand	Anodyne	ADRB3	62	54
CCc1cccc2c(CCNC[C@@H](O)c3ccc(F)cc3)c[nH]c12	ZINC000819049246	EH	On-Demand	Anodyne	MPO	68	41
O[C@@H](CN[C@H]1CCCN(Cc2c(F)cccc2F)C1)c1ccc(F)cc1	ZINC000819049252	FG	On-Demand	Anodyne	SLC6A3	19	44
O[C@H](CN[C@H]1CCCN(Cc2c(F)cccc2F)C1)c1ccc(F)cc1	ZINC000819049253	FG	On-Demand	Anodyne	SLC6A3	19	44
O[C@H](CN[C@@H]1CCCN(Cc2c(F)cccc2F)C1)c1ccc(F)cc1	ZINC000819049254	FG	On-Demand	Anodyne	SLC6A3	19	44
O[C@@H](CN[C@@H]1CCCN(Cc2c(F)cccc2F)C1)c1ccc(F)cc1	ZINC000819049256	FG	On-Demand	Anodyne	SLC6A3	19	44
O=C(CN1CCN(C(=O)C(F)=C2CCC2)CC1)Nc1ccccc1	ZINC000819049258	EE	On-Demand	Anodyne	SLC27A1	40	38
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819049276	FF	On-Demand	Anodyne	ADRB2	22	42
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819049276	FF	On-Demand	Anodyne	ADRB1	19	42
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819049276	FF	On-Demand	Anodyne	ABCB1	18	40
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819049276	FF	On-Demand	Anodyne	GPR119	36	41
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819049277	FF	On-Demand	Anodyne	ADRB2	22	42
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819049277	FF	On-Demand	Anodyne	ADRB1	19	42
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819049277	FF	On-Demand	Anodyne	ABCB1	18	40
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819049277	FF	On-Demand	Anodyne	GPR119	36	41
Cc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819049279	FF	On-Demand	Anodyne	ADRB2	22	42
Cc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819049279	FF	On-Demand	Anodyne	ADRB1	19	42
Cc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819049279	FF	On-Demand	Anodyne	ABCB1	18	40
Cc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819049279	FF	On-Demand	Anodyne	GPR119	36	41
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819049282	FF	On-Demand	Anodyne	ADRB2	22	42
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819049282	FF	On-Demand	Anodyne	ADRB1	19	42
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819049282	FF	On-Demand	Anodyne	ABCB1	18	40
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819049282	FF	On-Demand	Anodyne	GPR119	36	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccc(Cl)cc2)C1	ZINC000819049284	GF	On-Demand	Anodyne	GPR119	38	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccc(Cl)cc2)C1	ZINC000819049285	GF	On-Demand	Anodyne	GPR119	38	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COCc2ccc(Cl)cc2)C1	ZINC000819049286	GF	On-Demand	Anodyne	GPR119	38	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccc(Cl)cc2)C1	ZINC000819049287	GF	On-Demand	Anodyne	GPR119	38	40
CON(C)C(=O)CCNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000819049293	EE	On-Demand	Anodyne	DRD2	24	48
CON(C)C(=O)CCNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000819049293	EE	On-Demand	Anodyne	DRD3	16	46
CON(C)C(=O)CCNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000819049293	EE	On-Demand	Anodyne	SLC6A3	28	46
CON(C)C(=O)CCNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000819049293	EE	On-Demand	Anodyne	KCNH2	28	41
CON(C)C(=O)CCNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000819049293	EE	On-Demand	Anodyne	SIGMAR1	22	46
CON(C)C(=O)CCNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000819049293	EE	On-Demand	Anodyne	ACHP_LYMST	22	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819049305	ED	On-Demand	Anodyne	GPR119	55	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819049306	ED	On-Demand	Anodyne	GPR119	55	44
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819049307	ED	On-Demand	Anodyne	GPR119	55	44
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819049308	ED	On-Demand	Anodyne	GPR119	55	44
CC(C)(C)OC(=O)N1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819049309	FD	On-Demand	Anodyne	GPR119	51	47
CC(C)(C)OC(=O)N1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819049309	FD	On-Demand	Anodyne	KCNJ1	64	42
O[C@@H](CNCCCc1cccc(F)c1)c1ccc(F)c(F)c1	ZINC000819049312	DG	On-Demand	Anodyne	ADRB2	60	42
O[C@@H](CNCCCc1cccc(F)c1)c1ccc(F)c(F)c1	ZINC000819049312	DG	On-Demand	Anodyne	ADRB1	45	44
O[C@@H](CNCCCc1cccc(F)c1)c1ccc(F)c(F)c1	ZINC000819049312	DG	On-Demand	Anodyne	ADRB3	49	44
O[C@H](CNCCCc1cccc(F)c1)c1ccc(F)c(F)c1	ZINC000819049313	DG	On-Demand	Anodyne	ADRB2	60	42
O[C@H](CNCCCc1cccc(F)c1)c1ccc(F)c(F)c1	ZINC000819049313	DG	On-Demand	Anodyne	ADRB1	45	44
O[C@H](CNCCCc1cccc(F)c1)c1ccc(F)c(F)c1	ZINC000819049313	DG	On-Demand	Anodyne	ADRB3	49	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(SCc2cccnc2)cc1	ZINC000819049326	GI	On-Demand	Anodyne	NAMPT	50	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(CCc3ccccc3)CC1)C2	ZINC000819049332	GE	On-Demand	Anodyne	OPRM1	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(CCc3ccccc3)CC1)C2	ZINC000819049332	GE	On-Demand	Anodyne	SIGMAR1	40	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(CCc3ccccc3)CC1)C2	ZINC000819049332	GE	On-Demand	Anodyne	PREP	50	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(CCc3ccccc3)CC1)C2	ZINC000819049333	GE	On-Demand	Anodyne	OPRM1	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(CCc3ccccc3)CC1)C2	ZINC000819049333	GE	On-Demand	Anodyne	SIGMAR1	40	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(CCc3ccccc3)CC1)C2	ZINC000819049333	GE	On-Demand	Anodyne	PREP	50	36
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1cccnc1	ZINC000819049347	FG	On-Demand	Anodyne	ADRB2	48	50
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1cccnc1	ZINC000819049347	FG	On-Demand	Anodyne	ADRB1	53	46
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1cccnc1	ZINC000819049347	FG	On-Demand	Anodyne	ACHE	21	69
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1cccnc1	ZINC000819049347	FG	On-Demand	Anodyne	SLC6A3	19	48
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1cccnc1	ZINC000819049347	FG	On-Demand	Anodyne	GRIN2B	63	45
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1cccnc1	ZINC000819049347	FG	On-Demand	Anodyne	ADRB3	128	50
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1cccnc1	ZINC000819049347	FG	On-Demand	Anodyne	PTAFR	17	41
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1cccnc1	ZINC000819049347	FG	On-Demand	Anodyne	SIGMAR1	25	48
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1cccnc1	ZINC000819049347	FG	On-Demand	Anodyne	CCR3	38	51
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1cccnc1	ZINC000819049348	FG	On-Demand	Anodyne	ADRB2	48	50
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1cccnc1	ZINC000819049348	FG	On-Demand	Anodyne	ADRB1	53	46
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1cccnc1	ZINC000819049348	FG	On-Demand	Anodyne	ACHE	21	69
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1cccnc1	ZINC000819049348	FG	On-Demand	Anodyne	SLC6A3	19	48
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1cccnc1	ZINC000819049348	FG	On-Demand	Anodyne	GRIN2B	63	45
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1cccnc1	ZINC000819049348	FG	On-Demand	Anodyne	ADRB3	128	50
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1cccnc1	ZINC000819049348	FG	On-Demand	Anodyne	PTAFR	17	41
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1cccnc1	ZINC000819049348	FG	On-Demand	Anodyne	SIGMAR1	25	48
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1cccnc1	ZINC000819049348	FG	On-Demand	Anodyne	CCR3	38	51
O[C@@H](CNCCCc1cccc(F)c1)c1ccccc1F	ZINC000819049355	CG	On-Demand	Anodyne	ADRB2	64	42
O[C@@H](CNCCCc1cccc(F)c1)c1ccccc1F	ZINC000819049355	CG	On-Demand	Anodyne	ADRB1	45	42
O[C@H](CNCCCc1cccc(F)c1)c1ccccc1F	ZINC000819049356	CG	On-Demand	Anodyne	ADRB2	64	42
O[C@H](CNCCCc1cccc(F)c1)c1ccccc1F	ZINC000819049356	CG	On-Demand	Anodyne	ADRB1	45	42
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(SCc2cccnc2)cc1	ZINC000819049378	EI	On-Demand	Anodyne	CHRNA7	40	39
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(SCc2cccnc2)cc1	ZINC000819049378	EI	On-Demand	Anodyne	NAMPT	40	38
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(SCc2cccnc2)cc1	ZINC000819049379	EI	On-Demand	Anodyne	CHRNA7	40	39
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(SCc2cccnc2)cc1	ZINC000819049379	EI	On-Demand	Anodyne	NAMPT	40	38
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(SCc2cccnc2)cc1	ZINC000819049380	EI	On-Demand	Anodyne	CHRNA7	40	39
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(SCc2cccnc2)cc1	ZINC000819049380	EI	On-Demand	Anodyne	NAMPT	40	38
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(SCc2cccnc2)cc1	ZINC000819049381	EI	On-Demand	Anodyne	CHRNA7	40	39
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(SCc2cccnc2)cc1	ZINC000819049381	EI	On-Demand	Anodyne	NAMPT	40	38
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819049382	GH	On-Demand	Anodyne	DRD2	16	44
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819049382	GH	On-Demand	Anodyne	ACHE	17	53
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819049382	GH	On-Demand	Anodyne	HTR2A	19	52
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819049382	GH	On-Demand	Anodyne	SLC6A3	20	40
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819049382	GH	On-Demand	Anodyne	GRIN2B	63	42
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819049382	GH	On-Demand	Anodyne	HTR7	17	42
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819049382	GH	On-Demand	Anodyne	SIGMAR1	33	46
O[C@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819049382	GH	On-Demand	Anodyne	CCR3	70	55
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819049383	GH	On-Demand	Anodyne	DRD2	16	44
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819049383	GH	On-Demand	Anodyne	ACHE	17	53
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819049383	GH	On-Demand	Anodyne	HTR2A	19	52
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819049383	GH	On-Demand	Anodyne	SLC6A3	20	40
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819049383	GH	On-Demand	Anodyne	GRIN2B	63	42
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819049383	GH	On-Demand	Anodyne	HTR7	17	42
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819049383	GH	On-Demand	Anodyne	SIGMAR1	33	46
O[C@@H](CNCCCCN1CCC(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819049383	GH	On-Demand	Anodyne	CCR3	70	55
O=S(=O)(CCNC[C@H](O)c1cccnc1)NCC1CCC1	ZINC000819049401	DC	On-Demand	Anodyne	ADRB2	29	46
O=S(=O)(CCNC[C@H](O)c1cccnc1)NCC1CCC1	ZINC000819049401	DC	On-Demand	Anodyne	ADRB1	36	47
O=S(=O)(CCNC[C@H](O)c1cccnc1)NCC1CCC1	ZINC000819049401	DC	On-Demand	Anodyne	ADRB3	119	52
O=S(=O)(CCNC[C@@H](O)c1cccnc1)NCC1CCC1	ZINC000819049402	DC	On-Demand	Anodyne	ADRB2	29	46
O=S(=O)(CCNC[C@@H](O)c1cccnc1)NCC1CCC1	ZINC000819049402	DC	On-Demand	Anodyne	ADRB1	36	47
O=S(=O)(CCNC[C@@H](O)c1cccnc1)NCC1CCC1	ZINC000819049402	DC	On-Demand	Anodyne	ADRB3	119	52
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000819049418	GG	On-Demand	Anodyne	PIK3CA	48	38
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000819049418	GG	On-Demand	Anodyne	MTOR	107	38
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000819049419	GG	On-Demand	Anodyne	PIK3CA	48	38
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000819049419	GG	On-Demand	Anodyne	MTOR	107	38
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000819049420	GG	On-Demand	Anodyne	PIK3CA	48	38
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000819049420	GG	On-Demand	Anodyne	MTOR	107	38
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000819049421	GG	On-Demand	Anodyne	PIK3CA	48	38
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000819049421	GG	On-Demand	Anodyne	MTOR	107	38
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccc(OCCN3CCCC3)cc2)c1	ZINC000819049422	GF	On-Demand	Bother	ESR1	76	38
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccc(OCCN3CCCC3)cc2)c1	ZINC000819049422	GF	On-Demand	Bother	HRH2	16	41
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccc(OCCN3CCCC3)cc2)c1	ZINC000819049422	GF	On-Demand	Bother	ESR2	53	38
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccc(OCCN3CCCC3)cc2)c1	ZINC000819049422	GF	On-Demand	Bother	LTA4H	53	58
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccc(OCCN3CCCC3)cc2)c1	ZINC000819049422	GF	On-Demand	Bother	HRH3	46	40
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccc(OCCN3CCCC3)cc2)c1	ZINC000819049422	GF	On-Demand	Bother	PSMB2	41	41
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccc(OCCN3CCCC3)cc2)c1	ZINC000819049422	GF	On-Demand	Bother	PSMB1	45	41
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccc(OCCN3CCCC3)cc2)c1	ZINC000819049423	GF	On-Demand	Bother	ESR1	76	38
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccc(OCCN3CCCC3)cc2)c1	ZINC000819049423	GF	On-Demand	Bother	HRH2	16	41
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccc(OCCN3CCCC3)cc2)c1	ZINC000819049423	GF	On-Demand	Bother	ESR2	53	38
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccc(OCCN3CCCC3)cc2)c1	ZINC000819049423	GF	On-Demand	Bother	LTA4H	53	58
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccc(OCCN3CCCC3)cc2)c1	ZINC000819049423	GF	On-Demand	Bother	HRH3	46	40
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccc(OCCN3CCCC3)cc2)c1	ZINC000819049423	GF	On-Demand	Bother	PSMB2	41	41
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccc(OCCN3CCCC3)cc2)c1	ZINC000819049423	GF	On-Demand	Bother	PSMB1	45	41
CCc1cccc2c(CCNC[C@H](O)C3CC3)c[nH]c12	ZINC000819049433	CF	On-Demand	Anodyne	ADRB3	17	43
CCc1cccc2c(CCNC[C@@H](O)C3CC3)c[nH]c12	ZINC000819049434	CF	On-Demand	Anodyne	ADRB3	17	43
Cc1cc(F)ccc1[C@@H](O)CNCCCCCN1CCCCC1	ZINC000819049446	DG	On-Demand	Anodyne	ADRB2	18	40
Cc1cc(F)ccc1[C@@H](O)CNCCCCCN1CCCCC1	ZINC000819049446	DG	On-Demand	Anodyne	CHRNA7	15	42
Cc1cc(F)ccc1[C@@H](O)CNCCCCCN1CCCCC1	ZINC000819049446	DG	On-Demand	Anodyne	HNMT	48	38
CCc1cccc2c(CCNC[C@@H](O)c3cccnc3)c[nH]c12	ZINC000819049452	DF	On-Demand	Anodyne	ADRB2	51	47
CCc1cccc2c(CCNC[C@@H](O)c3cccnc3)c[nH]c12	ZINC000819049452	DF	On-Demand	Anodyne	ADRB1	59	47
CCc1cccc2c(CCNC[C@@H](O)c3cccnc3)c[nH]c12	ZINC000819049452	DF	On-Demand	Anodyne	ADRB3	148	54
CCc1cccc2c(CCNC[C@H](O)c3cccnc3)c[nH]c12	ZINC000819049453	DF	On-Demand	Anodyne	ADRB2	51	47
CCc1cccc2c(CCNC[C@H](O)c3cccnc3)c[nH]c12	ZINC000819049453	DF	On-Demand	Anodyne	ADRB1	59	47
CCc1cccc2c(CCNC[C@H](O)c3cccnc3)c[nH]c12	ZINC000819049453	DF	On-Demand	Anodyne	ADRB3	148	54
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2nc(-c3cccs3)no2)CC1	ZINC000819049464	FE	On-Demand	Anodyne	ETHR	57	49
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2nc(-c3cccs3)no2)CC1	ZINC000819049465	FE	On-Demand	Anodyne	ETHR	57	49
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2nc(-c3cccs3)no2)CC1	ZINC000819049466	FE	On-Demand	Anodyne	ETHR	57	49
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2nc(-c3cccs3)no2)CC1	ZINC000819049467	FE	On-Demand	Anodyne	ETHR	57	49
NS(=O)(=O)Cc1ccc(NC(=O)C(F)=C2CCC2)cc1	ZINC000819049468	CD	On-Demand	Anodyne	CA2	31	46
NS(=O)(=O)Cc1ccc(NC(=O)C(F)=C2CCC2)cc1	ZINC000819049468	CD	On-Demand	Anodyne	CA1	35	46
NS(=O)(=O)Cc1ccc(NC(=O)C(F)=C2CCC2)cc1	ZINC000819049468	CD	On-Demand	Anodyne	CA7	17	46
NS(=O)(=O)Cc1ccc(NC(=O)C(F)=C2CCC2)cc1	ZINC000819049468	CD	On-Demand	Anodyne	CA14	15	46
NS(=O)(=O)Cc1ccc(NC(=O)C(F)=C2CCC2)cc1	ZINC000819049468	CD	On-Demand	Anodyne	CA12	29	40
NS(=O)(=O)Cc1ccc(NC(=O)C(F)=C2CCC2)cc1	ZINC000819049468	CD	On-Demand	Anodyne	CA9	32	40
NS(=O)(=O)Cc1ccc(NC(=O)C(F)=C2CCC2)cc1	ZINC000819049468	CD	On-Demand	Anodyne	P96878_MYCTU	45	38
O[C@@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819049469	GG	On-Demand	Anodyne	ESR1	88	41
O[C@@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819049469	GG	On-Demand	Anodyne	ESR2	61	41
O[C@@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819049469	GG	On-Demand	Anodyne	LTA4H	60	51
O[C@@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819049469	GG	On-Demand	Anodyne	HRH3	58	49
O[C@@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819049469	GG	On-Demand	Anodyne	PSMB2	45	47
O[C@@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819049469	GG	On-Demand	Anodyne	PSMB1	49	47
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819049470	GG	On-Demand	Anodyne	ESR1	88	41
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819049470	GG	On-Demand	Anodyne	ESR2	61	41
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819049470	GG	On-Demand	Anodyne	LTA4H	60	51
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819049470	GG	On-Demand	Anodyne	HRH3	58	49
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819049470	GG	On-Demand	Anodyne	PSMB2	45	47
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819049470	GG	On-Demand	Anodyne	PSMB1	49	47
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1cc2c(cn1)OCCO2	ZINC000819049479	FE	On-Demand	Anodyne	L3MBTL3	44	36
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1cc2c(cn1)OCCO2	ZINC000819049479	FE	On-Demand	Anodyne	NAMPT	48	42
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819049480	FD	On-Demand	Mild	ADRB1	64	49
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819049481	FD	On-Demand	Mild	ADRB1	64	49
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819049482	FD	On-Demand	Mild	ADRB1	64	49
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819049483	FD	On-Demand	Mild	ADRB1	64	49
CCc1cccc2c(CCNC[C@H](O)c3cc(OC)ccc3OC)c[nH]c12	ZINC000819049492	FH	On-Demand	Anodyne	ADRB2	65	47
CCc1cccc2c(CCNC[C@H](O)c3cc(OC)ccc3OC)c[nH]c12	ZINC000819049492	FH	On-Demand	Anodyne	ADRB1	58	44
CCc1cccc2c(CCNC[C@H](O)c3cc(OC)ccc3OC)c[nH]c12	ZINC000819049492	FH	On-Demand	Anodyne	ADRB3	50	52
CCc1cccc2c(CCNC[C@H](O)c3cc(OC)ccc3OC)c[nH]c12	ZINC000819049492	FH	On-Demand	Anodyne	NQO2	23	40
CCc1cccc2c(CCNC[C@H](O)c3cc(OC)ccc3OC)c[nH]c12	ZINC000819049492	FH	On-Demand	Anodyne	MTNR1A	53	41
CCc1cccc2c(CCNC[C@H](O)c3cc(OC)ccc3OC)c[nH]c12	ZINC000819049492	FH	On-Demand	Anodyne	MTNR1B	36	40
CCc1cccc2c(CCNC[C@@H](O)c3cc(OC)ccc3OC)c[nH]c12	ZINC000819049493	FH	On-Demand	Anodyne	ADRB2	65	47
CCc1cccc2c(CCNC[C@@H](O)c3cc(OC)ccc3OC)c[nH]c12	ZINC000819049493	FH	On-Demand	Anodyne	ADRB1	58	44
CCc1cccc2c(CCNC[C@@H](O)c3cc(OC)ccc3OC)c[nH]c12	ZINC000819049493	FH	On-Demand	Anodyne	ADRB3	50	52
CCc1cccc2c(CCNC[C@@H](O)c3cc(OC)ccc3OC)c[nH]c12	ZINC000819049493	FH	On-Demand	Anodyne	NQO2	23	40
CCc1cccc2c(CCNC[C@@H](O)c3cc(OC)ccc3OC)c[nH]c12	ZINC000819049493	FH	On-Demand	Anodyne	MTNR1A	53	41
CCc1cccc2c(CCNC[C@@H](O)c3cc(OC)ccc3OC)c[nH]c12	ZINC000819049493	FH	On-Demand	Anodyne	MTNR1B	36	40
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819049500	GH	On-Demand	Anodyne	ESR1	101	42
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819049500	GH	On-Demand	Anodyne	KCNH2	15	41
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819049500	GH	On-Demand	Anodyne	ESR2	68	42
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819049500	GH	On-Demand	Anodyne	LTA4H	68	50
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819049500	GH	On-Demand	Anodyne	HRH3	55	45
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819049500	GH	On-Demand	Anodyne	SIGMAR1	15	45
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819049500	GH	On-Demand	Anodyne	TNK2	22	40
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819049500	GH	On-Demand	Anodyne	PSMB2	44	44
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819049500	GH	On-Demand	Anodyne	PSMB1	48	44
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000819049586	FG	On-Demand	Anodyne	EPHX2	35	45
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000819049586	FG	On-Demand	Anodyne	GPR119	39	40
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000819049587	FG	On-Demand	Anodyne	EPHX2	35	45
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000819049587	FG	On-Demand	Anodyne	GPR119	39	40
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(N2CCCCC2)nc1	ZINC000819049600	DF	On-Demand	Anodyne	DGAT1	40	43
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(N2CCCCC2)nc1	ZINC000819049601	DF	On-Demand	Anodyne	DGAT1	40	43
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(N2CCCCC2)nc1	ZINC000819049602	DF	On-Demand	Anodyne	DGAT1	40	43
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(N2CCCCC2)nc1	ZINC000819049604	DF	On-Demand	Anodyne	DGAT1	40	43
C=CCOc1ccccc1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819049605	GG	On-Demand	Mild	GPR119	44	51
CC(C)(C)OC(=O)N1CCN(C(=O)Cc2nsc3ccccc23)CC1	ZINC000819049606	FF	On-Demand	Anodyne	GPR119	44	40
C=CCOc1ccccc1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819049607	GG	On-Demand	Mild	GPR119	44	51
CN1CCN(C)[C@@H](CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819049614	FC	On-Demand	Anodyne	GPR119	27	41
CN1CCN(C)[C@H](CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819049615	FC	On-Demand	Anodyne	GPR119	27	41
CN1CCN(C)[C@@H](CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819049617	FC	On-Demand	Anodyne	GPR119	27	41
CN1CCN(C)[C@H](CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819049618	FC	On-Demand	Anodyne	GPR119	27	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1Cc1ccccc1)C2	ZINC000819049622	FG	On-Demand	Anodyne	PREP	74	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1Cc1ccccc1)C2	ZINC000819049626	FG	On-Demand	Anodyne	PREP	74	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H]1Cc1ccccc1)C2	ZINC000819049627	FG	On-Demand	Anodyne	PREP	74	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H]1Cc1ccccc1)C2	ZINC000819049628	FG	On-Demand	Anodyne	PREP	74	37
C=CCC1(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)CCOCC1	ZINC000819049641	FF	On-Demand	Mild	L3MBTL3	44	34
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)c(F)c1	ZINC000819049645	EG	On-Demand	Anodyne	ADRB2	40	42
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)c(F)c1	ZINC000819049645	EG	On-Demand	Anodyne	HNMT	54	39
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)c(F)c1	ZINC000819049647	EG	On-Demand	Anodyne	ADRB2	40	42
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)c(F)c1	ZINC000819049647	EG	On-Demand	Anodyne	HNMT	54	39
C=C(C)C(C)(C)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819049660	DG	On-Demand	Mild	MLYCD	18	40
C=C(C)C(C)(C)C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819049660	DG	On-Demand	Mild	L3MBTL3	65	38
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1F	ZINC000819049661	EG	On-Demand	Anodyne	ADRB2	17	40
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1F	ZINC000819049661	EG	On-Demand	Anodyne	CHRM3	15	42
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1F	ZINC000819049661	EG	On-Demand	Anodyne	HRH3	17	43
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1F	ZINC000819049661	EG	On-Demand	Anodyne	CHRNA7	17	47
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1F	ZINC000819049661	EG	On-Demand	Anodyne	HNMT	47	37
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1F	ZINC000819049662	EG	On-Demand	Anodyne	ADRB2	17	40
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1F	ZINC000819049662	EG	On-Demand	Anodyne	CHRM3	15	42
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1F	ZINC000819049662	EG	On-Demand	Anodyne	HRH3	17	43
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1F	ZINC000819049662	EG	On-Demand	Anodyne	CHRNA7	17	47
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1F	ZINC000819049662	EG	On-Demand	Anodyne	HNMT	47	37
CCN1CCCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819049667	CF	On-Demand	Anodyne	ADRB1	36	44
CCN1CCCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819049667	CF	On-Demand	Anodyne	ADRB3	56	44
CCN1CCCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819049667	CF	On-Demand	Anodyne	CYP3A4	43	35
CCN1CCCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819049672	CF	On-Demand	Anodyne	ADRB1	36	44
CCN1CCCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819049672	CF	On-Demand	Anodyne	ADRB3	56	44
CCN1CCCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819049672	CF	On-Demand	Anodyne	CYP3A4	43	35
NC(=O)CN1CCC(NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819049676	FD	On-Demand	Anodyne	DRD4	23	41
NC(=O)CN1CCC(NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819049676	FD	On-Demand	Anodyne	SIGMAR1	18	43
NC(=O)CN1CCC(NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819049676	FD	On-Demand	Anodyne	CCR3	23	41
NC(=O)CN1CCC(NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819049676	FD	On-Demand	Anodyne	MCHR1	19	41
N#Cc1ccc([C@@H](O)CN[C@@H]2CCCN(Cc3ccc(F)cc3Cl)C2)cc1	ZINC000819049677	GH	On-Demand	Mild	CCR3	18	42
N#Cc1ccc([C@@H](O)CN[C@H]2CCCN(Cc3ccc(F)cc3Cl)C2)cc1	ZINC000819049681	GH	On-Demand	Mild	CCR3	18	42
N#Cc1ccc([C@H](O)CN[C@H]2CCCN(Cc3ccc(F)cc3Cl)C2)cc1	ZINC000819049684	GH	On-Demand	Mild	CCR3	18	42
N#Cc1ccc([C@H](O)CN[C@@H]2CCCN(Cc3ccc(F)cc3Cl)C2)cc1	ZINC000819049688	GH	On-Demand	Mild	CCR3	18	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819049691	EG	On-Demand	Anodyne	GPR119	35	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819049691	EG	On-Demand	Anodyne	SFRP1	90	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819049691	EG	On-Demand	Anodyne	WNT3	66	36
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819049693	EG	On-Demand	Anodyne	GPR119	35	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819049693	EG	On-Demand	Anodyne	SFRP1	90	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819049693	EG	On-Demand	Anodyne	WNT3	66	36
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819049707	GD	On-Demand	Mild	ADRB2	19	42
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819049707	GD	On-Demand	Mild	ADRB1	60	42
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819049709	GD	On-Demand	Mild	ADRB2	19	42
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819049709	GD	On-Demand	Mild	ADRB1	60	42
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819049710	GD	On-Demand	Mild	ADRB2	19	42
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819049710	GD	On-Demand	Mild	ADRB1	60	42
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819049711	GD	On-Demand	Mild	ADRB2	19	42
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819049711	GD	On-Demand	Mild	ADRB1	60	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCCN2CCCCC2)cc1	ZINC000819049713	FE	On-Demand	Anodyne	ADRB2	43	46
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCCN2CCCCC2)cc1	ZINC000819049713	FE	On-Demand	Anodyne	ADRB1	34	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCCN2CCCCC2)cc1	ZINC000819049713	FE	On-Demand	Anodyne	ADRB3	70	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCCN2CCCCC2)cc1	ZINC000819049713	FE	On-Demand	Anodyne	HNMT	46	34
CS(=O)(=O)c1ccc([C@H](O)CNCCCCCN2CCCCC2)cc1	ZINC000819049714	FE	On-Demand	Anodyne	ADRB2	43	46
CS(=O)(=O)c1ccc([C@H](O)CNCCCCCN2CCCCC2)cc1	ZINC000819049714	FE	On-Demand	Anodyne	ADRB1	34	40
CS(=O)(=O)c1ccc([C@H](O)CNCCCCCN2CCCCC2)cc1	ZINC000819049714	FE	On-Demand	Anodyne	ADRB3	70	40
CS(=O)(=O)c1ccc([C@H](O)CNCCCCCN2CCCCC2)cc1	ZINC000819049714	FE	On-Demand	Anodyne	HNMT	46	34
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049719	GG	On-Demand	Anodyne	EPHX2	17	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049719	GG	On-Demand	Anodyne	MCHR1	24	44
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049719	GG	On-Demand	Anodyne	GPR119	44	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049719	GG	On-Demand	Anodyne	SFRP1	71	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049719	GG	On-Demand	Anodyne	WNT3	54	35
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049722	GG	On-Demand	Anodyne	EPHX2	17	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049722	GG	On-Demand	Anodyne	MCHR1	24	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049722	GG	On-Demand	Anodyne	GPR119	44	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049722	GG	On-Demand	Anodyne	SFRP1	71	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049722	GG	On-Demand	Anodyne	WNT3	54	35
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1F	ZINC000819049725	DG	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1F	ZINC000819049725	DG	On-Demand	Anodyne	CHRM3	17	42
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1F	ZINC000819049725	DG	On-Demand	Anodyne	HRH3	27	40
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1F	ZINC000819049725	DG	On-Demand	Anodyne	SIGMAR1	17	43
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1F	ZINC000819049725	DG	On-Demand	Anodyne	CHRNA7	23	47
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1F	ZINC000819049725	DG	On-Demand	Anodyne	HNMT	79	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049726	GG	On-Demand	Anodyne	EPHX2	17	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049726	GG	On-Demand	Anodyne	MCHR1	24	44
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049726	GG	On-Demand	Anodyne	GPR119	44	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049726	GG	On-Demand	Anodyne	SFRP1	71	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049726	GG	On-Demand	Anodyne	WNT3	54	35
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1F	ZINC000819049727	DG	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1F	ZINC000819049727	DG	On-Demand	Anodyne	CHRM3	17	42
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1F	ZINC000819049727	DG	On-Demand	Anodyne	HRH3	27	40
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1F	ZINC000819049727	DG	On-Demand	Anodyne	SIGMAR1	17	43
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1F	ZINC000819049727	DG	On-Demand	Anodyne	CHRNA7	23	47
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1F	ZINC000819049727	DG	On-Demand	Anodyne	HNMT	79	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049730	GG	On-Demand	Anodyne	EPHX2	17	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049730	GG	On-Demand	Anodyne	MCHR1	24	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049730	GG	On-Demand	Anodyne	GPR119	44	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049730	GG	On-Demand	Anodyne	SFRP1	71	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819049730	GG	On-Demand	Anodyne	WNT3	54	35
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819049736	FG	On-Demand	Anodyne	GPR119	39	47
CCN(CC)S(=O)(=O)N1CCN(C(=O)Cc2cccc(NC(C)=O)c2)CC1	ZINC000819049737	GC	On-Demand	Anodyne	TRY2_BOVIN	45	34
CCN(CC)S(=O)(=O)N1CCN(C(=O)Cc2cccc(NC(C)=O)c2)CC1	ZINC000819049737	GC	On-Demand	Anodyne	ST14	40	35
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819049742	FG	On-Demand	Anodyne	GPR119	39	47
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819049747	FG	On-Demand	Anodyne	GPR119	39	47
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819049752	FG	On-Demand	Anodyne	GPR119	39	47
N#Cc1ccc([C@H](O)CNCCCc2cccc(F)c2)cc1	ZINC000819049754	CF	On-Demand	Mild	ADRB2	53	39
N#Cc1ccc([C@H](O)CNCCCc2cccc(F)c2)cc1	ZINC000819049754	CF	On-Demand	Mild	ADRB1	41	40
N#Cc1ccc([C@H](O)CNCCCc2cccc(F)c2)cc1	ZINC000819049754	CF	On-Demand	Mild	ADRB3	36	40
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@@H](O)c1cccnc1	ZINC000819049756	GD	On-Demand	Anodyne	NAMPT	41	49
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@H](O)c1cccnc1	ZINC000819049758	GD	On-Demand	Anodyne	NAMPT	41	49
N#Cc1ccc([C@@H](O)CNCCCc2cccc(F)c2)cc1	ZINC000819049760	CF	On-Demand	Mild	ADRB2	53	39
N#Cc1ccc([C@@H](O)CNCCCc2cccc(F)c2)cc1	ZINC000819049760	CF	On-Demand	Mild	ADRB1	41	40
N#Cc1ccc([C@@H](O)CNCCCc2cccc(F)c2)cc1	ZINC000819049760	CF	On-Demand	Mild	ADRB3	36	40
O=[N+]([O-])c1ccc([C@@H](O)CNCCCc2cccc(F)c2)cc1	ZINC000819049762	DF	On-Demand	Bother	ADRB2	57	38
O=[N+]([O-])c1ccc([C@@H](O)CNCCCc2cccc(F)c2)cc1	ZINC000819049762	DF	On-Demand	Bother	ADRB1	48	39
O=[N+]([O-])c1ccc([C@@H](O)CNCCCc2cccc(F)c2)cc1	ZINC000819049762	DF	On-Demand	Bother	ADRB3	49	42
O=[N+]([O-])c1ccc([C@H](O)CNCCCc2cccc(F)c2)cc1	ZINC000819049763	DF	On-Demand	Bother	ADRB2	57	38
O=[N+]([O-])c1ccc([C@H](O)CNCCCc2cccc(F)c2)cc1	ZINC000819049763	DF	On-Demand	Bother	ADRB1	48	39
O=[N+]([O-])c1ccc([C@H](O)CNCCCc2cccc(F)c2)cc1	ZINC000819049763	DF	On-Demand	Bother	ADRB3	49	42
Cc1cc(F)ccc1[C@@H](O)CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000819049770	FH	On-Demand	Anodyne	SLC6A3	23	47
Cc1cc(F)ccc1[C@@H](O)CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000819049770	FH	On-Demand	Anodyne	SIGMAR1	15	44
Cc1cc(F)ccc1[C@@H](O)CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000819049770	FH	On-Demand	Anodyne	CCR3	26	42
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819049781	HE	On-Demand	Anodyne	CTSK	31	40
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819049781	HE	On-Demand	Anodyne	CTSS	17	40
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819049781	HE	On-Demand	Anodyne	CAPN1	58	43
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819049781	HE	On-Demand	Anodyne	CAPN2	64	43
COc1ccccc1COC[C@H](O)CN[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819049782	GE	On-Demand	Anodyne	GPR119	27	42
COc1ccccc1COC[C@H](O)CN[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819049782	GE	On-Demand	Anodyne	MBTPS1	43	30
O=S(=O)(CCNC[C@H](O)c1ccccc1)NCC1CCC1	ZINC000819049783	DD	On-Demand	Anodyne	ADRB2	29	40
O=S(=O)(CCNC[C@H](O)c1ccccc1)NCC1CCC1	ZINC000819049783	DD	On-Demand	Anodyne	ADRB1	36	44
O=S(=O)(CCNC[C@H](O)c1ccccc1)NCC1CCC1	ZINC000819049783	DD	On-Demand	Anodyne	ADRB3	66	44
COC(=O)N[C@H](CC(C)C)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819049784	HE	On-Demand	Anodyne	CTSK	31	40
COC(=O)N[C@H](CC(C)C)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819049784	HE	On-Demand	Anodyne	CTSS	17	40
COC(=O)N[C@H](CC(C)C)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819049784	HE	On-Demand	Anodyne	CAPN1	58	43
COC(=O)N[C@H](CC(C)C)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819049784	HE	On-Demand	Anodyne	CAPN2	64	43
O=S(=O)(CCNC[C@@H](O)c1ccccc1)NCC1CCC1	ZINC000819049785	DD	On-Demand	Anodyne	ADRB2	29	40
O=S(=O)(CCNC[C@@H](O)c1ccccc1)NCC1CCC1	ZINC000819049785	DD	On-Demand	Anodyne	ADRB1	36	44
O=S(=O)(CCNC[C@@H](O)c1ccccc1)NCC1CCC1	ZINC000819049785	DD	On-Demand	Anodyne	ADRB3	66	44
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)NCC1CCC1	ZINC000819049786	ED	On-Demand	Anodyne	ADRB2	42	38
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)NCC1CCC1	ZINC000819049786	ED	On-Demand	Anodyne	ADRB1	61	47
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)NCC1CCC1	ZINC000819049786	ED	On-Demand	Anodyne	ADRB3	87	47
COc1ccccc1COC[C@H](O)CN[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819049788	GE	On-Demand	Anodyne	GPR119	27	42
COc1ccccc1COC[C@H](O)CN[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819049788	GE	On-Demand	Anodyne	MBTPS1	43	30
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)NCC1CCC1	ZINC000819049789	ED	On-Demand	Anodyne	ADRB2	42	38
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)NCC1CCC1	ZINC000819049789	ED	On-Demand	Anodyne	ADRB1	61	47
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)NCC1CCC1	ZINC000819049789	ED	On-Demand	Anodyne	ADRB3	87	47
COc1ccccc1COC[C@@H](O)CN[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819049793	GE	On-Demand	Anodyne	GPR119	27	42
COc1ccccc1COC[C@@H](O)CN[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819049793	GE	On-Demand	Anodyne	MBTPS1	43	30
COc1ccccc1COC[C@@H](O)CN[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819049796	GE	On-Demand	Anodyne	GPR119	27	42
COc1ccccc1COC[C@@H](O)CN[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819049796	GE	On-Demand	Anodyne	MBTPS1	43	30
O=C(CN1CCC(NC(=O)C(F)=C2CCC2)CC1)Nc1ccccc1	ZINC000819049801	EF	On-Demand	Anodyne	DRD4	26	47
O=C(CN1CCC(NC(=O)C(F)=C2CCC2)CC1)Nc1ccccc1	ZINC000819049801	EF	On-Demand	Anodyne	SIGMAR1	17	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCS(=O)(=O)NCC2CCC2)cc1	ZINC000819049804	GC	On-Demand	Anodyne	ADRB2	16	41
CS(=O)(=O)c1ccc([C@H](O)CNCCS(=O)(=O)NCC2CCC2)cc1	ZINC000819049806	GC	On-Demand	Anodyne	ADRB2	16	41
C#Cc1ccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)nc1	ZINC000819049814	FE	On-Demand	Mild	BACE2	28	40
C#Cc1ccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)nc1	ZINC000819049814	FE	On-Demand	Mild	TYK2	47	38
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@H](F)c1ccccc1	ZINC000819049821	GG	On-Demand	Anodyne	CASR	23	42
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@@H](F)c1ccccc1	ZINC000819049823	GG	On-Demand	Anodyne	CASR	23	42
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc([N+](=O)[O-])c(Cl)c1	ZINC000819049826	HG	On-Demand	Bother	TAAR1	33	46
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc([N+](=O)[O-])c(Cl)c1	ZINC000819049826	HG	On-Demand	Bother	KCNK3	52	34
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(C2SCCS2)cc1	ZINC000819049855	II	On-Demand	Anodyne	KCNK3	64	38
Nc1ccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1[N+](=O)[O-]	ZINC000819049869	HE	On-Demand	Bother	TAAR1	31	46
Nc1ccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1[N+](=O)[O-]	ZINC000819049869	HE	On-Demand	Bother	KCNK3	44	34
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049876	GE	On-Demand	Anodyne	ADRB2	27	43
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049876	GE	On-Demand	Anodyne	ADRB3	34	43
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049876	GE	On-Demand	Anodyne	ACOX1	44	32
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049876	GE	On-Demand	Anodyne	ABCB1	23	46
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049876	GE	On-Demand	Anodyne	GPR119	37	40
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049881	GE	On-Demand	Anodyne	ADRB2	27	43
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049881	GE	On-Demand	Anodyne	ADRB3	34	43
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049881	GE	On-Demand	Anodyne	ACOX1	44	32
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049881	GE	On-Demand	Anodyne	ABCB1	23	46
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049881	GE	On-Demand	Anodyne	GPR119	37	40
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049886	GE	On-Demand	Anodyne	ADRB2	27	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049886	GE	On-Demand	Anodyne	ADRB3	34	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049886	GE	On-Demand	Anodyne	ACOX1	44	32
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049886	GE	On-Demand	Anodyne	ABCB1	23	46
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049886	GE	On-Demand	Anodyne	GPR119	37	40
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049888	GE	On-Demand	Anodyne	ADRB2	27	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049888	GE	On-Demand	Anodyne	ADRB3	34	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049888	GE	On-Demand	Anodyne	ACOX1	44	32
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049888	GE	On-Demand	Anodyne	ABCB1	23	46
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819049888	GE	On-Demand	Anodyne	GPR119	37	40
C[C@@H](Cc1ccc(F)cc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819049898	HH	On-Demand	Anodyne	CCR3	51	43
C[C@@H](Cc1ccc(F)cc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819049898	HH	On-Demand	Anodyne	ST14	42	34
O[C@@H](CNCCCc1cccc(F)c1)c1cc(F)ccc1F	ZINC000819049902	DG	On-Demand	Anodyne	ADRB2	58	40
O[C@@H](CNCCCc1cccc(F)c1)c1cc(F)ccc1F	ZINC000819049902	DG	On-Demand	Anodyne	ADRB1	44	40
O[C@@H](CNCCCc1cccc(F)c1)c1cc(F)ccc1F	ZINC000819049902	DG	On-Demand	Anodyne	ADRB3	28	40
O[C@@H](CNCCCc1cccc(F)c1)c1cc(F)ccc1F	ZINC000819049902	DG	On-Demand	Anodyne	NOS1	16	42
O[C@H](CNCCCc1cccc(F)c1)c1cc(F)ccc1F	ZINC000819049905	DG	On-Demand	Anodyne	ADRB2	58	40
O[C@H](CNCCCc1cccc(F)c1)c1cc(F)ccc1F	ZINC000819049905	DG	On-Demand	Anodyne	ADRB1	44	40
O[C@H](CNCCCc1cccc(F)c1)c1cc(F)ccc1F	ZINC000819049905	DG	On-Demand	Anodyne	ADRB3	28	40
O[C@H](CNCCCc1cccc(F)c1)c1cc(F)ccc1F	ZINC000819049905	DG	On-Demand	Anodyne	NOS1	16	42
O[C@@H](CNCCCc1cccc(F)c1)C1CC1	ZINC000819049911	BE	On-Demand	Anodyne	NOS1	20	43
O[C@H](CNCCCc1cccc(F)c1)C1CC1	ZINC000819049914	BE	On-Demand	Anodyne	NOS1	20	43
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(-n2ccnc2S)cc1	ZINC000819049925	IG	On-Demand	Anodyne	KCNK3	42	34
COc1ccc(OC)c([C@H](O)CNCCCc2cccc(F)c2)c1	ZINC000819049940	EG	On-Demand	Anodyne	ADRB2	62	46
COc1ccc(OC)c([C@H](O)CNCCCc2cccc(F)c2)c1	ZINC000819049940	EG	On-Demand	Anodyne	ADRB1	49	43
COc1ccc(OC)c([C@H](O)CNCCCc2cccc(F)c2)c1	ZINC000819049940	EG	On-Demand	Anodyne	ADRB3	33	43
COc1ccc(OC)c([C@H](O)CNCCCc2cccc(F)c2)c1	ZINC000819049940	EG	On-Demand	Anodyne	MTNR1A	17	42
COc1ccc(OC)c([C@H](O)CNCCCc2cccc(F)c2)c1	ZINC000819049940	EG	On-Demand	Anodyne	MTNR1B	18	42
CCOc1ccccc1C(F)(F)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819049948	FG	On-Demand	Anodyne	HCN1	60	37
CCOc1ccccc1C(F)(F)C(=O)N1CCC[C@@](CO)(C(C)C)C1	ZINC000819049948	FG	On-Demand	Anodyne	HCN4	51	37
CCOc1ccccc1C(F)(F)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819049951	FG	On-Demand	Anodyne	HCN1	60	37
CCOc1ccccc1C(F)(F)C(=O)N1CCC[C@](CO)(C(C)C)C1	ZINC000819049951	FG	On-Demand	Anodyne	HCN4	51	37
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(-c2nnc(S)o2)cc1	ZINC000819049959	IG	On-Demand	Anodyne	KCNK3	44	35
C[C@@H](O)c1ncc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)s1	ZINC000819049962	GE	On-Demand	Anodyne	GCK	20	41
C[C@H](O)c1ncc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)s1	ZINC000819049963	GE	On-Demand	Anodyne	GCK	20	41
O=C(/C=C\c1ccc2c(c1)OCO2)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819049967	HG	On-Demand	Anodyne	DYRK2	46	35
O=C(/C=C/c1ccc2c(c1)OCO2)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819049968	HG	On-Demand	Anodyne	DYRK2	46	35
Cn1ncc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)n1	ZINC000819049977	FD	On-Demand	Anodyne	NAMPT	18	42
O=S(=O)(CCNC[C@H](O)c1cccc(C(F)(F)F)c1)NCC1CCC1	ZINC000819049979	GE	On-Demand	Anodyne	ADRB3	46	36
O=S(=O)(CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)NCC1CCC1	ZINC000819049980	GE	On-Demand	Anodyne	ADRB3	46	36
O[C@@H](CNCCCc1cccc(F)c1)c1ccccc1Cl	ZINC000819049981	DH	On-Demand	Anodyne	ADRB2	65	41
O[C@@H](CNCCCc1cccc(F)c1)c1ccccc1Cl	ZINC000819049981	DH	On-Demand	Anodyne	ADRB1	51	45
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1Cl	ZINC000819049991	EH	On-Demand	Anodyne	ADRB2	17	43
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1Cl	ZINC000819049991	EH	On-Demand	Anodyne	CHRNA7	15	42
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1Cl	ZINC000819049991	EH	On-Demand	Anodyne	HNMT	47	38
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1Cl	ZINC000819049992	EH	On-Demand	Anodyne	ADRB2	17	43
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1Cl	ZINC000819049992	EH	On-Demand	Anodyne	CHRNA7	15	42
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1Cl	ZINC000819049992	EH	On-Demand	Anodyne	HNMT	47	38
CCc1cccc2c(CCNC[C@H](O)c3ccc(F)c(F)c3)c[nH]c12	ZINC000819050006	EH	On-Demand	Anodyne	ADRB2	59	41
CCc1cccc2c(CCNC[C@H](O)c3ccc(F)c(F)c3)c[nH]c12	ZINC000819050006	EH	On-Demand	Anodyne	ADRB1	52	49
CCc1cccc2c(CCNC[C@H](O)c3ccc(F)c(F)c3)c[nH]c12	ZINC000819050006	EH	On-Demand	Anodyne	ADRB3	66	53
CCc1cccc2c(CCNC[C@H](O)c3ccc(F)c(F)c3)c[nH]c12	ZINC000819050006	EH	On-Demand	Anodyne	MPO	37	41
CCc1cccc2c(CCNC[C@@H](O)c3ccc(F)c(F)c3)c[nH]c12	ZINC000819050007	EH	On-Demand	Anodyne	ADRB2	59	41
CCc1cccc2c(CCNC[C@@H](O)c3ccc(F)c(F)c3)c[nH]c12	ZINC000819050007	EH	On-Demand	Anodyne	ADRB1	52	49
CCc1cccc2c(CCNC[C@@H](O)c3ccc(F)c(F)c3)c[nH]c12	ZINC000819050007	EH	On-Demand	Anodyne	ADRB3	66	53
CCc1cccc2c(CCNC[C@@H](O)c3ccc(F)c(F)c3)c[nH]c12	ZINC000819050007	EH	On-Demand	Anodyne	MPO	37	41
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COCc1ccccc1	ZINC000819050008	EC	On-Demand	Mild	ADRB1	45	35
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COCc1ccccc1	ZINC000819050009	EC	On-Demand	Mild	ADRB1	45	35
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COCc1ccccc1	ZINC000819050010	EC	On-Demand	Mild	ADRB1	45	35
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COCc1ccccc1	ZINC000819050011	EC	On-Demand	Mild	ADRB1	45	35
Cc1ccccc1[C@@H](O)CNCCCCCN1CCCCC1	ZINC000819050014	DG	On-Demand	Anodyne	ADRB2	24	40
Cc1ccccc1[C@@H](O)CNCCCCCN1CCCCC1	ZINC000819050014	DG	On-Demand	Anodyne	SLC6A1	26	41
Cc1ccccc1[C@@H](O)CNCCCCCN1CCCCC1	ZINC000819050014	DG	On-Demand	Anodyne	HTR4	26	41
Cc1ccccc1[C@@H](O)CNCCCCCN1CCCCC1	ZINC000819050014	DG	On-Demand	Anodyne	CHRM3	19	40
Cc1ccccc1[C@@H](O)CNCCCCCN1CCCCC1	ZINC000819050014	DG	On-Demand	Anodyne	HRH3	35	46
Cc1ccccc1[C@@H](O)CNCCCCCN1CCCCC1	ZINC000819050014	DG	On-Demand	Anodyne	SIGMAR1	18	43
Cc1ccccc1[C@@H](O)CNCCCCCN1CCCCC1	ZINC000819050014	DG	On-Demand	Anodyne	CHRNA7	19	43
Cc1ccccc1[C@@H](O)CNCCCCCN1CCCCC1	ZINC000819050014	DG	On-Demand	Anodyne	HNMT	95	46
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1C(F)(F)F	ZINC000819050022	FH	On-Demand	Anodyne	DRD2	15	40
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1C(F)(F)F	ZINC000819050022	FH	On-Demand	Anodyne	HRH3	18	40
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1C(F)(F)F	ZINC000819050022	FH	On-Demand	Anodyne	CHRNA7	17	40
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1C(F)(F)F	ZINC000819050022	FH	On-Demand	Anodyne	HNMT	58	38
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1C(F)(F)F	ZINC000819050023	FH	On-Demand	Anodyne	DRD2	15	40
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1C(F)(F)F	ZINC000819050023	FH	On-Demand	Anodyne	HRH3	18	40
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1C(F)(F)F	ZINC000819050023	FH	On-Demand	Anodyne	CHRNA7	17	40
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1C(F)(F)F	ZINC000819050023	FH	On-Demand	Anodyne	HNMT	58	38
CON(C)C(=O)CCNCc1ccc(OCCN2CCCC2)cc1	ZINC000819050028	ED	On-Demand	Anodyne	ESR1	94	41
CON(C)C(=O)CCNCc1ccc(OCCN2CCCC2)cc1	ZINC000819050028	ED	On-Demand	Anodyne	ACHE	17	43
CON(C)C(=O)CCNCc1ccc(OCCN2CCCC2)cc1	ZINC000819050028	ED	On-Demand	Anodyne	KCNH2	15	41
CON(C)C(=O)CCNCc1ccc(OCCN2CCCC2)cc1	ZINC000819050028	ED	On-Demand	Anodyne	ESR2	65	40
CON(C)C(=O)CCNCc1ccc(OCCN2CCCC2)cc1	ZINC000819050028	ED	On-Demand	Anodyne	LTA4H	73	49
CON(C)C(=O)CCNCc1ccc(OCCN2CCCC2)cc1	ZINC000819050028	ED	On-Demand	Anodyne	HRH3	68	49
CON(C)C(=O)CCNCc1ccc(OCCN2CCCC2)cc1	ZINC000819050028	ED	On-Demand	Anodyne	DPP7	28	41
CON(C)C(=O)CCNCc1ccc(OCCN2CCCC2)cc1	ZINC000819050028	ED	On-Demand	Anodyne	PSMB2	46	47
CON(C)C(=O)CCNCc1ccc(OCCN2CCCC2)cc1	ZINC000819050028	ED	On-Demand	Anodyne	PSMB1	50	47
O=C(Nc1ccc(-c2csc(N3CCOCC3)n2)cc1)C(F)=C1CCC1	ZINC000819050037	FH	On-Demand	Anodyne	PIK3CA	40	40
O=C(Nc1ccc(-c2csc(N3CCOCC3)n2)cc1)C(F)=C1CCC1	ZINC000819050037	FH	On-Demand	Anodyne	MTOR	76	40
O=C(Nc1ccc(-c2csc(N3CCOCC3)n2)cc1)C(F)=C1CCC1	ZINC000819050037	FH	On-Demand	Anodyne	PIK3CG	36	40
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1	ZINC000819050049	DG	On-Demand	Anodyne	ADRB2	33	41
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1	ZINC000819050049	DG	On-Demand	Anodyne	DRD3	15	42
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1	ZINC000819050049	DG	On-Demand	Anodyne	SLC6A3	29	40
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1	ZINC000819050049	DG	On-Demand	Anodyne	HRH3	22	42
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1	ZINC000819050049	DG	On-Demand	Anodyne	SIGMAR1	18	44
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1	ZINC000819050049	DG	On-Demand	Anodyne	CHRNA7	17	49
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1	ZINC000819050049	DG	On-Demand	Anodyne	HNMT	51	36
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1	ZINC000819050049	DG	On-Demand	Anodyne	LEF	24	47
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1	ZINC000819050050	DG	On-Demand	Anodyne	ADRB2	33	41
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1	ZINC000819050050	DG	On-Demand	Anodyne	DRD3	15	42
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1	ZINC000819050050	DG	On-Demand	Anodyne	SLC6A3	29	40
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1	ZINC000819050050	DG	On-Demand	Anodyne	HRH3	22	42
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1	ZINC000819050050	DG	On-Demand	Anodyne	SIGMAR1	18	44
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1	ZINC000819050050	DG	On-Demand	Anodyne	CHRNA7	17	49
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1	ZINC000819050050	DG	On-Demand	Anodyne	HNMT	51	36
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)cc1	ZINC000819050050	DG	On-Demand	Anodyne	LEF	24	47
O[C@@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1Cl	ZINC000819050051	GI	On-Demand	Anodyne	SLC6A3	24	48
O[C@@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1Cl	ZINC000819050051	GI	On-Demand	Anodyne	LTA4H	15	41
O[C@@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1Cl	ZINC000819050051	GI	On-Demand	Anodyne	SIGMAR1	17	42
O[C@@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1Cl	ZINC000819050051	GI	On-Demand	Anodyne	CCR3	27	43
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)c1	ZINC000819050055	ID	On-Demand	Anodyne	CA2	34	51
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)c1	ZINC000819050055	ID	On-Demand	Anodyne	CA1	26	40
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)c1	ZINC000819050055	ID	On-Demand	Anodyne	CA4	35	51
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)c1	ZINC000819050055	ID	On-Demand	Anodyne	CA12	18	43
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)c1	ZINC000819050055	ID	On-Demand	Anodyne	CA9	22	51
O[C@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1Cl	ZINC000819050062	GI	On-Demand	Anodyne	SLC6A3	24	48
O[C@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1Cl	ZINC000819050062	GI	On-Demand	Anodyne	LTA4H	15	41
O[C@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1Cl	ZINC000819050062	GI	On-Demand	Anodyne	SIGMAR1	17	42
O[C@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1Cl	ZINC000819050062	GI	On-Demand	Anodyne	CCR3	27	43
CCc1cccc2c(CCNC[C@H](O)c3ccc(S(C)(=O)=O)cc3)c[nH]c12	ZINC000819050065	GF	On-Demand	Anodyne	ADRB2	49	56
CCc1cccc2c(CCNC[C@H](O)c3ccc(S(C)(=O)=O)cc3)c[nH]c12	ZINC000819050065	GF	On-Demand	Anodyne	ADRB1	40	56
CCc1cccc2c(CCNC[C@H](O)c3ccc(S(C)(=O)=O)cc3)c[nH]c12	ZINC000819050065	GF	On-Demand	Anodyne	ADRB3	72	62
CCc1cccc2c(CCNC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)c[nH]c12	ZINC000819050067	GF	On-Demand	Anodyne	ADRB2	49	56
CCc1cccc2c(CCNC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)c[nH]c12	ZINC000819050067	GF	On-Demand	Anodyne	ADRB1	40	56
CCc1cccc2c(CCNC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)c[nH]c12	ZINC000819050067	GF	On-Demand	Anodyne	ADRB3	72	62
CCN1CCCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819050077	CD	On-Demand	Anodyne	ADRB1	23	43
CCN1CCCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819050077	CD	On-Demand	Anodyne	ADRB3	88	44
CCN1CCCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819050082	CD	On-Demand	Anodyne	ADRB1	23	43
CCN1CCCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819050082	CD	On-Demand	Anodyne	ADRB3	88	44
O=C(C#Cc1ccc(C(F)(F)F)cc1)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050083	IH	On-Demand	Mild	EPHX2	15	49
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050097	IF	On-Demand	Anodyne	CELA1	15	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050097	IF	On-Demand	Anodyne	CASP3	16	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050097	IF	On-Demand	Anodyne	KLK3	70	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050097	IF	On-Demand	Anodyne	CTSB	62	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050097	IF	On-Demand	Anodyne	PAPA1_CARPA	67	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050097	IF	On-Demand	Anodyne	CYSP_TRYCR	51	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050097	IF	On-Demand	Anodyne	CTSK	37	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050097	IF	On-Demand	Anodyne	CTSL	42	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050097	IF	On-Demand	Anodyne	CAPNS1	79	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050097	IF	On-Demand	Anodyne	CAPN1	91	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050097	IF	On-Demand	Anodyne	CASP1	25	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050097	IF	On-Demand	Anodyne	CTRC	15	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050097	IF	On-Demand	Anodyne	CAPN2	135	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050097	IF	On-Demand	Anodyne	NPR	68	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050097	IF	On-Demand	Anodyne	PSMB5	52	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050097	IF	On-Demand	Anodyne	Q6PRC7_IXORI	41	34
CC(C)n1ncc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)c1N	ZINC000819050113	GE	On-Demand	Anodyne	ATR	17	42
O[C@H](CN[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1)C1CC1	ZINC000819050119	EF	On-Demand	Anodyne	P2RX7	41	41
O[C@H](CN[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1)C1CC1	ZINC000819050120	EF	On-Demand	Anodyne	P2RX7	41	41
O[C@@H](CN[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1)C1CC1	ZINC000819050122	EF	On-Demand	Anodyne	P2RX7	41	41
O[C@@H](CN[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1)C1CC1	ZINC000819050124	EF	On-Demand	Anodyne	P2RX7	41	41
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC1CCN(CC(N)=O)CC1	ZINC000819050181	FD	On-Demand	Anodyne	DRD4	21	43
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC1CCN(CC(N)=O)CC1	ZINC000819050181	FD	On-Demand	Anodyne	HTR4	42	34
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC1CCN(CC(N)=O)CC1	ZINC000819050181	FD	On-Demand	Anodyne	SIGMAR1	17	44
O[C@@H](CN[C@@H]1CCCN(Cc2c(F)cccc2F)C1)c1cccnc1	ZINC000819050184	EF	On-Demand	Anodyne	ADRB3	52	43
O[C@H](CN[C@@H]1CCCN(Cc2c(F)cccc2F)C1)c1cccnc1	ZINC000819050186	EF	On-Demand	Anodyne	ADRB3	52	43
O[C@H](CN[C@H]1CCCN(Cc2c(F)cccc2F)C1)c1cccnc1	ZINC000819050187	EF	On-Demand	Anodyne	ADRB3	52	43
O[C@@H](CN[C@H]1CCCN(Cc2c(F)cccc2F)C1)c1cccnc1	ZINC000819050188	EF	On-Demand	Anodyne	ADRB3	52	43
O[C@@H](CN[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1)c1ccc(F)cn1	ZINC000819050196	GG	On-Demand	Anodyne	P2RX7	41	38
O[C@@H](CN[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1)c1ccc(F)cn1	ZINC000819050205	GG	On-Demand	Anodyne	P2RX7	41	38
O[C@H](CN[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1)c1ccc(F)cn1	ZINC000819050207	GG	On-Demand	Anodyne	P2RX7	41	38
O[C@H](CN[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1)c1ccc(F)cn1	ZINC000819050208	GG	On-Demand	Anodyne	P2RX7	41	38
O=C1c2ccccc2C(=O)N1CCCCNC[C@@H](O)c1cccc(F)c1	ZINC000819050220	FF	On-Demand	Anodyne	ADRB2	46	35
O=C1c2ccccc2C(=O)N1CCCCNC[C@@H](O)c1cccc(F)c1	ZINC000819050220	FF	On-Demand	Anodyne	ADRB1	43	46
O=C1c2ccccc2C(=O)N1CCCCNC[C@@H](O)c1cccc(F)c1	ZINC000819050220	FF	On-Demand	Anodyne	ADRB3	55	46
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1cccc(F)c1	ZINC000819050222	FF	On-Demand	Anodyne	ADRB2	46	35
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1cccc(F)c1	ZINC000819050222	FF	On-Demand	Anodyne	ADRB1	43	46
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1cccc(F)c1	ZINC000819050222	FF	On-Demand	Anodyne	ADRB3	55	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3ccc(O)cc3)CC1)C2	ZINC000819050229	FF	On-Demand	Anodyne	ADAM10	19	41
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(Cn2cccn2)o1	ZINC000819050234	HF	On-Demand	Anodyne	NAMPT	26	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3ccc(O)cc3)CC1)C2	ZINC000819050235	FF	On-Demand	Anodyne	ADAM10	19	41
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2cccnc2)C1	ZINC000819050236	EE	On-Demand	Anodyne	EPHX2	15	43
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2cccnc2)C1	ZINC000819050236	EE	On-Demand	Anodyne	GPR119	40	43
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2cccnc2)C1	ZINC000819050236	EE	On-Demand	Anodyne	NAMPT	19	42
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2cccnc2)C1	ZINC000819050237	EE	On-Demand	Anodyne	EPHX2	15	43
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2cccnc2)C1	ZINC000819050237	EE	On-Demand	Anodyne	GPR119	40	43
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2cccnc2)C1	ZINC000819050237	EE	On-Demand	Anodyne	NAMPT	19	42
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050248	IF	On-Demand	Anodyne	SFRP1	52	43
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050248	IF	On-Demand	Anodyne	WNT3	57	43
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050250	IF	On-Demand	Anodyne	SFRP1	52	43
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050250	IF	On-Demand	Anodyne	WNT3	57	43
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccn(-c2ccccc2Cl)n1	ZINC000819050270	IH	On-Demand	Anodyne	TYK2	46	34
Cn1cc(-c2cccc(C(=O)Nc3cccc(S(=O)(=O)C4CCOCC4)c3)c2)cn1	ZINC000819050282	IG	On-Demand	Anodyne	GCK	17	40
Cn1cc(-c2cccc(C(=O)Nc3cccc(S(=O)(=O)C4CCOCC4)c3)c2)cn1	ZINC000819050282	IG	On-Demand	Anodyne	KCNK3	75	36
CCc1cccc2c(CCNC[C@H](O)c3cccc(F)c3)c[nH]c12	ZINC000819050290	EH	On-Demand	Anodyne	ADRB2	56	41
CCc1cccc2c(CCNC[C@H](O)c3cccc(F)c3)c[nH]c12	ZINC000819050290	EH	On-Demand	Anodyne	ADRB1	52	52
CCc1cccc2c(CCNC[C@H](O)c3cccc(F)c3)c[nH]c12	ZINC000819050290	EH	On-Demand	Anodyne	ADRB3	74	63
CCc1cccc2c(CCNC[C@H](O)c3cccc(F)c3)c[nH]c12	ZINC000819050290	EH	On-Demand	Anodyne	MPO	73	39
CCc1cccc2c(CCNC[C@@H](O)c3cccc(F)c3)c[nH]c12	ZINC000819050291	EH	On-Demand	Anodyne	ADRB2	56	41
CCc1cccc2c(CCNC[C@@H](O)c3cccc(F)c3)c[nH]c12	ZINC000819050291	EH	On-Demand	Anodyne	ADRB1	52	52
CCc1cccc2c(CCNC[C@@H](O)c3cccc(F)c3)c[nH]c12	ZINC000819050291	EH	On-Demand	Anodyne	ADRB3	74	63
CCc1cccc2c(CCNC[C@@H](O)c3cccc(F)c3)c[nH]c12	ZINC000819050291	EH	On-Demand	Anodyne	MPO	73	39
C=C(C)C(C)(C)C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000819050312	FI	On-Demand	Mild	PIK3CA	47	41
C=C(C)C(C)(C)C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000819050312	FI	On-Demand	Mild	MTOR	97	41
C=C(C)C(C)(C)C(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000819050312	FI	On-Demand	Mild	PIK3CG	40	41
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819050320	ED	On-Demand	Anodyne	L3MBTL3	52	36
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819050321	ED	On-Demand	Anodyne	L3MBTL3	52	36
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819050322	ED	On-Demand	Anodyne	L3MBTL3	52	36
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819050323	ED	On-Demand	Anodyne	L3MBTL3	52	36
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819050335	GC	On-Demand	Mild	ADRB2	16	46
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819050335	GC	On-Demand	Mild	ADRB1	49	39
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819050335	GC	On-Demand	Mild	ADRB3	16	46
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819050336	GC	On-Demand	Mild	ADRB2	16	46
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819050336	GC	On-Demand	Mild	ADRB1	49	39
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819050336	GC	On-Demand	Mild	ADRB3	16	46
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819050337	GC	On-Demand	Mild	ADRB2	16	46
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819050337	GC	On-Demand	Mild	ADRB1	49	39
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819050337	GC	On-Demand	Mild	ADRB3	16	46
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819050338	GC	On-Demand	Mild	ADRB2	16	46
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819050338	GC	On-Demand	Mild	ADRB1	49	39
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819050338	GC	On-Demand	Mild	ADRB3	16	46
CN1CCN(C)[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819050344	CD	On-Demand	Anodyne	ADRB1	30	42
CN1CCN(C)[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819050344	CD	On-Demand	Anodyne	ADRB3	46	42
CN1CCN(C)[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819050344	CD	On-Demand	Anodyne	CYP3A4	42	35
CN1CCN(C)[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819050345	CD	On-Demand	Anodyne	ADRB1	30	42
CN1CCN(C)[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819050345	CD	On-Demand	Anodyne	ADRB3	46	42
CN1CCN(C)[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819050345	CD	On-Demand	Anodyne	CYP3A4	42	35
CN1CCN(C)[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819050346	CD	On-Demand	Anodyne	ADRB1	30	42
CN1CCN(C)[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819050346	CD	On-Demand	Anodyne	ADRB3	46	42
CN1CCN(C)[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819050346	CD	On-Demand	Anodyne	CYP3A4	42	35
CN1CCN(C)[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819050347	CD	On-Demand	Anodyne	ADRB1	30	42
CN1CCN(C)[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819050347	CD	On-Demand	Anodyne	ADRB3	46	42
CN1CCN(C)[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819050347	CD	On-Demand	Anodyne	CYP3A4	42	35
C[C@@H]1CCCC[C@H]1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819050360	EG	On-Demand	Anodyne	F2	18	41
C[C@@H]1CCCC[C@H]1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819050360	EG	On-Demand	Anodyne	PREP	21	42
C[C@@H]1CCCC[C@H]1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819050360	EG	On-Demand	Anodyne	L3MBTL3	95	43
C[C@@H]1CCCC[C@H]1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819050360	EG	On-Demand	Anodyne	NAMPT	17	42
C[C@@H]1CCCC[C@H]1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819050360	EG	On-Demand	Anodyne	TMPRSS11D	61	33
C[C@@H]1CCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819050362	EG	On-Demand	Anodyne	F2	18	41
C[C@@H]1CCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819050362	EG	On-Demand	Anodyne	PREP	21	42
C[C@@H]1CCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819050362	EG	On-Demand	Anodyne	L3MBTL3	95	43
C[C@@H]1CCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819050362	EG	On-Demand	Anodyne	NAMPT	17	42
C[C@@H]1CCCC[C@@H]1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819050362	EG	On-Demand	Anodyne	TMPRSS11D	61	33
CCc1cccc2c(CCNCCS(=O)(=O)CC)c[nH]c12	ZINC000819050368	DE	On-Demand	Anodyne	ALOX15	15	43
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc2c(c1)OCO2	ZINC000819050371	CE	On-Demand	Anodyne	KCNQ2	46	57
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc2c(c1)OCO2	ZINC000819050372	CE	On-Demand	Anodyne	KCNQ2	46	57
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc2c(c1)OCO2	ZINC000819050373	CE	On-Demand	Anodyne	KCNQ2	46	57
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc2c(c1)OCO2	ZINC000819050374	CE	On-Demand	Anodyne	KCNQ2	46	57
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)cn1	ZINC000819050375	DE	On-Demand	Anodyne	CHRNA7	15	47
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)cn1	ZINC000819050375	DE	On-Demand	Anodyne	HNMT	57	38
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)cn1	ZINC000819050376	DE	On-Demand	Anodyne	CHRNA7	15	47
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)cn1	ZINC000819050376	DE	On-Demand	Anodyne	HNMT	57	38
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050381	CF	On-Demand	Anodyne	ADRB2	46	44
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050381	CF	On-Demand	Anodyne	ADRB1	49	44
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050381	CF	On-Demand	Anodyne	HTR1A	23	42
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050381	CF	On-Demand	Anodyne	DRD2	24	47
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050381	CF	On-Demand	Anodyne	HTR2A	17	43
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050381	CF	On-Demand	Anodyne	DRD3	34	47
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050381	CF	On-Demand	Anodyne	SLC6A3	21	40
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050381	CF	On-Demand	Anodyne	HTR4	18	40
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050381	CF	On-Demand	Anodyne	CHRM3	21	44
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050381	CF	On-Demand	Anodyne	ADRB3	76	44
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050381	CF	On-Demand	Anodyne	HRH3	42	46
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050381	CF	On-Demand	Anodyne	SIGMAR1	28	49
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050381	CF	On-Demand	Anodyne	BCHE	17	42
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050381	CF	On-Demand	Anodyne	CHRNA7	19	48
O[C@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050381	CF	On-Demand	Anodyne	HNMT	94	43
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050382	CF	On-Demand	Anodyne	ADRB2	46	44
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050382	CF	On-Demand	Anodyne	ADRB1	49	44
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050382	CF	On-Demand	Anodyne	HTR1A	23	42
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050382	CF	On-Demand	Anodyne	DRD2	24	47
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050382	CF	On-Demand	Anodyne	HTR2A	17	43
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050382	CF	On-Demand	Anodyne	DRD3	34	47
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050382	CF	On-Demand	Anodyne	SLC6A3	21	40
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050382	CF	On-Demand	Anodyne	HTR4	18	40
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050382	CF	On-Demand	Anodyne	CHRM3	21	44
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050382	CF	On-Demand	Anodyne	ADRB3	76	44
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050382	CF	On-Demand	Anodyne	HRH3	42	46
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050382	CF	On-Demand	Anodyne	SIGMAR1	28	49
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050382	CF	On-Demand	Anodyne	BCHE	17	42
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050382	CF	On-Demand	Anodyne	CHRNA7	19	48
O[C@@H](CNCCCCCN1CCCCC1)c1ccccc1	ZINC000819050382	CF	On-Demand	Anodyne	HNMT	94	43
O[C@H](CNCCCCCN1CCCCC1)c1cccc(C(F)(F)F)c1	ZINC000819050383	FH	On-Demand	Anodyne	ADRB1	40	38
O[C@H](CNCCCCCN1CCCCC1)c1cccc(C(F)(F)F)c1	ZINC000819050383	FH	On-Demand	Anodyne	DRD3	18	43
O[C@H](CNCCCCCN1CCCCC1)c1cccc(C(F)(F)F)c1	ZINC000819050383	FH	On-Demand	Anodyne	ADRB3	46	40
O[C@H](CNCCCCCN1CCCCC1)c1cccc(C(F)(F)F)c1	ZINC000819050383	FH	On-Demand	Anodyne	HNMT	41	34
O[C@H](CNCCCCCN1CCCCC1)c1cccc(C(F)(F)F)c1	ZINC000819050383	FH	On-Demand	Anodyne	CCR2	15	43
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(C(F)(F)F)c1	ZINC000819050384	FH	On-Demand	Anodyne	ADRB1	40	38
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(C(F)(F)F)c1	ZINC000819050384	FH	On-Demand	Anodyne	DRD3	18	43
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(C(F)(F)F)c1	ZINC000819050384	FH	On-Demand	Anodyne	ADRB3	46	40
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(C(F)(F)F)c1	ZINC000819050384	FH	On-Demand	Anodyne	HNMT	41	34
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(C(F)(F)F)c1	ZINC000819050384	FH	On-Demand	Anodyne	CCR2	15	43
O[C@@H](CNCCCCCN1CCCCC1)c1cccnc1	ZINC000819050388	CE	On-Demand	Anodyne	ADRB2	43	46
O[C@@H](CNCCCCCN1CCCCC1)c1cccnc1	ZINC000819050388	CE	On-Demand	Anodyne	ADRB1	46	49
O[C@@H](CNCCCCCN1CCCCC1)c1cccnc1	ZINC000819050388	CE	On-Demand	Anodyne	ADRB3	123	53
O[C@@H](CNCCCCCN1CCCCC1)c1cccnc1	ZINC000819050388	CE	On-Demand	Anodyne	HRH3	17	41
O[C@@H](CNCCCCCN1CCCCC1)c1cccnc1	ZINC000819050388	CE	On-Demand	Anodyne	CHRNA7	18	48
O[C@@H](CNCCCCCN1CCCCC1)c1cccnc1	ZINC000819050388	CE	On-Demand	Anodyne	HNMT	77	41
O[C@H](CNCCCCCN1CCCCC1)c1cccnc1	ZINC000819050389	CE	On-Demand	Anodyne	ADRB2	43	46
O[C@H](CNCCCCCN1CCCCC1)c1cccnc1	ZINC000819050389	CE	On-Demand	Anodyne	ADRB1	46	49
O[C@H](CNCCCCCN1CCCCC1)c1cccnc1	ZINC000819050389	CE	On-Demand	Anodyne	ADRB3	123	53
O[C@H](CNCCCCCN1CCCCC1)c1cccnc1	ZINC000819050389	CE	On-Demand	Anodyne	HRH3	17	41
O[C@H](CNCCCCCN1CCCCC1)c1cccnc1	ZINC000819050389	CE	On-Demand	Anodyne	CHRNA7	18	48
O[C@H](CNCCCCCN1CCCCC1)c1cccnc1	ZINC000819050389	CE	On-Demand	Anodyne	HNMT	77	41
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccccc1SC(F)(F)F	ZINC000819050398	IJ	On-Demand	Anodyne	KCNK3	56	37
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccccc1SC(F)(F)F	ZINC000819050398	IJ	On-Demand	Anodyne	KCNK9	46	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1csc(-c3ccccc3)n1)C2	ZINC000819050404	GG	On-Demand	Anodyne	PDE8B	52	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1csc(-c3ccccc3)n1)C2	ZINC000819050404	GG	On-Demand	Anodyne	VHL	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1csc(-c3ccccc3)n1)C2	ZINC000819050406	GG	On-Demand	Anodyne	PDE8B	52	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1csc(-c3ccccc3)n1)C2	ZINC000819050406	GG	On-Demand	Anodyne	VHL	40	31
O=C(Cc1cccnc1Br)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050407	IF	On-Demand	Anodyne	NAMPT	22	43
O[C@@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1cccc2ccccc12	ZINC000819050409	GJ	On-Demand	Anodyne	DRD4	18	41
O[C@@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1cccc2ccccc12	ZINC000819050409	GJ	On-Demand	Anodyne	KCNH2	26	40
O[C@@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1cccc2ccccc12	ZINC000819050409	GJ	On-Demand	Anodyne	LTA4H	16	46
O[C@@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1cccc2ccccc12	ZINC000819050409	GJ	On-Demand	Anodyne	SIGMAR1	19	53
O[C@@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1cccc2ccccc12	ZINC000819050409	GJ	On-Demand	Anodyne	ACHP_LYMST	18	40
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@@H](O)c1ccccn1	ZINC000819050411	GD	On-Demand	Anodyne	GCK	15	40
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@H](O)c1ccccn1	ZINC000819050412	GD	On-Demand	Anodyne	GCK	15	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)CC2CCCC2)C1	ZINC000819050414	DF	On-Demand	Anodyne	GPR119	26	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CC2CCCC2)C1	ZINC000819050415	DF	On-Demand	Anodyne	GPR119	26	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)CC2CCCC2)C1	ZINC000819050416	DF	On-Demand	Anodyne	GPR119	26	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CC2CCCC2)C1	ZINC000819050417	DF	On-Demand	Anodyne	GPR119	26	42
C=CCC1(C(=O)N2CCN(Cc3cccc4cccnc34)CC2)CCOCC1	ZINC000819050419	GG	On-Demand	Mild	CCR8	22	40
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc2nc(S)oc2c1	ZINC000819050420	HG	On-Demand	Anodyne	KCNK3	67	37
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccnc(C(F)(F)F)c1	ZINC000819050422	HG	On-Demand	Anodyne	TYK2	42	34
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccnc(C(F)(F)F)c1	ZINC000819050422	HG	On-Demand	Anodyne	BTK	26	40
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccnc(C(F)(F)F)c1	ZINC000819050422	HG	On-Demand	Anodyne	BRAF	34	42
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccnc(C(F)(F)F)c1	ZINC000819050422	HG	On-Demand	Anodyne	KCNK3	64	40
CC(C)(C)C(=O)Nc1ccccc1C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050425	IH	On-Demand	Anodyne	NR1H4	21	42
CC(C)(C)C(=O)Nc1ccccc1C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050425	IH	On-Demand	Anodyne	KCNK3	60	35
CC(C)(C)C(=O)Nc1ccccc1C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050425	IH	On-Demand	Anodyne	KCNK9	54	35
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccnc(Br)c1	ZINC000819050431	IG	On-Demand	Anodyne	TYK2	52	35
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccnc(Br)c1	ZINC000819050431	IG	On-Demand	Anodyne	KCNK3	74	40
CCOC(=O)N1CCC[C@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819050452	HE	On-Demand	Anodyne	P2RY12	41	39
CCOC(=O)N1CCC[C@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819050452	HE	On-Demand	Anodyne	EPHX2	25	44
CCOC(=O)N1CCC[C@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819050452	HE	On-Demand	Anodyne	ST14	41	40
CCOC(=O)N1CCC[C@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819050452	HE	On-Demand	Anodyne	F13A1	41	38
CCOC(=O)N1CCC[C@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819050452	HE	On-Demand	Anodyne	CCR8	25	41
CCOC(=O)N1CCC[C@@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819050453	HE	On-Demand	Anodyne	P2RY12	41	39
CCOC(=O)N1CCC[C@@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819050453	HE	On-Demand	Anodyne	EPHX2	25	44
CCOC(=O)N1CCC[C@@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819050453	HE	On-Demand	Anodyne	ST14	41	40
CCOC(=O)N1CCC[C@@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819050453	HE	On-Demand	Anodyne	F13A1	41	38
CCOC(=O)N1CCC[C@@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819050453	HE	On-Demand	Anodyne	CCR8	25	41
O=C1c2ccccc2C(=O)N1CCCCNC[C@@H](O)c1ccc(F)cc1	ZINC000819050476	FF	On-Demand	Anodyne	ADRB2	52	37
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1ccc(F)cc1	ZINC000819050478	FF	On-Demand	Anodyne	ADRB2	52	37
CCOC(=O)N1CCC(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)CC1	ZINC000819050482	HE	On-Demand	Anodyne	EPHX2	42	43
CCOC(=O)N1CCC(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)CC1	ZINC000819050482	HE	On-Demand	Anodyne	ST14	56	40
CCOC(=O)N1CCC(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)CC1	ZINC000819050482	HE	On-Demand	Anodyne	F13A1	48	38
COc1ccccc1[C@@H](NC(=O)c1cn(Cc2ccccc2)nn1)c1nccn1C	ZINC000819050542	HF	On-Demand	Anodyne	GHSR	21	43
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819050562	EE	On-Demand	Mild	ADRB3	21	51
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819050562	EE	On-Demand	Mild	CTRB_BOVIN	43	30
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819050562	EE	On-Demand	Mild	GPR119	40	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819050566	EE	On-Demand	Mild	ADRB3	21	51
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819050566	EE	On-Demand	Mild	CTRB_BOVIN	43	30
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819050566	EE	On-Demand	Mild	GPR119	40	45
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819050568	EE	On-Demand	Mild	ADRB3	21	51
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819050568	EE	On-Demand	Mild	CTRB_BOVIN	43	30
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819050568	EE	On-Demand	Mild	GPR119	40	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819050569	EE	On-Demand	Mild	ADRB3	21	51
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819050569	EE	On-Demand	Mild	CTRB_BOVIN	43	30
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819050569	EE	On-Demand	Mild	GPR119	40	45
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@@H]1C[C@H]1c1ccccc1	ZINC000819050580	GG	On-Demand	Anodyne	NAMPT	25	61
CC(C)(C)OC(=O)N1CC(CC(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819050581	IF	On-Demand	Anodyne	EPHX2	16	40
CC(C)(C)OC(=O)N1CC(CC(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819050581	IF	On-Demand	Anodyne	GPR119	45	40
N#Cc1ccc([C@H](O)CNCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819050590	FF	On-Demand	Mild	ESR1	74	38
N#Cc1ccc([C@H](O)CNCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819050590	FF	On-Demand	Mild	ESR2	51	38
N#Cc1ccc([C@H](O)CNCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819050590	FF	On-Demand	Mild	LTA4H	58	48
N#Cc1ccc([C@H](O)CNCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819050590	FF	On-Demand	Mild	HRH3	50	53
N#Cc1ccc([C@H](O)CNCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819050590	FF	On-Demand	Mild	PSMB2	45	47
N#Cc1ccc([C@H](O)CNCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819050590	FF	On-Demand	Mild	PSMB1	50	47
N#Cc1ccc([C@H](O)CNCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819050590	FF	On-Demand	Mild	MEN1	41	38
N#Cc1ccc([C@@H](O)CNCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819050591	FF	On-Demand	Mild	ESR1	74	38
N#Cc1ccc([C@@H](O)CNCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819050591	FF	On-Demand	Mild	ESR2	51	38
N#Cc1ccc([C@@H](O)CNCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819050591	FF	On-Demand	Mild	LTA4H	58	48
N#Cc1ccc([C@@H](O)CNCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819050591	FF	On-Demand	Mild	HRH3	50	53
N#Cc1ccc([C@@H](O)CNCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819050591	FF	On-Demand	Mild	PSMB2	45	47
N#Cc1ccc([C@@H](O)CNCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819050591	FF	On-Demand	Mild	PSMB1	50	47
N#Cc1ccc([C@@H](O)CNCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819050591	FF	On-Demand	Mild	MEN1	41	38
CN(C)c1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cn1	ZINC000819050596	FF	On-Demand	Mild	PAPA1_CARPA	42	45
CN(C)c1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cn1	ZINC000819050597	FF	On-Demand	Mild	PAPA1_CARPA	42	45
O=[N+]([O-])c1ccc([C@H](O)CNCCCCCN2CCCCC2)cc1	ZINC000819050599	EF	On-Demand	Bother	HNMT	40	33
O=[N+]([O-])c1ccc([C@@H](O)CNCCCCCN2CCCCC2)cc1	ZINC000819050600	EF	On-Demand	Bother	HNMT	40	33
O[C@H](CNCCCCCN1CCCCC1)c1ccc(Cl)c(F)c1	ZINC000819050620	EH	On-Demand	Anodyne	ADRB2	38	43
O[C@H](CNCCCCCN1CCCCC1)c1ccc(Cl)c(F)c1	ZINC000819050620	EH	On-Demand	Anodyne	ADRB1	35	41
O[C@H](CNCCCCCN1CCCCC1)c1ccc(Cl)c(F)c1	ZINC000819050620	EH	On-Demand	Anodyne	ADRB3	33	41
O[C@H](CNCCCCCN1CCCCC1)c1ccc(Cl)c(F)c1	ZINC000819050620	EH	On-Demand	Anodyne	HNMT	51	39
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(Cl)c(F)c1	ZINC000819050621	EH	On-Demand	Anodyne	ADRB2	38	43
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(Cl)c(F)c1	ZINC000819050621	EH	On-Demand	Anodyne	ADRB1	35	41
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(Cl)c(F)c1	ZINC000819050621	EH	On-Demand	Anodyne	ADRB3	33	41
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(Cl)c(F)c1	ZINC000819050621	EH	On-Demand	Anodyne	HNMT	51	39
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(C)c2)c1	ZINC000819050622	FH	On-Demand	Anodyne	HTR1D	26	44
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(C)c2)c1	ZINC000819050622	FH	On-Demand	Anodyne	HTR1B	28	44
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(C)c2)c1	ZINC000819050622	FH	On-Demand	Anodyne	KCNQ2	74	48
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(C)c2)c1	ZINC000819050622	FH	On-Demand	Anodyne	NPY2R	63	45
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(C)c2)c1	ZINC000819050622	FH	On-Demand	Anodyne	TAAR1	31	47
O[C@H](CNCCCCCN1CCCCC1)c1cccc(F)c1	ZINC000819050628	DG	On-Demand	Anodyne	ADRB2	38	41
O[C@H](CNCCCCCN1CCCCC1)c1cccc(F)c1	ZINC000819050628	DG	On-Demand	Anodyne	ADRB1	43	44
O[C@H](CNCCCCCN1CCCCC1)c1cccc(F)c1	ZINC000819050628	DG	On-Demand	Anodyne	SLC6A1	17	40
O[C@H](CNCCCCCN1CCCCC1)c1cccc(F)c1	ZINC000819050628	DG	On-Demand	Anodyne	DRD3	15	40
O[C@H](CNCCCCCN1CCCCC1)c1cccc(F)c1	ZINC000819050628	DG	On-Demand	Anodyne	ADRB3	54	44
O[C@H](CNCCCCCN1CCCCC1)c1cccc(F)c1	ZINC000819050628	DG	On-Demand	Anodyne	CHRNA7	17	42
O[C@H](CNCCCCCN1CCCCC1)c1cccc(F)c1	ZINC000819050628	DG	On-Demand	Anodyne	HNMT	51	36
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(F)c1	ZINC000819050629	DG	On-Demand	Anodyne	ADRB2	38	41
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(F)c1	ZINC000819050629	DG	On-Demand	Anodyne	ADRB1	43	44
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(F)c1	ZINC000819050629	DG	On-Demand	Anodyne	SLC6A1	17	40
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(F)c1	ZINC000819050629	DG	On-Demand	Anodyne	DRD3	15	40
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(F)c1	ZINC000819050629	DG	On-Demand	Anodyne	ADRB3	54	44
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(F)c1	ZINC000819050629	DG	On-Demand	Anodyne	CHRNA7	17	42
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(F)c1	ZINC000819050629	DG	On-Demand	Anodyne	HNMT	51	36
NC(=O)c1ccc(N2CCCCC2)c(NC(=O)C(F)=C2CCC2)c1	ZINC000819050631	EG	On-Demand	Anodyne	KCNQ2	62	34
O[C@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050636	DH	On-Demand	Anodyne	ADRB2	52	43
O[C@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050636	DH	On-Demand	Anodyne	ADRB1	62	51
O[C@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050636	DH	On-Demand	Anodyne	HTR1A	21	44
O[C@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050636	DH	On-Demand	Anodyne	DRD2	18	44
O[C@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050636	DH	On-Demand	Anodyne	HTR2A	23	44
O[C@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050636	DH	On-Demand	Anodyne	DRD3	31	44
O[C@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050636	DH	On-Demand	Anodyne	ADRB3	78	51
O[C@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050636	DH	On-Demand	Anodyne	IGF1R	27	40
O[C@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050636	DH	On-Demand	Anodyne	HRH3	24	43
O[C@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050636	DH	On-Demand	Anodyne	HNMT	66	43
O[C@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050636	DH	On-Demand	Anodyne	CYP3A4	46	35
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050637	DH	On-Demand	Anodyne	ADRB2	52	43
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050637	DH	On-Demand	Anodyne	ADRB1	62	51
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050637	DH	On-Demand	Anodyne	HTR1A	21	44
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050637	DH	On-Demand	Anodyne	DRD2	18	44
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050637	DH	On-Demand	Anodyne	HTR2A	23	44
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050637	DH	On-Demand	Anodyne	DRD3	31	44
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050637	DH	On-Demand	Anodyne	ADRB3	78	51
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050637	DH	On-Demand	Anodyne	IGF1R	27	40
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050637	DH	On-Demand	Anodyne	HRH3	24	43
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050637	DH	On-Demand	Anodyne	HNMT	66	43
O[C@@H](CNCCCCCN1CCCCC1)c1cccc(Cl)c1	ZINC000819050637	DH	On-Demand	Anodyne	CYP3A4	46	35
O[C@H](CNCCCCCN1CCCCC1)c1cc(F)ccc1F	ZINC000819050646	EG	On-Demand	Anodyne	ADRA1B	15	40
O[C@H](CNCCCCCN1CCCCC1)c1cc(F)ccc1F	ZINC000819050646	EG	On-Demand	Anodyne	HRH3	18	41
O[C@H](CNCCCCCN1CCCCC1)c1cc(F)ccc1F	ZINC000819050646	EG	On-Demand	Anodyne	CHRNA7	17	44
O[C@H](CNCCCCCN1CCCCC1)c1cc(F)ccc1F	ZINC000819050646	EG	On-Demand	Anodyne	HNMT	54	39
O[C@@H](CNCCCCCN1CCCCC1)c1cc(F)ccc1F	ZINC000819050647	EG	On-Demand	Anodyne	ADRA1B	15	40
O[C@@H](CNCCCCCN1CCCCC1)c1cc(F)ccc1F	ZINC000819050647	EG	On-Demand	Anodyne	HRH3	18	41
O[C@@H](CNCCCCCN1CCCCC1)c1cc(F)ccc1F	ZINC000819050647	EG	On-Demand	Anodyne	CHRNA7	17	44
O[C@@H](CNCCCCCN1CCCCC1)c1cc(F)ccc1F	ZINC000819050647	EG	On-Demand	Anodyne	HNMT	54	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(N3CCCCC3)nc1)C2	ZINC000819050679	FF	On-Demand	Anodyne	DGAT1	38	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(N3CCCCC3)nc1)C2	ZINC000819050680	FF	On-Demand	Anodyne	DGAT1	38	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)c1ccc3c(c1)OCO3)C2	ZINC000819050682	FE	On-Demand	Anodyne	KCNQ2	21	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)c1ccc3c(c1)OCO3)C2	ZINC000819050683	FE	On-Demand	Anodyne	KCNQ2	21	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)c1ccc3c(c1)OCO3)C2	ZINC000819050684	FE	On-Demand	Anodyne	KCNQ2	21	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)c1ccc3c(c1)OCO3)C2	ZINC000819050685	FE	On-Demand	Anodyne	KCNQ2	21	41
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819050689	ED	On-Demand	Mild	ADRB1	35	45
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819050689	ED	On-Demand	Mild	ADRB3	49	45
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccccc1NC(=O)C1CC1	ZINC000819050698	IG	On-Demand	Anodyne	NR2E3	33	40
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccccc1NC(=O)C1CC1	ZINC000819050698	IG	On-Demand	Anodyne	KCNK3	62	41
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccccc1NC(=O)C1CC1	ZINC000819050698	IG	On-Demand	Anodyne	KCNK9	48	34
N#C/C(=C\c1ccc(O)cc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050735	HF	On-Demand	Reactive	CA12	16	52
N#C/C(=C/c1ccc(O)cc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050736	HF	On-Demand	Reactive	CA12	16	52
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(-n2ccnc2)nc1	ZINC000819050743	HE	On-Demand	Anodyne	NAMPT	24	42
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819050759	ED	On-Demand	Mild	ADRB1	35	45
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819050759	ED	On-Demand	Mild	ADRB3	49	45
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819050760	ED	On-Demand	Mild	ADRB1	35	45
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819050760	ED	On-Demand	Mild	ADRB3	49	45
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819050761	ED	On-Demand	Mild	ADRB1	35	45
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819050761	ED	On-Demand	Mild	ADRB3	49	45
O=[N+]([O-])c1cccc([C@H](O)CNCCCCCN2CCCCC2)c1	ZINC000819050764	EF	On-Demand	Bother	ADRB2	35	40
O=[N+]([O-])c1cccc([C@H](O)CNCCCCCN2CCCCC2)c1	ZINC000819050764	EF	On-Demand	Bother	ADRB1	44	39
O=[N+]([O-])c1cccc([C@H](O)CNCCCCCN2CCCCC2)c1	ZINC000819050764	EF	On-Demand	Bother	ADRB3	59	41
O=[N+]([O-])c1cccc([C@H](O)CNCCCCCN2CCCCC2)c1	ZINC000819050764	EF	On-Demand	Bother	HNMT	40	33
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCCN2CCCCC2)c1	ZINC000819050765	EF	On-Demand	Bother	ADRB2	35	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCCN2CCCCC2)c1	ZINC000819050765	EF	On-Demand	Bother	ADRB1	44	39
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCCN2CCCCC2)c1	ZINC000819050765	EF	On-Demand	Bother	ADRB3	59	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCCN2CCCCC2)c1	ZINC000819050765	EF	On-Demand	Bother	HNMT	40	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819050774	GE	On-Demand	Anodyne	L3MBTL3	49	35
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1c(C(F)(F)F)ccnc1Cl	ZINC000819050781	IH	On-Demand	Anodyne	TYK2	74	42
C[C@@H](CC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)n1cccn1	ZINC000819050803	EE	On-Demand	Anodyne	FABI	43	36
C[C@@H](CC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)n1cccn1	ZINC000819050803	EE	On-Demand	Anodyne	L3MBTL3	40	36
C[C@H](CC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)n1cccn1	ZINC000819050806	EE	On-Demand	Anodyne	FABI	43	36
C[C@H](CC(=O)NCc1ccc(C(=O)N2CCCC2)cc1)n1cccn1	ZINC000819050806	EE	On-Demand	Anodyne	L3MBTL3	40	36
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050814	GD	On-Demand	Anodyne	ADRB3	27	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050814	GD	On-Demand	Anodyne	CCR8	27	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050814	GD	On-Demand	Anodyne	GPR119	85	55
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050814	GD	On-Demand	Anodyne	SFRP1	102	43
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050814	GD	On-Demand	Anodyne	WNT3	70	38
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050817	GD	On-Demand	Anodyne	ADRB3	27	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050817	GD	On-Demand	Anodyne	CCR8	27	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050817	GD	On-Demand	Anodyne	GPR119	85	55
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050817	GD	On-Demand	Anodyne	SFRP1	102	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050817	GD	On-Demand	Anodyne	WNT3	70	38
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050820	GD	On-Demand	Anodyne	ADRB3	27	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050820	GD	On-Demand	Anodyne	CCR8	27	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050820	GD	On-Demand	Anodyne	GPR119	85	55
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050820	GD	On-Demand	Anodyne	SFRP1	102	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050820	GD	On-Demand	Anodyne	WNT3	70	38
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050823	GD	On-Demand	Anodyne	ADRB3	27	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050823	GD	On-Demand	Anodyne	CCR8	27	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050823	GD	On-Demand	Anodyne	GPR119	85	55
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050823	GD	On-Demand	Anodyne	SFRP1	102	43
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819050823	GD	On-Demand	Anodyne	WNT3	70	38
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(N2CCCC2)nc1	ZINC000819050834	CE	On-Demand	Anodyne	DGAT1	41	42
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(N2CCCC2)nc1	ZINC000819050836	CE	On-Demand	Anodyne	DGAT1	41	42
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(N2CCCC2)nc1	ZINC000819050837	CE	On-Demand	Anodyne	DGAT1	41	42
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(N2CCCC2)nc1	ZINC000819050839	CE	On-Demand	Anodyne	DGAT1	41	42
O=C1c2ccccc2C(=O)N1CCCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819050841	GE	On-Demand	Bother	ADRB3	45	38
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819050844	GE	On-Demand	Bother	ADRB3	45	38
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819050847	FF	On-Demand	Anodyne	ADRB2	34	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819050847	FF	On-Demand	Anodyne	ADRB1	55	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819050847	FF	On-Demand	Anodyne	ADRB3	45	45
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819050847	FF	On-Demand	Anodyne	GPR119	48	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819050849	FF	On-Demand	Anodyne	ADRB2	34	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819050849	FF	On-Demand	Anodyne	ADRB1	55	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819050849	FF	On-Demand	Anodyne	ADRB3	45	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819050849	FF	On-Demand	Anodyne	GPR119	48	43
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819050851	FF	On-Demand	Anodyne	ADRB2	34	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819050851	FF	On-Demand	Anodyne	ADRB1	55	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819050851	FF	On-Demand	Anodyne	ADRB3	45	45
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819050851	FF	On-Demand	Anodyne	GPR119	48	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819050854	FF	On-Demand	Anodyne	ADRB2	34	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819050854	FF	On-Demand	Anodyne	ADRB1	55	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819050854	FF	On-Demand	Anodyne	ADRB3	45	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819050854	FF	On-Demand	Anodyne	GPR119	48	43
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819050857	GD	On-Demand	Mild	ADRB1	51	37
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819050857	GD	On-Demand	Mild	PDS	45	39
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819050859	GD	On-Demand	Mild	ADRB1	51	37
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819050859	GD	On-Demand	Mild	PDS	45	39
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819050861	GD	On-Demand	Mild	ADRB1	51	37
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819050861	GD	On-Demand	Mild	PDS	45	39
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819050865	GD	On-Demand	Mild	ADRB1	51	37
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819050865	GD	On-Demand	Mild	PDS	45	39
CSc1ccc(OC[C@@H](O)CNCCN/C(O)=C2\N=CC=CC2=O)cc1	ZINC000819050890	GD	On-Demand	Mild	ADRB1	58	38
CC(=O)CCCCCCC(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050892	GH	On-Demand	Anodyne	HDAC10	36	43
CC(=O)CCCCCCC(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050892	GH	On-Demand	Anodyne	HDAC1	19	41
CC(=O)CCCCCCC(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050892	GH	On-Demand	Anodyne	HDAC3	42	39
CC(=O)CCCCCCC(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819050892	GH	On-Demand	Anodyne	HDAC6	34	40
CSc1ccc(OC[C@@H](O)CNCCN/C(O)=C2/N=CC=CC2=O)cc1	ZINC000819050893	GD	On-Demand	Mild	ADRB1	58	38
CSc1ccc(OC[C@H](O)CNCCN/C(O)=C2\N=CC=CC2=O)cc1	ZINC000819050896	GD	On-Demand	Mild	ADRB1	58	38
CSc1ccc(OC[C@H](O)CNCCN/C(O)=C2/N=CC=CC2=O)cc1	ZINC000819050898	GD	On-Demand	Mild	ADRB1	58	38
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cc(C(F)(F)F)cnc1Cl	ZINC000819050906	IH	On-Demand	Anodyne	ATF1	55	35
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cc(C(F)(F)F)cnc1Cl	ZINC000819050906	IH	On-Demand	Anodyne	NFKB1	51	35
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cc(C(F)(F)F)cnc1Cl	ZINC000819050906	IH	On-Demand	Anodyne	BTK	24	41
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cccn1Cc1ccncc1	ZINC000819050909	IG	On-Demand	Anodyne	NAMPT	20	42
C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819050937	GI	On-Demand	Mild	PAPA1_CARPA	43	44
C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819050937	GI	On-Demand	Mild	CTSK	19	41
C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819050938	GI	On-Demand	Mild	PAPA1_CARPA	43	44
C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819050938	GI	On-Demand	Mild	CTSK	19	41
O[C@H](CNCCCCCN1CCCCC1)c1cc2ccccc2o1	ZINC000819050941	EH	On-Demand	Anodyne	DRD2	15	42
O[C@H](CNCCCCCN1CCCCC1)c1cc2ccccc2o1	ZINC000819050941	EH	On-Demand	Anodyne	DRD3	31	44
O[C@H](CNCCCCCN1CCCCC1)c1cc2ccccc2o1	ZINC000819050941	EH	On-Demand	Anodyne	SIGMAR1	20	41
O[C@H](CNCCCCCN1CCCCC1)c1cc2ccccc2o1	ZINC000819050941	EH	On-Demand	Anodyne	CHRNA7	20	41
O[C@H](CNCCCCCN1CCCCC1)c1cc2ccccc2o1	ZINC000819050941	EH	On-Demand	Anodyne	HNMT	55	37
O[C@@H](CNCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819050943	FF	On-Demand	Anodyne	ESR1	70	38
O[C@@H](CNCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819050943	FF	On-Demand	Anodyne	ESR2	48	38
O[C@@H](CNCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819050943	FF	On-Demand	Anodyne	LTA4H	55	49
O[C@@H](CNCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819050943	FF	On-Demand	Anodyne	HRH3	47	41
O[C@@H](CNCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819050943	FF	On-Demand	Anodyne	PSMB2	43	45
O[C@@H](CNCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819050943	FF	On-Demand	Anodyne	PSMB1	47	45
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819050945	FF	On-Demand	Anodyne	ESR1	70	38
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819050945	FF	On-Demand	Anodyne	ESR2	48	38
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819050945	FF	On-Demand	Anodyne	LTA4H	55	49
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819050945	FF	On-Demand	Anodyne	HRH3	47	41
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819050945	FF	On-Demand	Anodyne	PSMB2	43	45
O[C@H](CNCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819050945	FF	On-Demand	Anodyne	PSMB1	47	45
CCc1cccc2c(CCNC[C@H](O)c3cccc([N+](=O)[O-])c3)c[nH]c12	ZINC000819050955	FH	On-Demand	Bother	ADRB2	39	49
CCc1cccc2c(CCNC[C@H](O)c3cccc([N+](=O)[O-])c3)c[nH]c12	ZINC000819050955	FH	On-Demand	Bother	ADRB1	39	49
CCc1cccc2c(CCNC[C@H](O)c3cccc([N+](=O)[O-])c3)c[nH]c12	ZINC000819050955	FH	On-Demand	Bother	ADRB3	65	52
CCc1cccc2c(CCNC[C@@H](O)c3cccc([N+](=O)[O-])c3)c[nH]c12	ZINC000819050957	FH	On-Demand	Bother	ADRB2	39	49
CCc1cccc2c(CCNC[C@@H](O)c3cccc([N+](=O)[O-])c3)c[nH]c12	ZINC000819050957	FH	On-Demand	Bother	ADRB1	39	49
CCc1cccc2c(CCNC[C@@H](O)c3cccc([N+](=O)[O-])c3)c[nH]c12	ZINC000819050957	FH	On-Demand	Bother	ADRB3	65	52
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819050963	EE	On-Demand	Anodyne	L3MBTL3	80	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819050964	GG	On-Demand	Anodyne	ADRB3	22	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819050964	GG	On-Demand	Anodyne	GPR119	41	40
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819050965	EE	On-Demand	Anodyne	L3MBTL3	80	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819050966	GG	On-Demand	Anodyne	ADRB3	22	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819050966	GG	On-Demand	Anodyne	GPR119	41	40
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819050967	EE	On-Demand	Anodyne	L3MBTL3	80	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819050968	GG	On-Demand	Anodyne	ADRB3	22	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819050968	GG	On-Demand	Anodyne	GPR119	41	40
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819050969	EE	On-Demand	Anodyne	L3MBTL3	80	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819050970	GG	On-Demand	Anodyne	ADRB3	22	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819050970	GG	On-Demand	Anodyne	GPR119	41	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccccc2F)C1	ZINC000819050988	FE	On-Demand	Anodyne	GPR119	37	54
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COCc2ccccc2F)C1	ZINC000819050989	FE	On-Demand	Anodyne	GPR119	37	54
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)c(Br)c1	ZINC000819050998	GH	On-Demand	Anodyne	ADRB2	35	40
O[C@H](CNCCCCCN1CCCCC1)c1ccc(F)c(Br)c1	ZINC000819050998	GH	On-Demand	Anodyne	HNMT	52	39
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)c(Br)c1	ZINC000819050999	GH	On-Demand	Anodyne	ADRB2	35	40
O[C@@H](CNCCCCCN1CCCCC1)c1ccc(F)c(Br)c1	ZINC000819050999	GH	On-Demand	Anodyne	HNMT	52	39
O=C(C(F)=C1CCC1)N1CCN(Cc2nc(-c3cccs3)no2)CC1	ZINC000819051004	FF	On-Demand	Anodyne	ETHR	49	44
O[C@@H](CNCCCCCN1CCCCC1)c1c(F)cccc1F	ZINC000819051018	EG	On-Demand	Anodyne	CHRNA7	20	44
O[C@@H](CNCCCCCN1CCCCC1)c1c(F)cccc1F	ZINC000819051018	EG	On-Demand	Anodyne	HNMT	60	38
O[C@H](CNCCCCCN1CCCCC1)c1c(F)cccc1F	ZINC000819051019	EG	On-Demand	Anodyne	CHRNA7	20	44
O[C@H](CNCCCCCN1CCCCC1)c1c(F)cccc1F	ZINC000819051019	EG	On-Demand	Anodyne	HNMT	60	38
NC(=O)CN1CCC(NC(=O)Cc2nsc3ccccc23)CC1	ZINC000819051020	EC	On-Demand	Anodyne	SIGMAR1	17	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(C(=O)N3CCCC3)cc1)C2	ZINC000819051025	GE	On-Demand	Anodyne	L3MBTL3	57	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(C(=O)N3CCCC3)cc1)C2	ZINC000819051026	GE	On-Demand	Anodyne	L3MBTL3	57	35
O=C(Cc1nsc2ccccc12)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819051029	GG	On-Demand	Anodyne	HTR1A	20	48
O=C(Cc1nsc2ccccc12)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819051029	GG	On-Demand	Anodyne	DRD2	18	48
O=C(Cc1nsc2ccccc12)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819051029	GG	On-Demand	Anodyne	L3MBTL3	54	35
O=C(Cc1nsc2ccccc12)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819051029	GG	On-Demand	Anodyne	NAMPT	18	43
CCc1cccc2c(CCNC[C@H](O)c3ccccc3)c[nH]c12	ZINC000819051035	DH	On-Demand	Anodyne	ADRB2	74	45
CCc1cccc2c(CCNC[C@H](O)c3ccccc3)c[nH]c12	ZINC000819051035	DH	On-Demand	Anodyne	ADRB1	68	51
CCc1cccc2c(CCNC[C@H](O)c3ccccc3)c[nH]c12	ZINC000819051035	DH	On-Demand	Anodyne	ADRB3	92	60
CCc1cccc2c(CCNC[C@@H](O)c3ccccc3)c[nH]c12	ZINC000819051036	DH	On-Demand	Anodyne	ADRB2	74	45
CCc1cccc2c(CCNC[C@@H](O)c3ccccc3)c[nH]c12	ZINC000819051036	DH	On-Demand	Anodyne	ADRB1	68	51
CCc1cccc2c(CCNC[C@@H](O)c3ccccc3)c[nH]c12	ZINC000819051036	DH	On-Demand	Anodyne	ADRB3	92	60
C=CC(=O)NCCC(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051043	FD	On-Demand	Anodyne	TGM2	46	39
C=CC(=O)NCCC(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051043	FD	On-Demand	Anodyne	F13A1	61	39
CON=Cc1ccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1	ZINC000819051065	HF	On-Demand	Mild	KCNK3	70	35
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cc(Cl)nc2ccccc12	ZINC000819051074	II	On-Demand	Anodyne	NR2E3	62	36
CCCCSCC(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051084	FG	On-Demand	Anodyne	EPHX2	16	42
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cc(Cl)ncc1Cl	ZINC000819051130	HH	On-Demand	Anodyne	TYK2	66	37
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cc(Cl)ncc1Cl	ZINC000819051130	HH	On-Demand	Anodyne	NR2E3	61	36
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccccc2F)C1	ZINC000819051137	FE	On-Demand	Anodyne	GPR119	37	54
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccccc2F)C1	ZINC000819051138	FE	On-Demand	Anodyne	GPR119	37	54
COc1cccc([S@](=O)CC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819051145	GD	On-Demand	Anodyne	DRD4	40	31
COc1cccc([S@](=O)CC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819051145	GD	On-Demand	Anodyne	GPR119	35	41
COc1cccc([S@@](=O)CC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819051146	GD	On-Demand	Anodyne	DRD4	40	31
COc1cccc([S@@](=O)CC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819051146	GD	On-Demand	Anodyne	GPR119	35	41
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051165	FE	On-Demand	Anodyne	ADRB2	37	46
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051165	FE	On-Demand	Anodyne	ADRB1	50	41
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051165	FE	On-Demand	Anodyne	ADRB3	37	46
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051165	FE	On-Demand	Anodyne	ACOX1	49	32
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051165	FE	On-Demand	Anodyne	GPR119	47	46
Cc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051166	FE	On-Demand	Anodyne	ADRB2	37	46
Cc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051166	FE	On-Demand	Anodyne	ADRB1	50	41
Cc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051166	FE	On-Demand	Anodyne	ADRB3	37	46
Cc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051166	FE	On-Demand	Anodyne	ACOX1	49	32
Cc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051166	FE	On-Demand	Anodyne	GPR119	47	46
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051167	FE	On-Demand	Anodyne	ADRB2	37	46
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051167	FE	On-Demand	Anodyne	ADRB1	50	41
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051167	FE	On-Demand	Anodyne	ADRB3	37	46
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051167	FE	On-Demand	Anodyne	ACOX1	49	32
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051167	FE	On-Demand	Anodyne	GPR119	47	46
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051168	FE	On-Demand	Anodyne	ADRB2	37	46
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051168	FE	On-Demand	Anodyne	ADRB1	50	41
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051168	FE	On-Demand	Anodyne	ADRB3	37	46
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051168	FE	On-Demand	Anodyne	ACOX1	49	32
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051168	FE	On-Demand	Anodyne	GPR119	47	46
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000819051170	FD	On-Demand	Anodyne	DRD4	24	46
O=C(/C=C\[C@H]1CCCO1)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000819051171	FD	On-Demand	Anodyne	DRD4	24	46
O=C(/C=C/[C@H]1CCCO1)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000819051172	FD	On-Demand	Anodyne	DRD4	24	46
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000819051173	FD	On-Demand	Anodyne	DRD4	24	46
CCN1CCCC[C@@H]1CNC[C@H](O)c1ccccc1Cl	ZINC000819051176	CF	On-Demand	Anodyne	OPRL1	38	41
CC(C)(C)OC(=O)N1CC[C@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819051191	GD	On-Demand	Mild	NR1H2	16	45
CC(C)(C)OC(=O)N1CC[C@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819051191	GD	On-Demand	Mild	GPR119	44	39
CC(C)(C)OC(=O)N1CC[C@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819051191	GD	On-Demand	Mild	SFRP1	119	43
CC(C)(C)OC(=O)N1CC[C@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819051191	GD	On-Demand	Mild	WNT3	79	38
CC(C)(C)OC(=O)N1CC[C@@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819051192	GD	On-Demand	Mild	NR1H2	16	45
CC(C)(C)OC(=O)N1CC[C@@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819051192	GD	On-Demand	Mild	GPR119	44	39
CC(C)(C)OC(=O)N1CC[C@@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819051192	GD	On-Demand	Mild	SFRP1	119	43
CC(C)(C)OC(=O)N1CC[C@@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819051192	GD	On-Demand	Mild	WNT3	79	38
C#CCNC(=O)CCN[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000819051202	FE	On-Demand	Mild	P2RX7	74	44
C#CCNC(=O)CCN[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000819051202	FE	On-Demand	Mild	CCR3	44	38
C#CCNC(=O)CCN[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000819051203	FE	On-Demand	Mild	P2RX7	74	44
C#CCNC(=O)CCN[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000819051203	FE	On-Demand	Mild	CCR3	44	38
CCN1CCCC[C@@H]1CNC[C@H](O)c1ccc(Br)cc1	ZINC000819051220	EF	On-Demand	Anodyne	DRD2	26	41
CCN1CCCC[C@@H]1CNC[C@@H](O)c1ccc(Br)cc1	ZINC000819051222	EF	On-Demand	Anodyne	DRD2	26	41
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1c(Cl)ccc(Cl)c1Cl	ZINC000819051237	IJ	On-Demand	Anodyne	TYK2	66	42
N#C/C(=C\c1ccc(F)cc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051240	HG	On-Demand	Reactive	CA12	15	42
N#C/C(=C\c1ccc(F)cc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051240	HG	On-Demand	Reactive	CA9	15	42
N#C/C(=C/c1ccc(F)cc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051241	HG	On-Demand	Reactive	CA12	15	42
N#C/C(=C/c1ccc(F)cc1)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051241	HG	On-Demand	Reactive	CA9	15	42
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@@H]1C[C@H]1Cc1ccccc1	ZINC000819051246	GG	On-Demand	Anodyne	NAMPT	15	44
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@@H]1C[C@@H]1Cc1ccccc1	ZINC000819051247	GG	On-Demand	Anodyne	NAMPT	15	44
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@H]1C[C@H]1Cc1ccccc1	ZINC000819051248	GG	On-Demand	Anodyne	NAMPT	15	44
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@H]1C[C@@H]1Cc1ccccc1	ZINC000819051249	GG	On-Demand	Anodyne	NAMPT	15	44
C/C(=C/C(=O)N1CCC[C@@](CO)(C(C)C)C1)c1cccc(C(F)(F)F)c1	ZINC000819051255	FI	On-Demand	Anodyne	CCR2	63	38
C/C(=C/C(=O)N1CCC[C@](CO)(C(C)C)C1)c1cccc(C(F)(F)F)c1	ZINC000819051258	FI	On-Demand	Anodyne	CCR2	63	38
O=Cc1cccc(OCCC(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)c1	ZINC000819051272	HF	On-Demand	Anodyne	EPHX2	18	45
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@H](F)c1ccc(C(F)(F)F)cc1	ZINC000819051273	II	On-Demand	Anodyne	EPHX2	17	50
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@@H](F)c1ccc(C(F)(F)F)cc1	ZINC000819051274	II	On-Demand	Anodyne	EPHX2	17	50
NC(=S)c1ccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1	ZINC000819051275	HF	On-Demand	Anodyne	KCNK3	72	42
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cnc(Cl)c(Cl)c1	ZINC000819051279	HH	On-Demand	Anodyne	TYK2	59	37
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cnc(Cl)c(Cl)c1	ZINC000819051279	HH	On-Demand	Anodyne	KCNK3	47	35
COc1cccc(C2=NO[C@H](C(=O)Nc3cccc(S(=O)(=O)C4CCOCC4)c3)C2)c1	ZINC000819051286	IF	On-Demand	Anodyne	TAAR1	27	40
COc1cccc(C2=NO[C@H](C(=O)Nc3cccc(S(=O)(=O)C4CCOCC4)c3)C2)c1	ZINC000819051286	IF	On-Demand	Anodyne	LUCI_PHOPY	19	41
COc1cccc(C2=NO[C@@H](C(=O)Nc3cccc(S(=O)(=O)C4CCOCC4)c3)C2)c1	ZINC000819051287	IF	On-Demand	Anodyne	TAAR1	27	40
COc1cccc(C2=NO[C@@H](C(=O)Nc3cccc(S(=O)(=O)C4CCOCC4)c3)C2)c1	ZINC000819051287	IF	On-Demand	Anodyne	LUCI_PHOPY	19	41
Cc1nsc(N2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)n1	ZINC000819051301	FD	On-Demand	Anodyne	FAAH	19	57
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(SC(F)(F)F)cc1	ZINC000819051305	IJ	On-Demand	Anodyne	KCNK3	64	38
Cc1oc(-c2ccco2)nc1CC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819051306	EG	On-Demand	Anodyne	PPARG	54	42
Cc1oc(-c2ccco2)nc1CC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819051306	EG	On-Demand	Anodyne	PPARA	63	42
Cc1nsc(N2CCCN(C(=O)Nc3ccccc3CC(=O)O)CC2)n1	ZINC000819051308	GE	On-Demand	Anodyne	KCNQ2	50	34
Cc1nsc(N2CCCN(C(=O)Nc3ccccc3CC(=O)O)CC2)n1	ZINC000819051308	GE	On-Demand	Anodyne	FAAH	17	53
Cc1oc(-c2ccco2)nc1CC(=O)N(CC(=O)O)c1ccc2c(c1)OCO2	ZINC000819051312	GF	On-Demand	Anodyne	PPARG	16	43
CC(C)(C)OC(=O)N1CC[C@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819051313	IF	On-Demand	Anodyne	EPHX2	34	45
CC(C)(C)OC(=O)N1CC[C@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819051313	IF	On-Demand	Anodyne	TGM2	15	41
CC(C)(C)OC(=O)N1CC[C@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819051313	IF	On-Demand	Anodyne	F13A1	23	41
CC(C)(C)OC(=O)N1CC[C@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819051313	IF	On-Demand	Anodyne	GPR119	44	43
CC(C)(C)OC(=O)N1CC[C@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819051313	IF	On-Demand	Anodyne	SFRP1	105	45
CC(C)(C)OC(=O)N1CC[C@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819051313	IF	On-Demand	Anodyne	WNT3	71	36
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819051314	IF	On-Demand	Anodyne	EPHX2	34	45
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819051314	IF	On-Demand	Anodyne	TGM2	15	41
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819051314	IF	On-Demand	Anodyne	F13A1	23	41
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819051314	IF	On-Demand	Anodyne	GPR119	44	43
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819051314	IF	On-Demand	Anodyne	SFRP1	105	45
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819051314	IF	On-Demand	Anodyne	WNT3	71	36
C/C(=C/C(=O)N1CCC[C@](CO)(C(C)C)C1)c1ccccc1C(F)(F)F	ZINC000819051323	FI	On-Demand	Anodyne	RBP4	57	35
C/C(=C/C(=O)N1CCC[C@@](CO)(C(C)C)C1)c1ccccc1C(F)(F)F	ZINC000819051325	FI	On-Demand	Anodyne	RBP4	57	35
O=C(CCN1CCOCC1)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051328	GD	On-Demand	Anodyne	CASR	43	46
O=C(CCN1CCOCC1)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051328	GD	On-Demand	Anodyne	EPHX2	33	52
O=C(CCN1CCOCC1)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051328	GD	On-Demand	Anodyne	ST14	42	37
C[C@H](C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(C(F)(F)F)cc1	ZINC000819051329	II	On-Demand	Anodyne	EPHX2	17	48
Cc1oc(-c2ccccc2)nc1CN[C@H](C(=O)O)C(C)C	ZINC000819051331	CF	On-Demand	Anodyne	PPARG	99	48
Cc1oc(-c2ccccc2)nc1CN[C@H](C(=O)O)C(C)C	ZINC000819051331	CF	On-Demand	Anodyne	PPARA	107	53
Cc1oc(-c2ccccc2)nc1CN[C@H](C(=O)O)C(C)C	ZINC000819051331	CF	On-Demand	Anodyne	PDE8B	68	39
Cc1oc(-c2ccccc2)nc1C[S@](=O)Cc1ccc(C(=O)O)cc1	ZINC000819051333	FH	On-Demand	Anodyne	PPARG	94	48
Cc1oc(-c2ccccc2)nc1C[S@](=O)Cc1ccc(C(=O)O)cc1	ZINC000819051333	FH	On-Demand	Anodyne	PPARA	103	48
Cc1oc(-c2ccccc2)nc1C[S@](=O)Cc1ccc(C(=O)O)cc1	ZINC000819051333	FH	On-Demand	Anodyne	PDE8B	61	35
Cc1oc(-c2ccccc2)nc1C[S@@](=O)Cc1ccc(C(=O)O)cc1	ZINC000819051335	FH	On-Demand	Anodyne	PPARG	94	48
Cc1oc(-c2ccccc2)nc1C[S@@](=O)Cc1ccc(C(=O)O)cc1	ZINC000819051335	FH	On-Demand	Anodyne	PPARA	103	48
Cc1oc(-c2ccccc2)nc1C[S@@](=O)Cc1ccc(C(=O)O)cc1	ZINC000819051335	FH	On-Demand	Anodyne	PDE8B	61	35
CCCCCCCCC(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051347	GI	On-Demand	Mild	HDAC10	36	43
CCCCCCCCC(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051347	GI	On-Demand	Mild	HDAC1	16	42
CCCCCCCCC(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051347	GI	On-Demand	Mild	HDAC2	23	43
CCCCCCCCC(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051347	GI	On-Demand	Mild	HDAC3	42	39
CCCCCCCCC(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051347	GI	On-Demand	Mild	HDAC6	34	40
CCCCCCCCC(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051347	GI	On-Demand	Mild	LASR	48	37
O=C(Cn1cccc(C(F)(F)F)c1=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051348	IE	On-Demand	Anodyne	SFRP1	47	34
Cc1nonc1CNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819051350	CD	On-Demand	Anodyne	P2RX1	17	42
C=C(CN(C)C)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051359	FD	On-Demand	Mild	CASR	21	41
Cc1nsc(N2CCN(C(=O)Nc3cccc(CC(=O)O)c3)CC2)n1	ZINC000819051370	FD	On-Demand	Anodyne	HTR1D	25	40
Cc1nsc(N2CCN(C(=O)Nc3cccc(CC(=O)O)c3)CC2)n1	ZINC000819051370	FD	On-Demand	Anodyne	HTR1B	25	40
Cc1nsc(N2CCN(C(=O)Nc3cccc(CC(=O)O)c3)CC2)n1	ZINC000819051370	FD	On-Demand	Anodyne	FAAH	25	60
Cc1nsc(N2CCN(C(=O)Nc3cccc(CC(=O)O)c3)CC2)n1	ZINC000819051370	FD	On-Demand	Anodyne	P2RY14	54	40
Cc1nonc1CNC(=O)Nc1cccc(CC(=O)O)c1	ZINC000819051391	CD	On-Demand	Anodyne	ROCK2	20	40
Cc1oc(-c2ccccc2)nc1CS(=O)(=O)Cc1ccc(C(=O)O)cc1	ZINC000819051409	FG	On-Demand	Anodyne	PPARG	96	48
Cc1oc(-c2ccccc2)nc1CS(=O)(=O)Cc1ccc(C(=O)O)cc1	ZINC000819051409	FG	On-Demand	Anodyne	PPARA	105	48
Cc1oc(-c2ccccc2)nc1CS(=O)(=O)Cc1ccc(C(=O)O)cc1	ZINC000819051409	FG	On-Demand	Anodyne	PDE8B	61	35
Cc1nsc(N2CCCN(C(=O)Nc3cccc(CC(=O)O)c3)CC2)n1	ZINC000819051414	GE	On-Demand	Anodyne	FAAH	21	56
Cc1nsc(N2CCCN(C(=O)Nc3cccc(CC(=O)O)c3)CC2)n1	ZINC000819051414	GE	On-Demand	Anodyne	P2RY14	54	40
Cc1oc(-c2ccccc2)nc1C(=O)N(CC(=O)O)c1ccc2c(c1)OCO2	ZINC000819051417	GG	On-Demand	Anodyne	PPARG	48	52
Cc1oc(-c2ccccc2)nc1C(=O)N(CC(=O)O)c1ccc2c(c1)OCO2	ZINC000819051417	GG	On-Demand	Anodyne	PPARA	50	52
Cc1oc(-c2ccccc2)nc1C(=O)N(CC(=O)O)c1ccc2c(c1)OCO2	ZINC000819051417	GG	On-Demand	Anodyne	PDE8B	55	32
O[C@@H](CN[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1)c1cccnc1	ZINC000819051446	FG	On-Demand	Anodyne	ADRB3	41	41
O[C@@H](CN[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1)c1cccnc1	ZINC000819051446	FG	On-Demand	Anodyne	P2RX7	39	41
O[C@H](CN[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1)c1cccnc1	ZINC000819051447	FG	On-Demand	Anodyne	ADRB3	41	41
O[C@H](CN[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1)c1cccnc1	ZINC000819051447	FG	On-Demand	Anodyne	P2RX7	39	41
O[C@@H](CN[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1)c1cccnc1	ZINC000819051448	FG	On-Demand	Anodyne	ADRB3	41	41
O[C@@H](CN[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1)c1cccnc1	ZINC000819051448	FG	On-Demand	Anodyne	P2RX7	39	41
O[C@H](CN[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1)c1cccnc1	ZINC000819051449	FG	On-Demand	Anodyne	ADRB3	41	41
O[C@H](CN[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1)c1cccnc1	ZINC000819051449	FG	On-Demand	Anodyne	P2RX7	39	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819051456	FE	On-Demand	Anodyne	GHSR	37	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819051456	FE	On-Demand	Anodyne	CCR8	29	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819051456	FE	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819051456	FE	On-Demand	Anodyne	SFRP1	69	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819051456	FE	On-Demand	Anodyne	WNT3	52	35
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819051457	FE	On-Demand	Anodyne	GHSR	37	45
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819051457	FE	On-Demand	Anodyne	CCR8	29	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819051457	FE	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819051457	FE	On-Demand	Anodyne	SFRP1	69	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819051457	FE	On-Demand	Anodyne	WNT3	52	35
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819051458	FE	On-Demand	Anodyne	GHSR	37	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819051458	FE	On-Demand	Anodyne	CCR8	29	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819051458	FE	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819051458	FE	On-Demand	Anodyne	SFRP1	69	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819051458	FE	On-Demand	Anodyne	WNT3	52	35
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819051459	FE	On-Demand	Anodyne	GHSR	37	45
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819051459	FE	On-Demand	Anodyne	CCR8	29	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819051459	FE	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819051459	FE	On-Demand	Anodyne	SFRP1	69	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819051459	FE	On-Demand	Anodyne	WNT3	52	35
O=C1c2ccccc2C(=O)N1CCCCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819051460	FF	On-Demand	Anodyne	ADRB2	48	37
O=C1c2ccccc2C(=O)N1CCCCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819051460	FF	On-Demand	Anodyne	ADRB1	40	42
O=C1c2ccccc2C(=O)N1CCCCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819051460	FF	On-Demand	Anodyne	ADRB3	46	42
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819051461	FF	On-Demand	Anodyne	ADRB2	48	37
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819051461	FF	On-Demand	Anodyne	ADRB1	40	42
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819051461	FF	On-Demand	Anodyne	ADRB3	46	42
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051481	GD	On-Demand	Anodyne	ADRB2	40	53
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051481	GD	On-Demand	Anodyne	ADRB1	73	53
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051481	GD	On-Demand	Anodyne	ADRB3	52	44
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051482	GD	On-Demand	Anodyne	ADRB2	40	53
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051482	GD	On-Demand	Anodyne	ADRB1	73	53
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051482	GD	On-Demand	Anodyne	ADRB3	52	44
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051483	GD	On-Demand	Anodyne	ADRB2	40	53
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051483	GD	On-Demand	Anodyne	ADRB1	73	53
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051483	GD	On-Demand	Anodyne	ADRB3	52	44
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051484	GD	On-Demand	Anodyne	ADRB2	40	53
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051484	GD	On-Demand	Anodyne	ADRB1	73	53
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051484	GD	On-Demand	Anodyne	ADRB3	52	44
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819051496	GG	On-Demand	Anodyne	RBP4	60	35
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819051496	GG	On-Demand	Anodyne	GPR119	33	46
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819051496	GG	On-Demand	Anodyne	SFRP1	134	47
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819051496	GG	On-Demand	Anodyne	WNT3	92	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819051497	GG	On-Demand	Anodyne	RBP4	60	35
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819051497	GG	On-Demand	Anodyne	GPR119	33	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819051497	GG	On-Demand	Anodyne	SFRP1	134	47
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819051497	GG	On-Demand	Anodyne	WNT3	92	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819051498	GG	On-Demand	Anodyne	RBP4	60	35
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819051498	GG	On-Demand	Anodyne	GPR119	33	46
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819051498	GG	On-Demand	Anodyne	SFRP1	134	47
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819051498	GG	On-Demand	Anodyne	WNT3	92	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819051499	GG	On-Demand	Anodyne	RBP4	60	35
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819051499	GG	On-Demand	Anodyne	GPR119	33	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819051499	GG	On-Demand	Anodyne	SFRP1	134	47
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819051499	GG	On-Demand	Anodyne	WNT3	92	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccccc2Cl)C1	ZINC000819051504	GF	On-Demand	Anodyne	GPR119	29	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COCc2ccccc2Cl)C1	ZINC000819051505	GF	On-Demand	Anodyne	GPR119	29	43
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccccc2Cl)C1	ZINC000819051506	GF	On-Demand	Anodyne	GPR119	29	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccccc2Cl)C1	ZINC000819051507	GF	On-Demand	Anodyne	GPR119	29	43
O=C(Nc1ccc(N2CCCC2)nc1)C(F)=C1CCC1	ZINC000819051508	CG	On-Demand	Anodyne	DGAT1	40	42
O=C(Nc1ccc(N2CCCC2)nc1)C(F)=C1CCC1	ZINC000819051508	CG	On-Demand	Anodyne	SLC27A1	39	41
O=C1c2ccccc2C(=O)N1CCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819051509	FG	On-Demand	Anodyne	ADRB2	66	38
O=C1c2ccccc2C(=O)N1CCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819051509	FG	On-Demand	Anodyne	ADRB1	65	53
O=C1c2ccccc2C(=O)N1CCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819051509	FG	On-Demand	Anodyne	ADRB3	83	53
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819051510	FG	On-Demand	Anodyne	ADRB2	66	38
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819051510	FG	On-Demand	Anodyne	ADRB1	65	53
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819051510	FG	On-Demand	Anodyne	ADRB3	83	53
NC(=O)Nc1ccc(CNC(=O)C(F)=C2CCC2)cc1	ZINC000819051529	CE	On-Demand	Anodyne	TPSAB1	15	44
CC(C)(C)OC(=O)N1CC[C@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819051538	GD	On-Demand	Mild	GPR119	51	44
CC(C)(C)OC(=O)N1CC[C@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819051538	GD	On-Demand	Mild	SFRP1	90	41
CC(C)(C)OC(=O)N1CC[C@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819051538	GD	On-Demand	Mild	WNT3	63	36
CC(C)(C)OC(=O)N1CC[C@@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819051539	GD	On-Demand	Mild	GPR119	51	44
CC(C)(C)OC(=O)N1CC[C@@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819051539	GD	On-Demand	Mild	SFRP1	90	41
CC(C)(C)OC(=O)N1CC[C@@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819051539	GD	On-Demand	Mild	WNT3	63	36
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819051540	FF	On-Demand	Anodyne	ADRB2	37	49
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819051540	FF	On-Demand	Anodyne	ADRB1	38	49
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819051540	FF	On-Demand	Anodyne	ADRB3	34	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819051540	FF	On-Demand	Anodyne	ABCB1	45	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819051540	FF	On-Demand	Anodyne	GPR119	33	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819051540	FF	On-Demand	Anodyne	SFRP1	55	39
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819051540	FF	On-Demand	Anodyne	WNT3	42	35
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819051541	FF	On-Demand	Anodyne	ADRB2	37	49
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819051541	FF	On-Demand	Anodyne	ADRB1	38	49
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819051541	FF	On-Demand	Anodyne	ADRB3	34	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819051541	FF	On-Demand	Anodyne	ABCB1	45	46
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819051541	FF	On-Demand	Anodyne	GPR119	33	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819051541	FF	On-Demand	Anodyne	SFRP1	55	39
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819051541	FF	On-Demand	Anodyne	WNT3	42	35
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819051542	FF	On-Demand	Anodyne	ADRB2	37	49
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819051542	FF	On-Demand	Anodyne	ADRB1	38	49
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819051542	FF	On-Demand	Anodyne	ADRB3	34	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819051542	FF	On-Demand	Anodyne	ABCB1	45	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819051542	FF	On-Demand	Anodyne	GPR119	33	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819051542	FF	On-Demand	Anodyne	SFRP1	55	39
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819051542	FF	On-Demand	Anodyne	WNT3	42	35
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1c(O)cccc1Cl	ZINC000819051581	GG	On-Demand	Anodyne	ITGA4	44	34
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1c(O)cccc1Cl	ZINC000819051581	GG	On-Demand	Anodyne	TYK2	77	47
O=C(CCN1CCOC1=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051599	GD	On-Demand	Anodyne	ST14	40	35
C=CC(=O)NCc1ccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1	ZINC000819051618	IF	On-Demand	Anodyne	TGM2	53	41
C=CC(=O)NCc1ccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1	ZINC000819051618	IF	On-Demand	Anodyne	F13A1	42	39
C=CC(=O)NCc1ccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1	ZINC000819051618	IF	On-Demand	Anodyne	NAMPT	51	47
C=CC(=O)NCc1ccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1	ZINC000819051618	IF	On-Demand	Anodyne	KCNK3	44	35
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cccc(C2OCCO2)c1	ZINC000819051631	HF	On-Demand	Anodyne	KCNK3	92	38
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cccc(C2OCCO2)c1	ZINC000819051631	HF	On-Demand	Anodyne	KCNK9	45	36
NS(=O)(=O)c1cc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)ccc1F	ZINC000819051646	ID	On-Demand	Anodyne	CA2	15	47
NS(=O)(=O)c1cc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)ccc1F	ZINC000819051646	ID	On-Demand	Anodyne	CA4	22	47
NS(=O)(=O)c1cc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)ccc1F	ZINC000819051646	ID	On-Demand	Anodyne	KCNK3	57	36
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819051652	FF	On-Demand	Anodyne	ADRB2	37	49
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819051652	FF	On-Demand	Anodyne	ADRB1	38	49
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819051652	FF	On-Demand	Anodyne	ADRB3	34	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819051652	FF	On-Demand	Anodyne	ABCB1	45	46
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819051652	FF	On-Demand	Anodyne	GPR119	33	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819051652	FF	On-Demand	Anodyne	SFRP1	55	39
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819051652	FF	On-Demand	Anodyne	WNT3	42	35
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@H](OC1CCCC1)c1ccccc1	ZINC000819051689	II	On-Demand	Anodyne	CASR	22	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819051691	EF	On-Demand	Anodyne	GPR119	48	53
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819051692	EF	On-Demand	Anodyne	GPR119	48	53
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819051693	EF	On-Demand	Anodyne	GPR119	48	53
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819051694	EF	On-Demand	Anodyne	GPR119	48	53
Cc1c(F)cccc1NC(=O)CCN[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819051698	FG	On-Demand	Anodyne	CCR8	57	39
Cc1c(F)cccc1NC(=O)CCN[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819051698	FG	On-Demand	Anodyne	GPR119	46	46
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@@H](OC1CCCC1)c1ccccc1	ZINC000819051699	II	On-Demand	Anodyne	CASR	22	41
Cc1c(F)cccc1NC(=O)CCN[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819051700	FG	On-Demand	Anodyne	CCR8	57	39
Cc1c(F)cccc1NC(=O)CCN[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819051700	FG	On-Demand	Anodyne	GPR119	46	46
O[C@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1cc2ccccc2o1	ZINC000819051713	GI	On-Demand	Anodyne	KCNH2	30	41
O[C@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1cc2ccccc2o1	ZINC000819051713	GI	On-Demand	Anodyne	LTA4H	16	41
O[C@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1cc2ccccc2o1	ZINC000819051713	GI	On-Demand	Anodyne	SIGMAR1	17	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051718	GD	On-Demand	Bother	ADRB2	29	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051718	GD	On-Demand	Bother	ADRB1	24	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051718	GD	On-Demand	Bother	ADRB3	23	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051718	GD	On-Demand	Bother	ABCB1	23	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051718	GD	On-Demand	Bother	WNT3	42	36
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051719	GD	On-Demand	Bother	ADRB2	29	46
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051719	GD	On-Demand	Bother	ADRB1	24	46
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051719	GD	On-Demand	Bother	ADRB3	23	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051719	GD	On-Demand	Bother	ABCB1	23	44
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051719	GD	On-Demand	Bother	WNT3	42	36
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051721	GD	On-Demand	Bother	ADRB2	29	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051721	GD	On-Demand	Bother	ADRB1	24	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051721	GD	On-Demand	Bother	ADRB3	23	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051721	GD	On-Demand	Bother	ABCB1	23	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051721	GD	On-Demand	Bother	WNT3	42	36
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051722	GD	On-Demand	Bother	ADRB2	29	46
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051722	GD	On-Demand	Bother	ADRB1	24	46
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051722	GD	On-Demand	Bother	ADRB3	23	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051722	GD	On-Demand	Bother	ABCB1	23	44
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819051722	GD	On-Demand	Bother	WNT3	42	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(N3CCCC3)nc1)C2	ZINC000819051724	FE	On-Demand	Anodyne	DGAT1	39	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(N3CCCC3)nc1)C2	ZINC000819051726	FE	On-Demand	Anodyne	DGAT1	39	40
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2cccc(F)c2)C1	ZINC000819051733	FF	On-Demand	Anodyne	CCR3	36	41
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2cccc(F)c2)C1	ZINC000819051733	FF	On-Demand	Anodyne	MLNR	25	41
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2cccc(F)c2)C1	ZINC000819051733	FF	On-Demand	Anodyne	EPHX2	20	48
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2cccc(F)c2)C1	ZINC000819051733	FF	On-Demand	Anodyne	GPR119	38	49
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2cccc(F)c2)C1	ZINC000819051733	FF	On-Demand	Anodyne	SFRP1	46	39
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2cccc(F)c2)C1	ZINC000819051734	FF	On-Demand	Anodyne	CCR3	36	41
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2cccc(F)c2)C1	ZINC000819051734	FF	On-Demand	Anodyne	MLNR	25	41
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2cccc(F)c2)C1	ZINC000819051734	FF	On-Demand	Anodyne	EPHX2	20	48
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2cccc(F)c2)C1	ZINC000819051734	FF	On-Demand	Anodyne	GPR119	38	49
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2cccc(F)c2)C1	ZINC000819051734	FF	On-Demand	Anodyne	SFRP1	46	39
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2ccccc2F)C1	ZINC000819051749	FF	On-Demand	Anodyne	CCR8	81	43
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2ccccc2F)C1	ZINC000819051749	FF	On-Demand	Anodyne	GPR119	44	48
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2ccccc2F)C1	ZINC000819051749	FF	On-Demand	Anodyne	SFRP1	66	40
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2ccccc2F)C1	ZINC000819051749	FF	On-Demand	Anodyne	WNT3	41	35
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2ccccc2F)C1	ZINC000819051750	FF	On-Demand	Anodyne	CCR8	81	43
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2ccccc2F)C1	ZINC000819051750	FF	On-Demand	Anodyne	GPR119	44	48
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2ccccc2F)C1	ZINC000819051750	FF	On-Demand	Anodyne	SFRP1	66	40
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2ccccc2F)C1	ZINC000819051750	FF	On-Demand	Anodyne	WNT3	41	35
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000819051752	GF	On-Demand	Bother	CCR8	60	41
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000819051752	GF	On-Demand	Bother	SFRP1	41	38
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000819051752	GF	On-Demand	Bother	WNT3	42	37
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000819051753	GF	On-Demand	Bother	CCR8	60	41
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000819051753	GF	On-Demand	Bother	SFRP1	41	38
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000819051753	GF	On-Demand	Bother	WNT3	42	37
O=C(NC1CCN(C(=O)c2ccco2)CC1)C(F)=C1CCC1	ZINC000819051755	DE	On-Demand	Anodyne	L3MBTL3	40	37
CC(C)(C)OC(=O)N1CCN(C(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819051767	GG	On-Demand	Anodyne	GPR119	35	43
CON(C)C(=O)CCN[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000819051768	FE	On-Demand	Anodyne	P2RX7	63	42
CON(C)C(=O)CCN[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000819051768	FE	On-Demand	Anodyne	CCR3	40	38
CON(C)C(=O)CCN[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000819051769	FE	On-Demand	Anodyne	P2RX7	63	42
CON(C)C(=O)CCN[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000819051769	FE	On-Demand	Anodyne	CCR3	40	38
O=C(Cn1cnc2sccc2c1=O)OCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2	ZINC000819051772	JE	On-Demand	Anodyne	CPT1A	39	40
O=C(Cn1cnc2sccc2c1=O)OCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2	ZINC000819051774	JE	On-Demand	Anodyne	CPT1A	39	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1cccc2cccnc12	ZINC000819051778	FF	On-Demand	Anodyne	NQO2	28	48
C[C@@H]1CCCC[C@@H]1C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819051781	DF	On-Demand	Anodyne	GPR119	44	41
COc1cccc([C@H](O)C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)c1	ZINC000819051782	HE	On-Demand	Anodyne	MTNR1B	17	41
C[C@@H]1CCCC[C@H]1C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819051784	DF	On-Demand	Anodyne	GPR119	44	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051785	GG	On-Demand	Anodyne	ADRB2	43	51
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051785	GG	On-Demand	Anodyne	ADRB1	51	45
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051785	GG	On-Demand	Anodyne	ADRB3	44	44
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051785	GG	On-Demand	Anodyne	CASR	43	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051785	GG	On-Demand	Anodyne	ACOX1	54	39
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051785	GG	On-Demand	Anodyne	ABCB1	27	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051785	GG	On-Demand	Anodyne	GPR119	41	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051785	GG	On-Demand	Anodyne	SFRP1	49	39
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051785	GG	On-Demand	Anodyne	WNT3	42	35
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051786	GG	On-Demand	Anodyne	ADRB2	43	51
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051786	GG	On-Demand	Anodyne	ADRB1	51	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051786	GG	On-Demand	Anodyne	ADRB3	44	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051786	GG	On-Demand	Anodyne	CASR	43	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051786	GG	On-Demand	Anodyne	ACOX1	54	39
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051786	GG	On-Demand	Anodyne	ABCB1	27	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051786	GG	On-Demand	Anodyne	GPR119	41	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051786	GG	On-Demand	Anodyne	SFRP1	49	39
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051786	GG	On-Demand	Anodyne	WNT3	42	35
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051788	GG	On-Demand	Anodyne	ADRB2	43	51
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051788	GG	On-Demand	Anodyne	ADRB1	51	45
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051788	GG	On-Demand	Anodyne	ADRB3	44	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051788	GG	On-Demand	Anodyne	CASR	43	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051788	GG	On-Demand	Anodyne	ACOX1	54	39
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051788	GG	On-Demand	Anodyne	ABCB1	27	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051788	GG	On-Demand	Anodyne	GPR119	41	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051788	GG	On-Demand	Anodyne	SFRP1	49	39
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051788	GG	On-Demand	Anodyne	WNT3	42	35
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051790	GG	On-Demand	Anodyne	ADRB2	43	51
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051790	GG	On-Demand	Anodyne	ADRB1	51	45
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051790	GG	On-Demand	Anodyne	ADRB3	44	44
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051790	GG	On-Demand	Anodyne	CASR	43	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051790	GG	On-Demand	Anodyne	ACOX1	54	39
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051790	GG	On-Demand	Anodyne	ABCB1	27	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051790	GG	On-Demand	Anodyne	GPR119	41	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051790	GG	On-Demand	Anodyne	SFRP1	49	39
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819051790	GG	On-Demand	Anodyne	WNT3	42	35
N#CCOc1ccccc1C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051815	HF	On-Demand	Mild	KCNK3	57	42
N#CCOc1ccccc1C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819051815	HF	On-Demand	Mild	KCNK9	58	42
CCOC(=O)N[C@H](C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1)C(C)C	ZINC000819051838	HE	On-Demand	Anodyne	MMP12	32	41
CCOC(=O)N[C@@H](C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1)C(C)C	ZINC000819051839	HE	On-Demand	Anodyne	MMP12	32	41
C#Cc1ccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cn1	ZINC000819051854	FE	On-Demand	Mild	KCNK3	42	37
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(SC(F)F)cc1	ZINC000819051873	II	On-Demand	Anodyne	KCNK3	60	37
O[C@@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cn1	ZINC000819051889	FG	On-Demand	Anodyne	SLC6A3	17	48
O[C@@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cn1	ZINC000819051889	FG	On-Demand	Anodyne	LTA4H	15	41
O[C@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cn1	ZINC000819051890	FG	On-Demand	Anodyne	SLC6A3	17	48
O[C@H](CNC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cn1	ZINC000819051890	FG	On-Demand	Anodyne	LTA4H	15	41
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819051899	FE	On-Demand	Anodyne	EPHX2	15	47
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819051899	FE	On-Demand	Anodyne	TGM2	28	42
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819051899	FE	On-Demand	Anodyne	F13A1	43	42
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819051899	FE	On-Demand	Anodyne	GPR119	43	47
CSc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051900	GF	On-Demand	Anodyne	ADRB2	31	40
CSc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051900	GF	On-Demand	Anodyne	ADRB1	44	40
CSc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051900	GF	On-Demand	Anodyne	ADRB3	34	44
CSc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051900	GF	On-Demand	Anodyne	GPR119	45	48
CSc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051901	GF	On-Demand	Anodyne	ADRB2	31	40
CSc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051901	GF	On-Demand	Anodyne	ADRB1	44	40
CSc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051901	GF	On-Demand	Anodyne	ADRB3	34	44
CSc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051901	GF	On-Demand	Anodyne	GPR119	45	48
CSc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051902	GF	On-Demand	Anodyne	ADRB2	31	40
CSc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051902	GF	On-Demand	Anodyne	ADRB1	44	40
CSc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051902	GF	On-Demand	Anodyne	ADRB3	34	44
CSc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051902	GF	On-Demand	Anodyne	GPR119	45	48
CSc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051903	GF	On-Demand	Anodyne	ADRB2	31	40
CSc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051903	GF	On-Demand	Anodyne	ADRB1	44	40
CSc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051903	GF	On-Demand	Anodyne	ADRB3	34	44
CSc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051903	GF	On-Demand	Anodyne	GPR119	45	48
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051914	GE	On-Demand	Anodyne	ADRB2	36	42
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051914	GE	On-Demand	Anodyne	ADRB1	49	43
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051914	GE	On-Demand	Anodyne	ADRB3	36	46
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051914	GE	On-Demand	Anodyne	MMP13	15	49
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051914	GE	On-Demand	Anodyne	GPR119	49	43
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051915	GE	On-Demand	Anodyne	ADRB2	36	42
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051915	GE	On-Demand	Anodyne	ADRB1	49	43
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051915	GE	On-Demand	Anodyne	ADRB3	36	46
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051915	GE	On-Demand	Anodyne	MMP13	15	49
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051915	GE	On-Demand	Anodyne	GPR119	49	43
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051916	GE	On-Demand	Anodyne	ADRB2	36	42
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051916	GE	On-Demand	Anodyne	ADRB1	49	43
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051916	GE	On-Demand	Anodyne	ADRB3	36	46
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051916	GE	On-Demand	Anodyne	MMP13	15	49
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051916	GE	On-Demand	Anodyne	GPR119	49	43
CCOc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051917	GE	On-Demand	Anodyne	ADRB2	36	42
CCOc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051917	GE	On-Demand	Anodyne	ADRB1	49	43
CCOc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051917	GE	On-Demand	Anodyne	ADRB3	36	46
CCOc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051917	GE	On-Demand	Anodyne	MMP13	15	49
CCOc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051917	GE	On-Demand	Anodyne	GPR119	49	43
O=C(/C=C\[C@H]1CCCO1)NC1CCN(C(=O)c2ccco2)CC1	ZINC000819051918	DD	On-Demand	Anodyne	L3MBTL3	45	34
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(C(=O)c2ccco2)CC1	ZINC000819051919	DD	On-Demand	Anodyne	L3MBTL3	45	34
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(C(=O)c2ccco2)CC1	ZINC000819051920	DD	On-Demand	Anodyne	L3MBTL3	45	34
O=C(/C=C/[C@H]1CCCO1)NC1CCN(C(=O)c2ccco2)CC1	ZINC000819051921	DD	On-Demand	Anodyne	L3MBTL3	45	34
COc1ccccc1[C@@H](NC(=O)c1sc(-c2ccc(C(F)(F)F)cc2)nc1C)c1nccn1C	ZINC000819051923	JK	On-Demand	Anodyne	PPARA	17	46
COc1ccccc1[C@@H](NC(=O)c1sc(-c2ccc(C(F)(F)F)cc2)nc1C)c1nccn1C	ZINC000819051923	JK	On-Demand	Anodyne	PPARD	27	43
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819051928	FG	On-Demand	Anodyne	SSTR2	51	37
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819051928	FG	On-Demand	Anodyne	CCR8	85	44
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819051928	FG	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819051929	FG	On-Demand	Anodyne	SSTR2	51	37
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819051929	FG	On-Demand	Anodyne	CCR8	85	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819051929	FG	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819051939	EE	On-Demand	Anodyne	GPR119	47	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819051940	EE	On-Demand	Anodyne	GPR119	47	46
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819051941	EE	On-Demand	Anodyne	GPR119	47	46
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819051942	EE	On-Demand	Anodyne	GPR119	47	46
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1cccnc1	ZINC000819051948	ED	On-Demand	Anodyne	ADRB2	41	51
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1cccnc1	ZINC000819051948	ED	On-Demand	Anodyne	ADRB1	46	45
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1cccnc1	ZINC000819051948	ED	On-Demand	Anodyne	ADRB3	126	48
O=C1c2ccccc2C(=O)N1CCCCNC[C@@H](O)c1cccnc1	ZINC000819051949	ED	On-Demand	Anodyne	ADRB2	41	51
O=C1c2ccccc2C(=O)N1CCCCNC[C@@H](O)c1cccnc1	ZINC000819051949	ED	On-Demand	Anodyne	ADRB1	46	45
O=C1c2ccccc2C(=O)N1CCCCNC[C@@H](O)c1cccnc1	ZINC000819051949	ED	On-Demand	Anodyne	ADRB3	126	48
CCN1CCCC[C@@H]1CNC[C@H](O)c1ccccc1	ZINC000819051952	CE	On-Demand	Anodyne	SLC18A2	25	41
CCN1CCCC[C@@H]1CNC[C@H](O)c1ccccc1	ZINC000819051952	CE	On-Demand	Anodyne	ADRB3	42	38
CCN1CCCC[C@@H]1CNC[C@H](O)c1ccccc1	ZINC000819051952	CE	On-Demand	Anodyne	Q8WSF8_APLCA	18	41
CCN1CCCC[C@@H]1CNC[C@@H](O)c1ccccc1	ZINC000819051954	CE	On-Demand	Anodyne	SLC18A2	25	41
CCN1CCCC[C@@H]1CNC[C@@H](O)c1ccccc1	ZINC000819051954	CE	On-Demand	Anodyne	ADRB3	42	38
CCN1CCCC[C@@H]1CNC[C@@H](O)c1ccccc1	ZINC000819051954	CE	On-Demand	Anodyne	Q8WSF8_APLCA	18	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051956	GF	On-Demand	Anodyne	ADRB2	30	64
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051956	GF	On-Demand	Anodyne	ADRB1	32	64
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051956	GF	On-Demand	Anodyne	HTR1A	16	64
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051956	GF	On-Demand	Anodyne	SSTR2	48	36
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051956	GF	On-Demand	Anodyne	SLC6A4	19	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051956	GF	On-Demand	Anodyne	ADRB3	30	54
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051957	GF	On-Demand	Anodyne	ADRB2	30	64
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051957	GF	On-Demand	Anodyne	ADRB1	32	64
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051957	GF	On-Demand	Anodyne	HTR1A	16	64
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051957	GF	On-Demand	Anodyne	SSTR2	48	36
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051957	GF	On-Demand	Anodyne	SLC6A4	19	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051957	GF	On-Demand	Anodyne	ADRB3	30	54
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051958	GF	On-Demand	Anodyne	ADRB2	30	64
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051958	GF	On-Demand	Anodyne	ADRB1	32	64
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051958	GF	On-Demand	Anodyne	HTR1A	16	64
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051958	GF	On-Demand	Anodyne	SSTR2	48	36
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051958	GF	On-Demand	Anodyne	SLC6A4	19	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051958	GF	On-Demand	Anodyne	ADRB3	30	54
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051959	GF	On-Demand	Anodyne	ADRB2	30	64
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051959	GF	On-Demand	Anodyne	ADRB1	32	64
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051959	GF	On-Demand	Anodyne	HTR1A	16	64
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051959	GF	On-Demand	Anodyne	SSTR2	48	36
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051959	GF	On-Demand	Anodyne	SLC6A4	19	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819051959	GF	On-Demand	Anodyne	ADRB3	30	54
O=[N+]([O-])c1cccc([C@@H](O)CNC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)c1	ZINC000819051964	GG	On-Demand	Bother	SLC6A3	15	48
O=[N+]([O-])c1cccc([C@@H](O)CNC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)c1	ZINC000819051964	GG	On-Demand	Bother	KCNH2	27	40
O=[N+]([O-])c1cccc([C@H](O)CNC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)c1	ZINC000819051965	GG	On-Demand	Bother	SLC6A3	15	48
O=[N+]([O-])c1cccc([C@H](O)CNC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)c1	ZINC000819051965	GG	On-Demand	Bother	KCNH2	27	40
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051987	GE	On-Demand	Anodyne	ADRB2	31	40
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051987	GE	On-Demand	Anodyne	ADRB1	47	40
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051987	GE	On-Demand	Anodyne	ADRB3	36	44
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051987	GE	On-Demand	Anodyne	GPR119	40	48
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051988	GE	On-Demand	Anodyne	ADRB2	31	40
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051988	GE	On-Demand	Anodyne	ADRB1	47	40
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051988	GE	On-Demand	Anodyne	ADRB3	36	44
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051988	GE	On-Demand	Anodyne	GPR119	40	48
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051989	GE	On-Demand	Anodyne	ADRB2	31	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051989	GE	On-Demand	Anodyne	ADRB1	47	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051989	GE	On-Demand	Anodyne	ADRB3	36	44
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051989	GE	On-Demand	Anodyne	GPR119	40	48
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051990	GE	On-Demand	Anodyne	ADRB2	31	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051990	GE	On-Demand	Anodyne	ADRB1	47	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051990	GE	On-Demand	Anodyne	ADRB3	36	44
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819051990	GE	On-Demand	Anodyne	GPR119	40	48
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819051991	FD	On-Demand	Anodyne	GPR119	33	43
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819051992	FD	On-Demand	Anodyne	GPR119	33	43
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819051993	FD	On-Demand	Anodyne	GPR119	33	43
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819051994	FD	On-Demand	Anodyne	GPR119	33	43
O=C1c2ccccc2C(=O)N1CCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819051995	GG	On-Demand	Anodyne	ADRB2	45	40
O=C1c2ccccc2C(=O)N1CCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819051995	GG	On-Demand	Anodyne	ADRB1	39	42
O=C1c2ccccc2C(=O)N1CCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819051995	GG	On-Demand	Anodyne	ADRB3	38	42
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819051996	GG	On-Demand	Anodyne	ADRB2	45	40
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819051996	GG	On-Demand	Anodyne	ADRB1	39	42
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819051996	GG	On-Demand	Anodyne	ADRB3	38	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052010	FG	On-Demand	Anodyne	TRY2_BOVIN	54	34
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052010	FG	On-Demand	Anodyne	MCHR1	15	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052010	FG	On-Demand	Anodyne	CCR8	44	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052010	FG	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052010	FG	On-Demand	Anodyne	SFRP1	44	39
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052011	FG	On-Demand	Anodyne	TRY2_BOVIN	54	34
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052011	FG	On-Demand	Anodyne	MCHR1	15	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052011	FG	On-Demand	Anodyne	CCR8	44	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052011	FG	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052011	FG	On-Demand	Anodyne	SFRP1	44	39
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052012	FG	On-Demand	Anodyne	TRY2_BOVIN	54	34
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052012	FG	On-Demand	Anodyne	MCHR1	15	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052012	FG	On-Demand	Anodyne	CCR8	44	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052012	FG	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052012	FG	On-Demand	Anodyne	SFRP1	44	39
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052013	FG	On-Demand	Anodyne	TRY2_BOVIN	54	34
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052013	FG	On-Demand	Anodyne	MCHR1	15	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052013	FG	On-Demand	Anodyne	CCR8	44	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052013	FG	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819052013	FG	On-Demand	Anodyne	SFRP1	44	39
CC(C)(C)OC(=O)N1CC[C@H](NCCS(=O)(=O)c2ccc(C#N)cn2)C1	ZINC000819052014	GD	On-Demand	Mild	GPR119	56	44
CC(C)(C)OC(=O)N1CC[C@@H](NCCS(=O)(=O)c2ccc(C#N)cn2)C1	ZINC000819052015	GD	On-Demand	Mild	GPR119	56	44
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819052016	FD	On-Demand	Mild	ADRB2	29	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819052016	FD	On-Demand	Mild	ADRB1	42	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819052016	FD	On-Demand	Mild	ADRB3	30	44
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819052016	FD	On-Demand	Mild	GPR119	41	47
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819052017	FD	On-Demand	Mild	ADRB2	29	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819052017	FD	On-Demand	Mild	ADRB1	42	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819052017	FD	On-Demand	Mild	ADRB3	30	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819052017	FD	On-Demand	Mild	GPR119	41	47
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819052018	FD	On-Demand	Mild	ADRB2	29	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819052018	FD	On-Demand	Mild	ADRB1	42	41
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819052018	FD	On-Demand	Mild	ADRB3	30	44
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819052018	FD	On-Demand	Mild	GPR119	41	47
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819052019	FD	On-Demand	Mild	ADRB2	29	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819052019	FD	On-Demand	Mild	ADRB1	42	41
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819052019	FD	On-Demand	Mild	ADRB3	30	44
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819052019	FD	On-Demand	Mild	GPR119	41	47
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819052022	FG	On-Demand	Anodyne	ADRB2	48	38
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819052022	FG	On-Demand	Anodyne	ADRB1	44	41
O=C1c2ccccc2C(=O)N1CCCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819052022	FG	On-Demand	Anodyne	ADRB3	42	41
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819052028	GD	On-Demand	Anodyne	ADRB2	35	42
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819052028	GD	On-Demand	Anodyne	ADRB1	54	42
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819052028	GD	On-Demand	Anodyne	ADRB3	43	46
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819052028	GD	On-Demand	Anodyne	GPR119	40	38
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819052029	GD	On-Demand	Anodyne	ADRB2	35	42
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819052029	GD	On-Demand	Anodyne	ADRB1	54	42
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819052029	GD	On-Demand	Anodyne	ADRB3	43	46
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819052029	GD	On-Demand	Anodyne	GPR119	40	38
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819052030	GD	On-Demand	Anodyne	ADRB2	35	42
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819052030	GD	On-Demand	Anodyne	ADRB1	54	42
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819052030	GD	On-Demand	Anodyne	ADRB3	43	46
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819052030	GD	On-Demand	Anodyne	GPR119	40	38
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819052031	GD	On-Demand	Anodyne	ADRB2	35	42
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819052031	GD	On-Demand	Anodyne	ADRB1	54	42
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819052031	GD	On-Demand	Anodyne	ADRB3	43	46
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819052031	GD	On-Demand	Anodyne	GPR119	40	38
CCN1CCCC[C@@H]1CNC[C@H](O)c1cc(OC)ccc1OC	ZINC000819052038	DE	On-Demand	Anodyne	DRD2	33	43
CCN1CCCC[C@@H]1CNC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819052039	DE	On-Demand	Anodyne	DRD2	33	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819052069	FE	On-Demand	Bother	CACNA1D	48	34
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819052069	FE	On-Demand	Bother	GPR119	37	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819052070	FE	On-Demand	Bother	CACNA1D	48	34
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819052070	FE	On-Demand	Bother	GPR119	37	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819052071	FE	On-Demand	Bother	CACNA1D	48	34
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819052071	FE	On-Demand	Bother	GPR119	37	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819052072	FE	On-Demand	Bother	CACNA1D	48	34
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819052072	FE	On-Demand	Bother	GPR119	37	40
Cc1cc(F)ccc1[C@@H](O)CNCCCCN1C(=O)c2ccccc2C1=O	ZINC000819052073	FF	On-Demand	Anodyne	LEF	41	32
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819052081	FG	On-Demand	Anodyne	NPY2R	26	41
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819052081	FG	On-Demand	Anodyne	EPHX2	20	48
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819052081	FG	On-Demand	Anodyne	MCHR1	25	40
CC(C)(C)OC(=O)N1CC[C@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819052081	FG	On-Demand	Anodyne	GPR119	31	41
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819052082	FG	On-Demand	Anodyne	NPY2R	26	41
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819052082	FG	On-Demand	Anodyne	EPHX2	20	48
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819052082	FG	On-Demand	Anodyne	MCHR1	25	40
CC(C)(C)OC(=O)N1CC[C@@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819052082	FG	On-Demand	Anodyne	GPR119	31	41
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H]1Cc1ccccc1	ZINC000819052104	CF	On-Demand	Anodyne	PREP	76	37
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H]1Cc1ccccc1	ZINC000819052104	CF	On-Demand	Anodyne	CYP2J2	42	30
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H]1Cc1ccccc1	ZINC000819052105	CF	On-Demand	Anodyne	PREP	76	37
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H]1Cc1ccccc1	ZINC000819052105	CF	On-Demand	Anodyne	CYP2J2	42	30
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H]1Cc1ccccc1	ZINC000819052106	CF	On-Demand	Anodyne	PREP	76	37
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H]1Cc1ccccc1	ZINC000819052106	CF	On-Demand	Anodyne	CYP2J2	42	30
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H]1Cc1ccccc1	ZINC000819052107	CF	On-Demand	Anodyne	PREP	76	37
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H]1Cc1ccccc1	ZINC000819052107	CF	On-Demand	Anodyne	CYP2J2	42	30
O[C@@H](CNCc1cccc(COC2CCOCC2)c1)c1ccc(Cl)cc1	ZINC000819052152	GH	On-Demand	Anodyne	ADRB3	25	41
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000819052156	DG	On-Demand	Anodyne	HTR1A	20	43
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000819052156	DG	On-Demand	Anodyne	KCNQ2	82	51
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000819052156	DG	On-Demand	Anodyne	CSF1R	18	47
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000819052158	DG	On-Demand	Anodyne	HTR1A	20	43
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000819052158	DG	On-Demand	Anodyne	KCNQ2	82	51
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000819052158	DG	On-Demand	Anodyne	CSF1R	18	47
O=C(CCCNC[C@H](O)c1ccccc1)N1CCc2ccccc21	ZINC000819052174	DF	On-Demand	Anodyne	ADRB3	41	36
O=C(CCCNC[C@@H](O)c1ccccc1)N1CCc2ccccc21	ZINC000819052175	DF	On-Demand	Anodyne	ADRB3	41	36
COc1cccc([S@@](=O)CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052183	GE	On-Demand	Anodyne	HTR1A	51	44
COc1cccc([S@@](=O)CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052183	GE	On-Demand	Anodyne	DRD2	39	43
COc1cccc([S@@](=O)CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052183	GE	On-Demand	Anodyne	DRD4	51	43
COc1cccc([S@@](=O)CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052183	GE	On-Demand	Anodyne	HTR1D	20	44
COc1cccc([S@@](=O)CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052183	GE	On-Demand	Anodyne	HTR1B	28	44
COc1cccc([S@@](=O)CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052183	GE	On-Demand	Anodyne	DRD3	52	42
COc1cccc([S@@](=O)CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052183	GE	On-Demand	Anodyne	HTR7	45	43
COc1cccc([S@@](=O)CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052183	GE	On-Demand	Anodyne	KCNQ2	78	49
COc1cccc([S@@](=O)CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052183	GE	On-Demand	Anodyne	MTNR1B	30	40
O=C(CCCNC[C@H](O)c1cccc(Cl)c1)N1CCc2ccccc21	ZINC000819052200	FG	On-Demand	Anodyne	ADRB1	49	46
O=C(CCCNC[C@H](O)c1cccc(Cl)c1)N1CCc2ccccc21	ZINC000819052200	FG	On-Demand	Anodyne	AVPR2	17	43
O=C(CCCNC[C@H](O)c1cccc(Cl)c1)N1CCc2ccccc21	ZINC000819052200	FG	On-Demand	Anodyne	ADRB3	61	46
O=C(CCCNC[C@@H](O)c1cccc(Cl)c1)N1CCc2ccccc21	ZINC000819052201	FG	On-Demand	Anodyne	ADRB1	49	46
O=C(CCCNC[C@@H](O)c1cccc(Cl)c1)N1CCc2ccccc21	ZINC000819052201	FG	On-Demand	Anodyne	AVPR2	17	43
O=C(CCCNC[C@@H](O)c1cccc(Cl)c1)N1CCc2ccccc21	ZINC000819052201	FG	On-Demand	Anodyne	ADRB3	61	46
O=C(/C=C/[C@@H]1CCCO1)NCc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000819052250	GE	On-Demand	Anodyne	EPHX2	25	40
O=C(/C=C\[C@@H]1CCCO1)NCc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000819052251	GE	On-Demand	Anodyne	EPHX2	25	40
O=C(/C=C\[C@H]1CCCO1)NCc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000819052252	GE	On-Demand	Anodyne	EPHX2	25	40
O=C(/C=C/[C@H]1CCCO1)NCc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000819052253	GE	On-Demand	Anodyne	EPHX2	25	40
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1ccccc1Cl	ZINC000819052254	FD	On-Demand	Mild	ADRB2	24	48
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1ccccc1Cl	ZINC000819052254	FD	On-Demand	Mild	ADRB1	57	43
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1ccccc1Cl	ZINC000819052255	FD	On-Demand	Mild	ADRB2	24	48
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1ccccc1Cl	ZINC000819052255	FD	On-Demand	Mild	ADRB1	57	43
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1ccccc1Cl	ZINC000819052256	FD	On-Demand	Mild	ADRB2	24	48
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1ccccc1Cl	ZINC000819052256	FD	On-Demand	Mild	ADRB1	57	43
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1ccccc1Cl	ZINC000819052257	FD	On-Demand	Mild	ADRB2	24	48
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1ccccc1Cl	ZINC000819052257	FD	On-Demand	Mild	ADRB1	57	43
O=C(NCc1ccccc1S(=O)(=O)N1CCCCC1)C(F)=C1CCC1	ZINC000819052278	FF	On-Demand	Anodyne	NAMPT	18	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(C(=O)N(C)C)cc1)C2	ZINC000819052281	FD	On-Demand	Anodyne	VHL	56	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(C(=O)N(C)C)cc1)C2	ZINC000819052282	FD	On-Demand	Anodyne	VHL	56	33
O=C(CCCNC[C@H](O)c1cccc(F)c1)N1Cc2ccccc2C1	ZINC000819052286	EF	On-Demand	Anodyne	ADRB1	31	41
O=C(CCCNC[C@H](O)c1cccc(F)c1)N1Cc2ccccc2C1	ZINC000819052286	EF	On-Demand	Anodyne	ADRB3	42	41
O=C(CCCNC[C@@H](O)c1cccc(F)c1)N1Cc2ccccc2C1	ZINC000819052287	EF	On-Demand	Anodyne	ADRB1	31	41
O=C(CCCNC[C@@H](O)c1cccc(F)c1)N1Cc2ccccc2C1	ZINC000819052287	EF	On-Demand	Anodyne	ADRB3	42	41
O[C@H](CN[C@@H](Cc1ccccc1)CN1CCOCC1)c1ccc(F)cc1	ZINC000819052293	FE	On-Demand	Anodyne	SLC6A3	25	45
O[C@H](CN[C@H](Cc1ccccc1)CN1CCOCC1)c1ccc(F)cc1	ZINC000819052294	FE	On-Demand	Anodyne	SLC6A3	25	45
O[C@@H](CN[C@H](Cc1ccccc1)CN1CCOCC1)c1ccc(F)cc1	ZINC000819052295	FE	On-Demand	Anodyne	SLC6A3	25	45
O[C@@H](CN[C@@H](Cc1ccccc1)CN1CCOCC1)c1ccc(F)cc1	ZINC000819052296	FE	On-Demand	Anodyne	SLC6A3	25	45
CC(C)c1nn(-c2ccccc2)cc1C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000819052310	FJ	On-Demand	Anodyne	KCNQ2	30	47
CC(C)c1nn(-c2ccccc2)cc1C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000819052310	FJ	On-Demand	Anodyne	PRNP	69	45
CC(C)c1nn(-c2ccccc2)cc1C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000819052310	FJ	On-Demand	Anodyne	F3	70	36
CC(C)c1nn(-c2ccccc2)cc1C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000819052310	FJ	On-Demand	Anodyne	PDE7A	24	44
CC(C)c1nn(-c2ccccc2)cc1C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000819052310	FJ	On-Demand	Anodyne	DGAT1	19	42
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819052320	FD	On-Demand	Mild	ADRB2	31	41
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819052320	FD	On-Demand	Mild	ADRB1	66	44
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819052320	FD	On-Demand	Mild	ADRB3	36	41
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819052321	FD	On-Demand	Mild	ADRB2	31	41
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819052321	FD	On-Demand	Mild	ADRB1	66	44
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819052321	FD	On-Demand	Mild	ADRB3	36	41
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819052322	FD	On-Demand	Mild	ADRB2	31	41
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819052322	FD	On-Demand	Mild	ADRB1	66	44
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819052322	FD	On-Demand	Mild	ADRB3	36	41
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819052323	FD	On-Demand	Mild	ADRB2	31	41
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819052323	FD	On-Demand	Mild	ADRB1	66	44
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819052323	FD	On-Demand	Mild	ADRB3	36	41
CN1CCN(c2ccccc2NC(=O)C(F)=C2CCC2)CC1	ZINC000819052332	DF	On-Demand	Anodyne	KCNQ2	83	43
O=C(NCC#Cc1cccc(C(F)(F)F)c1)C(F)=C1CCC1	ZINC000819052357	DH	On-Demand	Mild	PDS	41	32
O=C(/C=C/[C@H]1CCCO1)NC1C2CC3CC(C2)CC1C3	ZINC000819052365	CF	On-Demand	Anodyne	HSD11B1	42	33
O=C(/C=C\[C@H]1CCCO1)NC1C2CC3CC(C2)CC1C3	ZINC000819052366	CF	On-Demand	Anodyne	HSD11B1	42	33
O=C(/C=C/[C@@H]1CCCO1)NC1C2CC3CC(C2)CC1C3	ZINC000819052367	CF	On-Demand	Anodyne	HSD11B1	42	33
O=C(/C=C\[C@@H]1CCCO1)NC1C2CC3CC(C2)CC1C3	ZINC000819052368	CF	On-Demand	Anodyne	HSD11B1	42	33
CN1CCN(c2ccccc2NC(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819052388	DE	On-Demand	Anodyne	KCNQ2	73	40
CN1CCN(c2ccccc2NC(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819052389	DE	On-Demand	Anodyne	KCNQ2	73	40
CN1CCN(c2ccccc2NC(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819052390	DE	On-Demand	Anodyne	KCNQ2	73	40
CN1CCN(c2ccccc2NC(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819052391	DE	On-Demand	Anodyne	KCNQ2	73	40
CN(C)c1ccc(NC(=O)CCNCCCC(=O)N2CCc3ccccc32)cc1	ZINC000819052418	GG	On-Demand	Anodyne	AVPR2	38	41
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000819052448	EG	On-Demand	Anodyne	KCNQ2	57	46
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000819052448	EG	On-Demand	Anodyne	NPY2R	17	40
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000819052448	EG	On-Demand	Anodyne	PRNP	44	37
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000819052448	EG	On-Demand	Anodyne	TAAR1	25	42
CCOc1ccccc1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819052457	CF	On-Demand	Anodyne	HCN1	47	32
CCOc1ccccc1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819052457	CF	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819052458	CF	On-Demand	Anodyne	HCN1	47	32
CCOc1ccccc1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819052458	CF	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819052459	CF	On-Demand	Anodyne	HCN1	47	32
CCOc1ccccc1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819052459	CF	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819052460	CF	On-Demand	Anodyne	HCN1	47	32
CCOc1ccccc1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819052460	CF	On-Demand	Anodyne	HCN4	41	32
O=C(CCCNC[C@@H](O)c1cccnc1)N1Cc2ccccc2C1	ZINC000819052463	EE	On-Demand	Anodyne	ADRB2	30	49
O=C(CCCNC[C@@H](O)c1cccnc1)N1Cc2ccccc2C1	ZINC000819052463	EE	On-Demand	Anodyne	ADRB1	32	43
O=C(CCCNC[C@@H](O)c1cccnc1)N1Cc2ccccc2C1	ZINC000819052463	EE	On-Demand	Anodyne	ADRB3	108	49
O=C(CCCNC[C@@H](O)c1cccnc1)N1Cc2ccccc2C1	ZINC000819052463	EE	On-Demand	Anodyne	PTAFR	18	42
O=C(CCCNC[C@H](O)c1cccnc1)N1Cc2ccccc2C1	ZINC000819052464	EE	On-Demand	Anodyne	ADRB2	30	49
O=C(CCCNC[C@H](O)c1cccnc1)N1Cc2ccccc2C1	ZINC000819052464	EE	On-Demand	Anodyne	ADRB1	32	43
O=C(CCCNC[C@H](O)c1cccnc1)N1Cc2ccccc2C1	ZINC000819052464	EE	On-Demand	Anodyne	ADRB3	108	49
O=C(CCCNC[C@H](O)c1cccnc1)N1Cc2ccccc2C1	ZINC000819052464	EE	On-Demand	Anodyne	PTAFR	18	42
O[C@H](CN[C@@H](Cc1ccccc1)CN1CCOCC1)c1cccc(F)c1	ZINC000819052465	FE	On-Demand	Anodyne	ADRB3	19	40
O[C@H](CN[C@H](Cc1ccccc1)CN1CCOCC1)c1cccc(F)c1	ZINC000819052466	FE	On-Demand	Anodyne	ADRB3	19	40
O[C@@H](CN[C@H](Cc1ccccc1)CN1CCOCC1)c1cccc(F)c1	ZINC000819052467	FE	On-Demand	Anodyne	ADRB3	19	40
O[C@@H](CN[C@@H](Cc1ccccc1)CN1CCOCC1)c1cccc(F)c1	ZINC000819052468	FE	On-Demand	Anodyne	ADRB3	19	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000819052479	FF	On-Demand	Anodyne	EPHX2	55	43
O=C(Nc1ccc(NC(=O)C(F)=C2CCC2)cc1)NC1CC1	ZINC000819052480	DG	On-Demand	Anodyne	EPHX2	55	48
O=C(Nc1ccc(NC(=O)C(F)=C2CCC2)cc1)NC1CC1	ZINC000819052480	DG	On-Demand	Anodyne	P96878_MYCTU	20	51
COc1ccc(OC)c([C@H](O)CNCCOc2ccccc2C(C)C)c1	ZINC000819052482	FH	On-Demand	Anodyne	ADRB2	34	46
COc1ccc(OC)c([C@H](O)CNCCOc2ccccc2C(C)C)c1	ZINC000819052482	FH	On-Demand	Anodyne	ADRB1	32	42
COc1ccc(OC)c([C@H](O)CNCCOc2ccccc2C(C)C)c1	ZINC000819052482	FH	On-Demand	Anodyne	ADRB3	24	42
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H](Cc2ccccc2)CN2CCOCC2)cc1	ZINC000819052501	GE	On-Demand	Bother	KCNJ1	19	45
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H](Cc2ccccc2)CN2CCOCC2)cc1	ZINC000819052502	GE	On-Demand	Bother	KCNJ1	19	45
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H](Cc2ccccc2)CN2CCOCC2)cc1	ZINC000819052503	GE	On-Demand	Bother	KCNJ1	19	45
O=[N+]([O-])c1ccc([C@H](O)CN[C@H](Cc2ccccc2)CN2CCOCC2)cc1	ZINC000819052504	GE	On-Demand	Bother	KCNJ1	19	45
O=C(CCCNC[C@H](O)c1ccccc1F)N1Cc2ccccc2C1	ZINC000819052505	EF	On-Demand	Anodyne	DPP8	20	41
O=C(CCCNC[C@@H](O)c1ccccc1F)N1Cc2ccccc2C1	ZINC000819052506	EF	On-Demand	Anodyne	DPP8	20	41
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccccc3F)C2=O)cc1	ZINC000819052512	GD	On-Demand	Anodyne	F10	20	45
O[C@H](CN[C@@H](Cc1ccccc1)CN1CCOCC1)c1cccc(Cl)c1	ZINC000819052515	FF	On-Demand	Anodyne	ADRB1	31	48
O[C@H](CN[C@@H](Cc1ccccc1)CN1CCOCC1)c1cccc(Cl)c1	ZINC000819052515	FF	On-Demand	Anodyne	ADRB3	51	54
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3ccccc3F)C2=O)cc1	ZINC000819052516	GD	On-Demand	Anodyne	F10	20	45
O[C@H](CN[C@H](Cc1ccccc1)CN1CCOCC1)c1cccc(Cl)c1	ZINC000819052517	FF	On-Demand	Anodyne	ADRB1	31	48
O[C@H](CN[C@H](Cc1ccccc1)CN1CCOCC1)c1cccc(Cl)c1	ZINC000819052517	FF	On-Demand	Anodyne	ADRB3	51	54
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3ccccc3F)C2=O)cc1	ZINC000819052518	GD	On-Demand	Anodyne	F10	20	45
O[C@@H](CN[C@H](Cc1ccccc1)CN1CCOCC1)c1cccc(Cl)c1	ZINC000819052519	FF	On-Demand	Anodyne	ADRB1	31	48
O[C@@H](CN[C@H](Cc1ccccc1)CN1CCOCC1)c1cccc(Cl)c1	ZINC000819052519	FF	On-Demand	Anodyne	ADRB3	51	54
O[C@@H](CN[C@@H](Cc1ccccc1)CN1CCOCC1)c1cccc(Cl)c1	ZINC000819052520	FF	On-Demand	Anodyne	ADRB1	31	48
O[C@@H](CN[C@@H](Cc1ccccc1)CN1CCOCC1)c1cccc(Cl)c1	ZINC000819052520	FF	On-Demand	Anodyne	ADRB3	51	54
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3ccccc3F)C2=O)cc1	ZINC000819052521	GD	On-Demand	Anodyne	F10	20	45
COc1ccc(OC)c([C@H](O)CNCCc2cccc(F)c2F)c1	ZINC000819052527	EF	On-Demand	Anodyne	ADRB2	28	49
COc1ccc(OC)c([C@H](O)CNCCc2cccc(F)c2F)c1	ZINC000819052527	EF	On-Demand	Anodyne	ADRB1	34	40
COc1ccc(OC)c([C@H](O)CNCCc2cccc(F)c2F)c1	ZINC000819052527	EF	On-Demand	Anodyne	ADRB3	27	40
Cc1nc(CN2CCC(CNC[C@H](O)c3ccc(Cl)cc3)CC2)oc1C	ZINC000819052541	GG	On-Demand	Anodyne	CACNA1I	47	37
CN1CCC(N2CC[C@@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C2)CC1	ZINC000819052568	GC	On-Demand	Anodyne	SLC6A5	17	41
O[C@@H](CNCc1cccc(COC2CCOCC2)c1)c1cccnc1	ZINC000819052586	EF	On-Demand	Anodyne	ADRB1	29	42
O[C@@H](CNCc1cccc(COC2CCOCC2)c1)c1cccnc1	ZINC000819052586	EF	On-Demand	Anodyne	ADRB3	89	42
O[C@H](CNCc1cccc(COC2CCOCC2)c1)c1cccnc1	ZINC000819052589	EF	On-Demand	Anodyne	ADRB1	29	42
O[C@H](CNCc1cccc(COC2CCOCC2)c1)c1cccnc1	ZINC000819052589	EF	On-Demand	Anodyne	ADRB3	89	42
Cc1nc(CN2CCC(CNC[C@H](O)c3cccc4ccccc34)CC2)oc1C	ZINC000819052624	GH	On-Demand	Anodyne	HTR4	65	41
CN1CCC(N2CC[C@@H](NC[C@H](O)c3ccc(Cl)cc3Cl)C2)CC1	ZINC000819052648	FF	On-Demand	Anodyne	SLC6A5	18	49
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3ccc(Cl)cc3Cl)C2)CC1	ZINC000819052650	FF	On-Demand	Anodyne	SLC6A5	18	49
O=C1[C@@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)CCN1c1ccccc1F	ZINC000819052670	GG	On-Demand	Anodyne	P2RY1	42	38
O=C1[C@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)CCN1c1ccccc1F	ZINC000819052671	GG	On-Demand	Anodyne	P2RY1	42	38
O=C1[C@@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)CCN1c1ccccc1F	ZINC000819052672	GG	On-Demand	Anodyne	P2RY1	42	38
O=C1[C@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)CCN1c1ccccc1F	ZINC000819052674	GG	On-Demand	Anodyne	P2RY1	42	38
CN1CCC(N2CC[C@@H](NC[C@H](O)c3ccc(S(C)(=O)=O)cc3)C2)CC1	ZINC000819052701	GC	On-Demand	Anodyne	ADRB3	22	41
Cc1ccccc1[C@@H](O)CNCC1CCN(Cc2nc(C)c(C)o2)CC1	ZINC000819052702	FG	On-Demand	Anodyne	HTR4	47	39
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)C2)CC1	ZINC000819052707	GC	On-Demand	Anodyne	ADRB3	22	41
CN1CCN(c2ccccc2NC(=O)Cc2nsc3ccccc23)CC1	ZINC000819052709	FG	On-Demand	Anodyne	HTR1A	34	44
CN1CCN(c2ccccc2NC(=O)Cc2nsc3ccccc23)CC1	ZINC000819052709	FG	On-Demand	Anodyne	DRD2	32	42
CN1CCN(c2ccccc2NC(=O)Cc2nsc3ccccc23)CC1	ZINC000819052709	FG	On-Demand	Anodyne	KCNQ2	78	48
CN1CCN(c2ccccc2NC(=O)Cc2nsc3ccccc23)CC1	ZINC000819052709	FG	On-Demand	Anodyne	WDR5	30	41
CCN(Cc1ccc2c(c1)OCO2)C(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819052728	FF	On-Demand	Anodyne	BMP1	65	39
CCN(Cc1ccc2c(c1)OCO2)C(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819052728	FF	On-Demand	Anodyne	NOS2	57	33
CCN(Cc1ccc2c(c1)OCO2)C(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819052729	FF	On-Demand	Anodyne	BMP1	65	39
CCN(Cc1ccc2c(c1)OCO2)C(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819052729	FF	On-Demand	Anodyne	NOS2	57	33
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2cccc(F)c2F)CC1	ZINC000819052750	GG	On-Demand	Anodyne	GPR119	45	65
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2cccc(F)c2F)CC1	ZINC000819052751	GG	On-Demand	Anodyne	GPR119	45	65
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052783	FF	On-Demand	Anodyne	HTR1A	36	48
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052783	FF	On-Demand	Anodyne	DRD2	33	48
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052783	FF	On-Demand	Anodyne	DRD4	24	41
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052783	FF	On-Demand	Anodyne	HTR1D	36	48
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052783	FF	On-Demand	Anodyne	HTR1B	50	48
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052783	FF	On-Demand	Anodyne	HTR2A	15	48
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052783	FF	On-Demand	Anodyne	HTR7	32	48
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052783	FF	On-Demand	Anodyne	KCNQ2	88	58
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052783	FF	On-Demand	Anodyne	NPY2R	43	42
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052783	FF	On-Demand	Anodyne	CCKBR	15	42
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000819052783	FF	On-Demand	Anodyne	WDR5	31	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccccc1N1CCN(C)CC1)C2	ZINC000819052785	GE	On-Demand	Anodyne	KCNQ2	68	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccccc1N1CCN(C)CC1)C2	ZINC000819052786	GE	On-Demand	Anodyne	KCNQ2	68	41
CNC(=O)Nc1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819052791	CF	On-Demand	Anodyne	KCNK3	86	34
CNC(=O)Nc1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819052791	CF	On-Demand	Anodyne	KCNK9	57	34
O=C(CCCNC[C@H](O)c1cccc(Cl)c1)N1Cc2ccccc2C1	ZINC000819052794	FG	On-Demand	Anodyne	ADRB2	52	39
O=C(CCCNC[C@H](O)c1cccc(Cl)c1)N1Cc2ccccc2C1	ZINC000819052794	FG	On-Demand	Anodyne	ADRB1	57	48
O=C(CCCNC[C@H](O)c1cccc(Cl)c1)N1Cc2ccccc2C1	ZINC000819052794	FG	On-Demand	Anodyne	ADRB3	72	48
O=C(CCCNC[C@@H](O)c1cccc(Cl)c1)N1Cc2ccccc2C1	ZINC000819052795	FG	On-Demand	Anodyne	ADRB2	52	39
O=C(CCCNC[C@@H](O)c1cccc(Cl)c1)N1Cc2ccccc2C1	ZINC000819052795	FG	On-Demand	Anodyne	ADRB1	57	48
O=C(CCCNC[C@@H](O)c1cccc(Cl)c1)N1Cc2ccccc2C1	ZINC000819052795	FG	On-Demand	Anodyne	ADRB3	72	48
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1ccccc1F	ZINC000819052796	EC	On-Demand	Mild	ADRB2	21	43
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1ccccc1F	ZINC000819052796	EC	On-Demand	Mild	ADRB1	60	49
O[C@@H](CNCCc1cccc(F)c1F)c1ccccc1F	ZINC000819052797	CF	On-Demand	Anodyne	ADRB2	34	44
O[C@@H](CNCCc1cccc(F)c1F)c1ccccc1F	ZINC000819052797	CF	On-Demand	Anodyne	ADRB1	26	44
O[C@H](CNCCc1cccc(F)c1F)c1ccccc1F	ZINC000819052798	CF	On-Demand	Anodyne	ADRB2	34	44
O[C@H](CNCCc1cccc(F)c1F)c1ccccc1F	ZINC000819052798	CF	On-Demand	Anodyne	ADRB1	26	44
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCc2cccc(F)c2F)CC1	ZINC000819052799	GG	On-Demand	Anodyne	GPR119	22	48
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCc2cccc(F)c2F)CC1	ZINC000819052800	GG	On-Demand	Anodyne	GPR119	22	48
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1ccccc1F	ZINC000819052822	EC	On-Demand	Mild	ADRB2	21	43
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1ccccc1F	ZINC000819052822	EC	On-Demand	Mild	ADRB1	60	49
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1ccccc1F	ZINC000819052825	EC	On-Demand	Mild	ADRB2	21	43
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1ccccc1F	ZINC000819052825	EC	On-Demand	Mild	ADRB1	60	49
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1ccccc1F	ZINC000819052828	EC	On-Demand	Mild	ADRB2	21	43
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1ccccc1F	ZINC000819052828	EC	On-Demand	Mild	ADRB1	60	49
CN1CCC(N2CC[C@@H](NC[C@H](O)c3ccc(F)c(F)c3)C2)CC1	ZINC000819052846	ED	On-Demand	Anodyne	SLC6A5	15	40
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3ccc(F)c(F)c3)C2)CC1	ZINC000819052851	ED	On-Demand	Anodyne	SLC6A5	15	40
CN1CCC(N2CC[C@@H](NC[C@H](O)c3ccccc3)C2)CC1	ZINC000819052875	DD	On-Demand	Anodyne	SLC6A3	16	44
CN1CCC(N2CC[C@@H](NC[C@H](O)c3ccccc3)C2)CC1	ZINC000819052875	DD	On-Demand	Anodyne	SLC6A5	18	47
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3ccccc3)C2)CC1	ZINC000819052880	DD	On-Demand	Anodyne	SLC6A3	16	44
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3ccccc3)C2)CC1	ZINC000819052880	DD	On-Demand	Anodyne	SLC6A5	18	47
O=C1[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)CCN1c1ccccc1F	ZINC000819052885	GH	On-Demand	Anodyne	F10	17	40
O=C1[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)CCN1c1ccccc1F	ZINC000819052887	GH	On-Demand	Anodyne	F10	17	40
O=C1[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)CCN1c1ccccc1F	ZINC000819052889	GH	On-Demand	Anodyne	F10	17	40
O=C1[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)CCN1c1ccccc1F	ZINC000819052892	GH	On-Demand	Anodyne	F10	17	40
O[C@@H](CNCCN1CCSCC1)c1cccc(Cl)c1	ZINC000819052906	DE	On-Demand	Anodyne	ADRB2	40	38
O[C@@H](CNCCN1CCSCC1)c1cccc(Cl)c1	ZINC000819052906	DE	On-Demand	Anodyne	ADRB1	51	53
O[C@@H](CNCCN1CCSCC1)c1cccc(Cl)c1	ZINC000819052906	DE	On-Demand	Anodyne	ADRB3	67	53
O[C@H](CNCCN1CCSCC1)c1cccc(Cl)c1	ZINC000819052909	DE	On-Demand	Anodyne	ADRB2	40	38
O[C@H](CNCCN1CCSCC1)c1cccc(Cl)c1	ZINC000819052909	DE	On-Demand	Anodyne	ADRB1	51	53
O[C@H](CNCCN1CCSCC1)c1cccc(Cl)c1	ZINC000819052909	DE	On-Demand	Anodyne	ADRB3	67	53
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC#Cc1cccc(C(F)(F)F)c1)C2	ZINC000819052951	GG	On-Demand	Mild	CCR2	66	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC#Cc1cccc(C(F)(F)F)c1)C2	ZINC000819052954	GG	On-Demand	Mild	CCR2	66	36
O=C(CCCNC[C@H](O)C1CC1)N1Cc2ccccc2C1	ZINC000819052958	CD	On-Demand	Anodyne	DPP8	25	40
O=C(CCCNC[C@@H](O)C1CC1)N1Cc2ccccc2C1	ZINC000819052960	CD	On-Demand	Anodyne	DPP8	25	40
C=CCCn1cc(C(=O)Nc2ccccc2N2CCN(C)CC2)nn1	ZINC000819053005	ED	On-Demand	Mild	KCNQ2	70	37
CCONC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819053044	DF	On-Demand	Anodyne	CNR1	55	34
CCONC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819053056	BD	On-Demand	Anodyne	KCNK3	62	37
CCONC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819053056	BD	On-Demand	Anodyne	KCNK9	53	37
CN(CCNC[C@@H](O)c1cccnc1)CC(F)(F)F	ZINC000819053073	CD	On-Demand	Anodyne	ADRB2	25	48
CN(CCNC[C@@H](O)c1cccnc1)CC(F)(F)F	ZINC000819053073	CD	On-Demand	Anodyne	ADRB1	27	48
CN(CCNC[C@@H](O)c1cccnc1)CC(F)(F)F	ZINC000819053073	CD	On-Demand	Anodyne	ADRB3	100	51
CN(CCNC[C@H](O)c1cccnc1)CC(F)(F)F	ZINC000819053074	CD	On-Demand	Anodyne	ADRB2	25	48
CN(CCNC[C@H](O)c1cccnc1)CC(F)(F)F	ZINC000819053074	CD	On-Demand	Anodyne	ADRB1	27	48
CN(CCNC[C@H](O)c1cccnc1)CC(F)(F)F	ZINC000819053074	CD	On-Demand	Anodyne	ADRB3	100	51
CC(=O)Nc1cccc(CC(=O)NNc2nc(C)cc(C)n2)c1	ZINC000819053075	DD	On-Demand	Reactive	HTR1D	22	42
CC(=O)Nc1cccc(CC(=O)NNc2nc(C)cc(C)n2)c1	ZINC000819053075	DD	On-Demand	Reactive	HTR1B	18	42
CCONC(=O)[C@H]1C[C@@H]1c1ccc(C)cc1	ZINC000819053088	BE	On-Demand	Anodyne	SLC6A3	28	41
CCONC(=O)[C@@H]1C[C@H]1c1ccc(C)cc1	ZINC000819053089	BE	On-Demand	Anodyne	SLC6A3	28	41
CCONC(=O)[C@H]1C[C@H]1c1ccc(C)cc1	ZINC000819053090	BE	On-Demand	Anodyne	SLC6A3	28	41
CCONC(=O)[C@@H]1C[C@@H]1c1ccc(C)cc1	ZINC000819053091	BE	On-Demand	Anodyne	SLC6A3	28	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3ccccc3)CC1)C2	ZINC000819053098	FG	On-Demand	Anodyne	SLC18A3	48	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3ccccc3)CC1)C2	ZINC000819053098	FG	On-Demand	Anodyne	ADAM10	52	51
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3ccccc3)CC1)C2	ZINC000819053099	FG	On-Demand	Anodyne	SLC18A3	48	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3ccccc3)CC1)C2	ZINC000819053099	FG	On-Demand	Anodyne	ADAM10	52	51
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819053111	ED	On-Demand	Anodyne	SCD1	15	41
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819053111	ED	On-Demand	Anodyne	SCD	22	41
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819053112	ED	On-Demand	Anodyne	SCD1	15	41
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819053112	ED	On-Demand	Anodyne	SCD	22	41
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819053113	ED	On-Demand	Anodyne	SCD1	15	41
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819053113	ED	On-Demand	Anodyne	SCD	22	41
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819053114	ED	On-Demand	Anodyne	SCD1	15	41
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819053114	ED	On-Demand	Anodyne	SCD	22	41
O=C1[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)CCN1CC(F)(F)F	ZINC000819053119	FE	On-Demand	Anodyne	RBP4	44	34
O=C1[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)CCN1CC(F)(F)F	ZINC000819053120	FE	On-Demand	Anodyne	RBP4	44	34
O=C1[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)CCN1CC(F)(F)F	ZINC000819053121	FE	On-Demand	Anodyne	RBP4	44	34
O=C1[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)CCN1CC(F)(F)F	ZINC000819053122	FE	On-Demand	Anodyne	RBP4	44	34
CN1CCC(N2CC[C@@H](NC[C@H](O)c3ccc(Cl)c(F)c3)C2)CC1	ZINC000819053146	FE	On-Demand	Anodyne	SLC6A5	15	42
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3ccc(Cl)c(F)c3)C2)CC1	ZINC000819053148	FE	On-Demand	Anodyne	SLC6A5	15	42
CN1CCC(N2CC[C@@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C2)CC1	ZINC000819053151	FD	On-Demand	Anodyne	SLC6A5	17	41
CN1CCC(N2CC[C@@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C2)CC1	ZINC000819053153	FD	On-Demand	Anodyne	SLC6A5	17	41
O[C@@H](CNCCc1cccc(F)c1F)c1ccccc1Cl	ZINC000819053175	DG	On-Demand	Anodyne	ADRB2	28	42
O[C@@H](CNCCc1cccc(F)c1F)c1ccccc1Cl	ZINC000819053175	DG	On-Demand	Anodyne	ADRB1	28	42
O[C@@H](CNCCc1cccc(F)c1F)c1ccccc1Cl	ZINC000819053175	DG	On-Demand	Anodyne	ADRB3	18	41
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(F)c(Br)c1	ZINC000819053176	FH	On-Demand	Anodyne	ADRB1	32	41
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(F)c(Br)c1	ZINC000819053176	FH	On-Demand	Anodyne	ADRB3	40	42
O[C@H](CNCCc1cccc(F)c1F)c1ccc(F)c(Br)c1	ZINC000819053177	FH	On-Demand	Anodyne	ADRB1	32	41
O[C@H](CNCCc1cccc(F)c1F)c1ccc(F)c(Br)c1	ZINC000819053177	FH	On-Demand	Anodyne	ADRB3	40	42
O=C1[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1c1ccccc1F	ZINC000819053180	EF	On-Demand	Anodyne	F10	15	44
O=C1[C@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1c1ccccc1F	ZINC000819053181	EF	On-Demand	Anodyne	F10	15	44
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(OC(F)(F)F)cc1	ZINC000819053184	FH	On-Demand	Anodyne	ADRB2	36	42
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(OC(F)(F)F)cc1	ZINC000819053184	FH	On-Demand	Anodyne	ADRB3	38	45
O[C@H](CNCCc1cccc(F)c1F)c1ccc(OC(F)(F)F)cc1	ZINC000819053185	FH	On-Demand	Anodyne	ADRB2	36	42
O[C@H](CNCCc1cccc(F)c1F)c1ccc(OC(F)(F)F)cc1	ZINC000819053185	FH	On-Demand	Anodyne	ADRB3	38	45
Cc1nc(CN2CCC(CNC[C@@H](O)c3cccnc3)CC2)oc1C	ZINC000819053191	EE	On-Demand	Anodyne	ADRB2	18	41
Cc1nc(CN2CCC(CNC[C@@H](O)c3cccnc3)CC2)oc1C	ZINC000819053191	EE	On-Demand	Anodyne	ADRB1	22	41
Cc1nc(CN2CCC(CNC[C@@H](O)c3cccnc3)CC2)oc1C	ZINC000819053191	EE	On-Demand	Anodyne	ADRB3	78	44
Cc1nc(CN2CCC(CNC[C@H](O)c3cccnc3)CC2)oc1C	ZINC000819053192	EE	On-Demand	Anodyne	ADRB2	18	41
Cc1nc(CN2CCC(CNC[C@H](O)c3cccnc3)CC2)oc1C	ZINC000819053192	EE	On-Demand	Anodyne	ADRB1	22	41
Cc1nc(CN2CCC(CNC[C@H](O)c3cccnc3)CC2)oc1C	ZINC000819053192	EE	On-Demand	Anodyne	ADRB3	78	44
CN1CCC(N2CC[C@@H](NC[C@H](O)c3cc(F)ccc3F)C2)CC1	ZINC000819053207	ED	On-Demand	Anodyne	SLC6A5	17	41
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3cc(F)ccc3F)C2)CC1	ZINC000819053209	ED	On-Demand	Anodyne	SLC6A5	17	41
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1cccc(F)c1F	ZINC000819053224	EE	On-Demand	Anodyne	PAPA1_CARPA	29	41
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1cccc(F)c1F	ZINC000819053225	EE	On-Demand	Anodyne	PAPA1_CARPA	29	41
O[C@@H](CNCc1cccc(COC2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819053251	GH	On-Demand	Anodyne	ADRB1	45	42
O[C@@H](CNCc1cccc(COC2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819053251	GH	On-Demand	Anodyne	ADRB3	51	42
O[C@@H](CNCc1cccc(COC2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819053251	GH	On-Demand	Anodyne	CYP3A4	47	36
O[C@H](CNCc1cccc(COC2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819053252	GH	On-Demand	Anodyne	ADRB1	45	42
O[C@H](CNCc1cccc(COC2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819053252	GH	On-Demand	Anodyne	ADRB3	51	42
O[C@H](CNCc1cccc(COC2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819053252	GH	On-Demand	Anodyne	CYP3A4	47	36
C[C@@H]1Cc2ccccc2[C@@H]1NC[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819053271	EF	On-Demand	Anodyne	PLM1_PLAFA	42	37
C[C@@H]1Cc2ccccc2[C@H]1NC[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819053272	EF	On-Demand	Anodyne	PLM1_PLAFA	42	37
C[C@@H]1Cc2ccccc2[C@@H]1NC[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819053273	EF	On-Demand	Anodyne	PLM1_PLAFA	42	37
C[C@@H]1Cc2ccccc2[C@H]1NC[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819053274	EF	On-Demand	Anodyne	PLM1_PLAFA	42	37
CCN(Cc1ccc2c(c1)OCO2)C(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819053289	FE	On-Demand	Anodyne	BMP1	62	37
CCN(Cc1ccc2c(c1)OCO2)C(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819053289	FE	On-Demand	Anodyne	NOS2	55	35
CCN(Cc1ccc2c(c1)OCO2)C(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819053290	FE	On-Demand	Anodyne	BMP1	62	37
CCN(Cc1ccc2c(c1)OCO2)C(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819053290	FE	On-Demand	Anodyne	NOS2	55	35
O=C(/C=C/[C@H]1CCCO1)NCc1ccccc1Cn1ccnc1	ZINC000819053302	DE	On-Demand	Anodyne	CYP19A1	22	43
O=C(/C=C/[C@H]1CCCO1)NCc1ccccc1Cn1ccnc1	ZINC000819053302	DE	On-Demand	Anodyne	TBXAS1	32	40
O=C(/C=C/[C@@H]1CCCO1)NCc1ccccc1Cn1ccnc1	ZINC000819053303	DE	On-Demand	Anodyne	CYP19A1	22	43
O=C(/C=C/[C@@H]1CCCO1)NCc1ccccc1Cn1ccnc1	ZINC000819053303	DE	On-Demand	Anodyne	TBXAS1	32	40
O=C(/C=C\[C@@H]1CCCO1)NCc1ccccc1Cn1ccnc1	ZINC000819053305	DE	On-Demand	Anodyne	CYP19A1	22	43
O=C(/C=C\[C@@H]1CCCO1)NCc1ccccc1Cn1ccnc1	ZINC000819053305	DE	On-Demand	Anodyne	TBXAS1	32	40
O=C(/C=C\[C@H]1CCCO1)NCc1ccccc1Cn1ccnc1	ZINC000819053307	DE	On-Demand	Anodyne	CYP19A1	22	43
O=C(/C=C\[C@H]1CCCO1)NCc1ccccc1Cn1ccnc1	ZINC000819053307	DE	On-Demand	Anodyne	TBXAS1	32	40
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1ccccc1	ZINC000819053316	EC	On-Demand	Mild	ADRB2	41	48
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1ccccc1	ZINC000819053316	EC	On-Demand	Mild	ADRB1	76	47
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1ccccc1	ZINC000819053316	EC	On-Demand	Mild	ADRB3	43	47
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1ccccc1	ZINC000819053317	EC	On-Demand	Mild	ADRB2	41	48
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1ccccc1	ZINC000819053317	EC	On-Demand	Mild	ADRB1	76	47
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1ccccc1	ZINC000819053317	EC	On-Demand	Mild	ADRB3	43	47
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1ccccc1	ZINC000819053318	EC	On-Demand	Mild	ADRB2	41	48
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1ccccc1	ZINC000819053318	EC	On-Demand	Mild	ADRB1	76	47
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1ccccc1	ZINC000819053318	EC	On-Demand	Mild	ADRB3	43	47
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1ccccc1	ZINC000819053319	EC	On-Demand	Mild	ADRB2	41	48
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1ccccc1	ZINC000819053319	EC	On-Demand	Mild	ADRB1	76	47
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1ccccc1	ZINC000819053319	EC	On-Demand	Mild	ADRB3	43	47
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C(F)=C1CCC1	ZINC000819053335	DG	On-Demand	Anodyne	EPHX2	15	45
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C(F)=C1CCC1	ZINC000819053335	DG	On-Demand	Anodyne	MLYCD	19	43
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C(F)=C1CCC1	ZINC000819053335	DG	On-Demand	Anodyne	L3MBTL3	77	40
O=C(Cn1cc(C(=O)O)c2ccccc21)NC1(c2ccccc2)CCC1	ZINC000819053339	EH	On-Demand	Anodyne	CNR1	17	42
O=C(Cn1cc(C(=O)O)c2ccccc21)NC1(c2ccccc2)CCC1	ZINC000819053339	EH	On-Demand	Anodyne	CNR2	23	42
O[C@@H](CNCCSCCOc1cccc(Br)c1)c1cccnc1	ZINC000819053355	GG	On-Demand	Anodyne	ADRB2	29	52
O[C@@H](CNCCSCCOc1cccc(Br)c1)c1cccnc1	ZINC000819053355	GG	On-Demand	Anodyne	ADRB1	38	52
O[C@@H](CNCCSCCOc1cccc(Br)c1)c1cccnc1	ZINC000819053355	GG	On-Demand	Anodyne	ADRB3	101	52
O[C@H](CNCCSCCOc1cccc(Br)c1)c1cccnc1	ZINC000819053357	GG	On-Demand	Anodyne	ADRB2	29	52
O[C@H](CNCCSCCOc1cccc(Br)c1)c1cccnc1	ZINC000819053357	GG	On-Demand	Anodyne	ADRB1	38	52
O[C@H](CNCCSCCOc1cccc(Br)c1)c1cccnc1	ZINC000819053357	GG	On-Demand	Anodyne	ADRB3	101	52
O=C(Nc1ccc(N2CCCC2)cc1)c1cc2c(cn1)OCCO2	ZINC000819053370	EF	On-Demand	Anodyne	LCK	15	40
O=C(Nc1ccc(N2CCCC2)cc1)c1cc2c(cn1)OCCO2	ZINC000819053370	EF	On-Demand	Anodyne	PRNP	40	36
O=C(Nc1ccc(N2CCCC2)cc1)c1cc2c(cn1)OCCO2	ZINC000819053370	EF	On-Demand	Anodyne	GRM4	34	40
O=C(Nc1ccc(N2CCCC2)cc1)c1cc2c(cn1)OCCO2	ZINC000819053370	EF	On-Demand	Anodyne	STAT6	47	32
O=C(Nc1ccc(N2CCCC2)cc1)c1cc2c(cn1)OCCO2	ZINC000819053370	EF	On-Demand	Anodyne	DGAT1	24	41
O=C(CCCNC[C@H](O)c1ccc(F)cc1)N1Cc2ccccc2C1	ZINC000819053389	EF	On-Demand	Anodyne	DPP8	24	46
O=C(CCCNC[C@@H](O)c1ccc(F)cc1)N1Cc2ccccc2C1	ZINC000819053390	EF	On-Demand	Anodyne	DPP8	24	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccccc1Cn1ccnc1	ZINC000819053394	FE	On-Demand	Anodyne	CYP19A1	21	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccccc1Cn1ccnc1	ZINC000819053394	FE	On-Demand	Anodyne	CYP11B1	32	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccccc1Cn1ccnc1	ZINC000819053394	FE	On-Demand	Anodyne	TBXAS1	30	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccccc1Cn1ccnc1	ZINC000819053394	FE	On-Demand	Anodyne	CYP11B2	19	40
CCN(Cc1ccccc1)C(=O)/C=C/[C@H]1CCCO1	ZINC000819053418	CF	On-Demand	Anodyne	LIMK2	15	40
CCN(Cc1ccccc1)C(=O)/C=C\[C@H]1CCCO1	ZINC000819053419	CF	On-Demand	Anodyne	LIMK2	15	40
CCN(Cc1ccccc1)C(=O)/C=C/[C@@H]1CCCO1	ZINC000819053420	CF	On-Demand	Anodyne	LIMK2	15	40
CCN(Cc1ccccc1)C(=O)/C=C\[C@@H]1CCCO1	ZINC000819053421	CF	On-Demand	Anodyne	LIMK2	15	40
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000819053424	CH	On-Demand	Mild	PRNP	39	40
CCOc1ccccc1NC(=O)C(F)=C1CCC1	ZINC000819053425	BG	On-Demand	Anodyne	HCN1	50	33
CCOc1ccccc1NC(=O)C(F)=C1CCC1	ZINC000819053425	BG	On-Demand	Anodyne	HCN4	42	32
Cc1cc(C)nc(NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819053480	FE	On-Demand	Reactive	PAPA1_CARPA	45	47
Cc1cc(C)nc(NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819053480	FE	On-Demand	Reactive	CTSK	15	45
Cc1cc(C)nc(NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819053481	FE	On-Demand	Reactive	PAPA1_CARPA	45	47
Cc1cc(C)nc(NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819053481	FE	On-Demand	Reactive	CTSK	15	45
COC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819053484	ED	On-Demand	Anodyne	CACNA1C	47	35
COC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819053484	ED	On-Demand	Anodyne	CACNA1D	65	35
COC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819053484	ED	On-Demand	Anodyne	SLC27A4	66	34
COC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819053485	ED	On-Demand	Anodyne	CACNA1C	47	35
COC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819053485	ED	On-Demand	Anodyne	CACNA1D	65	35
COC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819053485	ED	On-Demand	Anodyne	SLC27A4	66	34
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(OC(F)(F)F)c1	ZINC000819053494	DG	On-Demand	Anodyne	EPHX2	25	46
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(OC(F)(F)F)c1	ZINC000819053495	DG	On-Demand	Anodyne	EPHX2	25	46
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(OC(F)(F)F)c1	ZINC000819053496	DG	On-Demand	Anodyne	EPHX2	25	46
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(OC(F)(F)F)c1	ZINC000819053497	DG	On-Demand	Anodyne	EPHX2	25	46
COc1cccc([S@](=O)CC(=O)N2CCC(C(=O)NCC(C)C)CC2)c1	ZINC000819053501	GD	On-Demand	Anodyne	DRD4	41	32
COc1cccc([S@](=O)CC(=O)N2CCC(C(=O)NCC(C)C)CC2)c1	ZINC000819053501	GD	On-Demand	Anodyne	MTNR1A	33	53
COc1cccc([S@](=O)CC(=O)N2CCC(C(=O)NCC(C)C)CC2)c1	ZINC000819053501	GD	On-Demand	Anodyne	MTNR1B	35	53
COc1cccc([S@](=O)CC(=O)N2CCC(C(=O)NCC(C)C)CC2)c1	ZINC000819053501	GD	On-Demand	Anodyne	CACNA1G	19	40
COc1cccc([S@@](=O)CC(=O)N2CCC(C(=O)NCC(C)C)CC2)c1	ZINC000819053502	GD	On-Demand	Anodyne	DRD4	41	32
COc1cccc([S@@](=O)CC(=O)N2CCC(C(=O)NCC(C)C)CC2)c1	ZINC000819053502	GD	On-Demand	Anodyne	MTNR1A	33	53
COc1cccc([S@@](=O)CC(=O)N2CCC(C(=O)NCC(C)C)CC2)c1	ZINC000819053502	GD	On-Demand	Anodyne	MTNR1B	35	53
COc1cccc([S@@](=O)CC(=O)N2CCC(C(=O)NCC(C)C)CC2)c1	ZINC000819053502	GD	On-Demand	Anodyne	CACNA1G	19	40
C=CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819053509	EF	On-Demand	Mild	CACNA1C	22	43
C=CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819053509	EF	On-Demand	Mild	CACNA1D	36	43
C=CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819053509	EF	On-Demand	Mild	SLC27A4	46	36
C=CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819053510	EF	On-Demand	Mild	CACNA1C	22	43
C=CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819053510	EF	On-Demand	Mild	CACNA1D	36	43
C=CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819053510	EF	On-Demand	Mild	SLC27A4	46	36
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3cccnc3)C2)CC1	ZINC000819053532	DC	On-Demand	Anodyne	ADRB3	65	47
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3cccnc3)C2)CC1	ZINC000819053532	DC	On-Demand	Anodyne	SLC6A5	16	41
CN1CCC(N2CC[C@@H](NC[C@H](O)c3cccnc3)C2)CC1	ZINC000819053534	DC	On-Demand	Anodyne	ADRB3	65	47
CN1CCC(N2CC[C@@H](NC[C@H](O)c3cccnc3)C2)CC1	ZINC000819053534	DC	On-Demand	Anodyne	SLC6A5	16	41
O[C@@H](CNCCc1cccc(F)c1F)c1cccc(F)c1	ZINC000819053535	CF	On-Demand	Anodyne	ADRB2	35	41
O[C@@H](CNCCc1cccc(F)c1F)c1cccc(F)c1	ZINC000819053535	CF	On-Demand	Anodyne	ADRB1	35	45
O[C@@H](CNCCc1cccc(F)c1F)c1cccc(F)c1	ZINC000819053535	CF	On-Demand	Anodyne	ADRB3	62	45
O[C@H](CNCCc1cccc(F)c1F)c1cccc(F)c1	ZINC000819053536	CF	On-Demand	Anodyne	ADRB2	35	41
O[C@H](CNCCc1cccc(F)c1F)c1cccc(F)c1	ZINC000819053536	CF	On-Demand	Anodyne	ADRB1	35	45
O[C@H](CNCCc1cccc(F)c1F)c1cccc(F)c1	ZINC000819053536	CF	On-Demand	Anodyne	ADRB3	62	45
CN1CCC(N2CC[C@@H](NC[C@H](O)c3ccccc3C(F)(F)F)C2)CC1	ZINC000819053546	FE	On-Demand	Anodyne	SLC6A5	19	42
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3ccccc3C(F)(F)F)C2)CC1	ZINC000819053548	FE	On-Demand	Anodyne	SLC6A5	19	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CC(C)C)c1nc3ccccc3[nH]1)C2	ZINC000819053555	GH	On-Demand	Anodyne	MMP7	23	52
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CC(C)C)c1nc3ccccc3[nH]1)C2	ZINC000819053556	GH	On-Demand	Anodyne	MMP7	23	52
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CC(C)C)c1nc3ccccc3[nH]1)C2	ZINC000819053557	GH	On-Demand	Anodyne	MMP7	23	52
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CC(C)C)c1nc3ccccc3[nH]1)C2	ZINC000819053558	GH	On-Demand	Anodyne	MMP7	23	52
CN1CCC(N2CC[C@@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C2)CC1	ZINC000819053560	FD	On-Demand	Anodyne	SLC6A5	19	43
CN1CCC(N2CC[C@@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C2)CC1	ZINC000819053561	FD	On-Demand	Anodyne	SLC6A5	19	43
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(F)cc1F	ZINC000819053564	DG	On-Demand	Anodyne	ADRB2	41	42
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(F)cc1F	ZINC000819053564	DG	On-Demand	Anodyne	ADRB1	32	42
O[C@H](CNCCc1cccc(F)c1F)c1ccc(F)cc1F	ZINC000819053565	DG	On-Demand	Anodyne	ADRB2	41	42
O[C@H](CNCCc1cccc(F)c1F)c1ccc(F)cc1F	ZINC000819053565	DG	On-Demand	Anodyne	ADRB1	32	42
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(C2CCN(C)CC2)C1	ZINC000819053578	DD	On-Demand	Anodyne	SLC6A5	17	42
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(C2CCN(C)CC2)C1	ZINC000819053579	DD	On-Demand	Anodyne	SLC6A5	17	42
CN1CCC(N2CC[C@@H](NCCC(=O)Nc3ccc(N(C)C)cc3)C2)CC1	ZINC000819053599	FD	On-Demand	Anodyne	SLC6A5	19	41
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3ccc(OC(F)(F)F)cc3)C2)CC1	ZINC000819053607	GE	On-Demand	Anodyne	SLC6A5	20	45
CN1CCC(N2CC[C@@H](NC[C@H](O)c3ccc(OC(F)(F)F)cc3)C2)CC1	ZINC000819053609	GE	On-Demand	Anodyne	SLC6A5	20	45
O[C@@H](CNCCc1cccc(F)c1F)c1cc(F)ccc1F	ZINC000819053611	DG	On-Demand	Anodyne	ADRB2	23	40
O[C@@H](CNCCc1cccc(F)c1F)c1cc(F)ccc1F	ZINC000819053611	DG	On-Demand	Anodyne	ADRB1	23	40
O[C@H](CNCCc1cccc(F)c1F)c1cc(F)ccc1F	ZINC000819053612	DG	On-Demand	Anodyne	ADRB2	23	40
O[C@H](CNCCc1cccc(F)c1F)c1cc(F)ccc1F	ZINC000819053612	DG	On-Demand	Anodyne	ADRB1	23	40
Cc1nc(CN2CCC(CNC[C@H](O)c3cccc(Cl)c3)CC2)oc1C	ZINC000819053631	GG	On-Demand	Anodyne	ADRB3	42	38
Cc1nc(CN2CCC(CNC[C@H](O)c3cccc(Cl)c3)CC2)oc1C	ZINC000819053631	GG	On-Demand	Anodyne	CYP3A4	49	37
Cc1nc(CN2CCC(CNC[C@H](O)c3cccc(Cl)c3)CC2)oc1C	ZINC000819053631	GG	On-Demand	Anodyne	CACNA1I	49	38
Cc1nc(CN2CCC(CNC[C@@H](O)c3cccc(Cl)c3)CC2)oc1C	ZINC000819053632	GG	On-Demand	Anodyne	ADRB3	42	38
Cc1nc(CN2CCC(CNC[C@@H](O)c3cccc(Cl)c3)CC2)oc1C	ZINC000819053632	GG	On-Demand	Anodyne	CYP3A4	49	37
Cc1nc(CN2CCC(CNC[C@@H](O)c3cccc(Cl)c3)CC2)oc1C	ZINC000819053632	GG	On-Demand	Anodyne	CACNA1I	49	38
CN1CCN(c2ccccc2NC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819053646	GE	On-Demand	Anodyne	HTR1A	21	44
CN1CCN(c2ccccc2NC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819053646	GE	On-Demand	Anodyne	DRD2	15	43
CN1CCN(c2ccccc2NC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819053646	GE	On-Demand	Anodyne	HTR1D	54	38
CN1CCN(c2ccccc2NC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819053646	GE	On-Demand	Anodyne	HTR1B	54	38
CN1CCN(c2ccccc2NC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819053646	GE	On-Demand	Anodyne	KCNQ2	83	56
CN1CCN(c2ccccc2NC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819053646	GE	On-Demand	Anodyne	CSF1R	20	48
COc1ccc(OC)c([C@H](O)CNCCCC(=O)N2CCc3ccccc32)c1	ZINC000819053656	GF	On-Demand	Anodyne	ADRB2	15	40
COc1ccc(OC)c([C@H](O)CNCCCC(=O)N2CCc3ccccc32)c1	ZINC000819053656	GF	On-Demand	Anodyne	DRD2	24	41
COc1ccc(OC)c([C@H](O)CNCCCC(=O)N2CCc3ccccc32)c1	ZINC000819053656	GF	On-Demand	Anodyne	DRD4	41	33
COc1ccc(OC)c([C@H](O)CNCCCC(=O)N2CCc3ccccc32)c1	ZINC000819053656	GF	On-Demand	Anodyne	DRD3	40	38
O=C(/C=C\[C@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCC1	ZINC000819053667	FH	On-Demand	Anodyne	KCNQ2	30	41
O=C(/C=C\[C@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCC1	ZINC000819053667	FH	On-Demand	Anodyne	TEK	18	43
O=C(/C=C\[C@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCC1	ZINC000819053667	FH	On-Demand	Anodyne	LIPG	48	33
O=C(/C=C/[C@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCC1	ZINC000819053668	FH	On-Demand	Anodyne	KCNQ2	30	41
O=C(/C=C/[C@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCC1	ZINC000819053668	FH	On-Demand	Anodyne	TEK	18	43
O=C(/C=C/[C@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCC1	ZINC000819053668	FH	On-Demand	Anodyne	LIPG	48	33
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCC1	ZINC000819053669	FH	On-Demand	Anodyne	KCNQ2	30	41
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCC1	ZINC000819053669	FH	On-Demand	Anodyne	TEK	18	43
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCC1	ZINC000819053669	FH	On-Demand	Anodyne	LIPG	48	33
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCC1	ZINC000819053670	FH	On-Demand	Anodyne	KCNQ2	30	41
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCC1	ZINC000819053670	FH	On-Demand	Anodyne	TEK	18	43
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(C(F)(F)F)ccc1N1CCCC1	ZINC000819053670	FH	On-Demand	Anodyne	LIPG	48	33
Cc1nc(CN2CCC(CNC[C@H](O)c3ccccc3F)CC2)oc1C	ZINC000819053703	FF	On-Demand	Anodyne	HTR4	41	38
Cc1nc(CN2CCC(CNC[C@@H](O)c3ccccc3F)CC2)oc1C	ZINC000819053704	FF	On-Demand	Anodyne	HTR4	41	38
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819053709	FH	On-Demand	Bother	ADRB2	46	38
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819053709	FH	On-Demand	Bother	ADRB1	34	50
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819053709	FH	On-Demand	Bother	ADRB3	62	50
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819053711	FH	On-Demand	Bother	ADRB2	46	38
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819053711	FH	On-Demand	Bother	ADRB1	34	50
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819053711	FH	On-Demand	Bother	ADRB3	62	50
Cc1nc(CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cs1	ZINC000819053762	FF	On-Demand	Mild	PAPA1_CARPA	45	50
Cc1nc(CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cs1	ZINC000819053763	FF	On-Demand	Mild	PAPA1_CARPA	45	50
COc1ccc(OC)c([C@H](O)CNCCCC(=O)N2Cc3ccccc3C2)c1	ZINC000819053795	GF	On-Demand	Anodyne	ADRB2	25	43
COc1ccc(OC)c([C@H](O)CNCCCC(=O)N2Cc3ccccc3C2)c1	ZINC000819053795	GF	On-Demand	Anodyne	MTNR1B	41	37
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000819053813	FG	On-Demand	Anodyne	DRD4	50	41
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000819053813	FG	On-Demand	Anodyne	KCNQ2	25	42
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000819053813	FG	On-Demand	Anodyne	PRNP	41	34
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000819053813	FG	On-Demand	Anodyne	MTNR1A	27	45
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000819053813	FG	On-Demand	Anodyne	MTNR1B	34	45
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000819053813	FG	On-Demand	Anodyne	GALR2	37	41
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000819053813	FG	On-Demand	Anodyne	ACR	28	42
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000819053813	FG	On-Demand	Anodyne	TAAR1	36	40
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(Cl)cc1	ZINC000819053814	DG	On-Demand	Anodyne	ADRB2	34	45
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(Cl)cc1	ZINC000819053814	DG	On-Demand	Anodyne	ADRB1	35	43
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(Cl)cc1	ZINC000819053814	DG	On-Demand	Anodyne	ADRB3	44	45
CCONC(=O)[C@H](CC)Cc1ccccc1C	ZINC000819053819	BF	On-Demand	Anodyne	MME	17	41
CCONC(=O)[C@H](CC)Cc1ccccc1C	ZINC000819053819	BF	On-Demand	Anodyne	CPA1	17	51
CCONC(=O)[C@@H](CC)Cc1ccccc1C	ZINC000819053820	BF	On-Demand	Anodyne	MME	17	41
CCONC(=O)[C@@H](CC)Cc1ccccc1C	ZINC000819053820	BF	On-Demand	Anodyne	CPA1	17	51
O=S(=O)(CCNC[C@H](O)c1ccccc1)NC[C@H]1CCCCO1	ZINC000819053825	EC	On-Demand	Anodyne	ADRB3	44	41
O=S(=O)(CCNC[C@H](O)c1ccccc1)NC[C@@H]1CCCCO1	ZINC000819053827	EC	On-Demand	Anodyne	ADRB3	44	41
O=S(=O)(CCNC[C@@H](O)c1ccccc1)NC[C@H]1CCCCO1	ZINC000819053830	EC	On-Demand	Anodyne	ADRB3	44	41
O=S(=O)(CCNC[C@@H](O)c1ccccc1)NC[C@@H]1CCCCO1	ZINC000819053832	EC	On-Demand	Anodyne	ADRB3	44	41
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1ccc(F)cc1	ZINC000819053835	EC	On-Demand	Mild	ADRB2	35	43
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1ccc(F)cc1	ZINC000819053835	EC	On-Demand	Mild	ADRB1	66	44
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COc1ccc(F)cc1	ZINC000819053835	EC	On-Demand	Mild	ADRB3	36	41
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819053837	EC	On-Demand	Mild	ADRB2	35	43
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819053837	EC	On-Demand	Mild	ADRB1	66	44
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819053837	EC	On-Demand	Mild	ADRB3	36	41
COCCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819053839	GD	On-Demand	Anodyne	CACNA1C	83	40
COCCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819053839	GD	On-Demand	Anodyne	CACNA1D	87	40
COCCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819053839	GD	On-Demand	Anodyne	SLC27A4	66	33
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819053840	EC	On-Demand	Mild	ADRB2	35	43
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819053840	EC	On-Demand	Mild	ADRB1	66	44
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819053840	EC	On-Demand	Mild	ADRB3	36	41
COCCOC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819053841	GD	On-Demand	Anodyne	CACNA1C	83	40
COCCOC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819053841	GD	On-Demand	Anodyne	CACNA1D	87	40
COCCOC(=O)C1=C(C)NC(=S)N[C@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819053841	GD	On-Demand	Anodyne	SLC27A4	66	33
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1ccc(F)cc1	ZINC000819053842	EC	On-Demand	Mild	ADRB2	35	43
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1ccc(F)cc1	ZINC000819053842	EC	On-Demand	Mild	ADRB1	66	44
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COc1ccc(F)cc1	ZINC000819053842	EC	On-Demand	Mild	ADRB3	36	41
O=S(=O)(N1CCC(CNC[C@@H](O)CCc2ccccc2)CC1)C(F)(F)F	ZINC000819053865	GE	On-Demand	Anodyne	ADRB1	17	42
O=S(=O)(N1CCC(CNC[C@@H](O)CCc2ccccc2)CC1)C(F)(F)F	ZINC000819053865	GE	On-Demand	Anodyne	SLC6A3	17	45
O=S(=O)(N1CCC(CNC[C@@H](O)CCc2ccccc2)CC1)C(F)(F)F	ZINC000819053865	GE	On-Demand	Anodyne	ADRB3	22	42
O=S(=O)(N1CCC(CNC[C@@H](O)CCc2ccccc2)CC1)C(F)(F)F	ZINC000819053865	GE	On-Demand	Anodyne	SIGMAR1	16	44
O=S(=O)(N1CCC(CNC[C@@H](O)CCc2ccccc2)CC1)C(F)(F)F	ZINC000819053865	GE	On-Demand	Anodyne	SFRP1	41	33
O=S(=O)(N1CCC(CNC[C@H](O)CCc2ccccc2)CC1)C(F)(F)F	ZINC000819053867	GE	On-Demand	Anodyne	ADRB1	17	42
O=S(=O)(N1CCC(CNC[C@H](O)CCc2ccccc2)CC1)C(F)(F)F	ZINC000819053867	GE	On-Demand	Anodyne	SLC6A3	17	45
O=S(=O)(N1CCC(CNC[C@H](O)CCc2ccccc2)CC1)C(F)(F)F	ZINC000819053867	GE	On-Demand	Anodyne	ADRB3	22	42
O=S(=O)(N1CCC(CNC[C@H](O)CCc2ccccc2)CC1)C(F)(F)F	ZINC000819053867	GE	On-Demand	Anodyne	SIGMAR1	16	44
O=S(=O)(N1CCC(CNC[C@H](O)CCc2ccccc2)CC1)C(F)(F)F	ZINC000819053867	GE	On-Demand	Anodyne	SFRP1	41	33
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819053869	FE	On-Demand	Anodyne	ADRB3	25	42
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819053870	FE	On-Demand	Anodyne	ADRB3	25	42
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1CC(F)(F)F	ZINC000819053874	DC	On-Demand	Anodyne	ADRB3	64	44
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1CC(F)(F)F	ZINC000819053876	DC	On-Demand	Anodyne	ADRB3	64	44
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1CC(F)(F)F	ZINC000819053878	DC	On-Demand	Anodyne	ADRB3	64	44
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1CC(F)(F)F	ZINC000819053879	DC	On-Demand	Anodyne	ADRB3	64	44
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(Cl)c(F)c1	ZINC000819053881	EH	On-Demand	Anodyne	ADRB2	42	40
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(Cl)c(F)c1	ZINC000819053881	EH	On-Demand	Anodyne	ADRB1	38	43
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(Cl)c(F)c1	ZINC000819053881	EH	On-Demand	Anodyne	ADRB3	43	44
O[C@H](CNCCc1cccc(F)c1F)c1ccc(Cl)c(F)c1	ZINC000819053883	EH	On-Demand	Anodyne	ADRB2	42	40
O[C@H](CNCCc1cccc(F)c1F)c1ccc(Cl)c(F)c1	ZINC000819053883	EH	On-Demand	Anodyne	ADRB1	38	43
O[C@H](CNCCc1cccc(F)c1F)c1ccc(Cl)c(F)c1	ZINC000819053883	EH	On-Demand	Anodyne	ADRB3	43	44
O=C(CCCNC[C@H](O)c1ccc(Cl)cc1)N1Cc2ccccc2C1	ZINC000819053896	FG	On-Demand	Anodyne	DPP8	20	43
O[C@@H](CNCCc1cccc(F)c1F)c1cccnc1	ZINC000819053908	CE	On-Demand	Anodyne	ADRB2	40	51
O[C@@H](CNCCc1cccc(F)c1F)c1cccnc1	ZINC000819053908	CE	On-Demand	Anodyne	ADRB1	46	53
O[C@@H](CNCCc1cccc(F)c1F)c1cccnc1	ZINC000819053908	CE	On-Demand	Anodyne	ADRB3	132	53
O[C@H](CNCCc1cccc(F)c1F)c1cccnc1	ZINC000819053910	CE	On-Demand	Anodyne	ADRB2	40	51
O[C@H](CNCCc1cccc(F)c1F)c1cccnc1	ZINC000819053910	CE	On-Demand	Anodyne	ADRB1	46	53
O[C@H](CNCCc1cccc(F)c1F)c1cccnc1	ZINC000819053910	CE	On-Demand	Anodyne	ADRB3	132	53
O[C@@H](CN[C@H](Cc1ccccc1)CN1CCOCC1)c1ccc(Cl)cc1	ZINC000819053911	FF	On-Demand	Anodyne	ADRB3	19	40
O[C@@H](CN[C@@H](Cc1ccccc1)CN1CCOCC1)c1ccc(Cl)cc1	ZINC000819053913	FF	On-Demand	Anodyne	ADRB3	19	40
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1F	ZINC000819053928	EF	On-Demand	Anodyne	F10	19	43
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1F	ZINC000819053928	EF	On-Demand	Anodyne	ADRB3	48	42
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1F	ZINC000819053928	EF	On-Demand	Anodyne	CYP3A4	47	35
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1F	ZINC000819053930	EF	On-Demand	Anodyne	F10	19	43
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1F	ZINC000819053930	EF	On-Demand	Anodyne	ADRB3	48	42
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccccc1F	ZINC000819053930	EF	On-Demand	Anodyne	CYP3A4	47	35
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1F	ZINC000819053932	EF	On-Demand	Anodyne	F10	19	43
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1F	ZINC000819053932	EF	On-Demand	Anodyne	ADRB3	48	42
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1F	ZINC000819053932	EF	On-Demand	Anodyne	CYP3A4	47	35
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1F	ZINC000819053934	EF	On-Demand	Anodyne	F10	19	43
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1F	ZINC000819053934	EF	On-Demand	Anodyne	ADRB3	48	42
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccccc1F	ZINC000819053934	EF	On-Demand	Anodyne	CYP3A4	47	35
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819053940	EG	On-Demand	Anodyne	DRD4	30	44
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819053940	EG	On-Demand	Anodyne	SIGMAR1	17	41
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819053940	EG	On-Demand	Anodyne	LSS	17	43
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819053940	EG	On-Demand	Anodyne	FAAH	15	45
O=C(/C=C\[C@H]1CCCO1)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819053941	EG	On-Demand	Anodyne	DRD4	30	44
O=C(/C=C\[C@H]1CCCO1)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819053941	EG	On-Demand	Anodyne	SIGMAR1	17	41
O=C(/C=C\[C@H]1CCCO1)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819053941	EG	On-Demand	Anodyne	LSS	17	43
O=C(/C=C\[C@H]1CCCO1)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819053941	EG	On-Demand	Anodyne	FAAH	15	45
O=C(/C=C/[C@H]1CCCO1)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819053944	EG	On-Demand	Anodyne	DRD4	30	44
O=C(/C=C/[C@H]1CCCO1)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819053944	EG	On-Demand	Anodyne	SIGMAR1	17	41
O=C(/C=C/[C@H]1CCCO1)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819053944	EG	On-Demand	Anodyne	LSS	17	43
O=C(/C=C/[C@H]1CCCO1)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819053944	EG	On-Demand	Anodyne	FAAH	15	45
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819053946	EG	On-Demand	Anodyne	DRD4	30	44
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819053946	EG	On-Demand	Anodyne	SIGMAR1	17	41
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819053946	EG	On-Demand	Anodyne	LSS	17	43
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819053946	EG	On-Demand	Anodyne	FAAH	15	45
CN(CCNC[C@@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819053981	DE	On-Demand	Anodyne	ADRB1	41	48
CN(CCNC[C@@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819053981	DE	On-Demand	Anodyne	ADRB3	58	48
CN(CCNC[C@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819053983	DE	On-Demand	Anodyne	ADRB1	41	48
CN(CCNC[C@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819053983	DE	On-Demand	Anodyne	ADRB3	58	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCO[C@H](c3ccccc3)C1)C2	ZINC000819053985	FE	On-Demand	Anodyne	ADAM10	23	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCO[C@@H](c3ccccc3)C1)C2	ZINC000819053987	FE	On-Demand	Anodyne	ADAM10	23	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCO[C@H](c3ccccc3)C1)C2	ZINC000819053989	FE	On-Demand	Anodyne	ADAM10	23	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCO[C@@H](c3ccccc3)C1)C2	ZINC000819053991	FE	On-Demand	Anodyne	ADAM10	23	40
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(F)cc1	ZINC000819054015	CF	On-Demand	Anodyne	ADRB2	41	46
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(F)cc1	ZINC000819054015	CF	On-Demand	Anodyne	ADRB1	30	41
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(F)cc1	ZINC000819054015	CF	On-Demand	Anodyne	ADRB3	44	40
O[C@H](CNCCc1cccc(F)c1F)c1ccc(F)cc1	ZINC000819054016	CF	On-Demand	Anodyne	ADRB2	41	46
O[C@H](CNCCc1cccc(F)c1F)c1ccc(F)cc1	ZINC000819054016	CF	On-Demand	Anodyne	ADRB1	30	41
O[C@H](CNCCc1cccc(F)c1F)c1ccc(F)cc1	ZINC000819054016	CF	On-Demand	Anodyne	ADRB3	44	40
CN1CCC(N2CC[C@@H](NC[C@H](O)c3ccccc3F)C2)CC1	ZINC000819054023	DD	On-Demand	Anodyne	SLC6A5	17	42
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3ccccc3F)C2)CC1	ZINC000819054025	DD	On-Demand	Anodyne	SLC6A5	17	42
COc1cccc([S@@](=O)CC(=O)Nc2ccccc2C(=O)NC2CC2)c1	ZINC000819054039	FE	On-Demand	Anodyne	DRD4	40	31
COc1cccc([S@@](=O)CC(=O)Nc2ccccc2C(=O)NC2CC2)c1	ZINC000819054039	FE	On-Demand	Anodyne	MTNR1B	28	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(N3CCN(C)CC3)nc1)C2	ZINC000819054042	GD	On-Demand	Anodyne	DGAT1	37	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(N3CCN(C)CC3)nc1)C2	ZINC000819054043	GD	On-Demand	Anodyne	DGAT1	37	42
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccccc1C(=O)NC1CC1	ZINC000819054057	DG	On-Demand	Anodyne	CNR2	26	42
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccccc1C(=O)NC1CC1	ZINC000819054058	DG	On-Demand	Anodyne	CNR2	26	42
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819054064	EH	On-Demand	Mild	ADRB1	15	48
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819054065	EH	On-Demand	Mild	ADRB1	15	48
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H]1CCS(=O)(=O)C1	ZINC000819054088	GD	On-Demand	Mild	PAPA1_CARPA	30	41
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H]1CCS(=O)(=O)C1	ZINC000819054089	GD	On-Demand	Mild	PAPA1_CARPA	30	41
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC[C@H](O)c1ccccc1	ZINC000819054096	DH	On-Demand	Anodyne	ADRB2	52	40
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC[C@H](O)c1ccccc1	ZINC000819054096	DH	On-Demand	Anodyne	ADRB1	31	67
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC[C@H](O)c1ccccc1	ZINC000819054096	DH	On-Demand	Anodyne	ADRB3	69	67
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC[C@@H](O)c1ccccc1	ZINC000819054097	DH	On-Demand	Anodyne	ADRB2	52	40
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC[C@@H](O)c1ccccc1	ZINC000819054097	DH	On-Demand	Anodyne	ADRB1	31	67
C[C@@H](Cc1ccc(C(F)(F)F)cc1)NC[C@@H](O)c1ccccc1	ZINC000819054097	DH	On-Demand	Anodyne	ADRB3	69	67
Cc1nc(CN2CCC(CNC[C@H](O)c3ccccc3)CC2)oc1C	ZINC000819054105	EF	On-Demand	Anodyne	SLC6A3	20	47
Cc1nc(CN2CCC(CNC[C@H](O)c3ccccc3)CC2)oc1C	ZINC000819054105	EF	On-Demand	Anodyne	HTR4	39	41
Cc1nc(CN2CCC(CNC[C@@H](O)c3ccccc3)CC2)oc1C	ZINC000819054106	EF	On-Demand	Anodyne	SLC6A3	20	47
Cc1nc(CN2CCC(CNC[C@@H](O)c3ccccc3)CC2)oc1C	ZINC000819054106	EF	On-Demand	Anodyne	HTR4	39	41
CON(C)C(=O)CCc1cccc(OC(F)F)c1	ZINC000819054124	CE	On-Demand	Anodyne	CRTM	61	40
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H]1CCc2ccccc21	ZINC000819054137	FH	On-Demand	Mild	PAPA1_CARPA	48	42
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H]1CCc2ccccc21	ZINC000819054138	FH	On-Demand	Mild	PAPA1_CARPA	48	42
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(F)cc1Cl	ZINC000819054161	EH	On-Demand	Anodyne	ADRB2	30	40
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(F)cc1Cl	ZINC000819054161	EH	On-Demand	Anodyne	ADRB1	28	40
O[C@H](CNCCc1cccc(F)c1F)c1ccc(F)cc1Cl	ZINC000819054162	EH	On-Demand	Anodyne	ADRB2	30	40
O[C@H](CNCCc1cccc(F)c1F)c1ccc(F)cc1Cl	ZINC000819054162	EH	On-Demand	Anodyne	ADRB1	28	40
CN1CCC(N2CC[C@@H](NC[C@H](O)c3ccccc3Cl)C2)CC1	ZINC000819054182	EE	On-Demand	Anodyne	OPRL1	44	37
CN1CCC(N2CC[C@@H](NC[C@H](O)c3ccccc3Cl)C2)CC1	ZINC000819054182	EE	On-Demand	Anodyne	SLC6A5	18	44
CN1CCC(N2CC[C@@H](NC[C@H](O)c3ccccc3Br)C2)CC1	ZINC000819054185	GE	On-Demand	Anodyne	SLC6A5	17	42
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3ccccc3Br)C2)CC1	ZINC000819054187	GE	On-Demand	Anodyne	SLC6A5	17	42
O[C@@H](CNCCc1cccc(F)c1F)c1cccc(Br)c1	ZINC000819054188	FH	On-Demand	Anodyne	ADRB2	27	43
O[C@@H](CNCCc1cccc(F)c1F)c1cccc(Br)c1	ZINC000819054188	FH	On-Demand	Anodyne	ADRB1	28	41
O[C@@H](CNCCc1cccc(F)c1F)c1cccc(Br)c1	ZINC000819054188	FH	On-Demand	Anodyne	ADRB3	48	42
O[C@H](CNCCc1cccc(F)c1F)c1cccc(Br)c1	ZINC000819054189	FH	On-Demand	Anodyne	ADRB2	27	43
O[C@H](CNCCc1cccc(F)c1F)c1cccc(Br)c1	ZINC000819054189	FH	On-Demand	Anodyne	ADRB1	28	41
O[C@H](CNCCc1cccc(F)c1F)c1cccc(Br)c1	ZINC000819054189	FH	On-Demand	Anodyne	ADRB3	48	42
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(N2CCOCC2)cn1	ZINC000819054190	DD	On-Demand	Anodyne	STAT6	51	31
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(N2CCOCC2)cn1	ZINC000819054193	DD	On-Demand	Anodyne	STAT6	51	31
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(N2CCOCC2)cn1	ZINC000819054195	DD	On-Demand	Anodyne	STAT6	51	31
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(N2CCOCC2)cn1	ZINC000819054196	DD	On-Demand	Anodyne	STAT6	51	31
O=C(Nc1ccc(N2CCOCC2)cn1)C(F)=C1CCC1	ZINC000819054198	CE	On-Demand	Anodyne	STAT6	56	34
CN1CCC(N2CC[C@@H](NC[C@H](O)c3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000819054200	FE	On-Demand	Anodyne	SLC6A5	32	52
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3ccc(C(F)(F)F)cc3)C2)CC1	ZINC000819054204	FE	On-Demand	Anodyne	SLC6A5	32	52
CN(Cc1ccc(F)cc1F)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819054227	GH	On-Demand	Mild	PAPA1_CARPA	44	46
CN1CCC(N2CC[C@@H](NCCS(C)(=O)=O)C2)CC1	ZINC000819054229	CB	On-Demand	Anodyne	SLC6A5	17	42
CN(Cc1ccc(F)cc1F)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819054232	GH	On-Demand	Mild	PAPA1_CARPA	44	46
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3c(F)cccc3F)C2)CC1	ZINC000819054255	ED	On-Demand	Anodyne	SLC6A5	17	40
CN1CCC(N2CC[C@@H](NC[C@H](O)c3c(F)cccc3F)C2)CC1	ZINC000819054257	ED	On-Demand	Anodyne	SLC6A5	17	40
O[C@@H](CNCCc1ccc(F)cc1F)c1ccccc1Cl	ZINC000819054289	DG	On-Demand	Anodyne	ADRB3	27	41
O=S(=O)(N1CCC(CNC[C@@H](O)c2ccc(F)cn2)CC1)C(F)(F)F	ZINC000819054290	GD	On-Demand	Anodyne	ADAMTS4	66	35
O=S(=O)(N1CCC(CNC[C@H](O)c2ccc(F)cn2)CC1)C(F)(F)F	ZINC000819054291	GD	On-Demand	Anodyne	ADAMTS4	66	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(C(=O)N3CCCC3)cc1)C2	ZINC000819054323	GF	On-Demand	Anodyne	EPHX2	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(C(=O)N3CCCC3)cc1)C2	ZINC000819054323	GF	On-Demand	Anodyne	L3MBTL3	66	36
CN(CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CC(F)(F)F	ZINC000819054325	GE	On-Demand	Anodyne	GPR119	28	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(C(=O)N3CCCC3)cc1)C2	ZINC000819054326	GF	On-Demand	Anodyne	EPHX2	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(C(=O)N3CCCC3)cc1)C2	ZINC000819054326	GF	On-Demand	Anodyne	L3MBTL3	66	36
CN(CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CC(F)(F)F	ZINC000819054327	GE	On-Demand	Anodyne	GPR119	28	41
COc1cccc([S@@](=O)CC(=O)N2CCCc3cc(C)ccc32)c1	ZINC000819054349	EG	On-Demand	Anodyne	DRD4	44	37
COc1cccc([S@](=O)CC(=O)N2CCCc3cc(C)ccc32)c1	ZINC000819054351	EG	On-Demand	Anodyne	DRD4	44	37
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819054362	FH	On-Demand	Mild	ACE	28	44
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819054362	FH	On-Demand	Mild	PAPA1_CARPA	40	44
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819054362	FH	On-Demand	Mild	TPP2	56	39
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819054362	FH	On-Demand	Mild	FPR1	42	36
C[C@@H]1Cc2ccccc2N1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819054370	FH	On-Demand	Mild	ACE	28	44
C[C@@H]1Cc2ccccc2N1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819054370	FH	On-Demand	Mild	PAPA1_CARPA	40	44
C[C@@H]1Cc2ccccc2N1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819054370	FH	On-Demand	Mild	TPP2	56	39
C[C@@H]1Cc2ccccc2N1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819054370	FH	On-Demand	Mild	FPR1	42	36
O=C(C(F)=C1CCC1)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819054378	DG	On-Demand	Anodyne	SIGMAR1	24	42
CNC(=O)Nc1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819054382	CE	On-Demand	Anodyne	KCNK3	62	35
CNC(=O)Nc1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819054384	CE	On-Demand	Anodyne	KCNK3	62	35
CNC(=O)Nc1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819054386	CE	On-Demand	Anodyne	KCNK3	62	35
CNC(=O)Nc1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819054387	CE	On-Demand	Anodyne	KCNK3	62	35
C[C@@H]1Cc2ccccc2N1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819054393	CF	On-Demand	Anodyne	DRD4	23	40
C[C@@H]1Cc2ccccc2N1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819054393	CF	On-Demand	Anodyne	TPP2	42	32
C[C@@H]1Cc2ccccc2N1C(=O)/C=C\[C@H]1CCCO1	ZINC000819054394	CF	On-Demand	Anodyne	DRD4	23	40
C[C@@H]1Cc2ccccc2N1C(=O)/C=C\[C@H]1CCCO1	ZINC000819054394	CF	On-Demand	Anodyne	TPP2	42	32
C[C@@H]1Cc2ccccc2N1C(=O)/C=C/[C@H]1CCCO1	ZINC000819054396	CF	On-Demand	Anodyne	DRD4	23	40
C[C@@H]1Cc2ccccc2N1C(=O)/C=C/[C@H]1CCCO1	ZINC000819054396	CF	On-Demand	Anodyne	TPP2	42	32
CC(=O)Nc1cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1F	ZINC000819054397	GG	On-Demand	Mild	PAPA1_CARPA	45	45
C[C@@H]1Cc2ccccc2N1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819054398	CF	On-Demand	Anodyne	DRD4	23	40
C[C@@H]1Cc2ccccc2N1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819054398	CF	On-Demand	Anodyne	TPP2	42	32
CC(=O)Nc1cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1F	ZINC000819054401	GG	On-Demand	Mild	PAPA1_CARPA	45	45
CN1CCN(c2ccccc2NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819054403	GH	On-Demand	Anodyne	HTR1A	32	40
CN1CCN(c2ccccc2NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819054403	GH	On-Demand	Anodyne	DRD2	25	41
CN1CCN(c2ccccc2NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819054403	GH	On-Demand	Anodyne	DRD1	21	41
CN1CCN(c2ccccc2NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819054403	GH	On-Demand	Anodyne	HTR7	36	40
CN1CCN(c2ccccc2NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819054403	GH	On-Demand	Anodyne	KCNQ2	80	47
CN1CCN(c2ccccc2NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819054403	GH	On-Demand	Anodyne	ABCB1	32	40
CN1CCN(c2ccccc2NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819054403	GH	On-Demand	Anodyne	HCAR2	32	40
O=C(CCCNC[C@H](O)c1ccccc1Cl)N1Cc2ccccc2C1	ZINC000819054419	FG	On-Demand	Anodyne	DPP8	15	41
O=C(CCCNC[C@@H](O)c1cccnc1)N1CCc2ccccc21	ZINC000819054427	EE	On-Demand	Anodyne	ADRB2	25	45
O=C(CCCNC[C@@H](O)c1cccnc1)N1CCc2ccccc21	ZINC000819054427	EE	On-Demand	Anodyne	ADRB1	27	40
O=C(CCCNC[C@@H](O)c1cccnc1)N1CCc2ccccc21	ZINC000819054427	EE	On-Demand	Anodyne	ADRB3	98	50
O=C(CCCNC[C@H](O)c1cccnc1)N1CCc2ccccc21	ZINC000819054430	EE	On-Demand	Anodyne	ADRB2	25	45
O=C(CCCNC[C@H](O)c1cccnc1)N1CCc2ccccc21	ZINC000819054430	EE	On-Demand	Anodyne	ADRB1	27	40
O=C(CCCNC[C@H](O)c1cccnc1)N1CCc2ccccc21	ZINC000819054430	EE	On-Demand	Anodyne	ADRB3	98	50
O=C(CCc1cccc(OC(F)F)c1)Nc1ccccc1C(=O)NC1CC1	ZINC000819054447	FH	On-Demand	Anodyne	HCAR2	46	44
CN1CCN(c2ccccc2NC(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819054479	FD	On-Demand	Anodyne	HTR1A	17	43
CN1CCN(c2ccccc2NC(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819054479	FD	On-Demand	Anodyne	DRD1	43	38
CN1CCN(c2ccccc2NC(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819054479	FD	On-Demand	Anodyne	KCNQ2	75	37
CN1CCN(c2ccccc2NC(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819054479	FD	On-Demand	Anodyne	CSF1R	29	49
CN1CCN(c2ccccc2NC(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819054479	FD	On-Demand	Anodyne	CHEK1	20	47
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)Nc3ccccn3)nn2)C1	ZINC000819054484	FE	On-Demand	Anodyne	GPR119	20	43
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)Nc3ccccn3)nn2)C1	ZINC000819054485	FE	On-Demand	Anodyne	GPR119	20	43
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2C(=O)NC2CC2)c1	ZINC000819054490	FF	On-Demand	Anodyne	DRD4	18	41
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2C(=O)NC2CC2)c1	ZINC000819054490	FF	On-Demand	Anodyne	CNR2	16	43
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2C(=O)NC2CC2)c1	ZINC000819054490	FF	On-Demand	Anodyne	SIGMAR1	19	40
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2C(=O)NC2CC2)c1	ZINC000819054490	FF	On-Demand	Anodyne	CCR3	41	36
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2C(=O)NC2CC2)c1	ZINC000819054490	FF	On-Demand	Anodyne	MCHR1	20	42
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2C(=O)NC2CC2)c1	ZINC000819054490	FF	On-Demand	Anodyne	KCNK3	65	35
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2C(=O)NC2CC2)c1	ZINC000819054490	FF	On-Demand	Anodyne	KCNK9	53	35
C[C@@H]1Cc2ccccc2[C@@H]1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819054501	FH	On-Demand	Anodyne	GPR119	47	48
C[C@@H]1Cc2ccccc2[C@@H]1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819054502	FH	On-Demand	Anodyne	GPR119	47	48
C[C@@H]1Cc2ccccc2[C@H]1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819054503	FH	On-Demand	Anodyne	GPR119	47	48
C[C@@H]1Cc2ccccc2[C@H]1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819054504	FH	On-Demand	Anodyne	GPR119	47	48
O[C@@H](CNCc1cccc(COC2CCOCC2)c1)c1ccccc1	ZINC000819054525	EG	On-Demand	Anodyne	ADRB3	40	38
O[C@H](CNCc1cccc(COC2CCOCC2)c1)c1ccccc1	ZINC000819054526	EG	On-Demand	Anodyne	ADRB3	40	38
O=C(Nc1ccccc1C(=O)NC1CC1)c1cc2c(cn1)OCCO2	ZINC000819054527	ED	On-Demand	Anodyne	EPHB3	42	34
Cc1nc(CN2CCC(CNC[C@H](O)c3ccccc3Cl)CC2)oc1C	ZINC000819054562	GG	On-Demand	Anodyne	HTR4	46	39
CN1CCN(c2ccccc2NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819054565	FE	On-Demand	Anodyne	KCNQ2	71	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc(F)c2F)cc1	ZINC000819054580	FE	On-Demand	Anodyne	ADRB2	46	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc(F)c2F)cc1	ZINC000819054580	FE	On-Demand	Anodyne	ADRB1	43	38
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc(F)c2F)cc1	ZINC000819054580	FE	On-Demand	Anodyne	ADRB3	97	41
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc(F)c2F)cc1	ZINC000819054581	FE	On-Demand	Anodyne	ADRB2	46	42
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc(F)c2F)cc1	ZINC000819054581	FE	On-Demand	Anodyne	ADRB1	43	38
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc(F)c2F)cc1	ZINC000819054581	FE	On-Demand	Anodyne	ADRB3	97	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cccc(F)c2F)c1	ZINC000819054585	DF	On-Demand	Bother	ADRB1	31	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cccc(F)c2F)c1	ZINC000819054585	DF	On-Demand	Bother	ADRB3	57	42
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cccc(F)c2F)c1	ZINC000819054586	DF	On-Demand	Bother	ADRB1	31	42
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cccc(F)c2F)c1	ZINC000819054586	DF	On-Demand	Bother	ADRB3	57	42
CON(C)C(=O)CCN[C@@H]1CCN(C2CCN(C)CC2)C1	ZINC000819054608	CC	On-Demand	Anodyne	SLC6A5	18	42
CON(C)C(=O)CCN[C@H]1CCN(C2CCN(C)CC2)C1	ZINC000819054609	CC	On-Demand	Anodyne	SLC6A5	18	42
CC1(C)C[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819054620	BD	On-Demand	Anodyne	ADRB2	22	41
CC1(C)C[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819054620	BD	On-Demand	Anodyne	ADRB1	23	41
CC1(C)C[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819054620	BD	On-Demand	Anodyne	ADRB3	90	46
CC1(C)C[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819054623	BD	On-Demand	Anodyne	ADRB2	22	41
CC1(C)C[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819054623	BD	On-Demand	Anodyne	ADRB1	23	41
CC1(C)C[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819054623	BD	On-Demand	Anodyne	ADRB3	90	46
CN1CCC(N2CC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2)CC1	ZINC000819054643	EE	On-Demand	Anodyne	ADRB1	33	46
CN1CCC(N2CC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2)CC1	ZINC000819054643	EE	On-Demand	Anodyne	ADRB3	52	48
CN1CCC(N2CC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2)CC1	ZINC000819054643	EE	On-Demand	Anodyne	IGF1R	28	43
CN1CCC(N2CC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2)CC1	ZINC000819054643	EE	On-Demand	Anodyne	SLC6A5	18	49
CN1CCC(N2CC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2)CC1	ZINC000819054643	EE	On-Demand	Anodyne	CYP3A4	51	43
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2)CC1	ZINC000819054645	EE	On-Demand	Anodyne	ADRB1	33	46
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2)CC1	ZINC000819054645	EE	On-Demand	Anodyne	ADRB3	52	48
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2)CC1	ZINC000819054645	EE	On-Demand	Anodyne	IGF1R	28	43
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2)CC1	ZINC000819054645	EE	On-Demand	Anodyne	SLC6A5	18	49
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2)CC1	ZINC000819054645	EE	On-Demand	Anodyne	CYP3A4	51	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(OC(F)(F)F)c1)C2	ZINC000819054670	FG	On-Demand	Anodyne	EPHX2	35	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(OC(F)(F)F)c1)C2	ZINC000819054674	FG	On-Demand	Anodyne	EPHX2	35	48
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1ccccc1F	ZINC000819054685	DD	On-Demand	Anodyne	ADRB3	66	45
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1ccccc1F	ZINC000819054688	DD	On-Demand	Anodyne	ADRB3	66	45
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1ccccc1F	ZINC000819054691	DD	On-Demand	Anodyne	ADRB3	66	45
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1ccccc1F	ZINC000819054692	DD	On-Demand	Anodyne	ADRB3	66	45
O=C(/C=C\[C@@H]1CCCO1)Nc1ccccc1N1CCCCCC1	ZINC000819054708	DH	On-Demand	Anodyne	KCNQ2	83	45
O=C(/C=C/[C@H]1CCCO1)Nc1ccccc1N1CCCCCC1	ZINC000819054710	DH	On-Demand	Anodyne	KCNQ2	83	45
O=C(/C=C/[C@@H]1CCCO1)Nc1ccccc1N1CCCCCC1	ZINC000819054712	DH	On-Demand	Anodyne	KCNQ2	83	45
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819054713	GF	On-Demand	Anodyne	CCR2	47	37
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819054713	GF	On-Demand	Anodyne	LIPG	60	41
O=C(/C=C\[C@H]1CCCO1)Nc1ccccc1N1CCCCCC1	ZINC000819054714	DH	On-Demand	Anodyne	KCNQ2	83	45
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819054715	GF	On-Demand	Anodyne	CCR2	47	37
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819054715	GF	On-Demand	Anodyne	LIPG	60	41
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819054717	GF	On-Demand	Anodyne	CCR2	47	37
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819054717	GF	On-Demand	Anodyne	LIPG	60	41
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819054720	GF	On-Demand	Anodyne	CCR2	47	37
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819054720	GF	On-Demand	Anodyne	LIPG	60	41
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(c2ccccc2C(N)=O)C1	ZINC000819054775	ED	On-Demand	Anodyne	CCR8	52	33
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(c2ccccc2C(N)=O)C1	ZINC000819054782	ED	On-Demand	Anodyne	CCR8	52	33
COC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819054795	ED	On-Demand	Anodyne	CACNA1C	51	35
COC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819054795	ED	On-Demand	Anodyne	CACNA1D	70	35
COC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819054795	ED	On-Demand	Anodyne	SLC27A4	96	46
COC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819054800	ED	On-Demand	Anodyne	CACNA1C	51	35
COC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819054800	ED	On-Demand	Anodyne	CACNA1D	70	35
COC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819054800	ED	On-Demand	Anodyne	SLC27A4	96	46
COCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819054805	EE	On-Demand	Anodyne	CACNA1C	110	43
COCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819054805	EE	On-Demand	Anodyne	CACNA1D	94	43
COCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819054805	EE	On-Demand	Anodyne	SLC27A4	85	39
COCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819054809	EE	On-Demand	Anodyne	CACNA1C	110	43
COCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819054809	EE	On-Demand	Anodyne	CACNA1D	94	43
COCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819054809	EE	On-Demand	Anodyne	SLC27A4	85	39
O=C(/C=C/[C@@H]1CCCO1)Nc1ccccc1C(=O)NCc1ccc2c(c1)OCO2	ZINC000819054821	GG	On-Demand	Anodyne	NOS2	80	34
O=C(/C=C\[C@H]1CCCO1)Nc1ccccc1C(=O)NCc1ccc2c(c1)OCO2	ZINC000819054823	GG	On-Demand	Anodyne	NOS2	80	34
O=C(/C=C/[C@H]1CCCO1)Nc1ccccc1C(=O)NCc1ccc2c(c1)OCO2	ZINC000819054825	GG	On-Demand	Anodyne	NOS2	80	34
O=C(/C=C\[C@@H]1CCCO1)Nc1ccccc1C(=O)NCc1ccc2c(c1)OCO2	ZINC000819054827	GG	On-Demand	Anodyne	NOS2	80	34
C[C@@H](CC(=O)NCCN1C(=O)S/C(=C/c2ccccc2)C1=O)n1cccn1	ZINC000819054832	GF	On-Demand	Anodyne	AKR1B1	49	44
C[C@@H](CC(=O)NCCN1C(=O)S/C(=C\c2ccccc2)C1=O)n1cccn1	ZINC000819054834	GF	On-Demand	Anodyne	AKR1B1	49	44
C[C@H](CC(=O)NCCN1C(=O)S/C(=C/c2ccccc2)C1=O)n1cccn1	ZINC000819054835	GF	On-Demand	Anodyne	AKR1B1	49	44
C[C@H](CC(=O)NCCN1C(=O)S/C(=C\c2ccccc2)C1=O)n1cccn1	ZINC000819054836	GF	On-Demand	Anodyne	AKR1B1	49	44
O=C(CCNCC1CCN(S(=O)(=O)C(F)(F)F)CC1)Nc1cccnc1	ZINC000819054840	GD	On-Demand	Anodyne	CHRNA7	43	37
O=C(CCNCC1CCN(S(=O)(=O)C(F)(F)F)CC1)Nc1cccnc1	ZINC000819054840	GD	On-Demand	Anodyne	NAMPT	48	41
O=C(NC1CCN(C(=O)c2ccoc2)CC1)C(F)=C1CCC1	ZINC000819054846	DE	On-Demand	Anodyne	L3MBTL3	60	35
O=S(=O)(N1CCC(CNC[C@@H](O)Cc2ccc(F)cc2)CC1)C(F)(F)F	ZINC000819054888	GD	On-Demand	Anodyne	SLC6A3	18	43
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000819054890	DF	On-Demand	Anodyne	EPHX2	46	41
O=S(=O)(N1CCC(CNC[C@H](O)Cc2ccc(F)cc2)CC1)C(F)(F)F	ZINC000819054891	GD	On-Demand	Anodyne	SLC6A3	18	43
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000819054892	DF	On-Demand	Anodyne	EPHX2	46	41
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000819054893	DF	On-Demand	Anodyne	EPHX2	46	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(NC(=O)NC2CC2)cc1	ZINC000819054894	DF	On-Demand	Anodyne	EPHX2	46	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(C)C[C@@H]1c1ccccc1)C2	ZINC000819054899	FE	On-Demand	Anodyne	SLC6A3	17	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(C)C[C@H]1c1ccccc1)C2	ZINC000819054900	FE	On-Demand	Anodyne	SLC6A3	17	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(C)C[C@H]1c1ccccc1)C2	ZINC000819054901	FE	On-Demand	Anodyne	SLC6A3	17	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(C)C[C@@H]1c1ccccc1)C2	ZINC000819054902	FE	On-Demand	Anodyne	SLC6A3	17	43
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(Br)cc2F)cc1	ZINC000819054905	GG	On-Demand	Mild	ADRB2	30	40
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(Br)cc2F)cc1	ZINC000819054905	GG	On-Demand	Mild	ADRB1	54	41
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(Br)cc2F)cc1	ZINC000819054905	GG	On-Demand	Mild	GRIN1	16	41
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(Br)cc2F)cc1	ZINC000819054905	GG	On-Demand	Mild	ADRB3	35	41
N#CCc1ccc(OC[C@H](O)CNCc2ccc(Br)cc2F)cc1	ZINC000819054906	GG	On-Demand	Mild	ADRB2	30	40
N#CCc1ccc(OC[C@H](O)CNCc2ccc(Br)cc2F)cc1	ZINC000819054906	GG	On-Demand	Mild	ADRB1	54	41
N#CCc1ccc(OC[C@H](O)CNCc2ccc(Br)cc2F)cc1	ZINC000819054906	GG	On-Demand	Mild	GRIN1	16	41
N#CCc1ccc(OC[C@H](O)CNCc2ccc(Br)cc2F)cc1	ZINC000819054906	GG	On-Demand	Mild	ADRB3	35	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(Br)cc2F)cc1	ZINC000819054942	GG	On-Demand	Anodyne	ADRB2	35	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(Br)cc2F)cc1	ZINC000819054942	GG	On-Demand	Anodyne	ADRB1	62	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(Br)cc2F)cc1	ZINC000819054942	GG	On-Demand	Anodyne	GRIN1	15	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(Br)cc2F)cc1	ZINC000819054942	GG	On-Demand	Anodyne	ADRB3	34	42
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(Br)cc2F)cc1	ZINC000819054943	GG	On-Demand	Anodyne	ADRB2	35	40
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(Br)cc2F)cc1	ZINC000819054943	GG	On-Demand	Anodyne	ADRB1	62	42
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(Br)cc2F)cc1	ZINC000819054943	GG	On-Demand	Anodyne	GRIN1	15	42
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(Br)cc2F)cc1	ZINC000819054943	GG	On-Demand	Anodyne	ADRB3	34	42
CCN(Cc1ccccc1)C(=O)C(F)=C1CCC1	ZINC000819054944	BG	On-Demand	Anodyne	OPRD1	15	40
CCN(Cc1ccccc1)C(=O)C(F)=C1CCC1	ZINC000819054944	BG	On-Demand	Anodyne	TSPO	30	44
CCN(Cc1ccccc1)C(=O)C(F)=C1CCC1	ZINC000819054944	BG	On-Demand	Anodyne	LIMK2	19	42
O=C(Cc1nsc2ccccc12)Nc1ccc(N2CCCC2)cc1	ZINC000819054957	EI	On-Demand	Anodyne	HTR1A	20	40
O=C(Cc1nsc2ccccc12)Nc1ccc(N2CCCC2)cc1	ZINC000819054957	EI	On-Demand	Anodyne	DRD2	24	42
O=C(Cc1nsc2ccccc12)Nc1ccc(N2CCCC2)cc1	ZINC000819054957	EI	On-Demand	Anodyne	KCNQ2	27	43
O=C(CCCNC[C@H](O)c1ccccc1)N1Cc2ccccc2C1	ZINC000819054971	DF	On-Demand	Anodyne	ADRB2	26	45
O=C(CCCNC[C@H](O)c1ccccc1)N1Cc2ccccc2C1	ZINC000819054971	DF	On-Demand	Anodyne	ADRB3	50	41
O=C(CCCNC[C@H](O)c1ccccc1)N1Cc2ccccc2C1	ZINC000819054971	DF	On-Demand	Anodyne	DPP8	25	44
O=C(CCCNC[C@@H](O)c1ccccc1)N1Cc2ccccc2C1	ZINC000819054972	DF	On-Demand	Anodyne	ADRB2	26	45
O=C(CCCNC[C@@H](O)c1ccccc1)N1Cc2ccccc2C1	ZINC000819054972	DF	On-Demand	Anodyne	ADRB3	50	41
O=C(CCCNC[C@@H](O)c1ccccc1)N1Cc2ccccc2C1	ZINC000819054972	DF	On-Demand	Anodyne	DPP8	25	44
CN1CCC(N2CC[C@@H](NC[C@H](O)c3ccc(F)cc3Cl)C2)CC1	ZINC000819054999	FE	On-Demand	Anodyne	SLC6A5	17	42
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3ccc(F)cc3Cl)C2)CC1	ZINC000819055001	FE	On-Demand	Anodyne	SLC6A5	17	42
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(F)c(F)c1	ZINC000819055029	DG	On-Demand	Anodyne	ADRB2	44	39
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(F)c(F)c1	ZINC000819055029	DG	On-Demand	Anodyne	ADRB1	39	43
O[C@@H](CNCCc1cccc(F)c1F)c1ccc(F)c(F)c1	ZINC000819055029	DG	On-Demand	Anodyne	ADRB3	54	44
O[C@H](CNCCc1cccc(F)c1F)c1ccc(F)c(F)c1	ZINC000819055030	DG	On-Demand	Anodyne	ADRB2	44	39
O[C@H](CNCCc1cccc(F)c1F)c1ccc(F)c(F)c1	ZINC000819055030	DG	On-Demand	Anodyne	ADRB1	39	43
O[C@H](CNCCc1cccc(F)c1F)c1ccc(F)c(F)c1	ZINC000819055030	DG	On-Demand	Anodyne	ADRB3	54	44
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc(F)c1F	ZINC000819055031	DG	On-Demand	Anodyne	ADRB2	31	40
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc(F)c1F	ZINC000819055031	DG	On-Demand	Anodyne	ADRB1	21	40
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc(F)c1F	ZINC000819055031	DG	On-Demand	Anodyne	LEF	42	33
O[C@@H](CNCCc1cccc(F)c1F)c1cccc(Cl)c1	ZINC000819055036	DG	On-Demand	Anodyne	ADRB2	58	43
O[C@@H](CNCCc1cccc(F)c1F)c1cccc(Cl)c1	ZINC000819055036	DG	On-Demand	Anodyne	ADRB1	65	56
O[C@@H](CNCCc1cccc(F)c1F)c1cccc(Cl)c1	ZINC000819055036	DG	On-Demand	Anodyne	ADRB3	86	58
O[C@H](CNCCc1cccc(F)c1F)c1cccc(Cl)c1	ZINC000819055037	DG	On-Demand	Anodyne	ADRB2	58	43
O[C@H](CNCCc1cccc(F)c1F)c1cccc(Cl)c1	ZINC000819055037	DG	On-Demand	Anodyne	ADRB1	65	56
O[C@H](CNCCc1cccc(F)c1F)c1cccc(Cl)c1	ZINC000819055037	DG	On-Demand	Anodyne	ADRB3	86	58
O[C@@H](CNCCN1CCSCC1)c1ccc(OC(F)(F)F)cc1	ZINC000819055045	FE	On-Demand	Anodyne	ADRB3	19	42
O[C@H](CNCCN1CCSCC1)c1ccc(OC(F)(F)F)cc1	ZINC000819055046	FE	On-Demand	Anodyne	ADRB3	19	42
CN1CCC(N2CC[C@@H](NC[C@H](O)c3ccc(Cl)cc3)C2)CC1	ZINC000819055071	EE	On-Demand	Anodyne	SLC6A3	23	43
CN1CCC(N2CC[C@@H](NC[C@H](O)c3ccc(Cl)cc3)C2)CC1	ZINC000819055071	EE	On-Demand	Anodyne	ADRB3	20	44
CN1CCC(N2CC[C@@H](NC[C@H](O)c3ccc(Cl)cc3)C2)CC1	ZINC000819055071	EE	On-Demand	Anodyne	SLC6A5	18	48
O=S(=O)(N1CCC(CNC[C@H](O)c2cccc(F)c2)CC1)C(F)(F)F	ZINC000819055076	GE	On-Demand	Anodyne	ADRB2	15	42
O=S(=O)(N1CCC(CNC[C@H](O)c2cccc(F)c2)CC1)C(F)(F)F	ZINC000819055076	GE	On-Demand	Anodyne	ADRB1	29	40
O=S(=O)(N1CCC(CNC[C@H](O)c2cccc(F)c2)CC1)C(F)(F)F	ZINC000819055076	GE	On-Demand	Anodyne	ADRB3	44	42
O=S(=O)(N1CCC(CNC[C@@H](O)c2cccc(F)c2)CC1)C(F)(F)F	ZINC000819055080	GE	On-Demand	Anodyne	ADRB2	15	42
O=S(=O)(N1CCC(CNC[C@@H](O)c2cccc(F)c2)CC1)C(F)(F)F	ZINC000819055080	GE	On-Demand	Anodyne	ADRB1	29	40
O=S(=O)(N1CCC(CNC[C@@H](O)c2cccc(F)c2)CC1)C(F)(F)F	ZINC000819055080	GE	On-Demand	Anodyne	ADRB3	44	42
Cc1ccccc1[C@@H](O)CNCCc1cccc(F)c1F	ZINC000819055089	CG	On-Demand	Anodyne	ADRB2	29	42
Cc1ccccc1[C@@H](O)CNCCc1cccc(F)c1F	ZINC000819055089	CG	On-Demand	Anodyne	ADRB1	19	42
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819055103	ED	On-Demand	Anodyne	ADRB1	22	40
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819055103	ED	On-Demand	Anodyne	ADRB3	66	49
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819055103	ED	On-Demand	Anodyne	SCD1	19	42
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819055103	ED	On-Demand	Anodyne	SCD	27	42
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819055104	ED	On-Demand	Anodyne	ADRB1	22	40
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819055104	ED	On-Demand	Anodyne	ADRB3	66	49
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819055104	ED	On-Demand	Anodyne	SCD1	19	42
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819055104	ED	On-Demand	Anodyne	SCD	27	42
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819055105	ED	On-Demand	Anodyne	ADRB1	22	40
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819055105	ED	On-Demand	Anodyne	ADRB3	66	49
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819055105	ED	On-Demand	Anodyne	SCD1	19	42
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819055105	ED	On-Demand	Anodyne	SCD	27	42
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819055106	ED	On-Demand	Anodyne	ADRB1	22	40
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819055106	ED	On-Demand	Anodyne	ADRB3	66	49
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819055106	ED	On-Demand	Anodyne	SCD1	19	42
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819055106	ED	On-Demand	Anodyne	SCD	27	42
O=S(=O)(N1CCC(CNC[C@@H](O)c2cccnc2)CC1)C(F)(F)F	ZINC000819055113	FD	On-Demand	Anodyne	ADRB2	27	43
O=S(=O)(N1CCC(CNC[C@@H](O)c2cccnc2)CC1)C(F)(F)F	ZINC000819055113	FD	On-Demand	Anodyne	ADRB1	30	42
O=S(=O)(N1CCC(CNC[C@@H](O)c2cccnc2)CC1)C(F)(F)F	ZINC000819055113	FD	On-Demand	Anodyne	ADRB3	106	54
O=S(=O)(N1CCC(CNC[C@H](O)c2cccnc2)CC1)C(F)(F)F	ZINC000819055115	FD	On-Demand	Anodyne	ADRB2	27	43
O=S(=O)(N1CCC(CNC[C@H](O)c2cccnc2)CC1)C(F)(F)F	ZINC000819055115	FD	On-Demand	Anodyne	ADRB1	30	42
O=S(=O)(N1CCC(CNC[C@H](O)c2cccnc2)CC1)C(F)(F)F	ZINC000819055115	FD	On-Demand	Anodyne	ADRB3	106	54
O=C(C(F)=C1CCC1)N1CCC(c2ccccc2)CC1	ZINC000819055129	CH	On-Demand	Anodyne	SLC18A3	71	49
O=C(C(F)=C1CCC1)N1CCC(c2ccccc2)CC1	ZINC000819055129	CH	On-Demand	Anodyne	RBP4	28	44
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819055138	ED	On-Demand	Anodyne	ADRB3	19	40
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819055138	ED	On-Demand	Anodyne	SCD1	15	44
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819055138	ED	On-Demand	Anodyne	SCD	17	44
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819055140	ED	On-Demand	Anodyne	ADRB3	19	40
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819055140	ED	On-Demand	Anodyne	SCD1	15	44
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819055140	ED	On-Demand	Anodyne	SCD	17	44
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819055141	ED	On-Demand	Anodyne	ADRB3	19	40
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819055141	ED	On-Demand	Anodyne	SCD1	15	44
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819055141	ED	On-Demand	Anodyne	SCD	17	44
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819055143	ED	On-Demand	Anodyne	ADRB3	19	40
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819055143	ED	On-Demand	Anodyne	SCD1	15	44
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819055143	ED	On-Demand	Anodyne	SCD	17	44
CON(C)C(=O)CCNCC1(N2CCSCC2)CCCCC1	ZINC000819055151	ED	On-Demand	Anodyne	HCN1	52	32
CON(C)C(=O)CCNCC1(N2CCSCC2)CCCCC1	ZINC000819055151	ED	On-Demand	Anodyne	HCN4	50	32
Cc1cc(F)ccc1[C@@H](O)CNCC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000819055166	GE	On-Demand	Anodyne	ADAMTS4	50	36
CCONC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819055169	CC	On-Demand	Anodyne	MTNR1A	45	42
CCONC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819055169	CC	On-Demand	Anodyne	MTNR1B	45	42
CCONC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819055170	CC	On-Demand	Anodyne	MTNR1A	45	42
CCONC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819055170	CC	On-Demand	Anodyne	MTNR1B	45	42
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1CC(F)(F)F	ZINC000819055171	EE	On-Demand	Anodyne	ADRB1	29	41
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1CC(F)(F)F	ZINC000819055171	EE	On-Demand	Anodyne	ADRB3	46	45
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1CC(F)(F)F	ZINC000819055171	EE	On-Demand	Anodyne	CYP3A4	48	36
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1CC(F)(F)F	ZINC000819055173	EE	On-Demand	Anodyne	ADRB1	29	41
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1CC(F)(F)F	ZINC000819055173	EE	On-Demand	Anodyne	ADRB3	46	45
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1CC(F)(F)F	ZINC000819055173	EE	On-Demand	Anodyne	CYP3A4	48	36
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1CC(F)(F)F	ZINC000819055174	EE	On-Demand	Anodyne	ADRB1	29	41
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1CC(F)(F)F	ZINC000819055174	EE	On-Demand	Anodyne	ADRB3	46	45
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1CC(F)(F)F	ZINC000819055174	EE	On-Demand	Anodyne	CYP3A4	48	36
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1CC(F)(F)F	ZINC000819055175	EE	On-Demand	Anodyne	ADRB1	29	41
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1CC(F)(F)F	ZINC000819055175	EE	On-Demand	Anodyne	ADRB3	46	45
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1CC(F)(F)F	ZINC000819055175	EE	On-Demand	Anodyne	CYP3A4	48	36
C=CCCn1cc(C(=O)NCCCCCC)nn1	ZINC000819055177	CE	On-Demand	Mild	ASAH1	91	38
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819055202	GF	On-Demand	Anodyne	ADRB3	15	45
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819055202	GF	On-Demand	Anodyne	LIPG	56	41
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819055203	GF	On-Demand	Anodyne	ADRB3	15	45
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819055203	GF	On-Demand	Anodyne	LIPG	56	41
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819055204	GF	On-Demand	Anodyne	ADRB3	15	45
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819055204	GF	On-Demand	Anodyne	LIPG	56	41
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819055206	GF	On-Demand	Anodyne	ADRB3	15	45
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819055206	GF	On-Demand	Anodyne	LIPG	56	41
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819055223	ED	On-Demand	Anodyne	ADRB3	24	40
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819055224	ED	On-Demand	Anodyne	ADRB3	24	40
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819055225	ED	On-Demand	Anodyne	ADRB3	24	40
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819055226	ED	On-Demand	Anodyne	ADRB3	24	40
COCCNC(=O)c1ccccc1NC(=O)C1(c2ccc(C)cc2)CCC1	ZINC000819055251	FG	On-Demand	Anodyne	KCNA3	41	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000819055256	FD	On-Demand	Anodyne	EPHX2	16	41
COc1cccc(C(=O)NCCNC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819055265	DD	On-Demand	Anodyne	DRD4	57	43
COc1cccc(C(=O)NCCNC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819055265	DD	On-Demand	Anodyne	CTSL	20	40
COc1cccc(C(=O)NCCNC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819055265	DD	On-Demand	Anodyne	MTNR1B	32	43
COc1cccc(C(=O)NCCNC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819055265	DD	On-Demand	Anodyne	CTSS	17	40
COc1cccc(C(=O)NCCNC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819055266	DD	On-Demand	Anodyne	DRD4	57	43
COc1cccc(C(=O)NCCNC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819055266	DD	On-Demand	Anodyne	CTSL	20	40
COc1cccc(C(=O)NCCNC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819055266	DD	On-Demand	Anodyne	MTNR1B	32	43
COc1cccc(C(=O)NCCNC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819055266	DD	On-Demand	Anodyne	CTSS	17	40
COc1cccc(C(=O)NCCNC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819055267	DD	On-Demand	Anodyne	DRD4	57	43
COc1cccc(C(=O)NCCNC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819055267	DD	On-Demand	Anodyne	CTSL	20	40
COc1cccc(C(=O)NCCNC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819055267	DD	On-Demand	Anodyne	MTNR1B	32	43
COc1cccc(C(=O)NCCNC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819055267	DD	On-Demand	Anodyne	CTSS	17	40
COc1cccc(C(=O)NCCNC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819055268	DD	On-Demand	Anodyne	DRD4	57	43
COc1cccc(C(=O)NCCNC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819055268	DD	On-Demand	Anodyne	CTSL	20	40
COc1cccc(C(=O)NCCNC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819055268	DD	On-Demand	Anodyne	MTNR1B	32	43
COc1cccc(C(=O)NCCNC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819055268	DD	On-Demand	Anodyne	CTSS	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCNC(=O)c1cccc(OC)c1)C2	ZINC000819055269	GD	On-Demand	Anodyne	DRD4	56	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCNC(=O)c1cccc(OC)c1)C2	ZINC000819055269	GD	On-Demand	Anodyne	CCR2	44	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCNC(=O)c1cccc(OC)c1)C2	ZINC000819055270	GD	On-Demand	Anodyne	DRD4	56	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCNC(=O)c1cccc(OC)c1)C2	ZINC000819055270	GD	On-Demand	Anodyne	CCR2	44	39
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCCC2)cc1	ZINC000819055290	EG	On-Demand	Anodyne	HTR1D	19	45
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCCC2)cc1	ZINC000819055290	EG	On-Demand	Anodyne	HTR1B	17	45
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCCC2)cc1	ZINC000819055290	EG	On-Demand	Anodyne	KCNQ2	26	43
O=C(NCc1ccccc1Cn1ccnc1)C(F)=C1CCC1	ZINC000819055294	CF	On-Demand	Anodyne	CYP19A1	33	46
O=C(NCc1ccccc1Cn1ccnc1)C(F)=C1CCC1	ZINC000819055294	CF	On-Demand	Anodyne	CYP11B1	47	44
O=C(NCc1ccccc1Cn1ccnc1)C(F)=C1CCC1	ZINC000819055294	CF	On-Demand	Anodyne	TBXAS1	43	45
O=C(NCc1ccccc1Cn1ccnc1)C(F)=C1CCC1	ZINC000819055294	CF	On-Demand	Anodyne	CYP11B2	25	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ccc(Br)cc2F)c1	ZINC000819055310	GG	On-Demand	Bother	ADRB1	24	45
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ccc(Br)cc2F)c1	ZINC000819055310	GG	On-Demand	Bother	ADRB3	17	45
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ccc(Br)cc2F)c1	ZINC000819055310	GG	On-Demand	Bother	PDS	16	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ccc(Br)cc2F)c1	ZINC000819055311	GG	On-Demand	Bother	ADRB1	24	45
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ccc(Br)cc2F)c1	ZINC000819055311	GG	On-Demand	Bother	ADRB3	17	45
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ccc(Br)cc2F)c1	ZINC000819055311	GG	On-Demand	Bother	PDS	16	43
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1ccc(Br)cc1F	ZINC000819055320	GG	On-Demand	Bother	ADRB1	46	38
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1ccc(Br)cc1F	ZINC000819055321	GG	On-Demand	Bother	ADRB1	46	38
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000819055331	DF	On-Demand	Anodyne	EPHX2	15	43
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000819055331	DF	On-Demand	Anodyne	L3MBTL3	91	42
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000819055332	DF	On-Demand	Anodyne	EPHX2	15	43
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000819055332	DF	On-Demand	Anodyne	L3MBTL3	91	42
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000819055333	DF	On-Demand	Anodyne	EPHX2	15	43
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000819055333	DF	On-Demand	Anodyne	L3MBTL3	91	42
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000819055334	DF	On-Demand	Anodyne	EPHX2	15	43
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000819055334	DF	On-Demand	Anodyne	L3MBTL3	91	42
O=C(CCCNC[C@H](O)c1cccc2ccccc12)N1Cc2ccccc2C1	ZINC000819055353	FH	On-Demand	Anodyne	DPP8	18	40
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000819055356	CI	On-Demand	Anodyne	KCNQ2	32	44
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000819055356	CI	On-Demand	Anodyne	EPHX2	22	47
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000819055357	CI	On-Demand	Anodyne	KCNQ2	32	44
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000819055357	CI	On-Demand	Anodyne	EPHX2	22	47
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(c2ccccc2F)C1=O	ZINC000819055379	EF	On-Demand	Anodyne	CTSA	46	37
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(c2ccccc2F)C1=O	ZINC000819055382	EF	On-Demand	Anodyne	CTSA	46	37
O[C@@H](CNCCc1cccc(F)c1F)c1cccc(C(F)(F)F)c1	ZINC000819055387	EH	On-Demand	Anodyne	ADRB2	25	41
O[C@@H](CNCCc1cccc(F)c1F)c1cccc(C(F)(F)F)c1	ZINC000819055387	EH	On-Demand	Anodyne	ADRB1	25	41
O[C@@H](CNCCc1cccc(F)c1F)c1cccc(C(F)(F)F)c1	ZINC000819055387	EH	On-Demand	Anodyne	ADRB3	44	41
O[C@H](CNCCc1cccc(F)c1F)c1cccc(C(F)(F)F)c1	ZINC000819055388	EH	On-Demand	Anodyne	ADRB2	25	41
O[C@H](CNCCc1cccc(F)c1F)c1cccc(C(F)(F)F)c1	ZINC000819055388	EH	On-Demand	Anodyne	ADRB1	25	41
O[C@H](CNCCc1cccc(F)c1F)c1cccc(C(F)(F)F)c1	ZINC000819055388	EH	On-Demand	Anodyne	ADRB3	44	41
CN1CCC(N2CC[C@@H](NC[C@H](O)c3cccc4ccccc34)C2)CC1	ZINC000819055411	FF	On-Demand	Anodyne	SLC6A5	18	44
CN(CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)CC(F)(F)F	ZINC000819055418	FD	On-Demand	Anodyne	CTSF	43	35
CN(CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)CC(F)(F)F	ZINC000819055419	FD	On-Demand	Anodyne	CTSF	43	35
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819055426	EF	On-Demand	Anodyne	SIGMAR1	25	45
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819055426	EF	On-Demand	Anodyne	CCR3	24	47
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819055426	EF	On-Demand	Anodyne	MLNR	46	39
O=C(/C=C\[C@H]1CCCO1)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819055428	EF	On-Demand	Anodyne	SIGMAR1	25	45
O=C(/C=C\[C@H]1CCCO1)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819055428	EF	On-Demand	Anodyne	CCR3	24	47
O=C(/C=C\[C@H]1CCCO1)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819055428	EF	On-Demand	Anodyne	MLNR	46	39
O=C(/C=C/[C@H]1CCCO1)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819055431	EF	On-Demand	Anodyne	SIGMAR1	25	45
O=C(/C=C/[C@H]1CCCO1)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819055431	EF	On-Demand	Anodyne	CCR3	24	47
O=C(/C=C/[C@H]1CCCO1)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819055431	EF	On-Demand	Anodyne	MLNR	46	39
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000819055432	EG	On-Demand	Anodyne	L3MBTL3	30	40
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819055433	EF	On-Demand	Anodyne	SIGMAR1	25	45
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819055433	EF	On-Demand	Anodyne	CCR3	24	47
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819055433	EF	On-Demand	Anodyne	MLNR	46	39
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(c3ccccc3C(N)=O)C2)cc1	ZINC000819055449	FD	On-Demand	Mild	ADRB3	16	44
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(c3ccccc3C(N)=O)C2)cc1	ZINC000819055450	FD	On-Demand	Mild	ADRB3	16	44
CCCNC(=O)c1ccccc1NC(=O)c1cc2c(cn1)OCCO2	ZINC000819055451	EE	On-Demand	Anodyne	G2YM83_BOTF4	56	32
N#Cc1ccc([C@H](O)CN[C@H]2CCN(c3ccccc3C(N)=O)C2)cc1	ZINC000819055453	FD	On-Demand	Mild	ADRB3	16	44
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(c3ccccc3C(N)=O)C2)cc1	ZINC000819055456	FD	On-Demand	Mild	ADRB3	16	44
O=S(=O)(N1CCC(CNC[C@@H](O)Cc2ccccc2)CC1)C(F)(F)F	ZINC000819055458	GD	On-Demand	Anodyne	SLC6A3	17	45
O=S(=O)(N1CCC(CNC[C@@H](O)Cc2ccccc2)CC1)C(F)(F)F	ZINC000819055458	GD	On-Demand	Anodyne	ADRB3	20	44
O=S(=O)(N1CCC(CNC[C@@H](O)Cc2ccccc2)CC1)C(F)(F)F	ZINC000819055458	GD	On-Demand	Anodyne	SIGMAR1	16	41
O=S(=O)(N1CCC(CNC[C@@H](O)Cc2ccccc2)CC1)C(F)(F)F	ZINC000819055458	GD	On-Demand	Anodyne	PGA5	42	33
O=S(=O)(N1CCC(CNC[C@@H](O)Cc2ccccc2)CC1)C(F)(F)F	ZINC000819055458	GD	On-Demand	Anodyne	SFRP1	55	35
O=S(=O)(N1CCC(CNC[C@H](O)Cc2ccccc2)CC1)C(F)(F)F	ZINC000819055462	GD	On-Demand	Anodyne	SLC6A3	17	45
O=S(=O)(N1CCC(CNC[C@H](O)Cc2ccccc2)CC1)C(F)(F)F	ZINC000819055462	GD	On-Demand	Anodyne	ADRB3	20	44
O=S(=O)(N1CCC(CNC[C@H](O)Cc2ccccc2)CC1)C(F)(F)F	ZINC000819055462	GD	On-Demand	Anodyne	SIGMAR1	16	41
O=S(=O)(N1CCC(CNC[C@H](O)Cc2ccccc2)CC1)C(F)(F)F	ZINC000819055462	GD	On-Demand	Anodyne	PGA5	42	33
O=S(=O)(N1CCC(CNC[C@H](O)Cc2ccccc2)CC1)C(F)(F)F	ZINC000819055462	GD	On-Demand	Anodyne	SFRP1	55	35
O[C@@H](CNCCc1cccc(F)c1F)c1ccccc1	ZINC000819055475	CF	On-Demand	Anodyne	ADRB2	45	51
O[C@@H](CNCCc1cccc(F)c1F)c1ccccc1	ZINC000819055475	CF	On-Demand	Anodyne	ADRB1	53	42
O[C@@H](CNCCc1cccc(F)c1F)c1ccccc1	ZINC000819055475	CF	On-Demand	Anodyne	ADRB3	82	44
O[C@H](CNCCc1cccc(F)c1F)c1ccccc1	ZINC000819055478	CF	On-Demand	Anodyne	ADRB2	45	51
O[C@H](CNCCc1cccc(F)c1F)c1ccccc1	ZINC000819055478	CF	On-Demand	Anodyne	ADRB1	53	42
O[C@H](CNCCc1cccc(F)c1F)c1ccccc1	ZINC000819055478	CF	On-Demand	Anodyne	ADRB3	82	44
CC(=O)c1cccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)c1	ZINC000819055492	ED	On-Demand	Anodyne	ADRB2	48	48
CC(=O)c1cccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)c1	ZINC000819055492	ED	On-Demand	Anodyne	ADRB1	72	42
CC(=O)c1cccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)c1	ZINC000819055492	ED	On-Demand	Anodyne	ADRB3	41	42
CC(=O)c1cccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)c1	ZINC000819055492	ED	On-Demand	Anodyne	ABCB1	22	49
CC(=O)c1cccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)c1	ZINC000819055495	ED	On-Demand	Anodyne	ADRB2	48	48
CC(=O)c1cccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)c1	ZINC000819055495	ED	On-Demand	Anodyne	ADRB1	72	42
CC(=O)c1cccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)c1	ZINC000819055495	ED	On-Demand	Anodyne	ADRB3	41	42
CC(=O)c1cccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)c1	ZINC000819055495	ED	On-Demand	Anodyne	ABCB1	22	49
CC(=O)c1cccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)c1	ZINC000819055496	ED	On-Demand	Anodyne	ADRB2	48	48
CC(=O)c1cccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)c1	ZINC000819055496	ED	On-Demand	Anodyne	ADRB1	72	42
CC(=O)c1cccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)c1	ZINC000819055496	ED	On-Demand	Anodyne	ADRB3	41	42
CC(=O)c1cccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)c1	ZINC000819055496	ED	On-Demand	Anodyne	ABCB1	22	49
CC(=O)c1cccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)c1	ZINC000819055498	ED	On-Demand	Anodyne	ADRB2	48	48
CC(=O)c1cccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)c1	ZINC000819055498	ED	On-Demand	Anodyne	ADRB1	72	42
CC(=O)c1cccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)c1	ZINC000819055498	ED	On-Demand	Anodyne	ADRB3	41	42
CC(=O)c1cccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)c1	ZINC000819055498	ED	On-Demand	Anodyne	ABCB1	22	49
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCc2ccc(F)cc2F)CC1	ZINC000819055507	GG	On-Demand	Anodyne	GPR119	25	42
O=C(NCCN1C(=O)S/C(=C/c2ccccc2F)C1=O)C(F)=C1CCC1	ZINC000819055511	GG	On-Demand	Anodyne	AKR1B1	41	38
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCc2ccc(F)cc2F)CC1	ZINC000819055512	GG	On-Demand	Anodyne	GPR119	25	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(N2CCOCC2)cn1	ZINC000819055513	FD	On-Demand	Anodyne	STAT6	52	33
COC(=O)C1=C(C)NC(=S)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819055517	DE	On-Demand	Anodyne	CACNA1C	56	38
COC(=O)C1=C(C)NC(=S)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819055517	DE	On-Demand	Anodyne	CACNA1D	72	38
COC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819055518	DE	On-Demand	Anodyne	CACNA1C	56	38
COC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819055518	DE	On-Demand	Anodyne	CACNA1D	72	38
O=C(NCCN1C(=O)S/C(=C\c2ccccc2F)C1=O)C(F)=C1CCC1	ZINC000819055519	GG	On-Demand	Anodyne	AKR1B1	41	38
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819055544	FE	On-Demand	Anodyne	ADRB1	34	44
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819055544	FE	On-Demand	Anodyne	ADRB3	56	46
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819055544	FE	On-Demand	Anodyne	CYP3A4	49	39
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819055547	FE	On-Demand	Anodyne	ADRB1	34	44
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819055547	FE	On-Demand	Anodyne	ADRB3	56	46
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819055547	FE	On-Demand	Anodyne	CYP3A4	49	39
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819055549	FE	On-Demand	Anodyne	ADRB1	34	44
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819055549	FE	On-Demand	Anodyne	ADRB3	56	46
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819055549	FE	On-Demand	Anodyne	CYP3A4	49	39
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CCN(c2ccccc2F)C1=O	ZINC000819055550	GD	On-Demand	Anodyne	GPR119	15	40
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819055553	FE	On-Demand	Anodyne	ADRB1	34	44
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819055553	FE	On-Demand	Anodyne	ADRB3	56	46
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819055553	FE	On-Demand	Anodyne	CYP3A4	49	39
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CCN(c2ccccc2F)C1=O	ZINC000819055554	GD	On-Demand	Anodyne	GPR119	15	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1CCN(c2ccccc2F)C1=O	ZINC000819055556	GD	On-Demand	Anodyne	GPR119	15	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H]1CCN(c2ccccc2F)C1=O	ZINC000819055560	GD	On-Demand	Anodyne	GPR119	15	40
COCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819055561	FD	On-Demand	Anodyne	CACNA1C	92	41
COCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819055561	FD	On-Demand	Anodyne	CACNA1D	90	41
COCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819055561	FD	On-Demand	Anodyne	SLC27A4	95	43
COCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819055564	FD	On-Demand	Anodyne	CACNA1C	92	41
COCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819055564	FD	On-Demand	Anodyne	CACNA1D	90	41
COCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc2c(c1)OC(F)(F)O2	ZINC000819055564	FD	On-Demand	Anodyne	SLC27A4	95	43
CCCNC(=O)c1ccccc1NC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819055582	FF	On-Demand	Anodyne	KCNK3	73	36
CCCNC(=O)c1ccccc1NC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819055582	FF	On-Demand	Anodyne	KCNK9	63	36
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055583	GF	On-Demand	Anodyne	RBP4	41	32
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055583	GF	On-Demand	Anodyne	SCD1	33	41
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055583	GF	On-Demand	Anodyne	LIPG	46	33
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055583	GF	On-Demand	Anodyne	SFRP1	83	39
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055583	GF	On-Demand	Anodyne	SCD	33	41
NC(=O)c1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055583	GF	On-Demand	Anodyne	WNT3	43	36
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055586	GF	On-Demand	Anodyne	RBP4	41	32
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055586	GF	On-Demand	Anodyne	SCD1	33	41
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055586	GF	On-Demand	Anodyne	LIPG	46	33
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055586	GF	On-Demand	Anodyne	SFRP1	83	39
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055586	GF	On-Demand	Anodyne	SCD	33	41
NC(=O)c1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055586	GF	On-Demand	Anodyne	WNT3	43	36
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055589	GF	On-Demand	Anodyne	RBP4	41	32
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055589	GF	On-Demand	Anodyne	SCD1	33	41
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055589	GF	On-Demand	Anodyne	LIPG	46	33
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055589	GF	On-Demand	Anodyne	SFRP1	83	39
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055589	GF	On-Demand	Anodyne	SCD	33	41
NC(=O)c1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055589	GF	On-Demand	Anodyne	WNT3	43	36
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055593	GF	On-Demand	Anodyne	RBP4	41	32
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055593	GF	On-Demand	Anodyne	SCD1	33	41
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055593	GF	On-Demand	Anodyne	LIPG	46	33
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055593	GF	On-Demand	Anodyne	SFRP1	83	39
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055593	GF	On-Demand	Anodyne	SCD	33	41
NC(=O)c1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819055593	GF	On-Demand	Anodyne	WNT3	43	36
O[C@@H](CNCCc1ccc(F)cc1F)c1ccccc1	ZINC000819055604	CF	On-Demand	Anodyne	ADRB2	49	50
O[C@@H](CNCCc1ccc(F)cc1F)c1ccccc1	ZINC000819055604	CF	On-Demand	Anodyne	ADRB1	53	44
O[C@@H](CNCCc1ccc(F)cc1F)c1ccccc1	ZINC000819055604	CF	On-Demand	Anodyne	ADRB3	99	45
O[C@H](CNCCc1ccc(F)cc1F)c1ccccc1	ZINC000819055607	CF	On-Demand	Anodyne	ADRB2	49	50
O[C@H](CNCCc1ccc(F)cc1F)c1ccccc1	ZINC000819055607	CF	On-Demand	Anodyne	ADRB1	53	44
O[C@H](CNCCc1ccc(F)cc1F)c1ccccc1	ZINC000819055607	CF	On-Demand	Anodyne	ADRB3	99	45
O[C@@H](CNCCc1ccc(F)cc1F)c1ccc(Cl)c(F)c1	ZINC000819055609	EH	On-Demand	Anodyne	ADRB2	29	44
O[C@@H](CNCCc1ccc(F)cc1F)c1ccc(Cl)c(F)c1	ZINC000819055609	EH	On-Demand	Anodyne	ADRB3	38	40
O[C@H](CNCCc1ccc(F)cc1F)c1ccc(Cl)c(F)c1	ZINC000819055612	EH	On-Demand	Anodyne	ADRB2	29	44
O[C@H](CNCCc1ccc(F)cc1F)c1ccc(Cl)c(F)c1	ZINC000819055612	EH	On-Demand	Anodyne	ADRB3	38	40
O=S(=O)(N1CCC(CNC[C@H](O)c2ccc(F)cc2)CC1)C(F)(F)F	ZINC000819055636	GE	On-Demand	Anodyne	SLC6A3	39	44
O=S(=O)(N1CCC(CNC[C@H](O)c2ccc(F)cc2)CC1)C(F)(F)F	ZINC000819055636	GE	On-Demand	Anodyne	ADRB3	18	43
O=S(=O)(N1CCC(CNC[C@@H](O)c2ccc(F)cc2)CC1)C(F)(F)F	ZINC000819055639	GE	On-Demand	Anodyne	SLC6A3	39	44
O=S(=O)(N1CCC(CNC[C@@H](O)c2ccc(F)cc2)CC1)C(F)(F)F	ZINC000819055639	GE	On-Demand	Anodyne	ADRB3	18	43
O=C(/C=C\[C@H]1CCCO1)NC1CCN(C(=O)c2ccoc2)CC1	ZINC000819055659	DD	On-Demand	Anodyne	L3MBTL3	44	34
N#Cc1ccc([C@@H](O)CNCC2(N3CCSCC3)CCCCC2)cc1	ZINC000819055662	FF	On-Demand	Mild	HCN1	40	31
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(C(=O)c2ccoc2)CC1	ZINC000819055663	DD	On-Demand	Anodyne	L3MBTL3	44	34
N#Cc1ccc([C@H](O)CNCC2(N3CCSCC3)CCCCC2)cc1	ZINC000819055666	FF	On-Demand	Mild	HCN1	40	31
O[C@@H](CNCCc1cccc(F)c1F)c1ccccc1C(F)(F)F	ZINC000819055668	EH	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CNCCc1cccc(F)c1F)c1ccccc1C(F)(F)F	ZINC000819055668	EH	On-Demand	Anodyne	ADRB1	15	40
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)NC[C@H]1CCCCO1	ZINC000819055675	GD	On-Demand	Anodyne	ADRB1	44	43
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)NC[C@H]1CCCCO1	ZINC000819055675	GD	On-Demand	Anodyne	ADRB3	61	43
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)NC[C@@H]1CCCCO1	ZINC000819055676	GD	On-Demand	Anodyne	ADRB1	44	43
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)NC[C@@H]1CCCCO1	ZINC000819055676	GD	On-Demand	Anodyne	ADRB3	61	43
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)NC[C@H]1CCCCO1	ZINC000819055677	GD	On-Demand	Anodyne	ADRB1	44	43
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)NC[C@H]1CCCCO1	ZINC000819055677	GD	On-Demand	Anodyne	ADRB3	61	43
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)NC[C@@H]1CCCCO1	ZINC000819055678	GD	On-Demand	Anodyne	ADRB1	44	43
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)NC[C@@H]1CCCCO1	ZINC000819055678	GD	On-Demand	Anodyne	ADRB3	61	43
O[C@@H](CN[C@@H](Cc1ccccc1)CN1CCOCC1)c1cccnc1	ZINC000819055679	ED	On-Demand	Anodyne	ADRB1	21	48
O[C@@H](CN[C@@H](Cc1ccccc1)CN1CCOCC1)c1cccnc1	ZINC000819055679	ED	On-Demand	Anodyne	ADRB3	63	48
O[C@@H](CN[C@@H](Cc1ccccc1)CN1CCOCC1)c1cccnc1	ZINC000819055679	ED	On-Demand	Anodyne	CASR	32	43
O[C@@H](CN[C@H](Cc1ccccc1)CN1CCOCC1)c1cccnc1	ZINC000819055680	ED	On-Demand	Anodyne	ADRB1	21	48
O[C@@H](CN[C@H](Cc1ccccc1)CN1CCOCC1)c1cccnc1	ZINC000819055680	ED	On-Demand	Anodyne	ADRB3	63	48
O[C@@H](CN[C@H](Cc1ccccc1)CN1CCOCC1)c1cccnc1	ZINC000819055680	ED	On-Demand	Anodyne	CASR	32	43
O[C@H](CN[C@@H](Cc1ccccc1)CN1CCOCC1)c1cccnc1	ZINC000819055681	ED	On-Demand	Anodyne	ADRB1	21	48
O[C@H](CN[C@@H](Cc1ccccc1)CN1CCOCC1)c1cccnc1	ZINC000819055681	ED	On-Demand	Anodyne	ADRB3	63	48
O[C@H](CN[C@@H](Cc1ccccc1)CN1CCOCC1)c1cccnc1	ZINC000819055681	ED	On-Demand	Anodyne	CASR	32	43
O[C@H](CN[C@H](Cc1ccccc1)CN1CCOCC1)c1cccnc1	ZINC000819055682	ED	On-Demand	Anodyne	ADRB1	21	48
O[C@H](CN[C@H](Cc1ccccc1)CN1CCOCC1)c1cccnc1	ZINC000819055682	ED	On-Demand	Anodyne	ADRB3	63	48
O[C@H](CN[C@H](Cc1ccccc1)CN1CCOCC1)c1cccnc1	ZINC000819055682	ED	On-Demand	Anodyne	CASR	32	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000819055695	FF	On-Demand	Anodyne	EPHX2	22	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CCCC2)cc1	ZINC000819055695	FF	On-Demand	Anodyne	L3MBTL3	64	36
CNC(=O)Nc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819055708	GF	On-Demand	Mild	PAPA1_CARPA	45	47
CNC(=O)Nc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819055708	GF	On-Demand	Mild	CTSL	15	48
CNC(=O)Nc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819055708	GF	On-Demand	Mild	FPR1	44	38
CNC(=O)Nc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819055709	GF	On-Demand	Mild	PAPA1_CARPA	45	47
CNC(=O)Nc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819055709	GF	On-Demand	Mild	CTSL	15	48
CNC(=O)Nc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819055709	GF	On-Demand	Mild	FPR1	44	38
O[C@H](CNCCc1cccc(F)c1F)c1ccccc1C(F)(F)F	ZINC000819055710	EH	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CNCCc1cccc(F)c1F)c1ccccc1C(F)(F)F	ZINC000819055710	EH	On-Demand	Anodyne	ADRB1	15	40
CC(=O)Nc1cccc(CC(=O)N2CCCc3cc(C)ccc32)c1	ZINC000819055728	DG	On-Demand	Anodyne	AVPR2	32	42
CC(=O)Nc1cccc(CC(=O)N2CCCc3cc(C)ccc32)c1	ZINC000819055728	DG	On-Demand	Anodyne	EIF2AK3	58	43
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)CCN1c1ccccc1F	ZINC000819055731	FG	On-Demand	Anodyne	P2RX7	36	48
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)CCN1c1ccccc1F	ZINC000819055733	FG	On-Demand	Anodyne	P2RX7	36	48
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)CCN1c1ccccc1F	ZINC000819055735	FG	On-Demand	Anodyne	P2RX7	36	48
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2Cl)CCN1c1ccccc1F	ZINC000819055737	FG	On-Demand	Anodyne	P2RX7	36	48
CCOc1ccc(OC[C@@H](O)CNCc2cc(CC)[nH]n2)cc1	ZINC000819055755	DD	On-Demand	Anodyne	ADRB2	39	46
CCOc1ccc(OC[C@@H](O)CNCc2cc(CC)[nH]n2)cc1	ZINC000819055755	DD	On-Demand	Anodyne	ADRB1	52	46
CCOc1ccc(OC[C@@H](O)CNCc2cc(CC)[nH]n2)cc1	ZINC000819055755	DD	On-Demand	Anodyne	ADRB3	32	40
CCOc1ccc(OC[C@H](O)CNCc2cc(CC)[nH]n2)cc1	ZINC000819055757	DD	On-Demand	Anodyne	ADRB2	39	46
CCOc1ccc(OC[C@H](O)CNCc2cc(CC)[nH]n2)cc1	ZINC000819055757	DD	On-Demand	Anodyne	ADRB1	52	46
CCOc1ccc(OC[C@H](O)CNCc2cc(CC)[nH]n2)cc1	ZINC000819055757	DD	On-Demand	Anodyne	ADRB3	32	40
O[C@@H](CNCCc1cccc(F)c1F)c1ccccc1Br	ZINC000819055758	FH	On-Demand	Anodyne	ADRB2	20	42
O[C@H](CNCCc1cccc(F)c1F)c1ccccc1Br	ZINC000819055760	FH	On-Demand	Anodyne	ADRB2	20	42
CN1CCC(N2CC[C@@H](NC[C@H](O)c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000819055780	FE	On-Demand	Anodyne	CCR2	67	41
CN1CCC(N2CC[C@@H](NC[C@H](O)c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000819055780	FE	On-Demand	Anodyne	SLC6A5	19	45
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000819055785	FE	On-Demand	Anodyne	CCR2	67	41
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3cccc(C(F)(F)F)c3)C2)CC1	ZINC000819055785	FE	On-Demand	Anodyne	SLC6A5	19	45
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCCC(=O)N1Cc2ccccc2C1	ZINC000819055794	GE	On-Demand	Anodyne	PREP	15	56
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCCC(=O)N1Cc2ccccc2C1	ZINC000819055796	GE	On-Demand	Anodyne	PREP	15	56
O=C1C=CC=N/C1=C(\O)NCCNC[C@H](O)COCc1ccccc1F	ZINC000819055803	FC	On-Demand	Mild	ADRB1	45	40
O=C1C=CC=N/C1=C(/O)NCCNC[C@@H](O)COCc1ccccc1F	ZINC000819055804	FC	On-Demand	Mild	ADRB1	45	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(S(C)(=O)=O)CC1	ZINC000819055805	FC	On-Demand	Anodyne	EPHX2	18	43
O=C1C=CC=N/C1=C(\O)NCCNC[C@@H](O)COCc1ccccc1F	ZINC000819055806	FC	On-Demand	Mild	ADRB1	45	40
O=C1C=CC=N/C1=C(/O)NCCNC[C@H](O)COCc1ccccc1F	ZINC000819055808	FC	On-Demand	Mild	ADRB1	45	40
O=C(CCc1cccc(OC(F)F)c1)Nc1ccc(N2CCCC2)cc1	ZINC000819055816	FI	On-Demand	Anodyne	KCNQ2	28	41
O=C(CCc1cccc(OC(F)F)c1)Nc1ccc(N2CCCC2)cc1	ZINC000819055816	FI	On-Demand	Anodyne	PLA2G4A	26	41
O=C(CCc1cccc(OC(F)F)c1)Nc1ccc(N2CCCC2)cc1	ZINC000819055816	FI	On-Demand	Anodyne	TAAR1	18	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(Br)cc2F)c1	ZINC000819055821	GG	On-Demand	Anodyne	ADRB2	26	42
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(Br)cc2F)c1	ZINC000819055821	GG	On-Demand	Anodyne	ADRB1	46	38
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(Br)cc2F)c1	ZINC000819055821	GG	On-Demand	Anodyne	ABCB1	15	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(Br)cc2F)c1	ZINC000819055821	GG	On-Demand	Anodyne	PDS	60	37
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(Br)cc2F)c1	ZINC000819055823	GG	On-Demand	Anodyne	ADRB2	26	42
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(Br)cc2F)c1	ZINC000819055823	GG	On-Demand	Anodyne	ADRB1	46	38
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(Br)cc2F)c1	ZINC000819055823	GG	On-Demand	Anodyne	ABCB1	15	43
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(Br)cc2F)c1	ZINC000819055823	GG	On-Demand	Anodyne	PDS	60	37
CN1CCC(N2CC[C@@H](NC[C@H](O)c3ccc(F)cc3)C2)CC1	ZINC000819055850	DD	On-Demand	Anodyne	SLC6A3	27	43
CN1CCC(N2CC[C@@H](NC[C@@H](O)c3ccc(F)cc3)C2)CC1	ZINC000819055852	DD	On-Demand	Anodyne	SLC6A3	27	43
C=C(C)C(C)(C)C(=O)NCCN1C(=O)S/C(=C/c2ccccc2)C1=O	ZINC000819055860	FG	On-Demand	Mild	AKR1B1	54	49
C=C(C)C(C)(C)C(=O)NCCN1C(=O)S/C(=C/c2ccccc2)C1=O	ZINC000819055860	FG	On-Demand	Mild	ENPP2	36	41
C=C(C)C(C)(C)C(=O)NCCN1C(=O)S/C(=C/c2ccccc2)C1=O	ZINC000819055860	FG	On-Demand	Mild	CYSK1	59	36
C=C(C)C(C)(C)C(=O)NCCN1C(=O)S/C(=C\c2ccccc2)C1=O	ZINC000819055861	FG	On-Demand	Mild	AKR1B1	54	49
C=C(C)C(C)(C)C(=O)NCCN1C(=O)S/C(=C\c2ccccc2)C1=O	ZINC000819055861	FG	On-Demand	Mild	ENPP2	36	41
C=C(C)C(C)(C)C(=O)NCCN1C(=O)S/C(=C\c2ccccc2)C1=O	ZINC000819055861	FG	On-Demand	Mild	CYSK1	59	36
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(C(=O)c2ccoc2)CC1	ZINC000819055865	DD	On-Demand	Anodyne	L3MBTL3	44	34
O=C(/C=C/[C@H]1CCCO1)NC1CCN(C(=O)c2ccoc2)CC1	ZINC000819055867	DD	On-Demand	Anodyne	L3MBTL3	44	34
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000819055892	EE	On-Demand	Anodyne	L3MBTL3	56	42
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000819055894	EE	On-Demand	Anodyne	L3MBTL3	56	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000819055896	EE	On-Demand	Anodyne	L3MBTL3	56	42
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000819055899	EE	On-Demand	Anodyne	L3MBTL3	56	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(F)cc2F)cc1	ZINC000819055921	FE	On-Demand	Anodyne	ADRB2	54	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(F)cc2F)cc1	ZINC000819055921	FE	On-Demand	Anodyne	ADRB1	45	38
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(F)cc2F)cc1	ZINC000819055921	FE	On-Demand	Anodyne	PTGS2	28	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(F)cc2F)cc1	ZINC000819055921	FE	On-Demand	Anodyne	ADRB3	112	45
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(F)cc2F)cc1	ZINC000819055921	FE	On-Demand	Anodyne	TRPV1	71	34
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(F)cc2F)cc1	ZINC000819055922	FE	On-Demand	Anodyne	ADRB2	54	44
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(F)cc2F)cc1	ZINC000819055922	FE	On-Demand	Anodyne	ADRB1	45	38
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(F)cc2F)cc1	ZINC000819055922	FE	On-Demand	Anodyne	PTGS2	28	44
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(F)cc2F)cc1	ZINC000819055922	FE	On-Demand	Anodyne	ADRB3	112	45
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(F)cc2F)cc1	ZINC000819055922	FE	On-Demand	Anodyne	TRPV1	71	34
O[C@@H](CNCCc1ccc(F)cc1F)c1ccc(Br)cc1	ZINC000819055923	FH	On-Demand	Anodyne	ADRB2	26	50
O[C@H](CNCCc1ccc(F)cc1F)c1ccc(Br)cc1	ZINC000819055924	FH	On-Demand	Anodyne	ADRB2	26	50
O=C(CCNCC1CCN(S(=O)(=O)C(F)(F)F)CC1)Nc1ccccc1	ZINC000819055931	GE	On-Demand	Anodyne	CCR3	25	42
O=C(CCNCC1CCN(S(=O)(=O)C(F)(F)F)CC1)Nc1ccccc1	ZINC000819055931	GE	On-Demand	Anodyne	EPHX2	25	42
O=C(CCNCC1CCN(S(=O)(=O)C(F)(F)F)CC1)Nc1ccccc1	ZINC000819055931	GE	On-Demand	Anodyne	TGM2	45	39
O=C(CCNCC1CCN(S(=O)(=O)C(F)(F)F)CC1)Nc1ccccc1	ZINC000819055931	GE	On-Demand	Anodyne	F13A1	65	39
O=C(CCNCC1CCN(S(=O)(=O)C(F)(F)F)CC1)Nc1ccccc1	ZINC000819055931	GE	On-Demand	Anodyne	SFRP1	47	35
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2C(=O)NCC(C)C)c1	ZINC000819055938	FG	On-Demand	Anodyne	F3	79	39
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2C(=O)NCC(C)C)c1	ZINC000819055938	FG	On-Demand	Anodyne	KCNK3	71	36
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2C(=O)NCC(C)C)c1	ZINC000819055938	FG	On-Demand	Anodyne	KCNK9	59	36
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc2ccccc2c1	ZINC000819055945	GI	On-Demand	Mild	PAPA1_CARPA	55	54
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc2ccccc2c1	ZINC000819055945	GI	On-Demand	Mild	CTSK	21	42
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc2ccccc2c1	ZINC000819055945	GI	On-Demand	Mild	CTSL	17	54
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc2ccccc2c1	ZINC000819055945	GI	On-Demand	Mild	FPR1	45	38
C=C(C)C(C)(C)C(=O)NCCCCCC	ZINC000819055958	BG	On-Demand	Mild	ASAH1	79	35
O=C(Nc1ccc(C(=O)NC2CC2)cc1)C(F)=C1CCC1	ZINC000819055965	CF	On-Demand	Anodyne	MAPK14	18	41
CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819055973	DE	On-Demand	Anodyne	CACNA1C	88	51
CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819055973	DE	On-Demand	Anodyne	CACNA1D	76	51
CCOC(=O)C1=C(C)NC(=O)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819055973	DE	On-Demand	Anodyne	SLC27A4	92	43
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819055978	DE	On-Demand	Anodyne	CACNA1C	88	51
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819055978	DE	On-Demand	Anodyne	CACNA1D	76	51
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819055978	DE	On-Demand	Anodyne	SLC27A4	92	43
CN(CCNC[C@@H](O)c1cccc(F)c1)CC(F)(F)F	ZINC000819055993	CD	On-Demand	Anodyne	ADRB1	18	41
CN(CCNC[C@@H](O)c1cccc(F)c1)CC(F)(F)F	ZINC000819055993	CD	On-Demand	Anodyne	ADRB3	26	41
CN(CCNC[C@H](O)c1cccc(F)c1)CC(F)(F)F	ZINC000819055995	CD	On-Demand	Anodyne	ADRB1	18	41
CN(CCNC[C@H](O)c1cccc(F)c1)CC(F)(F)F	ZINC000819055995	CD	On-Demand	Anodyne	ADRB3	26	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2ccc(F)cc2F)CC1	ZINC000819055997	GG	On-Demand	Anodyne	GPR119	49	58
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2ccc(F)cc2F)CC1	ZINC000819055999	GG	On-Demand	Anodyne	GPR119	49	58
COc1cccc(C(=O)NCCNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819056001	GD	On-Demand	Anodyne	DRD4	58	45
COc1cccc(C(=O)NCCNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819056001	GD	On-Demand	Anodyne	CTSL	21	41
COc1cccc(C(=O)NCCNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819056001	GD	On-Demand	Anodyne	CTSS	18	41
O=S(=O)(N1CCC(CNC[C@H](O)COc2ccccc2)CC1)C(F)(F)F	ZINC000819056002	GD	On-Demand	Anodyne	ADRB2	61	47
O=S(=O)(N1CCC(CNC[C@H](O)COc2ccccc2)CC1)C(F)(F)F	ZINC000819056002	GD	On-Demand	Anodyne	ADRB1	91	58
O=S(=O)(N1CCC(CNC[C@H](O)COc2ccccc2)CC1)C(F)(F)F	ZINC000819056002	GD	On-Demand	Anodyne	ADRB3	71	58
O=S(=O)(N1CCC(CNC[C@@H](O)COc2ccccc2)CC1)C(F)(F)F	ZINC000819056004	GD	On-Demand	Anodyne	ADRB2	61	47
O=S(=O)(N1CCC(CNC[C@@H](O)COc2ccccc2)CC1)C(F)(F)F	ZINC000819056004	GD	On-Demand	Anodyne	ADRB1	91	58
O=S(=O)(N1CCC(CNC[C@@H](O)COc2ccccc2)CC1)C(F)(F)F	ZINC000819056004	GD	On-Demand	Anodyne	ADRB3	71	58
O=C(NCCNC(=O)c1ccccc1)C(F)=C1CCC1	ZINC000819056009	CD	On-Demand	Anodyne	BCHE	20	40
O=[N+]([O-])c1cccc([C@H](O)CNCC2(N3CCSCC3)CCCCC2)c1	ZINC000819056013	GF	On-Demand	Bother	HCN1	51	32
O=[N+]([O-])c1cccc([C@H](O)CNCC2(N3CCSCC3)CCCCC2)c1	ZINC000819056013	GF	On-Demand	Bother	HCN4	48	32
O=[N+]([O-])c1cccc([C@@H](O)CNCC2(N3CCSCC3)CCCCC2)c1	ZINC000819056015	GF	On-Demand	Bother	HCN1	51	32
O=[N+]([O-])c1cccc([C@@H](O)CNCC2(N3CCSCC3)CCCCC2)c1	ZINC000819056015	GF	On-Demand	Bother	HCN4	48	32
O[C@@H](CNCCc1ccc(F)cc1F)c1ccc(F)cc1F	ZINC000819056030	DG	On-Demand	Anodyne	ADRB2	37	40
O[C@@H](CNCCc1ccc(F)cc1F)c1ccc(F)cc1F	ZINC000819056030	DG	On-Demand	Anodyne	ADRB1	28	40
O[C@H](CNCCc1ccc(F)cc1F)c1ccc(F)cc1F	ZINC000819056032	DG	On-Demand	Anodyne	ADRB2	37	40
O[C@H](CNCCc1ccc(F)cc1F)c1ccc(F)cc1F	ZINC000819056032	DG	On-Demand	Anodyne	ADRB1	28	40
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2ccccc2)CC1	ZINC000819056037	CG	On-Demand	Anodyne	SLC18A3	61	44
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2ccccc2)CC1	ZINC000819056037	CG	On-Demand	Anodyne	LIPE	15	45
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2ccccc2)CC1	ZINC000819056037	CG	On-Demand	Anodyne	ADAM10	20	43
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2ccccc2)CC1	ZINC000819056038	CG	On-Demand	Anodyne	SLC18A3	61	44
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2ccccc2)CC1	ZINC000819056038	CG	On-Demand	Anodyne	LIPE	15	45
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2ccccc2)CC1	ZINC000819056038	CG	On-Demand	Anodyne	ADAM10	20	43
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2ccccc2)CC1	ZINC000819056039	CG	On-Demand	Anodyne	SLC18A3	61	44
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2ccccc2)CC1	ZINC000819056039	CG	On-Demand	Anodyne	LIPE	15	45
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2ccccc2)CC1	ZINC000819056039	CG	On-Demand	Anodyne	ADAM10	20	43
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2ccccc2)CC1	ZINC000819056040	CG	On-Demand	Anodyne	SLC18A3	61	44
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2ccccc2)CC1	ZINC000819056040	CG	On-Demand	Anodyne	LIPE	15	45
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2ccccc2)CC1	ZINC000819056040	CG	On-Demand	Anodyne	ADAM10	20	43
CN(CCNC[C@@H](O)c1ccccc1)CC(F)(F)F	ZINC000819056045	CD	On-Demand	Anodyne	ADRB2	15	44
CN(CCNC[C@@H](O)c1ccccc1)CC(F)(F)F	ZINC000819056045	CD	On-Demand	Anodyne	ADRB3	40	42
CN(CCNC[C@@H](O)c1ccccc1)CC(F)(F)F	ZINC000819056045	CD	On-Demand	Anodyne	AOC3	20	41
CN(CCNC[C@H](O)c1ccccc1)CC(F)(F)F	ZINC000819056046	CD	On-Demand	Anodyne	ADRB2	15	44
CN(CCNC[C@H](O)c1ccccc1)CC(F)(F)F	ZINC000819056046	CD	On-Demand	Anodyne	ADRB3	40	42
CN(CCNC[C@H](O)c1ccccc1)CC(F)(F)F	ZINC000819056046	CD	On-Demand	Anodyne	AOC3	20	41
CCOc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056068	FH	On-Demand	Mild	PAPA1_CARPA	51	48
CCOc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056068	FH	On-Demand	Mild	CCKAR	42	40
CCOc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056068	FH	On-Demand	Mild	CTSK	23	42
CCOc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056068	FH	On-Demand	Mild	FPR1	45	40
CCOc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056068	FH	On-Demand	Mild	CTRB_BOVIN	47	38
CCOc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056069	FH	On-Demand	Mild	PAPA1_CARPA	51	48
CCOc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056069	FH	On-Demand	Mild	CCKAR	42	40
CCOc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056069	FH	On-Demand	Mild	CTSK	23	42
CCOc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056069	FH	On-Demand	Mild	FPR1	45	40
CCOc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056069	FH	On-Demand	Mild	CTRB_BOVIN	47	38
O=S(=O)(CCNC[C@H](O)c1cccnc1)NC[C@H]1CCCCO1	ZINC000819056070	EC	On-Demand	Anodyne	ADRB2	26	45
O=S(=O)(CCNC[C@H](O)c1cccnc1)NC[C@H]1CCCCO1	ZINC000819056070	EC	On-Demand	Anodyne	ADRB1	29	43
O=S(=O)(CCNC[C@H](O)c1cccnc1)NC[C@H]1CCCCO1	ZINC000819056070	EC	On-Demand	Anodyne	ADRB3	104	48
O=S(=O)(CCNC[C@H](O)c1cccnc1)NC[C@@H]1CCCCO1	ZINC000819056071	EC	On-Demand	Anodyne	ADRB2	26	45
O=S(=O)(CCNC[C@H](O)c1cccnc1)NC[C@@H]1CCCCO1	ZINC000819056071	EC	On-Demand	Anodyne	ADRB1	29	43
O=S(=O)(CCNC[C@H](O)c1cccnc1)NC[C@@H]1CCCCO1	ZINC000819056071	EC	On-Demand	Anodyne	ADRB3	104	48
O=S(=O)(CCNC[C@@H](O)c1cccnc1)NC[C@H]1CCCCO1	ZINC000819056072	EC	On-Demand	Anodyne	ADRB2	26	45
O=S(=O)(CCNC[C@@H](O)c1cccnc1)NC[C@H]1CCCCO1	ZINC000819056072	EC	On-Demand	Anodyne	ADRB1	29	43
O=S(=O)(CCNC[C@@H](O)c1cccnc1)NC[C@H]1CCCCO1	ZINC000819056072	EC	On-Demand	Anodyne	ADRB3	104	48
O=S(=O)(CCNC[C@@H](O)c1cccnc1)NC[C@@H]1CCCCO1	ZINC000819056073	EC	On-Demand	Anodyne	ADRB2	26	45
O=S(=O)(CCNC[C@@H](O)c1cccnc1)NC[C@@H]1CCCCO1	ZINC000819056073	EC	On-Demand	Anodyne	ADRB1	29	43
O=S(=O)(CCNC[C@@H](O)c1cccnc1)NC[C@@H]1CCCCO1	ZINC000819056073	EC	On-Demand	Anodyne	ADRB3	104	48
O[C@H](CNCc1ccc(Br)cc1F)COc1ccccc1F	ZINC000819056082	FG	On-Demand	Anodyne	ADRB2	23	42
O[C@H](CNCc1ccc(Br)cc1F)COc1ccccc1F	ZINC000819056082	FG	On-Demand	Anodyne	ADRB1	55	39
O[C@@H](CNCc1ccc(Br)cc1F)COc1ccccc1F	ZINC000819056083	FG	On-Demand	Anodyne	ADRB2	23	42
O[C@@H](CNCc1ccc(Br)cc1F)COc1ccccc1F	ZINC000819056083	FG	On-Demand	Anodyne	ADRB1	55	39
O=C(CCCNC[C@H](O)c1ccc([N+](=O)[O-])cc1)N1Cc2ccccc2C1	ZINC000819056098	FF	On-Demand	Bother	SSTR1	16	40
O=C(CCCNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)N1Cc2ccccc2C1	ZINC000819056099	FF	On-Demand	Bother	SSTR1	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(NC(=O)NC3CC3)cc1)C2	ZINC000819056121	GF	On-Demand	Anodyne	EPHX2	56	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(NC(=O)NC3CC3)cc1)C2	ZINC000819056122	GF	On-Demand	Anodyne	EPHX2	56	39
CCN(Cc1ccccc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056129	FH	On-Demand	Mild	CTSB	55	50
CCN(Cc1ccccc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056129	FH	On-Demand	Mild	PAPA1_CARPA	75	53
CCN(Cc1ccccc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056129	FH	On-Demand	Mild	CCKAR	50	36
CCN(Cc1ccccc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056129	FH	On-Demand	Mild	CTSK	48	47
CCN(Cc1ccccc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056129	FH	On-Demand	Mild	CTSL	33	53
CCN(Cc1ccccc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056129	FH	On-Demand	Mild	REN	47	39
CCN(Cc1ccccc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056129	FH	On-Demand	Mild	CTSS	24	53
CCN(Cc1ccccc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056129	FH	On-Demand	Mild	CAPN1	15	41
CCN(Cc1ccccc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056129	FH	On-Demand	Mild	FPR1	51	42
CCN(Cc1ccccc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056129	FH	On-Demand	Mild	CTRB_BOVIN	60	42
CCN(Cc1ccccc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056130	FH	On-Demand	Mild	CTSB	55	50
CCN(Cc1ccccc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056130	FH	On-Demand	Mild	PAPA1_CARPA	75	53
CCN(Cc1ccccc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056130	FH	On-Demand	Mild	CCKAR	50	36
CCN(Cc1ccccc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056130	FH	On-Demand	Mild	CTSK	48	47
CCN(Cc1ccccc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056130	FH	On-Demand	Mild	CTSL	33	53
CCN(Cc1ccccc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056130	FH	On-Demand	Mild	REN	47	39
CCN(Cc1ccccc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056130	FH	On-Demand	Mild	CTSS	24	53
CCN(Cc1ccccc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056130	FH	On-Demand	Mild	CAPN1	15	41
CCN(Cc1ccccc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056130	FH	On-Demand	Mild	FPR1	51	42
CCN(Cc1ccccc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819056130	FH	On-Demand	Mild	CTRB_BOVIN	60	42
Cc1ccc(OC[C@@H](O)CNCCN/C(O)=C2/N=CC=CC2=O)cc1	ZINC000819056133	EC	On-Demand	Mild	ADRB2	40	43
Cc1ccc(OC[C@@H](O)CNCCN/C(O)=C2/N=CC=CC2=O)cc1	ZINC000819056133	EC	On-Demand	Mild	ADRB1	66	44
Cc1ccc(OC[C@@H](O)CNCCN/C(O)=C2/N=CC=CC2=O)cc1	ZINC000819056133	EC	On-Demand	Mild	ADRB3	36	41
Cc1ccc(OC[C@H](O)CNCCN/C(O)=C2\N=CC=CC2=O)cc1	ZINC000819056134	EC	On-Demand	Mild	ADRB2	40	43
Cc1ccc(OC[C@H](O)CNCCN/C(O)=C2\N=CC=CC2=O)cc1	ZINC000819056134	EC	On-Demand	Mild	ADRB1	66	44
Cc1ccc(OC[C@H](O)CNCCN/C(O)=C2\N=CC=CC2=O)cc1	ZINC000819056134	EC	On-Demand	Mild	ADRB3	36	41
Cc1ccc(OC[C@H](O)CNCCN/C(O)=C2/N=CC=CC2=O)cc1	ZINC000819056135	EC	On-Demand	Mild	ADRB2	40	43
Cc1ccc(OC[C@H](O)CNCCN/C(O)=C2/N=CC=CC2=O)cc1	ZINC000819056135	EC	On-Demand	Mild	ADRB1	66	44
Cc1ccc(OC[C@H](O)CNCCN/C(O)=C2/N=CC=CC2=O)cc1	ZINC000819056135	EC	On-Demand	Mild	ADRB3	36	41
Cc1ccc(OC[C@@H](O)CNCCN/C(O)=C2\N=CC=CC2=O)cc1	ZINC000819056136	EC	On-Demand	Mild	ADRB2	40	43
Cc1ccc(OC[C@@H](O)CNCCN/C(O)=C2\N=CC=CC2=O)cc1	ZINC000819056136	EC	On-Demand	Mild	ADRB1	66	44
Cc1ccc(OC[C@@H](O)CNCCN/C(O)=C2\N=CC=CC2=O)cc1	ZINC000819056136	EC	On-Demand	Mild	ADRB3	36	41
O[C@H](CNCC1(N2CCSCC2)CCCCC1)c1ccccc1F	ZINC000819056160	FG	On-Demand	Anodyne	HCN1	58	36
O[C@H](CNCC1(N2CCSCC2)CCCCC1)c1ccccc1F	ZINC000819056160	FG	On-Demand	Anodyne	HCN4	55	36
O[C@@H](CNCC1(N2CCSCC2)CCCCC1)c1ccccc1F	ZINC000819056161	FG	On-Demand	Anodyne	HCN1	58	36
O[C@@H](CNCC1(N2CCSCC2)CCCCC1)c1ccccc1F	ZINC000819056161	FG	On-Demand	Anodyne	HCN4	55	36
CCCNC(=O)c1ccccc1NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819056167	FE	On-Demand	Anodyne	HCN1	41	30
CCCNC(=O)c1ccccc1NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819056168	FE	On-Demand	Anodyne	HCN1	41	30
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(F)cc2F)c1	ZINC000819056178	DF	On-Demand	Bother	ADRB1	31	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(F)cc2F)c1	ZINC000819056178	DF	On-Demand	Bother	ADRB3	67	42
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(F)cc2F)c1	ZINC000819056179	DF	On-Demand	Bother	ADRB1	31	42
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(F)cc2F)c1	ZINC000819056179	DF	On-Demand	Bother	ADRB3	67	42
COc1cccc(C(=O)NCCNC(=O)C(F)=C2CCC2)c1	ZINC000819056180	DD	On-Demand	Anodyne	DRD4	66	50
COc1cccc(C(=O)NCCNC(=O)C(F)=C2CCC2)c1	ZINC000819056180	DD	On-Demand	Anodyne	DRD3	18	52
COc1cccc(C(=O)NCCNC(=O)C(F)=C2CCC2)c1	ZINC000819056180	DD	On-Demand	Anodyne	NQO2	29	42
COc1cccc(C(=O)NCCNC(=O)C(F)=C2CCC2)c1	ZINC000819056180	DD	On-Demand	Anodyne	MTNR1A	48	40
COc1cccc(C(=O)NCCNC(=O)C(F)=C2CCC2)c1	ZINC000819056180	DD	On-Demand	Anodyne	MTNR1B	47	40
COc1cccc(C(=O)NCCNC(=O)C(F)=C2CCC2)c1	ZINC000819056180	DD	On-Demand	Anodyne	CTSS	19	48
O=[N+]([O-])c1ccc([C@H](O)CNCC2(N3CCSCC3)CCCCC2)cc1	ZINC000819056183	GF	On-Demand	Bother	HCN1	50	32
O=[N+]([O-])c1ccc([C@H](O)CNCC2(N3CCSCC3)CCCCC2)cc1	ZINC000819056183	GF	On-Demand	Bother	HCN4	48	32
O=[N+]([O-])c1ccc([C@@H](O)CNCC2(N3CCSCC3)CCCCC2)cc1	ZINC000819056184	GF	On-Demand	Bother	HCN1	50	32
O=[N+]([O-])c1ccc([C@@H](O)CNCC2(N3CCSCC3)CCCCC2)cc1	ZINC000819056184	GF	On-Demand	Bother	HCN4	48	32
COc1cccc([S@@](=O)CC(=O)Nc2ccccc2C(=O)NCC(C)C)c1	ZINC000819056204	GF	On-Demand	Anodyne	MTNR1B	30	40
O=S(=O)(N1CCC(CNC[C@H](O)c2ccccc2)CC1)C(F)(F)F	ZINC000819056250	FD	On-Demand	Anodyne	ADRB1	25	41
O=S(=O)(N1CCC(CNC[C@H](O)c2ccccc2)CC1)C(F)(F)F	ZINC000819056250	FD	On-Demand	Anodyne	SLC6A3	26	45
O=S(=O)(N1CCC(CNC[C@H](O)c2ccccc2)CC1)C(F)(F)F	ZINC000819056250	FD	On-Demand	Anodyne	ADRB3	49	41
O=S(=O)(N1CCC(CNC[C@H](O)c2ccccc2)CC1)C(F)(F)F	ZINC000819056250	FD	On-Demand	Anodyne	SFRP1	56	35
O=S(=O)(N1CCC(CNC[C@@H](O)c2ccccc2)CC1)C(F)(F)F	ZINC000819056251	FD	On-Demand	Anodyne	ADRB1	25	41
O=S(=O)(N1CCC(CNC[C@@H](O)c2ccccc2)CC1)C(F)(F)F	ZINC000819056251	FD	On-Demand	Anodyne	SLC6A3	26	45
O=S(=O)(N1CCC(CNC[C@@H](O)c2ccccc2)CC1)C(F)(F)F	ZINC000819056251	FD	On-Demand	Anodyne	ADRB3	49	41
O=S(=O)(N1CCC(CNC[C@@H](O)c2ccccc2)CC1)C(F)(F)F	ZINC000819056251	FD	On-Demand	Anodyne	SFRP1	56	35
O[C@@H](CNCC1(N2CCSCC2)CCCCC1)c1ccc(F)cn1	ZINC000819056261	FF	On-Demand	Anodyne	HCN1	53	32
O[C@@H](CNCC1(N2CCSCC2)CCCCC1)c1ccc(F)cn1	ZINC000819056261	FF	On-Demand	Anodyne	HCN4	51	32
O[C@H](CNCC1(N2CCSCC2)CCCCC1)c1ccc(F)cn1	ZINC000819056262	FF	On-Demand	Anodyne	HCN1	53	32
O[C@H](CNCC1(N2CCSCC2)CCCCC1)c1ccc(F)cn1	ZINC000819056262	FF	On-Demand	Anodyne	HCN4	51	32
COc1ccc(OC)c([C@H](O)CNCC[S@@](=O)C(C)(C)C)c1	ZINC000819056267	ED	On-Demand	Anodyne	ADRB2	21	47
COc1ccc(OC)c([C@H](O)CNCC[S@](=O)C(C)(C)C)c1	ZINC000819056268	ED	On-Demand	Anodyne	ADRB2	21	47
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCN2CCSCC2)CC1	ZINC000819056281	FD	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCN2CCSCC2)CC1	ZINC000819056283	FD	On-Demand	Anodyne	GPR119	29	40
COCCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819056297	FE	On-Demand	Anodyne	CACNA1C	97	42
COCCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819056297	FE	On-Demand	Anodyne	CACNA1D	90	42
COCCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819056297	FE	On-Demand	Anodyne	SLC27A4	41	30
COCCOC(=O)C1=C(C)NC(=S)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819056298	FE	On-Demand	Anodyne	CACNA1C	97	42
COCCOC(=O)C1=C(C)NC(=S)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819056298	FE	On-Demand	Anodyne	CACNA1D	90	42
COCCOC(=O)C1=C(C)NC(=S)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819056298	FE	On-Demand	Anodyne	SLC27A4	41	30
COC(=O)C1=C(C)NC(=O)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819056328	CE	On-Demand	Anodyne	CACNA1C	67	39
COC(=O)C1=C(C)NC(=O)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819056328	CE	On-Demand	Anodyne	CACNA1D	77	39
COC(=O)C1=C(C)NC(=O)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819056328	CE	On-Demand	Anodyne	SLC27A4	86	42
COC(=O)C1=C(C)NC(=O)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819056329	CE	On-Demand	Anodyne	CACNA1C	67	39
COC(=O)C1=C(C)NC(=O)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819056329	CE	On-Demand	Anodyne	CACNA1D	77	39
COC(=O)C1=C(C)NC(=O)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819056329	CE	On-Demand	Anodyne	SLC27A4	86	42
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819056343	EF	On-Demand	Anodyne	CACNA1C	72	49
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819056343	EF	On-Demand	Anodyne	CACNA1D	64	49
CCOC(=O)C1=C(C)NC(=S)N[C@H]1c1c(F)cc(C)cc1F	ZINC000819056343	EF	On-Demand	Anodyne	SLC27A4	55	33
CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819056344	EF	On-Demand	Anodyne	CACNA1C	72	49
CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819056344	EF	On-Demand	Anodyne	CACNA1D	64	49
CCOC(=O)C1=C(C)NC(=S)N[C@@H]1c1c(F)cc(C)cc1F	ZINC000819056344	EF	On-Demand	Anodyne	SLC27A4	55	33
O[C@@H](CNCCc1ccc(F)cc1F)c1ccc(F)c(Br)c1	ZINC000819056371	FH	On-Demand	Anodyne	ADRB2	28	44
O[C@H](CNCCc1ccc(F)cc1F)c1ccc(F)c(Br)c1	ZINC000819056372	FH	On-Demand	Anodyne	ADRB2	28	44
CC(=O)Nc1cccc(CC(=O)N2CCC(C(=O)NCC(C)C)CC2)c1	ZINC000819056397	FE	On-Demand	Anodyne	EPHX2	25	43
CC(=O)c1ccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819056413	ED	On-Demand	Anodyne	ADRB2	53	46
CC(=O)c1ccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819056413	ED	On-Demand	Anodyne	ADRB1	82	46
CC(=O)c1ccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819056413	ED	On-Demand	Anodyne	ADRB3	50	46
CC(=O)c1ccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819056413	ED	On-Demand	Anodyne	ABCB1	16	60
CC(=O)c1ccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819056414	ED	On-Demand	Anodyne	ADRB2	53	46
CC(=O)c1ccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819056414	ED	On-Demand	Anodyne	ADRB1	82	46
CC(=O)c1ccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819056414	ED	On-Demand	Anodyne	ADRB3	50	46
CC(=O)c1ccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819056414	ED	On-Demand	Anodyne	ABCB1	16	60
CC(=O)c1ccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819056416	ED	On-Demand	Anodyne	ADRB2	53	46
CC(=O)c1ccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819056416	ED	On-Demand	Anodyne	ADRB1	82	46
CC(=O)c1ccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819056416	ED	On-Demand	Anodyne	ADRB3	50	46
CC(=O)c1ccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819056416	ED	On-Demand	Anodyne	ABCB1	16	60
CC(=O)c1ccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819056418	ED	On-Demand	Anodyne	ADRB2	53	46
CC(=O)c1ccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819056418	ED	On-Demand	Anodyne	ADRB1	82	46
CC(=O)c1ccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819056418	ED	On-Demand	Anodyne	ADRB3	50	46
CC(=O)c1ccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819056418	ED	On-Demand	Anodyne	ABCB1	16	60
CCCNC(=O)c1ccccc1NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819056443	GH	On-Demand	Anodyne	HCAR2	38	45
CCCNC(=O)c1ccccc1NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819056443	GH	On-Demand	Anodyne	CRTM	56	38
COCCNC(=O)c1ccccc1NC(=O)c1cc2c(cn1)OCCO2	ZINC000819056492	FD	On-Demand	Anodyne	KIT	15	44
CCCNC(=O)c1ccccc1NC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819056507	FF	On-Demand	Anodyne	DRD4	43	33
CCCNC(=O)c1ccccc1NC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819056507	FF	On-Demand	Anodyne	MTNR1A	43	38
CCCNC(=O)c1ccccc1NC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819056507	FF	On-Demand	Anodyne	MTNR1B	41	45
CCCNC(=O)c1ccccc1NC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819056510	FF	On-Demand	Anodyne	DRD4	43	33
CCCNC(=O)c1ccccc1NC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819056510	FF	On-Demand	Anodyne	MTNR1A	43	38
CCCNC(=O)c1ccccc1NC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819056510	FF	On-Demand	Anodyne	MTNR1B	41	45
O=C(NC1CCN(C(=O)C2CC2)CC1)C(F)=C1CCC1	ZINC000819056554	CD	On-Demand	Anodyne	EPHX2	24	45
NS(=O)(=O)c1ccc(F)c(C(=O)NCCc2cnc(SC3CCCC3)nc2)c1	ZINC000819056620	HE	On-Demand	Anodyne	CA2	37	52
NS(=O)(=O)c1ccc(F)c(C(=O)NCCc2cnc(SC3CCCC3)nc2)c1	ZINC000819056620	HE	On-Demand	Anodyne	CA1	31	44
NS(=O)(=O)c1ccc(F)c(C(=O)NCCc2cnc(SC3CCCC3)nc2)c1	ZINC000819056620	HE	On-Demand	Anodyne	CA4	29	44
NS(=O)(=O)c1ccc(F)c(C(=O)NCCc2cnc(SC3CCCC3)nc2)c1	ZINC000819056620	HE	On-Demand	Anodyne	CA9	24	44
Cc1ccc(N2CCCC2)c(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)c1	ZINC000819056623	IH	On-Demand	Anodyne	EPHX2	17	43
Cc1ccc(N2CCCC2)c(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)c1	ZINC000819056623	IH	On-Demand	Anodyne	TAAR1	30	43
Cc1ccc(N2CCCC2)c(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)c1	ZINC000819056623	IH	On-Demand	Anodyne	KCNK3	65	34
Cc1ccc(N2CCCC2)c(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)c1	ZINC000819056623	IH	On-Demand	Anodyne	KCNK9	52	33
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ncccn1	ZINC000819056627	ED	On-Demand	Anodyne	TYK2	54	37
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ncccn1	ZINC000819056627	ED	On-Demand	Anodyne	GCK	19	40
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ncccn1	ZINC000819056627	ED	On-Demand	Anodyne	NAMPT	15	44
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc2c(c1)-c1ccccc1C2	ZINC000819056629	II	On-Demand	Anodyne	KCNK3	77	37
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1csc(-c2ccccn2)n1	ZINC000819056632	IG	On-Demand	Anodyne	GRM4	61	40
CC[C@H]1OCC[C@H]1C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819056635	FE	On-Demand	Anodyne	NAMPT	15	45
CCC(=O)c1cc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)ccc1F	ZINC000819056654	HH	On-Demand	Anodyne	TAAR1	40	37
CCC(=O)c1cc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)ccc1F	ZINC000819056654	HH	On-Demand	Anodyne	KCNK3	77	35
CCC(=O)c1cc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)ccc1F	ZINC000819056654	HH	On-Demand	Anodyne	KCNK9	44	34
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cc(Cl)nc(Cl)c1	ZINC000819056672	HH	On-Demand	Anodyne	TYK2	44	35
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cc(Cl)nc(Cl)c1	ZINC000819056672	HH	On-Demand	Anodyne	KCNK3	71	37
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819056689	IH	On-Demand	Anodyne	F2	44	38
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819056689	IH	On-Demand	Anodyne	FKBP1A	40	41
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819056689	IH	On-Demand	Anodyne	TRY1_BOVIN	52	35
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819056689	IH	On-Demand	Anodyne	PREP	89	49
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819056689	IH	On-Demand	Anodyne	TMPRSS11D	60	34
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819056690	IH	On-Demand	Anodyne	F2	44	38
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819056690	IH	On-Demand	Anodyne	FKBP1A	40	41
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819056690	IH	On-Demand	Anodyne	TRY1_BOVIN	52	35
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819056690	IH	On-Demand	Anodyne	PREP	89	49
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819056690	IH	On-Demand	Anodyne	TMPRSS11D	60	34
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819056693	HH	On-Demand	Anodyne	REN	45	39
CC[C@@H](C)c1ccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1	ZINC000819056698	HI	On-Demand	Anodyne	KCNK3	73	37
CCOc1ccccc1C(F)(F)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819056705	IH	On-Demand	Anodyne	KCNK3	46	45
CCOc1ccccc1C(F)(F)C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819056705	IH	On-Demand	Anodyne	KCNK9	45	45
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cc(C(F)(F)F)cc(Cl)n1	ZINC000819056711	IH	On-Demand	Anodyne	EPHX2	16	46
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cc(C(F)(F)F)cc(Cl)n1	ZINC000819056711	IH	On-Demand	Anodyne	BRAF	15	41
COc1ccc(OC)c([C@H](O)CNCCc2ccc(F)cc2F)c1	ZINC000819056774	EF	On-Demand	Anodyne	ADRB2	26	51
CCOc1ccc(Br)cc1S(=O)(=O)N[C@H]1CCOC1=O	ZINC000819056818	FD	On-Demand	Anodyne	LUXR	58	38
CCOc1ccc(Br)cc1S(=O)(=O)N[C@H]1CCOC1=O	ZINC000819056818	FD	On-Demand	Anodyne	TRAR	78	42
CCOc1ccc(Br)cc1S(=O)(=O)N[C@H]1CCOC1=O	ZINC000819056818	FD	On-Demand	Anodyne	LASR	48	38
NS(=O)(=O)c1cc(C(=O)NCCc2cnc(SC3CCCC3)nc2)ccc1Cl	ZINC000819056823	IF	On-Demand	Anodyne	CA2	21	58
NS(=O)(=O)c1cc(C(=O)NCCc2cnc(SC3CCCC3)nc2)ccc1Cl	ZINC000819056823	IF	On-Demand	Anodyne	CA6	19	49
NS(=O)(=O)c1cc(C(=O)NCCc2cnc(SC3CCCC3)nc2)ccc1Cl	ZINC000819056823	IF	On-Demand	Anodyne	CA1	20	58
NS(=O)(=O)c1cc(C(=O)NCCc2cnc(SC3CCCC3)nc2)ccc1Cl	ZINC000819056823	IF	On-Demand	Anodyne	CA7	30	51
NS(=O)(=O)c1cc(C(=O)NCCc2cnc(SC3CCCC3)nc2)ccc1Cl	ZINC000819056823	IF	On-Demand	Anodyne	CA13	48	51
NS(=O)(=O)c1cc(C(=O)NCCc2cnc(SC3CCCC3)nc2)ccc1Cl	ZINC000819056823	IF	On-Demand	Anodyne	CA4	16	58
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1	ZINC000819056827	IG	On-Demand	Anodyne	PRNP	50	36
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1	ZINC000819056827	IG	On-Demand	Anodyne	ST14	18	41
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1	ZINC000819056827	IG	On-Demand	Anodyne	KCNK3	92	36
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1	ZINC000819056827	IG	On-Demand	Anodyne	KCNK9	57	34
O=C(NCCc1cnc(SC2CCCC2)nc1)c1cnn(Cc2ccccc2)c1Cl	ZINC000819056828	II	On-Demand	Anodyne	CTSK	20	44
CC(C)(C)OC(=O)N1CC(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819056836	HE	On-Demand	Anodyne	EPHX2	18	40
CC(C)(C)OC(=O)N1CC(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)C1	ZINC000819056836	HE	On-Demand	Anodyne	GPR119	39	41
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(C(F)(F)F)nc1Cl	ZINC000819056840	IH	On-Demand	Anodyne	SHH	25	45
CC(C)c1ocnc1C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819056841	GG	On-Demand	Anodyne	ATR	16	41
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cccc(N2CCOC2=O)c1	ZINC000819056845	IF	On-Demand	Anodyne	KCNK3	83	37
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@@H]1CCCN1C(=O)OCC(F)(F)F	ZINC000819056848	IG	On-Demand	Anodyne	LGMN	71	38
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@H]1CCCN1C(=O)OCC(F)(F)F	ZINC000819056849	IG	On-Demand	Anodyne	LGMN	71	38
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819056852	IH	On-Demand	Anodyne	F2	17	43
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819056852	IH	On-Demand	Anodyne	FKBP1A	45	39
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819056852	IH	On-Demand	Anodyne	PREP	29	45
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819056852	IH	On-Demand	Anodyne	LGMN	45	33
Cc1cc(C)c(S(=O)(=O)N[C@H]2CCOC2=O)c(C)c1	ZINC000819056864	CD	On-Demand	Anodyne	LUXR	63	34
Cc1cc(C)c(S(=O)(=O)N[C@H]2CCOC2=O)c(C)c1	ZINC000819056864	CD	On-Demand	Anodyne	TRAR	74	33
Cc1cc(C)c(S(=O)(=O)N[C@H]2CCOC2=O)c(C)c1	ZINC000819056864	CD	On-Demand	Anodyne	LASR	53	33
CCOc1ccc(/C=C(/C#N)C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1	ZINC000819056866	IH	On-Demand	Reactive	CA12	15	44
CCOc1ccc(/C=C(\C#N)C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1	ZINC000819056867	IH	On-Demand	Reactive	CA12	15	44
C[C@H](C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1)N1CCc2ccccc21	ZINC000819056872	HG	On-Demand	Anodyne	NPY1R	28	40
CCC(=O)Nc1ccccc1C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819056873	HG	On-Demand	Anodyne	KCNK3	55	35
CCC(=O)Nc1ccccc1C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819056873	HG	On-Demand	Anodyne	KCNK9	54	35
CC(C)c1nn(C)c(Cl)c1C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819056899	IG	On-Demand	Anodyne	TYK2	44	34
O=C(CCc1cncc2ccccc12)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819056913	HH	On-Demand	Anodyne	NAMPT	20	42
O[C@H](CNCC1(N2CCSCC2)CCCCC1)c1cccc(F)c1	ZINC000819056961	FG	On-Demand	Anodyne	HCN1	51	32
O[C@H](CNCC1(N2CCSCC2)CCCCC1)c1cccc(F)c1	ZINC000819056961	FG	On-Demand	Anodyne	HCN4	48	32
O[C@@H](CNCC1(N2CCSCC2)CCCCC1)c1cccc(F)c1	ZINC000819056962	FG	On-Demand	Anodyne	HCN1	51	32
O[C@@H](CNCC1(N2CCSCC2)CCCCC1)c1cccc(F)c1	ZINC000819056962	FG	On-Demand	Anodyne	HCN4	48	32
COCCNC(=O)c1ccccc1NC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819056971	FE	On-Demand	Anodyne	KCNK3	74	39
COCCNC(=O)c1ccccc1NC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819056971	FE	On-Demand	Anodyne	KCNK9	60	39
CN(C)c1ccc([C@@H]2C[C@H]2C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1	ZINC000819057026	IG	On-Demand	Anodyne	NAMPT	22	53
CN(C)c1ccc([C@@H]2C[C@@H]2C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1	ZINC000819057028	IG	On-Demand	Anodyne	NAMPT	22	53
O=C(NCCc1cnc(SC2CCCC2)nc1)c1cccnc1F	ZINC000819057049	EG	On-Demand	Anodyne	CTSK	23	41
CC(C)(C)OC(=O)NCCCCC(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819057055	IG	On-Demand	Anodyne	HDAC10	17	44
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(OC(F)(F)Cl)cc1	ZINC000819057062	II	On-Demand	Anodyne	EPHX2	19	42
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(OC(F)(F)Cl)cc1	ZINC000819057062	II	On-Demand	Anodyne	TAAR1	46	36
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(OC(F)(F)Cl)cc1	ZINC000819057062	II	On-Demand	Anodyne	SHH	45	37
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(OC(F)(F)Cl)cc1	ZINC000819057062	II	On-Demand	Anodyne	KCNK3	77	38
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cccnc1Br	ZINC000819057080	IG	On-Demand	Anodyne	KCNK3	40	33
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000819057083	IF	On-Demand	Bother	TAAR1	23	41
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000819057083	IF	On-Demand	Bother	KCNK3	62	39
COc1cccc(C2=NO[C@H](C(=O)NCCc3cnc(SC4CCCC4)nc3)C2)c1	ZINC000819057087	IG	On-Demand	Anodyne	LUCI_PHOPY	20	42
COc1cccc(C2=NO[C@@H](C(=O)NCCc3cnc(SC4CCCC4)nc3)C2)c1	ZINC000819057088	IG	On-Demand	Anodyne	LUCI_PHOPY	20	42
O=C1OCC[C@@H]1NS(=O)(=O)c1cc(F)cc(F)c1	ZINC000819057093	CC	On-Demand	Anodyne	LUXR	65	36
O=C1OCC[C@@H]1NS(=O)(=O)c1cc(F)cc(F)c1	ZINC000819057093	CC	On-Demand	Anodyne	TRAR	75	35
O=C1OCC[C@@H]1NS(=O)(=O)c1cc(F)cc(F)c1	ZINC000819057093	CC	On-Demand	Anodyne	LASR	47	32
O[C@@H](CNCC1(N2CCSCC2)CCCCC1)c1cccnc1	ZINC000819057120	EE	On-Demand	Anodyne	ADRB3	87	46
O[C@@H](CNCC1(N2CCSCC2)CCCCC1)c1cccnc1	ZINC000819057120	EE	On-Demand	Anodyne	HCN1	51	32
O[C@@H](CNCC1(N2CCSCC2)CCCCC1)c1cccnc1	ZINC000819057120	EE	On-Demand	Anodyne	HCN4	48	32
O[C@H](CNCC1(N2CCSCC2)CCCCC1)c1cccnc1	ZINC000819057121	EE	On-Demand	Anodyne	ADRB3	87	46
O[C@H](CNCC1(N2CCSCC2)CCCCC1)c1cccnc1	ZINC000819057121	EE	On-Demand	Anodyne	HCN1	51	32
O[C@H](CNCC1(N2CCSCC2)CCCCC1)c1cccnc1	ZINC000819057121	EE	On-Demand	Anodyne	HCN4	48	32
Cc1cc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)c(C(C)C)cc1Cl	ZINC000819057137	GH	On-Demand	Anodyne	ADRB2	17	40
Cc1cc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)c(C(C)C)cc1Cl	ZINC000819057138	GH	On-Demand	Anodyne	ADRB2	17	40
Cc1cc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)c(C(C)C)cc1Cl	ZINC000819057139	GH	On-Demand	Anodyne	ADRB2	17	40
Cc1cc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)c(C(C)C)cc1Cl	ZINC000819057140	GH	On-Demand	Anodyne	ADRB2	17	40
O[C@H](CNCC1(N2CCSCC2)CCCCC1)c1ccccc1	ZINC000819057172	EG	On-Demand	Anodyne	HCN1	60	37
O[C@H](CNCC1(N2CCSCC2)CCCCC1)c1ccccc1	ZINC000819057172	EG	On-Demand	Anodyne	HCN4	56	37
O[C@@H](CNCC1(N2CCSCC2)CCCCC1)c1ccccc1	ZINC000819057173	EG	On-Demand	Anodyne	HCN1	60	37
O[C@@H](CNCC1(N2CCSCC2)CCCCC1)c1ccccc1	ZINC000819057173	EG	On-Demand	Anodyne	HCN4	56	37
O[C@H](CNCCN1CCSCC1)c1cccnc1	ZINC000819057179	CC	On-Demand	Anodyne	ADRB2	30	46
O[C@H](CNCCN1CCSCC1)c1cccnc1	ZINC000819057179	CC	On-Demand	Anodyne	ADRB1	34	46
O[C@H](CNCCN1CCSCC1)c1cccnc1	ZINC000819057179	CC	On-Demand	Anodyne	ADRB3	114	51
O[C@@H](CNCCN1CCSCC1)c1cccnc1	ZINC000819057180	CC	On-Demand	Anodyne	ADRB2	30	46
O[C@@H](CNCCN1CCSCC1)c1cccnc1	ZINC000819057180	CC	On-Demand	Anodyne	ADRB1	34	46
O[C@@H](CNCCN1CCSCC1)c1cccnc1	ZINC000819057180	CC	On-Demand	Anodyne	ADRB3	114	51
CSc1ccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057208	EE	On-Demand	Anodyne	ADRB2	49	43
CSc1ccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057208	EE	On-Demand	Anodyne	ADRB1	70	43
CSc1ccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057208	EE	On-Demand	Anodyne	ADRB3	42	43
CSc1ccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057209	EE	On-Demand	Anodyne	ADRB2	49	43
CSc1ccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057209	EE	On-Demand	Anodyne	ADRB1	70	43
CSc1ccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057209	EE	On-Demand	Anodyne	ADRB3	42	43
CSc1ccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057210	EE	On-Demand	Anodyne	ADRB2	49	43
CSc1ccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057210	EE	On-Demand	Anodyne	ADRB1	70	43
CSc1ccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057210	EE	On-Demand	Anodyne	ADRB3	42	43
CSc1ccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057211	EE	On-Demand	Anodyne	ADRB2	49	43
CSc1ccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057211	EE	On-Demand	Anodyne	ADRB1	70	43
CSc1ccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057211	EE	On-Demand	Anodyne	ADRB3	42	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC[S@](=O)C(C)(C)C)CC1	ZINC000819057212	GE	On-Demand	Anodyne	GPR119	27	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC[S@](=O)C(C)(C)C)CC1	ZINC000819057213	GE	On-Demand	Anodyne	GPR119	27	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC[S@@](=O)C(C)(C)C)CC1	ZINC000819057214	GE	On-Demand	Anodyne	GPR119	27	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC[S@@](=O)C(C)(C)C)CC1	ZINC000819057215	GE	On-Demand	Anodyne	GPR119	27	41
N#Cc1cccc(OCC(=O)NCCc2cnc(SC3CCCC3)nc2)c1	ZINC000819057231	GG	On-Demand	Mild	CTSL	15	42
N#Cc1cccc(OCC(=O)NCCc2cnc(SC3CCCC3)nc2)c1	ZINC000819057231	GG	On-Demand	Mild	VCP	45	36
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819057241	CC	On-Demand	Bother	SLC27A4	42	31
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819057241	CC	On-Demand	Bother	LUXR	72	57
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819057241	CC	On-Demand	Bother	TRAR	81	52
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819057241	CC	On-Demand	Bother	LASR	44	47
Cc1nc(C(=O)NCCc2cnc(SC3CCCC3)nc2)nn1-c1ccccc1	ZINC000819057245	HG	On-Demand	Anodyne	CTSK	24	40
O=C(NCCc1cnc(SC2CCCC2)nc1)c1ccccc1SC(F)(F)F	ZINC000819057249	IK	On-Demand	Anodyne	CTSK	23	41
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819057255	IF	On-Demand	Anodyne	VHL	61	36
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cc(F)c([N+](=O)[O-])cc1F	ZINC000819057257	IG	On-Demand	Bother	TAAR1	20	40
CC(C)(C)C(=O)Nc1ccccc1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819057260	II	On-Demand	Anodyne	CTSK	24	40
O=C(CCCCN1CCCC1)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819057261	GF	On-Demand	Anodyne	CASR	22	40
O=C(CCCCN1CCCC1)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819057261	GF	On-Demand	Anodyne	CCR3	21	40
O=C(CCCCN1CCCC1)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819057261	GF	On-Demand	Anodyne	CHRNA7	25	51
O=C(CCCCN1CCCC1)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819057261	GF	On-Demand	Anodyne	EPHX2	31	50
O=C(CCCCN1CCCC1)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819057261	GF	On-Demand	Anodyne	ST14	40	36
O=C(CCCCN1CCCC1)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819057261	GF	On-Demand	Anodyne	MCHR1	23	41
O=C(NCCc1cnc(SC2CCCC2)nc1)c1ccnc(Br)c1	ZINC000819057265	HH	On-Demand	Anodyne	KDM4E	23	42
CC(C)(C)OC(=O)NCCCC(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819057278	IF	On-Demand	Anodyne	HDAC10	16	41
O=C(NCCc1cnc(SC2CCCC2)nc1)c1cnc(Cl)c(Cl)c1	ZINC000819057288	GI	On-Demand	Anodyne	CXCR3	19	41
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@H]1CC(=O)N(C2CCCC2)C1	ZINC000819057294	HE	On-Demand	Anodyne	INHA	26	63
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@@H]1CC(=O)N(C2CCCC2)C1	ZINC000819057295	HE	On-Demand	Anodyne	INHA	26	63
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@@H]1CCCN1C(=O)C(F)(F)F	ZINC000819057296	IE	On-Demand	Anodyne	SFRP1	53	37
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@@H]1CCCN1C(=O)C(F)(F)F	ZINC000819057296	IE	On-Demand	Anodyne	WNT3	57	37
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@H]1CCCN1C(=O)C(F)(F)F	ZINC000819057297	IE	On-Demand	Anodyne	SFRP1	53	37
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@H]1CCCN1C(=O)C(F)(F)F	ZINC000819057297	IE	On-Demand	Anodyne	WNT3	57	37
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1F	ZINC000819057299	CC	On-Demand	Anodyne	LUXR	65	39
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1F	ZINC000819057299	CC	On-Demand	Anodyne	TRAR	75	35
O=C(CNC(=O)OCc1ccccc1)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819057301	IF	On-Demand	Anodyne	TGM2	25	43
O=C(CNC(=O)OCc1ccccc1)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819057301	IF	On-Demand	Anodyne	NPR	50	32
O=C(CNC(=O)OCc1ccccc1)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819057301	IF	On-Demand	Anodyne	F13A1	37	43
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1nc(Cl)ccc1Cl	ZINC000819057302	HH	On-Demand	Anodyne	TYK2	51	35
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1	ZINC000819057304	ED	On-Demand	Anodyne	LUXR	57	42
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1	ZINC000819057304	ED	On-Demand	Anodyne	SFRP1	51	34
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1	ZINC000819057304	ED	On-Demand	Anodyne	TRAR	63	39
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057338	FD	On-Demand	Anodyne	ADRB2	58	61
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057338	FD	On-Demand	Anodyne	ADRB1	95	61
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057338	FD	On-Demand	Anodyne	GRIN1	20	43
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057338	FD	On-Demand	Anodyne	ADRB3	60	61
CC(=O)Nc1ccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057339	FD	On-Demand	Anodyne	ADRB2	58	61
CC(=O)Nc1ccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057339	FD	On-Demand	Anodyne	ADRB1	95	61
CC(=O)Nc1ccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057339	FD	On-Demand	Anodyne	GRIN1	20	43
CC(=O)Nc1ccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057339	FD	On-Demand	Anodyne	ADRB3	60	61
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057340	FD	On-Demand	Anodyne	ADRB2	58	61
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057340	FD	On-Demand	Anodyne	ADRB1	95	61
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057340	FD	On-Demand	Anodyne	GRIN1	20	43
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057340	FD	On-Demand	Anodyne	ADRB3	60	61
CC(=O)Nc1ccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057341	FD	On-Demand	Anodyne	ADRB2	58	61
CC(=O)Nc1ccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057341	FD	On-Demand	Anodyne	ADRB1	95	61
CC(=O)Nc1ccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057341	FD	On-Demand	Anodyne	GRIN1	20	43
CC(=O)Nc1ccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057341	FD	On-Demand	Anodyne	ADRB3	60	61
O=C(/C=C/[C@@H]1CCCO1)NCCN1C(=O)S/C(=C/c2ccccc2)C1=O	ZINC000819057374	FF	On-Demand	Anodyne	AKR1B1	48	44
O=C(/C=C\[C@@H]1CCCO1)NCCN1C(=O)S/C(=C\c2ccccc2)C1=O	ZINC000819057375	FF	On-Demand	Anodyne	AKR1B1	48	44
O=C(/C=C/[C@@H]1CCCO1)NCCN1C(=O)S/C(=C\c2ccccc2)C1=O	ZINC000819057376	FF	On-Demand	Anodyne	AKR1B1	48	44
O=C(/C=C\[C@@H]1CCCO1)NCCN1C(=O)S/C(=C/c2ccccc2)C1=O	ZINC000819057377	FF	On-Demand	Anodyne	AKR1B1	48	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccccc1N1CCCCCC1)C2	ZINC000819057378	GH	On-Demand	Anodyne	KCNQ2	82	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccccc1N1CCCCCC1)C2	ZINC000819057379	GH	On-Demand	Anodyne	KCNQ2	82	46
COCCNC(=O)c1ccccc1NC(=O)[C@H]1CCCC[C@@H]1C	ZINC000819057394	DF	On-Demand	Anodyne	POLR1A	45	34
COCCNC(=O)c1ccccc1NC(=O)[C@H]1CCCC[C@H]1C	ZINC000819057395	DF	On-Demand	Anodyne	POLR1A	45	34
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCC[C@@H]1C	ZINC000819057396	DF	On-Demand	Anodyne	POLR1A	45	34
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCC[C@H]1C	ZINC000819057397	DF	On-Demand	Anodyne	POLR1A	45	34
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(-c2ccccc2)cc1	ZINC000819057420	HJ	On-Demand	Anodyne	PRNP	57	42
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(-c2ccccc2)cc1	ZINC000819057420	HJ	On-Demand	Anodyne	KLK1	24	40
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(-c2ccccc2)cc1	ZINC000819057420	HJ	On-Demand	Anodyne	SMO	18	42
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(-c2ccccc2)cc1	ZINC000819057420	HJ	On-Demand	Anodyne	KCNK3	92	45
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(-c2ccccc2)cc1	ZINC000819057420	HJ	On-Demand	Anodyne	KCNK9	41	39
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cc(O)c2ccsc2c1	ZINC000819057421	HH	On-Demand	Anodyne	KCNK3	42	35
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000819057424	CC	On-Demand	Anodyne	PKM	38	45
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000819057424	CC	On-Demand	Anodyne	LUXR	67	42
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000819057424	CC	On-Demand	Anodyne	TRAR	75	35
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000819057424	CC	On-Demand	Anodyne	LASR	42	34
C[Si](C)(C)c1ccc(CC(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1	ZINC000819057428	IG	On-Demand	Anodyne	RORC	47	38
C[Si](C)(C)c1ccc(CC(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cc1	ZINC000819057428	IG	On-Demand	Anodyne	NAMPT	16	41
N#Cc1ccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)o1	ZINC000819057430	FE	On-Demand	Mild	CSF1R	22	43
O=C(NCCc1cnc(SC2CCCC2)nc1)c1ccnc(C(F)(F)F)c1	ZINC000819057431	GH	On-Demand	Anodyne	KDM4E	23	43
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(F)c(F)c1	ZINC000819057443	CC	On-Demand	Anodyne	F10	19	42
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(F)c(F)c1	ZINC000819057443	CC	On-Demand	Anodyne	LUXR	68	42
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(F)c(F)c1	ZINC000819057443	CC	On-Demand	Anodyne	TRAR	77	36
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(F)c(F)c1	ZINC000819057443	CC	On-Demand	Anodyne	LASR	42	34
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(Br)nc1	ZINC000819057460	IG	On-Demand	Anodyne	KCNK3	58	35
CS(=O)(=O)Nc1cccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)c1	ZINC000819057462	IE	On-Demand	Anodyne	NR3C2	18	40
CS(=O)(=O)Nc1cccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)c1	ZINC000819057462	IE	On-Demand	Anodyne	KCNK3	100	40
CS(=O)(=O)Nc1cccc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)c1	ZINC000819057462	IE	On-Demand	Anodyne	KCNK9	53	40
O=C(NCCc1cnc(SC2CCCC2)nc1)c1cccc(O)c1O	ZINC000819057463	FF	On-Demand	Clean	CTSK	24	43
O=C(NCCc1cnc(SC2CCCC2)nc1)c1cccc(O)c1O	ZINC000819057463	FF	On-Demand	Clean	CTSL	15	40
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@@H](F)Cc1ccccc1	ZINC000819057506	GG	On-Demand	Anodyne	ST14	47	37
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@H](F)Cc1ccccc1	ZINC000819057507	GG	On-Demand	Anodyne	ST14	47	37
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@@H](O)c1cccnc1	ZINC000819057521	FE	On-Demand	Anodyne	ADRB3	58	40
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@@H](O)c1cccnc1	ZINC000819057521	FE	On-Demand	Anodyne	VCP	53	35
COc1ccc(OC)c([C@H](O)CNCC2(N3CCSCC3)CCCCC2)c1	ZINC000819057522	GG	On-Demand	Anodyne	HCN1	60	40
COc1ccc(OC)c([C@H](O)CNCC2(N3CCSCC3)CCCCC2)c1	ZINC000819057522	GG	On-Demand	Anodyne	HCN4	56	40
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@H](O)c1cccnc1	ZINC000819057523	FE	On-Demand	Anodyne	ADRB3	58	40
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@H](O)c1cccnc1	ZINC000819057523	FE	On-Demand	Anodyne	VCP	53	35
NS(=O)(=O)c1cc(C(=O)NCCc2cnc(SC3CCCC3)nc2)ccc1F	ZINC000819057524	HE	On-Demand	Anodyne	CA2	15	44
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000819057527	IG	On-Demand	Anodyne	GPBAR1	15	40
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000819057529	IG	On-Demand	Anodyne	GPBAR1	15	40
O[C@@H](CNCCc1ccc(F)cc1F)c1ccc(C(F)(F)F)cc1	ZINC000819057530	EH	On-Demand	Anodyne	ADRB2	22	43
O[C@H](CNCCc1ccc(F)cc1F)c1ccc(C(F)(F)F)cc1	ZINC000819057532	EH	On-Demand	Anodyne	ADRB2	22	43
COc1ccc(C(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1OC	ZINC000819057539	FD	On-Demand	Anodyne	L3MBTL3	63	36
COc1ccc(C(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1OC	ZINC000819057540	FD	On-Demand	Anodyne	L3MBTL3	63	36
COc1ccc(C(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1OC	ZINC000819057542	FD	On-Demand	Anodyne	L3MBTL3	63	36
COc1ccc(C(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1OC	ZINC000819057544	FD	On-Demand	Anodyne	L3MBTL3	63	36
O[C@H](CNCC1(N2CCSCC2)CCCCC1)c1ccc(F)cc1	ZINC000819057554	FG	On-Demand	Anodyne	HCN1	54	34
O[C@H](CNCC1(N2CCSCC2)CCCCC1)c1ccc(F)cc1	ZINC000819057554	FG	On-Demand	Anodyne	HCN4	51	34
O[C@@H](CNCC1(N2CCSCC2)CCCCC1)c1ccc(F)cc1	ZINC000819057556	FG	On-Demand	Anodyne	HCN1	54	34
O[C@@H](CNCC1(N2CCSCC2)CCCCC1)c1ccc(F)cc1	ZINC000819057556	FG	On-Demand	Anodyne	HCN4	51	34
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819057560	HG	On-Demand	Anodyne	REN	60	40
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@@H]1CC(c2cccnc2)=NO1	ZINC000819057572	HE	On-Demand	Anodyne	NAMPT	29	49
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@H]1CC(c2cccnc2)=NO1	ZINC000819057575	HE	On-Demand	Anodyne	NAMPT	29	49
CCOc1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819057577	CC	On-Demand	Anodyne	LUXR	66	36
CCOc1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819057577	CC	On-Demand	Anodyne	TRAR	88	44
CCOc1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819057577	CC	On-Demand	Anodyne	LASR	57	35
Cc1ccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)c(C)c1	ZINC000819057581	EE	On-Demand	Anodyne	ADRB2	28	46
Cc1ccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)c(C)c1	ZINC000819057581	EE	On-Demand	Anodyne	ADRB1	45	34
Cc1ccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)c(C)c1	ZINC000819057581	EE	On-Demand	Anodyne	VDR	18	41
Cc1ccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)c(C)c1	ZINC000819057582	EE	On-Demand	Anodyne	ADRB2	28	46
Cc1ccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)c(C)c1	ZINC000819057582	EE	On-Demand	Anodyne	ADRB1	45	34
Cc1ccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)c(C)c1	ZINC000819057582	EE	On-Demand	Anodyne	VDR	18	41
Cc1ccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)c(C)c1	ZINC000819057583	EE	On-Demand	Anodyne	ADRB2	28	46
Cc1ccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)c(C)c1	ZINC000819057583	EE	On-Demand	Anodyne	ADRB1	45	34
Cc1ccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)c(C)c1	ZINC000819057583	EE	On-Demand	Anodyne	VDR	18	41
Cc1ccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)c(C)c1	ZINC000819057584	EE	On-Demand	Anodyne	ADRB2	28	46
Cc1ccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)c(C)c1	ZINC000819057584	EE	On-Demand	Anodyne	ADRB1	45	34
Cc1ccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)c(C)c1	ZINC000819057584	EE	On-Demand	Anodyne	VDR	18	41
O=C(NCCN1C(=O)S/C(=C\c2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819057587	FG	On-Demand	Anodyne	AKR1B1	60	49
O=C(NCCN1C(=O)S/C(=C\c2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819057587	FG	On-Demand	Anodyne	ENPP2	36	41
O=C(NCCN1C(=O)S/C(=C/c2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819057588	FG	On-Demand	Anodyne	AKR1B1	60	49
O=C(NCCN1C(=O)S/C(=C/c2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819057588	FG	On-Demand	Anodyne	ENPP2	36	41
C=C(C)C(C)(C)C(=O)NCCN1C(=O)S/C(=C\c2ccccc2F)C1=O	ZINC000819057602	GH	On-Demand	Mild	AKR1B1	40	37
C=C(C)C(C)(C)C(=O)NCCN1C(=O)S/C(=C/c2ccccc2F)C1=O	ZINC000819057603	GH	On-Demand	Mild	AKR1B1	40	37
O[C@H](CNCC1(N2CCSCC2)CCCCC1)c1ccc(F)c(F)c1	ZINC000819057606	FG	On-Demand	Anodyne	HCN1	40	31
O[C@@H](CNCC1(N2CCSCC2)CCCCC1)c1ccc(F)c(F)c1	ZINC000819057607	FG	On-Demand	Anodyne	HCN1	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCNC(=O)c1ccc(Cl)cc1)C2	ZINC000819057608	GE	On-Demand	Anodyne	CACNA1I	45	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCNC(=O)c1ccc(Cl)cc1)C2	ZINC000819057609	GE	On-Demand	Anodyne	CACNA1I	45	32
Cc1ccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057610	DD	On-Demand	Anodyne	ADRB2	56	52
Cc1ccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057610	DD	On-Demand	Anodyne	ADRB1	79	47
Cc1ccc(OC[C@@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057610	DD	On-Demand	Anodyne	ADRB3	49	47
Cc1ccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057611	DD	On-Demand	Anodyne	ADRB2	56	52
Cc1ccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057611	DD	On-Demand	Anodyne	ADRB1	79	47
Cc1ccc(OC[C@@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057611	DD	On-Demand	Anodyne	ADRB3	49	47
Cc1ccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057612	DD	On-Demand	Anodyne	ADRB2	56	52
Cc1ccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057612	DD	On-Demand	Anodyne	ADRB1	79	47
Cc1ccc(OC[C@H](O)CNCC[S@@](=O)C(C)(C)C)cc1	ZINC000819057612	DD	On-Demand	Anodyne	ADRB3	49	47
Cc1ccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057613	DD	On-Demand	Anodyne	ADRB2	56	52
Cc1ccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057613	DD	On-Demand	Anodyne	ADRB1	79	47
Cc1ccc(OC[C@H](O)CNCC[S@](=O)C(C)(C)C)cc1	ZINC000819057613	DD	On-Demand	Anodyne	ADRB3	49	47
COCCNC(=O)c1ccccc1NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819057619	GG	On-Demand	Anodyne	HCAR2	35	47
COCCNC(=O)c1ccccc1NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819057619	GG	On-Demand	Anodyne	CRTM	41	35
COc1ccc(C(=O)N2CCN(C(=O)C(F)=C3CCC3)CC2)cc1OC	ZINC000819057622	FE	On-Demand	Anodyne	L3MBTL3	40	35
COc1ccc(C(=O)N2CCN(C(=O)C(F)=C3CCC3)CC2)cc1OC	ZINC000819057622	FE	On-Demand	Anodyne	HPGD	35	40
O[C@@H](CNCCc1ccc(F)cc1F)c1ccc(F)c(F)c1	ZINC000819057647	DG	On-Demand	Anodyne	ADRB2	32	46
O[C@@H](CNCCc1ccc(F)cc1F)c1ccc(F)c(F)c1	ZINC000819057647	DG	On-Demand	Anodyne	ADRB3	48	40
O[C@H](CNCCc1ccc(F)cc1F)c1ccc(F)c(F)c1	ZINC000819057648	DG	On-Demand	Anodyne	ADRB2	32	46
O[C@H](CNCCc1ccc(F)cc1F)c1ccc(F)c(F)c1	ZINC000819057648	DG	On-Demand	Anodyne	ADRB3	48	40
Cc1oc(-c2cccs2)nc1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819057649	HJ	On-Demand	Anodyne	GPR142	47	32
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cccc(Cl)c1[N+](=O)[O-]	ZINC000819057650	HG	On-Demand	Bother	NR2E3	45	34
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cccc(Cl)c1O	ZINC000819057652	GG	On-Demand	Anodyne	TYK2	54	37
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cccc(Cl)c1O	ZINC000819057652	GG	On-Demand	Anodyne	NR2E3	66	39
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cccc(Cl)c1O	ZINC000819057652	GG	On-Demand	Anodyne	SMO	16	41
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cccc(Cl)c1O	ZINC000819057652	GG	On-Demand	Anodyne	KCNK3	47	38
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1cccc(Cl)c1O	ZINC000819057652	GG	On-Demand	Anodyne	KCNK9	42	33
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccnnc1	ZINC000819057656	ED	On-Demand	Anodyne	NAMPT	20	44
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccnnc1	ZINC000819057656	ED	On-Demand	Anodyne	KCNK3	71	40
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(N2CCOC2=O)cc1	ZINC000819057678	IF	On-Demand	Anodyne	KCNK3	62	38
O=Cc1cc(C(=O)Nc2cccc(S(=O)(=O)C3CCOCC3)c2)cs1	ZINC000819057684	GF	On-Demand	Anodyne	KCNK3	51	35
COc1ccccc1/C(C)=C/C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819057691	HH	On-Demand	Anodyne	KCNK3	41	42
COc1ccccc1/C(C)=C/C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819057691	HH	On-Demand	Anodyne	KCNK9	36	42
COc1ccccc1/C(C)=C\C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819057692	HH	On-Demand	Anodyne	KCNK3	41	42
COc1ccccc1/C(C)=C\C(=O)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819057692	HH	On-Demand	Anodyne	KCNK9	36	42
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)NCCc2cnc(SC3CCCC3)nc2)C1	ZINC000819057702	IH	On-Demand	Anodyne	GPR119	40	38
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)NCCc2cnc(SC3CCCC3)nc2)C1	ZINC000819057703	IH	On-Demand	Anodyne	GPR119	40	38
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1scnc1Cl	ZINC000819057704	GG	On-Demand	Anodyne	TYK2	49	35
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1scnc1Cl	ZINC000819057704	GG	On-Demand	Anodyne	GCK	18	40
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)C(F)(F)c1nccs1	ZINC000819057706	HF	On-Demand	Anodyne	GCK	15	44
O=C1OCC[C@@H]1NS(=O)(=O)c1cccc(Cl)c1	ZINC000819057745	CC	On-Demand	Anodyne	F10	21	42
O=C1OCC[C@@H]1NS(=O)(=O)c1cccc(Cl)c1	ZINC000819057745	CC	On-Demand	Anodyne	LUXR	67	39
O=C1OCC[C@@H]1NS(=O)(=O)c1cccc(Cl)c1	ZINC000819057745	CC	On-Demand	Anodyne	TRAR	76	38
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@@H](F)CC1CCCCC1	ZINC000819057755	GH	On-Demand	Anodyne	GCK	31	43
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)[C@H](F)CC1CCCCC1	ZINC000819057756	GH	On-Demand	Anodyne	GCK	31	43
O=C1OCC[C@@H]1NS(=O)(=O)c1cccc(F)c1	ZINC000819057766	CC	On-Demand	Anodyne	LUXR	68	37
O=C1OCC[C@@H]1NS(=O)(=O)c1cccc(F)c1	ZINC000819057766	CC	On-Demand	Anodyne	TRAR	76	36
COc1cccc([C@H](O)C(=O)NCCc2cnc(SC3CCCC3)nc2)c1	ZINC000819057779	GF	On-Demand	Anodyne	MTNR1A	43	37
O=C(/C=C/c1ccc(Cl)cc1)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819057780	HH	On-Demand	Anodyne	HDAC1	15	42
O=C(/C=C\c1ccc(Cl)cc1)Nc1cccc(S(=O)(=O)C2CCOCC2)c1	ZINC000819057781	HH	On-Demand	Anodyne	HDAC1	15	42
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(N2CCOCC2)nc1	ZINC000819057782	IE	On-Demand	Anodyne	MAPK14	15	41
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(N2CCOCC2)nc1	ZINC000819057782	IE	On-Demand	Anodyne	TAAR1	31	40
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(N2CCOCC2)nc1	ZINC000819057782	IE	On-Demand	Anodyne	DGAT1	40	46
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(N2CCOCC2)nc1	ZINC000819057782	IE	On-Demand	Anodyne	HPGDS	18	46
O=C(Nc1cccc(S(=O)(=O)C2CCOCC2)c1)c1ccc(N2CCOCC2)nc1	ZINC000819057782	IE	On-Demand	Anodyne	NAMPT	21	41
Cn1c(=O)c2sccc2n2c(CN3CC[C@@H](C(=O)O)C3)nnc12	ZINC000819057787	EC	On-Demand	Anodyne	SLC6A1	130	40
Cn1c(=O)c2sccc2n2c(CN3CC[C@H](C(=O)O)C3)nnc12	ZINC000819057788	EC	On-Demand	Anodyne	SLC6A1	130	40
Cn1c(-c2ccccc2F)nn(CN2CC[C@H](C(=O)O)C2)c1=S	ZINC000819057789	EE	On-Demand	Anodyne	SLC6A1	169	46
Cn1c(-c2ccccc2F)nn(CN2CC[C@@H](C(=O)O)C2)c1=S	ZINC000819057790	EE	On-Demand	Anodyne	SLC6A1	169	46
Cn1c(=O)nc(O)c2nc(CCC(=O)N3CCC[C@@H]3C(=O)O)[nH]c21	ZINC000819057791	EB	On-Demand	Anodyne	ACE	26	43
Cn1c(=O)nc(O)c2nc(CCC(=O)N3CCC[C@H]3C(=O)O)[nH]c21	ZINC000819057792	EB	On-Demand	Anodyne	ACE	26	43
Cn1c(-c2ccccc2F)nn(CN2CCC[C@H](CC(=O)O)C2)c1=S	ZINC000819057802	FF	On-Demand	Anodyne	SLC6A1	121	39
Cn1c(-c2ccccc2F)nn(CN2CCC[C@@H](CC(=O)O)C2)c1=S	ZINC000819057803	FF	On-Demand	Anodyne	SLC6A1	121	39
Cn1c(-c2cccc(Cl)c2)nn(CN2CCC(C(=O)O)CC2)c1=S	ZINC000819057806	FG	On-Demand	Anodyne	SLC6A1	58	38
Cn1c(=O)c(C(=O)CN2CC[C@@H](C(=O)O)C2)c(N)n(Cc2ccccc2)c1=O	ZINC000819057810	GB	On-Demand	Anodyne	ACHE	25	41
Cn1c(=O)c(C(=O)CN2CC[C@@H](C(=O)O)C2)c(N)n(Cc2ccccc2)c1=O	ZINC000819057810	GB	On-Demand	Anodyne	SLC6A1	117	36
Cn1c(=O)c(C(=O)CN2CC[C@@H](C(=O)O)C2)c(N)n(Cc2ccccc2)c1=O	ZINC000819057810	GB	On-Demand	Anodyne	CYP2J2	47	33
Cn1c(=O)c(C(=O)CN2CC[C@H](C(=O)O)C2)c(N)n(Cc2ccccc2)c1=O	ZINC000819057811	GB	On-Demand	Anodyne	ACHE	25	41
Cn1c(=O)c(C(=O)CN2CC[C@H](C(=O)O)C2)c(N)n(Cc2ccccc2)c1=O	ZINC000819057811	GB	On-Demand	Anodyne	SLC6A1	117	36
Cn1c(=O)c(C(=O)CN2CC[C@H](C(=O)O)C2)c(N)n(Cc2ccccc2)c1=O	ZINC000819057811	GB	On-Demand	Anodyne	CYP2J2	47	33
Cn1c(-c2ccncc2)nn(CN2CC[C@@H](C(=O)O)C2)c1=S	ZINC000819057813	DD	On-Demand	Anodyne	SLC6A1	128	37
Cn1c(-c2ccncc2)nn(CN2CC[C@H](C(=O)O)C2)c1=S	ZINC000819057814	DD	On-Demand	Anodyne	SLC6A1	128	37
Cn1c(=O)n(CN2CCC[C@H](CC(=O)O)C2)c2ccccc21	ZINC000819057816	DD	On-Demand	Anodyne	SLC6A1	106	36
Cn1c(=O)n(CN2CCC[C@H](CC(=O)O)C2)c2ccccc21	ZINC000819057816	DD	On-Demand	Anodyne	SIGMAR1	15	42
Cn1c(=O)n(CN2CCC[C@@H](CC(=O)O)C2)c2ccccc21	ZINC000819057817	DD	On-Demand	Anodyne	SLC6A1	106	36
Cn1c(=O)n(CN2CCC[C@@H](CC(=O)O)C2)c2ccccc21	ZINC000819057817	DD	On-Demand	Anodyne	SIGMAR1	15	42
Cn1c(-c2ccccn2)nn(CN2CC[C@H](C(=O)O)C2)c1=S	ZINC000819057821	DD	On-Demand	Anodyne	SLC6A1	150	39
Cn1c(-c2ccccn2)nn(CN2CC[C@@H](C(=O)O)C2)c1=S	ZINC000819057822	DD	On-Demand	Anodyne	SLC6A1	150	39
Cn1c(=O)n(CN2CC[C@H](C(=O)O)C2)c2ccccc21	ZINC000819057823	CC	On-Demand	Anodyne	SLC6A1	167	43
Cn1c(=O)n(CN2CC[C@H](C(=O)O)C2)c2ccccc21	ZINC000819057823	CC	On-Demand	Anodyne	OPRL1	22	40
Cn1c(=O)n(CN2CC[C@H](C(=O)O)C2)c2ccccc21	ZINC000819057823	CC	On-Demand	Anodyne	CYP2J2	46	34
Cn1c(=O)n(CN2CC[C@@H](C(=O)O)C2)c2ccccc21	ZINC000819057824	CC	On-Demand	Anodyne	SLC6A1	167	43
Cn1c(=O)n(CN2CC[C@@H](C(=O)O)C2)c2ccccc21	ZINC000819057824	CC	On-Demand	Anodyne	OPRL1	22	40
Cn1c(=O)n(CN2CC[C@@H](C(=O)O)C2)c2ccccc21	ZINC000819057824	CC	On-Demand	Anodyne	CYP2J2	46	34
Cn1c(-c2ccccn2)nn(CN2CCC[C@H](CC(=O)O)C2)c1=S	ZINC000819057825	EE	On-Demand	Anodyne	SLC6A1	78	33
Cn1c(-c2ccccn2)nn(CN2CCC[C@@H](CC(=O)O)C2)c1=S	ZINC000819057826	EE	On-Demand	Anodyne	SLC6A1	78	33
Cn1c(-c2cnccn2)nn(CN2CC[C@@H](C(=O)O)C2)c1=S	ZINC000819057841	DC	On-Demand	Anodyne	SLC6A1	83	33
Cn1c(-c2cnccn2)nn(CN2CC[C@H](C(=O)O)C2)c1=S	ZINC000819057842	DC	On-Demand	Anodyne	SLC6A1	83	33
Cn1c(-c2ccc(Cl)cc2)nnc1S(=O)(=O)Cc1ccc(C(=O)O)cc1	ZINC000819057847	GF	On-Demand	Anodyne	HSD11B1	15	41
Cn1c(-c2ccco2)nn(CN2CCC[C@H](CC(=O)O)C2)c1=S	ZINC000819057859	EE	On-Demand	Anodyne	SLC6A1	44	32
Cn1c(-c2ccco2)nn(CN2CCC[C@@H](CC(=O)O)C2)c1=S	ZINC000819057860	EE	On-Demand	Anodyne	SLC6A1	44	32
Cn1c(-c2ccccc2)nn(CN2CC[C@@H](C(=O)O)C2)c1=S	ZINC000819057863	DD	On-Demand	Anodyne	SLC6A1	164	42
Cn1c(-c2ccccc2)nn(CN2CC[C@H](C(=O)O)C2)c1=S	ZINC000819057864	DD	On-Demand	Anodyne	SLC6A1	164	42
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NCc3ccc(C(=O)O)cc3)ccc21	ZINC000819057868	GC	On-Demand	Anodyne	PRNP	40	35
Cn1c(=O)n(C)c2cc(NC(=O)C(=O)NCc3ccc(C(=O)O)cc3)ccc21	ZINC000819057868	GC	On-Demand	Anodyne	PTPN11	49	32
Cn1c(-c2cccc(Cl)c2)nn(CN2CC[C@@H](C(=O)O)C2)c1=S	ZINC000819057879	FF	On-Demand	Anodyne	SLC6A1	145	42
Cn1c(-c2cccc(Cl)c2)nn(CN2CC[C@H](C(=O)O)C2)c1=S	ZINC000819057880	FF	On-Demand	Anodyne	SLC6A1	145	42
Cn1c(-c2ccco2)nn(CN2CC[C@@H](C(=O)O)C2)c1=S	ZINC000819057882	DD	On-Demand	Anodyne	SLC6A1	145	38
Cn1c(-c2ccco2)nn(CN2CC[C@H](C(=O)O)C2)c1=S	ZINC000819057883	DD	On-Demand	Anodyne	SLC6A1	145	38
Cn1c(-c2ccccc2)nn(CN2CCC[C@H](CC(=O)O)C2)c1=S	ZINC000819057889	EF	On-Demand	Anodyne	SLC6A1	103	36
Cn1c(-c2ccccc2)nn(CN2CCC[C@@H](CC(=O)O)C2)c1=S	ZINC000819057890	EF	On-Demand	Anodyne	SLC6A1	103	36
Cn1c(=O)n(C)c2cc(S(=O)(=O)Nc3ccccc3CC(=O)O)ccc21	ZINC000819057891	GD	On-Demand	Anodyne	PRTN3	53	35
Cn1c(=O)n(C)c2cc(S(=O)(=O)Nc3ccccc3CC(=O)O)ccc21	ZINC000819057891	GD	On-Demand	Anodyne	PTGDR2	17	40
Cn1c(C(=O)NC2(C(=O)O)CCCCC2)cc2c(=O)n3ccccc3nc21	ZINC000819057899	FD	On-Demand	Anodyne	NTSR2	18	41
Cn1c(C(=O)NC2(C(=O)O)CCCCC2)cc2c(=O)n3ccccc3nc21	ZINC000819057899	FD	On-Demand	Anodyne	POLR1A	76	37
Cn1c(-c2cccnc2)nn(CN2CC[C@@H](C(=O)O)C2)c1=S	ZINC000819057903	DD	On-Demand	Anodyne	SLC6A1	124	37
Cn1c(-c2cccnc2)nn(CN2CC[C@H](C(=O)O)C2)c1=S	ZINC000819057904	DD	On-Demand	Anodyne	SLC6A1	124	37
Cn1c(=S)n(CN2CC[C@H](C(=O)O)C2)c2ccccc21	ZINC000819057913	CE	On-Demand	Anodyne	SLC6A1	177	44
Cn1c(=S)n(CN2CC[C@H](C(=O)O)C2)c2ccccc21	ZINC000819057913	CE	On-Demand	Anodyne	CYP2J2	44	31
Cn1c(=S)n(CN2CC[C@@H](C(=O)O)C2)c2ccccc21	ZINC000819057914	CE	On-Demand	Anodyne	SLC6A1	177	44
Cn1c(=S)n(CN2CC[C@@H](C(=O)O)C2)c2ccccc21	ZINC000819057914	CE	On-Demand	Anodyne	CYP2J2	44	31
Cn1c(=O)oc2ccc(NCc3ccc(C(=O)O)cc3)cc21	ZINC000819057916	CE	On-Demand	Anodyne	UL80	19	41
Cn1c(=O)n(C)c2cc(NC(=O)Nc3ccccc3CC(=O)O)ccc21	ZINC000819057919	FE	On-Demand	Anodyne	LPL	51	35
Cn1c(=O)n(C)c2cc(NC(=O)Nc3ccccc3CC(=O)O)ccc21	ZINC000819057919	FE	On-Demand	Anodyne	P2RY1	47	35
Cn1c(=O)n(C)c2cc(NC(=O)Nc3ccccc3CC(=O)O)ccc21	ZINC000819057919	FE	On-Demand	Anodyne	CCR3	18	41
Cn1c(-c2ccc(Cl)cc2)nn(CN2CC[C@@H](C(=O)O)C2)c1=S	ZINC000819057920	FF	On-Demand	Anodyne	SLC6A1	141	40
Cn1c(-c2ccc(Cl)cc2)nn(CN2CC[C@H](C(=O)O)C2)c1=S	ZINC000819057921	FF	On-Demand	Anodyne	SLC6A1	141	40
Cn1c(=O)c2sccc2n2c(CN3CCC[C@@H](CC(=O)O)C3)nnc12	ZINC000819057922	FD	On-Demand	Anodyne	SLC6A1	52	35
Cn1c(=O)c2sccc2n2c(CN3CCC[C@H](CC(=O)O)C3)nnc12	ZINC000819057923	FD	On-Demand	Anodyne	SLC6A1	52	35
Cn1c(=O)n(CN2CC[C@@H](C(=O)O)C2)c2cnccc21	ZINC000819057924	CC	On-Demand	Anodyne	SLC6A1	111	35
Cn1c(=O)n(CN2CC[C@H](C(=O)O)C2)c2cnccc21	ZINC000819057925	CC	On-Demand	Anodyne	SLC6A1	111	35
Cn1c(-c2ccccc2Cl)nn(CN2CC[C@H](C(=O)O)C2)c1=S	ZINC000819057926	FF	On-Demand	Anodyne	SLC6A1	161	45
Cn1c(-c2ccccc2Cl)nn(CN2CC[C@H](C(=O)O)C2)c1=S	ZINC000819057926	FF	On-Demand	Anodyne	S1PR5	15	40
Cn1c(-c2ccccc2Cl)nn(CN2CC[C@@H](C(=O)O)C2)c1=S	ZINC000819057927	FF	On-Demand	Anodyne	SLC6A1	161	45
Cn1c(-c2ccccc2Cl)nn(CN2CC[C@@H](C(=O)O)C2)c1=S	ZINC000819057927	FF	On-Demand	Anodyne	S1PR5	15	40
Cn1c(-c2ccccn2)nn(CN2CCC(C(=O)O)CC2)c1=S	ZINC000819057932	ED	On-Demand	Anodyne	SLC6A1	90	34
Cn1c(-c2ccc(F)cc2)nn(CN2CCC[C@H](CC(=O)O)C2)c1=S	ZINC000819057933	FF	On-Demand	Anodyne	SLC6A1	61	35
Cn1c(-c2ccc(F)cc2)nn(CN2CCC[C@H](CC(=O)O)C2)c1=S	ZINC000819057933	FF	On-Demand	Anodyne	CCR3	93	37
Cn1c(-c2ccc(F)cc2)nn(CN2CCC[C@@H](CC(=O)O)C2)c1=S	ZINC000819057934	FF	On-Demand	Anodyne	SLC6A1	61	35
Cn1c(-c2ccc(F)cc2)nn(CN2CCC[C@@H](CC(=O)O)C2)c1=S	ZINC000819057934	FF	On-Demand	Anodyne	CCR3	93	37
Cn1c(-c2ccc(F)cc2)nn(CN2CC[C@@H](C(=O)O)C2)c1=S	ZINC000819057937	EE	On-Demand	Anodyne	SLC6A1	148	40
Cn1c(-c2ccc(F)cc2)nn(CN2CC[C@H](C(=O)O)C2)c1=S	ZINC000819057938	EE	On-Demand	Anodyne	SLC6A1	148	40
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819057942	GD	On-Demand	Anodyne	CTSD	87	49
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819057942	GD	On-Demand	Anodyne	PGC	61	44
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819057942	GD	On-Demand	Anodyne	CTSB	41	37
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819057942	GD	On-Demand	Anodyne	PAPA1_CARPA	55	45
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819057942	GD	On-Demand	Anodyne	CTSK	24	52
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819057942	GD	On-Demand	Anodyne	CTSL	21	45
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819057942	GD	On-Demand	Anodyne	PGA	60	44
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819057942	GD	On-Demand	Anodyne	BACE2	58	40
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819057942	GD	On-Demand	Anodyne	TACR3	17	43
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819057942	GD	On-Demand	Anodyne	CAPNS1	42	32
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819057942	GD	On-Demand	Anodyne	REN	84	54
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819057942	GD	On-Demand	Anodyne	REN1	40	49
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819057942	GD	On-Demand	Anodyne	CAPN1	30	41
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819057942	GD	On-Demand	Anodyne	BACE1	71	46
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819057942	GD	On-Demand	Anodyne	FPR1	58	46
C[C@H](CNC[C@H](O)c1ccc(F)cc1)CN1CCN(C)CC1	ZINC000819057967	DD	On-Demand	Anodyne	SLC6A3	28	47
C[C@H](CNC[C@@H](O)c1ccc(F)cc1)CN1CCN(C)CC1	ZINC000819057968	DD	On-Demand	Anodyne	SLC6A3	28	47
C[C@@H](CNC[C@@H](O)c1ccc(F)cc1)CN1CCN(C)CC1	ZINC000819057969	DD	On-Demand	Anodyne	SLC6A3	28	47
C[C@@H](CNC[C@H](O)c1ccc(F)cc1)CN1CCN(C)CC1	ZINC000819057970	DD	On-Demand	Anodyne	SLC6A3	28	47
C[C@@](O)(CNCCCCn1ccnc1)c1ccc(Br)cc1Cl	ZINC000819057977	GH	On-Demand	Anodyne	TBXAS1	49	48
C[C@@](O)(CNCCCCn1ccnc1)c1ccc(Br)cc1Cl	ZINC000819057977	GH	On-Demand	Anodyne	HMOX2	49	41
O=C(NCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819058007	ED	On-Demand	Anodyne	HTR1A	59	57
O=C(NCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819058007	ED	On-Demand	Anodyne	DRD2	58	49
O=C(NCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819058007	ED	On-Demand	Anodyne	DRD4	33	48
O=C(NCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819058007	ED	On-Demand	Anodyne	ADRA1D	23	42
O=C(NCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819058007	ED	On-Demand	Anodyne	HTR2A	46	48
O=C(NCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819058007	ED	On-Demand	Anodyne	HTR2C	29	48
O=C(NCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819058007	ED	On-Demand	Anodyne	ADRA1A	26	42
O=C(NCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819058007	ED	On-Demand	Anodyne	DRD3	70	50
O=C(NCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819058007	ED	On-Demand	Anodyne	HTR7	41	41
O=C(NCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819058007	ED	On-Demand	Anodyne	ATP6V0A1	15	45
O[C@H](CNCCCCn1ccnc1)c1cc2ccccc2o1	ZINC000819058015	CF	On-Demand	Anodyne	CYP19A1	18	40
O[C@H](CNCCCCn1ccnc1)c1cc2ccccc2o1	ZINC000819058015	CF	On-Demand	Anodyne	CYP11B1	22	46
O[C@H](CNCCCCn1ccnc1)c1cc2ccccc2o1	ZINC000819058015	CF	On-Demand	Anodyne	TBXAS1	45	59
O[C@H](CNCCCCn1ccnc1)c1cc2ccccc2o1	ZINC000819058015	CF	On-Demand	Anodyne	HMOX2	50	38
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCn2ccnc2)c1	ZINC000819058020	DD	On-Demand	Bother	ADRB2	21	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCn2ccnc2)c1	ZINC000819058020	DD	On-Demand	Bother	ADRB3	67	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCn2ccnc2)c1	ZINC000819058020	DD	On-Demand	Bother	TBXAS1	46	45
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCn2ccnc2)c1	ZINC000819058020	DD	On-Demand	Bother	HMOX2	50	38
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCn2ccnc2)c1	ZINC000819058020	DD	On-Demand	Bother	QPCT	34	40
O=[N+]([O-])c1cccc([C@H](O)CNCCCCn2ccnc2)c1	ZINC000819058021	DD	On-Demand	Bother	ADRB2	21	40
O=[N+]([O-])c1cccc([C@H](O)CNCCCCn2ccnc2)c1	ZINC000819058021	DD	On-Demand	Bother	ADRB3	67	40
O=[N+]([O-])c1cccc([C@H](O)CNCCCCn2ccnc2)c1	ZINC000819058021	DD	On-Demand	Bother	TBXAS1	46	45
O=[N+]([O-])c1cccc([C@H](O)CNCCCCn2ccnc2)c1	ZINC000819058021	DD	On-Demand	Bother	HMOX2	50	38
O=[N+]([O-])c1cccc([C@H](O)CNCCCCn2ccnc2)c1	ZINC000819058021	DD	On-Demand	Bother	QPCT	34	40
O[C@@H](CNCCCCn1ccnc1)c1cccc(Cl)c1	ZINC000819058047	CF	On-Demand	Anodyne	ADRB2	45	41
O[C@@H](CNCCCCn1ccnc1)c1cccc(Cl)c1	ZINC000819058047	CF	On-Demand	Anodyne	ADRB1	59	48
O[C@@H](CNCCCCn1ccnc1)c1cccc(Cl)c1	ZINC000819058047	CF	On-Demand	Anodyne	CYP11B1	22	45
O[C@@H](CNCCCCn1ccnc1)c1cccc(Cl)c1	ZINC000819058047	CF	On-Demand	Anodyne	ADRB3	95	48
O[C@@H](CNCCCCn1ccnc1)c1cccc(Cl)c1	ZINC000819058047	CF	On-Demand	Anodyne	TBXAS1	57	48
O[C@@H](CNCCCCn1ccnc1)c1cccc(Cl)c1	ZINC000819058047	CF	On-Demand	Anodyne	HMOX2	59	44
O[C@@H](CNCCCCn1ccnc1)c1cccc(Cl)c1	ZINC000819058047	CF	On-Demand	Anodyne	QPCT	41	38
O[C@H](CNCCCCn1ccnc1)c1cccc(Cl)c1	ZINC000819058048	CF	On-Demand	Anodyne	ADRB2	45	41
O[C@H](CNCCCCn1ccnc1)c1cccc(Cl)c1	ZINC000819058048	CF	On-Demand	Anodyne	ADRB1	59	48
O[C@H](CNCCCCn1ccnc1)c1cccc(Cl)c1	ZINC000819058048	CF	On-Demand	Anodyne	CYP11B1	22	45
O[C@H](CNCCCCn1ccnc1)c1cccc(Cl)c1	ZINC000819058048	CF	On-Demand	Anodyne	ADRB3	95	48
O[C@H](CNCCCCn1ccnc1)c1cccc(Cl)c1	ZINC000819058048	CF	On-Demand	Anodyne	TBXAS1	57	48
O[C@H](CNCCCCn1ccnc1)c1cccc(Cl)c1	ZINC000819058048	CF	On-Demand	Anodyne	HMOX2	59	44
O[C@H](CNCCCCn1ccnc1)c1cccc(Cl)c1	ZINC000819058048	CF	On-Demand	Anodyne	QPCT	41	38
O[C@@H](CNCCCCn1ccnc1)c1ccc(Br)cc1	ZINC000819058063	EF	On-Demand	Anodyne	TBXAS1	52	44
O[C@@H](CNCCCCn1ccnc1)c1ccc(Br)cc1	ZINC000819058063	EF	On-Demand	Anodyne	HMOX1	36	46
O[C@@H](CNCCCCn1ccnc1)c1ccc(Br)cc1	ZINC000819058063	EF	On-Demand	Anodyne	HMOX2	53	41
O[C@@H](CNCCCCn1ccnc1)c1ccc(Br)cc1	ZINC000819058063	EF	On-Demand	Anodyne	QPCT	39	40
O[C@H](CNCCCCn1ccnc1)c1ccc(Br)cc1	ZINC000819058064	EF	On-Demand	Anodyne	TBXAS1	52	44
O[C@H](CNCCCCn1ccnc1)c1ccc(Br)cc1	ZINC000819058064	EF	On-Demand	Anodyne	HMOX1	36	46
O[C@H](CNCCCCn1ccnc1)c1ccc(Br)cc1	ZINC000819058064	EF	On-Demand	Anodyne	HMOX2	53	41
O[C@H](CNCCCCn1ccnc1)c1ccc(Br)cc1	ZINC000819058064	EF	On-Demand	Anodyne	QPCT	39	40
CNC(=O)CCCNC[C@@H](O)c1ccc(F)cc1C	ZINC000819058079	CD	On-Demand	Anodyne	LEF	84	34
CNC(=O)CCCNC[C@H](O)c1ccc(F)cc1C	ZINC000819058080	CD	On-Demand	Anodyne	LEF	84	34
O[C@@H](CNCCCCn1ccnc1)c1cccnc1	ZINC000819058081	CD	On-Demand	Anodyne	ADRB2	28	51
O[C@@H](CNCCCCn1ccnc1)c1cccnc1	ZINC000819058081	CD	On-Demand	Anodyne	ADRB1	35	44
O[C@@H](CNCCCCn1ccnc1)c1cccnc1	ZINC000819058081	CD	On-Demand	Anodyne	CYP11B1	26	41
O[C@@H](CNCCCCn1ccnc1)c1cccnc1	ZINC000819058081	CD	On-Demand	Anodyne	ADRB3	112	51
O[C@@H](CNCCCCn1ccnc1)c1cccnc1	ZINC000819058081	CD	On-Demand	Anodyne	TBXAS1	52	46
O[C@@H](CNCCCCn1ccnc1)c1cccnc1	ZINC000819058081	CD	On-Demand	Anodyne	HMOX1	35	41
O[C@@H](CNCCCCn1ccnc1)c1cccnc1	ZINC000819058081	CD	On-Demand	Anodyne	HMOX2	52	41
O[C@H](CNCCCCn1ccnc1)c1cccnc1	ZINC000819058082	CD	On-Demand	Anodyne	ADRB2	28	51
O[C@H](CNCCCCn1ccnc1)c1cccnc1	ZINC000819058082	CD	On-Demand	Anodyne	ADRB1	35	44
O[C@H](CNCCCCn1ccnc1)c1cccnc1	ZINC000819058082	CD	On-Demand	Anodyne	CYP11B1	26	41
O[C@H](CNCCCCn1ccnc1)c1cccnc1	ZINC000819058082	CD	On-Demand	Anodyne	ADRB3	112	51
O[C@H](CNCCCCn1ccnc1)c1cccnc1	ZINC000819058082	CD	On-Demand	Anodyne	TBXAS1	52	46
O[C@H](CNCCCCn1ccnc1)c1cccnc1	ZINC000819058082	CD	On-Demand	Anodyne	HMOX1	35	41
O[C@H](CNCCCCn1ccnc1)c1cccnc1	ZINC000819058082	CD	On-Demand	Anodyne	HMOX2	52	41
CNC(=O)CCCNC[C@@H](O)c1ccc(C)cc1	ZINC000819058083	CD	On-Demand	Anodyne	ADRB2	28	41
CNC(=O)CCCNC[C@H](O)c1ccc(C)cc1	ZINC000819058084	CD	On-Demand	Anodyne	ADRB2	28	41
C[C@H](CNC[C@H](O)c1ccccc1Cl)CN1CCN(C)CC1	ZINC000819058093	ED	On-Demand	Anodyne	OPRL1	20	40
C[C@@H](CNC[C@H](O)c1ccccc1Cl)CN1CCN(C)CC1	ZINC000819058094	ED	On-Demand	Anodyne	OPRL1	20	40
CNC(=O)CCCNC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819058130	FC	On-Demand	Clean	HTR1A	21	40
CNC(=O)CCCNC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819058130	FC	On-Demand	Clean	DRD4	44	37
CNC(=O)CCCNC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819058130	FC	On-Demand	Clean	HTR2A	15	43
CNC(=O)CCCNC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819058130	FC	On-Demand	Clean	HTR7	32	40
CNC(=O)CCCNC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819058130	FC	On-Demand	Clean	ACOX1	48	33
CNC(=O)CCCNC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819058130	FC	On-Demand	Clean	ABCB1	46	39
CNC(=O)CCCNC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819058131	FC	On-Demand	Clean	HTR1A	21	40
CNC(=O)CCCNC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819058131	FC	On-Demand	Clean	DRD4	44	37
CNC(=O)CCCNC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819058131	FC	On-Demand	Clean	HTR2A	15	43
CNC(=O)CCCNC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819058131	FC	On-Demand	Clean	HTR7	32	40
CNC(=O)CCCNC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819058131	FC	On-Demand	Clean	ACOX1	48	33
CNC(=O)CCCNC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819058131	FC	On-Demand	Clean	ABCB1	46	39
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2ccccc2)CC1	ZINC000819058155	ED	On-Demand	Anodyne	ADRB1	23	41
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2ccccc2)CC1	ZINC000819058155	ED	On-Demand	Anodyne	SLC6A3	17	45
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2ccccc2)CC1	ZINC000819058155	ED	On-Demand	Anodyne	ADRB3	50	41
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)c2ccccc2)CC1	ZINC000819058156	ED	On-Demand	Anodyne	ADRB1	23	41
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)c2ccccc2)CC1	ZINC000819058156	ED	On-Demand	Anodyne	SLC6A3	17	45
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)c2ccccc2)CC1	ZINC000819058156	ED	On-Demand	Anodyne	ADRB3	50	41
O=C(Nc1ccccc1C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819058157	DG	On-Demand	Anodyne	NPSR1	17	48
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819058162	GE	On-Demand	Anodyne	ADRB3	26	41
CC1(C)C[C@@H]1CNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819058169	CG	On-Demand	Anodyne	ENV	42	37
CC1(C)C[C@@H]1CNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819058170	CG	On-Demand	Anodyne	ENV	42	37
O=C(CCNCC1CCN(S(=O)(=O)C(F)F)CC1)Nc1cccnc1	ZINC000819058182	GD	On-Demand	Anodyne	NAMPT	42	40
COc1cccc(C[C@@H](C)NC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058183	FE	On-Demand	Anodyne	PAPA1_CARPA	31	40
COc1cccc(C[C@@H](C)NC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058183	FE	On-Demand	Anodyne	CTSL	15	43
COc1cccc(C[C@@H](C)NC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058183	FE	On-Demand	Anodyne	MTNR1A	44	43
COc1cccc(C[C@@H](C)NC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058183	FE	On-Demand	Anodyne	MTNR1B	49	43
COc1cccc(C[C@@H](C)NC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058183	FE	On-Demand	Anodyne	PDS	42	38
COc1cccc(C[C@H](C)NC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058184	FE	On-Demand	Anodyne	PAPA1_CARPA	31	40
COc1cccc(C[C@H](C)NC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058184	FE	On-Demand	Anodyne	CTSL	15	43
COc1cccc(C[C@H](C)NC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058184	FE	On-Demand	Anodyne	MTNR1A	44	43
COc1cccc(C[C@H](C)NC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058184	FE	On-Demand	Anodyne	MTNR1B	49	43
COc1cccc(C[C@H](C)NC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058184	FE	On-Demand	Anodyne	PDS	42	38
COc1cccc(C[C@@H](C)NC[C@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058185	FE	On-Demand	Anodyne	PAPA1_CARPA	31	40
COc1cccc(C[C@@H](C)NC[C@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058185	FE	On-Demand	Anodyne	CTSL	15	43
COc1cccc(C[C@@H](C)NC[C@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058185	FE	On-Demand	Anodyne	MTNR1A	44	43
COc1cccc(C[C@@H](C)NC[C@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058185	FE	On-Demand	Anodyne	MTNR1B	49	43
COc1cccc(C[C@@H](C)NC[C@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058185	FE	On-Demand	Anodyne	PDS	42	38
COc1cccc(C[C@H](C)NC[C@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058186	FE	On-Demand	Anodyne	PAPA1_CARPA	31	40
COc1cccc(C[C@H](C)NC[C@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058186	FE	On-Demand	Anodyne	CTSL	15	43
COc1cccc(C[C@H](C)NC[C@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058186	FE	On-Demand	Anodyne	MTNR1A	44	43
COc1cccc(C[C@H](C)NC[C@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058186	FE	On-Demand	Anodyne	MTNR1B	49	43
COc1cccc(C[C@H](C)NC[C@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819058186	FE	On-Demand	Anodyne	PDS	42	38
N#CCc1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058193	DF	On-Demand	Mild	ADRB2	52	46
N#CCc1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058193	DF	On-Demand	Mild	ADRB1	79	46
N#CCc1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058193	DF	On-Demand	Mild	ADRB3	46	46
N#CCc1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058194	DF	On-Demand	Mild	ADRB2	52	46
N#CCc1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058194	DF	On-Demand	Mild	ADRB1	79	46
N#CCc1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058194	DF	On-Demand	Mild	ADRB3	46	46
N#CCc1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058195	DF	On-Demand	Mild	ADRB2	52	46
N#CCc1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058195	DF	On-Demand	Mild	ADRB1	79	46
N#CCc1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058195	DF	On-Demand	Mild	ADRB3	46	46
N#CCc1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058196	DF	On-Demand	Mild	ADRB2	52	46
N#CCc1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058196	DF	On-Demand	Mild	ADRB1	79	46
N#CCc1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058196	DF	On-Demand	Mild	ADRB3	46	46
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819058215	CG	On-Demand	Anodyne	ADRB2	56	55
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819058215	CG	On-Demand	Anodyne	ADRB1	39	51
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819058215	CG	On-Demand	Anodyne	ADRB3	63	49
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819058215	CG	On-Demand	Anodyne	AOC3	15	47
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819058216	CG	On-Demand	Anodyne	ADRB2	56	55
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819058216	CG	On-Demand	Anodyne	ADRB1	39	51
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819058216	CG	On-Demand	Anodyne	ADRB3	63	49
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819058216	CG	On-Demand	Anodyne	AOC3	15	47
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819058217	CG	On-Demand	Anodyne	ADRB2	56	55
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819058217	CG	On-Demand	Anodyne	ADRB1	39	51
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819058217	CG	On-Demand	Anodyne	ADRB3	63	49
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819058217	CG	On-Demand	Anodyne	AOC3	15	47
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819058218	CG	On-Demand	Anodyne	ADRB2	56	55
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819058218	CG	On-Demand	Anodyne	ADRB1	39	51
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819058218	CG	On-Demand	Anodyne	ADRB3	63	49
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819058218	CG	On-Demand	Anodyne	AOC3	15	47
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)c2ccc(F)cn2)CC1	ZINC000819058219	FD	On-Demand	Anodyne	ADAMTS4	68	32
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2ccc(F)cn2)CC1	ZINC000819058220	FD	On-Demand	Anodyne	ADAMTS4	68	32
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccccc1C(=O)N1CCCC1	ZINC000819058226	FF	On-Demand	Anodyne	NPSR1	15	41
O[C@@H](CNCc1ccccc1CN1CCCCCC1)c1cccnc1	ZINC000819058229	EG	On-Demand	Anodyne	ADRB3	89	48
O[C@H](CNCc1ccccc1CN1CCCCCC1)c1cccnc1	ZINC000819058230	EG	On-Demand	Anodyne	ADRB3	89	48
CN(C)c1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819058237	FG	On-Demand	Mild	PAPA1_CARPA	49	46
CN(C)c1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819058237	FG	On-Demand	Mild	CTSK	21	44
CN(C)c1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819058238	FG	On-Demand	Mild	PAPA1_CARPA	49	46
CN(C)c1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819058238	FG	On-Demand	Mild	CTSK	21	44
CNC(=O)CCCNC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819058242	CD	On-Demand	Anodyne	LEF	47	32
CNC(=O)CCCNC[C@H](O)c1ccc(F)cc1Cl	ZINC000819058243	CD	On-Demand	Anodyne	LEF	47	32
CNC(=O)CCCNC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819058248	ED	On-Demand	Anodyne	LEF	47	32
CNC(=O)CCCNC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819058249	ED	On-Demand	Anodyne	LEF	47	32
CON(C)C(=O)CCNCCCCn1ccnc1	ZINC000819058250	CC	On-Demand	Anodyne	TBXAS1	50	46
CON(C)C(=O)CCNCCCCn1ccnc1	ZINC000819058250	CC	On-Demand	Anodyne	QPCT	37	42
C[C@H](CNC[C@H](O)c1ccc([N+](=O)[O-])cc1)CN1CCN(C)CC1	ZINC000819058253	ED	On-Demand	Bother	KCNJ1	28	49
C[C@H](CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)CN1CCN(C)CC1	ZINC000819058254	ED	On-Demand	Bother	KCNJ1	28	49
C[C@@H](CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)CN1CCN(C)CC1	ZINC000819058255	ED	On-Demand	Bother	KCNJ1	28	49
C[C@@H](CNC[C@H](O)c1ccc([N+](=O)[O-])cc1)CN1CCN(C)CC1	ZINC000819058256	ED	On-Demand	Bother	KCNJ1	28	49
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C(=O)N(C)C	ZINC000819058332	CD	On-Demand	Anodyne	ADRB1	44	54
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C(=O)N(C)C	ZINC000819058332	CD	On-Demand	Anodyne	ADRB3	68	54
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C(=O)N(C)C	ZINC000819058332	CD	On-Demand	Anodyne	IGF1R	19	40
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N(C)C	ZINC000819058333	CD	On-Demand	Anodyne	ADRB1	44	54
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N(C)C	ZINC000819058333	CD	On-Demand	Anodyne	ADRB3	68	54
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N(C)C	ZINC000819058333	CD	On-Demand	Anodyne	IGF1R	19	40
C[C@H](CNC[C@@H](O)c1cccnc1)CN1CCN(C)CC1	ZINC000819058344	CC	On-Demand	Anodyne	ADRB2	21	42
C[C@H](CNC[C@@H](O)c1cccnc1)CN1CCN(C)CC1	ZINC000819058344	CC	On-Demand	Anodyne	ADRB1	24	42
C[C@H](CNC[C@@H](O)c1cccnc1)CN1CCN(C)CC1	ZINC000819058344	CC	On-Demand	Anodyne	ADRB3	87	46
C[C@@H](CNC[C@@H](O)c1cccnc1)CN1CCN(C)CC1	ZINC000819058345	CC	On-Demand	Anodyne	ADRB2	21	42
C[C@@H](CNC[C@@H](O)c1cccnc1)CN1CCN(C)CC1	ZINC000819058345	CC	On-Demand	Anodyne	ADRB1	24	42
C[C@@H](CNC[C@@H](O)c1cccnc1)CN1CCN(C)CC1	ZINC000819058345	CC	On-Demand	Anodyne	ADRB3	87	46
C[C@@H](CNC[C@H](O)c1cccnc1)CN1CCN(C)CC1	ZINC000819058346	CC	On-Demand	Anodyne	ADRB2	21	42
C[C@@H](CNC[C@H](O)c1cccnc1)CN1CCN(C)CC1	ZINC000819058346	CC	On-Demand	Anodyne	ADRB1	24	42
C[C@@H](CNC[C@H](O)c1cccnc1)CN1CCN(C)CC1	ZINC000819058346	CC	On-Demand	Anodyne	ADRB3	87	46
C[C@H](CNC[C@H](O)c1cccnc1)CN1CCN(C)CC1	ZINC000819058347	CC	On-Demand	Anodyne	ADRB2	21	42
C[C@H](CNC[C@H](O)c1cccnc1)CN1CCN(C)CC1	ZINC000819058347	CC	On-Demand	Anodyne	ADRB1	24	42
C[C@H](CNC[C@H](O)c1cccnc1)CN1CCN(C)CC1	ZINC000819058347	CC	On-Demand	Anodyne	ADRB3	87	46
O[C@@H](CNCCCCn1ccnc1)c1ccc(F)cc1Cl	ZINC000819058360	DF	On-Demand	Anodyne	TBXAS1	48	45
O[C@@H](CNCCCCn1ccnc1)c1ccc(F)cc1Cl	ZINC000819058360	DF	On-Demand	Anodyne	HMOX2	50	36
O[C@H](CNCCCCn1ccnc1)c1ccc(F)cc1Cl	ZINC000819058361	DF	On-Demand	Anodyne	TBXAS1	48	45
O[C@H](CNCCCCn1ccnc1)c1ccc(F)cc1Cl	ZINC000819058361	DF	On-Demand	Anodyne	HMOX2	50	36
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058391	EC	On-Demand	Anodyne	HTR1A	38	53
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058391	EC	On-Demand	Anodyne	DRD2	36	46
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058391	EC	On-Demand	Anodyne	DRD4	19	43
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058391	EC	On-Demand	Anodyne	HTR2A	27	42
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058391	EC	On-Demand	Anodyne	HTR2C	19	42
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058391	EC	On-Demand	Anodyne	DRD3	51	40
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058392	EC	On-Demand	Anodyne	HTR1A	38	53
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058392	EC	On-Demand	Anodyne	DRD2	36	46
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058392	EC	On-Demand	Anodyne	DRD4	19	43
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058392	EC	On-Demand	Anodyne	HTR2A	27	42
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058392	EC	On-Demand	Anodyne	HTR2C	19	42
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058392	EC	On-Demand	Anodyne	DRD3	51	40
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058393	EC	On-Demand	Anodyne	HTR1A	38	53
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058393	EC	On-Demand	Anodyne	DRD2	36	46
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058393	EC	On-Demand	Anodyne	DRD4	19	43
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058393	EC	On-Demand	Anodyne	HTR2A	27	42
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058393	EC	On-Demand	Anodyne	HTR2C	19	42
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058393	EC	On-Demand	Anodyne	DRD3	51	40
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058394	EC	On-Demand	Anodyne	HTR1A	38	53
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058394	EC	On-Demand	Anodyne	DRD2	36	46
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058394	EC	On-Demand	Anodyne	DRD4	19	43
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058394	EC	On-Demand	Anodyne	HTR2A	27	42
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058394	EC	On-Demand	Anodyne	HTR2C	19	42
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ncccn2)CC1	ZINC000819058394	EC	On-Demand	Anodyne	DRD3	51	40
O[C@@H](CNCCCCn1ccnc1)c1ccc(OC(F)(F)F)cc1	ZINC000819058426	EF	On-Demand	Anodyne	TBXAS1	44	44
O[C@@H](CNCCCCn1ccnc1)c1ccc(OC(F)(F)F)cc1	ZINC000819058426	EF	On-Demand	Anodyne	HMOX1	28	40
O[C@@H](CNCCCCn1ccnc1)c1ccc(OC(F)(F)F)cc1	ZINC000819058426	EF	On-Demand	Anodyne	HMOX2	49	40
O[C@H](CNCCCCn1ccnc1)c1ccc(OC(F)(F)F)cc1	ZINC000819058427	EF	On-Demand	Anodyne	TBXAS1	44	44
O[C@H](CNCCCCn1ccnc1)c1ccc(OC(F)(F)F)cc1	ZINC000819058427	EF	On-Demand	Anodyne	HMOX1	28	40
O[C@H](CNCCCCn1ccnc1)c1ccc(OC(F)(F)F)cc1	ZINC000819058427	EF	On-Demand	Anodyne	HMOX2	49	40
COC(=O)c1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058429	EF	On-Demand	Anodyne	ADRB2	62	55
COC(=O)c1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058429	EF	On-Demand	Anodyne	ADRB1	93	55
COC(=O)c1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058429	EF	On-Demand	Anodyne	ADRB3	57	55
COC(=O)c1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058429	EF	On-Demand	Anodyne	ABCB1	31	51
COC(=O)c1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058431	EF	On-Demand	Anodyne	ADRB2	62	55
COC(=O)c1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058431	EF	On-Demand	Anodyne	ADRB1	93	55
COC(=O)c1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058431	EF	On-Demand	Anodyne	ADRB3	57	55
COC(=O)c1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058431	EF	On-Demand	Anodyne	ABCB1	31	51
COC(=O)c1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058432	EF	On-Demand	Anodyne	ADRB2	62	55
COC(=O)c1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058432	EF	On-Demand	Anodyne	ADRB1	93	55
COC(=O)c1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058432	EF	On-Demand	Anodyne	ADRB3	57	55
COC(=O)c1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058432	EF	On-Demand	Anodyne	ABCB1	31	51
COC(=O)c1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058433	EF	On-Demand	Anodyne	ADRB2	62	55
COC(=O)c1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058433	EF	On-Demand	Anodyne	ADRB1	93	55
COC(=O)c1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058433	EF	On-Demand	Anodyne	ADRB3	57	55
COC(=O)c1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058433	EF	On-Demand	Anodyne	ABCB1	31	51
CN(C)c1ccc(NC(=O)CCNC/C=C/c2ccccc2)cc1	ZINC000819058434	DG	On-Demand	Anodyne	HDAC10	18	49
CN(C)c1ccc(NC(=O)CCNC/C=C/c2ccccc2)cc1	ZINC000819058434	DG	On-Demand	Anodyne	HDAC2	17	49
CN(C)c1ccc(NC(=O)CCNC/C=C/c2ccccc2)cc1	ZINC000819058434	DG	On-Demand	Anodyne	HDAC3	17	42
CN(C)c1ccc(NC(=O)CCNC/C=C/c2ccccc2)cc1	ZINC000819058434	DG	On-Demand	Anodyne	HDAC6	15	49
CN(C)c1ccc(NC(=O)CCNC/C=C\c2ccccc2)cc1	ZINC000819058436	DG	On-Demand	Anodyne	HDAC10	18	49
CN(C)c1ccc(NC(=O)CCNC/C=C\c2ccccc2)cc1	ZINC000819058436	DG	On-Demand	Anodyne	HDAC2	17	49
CN(C)c1ccc(NC(=O)CCNC/C=C\c2ccccc2)cc1	ZINC000819058436	DG	On-Demand	Anodyne	HDAC3	17	42
CN(C)c1ccc(NC(=O)CCNC/C=C\c2ccccc2)cc1	ZINC000819058436	DG	On-Demand	Anodyne	HDAC6	15	49
CCOc1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058459	EG	On-Demand	Anodyne	ADRB2	58	52
CCOc1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058459	EG	On-Demand	Anodyne	ADRB1	76	44
CCOc1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058459	EG	On-Demand	Anodyne	ADRB3	45	44
CCOc1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058459	EG	On-Demand	Anodyne	ABCB1	15	44
CCOc1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058460	EG	On-Demand	Anodyne	ADRB2	58	52
CCOc1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058460	EG	On-Demand	Anodyne	ADRB1	76	44
CCOc1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058460	EG	On-Demand	Anodyne	ADRB3	45	44
CCOc1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058460	EG	On-Demand	Anodyne	ABCB1	15	44
CCOc1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058461	EG	On-Demand	Anodyne	ADRB2	58	52
CCOc1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058461	EG	On-Demand	Anodyne	ADRB1	76	44
CCOc1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058461	EG	On-Demand	Anodyne	ADRB3	45	44
CCOc1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058461	EG	On-Demand	Anodyne	ABCB1	15	44
CCOc1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058462	EG	On-Demand	Anodyne	ADRB2	58	52
CCOc1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058462	EG	On-Demand	Anodyne	ADRB1	76	44
CCOc1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058462	EG	On-Demand	Anodyne	ADRB3	45	44
CCOc1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058462	EG	On-Demand	Anodyne	ABCB1	15	44
CC(=O)Nc1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058463	EF	On-Demand	Anodyne	ADRB2	61	58
CC(=O)Nc1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058463	EF	On-Demand	Anodyne	ADRB1	98	58
CC(=O)Nc1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058463	EF	On-Demand	Anodyne	GRIN1	26	42
CC(=O)Nc1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058463	EF	On-Demand	Anodyne	ADRB3	60	55
CC(=O)Nc1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058463	EF	On-Demand	Anodyne	ABCB1	27	48
CC(=O)Nc1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058464	EF	On-Demand	Anodyne	ADRB2	61	58
CC(=O)Nc1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058464	EF	On-Demand	Anodyne	ADRB1	98	58
CC(=O)Nc1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058464	EF	On-Demand	Anodyne	GRIN1	26	42
CC(=O)Nc1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058464	EF	On-Demand	Anodyne	ADRB3	60	55
CC(=O)Nc1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819058464	EF	On-Demand	Anodyne	ABCB1	27	48
CC(=O)Nc1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058465	EF	On-Demand	Anodyne	ADRB2	61	58
CC(=O)Nc1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058465	EF	On-Demand	Anodyne	ADRB1	98	58
CC(=O)Nc1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058465	EF	On-Demand	Anodyne	GRIN1	26	42
CC(=O)Nc1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058465	EF	On-Demand	Anodyne	ADRB3	60	55
CC(=O)Nc1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058465	EF	On-Demand	Anodyne	ABCB1	27	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058466	EF	On-Demand	Anodyne	ADRB2	61	58
CC(=O)Nc1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058466	EF	On-Demand	Anodyne	ADRB1	98	58
CC(=O)Nc1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058466	EF	On-Demand	Anodyne	GRIN1	26	42
CC(=O)Nc1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058466	EF	On-Demand	Anodyne	ADRB3	60	55
CC(=O)Nc1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819058466	EF	On-Demand	Anodyne	ABCB1	27	48
COc1cccc(C[C@@H](C)NCCC(=O)N(C)OC)c1	ZINC000819058477	CD	On-Demand	Anodyne	DRD4	40	30
COc1cccc(C[C@@H](C)NCCC(=O)N(C)OC)c1	ZINC000819058477	CD	On-Demand	Anodyne	MTNR1A	44	43
COc1cccc(C[C@@H](C)NCCC(=O)N(C)OC)c1	ZINC000819058477	CD	On-Demand	Anodyne	MTNR1B	44	43
COc1cccc(C[C@@H](C)NCCC(=O)N(C)OC)c1	ZINC000819058477	CD	On-Demand	Anodyne	ROCK2	37	40
COc1cccc(C[C@H](C)NCCC(=O)N(C)OC)c1	ZINC000819058478	CD	On-Demand	Anodyne	DRD4	40	30
COc1cccc(C[C@H](C)NCCC(=O)N(C)OC)c1	ZINC000819058478	CD	On-Demand	Anodyne	MTNR1A	44	43
COc1cccc(C[C@H](C)NCCC(=O)N(C)OC)c1	ZINC000819058478	CD	On-Demand	Anodyne	MTNR1B	44	43
COc1cccc(C[C@H](C)NCCC(=O)N(C)OC)c1	ZINC000819058478	CD	On-Demand	Anodyne	ROCK2	37	40
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819058529	FH	On-Demand	Anodyne	ADRB2	49	51
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819058529	FH	On-Demand	Anodyne	ADRB1	36	50
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819058529	FH	On-Demand	Anodyne	ADRB3	47	50
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819058530	FH	On-Demand	Anodyne	ADRB2	49	51
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819058530	FH	On-Demand	Anodyne	ADRB1	36	50
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819058530	FH	On-Demand	Anodyne	ADRB3	47	50
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819058531	FH	On-Demand	Anodyne	ADRB2	49	51
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819058531	FH	On-Demand	Anodyne	ADRB1	36	50
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819058531	FH	On-Demand	Anodyne	ADRB3	47	50
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819058532	FH	On-Demand	Anodyne	ADRB2	49	51
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819058532	FH	On-Demand	Anodyne	ADRB1	36	50
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819058532	FH	On-Demand	Anodyne	ADRB3	47	50
O[C@@H](CNCCCCn1ccnc1)c1ccccc1Br	ZINC000819058548	EF	On-Demand	Anodyne	TBXAS1	53	46
O[C@@H](CNCCCCn1ccnc1)c1ccccc1Br	ZINC000819058548	EF	On-Demand	Anodyne	HMOX2	51	40
O[C@H](CNCCCCn1ccnc1)c1ccccc1Br	ZINC000819058549	EF	On-Demand	Anodyne	TBXAS1	53	46
O[C@H](CNCCCCn1ccnc1)c1ccccc1Br	ZINC000819058549	EF	On-Demand	Anodyne	HMOX2	51	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(Cc2cccnc2)CC1	ZINC000819058550	FD	On-Demand	Anodyne	CHRNA7	43	37
O=C(/C=C/[C@H]1CCCO1)Nc1cc(Cl)ccc1OCC(F)(F)F	ZINC000819058551	EH	On-Demand	Anodyne	RBP4	19	41
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(Cl)ccc1OCC(F)(F)F	ZINC000819058552	EH	On-Demand	Anodyne	RBP4	19	41
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(Cl)ccc1OCC(F)(F)F	ZINC000819058553	EH	On-Demand	Anodyne	RBP4	19	41
O=C(/C=C\[C@H]1CCCO1)Nc1cc(Cl)ccc1OCC(F)(F)F	ZINC000819058554	EH	On-Demand	Anodyne	RBP4	19	41
C[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)C	ZINC000819058567	CC	On-Demand	Bother	CACNA1C	40	35
C[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)C	ZINC000819058567	CC	On-Demand	Bother	CACNA1D	63	35
C[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)C	ZINC000819058567	CC	On-Demand	Bother	COLA	42	38
C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)C	ZINC000819058568	CC	On-Demand	Bother	CACNA1C	40	35
C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)C	ZINC000819058568	CC	On-Demand	Bother	CACNA1D	63	35
C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)C	ZINC000819058568	CC	On-Demand	Bother	COLA	42	38
CNC(=O)CCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819058571	CC	On-Demand	Bother	ADRB3	43	36
CNC(=O)CCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819058571	CC	On-Demand	Bother	CACNA1D	51	33
CNC(=O)CCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819058572	CC	On-Demand	Bother	ADRB3	43	36
CNC(=O)CCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819058572	CC	On-Demand	Bother	CACNA1D	51	33
O=C(NCCc1cccnc1)C(F)=C1CCC1	ZINC000819058579	BE	On-Demand	Anodyne	TBXAS1	39	41
O=C(NCCc1cccnc1)C(F)=C1CCC1	ZINC000819058579	BE	On-Demand	Anodyne	PTAFR	27	41
O=C(NCCc1cccnc1)C(F)=C1CCC1	ZINC000819058579	BE	On-Demand	Anodyne	CHRNA7	41	35
O=C(NCCc1cccnc1)C(F)=C1CCC1	ZINC000819058579	BE	On-Demand	Anodyne	NAMPT	39	44
C[C@@H](NC[C@@H](O)c1cccnc1)C(=O)N(C)C	ZINC000819058584	BC	On-Demand	Anodyne	ADRB2	26	40
C[C@@H](NC[C@@H](O)c1cccnc1)C(=O)N(C)C	ZINC000819058584	BC	On-Demand	Anodyne	ADRB1	28	54
C[C@@H](NC[C@@H](O)c1cccnc1)C(=O)N(C)C	ZINC000819058584	BC	On-Demand	Anodyne	ADRB3	89	54
C[C@@H](NC[C@@H](O)c1cccnc1)C(=O)N(C)C	ZINC000819058584	BC	On-Demand	Anodyne	KCNA5	25	44
C[C@H](NC[C@H](O)c1cccnc1)C(=O)N(C)C	ZINC000819058585	BC	On-Demand	Anodyne	ADRB2	26	40
C[C@H](NC[C@H](O)c1cccnc1)C(=O)N(C)C	ZINC000819058585	BC	On-Demand	Anodyne	ADRB1	28	54
C[C@H](NC[C@H](O)c1cccnc1)C(=O)N(C)C	ZINC000819058585	BC	On-Demand	Anodyne	ADRB3	89	54
C[C@H](NC[C@H](O)c1cccnc1)C(=O)N(C)C	ZINC000819058585	BC	On-Demand	Anodyne	KCNA5	25	44
O[C@@H](CNCCCCn1ccnc1)c1ccccc1C(F)(F)F	ZINC000819058609	EG	On-Demand	Anodyne	TBXAS1	47	48
O[C@@H](CNCCCCn1ccnc1)c1ccccc1C(F)(F)F	ZINC000819058609	EG	On-Demand	Anodyne	HMOX2	48	39
O[C@H](CNCCCCn1ccnc1)c1ccccc1C(F)(F)F	ZINC000819058610	EG	On-Demand	Anodyne	TBXAS1	47	48
O[C@H](CNCCCCn1ccnc1)c1ccccc1C(F)(F)F	ZINC000819058610	EG	On-Demand	Anodyne	HMOX2	48	39
O[C@H](CNCCCCn1ccnc1)C1CC1	ZINC000819058611	BD	On-Demand	Anodyne	TBXAS1	40	45
O[C@H](CNCCCCn1ccnc1)C1CC1	ZINC000819058611	BD	On-Demand	Anodyne	HMOX2	47	34
O[C@@H](CNCCCCn1ccnc1)C1CC1	ZINC000819058612	BD	On-Demand	Anodyne	TBXAS1	40	45
O[C@@H](CNCCCCn1ccnc1)C1CC1	ZINC000819058612	BD	On-Demand	Anodyne	HMOX2	47	34
C[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CN1CCN(C)CC1	ZINC000819058613	GD	On-Demand	Anodyne	GPR119	24	41
C[C@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CN1CCN(C)CC1	ZINC000819058614	GD	On-Demand	Anodyne	GPR119	24	41
C[C@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CN1CCN(C)CC1	ZINC000819058615	GD	On-Demand	Anodyne	GPR119	24	41
C[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CN1CCN(C)CC1	ZINC000819058616	GD	On-Demand	Anodyne	GPR119	24	41
C[C@@H](CNC[C@@H](O)c1ccccc1)CN1CCN(C)CC1	ZINC000819058633	CD	On-Demand	Anodyne	SLC6A3	16	46
C[C@H](CNC[C@@H](O)c1ccccc1)CN1CCN(C)CC1	ZINC000819058634	CD	On-Demand	Anodyne	SLC6A3	16	46
C[C@@H](CNC[C@H](O)c1ccccc1)CN1CCN(C)CC1	ZINC000819058635	CD	On-Demand	Anodyne	SLC6A3	16	46
C[C@H](CNC[C@H](O)c1ccccc1)CN1CCN(C)CC1	ZINC000819058636	CD	On-Demand	Anodyne	SLC6A3	16	46
COc1ccc(OCC(F)(F)C(F)F)c(C(=O)Nc2ccc(Cl)nc2)c1	ZINC000819058650	GI	On-Demand	Anodyne	ATF1	52	32
COc1ccc(OCC(F)(F)C(F)F)c(C(=O)Nc2ccc(Cl)nc2)c1	ZINC000819058650	GI	On-Demand	Anodyne	NFKB1	48	32
COc1ccc(OCC(F)(F)C(F)F)c(C(=O)Nc2ccc(Cl)nc2)c1	ZINC000819058650	GI	On-Demand	Anodyne	KCNK3	48	35
COc1ccc(OCC(F)(F)C(F)F)c(C(=O)Nc2ccc(Cl)nc2)c1	ZINC000819058650	GI	On-Demand	Anodyne	KCNK9	45	35
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccccc2F)c1	ZINC000819058655	DG	On-Demand	Anodyne	ADRB2	44	38
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccccc2F)c1	ZINC000819058655	DG	On-Demand	Anodyne	ADRB1	27	47
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccccc2F)c1	ZINC000819058655	DG	On-Demand	Anodyne	ADRB3	38	40
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccccc2F)c1	ZINC000819058656	DG	On-Demand	Anodyne	ADRB2	44	38
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccccc2F)c1	ZINC000819058656	DG	On-Demand	Anodyne	ADRB1	27	47
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccccc2F)c1	ZINC000819058656	DG	On-Demand	Anodyne	ADRB3	38	40
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccccc2F)c1	ZINC000819058657	DG	On-Demand	Anodyne	ADRB2	44	38
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccccc2F)c1	ZINC000819058657	DG	On-Demand	Anodyne	ADRB1	27	47
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccccc2F)c1	ZINC000819058657	DG	On-Demand	Anodyne	ADRB3	38	40
COc1cccc(C[C@H](C)NC[C@H](O)c2ccccc2F)c1	ZINC000819058658	DG	On-Demand	Anodyne	ADRB2	44	38
COc1cccc(C[C@H](C)NC[C@H](O)c2ccccc2F)c1	ZINC000819058658	DG	On-Demand	Anodyne	ADRB1	27	47
COc1cccc(C[C@H](C)NC[C@H](O)c2ccccc2F)c1	ZINC000819058658	DG	On-Demand	Anodyne	ADRB3	38	40
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)Cc2ccccc2)CC1	ZINC000819058680	FD	On-Demand	Anodyne	ADRB3	21	45
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)Cc2ccccc2)CC1	ZINC000819058680	FD	On-Demand	Anodyne	SIGMAR1	15	42
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)Cc2ccccc2)CC1	ZINC000819058681	FD	On-Demand	Anodyne	ADRB3	21	45
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)Cc2ccccc2)CC1	ZINC000819058681	FD	On-Demand	Anodyne	SIGMAR1	15	42
O=C(/C=C/[C@H]1CCCO1)Nc1ccccc1C(=O)N1CCCCC1	ZINC000819058695	EF	On-Demand	Anodyne	NPSR1	16	47
O=C(/C=C/[C@H]1CCCO1)Nc1ccccc1C(=O)N1CCCCC1	ZINC000819058695	EF	On-Demand	Anodyne	L3MBTL3	51	39
O=C(/C=C\[C@H]1CCCO1)Nc1ccccc1C(=O)N1CCCCC1	ZINC000819058696	EF	On-Demand	Anodyne	NPSR1	16	47
O=C(/C=C\[C@H]1CCCO1)Nc1ccccc1C(=O)N1CCCCC1	ZINC000819058696	EF	On-Demand	Anodyne	L3MBTL3	51	39
O=C(/C=C/[C@@H]1CCCO1)Nc1ccccc1C(=O)N1CCCCC1	ZINC000819058697	EF	On-Demand	Anodyne	NPSR1	16	47
O=C(/C=C/[C@@H]1CCCO1)Nc1ccccc1C(=O)N1CCCCC1	ZINC000819058697	EF	On-Demand	Anodyne	L3MBTL3	51	39
O=C(/C=C\[C@@H]1CCCO1)Nc1ccccc1C(=O)N1CCCCC1	ZINC000819058698	EF	On-Demand	Anodyne	NPSR1	16	47
O=C(/C=C\[C@@H]1CCCO1)Nc1ccccc1C(=O)N1CCCCC1	ZINC000819058698	EF	On-Demand	Anodyne	L3MBTL3	51	39
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819058701	EF	On-Demand	Bother	ADRB2	50	49
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819058701	EF	On-Demand	Bother	ADRB1	38	48
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819058701	EF	On-Demand	Bother	ADRB3	58	47
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819058702	EF	On-Demand	Bother	ADRB2	50	49
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819058702	EF	On-Demand	Bother	ADRB1	38	48
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819058702	EF	On-Demand	Bother	ADRB3	58	47
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819058703	EF	On-Demand	Bother	ADRB2	50	49
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819058703	EF	On-Demand	Bother	ADRB1	38	48
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819058703	EF	On-Demand	Bother	ADRB3	58	47
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819058704	EF	On-Demand	Bother	ADRB2	50	49
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819058704	EF	On-Demand	Bother	ADRB1	38	48
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819058704	EF	On-Demand	Bother	ADRB3	58	47
COc1cccc(C[C@H](C)NCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819058707	FG	On-Demand	Anodyne	ROCK1	23	42
COc1cccc(C[C@H](C)NCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819058707	FG	On-Demand	Anodyne	MTNR1A	36	53
COc1cccc(C[C@H](C)NCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819058707	FG	On-Demand	Anodyne	MTNR1B	39	53
COc1cccc(C[C@H](C)NCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819058707	FG	On-Demand	Anodyne	ROCK2	34	44
COc1cccc(C[C@H](C)NCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819058707	FG	On-Demand	Anodyne	NPY5R	27	41
COc1cccc(C[C@@H](C)NCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819058708	FG	On-Demand	Anodyne	ROCK1	23	42
COc1cccc(C[C@@H](C)NCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819058708	FG	On-Demand	Anodyne	MTNR1A	36	53
COc1cccc(C[C@@H](C)NCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819058708	FG	On-Demand	Anodyne	MTNR1B	39	53
COc1cccc(C[C@@H](C)NCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819058708	FG	On-Demand	Anodyne	ROCK2	34	44
COc1cccc(C[C@@H](C)NCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819058708	FG	On-Demand	Anodyne	NPY5R	27	41
O[C@H](CNC/C=C\c1ccccc1)COCc1ccc(Cl)cc1	ZINC000819058722	EH	On-Demand	Anodyne	ADRB2	17	42
O[C@H](CNC/C=C\c1ccccc1)COCc1ccc(Cl)cc1	ZINC000819058722	EH	On-Demand	Anodyne	ADRB1	20	42
O[C@H](CNC/C=C\c1ccccc1)COCc1ccc(Cl)cc1	ZINC000819058722	EH	On-Demand	Anodyne	ADRB3	15	42
O[C@@H](CNC/C=C\c1ccccc1)COCc1ccc(Cl)cc1	ZINC000819058724	EH	On-Demand	Anodyne	ADRB2	17	42
O[C@@H](CNC/C=C\c1ccccc1)COCc1ccc(Cl)cc1	ZINC000819058724	EH	On-Demand	Anodyne	ADRB1	20	42
O[C@@H](CNC/C=C\c1ccccc1)COCc1ccc(Cl)cc1	ZINC000819058724	EH	On-Demand	Anodyne	ADRB3	15	42
O[C@@H](CNC/C=C/c1ccccc1)COCc1ccc(Cl)cc1	ZINC000819058726	EH	On-Demand	Anodyne	ADRB2	17	42
O[C@@H](CNC/C=C/c1ccccc1)COCc1ccc(Cl)cc1	ZINC000819058726	EH	On-Demand	Anodyne	ADRB1	20	42
O[C@@H](CNC/C=C/c1ccccc1)COCc1ccc(Cl)cc1	ZINC000819058726	EH	On-Demand	Anodyne	ADRB3	15	42
O[C@H](CNC/C=C/c1ccccc1)COCc1ccc(Cl)cc1	ZINC000819058728	EH	On-Demand	Anodyne	ADRB2	17	42
O[C@H](CNC/C=C/c1ccccc1)COCc1ccc(Cl)cc1	ZINC000819058728	EH	On-Demand	Anodyne	ADRB1	20	42
O[C@H](CNC/C=C/c1ccccc1)COCc1ccc(Cl)cc1	ZINC000819058728	EH	On-Demand	Anodyne	ADRB3	15	42
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819058743	DG	On-Demand	Anodyne	ADRB2	40	37
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819058743	DG	On-Demand	Anodyne	ADRB1	27	48
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819058743	DG	On-Demand	Anodyne	ADRB3	37	41
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819058743	DG	On-Demand	Anodyne	BACE1	18	40
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819058744	DG	On-Demand	Anodyne	ADRB2	40	37
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819058744	DG	On-Demand	Anodyne	ADRB1	27	48
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819058744	DG	On-Demand	Anodyne	ADRB3	37	41
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819058744	DG	On-Demand	Anodyne	BACE1	18	40
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819058745	DG	On-Demand	Anodyne	ADRB2	40	37
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819058745	DG	On-Demand	Anodyne	ADRB1	27	48
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819058745	DG	On-Demand	Anodyne	ADRB3	37	41
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819058745	DG	On-Demand	Anodyne	BACE1	18	40
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819058746	DG	On-Demand	Anodyne	ADRB2	40	37
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819058746	DG	On-Demand	Anodyne	ADRB1	27	48
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819058746	DG	On-Demand	Anodyne	ADRB3	37	41
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819058746	DG	On-Demand	Anodyne	BACE1	18	40
Cc1ccccc1[C@@H](O)CNCCCCn1ccnc1	ZINC000819058782	CE	On-Demand	Anodyne	CYP19A1	15	41
Cc1ccccc1[C@@H](O)CNCCCCn1ccnc1	ZINC000819058782	CE	On-Demand	Anodyne	CYP11B1	22	43
Cc1ccccc1[C@@H](O)CNCCCCn1ccnc1	ZINC000819058782	CE	On-Demand	Anodyne	TBXAS1	60	46
Cc1ccccc1[C@@H](O)CNCCCCn1ccnc1	ZINC000819058782	CE	On-Demand	Anodyne	HMOX2	50	38
Cc1ccccc1[C@@H](O)CNCCCCn1ccnc1	ZINC000819058782	CE	On-Demand	Anodyne	QPCT	45	40
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)CN1CCN(C)CC1	ZINC000819058803	ED	On-Demand	Anodyne	ADRB1	33	43
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)CN1CCN(C)CC1	ZINC000819058803	ED	On-Demand	Anodyne	ADRB3	50	43
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)CN1CCN(C)CC1	ZINC000819058804	ED	On-Demand	Anodyne	ADRB1	33	43
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)CN1CCN(C)CC1	ZINC000819058804	ED	On-Demand	Anodyne	ADRB3	50	43
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)CN1CCN(C)CC1	ZINC000819058806	ED	On-Demand	Anodyne	ADRB1	33	43
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)CN1CCN(C)CC1	ZINC000819058806	ED	On-Demand	Anodyne	ADRB3	50	43
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)CN1CCN(C)CC1	ZINC000819058809	ED	On-Demand	Anodyne	ADRB1	33	43
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)CN1CCN(C)CC1	ZINC000819058809	ED	On-Demand	Anodyne	ADRB3	50	43
O=C(C(F)=C1CCC1)N(Cc1cccnc1)C1CC1	ZINC000819058815	CF	On-Demand	Anodyne	CHRNA7	45	36
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3Cl)c2c1	ZINC000819058818	FH	On-Demand	Anodyne	HTR1A	16	48
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3Cl)c2c1	ZINC000819058818	FH	On-Demand	Anodyne	HTR1D	27	47
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3Cl)c2c1	ZINC000819058818	FH	On-Demand	Anodyne	ADRB3	17	47
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3Cl)c2c1	ZINC000819058818	FH	On-Demand	Anodyne	MPO	97	50
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3Cl)c2c1	ZINC000819058818	FH	On-Demand	Anodyne	HTR1E	15	41
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3Cl)c2c1	ZINC000819058818	FH	On-Demand	Anodyne	MTNR1A	31	51
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3Cl)c2c1	ZINC000819058818	FH	On-Demand	Anodyne	MTNR1B	17	51
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3Cl)c2c1	ZINC000819058820	FH	On-Demand	Anodyne	HTR1A	16	48
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3Cl)c2c1	ZINC000819058820	FH	On-Demand	Anodyne	HTR1D	27	47
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3Cl)c2c1	ZINC000819058820	FH	On-Demand	Anodyne	ADRB3	17	47
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3Cl)c2c1	ZINC000819058820	FH	On-Demand	Anodyne	MPO	97	50
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3Cl)c2c1	ZINC000819058820	FH	On-Demand	Anodyne	HTR1E	15	41
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3Cl)c2c1	ZINC000819058820	FH	On-Demand	Anodyne	MTNR1A	31	51
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3Cl)c2c1	ZINC000819058820	FH	On-Demand	Anodyne	MTNR1B	17	51
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccnc3)c2c1	ZINC000819058840	DE	On-Demand	Anodyne	ADRB2	45	43
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccnc3)c2c1	ZINC000819058840	DE	On-Demand	Anodyne	ADRB1	50	51
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccnc3)c2c1	ZINC000819058840	DE	On-Demand	Anodyne	HTR1D	47	47
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccnc3)c2c1	ZINC000819058840	DE	On-Demand	Anodyne	HTR1B	38	47
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccnc3)c2c1	ZINC000819058840	DE	On-Demand	Anodyne	ADRB3	128	51
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccnc3)c2c1	ZINC000819058840	DE	On-Demand	Anodyne	NQO2	19	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccnc3)c2c1	ZINC000819058840	DE	On-Demand	Anodyne	MPO	43	40
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccnc3)c2c1	ZINC000819058840	DE	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccnc3)c2c1	ZINC000819058840	DE	On-Demand	Anodyne	MTNR1A	40	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccnc3)c2c1	ZINC000819058840	DE	On-Demand	Anodyne	MTNR1B	25	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccnc3)c2c1	ZINC000819058843	DE	On-Demand	Anodyne	ADRB2	45	43
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccnc3)c2c1	ZINC000819058843	DE	On-Demand	Anodyne	ADRB1	50	51
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccnc3)c2c1	ZINC000819058843	DE	On-Demand	Anodyne	HTR1D	47	47
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccnc3)c2c1	ZINC000819058843	DE	On-Demand	Anodyne	HTR1B	38	47
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccnc3)c2c1	ZINC000819058843	DE	On-Demand	Anodyne	ADRB3	128	51
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccnc3)c2c1	ZINC000819058843	DE	On-Demand	Anodyne	NQO2	19	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccnc3)c2c1	ZINC000819058843	DE	On-Demand	Anodyne	MPO	43	40
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccnc3)c2c1	ZINC000819058843	DE	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccnc3)c2c1	ZINC000819058843	DE	On-Demand	Anodyne	MTNR1A	40	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccnc3)c2c1	ZINC000819058843	DE	On-Demand	Anodyne	MTNR1B	25	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3cc(F)ccc3F)c2c1	ZINC000819058853	EG	On-Demand	Anodyne	HTR1A	22	51
COc1ccc2[nH]cc(CCNC[C@H](O)c3cc(F)ccc3F)c2c1	ZINC000819058853	EG	On-Demand	Anodyne	HTR1D	35	51
COc1ccc2[nH]cc(CCNC[C@H](O)c3cc(F)ccc3F)c2c1	ZINC000819058853	EG	On-Demand	Anodyne	SLC6A4	19	51
COc1ccc2[nH]cc(CCNC[C@H](O)c3cc(F)ccc3F)c2c1	ZINC000819058853	EG	On-Demand	Anodyne	ADRB3	15	46
COc1ccc2[nH]cc(CCNC[C@H](O)c3cc(F)ccc3F)c2c1	ZINC000819058853	EG	On-Demand	Anodyne	MPO	100	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3cc(F)ccc3F)c2c1	ZINC000819058853	EG	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3cc(F)ccc3F)c2c1	ZINC000819058853	EG	On-Demand	Anodyne	MTNR1A	34	53
COc1ccc2[nH]cc(CCNC[C@H](O)c3cc(F)ccc3F)c2c1	ZINC000819058853	EG	On-Demand	Anodyne	MTNR1B	20	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cc(F)ccc3F)c2c1	ZINC000819058854	EG	On-Demand	Anodyne	HTR1A	22	51
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cc(F)ccc3F)c2c1	ZINC000819058854	EG	On-Demand	Anodyne	HTR1D	35	51
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cc(F)ccc3F)c2c1	ZINC000819058854	EG	On-Demand	Anodyne	SLC6A4	19	51
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cc(F)ccc3F)c2c1	ZINC000819058854	EG	On-Demand	Anodyne	ADRB3	15	46
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cc(F)ccc3F)c2c1	ZINC000819058854	EG	On-Demand	Anodyne	MPO	100	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cc(F)ccc3F)c2c1	ZINC000819058854	EG	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cc(F)ccc3F)c2c1	ZINC000819058854	EG	On-Demand	Anodyne	MTNR1A	34	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cc(F)ccc3F)c2c1	ZINC000819058854	EG	On-Demand	Anodyne	MTNR1B	20	53
CN(C)c1ccc(NC(=O)CCNCCCCn2ccnc2)cc1	ZINC000819058861	EE	On-Demand	Anodyne	TBXAS1	53	43
CN(C)c1ccc(NC(=O)CCNCCCCn2ccnc2)cc1	ZINC000819058861	EE	On-Demand	Anodyne	HMOX2	46	34
CN(C)c1ccc(NC(=O)CCNCCCCn2ccnc2)cc1	ZINC000819058861	EE	On-Demand	Anodyne	QPCT	42	45
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(Br)c3)c2c1	ZINC000819058864	GH	On-Demand	Anodyne	ADRB2	46	43
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(Br)c3)c2c1	ZINC000819058864	GH	On-Demand	Anodyne	ADRB1	46	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(Br)c3)c2c1	ZINC000819058864	GH	On-Demand	Anodyne	HTR1A	15	49
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(Br)c3)c2c1	ZINC000819058864	GH	On-Demand	Anodyne	HTR1D	44	49
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(Br)c3)c2c1	ZINC000819058864	GH	On-Demand	Anodyne	HTR1B	35	49
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(Br)c3)c2c1	ZINC000819058864	GH	On-Demand	Anodyne	ADRB3	62	57
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(Br)c3)c2c1	ZINC000819058864	GH	On-Demand	Anodyne	NQO2	24	53
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(Br)c3)c2c1	ZINC000819058864	GH	On-Demand	Anodyne	MPO	54	40
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(Br)c3)c2c1	ZINC000819058864	GH	On-Demand	Anodyne	HTR1E	15	43
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(Br)c3)c2c1	ZINC000819058864	GH	On-Demand	Anodyne	MTNR1A	52	54
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(Br)c3)c2c1	ZINC000819058864	GH	On-Demand	Anodyne	MTNR1B	35	53
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(Br)c3)c2c1	ZINC000819058864	GH	On-Demand	Anodyne	ABCG2	26	43
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(Br)c3)c2c1	ZINC000819058866	GH	On-Demand	Anodyne	ADRB2	46	43
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(Br)c3)c2c1	ZINC000819058866	GH	On-Demand	Anodyne	ADRB1	46	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(Br)c3)c2c1	ZINC000819058866	GH	On-Demand	Anodyne	HTR1A	15	49
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(Br)c3)c2c1	ZINC000819058866	GH	On-Demand	Anodyne	HTR1D	44	49
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(Br)c3)c2c1	ZINC000819058866	GH	On-Demand	Anodyne	HTR1B	35	49
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(Br)c3)c2c1	ZINC000819058866	GH	On-Demand	Anodyne	ADRB3	62	57
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(Br)c3)c2c1	ZINC000819058866	GH	On-Demand	Anodyne	NQO2	24	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(Br)c3)c2c1	ZINC000819058866	GH	On-Demand	Anodyne	MPO	54	40
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(Br)c3)c2c1	ZINC000819058866	GH	On-Demand	Anodyne	HTR1E	15	43
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(Br)c3)c2c1	ZINC000819058866	GH	On-Demand	Anodyne	MTNR1A	52	54
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(Br)c3)c2c1	ZINC000819058866	GH	On-Demand	Anodyne	MTNR1B	35	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(Br)c3)c2c1	ZINC000819058866	GH	On-Demand	Anodyne	ABCG2	26	43
O[C@@H](CNCCCCn1ccnc1)c1ccc(Cl)c(F)c1	ZINC000819058882	DF	On-Demand	Anodyne	TBXAS1	45	46
O[C@@H](CNCCCCn1ccnc1)c1ccc(Cl)c(F)c1	ZINC000819058882	DF	On-Demand	Anodyne	HMOX2	53	39
C[C@@H](CCN(C)C)NC[C@H](O)c1cccc2ccccc12	ZINC000819058918	CF	On-Demand	Anodyne	UTS2	42	33
O[C@H](CNC[C@@H]1OCCc2ccccc21)c1cccc(Cl)c1	ZINC000819058919	DG	On-Demand	Anodyne	ADRB3	42	39
O[C@H](CNC[C@H]1OCCc2ccccc21)c1cccc(Cl)c1	ZINC000819058920	DG	On-Demand	Anodyne	ADRB3	42	39
O[C@@H](CNC[C@@H]1OCCc2ccccc21)c1cccc(Cl)c1	ZINC000819058921	DG	On-Demand	Anodyne	ADRB3	42	39
C[C@H](NC[C@H](O)c1ccc(Cl)c(F)c1)C(=O)N1CCCC[C@@H]1C	ZINC000819058926	EF	On-Demand	Anodyne	ADRB1	15	43
C[C@H](NC[C@H](O)c1ccc(Cl)c(F)c1)C(=O)N1CCCC[C@@H]1C	ZINC000819058926	EF	On-Demand	Anodyne	AKT3	16	41
C[C@H](NC[C@H](O)c1ccc(Cl)c(F)c1)C(=O)N1CCCC[C@H]1C	ZINC000819058928	EF	On-Demand	Anodyne	ADRB1	15	43
C[C@H](NC[C@H](O)c1ccc(Cl)c(F)c1)C(=O)N1CCCC[C@H]1C	ZINC000819058928	EF	On-Demand	Anodyne	AKT3	16	41
Cc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c(C)c1	ZINC000819058956	FE	On-Demand	Anodyne	ADRB2	24	46
Cc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c(C)c1	ZINC000819058956	FE	On-Demand	Anodyne	ADRB1	19	46
Cc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c(C)c1	ZINC000819058956	FE	On-Demand	Anodyne	ADRB3	19	40
O[C@H](CNCCCCn1ccnc1)c1ccc(Cl)c(F)c1	ZINC000819058957	DF	On-Demand	Anodyne	TBXAS1	45	46
O[C@H](CNCCCCn1ccnc1)c1ccc(Cl)c(F)c1	ZINC000819058957	DF	On-Demand	Anodyne	HMOX2	53	39
O[C@@H](CNCCCCn1ccnc1)c1ccc(F)c(Br)c1	ZINC000819058958	FF	On-Demand	Anodyne	TBXAS1	40	44
O[C@@H](CNCCCCn1ccnc1)c1ccc(F)c(Br)c1	ZINC000819058958	FF	On-Demand	Anodyne	HMOX2	52	37
Cc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c(C)c1	ZINC000819058959	FE	On-Demand	Anodyne	ADRB2	24	46
Cc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c(C)c1	ZINC000819058959	FE	On-Demand	Anodyne	ADRB1	19	46
Cc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c(C)c1	ZINC000819058959	FE	On-Demand	Anodyne	ADRB3	19	40
O[C@H](CNCCCCn1ccnc1)c1ccc(F)c(Br)c1	ZINC000819058960	FF	On-Demand	Anodyne	TBXAS1	40	44
O[C@H](CNCCCCn1ccnc1)c1ccc(F)c(Br)c1	ZINC000819058960	FF	On-Demand	Anodyne	HMOX2	52	37
Cc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c(C)c1	ZINC000819058961	FE	On-Demand	Anodyne	ADRB2	24	46
Cc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c(C)c1	ZINC000819058961	FE	On-Demand	Anodyne	ADRB1	19	46
Cc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c(C)c1	ZINC000819058961	FE	On-Demand	Anodyne	ADRB3	19	40
Cc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c(C)c1	ZINC000819058963	FE	On-Demand	Anodyne	ADRB2	24	46
Cc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c(C)c1	ZINC000819058963	FE	On-Demand	Anodyne	ADRB1	19	46
Cc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c(C)c1	ZINC000819058963	FE	On-Demand	Anodyne	ADRB3	19	40
C[C@@](O)(CNCCCCn1ccnc1)c1ccc(Br)cc1F	ZINC000819058988	FG	On-Demand	Anodyne	TBXAS1	46	44
C[C@@](O)(CNCCCCn1ccnc1)c1ccc(Br)cc1F	ZINC000819058988	FG	On-Demand	Anodyne	HMOX2	48	42
O=C(/C=C\[C@H]1CCCO1)NCCc1cccnc1	ZINC000819058990	BD	On-Demand	Anodyne	TBXAS1	34	41
O=C(/C=C\[C@H]1CCCO1)NCCc1cccnc1	ZINC000819058990	BD	On-Demand	Anodyne	PTAFR	30	47
O=C(/C=C\[C@H]1CCCO1)NCCc1cccnc1	ZINC000819058990	BD	On-Demand	Anodyne	CHRNA7	47	39
O=C(/C=C\[C@H]1CCCO1)NCCc1cccnc1	ZINC000819058990	BD	On-Demand	Anodyne	NAMPT	35	40
O=C(/C=C/[C@@H]1CCCO1)NCCc1cccnc1	ZINC000819058991	BD	On-Demand	Anodyne	TBXAS1	34	41
O=C(/C=C/[C@@H]1CCCO1)NCCc1cccnc1	ZINC000819058991	BD	On-Demand	Anodyne	PTAFR	30	47
O=C(/C=C/[C@@H]1CCCO1)NCCc1cccnc1	ZINC000819058991	BD	On-Demand	Anodyne	CHRNA7	47	39
O=C(/C=C/[C@@H]1CCCO1)NCCc1cccnc1	ZINC000819058991	BD	On-Demand	Anodyne	NAMPT	35	40
O=C(/C=C\[C@@H]1CCCO1)NCCc1cccnc1	ZINC000819058993	BD	On-Demand	Anodyne	TBXAS1	34	41
O=C(/C=C\[C@@H]1CCCO1)NCCc1cccnc1	ZINC000819058993	BD	On-Demand	Anodyne	PTAFR	30	47
O=C(/C=C\[C@@H]1CCCO1)NCCc1cccnc1	ZINC000819058993	BD	On-Demand	Anodyne	CHRNA7	47	39
O=C(/C=C\[C@@H]1CCCO1)NCCc1cccnc1	ZINC000819058993	BD	On-Demand	Anodyne	NAMPT	35	40
O=C(/C=C/[C@H]1CCCO1)NCCc1cccnc1	ZINC000819058995	BD	On-Demand	Anodyne	TBXAS1	34	41
O=C(/C=C/[C@H]1CCCO1)NCCc1cccnc1	ZINC000819058995	BD	On-Demand	Anodyne	PTAFR	30	47
O=C(/C=C/[C@H]1CCCO1)NCCc1cccnc1	ZINC000819058995	BD	On-Demand	Anodyne	CHRNA7	47	39
O=C(/C=C/[C@H]1CCCO1)NCCc1cccnc1	ZINC000819058995	BD	On-Demand	Anodyne	NAMPT	35	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccccc1N1CCCC1	ZINC000819059008	EG	On-Demand	Anodyne	KCNQ2	87	47
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2cccnc2)CC1	ZINC000819059009	DD	On-Demand	Anodyne	CHRNA7	46	37
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2cccnc2)CC1	ZINC000819059011	DD	On-Demand	Anodyne	CHRNA7	46	37
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2cccnc2)CC1	ZINC000819059014	DD	On-Demand	Anodyne	CHRNA7	46	37
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2cccnc2)CC1	ZINC000819059016	DD	On-Demand	Anodyne	CHRNA7	46	37
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1	ZINC000819059022	FD	On-Demand	Anodyne	L3MBTL3	65	36
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1	ZINC000819059025	FD	On-Demand	Anodyne	L3MBTL3	65	36
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1	ZINC000819059028	FD	On-Demand	Anodyne	L3MBTL3	65	36
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccc3c(c2)OCO3)CC1	ZINC000819059032	FD	On-Demand	Anodyne	L3MBTL3	65	36
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819059035	EF	On-Demand	Anodyne	ADRB2	47	54
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819059035	EF	On-Demand	Anodyne	ADRB1	31	48
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819059035	EF	On-Demand	Anodyne	ADRB3	40	43
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819059035	EF	On-Demand	Anodyne	MTNR1A	21	45
COc1cccc(C[C@H](C)NC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819059039	EF	On-Demand	Anodyne	ADRB2	47	54
COc1cccc(C[C@H](C)NC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819059039	EF	On-Demand	Anodyne	ADRB1	31	48
COc1cccc(C[C@H](C)NC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819059039	EF	On-Demand	Anodyne	ADRB3	40	43
COc1cccc(C[C@H](C)NC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819059039	EF	On-Demand	Anodyne	MTNR1A	21	45
COc1cccc(C[C@@H](C)NC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819059041	EF	On-Demand	Anodyne	ADRB2	47	54
COc1cccc(C[C@@H](C)NC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819059041	EF	On-Demand	Anodyne	ADRB1	31	48
COc1cccc(C[C@@H](C)NC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819059041	EF	On-Demand	Anodyne	ADRB3	40	43
COc1cccc(C[C@@H](C)NC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819059041	EF	On-Demand	Anodyne	MTNR1A	21	45
COc1cccc(C[C@H](C)NC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819059042	EF	On-Demand	Anodyne	ADRB2	47	54
COc1cccc(C[C@H](C)NC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819059042	EF	On-Demand	Anodyne	ADRB1	31	48
COc1cccc(C[C@H](C)NC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819059042	EF	On-Demand	Anodyne	ADRB3	40	43
COc1cccc(C[C@H](C)NC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819059042	EF	On-Demand	Anodyne	MTNR1A	21	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccccc1NS(C)(=O)=O	ZINC000819059046	FD	On-Demand	Anodyne	PRTN3	51	32
CC(=O)c1cccc(OC[C@@H](O)CNC/C=C/c2ccccc2)c1	ZINC000819059051	EF	On-Demand	Anodyne	ADRB2	46	47
CC(=O)c1cccc(OC[C@@H](O)CNC/C=C/c2ccccc2)c1	ZINC000819059051	EF	On-Demand	Anodyne	ADRB1	67	44
CC(=O)c1cccc(OC[C@@H](O)CNC/C=C/c2ccccc2)c1	ZINC000819059051	EF	On-Demand	Anodyne	ADRB3	39	44
CC(=O)c1cccc(OC[C@@H](O)CNC/C=C/c2ccccc2)c1	ZINC000819059051	EF	On-Demand	Anodyne	ABCB1	39	48
CC(=O)c1cccc(OC[C@@H](O)CNC/C=C/c2ccccc2)c1	ZINC000819059051	EF	On-Demand	Anodyne	PDS	64	39
CC(=O)c1cccc(OC[C@H](O)CNC/C=C/c2ccccc2)c1	ZINC000819059053	EF	On-Demand	Anodyne	ADRB2	46	47
CC(=O)c1cccc(OC[C@H](O)CNC/C=C/c2ccccc2)c1	ZINC000819059053	EF	On-Demand	Anodyne	ADRB1	67	44
CC(=O)c1cccc(OC[C@H](O)CNC/C=C/c2ccccc2)c1	ZINC000819059053	EF	On-Demand	Anodyne	ADRB3	39	44
CC(=O)c1cccc(OC[C@H](O)CNC/C=C/c2ccccc2)c1	ZINC000819059053	EF	On-Demand	Anodyne	ABCB1	39	48
CC(=O)c1cccc(OC[C@H](O)CNC/C=C/c2ccccc2)c1	ZINC000819059053	EF	On-Demand	Anodyne	PDS	64	39
CC(=O)c1cccc(OC[C@@H](O)CNC/C=C\c2ccccc2)c1	ZINC000819059055	EF	On-Demand	Anodyne	ADRB2	46	47
CC(=O)c1cccc(OC[C@@H](O)CNC/C=C\c2ccccc2)c1	ZINC000819059055	EF	On-Demand	Anodyne	ADRB1	67	44
CC(=O)c1cccc(OC[C@@H](O)CNC/C=C\c2ccccc2)c1	ZINC000819059055	EF	On-Demand	Anodyne	ADRB3	39	44
CC(=O)c1cccc(OC[C@@H](O)CNC/C=C\c2ccccc2)c1	ZINC000819059055	EF	On-Demand	Anodyne	ABCB1	39	48
CC(=O)c1cccc(OC[C@@H](O)CNC/C=C\c2ccccc2)c1	ZINC000819059055	EF	On-Demand	Anodyne	PDS	64	39
CC(=O)c1cccc(OC[C@H](O)CNC/C=C\c2ccccc2)c1	ZINC000819059057	EF	On-Demand	Anodyne	ADRB2	46	47
CC(=O)c1cccc(OC[C@H](O)CNC/C=C\c2ccccc2)c1	ZINC000819059057	EF	On-Demand	Anodyne	ADRB1	67	44
CC(=O)c1cccc(OC[C@H](O)CNC/C=C\c2ccccc2)c1	ZINC000819059057	EF	On-Demand	Anodyne	ADRB3	39	44
CC(=O)c1cccc(OC[C@H](O)CNC/C=C\c2ccccc2)c1	ZINC000819059057	EF	On-Demand	Anodyne	ABCB1	39	48
CC(=O)c1cccc(OC[C@H](O)CNC/C=C\c2ccccc2)c1	ZINC000819059057	EF	On-Demand	Anodyne	PDS	64	39
COC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059070	GD	On-Demand	Anodyne	ADRB2	35	43
COC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059070	GD	On-Demand	Anodyne	ADRB1	52	49
COC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059070	GD	On-Demand	Anodyne	ADRB3	39	47
O=C(C(F)=C1CCC1)N1CCN(Cc2cccnc2)CC1	ZINC000819059072	CE	On-Demand	Anodyne	CHRNA7	40	35
O=C(C(F)=C1CCC1)N1CCN(Cc2cccnc2)CC1	ZINC000819059072	CE	On-Demand	Anodyne	FAAH	26	42
COC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059073	GD	On-Demand	Anodyne	ADRB2	35	43
COC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059073	GD	On-Demand	Anodyne	ADRB1	52	49
COC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059073	GD	On-Demand	Anodyne	ADRB3	39	47
COC(=O)c1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059076	GD	On-Demand	Anodyne	ADRB2	35	43
COC(=O)c1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059076	GD	On-Demand	Anodyne	ADRB1	52	49
COC(=O)c1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059076	GD	On-Demand	Anodyne	ADRB3	39	47
COC(=O)c1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059079	GD	On-Demand	Anodyne	ADRB2	35	43
COC(=O)c1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059079	GD	On-Demand	Anodyne	ADRB1	52	49
COC(=O)c1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059079	GD	On-Demand	Anodyne	ADRB3	39	47
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccccc1F	ZINC000819059091	FD	On-Demand	Anodyne	ADRB2	33	52
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccccc1F	ZINC000819059091	FD	On-Demand	Anodyne	ADRB1	30	52
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccccc1F	ZINC000819059091	FD	On-Demand	Anodyne	ADRB3	27	50
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccccc1F	ZINC000819059091	FD	On-Demand	Anodyne	ABCB1	22	41
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccccc1F	ZINC000819059094	FD	On-Demand	Anodyne	ADRB2	33	52
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccccc1F	ZINC000819059094	FD	On-Demand	Anodyne	ADRB1	30	52
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccccc1F	ZINC000819059094	FD	On-Demand	Anodyne	ADRB3	27	50
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccccc1F	ZINC000819059094	FD	On-Demand	Anodyne	ABCB1	22	41
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccccc1F	ZINC000819059097	FD	On-Demand	Anodyne	ADRB2	33	52
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccccc1F	ZINC000819059097	FD	On-Demand	Anodyne	ADRB1	30	52
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccccc1F	ZINC000819059097	FD	On-Demand	Anodyne	ADRB3	27	50
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccccc1F	ZINC000819059097	FD	On-Demand	Anodyne	ABCB1	22	41
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccccc1F	ZINC000819059099	FD	On-Demand	Anodyne	ADRB2	33	52
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccccc1F	ZINC000819059099	FD	On-Demand	Anodyne	ADRB1	30	52
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccccc1F	ZINC000819059099	FD	On-Demand	Anodyne	ADRB3	27	50
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccccc1F	ZINC000819059099	FD	On-Demand	Anodyne	ABCB1	22	41
CNC(=O)CCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819059149	DD	On-Demand	Anodyne	ADRB3	39	48
CNC(=O)CCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819059152	DD	On-Demand	Anodyne	ADRB3	39	48
C[C@H](CNC[C@H](O)c1cccc(F)c1)CN1CCN(C)CC1	ZINC000819059157	DD	On-Demand	Anodyne	ADRB3	15	40
CSc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059158	GE	On-Demand	Anodyne	ADRB2	26	45
CSc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059158	GE	On-Demand	Anodyne	ADRB1	36	46
CSc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059158	GE	On-Demand	Anodyne	ADRB3	25	45
C[C@H](CNC[C@@H](O)c1cccc(F)c1)CN1CCN(C)CC1	ZINC000819059159	DD	On-Demand	Anodyne	ADRB3	15	40
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)CN1CCN(C)CC1	ZINC000819059160	DD	On-Demand	Anodyne	ADRB3	15	40
CSc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059162	GE	On-Demand	Anodyne	ADRB2	26	45
CSc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059162	GE	On-Demand	Anodyne	ADRB1	36	46
CSc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059162	GE	On-Demand	Anodyne	ADRB3	25	45
CSc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059164	GE	On-Demand	Anodyne	ADRB2	26	45
CSc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059164	GE	On-Demand	Anodyne	ADRB1	36	46
CSc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059164	GE	On-Demand	Anodyne	ADRB3	25	45
CSc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059166	GE	On-Demand	Anodyne	ADRB2	26	45
CSc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059166	GE	On-Demand	Anodyne	ADRB1	36	46
CSc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059166	GE	On-Demand	Anodyne	ADRB3	25	45
C[C@@H](CNC[C@H](O)c1cccc(F)c1)CN1CCN(C)CC1	ZINC000819059167	DD	On-Demand	Anodyne	ADRB3	15	40
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1	ZINC000819059170	FH	On-Demand	Mild	PAPA1_CARPA	45	51
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1	ZINC000819059170	FH	On-Demand	Mild	CTSK	21	40
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCCC1	ZINC000819059179	FH	On-Demand	Mild	PAPA1_CARPA	34	43
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCCC1	ZINC000819059179	FH	On-Demand	Mild	CTSK	18	43
O[C@@H](CN[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1cccnc1	ZINC000819059199	GD	On-Demand	Anodyne	ADRB3	51	44
O[C@H](CN[C@@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1cccnc1	ZINC000819059201	GD	On-Demand	Anodyne	ADRB3	51	44
O[C@@H](CN[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1cccnc1	ZINC000819059203	GD	On-Demand	Anodyne	ADRB3	51	44
O[C@H](CN[C@H]1CCCN(c2cc(N3CCOCC3)ncn2)C1)c1cccnc1	ZINC000819059206	GD	On-Demand	Anodyne	ADRB3	51	44
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3Br)c2c1	ZINC000819059232	GH	On-Demand	Anodyne	HTR1A	18	55
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3Br)c2c1	ZINC000819059232	GH	On-Demand	Anodyne	HTR1D	48	50
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3Br)c2c1	ZINC000819059232	GH	On-Demand	Anodyne	HTR1B	37	50
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3Br)c2c1	ZINC000819059232	GH	On-Demand	Anodyne	ADRB3	21	50
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3Br)c2c1	ZINC000819059232	GH	On-Demand	Anodyne	NQO2	24	54
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3Br)c2c1	ZINC000819059232	GH	On-Demand	Anodyne	MPO	60	41
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3Br)c2c1	ZINC000819059232	GH	On-Demand	Anodyne	HTR1E	22	44
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3Br)c2c1	ZINC000819059232	GH	On-Demand	Anodyne	MTNR1A	55	55
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3Br)c2c1	ZINC000819059232	GH	On-Demand	Anodyne	MTNR1B	38	54
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3Br)c2c1	ZINC000819059232	GH	On-Demand	Anodyne	ABCG2	25	41
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3Br)c2c1	ZINC000819059233	GH	On-Demand	Anodyne	HTR1A	18	55
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3Br)c2c1	ZINC000819059233	GH	On-Demand	Anodyne	HTR1D	48	50
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3Br)c2c1	ZINC000819059233	GH	On-Demand	Anodyne	HTR1B	37	50
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3Br)c2c1	ZINC000819059233	GH	On-Demand	Anodyne	ADRB3	21	50
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3Br)c2c1	ZINC000819059233	GH	On-Demand	Anodyne	NQO2	24	54
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3Br)c2c1	ZINC000819059233	GH	On-Demand	Anodyne	MPO	60	41
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3Br)c2c1	ZINC000819059233	GH	On-Demand	Anodyne	HTR1E	22	44
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3Br)c2c1	ZINC000819059233	GH	On-Demand	Anodyne	MTNR1A	55	55
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3Br)c2c1	ZINC000819059233	GH	On-Demand	Anodyne	MTNR1B	38	54
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3Br)c2c1	ZINC000819059233	GH	On-Demand	Anodyne	ABCG2	25	41
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Cl)cc3)c2c1	ZINC000819059272	EH	On-Demand	Anodyne	ADRB2	35	41
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Cl)cc3)c2c1	ZINC000819059272	EH	On-Demand	Anodyne	HTR1A	15	54
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Cl)cc3)c2c1	ZINC000819059272	EH	On-Demand	Anodyne	HTR1D	43	54
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Cl)cc3)c2c1	ZINC000819059272	EH	On-Demand	Anodyne	HTR1B	34	54
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Cl)cc3)c2c1	ZINC000819059272	EH	On-Demand	Anodyne	PTGS2	15	41
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Cl)cc3)c2c1	ZINC000819059272	EH	On-Demand	Anodyne	ADRB3	45	56
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Cl)cc3)c2c1	ZINC000819059272	EH	On-Demand	Anodyne	MPO	65	41
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Cl)cc3)c2c1	ZINC000819059272	EH	On-Demand	Anodyne	HTR1E	23	44
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Cl)cc3)c2c1	ZINC000819059272	EH	On-Demand	Anodyne	MTNR1A	42	55
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Cl)cc3)c2c1	ZINC000819059272	EH	On-Demand	Anodyne	MTNR1B	25	55
C[C@H]1CCCCN1C(=O)[C@@H](C)NCC1(O)CCCCC1	ZINC000819059305	CE	On-Demand	Anodyne	ACE	22	43
C[C@@H](NCC1(O)CCCCC1)C(=O)N1CCCC[C@H]1C	ZINC000819059306	CE	On-Demand	Anodyne	ACE	22	43
O[C@@H](CNCCCc1nnc2n1CCCCC2)c1cccc(Cl)c1	ZINC000819059311	EF	On-Demand	Anodyne	ADRB1	49	46
O[C@@H](CNCCCc1nnc2n1CCCCC2)c1cccc(Cl)c1	ZINC000819059311	EF	On-Demand	Anodyne	ADRB3	60	46
O[C@H](CNCCCc1nnc2n1CCCCC2)c1cccc(Cl)c1	ZINC000819059312	EF	On-Demand	Anodyne	ADRB1	49	46
O[C@H](CNCCCc1nnc2n1CCCCC2)c1cccc(Cl)c1	ZINC000819059312	EF	On-Demand	Anodyne	ADRB3	60	46
COc1ccc2[nH]cc(CCNCCS(C)(=O)=O)c2c1	ZINC000819059328	CD	On-Demand	Anodyne	HTR1A	21	59
COc1ccc2[nH]cc(CCNCCS(C)(=O)=O)c2c1	ZINC000819059328	CD	On-Demand	Anodyne	HTR1D	60	57
COc1ccc2[nH]cc(CCNCCS(C)(=O)=O)c2c1	ZINC000819059328	CD	On-Demand	Anodyne	HTR1B	39	57
COc1ccc2[nH]cc(CCNCCS(C)(=O)=O)c2c1	ZINC000819059328	CD	On-Demand	Anodyne	NQO2	32	62
COc1ccc2[nH]cc(CCNCCS(C)(=O)=O)c2c1	ZINC000819059328	CD	On-Demand	Anodyne	MPO	87	48
COc1ccc2[nH]cc(CCNCCS(C)(=O)=O)c2c1	ZINC000819059328	CD	On-Demand	Anodyne	HTR1E	24	49
COc1ccc2[nH]cc(CCNCCS(C)(=O)=O)c2c1	ZINC000819059328	CD	On-Demand	Anodyne	MTNR1A	67	63
COc1ccc2[nH]cc(CCNCCS(C)(=O)=O)c2c1	ZINC000819059328	CD	On-Demand	Anodyne	MTNR1B	47	62
COc1ccc2[nH]cc(CCNCCS(C)(=O)=O)c2c1	ZINC000819059328	CD	On-Demand	Anodyne	ABCG2	25	42
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CCCN1C	ZINC000819059335	CD	On-Demand	Anodyne	CHRNA10	59	41
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CCCN1C	ZINC000819059335	CD	On-Demand	Anodyne	ACKR3	46	33
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CCCN1C	ZINC000819059337	CD	On-Demand	Anodyne	CHRNA10	59	41
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CCCN1C	ZINC000819059337	CD	On-Demand	Anodyne	ACKR3	46	33
O[C@@H](CNCCCCn1ccnc1)c1ccc(F)cn1	ZINC000819059342	CD	On-Demand	Anodyne	TBXAS1	39	41
O[C@@H](CNCCCCn1ccnc1)c1ccc(F)cn1	ZINC000819059342	CD	On-Demand	Anodyne	HMOX2	49	36
O[C@@H](CNCCCCn1ccnc1)c1ccc(F)cn1	ZINC000819059342	CD	On-Demand	Anodyne	NAMPT	22	41
O[C@H](CNCCCCn1ccnc1)c1ccc(F)cn1	ZINC000819059343	CD	On-Demand	Anodyne	TBXAS1	39	41
O[C@H](CNCCCCn1ccnc1)c1ccc(F)cn1	ZINC000819059343	CD	On-Demand	Anodyne	HMOX2	49	36
O[C@H](CNCCCCn1ccnc1)c1ccc(F)cn1	ZINC000819059343	CD	On-Demand	Anodyne	NAMPT	22	41
CNC(=O)CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819059350	CD	On-Demand	Anodyne	ADRB2	63	42
CNC(=O)CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819059350	CD	On-Demand	Anodyne	ADRB1	66	53
CNC(=O)CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819059350	CD	On-Demand	Anodyne	ADRB3	87	53
CNC(=O)CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819059351	CD	On-Demand	Anodyne	ADRB2	63	42
CNC(=O)CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819059351	CD	On-Demand	Anodyne	ADRB1	66	53
CNC(=O)CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819059351	CD	On-Demand	Anodyne	ADRB3	87	53
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3cccnc3)CC1)C2	ZINC000819059395	FD	On-Demand	Anodyne	CHRNA7	42	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3cccnc3)CC1)C2	ZINC000819059396	FD	On-Demand	Anodyne	CHRNA7	42	35
O=C(CCNC1CCN(C[C@@H]2CCCO2)CC1)Nc1cccnc1	ZINC000819059466	ED	On-Demand	Anodyne	CHRNA7	22	40
O=C(CCNC1CCN(C[C@H]2CCCO2)CC1)Nc1cccnc1	ZINC000819059467	ED	On-Demand	Anodyne	CHRNA7	22	40
O=C(CCNC1CCN(C[C@H]2CCCO2)CC1)Nc1cccc(C(F)(F)F)c1	ZINC000819059484	GG	On-Demand	Anodyne	CCR3	15	43
O=C(CCNC1CCN(C[C@H]2CCCO2)CC1)Nc1cccc(C(F)(F)F)c1	ZINC000819059484	GG	On-Demand	Anodyne	CCR2	53	45
O=C(CCNC1CCN(C[C@H]2CCCO2)CC1)Nc1cccc(C(F)(F)F)c1	ZINC000819059484	GG	On-Demand	Anodyne	EPHX2	22	44
O=C(CCNC1CCN(C[C@@H]2CCCO2)CC1)Nc1cccc(C(F)(F)F)c1	ZINC000819059485	GG	On-Demand	Anodyne	CCR3	15	43
O=C(CCNC1CCN(C[C@@H]2CCCO2)CC1)Nc1cccc(C(F)(F)F)c1	ZINC000819059485	GG	On-Demand	Anodyne	CCR2	53	45
O=C(CCNC1CCN(C[C@@H]2CCCO2)CC1)Nc1cccc(C(F)(F)F)c1	ZINC000819059485	GG	On-Demand	Anodyne	EPHX2	22	44
CC(C)(C)OC(=O)N1CCCC[C@@H](NCCS(C)(=O)=O)C1	ZINC000819059515	DD	On-Demand	Anodyne	GPR119	40	39
CC(C)(C)OC(=O)N1CCCC[C@H](NCCS(C)(=O)=O)C1	ZINC000819059517	DD	On-Demand	Anodyne	GPR119	40	39
O=C(CCNC1CCN(C[C@H]2CCCO2)CC1)Nc1cccc(Cl)c1	ZINC000819059543	FF	On-Demand	Anodyne	DRD4	15	44
O=C(CCNC1CCN(C[C@@H]2CCCO2)CC1)Nc1cccc(Cl)c1	ZINC000819059545	FF	On-Demand	Anodyne	DRD4	15	44
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3C)c2c1	ZINC000819059546	EG	On-Demand	Anodyne	HTR1A	19	49
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3C)c2c1	ZINC000819059546	EG	On-Demand	Anodyne	HTR1D	28	47
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3C)c2c1	ZINC000819059546	EG	On-Demand	Anodyne	SLC6A4	17	51
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3C)c2c1	ZINC000819059546	EG	On-Demand	Anodyne	MPO	98	51
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3C)c2c1	ZINC000819059546	EG	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3C)c2c1	ZINC000819059546	EG	On-Demand	Anodyne	MTNR1A	33	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3C)c2c1	ZINC000819059546	EG	On-Demand	Anodyne	MTNR1B	18	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3C)c2c1	ZINC000819059548	EG	On-Demand	Anodyne	HTR1A	19	49
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3C)c2c1	ZINC000819059548	EG	On-Demand	Anodyne	HTR1D	28	47
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3C)c2c1	ZINC000819059548	EG	On-Demand	Anodyne	SLC6A4	17	51
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3C)c2c1	ZINC000819059548	EG	On-Demand	Anodyne	MPO	98	51
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3C)c2c1	ZINC000819059548	EG	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3C)c2c1	ZINC000819059548	EG	On-Demand	Anodyne	MTNR1A	33	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3C)c2c1	ZINC000819059548	EG	On-Demand	Anodyne	MTNR1B	18	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3Cl)c2c1	ZINC000819059549	EH	On-Demand	Anodyne	HTR1A	18	54
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3Cl)c2c1	ZINC000819059549	EH	On-Demand	Anodyne	HTR1D	42	49
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3Cl)c2c1	ZINC000819059549	EH	On-Demand	Anodyne	HTR1B	37	49
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3Cl)c2c1	ZINC000819059549	EH	On-Demand	Anodyne	ADRB3	29	54
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3Cl)c2c1	ZINC000819059549	EH	On-Demand	Anodyne	NQO2	22	53
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3Cl)c2c1	ZINC000819059549	EH	On-Demand	Anodyne	MPO	77	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3Cl)c2c1	ZINC000819059549	EH	On-Demand	Anodyne	HTR1E	15	43
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3Cl)c2c1	ZINC000819059549	EH	On-Demand	Anodyne	MTNR1A	52	54
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3Cl)c2c1	ZINC000819059549	EH	On-Demand	Anodyne	MTNR1B	37	53
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(Cl)ccc1N1CCCCC1	ZINC000819059576	EI	On-Demand	Anodyne	CNR1	50	31
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(Cl)ccc1N1CCCCC1	ZINC000819059576	EI	On-Demand	Anodyne	KCNQ2	44	38
Cc1cc(F)ccc1[C@@H](O)CNCCCCn1ccnc1	ZINC000819059579	CE	On-Demand	Anodyne	TBXAS1	48	45
Cc1cc(F)ccc1[C@@H](O)CNCCCCn1ccnc1	ZINC000819059579	CE	On-Demand	Anodyne	HMOX2	47	33
Cc1cc(F)ccc1[C@@H](O)CNCCCCn1ccnc1	ZINC000819059579	CE	On-Demand	Anodyne	LEF	40	32
O=C(/C=C/[C@H]1CCCO1)Nc1cc(Cl)ccc1N1CCCCC1	ZINC000819059583	EI	On-Demand	Anodyne	CNR1	50	31
O=C(/C=C/[C@H]1CCCO1)Nc1cc(Cl)ccc1N1CCCCC1	ZINC000819059583	EI	On-Demand	Anodyne	KCNQ2	44	38
O=C(/C=C\[C@H]1CCCO1)Nc1cc(Cl)ccc1N1CCCCC1	ZINC000819059585	EI	On-Demand	Anodyne	CNR1	50	31
O=C(/C=C\[C@H]1CCCO1)Nc1cc(Cl)ccc1N1CCCCC1	ZINC000819059585	EI	On-Demand	Anodyne	KCNQ2	44	38
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059588	GD	On-Demand	Anodyne	ADRB2	29	43
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059588	GD	On-Demand	Anodyne	ADRB1	44	49
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059588	GD	On-Demand	Anodyne	ADRB3	32	45
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059588	GD	On-Demand	Anodyne	ABCB1	17	42
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(Cl)ccc1N1CCCCC1	ZINC000819059589	EI	On-Demand	Anodyne	CNR1	50	31
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(Cl)ccc1N1CCCCC1	ZINC000819059589	EI	On-Demand	Anodyne	KCNQ2	44	38
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059594	GD	On-Demand	Anodyne	ADRB2	29	43
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059594	GD	On-Demand	Anodyne	ADRB1	44	49
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059594	GD	On-Demand	Anodyne	ADRB3	32	45
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819059594	GD	On-Demand	Anodyne	ABCB1	17	42
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059598	GD	On-Demand	Anodyne	ADRB2	29	43
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059598	GD	On-Demand	Anodyne	ADRB1	44	49
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059598	GD	On-Demand	Anodyne	ADRB3	32	45
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059598	GD	On-Demand	Anodyne	ABCB1	17	42
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059604	GD	On-Demand	Anodyne	ADRB2	29	43
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059604	GD	On-Demand	Anodyne	ADRB1	44	49
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059604	GD	On-Demand	Anodyne	ADRB3	32	45
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819059604	GD	On-Demand	Anodyne	ABCB1	17	42
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819059630	GF	On-Demand	Anodyne	ADRB2	38	45
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819059630	GF	On-Demand	Anodyne	ADRB1	38	45
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819059630	GF	On-Demand	Anodyne	ADRB3	26	43
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819059630	GF	On-Demand	Anodyne	ABCB1	39	45
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819059630	GF	On-Demand	Anodyne	GPR119	34	47
CON(C)C(=O)CCNC[C@@H]1CCCN1C	ZINC000819059633	BC	On-Demand	Anodyne	CHRNA10	49	34
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819059635	GF	On-Demand	Anodyne	ADRB2	38	45
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819059635	GF	On-Demand	Anodyne	ADRB1	38	45
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819059635	GF	On-Demand	Anodyne	ADRB3	26	43
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819059635	GF	On-Demand	Anodyne	ABCB1	39	45
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819059635	GF	On-Demand	Anodyne	GPR119	34	47
CON(C)C(=O)CCNC[C@H]1CCCN1C	ZINC000819059636	BC	On-Demand	Anodyne	CHRNA10	49	34
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819059642	GF	On-Demand	Anodyne	ADRB2	38	45
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819059642	GF	On-Demand	Anodyne	ADRB1	38	45
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819059642	GF	On-Demand	Anodyne	ADRB3	26	43
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819059642	GF	On-Demand	Anodyne	ABCB1	39	45
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819059642	GF	On-Demand	Anodyne	GPR119	34	47
O[C@@H](CNCCCCn1ccnc1)c1cccc2ccccc12	ZINC000819059645	DG	On-Demand	Anodyne	CYP19A1	18	40
O[C@@H](CNCCCCn1ccnc1)c1cccc2ccccc12	ZINC000819059645	DG	On-Demand	Anodyne	TBXAS1	63	47
O[C@@H](CNCCCCn1ccnc1)c1cccc2ccccc12	ZINC000819059645	DG	On-Demand	Anodyne	HMOX1	30	40
O[C@@H](CNCCCCn1ccnc1)c1cccc2ccccc12	ZINC000819059645	DG	On-Demand	Anodyne	HMOX2	52	40
O[C@@H](CNCCCCn1ccnc1)c1cccc2ccccc12	ZINC000819059645	DG	On-Demand	Anodyne	QPCT	42	45
O[C@@H](CNCCCCn1ccnc1)c1cccc2ccccc12	ZINC000819059645	DG	On-Demand	Anodyne	CYP27B1	47	38
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819059647	GF	On-Demand	Anodyne	ADRB2	38	45
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819059647	GF	On-Demand	Anodyne	ADRB1	38	45
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819059647	GF	On-Demand	Anodyne	ADRB3	26	43
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819059647	GF	On-Demand	Anodyne	ABCB1	39	45
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819059647	GF	On-Demand	Anodyne	GPR119	34	47
O[C@@H](CNCCCCn1ccnc1)c1ccc(Cl)cc1Cl	ZINC000819059688	EG	On-Demand	Anodyne	TBXAS1	53	51
O[C@@H](CNCCCCn1ccnc1)c1ccc(Cl)cc1Cl	ZINC000819059688	EG	On-Demand	Anodyne	HMOX1	33	41
O[C@@H](CNCCCCn1ccnc1)c1ccc(Cl)cc1Cl	ZINC000819059688	EG	On-Demand	Anodyne	HMOX2	56	44
O[C@@H](CNCCCCn1ccnc1)c1ccc(Cl)cc1Cl	ZINC000819059688	EG	On-Demand	Anodyne	QPCT	38	40
O[C@H](CNCCCCn1ccnc1)c1ccc(Cl)cc1Cl	ZINC000819059690	EG	On-Demand	Anodyne	TBXAS1	53	51
O[C@H](CNCCCCn1ccnc1)c1ccc(Cl)cc1Cl	ZINC000819059690	EG	On-Demand	Anodyne	HMOX1	33	41
O[C@H](CNCCCCn1ccnc1)c1ccc(Cl)cc1Cl	ZINC000819059690	EG	On-Demand	Anodyne	HMOX2	56	44
O[C@H](CNCCCCn1ccnc1)c1ccc(Cl)cc1Cl	ZINC000819059690	EG	On-Demand	Anodyne	QPCT	38	40
O=C(CCNC1CCN(C[C@H]2CCCO2)CC1)Nc1cccc(F)c1	ZINC000819059708	EE	On-Demand	Anodyne	CCR3	47	42
C[C@H](NC[C@H](O)C1CC1)C(=O)N1CCCC[C@@H]1C	ZINC000819059719	CD	On-Demand	Anodyne	ACE	25	46
O=C(/C=C/[C@H]1CCCO1)Nc1ccccc1C(=O)N1CCCC1	ZINC000819059720	DF	On-Demand	Anodyne	RBP4	32	40
O=C(/C=C/[C@H]1CCCO1)Nc1ccccc1C(=O)N1CCCC1	ZINC000819059720	DF	On-Demand	Anodyne	NPSR1	15	46
O=C(/C=C/[C@H]1CCCO1)Nc1ccccc1C(=O)N1CCCC1	ZINC000819059720	DF	On-Demand	Anodyne	L3MBTL3	53	40
O=C(/C=C\[C@H]1CCCO1)Nc1ccccc1C(=O)N1CCCC1	ZINC000819059722	DF	On-Demand	Anodyne	RBP4	32	40
O=C(/C=C\[C@H]1CCCO1)Nc1ccccc1C(=O)N1CCCC1	ZINC000819059722	DF	On-Demand	Anodyne	NPSR1	15	46
O=C(/C=C\[C@H]1CCCO1)Nc1ccccc1C(=O)N1CCCC1	ZINC000819059722	DF	On-Demand	Anodyne	L3MBTL3	53	40
O=C(/C=C\[C@@H]1CCCO1)Nc1ccccc1C(=O)N1CCCC1	ZINC000819059724	DF	On-Demand	Anodyne	RBP4	32	40
O=C(/C=C\[C@@H]1CCCO1)Nc1ccccc1C(=O)N1CCCC1	ZINC000819059724	DF	On-Demand	Anodyne	NPSR1	15	46
O=C(/C=C\[C@@H]1CCCO1)Nc1ccccc1C(=O)N1CCCC1	ZINC000819059724	DF	On-Demand	Anodyne	L3MBTL3	53	40
C[C@H](NC[C@H](O)C1CC1)C(=O)N1CCCC[C@H]1C	ZINC000819059726	CD	On-Demand	Anodyne	ACE	25	46
O=C(/C=C/[C@@H]1CCCO1)Nc1ccccc1C(=O)N1CCCC1	ZINC000819059733	DF	On-Demand	Anodyne	RBP4	32	40
O=C(/C=C/[C@@H]1CCCO1)Nc1ccccc1C(=O)N1CCCC1	ZINC000819059733	DF	On-Demand	Anodyne	NPSR1	15	46
O=C(/C=C/[C@@H]1CCCO1)Nc1ccccc1C(=O)N1CCCC1	ZINC000819059733	DF	On-Demand	Anodyne	L3MBTL3	53	40
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819059749	DH	On-Demand	Anodyne	ADRB2	55	54
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819059749	DH	On-Demand	Anodyne	ADRB1	47	58
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819059749	DH	On-Demand	Anodyne	ADRB3	63	50
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819059751	DH	On-Demand	Anodyne	ADRB2	55	54
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819059751	DH	On-Demand	Anodyne	ADRB1	47	58
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819059751	DH	On-Demand	Anodyne	ADRB3	63	50
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819059754	FG	On-Demand	Anodyne	SSTR2	52	38
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819059754	FG	On-Demand	Anodyne	GPR119	41	47
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819059754	FG	On-Demand	Anodyne	SFRP1	46	38
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819059754	FG	On-Demand	Anodyne	WNT3	42	35
C[C@H](NC[C@H](O)c1ccc(Cl)cc1Cl)C(=O)N1CCCC[C@@H]1C	ZINC000819059755	FG	On-Demand	Anodyne	DPP7	16	45
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819059756	FG	On-Demand	Anodyne	SSTR2	52	38
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819059756	FG	On-Demand	Anodyne	GPR119	41	47
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819059756	FG	On-Demand	Anodyne	SFRP1	46	38
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819059756	FG	On-Demand	Anodyne	WNT3	42	35
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819059758	FG	On-Demand	Anodyne	SSTR2	52	38
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819059758	FG	On-Demand	Anodyne	GPR119	41	47
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819059758	FG	On-Demand	Anodyne	SFRP1	46	38
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819059758	FG	On-Demand	Anodyne	WNT3	42	35
C[C@H](NC[C@H](O)c1ccc(Cl)cc1Cl)C(=O)N1CCCC[C@H]1C	ZINC000819059759	FG	On-Demand	Anodyne	DPP7	16	45
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819059761	FG	On-Demand	Anodyne	SSTR2	52	38
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819059761	FG	On-Demand	Anodyne	GPR119	41	47
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819059761	FG	On-Demand	Anodyne	SFRP1	46	38
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819059761	FG	On-Demand	Anodyne	WNT3	42	35
C[C@@]1(CNC[C@H](O)c2cccc(Cl)c2)CCOC1	ZINC000819059775	CE	On-Demand	Anodyne	ADRB1	26	40
C[C@@]1(CNC[C@H](O)c2cccc(Cl)c2)CCOC1	ZINC000819059775	CE	On-Demand	Anodyne	ADRB3	40	41
C[C@@]1(CNC[C@H](O)c2cccc(Cl)c2)CCOC1	ZINC000819059775	CE	On-Demand	Anodyne	CYP3A4	41	36
COc1cccc(C[C@H](C)NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819059777	GG	On-Demand	Anodyne	MMP13	15	45
COc1cccc(C[C@H](C)NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819059777	GG	On-Demand	Anodyne	GPR119	43	51
C[C@@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCOC1	ZINC000819059778	CE	On-Demand	Anodyne	ADRB1	26	40
C[C@@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCOC1	ZINC000819059778	CE	On-Demand	Anodyne	ADRB3	40	41
C[C@@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCOC1	ZINC000819059778	CE	On-Demand	Anodyne	CYP3A4	41	36
C[C@]1(CNC[C@H](O)c2cccc(Cl)c2)CCOC1	ZINC000819059780	CE	On-Demand	Anodyne	ADRB1	26	40
C[C@]1(CNC[C@H](O)c2cccc(Cl)c2)CCOC1	ZINC000819059780	CE	On-Demand	Anodyne	ADRB3	40	41
C[C@]1(CNC[C@H](O)c2cccc(Cl)c2)CCOC1	ZINC000819059780	CE	On-Demand	Anodyne	CYP3A4	41	36
COc1cccc(C[C@H](C)NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819059781	GG	On-Demand	Anodyne	MMP13	15	45
COc1cccc(C[C@H](C)NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819059781	GG	On-Demand	Anodyne	GPR119	43	51
C[C@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCOC1	ZINC000819059783	CE	On-Demand	Anodyne	ADRB1	26	40
C[C@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCOC1	ZINC000819059783	CE	On-Demand	Anodyne	ADRB3	40	41
C[C@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCOC1	ZINC000819059783	CE	On-Demand	Anodyne	CYP3A4	41	36
COc1cccc(C[C@@H](C)NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819059785	GG	On-Demand	Anodyne	MMP13	15	45
COc1cccc(C[C@@H](C)NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819059785	GG	On-Demand	Anodyne	GPR119	43	51
COc1cccc(C[C@@H](C)NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819059788	GG	On-Demand	Anodyne	MMP13	15	45
COc1cccc(C[C@@H](C)NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819059788	GG	On-Demand	Anodyne	GPR119	43	51
COc1cccc(C[C@H](C)NC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819059790	DH	On-Demand	Anodyne	ADRB2	53	58
COc1cccc(C[C@H](C)NC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819059790	DH	On-Demand	Anodyne	ADRB1	36	51
COc1cccc(C[C@H](C)NC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819059790	DH	On-Demand	Anodyne	ADRB3	45	44
COc1cccc(C[C@H](C)NC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819059790	DH	On-Demand	Anodyne	IDH1	16	42
COc1cccc(C[C@H](C)NC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819059792	DH	On-Demand	Anodyne	ADRB2	53	58
COc1cccc(C[C@H](C)NC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819059792	DH	On-Demand	Anodyne	ADRB1	36	51
COc1cccc(C[C@H](C)NC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819059792	DH	On-Demand	Anodyne	ADRB3	45	44
COc1cccc(C[C@H](C)NC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819059792	DH	On-Demand	Anodyne	IDH1	16	42
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819059794	DH	On-Demand	Anodyne	ADRB2	53	58
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819059794	DH	On-Demand	Anodyne	ADRB1	36	51
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819059794	DH	On-Demand	Anodyne	ADRB3	45	44
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819059794	DH	On-Demand	Anodyne	IDH1	16	42
COc1cccc(C[C@@H](C)NC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819059797	DH	On-Demand	Anodyne	ADRB2	53	58
COc1cccc(C[C@@H](C)NC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819059797	DH	On-Demand	Anodyne	ADRB1	36	51
COc1cccc(C[C@@H](C)NC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819059797	DH	On-Demand	Anodyne	ADRB3	45	44
COc1cccc(C[C@@H](C)NC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819059797	DH	On-Demand	Anodyne	IDH1	16	42
COc1cccc(C[C@@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819059798	EF	On-Demand	Bother	ADRB2	49	41
COc1cccc(C[C@@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819059798	EF	On-Demand	Bother	ADRB1	41	52
COc1cccc(C[C@@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819059798	EF	On-Demand	Bother	ADRB3	70	46
COc1cccc(C[C@@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819059798	EF	On-Demand	Bother	CACNA1D	48	35
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819059799	EF	On-Demand	Bother	ADRB2	49	41
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819059799	EF	On-Demand	Bother	ADRB1	41	52
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819059799	EF	On-Demand	Bother	ADRB3	70	46
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819059799	EF	On-Demand	Bother	CACNA1D	48	35
COc1cccc(C[C@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819059801	EF	On-Demand	Bother	ADRB2	49	41
COc1cccc(C[C@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819059801	EF	On-Demand	Bother	ADRB1	41	52
COc1cccc(C[C@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819059801	EF	On-Demand	Bother	ADRB3	70	46
COc1cccc(C[C@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819059801	EF	On-Demand	Bother	CACNA1D	48	35
COc1cccc(C[C@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819059803	EF	On-Demand	Bother	ADRB2	49	41
COc1cccc(C[C@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819059803	EF	On-Demand	Bother	ADRB1	41	52
COc1cccc(C[C@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819059803	EF	On-Demand	Bother	ADRB3	70	46
COc1cccc(C[C@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819059803	EF	On-Demand	Bother	CACNA1D	48	35
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccccc2Br)c1	ZINC000819059834	FH	On-Demand	Anodyne	ADRB2	39	47
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccccc2Br)c1	ZINC000819059834	FH	On-Demand	Anodyne	ADRB1	26	47
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccccc2Br)c1	ZINC000819059834	FH	On-Demand	Anodyne	ADRB3	38	40
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccccc2Br)c1	ZINC000819059839	FH	On-Demand	Anodyne	ADRB2	39	47
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccccc2Br)c1	ZINC000819059839	FH	On-Demand	Anodyne	ADRB1	26	47
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccccc2Br)c1	ZINC000819059839	FH	On-Demand	Anodyne	ADRB3	38	40
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccccc2Br)c1	ZINC000819059842	FH	On-Demand	Anodyne	ADRB2	39	47
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccccc2Br)c1	ZINC000819059842	FH	On-Demand	Anodyne	ADRB1	26	47
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccccc2Br)c1	ZINC000819059842	FH	On-Demand	Anodyne	ADRB3	38	40
COc1cccc(C[C@H](C)NC[C@H](O)c2ccccc2Br)c1	ZINC000819059845	FH	On-Demand	Anodyne	ADRB2	39	47
COc1cccc(C[C@H](C)NC[C@H](O)c2ccccc2Br)c1	ZINC000819059845	FH	On-Demand	Anodyne	ADRB1	26	47
COc1cccc(C[C@H](C)NC[C@H](O)c2ccccc2Br)c1	ZINC000819059845	FH	On-Demand	Anodyne	ADRB3	38	40
O[C@@H](CNC[C@H]1OCCc2ccccc21)c1cccnc1	ZINC000819059854	CE	On-Demand	Anodyne	ADRB3	76	41
O[C@H](CNC[C@H]1OCCc2ccccc21)c1cccnc1	ZINC000819059856	CE	On-Demand	Anodyne	ADRB3	76	41
O[C@@H](CNC[C@@H]1OCCc2ccccc21)c1cccnc1	ZINC000819059859	CE	On-Demand	Anodyne	ADRB3	76	41
O[C@H](CNC[C@@H]1OCCc2ccccc21)c1cccnc1	ZINC000819059862	CE	On-Demand	Anodyne	ADRB3	76	41
C[C@]1(CNC[C@@H](O)c2cccnc2)CCOC1	ZINC000819059876	BD	On-Demand	Anodyne	ADRB2	19	40
C[C@]1(CNC[C@@H](O)c2cccnc2)CCOC1	ZINC000819059876	BD	On-Demand	Anodyne	ADRB1	21	40
C[C@]1(CNC[C@@H](O)c2cccnc2)CCOC1	ZINC000819059876	BD	On-Demand	Anodyne	ADRB3	83	41
C[C@@]1(CNC[C@@H](O)c2cccnc2)CCOC1	ZINC000819059877	BD	On-Demand	Anodyne	ADRB2	19	40
C[C@@]1(CNC[C@@H](O)c2cccnc2)CCOC1	ZINC000819059877	BD	On-Demand	Anodyne	ADRB1	21	40
C[C@@]1(CNC[C@@H](O)c2cccnc2)CCOC1	ZINC000819059877	BD	On-Demand	Anodyne	ADRB3	83	41
C[C@]1(CNC[C@H](O)c2cccnc2)CCOC1	ZINC000819059878	BD	On-Demand	Anodyne	ADRB2	19	40
C[C@]1(CNC[C@H](O)c2cccnc2)CCOC1	ZINC000819059878	BD	On-Demand	Anodyne	ADRB1	21	40
C[C@]1(CNC[C@H](O)c2cccnc2)CCOC1	ZINC000819059878	BD	On-Demand	Anodyne	ADRB3	83	41
C[C@@]1(CNC[C@H](O)c2cccnc2)CCOC1	ZINC000819059879	BD	On-Demand	Anodyne	ADRB2	19	40
C[C@@]1(CNC[C@H](O)c2cccnc2)CCOC1	ZINC000819059879	BD	On-Demand	Anodyne	ADRB1	21	40
C[C@@]1(CNC[C@H](O)c2cccnc2)CCOC1	ZINC000819059879	BD	On-Demand	Anodyne	ADRB3	83	41
O=C(CCNC1CCN(C[C@@H]2CCCO2)CC1)Nc1cccc(F)c1	ZINC000819059897	EE	On-Demand	Anodyne	CCR3	47	42
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H]1CCCc2ccccc21	ZINC000819059922	GI	On-Demand	Mild	PAPA1_CARPA	48	43
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H]1CCCc2ccccc21	ZINC000819059923	GI	On-Demand	Mild	PAPA1_CARPA	48	43
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc([N+](=O)[O-])cc3)c2c1	ZINC000819059937	FF	On-Demand	Bother	HTR1D	30	47
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc([N+](=O)[O-])cc3)c2c1	ZINC000819059937	FF	On-Demand	Bother	ADRB3	31	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc([N+](=O)[O-])cc3)c2c1	ZINC000819059937	FF	On-Demand	Bother	MPO	42	38
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc([N+](=O)[O-])cc3)c2c1	ZINC000819059937	FF	On-Demand	Bother	HTR1E	21	41
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc([N+](=O)[O-])cc3)c2c1	ZINC000819059937	FF	On-Demand	Bother	MTNR1A	46	54
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc([N+](=O)[O-])cc3)c2c1	ZINC000819059937	FF	On-Demand	Bother	MTNR1B	31	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc([N+](=O)[O-])cc3)c2c1	ZINC000819059940	FF	On-Demand	Bother	HTR1D	30	47
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc([N+](=O)[O-])cc3)c2c1	ZINC000819059940	FF	On-Demand	Bother	ADRB3	31	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc([N+](=O)[O-])cc3)c2c1	ZINC000819059940	FF	On-Demand	Bother	MPO	42	38
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc([N+](=O)[O-])cc3)c2c1	ZINC000819059940	FF	On-Demand	Bother	HTR1E	21	41
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc([N+](=O)[O-])cc3)c2c1	ZINC000819059940	FF	On-Demand	Bother	MTNR1A	46	54
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc([N+](=O)[O-])cc3)c2c1	ZINC000819059940	FF	On-Demand	Bother	MTNR1B	31	53
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1CCCC[C@@H]1C	ZINC000819059976	CE	On-Demand	Anodyne	ADRB1	22	43
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1CCCC[C@@H]1C	ZINC000819059976	CE	On-Demand	Anodyne	ACE	54	44
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1CCCC[C@@H]1C	ZINC000819059976	CE	On-Demand	Anodyne	ADRB3	47	43
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1CCCC[C@@H]1C	ZINC000819059976	CE	On-Demand	Anodyne	MME	19	44
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1CCCC[C@@H]1C	ZINC000819059976	CE	On-Demand	Anodyne	CPT1A	43	33
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1CCCC[C@@H]1C	ZINC000819059976	CE	On-Demand	Anodyne	PREP	35	43
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1CCCC[C@@H]1C	ZINC000819059976	CE	On-Demand	Anodyne	ACE2	36	40
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1CCCC[C@@H]1C	ZINC000819059976	CE	On-Demand	Anodyne	XIAP	57	43
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1CCCC[C@@H]1C	ZINC000819059976	CE	On-Demand	Anodyne	BIRC8	45	33
C[C@@H](NC[C@@H](O)c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000819059980	CE	On-Demand	Anodyne	ADRB1	22	43
C[C@@H](NC[C@@H](O)c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000819059980	CE	On-Demand	Anodyne	ACE	54	44
C[C@@H](NC[C@@H](O)c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000819059980	CE	On-Demand	Anodyne	ADRB3	47	43
C[C@@H](NC[C@@H](O)c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000819059980	CE	On-Demand	Anodyne	MME	19	44
C[C@@H](NC[C@@H](O)c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000819059980	CE	On-Demand	Anodyne	CPT1A	43	33
C[C@@H](NC[C@@H](O)c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000819059980	CE	On-Demand	Anodyne	PREP	35	43
C[C@@H](NC[C@@H](O)c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000819059980	CE	On-Demand	Anodyne	ACE2	36	40
C[C@@H](NC[C@@H](O)c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000819059980	CE	On-Demand	Anodyne	XIAP	57	43
C[C@@H](NC[C@@H](O)c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000819059980	CE	On-Demand	Anodyne	BIRC8	45	33
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819059984	CE	On-Demand	Anodyne	ADRB1	22	43
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819059984	CE	On-Demand	Anodyne	ACE	54	44
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819059984	CE	On-Demand	Anodyne	ADRB3	47	43
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819059984	CE	On-Demand	Anodyne	MME	19	44
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819059984	CE	On-Demand	Anodyne	CPT1A	43	33
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819059984	CE	On-Demand	Anodyne	PREP	35	43
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819059984	CE	On-Demand	Anodyne	ACE2	36	40
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819059984	CE	On-Demand	Anodyne	XIAP	57	43
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819059984	CE	On-Demand	Anodyne	BIRC8	45	33
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819059987	CE	On-Demand	Anodyne	ADRB1	22	43
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819059987	CE	On-Demand	Anodyne	ACE	54	44
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819059987	CE	On-Demand	Anodyne	ADRB3	47	43
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819059987	CE	On-Demand	Anodyne	MME	19	44
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819059987	CE	On-Demand	Anodyne	CPT1A	43	33
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819059987	CE	On-Demand	Anodyne	PREP	35	43
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819059987	CE	On-Demand	Anodyne	ACE2	36	40
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819059987	CE	On-Demand	Anodyne	XIAP	57	43
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819059987	CE	On-Demand	Anodyne	BIRC8	45	33
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000819059988	CE	On-Demand	Anodyne	ADRB1	22	43
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000819059988	CE	On-Demand	Anodyne	ACE	54	44
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000819059988	CE	On-Demand	Anodyne	ADRB3	47	43
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000819059988	CE	On-Demand	Anodyne	MME	19	44
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000819059988	CE	On-Demand	Anodyne	CPT1A	43	33
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000819059988	CE	On-Demand	Anodyne	PREP	35	43
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000819059988	CE	On-Demand	Anodyne	ACE2	36	40
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000819059988	CE	On-Demand	Anodyne	XIAP	57	43
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1CCCC[C@H]1C	ZINC000819059988	CE	On-Demand	Anodyne	BIRC8	45	33
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819060005	EC	On-Demand	Anodyne	ADRB2	27	42
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819060005	EC	On-Demand	Anodyne	ADRB1	33	43
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819060005	EC	On-Demand	Anodyne	ADRB3	110	52
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819060008	EC	On-Demand	Anodyne	ADRB2	27	42
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819060008	EC	On-Demand	Anodyne	ADRB1	33	43
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819060008	EC	On-Demand	Anodyne	ADRB3	110	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C(F)(F)F)cc3)c2c1	ZINC000819060009	GI	On-Demand	Anodyne	ADRB2	22	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C(F)(F)F)cc3)c2c1	ZINC000819060009	GI	On-Demand	Anodyne	HTR1D	32	48
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C(F)(F)F)cc3)c2c1	ZINC000819060009	GI	On-Demand	Anodyne	ADRB3	28	46
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C(F)(F)F)cc3)c2c1	ZINC000819060009	GI	On-Demand	Anodyne	MPO	67	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C(F)(F)F)cc3)c2c1	ZINC000819060009	GI	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C(F)(F)F)cc3)c2c1	ZINC000819060009	GI	On-Demand	Anodyne	MTNR1A	34	57
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C(F)(F)F)cc3)c2c1	ZINC000819060009	GI	On-Demand	Anodyne	MTNR1B	20	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C(F)(F)F)cc3)c2c1	ZINC000819060011	GI	On-Demand	Anodyne	ADRB2	22	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C(F)(F)F)cc3)c2c1	ZINC000819060011	GI	On-Demand	Anodyne	HTR1D	32	48
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C(F)(F)F)cc3)c2c1	ZINC000819060011	GI	On-Demand	Anodyne	ADRB3	28	46
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C(F)(F)F)cc3)c2c1	ZINC000819060011	GI	On-Demand	Anodyne	MPO	67	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C(F)(F)F)cc3)c2c1	ZINC000819060011	GI	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C(F)(F)F)cc3)c2c1	ZINC000819060011	GI	On-Demand	Anodyne	MTNR1A	34	57
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C(F)(F)F)cc3)c2c1	ZINC000819060011	GI	On-Demand	Anodyne	MTNR1B	20	53
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819060062	EH	On-Demand	Anodyne	ADRB2	51	46
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819060062	EH	On-Demand	Anodyne	ADRB1	36	53
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819060062	EH	On-Demand	Anodyne	ADRB3	53	53
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819060063	EH	On-Demand	Anodyne	ADRB2	51	46
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819060063	EH	On-Demand	Anodyne	ADRB1	36	53
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819060063	EH	On-Demand	Anodyne	ADRB3	53	53
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819060064	EH	On-Demand	Anodyne	ADRB2	51	46
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819060064	EH	On-Demand	Anodyne	ADRB1	36	53
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819060064	EH	On-Demand	Anodyne	ADRB3	53	53
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819060065	EH	On-Demand	Anodyne	ADRB2	51	46
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819060065	EH	On-Demand	Anodyne	ADRB1	36	53
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819060065	EH	On-Demand	Anodyne	ADRB3	53	53
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccccc2C)c1	ZINC000819060068	CG	On-Demand	Anodyne	ADRB2	45	41
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccccc2C)c1	ZINC000819060068	CG	On-Demand	Anodyne	ADRB1	27	48
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccccc2C)c1	ZINC000819060068	CG	On-Demand	Anodyne	ADRB3	38	41
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccccc2C)c1	ZINC000819060068	CG	On-Demand	Anodyne	MTNR1A	15	42
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccccc2C)c1	ZINC000819060069	CG	On-Demand	Anodyne	ADRB2	45	41
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccccc2C)c1	ZINC000819060069	CG	On-Demand	Anodyne	ADRB1	27	48
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccccc2C)c1	ZINC000819060069	CG	On-Demand	Anodyne	ADRB3	38	41
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccccc2C)c1	ZINC000819060069	CG	On-Demand	Anodyne	MTNR1A	15	42
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccccc2C)c1	ZINC000819060070	CG	On-Demand	Anodyne	ADRB2	45	41
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccccc2C)c1	ZINC000819060070	CG	On-Demand	Anodyne	ADRB1	27	48
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccccc2C)c1	ZINC000819060070	CG	On-Demand	Anodyne	ADRB3	38	41
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccccc2C)c1	ZINC000819060070	CG	On-Demand	Anodyne	MTNR1A	15	42
COc1cccc(C[C@H](C)NC[C@H](O)c2ccccc2C)c1	ZINC000819060071	CG	On-Demand	Anodyne	ADRB2	45	41
COc1cccc(C[C@H](C)NC[C@H](O)c2ccccc2C)c1	ZINC000819060071	CG	On-Demand	Anodyne	ADRB1	27	48
COc1cccc(C[C@H](C)NC[C@H](O)c2ccccc2C)c1	ZINC000819060071	CG	On-Demand	Anodyne	ADRB3	38	41
COc1cccc(C[C@H](C)NC[C@H](O)c2ccccc2C)c1	ZINC000819060071	CG	On-Demand	Anodyne	MTNR1A	15	42
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819060099	DG	On-Demand	Anodyne	ADRB1	22	45
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819060099	DG	On-Demand	Anodyne	BACE1	18	40
C[C@@H](NC[C@@H](O)c1cc2ccccc2o1)C(=O)N1CCCC[C@H]1C	ZINC000819060113	EF	On-Demand	Anodyne	CPT1A	60	36
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@@H](O)c1cc2ccccc2o1	ZINC000819060116	EF	On-Demand	Anodyne	CPT1A	60	36
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2ccc(F)cc2F)CC1	ZINC000819060119	GE	On-Demand	Anodyne	HTR2A	22	41
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2ccc(F)cc2F)CC1	ZINC000819060120	GE	On-Demand	Anodyne	HTR2A	22	41
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819060122	DG	On-Demand	Anodyne	ADRB1	22	45
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819060122	DG	On-Demand	Anodyne	BACE1	18	40
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819060123	DG	On-Demand	Anodyne	ADRB1	22	45
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819060123	DG	On-Demand	Anodyne	BACE1	18	40
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819060124	DG	On-Demand	Anodyne	ADRB1	22	45
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819060124	DG	On-Demand	Anodyne	BACE1	18	40
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819060140	EH	On-Demand	Anodyne	ADRB2	36	44
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819060140	EH	On-Demand	Anodyne	ADRB1	27	48
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819060140	EH	On-Demand	Anodyne	ADRB3	37	42
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819060142	EH	On-Demand	Anodyne	ADRB2	36	44
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819060142	EH	On-Demand	Anodyne	ADRB1	27	48
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819060142	EH	On-Demand	Anodyne	ADRB3	37	42
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819060146	EH	On-Demand	Anodyne	ADRB2	36	44
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819060146	EH	On-Demand	Anodyne	ADRB1	27	48
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819060146	EH	On-Demand	Anodyne	ADRB3	37	42
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819060148	EH	On-Demand	Anodyne	ADRB2	36	44
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819060148	EH	On-Demand	Anodyne	ADRB1	27	48
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819060148	EH	On-Demand	Anodyne	ADRB3	37	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cn3)c2c1	ZINC000819060150	EF	On-Demand	Anodyne	HTR1A	17	48
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cn3)c2c1	ZINC000819060150	EF	On-Demand	Anodyne	HTR1D	32	47
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cn3)c2c1	ZINC000819060150	EF	On-Demand	Anodyne	MPO	91	49
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cn3)c2c1	ZINC000819060150	EF	On-Demand	Anodyne	HTR1E	15	41
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cn3)c2c1	ZINC000819060150	EF	On-Demand	Anodyne	MTNR1A	32	51
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cn3)c2c1	ZINC000819060150	EF	On-Demand	Anodyne	MTNR1B	18	51
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cn3)c2c1	ZINC000819060152	EF	On-Demand	Anodyne	HTR1A	17	48
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cn3)c2c1	ZINC000819060152	EF	On-Demand	Anodyne	HTR1D	32	47
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cn3)c2c1	ZINC000819060152	EF	On-Demand	Anodyne	MPO	91	49
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cn3)c2c1	ZINC000819060152	EF	On-Demand	Anodyne	HTR1E	15	41
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cn3)c2c1	ZINC000819060152	EF	On-Demand	Anodyne	MTNR1A	32	51
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cn3)c2c1	ZINC000819060152	EF	On-Demand	Anodyne	MTNR1B	18	51
CC(C)(C)OC(=O)NC[C@](C)(O)CNC/C=C\c1ccccc1	ZINC000819060154	DF	On-Demand	Anodyne	PAPA1_CARPA	33	43
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC/C=C/c1ccccc1	ZINC000819060155	DF	On-Demand	Anodyne	PAPA1_CARPA	33	43
CC(C)(C)OC(=O)NC[C@](C)(O)CNC/C=C/c1ccccc1	ZINC000819060156	DF	On-Demand	Anodyne	PAPA1_CARPA	33	43
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC/C=C\c1ccccc1	ZINC000819060158	DF	On-Demand	Anodyne	PAPA1_CARPA	33	43
C[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1CCCC[C@H]1C	ZINC000819060178	FG	On-Demand	Anodyne	CACNA1B	44	32
C[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1CCCC[C@H]1C	ZINC000819060178	FG	On-Demand	Anodyne	CCR2	50	43
C[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1CCCC[C@H]1C	ZINC000819060178	FG	On-Demand	Anodyne	WNT3	40	33
C[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1CCCC[C@@H]1C	ZINC000819060180	FG	On-Demand	Anodyne	CACNA1B	44	32
C[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1CCCC[C@@H]1C	ZINC000819060180	FG	On-Demand	Anodyne	CCR2	50	43
C[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1CCCC[C@@H]1C	ZINC000819060180	FG	On-Demand	Anodyne	WNT3	40	33
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C(=O)N1CCCC[C@@H]1C	ZINC000819060188	GE	On-Demand	Anodyne	GPR119	21	41
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C(=O)N1CCCC[C@H]1C	ZINC000819060192	GE	On-Demand	Anodyne	GPR119	21	41
CC1(C)C[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819060204	CG	On-Demand	Anodyne	ADRB1	33	44
CC1(C)C[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819060204	CG	On-Demand	Anodyne	ADRB3	46	44
CC1(C)C[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819060209	CG	On-Demand	Anodyne	ADRB1	33	44
CC1(C)C[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819060209	CG	On-Demand	Anodyne	ADRB3	46	44
C[C@H](NC[C@H](O)c1ccccc1C(F)(F)F)C(=O)N1CCCC[C@H]1C	ZINC000819060222	FG	On-Demand	Anodyne	SFRP1	98	37
C[C@H](NC[C@H](O)c1ccccc1C(F)(F)F)C(=O)N1CCCC[C@H]1C	ZINC000819060222	FG	On-Demand	Anodyne	WNT3	73	37
C[C@H](NC[C@H](O)c1ccccc1C(F)(F)F)C(=O)N1CCCC[C@@H]1C	ZINC000819060224	FG	On-Demand	Anodyne	SFRP1	98	37
C[C@H](NC[C@H](O)c1ccccc1C(F)(F)F)C(=O)N1CCCC[C@@H]1C	ZINC000819060224	FG	On-Demand	Anodyne	WNT3	73	37
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCc3c(O)cccc32)CC1	ZINC000819060225	GF	On-Demand	Anodyne	GPR119	37	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCc3c(O)cccc32)CC1	ZINC000819060227	GF	On-Demand	Anodyne	GPR119	37	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCc3c(O)cccc32)CC1	ZINC000819060230	GF	On-Demand	Anodyne	GPR119	37	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCc3c(O)cccc32)CC1	ZINC000819060232	GF	On-Demand	Anodyne	GPR119	37	49
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819060234	FG	On-Demand	Anodyne	SSTR2	40	36
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819060234	FG	On-Demand	Anodyne	GPR119	44	48
C[C@H](NC[C@H](O)c1ccccc1Cl)C(=O)N1CCCC[C@H]1C	ZINC000819060235	DF	On-Demand	Anodyne	ACE	39	42
C[C@H](NC[C@H](O)c1ccccc1Cl)C(=O)N1CCCC[C@H]1C	ZINC000819060235	DF	On-Demand	Anodyne	OPRL1	39	44
C[C@H](NC[C@H](O)c1ccccc1Cl)C(=O)N1CCCC[C@H]1C	ZINC000819060235	DF	On-Demand	Anodyne	PREP	17	40
C[C@H](NC[C@H](O)c1ccccc1Cl)C(=O)N1CCCC[C@H]1C	ZINC000819060235	DF	On-Demand	Anodyne	DPP7	20	43
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819060236	FG	On-Demand	Anodyne	SSTR2	40	36
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819060236	FG	On-Demand	Anodyne	GPR119	44	48
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819060237	FG	On-Demand	Anodyne	SSTR2	40	36
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819060237	FG	On-Demand	Anodyne	GPR119	44	48
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819060238	FG	On-Demand	Anodyne	SSTR2	40	36
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819060238	FG	On-Demand	Anodyne	GPR119	44	48
CC(C)(C)OC(=O)N1CCCC[C@H](NCCC(=O)Nc2cccnc2)C1	ZINC000819060248	FF	On-Demand	Anodyne	GPR119	35	41
CC(C)(C)OC(=O)N1CCCC[C@H](NCCC(=O)Nc2cccnc2)C1	ZINC000819060248	FF	On-Demand	Anodyne	NAMPT	18	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NCCC(=O)Nc2cccnc2)C1	ZINC000819060249	FF	On-Demand	Anodyne	GPR119	35	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NCCC(=O)Nc2cccnc2)C1	ZINC000819060249	FF	On-Demand	Anodyne	NAMPT	18	40
Oc1nc2c(cc1CNC[C@H](O)c1cccnc1)CCC2	ZINC000819060251	CD	On-Demand	Anodyne	ADRB3	86	39
Oc1nc2c(cc1CNC[C@@H](O)c1cccnc1)CCC2	ZINC000819060252	CD	On-Demand	Anodyne	ADRB3	86	39
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2ccccc2F)CC1	ZINC000819060256	GE	On-Demand	Anodyne	SLC6A1	45	35
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2ccccc2F)CC1	ZINC000819060257	GE	On-Demand	Anodyne	SLC6A1	45	35
Cc1ccccc1[C@@H](O)CNCCN1CCN(C(=O)C2CCCCC2)CC1	ZINC000819060273	FE	On-Demand	Anodyne	SLC6A1	47	38
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819060287	FF	On-Demand	Anodyne	GPR119	46	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819060288	FF	On-Demand	Anodyne	GPR119	46	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819060289	FF	On-Demand	Anodyne	GPR119	46	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819060290	FF	On-Demand	Anodyne	GPR119	46	41
C[C@H](NC[C@H](O)c1ccccc1Cl)C(=O)N1CCCC[C@@H]1C	ZINC000819060298	DF	On-Demand	Anodyne	ACE	39	42
C[C@H](NC[C@H](O)c1ccccc1Cl)C(=O)N1CCCC[C@@H]1C	ZINC000819060298	DF	On-Demand	Anodyne	OPRL1	39	44
C[C@H](NC[C@H](O)c1ccccc1Cl)C(=O)N1CCCC[C@@H]1C	ZINC000819060298	DF	On-Demand	Anodyne	PREP	17	40
C[C@H](NC[C@H](O)c1ccccc1Cl)C(=O)N1CCCC[C@@H]1C	ZINC000819060298	DF	On-Demand	Anodyne	DPP7	20	43
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@H](O)c1ccccc1Cl	ZINC000819060299	DF	On-Demand	Anodyne	ACE	39	42
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@H](O)c1ccccc1Cl	ZINC000819060299	DF	On-Demand	Anodyne	OPRL1	39	44
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@H](O)c1ccccc1Cl	ZINC000819060299	DF	On-Demand	Anodyne	PREP	17	40
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@H](O)c1ccccc1Cl	ZINC000819060299	DF	On-Demand	Anodyne	DPP7	20	43
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C)c2c1	ZINC000819060302	DG	On-Demand	Anodyne	ADRB2	34	41
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C)c2c1	ZINC000819060302	DG	On-Demand	Anodyne	ADRB1	27	41
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C)c2c1	ZINC000819060302	DG	On-Demand	Anodyne	HTR1A	18	55
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C)c2c1	ZINC000819060302	DG	On-Demand	Anodyne	HTR1D	47	50
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C)c2c1	ZINC000819060302	DG	On-Demand	Anodyne	HTR1B	38	50
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C)c2c1	ZINC000819060302	DG	On-Demand	Anodyne	ADRB3	21	50
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C)c2c1	ZINC000819060302	DG	On-Demand	Anodyne	NQO2	24	54
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C)c2c1	ZINC000819060302	DG	On-Demand	Anodyne	MPO	60	41
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C)c2c1	ZINC000819060302	DG	On-Demand	Anodyne	HTR1E	22	44
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C)c2c1	ZINC000819060302	DG	On-Demand	Anodyne	MTNR1A	56	55
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C)c2c1	ZINC000819060302	DG	On-Demand	Anodyne	MTNR1B	40	54
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C)c2c1	ZINC000819060311	DG	On-Demand	Anodyne	ADRB2	34	41
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C)c2c1	ZINC000819060311	DG	On-Demand	Anodyne	ADRB1	27	41
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C)c2c1	ZINC000819060311	DG	On-Demand	Anodyne	HTR1A	18	55
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C)c2c1	ZINC000819060311	DG	On-Demand	Anodyne	HTR1D	47	50
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C)c2c1	ZINC000819060311	DG	On-Demand	Anodyne	HTR1B	38	50
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C)c2c1	ZINC000819060311	DG	On-Demand	Anodyne	ADRB3	21	50
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C)c2c1	ZINC000819060311	DG	On-Demand	Anodyne	NQO2	24	54
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C)c2c1	ZINC000819060311	DG	On-Demand	Anodyne	MPO	60	41
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C)c2c1	ZINC000819060311	DG	On-Demand	Anodyne	HTR1E	22	44
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C)c2c1	ZINC000819060311	DG	On-Demand	Anodyne	MTNR1A	56	55
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C)c2c1	ZINC000819060311	DG	On-Demand	Anodyne	MTNR1B	40	54
C[C@@H](OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)c1ccc(Cl)cc1	ZINC000819060337	GF	On-Demand	Anodyne	CASR	15	40
C[C@@H](OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)c1ccc(Cl)cc1	ZINC000819060339	GF	On-Demand	Anodyne	CASR	15	40
Oc1nc2c(cc1CNC[C@H](O)c1cccc(Cl)c1)CCC2	ZINC000819060400	DF	On-Demand	Anodyne	ADRB1	27	40
Oc1nc2c(cc1CNC[C@H](O)c1cccc(Cl)c1)CCC2	ZINC000819060400	DF	On-Demand	Anodyne	ADRB3	39	40
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COCc1ccccc1	ZINC000819060403	ED	On-Demand	Anodyne	ADRB2	17	42
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COCc1ccccc1	ZINC000819060403	ED	On-Demand	Anodyne	ADRB1	16	42
Oc1nc2c(cc1CNC[C@@H](O)c1cccc(Cl)c1)CCC2	ZINC000819060404	DF	On-Demand	Anodyne	ADRB1	27	40
Oc1nc2c(cc1CNC[C@@H](O)c1cccc(Cl)c1)CCC2	ZINC000819060404	DF	On-Demand	Anodyne	ADRB3	39	40
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COCc1ccccc1	ZINC000819060406	ED	On-Demand	Anodyne	ADRB2	17	42
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COCc1ccccc1	ZINC000819060406	ED	On-Demand	Anodyne	ADRB1	16	42
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COCc2ccccc2F)C1	ZINC000819060407	GG	On-Demand	Anodyne	GPR119	31	49
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COCc1ccccc1	ZINC000819060409	ED	On-Demand	Anodyne	ADRB2	17	42
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COCc1ccccc1	ZINC000819060409	ED	On-Demand	Anodyne	ADRB1	16	42
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COCc2ccccc2F)C1	ZINC000819060410	GG	On-Demand	Anodyne	GPR119	31	49
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COCc1ccccc1	ZINC000819060412	ED	On-Demand	Anodyne	ADRB2	17	42
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COCc1ccccc1	ZINC000819060412	ED	On-Demand	Anodyne	ADRB1	16	42
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COCc2ccccc2F)C1	ZINC000819060413	GG	On-Demand	Anodyne	GPR119	31	49
COc1ccc2[nH]cc(CCNC[C@H](O)C3CC3)c2c1	ZINC000819060414	CE	On-Demand	Anodyne	HTR1A	23	53
COc1ccc2[nH]cc(CCNC[C@H](O)C3CC3)c2c1	ZINC000819060414	CE	On-Demand	Anodyne	HTR1D	76	53
COc1ccc2[nH]cc(CCNC[C@H](O)C3CC3)c2c1	ZINC000819060414	CE	On-Demand	Anodyne	HTR1B	61	53
COc1ccc2[nH]cc(CCNC[C@H](O)C3CC3)c2c1	ZINC000819060414	CE	On-Demand	Anodyne	SLC6A4	16	50
COc1ccc2[nH]cc(CCNC[C@H](O)C3CC3)c2c1	ZINC000819060414	CE	On-Demand	Anodyne	NQO2	25	57
COc1ccc2[nH]cc(CCNC[C@H](O)C3CC3)c2c1	ZINC000819060414	CE	On-Demand	Anodyne	MPO	74	44
COc1ccc2[nH]cc(CCNC[C@H](O)C3CC3)c2c1	ZINC000819060414	CE	On-Demand	Anodyne	HTR1E	23	46
COc1ccc2[nH]cc(CCNC[C@H](O)C3CC3)c2c1	ZINC000819060414	CE	On-Demand	Anodyne	MTNR1A	58	58
COc1ccc2[nH]cc(CCNC[C@H](O)C3CC3)c2c1	ZINC000819060414	CE	On-Demand	Anodyne	MTNR1B	38	57
COc1ccc2[nH]cc(CCNC[C@H](O)C3CC3)c2c1	ZINC000819060414	CE	On-Demand	Anodyne	ABCG2	24	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COCc2ccccc2F)C1	ZINC000819060416	GG	On-Demand	Anodyne	GPR119	31	49
COc1ccc2[nH]cc(CCNC[C@@H](O)C3CC3)c2c1	ZINC000819060417	CE	On-Demand	Anodyne	HTR1A	23	53
COc1ccc2[nH]cc(CCNC[C@@H](O)C3CC3)c2c1	ZINC000819060417	CE	On-Demand	Anodyne	HTR1D	76	53
COc1ccc2[nH]cc(CCNC[C@@H](O)C3CC3)c2c1	ZINC000819060417	CE	On-Demand	Anodyne	HTR1B	61	53
COc1ccc2[nH]cc(CCNC[C@@H](O)C3CC3)c2c1	ZINC000819060417	CE	On-Demand	Anodyne	SLC6A4	16	50
COc1ccc2[nH]cc(CCNC[C@@H](O)C3CC3)c2c1	ZINC000819060417	CE	On-Demand	Anodyne	NQO2	25	57
COc1ccc2[nH]cc(CCNC[C@@H](O)C3CC3)c2c1	ZINC000819060417	CE	On-Demand	Anodyne	MPO	74	44
COc1ccc2[nH]cc(CCNC[C@@H](O)C3CC3)c2c1	ZINC000819060417	CE	On-Demand	Anodyne	HTR1E	23	46
COc1ccc2[nH]cc(CCNC[C@@H](O)C3CC3)c2c1	ZINC000819060417	CE	On-Demand	Anodyne	MTNR1A	58	58
COc1ccc2[nH]cc(CCNC[C@@H](O)C3CC3)c2c1	ZINC000819060417	CE	On-Demand	Anodyne	MTNR1B	38	57
COc1ccc2[nH]cc(CCNC[C@@H](O)C3CC3)c2c1	ZINC000819060417	CE	On-Demand	Anodyne	ABCG2	24	40
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819060475	FE	On-Demand	Anodyne	ADRB2	60	50
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819060475	FE	On-Demand	Anodyne	ADRB1	43	49
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819060475	FE	On-Demand	Anodyne	ADRB3	73	49
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819060477	FE	On-Demand	Anodyne	ADRB2	60	50
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819060477	FE	On-Demand	Anodyne	ADRB1	43	49
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819060477	FE	On-Demand	Anodyne	ADRB3	73	49
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819060478	FE	On-Demand	Anodyne	ADRB2	60	50
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819060478	FE	On-Demand	Anodyne	ADRB1	43	49
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819060478	FE	On-Demand	Anodyne	ADRB3	73	49
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819060480	FE	On-Demand	Anodyne	ADRB2	60	50
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819060480	FE	On-Demand	Anodyne	ADRB1	43	49
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819060480	FE	On-Demand	Anodyne	ADRB3	73	49
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(F)cn2)c1	ZINC000819060484	DE	On-Demand	Anodyne	ADRB1	21	42
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(F)cn2)c1	ZINC000819060486	DE	On-Demand	Anodyne	ADRB1	21	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819060487	GI	On-Demand	Anodyne	HTR1A	19	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819060487	GI	On-Demand	Anodyne	HTR1D	50	47
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819060487	GI	On-Demand	Anodyne	HTR1B	38	47
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819060487	GI	On-Demand	Anodyne	ADRB3	24	50
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819060487	GI	On-Demand	Anodyne	NQO2	24	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819060487	GI	On-Demand	Anodyne	MPO	63	41
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819060487	GI	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819060487	GI	On-Demand	Anodyne	MTNR1A	47	56
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819060487	GI	On-Demand	Anodyne	MTNR1B	32	52
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819060488	DE	On-Demand	Anodyne	ADRB1	21	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819060489	GI	On-Demand	Anodyne	HTR1A	19	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819060489	GI	On-Demand	Anodyne	HTR1D	50	47
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819060489	GI	On-Demand	Anodyne	HTR1B	38	47
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819060489	GI	On-Demand	Anodyne	ADRB3	24	50
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819060489	GI	On-Demand	Anodyne	NQO2	24	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819060489	GI	On-Demand	Anodyne	MPO	63	41
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819060489	GI	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819060489	GI	On-Demand	Anodyne	MTNR1A	47	56
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819060489	GI	On-Demand	Anodyne	MTNR1B	32	52
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819060490	DE	On-Demand	Anodyne	ADRB1	21	42
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)c1ccc(Cl)cc1	ZINC000819060502	EF	On-Demand	Anodyne	ADRB3	18	42
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)c1ccc(Cl)cc1	ZINC000819060504	EF	On-Demand	Anodyne	ADRB3	18	42
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)c1ccc(Cl)cc1	ZINC000819060507	EF	On-Demand	Anodyne	ADRB3	18	42
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)c1ccc(Cl)cc1	ZINC000819060510	EF	On-Demand	Anodyne	ADRB3	18	42
C[C@H](NC[C@H](O)c1ccc(F)cc1)C(=O)N1CCCC[C@H]1C	ZINC000819060526	DE	On-Demand	Anodyne	SLC6A3	17	40
C[C@H](NC[C@H](O)c1ccc(F)cc1)C(=O)N1CCCC[C@@H]1C	ZINC000819060527	DE	On-Demand	Anodyne	SLC6A3	17	40
COc1cccc(C[C@@H](C)NC[C@H](O)c2cccc(F)c2)c1	ZINC000819060556	DG	On-Demand	Anodyne	ADRB2	52	53
COc1cccc(C[C@@H](C)NC[C@H](O)c2cccc(F)c2)c1	ZINC000819060556	DG	On-Demand	Anodyne	ADRB1	40	54
COc1cccc(C[C@@H](C)NC[C@H](O)c2cccc(F)c2)c1	ZINC000819060556	DG	On-Demand	Anodyne	ADRB3	61	48
COc1cccc(C[C@@H](C)NC[C@H](O)c2cccc(F)c2)c1	ZINC000819060556	DG	On-Demand	Anodyne	BACE1	19	44
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cccc(F)c2)c1	ZINC000819060558	DG	On-Demand	Anodyne	ADRB2	52	53
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cccc(F)c2)c1	ZINC000819060558	DG	On-Demand	Anodyne	ADRB1	40	54
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cccc(F)c2)c1	ZINC000819060558	DG	On-Demand	Anodyne	ADRB3	61	48
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cccc(F)c2)c1	ZINC000819060558	DG	On-Demand	Anodyne	BACE1	19	44
COc1cccc(C[C@H](C)NC[C@@H](O)c2cccc(F)c2)c1	ZINC000819060560	DG	On-Demand	Anodyne	ADRB2	52	53
COc1cccc(C[C@H](C)NC[C@@H](O)c2cccc(F)c2)c1	ZINC000819060560	DG	On-Demand	Anodyne	ADRB1	40	54
COc1cccc(C[C@H](C)NC[C@@H](O)c2cccc(F)c2)c1	ZINC000819060560	DG	On-Demand	Anodyne	ADRB3	61	48
COc1cccc(C[C@H](C)NC[C@@H](O)c2cccc(F)c2)c1	ZINC000819060560	DG	On-Demand	Anodyne	BACE1	19	44
COc1cccc(C[C@H](C)NC[C@H](O)c2cccc(F)c2)c1	ZINC000819060562	DG	On-Demand	Anodyne	ADRB2	52	53
COc1cccc(C[C@H](C)NC[C@H](O)c2cccc(F)c2)c1	ZINC000819060562	DG	On-Demand	Anodyne	ADRB1	40	54
COc1cccc(C[C@H](C)NC[C@H](O)c2cccc(F)c2)c1	ZINC000819060562	DG	On-Demand	Anodyne	ADRB3	61	48
COc1cccc(C[C@H](C)NC[C@H](O)c2cccc(F)c2)c1	ZINC000819060562	DG	On-Demand	Anodyne	BACE1	19	44
O=C(NCCNC[C@@H](O)C1CC1)c1c(F)cccc1F	ZINC000819060567	CD	On-Demand	Anodyne	DAC	21	40
O=C(NCCNC[C@H](O)C1CC1)c1c(F)cccc1F	ZINC000819060568	CD	On-Demand	Anodyne	DAC	21	40
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2ccccc2Cl)CC1	ZINC000819060576	GF	On-Demand	Anodyne	DRD2	15	42
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2ccccc2Cl)CC1	ZINC000819060576	GF	On-Demand	Anodyne	DRD3	26	42
CON(C)C(=O)CCN[C@@H](C)C(=O)N1CCCC[C@H]1C	ZINC000819060600	CC	On-Demand	Anodyne	ACE	20	40
CON(C)C(=O)CCN[C@@H](C)C(=O)N1CCCC[C@H]1C	ZINC000819060600	CC	On-Demand	Anodyne	CELA1	46	36
CON(C)C(=O)CCN[C@H](C)C(=O)N1CCCC[C@@H]1C	ZINC000819060602	CC	On-Demand	Anodyne	ACE	20	40
CON(C)C(=O)CCN[C@H](C)C(=O)N1CCCC[C@@H]1C	ZINC000819060602	CC	On-Demand	Anodyne	CELA1	46	36
CON(C)C(=O)CCN[C@@H](C)C(=O)N1CCCC[C@@H]1C	ZINC000819060605	CC	On-Demand	Anodyne	ACE	20	40
CON(C)C(=O)CCN[C@@H](C)C(=O)N1CCCC[C@@H]1C	ZINC000819060605	CC	On-Demand	Anodyne	CELA1	46	36
CON(C)C(=O)CCN[C@H](C)C(=O)N1CCCC[C@H]1C	ZINC000819060607	CC	On-Demand	Anodyne	ACE	20	40
CON(C)C(=O)CCN[C@H](C)C(=O)N1CCCC[C@H]1C	ZINC000819060607	CC	On-Demand	Anodyne	CELA1	46	36
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)c(C)c1	ZINC000819060610	ED	On-Demand	Anodyne	ADRB2	37	46
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)c(C)c1	ZINC000819060610	ED	On-Demand	Anodyne	ADRB1	45	34
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)c(C)c1	ZINC000819060612	ED	On-Demand	Anodyne	ADRB2	37	46
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)c(C)c1	ZINC000819060612	ED	On-Demand	Anodyne	ADRB1	45	34
COc1cccc(C[C@@H](C)NC[C@H](O)c2cccc(Br)c2)c1	ZINC000819060623	FH	On-Demand	Anodyne	ADRB2	52	53
COc1cccc(C[C@@H](C)NC[C@H](O)c2cccc(Br)c2)c1	ZINC000819060623	FH	On-Demand	Anodyne	ADRB1	40	54
COc1cccc(C[C@@H](C)NC[C@H](O)c2cccc(Br)c2)c1	ZINC000819060623	FH	On-Demand	Anodyne	ADRB3	60	47
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819060625	FH	On-Demand	Anodyne	ADRB2	52	53
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819060625	FH	On-Demand	Anodyne	ADRB1	40	54
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819060625	FH	On-Demand	Anodyne	ADRB3	60	47
COc1cccc(C[C@H](C)NC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819060628	FH	On-Demand	Anodyne	ADRB2	52	53
COc1cccc(C[C@H](C)NC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819060628	FH	On-Demand	Anodyne	ADRB1	40	54
COc1cccc(C[C@H](C)NC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819060628	FH	On-Demand	Anodyne	ADRB3	60	47
COc1cccc(C[C@H](C)NC[C@H](O)c2cccc(Br)c2)c1	ZINC000819060631	FH	On-Demand	Anodyne	ADRB2	52	53
COc1cccc(C[C@H](C)NC[C@H](O)c2cccc(Br)c2)c1	ZINC000819060631	FH	On-Demand	Anodyne	ADRB1	40	54
COc1cccc(C[C@H](C)NC[C@H](O)c2cccc(Br)c2)c1	ZINC000819060631	FH	On-Demand	Anodyne	ADRB3	60	47
C[C@H](NC[C@H](O)c1ccc(OC(F)(F)F)cc1)C(=O)N1CCCC[C@H]1C	ZINC000819060649	FF	On-Demand	Anodyne	CTSS	17	40
C[C@H](NC[C@H](O)c1ccc(OC(F)(F)F)cc1)C(=O)N1CCCC[C@@H]1C	ZINC000819060651	FF	On-Demand	Anodyne	CTSS	17	40
C[C@@]1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CCOC1	ZINC000819060659	CD	On-Demand	Bother	CACNA1D	46	32
C[C@@]1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCOC1	ZINC000819060661	CD	On-Demand	Bother	CACNA1D	46	32
C[C@]1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CCOC1	ZINC000819060663	CD	On-Demand	Bother	CACNA1D	46	32
C[C@]1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCOC1	ZINC000819060665	CD	On-Demand	Bother	CACNA1D	46	32
O[C@@H](CNCCCc1nnc2n1CCCCC2)c1cccnc1	ZINC000819060666	DD	On-Demand	Anodyne	ADRB2	27	43
O[C@@H](CNCCCc1nnc2n1CCCCC2)c1cccnc1	ZINC000819060666	DD	On-Demand	Anodyne	ADRB1	32	45
O[C@@H](CNCCCc1nnc2n1CCCCC2)c1cccnc1	ZINC000819060666	DD	On-Demand	Anodyne	ADRB3	105	51
O[C@H](CNCCCc1nnc2n1CCCCC2)c1cccnc1	ZINC000819060668	DD	On-Demand	Anodyne	ADRB2	27	43
O[C@H](CNCCCc1nnc2n1CCCCC2)c1cccnc1	ZINC000819060668	DD	On-Demand	Anodyne	ADRB1	32	45
O[C@H](CNCCCc1nnc2n1CCCCC2)c1cccnc1	ZINC000819060668	DD	On-Demand	Anodyne	ADRB3	105	51
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cc3ccccc3o2)c1	ZINC000819060684	EH	On-Demand	Anodyne	ADRB2	42	37
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cc3ccccc3o2)c1	ZINC000819060684	EH	On-Demand	Anodyne	ADRB1	23	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccccc1C(=O)N1CCCCC1)C2	ZINC000819060685	GG	On-Demand	Anodyne	NPSR1	15	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccccc1C(=O)N1CCCCC1)C2	ZINC000819060686	GG	On-Demand	Anodyne	NPSR1	15	42
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cccnc2)c1	ZINC000819060691	CE	On-Demand	Anodyne	ADRB2	65	52
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cccnc2)c1	ZINC000819060691	CE	On-Demand	Anodyne	ADRB1	53	59
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cccnc2)c1	ZINC000819060691	CE	On-Demand	Anodyne	ADRB3	108	59
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cccnc2)c1	ZINC000819060691	CE	On-Demand	Anodyne	PTAFR	21	44
COc1cccc(C[C@@H](C)NC[C@H](O)c2cccnc2)c1	ZINC000819060693	CE	On-Demand	Anodyne	ADRB2	65	52
COc1cccc(C[C@@H](C)NC[C@H](O)c2cccnc2)c1	ZINC000819060693	CE	On-Demand	Anodyne	ADRB1	53	59
COc1cccc(C[C@@H](C)NC[C@H](O)c2cccnc2)c1	ZINC000819060693	CE	On-Demand	Anodyne	ADRB3	108	59
COc1cccc(C[C@@H](C)NC[C@H](O)c2cccnc2)c1	ZINC000819060693	CE	On-Demand	Anodyne	PTAFR	21	44
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3)c2c1	ZINC000819060704	DG	On-Demand	Anodyne	ADRB2	54	46
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3)c2c1	ZINC000819060704	DG	On-Demand	Anodyne	ADRB1	62	41
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3)c2c1	ZINC000819060704	DG	On-Demand	Anodyne	HTR1A	20	55
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3)c2c1	ZINC000819060704	DG	On-Demand	Anodyne	HTR1D	68	53
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3)c2c1	ZINC000819060704	DG	On-Demand	Anodyne	HTR1B	52	53
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3)c2c1	ZINC000819060704	DG	On-Demand	Anodyne	ADRB3	81	58
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3)c2c1	ZINC000819060704	DG	On-Demand	Anodyne	NQO2	26	57
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3)c2c1	ZINC000819060704	DG	On-Demand	Anodyne	MPO	74	43
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3)c2c1	ZINC000819060704	DG	On-Demand	Anodyne	HTR1E	23	46
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3)c2c1	ZINC000819060704	DG	On-Demand	Anodyne	MTNR1A	70	58
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3)c2c1	ZINC000819060704	DG	On-Demand	Anodyne	MTNR1B	53	57
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3)c2c1	ZINC000819060704	DG	On-Demand	Anodyne	ABCG2	25	40
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3)c2c1	ZINC000819060705	DG	On-Demand	Anodyne	ADRB2	54	46
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3)c2c1	ZINC000819060705	DG	On-Demand	Anodyne	ADRB1	62	41
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3)c2c1	ZINC000819060705	DG	On-Demand	Anodyne	HTR1A	20	55
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3)c2c1	ZINC000819060705	DG	On-Demand	Anodyne	HTR1D	68	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3)c2c1	ZINC000819060705	DG	On-Demand	Anodyne	HTR1B	52	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3)c2c1	ZINC000819060705	DG	On-Demand	Anodyne	ADRB3	81	58
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3)c2c1	ZINC000819060705	DG	On-Demand	Anodyne	NQO2	26	57
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3)c2c1	ZINC000819060705	DG	On-Demand	Anodyne	MPO	74	43
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3)c2c1	ZINC000819060705	DG	On-Demand	Anodyne	HTR1E	23	46
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3)c2c1	ZINC000819060705	DG	On-Demand	Anodyne	MTNR1A	70	58
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3)c2c1	ZINC000819060705	DG	On-Demand	Anodyne	MTNR1B	53	57
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3)c2c1	ZINC000819060705	DG	On-Demand	Anodyne	ABCG2	25	40
COc1ccc2[nH]cc(CCNCCC(=O)Nc3ccc(N(C)C)cc3)c2c1	ZINC000819060706	GG	On-Demand	Anodyne	HTR1A	15	51
COc1ccc2[nH]cc(CCNCCC(=O)Nc3ccc(N(C)C)cc3)c2c1	ZINC000819060706	GG	On-Demand	Anodyne	HTR1D	51	50
COc1ccc2[nH]cc(CCNCCC(=O)Nc3ccc(N(C)C)cc3)c2c1	ZINC000819060706	GG	On-Demand	Anodyne	HTR1B	44	50
COc1ccc2[nH]cc(CCNCCC(=O)Nc3ccc(N(C)C)cc3)c2c1	ZINC000819060706	GG	On-Demand	Anodyne	NQO2	29	56
COc1ccc2[nH]cc(CCNCCC(=O)Nc3ccc(N(C)C)cc3)c2c1	ZINC000819060706	GG	On-Demand	Anodyne	MPO	49	40
COc1ccc2[nH]cc(CCNCCC(=O)Nc3ccc(N(C)C)cc3)c2c1	ZINC000819060706	GG	On-Demand	Anodyne	HTR1E	22	43
COc1ccc2[nH]cc(CCNCCC(=O)Nc3ccc(N(C)C)cc3)c2c1	ZINC000819060706	GG	On-Demand	Anodyne	MTNR1A	73	60
COc1ccc2[nH]cc(CCNCCC(=O)Nc3ccc(N(C)C)cc3)c2c1	ZINC000819060706	GG	On-Demand	Anodyne	MTNR1B	61	56
COc1ccc2[nH]cc(CCNCCC(=O)Nc3ccc(N(C)C)cc3)c2c1	ZINC000819060706	GG	On-Demand	Anodyne	ABCG2	25	40
COC(=O)[C@H](CO)NC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819060707	GC	On-Demand	Anodyne	SSTR2	46	33
COC(=O)[C@@H](CO)NC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819060708	GC	On-Demand	Anodyne	SSTR2	46	33
COC(=O)[C@@H](CO)NC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819060709	GC	On-Demand	Anodyne	SSTR2	46	33
COC(=O)[C@H](CO)NC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819060710	GC	On-Demand	Anodyne	SSTR2	46	33
C[C@@H](CCN(C)C)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819060711	EF	On-Demand	Anodyne	UTS2	41	32
C[C@@H](CCN(C)C)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819060712	EF	On-Demand	Anodyne	UTS2	41	32
C[C@H](NC[C@H](O)c1cccnc1)C(=O)N1CCCC[C@H]1C	ZINC000819060723	CD	On-Demand	Anodyne	ADRB1	26	49
C[C@H](NC[C@H](O)c1cccnc1)C(=O)N1CCCC[C@H]1C	ZINC000819060723	CD	On-Demand	Anodyne	ADRB3	82	49
C[C@H](NC[C@H](O)c1cccnc1)C(=O)N1CCCC[C@H]1C	ZINC000819060723	CD	On-Demand	Anodyne	CPT1A	42	36
C[C@H](NC[C@H](O)c1cccnc1)C(=O)N1CCCC[C@@H]1C	ZINC000819060726	CD	On-Demand	Anodyne	ADRB1	26	49
C[C@H](NC[C@H](O)c1cccnc1)C(=O)N1CCCC[C@@H]1C	ZINC000819060726	CD	On-Demand	Anodyne	ADRB3	82	49
C[C@H](NC[C@H](O)c1cccnc1)C(=O)N1CCCC[C@@H]1C	ZINC000819060726	CD	On-Demand	Anodyne	CPT1A	42	36
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C)cc3)c2c1	ZINC000819060731	DG	On-Demand	Anodyne	ADRB2	34	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C)cc3)c2c1	ZINC000819060731	DG	On-Demand	Anodyne	HTR1A	15	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C)cc3)c2c1	ZINC000819060731	DG	On-Demand	Anodyne	HTR1D	47	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C)cc3)c2c1	ZINC000819060731	DG	On-Demand	Anodyne	HTR1B	36	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C)cc3)c2c1	ZINC000819060731	DG	On-Demand	Anodyne	ADRB3	38	49
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C)cc3)c2c1	ZINC000819060731	DG	On-Demand	Anodyne	MPO	67	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C)cc3)c2c1	ZINC000819060731	DG	On-Demand	Anodyne	HTR1E	22	45
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C)cc3)c2c1	ZINC000819060731	DG	On-Demand	Anodyne	MTNR1A	43	57
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C)cc3)c2c1	ZINC000819060731	DG	On-Demand	Anodyne	MTNR1B	26	56
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C)cc3)c2c1	ZINC000819060731	DG	On-Demand	Anodyne	ABCG2	24	40
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C)cc3)c2c1	ZINC000819060732	DG	On-Demand	Anodyne	ADRB2	34	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C)cc3)c2c1	ZINC000819060732	DG	On-Demand	Anodyne	HTR1A	15	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C)cc3)c2c1	ZINC000819060732	DG	On-Demand	Anodyne	HTR1D	47	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C)cc3)c2c1	ZINC000819060732	DG	On-Demand	Anodyne	HTR1B	36	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C)cc3)c2c1	ZINC000819060732	DG	On-Demand	Anodyne	ADRB3	38	49
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C)cc3)c2c1	ZINC000819060732	DG	On-Demand	Anodyne	MPO	67	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C)cc3)c2c1	ZINC000819060732	DG	On-Demand	Anodyne	HTR1E	22	45
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C)cc3)c2c1	ZINC000819060732	DG	On-Demand	Anodyne	MTNR1A	43	57
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C)cc3)c2c1	ZINC000819060732	DG	On-Demand	Anodyne	MTNR1B	26	56
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C)cc3)c2c1	ZINC000819060732	DG	On-Demand	Anodyne	ABCG2	24	40
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1CCCC[C@H]1C	ZINC000819060740	DF	On-Demand	Anodyne	ADRB1	42	49
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1CCCC[C@H]1C	ZINC000819060740	DF	On-Demand	Anodyne	ADRB3	68	49
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1CCCC[C@H]1C	ZINC000819060740	DF	On-Demand	Anodyne	DPP7	15	43
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1CCCC[C@H]1C	ZINC000819060740	DF	On-Demand	Anodyne	CYP3A4	46	35
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1CCCC[C@@H]1C	ZINC000819060742	DF	On-Demand	Anodyne	ADRB1	42	49
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1CCCC[C@@H]1C	ZINC000819060742	DF	On-Demand	Anodyne	ADRB3	68	49
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1CCCC[C@@H]1C	ZINC000819060742	DF	On-Demand	Anodyne	DPP7	15	43
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1CCCC[C@@H]1C	ZINC000819060742	DF	On-Demand	Anodyne	CYP3A4	46	35
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819060743	EE	On-Demand	Anodyne	ADRB1	26	42
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819060743	EE	On-Demand	Anodyne	ADRB3	77	49
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819060743	EE	On-Demand	Anodyne	GPR119	44	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819060746	EE	On-Demand	Anodyne	ADRB1	26	42
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819060746	EE	On-Demand	Anodyne	ADRB3	77	49
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819060746	EE	On-Demand	Anodyne	GPR119	44	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819060748	EE	On-Demand	Anodyne	ADRB1	26	42
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819060748	EE	On-Demand	Anodyne	ADRB3	77	49
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819060748	EE	On-Demand	Anodyne	GPR119	44	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819060749	EE	On-Demand	Anodyne	ADRB1	26	42
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819060749	EE	On-Demand	Anodyne	ADRB3	77	49
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819060749	EE	On-Demand	Anodyne	GPR119	44	40
COc1ccc2[nH]cc(CCNC[C@@H](O)c3c(F)cccc3F)c2c1	ZINC000819060751	EG	On-Demand	Anodyne	HTR1A	20	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3c(F)cccc3F)c2c1	ZINC000819060751	EG	On-Demand	Anodyne	HTR1D	47	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3c(F)cccc3F)c2c1	ZINC000819060751	EG	On-Demand	Anodyne	HTR1B	34	40
COc1ccc2[nH]cc(CCNC[C@@H](O)c3c(F)cccc3F)c2c1	ZINC000819060751	EG	On-Demand	Anodyne	ADRB3	18	48
COc1ccc2[nH]cc(CCNC[C@@H](O)c3c(F)cccc3F)c2c1	ZINC000819060751	EG	On-Demand	Anodyne	NQO2	25	54
COc1ccc2[nH]cc(CCNC[C@@H](O)c3c(F)cccc3F)c2c1	ZINC000819060751	EG	On-Demand	Anodyne	MPO	100	46
COc1ccc2[nH]cc(CCNC[C@@H](O)c3c(F)cccc3F)c2c1	ZINC000819060751	EG	On-Demand	Anodyne	HTR1E	23	44
COc1ccc2[nH]cc(CCNC[C@@H](O)c3c(F)cccc3F)c2c1	ZINC000819060751	EG	On-Demand	Anodyne	MTNR1A	59	55
COc1ccc2[nH]cc(CCNC[C@@H](O)c3c(F)cccc3F)c2c1	ZINC000819060751	EG	On-Demand	Anodyne	MTNR1B	41	54
COc1ccc2[nH]cc(CCNC[C@@H](O)c3c(F)cccc3F)c2c1	ZINC000819060751	EG	On-Demand	Anodyne	ABCG2	25	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3c(F)cccc3F)c2c1	ZINC000819060753	EG	On-Demand	Anodyne	HTR1A	20	53
COc1ccc2[nH]cc(CCNC[C@H](O)c3c(F)cccc3F)c2c1	ZINC000819060753	EG	On-Demand	Anodyne	HTR1D	47	53
COc1ccc2[nH]cc(CCNC[C@H](O)c3c(F)cccc3F)c2c1	ZINC000819060753	EG	On-Demand	Anodyne	HTR1B	34	40
COc1ccc2[nH]cc(CCNC[C@H](O)c3c(F)cccc3F)c2c1	ZINC000819060753	EG	On-Demand	Anodyne	ADRB3	18	48
COc1ccc2[nH]cc(CCNC[C@H](O)c3c(F)cccc3F)c2c1	ZINC000819060753	EG	On-Demand	Anodyne	NQO2	25	54
COc1ccc2[nH]cc(CCNC[C@H](O)c3c(F)cccc3F)c2c1	ZINC000819060753	EG	On-Demand	Anodyne	MPO	100	46
COc1ccc2[nH]cc(CCNC[C@H](O)c3c(F)cccc3F)c2c1	ZINC000819060753	EG	On-Demand	Anodyne	HTR1E	23	44
COc1ccc2[nH]cc(CCNC[C@H](O)c3c(F)cccc3F)c2c1	ZINC000819060753	EG	On-Demand	Anodyne	MTNR1A	59	55
COc1ccc2[nH]cc(CCNC[C@H](O)c3c(F)cccc3F)c2c1	ZINC000819060753	EG	On-Demand	Anodyne	MTNR1B	41	54
COc1ccc2[nH]cc(CCNC[C@H](O)c3c(F)cccc3F)c2c1	ZINC000819060753	EG	On-Demand	Anodyne	ABCG2	25	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(F)c3)c2c1	ZINC000819060755	EG	On-Demand	Anodyne	ADRB2	42	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(F)c3)c2c1	ZINC000819060755	EG	On-Demand	Anodyne	ADRB1	44	41
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(F)c3)c2c1	ZINC000819060755	EG	On-Demand	Anodyne	HTR1A	19	49
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(F)c3)c2c1	ZINC000819060755	EG	On-Demand	Anodyne	HTR1D	41	48
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(F)c3)c2c1	ZINC000819060755	EG	On-Demand	Anodyne	HTR1B	35	48
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(F)c3)c2c1	ZINC000819060755	EG	On-Demand	Anodyne	SLC6A4	16	48
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(F)c3)c2c1	ZINC000819060755	EG	On-Demand	Anodyne	ADRB3	60	56
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(F)c3)c2c1	ZINC000819060755	EG	On-Demand	Anodyne	NQO2	26	53
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(F)c3)c2c1	ZINC000819060755	EG	On-Demand	Anodyne	MPO	94	49
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(F)c3)c2c1	ZINC000819060755	EG	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(F)c3)c2c1	ZINC000819060755	EG	On-Demand	Anodyne	MTNR1A	49	53
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(F)c3)c2c1	ZINC000819060755	EG	On-Demand	Anodyne	MTNR1B	33	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(F)c3)c2c1	ZINC000819060757	EG	On-Demand	Anodyne	ADRB2	42	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(F)c3)c2c1	ZINC000819060757	EG	On-Demand	Anodyne	ADRB1	44	41
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(F)c3)c2c1	ZINC000819060757	EG	On-Demand	Anodyne	HTR1A	19	49
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(F)c3)c2c1	ZINC000819060757	EG	On-Demand	Anodyne	HTR1D	41	48
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(F)c3)c2c1	ZINC000819060757	EG	On-Demand	Anodyne	HTR1B	35	48
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(F)c3)c2c1	ZINC000819060757	EG	On-Demand	Anodyne	SLC6A4	16	48
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(F)c3)c2c1	ZINC000819060757	EG	On-Demand	Anodyne	ADRB3	60	56
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(F)c3)c2c1	ZINC000819060757	EG	On-Demand	Anodyne	NQO2	26	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(F)c3)c2c1	ZINC000819060757	EG	On-Demand	Anodyne	MPO	94	49
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(F)c3)c2c1	ZINC000819060757	EG	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(F)c3)c2c1	ZINC000819060757	EG	On-Demand	Anodyne	MTNR1A	49	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(F)c3)c2c1	ZINC000819060757	EG	On-Demand	Anodyne	MTNR1B	33	53
N#CCc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819060824	FD	On-Demand	Mild	ADRB2	25	41
N#CCc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819060824	FD	On-Demand	Mild	ADRB1	35	48
N#CCc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819060824	FD	On-Demand	Mild	ADRB3	26	42
CC(C)(C)OC(=O)N1CCCC[C@H](NCCC(=O)Nc2ccccc2F)C1	ZINC000819060826	GH	On-Demand	Anodyne	GPR119	33	44
CC(C)(C)OC(=O)N1CCCC[C@@H](NCCC(=O)Nc2ccccc2F)C1	ZINC000819060828	GH	On-Demand	Anodyne	GPR119	33	44
N#CCc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819060830	FD	On-Demand	Mild	ADRB2	25	41
N#CCc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819060830	FD	On-Demand	Mild	ADRB1	35	48
N#CCc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819060830	FD	On-Demand	Mild	ADRB3	26	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060832	GE	On-Demand	Anodyne	ADRB2	41	44
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060832	GE	On-Demand	Anodyne	ADRB1	37	44
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060832	GE	On-Demand	Anodyne	HTR1D	37	47
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060832	GE	On-Demand	Anodyne	HTR1B	34	40
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060832	GE	On-Demand	Anodyne	ADRB3	70	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060832	GE	On-Demand	Anodyne	NQO2	26	54
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060832	GE	On-Demand	Anodyne	MPO	48	39
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060832	GE	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060832	GE	On-Demand	Anodyne	MTNR1A	49	55
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060832	GE	On-Demand	Anodyne	MTNR1B	31	54
N#CCc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819060833	FD	On-Demand	Mild	ADRB2	25	41
N#CCc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819060833	FD	On-Demand	Mild	ADRB1	35	48
N#CCc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819060833	FD	On-Demand	Mild	ADRB3	26	42
N#CCc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819060835	FD	On-Demand	Mild	ADRB2	25	41
N#CCc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819060835	FD	On-Demand	Mild	ADRB1	35	48
N#CCc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819060835	FD	On-Demand	Mild	ADRB3	26	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060836	GE	On-Demand	Anodyne	ADRB2	41	44
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060836	GE	On-Demand	Anodyne	ADRB1	37	44
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060836	GE	On-Demand	Anodyne	HTR1D	37	47
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060836	GE	On-Demand	Anodyne	HTR1B	34	40
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060836	GE	On-Demand	Anodyne	ADRB3	70	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060836	GE	On-Demand	Anodyne	NQO2	26	54
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060836	GE	On-Demand	Anodyne	MPO	48	39
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060836	GE	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060836	GE	On-Demand	Anodyne	MTNR1A	49	55
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)c2c1	ZINC000819060836	GE	On-Demand	Anodyne	MTNR1B	31	54
COc1cccc(C[C@H](C)NC[C@H](O)c2cccnc2)c1	ZINC000819060837	CE	On-Demand	Anodyne	ADRB2	65	52
COc1cccc(C[C@H](C)NC[C@H](O)c2cccnc2)c1	ZINC000819060837	CE	On-Demand	Anodyne	ADRB1	53	59
COc1cccc(C[C@H](C)NC[C@H](O)c2cccnc2)c1	ZINC000819060837	CE	On-Demand	Anodyne	ADRB3	108	59
COc1cccc(C[C@H](C)NC[C@H](O)c2cccnc2)c1	ZINC000819060837	CE	On-Demand	Anodyne	PTAFR	21	44
COc1cccc(C[C@H](C)NC[C@@H](O)c2cccnc2)c1	ZINC000819060841	CE	On-Demand	Anodyne	ADRB2	65	52
COc1cccc(C[C@H](C)NC[C@@H](O)c2cccnc2)c1	ZINC000819060841	CE	On-Demand	Anodyne	ADRB1	53	59
COc1cccc(C[C@H](C)NC[C@@H](O)c2cccnc2)c1	ZINC000819060841	CE	On-Demand	Anodyne	ADRB3	108	59
COc1cccc(C[C@H](C)NC[C@@H](O)c2cccnc2)c1	ZINC000819060841	CE	On-Demand	Anodyne	PTAFR	21	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCNC(=O)c2c(F)cccc2F)cc1	ZINC000819060868	GD	On-Demand	Anodyne	ADRB3	55	37
CS(=O)(=O)c1ccc([C@@H](O)CNCCNC(=O)c2c(F)cccc2F)cc1	ZINC000819060868	GD	On-Demand	Anodyne	CTSF	47	32
CS(=O)(=O)c1ccc([C@H](O)CNCCNC(=O)c2c(F)cccc2F)cc1	ZINC000819060870	GD	On-Demand	Anodyne	ADRB3	55	37
CS(=O)(=O)c1ccc([C@H](O)CNCCNC(=O)c2c(F)cccc2F)cc1	ZINC000819060870	GD	On-Demand	Anodyne	CTSF	47	32
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819060873	FH	On-Demand	Anodyne	ADRB2	52	43
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819060873	FH	On-Demand	Anodyne	ADRB1	32	49
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819060873	FH	On-Demand	Anodyne	GRIN2B	17	50
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819060873	FH	On-Demand	Anodyne	ADRB3	48	49
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819060882	FH	On-Demand	Anodyne	ADRB2	52	43
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819060882	FH	On-Demand	Anodyne	ADRB1	32	49
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819060882	FH	On-Demand	Anodyne	GRIN2B	17	50
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819060882	FH	On-Demand	Anodyne	ADRB3	48	49
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819060886	FH	On-Demand	Anodyne	ADRB2	52	43
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819060886	FH	On-Demand	Anodyne	ADRB1	32	49
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819060886	FH	On-Demand	Anodyne	GRIN2B	17	50
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819060886	FH	On-Demand	Anodyne	ADRB3	48	49
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819060891	FH	On-Demand	Anodyne	ADRB2	52	43
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819060891	FH	On-Demand	Anodyne	ADRB1	32	49
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819060891	FH	On-Demand	Anodyne	GRIN2B	17	50
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819060891	FH	On-Demand	Anodyne	ADRB3	48	49
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccccc1N1CCCC1)C2	ZINC000819060901	FG	On-Demand	Anodyne	KCNQ2	83	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccccc1N1CCCC1)C2	ZINC000819060905	FG	On-Demand	Anodyne	KCNQ2	83	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(O)c1	ZINC000819060911	GF	On-Demand	Anodyne	CTSD	100	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(O)c1	ZINC000819060911	GF	On-Demand	Anodyne	PGC	58	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(O)c1	ZINC000819060911	GF	On-Demand	Anodyne	CTSB	41	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(O)c1	ZINC000819060911	GF	On-Demand	Anodyne	PAPA1_CARPA	52	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(O)c1	ZINC000819060911	GF	On-Demand	Anodyne	CTSK	21	51
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(O)c1	ZINC000819060911	GF	On-Demand	Anodyne	CTSL	24	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(O)c1	ZINC000819060911	GF	On-Demand	Anodyne	PGA	46	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(O)c1	ZINC000819060911	GF	On-Demand	Anodyne	BACE2	58	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(O)c1	ZINC000819060911	GF	On-Demand	Anodyne	TACR3	15	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(O)c1	ZINC000819060911	GF	On-Demand	Anodyne	REN	76	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(O)c1	ZINC000819060911	GF	On-Demand	Anodyne	REN1	20	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(O)c1	ZINC000819060911	GF	On-Demand	Anodyne	BACE1	107	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(O)c1	ZINC000819060911	GF	On-Demand	Anodyne	FPR1	52	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(O)c1	ZINC000819060911	GF	On-Demand	Anodyne	PLM2_PLAFA	34	40
COc1cccc(C[C@@H](C)NCCS(C)(=O)=O)c1	ZINC000819060916	CD	On-Demand	Anodyne	MTNR1A	31	41
COc1cccc(C[C@@H](C)NCCS(C)(=O)=O)c1	ZINC000819060916	CD	On-Demand	Anodyne	MTNR1B	30	41
COc1cccc(C[C@@H](C)NCCS(C)(=O)=O)c1	ZINC000819060916	CD	On-Demand	Anodyne	ROCK2	24	41
COc1cccc(C[C@H](C)NCCS(C)(=O)=O)c1	ZINC000819060923	CD	On-Demand	Anodyne	MTNR1A	31	41
COc1cccc(C[C@H](C)NCCS(C)(=O)=O)c1	ZINC000819060923	CD	On-Demand	Anodyne	MTNR1B	30	41
COc1cccc(C[C@H](C)NCCS(C)(=O)=O)c1	ZINC000819060923	CD	On-Demand	Anodyne	ROCK2	24	41
COc1cccc(C[C@H](C)NC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819060929	DG	On-Demand	Anodyne	ADRB2	40	36
COc1cccc(C[C@H](C)NC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819060929	DG	On-Demand	Anodyne	ADRB1	24	48
COc1cccc(C[C@H](C)NC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819060929	DG	On-Demand	Anodyne	ADRB3	37	41
COc1cccc(C[C@H](C)NC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819060929	DG	On-Demand	Anodyne	BACE1	18	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cc3c(nc2O)CCC3)CC1	ZINC000819060930	GE	On-Demand	Anodyne	GPR119	36	45
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819060932	DG	On-Demand	Anodyne	ADRB2	40	36
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819060932	DG	On-Demand	Anodyne	ADRB1	24	48
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819060932	DG	On-Demand	Anodyne	ADRB3	37	41
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819060932	DG	On-Demand	Anodyne	BACE1	18	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cc3c(nc2O)CCC3)CC1	ZINC000819060933	GE	On-Demand	Anodyne	GPR119	36	45
COc1cccc(C[C@H](C)NC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819060934	DG	On-Demand	Anodyne	ADRB2	40	36
COc1cccc(C[C@H](C)NC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819060934	DG	On-Demand	Anodyne	ADRB1	24	48
COc1cccc(C[C@H](C)NC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819060934	DG	On-Demand	Anodyne	ADRB3	37	41
COc1cccc(C[C@H](C)NC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819060934	DG	On-Demand	Anodyne	BACE1	18	40
COc1cccc(C[C@@H](C)NC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819060938	DG	On-Demand	Anodyne	ADRB2	40	36
COc1cccc(C[C@@H](C)NC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819060938	DG	On-Demand	Anodyne	ADRB1	24	48
COc1cccc(C[C@@H](C)NC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819060938	DG	On-Demand	Anodyne	ADRB3	37	41
COc1cccc(C[C@@H](C)NC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819060938	DG	On-Demand	Anodyne	BACE1	18	40
CN(Cc1nc2ccccc2[nH]1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819060947	GG	On-Demand	Mild	PAPA1_CARPA	50	41
CN(Cc1nc2ccccc2[nH]1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819060947	GG	On-Demand	Mild	PIN1	35	40
CN(Cc1nc2ccccc2[nH]1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819060947	GG	On-Demand	Mild	CACNA1G	21	40
CN(Cc1nc2ccccc2[nH]1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819060951	GG	On-Demand	Mild	PAPA1_CARPA	50	41
CN(Cc1nc2ccccc2[nH]1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819060951	GG	On-Demand	Mild	PIN1	35	40
CN(Cc1nc2ccccc2[nH]1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819060951	GG	On-Demand	Mild	CACNA1G	21	40
O=C(NCCNC[C@H](O)c1ccc(F)cn1)c1c(F)cccc1F	ZINC000819060956	ED	On-Demand	Anodyne	DAC	21	40
CCC(CC)[C@@H](CNC[C@H](O)c1cccnc1)N1CCCC1	ZINC000819060958	DF	On-Demand	Anodyne	ADRB2	21	40
CCC(CC)[C@@H](CNC[C@H](O)c1cccnc1)N1CCCC1	ZINC000819060958	DF	On-Demand	Anodyne	ADRB1	22	40
CCC(CC)[C@@H](CNC[C@H](O)c1cccnc1)N1CCCC1	ZINC000819060958	DF	On-Demand	Anodyne	ADRB3	88	46
CCC(CC)[C@@H](CNC[C@@H](O)c1cccnc1)N1CCCC1	ZINC000819060960	DF	On-Demand	Anodyne	ADRB2	21	40
CCC(CC)[C@@H](CNC[C@@H](O)c1cccnc1)N1CCCC1	ZINC000819060960	DF	On-Demand	Anodyne	ADRB1	22	40
CCC(CC)[C@@H](CNC[C@@H](O)c1cccnc1)N1CCCC1	ZINC000819060960	DF	On-Demand	Anodyne	ADRB3	88	46
CCC(CC)[C@H](CNC[C@H](O)c1cccnc1)N1CCCC1	ZINC000819060962	DF	On-Demand	Anodyne	ADRB2	21	40
CCC(CC)[C@H](CNC[C@H](O)c1cccnc1)N1CCCC1	ZINC000819060962	DF	On-Demand	Anodyne	ADRB1	22	40
CCC(CC)[C@H](CNC[C@H](O)c1cccnc1)N1CCCC1	ZINC000819060962	DF	On-Demand	Anodyne	ADRB3	88	46
CCC(CC)[C@H](CNC[C@@H](O)c1cccnc1)N1CCCC1	ZINC000819060964	DF	On-Demand	Anodyne	ADRB2	21	40
CCC(CC)[C@H](CNC[C@@H](O)c1cccnc1)N1CCCC1	ZINC000819060964	DF	On-Demand	Anodyne	ADRB1	22	40
CCC(CC)[C@H](CNC[C@@H](O)c1cccnc1)N1CCCC1	ZINC000819060964	DF	On-Demand	Anodyne	ADRB3	88	46
O=C(NCCNC[C@@H](O)c1ccc(F)cn1)c1c(F)cccc1F	ZINC000819060969	ED	On-Demand	Anodyne	DAC	21	40
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000819060979	DE	On-Demand	Anodyne	SLC6A3	22	47
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000819060983	DE	On-Demand	Anodyne	SLC6A3	22	47
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000819060986	DE	On-Demand	Anodyne	SLC6A3	22	47
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)c1ccc(F)cc1	ZINC000819060989	DE	On-Demand	Anodyne	SLC6A3	22	47
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819060994	GF	On-Demand	Anodyne	ADRB3	43	38
O=C(Nc1ccccc1C(=O)N1CCCCC1)C(F)=C1CCC1	ZINC000819061004	DH	On-Demand	Anodyne	NPSR1	18	50
CC(=O)c1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819061017	FD	On-Demand	Anodyne	ADRB2	54	46
CC(=O)c1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819061017	FD	On-Demand	Anodyne	ADRB1	86	46
CC(=O)c1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819061017	FD	On-Demand	Anodyne	GRIN1	16	44
CC(=O)c1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819061017	FD	On-Demand	Anodyne	ADRB3	54	46
CC(=O)c1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819061020	FD	On-Demand	Anodyne	ADRB2	54	46
CC(=O)c1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819061020	FD	On-Demand	Anodyne	ADRB1	86	46
CC(=O)c1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819061020	FD	On-Demand	Anodyne	GRIN1	16	44
CC(=O)c1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819061020	FD	On-Demand	Anodyne	ADRB3	54	46
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccccc1Cl	ZINC000819061024	FE	On-Demand	Anodyne	ADRB2	33	52
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccccc1Cl	ZINC000819061024	FE	On-Demand	Anodyne	ADRB1	27	52
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccccc1Cl	ZINC000819061024	FE	On-Demand	Anodyne	ADRB3	25	40
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccccc1Cl	ZINC000819061024	FE	On-Demand	Anodyne	ABCB1	22	41
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccccc1Cl	ZINC000819061028	FE	On-Demand	Anodyne	ADRB2	33	52
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccccc1Cl	ZINC000819061028	FE	On-Demand	Anodyne	ADRB1	27	52
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccccc1Cl	ZINC000819061028	FE	On-Demand	Anodyne	ADRB3	25	40
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccccc1Cl	ZINC000819061028	FE	On-Demand	Anodyne	ABCB1	22	41
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccccc1Cl	ZINC000819061031	FE	On-Demand	Anodyne	ADRB2	33	52
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccccc1Cl	ZINC000819061031	FE	On-Demand	Anodyne	ADRB1	27	52
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccccc1Cl	ZINC000819061031	FE	On-Demand	Anodyne	ADRB3	25	40
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccccc1Cl	ZINC000819061031	FE	On-Demand	Anodyne	ABCB1	22	41
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccccc1Cl	ZINC000819061034	FE	On-Demand	Anodyne	ADRB2	33	52
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccccc1Cl	ZINC000819061034	FE	On-Demand	Anodyne	ADRB1	27	52
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccccc1Cl	ZINC000819061034	FE	On-Demand	Anodyne	ADRB3	25	40
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccccc1Cl	ZINC000819061034	FE	On-Demand	Anodyne	ABCB1	22	41
COc1ccc(OC)c([C@H](O)CNCCNC(=O)c2c(F)cccc2F)c1	ZINC000819061066	GE	On-Demand	Anodyne	ADRB2	22	43
COc1ccc(OC)c([C@H](O)CNCCNC(=O)c2c(F)cccc2F)c1	ZINC000819061066	GE	On-Demand	Anodyne	ADRB1	35	40
COc1ccc(OC)c([C@H](O)CNCCNC(=O)c2c(F)cccc2F)c1	ZINC000819061066	GE	On-Demand	Anodyne	DRD4	44	34
COc1ccc(OC)c([C@H](O)CNCCNC(=O)c2c(F)cccc2F)c1	ZINC000819061066	GE	On-Demand	Anodyne	ADRB3	23	40
COc1ccc(OC)c([C@H](O)CNCCNC(=O)c2c(F)cccc2F)c1	ZINC000819061066	GE	On-Demand	Anodyne	MTNR1A	59	47
COc1ccc(OC)c([C@H](O)CNCCNC(=O)c2c(F)cccc2F)c1	ZINC000819061066	GE	On-Demand	Anodyne	MTNR1B	53	39
COc1cccc(C[C@@H](C)NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819061068	FH	On-Demand	Anodyne	ADRB2	48	41
COc1cccc(C[C@@H](C)NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819061068	FH	On-Demand	Anodyne	ADRB1	37	54
COc1cccc(C[C@@H](C)NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819061068	FH	On-Demand	Anodyne	ADRB3	53	45
COc1cccc(C[C@@H](C)NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819061068	FH	On-Demand	Anodyne	PDS	40	37
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819061069	FH	On-Demand	Anodyne	ADRB2	48	41
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819061069	FH	On-Demand	Anodyne	ADRB1	37	54
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819061069	FH	On-Demand	Anodyne	ADRB3	53	45
COc1cccc(C[C@@H](C)NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819061069	FH	On-Demand	Anodyne	PDS	40	37
COc1cccc(C[C@H](C)NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819061070	FH	On-Demand	Anodyne	ADRB2	48	41
COc1cccc(C[C@H](C)NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819061070	FH	On-Demand	Anodyne	ADRB1	37	54
COc1cccc(C[C@H](C)NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819061070	FH	On-Demand	Anodyne	ADRB3	53	45
COc1cccc(C[C@H](C)NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819061070	FH	On-Demand	Anodyne	PDS	40	37
COc1cccc(C[C@H](C)NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819061071	FH	On-Demand	Anodyne	ADRB2	48	41
COc1cccc(C[C@H](C)NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819061071	FH	On-Demand	Anodyne	ADRB1	37	54
COc1cccc(C[C@H](C)NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819061071	FH	On-Demand	Anodyne	ADRB3	53	45
COc1cccc(C[C@H](C)NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819061071	FH	On-Demand	Anodyne	PDS	40	37
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819061072	GF	On-Demand	Anodyne	HTR4	41	35
O=C(NCCNC[C@H](O)c1cccnc1)c1c(F)cccc1F	ZINC000819061075	DD	On-Demand	Anodyne	ADRB2	26	50
O=C(NCCNC[C@H](O)c1cccnc1)c1c(F)cccc1F	ZINC000819061075	DD	On-Demand	Anodyne	ADRB1	43	53
O=C(NCCNC[C@H](O)c1cccnc1)c1c(F)cccc1F	ZINC000819061075	DD	On-Demand	Anodyne	ADRB3	120	53
O=C(NCCNC[C@@H](O)c1cccnc1)c1c(F)cccc1F	ZINC000819061076	DD	On-Demand	Anodyne	ADRB2	26	50
O=C(NCCNC[C@@H](O)c1cccnc1)c1c(F)cccc1F	ZINC000819061076	DD	On-Demand	Anodyne	ADRB1	43	53
O=C(NCCNC[C@@H](O)c1cccnc1)c1c(F)cccc1F	ZINC000819061076	DD	On-Demand	Anodyne	ADRB3	120	53
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819061077	FH	On-Demand	Anodyne	ADRB2	40	37
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819061077	FH	On-Demand	Anodyne	ADRB1	27	49
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819061077	FH	On-Demand	Anodyne	ADRB3	38	40
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819061078	FH	On-Demand	Anodyne	ADRB2	40	37
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819061078	FH	On-Demand	Anodyne	ADRB1	27	49
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819061078	FH	On-Demand	Anodyne	ADRB3	38	40
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819061079	FH	On-Demand	Anodyne	ADRB2	40	37
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819061079	FH	On-Demand	Anodyne	ADRB1	27	49
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819061079	FH	On-Demand	Anodyne	ADRB3	38	40
COc1cccc(C[C@H](C)NC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819061080	FH	On-Demand	Anodyne	ADRB2	40	37
COc1cccc(C[C@H](C)NC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819061080	FH	On-Demand	Anodyne	ADRB1	27	49
COc1cccc(C[C@H](C)NC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819061080	FH	On-Demand	Anodyne	ADRB3	38	40
COc1cccc(C[C@@H](C)NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)c1	ZINC000819061085	FE	On-Demand	Anodyne	ADRB1	18	42
COc1cccc(C[C@H](C)NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)c1	ZINC000819061086	FE	On-Demand	Anodyne	ADRB1	18	42
COc1cccc(C[C@H](C)NC[C@H](O)CN(C)C(=O)OC(C)(C)C)c1	ZINC000819061087	FE	On-Demand	Anodyne	ADRB1	18	42
COc1cccc(C[C@@H](C)NC[C@H](O)CN(C)C(=O)OC(C)(C)C)c1	ZINC000819061088	FE	On-Demand	Anodyne	ADRB1	18	42
COc1ccc2[nH]cc(CCNC[C@](C)(O)CNC(=O)OC(C)(C)C)c2c1	ZINC000819061109	GF	On-Demand	Anodyne	HTR1D	38	48
COc1ccc2[nH]cc(CCNC[C@](C)(O)CNC(=O)OC(C)(C)C)c2c1	ZINC000819061109	GF	On-Demand	Anodyne	HTR1B	35	43
COc1ccc2[nH]cc(CCNC[C@](C)(O)CNC(=O)OC(C)(C)C)c2c1	ZINC000819061109	GF	On-Demand	Anodyne	NQO2	45	61
COc1ccc2[nH]cc(CCNC[C@](C)(O)CNC(=O)OC(C)(C)C)c2c1	ZINC000819061109	GF	On-Demand	Anodyne	MPO	50	42
COc1ccc2[nH]cc(CCNC[C@](C)(O)CNC(=O)OC(C)(C)C)c2c1	ZINC000819061109	GF	On-Demand	Anodyne	HTR1E	22	44
COc1ccc2[nH]cc(CCNC[C@](C)(O)CNC(=O)OC(C)(C)C)c2c1	ZINC000819061109	GF	On-Demand	Anodyne	MTNR1A	102	62
COc1ccc2[nH]cc(CCNC[C@](C)(O)CNC(=O)OC(C)(C)C)c2c1	ZINC000819061109	GF	On-Demand	Anodyne	MTNR1B	80	61
COc1ccc2[nH]cc(CCNC[C@](C)(O)CNC(=O)OC(C)(C)C)c2c1	ZINC000819061109	GF	On-Demand	Anodyne	ABCG2	26	43
COc1ccc2[nH]cc(CCNC[C@@](C)(O)CNC(=O)OC(C)(C)C)c2c1	ZINC000819061110	GF	On-Demand	Anodyne	HTR1D	38	48
COc1ccc2[nH]cc(CCNC[C@@](C)(O)CNC(=O)OC(C)(C)C)c2c1	ZINC000819061110	GF	On-Demand	Anodyne	HTR1B	35	43
COc1ccc2[nH]cc(CCNC[C@@](C)(O)CNC(=O)OC(C)(C)C)c2c1	ZINC000819061110	GF	On-Demand	Anodyne	NQO2	45	61
COc1ccc2[nH]cc(CCNC[C@@](C)(O)CNC(=O)OC(C)(C)C)c2c1	ZINC000819061110	GF	On-Demand	Anodyne	MPO	50	42
COc1ccc2[nH]cc(CCNC[C@@](C)(O)CNC(=O)OC(C)(C)C)c2c1	ZINC000819061110	GF	On-Demand	Anodyne	HTR1E	22	44
COc1ccc2[nH]cc(CCNC[C@@](C)(O)CNC(=O)OC(C)(C)C)c2c1	ZINC000819061110	GF	On-Demand	Anodyne	MTNR1A	102	62
COc1ccc2[nH]cc(CCNC[C@@](C)(O)CNC(=O)OC(C)(C)C)c2c1	ZINC000819061110	GF	On-Demand	Anodyne	MTNR1B	80	61
COc1ccc2[nH]cc(CCNC[C@@](C)(O)CNC(=O)OC(C)(C)C)c2c1	ZINC000819061110	GF	On-Demand	Anodyne	ABCG2	26	43
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3F)c2c1	ZINC000819061119	EG	On-Demand	Anodyne	HTR1A	21	54
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3F)c2c1	ZINC000819061119	EG	On-Demand	Anodyne	HTR1D	48	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3F)c2c1	ZINC000819061119	EG	On-Demand	Anodyne	HTR1B	38	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3F)c2c1	ZINC000819061119	EG	On-Demand	Anodyne	ADRB3	20	49
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3F)c2c1	ZINC000819061119	EG	On-Demand	Anodyne	NQO2	23	53
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3F)c2c1	ZINC000819061119	EG	On-Demand	Anodyne	MPO	88	45
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3F)c2c1	ZINC000819061119	EG	On-Demand	Anodyne	HTR1E	16	43
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3F)c2c1	ZINC000819061119	EG	On-Demand	Anodyne	MTNR1A	50	54
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3F)c2c1	ZINC000819061119	EG	On-Demand	Anodyne	MTNR1B	34	53
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3F)c2c1	ZINC000819061119	EG	On-Demand	Anodyne	ABCG2	25	40
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3F)c2c1	ZINC000819061120	EG	On-Demand	Anodyne	HTR1A	21	54
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3F)c2c1	ZINC000819061120	EG	On-Demand	Anodyne	HTR1D	48	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3F)c2c1	ZINC000819061120	EG	On-Demand	Anodyne	HTR1B	38	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3F)c2c1	ZINC000819061120	EG	On-Demand	Anodyne	ADRB3	20	49
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3F)c2c1	ZINC000819061120	EG	On-Demand	Anodyne	NQO2	23	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3F)c2c1	ZINC000819061120	EG	On-Demand	Anodyne	MPO	88	45
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3F)c2c1	ZINC000819061120	EG	On-Demand	Anodyne	HTR1E	16	43
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3F)c2c1	ZINC000819061120	EG	On-Demand	Anodyne	MTNR1A	50	54
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3F)c2c1	ZINC000819061120	EG	On-Demand	Anodyne	MTNR1B	34	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3F)c2c1	ZINC000819061120	EG	On-Demand	Anodyne	ABCG2	25	40
C[C@H](NC[C@H](O)c1cccc(F)c1)C(=O)N1CCCC[C@H]1C	ZINC000819061131	DE	On-Demand	Anodyne	ADRB3	41	37
C[C@H](NC[C@H](O)c1cccc(F)c1)C(=O)N1CCCC[C@@H]1C	ZINC000819061132	DE	On-Demand	Anodyne	ADRB3	41	37
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)c(F)c3)c2c1	ZINC000819061133	EG	On-Demand	Anodyne	ADRB2	29	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)c(F)c3)c2c1	ZINC000819061133	EG	On-Demand	Anodyne	HTR1A	16	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)c(F)c3)c2c1	ZINC000819061133	EG	On-Demand	Anodyne	HTR1D	39	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)c(F)c3)c2c1	ZINC000819061133	EG	On-Demand	Anodyne	ADRB3	36	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)c(F)c3)c2c1	ZINC000819061133	EG	On-Demand	Anodyne	MPO	84	45
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)c(F)c3)c2c1	ZINC000819061133	EG	On-Demand	Anodyne	HTR1E	16	43
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)c(F)c3)c2c1	ZINC000819061133	EG	On-Demand	Anodyne	MTNR1A	37	53
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)c(F)c3)c2c1	ZINC000819061133	EG	On-Demand	Anodyne	MTNR1B	21	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)c(F)c3)c2c1	ZINC000819061134	EG	On-Demand	Anodyne	ADRB2	29	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)c(F)c3)c2c1	ZINC000819061134	EG	On-Demand	Anodyne	HTR1A	16	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)c(F)c3)c2c1	ZINC000819061134	EG	On-Demand	Anodyne	HTR1D	39	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)c(F)c3)c2c1	ZINC000819061134	EG	On-Demand	Anodyne	ADRB3	36	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)c(F)c3)c2c1	ZINC000819061134	EG	On-Demand	Anodyne	MPO	84	45
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)c(F)c3)c2c1	ZINC000819061134	EG	On-Demand	Anodyne	HTR1E	16	43
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)c(F)c3)c2c1	ZINC000819061134	EG	On-Demand	Anodyne	MTNR1A	37	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)c(F)c3)c2c1	ZINC000819061134	EG	On-Demand	Anodyne	MTNR1B	21	53
C[C@H](NC[C@H](O)c1ccccc1Br)C(=O)N1CCCC[C@H]1C	ZINC000819061143	FF	On-Demand	Anodyne	ACE	36	41
C[C@H](NC[C@H](O)c1ccccc1Br)C(=O)N1CCCC[C@@H]1C	ZINC000819061144	FF	On-Demand	Anodyne	ACE	36	41
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Br)cc3)c2c1	ZINC000819061147	GH	On-Demand	Anodyne	ADRB2	32	45
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Br)cc3)c2c1	ZINC000819061147	GH	On-Demand	Anodyne	HTR1D	40	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Br)cc3)c2c1	ZINC000819061147	GH	On-Demand	Anodyne	HTR1B	33	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Br)cc3)c2c1	ZINC000819061147	GH	On-Demand	Anodyne	ADRB3	30	49
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Br)cc3)c2c1	ZINC000819061147	GH	On-Demand	Anodyne	MPO	65	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Br)cc3)c2c1	ZINC000819061147	GH	On-Demand	Anodyne	HTR1E	22	45
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Br)cc3)c2c1	ZINC000819061147	GH	On-Demand	Anodyne	MTNR1A	43	57
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Br)cc3)c2c1	ZINC000819061147	GH	On-Demand	Anodyne	MTNR1B	26	56
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Br)cc3)c2c1	ZINC000819061147	GH	On-Demand	Anodyne	ABCG2	28	47
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(Br)cc3)c2c1	ZINC000819061148	GH	On-Demand	Anodyne	ADRB2	32	45
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(Br)cc3)c2c1	ZINC000819061148	GH	On-Demand	Anodyne	HTR1D	40	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(Br)cc3)c2c1	ZINC000819061148	GH	On-Demand	Anodyne	HTR1B	33	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(Br)cc3)c2c1	ZINC000819061148	GH	On-Demand	Anodyne	ADRB3	30	49
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(Br)cc3)c2c1	ZINC000819061148	GH	On-Demand	Anodyne	MPO	65	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(Br)cc3)c2c1	ZINC000819061148	GH	On-Demand	Anodyne	HTR1E	22	45
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(Br)cc3)c2c1	ZINC000819061148	GH	On-Demand	Anodyne	MTNR1A	43	57
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(Br)cc3)c2c1	ZINC000819061148	GH	On-Demand	Anodyne	MTNR1B	26	56
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(Br)cc3)c2c1	ZINC000819061148	GH	On-Demand	Anodyne	ABCG2	28	47
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Cl)c(F)c3)c2c1	ZINC000819061149	FH	On-Demand	Anodyne	ADRB2	26	40
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Cl)c(F)c3)c2c1	ZINC000819061149	FH	On-Demand	Anodyne	HTR1D	29	49
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Cl)c(F)c3)c2c1	ZINC000819061149	FH	On-Demand	Anodyne	ADRB3	35	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Cl)c(F)c3)c2c1	ZINC000819061149	FH	On-Demand	Anodyne	MPO	78	43
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Cl)c(F)c3)c2c1	ZINC000819061149	FH	On-Demand	Anodyne	HTR1E	15	41
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Cl)c(F)c3)c2c1	ZINC000819061149	FH	On-Demand	Anodyne	MTNR1A	39	53
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(Cl)c(F)c3)c2c1	ZINC000819061149	FH	On-Demand	Anodyne	MTNR1B	23	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(Cl)c(F)c3)c2c1	ZINC000819061150	FH	On-Demand	Anodyne	ADRB2	26	40
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(Cl)c(F)c3)c2c1	ZINC000819061150	FH	On-Demand	Anodyne	HTR1D	29	49
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(Cl)c(F)c3)c2c1	ZINC000819061150	FH	On-Demand	Anodyne	ADRB3	35	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(Cl)c(F)c3)c2c1	ZINC000819061150	FH	On-Demand	Anodyne	MPO	78	43
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(Cl)c(F)c3)c2c1	ZINC000819061150	FH	On-Demand	Anodyne	HTR1E	15	41
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(Cl)c(F)c3)c2c1	ZINC000819061150	FH	On-Demand	Anodyne	MTNR1A	39	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(Cl)c(F)c3)c2c1	ZINC000819061150	FH	On-Demand	Anodyne	MTNR1B	23	53
C#CCNC(=O)CCNCCc1c[nH]c2ccc(OC)cc12	ZINC000819061160	CD	On-Demand	Mild	HTR1A	18	56
C#CCNC(=O)CCNCCc1c[nH]c2ccc(OC)cc12	ZINC000819061160	CD	On-Demand	Mild	ACHE	22	45
C#CCNC(=O)CCNCCc1c[nH]c2ccc(OC)cc12	ZINC000819061160	CD	On-Demand	Mild	HTR1D	41	51
C#CCNC(=O)CCNCCc1c[nH]c2ccc(OC)cc12	ZINC000819061160	CD	On-Demand	Mild	HTR1B	36	48
C#CCNC(=O)CCNCCc1c[nH]c2ccc(OC)cc12	ZINC000819061160	CD	On-Demand	Mild	NQO2	34	45
C#CCNC(=O)CCNCCc1c[nH]c2ccc(OC)cc12	ZINC000819061160	CD	On-Demand	Mild	MPO	69	44
C#CCNC(=O)CCNCCc1c[nH]c2ccc(OC)cc12	ZINC000819061160	CD	On-Demand	Mild	HTR1E	22	44
C#CCNC(=O)CCNCCc1c[nH]c2ccc(OC)cc12	ZINC000819061160	CD	On-Demand	Mild	MTNR1A	118	70
C#CCNC(=O)CCNCCc1c[nH]c2ccc(OC)cc12	ZINC000819061160	CD	On-Demand	Mild	MTNR1B	90	64
C#CCNC(=O)CCNCCc1c[nH]c2ccc(OC)cc12	ZINC000819061160	CD	On-Demand	Mild	ABCG2	27	45
C[C@@H](NCCS(C)(=O)=O)C(=O)N1CCCC[C@H]1C	ZINC000819061161	CC	On-Demand	Anodyne	ACE	22	44
C[C@H]1CCCCN1C(=O)[C@@H](C)NCCS(C)(=O)=O	ZINC000819061164	CC	On-Demand	Anodyne	ACE	22	44
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)C(=O)N1CCCC[C@H]1C	ZINC000819061182	DF	On-Demand	Anodyne	ADRB1	16	42
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)C(=O)N1CCCC[C@H]1C	ZINC000819061182	DF	On-Demand	Anodyne	ADRB3	28	42
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)C(=O)N1CCCC[C@H]1C	ZINC000819061182	DF	On-Demand	Anodyne	CCR1	45	37
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)C(=O)N1CCCC[C@H]1C	ZINC000819061182	DF	On-Demand	Anodyne	DPP7	30	51
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)C(=O)N1CCCC[C@@H]1C	ZINC000819061183	DF	On-Demand	Anodyne	ADRB1	16	42
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)C(=O)N1CCCC[C@@H]1C	ZINC000819061183	DF	On-Demand	Anodyne	ADRB3	28	42
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)C(=O)N1CCCC[C@@H]1C	ZINC000819061183	DF	On-Demand	Anodyne	CCR1	45	37
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)C(=O)N1CCCC[C@@H]1C	ZINC000819061183	DF	On-Demand	Anodyne	DPP7	30	51
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819061184	DF	On-Demand	Anodyne	ADRB1	16	42
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819061184	DF	On-Demand	Anodyne	ADRB3	28	42
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819061184	DF	On-Demand	Anodyne	CCR1	45	37
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819061184	DF	On-Demand	Anodyne	DPP7	30	51
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C#N)cc3)c2c1	ZINC000819061195	EF	On-Demand	Mild	ADRB2	22	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C#N)cc3)c2c1	ZINC000819061195	EF	On-Demand	Mild	HTR1A	15	48
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C#N)cc3)c2c1	ZINC000819061195	EF	On-Demand	Mild	HTR1D	30	48
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C#N)cc3)c2c1	ZINC000819061195	EF	On-Demand	Mild	SLC6A4	15	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C#N)cc3)c2c1	ZINC000819061195	EF	On-Demand	Mild	ADRB3	23	46
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C#N)cc3)c2c1	ZINC000819061195	EF	On-Demand	Mild	MPO	47	39
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C#N)cc3)c2c1	ZINC000819061195	EF	On-Demand	Mild	HTR1E	15	44
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C#N)cc3)c2c1	ZINC000819061195	EF	On-Demand	Mild	MTNR1A	34	53
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C#N)cc3)c2c1	ZINC000819061195	EF	On-Demand	Mild	MTNR1B	19	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C#N)cc3)c2c1	ZINC000819061196	EF	On-Demand	Mild	ADRB2	22	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C#N)cc3)c2c1	ZINC000819061196	EF	On-Demand	Mild	HTR1A	15	48
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C#N)cc3)c2c1	ZINC000819061196	EF	On-Demand	Mild	HTR1D	30	48
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C#N)cc3)c2c1	ZINC000819061196	EF	On-Demand	Mild	SLC6A4	15	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C#N)cc3)c2c1	ZINC000819061196	EF	On-Demand	Mild	ADRB3	23	46
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C#N)cc3)c2c1	ZINC000819061196	EF	On-Demand	Mild	MPO	47	39
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C#N)cc3)c2c1	ZINC000819061196	EF	On-Demand	Mild	HTR1E	15	44
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C#N)cc3)c2c1	ZINC000819061196	EF	On-Demand	Mild	MTNR1A	34	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C#N)cc3)c2c1	ZINC000819061196	EF	On-Demand	Mild	MTNR1B	19	53
CC(=O)c1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061207	EF	On-Demand	Anodyne	ADRB2	52	48
CC(=O)c1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061207	EF	On-Demand	Anodyne	ADRB1	83	46
CC(=O)c1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061207	EF	On-Demand	Anodyne	ADRB3	47	46
CC(=O)c1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061207	EF	On-Demand	Anodyne	ABCB1	33	62
CC(=O)c1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061209	EF	On-Demand	Anodyne	ADRB2	52	48
CC(=O)c1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061209	EF	On-Demand	Anodyne	ADRB1	83	46
CC(=O)c1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061209	EF	On-Demand	Anodyne	ADRB3	47	46
CC(=O)c1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061209	EF	On-Demand	Anodyne	ABCB1	33	62
CC(=O)c1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061211	EF	On-Demand	Anodyne	ADRB2	52	48
CC(=O)c1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061211	EF	On-Demand	Anodyne	ADRB1	83	46
CC(=O)c1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061211	EF	On-Demand	Anodyne	ADRB3	47	46
CC(=O)c1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061211	EF	On-Demand	Anodyne	ABCB1	33	62
CC(=O)c1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061214	EF	On-Demand	Anodyne	ADRB2	52	48
CC(=O)c1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061214	EF	On-Demand	Anodyne	ADRB1	83	46
CC(=O)c1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061214	EF	On-Demand	Anodyne	ADRB3	47	46
CC(=O)c1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061214	EF	On-Demand	Anodyne	ABCB1	33	62
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1cccc(O)c1	ZINC000819061271	DD	On-Demand	Anodyne	PAPA1_CARPA	33	40
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1cccc(O)c1	ZINC000819061274	DD	On-Demand	Anodyne	PAPA1_CARPA	33	40
CC(=O)Nc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819061292	FD	On-Demand	Anodyne	ADRB2	57	61
CC(=O)Nc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819061292	FD	On-Demand	Anodyne	ADRB1	97	61
CC(=O)Nc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819061292	FD	On-Demand	Anodyne	GRIN1	30	48
CC(=O)Nc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819061292	FD	On-Demand	Anodyne	ADRB3	67	61
CC(=O)Nc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819061293	FD	On-Demand	Anodyne	ADRB2	57	61
CC(=O)Nc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819061293	FD	On-Demand	Anodyne	ADRB1	97	61
CC(=O)Nc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819061293	FD	On-Demand	Anodyne	GRIN1	30	48
CC(=O)Nc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819061293	FD	On-Demand	Anodyne	ADRB3	67	61
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)c1cccc(Cl)c1	ZINC000819061304	EF	On-Demand	Anodyne	ADRB1	34	47
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)c1cccc(Cl)c1	ZINC000819061304	EF	On-Demand	Anodyne	ADRB3	51	47
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)c1cccc(Cl)c1	ZINC000819061304	EF	On-Demand	Anodyne	CYP3A4	48	38
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)COCc2ccccc2)CC1	ZINC000819061305	GD	On-Demand	Anodyne	ADRB1	18	48
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)COCc2ccccc2)CC1	ZINC000819061305	GD	On-Demand	Anodyne	ADRB3	21	48
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)c1cccc(Cl)c1	ZINC000819061307	EF	On-Demand	Anodyne	ADRB1	34	47
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)c1cccc(Cl)c1	ZINC000819061307	EF	On-Demand	Anodyne	ADRB3	51	47
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)c1cccc(Cl)c1	ZINC000819061307	EF	On-Demand	Anodyne	CYP3A4	48	38
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)c1cccc(Cl)c1	ZINC000819061310	EF	On-Demand	Anodyne	ADRB1	34	47
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)c1cccc(Cl)c1	ZINC000819061310	EF	On-Demand	Anodyne	ADRB3	51	47
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)c1cccc(Cl)c1	ZINC000819061310	EF	On-Demand	Anodyne	CYP3A4	48	38
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)c1cccc(Cl)c1	ZINC000819061313	EF	On-Demand	Anodyne	ADRB1	34	47
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)c1cccc(Cl)c1	ZINC000819061313	EF	On-Demand	Anodyne	ADRB3	51	47
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)c1cccc(Cl)c1	ZINC000819061313	EF	On-Demand	Anodyne	CYP3A4	48	38
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819061323	DF	On-Demand	Mild	ADRB2	49	41
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819061323	DF	On-Demand	Mild	ADRB1	33	50
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819061323	DF	On-Demand	Mild	ADRB3	40	50
Cc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819061335	ED	On-Demand	Anodyne	ADRB2	35	47
Cc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819061335	ED	On-Demand	Anodyne	ADRB1	42	49
Cc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819061335	ED	On-Demand	Anodyne	ADRB3	29	47
Cc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819061336	ED	On-Demand	Anodyne	ADRB2	35	47
Cc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819061336	ED	On-Demand	Anodyne	ADRB1	42	49
Cc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819061336	ED	On-Demand	Anodyne	ADRB3	29	47
Cc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819061337	ED	On-Demand	Anodyne	ADRB2	35	47
Cc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819061337	ED	On-Demand	Anodyne	ADRB1	42	49
Cc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819061337	ED	On-Demand	Anodyne	ADRB3	29	47
Cc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819061338	ED	On-Demand	Anodyne	ADRB2	35	47
Cc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819061338	ED	On-Demand	Anodyne	ADRB1	42	49
Cc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819061338	ED	On-Demand	Anodyne	ADRB3	29	47
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819061346	DF	On-Demand	Mild	ADRB2	49	41
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819061346	DF	On-Demand	Mild	ADRB1	33	50
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819061346	DF	On-Demand	Mild	ADRB3	40	50
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819061347	DF	On-Demand	Mild	ADRB2	49	41
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819061347	DF	On-Demand	Mild	ADRB1	33	50
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819061347	DF	On-Demand	Mild	ADRB3	40	50
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819061348	DF	On-Demand	Mild	ADRB2	49	41
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819061348	DF	On-Demand	Mild	ADRB1	33	50
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819061348	DF	On-Demand	Mild	ADRB3	40	50
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819061365	FF	On-Demand	Anodyne	ADRB2	55	47
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819061365	FF	On-Demand	Anodyne	ADRB1	74	43
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819061365	FF	On-Demand	Anodyne	ADRB3	57	43
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819061365	FF	On-Demand	Anodyne	CPT1A	93	37
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819061365	FF	On-Demand	Anodyne	AMY2	45	31
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819061365	FF	On-Demand	Anodyne	ABCB1	37	43
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819061365	FF	On-Demand	Anodyne	SFRP1	53	38
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819061365	FF	On-Demand	Anodyne	WNT3	52	35
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819061367	FF	On-Demand	Anodyne	ADRB2	55	47
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819061367	FF	On-Demand	Anodyne	ADRB1	74	43
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819061367	FF	On-Demand	Anodyne	ADRB3	57	43
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819061367	FF	On-Demand	Anodyne	CPT1A	93	37
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819061367	FF	On-Demand	Anodyne	AMY2	45	31
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819061367	FF	On-Demand	Anodyne	ABCB1	37	43
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819061367	FF	On-Demand	Anodyne	SFRP1	53	38
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819061367	FF	On-Demand	Anodyne	WNT3	52	35
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819061369	FF	On-Demand	Anodyne	ADRB2	55	47
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819061369	FF	On-Demand	Anodyne	ADRB1	74	43
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819061369	FF	On-Demand	Anodyne	ADRB3	57	43
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819061369	FF	On-Demand	Anodyne	CPT1A	93	37
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819061369	FF	On-Demand	Anodyne	AMY2	45	31
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819061369	FF	On-Demand	Anodyne	ABCB1	37	43
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819061369	FF	On-Demand	Anodyne	SFRP1	53	38
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819061369	FF	On-Demand	Anodyne	WNT3	52	35
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819061370	FF	On-Demand	Anodyne	ADRB2	55	47
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819061370	FF	On-Demand	Anodyne	ADRB1	74	43
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819061370	FF	On-Demand	Anodyne	ADRB3	57	43
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819061370	FF	On-Demand	Anodyne	CPT1A	93	37
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819061370	FF	On-Demand	Anodyne	AMY2	45	31
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819061370	FF	On-Demand	Anodyne	ABCB1	37	43
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819061370	FF	On-Demand	Anodyne	SFRP1	53	38
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819061370	FF	On-Demand	Anodyne	WNT3	52	35
COC(=O)C1(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCCCCC1	ZINC000819061390	GF	On-Demand	Mild	PAPA1_CARPA	40	49
COC(=O)C1(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCCCCC1	ZINC000819061393	GF	On-Demand	Mild	PAPA1_CARPA	40	49
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819061396	FH	On-Demand	Anodyne	ADRB2	53	54
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819061396	FH	On-Demand	Anodyne	ADRB1	36	50
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819061396	FH	On-Demand	Anodyne	ADRB3	47	50
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819061398	FH	On-Demand	Anodyne	ADRB2	53	54
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819061398	FH	On-Demand	Anodyne	ADRB1	36	50
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819061398	FH	On-Demand	Anodyne	ADRB3	47	50
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819061399	FH	On-Demand	Anodyne	ADRB2	53	54
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819061399	FH	On-Demand	Anodyne	ADRB1	36	50
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819061399	FH	On-Demand	Anodyne	ADRB3	47	50
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819061401	FH	On-Demand	Anodyne	ADRB2	53	54
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819061401	FH	On-Demand	Anodyne	ADRB1	36	50
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819061401	FH	On-Demand	Anodyne	ADRB3	47	50
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819061410	FG	On-Demand	Anodyne	SLC6A3	19	42
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819061410	FG	On-Demand	Anodyne	GPR119	43	43
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819061412	FG	On-Demand	Anodyne	SLC6A3	19	42
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819061412	FG	On-Demand	Anodyne	GPR119	43	43
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819061415	FG	On-Demand	Anodyne	SLC6A3	19	42
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819061415	FG	On-Demand	Anodyne	GPR119	43	43
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819061418	FG	On-Demand	Anodyne	SLC6A3	19	42
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819061418	FG	On-Demand	Anodyne	GPR119	43	43
CC(C)(C)OC(=O)NCC[C@H](O)CNC/C=C\c1ccccc1	ZINC000819061419	DF	On-Demand	Anodyne	PAPA1_CARPA	33	42
CC(C)(C)OC(=O)NCC[C@@H](O)CNC/C=C\c1ccccc1	ZINC000819061422	DF	On-Demand	Anodyne	PAPA1_CARPA	33	42
CC(C)(C)OC(=O)NCC[C@H](O)CNC/C=C/c1ccccc1	ZINC000819061423	DF	On-Demand	Anodyne	PAPA1_CARPA	33	42
CC(C)(C)OC(=O)NCC[C@@H](O)CNC/C=C/c1ccccc1	ZINC000819061425	DF	On-Demand	Anodyne	PAPA1_CARPA	33	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCOC1	ZINC000819061431	GE	On-Demand	Anodyne	CTSD	92	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCOC1	ZINC000819061431	GE	On-Demand	Anodyne	PGC	57	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCOC1	ZINC000819061431	GE	On-Demand	Anodyne	PAPA1_CARPA	29	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCOC1	ZINC000819061431	GE	On-Demand	Anodyne	BACE2	44	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCOC1	ZINC000819061431	GE	On-Demand	Anodyne	REN	69	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCOC1	ZINC000819061431	GE	On-Demand	Anodyne	REN1	17	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCOC1	ZINC000819061431	GE	On-Demand	Anodyne	BACE1	84	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCOC1	ZINC000819061431	GE	On-Demand	Anodyne	FPR1	48	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCOC1	ZINC000819061431	GE	On-Demand	Anodyne	Q82323_9DELA	72	31
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCOC1	ZINC000819061433	GE	On-Demand	Anodyne	CTSD	92	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCOC1	ZINC000819061433	GE	On-Demand	Anodyne	PGC	57	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCOC1	ZINC000819061433	GE	On-Demand	Anodyne	PAPA1_CARPA	29	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCOC1	ZINC000819061433	GE	On-Demand	Anodyne	BACE2	44	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCOC1	ZINC000819061433	GE	On-Demand	Anodyne	REN	69	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCOC1	ZINC000819061433	GE	On-Demand	Anodyne	REN1	17	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCOC1	ZINC000819061433	GE	On-Demand	Anodyne	BACE1	84	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCOC1	ZINC000819061433	GE	On-Demand	Anodyne	FPR1	48	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCOC1	ZINC000819061433	GE	On-Demand	Anodyne	Q82323_9DELA	72	31
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819061435	FG	On-Demand	Anodyne	GPR119	40	49
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819061437	FG	On-Demand	Anodyne	GPR119	40	49
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819061439	FG	On-Demand	Anodyne	GPR119	40	49
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819061440	FG	On-Demand	Anodyne	GPR119	40	49
CC1(C)C[C@@H]1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819061445	CE	On-Demand	Bother	CACNA1C	54	36
CC1(C)C[C@@H]1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819061445	CE	On-Demand	Bother	CACNA1D	85	36
CC1(C)C[C@@H]1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819061449	CE	On-Demand	Bother	CACNA1C	54	36
CC1(C)C[C@@H]1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819061449	CE	On-Demand	Bother	CACNA1D	85	36
O=[N+]([O-])c1cccc([C@@H](O)CNCC2CCN(S(=O)(=O)C(F)F)CC2)c1	ZINC000819061457	GD	On-Demand	Bother	ADRB1	18	40
O=[N+]([O-])c1cccc([C@@H](O)CNCC2CCN(S(=O)(=O)C(F)F)CC2)c1	ZINC000819061457	GD	On-Demand	Bother	ADRB3	30	40
O=[N+]([O-])c1cccc([C@H](O)CNCC2CCN(S(=O)(=O)C(F)F)CC2)c1	ZINC000819061459	GD	On-Demand	Bother	ADRB1	18	40
O=[N+]([O-])c1cccc([C@H](O)CNCC2CCN(S(=O)(=O)C(F)F)CC2)c1	ZINC000819061459	GD	On-Demand	Bother	ADRB3	30	40
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2cccnc2)CC1	ZINC000819061463	FD	On-Demand	Anodyne	ADRB2	35	49
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2cccnc2)CC1	ZINC000819061463	FD	On-Demand	Anodyne	ADRB1	40	50
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2cccnc2)CC1	ZINC000819061463	FD	On-Demand	Anodyne	ADRB3	126	55
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2cccnc2)CC1	ZINC000819061463	FD	On-Demand	Anodyne	PTAFR	15	41
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2cccnc2)CC1	ZINC000819061464	FD	On-Demand	Anodyne	ADRB2	35	49
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2cccnc2)CC1	ZINC000819061464	FD	On-Demand	Anodyne	ADRB1	40	50
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2cccnc2)CC1	ZINC000819061464	FD	On-Demand	Anodyne	ADRB3	126	55
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2cccnc2)CC1	ZINC000819061464	FD	On-Demand	Anodyne	PTAFR	15	41
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2ccccc2)CC1	ZINC000819061467	FE	On-Demand	Anodyne	ADRB1	37	46
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2ccccc2)CC1	ZINC000819061467	FE	On-Demand	Anodyne	SLC6A1	51	39
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2ccccc2)CC1	ZINC000819061467	FE	On-Demand	Anodyne	SLC6A3	20	40
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2ccccc2)CC1	ZINC000819061467	FE	On-Demand	Anodyne	ADRB3	90	46
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2ccccc2)CC1	ZINC000819061468	FE	On-Demand	Anodyne	ADRB1	37	46
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2ccccc2)CC1	ZINC000819061468	FE	On-Demand	Anodyne	SLC6A1	51	39
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2ccccc2)CC1	ZINC000819061468	FE	On-Demand	Anodyne	SLC6A3	20	40
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2ccccc2)CC1	ZINC000819061468	FE	On-Demand	Anodyne	ADRB3	90	46
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819061482	GF	On-Demand	Anodyne	CTSK	17	42
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819061482	GF	On-Demand	Anodyne	PREP	41	42
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819061482	GF	On-Demand	Anodyne	REN	42	35
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819061482	GF	On-Demand	Anodyne	ABCB1	24	43
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819061482	GF	On-Demand	Anodyne	GHSR	36	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819061482	GF	On-Demand	Anodyne	BIRC2	18	44
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819061483	GF	On-Demand	Anodyne	CTSK	17	42
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819061483	GF	On-Demand	Anodyne	PREP	41	42
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819061483	GF	On-Demand	Anodyne	REN	42	35
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819061483	GF	On-Demand	Anodyne	ABCB1	24	43
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819061483	GF	On-Demand	Anodyne	GHSR	36	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819061483	GF	On-Demand	Anodyne	BIRC2	18	44
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819061484	GF	On-Demand	Anodyne	CTSK	17	42
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819061484	GF	On-Demand	Anodyne	PREP	41	42
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819061484	GF	On-Demand	Anodyne	REN	42	35
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819061484	GF	On-Demand	Anodyne	ABCB1	24	43
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819061484	GF	On-Demand	Anodyne	GHSR	36	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819061484	GF	On-Demand	Anodyne	BIRC2	18	44
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819061485	GF	On-Demand	Anodyne	CTSK	17	42
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819061485	GF	On-Demand	Anodyne	PREP	41	42
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819061485	GF	On-Demand	Anodyne	REN	42	35
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819061485	GF	On-Demand	Anodyne	ABCB1	24	43
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819061485	GF	On-Demand	Anodyne	GHSR	36	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819061485	GF	On-Demand	Anodyne	BIRC2	18	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2nnc3n2CCCCC3)cc1	ZINC000819061511	GD	On-Demand	Anodyne	ADRB2	21	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2nnc3n2CCCCC3)cc1	ZINC000819061511	GD	On-Demand	Anodyne	ADRB3	56	36
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2nnc3n2CCCCC3)cc1	ZINC000819061512	GD	On-Demand	Anodyne	ADRB2	21	40
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2nnc3n2CCCCC3)cc1	ZINC000819061512	GD	On-Demand	Anodyne	ADRB3	56	36
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(OC)cc23)c1	ZINC000819061516	FG	On-Demand	Anodyne	ADRB2	27	49
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(OC)cc23)c1	ZINC000819061516	FG	On-Demand	Anodyne	HTR1A	18	53
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(OC)cc23)c1	ZINC000819061516	FG	On-Demand	Anodyne	HTR1D	41	53
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(OC)cc23)c1	ZINC000819061516	FG	On-Demand	Anodyne	HTR1B	34	53
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(OC)cc23)c1	ZINC000819061516	FG	On-Demand	Anodyne	ADRB3	20	48
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(OC)cc23)c1	ZINC000819061516	FG	On-Demand	Anodyne	NQO2	24	57
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(OC)cc23)c1	ZINC000819061516	FG	On-Demand	Anodyne	MPO	70	43
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(OC)cc23)c1	ZINC000819061516	FG	On-Demand	Anodyne	HTR1E	23	46
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(OC)cc23)c1	ZINC000819061516	FG	On-Demand	Anodyne	MTNR1A	56	58
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(OC)cc23)c1	ZINC000819061516	FG	On-Demand	Anodyne	MTNR1B	41	57
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(OC)cc23)c1	ZINC000819061516	FG	On-Demand	Anodyne	ABCG2	25	40
C[C@H](NC[C@H](O)c1cccc(Br)c1)C(=O)N1CCCC[C@H]1C	ZINC000819061519	FF	On-Demand	Anodyne	ADRB3	42	37
C[C@H](NC[C@H](O)c1cccc(Br)c1)C(=O)N1CCCC[C@@H]1C	ZINC000819061520	FF	On-Demand	Anodyne	ADRB3	42	37
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3F)c2c1	ZINC000819061525	EG	On-Demand	Anodyne	HTR1A	21	51
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3F)c2c1	ZINC000819061525	EG	On-Demand	Anodyne	HTR1D	35	51
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3F)c2c1	ZINC000819061525	EG	On-Demand	Anodyne	SLC6A4	18	54
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3F)c2c1	ZINC000819061525	EG	On-Demand	Anodyne	ADRB3	18	46
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3F)c2c1	ZINC000819061525	EG	On-Demand	Anodyne	MPO	101	54
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3F)c2c1	ZINC000819061525	EG	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3F)c2c1	ZINC000819061525	EG	On-Demand	Anodyne	MTNR1A	38	53
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3F)c2c1	ZINC000819061525	EG	On-Demand	Anodyne	MTNR1B	25	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3F)c2c1	ZINC000819061526	EG	On-Demand	Anodyne	HTR1A	21	51
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3F)c2c1	ZINC000819061526	EG	On-Demand	Anodyne	HTR1D	35	51
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3F)c2c1	ZINC000819061526	EG	On-Demand	Anodyne	SLC6A4	18	54
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3F)c2c1	ZINC000819061526	EG	On-Demand	Anodyne	ADRB3	18	46
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3F)c2c1	ZINC000819061526	EG	On-Demand	Anodyne	MPO	101	54
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3F)c2c1	ZINC000819061526	EG	On-Demand	Anodyne	HTR1E	15	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3F)c2c1	ZINC000819061526	EG	On-Demand	Anodyne	MTNR1A	38	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3F)c2c1	ZINC000819061526	EG	On-Demand	Anodyne	MTNR1B	25	53
C[C@H](NC[C@H](O)c1ccccc1F)C(=O)N1CCCC[C@H]1C	ZINC000819061530	DE	On-Demand	Anodyne	ACE	37	41
C[C@H](NC[C@H](O)c1ccccc1F)C(=O)N1CCCC[C@@H]1C	ZINC000819061531	DE	On-Demand	Anodyne	ACE	37	41
C[C@H](NC[C@H](O)c1cccc2ccccc12)C(=O)N1CCCC[C@@H]1C	ZINC000819061552	EG	On-Demand	Anodyne	ACE	35	43
C[C@H](NC[C@H](O)c1cccc2ccccc12)C(=O)N1CCCC[C@@H]1C	ZINC000819061552	EG	On-Demand	Anodyne	CPT1A	47	33
C[C@H](NC[C@H](O)c1cccc2ccccc12)C(=O)N1CCCC[C@H]1C	ZINC000819061553	EG	On-Demand	Anodyne	ACE	35	43
C[C@H](NC[C@H](O)c1cccc2ccccc12)C(=O)N1CCCC[C@H]1C	ZINC000819061553	EG	On-Demand	Anodyne	CPT1A	47	33
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@H](O)c1cccc2ccccc12	ZINC000819061555	EG	On-Demand	Anodyne	ACE	35	43
C[C@H]1CCCCN1C(=O)[C@@H](C)NC[C@H](O)c1cccc2ccccc12	ZINC000819061555	EG	On-Demand	Anodyne	CPT1A	47	33
COc1ccc2[nH]cc(CCNC[C@H](O)CN(C)C(=O)OC(C)(C)C)c2c1	ZINC000819061593	GF	On-Demand	Anodyne	HTR1D	35	48
COc1ccc2[nH]cc(CCNC[C@H](O)CN(C)C(=O)OC(C)(C)C)c2c1	ZINC000819061593	GF	On-Demand	Anodyne	HTR1B	32	41
COc1ccc2[nH]cc(CCNC[C@H](O)CN(C)C(=O)OC(C)(C)C)c2c1	ZINC000819061593	GF	On-Demand	Anodyne	NQO2	27	53
COc1ccc2[nH]cc(CCNC[C@H](O)CN(C)C(=O)OC(C)(C)C)c2c1	ZINC000819061593	GF	On-Demand	Anodyne	HTR1E	21	41
COc1ccc2[nH]cc(CCNC[C@H](O)CN(C)C(=O)OC(C)(C)C)c2c1	ZINC000819061593	GF	On-Demand	Anodyne	MTNR1A	54	54
COc1ccc2[nH]cc(CCNC[C@H](O)CN(C)C(=O)OC(C)(C)C)c2c1	ZINC000819061593	GF	On-Demand	Anodyne	MTNR1B	35	53
COc1ccc2[nH]cc(CCNC[C@@H](O)CN(C)C(=O)OC(C)(C)C)c2c1	ZINC000819061594	GF	On-Demand	Anodyne	HTR1D	35	48
COc1ccc2[nH]cc(CCNC[C@@H](O)CN(C)C(=O)OC(C)(C)C)c2c1	ZINC000819061594	GF	On-Demand	Anodyne	HTR1B	32	41
COc1ccc2[nH]cc(CCNC[C@@H](O)CN(C)C(=O)OC(C)(C)C)c2c1	ZINC000819061594	GF	On-Demand	Anodyne	NQO2	27	53
COc1ccc2[nH]cc(CCNC[C@@H](O)CN(C)C(=O)OC(C)(C)C)c2c1	ZINC000819061594	GF	On-Demand	Anodyne	HTR1E	21	41
COc1ccc2[nH]cc(CCNC[C@@H](O)CN(C)C(=O)OC(C)(C)C)c2c1	ZINC000819061594	GF	On-Demand	Anodyne	MTNR1A	54	54
COc1ccc2[nH]cc(CCNC[C@@H](O)CN(C)C(=O)OC(C)(C)C)c2c1	ZINC000819061594	GF	On-Demand	Anodyne	MTNR1B	35	53
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccc(Cl)cc1	ZINC000819061660	FE	On-Demand	Anodyne	ADRB2	26	43
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccc(Cl)cc1	ZINC000819061660	FE	On-Demand	Anodyne	ADRB1	40	46
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccc(Cl)cc1	ZINC000819061660	FE	On-Demand	Anodyne	ADRB3	28	43
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccc(Cl)cc1	ZINC000819061660	FE	On-Demand	Anodyne	EBP	17	42
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccc(Cl)cc1	ZINC000819061661	FE	On-Demand	Anodyne	ADRB2	26	43
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccc(Cl)cc1	ZINC000819061661	FE	On-Demand	Anodyne	ADRB1	40	46
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccc(Cl)cc1	ZINC000819061661	FE	On-Demand	Anodyne	ADRB3	28	43
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccc(Cl)cc1	ZINC000819061661	FE	On-Demand	Anodyne	EBP	17	42
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccc(Cl)cc1	ZINC000819061663	FE	On-Demand	Anodyne	ADRB2	26	43
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccc(Cl)cc1	ZINC000819061663	FE	On-Demand	Anodyne	ADRB1	40	46
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccc(Cl)cc1	ZINC000819061663	FE	On-Demand	Anodyne	ADRB3	28	43
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccc(Cl)cc1	ZINC000819061663	FE	On-Demand	Anodyne	EBP	17	42
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccc(Cl)cc1	ZINC000819061664	FE	On-Demand	Anodyne	ADRB2	26	43
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccc(Cl)cc1	ZINC000819061664	FE	On-Demand	Anodyne	ADRB1	40	46
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccc(Cl)cc1	ZINC000819061664	FE	On-Demand	Anodyne	ADRB3	28	43
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccc(Cl)cc1	ZINC000819061664	FE	On-Demand	Anodyne	EBP	17	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccccc1C(=O)N1CCCCC1	ZINC000819061721	GG	On-Demand	Anodyne	NPSR1	15	42
CN(C)c1ccc(NC(=O)c2cc3c(cn2)OCCO3)cc1	ZINC000819061723	CE	On-Demand	Anodyne	GRM4	27	42
O=C(NNc1ccccc1C(F)(F)F)C(F)=C1CCC1	ZINC000819061728	CH	On-Demand	Reactive	RBP4	70	37
CC(C)(C)OC(=O)N1CCCC[C@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819061730	FG	On-Demand	Anodyne	LTA4H	26	40
CC(C)(C)OC(=O)N1CCCC[C@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819061730	FG	On-Demand	Anodyne	CCR8	32	40
CC(C)(C)OC(=O)N1CCCC[C@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819061730	FG	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CCCC[C@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819061730	FG	On-Demand	Anodyne	SFRP1	54	39
CC(C)(C)OC(=O)N1CCCC[C@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819061730	FG	On-Demand	Anodyne	WNT3	47	36
CC(C)(C)OC(=O)N1CCCC[C@@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819061731	FG	On-Demand	Anodyne	LTA4H	26	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819061731	FG	On-Demand	Anodyne	CCR8	32	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819061731	FG	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819061731	FG	On-Demand	Anodyne	SFRP1	54	39
CC(C)(C)OC(=O)N1CCCC[C@@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819061731	FG	On-Demand	Anodyne	WNT3	47	36
COc1cccc(C[C@@H](C)NC[C@H](O)c2c(F)cccc2F)c1	ZINC000819061740	DG	On-Demand	Anodyne	ADRB2	41	37
COc1cccc(C[C@@H](C)NC[C@H](O)c2c(F)cccc2F)c1	ZINC000819061740	DG	On-Demand	Anodyne	ADRB1	22	46
COc1cccc(C[C@H](C)NC[C@H](O)c2c(F)cccc2F)c1	ZINC000819061742	DG	On-Demand	Anodyne	ADRB2	41	37
COc1cccc(C[C@H](C)NC[C@H](O)c2c(F)cccc2F)c1	ZINC000819061742	DG	On-Demand	Anodyne	ADRB1	22	46
COc1cccc(C[C@@H](C)NC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819061745	DG	On-Demand	Anodyne	ADRB2	41	37
COc1cccc(C[C@@H](C)NC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819061745	DG	On-Demand	Anodyne	ADRB1	22	46
COc1cccc(C[C@H](C)NC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819061748	DG	On-Demand	Anodyne	ADRB2	41	37
COc1cccc(C[C@H](C)NC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819061748	DG	On-Demand	Anodyne	ADRB1	22	46
O=C(NCCNC[C@H](O)c1cccc(C(F)(F)F)c1)c1c(F)cccc1F	ZINC000819061782	GG	On-Demand	Anodyne	ADRB1	26	41
O=C(NCCNC[C@H](O)c1cccc(C(F)(F)F)c1)c1c(F)cccc1F	ZINC000819061782	GG	On-Demand	Anodyne	ADRB3	33	41
O=C(NCCNC[C@H](O)c1cccc(C(F)(F)F)c1)c1c(F)cccc1F	ZINC000819061782	GG	On-Demand	Anodyne	CES2	15	43
O=C(NCCNC[C@@H](O)c1cccc(C(F)(F)F)c1)c1c(F)cccc1F	ZINC000819061784	GG	On-Demand	Anodyne	ADRB1	26	41
O=C(NCCNC[C@@H](O)c1cccc(C(F)(F)F)c1)c1c(F)cccc1F	ZINC000819061784	GG	On-Demand	Anodyne	ADRB3	33	41
O=C(NCCNC[C@@H](O)c1cccc(C(F)(F)F)c1)c1c(F)cccc1F	ZINC000819061784	GG	On-Demand	Anodyne	CES2	15	43
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819061785	GE	On-Demand	Anodyne	ADRB1	33	41
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819061785	GE	On-Demand	Anodyne	SLC6A1	35	41
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819061785	GE	On-Demand	Anodyne	ADRB3	75	41
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819061786	GH	On-Demand	Anodyne	ADRB2	51	43
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819061786	GH	On-Demand	Anodyne	ADRB1	34	52
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819061786	GH	On-Demand	Anodyne	ADRB3	49	52
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819061787	GE	On-Demand	Anodyne	ADRB1	33	41
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819061787	GE	On-Demand	Anodyne	SLC6A1	35	41
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819061787	GE	On-Demand	Anodyne	ADRB3	75	41
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819061788	GH	On-Demand	Anodyne	ADRB2	51	43
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819061788	GH	On-Demand	Anodyne	ADRB1	34	52
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819061788	GH	On-Demand	Anodyne	ADRB3	49	52
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819061790	GH	On-Demand	Anodyne	ADRB2	51	43
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819061790	GH	On-Demand	Anodyne	ADRB1	34	52
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819061790	GH	On-Demand	Anodyne	ADRB3	49	52
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819061791	GH	On-Demand	Anodyne	ADRB2	51	43
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819061791	GH	On-Demand	Anodyne	ADRB1	34	52
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819061791	GH	On-Demand	Anodyne	ADRB3	49	52
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819061795	FG	On-Demand	Anodyne	ADRB1	18	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819061795	FG	On-Demand	Anodyne	ADRB3	30	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819061795	FG	On-Demand	Anodyne	GPR119	36	49
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819061797	FG	On-Demand	Anodyne	ADRB1	18	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819061797	FG	On-Demand	Anodyne	ADRB3	30	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819061797	FG	On-Demand	Anodyne	GPR119	36	49
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819061799	FG	On-Demand	Anodyne	ADRB1	18	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819061799	FG	On-Demand	Anodyne	ADRB3	30	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819061799	FG	On-Demand	Anodyne	GPR119	36	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC/C=C\c2ccccc2)CC1	ZINC000819061800	FG	On-Demand	Anodyne	CCR8	27	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC/C=C\c2ccccc2)CC1	ZINC000819061800	FG	On-Demand	Anodyne	GPR119	44	48
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC/C=C\c2ccccc2)CC1	ZINC000819061800	FG	On-Demand	Anodyne	SFRP1	28	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819061801	FG	On-Demand	Anodyne	ADRB1	18	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819061801	FG	On-Demand	Anodyne	ADRB3	30	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819061801	FG	On-Demand	Anodyne	GPR119	36	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC/C=C\c2ccccc2)CC1	ZINC000819061802	FG	On-Demand	Anodyne	CCR8	27	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC/C=C\c2ccccc2)CC1	ZINC000819061802	FG	On-Demand	Anodyne	GPR119	44	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC/C=C\c2ccccc2)CC1	ZINC000819061802	FG	On-Demand	Anodyne	SFRP1	28	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC/C=C/c2ccccc2)CC1	ZINC000819061804	FG	On-Demand	Anodyne	CCR8	27	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC/C=C/c2ccccc2)CC1	ZINC000819061804	FG	On-Demand	Anodyne	GPR119	44	48
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC/C=C/c2ccccc2)CC1	ZINC000819061804	FG	On-Demand	Anodyne	SFRP1	28	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC/C=C/c2ccccc2)CC1	ZINC000819061806	FG	On-Demand	Anodyne	CCR8	27	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC/C=C/c2ccccc2)CC1	ZINC000819061806	FG	On-Demand	Anodyne	GPR119	44	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC/C=C/c2ccccc2)CC1	ZINC000819061806	FG	On-Demand	Anodyne	SFRP1	28	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NNc1ccccc1C(F)(F)F)C2	ZINC000819061808	FG	On-Demand	Reactive	RBP4	77	34
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCS(=O)(=O)C(C)(C)C)CC1	ZINC000819061809	GD	On-Demand	Anodyne	GPR119	39	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCS(=O)(=O)C(C)(C)C)CC1	ZINC000819061810	GD	On-Demand	Anodyne	GPR119	39	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NNc1ccccc1C(F)(F)F)C2	ZINC000819061823	FG	On-Demand	Reactive	RBP4	77	34
Cc1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061825	CG	On-Demand	Anodyne	ADRB2	58	52
Cc1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061825	CG	On-Demand	Anodyne	ADRB1	77	51
Cc1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061825	CG	On-Demand	Anodyne	ADRB3	45	51
Cc1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061825	CG	On-Demand	Anodyne	ABCB1	20	44
Cc1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061827	CG	On-Demand	Anodyne	ADRB2	58	52
Cc1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061827	CG	On-Demand	Anodyne	ADRB1	77	51
Cc1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061827	CG	On-Demand	Anodyne	ADRB3	45	51
Cc1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061827	CG	On-Demand	Anodyne	ABCB1	20	44
Cc1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061828	CG	On-Demand	Anodyne	ADRB2	58	52
Cc1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061828	CG	On-Demand	Anodyne	ADRB1	77	51
Cc1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061828	CG	On-Demand	Anodyne	ADRB3	45	51
Cc1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061828	CG	On-Demand	Anodyne	ABCB1	20	44
Cc1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061830	CG	On-Demand	Anodyne	ADRB2	58	52
Cc1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061830	CG	On-Demand	Anodyne	ADRB1	77	51
Cc1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061830	CG	On-Demand	Anodyne	ADRB3	45	51
Cc1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061830	CG	On-Demand	Anodyne	ABCB1	20	44
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061843	EF	On-Demand	Anodyne	ACE	40	38
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061843	EF	On-Demand	Anodyne	FKBP1A	40	38
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061843	EF	On-Demand	Anodyne	CTSD	40	39
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061843	EF	On-Demand	Anodyne	PGC	61	37
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061843	EF	On-Demand	Anodyne	CACNA1B	45	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061843	EF	On-Demand	Anodyne	PREP	40	39
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061843	EF	On-Demand	Anodyne	AMY2	43	30
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061843	EF	On-Demand	Anodyne	REN	95	39
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061843	EF	On-Demand	Anodyne	ABCB1	25	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061843	EF	On-Demand	Anodyne	FPR1	45	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061843	EF	On-Demand	Anodyne	BIRC2	25	42
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061843	EF	On-Demand	Anodyne	GPR119	35	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061843	EF	On-Demand	Anodyne	SFRP1	54	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061843	EF	On-Demand	Anodyne	WNT3	52	36
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061845	EF	On-Demand	Anodyne	ACE	40	38
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061845	EF	On-Demand	Anodyne	FKBP1A	40	38
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061845	EF	On-Demand	Anodyne	CTSD	40	39
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061845	EF	On-Demand	Anodyne	PGC	61	37
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061845	EF	On-Demand	Anodyne	CACNA1B	45	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061845	EF	On-Demand	Anodyne	PREP	40	39
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061845	EF	On-Demand	Anodyne	AMY2	43	30
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061845	EF	On-Demand	Anodyne	REN	95	39
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061845	EF	On-Demand	Anodyne	ABCB1	25	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061845	EF	On-Demand	Anodyne	FPR1	45	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061845	EF	On-Demand	Anodyne	BIRC2	25	42
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061845	EF	On-Demand	Anodyne	GPR119	35	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061845	EF	On-Demand	Anodyne	SFRP1	54	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061845	EF	On-Demand	Anodyne	WNT3	52	36
O=C(Nc1ccccc1N1CCCC1)C(F)=C1CCC1	ZINC000819061846	CH	On-Demand	Anodyne	KCNQ2	100	53
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061847	EF	On-Demand	Anodyne	ACE	40	38
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061847	EF	On-Demand	Anodyne	FKBP1A	40	38
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061847	EF	On-Demand	Anodyne	CTSD	40	39
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061847	EF	On-Demand	Anodyne	PGC	61	37
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061847	EF	On-Demand	Anodyne	CACNA1B	45	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061847	EF	On-Demand	Anodyne	PREP	40	39
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061847	EF	On-Demand	Anodyne	AMY2	43	30
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061847	EF	On-Demand	Anodyne	REN	95	39
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061847	EF	On-Demand	Anodyne	ABCB1	25	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061847	EF	On-Demand	Anodyne	FPR1	45	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061847	EF	On-Demand	Anodyne	BIRC2	25	42
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061847	EF	On-Demand	Anodyne	GPR119	35	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061847	EF	On-Demand	Anodyne	SFRP1	54	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819061847	EF	On-Demand	Anodyne	WNT3	52	36
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819061848	GE	On-Demand	Anodyne	ADRB2	27	40
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819061848	GE	On-Demand	Anodyne	ADRB1	51	44
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819061848	GE	On-Demand	Anodyne	ADRB3	70	48
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819061848	GE	On-Demand	Anodyne	CYP3A4	47	36
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061849	EF	On-Demand	Anodyne	ACE	40	38
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061849	EF	On-Demand	Anodyne	FKBP1A	40	38
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061849	EF	On-Demand	Anodyne	CTSD	40	39
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061849	EF	On-Demand	Anodyne	PGC	61	37
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061849	EF	On-Demand	Anodyne	CACNA1B	45	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061849	EF	On-Demand	Anodyne	PREP	40	39
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061849	EF	On-Demand	Anodyne	AMY2	43	30
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061849	EF	On-Demand	Anodyne	REN	95	39
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061849	EF	On-Demand	Anodyne	ABCB1	25	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061849	EF	On-Demand	Anodyne	FPR1	45	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061849	EF	On-Demand	Anodyne	BIRC2	25	42
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061849	EF	On-Demand	Anodyne	GPR119	35	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061849	EF	On-Demand	Anodyne	SFRP1	54	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819061849	EF	On-Demand	Anodyne	WNT3	52	36
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819061850	GE	On-Demand	Anodyne	ADRB2	27	40
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819061850	GE	On-Demand	Anodyne	ADRB1	51	44
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819061850	GE	On-Demand	Anodyne	ADRB3	70	48
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819061850	GE	On-Demand	Anodyne	CYP3A4	47	36
O=C(/C=C\[C@@H]1CCCO1)NNc1ccccc1C(F)(F)F	ZINC000819061854	DF	On-Demand	Reactive	RBP4	48	40
O=C(/C=C\[C@H]1CCCO1)NNc1ccccc1C(F)(F)F	ZINC000819061856	DF	On-Demand	Reactive	RBP4	48	40
O=C(/C=C/[C@@H]1CCCO1)NNc1ccccc1C(F)(F)F	ZINC000819061857	DF	On-Demand	Reactive	RBP4	48	40
O=C(/C=C/[C@H]1CCCO1)NNc1ccccc1C(F)(F)F	ZINC000819061858	DF	On-Demand	Reactive	RBP4	48	40
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(F)cc2)c1	ZINC000819061859	DG	On-Demand	Anodyne	ADRB2	58	54
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(F)cc2)c1	ZINC000819061859	DG	On-Demand	Anodyne	ADRB1	40	50
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(F)cc2)c1	ZINC000819061859	DG	On-Demand	Anodyne	ADRB3	52	50
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccc(F)cc2)c1	ZINC000819061859	DG	On-Demand	Anodyne	BACE1	19	46
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819061860	DG	On-Demand	Anodyne	ADRB2	58	54
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819061860	DG	On-Demand	Anodyne	ADRB1	40	50
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819061860	DG	On-Demand	Anodyne	ADRB3	52	50
COc1cccc(C[C@@H](C)NC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819061860	DG	On-Demand	Anodyne	BACE1	19	46
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819061862	DG	On-Demand	Anodyne	ADRB2	58	54
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819061862	DG	On-Demand	Anodyne	ADRB1	40	50
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819061862	DG	On-Demand	Anodyne	ADRB3	52	50
COc1cccc(C[C@H](C)NC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819061862	DG	On-Demand	Anodyne	BACE1	19	46
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(F)cc2)c1	ZINC000819061864	DG	On-Demand	Anodyne	ADRB2	58	54
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(F)cc2)c1	ZINC000819061864	DG	On-Demand	Anodyne	ADRB1	40	50
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(F)cc2)c1	ZINC000819061864	DG	On-Demand	Anodyne	ADRB3	52	50
COc1cccc(C[C@H](C)NC[C@H](O)c2ccc(F)cc2)c1	ZINC000819061864	DG	On-Demand	Anodyne	BACE1	19	46
CC(=O)c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)c1	ZINC000819061873	FD	On-Demand	Anodyne	ADRB2	50	48
CC(=O)c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)c1	ZINC000819061873	FD	On-Demand	Anodyne	ADRB1	78	42
CC(=O)c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)c1	ZINC000819061873	FD	On-Demand	Anodyne	ADRB3	50	42
CC(=O)c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)c1	ZINC000819061873	FD	On-Demand	Anodyne	ABCB1	22	48
CC(=O)c1cccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)c1	ZINC000819061874	FD	On-Demand	Anodyne	ADRB2	50	48
CC(=O)c1cccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)c1	ZINC000819061874	FD	On-Demand	Anodyne	ADRB1	78	42
CC(=O)c1cccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)c1	ZINC000819061874	FD	On-Demand	Anodyne	ADRB3	50	42
CC(=O)c1cccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)c1	ZINC000819061874	FD	On-Demand	Anodyne	ABCB1	22	48
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819061889	FG	On-Demand	Anodyne	GPR119	40	43
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819061889	FG	On-Demand	Anodyne	WNT3	53	36
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819061890	FG	On-Demand	Anodyne	GPR119	40	43
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819061890	FG	On-Demand	Anodyne	WNT3	53	36
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819061891	FG	On-Demand	Anodyne	GPR119	40	43
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819061891	FG	On-Demand	Anodyne	WNT3	53	36
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819061892	FG	On-Demand	Anodyne	GPR119	40	43
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819061892	FG	On-Demand	Anodyne	WNT3	53	36
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819061893	GE	On-Demand	Anodyne	ADRB3	39	41
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819061894	GE	On-Demand	Anodyne	ADRB3	39	41
COc1ccc2[nH]cc(CCNCCC(=O)N(C)OC)c2c1	ZINC000819061905	DD	On-Demand	Anodyne	HTR1A	21	56
COc1ccc2[nH]cc(CCNCCC(=O)N(C)OC)c2c1	ZINC000819061905	DD	On-Demand	Anodyne	HTR1D	64	56
COc1ccc2[nH]cc(CCNCCC(=O)N(C)OC)c2c1	ZINC000819061905	DD	On-Demand	Anodyne	HTR1B	41	56
COc1ccc2[nH]cc(CCNCCC(=O)N(C)OC)c2c1	ZINC000819061905	DD	On-Demand	Anodyne	NQO2	34	62
COc1ccc2[nH]cc(CCNCCC(=O)N(C)OC)c2c1	ZINC000819061905	DD	On-Demand	Anodyne	MPO	72	44
COc1ccc2[nH]cc(CCNCCC(=O)N(C)OC)c2c1	ZINC000819061905	DD	On-Demand	Anodyne	HTR1E	24	47
COc1ccc2[nH]cc(CCNCCC(=O)N(C)OC)c2c1	ZINC000819061905	DD	On-Demand	Anodyne	MTNR1A	89	63
COc1ccc2[nH]cc(CCNCCC(=O)N(C)OC)c2c1	ZINC000819061905	DD	On-Demand	Anodyne	MTNR1B	68	62
COc1ccc2[nH]cc(CCNCCC(=O)N(C)OC)c2c1	ZINC000819061905	DD	On-Demand	Anodyne	ABCG2	26	43
C[C@@H](NCCC(=O)Nc1ccc(N(C)C)cc1)C(=O)N1CCCC[C@H]1C	ZINC000819061944	FE	On-Demand	Anodyne	ACE	21	44
C[C@H]1CCCCN1C(=O)[C@@H](C)NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819061945	FE	On-Demand	Anodyne	ACE	21	44
O[C@@H](CNCCCc1nnc2n1CCCCC2)c1ccccc1	ZINC000819061950	DE	On-Demand	Anodyne	ADRB2	15	41
O[C@@H](CNCCCc1nnc2n1CCCCC2)c1ccccc1	ZINC000819061950	DE	On-Demand	Anodyne	ADRB1	21	41
O[C@@H](CNCCCc1nnc2n1CCCCC2)c1ccccc1	ZINC000819061950	DE	On-Demand	Anodyne	ADRB3	52	41
O[C@H](CNCCCc1nnc2n1CCCCC2)c1ccccc1	ZINC000819061951	DE	On-Demand	Anodyne	ADRB2	15	41
O[C@H](CNCCCc1nnc2n1CCCCC2)c1ccccc1	ZINC000819061951	DE	On-Demand	Anodyne	ADRB1	21	41
O[C@H](CNCCCc1nnc2n1CCCCC2)c1ccccc1	ZINC000819061951	DE	On-Demand	Anodyne	ADRB3	52	41
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3)c2c1	ZINC000819061957	EG	On-Demand	Anodyne	ADRB2	31	45
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3)c2c1	ZINC000819061957	EG	On-Demand	Anodyne	HTR1A	21	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3)c2c1	ZINC000819061957	EG	On-Demand	Anodyne	HTR1D	42	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3)c2c1	ZINC000819061957	EG	On-Demand	Anodyne	HTR1B	34	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3)c2c1	ZINC000819061957	EG	On-Demand	Anodyne	SLC6A4	17	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3)c2c1	ZINC000819061957	EG	On-Demand	Anodyne	ADRB3	32	49
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3)c2c1	ZINC000819061957	EG	On-Demand	Anodyne	MPO	100	53
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3)c2c1	ZINC000819061957	EG	On-Demand	Anodyne	HTR1E	22	45
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3)c2c1	ZINC000819061957	EG	On-Demand	Anodyne	MTNR1A	44	57
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3)c2c1	ZINC000819061957	EG	On-Demand	Anodyne	MTNR1B	27	56
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(F)cc3)c2c1	ZINC000819061957	EG	On-Demand	Anodyne	ABCG2	24	40
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3)c2c1	ZINC000819061958	EG	On-Demand	Anodyne	ADRB2	31	45
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3)c2c1	ZINC000819061958	EG	On-Demand	Anodyne	HTR1A	21	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3)c2c1	ZINC000819061958	EG	On-Demand	Anodyne	HTR1D	42	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3)c2c1	ZINC000819061958	EG	On-Demand	Anodyne	HTR1B	34	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3)c2c1	ZINC000819061958	EG	On-Demand	Anodyne	SLC6A4	17	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3)c2c1	ZINC000819061958	EG	On-Demand	Anodyne	ADRB3	32	49
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3)c2c1	ZINC000819061958	EG	On-Demand	Anodyne	MPO	100	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3)c2c1	ZINC000819061958	EG	On-Demand	Anodyne	HTR1E	22	45
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3)c2c1	ZINC000819061958	EG	On-Demand	Anodyne	MTNR1A	44	57
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3)c2c1	ZINC000819061958	EG	On-Demand	Anodyne	MTNR1B	27	56
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(F)cc3)c2c1	ZINC000819061958	EG	On-Demand	Anodyne	ABCG2	24	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H]2OCCc3ccccc32)CC1	ZINC000819061961	GF	On-Demand	Anodyne	GPR119	34	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2OCCc3ccccc32)CC1	ZINC000819061962	GF	On-Demand	Anodyne	GPR119	34	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H]2OCCc3ccccc32)CC1	ZINC000819061963	GF	On-Demand	Anodyne	GPR119	34	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2OCCc3ccccc32)CC1	ZINC000819061964	GF	On-Demand	Anodyne	GPR119	34	44
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc([N+](=O)[O-])c3)c2c1	ZINC000819061969	FF	On-Demand	Bother	ADRB2	33	40
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc([N+](=O)[O-])c3)c2c1	ZINC000819061969	FF	On-Demand	Bother	ADRB1	42	41
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc([N+](=O)[O-])c3)c2c1	ZINC000819061969	FF	On-Demand	Bother	HTR1D	30	44
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc([N+](=O)[O-])c3)c2c1	ZINC000819061969	FF	On-Demand	Bother	ADRB3	63	48
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc([N+](=O)[O-])c3)c2c1	ZINC000819061969	FF	On-Demand	Bother	NQO2	25	51
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc([N+](=O)[O-])c3)c2c1	ZINC000819061969	FF	On-Demand	Bother	CACNA1D	59	35
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc([N+](=O)[O-])c3)c2c1	ZINC000819061969	FF	On-Demand	Bother	MTNR1A	50	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc([N+](=O)[O-])c3)c2c1	ZINC000819061969	FF	On-Demand	Bother	MTNR1B	37	51
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc([N+](=O)[O-])c3)c2c1	ZINC000819061970	FF	On-Demand	Bother	ADRB2	33	40
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc([N+](=O)[O-])c3)c2c1	ZINC000819061970	FF	On-Demand	Bother	ADRB1	42	41
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc([N+](=O)[O-])c3)c2c1	ZINC000819061970	FF	On-Demand	Bother	HTR1D	30	44
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc([N+](=O)[O-])c3)c2c1	ZINC000819061970	FF	On-Demand	Bother	ADRB3	63	48
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc([N+](=O)[O-])c3)c2c1	ZINC000819061970	FF	On-Demand	Bother	NQO2	25	51
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc([N+](=O)[O-])c3)c2c1	ZINC000819061970	FF	On-Demand	Bother	CACNA1D	59	35
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc([N+](=O)[O-])c3)c2c1	ZINC000819061970	FF	On-Demand	Bother	MTNR1A	50	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc([N+](=O)[O-])c3)c2c1	ZINC000819061970	FF	On-Demand	Bother	MTNR1B	37	51
COc1ccc2[nH]cc(CCNC[C@H](O)c3cc(C)cc(C)c3)c2c1	ZINC000819061975	EH	On-Demand	Anodyne	ADRB2	21	47
COc1ccc2[nH]cc(CCNC[C@H](O)c3cc(C)cc(C)c3)c2c1	ZINC000819061975	EH	On-Demand	Anodyne	HTR1D	41	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3cc(C)cc(C)c3)c2c1	ZINC000819061975	EH	On-Demand	Anodyne	HTR1B	33	52
COc1ccc2[nH]cc(CCNC[C@H](O)c3cc(C)cc(C)c3)c2c1	ZINC000819061975	EH	On-Demand	Anodyne	ADRB3	22	49
COc1ccc2[nH]cc(CCNC[C@H](O)c3cc(C)cc(C)c3)c2c1	ZINC000819061975	EH	On-Demand	Anodyne	MPO	67	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3cc(C)cc(C)c3)c2c1	ZINC000819061975	EH	On-Demand	Anodyne	HTR1E	22	45
COc1ccc2[nH]cc(CCNC[C@H](O)c3cc(C)cc(C)c3)c2c1	ZINC000819061975	EH	On-Demand	Anodyne	MTNR1A	43	57
COc1ccc2[nH]cc(CCNC[C@H](O)c3cc(C)cc(C)c3)c2c1	ZINC000819061975	EH	On-Demand	Anodyne	MTNR1B	26	56
COc1ccc2[nH]cc(CCNC[C@H](O)c3cc(C)cc(C)c3)c2c1	ZINC000819061975	EH	On-Demand	Anodyne	ABCG2	24	40
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cc(C)cc(C)c3)c2c1	ZINC000819061976	EH	On-Demand	Anodyne	ADRB2	21	47
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cc(C)cc(C)c3)c2c1	ZINC000819061976	EH	On-Demand	Anodyne	HTR1D	41	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cc(C)cc(C)c3)c2c1	ZINC000819061976	EH	On-Demand	Anodyne	HTR1B	33	52
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cc(C)cc(C)c3)c2c1	ZINC000819061976	EH	On-Demand	Anodyne	ADRB3	22	49
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cc(C)cc(C)c3)c2c1	ZINC000819061976	EH	On-Demand	Anodyne	MPO	67	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cc(C)cc(C)c3)c2c1	ZINC000819061976	EH	On-Demand	Anodyne	HTR1E	22	45
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cc(C)cc(C)c3)c2c1	ZINC000819061976	EH	On-Demand	Anodyne	MTNR1A	43	57
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cc(C)cc(C)c3)c2c1	ZINC000819061976	EH	On-Demand	Anodyne	MTNR1B	26	56
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cc(C)cc(C)c3)c2c1	ZINC000819061976	EH	On-Demand	Anodyne	ABCG2	24	40
CSc1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061984	EG	On-Demand	Anodyne	ADRB2	53	50
CSc1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061984	EG	On-Demand	Anodyne	ADRB1	73	43
CSc1ccc(OC[C@@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061984	EG	On-Demand	Anodyne	ADRB3	40	43
CSc1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061985	EG	On-Demand	Anodyne	ADRB2	53	50
CSc1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061985	EG	On-Demand	Anodyne	ADRB1	73	43
CSc1ccc(OC[C@H](O)CNC/C=C\c2ccccc2)cc1	ZINC000819061985	EG	On-Demand	Anodyne	ADRB3	40	43
CSc1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061986	EG	On-Demand	Anodyne	ADRB2	53	50
CSc1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061986	EG	On-Demand	Anodyne	ADRB1	73	43
CSc1ccc(OC[C@@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061986	EG	On-Demand	Anodyne	ADRB3	40	43
CSc1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061987	EG	On-Demand	Anodyne	ADRB2	53	50
CSc1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061987	EG	On-Demand	Anodyne	ADRB1	73	43
CSc1ccc(OC[C@H](O)CNC/C=C/c2ccccc2)cc1	ZINC000819061987	EG	On-Demand	Anodyne	ADRB3	40	43
O=C(/C=C/[C@H]1CCCO1)Nc1ccccc1N1CCCC1	ZINC000819061996	CF	On-Demand	Anodyne	KCNQ2	84	46
O=C(/C=C\[C@H]1CCCO1)Nc1ccccc1N1CCCC1	ZINC000819061997	CF	On-Demand	Anodyne	KCNQ2	84	46
O=C(/C=C\[C@@H]1CCCO1)Nc1ccccc1N1CCCC1	ZINC000819061998	CF	On-Demand	Anodyne	KCNQ2	84	46
O=C(/C=C/[C@@H]1CCCO1)Nc1ccccc1N1CCCC1	ZINC000819062000	CF	On-Demand	Anodyne	KCNQ2	84	46
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccccc2Cl)c1	ZINC000819062002	DH	On-Demand	Anodyne	ADRB2	46	47
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccccc2Cl)c1	ZINC000819062002	DH	On-Demand	Anodyne	ADRB1	33	52
COc1cccc(C[C@@H](C)NC[C@H](O)c2ccccc2Cl)c1	ZINC000819062002	DH	On-Demand	Anodyne	ADRB3	39	44
COc1cccc(C[C@H](C)NC[C@H](O)c2ccccc2Cl)c1	ZINC000819062004	DH	On-Demand	Anodyne	ADRB2	46	47
COc1cccc(C[C@H](C)NC[C@H](O)c2ccccc2Cl)c1	ZINC000819062004	DH	On-Demand	Anodyne	ADRB1	33	52
COc1cccc(C[C@H](C)NC[C@H](O)c2ccccc2Cl)c1	ZINC000819062004	DH	On-Demand	Anodyne	ADRB3	39	44
Cc1ccccc1[C@@H](O)CNC[C@H]1CCCN1C	ZINC000819062013	BD	On-Demand	Anodyne	CHRNA10	59	41
Cc1ccccc1[C@@H](O)CNC[C@@H]1CCCN1C	ZINC000819062016	BD	On-Demand	Anodyne	CHRNA10	59	41
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819062029	GI	On-Demand	Anodyne	ADRB2	25	40
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819062029	GI	On-Demand	Anodyne	ADRB1	33	40
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819062029	GI	On-Demand	Anodyne	HTR1D	33	46
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819062029	GI	On-Demand	Anodyne	HTR1B	29	46
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819062029	GI	On-Demand	Anodyne	ADRB3	49	53
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819062029	GI	On-Demand	Anodyne	NQO2	22	50
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819062029	GI	On-Demand	Anodyne	MPO	56	40
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819062029	GI	On-Demand	Anodyne	MTNR1A	38	54
COc1ccc2[nH]cc(CCNC[C@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819062029	GI	On-Demand	Anodyne	MTNR1B	25	50
Cc1ccccc1[C@@H](O)CNCCNC(=O)c1c(F)cccc1F	ZINC000819062030	EE	On-Demand	Anodyne	DAC	23	42
Cc1ccccc1[C@@H](O)CNCCNC(=O)c1c(F)cccc1F	ZINC000819062030	EE	On-Demand	Anodyne	CTSA	51	35
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819062032	GI	On-Demand	Anodyne	ADRB2	25	40
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819062032	GI	On-Demand	Anodyne	ADRB1	33	40
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819062032	GI	On-Demand	Anodyne	HTR1D	33	46
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819062032	GI	On-Demand	Anodyne	HTR1B	29	46
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819062032	GI	On-Demand	Anodyne	ADRB3	49	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819062032	GI	On-Demand	Anodyne	NQO2	22	50
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819062032	GI	On-Demand	Anodyne	MPO	56	40
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819062032	GI	On-Demand	Anodyne	MTNR1A	38	54
COc1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819062032	GI	On-Demand	Anodyne	MTNR1B	25	50
CCn1c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc21	ZINC000819062033	GH	On-Demand	Mild	PAPA1_CARPA	42	43
CCn1c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc21	ZINC000819062033	GH	On-Demand	Mild	FPR1	42	38
CCn1c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc21	ZINC000819062036	GH	On-Demand	Mild	PAPA1_CARPA	42	43
CCn1c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc21	ZINC000819062036	GH	On-Demand	Mild	FPR1	42	38
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(OC(F)(F)F)cc3)c2c1	ZINC000819062063	GH	On-Demand	Anodyne	ADRB2	30	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(OC(F)(F)F)cc3)c2c1	ZINC000819062063	GH	On-Demand	Anodyne	HTR1D	34	49
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(OC(F)(F)F)cc3)c2c1	ZINC000819062063	GH	On-Demand	Anodyne	ADRB3	28	47
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(OC(F)(F)F)cc3)c2c1	ZINC000819062063	GH	On-Demand	Anodyne	MPO	71	42
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(OC(F)(F)F)cc3)c2c1	ZINC000819062063	GH	On-Demand	Anodyne	HTR1E	15	43
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(OC(F)(F)F)cc3)c2c1	ZINC000819062063	GH	On-Demand	Anodyne	MTNR1A	37	58
COc1ccc2[nH]cc(CCNC[C@H](O)c3ccc(OC(F)(F)F)cc3)c2c1	ZINC000819062063	GH	On-Demand	Anodyne	MTNR1B	21	53
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(OC(F)(F)F)cc3)c2c1	ZINC000819062065	GH	On-Demand	Anodyne	ADRB2	30	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(OC(F)(F)F)cc3)c2c1	ZINC000819062065	GH	On-Demand	Anodyne	HTR1D	34	49
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(OC(F)(F)F)cc3)c2c1	ZINC000819062065	GH	On-Demand	Anodyne	ADRB3	28	47
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(OC(F)(F)F)cc3)c2c1	ZINC000819062065	GH	On-Demand	Anodyne	MPO	71	42
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(OC(F)(F)F)cc3)c2c1	ZINC000819062065	GH	On-Demand	Anodyne	HTR1E	15	43
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(OC(F)(F)F)cc3)c2c1	ZINC000819062065	GH	On-Demand	Anodyne	MTNR1A	37	58
COc1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(OC(F)(F)F)cc3)c2c1	ZINC000819062065	GH	On-Demand	Anodyne	MTNR1B	21	53
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)COc2ccccc2)CC1	ZINC000819062069	GD	On-Demand	Anodyne	ADRB2	59	48
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)COc2ccccc2)CC1	ZINC000819062069	GD	On-Demand	Anodyne	ADRB1	92	59
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)COc2ccccc2)CC1	ZINC000819062069	GD	On-Demand	Anodyne	ADRB3	71	59
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)COc2ccccc2)CC1	ZINC000819062073	GD	On-Demand	Anodyne	ADRB2	59	48
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)COc2ccccc2)CC1	ZINC000819062073	GD	On-Demand	Anodyne	ADRB1	92	59
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)COc2ccccc2)CC1	ZINC000819062073	GD	On-Demand	Anodyne	ADRB3	71	59
N#Cc1ccc(OC[C@@H](O)CNCCCSc2nccs2)cc1	ZINC000819062099	EF	On-Demand	Mild	ADRB2	32	40
N#Cc1ccc(OC[C@@H](O)CNCCCSc2nccs2)cc1	ZINC000819062099	EF	On-Demand	Mild	ADRB1	57	40
N#Cc1ccc(OC[C@@H](O)CNCCCSc2nccs2)cc1	ZINC000819062099	EF	On-Demand	Mild	ADRB3	31	40
N#Cc1ccc(OC[C@H](O)CNCCCSc2nccs2)cc1	ZINC000819062105	EF	On-Demand	Mild	ADRB2	32	40
N#Cc1ccc(OC[C@H](O)CNCCCSc2nccs2)cc1	ZINC000819062105	EF	On-Demand	Mild	ADRB1	57	40
N#Cc1ccc(OC[C@H](O)CNCCCSc2nccs2)cc1	ZINC000819062105	EF	On-Demand	Mild	ADRB3	31	40
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)COc2ccccc2F)CC1	ZINC000819062108	GD	On-Demand	Anodyne	ADRB2	33	40
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)COc2ccccc2F)CC1	ZINC000819062108	GD	On-Demand	Anodyne	ADRB1	56	38
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)COc2ccccc2F)CC1	ZINC000819062108	GD	On-Demand	Anodyne	ADRB3	29	49
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)COc2ccccc2F)CC1	ZINC000819062112	GD	On-Demand	Anodyne	ADRB2	33	40
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)COc2ccccc2F)CC1	ZINC000819062112	GD	On-Demand	Anodyne	ADRB1	56	38
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)COc2ccccc2F)CC1	ZINC000819062112	GD	On-Demand	Anodyne	ADRB3	29	49
CN1CCN(C(C)(C)CNC[C@H](O)c2cccnc2)CC1	ZINC000819062116	CC	On-Demand	Anodyne	ADRB2	21	40
CN1CCN(C(C)(C)CNC[C@H](O)c2cccnc2)CC1	ZINC000819062116	CC	On-Demand	Anodyne	ADRB1	23	43
CN1CCN(C(C)(C)CNC[C@H](O)c2cccnc2)CC1	ZINC000819062116	CC	On-Demand	Anodyne	ADRB3	89	51
CN1CCN(C(C)(C)CNC[C@@H](O)c2cccnc2)CC1	ZINC000819062119	CC	On-Demand	Anodyne	ADRB2	21	40
CN1CCN(C(C)(C)CNC[C@@H](O)c2cccnc2)CC1	ZINC000819062119	CC	On-Demand	Anodyne	ADRB1	23	43
CN1CCN(C(C)(C)CNC[C@@H](O)c2cccnc2)CC1	ZINC000819062119	CC	On-Demand	Anodyne	ADRB3	89	51
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819062134	GD	On-Demand	Anodyne	ADRB2	40	50
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819062134	GD	On-Demand	Anodyne	ADRB1	74	50
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819062134	GD	On-Demand	Anodyne	ADRB3	53	44
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819062135	GD	On-Demand	Anodyne	ADRB2	40	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819062135	GD	On-Demand	Anodyne	ADRB1	74	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819062135	GD	On-Demand	Anodyne	ADRB3	53	44
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819062137	GD	On-Demand	Anodyne	ADRB2	40	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819062137	GD	On-Demand	Anodyne	ADRB1	74	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819062137	GD	On-Demand	Anodyne	ADRB3	53	44
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819062138	GD	On-Demand	Anodyne	ADRB2	40	50
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819062138	GD	On-Demand	Anodyne	ADRB1	74	50
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819062138	GD	On-Demand	Anodyne	ADRB3	53	44
COc1cccc(OC)c1OC[C@H](O)CNC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819062140	GD	On-Demand	Anodyne	ADRB2	33	48
COc1cccc(OC)c1OC[C@H](O)CNC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819062140	GD	On-Demand	Anodyne	ADRB1	29	48
COc1cccc(OC)c1OC[C@H](O)CNC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819062140	GD	On-Demand	Anodyne	ADRB3	24	42
COc1cccc(OC)c1OC[C@H](O)CNC1CCN(C[C@H]2CCCO2)CC1	ZINC000819062141	GD	On-Demand	Anodyne	ADRB2	33	48
COc1cccc(OC)c1OC[C@H](O)CNC1CCN(C[C@H]2CCCO2)CC1	ZINC000819062141	GD	On-Demand	Anodyne	ADRB1	29	48
COc1cccc(OC)c1OC[C@H](O)CNC1CCN(C[C@H]2CCCO2)CC1	ZINC000819062141	GD	On-Demand	Anodyne	ADRB3	24	42
COc1cccc(OC)c1OC[C@@H](O)CNC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819062143	GD	On-Demand	Anodyne	ADRB2	33	48
COc1cccc(OC)c1OC[C@@H](O)CNC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819062143	GD	On-Demand	Anodyne	ADRB1	29	48
COc1cccc(OC)c1OC[C@@H](O)CNC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819062143	GD	On-Demand	Anodyne	ADRB3	24	42
COc1cccc(OC)c1OC[C@@H](O)CNC1CCN(C[C@H]2CCCO2)CC1	ZINC000819062144	GD	On-Demand	Anodyne	ADRB2	33	48
COc1cccc(OC)c1OC[C@@H](O)CNC1CCN(C[C@H]2CCCO2)CC1	ZINC000819062144	GD	On-Demand	Anodyne	ADRB1	29	48
COc1cccc(OC)c1OC[C@@H](O)CNC1CCN(C[C@H]2CCCO2)CC1	ZINC000819062144	GD	On-Demand	Anodyne	ADRB3	24	42
CSc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819062156	FD	On-Demand	Anodyne	ADRB2	50	46
CSc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819062156	FD	On-Demand	Anodyne	ADRB1	74	46
CSc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819062156	FD	On-Demand	Anodyne	GRIN1	18	46
CSc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819062156	FD	On-Demand	Anodyne	ADRB3	46	46
CSc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819062158	FD	On-Demand	Anodyne	ADRB2	50	46
CSc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819062158	FD	On-Demand	Anodyne	ADRB1	74	46
CSc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819062158	FD	On-Demand	Anodyne	GRIN1	18	46
CSc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819062158	FD	On-Demand	Anodyne	ADRB3	46	46
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819062179	FG	On-Demand	Anodyne	GPR119	40	46
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819062180	FG	On-Demand	Anodyne	GPR119	40	46
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819062183	FG	On-Demand	Anodyne	GPR119	40	46
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819062185	FG	On-Demand	Anodyne	GPR119	40	46
Cc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c(C)c1	ZINC000819062201	FF	On-Demand	Anodyne	ADRB2	30	48
Cc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c(C)c1	ZINC000819062201	FF	On-Demand	Anodyne	ADRB1	25	48
Cc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c(C)c1	ZINC000819062201	FF	On-Demand	Anodyne	ADRB3	26	40
Cc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c(C)c1	ZINC000819062201	FF	On-Demand	Anodyne	GPR119	40	39
CC(C)(C)OC(=O)N1CCCC[C@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819062202	GF	On-Demand	Anodyne	MMP13	17	43
CC(C)(C)OC(=O)N1CCCC[C@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819062202	GF	On-Demand	Anodyne	EPHX2	19	40
CC(C)(C)OC(=O)N1CCCC[C@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819062202	GF	On-Demand	Anodyne	CCR8	35	41
CC(C)(C)OC(=O)N1CCCC[C@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819062202	GF	On-Demand	Anodyne	GPR119	49	41
CC(C)(C)OC(=O)N1CCCC[C@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819062202	GF	On-Demand	Anodyne	SFRP1	135	46
CC(C)(C)OC(=O)N1CCCC[C@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819062202	GF	On-Demand	Anodyne	WNT3	93	42
CC(C)(C)OC(=O)N1CCCC[C@@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819062205	GF	On-Demand	Anodyne	MMP13	17	43
CC(C)(C)OC(=O)N1CCCC[C@@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819062205	GF	On-Demand	Anodyne	EPHX2	19	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819062205	GF	On-Demand	Anodyne	CCR8	35	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819062205	GF	On-Demand	Anodyne	GPR119	49	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819062205	GF	On-Demand	Anodyne	SFRP1	135	46
CC(C)(C)OC(=O)N1CCCC[C@@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819062205	GF	On-Demand	Anodyne	WNT3	93	42
Cc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c(C)c1	ZINC000819062208	FF	On-Demand	Anodyne	ADRB2	30	48
Cc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c(C)c1	ZINC000819062208	FF	On-Demand	Anodyne	ADRB1	25	48
Cc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c(C)c1	ZINC000819062208	FF	On-Demand	Anodyne	ADRB3	26	40
Cc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c(C)c1	ZINC000819062208	FF	On-Demand	Anodyne	GPR119	40	39
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819062220	GE	On-Demand	Anodyne	SLC6A3	26	40
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819062222	GE	On-Demand	Anodyne	SLC6A3	26	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cccc(O)c2)CC1	ZINC000819062229	FE	On-Demand	Anodyne	GPR119	52	55
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cccc(O)c2)CC1	ZINC000819062231	FE	On-Demand	Anodyne	GPR119	52	55
O[C@H](CNCCCSc1nccs1)c1cccc(Cl)c1	ZINC000819062253	EH	On-Demand	Clean	ADRB1	46	44
O[C@H](CNCCCSc1nccs1)c1cccc(Cl)c1	ZINC000819062253	EH	On-Demand	Clean	ADRB3	54	44
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819062257	GF	On-Demand	Anodyne	ADRB2	43	36
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819062257	GF	On-Demand	Anodyne	ADRB1	60	51
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819062257	GF	On-Demand	Anodyne	HTR1A	15	46
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819062257	GF	On-Demand	Anodyne	DRD3	24	46
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819062257	GF	On-Demand	Anodyne	ADRB3	96	55
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819062257	GF	On-Demand	Anodyne	IGF1R	27	40
O=C(C1CCCCC1)N1CCN(CCNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819062257	GF	On-Demand	Anodyne	CYP3A4	47	40
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819062258	GF	On-Demand	Anodyne	ADRB2	43	36
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819062258	GF	On-Demand	Anodyne	ADRB1	60	51
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819062258	GF	On-Demand	Anodyne	HTR1A	15	46
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819062258	GF	On-Demand	Anodyne	DRD3	24	46
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819062258	GF	On-Demand	Anodyne	ADRB3	96	55
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819062258	GF	On-Demand	Anodyne	IGF1R	27	40
O=C(C1CCCCC1)N1CCN(CCNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819062258	GF	On-Demand	Anodyne	CYP3A4	47	40
O[C@@H](CNCCCSc1nccs1)c1cccc(Cl)c1	ZINC000819062259	EH	On-Demand	Clean	ADRB1	46	44
O[C@@H](CNCCCSc1nccs1)c1cccc(Cl)c1	ZINC000819062259	EH	On-Demand	Clean	ADRB3	54	44
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062275	GD	On-Demand	Anodyne	ADRB2	46	55
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062275	GD	On-Demand	Anodyne	ADRB1	79	55
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062275	GD	On-Demand	Anodyne	ADRB3	58	49
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062275	GD	On-Demand	Anodyne	ACOX1	45	34
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062275	GD	On-Demand	Anodyne	GPR119	35	41
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062276	GD	On-Demand	Anodyne	ADRB2	46	55
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062276	GD	On-Demand	Anodyne	ADRB1	79	55
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062276	GD	On-Demand	Anodyne	ADRB3	58	49
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062276	GD	On-Demand	Anodyne	ACOX1	45	34
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062276	GD	On-Demand	Anodyne	GPR119	35	41
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819062279	FD	On-Demand	Anodyne	SLC6A3	30	45
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819062279	FD	On-Demand	Anodyne	ADRB3	19	43
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819062286	FD	On-Demand	Anodyne	SLC6A3	30	45
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819062286	FD	On-Demand	Anodyne	ADRB3	19	43
CC[C@@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819062294	CD	On-Demand	Anodyne	GPR119	32	45
CC[C@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819062297	CD	On-Demand	Anodyne	GPR119	32	45
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819062328	EG	On-Demand	Anodyne	ADRB1	23	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819062328	EG	On-Demand	Anodyne	SSTR2	52	37
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819062328	EG	On-Demand	Anodyne	ADRB3	46	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819062328	EG	On-Demand	Anodyne	AMY2	45	32
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819062328	EG	On-Demand	Anodyne	BIRC2	23	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819062328	EG	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819062328	EG	On-Demand	Anodyne	SFRP1	79	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819062328	EG	On-Demand	Anodyne	WNT3	65	37
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819062329	EG	On-Demand	Anodyne	ADRB1	23	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819062329	EG	On-Demand	Anodyne	SSTR2	52	37
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819062329	EG	On-Demand	Anodyne	ADRB3	46	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819062329	EG	On-Demand	Anodyne	AMY2	45	32
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819062329	EG	On-Demand	Anodyne	BIRC2	23	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819062329	EG	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819062329	EG	On-Demand	Anodyne	SFRP1	79	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819062329	EG	On-Demand	Anodyne	WNT3	65	37
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819062330	EG	On-Demand	Anodyne	ADRB1	23	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819062330	EG	On-Demand	Anodyne	SSTR2	52	37
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819062330	EG	On-Demand	Anodyne	ADRB3	46	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819062330	EG	On-Demand	Anodyne	AMY2	45	32
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819062330	EG	On-Demand	Anodyne	BIRC2	23	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819062330	EG	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819062330	EG	On-Demand	Anodyne	SFRP1	79	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819062330	EG	On-Demand	Anodyne	WNT3	65	37
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819062331	EG	On-Demand	Anodyne	ADRB1	23	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819062331	EG	On-Demand	Anodyne	SSTR2	52	37
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819062331	EG	On-Demand	Anodyne	ADRB3	46	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819062331	EG	On-Demand	Anodyne	AMY2	45	32
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819062331	EG	On-Demand	Anodyne	BIRC2	23	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819062331	EG	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819062331	EG	On-Demand	Anodyne	SFRP1	79	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819062331	EG	On-Demand	Anodyne	WNT3	65	37
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819062361	ED	On-Demand	Anodyne	ADRB2	58	52
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819062361	ED	On-Demand	Anodyne	ADRB1	83	52
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819062361	ED	On-Demand	Anodyne	GRIN1	21	47
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819062361	ED	On-Demand	Anodyne	ADRB3	53	52
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819062362	ED	On-Demand	Anodyne	ADRB2	58	52
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819062362	ED	On-Demand	Anodyne	ADRB1	83	52
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819062362	ED	On-Demand	Anodyne	GRIN1	21	47
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)(C)C)cc1	ZINC000819062362	ED	On-Demand	Anodyne	ADRB3	53	52
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819062394	FF	On-Demand	Mild	ADRB3	17	49
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819062394	FF	On-Demand	Mild	GPR119	33	45
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819062395	FF	On-Demand	Mild	ADRB3	17	49
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819062395	FF	On-Demand	Mild	GPR119	33	45
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819062396	FF	On-Demand	Mild	ADRB3	17	49
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819062396	FF	On-Demand	Mild	GPR119	33	45
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819062397	FF	On-Demand	Mild	ADRB3	17	49
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819062397	FF	On-Demand	Mild	GPR119	33	45
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819062418	GF	On-Demand	Mild	ADRB2	28	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819062418	GF	On-Demand	Mild	ADRB1	39	42
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819062418	GF	On-Demand	Mild	ADRB3	24	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819062418	GF	On-Demand	Mild	GPR119	32	46
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819062419	GF	On-Demand	Mild	ADRB2	28	40
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819062419	GF	On-Demand	Mild	ADRB1	39	42
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819062419	GF	On-Demand	Mild	ADRB3	24	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819062419	GF	On-Demand	Mild	GPR119	32	46
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819062420	GF	On-Demand	Mild	ADRB2	28	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819062420	GF	On-Demand	Mild	ADRB1	39	42
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819062420	GF	On-Demand	Mild	ADRB3	24	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819062420	GF	On-Demand	Mild	GPR119	32	46
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819062421	GF	On-Demand	Mild	ADRB2	28	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819062421	GF	On-Demand	Mild	ADRB1	39	42
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819062421	GF	On-Demand	Mild	ADRB3	24	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819062421	GF	On-Demand	Mild	GPR119	32	46
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)c1ccccc1C(F)(F)F	ZINC000819062463	FF	On-Demand	Anodyne	SFRP1	65	34
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)c1ccccc1C(F)(F)F	ZINC000819062463	FF	On-Demand	Anodyne	WNT3	40	33
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)c1ccccc1C(F)(F)F	ZINC000819062464	FF	On-Demand	Anodyne	SFRP1	65	34
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)c1ccccc1C(F)(F)F	ZINC000819062464	FF	On-Demand	Anodyne	WNT3	40	33
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)c1ccccc1C(F)(F)F	ZINC000819062465	FF	On-Demand	Anodyne	SFRP1	65	34
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)c1ccccc1C(F)(F)F	ZINC000819062465	FF	On-Demand	Anodyne	WNT3	40	33
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)c1ccccc1C(F)(F)F	ZINC000819062466	FF	On-Demand	Anodyne	SFRP1	65	34
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)c1ccccc1C(F)(F)F	ZINC000819062466	FF	On-Demand	Anodyne	WNT3	40	33
COc1ccc(OC)c([C@H](O)CNCCC(=O)N2CCN(C)CC2)c1	ZINC000819062468	FC	On-Demand	Anodyne	ADRB2	16	44
O[C@H](CNCCCSc1nccs1)COc1ccccc1	ZINC000819062502	DF	On-Demand	Clean	ADRB2	50	49
O[C@H](CNCCCSc1nccs1)COc1ccccc1	ZINC000819062502	DF	On-Demand	Clean	ADRB1	76	46
O[C@H](CNCCCSc1nccs1)COc1ccccc1	ZINC000819062502	DF	On-Demand	Clean	ADRB3	51	46
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1cccc2ccccc12	ZINC000819062504	GF	On-Demand	Anodyne	ADRB2	39	51
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1cccc2ccccc12	ZINC000819062504	GF	On-Demand	Anodyne	ADRB1	32	51
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1cccc2ccccc12	ZINC000819062504	GF	On-Demand	Anodyne	ADRB3	27	47
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1cccc2ccccc12	ZINC000819062504	GF	On-Demand	Anodyne	ABCB1	29	41
O[C@@H](CNCCCSc1nccs1)COc1ccccc1	ZINC000819062505	DF	On-Demand	Clean	ADRB2	50	49
O[C@@H](CNCCCSc1nccs1)COc1ccccc1	ZINC000819062505	DF	On-Demand	Clean	ADRB1	76	46
O[C@@H](CNCCCSc1nccs1)COc1ccccc1	ZINC000819062505	DF	On-Demand	Clean	ADRB3	51	46
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1cccc2ccccc12	ZINC000819062507	GF	On-Demand	Anodyne	ADRB2	39	51
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1cccc2ccccc12	ZINC000819062507	GF	On-Demand	Anodyne	ADRB1	32	51
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1cccc2ccccc12	ZINC000819062507	GF	On-Demand	Anodyne	ADRB3	27	47
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1cccc2ccccc12	ZINC000819062507	GF	On-Demand	Anodyne	ABCB1	29	41
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1cccc2ccccc12	ZINC000819062509	GF	On-Demand	Anodyne	ADRB2	39	51
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1cccc2ccccc12	ZINC000819062509	GF	On-Demand	Anodyne	ADRB1	32	51
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1cccc2ccccc12	ZINC000819062509	GF	On-Demand	Anodyne	ADRB3	27	47
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1cccc2ccccc12	ZINC000819062509	GF	On-Demand	Anodyne	ABCB1	29	41
CCOc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062510	GE	On-Demand	Anodyne	ADRB2	46	50
CCOc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062510	GE	On-Demand	Anodyne	ADRB1	62	50
CCOc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062510	GE	On-Demand	Anodyne	ADRB3	46	53
CCOc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062510	GE	On-Demand	Anodyne	MMP13	19	46
CCOc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062510	GE	On-Demand	Anodyne	ACOX1	43	31
CCOc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062510	GE	On-Demand	Anodyne	GPR119	41	47
CCOc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062511	GE	On-Demand	Anodyne	ADRB2	46	50
CCOc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062511	GE	On-Demand	Anodyne	ADRB1	62	50
CCOc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062511	GE	On-Demand	Anodyne	ADRB3	46	53
CCOc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062511	GE	On-Demand	Anodyne	MMP13	19	46
CCOc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062511	GE	On-Demand	Anodyne	ACOX1	43	31
CCOc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062511	GE	On-Demand	Anodyne	GPR119	41	47
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1cccc2ccccc12	ZINC000819062520	GF	On-Demand	Anodyne	ADRB2	39	51
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1cccc2ccccc12	ZINC000819062520	GF	On-Demand	Anodyne	ADRB1	32	51
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1cccc2ccccc12	ZINC000819062520	GF	On-Demand	Anodyne	ADRB3	27	47
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1cccc2ccccc12	ZINC000819062520	GF	On-Demand	Anodyne	ABCB1	29	41
CCn1c(NNC(=O)c2cc(C)ccc2C2CC2)nc2ccccc2c1=O	ZINC000819062532	FG	On-Demand	Reactive	ADAM17	40	33
CCn1c(NNC(=O)c2cc(C)ccc2C2CC2)nc2ccccc2c1=O	ZINC000819062532	FG	On-Demand	Reactive	CCKBR	19	45
CC(C)(C)CC(C)(C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819062591	FH	On-Demand	Mild	PAPA1_CARPA	42	53
CC(C)(C)CC(C)(C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819062591	FH	On-Demand	Mild	CTSK	16	50
CC(C)(C)CC(C)(C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819062592	FH	On-Demand	Mild	PAPA1_CARPA	42	53
CC(C)(C)CC(C)(C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819062592	FH	On-Demand	Mild	CTSK	16	50
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062637	FE	On-Demand	Anodyne	ADRB2	30	69
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062637	FE	On-Demand	Anodyne	ADRB1	30	69
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062637	FE	On-Demand	Anodyne	HTR1A	15	69
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062637	FE	On-Demand	Anodyne	SLC6A4	18	42
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062637	FE	On-Demand	Anodyne	ADRB3	27	52
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062638	FE	On-Demand	Anodyne	ADRB2	30	69
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062638	FE	On-Demand	Anodyne	ADRB1	30	69
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062638	FE	On-Demand	Anodyne	HTR1A	15	69
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062638	FE	On-Demand	Anodyne	SLC6A4	18	42
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062638	FE	On-Demand	Anodyne	ADRB3	27	52
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062639	FE	On-Demand	Anodyne	ADRB2	30	69
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062639	FE	On-Demand	Anodyne	ADRB1	30	69
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062639	FE	On-Demand	Anodyne	HTR1A	15	69
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062639	FE	On-Demand	Anodyne	SLC6A4	18	42
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062639	FE	On-Demand	Anodyne	ADRB3	27	52
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062640	FE	On-Demand	Anodyne	ADRB2	30	69
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062640	FE	On-Demand	Anodyne	ADRB1	30	69
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062640	FE	On-Demand	Anodyne	HTR1A	15	69
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062640	FE	On-Demand	Anodyne	SLC6A4	18	42
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1cccc2[nH]ccc12	ZINC000819062640	FE	On-Demand	Anodyne	ADRB3	27	52
N#Cc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819062647	FD	On-Demand	Mild	ADRB2	24	43
N#Cc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819062647	FD	On-Demand	Mild	ADRB1	34	45
N#Cc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819062647	FD	On-Demand	Mild	ADRB3	23	43
N#Cc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819062648	FD	On-Demand	Mild	ADRB2	24	43
N#Cc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819062648	FD	On-Demand	Mild	ADRB1	34	45
N#Cc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819062648	FD	On-Demand	Mild	ADRB3	23	43
N#Cc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819062649	FD	On-Demand	Mild	ADRB2	24	43
N#Cc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819062649	FD	On-Demand	Mild	ADRB1	34	45
N#Cc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819062649	FD	On-Demand	Mild	ADRB3	23	43
N#Cc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819062650	FD	On-Demand	Mild	ADRB2	24	43
N#Cc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819062650	FD	On-Demand	Mild	ADRB1	34	45
N#Cc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819062650	FD	On-Demand	Mild	ADRB3	23	43
COC[C@@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819062669	CC	On-Demand	Anodyne	GPR119	22	41
O[C@@H](CNCCCOC[C@H]1CCCO1)c1cccnc1	ZINC000819062677	CD	On-Demand	Anodyne	ADRB2	33	47
O[C@@H](CNCCCOC[C@H]1CCCO1)c1cccnc1	ZINC000819062677	CD	On-Demand	Anodyne	ADRB1	35	48
O[C@@H](CNCCCOC[C@H]1CCCO1)c1cccnc1	ZINC000819062677	CD	On-Demand	Anodyne	ADRB3	103	49
O[C@@H](CNCCCOC[C@@H]1CCCO1)c1cccnc1	ZINC000819062678	CD	On-Demand	Anodyne	ADRB2	33	47
O[C@@H](CNCCCOC[C@@H]1CCCO1)c1cccnc1	ZINC000819062678	CD	On-Demand	Anodyne	ADRB1	35	48
O[C@@H](CNCCCOC[C@@H]1CCCO1)c1cccnc1	ZINC000819062678	CD	On-Demand	Anodyne	ADRB3	103	49
O[C@H](CNCCCOC[C@H]1CCCO1)c1cccnc1	ZINC000819062679	CD	On-Demand	Anodyne	ADRB2	33	47
O[C@H](CNCCCOC[C@H]1CCCO1)c1cccnc1	ZINC000819062679	CD	On-Demand	Anodyne	ADRB1	35	48
O[C@H](CNCCCOC[C@H]1CCCO1)c1cccnc1	ZINC000819062679	CD	On-Demand	Anodyne	ADRB3	103	49
O[C@H](CNCCCOC[C@@H]1CCCO1)c1cccnc1	ZINC000819062681	CD	On-Demand	Anodyne	ADRB2	33	47
O[C@H](CNCCCOC[C@@H]1CCCO1)c1cccnc1	ZINC000819062681	CD	On-Demand	Anodyne	ADRB1	35	48
O[C@H](CNCCCOC[C@@H]1CCCO1)c1cccnc1	ZINC000819062681	CD	On-Demand	Anodyne	ADRB3	103	49
Cc1ccc(OC[C@@H](O)CNCC2CCN(S(=O)(=O)C(F)F)CC2)cc1	ZINC000819062711	GD	On-Demand	Anodyne	ADRB2	48	49
Cc1ccc(OC[C@@H](O)CNCC2CCN(S(=O)(=O)C(F)F)CC2)cc1	ZINC000819062711	GD	On-Demand	Anodyne	ADRB1	67	52
Cc1ccc(OC[C@@H](O)CNCC2CCN(S(=O)(=O)C(F)F)CC2)cc1	ZINC000819062711	GD	On-Demand	Anodyne	ADRB3	51	52
Cc1ccc(OC[C@H](O)CNCC2CCN(S(=O)(=O)C(F)F)CC2)cc1	ZINC000819062712	GD	On-Demand	Anodyne	ADRB2	48	49
Cc1ccc(OC[C@H](O)CNCC2CCN(S(=O)(=O)C(F)F)CC2)cc1	ZINC000819062712	GD	On-Demand	Anodyne	ADRB1	67	52
Cc1ccc(OC[C@H](O)CNCC2CCN(S(=O)(=O)C(F)F)CC2)cc1	ZINC000819062712	GD	On-Demand	Anodyne	ADRB3	51	52
Cc1ccc(OC[C@@H](O)CNCCCSc2nccs2)cc1	ZINC000819062720	EF	On-Demand	Clean	ADRB2	45	46
Cc1ccc(OC[C@@H](O)CNCCCSc2nccs2)cc1	ZINC000819062720	EF	On-Demand	Clean	ADRB1	64	43
Cc1ccc(OC[C@@H](O)CNCCCSc2nccs2)cc1	ZINC000819062720	EF	On-Demand	Clean	ADRB3	40	43
Cc1ccc(OC[C@H](O)CNCCCSc2nccs2)cc1	ZINC000819062721	EF	On-Demand	Clean	ADRB2	45	46
Cc1ccc(OC[C@H](O)CNCCCSc2nccs2)cc1	ZINC000819062721	EF	On-Demand	Clean	ADRB1	64	43
Cc1ccc(OC[C@H](O)CNCCCSc2nccs2)cc1	ZINC000819062721	EF	On-Demand	Clean	ADRB3	40	43
O[C@H](CNCCCSc1nccs1)COc1ccccc1Cl	ZINC000819062731	FG	On-Demand	Clean	ADRB2	22	49
O[C@H](CNCCCSc1nccs1)COc1ccccc1Cl	ZINC000819062731	FG	On-Demand	Clean	ADRB1	44	34
O[C@@H](CNCCCSc1nccs1)COc1ccccc1Cl	ZINC000819062733	FG	On-Demand	Clean	ADRB2	22	49
O[C@@H](CNCCCSc1nccs1)COc1ccccc1Cl	ZINC000819062733	FG	On-Demand	Clean	ADRB1	44	34
COC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062747	GD	On-Demand	Anodyne	ADRB2	41	46
COC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062747	GD	On-Demand	Anodyne	ADRB1	59	45
COC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062747	GD	On-Demand	Anodyne	ADRB3	45	52
COC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062747	GD	On-Demand	Anodyne	MMP13	15	40
COC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062747	GD	On-Demand	Anodyne	GPR119	39	42
COC(=O)c1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062748	GD	On-Demand	Anodyne	ADRB2	41	46
COC(=O)c1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062748	GD	On-Demand	Anodyne	ADRB1	59	45
COC(=O)c1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062748	GD	On-Demand	Anodyne	ADRB3	45	52
COC(=O)c1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062748	GD	On-Demand	Anodyne	MMP13	15	40
COC(=O)c1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819062748	GD	On-Demand	Anodyne	GPR119	39	42
COc1cccc(OC)c1OC[C@@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819062763	GE	On-Demand	Anodyne	ADRB2	39	51
COc1cccc(OC)c1OC[C@@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819062763	GE	On-Demand	Anodyne	ADRB1	36	51
COc1cccc(OC)c1OC[C@@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819062763	GE	On-Demand	Anodyne	ADRB3	32	47
COc1cccc(OC)c1OC[C@@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819062763	GE	On-Demand	Anodyne	ABCB1	15	41
COc1cccc(OC)c1OC[C@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819062766	GE	On-Demand	Anodyne	ADRB2	39	51
COc1cccc(OC)c1OC[C@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819062766	GE	On-Demand	Anodyne	ADRB1	36	51
COc1cccc(OC)c1OC[C@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819062766	GE	On-Demand	Anodyne	ADRB3	32	47
COc1cccc(OC)c1OC[C@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819062766	GE	On-Demand	Anodyne	ABCB1	15	41
Cc1cc(F)ccc1[C@@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819062794	EF	On-Demand	Anodyne	GPR119	43	46
O=C(NCCc1cnc(SC2CCCC2)nc1)c1cc(=O)c2ccccc2o1	ZINC000819062855	GH	On-Demand	Anodyne	BCHE	34	45
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC([C@@H]4NC(=O)C4(C)C)CC3)c2c1	ZINC000819062860	IJ	On-Demand	Anodyne	PRS	41	35
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC([C@@H]4NC(=O)C4(C)C)CC3)c2c1	ZINC000819062860	IJ	On-Demand	Anodyne	MT-CO2	50	39
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC([C@H]4NC(=O)C4(C)C)CC3)c2c1	ZINC000819062861	IJ	On-Demand	Anodyne	PRS	41	35
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC([C@H]4NC(=O)C4(C)C)CC3)c2c1	ZINC000819062861	IJ	On-Demand	Anodyne	MT-CO2	50	39
C[C@H](C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819062868	GH	On-Demand	Anodyne	EPHX2	21	46
C[C@H](C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819062869	GH	On-Demand	Anodyne	EPHX2	21	46
C[C@@H](C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819062870	GH	On-Demand	Anodyne	EPHX2	21	46
C[C@@H](C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819062871	GH	On-Demand	Anodyne	EPHX2	21	46
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819062879	HG	On-Demand	Anodyne	REN	52	40
O=Cc1ccc(OCC(=O)NCCc2cnc(SC3CCCC3)nc2)cc1	ZINC000819062893	GG	On-Demand	Anodyne	VCP	42	41
CC(=O)N1CCc2cc(S(=O)(=O)N[C@H]3CCOC3=O)ccc21	ZINC000819062900	DC	On-Demand	Anodyne	LUXR	62	35
CC(=O)N1CCc2cc(S(=O)(=O)N[C@H]3CCOC3=O)ccc21	ZINC000819062900	DC	On-Demand	Anodyne	TRAR	72	32
CC(=O)N1CCc2cc(S(=O)(=O)N[C@H]3CCOC3=O)ccc21	ZINC000819062900	DC	On-Demand	Anodyne	LASR	42	32
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccc2ccccc2c1	ZINC000819062992	GF	On-Demand	Anodyne	ADRB2	32	47
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccc2ccccc2c1	ZINC000819062992	GF	On-Demand	Anodyne	ADRB1	38	46
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccc2ccccc2c1	ZINC000819062992	GF	On-Demand	Anodyne	ADRB3	28	43
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccc2ccccc2c1	ZINC000819062992	GF	On-Demand	Anodyne	ACOX1	40	34
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccc2ccccc2c1	ZINC000819062993	GF	On-Demand	Anodyne	ADRB2	32	47
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccc2ccccc2c1	ZINC000819062993	GF	On-Demand	Anodyne	ADRB1	38	46
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccc2ccccc2c1	ZINC000819062993	GF	On-Demand	Anodyne	ADRB3	28	43
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccc2ccccc2c1	ZINC000819062993	GF	On-Demand	Anodyne	ACOX1	40	34
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccc2ccccc2c1	ZINC000819062994	GF	On-Demand	Anodyne	ADRB2	32	47
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccc2ccccc2c1	ZINC000819062994	GF	On-Demand	Anodyne	ADRB1	38	46
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccc2ccccc2c1	ZINC000819062994	GF	On-Demand	Anodyne	ADRB3	28	43
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)COc1ccc2ccccc2c1	ZINC000819062994	GF	On-Demand	Anodyne	ACOX1	40	34
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccc2ccccc2c1	ZINC000819062995	GF	On-Demand	Anodyne	ADRB2	32	47
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccc2ccccc2c1	ZINC000819062995	GF	On-Demand	Anodyne	ADRB1	38	46
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccc2ccccc2c1	ZINC000819062995	GF	On-Demand	Anodyne	ADRB3	28	43
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)COc1ccc2ccccc2c1	ZINC000819062995	GF	On-Demand	Anodyne	ACOX1	40	34
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819063030	GD	On-Demand	Anodyne	ADRB2	28	46
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819063030	GD	On-Demand	Anodyne	ADRB1	40	43
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819063030	GD	On-Demand	Anodyne	ADRB3	33	46
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819063030	GD	On-Demand	Anodyne	ACOX1	47	32
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819063030	GD	On-Demand	Anodyne	CCR3	16	49
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819063030	GD	On-Demand	Anodyne	ABCB1	26	48
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819063031	GD	On-Demand	Anodyne	ADRB2	28	46
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819063031	GD	On-Demand	Anodyne	ADRB1	40	43
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819063031	GD	On-Demand	Anodyne	ADRB3	33	46
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819063031	GD	On-Demand	Anodyne	ACOX1	47	32
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819063031	GD	On-Demand	Anodyne	CCR3	16	49
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819063031	GD	On-Demand	Anodyne	ABCB1	26	48
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819063032	GD	On-Demand	Anodyne	ADRB2	28	46
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819063032	GD	On-Demand	Anodyne	ADRB1	40	43
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819063032	GD	On-Demand	Anodyne	ADRB3	33	46
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819063032	GD	On-Demand	Anodyne	ACOX1	47	32
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819063032	GD	On-Demand	Anodyne	CCR3	16	49
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819063032	GD	On-Demand	Anodyne	ABCB1	26	48
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819063033	GD	On-Demand	Anodyne	ADRB2	28	46
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819063033	GD	On-Demand	Anodyne	ADRB1	40	43
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819063033	GD	On-Demand	Anodyne	ADRB3	33	46
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819063033	GD	On-Demand	Anodyne	ACOX1	47	32
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819063033	GD	On-Demand	Anodyne	CCR3	16	49
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819063033	GD	On-Demand	Anodyne	ABCB1	26	48
O[C@@H](CNC1CCN(C[C@@H]2CCCO2)CC1)Cc1ccccc1C(F)(F)F	ZINC000819063069	GF	On-Demand	Anodyne	SFRP1	49	33
O[C@@H](CNC1CCN(C[C@H]2CCCO2)CC1)Cc1ccccc1C(F)(F)F	ZINC000819063070	GF	On-Demand	Anodyne	SFRP1	49	33
O[C@H](CNC1CCN(C[C@@H]2CCCO2)CC1)Cc1ccccc1C(F)(F)F	ZINC000819063071	GF	On-Demand	Anodyne	SFRP1	49	33
O[C@H](CNC1CCN(C[C@H]2CCCO2)CC1)Cc1ccccc1C(F)(F)F	ZINC000819063072	GF	On-Demand	Anodyne	SFRP1	49	33
CCCc1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819063077	CD	On-Demand	Anodyne	LUXR	80	46
CCCc1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819063077	CD	On-Demand	Anodyne	TRAR	88	46
CCCc1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819063077	CD	On-Demand	Anodyne	LASR	64	46
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(C2CCCCC2)cc1	ZINC000819063079	DE	On-Demand	Anodyne	LUXR	63	35
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(C2CCCCC2)cc1	ZINC000819063079	DE	On-Demand	Anodyne	TRAR	75	35
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(C2CCCCC2)cc1	ZINC000819063079	DE	On-Demand	Anodyne	LASR	42	33
O=C(NCCc1cnc(SC2CCCC2)nc1)c1cc(=O)c2ccc(F)cc2o1	ZINC000819063080	HH	On-Demand	Anodyne	KCNH2	15	47
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc2c(c1)CCC2	ZINC000819063081	CC	On-Demand	Anodyne	LUXR	63	34
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc2c(c1)CCC2	ZINC000819063081	CC	On-Demand	Anodyne	TRAR	73	33
O=C(NCCc1cnc(SC2CCCC2)nc1)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819063092	IG	On-Demand	Anodyne	VCP	41	34
O=C(NCCc1cnc(SC2CCCC2)nc1)c1cnc(Cl)c2ccccc12	ZINC000819063101	HJ	On-Demand	Anodyne	CTSK	24	44
CC(C)(C)OC(=O)N1CC(CC(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819063108	GE	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CC(CC(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819063109	GE	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819063138	GE	On-Demand	Anodyne	GPR119	21	42
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819063138	GE	On-Demand	Anodyne	SFRP1	16	44
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819063139	GE	On-Demand	Anodyne	GPR119	21	42
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819063139	GE	On-Demand	Anodyne	SFRP1	16	44
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819063143	IH	On-Demand	Anodyne	F2	17	43
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819063143	IH	On-Demand	Anodyne	FKBP1A	45	39
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819063143	IH	On-Demand	Anodyne	PREP	29	45
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819063143	IH	On-Demand	Anodyne	LGMN	45	33
CCC(=O)Nc1ccccc1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819063158	GH	On-Demand	Anodyne	CTSK	23	41
CC(=O)Nc1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819063173	CC	On-Demand	Anodyne	CA12	15	42
CC(=O)Nc1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819063173	CC	On-Demand	Anodyne	IDO1	36	44
CC(=O)Nc1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819063173	CC	On-Demand	Anodyne	LUXR	71	38
CC(=O)Nc1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819063173	CC	On-Demand	Anodyne	TRAR	84	38
CC(=O)Nc1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819063173	CC	On-Demand	Anodyne	LASR	59	36
CC(=O)Nc1cccc(CC(=O)NNC(=O)CC(C)C)c1	ZINC000819063191	CD	On-Demand	Reactive	MTNR1B	18	43
CC(=O)Nc1cccc(CC(=O)NNC(=O)CC(C)C)c1	ZINC000819063191	CD	On-Demand	Reactive	KCNK3	51	34
CC(=O)Nc1cccc(CC(=O)NNC(=O)CC(C)C)c1	ZINC000819063191	CD	On-Demand	Reactive	KCNK9	43	34
CN1CCN(C(C)(C)CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819063233	ED	On-Demand	Anodyne	ADRB1	31	45
CN1CCN(C(C)(C)CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819063233	ED	On-Demand	Anodyne	ADRB3	47	45
CN1CCN(C(C)(C)CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819063233	ED	On-Demand	Anodyne	IGF1R	26	40
CN1CCN(C(C)(C)CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819063233	ED	On-Demand	Anodyne	CYP3A4	42	37
CN1CCN(C(C)(C)CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819063234	ED	On-Demand	Anodyne	ADRB1	31	45
CN1CCN(C(C)(C)CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819063234	ED	On-Demand	Anodyne	ADRB3	47	45
CN1CCN(C(C)(C)CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819063234	ED	On-Demand	Anodyne	IGF1R	26	40
CN1CCN(C(C)(C)CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819063234	ED	On-Demand	Anodyne	CYP3A4	42	37
COc1ccccc1COC[C@@H](O)CNC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819063247	GD	On-Demand	Anodyne	ADRB2	18	44
COc1ccccc1COC[C@@H](O)CNC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819063247	GD	On-Demand	Anodyne	ADRB1	15	44
COc1ccccc1COC[C@H](O)CNC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819063248	GD	On-Demand	Anodyne	ADRB2	18	44
COc1ccccc1COC[C@H](O)CNC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819063248	GD	On-Demand	Anodyne	ADRB1	15	44
COc1ccccc1COC[C@@H](O)CNC1CCN(C[C@H]2CCCO2)CC1	ZINC000819063249	GD	On-Demand	Anodyne	ADRB2	18	44
COc1ccccc1COC[C@@H](O)CNC1CCN(C[C@H]2CCCO2)CC1	ZINC000819063249	GD	On-Demand	Anodyne	ADRB1	15	44
COc1ccccc1COC[C@H](O)CNC1CCN(C[C@H]2CCCO2)CC1	ZINC000819063250	GD	On-Demand	Anodyne	ADRB2	18	44
COc1ccccc1COC[C@H](O)CNC1CCN(C[C@H]2CCCO2)CC1	ZINC000819063250	GD	On-Demand	Anodyne	ADRB1	15	44
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1CCN(C[C@H]2CCCO2)CC1	ZINC000819063280	GD	On-Demand	Bother	ADRB2	27	48
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1CCN(C[C@H]2CCCO2)CC1	ZINC000819063280	GD	On-Demand	Bother	ADRB1	22	48
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1CCN(C[C@H]2CCCO2)CC1	ZINC000819063280	GD	On-Demand	Bother	ABCB1	17	41
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1CCN(C[C@H]2CCCO2)CC1	ZINC000819063281	GD	On-Demand	Bother	ADRB2	27	48
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1CCN(C[C@H]2CCCO2)CC1	ZINC000819063281	GD	On-Demand	Bother	ADRB1	22	48
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1CCN(C[C@H]2CCCO2)CC1	ZINC000819063281	GD	On-Demand	Bother	ABCB1	17	41
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819063282	GD	On-Demand	Bother	ADRB2	27	48
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819063282	GD	On-Demand	Bother	ADRB1	22	48
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819063282	GD	On-Demand	Bother	ABCB1	17	41
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819063283	GD	On-Demand	Bother	ADRB2	27	48
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819063283	GD	On-Demand	Bother	ADRB1	22	48
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819063283	GD	On-Demand	Bother	ABCB1	17	41
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819063284	GD	On-Demand	Bother	ADRB2	21	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819063284	GD	On-Demand	Bother	ADRB1	23	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819063284	GD	On-Demand	Bother	ADRB3	22	40
O=[N+]([O-])c1cccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819063285	GD	On-Demand	Bother	ADRB2	21	40
O=[N+]([O-])c1cccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819063285	GD	On-Demand	Bother	ADRB1	23	40
O=[N+]([O-])c1cccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819063285	GD	On-Demand	Bother	ADRB3	22	40
O=[N+]([O-])c1cccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819063286	GD	On-Demand	Bother	ADRB2	21	40
O=[N+]([O-])c1cccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819063286	GD	On-Demand	Bother	ADRB1	23	40
O=[N+]([O-])c1cccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819063286	GD	On-Demand	Bother	ADRB3	22	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819063287	GD	On-Demand	Bother	ADRB2	21	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819063287	GD	On-Demand	Bother	ADRB1	23	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819063287	GD	On-Demand	Bother	ADRB3	22	40
CCOc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819063289	GE	On-Demand	Anodyne	ADRB2	34	46
CCOc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819063289	GE	On-Demand	Anodyne	ADRB1	42	49
CCOc1ccc(OC[C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819063289	GE	On-Demand	Anodyne	ADRB3	30	46
CCOc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819063290	GE	On-Demand	Anodyne	ADRB2	34	46
CCOc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819063290	GE	On-Demand	Anodyne	ADRB1	42	49
CCOc1ccc(OC[C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819063290	GE	On-Demand	Anodyne	ADRB3	30	46
CCOc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819063291	GE	On-Demand	Anodyne	ADRB2	34	46
CCOc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819063291	GE	On-Demand	Anodyne	ADRB1	42	49
CCOc1ccc(OC[C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819063291	GE	On-Demand	Anodyne	ADRB3	30	46
CCOc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819063292	GE	On-Demand	Anodyne	ADRB2	34	46
CCOc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819063292	GE	On-Demand	Anodyne	ADRB1	42	49
CCOc1ccc(OC[C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819063292	GE	On-Demand	Anodyne	ADRB3	30	46
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819063310	GD	On-Demand	Anodyne	ADRB3	18	41
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819063311	GD	On-Demand	Anodyne	ADRB3	18	41
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(C[C@H]3CCCO3)CC2)cc1	ZINC000819063312	GD	On-Demand	Anodyne	ADRB3	18	41
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(C[C@@H]3CCCO3)CC2)cc1	ZINC000819063313	GD	On-Demand	Anodyne	ADRB3	18	41
CC(C)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819063325	FI	On-Demand	Mild	PAPA1_CARPA	57	50
CC(C)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819063325	FI	On-Demand	Mild	CCKAR	38	45
CC(C)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819063325	FI	On-Demand	Mild	CTSK	28	46
CC(C)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819063325	FI	On-Demand	Mild	CTSL	19	50
CC(C)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819063325	FI	On-Demand	Mild	REN	40	40
CC(C)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819063325	FI	On-Demand	Mild	CTSS	16	50
CC(C)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819063325	FI	On-Demand	Mild	FPR1	51	43
Cc1c(F)cccc1NC(=O)CCNC1CCN(C(=O)OC(C)C)CC1	ZINC000819063337	FG	On-Demand	Anodyne	GPR119	41	43
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819063340	GD	On-Demand	Anodyne	ADRB2	15	45
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819063340	GD	On-Demand	Anodyne	ADRB1	16	41
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819063340	GD	On-Demand	Anodyne	ADRB3	27	45
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819063341	GD	On-Demand	Anodyne	ADRB2	15	45
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819063341	GD	On-Demand	Anodyne	ADRB1	16	41
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819063341	GD	On-Demand	Anodyne	ADRB3	27	45
O[C@H](CNCCCSc1nccs1)c1ccccc1	ZINC000819063342	CF	On-Demand	Clean	ADRB3	40	40
O[C@@H](CNCCCSc1nccs1)c1ccccc1	ZINC000819063343	CF	On-Demand	Clean	ADRB3	40	40
O[C@H](CNCCCSc1nccs1)c1cccnc1	ZINC000819063344	CE	On-Demand	Clean	ADRB2	23	45
O[C@H](CNCCCSc1nccs1)c1cccnc1	ZINC000819063344	CE	On-Demand	Clean	ADRB1	25	45
O[C@H](CNCCCSc1nccs1)c1cccnc1	ZINC000819063344	CE	On-Demand	Clean	ADRB3	95	46
O[C@@H](CNCCCSc1nccs1)c1cccnc1	ZINC000819063345	CE	On-Demand	Clean	ADRB2	23	45
O[C@@H](CNCCCSc1nccs1)c1cccnc1	ZINC000819063345	CE	On-Demand	Clean	ADRB1	25	45
O[C@@H](CNCCCSc1nccs1)c1cccnc1	ZINC000819063345	CE	On-Demand	Clean	ADRB3	95	46
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819063379	FD	On-Demand	Anodyne	ADRB2	15	43
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819063379	FD	On-Demand	Anodyne	ADRB1	29	40
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819063379	FD	On-Demand	Anodyne	ADRB3	45	43
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819063382	FD	On-Demand	Anodyne	ADRB2	15	43
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819063382	FD	On-Demand	Anodyne	ADRB1	29	40
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819063382	FD	On-Demand	Anodyne	ADRB3	45	43
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(Br)cc1Cl	ZINC000819063390	FD	On-Demand	Anodyne	LUXR	62	40
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(Br)cc1Cl	ZINC000819063390	FD	On-Demand	Anodyne	TRAR	77	43
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(Br)cc1Cl	ZINC000819063390	FD	On-Demand	Anodyne	LASR	24	40
O=C1OCC[C@@H]1NS(=O)(=O)c1c(Cl)cc(Br)cc1Cl	ZINC000819063405	GE	On-Demand	Anodyne	LUXR	58	37
O=C1OCC[C@@H]1NS(=O)(=O)c1c(Cl)cc(Br)cc1Cl	ZINC000819063405	GE	On-Demand	Anodyne	TRAR	70	40
O=C1OCC[C@@H]1NS(=O)(=O)c1c(Cl)cc(Br)cc1Cl	ZINC000819063405	GE	On-Demand	Anodyne	LASR	42	37
CN1CCN(C(C)(C)CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819063437	GD	On-Demand	Anodyne	GPR119	24	40
CN1CCN(C(C)(C)CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819063441	GD	On-Demand	Anodyne	GPR119	24	40
CCOc1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1OCC	ZINC000819063456	ED	On-Demand	Anodyne	LUXR	64	34
CCOc1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1OCC	ZINC000819063456	ED	On-Demand	Anodyne	TRAR	78	35
CCOc1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1OCC	ZINC000819063456	ED	On-Demand	Anodyne	LASR	54	33
O=C(CCNCC1CCN(S(=O)(=O)C(F)F)CC1)Nc1cccc(F)c1	ZINC000819063465	GE	On-Demand	Anodyne	CCR3	49	39
O=C(CCNCC1CCN(S(=O)(=O)C(F)F)CC1)Nc1cccc(F)c1	ZINC000819063465	GE	On-Demand	Anodyne	ST14	40	36
Cn1cc(C#N)cc1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819063513	CD	On-Demand	Mild	SCN10A	16	41
Cn1cc(C#N)cc1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819063513	CD	On-Demand	Mild	PTGDR	16	44
Cn1cc(C#N)cc1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819063513	CD	On-Demand	Mild	KCNK3	71	33
Cn1cc(C#N)cc1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819063513	CD	On-Demand	Mild	KCNK9	47	33
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	ACE	65	47
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	MME	146	47
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	ANPEP	73	41
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	CTRA_BOVIN	15	41
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	CTSB	65	40
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	PAPA1_CARPA	67	47
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	CYSP_TRYCR	57	34
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	CTSF	43	34
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	CTSK	16	45
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	CTSL	53	47
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	CPA1	54	43
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	ITGA4	57	34
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	NAALAD2	31	45
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	CAPNS1	42	35
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	ECE1	45	39
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	CTSS	33	47
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	CAPN1	61	47
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	ACE2	108	43
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	CTSV	62	42
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	PIN1	43	33
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	FPR1	79	41
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	CTRB_BOVIN	64	41
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	BLA1_STEMA	83	42
Cn1cc(C#N)cc1C(=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819063590	CD	On-Demand	Mild	BRCA1	55	33
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	ACE	65	47
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	MME	146	47
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	ANPEP	73	41
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	CTRA_BOVIN	15	41
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	CTSB	65	40
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	PAPA1_CARPA	67	47
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	CYSP_TRYCR	57	34
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	CTSF	43	34
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	CTSK	16	45
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	CTSL	53	47
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	CPA1	54	43
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	ITGA4	57	34
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	NAALAD2	31	45
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	CAPNS1	42	35
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	ECE1	45	39
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	CTSS	33	47
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	CAPN1	61	47
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	ACE2	108	43
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	CTSV	62	42
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	PIN1	43	33
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	FPR1	79	41
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	CTRB_BOVIN	64	41
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	BLA1_STEMA	83	42
Cn1cc(C#N)cc1C(=O)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819063591	CD	On-Demand	Mild	BRCA1	55	33
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819063619	GE	On-Demand	Anodyne	ADRB2	32	46
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819063619	GE	On-Demand	Anodyne	ADRB1	44	44
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819063619	GE	On-Demand	Anodyne	ADRB3	38	46
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819063619	GE	On-Demand	Anodyne	ACOX1	49	33
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819063619	GE	On-Demand	Anodyne	ABCB1	25	47
CC(=O)c1cccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819063619	GE	On-Demand	Anodyne	PDS	44	35
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819063620	GE	On-Demand	Anodyne	ADRB2	32	46
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819063620	GE	On-Demand	Anodyne	ADRB1	44	44
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819063620	GE	On-Demand	Anodyne	ADRB3	38	46
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819063620	GE	On-Demand	Anodyne	ACOX1	49	33
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819063620	GE	On-Demand	Anodyne	ABCB1	25	47
CC(=O)c1cccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819063620	GE	On-Demand	Anodyne	PDS	44	35
O[C@H](CNCCCSc1nccs1)COc1ccccc1F	ZINC000819063630	EF	On-Demand	Clean	ADRB2	20	40
O[C@H](CNCCCSc1nccs1)COc1ccccc1F	ZINC000819063630	EF	On-Demand	Clean	ADRB1	50	39
O[C@@H](CNCCCSc1nccs1)COc1ccccc1F	ZINC000819063631	EF	On-Demand	Clean	ADRB2	20	40
O[C@@H](CNCCCSc1nccs1)COc1ccccc1F	ZINC000819063631	EF	On-Demand	Clean	ADRB1	50	39
COc1ccc(OC)c([C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819063635	FE	On-Demand	Anodyne	GPR119	37	41
C=C(C)C(C)(C)C(=O)N(CC)CC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000819063650	FF	On-Demand	Mild	MTOR	47	36
C=C(C)C(C)(C)C(=O)N(CC)CC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000819063650	FF	On-Demand	Mild	STAT6	55	34
O=C(CCNCC1CCN(S(=O)(=O)C(F)F)CC1)Nc1ccccc1	ZINC000819063653	GD	On-Demand	Anodyne	CCR3	23	41
O=C(CCNCC1CCN(S(=O)(=O)C(F)F)CC1)Nc1ccccc1	ZINC000819063653	GD	On-Demand	Anodyne	F13A1	59	38
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)CCc2ccccc2)CC1	ZINC000819063672	GD	On-Demand	Anodyne	ADRB1	17	43
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)CCc2ccccc2)CC1	ZINC000819063672	GD	On-Demand	Anodyne	ADRB3	21	43
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)CCc2ccccc2)CC1	ZINC000819063672	GD	On-Demand	Anodyne	SIGMAR1	15	42
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)CCc2ccccc2)CC1	ZINC000819063673	GD	On-Demand	Anodyne	ADRB1	17	43
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)CCc2ccccc2)CC1	ZINC000819063673	GD	On-Demand	Anodyne	ADRB3	21	43
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)CCc2ccccc2)CC1	ZINC000819063673	GD	On-Demand	Anodyne	SIGMAR1	15	42
COc1ccccc1COC[C@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819063693	GE	On-Demand	Anodyne	ADRB2	19	46
COc1ccccc1COC[C@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819063693	GE	On-Demand	Anodyne	ADRB1	16	46
COc1ccccc1COC[C@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819063693	GE	On-Demand	Anodyne	ADRB3	21	41
COc1ccccc1COC[C@@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819063694	GE	On-Demand	Anodyne	ADRB2	19	46
COc1ccccc1COC[C@@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819063694	GE	On-Demand	Anodyne	ADRB1	16	46
COc1ccccc1COC[C@@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819063694	GE	On-Demand	Anodyne	ADRB3	21	41
Cn1cc(C#N)cc1C(=O)NCCC(=O)O	ZINC000819063742	BC	On-Demand	Mild	HRAS	49	33
N#CCOc1cccc(CC(=O)NCCc2cnc(SC3CCCC3)nc2)c1	ZINC000819063753	GG	On-Demand	Mild	CTSL	15	45
CC(=O)N1CCCc2cc(S(=O)(=O)N[C@H]3CCOC3=O)ccc21	ZINC000819063783	EC	On-Demand	Anodyne	LUXR	61	34
CC(=O)N1CCCc2cc(S(=O)(=O)N[C@H]3CCOC3=O)ccc21	ZINC000819063783	EC	On-Demand	Anodyne	TRAR	71	32
CC(C)(C)OC(=O)N[C@@H](C(=O)NCCc1cnc(SC2CCCC2)nc1)C(F)(F)F	ZINC000819063797	IH	On-Demand	Anodyne	REN	46	38
Cn1cc(C#N)cc1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819063813	CD	On-Demand	Mild	UL54	52	37
Cn1cc(Br)cc1C(=O)NNC(=O)NCCCCCC(=O)O	ZINC000819063816	GD	On-Demand	Reactive	FOLH1	42	35
N#CCSc1ccccc1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819063819	GI	On-Demand	Mild	CTSK	26	46
N#CCSc1ccccc1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819063819	GI	On-Demand	Mild	CTSL	15	40
Cn1cc(-c2nc3ccccn3c2NC(=O)Nc2cccc(CC(=O)O)c2)cn1	ZINC000819063834	GG	On-Demand	Anodyne	CCKBR	21	44
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(O)c([N+](=O)[O-])c1	ZINC000819063848	DB	On-Demand	Bother	LUXR	67	43
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(O)c([N+](=O)[O-])c1	ZINC000819063848	DB	On-Demand	Bother	TRAR	76	42
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(O)c([N+](=O)[O-])c1	ZINC000819063848	DB	On-Demand	Bother	LASR	25	42
O=C1OCC[C@@H]1NS(=O)(=O)c1ccccc1Br	ZINC000819063868	DD	On-Demand	Anodyne	LUXR	66	38
O=C1OCC[C@@H]1NS(=O)(=O)c1ccccc1Br	ZINC000819063868	DD	On-Demand	Anodyne	TRAR	79	41
O=C1OCC[C@@H]1NS(=O)(=O)c1ccccc1Br	ZINC000819063868	DD	On-Demand	Anodyne	LASR	44	38
C#Cc1ccc(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)cn1	ZINC000819063872	DD	On-Demand	Mild	L3MBTL3	65	41
C#Cc1ccc(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)cn1	ZINC000819063873	DD	On-Demand	Mild	L3MBTL3	65	41
Cn1cc(C#N)cc1C(=O)N1CCC[C@@H]1C(=O)O	ZINC000819063885	BC	On-Demand	Mild	ACE	49	40
Cn1cc(C#N)cc1C(=O)N1CCC[C@@H]1C(=O)O	ZINC000819063885	BC	On-Demand	Mild	PREP	39	40
Cn1cc(C#N)cc1C(=O)N1CCC[C@H]1C(=O)O	ZINC000819063886	BC	On-Demand	Mild	ACE	49	40
Cn1cc(C#N)cc1C(=O)N1CCC[C@H]1C(=O)O	ZINC000819063886	BC	On-Demand	Mild	PREP	39	40
Cn1cc(Br)cc(NC(=O)C(=O)NCCCCCC(=O)O)c1=O	ZINC000819063915	GC	On-Demand	Anodyne	ASAH1	42	32
Cn1cc(-c2nc(CN3CC[C@@H](C(=O)O)C3)cs2)cn1	ZINC000819063937	CD	On-Demand	Anodyne	SLC6A1	94	37
Cn1cc(-c2nc(CN3CC[C@H](C(=O)O)C3)cs2)cn1	ZINC000819063938	CD	On-Demand	Anodyne	SLC6A1	94	37
CCn1c(NNC(=O)[C@@H]2CCCO[C@@H]2C(C)C)nc2ccccc2c1=O	ZINC000819063960	FE	On-Demand	Reactive	CCKBR	15	43
O[C@H](CNCCCSc1nccs1)COc1cccc2[nH]ccc12	ZINC000819063974	FG	On-Demand	Clean	ADRB1	38	52
O[C@@H](CNCCCSc1nccs1)COc1cccc2[nH]ccc12	ZINC000819063975	FG	On-Demand	Clean	ADRB1	38	52
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063976	GE	On-Demand	Anodyne	ADRB2	36	44
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063976	GE	On-Demand	Anodyne	ADRB1	51	44
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063976	GE	On-Demand	Anodyne	ADRB3	39	50
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063976	GE	On-Demand	Anodyne	ABCB1	16	44
CC(=O)c1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063976	GE	On-Demand	Anodyne	GPR119	38	42
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063977	GE	On-Demand	Anodyne	ADRB2	36	44
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063977	GE	On-Demand	Anodyne	ADRB1	51	44
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063977	GE	On-Demand	Anodyne	ADRB3	39	50
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063977	GE	On-Demand	Anodyne	ABCB1	16	44
CC(=O)c1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063977	GE	On-Demand	Anodyne	GPR119	38	42
Cc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063996	FE	On-Demand	Anodyne	ADRB2	44	48
Cc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063996	FE	On-Demand	Anodyne	ADRB1	57	46
Cc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063996	FE	On-Demand	Anodyne	ADRB3	43	52
Cc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063996	FE	On-Demand	Anodyne	MMP13	18	45
Cc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063996	FE	On-Demand	Anodyne	ACOX1	50	33
Cc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063996	FE	On-Demand	Anodyne	GPR119	42	43
Cc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063997	FE	On-Demand	Anodyne	ADRB2	44	48
Cc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063997	FE	On-Demand	Anodyne	ADRB1	57	46
Cc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063997	FE	On-Demand	Anodyne	ADRB3	43	52
Cc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063997	FE	On-Demand	Anodyne	MMP13	18	45
Cc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063997	FE	On-Demand	Anodyne	ACOX1	50	33
Cc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819063997	FE	On-Demand	Anodyne	GPR119	42	43
CN(C)c1ncc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n1C	ZINC000819064019	GD	On-Demand	Anodyne	GPR119	45	42
CN(C)c1ncc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n1C	ZINC000819064020	GD	On-Demand	Anodyne	GPR119	45	42
CSc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819064036	GF	On-Demand	Anodyne	ADRB2	34	44
CSc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819064036	GF	On-Demand	Anodyne	ADRB1	50	44
CSc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819064036	GF	On-Demand	Anodyne	ADRB3	38	49
CSc1ccc(OC[C@@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819064036	GF	On-Demand	Anodyne	GPR119	43	43
CSc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819064037	GF	On-Demand	Anodyne	ADRB2	34	44
CSc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819064037	GF	On-Demand	Anodyne	ADRB1	50	44
CSc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819064037	GF	On-Demand	Anodyne	ADRB3	38	49
CSc1ccc(OC[C@H](O)CNC2CCN(C(=O)OC(C)C)CC2)cc1	ZINC000819064037	GF	On-Demand	Anodyne	GPR119	43	43
O[C@H](CNCCCSc1nccs1)COc1ccc(Cl)cc1	ZINC000819064044	FG	On-Demand	Clean	ADRB2	36	42
O[C@H](CNCCCSc1nccs1)COc1ccc(Cl)cc1	ZINC000819064044	FG	On-Demand	Clean	ADRB1	58	44
O[C@H](CNCCCSc1nccs1)COc1ccc(Cl)cc1	ZINC000819064044	FG	On-Demand	Clean	ADRB3	37	42
O[C@@H](CNCCCSc1nccs1)COc1ccc(Cl)cc1	ZINC000819064045	FG	On-Demand	Clean	ADRB2	36	42
O[C@@H](CNCCCSc1nccs1)COc1ccc(Cl)cc1	ZINC000819064045	FG	On-Demand	Clean	ADRB1	58	44
O[C@@H](CNCCCSc1nccs1)COc1ccc(Cl)cc1	ZINC000819064045	FG	On-Demand	Clean	ADRB3	37	42
O=C1OCC[C@@H]1NS(=O)(=O)c1cc(Br)ccc1Br	ZINC000819064091	GD	On-Demand	Anodyne	LUXR	64	41
O=C1OCC[C@@H]1NS(=O)(=O)c1cc(Br)ccc1Br	ZINC000819064091	GD	On-Demand	Anodyne	TRAR	78	45
O=C1OCC[C@@H]1NS(=O)(=O)c1cc(Br)ccc1Br	ZINC000819064091	GD	On-Demand	Anodyne	LASR	29	42
NC(=O)c1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819064093	CB	On-Demand	Anodyne	LUXR	71	39
NC(=O)c1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819064093	CB	On-Demand	Anodyne	TRAR	85	39
NC(=O)c1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819064093	CB	On-Demand	Anodyne	LASR	57	37
COc1cc(Br)c(S(=O)(=O)N[C@H]2CCOC2=O)cc1OC	ZINC000819064096	GD	On-Demand	Anodyne	LUXR	42	32
COc1cc(Br)c(S(=O)(=O)N[C@H]2CCOC2=O)cc1OC	ZINC000819064096	GD	On-Demand	Anodyne	TRAR	62	35
COc1cc(Br)c(S(=O)(=O)N[C@H]2CCOC2=O)cc1OC	ZINC000819064096	GD	On-Demand	Anodyne	LASR	41	32
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819064136	HH	On-Demand	Anodyne	F2	27	45
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819064136	HH	On-Demand	Anodyne	FKBP1A	36	41
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819064136	HH	On-Demand	Anodyne	PREP	39	45
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819064136	HH	On-Demand	Anodyne	LGMN	65	35
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819064137	HH	On-Demand	Anodyne	F2	27	45
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819064137	HH	On-Demand	Anodyne	FKBP1A	36	41
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819064137	HH	On-Demand	Anodyne	PREP	39	45
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819064137	HH	On-Demand	Anodyne	LGMN	65	35
CC(C)(C)OC(=O)NC[C@@H](C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)c1ccccc1	ZINC000819064138	IG	On-Demand	Anodyne	WNT3	40	30
CC(C)(C)OC(=O)NC[C@H](C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)c1ccccc1	ZINC000819064139	IG	On-Demand	Anodyne	WNT3	40	30
CC(C)(C)OC(=O)NC[C@H](C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)c1ccccc1	ZINC000819064140	IG	On-Demand	Anodyne	WNT3	40	30
CC(C)(C)OC(=O)NC[C@@H](C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)c1ccccc1	ZINC000819064141	IG	On-Demand	Anodyne	WNT3	40	30
O=C1OCC[C@@H]1NS(=O)(=O)c1cc(F)ccc1F	ZINC000819064142	CC	On-Demand	Anodyne	LUXR	70	44
O=C1OCC[C@@H]1NS(=O)(=O)c1cc(F)ccc1F	ZINC000819064142	CC	On-Demand	Anodyne	TRAR	81	38
O=C1OCC[C@@H]1NS(=O)(=O)c1cc(F)ccc1F	ZINC000819064142	CC	On-Demand	Anodyne	LASR	49	35
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819064147	GE	On-Demand	Anodyne	GPR119	16	40
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819064147	GE	On-Demand	Anodyne	SFRP1	20	42
C=C(C)C(C)(C)C(=O)NNc1nc2ccccc2c(=O)n1CC	ZINC000819064189	DE	On-Demand	Reactive	CCKBR	15	40
O[C@H](CNCCCSc1nccs1)COc1ccc(F)cc1	ZINC000819064200	EF	On-Demand	Clean	ADRB2	40	42
O[C@H](CNCCCSc1nccs1)COc1ccc(F)cc1	ZINC000819064200	EF	On-Demand	Clean	ADRB1	64	42
O[C@H](CNCCCSc1nccs1)COc1ccc(F)cc1	ZINC000819064200	EF	On-Demand	Clean	ADRB3	38	42
O[C@@H](CNCCCSc1nccs1)COc1ccc(F)cc1	ZINC000819064201	EF	On-Demand	Clean	ADRB2	40	42
O[C@@H](CNCCCSc1nccs1)COc1ccc(F)cc1	ZINC000819064201	EF	On-Demand	Clean	ADRB1	64	42
O[C@@H](CNCCCSc1nccs1)COc1ccc(F)cc1	ZINC000819064201	EF	On-Demand	Clean	ADRB3	38	42
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)COCc2ccccc2)CC1	ZINC000819064221	GD	On-Demand	Anodyne	ADRB1	18	48
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)COCc2ccccc2)CC1	ZINC000819064221	GD	On-Demand	Anodyne	ADRB3	21	48
Cc1ccccc1[C@@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819064247	DF	On-Demand	Anodyne	ADRB1	15	43
Cc1ccccc1[C@@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819064247	DF	On-Demand	Anodyne	CCR8	80	41
Cc1ccccc1[C@@H](O)CNC1CCN(C(=O)OC(C)C)CC1	ZINC000819064247	DF	On-Demand	Anodyne	GPR119	40	44
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819064284	GE	On-Demand	Anodyne	GPR119	16	40
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819064284	GE	On-Demand	Anodyne	SFRP1	20	42
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@H](F)Cc1ccccc1	ZINC000819064300	FH	On-Demand	Anodyne	MME	48	37
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@H](F)Cc1ccccc1	ZINC000819064300	FH	On-Demand	Anodyne	AMP1_PLAFQ	22	40
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@@H](F)Cc1ccccc1	ZINC000819064301	FH	On-Demand	Anodyne	MME	48	37
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@@H](F)Cc1ccccc1	ZINC000819064301	FH	On-Demand	Anodyne	AMP1_PLAFQ	22	40
COC(=O)N[C@@H](C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)C(C)C	ZINC000819064305	ED	On-Demand	Anodyne	CCR1	48	36
COC(=O)N[C@@H](C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)C(C)C	ZINC000819064306	ED	On-Demand	Anodyne	CCR1	48	36
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1F	ZINC000819064308	CD	On-Demand	Anodyne	LUXR	65	41
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1F	ZINC000819064308	CD	On-Demand	Anodyne	TRAR	75	40
CC(C)(C)OC(=O)NC1CCN(CC(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819064311	HD	On-Demand	Anodyne	EPHX2	17	40
CC(C)(C)OC(=O)NC1CCN(CC(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819064312	HD	On-Demand	Anodyne	EPHX2	17	40
O=C1OCC[C@@H]1NS(=O)(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000819064319	GE	On-Demand	Anodyne	LUXR	62	46
O=C1OCC[C@@H]1NS(=O)(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000819064319	GE	On-Demand	Anodyne	TRAR	78	46
O=C1OCC[C@@H]1NS(=O)(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000819064319	GE	On-Demand	Anodyne	LASR	40	30
CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819064332	IG	On-Demand	Anodyne	CACNA1B	21	46
CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819064333	IG	On-Demand	Anodyne	CACNA1B	21	46
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	ZINC000819064335	CC	On-Demand	Anodyne	LUXR	68	37
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	ZINC000819064335	CC	On-Demand	Anodyne	TRAR	80	37
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(F)cc1	ZINC000819064335	CC	On-Demand	Anodyne	LASR	48	35
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc2nc(O)oc2c1	ZINC000819064359	CC	On-Demand	Anodyne	LUXR	55	35
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc2nc(O)oc2c1	ZINC000819064359	CC	On-Demand	Anodyne	TRAR	61	32
O[C@@H](CNCCCSc1nccs1)COc1cccc2ccccc12	ZINC000819064395	FH	On-Demand	Clean	ADRB2	29	55
O[C@@H](CNCCCSc1nccs1)COc1cccc2ccccc12	ZINC000819064395	FH	On-Demand	Clean	ADRB1	53	33
O[C@@H](CNCCCSc1nccs1)COc1cccc2ccccc12	ZINC000819064395	FH	On-Demand	Clean	ADRB3	19	48
O[C@H](CNCCCSc1nccs1)COc1cccc2ccccc12	ZINC000819064396	FH	On-Demand	Clean	ADRB2	29	55
O[C@H](CNCCCSc1nccs1)COc1cccc2ccccc12	ZINC000819064396	FH	On-Demand	Clean	ADRB1	53	33
O[C@H](CNCCCSc1nccs1)COc1cccc2ccccc12	ZINC000819064396	FH	On-Demand	Clean	ADRB3	19	48
O[C@@H](CNCCCSc1nccs1)COc1ccc2ccccc2c1	ZINC000819064417	FH	On-Demand	Clean	ADRB2	40	48
O[C@@H](CNCCCSc1nccs1)COc1ccc2ccccc2c1	ZINC000819064417	FH	On-Demand	Clean	ADRB1	51	42
O[C@@H](CNCCCSc1nccs1)COc1ccc2ccccc2c1	ZINC000819064417	FH	On-Demand	Clean	ADRB3	37	42
O[C@H](CNCCCSc1nccs1)COc1ccc2ccccc2c1	ZINC000819064418	FH	On-Demand	Clean	ADRB2	40	48
O[C@H](CNCCCSc1nccs1)COc1ccc2ccccc2c1	ZINC000819064418	FH	On-Demand	Clean	ADRB1	51	42
O[C@H](CNCCCSc1nccs1)COc1ccc2ccccc2c1	ZINC000819064418	FH	On-Demand	Clean	ADRB3	37	42
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000819064425	GD	On-Demand	Anodyne	ADRB2	45	47
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000819064425	GD	On-Demand	Anodyne	ADRB1	70	53
O=S(=O)(C(F)F)N1CCC(CNC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000819064425	GD	On-Demand	Anodyne	ADRB3	53	53
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000819064426	GD	On-Demand	Anodyne	ADRB2	45	47
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000819064426	GD	On-Demand	Anodyne	ADRB1	70	53
O=S(=O)(C(F)F)N1CCC(CNC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000819064426	GD	On-Demand	Anodyne	ADRB3	53	53
CCn1c(NNC(=O)C[C@@H](C)n2cccn2)nc2ccccc2c1=O	ZINC000819064431	ED	On-Demand	Reactive	CCKBR	15	42
CCn1c(NNC(=O)C[C@H](C)n2cccn2)nc2ccccc2c1=O	ZINC000819064432	ED	On-Demand	Reactive	CCKBR	15	42
CN(C)c1ncc(CNC[C@@H](O)c2cccnc2)n1C	ZINC000819064437	CC	On-Demand	Anodyne	ADRB2	22	43
CN(C)c1ncc(CNC[C@@H](O)c2cccnc2)n1C	ZINC000819064437	CC	On-Demand	Anodyne	ADRB1	23	43
CN(C)c1ncc(CNC[C@@H](O)c2cccnc2)n1C	ZINC000819064437	CC	On-Demand	Anodyne	ADRB3	90	47
CN(C)c1ncc(CNC[C@H](O)c2cccnc2)n1C	ZINC000819064438	CC	On-Demand	Anodyne	ADRB2	22	43
CN(C)c1ncc(CNC[C@H](O)c2cccnc2)n1C	ZINC000819064438	CC	On-Demand	Anodyne	ADRB1	23	43
CN(C)c1ncc(CNC[C@H](O)c2cccnc2)n1C	ZINC000819064438	CC	On-Demand	Anodyne	ADRB3	90	47
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc2c(c1)CCCC2	ZINC000819064484	CD	On-Demand	Anodyne	LUXR	66	36
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc2c(c1)CCCC2	ZINC000819064484	CD	On-Demand	Anodyne	TRAR	74	36
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819064500	CB	On-Demand	Anodyne	LUXR	61	34
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819064500	CB	On-Demand	Anodyne	TRAR	70	32
O=C(/C=C/c1cccnc1)NCCc1cnc(SC2CCCC2)nc1	ZINC000819064505	FG	On-Demand	Anodyne	VCP	43	33
O=C(/C=C\c1cccnc1)NCCc1cnc(SC2CCCC2)nc1	ZINC000819064506	FG	On-Demand	Anodyne	VCP	43	33
O=C(NCCc1cnc(SC2CCCC2)nc1)c1cccc(Cl)c1O	ZINC000819064518	GH	On-Demand	Anodyne	CTSK	24	41
O=C(NCCc1cnc(SC2CCCC2)nc1)c1ccc(CN2CCCCC2=O)cc1	ZINC000819064524	IH	On-Demand	Anodyne	TYRO3	19	40
O=C1OCC[C@@H]1NS(=O)(=O)c1cccc(Cl)c1Cl	ZINC000819064528	DD	On-Demand	Anodyne	LUXR	65	37
O=C1OCC[C@@H]1NS(=O)(=O)c1cccc(Cl)c1Cl	ZINC000819064528	DD	On-Demand	Anodyne	TRAR	76	36
O=C1OCC[C@@H]1NS(=O)(=O)c1cccc(Cl)c1Cl	ZINC000819064528	DD	On-Demand	Anodyne	LASR	42	35
O=C1OCC[C@@H]1NS(=O)(=O)c1c(Cl)cccc1Cl	ZINC000819064533	DD	On-Demand	Anodyne	LUXR	68	38
O=C1OCC[C@@H]1NS(=O)(=O)c1c(Cl)cccc1Cl	ZINC000819064533	DD	On-Demand	Anodyne	TRAR	79	38
O=C1OCC[C@@H]1NS(=O)(=O)c1c(Cl)cccc1Cl	ZINC000819064533	DD	On-Demand	Anodyne	LASR	44	37
COC(=O)c1sccc1S(=O)(=O)N[C@H]1CCOC1=O	ZINC000819064537	DC	On-Demand	Anodyne	LUXR	65	35
COC(=O)c1sccc1S(=O)(=O)N[C@H]1CCOC1=O	ZINC000819064537	DC	On-Demand	Anodyne	TRAR	79	35
COC(=O)c1sccc1S(=O)(=O)N[C@H]1CCOC1=O	ZINC000819064537	DC	On-Demand	Anodyne	LASR	54	33
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(N2CCCC2=O)cc1	ZINC000819064538	DC	On-Demand	Anodyne	TRAR	55	32
COC(=O)c1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819064562	CC	On-Demand	Anodyne	LUXR	70	38
COC(=O)c1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819064562	CC	On-Demand	Anodyne	TRAR	86	38
COC(=O)c1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819064562	CC	On-Demand	Anodyne	LASR	58	37
COc1cccc(C(=O)NCCc2cnc(SC3CCCC3)nc2)n1	ZINC000819064565	FF	On-Demand	Anodyne	CTSK	27	41
COc1cccc(C(=O)NCCc2cnc(SC3CCCC3)nc2)n1	ZINC000819064565	FF	On-Demand	Anodyne	CTSL	20	44
N#CCOc1ccccc1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819064566	GG	On-Demand	Mild	CTSK	29	46
N#CCOc1ccccc1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819064566	GG	On-Demand	Mild	CTSL	22	42
N#CCOc1ccccc1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819064566	GG	On-Demand	Mild	HCN1	43	33
N#CCOc1ccccc1C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819064566	GG	On-Demand	Mild	HCN4	41	33
CCCCCCC(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819064569	EI	On-Demand	Anodyne	LASR	40	34
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@H](O)[C@H](O)c1nc2ccccc2s1	ZINC000819064571	IF	On-Demand	Anodyne	ST14	45	32
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@H](O)[C@H](O)c1nc2ccccc2s1	ZINC000819064571	IF	On-Demand	Anodyne	TMPRSS6	62	32
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@H](O)[C@@H](O)c1nc2ccccc2s1	ZINC000819064572	IF	On-Demand	Anodyne	ST14	45	32
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@H](O)[C@@H](O)c1nc2ccccc2s1	ZINC000819064572	IF	On-Demand	Anodyne	TMPRSS6	62	32
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@@H](O)[C@H](O)c1nc2ccccc2s1	ZINC000819064573	IF	On-Demand	Anodyne	ST14	45	32
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@@H](O)[C@H](O)c1nc2ccccc2s1	ZINC000819064573	IF	On-Demand	Anodyne	TMPRSS6	62	32
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@@H](O)[C@@H](O)c1nc2ccccc2s1	ZINC000819064574	IF	On-Demand	Anodyne	ST14	45	32
O=C(NCCc1cnc(SC2CCCC2)nc1)[C@@H](O)[C@@H](O)c1nc2ccccc2s1	ZINC000819064574	IF	On-Demand	Anodyne	TMPRSS6	62	32
CC[C@@H](C)c1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819064580	CD	On-Demand	Anodyne	LUXR	65	35
CC[C@@H](C)c1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819064580	CD	On-Demand	Anodyne	TRAR	78	35
CC[C@@H](C)c1ccc(S(=O)(=O)N[C@H]2CCOC2=O)cc1	ZINC000819064580	CD	On-Demand	Anodyne	LASR	57	35
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1C(F)(F)F	ZINC000819064581	ED	On-Demand	Anodyne	LUXR	51	47
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(Cl)cc1C(F)(F)F	ZINC000819064581	ED	On-Demand	Anodyne	TRAR	61	40
COc1ccccc1/C(C)=C/C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819064590	GI	On-Demand	Anodyne	KCNA3	43	39
COc1ccccc1/C(C)=C\C(=O)NCCc1cnc(SC2CCCC2)nc1	ZINC000819064591	GI	On-Demand	Anodyne	KCNA3	43	39
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000819064593	DC	On-Demand	Anodyne	PKM	36	40
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000819064593	DC	On-Demand	Anodyne	LUXR	64	40
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000819064593	DC	On-Demand	Anodyne	TRAR	73	33
O=C1OCC[C@@H]1NS(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000819064601	DD	On-Demand	Anodyne	LUXR	65	39
O=C1OCC[C@@H]1NS(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000819064601	DD	On-Demand	Anodyne	TRAR	76	38
O=C1OCC[C@@H]1NS(=O)(=O)c1cc(Cl)cc(Cl)c1	ZINC000819064601	DD	On-Demand	Anodyne	LASR	47	32
C=CC(=O)NCc1ccc(C(=O)NCCc2cnc(SC3CCCC3)nc2)cc1	ZINC000819064622	HG	On-Demand	Anodyne	TGM2	23	40
N#Cc1ccc(C(=O)NCCc2cnc(SC3CCCC3)nc2)nc1Cl	ZINC000819064629	GG	On-Demand	Mild	CTSK	25	42
N#Cc1ccc(C(=O)NCCc2cnc(SC3CCCC3)nc2)nc1Cl	ZINC000819064629	GG	On-Demand	Mild	CTSL	15	40
O=C1OCC[C@@H]1NS(=O)(=O)c1ccccc1F	ZINC000819064640	CC	On-Demand	Anodyne	LUXR	67	38
O=C1OCC[C@@H]1NS(=O)(=O)c1ccccc1F	ZINC000819064640	CC	On-Demand	Anodyne	TRAR	78	38
O=C1OCC[C@@H]1NS(=O)(=O)c1ccccc1F	ZINC000819064640	CC	On-Demand	Anodyne	LASR	43	38
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(F)c(F)c1F	ZINC000819064646	CC	On-Demand	Anodyne	LUXR	64	39
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(F)c(F)c1F	ZINC000819064646	CC	On-Demand	Anodyne	TRAR	77	36
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(F)c(F)c1F	ZINC000819064646	CC	On-Demand	Anodyne	LASR	43	33
O=C(Nc1ccc(-c2cc3ccccc3o2)cc1)C(F)(F)F	ZINC000819064647	DJ	On-Demand	Anodyne	KCNJ11	58	32
O=C(Nc1ccc(-c2cc3ccccc3o2)cc1)C(F)(F)F	ZINC000819064647	DJ	On-Demand	Anodyne	TNKS	29	40
O=C(Nc1ccc(-c2cc3ccccc3o2)cc1)C(F)(F)F	ZINC000819064647	DJ	On-Demand	Anodyne	HDAH	57	36
O=C1OCC[C@@H]1NS(=O)(=O)c1cccc(Br)c1	ZINC000819064649	DD	On-Demand	Anodyne	LUXR	67	49
O=C1OCC[C@@H]1NS(=O)(=O)c1cccc(Br)c1	ZINC000819064649	DD	On-Demand	Anodyne	TRAR	78	42
O=C(NCCc1cnc(SC2CCCC2)nc1)c1ccc(N2CCOCC2)nc1	ZINC000819064654	HF	On-Demand	Anodyne	HPGDS	31	49
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(OC(F)(F)F)cc1	ZINC000819064656	ED	On-Demand	Anodyne	LUXR	68	41
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(OC(F)(F)F)cc1	ZINC000819064656	ED	On-Demand	Anodyne	TRAR	88	57
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(OC(F)(F)F)cc1	ZINC000819064656	ED	On-Demand	Anodyne	LASR	42	33
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819064661	FC	On-Demand	Anodyne	LUXR	58	33
O=C1OCC[C@@H]1NS(=O)(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819064661	FC	On-Demand	Anodyne	TRAR	72	33
O=C1OCC[C@@H]1NS(=O)(=O)/C=C/c1ccc(Cl)cc1	ZINC000819064695	DD	On-Demand	Anodyne	LUXR	56	43
O=C1OCC[C@@H]1NS(=O)(=O)/C=C/c1ccc(Cl)cc1	ZINC000819064695	DD	On-Demand	Anodyne	TRAR	75	43
O=C1OCC[C@@H]1NS(=O)(=O)/C=C\c1ccc(Cl)cc1	ZINC000819064696	DD	On-Demand	Anodyne	LUXR	56	43
O=C1OCC[C@@H]1NS(=O)(=O)/C=C\c1ccc(Cl)cc1	ZINC000819064696	DD	On-Demand	Anodyne	TRAR	75	43
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819064697	IG	On-Demand	Anodyne	PREP	37	46
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819064697	IG	On-Demand	Anodyne	CFTR	52	33
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819064697	IG	On-Demand	Anodyne	GPR119	15	40
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819064697	IG	On-Demand	Anodyne	WNT3	53	37
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819064698	IG	On-Demand	Anodyne	PREP	37	46
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819064698	IG	On-Demand	Anodyne	CFTR	52	33
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819064698	IG	On-Demand	Anodyne	GPR119	15	40
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819064698	IG	On-Demand	Anodyne	WNT3	53	37
O=C1OCC[C@@H]1NS(=O)(=O)c1ccccc1Cl	ZINC000819064703	CC	On-Demand	Anodyne	LUXR	66	38
O=C1OCC[C@@H]1NS(=O)(=O)c1ccccc1Cl	ZINC000819064703	CC	On-Demand	Anodyne	TRAR	78	38
O=C1OCC[C@@H]1NS(=O)(=O)c1ccccc1Cl	ZINC000819064703	CC	On-Demand	Anodyne	LASR	43	38
C[C@H](CNC[C@H](O)c1ccccc1Cl)Oc1ccccc1	ZINC000819064724	DG	On-Demand	Anodyne	ADRB3	15	40
C[C@@H](CNC[C@H](O)c1ccccc1Cl)Oc1ccccc1	ZINC000819064725	DG	On-Demand	Anodyne	ADRB3	15	40
C[C@H](CNC[C@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1	ZINC000819064748	DH	On-Demand	Anodyne	ADRB2	22	42
C[C@H](CNC[C@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1	ZINC000819064748	DH	On-Demand	Anodyne	ADRB1	30	42
C[C@H](CNC[C@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1	ZINC000819064748	DH	On-Demand	Anodyne	ADRB3	40	41
C[C@@H](CNC[C@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1	ZINC000819064749	DH	On-Demand	Anodyne	ADRB2	22	42
C[C@@H](CNC[C@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1	ZINC000819064749	DH	On-Demand	Anodyne	ADRB1	30	42
C[C@@H](CNC[C@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1	ZINC000819064749	DH	On-Demand	Anodyne	ADRB3	40	41
C[C@H](CNC[C@@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1	ZINC000819064750	DH	On-Demand	Anodyne	ADRB2	22	42
C[C@H](CNC[C@@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1	ZINC000819064750	DH	On-Demand	Anodyne	ADRB1	30	42
C[C@H](CNC[C@@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1	ZINC000819064750	DH	On-Demand	Anodyne	ADRB3	40	41
C[C@@H](CNC[C@@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1	ZINC000819064751	DH	On-Demand	Anodyne	ADRB2	22	42
C[C@@H](CNC[C@@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1	ZINC000819064751	DH	On-Demand	Anodyne	ADRB1	30	42
C[C@@H](CNC[C@@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1	ZINC000819064751	DH	On-Demand	Anodyne	ADRB3	40	41
C[C@H](CNC[C@@H](O)c1ccc(Br)cc1)Oc1ccccc1	ZINC000819064762	FH	On-Demand	Anodyne	ADRB2	21	51
C[C@H](CNC[C@H](O)c1ccc(Br)cc1)Oc1ccccc1	ZINC000819064763	FH	On-Demand	Anodyne	ADRB2	21	51
C[C@@H](CNC[C@H](O)c1ccc(Br)cc1)Oc1ccccc1	ZINC000819064764	FH	On-Demand	Anodyne	ADRB2	21	51
C[C@@H](CNC[C@@H](O)c1ccc(Br)cc1)Oc1ccccc1	ZINC000819064765	FH	On-Demand	Anodyne	ADRB2	21	51
C[C@H](CNC[C@H](O)c1ccc(F)c(Br)c1)Oc1ccccc1	ZINC000819064779	FH	On-Demand	Anodyne	ADRB3	30	41
C[C@@H](CNC[C@H](O)c1ccc(F)c(Br)c1)Oc1ccccc1	ZINC000819064780	FH	On-Demand	Anodyne	ADRB3	30	41
C[C@H](CNC[C@@H](O)c1ccc(F)c(Br)c1)Oc1ccccc1	ZINC000819064781	FH	On-Demand	Anodyne	ADRB3	30	41
C[C@@H](CNC[C@@H](O)c1ccc(F)c(Br)c1)Oc1ccccc1	ZINC000819064782	FH	On-Demand	Anodyne	ADRB3	30	41
CCS(=O)(=O)C[C@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819064818	DD	On-Demand	Bother	ADRB3	51	39
CCS(=O)(=O)C[C@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819064818	DD	On-Demand	Bother	CACNA1D	51	33
CCS(=O)(=O)C[C@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819064819	DD	On-Demand	Bother	ADRB3	51	39
CCS(=O)(=O)C[C@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819064819	DD	On-Demand	Bother	CACNA1D	51	33
CCS(=O)(=O)C[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819064820	DD	On-Demand	Bother	ADRB3	51	39
CCS(=O)(=O)C[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819064820	DD	On-Demand	Bother	CACNA1D	51	33
CCS(=O)(=O)C[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819064821	DD	On-Demand	Bother	ADRB3	51	39
CCS(=O)(=O)C[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819064821	DD	On-Demand	Bother	CACNA1D	51	33
CCCNC(=O)c1ccccc1NCC[C@@H]1CC1(Cl)Cl	ZINC000819064822	DH	On-Demand	Anodyne	HCN1	46	31
CCCNC(=O)c1ccccc1NCC[C@H]1CC1(Cl)Cl	ZINC000819064823	DH	On-Demand	Anodyne	HCN1	46	31
CCCNC(=O)c1cccc(NCC[C@@H]2CC2(Cl)Cl)c1	ZINC000819064829	DH	On-Demand	Anodyne	DRD4	42	32
CCCNC(=O)c1cccc(NCC[C@H]2CC2(Cl)Cl)c1	ZINC000819064830	DH	On-Demand	Anodyne	DRD4	42	32
CC(=O)Nc1ccc(NC(=O)C[C@@H](C)n2cccn2)cc1C	ZINC000819064841	DF	On-Demand	Anodyne	SLC1A2	45	37
CC(=O)Nc1ccc(NC(=O)C[C@H](C)n2cccn2)cc1C	ZINC000819064842	DF	On-Demand	Anodyne	SLC1A2	45	37
CC(=O)Nc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819064855	GG	On-Demand	Mild	PAPA1_CARPA	45	43
CC(=O)Nc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819064856	GG	On-Demand	Mild	PAPA1_CARPA	45	43
C[C@@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1ccccc1	ZINC000819064868	EE	On-Demand	Anodyne	ADRB2	26	40
C[C@@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1ccccc1	ZINC000819064868	EE	On-Demand	Anodyne	ADRB3	68	47
C[C@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1ccccc1	ZINC000819064869	EE	On-Demand	Anodyne	ADRB2	26	40
C[C@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1ccccc1	ZINC000819064869	EE	On-Demand	Anodyne	ADRB3	68	47
C[C@@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1ccccc1	ZINC000819064870	EE	On-Demand	Anodyne	ADRB2	26	40
C[C@@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1ccccc1	ZINC000819064870	EE	On-Demand	Anodyne	ADRB3	68	47
C[C@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1ccccc1	ZINC000819064871	EE	On-Demand	Anodyne	ADRB2	26	40
C[C@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1ccccc1	ZINC000819064871	EE	On-Demand	Anodyne	ADRB3	68	47
Cc1cccc(CNC(=O)c2cn([C@H]3CCCN(C(=O)OC(C)(C)C)C3)nn2)c1	ZINC000819064878	GG	On-Demand	Anodyne	MMP13	15	42
Cc1cccc(CNC(=O)c2cn([C@H]3CCCN(C(=O)OC(C)(C)C)C3)nn2)c1	ZINC000819064878	GG	On-Demand	Anodyne	PREP	25	43
Cc1cccc(CNC(=O)c2cn([C@H]3CCCN(C(=O)OC(C)(C)C)C3)nn2)c1	ZINC000819064878	GG	On-Demand	Anodyne	GPR119	18	41
Cc1cccc(CNC(=O)c2cn([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)nn2)c1	ZINC000819064879	GG	On-Demand	Anodyne	MMP13	15	42
Cc1cccc(CNC(=O)c2cn([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)nn2)c1	ZINC000819064879	GG	On-Demand	Anodyne	PREP	25	43
Cc1cccc(CNC(=O)c2cn([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)nn2)c1	ZINC000819064879	GG	On-Demand	Anodyne	GPR119	18	41
C[C@H](CNC[C@@H](O)c1ccc(F)cc1)Oc1ccccc1	ZINC000819064880	CF	On-Demand	Anodyne	ADRB2	23	40
C[C@H](CNC[C@@H](O)c1ccc(F)cc1)Oc1ccccc1	ZINC000819064880	CF	On-Demand	Anodyne	ADRB3	30	48
C[C@H](CNC[C@H](O)c1ccc(F)cc1)Oc1ccccc1	ZINC000819064881	CF	On-Demand	Anodyne	ADRB2	23	40
C[C@H](CNC[C@H](O)c1ccc(F)cc1)Oc1ccccc1	ZINC000819064881	CF	On-Demand	Anodyne	ADRB3	30	48
C[C@@H](CNC[C@H](O)c1ccc(F)cc1)Oc1ccccc1	ZINC000819064882	CF	On-Demand	Anodyne	ADRB2	23	40
C[C@@H](CNC[C@H](O)c1ccc(F)cc1)Oc1ccccc1	ZINC000819064882	CF	On-Demand	Anodyne	ADRB3	30	48
C[C@@H](CNC[C@@H](O)c1ccc(F)cc1)Oc1ccccc1	ZINC000819064883	CF	On-Demand	Anodyne	ADRB2	23	40
C[C@@H](CNC[C@@H](O)c1ccc(F)cc1)Oc1ccccc1	ZINC000819064883	CF	On-Demand	Anodyne	ADRB3	30	48
COc1ccc(OC)c([C@H](O)CNC[C@H](C)Oc2ccccc2)c1	ZINC000819064889	EF	On-Demand	Anodyne	ADRB2	19	47
COc1ccc(OC)c([C@H](O)CNC[C@H](C)Oc2ccccc2)c1	ZINC000819064889	EF	On-Demand	Anodyne	MTNR1A	19	46
COc1ccc(OC)c([C@H](O)CNC[C@H](C)Oc2ccccc2)c1	ZINC000819064889	EF	On-Demand	Anodyne	MTNR1B	22	46
COc1ccc(OC)c([C@H](O)CNC[C@@H](C)Oc2ccccc2)c1	ZINC000819064892	EF	On-Demand	Anodyne	ADRB2	19	47
COc1ccc(OC)c([C@H](O)CNC[C@@H](C)Oc2ccccc2)c1	ZINC000819064892	EF	On-Demand	Anodyne	MTNR1A	19	46
COc1ccc(OC)c([C@H](O)CNC[C@@H](C)Oc2ccccc2)c1	ZINC000819064892	EF	On-Demand	Anodyne	MTNR1B	22	46
C[C@H](CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)Oc1ccccc1	ZINC000819064906	DF	On-Demand	Bother	F2RL3	45	32
C[C@H](CNC[C@H](O)c1ccc([N+](=O)[O-])cc1)Oc1ccccc1	ZINC000819064907	DF	On-Demand	Bother	F2RL3	45	32
C[C@@H](CNC[C@H](O)c1ccc([N+](=O)[O-])cc1)Oc1ccccc1	ZINC000819064908	DF	On-Demand	Bother	F2RL3	45	32
C[C@@H](CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)Oc1ccccc1	ZINC000819064909	DF	On-Demand	Bother	F2RL3	45	32
C[C@@H](CNC[C@@H](O)c1ccc(C#N)cc1)Oc1ccccc1	ZINC000819064914	CF	On-Demand	Mild	ADRB2	17	41
C[C@@H](CNC[C@@H](O)c1ccc(C#N)cc1)Oc1ccccc1	ZINC000819064914	CF	On-Demand	Mild	ADRB3	23	45
C[C@H](CNC[C@H](O)c1ccc(C#N)cc1)Oc1ccccc1	ZINC000819064915	CF	On-Demand	Mild	ADRB2	17	41
C[C@H](CNC[C@H](O)c1ccc(C#N)cc1)Oc1ccccc1	ZINC000819064915	CF	On-Demand	Mild	ADRB3	23	45
C[C@@H](CNC[C@H](O)c1ccc(C#N)cc1)Oc1ccccc1	ZINC000819064916	CF	On-Demand	Mild	ADRB2	17	41
C[C@@H](CNC[C@H](O)c1ccc(C#N)cc1)Oc1ccccc1	ZINC000819064916	CF	On-Demand	Mild	ADRB3	23	45
C[C@H](CNC[C@@H](O)c1ccc(C#N)cc1)Oc1ccccc1	ZINC000819064917	CF	On-Demand	Mild	ADRB2	17	41
C[C@H](CNC[C@@H](O)c1ccc(C#N)cc1)Oc1ccccc1	ZINC000819064917	CF	On-Demand	Mild	ADRB3	23	45
Cc1cc(CNC[C@@H](O)c2ccc(F)cn2)n[nH]1	ZINC000819064918	CD	On-Demand	Anodyne	JAK2	16	44
Cc1cc(CNC[C@H](O)c2ccc(F)cn2)n[nH]1	ZINC000819064919	CD	On-Demand	Anodyne	JAK2	16	44
C[C@H](CNC[C@H](O)c1ccc(F)c(F)c1)Oc1ccccc1	ZINC000819064920	DG	On-Demand	Anodyne	ADRB2	29	41
C[C@H](CNC[C@H](O)c1ccc(F)c(F)c1)Oc1ccccc1	ZINC000819064920	DG	On-Demand	Anodyne	ADRB1	34	40
C[C@H](CNC[C@H](O)c1ccc(F)c(F)c1)Oc1ccccc1	ZINC000819064920	DG	On-Demand	Anodyne	ADRB3	46	43
C[C@@H](CNC[C@H](O)c1ccc(F)c(F)c1)Oc1ccccc1	ZINC000819064921	DG	On-Demand	Anodyne	ADRB2	29	41
C[C@@H](CNC[C@H](O)c1ccc(F)c(F)c1)Oc1ccccc1	ZINC000819064921	DG	On-Demand	Anodyne	ADRB1	34	40
C[C@@H](CNC[C@H](O)c1ccc(F)c(F)c1)Oc1ccccc1	ZINC000819064921	DG	On-Demand	Anodyne	ADRB3	46	43
C[C@H](CNC[C@@H](O)c1ccc(F)c(F)c1)Oc1ccccc1	ZINC000819064922	DG	On-Demand	Anodyne	ADRB2	29	41
C[C@H](CNC[C@@H](O)c1ccc(F)c(F)c1)Oc1ccccc1	ZINC000819064922	DG	On-Demand	Anodyne	ADRB1	34	40
C[C@H](CNC[C@@H](O)c1ccc(F)c(F)c1)Oc1ccccc1	ZINC000819064922	DG	On-Demand	Anodyne	ADRB3	46	43
C[C@@H](CNC[C@@H](O)c1ccc(F)c(F)c1)Oc1ccccc1	ZINC000819064923	DG	On-Demand	Anodyne	ADRB2	29	41
C[C@@H](CNC[C@@H](O)c1ccc(F)c(F)c1)Oc1ccccc1	ZINC000819064923	DG	On-Demand	Anodyne	ADRB1	34	40
C[C@@H](CNC[C@@H](O)c1ccc(F)c(F)c1)Oc1ccccc1	ZINC000819064923	DG	On-Demand	Anodyne	ADRB3	46	43
COC(=O)c1cc(NC(=O)C(F)=C2CCC2)ccc1Cl	ZINC000819064948	CG	On-Demand	Anodyne	ENV	44	37
COC(=O)c1cc(NC(=O)C(F)=C2CCC2)ccc1Cl	ZINC000819064948	CG	On-Demand	Anodyne	Q9FYV8_MAIZE	38	43
O[C@@H](CNCCCO[C@H]1CCCc2ccccc21)c1cccnc1	ZINC000819064956	EG	On-Demand	Anodyne	ADRB2	25	43
O[C@@H](CNCCCO[C@H]1CCCc2ccccc21)c1cccnc1	ZINC000819064956	EG	On-Demand	Anodyne	ADRB1	28	45
O[C@@H](CNCCCO[C@H]1CCCc2ccccc21)c1cccnc1	ZINC000819064956	EG	On-Demand	Anodyne	ADRB3	94	45
O[C@H](CNCCCO[C@H]1CCCc2ccccc21)c1cccnc1	ZINC000819064957	EG	On-Demand	Anodyne	ADRB2	25	43
O[C@H](CNCCCO[C@H]1CCCc2ccccc21)c1cccnc1	ZINC000819064957	EG	On-Demand	Anodyne	ADRB1	28	45
O[C@H](CNCCCO[C@H]1CCCc2ccccc21)c1cccnc1	ZINC000819064957	EG	On-Demand	Anodyne	ADRB3	94	45
O[C@@H](CNCCCO[C@@H]1CCCc2ccccc21)c1cccnc1	ZINC000819064958	EG	On-Demand	Anodyne	ADRB2	25	43
O[C@@H](CNCCCO[C@@H]1CCCc2ccccc21)c1cccnc1	ZINC000819064958	EG	On-Demand	Anodyne	ADRB1	28	45
O[C@@H](CNCCCO[C@@H]1CCCc2ccccc21)c1cccnc1	ZINC000819064958	EG	On-Demand	Anodyne	ADRB3	94	45
O[C@H](CNCCCO[C@@H]1CCCc2ccccc21)c1cccnc1	ZINC000819064959	EG	On-Demand	Anodyne	ADRB2	25	43
O[C@H](CNCCCO[C@@H]1CCCc2ccccc21)c1cccnc1	ZINC000819064959	EG	On-Demand	Anodyne	ADRB1	28	45
O[C@H](CNCCCO[C@@H]1CCCc2ccccc21)c1cccnc1	ZINC000819064959	EG	On-Demand	Anodyne	ADRB3	94	45
Cc1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819064962	BG	On-Demand	Anodyne	FBP1	15	40
O=[N+]([O-])c1cccc(NCC[C@@H]2CC2(Cl)Cl)c1	ZINC000819064969	CH	On-Demand	Bother	CACNA1D	55	32
O=[N+]([O-])c1cccc(NCC[C@@H]2CC2(Cl)Cl)c1	ZINC000819064969	CH	On-Demand	Bother	ICMT	19	47
O=[N+]([O-])c1cccc(NCC[C@H]2CC2(Cl)Cl)c1	ZINC000819064970	CH	On-Demand	Bother	CACNA1D	55	32
O=[N+]([O-])c1cccc(NCC[C@H]2CC2(Cl)Cl)c1	ZINC000819064970	CH	On-Demand	Bother	ICMT	19	47
CC[C@@H]1CCCCN1CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819064986	FD	On-Demand	Anodyne	ADRB3	49	36
CC[C@H]1CCCCN1CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819064989	FD	On-Demand	Anodyne	ADRB3	49	36
CC[C@@H]1CCCCN1CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819064991	FD	On-Demand	Anodyne	ADRB3	49	36
CC[C@H]1CCCCN1CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819064993	FD	On-Demand	Anodyne	ADRB3	49	36
C[C@H](CNC[C@@H](O)c1cccc(Br)c1)Oc1ccccc1	ZINC000819065014	FH	On-Demand	Anodyne	ADRB1	40	41
C[C@H](CNC[C@@H](O)c1cccc(Br)c1)Oc1ccccc1	ZINC000819065014	FH	On-Demand	Anodyne	ADRB3	56	45
C[C@H](CNC[C@H](O)c1cccc(Br)c1)Oc1ccccc1	ZINC000819065015	FH	On-Demand	Anodyne	ADRB1	40	41
C[C@H](CNC[C@H](O)c1cccc(Br)c1)Oc1ccccc1	ZINC000819065015	FH	On-Demand	Anodyne	ADRB3	56	45
C[C@@H](CNC[C@H](O)c1cccc(Br)c1)Oc1ccccc1	ZINC000819065016	FH	On-Demand	Anodyne	ADRB1	40	41
C[C@@H](CNC[C@H](O)c1cccc(Br)c1)Oc1ccccc1	ZINC000819065016	FH	On-Demand	Anodyne	ADRB3	56	45
C[C@@H](CNC[C@@H](O)c1cccc(Br)c1)Oc1ccccc1	ZINC000819065017	FH	On-Demand	Anodyne	ADRB1	40	41
C[C@@H](CNC[C@@H](O)c1cccc(Br)c1)Oc1ccccc1	ZINC000819065017	FH	On-Demand	Anodyne	ADRB3	56	45
NS(=O)(=O)Nc1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819065019	CD	On-Demand	Anodyne	CA2	17	45
NS(=O)(=O)Nc1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819065019	CD	On-Demand	Anodyne	CA4	16	40
NS(=O)(=O)Nc1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819065019	CD	On-Demand	Anodyne	NCE103	18	41
C[C@@H](CNCCC(=O)Nc1ccc(N(C)C)cc1)Oc1ccccc1	ZINC000819065032	EG	On-Demand	Anodyne	LTA4H	52	45
C[C@@H](CNCCC(=O)Nc1ccc(N(C)C)cc1)Oc1ccccc1	ZINC000819065032	EG	On-Demand	Anodyne	MTNR1B	17	42
C[C@H](CNCCC(=O)Nc1ccc(N(C)C)cc1)Oc1ccccc1	ZINC000819065034	EG	On-Demand	Anodyne	LTA4H	52	45
C[C@H](CNCCC(=O)Nc1ccc(N(C)C)cc1)Oc1ccccc1	ZINC000819065034	EG	On-Demand	Anodyne	MTNR1B	17	42
O=C(CCNC[C@H](O)c1ccc(C(F)(F)F)cc1)Nc1ccccc1	ZINC000819065036	FG	On-Demand	Anodyne	ADRB2	23	42
O=C(CCNC[C@H](O)c1ccc(C(F)(F)F)cc1)Nc1ccccc1	ZINC000819065036	FG	On-Demand	Anodyne	ADRB3	54	42
O=C(CCNC[C@H](O)c1ccc(C(F)(F)F)cc1)Nc1ccccc1	ZINC000819065036	FG	On-Demand	Anodyne	EPHX2	16	41
O=C(CCNC[C@@H](O)c1ccc(C(F)(F)F)cc1)Nc1ccccc1	ZINC000819065038	FG	On-Demand	Anodyne	ADRB2	23	42
O=C(CCNC[C@@H](O)c1ccc(C(F)(F)F)cc1)Nc1ccccc1	ZINC000819065038	FG	On-Demand	Anodyne	ADRB3	54	42
O=C(CCNC[C@@H](O)c1ccc(C(F)(F)F)cc1)Nc1ccccc1	ZINC000819065038	FG	On-Demand	Anodyne	EPHX2	16	41
OC1CCN(Cc2ccc(CNC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819065053	ED	On-Demand	Anodyne	ADRB2	25	40
OC1CCN(Cc2ccc(CNC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819065053	ED	On-Demand	Anodyne	ADRB1	25	41
OC1CCN(Cc2ccc(CNC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819065053	ED	On-Demand	Anodyne	ADRB3	97	46
OC1CCN(Cc2ccc(CNC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819065053	ED	On-Demand	Anodyne	SIGMAR1	18	40
OC1CCN(Cc2ccc(CNC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819065054	ED	On-Demand	Anodyne	ADRB2	25	40
OC1CCN(Cc2ccc(CNC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819065054	ED	On-Demand	Anodyne	ADRB1	25	41
OC1CCN(Cc2ccc(CNC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819065054	ED	On-Demand	Anodyne	ADRB3	97	46
OC1CCN(Cc2ccc(CNC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819065054	ED	On-Demand	Anodyne	SIGMAR1	18	40
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccc(F)cn3)cc2)CC1	ZINC000819065056	FE	On-Demand	Anodyne	SIGMAR1	18	40
OC1CCN(Cc2ccc(CNC[C@@H](O)c3ccc(F)cn3)cc2)CC1	ZINC000819065057	FE	On-Demand	Anodyne	SIGMAR1	18	40
CN(CCO)S(=O)(=O)c1ccccc1CNC[C@H](O)c1ccc(Cl)cc1	ZINC000819065063	GD	On-Demand	Anodyne	UTS2	43	33
OC1CCN(Cc2ccc(CNC[C@H](O)c3cccc4ccccc34)cc2)CC1	ZINC000819065068	GH	On-Demand	Anodyne	DRD4	26	43
OC1CCN(Cc2ccc(CNC[C@H](O)c3cccc4ccccc34)cc2)CC1	ZINC000819065068	GH	On-Demand	Anodyne	SIGMAR1	34	47
N#Cc1ccc([C@H](O)CNCc2ccc(CN3CCC(O)CC3)cc2)cc1	ZINC000819065072	FE	On-Demand	Mild	SIGMAR1	15	42
N#Cc1ccc([C@@H](O)CNCc2ccc(CN3CCC(O)CC3)cc2)cc1	ZINC000819065073	FE	On-Demand	Mild	SIGMAR1	15	42
O=[N+]([O-])c1ccc([C@@H](O)CNCc2ccc(CN3CCC(O)CC3)cc2)cc1	ZINC000819065074	GE	On-Demand	Bother	SIGMAR1	17	48
O=[N+]([O-])c1ccc([C@@H](O)CNCc2ccc(CN3CCC(O)CC3)cc2)cc1	ZINC000819065074	GE	On-Demand	Bother	KCNJ1	22	44
O=[N+]([O-])c1ccc([C@H](O)CNCc2ccc(CN3CCC(O)CC3)cc2)cc1	ZINC000819065075	GE	On-Demand	Bother	SIGMAR1	17	48
O=[N+]([O-])c1ccc([C@H](O)CNCc2ccc(CN3CCC(O)CC3)cc2)cc1	ZINC000819065075	GE	On-Demand	Bother	KCNJ1	22	44
O[C@@H](CNCc1ccnc(OC2CCOCC2)c1)c1cccnc1	ZINC000819065080	ED	On-Demand	Anodyne	ADRB1	26	45
O[C@@H](CNCc1ccnc(OC2CCOCC2)c1)c1cccnc1	ZINC000819065080	ED	On-Demand	Anodyne	ADRB3	84	45
O[C@H](CNCc1ccnc(OC2CCOCC2)c1)c1cccnc1	ZINC000819065081	ED	On-Demand	Anodyne	ADRB1	26	45
O[C@H](CNCc1ccnc(OC2CCOCC2)c1)c1cccnc1	ZINC000819065081	ED	On-Demand	Anodyne	ADRB3	84	45
O[C@@H](CNCC1CCSCC1)c1cccc(Cl)c1	ZINC000819065082	CG	On-Demand	Anodyne	ADRB1	55	46
O[C@@H](CNCC1CCSCC1)c1cccc(Cl)c1	ZINC000819065082	CG	On-Demand	Anodyne	ADRB3	65	47
O[C@H](CNCC1CCSCC1)c1cccc(Cl)c1	ZINC000819065083	CG	On-Demand	Anodyne	ADRB1	55	46
O[C@H](CNCC1CCSCC1)c1cccc(Cl)c1	ZINC000819065083	CG	On-Demand	Anodyne	ADRB3	65	47
CC[C@H]1CCCCN1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819065084	DE	On-Demand	Bother	ADRB3	45	37
CC[C@@H]1CCCCN1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819065085	DE	On-Demand	Bother	ADRB3	45	37
CC[C@H]1CCCCN1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819065086	DE	On-Demand	Bother	ADRB3	45	37
CC[C@@H]1CCCCN1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819065087	DE	On-Demand	Bother	ADRB3	45	37
O[C@H](CNCc1ccnc(OC2CCOCC2)c1)c1ccc(F)cc1Cl	ZINC000819065094	GG	On-Demand	Anodyne	MAPK1	47	34
O[C@@H](CNCc1ccnc(OC2CCOCC2)c1)c1ccc(F)cc1Cl	ZINC000819065095	GG	On-Demand	Anodyne	MAPK1	47	34
CC[C@H]1CCCCN1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819065104	CF	On-Demand	Anodyne	ADRB1	22	41
CC[C@@H]1CCCCN1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819065105	CF	On-Demand	Anodyne	ADRB1	22	41
CC[C@H]1CCCCN1CCNC[C@H](O)c1cccc(F)c1	ZINC000819065106	CF	On-Demand	Anodyne	ADRB1	22	41
CC[C@@H]1CCCCN1CCNC[C@H](O)c1cccc(F)c1	ZINC000819065107	CF	On-Demand	Anodyne	ADRB1	22	41
CCS(=O)(=O)C[C@H](C)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819065118	GD	On-Demand	Anodyne	GPR119	43	48
CCS(=O)(=O)C[C@@H](C)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819065119	GD	On-Demand	Anodyne	GPR119	43	48
CCS(=O)(=O)C[C@@H](C)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819065120	GD	On-Demand	Anodyne	GPR119	43	48
CCS(=O)(=O)C[C@H](C)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819065121	GD	On-Demand	Anodyne	GPR119	43	48
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000819065144	EE	On-Demand	Anodyne	L3MBTL3	77	42
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000819065145	EE	On-Demand	Anodyne	L3MBTL3	77	42
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000819065146	EE	On-Demand	Anodyne	L3MBTL3	77	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000819065147	EE	On-Demand	Anodyne	L3MBTL3	77	42
C[C@H](CNC[C@@H](O)c1ccc(C(F)(F)F)cc1)Oc1ccccc1	ZINC000819065148	EH	On-Demand	Anodyne	ADRB3	24	45
C[C@H](CNC[C@H](O)c1ccc(C(F)(F)F)cc1)Oc1ccccc1	ZINC000819065149	EH	On-Demand	Anodyne	ADRB3	24	45
C[C@@H](CNC[C@H](O)c1ccc(C(F)(F)F)cc1)Oc1ccccc1	ZINC000819065150	EH	On-Demand	Anodyne	ADRB3	24	45
C[C@@H](CNC[C@@H](O)c1ccc(C(F)(F)F)cc1)Oc1ccccc1	ZINC000819065151	EH	On-Demand	Anodyne	ADRB3	24	45
CCS(=O)(=O)C[C@@H](C)NC[C@H](O)c1cccc2ccccc12	ZINC000819065166	DE	On-Demand	Anodyne	ADRB2	28	44
CCS(=O)(=O)C[C@H](C)NC[C@H](O)c1cccc2ccccc12	ZINC000819065167	DE	On-Demand	Anodyne	ADRB2	28	44
C[C@H](CS(C)(=O)=O)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819065168	ED	On-Demand	Anodyne	ADRB2	22	62
C[C@H](CS(C)(=O)=O)NC[C@H](O)c1ccc(Br)cc1	ZINC000819065171	ED	On-Demand	Anodyne	ADRB2	22	62
O[C@H](CNCc1ccnc(OC2CCOCC2)c1)c1ccc(F)cc1	ZINC000819065190	EF	On-Demand	Anodyne	MAPK1	48	34
O[C@@H](CNCc1ccnc(OC2CCOCC2)c1)c1ccc(F)cc1	ZINC000819065191	EF	On-Demand	Anodyne	MAPK1	48	34
C[C@H](NC1(CNC[C@@H](O)c2cccnc2)CCCC1)c1ccccc1	ZINC000819065221	EG	On-Demand	Anodyne	ADRB2	21	41
C[C@H](NC1(CNC[C@@H](O)c2cccnc2)CCCC1)c1ccccc1	ZINC000819065221	EG	On-Demand	Anodyne	ADRB1	22	41
C[C@H](NC1(CNC[C@@H](O)c2cccnc2)CCCC1)c1ccccc1	ZINC000819065221	EG	On-Demand	Anodyne	ADRB3	88	44
Cn1nnnc1-c1cccc(NCC[C@H]2CC2(Cl)Cl)c1	ZINC000819065222	DF	On-Demand	Anodyne	CCR3	75	40
Cn1nnnc1-c1cccc(NCC[C@@H]2CC2(Cl)Cl)c1	ZINC000819065223	DF	On-Demand	Anodyne	CCR3	75	40
C[C@H](NC1(CNC[C@H](O)c2cccnc2)CCCC1)c1ccccc1	ZINC000819065224	EG	On-Demand	Anodyne	ADRB2	21	41
C[C@H](NC1(CNC[C@H](O)c2cccnc2)CCCC1)c1ccccc1	ZINC000819065224	EG	On-Demand	Anodyne	ADRB1	22	41
C[C@H](NC1(CNC[C@H](O)c2cccnc2)CCCC1)c1ccccc1	ZINC000819065224	EG	On-Demand	Anodyne	ADRB3	88	44
C[C@@H](NC1(CNC[C@H](O)c2cccnc2)CCCC1)c1ccccc1	ZINC000819065226	EG	On-Demand	Anodyne	ADRB2	21	41
C[C@@H](NC1(CNC[C@H](O)c2cccnc2)CCCC1)c1ccccc1	ZINC000819065226	EG	On-Demand	Anodyne	ADRB1	22	41
C[C@@H](NC1(CNC[C@H](O)c2cccnc2)CCCC1)c1ccccc1	ZINC000819065226	EG	On-Demand	Anodyne	ADRB3	88	44
C[C@@H](NC1(CNC[C@@H](O)c2cccnc2)CCCC1)c1ccccc1	ZINC000819065228	EG	On-Demand	Anodyne	ADRB2	21	41
C[C@@H](NC1(CNC[C@@H](O)c2cccnc2)CCCC1)c1ccccc1	ZINC000819065228	EG	On-Demand	Anodyne	ADRB1	22	41
C[C@@H](NC1(CNC[C@@H](O)c2cccnc2)CCCC1)c1ccccc1	ZINC000819065228	EG	On-Demand	Anodyne	ADRB3	88	44
C[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1ccccc1	ZINC000819065233	GG	On-Demand	Anodyne	MMP13	17	45
C[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1ccccc1	ZINC000819065233	GG	On-Demand	Anodyne	CCR8	20	40
C[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1ccccc1	ZINC000819065233	GG	On-Demand	Anodyne	GPR119	53	51
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819065234	EE	On-Demand	Anodyne	ACHE	37	41
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819065234	EE	On-Demand	Anodyne	SLC6A3	29	51
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819065234	EE	On-Demand	Anodyne	LTA4H	15	45
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819065234	EE	On-Demand	Anodyne	SIGMAR1	50	47
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819065234	EE	On-Demand	Anodyne	CCR5	15	40
C[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1ccccc1	ZINC000819065235	GG	On-Demand	Anodyne	MMP13	17	45
C[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1ccccc1	ZINC000819065235	GG	On-Demand	Anodyne	CCR8	20	40
C[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1ccccc1	ZINC000819065235	GG	On-Demand	Anodyne	GPR119	53	51
OC1CCN(Cc2ccc(CNC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819065236	EE	On-Demand	Anodyne	ACHE	37	41
OC1CCN(Cc2ccc(CNC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819065236	EE	On-Demand	Anodyne	SLC6A3	29	51
OC1CCN(Cc2ccc(CNC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819065236	EE	On-Demand	Anodyne	LTA4H	15	45
OC1CCN(Cc2ccc(CNC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819065236	EE	On-Demand	Anodyne	SIGMAR1	50	47
OC1CCN(Cc2ccc(CNC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819065236	EE	On-Demand	Anodyne	CCR5	15	40
C[C@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1ccccc1	ZINC000819065237	GG	On-Demand	Anodyne	MMP13	17	45
C[C@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1ccccc1	ZINC000819065237	GG	On-Demand	Anodyne	CCR8	20	40
C[C@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1ccccc1	ZINC000819065237	GG	On-Demand	Anodyne	GPR119	53	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCN2C(=O)CNC2=O)CC1	ZINC000819065258	FC	On-Demand	Anodyne	GPR119	28	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCN2C(=O)CNC2=O)CC1	ZINC000819065259	FC	On-Demand	Anodyne	GPR119	28	40
O[C@H](CNCc1ccnc(OC2CCOCC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819065279	GG	On-Demand	Anodyne	MAPK1	15	43
O[C@@H](CNCc1ccnc(OC2CCOCC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819065280	GG	On-Demand	Anodyne	MAPK1	15	43
O=C(CCNC[C@H](O)c1cccnc1)Nc1ccccc1	ZINC000819065291	CD	On-Demand	Anodyne	ADRB2	41	61
O=C(CCNC[C@H](O)c1cccnc1)Nc1ccccc1	ZINC000819065291	CD	On-Demand	Anodyne	ADRB1	66	55
O=C(CCNC[C@H](O)c1cccnc1)Nc1ccccc1	ZINC000819065291	CD	On-Demand	Anodyne	ADRB3	156	69
O=C(CCNC[C@H](O)c1cccnc1)Nc1ccccc1	ZINC000819065291	CD	On-Demand	Anodyne	HDAC3	17	45
O=C(CCNC[C@H](O)c1cccnc1)Nc1ccccc1	ZINC000819065291	CD	On-Demand	Anodyne	NAMPT	22	44
O=C(CCNC[C@@H](O)c1cccnc1)Nc1ccccc1	ZINC000819065292	CD	On-Demand	Anodyne	ADRB2	41	61
O=C(CCNC[C@@H](O)c1cccnc1)Nc1ccccc1	ZINC000819065292	CD	On-Demand	Anodyne	ADRB1	66	55
O=C(CCNC[C@@H](O)c1cccnc1)Nc1ccccc1	ZINC000819065292	CD	On-Demand	Anodyne	ADRB3	156	69
O=C(CCNC[C@@H](O)c1cccnc1)Nc1ccccc1	ZINC000819065292	CD	On-Demand	Anodyne	HDAC3	17	45
O=C(CCNC[C@@H](O)c1cccnc1)Nc1ccccc1	ZINC000819065292	CD	On-Demand	Anodyne	NAMPT	22	44
O[C@@H](CNCc1ccnc(OC2CCOCC2)c1)c1ccccc1Cl	ZINC000819065303	FG	On-Demand	Anodyne	MAPK1	32	41
O[C@@H](CNCc1ccnc(OC2CCOCC2)c1)C1CC1	ZINC000819065304	CD	On-Demand	Anodyne	MAPK1	44	33
O[C@H](CNCc1ccnc(OC2CCOCC2)c1)C1CC1	ZINC000819065305	CD	On-Demand	Anodyne	MAPK1	44	33
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1	ZINC000819065318	CE	On-Demand	Anodyne	ADRB2	36	50
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1	ZINC000819065318	CE	On-Demand	Anodyne	ADRB1	44	50
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1	ZINC000819065318	CE	On-Demand	Anodyne	ADRB3	115	50
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1	ZINC000819065318	CE	On-Demand	Anodyne	KCNA5	24	42
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1	ZINC000819065319	CE	On-Demand	Anodyne	ADRB2	36	50
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1	ZINC000819065319	CE	On-Demand	Anodyne	ADRB1	44	50
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1	ZINC000819065319	CE	On-Demand	Anodyne	ADRB3	115	50
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1	ZINC000819065319	CE	On-Demand	Anodyne	KCNA5	24	42
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1	ZINC000819065320	CE	On-Demand	Anodyne	ADRB2	36	50
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1	ZINC000819065320	CE	On-Demand	Anodyne	ADRB1	44	50
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1	ZINC000819065320	CE	On-Demand	Anodyne	ADRB3	115	50
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1	ZINC000819065320	CE	On-Demand	Anodyne	KCNA5	24	42
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1	ZINC000819065321	CE	On-Demand	Anodyne	ADRB2	36	50
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1	ZINC000819065321	CE	On-Demand	Anodyne	ADRB1	44	50
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1	ZINC000819065321	CE	On-Demand	Anodyne	ADRB3	115	50
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1	ZINC000819065321	CE	On-Demand	Anodyne	KCNA5	24	42
O=C(c1ccccc1NCC[C@@H]1CC1(Cl)Cl)N1CCCC1	ZINC000819065332	EH	On-Demand	Anodyne	NPSR1	15	42
O=C(c1ccccc1NCC[C@H]1CC1(Cl)Cl)N1CCCC1	ZINC000819065333	EH	On-Demand	Anodyne	NPSR1	15	42
O=C(Cn1cnc2sccc2c1=O)OCc1cccc(Cl)c1	ZINC000819065335	EF	On-Demand	Anodyne	MAOB	27	40
CC[C@H]1CCCCN1CCNC[C@@H](O)c1ccccc1	ZINC000819065419	CF	On-Demand	Anodyne	ADRB2	20	42
CC[C@H]1CCCCN1CCNC[C@@H](O)c1ccccc1	ZINC000819065419	CF	On-Demand	Anodyne	ADRB1	25	41
CC[C@H]1CCCCN1CCNC[C@@H](O)c1ccccc1	ZINC000819065419	CF	On-Demand	Anodyne	SLC6A3	17	44
CC[C@H]1CCCCN1CCNC[C@@H](O)c1ccccc1	ZINC000819065419	CF	On-Demand	Anodyne	SLC18A2	37	42
CC[C@H]1CCCCN1CCNC[C@@H](O)c1ccccc1	ZINC000819065419	CF	On-Demand	Anodyne	ADRB3	54	41
CC[C@H]1CCCCN1CCNC[C@@H](O)c1ccccc1	ZINC000819065419	CF	On-Demand	Anodyne	Q8WSF8_APLCA	17	42
CC[C@@H]1CCCCN1CCNC[C@@H](O)c1ccccc1	ZINC000819065421	CF	On-Demand	Anodyne	ADRB2	20	42
CC[C@@H]1CCCCN1CCNC[C@@H](O)c1ccccc1	ZINC000819065421	CF	On-Demand	Anodyne	ADRB1	25	41
CC[C@@H]1CCCCN1CCNC[C@@H](O)c1ccccc1	ZINC000819065421	CF	On-Demand	Anodyne	SLC6A3	17	44
CC[C@@H]1CCCCN1CCNC[C@@H](O)c1ccccc1	ZINC000819065421	CF	On-Demand	Anodyne	SLC18A2	37	42
CC[C@@H]1CCCCN1CCNC[C@@H](O)c1ccccc1	ZINC000819065421	CF	On-Demand	Anodyne	ADRB3	54	41
CC[C@@H]1CCCCN1CCNC[C@@H](O)c1ccccc1	ZINC000819065421	CF	On-Demand	Anodyne	Q8WSF8_APLCA	17	42
CC[C@H]1CCCCN1CCNC[C@H](O)c1ccccc1	ZINC000819065423	CF	On-Demand	Anodyne	ADRB2	20	42
CC[C@H]1CCCCN1CCNC[C@H](O)c1ccccc1	ZINC000819065423	CF	On-Demand	Anodyne	ADRB1	25	41
CC[C@H]1CCCCN1CCNC[C@H](O)c1ccccc1	ZINC000819065423	CF	On-Demand	Anodyne	SLC6A3	17	44
CC[C@H]1CCCCN1CCNC[C@H](O)c1ccccc1	ZINC000819065423	CF	On-Demand	Anodyne	SLC18A2	37	42
CC[C@H]1CCCCN1CCNC[C@H](O)c1ccccc1	ZINC000819065423	CF	On-Demand	Anodyne	ADRB3	54	41
CC[C@H]1CCCCN1CCNC[C@H](O)c1ccccc1	ZINC000819065423	CF	On-Demand	Anodyne	Q8WSF8_APLCA	17	42
CC[C@@H]1CCCCN1CCNC[C@H](O)c1ccccc1	ZINC000819065425	CF	On-Demand	Anodyne	ADRB2	20	42
CC[C@@H]1CCCCN1CCNC[C@H](O)c1ccccc1	ZINC000819065425	CF	On-Demand	Anodyne	ADRB1	25	41
CC[C@@H]1CCCCN1CCNC[C@H](O)c1ccccc1	ZINC000819065425	CF	On-Demand	Anodyne	SLC6A3	17	44
CC[C@@H]1CCCCN1CCNC[C@H](O)c1ccccc1	ZINC000819065425	CF	On-Demand	Anodyne	SLC18A2	37	42
CC[C@@H]1CCCCN1CCNC[C@H](O)c1ccccc1	ZINC000819065425	CF	On-Demand	Anodyne	ADRB3	54	41
CC[C@@H]1CCCCN1CCNC[C@H](O)c1ccccc1	ZINC000819065425	CF	On-Demand	Anodyne	Q8WSF8_APLCA	17	42
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccccc3Cl)cc2)CC1	ZINC000819065426	FG	On-Demand	Anodyne	SIGMAR1	40	45
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccccc1	ZINC000819065431	CF	On-Demand	Anodyne	ADRB1	39	47
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccccc1	ZINC000819065431	CF	On-Demand	Anodyne	ADRB3	54	47
C[C@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccccc1	ZINC000819065432	CF	On-Demand	Anodyne	ADRB1	39	47
C[C@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccccc1	ZINC000819065432	CF	On-Demand	Anodyne	ADRB3	54	47
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccccc1	ZINC000819065434	CF	On-Demand	Anodyne	ADRB1	39	47
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccccc1	ZINC000819065434	CF	On-Demand	Anodyne	ADRB3	54	47
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccccc1	ZINC000819065436	CF	On-Demand	Anodyne	ADRB1	39	47
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccccc1	ZINC000819065436	CF	On-Demand	Anodyne	ADRB3	54	47
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCC(=O)Nc1ccccc1	ZINC000819065439	FD	On-Demand	Anodyne	LTA4H	20	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCC(=O)Nc1ccccc1	ZINC000819065440	FD	On-Demand	Anodyne	LTA4H	20	40
OC1CCN(Cc2ccc(CNC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819065441	FG	On-Demand	Anodyne	ADRB1	38	46
OC1CCN(Cc2ccc(CNC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819065441	FG	On-Demand	Anodyne	ADRB3	51	46
OC1CCN(Cc2ccc(CNC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819065441	FG	On-Demand	Anodyne	SIGMAR1	24	42
OC1CCN(Cc2ccc(CNC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819065441	FG	On-Demand	Anodyne	CYP3A4	45	39
OC1CCN(Cc2ccc(CNC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819065442	FG	On-Demand	Anodyne	ADRB1	38	46
OC1CCN(Cc2ccc(CNC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819065442	FG	On-Demand	Anodyne	ADRB3	51	46
OC1CCN(Cc2ccc(CNC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819065442	FG	On-Demand	Anodyne	SIGMAR1	24	42
OC1CCN(Cc2ccc(CNC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819065442	FG	On-Demand	Anodyne	CYP3A4	45	39
OC1CCN(Cc2ccc(CNC[C@@H](O)c3cc4ccccc4o3)cc2)CC1	ZINC000819065451	GG	On-Demand	Anodyne	ACHE	15	43
OC1CCN(Cc2ccc(CNC[C@@H](O)c3cc4ccccc4o3)cc2)CC1	ZINC000819065451	GG	On-Demand	Anodyne	SIGMAR1	36	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCC(=O)Nc2ccccc2)CC1	ZINC000819065459	GF	On-Demand	Anodyne	CCR8	33	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCC(=O)Nc2ccccc2)CC1	ZINC000819065459	GF	On-Demand	Anodyne	GPR119	42	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCC(=O)Nc2ccccc2)CC1	ZINC000819065460	GF	On-Demand	Anodyne	CCR8	33	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCC(=O)Nc2ccccc2)CC1	ZINC000819065460	GF	On-Demand	Anodyne	GPR119	42	48
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccc(CN3CCC(O)CC3)cc2)c1	ZINC000819065471	GE	On-Demand	Bother	SIGMAR1	20	48
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccc(CN3CCC(O)CC3)cc2)c1	ZINC000819065472	GE	On-Demand	Bother	SIGMAR1	20	48
O[C@H](CNCc1ccnc(OC2CCOCC2)c1)c1ccc(F)cc1F	ZINC000819065478	FF	On-Demand	Anodyne	MAPK1	47	33
O[C@@H](CNCc1ccnc(OC2CCOCC2)c1)c1ccc(F)cc1F	ZINC000819065479	FF	On-Demand	Anodyne	MAPK1	47	33
CC[C@H]1CCCCN1CCNC[C@@H](O)c1ccc(F)cc1	ZINC000819065480	CF	On-Demand	Anodyne	SLC6A3	18	41
CC[C@@H]1CCCCN1CCNC[C@@H](O)c1ccc(F)cc1	ZINC000819065481	CF	On-Demand	Anodyne	SLC6A3	18	41
CC[C@H]1CCCCN1CCNC[C@H](O)c1ccc(F)cc1	ZINC000819065482	CF	On-Demand	Anodyne	SLC6A3	18	41
CC[C@@H]1CCCCN1CCNC[C@H](O)c1ccc(F)cc1	ZINC000819065483	CF	On-Demand	Anodyne	SLC6A3	18	41
COc1ccc(OC)c([C@H](O)CNCCN2C(=O)CNC2=O)c1	ZINC000819065503	DB	On-Demand	Anodyne	ADRB2	26	44
O[C@H](CNCc1ccnc(OC2CCOCC2)c1)c1ccccc1	ZINC000819065505	EE	On-Demand	Anodyne	ADRB3	42	40
O[C@@H](CNCc1ccnc(OC2CCOCC2)c1)c1ccccc1	ZINC000819065506	EE	On-Demand	Anodyne	ADRB3	42	40
COC(=O)c1cc(OC)c(OC)cc1N[C@@H]1CCN(C(C)(C)C)C1=O	ZINC000819065508	FE	On-Demand	Anodyne	HTR4	47	34
COC(=O)c1cc(OC)c(OC)cc1N[C@H]1CCN(C(C)(C)C)C1=O	ZINC000819065509	FE	On-Demand	Anodyne	HTR4	47	34
O=C(c1ccccc1NCC[C@@H]1CC1(Cl)Cl)N1CCCCC1	ZINC000819065544	EI	On-Demand	Anodyne	NPSR1	16	44
O=C(c1ccccc1NCC[C@H]1CC1(Cl)Cl)N1CCCCC1	ZINC000819065545	EI	On-Demand	Anodyne	NPSR1	16	44
Cc1cc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n[nH]1	ZINC000819065558	ED	On-Demand	Anodyne	GPR119	53	47
Cc1cc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n[nH]1	ZINC000819065559	ED	On-Demand	Anodyne	GPR119	53	47
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065568	DG	On-Demand	Anodyne	ADRB2	41	50
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065568	DG	On-Demand	Anodyne	ADRB1	61	52
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065568	DG	On-Demand	Anodyne	ADRB3	80	52
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065568	DG	On-Demand	Anodyne	AOC3	15	43
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065568	DG	On-Demand	Anodyne	PDS	24	40
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065569	DG	On-Demand	Anodyne	ADRB2	41	50
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065569	DG	On-Demand	Anodyne	ADRB1	61	52
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065569	DG	On-Demand	Anodyne	ADRB3	80	52
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065569	DG	On-Demand	Anodyne	AOC3	15	43
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065569	DG	On-Demand	Anodyne	PDS	24	40
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065570	DG	On-Demand	Anodyne	ADRB2	41	50
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065570	DG	On-Demand	Anodyne	ADRB1	61	52
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065570	DG	On-Demand	Anodyne	ADRB3	80	52
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065570	DG	On-Demand	Anodyne	AOC3	15	43
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065570	DG	On-Demand	Anodyne	PDS	24	40
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065571	DG	On-Demand	Anodyne	ADRB2	41	50
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065571	DG	On-Demand	Anodyne	ADRB1	61	52
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065571	DG	On-Demand	Anodyne	ADRB3	80	52
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065571	DG	On-Demand	Anodyne	AOC3	15	43
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccccc1	ZINC000819065571	DG	On-Demand	Anodyne	PDS	24	40
O=C(c1ccc(NCC[C@@H]2CC2(Cl)Cl)cc1)N1CCOCC1	ZINC000819065607	EG	On-Demand	Anodyne	EPHX2	18	51
O=C(c1ccc(NCC[C@@H]2CC2(Cl)Cl)cc1)N1CCOCC1	ZINC000819065607	EG	On-Demand	Anodyne	L3MBTL3	40	33
O=C(c1ccc(NCC[C@H]2CC2(Cl)Cl)cc1)N1CCOCC1	ZINC000819065608	EG	On-Demand	Anodyne	EPHX2	18	51
O=C(c1ccc(NCC[C@H]2CC2(Cl)Cl)cc1)N1CCOCC1	ZINC000819065608	EG	On-Demand	Anodyne	L3MBTL3	40	33
CC(=O)Nc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1C	ZINC000819065609	GG	On-Demand	Mild	PAPA1_CARPA	48	47
CC(=O)Nc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1C	ZINC000819065609	GG	On-Demand	Mild	CTSK	15	43
CC(=O)Nc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1C	ZINC000819065609	GG	On-Demand	Mild	FPR1	44	39
CC(=O)Nc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1C	ZINC000819065610	GG	On-Demand	Mild	PAPA1_CARPA	48	47
CC(=O)Nc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1C	ZINC000819065610	GG	On-Demand	Mild	CTSK	15	43
CC(=O)Nc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1C	ZINC000819065610	GG	On-Demand	Mild	FPR1	44	39
CCC(CC)(CNC[C@@H](O)c1cccnc1)N[C@@H](C)c1ccccc1	ZINC000819065624	EH	On-Demand	Anodyne	ADRB2	24	42
CCC(CC)(CNC[C@@H](O)c1cccnc1)N[C@@H](C)c1ccccc1	ZINC000819065624	EH	On-Demand	Anodyne	ADRB1	24	44
CCC(CC)(CNC[C@@H](O)c1cccnc1)N[C@@H](C)c1ccccc1	ZINC000819065624	EH	On-Demand	Anodyne	ADRB3	92	44
CCC(CC)(CNC[C@H](O)c1cccnc1)N[C@@H](C)c1ccccc1	ZINC000819065625	EH	On-Demand	Anodyne	ADRB2	24	42
CCC(CC)(CNC[C@H](O)c1cccnc1)N[C@@H](C)c1ccccc1	ZINC000819065625	EH	On-Demand	Anodyne	ADRB1	24	44
CCC(CC)(CNC[C@H](O)c1cccnc1)N[C@@H](C)c1ccccc1	ZINC000819065625	EH	On-Demand	Anodyne	ADRB3	92	44
CCC(CC)(CNC[C@H](O)c1cccnc1)N[C@H](C)c1ccccc1	ZINC000819065626	EH	On-Demand	Anodyne	ADRB2	24	42
CCC(CC)(CNC[C@H](O)c1cccnc1)N[C@H](C)c1ccccc1	ZINC000819065626	EH	On-Demand	Anodyne	ADRB1	24	44
CCC(CC)(CNC[C@H](O)c1cccnc1)N[C@H](C)c1ccccc1	ZINC000819065626	EH	On-Demand	Anodyne	ADRB3	92	44
CCC(CC)(CNC[C@@H](O)c1cccnc1)N[C@H](C)c1ccccc1	ZINC000819065627	EH	On-Demand	Anodyne	ADRB2	24	42
CCC(CC)(CNC[C@@H](O)c1cccnc1)N[C@H](C)c1ccccc1	ZINC000819065627	EH	On-Demand	Anodyne	ADRB1	24	44
CCC(CC)(CNC[C@@H](O)c1cccnc1)N[C@H](C)c1ccccc1	ZINC000819065627	EH	On-Demand	Anodyne	ADRB3	92	44
O=C(CCNC[C@H](O)c1ccc(F)cn1)Nc1ccccc1	ZINC000819065640	DD	On-Demand	Anodyne	ADRB1	45	37
O=C(CCNC[C@H](O)c1ccc(F)cn1)Nc1ccccc1	ZINC000819065640	DD	On-Demand	Anodyne	ADRB3	35	41
O=C(CCNC[C@@H](O)c1ccc(F)cn1)Nc1ccccc1	ZINC000819065641	DD	On-Demand	Anodyne	ADRB1	45	37
O=C(CCNC[C@@H](O)c1ccc(F)cn1)Nc1ccccc1	ZINC000819065641	DD	On-Demand	Anodyne	ADRB3	35	41
Cc1ccccc1[C@@H](O)CNCc1ccc(CN2CCC(O)CC2)cc1	ZINC000819065646	FF	On-Demand	Anodyne	ACHE	19	41
Cc1ccccc1[C@@H](O)CNCc1ccc(CN2CCC(O)CC2)cc1	ZINC000819065646	FF	On-Demand	Anodyne	SIGMAR1	35	43
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccc(Cl)cc3)cc2)CC1	ZINC000819065650	FG	On-Demand	Anodyne	SIGMAR1	25	42
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccc(Cl)cc3)cc2)CC1	ZINC000819065650	FG	On-Demand	Anodyne	CXCR3	19	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCC(=O)Nc2ccccc2)cc1	ZINC000819065657	FD	On-Demand	Anodyne	ADRB2	45	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCC(=O)Nc2ccccc2)cc1	ZINC000819065657	FD	On-Demand	Anodyne	ADRB1	46	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCC(=O)Nc2ccccc2)cc1	ZINC000819065657	FD	On-Demand	Anodyne	PTGS2	15	50
CS(=O)(=O)c1ccc([C@@H](O)CNCCC(=O)Nc2ccccc2)cc1	ZINC000819065657	FD	On-Demand	Anodyne	ADRB3	108	46
CS(=O)(=O)c1ccc([C@H](O)CNCCC(=O)Nc2ccccc2)cc1	ZINC000819065658	FD	On-Demand	Anodyne	ADRB2	45	42
CS(=O)(=O)c1ccc([C@H](O)CNCCC(=O)Nc2ccccc2)cc1	ZINC000819065658	FD	On-Demand	Anodyne	ADRB1	46	41
CS(=O)(=O)c1ccc([C@H](O)CNCCC(=O)Nc2ccccc2)cc1	ZINC000819065658	FD	On-Demand	Anodyne	PTGS2	15	50
CS(=O)(=O)c1ccc([C@H](O)CNCCC(=O)Nc2ccccc2)cc1	ZINC000819065658	FD	On-Demand	Anodyne	ADRB3	108	46
OC1CCN(Cc2ccc(CNCC3(O)CCCCC3)cc2)CC1	ZINC000819065659	EE	On-Demand	Anodyne	HRH3	15	50
O[C@H](CNCc1ccnc(OC2CCOCC2)c1)c1ccc(Cl)c(F)c1	ZINC000819065665	GG	On-Demand	Anodyne	MAPK1	61	42
O[C@@H](CNCc1ccnc(OC2CCOCC2)c1)c1ccc(Cl)c(F)c1	ZINC000819065666	GG	On-Demand	Anodyne	MAPK1	61	42
CC(=O)c1cccc(NCC[C@@H]2CC2(Cl)Cl)c1	ZINC000819065669	CH	On-Demand	Anodyne	AKR1C3	22	44
CC(=O)c1cccc(NCC[C@@H]2CC2(Cl)Cl)c1	ZINC000819065669	CH	On-Demand	Anodyne	KCNK3	55	33
CC(=O)c1cccc(NCC[C@H]2CC2(Cl)Cl)c1	ZINC000819065670	CH	On-Demand	Anodyne	AKR1C3	22	44
CC(=O)c1cccc(NCC[C@H]2CC2(Cl)Cl)c1	ZINC000819065670	CH	On-Demand	Anodyne	KCNK3	55	33
O[C@H](CNCc1ccnc(OC2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819065678	FG	On-Demand	Anodyne	ADRB1	37	44
O[C@H](CNCc1ccnc(OC2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819065678	FG	On-Demand	Anodyne	ADRB3	49	44
O[C@H](CNCc1ccnc(OC2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819065678	FG	On-Demand	Anodyne	MAPK1	49	41
O[C@H](CNCc1ccnc(OC2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819065678	FG	On-Demand	Anodyne	CYP3A4	44	33
O[C@@H](CNCc1ccnc(OC2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819065679	FG	On-Demand	Anodyne	ADRB1	37	44
O[C@@H](CNCc1ccnc(OC2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819065679	FG	On-Demand	Anodyne	ADRB3	49	44
O[C@@H](CNCc1ccnc(OC2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819065679	FG	On-Demand	Anodyne	MAPK1	49	41
O[C@@H](CNCc1ccnc(OC2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819065679	FG	On-Demand	Anodyne	CYP3A4	44	33
CN(CCO)S(=O)(=O)c1ccccc1CNC[C@H](O)c1cccnc1	ZINC000819065691	FC	On-Demand	Anodyne	ADRB3	91	47
CN(CCO)S(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccnc1	ZINC000819065692	FC	On-Demand	Anodyne	ADRB3	91	47
OC1CCN(Cc2ccc(CNC[C@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819065702	FF	On-Demand	Anodyne	SLC6A3	17	49
OC1CCN(Cc2ccc(CNC[C@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819065702	FF	On-Demand	Anodyne	SIGMAR1	30	46
OC1CCN(Cc2ccc(CNC[C@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819065702	FF	On-Demand	Anodyne	CCR3	26	43
OC1CCN(Cc2ccc(CNC[C@@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819065703	FF	On-Demand	Anodyne	SLC6A3	17	49
OC1CCN(Cc2ccc(CNC[C@@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819065703	FF	On-Demand	Anodyne	SIGMAR1	30	46
OC1CCN(Cc2ccc(CNC[C@@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819065703	FF	On-Demand	Anodyne	CCR3	26	43
O[C@@H](CNCc1ccnc(OC2CCOCC2)c1)c1ccc(F)cn1	ZINC000819065704	ED	On-Demand	Anodyne	MAPK1	40	33
O[C@H](CNCc1ccnc(OC2CCOCC2)c1)c1ccc(F)cn1	ZINC000819065705	ED	On-Demand	Anodyne	MAPK1	40	33
COc1ccc([N+](=O)[O-])cc1NCC[C@@H]1CC1(Cl)Cl	ZINC000819065708	DH	On-Demand	Bother	KCNMA1	21	43
COc1ccc([N+](=O)[O-])cc1NCC[C@H]1CC1(Cl)Cl	ZINC000819065709	DH	On-Demand	Bother	KCNMA1	21	43
C[C@@H](CC(=O)NCC(=O)Nc1ccc2nc(O)[nH]c2c1)n1cccn1	ZINC000819065721	ED	On-Demand	Anodyne	ENPP1	59	34
C[C@H](CC(=O)NCC(=O)Nc1ccc2nc(O)[nH]c2c1)n1cccn1	ZINC000819065722	ED	On-Demand	Anodyne	ENPP1	59	34
C[C@H](CS(C)(=O)=O)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819065733	FD	On-Demand	Anodyne	GPR119	46	49
C[C@H](CS(C)(=O)=O)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819065734	FD	On-Demand	Anodyne	GPR119	46	49
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1	ZINC000819065749	DF	On-Demand	Bother	ADRB1	41	40
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1	ZINC000819065749	DF	On-Demand	Bother	ADRB3	60	39
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1	ZINC000819065749	DF	On-Demand	Bother	CACNA1D	58	38
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1	ZINC000819065749	DF	On-Demand	Bother	F2RL3	46	32
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1	ZINC000819065750	DF	On-Demand	Bother	ADRB1	41	40
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1	ZINC000819065750	DF	On-Demand	Bother	ADRB3	60	39
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1	ZINC000819065750	DF	On-Demand	Bother	CACNA1D	58	38
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1	ZINC000819065750	DF	On-Demand	Bother	F2RL3	46	32
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1	ZINC000819065751	DF	On-Demand	Bother	ADRB1	41	40
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1	ZINC000819065751	DF	On-Demand	Bother	ADRB3	60	39
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1	ZINC000819065751	DF	On-Demand	Bother	CACNA1D	58	38
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1	ZINC000819065751	DF	On-Demand	Bother	F2RL3	46	32
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1	ZINC000819065752	DF	On-Demand	Bother	ADRB1	41	40
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1	ZINC000819065752	DF	On-Demand	Bother	ADRB3	60	39
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1	ZINC000819065752	DF	On-Demand	Bother	CACNA1D	58	38
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1	ZINC000819065752	DF	On-Demand	Bother	F2RL3	46	32
CCS(=O)(=O)C[C@H](C)NC[C@H](O)c1ccc(Br)cc1	ZINC000819065770	FD	On-Demand	Anodyne	ADRB2	22	64
CCS(=O)(=O)C[C@H](C)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819065771	FD	On-Demand	Anodyne	ADRB2	22	64
CCS(=O)(=O)C[C@@H](C)NC[C@H](O)c1ccc(Br)cc1	ZINC000819065772	FD	On-Demand	Anodyne	ADRB2	22	64
CCS(=O)(=O)C[C@@H](C)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819065773	FD	On-Demand	Anodyne	ADRB2	22	64
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n[nH]1	ZINC000819065774	FE	On-Demand	Anodyne	CTSD	89	42
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n[nH]1	ZINC000819065774	FE	On-Demand	Anodyne	PGC	60	38
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n[nH]1	ZINC000819065774	FE	On-Demand	Anodyne	PAPA1_CARPA	32	43
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n[nH]1	ZINC000819065774	FE	On-Demand	Anodyne	BACE2	46	40
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n[nH]1	ZINC000819065774	FE	On-Demand	Anodyne	REN	83	46
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n[nH]1	ZINC000819065774	FE	On-Demand	Anodyne	REN1	24	44
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n[nH]1	ZINC000819065774	FE	On-Demand	Anodyne	BACE1	91	43
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n[nH]1	ZINC000819065774	FE	On-Demand	Anodyne	FPR1	47	41
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n[nH]1	ZINC000819065774	FE	On-Demand	Anodyne	PLM2_PLAFA	40	34
O=C1CCC(=O)N1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819065780	DC	On-Demand	Bother	ADRB3	42	36
O=C1CCC(=O)N1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819065781	DC	On-Demand	Bother	ADRB3	42	36
O=C(c1cccc(NCC[C@@H]2CC2(Cl)Cl)c1)N1CCOCC1	ZINC000819065799	EG	On-Demand	Anodyne	ITGAL	41	31
O=C(c1cccc(NCC[C@@H]2CC2(Cl)Cl)c1)N1CCOCC1	ZINC000819065799	EG	On-Demand	Anodyne	EPHX2	25	53
O=C(c1cccc(NCC[C@H]2CC2(Cl)Cl)c1)N1CCOCC1	ZINC000819065800	EG	On-Demand	Anodyne	ITGAL	41	31
O=C(c1cccc(NCC[C@H]2CC2(Cl)Cl)c1)N1CCOCC1	ZINC000819065800	EG	On-Demand	Anodyne	EPHX2	25	53
O=C(Nc1ccccc1NCC[C@H]1CC1(Cl)Cl)c1ccccc1	ZINC000819065802	EJ	On-Demand	Anodyne	CCR8	24	40
O=C(Nc1ccccc1NCC[C@H]1CC1(Cl)Cl)c1ccccc1	ZINC000819065802	EJ	On-Demand	Anodyne	KCNK3	40	33
O=C(Nc1ccccc1NCC[C@@H]1CC1(Cl)Cl)c1ccccc1	ZINC000819065803	EJ	On-Demand	Anodyne	CCR8	24	40
O=C(Nc1ccccc1NCC[C@@H]1CC1(Cl)Cl)c1ccccc1	ZINC000819065803	EJ	On-Demand	Anodyne	KCNK3	40	33
CC[C@@H]1CCCCN1CCNC[C@H](O)c1ccccc1Cl	ZINC000819065817	DG	On-Demand	Anodyne	OPRL1	31	42
CC[C@H]1CCCCN1CCNC[C@H](O)c1ccccc1Cl	ZINC000819065818	DG	On-Demand	Anodyne	OPRL1	31	42
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccc(F)cc3Cl)cc2)CC1	ZINC000819065822	GG	On-Demand	Anodyne	SIGMAR1	24	42
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccc(F)cc3Cl)cc2)CC1	ZINC000819065822	GG	On-Demand	Anodyne	CCR3	28	42
OC1CCN(Cc2ccc(CNC[C@@H](O)c3ccc(F)cc3Cl)cc2)CC1	ZINC000819065823	GG	On-Demand	Anodyne	SIGMAR1	24	42
OC1CCN(Cc2ccc(CNC[C@@H](O)c3ccc(F)cc3Cl)cc2)CC1	ZINC000819065823	GG	On-Demand	Anodyne	CCR3	28	42
O[C@H](CNCC1CCSCC1)c1cccnc1	ZINC000819065832	CD	On-Demand	Anodyne	ADRB2	24	46
O[C@H](CNCC1CCSCC1)c1cccnc1	ZINC000819065832	CD	On-Demand	Anodyne	ADRB1	28	46
O[C@H](CNCC1CCSCC1)c1cccnc1	ZINC000819065832	CD	On-Demand	Anodyne	ADRB3	101	47
O[C@@H](CNCC1CCSCC1)c1cccnc1	ZINC000819065833	CD	On-Demand	Anodyne	ADRB2	24	46
O[C@@H](CNCC1CCSCC1)c1cccnc1	ZINC000819065833	CD	On-Demand	Anodyne	ADRB1	28	46
O[C@@H](CNCC1CCSCC1)c1cccnc1	ZINC000819065833	CD	On-Demand	Anodyne	ADRB3	101	47
CN(CCO)S(=O)(=O)c1ccccc1CNC[C@H](O)c1cccc(F)c1	ZINC000819065845	GD	On-Demand	Anodyne	ADRB3	16	41
CN(CCO)S(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccc(F)c1	ZINC000819065846	GD	On-Demand	Anodyne	ADRB3	16	41
O[C@H](CNCc1ccnc(OC2CCOCC2)c1)c1ccc(F)c(F)c1	ZINC000819065853	FF	On-Demand	Anodyne	MAPK1	42	40
O[C@@H](CNCc1ccnc(OC2CCOCC2)c1)c1ccc(F)c(F)c1	ZINC000819065854	FF	On-Demand	Anodyne	MAPK1	42	40
CCC(CC)(CNC[C@H](O)c1ccc(C#N)cc1)N[C@@H](C)c1ccccc1	ZINC000819065867	FI	On-Demand	Mild	CTRB_BOVIN	44	30
CCC(CC)(CNC[C@H](O)c1ccc(C#N)cc1)N[C@H](C)c1ccccc1	ZINC000819065868	FI	On-Demand	Mild	CTRB_BOVIN	44	30
CCC(CC)(CNC[C@@H](O)c1ccc(C#N)cc1)N[C@@H](C)c1ccccc1	ZINC000819065869	FI	On-Demand	Mild	CTRB_BOVIN	44	30
CCC(CC)(CNC[C@@H](O)c1ccc(C#N)cc1)N[C@H](C)c1ccccc1	ZINC000819065870	FI	On-Demand	Mild	CTRB_BOVIN	44	30
CN(C[C@@H](O)CNCCC(=O)Nc1ccccc1)C(=O)OC(C)(C)C	ZINC000819065887	FD	On-Demand	Anodyne	ADRB1	40	32
CN(C[C@H](O)CNCCC(=O)Nc1ccccc1)C(=O)OC(C)(C)C	ZINC000819065888	FD	On-Demand	Anodyne	ADRB1	40	32
O=S(=O)(c1ccc(NCC[C@@H]2CC2(Cl)Cl)cc1)N1CCCC1	ZINC000819065889	FG	On-Demand	Anodyne	TGM2	45	37
O=S(=O)(c1ccc(NCC[C@@H]2CC2(Cl)Cl)cc1)N1CCCC1	ZINC000819065889	FG	On-Demand	Anodyne	F13A1	61	43
O=S(=O)(c1ccc(NCC[C@@H]2CC2(Cl)Cl)cc1)N1CCCC1	ZINC000819065889	FG	On-Demand	Anodyne	NAMPT	28	43
O=S(=O)(c1ccc(NCC[C@H]2CC2(Cl)Cl)cc1)N1CCCC1	ZINC000819065890	FG	On-Demand	Anodyne	TGM2	45	37
O=S(=O)(c1ccc(NCC[C@H]2CC2(Cl)Cl)cc1)N1CCCC1	ZINC000819065890	FG	On-Demand	Anodyne	F13A1	61	43
O=S(=O)(c1ccc(NCC[C@H]2CC2(Cl)Cl)cc1)N1CCCC1	ZINC000819065890	FG	On-Demand	Anodyne	NAMPT	28	43
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819065897	FF	On-Demand	Anodyne	SLC6A3	33	52
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819065897	FF	On-Demand	Anodyne	SIGMAR1	32	54
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819065897	FF	On-Demand	Anodyne	CCR3	25	41
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819065897	FF	On-Demand	Anodyne	SLC18A3	15	40
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819065897	FF	On-Demand	Anodyne	MCHR1	16	43
OC1CCN(Cc2ccc(CNC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819065898	FF	On-Demand	Anodyne	SLC6A3	33	52
OC1CCN(Cc2ccc(CNC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819065898	FF	On-Demand	Anodyne	SIGMAR1	32	54
OC1CCN(Cc2ccc(CNC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819065898	FF	On-Demand	Anodyne	CCR3	25	41
OC1CCN(Cc2ccc(CNC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819065898	FF	On-Demand	Anodyne	SLC18A3	15	40
OC1CCN(Cc2ccc(CNC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819065898	FF	On-Demand	Anodyne	MCHR1	16	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CCSCC1	ZINC000819065904	GG	On-Demand	Anodyne	CTSD	112	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CCSCC1	ZINC000819065904	GG	On-Demand	Anodyne	PGC	64	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CCSCC1	ZINC000819065904	GG	On-Demand	Anodyne	CMA1	31	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CCSCC1	ZINC000819065904	GG	On-Demand	Anodyne	CTRA_BOVIN	15	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CCSCC1	ZINC000819065904	GG	On-Demand	Anodyne	PAPA1_CARPA	35	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CCSCC1	ZINC000819065904	GG	On-Demand	Anodyne	CTSK	19	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CCSCC1	ZINC000819065904	GG	On-Demand	Anodyne	CTSL	16	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CCSCC1	ZINC000819065904	GG	On-Demand	Anodyne	BACE2	56	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CCSCC1	ZINC000819065904	GG	On-Demand	Anodyne	REN	106	51
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CCSCC1	ZINC000819065904	GG	On-Demand	Anodyne	REN1	26	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CCSCC1	ZINC000819065904	GG	On-Demand	Anodyne	BACE1	90	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CCSCC1	ZINC000819065904	GG	On-Demand	Anodyne	FPR1	54	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CCSCC1	ZINC000819065904	GG	On-Demand	Anodyne	PLM1_PLAFA	31	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CCSCC1	ZINC000819065904	GG	On-Demand	Anodyne	PLM2_PLAFA	57	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CCSCC1	ZINC000819065904	GG	On-Demand	Anodyne	Q82323_9DELA	58	30
CC[C@H]1CCCCN1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819065911	DG	On-Demand	Anodyne	ADRB1	50	47
CC[C@H]1CCCCN1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819065911	DG	On-Demand	Anodyne	ADRB3	68	47
CC[C@H]1CCCCN1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819065911	DG	On-Demand	Anodyne	SPHK1	17	41
CC[C@H]1CCCCN1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819065911	DG	On-Demand	Anodyne	CYP3A4	40	34
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)COc1ccc2ccc(=O)oc2c1	ZINC000819065918	GF	On-Demand	Anodyne	MAOA	32	40
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)COc1ccc2ccc(=O)oc2c1	ZINC000819065918	GF	On-Demand	Anodyne	MAOB	19	41
CN(Cc1ccc(F)c(F)c1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819065925	GH	On-Demand	Mild	PAPA1_CARPA	54	48
CN(Cc1ccc(F)c(F)c1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819065926	GH	On-Demand	Mild	PAPA1_CARPA	54	48
CCCNS(=O)(=O)c1ccc(NC(=O)C(F)=C2CCC2)cc1	ZINC000819065927	EF	On-Demand	Anodyne	CA2	28	44
CCCNS(=O)(=O)c1ccc(NC(=O)C(F)=C2CCC2)cc1	ZINC000819065927	EF	On-Demand	Anodyne	CA1	29	44
CCCNS(=O)(=O)c1ccc(NC(=O)C(F)=C2CCC2)cc1	ZINC000819065927	EF	On-Demand	Anodyne	CA4	24	44
CCCNS(=O)(=O)c1ccc(NC(=O)C(F)=C2CCC2)cc1	ZINC000819065927	EF	On-Demand	Anodyne	P96878_MYCTU	41	36
O=C(COc1cccc(NCC[C@@H]2CC2(Cl)Cl)c1)N1CCCC1	ZINC000819065949	FH	On-Demand	Anodyne	CPT1A	79	38
O=C(COc1cccc(NCC[C@@H]2CC2(Cl)Cl)c1)N1CCCC1	ZINC000819065949	FH	On-Demand	Anodyne	CPT2	41	35
O=C(COc1cccc(NCC[C@@H]2CC2(Cl)Cl)c1)N1CCCC1	ZINC000819065949	FH	On-Demand	Anodyne	EPHX2	19	40
O=C(COc1cccc(NCC[C@H]2CC2(Cl)Cl)c1)N1CCCC1	ZINC000819065950	FH	On-Demand	Anodyne	CPT1A	79	38
O=C(COc1cccc(NCC[C@H]2CC2(Cl)Cl)c1)N1CCCC1	ZINC000819065950	FH	On-Demand	Anodyne	CPT2	41	35
O=C(COc1cccc(NCC[C@H]2CC2(Cl)Cl)c1)N1CCCC1	ZINC000819065950	FH	On-Demand	Anodyne	EPHX2	19	40
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)COc1ccc2c(c1)CCC2	ZINC000819065953	FF	On-Demand	Anodyne	CPT1A	35	40
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)COc1ccc2c(c1)CCC2	ZINC000819065953	FF	On-Demand	Anodyne	CPT2	44	40
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)COc1ccc2c(c1)CCC2	ZINC000819065954	FF	On-Demand	Anodyne	CPT1A	35	40
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)COc1ccc2c(c1)CCC2	ZINC000819065954	FF	On-Demand	Anodyne	CPT2	44	40
Cc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)n[nH]1	ZINC000819065970	CD	On-Demand	Bother	CACNA1C	56	37
Cc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)n[nH]1	ZINC000819065970	CD	On-Demand	Bother	CACNA1D	88	36
Cc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)n[nH]1	ZINC000819065971	CD	On-Demand	Bother	CACNA1C	56	37
Cc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)n[nH]1	ZINC000819065971	CD	On-Demand	Bother	CACNA1D	88	36
O=C1CCC(=O)N1CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819065982	ED	On-Demand	Anodyne	ADRB3	25	45
O=C1CCC(=O)N1CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819065983	ED	On-Demand	Anodyne	ADRB3	25	45
COC(=O)c1cccc(NCC[C@H]2CC2(Cl)Cl)c1	ZINC000819065988	CG	On-Demand	Anodyne	HIF1A	15	44
COC(=O)c1cccc(NCC[C@@H]2CC2(Cl)Cl)c1	ZINC000819065989	CG	On-Demand	Anodyne	HIF1A	15	44
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000819065994	EG	On-Demand	Anodyne	L3MBTL3	56	38
CC[C@@H]1CCCCN1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819066012	DG	On-Demand	Anodyne	ADRB1	50	47
CC[C@@H]1CCCCN1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819066012	DG	On-Demand	Anodyne	ADRB3	68	47
CC[C@@H]1CCCCN1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819066012	DG	On-Demand	Anodyne	SPHK1	17	41
CC[C@@H]1CCCCN1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819066012	DG	On-Demand	Anodyne	CYP3A4	40	34
CC[C@H]1CCCCN1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819066013	DG	On-Demand	Anodyne	ADRB1	50	47
CC[C@H]1CCCCN1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819066013	DG	On-Demand	Anodyne	ADRB3	68	47
CC[C@H]1CCCCN1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819066013	DG	On-Demand	Anodyne	SPHK1	17	41
CC[C@H]1CCCCN1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819066013	DG	On-Demand	Anodyne	CYP3A4	40	34
CC[C@@H]1CCCCN1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819066014	DG	On-Demand	Anodyne	ADRB1	50	47
CC[C@@H]1CCCCN1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819066014	DG	On-Demand	Anodyne	ADRB3	68	47
CC[C@@H]1CCCCN1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819066014	DG	On-Demand	Anodyne	SPHK1	17	41
CC[C@@H]1CCCCN1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819066014	DG	On-Demand	Anodyne	CYP3A4	40	34
O=[N+]([O-])c1cccc([C@@H](O)CNCC2CCSCC2)c1	ZINC000819066015	CE	On-Demand	Bother	CACNA1D	47	35
O=[N+]([O-])c1cccc([C@H](O)CNCC2CCSCC2)c1	ZINC000819066016	CE	On-Demand	Bother	CACNA1D	47	35
Cc1ccccc1[C@@H](O)CNCCC(=O)Nc1ccccc1	ZINC000819066026	CF	On-Demand	Anodyne	ADRB2	26	40
Cc1ccccc1[C@@H](O)CNCCC(=O)Nc1ccccc1	ZINC000819066026	CF	On-Demand	Anodyne	ADRB3	40	39
Cc1ccccc1[C@@H](O)CNCCC(=O)Nc1ccccc1	ZINC000819066026	CF	On-Demand	Anodyne	LTA4H	21	40
O[C@@H](CNCc1ccnc(OC2CCOCC2)c1)c1ccc(Cl)cc1	ZINC000819066030	FG	On-Demand	Anodyne	MAPK1	51	38
OC1CCN(Cc2ccc(CNC[C@H](O)c3cc(F)ccc3F)cc2)CC1	ZINC000819066033	GF	On-Demand	Anodyne	SIGMAR1	26	45
OC1CCN(Cc2ccc(CNC[C@H](O)c3cc(F)ccc3F)cc2)CC1	ZINC000819066033	GF	On-Demand	Anodyne	CCR3	26	42
OC1CCN(Cc2ccc(CNC[C@@H](O)c3cc(F)ccc3F)cc2)CC1	ZINC000819066034	GF	On-Demand	Anodyne	SIGMAR1	26	45
OC1CCN(Cc2ccc(CNC[C@@H](O)c3cc(F)ccc3F)cc2)CC1	ZINC000819066034	GF	On-Demand	Anodyne	CCR3	26	42
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccc(F)c(F)c3)cc2)CC1	ZINC000819066035	GF	On-Demand	Anodyne	SIGMAR1	19	43
OC1CCN(Cc2ccc(CNC[C@@H](O)c3ccc(F)c(F)c3)cc2)CC1	ZINC000819066036	GF	On-Demand	Anodyne	SIGMAR1	19	43
O[C@H](CNCc1ccnc(OC2CCOCC2)c1)c1cc(F)ccc1F	ZINC000819066053	FF	On-Demand	Anodyne	MAPK1	41	33
O[C@@H](CNCc1ccnc(OC2CCOCC2)c1)c1cc(F)ccc1F	ZINC000819066054	FF	On-Demand	Anodyne	MAPK1	41	33
O=C(CCNCC1(O)CCCCC1)Nc1ccccc1	ZINC000819066060	CE	On-Demand	Anodyne	LTA4H	16	40
CN(C)c1ccc(NC(=O)CCNCCC(=O)Nc2ccccc2)cc1	ZINC000819066061	FF	On-Demand	Anodyne	LTA4H	44	44
CN(C)c1ccc(NC(=O)CCNCCC(=O)Nc2ccccc2)cc1	ZINC000819066061	FF	On-Demand	Anodyne	HDAC10	21	51
CN(C)c1ccc(NC(=O)CCNCCC(=O)Nc2ccccc2)cc1	ZINC000819066061	FF	On-Demand	Anodyne	HDAC2	18	51
CN(C)c1ccc(NC(=O)CCNCCC(=O)Nc2ccccc2)cc1	ZINC000819066061	FF	On-Demand	Anodyne	HDAC3	17	46
CN(C)c1ccc(NC(=O)CCNCCC(=O)Nc2ccccc2)cc1	ZINC000819066061	FF	On-Demand	Anodyne	HDAC6	17	51
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccc(F)cc3F)cc2)CC1	ZINC000819066064	GF	On-Demand	Anodyne	SIGMAR1	25	45
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccc(F)cc3F)cc2)CC1	ZINC000819066064	GF	On-Demand	Anodyne	CCR3	27	42
OC1CCN(Cc2ccc(CNC[C@@H](O)c3ccc(F)cc3F)cc2)CC1	ZINC000819066065	GF	On-Demand	Anodyne	SIGMAR1	25	45
OC1CCN(Cc2ccc(CNC[C@@H](O)c3ccc(F)cc3F)cc2)CC1	ZINC000819066065	GF	On-Demand	Anodyne	CCR3	27	42
OC1CCN(Cc2ccc(CNC[C@H](O)c3ccccc3F)cc2)CC1	ZINC000819066090	FF	On-Demand	Anodyne	SIGMAR1	38	45
OC1CCN(Cc2ccc(CNC[C@@H](O)c3ccccc3F)cc2)CC1	ZINC000819066091	FF	On-Demand	Anodyne	SIGMAR1	38	45
OC1CCN(Cc2ccc(CNC[C@H](O)c3c(F)cccc3F)cc2)CC1	ZINC000819066106	GF	On-Demand	Anodyne	SIGMAR1	29	42
OC1CCN(Cc2ccc(CNC[C@@H](O)c3c(F)cccc3F)cc2)CC1	ZINC000819066107	GF	On-Demand	Anodyne	SIGMAR1	29	42
O=C1CCC(=O)N1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819066124	CD	On-Demand	Anodyne	ADRB2	54	39
O=C1CCC(=O)N1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819066124	CD	On-Demand	Anodyne	ADRB1	60	53
O=C1CCC(=O)N1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819066124	CD	On-Demand	Anodyne	ADRB3	86	53
O=C1CCC(=O)N1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819066125	CD	On-Demand	Anodyne	ADRB2	54	39
O=C1CCC(=O)N1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819066125	CD	On-Demand	Anodyne	ADRB1	60	53
O=C1CCC(=O)N1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819066125	CD	On-Demand	Anodyne	ADRB3	86	53
C[C@H](CS(C)(=O)=O)NC[C@H](O)c1cccc2ccccc12	ZINC000819066131	DD	On-Demand	Anodyne	ADRB2	25	43
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819066135	JG	On-Demand	Bother	CACNA1D	56	34
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819066137	JG	On-Demand	Bother	CACNA1D	56	34
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCN2C(=O)CCC2=O)CC1	ZINC000819066149	FC	On-Demand	Anodyne	GPR119	33	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCN2C(=O)CCC2=O)CC1	ZINC000819066150	FC	On-Demand	Anodyne	GPR119	33	43
C[C@H](CNC[C@@H](O)c1cccc(C(F)(F)F)c1)Oc1ccccc1	ZINC000819066166	EH	On-Demand	Anodyne	ADRB3	46	43
C[C@H](CNC[C@@H](O)c1cccc(C(F)(F)F)c1)Oc1ccccc1	ZINC000819066166	EH	On-Demand	Anodyne	PDS	43	42
C[C@H](CNC[C@H](O)c1cccc(C(F)(F)F)c1)Oc1ccccc1	ZINC000819066167	EH	On-Demand	Anodyne	ADRB3	46	43
C[C@H](CNC[C@H](O)c1cccc(C(F)(F)F)c1)Oc1ccccc1	ZINC000819066167	EH	On-Demand	Anodyne	PDS	43	42
C[C@@H](CNC[C@H](O)c1cccc(C(F)(F)F)c1)Oc1ccccc1	ZINC000819066168	EH	On-Demand	Anodyne	ADRB3	46	43
C[C@@H](CNC[C@H](O)c1cccc(C(F)(F)F)c1)Oc1ccccc1	ZINC000819066168	EH	On-Demand	Anodyne	PDS	43	42
C[C@@H](CNC[C@@H](O)c1cccc(C(F)(F)F)c1)Oc1ccccc1	ZINC000819066169	EH	On-Demand	Anodyne	ADRB3	46	43
C[C@@H](CNC[C@@H](O)c1cccc(C(F)(F)F)c1)Oc1ccccc1	ZINC000819066169	EH	On-Demand	Anodyne	PDS	43	42
C[C@@H](c1cc2ccccc2o1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819066170	GJ	On-Demand	Mild	PAPA1_CARPA	48	43
C[C@H](c1cc2ccccc2o1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819066171	GJ	On-Demand	Mild	PAPA1_CARPA	48	43
C[C@@H](c1cc2ccccc2o1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819066172	GJ	On-Demand	Mild	PAPA1_CARPA	48	43
C[C@H](c1cc2ccccc2o1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819066173	GJ	On-Demand	Mild	PAPA1_CARPA	48	43
C[C@H](CS(C)(=O)=O)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819066183	DC	On-Demand	Bother	ADRB3	50	38
C[C@H](CS(C)(=O)=O)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819066186	DC	On-Demand	Bother	ADRB3	50	38
CCN(C(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)C1CC1	ZINC000819066191	FE	On-Demand	Anodyne	GPR119	19	40
CCN(C(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)C1CC1	ZINC000819066192	FE	On-Demand	Anodyne	GPR119	19	40
C[C@H](CNC[C@H](O)c1ccc(Cl)cc1)Oc1ccccc1	ZINC000819066193	DG	On-Demand	Anodyne	ADRB2	23	40
C[C@H](CNC[C@H](O)c1ccc(Cl)cc1)Oc1ccccc1	ZINC000819066193	DG	On-Demand	Anodyne	ADRB1	38	42
C[C@H](CNC[C@H](O)c1ccc(Cl)cc1)Oc1ccccc1	ZINC000819066193	DG	On-Demand	Anodyne	ADRB3	51	48
C[C@@H](CNC[C@H](O)c1ccc(Cl)cc1)Oc1ccccc1	ZINC000819066194	DG	On-Demand	Anodyne	ADRB2	23	40
C[C@@H](CNC[C@H](O)c1ccc(Cl)cc1)Oc1ccccc1	ZINC000819066194	DG	On-Demand	Anodyne	ADRB1	38	42
C[C@@H](CNC[C@H](O)c1ccc(Cl)cc1)Oc1ccccc1	ZINC000819066194	DG	On-Demand	Anodyne	ADRB3	51	48
O=C(CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)Nc1ccccc1	ZINC000819066215	FG	On-Demand	Anodyne	ADRB2	42	43
O=C(CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)Nc1ccccc1	ZINC000819066215	FG	On-Demand	Anodyne	ADRB1	65	39
O=C(CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)Nc1ccccc1	ZINC000819066215	FG	On-Demand	Anodyne	GCGR	19	41
O=C(CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)Nc1ccccc1	ZINC000819066215	FG	On-Demand	Anodyne	ADRB3	88	51
O=C(CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)Nc1ccccc1	ZINC000819066215	FG	On-Demand	Anodyne	LTA4H	29	43
O=C(CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)Nc1ccccc1	ZINC000819066215	FG	On-Demand	Anodyne	P2RY1	48	35
O=C(CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)Nc1ccccc1	ZINC000819066215	FG	On-Demand	Anodyne	EPHX2	40	36
O=C(CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)Nc1ccccc1	ZINC000819066216	FG	On-Demand	Anodyne	ADRB2	42	43
O=C(CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)Nc1ccccc1	ZINC000819066216	FG	On-Demand	Anodyne	ADRB1	65	39
O=C(CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)Nc1ccccc1	ZINC000819066216	FG	On-Demand	Anodyne	GCGR	19	41
O=C(CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)Nc1ccccc1	ZINC000819066216	FG	On-Demand	Anodyne	ADRB3	88	51
O=C(CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)Nc1ccccc1	ZINC000819066216	FG	On-Demand	Anodyne	LTA4H	29	43
O=C(CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)Nc1ccccc1	ZINC000819066216	FG	On-Demand	Anodyne	P2RY1	48	35
O=C(CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)Nc1ccccc1	ZINC000819066216	FG	On-Demand	Anodyne	EPHX2	40	36
O=C(CCNC[C@H](O)c1ccccc1C(F)(F)F)Nc1ccccc1	ZINC000819066217	FG	On-Demand	Anodyne	ADRB3	35	40
O=C(CCNC[C@@H](O)c1ccccc1C(F)(F)F)Nc1ccccc1	ZINC000819066218	FG	On-Demand	Anodyne	ADRB3	35	40
O=C(CCNC[C@H](O)c1cccc(C(F)(F)F)c1)Nc1ccccc1	ZINC000819066231	FG	On-Demand	Anodyne	ADRB2	31	40
O=C(CCNC[C@H](O)c1cccc(C(F)(F)F)c1)Nc1ccccc1	ZINC000819066231	FG	On-Demand	Anodyne	ADRB1	45	41
O=C(CCNC[C@H](O)c1cccc(C(F)(F)F)c1)Nc1ccccc1	ZINC000819066231	FG	On-Demand	Anodyne	ADRB3	75	42
O=C(CCNC[C@H](O)c1cccc(C(F)(F)F)c1)Nc1ccccc1	ZINC000819066231	FG	On-Demand	Anodyne	SLC1A1	25	43
O=C(CCNC[C@H](O)c1cccc(C(F)(F)F)c1)Nc1ccccc1	ZINC000819066231	FG	On-Demand	Anodyne	SLC1A3	18	43
O=C(CCNC[C@H](O)c1cccc(C(F)(F)F)c1)Nc1ccccc1	ZINC000819066231	FG	On-Demand	Anodyne	SLC1A2	41	43
O=C(CCNC[C@H](O)c1cccc(C(F)(F)F)c1)Nc1ccccc1	ZINC000819066231	FG	On-Demand	Anodyne	PDS	31	41
O=C(CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)Nc1ccccc1	ZINC000819066232	FG	On-Demand	Anodyne	ADRB2	31	40
O=C(CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)Nc1ccccc1	ZINC000819066232	FG	On-Demand	Anodyne	ADRB1	45	41
O=C(CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)Nc1ccccc1	ZINC000819066232	FG	On-Demand	Anodyne	ADRB3	75	42
O=C(CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)Nc1ccccc1	ZINC000819066232	FG	On-Demand	Anodyne	SLC1A1	25	43
O=C(CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)Nc1ccccc1	ZINC000819066232	FG	On-Demand	Anodyne	SLC1A3	18	43
O=C(CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)Nc1ccccc1	ZINC000819066232	FG	On-Demand	Anodyne	SLC1A2	41	43
O=C(CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)Nc1ccccc1	ZINC000819066232	FG	On-Demand	Anodyne	PDS	31	41
CC[C@@H]1CCCCN1CCNC[C@H](O)c1cccnc1	ZINC000819066246	CD	On-Demand	Anodyne	ADRB2	30	44
CC[C@@H]1CCCCN1CCNC[C@H](O)c1cccnc1	ZINC000819066246	CD	On-Demand	Anodyne	ADRB1	33	45
CC[C@@H]1CCCCN1CCNC[C@H](O)c1cccnc1	ZINC000819066246	CD	On-Demand	Anodyne	ADRB3	111	51
CC[C@H]1CCCCN1CCNC[C@H](O)c1cccnc1	ZINC000819066247	CD	On-Demand	Anodyne	ADRB2	30	44
CC[C@H]1CCCCN1CCNC[C@H](O)c1cccnc1	ZINC000819066247	CD	On-Demand	Anodyne	ADRB1	33	45
CC[C@H]1CCCCN1CCNC[C@H](O)c1cccnc1	ZINC000819066247	CD	On-Demand	Anodyne	ADRB3	111	51
CC[C@@H]1CCCCN1CCNC[C@@H](O)c1cccnc1	ZINC000819066248	CD	On-Demand	Anodyne	ADRB2	30	44
CC[C@@H]1CCCCN1CCNC[C@@H](O)c1cccnc1	ZINC000819066248	CD	On-Demand	Anodyne	ADRB1	33	45
CC[C@@H]1CCCCN1CCNC[C@@H](O)c1cccnc1	ZINC000819066248	CD	On-Demand	Anodyne	ADRB3	111	51
CC[C@H]1CCCCN1CCNC[C@@H](O)c1cccnc1	ZINC000819066249	CD	On-Demand	Anodyne	ADRB2	30	44
CC[C@H]1CCCCN1CCNC[C@@H](O)c1cccnc1	ZINC000819066249	CD	On-Demand	Anodyne	ADRB1	33	45
CC[C@H]1CCCCN1CCNC[C@@H](O)c1cccnc1	ZINC000819066249	CD	On-Demand	Anodyne	ADRB3	111	51
OC1CCN(Cc2ccc(CNC[C@@H](O)C3CC3)cc2)CC1	ZINC000819066252	DD	On-Demand	Anodyne	SIGMAR1	26	45
OC1CCN(Cc2ccc(CNC[C@H](O)C3CC3)cc2)CC1	ZINC000819066253	DD	On-Demand	Anodyne	SIGMAR1	26	45
O[C@H](CNCc1ccnc(OC2CCOCC2)c1)c1cccc(F)c1	ZINC000819066276	EF	On-Demand	Anodyne	MAPK1	45	42
O[C@@H](CNCc1ccnc(OC2CCOCC2)c1)c1cccc(F)c1	ZINC000819066277	EF	On-Demand	Anodyne	MAPK1	45	42
CN(CCO)S(=O)(=O)c1ccccc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819066284	GD	On-Demand	Anodyne	ADRB1	31	42
CN(CCO)S(=O)(=O)c1ccccc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819066284	GD	On-Demand	Anodyne	ADRB3	49	42
CN(CCO)S(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819066285	GD	On-Demand	Anodyne	ADRB1	31	42
CN(CCO)S(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819066285	GD	On-Demand	Anodyne	ADRB3	49	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2CCSCC2)CC1	ZINC000819066307	FF	On-Demand	Anodyne	GPR119	30	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2CCSCC2)CC1	ZINC000819066308	FF	On-Demand	Anodyne	GPR119	30	42
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cc(C)ccc2Cl)c1	ZINC000819066325	GH	On-Demand	Mild	PDS	45	34
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cc(C)ccc2Cl)c1	ZINC000819066326	GH	On-Demand	Mild	PDS	45	34
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2cc(C)ccc2Cl)c1	ZINC000819066327	GH	On-Demand	Mild	PDS	45	34
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2cc(C)ccc2Cl)c1	ZINC000819066328	GH	On-Demand	Mild	PDS	45	34
COc1ccc(C(=O)N2CCOCC2)cc1NCC[C@@H]1CC1(Cl)Cl	ZINC000819066337	FG	On-Demand	Anodyne	LRRK2	36	52
COc1ccc(C(=O)N2CCOCC2)cc1NCC[C@H]1CC1(Cl)Cl	ZINC000819066338	FG	On-Demand	Anodyne	LRRK2	36	52
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)C(F)(F)F)c1	ZINC000819066343	DE	On-Demand	Mild	PDS	57	36
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)C(F)(F)F)c1	ZINC000819066344	DE	On-Demand	Mild	PDS	57	36
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)C(F)(F)F)c1	ZINC000819066345	DE	On-Demand	Mild	PDS	57	36
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)C(F)(F)F)c1	ZINC000819066346	DE	On-Demand	Mild	PDS	57	36
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)Cc2ccc(C(F)(F)F)cc2)c1	ZINC000819066357	GI	On-Demand	Mild	CTSD	16	41
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)Cc2ccc(C(F)(F)F)cc2)c1	ZINC000819066357	GI	On-Demand	Mild	PDS	57	38
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)c1	ZINC000819066358	GI	On-Demand	Mild	CTSD	16	41
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)c1	ZINC000819066358	GI	On-Demand	Mild	PDS	57	38
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)c1	ZINC000819066359	GI	On-Demand	Mild	CTSD	16	41
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)c1	ZINC000819066359	GI	On-Demand	Mild	PDS	57	38
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)Cc2ccc(C(F)(F)F)cc2)c1	ZINC000819066360	GI	On-Demand	Mild	CTSD	16	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)Cc2ccc(C(F)(F)F)cc2)c1	ZINC000819066360	GI	On-Demand	Mild	PDS	57	38
Cc1cc([C@@H]2CCCN2C(=O)c2coc(=O)c3ccccc23)no1	ZINC000819066363	DG	On-Demand	Anodyne	KCNA5	15	46
Cc1cc([C@@H]2CCCN2C(=O)c2coc(=O)c3ccccc23)no1	ZINC000819066363	DG	On-Demand	Anodyne	CPT1A	51	39
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)[C@H](C)c2ccccc2)c1	ZINC000819066379	EH	On-Demand	Mild	CTSD	17	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)[C@H](C)c2ccccc2)c1	ZINC000819066379	EH	On-Demand	Mild	BACE1	32	42
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)[C@H](C)c2ccccc2)c1	ZINC000819066379	EH	On-Demand	Mild	PDS	44	37
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)[C@@H](C)c2ccccc2)c1	ZINC000819066380	EH	On-Demand	Mild	CTSD	17	41
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)[C@@H](C)c2ccccc2)c1	ZINC000819066380	EH	On-Demand	Mild	BACE1	32	42
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)[C@@H](C)c2ccccc2)c1	ZINC000819066380	EH	On-Demand	Mild	PDS	44	37
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)[C@H](C)c2ccccc2)c1	ZINC000819066381	EH	On-Demand	Mild	CTSD	17	41
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)[C@H](C)c2ccccc2)c1	ZINC000819066381	EH	On-Demand	Mild	BACE1	32	42
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)[C@H](C)c2ccccc2)c1	ZINC000819066381	EH	On-Demand	Mild	PDS	44	37
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)[C@@H](C)c2ccccc2)c1	ZINC000819066382	EH	On-Demand	Mild	CTSD	17	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)[C@@H](C)c2ccccc2)c1	ZINC000819066382	EH	On-Demand	Mild	BACE1	32	42
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)[C@@H](C)c2ccccc2)c1	ZINC000819066382	EH	On-Demand	Mild	PDS	44	37
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819066387	GF	On-Demand	Mild	PDS	45	35
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819066388	GF	On-Demand	Mild	PDS	45	35
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819066389	GF	On-Demand	Mild	PDS	45	35
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819066390	GF	On-Demand	Mild	PDS	45	35
O=C(COC(=O)Cn1cnc2sccc2c1=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819066393	JC	On-Demand	Anodyne	TGM2	51	35
O=C(COC(=O)Cn1cnc2sccc2c1=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819066393	JC	On-Demand	Anodyne	F13A1	59	35
O=C(COC(=O)Cn1cnc2sccc2c1=O)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819066393	JC	On-Demand	Anodyne	NAMPT	22	41
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000819066407	FG	On-Demand	Mild	ADRB2	42	41
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000819066407	FG	On-Demand	Mild	ADRB1	70	41
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000819066407	FG	On-Demand	Mild	ADRB3	39	41
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000819066407	FG	On-Demand	Mild	PDS	59	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000819066408	FG	On-Demand	Mild	ADRB2	42	41
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000819066408	FG	On-Demand	Mild	ADRB1	70	41
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000819066408	FG	On-Demand	Mild	ADRB3	39	41
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000819066408	FG	On-Demand	Mild	PDS	59	40
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(F)cc2)c1	ZINC000819066409	FG	On-Demand	Mild	ADRB2	42	41
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(F)cc2)c1	ZINC000819066409	FG	On-Demand	Mild	ADRB1	70	41
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(F)cc2)c1	ZINC000819066409	FG	On-Demand	Mild	ADRB3	39	41
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(F)cc2)c1	ZINC000819066409	FG	On-Demand	Mild	PDS	59	40
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(F)cc2)c1	ZINC000819066410	FG	On-Demand	Mild	ADRB2	42	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(F)cc2)c1	ZINC000819066410	FG	On-Demand	Mild	ADRB1	70	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(F)cc2)c1	ZINC000819066410	FG	On-Demand	Mild	ADRB3	39	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(F)cc2)c1	ZINC000819066410	FG	On-Demand	Mild	PDS	59	40
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(COc2ccc3c(C)cc(=O)oc3c2)cc1	ZINC000819066470	JJ	On-Demand	Anodyne	MAOA	59	43
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(COc2ccc3c(C)cc(=O)oc3c2)cc1	ZINC000819066470	JJ	On-Demand	Anodyne	MAOB	54	52
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(COc2ccc3c(C)cc(=O)oc3c2)cc1	ZINC000819066472	JJ	On-Demand	Anodyne	MAOA	59	43
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(COc2ccc3c(C)cc(=O)oc3c2)cc1	ZINC000819066472	JJ	On-Demand	Anodyne	MAOB	54	52
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)CCc2ccccc2)c1	ZINC000819066529	EG	On-Demand	Mild	BACE1	21	41
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)CCc2ccccc2)c1	ZINC000819066529	EG	On-Demand	Mild	PDS	49	36
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)CCc2ccccc2)c1	ZINC000819066530	EG	On-Demand	Mild	BACE1	21	41
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)CCc2ccccc2)c1	ZINC000819066530	EG	On-Demand	Mild	PDS	49	36
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)CCc2ccccc2)c1	ZINC000819066531	EG	On-Demand	Mild	BACE1	21	41
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)CCc2ccccc2)c1	ZINC000819066531	EG	On-Demand	Mild	PDS	49	36
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)CCc2ccccc2)c1	ZINC000819066532	EG	On-Demand	Mild	BACE1	21	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)CCc2ccccc2)c1	ZINC000819066532	EG	On-Demand	Mild	PDS	49	36
Cc1cc([C@@H]2CCCN2C(=O)CCc2cccc(OC(F)F)c2)no1	ZINC000819066536	FH	On-Demand	Anodyne	CPT1A	115	49
CS(=O)(=O)Nc1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819066538	CE	On-Demand	Anodyne	KCNK3	58	33
CS(=O)(=O)Nc1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819066538	CE	On-Demand	Anodyne	KCNK9	43	33
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819066558	GI	On-Demand	Mild	PDS	47	36
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819066559	GI	On-Demand	Mild	PDS	47	36
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819066560	GI	On-Demand	Mild	PDS	47	36
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819066561	GI	On-Demand	Mild	PDS	47	36
C[C@@H]1CCCC[C@H]1C(=O)N(C)Cc1ccc(Cl)nc1	ZINC000819066567	CH	On-Demand	Anodyne	Q8WSF8_APLCA	38	45
C[C@@H]1CCCC[C@H]1C(=O)N(C)Cc1ccc(Cl)nc1	ZINC000819066567	CH	On-Demand	Anodyne	NACHRBETA2	41	45
C[C@@H]1CCCC[C@@H]1C(=O)N(C)Cc1ccc(Cl)nc1	ZINC000819066569	CH	On-Demand	Anodyne	Q8WSF8_APLCA	38	45
C[C@@H]1CCCC[C@@H]1C(=O)N(C)Cc1ccc(Cl)nc1	ZINC000819066569	CH	On-Demand	Anodyne	NACHRBETA2	41	45
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc3ccccc23)c1	ZINC000819066572	GI	On-Demand	Mild	ADRB2	34	52
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc3ccccc23)c1	ZINC000819066572	GI	On-Demand	Mild	ADRB1	62	38
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc3ccccc23)c1	ZINC000819066572	GI	On-Demand	Mild	ADRB3	22	47
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc3ccccc23)c1	ZINC000819066572	GI	On-Demand	Mild	CASR	44	40
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc3ccccc23)c1	ZINC000819066572	GI	On-Demand	Mild	CYP2D6	20	40
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc3ccccc23)c1	ZINC000819066572	GI	On-Demand	Mild	PDS	53	37
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc3ccccc23)c1	ZINC000819066573	GI	On-Demand	Mild	ADRB2	34	52
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc3ccccc23)c1	ZINC000819066573	GI	On-Demand	Mild	ADRB1	62	38
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc3ccccc23)c1	ZINC000819066573	GI	On-Demand	Mild	ADRB3	22	47
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc3ccccc23)c1	ZINC000819066573	GI	On-Demand	Mild	CASR	44	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc3ccccc23)c1	ZINC000819066573	GI	On-Demand	Mild	CYP2D6	20	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc3ccccc23)c1	ZINC000819066573	GI	On-Demand	Mild	PDS	53	37
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc3ccccc23)c1	ZINC000819066574	GI	On-Demand	Mild	ADRB2	34	52
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc3ccccc23)c1	ZINC000819066574	GI	On-Demand	Mild	ADRB1	62	38
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc3ccccc23)c1	ZINC000819066574	GI	On-Demand	Mild	ADRB3	22	47
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc3ccccc23)c1	ZINC000819066574	GI	On-Demand	Mild	CASR	44	40
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc3ccccc23)c1	ZINC000819066574	GI	On-Demand	Mild	CYP2D6	20	40
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc3ccccc23)c1	ZINC000819066574	GI	On-Demand	Mild	PDS	53	37
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc3ccccc23)c1	ZINC000819066575	GI	On-Demand	Mild	ADRB2	34	52
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc3ccccc23)c1	ZINC000819066575	GI	On-Demand	Mild	ADRB1	62	38
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc3ccccc23)c1	ZINC000819066575	GI	On-Demand	Mild	ADRB3	22	47
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc3ccccc23)c1	ZINC000819066575	GI	On-Demand	Mild	CASR	44	40
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc3ccccc23)c1	ZINC000819066575	GI	On-Demand	Mild	CYP2D6	20	40
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc3ccccc23)c1	ZINC000819066575	GI	On-Demand	Mild	PDS	53	37
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819066576	EG	On-Demand	Mild	PDS	44	36
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819066577	EG	On-Demand	Mild	PDS	44	36
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819066578	EG	On-Demand	Mild	PDS	44	36
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819066579	EG	On-Demand	Mild	PDS	44	36
CC[C@H](C#N)Oc1cccc(CNCCC(N)=O)c1	ZINC000819066612	CD	On-Demand	Mild	DPP7	18	42
CC[C@H](C#N)Oc1cccc(CNCCC(N)=O)c1	ZINC000819066612	CD	On-Demand	Mild	PDS	43	36
CC[C@@H](C#N)Oc1cccc(CNCCC(N)=O)c1	ZINC000819066613	CD	On-Demand	Mild	DPP7	18	42
CC[C@@H](C#N)Oc1cccc(CNCCC(N)=O)c1	ZINC000819066613	CD	On-Demand	Mild	PDS	43	36
C=C(C)C(C)(C)C(=O)N(C)Cc1ccc(Cl)nc1	ZINC000819066620	CG	On-Demand	Mild	Q8WSF8_APLCA	22	52
C=C(C)C(C)(C)C(=O)N(C)Cc1ccc(Cl)nc1	ZINC000819066620	CG	On-Demand	Mild	NACHRBETA2	31	52
CC[C@H](C#N)Oc1cccc(CNCCC(=O)Nc2ccc(Cl)cc2)c1	ZINC000819066621	FI	On-Demand	Mild	PDS	58	34
CC[C@@H](C#N)Oc1cccc(CNCCC(=O)Nc2ccc(Cl)cc2)c1	ZINC000819066622	FI	On-Demand	Mild	PDS	58	34
COc1ccc(C(=O)N2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819066623	EE	On-Demand	Anodyne	L3MBTL3	47	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccnc1-n1ccnc1)C2	ZINC000819066625	FD	On-Demand	Anodyne	NOS2	84	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccnc1-n1ccnc1)C2	ZINC000819066626	FD	On-Demand	Anodyne	NOS2	84	34
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@H]1CCCN(c2ccccc2)C1=O	ZINC000819066634	GD	On-Demand	Anodyne	SFRP1	47	32
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@@H]1CCCN(c2ccccc2)C1=O	ZINC000819066635	GD	On-Demand	Anodyne	SFRP1	47	32
O=C1[C@H](NC[C@H](O)c2ccc(Cl)cc2)CCCN1c1ccccc1	ZINC000819066667	EG	On-Demand	Anodyne	ADRB3	21	40
O=C1[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CCCN1c1ccccc1	ZINC000819066668	EG	On-Demand	Anodyne	ADRB3	21	40
O[C@@H](CNCCc1csc(N2CCCC2)n1)c1cccc(C(F)(F)F)c1	ZINC000819066669	GH	On-Demand	Anodyne	ADRB3	47	40
O[C@H](CNCCc1csc(N2CCCC2)n1)c1cccc(C(F)(F)F)c1	ZINC000819066670	GH	On-Demand	Anodyne	ADRB3	47	40
C[C@H](CC(=O)NCc1cccnc1-n1ccnc1)n1cccn1	ZINC000819066678	DD	On-Demand	Anodyne	NOS2	78	33
C[C@@H](CC(=O)NCc1cccnc1-n1ccnc1)n1cccn1	ZINC000819066679	DD	On-Demand	Anodyne	NOS2	78	33
O=C(Cc1cccs1)Nc1ccccc1NCC[C@@H]1CC1(Cl)Cl	ZINC000819066692	FJ	On-Demand	Anodyne	CA5B	46	47
O=C(Cc1cccs1)Nc1ccccc1NCC[C@@H]1CC1(Cl)Cl	ZINC000819066692	FJ	On-Demand	Anodyne	CA5A	48	47
O=C(Cc1cccs1)Nc1ccccc1NCC[C@H]1CC1(Cl)Cl	ZINC000819066693	FJ	On-Demand	Anodyne	CA5B	46	47
O=C(Cc1cccs1)Nc1ccccc1NCC[C@H]1CC1(Cl)Cl	ZINC000819066693	FJ	On-Demand	Anodyne	CA5A	48	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2coc3ccccc23)CC1	ZINC000819066694	FH	On-Demand	Anodyne	CCR8	30	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2coc3ccccc23)CC1	ZINC000819066694	FH	On-Demand	Anodyne	GPR119	42	51
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2coc3ccccc23)CC1	ZINC000819066695	FH	On-Demand	Anodyne	CCR8	30	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2coc3ccccc23)CC1	ZINC000819066695	FH	On-Demand	Anodyne	GPR119	42	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccnc1-n1ccnc1	ZINC000819066718	FD	On-Demand	Anodyne	NOS2	47	31
CC[C@H](C#N)Oc1cc(CNC[C@@H](O)c2cccnc2)ccc1OC	ZINC000819066780	EF	On-Demand	Mild	ADRB2	25	41
CC[C@H](C#N)Oc1cc(CNC[C@@H](O)c2cccnc2)ccc1OC	ZINC000819066780	EF	On-Demand	Mild	ADRB1	26	44
CC[C@H](C#N)Oc1cc(CNC[C@@H](O)c2cccnc2)ccc1OC	ZINC000819066780	EF	On-Demand	Mild	ADRB3	88	44
CC[C@H](C#N)Oc1cc(CNC[C@H](O)c2cccnc2)ccc1OC	ZINC000819066784	EF	On-Demand	Mild	ADRB2	25	41
CC[C@H](C#N)Oc1cc(CNC[C@H](O)c2cccnc2)ccc1OC	ZINC000819066784	EF	On-Demand	Mild	ADRB1	26	44
CC[C@H](C#N)Oc1cc(CNC[C@H](O)c2cccnc2)ccc1OC	ZINC000819066784	EF	On-Demand	Mild	ADRB3	88	44
CON(C)C(=O)CCNCCc1ccc(F)cc1Cl	ZINC000819066794	CE	On-Demand	Anodyne	P2RX7	50	40
Cc1cc([C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@H]2C)no1	ZINC000819066815	CG	On-Demand	Anodyne	CPT1A	41	40
Cc1cc([C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@@H]2C)no1	ZINC000819066816	CG	On-Demand	Anodyne	CPT1A	41	40
Cc1cc([C@@H]2CCCN2C(=O)[C@H]2CCCC[C@@H]2C)no1	ZINC000819066817	CG	On-Demand	Anodyne	CPT1A	41	40
Cc1cc([C@@H]2CCCN2C(=O)[C@H]2CCCC[C@H]2C)no1	ZINC000819066818	CG	On-Demand	Anodyne	CPT1A	41	40
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819066833	FH	On-Demand	Mild	ADRB1	18	40
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819066833	FH	On-Demand	Mild	ADRB3	19	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819066835	FH	On-Demand	Mild	ADRB1	18	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819066835	FH	On-Demand	Mild	ADRB3	19	40
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819066837	FH	On-Demand	Mild	ADRB1	18	40
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819066837	FH	On-Demand	Mild	ADRB3	19	40
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819066838	FH	On-Demand	Mild	ADRB1	18	40
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819066838	FH	On-Demand	Mild	ADRB3	19	40
CCCc1ccc(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819066904	FF	On-Demand	Anodyne	CA2	32	48
CCCc1ccc(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819066904	FF	On-Demand	Anodyne	CA1	30	48
CCCc1ccc(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819066904	FF	On-Demand	Anodyne	CA7	23	40
CCCc1ccc(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819066904	FF	On-Demand	Anodyne	TRPV1	15	44
CCCc1ccc(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819066904	FF	On-Demand	Anodyne	CA4	24	48
CCCc1ccc(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819066904	FF	On-Demand	Anodyne	CA14	20	40
CCCc1ccc(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819066904	FF	On-Demand	Anodyne	GHSR	26	43
CCCc1ccc(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819066904	FF	On-Demand	Anodyne	CA12	20	40
CC[C@H](O)CNCc1cccc(O[C@H](C#N)CC)c1	ZINC000819066915	CE	On-Demand	Mild	PDS	43	35
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)CC)c1	ZINC000819066916	CE	On-Demand	Mild	PDS	43	35
CC[C@H](O)CNCc1cccc(O[C@@H](C#N)CC)c1	ZINC000819066917	CE	On-Demand	Mild	PDS	43	35
CC[C@@H](O)CNCc1cccc(O[C@@H](C#N)CC)c1	ZINC000819066918	CE	On-Demand	Mild	PDS	43	35
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066936	GH	On-Demand	Anodyne	DRD4	19	47
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066936	GH	On-Demand	Anodyne	ADRB3	21	40
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066936	GH	On-Demand	Anodyne	SIGMAR1	21	46
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066936	GH	On-Demand	Anodyne	CCR3	33	42
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066936	GH	On-Demand	Anodyne	MLNR	42	42
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066936	GH	On-Demand	Anodyne	CCR2	31	47
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066936	GH	On-Demand	Anodyne	SLC6A5	28	40
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066936	GH	On-Demand	Anodyne	MCHR1	32	43
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066937	GH	On-Demand	Anodyne	DRD4	19	47
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066937	GH	On-Demand	Anodyne	ADRB3	21	40
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066937	GH	On-Demand	Anodyne	SIGMAR1	21	46
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066937	GH	On-Demand	Anodyne	CCR3	33	42
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066937	GH	On-Demand	Anodyne	MLNR	42	42
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066937	GH	On-Demand	Anodyne	CCR2	31	47
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066937	GH	On-Demand	Anodyne	SLC6A5	28	40
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066937	GH	On-Demand	Anodyne	MCHR1	32	43
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066938	GH	On-Demand	Anodyne	DRD4	19	47
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066938	GH	On-Demand	Anodyne	ADRB3	21	40
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066938	GH	On-Demand	Anodyne	SIGMAR1	21	46
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066938	GH	On-Demand	Anodyne	CCR3	33	42
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066938	GH	On-Demand	Anodyne	MLNR	42	42
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066938	GH	On-Demand	Anodyne	CCR2	31	47
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066938	GH	On-Demand	Anodyne	SLC6A5	28	40
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066938	GH	On-Demand	Anodyne	MCHR1	32	43
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066939	GH	On-Demand	Anodyne	DRD4	19	47
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066939	GH	On-Demand	Anodyne	ADRB3	21	40
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066939	GH	On-Demand	Anodyne	SIGMAR1	21	46
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066939	GH	On-Demand	Anodyne	CCR3	33	42
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066939	GH	On-Demand	Anodyne	MLNR	42	42
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066939	GH	On-Demand	Anodyne	CCR2	31	47
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066939	GH	On-Demand	Anodyne	SLC6A5	28	40
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819066939	GH	On-Demand	Anodyne	MCHR1	32	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(C)(C)c2cccs2)CC1	ZINC000819066953	GH	On-Demand	Anodyne	GPR119	40	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(C)(C)c2cccs2)CC1	ZINC000819066954	GH	On-Demand	Anodyne	GPR119	40	46
C#CCNC(=O)CCN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819066955	FE	On-Demand	Mild	DRD4	21	52
C#CCNC(=O)CCN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819066955	FE	On-Demand	Mild	SIGMAR1	21	51
C#CCNC(=O)CCN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819066955	FE	On-Demand	Mild	CCR3	22	40
C#CCNC(=O)CCN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819066955	FE	On-Demand	Mild	MLNR	36	45
C#CCNC(=O)CCN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819066955	FE	On-Demand	Mild	CCR2	35	48
C#CCNC(=O)CCN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819066955	FE	On-Demand	Mild	SLC6A5	33	44
C#CCNC(=O)CCN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819066955	FE	On-Demand	Mild	MCHR1	47	42
C#CCNC(=O)CCN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819066955	FE	On-Demand	Mild	CACNA1G	36	41
C#CCNC(=O)CCN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819066956	FE	On-Demand	Mild	DRD4	21	52
C#CCNC(=O)CCN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819066956	FE	On-Demand	Mild	SIGMAR1	21	51
C#CCNC(=O)CCN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819066956	FE	On-Demand	Mild	CCR3	22	40
C#CCNC(=O)CCN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819066956	FE	On-Demand	Mild	MLNR	36	45
C#CCNC(=O)CCN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819066956	FE	On-Demand	Mild	CCR2	35	48
C#CCNC(=O)CCN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819066956	FE	On-Demand	Mild	SLC6A5	33	44
C#CCNC(=O)CCN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819066956	FE	On-Demand	Mild	MCHR1	47	42
C#CCNC(=O)CCN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819066956	FE	On-Demand	Mild	CACNA1G	36	41
O[C@@H](CNCCc1csc(N2CCCC2)n1)c1ccc(C(F)(F)F)cc1	ZINC000819066962	GH	On-Demand	Anodyne	ADRB3	19	42
O[C@H](CNCCc1csc(N2CCCC2)n1)c1ccc(C(F)(F)F)cc1	ZINC000819066963	GH	On-Demand	Anodyne	ADRB3	19	42
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2Cl)CCCN1c1ccccc1	ZINC000819066971	FG	On-Demand	Anodyne	P2RX7	29	44
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)CCCN1c1ccccc1	ZINC000819066972	FG	On-Demand	Anodyne	P2RX7	29	44
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)CCCN1c1ccccc1	ZINC000819066973	FG	On-Demand	Anodyne	P2RX7	29	44
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)CCCN1c1ccccc1	ZINC000819066974	FG	On-Demand	Anodyne	P2RX7	29	44
COC(=O)CCCCCCNC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819066978	FE	On-Demand	Anodyne	EPHX2	15	44
COC(=O)CCCCCCNC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819066979	FE	On-Demand	Anodyne	EPHX2	15	44
CON(C)C(=O)CCN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819067013	FE	On-Demand	Anodyne	DRD4	25	52
CON(C)C(=O)CCN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819067013	FE	On-Demand	Anodyne	SIGMAR1	22	48
CON(C)C(=O)CCN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819067013	FE	On-Demand	Anodyne	SSTR5	40	41
CON(C)C(=O)CCN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819067013	FE	On-Demand	Anodyne	CCR3	22	40
CON(C)C(=O)CCN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819067013	FE	On-Demand	Anodyne	UTS2R	19	42
CON(C)C(=O)CCN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819067013	FE	On-Demand	Anodyne	MLNR	37	43
CON(C)C(=O)CCN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819067013	FE	On-Demand	Anodyne	CCR2	24	46
CON(C)C(=O)CCN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819067013	FE	On-Demand	Anodyne	SLC6A5	35	46
CON(C)C(=O)CCN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819067013	FE	On-Demand	Anodyne	MCHR1	59	43
CON(C)C(=O)CCN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819067014	FE	On-Demand	Anodyne	DRD4	25	52
CON(C)C(=O)CCN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819067014	FE	On-Demand	Anodyne	SIGMAR1	22	48
CON(C)C(=O)CCN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819067014	FE	On-Demand	Anodyne	SSTR5	40	41
CON(C)C(=O)CCN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819067014	FE	On-Demand	Anodyne	CCR3	22	40
CON(C)C(=O)CCN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819067014	FE	On-Demand	Anodyne	UTS2R	19	42
CON(C)C(=O)CCN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819067014	FE	On-Demand	Anodyne	MLNR	37	43
CON(C)C(=O)CCN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819067014	FE	On-Demand	Anodyne	CCR2	24	46
CON(C)C(=O)CCN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819067014	FE	On-Demand	Anodyne	SLC6A5	35	46
CON(C)C(=O)CCN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819067014	FE	On-Demand	Anodyne	MCHR1	59	43
CCCCC[C@@H](C)NC(=O)C[C@@H](C)n1cccn1	ZINC000819067017	CF	On-Demand	Anodyne	NOD1	50	34
CCCCC[C@@H](C)NC(=O)C[C@H](C)n1cccn1	ZINC000819067018	CF	On-Demand	Anodyne	NOD1	50	34
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000819067032	FF	On-Demand	Mild	ADRB2	37	40
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000819067032	FF	On-Demand	Mild	ADRB1	65	40
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000819067032	FF	On-Demand	Mild	ADRB3	35	40
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000819067032	FF	On-Demand	Mild	PDS	53	43
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000819067033	FF	On-Demand	Mild	ADRB2	37	40
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000819067033	FF	On-Demand	Mild	ADRB1	65	40
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000819067033	FF	On-Demand	Mild	ADRB3	35	40
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000819067033	FF	On-Demand	Mild	PDS	53	43
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000819067034	FF	On-Demand	Mild	ADRB2	37	40
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000819067034	FF	On-Demand	Mild	ADRB1	65	40
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000819067034	FF	On-Demand	Mild	ADRB3	35	40
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000819067034	FF	On-Demand	Mild	PDS	53	43
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000819067035	FF	On-Demand	Mild	ADRB2	37	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000819067035	FF	On-Demand	Mild	ADRB1	65	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000819067035	FF	On-Demand	Mild	ADRB3	35	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000819067035	FF	On-Demand	Mild	PDS	53	43
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000819067078	FH	On-Demand	Mild	PDS	64	40
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000819067079	FH	On-Demand	Mild	PDS	64	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000819067080	FH	On-Demand	Mild	PDS	64	40
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000819067081	FH	On-Demand	Mild	PDS	64	40
CN(Cc1ccc(Cl)nc1)C(=O)/C=C/[C@H]1CCCO1	ZINC000819067100	CE	On-Demand	Anodyne	NACHRBETA2	24	41
CN(Cc1ccc(Cl)nc1)C(=O)/C=C\[C@@H]1CCCO1	ZINC000819067101	CE	On-Demand	Anodyne	NACHRBETA2	24	41
CN(Cc1ccc(Cl)nc1)C(=O)/C=C/[C@@H]1CCCO1	ZINC000819067102	CE	On-Demand	Anodyne	NACHRBETA2	24	41
CN(Cc1ccc(Cl)nc1)C(=O)/C=C\[C@H]1CCCO1	ZINC000819067103	CE	On-Demand	Anodyne	NACHRBETA2	24	41
C[C@@H](CC(=O)N(C)Cc1ccc(Cl)nc1)n1cccn1	ZINC000819067105	CF	On-Demand	Anodyne	Q8WSF8_APLCA	39	45
C[C@@H](CC(=O)N(C)Cc1ccc(Cl)nc1)n1cccn1	ZINC000819067105	CF	On-Demand	Anodyne	NACHRBETA2	50	45
O=C(Nc1cccc(NC(=O)C2CC2)c1)C(F)=C1CCC1	ZINC000819067122	CG	On-Demand	Anodyne	TYK2	45	38
O=C(Nc1cccc(NC(=O)C2CC2)c1)C(F)=C1CCC1	ZINC000819067122	CG	On-Demand	Anodyne	KCNK3	34	50
CC(=O)Nc1cccc(CC(=O)NCCCCCCC(C)C)c1	ZINC000819067138	DH	On-Demand	Anodyne	MMP3	24	47
CC(=O)Nc1cccc(CC(=O)NCCCCCCC(C)C)c1	ZINC000819067138	DH	On-Demand	Anodyne	GRIA1	50	34
CC(=O)Nc1cccc(CC(=O)NCCCCCCC(C)C)c1	ZINC000819067138	DH	On-Demand	Anodyne	HDAC3	15	40
CC(=O)Nc1cccc(CC(=O)NCCCCCCC(C)C)c1	ZINC000819067138	DH	On-Demand	Anodyne	KISS1R	45	31
CC(=O)Nc1cccc(CC(=O)NCCCCCCC(C)C)c1	ZINC000819067138	DH	On-Demand	Anodyne	KCNK3	41	31
COC(=O)CCCCCCNC(=O)c1cnc(OC)c(Br)c1	ZINC000819067146	FF	On-Demand	Anodyne	HDAC3	18	42
COC(=O)CCCCCCNC(=O)c1cnc(OC)c(Br)c1	ZINC000819067146	FF	On-Demand	Anodyne	HDAC9	16	42
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067202	GH	On-Demand	Anodyne	DRD4	20	52
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067202	GH	On-Demand	Anodyne	SIGMAR1	28	51
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067202	GH	On-Demand	Anodyne	MLNR	28	41
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067202	GH	On-Demand	Anodyne	CCR2	26	43
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067202	GH	On-Demand	Anodyne	SLC6A5	29	43
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067202	GH	On-Demand	Anodyne	MCHR1	30	40
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067205	GH	On-Demand	Anodyne	DRD4	20	52
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067205	GH	On-Demand	Anodyne	SIGMAR1	28	51
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067205	GH	On-Demand	Anodyne	MLNR	28	41
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067205	GH	On-Demand	Anodyne	CCR2	26	43
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067205	GH	On-Demand	Anodyne	SLC6A5	29	43
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067205	GH	On-Demand	Anodyne	MCHR1	30	40
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067207	GH	On-Demand	Anodyne	DRD4	20	52
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067207	GH	On-Demand	Anodyne	SIGMAR1	28	51
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067207	GH	On-Demand	Anodyne	MLNR	28	41
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067207	GH	On-Demand	Anodyne	CCR2	26	43
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067207	GH	On-Demand	Anodyne	SLC6A5	29	43
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067207	GH	On-Demand	Anodyne	MCHR1	30	40
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067209	GH	On-Demand	Anodyne	DRD4	20	52
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067209	GH	On-Demand	Anodyne	SIGMAR1	28	51
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067209	GH	On-Demand	Anodyne	MLNR	28	41
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067209	GH	On-Demand	Anodyne	CCR2	26	43
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067209	GH	On-Demand	Anodyne	SLC6A5	29	43
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1F	ZINC000819067209	GH	On-Demand	Anodyne	MCHR1	30	40
Cn1cc([C@@H]2CCN(C(=O)Nc3ccccc3CC(=O)O)C2)cn1	ZINC000819067213	EE	On-Demand	Anodyne	EPHX2	17	41
Cn1cc([C@@H]2CCN(C(=O)Nc3ccccc3CC(=O)O)C2)cn1	ZINC000819067213	EE	On-Demand	Anodyne	RBP4	60	38
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cn1	ZINC000819067239	GG	On-Demand	Anodyne	SIGMAR1	15	43
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cn1	ZINC000819067239	GG	On-Demand	Anodyne	CCR2	18	43
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cn1	ZINC000819067242	GG	On-Demand	Anodyne	SIGMAR1	15	43
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cn1	ZINC000819067242	GG	On-Demand	Anodyne	CCR2	18	43
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cn1	ZINC000819067245	GG	On-Demand	Anodyne	SIGMAR1	15	43
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cn1	ZINC000819067245	GG	On-Demand	Anodyne	CCR2	18	43
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cn1	ZINC000819067247	GG	On-Demand	Anodyne	SIGMAR1	15	43
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cn1	ZINC000819067247	GG	On-Demand	Anodyne	CCR2	18	43
Cn1cc([C@@H](O)CNC(=O)Nc2cccc(CC(=O)O)c2)cn1	ZINC000819067312	DC	On-Demand	Anodyne	ADRB2	42	36
Cn1cc([C@@H](O)CNC(=O)Nc2cccc(CC(=O)O)c2)cn1	ZINC000819067312	DC	On-Demand	Anodyne	CCKBR	15	43
Cn1cc([C@@]2(C)CN(C(=O)Nc3cccc(CC(=O)O)c3)CCO2)cn1	ZINC000819067313	FD	On-Demand	Anodyne	P2RY14	43	34
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCc1ccc(F)cc1Cl	ZINC000819067334	FF	On-Demand	Anodyne	P2RX7	41	38
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCc1ccc(F)cc1Cl	ZINC000819067335	FF	On-Demand	Anodyne	P2RX7	41	38
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCCN1c1ccccc1	ZINC000819067372	DD	On-Demand	Anodyne	ADRB2	16	43
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCCN1c1ccccc1	ZINC000819067372	DD	On-Demand	Anodyne	ADRB1	21	41
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCCN1c1ccccc1	ZINC000819067372	DD	On-Demand	Anodyne	ADRB3	75	45
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCCN1c1ccccc1	ZINC000819067375	DD	On-Demand	Anodyne	ADRB2	16	43
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCCN1c1ccccc1	ZINC000819067375	DD	On-Demand	Anodyne	ADRB1	21	41
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCCN1c1ccccc1	ZINC000819067375	DD	On-Demand	Anodyne	ADRB3	75	45
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCCN1c1ccccc1	ZINC000819067377	DD	On-Demand	Anodyne	ADRB2	16	43
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCCN1c1ccccc1	ZINC000819067377	DD	On-Demand	Anodyne	ADRB1	21	41
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCCN1c1ccccc1	ZINC000819067377	DD	On-Demand	Anodyne	ADRB3	75	45
O=C1[C@H](NC[C@H](O)c2cccnc2)CCCN1c1ccccc1	ZINC000819067379	DD	On-Demand	Anodyne	ADRB2	16	43
O=C1[C@H](NC[C@H](O)c2cccnc2)CCCN1c1ccccc1	ZINC000819067379	DD	On-Demand	Anodyne	ADRB1	21	41
O=C1[C@H](NC[C@H](O)c2cccnc2)CCCN1c1ccccc1	ZINC000819067379	DD	On-Demand	Anodyne	ADRB3	75	45
O[C@@H](CNCCc1csc(N2CCCC2)n1)c1cccc(Cl)c1	ZINC000819067381	FG	On-Demand	Anodyne	ADRB1	45	48
O[C@@H](CNCCc1csc(N2CCCC2)n1)c1cccc(Cl)c1	ZINC000819067381	FG	On-Demand	Anodyne	ADRB3	85	48
O[C@@H](CNCCc1csc(N2CCCC2)n1)c1cccc(Cl)c1	ZINC000819067381	FG	On-Demand	Anodyne	CYP3A4	45	35
O[C@H](CNCCc1csc(N2CCCC2)n1)c1cccc(Cl)c1	ZINC000819067383	FG	On-Demand	Anodyne	ADRB1	45	48
O[C@H](CNCCc1csc(N2CCCC2)n1)c1cccc(Cl)c1	ZINC000819067383	FG	On-Demand	Anodyne	ADRB3	85	48
O[C@H](CNCCc1csc(N2CCCC2)n1)c1cccc(Cl)c1	ZINC000819067383	FG	On-Demand	Anodyne	CYP3A4	45	35
Cn1cc(CN2CCCN(C(=O)Nc3cccc(CC(=O)O)c3)CC2)cn1	ZINC000819067387	FD	On-Demand	Anodyne	HRH2	41	36
Cn1cc(CN2CCCN(C(=O)Nc3cccc(CC(=O)O)c3)CC2)cn1	ZINC000819067387	FD	On-Demand	Anodyne	FAAH	30	50
Cn1cc(CN2CCCN(C(=O)Nc3cccc(CC(=O)O)c3)CC2)cn1	ZINC000819067387	FD	On-Demand	Anodyne	MCHR1	15	41
Cn1cc(CN2CCCN(C(=O)Nc3cccc(CC(=O)O)c3)CC2)cn1	ZINC000819067387	FD	On-Demand	Anodyne	P2RY14	46	35
Cn1cc([C@H](NC(=O)Nc2cccc(CC(=O)O)c2)C(C)(C)C)cn1	ZINC000819067402	EF	On-Demand	Anodyne	CCKBR	16	42
Cn1cc([C@@H](NC(=O)Nc2cccc(CC(=O)O)c2)C(C)(C)C)cn1	ZINC000819067403	EF	On-Demand	Anodyne	CCKBR	16	42
Cn1cc(/C=C\C(=O)N(CC(=O)O)c2ccc3c(c2)OCO3)cn1	ZINC000819067406	ED	On-Demand	Clean	DYRK2	42	32
Cn1cc(/C=C/C(=O)N(CC(=O)O)c2ccc3c(c2)OCO3)cn1	ZINC000819067407	ED	On-Demand	Clean	DYRK2	42	32
Cn1cc(CN2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)cn1	ZINC000819067410	FD	On-Demand	Anodyne	CCR3	17	40
Cn1cc(CN2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)cn1	ZINC000819067410	FD	On-Demand	Anodyne	FAAH	30	46
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819067427	EG	On-Demand	Mild	ADRB1	16	40
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819067427	EG	On-Demand	Mild	ADRB3	18	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819067428	EG	On-Demand	Mild	ADRB1	16	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819067428	EG	On-Demand	Mild	ADRB3	18	40
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819067429	EG	On-Demand	Mild	ADRB1	16	40
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819067429	EG	On-Demand	Mild	ADRB3	18	40
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819067430	EG	On-Demand	Mild	ADRB1	16	40
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819067430	EG	On-Demand	Mild	ADRB3	18	40
O=C1CCc2cc(OC[C@@H](O)CNCCOc3cccnc3)ccc2N1	ZINC000819067508	FD	On-Demand	Anodyne	ADRB2	32	45
O=C1CCc2cc(OC[C@@H](O)CNCCOc3cccnc3)ccc2N1	ZINC000819067508	FD	On-Demand	Anodyne	ADRB1	59	45
O=C1CCc2cc(OC[C@@H](O)CNCCOc3cccnc3)ccc2N1	ZINC000819067508	FD	On-Demand	Anodyne	ADRB3	42	45
O=C1CCc2cc(OC[C@H](O)CNCCOc3cccnc3)ccc2N1	ZINC000819067510	FD	On-Demand	Anodyne	ADRB2	32	45
O=C1CCc2cc(OC[C@H](O)CNCCOc3cccnc3)ccc2N1	ZINC000819067510	FD	On-Demand	Anodyne	ADRB1	59	45
O=C1CCc2cc(OC[C@H](O)CNCCOc3cccnc3)ccc2N1	ZINC000819067510	FD	On-Demand	Anodyne	ADRB3	42	45
O=C1c2ccccc2C(=O)N1C[C@H](O)CNCCOc1cccnc1	ZINC000819067514	EC	On-Demand	Anodyne	ADRB2	21	45
O=C1c2ccccc2C(=O)N1C[C@H](O)CNCCOc1cccnc1	ZINC000819067514	EC	On-Demand	Anodyne	ADRB1	36	45
O=C1c2ccccc2C(=O)N1C[C@H](O)CNCCOc1cccnc1	ZINC000819067514	EC	On-Demand	Anodyne	ADRB3	41	46
O=C1c2ccccc2C(=O)N1C[C@@H](O)CNCCOc1cccnc1	ZINC000819067516	EC	On-Demand	Anodyne	ADRB2	21	45
O=C1c2ccccc2C(=O)N1C[C@@H](O)CNCCOc1cccnc1	ZINC000819067516	EC	On-Demand	Anodyne	ADRB1	36	45
O=C1c2ccccc2C(=O)N1C[C@@H](O)CNCCOc1cccnc1	ZINC000819067516	EC	On-Demand	Anodyne	ADRB3	41	46
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819067520	DG	On-Demand	Mild	ADRB3	41	41
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819067520	DG	On-Demand	Mild	BACE1	20	40
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819067520	DG	On-Demand	Mild	PDS	58	37
O[C@H](CNCCOc1cccnc1)COc1cc(Cl)ccc1Cl	ZINC000819067528	FF	On-Demand	Anodyne	ADRB2	32	51
O[C@H](CNCCOc1cccnc1)COc1cc(Cl)ccc1Cl	ZINC000819067528	FF	On-Demand	Anodyne	ADRB1	62	51
O[C@H](CNCCOc1cccnc1)COc1cc(Cl)ccc1Cl	ZINC000819067528	FF	On-Demand	Anodyne	ADRB3	37	51
O[C@@H](CNCCOc1cccnc1)COc1cc(Cl)ccc1Cl	ZINC000819067530	FF	On-Demand	Anodyne	ADRB2	32	51
O[C@@H](CNCCOc1cccnc1)COc1cc(Cl)ccc1Cl	ZINC000819067530	FF	On-Demand	Anodyne	ADRB1	62	51
O[C@@H](CNCCOc1cccnc1)COc1cc(Cl)ccc1Cl	ZINC000819067530	FF	On-Demand	Anodyne	ADRB3	37	51
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819067532	DG	On-Demand	Mild	ADRB3	41	41
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819067532	DG	On-Demand	Mild	BACE1	20	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819067532	DG	On-Demand	Mild	PDS	58	37
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819067535	DG	On-Demand	Mild	ADRB3	41	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819067535	DG	On-Demand	Mild	BACE1	20	40
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819067535	DG	On-Demand	Mild	PDS	58	37
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819067538	DG	On-Demand	Mild	ADRB3	41	41
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819067538	DG	On-Demand	Mild	BACE1	20	40
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819067538	DG	On-Demand	Mild	PDS	58	37
CN(C[C@H](O)CNCCOc1cccnc1)C(=O)OC(C)(C)C	ZINC000819067539	ED	On-Demand	Anodyne	ADRB1	22	41
CN(C[C@H](O)CNCCOc1cccnc1)C(=O)OC(C)(C)C	ZINC000819067539	ED	On-Demand	Anodyne	ADRB3	23	46
CN(C[C@@H](O)CNCCOc1cccnc1)C(=O)OC(C)(C)C	ZINC000819067542	ED	On-Demand	Anodyne	ADRB1	22	41
CN(C[C@@H](O)CNCCOc1cccnc1)C(=O)OC(C)(C)C	ZINC000819067542	ED	On-Demand	Anodyne	ADRB3	23	46
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1ccc(F)c(F)c1	ZINC000819067545	DF	On-Demand	Anodyne	ADRB2	26	41
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1ccc(F)c(F)c1	ZINC000819067545	DF	On-Demand	Anodyne	ADRB1	24	41
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1ccc(F)c(F)c1	ZINC000819067545	DF	On-Demand	Anodyne	ADRB3	42	41
O[C@H](CNCCc1ccc2c(c1)CCO2)c1ccc(F)c(F)c1	ZINC000819067547	DF	On-Demand	Anodyne	ADRB2	26	41
O[C@H](CNCCc1ccc2c(c1)CCO2)c1ccc(F)c(F)c1	ZINC000819067547	DF	On-Demand	Anodyne	ADRB1	24	41
O[C@H](CNCCc1ccc2c(c1)CCO2)c1ccc(F)c(F)c1	ZINC000819067547	DF	On-Demand	Anodyne	ADRB3	42	41
CC(C)(C)NC(=O)c1cccc(NCC[C@@H]2CC2(Cl)Cl)c1	ZINC000819067551	EI	On-Demand	Anodyne	KCNK3	51	33
CC(C)(C)NC(=O)c1cccc(NCC[C@H]2CC2(Cl)Cl)c1	ZINC000819067553	EI	On-Demand	Anodyne	KCNK3	51	33
COC(=O)c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1C	ZINC000819067556	GG	On-Demand	Mild	PAPA1_CARPA	47	46
COC(=O)c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1C	ZINC000819067559	GG	On-Demand	Mild	PAPA1_CARPA	47	46
O[C@@H](CNCCOc1cccnc1)c1ccccc1F	ZINC000819067561	CD	On-Demand	Anodyne	ADRB2	23	48
O[C@@H](CNCCOc1cccnc1)c1ccccc1F	ZINC000819067561	CD	On-Demand	Anodyne	ADRB1	32	48
O[C@@H](CNCCOc1cccnc1)c1ccccc1F	ZINC000819067561	CD	On-Demand	Anodyne	ADRB3	58	50
O[C@H](CNCCOc1cccnc1)c1ccccc1F	ZINC000819067564	CD	On-Demand	Anodyne	ADRB2	23	48
O[C@H](CNCCOc1cccnc1)c1ccccc1F	ZINC000819067564	CD	On-Demand	Anodyne	ADRB1	32	48
O[C@H](CNCCOc1cccnc1)c1ccccc1F	ZINC000819067564	CD	On-Demand	Anodyne	ADRB3	58	50
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1ccc(Br)cc1	ZINC000819067565	FG	On-Demand	Anodyne	ADRB2	26	50
O[C@H](CNCCc1ccc2c(c1)CCO2)c1ccc(Br)cc1	ZINC000819067568	FG	On-Demand	Anodyne	ADRB2	26	50
O=C(CCNCCOc1cccnc1)Nc1ccc(Cl)cc1	ZINC000819067573	DF	On-Demand	Anodyne	ADRB1	18	42
O=C(CCNCCOc1cccnc1)Nc1ccc(Cl)cc1	ZINC000819067573	DF	On-Demand	Anodyne	ADRB3	29	42
O=C(CCNCCOc1cccnc1)Nc1ccc(Cl)cc1	ZINC000819067573	DF	On-Demand	Anodyne	TBXAS1	26	44
O=C(CCNCCOc1cccnc1)Nc1ccc(Cl)cc1	ZINC000819067573	DF	On-Demand	Anodyne	CHRNA7	18	46
O=C(CCNCCOc1cccnc1)Nc1ccc(Cl)cc1	ZINC000819067573	DF	On-Demand	Anodyne	NAMPT	24	47
O[C@@H](CNCCOc1cccnc1)c1ccccc1	ZINC000819067577	CD	On-Demand	Anodyne	ADRB2	46	62
O[C@@H](CNCCOc1cccnc1)c1ccccc1	ZINC000819067577	CD	On-Demand	Anodyne	ADRB1	67	62
O[C@@H](CNCCOc1cccnc1)c1ccccc1	ZINC000819067577	CD	On-Demand	Anodyne	ADRB3	137	63
O[C@H](CNCCOc1cccnc1)c1ccccc1	ZINC000819067578	CD	On-Demand	Anodyne	ADRB2	46	62
O[C@H](CNCCOc1cccnc1)c1ccccc1	ZINC000819067578	CD	On-Demand	Anodyne	ADRB1	67	62
O[C@H](CNCCOc1cccnc1)c1ccccc1	ZINC000819067578	CD	On-Demand	Anodyne	ADRB3	137	63
O[C@@H](CNCCOc1cccnc1)COc1ccc(Br)cc1	ZINC000819067580	FE	On-Demand	Anodyne	ADRB2	54	59
O[C@@H](CNCCOc1cccnc1)COc1ccc(Br)cc1	ZINC000819067580	FE	On-Demand	Anodyne	ADRB1	89	57
O[C@@H](CNCCOc1cccnc1)COc1ccc(Br)cc1	ZINC000819067580	FE	On-Demand	Anodyne	ADRB3	61	59
O[C@H](CNCCOc1cccnc1)COc1ccc(Br)cc1	ZINC000819067581	FE	On-Demand	Anodyne	ADRB2	54	59
O[C@H](CNCCOc1cccnc1)COc1ccc(Br)cc1	ZINC000819067581	FE	On-Demand	Anodyne	ADRB1	89	57
O[C@H](CNCCOc1cccnc1)COc1ccc(Br)cc1	ZINC000819067581	FE	On-Demand	Anodyne	ADRB3	61	59
COc1ccc(OC)c([C@H](O)CNCCc2csc(N3CCCC3)n2)c1	ZINC000819067585	GF	On-Demand	Anodyne	ADRB2	16	43
Cc1ccc(OC[C@@H](O)CNCCOc2cccnc2)c(C)c1	ZINC000819067592	DE	On-Demand	Anodyne	ADRB2	40	52
Cc1ccc(OC[C@@H](O)CNCCOc2cccnc2)c(C)c1	ZINC000819067592	DE	On-Demand	Anodyne	ADRB1	58	52
Cc1ccc(OC[C@@H](O)CNCCOc2cccnc2)c(C)c1	ZINC000819067592	DE	On-Demand	Anodyne	ADRB3	37	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2csc(N3CCCC3)n2)cc1	ZINC000819067594	GE	On-Demand	Anodyne	ADRB2	20	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2csc(N3CCCC3)n2)cc1	ZINC000819067594	GE	On-Demand	Anodyne	ADRB3	76	43
Cc1ccc(OC[C@H](O)CNCCOc2cccnc2)c(C)c1	ZINC000819067595	DE	On-Demand	Anodyne	ADRB2	40	52
Cc1ccc(OC[C@H](O)CNCCOc2cccnc2)c(C)c1	ZINC000819067595	DE	On-Demand	Anodyne	ADRB1	58	52
Cc1ccc(OC[C@H](O)CNCCOc2cccnc2)c(C)c1	ZINC000819067595	DE	On-Demand	Anodyne	ADRB3	37	44
CS(=O)(=O)c1ccc([C@H](O)CNCCc2csc(N3CCCC3)n2)cc1	ZINC000819067596	GE	On-Demand	Anodyne	ADRB2	20	40
CS(=O)(=O)c1ccc([C@H](O)CNCCc2csc(N3CCCC3)n2)cc1	ZINC000819067596	GE	On-Demand	Anodyne	ADRB3	76	43
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2cccnc2)c1	ZINC000819067597	DD	On-Demand	Bother	ADRB2	36	52
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2cccnc2)c1	ZINC000819067597	DD	On-Demand	Bother	ADRB1	53	52
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2cccnc2)c1	ZINC000819067597	DD	On-Demand	Bother	ADRB3	117	52
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2cccnc2)c1	ZINC000819067598	DD	On-Demand	Bother	ADRB2	36	52
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2cccnc2)c1	ZINC000819067598	DD	On-Demand	Bother	ADRB1	53	52
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2cccnc2)c1	ZINC000819067598	DD	On-Demand	Bother	ADRB3	117	52
C=CCC1(C(=O)NCc2cccnc2-n2ccnc2)CCOCC1	ZINC000819067618	EE	On-Demand	Mild	NOS2	70	32
CCOc1cc(CNC[C@H](O)c2ccc(F)cn2)ccc1OC	ZINC000819067628	DE	On-Demand	Anodyne	DRTS_TRYCR	44	31
CCOc1cc(CNC[C@@H](O)c2ccc(F)cn2)ccc1OC	ZINC000819067632	DE	On-Demand	Anodyne	DRTS_TRYCR	44	31
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067636	GH	On-Demand	Anodyne	DRD4	15	48
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067636	GH	On-Demand	Anodyne	SLC6A3	25	52
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067636	GH	On-Demand	Anodyne	SIGMAR1	24	52
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067636	GH	On-Demand	Anodyne	CCR3	31	44
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067636	GH	On-Demand	Anodyne	MLNR	41	44
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067636	GH	On-Demand	Anodyne	CCR2	25	48
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067636	GH	On-Demand	Anodyne	SLC6A5	29	40
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067636	GH	On-Demand	Anodyne	MCHR1	32	41
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067636	GH	On-Demand	Anodyne	CACNA1G	42	42
CCOc1cc(CNC[C@H](O)c2ccc(F)c(Br)c2)ccc1OC	ZINC000819067637	GH	On-Demand	Anodyne	DRTS_TRYCR	44	31
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067639	GH	On-Demand	Anodyne	DRD4	15	48
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067639	GH	On-Demand	Anodyne	SLC6A3	25	52
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067639	GH	On-Demand	Anodyne	SIGMAR1	24	52
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067639	GH	On-Demand	Anodyne	CCR3	31	44
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067639	GH	On-Demand	Anodyne	MLNR	41	44
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067639	GH	On-Demand	Anodyne	CCR2	25	48
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067639	GH	On-Demand	Anodyne	SLC6A5	29	40
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067639	GH	On-Demand	Anodyne	MCHR1	32	41
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067639	GH	On-Demand	Anodyne	CACNA1G	42	42
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067641	GH	On-Demand	Anodyne	DRD4	15	48
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067641	GH	On-Demand	Anodyne	SLC6A3	25	52
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067641	GH	On-Demand	Anodyne	SIGMAR1	24	52
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067641	GH	On-Demand	Anodyne	CCR3	31	44
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067641	GH	On-Demand	Anodyne	MLNR	41	44
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067641	GH	On-Demand	Anodyne	CCR2	25	48
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067641	GH	On-Demand	Anodyne	SLC6A5	29	40
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067641	GH	On-Demand	Anodyne	MCHR1	32	41
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067641	GH	On-Demand	Anodyne	CACNA1G	42	42
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067642	GH	On-Demand	Anodyne	DRD4	15	48
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067642	GH	On-Demand	Anodyne	SLC6A3	25	52
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067642	GH	On-Demand	Anodyne	SIGMAR1	24	52
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067642	GH	On-Demand	Anodyne	CCR3	31	44
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067642	GH	On-Demand	Anodyne	MLNR	41	44
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067642	GH	On-Demand	Anodyne	CCR2	25	48
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067642	GH	On-Demand	Anodyne	SLC6A5	29	40
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067642	GH	On-Demand	Anodyne	MCHR1	32	41
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819067642	GH	On-Demand	Anodyne	CACNA1G	42	42
CCOc1cc(CNC[C@@H](O)c2ccc(F)c(Br)c2)ccc1OC	ZINC000819067644	GH	On-Demand	Anodyne	DRTS_TRYCR	44	31
O=C(/C=C\[C@H]1CCCO1)NCc1cccnc1-n1ccnc1	ZINC000819067650	CD	On-Demand	Anodyne	NOS2	66	33
O=C(/C=C/[C@@H]1CCCO1)NCc1cccnc1-n1ccnc1	ZINC000819067651	CD	On-Demand	Anodyne	NOS2	66	33
O=C(/C=C\[C@@H]1CCCO1)NCc1cccnc1-n1ccnc1	ZINC000819067653	CD	On-Demand	Anodyne	NOS2	66	33
O=C(/C=C/[C@H]1CCCO1)NCc1cccnc1-n1ccnc1	ZINC000819067655	CD	On-Demand	Anodyne	NOS2	66	33
COc1cc(NCc2nc(C(F)F)no2)cc(OC)c1OC	ZINC000819067656	DF	On-Demand	Anodyne	DRTS_TRYCR	22	41
Cc1cccc(C(=O)N2CCCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c1	ZINC000819067665	EE	On-Demand	Anodyne	L3MBTL3	52	42
O[C@@H](CNCCOc1cccnc1)CC(F)(F)F	ZINC000819067666	CD	On-Demand	Anodyne	ADRB2	16	47
O[C@@H](CNCCOc1cccnc1)CC(F)(F)F	ZINC000819067666	CD	On-Demand	Anodyne	ADRB1	27	48
O[C@@H](CNCCOc1cccnc1)CC(F)(F)F	ZINC000819067666	CD	On-Demand	Anodyne	ADRB3	30	48
Cc1cccc(C(=O)N2CCCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c1	ZINC000819067669	EE	On-Demand	Anodyne	L3MBTL3	52	42
O[C@H](CNCCOc1cccnc1)CC(F)(F)F	ZINC000819067671	CD	On-Demand	Anodyne	ADRB2	16	47
O[C@H](CNCCOc1cccnc1)CC(F)(F)F	ZINC000819067671	CD	On-Demand	Anodyne	ADRB1	27	48
O[C@H](CNCCOc1cccnc1)CC(F)(F)F	ZINC000819067671	CD	On-Demand	Anodyne	ADRB3	30	48
Cc1cccc(C(=O)N2CCCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c1	ZINC000819067672	EE	On-Demand	Anodyne	L3MBTL3	52	42
Cc1cccc(C(=O)N2CCCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c1	ZINC000819067673	EE	On-Demand	Anodyne	L3MBTL3	52	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2csc(N3CCCC3)n2)c1	ZINC000819067687	FF	On-Demand	Bother	ADRB3	66	38
O=[N+]([O-])c1cccc([C@H](O)CNCCc2csc(N3CCCC3)n2)c1	ZINC000819067690	FF	On-Demand	Bother	ADRB3	66	38
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)cc1	ZINC000819067692	GG	On-Demand	Mild	CCR3	15	46
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)cc1	ZINC000819067692	GG	On-Demand	Mild	MLNR	25	41
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)cc1	ZINC000819067692	GG	On-Demand	Mild	SLC6A5	29	40
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)cc1	ZINC000819067703	GG	On-Demand	Mild	CCR3	15	46
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)cc1	ZINC000819067703	GG	On-Demand	Mild	MLNR	25	41
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)cc1	ZINC000819067703	GG	On-Demand	Mild	SLC6A5	29	40
CC(C)(C)[C@@H](O)CNCCOc1cccnc1	ZINC000819067704	BD	On-Demand	Anodyne	ADRB1	20	48
CC(C)(C)[C@@H](O)CNCCOc1cccnc1	ZINC000819067704	BD	On-Demand	Anodyne	ADRB3	30	48
N#Cc1ccc([C@H](O)CN[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)cc1	ZINC000819067705	GG	On-Demand	Mild	CCR3	15	46
N#Cc1ccc([C@H](O)CN[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)cc1	ZINC000819067705	GG	On-Demand	Mild	MLNR	25	41
N#Cc1ccc([C@H](O)CN[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)cc1	ZINC000819067705	GG	On-Demand	Mild	SLC6A5	29	40
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)cc1	ZINC000819067708	GG	On-Demand	Mild	CCR3	15	46
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)cc1	ZINC000819067708	GG	On-Demand	Mild	MLNR	25	41
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)cc1	ZINC000819067708	GG	On-Demand	Mild	SLC6A5	29	40
O[C@@H](CNCCc1csc(N2CCCC2)n1)c1ccccc1	ZINC000819067711	DF	On-Demand	Anodyne	ADRB2	23	43
O[C@@H](CNCCc1csc(N2CCCC2)n1)c1ccccc1	ZINC000819067711	DF	On-Demand	Anodyne	ADRB1	32	40
O[C@@H](CNCCc1csc(N2CCCC2)n1)c1ccccc1	ZINC000819067711	DF	On-Demand	Anodyne	ADRB3	81	45
Cn1cc(/C=C\C(=O)OCc2ccc(C(=O)O)cc2)cn1	ZINC000819067718	CD	On-Demand	Anodyne	AKR1B10	21	46
O[C@H](CNCCc1csc(N2CCCC2)n1)c1ccccc1	ZINC000819067724	DF	On-Demand	Anodyne	ADRB2	23	43
O[C@H](CNCCc1csc(N2CCCC2)n1)c1ccccc1	ZINC000819067724	DF	On-Demand	Anodyne	ADRB1	32	40
O[C@H](CNCCc1csc(N2CCCC2)n1)c1ccccc1	ZINC000819067724	DF	On-Demand	Anodyne	ADRB3	81	45
CCCCC[C@@H](C)NC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819067725	CG	On-Demand	Anodyne	INHA	24	45
CCCCC[C@@H](C)NC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819067725	CG	On-Demand	Anodyne	MMP3	24	40
CCCCC[C@@H](C)NC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819067725	CG	On-Demand	Anodyne	NOD1	41	33
Cn1cc(/C=C/C(=O)OCc2ccc(C(=O)O)cc2)cn1	ZINC000819067732	CD	On-Demand	Anodyne	AKR1B10	21	46
Cn1cc(CNCCCC(=O)O)c(-c2cccnc2)n1	ZINC000819067737	CD	On-Demand	Anodyne	TBXAS1	91	43
O[C@@H](CNCCc1csc(N2CCCC2)n1)c1ccc(F)cc1	ZINC000819067738	EF	On-Demand	Anodyne	ADRB3	27	44
O[C@H](CNCCc1csc(N2CCCC2)n1)c1ccc(F)cc1	ZINC000819067740	EF	On-Demand	Anodyne	ADRB3	27	44
O[C@@H](CNCCOc1cccnc1)COCc1ccccc1	ZINC000819067764	DD	On-Demand	Anodyne	ADRB2	43	51
O[C@@H](CNCCOc1cccnc1)COCc1ccccc1	ZINC000819067764	DD	On-Demand	Anodyne	ADRB1	69	51
O[C@@H](CNCCOc1cccnc1)COCc1ccccc1	ZINC000819067764	DD	On-Demand	Anodyne	ADRB3	61	51
CC[C@H](C#N)Oc1cc(CNC[C@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819067771	FH	On-Demand	Mild	ADRB2	15	40
CC[C@H](C#N)Oc1cc(CNC[C@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819067771	FH	On-Demand	Mild	ADRB1	29	47
CC[C@H](C#N)Oc1cc(CNC[C@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819067771	FH	On-Demand	Mild	ADRB3	44	47
CC[C@H](C#N)Oc1cc(CNC[C@@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819067772	FH	On-Demand	Mild	ADRB2	15	40
CC[C@H](C#N)Oc1cc(CNC[C@@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819067772	FH	On-Demand	Mild	ADRB1	29	47
CC[C@H](C#N)Oc1cc(CNC[C@@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819067772	FH	On-Demand	Mild	ADRB3	44	47
O[C@H](CNCCOc1cccnc1)COCc1ccccc1	ZINC000819067774	DD	On-Demand	Anodyne	ADRB2	43	51
O[C@H](CNCCOc1cccnc1)COCc1ccccc1	ZINC000819067774	DD	On-Demand	Anodyne	ADRB1	69	51
O[C@H](CNCCOc1cccnc1)COCc1ccccc1	ZINC000819067774	DD	On-Demand	Anodyne	ADRB3	61	51
C[C@@H]1CCCC[C@@H]1CCNC[C@H](O)c1cccnc1	ZINC000819067779	CF	On-Demand	Anodyne	ADRB2	28	44
C[C@@H]1CCCC[C@@H]1CCNC[C@H](O)c1cccnc1	ZINC000819067779	CF	On-Demand	Anodyne	ADRB1	33	51
C[C@@H]1CCCC[C@@H]1CCNC[C@H](O)c1cccnc1	ZINC000819067779	CF	On-Demand	Anodyne	ADRB3	111	51
C[C@@H]1CCCC[C@@H]1CCNC[C@@H](O)c1cccnc1	ZINC000819067782	CF	On-Demand	Anodyne	ADRB2	28	44
C[C@@H]1CCCC[C@@H]1CCNC[C@@H](O)c1cccnc1	ZINC000819067782	CF	On-Demand	Anodyne	ADRB1	33	51
C[C@@H]1CCCC[C@@H]1CCNC[C@@H](O)c1cccnc1	ZINC000819067782	CF	On-Demand	Anodyne	ADRB3	111	51
C[C@@H]1CCCC[C@H]1CCNC[C@@H](O)c1cccnc1	ZINC000819067785	CF	On-Demand	Anodyne	ADRB2	28	44
C[C@@H]1CCCC[C@H]1CCNC[C@@H](O)c1cccnc1	ZINC000819067785	CF	On-Demand	Anodyne	ADRB1	33	51
C[C@@H]1CCCC[C@H]1CCNC[C@@H](O)c1cccnc1	ZINC000819067785	CF	On-Demand	Anodyne	ADRB3	111	51
C[C@@H]1CCCC[C@H]1CCNC[C@H](O)c1cccnc1	ZINC000819067788	CF	On-Demand	Anodyne	ADRB2	28	44
C[C@@H]1CCCC[C@H]1CCNC[C@H](O)c1cccnc1	ZINC000819067788	CF	On-Demand	Anodyne	ADRB1	33	51
C[C@@H]1CCCC[C@H]1CCNC[C@H](O)c1cccnc1	ZINC000819067788	CF	On-Demand	Anodyne	ADRB3	111	51
O[C@@H](CNCCOc1cccnc1)COCc1ccccc1F	ZINC000819067821	DD	On-Demand	Anodyne	ADRB2	24	45
O[C@@H](CNCCOc1cccnc1)COCc1ccccc1F	ZINC000819067821	DD	On-Demand	Anodyne	ADRB1	48	45
O[C@@H](CNCCOc1cccnc1)COCc1ccccc1F	ZINC000819067821	DD	On-Demand	Anodyne	ADRB3	32	44
O[C@H](CNCCOc1cccnc1)COCc1ccccc1F	ZINC000819067827	DD	On-Demand	Anodyne	ADRB2	24	45
O[C@H](CNCCOc1cccnc1)COCc1ccccc1F	ZINC000819067827	DD	On-Demand	Anodyne	ADRB1	48	45
O[C@H](CNCCOc1cccnc1)COCc1ccccc1F	ZINC000819067827	DD	On-Demand	Anodyne	ADRB3	32	44
O=C(CCNCCOc1cccnc1)Nc1cccnc1	ZINC000819067841	CD	On-Demand	Anodyne	CHRNA7	15	41
O=C(CCNCCOc1cccnc1)Nc1cccnc1	ZINC000819067841	CD	On-Demand	Anodyne	NAMPT	18	45
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCOc2cccnc2)c1	ZINC000819067846	ED	On-Demand	Bother	ADRB2	41	50
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCOc2cccnc2)c1	ZINC000819067846	ED	On-Demand	Bother	ADRB1	70	50
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCOc2cccnc2)c1	ZINC000819067846	ED	On-Demand	Bother	ADRB3	50	50
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCOc2cccnc2)c1	ZINC000819067847	ED	On-Demand	Bother	ADRB2	41	50
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCOc2cccnc2)c1	ZINC000819067847	ED	On-Demand	Bother	ADRB1	70	50
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCOc2cccnc2)c1	ZINC000819067847	ED	On-Demand	Bother	ADRB3	50	50
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1ccc(F)cc1	ZINC000819067848	DF	On-Demand	Anodyne	ADRB2	32	47
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1ccc(F)cc1	ZINC000819067848	DF	On-Demand	Anodyne	ADRB3	47	37
O[C@H](CNCCc1ccc2c(c1)CCO2)c1ccc(F)cc1	ZINC000819067850	DF	On-Demand	Anodyne	ADRB2	32	47
O[C@H](CNCCc1ccc2c(c1)CCO2)c1ccc(F)cc1	ZINC000819067850	DF	On-Demand	Anodyne	ADRB3	47	37
Cn1cc(CNc2cccc(CC(=O)O)c2)c(-c2cccnc2)n1	ZINC000819067874	DF	On-Demand	Anodyne	NR1H3	22	43
Cn1cc(CNc2cccc(CC(=O)O)c2)c(-c2cccnc2)n1	ZINC000819067874	DF	On-Demand	Anodyne	CYP2E1	17	40
Cn1cc(CNc2cccc(CC(=O)O)c2)c(-c2cccnc2)n1	ZINC000819067874	DF	On-Demand	Anodyne	NR1H2	39	43
Cn1cc(CNCCC(=O)O)c(-c2cccnc2)n1	ZINC000819067876	CD	On-Demand	Anodyne	TBXAS1	66	40
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(NC(=O)C2CC2)c1	ZINC000819067905	DF	On-Demand	Anodyne	KCNK3	42	48
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(NC(=O)C2CC2)c1	ZINC000819067906	DF	On-Demand	Anodyne	KCNK3	42	48
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(NC(=O)C2CC2)c1	ZINC000819067907	DF	On-Demand	Anodyne	KCNK3	42	48
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(NC(=O)C2CC2)c1	ZINC000819067908	DF	On-Demand	Anodyne	KCNK3	42	48
CC[C@H](C#N)Oc1cccc(CNCCC(=O)Nc2cccc(Cl)c2)c1	ZINC000819067915	FI	On-Demand	Mild	HRH2	15	42
CC[C@H](C#N)Oc1cccc(CNCCC(=O)Nc2cccc(Cl)c2)c1	ZINC000819067915	FI	On-Demand	Mild	PDS	59	37
CC[C@@H](C#N)Oc1cccc(CNCCC(=O)Nc2cccc(Cl)c2)c1	ZINC000819067916	FI	On-Demand	Mild	HRH2	15	42
CC[C@@H](C#N)Oc1cccc(CNCCC(=O)Nc2cccc(Cl)c2)c1	ZINC000819067916	FI	On-Demand	Mild	PDS	59	37
CN(Cc1ccc(Cl)nc1)C(=O)c1cc2c(cn1)OCCO2	ZINC000819067921	DE	On-Demand	Anodyne	Q8WSF8_APLCA	20	44
CN(Cc1ccc(Cl)nc1)C(=O)c1cc2c(cn1)OCCO2	ZINC000819067921	DE	On-Demand	Anodyne	NACHRBETA2	24	44
O=C(COC(=O)Cn1cnc2sccc2c1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000819067942	ID	On-Demand	Anodyne	STAT6	54	34
O=C(C(F)=C1CCC1)N1CCCN(C(=O)c2ccccc2)CC1	ZINC000819067950	DF	On-Demand	Anodyne	MLYCD	18	41
O=C(C(F)=C1CCC1)N1CCCN(C(=O)c2ccccc2)CC1	ZINC000819067950	DF	On-Demand	Anodyne	L3MBTL3	56	38
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2)CCCN1c1ccccc1	ZINC000819067960	EF	On-Demand	Anodyne	SLC6A3	21	44
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2)CCCN1c1ccccc1	ZINC000819067961	EF	On-Demand	Anodyne	SLC6A3	21	44
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2)CCCN1c1ccccc1	ZINC000819067962	EF	On-Demand	Anodyne	SLC6A3	21	44
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2)CCCN1c1ccccc1	ZINC000819067963	EF	On-Demand	Anodyne	SLC6A3	21	44
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCOc1cccnc1	ZINC000819067972	ED	On-Demand	Bother	ADRB2	44	46
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCOc1cccnc1	ZINC000819067972	ED	On-Demand	Bother	ADRB1	71	47
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCOc1cccnc1	ZINC000819067972	ED	On-Demand	Bother	ADRB3	58	47
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCOc1cccnc1	ZINC000819067973	ED	On-Demand	Bother	ADRB2	44	46
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCOc1cccnc1	ZINC000819067973	ED	On-Demand	Bother	ADRB1	71	47
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCOc1cccnc1	ZINC000819067973	ED	On-Demand	Bother	ADRB3	58	47
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1cccnc1	ZINC000819067978	CD	On-Demand	Anodyne	ADRB2	47	51
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1cccnc1	ZINC000819067978	CD	On-Demand	Anodyne	ADRB1	53	49
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1cccnc1	ZINC000819067978	CD	On-Demand	Anodyne	ADRB3	147	52
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1cccnc1	ZINC000819067978	CD	On-Demand	Anodyne	CYP51A1	16	41
O[C@H](CNCCc1ccc2c(c1)CCO2)c1cccnc1	ZINC000819067979	CD	On-Demand	Anodyne	ADRB2	47	51
O[C@H](CNCCc1ccc2c(c1)CCO2)c1cccnc1	ZINC000819067979	CD	On-Demand	Anodyne	ADRB1	53	49
O[C@H](CNCCc1ccc2c(c1)CCO2)c1cccnc1	ZINC000819067979	CD	On-Demand	Anodyne	ADRB3	147	52
O[C@H](CNCCc1ccc2c(c1)CCO2)c1cccnc1	ZINC000819067979	CD	On-Demand	Anodyne	CYP51A1	16	41
CCOc1cc(CNCCC(=O)Nc2ccc(N(C)C)cc2)ccc1OC	ZINC000819067988	FG	On-Demand	Anodyne	MTNR1B	15	42
CCOc1cc(CNCCC(=O)Nc2ccc(N(C)C)cc2)ccc1OC	ZINC000819067988	FG	On-Demand	Anodyne	ENPP1	69	34
CCOc1cc(CNCCC(=O)Nc2ccc(N(C)C)cc2)ccc1OC	ZINC000819067988	FG	On-Demand	Anodyne	DRTS_TRYCR	49	36
O[C@@H](CNCCOc1cccnc1)c1c(F)cccc1F	ZINC000819067996	CE	On-Demand	Anodyne	ADRB2	19	49
O[C@@H](CNCCOc1cccnc1)c1c(F)cccc1F	ZINC000819067996	CE	On-Demand	Anodyne	ADRB1	27	49
O[C@@H](CNCCOc1cccnc1)c1c(F)cccc1F	ZINC000819067996	CE	On-Demand	Anodyne	ADRB3	57	51
O[C@H](CNCCOc1cccnc1)c1c(F)cccc1F	ZINC000819067997	CE	On-Demand	Anodyne	ADRB2	19	49
O[C@H](CNCCOc1cccnc1)c1c(F)cccc1F	ZINC000819067997	CE	On-Demand	Anodyne	ADRB1	27	49
O[C@H](CNCCOc1cccnc1)c1c(F)cccc1F	ZINC000819067997	CE	On-Demand	Anodyne	ADRB3	57	51
CN(CC1CCCCC1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819067999	FH	On-Demand	Mild	PAPA1_CARPA	34	43
CN(CC1CCCCC1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819067999	FH	On-Demand	Mild	CTSK	18	48
CN(CC1CCCCC1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819067999	FH	On-Demand	Mild	REN	39	41
CN(CC1CCCCC1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819068001	FH	On-Demand	Mild	PAPA1_CARPA	34	43
CN(CC1CCCCC1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819068001	FH	On-Demand	Mild	CTSK	18	48
CN(CC1CCCCC1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819068001	FH	On-Demand	Mild	REN	39	41
Cn1cc(/C=C/C(=O)N2CC[C@H](C(=O)O)C2)c(=O)n(C)c1=O	ZINC000819068002	DB	On-Demand	Anodyne	SLC6A1	47	34
Cn1cc(/C=C/C(=O)N2CC[C@H](C(=O)O)C2)c(=O)n(C)c1=O	ZINC000819068002	DB	On-Demand	Anodyne	ITGAL	38	44
N#Cc1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819068003	DD	On-Demand	Mild	ADRB2	53	55
N#Cc1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819068003	DD	On-Demand	Mild	ADRB1	91	55
N#Cc1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819068003	DD	On-Demand	Mild	ADRB3	57	55
Cn1cc(/C=C/C(=O)N2CC[C@@H](C(=O)O)C2)c(=O)n(C)c1=O	ZINC000819068004	DB	On-Demand	Anodyne	SLC6A1	47	34
Cn1cc(/C=C/C(=O)N2CC[C@@H](C(=O)O)C2)c(=O)n(C)c1=O	ZINC000819068004	DB	On-Demand	Anodyne	ITGAL	38	44
Cn1cc(/C=C\C(=O)N2CC[C@@H](C(=O)O)C2)c(=O)n(C)c1=O	ZINC000819068005	DB	On-Demand	Anodyne	SLC6A1	47	34
Cn1cc(/C=C\C(=O)N2CC[C@@H](C(=O)O)C2)c(=O)n(C)c1=O	ZINC000819068005	DB	On-Demand	Anodyne	ITGAL	38	44
Cn1cc(/C=C\C(=O)N2CC[C@H](C(=O)O)C2)c(=O)n(C)c1=O	ZINC000819068006	DB	On-Demand	Anodyne	SLC6A1	47	34
Cn1cc(/C=C\C(=O)N2CC[C@H](C(=O)O)C2)c(=O)n(C)c1=O	ZINC000819068006	DB	On-Demand	Anodyne	ITGAL	38	44
N#Cc1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819068019	DD	On-Demand	Mild	ADRB2	53	55
N#Cc1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819068019	DD	On-Demand	Mild	ADRB1	91	55
N#Cc1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819068019	DD	On-Demand	Mild	ADRB3	57	55
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819068026	GI	On-Demand	Mild	PDS	59	34
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819068029	GI	On-Demand	Mild	PDS	59	34
O[C@H](CNCCOc1cccnc1)COCc1ccco1	ZINC000819068030	CD	On-Demand	Anodyne	ADRB1	26	43
O[C@H](CNCCOc1cccnc1)COCc1ccco1	ZINC000819068030	CD	On-Demand	Anodyne	ADRB3	20	48
O[C@@H](CNCCOc1cccnc1)COCc1ccco1	ZINC000819068032	CD	On-Demand	Anodyne	ADRB1	26	43
O[C@@H](CNCCOc1cccnc1)COCc1ccco1	ZINC000819068032	CD	On-Demand	Anodyne	ADRB3	20	48
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819068033	GI	On-Demand	Mild	PDS	59	34
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000819068035	FF	On-Demand	Anodyne	PARP1	18	40
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000819068035	FF	On-Demand	Anodyne	L3MBTL3	35	41
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819068036	GI	On-Demand	Mild	PDS	59	34
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000819068038	FF	On-Demand	Anodyne	PARP1	18	40
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000819068038	FF	On-Demand	Anodyne	L3MBTL3	35	41
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000819068042	FF	On-Demand	Anodyne	PARP1	18	40
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000819068042	FF	On-Demand	Anodyne	L3MBTL3	35	41
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000819068044	FF	On-Demand	Anodyne	PARP1	18	40
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000819068044	FF	On-Demand	Anodyne	L3MBTL3	35	41
COCCc1ccc(OC[C@H](O)CNCc2cc(C)oc2C)cc1	ZINC000819068050	EF	On-Demand	Anodyne	ADRB2	47	59
COCCc1ccc(OC[C@H](O)CNCc2cc(C)oc2C)cc1	ZINC000819068050	EF	On-Demand	Anodyne	ADRB1	72	59
COCCc1ccc(OC[C@H](O)CNCc2cc(C)oc2C)cc1	ZINC000819068050	EF	On-Demand	Anodyne	GRIN1	19	42
COCCc1ccc(OC[C@H](O)CNCc2cc(C)oc2C)cc1	ZINC000819068050	EF	On-Demand	Anodyne	ADRB3	47	48
COCCc1ccc(OC[C@@H](O)CNCc2cc(C)oc2C)cc1	ZINC000819068051	EF	On-Demand	Anodyne	ADRB2	47	59
COCCc1ccc(OC[C@@H](O)CNCc2cc(C)oc2C)cc1	ZINC000819068051	EF	On-Demand	Anodyne	ADRB1	72	59
COCCc1ccc(OC[C@@H](O)CNCc2cc(C)oc2C)cc1	ZINC000819068051	EF	On-Demand	Anodyne	GRIN1	19	42
COCCc1ccc(OC[C@@H](O)CNCc2cc(C)oc2C)cc1	ZINC000819068051	EF	On-Demand	Anodyne	ADRB3	47	48
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819068054	GF	On-Demand	Mild	CTSF	52	35
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819068058	GF	On-Demand	Mild	CTSF	52	35
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819068060	GF	On-Demand	Mild	CTSF	52	35
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819068062	GF	On-Demand	Mild	CTSF	52	35
O[C@@H](CNCCOc1cccnc1)COc1cccc2ccccc12	ZINC000819068071	EF	On-Demand	Anodyne	ADRB2	53	57
O[C@@H](CNCCOc1cccnc1)COc1cccc2ccccc12	ZINC000819068071	EF	On-Demand	Anodyne	ADRB1	78	52
O[C@@H](CNCCOc1cccnc1)COc1cccc2ccccc12	ZINC000819068071	EF	On-Demand	Anodyne	ADRB3	52	52
O[C@@H](CNCCOc1cccnc1)COc1cccc2ccccc12	ZINC000819068071	EF	On-Demand	Anodyne	CYP2D6	17	43
O[C@H](CNCCOc1cccnc1)COc1cccc2ccccc12	ZINC000819068074	EF	On-Demand	Anodyne	ADRB2	53	57
O[C@H](CNCCOc1cccnc1)COc1cccc2ccccc12	ZINC000819068074	EF	On-Demand	Anodyne	ADRB1	78	52
O[C@H](CNCCOc1cccnc1)COc1cccc2ccccc12	ZINC000819068074	EF	On-Demand	Anodyne	ADRB3	52	52
O[C@H](CNCCOc1cccnc1)COc1cccc2ccccc12	ZINC000819068074	EF	On-Demand	Anodyne	CYP2D6	17	43
O[C@H](CNCCOc1cccnc1)Cn1cccn1	ZINC000819068078	CC	On-Demand	Anodyne	ADRB1	20	47
O[C@H](CNCCOc1cccnc1)Cn1cccn1	ZINC000819068078	CC	On-Demand	Anodyne	ADRB3	21	47
O[C@@H](CNCCOc1cccnc1)Cn1cccn1	ZINC000819068079	CC	On-Demand	Anodyne	ADRB1	20	47
O[C@@H](CNCCOc1cccnc1)Cn1cccn1	ZINC000819068079	CC	On-Demand	Anodyne	ADRB3	21	47
CCOC(=O)C1CCN(C(=O)COC(=O)Cn2cnc3sccc3c2=O)CC1	ZINC000819068082	HC	On-Demand	Anodyne	PTR1	45	34
Cc1cc([C@@H]2CCCN2C(=O)Cc2nsc3ccccc23)no1	ZINC000819068086	EG	On-Demand	Anodyne	CPT1A	94	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccc3c(c2)CCO3)cc1	ZINC000819068090	EE	On-Demand	Bother	ADRB3	42	36
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccc3c(c2)CCO3)cc1	ZINC000819068091	EE	On-Demand	Bother	ADRB3	42	36
CNC(=O)Cc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819068096	GF	On-Demand	Mild	PAPA1_CARPA	46	47
CNC(=O)Cc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819068096	GF	On-Demand	Mild	CTSK	17	43
CNC(=O)Cc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819068096	GF	On-Demand	Mild	HDAC8	16	46
CNC(=O)Cc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819068096	GF	On-Demand	Mild	FPR1	46	38
CNC(=O)Cc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819068103	GF	On-Demand	Mild	PAPA1_CARPA	46	47
CNC(=O)Cc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819068103	GF	On-Demand	Mild	CTSK	17	43
CNC(=O)Cc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819068103	GF	On-Demand	Mild	HDAC8	16	46
CNC(=O)Cc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819068103	GF	On-Demand	Mild	FPR1	46	38
O[C@H](CNCCOc1cccnc1)COc1ccc(Cl)cc1Cl	ZINC000819068126	FF	On-Demand	Anodyne	ADRB2	33	50
O[C@H](CNCCOc1cccnc1)COc1ccc(Cl)cc1Cl	ZINC000819068126	FF	On-Demand	Anodyne	ADRB1	61	50
O[C@H](CNCCOc1cccnc1)COc1ccc(Cl)cc1Cl	ZINC000819068126	FF	On-Demand	Anodyne	ADRB3	37	50
O[C@@H](CNCCOc1cccnc1)COc1ccc(Cl)cc1Cl	ZINC000819068128	FF	On-Demand	Anodyne	ADRB2	33	50
O[C@@H](CNCCOc1cccnc1)COc1ccc(Cl)cc1Cl	ZINC000819068128	FF	On-Demand	Anodyne	ADRB1	61	50
O[C@@H](CNCCOc1cccnc1)COc1ccc(Cl)cc1Cl	ZINC000819068128	FF	On-Demand	Anodyne	ADRB3	37	50
O[C@@H](CNCCOc1cccnc1)c1ccc(C(F)(F)F)cc1	ZINC000819068145	EF	On-Demand	Anodyne	ADRB2	27	53
O[C@@H](CNCCOc1cccnc1)c1ccc(C(F)(F)F)cc1	ZINC000819068145	EF	On-Demand	Anodyne	ADRB1	34	56
O[C@@H](CNCCOc1cccnc1)c1ccc(C(F)(F)F)cc1	ZINC000819068145	EF	On-Demand	Anodyne	ADRB3	81	56
O[C@H](CNCCOc1cccnc1)c1ccc(C(F)(F)F)cc1	ZINC000819068148	EF	On-Demand	Anodyne	ADRB2	27	53
O[C@H](CNCCOc1cccnc1)c1ccc(C(F)(F)F)cc1	ZINC000819068148	EF	On-Demand	Anodyne	ADRB1	34	56
O[C@H](CNCCOc1cccnc1)c1ccc(C(F)(F)F)cc1	ZINC000819068148	EF	On-Demand	Anodyne	ADRB3	81	56
O[C@H](CNCCOc1cccnc1)C(F)(F)F	ZINC000819068166	CC	On-Demand	Anodyne	ADRB2	17	51
O[C@H](CNCCOc1cccnc1)C(F)(F)F	ZINC000819068166	CC	On-Demand	Anodyne	ADRB1	27	52
O[C@H](CNCCOc1cccnc1)C(F)(F)F	ZINC000819068166	CC	On-Demand	Anodyne	ADRB3	49	52
O[C@@H](CNCCOc1cccnc1)C(F)(F)F	ZINC000819068169	CC	On-Demand	Anodyne	ADRB2	17	51
O[C@@H](CNCCOc1cccnc1)C(F)(F)F	ZINC000819068169	CC	On-Demand	Anodyne	ADRB1	27	52
O[C@@H](CNCCOc1cccnc1)C(F)(F)F	ZINC000819068169	CC	On-Demand	Anodyne	ADRB3	49	52
O=C(CCNCCOc1cccnc1)Nc1cccc(C(F)(F)F)c1	ZINC000819068176	FG	On-Demand	Anodyne	LCK	26	41
O=C(CCNCCOc1cccnc1)Nc1cccc(C(F)(F)F)c1	ZINC000819068176	FG	On-Demand	Anodyne	RAF1	19	41
O=C(CCNCCOc1cccnc1)Nc1cccc(C(F)(F)F)c1	ZINC000819068176	FG	On-Demand	Anodyne	KDR	19	40
O=C(CCNCCOc1cccnc1)Nc1cccc(C(F)(F)F)c1	ZINC000819068176	FG	On-Demand	Anodyne	EPHX2	18	46
O=C(CCNCCOc1cccnc1)Nc1cccc(C(F)(F)F)c1	ZINC000819068176	FG	On-Demand	Anodyne	TEK	31	40
O=C(CCNCCOc1cccnc1)Nc1cccc(C(F)(F)F)c1	ZINC000819068176	FG	On-Demand	Anodyne	BTK	24	41
O=C(CCNCCOc1cccnc1)Nc1cccc(C(F)(F)F)c1	ZINC000819068176	FG	On-Demand	Anodyne	BRAF	39	40
CCCNC(=O)c1ccc(NCC[C@H]2CC2(Cl)Cl)cc1Cl	ZINC000819068177	EI	On-Demand	Anodyne	SLC6A9	51	36
CCCNC(=O)c1ccc(NCC[C@@H]2CC2(Cl)Cl)cc1Cl	ZINC000819068179	EI	On-Demand	Anodyne	SLC6A9	51	36
CC[C@H](O)CNCCOc1cccnc1	ZINC000819068183	BC	On-Demand	Anodyne	ADRB2	29	50
CC[C@H](O)CNCCOc1cccnc1	ZINC000819068183	BC	On-Demand	Anodyne	ADRB1	45	50
CC[C@H](O)CNCCOc1cccnc1	ZINC000819068183	BC	On-Demand	Anodyne	ADRB3	48	50
CC[C@@H](O)CNCCOc1cccnc1	ZINC000819068186	BC	On-Demand	Anodyne	ADRB2	29	50
CC[C@@H](O)CNCCOc1cccnc1	ZINC000819068186	BC	On-Demand	Anodyne	ADRB1	45	50
CC[C@@H](O)CNCCOc1cccnc1	ZINC000819068186	BC	On-Demand	Anodyne	ADRB3	48	50
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2cc(C)ccc2C)c1	ZINC000819068197	FH	On-Demand	Mild	ADRB2	26	43
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2cc(C)ccc2C)c1	ZINC000819068197	FH	On-Demand	Mild	ADRB1	50	35
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cc(C)ccc2C)c1	ZINC000819068200	FH	On-Demand	Mild	ADRB2	26	43
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cc(C)ccc2C)c1	ZINC000819068200	FH	On-Demand	Mild	ADRB1	50	35
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1cccc(F)c1	ZINC000819068202	DF	On-Demand	Anodyne	ADRB2	34	40
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1cccc(F)c1	ZINC000819068202	DF	On-Demand	Anodyne	ADRB1	33	46
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1cccc(F)c1	ZINC000819068202	DF	On-Demand	Anodyne	ADRB3	72	46
COc1cc(F)c(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1OC	ZINC000819068203	GD	On-Demand	Anodyne	PTGS2	24	41
COc1cc(F)c(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1OC	ZINC000819068203	GD	On-Demand	Anodyne	TRPV1	44	45
COc1cc(F)c(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1OC	ZINC000819068203	GD	On-Demand	Anodyne	CA9	19	42
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2cc(C)ccc2C)c1	ZINC000819068204	FH	On-Demand	Mild	ADRB2	26	43
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2cc(C)ccc2C)c1	ZINC000819068204	FH	On-Demand	Mild	ADRB1	50	35
O[C@H](CNCCc1ccc2c(c1)CCO2)c1cccc(F)c1	ZINC000819068205	DF	On-Demand	Anodyne	ADRB2	34	40
O[C@H](CNCCc1ccc2c(c1)CCO2)c1cccc(F)c1	ZINC000819068205	DF	On-Demand	Anodyne	ADRB1	33	46
O[C@H](CNCCc1ccc2c(c1)CCO2)c1cccc(F)c1	ZINC000819068205	DF	On-Demand	Anodyne	ADRB3	72	46
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cc(C)ccc2C)c1	ZINC000819068206	FH	On-Demand	Mild	ADRB2	26	43
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cc(C)ccc2C)c1	ZINC000819068206	FH	On-Demand	Mild	ADRB1	50	35
O=C(NCc1cccnc1-n1ccnc1)C(F)=C1CCC1	ZINC000819068211	CE	On-Demand	Anodyne	NOS2	78	33
Cn1cc(CNCCCCCC(=O)O)c(=O)n(C)c1=O	ZINC000819068337	CB	On-Demand	Anodyne	ASAH1	41	36
Cn1cc([C@@H]2CN(C(=O)Nc3cccc(CC(=O)O)c3)CCO2)cn1	ZINC000819068345	ED	On-Demand	Anodyne	P2RY14	44	34
CC[C@H](C#N)Oc1cc(CNCCC(=O)Nc2cccnc2)ccc1OC	ZINC000819068354	FF	On-Demand	Mild	ENPP1	56	33
CONC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819068366	DE	On-Demand	Anodyne	CNR1	58	35
Cn1cc(CN2CCCN(C(=O)Nc3ccccc3CC(=O)O)CC2)cn1	ZINC000819068369	FD	On-Demand	Anodyne	FAAH	23	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CN1CCCC1)c1ccccc1)C2	ZINC000819068421	GF	On-Demand	Anodyne	CCR5	28	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CN1CCCC1)c1ccccc1)C2	ZINC000819068422	GF	On-Demand	Anodyne	CCR5	28	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CN1CCCC1)c1ccccc1)C2	ZINC000819068423	GF	On-Demand	Anodyne	CCR5	28	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CN1CCCC1)c1ccccc1)C2	ZINC000819068424	GF	On-Demand	Anodyne	CCR5	28	42
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2c2cc(C)on2)c1	ZINC000819068425	EF	On-Demand	Anodyne	CPT1A	95	47
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2c2cc(C)on2)c1	ZINC000819068426	EF	On-Demand	Anodyne	CPT1A	95	47
CN(Cc1ccc(Cl)nc1)C(=O)C(F)=C1CCC1	ZINC000819068433	CG	On-Demand	Anodyne	Q8WSF8_APLCA	33	46
CN(Cc1ccc(Cl)nc1)C(=O)C(F)=C1CCC1	ZINC000819068433	CG	On-Demand	Anodyne	NACHRBETA2	42	46
O[C@H](CNCCOc1cccnc1)COc1ccc(Cl)c(Cl)c1	ZINC000819068459	FF	On-Demand	Anodyne	ADRB2	52	59
O[C@H](CNCCOc1cccnc1)COc1ccc(Cl)c(Cl)c1	ZINC000819068459	FF	On-Demand	Anodyne	ADRB1	83	59
O[C@H](CNCCOc1cccnc1)COc1ccc(Cl)c(Cl)c1	ZINC000819068459	FF	On-Demand	Anodyne	GRIN1	29	48
O[C@H](CNCCOc1cccnc1)COc1ccc(Cl)c(Cl)c1	ZINC000819068459	FF	On-Demand	Anodyne	ADRB3	57	59
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819068460	EG	On-Demand	Mild	BACE1	23	41
O[C@@H](CNCCOc1cccnc1)COc1ccc(Cl)c(Cl)c1	ZINC000819068461	FF	On-Demand	Anodyne	ADRB2	52	59
O[C@@H](CNCCOc1cccnc1)COc1ccc(Cl)c(Cl)c1	ZINC000819068461	FF	On-Demand	Anodyne	ADRB1	83	59
O[C@@H](CNCCOc1cccnc1)COc1ccc(Cl)c(Cl)c1	ZINC000819068461	FF	On-Demand	Anodyne	GRIN1	29	48
O[C@@H](CNCCOc1cccnc1)COc1ccc(Cl)c(Cl)c1	ZINC000819068461	FF	On-Demand	Anodyne	ADRB3	57	59
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819068463	EG	On-Demand	Mild	BACE1	23	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819068465	EG	On-Demand	Mild	BACE1	23	41
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819068467	EG	On-Demand	Mild	BACE1	23	41
O[C@@H](CNCCOc1cccnc1)c1ccc(Cl)cc1	ZINC000819068474	CE	On-Demand	Anodyne	ADRB2	33	54
O[C@@H](CNCCOc1cccnc1)c1ccc(Cl)cc1	ZINC000819068474	CE	On-Demand	Anodyne	ADRB1	51	54
O[C@@H](CNCCOc1cccnc1)c1ccc(Cl)cc1	ZINC000819068474	CE	On-Demand	Anodyne	ADRB3	98	56
O[C@@H](CNCCOc1cccnc1)c1ccc(Cl)cc1	ZINC000819068474	CE	On-Demand	Anodyne	TBXAS1	15	44
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1cccc2ccccc12	ZINC000819068476	EH	On-Demand	Anodyne	ADRB2	49	36
COc1cccc([S@@](=O)CC(=O)N2CCC[C@H]2c2cc(C)on2)c1	ZINC000819068479	EE	On-Demand	Anodyne	CPT1A	113	47
COc1cccc([S@@](=O)CC(=O)N2CCC[C@@H]2c2cc(C)on2)c1	ZINC000819068483	EE	On-Demand	Anodyne	CPT1A	113	47
COc1cccc([S@](=O)CC(=O)N2CCC[C@H]2c2cc(C)on2)c1	ZINC000819068485	EE	On-Demand	Anodyne	CPT1A	113	47
COc1cccc([S@](=O)CC(=O)N2CCC[C@@H]2c2cc(C)on2)c1	ZINC000819068488	EE	On-Demand	Anodyne	CPT1A	113	47
O[C@H](CNCCOc1cccnc1)CN1CCc2ccccc2C1	ZINC000819068490	ED	On-Demand	Anodyne	ADRB1	18	42
O[C@H](CNCCOc1cccnc1)CN1CCc2ccccc2C1	ZINC000819068490	ED	On-Demand	Anodyne	ADRB3	17	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819068491	FH	On-Demand	Mild	ADRB2	28	48
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819068491	FH	On-Demand	Mild	ADRB1	58	37
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819068491	FH	On-Demand	Mild	CASR	42	43
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819068491	FH	On-Demand	Mild	CYP2D6	17	43
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819068491	FH	On-Demand	Mild	PDS	69	42
O[C@@H](CNCCOc1cccnc1)CN1CCc2ccccc2C1	ZINC000819068492	ED	On-Demand	Anodyne	ADRB1	18	42
O[C@@H](CNCCOc1cccnc1)CN1CCc2ccccc2C1	ZINC000819068492	ED	On-Demand	Anodyne	ADRB3	17	41
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819068493	FH	On-Demand	Mild	ADRB2	28	48
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819068493	FH	On-Demand	Mild	ADRB1	58	37
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819068493	FH	On-Demand	Mild	CASR	42	43
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819068493	FH	On-Demand	Mild	CYP2D6	17	43
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819068493	FH	On-Demand	Mild	PDS	69	42
O[C@H](CNCCOc1cccnc1)Cc1ccc(F)cc1	ZINC000819068494	CD	On-Demand	Anodyne	ADRB2	34	55
O[C@H](CNCCOc1cccnc1)Cc1ccc(F)cc1	ZINC000819068494	CD	On-Demand	Anodyne	ADRB1	52	55
O[C@H](CNCCOc1cccnc1)Cc1ccc(F)cc1	ZINC000819068494	CD	On-Demand	Anodyne	ADRB3	70	55
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819068495	FH	On-Demand	Mild	ADRB2	28	48
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819068495	FH	On-Demand	Mild	ADRB1	58	37
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819068495	FH	On-Demand	Mild	CASR	42	43
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819068495	FH	On-Demand	Mild	CYP2D6	17	43
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819068495	FH	On-Demand	Mild	PDS	69	42
O[C@@H](CNCCOc1cccnc1)Cc1ccc(F)cc1	ZINC000819068496	CD	On-Demand	Anodyne	ADRB2	34	55
O[C@@H](CNCCOc1cccnc1)Cc1ccc(F)cc1	ZINC000819068496	CD	On-Demand	Anodyne	ADRB1	52	55
O[C@@H](CNCCOc1cccnc1)Cc1ccc(F)cc1	ZINC000819068496	CD	On-Demand	Anodyne	ADRB3	70	55
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819068497	FH	On-Demand	Mild	ADRB2	28	48
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819068497	FH	On-Demand	Mild	ADRB1	58	37
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819068497	FH	On-Demand	Mild	CASR	42	43
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819068497	FH	On-Demand	Mild	CYP2D6	17	43
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819068497	FH	On-Demand	Mild	PDS	69	42
O[C@H](CNCCOc1cccnc1)COc1ccccc1C(F)(F)F	ZINC000819068499	FF	On-Demand	Anodyne	ADRB2	45	48
O[C@H](CNCCOc1cccnc1)COc1ccccc1C(F)(F)F	ZINC000819068499	FF	On-Demand	Anodyne	ADRB1	70	39
O[C@H](CNCCOc1cccnc1)COc1ccccc1C(F)(F)F	ZINC000819068499	FF	On-Demand	Anodyne	ADRB3	43	47
O[C@@H](CNCCOc1cccnc1)COc1ccccc1C(F)(F)F	ZINC000819068501	FF	On-Demand	Anodyne	ADRB2	45	48
O[C@@H](CNCCOc1cccnc1)COc1ccccc1C(F)(F)F	ZINC000819068501	FF	On-Demand	Anodyne	ADRB1	70	39
O[C@@H](CNCCOc1cccnc1)COc1ccccc1C(F)(F)F	ZINC000819068501	FF	On-Demand	Anodyne	ADRB3	43	47
Cc1cc([C@@H]2CCCN2C(=O)c2cc(Br)oc2C)no1	ZINC000819068502	EH	On-Demand	Anodyne	KCNA5	15	46
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C)cc2C)c1	ZINC000819068504	FH	On-Demand	Mild	ADRB2	18	41
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C)cc2C)c1	ZINC000819068504	FH	On-Demand	Mild	ADRB1	43	38
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C)cc2C)c1	ZINC000819068506	FH	On-Demand	Mild	ADRB2	18	41
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C)cc2C)c1	ZINC000819068506	FH	On-Demand	Mild	ADRB1	43	38
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C)cc2C)c1	ZINC000819068508	FH	On-Demand	Mild	ADRB2	18	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C)cc2C)c1	ZINC000819068508	FH	On-Demand	Mild	ADRB1	43	38
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C)cc2C)c1	ZINC000819068509	FH	On-Demand	Mild	ADRB2	18	41
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C)cc2C)c1	ZINC000819068509	FH	On-Demand	Mild	ADRB1	43	38
CS(=O)(=O)Nc1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819068522	DD	On-Demand	Anodyne	KCNK3	43	33
CS(=O)(=O)Nc1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819068524	DD	On-Demand	Anodyne	KCNK3	43	33
CC(=O)c1cccc(OC[C@@H](O)CNCCOc2cccnc2)c1	ZINC000819068525	ED	On-Demand	Anodyne	ADRB2	54	51
CC(=O)c1cccc(OC[C@@H](O)CNCCOc2cccnc2)c1	ZINC000819068525	ED	On-Demand	Anodyne	ADRB1	91	51
CC(=O)c1cccc(OC[C@@H](O)CNCCOc2cccnc2)c1	ZINC000819068525	ED	On-Demand	Anodyne	ADRB3	69	51
CC(=O)c1cccc(OC[C@@H](O)CNCCOc2cccnc2)c1	ZINC000819068525	ED	On-Demand	Anodyne	ABCB1	19	48
CS(=O)(=O)Nc1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819068527	DD	On-Demand	Anodyne	KCNK3	43	33
CC(=O)c1cccc(OC[C@H](O)CNCCOc2cccnc2)c1	ZINC000819068528	ED	On-Demand	Anodyne	ADRB2	54	51
CC(=O)c1cccc(OC[C@H](O)CNCCOc2cccnc2)c1	ZINC000819068528	ED	On-Demand	Anodyne	ADRB1	91	51
CC(=O)c1cccc(OC[C@H](O)CNCCOc2cccnc2)c1	ZINC000819068528	ED	On-Demand	Anodyne	ADRB3	69	51
CC(=O)c1cccc(OC[C@H](O)CNCCOc2cccnc2)c1	ZINC000819068528	ED	On-Demand	Anodyne	ABCB1	19	48
CS(=O)(=O)Nc1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819068530	DD	On-Demand	Anodyne	KCNK3	43	33
CN(C)c1ccc(NC(=O)CCNCCOc2cccnc2)cc1	ZINC000819068561	EE	On-Demand	Anodyne	ADRB3	24	43
CN(C)c1ccc(NC(=O)CCNCCOc2cccnc2)cc1	ZINC000819068561	EE	On-Demand	Anodyne	NAMPT	16	45
CN(Cc1ccc(Cl)nc1)C(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819068568	FI	On-Demand	Anodyne	Q8WSF8_APLCA	15	43
CN(Cc1ccc(Cl)nc1)C(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819068568	FI	On-Demand	Anodyne	NACHRBETA2	20	43
O[C@@H](CNCCOc1cccnc1)c1ccccc1Br	ZINC000819068569	EF	On-Demand	Anodyne	ADRB2	21	51
O[C@@H](CNCCOc1cccnc1)c1ccccc1Br	ZINC000819068569	EF	On-Demand	Anodyne	ADRB1	30	51
O[C@@H](CNCCOc1cccnc1)c1ccccc1Br	ZINC000819068569	EF	On-Demand	Anodyne	ADRB3	57	51
O[C@H](CNCCOc1cccnc1)c1ccccc1Br	ZINC000819068571	EF	On-Demand	Anodyne	ADRB2	21	51
O[C@H](CNCCOc1cccnc1)c1ccccc1Br	ZINC000819068571	EF	On-Demand	Anodyne	ADRB1	30	51
O[C@H](CNCCOc1cccnc1)c1ccccc1Br	ZINC000819068571	EF	On-Demand	Anodyne	ADRB3	57	51
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2C)c1	ZINC000819068578	FG	On-Demand	Mild	ADRB2	32	49
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2C)c1	ZINC000819068578	FG	On-Demand	Mild	ADRB1	59	38
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2C)c1	ZINC000819068578	FG	On-Demand	Mild	CASR	41	36
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2C)c1	ZINC000819068578	FG	On-Demand	Mild	ABCB1	44	39
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2C)c1	ZINC000819068578	FG	On-Demand	Mild	PDS	52	36
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2C)c1	ZINC000819068586	FG	On-Demand	Mild	ADRB2	32	49
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2C)c1	ZINC000819068586	FG	On-Demand	Mild	ADRB1	59	38
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2C)c1	ZINC000819068586	FG	On-Demand	Mild	CASR	41	36
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2C)c1	ZINC000819068586	FG	On-Demand	Mild	ABCB1	44	39
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2C)c1	ZINC000819068586	FG	On-Demand	Mild	PDS	52	36
O[C@H](CNCCOc1cccnc1)COC1CCOCC1	ZINC000819068587	CC	On-Demand	Anodyne	ADRB2	22	43
O[C@H](CNCCOc1cccnc1)COC1CCOCC1	ZINC000819068587	CC	On-Demand	Anodyne	ADRB1	41	43
O[C@H](CNCCOc1cccnc1)COC1CCOCC1	ZINC000819068587	CC	On-Demand	Anodyne	ADRB3	28	45
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2C)c1	ZINC000819068589	FG	On-Demand	Mild	ADRB2	32	49
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2C)c1	ZINC000819068589	FG	On-Demand	Mild	ADRB1	59	38
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2C)c1	ZINC000819068589	FG	On-Demand	Mild	CASR	41	36
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2C)c1	ZINC000819068589	FG	On-Demand	Mild	ABCB1	44	39
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2C)c1	ZINC000819068589	FG	On-Demand	Mild	PDS	52	36
O[C@@H](CNCCOc1cccnc1)COC1CCOCC1	ZINC000819068590	CC	On-Demand	Anodyne	ADRB2	22	43
O[C@@H](CNCCOc1cccnc1)COC1CCOCC1	ZINC000819068590	CC	On-Demand	Anodyne	ADRB1	41	43
O[C@@H](CNCCOc1cccnc1)COC1CCOCC1	ZINC000819068590	CC	On-Demand	Anodyne	ADRB3	28	45
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2C)c1	ZINC000819068592	FG	On-Demand	Mild	ADRB2	32	49
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2C)c1	ZINC000819068592	FG	On-Demand	Mild	ADRB1	59	38
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2C)c1	ZINC000819068592	FG	On-Demand	Mild	CASR	41	36
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2C)c1	ZINC000819068592	FG	On-Demand	Mild	ABCB1	44	39
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2C)c1	ZINC000819068592	FG	On-Demand	Mild	PDS	52	36
O=S(=O)(CCNCCOc1cccnc1)c1ccc(F)cc1	ZINC000819068594	DD	On-Demand	Anodyne	DRD4	15	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2ccccc2Cl)c1	ZINC000819068596	EH	On-Demand	Mild	PDS	61	38
CO[C@]1(c2nnc(CNc3ccc(OCc4ccccc4)cc3C)o2)CCOC1	ZINC000819068598	GH	On-Demand	Anodyne	ALOX5	15	44
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2ccccc2Cl)c1	ZINC000819068601	EH	On-Demand	Mild	PDS	61	38
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCOc2cccnc2)CC1	ZINC000819068612	FE	On-Demand	Anodyne	GPR119	60	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCOc2cccnc2)CC1	ZINC000819068615	FE	On-Demand	Anodyne	GPR119	60	44
O[C@H](CNCCOc1cccnc1)Cc1ccc2ccccc2c1	ZINC000819068631	DF	On-Demand	Anodyne	ADRB2	41	48
O[C@H](CNCCOc1cccnc1)Cc1ccc2ccccc2c1	ZINC000819068631	DF	On-Demand	Anodyne	ADRB1	54	46
O[C@H](CNCCOc1cccnc1)Cc1ccc2ccccc2c1	ZINC000819068631	DF	On-Demand	Anodyne	ADRB3	77	48
O[C@@H](CNCCc1csc(N2CCCC2)n1)c1cccnc1	ZINC000819068632	DE	On-Demand	Anodyne	ADRB2	30	50
O[C@@H](CNCCc1csc(N2CCCC2)n1)c1cccnc1	ZINC000819068632	DE	On-Demand	Anodyne	ADRB1	35	49
O[C@@H](CNCCc1csc(N2CCCC2)n1)c1cccnc1	ZINC000819068632	DE	On-Demand	Anodyne	ADRB3	123	52
O[C@@H](CNCCOc1cccnc1)Cc1ccc2ccccc2c1	ZINC000819068633	DF	On-Demand	Anodyne	ADRB2	41	48
O[C@@H](CNCCOc1cccnc1)Cc1ccc2ccccc2c1	ZINC000819068633	DF	On-Demand	Anodyne	ADRB1	54	46
O[C@@H](CNCCOc1cccnc1)Cc1ccc2ccccc2c1	ZINC000819068633	DF	On-Demand	Anodyne	ADRB3	77	48
O[C@H](CNCCc1csc(N2CCCC2)n1)c1cccnc1	ZINC000819068635	DE	On-Demand	Anodyne	ADRB2	30	50
O[C@H](CNCCc1csc(N2CCCC2)n1)c1cccnc1	ZINC000819068635	DE	On-Demand	Anodyne	ADRB1	35	49
O[C@H](CNCCc1csc(N2CCCC2)n1)c1cccnc1	ZINC000819068635	DE	On-Demand	Anodyne	ADRB3	123	52
O[C@@H](CNCCOc1cccnc1)c1cccc(Cl)c1	ZINC000819068636	CE	On-Demand	Anodyne	ADRB2	59	54
O[C@@H](CNCCOc1cccnc1)c1cccc(Cl)c1	ZINC000819068636	CE	On-Demand	Anodyne	ADRB1	83	54
O[C@@H](CNCCOc1cccnc1)c1cccc(Cl)c1	ZINC000819068636	CE	On-Demand	Anodyne	ADRB3	147	56
O[C@H](CNCCOc1cccnc1)c1cccc(Cl)c1	ZINC000819068639	CE	On-Demand	Anodyne	ADRB2	59	54
O[C@H](CNCCOc1cccnc1)c1cccc(Cl)c1	ZINC000819068639	CE	On-Demand	Anodyne	ADRB1	83	54
O[C@H](CNCCOc1cccnc1)c1cccc(Cl)c1	ZINC000819068639	CE	On-Demand	Anodyne	ADRB3	147	56
O[C@@H](CNCCOc1cccnc1)c1ccc(Cl)c(F)c1	ZINC000819068658	DF	On-Demand	Anodyne	ADRB2	34	49
O[C@@H](CNCCOc1cccnc1)c1ccc(Cl)c(F)c1	ZINC000819068658	DF	On-Demand	Anodyne	ADRB1	47	49
O[C@@H](CNCCOc1cccnc1)c1ccc(Cl)c(F)c1	ZINC000819068658	DF	On-Demand	Anodyne	ADRB3	86	51
O[C@H](CNCCOc1cccnc1)c1ccc(Cl)c(F)c1	ZINC000819068660	DF	On-Demand	Anodyne	ADRB2	34	49
O[C@H](CNCCOc1cccnc1)c1ccc(Cl)c(F)c1	ZINC000819068660	DF	On-Demand	Anodyne	ADRB1	47	49
O[C@H](CNCCOc1cccnc1)c1ccc(Cl)c(F)c1	ZINC000819068660	DF	On-Demand	Anodyne	ADRB3	86	51
O=C(NCc1cccnc1-n1ccnc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819068661	GG	On-Demand	Anodyne	NOS2	62	32
CCOc1cc(CNC[C@@H](O)c2cc3ccccc3o2)ccc1OC	ZINC000819068665	EH	On-Demand	Anodyne	SSTR5	39	43
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1	ZINC000819068677	EG	On-Demand	Anodyne	ADRB1	35	43
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1	ZINC000819068677	EG	On-Demand	Anodyne	ADRB3	53	45
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1	ZINC000819068677	EG	On-Demand	Anodyne	CYP3A4	50	38
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1	ZINC000819068679	EG	On-Demand	Anodyne	ADRB1	35	43
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1	ZINC000819068679	EG	On-Demand	Anodyne	ADRB3	53	45
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1	ZINC000819068679	EG	On-Demand	Anodyne	CYP3A4	50	38
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1	ZINC000819068680	EG	On-Demand	Anodyne	ADRB1	35	43
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1	ZINC000819068680	EG	On-Demand	Anodyne	ADRB3	53	45
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1	ZINC000819068680	EG	On-Demand	Anodyne	CYP3A4	50	38
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1	ZINC000819068681	EG	On-Demand	Anodyne	ADRB1	35	43
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1	ZINC000819068681	EG	On-Demand	Anodyne	ADRB3	53	45
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1	ZINC000819068681	EG	On-Demand	Anodyne	CYP3A4	50	38
COc1ccc(OC)c([C@H](O)CNCCOc2cccnc2)c1	ZINC000819068700	DD	On-Demand	Anodyne	ADRB2	29	47
COc1ccc(OC)c([C@H](O)CNCCOc2cccnc2)c1	ZINC000819068700	DD	On-Demand	Anodyne	ADRB1	39	47
COc1ccc(OC)c([C@H](O)CNCCOc2cccnc2)c1	ZINC000819068700	DD	On-Demand	Anodyne	ADRB3	45	48
O[C@@H](CNCCc1csc(N2CCCC2)n1)c1cccc(Br)c1	ZINC000819068705	GG	On-Demand	Anodyne	ADRB3	54	39
O[C@H](CNCCc1csc(N2CCCC2)n1)c1cccc(Br)c1	ZINC000819068706	GG	On-Demand	Anodyne	ADRB3	54	39
O=C1[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)CCCN1c1ccccc1	ZINC000819068707	GH	On-Demand	Anodyne	RBP4	47	37
O=C1[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)CCCN1c1ccccc1	ZINC000819068707	GH	On-Demand	Anodyne	SFRP1	45	32
O=C1[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)CCCN1c1ccccc1	ZINC000819068708	GH	On-Demand	Anodyne	RBP4	47	37
O=C1[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)CCCN1c1ccccc1	ZINC000819068708	GH	On-Demand	Anodyne	SFRP1	45	32
O=C1[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)CCCN1c1ccccc1	ZINC000819068709	GH	On-Demand	Anodyne	RBP4	47	37
O=C1[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)CCCN1c1ccccc1	ZINC000819068709	GH	On-Demand	Anodyne	SFRP1	45	32
O=C1[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)CCCN1c1ccccc1	ZINC000819068710	GH	On-Demand	Anodyne	RBP4	47	37
O=C1[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)CCCN1c1ccccc1	ZINC000819068710	GH	On-Demand	Anodyne	SFRP1	45	32
O=C(COC(=O)Cn1cnc2sccc2c1=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819068732	JD	On-Demand	Anodyne	TGM2	61	36
O=C(COC(=O)Cn1cnc2sccc2c1=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819068732	JD	On-Demand	Anodyne	F13A1	71	38
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2)c1	ZINC000819068737	EF	On-Demand	Mild	ADRB2	47	48
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2)c1	ZINC000819068737	EF	On-Demand	Mild	ADRB1	75	42
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2)c1	ZINC000819068737	EF	On-Demand	Mild	ADRB3	44	42
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2)c1	ZINC000819068737	EF	On-Demand	Mild	ABCB1	30	43
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2)c1	ZINC000819068737	EF	On-Demand	Mild	BACE1	17	41
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2)c1	ZINC000819068737	EF	On-Demand	Mild	PDS	90	45
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2)c1	ZINC000819068738	EF	On-Demand	Mild	ADRB2	47	48
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2)c1	ZINC000819068738	EF	On-Demand	Mild	ADRB1	75	42
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2)c1	ZINC000819068738	EF	On-Demand	Mild	ADRB3	44	42
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2)c1	ZINC000819068738	EF	On-Demand	Mild	ABCB1	30	43
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2)c1	ZINC000819068738	EF	On-Demand	Mild	BACE1	17	41
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2)c1	ZINC000819068738	EF	On-Demand	Mild	PDS	90	45
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2)c1	ZINC000819068739	EF	On-Demand	Mild	ADRB2	47	48
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2)c1	ZINC000819068739	EF	On-Demand	Mild	ADRB1	75	42
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2)c1	ZINC000819068739	EF	On-Demand	Mild	ADRB3	44	42
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2)c1	ZINC000819068739	EF	On-Demand	Mild	ABCB1	30	43
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2)c1	ZINC000819068739	EF	On-Demand	Mild	BACE1	17	41
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2)c1	ZINC000819068739	EF	On-Demand	Mild	PDS	90	45
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2)c1	ZINC000819068740	EF	On-Demand	Mild	ADRB2	47	48
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2)c1	ZINC000819068740	EF	On-Demand	Mild	ADRB1	75	42
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2)c1	ZINC000819068740	EF	On-Demand	Mild	ADRB3	44	42
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2)c1	ZINC000819068740	EF	On-Demand	Mild	ABCB1	30	43
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2)c1	ZINC000819068740	EF	On-Demand	Mild	BACE1	17	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2)c1	ZINC000819068740	EF	On-Demand	Mild	PDS	90	45
CC[C@H](C#N)Oc1cccc(CNCCC(=O)Nc2ccccc2)c1	ZINC000819068741	EG	On-Demand	Mild	LTA4H	29	40
CC[C@H](C#N)Oc1cccc(CNCCC(=O)Nc2ccccc2)c1	ZINC000819068741	EG	On-Demand	Mild	MTNR1B	16	42
CC[C@H](C#N)Oc1cccc(CNCCC(=O)Nc2ccccc2)c1	ZINC000819068741	EG	On-Demand	Mild	PDS	58	37
CC[C@@H](C#N)Oc1cccc(CNCCC(=O)Nc2ccccc2)c1	ZINC000819068742	EG	On-Demand	Mild	LTA4H	29	40
CC[C@@H](C#N)Oc1cccc(CNCCC(=O)Nc2ccccc2)c1	ZINC000819068742	EG	On-Demand	Mild	MTNR1B	16	42
CC[C@@H](C#N)Oc1cccc(CNCCC(=O)Nc2ccccc2)c1	ZINC000819068742	EG	On-Demand	Mild	PDS	58	37
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc3ccccc23)c1	ZINC000819068744	FI	On-Demand	Mild	PDS	46	35
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc3ccccc23)c1	ZINC000819068745	FI	On-Demand	Mild	PDS	46	35
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819068746	EH	On-Demand	Mild	ADRB3	27	41
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819068746	EH	On-Demand	Mild	PDS	53	34
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819068747	EH	On-Demand	Mild	ADRB3	27	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819068747	EH	On-Demand	Mild	PDS	53	34
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2F)c1	ZINC000819068760	FG	On-Demand	Mild	ADRB2	27	40
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2F)c1	ZINC000819068760	FG	On-Demand	Mild	ADRB1	61	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2F)c1	ZINC000819068760	FG	On-Demand	Mild	CASR	40	36
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2F)c1	ZINC000819068760	FG	On-Demand	Mild	PDS	62	37
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2F)c1	ZINC000819068762	FG	On-Demand	Mild	ADRB2	27	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2F)c1	ZINC000819068762	FG	On-Demand	Mild	ADRB1	61	41
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2F)c1	ZINC000819068762	FG	On-Demand	Mild	CASR	40	36
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2F)c1	ZINC000819068762	FG	On-Demand	Mild	PDS	62	37
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2F)c1	ZINC000819068764	FG	On-Demand	Mild	ADRB2	27	40
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2F)c1	ZINC000819068764	FG	On-Demand	Mild	ADRB1	61	41
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2F)c1	ZINC000819068764	FG	On-Demand	Mild	CASR	40	36
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccccc2F)c1	ZINC000819068764	FG	On-Demand	Mild	PDS	62	37
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2F)c1	ZINC000819068766	FG	On-Demand	Mild	ADRB2	27	40
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2F)c1	ZINC000819068766	FG	On-Demand	Mild	ADRB1	61	41
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2F)c1	ZINC000819068766	FG	On-Demand	Mild	CASR	40	36
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccccc2F)c1	ZINC000819068766	FG	On-Demand	Mild	PDS	62	37
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc(C)c2)c1	ZINC000819068767	FG	On-Demand	Mild	ADRB2	29	52
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc(C)c2)c1	ZINC000819068767	FG	On-Demand	Mild	ADRB1	39	50
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc(C)c2)c1	ZINC000819068767	FG	On-Demand	Mild	PDS	70	45
CONC(=O)CCc1cccc(OC(F)F)c1	ZINC000819068768	BD	On-Demand	Anodyne	PLA2G4A	26	41
CONC(=O)CCc1cccc(OC(F)F)c1	ZINC000819068768	BD	On-Demand	Anodyne	MTNR1A	23	43
CONC(=O)CCc1cccc(OC(F)F)c1	ZINC000819068768	BD	On-Demand	Anodyne	MTNR1B	25	43
CONC(=O)CCc1cccc(OC(F)F)c1	ZINC000819068768	BD	On-Demand	Anodyne	CRTM	55	34
NC(=O)c1ccc(N2CCCC2)c(NCC[C@@H]2CC2(Cl)Cl)c1	ZINC000819068769	EG	On-Demand	Anodyne	KCNQ2	49	33
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc(C)c2)c1	ZINC000819068770	FG	On-Demand	Mild	ADRB2	29	52
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc(C)c2)c1	ZINC000819068770	FG	On-Demand	Mild	ADRB1	39	50
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc(C)c2)c1	ZINC000819068770	FG	On-Demand	Mild	PDS	70	45
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc(C)c2)c1	ZINC000819068771	FG	On-Demand	Mild	ADRB2	29	52
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc(C)c2)c1	ZINC000819068771	FG	On-Demand	Mild	ADRB1	39	50
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc(C)c2)c1	ZINC000819068771	FG	On-Demand	Mild	PDS	70	45
NC(=O)c1ccc(N2CCCC2)c(NCC[C@H]2CC2(Cl)Cl)c1	ZINC000819068772	EG	On-Demand	Anodyne	KCNQ2	49	33
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc(C)c2)c1	ZINC000819068773	FG	On-Demand	Mild	ADRB2	29	52
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc(C)c2)c1	ZINC000819068773	FG	On-Demand	Mild	ADRB1	39	50
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc(C)c2)c1	ZINC000819068773	FG	On-Demand	Mild	PDS	70	45
COC(=O)c1cc(OC)ccc1N[C@H]1CCN(C(C)(C)C)C1=O	ZINC000819068834	DE	On-Demand	Anodyne	AKR1C2	40	35
COC(=O)c1cc(OC)ccc1N[C@@H]1CCN(C(C)(C)C)C1=O	ZINC000819068835	DE	On-Demand	Anodyne	AKR1C2	40	35
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819068843	FH	On-Demand	Mild	ADRB2	28	45
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819068843	FH	On-Demand	Mild	ADRB1	38	42
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819068843	FH	On-Demand	Mild	PDS	56	39
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819068845	FH	On-Demand	Mild	ADRB2	28	45
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819068845	FH	On-Demand	Mild	ADRB1	38	42
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819068845	FH	On-Demand	Mild	PDS	56	39
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819068847	FH	On-Demand	Mild	ADRB2	28	45
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819068847	FH	On-Demand	Mild	ADRB1	38	42
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819068847	FH	On-Demand	Mild	PDS	56	39
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819068849	FH	On-Demand	Mild	ADRB2	28	45
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819068849	FH	On-Demand	Mild	ADRB1	38	42
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819068849	FH	On-Demand	Mild	PDS	56	39
Cc1noc(C)c1[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819068855	CE	On-Demand	Anodyne	ADRB1	20	46
Cc1noc(C)c1[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819068855	CE	On-Demand	Anodyne	ADRB3	67	46
Cc1noc(C)c1[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819068858	CE	On-Demand	Anodyne	ADRB1	20	46
Cc1noc(C)c1[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819068858	CE	On-Demand	Anodyne	ADRB3	67	46
Cc1noc(C)c1[C@H](C)NC[C@@H](O)c1cccnc1	ZINC000819068860	CE	On-Demand	Anodyne	ADRB1	20	46
Cc1noc(C)c1[C@H](C)NC[C@@H](O)c1cccnc1	ZINC000819068860	CE	On-Demand	Anodyne	ADRB3	67	46
Cc1noc(C)c1[C@H](C)NC[C@H](O)c1cccnc1	ZINC000819068862	CE	On-Demand	Anodyne	ADRB1	20	46
Cc1noc(C)c1[C@H](C)NC[C@H](O)c1cccnc1	ZINC000819068862	CE	On-Demand	Anodyne	ADRB3	67	46
Cc1cc([C@@H]2CCCN2C(=O)Cc2ccc(-n3cnnc3)cc2)no1	ZINC000819068863	EE	On-Demand	Anodyne	CPT1A	68	40
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819068870	EH	On-Demand	Mild	ADRB2	18	41
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819068870	EH	On-Demand	Mild	ADRB1	40	48
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819068870	EH	On-Demand	Mild	ADRB3	53	51
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819068870	EH	On-Demand	Mild	PDS	52	37
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819068872	EH	On-Demand	Mild	ADRB2	18	41
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819068872	EH	On-Demand	Mild	ADRB1	40	48
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819068872	EH	On-Demand	Mild	ADRB3	53	51
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819068872	EH	On-Demand	Mild	PDS	52	37
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819068873	EH	On-Demand	Mild	ADRB2	18	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819068873	EH	On-Demand	Mild	ADRB1	40	48
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819068873	EH	On-Demand	Mild	ADRB3	53	51
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819068873	EH	On-Demand	Mild	PDS	52	37
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819068875	EH	On-Demand	Mild	ADRB2	18	41
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819068875	EH	On-Demand	Mild	ADRB1	40	48
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819068875	EH	On-Demand	Mild	ADRB3	53	51
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819068875	EH	On-Demand	Mild	PDS	52	37
CN(Cc1ccc(Cl)nc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819068877	GG	On-Demand	Mild	PAPA1_CARPA	51	42
CN(Cc1ccc(Cl)nc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819068877	GG	On-Demand	Mild	NACHRBETA2	17	44
CN(Cc1ccc(Cl)nc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819068879	GG	On-Demand	Mild	PAPA1_CARPA	51	42
CN(Cc1ccc(Cl)nc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819068879	GG	On-Demand	Mild	NACHRBETA2	17	44
O[C@@H](CNCCOc1cccnc1)CO[C@@H]1CCCc2ccccc21	ZINC000819068885	EF	On-Demand	Anodyne	ADRB2	21	44
O[C@@H](CNCCOc1cccnc1)CO[C@@H]1CCCc2ccccc21	ZINC000819068885	EF	On-Demand	Anodyne	ADRB1	43	44
O[C@@H](CNCCOc1cccnc1)CO[C@@H]1CCCc2ccccc21	ZINC000819068885	EF	On-Demand	Anodyne	ADRB3	29	44
O[C@@H](CNCCOc1cccnc1)CO[C@H]1CCCc2ccccc21	ZINC000819068887	EF	On-Demand	Anodyne	ADRB2	21	44
O[C@@H](CNCCOc1cccnc1)CO[C@H]1CCCc2ccccc21	ZINC000819068887	EF	On-Demand	Anodyne	ADRB1	43	44
O[C@@H](CNCCOc1cccnc1)CO[C@H]1CCCc2ccccc21	ZINC000819068887	EF	On-Demand	Anodyne	ADRB3	29	44
O[C@H](CNCCOc1cccnc1)CO[C@H]1CCCc2ccccc21	ZINC000819068889	EF	On-Demand	Anodyne	ADRB2	21	44
O[C@H](CNCCOc1cccnc1)CO[C@H]1CCCc2ccccc21	ZINC000819068889	EF	On-Demand	Anodyne	ADRB1	43	44
O[C@H](CNCCOc1cccnc1)CO[C@H]1CCCc2ccccc21	ZINC000819068889	EF	On-Demand	Anodyne	ADRB3	29	44
O[C@H](CNCCOc1cccnc1)CO[C@@H]1CCCc2ccccc21	ZINC000819068891	EF	On-Demand	Anodyne	ADRB2	21	44
O[C@H](CNCCOc1cccnc1)CO[C@@H]1CCCc2ccccc21	ZINC000819068891	EF	On-Demand	Anodyne	ADRB1	43	44
O[C@H](CNCCOc1cccnc1)CO[C@@H]1CCCc2ccccc21	ZINC000819068891	EF	On-Demand	Anodyne	ADRB3	29	44
O[C@@H](CCc1ccccc1)CNCCOc1cccnc1	ZINC000819068903	CE	On-Demand	Anodyne	ADRB2	48	53
O[C@@H](CCc1ccccc1)CNCCOc1cccnc1	ZINC000819068903	CE	On-Demand	Anodyne	ADRB1	70	53
O[C@@H](CCc1ccccc1)CNCCOc1cccnc1	ZINC000819068903	CE	On-Demand	Anodyne	ADRB3	96	52
O[C@H](CCc1ccccc1)CNCCOc1cccnc1	ZINC000819068904	CE	On-Demand	Anodyne	ADRB2	48	53
O[C@H](CCc1ccccc1)CNCCOc1cccnc1	ZINC000819068904	CE	On-Demand	Anodyne	ADRB1	70	53
O[C@H](CCc1ccccc1)CNCCOc1cccnc1	ZINC000819068904	CE	On-Demand	Anodyne	ADRB3	96	52
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC2(CC1)OCCO2	ZINC000819068905	ED	On-Demand	Anodyne	KCNJ1	65	43
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1ccc(OC(F)(F)F)cc1	ZINC000819068906	FG	On-Demand	Anodyne	ADRB2	29	41
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1ccc(OC(F)(F)F)cc1	ZINC000819068906	FG	On-Demand	Anodyne	ADRB3	37	44
O[C@H](CNCCc1ccc2c(c1)CCO2)c1ccc(OC(F)(F)F)cc1	ZINC000819068907	FG	On-Demand	Anodyne	ADRB2	29	41
O[C@H](CNCCc1ccc2c(c1)CCO2)c1ccc(OC(F)(F)F)cc1	ZINC000819068907	FG	On-Demand	Anodyne	ADRB3	37	44
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1ccccc1Cl	ZINC000819068914	DG	On-Demand	Anodyne	ADRB1	34	42
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1ccccc1Cl	ZINC000819068914	DG	On-Demand	Anodyne	ADRB3	29	42
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2ccc(F)cc2)CC1	ZINC000819068924	DF	On-Demand	Anodyne	L3MBTL3	61	40
CCOc1cc(CNC[C@H](O)c2ccc(F)cc2C)ccc1OC	ZINC000819068941	EG	On-Demand	Anodyne	LEF	47	34
CCOc1cc(CNC[C@@H](O)c2ccc(F)cc2C)ccc1OC	ZINC000819068942	EG	On-Demand	Anodyne	LEF	47	34
CSc1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819068943	EE	On-Demand	Anodyne	ADRB2	54	54
CSc1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819068943	EE	On-Demand	Anodyne	ADRB1	89	54
CSc1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819068943	EE	On-Demand	Anodyne	ADRB3	60	54
CSc1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819068944	EE	On-Demand	Anodyne	ADRB2	54	54
CSc1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819068944	EE	On-Demand	Anodyne	ADRB1	89	54
CSc1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819068944	EE	On-Demand	Anodyne	ADRB3	60	54
O[C@@H](CNCCOc1cccnc1)COc1cc(F)cc(Br)c1	ZINC000819068951	GE	On-Demand	Anodyne	ADRB2	31	49
O[C@@H](CNCCOc1cccnc1)COc1cc(F)cc(Br)c1	ZINC000819068951	GE	On-Demand	Anodyne	ADRB1	54	49
O[C@@H](CNCCOc1cccnc1)COc1cc(F)cc(Br)c1	ZINC000819068951	GE	On-Demand	Anodyne	ADRB3	37	49
O[C@H](CNCCOc1cccnc1)COc1cc(F)cc(Br)c1	ZINC000819068953	GE	On-Demand	Anodyne	ADRB2	31	49
O[C@H](CNCCOc1cccnc1)COc1cc(F)cc(Br)c1	ZINC000819068953	GE	On-Demand	Anodyne	ADRB1	54	49
O[C@H](CNCCOc1cccnc1)COc1cc(F)cc(Br)c1	ZINC000819068953	GE	On-Demand	Anodyne	ADRB3	37	49
Cc1cc([C@@H]2CCCN2C(=O)Cc2noc3ccc(Br)cc23)no1	ZINC000819068963	GH	On-Demand	Anodyne	CPT1A	51	38
COc1ccc(OC)c([C@H](O)CNCc2cc(C(C)C)no2)c1	ZINC000819068973	DF	On-Demand	Anodyne	SLC5A7	24	42
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1ccc(Cl)cc1	ZINC000819068974	DG	On-Demand	Anodyne	ADRB2	30	47
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1ccc(Cl)cc1	ZINC000819068974	DG	On-Demand	Anodyne	ADRB1	34	43
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1ccc(Cl)cc1	ZINC000819068974	DG	On-Demand	Anodyne	ADRB3	47	43
O=C(CCNCCOc1cccnc1)Nc1ccc(Br)cc1	ZINC000819068984	FF	On-Demand	Anodyne	ADRB1	16	42
O=C(CCNCCOc1cccnc1)Nc1ccc(Br)cc1	ZINC000819068984	FF	On-Demand	Anodyne	ADRB3	28	42
O=C(CCNCCOc1cccnc1)Nc1ccc(Br)cc1	ZINC000819068984	FF	On-Demand	Anodyne	CHRNA7	19	46
O=C(CCNCCOc1cccnc1)Nc1ccc(Br)cc1	ZINC000819068984	FF	On-Demand	Anodyne	NAMPT	20	47
O[C@H](CNCCOc1cccnc1)COc1ccccc1F	ZINC000819068986	DD	On-Demand	Anodyne	ADRB2	48	50
O[C@H](CNCCOc1cccnc1)COc1ccccc1F	ZINC000819068986	DD	On-Demand	Anodyne	ADRB1	75	50
O[C@H](CNCCOc1cccnc1)COc1ccccc1F	ZINC000819068986	DD	On-Demand	Anodyne	ADRB3	48	50
O[C@H](CNCCOc1cccnc1)COc1ccccc1F	ZINC000819068986	DD	On-Demand	Anodyne	NMT1	28	41
O[C@@H](CNCCOc1cccnc1)COc1ccccc1F	ZINC000819068987	DD	On-Demand	Anodyne	ADRB2	48	50
O[C@@H](CNCCOc1cccnc1)COc1ccccc1F	ZINC000819068987	DD	On-Demand	Anodyne	ADRB1	75	50
O[C@@H](CNCCOc1cccnc1)COc1ccccc1F	ZINC000819068987	DD	On-Demand	Anodyne	ADRB3	48	50
O[C@@H](CNCCOc1cccnc1)COc1ccccc1F	ZINC000819068987	DD	On-Demand	Anodyne	NMT1	28	41
O[C@@H](CNCCOc1cccnc1)COc1ccccc1	ZINC000819068995	CD	On-Demand	Anodyne	ADRB2	71	65
O[C@@H](CNCCOc1cccnc1)COc1ccccc1	ZINC000819068995	CD	On-Demand	Anodyne	ADRB1	109	65
O[C@@H](CNCCOc1cccnc1)COc1ccccc1	ZINC000819068995	CD	On-Demand	Anodyne	DRD4	18	40
O[C@@H](CNCCOc1cccnc1)COc1ccccc1	ZINC000819068995	CD	On-Demand	Anodyne	ADRB3	85	65
O[C@H](CNCCOc1cccnc1)COc1ccccc1	ZINC000819068997	CD	On-Demand	Anodyne	ADRB2	71	65
O[C@H](CNCCOc1cccnc1)COc1ccccc1	ZINC000819068997	CD	On-Demand	Anodyne	ADRB1	109	65
O[C@H](CNCCOc1cccnc1)COc1ccccc1	ZINC000819068997	CD	On-Demand	Anodyne	DRD4	18	40
O[C@H](CNCCOc1cccnc1)COc1ccccc1	ZINC000819068997	CD	On-Demand	Anodyne	ADRB3	85	65
O[C@@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cccnc1	ZINC000819068999	FF	On-Demand	Anodyne	ADRB2	21	42
O[C@@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cccnc1	ZINC000819068999	FF	On-Demand	Anodyne	ADRB1	28	42
O[C@@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cccnc1	ZINC000819068999	FF	On-Demand	Anodyne	ADRB3	72	49
O[C@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cccnc1	ZINC000819069001	FF	On-Demand	Anodyne	ADRB2	21	42
O[C@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cccnc1	ZINC000819069001	FF	On-Demand	Anodyne	ADRB1	28	42
O[C@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cccnc1	ZINC000819069001	FF	On-Demand	Anodyne	ADRB3	72	49
O[C@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cccnc1	ZINC000819069004	FF	On-Demand	Anodyne	ADRB2	21	42
O[C@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cccnc1	ZINC000819069004	FF	On-Demand	Anodyne	ADRB1	28	42
O[C@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cccnc1	ZINC000819069004	FF	On-Demand	Anodyne	ADRB3	72	49
O[C@@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cccnc1	ZINC000819069006	FF	On-Demand	Anodyne	ADRB2	21	42
O[C@@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cccnc1	ZINC000819069006	FF	On-Demand	Anodyne	ADRB1	28	42
O[C@@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cccnc1	ZINC000819069006	FF	On-Demand	Anodyne	ADRB3	72	49
N#CCc1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819069007	ED	On-Demand	Mild	ADRB2	60	52
N#CCc1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819069007	ED	On-Demand	Mild	ADRB1	100	52
N#CCc1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819069007	ED	On-Demand	Mild	ADRB3	74	52
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069009	EF	On-Demand	Anodyne	DRD4	16	51
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069009	EF	On-Demand	Anodyne	SIGMAR1	18	50
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069009	EF	On-Demand	Anodyne	MLNR	17	42
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069009	EF	On-Demand	Anodyne	CCR2	22	43
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069009	EF	On-Demand	Anodyne	SLC6A5	31	42
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069009	EF	On-Demand	Anodyne	MCHR1	26	42
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069010	EF	On-Demand	Anodyne	DRD4	16	51
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069010	EF	On-Demand	Anodyne	SIGMAR1	18	50
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069010	EF	On-Demand	Anodyne	MLNR	17	42
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069010	EF	On-Demand	Anodyne	CCR2	22	43
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069010	EF	On-Demand	Anodyne	SLC6A5	31	42
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069010	EF	On-Demand	Anodyne	MCHR1	26	42
N#CCc1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819069011	ED	On-Demand	Mild	ADRB2	60	52
N#CCc1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819069011	ED	On-Demand	Mild	ADRB1	100	52
N#CCc1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819069011	ED	On-Demand	Mild	ADRB3	74	52
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069012	EF	On-Demand	Anodyne	DRD4	16	51
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069012	EF	On-Demand	Anodyne	SIGMAR1	18	50
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069012	EF	On-Demand	Anodyne	MLNR	17	42
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069012	EF	On-Demand	Anodyne	CCR2	22	43
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069012	EF	On-Demand	Anodyne	SLC6A5	31	42
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069012	EF	On-Demand	Anodyne	MCHR1	26	42
O[C@@H](CNCCOc1cccnc1)c1cccc(Br)c1	ZINC000819069013	EF	On-Demand	Anodyne	ADRB2	40	57
O[C@@H](CNCCOc1cccnc1)c1cccc(Br)c1	ZINC000819069013	EF	On-Demand	Anodyne	ADRB1	53	57
O[C@@H](CNCCOc1cccnc1)c1cccc(Br)c1	ZINC000819069013	EF	On-Demand	Anodyne	ADRB3	112	57
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069014	EF	On-Demand	Anodyne	DRD4	16	51
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069014	EF	On-Demand	Anodyne	SIGMAR1	18	50
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069014	EF	On-Demand	Anodyne	MLNR	17	42
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069014	EF	On-Demand	Anodyne	CCR2	22	43
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069014	EF	On-Demand	Anodyne	SLC6A5	31	42
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819069014	EF	On-Demand	Anodyne	MCHR1	26	42
O[C@H](CNCCOc1cccnc1)c1cccc(Br)c1	ZINC000819069015	EF	On-Demand	Anodyne	ADRB2	40	57
O[C@H](CNCCOc1cccnc1)c1cccc(Br)c1	ZINC000819069015	EF	On-Demand	Anodyne	ADRB1	53	57
O[C@H](CNCCOc1cccnc1)c1cccc(Br)c1	ZINC000819069015	EF	On-Demand	Anodyne	ADRB3	112	57
O=c1onc(-c2ccccc2)n1C[C@@H](O)CNCCOc1cccnc1	ZINC000819069016	FC	On-Demand	Anodyne	ADRB1	23	44
O=c1onc(-c2ccccc2)n1C[C@@H](O)CNCCOc1cccnc1	ZINC000819069016	FC	On-Demand	Anodyne	ADRB3	26	44
O=c1onc(-c2ccccc2)n1C[C@H](O)CNCCOc1cccnc1	ZINC000819069019	FC	On-Demand	Anodyne	ADRB1	23	44
O=c1onc(-c2ccccc2)n1C[C@H](O)CNCCOc1cccnc1	ZINC000819069019	FC	On-Demand	Anodyne	ADRB3	26	44
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1ccc(C(F)(F)F)cc1	ZINC000819069028	FH	On-Demand	Anodyne	ADRB2	22	40
O[C@H](CNCCc1ccc2c(c1)CCO2)c1ccc(C(F)(F)F)cc1	ZINC000819069029	FH	On-Demand	Anodyne	ADRB2	22	40
C[C@@H](OC[C@@H](O)CNCCOc1cccnc1)c1ccc(Cl)cc1	ZINC000819069030	FF	On-Demand	Anodyne	ADRB2	23	49
C[C@@H](OC[C@@H](O)CNCCOc1cccnc1)c1ccc(Cl)cc1	ZINC000819069030	FF	On-Demand	Anodyne	ADRB1	35	49
C[C@@H](OC[C@@H](O)CNCCOc1cccnc1)c1ccc(Cl)cc1	ZINC000819069030	FF	On-Demand	Anodyne	ADRB3	31	49
C[C@@H](OC[C@H](O)CNCCOc1cccnc1)c1ccc(Cl)cc1	ZINC000819069031	FF	On-Demand	Anodyne	ADRB2	23	49
C[C@@H](OC[C@H](O)CNCCOc1cccnc1)c1ccc(Cl)cc1	ZINC000819069031	FF	On-Demand	Anodyne	ADRB1	35	49
C[C@@H](OC[C@H](O)CNCCOc1cccnc1)c1ccc(Cl)cc1	ZINC000819069031	FF	On-Demand	Anodyne	ADRB3	31	49
O[C@@H](CNCCOc1cccnc1)COCc1ccccc1Cl	ZINC000819069036	EE	On-Demand	Anodyne	ADRB2	26	45
O[C@@H](CNCCOc1cccnc1)COCc1ccccc1Cl	ZINC000819069036	EE	On-Demand	Anodyne	ADRB1	47	45
O[C@@H](CNCCOc1cccnc1)COCc1ccccc1Cl	ZINC000819069036	EE	On-Demand	Anodyne	ADRB3	34	44
O[C@H](CNCCOc1cccnc1)COCc1ccccc1Cl	ZINC000819069038	EE	On-Demand	Anodyne	ADRB2	26	45
O[C@H](CNCCOc1cccnc1)COCc1ccccc1Cl	ZINC000819069038	EE	On-Demand	Anodyne	ADRB1	47	45
O[C@H](CNCCOc1cccnc1)COCc1ccccc1Cl	ZINC000819069038	EE	On-Demand	Anodyne	ADRB3	34	44
CCOc1cc(CNC[C@H](O)c2cc(F)ccc2F)ccc1OC	ZINC000819069040	EG	On-Demand	Anodyne	LEF	44	34
CCOc1cc(CNC[C@H](O)c2cc(F)ccc2F)ccc1OC	ZINC000819069040	EG	On-Demand	Anodyne	DRTS_TRYCR	46	32
CCOc1cc(CNC[C@@H](O)c2cc(F)ccc2F)ccc1OC	ZINC000819069041	EG	On-Demand	Anodyne	LEF	44	34
CCOc1cc(CNC[C@@H](O)c2cc(F)ccc2F)ccc1OC	ZINC000819069041	EG	On-Demand	Anodyne	DRTS_TRYCR	46	32
O=C(c1cccc(NCC[C@@H]2CC2(Cl)Cl)c1)N1CCSCC1	ZINC000819069044	FH	On-Demand	Anodyne	EPHX2	19	44
O=C(c1cccc(NCC[C@H]2CC2(Cl)Cl)c1)N1CCSCC1	ZINC000819069045	FH	On-Demand	Anodyne	EPHX2	19	44
Cc1cccc(C(=O)N2CCCN(C(=O)C(F)=C3CCC3)CC2)c1	ZINC000819069046	EG	On-Demand	Anodyne	HPGD	43	41
Cc1cc([C@@H]2CCCN2C(=O)C[C@H](C)n2cccn2)no1	ZINC000819069050	CE	On-Demand	Anodyne	CPT1A	65	40
Cc1cc([C@@H]2CCCN2C(=O)C[C@@H](C)n2cccn2)no1	ZINC000819069052	CE	On-Demand	Anodyne	CPT1A	65	40
COC(=O)c1cc(Cl)cc(N[C@@H]2CCN(C(C)(C)C)C2=O)c1	ZINC000819069061	DF	On-Demand	Anodyne	CACNA1I	50	38
COC(=O)c1cc(Cl)cc(N[C@H]2CCN(C(C)(C)C)C2=O)c1	ZINC000819069063	DF	On-Demand	Anodyne	CACNA1I	50	38
C[C@@H]1CCCC[C@@H]1C(=O)NCc1cccnc1-n1ccnc1	ZINC000819069076	CF	On-Demand	Anodyne	NOS2	90	37
C[C@@H]1CCCC[C@H]1C(=O)NCc1cccnc1-n1ccnc1	ZINC000819069077	CF	On-Demand	Anodyne	NOS2	90	37
O=C1[C@H](NC[C@H](O)c2ccccc2Cl)CCCN1c1ccccc1	ZINC000819069097	EG	On-Demand	Anodyne	OPRL1	44	39
O=C1[C@@H](NC[C@H](O)c2ccccc2Cl)CCCN1c1ccccc1	ZINC000819069098	EG	On-Demand	Anodyne	OPRL1	44	39
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819069131	DF	On-Demand	Mild	ADRB2	23	44
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819069131	DF	On-Demand	Mild	ADRB1	32	47
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819069131	DF	On-Demand	Mild	ADRB3	95	47
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819069131	DF	On-Demand	Mild	PTAFR	18	43
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819069132	DF	On-Demand	Mild	ADRB2	23	44
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819069132	DF	On-Demand	Mild	ADRB1	32	47
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819069132	DF	On-Demand	Mild	ADRB3	95	47
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819069132	DF	On-Demand	Mild	PTAFR	18	43
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819069133	DF	On-Demand	Mild	ADRB2	23	44
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819069133	DF	On-Demand	Mild	ADRB1	32	47
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819069133	DF	On-Demand	Mild	ADRB3	95	47
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819069133	DF	On-Demand	Mild	PTAFR	18	43
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819069134	DF	On-Demand	Mild	ADRB2	23	44
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819069134	DF	On-Demand	Mild	ADRB1	32	47
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819069134	DF	On-Demand	Mild	ADRB3	95	47
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819069134	DF	On-Demand	Mild	PTAFR	18	43
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819069135	FG	On-Demand	Mild	CACNA1C	42	34
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819069135	FG	On-Demand	Mild	CACNA1D	72	34
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819069136	FG	On-Demand	Mild	CACNA1C	42	34
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819069136	FG	On-Demand	Mild	CACNA1D	72	34
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819069137	FG	On-Demand	Mild	CACNA1C	42	34
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819069137	FG	On-Demand	Mild	CACNA1D	72	34
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819069138	FG	On-Demand	Mild	CACNA1C	42	34
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819069138	FG	On-Demand	Mild	CACNA1D	72	34
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)Cc2ccccc2)c1	ZINC000819069141	DG	On-Demand	Mild	CTSD	20	43
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)Cc2ccccc2)c1	ZINC000819069141	DG	On-Demand	Mild	BACE1	32	45
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)Cc2ccccc2)c1	ZINC000819069141	DG	On-Demand	Mild	PDS	72	40
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)Cc2ccccc2)c1	ZINC000819069142	DG	On-Demand	Mild	CTSD	20	43
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)Cc2ccccc2)c1	ZINC000819069142	DG	On-Demand	Mild	BACE1	32	45
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)Cc2ccccc2)c1	ZINC000819069142	DG	On-Demand	Mild	PDS	72	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)Cc2ccccc2)c1	ZINC000819069143	DG	On-Demand	Mild	CTSD	20	43
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)Cc2ccccc2)c1	ZINC000819069143	DG	On-Demand	Mild	BACE1	32	45
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)Cc2ccccc2)c1	ZINC000819069143	DG	On-Demand	Mild	PDS	72	40
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)Cc2ccccc2)c1	ZINC000819069144	DG	On-Demand	Mild	CTSD	20	43
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)Cc2ccccc2)c1	ZINC000819069144	DG	On-Demand	Mild	BACE1	32	45
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)Cc2ccccc2)c1	ZINC000819069144	DG	On-Demand	Mild	PDS	72	40
CC[C@@H](C#N)Oc1cccc(CNCCS(=O)(=O)c2ccccc2)c1	ZINC000819069154	FF	On-Demand	Mild	PDS	45	36
CC[C@H](C#N)Oc1cccc(CNCCS(=O)(=O)c2ccccc2)c1	ZINC000819069155	FF	On-Demand	Mild	PDS	45	36
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C)cc2)c1	ZINC000819069166	FG	On-Demand	Mild	ADRB2	40	43
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C)cc2)c1	ZINC000819069166	FG	On-Demand	Mild	ADRB1	62	41
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C)cc2)c1	ZINC000819069166	FG	On-Demand	Mild	ADRB3	36	41
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C)cc2)c1	ZINC000819069166	FG	On-Demand	Mild	PDS	56	39
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C)cc2)c1	ZINC000819069167	FG	On-Demand	Mild	ADRB2	40	43
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C)cc2)c1	ZINC000819069167	FG	On-Demand	Mild	ADRB1	62	41
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C)cc2)c1	ZINC000819069167	FG	On-Demand	Mild	ADRB3	36	41
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C)cc2)c1	ZINC000819069167	FG	On-Demand	Mild	PDS	56	39
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C)cc2)c1	ZINC000819069168	FG	On-Demand	Mild	ADRB2	40	43
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C)cc2)c1	ZINC000819069168	FG	On-Demand	Mild	ADRB1	62	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C)cc2)c1	ZINC000819069168	FG	On-Demand	Mild	ADRB3	36	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(C)cc2)c1	ZINC000819069168	FG	On-Demand	Mild	PDS	56	39
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C)cc2)c1	ZINC000819069169	FG	On-Demand	Mild	ADRB2	40	43
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C)cc2)c1	ZINC000819069169	FG	On-Demand	Mild	ADRB1	62	41
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C)cc2)c1	ZINC000819069169	FG	On-Demand	Mild	ADRB3	36	41
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(C)cc2)c1	ZINC000819069169	FG	On-Demand	Mild	PDS	56	39
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069176	GI	On-Demand	Mild	ADRB2	36	48
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069176	GI	On-Demand	Mild	ADRB1	51	39
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069176	GI	On-Demand	Mild	CASR	43	38
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069176	GI	On-Demand	Mild	ABCB1	21	40
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069176	GI	On-Demand	Mild	PDS	79	39
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069177	GI	On-Demand	Mild	ADRB2	36	48
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069177	GI	On-Demand	Mild	ADRB1	51	39
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069177	GI	On-Demand	Mild	CASR	43	38
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069177	GI	On-Demand	Mild	ABCB1	21	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069177	GI	On-Demand	Mild	PDS	79	39
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069178	GI	On-Demand	Mild	ADRB2	36	48
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069178	GI	On-Demand	Mild	ADRB1	51	39
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069178	GI	On-Demand	Mild	CASR	43	38
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069178	GI	On-Demand	Mild	ABCB1	21	40
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069178	GI	On-Demand	Mild	PDS	79	39
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069179	GI	On-Demand	Mild	ADRB2	36	48
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069179	GI	On-Demand	Mild	ADRB1	51	39
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069179	GI	On-Demand	Mild	CASR	43	38
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069179	GI	On-Demand	Mild	ABCB1	21	40
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc3ccccc3c2)c1	ZINC000819069179	GI	On-Demand	Mild	PDS	79	39
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069182	FH	On-Demand	Mild	ADRB2	38	43
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069182	FH	On-Demand	Mild	ADRB1	70	41
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069182	FH	On-Demand	Mild	GRIN1	16	42
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069182	FH	On-Demand	Mild	ADRB3	43	41
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069182	FH	On-Demand	Mild	PDS	81	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069183	FH	On-Demand	Mild	ADRB2	38	43
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069183	FH	On-Demand	Mild	ADRB1	70	41
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069183	FH	On-Demand	Mild	GRIN1	16	42
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069183	FH	On-Demand	Mild	ADRB3	43	41
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069183	FH	On-Demand	Mild	PDS	81	40
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069184	FH	On-Demand	Mild	ADRB2	38	43
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069184	FH	On-Demand	Mild	ADRB1	70	41
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069184	FH	On-Demand	Mild	GRIN1	16	42
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069184	FH	On-Demand	Mild	ADRB3	43	41
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069184	FH	On-Demand	Mild	PDS	81	40
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069185	FH	On-Demand	Mild	ADRB2	38	43
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069185	FH	On-Demand	Mild	ADRB1	70	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069185	FH	On-Demand	Mild	GRIN1	16	42
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069185	FH	On-Demand	Mild	ADRB3	43	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819069185	FH	On-Demand	Mild	PDS	81	40
C=CCC1(C(=O)N(C)Cc2ccc(Cl)nc2)CCOCC1	ZINC000819069195	DG	On-Demand	Mild	NACHRBETA2	23	41
O=C(Cc1ccccc1)Nc1cc(NCC[C@H]2CC2(Cl)Cl)ccc1F	ZINC000819069196	GK	On-Demand	Anodyne	CA5B	26	43
O=C(Cc1ccccc1)Nc1cc(NCC[C@H]2CC2(Cl)Cl)ccc1F	ZINC000819069196	GK	On-Demand	Anodyne	CA5A	30	43
O=C(Cc1ccccc1)Nc1cc(NCC[C@@H]2CC2(Cl)Cl)ccc1F	ZINC000819069197	GK	On-Demand	Anodyne	CA5B	26	43
O=C(Cc1ccccc1)Nc1cc(NCC[C@@H]2CC2(Cl)Cl)ccc1F	ZINC000819069197	GK	On-Demand	Anodyne	CA5A	30	43
Cc1cc([C@@H]2CCCN2C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)no1	ZINC000819069206	GG	On-Demand	Mild	TRY1_BOVIN	19	40
Cc1cc([C@@H]2CCCN2C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)no1	ZINC000819069207	GG	On-Demand	Mild	TRY1_BOVIN	19	40
CC[C@@H](C#N)Oc1cccc(CNC[C@@](C)(O)C(F)(F)F)c1	ZINC000819069208	DF	On-Demand	Mild	PDS	41	33
CC[C@@H](C#N)Oc1cccc(CNC[C@](C)(O)C(F)(F)F)c1	ZINC000819069210	DF	On-Demand	Mild	PDS	41	33
CC[C@H](C#N)Oc1cccc(CNC[C@](C)(O)C(F)(F)F)c1	ZINC000819069212	DF	On-Demand	Mild	PDS	41	33
CC[C@H](C#N)Oc1cccc(CNC[C@@](C)(O)C(F)(F)F)c1	ZINC000819069213	DF	On-Demand	Mild	PDS	41	33
Cc1noc(C)c1[C@H](C)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819069221	FF	On-Demand	Anodyne	GPR119	33	41
O[C@@H](CNCCOc1cccnc1)c1ccc(F)cc1Cl	ZINC000819069222	DF	On-Demand	Anodyne	ADRB2	17	45
O[C@@H](CNCCOc1cccnc1)c1ccc(F)cc1Cl	ZINC000819069222	DF	On-Demand	Anodyne	ADRB1	28	45
O[C@@H](CNCCOc1cccnc1)c1ccc(F)cc1Cl	ZINC000819069222	DF	On-Demand	Anodyne	ADRB3	42	46
O[C@H](CNCCOc1cccnc1)c1ccc(F)cc1Cl	ZINC000819069223	DF	On-Demand	Anodyne	ADRB2	17	45
O[C@H](CNCCOc1cccnc1)c1ccc(F)cc1Cl	ZINC000819069223	DF	On-Demand	Anodyne	ADRB1	28	45
O[C@H](CNCCOc1cccnc1)c1ccc(F)cc1Cl	ZINC000819069223	DF	On-Demand	Anodyne	ADRB3	42	46
Cc1noc(C)c1[C@H](C)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819069225	FF	On-Demand	Anodyne	GPR119	33	41
Cc1noc(C)c1[C@@H](C)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819069227	FF	On-Demand	Anodyne	GPR119	33	41
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(c3cccc(OC(F)(F)F)c3)C2)cc1	ZINC000819069228	GG	On-Demand	Mild	ADRB3	19	43
Cc1noc(C)c1[C@@H](C)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819069229	FF	On-Demand	Anodyne	GPR119	33	41
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(c3cccc(OC(F)(F)F)c3)C2)cc1	ZINC000819069232	GG	On-Demand	Mild	ADRB3	19	43
N#Cc1ccc([C@H](O)CN[C@H]2CCN(c3cccc(OC(F)(F)F)c3)C2)cc1	ZINC000819069233	GG	On-Demand	Mild	ADRB3	19	43
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(c3cccc(OC(F)(F)F)c3)C2)cc1	ZINC000819069234	GG	On-Demand	Mild	ADRB3	19	43
N#Cc1ccc([C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819069250	CD	On-Demand	Mild	ADRB2	24	54
N#Cc1ccc([C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819069250	CD	On-Demand	Mild	ADRB1	35	54
N#Cc1ccc([C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819069250	CD	On-Demand	Mild	ADRB3	69	56
N#Cc1ccc([C@H](O)CNCCOc2cccnc2)cc1	ZINC000819069258	CD	On-Demand	Mild	ADRB2	24	54
N#Cc1ccc([C@H](O)CNCCOc2cccnc2)cc1	ZINC000819069258	CD	On-Demand	Mild	ADRB1	35	54
N#Cc1ccc([C@H](O)CNCCOc2cccnc2)cc1	ZINC000819069258	CD	On-Demand	Mild	ADRB3	69	56
O[C@@H](CNCCOc1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819069259	EF	On-Demand	Anodyne	ADRB2	32	53
O[C@@H](CNCCOc1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819069259	EF	On-Demand	Anodyne	ADRB1	49	56
O[C@@H](CNCCOc1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819069259	EF	On-Demand	Anodyne	ADRB3	103	56
O[C@H](CNCCOc1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819069260	EF	On-Demand	Anodyne	ADRB2	32	53
O[C@H](CNCCOc1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819069260	EF	On-Demand	Anodyne	ADRB1	49	56
O[C@H](CNCCOc1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819069260	EF	On-Demand	Anodyne	ADRB3	103	56
CCOc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1OC	ZINC000819069262	EF	On-Demand	Bother	CACNA1C	48	42
CCOc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1OC	ZINC000819069262	EF	On-Demand	Bother	ADRB3	42	38
CCOc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1OC	ZINC000819069262	EF	On-Demand	Bother	CACNA1D	76	42
CCOc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1OC	ZINC000819069264	EF	On-Demand	Bother	CACNA1C	48	42
CCOc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1OC	ZINC000819069264	EF	On-Demand	Bother	ADRB3	42	38
CCOc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1OC	ZINC000819069264	EF	On-Demand	Bother	CACNA1D	76	42
O=C(c1cccc(NCC[C@@H]2CC2(Cl)Cl)c1)N1CCC(O)CC1	ZINC000819069266	FG	On-Demand	Anodyne	L3MBTL3	48	40
O=C(c1cccc(NCC[C@H]2CC2(Cl)Cl)c1)N1CCC(O)CC1	ZINC000819069268	FG	On-Demand	Anodyne	L3MBTL3	48	40
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1cccc(Br)c1	ZINC000819069270	FG	On-Demand	Anodyne	ADRB2	33	43
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1cccc(Br)c1	ZINC000819069270	FG	On-Demand	Anodyne	ADRB1	34	44
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1cccc(Br)c1	ZINC000819069270	FG	On-Demand	Anodyne	ADRB3	63	44
O[C@H](CNCCc1ccc2c(c1)CCO2)c1cccc(Br)c1	ZINC000819069271	FG	On-Demand	Anodyne	ADRB2	33	43
O[C@H](CNCCc1ccc2c(c1)CCO2)c1cccc(Br)c1	ZINC000819069271	FG	On-Demand	Anodyne	ADRB1	34	44
O[C@H](CNCCc1ccc2c(c1)CCO2)c1cccc(Br)c1	ZINC000819069271	FG	On-Demand	Anodyne	ADRB3	63	44
O[C@@H](CNCCOc1cccnc1)c1ccc(F)cc1	ZINC000819069286	CD	On-Demand	Anodyne	ADRB2	33	54
O[C@@H](CNCCOc1cccnc1)c1ccc(F)cc1	ZINC000819069286	CD	On-Demand	Anodyne	ADRB1	40	54
O[C@@H](CNCCOc1cccnc1)c1ccc(F)cc1	ZINC000819069286	CD	On-Demand	Anodyne	ADRB3	93	56
O[C@H](CNCCOc1cccnc1)c1ccc(F)cc1	ZINC000819069288	CD	On-Demand	Anodyne	ADRB2	33	54
O[C@H](CNCCOc1cccnc1)c1ccc(F)cc1	ZINC000819069288	CD	On-Demand	Anodyne	ADRB1	40	54
O[C@H](CNCCOc1cccnc1)c1ccc(F)cc1	ZINC000819069288	CD	On-Demand	Anodyne	ADRB3	93	56
O[C@H](CNCCOc1cccnc1)COCc1cccs1	ZINC000819069291	DD	On-Demand	Anodyne	ADRB2	20	44
O[C@H](CNCCOc1cccnc1)COCc1cccs1	ZINC000819069291	DD	On-Demand	Anodyne	ADRB1	38	44
O[C@H](CNCCOc1cccnc1)COCc1cccs1	ZINC000819069291	DD	On-Demand	Anodyne	ADRB3	22	44
O[C@@H](CNCCOc1cccnc1)COCc1cccs1	ZINC000819069292	DD	On-Demand	Anodyne	ADRB2	20	44
O[C@@H](CNCCOc1cccnc1)COCc1cccs1	ZINC000819069292	DD	On-Demand	Anodyne	ADRB1	38	44
O[C@@H](CNCCOc1cccnc1)COCc1cccs1	ZINC000819069292	DD	On-Demand	Anodyne	ADRB3	22	44
O[C@H](CNCCOc1cccnc1)C1CC1	ZINC000819069295	BC	On-Demand	Anodyne	ADRB1	23	46
O[C@H](CNCCOc1cccnc1)C1CC1	ZINC000819069295	BC	On-Demand	Anodyne	ADRB3	30	47
O[C@@H](CNCCOc1cccnc1)C1CC1	ZINC000819069296	BC	On-Demand	Anodyne	ADRB1	23	46
O[C@@H](CNCCOc1cccnc1)C1CC1	ZINC000819069296	BC	On-Demand	Anodyne	ADRB3	30	47
CCOc1cc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1OC	ZINC000819069314	GE	On-Demand	Anodyne	ADRB2	20	40
CCOc1cc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1OC	ZINC000819069316	GE	On-Demand	Anodyne	ADRB2	20	40
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc3c(c2)CCO3)cc1	ZINC000819069318	FD	On-Demand	Anodyne	ADRB2	49	42
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc3c(c2)CCO3)cc1	ZINC000819069318	FD	On-Demand	Anodyne	ADRB1	44	38
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc3c(c2)CCO3)cc1	ZINC000819069318	FD	On-Demand	Anodyne	ADRB3	112	38
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc3c(c2)CCO3)cc1	ZINC000819069320	FD	On-Demand	Anodyne	ADRB2	49	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc3c(c2)CCO3)cc1	ZINC000819069320	FD	On-Demand	Anodyne	ADRB1	44	38
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc3c(c2)CCO3)cc1	ZINC000819069320	FD	On-Demand	Anodyne	ADRB3	112	38
O[C@@H](CNCCOc1cccnc1)c1ccc(Br)cc1	ZINC000819069322	EF	On-Demand	Anodyne	ADRB2	31	57
O[C@@H](CNCCOc1cccnc1)c1ccc(Br)cc1	ZINC000819069322	EF	On-Demand	Anodyne	ADRB1	39	57
O[C@@H](CNCCOc1cccnc1)c1ccc(Br)cc1	ZINC000819069322	EF	On-Demand	Anodyne	ADRB3	84	57
O[C@H](CNCCOc1cccnc1)c1ccc(Br)cc1	ZINC000819069324	EF	On-Demand	Anodyne	ADRB2	31	57
O[C@H](CNCCOc1cccnc1)c1ccc(Br)cc1	ZINC000819069324	EF	On-Demand	Anodyne	ADRB1	39	57
O[C@H](CNCCOc1cccnc1)c1ccc(Br)cc1	ZINC000819069324	EF	On-Demand	Anodyne	ADRB3	84	57
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1ccc(Cl)c(F)c1	ZINC000819069336	EG	On-Demand	Anodyne	ADRB1	20	42
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1ccc(Cl)c(F)c1	ZINC000819069336	EG	On-Demand	Anodyne	ADRB3	30	42
O[C@H](CNCCc1ccc2c(c1)CCO2)c1ccc(Cl)c(F)c1	ZINC000819069337	EG	On-Demand	Anodyne	ADRB1	20	42
O[C@H](CNCCc1ccc2c(c1)CCO2)c1ccc(Cl)c(F)c1	ZINC000819069337	EG	On-Demand	Anodyne	ADRB3	30	42
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1ccc(F)c(Br)c1	ZINC000819069338	GG	On-Demand	Anodyne	ADRB2	22	41
O[C@H](CNCCc1ccc2c(c1)CCO2)c1ccc(F)c(Br)c1	ZINC000819069340	GG	On-Demand	Anodyne	ADRB2	22	41
O=C(NC1CC1)c1ccccc1NCC[C@H]1CC1(Cl)Cl	ZINC000819069341	DH	On-Demand	Anodyne	CNR2	18	41
O=C(NC1CC1)c1ccccc1NCC[C@@H]1CC1(Cl)Cl	ZINC000819069343	DH	On-Demand	Anodyne	CNR2	18	41
CN(C)C(=O)C1(CNC[C@H](O)c2cccnc2)CCCC1	ZINC000819069344	CD	On-Demand	Anodyne	ADRB2	20	40
CN(C)C(=O)C1(CNC[C@H](O)c2cccnc2)CCCC1	ZINC000819069344	CD	On-Demand	Anodyne	ADRB1	22	41
CN(C)C(=O)C1(CNC[C@H](O)c2cccnc2)CCCC1	ZINC000819069344	CD	On-Demand	Anodyne	ADRB3	91	45
CN(C)C(=O)C1(CNC[C@@H](O)c2cccnc2)CCCC1	ZINC000819069346	CD	On-Demand	Anodyne	ADRB2	20	40
CN(C)C(=O)C1(CNC[C@@H](O)c2cccnc2)CCCC1	ZINC000819069346	CD	On-Demand	Anodyne	ADRB1	22	41
CN(C)C(=O)C1(CNC[C@@H](O)c2cccnc2)CCCC1	ZINC000819069346	CD	On-Demand	Anodyne	ADRB3	91	45
O[C@H](CNCCOc1cccnc1)Cc1ccc(C(F)(F)F)cc1	ZINC000819069364	EF	On-Demand	Anodyne	ADRB2	24	43
O[C@H](CNCCOc1cccnc1)Cc1ccc(C(F)(F)F)cc1	ZINC000819069364	EF	On-Demand	Anodyne	ADRB1	35	46
O[C@H](CNCCOc1cccnc1)Cc1ccc(C(F)(F)F)cc1	ZINC000819069364	EF	On-Demand	Anodyne	ADRB3	50	46
O[C@@H](CNCCOc1cccnc1)Cc1ccc(C(F)(F)F)cc1	ZINC000819069365	EF	On-Demand	Anodyne	ADRB2	24	43
O[C@@H](CNCCOc1cccnc1)Cc1ccc(C(F)(F)F)cc1	ZINC000819069365	EF	On-Demand	Anodyne	ADRB1	35	46
O[C@@H](CNCCOc1cccnc1)Cc1ccc(C(F)(F)F)cc1	ZINC000819069365	EF	On-Demand	Anodyne	ADRB3	50	46
CONC(=O)[C@@H]1C[C@@H]1c1ccc(C)cc1	ZINC000819069387	BD	On-Demand	Anodyne	SLC6A4	29	47
CONC(=O)[C@@H]1C[C@@H]1c1ccc(C)cc1	ZINC000819069387	BD	On-Demand	Anodyne	SLC6A3	53	47
CONC(=O)[C@H]1C[C@@H]1c1ccc(C)cc1	ZINC000819069388	BD	On-Demand	Anodyne	SLC6A4	29	47
CONC(=O)[C@H]1C[C@@H]1c1ccc(C)cc1	ZINC000819069388	BD	On-Demand	Anodyne	SLC6A3	53	47
CONC(=O)[C@H]1C[C@H]1c1ccc(C)cc1	ZINC000819069389	BD	On-Demand	Anodyne	SLC6A4	29	47
CONC(=O)[C@H]1C[C@H]1c1ccc(C)cc1	ZINC000819069389	BD	On-Demand	Anodyne	SLC6A3	53	47
CONC(=O)[C@@H]1C[C@H]1c1ccc(C)cc1	ZINC000819069390	BD	On-Demand	Anodyne	SLC6A4	29	47
CONC(=O)[C@@H]1C[C@H]1c1ccc(C)cc1	ZINC000819069390	BD	On-Demand	Anodyne	SLC6A3	53	47
CN(C)C(=O)C1(CNC[C@H](O)c2cccc(Cl)c2)CCCC1	ZINC000819069417	DF	On-Demand	Anodyne	ADRB1	33	45
CN(C)C(=O)C1(CNC[C@H](O)c2cccc(Cl)c2)CCCC1	ZINC000819069417	DF	On-Demand	Anodyne	ADRB3	52	45
CN(C)C(=O)C1(CNC[C@@H](O)c2cccc(Cl)c2)CCCC1	ZINC000819069419	DF	On-Demand	Anodyne	ADRB1	33	45
CN(C)C(=O)C1(CNC[C@@H](O)c2cccc(Cl)c2)CCCC1	ZINC000819069419	DF	On-Demand	Anodyne	ADRB3	52	45
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(F)cc2Cl)cc1	ZINC000819069425	FF	On-Demand	Anodyne	ADRB2	42	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(F)cc2Cl)cc1	ZINC000819069425	FF	On-Demand	Anodyne	ADRB1	40	37
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(F)cc2Cl)cc1	ZINC000819069425	FF	On-Demand	Anodyne	PTGS2	43	39
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(F)cc2Cl)cc1	ZINC000819069425	FF	On-Demand	Anodyne	ADRB3	89	42
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(F)cc2Cl)cc1	ZINC000819069427	FF	On-Demand	Anodyne	ADRB2	42	43
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(F)cc2Cl)cc1	ZINC000819069427	FF	On-Demand	Anodyne	ADRB1	40	37
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(F)cc2Cl)cc1	ZINC000819069427	FF	On-Demand	Anodyne	PTGS2	43	39
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(F)cc2Cl)cc1	ZINC000819069427	FF	On-Demand	Anodyne	ADRB3	89	42
Cc1ccc(C(=O)N2CCOCC2)cc1NCC[C@H]1CC1(Cl)Cl	ZINC000819069485	FG	On-Demand	Anodyne	LRRK2	22	44
Cc1ccc(C(=O)N2CCOCC2)cc1NCC[C@@H]1CC1(Cl)Cl	ZINC000819069486	FG	On-Demand	Anodyne	LRRK2	22	44
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069493	FH	On-Demand	Anodyne	DRD4	26	56
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069493	FH	On-Demand	Anodyne	ACHE	15	41
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069493	FH	On-Demand	Anodyne	SLC6A3	23	51
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069493	FH	On-Demand	Anodyne	ADRB3	24	45
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069493	FH	On-Demand	Anodyne	TACR1	15	41
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069493	FH	On-Demand	Anodyne	SIGMAR1	34	58
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069493	FH	On-Demand	Anodyne	CCR3	26	40
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069493	FH	On-Demand	Anodyne	CCR5	19	45
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069493	FH	On-Demand	Anodyne	MLNR	27	42
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069493	FH	On-Demand	Anodyne	CCR2	34	46
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069493	FH	On-Demand	Anodyne	SLC6A5	31	47
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069493	FH	On-Demand	Anodyne	MCHR1	33	46
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069494	FH	On-Demand	Anodyne	DRD4	26	56
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069494	FH	On-Demand	Anodyne	ACHE	15	41
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069494	FH	On-Demand	Anodyne	SLC6A3	23	51
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069494	FH	On-Demand	Anodyne	ADRB3	24	45
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069494	FH	On-Demand	Anodyne	TACR1	15	41
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069494	FH	On-Demand	Anodyne	SIGMAR1	34	58
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069494	FH	On-Demand	Anodyne	CCR3	26	40
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069494	FH	On-Demand	Anodyne	CCR5	19	45
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069494	FH	On-Demand	Anodyne	MLNR	27	42
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069494	FH	On-Demand	Anodyne	CCR2	34	46
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069494	FH	On-Demand	Anodyne	SLC6A5	31	47
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069494	FH	On-Demand	Anodyne	MCHR1	33	46
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069495	FH	On-Demand	Anodyne	DRD4	26	56
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069495	FH	On-Demand	Anodyne	ACHE	15	41
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069495	FH	On-Demand	Anodyne	SLC6A3	23	51
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069495	FH	On-Demand	Anodyne	ADRB3	24	45
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069495	FH	On-Demand	Anodyne	TACR1	15	41
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069495	FH	On-Demand	Anodyne	SIGMAR1	34	58
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069495	FH	On-Demand	Anodyne	CCR3	26	40
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069495	FH	On-Demand	Anodyne	CCR5	19	45
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069495	FH	On-Demand	Anodyne	MLNR	27	42
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069495	FH	On-Demand	Anodyne	CCR2	34	46
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069495	FH	On-Demand	Anodyne	SLC6A5	31	47
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069495	FH	On-Demand	Anodyne	MCHR1	33	46
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069496	FH	On-Demand	Anodyne	DRD4	26	56
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069496	FH	On-Demand	Anodyne	ACHE	15	41
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069496	FH	On-Demand	Anodyne	SLC6A3	23	51
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069496	FH	On-Demand	Anodyne	ADRB3	24	45
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069496	FH	On-Demand	Anodyne	TACR1	15	41
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069496	FH	On-Demand	Anodyne	SIGMAR1	34	58
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069496	FH	On-Demand	Anodyne	CCR3	26	40
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069496	FH	On-Demand	Anodyne	CCR5	19	45
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069496	FH	On-Demand	Anodyne	MLNR	27	42
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069496	FH	On-Demand	Anodyne	CCR2	34	46
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069496	FH	On-Demand	Anodyne	SLC6A5	31	47
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819069496	FH	On-Demand	Anodyne	MCHR1	33	46
O=C(Cc1ccc(NCC[C@H]2CC2(Cl)Cl)cc1)Nc1ccccc1F	ZINC000819069500	GK	On-Demand	Anodyne	KCNQ2	23	40
O=C(Cc1ccc(NCC[C@H]2CC2(Cl)Cl)cc1)Nc1ccccc1F	ZINC000819069500	GK	On-Demand	Anodyne	CA5B	20	40
O=C(Cc1ccc(NCC[C@H]2CC2(Cl)Cl)cc1)Nc1ccccc1F	ZINC000819069500	GK	On-Demand	Anodyne	CA5A	23	40
O=C(Cc1ccc(NCC[C@@H]2CC2(Cl)Cl)cc1)Nc1ccccc1F	ZINC000819069501	GK	On-Demand	Anodyne	KCNQ2	23	40
O=C(Cc1ccc(NCC[C@@H]2CC2(Cl)Cl)cc1)Nc1ccccc1F	ZINC000819069501	GK	On-Demand	Anodyne	CA5B	20	40
O=C(Cc1ccc(NCC[C@@H]2CC2(Cl)Cl)cc1)Nc1ccccc1F	ZINC000819069501	GK	On-Demand	Anodyne	CA5A	23	40
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccnc1	ZINC000819069502	FF	On-Demand	Anodyne	ADRB3	69	47
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccnc1	ZINC000819069502	FF	On-Demand	Anodyne	SLC6A5	29	47
O[C@@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccnc1	ZINC000819069502	FF	On-Demand	Anodyne	MCHR1	23	43
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccnc1	ZINC000819069503	FF	On-Demand	Anodyne	ADRB3	69	47
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccnc1	ZINC000819069503	FF	On-Demand	Anodyne	SLC6A5	29	47
O[C@H](CN[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccnc1	ZINC000819069503	FF	On-Demand	Anodyne	MCHR1	23	43
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccnc1	ZINC000819069504	FF	On-Demand	Anodyne	ADRB3	69	47
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccnc1	ZINC000819069504	FF	On-Demand	Anodyne	SLC6A5	29	47
O[C@@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccnc1	ZINC000819069504	FF	On-Demand	Anodyne	MCHR1	23	43
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccnc1	ZINC000819069505	FF	On-Demand	Anodyne	ADRB3	69	47
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccnc1	ZINC000819069505	FF	On-Demand	Anodyne	SLC6A5	29	47
O[C@H](CN[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1)c1cccnc1	ZINC000819069505	FF	On-Demand	Anodyne	MCHR1	23	43
CCCCC[C@@H](C)NC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819069508	GH	On-Demand	Anodyne	SSTR2	51	34
CCCCC[C@@H](C)NC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819069508	GH	On-Demand	Anodyne	P2RY12	71	36
CCCCC[C@@H](C)NC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819069510	GH	On-Demand	Anodyne	SSTR2	51	34
CCCCC[C@@H](C)NC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819069510	GH	On-Demand	Anodyne	P2RY12	71	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCN(C(=O)c3ccccc3)CC1)C2	ZINC000819069512	GE	On-Demand	Anodyne	PREP	40	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCN(C(=O)c3ccccc3)CC1)C2	ZINC000819069512	GE	On-Demand	Anodyne	ADAM10	41	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCN(C(=O)c3ccccc3)CC1)C2	ZINC000819069513	GE	On-Demand	Anodyne	PREP	40	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCN(C(=O)c3ccccc3)CC1)C2	ZINC000819069513	GE	On-Demand	Anodyne	ADAM10	41	41
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819069532	GI	On-Demand	Mild	PDS	51	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819069533	GI	On-Demand	Mild	PDS	51	40
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819069534	GI	On-Demand	Mild	PDS	51	40
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819069535	GI	On-Demand	Mild	PDS	51	40
COc1ccc(C(=O)N2CCCC2)cc1NCC[C@@H]1CC1(Cl)Cl	ZINC000819069536	FH	On-Demand	Anodyne	L3MBTL3	54	36
COc1ccc(C(=O)N2CCCC2)cc1NCC[C@H]1CC1(Cl)Cl	ZINC000819069537	FH	On-Demand	Anodyne	L3MBTL3	54	36
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)Cc2ccc3ccccc3c2)c1	ZINC000819069543	FI	On-Demand	Mild	CASR	41	36
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)Cc2ccc3ccccc3c2)c1	ZINC000819069543	FI	On-Demand	Mild	TRY2_BOVIN	40	32
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)Cc2ccc3ccccc3c2)c1	ZINC000819069544	FI	On-Demand	Mild	CASR	41	36
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)Cc2ccc3ccccc3c2)c1	ZINC000819069544	FI	On-Demand	Mild	TRY2_BOVIN	40	32
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)Cc2ccc3ccccc3c2)c1	ZINC000819069545	FI	On-Demand	Mild	CASR	41	36
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)Cc2ccc3ccccc3c2)c1	ZINC000819069545	FI	On-Demand	Mild	TRY2_BOVIN	40	32
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)Cc2ccc3ccccc3c2)c1	ZINC000819069546	FI	On-Demand	Mild	CASR	41	36
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)Cc2ccc3ccccc3c2)c1	ZINC000819069546	FI	On-Demand	Mild	TRY2_BOVIN	40	32
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819069547	GG	On-Demand	Mild	ADRB2	20	52
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819069547	GG	On-Demand	Mild	ADRB1	59	52
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819069548	GG	On-Demand	Mild	ADRB2	20	52
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819069548	GG	On-Demand	Mild	ADRB1	59	52
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819069549	GG	On-Demand	Mild	ADRB2	20	52
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819069549	GG	On-Demand	Mild	ADRB1	59	52
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819069550	GG	On-Demand	Mild	ADRB2	20	52
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819069550	GG	On-Demand	Mild	ADRB1	59	52
CC[C@H](C#N)Oc1cccc(CNCCC(=O)NC(N)=O)c1	ZINC000819069602	DD	On-Demand	Mild	DPP7	15	40
CC[C@@H](C#N)Oc1cccc(CNCCC(=O)NC(N)=O)c1	ZINC000819069606	DD	On-Demand	Mild	DPP7	15	40
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819069609	FG	On-Demand	Mild	BACE1	19	40
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819069610	FG	On-Demand	Mild	BACE1	19	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819069612	FG	On-Demand	Mild	BACE1	19	40
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819069614	FG	On-Demand	Mild	BACE1	19	40
O=[N+]([O-])c1ccc([C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819069624	DD	On-Demand	Bother	ADRB2	31	50
O=[N+]([O-])c1ccc([C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819069624	DD	On-Demand	Bother	ADRB1	36	50
O=[N+]([O-])c1ccc([C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819069624	DD	On-Demand	Bother	ADRB3	96	52
O=[N+]([O-])c1ccc([C@H](O)CNCCOc2cccnc2)cc1	ZINC000819069625	DD	On-Demand	Bother	ADRB2	31	50
O=[N+]([O-])c1ccc([C@H](O)CNCCOc2cccnc2)cc1	ZINC000819069625	DD	On-Demand	Bother	ADRB1	36	50
O=[N+]([O-])c1ccc([C@H](O)CNCCOc2cccnc2)cc1	ZINC000819069625	DD	On-Demand	Bother	ADRB3	96	52
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1ccc(C(F)(F)F)cc1	ZINC000819069633	FF	On-Demand	Anodyne	ADRB3	54	45
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1ccc(C(F)(F)F)cc1	ZINC000819069635	FF	On-Demand	Anodyne	ADRB3	54	45
O[C@@H](CNCCOc1cccnc1)c1ccc(OC(F)(F)F)cc1	ZINC000819069636	EF	On-Demand	Anodyne	ADRB2	41	55
O[C@@H](CNCCOc1cccnc1)c1ccc(OC(F)(F)F)cc1	ZINC000819069636	EF	On-Demand	Anodyne	ADRB1	42	56
O[C@@H](CNCCOc1cccnc1)c1ccc(OC(F)(F)F)cc1	ZINC000819069636	EF	On-Demand	Anodyne	ADRB3	99	56
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1ccc(C(F)(F)F)cc1	ZINC000819069637	FF	On-Demand	Anodyne	ADRB3	54	45
O[C@H](CNCCOc1cccnc1)c1ccc(OC(F)(F)F)cc1	ZINC000819069638	EF	On-Demand	Anodyne	ADRB2	41	55
O[C@H](CNCCOc1cccnc1)c1ccc(OC(F)(F)F)cc1	ZINC000819069638	EF	On-Demand	Anodyne	ADRB1	42	56
O[C@H](CNCCOc1cccnc1)c1ccc(OC(F)(F)F)cc1	ZINC000819069638	EF	On-Demand	Anodyne	ADRB3	99	56
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1ccc(C(F)(F)F)cc1	ZINC000819069640	FF	On-Demand	Anodyne	ADRB3	54	45
O[C@@H](CNCCOc1cccnc1)c1ccc(F)cc1F	ZINC000819069651	CE	On-Demand	Anodyne	ADRB2	21	46
O[C@@H](CNCCOc1cccnc1)c1ccc(F)cc1F	ZINC000819069651	CE	On-Demand	Anodyne	ADRB1	30	46
O[C@@H](CNCCOc1cccnc1)c1ccc(F)cc1F	ZINC000819069651	CE	On-Demand	Anodyne	ADRB3	52	48
O[C@H](CNCCOc1cccnc1)c1ccc(F)cc1F	ZINC000819069652	CE	On-Demand	Anodyne	ADRB2	21	46
O[C@H](CNCCOc1cccnc1)c1ccc(F)cc1F	ZINC000819069652	CE	On-Demand	Anodyne	ADRB1	30	46
O[C@H](CNCCOc1cccnc1)c1ccc(F)cc1F	ZINC000819069652	CE	On-Demand	Anodyne	ADRB3	52	48
O=C(CCNCCOc1cccnc1)Nc1ccccc1	ZINC000819069657	CE	On-Demand	Anodyne	ADRB1	23	44
O=C(CCNCCOc1cccnc1)Nc1ccccc1	ZINC000819069657	CE	On-Demand	Anodyne	ADRB3	33	40
O=C(CCNCCOc1cccnc1)Nc1ccccc1	ZINC000819069657	CE	On-Demand	Anodyne	LTA4H	35	43
O=C(CCNCCOc1cccnc1)Nc1ccccc1	ZINC000819069657	CE	On-Demand	Anodyne	CHRNA7	21	44
O=C(CCNCCOc1cccnc1)Nc1ccccc1	ZINC000819069657	CE	On-Demand	Anodyne	NAMPT	26	53
CN(CCC#N)C[C@H](O)CNCCOc1cccnc1	ZINC000819069662	CC	On-Demand	Mild	ADRB1	15	41
CN(CCC#N)C[C@@H](O)CNCCOc1cccnc1	ZINC000819069663	CC	On-Demand	Mild	ADRB1	15	41
O=C(CCNCCOc1cccnc1)Nc1cccc(Br)c1	ZINC000819069668	FF	On-Demand	Anodyne	EGFR	39	41
O=C(CCNCCOc1cccnc1)Nc1cccc(Br)c1	ZINC000819069668	FF	On-Demand	Anodyne	HDAC3	15	44
O[C@@H](CNCCOc1cccnc1)COc1ccc(F)cc1	ZINC000819069671	DD	On-Demand	Anodyne	ADRB2	62	59
O[C@@H](CNCCOc1cccnc1)COc1ccc(F)cc1	ZINC000819069671	DD	On-Demand	Anodyne	ADRB1	102	59
O[C@@H](CNCCOc1cccnc1)COc1ccc(F)cc1	ZINC000819069671	DD	On-Demand	Anodyne	DRD4	17	42
O[C@@H](CNCCOc1cccnc1)COc1ccc(F)cc1	ZINC000819069671	DD	On-Demand	Anodyne	ADRB3	74	59
O[C@@H](CNCCOc1cccnc1)COc1ccc(F)cc1	ZINC000819069671	DD	On-Demand	Anodyne	NMT1	27	41
O[C@H](CNCCOc1cccnc1)COc1ccc(F)cc1	ZINC000819069672	DD	On-Demand	Anodyne	ADRB2	62	59
O[C@H](CNCCOc1cccnc1)COc1ccc(F)cc1	ZINC000819069672	DD	On-Demand	Anodyne	ADRB1	102	59
O[C@H](CNCCOc1cccnc1)COc1ccc(F)cc1	ZINC000819069672	DD	On-Demand	Anodyne	DRD4	17	42
O[C@H](CNCCOc1cccnc1)COc1ccc(F)cc1	ZINC000819069672	DD	On-Demand	Anodyne	ADRB3	74	59
O[C@H](CNCCOc1cccnc1)COc1ccc(F)cc1	ZINC000819069672	DD	On-Demand	Anodyne	NMT1	27	41
COc1ccc(OC)c([C@H](O)CNCCc2ccc3c(c2)CCO3)c1	ZINC000819069673	EF	On-Demand	Anodyne	ADRB2	28	50
COc1ccc(OC)c([C@H](O)CNCCc2ccc3c(c2)CCO3)c1	ZINC000819069673	EF	On-Demand	Anodyne	ADRB1	29	41
O[C@H](CNCCOc1cccnc1)COc1ccccc1Cl	ZINC000819069675	DE	On-Demand	Anodyne	ADRB2	48	53
O[C@H](CNCCOc1cccnc1)COc1ccccc1Cl	ZINC000819069675	DE	On-Demand	Anodyne	ADRB1	76	50
O[C@H](CNCCOc1cccnc1)COc1ccccc1Cl	ZINC000819069675	DE	On-Demand	Anodyne	ADRB3	46	49
O[C@@H](CNCCOc1cccnc1)COc1ccccc1Cl	ZINC000819069676	DE	On-Demand	Anodyne	ADRB2	48	53
O[C@@H](CNCCOc1cccnc1)COc1ccccc1Cl	ZINC000819069676	DE	On-Demand	Anodyne	ADRB1	76	50
O[C@@H](CNCCOc1cccnc1)COc1ccccc1Cl	ZINC000819069676	DE	On-Demand	Anodyne	ADRB3	46	49
CCOc1cc(CNC[C@H](O)c2cccc3ccccc23)ccc1OC	ZINC000819069681	FI	On-Demand	Anodyne	DRTS_TRYCR	47	34
O[C@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cccc(F)c1	ZINC000819069683	GH	On-Demand	Anodyne	ADRB3	23	40
O[C@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cccc(F)c1	ZINC000819069684	GH	On-Demand	Anodyne	ADRB3	23	40
O[C@@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cccc(F)c1	ZINC000819069685	GH	On-Demand	Anodyne	ADRB3	23	40
O[C@@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1cccc(F)c1	ZINC000819069686	GH	On-Demand	Anodyne	ADRB3	23	40
O[C@H](CNCCOc1cccnc1)COc1ccc2ccccc2c1	ZINC000819069691	EF	On-Demand	Anodyne	ADRB2	62	55
O[C@H](CNCCOc1cccnc1)COc1ccc2ccccc2c1	ZINC000819069691	EF	On-Demand	Anodyne	ADRB1	86	55
O[C@H](CNCCOc1cccnc1)COc1ccc2ccccc2c1	ZINC000819069691	EF	On-Demand	Anodyne	ADRB3	66	55
O[C@@H](CNCCOc1cccnc1)COc1ccc2ccccc2c1	ZINC000819069692	EF	On-Demand	Anodyne	ADRB2	62	55
O[C@@H](CNCCOc1cccnc1)COc1ccc2ccccc2c1	ZINC000819069692	EF	On-Demand	Anodyne	ADRB1	86	55
O[C@@H](CNCCOc1cccnc1)COc1ccc2ccccc2c1	ZINC000819069692	EF	On-Demand	Anodyne	ADRB3	66	55
O[C@@H](CNCCOc1cccnc1)COc1ccc(Cl)cc1	ZINC000819069693	DE	On-Demand	Anodyne	ADRB2	57	59
O[C@@H](CNCCOc1cccnc1)COc1ccc(Cl)cc1	ZINC000819069693	DE	On-Demand	Anodyne	ADRB1	96	59
O[C@@H](CNCCOc1cccnc1)COc1ccc(Cl)cc1	ZINC000819069693	DE	On-Demand	Anodyne	DRD4	18	49
O[C@@H](CNCCOc1cccnc1)COc1ccc(Cl)cc1	ZINC000819069693	DE	On-Demand	Anodyne	ADRB3	67	59
O[C@H](CNCCOc1cccnc1)COc1ccc(Cl)cc1	ZINC000819069694	DE	On-Demand	Anodyne	ADRB2	57	59
O[C@H](CNCCOc1cccnc1)COc1ccc(Cl)cc1	ZINC000819069694	DE	On-Demand	Anodyne	ADRB1	96	59
O[C@H](CNCCOc1cccnc1)COc1ccc(Cl)cc1	ZINC000819069694	DE	On-Demand	Anodyne	DRD4	18	49
O[C@H](CNCCOc1cccnc1)COc1ccc(Cl)cc1	ZINC000819069694	DE	On-Demand	Anodyne	ADRB3	67	59
O[C@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccccc1	ZINC000819069695	FG	On-Demand	Anodyne	ADRB1	21	44
O[C@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccccc1	ZINC000819069695	FG	On-Demand	Anodyne	ADRB3	38	44
O[C@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccccc1	ZINC000819069695	FG	On-Demand	Anodyne	PIM1	15	40
O[C@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccccc1	ZINC000819069696	FG	On-Demand	Anodyne	ADRB1	21	44
O[C@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccccc1	ZINC000819069696	FG	On-Demand	Anodyne	ADRB3	38	44
O[C@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccccc1	ZINC000819069696	FG	On-Demand	Anodyne	PIM1	15	40
O[C@@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccccc1	ZINC000819069697	FG	On-Demand	Anodyne	ADRB1	21	44
O[C@@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccccc1	ZINC000819069697	FG	On-Demand	Anodyne	ADRB3	38	44
O[C@@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccccc1	ZINC000819069697	FG	On-Demand	Anodyne	PIM1	15	40
O[C@@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccccc1	ZINC000819069698	FG	On-Demand	Anodyne	ADRB1	21	44
O[C@@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccccc1	ZINC000819069698	FG	On-Demand	Anodyne	ADRB3	38	44
O[C@@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccccc1	ZINC000819069698	FG	On-Demand	Anodyne	PIM1	15	40
O[C@H](CNCCOc1cccnc1)Cc1ccccc1	ZINC000819069703	CD	On-Demand	Anodyne	ADRB2	41	50
O[C@H](CNCCOc1cccnc1)Cc1ccccc1	ZINC000819069703	CD	On-Demand	Anodyne	ADRB1	62	50
O[C@H](CNCCOc1cccnc1)Cc1ccccc1	ZINC000819069703	CD	On-Demand	Anodyne	ADRB3	74	50
O[C@@H](CNCCOc1cccnc1)Cc1ccccc1	ZINC000819069704	CD	On-Demand	Anodyne	ADRB2	41	50
O[C@@H](CNCCOc1cccnc1)Cc1ccccc1	ZINC000819069704	CD	On-Demand	Anodyne	ADRB1	62	50
O[C@@H](CNCCOc1cccnc1)Cc1ccccc1	ZINC000819069704	CD	On-Demand	Anodyne	ADRB3	74	50
O[C@@H](CNCCOc1cccnc1)c1ccc(F)c(Br)c1	ZINC000819069705	FF	On-Demand	Anodyne	ADRB2	33	52
O[C@@H](CNCCOc1cccnc1)c1ccc(F)c(Br)c1	ZINC000819069705	FF	On-Demand	Anodyne	ADRB1	41	52
O[C@@H](CNCCOc1cccnc1)c1ccc(F)c(Br)c1	ZINC000819069705	FF	On-Demand	Anodyne	ADRB3	80	52
O[C@H](CNCCOc1cccnc1)c1ccc(F)c(Br)c1	ZINC000819069706	FF	On-Demand	Anodyne	ADRB2	33	52
O[C@H](CNCCOc1cccnc1)c1ccc(F)c(Br)c1	ZINC000819069706	FF	On-Demand	Anodyne	ADRB1	41	52
O[C@H](CNCCOc1cccnc1)c1ccc(F)c(Br)c1	ZINC000819069706	FF	On-Demand	Anodyne	ADRB3	80	52
CC(=O)Nc1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819069714	ED	On-Demand	Anodyne	ADRB2	71	58
CC(=O)Nc1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819069714	ED	On-Demand	Anodyne	ADRB1	122	58
CC(=O)Nc1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819069714	ED	On-Demand	Anodyne	GRIN1	27	43
CC(=O)Nc1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819069714	ED	On-Demand	Anodyne	ADRB3	112	58
CC(=O)Nc1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819069714	ED	On-Demand	Anodyne	FAAH	15	41
CC(=O)Nc1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819069715	ED	On-Demand	Anodyne	ADRB2	71	58
CC(=O)Nc1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819069715	ED	On-Demand	Anodyne	ADRB1	122	58
CC(=O)Nc1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819069715	ED	On-Demand	Anodyne	GRIN1	27	43
CC(=O)Nc1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819069715	ED	On-Demand	Anodyne	ADRB3	112	58
CC(=O)Nc1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819069715	ED	On-Demand	Anodyne	FAAH	15	41
O[C@@H](CNCCc1csc(N2CCCC2)n1)c1cccc(F)c1	ZINC000819069838	EF	On-Demand	Anodyne	ADRB1	21	42
O[C@@H](CNCCc1csc(N2CCCC2)n1)c1cccc(F)c1	ZINC000819069838	EF	On-Demand	Anodyne	ADRB3	62	42
O[C@H](CNCCc1csc(N2CCCC2)n1)c1cccc(F)c1	ZINC000819069840	EF	On-Demand	Anodyne	ADRB1	21	42
O[C@H](CNCCc1csc(N2CCCC2)n1)c1cccc(F)c1	ZINC000819069840	EF	On-Demand	Anodyne	ADRB3	62	42
CONC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819069868	BC	On-Demand	Anodyne	DRD4	40	30
CONC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819069868	BC	On-Demand	Anodyne	MTNR1A	44	41
CONC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819069868	BC	On-Demand	Anodyne	MTNR1B	42	41
COC(=O)CCCCCCNC(=O)[C@@H]1C[C@H]1c1ccc(C)cc1	ZINC000819069877	DG	On-Demand	Anodyne	SLC6A3	16	46
CONC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819069878	BC	On-Demand	Anodyne	DRD4	40	30
CONC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819069878	BC	On-Demand	Anodyne	MTNR1A	44	41
CONC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819069878	BC	On-Demand	Anodyne	MTNR1B	42	41
COC(=O)CCCCCCNC(=O)[C@@H]1C[C@@H]1c1ccc(C)cc1	ZINC000819069879	DG	On-Demand	Anodyne	SLC6A3	16	46
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)COC)c1	ZINC000819069880	CD	On-Demand	Mild	PDS	45	35
COC(=O)CCCCCCNC(=O)[C@H]1C[C@H]1c1ccc(C)cc1	ZINC000819069882	DG	On-Demand	Anodyne	SLC6A3	16	46
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)COC)c1	ZINC000819069883	CD	On-Demand	Mild	PDS	45	35
COC(=O)CCCCCCNC(=O)[C@H]1C[C@@H]1c1ccc(C)cc1	ZINC000819069884	DG	On-Demand	Anodyne	SLC6A3	16	46
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)COC)c1	ZINC000819069886	CD	On-Demand	Mild	PDS	45	35
O=C(/C=C\[C@H]1CCCO1)N1CCCN(C(=O)c2ccccc2)CC1	ZINC000819069887	EE	On-Demand	Anodyne	PREP	19	41
O=C(/C=C\[C@H]1CCCO1)N1CCCN(C(=O)c2ccccc2)CC1	ZINC000819069887	EE	On-Demand	Anodyne	L3MBTL3	79	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)COC)c1	ZINC000819069888	CD	On-Demand	Mild	PDS	45	35
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)CN2CCCC2=O)c1	ZINC000819069890	ED	On-Demand	Mild	BACE1	24	42
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)CN2CCCC2=O)c1	ZINC000819069891	ED	On-Demand	Mild	BACE1	24	42
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)CN2CCCC2=O)c1	ZINC000819069893	ED	On-Demand	Mild	BACE1	24	42
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)CN2CCCC2=O)c1	ZINC000819069895	ED	On-Demand	Mild	BACE1	24	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(NC(=O)C3CC3)c1)C2	ZINC000819069908	FF	On-Demand	Anodyne	KCNK3	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(NC(=O)C3CC3)c1)C2	ZINC000819069910	FF	On-Demand	Anodyne	KCNK3	21	40
O=C(c1ccc(NCC[C@@H]2CC2(Cl)Cl)cc1)N1CCCC1	ZINC000819069919	EH	On-Demand	Anodyne	MLYCD	18	41
O=C(c1ccc(NCC[C@@H]2CC2(Cl)Cl)cc1)N1CCCC1	ZINC000819069919	EH	On-Demand	Anodyne	L3MBTL3	81	41
O=C(c1ccc(NCC[C@H]2CC2(Cl)Cl)cc1)N1CCCC1	ZINC000819069921	EH	On-Demand	Anodyne	MLYCD	18	41
O=C(c1ccc(NCC[C@H]2CC2(Cl)Cl)cc1)N1CCCC1	ZINC000819069921	EH	On-Demand	Anodyne	L3MBTL3	81	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(NC(=O)C2CC2)c1	ZINC000819069935	FF	On-Demand	Anodyne	TYK2	46	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(NC(=O)C2CC2)c1	ZINC000819069935	FF	On-Demand	Anodyne	KCNK3	28	43
O=C(/C=C\[C@@H]1CCCO1)NC[C@H]1CCCc2ccccc21	ZINC000819069938	CF	On-Demand	Anodyne	HTR6	21	40
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H]1CCCc2ccccc21	ZINC000819069940	CF	On-Demand	Anodyne	HTR6	21	40
O=C(/C=C/[C@@H]1CCCO1)NC[C@H]1CCCc2ccccc21	ZINC000819069942	CF	On-Demand	Anodyne	HTR6	21	40
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H]1CCCc2ccccc21	ZINC000819069944	CF	On-Demand	Anodyne	HTR6	21	40
O=C(c1ccc(NCC[C@@H]2CC2(Cl)Cl)cc1Cl)N1CCOCC1	ZINC000819069946	GH	On-Demand	Anodyne	AVPR2	20	40
O=C(c1ccc(NCC[C@H]2CC2(Cl)Cl)cc1Cl)N1CCOCC1	ZINC000819069949	GH	On-Demand	Anodyne	AVPR2	20	40
COc1ccc(C(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1	ZINC000819069952	ED	On-Demand	Anodyne	L3MBTL3	69	40
COc1ccc(C(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1	ZINC000819069955	ED	On-Demand	Anodyne	L3MBTL3	69	40
COc1ccc(C(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1	ZINC000819069958	ED	On-Demand	Anodyne	L3MBTL3	69	40
COc1ccc(C(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1	ZINC000819069960	ED	On-Demand	Anodyne	L3MBTL3	69	40
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)CSC)c1	ZINC000819069966	CE	On-Demand	Mild	PDS	56	37
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)CSC)c1	ZINC000819069967	CE	On-Demand	Mild	PDS	56	37
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)CSC)c1	ZINC000819069968	CE	On-Demand	Mild	PDS	56	37
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)CSC)c1	ZINC000819069969	CE	On-Demand	Mild	PDS	56	37
CC[C@@H](C#N)Oc1cccc(CNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819069970	GH	On-Demand	Mild	MTNR1B	15	42
CC[C@H](C#N)Oc1cccc(CNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819069971	GH	On-Demand	Mild	MTNR1B	15	42
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819069972	EG	On-Demand	Mild	ADRB1	18	41
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819069972	EG	On-Demand	Mild	ADRB3	22	41
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819069973	EG	On-Demand	Mild	ADRB1	18	41
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819069973	EG	On-Demand	Mild	ADRB3	22	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819069974	EG	On-Demand	Mild	ADRB1	18	41
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819069974	EG	On-Demand	Mild	ADRB3	22	41
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819069975	EG	On-Demand	Mild	ADRB1	18	41
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819069975	EG	On-Demand	Mild	ADRB3	22	41
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(C(=O)c2ccccc2)CC1	ZINC000819069977	EE	On-Demand	Anodyne	PREP	19	41
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(C(=O)c2ccccc2)CC1	ZINC000819069977	EE	On-Demand	Anodyne	L3MBTL3	79	40
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)Cc2ccccc2C(F)(F)F)c1	ZINC000819069978	GI	On-Demand	Mild	PDS	53	35
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(C(=O)c2ccccc2)CC1	ZINC000819069979	EE	On-Demand	Anodyne	PREP	19	41
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(C(=O)c2ccccc2)CC1	ZINC000819069979	EE	On-Demand	Anodyne	L3MBTL3	79	40
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)Cc2ccccc2C(F)(F)F)c1	ZINC000819069980	GI	On-Demand	Mild	PDS	53	35
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)Cc2ccccc2C(F)(F)F)c1	ZINC000819069981	GI	On-Demand	Mild	PDS	53	35
O=C(/C=C/[C@H]1CCCO1)N1CCCN(C(=O)c2ccccc2)CC1	ZINC000819069982	EE	On-Demand	Anodyne	PREP	19	41
O=C(/C=C/[C@H]1CCCO1)N1CCCN(C(=O)c2ccccc2)CC1	ZINC000819069982	EE	On-Demand	Anodyne	L3MBTL3	79	40
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)Cc2ccccc2C(F)(F)F)c1	ZINC000819069983	GI	On-Demand	Mild	PDS	53	35
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2ccccc2F)c1	ZINC000819069997	EG	On-Demand	Mild	PDS	42	35
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccccc2F)c1	ZINC000819069998	EG	On-Demand	Mild	PDS	42	35
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccccc2F)c1	ZINC000819070000	EG	On-Demand	Mild	PDS	42	35
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2ccccc2F)c1	ZINC000819070002	EG	On-Demand	Mild	PDS	42	35
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819070003	GI	On-Demand	Mild	PDS	49	38
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819070005	GI	On-Demand	Mild	PDS	49	38
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819070006	GI	On-Demand	Mild	PDS	49	38
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819070007	GI	On-Demand	Mild	PDS	49	38
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccccc2C)c1	ZINC000819070010	DG	On-Demand	Mild	PDS	44	34
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2ccccc2C)c1	ZINC000819070011	DG	On-Demand	Mild	PDS	44	34
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2ccccc2C)c1	ZINC000819070012	DG	On-Demand	Mild	PDS	44	34
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2ccccc2C)c1	ZINC000819070013	DG	On-Demand	Mild	PDS	44	34
O[C@@H](CNCCOc1cccnc1)c1cccc(F)c1	ZINC000819070023	CD	On-Demand	Anodyne	ADRB2	40	54
O[C@@H](CNCCOc1cccnc1)c1cccc(F)c1	ZINC000819070023	CD	On-Demand	Anodyne	ADRB1	54	54
O[C@@H](CNCCOc1cccnc1)c1cccc(F)c1	ZINC000819070023	CD	On-Demand	Anodyne	ADRB3	113	56
O[C@H](CNCCOc1cccnc1)c1cccc(F)c1	ZINC000819070024	CD	On-Demand	Anodyne	ADRB2	40	54
O[C@H](CNCCOc1cccnc1)c1cccc(F)c1	ZINC000819070024	CD	On-Demand	Anodyne	ADRB1	54	54
O[C@H](CNCCOc1cccnc1)c1cccc(F)c1	ZINC000819070024	CD	On-Demand	Anodyne	ADRB3	113	56
O[C@@H](CNCCOc1cccnc1)c1ccccc1C(F)(F)F	ZINC000819070026	EF	On-Demand	Anodyne	ADRB2	21	52
O[C@@H](CNCCOc1cccnc1)c1ccccc1C(F)(F)F	ZINC000819070026	EF	On-Demand	Anodyne	ADRB1	30	53
O[C@@H](CNCCOc1cccnc1)c1ccccc1C(F)(F)F	ZINC000819070026	EF	On-Demand	Anodyne	ADRB3	68	53
O[C@H](CNCCOc1cccnc1)c1ccccc1C(F)(F)F	ZINC000819070027	EF	On-Demand	Anodyne	ADRB2	21	52
O[C@H](CNCCOc1cccnc1)c1ccccc1C(F)(F)F	ZINC000819070027	EF	On-Demand	Anodyne	ADRB1	30	53
O[C@H](CNCCOc1cccnc1)c1ccccc1C(F)(F)F	ZINC000819070027	EF	On-Demand	Anodyne	ADRB3	68	53
O=C(CCNCCOc1cccnc1)Nc1ccc(N2CCCC2=O)cc1	ZINC000819070030	FE	On-Demand	Anodyne	CHRNA7	20	40
O[C@@H](CNCCOc1cccnc1)COc1cccc(Br)c1	ZINC000819070033	FE	On-Demand	Anodyne	ADRB2	44	52
O[C@@H](CNCCOc1cccnc1)COc1cccc(Br)c1	ZINC000819070033	FE	On-Demand	Anodyne	ADRB1	69	52
O[C@@H](CNCCOc1cccnc1)COc1cccc(Br)c1	ZINC000819070033	FE	On-Demand	Anodyne	ADRB3	47	52
O[C@H](CNCCOc1cccnc1)COc1cccc(Br)c1	ZINC000819070034	FE	On-Demand	Anodyne	ADRB2	44	52
O[C@H](CNCCOc1cccnc1)COc1cccc(Br)c1	ZINC000819070034	FE	On-Demand	Anodyne	ADRB1	69	52
O[C@H](CNCCOc1cccnc1)COc1cccc(Br)c1	ZINC000819070034	FE	On-Demand	Anodyne	ADRB3	47	52
O[C@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccc(F)cc1	ZINC000819070036	GH	On-Demand	Anodyne	ADRB1	15	40
O[C@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccc(F)cc1	ZINC000819070036	GH	On-Demand	Anodyne	ADRB3	27	40
O[C@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccc(F)cc1	ZINC000819070037	GH	On-Demand	Anodyne	ADRB1	15	40
O[C@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccc(F)cc1	ZINC000819070037	GH	On-Demand	Anodyne	ADRB3	27	40
O[C@@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccc(F)cc1	ZINC000819070038	GH	On-Demand	Anodyne	ADRB1	15	40
O[C@@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccc(F)cc1	ZINC000819070038	GH	On-Demand	Anodyne	ADRB3	27	40
O[C@@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccc(F)cc1	ZINC000819070039	GH	On-Demand	Anodyne	ADRB1	15	40
O[C@@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)c1ccc(F)cc1	ZINC000819070039	GH	On-Demand	Anodyne	ADRB3	27	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819070040	ED	On-Demand	Anodyne	ADRB2	47	52
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819070040	ED	On-Demand	Anodyne	ADRB1	52	52
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819070040	ED	On-Demand	Anodyne	ADRB3	139	58
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2cccnc2)cc1	ZINC000819070041	ED	On-Demand	Anodyne	ADRB2	47	52
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2cccnc2)cc1	ZINC000819070041	ED	On-Demand	Anodyne	ADRB1	52	52
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2cccnc2)cc1	ZINC000819070041	ED	On-Demand	Anodyne	ADRB3	139	58
C[C@@H](c1cccc(NCC[C@@H]2CC2(Cl)Cl)c1)N1CCOCC1	ZINC000819070045	EI	On-Demand	Anodyne	ICMT	47	32
C[C@@H](c1cccc(NCC[C@H]2CC2(Cl)Cl)c1)N1CCOCC1	ZINC000819070048	EI	On-Demand	Anodyne	ICMT	47	32
O[C@H](CNCCOc1cccnc1)COc1c(Cl)cccc1Cl	ZINC000819070049	FF	On-Demand	Anodyne	ADRB2	36	49
O[C@H](CNCCOc1cccnc1)COc1c(Cl)cccc1Cl	ZINC000819070049	FF	On-Demand	Anodyne	ADRB1	62	49
O[C@H](CNCCOc1cccnc1)COc1c(Cl)cccc1Cl	ZINC000819070049	FF	On-Demand	Anodyne	ADRB3	40	49
O[C@@H](CNCCOc1cccnc1)COc1c(Cl)cccc1Cl	ZINC000819070050	FF	On-Demand	Anodyne	ADRB2	36	49
O[C@@H](CNCCOc1cccnc1)COc1c(Cl)cccc1Cl	ZINC000819070050	FF	On-Demand	Anodyne	ADRB1	62	49
O[C@@H](CNCCOc1cccnc1)COc1c(Cl)cccc1Cl	ZINC000819070050	FF	On-Demand	Anodyne	ADRB3	40	49
COC[C@@H](O)CNCCOc1cccnc1	ZINC000819070074	BC	On-Demand	Anodyne	ADRB2	49	51
COC[C@@H](O)CNCCOc1cccnc1	ZINC000819070074	BC	On-Demand	Anodyne	ADRB1	72	51
COC[C@@H](O)CNCCOc1cccnc1	ZINC000819070074	BC	On-Demand	Anodyne	ADRB3	59	50
CCOC[C@H](O)CNCCOc1cccnc1	ZINC000819070084	BC	On-Demand	Anodyne	ADRB2	39	49
CCOC[C@H](O)CNCCOc1cccnc1	ZINC000819070084	BC	On-Demand	Anodyne	ADRB1	58	49
CCOC[C@H](O)CNCCOc1cccnc1	ZINC000819070084	BC	On-Demand	Anodyne	ADRB3	44	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2ccc3c(c2)CCO3)CC1	ZINC000819070089	GF	On-Demand	Anodyne	GPR119	35	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2ccc3c(c2)CCO3)CC1	ZINC000819070090	GF	On-Demand	Anodyne	GPR119	35	47
O=S(=O)(CCNCCOc1cccnc1)c1ccccc1	ZINC000819070095	DD	On-Demand	Anodyne	DRD4	18	41
O=S(=O)(CCNCCOc1cccnc1)c1ccccc1	ZINC000819070095	DD	On-Demand	Anodyne	NAMPT	15	47
O[C@@H](CNCCOc1cccnc1)COc1cccc2[nH]ccc12	ZINC000819070097	ED	On-Demand	Anodyne	ADRB2	34	56
O[C@@H](CNCCOc1cccnc1)COc1cccc2[nH]ccc12	ZINC000819070097	ED	On-Demand	Anodyne	ADRB1	70	56
O[C@@H](CNCCOc1cccnc1)COc1cccc2[nH]ccc12	ZINC000819070097	ED	On-Demand	Anodyne	ADRB3	33	56
O[C@H](CNCCOc1cccnc1)COc1cccc2[nH]ccc12	ZINC000819070098	ED	On-Demand	Anodyne	ADRB2	34	56
O[C@H](CNCCOc1cccnc1)COc1cccc2[nH]ccc12	ZINC000819070098	ED	On-Demand	Anodyne	ADRB1	70	56
O[C@H](CNCCOc1cccnc1)COc1cccc2[nH]ccc12	ZINC000819070098	ED	On-Demand	Anodyne	ADRB3	33	56
O[C@H](CNCCc1ccc2c(c1)CCO2)c1cccc(C(F)(F)F)c1	ZINC000819070102	FH	On-Demand	Anodyne	ADRB1	27	43
O[C@H](CNCCc1ccc2c(c1)CCO2)c1cccc(C(F)(F)F)c1	ZINC000819070102	FH	On-Demand	Anodyne	ADRB3	53	43
O[C@@H](CNCCOc1cccnc1)c1ccc(F)c(F)c1	ZINC000819070104	CE	On-Demand	Anodyne	ADRB2	39	52
O[C@@H](CNCCOc1cccnc1)c1ccc(F)c(F)c1	ZINC000819070104	CE	On-Demand	Anodyne	ADRB1	48	52
O[C@@H](CNCCOc1cccnc1)c1ccc(F)c(F)c1	ZINC000819070104	CE	On-Demand	Anodyne	ADRB3	93	53
O[C@H](CNCCOc1cccnc1)c1ccc(F)c(F)c1	ZINC000819070105	CE	On-Demand	Anodyne	ADRB2	39	52
O[C@H](CNCCOc1cccnc1)c1ccc(F)c(F)c1	ZINC000819070105	CE	On-Demand	Anodyne	ADRB1	48	52
O[C@H](CNCCOc1cccnc1)c1ccc(F)c(F)c1	ZINC000819070105	CE	On-Demand	Anodyne	ADRB3	93	53
Cc1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819070110	DD	On-Demand	Anodyne	ADRB2	63	58
Cc1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819070110	DD	On-Demand	Anodyne	ADRB1	100	58
Cc1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819070110	DD	On-Demand	Anodyne	DRD4	19	49
Cc1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819070110	DD	On-Demand	Anodyne	ADRB3	72	57
Cc1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819070111	DD	On-Demand	Anodyne	ADRB2	63	58
Cc1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819070111	DD	On-Demand	Anodyne	ADRB1	100	58
Cc1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819070111	DD	On-Demand	Anodyne	DRD4	19	49
Cc1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819070111	DD	On-Demand	Anodyne	ADRB3	72	57
CC(=O)c1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819070113	ED	On-Demand	Anodyne	ADRB2	61	53
CC(=O)c1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819070113	ED	On-Demand	Anodyne	ADRB1	104	58
CC(=O)c1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819070113	ED	On-Demand	Anodyne	ADRB3	82	58
CC(=O)c1ccc(OC[C@@H](O)CNCCOc2cccnc2)cc1	ZINC000819070113	ED	On-Demand	Anodyne	ABCB1	16	60
CC(=O)c1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819070114	ED	On-Demand	Anodyne	ADRB2	61	53
CC(=O)c1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819070114	ED	On-Demand	Anodyne	ADRB1	104	58
CC(=O)c1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819070114	ED	On-Demand	Anodyne	ADRB3	82	58
CC(=O)c1ccc(OC[C@H](O)CNCCOc2cccnc2)cc1	ZINC000819070114	ED	On-Demand	Anodyne	ABCB1	16	60
O[C@@H](CNCCOc1cccnc1)c1ccc(Cl)cc1Cl	ZINC000819070115	EG	On-Demand	Anodyne	ADRB2	22	48
O[C@@H](CNCCOc1cccnc1)c1ccc(Cl)cc1Cl	ZINC000819070115	EG	On-Demand	Anodyne	ADRB1	43	48
O[C@@H](CNCCOc1cccnc1)c1ccc(Cl)cc1Cl	ZINC000819070115	EG	On-Demand	Anodyne	ADRB3	53	48
O[C@H](CNCCOc1cccnc1)c1ccc(Cl)cc1Cl	ZINC000819070116	EG	On-Demand	Anodyne	ADRB2	22	48
O[C@H](CNCCOc1cccnc1)c1ccc(Cl)cc1Cl	ZINC000819070116	EG	On-Demand	Anodyne	ADRB1	43	48
O[C@H](CNCCOc1cccnc1)c1ccc(Cl)cc1Cl	ZINC000819070116	EG	On-Demand	Anodyne	ADRB3	53	48
CCOc1cc(CNCCC(=O)N(C)OC)ccc1OC	ZINC000819070117	CD	On-Demand	Anodyne	LPAR2	39	45
CCOc1cc(CNCCC(=O)N(C)OC)ccc1OC	ZINC000819070117	CD	On-Demand	Anodyne	PDE6A	41	32
CCOc1cc(CNCCC(=O)N(C)OC)ccc1OC	ZINC000819070117	CD	On-Demand	Anodyne	S1PR2	40	34
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1cccc(Cl)c1	ZINC000819070201	DG	On-Demand	Anodyne	ADRB2	56	40
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1cccc(Cl)c1	ZINC000819070201	DG	On-Demand	Anodyne	ADRB1	68	57
O[C@@H](CNCCc1ccc2c(c1)CCO2)c1cccc(Cl)c1	ZINC000819070201	DG	On-Demand	Anodyne	ADRB3	95	57
O[C@H](CNCCc1ccc2c(c1)CCO2)c1cccc(Cl)c1	ZINC000819070203	DG	On-Demand	Anodyne	ADRB2	56	40
O[C@H](CNCCc1ccc2c(c1)CCO2)c1cccc(Cl)c1	ZINC000819070203	DG	On-Demand	Anodyne	ADRB1	68	57
O[C@H](CNCCc1ccc2c(c1)CCO2)c1cccc(Cl)c1	ZINC000819070203	DG	On-Demand	Anodyne	ADRB3	95	57
O[C@@H](CNCCOc1cccnc1)COCc1ccc(Cl)cc1	ZINC000819070210	EE	On-Demand	Anodyne	ADRB2	35	55
O[C@@H](CNCCOc1cccnc1)COCc1ccc(Cl)cc1	ZINC000819070210	EE	On-Demand	Anodyne	ADRB1	59	55
O[C@@H](CNCCOc1cccnc1)COCc1ccc(Cl)cc1	ZINC000819070210	EE	On-Demand	Anodyne	ADRB3	56	55
O[C@H](CNCCOc1cccnc1)COCc1ccc(Cl)cc1	ZINC000819070213	EE	On-Demand	Anodyne	ADRB2	35	55
O[C@H](CNCCOc1cccnc1)COCc1ccc(Cl)cc1	ZINC000819070213	EE	On-Demand	Anodyne	ADRB1	59	55
O[C@H](CNCCOc1cccnc1)COCc1ccc(Cl)cc1	ZINC000819070213	EE	On-Demand	Anodyne	ADRB3	56	55
C[C@@H](CNCCOc1cccnc1)S(C)(=O)=O	ZINC000819070219	CC	On-Demand	Anodyne	ADRB1	22	44
C[C@@H](CNCCOc1cccnc1)S(C)(=O)=O	ZINC000819070219	CC	On-Demand	Anodyne	ADRB3	40	49
C[C@H](CNCCOc1cccnc1)S(C)(=O)=O	ZINC000819070220	CC	On-Demand	Anodyne	ADRB1	22	44
C[C@H](CNCCOc1cccnc1)S(C)(=O)=O	ZINC000819070220	CC	On-Demand	Anodyne	ADRB3	40	49
Cc1ccccc1[C@@H](O)CNCCc1ccc2c(c1)CCO2	ZINC000819070234	CF	On-Demand	Anodyne	ADRB2	41	35
CC[C@H](C#N)Oc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1OC	ZINC000819070240	GG	On-Demand	Mild	CACNA1D	42	38
O[C@H](CNCCOc1cccnc1)CC1CCCC1	ZINC000819070241	CD	On-Demand	Anodyne	ADRB2	26	45
O[C@H](CNCCOc1cccnc1)CC1CCCC1	ZINC000819070241	CD	On-Demand	Anodyne	ADRB1	48	48
O[C@H](CNCCOc1cccnc1)CC1CCCC1	ZINC000819070241	CD	On-Demand	Anodyne	ADRB3	42	48
CC[C@H](C#N)Oc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1OC	ZINC000819070242	GG	On-Demand	Mild	CACNA1D	42	38
O[C@@H](CNCCOc1cccnc1)CC1CCCC1	ZINC000819070243	CD	On-Demand	Anodyne	ADRB2	26	45
O[C@@H](CNCCOc1cccnc1)CC1CCCC1	ZINC000819070243	CD	On-Demand	Anodyne	ADRB1	48	48
O[C@@H](CNCCOc1cccnc1)CC1CCCC1	ZINC000819070243	CD	On-Demand	Anodyne	ADRB3	42	48
O[C@@H](CNCCC1CCOCC1)c1cccc(Cl)c1	ZINC000819070258	CF	On-Demand	Anodyne	ADRB1	50	49
O[C@@H](CNCCC1CCOCC1)c1cccc(Cl)c1	ZINC000819070258	CF	On-Demand	Anodyne	ADRB3	62	49
O[C@@H](CNCCC1CCOCC1)c1cccc(Cl)c1	ZINC000819070258	CF	On-Demand	Anodyne	CYP3A4	47	36
O[C@H](CNCCC1CCOCC1)c1cccc(Cl)c1	ZINC000819070259	CF	On-Demand	Anodyne	ADRB1	50	49
O[C@H](CNCCC1CCOCC1)c1cccc(Cl)c1	ZINC000819070259	CF	On-Demand	Anodyne	ADRB3	62	49
O[C@H](CNCCC1CCOCC1)c1cccc(Cl)c1	ZINC000819070259	CF	On-Demand	Anodyne	CYP3A4	47	36
O[C@@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)C1CC1	ZINC000819070269	EF	On-Demand	Anodyne	PIM1	16	41
O[C@H](CN[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)C1CC1	ZINC000819070270	EF	On-Demand	Anodyne	PIM1	16	41
O[C@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)C1CC1	ZINC000819070271	EF	On-Demand	Anodyne	PIM1	16	41
O[C@@H](CN[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1)C1CC1	ZINC000819070272	EF	On-Demand	Anodyne	PIM1	16	41
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCOc2cccnc2)CC1	ZINC000819070273	FE	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCOc2cccnc2)CC1	ZINC000819070274	FE	On-Demand	Anodyne	GPR119	30	41
O[C@@H](CNCCOc1cccnc1)COc1cccc(C(F)(F)F)c1	ZINC000819070283	FF	On-Demand	Anodyne	ADRB2	38	49
O[C@@H](CNCCOc1cccnc1)COc1cccc(C(F)(F)F)c1	ZINC000819070283	FF	On-Demand	Anodyne	ADRB1	58	49
O[C@@H](CNCCOc1cccnc1)COc1cccc(C(F)(F)F)c1	ZINC000819070283	FF	On-Demand	Anodyne	ADRB3	41	47
O[C@@H](CNCCOc1cccnc1)COc1cccc(C(F)(F)F)c1	ZINC000819070283	FF	On-Demand	Anodyne	GALR3	41	36
O[C@@H](CNCCOc1cccnc1)COc1cccc(C(F)(F)F)c1	ZINC000819070283	FF	On-Demand	Anodyne	PDS	46	39
O[C@H](CNCCOc1cccnc1)COc1cccc(C(F)(F)F)c1	ZINC000819070284	FF	On-Demand	Anodyne	ADRB2	38	49
O[C@H](CNCCOc1cccnc1)COc1cccc(C(F)(F)F)c1	ZINC000819070284	FF	On-Demand	Anodyne	ADRB1	58	49
O[C@H](CNCCOc1cccnc1)COc1cccc(C(F)(F)F)c1	ZINC000819070284	FF	On-Demand	Anodyne	ADRB3	41	47
O[C@H](CNCCOc1cccnc1)COc1cccc(C(F)(F)F)c1	ZINC000819070284	FF	On-Demand	Anodyne	GALR3	41	36
O[C@H](CNCCOc1cccnc1)COc1cccc(C(F)(F)F)c1	ZINC000819070284	FF	On-Demand	Anodyne	PDS	46	39
CN(C[C@H](O)CNCCOc1cccnc1)C1CC1	ZINC000819070295	CC	On-Demand	Anodyne	ADRB1	29	42
CN(C[C@H](O)CNCCOc1cccnc1)C1CC1	ZINC000819070295	CC	On-Demand	Anodyne	ADRB3	23	47
CN(C[C@@H](O)CNCCOc1cccnc1)C1CC1	ZINC000819070296	CC	On-Demand	Anodyne	ADRB1	29	42
CN(C[C@@H](O)CNCCOc1cccnc1)C1CC1	ZINC000819070296	CC	On-Demand	Anodyne	ADRB3	23	47
O[C@H](CNCCOc1cccnc1)Cc1ccccc1C(F)(F)F	ZINC000819070301	EF	On-Demand	Anodyne	ADRB1	22	45
O[C@H](CNCCOc1cccnc1)Cc1ccccc1C(F)(F)F	ZINC000819070301	EF	On-Demand	Anodyne	ADRB3	20	45
O[C@@H](CNCCOc1cccnc1)Cc1ccccc1C(F)(F)F	ZINC000819070302	EF	On-Demand	Anodyne	ADRB1	22	45
O[C@@H](CNCCOc1cccnc1)Cc1ccccc1C(F)(F)F	ZINC000819070302	EF	On-Demand	Anodyne	ADRB3	20	45
C=C(Cl)CSc1nc(C)c(CC(=O)N2CCC[C@H]2c2cc(C)on2)s1	ZINC000819070311	GI	On-Demand	Mild	CPT1A	40	38
C=C(Cl)CSc1nc(C)c(CC(=O)N2CCC[C@@H]2c2cc(C)on2)s1	ZINC000819070312	GI	On-Demand	Mild	CPT1A	40	38
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc3c(c2)CCO3)c1	ZINC000819070313	EE	On-Demand	Bother	ADRB1	33	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc3c(c2)CCO3)c1	ZINC000819070313	EE	On-Demand	Bother	ADRB3	71	42
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc3c(c2)CCO3)c1	ZINC000819070314	EE	On-Demand	Bother	ADRB1	33	42
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc3c(c2)CCO3)c1	ZINC000819070314	EE	On-Demand	Bother	ADRB3	71	42
O[C@H](CNCCOc1cccnc1)Cc1cccc(Cl)c1	ZINC000819070329	DE	On-Demand	Anodyne	ADRB2	29	46
O[C@H](CNCCOc1cccnc1)Cc1cccc(Cl)c1	ZINC000819070329	DE	On-Demand	Anodyne	ADRB1	58	46
O[C@H](CNCCOc1cccnc1)Cc1cccc(Cl)c1	ZINC000819070329	DE	On-Demand	Anodyne	MAOB	17	40
O[C@H](CNCCOc1cccnc1)Cc1cccc(Cl)c1	ZINC000819070329	DE	On-Demand	Anodyne	ADRB3	58	46
O[C@@H](CNCCOc1cccnc1)Cc1cccc(Cl)c1	ZINC000819070330	DE	On-Demand	Anodyne	ADRB2	29	46
O[C@@H](CNCCOc1cccnc1)Cc1cccc(Cl)c1	ZINC000819070330	DE	On-Demand	Anodyne	ADRB1	58	46
O[C@@H](CNCCOc1cccnc1)Cc1cccc(Cl)c1	ZINC000819070330	DE	On-Demand	Anodyne	MAOB	17	40
O[C@@H](CNCCOc1cccnc1)Cc1cccc(Cl)c1	ZINC000819070330	DE	On-Demand	Anodyne	ADRB3	58	46
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccc(F)cc2)CC1	ZINC000819070334	ED	On-Demand	Anodyne	L3MBTL3	80	45
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(F)cc2)CC1	ZINC000819070335	ED	On-Demand	Anodyne	L3MBTL3	80	45
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(F)cc2)CC1	ZINC000819070336	ED	On-Demand	Anodyne	L3MBTL3	80	45
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccc(F)cc2)CC1	ZINC000819070337	ED	On-Demand	Anodyne	L3MBTL3	80	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(Cl)c(C(N)=O)c1	ZINC000819070344	FE	On-Demand	Anodyne	IMDH_CRYPV	19	41
CCNC(=O)CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819070345	GC	On-Demand	Mild	PAPA1_CARPA	34	44
CCNC(=O)CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819070346	GC	On-Demand	Mild	PAPA1_CARPA	34	44
C[C@@H]1CCCC[C@@H]1CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819070353	EF	On-Demand	Anodyne	ADRB2	25	40
C[C@@H]1CCCC[C@@H]1CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819070353	EF	On-Demand	Anodyne	ADRB3	49	39
C[C@@H]1CCCC[C@@H]1CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819070354	EF	On-Demand	Anodyne	ADRB2	25	40
C[C@@H]1CCCC[C@@H]1CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819070354	EF	On-Demand	Anodyne	ADRB3	49	39
C[C@@H]1CCCC[C@H]1CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819070355	EF	On-Demand	Anodyne	ADRB2	25	40
C[C@@H]1CCCC[C@H]1CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819070355	EF	On-Demand	Anodyne	ADRB3	49	39
C[C@@H]1CCCC[C@H]1CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819070356	EF	On-Demand	Anodyne	ADRB2	25	40
C[C@@H]1CCCC[C@H]1CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819070356	EF	On-Demand	Anodyne	ADRB3	49	39
O[C@@H](CNCCc1ccc(F)cc1Cl)c1cc(F)ccc1F	ZINC000819070392	EH	On-Demand	Anodyne	ADRB1	22	40
O[C@@H](CNCCc1ccc(F)cc1Cl)c1cc(F)ccc1F	ZINC000819070392	EH	On-Demand	Anodyne	ADRB3	18	40
O[C@H](CNCCc1ccc(F)cc1Cl)c1cc(F)ccc1F	ZINC000819070393	EH	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CNCCc1ccc(F)cc1Cl)c1cc(F)ccc1F	ZINC000819070393	EH	On-Demand	Anodyne	ADRB3	18	40
CONC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819070440	EG	On-Demand	Anodyne	CTSD	15	43
CONC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819070440	EG	On-Demand	Anodyne	CTSK	21	55
CONC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819070440	EG	On-Demand	Anodyne	ECE1	23	43
CONC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819070440	EG	On-Demand	Anodyne	REN	56	45
CONC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819070441	EG	On-Demand	Anodyne	CTSD	15	43
CONC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819070441	EG	On-Demand	Anodyne	CTSK	21	55
CONC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819070441	EG	On-Demand	Anodyne	ECE1	23	43
CONC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819070441	EG	On-Demand	Anodyne	REN	56	45
CONC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819070566	BC	On-Demand	Anodyne	TSHR	40	29
CONC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819070566	BC	On-Demand	Anodyne	MTNR1A	33	43
CONC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819070566	BC	On-Demand	Anodyne	MTNR1B	37	43
CONC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819070566	BC	On-Demand	Anodyne	KCNK3	85	38
CONC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819070566	BC	On-Demand	Anodyne	KCNK9	63	38
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(F)cc2Cl)c1	ZINC000819070605	EG	On-Demand	Bother	ADRB1	34	45
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(F)cc2Cl)c1	ZINC000819070605	EG	On-Demand	Bother	ADRB3	65	45
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(F)cc2Cl)c1	ZINC000819070606	EG	On-Demand	Bother	ADRB1	34	45
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(F)cc2Cl)c1	ZINC000819070606	EG	On-Demand	Bother	ADRB3	65	45
CCCCCCCCCC(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819070646	EH	On-Demand	Mild	LASR	40	33
CCCCCCCCCC(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819070649	EH	On-Demand	Mild	LASR	40	33
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819070653	GF	On-Demand	Anodyne	PREP	44	61
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819070653	GF	On-Demand	Anodyne	SFRP1	46	44
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819070653	GF	On-Demand	Anodyne	WNT3	58	44
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819070657	GF	On-Demand	Anodyne	PREP	44	61
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819070657	GF	On-Demand	Anodyne	SFRP1	46	44
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819070657	GF	On-Demand	Anodyne	WNT3	58	44
CC(C)(C)OC(=O)N1CCC(CC(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819070697	HF	On-Demand	Anodyne	GPR119	33	42
CC(C)(C)OC(=O)N1CCC(CC(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819070698	HF	On-Demand	Anodyne	GPR119	33	42
CC(C)(C)OC(=O)N1CCN(C(C)(C)C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819070739	IE	On-Demand	Anodyne	GPR119	27	42
CC(C)(C)OC(=O)N1CCN(C(C)(C)C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819070740	IE	On-Demand	Anodyne	GPR119	27	42
CC(C)(C)OC(=O)N1CCc2cc(C(=O)N3CCC([C@@H]4NC(=O)C4(C)C)CC3)ccc21	ZINC000819070741	IG	On-Demand	Anodyne	GPR119	21	44
CC(C)(C)OC(=O)N1CCc2cc(C(=O)N3CCC([C@H]4NC(=O)C4(C)C)CC3)ccc21	ZINC000819070742	IG	On-Demand	Anodyne	GPR119	21	44
C#CCNS(=O)(=O)c1ccc(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)cc1	ZINC000819070828	HC	On-Demand	Mild	SFRP1	61	36
C#CCNS(=O)(=O)c1ccc(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)cc1	ZINC000819070828	HC	On-Demand	Mild	L3MBTL3	61	40
C#CCNS(=O)(=O)c1ccc(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)cc1	ZINC000819070829	HC	On-Demand	Mild	SFRP1	61	36
C#CCNS(=O)(=O)c1ccc(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)cc1	ZINC000819070829	HC	On-Demand	Mild	L3MBTL3	61	40
CCCCCCCCC(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819070842	DH	On-Demand	Mild	LASR	40	33
CCCCCCCCC(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819070843	DH	On-Demand	Mild	LASR	40	33
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819070864	GE	On-Demand	Anodyne	GPR119	21	42
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819070864	GE	On-Demand	Anodyne	SFRP1	16	44
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819070865	GE	On-Demand	Anodyne	GPR119	21	42
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819070865	GE	On-Demand	Anodyne	SFRP1	16	44
CC(C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)=C1CN(C(=O)OC(C)(C)C)C1	ZINC000819071012	GE	On-Demand	Anodyne	GPR119	16	41
CC(C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)=C1CN(C(=O)OC(C)(C)C)C1	ZINC000819071013	GE	On-Demand	Anodyne	GPR119	16	41
CN(CCO)S(=O)(=O)c1ccc(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)cc1	ZINC000819071060	HC	On-Demand	Anodyne	L3MBTL3	49	38
CN(CCO)S(=O)(=O)c1ccc(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)cc1	ZINC000819071061	HC	On-Demand	Anodyne	L3MBTL3	49	38
COc1ccc2c(C)c(CCC(=O)N3CCC([C@@H]4NC(=O)C4(C)C)CC3)c(=O)oc2c1	ZINC000819071076	IF	On-Demand	Anodyne	MAOB	30	43
COc1ccc2c(C)c(CCC(=O)N3CCC([C@@H]4NC(=O)C4(C)C)CC3)c(=O)oc2c1	ZINC000819071076	IF	On-Demand	Anodyne	NQO1	17	42
COc1ccc2c(C)c(CCC(=O)N3CCC([C@H]4NC(=O)C4(C)C)CC3)c(=O)oc2c1	ZINC000819071077	IF	On-Demand	Anodyne	MAOB	30	43
COc1ccc2c(C)c(CCC(=O)N3CCC([C@H]4NC(=O)C4(C)C)CC3)c(=O)oc2c1	ZINC000819071077	IF	On-Demand	Anodyne	NQO1	17	42
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071104	HE	On-Demand	Anodyne	POLG_HCV1	24	42
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071105	HE	On-Demand	Anodyne	POLG_HCV1	24	42
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071106	HE	On-Demand	Anodyne	POLG_HCV1	24	42
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071107	HE	On-Demand	Anodyne	POLG_HCV1	24	42
CC(C)(C)OC(=O)NCc1ccc(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)cc1	ZINC000819071128	HG	On-Demand	Anodyne	L3MBTL3	50	35
CC(C)(C)OC(=O)NCc1ccc(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)cc1	ZINC000819071129	HG	On-Demand	Anodyne	L3MBTL3	50	35
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819071336	GE	On-Demand	Anodyne	GPR119	37	46
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819071336	GE	On-Demand	Anodyne	SFRP1	15	42
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819071337	GE	On-Demand	Anodyne	GPR119	37	46
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819071337	GE	On-Demand	Anodyne	SFRP1	15	42
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071340	GE	On-Demand	Anodyne	PREP	44	63
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071340	GE	On-Demand	Anodyne	SFRP1	46	45
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071340	GE	On-Demand	Anodyne	WNT3	59	45
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071341	GE	On-Demand	Anodyne	PREP	44	63
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071341	GE	On-Demand	Anodyne	SFRP1	46	45
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071341	GE	On-Demand	Anodyne	WNT3	59	45
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071342	GE	On-Demand	Anodyne	PREP	44	63
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071342	GE	On-Demand	Anodyne	SFRP1	46	45
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071342	GE	On-Demand	Anodyne	WNT3	59	45
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071343	GE	On-Demand	Anodyne	PREP	44	63
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071343	GE	On-Demand	Anodyne	SFRP1	46	45
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071343	GE	On-Demand	Anodyne	WNT3	59	45
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819071360	GE	On-Demand	Anodyne	GPR119	16	40
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819071360	GE	On-Demand	Anodyne	SFRP1	20	42
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819071361	GE	On-Demand	Anodyne	GPR119	16	40
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819071361	GE	On-Demand	Anodyne	SFRP1	20	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)Cc1ccccc1	ZINC000819071362	IG	On-Demand	Anodyne	PGC	56	39
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)Cc1ccccc1	ZINC000819071362	IG	On-Demand	Anodyne	PAPA1_CARPA	27	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)Cc1ccccc1	ZINC000819071362	IG	On-Demand	Anodyne	CCKAR	64	39
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)Cc1ccccc1	ZINC000819071362	IG	On-Demand	Anodyne	CTSL	22	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)Cc1ccccc1	ZINC000819071362	IG	On-Demand	Anodyne	REN	72	39
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)Cc1ccccc1	ZINC000819071362	IG	On-Demand	Anodyne	FPR1	47	38
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)Cc1ccccc1	ZINC000819071365	IG	On-Demand	Anodyne	PGC	56	39
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)Cc1ccccc1	ZINC000819071365	IG	On-Demand	Anodyne	PAPA1_CARPA	27	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)Cc1ccccc1	ZINC000819071365	IG	On-Demand	Anodyne	CCKAR	64	39
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)Cc1ccccc1	ZINC000819071365	IG	On-Demand	Anodyne	CTSL	22	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)Cc1ccccc1	ZINC000819071365	IG	On-Demand	Anodyne	REN	72	39
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)Cc1ccccc1	ZINC000819071365	IG	On-Demand	Anodyne	FPR1	47	38
CC(C)(C)OC(=O)N1CCC(CCC(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819071374	HG	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CCC(CCC(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819071375	HG	On-Demand	Anodyne	GPR119	30	41
CN(C)S(=O)(=O)c1cc(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)ccc1F	ZINC000819071404	HD	On-Demand	Anodyne	L3MBTL3	42	36
CN(C)S(=O)(=O)c1cc(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)ccc1F	ZINC000819071405	HD	On-Demand	Anodyne	L3MBTL3	42	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	F2	32	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	PLG	34	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	ACE	44	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	GHRHR	79	35
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	P2RY12	82	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	CELA1	19	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	MME	41	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	TACR1	15	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	CTSD	18	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	PGC	64	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	MC4R	81	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	CMA1	42	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	CTRA_BOVIN	43	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	PAPA1_CARPA	51	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	CYSP_TRYCR	48	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	CCKAR	72	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	CTSK	29	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	CTSL	39	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	CACNA1B	41	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	PGA	30	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	CYP51A1	22	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	TIMP3	74	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	TACR3	16	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	MC5R	52	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	CAPNS1	54	30
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	HLA-DRB1	24	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	CELA2A	43	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	REN	98	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	CCKBR	42	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	CTSS	19	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	CAPN1	36	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	CTSE	16	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	ACE2	50	35
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	ST14	48	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	FPR1	59	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	PLM2_PLAFA	44	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	CALCRL	21	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071429	IF	On-Demand	Anodyne	GAG-PRO	47	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	F2	32	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	PLG	34	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	ACE	44	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	GHRHR	79	35
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	P2RY12	82	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	CELA1	19	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	MME	41	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	TACR1	15	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	CTSD	18	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	PGC	64	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	MC4R	81	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	CMA1	42	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	CTRA_BOVIN	43	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	PAPA1_CARPA	51	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	CYSP_TRYCR	48	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	CCKAR	72	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	CTSK	29	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	CTSL	39	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	CACNA1B	41	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	PGA	30	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	CYP51A1	22	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	TIMP3	74	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	TACR3	16	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	MC5R	52	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	CAPNS1	54	30
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	HLA-DRB1	24	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	CELA2A	43	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	REN	98	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	CCKBR	42	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	CTSS	19	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	CAPN1	36	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	CTSE	16	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	ACE2	50	35
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	ST14	48	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	FPR1	59	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	PLM2_PLAFA	44	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	CALCRL	21	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071430	IF	On-Demand	Anodyne	GAG-PRO	47	32
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	ACE	27	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	GHRHR	61	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	P2RY12	200	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	ELANE	21	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	CTRA_BOVIN	66	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	KLK3	78	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	CTSB	53	47
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	PAPA1_CARPA	47	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	CYSP_TRYCR	50	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	CTSG	44	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	CTSK	48	47
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	CTSL	48	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	CCR1	15	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	CAPNS1	61	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	CELA2A	54	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	MMP11	56	31
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	CCKBR	16	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	CTSS	21	47
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	CAPN1	75	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	CAPN2	121	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	TGM2	42	47
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071492	IE	On-Demand	Anodyne	NPR	55	32
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	ACE	27	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	GHRHR	61	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	P2RY12	200	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	ELANE	21	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	CTRA_BOVIN	66	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	KLK3	78	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	CTSB	53	47
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	PAPA1_CARPA	47	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	CYSP_TRYCR	50	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	CTSG	44	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	CTSK	48	47
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	CTSL	48	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	CCR1	15	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	CAPNS1	61	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	CELA2A	54	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	MMP11	56	31
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	CCKBR	16	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	CTSS	21	47
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	CAPN1	75	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	CAPN2	121	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	TGM2	42	47
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071493	IE	On-Demand	Anodyne	NPR	55	32
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	ACE	27	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	GHRHR	61	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	P2RY12	200	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	ELANE	21	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	CTRA_BOVIN	66	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	KLK3	78	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	CTSB	53	47
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	PAPA1_CARPA	47	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	CYSP_TRYCR	50	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	CTSG	44	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	CTSK	48	47
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	CTSL	48	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	CCR1	15	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	CAPNS1	61	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	CELA2A	54	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	MMP11	56	31
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	CCKBR	16	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	CTSS	21	47
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	CAPN1	75	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	CAPN2	121	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	TGM2	42	47
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071495	IE	On-Demand	Anodyne	NPR	55	32
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)C[C@@H]2CCCC[C@H]21	ZINC000819071522	IG	On-Demand	Anodyne	PREP	15	69
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)C[C@@H]2CCCC[C@@H]21	ZINC000819071523	IG	On-Demand	Anodyne	PREP	15	69
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)C[C@H]2CCCC[C@@H]21	ZINC000819071524	IG	On-Demand	Anodyne	PREP	15	69
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)C[C@H]2CCCC[C@H]21	ZINC000819071525	IG	On-Demand	Anodyne	PREP	15	69
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071528	EF	On-Demand	Anodyne	MLNR	24	42
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071529	EF	On-Demand	Anodyne	MLNR	24	42
CC(C)(C)OC(=O)N1CCC(=CC(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819071534	HF	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)N1CCC(=CC(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819071535	HF	On-Demand	Anodyne	GPR119	23	40
CCNS(=O)(=O)c1ccc(F)c(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)c1	ZINC000819071552	HD	On-Demand	Anodyne	PARP1	44	36
CCNS(=O)(=O)c1ccc(F)c(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)c1	ZINC000819071552	HD	On-Demand	Anodyne	SFRP1	53	34
CCNS(=O)(=O)c1ccc(F)c(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)c1	ZINC000819071553	HD	On-Demand	Anodyne	PARP1	44	36
CCNS(=O)(=O)c1ccc(F)c(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)c1	ZINC000819071553	HD	On-Demand	Anodyne	SFRP1	53	34
COc1cccc(C2=NO[C@@H](C(=O)N3CCC([C@@H]4NC(=O)C4(C)C)CC3)C2)c1	ZINC000819071568	GD	On-Demand	Anodyne	LUCI_PHOPY	16	41
COc1cccc(C2=NO[C@@H](C(=O)N3CCC([C@H]4NC(=O)C4(C)C)CC3)C2)c1	ZINC000819071569	GD	On-Demand	Anodyne	LUCI_PHOPY	16	41
COc1cccc(C2=NO[C@H](C(=O)N3CCC([C@@H]4NC(=O)C4(C)C)CC3)C2)c1	ZINC000819071570	GD	On-Demand	Anodyne	LUCI_PHOPY	16	41
COc1cccc(C2=NO[C@H](C(=O)N3CCC([C@H]4NC(=O)C4(C)C)CC3)C2)c1	ZINC000819071571	GD	On-Demand	Anodyne	LUCI_PHOPY	16	41
C[C@@H](CC(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819071580	IG	On-Demand	Anodyne	GPR119	26	42
C[C@@H](CC(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819071581	IG	On-Demand	Anodyne	GPR119	26	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071600	HF	On-Demand	Anodyne	GPR119	22	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071601	HF	On-Demand	Anodyne	GPR119	22	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071602	HF	On-Demand	Anodyne	GPR119	22	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071603	HF	On-Demand	Anodyne	GPR119	22	41
CCCCCCC(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071604	CF	On-Demand	Anodyne	LASR	40	33
CCCCCCC(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071605	CF	On-Demand	Anodyne	LASR	40	33
CC(C)(C)OC(=O)N1CCC(OCC(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819071624	HE	On-Demand	Anodyne	GPR119	30	40
CC(C)(C)OC(=O)N1CCC(OCC(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819071625	HE	On-Demand	Anodyne	GPR119	30	40
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071728	FD	On-Demand	Anodyne	PREP	15	52
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071729	FD	On-Demand	Anodyne	PREP	15	52
CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071750	GE	On-Demand	Anodyne	PREP	21	42
CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071751	GE	On-Demand	Anodyne	PREP	21	42
CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071752	GE	On-Demand	Anodyne	PREP	21	42
CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071753	GE	On-Demand	Anodyne	PREP	21	42
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819071769	GE	On-Demand	Anodyne	P2RY12	40	32
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819071771	GE	On-Demand	Anodyne	P2RY12	40	32
CCOC(=O)N[C@H](C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)C(C)C	ZINC000819071780	FD	On-Demand	Anodyne	CCR1	49	36
CCOC(=O)N[C@@H](C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)C(C)C	ZINC000819071781	FD	On-Demand	Anodyne	CCR1	49	36
CCOC(=O)N[C@H](C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)C(C)C	ZINC000819071782	FD	On-Demand	Anodyne	CCR1	49	36
CCOC(=O)N[C@@H](C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)C(C)C	ZINC000819071783	FD	On-Demand	Anodyne	CCR1	49	36
CCOc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071795	GF	On-Demand	Anodyne	ADRB2	38	43
CCOc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071795	GF	On-Demand	Anodyne	ADRB1	50	42
CCOc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071795	GF	On-Demand	Anodyne	ADRB3	34	43
CCOc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071795	GF	On-Demand	Anodyne	GPR119	38	41
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071796	GF	On-Demand	Anodyne	ADRB2	38	43
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071796	GF	On-Demand	Anodyne	ADRB1	50	42
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071796	GF	On-Demand	Anodyne	ADRB3	34	43
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071796	GF	On-Demand	Anodyne	GPR119	38	41
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071797	GF	On-Demand	Anodyne	ADRB2	38	43
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071797	GF	On-Demand	Anodyne	ADRB1	50	42
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071797	GF	On-Demand	Anodyne	ADRB3	34	43
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071797	GF	On-Demand	Anodyne	GPR119	38	41
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071798	GF	On-Demand	Anodyne	ADRB2	38	43
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071798	GF	On-Demand	Anodyne	ADRB1	50	42
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071798	GF	On-Demand	Anodyne	ADRB3	34	43
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071798	GF	On-Demand	Anodyne	GPR119	38	41
C=C(C)C(C)(C)C(=O)Nc1n[nH]c2ccccc12	ZINC000819071816	BG	On-Demand	Mild	GSK3A	35	40
Cc1ccccc1[C@@H](O)CNC[C@H]1CCCN1Cc1ccccc1	ZINC000819071817	DG	On-Demand	Anodyne	SIGMAR1	24	44
Cc1ccccc1[C@@H](O)CNC[C@@H]1CCCN1Cc1ccccc1	ZINC000819071818	DG	On-Demand	Anodyne	SIGMAR1	24	44
C#CCOc1ccccc1CNC[C@H](O)COC(C)C	ZINC000819071823	CD	On-Demand	Mild	ADRB2	22	46
C#CCOc1ccccc1CNC[C@@H](O)COC(C)C	ZINC000819071824	CD	On-Demand	Mild	ADRB2	22	46
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071826	GF	On-Demand	Anodyne	ADRB2	28	66
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071826	GF	On-Demand	Anodyne	ADRB1	34	66
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071826	GF	On-Demand	Anodyne	HTR1A	15	66
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071826	GF	On-Demand	Anodyne	SSTR2	56	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071826	GF	On-Demand	Anodyne	SLC6A4	19	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071826	GF	On-Demand	Anodyne	ADRB3	25	56
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071827	GF	On-Demand	Anodyne	ADRB2	28	66
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071827	GF	On-Demand	Anodyne	ADRB1	34	66
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071827	GF	On-Demand	Anodyne	HTR1A	15	66
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071827	GF	On-Demand	Anodyne	SSTR2	56	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071827	GF	On-Demand	Anodyne	SLC6A4	19	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071827	GF	On-Demand	Anodyne	ADRB3	25	56
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071828	GF	On-Demand	Anodyne	ADRB2	28	66
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071828	GF	On-Demand	Anodyne	ADRB1	34	66
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071828	GF	On-Demand	Anodyne	HTR1A	15	66
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071828	GF	On-Demand	Anodyne	SSTR2	56	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071828	GF	On-Demand	Anodyne	SLC6A4	19	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071828	GF	On-Demand	Anodyne	ADRB3	25	56
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071829	GF	On-Demand	Anodyne	ADRB2	28	66
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071829	GF	On-Demand	Anodyne	ADRB1	34	66
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071829	GF	On-Demand	Anodyne	HTR1A	15	66
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071829	GF	On-Demand	Anodyne	SSTR2	56	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071829	GF	On-Demand	Anodyne	SLC6A4	19	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819071829	GF	On-Demand	Anodyne	ADRB3	25	56
C#CCOc1ccccc1CNC[C@H](O)CN1CCN(C)CC1	ZINC000819071840	DC	On-Demand	Mild	ABCB1	54	37
C#CCOc1ccccc1CNC[C@@H](O)CN1CCN(C)CC1	ZINC000819071841	DC	On-Demand	Mild	ABCB1	54	37
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819071842	FE	On-Demand	Mild	ADRB2	41	40
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819071842	FE	On-Demand	Mild	ADRB1	66	41
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819071842	FE	On-Demand	Mild	ADRB3	36	41
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819071843	FE	On-Demand	Mild	ADRB2	41	40
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819071843	FE	On-Demand	Mild	ADRB1	66	41
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819071843	FE	On-Demand	Mild	ADRB3	36	41
O=C(/C=C\[C@@H]1CCCO1)Nc1n[nH]c2ccccc12	ZINC000819071869	CE	On-Demand	Anodyne	GSK3A	39	42
O=C(/C=C\[C@H]1CCCO1)Nc1n[nH]c2ccccc12	ZINC000819071870	CE	On-Demand	Anodyne	GSK3A	39	42
O=C(/C=C/[C@@H]1CCCO1)Nc1n[nH]c2ccccc12	ZINC000819071871	CE	On-Demand	Anodyne	GSK3A	39	42
O=C(/C=C/[C@H]1CCCO1)Nc1n[nH]c2ccccc12	ZINC000819071872	CE	On-Demand	Anodyne	GSK3A	39	42
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819071873	FE	On-Demand	Mild	ADRB2	55	55
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819071873	FE	On-Demand	Mild	ADRB1	90	55
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819071873	FE	On-Demand	Mild	TSHR	41	30
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819071873	FE	On-Demand	Mild	GRIN1	16	44
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819071873	FE	On-Demand	Mild	ADRB3	53	50
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819071873	FE	On-Demand	Mild	ABCB1	19	42
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819071874	FE	On-Demand	Mild	ADRB2	55	55
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819071874	FE	On-Demand	Mild	ADRB1	90	55
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819071874	FE	On-Demand	Mild	TSHR	41	30
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819071874	FE	On-Demand	Mild	GRIN1	16	44
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819071874	FE	On-Demand	Mild	ADRB3	53	50
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819071874	FE	On-Demand	Mild	ABCB1	19	42
C#CCOc1ccccc1CNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819071882	FE	On-Demand	Mild	ADRB2	17	41
C#CCOc1ccccc1CNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819071882	FE	On-Demand	Mild	ADRB1	55	37
C#CCOc1ccccc1CNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819071883	FE	On-Demand	Mild	ADRB2	17	41
C#CCOc1ccccc1CNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819071883	FE	On-Demand	Mild	ADRB1	55	37
C#CCOc1ccccc1CNC[C@@H](O)COCc1ccccc1Cl	ZINC000819071893	FG	On-Demand	Mild	FABP5	26	40
C#CCOc1ccccc1CNC[C@H](O)COCc1ccccc1Cl	ZINC000819071894	FG	On-Demand	Mild	FABP5	26	40
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2ccccc2F)C1	ZINC000819071919	FG	On-Demand	Anodyne	GPR119	37	44
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2ccccc2F)C1	ZINC000819071920	FG	On-Demand	Anodyne	GPR119	37	44
C#CCOc1ccccc1CNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819071923	FE	On-Demand	Mild	ADRB2	21	45
C#CCOc1ccccc1CNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819071923	FE	On-Demand	Mild	ADRB1	50	41
C#CCOc1ccccc1CNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819071923	FE	On-Demand	Mild	ADRB3	15	45
C#CCOc1ccccc1CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819071924	FE	On-Demand	Mild	ADRB2	21	45
C#CCOc1ccccc1CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819071924	FE	On-Demand	Mild	ADRB1	50	41
C#CCOc1ccccc1CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819071924	FE	On-Demand	Mild	ADRB3	15	45
Cc1cc(F)ccc1[C@@H](O)CNCCc1nc(-c2cccc(Cl)c2)no1	ZINC000819071936	GH	On-Demand	Anodyne	ADRB1	18	40
Cc1cc(F)ccc1[C@@H](O)CNCCc1nc(-c2cccc(Cl)c2)no1	ZINC000819071936	GH	On-Demand	Anodyne	ADRB3	30	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819071951	FG	On-Demand	Anodyne	SSTR2	42	34
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819071951	FG	On-Demand	Anodyne	SFRP1	53	38
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819071951	FG	On-Demand	Anodyne	WNT3	52	35
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819071952	FG	On-Demand	Anodyne	SSTR2	42	34
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819071952	FG	On-Demand	Anodyne	SFRP1	53	38
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819071952	FG	On-Demand	Anodyne	WNT3	52	35
C#CCOc1ccccc1CNC[C@H](O)Cc1ccc(F)cc1	ZINC000819071956	DF	On-Demand	Mild	ADRB1	17	40
C#CCOc1ccccc1CNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819071957	DF	On-Demand	Mild	ADRB1	17	40
O=C(Nc1ccc(F)cc1)N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819071958	EF	On-Demand	Anodyne	PDGFRB	17	40
O=C(Nc1ccc(F)cc1)N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819071958	EF	On-Demand	Anodyne	EPHX2	15	42
O=C(Nc1ccc(F)cc1)N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819071958	EF	On-Demand	Anodyne	TRPM8	43	39
C#CCOc1ccccc1CNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819071964	FE	On-Demand	Mild	ADRB2	35	43
C#CCOc1ccccc1CNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819071964	FE	On-Demand	Mild	ADRB1	63	41
C#CCOc1ccccc1CNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819071964	FE	On-Demand	Mild	ABCB1	30	46
C#CCOc1ccccc1CNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819071965	FE	On-Demand	Mild	ADRB2	35	43
C#CCOc1ccccc1CNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819071965	FE	On-Demand	Mild	ADRB1	63	41
C#CCOc1ccccc1CNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819071965	FE	On-Demand	Mild	ABCB1	30	46
Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071968	FF	On-Demand	Anodyne	ADRB2	38	48
Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071968	FF	On-Demand	Anodyne	ADRB1	49	42
Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071968	FF	On-Demand	Anodyne	ADRB3	35	43
Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071968	FF	On-Demand	Anodyne	ACOX1	45	33
Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071968	FF	On-Demand	Anodyne	GPR119	37	43
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071969	FF	On-Demand	Anodyne	ADRB2	38	48
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071969	FF	On-Demand	Anodyne	ADRB1	49	42
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071969	FF	On-Demand	Anodyne	ADRB3	35	43
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071969	FF	On-Demand	Anodyne	ACOX1	45	33
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071969	FF	On-Demand	Anodyne	GPR119	37	43
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071970	FF	On-Demand	Anodyne	ADRB2	38	48
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071970	FF	On-Demand	Anodyne	ADRB1	49	42
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071970	FF	On-Demand	Anodyne	ADRB3	35	43
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071970	FF	On-Demand	Anodyne	ACOX1	45	33
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071970	FF	On-Demand	Anodyne	GPR119	37	43
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071971	FF	On-Demand	Anodyne	ADRB2	38	48
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071971	FF	On-Demand	Anodyne	ADRB1	49	42
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071971	FF	On-Demand	Anodyne	ADRB3	35	43
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071971	FF	On-Demand	Anodyne	ACOX1	45	33
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819071971	FF	On-Demand	Anodyne	GPR119	37	43
C#CCOc1ccccc1CNC[C@H](O)COc1ccccc1F	ZINC000819072000	EE	On-Demand	Mild	ADRB2	21	45
C#CCOc1ccccc1CNC[C@H](O)COc1ccccc1F	ZINC000819072000	EE	On-Demand	Mild	ADRB1	59	42
C#CCOc1ccccc1CNC[C@@H](O)COc1ccccc1F	ZINC000819072001	EE	On-Demand	Mild	ADRB2	21	45
C#CCOc1ccccc1CNC[C@@H](O)COc1ccccc1F	ZINC000819072001	EE	On-Demand	Mild	ADRB1	59	42
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(C)cc1	ZINC000819072002	EF	On-Demand	Mild	ADRB2	48	50
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(C)cc1	ZINC000819072002	EF	On-Demand	Mild	ADRB1	62	42
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(C)cc1	ZINC000819072002	EF	On-Demand	Mild	ADRB3	32	42
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(C)cc1	ZINC000819072003	EF	On-Demand	Mild	ADRB2	48	50
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(C)cc1	ZINC000819072003	EF	On-Demand	Mild	ADRB1	62	42
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(C)cc1	ZINC000819072003	EF	On-Demand	Mild	ADRB3	32	42
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072006	GF	On-Demand	Anodyne	ADRB2	28	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072006	GF	On-Demand	Anodyne	ADRB1	37	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072006	GF	On-Demand	Anodyne	ADRB3	32	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072006	GF	On-Demand	Anodyne	ACOX1	44	32
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072006	GF	On-Demand	Anodyne	ABCB1	22	46
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072007	GF	On-Demand	Anodyne	ADRB2	28	43
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072007	GF	On-Demand	Anodyne	ADRB1	37	41
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072007	GF	On-Demand	Anodyne	ADRB3	32	41
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072007	GF	On-Demand	Anodyne	ACOX1	44	32
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072007	GF	On-Demand	Anodyne	ABCB1	22	46
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072008	GF	On-Demand	Anodyne	ADRB2	28	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072008	GF	On-Demand	Anodyne	ADRB1	37	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072008	GF	On-Demand	Anodyne	ADRB3	32	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072008	GF	On-Demand	Anodyne	ACOX1	44	32
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072008	GF	On-Demand	Anodyne	ABCB1	22	46
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072009	GF	On-Demand	Anodyne	ADRB2	28	43
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072009	GF	On-Demand	Anodyne	ADRB1	37	41
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072009	GF	On-Demand	Anodyne	ADRB3	32	41
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072009	GF	On-Demand	Anodyne	ACOX1	44	32
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819072009	GF	On-Demand	Anodyne	ABCB1	22	46
COc1ccccc1COC[C@@H](O)CN[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819072015	GF	On-Demand	Anodyne	ADRB2	18	41
COc1ccccc1COC[C@@H](O)CN[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819072015	GF	On-Demand	Anodyne	BIRC2	15	43
COc1ccccc1COC[C@@H](O)CN[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819072015	GF	On-Demand	Anodyne	MBTPS1	49	32
COc1ccccc1COC[C@H](O)CN[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819072016	GF	On-Demand	Anodyne	ADRB2	18	41
COc1ccccc1COC[C@H](O)CN[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819072016	GF	On-Demand	Anodyne	BIRC2	15	43
COc1ccccc1COC[C@H](O)CN[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819072016	GF	On-Demand	Anodyne	MBTPS1	49	32
COc1ccccc1COC[C@@H](O)CN[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819072017	GF	On-Demand	Anodyne	ADRB2	18	41
COc1ccccc1COC[C@@H](O)CN[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819072017	GF	On-Demand	Anodyne	BIRC2	15	43
COc1ccccc1COC[C@@H](O)CN[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819072017	GF	On-Demand	Anodyne	MBTPS1	49	32
COc1ccccc1COC[C@H](O)CN[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819072018	GF	On-Demand	Anodyne	ADRB2	18	41
COc1ccccc1COC[C@H](O)CN[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819072018	GF	On-Demand	Anodyne	BIRC2	15	43
COc1ccccc1COC[C@H](O)CN[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819072018	GF	On-Demand	Anodyne	MBTPS1	49	32
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H]1CCCN1Cc1ccccc1	ZINC000819072043	GF	On-Demand	Anodyne	DRD2	37	46
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H]1CCCN1Cc1ccccc1	ZINC000819072043	GF	On-Demand	Anodyne	SIGMAR1	23	46
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H]1CCCN1Cc1ccccc1	ZINC000819072043	GF	On-Demand	Anodyne	PREP	28	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H]1CCCN1Cc1ccccc1	ZINC000819072044	GF	On-Demand	Anodyne	DRD2	37	46
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H]1CCCN1Cc1ccccc1	ZINC000819072044	GF	On-Demand	Anodyne	SIGMAR1	23	46
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H]1CCCN1Cc1ccccc1	ZINC000819072044	GF	On-Demand	Anodyne	PREP	28	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H]1CCCN1Cc1ccccc1	ZINC000819072045	GF	On-Demand	Anodyne	DRD2	37	46
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H]1CCCN1Cc1ccccc1	ZINC000819072045	GF	On-Demand	Anodyne	SIGMAR1	23	46
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H]1CCCN1Cc1ccccc1	ZINC000819072045	GF	On-Demand	Anodyne	PREP	28	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H]1CCCN1Cc1ccccc1	ZINC000819072046	GF	On-Demand	Anodyne	DRD2	37	46
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H]1CCCN1Cc1ccccc1	ZINC000819072046	GF	On-Demand	Anodyne	SIGMAR1	23	46
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H]1CCCN1Cc1ccccc1	ZINC000819072046	GF	On-Demand	Anodyne	PREP	28	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819072060	FF	On-Demand	Anodyne	ADRB2	38	46
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819072060	FF	On-Demand	Anodyne	ADRB1	38	46
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819072060	FF	On-Demand	Anodyne	ADRB3	27	44
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819072060	FF	On-Demand	Anodyne	ABCB1	42	46
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819072060	FF	On-Demand	Anodyne	GPR119	36	48
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819072060	FF	On-Demand	Anodyne	WNT3	41	34
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819072061	FF	On-Demand	Anodyne	ADRB2	38	46
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819072061	FF	On-Demand	Anodyne	ADRB1	38	46
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819072061	FF	On-Demand	Anodyne	ADRB3	27	44
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819072061	FF	On-Demand	Anodyne	ABCB1	42	46
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819072061	FF	On-Demand	Anodyne	GPR119	36	48
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819072061	FF	On-Demand	Anodyne	WNT3	41	34
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819072062	FF	On-Demand	Anodyne	ADRB2	38	46
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819072062	FF	On-Demand	Anodyne	ADRB1	38	46
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819072062	FF	On-Demand	Anodyne	ADRB3	27	44
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819072062	FF	On-Demand	Anodyne	ABCB1	42	46
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819072062	FF	On-Demand	Anodyne	GPR119	36	48
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819072062	FF	On-Demand	Anodyne	WNT3	41	34
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819072063	FF	On-Demand	Anodyne	ADRB2	38	46
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819072063	FF	On-Demand	Anodyne	ADRB1	38	46
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819072063	FF	On-Demand	Anodyne	ADRB3	27	44
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819072063	FF	On-Demand	Anodyne	ABCB1	42	46
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819072063	FF	On-Demand	Anodyne	GPR119	36	48
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819072063	FF	On-Demand	Anodyne	WNT3	41	34
Cn1cccc1C(=O)CN1CCC[C@H](CC(=O)O)C1	ZINC000819072079	CD	On-Demand	Anodyne	SLC6A1	82	43
Cn1cccc1C(=O)CN1CCC[C@@H](CC(=O)O)C1	ZINC000819072081	CD	On-Demand	Anodyne	SLC6A1	82	43
CSc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072102	GG	On-Demand	Anodyne	ADRB1	43	41
CSc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072102	GG	On-Demand	Anodyne	ADRB3	32	42
CSc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072102	GG	On-Demand	Anodyne	GPR119	35	44
CSc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072103	GG	On-Demand	Anodyne	ADRB1	43	41
CSc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072103	GG	On-Demand	Anodyne	ADRB3	32	42
CSc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072103	GG	On-Demand	Anodyne	GPR119	35	44
CSc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072104	GG	On-Demand	Anodyne	ADRB1	43	41
CSc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072104	GG	On-Demand	Anodyne	ADRB3	32	42
CSc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072104	GG	On-Demand	Anodyne	GPR119	35	44
CSc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072106	GG	On-Demand	Anodyne	ADRB1	43	41
CSc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072106	GG	On-Demand	Anodyne	ADRB3	32	42
CSc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072106	GG	On-Demand	Anodyne	GPR119	35	44
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(C(=O)c2ccccc2F)CC1	ZINC000819072108	EE	On-Demand	Anodyne	PARP1	33	42
Cn1cccc(NC(=O)NCc2ccc(C(=O)O)cc2)c1=O	ZINC000819072111	DD	On-Demand	Anodyne	HDAC1	15	45
Cn1cccc1C(=O)OCc1ccc(C(=O)O)cc1	ZINC000819072115	CE	On-Demand	Anodyne	SLC12A5	70	36
Cn1cccc1C(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819072117	BC	On-Demand	Anodyne	SLC6A1	161	51
Cn1cccc1C(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819072117	BC	On-Demand	Anodyne	S1PR5	16	43
Cn1cccc1C(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819072117	BC	On-Demand	Anodyne	CYP2J2	45	32
Cn1cccc1C(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819072118	BC	On-Demand	Anodyne	SLC6A1	161	51
Cn1cccc1C(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819072118	BC	On-Demand	Anodyne	S1PR5	16	43
Cn1cccc1C(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819072118	BC	On-Demand	Anodyne	CYP2J2	45	32
Cn1cccc(NC(=O)Nc2cccc(CC(=O)O)c2)c1=O	ZINC000819072119	DD	On-Demand	Anodyne	PTGER3	18	55
Cn1cccc(NC(=O)Nc2cccc(CC(=O)O)c2)c1=O	ZINC000819072119	DD	On-Demand	Anodyne	CCKAR	21	49
Cn1cccc(NC(=O)Nc2cccc(CC(=O)O)c2)c1=O	ZINC000819072119	DD	On-Demand	Anodyne	CCR3	31	42
Cn1cccc(NC(=O)Nc2cccc(CC(=O)O)c2)c1=O	ZINC000819072119	DD	On-Demand	Anodyne	CCKBR	32	49
Cn1cccc(NC(=O)NC(C)(C)CCC(=O)O)c1=O	ZINC000819072168	CD	On-Demand	Anodyne	NAALAD2	17	40
Cn1cccc1[C@H]1CCCCN1C(=O)CSCC(=O)O	ZINC000819072169	CD	On-Demand	Anodyne	CPT1A	108	39
Cn1cccc1[C@H]1CCCCN1C(=O)CSCC(=O)O	ZINC000819072169	CD	On-Demand	Anodyne	PREP	41	34
Cn1cccc1[C@@H]1CCCCN1C(=O)CSCC(=O)O	ZINC000819072170	CD	On-Demand	Anodyne	CPT1A	108	39
Cn1cccc1[C@@H]1CCCCN1C(=O)CSCC(=O)O	ZINC000819072170	CD	On-Demand	Anodyne	PREP	41	34
Cn1ccnc1-c1cccc(NC(=O)C(=O)NCC(=O)O)c1	ZINC000819072175	DC	On-Demand	Anodyne	CCR3	25	40
Cn1ccnc1-c1cccc(NC(=O)C(=O)NCC(=O)O)c1	ZINC000819072175	DC	On-Demand	Anodyne	PTPN11	61	35
Cn1cccc(NC(=O)NCCCCCC(=O)O)c1=O	ZINC000819072177	CD	On-Demand	Anodyne	FOLH1	25	40
Cn1cccc1[C@@H]1CCCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819072189	EG	On-Demand	Anodyne	FKBP1A	34	42
Cn1cccc1[C@@H]1CCCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819072189	EG	On-Demand	Anodyne	PTGER4	41	32
Cn1cccc1[C@@H]1CCCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819072189	EG	On-Demand	Anodyne	CPT1A	49	38
Cn1cccc1[C@@H]1CCCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819072189	EG	On-Demand	Anodyne	PREP	23	41
Cn1cccc1[C@@H]1CCCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819072189	EG	On-Demand	Anodyne	TMPRSS11D	57	35
Cn1cccc1[C@H]1CCCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819072190	EG	On-Demand	Anodyne	FKBP1A	34	42
Cn1cccc1[C@H]1CCCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819072190	EG	On-Demand	Anodyne	PTGER4	41	32
Cn1cccc1[C@H]1CCCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819072190	EG	On-Demand	Anodyne	CPT1A	49	38
Cn1cccc1[C@H]1CCCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819072190	EG	On-Demand	Anodyne	PREP	23	41
Cn1cccc1[C@H]1CCCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819072190	EG	On-Demand	Anodyne	TMPRSS11D	57	35
O=C(C(F)=C1CCC1)N1CCN(C2CCCC2)CC1	ZINC000819072219	CE	On-Demand	Anodyne	HRH3	16	43
O=C(C(F)=C1CCC1)N1CCN(C2CCCC2)CC1	ZINC000819072219	CE	On-Demand	Anodyne	L3MBTL3	56	38
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819072252	EF	On-Demand	Bother	SSTR1	23	40
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819072253	EF	On-Demand	Bother	SSTR1	23	40
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819072254	EF	On-Demand	Bother	SSTR1	23	40
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819072255	EF	On-Demand	Bother	SSTR1	23	40
O[C@@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819072256	FH	On-Demand	Anodyne	SFRP1	78	35
O[C@@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819072256	FH	On-Demand	Anodyne	WNT3	50	32
O[C@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819072257	FH	On-Demand	Anodyne	SFRP1	78	35
O[C@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819072257	FH	On-Demand	Anodyne	WNT3	50	32
O[C@H](CN[C@H]1CCCN(c2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819072258	FH	On-Demand	Anodyne	SFRP1	78	35
O[C@H](CN[C@H]1CCCN(c2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819072258	FH	On-Demand	Anodyne	WNT3	50	32
O[C@@H](CN[C@H]1CCCN(c2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819072259	FH	On-Demand	Anodyne	SFRP1	78	35
O[C@@H](CN[C@H]1CCCN(c2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819072259	FH	On-Demand	Anodyne	WNT3	50	32
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(C(=O)c2ccccc2F)CC1	ZINC000819072292	EE	On-Demand	Anodyne	PARP1	33	42
O=C(/C=C\[C@H]1CCCO1)N1CCCN(C(=O)c2ccccc2F)CC1	ZINC000819072293	EE	On-Demand	Anodyne	PARP1	33	42
O=C(/C=C/[C@H]1CCCO1)N1CCCN(C(=O)c2ccccc2F)CC1	ZINC000819072294	EE	On-Demand	Anodyne	PARP1	33	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819072295	GE	On-Demand	Bother	ADRB2	27	43
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819072295	GE	On-Demand	Bother	ABCB1	23	43
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819072295	GE	On-Demand	Bother	WNT3	41	36
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819072296	GE	On-Demand	Bother	ADRB2	27	43
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819072296	GE	On-Demand	Bother	ABCB1	23	43
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819072296	GE	On-Demand	Bother	WNT3	41	36
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819072297	GE	On-Demand	Bother	ADRB2	27	43
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819072297	GE	On-Demand	Bother	ABCB1	23	43
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819072297	GE	On-Demand	Bother	WNT3	41	36
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819072298	GE	On-Demand	Bother	ADRB2	27	43
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819072298	GE	On-Demand	Bother	ABCB1	23	43
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819072298	GE	On-Demand	Bother	WNT3	41	36
CC(C)(C)OC(=O)N1CCC[C@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819072312	GE	On-Demand	Mild	MMP13	15	45
CC(C)(C)OC(=O)N1CCC[C@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819072312	GE	On-Demand	Mild	ADAM17	17	45
CC(C)(C)OC(=O)N1CCC[C@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819072312	GE	On-Demand	Mild	GPR119	48	44
CC(C)(C)OC(=O)N1CCC[C@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819072312	GE	On-Demand	Mild	SFRP1	58	38
CC(C)(C)OC(=O)N1CCC[C@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819072312	GE	On-Demand	Mild	WNT3	46	35
CC(C)(C)OC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819072315	GE	On-Demand	Mild	MMP13	15	45
CC(C)(C)OC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819072315	GE	On-Demand	Mild	ADAM17	17	45
CC(C)(C)OC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819072315	GE	On-Demand	Mild	GPR119	48	44
CC(C)(C)OC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819072315	GE	On-Demand	Mild	SFRP1	58	38
CC(C)(C)OC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819072315	GE	On-Demand	Mild	WNT3	46	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1nc(-c3ccccc3)no1)C2	ZINC000819072317	FE	On-Demand	Anodyne	PDE8B	44	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1nc(-c3ccccc3)no1)C2	ZINC000819072320	FE	On-Demand	Anodyne	PDE8B	44	33
Cn1cccc1CNc1cccc(CC(=O)O)c1	ZINC000819072323	BE	On-Demand	Anodyne	NR1H2	19	40
Cn1ccnc1-c1cccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819072324	GE	On-Demand	Anodyne	PTGIR	15	40
Cn1ccnc1-c1cccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819072324	GE	On-Demand	Anodyne	CCKAR	25	40
Cn1ccnc1-c1cccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819072324	GE	On-Demand	Anodyne	CCR3	30	42
Cn1ccnc1-c1cccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819072324	GE	On-Demand	Anodyne	CCKBR	44	40
Cn1ccnc1-c1cccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819072324	GE	On-Demand	Anodyne	PTPN11	61	34
Cn1ccnc1-c1cccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819072324	GE	On-Demand	Anodyne	EPHB4	24	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819072330	FF	On-Demand	Anodyne	CCR3	29	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819072330	FF	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819072332	FF	On-Demand	Anodyne	CCR3	29	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819072332	FF	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819072334	FF	On-Demand	Anodyne	CCR3	29	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819072334	FF	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819072336	FF	On-Demand	Anodyne	CCR3	29	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819072336	FF	On-Demand	Anodyne	GPR119	40	42
Cn1ccnc(N2CCN(C(=O)NCCCCCC(=O)O)CC2)c1=O	ZINC000819072348	FC	On-Demand	Anodyne	ASAH1	50	33
Cn1cccc1[C@H]1CCCCN1C(=O)NCCC(=O)O	ZINC000819072358	CD	On-Demand	Anodyne	CPT1A	55	33
Cn1cccc1[C@@H]1CCCCN1C(=O)NCCC(=O)O	ZINC000819072360	CD	On-Demand	Anodyne	CPT1A	55	33
Cn1cccc1CNC(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819072368	CC	On-Demand	Anodyne	SLC6A1	95	38
Cn1cccc1CNC(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819072368	CC	On-Demand	Anodyne	EPHX2	21	45
Cn1cccc1CNC(=O)N1CC[C@H](C(=O)O)C1	ZINC000819072369	CC	On-Demand	Anodyne	SLC6A1	95	38
Cn1cccc1CNC(=O)N1CC[C@H](C(=O)O)C1	ZINC000819072369	CC	On-Demand	Anodyne	EPHX2	21	45
Cn1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1=O	ZINC000819072377	CC	On-Demand	Anodyne	ACE	55	41
Cn1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1=O	ZINC000819072377	CC	On-Demand	Anodyne	FKBP1A	19	41
Cn1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1=O	ZINC000819072377	CC	On-Demand	Anodyne	UL80	36	43
Cn1cccc1CNC(=O)N1CCC(C(=O)O)CC1	ZINC000819072380	CD	On-Demand	Anodyne	EPHX2	29	52
Cn1cccc1[C@@H]1CCCN1C(=O)NCCCCCC(=O)O	ZINC000819072381	DF	On-Demand	Anodyne	ASAH1	42	34
Cn1cccc1[C@H]1CCCN1C(=O)NCCCCCC(=O)O	ZINC000819072382	DF	On-Demand	Anodyne	ASAH1	42	34
Cn1cccc1C(=O)OC[C@@H]1CCCN1CC(=O)O	ZINC000819072383	CC	On-Demand	Anodyne	CHRNA10	40	36
Cn1cccc1C(=O)OC[C@H]1CCCN1CC(=O)O	ZINC000819072385	CC	On-Demand	Anodyne	CHRNA10	40	36
Cn1cccc1CNC(=O)Nc1cccc(CC(=O)O)c1	ZINC000819072396	CD	On-Demand	Anodyne	ROCK2	23	41
Cn1cccc1CNC(=O)Nc1cccc(CC(=O)O)c1	ZINC000819072396	CD	On-Demand	Anodyne	CCKBR	19	47
Cn1ccnc1-c1cccc(NC(=O)C(=O)N2CCC(C(=O)O)CC2)c1	ZINC000819072405	FD	On-Demand	Anodyne	CCR3	25	42
Cn1ccnc1-c1cccc(NC(=O)C(=O)N2CCC(C(=O)O)CC2)c1	ZINC000819072405	FD	On-Demand	Anodyne	CCKBR	50	38
Cn1ccnc1-c1cccc(NC(=O)C(=O)N2CCC(C(=O)O)CC2)c1	ZINC000819072405	FD	On-Demand	Anodyne	PTPN11	55	34
Cn1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1=O	ZINC000819072407	CC	On-Demand	Anodyne	SLC6A1	67	36
Cn1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1=O	ZINC000819072409	CC	On-Demand	Anodyne	SLC6A1	67	36
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819072421	FH	On-Demand	Anodyne	GPR119	36	44
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819072422	FH	On-Demand	Anodyne	GPR119	36	44
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819072423	FH	On-Demand	Anodyne	GPR119	36	44
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819072424	FH	On-Demand	Anodyne	GPR119	36	44
Cn1cccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)c1=O	ZINC000819072426	CB	On-Demand	Anodyne	SLC6A1	46	34
Cn1cccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)c1=O	ZINC000819072428	CB	On-Demand	Anodyne	SLC6A1	46	34
Cn1ccnc1-c1cccc(NC(=O)C(=O)NCCC(=O)O)c1	ZINC000819072454	DC	On-Demand	Anodyne	PTPN11	60	34
Cn1cccc1[C@@H]1CCCN1C(=O)Nc1ccccc1CC(=O)O	ZINC000819072456	EG	On-Demand	Anodyne	SLC6A1	40	35
Cn1cccc1[C@@H]1CCCN1C(=O)Nc1ccccc1CC(=O)O	ZINC000819072456	EG	On-Demand	Anodyne	KCNQ2	45	34
Cn1cccc1[C@H]1CCCN1C(=O)Nc1ccccc1CC(=O)O	ZINC000819072457	EG	On-Demand	Anodyne	SLC6A1	40	35
Cn1cccc1[C@H]1CCCN1C(=O)Nc1ccccc1CC(=O)O	ZINC000819072457	EG	On-Demand	Anodyne	KCNQ2	45	34
Cn1cccc1[C@@H]1CCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819072460	EF	On-Demand	Anodyne	F2	24	41
Cn1cccc1[C@@H]1CCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819072460	EF	On-Demand	Anodyne	PTGER4	42	32
Cn1cccc1[C@@H]1CCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819072460	EF	On-Demand	Anodyne	PREP	30	44
Cn1cccc1[C@@H]1CCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819072460	EF	On-Demand	Anodyne	TMPRSS11D	65	38
Cn1cccc1[C@H]1CCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819072461	EF	On-Demand	Anodyne	F2	24	41
Cn1cccc1[C@H]1CCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819072461	EF	On-Demand	Anodyne	PTGER4	42	32
Cn1cccc1[C@H]1CCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819072461	EF	On-Demand	Anodyne	PREP	30	44
Cn1cccc1[C@H]1CCCN1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819072461	EF	On-Demand	Anodyne	TMPRSS11D	65	38
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(C(=O)c2ccc(F)cc2)CC1	ZINC000819072478	EE	On-Demand	Anodyne	L3MBTL3	72	43
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(C(=O)c2ccc(F)cc2)CC1	ZINC000819072480	EE	On-Demand	Anodyne	L3MBTL3	72	43
O=C(/C=C/[C@H]1CCCO1)N1CCCN(C(=O)c2ccc(F)cc2)CC1	ZINC000819072482	EE	On-Demand	Anodyne	L3MBTL3	72	43
O=C(/C=C\[C@H]1CCCO1)N1CCCN(C(=O)c2ccc(F)cc2)CC1	ZINC000819072484	EE	On-Demand	Anodyne	L3MBTL3	72	43
Cn1cccc1CNC(=O)NCCCCCC(=O)O	ZINC000819072493	CD	On-Demand	Anodyne	EPHX2	15	44
Cn1ccnc1-c1cccc(NC(=O)C(=O)N2CCO[C@@H](C(=O)O)C2)c1	ZINC000819072499	FC	On-Demand	Anodyne	CASR	19	41
Cn1ccnc1-c1cccc(NC(=O)C(=O)N2CCO[C@@H](C(=O)O)C2)c1	ZINC000819072499	FC	On-Demand	Anodyne	CCR3	26	40
Cn1ccnc1-c1cccc(NC(=O)C(=O)N2CCO[C@H](C(=O)O)C2)c1	ZINC000819072500	FC	On-Demand	Anodyne	CASR	19	41
Cn1ccnc1-c1cccc(NC(=O)C(=O)N2CCO[C@H](C(=O)O)C2)c1	ZINC000819072500	FC	On-Demand	Anodyne	CCR3	26	40
Cn1ccnc(N2CCN(C(=O)Nc3cccc(CC(=O)O)c3)CC2)c1=O	ZINC000819072509	FC	On-Demand	Anodyne	PDGFRB	55	41
Cn1ccnc(N2CCN(C(=O)Nc3cccc(CC(=O)O)c3)CC2)c1=O	ZINC000819072509	FC	On-Demand	Anodyne	P2RY14	44	34
Cn1ccnc(N2CCN(C(=O)Nc3cccc(CC(=O)O)c3)CC2)c1=O	ZINC000819072509	FC	On-Demand	Anodyne	LIMK2	21	42
O[C@@H](CN[C@H]1CCCN(c2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819072560	FH	On-Demand	Anodyne	ADRB3	17	47
O[C@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819072561	FH	On-Demand	Anodyne	ADRB3	17	47
O[C@@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819072562	FH	On-Demand	Anodyne	ADRB3	17	47
O[C@H](CN[C@H]1CCCN(c2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819072563	FH	On-Demand	Anodyne	ADRB3	17	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(C(=O)c2ccccn2)CC1	ZINC000819072604	FD	On-Demand	Anodyne	SFRP1	17	40
CN(C)[C@@H](CNC[C@H](O)c1cccnc1)c1c(F)cccc1F	ZINC000819072611	DE	On-Demand	Anodyne	ADRB1	22	44
CN(C)[C@@H](CNC[C@H](O)c1cccnc1)c1c(F)cccc1F	ZINC000819072611	DE	On-Demand	Anodyne	ADRB3	88	46
CN(C)[C@@H](CNC[C@@H](O)c1cccnc1)c1c(F)cccc1F	ZINC000819072613	DE	On-Demand	Anodyne	ADRB1	22	44
CN(C)[C@@H](CNC[C@@H](O)c1cccnc1)c1c(F)cccc1F	ZINC000819072613	DE	On-Demand	Anodyne	ADRB3	88	46
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819072631	GG	On-Demand	Anodyne	ADRB2	37	46
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819072631	GG	On-Demand	Anodyne	ADRB1	39	46
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819072631	GG	On-Demand	Anodyne	ADRB3	33	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819072631	GG	On-Demand	Anodyne	ABCB1	42	46
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819072631	GG	On-Demand	Anodyne	WNT3	41	34
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819072632	GG	On-Demand	Anodyne	ADRB2	37	46
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819072632	GG	On-Demand	Anodyne	ADRB1	39	46
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819072632	GG	On-Demand	Anodyne	ADRB3	33	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819072632	GG	On-Demand	Anodyne	ABCB1	42	46
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819072632	GG	On-Demand	Anodyne	WNT3	41	34
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819072633	GG	On-Demand	Anodyne	ADRB2	37	46
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819072633	GG	On-Demand	Anodyne	ADRB1	39	46
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819072633	GG	On-Demand	Anodyne	ADRB3	33	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819072633	GG	On-Demand	Anodyne	ABCB1	42	46
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819072633	GG	On-Demand	Anodyne	WNT3	41	34
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819072634	GG	On-Demand	Anodyne	ADRB2	37	46
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819072634	GG	On-Demand	Anodyne	ADRB1	39	46
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819072634	GG	On-Demand	Anodyne	ADRB3	33	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819072634	GG	On-Demand	Anodyne	ABCB1	42	46
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819072634	GG	On-Demand	Anodyne	WNT3	41	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1n[nH]c3ccccc13)C2	ZINC000819072648	EE	On-Demand	Anodyne	GSK3A	40	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1n[nH]c3ccccc13)C2	ZINC000819072649	EE	On-Demand	Anodyne	GSK3A	40	41
O[C@H](CNC[C@@H]1CCCN1Cc1ccccc1)c1cc2ccccc2o1	ZINC000819072660	FH	On-Demand	Anodyne	SIGMAR1	22	44
O[C@H](CNC[C@H]1CCCN1Cc1ccccc1)c1cc2ccccc2o1	ZINC000819072661	FH	On-Demand	Anodyne	SIGMAR1	22	44
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(OCc2ccccc2)c(OC)c1	ZINC000819072677	HI	On-Demand	Anodyne	ACE	18	44
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(OCc2ccccc2)c(OC)c1	ZINC000819072677	HI	On-Demand	Anodyne	FKBP1A	46	38
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(OCc2ccccc2)c(OC)c1	ZINC000819072677	HI	On-Demand	Anodyne	PTGER1	46	35
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(OCc2ccccc2)c(OC)c1	ZINC000819072677	HI	On-Demand	Anodyne	ACKR3	42	33
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(OCc2ccccc2)c(OC)c1	ZINC000819072679	HI	On-Demand	Anodyne	ACE	18	44
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(OCc2ccccc2)c(OC)c1	ZINC000819072679	HI	On-Demand	Anodyne	FKBP1A	46	38
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(OCc2ccccc2)c(OC)c1	ZINC000819072679	HI	On-Demand	Anodyne	PTGER1	46	35
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(OCc2ccccc2)c(OC)c1	ZINC000819072679	HI	On-Demand	Anodyne	ACKR3	42	33
CN(C[C@@H](O)CNC[C@H]1CCCN1Cc1ccccc1)C(=O)OC(C)(C)C	ZINC000819072688	GE	On-Demand	Anodyne	DRD2	15	43
CN(C[C@@H](O)CNC[C@@H]1CCCN1Cc1ccccc1)C(=O)OC(C)(C)C	ZINC000819072689	GE	On-Demand	Anodyne	DRD2	15	43
CN(C[C@H](O)CNC[C@@H]1CCCN1Cc1ccccc1)C(=O)OC(C)(C)C	ZINC000819072690	GE	On-Demand	Anodyne	DRD2	15	43
CN(C[C@H](O)CNC[C@H]1CCCN1Cc1ccccc1)C(=O)OC(C)(C)C	ZINC000819072691	GE	On-Demand	Anodyne	DRD2	15	43
CCNc1ccc(C#N)cc1NCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000819072696	GE	On-Demand	Mild	MAPK9	28	43
CCNc1ccc(C#N)cc1NCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000819072696	GE	On-Demand	Mild	MAPK8	24	43
CCNc1ccc(C#N)cc1NCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000819072696	GE	On-Demand	Mild	O49150_SOLTU	48	38
CCNc1ccc(C#N)cc1NCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000819072696	GE	On-Demand	Mild	RPS27	24	43
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819072697	FE	On-Demand	Mild	ADRB2	48	41
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819072697	FE	On-Demand	Mild	ADRB1	76	42
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819072697	FE	On-Demand	Mild	ADRB3	39	42
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819072697	FE	On-Demand	Mild	ABCB1	26	54
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819072698	FE	On-Demand	Mild	ADRB2	48	41
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819072698	FE	On-Demand	Mild	ADRB1	76	42
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819072698	FE	On-Demand	Mild	ADRB3	39	42
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819072698	FE	On-Demand	Mild	ABCB1	26	54
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819072701	JE	On-Demand	Anodyne	CNR2	16	50
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819072702	JE	On-Demand	Anodyne	CNR2	16	50
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819072704	GE	On-Demand	Anodyne	ADRB3	26	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819072704	GE	On-Demand	Anodyne	GPR119	81	51
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819072704	GE	On-Demand	Anodyne	SFRP1	82	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819072704	GE	On-Demand	Anodyne	WNT3	62	37
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819072705	GE	On-Demand	Anodyne	ADRB3	26	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819072705	GE	On-Demand	Anodyne	GPR119	81	51
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819072705	GE	On-Demand	Anodyne	SFRP1	82	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819072705	GE	On-Demand	Anodyne	WNT3	62	37
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819072706	GE	On-Demand	Anodyne	ADRB3	26	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819072706	GE	On-Demand	Anodyne	GPR119	81	51
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819072706	GE	On-Demand	Anodyne	SFRP1	82	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819072706	GE	On-Demand	Anodyne	WNT3	62	37
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819072707	GE	On-Demand	Anodyne	ADRB3	26	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819072707	GE	On-Demand	Anodyne	GPR119	81	51
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819072707	GE	On-Demand	Anodyne	SFRP1	82	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819072707	GE	On-Demand	Anodyne	WNT3	62	37
O[C@@H](CNCC1(c2cccc(Br)c2)CC1)c1cccnc1	ZINC000819072755	EG	On-Demand	Anodyne	ADRB2	20	41
O[C@@H](CNCC1(c2cccc(Br)c2)CC1)c1cccnc1	ZINC000819072755	EG	On-Demand	Anodyne	ADRB1	22	41
O[C@@H](CNCC1(c2cccc(Br)c2)CC1)c1cccnc1	ZINC000819072755	EG	On-Demand	Anodyne	ADRB3	85	43
O[C@H](CNCC1(c2cccc(Br)c2)CC1)c1cccnc1	ZINC000819072756	EG	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNCC1(c2cccc(Br)c2)CC1)c1cccnc1	ZINC000819072756	EG	On-Demand	Anodyne	ADRB1	22	41
O[C@H](CNCC1(c2cccc(Br)c2)CC1)c1cccnc1	ZINC000819072756	EG	On-Demand	Anodyne	ADRB3	85	43
Cn1ncc(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)c1C1CC1	ZINC000819072775	FD	On-Demand	Anodyne	NAMPT	73	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1C(=O)Nc1nccs1)C2	ZINC000819072792	GD	On-Demand	Anodyne	MAP1	92	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1C(=O)Nc1nccs1)C2	ZINC000819072793	GD	On-Demand	Anodyne	MAP1	92	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H]1C(=O)Nc1nccs1)C2	ZINC000819072794	GD	On-Demand	Anodyne	MAP1	92	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H]1C(=O)Nc1nccs1)C2	ZINC000819072795	GD	On-Demand	Anodyne	MAP1	92	36
O[C@@H](CNCCOC[C@@H]1CCCO1)c1cccnc1	ZINC000819072811	CC	On-Demand	Anodyne	ADRB2	24	49
O[C@@H](CNCCOC[C@@H]1CCCO1)c1cccnc1	ZINC000819072811	CC	On-Demand	Anodyne	ADRB1	28	50
O[C@@H](CNCCOC[C@@H]1CCCO1)c1cccnc1	ZINC000819072811	CC	On-Demand	Anodyne	ADRB3	97	52
O[C@@H](CNCCOC[C@H]1CCCO1)c1cccnc1	ZINC000819072812	CC	On-Demand	Anodyne	ADRB2	24	49
O[C@@H](CNCCOC[C@H]1CCCO1)c1cccnc1	ZINC000819072812	CC	On-Demand	Anodyne	ADRB1	28	50
O[C@@H](CNCCOC[C@H]1CCCO1)c1cccnc1	ZINC000819072812	CC	On-Demand	Anodyne	ADRB3	97	52
O[C@H](CNCCOC[C@@H]1CCCO1)c1cccnc1	ZINC000819072813	CC	On-Demand	Anodyne	ADRB2	24	49
O[C@H](CNCCOC[C@@H]1CCCO1)c1cccnc1	ZINC000819072813	CC	On-Demand	Anodyne	ADRB1	28	50
O[C@H](CNCCOC[C@@H]1CCCO1)c1cccnc1	ZINC000819072813	CC	On-Demand	Anodyne	ADRB3	97	52
O[C@H](CNCCOC[C@H]1CCCO1)c1cccnc1	ZINC000819072814	CC	On-Demand	Anodyne	ADRB2	24	49
O[C@H](CNCCOC[C@H]1CCCO1)c1cccnc1	ZINC000819072814	CC	On-Demand	Anodyne	ADRB1	28	50
O[C@H](CNCCOC[C@H]1CCCO1)c1cccnc1	ZINC000819072814	CC	On-Demand	Anodyne	ADRB3	97	52
C#CCOc1ccccc1CNC[C@H](O)COc1ccccc1Cl	ZINC000819072818	EF	On-Demand	Mild	ADRB2	24	49
C#CCOc1ccccc1CNC[C@H](O)COc1ccccc1Cl	ZINC000819072818	EF	On-Demand	Mild	ADRB1	57	36
C#CCOc1ccccc1CNC[C@@H](O)COc1ccccc1Cl	ZINC000819072819	EF	On-Demand	Mild	ADRB2	24	49
C#CCOc1ccccc1CNC[C@@H](O)COc1ccccc1Cl	ZINC000819072819	EF	On-Demand	Mild	ADRB1	57	36
Cc1c(F)cccc1NC(=O)CCN[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819072847	GG	On-Demand	Anodyne	GPR119	40	42
Cc1c(F)cccc1NC(=O)CCN[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819072848	GG	On-Demand	Anodyne	GPR119	40	42
Cc1ccccc1[C@@H](O)CNCCc1nc(-c2cccc(Cl)c2)no1	ZINC000819072855	FH	On-Demand	Anodyne	ADRB1	23	42
Cc1ccccc1[C@@H](O)CNCCc1nc(-c2cccc(Cl)c2)no1	ZINC000819072855	FH	On-Demand	Anodyne	ADRB3	31	42
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072857	GF	On-Demand	Anodyne	ADRB2	32	41
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072857	GF	On-Demand	Anodyne	ADRB1	44	41
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072857	GF	On-Demand	Anodyne	ADRB3	34	42
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072857	GF	On-Demand	Anodyne	GPR119	31	44
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072858	GF	On-Demand	Anodyne	ADRB2	32	41
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072858	GF	On-Demand	Anodyne	ADRB1	44	41
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072858	GF	On-Demand	Anodyne	ADRB3	34	42
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072858	GF	On-Demand	Anodyne	GPR119	31	44
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072859	GF	On-Demand	Anodyne	ADRB2	32	41
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072859	GF	On-Demand	Anodyne	ADRB1	44	41
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072859	GF	On-Demand	Anodyne	ADRB3	34	42
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072859	GF	On-Demand	Anodyne	GPR119	31	44
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072860	GF	On-Demand	Anodyne	ADRB2	32	41
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072860	GF	On-Demand	Anodyne	ADRB1	44	41
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072860	GF	On-Demand	Anodyne	ADRB3	34	42
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819072860	GF	On-Demand	Anodyne	GPR119	31	44
CC(C)(C)OC(=O)N1CCC[C@H](NCCS(=O)(=O)c2ccc(C#N)cn2)C1	ZINC000819072870	GD	On-Demand	Mild	GPR119	49	44
CC(C)(C)OC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2ccc(C#N)cn2)C1	ZINC000819072871	GD	On-Demand	Mild	GPR119	49	44
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)Nc2ccc(F)cc2)CC1	ZINC000819072888	EE	On-Demand	Anodyne	TRPM8	42	36
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)Nc2ccc(F)cc2)CC1	ZINC000819072889	EE	On-Demand	Anodyne	TRPM8	42	36
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)Nc2ccc(F)cc2)CC1	ZINC000819072890	EE	On-Demand	Anodyne	TRPM8	42	36
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)Nc2ccc(F)cc2)CC1	ZINC000819072891	EE	On-Demand	Anodyne	TRPM8	42	36
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819072911	GE	On-Demand	Mild	ADRB1	55	43
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819072911	GE	On-Demand	Mild	ADRB3	40	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819072911	GE	On-Demand	Mild	GPR119	31	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819072912	GE	On-Demand	Mild	ADRB1	55	43
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819072912	GE	On-Demand	Mild	ADRB3	40	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819072912	GE	On-Demand	Mild	GPR119	31	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819072913	GE	On-Demand	Mild	ADRB1	55	43
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819072913	GE	On-Demand	Mild	ADRB3	40	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819072913	GE	On-Demand	Mild	GPR119	31	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819072914	GE	On-Demand	Mild	ADRB1	55	43
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819072914	GE	On-Demand	Mild	ADRB3	40	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819072914	GE	On-Demand	Mild	GPR119	31	42
O[C@@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1cccnc1	ZINC000819072927	CE	On-Demand	Anodyne	ADRB3	88	51
O[C@H](CN[C@H]1CCCN(c2ccccc2)C1)c1cccnc1	ZINC000819072928	CE	On-Demand	Anodyne	ADRB3	88	51
O[C@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1cccnc1	ZINC000819072929	CE	On-Demand	Anodyne	ADRB3	88	51
O[C@@H](CN[C@H]1CCCN(c2ccccc2)C1)c1cccnc1	ZINC000819072930	CE	On-Demand	Anodyne	ADRB3	88	51
CC(C)(C)Nc1ccccc1NCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000819073000	GG	On-Demand	Anodyne	CA2	17	46
CC(C)(C)Nc1ccccc1NCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000819073000	GG	On-Demand	Anodyne	TRPV1	18	40
CC(C)(C)Nc1ccccc1NCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000819073000	GG	On-Demand	Anodyne	CA5B	21	43
CC(C)(C)Nc1ccccc1NCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000819073000	GG	On-Demand	Anodyne	CA5A	24	43
CC(C)(C)Nc1ccccc1NCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000819073000	GG	On-Demand	Anodyne	PRTN3	52	33
CC(C)(C)Nc1ccccc1NCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000819073000	GG	On-Demand	Anodyne	CA9	21	43
CON(C)C(=O)CCNCc1ccc(F)c(CN(C)C)c1	ZINC000819073006	CD	On-Demand	Anodyne	LEF	57	35
C[C@@H](CCC1CCCCC1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819073009	FG	On-Demand	Anodyne	ADRB2	15	41
C[C@@H](CCC1CCCCC1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819073010	FG	On-Demand	Anodyne	ADRB2	15	41
O[C@@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1ccccc1Cl	ZINC000819073012	EH	On-Demand	Anodyne	OPRL1	42	39
O[C@@H](CN[C@H]1CCCN(c2ccccc2)C1)c1ccccc1Cl	ZINC000819073013	EH	On-Demand	Anodyne	OPRL1	42	39
C=CC[C@H](NC[C@@H](O)COc1ccc(Br)cc1)c1ccncc1	ZINC000819073021	GG	On-Demand	Mild	ADRB2	17	40
C=CC[C@@H](NC[C@H](O)COc1ccc(Br)cc1)c1ccncc1	ZINC000819073022	GG	On-Demand	Mild	ADRB2	17	40
C=CC[C@@H](NC[C@@H](O)COc1ccc(Br)cc1)c1ccncc1	ZINC000819073023	GG	On-Demand	Mild	ADRB2	17	40
C=CC[C@H](NC[C@H](O)COc1ccc(Br)cc1)c1ccncc1	ZINC000819073024	GG	On-Demand	Mild	ADRB2	17	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccc(F)c1	ZINC000819073025	DE	On-Demand	Anodyne	PAPA1_CARPA	28	48
O[C@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1cccnc1	ZINC000819073070	FG	On-Demand	Anodyne	ADRB3	58	54
O[C@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1cccnc1	ZINC000819073071	FG	On-Demand	Anodyne	ADRB3	58	54
O[C@@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1cccnc1	ZINC000819073072	FG	On-Demand	Anodyne	ADRB3	58	54
O[C@@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1cccnc1	ZINC000819073073	FG	On-Demand	Anodyne	ADRB3	58	54
C=CC[C@@H](NC[C@H](O)COc1cc(C)cc(C)c1)c1ccncc1	ZINC000819073086	EG	On-Demand	Mild	ADRB2	19	53
C=CC[C@H](NC[C@H](O)COc1cc(C)cc(C)c1)c1ccncc1	ZINC000819073088	EG	On-Demand	Mild	ADRB2	19	53
C=CC[C@H](NC[C@@H](O)COc1cc(C)cc(C)c1)c1ccncc1	ZINC000819073089	EG	On-Demand	Mild	ADRB2	19	53
C=CC[C@@H](NC[C@@H](O)COc1cc(C)cc(C)c1)c1ccncc1	ZINC000819073090	EG	On-Demand	Mild	ADRB2	19	53
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccccc1C(F)(F)F)C2	ZINC000819073092	FG	On-Demand	Anodyne	P2RX7	53	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccccc1C(F)(F)F)C2	ZINC000819073095	FG	On-Demand	Anodyne	P2RX7	53	43
CCOC(=O)CC[C@H](O)CN[C@H](C)c1nc2ccccc2s1	ZINC000819073118	DF	On-Demand	Anodyne	TMPRSS6	49	32
CCOC(=O)CC[C@@H](O)CN[C@@H](C)c1nc2ccccc2s1	ZINC000819073120	DF	On-Demand	Anodyne	TMPRSS6	49	32
C=CC[C@@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccncc1	ZINC000819073121	EF	On-Demand	Mild	ADRB2	19	41
C=CC[C@@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccncc1	ZINC000819073121	EF	On-Demand	Mild	ADRB1	22	41
CCOC(=O)CC[C@H](O)CN[C@@H](C)c1nc2ccccc2s1	ZINC000819073122	DF	On-Demand	Anodyne	TMPRSS6	49	32
CCOC(=O)CC[C@@H](O)CN[C@H](C)c1nc2ccccc2s1	ZINC000819073123	DF	On-Demand	Anodyne	TMPRSS6	49	32
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(SC)cc1	ZINC000819073131	FF	On-Demand	Mild	ADRB2	38	42
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(SC)cc1	ZINC000819073131	FF	On-Demand	Mild	ADRB1	50	39
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(SC)cc1	ZINC000819073132	FF	On-Demand	Mild	ADRB2	38	42
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(SC)cc1	ZINC000819073132	FF	On-Demand	Mild	ADRB1	50	39
C#CCOc1ccccc1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819073133	GF	On-Demand	Mild	GPR119	45	51
C#CCOc1ccccc1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819073134	GF	On-Demand	Mild	GPR119	45	51
C=CC[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccncc1	ZINC000819073136	EF	On-Demand	Mild	ADRB2	19	41
C=CC[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccncc1	ZINC000819073136	EF	On-Demand	Mild	ADRB1	22	41
C=CC[C@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccncc1	ZINC000819073137	EF	On-Demand	Mild	ADRB2	19	41
C=CC[C@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccncc1	ZINC000819073137	EF	On-Demand	Mild	ADRB1	22	41
C=CC[C@@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccncc1	ZINC000819073138	EF	On-Demand	Mild	ADRB2	19	41
C=CC[C@@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccncc1	ZINC000819073138	EF	On-Demand	Mild	ADRB1	22	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819073146	FF	On-Demand	Anodyne	GPR119	43	49
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819073148	FF	On-Demand	Anodyne	GPR119	43	49
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819073149	FF	On-Demand	Anodyne	GPR119	43	49
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819073151	FF	On-Demand	Anodyne	GPR119	43	49
O[C@@H](CNC[C@H]1CCCN1Cc1ccccc1)c1cccnc1	ZINC000819073223	DE	On-Demand	Anodyne	ADRB2	23	43
O[C@@H](CNC[C@H]1CCCN1Cc1ccccc1)c1cccnc1	ZINC000819073223	DE	On-Demand	Anodyne	ADRB1	25	42
O[C@@H](CNC[C@H]1CCCN1Cc1ccccc1)c1cccnc1	ZINC000819073223	DE	On-Demand	Anodyne	ADRB3	94	45
O[C@@H](CNC[C@H]1CCCN1Cc1ccccc1)c1cccnc1	ZINC000819073223	DE	On-Demand	Anodyne	CHRNA7	18	40
O[C@@H](CNC[C@@H]1CCCN1Cc1ccccc1)c1cccnc1	ZINC000819073225	DE	On-Demand	Anodyne	ADRB2	23	43
O[C@@H](CNC[C@@H]1CCCN1Cc1ccccc1)c1cccnc1	ZINC000819073225	DE	On-Demand	Anodyne	ADRB1	25	42
O[C@@H](CNC[C@@H]1CCCN1Cc1ccccc1)c1cccnc1	ZINC000819073225	DE	On-Demand	Anodyne	ADRB3	94	45
O[C@@H](CNC[C@@H]1CCCN1Cc1ccccc1)c1cccnc1	ZINC000819073225	DE	On-Demand	Anodyne	CHRNA7	18	40
O[C@H](CNC[C@@H]1CCCN1Cc1ccccc1)c1cccnc1	ZINC000819073227	DE	On-Demand	Anodyne	ADRB2	23	43
O[C@H](CNC[C@@H]1CCCN1Cc1ccccc1)c1cccnc1	ZINC000819073227	DE	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CNC[C@@H]1CCCN1Cc1ccccc1)c1cccnc1	ZINC000819073227	DE	On-Demand	Anodyne	ADRB3	94	45
O[C@H](CNC[C@@H]1CCCN1Cc1ccccc1)c1cccnc1	ZINC000819073227	DE	On-Demand	Anodyne	CHRNA7	18	40
O[C@H](CNC[C@H]1CCCN1Cc1ccccc1)c1cccnc1	ZINC000819073229	DE	On-Demand	Anodyne	ADRB2	23	43
O[C@H](CNC[C@H]1CCCN1Cc1ccccc1)c1cccnc1	ZINC000819073229	DE	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CNC[C@H]1CCCN1Cc1ccccc1)c1cccnc1	ZINC000819073229	DE	On-Demand	Anodyne	ADRB3	94	45
O[C@H](CNC[C@H]1CCCN1Cc1ccccc1)c1cccnc1	ZINC000819073229	DE	On-Demand	Anodyne	CHRNA7	18	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1n[nH]c2ccccc12	ZINC000819073238	DE	On-Demand	Anodyne	GSK3A	37	42
N#Cc1ccc([C@H](O)CN[C@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819073239	DF	On-Demand	Mild	ADRB3	17	46
N#Cc1ccc([C@@H](O)CN[C@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819073242	DF	On-Demand	Mild	ADRB3	17	46
N#Cc1ccc([C@@H](O)CN[C@@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819073244	DF	On-Demand	Mild	ADRB3	17	46
N#Cc1ccc([C@H](O)CN[C@@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819073246	DF	On-Demand	Mild	ADRB3	17	46
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@H]1CCCN(c2ccccc2)C1	ZINC000819073248	GE	On-Demand	Anodyne	SFRP1	94	35
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@H]1CCCN(c2ccccc2)C1	ZINC000819073248	GE	On-Demand	Anodyne	WNT3	65	33
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@@H]1CCCN(c2ccccc2)C1	ZINC000819073249	GE	On-Demand	Anodyne	SFRP1	94	35
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@@H]1CCCN(c2ccccc2)C1	ZINC000819073249	GE	On-Demand	Anodyne	WNT3	65	33
CON(C)C(=O)CCN[C@H]1CCCN(c2ccccc2)C1	ZINC000819073252	CD	On-Demand	Anodyne	SLC6A1	54	32
CON(C)C(=O)CCN[C@@H]1CCCN(c2ccccc2)C1	ZINC000819073253	CD	On-Demand	Anodyne	SLC6A1	54	32
O[C@H](CNCc1nc(-c2cccc(Cl)c2)no1)C1CC1	ZINC000819073283	CE	On-Demand	Anodyne	GRM5	16	42
O[C@@H](CNCc1nc(-c2cccc(Cl)c2)no1)C1CC1	ZINC000819073284	CE	On-Demand	Anodyne	GRM5	16	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1C(=O)Nc1nccs1	ZINC000819073309	GD	On-Demand	Anodyne	MAP1	96	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1C(=O)Nc1nccs1	ZINC000819073310	GD	On-Demand	Anodyne	MAP1	96	37
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(Br)c1	ZINC000819073315	DG	On-Demand	Anodyne	KCNQ2	50	36
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(Br)c1	ZINC000819073316	DG	On-Demand	Anodyne	KCNQ2	50	36
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073360	FH	On-Demand	Mild	KLK3	44	33
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073360	FH	On-Demand	Mild	PAPA1_CARPA	74	53
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073360	FH	On-Demand	Mild	CCKAR	45	38
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073360	FH	On-Demand	Mild	CTSK	50	47
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073360	FH	On-Demand	Mild	CTSL	35	53
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073360	FH	On-Demand	Mild	TACR3	53	38
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073360	FH	On-Demand	Mild	REN	54	42
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073360	FH	On-Demand	Mild	CCKBR	20	40
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073360	FH	On-Demand	Mild	CTSS	26	56
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073360	FH	On-Demand	Mild	CAPN1	29	45
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073360	FH	On-Demand	Mild	CAPN2	56	35
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073360	FH	On-Demand	Mild	FPR1	53	46
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073360	FH	On-Demand	Mild	CTRB_BOVIN	56	39
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073361	FH	On-Demand	Mild	KLK3	44	33
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073361	FH	On-Demand	Mild	PAPA1_CARPA	74	53
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073361	FH	On-Demand	Mild	CCKAR	45	38
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073361	FH	On-Demand	Mild	CTSK	50	47
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073361	FH	On-Demand	Mild	CTSL	35	53
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073361	FH	On-Demand	Mild	TACR3	53	38
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073361	FH	On-Demand	Mild	REN	54	42
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073361	FH	On-Demand	Mild	CCKBR	20	40
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073361	FH	On-Demand	Mild	CTSS	26	56
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073361	FH	On-Demand	Mild	CAPN1	29	45
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073361	FH	On-Demand	Mild	CAPN2	56	35
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073361	FH	On-Demand	Mild	FPR1	53	46
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073361	FH	On-Demand	Mild	CTRB_BOVIN	56	39
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073362	FH	On-Demand	Mild	KLK3	44	33
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073362	FH	On-Demand	Mild	PAPA1_CARPA	74	53
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073362	FH	On-Demand	Mild	CCKAR	45	38
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073362	FH	On-Demand	Mild	CTSK	50	47
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073362	FH	On-Demand	Mild	CTSL	35	53
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073362	FH	On-Demand	Mild	TACR3	53	38
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073362	FH	On-Demand	Mild	REN	54	42
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073362	FH	On-Demand	Mild	CCKBR	20	40
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073362	FH	On-Demand	Mild	CTSS	26	56
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073362	FH	On-Demand	Mild	CAPN1	29	45
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073362	FH	On-Demand	Mild	CAPN2	56	35
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073362	FH	On-Demand	Mild	FPR1	53	46
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073362	FH	On-Demand	Mild	CTRB_BOVIN	56	39
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073363	FH	On-Demand	Mild	KLK3	44	33
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073363	FH	On-Demand	Mild	PAPA1_CARPA	74	53
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073363	FH	On-Demand	Mild	CCKAR	45	38
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073363	FH	On-Demand	Mild	CTSK	50	47
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073363	FH	On-Demand	Mild	CTSL	35	53
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073363	FH	On-Demand	Mild	TACR3	53	38
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073363	FH	On-Demand	Mild	REN	54	42
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073363	FH	On-Demand	Mild	CCKBR	20	40
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073363	FH	On-Demand	Mild	CTSS	26	56
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073363	FH	On-Demand	Mild	CAPN1	29	45
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073363	FH	On-Demand	Mild	CAPN2	56	35
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073363	FH	On-Demand	Mild	FPR1	53	46
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819073363	FH	On-Demand	Mild	CTRB_BOVIN	56	39
O[C@@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819073366	FH	On-Demand	Anodyne	ADRB1	15	46
O[C@@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819073366	FH	On-Demand	Anodyne	ADRB3	27	46
O[C@@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819073366	FH	On-Demand	Anodyne	MCHR1	15	41
O[C@@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819073366	FH	On-Demand	Anodyne	LIPG	46	35
O[C@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819073367	FH	On-Demand	Anodyne	ADRB1	15	46
O[C@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819073367	FH	On-Demand	Anodyne	ADRB3	27	46
O[C@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819073367	FH	On-Demand	Anodyne	MCHR1	15	41
O[C@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819073367	FH	On-Demand	Anodyne	LIPG	46	35
O[C@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819073368	FH	On-Demand	Anodyne	ADRB1	15	46
O[C@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819073368	FH	On-Demand	Anodyne	ADRB3	27	46
O[C@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819073368	FH	On-Demand	Anodyne	MCHR1	15	41
O[C@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819073368	FH	On-Demand	Anodyne	LIPG	46	35
O[C@@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819073369	FH	On-Demand	Anodyne	ADRB1	15	46
O[C@@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819073369	FH	On-Demand	Anodyne	ADRB3	27	46
O[C@@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819073369	FH	On-Demand	Anodyne	MCHR1	15	41
O[C@@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccccc1	ZINC000819073369	FH	On-Demand	Anodyne	LIPG	46	35
C=CCC1(C(=O)NCc2ccc(-n3ccnc3)nc2)CCOCC1	ZINC000819073380	EE	On-Demand	Mild	NOS2	84	34
C=CCC1(C(=O)NCc2ccc(-n3ccnc3)nc2)CCOCC1	ZINC000819073380	EE	On-Demand	Mild	NAMPT	19	49
C=CC[C@H](NC[C@@H](O)COc1cccc(C(F)(F)F)c1)c1ccncc1	ZINC000819073383	FH	On-Demand	Mild	PDS	42	37
C=CC[C@@H](NC[C@H](O)COc1cccc(C(F)(F)F)c1)c1ccncc1	ZINC000819073384	FH	On-Demand	Mild	PDS	42	37
C=CC[C@@H](NC[C@@H](O)COc1cccc(C(F)(F)F)c1)c1ccncc1	ZINC000819073385	FH	On-Demand	Mild	PDS	42	37
C=CC[C@H](NC[C@H](O)COc1cccc(C(F)(F)F)c1)c1ccncc1	ZINC000819073386	FH	On-Demand	Mild	PDS	42	37
C=CC[C@H](NC[C@@H](O)COc1ccccc1)c1ccncc1	ZINC000819073391	CF	On-Demand	Mild	ADRB2	36	51
C=CC[C@H](NC[C@@H](O)COc1ccccc1)c1ccncc1	ZINC000819073391	CF	On-Demand	Mild	ADRB1	42	40
C=CC[C@H](NC[C@@H](O)COc1ccccc1)c1ccncc1	ZINC000819073391	CF	On-Demand	Mild	ADRB3	27	40
C=CC[C@@H](NC[C@H](O)COc1ccccc1)c1ccncc1	ZINC000819073392	CF	On-Demand	Mild	ADRB2	36	51
C=CC[C@@H](NC[C@H](O)COc1ccccc1)c1ccncc1	ZINC000819073392	CF	On-Demand	Mild	ADRB1	42	40
C=CC[C@@H](NC[C@H](O)COc1ccccc1)c1ccncc1	ZINC000819073392	CF	On-Demand	Mild	ADRB3	27	40
C=CC[C@@H](NC[C@@H](O)COc1ccccc1)c1ccncc1	ZINC000819073393	CF	On-Demand	Mild	ADRB2	36	51
C=CC[C@@H](NC[C@@H](O)COc1ccccc1)c1ccncc1	ZINC000819073393	CF	On-Demand	Mild	ADRB1	42	40
C=CC[C@@H](NC[C@@H](O)COc1ccccc1)c1ccncc1	ZINC000819073393	CF	On-Demand	Mild	ADRB3	27	40
C=CC[C@H](NC[C@H](O)COc1ccccc1)c1ccncc1	ZINC000819073394	CF	On-Demand	Mild	ADRB2	36	51
C=CC[C@H](NC[C@H](O)COc1ccccc1)c1ccncc1	ZINC000819073394	CF	On-Demand	Mild	ADRB1	42	40
C=CC[C@H](NC[C@H](O)COc1ccccc1)c1ccncc1	ZINC000819073394	CF	On-Demand	Mild	ADRB3	27	40
C=CC[C@H](NC[C@H](O)COc1cccc(C)c1)c1ccncc1	ZINC000819073397	DG	On-Demand	Mild	ADRB2	23	58
C=CC[C@H](NC[C@H](O)COc1cccc(C)c1)c1ccncc1	ZINC000819073397	DG	On-Demand	Mild	ADRB1	18	58
C=CC[C@@H](NC[C@@H](O)COc1cccc(C)c1)c1ccncc1	ZINC000819073398	DG	On-Demand	Mild	ADRB2	23	58
C=CC[C@@H](NC[C@@H](O)COc1cccc(C)c1)c1ccncc1	ZINC000819073398	DG	On-Demand	Mild	ADRB1	18	58
C=CC[C@H](NC[C@@H](O)COc1cccc(C)c1)c1ccncc1	ZINC000819073399	DG	On-Demand	Mild	ADRB2	23	58
C=CC[C@H](NC[C@@H](O)COc1cccc(C)c1)c1ccncc1	ZINC000819073399	DG	On-Demand	Mild	ADRB1	18	58
C=CC[C@@H](NC[C@H](O)COc1cccc(C)c1)c1ccncc1	ZINC000819073400	DG	On-Demand	Mild	ADRB2	23	58
C=CC[C@@H](NC[C@H](O)COc1cccc(C)c1)c1ccncc1	ZINC000819073400	DG	On-Demand	Mild	ADRB1	18	58
C=CC[C@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccncc1	ZINC000819073411	EF	On-Demand	Mild	ADRB1	41	32
C=CC[C@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccncc1	ZINC000819073412	EF	On-Demand	Mild	ADRB1	41	32
C=CC[C@@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccncc1	ZINC000819073413	EF	On-Demand	Mild	ADRB1	41	32
C=CC[C@@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccncc1	ZINC000819073414	EF	On-Demand	Mild	ADRB1	41	32
C[C@@H](CC(=O)NNC(=O)[C@@H](C)Nc1nc2ccccc2s1)n1cccn1	ZINC000819073423	FE	On-Demand	Reactive	CSNK1D	24	40
C[C@@H](CC(=O)NNC(=O)[C@@H](C)Nc1nc2ccccc2s1)n1cccn1	ZINC000819073423	FE	On-Demand	Reactive	TMPRSS6	45	32
C[C@@H](Nc1nc2ccccc2s1)C(=O)NNC(=O)C[C@@H](C)n1cccn1	ZINC000819073425	FE	On-Demand	Reactive	CSNK1D	24	40
C[C@@H](Nc1nc2ccccc2s1)C(=O)NNC(=O)C[C@@H](C)n1cccn1	ZINC000819073425	FE	On-Demand	Reactive	TMPRSS6	45	32
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819073426	GE	On-Demand	Mild	ADRB2	30	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819073426	GE	On-Demand	Mild	ADRB1	41	43
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819073426	GE	On-Demand	Mild	ADRB3	27	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819073426	GE	On-Demand	Mild	GPR119	33	47
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819073427	GE	On-Demand	Mild	ADRB2	30	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819073427	GE	On-Demand	Mild	ADRB1	41	43
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819073427	GE	On-Demand	Mild	ADRB3	27	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819073427	GE	On-Demand	Mild	GPR119	33	47
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819073428	GE	On-Demand	Mild	ADRB2	30	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819073428	GE	On-Demand	Mild	ADRB1	41	43
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819073428	GE	On-Demand	Mild	ADRB3	27	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819073428	GE	On-Demand	Mild	GPR119	33	47
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819073429	GE	On-Demand	Mild	ADRB2	30	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819073429	GE	On-Demand	Mild	ADRB1	41	43
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819073429	GE	On-Demand	Mild	ADRB3	27	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819073429	GE	On-Demand	Mild	GPR119	33	47
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2Cl)C1	ZINC000819073430	GG	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2Cl)C1	ZINC000819073431	GG	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2Cl)C1	ZINC000819073432	GG	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2Cl)C1	ZINC000819073433	GG	On-Demand	Anodyne	GPR119	23	40
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819073475	EE	On-Demand	Mild	ADRB2	37	41
C#CCOc1ccccc1CNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819073475	EE	On-Demand	Mild	ADRB1	63	38
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819073478	EE	On-Demand	Mild	ADRB2	37	41
C#CCOc1ccccc1CNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819073478	EE	On-Demand	Mild	ADRB1	63	38
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(Br)c1	ZINC000819073489	DG	On-Demand	Anodyne	KCNQ2	50	36
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(Br)c1	ZINC000819073491	DG	On-Demand	Anodyne	KCNQ2	50	36
C[C@H](O)c1cc(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)ccc1F	ZINC000819073493	GE	On-Demand	Anodyne	TRPV1	22	42
C[C@H](O)c1cc(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)ccc1F	ZINC000819073493	GE	On-Demand	Anodyne	GHSR	17	41
CON(C)C(=O)CCN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1	ZINC000819073506	EE	On-Demand	Anodyne	MCHR1	28	44
CON(C)C(=O)CCN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1	ZINC000819073506	EE	On-Demand	Anodyne	LIPG	45	34
CON(C)C(=O)CCN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1	ZINC000819073508	EE	On-Demand	Anodyne	MCHR1	28	44
CON(C)C(=O)CCN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1	ZINC000819073508	EE	On-Demand	Anodyne	LIPG	45	34
O=C(NCc1ccccc1C(F)(F)F)C(F)=C1CCC1	ZINC000819073539	CH	On-Demand	Anodyne	P2RX7	41	39
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)COc1ccc2c(C)cc(=O)oc2c1	ZINC000819073552	GF	On-Demand	Anodyne	MAOA	64	52
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)COc1ccc2c(C)cc(=O)oc2c1	ZINC000819073552	GF	On-Demand	Anodyne	MAOB	47	52
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)COc1ccc2c(C)cc(=O)oc2c1	ZINC000819073555	GF	On-Demand	Anodyne	MAOA	64	52
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)COc1ccc2c(C)cc(=O)oc2c1	ZINC000819073555	GF	On-Demand	Anodyne	MAOB	47	52
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073576	FH	On-Demand	Mild	PAPA1_CARPA	52	47
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073576	FH	On-Demand	Mild	CTSK	41	47
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073576	FH	On-Demand	Mild	CTSL	26	46
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073576	FH	On-Demand	Mild	CTSS	24	51
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073576	FH	On-Demand	Mild	FPR1	49	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819073577	FF	On-Demand	Anodyne	ABCB1	23	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819073577	FF	On-Demand	Anodyne	GHSR	37	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819073577	FF	On-Demand	Anodyne	BIRC2	24	45
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073579	FH	On-Demand	Mild	PAPA1_CARPA	52	47
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073579	FH	On-Demand	Mild	CTSK	41	47
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073579	FH	On-Demand	Mild	CTSL	26	46
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073579	FH	On-Demand	Mild	CTSS	24	51
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073579	FH	On-Demand	Mild	FPR1	49	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819073580	FF	On-Demand	Anodyne	ABCB1	23	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819073580	FF	On-Demand	Anodyne	GHSR	37	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819073580	FF	On-Demand	Anodyne	BIRC2	24	45
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073582	FH	On-Demand	Mild	PAPA1_CARPA	52	47
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073582	FH	On-Demand	Mild	CTSK	41	47
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073582	FH	On-Demand	Mild	CTSL	26	46
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073582	FH	On-Demand	Mild	CTSS	24	51
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073582	FH	On-Demand	Mild	FPR1	49	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819073584	FF	On-Demand	Anodyne	ABCB1	23	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819073584	FF	On-Demand	Anodyne	GHSR	37	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819073584	FF	On-Demand	Anodyne	BIRC2	24	45
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073586	FH	On-Demand	Mild	PAPA1_CARPA	52	47
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073586	FH	On-Demand	Mild	CTSK	41	47
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073586	FH	On-Demand	Mild	CTSL	26	46
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073586	FH	On-Demand	Mild	CTSS	24	51
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819073586	FH	On-Demand	Mild	FPR1	49	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819073587	FF	On-Demand	Anodyne	ABCB1	23	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819073587	FF	On-Demand	Anodyne	GHSR	37	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2)C1	ZINC000819073587	FF	On-Demand	Anodyne	BIRC2	24	45
O=C(Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)Oc1ccc2c(c1)OCCO2	ZINC000819073596	HJ	On-Demand	Anodyne	PPARD	30	42
O=C(C(F)=C1CCC1)N1CCCN(C(=O)c2ccc(F)cc2)CC1	ZINC000819073624	EF	On-Demand	Anodyne	MLYCD	19	43
O=C(C(F)=C1CCC1)N1CCCN(C(=O)c2ccc(F)cc2)CC1	ZINC000819073624	EF	On-Demand	Anodyne	L3MBTL3	54	40
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CCCN(c2ccccc2)C1	ZINC000819073625	FF	On-Demand	Anodyne	REN	43	36
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@H]1CCCN(c2ccccc2)C1	ZINC000819073627	FF	On-Demand	Anodyne	REN	43	36
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1CCCN(c2ccccc2)C1	ZINC000819073629	FF	On-Demand	Anodyne	REN	43	36
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CCCN(c2ccccc2)C1	ZINC000819073631	FF	On-Demand	Anodyne	REN	43	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](C#N)c1ccc(Br)cc1	ZINC000819073638	GG	On-Demand	Mild	PAPA1_CARPA	30	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](C#N)c1ccc(Br)cc1	ZINC000819073644	GG	On-Demand	Mild	PAPA1_CARPA	30	44
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819073662	FH	On-Demand	Mild	PAPA1_CARPA	34	45
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819073662	FH	On-Demand	Mild	CTSK	17	42
C=CC[C@H](NC[C@@H](O)COc1cccc2[nH]ccc12)c1ccncc1	ZINC000819073671	EG	On-Demand	Mild	ADRB1	20	60
C=CC[C@@H](NC[C@H](O)COc1cccc2[nH]ccc12)c1ccncc1	ZINC000819073717	EG	On-Demand	Mild	ADRB1	20	60
C=CC[C@@H](NC[C@@H](O)COc1cccc2[nH]ccc12)c1ccncc1	ZINC000819073718	EG	On-Demand	Mild	ADRB1	20	60
C=CC[C@H](NC[C@H](O)COc1cccc2[nH]ccc12)c1ccncc1	ZINC000819073719	EG	On-Demand	Mild	ADRB1	20	60
C=CC[C@@H](NC[C@H](O)COc1ccccc1Cl)c1ccncc1	ZINC000819073735	EG	On-Demand	Mild	ADRB2	18	45
C=CC[C@@H](NC[C@@H](O)COc1ccccc1Cl)c1ccncc1	ZINC000819073736	EG	On-Demand	Mild	ADRB2	18	45
C=CC[C@H](NC[C@H](O)COc1ccccc1Cl)c1ccncc1	ZINC000819073737	EG	On-Demand	Mild	ADRB2	18	45
C=CC[C@H](NC[C@@H](O)COc1ccccc1Cl)c1ccncc1	ZINC000819073738	EG	On-Demand	Mild	ADRB2	18	45
C=CC[C@@H](NC[C@H](O)COc1cccc(C(C)=O)c1)c1ccncc1	ZINC000819073764	EF	On-Demand	Mild	ADRB2	20	53
C=CC[C@@H](NC[C@H](O)COc1cccc(C(C)=O)c1)c1ccncc1	ZINC000819073764	EF	On-Demand	Mild	ADRB1	21	42
C=CC[C@H](NC[C@H](O)COc1cccc(C(C)=O)c1)c1ccncc1	ZINC000819073765	EF	On-Demand	Mild	ADRB2	20	53
C=CC[C@H](NC[C@H](O)COc1cccc(C(C)=O)c1)c1ccncc1	ZINC000819073765	EF	On-Demand	Mild	ADRB1	21	42
C=CC[C@H](NC[C@@H](O)COc1cccc(C(C)=O)c1)c1ccncc1	ZINC000819073766	EF	On-Demand	Mild	ADRB2	20	53
C=CC[C@H](NC[C@@H](O)COc1cccc(C(C)=O)c1)c1ccncc1	ZINC000819073766	EF	On-Demand	Mild	ADRB1	21	42
C=CC[C@@H](NC[C@@H](O)COc1cccc(C(C)=O)c1)c1ccncc1	ZINC000819073767	EF	On-Demand	Mild	ADRB2	20	53
C=CC[C@@H](NC[C@@H](O)COc1cccc(C(C)=O)c1)c1ccncc1	ZINC000819073767	EF	On-Demand	Mild	ADRB1	21	42
C=CC[C@@H](NC[C@H](O)COc1ccccc1F)c1ccncc1	ZINC000819073781	DF	On-Demand	Mild	ADRB2	18	45
C=CC[C@@H](NC[C@H](O)COc1ccccc1F)c1ccncc1	ZINC000819073781	DF	On-Demand	Mild	ADRB1	43	35
C=CC[C@@H](NC[C@@H](O)COc1ccccc1F)c1ccncc1	ZINC000819073782	DF	On-Demand	Mild	ADRB2	18	45
C=CC[C@@H](NC[C@@H](O)COc1ccccc1F)c1ccncc1	ZINC000819073782	DF	On-Demand	Mild	ADRB1	43	35
C=CC[C@H](NC[C@H](O)COc1ccccc1F)c1ccncc1	ZINC000819073783	DF	On-Demand	Mild	ADRB2	18	45
C=CC[C@H](NC[C@H](O)COc1ccccc1F)c1ccncc1	ZINC000819073783	DF	On-Demand	Mild	ADRB1	43	35
C=CC[C@H](NC[C@@H](O)COc1ccccc1F)c1ccncc1	ZINC000819073784	DF	On-Demand	Mild	ADRB2	18	45
C=CC[C@H](NC[C@@H](O)COc1ccccc1F)c1ccncc1	ZINC000819073784	DF	On-Demand	Mild	ADRB1	43	35
C=CC[C@H](NC[C@@H](O)COc1ccc(C(C)(C)C)cc1)c1ccncc1	ZINC000819073788	FI	On-Demand	Mild	ADRB2	19	41
C=CC[C@H](NC[C@@H](O)COc1ccc(C(C)(C)C)cc1)c1ccncc1	ZINC000819073788	FI	On-Demand	Mild	ADRB1	18	40
C=CC[C@H](NC[C@H](O)COc1ccc(C(C)(C)C)cc1)c1ccncc1	ZINC000819073789	FI	On-Demand	Mild	ADRB2	19	41
C=CC[C@H](NC[C@H](O)COc1ccc(C(C)(C)C)cc1)c1ccncc1	ZINC000819073789	FI	On-Demand	Mild	ADRB1	18	40
C=CC[C@@H](NC[C@H](O)COc1ccc(C(C)(C)C)cc1)c1ccncc1	ZINC000819073790	FI	On-Demand	Mild	ADRB2	19	41
C=CC[C@@H](NC[C@H](O)COc1ccc(C(C)(C)C)cc1)c1ccncc1	ZINC000819073790	FI	On-Demand	Mild	ADRB1	18	40
C=CC[C@@H](NC[C@@H](O)COc1ccc(C(C)(C)C)cc1)c1ccncc1	ZINC000819073791	FI	On-Demand	Mild	ADRB2	19	41
C=CC[C@@H](NC[C@@H](O)COc1ccc(C(C)(C)C)cc1)c1ccncc1	ZINC000819073791	FI	On-Demand	Mild	ADRB1	18	40
C[C@@H]1CCCC[C@@H]1C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000819073799	CF	On-Demand	Anodyne	NOS2	99	42
C[C@@H]1CCCC[C@@H]1C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000819073799	CF	On-Demand	Anodyne	NAMPT	17	49
C[C@@H]1CCCC[C@H]1C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000819073800	CF	On-Demand	Anodyne	NOS2	99	42
C[C@@H]1CCCC[C@H]1C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000819073800	CF	On-Demand	Anodyne	NAMPT	17	49
O=C(/C=C/[C@@H]1CCCO1)N[C@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000819073825	EI	On-Demand	Anodyne	PRCP	32	42
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000819073826	EI	On-Demand	Anodyne	PRCP	32	42
O=C(/C=C\[C@@H]1CCCO1)N[C@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000819073827	EI	On-Demand	Anodyne	PRCP	32	42
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000819073828	EI	On-Demand	Anodyne	PRCP	32	42
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000819073831	EI	On-Demand	Anodyne	CCR3	45	39
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000819073831	EI	On-Demand	Anodyne	EPHX2	17	42
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000819073832	EI	On-Demand	Anodyne	CCR3	45	39
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000819073832	EI	On-Demand	Anodyne	EPHX2	17	42
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000819073833	EI	On-Demand	Anodyne	CCR3	45	39
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000819073833	EI	On-Demand	Anodyne	EPHX2	17	42
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000819073834	EI	On-Demand	Anodyne	CCR3	45	39
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000819073834	EI	On-Demand	Anodyne	EPHX2	17	42
Cc1ccccc1[C@@H](O)CNCc1ccc(F)c(CN(C)C)c1	ZINC000819073887	DG	On-Demand	Anodyne	LEF	43	34
C#CCOc1ccccc1CNC[C@@H](O)COc1ccccc1C	ZINC000819073910	EF	On-Demand	Mild	ADRB2	30	58
C#CCOc1ccccc1CNC[C@@H](O)COc1ccccc1C	ZINC000819073910	EF	On-Demand	Mild	ADRB1	57	37
C#CCOc1ccccc1CNC[C@H](O)COc1ccccc1C	ZINC000819073912	EF	On-Demand	Mild	ADRB2	30	58
C#CCOc1ccccc1CNC[C@H](O)COc1ccccc1C	ZINC000819073912	EF	On-Demand	Mild	ADRB1	57	37
C=CC[C@H](NC[C@@H](O)COc1ccc(Cl)cc1)c1ccncc1	ZINC000819073931	EG	On-Demand	Mild	ADRB2	17	40
C=CC[C@@H](NC[C@H](O)COc1ccc(Cl)cc1)c1ccncc1	ZINC000819073934	EG	On-Demand	Mild	ADRB2	17	40
C=CC[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1)c1ccncc1	ZINC000819073937	EG	On-Demand	Mild	ADRB2	17	40
C=CC[C@H](NC[C@H](O)COc1ccc(Cl)cc1)c1ccncc1	ZINC000819073939	EG	On-Demand	Mild	ADRB2	17	40
C=CC[C@@H](NC[C@H](O)COc1ccccc1C(F)(F)F)c1ccncc1	ZINC000819073942	FH	On-Demand	Mild	ADRB2	17	43
C=CC[C@@H](NC[C@@H](O)COc1ccccc1C(F)(F)F)c1ccncc1	ZINC000819073949	FH	On-Demand	Mild	ADRB2	17	43
C=CC[C@H](NC[C@H](O)COc1ccccc1C(F)(F)F)c1ccncc1	ZINC000819073952	FH	On-Demand	Mild	ADRB2	17	43
C=CC[C@H](NC[C@@H](O)COc1ccccc1C(F)(F)F)c1ccncc1	ZINC000819073954	FH	On-Demand	Mild	ADRB2	17	43
O[C@H](CNC[C@@H]1CCCN1Cc1ccccc1)C1CC1	ZINC000819073971	CE	On-Demand	Anodyne	SLC18A2	40	36
O[C@H](CNC[C@@H]1CCCN1Cc1ccccc1)C1CC1	ZINC000819073971	CE	On-Demand	Anodyne	SIGMAR1	24	47
O[C@H](CNC[C@H]1CCCN1Cc1ccccc1)C1CC1	ZINC000819073974	CE	On-Demand	Anodyne	SLC18A2	40	36
O[C@H](CNC[C@H]1CCCN1Cc1ccccc1)C1CC1	ZINC000819073974	CE	On-Demand	Anodyne	SIGMAR1	24	47
O[C@@H](CNC[C@@H]1CCCN1Cc1ccccc1)C1CC1	ZINC000819073976	CE	On-Demand	Anodyne	SLC18A2	40	36
O[C@@H](CNC[C@@H]1CCCN1Cc1ccccc1)C1CC1	ZINC000819073976	CE	On-Demand	Anodyne	SIGMAR1	24	47
O[C@@H](CNC[C@H]1CCCN1Cc1ccccc1)C1CC1	ZINC000819073978	CE	On-Demand	Anodyne	SLC18A2	40	36
O[C@@H](CNC[C@H]1CCCN1Cc1ccccc1)C1CC1	ZINC000819073978	CE	On-Demand	Anodyne	SIGMAR1	24	47
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2F)C1	ZINC000819073992	GF	On-Demand	Anodyne	GPR119	33	50
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2F)C1	ZINC000819073995	GF	On-Demand	Anodyne	GPR119	33	50
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2F)C1	ZINC000819073997	GF	On-Demand	Anodyne	GPR119	33	50
C=CC[C@H](NC[C@@H](O)COc1ccccc1C)c1ccncc1	ZINC000819073999	DG	On-Demand	Mild	ADRB2	24	56
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2F)C1	ZINC000819074000	GF	On-Demand	Anodyne	GPR119	33	50
C=CC[C@@H](NC[C@@H](O)COc1ccccc1C)c1ccncc1	ZINC000819074001	DG	On-Demand	Mild	ADRB2	24	56
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2cccc(F)c2)C1	ZINC000819074002	FG	On-Demand	Anodyne	CCR3	36	40
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2cccc(F)c2)C1	ZINC000819074002	FG	On-Demand	Anodyne	GPR119	34	46
C=CC[C@H](NC[C@H](O)COc1ccccc1C)c1ccncc1	ZINC000819074004	DG	On-Demand	Mild	ADRB2	24	56
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccc(F)c2)C1	ZINC000819074005	FG	On-Demand	Anodyne	CCR3	36	40
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccc(F)c2)C1	ZINC000819074005	FG	On-Demand	Anodyne	GPR119	34	46
C=CC[C@@H](NC[C@H](O)COc1ccccc1C)c1ccncc1	ZINC000819074006	DG	On-Demand	Mild	ADRB2	24	56
CON(C)C(=O)CCNC[C@@H]1CCCN1Cc1ccccc1	ZINC000819074013	DD	On-Demand	Anodyne	DRD2	42	48
CON(C)C(=O)CCNC[C@@H]1CCCN1Cc1ccccc1	ZINC000819074013	DD	On-Demand	Anodyne	LTA4H	15	42
CON(C)C(=O)CCNC[C@@H]1CCCN1Cc1ccccc1	ZINC000819074013	DD	On-Demand	Anodyne	SIGMAR1	32	49
CON(C)C(=O)CCNC[C@H]1CCCN1Cc1ccccc1	ZINC000819074014	DD	On-Demand	Anodyne	DRD2	42	48
CON(C)C(=O)CCNC[C@H]1CCCN1Cc1ccccc1	ZINC000819074014	DD	On-Demand	Anodyne	LTA4H	15	42
CON(C)C(=O)CCNC[C@H]1CCCN1Cc1ccccc1	ZINC000819074014	DD	On-Demand	Anodyne	SIGMAR1	32	49
CC(=O)c1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074015	FG	On-Demand	Mild	PAPA1_CARPA	61	49
CC(=O)c1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074015	FG	On-Demand	Mild	CTSK	23	43
CC(=O)c1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074015	FG	On-Demand	Mild	CTSL	20	49
CC(=O)c1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074015	FG	On-Demand	Mild	CTSS	15	49
CC(=O)c1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074015	FG	On-Demand	Mild	FPR1	48	41
CC(=O)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074016	FG	On-Demand	Mild	PAPA1_CARPA	61	49
CC(=O)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074016	FG	On-Demand	Mild	CTSK	23	43
CC(=O)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074016	FG	On-Demand	Mild	CTSL	20	49
CC(=O)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074016	FG	On-Demand	Mild	CTSS	15	49
CC(=O)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074016	FG	On-Demand	Mild	FPR1	48	41
C=CC[C@@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccncc1	ZINC000819074072	GG	On-Demand	Mild	GPR119	42	41
C=CC[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccncc1	ZINC000819074073	GG	On-Demand	Mild	GPR119	42	41
C=CC[C@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccncc1	ZINC000819074074	GG	On-Demand	Mild	GPR119	42	41
C=CC[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccncc1	ZINC000819074075	GG	On-Demand	Mild	GPR119	42	41
O[C@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819074076	DF	On-Demand	Anodyne	LIPG	44	32
O[C@@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819074077	DF	On-Demand	Anodyne	LIPG	44	32
O[C@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819074078	DF	On-Demand	Anodyne	LIPG	44	32
O[C@@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)C1CC1	ZINC000819074079	DF	On-Demand	Anodyne	LIPG	44	32
C=CC[C@H](NCCS(=O)(=O)c1ccc(C(C)(C)C)cc1)c1ccncc1	ZINC000819074091	FI	On-Demand	Mild	CYNT	23	43
C=CC[C@@H](NCCS(=O)(=O)c1ccc(C(C)(C)C)cc1)c1ccncc1	ZINC000819074092	FI	On-Demand	Mild	CYNT	23	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1nc(-c2ccccc2)no1	ZINC000819074127	FE	On-Demand	Anodyne	PDE8B	50	30
CC(C)(C)OC(=O)N1CCC[C@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819074137	GE	On-Demand	Mild	GPR119	44	38
CC(C)(C)OC(=O)N1CCC[C@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819074137	GE	On-Demand	Mild	SFRP1	109	40
CC(C)(C)OC(=O)N1CCC[C@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819074137	GE	On-Demand	Mild	WNT3	69	37
CC(C)(C)OC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819074138	GE	On-Demand	Mild	GPR119	44	38
CC(C)(C)OC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819074138	GE	On-Demand	Mild	SFRP1	109	40
CC(C)(C)OC(=O)N1CCC[C@@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819074138	GE	On-Demand	Mild	WNT3	69	37
CN(C)[C@@H](CNC[C@@H](O)c1ccccc1)c1c(F)cccc1F	ZINC000819074167	DF	On-Demand	Anodyne	AOC3	23	43
CN(C)[C@@H](CNC[C@H](O)c1ccccc1)c1c(F)cccc1F	ZINC000819074169	DF	On-Demand	Anodyne	AOC3	23	43
COc1cccc([S@@](=O)CC(=O)NC[C@@H]2CC2(Cl)Cl)c1	ZINC000819074172	EE	On-Demand	Anodyne	DRD4	41	31
COc1cccc([S@@](=O)CC(=O)NC[C@@H]2CC2(Cl)Cl)c1	ZINC000819074172	EE	On-Demand	Anodyne	MTNR1A	47	36
COc1cccc([S@@](=O)CC(=O)NC[C@@H]2CC2(Cl)Cl)c1	ZINC000819074172	EE	On-Demand	Anodyne	MTNR1B	42	36
COc1cccc([S@@](=O)CC(=O)NC[C@H]2CC2(Cl)Cl)c1	ZINC000819074174	EE	On-Demand	Anodyne	DRD4	41	31
COc1cccc([S@@](=O)CC(=O)NC[C@H]2CC2(Cl)Cl)c1	ZINC000819074174	EE	On-Demand	Anodyne	MTNR1A	47	36
COc1cccc([S@@](=O)CC(=O)NC[C@H]2CC2(Cl)Cl)c1	ZINC000819074174	EE	On-Demand	Anodyne	MTNR1B	42	36
O=C(NCC(=O)Oc1ccc2c(c1)OCCO2)Nc1ccccc1	ZINC000819074181	EE	On-Demand	Anodyne	F7	18	44
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1cc(-c2ccccn2)nc2ccccc12	ZINC000819074195	HI	On-Demand	Anodyne	METAP1	45	38
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc(-c2ccccn2)nc2ccccc12	ZINC000819074197	HI	On-Demand	Anodyne	METAP1	45	38
CN(C)[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)c1c(F)cccc1F	ZINC000819074250	FH	On-Demand	Anodyne	ADRB1	30	46
CN(C)[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)c1c(F)cccc1F	ZINC000819074250	FH	On-Demand	Anodyne	ADRB3	44	46
CN(C)[C@@H](CNC[C@H](O)c1cccc(Cl)c1)c1c(F)cccc1F	ZINC000819074254	FH	On-Demand	Anodyne	ADRB1	30	46
CN(C)[C@@H](CNC[C@H](O)c1cccc(Cl)c1)c1c(F)cccc1F	ZINC000819074254	FH	On-Demand	Anodyne	ADRB3	44	46
C=CC[C@H](NC[C@@H](O)COc1cc(C)ccc1C)c1ccncc1	ZINC000819074263	EG	On-Demand	Mild	ADRB2	15	47
C=CC[C@H](NC[C@H](O)COc1cc(C)ccc1C)c1ccncc1	ZINC000819074264	EG	On-Demand	Mild	ADRB2	15	47
C=CC[C@@H](NC[C@H](O)COc1cc(C)ccc1C)c1ccncc1	ZINC000819074265	EG	On-Demand	Mild	ADRB2	15	47
C=CC[C@@H](NC[C@@H](O)COc1cc(C)ccc1C)c1ccncc1	ZINC000819074266	EG	On-Demand	Mild	ADRB2	15	47
O[C@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccc(F)c(F)c1	ZINC000819074267	GH	On-Demand	Anodyne	ADRB3	17	44
O[C@@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccc(F)c(F)c1	ZINC000819074268	GH	On-Demand	Anodyne	ADRB3	17	44
O[C@@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccc(F)c(F)c1	ZINC000819074269	GH	On-Demand	Anodyne	ADRB3	17	44
O[C@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccc(F)c(F)c1	ZINC000819074271	GH	On-Demand	Anodyne	ADRB3	17	44
O[C@@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819074294	FH	On-Demand	Anodyne	LIPG	41	37
O[C@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819074296	FH	On-Demand	Anodyne	LIPG	41	37
O[C@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819074298	FH	On-Demand	Anodyne	LIPG	41	37
O[C@@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1ccc(F)cc1	ZINC000819074300	FH	On-Demand	Anodyne	LIPG	41	37
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819074311	FE	On-Demand	Anodyne	ADRB1	19	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819074311	FE	On-Demand	Anodyne	ADRB3	36	44
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819074312	FE	On-Demand	Anodyne	ADRB1	19	41
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819074312	FE	On-Demand	Anodyne	ADRB3	36	44
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819074313	FE	On-Demand	Anodyne	ADRB1	19	41
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819074313	FE	On-Demand	Anodyne	ADRB3	36	44
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819074314	FE	On-Demand	Anodyne	ADRB1	19	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819074314	FE	On-Demand	Anodyne	ADRB3	36	44
O[C@@H](CN[C@H]1CCCN(c2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819074334	EH	On-Demand	Anodyne	ADRB1	16	44
O[C@@H](CN[C@H]1CCCN(c2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819074334	EH	On-Demand	Anodyne	ADRB3	28	44
O[C@@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819074335	EH	On-Demand	Anodyne	ADRB1	16	44
O[C@@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819074335	EH	On-Demand	Anodyne	ADRB3	28	44
CC(=O)c1ccc(OC[C@H](O)CN[C@H](c2ccccc2)C2CCOCC2)cc1	ZINC000819074384	GG	On-Demand	Anodyne	ADRB2	39	44
CC(=O)c1ccc(OC[C@H](O)CN[C@H](c2ccccc2)C2CCOCC2)cc1	ZINC000819074384	GG	On-Demand	Anodyne	ADRB1	57	42
CC(=O)c1ccc(OC[C@H](O)CN[C@H](c2ccccc2)C2CCOCC2)cc1	ZINC000819074384	GG	On-Demand	Anodyne	ABCB1	24	56
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](c2ccccc2)C2CCOCC2)cc1	ZINC000819074385	GG	On-Demand	Anodyne	ADRB2	39	44
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](c2ccccc2)C2CCOCC2)cc1	ZINC000819074385	GG	On-Demand	Anodyne	ADRB1	57	42
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](c2ccccc2)C2CCOCC2)cc1	ZINC000819074385	GG	On-Demand	Anodyne	ABCB1	24	56
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](c2ccccc2)C2CCOCC2)cc1	ZINC000819074386	GG	On-Demand	Anodyne	ADRB2	39	44
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](c2ccccc2)C2CCOCC2)cc1	ZINC000819074386	GG	On-Demand	Anodyne	ADRB1	57	42
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](c2ccccc2)C2CCOCC2)cc1	ZINC000819074386	GG	On-Demand	Anodyne	ABCB1	24	56
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](c2ccccc2)C2CCOCC2)cc1	ZINC000819074387	GG	On-Demand	Anodyne	ADRB2	39	44
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](c2ccccc2)C2CCOCC2)cc1	ZINC000819074387	GG	On-Demand	Anodyne	ADRB1	57	42
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](c2ccccc2)C2CCOCC2)cc1	ZINC000819074387	GG	On-Demand	Anodyne	ABCB1	24	56
COC(=O)c1cc(N[C@H]2CCN(C(C)(C)C)C2=O)ccc1N1CCCCC1	ZINC000819074390	FG	On-Demand	Anodyne	NPY2R	40	39
COC(=O)c1cc(N[C@@H]2CCN(C(C)(C)C)C2=O)ccc1N1CCCCC1	ZINC000819074391	FG	On-Demand	Anodyne	NPY2R	40	39
C=CC[C@H](NC[C@@H](O)COc1ccc(F)cc1)c1ccncc1	ZINC000819074392	DF	On-Demand	Mild	ADRB2	21	40
C=CC[C@@H](NC[C@H](O)COc1ccc(F)cc1)c1ccncc1	ZINC000819074393	DF	On-Demand	Mild	ADRB2	21	40
C=CC[C@@H](NC[C@@H](O)COc1ccc(F)cc1)c1ccncc1	ZINC000819074394	DF	On-Demand	Mild	ADRB2	21	40
C=CC[C@H](NC[C@H](O)COc1ccc(F)cc1)c1ccncc1	ZINC000819074395	DF	On-Demand	Mild	ADRB2	21	40
O=C1NCCc2c(NCC[C@@H]3CC3(Cl)Cl)cccc21	ZINC000819074410	CF	On-Demand	Anodyne	PARP1	16	44
O=C1NCCc2c(NCC[C@H]3CC3(Cl)Cl)cccc21	ZINC000819074411	CF	On-Demand	Anodyne	PARP1	16	44
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(-n2ccnc2)nc1	ZINC000819074432	CD	On-Demand	Anodyne	NOS2	95	36
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(-n2ccnc2)nc1	ZINC000819074433	CD	On-Demand	Anodyne	NOS2	95	36
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(-n2ccnc2)nc1	ZINC000819074434	CD	On-Demand	Anodyne	NOS2	95	36
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(-n2ccnc2)nc1	ZINC000819074435	CD	On-Demand	Anodyne	NOS2	95	36
CNC(=O)CNC(=O)c1cccc(NCC[C@@H]2CC2(Cl)Cl)c1	ZINC000819074442	EE	On-Demand	Anodyne	CCR2	63	37
CNC(=O)CNC(=O)c1cccc(NCC[C@H]2CC2(Cl)Cl)c1	ZINC000819074443	EE	On-Demand	Anodyne	CCR2	63	37
C=CC[C@H](NC[C@H](O)COc1ccc(C)cc1)c1ccncc1	ZINC000819074544	DG	On-Demand	Mild	ADRB2	24	54
C=CC[C@H](NC[C@H](O)COc1ccc(C)cc1)c1ccncc1	ZINC000819074544	DG	On-Demand	Mild	ADRB1	22	41
C=CC[C@@H](NC[C@@H](O)COc1ccc(C)cc1)c1ccncc1	ZINC000819074545	DG	On-Demand	Mild	ADRB2	24	54
C=CC[C@@H](NC[C@@H](O)COc1ccc(C)cc1)c1ccncc1	ZINC000819074545	DG	On-Demand	Mild	ADRB1	22	41
C=CC[C@H](NC[C@@H](O)COc1ccc(C)cc1)c1ccncc1	ZINC000819074546	DG	On-Demand	Mild	ADRB2	24	54
C=CC[C@H](NC[C@@H](O)COc1ccc(C)cc1)c1ccncc1	ZINC000819074546	DG	On-Demand	Mild	ADRB1	22	41
C=CC[C@@H](NC[C@H](O)COc1ccc(C)cc1)c1ccncc1	ZINC000819074547	DG	On-Demand	Mild	ADRB2	24	54
C=CC[C@@H](NC[C@H](O)COc1ccc(C)cc1)c1ccncc1	ZINC000819074547	DG	On-Demand	Mild	ADRB1	22	41
C=CC[C@H](NC[C@@H](O)COc1c(C)cccc1C)c1ccncc1	ZINC000819074550	EG	On-Demand	Mild	ADRB2	17	40
C=CC[C@H](NC[C@H](O)COc1c(C)cccc1C)c1ccncc1	ZINC000819074551	EG	On-Demand	Mild	ADRB2	17	40
C=CC[C@@H](NC[C@H](O)COc1c(C)cccc1C)c1ccncc1	ZINC000819074552	EG	On-Demand	Mild	ADRB2	17	40
C=CC[C@@H](NC[C@@H](O)COc1c(C)cccc1C)c1ccncc1	ZINC000819074553	EG	On-Demand	Mild	ADRB2	17	40
C=CC[C@@H](NC[C@H](O)COc1ccc(NC(C)=O)cc1)c1ccncc1	ZINC000819074585	FF	On-Demand	Mild	ADRB2	36	58
C=CC[C@@H](NC[C@H](O)COc1ccc(NC(C)=O)cc1)c1ccncc1	ZINC000819074585	FF	On-Demand	Mild	ADRB1	60	58
C=CC[C@@H](NC[C@H](O)COc1ccc(NC(C)=O)cc1)c1ccncc1	ZINC000819074585	FF	On-Demand	Mild	ADRB3	37	46
C=CC[C@H](NC[C@H](O)COc1ccc(NC(C)=O)cc1)c1ccncc1	ZINC000819074586	FF	On-Demand	Mild	ADRB2	36	58
C=CC[C@H](NC[C@H](O)COc1ccc(NC(C)=O)cc1)c1ccncc1	ZINC000819074586	FF	On-Demand	Mild	ADRB1	60	58
C=CC[C@H](NC[C@H](O)COc1ccc(NC(C)=O)cc1)c1ccncc1	ZINC000819074586	FF	On-Demand	Mild	ADRB3	37	46
C=CC[C@H](NC[C@@H](O)COc1ccc(NC(C)=O)cc1)c1ccncc1	ZINC000819074587	FF	On-Demand	Mild	ADRB2	36	58
C=CC[C@H](NC[C@@H](O)COc1ccc(NC(C)=O)cc1)c1ccncc1	ZINC000819074587	FF	On-Demand	Mild	ADRB1	60	58
C=CC[C@H](NC[C@@H](O)COc1ccc(NC(C)=O)cc1)c1ccncc1	ZINC000819074587	FF	On-Demand	Mild	ADRB3	37	46
C=CC[C@@H](NC[C@@H](O)COc1ccc(NC(C)=O)cc1)c1ccncc1	ZINC000819074588	FF	On-Demand	Mild	ADRB2	36	58
C=CC[C@@H](NC[C@@H](O)COc1ccc(NC(C)=O)cc1)c1ccncc1	ZINC000819074588	FF	On-Demand	Mild	ADRB1	60	58
C=CC[C@@H](NC[C@@H](O)COc1ccc(NC(C)=O)cc1)c1ccncc1	ZINC000819074588	FF	On-Demand	Mild	ADRB3	37	46
CC(=O)Nc1cccc(CC(=O)NC[C@H]2CC2(Cl)Cl)c1	ZINC000819074600	DE	On-Demand	Anodyne	KCNK3	43	31
CC(=O)Nc1cccc(CC(=O)NC[C@@H]2CC2(Cl)Cl)c1	ZINC000819074601	DE	On-Demand	Anodyne	KCNK3	43	31
O=C(Cn1cnc2sccc2c1=O)OCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1	ZINC000819074602	JH	On-Demand	Anodyne	GRIN2D	77	33
O=C(Cn1cnc2sccc2c1=O)OCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1	ZINC000819074603	JH	On-Demand	Anodyne	GRIN2D	77	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(-n3ccnc3)nc1)C2	ZINC000819074614	FD	On-Demand	Anodyne	NOS2	95	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(-n3ccnc3)nc1)C2	ZINC000819074615	FD	On-Demand	Anodyne	NOS2	95	38
C=CC[C@H](NC[C@@H](O)COc1ccc(SC)cc1)c1ccncc1	ZINC000819074623	EG	On-Demand	Mild	ADRB2	16	40
C=CC[C@H](NC[C@H](O)COc1ccc(SC)cc1)c1ccncc1	ZINC000819074624	EG	On-Demand	Mild	ADRB2	16	40
C=CC[C@@H](NC[C@H](O)COc1ccc(SC)cc1)c1ccncc1	ZINC000819074625	EG	On-Demand	Mild	ADRB2	16	40
C=CC[C@@H](NC[C@@H](O)COc1ccc(SC)cc1)c1ccncc1	ZINC000819074626	EG	On-Demand	Mild	ADRB2	16	40
O[C@@H](CN[C@H]1CCCN(c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819074668	FH	On-Demand	Anodyne	LIPG	44	33
O[C@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819074669	FH	On-Demand	Anodyne	LIPG	44	33
O[C@@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819074670	FH	On-Demand	Anodyne	LIPG	44	33
O[C@H](CN[C@H]1CCCN(c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819074671	FH	On-Demand	Anodyne	LIPG	44	33
O=C(Nc1nccs1)[C@@H]1CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819074674	DD	On-Demand	Anodyne	MAP1	74	40
O=C(Nc1nccs1)[C@@H]1CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819074675	DD	On-Demand	Anodyne	MAP1	74	40
O=C(Nc1nccs1)[C@@H]1CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819074676	DD	On-Demand	Anodyne	MAP1	74	40
O=C(Nc1nccs1)[C@@H]1CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819074677	DD	On-Demand	Anodyne	MAP1	74	40
O[C@@H](CNCCOC[C@H]1CCCO1)c1cccc(Cl)c1	ZINC000819074678	CE	On-Demand	Anodyne	ADRB1	55	47
O[C@@H](CNCCOC[C@H]1CCCO1)c1cccc(Cl)c1	ZINC000819074678	CE	On-Demand	Anodyne	ADRB3	61	47
O[C@@H](CNCCOC[C@H]1CCCO1)c1cccc(Cl)c1	ZINC000819074678	CE	On-Demand	Anodyne	CYP3A4	45	34
O[C@@H](CNCCOC[C@@H]1CCCO1)c1cccc(Cl)c1	ZINC000819074679	CE	On-Demand	Anodyne	ADRB1	55	47
O[C@@H](CNCCOC[C@@H]1CCCO1)c1cccc(Cl)c1	ZINC000819074679	CE	On-Demand	Anodyne	ADRB3	61	47
O[C@@H](CNCCOC[C@@H]1CCCO1)c1cccc(Cl)c1	ZINC000819074679	CE	On-Demand	Anodyne	CYP3A4	45	34
O[C@H](CNCCOC[C@H]1CCCO1)c1cccc(Cl)c1	ZINC000819074680	CE	On-Demand	Anodyne	ADRB1	55	47
O[C@H](CNCCOC[C@H]1CCCO1)c1cccc(Cl)c1	ZINC000819074680	CE	On-Demand	Anodyne	ADRB3	61	47
O[C@H](CNCCOC[C@H]1CCCO1)c1cccc(Cl)c1	ZINC000819074680	CE	On-Demand	Anodyne	CYP3A4	45	34
O[C@H](CNCCOC[C@@H]1CCCO1)c1cccc(Cl)c1	ZINC000819074681	CE	On-Demand	Anodyne	ADRB1	55	47
O[C@H](CNCCOC[C@@H]1CCCO1)c1cccc(Cl)c1	ZINC000819074681	CE	On-Demand	Anodyne	ADRB3	61	47
O[C@H](CNCCOC[C@@H]1CCCO1)c1cccc(Cl)c1	ZINC000819074681	CE	On-Demand	Anodyne	CYP3A4	45	34
O=S(=O)(c1ccc(NCC[C@H]2CC2(Cl)Cl)cc1)N1CCC[C@@H]1CO	ZINC000819074711	GF	On-Demand	Anodyne	CASP3	72	41
O=S(=O)(c1ccc(NCC[C@H]2CC2(Cl)Cl)cc1)N1CCC[C@@H]1CO	ZINC000819074711	GF	On-Demand	Anodyne	CASP9	15	41
O=S(=O)(c1ccc(NCC[C@H]2CC2(Cl)Cl)cc1)N1CCC[C@@H]1CO	ZINC000819074711	GF	On-Demand	Anodyne	CASP7	84	41
O=S(=O)(c1ccc(NCC[C@H]2CC2(Cl)Cl)cc1)N1CCC[C@H]1CO	ZINC000819074712	GF	On-Demand	Anodyne	CASP3	72	41
O=S(=O)(c1ccc(NCC[C@H]2CC2(Cl)Cl)cc1)N1CCC[C@H]1CO	ZINC000819074712	GF	On-Demand	Anodyne	CASP9	15	41
O=S(=O)(c1ccc(NCC[C@H]2CC2(Cl)Cl)cc1)N1CCC[C@H]1CO	ZINC000819074712	GF	On-Demand	Anodyne	CASP7	84	41
O=S(=O)(c1ccc(NCC[C@@H]2CC2(Cl)Cl)cc1)N1CCC[C@H]1CO	ZINC000819074713	GF	On-Demand	Anodyne	CASP3	72	41
O=S(=O)(c1ccc(NCC[C@@H]2CC2(Cl)Cl)cc1)N1CCC[C@H]1CO	ZINC000819074713	GF	On-Demand	Anodyne	CASP9	15	41
O=S(=O)(c1ccc(NCC[C@@H]2CC2(Cl)Cl)cc1)N1CCC[C@H]1CO	ZINC000819074713	GF	On-Demand	Anodyne	CASP7	84	41
O=S(=O)(c1ccc(NCC[C@@H]2CC2(Cl)Cl)cc1)N1CCC[C@@H]1CO	ZINC000819074714	GF	On-Demand	Anodyne	CASP3	72	41
O=S(=O)(c1ccc(NCC[C@@H]2CC2(Cl)Cl)cc1)N1CCC[C@@H]1CO	ZINC000819074714	GF	On-Demand	Anodyne	CASP9	15	41
O=S(=O)(c1ccc(NCC[C@@H]2CC2(Cl)Cl)cc1)N1CCC[C@@H]1CO	ZINC000819074714	GF	On-Demand	Anodyne	CASP7	84	41
O=C(Nc1nccs1)[C@@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819074726	DE	On-Demand	Anodyne	MAP1	96	43
O=C(Nc1nccs1)[C@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819074727	DE	On-Demand	Anodyne	MAP1	96	43
O[C@@H](CN[C@H]1CCCN(c2ccccc2)C1)c1ccc(F)cc1	ZINC000819074739	DG	On-Demand	Anodyne	SLC6A3	28	51
O=C(NCc1ccc(-n2ccnc2)nc1)C(F)=C1CCC1	ZINC000819074751	CE	On-Demand	Anodyne	NOS2	96	37
CC[C@@H](NC(=O)C(F)=C1CCC1)c1ccccc1	ZINC000819074754	BH	On-Demand	Anodyne	TACR3	50	42
C=CC[C@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccncc1	ZINC000819074760	FI	On-Demand	Mild	HDAC10	22	41
C=CC[C@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccncc1	ZINC000819074760	FI	On-Demand	Mild	HDAC3	26	41
C=CC[C@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccncc1	ZINC000819074760	FI	On-Demand	Mild	HDAC6	20	54
C=CC[C@@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccncc1	ZINC000819074761	FI	On-Demand	Mild	HDAC10	22	41
C=CC[C@@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccncc1	ZINC000819074761	FI	On-Demand	Mild	HDAC3	26	41
C=CC[C@@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccncc1	ZINC000819074761	FI	On-Demand	Mild	HDAC6	20	54
CNC(=O)c1cc(Oc2cccc(NCC[C@@H]3CC3(Cl)Cl)c2)ccn1	ZINC000819074763	GI	On-Demand	Anodyne	RAF1	72	47
CNC(=O)c1cc(Oc2cccc(NCC[C@H]3CC3(Cl)Cl)c2)ccn1	ZINC000819074764	GI	On-Demand	Anodyne	RAF1	72	47
COC(=O)[C@@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819074776	BD	On-Demand	Anodyne	FKBP1A	57	37
COC(=O)[C@@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819074776	BD	On-Demand	Anodyne	PREP	24	43
O=C(NCc1ccc(-n2ccnc2)nc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819074777	GG	On-Demand	Anodyne	NOS2	94	36
O=C(NCc1ccc(-n2ccnc2)nc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819074777	GG	On-Demand	Anodyne	NAMPT	18	51
O[C@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1ccc(F)cc1	ZINC000819074799	DG	On-Demand	Anodyne	SLC6A3	28	51
O[C@@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1ccc(F)cc1	ZINC000819074801	DG	On-Demand	Anodyne	SLC6A3	28	51
O[C@H](CN[C@H]1CCCN(c2ccccc2)C1)c1ccc(F)cc1	ZINC000819074803	DG	On-Demand	Anodyne	SLC6A3	28	51
COC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074807	FD	On-Demand	Mild	F2	29	46
COC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074807	FD	On-Demand	Mild	PLG	26	42
COC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074807	FD	On-Demand	Mild	PRSS1	18	46
COC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074807	FD	On-Demand	Mild	CELA1	56	46
COC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074807	FD	On-Demand	Mild	TRHR	49	33
COC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074807	FD	On-Demand	Mild	CMA1	34	42
COC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074807	FD	On-Demand	Mild	PAPA1_CARPA	35	43
COC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074807	FD	On-Demand	Mild	TRY1_BOVIN	46	46
COC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074807	FD	On-Demand	Mild	NTSR1	33	41
COC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074807	FD	On-Demand	Mild	CTSK	16	44
COC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074810	FD	On-Demand	Mild	F2	29	46
COC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074810	FD	On-Demand	Mild	PLG	26	42
COC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074810	FD	On-Demand	Mild	PRSS1	18	46
COC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074810	FD	On-Demand	Mild	CELA1	56	46
COC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074810	FD	On-Demand	Mild	TRHR	49	33
COC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074810	FD	On-Demand	Mild	CMA1	34	42
COC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074810	FD	On-Demand	Mild	PAPA1_CARPA	35	43
COC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074810	FD	On-Demand	Mild	TRY1_BOVIN	46	46
COC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074810	FD	On-Demand	Mild	NTSR1	33	41
COC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819074810	FD	On-Demand	Mild	CTSK	16	44
CN(C)[C@@H](CNC[C@H](O)c1ccc(Cl)cc1)c1c(F)cccc1F	ZINC000819074816	FH	On-Demand	Anodyne	UTS2	41	32
O[C@@H](CN[C@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819074873	EH	On-Demand	Anodyne	ADRB1	41	49
O[C@@H](CN[C@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819074873	EH	On-Demand	Anodyne	ADRB3	62	50
O[C@@H](CN[C@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819074873	EH	On-Demand	Anodyne	CYP3A4	49	38
O[C@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819074874	EH	On-Demand	Anodyne	ADRB1	41	49
O[C@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819074874	EH	On-Demand	Anodyne	ADRB3	62	50
O[C@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819074874	EH	On-Demand	Anodyne	CYP3A4	49	38
O[C@@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819074875	EH	On-Demand	Anodyne	ADRB1	41	49
O[C@@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819074875	EH	On-Demand	Anodyne	ADRB3	62	50
O[C@@H](CN[C@@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819074875	EH	On-Demand	Anodyne	CYP3A4	49	38
O[C@H](CN[C@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819074876	EH	On-Demand	Anodyne	ADRB1	41	49
O[C@H](CN[C@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819074876	EH	On-Demand	Anodyne	ADRB3	62	50
O[C@H](CN[C@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819074876	EH	On-Demand	Anodyne	CYP3A4	49	38
C=CC[C@@H](NC[C@H](O)COc1cccc(CC)c1)c1ccncc1	ZINC000819074899	EG	On-Demand	Mild	ADRB2	28	45
C=CC[C@@H](NC[C@H](O)COc1cccc(CC)c1)c1ccncc1	ZINC000819074899	EG	On-Demand	Mild	ADRB1	29	42
C=CC[C@H](NC[C@H](O)COc1cccc(CC)c1)c1ccncc1	ZINC000819074900	EG	On-Demand	Mild	ADRB2	28	45
C=CC[C@H](NC[C@H](O)COc1cccc(CC)c1)c1ccncc1	ZINC000819074900	EG	On-Demand	Mild	ADRB1	29	42
C=CC[C@H](NC[C@@H](O)COc1cccc(CC)c1)c1ccncc1	ZINC000819074901	EG	On-Demand	Mild	ADRB2	28	45
C=CC[C@H](NC[C@@H](O)COc1cccc(CC)c1)c1ccncc1	ZINC000819074901	EG	On-Demand	Mild	ADRB1	29	42
C=CC[C@@H](NC[C@@H](O)COc1cccc(CC)c1)c1ccncc1	ZINC000819074902	EG	On-Demand	Mild	ADRB2	28	45
C=CC[C@@H](NC[C@@H](O)COc1cccc(CC)c1)c1ccncc1	ZINC000819074902	EG	On-Demand	Mild	ADRB1	29	42
C=C(C)C(C)(C)C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000819074915	CE	On-Demand	Mild	NOS2	75	34
COc1ccc(N[C@@H]2CCN(C(C)(C)C)C2=O)cc1S(C)(=O)=O	ZINC000819074979	ED	On-Demand	Anodyne	CPT2	40	33
COc1ccc(N[C@H]2CCN(C(C)(C)C)C2=O)cc1S(C)(=O)=O	ZINC000819074980	ED	On-Demand	Anodyne	CPT2	40	33
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCN(c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819074987	GH	On-Demand	Bother	ADRB3	18	41
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCN(c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819074988	GH	On-Demand	Bother	ADRB3	18	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCN(c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819074989	GH	On-Demand	Bother	ADRB3	18	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCN(c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819074990	GH	On-Demand	Bother	ADRB3	18	41
C=CC[C@@H](NC[C@H](O)COc1ccc(C(C)=O)cc1)c1ccncc1	ZINC000819074993	EF	On-Demand	Mild	ADRB2	20	44
C=CC[C@@H](NC[C@H](O)COc1ccc(C(C)=O)cc1)c1ccncc1	ZINC000819074993	EF	On-Demand	Mild	ADRB1	25	43
C=CC[C@H](NC[C@H](O)COc1ccc(C(C)=O)cc1)c1ccncc1	ZINC000819074994	EF	On-Demand	Mild	ADRB2	20	44
C=CC[C@H](NC[C@H](O)COc1ccc(C(C)=O)cc1)c1ccncc1	ZINC000819074994	EF	On-Demand	Mild	ADRB1	25	43
C=CC[C@H](NC[C@@H](O)COc1ccc(C(C)=O)cc1)c1ccncc1	ZINC000819074995	EF	On-Demand	Mild	ADRB2	20	44
C=CC[C@H](NC[C@@H](O)COc1ccc(C(C)=O)cc1)c1ccncc1	ZINC000819074995	EF	On-Demand	Mild	ADRB1	25	43
C=CC[C@@H](NC[C@@H](O)COc1ccc(C(C)=O)cc1)c1ccncc1	ZINC000819074996	EF	On-Demand	Mild	ADRB2	20	44
C=CC[C@@H](NC[C@@H](O)COc1ccc(C(C)=O)cc1)c1ccncc1	ZINC000819074996	EF	On-Demand	Mild	ADRB1	25	43
O[C@@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819075012	FH	On-Demand	Anodyne	ADRB3	20	43
O[C@@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819075012	FH	On-Demand	Anodyne	LIPG	40	33
O[C@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819075013	FH	On-Demand	Anodyne	ADRB3	20	43
O[C@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819075013	FH	On-Demand	Anodyne	LIPG	40	33
O[C@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819075014	FH	On-Demand	Anodyne	ADRB3	20	43
O[C@H](CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819075014	FH	On-Demand	Anodyne	LIPG	40	33
O[C@@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819075015	FH	On-Demand	Anodyne	ADRB3	20	43
O[C@@H](CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1)c1cccc(F)c1	ZINC000819075015	FH	On-Demand	Anodyne	LIPG	40	33
C[C@H](CC(=O)NCc1ccc(-n2ccnc2)nc1)n1cccn1	ZINC000819075026	DD	On-Demand	Anodyne	NOS2	90	36
C[C@@H](CC(=O)NCc1ccc(-n2ccnc2)nc1)n1cccn1	ZINC000819075027	DD	On-Demand	Anodyne	NOS2	90	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000819075030	FD	On-Demand	Anodyne	NOS2	90	36
C#CCNC(=O)CCN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1	ZINC000819075067	EE	On-Demand	Mild	MCHR1	23	42
C#CCNC(=O)CCN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1	ZINC000819075068	EE	On-Demand	Mild	MCHR1	23	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccnc1N1CCOCC1	ZINC000819075163	GD	On-Demand	Anodyne	SCN10A	30	47
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819075183	HI	On-Demand	Anodyne	TACR3	21	42
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819075184	HI	On-Demand	Anodyne	TACR3	21	42
O=C(/C=C\[C@H]1CCCO1)NCc1cccnc1N1CCOCC1	ZINC000819075191	DD	On-Demand	Anodyne	SCN10A	21	48
O=C(/C=C/[C@H]1CCCO1)NCc1cccnc1N1CCOCC1	ZINC000819075192	DD	On-Demand	Anodyne	SCN10A	21	48
O=C(/C=C/[C@@H]1CCCO1)NCc1cccnc1N1CCOCC1	ZINC000819075193	DD	On-Demand	Anodyne	SCN10A	21	48
O=C(/C=C\[C@@H]1CCCO1)NCc1cccnc1N1CCOCC1	ZINC000819075194	DD	On-Demand	Anodyne	SCN10A	21	48
O=C1CCc2cc(NCC[C@@H]3CC3(Cl)Cl)c(F)cc2N1	ZINC000819075208	DH	On-Demand	Anodyne	PKM	34	42
O=C1CCc2cc(NCC[C@H]3CC3(Cl)Cl)c(F)cc2N1	ZINC000819075209	DH	On-Demand	Anodyne	PKM	34	42
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)/C=C\[C@@H]1CCCO1	ZINC000819075232	CH	On-Demand	Anodyne	UTS2	40	31
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)/C=C/[C@@H]1CCCO1	ZINC000819075233	CH	On-Demand	Anodyne	UTS2	40	31
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)/C=C/[C@H]1CCCO1	ZINC000819075234	CH	On-Demand	Anodyne	UTS2	40	31
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)/C=C\[C@H]1CCCO1	ZINC000819075235	CH	On-Demand	Anodyne	UTS2	40	31
C[C@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C(C)(C)C	ZINC000819075238	EG	On-Demand	Anodyne	GPR119	34	46
C[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C(C)(C)C	ZINC000819075239	EG	On-Demand	Anodyne	GPR119	34	46
C[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C(C)(C)C	ZINC000819075240	EG	On-Demand	Anodyne	GPR119	34	46
C[C@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C(C)(C)C	ZINC000819075241	EG	On-Demand	Anodyne	GPR119	34	46
O=C(NC[C@H]1CCCCN1C(=O)C(F)=C1CCC1)Nc1ccccc1	ZINC000819075247	EH	On-Demand	Anodyne	HCRTR1	22	59
CC(=O)Nc1cccc([C@H](C)NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819075269	DF	On-Demand	Anodyne	KCNQ2	50	35
CC(=O)Nc1cccc([C@H](C)NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819075270	DF	On-Demand	Anodyne	KCNQ2	50	35
CC(=O)Nc1cccc([C@H](C)NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819075271	DF	On-Demand	Anodyne	KCNQ2	50	35
CC(=O)Nc1cccc([C@H](C)NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819075272	DF	On-Demand	Anodyne	KCNQ2	50	35
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000819075284	JG	On-Demand	Anodyne	EPHX2	22	43
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000819075287	JG	On-Demand	Anodyne	EPHX2	22	43
O=C(/C=C/[C@@H]1CCCO1)N(Cc1ccc(C(F)(F)F)cc1)C1CC1	ZINC000819075313	EH	On-Demand	Anodyne	LUXR	15	40
O=C(/C=C\[C@@H]1CCCO1)N(Cc1ccc(C(F)(F)F)cc1)C1CC1	ZINC000819075314	EH	On-Demand	Anodyne	LUXR	15	40
O=C(/C=C\[C@H]1CCCO1)N(Cc1ccc(C(F)(F)F)cc1)C1CC1	ZINC000819075315	EH	On-Demand	Anodyne	LUXR	15	40
O=C(/C=C/[C@H]1CCCO1)N(Cc1ccc(C(F)(F)F)cc1)C1CC1	ZINC000819075316	EH	On-Demand	Anodyne	LUXR	15	40
O=C(C(F)=C1CCC1)N1CCCN(C(=O)c2cccc(F)c2)CC1	ZINC000819075332	EF	On-Demand	Anodyne	HRH3	23	40
C[C@H](CNC[C@@H](O)COc1ccccc1[N+](=O)[O-])C(C)(C)C	ZINC000819075371	DF	On-Demand	Bother	ADRB2	33	49
C[C@H](CNC[C@@H](O)COc1ccccc1[N+](=O)[O-])C(C)(C)C	ZINC000819075371	DF	On-Demand	Bother	ADRB1	63	37
C[C@H](CNC[C@@H](O)COc1ccccc1[N+](=O)[O-])C(C)(C)C	ZINC000819075371	DF	On-Demand	Bother	COLA	77	34
C[C@H](CNC[C@H](O)COc1ccccc1[N+](=O)[O-])C(C)(C)C	ZINC000819075372	DF	On-Demand	Bother	ADRB2	33	49
C[C@H](CNC[C@H](O)COc1ccccc1[N+](=O)[O-])C(C)(C)C	ZINC000819075372	DF	On-Demand	Bother	ADRB1	63	37
C[C@H](CNC[C@H](O)COc1ccccc1[N+](=O)[O-])C(C)(C)C	ZINC000819075372	DF	On-Demand	Bother	COLA	77	34
C[C@@H](CNC[C@@H](O)COc1ccccc1[N+](=O)[O-])C(C)(C)C	ZINC000819075373	DF	On-Demand	Bother	ADRB2	33	49
C[C@@H](CNC[C@@H](O)COc1ccccc1[N+](=O)[O-])C(C)(C)C	ZINC000819075373	DF	On-Demand	Bother	ADRB1	63	37
C[C@@H](CNC[C@@H](O)COc1ccccc1[N+](=O)[O-])C(C)(C)C	ZINC000819075373	DF	On-Demand	Bother	COLA	77	34
C[C@@H](CNC[C@H](O)COc1ccccc1[N+](=O)[O-])C(C)(C)C	ZINC000819075374	DF	On-Demand	Bother	ADRB2	33	49
C[C@@H](CNC[C@H](O)COc1ccccc1[N+](=O)[O-])C(C)(C)C	ZINC000819075374	DF	On-Demand	Bother	ADRB1	63	37
C[C@@H](CNC[C@H](O)COc1ccccc1[N+](=O)[O-])C(C)(C)C	ZINC000819075374	DF	On-Demand	Bother	COLA	77	34
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075379	CF	On-Demand	Bother	CACNA1D	40	34
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075380	CF	On-Demand	Bother	CACNA1D	40	34
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075381	CF	On-Demand	Bother	CACNA1D	40	34
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075382	CF	On-Demand	Bother	CACNA1D	40	34
CCCOc1ccc(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819075390	GF	On-Demand	Anodyne	CA2	18	43
CCCOc1ccc(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819075390	GF	On-Demand	Anodyne	CA1	18	43
CCCOc1ccc(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819075390	GF	On-Demand	Anodyne	CA7	16	43
CCCOc1ccc(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819075390	GF	On-Demand	Anodyne	MMP2	15	43
CCCOc1ccc(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819075390	GF	On-Demand	Anodyne	FAAH	15	42
CCCOc1ccc(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819075390	GF	On-Demand	Anodyne	CA9	25	43
CCCOc1ccc(NCC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819075390	GF	On-Demand	Anodyne	MMP1	17	43
C[C@@H]1CCCC[C@H]1N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075444	FH	On-Demand	Mild	PAPA1_CARPA	36	42
C[C@@H]1CCCC[C@@H]1N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075445	FH	On-Demand	Mild	PAPA1_CARPA	36	42
C[C@@H]1CCCC[C@H]1N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075446	FH	On-Demand	Mild	PAPA1_CARPA	36	42
C[C@@H]1CCCC[C@@H]1N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075447	FH	On-Demand	Mild	PAPA1_CARPA	36	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccccc1CN1CCCC1=O	ZINC000819075477	GE	On-Demand	Anodyne	CCKAR	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1c1ccc(Cl)cc1)C2	ZINC000819075478	GH	On-Demand	Anodyne	SLC6A3	25	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H]1c1ccc(Cl)cc1)C2	ZINC000819075479	GH	On-Demand	Anodyne	SLC6A3	25	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1c1ccc(Cl)cc1)C2	ZINC000819075480	GH	On-Demand	Anodyne	SLC6A3	25	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H]1c1ccc(Cl)cc1)C2	ZINC000819075481	GH	On-Demand	Anodyne	SLC6A3	25	41
Cc1nc2cc(NCc3nc(C(F)F)no3)ccc2s1	ZINC000819075486	CH	On-Demand	Anodyne	ACOX1	47	34
C[C@@H](C#N)Oc1ccccc1NCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000819075520	GE	On-Demand	Mild	CTSF	41	33
C[C@@H](C#N)Oc1ccccc1NCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000819075520	GE	On-Demand	Mild	MAPK9	27	42
C[C@@H](C#N)Oc1ccccc1NCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000819075520	GE	On-Demand	Mild	MAPK8	25	42
C[C@H](C#N)Oc1ccccc1NCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000819075521	GE	On-Demand	Mild	CTSF	41	33
C[C@H](C#N)Oc1ccccc1NCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000819075521	GE	On-Demand	Mild	MAPK9	27	42
C[C@H](C#N)Oc1ccccc1NCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000819075521	GE	On-Demand	Mild	MAPK8	25	42
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075522	GI	On-Demand	Mild	PAPA1_CARPA	50	43
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075522	GI	On-Demand	Mild	CTSK	21	43
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075522	GI	On-Demand	Mild	FPR1	37	41
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075522	GI	On-Demand	Mild	UTS2	42	33
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075523	GI	On-Demand	Mild	PAPA1_CARPA	50	43
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075523	GI	On-Demand	Mild	CTSK	21	43
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075523	GI	On-Demand	Mild	FPR1	37	41
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075523	GI	On-Demand	Mild	UTS2	42	33
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075524	GI	On-Demand	Mild	PAPA1_CARPA	50	43
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075524	GI	On-Demand	Mild	CTSK	21	43
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075524	GI	On-Demand	Mild	FPR1	37	41
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075524	GI	On-Demand	Mild	UTS2	42	33
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075525	GI	On-Demand	Mild	PAPA1_CARPA	50	43
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075525	GI	On-Demand	Mild	CTSK	21	43
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075525	GI	On-Demand	Mild	FPR1	37	41
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075525	GI	On-Demand	Mild	UTS2	42	33
COc1ccccc1COC[C@H](O)CNC[C@@H](C)C(C)(C)C	ZINC000819075551	DF	On-Demand	Anodyne	ADRB2	25	42
COc1ccccc1COC[C@H](O)CNC[C@H](C)C(C)(C)C	ZINC000819075552	DF	On-Demand	Anodyne	ADRB2	25	42
COc1ccccc1COC[C@@H](O)CNC[C@H](C)C(C)(C)C	ZINC000819075553	DF	On-Demand	Anodyne	ADRB2	25	42
COc1ccccc1COC[C@@H](O)CNC[C@@H](C)C(C)(C)C	ZINC000819075554	DF	On-Demand	Anodyne	ADRB2	25	42
C[C@@H](CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075584	DF	On-Demand	Bother	ADRB2	41	49
C[C@@H](CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075584	DF	On-Demand	Bother	ADRB1	43	49
C[C@@H](CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075584	DF	On-Demand	Bother	ADRB3	28	49
C[C@@H](CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075584	DF	On-Demand	Bother	PDS	17	45
C[C@@H](CNC[C@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075585	DF	On-Demand	Bother	ADRB2	41	49
C[C@@H](CNC[C@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075585	DF	On-Demand	Bother	ADRB1	43	49
C[C@@H](CNC[C@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075585	DF	On-Demand	Bother	ADRB3	28	49
C[C@@H](CNC[C@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075585	DF	On-Demand	Bother	PDS	17	45
C[C@H](CNC[C@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075586	DF	On-Demand	Bother	ADRB2	41	49
C[C@H](CNC[C@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075586	DF	On-Demand	Bother	ADRB1	43	49
C[C@H](CNC[C@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075586	DF	On-Demand	Bother	ADRB3	28	49
C[C@H](CNC[C@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075586	DF	On-Demand	Bother	PDS	17	45
C[C@H](CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075587	DF	On-Demand	Bother	ADRB2	41	49
C[C@H](CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075587	DF	On-Demand	Bother	ADRB1	43	49
C[C@H](CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075587	DF	On-Demand	Bother	ADRB3	28	49
C[C@H](CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1)C(C)(C)C	ZINC000819075587	DF	On-Demand	Bother	PDS	17	45
COc1ncccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075599	FE	On-Demand	Mild	PAPA1_CARPA	56	52
COc1ncccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075599	FE	On-Demand	Mild	CTSK	17	47
COc1ncccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075599	FE	On-Demand	Mild	CTSL	24	52
COc1ncccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075599	FE	On-Demand	Mild	CTSS	22	53
COc1ncccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075599	FE	On-Demand	Mild	SCN10A	25	42
COc1ncccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075599	FE	On-Demand	Mild	FPR1	44	38
COc1ncccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075600	FE	On-Demand	Mild	PAPA1_CARPA	56	52
COc1ncccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075600	FE	On-Demand	Mild	CTSK	17	47
COc1ncccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075600	FE	On-Demand	Mild	CTSL	24	52
COc1ncccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075600	FE	On-Demand	Mild	CTSS	22	53
COc1ncccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075600	FE	On-Demand	Mild	SCN10A	25	42
COc1ncccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819075600	FE	On-Demand	Mild	FPR1	44	38
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075619	DF	On-Demand	Anodyne	ADRB2	56	50
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075619	DF	On-Demand	Anodyne	ADRB1	80	48
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075619	DF	On-Demand	Anodyne	ADRB3	47	44
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075619	DF	On-Demand	Anodyne	ABCB1	18	59
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075620	DF	On-Demand	Anodyne	ADRB2	56	50
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075620	DF	On-Demand	Anodyne	ADRB1	80	48
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075620	DF	On-Demand	Anodyne	ADRB3	47	44
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075620	DF	On-Demand	Anodyne	ABCB1	18	59
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075621	DF	On-Demand	Anodyne	ADRB2	56	50
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075621	DF	On-Demand	Anodyne	ADRB1	80	48
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075621	DF	On-Demand	Anodyne	ADRB3	47	44
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075621	DF	On-Demand	Anodyne	ABCB1	18	59
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075622	DF	On-Demand	Anodyne	ADRB2	56	50
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075622	DF	On-Demand	Anodyne	ADRB1	80	48
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075622	DF	On-Demand	Anodyne	ADRB3	47	44
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075622	DF	On-Demand	Anodyne	ABCB1	18	59
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(OCc2cccc(F)c2)cc1	ZINC000819075643	FH	On-Demand	Anodyne	MAOB	22	47
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(OCc2cccc(F)c2)cc1	ZINC000819075644	FH	On-Demand	Anodyne	MAOB	22	47
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(OCc2cccc(F)c2)cc1	ZINC000819075645	FH	On-Demand	Anodyne	MAOB	22	47
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(OCc2cccc(F)c2)cc1	ZINC000819075646	FH	On-Demand	Anodyne	MAOB	22	47
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075651	DF	On-Demand	Anodyne	ADRB2	61	67
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075651	DF	On-Demand	Anodyne	ADRB1	94	67
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075651	DF	On-Demand	Anodyne	GRIN1	24	41
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075651	DF	On-Demand	Anodyne	ADRB3	58	60
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075652	DF	On-Demand	Anodyne	ADRB2	61	67
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075652	DF	On-Demand	Anodyne	ADRB1	94	67
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075652	DF	On-Demand	Anodyne	GRIN1	24	41
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075652	DF	On-Demand	Anodyne	ADRB3	58	60
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075653	DF	On-Demand	Anodyne	ADRB2	61	67
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075653	DF	On-Demand	Anodyne	ADRB1	94	67
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075653	DF	On-Demand	Anodyne	GRIN1	24	41
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075653	DF	On-Demand	Anodyne	ADRB3	58	60
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075654	DF	On-Demand	Anodyne	ADRB2	61	67
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075654	DF	On-Demand	Anodyne	ADRB1	94	67
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075654	DF	On-Demand	Anodyne	GRIN1	24	41
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075654	DF	On-Demand	Anodyne	ADRB3	58	60
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H](C)C(C)(C)C)c1	ZINC000819075667	DF	On-Demand	Anodyne	ADRB2	50	50
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H](C)C(C)(C)C)c1	ZINC000819075667	DF	On-Demand	Anodyne	ADRB1	71	45
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H](C)C(C)(C)C)c1	ZINC000819075667	DF	On-Demand	Anodyne	ADRB3	38	40
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H](C)C(C)(C)C)c1	ZINC000819075667	DF	On-Demand	Anodyne	ABCB1	25	48
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H](C)C(C)(C)C)c1	ZINC000819075667	DF	On-Demand	Anodyne	PDS	62	33
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H](C)C(C)(C)C)c1	ZINC000819075668	DF	On-Demand	Anodyne	ADRB2	50	50
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H](C)C(C)(C)C)c1	ZINC000819075668	DF	On-Demand	Anodyne	ADRB1	71	45
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H](C)C(C)(C)C)c1	ZINC000819075668	DF	On-Demand	Anodyne	ADRB3	38	40
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H](C)C(C)(C)C)c1	ZINC000819075668	DF	On-Demand	Anodyne	ABCB1	25	48
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H](C)C(C)(C)C)c1	ZINC000819075668	DF	On-Demand	Anodyne	PDS	62	33
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](C)C(C)(C)C)c1	ZINC000819075669	DF	On-Demand	Anodyne	ADRB2	50	50
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](C)C(C)(C)C)c1	ZINC000819075669	DF	On-Demand	Anodyne	ADRB1	71	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](C)C(C)(C)C)c1	ZINC000819075669	DF	On-Demand	Anodyne	ADRB3	38	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](C)C(C)(C)C)c1	ZINC000819075669	DF	On-Demand	Anodyne	ABCB1	25	48
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](C)C(C)(C)C)c1	ZINC000819075669	DF	On-Demand	Anodyne	PDS	62	33
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](C)C(C)(C)C)c1	ZINC000819075670	DF	On-Demand	Anodyne	ADRB2	50	50
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](C)C(C)(C)C)c1	ZINC000819075670	DF	On-Demand	Anodyne	ADRB1	71	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](C)C(C)(C)C)c1	ZINC000819075670	DF	On-Demand	Anodyne	ADRB3	38	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](C)C(C)(C)C)c1	ZINC000819075670	DF	On-Demand	Anodyne	ABCB1	25	48
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](C)C(C)(C)C)c1	ZINC000819075670	DF	On-Demand	Anodyne	PDS	62	33
CN(C)S(=O)(=O)c1cc(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)ccc1Cl	ZINC000819075725	ID	On-Demand	Anodyne	L3MBTL3	42	36
CN(C)S(=O)(=O)c1cc(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)ccc1Cl	ZINC000819075727	ID	On-Demand	Anodyne	L3MBTL3	42	36
COC(=O)c1ccc(OC[C@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075728	DE	On-Demand	Anodyne	ADRB2	59	52
COC(=O)c1ccc(OC[C@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075728	DE	On-Demand	Anodyne	ADRB1	84	49
COC(=O)c1ccc(OC[C@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075728	DE	On-Demand	Anodyne	ADRB3	53	49
COC(=O)c1ccc(OC[C@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075728	DE	On-Demand	Anodyne	ABCB1	16	47
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075730	DE	On-Demand	Anodyne	ADRB2	59	52
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075730	DE	On-Demand	Anodyne	ADRB1	84	49
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075730	DE	On-Demand	Anodyne	ADRB3	53	49
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075730	DE	On-Demand	Anodyne	ABCB1	16	47
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075731	DE	On-Demand	Anodyne	ADRB2	59	52
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075731	DE	On-Demand	Anodyne	ADRB1	84	49
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075731	DE	On-Demand	Anodyne	ADRB3	53	49
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H](C)C(C)(C)C)cc1	ZINC000819075731	DE	On-Demand	Anodyne	ABCB1	16	47
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075733	DE	On-Demand	Anodyne	ADRB2	59	52
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075733	DE	On-Demand	Anodyne	ADRB1	84	49
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075733	DE	On-Demand	Anodyne	ADRB3	53	49
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H](C)C(C)(C)C)cc1	ZINC000819075733	DE	On-Demand	Anodyne	ABCB1	16	47
O=C(NCc1cccnc1N1CCOCC1)C(F)=C1CCC1	ZINC000819075738	DD	On-Demand	Anodyne	SCN10A	22	49
COc1ccc(OC)c([C@H](O)CNCC(C)(C)Oc2ccccc2)c1	ZINC000819075763	EG	On-Demand	Anodyne	ADRB2	25	49
COc1ccc(OC)c([C@H](O)CNCC(C)(C)Oc2ccccc2)c1	ZINC000819075763	EG	On-Demand	Anodyne	ADRB3	23	42
O=C(NCCN1CCc2ccccc2C1)C(F)=C1CCC1	ZINC000819075768	CF	On-Demand	Anodyne	NOD2	42	35
O=C(/C=C/[C@H]1CCCO1)N1CCCN(C(=O)c2cccc(F)c2)CC1	ZINC000819075771	EE	On-Demand	Anodyne	HRH3	26	41
O=C(/C=C/[C@H]1CCCO1)N1CCCN(C(=O)c2cccc(F)c2)CC1	ZINC000819075771	EE	On-Demand	Anodyne	L3MBTL3	41	41
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(C(=O)c2cccc(F)c2)CC1	ZINC000819075772	EE	On-Demand	Anodyne	HRH3	26	41
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(C(=O)c2cccc(F)c2)CC1	ZINC000819075772	EE	On-Demand	Anodyne	L3MBTL3	41	41
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(C(=O)c2cccc(F)c2)CC1	ZINC000819075774	EE	On-Demand	Anodyne	HRH3	26	41
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(C(=O)c2cccc(F)c2)CC1	ZINC000819075774	EE	On-Demand	Anodyne	L3MBTL3	41	41
O=C(/C=C\[C@H]1CCCO1)N1CCCN(C(=O)c2cccc(F)c2)CC1	ZINC000819075776	EE	On-Demand	Anodyne	HRH3	26	41
O=C(/C=C\[C@H]1CCCO1)N1CCCN(C(=O)c2cccc(F)c2)CC1	ZINC000819075776	EE	On-Demand	Anodyne	L3MBTL3	41	41
COC(=O)Nc1ccc(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)cc1	ZINC000819075822	FE	On-Demand	Anodyne	EPHX2	27	42
COC(=O)Nc1ccc(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)cc1	ZINC000819075822	FE	On-Demand	Anodyne	L3MBTL3	74	42
COC(=O)Nc1ccc(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)cc1	ZINC000819075824	FE	On-Demand	Anodyne	EPHX2	27	42
COC(=O)Nc1ccc(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)cc1	ZINC000819075824	FE	On-Demand	Anodyne	L3MBTL3	74	42
CCOC(=O)Nc1ccc(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)cc1	ZINC000819075834	FF	On-Demand	Anodyne	L3MBTL3	64	39
CCOC(=O)Nc1ccc(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)cc1	ZINC000819075836	FF	On-Demand	Anodyne	L3MBTL3	64	39
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075838	GF	On-Demand	Anodyne	PREP	44	61
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075838	GF	On-Demand	Anodyne	SFRP1	46	44
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075838	GF	On-Demand	Anodyne	WNT3	58	44
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075840	GF	On-Demand	Anodyne	PREP	44	61
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075840	GF	On-Demand	Anodyne	SFRP1	46	44
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075840	GF	On-Demand	Anodyne	WNT3	58	44
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819075887	IH	On-Demand	Anodyne	PAPA1_CARPA	23	41
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819075887	IH	On-Demand	Anodyne	CCR1	33	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	CELA1	24	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	ELANE	38	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	CTRA_BOVIN	64	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	CASP3	15	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	BMP1	22	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	KLK3	68	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	CTSB	58	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	PAPA1_CARPA	71	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	CYSP_TRYCR	46	37
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	CTSG	43	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	CTSK	47	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	CTSL	47	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	CCR1	30	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	CAPNS1	60	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	CELA2A	52	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	CTSS	19	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	CAPN1	73	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	CASP1	26	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	CAPN2	121	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	NPR	54	37
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	GAG-PRO	50	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	PSMB5	46	39
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075892	IG	On-Demand	Anodyne	F2RL1	16	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	CELA1	24	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	ELANE	38	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	CTRA_BOVIN	64	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	CASP3	15	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	BMP1	22	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	KLK3	68	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	CTSB	58	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	PAPA1_CARPA	71	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	CYSP_TRYCR	46	37
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	CTSG	43	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	CTSK	47	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	CTSL	47	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	CCR1	30	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	CAPNS1	60	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	CELA2A	52	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	CTSS	19	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	CAPN1	73	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	CASP1	26	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	CAPN2	121	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	NPR	54	37
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	GAG-PRO	50	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	PSMB5	46	39
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075893	IG	On-Demand	Anodyne	F2RL1	16	41
CC(C)(C)OC(=O)N1CC(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819075906	FD	On-Demand	Anodyne	GPR119	21	42
CC(C)(C)OC(=O)N1CC(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)C1	ZINC000819075907	FD	On-Demand	Anodyne	GPR119	21	42
CC(=O)c1ccccc1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819075920	EE	On-Demand	Anodyne	L3MBTL3	46	44
CC(=O)c1ccccc1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819075921	EE	On-Demand	Anodyne	L3MBTL3	46	44
Cc1cccc(C(=O)Nc2ccccc2C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)c1	ZINC000819075926	HH	On-Demand	Anodyne	AVPR2	21	41
Cc1cccc(C(=O)Nc2ccccc2C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)c1	ZINC000819075926	HH	On-Demand	Anodyne	CCR8	57	40
Cc1cccc(C(=O)Nc2ccccc2C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)c1	ZINC000819075926	HH	On-Demand	Anodyne	KCNK3	71	41
Cc1cccc(C(=O)Nc2ccccc2C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)c1	ZINC000819075926	HH	On-Demand	Anodyne	KCNK9	49	41
Cc1cccc(C(=O)Nc2ccccc2C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)c1	ZINC000819075927	HH	On-Demand	Anodyne	AVPR2	21	41
Cc1cccc(C(=O)Nc2ccccc2C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)c1	ZINC000819075927	HH	On-Demand	Anodyne	CCR8	57	40
Cc1cccc(C(=O)Nc2ccccc2C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)c1	ZINC000819075927	HH	On-Demand	Anodyne	KCNK3	71	41
Cc1cccc(C(=O)Nc2ccccc2C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)c1	ZINC000819075927	HH	On-Demand	Anodyne	KCNK9	49	41
CN(CCC(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)C(=O)OCc1ccccc1	ZINC000819075957	HE	On-Demand	Anodyne	SLC12A5	40	34
CN(CCC(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)C(=O)OCc1ccccc1	ZINC000819075958	HE	On-Demand	Anodyne	SLC12A5	40	34
C[C@H](CNCCC(=O)Nc1ccccc1[N+](=O)[O-])C(C)(C)C	ZINC000819075996	DG	On-Demand	Bother	COLA	106	37
C[C@@H](CNCCC(=O)Nc1ccccc1[N+](=O)[O-])C(C)(C)C	ZINC000819075997	DG	On-Demand	Bother	COLA	106	37
C[C@@H](CNC[C@H](O)COc1cccc2[nH]ccc12)C(C)(C)C	ZINC000819076020	DG	On-Demand	Anodyne	ADRB2	33	71
C[C@@H](CNC[C@H](O)COc1cccc2[nH]ccc12)C(C)(C)C	ZINC000819076020	DG	On-Demand	Anodyne	ADRB1	43	71
C[C@@H](CNC[C@H](O)COc1cccc2[nH]ccc12)C(C)(C)C	ZINC000819076020	DG	On-Demand	Anodyne	ADRB3	16	71
C[C@@H](CNC[C@H](O)COc1cccc2[nH]ccc12)C(C)(C)C	ZINC000819076020	DG	On-Demand	Anodyne	CYP2D6	22	49
C[C@H](CNC[C@H](O)COc1cccc2[nH]ccc12)C(C)(C)C	ZINC000819076021	DG	On-Demand	Anodyne	ADRB2	33	71
C[C@H](CNC[C@H](O)COc1cccc2[nH]ccc12)C(C)(C)C	ZINC000819076021	DG	On-Demand	Anodyne	ADRB1	43	71
C[C@H](CNC[C@H](O)COc1cccc2[nH]ccc12)C(C)(C)C	ZINC000819076021	DG	On-Demand	Anodyne	ADRB3	16	71
C[C@H](CNC[C@H](O)COc1cccc2[nH]ccc12)C(C)(C)C	ZINC000819076021	DG	On-Demand	Anodyne	CYP2D6	22	49
C[C@@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)C(C)(C)C	ZINC000819076022	DG	On-Demand	Anodyne	ADRB2	33	71
C[C@@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)C(C)(C)C	ZINC000819076022	DG	On-Demand	Anodyne	ADRB1	43	71
C[C@@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)C(C)(C)C	ZINC000819076022	DG	On-Demand	Anodyne	ADRB3	16	71
C[C@@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)C(C)(C)C	ZINC000819076022	DG	On-Demand	Anodyne	CYP2D6	22	49
C[C@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)C(C)(C)C	ZINC000819076023	DG	On-Demand	Anodyne	ADRB2	33	71
C[C@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)C(C)(C)C	ZINC000819076023	DG	On-Demand	Anodyne	ADRB1	43	71
C[C@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)C(C)(C)C	ZINC000819076023	DG	On-Demand	Anodyne	ADRB3	16	71
C[C@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)C(C)(C)C	ZINC000819076023	DG	On-Demand	Anodyne	CYP2D6	22	49
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1OC1CCCC1	ZINC000819076041	EH	On-Demand	Anodyne	PDE4A	41	44
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1OC1CCCC1	ZINC000819076041	EH	On-Demand	Anodyne	PDE4B	20	44
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1OC1CCCC1	ZINC000819076041	EH	On-Demand	Anodyne	PDE4D	25	45
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1OC1CCCC1	ZINC000819076041	EH	On-Demand	Anodyne	PDE4C	17	44
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1OC1CCCC1	ZINC000819076042	EH	On-Demand	Anodyne	PDE4A	41	44
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1OC1CCCC1	ZINC000819076042	EH	On-Demand	Anodyne	PDE4B	20	44
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1OC1CCCC1	ZINC000819076042	EH	On-Demand	Anodyne	PDE4D	25	45
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1OC1CCCC1	ZINC000819076042	EH	On-Demand	Anodyne	PDE4C	17	44
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1OC1CCCC1	ZINC000819076043	EH	On-Demand	Anodyne	PDE4A	41	44
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1OC1CCCC1	ZINC000819076043	EH	On-Demand	Anodyne	PDE4B	20	44
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1OC1CCCC1	ZINC000819076043	EH	On-Demand	Anodyne	PDE4D	25	45
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1OC1CCCC1	ZINC000819076043	EH	On-Demand	Anodyne	PDE4C	17	44
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1OC1CCCC1	ZINC000819076044	EH	On-Demand	Anodyne	PDE4A	41	44
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1OC1CCCC1	ZINC000819076044	EH	On-Demand	Anodyne	PDE4B	20	44
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1OC1CCCC1	ZINC000819076044	EH	On-Demand	Anodyne	PDE4D	25	45
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1OC1CCCC1	ZINC000819076044	EH	On-Demand	Anodyne	PDE4C	17	44
Cc1cc2c(cc1NCC(=O)NCc1ccc(S(C)(=O)=O)cc1)OCO2	ZINC000819076049	GD	On-Demand	Anodyne	BMP1	52	39
C[C@H](CNC[C@@H](O)COc1ccc(CC#N)cc1)C(C)(C)C	ZINC000819076060	DF	On-Demand	Mild	ADRB2	50	48
C[C@H](CNC[C@@H](O)COc1ccc(CC#N)cc1)C(C)(C)C	ZINC000819076060	DF	On-Demand	Mild	ADRB1	68	46
C[C@H](CNC[C@@H](O)COc1ccc(CC#N)cc1)C(C)(C)C	ZINC000819076060	DF	On-Demand	Mild	ADRB3	43	45
C[C@@H](CNC[C@@H](O)COc1ccc(CC#N)cc1)C(C)(C)C	ZINC000819076061	DF	On-Demand	Mild	ADRB2	50	48
C[C@@H](CNC[C@@H](O)COc1ccc(CC#N)cc1)C(C)(C)C	ZINC000819076061	DF	On-Demand	Mild	ADRB1	68	46
C[C@@H](CNC[C@@H](O)COc1ccc(CC#N)cc1)C(C)(C)C	ZINC000819076061	DF	On-Demand	Mild	ADRB3	43	45
C[C@@H](CNC[C@H](O)COc1ccc(CC#N)cc1)C(C)(C)C	ZINC000819076062	DF	On-Demand	Mild	ADRB2	50	48
C[C@@H](CNC[C@H](O)COc1ccc(CC#N)cc1)C(C)(C)C	ZINC000819076062	DF	On-Demand	Mild	ADRB1	68	46
C[C@@H](CNC[C@H](O)COc1ccc(CC#N)cc1)C(C)(C)C	ZINC000819076062	DF	On-Demand	Mild	ADRB3	43	45
C[C@H](CNC[C@H](O)COc1ccc(CC#N)cc1)C(C)(C)C	ZINC000819076063	DF	On-Demand	Mild	ADRB2	50	48
C[C@H](CNC[C@H](O)COc1ccc(CC#N)cc1)C(C)(C)C	ZINC000819076063	DF	On-Demand	Mild	ADRB1	68	46
C[C@H](CNC[C@H](O)COc1ccc(CC#N)cc1)C(C)(C)C	ZINC000819076063	DF	On-Demand	Mild	ADRB3	43	45
O=C(c1ccc(NCC[C@@H]2CC2(Cl)Cl)cc1F)N1CCOCC1	ZINC000819076073	FG	On-Demand	Anodyne	EPHX2	15	57
O=C(c1ccc(NCC[C@H]2CC2(Cl)Cl)cc1F)N1CCOCC1	ZINC000819076074	FG	On-Demand	Anodyne	EPHX2	15	57
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819076092	IG	On-Demand	Anodyne	GPR119	28	43
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819076093	IG	On-Demand	Anodyne	GPR119	28	43
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)N3CCC([C@@H]4NC(=O)C4(C)C)CC3)cc2C1	ZINC000819076100	IG	On-Demand	Anodyne	GPR119	24	42
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)N3CCC([C@@H]4NC(=O)C4(C)C)CC3)cc2C1	ZINC000819076100	IG	On-Demand	Anodyne	L3MBTL3	48	36
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)N3CCC([C@H]4NC(=O)C4(C)C)CC3)cc2C1	ZINC000819076101	IG	On-Demand	Anodyne	GPR119	24	42
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)N3CCC([C@H]4NC(=O)C4(C)C)CC3)cc2C1	ZINC000819076101	IG	On-Demand	Anodyne	L3MBTL3	48	36
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)c1	ZINC000819076118	HD	On-Demand	Anodyne	PARP1	41	36
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)c1	ZINC000819076119	HD	On-Demand	Anodyne	PARP1	41	36
C=CCCn1cc(C(=O)Nc2ccc(OC)c(OC3CCCC3)c2)nn1	ZINC000819076207	FG	On-Demand	Mild	PDE4A	49	44
C=CCCn1cc(C(=O)Nc2ccc(OC)c(OC3CCCC3)c2)nn1	ZINC000819076207	FG	On-Demand	Mild	PDE4B	25	44
C=CCCn1cc(C(=O)Nc2ccc(OC)c(OC3CCCC3)c2)nn1	ZINC000819076207	FG	On-Demand	Mild	PDE4D	31	44
C=CCCn1cc(C(=O)Nc2ccc(OC)c(OC3CCCC3)c2)nn1	ZINC000819076207	FG	On-Demand	Mild	PDE4C	17	44
C=CCCn1cc(C(=O)Nc2ccc(OC)c(OC3CCCC3)c2)nn1	ZINC000819076207	FG	On-Demand	Mild	ENPP1	70	34
C[C@H](CNCCC(=O)Nc1cccnc1)C(C)(C)C	ZINC000819076239	CF	On-Demand	Anodyne	ADRB3	31	40
C[C@H](CNCCC(=O)Nc1cccnc1)C(C)(C)C	ZINC000819076239	CF	On-Demand	Anodyne	NAMPT	19	44
C[C@@H](CNCCC(=O)Nc1cccnc1)C(C)(C)C	ZINC000819076240	CF	On-Demand	Anodyne	ADRB3	31	40
C[C@@H](CNCCC(=O)Nc1cccnc1)C(C)(C)C	ZINC000819076240	CF	On-Demand	Anodyne	NAMPT	19	44
CC(C)c1ccc2cc(C(=O)N3CCC([C@@H]4NC(=O)C4(C)C)CC3)[nH]c2c1	ZINC000819076351	FH	On-Demand	Anodyne	GRIN2B	26	45
CC(C)c1ccc2cc(C(=O)N3CCC([C@@H]4NC(=O)C4(C)C)CC3)[nH]c2c1	ZINC000819076351	FH	On-Demand	Anodyne	HRH4	29	43
CC(C)c1ccc2cc(C(=O)N3CCC([C@@H]4NC(=O)C4(C)C)CC3)[nH]c2c1	ZINC000819076351	FH	On-Demand	Anodyne	AKR1C3	18	41
CC(C)c1ccc2cc(C(=O)N3CCC([C@H]4NC(=O)C4(C)C)CC3)[nH]c2c1	ZINC000819076352	FH	On-Demand	Anodyne	GRIN2B	26	45
CC(C)c1ccc2cc(C(=O)N3CCC([C@H]4NC(=O)C4(C)C)CC3)[nH]c2c1	ZINC000819076352	FH	On-Demand	Anodyne	HRH4	29	43
CC(C)c1ccc2cc(C(=O)N3CCC([C@H]4NC(=O)C4(C)C)CC3)[nH]c2c1	ZINC000819076352	FH	On-Demand	Anodyne	AKR1C3	18	41
CC(C)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819076374	FI	On-Demand	Mild	PAPA1_CARPA	58	53
CC(C)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819076374	FI	On-Demand	Mild	CTSK	31	51
CC(C)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819076374	FI	On-Demand	Mild	CTSL	26	53
CC(C)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819076374	FI	On-Demand	Mild	REN	33	44
CC(C)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819076374	FI	On-Demand	Mild	FURIN	52	35
CC(C)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819076374	FI	On-Demand	Mild	CTSS	24	55
CC(C)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819076374	FI	On-Demand	Mild	FPR1	49	41
CC(C)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819076375	FI	On-Demand	Mild	PAPA1_CARPA	58	53
CC(C)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819076375	FI	On-Demand	Mild	CTSK	31	51
CC(C)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819076375	FI	On-Demand	Mild	CTSL	26	53
CC(C)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819076375	FI	On-Demand	Mild	REN	33	44
CC(C)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819076375	FI	On-Demand	Mild	FURIN	52	35
CC(C)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819076375	FI	On-Demand	Mild	CTSS	24	55
CC(C)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819076375	FI	On-Demand	Mild	FPR1	49	41
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)C(F)(F)C1	ZINC000819076392	IF	On-Demand	Anodyne	GPR119	24	42
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)C(F)(F)C1	ZINC000819076393	IF	On-Demand	Anodyne	GPR119	24	42
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)C(F)(F)C1	ZINC000819076394	IF	On-Demand	Anodyne	GPR119	24	42
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)C(F)(F)C1	ZINC000819076395	IF	On-Demand	Anodyne	GPR119	24	42
C#CCNC(=O)CCNCCCCSc1ccccc1Br	ZINC000819076396	FG	On-Demand	Mild	GRIA1	45	35
CC(C)(C)OC(=O)N1CCC(SCC(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819076404	IF	On-Demand	Anodyne	GPR119	27	42
CC(C)(C)OC(=O)N1CCC(SCC(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819076409	IF	On-Demand	Anodyne	GPR119	27	42
O=C(NCc1ccc(F)cc1F)C(F)=C1CCC1	ZINC000819076441	CF	On-Demand	Anodyne	P2RX7	38	45
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1ccc(Cl)cc1	ZINC000819076442	FD	On-Demand	Anodyne	ADRB3	17	42
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1ccc(Cl)cc1	ZINC000819076443	FD	On-Demand	Anodyne	ADRB3	17	42
O=C(NCc1ccccc1Br)C(F)=C1CCC1	ZINC000819076447	CG	On-Demand	Anodyne	CA9	17	41
Cc1ccccc1[C@@H](O)CNC[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000819076464	EG	On-Demand	Anodyne	PAPA1_CARPA	31	40
Cc1ccccc1[C@@H](O)CNC[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000819076464	EG	On-Demand	Anodyne	CTSK	15	42
Cc1ccccc1[C@@H](O)CNC[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000819076464	EG	On-Demand	Anodyne	FPR1	47	40
Cc1ccccc1[C@@H](O)CNC[C@@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000819076465	EG	On-Demand	Anodyne	PAPA1_CARPA	31	40
Cc1ccccc1[C@@H](O)CNC[C@@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000819076465	EG	On-Demand	Anodyne	CTSK	15	42
Cc1ccccc1[C@@H](O)CNC[C@@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000819076465	EG	On-Demand	Anodyne	FPR1	47	40
C=CCC1(C(=O)Nc2ccc(OC)c(OC3CCCC3)c2)CCOCC1	ZINC000819076516	FI	On-Demand	Mild	PDE4A	48	46
C=CCC1(C(=O)Nc2ccc(OC)c(OC3CCCC3)c2)CCOCC1	ZINC000819076516	FI	On-Demand	Mild	PDE4B	28	46
C=CCC1(C(=O)Nc2ccc(OC)c(OC3CCCC3)c2)CCOCC1	ZINC000819076516	FI	On-Demand	Mild	PDE4D	36	46
C=CCC1(C(=O)Nc2ccc(OC)c(OC3CCCC3)c2)CCOCC1	ZINC000819076516	FI	On-Demand	Mild	PDE4C	19	46
C=CCC1(C(=O)Nc2ccc(OC)c(OC3CCCC3)c2)CCOCC1	ZINC000819076516	FI	On-Demand	Mild	ENPP1	55	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccnc1N1CCOCC1)C2	ZINC000819076518	GD	On-Demand	Anodyne	SCN10A	19	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccnc1N1CCOCC1)C2	ZINC000819076519	GD	On-Demand	Anodyne	SCN10A	19	44
C[C@H]1c2cccn2CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819076531	FF	On-Demand	Mild	PAPA1_CARPA	35	40
C[C@H]1c2cccn2CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819076533	FF	On-Demand	Mild	PAPA1_CARPA	35	40
COc1ccc(NC(=O)c2cc3c(cn2)OCCO3)cc1OC1CCCC1	ZINC000819076612	FG	On-Demand	Anodyne	PDE4A	47	52
COc1ccc(NC(=O)c2cc3c(cn2)OCCO3)cc1OC1CCCC1	ZINC000819076612	FG	On-Demand	Anodyne	PDE4B	24	52
COc1ccc(NC(=O)c2cc3c(cn2)OCCO3)cc1OC1CCCC1	ZINC000819076612	FG	On-Demand	Anodyne	PDE4D	32	52
COc1ccc(NC(=O)c2cc3c(cn2)OCCO3)cc1OC1CCCC1	ZINC000819076612	FG	On-Demand	Anodyne	GRM4	25	40
COc1ccc(NC(=O)c2cc3c(cn2)OCCO3)cc1OC1CCCC1	ZINC000819076612	FG	On-Demand	Anodyne	PDE4C	18	52
COc1ccc(NC(=O)c2cc3c(cn2)OCCO3)cc1OC1CCCC1	ZINC000819076612	FG	On-Demand	Anodyne	ENPP1	70	36
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819076645	IG	On-Demand	Bother	SLC6A9	16	45
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819076646	IG	On-Demand	Bother	SLC6A9	16	45
CCC(=O)c1cc(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)ccc1F	ZINC000819076657	FF	On-Demand	Anodyne	L3MBTL3	70	36
CCC(=O)c1cc(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)ccc1F	ZINC000819076658	FF	On-Demand	Anodyne	L3MBTL3	70	36
CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819076662	IG	On-Demand	Anodyne	GPR119	19	40
CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819076663	IG	On-Demand	Anodyne	GPR119	19	40
CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819076664	IG	On-Demand	Anodyne	GPR119	19	40
CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819076665	IG	On-Demand	Anodyne	GPR119	19	40
O=C1OCCN1CCCNc1cc(Cl)ccc1OC(F)F	ZINC000819076707	DG	On-Demand	Anodyne	HRP1_PLAFA	88	43
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(Cl)c1Cl	ZINC000819076712	DG	On-Demand	Anodyne	P2RX7	29	44
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(Cl)c1Cl	ZINC000819076713	DG	On-Demand	Anodyne	P2RX7	29	44
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(Cl)c1Cl	ZINC000819076714	DG	On-Demand	Anodyne	P2RX7	29	44
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(Cl)c1Cl	ZINC000819076715	DG	On-Demand	Anodyne	P2RX7	29	44
CC[C@@H](O)CNC[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000819076745	CD	On-Demand	Anodyne	CTSD	16	40
CC[C@@H](O)CNC[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000819076745	CD	On-Demand	Anodyne	CTSK	19	50
CC[C@@H](O)CNC[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000819076745	CD	On-Demand	Anodyne	ECE1	31	40
CC[C@@H](O)CNC[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000819076745	CD	On-Demand	Anodyne	PGA5	23	42
CC[C@@H](O)CNC[C@@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000819076746	CD	On-Demand	Anodyne	CTSD	16	40
CC[C@@H](O)CNC[C@@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000819076746	CD	On-Demand	Anodyne	CTSK	19	50
CC[C@@H](O)CNC[C@@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000819076746	CD	On-Demand	Anodyne	ECE1	31	40
CC[C@@H](O)CNC[C@@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000819076746	CD	On-Demand	Anodyne	PGA5	23	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819076749	FF	On-Demand	Clean	ADRB2	33	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819076749	FF	On-Demand	Clean	ADRB1	55	39
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819076749	FF	On-Demand	Clean	ABCB1	19	51
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819076750	FF	On-Demand	Clean	ADRB2	33	42
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819076750	FF	On-Demand	Clean	ADRB1	55	39
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819076750	FF	On-Demand	Clean	ABCB1	19	51
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819076751	FF	On-Demand	Clean	ADRB2	43	53
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819076751	FF	On-Demand	Clean	ADRB1	74	53
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819076751	FF	On-Demand	Clean	GRIN1	26	41
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819076751	FF	On-Demand	Clean	ADRB3	45	51
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819076752	FF	On-Demand	Clean	ADRB2	43	53
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819076752	FF	On-Demand	Clean	ADRB1	74	53
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819076752	FF	On-Demand	Clean	GRIN1	26	41
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819076752	FF	On-Demand	Clean	ADRB3	45	51
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCN(CCN3CCOCC3)C2)c1	ZINC000819076761	FC	On-Demand	Bother	CASR	43	36
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCN(CCN3CCOCC3)C2)c1	ZINC000819076762	FC	On-Demand	Bother	CASR	43	36
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCN(CCN3CCOCC3)C2)c1	ZINC000819076763	FC	On-Demand	Bother	CASR	43	36
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCN(CCN3CCOCC3)C2)c1	ZINC000819076764	FC	On-Demand	Bother	CASR	43	36
CC(C)(C)OC(=O)N1CCCc2cc(C(=O)N3CCC([C@@H]4NC(=O)C4(C)C)CC3)ccc21	ZINC000819076846	IH	On-Demand	Anodyne	GPR119	20	40
CC(C)(C)OC(=O)N1CCCc2cc(C(=O)N3CCC([C@@H]4NC(=O)C4(C)C)CC3)ccc21	ZINC000819076846	IH	On-Demand	Anodyne	L3MBTL3	51	34
CC(C)(C)OC(=O)N1CCCc2cc(C(=O)N3CCC([C@H]4NC(=O)C4(C)C)CC3)ccc21	ZINC000819076847	IH	On-Demand	Anodyne	GPR119	20	40
CC(C)(C)OC(=O)N1CCCc2cc(C(=O)N3CCC([C@H]4NC(=O)C4(C)C)CC3)ccc21	ZINC000819076847	IH	On-Demand	Anodyne	L3MBTL3	51	34
CC(C)(C)OC(=O)N1CCC(C(F)(F)C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819076852	IG	On-Demand	Anodyne	GPR119	25	41
CC(C)(C)OC(=O)N1CCC(C(F)(F)C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)CC1	ZINC000819076853	IG	On-Demand	Anodyne	GPR119	25	41
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819076911	GD	On-Demand	Anodyne	ITGAL	41	35
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819076911	GD	On-Demand	Anodyne	CASR	41	46
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819076911	GD	On-Demand	Anodyne	CCR2	38	42
O[C@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819076912	GD	On-Demand	Anodyne	ITGAL	41	35
O[C@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819076912	GD	On-Demand	Anodyne	CASR	41	46
O[C@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819076912	GD	On-Demand	Anodyne	CCR2	38	42
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819076913	GD	On-Demand	Anodyne	ITGAL	41	35
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819076913	GD	On-Demand	Anodyne	CASR	41	46
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819076913	GD	On-Demand	Anodyne	CCR2	38	42
O[C@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819076914	GD	On-Demand	Anodyne	ITGAL	41	35
O[C@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819076914	GD	On-Demand	Anodyne	CASR	41	46
O[C@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819076914	GD	On-Demand	Anodyne	CCR2	38	42
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819076942	GD	On-Demand	Anodyne	EPHX2	16	41
O[C@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819076943	GD	On-Demand	Anodyne	EPHX2	16	41
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819076944	GD	On-Demand	Anodyne	EPHX2	16	41
O[C@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819076945	GD	On-Demand	Anodyne	EPHX2	16	41
CCCCCCCCCCC(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819076952	FI	On-Demand	Mild	LASR	40	33
CCCCCCCCCCC(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819076953	FI	On-Demand	Mild	LASR	40	33
O[C@@H](CNCCCCSc1ccccc1Br)c1cccnc1	ZINC000819076958	GI	On-Demand	Anodyne	ADRB2	24	46
O[C@@H](CNCCCCSc1ccccc1Br)c1cccnc1	ZINC000819076958	GI	On-Demand	Anodyne	ADRB1	25	44
O[C@@H](CNCCCCSc1ccccc1Br)c1cccnc1	ZINC000819076958	GI	On-Demand	Anodyne	ADRB3	96	46
O[C@H](CNCCCCSc1ccccc1Br)c1cccnc1	ZINC000819076961	GI	On-Demand	Anodyne	ADRB2	24	46
O[C@H](CNCCCCSc1ccccc1Br)c1cccnc1	ZINC000819076961	GI	On-Demand	Anodyne	ADRB1	25	44
O[C@H](CNCCCCSc1ccccc1Br)c1cccnc1	ZINC000819076961	GI	On-Demand	Anodyne	ADRB3	96	46
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1ccccc1	ZINC000819077018	DC	On-Demand	Anodyne	SLC6A3	17	47
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1ccccc1	ZINC000819077018	DC	On-Demand	Anodyne	CASR	50	41
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1ccccc1	ZINC000819077018	DC	On-Demand	Anodyne	SIGMAR1	16	40
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1ccccc1	ZINC000819077018	DC	On-Demand	Anodyne	CCR5	19	40
C/C(=C/C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000819077086	FF	On-Demand	Bother	SLC27A4	50	32
C/C(=C/C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000819077088	FF	On-Demand	Bother	SLC27A4	50	32
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)ccc1F	ZINC000819077123	IE	On-Demand	Anodyne	SFRP1	42	37
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)ccc1F	ZINC000819077123	IE	On-Demand	Anodyne	L3MBTL3	45	35
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)ccc1F	ZINC000819077124	IE	On-Demand	Anodyne	SFRP1	42	37
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)ccc1F	ZINC000819077124	IE	On-Demand	Anodyne	L3MBTL3	45	35
O[C@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1ccccc1	ZINC000819077151	DC	On-Demand	Anodyne	SLC6A3	17	47
O[C@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1ccccc1	ZINC000819077151	DC	On-Demand	Anodyne	CASR	50	41
O[C@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1ccccc1	ZINC000819077151	DC	On-Demand	Anodyne	SIGMAR1	16	40
O[C@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1ccccc1	ZINC000819077151	DC	On-Demand	Anodyne	CCR5	19	40
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1ccccc1	ZINC000819077152	DC	On-Demand	Anodyne	SLC6A3	17	47
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1ccccc1	ZINC000819077152	DC	On-Demand	Anodyne	CASR	50	41
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1ccccc1	ZINC000819077152	DC	On-Demand	Anodyne	SIGMAR1	16	40
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1ccccc1	ZINC000819077152	DC	On-Demand	Anodyne	CCR5	19	40
O[C@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1ccccc1	ZINC000819077154	DC	On-Demand	Anodyne	SLC6A3	17	47
O[C@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1ccccc1	ZINC000819077154	DC	On-Demand	Anodyne	CASR	50	41
O[C@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1ccccc1	ZINC000819077154	DC	On-Demand	Anodyne	SIGMAR1	16	40
O[C@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1ccccc1	ZINC000819077154	DC	On-Demand	Anodyne	CCR5	19	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1c(F)cccc1Cl)C2	ZINC000819077178	FF	On-Demand	Anodyne	P2RX7	63	52
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1c(F)cccc1Cl)C2	ZINC000819077179	FF	On-Demand	Anodyne	P2RX7	63	52
C#CCNS(=O)(=O)c1cccc(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)c1	ZINC000819077198	HC	On-Demand	Mild	SFRP1	97	40
C#CCNS(=O)(=O)c1cccc(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)c1	ZINC000819077198	HC	On-Demand	Mild	WNT3	58	32
C#CCNS(=O)(=O)c1cccc(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)c1	ZINC000819077200	HC	On-Demand	Mild	SFRP1	97	40
C#CCNS(=O)(=O)c1cccc(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)c1	ZINC000819077200	HC	On-Demand	Mild	WNT3	58	32
O=C(c1ccc(CNc2cc(Cl)ccc2OC(F)F)cc1)N1CCCC1	ZINC000819077201	GJ	On-Demand	Anodyne	HRH3	25	40
O=C(c1ccc(CNc2cc(Cl)ccc2OC(F)F)cc1)N1CCCC1	ZINC000819077201	GJ	On-Demand	Anodyne	DPP7	46	40
O=C(c1ccc(CNc2cc(Cl)ccc2OC(F)F)cc1)N1CCCC1	ZINC000819077201	GJ	On-Demand	Anodyne	L3MBTL3	34	40
COc1cccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077218	GG	On-Demand	Mild	PAPA1_CARPA	48	46
COc1cccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077218	GG	On-Demand	Mild	CTSK	40	45
COc1cccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077218	GG	On-Demand	Mild	CTSL	28	46
COc1cccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077218	GG	On-Demand	Mild	CTSS	29	48
COc1cccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077218	GG	On-Demand	Mild	FPR1	46	41
COc1cccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077219	GG	On-Demand	Mild	PAPA1_CARPA	48	46
COc1cccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077219	GG	On-Demand	Mild	CTSK	40	45
COc1cccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077219	GG	On-Demand	Mild	CTSL	28	46
COc1cccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077219	GG	On-Demand	Mild	CTSS	29	48
COc1cccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077219	GG	On-Demand	Mild	FPR1	46	41
COc1cccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077221	GG	On-Demand	Mild	PAPA1_CARPA	48	46
COc1cccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077221	GG	On-Demand	Mild	CTSK	40	45
COc1cccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077221	GG	On-Demand	Mild	CTSL	28	46
COc1cccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077221	GG	On-Demand	Mild	CTSS	29	48
COc1cccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077221	GG	On-Demand	Mild	FPR1	46	41
COc1cccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077223	GG	On-Demand	Mild	PAPA1_CARPA	48	46
COc1cccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077223	GG	On-Demand	Mild	CTSK	40	45
COc1cccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077223	GG	On-Demand	Mild	CTSL	28	46
COc1cccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077223	GG	On-Demand	Mild	CTSS	29	48
COc1cccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819077223	GG	On-Demand	Mild	FPR1	46	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccc(F)cc1F	ZINC000819077253	EE	On-Demand	Anodyne	P2RX7	46	41
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(F)c1	ZINC000819077266	EC	On-Demand	Anodyne	CASR	44	37
O[C@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(F)c1	ZINC000819077267	EC	On-Demand	Anodyne	CASR	44	37
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(F)c1	ZINC000819077268	EC	On-Demand	Anodyne	CASR	44	37
O[C@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(F)c1	ZINC000819077269	EC	On-Demand	Anodyne	CASR	44	37
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819077328	ID	On-Demand	Anodyne	PREP	16	43
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819077329	ID	On-Demand	Anodyne	PREP	16	43
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819077330	ID	On-Demand	Anodyne	PREP	16	43
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819077331	ID	On-Demand	Anodyne	PREP	16	43
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc2ccccc12	ZINC000819077407	FD	On-Demand	Anodyne	ADCY5	17	40
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc2ccccc12	ZINC000819077407	FD	On-Demand	Anodyne	PTGDS	44	40
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc2ccccc12	ZINC000819077408	FD	On-Demand	Anodyne	ADCY5	17	40
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc2ccccc12	ZINC000819077408	FD	On-Demand	Anodyne	PTGDS	44	40
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1c(F)cccc1F	ZINC000819077419	CF	On-Demand	Anodyne	KCNQ2	48	36
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1c(F)cccc1F	ZINC000819077420	CF	On-Demand	Anodyne	KCNQ2	48	36
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1c(F)cccc1F	ZINC000819077421	CF	On-Demand	Anodyne	KCNQ2	48	36
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1c(F)cccc1F	ZINC000819077422	CF	On-Demand	Anodyne	KCNQ2	48	36
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1ccc(F)cc1	ZINC000819077476	EC	On-Demand	Anodyne	SLC6A3	31	46
O[C@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1ccc(F)cc1	ZINC000819077477	EC	On-Demand	Anodyne	SLC6A3	31	46
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1ccc(F)cc1	ZINC000819077478	EC	On-Demand	Anodyne	SLC6A3	31	46
O[C@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1ccc(F)cc1	ZINC000819077479	EC	On-Demand	Anodyne	SLC6A3	31	46
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000819077523	GD	On-Demand	Anodyne	GPR119	18	43
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000819077524	GD	On-Demand	Anodyne	GPR119	18	43
CC[C@H](C)c1ccc(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)cc1	ZINC000819077535	EH	On-Demand	Anodyne	L3MBTL3	65	40
CC[C@@H](C)c1ccc(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)cc1	ZINC000819077536	EH	On-Demand	Anodyne	L3MBTL3	65	40
CC[C@H](C)c1ccc(C(=O)N2CCC([C@@H]3NC(=O)C3(C)C)CC2)cc1	ZINC000819077537	EH	On-Demand	Anodyne	L3MBTL3	65	40
CC[C@@H](C)c1ccc(C(=O)N2CCC([C@H]3NC(=O)C3(C)C)CC2)cc1	ZINC000819077538	EH	On-Demand	Anodyne	L3MBTL3	65	40
CC[C@H](CN1CCCC1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819077568	FE	On-Demand	Anodyne	GPR119	24	40
CC[C@H](CN1CCCC1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819077569	FE	On-Demand	Anodyne	GPR119	24	40
CC[C@@H](CN1CCCC1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819077570	FE	On-Demand	Anodyne	GPR119	24	40
CC[C@@H](CN1CCCC1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819077571	FE	On-Demand	Anodyne	GPR119	24	40
CC(C)(C)OC(=O)N1CC(NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819077587	FD	On-Demand	Mild	GPR119	41	42
O=C(CNc1ccccc1C(F)F)Nc1ccccc1C(=O)NC1CCCC1	ZINC000819077588	GI	On-Demand	Anodyne	CNR2	22	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCCN(c3cccc(F)c3)C2)cc1	ZINC000819077623	GF	On-Demand	Anodyne	CCR5	15	42
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCCN(c3cccc(F)c3)C2)cc1	ZINC000819077624	GF	On-Demand	Anodyne	CCR5	15	42
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCCN(c3cccc(F)c3)C2)cc1	ZINC000819077625	GF	On-Demand	Anodyne	CCR5	15	42
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCCN(c3cccc(F)c3)C2)cc1	ZINC000819077626	GF	On-Demand	Anodyne	CCR5	15	42
CC(C)(C)OC(=O)N1CC(NCCC(=O)Nc2ccccc2F)C1	ZINC000819077627	EE	On-Demand	Anodyne	GPR119	25	42
COc1cccc([C@@H](C)NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819077642	EF	On-Demand	Anodyne	MTNR1A	15	40
COc1cccc([C@@H](C)NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819077642	EF	On-Demand	Anodyne	MTNR1B	18	40
COc1cccc([C@H](C)NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819077644	EF	On-Demand	Anodyne	MTNR1A	15	40
COc1cccc([C@H](C)NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819077644	EF	On-Demand	Anodyne	MTNR1B	18	40
CCOc1ccc(OC[C@@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819077651	FF	On-Demand	Clean	ADRB2	33	41
CCOc1ccc(OC[C@@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819077651	FF	On-Demand	Clean	ADRB1	46	41
CCOc1ccc(OC[C@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819077652	FF	On-Demand	Clean	ADRB2	33	41
CCOc1ccc(OC[C@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819077652	FF	On-Demand	Clean	ADRB1	46	41
Cc1ccc(OC[C@@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819077739	EF	On-Demand	Clean	ADRB2	34	49
Cc1ccc(OC[C@@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819077739	EF	On-Demand	Clean	ADRB1	47	39
Cc1ccc(OC[C@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819077740	EF	On-Demand	Clean	ADRB2	34	49
Cc1ccc(OC[C@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819077740	EF	On-Demand	Clean	ADRB1	47	39
Cc1ccccc1[C@@H](C)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819077749	FI	On-Demand	Mild	PAPA1_CARPA	53	44
Cc1ccccc1[C@@H](C)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819077749	FI	On-Demand	Mild	CTSK	22	41
Cc1ccccc1[C@@H](C)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819077749	FI	On-Demand	Mild	FPR1	44	37
Cc1ccccc1[C@H](C)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819077750	FI	On-Demand	Mild	PAPA1_CARPA	53	44
Cc1ccccc1[C@H](C)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819077750	FI	On-Demand	Mild	CTSK	22	41
Cc1ccccc1[C@H](C)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819077750	FI	On-Demand	Mild	FPR1	44	37
Cc1ccccc1[C@@H](C)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819077751	FI	On-Demand	Mild	PAPA1_CARPA	53	44
Cc1ccccc1[C@@H](C)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819077751	FI	On-Demand	Mild	CTSK	22	41
Cc1ccccc1[C@@H](C)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819077751	FI	On-Demand	Mild	FPR1	44	37
Cc1ccccc1[C@H](C)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819077752	FI	On-Demand	Mild	PAPA1_CARPA	53	44
Cc1ccccc1[C@H](C)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819077752	FI	On-Demand	Mild	CTSK	22	41
Cc1ccccc1[C@H](C)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819077752	FI	On-Demand	Mild	FPR1	44	37
COC(=O)c1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819077779	GD	On-Demand	Anodyne	ADRB2	34	44
COC(=O)c1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819077779	GD	On-Demand	Anodyne	ADRB1	49	39
COC(=O)c1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819077779	GD	On-Demand	Anodyne	ADRB3	34	42
COC(=O)c1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819077780	GD	On-Demand	Anodyne	ADRB2	34	44
COC(=O)c1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819077780	GD	On-Demand	Anodyne	ADRB1	49	39
COC(=O)c1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819077780	GD	On-Demand	Anodyne	ADRB3	34	42
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077872	FD	On-Demand	Anodyne	ADRB1	31	44
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077872	FD	On-Demand	Anodyne	ADRB3	50	46
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077872	FD	On-Demand	Anodyne	IGF1R	29	40
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077872	FD	On-Demand	Anodyne	CASR	44	37
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077872	FD	On-Demand	Anodyne	CYP3A4	50	40
O[C@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077873	FD	On-Demand	Anodyne	ADRB1	31	44
O[C@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077873	FD	On-Demand	Anodyne	ADRB3	50	46
O[C@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077873	FD	On-Demand	Anodyne	IGF1R	29	40
O[C@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077873	FD	On-Demand	Anodyne	CASR	44	37
O[C@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077873	FD	On-Demand	Anodyne	CYP3A4	50	40
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077874	FD	On-Demand	Anodyne	ADRB1	31	44
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077874	FD	On-Demand	Anodyne	ADRB3	50	46
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077874	FD	On-Demand	Anodyne	IGF1R	29	40
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077874	FD	On-Demand	Anodyne	CASR	44	37
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077874	FD	On-Demand	Anodyne	CYP3A4	50	40
O[C@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077875	FD	On-Demand	Anodyne	ADRB1	31	44
O[C@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077875	FD	On-Demand	Anodyne	ADRB3	50	46
O[C@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077875	FD	On-Demand	Anodyne	IGF1R	29	40
O[C@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077875	FD	On-Demand	Anodyne	CASR	44	37
O[C@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(Cl)c1	ZINC000819077875	FD	On-Demand	Anodyne	CYP3A4	50	40
COc1cccc([C@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819077937	CG	On-Demand	Anodyne	KCNQ2	43	42
COc1cccc([C@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819077937	CG	On-Demand	Anodyne	MTNR1A	27	44
COc1cccc([C@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819077937	CG	On-Demand	Anodyne	MTNR1B	31	44
COc1cccc([C@@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819077938	CG	On-Demand	Anodyne	KCNQ2	43	42
COc1cccc([C@@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819077938	CG	On-Demand	Anodyne	MTNR1A	27	44
COc1cccc([C@@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819077938	CG	On-Demand	Anodyne	MTNR1B	31	44
CCOc1ccccc1[C@H](C)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819077946	CF	On-Demand	Anodyne	HCN1	50	37
CCOc1ccccc1[C@H](C)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819077946	CF	On-Demand	Anodyne	HCN4	43	36
CCOc1ccccc1[C@H](C)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819077947	CF	On-Demand	Anodyne	HCN1	50	37
CCOc1ccccc1[C@H](C)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819077947	CF	On-Demand	Anodyne	HCN4	43	36
CCOc1ccccc1[C@H](C)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819077948	CF	On-Demand	Anodyne	HCN1	50	37
CCOc1ccccc1[C@H](C)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819077948	CF	On-Demand	Anodyne	HCN4	43	36
CCOc1ccccc1[C@H](C)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819077949	CF	On-Demand	Anodyne	HCN1	50	37
CCOc1ccccc1[C@H](C)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819077949	CF	On-Demand	Anodyne	HCN4	43	36
Cn1ccnc1C[C@@H](NC(=O)Nc1cccc(CC(=O)O)c1)c1ccccc1	ZINC000819077963	GG	On-Demand	Anodyne	CCKAR	19	45
Cn1ccnc1C[C@@H](NC(=O)Nc1cccc(CC(=O)O)c1)c1ccccc1	ZINC000819077963	GG	On-Demand	Anodyne	CCKBR	26	45
Cn1ccnc1C[C@H](NC(=O)Nc1cccc(CC(=O)O)c1)c1ccccc1	ZINC000819077966	GG	On-Demand	Anodyne	CCKAR	19	45
Cn1ccnc1C[C@H](NC(=O)Nc1cccc(CC(=O)O)c1)c1ccccc1	ZINC000819077966	GG	On-Demand	Anodyne	CCKBR	26	45
Cn1nc(-c2ccccc2)c(CNc2cccc(CC(=O)O)c2)c1Cl	ZINC000819077974	FH	On-Demand	Anodyne	FABP4	39	42
Cn1nc(-c2ccccc2)c(CNc2cccc(CC(=O)O)c2)c1Cl	ZINC000819077974	FH	On-Demand	Anodyne	NR1H3	16	43
Cn1nc(-c2ccccc2)c(CNc2cccc(CC(=O)O)c2)c1Cl	ZINC000819077974	FH	On-Demand	Anodyne	NR1H2	29	43
Cn1nc(-c2ccccc2)c(CNc2cccc(CC(=O)O)c2)c1Cl	ZINC000819077974	FH	On-Demand	Anodyne	PTGDR2	29	40
Cn1ccnc1SCc1cccc(C(=O)NCCCC(=O)O)c1	ZINC000819077978	EE	On-Demand	Anodyne	DRD4	41	32
Cn1nc(C(=O)NNC(=O)NCCCCCC(=O)O)c2ccccc2c1=O	ZINC000819077995	GC	On-Demand	Reactive	FOLH1	43	35
Cn1nc(-c2ccncc2)cc1NC(=O)CSCC(=O)O	ZINC000819078008	DD	On-Demand	Anodyne	GPR142	30	53
Cn1cnnc1C1CCN(C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819078025	ED	On-Demand	Anodyne	RBP4	42	41
Cn1cnnc1C1CCN(C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819078025	ED	On-Demand	Anodyne	SMO	19	40
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819078032	EE	On-Demand	Anodyne	GPR119	19	41
CC(C)(C)OC(=O)N1CC(NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819078034	EE	On-Demand	Anodyne	GPR119	19	41
Cn1cnc2cc(NC(=O)C(=O)NCC(=O)O)ccc21	ZINC000819078037	CB	On-Demand	Anodyne	NR1I2	54	34
Cn1nc(C(=O)NCCCCCC(=O)O)c2ccccc2c1=O	ZINC000819078052	DD	On-Demand	Anodyne	HTR3A	19	40
Cn1nc(C(=O)NCCCCCC(=O)O)c2ccccc2c1=O	ZINC000819078052	DD	On-Demand	Anodyne	FOLH1	40	36
Cn1nc(C(=O)NCCCCCC(=O)O)c2ccccc2c1=O	ZINC000819078052	DD	On-Demand	Anodyne	POLR1A	41	33
Cn1cnn(CN2CC[C@@H](C(=O)O)C2)c1=S	ZINC000819078053	BC	On-Demand	Anodyne	SLC6A1	139	37
Cn1cnn(CN2CC[C@H](C(=O)O)C2)c1=S	ZINC000819078056	BC	On-Demand	Anodyne	SLC6A1	139	37
Cn1nc(C(=O)OCc2ccc(C(=O)O)cc2)c2ccccc2c1=O	ZINC000819078064	ED	On-Demand	Anodyne	ELANE	34	41
Cn1cnc(S(=O)(=O)Nc2ccccc2CC(=O)O)c1Cl	ZINC000819078066	ED	On-Demand	Anodyne	CXCL8	31	42
Cn1nc(C(=O)N(CC(=O)O)c2ccc3c(c2)OCO3)cc1C1CC1	ZINC000819078070	ED	On-Demand	Anodyne	NOS2	47	32
Cn1ccnc1[C@@H](O)[C@@H]1CCCN(C(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819078074	FE	On-Demand	Anodyne	CCR3	26	40
Cn1ccnc1[C@@H](O)[C@@H]1CCCN(C(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819078074	FE	On-Demand	Anodyne	P2RY14	44	35
Cn1ccnc1[C@H](O)[C@@H]1CCCN(C(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819078076	FE	On-Demand	Anodyne	CCR3	26	40
Cn1ccnc1[C@H](O)[C@@H]1CCCN(C(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819078076	FE	On-Demand	Anodyne	P2RY14	44	35
Cn1ccnc1[C@H](O)[C@H]1CCCN(C(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819078078	FE	On-Demand	Anodyne	CCR3	26	40
Cn1ccnc1[C@H](O)[C@H]1CCCN(C(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819078078	FE	On-Demand	Anodyne	P2RY14	44	35
Cn1ccnc1[C@@H](O)[C@H]1CCCN(C(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819078080	FE	On-Demand	Anodyne	CCR3	26	40
Cn1ccnc1[C@@H](O)[C@H]1CCCN(C(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819078080	FE	On-Demand	Anodyne	P2RY14	44	35
CC[C@H](CN1CCCC1)NC[C@H](O)c1cccnc1	ZINC000819078089	CD	On-Demand	Anodyne	ADRB1	20	45
CC[C@H](CN1CCCC1)NC[C@H](O)c1cccnc1	ZINC000819078089	CD	On-Demand	Anodyne	ADRB3	71	45
CC[C@@H](CN1CCCC1)NC[C@H](O)c1cccnc1	ZINC000819078091	CD	On-Demand	Anodyne	ADRB1	20	45
CC[C@@H](CN1CCCC1)NC[C@H](O)c1cccnc1	ZINC000819078091	CD	On-Demand	Anodyne	ADRB3	71	45
CC[C@H](CN1CCCC1)NC[C@@H](O)c1cccnc1	ZINC000819078093	CD	On-Demand	Anodyne	ADRB1	20	45
CC[C@H](CN1CCCC1)NC[C@@H](O)c1cccnc1	ZINC000819078093	CD	On-Demand	Anodyne	ADRB3	71	45
CC[C@@H](CN1CCCC1)NC[C@@H](O)c1cccnc1	ZINC000819078095	CD	On-Demand	Anodyne	ADRB1	20	45
CC[C@@H](CN1CCCC1)NC[C@@H](O)c1cccnc1	ZINC000819078095	CD	On-Demand	Anodyne	ADRB3	71	45
Cn1ccnc1-c1cccc(NC(=O)NC2(C(=O)O)CCCC2)c1	ZINC000819078100	EF	On-Demand	Anodyne	CCKAR	36	42
Cn1ccnc1-c1cccc(NC(=O)NC2(C(=O)O)CCCC2)c1	ZINC000819078100	EF	On-Demand	Anodyne	CCR3	30	44
Cn1ccnc1-c1cccc(NC(=O)NC2(C(=O)O)CCCC2)c1	ZINC000819078100	EF	On-Demand	Anodyne	CCKBR	61	42
Cn1ccnc1-c1cccc(NC(=O)NC2(C(=O)O)CCCC2)c1	ZINC000819078100	EF	On-Demand	Anodyne	NPPA	43	32
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	ACE	51	38
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	MME	115	41
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	ANPEP	50	36
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	FCER2	43	32
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	TRY2_BOVIN	83	34
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	CPA1	45	50
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	ITGA4	42	39
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	CAPNS1	51	36
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	MMP2	28	55
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	MMP3	16	50
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	CAPN1	58	39
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	MMP9	24	55
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	CAPN2	55	31
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	ACE2	74	38
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	ITGAV	72	39
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	ST14	46	33
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	ADAMTS4	17	41
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	FPR1	73	43
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	BLA1_STEMA	48	35
Cn1cnc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1Cl	ZINC000819078114	ED	On-Demand	Anodyne	GPR142	74	35
Cn1cnc2c(NCc3ccc(C(=O)O)cc3)ncnc21	ZINC000819078119	CD	On-Demand	Anodyne	ADORA1	36	46
Cn1cnc2c(NCc3ccc(C(=O)O)cc3)ncnc21	ZINC000819078119	CD	On-Demand	Anodyne	SLC29A1	19	45
Cn1cnc2c(NCc3ccc(C(=O)O)cc3)ncnc21	ZINC000819078119	CD	On-Demand	Anodyne	ADORA3	84	48
Cn1cnc2c(NCc3ccc(C(=O)O)cc3)ncnc21	ZINC000819078119	CD	On-Demand	Anodyne	DNMT3B	35	40
Cn1ccnc1[C@H](NC(=O)N1CC[C@H](C(=O)O)C1)c1cccc(F)c1	ZINC000819078122	ED	On-Demand	Anodyne	CCR5	66	34
Cn1ccnc1[C@@H](NC(=O)N1CC[C@H](C(=O)O)C1)c1cccc(F)c1	ZINC000819078124	ED	On-Demand	Anodyne	CCR5	66	34
Cn1ccnc1[C@@H](NC(=O)N1CC[C@@H](C(=O)O)C1)c1cccc(F)c1	ZINC000819078126	ED	On-Demand	Anodyne	CCR5	66	34
Cn1ccnc1[C@H](NC(=O)N1CC[C@@H](C(=O)O)C1)c1cccc(F)c1	ZINC000819078128	ED	On-Demand	Anodyne	CCR5	66	34
Cn1ccnc1SCc1cccc(C(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819078129	EE	On-Demand	Anodyne	SLC6A1	54	34
Cn1ccnc1SCc1cccc(C(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819078131	EE	On-Demand	Anodyne	SLC6A1	54	34
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(N(C)C)cc2C)c1	ZINC000819078158	FF	On-Demand	Clean	ADRB2	22	44
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(N(C)C)cc2C)c1	ZINC000819078158	FF	On-Demand	Clean	ADRB1	46	39
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(N(C)C)cc2C)c1	ZINC000819078158	FF	On-Demand	Clean	ABCB1	28	47
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(N(C)C)cc2C)c1	ZINC000819078158	FF	On-Demand	Clean	CCR2	17	40
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(N(C)C)cc2C)c1	ZINC000819078159	FF	On-Demand	Clean	ADRB2	22	44
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(N(C)C)cc2C)c1	ZINC000819078159	FF	On-Demand	Clean	ADRB1	46	39
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(N(C)C)cc2C)c1	ZINC000819078159	FF	On-Demand	Clean	ABCB1	28	47
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(N(C)C)cc2C)c1	ZINC000819078159	FF	On-Demand	Clean	CCR2	17	40
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCN(CCN3CCOCC3)C2)cc1	ZINC000819078176	FC	On-Demand	Bother	KCNJ1	28	44
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCN(CCN3CCOCC3)C2)cc1	ZINC000819078177	FC	On-Demand	Bother	KCNJ1	28	44
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCN(CCN3CCOCC3)C2)cc1	ZINC000819078178	FC	On-Demand	Bother	KCNJ1	28	44
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCN(CCN3CCOCC3)C2)cc1	ZINC000819078179	FC	On-Demand	Bother	KCNJ1	28	44
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078201	GI	On-Demand	Mild	PAPA1_CARPA	45	45
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078201	GI	On-Demand	Mild	CTSK	17	40
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078201	GI	On-Demand	Mild	CTSL	22	46
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078201	GI	On-Demand	Mild	CTSS	16	48
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078201	GI	On-Demand	Mild	FPR1	45	40
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078202	GI	On-Demand	Mild	PAPA1_CARPA	45	45
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078202	GI	On-Demand	Mild	CTSK	17	40
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078202	GI	On-Demand	Mild	CTSL	22	46
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078202	GI	On-Demand	Mild	CTSS	16	48
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078202	GI	On-Demand	Mild	FPR1	45	40
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078203	GI	On-Demand	Mild	PAPA1_CARPA	45	45
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078203	GI	On-Demand	Mild	CTSK	17	40
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078203	GI	On-Demand	Mild	CTSL	22	46
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078203	GI	On-Demand	Mild	CTSS	16	48
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078203	GI	On-Demand	Mild	FPR1	45	40
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078204	GI	On-Demand	Mild	PAPA1_CARPA	45	45
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078204	GI	On-Demand	Mild	CTSK	17	40
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078204	GI	On-Demand	Mild	CTSL	22	46
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078204	GI	On-Demand	Mild	CTSS	16	48
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819078204	GI	On-Demand	Mild	FPR1	45	40
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(Br)c1	ZINC000819078211	GD	On-Demand	Anodyne	CASR	43	36
O[C@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1cccc(Br)c1	ZINC000819078212	GD	On-Demand	Anodyne	CASR	43	36
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(Br)c1	ZINC000819078213	GD	On-Demand	Anodyne	CASR	43	36
O[C@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1cccc(Br)c1	ZINC000819078214	GD	On-Demand	Anodyne	CASR	43	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccc3ccccc13)C2	ZINC000819078235	FG	On-Demand	Anodyne	P2RX7	34	50
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccc3ccccc13)C2	ZINC000819078236	FG	On-Demand	Anodyne	P2RX7	34	50
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)[C@@H](C)c1cccc(C(F)(F)F)c1)C2	ZINC000819078241	GI	On-Demand	Anodyne	TACR1	28	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)[C@@H](C)c1cccc(C(F)(F)F)c1)C2	ZINC000819078241	GI	On-Demand	Anodyne	CCR2	52	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1)C2	ZINC000819078242	GI	On-Demand	Anodyne	TACR1	28	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1)C2	ZINC000819078242	GI	On-Demand	Anodyne	CCR2	52	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1)C2	ZINC000819078243	GI	On-Demand	Anodyne	TACR1	28	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)[C@H](C)c1cccc(C(F)(F)F)c1)C2	ZINC000819078243	GI	On-Demand	Anodyne	CCR2	52	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)[C@@H](C)c1cccc(C(F)(F)F)c1)C2	ZINC000819078244	GI	On-Demand	Anodyne	TACR1	28	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)[C@@H](C)c1cccc(C(F)(F)F)c1)C2	ZINC000819078244	GI	On-Demand	Anodyne	CCR2	52	38
C[C@H](c1cc(F)ccc1F)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078291	GI	On-Demand	Mild	PAPA1_CARPA	38	45
C[C@H](c1cc(F)ccc1F)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078292	GI	On-Demand	Mild	PAPA1_CARPA	38	45
C[C@@H](c1cc(F)ccc1F)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078293	GI	On-Demand	Mild	PAPA1_CARPA	38	45
C[C@@H](c1cc(F)ccc1F)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078294	GI	On-Demand	Mild	PAPA1_CARPA	38	45
Cn1ccnc1[C@@H](NC(=O)N1CC[C@H](C(=O)O)C1)c1ccccc1	ZINC000819078321	ED	On-Demand	Anodyne	SLC6A1	42	38
Cn1ccnc1[C@@H](NC(=O)N1CC[C@@H](C(=O)O)C1)c1ccccc1	ZINC000819078324	ED	On-Demand	Anodyne	SLC6A1	42	38
Cn1ccnc1[C@H](NC(=O)N1CC[C@H](C(=O)O)C1)c1ccccc1	ZINC000819078326	ED	On-Demand	Anodyne	SLC6A1	42	38
Cn1ccnc1[C@H](NC(=O)N1CC[C@@H](C(=O)O)C1)c1ccccc1	ZINC000819078327	ED	On-Demand	Anodyne	SLC6A1	42	38
CC(C)(C)OC(=O)N1CC(NCCS(=O)(=O)c2ccc(C#N)cn2)C1	ZINC000819078336	FC	On-Demand	Mild	GPR119	42	43
Cn1cnc2cc(NC(=O)C(=O)NCc3ccc(C(=O)O)cc3)ccc21	ZINC000819078338	FD	On-Demand	Anodyne	NR1I2	49	32
Cn1ccnc1[C@H](NC(=O)Nc1ccccc1CC(=O)O)c1ccccc1F	ZINC000819078342	GG	On-Demand	Anodyne	CXCL8	26	41
Cn1ccnc1[C@@H](NC(=O)Nc1ccccc1CC(=O)O)c1ccccc1F	ZINC000819078344	GG	On-Demand	Anodyne	CXCL8	26	41
Cn1cnnc1-c1cccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819078347	GD	On-Demand	Anodyne	PTGIR	15	40
Cn1cnnc1-c1cccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819078347	GD	On-Demand	Anodyne	PTPN11	61	34
Cn1cnnc1-c1cccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819078347	GD	On-Demand	Anodyne	RPA1	54	34
Cn1cnc2c1c(=O)n(CCCN1CC[C@H](C(=O)O)C1)c(=O)n2C	ZINC000819078361	EB	On-Demand	Anodyne	SLC6A1	98	36
Cn1cnc2c1c(=O)n(CCCN1CC[C@@H](C(=O)O)C1)c(=O)n2C	ZINC000819078362	EB	On-Demand	Anodyne	SLC6A1	98	36
Cn1nc(C(C)(C)C)cc1NC(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819078364	DD	On-Demand	Anodyne	SLC6A1	84	33
Cn1nc(C(C)(C)C)cc1NC(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819078364	DD	On-Demand	Anodyne	MAPK14	15	43
Cn1nc(C(C)(C)C)cc1NC(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819078365	DD	On-Demand	Anodyne	SLC6A1	84	33
Cn1nc(C(C)(C)C)cc1NC(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819078365	DD	On-Demand	Anodyne	MAPK14	15	43
Cn1ccnc1[C@H](NC(=O)N1CC[C@@H](C(=O)O)C1)c1ccccc1F	ZINC000819078367	ED	On-Demand	Anodyne	SLC6A1	42	33
Cn1ccnc1[C@@H](NC(=O)N1CC[C@H](C(=O)O)C1)c1ccccc1F	ZINC000819078368	ED	On-Demand	Anodyne	SLC6A1	42	33
Cn1ccnc1[C@@H](NC(=O)N1CC[C@@H](C(=O)O)C1)c1ccccc1F	ZINC000819078369	ED	On-Demand	Anodyne	SLC6A1	42	33
Cn1ccnc1[C@H](NC(=O)N1CC[C@H](C(=O)O)C1)c1ccccc1F	ZINC000819078370	ED	On-Demand	Anodyne	SLC6A1	42	33
Cn1ccnc1SCc1cccc(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819078371	GG	On-Demand	Anodyne	MMP13	17	53
Cn1ccnc1SCc1cccc(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819078371	GG	On-Demand	Anodyne	NAMPT	44	40
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819078372	GD	On-Demand	Anodyne	ACE	34	40
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819078372	GD	On-Demand	Anodyne	PREP	34	42
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819078373	GD	On-Demand	Anodyne	ACE	34	40
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819078373	GD	On-Demand	Anodyne	PREP	34	42
Cn1ccnc1SCc1cccc(C(=O)N[C@H](C(=O)O)c2ccccc2)c1	ZINC000819078379	GG	On-Demand	Anodyne	MTTP	53	31
Cn1nc(C(C)(C)C)cc1C(=O)N(CC(=O)O)c1ccc2c(c1)OCO2	ZINC000819078380	FE	On-Demand	Anodyne	CTSV	43	33
Cn1ccnc1-c1csc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)n1	ZINC000819078385	GD	On-Demand	Anodyne	MPL	57	33
Cn1ccnc1-c1csc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)n1	ZINC000819078385	GD	On-Demand	Anodyne	ROCK1	17	43
Cn1nc(C(C)(C)C)cc1NC(=O)CN(CC(=O)O)c1ccccc1	ZINC000819078386	EE	On-Demand	Anodyne	MAPK14	26	52
Cn1nc(C(=O)OCc2ccc(C(=O)O)cc2)cc1C1CC1	ZINC000819078395	DE	On-Demand	Anodyne	IL2RA	56	40
Cn1cncc1CNc1cccc(CC(=O)O)c1	ZINC000819078406	BD	On-Demand	Anodyne	NR1H2	22	40
Cn1ccnc1C[C@H](NC(=O)N1CC[C@@H](C(=O)O)C1)c1ccccc1	ZINC000819078417	ED	On-Demand	Anodyne	SLC6A1	54	36
Cn1ccnc1C[C@H](NC(=O)N1CC[C@@H](C(=O)O)C1)c1ccccc1	ZINC000819078417	ED	On-Demand	Anodyne	CCR5	30	40
Cn1ccnc1C[C@H](NC(=O)N1CC[C@H](C(=O)O)C1)c1ccccc1	ZINC000819078418	ED	On-Demand	Anodyne	SLC6A1	54	36
Cn1ccnc1C[C@H](NC(=O)N1CC[C@H](C(=O)O)C1)c1ccccc1	ZINC000819078418	ED	On-Demand	Anodyne	CCR5	30	40
Cn1ccnc1C[C@@H](NC(=O)N1CC[C@@H](C(=O)O)C1)c1ccccc1	ZINC000819078419	ED	On-Demand	Anodyne	SLC6A1	54	36
Cn1ccnc1C[C@@H](NC(=O)N1CC[C@@H](C(=O)O)C1)c1ccccc1	ZINC000819078419	ED	On-Demand	Anodyne	CCR5	30	40
Cn1ccnc1C[C@@H](NC(=O)N1CC[C@H](C(=O)O)C1)c1ccccc1	ZINC000819078420	ED	On-Demand	Anodyne	SLC6A1	54	36
Cn1ccnc1C[C@@H](NC(=O)N1CC[C@H](C(=O)O)C1)c1ccccc1	ZINC000819078420	ED	On-Demand	Anodyne	CCR5	30	40
Cn1ccnc1-c1cccc(NC(=O)NCCC(=O)O)c1	ZINC000819078438	CD	On-Demand	Anodyne	CCKAR	44	42
Cn1ccnc1-c1cccc(NC(=O)NCCC(=O)O)c1	ZINC000819078438	CD	On-Demand	Anodyne	CCR3	38	43
Cn1ccnc1-c1cccc(NC(=O)NCCC(=O)O)c1	ZINC000819078438	CD	On-Demand	Anodyne	CCKBR	70	42
Cn1ccnc1-c1cccc(NC(=O)NCCC(=O)O)c1	ZINC000819078438	CD	On-Demand	Anodyne	EPHB4	24	41
O[C@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1ccc(Cl)c(F)c1	ZINC000819078460	FD	On-Demand	Anodyne	MAPK1	44	38
O[C@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1ccc(Cl)c(F)c1	ZINC000819078461	FD	On-Demand	Anodyne	MAPK1	44	38
O[C@@H](CN[C@@H]1CCN(CCN2CCOCC2)C1)c1ccc(Cl)c(F)c1	ZINC000819078462	FD	On-Demand	Anodyne	MAPK1	44	38
O[C@@H](CN[C@H]1CCN(CCN2CCOCC2)C1)c1ccc(Cl)c(F)c1	ZINC000819078463	FD	On-Demand	Anodyne	MAPK1	44	38
Cc1ccccc1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819078520	GI	On-Demand	Mild	PAPA1_CARPA	58	47
Cc1ccccc1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819078520	GI	On-Demand	Mild	CTSL	17	47
Cc1ccccc1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819078520	GI	On-Demand	Mild	FPR1	45	36
Cc1ccccc1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819078521	GI	On-Demand	Mild	PAPA1_CARPA	58	47
Cc1ccccc1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819078521	GI	On-Demand	Mild	CTSL	17	47
Cc1ccccc1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819078521	GI	On-Demand	Mild	FPR1	45	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccc(Cl)c1Cl)C2	ZINC000819078522	FG	On-Demand	Anodyne	P2RX7	85	51
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccc(Cl)c1Cl)C2	ZINC000819078523	FG	On-Demand	Anodyne	P2RX7	85	51
CSc1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819078560	FE	On-Demand	Anodyne	ADRB1	40	39
CSc1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819078560	FE	On-Demand	Anodyne	ADRB3	27	40
CSc1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819078560	FE	On-Demand	Anodyne	GPR119	25	43
CSc1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819078561	FE	On-Demand	Anodyne	ADRB1	40	39
CSc1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819078561	FE	On-Demand	Anodyne	ADRB3	27	40
CSc1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819078561	FE	On-Demand	Anodyne	GPR119	25	43
Cn1nc(-c2ccncc2)cc1NC(=O)C1=NN(c2ccccc2)[C@H](C(=O)O)C1	ZINC000819078585	GE	On-Demand	Anodyne	GPR142	18	45
Cn1nc(-c2ccncc2)cc1NC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)O)C1	ZINC000819078587	GE	On-Demand	Anodyne	GPR142	18	45
Cn1ccnc1-c1cccc(NC(=O)NCC(=O)O)c1	ZINC000819078588	CD	On-Demand	Anodyne	FABP4	21	40
Cn1ccnc1-c1cccc(NC(=O)NCC(=O)O)c1	ZINC000819078588	CD	On-Demand	Anodyne	CCKAR	50	45
Cn1ccnc1-c1cccc(NC(=O)NCC(=O)O)c1	ZINC000819078588	CD	On-Demand	Anodyne	CCR3	32	44
Cn1ccnc1-c1cccc(NC(=O)NCC(=O)O)c1	ZINC000819078588	CD	On-Demand	Anodyne	CCKBR	82	45
Cn1ccnc1-c1cccc(NC(=O)NCC(=O)O)c1	ZINC000819078588	CD	On-Demand	Anodyne	EPHB4	25	42
Cn1cnc2cc(NC(=O)C(=O)NCCCCCC(=O)O)ccc21	ZINC000819078590	ED	On-Demand	Anodyne	QPCT	37	51
Cn1nc(C(=O)N(CC(=O)O)c2ccc3c(c2)OCO3)c2ccccc2c1=O	ZINC000819078617	GD	On-Demand	Anodyne	NOS2	86	35
Cn1cnc2cc(NC(=O)C(=O)NCCC(=O)O)ccc21	ZINC000819078624	CC	On-Demand	Anodyne	NR1I2	49	33
Cn1cnc2cc(NC(=O)C(=O)NCCC(=O)O)ccc21	ZINC000819078624	CC	On-Demand	Anodyne	QPCT	20	49
Cn1cnnc1C1CCN(C(=O)NCc2ccc(C(=O)O)cc2)CC1	ZINC000819078646	ED	On-Demand	Anodyne	IL2RA	40	34
Cn1cnnc1C1CCN(C(=O)NCc2ccc(C(=O)O)cc2)CC1	ZINC000819078646	ED	On-Demand	Anodyne	TRYP_PIG	45	31
Cn1ccnc1C[C@H](NC(=O)N1CCC(C(=O)O)CC1)c1ccccc1	ZINC000819078662	FE	On-Demand	Anodyne	CCR5	25	43
Cn1ccnc1C[C@@H](NC(=O)N1CCC(C(=O)O)CC1)c1ccccc1	ZINC000819078663	FE	On-Demand	Anodyne	CCR5	25	43
Cn1ccnc1[C@@H](O)C1CCN(C(=O)Nc2cccc(CC(=O)O)c2)CC1	ZINC000819078667	FE	On-Demand	Anodyne	P2RY14	46	36
Cn1ccnc1[C@H](O)C1CCN(C(=O)Nc2cccc(CC(=O)O)c2)CC1	ZINC000819078668	FE	On-Demand	Anodyne	P2RY14	46	36
CN(Cc1cccc(C#N)c1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078681	FG	On-Demand	Mild	CTSB	41	42
CN(Cc1cccc(C#N)c1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078681	FG	On-Demand	Mild	PAPA1_CARPA	56	46
CN(Cc1cccc(C#N)c1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078681	FG	On-Demand	Mild	CTSL	15	46
CN(Cc1cccc(C#N)c1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078681	FG	On-Demand	Mild	FPR1	43	37
CN(Cc1cccc(C#N)c1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078681	FG	On-Demand	Mild	CTRB_BOVIN	56	35
CN(Cc1cccc(C#N)c1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078683	FG	On-Demand	Mild	CTSB	41	42
CN(Cc1cccc(C#N)c1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078683	FG	On-Demand	Mild	PAPA1_CARPA	56	46
CN(Cc1cccc(C#N)c1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078683	FG	On-Demand	Mild	CTSL	15	46
CN(Cc1cccc(C#N)c1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078683	FG	On-Demand	Mild	FPR1	43	37
CN(Cc1cccc(C#N)c1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078683	FG	On-Demand	Mild	CTRB_BOVIN	56	35
CC[C@H](CN1CCCC1)NC[C@H](O)c1ccccc1	ZINC000819078691	CE	On-Demand	Anodyne	OPRK1	15	40
CC[C@H](CN1CCCC1)NC[C@H](O)c1ccccc1	ZINC000819078691	CE	On-Demand	Anodyne	KCNQ2	43	36
Cn1nc(C(=O)NCCCC(=O)O)c2ccccc2c1=O	ZINC000819078692	CC	On-Demand	Anodyne	IMDH_CRYPV	26	40
CC[C@@H](CN1CCCC1)NC[C@H](O)c1ccccc1	ZINC000819078693	CE	On-Demand	Anodyne	OPRK1	15	40
CC[C@@H](CN1CCCC1)NC[C@H](O)c1ccccc1	ZINC000819078693	CE	On-Demand	Anodyne	KCNQ2	43	36
CC[C@H](CN1CCCC1)NC[C@@H](O)c1ccccc1	ZINC000819078695	CE	On-Demand	Anodyne	OPRK1	15	40
CC[C@H](CN1CCCC1)NC[C@@H](O)c1ccccc1	ZINC000819078695	CE	On-Demand	Anodyne	KCNQ2	43	36
CC[C@@H](CN1CCCC1)NC[C@@H](O)c1ccccc1	ZINC000819078696	CE	On-Demand	Anodyne	OPRK1	15	40
CC[C@@H](CN1CCCC1)NC[C@@H](O)c1ccccc1	ZINC000819078696	CE	On-Demand	Anodyne	KCNQ2	43	36
Cn1nc(C(=O)NNC(=O)NCCC(=O)O)c2ccccc2c1=O	ZINC000819078705	EB	On-Demand	Reactive	IMDH_CRYPV	25	40
Cn1cnc(S(=O)(=O)NCc2ccc(C(=O)O)cc2)c1Cl	ZINC000819078709	ED	On-Demand	Anodyne	RPA1	61	39
CCC1CCC(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819078717	FH	On-Demand	Mild	PAPA1_CARPA	39	51
CCC1CCC(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819078717	FH	On-Demand	Mild	CTSK	17	46
CCC1CCC(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819078718	FH	On-Demand	Mild	PAPA1_CARPA	39	51
CCC1CCC(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819078718	FH	On-Demand	Mild	CTSK	17	46
COc1cccc([C@H](C)NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819078729	CF	On-Demand	Anodyne	KCNQ2	54	39
COc1cccc([C@H](C)NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819078730	CF	On-Demand	Anodyne	KCNQ2	54	39
COc1cccc([C@H](C)NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819078731	CF	On-Demand	Anodyne	KCNQ2	54	39
COc1cccc([C@H](C)NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819078732	CF	On-Demand	Anodyne	KCNQ2	54	39
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(OCc2ccccc2)cc1	ZINC000819078734	EH	On-Demand	Anodyne	MAOB	17	42
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(OCc2ccccc2)cc1	ZINC000819078734	EH	On-Demand	Anodyne	ADAM17	19	41
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(OCc2ccccc2)cc1	ZINC000819078734	EH	On-Demand	Anodyne	FFAR1	26	40
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(OCc2ccccc2)cc1	ZINC000819078735	EH	On-Demand	Anodyne	MAOB	17	42
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(OCc2ccccc2)cc1	ZINC000819078735	EH	On-Demand	Anodyne	ADAM17	19	41
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(OCc2ccccc2)cc1	ZINC000819078735	EH	On-Demand	Anodyne	FFAR1	26	40
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(OCc2ccccc2)cc1	ZINC000819078736	EH	On-Demand	Anodyne	MAOB	17	42
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(OCc2ccccc2)cc1	ZINC000819078736	EH	On-Demand	Anodyne	ADAM17	19	41
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(OCc2ccccc2)cc1	ZINC000819078736	EH	On-Demand	Anodyne	FFAR1	26	40
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(OCc2ccccc2)cc1	ZINC000819078737	EH	On-Demand	Anodyne	MAOB	17	42
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(OCc2ccccc2)cc1	ZINC000819078737	EH	On-Demand	Anodyne	ADAM17	19	41
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(OCc2ccccc2)cc1	ZINC000819078737	EH	On-Demand	Anodyne	FFAR1	26	40
CCOC(=O)N1CCN(C(=O)CNc2cc(Cl)ccc2OC(F)F)CC1	ZINC000819078738	GF	On-Demand	Anodyne	FDFT1	17	41
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819078744	FE	On-Demand	Clean	ADRB2	38	44
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819078744	FE	On-Demand	Clean	ADRB1	60	43
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819078744	FE	On-Demand	Clean	ADRB3	34	43
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819078744	FE	On-Demand	Clean	ABCB1	15	43
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819078745	FE	On-Demand	Clean	ADRB2	38	44
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819078745	FE	On-Demand	Clean	ADRB1	60	43
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819078745	FE	On-Demand	Clean	ADRB3	34	43
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N(C)C)cc2C)cc1	ZINC000819078745	FE	On-Demand	Clean	ABCB1	15	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(C(C)C)cc1)C2	ZINC000819078750	EG	On-Demand	Anodyne	VHL	48	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(C(C)C)cc1)C2	ZINC000819078751	EG	On-Demand	Anodyne	VHL	48	31
C[C@H](CCc1cccc(F)c1)NC[C@H](O)Cc1ccc(F)cc1	ZINC000819078769	DG	On-Demand	Anodyne	ADRB2	24	43
C[C@H](CCc1cccc(F)c1)NC[C@H](O)Cc1ccc(F)cc1	ZINC000819078769	DG	On-Demand	Anodyne	ADRB1	19	43
C[C@H](CCc1cccc(F)c1)NC[C@H](O)Cc1ccc(F)cc1	ZINC000819078769	DG	On-Demand	Anodyne	ADRB3	17	43
C[C@@H](CCc1cccc(F)c1)NC[C@H](O)Cc1ccc(F)cc1	ZINC000819078770	DG	On-Demand	Anodyne	ADRB2	24	43
C[C@@H](CCc1cccc(F)c1)NC[C@H](O)Cc1ccc(F)cc1	ZINC000819078770	DG	On-Demand	Anodyne	ADRB1	19	43
C[C@@H](CCc1cccc(F)c1)NC[C@H](O)Cc1ccc(F)cc1	ZINC000819078770	DG	On-Demand	Anodyne	ADRB3	17	43
C[C@H](CCc1cccc(F)c1)NC[C@@H](O)Cc1ccc(F)cc1	ZINC000819078771	DG	On-Demand	Anodyne	ADRB2	24	43
C[C@H](CCc1cccc(F)c1)NC[C@@H](O)Cc1ccc(F)cc1	ZINC000819078771	DG	On-Demand	Anodyne	ADRB1	19	43
C[C@H](CCc1cccc(F)c1)NC[C@@H](O)Cc1ccc(F)cc1	ZINC000819078771	DG	On-Demand	Anodyne	ADRB3	17	43
C[C@@H](CCc1cccc(F)c1)NC[C@@H](O)Cc1ccc(F)cc1	ZINC000819078772	DG	On-Demand	Anodyne	ADRB2	24	43
C[C@@H](CCc1cccc(F)c1)NC[C@@H](O)Cc1ccc(F)cc1	ZINC000819078772	DG	On-Demand	Anodyne	ADRB1	19	43
C[C@@H](CCc1cccc(F)c1)NC[C@@H](O)Cc1ccc(F)cc1	ZINC000819078772	DG	On-Demand	Anodyne	ADRB3	17	43
CC[C@H](CN1CCCC1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819078824	CF	On-Demand	Anodyne	ADRB1	30	46
CC[C@H](CN1CCCC1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819078824	CF	On-Demand	Anodyne	ADRB3	45	46
CC[C@H](CN1CCCC1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819078824	CF	On-Demand	Anodyne	KCNQ2	29	43
CC[C@@H](CN1CCCC1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819078825	CF	On-Demand	Anodyne	ADRB1	30	46
CC[C@@H](CN1CCCC1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819078825	CF	On-Demand	Anodyne	ADRB3	45	46
CC[C@@H](CN1CCCC1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819078825	CF	On-Demand	Anodyne	KCNQ2	29	43
CC[C@H](CN1CCCC1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819078826	CF	On-Demand	Anodyne	ADRB1	30	46
CC[C@H](CN1CCCC1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819078826	CF	On-Demand	Anodyne	ADRB3	45	46
CC[C@H](CN1CCCC1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819078826	CF	On-Demand	Anodyne	KCNQ2	29	43
CC[C@@H](CN1CCCC1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819078827	CF	On-Demand	Anodyne	ADRB1	30	46
CC[C@@H](CN1CCCC1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819078827	CF	On-Demand	Anodyne	ADRB3	45	46
CC[C@@H](CN1CCCC1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819078827	CF	On-Demand	Anodyne	KCNQ2	29	43
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc(C)n(Cc2ccccc2)c1C	ZINC000819078828	GI	On-Demand	Anodyne	ACE	15	44
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc(C)n(Cc2ccccc2)c1C	ZINC000819078828	GI	On-Demand	Anodyne	PLA2G2A	45	35
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1cc(C)n(Cc2ccccc2)c1C	ZINC000819078831	GI	On-Demand	Anodyne	ACE	15	44
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1cc(C)n(Cc2ccccc2)c1C	ZINC000819078831	GI	On-Demand	Anodyne	PLA2G2A	45	35
C[C@H](NC(=O)Cc1ccc(-n2cnnc2)cc1)c1ccc(C(C)(C)C)cc1	ZINC000819078841	FH	On-Demand	Anodyne	CACNA1I	19	50
C[C@@H](NC(=O)Cc1ccc(-n2cnnc2)cc1)c1ccc(C(C)(C)C)cc1	ZINC000819078842	FH	On-Demand	Anodyne	CACNA1I	19	50
Cc1c(F)cccc1NC(=O)CCNC1CN(C(=O)OC(C)(C)C)C1	ZINC000819078851	FF	On-Demand	Anodyne	GPR119	27	40
O=C(CNc1ccccc1C(F)F)Nc1ccc(N2CCCC2)cc1	ZINC000819078868	EI	On-Demand	Anodyne	KCNQ2	77	47
O=C(CNc1ccccc1C(F)F)Nc1ccc(N2CCCC2)cc1	ZINC000819078868	EI	On-Demand	Anodyne	PRNP	43	36
CCCOc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)cc1	ZINC000819078884	FG	On-Demand	Anodyne	ACACA	18	50
CCCOc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)cc1	ZINC000819078884	FG	On-Demand	Anodyne	ACACB	18	50
CCCOc1ccc([C@H](C)NC(=O)[C@@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)cc1	ZINC000819078885	FG	On-Demand	Anodyne	ACACA	18	50
CCCOc1ccc([C@H](C)NC(=O)[C@@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)cc1	ZINC000819078885	FG	On-Demand	Anodyne	ACACB	18	50
CCCOc1ccc([C@H](C)NC(=O)[C@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)cc1	ZINC000819078886	FG	On-Demand	Anodyne	ACACA	18	50
CCCOc1ccc([C@H](C)NC(=O)[C@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)cc1	ZINC000819078886	FG	On-Demand	Anodyne	ACACB	18	50
CCCOc1ccc([C@@H](C)NC(=O)[C@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)cc1	ZINC000819078887	FG	On-Demand	Anodyne	ACACA	18	50
CCCOc1ccc([C@@H](C)NC(=O)[C@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)cc1	ZINC000819078887	FG	On-Demand	Anodyne	ACACB	18	50
O=C(CNc1ccccc1C(F)F)NC1CCCCCCC1	ZINC000819078890	DI	On-Demand	Anodyne	EPHX2	19	45
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819078891	FE	On-Demand	Anodyne	ADRB2	32	46
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819078891	FE	On-Demand	Anodyne	ABCB1	41	46
CC(C)(C)OC(=O)N1CC(NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819078892	FE	On-Demand	Anodyne	ADRB2	32	46
CC(C)(C)OC(=O)N1CC(NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819078892	FE	On-Demand	Anodyne	ABCB1	41	46
CC(C)(C)OC(=O)N1CC(NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819078893	FD	On-Demand	Mild	NR1H2	18	46
CC(C)(C)OC(=O)N1CC(NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819078894	EF	On-Demand	Anodyne	GPR119	21	43
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819078895	EF	On-Demand	Anodyne	GPR119	21	43
CC(C)(C)OC(=O)N1CC(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819078908	FD	On-Demand	Anodyne	ADRB3	20	45
CC(C)(C)OC(=O)N1CC(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819078908	FD	On-Demand	Anodyne	GPR119	61	50
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819078909	FD	On-Demand	Anodyne	ADRB3	20	45
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819078909	FD	On-Demand	Anodyne	GPR119	61	50
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(F)=C1CCC1	ZINC000819078911	DG	On-Demand	Anodyne	BMP1	51	37
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)C(F)=C1CCC1	ZINC000819078911	DG	On-Demand	Anodyne	NOS2	80	33
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)C(F)=C1CCC1	ZINC000819078912	DG	On-Demand	Anodyne	BMP1	51	37
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)C(F)=C1CCC1	ZINC000819078912	DG	On-Demand	Anodyne	NOS2	80	33
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819078937	DG	On-Demand	Anodyne	ADRB1	26	42
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819078937	DG	On-Demand	Anodyne	ADRB3	41	44
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819078937	DG	On-Demand	Anodyne	CYP3A4	48	36
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819078938	DG	On-Demand	Anodyne	ADRB1	26	42
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819078938	DG	On-Demand	Anodyne	ADRB3	41	44
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819078938	DG	On-Demand	Anodyne	CYP3A4	48	36
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819078939	DG	On-Demand	Anodyne	ADRB1	26	42
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819078939	DG	On-Demand	Anodyne	ADRB3	41	44
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819078939	DG	On-Demand	Anodyne	CYP3A4	48	36
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819078940	DG	On-Demand	Anodyne	ADRB1	26	42
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819078940	DG	On-Demand	Anodyne	ADRB3	41	44
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819078940	DG	On-Demand	Anodyne	CYP3A4	48	36
CN(Cc1cccc(C#N)c1)C(=O)C(F)=C1CCC1	ZINC000819078957	CF	On-Demand	Mild	HSD17B2	17	40
CC(=O)c1cccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000819078973	FD	On-Demand	Anodyne	ADRB2	26	43
CC(=O)c1cccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000819078973	FD	On-Demand	Anodyne	ADRB1	30	41
CC(=O)c1cccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000819078973	FD	On-Demand	Anodyne	ADRB3	25	40
CC(=O)c1cccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000819078973	FD	On-Demand	Anodyne	ABCB1	22	46
CC(=O)c1cccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000819078974	FD	On-Demand	Anodyne	ADRB2	26	43
CC(=O)c1cccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000819078974	FD	On-Demand	Anodyne	ADRB1	30	41
CC(=O)c1cccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000819078974	FD	On-Demand	Anodyne	ADRB3	25	40
CC(=O)c1cccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000819078974	FD	On-Demand	Anodyne	ABCB1	22	46
C[C@@H](c1c(F)cccc1F)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078976	GI	On-Demand	Mild	PAPA1_CARPA	53	48
C[C@@H](c1c(F)cccc1F)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078976	GI	On-Demand	Mild	CTSK	20	41
C[C@H](c1c(F)cccc1F)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078977	GI	On-Demand	Mild	PAPA1_CARPA	53	48
C[C@H](c1c(F)cccc1F)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078977	GI	On-Demand	Mild	CTSK	20	41
C[C@H](c1c(F)cccc1F)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078978	GI	On-Demand	Mild	PAPA1_CARPA	53	48
C[C@H](c1c(F)cccc1F)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078978	GI	On-Demand	Mild	CTSK	20	41
C[C@@H](c1c(F)cccc1F)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078979	GI	On-Demand	Mild	PAPA1_CARPA	53	48
C[C@@H](c1c(F)cccc1F)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819078979	GI	On-Demand	Mild	CTSK	20	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)CC1	ZINC000819078985	GE	On-Demand	Anodyne	GPR119	34	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)CC1	ZINC000819078986	GE	On-Demand	Anodyne	GPR119	34	44
CC[C@H](CN1CCCC1)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819078993	DE	On-Demand	Bother	KCNJ1	16	42
CC[C@@H](CN1CCCC1)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819078994	DE	On-Demand	Bother	KCNJ1	16	42
CC[C@@H](CN1CCCC1)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819078995	DE	On-Demand	Bother	KCNJ1	16	42
CC[C@H](CN1CCCC1)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819078996	DE	On-Demand	Bother	KCNJ1	16	42
CCCOc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819079017	FH	On-Demand	Anodyne	ACACA	19	52
CCCOc1ccc([C@@H](C)NC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819079017	FH	On-Demand	Anodyne	ACACB	19	52
CCCOc1ccc([C@H](C)NC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819079018	FH	On-Demand	Anodyne	ACACA	19	52
CCCOc1ccc([C@H](C)NC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819079018	FH	On-Demand	Anodyne	ACACB	19	52
CCCOc1ccc([C@H](C)NC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819079019	FH	On-Demand	Anodyne	ACACA	19	52
CCCOc1ccc([C@H](C)NC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819079019	FH	On-Demand	Anodyne	ACACB	19	52
CCCOc1ccc([C@@H](C)NC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819079020	FH	On-Demand	Anodyne	ACACA	19	52
CCCOc1ccc([C@@H](C)NC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819079020	FH	On-Demand	Anodyne	ACACB	19	52
O[C@@H](CN[C@@H]1CCCN(c2cccc(F)c2)C1)c1cccnc1	ZINC000819079029	DF	On-Demand	Anodyne	ADRB3	61	45
O[C@H](CN[C@H]1CCCN(c2cccc(F)c2)C1)c1cccnc1	ZINC000819079030	DF	On-Demand	Anodyne	ADRB3	61	45
O[C@H](CN[C@@H]1CCCN(c2cccc(F)c2)C1)c1cccnc1	ZINC000819079031	DF	On-Demand	Anodyne	ADRB3	61	45
O[C@@H](CN[C@H]1CCCN(c2cccc(F)c2)C1)c1cccnc1	ZINC000819079032	DF	On-Demand	Anodyne	ADRB3	61	45
CC(C)(C)OC(=O)N1CC(NC[C@H](O)COCc2ccccc2F)C1	ZINC000819079046	FD	On-Demand	Anodyne	GPR119	20	49
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)COCc2ccccc2F)C1	ZINC000819079047	FD	On-Demand	Anodyne	GPR119	20	49
CCOc1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079098	FE	On-Demand	Anodyne	ADRB2	36	43
CCOc1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079098	FE	On-Demand	Anodyne	ADRB1	49	41
CCOc1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079098	FE	On-Demand	Anodyne	ADRB3	32	41
CCOc1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079099	FE	On-Demand	Anodyne	ADRB2	36	43
CCOc1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079099	FE	On-Demand	Anodyne	ADRB1	49	41
CCOc1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079099	FE	On-Demand	Anodyne	ADRB3	32	41
COc1ccc(OC)c([C@H](O)CNCCOC2CCCCCC2)c1	ZINC000819079112	EG	On-Demand	Anodyne	ADRB2	20	44
COc1ccc(OC)c([C@H](O)CNCCOC2CCCCCC2)c1	ZINC000819079112	EG	On-Demand	Anodyne	ADRB1	31	44
COc1ccc(OC)c([C@H](O)CNCCOC2CCCCCC2)c1	ZINC000819079112	EG	On-Demand	Anodyne	ADRB3	24	42
O[C@@H](CNCCOC1CCCCCC1)c1ccccc1	ZINC000819079156	CG	On-Demand	Anodyne	ADRB2	41	44
O[C@@H](CNCCOC1CCCCCC1)c1ccccc1	ZINC000819079156	CG	On-Demand	Anodyne	ADRB1	61	53
O[C@@H](CNCCOC1CCCCCC1)c1ccccc1	ZINC000819079156	CG	On-Demand	Anodyne	ADRB3	64	53
O[C@H](CNCCOC1CCCCCC1)c1ccccc1	ZINC000819079157	CG	On-Demand	Anodyne	ADRB2	41	44
O[C@H](CNCCOC1CCCCCC1)c1ccccc1	ZINC000819079157	CG	On-Demand	Anodyne	ADRB1	61	53
O[C@H](CNCCOC1CCCCCC1)c1ccccc1	ZINC000819079157	CG	On-Demand	Anodyne	ADRB3	64	53
CS(=O)(=O)c1ccc([C@H](O)CNCCOC2CCCCCC2)cc1	ZINC000819079179	FE	On-Demand	Anodyne	ADRB2	39	46
CS(=O)(=O)c1ccc([C@H](O)CNCCOC2CCCCCC2)cc1	ZINC000819079179	FE	On-Demand	Anodyne	ADRB1	43	42
CS(=O)(=O)c1ccc([C@H](O)CNCCOC2CCCCCC2)cc1	ZINC000819079179	FE	On-Demand	Anodyne	ADRB3	65	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCOC2CCCCCC2)cc1	ZINC000819079180	FE	On-Demand	Anodyne	ADRB2	39	46
CS(=O)(=O)c1ccc([C@@H](O)CNCCOC2CCCCCC2)cc1	ZINC000819079180	FE	On-Demand	Anodyne	ADRB1	43	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCOC2CCCCCC2)cc1	ZINC000819079180	FE	On-Demand	Anodyne	ADRB3	65	43
CC(C)(C)OC(=O)N1CC(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819079242	FD	On-Demand	Bother	ADRB1	15	40
CC(C)(C)OC(=O)N1CC(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819079242	FD	On-Demand	Bother	ADRB3	16	40
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819079243	FD	On-Demand	Bother	ADRB1	15	40
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819079243	FD	On-Demand	Bother	ADRB3	16	40
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819079265	DF	On-Demand	Anodyne	NOS2	59	34
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819079266	DF	On-Demand	Anodyne	NOS2	59	34
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819079267	DF	On-Demand	Anodyne	NOS2	59	34
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819079268	DF	On-Demand	Anodyne	NOS2	59	34
Cc1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079281	ED	On-Demand	Anodyne	ADRB2	35	49
Cc1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079281	ED	On-Demand	Anodyne	ADRB1	48	41
Cc1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079281	ED	On-Demand	Anodyne	ADRB3	31	41
Cc1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079281	ED	On-Demand	Anodyne	ACOX1	44	31
Cc1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079281	ED	On-Demand	Anodyne	GPR119	30	41
Cc1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079282	ED	On-Demand	Anodyne	ADRB2	35	49
Cc1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079282	ED	On-Demand	Anodyne	ADRB1	48	41
Cc1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079282	ED	On-Demand	Anodyne	ADRB3	31	41
Cc1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079282	ED	On-Demand	Anodyne	ACOX1	44	31
Cc1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079282	ED	On-Demand	Anodyne	GPR119	30	41
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819079287	FI	On-Demand	Mild	PAPA1_CARPA	44	44
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819079287	FI	On-Demand	Mild	CTSK	15	44
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819079287	FI	On-Demand	Mild	FPR1	46	40
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819079288	FI	On-Demand	Mild	PAPA1_CARPA	44	44
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819079288	FI	On-Demand	Mild	CTSK	15	44
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819079288	FI	On-Demand	Mild	FPR1	46	40
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819079289	FI	On-Demand	Mild	PAPA1_CARPA	44	44
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819079289	FI	On-Demand	Mild	CTSK	15	44
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819079289	FI	On-Demand	Mild	FPR1	46	40
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819079290	FI	On-Demand	Mild	PAPA1_CARPA	44	44
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819079290	FI	On-Demand	Mild	CTSK	15	44
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819079290	FI	On-Demand	Mild	FPR1	46	40
O=C(CNc1ccccc1C(F)F)Nc1ccc(N2CCCCC2)cc1	ZINC000819079291	FJ	On-Demand	Anodyne	KCNQ2	75	46
O=C(CNc1ccccc1C(F)F)Nc1ccc(N2CCCCC2)cc1	ZINC000819079291	FJ	On-Demand	Anodyne	PRNP	42	35
COc1ccc(OC)c([C@H](O)CNC2CCN([C@@H](C)c3ccccc3)CC2)c1	ZINC000819079300	GH	On-Demand	Anodyne	ADRB2	17	42
COc1ccc(OC)c([C@H](O)CNC2CCN([C@@H](C)c3ccccc3)CC2)c1	ZINC000819079300	GH	On-Demand	Anodyne	ADRB1	22	42
COc1ccc(OC)c([C@H](O)CNC2CCN([C@@H](C)c3ccccc3)CC2)c1	ZINC000819079300	GH	On-Demand	Anodyne	ADRB3	33	42
COc1ccc(OC)c([C@H](O)CNC2CCN([C@H](C)c3ccccc3)CC2)c1	ZINC000819079302	GH	On-Demand	Anodyne	ADRB2	17	42
COc1ccc(OC)c([C@H](O)CNC2CCN([C@H](C)c3ccccc3)CC2)c1	ZINC000819079302	GH	On-Demand	Anodyne	ADRB1	22	42
COc1ccc(OC)c([C@H](O)CNC2CCN([C@H](C)c3ccccc3)CC2)c1	ZINC000819079302	GH	On-Demand	Anodyne	ADRB3	33	42
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccccc2OC2CCC2)c1	ZINC000819079325	EG	On-Demand	Bother	ADRB1	16	42
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccccc2OC2CCC2)c1	ZINC000819079325	EG	On-Demand	Bother	ADRB3	33	42
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccccc2OC2CCC2)c1	ZINC000819079325	EG	On-Demand	Bother	CACNA1D	46	33
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccccc2OC2CCC2)c1	ZINC000819079326	EG	On-Demand	Bother	ADRB1	16	42
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccccc2OC2CCC2)c1	ZINC000819079326	EG	On-Demand	Bother	ADRB3	33	42
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccccc2OC2CCC2)c1	ZINC000819079326	EG	On-Demand	Bother	CACNA1D	46	33
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCc1ccc(Br)cc1	ZINC000819079420	GF	On-Demand	Anodyne	PAPA1_CARPA	23	44
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCc1ccc(Br)cc1	ZINC000819079422	GF	On-Demand	Anodyne	PAPA1_CARPA	23	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1)C2	ZINC000819079438	FH	On-Demand	Anodyne	ACACB	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)c1ccc(OC(C)C)cc1)C2	ZINC000819079441	FH	On-Demand	Anodyne	ACACB	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)c1ccc(OC(C)C)cc1)C2	ZINC000819079443	FH	On-Demand	Anodyne	ACACB	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)c1ccc(OC(C)C)cc1)C2	ZINC000819079446	FH	On-Demand	Anodyne	ACACB	15	41
C[C@H](c1cccc(Cl)c1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079486	GI	On-Demand	Mild	PAPA1_CARPA	52	43
C[C@H](c1cccc(Cl)c1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079486	GI	On-Demand	Mild	CTSK	20	40
C[C@H](c1cccc(Cl)c1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079486	GI	On-Demand	Mild	CTSL	22	43
C[C@H](c1cccc(Cl)c1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079486	GI	On-Demand	Mild	CTSS	17	43
C[C@H](c1cccc(Cl)c1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079486	GI	On-Demand	Mild	FPR1	43	38
C[C@H](c1cccc(Cl)c1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079487	GI	On-Demand	Mild	PAPA1_CARPA	52	43
C[C@H](c1cccc(Cl)c1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079487	GI	On-Demand	Mild	CTSK	20	40
C[C@H](c1cccc(Cl)c1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079487	GI	On-Demand	Mild	CTSL	22	43
C[C@H](c1cccc(Cl)c1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079487	GI	On-Demand	Mild	CTSS	17	43
C[C@H](c1cccc(Cl)c1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079487	GI	On-Demand	Mild	FPR1	43	38
C[C@@H](c1cccc(Cl)c1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079489	GI	On-Demand	Mild	PAPA1_CARPA	52	43
C[C@@H](c1cccc(Cl)c1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079489	GI	On-Demand	Mild	CTSK	20	40
C[C@@H](c1cccc(Cl)c1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079489	GI	On-Demand	Mild	CTSL	22	43
C[C@@H](c1cccc(Cl)c1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079489	GI	On-Demand	Mild	CTSS	17	43
C[C@@H](c1cccc(Cl)c1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079489	GI	On-Demand	Mild	FPR1	43	38
C[C@@H](c1cccc(Cl)c1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079491	GI	On-Demand	Mild	PAPA1_CARPA	52	43
C[C@@H](c1cccc(Cl)c1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079491	GI	On-Demand	Mild	CTSK	20	40
C[C@@H](c1cccc(Cl)c1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079491	GI	On-Demand	Mild	CTSL	22	43
C[C@@H](c1cccc(Cl)c1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079491	GI	On-Demand	Mild	CTSS	17	43
C[C@@H](c1cccc(Cl)c1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819079491	GI	On-Demand	Mild	FPR1	43	38
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819079539	FF	On-Demand	Anodyne	HTR1A	21	48
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819079539	FF	On-Demand	Anodyne	HTR1D	31	46
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819079539	FF	On-Demand	Anodyne	SLC6A4	21	55
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819079539	FF	On-Demand	Anodyne	NQO2	18	48
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819079539	FF	On-Demand	Anodyne	MPO	110	58
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819079539	FF	On-Demand	Anodyne	MTNR1A	15	48
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819079541	FF	On-Demand	Anodyne	HTR1A	21	48
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819079541	FF	On-Demand	Anodyne	HTR1D	31	46
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819079541	FF	On-Demand	Anodyne	SLC6A4	21	55
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819079541	FF	On-Demand	Anodyne	NQO2	18	48
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819079541	FF	On-Demand	Anodyne	MPO	110	58
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819079541	FF	On-Demand	Anodyne	MTNR1A	15	48
CC[C@H](CN1CCCC1)NC[C@H](O)c1cccc(F)c1	ZINC000819079549	CE	On-Demand	Anodyne	KCNQ2	29	42
CC[C@@H](CN1CCCC1)NC[C@H](O)c1cccc(F)c1	ZINC000819079551	CE	On-Demand	Anodyne	KCNQ2	29	42
CC[C@H](CN1CCCC1)NC[C@@H](O)c1cccc(F)c1	ZINC000819079553	CE	On-Demand	Anodyne	KCNQ2	29	42
CC[C@@H](CN1CCCC1)NC[C@@H](O)c1cccc(F)c1	ZINC000819079555	CE	On-Demand	Anodyne	KCNQ2	29	42
O=C(CNc1ccccc1C(F)F)NCc1ccc(N2CCOCC2)c(F)c1	ZINC000819079557	GG	On-Demand	Clean	STAT6	43	32
CN(C)CC[C@H](NC[C@H](O)c1ccc(Cl)cc1)C(C)(C)C	ZINC000819079563	DG	On-Demand	Anodyne	UTS2	51	42
CN(C)CC[C@@H](NC[C@H](O)c1ccc(Cl)cc1)C(C)(C)C	ZINC000819079566	DG	On-Demand	Anodyne	UTS2	51	42
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(Cl)cc1	ZINC000819079568	GH	On-Demand	Anodyne	ADRA1D	29	40
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(Cl)cc1	ZINC000819079568	GH	On-Demand	Anodyne	ADRA1A	21	40
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(Cl)cc1	ZINC000819079570	GH	On-Demand	Anodyne	ADRA1D	29	40
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(Cl)cc1	ZINC000819079570	GH	On-Demand	Anodyne	ADRA1A	21	40
CN(C)c1ccc(NC(=O)CCNCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819079580	FH	On-Demand	Anodyne	HTR1A	20	48
CN(C)c1ccc(NC(=O)CCNCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819079580	FH	On-Demand	Anodyne	HTR1D	47	46
CN(C)c1ccc(NC(=O)CCNCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819079580	FH	On-Demand	Anodyne	HTR1B	33	46
CN(C)c1ccc(NC(=O)CCNCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819079580	FH	On-Demand	Anodyne	SLC6A4	22	56
CN(C)c1ccc(NC(=O)CCNCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819079580	FH	On-Demand	Anodyne	MPO	110	56
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819079610	FF	On-Demand	Anodyne	DRD4	33	54
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819079610	FF	On-Demand	Anodyne	P2RX3	19	40
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819079636	GD	On-Demand	Bother	DRD4	24	40
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819079639	GD	On-Demand	Bother	DRD4	24	40
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819079642	GD	On-Demand	Bother	DRD4	24	42
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819079645	GD	On-Demand	Bother	DRD4	24	42
O=C(NC1CCN(C(=O)C(F)=C2CCC2)CC1)c1ccc(F)cc1	ZINC000819079685	EF	On-Demand	Anodyne	SSTR3	16	40
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccccc3C)CC2)cc1OC	ZINC000819079692	GF	On-Demand	Anodyne	ADRB2	16	40
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccccc3C)CC2)cc1OC	ZINC000819079692	GF	On-Demand	Anodyne	ADRB1	18	40
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccccc3C)CC2)cc1OC	ZINC000819079692	GF	On-Demand	Anodyne	DRD4	15	44
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccccc3C)CC2)cc1OC	ZINC000819079692	GF	On-Demand	Anodyne	ADRB3	27	44
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccccc3C)CC2)cc1OC	ZINC000819079692	GF	On-Demand	Anodyne	CCR8	48	35
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccccc3C)CC2)cc1OC	ZINC000819079692	GF	On-Demand	Anodyne	L3MBTL3	44	35
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccccc3C)CC2)cc1OC	ZINC000819079694	GF	On-Demand	Anodyne	ADRB2	16	40
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccccc3C)CC2)cc1OC	ZINC000819079694	GF	On-Demand	Anodyne	ADRB1	18	40
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccccc3C)CC2)cc1OC	ZINC000819079694	GF	On-Demand	Anodyne	DRD4	15	44
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccccc3C)CC2)cc1OC	ZINC000819079694	GF	On-Demand	Anodyne	ADRB3	27	44
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccccc3C)CC2)cc1OC	ZINC000819079694	GF	On-Demand	Anodyne	CCR8	48	35
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccccc3C)CC2)cc1OC	ZINC000819079694	GF	On-Demand	Anodyne	L3MBTL3	44	35
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCC(C)(C)c1cccc(F)c1	ZINC000819079715	FF	On-Demand	Anodyne	PAPA1_CARPA	16	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNCC(C)(C)c1cccc(F)c1	ZINC000819079717	FF	On-Demand	Anodyne	PAPA1_CARPA	16	41
O[C@H](CNC[C@@H]1CCc2ccccc2C1)c1ccc(F)c(F)c1	ZINC000819079728	DG	On-Demand	Anodyne	ADRB3	21	40
O[C@@H](CNC[C@H]1CCc2ccccc2C1)c1ccc(F)c(F)c1	ZINC000819079730	DG	On-Demand	Anodyne	ADRB3	21	40
O[C@H](CNC[C@H]1CCc2ccccc2C1)c1ccc(F)c(F)c1	ZINC000819079731	DG	On-Demand	Anodyne	ADRB3	21	40
O[C@@H](CNC[C@@H]1CCc2ccccc2C1)c1ccc(F)c(F)c1	ZINC000819079733	DG	On-Demand	Anodyne	ADRB3	21	40
Cc1ccccc1[C@@H](O)CNCc1ccccc1OC1CCC1	ZINC000819079762	DH	On-Demand	Anodyne	SLC5A4	44	33
O=[N+]([O-])c1ccc([C@@H](O)CNCCOC2CCCCCC2)cc1	ZINC000819079764	DF	On-Demand	Bother	ADRB1	28	43
O=[N+]([O-])c1ccc([C@@H](O)CNCCOC2CCCCCC2)cc1	ZINC000819079764	DF	On-Demand	Bother	ADRB3	35	43
O=[N+]([O-])c1ccc([C@H](O)CNCCOC2CCCCCC2)cc1	ZINC000819079765	DF	On-Demand	Bother	ADRB1	28	43
O=[N+]([O-])c1ccc([C@H](O)CNCCOC2CCCCCC2)cc1	ZINC000819079765	DF	On-Demand	Bother	ADRB3	35	43
O=C(CNc1ccccc1C(F)F)Nc1ccc(N2CCOCC2)cc1	ZINC000819079808	FH	On-Demand	Anodyne	MTOR	68	38
O=C(CNc1ccccc1C(F)F)Nc1ccc(N2CCOCC2)cc1	ZINC000819079808	FH	On-Demand	Anodyne	EPHX2	17	41
O=C(CNc1ccccc1C(F)F)Nc1ccc(N2CCOCC2)cc1	ZINC000819079808	FH	On-Demand	Anodyne	PIK3CB	19	41
O=C(CNc1ccccc1C(F)F)Nc1ccc(N2CCOCC2)cc1	ZINC000819079808	FH	On-Demand	Anodyne	STAT6	72	39
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079811	GD	On-Demand	Anodyne	ADRB2	40	56
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079811	GD	On-Demand	Anodyne	ADRB1	72	56
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079811	GD	On-Demand	Anodyne	ADRB3	48	46
CC(=O)Nc1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079812	GD	On-Demand	Anodyne	ADRB2	40	56
CC(=O)Nc1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079812	GD	On-Demand	Anodyne	ADRB1	72	56
CC(=O)Nc1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079812	GD	On-Demand	Anodyne	ADRB3	48	46
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819079813	FD	On-Demand	Bother	ADRB2	21	42
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819079813	FD	On-Demand	Bother	ABCB1	19	44
CC(C)(C)OC(=O)N1CC(NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819079814	FD	On-Demand	Bother	ADRB2	21	42
CC(C)(C)OC(=O)N1CC(NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819079814	FD	On-Demand	Bother	ABCB1	19	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)CCc1ccc3c(c1)OCO3)C2	ZINC000819079819	GF	On-Demand	Anodyne	BMP1	64	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)CCc1ccc3c(c1)OCO3)C2	ZINC000819079819	GF	On-Demand	Anodyne	NOS2	81	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)CCc1ccc3c(c1)OCO3)C2	ZINC000819079820	GF	On-Demand	Anodyne	BMP1	64	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)CCc1ccc3c(c1)OCO3)C2	ZINC000819079820	GF	On-Demand	Anodyne	NOS2	81	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)CCc1ccc3c(c1)OCO3)C2	ZINC000819079821	GF	On-Demand	Anodyne	BMP1	64	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)CCc1ccc3c(c1)OCO3)C2	ZINC000819079821	GF	On-Demand	Anodyne	NOS2	81	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)CCc1ccc3c(c1)OCO3)C2	ZINC000819079822	GF	On-Demand	Anodyne	BMP1	64	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)CCc1ccc3c(c1)OCO3)C2	ZINC000819079822	GF	On-Demand	Anodyne	NOS2	81	36
CC(=O)c1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079825	FD	On-Demand	Anodyne	ADRB2	28	42
CC(=O)c1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079825	FD	On-Demand	Anodyne	ADRB1	39	41
CC(=O)c1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079825	FD	On-Demand	Anodyne	ADRB3	25	40
CC(=O)c1ccc(OC[C@@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079825	FD	On-Demand	Anodyne	GPR119	21	43
CC(=O)c1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079826	FD	On-Demand	Anodyne	ADRB2	28	42
CC(=O)c1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079826	FD	On-Demand	Anodyne	ADRB1	39	41
CC(=O)c1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079826	FD	On-Demand	Anodyne	ADRB3	25	40
CC(=O)c1ccc(OC[C@H](O)CNC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819079826	FD	On-Demand	Anodyne	GPR119	21	43
CCOc1ccccc1[C@@H](C)NC(=O)C(F)=C1CCC1	ZINC000819079833	CH	On-Demand	Anodyne	HCN1	61	38
CCOc1ccccc1[C@@H](C)NC(=O)C(F)=C1CCC1	ZINC000819079833	CH	On-Demand	Anodyne	HCN4	52	38
CCOc1ccccc1[C@H](C)NC(=O)C(F)=C1CCC1	ZINC000819079834	CH	On-Demand	Anodyne	HCN1	61	38
CCOc1ccccc1[C@H](C)NC(=O)C(F)=C1CCC1	ZINC000819079834	CH	On-Demand	Anodyne	HCN4	52	38
CC(C)(C)OC(=O)N1CC(NCCC(=O)Nc2cccc(F)c2)C1	ZINC000819079837	EE	On-Demand	Anodyne	CCR3	16	40
CC(C)(C)OC(=O)N1CC(NCCC(=O)Nc2cccc(F)c2)C1	ZINC000819079837	EE	On-Demand	Anodyne	GPR119	22	43
CC(C)(C)OC(=O)N1CC(NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819079863	FE	On-Demand	Anodyne	ADRB2	33	40
CC(C)(C)OC(=O)N1CC(NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819079863	FE	On-Demand	Anodyne	ADRB1	53	40
CC(C)(C)OC(=O)N1CC(NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819079863	FE	On-Demand	Anodyne	ADRB3	39	41
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819079864	FE	On-Demand	Anodyne	ADRB2	33	40
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819079864	FE	On-Demand	Anodyne	ADRB1	53	40
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819079864	FE	On-Demand	Anodyne	ADRB3	39	41
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079873	FE	On-Demand	Anodyne	ADRB2	34	52
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079873	FE	On-Demand	Anodyne	ADRB1	48	52
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079873	FE	On-Demand	Anodyne	ADRB3	34	42
COCCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079874	FE	On-Demand	Anodyne	ADRB2	34	52
COCCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079874	FE	On-Demand	Anodyne	ADRB1	48	52
COCCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079874	FE	On-Demand	Anodyne	ADRB3	34	42
COCCc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079875	FE	On-Demand	Anodyne	ADRB2	34	52
COCCc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079875	FE	On-Demand	Anodyne	ADRB1	48	52
COCCc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079875	FE	On-Demand	Anodyne	ADRB3	34	42
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079876	FE	On-Demand	Anodyne	ADRB2	34	52
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079876	FE	On-Demand	Anodyne	ADRB1	48	52
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079876	FE	On-Demand	Anodyne	ADRB3	34	42
CC(C)(C)OC(=O)N1CC(NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819079886	FD	On-Demand	Mild	ADRB1	52	42
CC(C)(C)OC(=O)N1CC(NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819079886	FD	On-Demand	Mild	GPR119	21	42
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819079887	FD	On-Demand	Mild	ADRB1	52	42
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819079887	FD	On-Demand	Mild	GPR119	21	42
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079913	FE	On-Demand	Anodyne	ADRB2	24	41
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079913	FE	On-Demand	Anodyne	ADRB3	17	45
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079915	FE	On-Demand	Anodyne	ADRB2	24	41
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079915	FE	On-Demand	Anodyne	ADRB3	17	45
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079917	FE	On-Demand	Anodyne	ADRB2	24	41
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079917	FE	On-Demand	Anodyne	ADRB3	17	45
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079920	FE	On-Demand	Anodyne	ADRB2	24	41
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819079920	FE	On-Demand	Anodyne	ADRB3	17	45
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1ccc(Br)cc1	ZINC000819079933	GF	On-Demand	Anodyne	ADRB2	30	42
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1ccc(Br)cc1	ZINC000819079933	GF	On-Demand	Anodyne	ADRB1	56	42
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1ccc(Br)cc1	ZINC000819079933	GF	On-Demand	Anodyne	ADRB3	53	42
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1ccc(Br)cc1	ZINC000819079933	GF	On-Demand	Anodyne	PAPA1_CARPA	29	44
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1ccc(Br)cc1	ZINC000819079935	GF	On-Demand	Anodyne	ADRB2	30	42
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1ccc(Br)cc1	ZINC000819079935	GF	On-Demand	Anodyne	ADRB1	56	42
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1ccc(Br)cc1	ZINC000819079935	GF	On-Demand	Anodyne	ADRB3	53	42
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1ccc(Br)cc1	ZINC000819079935	GF	On-Demand	Anodyne	PAPA1_CARPA	29	44
O[C@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccc(C(F)(F)F)cc1	ZINC000819079937	FI	On-Demand	Anodyne	HTR1D	21	46
O[C@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccc(C(F)(F)F)cc1	ZINC000819079937	FI	On-Demand	Anodyne	HTR1B	17	43
O[C@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccc(C(F)(F)F)cc1	ZINC000819079937	FI	On-Demand	Anodyne	SLC6A4	20	58
O[C@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccc(C(F)(F)F)cc1	ZINC000819079937	FI	On-Demand	Anodyne	ADRB3	15	49
O[C@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccc(C(F)(F)F)cc1	ZINC000819079937	FI	On-Demand	Anodyne	MPO	109	58
O[C@@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccc(C(F)(F)F)cc1	ZINC000819079939	FI	On-Demand	Anodyne	HTR1D	21	46
O[C@@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccc(C(F)(F)F)cc1	ZINC000819079939	FI	On-Demand	Anodyne	HTR1B	17	43
O[C@@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccc(C(F)(F)F)cc1	ZINC000819079939	FI	On-Demand	Anodyne	SLC6A4	20	58
O[C@@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccc(C(F)(F)F)cc1	ZINC000819079939	FI	On-Demand	Anodyne	ADRB3	15	49
O[C@@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccc(C(F)(F)F)cc1	ZINC000819079939	FI	On-Demand	Anodyne	MPO	109	58
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)ncc32)c1	ZINC000819079954	FE	On-Demand	Anodyne	ADRB2	23	42
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)ncc32)c1	ZINC000819079954	FE	On-Demand	Anodyne	ADRB3	18	44
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)ncc32)c1	ZINC000819079956	FE	On-Demand	Anodyne	ADRB2	23	42
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)ncc32)c1	ZINC000819079956	FE	On-Demand	Anodyne	ADRB3	18	44
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)ncc32)c1	ZINC000819079959	FE	On-Demand	Anodyne	ADRB2	23	42
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)ncc32)c1	ZINC000819079959	FE	On-Demand	Anodyne	ADRB3	18	44
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)ncc32)c1	ZINC000819079961	FE	On-Demand	Anodyne	ADRB2	23	42
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)ncc32)c1	ZINC000819079961	FE	On-Demand	Anodyne	ADRB3	18	44
O[C@@H](CNCCOC1CCCCCC1)c1cccnc1	ZINC000819079979	CE	On-Demand	Anodyne	ADRB2	36	50
O[C@@H](CNCCOC1CCCCCC1)c1cccnc1	ZINC000819079979	CE	On-Demand	Anodyne	ADRB1	54	55
O[C@@H](CNCCOC1CCCCCC1)c1cccnc1	ZINC000819079979	CE	On-Demand	Anodyne	ADRB3	119	55
O[C@H](CNCCOC1CCCCCC1)c1cccnc1	ZINC000819079980	CE	On-Demand	Anodyne	ADRB2	36	50
O[C@H](CNCCOC1CCCCCC1)c1cccnc1	ZINC000819079980	CE	On-Demand	Anodyne	ADRB1	54	55
O[C@H](CNCCOC1CCCCCC1)c1cccnc1	ZINC000819079980	CE	On-Demand	Anodyne	ADRB3	119	55
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819080005	GH	On-Demand	Anodyne	ADRB2	38	41
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819080005	GH	On-Demand	Anodyne	ADRB1	40	41
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819080005	GH	On-Demand	Anodyne	ADRB3	28	48
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819080011	GH	On-Demand	Anodyne	ADRB2	38	41
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819080011	GH	On-Demand	Anodyne	ADRB1	40	41
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819080011	GH	On-Demand	Anodyne	ADRB3	28	48
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819080012	GH	On-Demand	Anodyne	ADRB2	38	41
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819080012	GH	On-Demand	Anodyne	ADRB1	40	41
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819080012	GH	On-Demand	Anodyne	ADRB3	28	48
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819080013	GH	On-Demand	Anodyne	ADRB2	38	41
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819080013	GH	On-Demand	Anodyne	ADRB1	40	41
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819080013	GH	On-Demand	Anodyne	ADRB3	28	48
CN(C)CC[C@H](NC[C@@H](O)c1ccc(Cl)c(F)c1)C(C)(C)C	ZINC000819080030	EG	On-Demand	Anodyne	UTS2	42	33
CN(C)CC[C@H](NC[C@H](O)c1ccc(Cl)c(F)c1)C(C)(C)C	ZINC000819080040	EG	On-Demand	Anodyne	UTS2	42	33
CN(C)CC[C@@H](NC[C@@H](O)c1ccc(Cl)c(F)c1)C(C)(C)C	ZINC000819080042	EG	On-Demand	Anodyne	UTS2	42	33
CN(C)CC[C@@H](NC[C@H](O)c1ccc(Cl)c(F)c1)C(C)(C)C	ZINC000819080043	EG	On-Demand	Anodyne	UTS2	42	33
O=[N+]([O-])c1cccc([C@@H](O)CNCCOC2CCCCCC2)c1	ZINC000819080050	DF	On-Demand	Bother	ADRB1	52	46
O=[N+]([O-])c1cccc([C@@H](O)CNCCOC2CCCCCC2)c1	ZINC000819080050	DF	On-Demand	Bother	ADRB3	53	46
O=[N+]([O-])c1cccc([C@@H](O)CNCCOC2CCCCCC2)c1	ZINC000819080050	DF	On-Demand	Bother	CACNA1D	42	32
O=[N+]([O-])c1cccc([C@H](O)CNCCOC2CCCCCC2)c1	ZINC000819080051	DF	On-Demand	Bother	ADRB1	52	46
O=[N+]([O-])c1cccc([C@H](O)CNCCOC2CCCCCC2)c1	ZINC000819080051	DF	On-Demand	Bother	ADRB3	53	46
O=[N+]([O-])c1cccc([C@H](O)CNCCOC2CCCCCC2)c1	ZINC000819080051	DF	On-Demand	Bother	CACNA1D	42	32
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819080056	FG	On-Demand	Anodyne	ADRB2	19	46
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819080056	FG	On-Demand	Anodyne	HTR1A	22	60
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819080056	FG	On-Demand	Anodyne	HTR1D	30	46
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819080056	FG	On-Demand	Anodyne	SLC6A4	25	60
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819080056	FG	On-Demand	Anodyne	MPO	105	55
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819080056	FG	On-Demand	Anodyne	HTR1E	15	40
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819080056	FG	On-Demand	Anodyne	MTNR1A	27	50
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819080056	FG	On-Demand	Anodyne	MTNR1B	18	50
N#Cc1ccc([C@@H](O)CNCc2ccccc2OC2CCC2)cc1	ZINC000819080083	DG	On-Demand	Mild	ADRB3	19	40
N#Cc1ccc([C@H](O)CNCc2ccccc2OC2CCC2)cc1	ZINC000819080084	DG	On-Demand	Mild	ADRB3	19	40
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNC[C@H](O)c1ccccc1F	ZINC000819080087	GD	On-Demand	Bother	COLA	55	35
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNC[C@@H](O)c1ccccc1F	ZINC000819080088	GD	On-Demand	Bother	COLA	55	35
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819080095	FE	On-Demand	Bother	ADRB2	18	40
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819080096	FE	On-Demand	Bother	ADRB2	18	40
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819080097	FE	On-Demand	Bother	ADRB2	18	40
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819080098	FE	On-Demand	Bother	ADRB2	18	40
O[C@H](CNCCc1c[nH]c2ccc(F)cc12)c1cccc(C(F)(F)F)c1	ZINC000819080107	FI	On-Demand	Anodyne	HTR1D	22	41
O[C@H](CNCCc1c[nH]c2ccc(F)cc12)c1cccc(C(F)(F)F)c1	ZINC000819080107	FI	On-Demand	Anodyne	SLC6A4	20	55
O[C@H](CNCCc1c[nH]c2ccc(F)cc12)c1cccc(C(F)(F)F)c1	ZINC000819080107	FI	On-Demand	Anodyne	ADRB3	37	57
O[C@H](CNCCc1c[nH]c2ccc(F)cc12)c1cccc(C(F)(F)F)c1	ZINC000819080107	FI	On-Demand	Anodyne	MPO	104	55
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819080109	FE	On-Demand	Anodyne	ADRB2	25	43
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819080109	FE	On-Demand	Anodyne	ADRB1	35	41
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819080109	FE	On-Demand	Anodyne	ADRB3	67	45
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819080109	FE	On-Demand	Anodyne	PTPN2	45	41
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819080109	FE	On-Demand	Anodyne	SIGMAR1	18	53
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819080109	FE	On-Demand	Anodyne	PTPN1	36	41
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819080110	FE	On-Demand	Anodyne	ADRB2	25	43
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819080110	FE	On-Demand	Anodyne	ADRB1	35	41
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819080110	FE	On-Demand	Anodyne	ADRB3	67	45
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819080110	FE	On-Demand	Anodyne	PTPN2	45	41
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819080110	FE	On-Demand	Anodyne	SIGMAR1	18	53
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819080110	FE	On-Demand	Anodyne	PTPN1	36	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1cccc2ccccc12	ZINC000819080116	GG	On-Demand	Anodyne	DRD4	33	47
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1cccc2ccccc12	ZINC000819080116	GG	On-Demand	Anodyne	SORD	41	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1cccc(F)c1	ZINC000819080148	FE	On-Demand	Anodyne	DRD4	29	47
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1cccc(F)c1	ZINC000819080148	FE	On-Demand	Anodyne	P2RX3	20	43
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1cccc(F)c1	ZINC000819080151	FE	On-Demand	Anodyne	DRD4	29	47
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1cccc(F)c1	ZINC000819080151	FE	On-Demand	Anodyne	P2RX3	20	43
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819080156	GD	On-Demand	Anodyne	ADRB2	41	42
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819080156	GD	On-Demand	Anodyne	ADRB1	35	42
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819080156	GD	On-Demand	Anodyne	ADRB3	55	42
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819080157	GD	On-Demand	Anodyne	ADRB2	41	42
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819080157	GD	On-Demand	Anodyne	ADRB1	35	42
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819080157	GD	On-Demand	Anodyne	ADRB3	55	42
C=CCC1(C(=O)N(CC)Cc2ccc(C(F)(F)F)cc2)CCOCC1	ZINC000819080160	FI	On-Demand	Mild	PLA2G7	41	31
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccc(F)cc1F	ZINC000819080161	GE	On-Demand	Anodyne	DRD4	32	48
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccc(F)cc1F	ZINC000819080161	GE	On-Demand	Anodyne	P2RX3	22	42
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1ccc(F)cc1F	ZINC000819080162	GE	On-Demand	Anodyne	DRD4	32	48
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1ccc(F)cc1F	ZINC000819080162	GE	On-Demand	Anodyne	P2RX3	22	42
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)C2CC2)CC1	ZINC000819080165	ED	On-Demand	Anodyne	PTPN2	43	39
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)C2CC2)CC1	ZINC000819080165	ED	On-Demand	Anodyne	SIGMAR1	17	53
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)C2CC2)CC1	ZINC000819080166	ED	On-Demand	Anodyne	PTPN2	43	39
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)C2CC2)CC1	ZINC000819080166	ED	On-Demand	Anodyne	SIGMAR1	17	53
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819080173	FD	On-Demand	Mild	DRD4	26	43
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819080174	FD	On-Demand	Mild	DRD4	26	43
C=CCCn1cc(C(=O)N(CC)Cc2ccc(C(F)(F)F)cc2)nn1	ZINC000819080186	FH	On-Demand	Mild	PLA2G7	46	41
CC(C)(C)OC(=O)N1CC(NC[C@H](O)c2ccc(F)c(Br)c2)C1	ZINC000819080216	GF	On-Demand	Anodyne	GPR119	28	41
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)c2ccc(F)c(Br)c2)C1	ZINC000819080217	GF	On-Demand	Anodyne	GPR119	28	41
CCCOc1ccc([C@H](C)NC(=O)/C=C/[C@@H]2CCCO2)cc1	ZINC000819080218	DG	On-Demand	Anodyne	ACACA	24	51
CCCOc1ccc([C@H](C)NC(=O)/C=C/[C@@H]2CCCO2)cc1	ZINC000819080218	DG	On-Demand	Anodyne	ACACB	24	51
CCCOc1ccc([C@H](C)NC(=O)/C=C\[C@@H]2CCCO2)cc1	ZINC000819080219	DG	On-Demand	Anodyne	ACACA	24	51
CCCOc1ccc([C@H](C)NC(=O)/C=C\[C@@H]2CCCO2)cc1	ZINC000819080219	DG	On-Demand	Anodyne	ACACB	24	51
CCCOc1ccc([C@H](C)NC(=O)/C=C/[C@H]2CCCO2)cc1	ZINC000819080220	DG	On-Demand	Anodyne	ACACA	24	51
CCCOc1ccc([C@H](C)NC(=O)/C=C/[C@H]2CCCO2)cc1	ZINC000819080220	DG	On-Demand	Anodyne	ACACB	24	51
CCCOc1ccc([C@H](C)NC(=O)/C=C\[C@H]2CCCO2)cc1	ZINC000819080221	DG	On-Demand	Anodyne	ACACA	24	51
CCCOc1ccc([C@H](C)NC(=O)/C=C\[C@H]2CCCO2)cc1	ZINC000819080221	DG	On-Demand	Anodyne	ACACB	24	51
COc1ccc(OC)c([C@H](O)CNCCc2ccc(C)cc2)c1	ZINC000819080246	DF	On-Demand	Anodyne	ADRB2	75	61
COc1ccc(OC)c([C@H](O)CNCCc2ccc(C)cc2)c1	ZINC000819080246	DF	On-Demand	Anodyne	ADRB1	89	45
COc1ccc(OC)c([C@H](O)CNCCc2ccc(C)cc2)c1	ZINC000819080246	DF	On-Demand	Anodyne	ADRB3	82	47
CC(C)(C)OC(=O)N1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819080256	FE	On-Demand	Anodyne	ADRB2	24	64
CC(C)(C)OC(=O)N1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819080256	FE	On-Demand	Anodyne	ADRB1	30	64
CC(C)(C)OC(=O)N1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819080256	FE	On-Demand	Anodyne	SLC6A4	15	40
CC(C)(C)OC(=O)N1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819080256	FE	On-Demand	Anodyne	ADRB3	17	57
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819080257	FE	On-Demand	Anodyne	ADRB2	24	64
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819080257	FE	On-Demand	Anodyne	ADRB1	30	64
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819080257	FE	On-Demand	Anodyne	SLC6A4	15	40
CC(C)(C)OC(=O)N1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819080257	FE	On-Demand	Anodyne	ADRB3	17	57
O[C@@H](CNCCOC1CCCCCC1)c1ccc(F)c(F)c1	ZINC000819080315	DG	On-Demand	Anodyne	ADRB1	40	42
O[C@@H](CNCCOC1CCCCCC1)c1ccc(F)c(F)c1	ZINC000819080315	DG	On-Demand	Anodyne	ADRB3	34	42
O[C@H](CNCCOC1CCCCCC1)c1ccc(F)c(F)c1	ZINC000819080316	DG	On-Demand	Anodyne	ADRB1	40	42
O[C@H](CNCCOC1CCCCCC1)c1ccc(F)c(F)c1	ZINC000819080316	DG	On-Demand	Anodyne	ADRB3	34	42
C#CCNC(=O)CCNC1CCN(C(=O)c2ccc(OC)c(OC)c2)CC1	ZINC000819080327	FD	On-Demand	Mild	L3MBTL3	56	34
O[C@@H](CNCCOC1CCCCCC1)c1ccc(F)cc1F	ZINC000819080332	DG	On-Demand	Anodyne	ADRB1	24	41
O[C@H](CNCCOC1CCCCCC1)c1ccc(F)cc1F	ZINC000819080333	DG	On-Demand	Anodyne	ADRB1	24	41
C[C@@](O)(CNCCCNc1ccccn1)c1ccc(Br)cc1F	ZINC000819080347	GG	On-Demand	Anodyne	METG	45	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(C(=O)c2cccc(F)c2)CC1	ZINC000819080357	GE	On-Demand	Anodyne	NPY2R	15	47
O[C@@H](CNCCc1c[nH]c2ccc(F)cc12)c1cccc(C(F)(F)F)c1	ZINC000819080358	FI	On-Demand	Anodyne	HTR1D	22	41
O[C@@H](CNCCc1c[nH]c2ccc(F)cc12)c1cccc(C(F)(F)F)c1	ZINC000819080358	FI	On-Demand	Anodyne	SLC6A4	20	55
O[C@@H](CNCCc1c[nH]c2ccc(F)cc12)c1cccc(C(F)(F)F)c1	ZINC000819080358	FI	On-Demand	Anodyne	ADRB3	37	57
O[C@@H](CNCCc1c[nH]c2ccc(F)cc12)c1cccc(C(F)(F)F)c1	ZINC000819080358	FI	On-Demand	Anodyne	MPO	104	55
CCOC(=O)N1CCN(C(=O)CNc2ccc(Cl)cc2COC)CC1	ZINC000819080394	FE	On-Demand	Anodyne	P2RY12	45	40
CCOC(=O)N1CCN(C(=O)CNc2ccc(Cl)cc2COC)CC1	ZINC000819080394	FE	On-Demand	Anodyne	FDFT1	15	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819080395	GE	On-Demand	Anodyne	DRD4	29	45
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819080398	GE	On-Demand	Anodyne	DRD4	29	45
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819080408	FF	On-Demand	Anodyne	ADRB2	18	60
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819080408	FF	On-Demand	Anodyne	ADRB1	24	53
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819080408	FF	On-Demand	Anodyne	HTR1A	15	60
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819080408	FF	On-Demand	Anodyne	SLC6A4	18	40
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819080410	FF	On-Demand	Anodyne	ADRB2	18	60
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819080410	FF	On-Demand	Anodyne	ADRB1	24	53
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819080410	FF	On-Demand	Anodyne	HTR1A	15	60
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819080410	FF	On-Demand	Anodyne	SLC6A4	18	40
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819080411	FF	On-Demand	Anodyne	ADRB2	18	60
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819080411	FF	On-Demand	Anodyne	ADRB1	24	53
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819080411	FF	On-Demand	Anodyne	HTR1A	15	60
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819080411	FF	On-Demand	Anodyne	SLC6A4	18	40
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819080413	FF	On-Demand	Anodyne	ADRB2	18	60
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819080413	FF	On-Demand	Anodyne	ADRB1	24	53
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819080413	FF	On-Demand	Anodyne	HTR1A	15	60
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819080413	FF	On-Demand	Anodyne	SLC6A4	18	40
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819080418	FG	On-Demand	Anodyne	ADRB2	23	40
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819080419	FG	On-Demand	Anodyne	ADRB2	23	40
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819080421	FG	On-Demand	Anodyne	ADRB2	23	40
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819080423	FG	On-Demand	Anodyne	ADRB2	23	40
O[C@@H](CNCCCc1ccc(Br)cc1F)c1cccnc1	ZINC000819080424	FG	On-Demand	Anodyne	ADRB2	33	45
O[C@@H](CNCCCc1ccc(Br)cc1F)c1cccnc1	ZINC000819080424	FG	On-Demand	Anodyne	ADRB1	35	49
O[C@@H](CNCCCc1ccc(Br)cc1F)c1cccnc1	ZINC000819080424	FG	On-Demand	Anodyne	ADRB3	111	52
O[C@H](CNCCCc1ccc(Br)cc1F)c1cccnc1	ZINC000819080426	FG	On-Demand	Anodyne	ADRB2	33	45
O[C@H](CNCCCc1ccc(Br)cc1F)c1cccnc1	ZINC000819080426	FG	On-Demand	Anodyne	ADRB1	35	49
O[C@H](CNCCCc1ccc(Br)cc1F)c1cccnc1	ZINC000819080426	FG	On-Demand	Anodyne	ADRB3	111	52
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cc(Br)ccc1F)C2	ZINC000819080427	GG	On-Demand	Anodyne	P2RX7	39	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cc(Br)ccc1F)C2	ZINC000819080429	GG	On-Demand	Anodyne	P2RX7	39	43
CCN(Cc1ccc(C)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819080443	FH	On-Demand	Mild	CTSB	26	40
CCN(Cc1ccc(C)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819080443	FH	On-Demand	Mild	PAPA1_CARPA	51	45
CCN(Cc1ccc(C)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819080444	FH	On-Demand	Mild	CTSB	26	40
CCN(Cc1ccc(C)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819080444	FH	On-Demand	Mild	PAPA1_CARPA	51	45
CCN(Cc1ccc(C)cc1)C(=O)C(F)=C1CCC1	ZINC000819080448	CH	On-Demand	Anodyne	TSPO	16	41
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819080476	FE	On-Demand	Mild	ADRB1	25	40
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819080476	FE	On-Demand	Mild	ADRB3	15	42
C[C@@H](Cc1cccc(F)c1)NC[C@H](O)Cc1ccc(F)cc1	ZINC000819080478	DG	On-Demand	Anodyne	ADRB1	26	44
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819080479	FE	On-Demand	Mild	ADRB1	25	40
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819080479	FE	On-Demand	Mild	ADRB3	15	42
C[C@@H](Cc1cccc(F)c1)NC[C@@H](O)Cc1ccc(F)cc1	ZINC000819080480	DG	On-Demand	Anodyne	ADRB1	26	44
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819080481	FE	On-Demand	Mild	ADRB1	25	40
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819080481	FE	On-Demand	Mild	ADRB3	15	42
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1cccnc1	ZINC000819080482	ED	On-Demand	Anodyne	ADRB1	20	47
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1cccnc1	ZINC000819080482	ED	On-Demand	Anodyne	DRD4	28	45
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1cccnc1	ZINC000819080482	ED	On-Demand	Anodyne	ADRB3	45	47
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819080484	FE	On-Demand	Mild	ADRB1	25	40
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819080484	FE	On-Demand	Mild	ADRB3	15	42
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1cccnc1	ZINC000819080485	ED	On-Demand	Anodyne	ADRB1	20	47
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1cccnc1	ZINC000819080485	ED	On-Demand	Anodyne	DRD4	28	45
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1cccnc1	ZINC000819080485	ED	On-Demand	Anodyne	ADRB3	45	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCCc3cc(OC)ccc31)C2	ZINC000819080514	FG	On-Demand	Anodyne	BDKRB1	46	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCCc3cc(OC)ccc31)C2	ZINC000819080517	FG	On-Demand	Anodyne	BDKRB1	46	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCCc3cc(OC)ccc31)C2	ZINC000819080519	FG	On-Demand	Anodyne	BDKRB1	46	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCCc3cc(OC)ccc31)C2	ZINC000819080520	FG	On-Demand	Anodyne	BDKRB1	46	42
CC(C)c1ccc(CCCNC[C@H](O)c2cccnc2)cc1	ZINC000819080545	CG	On-Demand	Anodyne	ADRB2	71	55
CC(C)c1ccc(CCCNC[C@H](O)c2cccnc2)cc1	ZINC000819080545	CG	On-Demand	Anodyne	ADRB1	73	50
CC(C)c1ccc(CCCNC[C@H](O)c2cccnc2)cc1	ZINC000819080545	CG	On-Demand	Anodyne	ADRB3	166	66
CC(C)c1ccc(CCCNC[C@H](O)c2cccnc2)cc1	ZINC000819080545	CG	On-Demand	Anodyne	KCNA5	16	41
CC(C)c1ccc(CCCNC[C@H](O)c2cccnc2)cc1	ZINC000819080545	CG	On-Demand	Anodyne	CYP51A1	17	41
CC(C)c1ccc(CCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819080547	CG	On-Demand	Anodyne	ADRB2	71	55
CC(C)c1ccc(CCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819080547	CG	On-Demand	Anodyne	ADRB1	73	50
CC(C)c1ccc(CCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819080547	CG	On-Demand	Anodyne	ADRB3	166	66
CC(C)c1ccc(CCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819080547	CG	On-Demand	Anodyne	KCNA5	16	41
CC(C)c1ccc(CCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819080547	CG	On-Demand	Anodyne	CYP51A1	17	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCOC2CCCCCC2)CC1	ZINC000819080654	GG	On-Demand	Anodyne	GPR119	28	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCOC2CCCCCC2)CC1	ZINC000819080655	GG	On-Demand	Anodyne	GPR119	28	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819080685	FF	On-Demand	Anodyne	ADRB1	28	45
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819080685	FF	On-Demand	Anodyne	DRD4	30	47
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819080685	FF	On-Demand	Anodyne	ADRB3	44	45
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819080691	FF	On-Demand	Anodyne	ADRB1	28	45
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819080691	FF	On-Demand	Anodyne	DRD4	30	47
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819080691	FF	On-Demand	Anodyne	ADRB3	44	45
CCOC(=O)C1=C(CNc2ccc(Cl)cc2COC)NC(=O)N[C@H]1C	ZINC000819080706	FE	On-Demand	Anodyne	CACNA1C	46	38
CCOC(=O)C1=C(CNc2ccc(Cl)cc2COC)NC(=O)N[C@H]1C	ZINC000819080706	FE	On-Demand	Anodyne	CACNA1D	62	38
CCOC(=O)C1=C(CNc2ccc(Cl)cc2COC)NC(=O)N[C@@H]1C	ZINC000819080707	FE	On-Demand	Anodyne	CACNA1C	46	38
CCOC(=O)C1=C(CNc2ccc(Cl)cc2COC)NC(=O)N[C@@H]1C	ZINC000819080707	FE	On-Demand	Anodyne	CACNA1D	62	38
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819080719	GD	On-Demand	Anodyne	ADRB2	33	41
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819080719	GD	On-Demand	Anodyne	ADRB1	34	41
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819080719	GD	On-Demand	Anodyne	ADRB3	61	43
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccc(F)c(F)c2)CC1	ZINC000819080720	FD	On-Demand	Anodyne	L3MBTL3	69	38
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819080722	GD	On-Demand	Anodyne	ADRB2	33	41
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819080722	GD	On-Demand	Anodyne	ADRB1	34	41
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819080722	GD	On-Demand	Anodyne	ADRB3	61	43
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(F)c(F)c2)CC1	ZINC000819080726	FD	On-Demand	Anodyne	L3MBTL3	69	38
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccc(F)c(F)c2)CC1	ZINC000819080729	FD	On-Demand	Anodyne	L3MBTL3	69	38
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(F)c(F)c2)CC1	ZINC000819080731	FD	On-Demand	Anodyne	L3MBTL3	69	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1c(Cl)cccc1Cl)C2	ZINC000819080743	FG	On-Demand	Anodyne	P2RX7	56	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1c(Cl)cccc1Cl)C2	ZINC000819080745	FG	On-Demand	Anodyne	P2RX7	56	47
CN1CCC[C@H](CNC[C@H](O)c2cccnc2)[C@@H]1c1ccc(C(F)(F)F)cc1	ZINC000819080752	GH	On-Demand	Anodyne	ADRB3	70	39
CN1CCC[C@H](CNC[C@@H](O)c2cccnc2)[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000819080755	GH	On-Demand	Anodyne	ADRB3	70	39
CN1CCC[C@H](CNC[C@@H](O)c2cccnc2)[C@@H]1c1ccc(C(F)(F)F)cc1	ZINC000819080757	GH	On-Demand	Anodyne	ADRB3	70	39
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(Br)cc2)c1	ZINC000819080759	FG	On-Demand	Bother	ADRB2	62	54
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(Br)cc2)c1	ZINC000819080759	FG	On-Demand	Bother	ADRB1	70	48
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(Br)cc2)c1	ZINC000819080759	FG	On-Demand	Bother	ADRB3	142	49
CN1CCC[C@H](CNC[C@H](O)c2cccnc2)[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000819080760	GH	On-Demand	Anodyne	ADRB3	70	39
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(Br)cc2)c1	ZINC000819080761	FG	On-Demand	Bother	ADRB2	62	54
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(Br)cc2)c1	ZINC000819080761	FG	On-Demand	Bother	ADRB1	70	48
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(Br)cc2)c1	ZINC000819080761	FG	On-Demand	Bother	ADRB3	142	49
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2ccc(F)cn2)CC1	ZINC000819080764	GD	On-Demand	Anodyne	PTPN2	44	39
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2ccc(F)cn2)CC1	ZINC000819080766	GD	On-Demand	Anodyne	PTPN2	44	39
Cc1cc(F)ccc1[C@@H](O)CNCCOC1CCCCCC1	ZINC000819080768	DG	On-Demand	Anodyne	ADRB1	24	40
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccc(Br)cc1	ZINC000819080780	GF	On-Demand	Anodyne	ADRB2	23	40
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccc(Br)cc1	ZINC000819080783	GF	On-Demand	Anodyne	ADRB2	23	40
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccc(Br)cc1	ZINC000819080786	GF	On-Demand	Anodyne	ADRB2	23	40
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccc(Br)cc1	ZINC000819080789	GF	On-Demand	Anodyne	ADRB2	23	40
CN(C)CC[C@H](NC[C@@H](O)c1cccc(Cl)c1)C(C)(C)C	ZINC000819080797	DG	On-Demand	Anodyne	ADRB1	27	46
CN(C)CC[C@H](NC[C@@H](O)c1cccc(Cl)c1)C(C)(C)C	ZINC000819080797	DG	On-Demand	Anodyne	ADRB3	40	46
CN(C)CC[C@H](NC[C@@H](O)c1cccc(Cl)c1)C(C)(C)C	ZINC000819080797	DG	On-Demand	Anodyne	UTS2	45	35
CN(C)CC[C@H](NC[C@H](O)c1cccc(Cl)c1)C(C)(C)C	ZINC000819080798	DG	On-Demand	Anodyne	ADRB1	27	46
CN(C)CC[C@H](NC[C@H](O)c1cccc(Cl)c1)C(C)(C)C	ZINC000819080798	DG	On-Demand	Anodyne	ADRB3	40	46
CN(C)CC[C@H](NC[C@H](O)c1cccc(Cl)c1)C(C)(C)C	ZINC000819080798	DG	On-Demand	Anodyne	UTS2	45	35
CN(C)CC[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C(C)(C)C	ZINC000819080800	DG	On-Demand	Anodyne	ADRB1	27	46
CN(C)CC[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C(C)(C)C	ZINC000819080800	DG	On-Demand	Anodyne	ADRB3	40	46
CN(C)CC[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C(C)(C)C	ZINC000819080800	DG	On-Demand	Anodyne	UTS2	45	35
CN(C)CC[C@@H](NC[C@H](O)c1cccc(Cl)c1)C(C)(C)C	ZINC000819080802	DG	On-Demand	Anodyne	ADRB1	27	46
CN(C)CC[C@@H](NC[C@H](O)c1cccc(Cl)c1)C(C)(C)C	ZINC000819080802	DG	On-Demand	Anodyne	ADRB3	40	46
CN(C)CC[C@@H](NC[C@H](O)c1cccc(Cl)c1)C(C)(C)C	ZINC000819080802	DG	On-Demand	Anodyne	UTS2	45	35
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccccc1C	ZINC000819080813	EF	On-Demand	Anodyne	ADRB2	29	48
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccccc1C	ZINC000819080816	EF	On-Demand	Anodyne	ADRB2	29	48
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccccc1C	ZINC000819080821	EF	On-Demand	Anodyne	ADRB2	29	48
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccccc1C	ZINC000819080824	EF	On-Demand	Anodyne	ADRB2	29	48
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	ZINC000819080837	JG	On-Demand	Anodyne	PREP	20	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2CCc3ccccc3C2)CC1	ZINC000819080864	GG	On-Demand	Anodyne	GRIN2B	16	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2CCc3ccccc3C2)CC1	ZINC000819080864	GG	On-Demand	Anodyne	PREP	28	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2CCc3ccccc3C2)CC1	ZINC000819080864	GG	On-Demand	Anodyne	GPR119	46	48
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2CCc3ccccc3C2)CC1	ZINC000819080866	GG	On-Demand	Anodyne	GRIN2B	16	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2CCc3ccccc3C2)CC1	ZINC000819080866	GG	On-Demand	Anodyne	PREP	28	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2CCc3ccccc3C2)CC1	ZINC000819080866	GG	On-Demand	Anodyne	GPR119	46	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H]2CCc3ccccc3C2)CC1	ZINC000819080868	GG	On-Demand	Anodyne	GRIN2B	16	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H]2CCc3ccccc3C2)CC1	ZINC000819080868	GG	On-Demand	Anodyne	PREP	28	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H]2CCc3ccccc3C2)CC1	ZINC000819080868	GG	On-Demand	Anodyne	GPR119	46	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H]2CCc3ccccc3C2)CC1	ZINC000819080871	GG	On-Demand	Anodyne	GRIN2B	16	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H]2CCc3ccccc3C2)CC1	ZINC000819080871	GG	On-Demand	Anodyne	PREP	28	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H]2CCc3ccccc3C2)CC1	ZINC000819080871	GG	On-Demand	Anodyne	GPR119	46	48
CON(C)C(=O)CCNCCc1c[nH]c2ccc(F)cc12	ZINC000819080872	CD	On-Demand	Anodyne	HTR1A	27	56
CON(C)C(=O)CCNCCc1c[nH]c2ccc(F)cc12	ZINC000819080872	CD	On-Demand	Anodyne	HTR1D	58	45
CON(C)C(=O)CCNCCc1c[nH]c2ccc(F)cc12	ZINC000819080872	CD	On-Demand	Anodyne	HTR1B	40	45
CON(C)C(=O)CCNCCc1c[nH]c2ccc(F)cc12	ZINC000819080872	CD	On-Demand	Anodyne	SLC6A4	29	61
CON(C)C(=O)CCNCCc1c[nH]c2ccc(F)cc12	ZINC000819080872	CD	On-Demand	Anodyne	MPO	121	61
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819080874	FD	On-Demand	Anodyne	ADRB2	31	43
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819080874	FD	On-Demand	Anodyne	ADRB1	40	36
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819080874	FD	On-Demand	Anodyne	ADRB3	25	45
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819080877	FD	On-Demand	Anodyne	ADRB2	31	43
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819080877	FD	On-Demand	Anodyne	ADRB1	40	36
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819080877	FD	On-Demand	Anodyne	ADRB3	25	45
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819080879	FD	On-Demand	Anodyne	ADRB2	31	43
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819080879	FD	On-Demand	Anodyne	ADRB1	40	36
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819080879	FD	On-Demand	Anodyne	ADRB3	25	45
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819080881	FD	On-Demand	Anodyne	ADRB2	31	43
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819080881	FD	On-Demand	Anodyne	ADRB1	40	36
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819080881	FD	On-Demand	Anodyne	ADRB3	25	45
Cc1ccccc1[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819080884	DG	On-Demand	Anodyne	ADRB2	18	40
Cc1ccccc1[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819080884	DG	On-Demand	Anodyne	HTR1A	21	49
Cc1ccccc1[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819080884	DG	On-Demand	Anodyne	HTR1D	47	41
Cc1ccccc1[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819080884	DG	On-Demand	Anodyne	HTR1B	38	41
Cc1ccccc1[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819080884	DG	On-Demand	Anodyne	SLC6A4	28	58
Cc1ccccc1[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819080884	DG	On-Demand	Anodyne	MPO	115	59
O[C@@H](CNCCOC1CCCCCC1)c1ccc(F)cn1	ZINC000819080892	CF	On-Demand	Anodyne	ADRB1	19	43
O[C@H](CNCCOC1CCCCCC1)c1ccc(F)cn1	ZINC000819080896	CF	On-Demand	Anodyne	ADRB1	19	43
COc1cc(F)ccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819080898	FG	On-Demand	Mild	PAPA1_CARPA	45	51
CCN(Cc1ccccc1C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819080899	FH	On-Demand	Mild	PAPA1_CARPA	56	46
CCN(Cc1ccccc1C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819080899	FH	On-Demand	Mild	CTSK	24	40
CCN(Cc1ccccc1C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819080899	FH	On-Demand	Mild	CTSL	15	46
CCN(Cc1ccccc1C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819080899	FH	On-Demand	Mild	FPR1	44	37
COc1cc(F)ccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819080900	FG	On-Demand	Mild	PAPA1_CARPA	45	51
CCN(Cc1ccccc1C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819080902	FH	On-Demand	Mild	PAPA1_CARPA	56	46
CCN(Cc1ccccc1C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819080902	FH	On-Demand	Mild	CTSK	24	40
CCN(Cc1ccccc1C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819080902	FH	On-Demand	Mild	CTSL	15	46
CCN(Cc1ccccc1C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819080902	FH	On-Demand	Mild	FPR1	44	37
C#CCNC(=O)CCNCc1ccc(-c2cccc(C)c2)cc1	ZINC000819080942	DF	On-Demand	Mild	SUCNR1	24	45
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080953	GF	On-Demand	Anodyne	ITGAL	43	32
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080953	GF	On-Demand	Anodyne	SLC9A1	21	43
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080953	GF	On-Demand	Anodyne	EPHX2	19	48
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080953	GF	On-Demand	Anodyne	MLYCD	19	44
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080953	GF	On-Demand	Anodyne	L3MBTL3	65	40
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080954	GF	On-Demand	Anodyne	ITGAL	43	32
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080954	GF	On-Demand	Anodyne	SLC9A1	21	43
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080954	GF	On-Demand	Anodyne	EPHX2	19	48
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080954	GF	On-Demand	Anodyne	MLYCD	19	44
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080954	GF	On-Demand	Anodyne	L3MBTL3	65	40
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080955	GF	On-Demand	Anodyne	ITGAL	43	32
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080955	GF	On-Demand	Anodyne	SLC9A1	21	43
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080955	GF	On-Demand	Anodyne	EPHX2	19	48
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080955	GF	On-Demand	Anodyne	MLYCD	19	44
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080955	GF	On-Demand	Anodyne	L3MBTL3	65	40
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080956	GF	On-Demand	Anodyne	ITGAL	43	32
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080956	GF	On-Demand	Anodyne	SLC9A1	21	43
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080956	GF	On-Demand	Anodyne	EPHX2	19	48
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080956	GF	On-Demand	Anodyne	MLYCD	19	44
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819080956	GF	On-Demand	Anodyne	L3MBTL3	65	40
COc1ccc(C(=O)N2CCC(NC[C@H](O)C3CC3)CC2)cc1OC	ZINC000819080961	ED	On-Demand	Anodyne	ENPP1	55	31
COc1ccc(C(=O)N2CCC(NC[C@H](O)C3CC3)CC2)cc1OC	ZINC000819080961	ED	On-Demand	Anodyne	L3MBTL3	65	35
COc1ccc(C(=O)N2CCC(NC[C@@H](O)C3CC3)CC2)cc1OC	ZINC000819080962	ED	On-Demand	Anodyne	ENPP1	55	31
COc1ccc(C(=O)N2CCC(NC[C@@H](O)C3CC3)CC2)cc1OC	ZINC000819080962	ED	On-Demand	Anodyne	L3MBTL3	65	35
O[C@@H](CNCCCNc1ccccn1)c1cccc(Cl)c1	ZINC000819080967	DF	On-Demand	Anodyne	ADRB2	54	38
O[C@@H](CNCCCNc1ccccn1)c1cccc(Cl)c1	ZINC000819080967	DF	On-Demand	Anodyne	ADRB1	59	45
O[C@@H](CNCCCNc1ccccn1)c1cccc(Cl)c1	ZINC000819080967	DF	On-Demand	Anodyne	ADRB3	66	47
O[C@H](CNCCCNc1ccccn1)c1cccc(Cl)c1	ZINC000819080968	DF	On-Demand	Anodyne	ADRB2	54	38
O[C@H](CNCCCNc1ccccn1)c1cccc(Cl)c1	ZINC000819080968	DF	On-Demand	Anodyne	ADRB1	59	45
O[C@H](CNCCCNc1ccccn1)c1cccc(Cl)c1	ZINC000819080968	DF	On-Demand	Anodyne	ADRB3	66	47
O[C@H](CNCc1ccccc1OC1CCC1)c1ccc(F)cc1	ZINC000819081024	DH	On-Demand	Anodyne	SLC6A3	22	42
O[C@H](CNCc1ccccc1OC1CCC1)c1ccc(F)cc1	ZINC000819081024	DH	On-Demand	Anodyne	ADRB3	21	42
O[C@@H](CNCc1ccccc1OC1CCC1)c1ccc(F)cc1	ZINC000819081026	DH	On-Demand	Anodyne	SLC6A3	22	42
O[C@@H](CNCc1ccccc1OC1CCC1)c1ccc(F)cc1	ZINC000819081026	DH	On-Demand	Anodyne	ADRB3	21	42
COc1ccc(C(=O)N2CCC(NCCC(=O)N(C)OC)CC2)cc1OC	ZINC000819081028	GD	On-Demand	Anodyne	L3MBTL3	51	34
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccccc2Cl)c1	ZINC000819081066	GE	On-Demand	Anodyne	ADRB1	28	41
Cc1ccccc1[C@@H](O)CN[C@@H](C)CN1CCN(c2ccccn2)CC1	ZINC000819081098	FE	On-Demand	Anodyne	DRD4	30	48
Cc1ccccc1[C@@H](O)CN[C@@H](C)CN1CCN(c2ccccn2)CC1	ZINC000819081098	FE	On-Demand	Anodyne	EBP	24	41
Cc1ccccc1[C@@H](O)CN[C@H](C)CN1CCN(c2ccccn2)CC1	ZINC000819081099	FE	On-Demand	Anodyne	DRD4	30	48
Cc1ccccc1[C@@H](O)CN[C@H](C)CN1CCN(c2ccccn2)CC1	ZINC000819081099	FE	On-Demand	Anodyne	EBP	24	41
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819081104	HD	On-Demand	Anodyne	CA6	20	43
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819081104	HD	On-Demand	Anodyne	CA7	17	43
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819081104	HD	On-Demand	Anodyne	CA13	33	43
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819081106	HD	On-Demand	Anodyne	CA6	20	43
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819081106	HD	On-Demand	Anodyne	CA7	17	43
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000819081106	HD	On-Demand	Anodyne	CA13	33	43
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819081116	GF	On-Demand	Anodyne	DRD4	27	45
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819081119	GF	On-Demand	Anodyne	DRD4	27	45
N#Cc1ccc([C@H](O)CNCCOC2CCCCCC2)cc1	ZINC000819081176	DF	On-Demand	Mild	ADRB1	26	43
N#Cc1ccc([C@H](O)CNCCOC2CCCCCC2)cc1	ZINC000819081176	DF	On-Demand	Mild	ADRB3	23	43
N#Cc1ccc([C@@H](O)CNCCOC2CCCCCC2)cc1	ZINC000819081179	DF	On-Demand	Mild	ADRB1	26	43
N#Cc1ccc([C@@H](O)CNCCOC2CCCCCC2)cc1	ZINC000819081179	DF	On-Demand	Mild	ADRB3	23	43
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccc(F)cc1	ZINC000819081183	FE	On-Demand	Anodyne	DRD4	37	48
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccc(F)cc1	ZINC000819081183	FE	On-Demand	Anodyne	P2RX3	25	45
CC(C)c1ccc(CCCNC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819081230	DH	On-Demand	Anodyne	ADRB3	47	42
CC(C)c1ccc(CCCNC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819081231	DH	On-Demand	Anodyne	ADRB3	47	42
CCN(Cc1cccc(Cl)c1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819081233	GI	On-Demand	Mild	PAPA1_CARPA	59	46
CCN(Cc1cccc(Cl)c1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819081233	GI	On-Demand	Mild	CTSL	25	46
CCN(Cc1cccc(Cl)c1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819081233	GI	On-Demand	Mild	CTSS	17	46
CCN(Cc1cccc(Cl)c1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819081233	GI	On-Demand	Mild	FPR1	44	39
CCN(Cc1cccc(Cl)c1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819081234	GI	On-Demand	Mild	PAPA1_CARPA	59	46
CCN(Cc1cccc(Cl)c1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819081234	GI	On-Demand	Mild	CTSL	25	46
CCN(Cc1cccc(Cl)c1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819081234	GI	On-Demand	Mild	CTSS	17	46
CCN(Cc1cccc(Cl)c1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819081234	GI	On-Demand	Mild	FPR1	44	39
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNC[C@@H](O)C1CC1	ZINC000819081235	EC	On-Demand	Bother	COLA	44	35
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNC[C@H](O)C1CC1	ZINC000819081236	EC	On-Demand	Bother	COLA	44	35
Cc1cc(F)ccc1[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819081251	EH	On-Demand	Anodyne	HTR1A	18	50
Cc1cc(F)ccc1[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819081251	EH	On-Demand	Anodyne	HTR1D	34	42
Cc1cc(F)ccc1[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819081251	EH	On-Demand	Anodyne	HTR1B	27	43
Cc1cc(F)ccc1[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819081251	EH	On-Demand	Anodyne	SLC6A4	24	60
Cc1cc(F)ccc1[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819081251	EH	On-Demand	Anodyne	MPO	117	61
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccccc1	ZINC000819081261	DE	On-Demand	Anodyne	ADRB2	47	45
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccccc1	ZINC000819081261	DE	On-Demand	Anodyne	ADRB1	48	42
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccccc1	ZINC000819081261	DE	On-Demand	Anodyne	ADRB3	34	51
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccccc1	ZINC000819081262	DE	On-Demand	Anodyne	ADRB2	47	45
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccccc1	ZINC000819081262	DE	On-Demand	Anodyne	ADRB1	48	42
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccccc1	ZINC000819081262	DE	On-Demand	Anodyne	ADRB3	34	51
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccccc1	ZINC000819081263	DE	On-Demand	Anodyne	ADRB2	47	45
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccccc1	ZINC000819081263	DE	On-Demand	Anodyne	ADRB1	48	42
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccccc1	ZINC000819081263	DE	On-Demand	Anodyne	ADRB3	34	51
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccccc1	ZINC000819081264	DE	On-Demand	Anodyne	ADRB2	47	45
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccccc1	ZINC000819081264	DE	On-Demand	Anodyne	ADRB1	48	42
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccccc1	ZINC000819081264	DE	On-Demand	Anodyne	ADRB3	34	51
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819081267	GG	On-Demand	Anodyne	ADRB2	23	42
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819081268	GG	On-Demand	Anodyne	ADRB2	23	42
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819081269	GG	On-Demand	Anodyne	ADRB2	23	42
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819081270	GG	On-Demand	Anodyne	ADRB2	23	42
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccccc1F	ZINC000819081272	EE	On-Demand	Anodyne	ADRB2	25	43
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccccc1F	ZINC000819081273	EE	On-Demand	Anodyne	ADRB2	25	43
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccccc1F	ZINC000819081274	EE	On-Demand	Anodyne	ADRB2	25	43
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccccc1F	ZINC000819081275	EE	On-Demand	Anodyne	ADRB2	25	43
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCCNc2ccccn2)CC1	ZINC000819081338	GF	On-Demand	Anodyne	GPR119	24	41
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCCNc2ccccn2)CC1	ZINC000819081339	GF	On-Demand	Anodyne	GPR119	24	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819081347	FE	On-Demand	Anodyne	DRD4	37	48
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819081347	FE	On-Demand	Anodyne	P2RX3	25	45
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819081365	GD	On-Demand	Anodyne	ADRB2	42	41
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819081365	GD	On-Demand	Anodyne	ADRB1	29	41
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819081365	GD	On-Demand	Anodyne	ADRB3	44	41
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819081366	GD	On-Demand	Anodyne	ADRB2	42	41
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819081366	GD	On-Demand	Anodyne	ADRB1	29	41
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819081366	GD	On-Demand	Anodyne	ADRB3	44	41
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccccc2C)c1	ZINC000819081378	GD	On-Demand	Anodyne	ADRB1	20	41
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2ccccc2C)c1	ZINC000819081380	GD	On-Demand	Anodyne	ADRB1	20	41
C[C@H](CN1CCN(c2ccccn2)CC1)NCCS(C)(=O)=O	ZINC000819081383	EC	On-Demand	Anodyne	DRD4	28	42
CON(C)C(=O)CCN[C@@H](C)CN1CCN(c2ccccn2)CC1	ZINC000819081385	EC	On-Demand	Anodyne	HTR1A	23	46
CON(C)C(=O)CCN[C@@H](C)CN1CCN(c2ccccn2)CC1	ZINC000819081385	EC	On-Demand	Anodyne	DRD2	17	47
CON(C)C(=O)CCN[C@@H](C)CN1CCN(c2ccccn2)CC1	ZINC000819081385	EC	On-Demand	Anodyne	DRD4	35	47
CON(C)C(=O)CCN[C@@H](C)CN1CCN(c2ccccn2)CC1	ZINC000819081385	EC	On-Demand	Anodyne	DRD3	16	44
CON(C)C(=O)CCN[C@H](C)CN1CCN(c2ccccn2)CC1	ZINC000819081386	EC	On-Demand	Anodyne	HTR1A	23	46
CON(C)C(=O)CCN[C@H](C)CN1CCN(c2ccccn2)CC1	ZINC000819081386	EC	On-Demand	Anodyne	DRD2	17	47
CON(C)C(=O)CCN[C@H](C)CN1CCN(c2ccccn2)CC1	ZINC000819081386	EC	On-Demand	Anodyne	DRD4	35	47
CON(C)C(=O)CCN[C@H](C)CN1CCN(c2ccccn2)CC1	ZINC000819081386	EC	On-Demand	Anodyne	DRD3	16	44
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1cc2ccccc2o1	ZINC000819081398	GF	On-Demand	Anodyne	DRD4	28	43
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1cc2ccccc2o1	ZINC000819081398	GF	On-Demand	Anodyne	P2RX3	19	40
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1cc2ccccc2o1	ZINC000819081398	GF	On-Demand	Anodyne	SORD	43	36
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2cccc(F)c2)CC1	ZINC000819081435	DF	On-Demand	Anodyne	L3MBTL3	34	41
CON(C)C(=O)CCNCCCNc1ccccn1	ZINC000819081441	CC	On-Demand	Anodyne	METG	47	31
COc1ccc(C(=O)N2CCC(NCCS(C)(=O)=O)CC2)cc1OC	ZINC000819081444	FC	On-Demand	Anodyne	L3MBTL3	66	35
O[C@H](CNC[C@H]1CCc2ccccc2C1)c1cccnc1	ZINC000819081493	CF	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNC[C@H]1CCc2ccccc2C1)c1cccnc1	ZINC000819081493	CF	On-Demand	Anodyne	ADRB1	26	41
O[C@H](CNC[C@H]1CCc2ccccc2C1)c1cccnc1	ZINC000819081493	CF	On-Demand	Anodyne	ADRB3	92	51
O[C@@H](CNC[C@@H]1CCc2ccccc2C1)c1cccnc1	ZINC000819081494	CF	On-Demand	Anodyne	ADRB2	20	40
O[C@@H](CNC[C@@H]1CCc2ccccc2C1)c1cccnc1	ZINC000819081494	CF	On-Demand	Anodyne	ADRB1	26	41
O[C@@H](CNC[C@@H]1CCc2ccccc2C1)c1cccnc1	ZINC000819081494	CF	On-Demand	Anodyne	ADRB3	92	51
O[C@@H](CNC[C@H]1CCc2ccccc2C1)c1cccnc1	ZINC000819081495	CF	On-Demand	Anodyne	ADRB2	20	40
O[C@@H](CNC[C@H]1CCc2ccccc2C1)c1cccnc1	ZINC000819081495	CF	On-Demand	Anodyne	ADRB1	26	41
O[C@@H](CNC[C@H]1CCc2ccccc2C1)c1cccnc1	ZINC000819081495	CF	On-Demand	Anodyne	ADRB3	92	51
O[C@H](CNC[C@@H]1CCc2ccccc2C1)c1cccnc1	ZINC000819081496	CF	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNC[C@@H]1CCc2ccccc2C1)c1cccnc1	ZINC000819081496	CF	On-Demand	Anodyne	ADRB1	26	41
O[C@H](CNC[C@@H]1CCc2ccccc2C1)c1cccnc1	ZINC000819081496	CF	On-Demand	Anodyne	ADRB3	92	51
CON(C)C(=O)CCNCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000819081498	FB	On-Demand	Bother	COLA	89	38
CN(C)CC[C@H](NC[C@@H](O)c1ccccc1)C(C)(C)C	ZINC000819081510	CF	On-Demand	Anodyne	AOC3	27	44
CN(C)CC[C@H](NC[C@@H](O)c1ccccc1)C(C)(C)C	ZINC000819081510	CF	On-Demand	Anodyne	UTS2	42	34
CN(C)CC[C@H](NC[C@H](O)c1ccccc1)C(C)(C)C	ZINC000819081511	CF	On-Demand	Anodyne	AOC3	27	44
CN(C)CC[C@H](NC[C@H](O)c1ccccc1)C(C)(C)C	ZINC000819081511	CF	On-Demand	Anodyne	UTS2	42	34
CN(C)CC[C@@H](NC[C@@H](O)c1ccccc1)C(C)(C)C	ZINC000819081512	CF	On-Demand	Anodyne	AOC3	27	44
CN(C)CC[C@@H](NC[C@@H](O)c1ccccc1)C(C)(C)C	ZINC000819081512	CF	On-Demand	Anodyne	UTS2	42	34
CN(C)CC[C@@H](NC[C@H](O)c1ccccc1)C(C)(C)C	ZINC000819081513	CF	On-Demand	Anodyne	AOC3	27	44
CN(C)CC[C@@H](NC[C@H](O)c1ccccc1)C(C)(C)C	ZINC000819081513	CF	On-Demand	Anodyne	UTS2	42	34
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819081534	FG	On-Demand	Anodyne	ADRB2	36	50
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819081534	FG	On-Demand	Anodyne	ADRB3	21	47
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819081535	FG	On-Demand	Anodyne	ADRB2	36	50
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819081535	FG	On-Demand	Anodyne	ADRB3	21	47
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819081536	FG	On-Demand	Anodyne	ADRB2	36	50
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819081536	FG	On-Demand	Anodyne	ADRB3	21	47
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819081537	FG	On-Demand	Anodyne	ADRB2	36	50
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819081537	FG	On-Demand	Anodyne	ADRB3	21	47
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCC2Cc3ccccc3C2)CC1	ZINC000819081554	FG	On-Demand	Anodyne	GPR119	36	40
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCC2Cc3ccccc3C2)CC1	ZINC000819081555	FG	On-Demand	Anodyne	GPR119	36	40
CN(C[C@@H](O)CNCCc1ccc(Br)cc1)C(=O)OC(C)(C)C	ZINC000819081560	GF	On-Demand	Anodyne	ADRB2	25	41
CN(C[C@@H](O)CNCCc1ccc(Br)cc1)C(=O)OC(C)(C)C	ZINC000819081560	GF	On-Demand	Anodyne	ADRB1	47	41
CN(C[C@@H](O)CNCCc1ccc(Br)cc1)C(=O)OC(C)(C)C	ZINC000819081560	GF	On-Demand	Anodyne	ADRB3	47	41
CN(C[C@H](O)CNCCc1ccc(Br)cc1)C(=O)OC(C)(C)C	ZINC000819081561	GF	On-Demand	Anodyne	ADRB2	25	41
CN(C[C@H](O)CNCCc1ccc(Br)cc1)C(=O)OC(C)(C)C	ZINC000819081561	GF	On-Demand	Anodyne	ADRB1	47	41
CN(C[C@H](O)CNCCc1ccc(Br)cc1)C(=O)OC(C)(C)C	ZINC000819081561	GF	On-Demand	Anodyne	ADRB3	47	41
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)c(F)c1	ZINC000819081585	GG	On-Demand	Anodyne	ADRA1D	29	42
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)c(F)c1	ZINC000819081585	GG	On-Demand	Anodyne	ADRA1A	21	42
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)c(F)c1	ZINC000819081585	GG	On-Demand	Anodyne	ADRA1B	23	42
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)c(F)c1	ZINC000819081586	GG	On-Demand	Anodyne	ADRA1D	29	42
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)c(F)c1	ZINC000819081586	GG	On-Demand	Anodyne	ADRA1A	21	42
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)c(F)c1	ZINC000819081586	GG	On-Demand	Anodyne	ADRA1B	23	42
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)c(F)c1	ZINC000819081587	GG	On-Demand	Anodyne	ADRA1D	29	42
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)c(F)c1	ZINC000819081587	GG	On-Demand	Anodyne	ADRA1A	21	42
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)c(F)c1	ZINC000819081587	GG	On-Demand	Anodyne	ADRA1B	23	42
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)c(F)c1	ZINC000819081588	GG	On-Demand	Anodyne	ADRA1D	29	42
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)c(F)c1	ZINC000819081588	GG	On-Demand	Anodyne	ADRA1A	21	42
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)c(F)c1	ZINC000819081588	GG	On-Demand	Anodyne	ADRA1B	23	42
O[C@@H](CNCCOC1CCCCCC1)c1c(F)cccc1F	ZINC000819081650	DG	On-Demand	Anodyne	ADRB1	20	44
O[C@H](CNCCOC1CCCCCC1)c1c(F)cccc1F	ZINC000819081651	DG	On-Demand	Anodyne	ADRB1	20	44
Cc1ccccc1[C@@H](O)CNCCOC1CCCCCC1	ZINC000819081656	CG	On-Demand	Anodyne	ADRB2	21	46
Cc1ccccc1[C@@H](O)CNCCOC1CCCCCC1	ZINC000819081656	CG	On-Demand	Anodyne	ADRB1	33	46
Cc1ccccc1[C@@H](O)CNCCOC1CCCCCC1	ZINC000819081656	CG	On-Demand	Anodyne	ADRB3	23	41
O[C@@H](CNCc1ccccc1OC1CCC1)c1cccnc1	ZINC000819081673	CF	On-Demand	Anodyne	ADRB1	27	51
O[C@@H](CNCc1ccccc1OC1CCC1)c1cccnc1	ZINC000819081673	CF	On-Demand	Anodyne	ADRB3	94	51
O[C@@H](CNCc1ccccc1OC1CCC1)c1cccnc1	ZINC000819081673	CF	On-Demand	Anodyne	PDE4A	15	41
O[C@H](CNCc1ccccc1OC1CCC1)c1cccnc1	ZINC000819081674	CF	On-Demand	Anodyne	ADRB1	27	51
O[C@H](CNCc1ccccc1OC1CCC1)c1cccnc1	ZINC000819081674	CF	On-Demand	Anodyne	ADRB3	94	51
O[C@H](CNCc1ccccc1OC1CCC1)c1cccnc1	ZINC000819081674	CF	On-Demand	Anodyne	PDE4A	15	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(C)(C)c2cccc(F)c2)CC1	ZINC000819081692	GH	On-Demand	Anodyne	GPR119	46	58
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(C)(C)c2cccc(F)c2)CC1	ZINC000819081692	GH	On-Demand	Anodyne	SFRP1	19	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(C)(C)c2cccc(F)c2)CC1	ZINC000819081693	GH	On-Demand	Anodyne	GPR119	46	58
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(C)(C)c2cccc(F)c2)CC1	ZINC000819081693	GH	On-Demand	Anodyne	SFRP1	19	40
CON(C)C(=O)CCNC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819081697	FC	On-Demand	Anodyne	AVPR1B	15	40
CON(C)C(=O)CCNC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819081697	FC	On-Demand	Anodyne	PTPN2	45	39
CON(C)C(=O)CCNC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819081697	FC	On-Demand	Anodyne	SIGMAR1	18	46
CON(C)C(=O)CCNC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819081697	FC	On-Demand	Anodyne	PTPN1	36	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1cc(F)ccc1F	ZINC000819081731	GE	On-Demand	Anodyne	DRD4	33	46
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1cc(F)ccc1F	ZINC000819081731	GE	On-Demand	Anodyne	P2RX3	22	42
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1cc(F)ccc1F	ZINC000819081732	GE	On-Demand	Anodyne	DRD4	33	46
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1cc(F)ccc1F	ZINC000819081732	GE	On-Demand	Anodyne	P2RX3	22	42
C#CCNC(=O)CCNC[C@H]1CCc2ccccc2C1	ZINC000819081735	CD	On-Demand	Mild	PREP	26	41
C#CCNC(=O)CCNC[C@@H]1CCc2ccccc2C1	ZINC000819081736	CD	On-Demand	Mild	PREP	26	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(OC(C)C)cc1)C2	ZINC000819081745	FF	On-Demand	Anodyne	VHL	57	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(OC(C)C)cc1)C2	ZINC000819081746	FF	On-Demand	Anodyne	VHL	57	32
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819081758	FD	On-Demand	Anodyne	ADRB2	48	41
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819081758	FD	On-Demand	Anodyne	ADRB1	52	41
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819081758	FD	On-Demand	Anodyne	ADRB3	88	41
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819081759	FD	On-Demand	Anodyne	ADRB2	48	41
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819081759	FD	On-Demand	Anodyne	ADRB1	52	41
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819081759	FD	On-Demand	Anodyne	ADRB3	88	41
COc1ccc(OC)c([C@H](O)CNCC(C)(C)Cc2ccccc2)c1	ZINC000819081783	EH	On-Demand	Anodyne	ADRB2	20	44
Cc1ccccc1[C@@H](O)CNC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819081786	GF	On-Demand	Anodyne	ADRB3	28	41
Cc1ccccc1[C@@H](O)CNC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819081786	GF	On-Demand	Anodyne	PTPN2	45	38
Cc1ccccc1[C@@H](O)CNC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819081786	GF	On-Demand	Anodyne	SIGMAR1	18	48
Cc1ccccc1[C@@H](O)CNC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819081786	GF	On-Demand	Anodyne	PTPN1	36	42
Cc1ccccc1[C@@H](O)CNC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819081786	GF	On-Demand	Anodyne	CCR8	58	33
O[C@@H](CNCCCNc1ccccn1)c1ccc(Cl)cc1Cl	ZINC000819081813	EH	On-Demand	Anodyne	METG	29	41
O[C@H](CNCCCNc1ccccn1)c1ccc(Cl)cc1Cl	ZINC000819081814	EH	On-Demand	Anodyne	METG	29	41
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccc(C)cc3)CC2)cc1OC	ZINC000819081821	GF	On-Demand	Anodyne	ADRB3	35	48
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccc(C)cc3)CC2)cc1OC	ZINC000819081821	GF	On-Demand	Anodyne	L3MBTL3	52	33
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccc(C)cc3)CC2)cc1OC	ZINC000819081824	GF	On-Demand	Anodyne	ADRB3	35	48
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccc(C)cc3)CC2)cc1OC	ZINC000819081824	GF	On-Demand	Anodyne	L3MBTL3	52	33
O[C@@H](CNCCCNc1ccccn1)c1cccc2ccccc12	ZINC000819081857	DG	On-Demand	Anodyne	METG	72	34
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccccc2OC2CCC2)cc1	ZINC000819081893	GF	On-Demand	Anodyne	ADRB2	22	40
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccccc2OC2CCC2)cc1	ZINC000819081893	GF	On-Demand	Anodyne	ADRB1	21	45
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccccc2OC2CCC2)cc1	ZINC000819081893	GF	On-Demand	Anodyne	ADRB3	39	45
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccccc2OC2CCC2)cc1	ZINC000819081895	GF	On-Demand	Anodyne	ADRB2	22	40
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccccc2OC2CCC2)cc1	ZINC000819081895	GF	On-Demand	Anodyne	ADRB1	21	45
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccccc2OC2CCC2)cc1	ZINC000819081895	GF	On-Demand	Anodyne	ADRB3	39	45
O[C@H](CNCc1ccccc1OC1CCC1)c1ccccc1	ZINC000819081896	CG	On-Demand	Anodyne	ADRB1	16	48
O[C@H](CNCc1ccccc1OC1CCC1)c1ccccc1	ZINC000819081896	CG	On-Demand	Anodyne	ADRB3	42	48
O[C@@H](CNCc1ccccc1OC1CCC1)c1ccccc1	ZINC000819081898	CG	On-Demand	Anodyne	ADRB1	16	48
O[C@@H](CNCc1ccccc1OC1CCC1)c1ccccc1	ZINC000819081898	CG	On-Demand	Anodyne	ADRB3	42	48
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819081929	FG	On-Demand	Anodyne	EPHX2	15	50
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819081929	FG	On-Demand	Anodyne	MLYCD	22	49
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819081929	FG	On-Demand	Anodyne	L3MBTL3	48	36
O=[N+]([O-])c1ccc([C@H](O)CNCc2ccccc2OC2CCC2)cc1	ZINC000819081931	EG	On-Demand	Bother	ADRB3	25	42
O=[N+]([O-])c1ccc([C@@H](O)CNCc2ccccc2OC2CCC2)cc1	ZINC000819081933	EG	On-Demand	Bother	ADRB3	25	42
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081935	GF	On-Demand	Anodyne	ADRB2	23	40
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081935	GF	On-Demand	Anodyne	ADRB1	37	41
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081935	GF	On-Demand	Anodyne	DRD4	17	48
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081935	GF	On-Demand	Anodyne	SLC6A3	15	41
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081935	GF	On-Demand	Anodyne	ADRB3	61	43
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081935	GF	On-Demand	Anodyne	PDE4A	24	45
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081935	GF	On-Demand	Anodyne	HRH3	25	40
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081935	GF	On-Demand	Anodyne	CCR8	40	36
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081935	GF	On-Demand	Anodyne	SCD1	16	41
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081935	GF	On-Demand	Anodyne	SCD	20	41
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081935	GF	On-Demand	Anodyne	L3MBTL3	62	39
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081935	GF	On-Demand	Anodyne	ACKR3	44	36
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081937	GF	On-Demand	Anodyne	ADRB2	23	40
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081937	GF	On-Demand	Anodyne	ADRB1	37	41
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081937	GF	On-Demand	Anodyne	DRD4	17	48
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081937	GF	On-Demand	Anodyne	SLC6A3	15	41
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081937	GF	On-Demand	Anodyne	ADRB3	61	43
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081937	GF	On-Demand	Anodyne	PDE4A	24	45
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081937	GF	On-Demand	Anodyne	HRH3	25	40
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081937	GF	On-Demand	Anodyne	CCR8	40	36
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081937	GF	On-Demand	Anodyne	SCD1	16	41
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081937	GF	On-Demand	Anodyne	SCD	20	41
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081937	GF	On-Demand	Anodyne	L3MBTL3	62	39
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1OC	ZINC000819081937	GF	On-Demand	Anodyne	ACKR3	44	36
COCc1cc(Cl)ccc1NCCCN1CCOC1=O	ZINC000819081988	CF	On-Demand	Anodyne	HRP1_PLAFA	68	40
CC(C)c1ccc(CCCNC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819081996	DH	On-Demand	Mild	ADRB2	42	42
CC(C)c1ccc(CCCNC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819081996	DH	On-Demand	Mild	ADRB3	48	40
CC(C)c1ccc(CCCNC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819081997	DH	On-Demand	Mild	ADRB2	42	42
CC(C)c1ccc(CCCNC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819081997	DH	On-Demand	Mild	ADRB3	48	40
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1cccc2ccccc12	ZINC000819082010	FG	On-Demand	Anodyne	ADRB2	33	50
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1cccc2ccccc12	ZINC000819082010	FG	On-Demand	Anodyne	ADRB1	30	50
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1cccc2ccccc12	ZINC000819082010	FG	On-Demand	Anodyne	ADRB3	17	52
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1cccc2ccccc12	ZINC000819082011	FG	On-Demand	Anodyne	ADRB2	33	50
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1cccc2ccccc12	ZINC000819082011	FG	On-Demand	Anodyne	ADRB1	30	50
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1cccc2ccccc12	ZINC000819082011	FG	On-Demand	Anodyne	ADRB3	17	52
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1cccc2ccccc12	ZINC000819082012	FG	On-Demand	Anodyne	ADRB2	33	50
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1cccc2ccccc12	ZINC000819082012	FG	On-Demand	Anodyne	ADRB1	30	50
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1cccc2ccccc12	ZINC000819082012	FG	On-Demand	Anodyne	ADRB3	17	52
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1cccc2ccccc12	ZINC000819082013	FG	On-Demand	Anodyne	ADRB2	33	50
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1cccc2ccccc12	ZINC000819082013	FG	On-Demand	Anodyne	ADRB1	30	50
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1cccc2ccccc12	ZINC000819082013	FG	On-Demand	Anodyne	ADRB3	17	52
CCN(Cc1ccc(Cl)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819082014	GI	On-Demand	Mild	PAPA1_CARPA	50	43
CCN(Cc1ccc(Cl)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819082014	GI	On-Demand	Mild	CTSK	22	42
CCN(Cc1ccc(Cl)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819082014	GI	On-Demand	Mild	FPR1	32	41
CCN(Cc1ccc(Cl)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819082015	GI	On-Demand	Mild	PAPA1_CARPA	50	43
CCN(Cc1ccc(Cl)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819082015	GI	On-Demand	Mild	CTSK	22	42
CCN(Cc1ccc(Cl)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819082015	GI	On-Demand	Mild	FPR1	32	41
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819082028	FF	On-Demand	Anodyne	HTR1A	18	46
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819082028	FF	On-Demand	Anodyne	HTR1D	28	43
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819082028	FF	On-Demand	Anodyne	HTR1B	24	43
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819082028	FF	On-Demand	Anodyne	SLC6A4	19	52
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819082028	FF	On-Demand	Anodyne	CCKAR	47	36
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819082028	FF	On-Demand	Anodyne	MPO	103	53
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819082029	FF	On-Demand	Anodyne	HTR1A	18	46
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819082029	FF	On-Demand	Anodyne	HTR1D	28	43
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819082029	FF	On-Demand	Anodyne	HTR1B	24	43
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819082029	FF	On-Demand	Anodyne	SLC6A4	19	52
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819082029	FF	On-Demand	Anodyne	CCKAR	47	36
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12	ZINC000819082029	FF	On-Demand	Anodyne	MPO	103	53
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819082030	FI	On-Demand	Mild	PAPA1_CARPA	46	45
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819082030	FI	On-Demand	Mild	CTSK	24	45
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819082030	FI	On-Demand	Mild	FPR1	45	40
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819082031	FI	On-Demand	Mild	PAPA1_CARPA	46	45
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819082031	FI	On-Demand	Mild	CTSK	24	45
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819082031	FI	On-Demand	Mild	FPR1	45	40
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819082032	FI	On-Demand	Mild	PAPA1_CARPA	46	45
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819082032	FI	On-Demand	Mild	CTSK	24	45
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819082032	FI	On-Demand	Mild	FPR1	45	40
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819082033	FI	On-Demand	Mild	PAPA1_CARPA	46	45
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819082033	FI	On-Demand	Mild	CTSK	24	45
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819082033	FI	On-Demand	Mild	FPR1	45	40
CCN(Cc1ccc(OC)cc1)C(=O)C(F)=C1CCC1	ZINC000819082038	CG	On-Demand	Anodyne	TSPO	18	42
COCc1cc(Cl)ccc1NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819082043	FI	On-Demand	Anodyne	L3MBTL3	43	40
CCN(Cc1ccc(Cl)cc1)C(=O)C(F)=C1CCC1	ZINC000819082044	CI	On-Demand	Anodyne	TSPO	17	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCN(c3ccccc3OC(F)F)C2)c1	ZINC000819082054	GG	On-Demand	Bother	ADRA1D	29	40
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCN(c3ccccc3OC(F)F)C2)c1	ZINC000819082054	GG	On-Demand	Bother	ADRA1A	20	40
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCN(c3ccccc3OC(F)F)C2)c1	ZINC000819082054	GG	On-Demand	Bother	ADRA1B	23	40
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCN(c3ccccc3OC(F)F)C2)c1	ZINC000819082055	GG	On-Demand	Bother	ADRA1D	29	40
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCN(c3ccccc3OC(F)F)C2)c1	ZINC000819082055	GG	On-Demand	Bother	ADRA1A	20	40
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCN(c3ccccc3OC(F)F)C2)c1	ZINC000819082055	GG	On-Demand	Bother	ADRA1B	23	40
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCN(c3ccccc3OC(F)F)C2)c1	ZINC000819082058	GG	On-Demand	Bother	ADRA1D	29	40
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCN(c3ccccc3OC(F)F)C2)c1	ZINC000819082058	GG	On-Demand	Bother	ADRA1A	20	40
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCN(c3ccccc3OC(F)F)C2)c1	ZINC000819082058	GG	On-Demand	Bother	ADRA1B	23	40
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCN(c3ccccc3OC(F)F)C2)c1	ZINC000819082064	GG	On-Demand	Bother	ADRA1D	29	40
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCN(c3ccccc3OC(F)F)C2)c1	ZINC000819082064	GG	On-Demand	Bother	ADRA1A	20	40
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCN(c3ccccc3OC(F)F)C2)c1	ZINC000819082064	GG	On-Demand	Bother	ADRA1B	23	40
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819082072	GE	On-Demand	Anodyne	ADRB2	43	41
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819082072	GE	On-Demand	Anodyne	ADRB1	40	41
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819082072	GE	On-Demand	Anodyne	ADRB3	51	41
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819082072	GE	On-Demand	Anodyne	TBXA2R	46	38
C#CCNC(=O)CCNC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819082079	FC	On-Demand	Mild	PTPN2	45	39
C#CCNC(=O)CCNC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819082079	FC	On-Demand	Mild	SIGMAR1	17	46
C#CCNC(=O)CCNC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819082079	FC	On-Demand	Mild	PTPN1	36	41
C[C@@H](Cc1cccc(F)c1)NC[C@@H](O)c1c(F)cccc1F	ZINC000819082082	DG	On-Demand	Anodyne	ADRB2	42	40
C[C@@H](Cc1cccc(F)c1)NC[C@@H](O)c1c(F)cccc1F	ZINC000819082082	DG	On-Demand	Anodyne	ADRB1	15	40
C[C@@H](Cc1cccc(F)c1)NC[C@H](O)c1c(F)cccc1F	ZINC000819082084	DG	On-Demand	Anodyne	ADRB2	42	40
C[C@@H](Cc1cccc(F)c1)NC[C@H](O)c1c(F)cccc1F	ZINC000819082084	DG	On-Demand	Anodyne	ADRB1	15	40
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccc(F)cc1Cl	ZINC000819082101	GF	On-Demand	Anodyne	DRD4	30	43
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccc(F)cc1Cl	ZINC000819082101	GF	On-Demand	Anodyne	P2RX3	20	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819082103	GF	On-Demand	Anodyne	DRD4	30	43
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819082103	GF	On-Demand	Anodyne	P2RX3	20	41
O[C@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccccc1C(F)(F)F	ZINC000819082118	FI	On-Demand	Anodyne	HTR1A	19	48
O[C@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccccc1C(F)(F)F	ZINC000819082118	FI	On-Demand	Anodyne	HTR1D	40	40
O[C@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccccc1C(F)(F)F	ZINC000819082118	FI	On-Demand	Anodyne	SLC6A4	26	57
O[C@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccccc1C(F)(F)F	ZINC000819082118	FI	On-Demand	Anodyne	ADRB3	15	53
O[C@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccccc1C(F)(F)F	ZINC000819082118	FI	On-Demand	Anodyne	MPO	110	57
O[C@@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccccc1C(F)(F)F	ZINC000819082119	FI	On-Demand	Anodyne	HTR1A	19	48
O[C@@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccccc1C(F)(F)F	ZINC000819082119	FI	On-Demand	Anodyne	HTR1D	40	40
O[C@@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccccc1C(F)(F)F	ZINC000819082119	FI	On-Demand	Anodyne	SLC6A4	26	57
O[C@@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccccc1C(F)(F)F	ZINC000819082119	FI	On-Demand	Anodyne	ADRB3	15	53
O[C@@H](CNCCc1c[nH]c2ccc(F)cc12)c1ccccc1C(F)(F)F	ZINC000819082119	FI	On-Demand	Anodyne	MPO	110	57
CCn1c(=O)c2ccccc2n(CC(=O)N2[C@H](C(=O)OC)C[C@H]3CCCC[C@@H]32)c1=O	ZINC000819082146	HD	On-Demand	Anodyne	Q7YY07_CRYPV	40	30
CCn1c(=O)c2ccccc2n(CC(=O)N2[C@H](C(=O)OC)C[C@H]3CCCC[C@H]32)c1=O	ZINC000819082147	HD	On-Demand	Anodyne	Q7YY07_CRYPV	40	30
CCn1c(=O)c2ccccc2n(CC(=O)N2[C@H](C(=O)OC)C[C@@H]3CCCC[C@H]32)c1=O	ZINC000819082148	HD	On-Demand	Anodyne	Q7YY07_CRYPV	40	30
CCn1c(=O)c2ccccc2n(CC(=O)N2[C@H](C(=O)OC)C[C@@H]3CCCC[C@@H]32)c1=O	ZINC000819082149	HD	On-Demand	Anodyne	Q7YY07_CRYPV	40	30
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CCc3ccccc3C2)c1	ZINC000819082150	EG	On-Demand	Bother	ADRB3	25	41
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CCc3ccccc3C2)c1	ZINC000819082151	EG	On-Demand	Bother	ADRB3	25	41
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2CCc3ccccc3C2)c1	ZINC000819082152	EG	On-Demand	Bother	ADRB3	25	41
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CCc3ccccc3C2)c1	ZINC000819082153	EG	On-Demand	Bother	ADRB3	25	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CSc3ccccc32)CC1	ZINC000819082181	GG	On-Demand	Anodyne	GPR119	34	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CSc3ccccc32)CC1	ZINC000819082182	GG	On-Demand	Anodyne	GPR119	34	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CSc3ccccc32)CC1	ZINC000819082183	GG	On-Demand	Anodyne	GPR119	34	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CSc3ccccc32)CC1	ZINC000819082184	GG	On-Demand	Anodyne	GPR119	34	46
O[C@@H](CNCCOC1CCCCCC1)c1cccc(F)c1	ZINC000819082203	CG	On-Demand	Anodyne	ADRB1	54	47
O[C@@H](CNCCOC1CCCCCC1)c1cccc(F)c1	ZINC000819082203	CG	On-Demand	Anodyne	ADRB3	54	45
O[C@H](CNCCOC1CCCCCC1)c1cccc(F)c1	ZINC000819082204	CG	On-Demand	Anodyne	ADRB1	54	47
O[C@H](CNCCOC1CCCCCC1)c1cccc(F)c1	ZINC000819082204	CG	On-Demand	Anodyne	ADRB3	54	45
O[C@@H](CNCCOC1CCCCCC1)c1ccccc1F	ZINC000819082205	CG	On-Demand	Anodyne	ADRB1	28	45
O[C@@H](CNCCOC1CCCCCC1)c1ccccc1F	ZINC000819082205	CG	On-Demand	Anodyne	ADRB3	21	41
O[C@H](CNCCOC1CCCCCC1)c1ccccc1F	ZINC000819082206	CG	On-Demand	Anodyne	ADRB1	28	45
O[C@H](CNCCOC1CCCCCC1)c1ccccc1F	ZINC000819082206	CG	On-Demand	Anodyne	ADRB3	21	41
O[C@@H](CNCCCNc1ccccn1)c1ccccc1	ZINC000819082227	CE	On-Demand	Anodyne	ADRB2	28	47
O[C@@H](CNCCCNc1ccccn1)c1ccccc1	ZINC000819082227	CE	On-Demand	Anodyne	ADRB3	48	40
O[C@H](CNCCCNc1ccccn1)c1ccccc1	ZINC000819082228	CE	On-Demand	Anodyne	ADRB2	28	47
O[C@H](CNCCCNc1ccccn1)c1ccccc1	ZINC000819082228	CE	On-Demand	Anodyne	ADRB3	48	40
O[C@@H](CNCCOC1CCCCCC1)c1cc(F)ccc1F	ZINC000819082229	DG	On-Demand	Anodyne	ADRB1	19	41
O[C@H](CNCCOC1CCCCCC1)c1cc(F)ccc1F	ZINC000819082230	DG	On-Demand	Anodyne	ADRB1	19	41
O[C@@H](CNCCOC1CCCCCC1)c1ccc(F)cc1	ZINC000819082265	CG	On-Demand	Anodyne	ADRB1	33	46
O[C@@H](CNCCOC1CCCCCC1)c1ccc(F)cc1	ZINC000819082265	CG	On-Demand	Anodyne	SLC6A3	17	40
O[C@@H](CNCCOC1CCCCCC1)c1ccc(F)cc1	ZINC000819082265	CG	On-Demand	Anodyne	ADRB3	25	42
O[C@H](CNCCOC1CCCCCC1)c1ccc(F)cc1	ZINC000819082266	CG	On-Demand	Anodyne	ADRB1	33	46
O[C@H](CNCCOC1CCCCCC1)c1ccc(F)cc1	ZINC000819082266	CG	On-Demand	Anodyne	SLC6A3	17	40
O[C@H](CNCCOC1CCCCCC1)c1ccc(F)cc1	ZINC000819082266	CG	On-Demand	Anodyne	ADRB3	25	42
CC(C)(C)OC(=O)NCC[C@H](O)CNCC(C)(C)c1cccc(F)c1	ZINC000819082275	FF	On-Demand	Anodyne	PAPA1_CARPA	18	40
CC(C)(C)OC(=O)NCC[C@@H](O)CNCC(C)(C)c1cccc(F)c1	ZINC000819082276	FF	On-Demand	Anodyne	PAPA1_CARPA	18	40
C=C(Cl)CSc1nc(C)c(CC(=O)Nc2cccc(COC)c2)s1	ZINC000819082277	GJ	On-Demand	Mild	ENPP1	49	31
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1	ZINC000819082285	FG	On-Demand	Anodyne	ADRA1D	27	40
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1	ZINC000819082285	FG	On-Demand	Anodyne	ADRA1A	19	40
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1	ZINC000819082285	FG	On-Demand	Anodyne	ADRA1B	21	40
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1	ZINC000819082285	FG	On-Demand	Anodyne	SLC6A3	21	45
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1	ZINC000819082286	FG	On-Demand	Anodyne	ADRA1D	27	40
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1	ZINC000819082286	FG	On-Demand	Anodyne	ADRA1A	19	40
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1	ZINC000819082286	FG	On-Demand	Anodyne	ADRA1B	21	40
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1	ZINC000819082286	FG	On-Demand	Anodyne	SLC6A3	21	45
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1	ZINC000819082287	FG	On-Demand	Anodyne	ADRA1D	27	40
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1	ZINC000819082287	FG	On-Demand	Anodyne	ADRA1A	19	40
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1	ZINC000819082287	FG	On-Demand	Anodyne	ADRA1B	21	40
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1	ZINC000819082287	FG	On-Demand	Anodyne	SLC6A3	21	45
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1	ZINC000819082288	FG	On-Demand	Anodyne	ADRA1D	27	40
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1	ZINC000819082288	FG	On-Demand	Anodyne	ADRA1A	19	40
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1	ZINC000819082288	FG	On-Demand	Anodyne	ADRA1B	21	40
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1	ZINC000819082288	FG	On-Demand	Anodyne	SLC6A3	21	45
CC(C)c1ccc(CCCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819082289	GG	On-Demand	Anodyne	ADRB2	75	56
CC(C)c1ccc(CCCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819082289	GG	On-Demand	Anodyne	ADRB1	65	45
CC(C)c1ccc(CCCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819082289	GG	On-Demand	Anodyne	ADRB3	130	51
CC(C)c1ccc(CCCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819082290	GG	On-Demand	Anodyne	ADRB2	75	56
CC(C)c1ccc(CCCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819082290	GG	On-Demand	Anodyne	ADRB1	65	45
CC(C)c1ccc(CCCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819082290	GG	On-Demand	Anodyne	ADRB3	130	51
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNC[C@H](O)c1cccc(F)c1	ZINC000819082306	GD	On-Demand	Bother	ADRB3	40	40
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNC[C@@H](O)c1cccc(F)c1	ZINC000819082307	GD	On-Demand	Bother	ADRB3	40	40
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cc(F)ccc1F	ZINC000819082308	GG	On-Demand	Anodyne	ADRA1D	30	40
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cc(F)ccc1F	ZINC000819082308	GG	On-Demand	Anodyne	ADRA1A	22	40
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cc(F)ccc1F	ZINC000819082308	GG	On-Demand	Anodyne	ADRA1B	23	40
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cc(F)ccc1F	ZINC000819082309	GG	On-Demand	Anodyne	ADRA1D	30	40
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cc(F)ccc1F	ZINC000819082309	GG	On-Demand	Anodyne	ADRA1A	22	40
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cc(F)ccc1F	ZINC000819082309	GG	On-Demand	Anodyne	ADRA1B	23	40
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cc(F)ccc1F	ZINC000819082310	GG	On-Demand	Anodyne	ADRA1D	30	40
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cc(F)ccc1F	ZINC000819082310	GG	On-Demand	Anodyne	ADRA1A	22	40
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cc(F)ccc1F	ZINC000819082310	GG	On-Demand	Anodyne	ADRA1B	23	40
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cc(F)ccc1F	ZINC000819082311	GG	On-Demand	Anodyne	ADRA1D	30	40
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cc(F)ccc1F	ZINC000819082311	GG	On-Demand	Anodyne	ADRA1A	22	40
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cc(F)ccc1F	ZINC000819082311	GG	On-Demand	Anodyne	ADRA1B	23	40
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccnc1	ZINC000819082346	EF	On-Demand	Anodyne	ADRA1D	23	41
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccnc1	ZINC000819082346	EF	On-Demand	Anodyne	ADRA1A	17	41
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccnc1	ZINC000819082346	EF	On-Demand	Anodyne	ADRA1B	18	41
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccnc1	ZINC000819082346	EF	On-Demand	Anodyne	ADRB3	42	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCNc2ccccn2)CC1	ZINC000819082347	GE	On-Demand	Anodyne	GRIN2B	19	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCNc2ccccn2)CC1	ZINC000819082347	GE	On-Demand	Anodyne	GPR119	51	48
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccnc1	ZINC000819082348	EF	On-Demand	Anodyne	ADRA1D	23	41
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccnc1	ZINC000819082348	EF	On-Demand	Anodyne	ADRA1A	17	41
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccnc1	ZINC000819082348	EF	On-Demand	Anodyne	ADRA1B	18	41
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccnc1	ZINC000819082348	EF	On-Demand	Anodyne	ADRB3	42	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCNc2ccccn2)CC1	ZINC000819082350	GE	On-Demand	Anodyne	GRIN2B	19	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCNc2ccccn2)CC1	ZINC000819082350	GE	On-Demand	Anodyne	GPR119	51	48
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccnc1	ZINC000819082351	EF	On-Demand	Anodyne	ADRA1D	23	41
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccnc1	ZINC000819082351	EF	On-Demand	Anodyne	ADRA1A	17	41
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccnc1	ZINC000819082351	EF	On-Demand	Anodyne	ADRA1B	18	41
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccnc1	ZINC000819082351	EF	On-Demand	Anodyne	ADRB3	42	49
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccnc1	ZINC000819082352	EF	On-Demand	Anodyne	ADRA1D	23	41
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccnc1	ZINC000819082352	EF	On-Demand	Anodyne	ADRA1A	17	41
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccnc1	ZINC000819082352	EF	On-Demand	Anodyne	ADRA1B	18	41
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccnc1	ZINC000819082352	EF	On-Demand	Anodyne	ADRB3	42	49
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082354	EF	On-Demand	Anodyne	ADRB2	29	47
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082354	EF	On-Demand	Anodyne	ADRB3	15	46
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082355	EF	On-Demand	Anodyne	ADRB2	29	47
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082355	EF	On-Demand	Anodyne	ADRB3	15	46
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1ccc(F)cn1	ZINC000819082356	FD	On-Demand	Anodyne	DRD4	30	43
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1ccc(F)cn1	ZINC000819082356	FD	On-Demand	Anodyne	P2RX3	21	41
Cc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082357	EF	On-Demand	Anodyne	ADRB2	29	47
Cc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082357	EF	On-Demand	Anodyne	ADRB3	15	46
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082359	EF	On-Demand	Anodyne	ADRB2	29	47
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082359	EF	On-Demand	Anodyne	ADRB3	15	46
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccc(F)cn1	ZINC000819082360	FD	On-Demand	Anodyne	DRD4	30	43
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccc(F)cn1	ZINC000819082360	FD	On-Demand	Anodyne	P2RX3	21	41
N#Cc1ccc([C@@H](O)CNC2CCN(S(=O)(=O)Cc3ccccc3)CC2)cc1	ZINC000819082377	GE	On-Demand	Mild	ADRB2	15	41
N#Cc1ccc([C@@H](O)CNC2CCN(S(=O)(=O)Cc3ccccc3)CC2)cc1	ZINC000819082377	GE	On-Demand	Mild	ADRB1	18	40
N#Cc1ccc([C@@H](O)CNC2CCN(S(=O)(=O)Cc3ccccc3)CC2)cc1	ZINC000819082377	GE	On-Demand	Mild	ADRB3	42	46
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819082383	GD	On-Demand	Bother	ADRB1	43	43
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819082383	GD	On-Demand	Bother	ADRB3	67	43
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819082384	GD	On-Demand	Bother	ADRB1	43	43
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819082384	GD	On-Demand	Bother	ADRB3	67	43
N#Cc1ccc([C@H](O)CNC2CCN(S(=O)(=O)Cc3ccccc3)CC2)cc1	ZINC000819082401	GE	On-Demand	Mild	ADRB2	15	41
N#Cc1ccc([C@H](O)CNC2CCN(S(=O)(=O)Cc3ccccc3)CC2)cc1	ZINC000819082401	GE	On-Demand	Mild	ADRB1	18	40
N#Cc1ccc([C@H](O)CNC2CCN(S(=O)(=O)Cc3ccccc3)CC2)cc1	ZINC000819082401	GE	On-Demand	Mild	ADRB3	42	46
COCc1cc(Cl)ccc1NCC(=O)Nc1ccc(N2CCCC2)cc1	ZINC000819082409	FI	On-Demand	Anodyne	F10	27	46
Cc1cc(F)ccc1N1CCC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819082413	EF	On-Demand	Anodyne	ADRB3	50	42
Cc1cc(F)ccc1N1CCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819082415	EF	On-Demand	Anodyne	ADRB3	50	42
Cc1cc(F)ccc1N1CCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819082417	EF	On-Demand	Anodyne	ADRB3	50	42
Cc1cc(F)ccc1N1CCC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819082418	EF	On-Demand	Anodyne	ADRB3	50	42
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)CCCCCn1c(S)nc2ccccc2c1=O	ZINC000819082432	JH	On-Demand	Anodyne	PREP	15	43
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)CCCCCn1c(S)nc2ccccc2c1=O	ZINC000819082432	JH	On-Demand	Anodyne	Q7YY07_CRYPV	48	31
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CCCCCn1c(S)nc2ccccc2c1=O	ZINC000819082436	JH	On-Demand	Anodyne	PREP	15	43
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CCCCCn1c(S)nc2ccccc2c1=O	ZINC000819082436	JH	On-Demand	Anodyne	Q7YY07_CRYPV	48	31
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)CCc1ccc(N(C)C)cc1	ZINC000819082452	FG	On-Demand	Anodyne	PREP	21	48
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CCc1ccc(N(C)C)cc1	ZINC000819082454	FG	On-Demand	Anodyne	PREP	21	48
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000819082462	JG	On-Demand	Anodyne	EPHX2	22	41
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000819082464	JG	On-Demand	Anodyne	EPHX2	22	41
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2ccccc2F)CC1	ZINC000819082478	GE	On-Demand	Anodyne	PTPN2	43	38
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2ccccc2F)CC1	ZINC000819082478	GE	On-Demand	Anodyne	SIGMAR1	20	48
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2ccccc2F)CC1	ZINC000819082480	GE	On-Demand	Anodyne	PTPN2	43	38
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2ccccc2F)CC1	ZINC000819082480	GE	On-Demand	Anodyne	SIGMAR1	20	48
O[C@H](CNCc1ccccc1OC1CCC1)c1cccc(F)c1	ZINC000819082488	DH	On-Demand	Anodyne	ADRB1	21	42
O[C@H](CNCc1ccccc1OC1CCC1)c1cccc(F)c1	ZINC000819082488	DH	On-Demand	Anodyne	ADRB3	31	42
O[C@@H](CNCc1ccccc1OC1CCC1)c1cccc(F)c1	ZINC000819082490	DH	On-Demand	Anodyne	ADRB1	21	42
O[C@@H](CNCc1ccccc1OC1CCC1)c1cccc(F)c1	ZINC000819082490	DH	On-Demand	Anodyne	ADRB3	31	42
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2ccc(F)c(F)c2)CC1	ZINC000819082500	EF	On-Demand	Anodyne	L3MBTL3	56	36
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H]1CCc2ccccc2C1	ZINC000819082503	EF	On-Demand	Anodyne	PREP	31	46
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H]1CCc2ccccc2C1	ZINC000819082504	EF	On-Demand	Anodyne	PREP	31	46
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H]1CCc2ccccc2C1	ZINC000819082506	EF	On-Demand	Anodyne	PREP	31	46
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H]1CCc2ccccc2C1	ZINC000819082507	EF	On-Demand	Anodyne	PREP	31	46
CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Cc1cccc(NC(C)=O)c1	ZINC000819082509	GI	On-Demand	Anodyne	PTGDR2	20	42
CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Cc1cccc(NC(C)=O)c1	ZINC000819082509	GI	On-Demand	Anodyne	RORC	18	42
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819082514	GE	On-Demand	Anodyne	ADRB2	24	43
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819082514	GE	On-Demand	Anodyne	ADRB1	25	42
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819082514	GE	On-Demand	Anodyne	SLC6A3	24	48
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819082514	GE	On-Demand	Anodyne	ADRB3	53	44
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819082514	GE	On-Demand	Anodyne	PTPN2	43	38
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819082514	GE	On-Demand	Anodyne	SIGMAR1	19	48
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819082516	GE	On-Demand	Anodyne	ADRB2	24	43
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819082516	GE	On-Demand	Anodyne	ADRB1	25	42
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819082516	GE	On-Demand	Anodyne	SLC6A3	24	48
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819082516	GE	On-Demand	Anodyne	ADRB3	53	44
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819082516	GE	On-Demand	Anodyne	PTPN2	43	38
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819082516	GE	On-Demand	Anodyne	SIGMAR1	19	48
C[C@H](CN1CCN(c2ccccn2)CC1)NCC1(O)CCCCC1	ZINC000819082524	ED	On-Demand	Anodyne	DRD4	28	43
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2cccc(F)c2)CC1	ZINC000819082528	ED	On-Demand	Anodyne	ITGAL	40	31
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2cccc(F)c2)CC1	ZINC000819082528	ED	On-Demand	Anodyne	L3MBTL3	54	42
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(F)c2)CC1	ZINC000819082530	ED	On-Demand	Anodyne	ITGAL	40	31
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(F)c2)CC1	ZINC000819082530	ED	On-Demand	Anodyne	L3MBTL3	54	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2cccc(F)c2)CC1	ZINC000819082532	ED	On-Demand	Anodyne	ITGAL	40	31
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2cccc(F)c2)CC1	ZINC000819082532	ED	On-Demand	Anodyne	L3MBTL3	54	42
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(F)c2)CC1	ZINC000819082534	ED	On-Demand	Anodyne	ITGAL	40	31
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(F)c2)CC1	ZINC000819082534	ED	On-Demand	Anodyne	L3MBTL3	54	42
O[C@@H](CNCCCNc1ccccn1)c1cccnc1	ZINC000819082540	CD	On-Demand	Anodyne	ADRB2	30	48
O[C@@H](CNCCCNc1ccccn1)c1cccnc1	ZINC000819082540	CD	On-Demand	Anodyne	ADRB1	31	46
O[C@@H](CNCCCNc1ccccn1)c1cccnc1	ZINC000819082540	CD	On-Demand	Anodyne	ADRB3	101	48
O[C@H](CNCCCNc1ccccn1)c1cccnc1	ZINC000819082541	CD	On-Demand	Anodyne	ADRB2	30	48
O[C@H](CNCCCNc1ccccn1)c1cccnc1	ZINC000819082541	CD	On-Demand	Anodyne	ADRB1	31	46
O[C@H](CNCCCNc1ccccn1)c1cccnc1	ZINC000819082541	CD	On-Demand	Anodyne	ADRB3	101	48
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)CNC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819082624	HG	On-Demand	Anodyne	ACE	30	48
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)CNC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819082624	HG	On-Demand	Anodyne	SLC6A3	23	41
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)CNC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819082624	HG	On-Demand	Anodyne	PREP	22	43
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CNC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819082625	HG	On-Demand	Anodyne	ACE	30	48
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CNC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819082625	HG	On-Demand	Anodyne	SLC6A3	23	41
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CNC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819082625	HG	On-Demand	Anodyne	PREP	22	43
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3cccnc3)CC2)cc1OC	ZINC000819082628	GE	On-Demand	Anodyne	ADRB1	34	44
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3cccnc3)CC2)cc1OC	ZINC000819082628	GE	On-Demand	Anodyne	ADRB3	84	50
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3cccnc3)CC2)cc1OC	ZINC000819082628	GE	On-Demand	Anodyne	PTAFR	26	41
COc1ccc(C(=O)N2CCC(NC[C@@H](O)c3cccnc3)CC2)cc1OC	ZINC000819082628	GE	On-Demand	Anodyne	C3AR1	40	38
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3cccnc3)CC2)cc1OC	ZINC000819082629	GE	On-Demand	Anodyne	ADRB1	34	44
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3cccnc3)CC2)cc1OC	ZINC000819082629	GE	On-Demand	Anodyne	ADRB3	84	50
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3cccnc3)CC2)cc1OC	ZINC000819082629	GE	On-Demand	Anodyne	PTAFR	26	41
COc1ccc(C(=O)N2CCC(NC[C@H](O)c3cccnc3)CC2)cc1OC	ZINC000819082629	GE	On-Demand	Anodyne	C3AR1	40	38
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccccc1F	ZINC000819082668	FE	On-Demand	Anodyne	DRD4	30	45
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccccc1F	ZINC000819082668	FE	On-Demand	Anodyne	EBP	23	40
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1ccccc1F	ZINC000819082671	FE	On-Demand	Anodyne	DRD4	30	45
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1ccccc1F	ZINC000819082671	FE	On-Demand	Anodyne	EBP	23	40
CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819082672	GH	On-Demand	Anodyne	PLA2G7	43	34
CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819082672	GH	On-Demand	Anodyne	PTGDR2	17	43
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccccc1Cl	ZINC000819082690	EF	On-Demand	Anodyne	ADRB2	26	43
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccccc1Cl	ZINC000819082692	EF	On-Demand	Anodyne	ADRB2	26	43
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccccc1Cl	ZINC000819082695	EF	On-Demand	Anodyne	ADRB2	26	43
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccccc1Cl	ZINC000819082697	EF	On-Demand	Anodyne	ADRB2	26	43
CC(C)(C)OC(=O)CS(=O)(=O)CCNCCc1c[nH]c2ccc(F)cc12	ZINC000819082707	GE	On-Demand	Anodyne	HTR1A	20	49
CC(C)(C)OC(=O)CS(=O)(=O)CCNCCc1c[nH]c2ccc(F)cc12	ZINC000819082707	GE	On-Demand	Anodyne	HTR1D	24	44
CC(C)(C)OC(=O)CS(=O)(=O)CCNCCc1c[nH]c2ccc(F)cc12	ZINC000819082707	GE	On-Demand	Anodyne	HTR1B	22	42
CC(C)(C)OC(=O)CS(=O)(=O)CCNCCc1c[nH]c2ccc(F)cc12	ZINC000819082707	GE	On-Demand	Anodyne	SLC6A4	22	55
CC(C)(C)OC(=O)CS(=O)(=O)CCNCCc1c[nH]c2ccc(F)cc12	ZINC000819082707	GE	On-Demand	Anodyne	MPO	106	55
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccccc3OC(F)F)C2)cc1	ZINC000819082723	GG	On-Demand	Bother	ADRA1D	27	40
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccccc3OC(F)F)C2)cc1	ZINC000819082723	GG	On-Demand	Bother	ADRA1A	19	40
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccccc3OC(F)F)C2)cc1	ZINC000819082723	GG	On-Demand	Bother	ADRA1B	21	40
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCN(c3ccccc3OC(F)F)C2)cc1	ZINC000819082725	GG	On-Demand	Bother	ADRA1D	27	40
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCN(c3ccccc3OC(F)F)C2)cc1	ZINC000819082725	GG	On-Demand	Bother	ADRA1A	19	40
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCN(c3ccccc3OC(F)F)C2)cc1	ZINC000819082725	GG	On-Demand	Bother	ADRA1B	21	40
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCN(c3ccccc3OC(F)F)C2)cc1	ZINC000819082726	GG	On-Demand	Bother	ADRA1D	27	40
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCN(c3ccccc3OC(F)F)C2)cc1	ZINC000819082726	GG	On-Demand	Bother	ADRA1A	19	40
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCN(c3ccccc3OC(F)F)C2)cc1	ZINC000819082726	GG	On-Demand	Bother	ADRA1B	21	40
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCN(c3ccccc3OC(F)F)C2)cc1	ZINC000819082728	GG	On-Demand	Bother	ADRA1D	27	40
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCN(c3ccccc3OC(F)F)C2)cc1	ZINC000819082728	GG	On-Demand	Bother	ADRA1A	19	40
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCN(c3ccccc3OC(F)F)C2)cc1	ZINC000819082728	GG	On-Demand	Bother	ADRA1B	21	40
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819082775	GE	On-Demand	Anodyne	ADRB2	52	46
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819082775	GE	On-Demand	Anodyne	ADRB1	58	46
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819082775	GE	On-Demand	Anodyne	ADRB3	80	46
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819082777	GE	On-Demand	Anodyne	ADRB2	52	46
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819082777	GE	On-Demand	Anodyne	ADRB1	58	46
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819082777	GE	On-Demand	Anodyne	ADRB3	80	46
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819082787	GG	On-Demand	Anodyne	ADRB3	16	43
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819082788	GG	On-Demand	Anodyne	ADRB3	16	43
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819082790	GG	On-Demand	Anodyne	ADRB3	16	43
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819082791	GG	On-Demand	Anodyne	ADRB3	16	43
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819082792	GD	On-Demand	Mild	ADRB2	23	40
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819082792	GD	On-Demand	Mild	ADRB3	20	40
Cc1ncc2c(n1)CCC[C@@H]2NCCC(=O)Nc1cccc(F)c1	ZINC000819082793	EF	On-Demand	Anodyne	TBK1	15	40
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819082794	GD	On-Demand	Mild	ADRB2	23	40
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819082794	GD	On-Demand	Mild	ADRB3	20	40
Cc1ncc2c(n1)CCC[C@H]2NCCC(=O)Nc1cccc(F)c1	ZINC000819082795	EF	On-Demand	Anodyne	TBK1	15	40
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082797	FE	On-Demand	Anodyne	ADRB2	35	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082797	FE	On-Demand	Anodyne	ADRB1	62	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082797	FE	On-Demand	Anodyne	ADRB3	40	44
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082799	FE	On-Demand	Anodyne	ADRB2	35	51
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082799	FE	On-Demand	Anodyne	ADRB1	62	51
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082799	FE	On-Demand	Anodyne	ADRB3	40	44
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082801	FE	On-Demand	Anodyne	ADRB2	35	51
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082801	FE	On-Demand	Anodyne	ADRB1	62	51
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082801	FE	On-Demand	Anodyne	ADRB3	40	44
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082804	FE	On-Demand	Anodyne	ADRB2	35	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082804	FE	On-Demand	Anodyne	ADRB1	62	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819082804	FE	On-Demand	Anodyne	ADRB3	40	44
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819082819	GD	On-Demand	Anodyne	ADRB2	27	41
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819082819	GD	On-Demand	Anodyne	ADRB1	17	41
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819082821	GD	On-Demand	Anodyne	ADRB2	27	41
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819082821	GD	On-Demand	Anodyne	ADRB1	17	41
Cc1ccccc1[C@@H](O)CNCCc1ccc(Br)cc1	ZINC000819082836	EH	On-Demand	Anodyne	ADRB2	70	52
Cc1ccccc1[C@@H](O)CNCCc1ccc(Br)cc1	ZINC000819082836	EH	On-Demand	Anodyne	ADRB1	74	44
Cc1ccccc1[C@@H](O)CNCCc1ccc(Br)cc1	ZINC000819082836	EH	On-Demand	Anodyne	ADRB3	88	44
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2cccc(F)c2)CC1	ZINC000819082844	GE	On-Demand	Anodyne	ADRB2	19	41
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2cccc(F)c2)CC1	ZINC000819082844	GE	On-Demand	Anodyne	ADRB3	59	42
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2cccc(F)c2)CC1	ZINC000819082844	GE	On-Demand	Anodyne	PTPN2	46	41
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2cccc(F)c2)CC1	ZINC000819082844	GE	On-Demand	Anodyne	SIGMAR1	16	52
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2cccc(F)c2)CC1	ZINC000819082844	GE	On-Demand	Anodyne	PTPN1	37	41
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819082846	GE	On-Demand	Anodyne	ADRB2	19	41
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819082846	GE	On-Demand	Anodyne	ADRB3	59	42
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819082846	GE	On-Demand	Anodyne	PTPN2	46	41
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819082846	GE	On-Demand	Anodyne	SIGMAR1	16	52
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819082846	GE	On-Demand	Anodyne	PTPN1	37	41
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccc(F)cc1	ZINC000819082855	EE	On-Demand	Anodyne	ADRB2	27	40
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1ccc(F)cc1	ZINC000819082855	EE	On-Demand	Anodyne	ADRB3	17	47
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccc(F)cc1	ZINC000819082856	EE	On-Demand	Anodyne	ADRB2	27	40
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1ccc(F)cc1	ZINC000819082856	EE	On-Demand	Anodyne	ADRB3	17	47
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccc(F)cc1	ZINC000819082857	EE	On-Demand	Anodyne	ADRB2	27	40
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1ccc(F)cc1	ZINC000819082857	EE	On-Demand	Anodyne	ADRB3	17	47
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccccc1Cl	ZINC000819082859	FF	On-Demand	Anodyne	DRD4	30	47
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccccc1Cl	ZINC000819082859	FF	On-Demand	Anodyne	EBP	24	40
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819082884	GD	On-Demand	Anodyne	ADRB2	35	40
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819082884	GD	On-Demand	Anodyne	ADRB1	42	41
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819082884	GD	On-Demand	Anodyne	ADRB3	128	51
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819082884	GD	On-Demand	Anodyne	C3AR1	41	41
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819082885	GD	On-Demand	Anodyne	ADRB2	35	40
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819082885	GD	On-Demand	Anodyne	ADRB1	42	41
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819082885	GD	On-Demand	Anodyne	ADRB3	128	51
O=S(=O)(Cc1ccccc1)N1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819082885	GD	On-Demand	Anodyne	C3AR1	41	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1ccccc1	ZINC000819082934	ED	On-Demand	Anodyne	DRD4	31	46
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1ccccc1	ZINC000819082934	ED	On-Demand	Anodyne	P2RX3	24	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1ccccc1	ZINC000819082934	ED	On-Demand	Anodyne	SORD	58	38
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccccc1	ZINC000819082935	ED	On-Demand	Anodyne	DRD4	31	46
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccccc1	ZINC000819082935	ED	On-Demand	Anodyne	P2RX3	24	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1ccccc1	ZINC000819082935	ED	On-Demand	Anodyne	SORD	58	38
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)C1CC1	ZINC000819082952	DC	On-Demand	Anodyne	DRD4	31	45
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)C1CC1	ZINC000819082955	DC	On-Demand	Anodyne	DRD4	31	45
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2ccccc2F)c1	ZINC000819082956	GD	On-Demand	Anodyne	ADRB1	16	40
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2ccccc2F)c1	ZINC000819082957	GD	On-Demand	Anodyne	ADRB1	16	40
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccc(F)cc1	ZINC000819082958	EE	On-Demand	Anodyne	ADRB2	27	40
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1ccc(F)cc1	ZINC000819082958	EE	On-Demand	Anodyne	ADRB3	17	47
O[C@H](CNCCc1ccc(Br)cc1)C1CC1	ZINC000819082959	CE	On-Demand	Anodyne	ADRB2	22	47
O[C@H](CNCCc1ccc(Br)cc1)C1CC1	ZINC000819082959	CE	On-Demand	Anodyne	ADRB1	28	42
O[C@H](CNCCc1ccc(Br)cc1)C1CC1	ZINC000819082959	CE	On-Demand	Anodyne	ADRB3	34	42
O[C@@H](CNCCc1ccc(Br)cc1)C1CC1	ZINC000819082960	CE	On-Demand	Anodyne	ADRB2	22	47
O[C@@H](CNCCc1ccc(Br)cc1)C1CC1	ZINC000819082960	CE	On-Demand	Anodyne	ADRB1	28	42
O[C@@H](CNCCc1ccc(Br)cc1)C1CC1	ZINC000819082960	CE	On-Demand	Anodyne	ADRB3	34	42
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1F	ZINC000819082975	GG	On-Demand	Anodyne	ADRA1D	28	40
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1F	ZINC000819082975	GG	On-Demand	Anodyne	ADRA1A	21	40
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1F	ZINC000819082975	GG	On-Demand	Anodyne	ADRA1B	22	40
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1F	ZINC000819082976	GG	On-Demand	Anodyne	ADRA1D	28	40
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1F	ZINC000819082976	GG	On-Demand	Anodyne	ADRA1A	21	40
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1F	ZINC000819082976	GG	On-Demand	Anodyne	ADRA1B	22	40
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1F	ZINC000819082977	GG	On-Demand	Anodyne	ADRA1D	28	40
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1F	ZINC000819082977	GG	On-Demand	Anodyne	ADRA1A	21	40
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1F	ZINC000819082977	GG	On-Demand	Anodyne	ADRA1B	22	40
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1F	ZINC000819082978	GG	On-Demand	Anodyne	ADRA1D	28	40
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1F	ZINC000819082978	GG	On-Demand	Anodyne	ADRA1A	21	40
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1ccc(F)cc1F	ZINC000819082978	GG	On-Demand	Anodyne	ADRA1B	22	40
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082992	GH	On-Demand	Anodyne	ADRB1	36	42
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082992	GH	On-Demand	Anodyne	ADRA1D	29	42
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082992	GH	On-Demand	Anodyne	ADRA1A	21	42
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082992	GH	On-Demand	Anodyne	ADRA1B	24	42
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082992	GH	On-Demand	Anodyne	ADRB3	57	43
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082992	GH	On-Demand	Anodyne	CYP3A4	49	39
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082993	GH	On-Demand	Anodyne	ADRB1	36	42
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082993	GH	On-Demand	Anodyne	ADRA1D	29	42
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082993	GH	On-Demand	Anodyne	ADRA1A	21	42
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082993	GH	On-Demand	Anodyne	ADRA1B	24	42
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082993	GH	On-Demand	Anodyne	ADRB3	57	43
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082993	GH	On-Demand	Anodyne	CYP3A4	49	39
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082994	GH	On-Demand	Anodyne	ADRB1	36	42
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082994	GH	On-Demand	Anodyne	ADRA1D	29	42
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082994	GH	On-Demand	Anodyne	ADRA1A	21	42
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082994	GH	On-Demand	Anodyne	ADRA1B	24	42
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082994	GH	On-Demand	Anodyne	ADRB3	57	43
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082994	GH	On-Demand	Anodyne	CYP3A4	49	39
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082995	GH	On-Demand	Anodyne	ADRB1	36	42
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082995	GH	On-Demand	Anodyne	ADRA1D	29	42
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082995	GH	On-Demand	Anodyne	ADRA1A	21	42
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082995	GH	On-Demand	Anodyne	ADRA1B	24	42
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082995	GH	On-Demand	Anodyne	ADRB3	57	43
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(Cl)c1	ZINC000819082995	GH	On-Demand	Anodyne	CYP3A4	49	39
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1c(F)cccc1F	ZINC000819083037	GG	On-Demand	Anodyne	ADRA1D	28	40
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1c(F)cccc1F	ZINC000819083037	GG	On-Demand	Anodyne	ADRA1A	20	40
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1c(F)cccc1F	ZINC000819083037	GG	On-Demand	Anodyne	ADRA1B	22	40
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1c(F)cccc1F	ZINC000819083038	GG	On-Demand	Anodyne	ADRA1D	28	40
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1c(F)cccc1F	ZINC000819083038	GG	On-Demand	Anodyne	ADRA1A	20	40
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1c(F)cccc1F	ZINC000819083038	GG	On-Demand	Anodyne	ADRA1B	22	40
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1c(F)cccc1F	ZINC000819083039	GG	On-Demand	Anodyne	ADRA1D	28	40
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1c(F)cccc1F	ZINC000819083039	GG	On-Demand	Anodyne	ADRA1A	20	40
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1c(F)cccc1F	ZINC000819083039	GG	On-Demand	Anodyne	ADRA1B	22	40
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1c(F)cccc1F	ZINC000819083040	GG	On-Demand	Anodyne	ADRA1D	28	40
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1c(F)cccc1F	ZINC000819083040	GG	On-Demand	Anodyne	ADRA1A	20	40
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1c(F)cccc1F	ZINC000819083040	GG	On-Demand	Anodyne	ADRA1B	22	40
C#CCNC(=O)CCNCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000819083041	FB	On-Demand	Mild	COLA	54	36
CN(C[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12)C(=O)OC(C)(C)C	ZINC000819083053	FF	On-Demand	Anodyne	HTR1A	17	45
CN(C[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12)C(=O)OC(C)(C)C	ZINC000819083053	FF	On-Demand	Anodyne	HTR1D	22	40
CN(C[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12)C(=O)OC(C)(C)C	ZINC000819083053	FF	On-Demand	Anodyne	HTR1B	19	40
CN(C[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12)C(=O)OC(C)(C)C	ZINC000819083053	FF	On-Demand	Anodyne	SLC6A4	21	50
CN(C[C@@H](O)CNCCc1c[nH]c2ccc(F)cc12)C(=O)OC(C)(C)C	ZINC000819083053	FF	On-Demand	Anodyne	MPO	101	51
CN(C[C@H](O)CNCCc1c[nH]c2ccc(F)cc12)C(=O)OC(C)(C)C	ZINC000819083054	FF	On-Demand	Anodyne	HTR1A	17	45
CN(C[C@H](O)CNCCc1c[nH]c2ccc(F)cc12)C(=O)OC(C)(C)C	ZINC000819083054	FF	On-Demand	Anodyne	HTR1D	22	40
CN(C[C@H](O)CNCCc1c[nH]c2ccc(F)cc12)C(=O)OC(C)(C)C	ZINC000819083054	FF	On-Demand	Anodyne	HTR1B	19	40
CN(C[C@H](O)CNCCc1c[nH]c2ccc(F)cc12)C(=O)OC(C)(C)C	ZINC000819083054	FF	On-Demand	Anodyne	SLC6A4	21	50
CN(C[C@H](O)CNCCc1c[nH]c2ccc(F)cc12)C(=O)OC(C)(C)C	ZINC000819083054	FF	On-Demand	Anodyne	MPO	101	51
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819083058	FC	On-Demand	Anodyne	ADRB2	37	47
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819083058	FC	On-Demand	Anodyne	ADRB1	44	47
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819083058	FC	On-Demand	Anodyne	ADRB3	125	52
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819083058	FC	On-Demand	Anodyne	TBXAS1	37	41
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819083059	FC	On-Demand	Anodyne	ADRB2	37	47
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819083059	FC	On-Demand	Anodyne	ADRB1	44	47
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819083059	FC	On-Demand	Anodyne	ADRB3	125	52
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819083059	FC	On-Demand	Anodyne	TBXAS1	37	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1c(F)cccc1F	ZINC000819083060	GE	On-Demand	Anodyne	DRD4	31	45
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1c(F)cccc1F	ZINC000819083060	GE	On-Demand	Anodyne	P2RX3	21	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@@H](O)c1c(F)cccc1F	ZINC000819083060	GE	On-Demand	Anodyne	EBP	24	43
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1c(F)cccc1F	ZINC000819083062	GE	On-Demand	Anodyne	DRD4	31	45
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1c(F)cccc1F	ZINC000819083062	GE	On-Demand	Anodyne	P2RX3	21	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC[C@H](O)c1c(F)cccc1F	ZINC000819083062	GE	On-Demand	Anodyne	EBP	24	43
O=C(NCCNS(=O)(=O)c1cccc(Cl)c1)C(F)=C1CCC1	ZINC000819083064	EE	On-Demand	Anodyne	FBP1	25	41
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819083065	GF	On-Demand	Anodyne	PREP	22	60
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819083066	GF	On-Demand	Anodyne	PREP	22	60
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1cccc(NS(C)(=O)=O)c1	ZINC000819083091	GE	On-Demand	Anodyne	PREP	16	42
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819083095	GE	On-Demand	Anodyne	ADRB2	28	40
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819083095	GE	On-Demand	Anodyne	ADRB1	16	40
COCCNS(=O)(=O)c1cccc(CNC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819083095	GE	On-Demand	Anodyne	ADRB3	26	40
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819083096	GE	On-Demand	Anodyne	ADRB2	28	40
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819083096	GE	On-Demand	Anodyne	ADRB1	16	40
COCCNS(=O)(=O)c1cccc(CNC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819083096	GE	On-Demand	Anodyne	ADRB3	26	40
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819083147	GF	On-Demand	Anodyne	ADRB1	55	43
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819083147	GF	On-Demand	Anodyne	ADRB3	40	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819083148	GF	On-Demand	Anodyne	ADRB1	55	43
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819083148	GF	On-Demand	Anodyne	ADRB3	40	42
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819083149	GF	On-Demand	Anodyne	ADRB1	55	43
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)ncc32)cc1	ZINC000819083149	GF	On-Demand	Anodyne	ADRB3	40	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819083150	GF	On-Demand	Anodyne	ADRB1	55	43
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)ncc32)cc1	ZINC000819083150	GF	On-Demand	Anodyne	ADRB3	40	42
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(F)c1	ZINC000819083159	FG	On-Demand	Anodyne	SLC6A2	15	41
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(F)c1	ZINC000819083159	FG	On-Demand	Anodyne	ADRA1D	28	41
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(F)c1	ZINC000819083159	FG	On-Demand	Anodyne	ADRA1A	21	41
O[C@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(F)c1	ZINC000819083159	FG	On-Demand	Anodyne	ADRA1B	22	41
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(F)c1	ZINC000819083160	FG	On-Demand	Anodyne	SLC6A2	15	41
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(F)c1	ZINC000819083160	FG	On-Demand	Anodyne	ADRA1D	28	41
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(F)c1	ZINC000819083160	FG	On-Demand	Anodyne	ADRA1A	21	41
O[C@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(F)c1	ZINC000819083160	FG	On-Demand	Anodyne	ADRA1B	22	41
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(F)c1	ZINC000819083161	FG	On-Demand	Anodyne	SLC6A2	15	41
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(F)c1	ZINC000819083161	FG	On-Demand	Anodyne	ADRA1D	28	41
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(F)c1	ZINC000819083161	FG	On-Demand	Anodyne	ADRA1A	21	41
O[C@@H](CN[C@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(F)c1	ZINC000819083161	FG	On-Demand	Anodyne	ADRA1B	22	41
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(F)c1	ZINC000819083162	FG	On-Demand	Anodyne	SLC6A2	15	41
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(F)c1	ZINC000819083162	FG	On-Demand	Anodyne	ADRA1D	28	41
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(F)c1	ZINC000819083162	FG	On-Demand	Anodyne	ADRA1A	21	41
O[C@@H](CN[C@@H]1CCN(c2ccccc2OC(F)F)C1)c1cccc(F)c1	ZINC000819083162	FG	On-Demand	Anodyne	ADRA1B	22	41
CCN(Cc1cccc(Cl)c1)C(=O)C(F)=C1CCC1	ZINC000819083163	CI	On-Demand	Anodyne	PDS	21	43
COc1ccc(N2CCN(C(=O)CNc3ccc4ccnc(O)c4c3)CC2)cc1	ZINC000819083171	GF	On-Demand	Clean	PDGFRB	45	36
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819083172	GD	On-Demand	Bother	COLA	46	37
O[C@@H](CNCCc1ccc(Br)cc1)c1ccc(F)cn1	ZINC000819083174	EF	On-Demand	Anodyne	ADRB2	38	46
O[C@@H](CNCCc1ccc(Br)cc1)c1ccc(F)cn1	ZINC000819083174	EF	On-Demand	Anodyne	ADRB3	78	45
O[C@H](CNCCc1ccc(Br)cc1)c1ccc(F)cn1	ZINC000819083175	EF	On-Demand	Anodyne	ADRB2	38	46
O[C@H](CNCCc1ccc(Br)cc1)c1ccc(F)cn1	ZINC000819083175	EF	On-Demand	Anodyne	ADRB3	78	45
O[C@@H](CNCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819083176	CE	On-Demand	Anodyne	HTR1A	25	49
O[C@@H](CNCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819083176	CE	On-Demand	Anodyne	HTR1D	66	41
O[C@@H](CNCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819083176	CE	On-Demand	Anodyne	HTR1B	58	44
O[C@@H](CNCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819083176	CE	On-Demand	Anodyne	SLC6A4	33	63
O[C@@H](CNCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819083176	CE	On-Demand	Anodyne	MPO	121	63
O[C@H](CNCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819083177	CE	On-Demand	Anodyne	HTR1A	25	49
O[C@H](CNCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819083177	CE	On-Demand	Anodyne	HTR1D	66	41
O[C@H](CNCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819083177	CE	On-Demand	Anodyne	HTR1B	58	44
O[C@H](CNCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819083177	CE	On-Demand	Anodyne	SLC6A4	33	63
O[C@H](CNCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819083177	CE	On-Demand	Anodyne	MPO	121	63
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819083193	GF	On-Demand	Anodyne	ADRB2	29	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819083193	GF	On-Demand	Anodyne	ADRB1	21	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819083193	GF	On-Demand	Anodyne	HTR1A	15	46
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819083193	GF	On-Demand	Anodyne	SLC6A4	19	55
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819083193	GF	On-Demand	Anodyne	ADRB3	54	51
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819083193	GF	On-Demand	Anodyne	MPO	108	56
CS(=O)(=O)c1ccc([C@H](O)CNCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819083194	GF	On-Demand	Anodyne	ADRB2	29	43
CS(=O)(=O)c1ccc([C@H](O)CNCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819083194	GF	On-Demand	Anodyne	ADRB1	21	43
CS(=O)(=O)c1ccc([C@H](O)CNCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819083194	GF	On-Demand	Anodyne	HTR1A	15	46
CS(=O)(=O)c1ccc([C@H](O)CNCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819083194	GF	On-Demand	Anodyne	SLC6A4	19	55
CS(=O)(=O)c1ccc([C@H](O)CNCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819083194	GF	On-Demand	Anodyne	ADRB3	54	51
CS(=O)(=O)c1ccc([C@H](O)CNCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819083194	GF	On-Demand	Anodyne	MPO	108	56
COCc1cc(Cl)ccc1NCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000819083195	GG	On-Demand	Anodyne	F10	22	48
COCc1cc(Cl)ccc1NCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000819083195	GG	On-Demand	Anodyne	PIK3CB	16	44
COCc1cc(Cl)ccc1NCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000819083195	GG	On-Demand	Anodyne	STAT6	54	34
CCOC(=O)N1CCN(C(=O)CNc2ccc3ccnc(O)c3c2)CC1	ZINC000819083203	FD	On-Demand	Anodyne	P2RY12	71	43
CN(C)CC[C@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C(C)(C)C	ZINC000819083223	GF	On-Demand	Anodyne	GPR119	25	41
CN(C)CC[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C(C)(C)C	ZINC000819083224	GF	On-Demand	Anodyne	GPR119	25	41
CN(C)CC[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C(C)(C)C	ZINC000819083225	GF	On-Demand	Anodyne	GPR119	25	41
CN(C)CC[C@@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C(C)(C)C	ZINC000819083226	GF	On-Demand	Anodyne	GPR119	25	41
CN(C)CC[C@H](NC[C@@H](O)c1cccnc1)C(C)(C)C	ZINC000819083243	CE	On-Demand	Anodyne	ADRB1	17	46
CN(C)CC[C@H](NC[C@@H](O)c1cccnc1)C(C)(C)C	ZINC000819083243	CE	On-Demand	Anodyne	ADRB3	49	46
CN(C)CC[C@H](NC[C@H](O)c1cccnc1)C(C)(C)C	ZINC000819083244	CE	On-Demand	Anodyne	ADRB1	17	46
CN(C)CC[C@H](NC[C@H](O)c1cccnc1)C(C)(C)C	ZINC000819083244	CE	On-Demand	Anodyne	ADRB3	49	46
CN(C)CC[C@@H](NC[C@@H](O)c1cccnc1)C(C)(C)C	ZINC000819083245	CE	On-Demand	Anodyne	ADRB1	17	46
CN(C)CC[C@@H](NC[C@@H](O)c1cccnc1)C(C)(C)C	ZINC000819083245	CE	On-Demand	Anodyne	ADRB3	49	46
CN(C)CC[C@@H](NC[C@H](O)c1cccnc1)C(C)(C)C	ZINC000819083246	CE	On-Demand	Anodyne	ADRB1	17	46
CN(C)CC[C@@H](NC[C@H](O)c1cccnc1)C(C)(C)C	ZINC000819083246	CE	On-Demand	Anodyne	ADRB3	49	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2Cc3ccccc3C2)CC1	ZINC000819083253	FF	On-Demand	Anodyne	GRIN2B	19	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2Cc3ccccc3C2)CC1	ZINC000819083253	FF	On-Demand	Anodyne	GPR119	52	51
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2Cc3ccccc3C2)CC1	ZINC000819083253	FF	On-Demand	Anodyne	SFRP1	27	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2Cc3ccccc3C2)CC1	ZINC000819083254	FF	On-Demand	Anodyne	GRIN2B	19	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2Cc3ccccc3C2)CC1	ZINC000819083254	FF	On-Demand	Anodyne	GPR119	52	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2Cc3ccccc3C2)CC1	ZINC000819083254	FF	On-Demand	Anodyne	SFRP1	27	43
Cc1ccccc1[C@@H](O)CNCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000819083260	GD	On-Demand	Bother	COLA	65	36
Cc1ncc2c(n1)CCC[C@@H]2NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819083272	GG	On-Demand	Anodyne	PDS	40	35
Cc1ncc2c(n1)CCC[C@H]2NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819083273	GG	On-Demand	Anodyne	PDS	40	35
Cc1ncc2c(n1)CCC[C@H]2NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819083274	GG	On-Demand	Anodyne	PDS	40	35
Cc1ncc2c(n1)CCC[C@@H]2NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819083275	GG	On-Demand	Anodyne	PDS	40	35
C[C@H]1[C@H](C(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)CCN1C(=O)OC(C)(C)C	ZINC000819083276	HH	On-Demand	Anodyne	MC4R	26	41
Cn1nc(C(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)c2ccccc2c1=O	ZINC000819083303	GF	On-Demand	Anodyne	IMDH_CRYPV	19	40
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNC[C@H](O)c1cccnc1	ZINC000819083325	FC	On-Demand	Bother	ADRB2	27	47
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNC[C@H](O)c1cccnc1	ZINC000819083325	FC	On-Demand	Bother	ADRB1	27	46
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNC[C@H](O)c1cccnc1	ZINC000819083325	FC	On-Demand	Bother	ADRB3	111	49
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNC[C@H](O)c1cccnc1	ZINC000819083325	FC	On-Demand	Bother	TBXAS1	24	45
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNC[C@@H](O)c1cccnc1	ZINC000819083327	FC	On-Demand	Bother	ADRB2	27	47
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNC[C@@H](O)c1cccnc1	ZINC000819083327	FC	On-Demand	Bother	ADRB1	27	46
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNC[C@@H](O)c1cccnc1	ZINC000819083327	FC	On-Demand	Bother	ADRB3	111	49
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCNC[C@@H](O)c1cccnc1	ZINC000819083327	FC	On-Demand	Bother	TBXAS1	24	45
O=C(CCn1c(S)nc2ccccc2c1=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083328	IG	On-Demand	Anodyne	GRIN2D	54	30
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083334	FI	On-Demand	Anodyne	MC4R	81	46
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083334	FI	On-Demand	Anodyne	CCR1	44	47
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083334	FI	On-Demand	Anodyne	MC3R	30	40
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083334	FI	On-Demand	Anodyne	MC5R	42	40
CN(C)CC[C@H](NC[C@@H](O)c1ccc(F)c(F)c1)C(C)(C)C	ZINC000819083343	DF	On-Demand	Anodyne	UTS2	41	32
CN(C)CC[C@H](NC[C@H](O)c1ccc(F)c(F)c1)C(C)(C)C	ZINC000819083344	DF	On-Demand	Anodyne	UTS2	41	32
CN(C)CC[C@@H](NC[C@@H](O)c1ccc(F)c(F)c1)C(C)(C)C	ZINC000819083346	DF	On-Demand	Anodyne	UTS2	41	32
CN(C)CC[C@@H](NC[C@H](O)c1ccc(F)c(F)c1)C(C)(C)C	ZINC000819083347	DF	On-Demand	Anodyne	UTS2	41	32
CC[C@H]1OCC[C@H]1C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083352	DG	On-Demand	Anodyne	MC4R	30	42
O=C(OCc1ccccc1)N1CCC(C(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)CC1	ZINC000819083359	II	On-Demand	Anodyne	GRIN2B	19	43
O=C(OCc1ccccc1)N1CCC(C(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)CC1	ZINC000819083359	II	On-Demand	Anodyne	CCR1	26	40
O=C(OCc1ccccc1)N1CCC(C(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)CC1	ZINC000819083359	II	On-Demand	Anodyne	PREP	29	42
O=C(c1cc(-c2ccccn2)nc2ccccc12)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083378	IK	On-Demand	Anodyne	METAP1	46	39
O=C(c1cc(-c2ccncc2)nc2ccccc12)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083382	IK	On-Demand	Anodyne	PRS	37	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	ACE	30	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	CELA1	19	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	ELANE	29	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	MC4R	44	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	CTRA_BOVIN	53	31
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	KLK3	76	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	CTSB	58	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	PAPA1_CARPA	61	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	CYSP_TRYCR	53	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	CTSG	40	31
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	CTSK	40	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	CTSL	44	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	CCR1	45	49
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	CAPNS1	61	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	CELA2A	40	31
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	CAPN1	75	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	CAPN2	125	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	TGM2	29	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	DPP7	47	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083391	HH	On-Demand	Anodyne	NPR	59	32
O=C(c1cc([N+](=O)[O-])ccc1N1CCOCC1)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083399	IG	On-Demand	Bother	SLC6A9	18	68
O=C([C@@H](O)[C@H](O)c1nc2ccccc2s1)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083420	HF	On-Demand	Anodyne	CCR1	23	45
O=C([C@@H](O)[C@@H](O)c1nc2ccccc2s1)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083422	HF	On-Demand	Anodyne	CCR1	23	45
CCN(Cc1ccccc1Cl)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819083425	GI	On-Demand	Mild	PAPA1_CARPA	53	45
CCN(Cc1ccccc1Cl)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819083425	GI	On-Demand	Mild	CTSK	22	43
CCN(Cc1ccccc1Cl)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819083425	GI	On-Demand	Mild	FPR1	43	36
CCN(Cc1ccccc1Cl)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819083426	GI	On-Demand	Mild	PAPA1_CARPA	53	45
CCN(Cc1ccccc1Cl)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819083426	GI	On-Demand	Mild	CTSK	22	43
CCN(Cc1ccccc1Cl)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819083426	GI	On-Demand	Mild	FPR1	43	36
O=C(/C=C\c1ccccc1F)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083451	EI	On-Demand	Anodyne	ITGAL	55	37
O=C(/C=C/c1ccccc1F)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083452	EI	On-Demand	Anodyne	ITGAL	55	37
COc1ccc2c(C)c(CCC(=O)N3CCO[C@@H](c4ccc(Cl)cc4)C3)c(=O)oc2c1	ZINC000819083458	II	On-Demand	Anodyne	MAOB	27	41
C=CCOc1ccc(/C=C\C(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)cc1OC	ZINC000819083460	HJ	On-Demand	Mild	ITGAL	16	41
C=CCOc1ccc(/C=C/C(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)cc1OC	ZINC000819083461	HJ	On-Demand	Mild	ITGAL	16	41
CCOC(=O)N[C@H](C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1)C(C)C	ZINC000819083466	FG	On-Demand	Anodyne	CCR1	78	52
CCOC(=O)N[C@@H](C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1)C(C)C	ZINC000819083468	FG	On-Demand	Anodyne	CCR1	78	52
O=C(/C=C\c1ccc2c(c1)OCO2)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083505	FH	On-Demand	Anodyne	ITGAL	22	43
O=C(/C=C/c1ccc2c(c1)OCO2)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819083507	FH	On-Demand	Anodyne	ITGAL	22	43
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)CC1	ZINC000819083526	HH	On-Demand	Anodyne	GPR119	43	39
C/C(=C/C(=O)N1CCO[C@@H](c2ccc(Cl)cc2)C1)c1ccccc1	ZINC000819083535	EI	On-Demand	Anodyne	CCR1	35	42
CCOc1cc(CCCNC[C@H](O)c2c(F)cccc2F)ccc1OC	ZINC000819083696	FH	On-Demand	Anodyne	ADRB1	28	40
CCOc1cc(CCCNC[C@H](O)c2c(F)cccc2F)ccc1OC	ZINC000819083696	FH	On-Demand	Anodyne	ADRB3	18	41
CCOc1cc(CCCNC[C@@H](O)c2c(F)cccc2F)ccc1OC	ZINC000819083697	FH	On-Demand	Anodyne	ADRB1	28	40
CCOc1cc(CCCNC[C@@H](O)c2c(F)cccc2F)ccc1OC	ZINC000819083697	FH	On-Demand	Anodyne	ADRB3	18	41
CCOc1cc(CCCNC[C@@H](O)c2cccc(F)c2)ccc1OC	ZINC000819083722	EG	On-Demand	Anodyne	ADRB2	65	37
CCOc1cc(CCCNC[C@@H](O)c2cccc(F)c2)ccc1OC	ZINC000819083722	EG	On-Demand	Anodyne	ADRB1	56	46
CCOc1cc(CCCNC[C@@H](O)c2cccc(F)c2)ccc1OC	ZINC000819083722	EG	On-Demand	Anodyne	ADRB3	60	46
CCOc1cc(CCCNC[C@H](O)c2cccc(F)c2)ccc1OC	ZINC000819083723	EG	On-Demand	Anodyne	ADRB2	65	37
CCOc1cc(CCCNC[C@H](O)c2cccc(F)c2)ccc1OC	ZINC000819083723	EG	On-Demand	Anodyne	ADRB1	56	46
CCOc1cc(CCCNC[C@H](O)c2cccc(F)c2)ccc1OC	ZINC000819083723	EG	On-Demand	Anodyne	ADRB3	60	46
CCOc1cc(CCCNC[C@@H](O)c2ccccc2F)ccc1OC	ZINC000819083778	EG	On-Demand	Anodyne	ADRB2	45	36
CCOc1cc(CCCNC[C@@H](O)c2ccccc2F)ccc1OC	ZINC000819083778	EG	On-Demand	Anodyne	ADRB1	37	40
CCOc1cc(CCCNC[C@@H](O)c2ccccc2F)ccc1OC	ZINC000819083778	EG	On-Demand	Anodyne	ADRB3	27	41
CCOc1cc(CCCNC[C@H](O)c2ccccc2F)ccc1OC	ZINC000819083779	EG	On-Demand	Anodyne	ADRB2	45	36
CCOc1cc(CCCNC[C@H](O)c2ccccc2F)ccc1OC	ZINC000819083779	EG	On-Demand	Anodyne	ADRB1	37	40
CCOc1cc(CCCNC[C@H](O)c2ccccc2F)ccc1OC	ZINC000819083779	EG	On-Demand	Anodyne	ADRB3	27	41
CCOc1cc(CCCNC[C@@H](O)c2ccc(F)cc2)ccc1OC	ZINC000819083827	EG	On-Demand	Anodyne	ADRB2	67	40
CCOc1cc(CCCNC[C@@H](O)c2ccc(F)cc2)ccc1OC	ZINC000819083827	EG	On-Demand	Anodyne	ADRB1	47	40
CCOc1cc(CCCNC[C@@H](O)c2ccc(F)cc2)ccc1OC	ZINC000819083827	EG	On-Demand	Anodyne	ADRB3	44	48
CCOc1cc(CCCNC[C@@H](O)c2ccc(F)cc2)ccc1OC	ZINC000819083827	EG	On-Demand	Anodyne	LEF	40	36
CCOc1cc(CCCNC[C@H](O)c2ccc(F)cc2)ccc1OC	ZINC000819083828	EG	On-Demand	Anodyne	ADRB2	67	40
CCOc1cc(CCCNC[C@H](O)c2ccc(F)cc2)ccc1OC	ZINC000819083828	EG	On-Demand	Anodyne	ADRB1	47	40
CCOc1cc(CCCNC[C@H](O)c2ccc(F)cc2)ccc1OC	ZINC000819083828	EG	On-Demand	Anodyne	ADRB3	44	48
CCOc1cc(CCCNC[C@H](O)c2ccc(F)cc2)ccc1OC	ZINC000819083828	EG	On-Demand	Anodyne	LEF	40	36
CCCCCOc1ccc([C@H]2NC(=O)[C@H]3Cn4c(C)nnc4CN23)cc1	ZINC000819083886	FE	On-Demand	Anodyne	PLA2G4B	42	29
CCCCCOc1ccc([C@@H]2NC(=O)[C@@H]3Cn4c(C)nnc4CN32)cc1	ZINC000819083887	FE	On-Demand	Anodyne	PLA2G4B	42	29
CCCCCOc1ccc([C@@H]2NC(=O)[C@H]3Cn4c(C)nnc4CN32)cc1	ZINC000819083888	FE	On-Demand	Anodyne	PLA2G4B	42	29
CCCCCOc1ccc([C@H]2NC(=O)[C@@H]3Cn4c(C)nnc4CN32)cc1	ZINC000819083889	FE	On-Demand	Anodyne	PLA2G4B	42	29
CCOc1cc(CCCNC[C@@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819083922	FI	On-Demand	Anodyne	ADRB2	81	43
CCOc1cc(CCCNC[C@@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819083922	FI	On-Demand	Anodyne	ADRB1	79	60
CCOc1cc(CCCNC[C@@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819083922	FI	On-Demand	Anodyne	ADRB3	88	60
CCOc1cc(CCCNC[C@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819083923	FI	On-Demand	Anodyne	ADRB2	81	43
CCOc1cc(CCCNC[C@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819083923	FI	On-Demand	Anodyne	ADRB1	79	60
CCOc1cc(CCCNC[C@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819083923	FI	On-Demand	Anodyne	ADRB3	88	60
CCOc1cc(CCCNC[C@H](O)c2ccc(C#N)cc2)ccc1OC	ZINC000819083996	FG	On-Demand	Mild	ADRB2	49	39
CCOc1cc(CCCNC[C@H](O)c2ccc(C#N)cc2)ccc1OC	ZINC000819083996	FG	On-Demand	Mild	ADRB3	30	46
CCOc1cc(CCCNC[C@@H](O)c2ccc(C#N)cc2)ccc1OC	ZINC000819083997	FG	On-Demand	Mild	ADRB2	49	39
CCOc1cc(CCCNC[C@@H](O)c2ccc(C#N)cc2)ccc1OC	ZINC000819083997	FG	On-Demand	Mild	ADRB3	30	46
Oc1ccc(CCCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819084017	CF	On-Demand	Anodyne	ADRB2	78	47
Oc1ccc(CCCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819084017	CF	On-Demand	Anodyne	ADRB1	78	49
Oc1ccc(CCCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819084017	CF	On-Demand	Anodyne	ADRB3	114	49
Oc1ccc(CCCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819084018	CF	On-Demand	Anodyne	ADRB2	78	47
Oc1ccc(CCCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819084018	CF	On-Demand	Anodyne	ADRB1	78	49
Oc1ccc(CCCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819084018	CF	On-Demand	Anodyne	ADRB3	114	49
CON(C)C(=O)CCNCCCc1ccc(O)cc1	ZINC000819084019	CD	On-Demand	Anodyne	GRIA1	58	37
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819084024	GG	On-Demand	Mild	CTSD	16	45
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819084024	GG	On-Demand	Mild	PAPA1_CARPA	57	54
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819084024	GG	On-Demand	Mild	CTSL	20	54
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819084024	GG	On-Demand	Mild	FURIN	46	31
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819084024	GG	On-Demand	Mild	CTSS	17	54
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819084024	GG	On-Demand	Mild	FPR1	42	38
CCC1CCC(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819084030	FI	On-Demand	Mild	PAPA1_CARPA	33	43
CCC1CCC(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819084031	FI	On-Demand	Mild	PAPA1_CARPA	33	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCCNc2ccccn2)cc1	ZINC000819084032	ED	On-Demand	Anodyne	ADRB2	30	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCCNc2ccccn2)cc1	ZINC000819084032	ED	On-Demand	Anodyne	ADRB3	64	38
CS(=O)(=O)c1ccc([C@H](O)CNCCCNc2ccccn2)cc1	ZINC000819084033	ED	On-Demand	Anodyne	ADRB2	30	41
CS(=O)(=O)c1ccc([C@H](O)CNCCCNc2ccccn2)cc1	ZINC000819084033	ED	On-Demand	Anodyne	ADRB3	64	38
O=[N+]([O-])c1ccc([C@@H](O)CNCCCc2ccc(O)cc2)cc1	ZINC000819084057	DF	On-Demand	Bother	ADRB2	61	47
O=[N+]([O-])c1ccc([C@@H](O)CNCCCc2ccc(O)cc2)cc1	ZINC000819084057	DF	On-Demand	Bother	ADRB1	61	43
O=[N+]([O-])c1ccc([C@@H](O)CNCCCc2ccc(O)cc2)cc1	ZINC000819084057	DF	On-Demand	Bother	ADRB3	76	43
O=[N+]([O-])c1ccc([C@H](O)CNCCCc2ccc(O)cc2)cc1	ZINC000819084058	DF	On-Demand	Bother	ADRB2	61	47
O=[N+]([O-])c1ccc([C@H](O)CNCCCc2ccc(O)cc2)cc1	ZINC000819084058	DF	On-Demand	Bother	ADRB1	61	43
O=[N+]([O-])c1ccc([C@H](O)CNCCCc2ccc(O)cc2)cc1	ZINC000819084058	DF	On-Demand	Bother	ADRB3	76	43
Oc1ccc(CCCNC[C@H](O)c2cccnc2)cc1	ZINC000819084059	CE	On-Demand	Anodyne	ADRB2	81	57
Oc1ccc(CCCNC[C@H](O)c2cccnc2)cc1	ZINC000819084059	CE	On-Demand	Anodyne	ADRB1	89	49
Oc1ccc(CCCNC[C@H](O)c2cccnc2)cc1	ZINC000819084059	CE	On-Demand	Anodyne	ADRB3	178	57
Oc1ccc(CCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819084060	CE	On-Demand	Anodyne	ADRB2	81	57
Oc1ccc(CCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819084060	CE	On-Demand	Anodyne	ADRB1	89	49
Oc1ccc(CCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819084060	CE	On-Demand	Anodyne	ADRB3	178	57
Oc1ccc(CCCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819084101	DG	On-Demand	Anodyne	ADRB2	72	46
Oc1ccc(CCCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819084101	DG	On-Demand	Anodyne	ADRB1	67	46
Oc1ccc(CCCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819084101	DG	On-Demand	Anodyne	ADRB3	55	45
Oc1ccc(CCCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819084101	DG	On-Demand	Anodyne	GRIA1	40	34
Oc1ccc(CCCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819084101	DG	On-Demand	Anodyne	SLC6A5	27	44
N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819084113	DF	On-Demand	Mild	ADRB1	46	38
N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819084113	DF	On-Demand	Mild	F7	17	40
N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819084114	DF	On-Demand	Mild	ADRB1	46	38
N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819084114	DF	On-Demand	Mild	F7	17	40
N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCC(=O)O)cc1Cl	ZINC000819084119	FH	On-Demand	Mild	ADRB1	42	32
N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCC(=O)O)cc1Cl	ZINC000819084120	FH	On-Demand	Mild	ADRB1	42	32
Cn1nnc2cc(CN3CCC(C(=O)O)CC3)ccc21	ZINC000819084121	CD	On-Demand	Anodyne	SIGMAR1	28	41
Cn1nnc2cc(CN3CCC(C(=O)O)CC3)ccc21	ZINC000819084121	CD	On-Demand	Anodyne	SSTR5	54	34
Cn1nnc2cc(CN3CCC(C(=O)O)CC3)ccc21	ZINC000819084121	CD	On-Demand	Anodyne	S1PR1	27	42
Cn1nc2c(cc1=O)CN(C(=O)Nc1ccccc1CC(=O)O)CC2	ZINC000819084128	EC	On-Demand	Anodyne	P2RY14	40	34
Cn1ncc2c(=O)n(CN3CCO[C@@H](C(=O)O)C3)nnc21	ZINC000819084131	CA	On-Demand	Anodyne	Q9M629_MAIZE	59	35
Cn1ncc2c(=O)n(CN3CCO[C@H](C(=O)O)C3)nnc21	ZINC000819084133	CA	On-Demand	Anodyne	Q9M629_MAIZE	59	35
O[C@H](CNC1CCN(C[C@@H]2CCOC2)CC1)c1ccccc1C(F)(F)F	ZINC000819084134	FF	On-Demand	Anodyne	SFRP1	41	34
O[C@@H](CNC1CCN(C[C@H]2CCOC2)CC1)c1ccccc1C(F)(F)F	ZINC000819084136	FF	On-Demand	Anodyne	SFRP1	41	34
O[C@@H](CNC1CCN(C[C@@H]2CCOC2)CC1)c1ccccc1C(F)(F)F	ZINC000819084137	FF	On-Demand	Anodyne	SFRP1	41	34
O[C@H](CNC1CCN(C[C@H]2CCOC2)CC1)c1ccccc1C(F)(F)F	ZINC000819084138	FF	On-Demand	Anodyne	SFRP1	41	34
O[C@H](CNC1CCN(C[C@@H]2CCOC2)CC1)c1cccc(Cl)c1	ZINC000819084140	EE	On-Demand	Anodyne	ADRB1	32	43
O[C@H](CNC1CCN(C[C@@H]2CCOC2)CC1)c1cccc(Cl)c1	ZINC000819084140	EE	On-Demand	Anodyne	ADRB3	49	46
O[C@H](CNC1CCN(C[C@@H]2CCOC2)CC1)c1cccc(Cl)c1	ZINC000819084140	EE	On-Demand	Anodyne	IGF1R	29	40
O[C@H](CNC1CCN(C[C@@H]2CCOC2)CC1)c1cccc(Cl)c1	ZINC000819084140	EE	On-Demand	Anodyne	CYP3A4	50	40
O[C@@H](CNC1CCN(C[C@H]2CCOC2)CC1)c1cccc(Cl)c1	ZINC000819084142	EE	On-Demand	Anodyne	ADRB1	32	43
O[C@@H](CNC1CCN(C[C@H]2CCOC2)CC1)c1cccc(Cl)c1	ZINC000819084142	EE	On-Demand	Anodyne	ADRB3	49	46
O[C@@H](CNC1CCN(C[C@H]2CCOC2)CC1)c1cccc(Cl)c1	ZINC000819084142	EE	On-Demand	Anodyne	IGF1R	29	40
O[C@@H](CNC1CCN(C[C@H]2CCOC2)CC1)c1cccc(Cl)c1	ZINC000819084142	EE	On-Demand	Anodyne	CYP3A4	50	40
O[C@@H](CNC1CCN(C[C@@H]2CCOC2)CC1)c1cccc(Cl)c1	ZINC000819084144	EE	On-Demand	Anodyne	ADRB1	32	43
O[C@@H](CNC1CCN(C[C@@H]2CCOC2)CC1)c1cccc(Cl)c1	ZINC000819084144	EE	On-Demand	Anodyne	ADRB3	49	46
O[C@@H](CNC1CCN(C[C@@H]2CCOC2)CC1)c1cccc(Cl)c1	ZINC000819084144	EE	On-Demand	Anodyne	IGF1R	29	40
O[C@@H](CNC1CCN(C[C@@H]2CCOC2)CC1)c1cccc(Cl)c1	ZINC000819084144	EE	On-Demand	Anodyne	CYP3A4	50	40
O[C@H](CNC1CCN(C[C@H]2CCOC2)CC1)c1cccc(Cl)c1	ZINC000819084146	EE	On-Demand	Anodyne	ADRB1	32	43
O[C@H](CNC1CCN(C[C@H]2CCOC2)CC1)c1cccc(Cl)c1	ZINC000819084146	EE	On-Demand	Anodyne	ADRB3	49	46
O[C@H](CNC1CCN(C[C@H]2CCOC2)CC1)c1cccc(Cl)c1	ZINC000819084146	EE	On-Demand	Anodyne	IGF1R	29	40
O[C@H](CNC1CCN(C[C@H]2CCOC2)CC1)c1cccc(Cl)c1	ZINC000819084146	EE	On-Demand	Anodyne	CYP3A4	50	40
Cn1nc2c(cc1=O)CN(C(=O)NCc1ccc(C(=O)O)cc1)CC2	ZINC000819084152	EC	On-Demand	Anodyne	MAPK1	21	41
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	DHFR	41	35
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	ACE	58	43
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	MME	120	41
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	ANPEP	56	38
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	CMA1	48	33
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	CTRA_BOVIN	42	43
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	PAPA1_CARPA	30	41
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	CYSP_TRYCR	43	35
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	CCKAR	17	48
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	CTSL	34	43
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	CPA1	48	39
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	ITGA4	61	42
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	NAALAD2	24	42
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	ECE1	47	37
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	CTSS	19	43
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	CAPN1	54	44
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	MMP9	15	42
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	ACE2	101	39
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	CTSV	53	37
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	PIN1	54	40
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	MMP1	19	42
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	FPR1	76	38
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	NPPA	43	35
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	CTRB_BOVIN	43	31
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	PSMB5	42	36
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	BLA1_STEMA	86	49
Cn1ncc2cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)cnc21	ZINC000819084154	DD	On-Demand	Anodyne	BRCA1	53	34
N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccccc1CC(=O)O	ZINC000819084156	FH	On-Demand	Mild	KCNQ2	43	34
N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccccc1CC(=O)O	ZINC000819084156	FH	On-Demand	Mild	DPP4	20	40
N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccccc1CC(=O)O	ZINC000819084156	FH	On-Demand	Mild	LGMN	50	37
N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccccc1CC(=O)O	ZINC000819084157	FH	On-Demand	Mild	KCNQ2	43	34
N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccccc1CC(=O)O	ZINC000819084157	FH	On-Demand	Mild	DPP4	20	40
N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccccc1CC(=O)O	ZINC000819084157	FH	On-Demand	Mild	LGMN	50	37
N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccccc1CC(=O)O	ZINC000819084158	FH	On-Demand	Mild	KCNQ2	43	34
N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccccc1CC(=O)O	ZINC000819084158	FH	On-Demand	Mild	DPP4	20	40
N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1ccccc1CC(=O)O	ZINC000819084158	FH	On-Demand	Mild	LGMN	50	37
N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccccc1CC(=O)O	ZINC000819084160	FH	On-Demand	Mild	KCNQ2	43	34
N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccccc1CC(=O)O	ZINC000819084160	FH	On-Demand	Mild	DPP4	20	40
N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1ccccc1CC(=O)O	ZINC000819084160	FH	On-Demand	Mild	LGMN	50	37
Cn1nc2c(c1C(=O)Nc1cccc(CC(=O)O)c1)CCCC2	ZINC000819084166	DE	On-Demand	Anodyne	PTGDR	16	42
Cn1nc2c(c1C(=O)Nc1cccc(CC(=O)O)c1)CCCC2	ZINC000819084166	DE	On-Demand	Anodyne	P2RY14	43	35
Cn1nc2c(c1C(=O)Nc1cccc(CC(=O)O)c1)CCCC2	ZINC000819084166	DE	On-Demand	Anodyne	KCNK3	70	34
Cn1ncc2cc(C(=O)N3CCC(C(=O)O)CC3)cnc21	ZINC000819084177	CC	On-Demand	Anodyne	L3MBTL3	62	38
Cn1nncc1CNc1cccc(CC(=O)O)c1	ZINC000819084180	BD	On-Demand	Anodyne	NR1H2	22	40
Cn1ncc2c(=O)n(CN3CCC(C(=O)O)CC3)nnc21	ZINC000819084192	CB	On-Demand	Anodyne	Q9M629_MAIZE	59	38
N#CC1(C(=O)OCc2ccc(C(=O)O)cc2)CCOCC1	ZINC000819084194	CD	On-Demand	Mild	SLC12A5	68	38
N#C[C@H]1C(CN2CC[C@H](C(=O)O)C2)=CC(=O)n2c1nc1ccccc12	ZINC000819084199	ED	On-Demand	Mild	SLC6A1	89	35
CCOc1cc(CCCNC[C@H](O)c2ccc(C)cc2)ccc1OC	ZINC000819084200	EH	On-Demand	Anodyne	ADRB2	64	41
CCOc1cc(CCCNC[C@H](O)c2ccc(C)cc2)ccc1OC	ZINC000819084200	EH	On-Demand	Anodyne	ADRB1	50	43
CCOc1cc(CCCNC[C@H](O)c2ccc(C)cc2)ccc1OC	ZINC000819084200	EH	On-Demand	Anodyne	ADRB3	51	48
CCOc1cc(CCCNC[C@@H](O)c2ccc(C)cc2)ccc1OC	ZINC000819084201	EH	On-Demand	Anodyne	ADRB2	64	41
CCOc1cc(CCCNC[C@@H](O)c2ccc(C)cc2)ccc1OC	ZINC000819084201	EH	On-Demand	Anodyne	ADRB1	50	43
CCOc1cc(CCCNC[C@@H](O)c2ccc(C)cc2)ccc1OC	ZINC000819084201	EH	On-Demand	Anodyne	ADRB3	51	48
N#C[C@@H]1C(CN2CC[C@@H](C(=O)O)C2)=CC(=O)n2c1nc1ccccc12	ZINC000819084202	ED	On-Demand	Mild	SLC6A1	89	35
N#C[C@@H]1C(CN2CC[C@H](C(=O)O)C2)=CC(=O)n2c1nc1ccccc12	ZINC000819084204	ED	On-Demand	Mild	SLC6A1	89	35
N#C[C@H]1C(CN2CC[C@@H](C(=O)O)C2)=CC(=O)n2c1nc1ccccc12	ZINC000819084206	ED	On-Demand	Mild	SLC6A1	89	35
N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCCC(=O)O)cc1Cl	ZINC000819084207	FH	On-Demand	Mild	ADRB1	41	31
N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCCC(=O)O)cc1Cl	ZINC000819084210	FH	On-Demand	Mild	ADRB1	41	31
N#CC1CCN(C(=O)C(=O)Nc2cccc(CC(=O)O)c2)CC1	ZINC000819084213	DD	On-Demand	Mild	CCR3	23	40
N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)CSCC(=O)O	ZINC000819084218	DE	On-Demand	Mild	DPP4	28	43
N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)CSCC(=O)O	ZINC000819084218	DE	On-Demand	Mild	PREP	67	40
N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)CSCC(=O)O	ZINC000819084221	DE	On-Demand	Mild	DPP4	28	43
N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)CSCC(=O)O	ZINC000819084221	DE	On-Demand	Mild	PREP	67	40
N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)CSCC(=O)O	ZINC000819084222	DE	On-Demand	Mild	DPP4	28	43
N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)CSCC(=O)O	ZINC000819084222	DE	On-Demand	Mild	PREP	67	40
N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)CSCC(=O)O	ZINC000819084224	DE	On-Demand	Mild	DPP4	28	43
N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)CSCC(=O)O	ZINC000819084224	DE	On-Demand	Mild	PREP	67	40
Cn1ncc2cc(C(=O)N[C@H](C(=O)O)c3ccccc3)cnc21	ZINC000819084258	DD	On-Demand	Anodyne	MTTP	46	33
Cn1nc2c(c1C(=O)N(CC(=O)O)c1ccc3c(c1)OCO3)CCCC2	ZINC000819084262	FD	On-Demand	Anodyne	NOS2	87	35
Cn1nc2c(cc1=O)CN(C(=O)C(=O)Nc1cccc(CC(=O)O)c1)CC2	ZINC000819084264	FB	On-Demand	Anodyne	P2RY14	46	37
Cn1ncc2c1CCC[C@@H]2NC(=O)Nc1ccccc1CC(=O)O	ZINC000819084278	EE	On-Demand	Anodyne	TRPV1	22	41
Cn1ncc2c1CCC[C@H]2NC(=O)Nc1ccccc1CC(=O)O	ZINC000819084280	EE	On-Demand	Anodyne	TRPV1	22	41
N#C[C@@H](c1ccccc1)[C@@H]1CCCN1CCC(=O)O	ZINC000819084286	CE	On-Demand	Mild	SLC6A1	20	43
N#C[C@H](c1ccccc1)[C@@H]1CCCN1CCC(=O)O	ZINC000819084289	CE	On-Demand	Mild	SLC6A1	20	43
N#C[C@@H](c1ccccc1)[C@H]1CCCN1CCC(=O)O	ZINC000819084291	CE	On-Demand	Mild	SLC6A1	20	43
N#C[C@H](c1ccccc1)[C@H]1CCCN1CCC(=O)O	ZINC000819084293	CE	On-Demand	Mild	SLC6A1	20	43
Cn1ncc(C(=O)Nc2ccccc2CC(=O)O)c1C(F)(F)F	ZINC000819084312	EE	On-Demand	Anodyne	EPHB3	41	36
Cn1ncnc1CNc1cccc(CC(=O)O)c1	ZINC000819084313	BD	On-Demand	Anodyne	NR1H2	23	40
Oc1ccc(CCCNC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819084316	CE	On-Demand	Anodyne	ADRB2	26	45
Oc1ccc(CCCNC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819084316	CE	On-Demand	Anodyne	ADRB1	27	45
Oc1ccc(CCCNC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819084316	CE	On-Demand	Anodyne	ADRB3	35	45
Cn1nc2c(c1C(=O)NCCCCCC(=O)O)CCCC2	ZINC000819084317	CD	On-Demand	Anodyne	BCHE	56	36
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819084318	CE	On-Demand	Anodyne	ADRB2	26	45
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819084318	CE	On-Demand	Anodyne	ADRB1	27	45
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819084318	CE	On-Demand	Anodyne	ADRB3	35	45
Cn1ncc2c(N3CCN(C(=O)NCCC(=O)O)CC3)ncnc21	ZINC000819084319	EB	On-Demand	Anodyne	PDGFRB	52	37
Cn1ncc2c(N3CCN(C(=O)NCCC(=O)O)CC3)ncnc21	ZINC000819084319	EB	On-Demand	Anodyne	SIRT3	59	34
Cn1ncc2c(N3CCN(C(=O)NCCC(=O)O)CC3)ncnc21	ZINC000819084319	EB	On-Demand	Anodyne	SIRT2	51	34
Cn1ncc2c(N3CCN(C(=O)NCCC(=O)O)CC3)ncnc21	ZINC000819084319	EB	On-Demand	Anodyne	SIRT1	44	31
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	ACE	50	50
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	MME	142	50
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	ANPEP	100	41
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	CTSB	58	42
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	PAPA1_CARPA	65	46
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	CYSP_TRYCR	45	34
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	CTSF	40	34
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	CTSL	40	45
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	CPA1	63	48
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	NAALAD2	32	44
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	CAPNS1	46	34
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	ECE1	31	44
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	CTSS	24	45
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	CAPN1	46	47
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	MMP9	15	43
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	CAPN2	46	32
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	ACE2	77	46
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	LAP3	51	38
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	CTSC	39	43
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	FPR1	67	40
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	CTRB_BOVIN	56	33
N#CC(C#N)=CN[C@H](Cc1ccccc1)C(=O)O	ZINC000819084328	BD	On-Demand	Reactive	BLA1_STEMA	74	36
Cn1nnc2cc(CNc3cccc(CC(=O)O)c3)ccc21	ZINC000819084344	CE	On-Demand	Anodyne	NR1H3	19	42
Cn1nnc2cc(CNc3cccc(CC(=O)O)c3)ccc21	ZINC000819084344	CE	On-Demand	Anodyne	NR1H2	32	42
Cn1nnc2cc(CNc3cccc(CC(=O)O)c3)ccc21	ZINC000819084344	CE	On-Demand	Anodyne	DRTS_TRYCR	44	32
Cn1ncc2c(O)nc(CN3CC[C@@H](C(=O)O)C3)nc21	ZINC000819084349	CB	On-Demand	Anodyne	SLC6A1	80	33
Cn1ncc2c(O)nc(CN3CC[C@H](C(=O)O)C3)nc21	ZINC000819084351	CB	On-Demand	Anodyne	SLC6A1	80	33
Cn1nnnc1SCCC(=O)N1CCC[C@@H]1C(=O)O	ZINC000819084354	CB	On-Demand	Anodyne	ACE	45	48
Cn1nnnc1SCCC(=O)N1CCC[C@H]1C(=O)O	ZINC000819084355	CB	On-Demand	Anodyne	ACE	45	48
N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCC(=O)O)cc1Cl	ZINC000819084363	EG	On-Demand	Mild	F7	18	41
N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCC(=O)O)cc1Cl	ZINC000819084366	EG	On-Demand	Mild	F7	18	41
N#CC(C#N)=CNc1ccccc1CC(=O)O	ZINC000819084369	BD	On-Demand	Reactive	CXCL8	39	46
N#CC1(C(=O)OCc2ccc(C(=O)O)cc2)CCCCC1	ZINC000819084375	CF	On-Demand	Mild	RARA	40	32
N#CC1(C(=O)OCc2ccc(C(=O)O)cc2)CCCCC1	ZINC000819084375	CF	On-Demand	Mild	SLC12A5	79	43
N#CC1(C(=O)NCc2ccc(C(=O)O)cc2)CCCCC1	ZINC000819084377	CE	On-Demand	Mild	RARA	41	33
N#CC1(C(=O)NCc2ccc(C(=O)O)cc2)CCCCC1	ZINC000819084377	CE	On-Demand	Mild	PROC	46	33
N#CC1(C(=O)Nc2ccccc2CC(=O)O)CCCC1	ZINC000819084389	CE	On-Demand	Mild	CXCL8	34	40
N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819084396	FH	On-Demand	Mild	CMA1	22	41
N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819084396	FH	On-Demand	Mild	CCR3	26	40
N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819084396	FH	On-Demand	Mild	LGMN	41	36
N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819084397	FH	On-Demand	Mild	CMA1	22	41
N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819084397	FH	On-Demand	Mild	CCR3	26	40
N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819084397	FH	On-Demand	Mild	LGMN	41	36
N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819084398	FH	On-Demand	Mild	CMA1	22	41
N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819084398	FH	On-Demand	Mild	CCR3	26	40
N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819084398	FH	On-Demand	Mild	LGMN	41	36
N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819084400	FH	On-Demand	Mild	CMA1	22	41
N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819084400	FH	On-Demand	Mild	CCR3	26	40
N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819084400	FH	On-Demand	Mild	LGMN	41	36
Oc1ccc(CCCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819084410	DG	On-Demand	Anodyne	ADRB2	61	46
Oc1ccc(CCCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819084410	DG	On-Demand	Anodyne	ADRB1	53	44
Oc1ccc(CCCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819084410	DG	On-Demand	Anodyne	ADRB3	62	44
Oc1ccc(CCCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819084411	DG	On-Demand	Anodyne	ADRB2	61	46
Oc1ccc(CCCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819084411	DG	On-Demand	Anodyne	ADRB1	53	44
Oc1ccc(CCCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819084411	DG	On-Demand	Anodyne	ADRB3	62	44
Cn1ncc2c(=O)n(CN3CC[C@@H](C(=O)O)C3)nnc21	ZINC000819084415	CA	On-Demand	Anodyne	SLC6A1	56	33
Cn1ncc2c(=O)n(CN3CC[C@@H](C(=O)O)C3)nnc21	ZINC000819084415	CA	On-Demand	Anodyne	Q9M629_MAIZE	55	37
Cn1ncc2c(=O)n(CN3CC[C@H](C(=O)O)C3)nnc21	ZINC000819084417	CA	On-Demand	Anodyne	SLC6A1	56	33
Cn1ncc2c(=O)n(CN3CC[C@H](C(=O)O)C3)nnc21	ZINC000819084417	CA	On-Demand	Anodyne	Q9M629_MAIZE	55	37
Cn1nc2c(c1C(=O)N1CCC(C(=O)O)CC1)CCCC2	ZINC000819084420	CD	On-Demand	Anodyne	L3MBTL3	53	33
Cn1nnc2cc(CN3CCC[C@H](CC(=O)O)C3)ccc21	ZINC000819084422	CD	On-Demand	Anodyne	CCR3	68	35
Cn1nnc2cc(CN3CCC[C@@H](CC(=O)O)C3)ccc21	ZINC000819084423	CD	On-Demand	Anodyne	CCR3	68	35
N#C[C@H](C(=O)CN1CC[C@H](C(=O)O)C1)c1nc(O)c2ccccc2n1	ZINC000819084425	EC	On-Demand	Mild	SLC6A1	56	34
N#C[C@H](C(=O)CN1CC[C@H](C(=O)O)C1)c1nc(O)c2ccccc2n1	ZINC000819084425	EC	On-Demand	Mild	TNKS	40	31
N#C[C@@H](C(=O)CN1CC[C@H](C(=O)O)C1)c1nc(O)c2ccccc2n1	ZINC000819084428	EC	On-Demand	Mild	SLC6A1	56	34
N#C[C@@H](C(=O)CN1CC[C@H](C(=O)O)C1)c1nc(O)c2ccccc2n1	ZINC000819084428	EC	On-Demand	Mild	TNKS	40	31
N#C[C@@H](C(=O)CN1CC[C@@H](C(=O)O)C1)c1nc(O)c2ccccc2n1	ZINC000819084430	EC	On-Demand	Mild	SLC6A1	56	34
N#C[C@@H](C(=O)CN1CC[C@@H](C(=O)O)C1)c1nc(O)c2ccccc2n1	ZINC000819084430	EC	On-Demand	Mild	TNKS	40	31
N#C[C@H](C(=O)CN1CC[C@@H](C(=O)O)C1)c1nc(O)c2ccccc2n1	ZINC000819084431	EC	On-Demand	Mild	SLC6A1	56	34
N#C[C@H](C(=O)CN1CC[C@@H](C(=O)O)C1)c1nc(O)c2ccccc2n1	ZINC000819084431	EC	On-Demand	Mild	TNKS	40	31
N#C[C@H](C(=O)CN1CC[C@@H](C(=O)O)C1)c1nc2ccccc2s1	ZINC000819084438	ED	On-Demand	Mild	SLC6A1	75	35
N#C[C@H](C(=O)CN1CC[C@@H](C(=O)O)C1)c1nc2ccccc2s1	ZINC000819084438	ED	On-Demand	Mild	LTA4H	26	46
N#C[C@@H](C(=O)CN1CC[C@@H](C(=O)O)C1)c1nc2ccccc2s1	ZINC000819084439	ED	On-Demand	Mild	SLC6A1	75	35
N#C[C@@H](C(=O)CN1CC[C@@H](C(=O)O)C1)c1nc2ccccc2s1	ZINC000819084439	ED	On-Demand	Mild	LTA4H	26	46
N#C[C@@H](C(=O)CN1CC[C@H](C(=O)O)C1)c1nc2ccccc2s1	ZINC000819084441	ED	On-Demand	Mild	SLC6A1	75	35
N#C[C@@H](C(=O)CN1CC[C@H](C(=O)O)C1)c1nc2ccccc2s1	ZINC000819084441	ED	On-Demand	Mild	LTA4H	26	46
N#C[C@H](C(=O)CN1CC[C@H](C(=O)O)C1)c1nc2ccccc2s1	ZINC000819084442	ED	On-Demand	Mild	SLC6A1	75	35
N#C[C@H](C(=O)CN1CC[C@H](C(=O)O)C1)c1nc2ccccc2s1	ZINC000819084442	ED	On-Demand	Mild	LTA4H	26	46
Cn1nc2c(c1C(=O)N1CCC[C@@H]1C(=O)O)CCCC2	ZINC000819084443	CC	On-Demand	Anodyne	ACE	38	42
Cn1nc2c(c1C(=O)N1CCC[C@H]1C(=O)O)CCCC2	ZINC000819084445	CC	On-Demand	Anodyne	ACE	38	42
Cn1nc2c(cc1=O)CN(C(=O)Nc1cccc(CC(=O)O)c1)CC2	ZINC000819084450	EC	On-Demand	Anodyne	P2RY14	60	45
Cn1ncc2c(N3CCN(C(=O)NCCCCCC(=O)O)CC3)ncnc21	ZINC000819084454	GC	On-Demand	Anodyne	PDGFRB	49	35
Cn1ncc2c(N3CCN(C(=O)CN4CC[C@@H](C(=O)O)C4)CC3)ncnc21	ZINC000819084463	FB	On-Demand	Anodyne	MAPK1	21	40
Cn1ncc2c(N3CCN(C(=O)CN4CC[C@H](C(=O)O)C4)CC3)ncnc21	ZINC000819084464	FB	On-Demand	Anodyne	MAPK1	21	40
Cn1nnc2cc(CNCCCCCC(=O)O)ccc21	ZINC000819084467	CD	On-Demand	Anodyne	S1PR2	35	45
Cn1nnc2cc(CNCCCCCC(=O)O)ccc21	ZINC000819084467	CD	On-Demand	Anodyne	LEF	49	32
N#C[C@H](c1ccccc1)[C@H]1CCCN1CC(=O)O	ZINC000819084479	BD	On-Demand	Mild	PTAFR	17	40
N#C[C@H](c1ccccc1)[C@@H]1CCCN1CC(=O)O	ZINC000819084481	BD	On-Demand	Mild	PTAFR	17	40
N#C[C@@H](c1ccccc1)[C@H]1CCCN1CC(=O)O	ZINC000819084482	BD	On-Demand	Mild	PTAFR	17	40
N#C[C@@H](c1ccccc1)[C@@H]1CCCN1CC(=O)O	ZINC000819084484	BD	On-Demand	Mild	PTAFR	17	40
Cn1ncc(C(=O)Nc2ccccc2CC(=O)O)c1C1CC1	ZINC000819084485	CE	On-Demand	Anodyne	PIM1	60	32
Cn1ncc(C(=O)Nc2ccccc2CC(=O)O)c1C1CC1	ZINC000819084485	CE	On-Demand	Anodyne	EPHB3	46	37
Cn1ncc(C(=O)Nc2ccccc2CC(=O)O)c1C1CC1	ZINC000819084485	CE	On-Demand	Anodyne	PIM3	53	32
Cn1nnc2cc(CN3CC[C@H](C(=O)O)C3)ccc21	ZINC000819084488	CC	On-Demand	Anodyne	SLC6A1	131	36
Cn1nnc2cc(CN3CC[C@H](C(=O)O)C3)ccc21	ZINC000819084488	CC	On-Demand	Anodyne	S1PR3	17	40
Cn1nnc2cc(CN3CC[C@H](C(=O)O)C3)ccc21	ZINC000819084488	CC	On-Demand	Anodyne	S1PR1	36	51
Cn1nnc2cc(CN3CC[C@H](C(=O)O)C3)ccc21	ZINC000819084488	CC	On-Demand	Anodyne	S1PR5	41	51
Cn1nnc2cc(CN3CC[C@@H](C(=O)O)C3)ccc21	ZINC000819084490	CC	On-Demand	Anodyne	SLC6A1	131	36
Cn1nnc2cc(CN3CC[C@@H](C(=O)O)C3)ccc21	ZINC000819084490	CC	On-Demand	Anodyne	S1PR3	17	40
Cn1nnc2cc(CN3CC[C@@H](C(=O)O)C3)ccc21	ZINC000819084490	CC	On-Demand	Anodyne	S1PR1	36	51
Cn1nnc2cc(CN3CC[C@@H](C(=O)O)C3)ccc21	ZINC000819084490	CC	On-Demand	Anodyne	S1PR5	41	51
Cn1nc2c(c1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084613	ED	On-Demand	Anodyne	ACE	72	42
Cn1nc2c(c1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084613	ED	On-Demand	Anodyne	MME	150	45
Cn1nc2c(c1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084613	ED	On-Demand	Anodyne	ANPEP	68	39
Cn1nc2c(c1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084613	ED	On-Demand	Anodyne	FCER2	43	32
Cn1nc2c(c1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084613	ED	On-Demand	Anodyne	PAPA1_CARPA	42	40
Cn1nc2c(c1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084613	ED	On-Demand	Anodyne	CYSP_TRYCR	41	33
Cn1nc2c(c1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084613	ED	On-Demand	Anodyne	CTSL	27	40
Cn1nc2c(c1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084613	ED	On-Demand	Anodyne	CPA1	43	41
Cn1nc2c(c1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084613	ED	On-Demand	Anodyne	ITGA4	44	43
Cn1nc2c(c1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084613	ED	On-Demand	Anodyne	NAALAD2	25	43
Cn1nc2c(c1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084613	ED	On-Demand	Anodyne	ECE1	61	40
Cn1nc2c(c1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084613	ED	On-Demand	Anodyne	CAPN1	53	44
Cn1nc2c(c1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084613	ED	On-Demand	Anodyne	ACE2	106	41
Cn1nc2c(c1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084613	ED	On-Demand	Anodyne	CTSV	49	35
Cn1nc2c(c1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084613	ED	On-Demand	Anodyne	FPR1	77	41
Cn1nc2c(c1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084613	ED	On-Demand	Anodyne	NPPA	51	40
Cn1nc2c(c1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084613	ED	On-Demand	Anodyne	BLA1_STEMA	80	42
Cn1nc2c(c1C(=O)N[C@@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084613	ED	On-Demand	Anodyne	BRCA1	54	33
Cn1nc2c(c1C(=O)N[C@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084614	ED	On-Demand	Anodyne	ACE	72	42
Cn1nc2c(c1C(=O)N[C@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084614	ED	On-Demand	Anodyne	MME	150	45
Cn1nc2c(c1C(=O)N[C@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084614	ED	On-Demand	Anodyne	ANPEP	68	39
Cn1nc2c(c1C(=O)N[C@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084614	ED	On-Demand	Anodyne	FCER2	43	32
Cn1nc2c(c1C(=O)N[C@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084614	ED	On-Demand	Anodyne	PAPA1_CARPA	42	40
Cn1nc2c(c1C(=O)N[C@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084614	ED	On-Demand	Anodyne	CYSP_TRYCR	41	33
Cn1nc2c(c1C(=O)N[C@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084614	ED	On-Demand	Anodyne	CTSL	27	40
Cn1nc2c(c1C(=O)N[C@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084614	ED	On-Demand	Anodyne	CPA1	43	41
Cn1nc2c(c1C(=O)N[C@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084614	ED	On-Demand	Anodyne	ITGA4	44	43
Cn1nc2c(c1C(=O)N[C@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084614	ED	On-Demand	Anodyne	NAALAD2	25	43
Cn1nc2c(c1C(=O)N[C@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084614	ED	On-Demand	Anodyne	ECE1	61	40
Cn1nc2c(c1C(=O)N[C@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084614	ED	On-Demand	Anodyne	CAPN1	53	44
Cn1nc2c(c1C(=O)N[C@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084614	ED	On-Demand	Anodyne	ACE2	106	41
Cn1nc2c(c1C(=O)N[C@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084614	ED	On-Demand	Anodyne	CTSV	49	35
Cn1nc2c(c1C(=O)N[C@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084614	ED	On-Demand	Anodyne	FPR1	77	41
Cn1nc2c(c1C(=O)N[C@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084614	ED	On-Demand	Anodyne	NPPA	51	40
Cn1nc2c(c1C(=O)N[C@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084614	ED	On-Demand	Anodyne	BLA1_STEMA	80	42
Cn1nc2c(c1C(=O)N[C@H](Cc1ccccc1)C(=O)O)CCCC2	ZINC000819084614	ED	On-Demand	Anodyne	BRCA1	54	33
N#C[C@@H](c1ccccc1)N1CCN(CCC(=O)O)CC1	ZINC000819084616	CD	On-Demand	Mild	PTAFR	45	55
N#C[C@H](c1ccccc1)N1CCN(CCC(=O)O)CC1	ZINC000819084617	CD	On-Demand	Mild	PTAFR	45	55
Cn1nc(CNc2cccc(CC(=O)O)c2)c2ccccc21	ZINC000819084625	CF	On-Demand	Anodyne	NR1H3	19	43
Cn1nc(CNc2cccc(CC(=O)O)c2)c2ccccc21	ZINC000819084625	CF	On-Demand	Anodyne	NR1H2	34	43
N#C[C@H](c1ccccc1)N1CCN(CC(=O)O)CC1	ZINC000819084631	CC	On-Demand	Mild	PTAFR	47	55
N#C[C@@H](c1ccccc1)N1CCN(CC(=O)O)CC1	ZINC000819084632	CC	On-Demand	Mild	PTAFR	47	55
Cn1ncc2c(SCc3ccc(C(=O)O)cc3)ncnc21	ZINC000819084633	DE	On-Demand	Anodyne	SLC29A1	56	38
N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819084634	EG	On-Demand	Mild	ADRB1	45	36
N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819084634	EG	On-Demand	Mild	FOLH1	17	43
N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819084635	EG	On-Demand	Mild	ADRB1	45	36
N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819084635	EG	On-Demand	Mild	FOLH1	17	43
Cn1nccc1C1CCN(C(=O)NCCCCCC(=O)O)CC1	ZINC000819084636	DD	On-Demand	Anodyne	EPHX2	16	41
Cn1ncc2c(=O)n(CC(=O)NCCCC(=O)O)cnc21	ZINC000819084639	CB	On-Demand	Anodyne	Q9M629_MAIZE	44	34
Cn1nnnc1-c1cccc(S(=O)(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819084643	FD	On-Demand	Anodyne	CCR3	46	39
Cn1nnnc1-c1cccc(S(=O)(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819084643	FD	On-Demand	Anodyne	MTNN	52	36
Cn1nnnc1-c1cccc(S(=O)(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819084643	FD	On-Demand	Anodyne	PTGDR2	15	41
Cn1ncc2c(=O)n(CN3CCC[C@H](CC(=O)O)C3)nnc21	ZINC000819084647	DB	On-Demand	Anodyne	Q9M629_MAIZE	52	35
Cn1ncc2c(=O)n(CN3CCC[C@@H](CC(=O)O)C3)nnc21	ZINC000819084648	DB	On-Demand	Anodyne	Q9M629_MAIZE	52	35
Cn1ncc2c(O)nc(CCC(=O)N3CCC[C@@H]3C(=O)O)nc21	ZINC000819084649	DC	On-Demand	Anodyne	ACE	39	43
Cn1ncc2c(O)nc(CCC(=O)N3CCC[C@@H]3C(=O)O)nc21	ZINC000819084649	DC	On-Demand	Anodyne	PREP	53	37
Cn1ncc2c(O)nc(CCC(=O)N3CCC[C@H]3C(=O)O)nc21	ZINC000819084650	DC	On-Demand	Anodyne	ACE	39	43
Cn1ncc2c(O)nc(CCC(=O)N3CCC[C@H]3C(=O)O)nc21	ZINC000819084650	DC	On-Demand	Anodyne	PREP	53	37
Cn1nnc2cc(CNCCCC(=O)O)ccc21	ZINC000819084656	BC	On-Demand	Anodyne	S1PR2	25	47
N#C[C@@H](c1ccccc1)c1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819084657	DF	On-Demand	Mild	F7	25	47
N#C[C@H](c1ccccc1)c1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819084658	DF	On-Demand	Mild	F7	25	47
Cn1nnnc1SCCC(=O)N[C@H](C(=O)O)c1ccccc1	ZINC000819084663	DC	On-Demand	Anodyne	C3AR1	44	33
Cn1nnnc1SCCC(=O)N[C@H](C(=O)O)c1ccccc1	ZINC000819084663	DC	On-Demand	Anodyne	NAALAD2	27	41
Cn1nnnc1SCCC(=O)N[C@H](C(=O)O)c1ccccc1	ZINC000819084663	DC	On-Demand	Anodyne	GSTP1	16	40
Cn1nnnc1SCCC(=O)N[C@H](C(=O)O)c1ccccc1	ZINC000819084663	DC	On-Demand	Anodyne	SLC22A6	15	42
Cn1nc(CC(=O)OCc2ccc(C(=O)O)cc2)c2ccccc2c1=O	ZINC000819084664	FD	On-Demand	Anodyne	AKR1B1	40	35
Cn1nc(CC(=O)OCc2ccc(C(=O)O)cc2)c2ccccc2c1=O	ZINC000819084664	FD	On-Demand	Anodyne	IMDH_CRYPV	31	47
Cn1nc(CC(=O)OCc2ccc(C(=O)O)cc2)c2ccccc2c1=O	ZINC000819084664	FD	On-Demand	Anodyne	SLC12A5	50	31
N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819084665	GE	On-Demand	Mild	DHODH	27	40
N#C[C@H](c1ccccc1)c1ccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819084666	GE	On-Demand	Mild	DHODH	27	40
N#C[C@H](c1ccccc1)c1ccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819084667	GE	On-Demand	Mild	DHODH	27	40
N#C[C@@H](c1ccccc1)c1ccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819084668	GE	On-Demand	Mild	DHODH	27	40
Cn1nccc1C(=O)N(CC(=O)O)c1ccc2c(c1)OCO2	ZINC000819084675	DC	On-Demand	Anodyne	NOS2	53	33
Cn1nccc1C1CCN(C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819084676	EE	On-Demand	Anodyne	RBP4	42	41
Cn1nccc1C1CCN(C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819084676	EE	On-Demand	Anodyne	SMO	34	40
CCOc1cc(CCCNC[C@H](O)c2cccnc2)ccc1OC	ZINC000819084686	EF	On-Demand	Anodyne	ADRB2	65	46
CCOc1cc(CCCNC[C@H](O)c2cccnc2)ccc1OC	ZINC000819084686	EF	On-Demand	Anodyne	ADRB1	71	54
CCOc1cc(CCCNC[C@H](O)c2cccnc2)ccc1OC	ZINC000819084686	EF	On-Demand	Anodyne	ADRB3	146	54
CCOc1cc(CCCNC[C@H](O)c2cccnc2)ccc1OC	ZINC000819084686	EF	On-Demand	Anodyne	PTAFR	17	41
CCOc1cc(CCCNC[C@@H](O)c2cccnc2)ccc1OC	ZINC000819084687	EF	On-Demand	Anodyne	ADRB2	65	46
CCOc1cc(CCCNC[C@@H](O)c2cccnc2)ccc1OC	ZINC000819084687	EF	On-Demand	Anodyne	ADRB1	71	54
CCOc1cc(CCCNC[C@@H](O)c2cccnc2)ccc1OC	ZINC000819084687	EF	On-Demand	Anodyne	ADRB3	146	54
CCOc1cc(CCCNC[C@@H](O)c2cccnc2)ccc1OC	ZINC000819084687	EF	On-Demand	Anodyne	PTAFR	17	41
Oc1ccc(CCCNC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819084729	FG	On-Demand	Anodyne	ADRB2	72	49
Oc1ccc(CCCNC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819084729	FG	On-Demand	Anodyne	ADRB1	74	44
Oc1ccc(CCCNC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819084729	FG	On-Demand	Anodyne	ADRB3	102	44
Oc1ccc(CCCNC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819084731	FG	On-Demand	Anodyne	ADRB2	72	49
Oc1ccc(CCCNC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819084731	FG	On-Demand	Anodyne	ADRB1	74	44
Oc1ccc(CCCNC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819084731	FG	On-Demand	Anodyne	ADRB3	102	44
O[C@H](CNC1CCN(C[C@@H]2CCOC2)CC1)c1ccc(F)cc1	ZINC000819084746	DD	On-Demand	Anodyne	SLC6A3	24	47
O[C@@H](CNC1CCN(C[C@H]2CCOC2)CC1)c1ccc(F)cc1	ZINC000819084747	DD	On-Demand	Anodyne	SLC6A3	24	47
O[C@@H](CNC1CCN(C[C@@H]2CCOC2)CC1)c1ccc(F)cc1	ZINC000819084749	DD	On-Demand	Anodyne	SLC6A3	24	47
O[C@H](CNC1CCN(C[C@H]2CCOC2)CC1)c1ccc(F)cc1	ZINC000819084750	DD	On-Demand	Anodyne	SLC6A3	24	47
CCOc1cc(CCCNC[C@@H](O)c2cc(F)ccc2F)ccc1OC	ZINC000819084751	FH	On-Demand	Anodyne	LEF	48	33
CCOc1cc(CCCNC[C@H](O)c2cc(F)ccc2F)ccc1OC	ZINC000819084752	FH	On-Demand	Anodyne	LEF	48	33
Oc1ccc(CCCNC[C@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819084830	EH	On-Demand	Anodyne	ADRB2	65	42
Oc1ccc(CCCNC[C@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819084830	EH	On-Demand	Anodyne	ADRB1	57	44
Oc1ccc(CCCNC[C@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819084830	EH	On-Demand	Anodyne	ADRB3	41	44
Oc1ccc(CCCNC[C@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819084830	EH	On-Demand	Anodyne	GRIA1	44	33
Oc1ccc(CCCNC[C@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819084830	EH	On-Demand	Anodyne	SLC6A5	16	40
Oc1ccc(CCCNC[C@@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819084832	EH	On-Demand	Anodyne	ADRB2	65	42
Oc1ccc(CCCNC[C@@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819084832	EH	On-Demand	Anodyne	ADRB1	57	44
Oc1ccc(CCCNC[C@@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819084832	EH	On-Demand	Anodyne	ADRB3	41	44
Oc1ccc(CCCNC[C@@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819084832	EH	On-Demand	Anodyne	GRIA1	44	33
Oc1ccc(CCCNC[C@@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819084832	EH	On-Demand	Anodyne	SLC6A5	16	40
CCOc1ccc([C@@H]2NC(=O)[C@@H]3Cn4c(C)nnc4CN32)cc1	ZINC000819084835	DC	On-Demand	Anodyne	CACNA2D2	54	36
CCOc1ccc([C@@H]2NC(=O)[C@H]3Cn4c(C)nnc4CN32)cc1	ZINC000819084839	DC	On-Demand	Anodyne	CACNA2D2	54	36
Oc1ccc(CCCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819084873	DF	On-Demand	Anodyne	ADRB2	81	42
Oc1ccc(CCCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819084873	DF	On-Demand	Anodyne	ADRB1	65	44
Oc1ccc(CCCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819084873	DF	On-Demand	Anodyne	ADRB3	45	44
Oc1ccc(CCCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819084873	DF	On-Demand	Anodyne	GRIA1	45	34
Oc1ccc(CCCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819084873	DF	On-Demand	Anodyne	LEF	43	37
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819084874	DF	On-Demand	Anodyne	ADRB2	81	42
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819084874	DF	On-Demand	Anodyne	ADRB1	65	44
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819084874	DF	On-Demand	Anodyne	ADRB3	45	44
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819084874	DF	On-Demand	Anodyne	GRIA1	45	34
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819084874	DF	On-Demand	Anodyne	LEF	43	37
CCOc1cc(CCCNC[C@@H](O)c2ccc(F)cc2F)ccc1OC	ZINC000819084948	FH	On-Demand	Anodyne	ADRB2	42	36
CCOc1cc(CCCNC[C@@H](O)c2ccc(F)cc2F)ccc1OC	ZINC000819084948	FH	On-Demand	Anodyne	ADRB3	18	40
CCOc1cc(CCCNC[C@H](O)c2ccc(F)cc2F)ccc1OC	ZINC000819084949	FH	On-Demand	Anodyne	ADRB2	42	36
CCOc1cc(CCCNC[C@H](O)c2ccc(F)cc2F)ccc1OC	ZINC000819084949	FH	On-Demand	Anodyne	ADRB3	18	40
CCOc1cc(CCCNC[C@H](O)c2ccc(F)cc2C)ccc1OC	ZINC000819084958	FH	On-Demand	Anodyne	LEF	50	36
CCOc1cc(CCCNC[C@@H](O)c2ccc(F)cc2C)ccc1OC	ZINC000819084959	FH	On-Demand	Anodyne	LEF	50	36
Cc1cc(F)ccc1[C@@H](O)CNCCCc1ccc(O)cc1	ZINC000819084982	DG	On-Demand	Anodyne	ADRB2	71	40
Cc1cc(F)ccc1[C@@H](O)CNCCCc1ccc(O)cc1	ZINC000819084982	DG	On-Demand	Anodyne	ADRB1	55	45
Cc1cc(F)ccc1[C@@H](O)CNCCCc1ccc(O)cc1	ZINC000819084982	DG	On-Demand	Anodyne	ADRB3	36	45
Cc1cc(F)ccc1[C@@H](O)CNCCCc1ccc(O)cc1	ZINC000819084982	DG	On-Demand	Anodyne	GRIA1	40	32
Cc1cc(F)ccc1[C@@H](O)CNCCCc1ccc(O)cc1	ZINC000819084982	DG	On-Demand	Anodyne	LEF	73	41
Oc1ccc(CCCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819085032	DF	On-Demand	Anodyne	ADRB2	68	50
Oc1ccc(CCCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819085032	DF	On-Demand	Anodyne	ADRB1	61	47
Oc1ccc(CCCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819085032	DF	On-Demand	Anodyne	ADRB3	75	47
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819085034	DF	On-Demand	Anodyne	ADRB2	68	50
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819085034	DF	On-Demand	Anodyne	ADRB1	61	47
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819085034	DF	On-Demand	Anodyne	ADRB3	75	47
Cn1nccc1CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819085044	GH	On-Demand	Anodyne	CTSD	15	42
Cn1nccc1CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819085044	GH	On-Demand	Anodyne	PGC	40	36
Cn1nccc1CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819085044	GH	On-Demand	Anodyne	CACNA1B	20	40
Cn1nccc1CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819085044	GH	On-Demand	Anodyne	PGA	20	42
Cn1nccc1CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819085044	GH	On-Demand	Anodyne	MMP2	50	31
Cn1nccc1CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819085044	GH	On-Demand	Anodyne	REN	76	45
Cn1nccc1CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819085044	GH	On-Demand	Anodyne	CTSE	22	42
Cn1nccc1CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819085046	GH	On-Demand	Anodyne	CTSD	15	42
Cn1nccc1CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819085046	GH	On-Demand	Anodyne	PGC	40	36
Cn1nccc1CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819085046	GH	On-Demand	Anodyne	CACNA1B	20	40
Cn1nccc1CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819085046	GH	On-Demand	Anodyne	PGA	20	42
Cn1nccc1CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819085046	GH	On-Demand	Anodyne	MMP2	50	31
Cn1nccc1CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819085046	GH	On-Demand	Anodyne	REN	76	45
Cn1nccc1CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819085046	GH	On-Demand	Anodyne	CTSE	22	42
COc1ccc(OC)c([C@H](O)CNCCCNc2ccccn2)c1	ZINC000819085072	EE	On-Demand	Anodyne	ADRB2	28	44
COc1ccc(OC)c([C@H](O)CNCCCNc2ccccn2)c1	ZINC000819085072	EE	On-Demand	Anodyne	METG	45	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(Cn3cncn3)cc1)C2	ZINC000819085084	FE	On-Demand	Anodyne	HIS3	43	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(Cn3cncn3)cc1)C2	ZINC000819085085	FE	On-Demand	Anodyne	HIS3	43	31
CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NC[C@H](O)c1ccccc1	ZINC000819085165	DH	On-Demand	Anodyne	ADRB2	17	41
CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NC[C@H](O)c1ccccc1	ZINC000819085165	DH	On-Demand	Anodyne	ADRB1	23	40
CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NC[C@H](O)c1ccccc1	ZINC000819085165	DH	On-Demand	Anodyne	ADRB3	41	39
CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NC[C@H](O)c1ccccc1	ZINC000819085165	DH	On-Demand	Anodyne	AOC3	15	40
CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819085166	DH	On-Demand	Anodyne	ADRB2	17	41
CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819085166	DH	On-Demand	Anodyne	ADRB1	23	40
CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819085166	DH	On-Demand	Anodyne	ADRB3	41	39
CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819085166	DH	On-Demand	Anodyne	AOC3	15	40
CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819085167	DH	On-Demand	Anodyne	ADRB2	17	41
CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819085167	DH	On-Demand	Anodyne	ADRB1	23	40
CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819085167	DH	On-Demand	Anodyne	ADRB3	41	39
CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819085167	DH	On-Demand	Anodyne	AOC3	15	40
CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NC[C@@H](O)c1ccccc1	ZINC000819085169	DH	On-Demand	Anodyne	ADRB2	17	41
CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NC[C@@H](O)c1ccccc1	ZINC000819085169	DH	On-Demand	Anodyne	ADRB1	23	40
CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NC[C@@H](O)c1ccccc1	ZINC000819085169	DH	On-Demand	Anodyne	ADRB3	41	39
CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NC[C@@H](O)c1ccccc1	ZINC000819085169	DH	On-Demand	Anodyne	AOC3	15	40
CCOc1cc(CCCNC[C@H](O)c2ccc(Cl)cc2)ccc1OC	ZINC000819085332	FI	On-Demand	Anodyne	ADRB2	67	41
CCOc1cc(CCCNC[C@H](O)c2ccc(Cl)cc2)ccc1OC	ZINC000819085332	FI	On-Demand	Anodyne	ADRB1	57	46
CCOc1cc(CCCNC[C@H](O)c2ccc(Cl)cc2)ccc1OC	ZINC000819085332	FI	On-Demand	Anodyne	ADRB3	57	48
C[C@@H](CC(=O)N1CCC([C@H](O)c2ccccc2)CC1)n1cccn1	ZINC000819085368	EF	On-Demand	Anodyne	PTAFR	28	44
C[C@@H](CC(=O)N1CCC([C@@H](O)c2ccccc2)CC1)n1cccn1	ZINC000819085370	EF	On-Demand	Anodyne	PTAFR	28	44
CCOc1cc(CCCNC[C@@H](O)c2ccccc2)ccc1OC	ZINC000819085382	EG	On-Demand	Anodyne	ADRB2	88	42
CCOc1cc(CCCNC[C@@H](O)c2ccccc2)ccc1OC	ZINC000819085382	EG	On-Demand	Anodyne	ADRB1	86	48
CCOc1cc(CCCNC[C@@H](O)c2ccccc2)ccc1OC	ZINC000819085382	EG	On-Demand	Anodyne	ADRB3	103	48
CCOc1cc(CCCNC[C@H](O)c2ccccc2)ccc1OC	ZINC000819085386	EG	On-Demand	Anodyne	ADRB2	88	42
CCOc1cc(CCCNC[C@H](O)c2ccccc2)ccc1OC	ZINC000819085386	EG	On-Demand	Anodyne	ADRB1	86	48
CCOc1cc(CCCNC[C@H](O)c2ccccc2)ccc1OC	ZINC000819085386	EG	On-Demand	Anodyne	ADRB3	103	48
COc1cccc(OCCCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819085407	GE	On-Demand	Anodyne	ADRB2	63	46
COc1cccc(OCCCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819085407	GE	On-Demand	Anodyne	ADRB1	67	39
COc1cccc(OCCCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819085407	GE	On-Demand	Anodyne	ADRB3	109	43
COc1cccc(OCCCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819085407	GE	On-Demand	Anodyne	MTNR1A	30	47
COc1cccc(OCCCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819085407	GE	On-Demand	Anodyne	MTNR1B	30	47
COc1cccc(OCCCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819085409	GE	On-Demand	Anodyne	ADRB2	63	46
COc1cccc(OCCCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819085409	GE	On-Demand	Anodyne	ADRB1	67	39
COc1cccc(OCCCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819085409	GE	On-Demand	Anodyne	ADRB3	109	43
COc1cccc(OCCCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819085409	GE	On-Demand	Anodyne	MTNR1A	30	47
COc1cccc(OCCCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819085409	GE	On-Demand	Anodyne	MTNR1B	30	47
O=C(O)C[C@H](Cc1ccccc1)NS(=O)(=O)CCOCC1CC1	ZINC000819085418	ED	On-Demand	Anodyne	MME	58	40
O=C(O)C[C@H](Cc1ccccc1)NS(=O)(=O)CCOCC1CC1	ZINC000819085418	ED	On-Demand	Anodyne	TIMP3	40	34
O=C(O)C[C@H](Cc1ccccc1)NS(=O)(=O)CCOCC1CC1	ZINC000819085418	ED	On-Demand	Anodyne	CAPN2	46	34
O=C(O)C[C@@H](Cc1ccccc1)NS(=O)(=O)CCOCC1CC1	ZINC000819085419	ED	On-Demand	Anodyne	MME	58	40
O=C(O)C[C@@H](Cc1ccccc1)NS(=O)(=O)CCOCC1CC1	ZINC000819085419	ED	On-Demand	Anodyne	TIMP3	40	34
O=C(O)C[C@@H](Cc1ccccc1)NS(=O)(=O)CCOCC1CC1	ZINC000819085419	ED	On-Demand	Anodyne	CAPN2	46	34
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819085432	FH	On-Demand	Anodyne	ADRB1	27	45
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819085432	FH	On-Demand	Anodyne	ADRB3	34	45
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819085432	FH	On-Demand	Anodyne	CRTM	32	41
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1ccc(Cl)cc1	ZINC000819085433	FH	On-Demand	Anodyne	ADRB1	27	45
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1ccc(Cl)cc1	ZINC000819085433	FH	On-Demand	Anodyne	ADRB3	34	45
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1ccc(Cl)cc1	ZINC000819085433	FH	On-Demand	Anodyne	CRTM	32	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085450	GH	On-Demand	Anodyne	PGC	51	33
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085450	GH	On-Demand	Anodyne	REN	70	39
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085450	GH	On-Demand	Anodyne	FPR1	44	36
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085450	GH	On-Demand	Anodyne	CCR8	20	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085450	GH	On-Demand	Anodyne	GPR119	47	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085451	GH	On-Demand	Anodyne	PGC	51	33
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085451	GH	On-Demand	Anodyne	REN	70	39
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085451	GH	On-Demand	Anodyne	FPR1	44	36
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085451	GH	On-Demand	Anodyne	CCR8	20	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085451	GH	On-Demand	Anodyne	GPR119	47	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085452	GH	On-Demand	Anodyne	PGC	51	33
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085452	GH	On-Demand	Anodyne	REN	70	39
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085452	GH	On-Demand	Anodyne	FPR1	44	36
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085452	GH	On-Demand	Anodyne	CCR8	20	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085452	GH	On-Demand	Anodyne	GPR119	47	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085454	GH	On-Demand	Anodyne	PGC	51	33
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085454	GH	On-Demand	Anodyne	REN	70	39
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085454	GH	On-Demand	Anodyne	FPR1	44	36
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085454	GH	On-Demand	Anodyne	CCR8	20	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819085454	GH	On-Demand	Anodyne	GPR119	47	49
CC(=O)Nc1cccc(CC(=O)N2CCC([C@H](O)c3ccccc3)CC2)c1	ZINC000819085464	FG	On-Demand	Anodyne	OPRK1	15	43
CC(=O)Nc1cccc(CC(=O)N2CCC([C@H](O)c3ccccc3)CC2)c1	ZINC000819085464	FG	On-Demand	Anodyne	GRIN2B	20	41
CC(=O)Nc1cccc(CC(=O)N2CCC([C@H](O)c3ccccc3)CC2)c1	ZINC000819085464	FG	On-Demand	Anodyne	SIGMAR1	18	44
CC(=O)Nc1cccc(CC(=O)N2CCC([C@H](O)c3ccccc3)CC2)c1	ZINC000819085464	FG	On-Demand	Anodyne	NPY2R	54	35
CC(=O)Nc1cccc(CC(=O)N2CCC([C@H](O)c3ccccc3)CC2)c1	ZINC000819085464	FG	On-Demand	Anodyne	ST14	49	35
CC(=O)Nc1cccc(CC(=O)N2CCC([C@H](O)c3ccccc3)CC2)c1	ZINC000819085464	FG	On-Demand	Anodyne	MCHR1	23	40
CC(=O)Nc1cccc(CC(=O)N2CCC([C@@H](O)c3ccccc3)CC2)c1	ZINC000819085465	FG	On-Demand	Anodyne	OPRK1	15	43
CC(=O)Nc1cccc(CC(=O)N2CCC([C@@H](O)c3ccccc3)CC2)c1	ZINC000819085465	FG	On-Demand	Anodyne	GRIN2B	20	41
CC(=O)Nc1cccc(CC(=O)N2CCC([C@@H](O)c3ccccc3)CC2)c1	ZINC000819085465	FG	On-Demand	Anodyne	SIGMAR1	18	44
CC(=O)Nc1cccc(CC(=O)N2CCC([C@@H](O)c3ccccc3)CC2)c1	ZINC000819085465	FG	On-Demand	Anodyne	NPY2R	54	35
CC(=O)Nc1cccc(CC(=O)N2CCC([C@@H](O)c3ccccc3)CC2)c1	ZINC000819085465	FG	On-Demand	Anodyne	ST14	49	35
CC(=O)Nc1cccc(CC(=O)N2CCC([C@@H](O)c3ccccc3)CC2)c1	ZINC000819085465	FG	On-Demand	Anodyne	MCHR1	23	40
CSCC[C@@H](C)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819085476	DE	On-Demand	Anodyne	ADRB2	29	53
CSCC[C@@H](C)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819085476	DE	On-Demand	Anodyne	ADRB1	35	48
CSCC[C@@H](C)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819085476	DE	On-Demand	Anodyne	ADRB3	16	43
CSCC[C@@H](C)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819085476	DE	On-Demand	Anodyne	ABCB1	17	44
CSCC[C@@H](C)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819085476	DE	On-Demand	Anodyne	PDS	51	37
CSCC[C@@H](C)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819085477	DE	On-Demand	Anodyne	ADRB2	29	53
CSCC[C@@H](C)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819085477	DE	On-Demand	Anodyne	ADRB1	35	48
CSCC[C@@H](C)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819085477	DE	On-Demand	Anodyne	ADRB3	16	43
CSCC[C@@H](C)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819085477	DE	On-Demand	Anodyne	ABCB1	17	44
CSCC[C@@H](C)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819085477	DE	On-Demand	Anodyne	PDS	51	37
CSCC[C@H](C)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819085478	DE	On-Demand	Anodyne	ADRB2	29	53
CSCC[C@H](C)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819085478	DE	On-Demand	Anodyne	ADRB1	35	48
CSCC[C@H](C)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819085478	DE	On-Demand	Anodyne	ADRB3	16	43
CSCC[C@H](C)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819085478	DE	On-Demand	Anodyne	ABCB1	17	44
CSCC[C@H](C)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819085478	DE	On-Demand	Anodyne	PDS	51	37
CSCC[C@H](C)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819085479	DE	On-Demand	Anodyne	ADRB2	29	53
CSCC[C@H](C)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819085479	DE	On-Demand	Anodyne	ADRB1	35	48
CSCC[C@H](C)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819085479	DE	On-Demand	Anodyne	ADRB3	16	43
CSCC[C@H](C)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819085479	DE	On-Demand	Anodyne	ABCB1	17	44
CSCC[C@H](C)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819085479	DE	On-Demand	Anodyne	PDS	51	37
Cc1ccc(N2CCC[C@@H](NC[C@H](O)c3cccnc3)C2)nn1	ZINC000819085535	DD	On-Demand	Anodyne	ADRB3	48	45
Cc1ccc(N2CCC[C@@H](NC[C@H](O)c3cccnc3)C2)nn1	ZINC000819085535	DD	On-Demand	Anodyne	SCD1	29	49
Cc1ccc(N2CCC[C@@H](NC[C@H](O)c3cccnc3)C2)nn1	ZINC000819085535	DD	On-Demand	Anodyne	SCD	34	43
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)c3cccnc3)C2)nn1	ZINC000819085537	DD	On-Demand	Anodyne	ADRB3	48	45
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)c3cccnc3)C2)nn1	ZINC000819085537	DD	On-Demand	Anodyne	SCD1	29	49
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)c3cccnc3)C2)nn1	ZINC000819085537	DD	On-Demand	Anodyne	SCD	34	43
Oc1ccc(CCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819085569	EH	On-Demand	Anodyne	ADRB2	57	49
Oc1ccc(CCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819085569	EH	On-Demand	Anodyne	ADRB1	49	44
Oc1ccc(CCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819085569	EH	On-Demand	Anodyne	ADRB3	56	44
Oc1ccc(CCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819085570	EH	On-Demand	Anodyne	ADRB2	57	49
Oc1ccc(CCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819085570	EH	On-Demand	Anodyne	ADRB1	49	44
Oc1ccc(CCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819085570	EH	On-Demand	Anodyne	ADRB3	56	44
CSCC[C@@H](C)NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819085584	DE	On-Demand	Anodyne	ADRB2	34	52
CSCC[C@@H](C)NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819085584	DE	On-Demand	Anodyne	ADRB1	43	52
CSCC[C@@H](C)NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819085584	DE	On-Demand	Anodyne	ADRB3	23	52
CSCC[C@@H](C)NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819085585	DE	On-Demand	Anodyne	ADRB2	34	52
CSCC[C@@H](C)NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819085585	DE	On-Demand	Anodyne	ADRB1	43	52
CSCC[C@@H](C)NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819085585	DE	On-Demand	Anodyne	ADRB3	23	52
CSCC[C@H](C)NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819085586	DE	On-Demand	Anodyne	ADRB2	34	52
CSCC[C@H](C)NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819085586	DE	On-Demand	Anodyne	ADRB1	43	52
CSCC[C@H](C)NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819085586	DE	On-Demand	Anodyne	ADRB3	23	52
CSCC[C@H](C)NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819085587	DE	On-Demand	Anodyne	ADRB2	34	52
CSCC[C@H](C)NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819085587	DE	On-Demand	Anodyne	ADRB1	43	52
CSCC[C@H](C)NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819085587	DE	On-Demand	Anodyne	ADRB3	23	52
CSCC[C@@H](C)NCCC(=O)Nc1cccc(Br)c1	ZINC000819085589	EH	On-Demand	Anodyne	EGFR	22	41
CSCC[C@@H](C)NCCC(=O)Nc1cccc(Br)c1	ZINC000819085589	EH	On-Demand	Anodyne	HDAC10	18	41
CSCC[C@H](C)NCCC(=O)Nc1cccc(Br)c1	ZINC000819085590	EH	On-Demand	Anodyne	EGFR	22	41
CSCC[C@H](C)NCCC(=O)Nc1cccc(Br)c1	ZINC000819085590	EH	On-Demand	Anodyne	HDAC10	18	41
COc1cccc(OCCCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819085650	GH	On-Demand	Anodyne	ADRB2	47	41
COc1cccc(OCCCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819085650	GH	On-Demand	Anodyne	ADRB1	53	40
COc1cccc(OCCCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819085650	GH	On-Demand	Anodyne	DRD4	15	40
COc1cccc(OCCCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819085650	GH	On-Demand	Anodyne	ADRB3	61	40
COc1cccc(OCCCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819085650	GH	On-Demand	Anodyne	MTNR1A	17	50
COc1cccc(OCCCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819085650	GH	On-Demand	Anodyne	MTNR1B	21	50
COc1cccc(OCCCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819085651	GH	On-Demand	Anodyne	ADRB2	47	41
COc1cccc(OCCCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819085651	GH	On-Demand	Anodyne	ADRB1	53	40
COc1cccc(OCCCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819085651	GH	On-Demand	Anodyne	DRD4	15	40
COc1cccc(OCCCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819085651	GH	On-Demand	Anodyne	ADRB3	61	40
COc1cccc(OCCCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819085651	GH	On-Demand	Anodyne	MTNR1A	17	50
COc1cccc(OCCCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819085651	GH	On-Demand	Anodyne	MTNR1B	21	50
COc1cccc(OCCCNC[C@@H](O)c2ccccc2)c1	ZINC000819085673	DF	On-Demand	Anodyne	ADRB2	73	46
COc1cccc(OCCCNC[C@@H](O)c2ccccc2)c1	ZINC000819085673	DF	On-Demand	Anodyne	ADRB1	85	48
COc1cccc(OCCCNC[C@@H](O)c2ccccc2)c1	ZINC000819085673	DF	On-Demand	Anodyne	DRD4	22	49
COc1cccc(OCCCNC[C@@H](O)c2ccccc2)c1	ZINC000819085673	DF	On-Demand	Anodyne	ADRB3	94	48
COc1cccc(OCCCNC[C@@H](O)c2ccccc2)c1	ZINC000819085673	DF	On-Demand	Anodyne	MTNR1A	35	51
COc1cccc(OCCCNC[C@@H](O)c2ccccc2)c1	ZINC000819085673	DF	On-Demand	Anodyne	MTNR1B	38	51
COc1cccc(OCCCNC[C@@H](O)c2ccccc2)c1	ZINC000819085673	DF	On-Demand	Anodyne	AOC3	18	52
COc1cccc(OCCCNC[C@H](O)c2ccccc2)c1	ZINC000819085675	DF	On-Demand	Anodyne	ADRB2	73	46
COc1cccc(OCCCNC[C@H](O)c2ccccc2)c1	ZINC000819085675	DF	On-Demand	Anodyne	ADRB1	85	48
COc1cccc(OCCCNC[C@H](O)c2ccccc2)c1	ZINC000819085675	DF	On-Demand	Anodyne	DRD4	22	49
COc1cccc(OCCCNC[C@H](O)c2ccccc2)c1	ZINC000819085675	DF	On-Demand	Anodyne	ADRB3	94	48
COc1cccc(OCCCNC[C@H](O)c2ccccc2)c1	ZINC000819085675	DF	On-Demand	Anodyne	MTNR1A	35	51
COc1cccc(OCCCNC[C@H](O)c2ccccc2)c1	ZINC000819085675	DF	On-Demand	Anodyne	MTNR1B	38	51
COc1cccc(OCCCNC[C@H](O)c2ccccc2)c1	ZINC000819085675	DF	On-Demand	Anodyne	AOC3	18	52
COc1cccc(OCCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819085704	FH	On-Demand	Anodyne	ADRB1	46	41
COc1cccc(OCCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819085704	FH	On-Demand	Anodyne	ADRB3	54	41
COc1cccc(OCCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819085704	FH	On-Demand	Anodyne	PDS	42	38
COc1cccc(OCCCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819085706	FH	On-Demand	Anodyne	ADRB1	46	41
COc1cccc(OCCCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819085706	FH	On-Demand	Anodyne	ADRB3	54	41
COc1cccc(OCCCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819085706	FH	On-Demand	Anodyne	PDS	42	38
CCOc1cc(CCCNC[C@H](O)C2CC2)ccc1OC	ZINC000819085726	CE	On-Demand	Anodyne	SSTR5	46	39
CCOc1cc(CCCNC[C@@H](O)C2CC2)ccc1OC	ZINC000819085728	CE	On-Demand	Anodyne	SSTR5	46	39
CCCCCCCCOc1ccc([C@H]2NC(=O)[C@H]3Cn4c(C)nnc4CN23)cc1	ZINC000819085745	GG	On-Demand	Mild	PLA2G4B	51	31
CCCCCCCCOc1ccc([C@H]2NC(=O)[C@@H]3Cn4c(C)nnc4CN32)cc1	ZINC000819085746	GG	On-Demand	Mild	PLA2G4B	51	31
CCCCCCCCOc1ccc([C@@H]2NC(=O)[C@@H]3Cn4c(C)nnc4CN32)cc1	ZINC000819085747	GG	On-Demand	Mild	PLA2G4B	51	31
CCCCCCCCOc1ccc([C@@H]2NC(=O)[C@H]3Cn4c(C)nnc4CN32)cc1	ZINC000819085748	GG	On-Demand	Mild	PLA2G4B	51	31
CCOc1cc(CCCNC[C@@H](O)c2cc3ccccc3o2)ccc1OC	ZINC000819085779	FI	On-Demand	Anodyne	SSTR5	37	42
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819085787	FH	On-Demand	Anodyne	ADRB2	33	40
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819085787	FH	On-Demand	Anodyne	ADRB1	40	40
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819085787	FH	On-Demand	Anodyne	DRD4	19	44
COc1cccc(OCCCNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819085788	FH	On-Demand	Anodyne	ADRB2	33	40
COc1cccc(OCCCNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819085788	FH	On-Demand	Anodyne	ADRB1	40	40
COc1cccc(OCCCNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819085788	FH	On-Demand	Anodyne	DRD4	19	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccc(Cn3ccnc3)c1)C2	ZINC000819085789	GE	On-Demand	Anodyne	CYP11B1	26	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccc(Cn3ccnc3)c1)C2	ZINC000819085789	GE	On-Demand	Anodyne	CYP11B2	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccc(Cn3ccnc3)c1)C2	ZINC000819085790	GE	On-Demand	Anodyne	CYP11B1	26	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccc(Cn3ccnc3)c1)C2	ZINC000819085790	GE	On-Demand	Anodyne	CYP11B2	15	40
CSCC[C@H](C)NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819085815	DE	On-Demand	Bother	ADRB2	20	46
CSCC[C@H](C)NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819085815	DE	On-Demand	Bother	ADRB1	22	48
CSCC[C@H](C)NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819085815	DE	On-Demand	Bother	PDS	22	45
CSCC[C@@H](C)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819085816	DE	On-Demand	Bother	ADRB2	20	46
CSCC[C@@H](C)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819085816	DE	On-Demand	Bother	ADRB1	22	48
CSCC[C@@H](C)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819085816	DE	On-Demand	Bother	PDS	22	45
CSCC[C@H](C)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819085817	DE	On-Demand	Bother	ADRB2	20	46
CSCC[C@H](C)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819085817	DE	On-Demand	Bother	ADRB1	22	48
CSCC[C@H](C)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819085817	DE	On-Demand	Bother	PDS	22	45
CSCC[C@@H](C)NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819085818	DE	On-Demand	Bother	ADRB2	20	46
CSCC[C@@H](C)NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819085818	DE	On-Demand	Bother	ADRB1	22	48
CSCC[C@@H](C)NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819085818	DE	On-Demand	Bother	PDS	22	45
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(Cn2ccnc2)c1	ZINC000819085819	DE	On-Demand	Anodyne	CYP11B1	32	45
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(Cn2ccnc2)c1	ZINC000819085819	DE	On-Demand	Anodyne	TBXAS1	31	46
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(Cn2ccnc2)c1	ZINC000819085819	DE	On-Demand	Anodyne	CYP11B2	18	42
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(Cn2ccnc2)c1	ZINC000819085820	DE	On-Demand	Anodyne	CYP11B1	32	45
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(Cn2ccnc2)c1	ZINC000819085820	DE	On-Demand	Anodyne	TBXAS1	31	46
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(Cn2ccnc2)c1	ZINC000819085820	DE	On-Demand	Anodyne	CYP11B2	18	42
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(Cn2ccnc2)c1	ZINC000819085821	DE	On-Demand	Anodyne	CYP11B1	32	45
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(Cn2ccnc2)c1	ZINC000819085821	DE	On-Demand	Anodyne	TBXAS1	31	46
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(Cn2ccnc2)c1	ZINC000819085821	DE	On-Demand	Anodyne	CYP11B2	18	42
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(Cn2ccnc2)c1	ZINC000819085822	DE	On-Demand	Anodyne	CYP11B1	32	45
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(Cn2ccnc2)c1	ZINC000819085822	DE	On-Demand	Anodyne	TBXAS1	31	46
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(Cn2ccnc2)c1	ZINC000819085822	DE	On-Demand	Anodyne	CYP11B2	18	42
COc1cccc(OCCCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819085831	GH	On-Demand	Anodyne	ADRB2	53	42
COc1cccc(OCCCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819085831	GH	On-Demand	Anodyne	ADRB1	51	39
COc1cccc(OCCCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819085831	GH	On-Demand	Anodyne	DRD4	15	40
COc1cccc(OCCCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819085831	GH	On-Demand	Anodyne	ADRB3	50	39
COc1cccc(OCCCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819085831	GH	On-Demand	Anodyne	MTNR1A	22	48
COc1cccc(OCCCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819085831	GH	On-Demand	Anodyne	MTNR1B	25	48
COc1cccc(OCCCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819085832	GH	On-Demand	Anodyne	ADRB2	53	42
COc1cccc(OCCCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819085832	GH	On-Demand	Anodyne	ADRB1	51	39
COc1cccc(OCCCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819085832	GH	On-Demand	Anodyne	DRD4	15	40
COc1cccc(OCCCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819085832	GH	On-Demand	Anodyne	ADRB3	50	39
COc1cccc(OCCCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819085832	GH	On-Demand	Anodyne	MTNR1A	22	48
COc1cccc(OCCCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819085832	GH	On-Demand	Anodyne	MTNR1B	25	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCc2ccc(O)cc2)CC1	ZINC000819085835	GF	On-Demand	Anodyne	ADRB1	26	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCc2ccc(O)cc2)CC1	ZINC000819085835	GF	On-Demand	Anodyne	ADRB3	24	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCc2ccc(O)cc2)CC1	ZINC000819085835	GF	On-Demand	Anodyne	GRIA1	40	32
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCc2ccc(O)cc2)CC1	ZINC000819085835	GF	On-Demand	Anodyne	GPR119	48	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCc2ccc(O)cc2)CC1	ZINC000819085837	GF	On-Demand	Anodyne	ADRB1	26	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCc2ccc(O)cc2)CC1	ZINC000819085837	GF	On-Demand	Anodyne	ADRB3	24	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCc2ccc(O)cc2)CC1	ZINC000819085837	GF	On-Demand	Anodyne	GRIA1	40	32
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCc2ccc(O)cc2)CC1	ZINC000819085837	GF	On-Demand	Anodyne	GPR119	48	47
CN(C(=O)c1ccncc1)c1ccc(CNC[C@H](O)CCc2ccccc2)cc1	ZINC000819085964	GG	On-Demand	Anodyne	ADRB1	17	40
CN(C(=O)c1ccncc1)c1ccc(CNC[C@@H](O)CCc2ccccc2)cc1	ZINC000819085965	GG	On-Demand	Anodyne	ADRB1	17	40
CN(C(=O)c1ccncc1)c1ccc(CNC[C@](C)(O)C(F)(F)F)cc1	ZINC000819086037	FF	On-Demand	Anodyne	MLYCD	17	58
CN(C(=O)c1ccncc1)c1ccc(CNC[C@@](C)(O)C(F)(F)F)cc1	ZINC000819086039	FF	On-Demand	Anodyne	MLYCD	17	58
O[C@H](CNCCNc1nccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819086090	FF	On-Demand	Anodyne	ADRB1	37	46
O[C@H](CNCCNc1nccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819086090	FF	On-Demand	Anodyne	ADRB3	53	46
O[C@@H](CNCCNc1nccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819086091	FF	On-Demand	Anodyne	ADRB1	37	46
O[C@@H](CNCCNc1nccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819086091	FF	On-Demand	Anodyne	ADRB3	53	46
COc1cccc(OCCCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819086133	EG	On-Demand	Anodyne	DRD4	16	43
COc1cccc(OCCCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819086133	EG	On-Demand	Anodyne	MTNR1A	16	45
COc1cccc(OCCCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819086133	EG	On-Demand	Anodyne	MTNR1B	18	45
COc1cccc(OCCCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819086134	EG	On-Demand	Anodyne	DRD4	16	43
COc1cccc(OCCCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819086134	EG	On-Demand	Anodyne	MTNR1A	16	45
COc1cccc(OCCCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819086134	EG	On-Demand	Anodyne	MTNR1B	18	45
COc1cccc(OCCCNC[C@H](O)C2CC2)c1	ZINC000819086145	CD	On-Demand	Anodyne	ADRB2	15	45
COc1cccc(OCCCNC[C@H](O)C2CC2)c1	ZINC000819086145	CD	On-Demand	Anodyne	ADRB1	21	41
COc1cccc(OCCCNC[C@H](O)C2CC2)c1	ZINC000819086145	CD	On-Demand	Anodyne	DRD4	17	42
COc1cccc(OCCCNC[C@H](O)C2CC2)c1	ZINC000819086145	CD	On-Demand	Anodyne	MTNR1A	32	50
COc1cccc(OCCCNC[C@H](O)C2CC2)c1	ZINC000819086145	CD	On-Demand	Anodyne	MTNR1B	33	50
COc1cccc(OCCCNC[C@@H](O)C2CC2)c1	ZINC000819086146	CD	On-Demand	Anodyne	ADRB2	15	45
COc1cccc(OCCCNC[C@@H](O)C2CC2)c1	ZINC000819086146	CD	On-Demand	Anodyne	ADRB1	21	41
COc1cccc(OCCCNC[C@@H](O)C2CC2)c1	ZINC000819086146	CD	On-Demand	Anodyne	DRD4	17	42
COc1cccc(OCCCNC[C@@H](O)C2CC2)c1	ZINC000819086146	CD	On-Demand	Anodyne	MTNR1A	32	50
COc1cccc(OCCCNC[C@@H](O)C2CC2)c1	ZINC000819086146	CD	On-Demand	Anodyne	MTNR1B	33	50
COc1cccc(OCCCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819086152	EG	On-Demand	Anodyne	ADRB2	69	44
COc1cccc(OCCCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819086152	EG	On-Demand	Anodyne	ADRB1	79	53
COc1cccc(OCCCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819086152	EG	On-Demand	Anodyne	DRD4	24	51
COc1cccc(OCCCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819086152	EG	On-Demand	Anodyne	ADRB3	91	53
COc1cccc(OCCCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819086152	EG	On-Demand	Anodyne	MTNR1A	19	47
COc1cccc(OCCCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819086152	EG	On-Demand	Anodyne	MTNR1B	21	47
COc1cccc(OCCCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819086153	EG	On-Demand	Anodyne	ADRB2	69	44
COc1cccc(OCCCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819086153	EG	On-Demand	Anodyne	ADRB1	79	53
COc1cccc(OCCCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819086153	EG	On-Demand	Anodyne	DRD4	24	51
COc1cccc(OCCCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819086153	EG	On-Demand	Anodyne	ADRB3	91	53
COc1cccc(OCCCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819086153	EG	On-Demand	Anodyne	MTNR1A	19	47
COc1cccc(OCCCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819086153	EG	On-Demand	Anodyne	MTNR1B	21	47
O=C(NCc1cccc(NC(=O)C2CCC2)c1)C(F)=C1CCC1	ZINC000819086159	DG	On-Demand	Anodyne	NMT1	28	40
CC[C@@H](O)CNCCc1ccc(NC(=O)OC)cc1	ZINC000819086176	CD	On-Demand	Anodyne	ADRB2	70	56
CC[C@@H](O)CNCCc1ccc(NC(=O)OC)cc1	ZINC000819086176	CD	On-Demand	Anodyne	ADRB1	102	56
CC[C@@H](O)CNCCc1ccc(NC(=O)OC)cc1	ZINC000819086176	CD	On-Demand	Anodyne	ADRB3	122	56
CSCC[C@@H](C)NC[C@@H](O)COc1cccc2ccccc12	ZINC000819086181	DG	On-Demand	Anodyne	ADRB2	41	69
CSCC[C@@H](C)NC[C@@H](O)COc1cccc2ccccc12	ZINC000819086181	DG	On-Demand	Anodyne	ADRB1	41	69
CSCC[C@@H](C)NC[C@@H](O)COc1cccc2ccccc12	ZINC000819086181	DG	On-Demand	Anodyne	ADRB3	16	69
CSCC[C@@H](C)NC[C@@H](O)COc1cccc2ccccc12	ZINC000819086181	DG	On-Demand	Anodyne	CYP2D6	16	45
CCOc1cc(CCCNC[C@@H](O)c2ccc(F)c(F)c2)ccc1OC	ZINC000819086184	FH	On-Demand	Anodyne	ADRB2	58	39
CCOc1cc(CCCNC[C@@H](O)c2ccc(F)c(F)c2)ccc1OC	ZINC000819086184	FH	On-Demand	Anodyne	ADRB1	44	43
CCOc1cc(CCCNC[C@@H](O)c2ccc(F)c(F)c2)ccc1OC	ZINC000819086184	FH	On-Demand	Anodyne	ADRB3	49	48
CCOc1cc(CCCNC[C@H](O)c2ccc(F)c(F)c2)ccc1OC	ZINC000819086185	FH	On-Demand	Anodyne	ADRB2	58	39
CCOc1cc(CCCNC[C@H](O)c2ccc(F)c(F)c2)ccc1OC	ZINC000819086185	FH	On-Demand	Anodyne	ADRB1	44	43
CCOc1cc(CCCNC[C@H](O)c2ccc(F)c(F)c2)ccc1OC	ZINC000819086185	FH	On-Demand	Anodyne	ADRB3	49	48
CCOc1cc(CCCNC[C@H](O)c2ccccc2Cl)ccc1OC	ZINC000819086204	FI	On-Demand	Anodyne	ADRB2	53	38
CCOc1cc(CCCNC[C@H](O)c2ccccc2Cl)ccc1OC	ZINC000819086204	FI	On-Demand	Anodyne	ADRB1	50	44
CCOc1cc(CCCNC[C@H](O)c2ccccc2Cl)ccc1OC	ZINC000819086204	FI	On-Demand	Anodyne	ADRB3	41	44
CSCC[C@H](C)NC[C@@H](O)COc1cccc2ccccc12	ZINC000819086278	DG	On-Demand	Anodyne	ADRB2	41	69
CSCC[C@H](C)NC[C@@H](O)COc1cccc2ccccc12	ZINC000819086278	DG	On-Demand	Anodyne	ADRB1	41	69
CSCC[C@H](C)NC[C@@H](O)COc1cccc2ccccc12	ZINC000819086278	DG	On-Demand	Anodyne	ADRB3	16	69
CSCC[C@H](C)NC[C@@H](O)COc1cccc2ccccc12	ZINC000819086278	DG	On-Demand	Anodyne	CYP2D6	16	45
CSCC[C@H](C)NC[C@H](O)COc1cccc2ccccc12	ZINC000819086282	DG	On-Demand	Anodyne	ADRB2	41	69
CSCC[C@H](C)NC[C@H](O)COc1cccc2ccccc12	ZINC000819086282	DG	On-Demand	Anodyne	ADRB1	41	69
CSCC[C@H](C)NC[C@H](O)COc1cccc2ccccc12	ZINC000819086282	DG	On-Demand	Anodyne	ADRB3	16	69
CSCC[C@H](C)NC[C@H](O)COc1cccc2ccccc12	ZINC000819086282	DG	On-Demand	Anodyne	CYP2D6	16	45
CSCC[C@@H](C)NC[C@H](O)COc1cccc2ccccc12	ZINC000819086285	DG	On-Demand	Anodyne	ADRB2	41	69
CSCC[C@@H](C)NC[C@H](O)COc1cccc2ccccc12	ZINC000819086285	DG	On-Demand	Anodyne	ADRB1	41	69
CSCC[C@@H](C)NC[C@H](O)COc1cccc2ccccc12	ZINC000819086285	DG	On-Demand	Anodyne	ADRB3	16	69
CSCC[C@@H](C)NC[C@H](O)COc1cccc2ccccc12	ZINC000819086285	DG	On-Demand	Anodyne	CYP2D6	16	45
O=C(O)c1cccc2c1CCN(S(=O)(=O)CCc1ccc(Cl)cc1)C2	ZINC000819086290	GF	On-Demand	Anodyne	AKR1C3	57	43
CSCC[C@H](C)NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819086302	DG	On-Demand	Anodyne	ADRB2	15	44
CSCC[C@H](C)NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819086303	DG	On-Demand	Anodyne	ADRB2	15	44
CSCC[C@@H](C)NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819086305	DG	On-Demand	Anodyne	ADRB2	15	44
CSCC[C@@H](C)NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819086306	DG	On-Demand	Anodyne	ADRB2	15	44
COc1cccc(OCCCNC[C@@H](O)c2ccccc2F)c1	ZINC000819086310	DF	On-Demand	Anodyne	ADRB2	39	43
COc1cccc(OCCCNC[C@@H](O)c2ccccc2F)c1	ZINC000819086310	DF	On-Demand	Anodyne	ADRB1	43	43
COc1cccc(OCCCNC[C@@H](O)c2ccccc2F)c1	ZINC000819086310	DF	On-Demand	Anodyne	DRD4	27	45
COc1cccc(OCCCNC[C@@H](O)c2ccccc2F)c1	ZINC000819086310	DF	On-Demand	Anodyne	MTNR1A	19	47
COc1cccc(OCCCNC[C@@H](O)c2ccccc2F)c1	ZINC000819086310	DF	On-Demand	Anodyne	MTNR1B	21	47
COc1cccc(OCCCNC[C@H](O)c2ccccc2F)c1	ZINC000819086311	DF	On-Demand	Anodyne	ADRB2	39	43
COc1cccc(OCCCNC[C@H](O)c2ccccc2F)c1	ZINC000819086311	DF	On-Demand	Anodyne	ADRB1	43	43
COc1cccc(OCCCNC[C@H](O)c2ccccc2F)c1	ZINC000819086311	DF	On-Demand	Anodyne	DRD4	27	45
COc1cccc(OCCCNC[C@H](O)c2ccccc2F)c1	ZINC000819086311	DF	On-Demand	Anodyne	MTNR1A	19	47
COc1cccc(OCCCNC[C@H](O)c2ccccc2F)c1	ZINC000819086311	DF	On-Demand	Anodyne	MTNR1B	21	47
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2ccc(O)cc2)c1	ZINC000819086340	DF	On-Demand	Bother	ADRB2	73	43
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2ccc(O)cc2)c1	ZINC000819086340	DF	On-Demand	Bother	ADRB1	80	44
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2ccc(O)cc2)c1	ZINC000819086340	DF	On-Demand	Bother	ADRB3	121	44
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)CC1CC1	ZINC000819086341	EE	On-Demand	Anodyne	F2	37	42
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)CC1CC1	ZINC000819086341	EE	On-Demand	Anodyne	PLG	27	41
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)CC1CC1	ZINC000819086341	EE	On-Demand	Anodyne	ACE	28	49
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)CC1CC1	ZINC000819086341	EE	On-Demand	Anodyne	MME	59	49
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)CC1CC1	ZINC000819086341	EE	On-Demand	Anodyne	FCER2	25	40
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)CC1CC1	ZINC000819086341	EE	On-Demand	Anodyne	TRY2_BOVIN	104	41
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)CC1CC1	ZINC000819086341	EE	On-Demand	Anodyne	TRY1_BOVIN	17	42
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)CC1CC1	ZINC000819086341	EE	On-Demand	Anodyne	CPA1	31	47
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)CC1CC1	ZINC000819086341	EE	On-Demand	Anodyne	MMP2	18	42
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)CC1CC1	ZINC000819086341	EE	On-Demand	Anodyne	ECE1	32	44
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)CC1CC1	ZINC000819086341	EE	On-Demand	Anodyne	ACE2	63	49
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)CC1CC1	ZINC000819086341	EE	On-Demand	Anodyne	ST14	74	42
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)CC1CC1	ZINC000819086341	EE	On-Demand	Anodyne	PIN1	37	40
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2ccc(O)cc2)c1	ZINC000819086342	DF	On-Demand	Bother	ADRB2	73	43
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2ccc(O)cc2)c1	ZINC000819086342	DF	On-Demand	Bother	ADRB1	80	44
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2ccc(O)cc2)c1	ZINC000819086342	DF	On-Demand	Bother	ADRB3	121	44
CSCC[C@H](C)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819086343	DE	On-Demand	Mild	ADRB2	37	56
CSCC[C@H](C)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819086343	DE	On-Demand	Mild	ADRB1	42	56
CSCC[C@H](C)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819086343	DE	On-Demand	Mild	ADRB3	25	56
CSCC[C@@H](C)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819086346	DE	On-Demand	Mild	ADRB2	37	56
CSCC[C@@H](C)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819086346	DE	On-Demand	Mild	ADRB1	42	56
CSCC[C@@H](C)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819086346	DE	On-Demand	Mild	ADRB3	25	56
CSCC[C@@H](C)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819086347	DE	On-Demand	Mild	ADRB2	37	56
CSCC[C@@H](C)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819086347	DE	On-Demand	Mild	ADRB1	42	56
CSCC[C@@H](C)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819086347	DE	On-Demand	Mild	ADRB3	25	56
CSCC[C@H](C)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819086348	DE	On-Demand	Mild	ADRB2	37	56
CSCC[C@H](C)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819086348	DE	On-Demand	Mild	ADRB1	42	56
CSCC[C@H](C)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819086348	DE	On-Demand	Mild	ADRB3	25	56
COc1cccc(OCCCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819086349	EG	On-Demand	Anodyne	ADRB2	19	44
COc1cccc(OCCCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819086349	EG	On-Demand	Anodyne	DRD4	21	41
COc1cccc(OCCCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819086349	EG	On-Demand	Anodyne	MTNR1A	25	49
COc1cccc(OCCCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819086349	EG	On-Demand	Anodyne	MTNR1B	27	49
COc1cccc(OCCCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819086351	EG	On-Demand	Anodyne	ADRB2	19	44
COc1cccc(OCCCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819086351	EG	On-Demand	Anodyne	DRD4	21	41
COc1cccc(OCCCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819086351	EG	On-Demand	Anodyne	MTNR1A	25	49
COc1cccc(OCCCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819086351	EG	On-Demand	Anodyne	MTNR1B	27	49
CN(C[C@H](O)CN[C@@H](Cc1ccccc1)C1CC1)C(=O)OC(C)(C)C	ZINC000819086362	EF	On-Demand	Anodyne	PGC	54	33
CN(C[C@H](O)CN[C@@H](Cc1ccccc1)C1CC1)C(=O)OC(C)(C)C	ZINC000819086362	EF	On-Demand	Anodyne	REN	56	39
CN(C[C@H](O)CN[C@@H](Cc1ccccc1)C1CC1)C(=O)OC(C)(C)C	ZINC000819086362	EF	On-Demand	Anodyne	FPR1	47	39
CN(C[C@H](O)CN[C@H](Cc1ccccc1)C1CC1)C(=O)OC(C)(C)C	ZINC000819086363	EF	On-Demand	Anodyne	PGC	54	33
CN(C[C@H](O)CN[C@H](Cc1ccccc1)C1CC1)C(=O)OC(C)(C)C	ZINC000819086363	EF	On-Demand	Anodyne	REN	56	39
CN(C[C@H](O)CN[C@H](Cc1ccccc1)C1CC1)C(=O)OC(C)(C)C	ZINC000819086363	EF	On-Demand	Anodyne	FPR1	47	39
CN(C[C@@H](O)CN[C@@H](Cc1ccccc1)C1CC1)C(=O)OC(C)(C)C	ZINC000819086364	EF	On-Demand	Anodyne	PGC	54	33
CN(C[C@@H](O)CN[C@@H](Cc1ccccc1)C1CC1)C(=O)OC(C)(C)C	ZINC000819086364	EF	On-Demand	Anodyne	REN	56	39
CN(C[C@@H](O)CN[C@@H](Cc1ccccc1)C1CC1)C(=O)OC(C)(C)C	ZINC000819086364	EF	On-Demand	Anodyne	FPR1	47	39
CN(C[C@@H](O)CN[C@H](Cc1ccccc1)C1CC1)C(=O)OC(C)(C)C	ZINC000819086365	EF	On-Demand	Anodyne	PGC	54	33
CN(C[C@@H](O)CN[C@H](Cc1ccccc1)C1CC1)C(=O)OC(C)(C)C	ZINC000819086365	EF	On-Demand	Anodyne	REN	56	39
CN(C[C@@H](O)CN[C@H](Cc1ccccc1)C1CC1)C(=O)OC(C)(C)C	ZINC000819086365	EF	On-Demand	Anodyne	FPR1	47	39
O=C(O)[C@@H]1CCO[C@@H]1CNS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819086369	ED	On-Demand	Anodyne	MMP12	16	40
O=C(O)[C@@H]1CCO[C@H]1CNS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819086370	ED	On-Demand	Anodyne	MMP12	16	40
O=C(O)[C@H]1CCO[C@@H]1CNS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819086371	ED	On-Demand	Anodyne	MMP12	16	40
O=C(O)[C@H]1CCO[C@H]1CNS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819086373	ED	On-Demand	Anodyne	MMP12	16	40
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819086383	DF	On-Demand	Anodyne	ADRB2	65	44
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819086383	DF	On-Demand	Anodyne	ADRB1	62	41
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819086383	DF	On-Demand	Anodyne	DRD4	18	42
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819086383	DF	On-Demand	Anodyne	ADRB3	57	39
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819086383	DF	On-Demand	Anodyne	MTNR1A	23	48
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819086383	DF	On-Demand	Anodyne	MTNR1B	27	48
COc1cccc(OCCCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819086384	DF	On-Demand	Anodyne	ADRB2	65	44
COc1cccc(OCCCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819086384	DF	On-Demand	Anodyne	ADRB1	62	41
COc1cccc(OCCCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819086384	DF	On-Demand	Anodyne	DRD4	18	42
COc1cccc(OCCCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819086384	DF	On-Demand	Anodyne	ADRB3	57	39
COc1cccc(OCCCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819086384	DF	On-Demand	Anodyne	MTNR1A	23	48
COc1cccc(OCCCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819086384	DF	On-Demand	Anodyne	MTNR1B	27	48
Cn1cnnc1CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819086387	GG	On-Demand	Anodyne	REN	64	43
Cn1cnnc1CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819086389	GG	On-Demand	Anodyne	REN	64	43
COc1cccc(OCCCNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819086392	FH	On-Demand	Anodyne	ADRB2	48	41
COc1cccc(OCCCNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819086392	FH	On-Demand	Anodyne	ADRB1	50	40
COc1cccc(OCCCNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819086392	FH	On-Demand	Anodyne	DRD4	20	40
COc1cccc(OCCCNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819086392	FH	On-Demand	Anodyne	ADRB3	55	40
COc1cccc(OCCCNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819086393	FH	On-Demand	Anodyne	ADRB2	48	41
COc1cccc(OCCCNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819086393	FH	On-Demand	Anodyne	ADRB1	50	40
COc1cccc(OCCCNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819086393	FH	On-Demand	Anodyne	DRD4	20	40
COc1cccc(OCCCNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819086393	FH	On-Demand	Anodyne	ADRB3	55	40
O=C(c1coc(=O)c2ccccc12)N1CCC([C@@H](O)c2ccccc2)CC1	ZINC000819086395	FG	On-Demand	Anodyne	L3MBTL3	23	42
O=C(c1coc(=O)c2ccccc12)N1CCC([C@H](O)c2ccccc2)CC1	ZINC000819086396	FG	On-Demand	Anodyne	L3MBTL3	23	42
COc1cccc(OCCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819086397	FH	On-Demand	Anodyne	ADRB2	42	40
COc1cccc(OCCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819086397	FH	On-Demand	Anodyne	ADRB1	43	39
COc1cccc(OCCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819086397	FH	On-Demand	Anodyne	ADRB3	49	39
COc1cccc(OCCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819086397	FH	On-Demand	Anodyne	MTNR1A	15	45
COc1cccc(OCCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819086397	FH	On-Demand	Anodyne	MTNR1B	17	45
COc1cccc(OCCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819086398	FH	On-Demand	Anodyne	ADRB2	42	40
COc1cccc(OCCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819086398	FH	On-Demand	Anodyne	ADRB1	43	39
COc1cccc(OCCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819086398	FH	On-Demand	Anodyne	ADRB3	49	39
COc1cccc(OCCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819086398	FH	On-Demand	Anodyne	MTNR1A	15	45
COc1cccc(OCCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819086398	FH	On-Demand	Anodyne	MTNR1B	17	45
COc1cccc(OCCCNC[C@H](O)c2ccccc2C)c1	ZINC000819086405	DG	On-Demand	Anodyne	ADRB2	49	41
COc1cccc(OCCCNC[C@H](O)c2ccccc2C)c1	ZINC000819086405	DG	On-Demand	Anodyne	ADRB1	50	41
COc1cccc(OCCCNC[C@H](O)c2ccccc2C)c1	ZINC000819086405	DG	On-Demand	Anodyne	DRD4	18	46
COc1cccc(OCCCNC[C@H](O)c2ccccc2C)c1	ZINC000819086405	DG	On-Demand	Anodyne	MTNR1A	23	48
COc1cccc(OCCCNC[C@H](O)c2ccccc2C)c1	ZINC000819086405	DG	On-Demand	Anodyne	MTNR1B	27	48
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)CCc1c(C)c2ccc(OC)cc2oc1=O	ZINC000819086406	IG	On-Demand	Anodyne	MAOB	32	43
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)CCc1c(C)c2ccc(OC)cc2oc1=O	ZINC000819086406	IG	On-Demand	Anodyne	NQO1	17	42
COc1cccc(OCCCNC[C@@H](O)c2ccccc2C)c1	ZINC000819086407	DG	On-Demand	Anodyne	ADRB2	49	41
COc1cccc(OCCCNC[C@@H](O)c2ccccc2C)c1	ZINC000819086407	DG	On-Demand	Anodyne	ADRB1	50	41
COc1cccc(OCCCNC[C@@H](O)c2ccccc2C)c1	ZINC000819086407	DG	On-Demand	Anodyne	DRD4	18	46
COc1cccc(OCCCNC[C@@H](O)c2ccccc2C)c1	ZINC000819086407	DG	On-Demand	Anodyne	MTNR1A	23	48
COc1cccc(OCCCNC[C@@H](O)c2ccccc2C)c1	ZINC000819086407	DG	On-Demand	Anodyne	MTNR1B	27	48
CSCC[C@@H](C)NCCC(=O)Nc1ccccc1	ZINC000819086417	CF	On-Demand	Anodyne	LTA4H	25	47
CSCC[C@H](C)NCCC(=O)Nc1ccccc1	ZINC000819086418	CF	On-Demand	Anodyne	LTA4H	25	47
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CCc1c(C)c2ccc(OC)cc2oc1=O	ZINC000819086420	IG	On-Demand	Anodyne	MAOB	32	43
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)CCc1c(C)c2ccc(OC)cc2oc1=O	ZINC000819086420	IG	On-Demand	Anodyne	NQO1	17	42
O=C(O)c1cccc2c1CCN(S(=O)(=O)CCOCC1CC1)C2	ZINC000819086422	ED	On-Demand	Anodyne	AKR1C3	53	40
COc1ccc(C)cc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819086446	GG	On-Demand	Mild	PAPA1_CARPA	52	49
COc1ccc(C)cc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819086446	GG	On-Demand	Mild	CTSL	21	48
COc1ccc(C)cc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819086446	GG	On-Demand	Mild	CTSS	16	53
COc1ccc(C)cc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819086447	GG	On-Demand	Mild	PAPA1_CARPA	52	49
COc1ccc(C)cc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819086447	GG	On-Demand	Mild	CTSL	21	48
COc1ccc(C)cc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819086447	GG	On-Demand	Mild	CTSS	16	53
COc1cccc(OCCCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819086481	FH	On-Demand	Anodyne	ADRB2	27	41
COc1cccc(OCCCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819086481	FH	On-Demand	Anodyne	DRD4	15	43
COc1cccc(OCCCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819086481	FH	On-Demand	Anodyne	MTNR1B	15	44
COc1cccc(OCCCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819086482	FH	On-Demand	Anodyne	ADRB2	27	41
COc1cccc(OCCCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819086482	FH	On-Demand	Anodyne	DRD4	15	43
COc1cccc(OCCCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819086482	FH	On-Demand	Anodyne	MTNR1B	15	44
CSCC[C@H](C)NC[C@@H](O)COc1ccc(Cl)cc1Br	ZINC000819086487	GH	On-Demand	Anodyne	ADRB2	19	42
CSCC[C@H](C)NC[C@H](O)COc1ccc(Cl)cc1Br	ZINC000819086488	GH	On-Demand	Anodyne	ADRB2	19	42
CSCC[C@@H](C)NC[C@H](O)COc1ccc(Cl)cc1Br	ZINC000819086489	GH	On-Demand	Anodyne	ADRB2	19	42
CSCC[C@@H](C)NC[C@@H](O)COc1ccc(Cl)cc1Br	ZINC000819086490	GH	On-Demand	Anodyne	ADRB2	19	42
CSCC[C@H](C)NC[C@@H](O)CO[C@H]1CCCc2ccccc21	ZINC000819086499	DG	On-Demand	Anodyne	ADRB2	15	41
CSCC[C@H](C)NC[C@H](O)CO[C@@H]1CCCc2ccccc21	ZINC000819086500	DG	On-Demand	Anodyne	ADRB2	15	41
CSCC[C@H](C)NC[C@@H](O)CO[C@@H]1CCCc2ccccc21	ZINC000819086501	DG	On-Demand	Anodyne	ADRB2	15	41
CSCC[C@H](C)NC[C@H](O)CO[C@H]1CCCc2ccccc21	ZINC000819086502	DG	On-Demand	Anodyne	ADRB2	15	41
O=C(NCc1cccc(Cn2ccnc2)c1)C(F)=C1CCC1	ZINC000819086505	CF	On-Demand	Anodyne	CYP19A1	24	48
O=C(NCc1cccc(Cn2ccnc2)c1)C(F)=C1CCC1	ZINC000819086505	CF	On-Demand	Anodyne	CYP11B1	50	51
O=C(NCc1cccc(Cn2ccnc2)c1)C(F)=C1CCC1	ZINC000819086505	CF	On-Demand	Anodyne	TBXAS1	44	47
O=C(NCc1cccc(Cn2ccnc2)c1)C(F)=C1CCC1	ZINC000819086505	CF	On-Demand	Anodyne	CYP11B2	24	48
COc1cccc(OCCCNC[C@@H](O)c2cc3ccccc3o2)c1	ZINC000819086518	EH	On-Demand	Anodyne	ADRB2	22	41
COc1cccc(OCCCNC[C@@H](O)c2cc3ccccc3o2)c1	ZINC000819086518	EH	On-Demand	Anodyne	DRD4	15	40
COc1cccc(OCCCNC[C@@H](O)c2cc3ccccc3o2)c1	ZINC000819086518	EH	On-Demand	Anodyne	MTNR1A	36	44
COc1cccc(OCCCNC[C@@H](O)c2cc3ccccc3o2)c1	ZINC000819086518	EH	On-Demand	Anodyne	MTNR1B	32	44
CSCC[C@@H](C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819086521	DG	On-Demand	Anodyne	ADRB2	40	69
CSCC[C@@H](C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819086521	DG	On-Demand	Anodyne	ADRB1	32	49
CSCC[C@@H](C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819086521	DG	On-Demand	Anodyne	ADRB3	19	49
CSCC[C@@H](C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819086522	DG	On-Demand	Anodyne	ADRB2	40	69
CSCC[C@@H](C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819086522	DG	On-Demand	Anodyne	ADRB1	32	49
CSCC[C@@H](C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819086522	DG	On-Demand	Anodyne	ADRB3	19	49
CSCC[C@H](C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819086523	DG	On-Demand	Anodyne	ADRB2	40	69
CSCC[C@H](C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819086523	DG	On-Demand	Anodyne	ADRB1	32	49
CSCC[C@H](C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819086523	DG	On-Demand	Anodyne	ADRB3	19	49
CSCC[C@H](C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819086524	DG	On-Demand	Anodyne	ADRB2	40	69
CSCC[C@H](C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819086524	DG	On-Demand	Anodyne	ADRB1	32	49
CSCC[C@H](C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819086524	DG	On-Demand	Anodyne	ADRB3	19	49
O=C(O)C[C@H](Cc1ccccc1)NS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819086539	GF	On-Demand	Anodyne	MME	65	44
O=C(O)C[C@H](Cc1ccccc1)NS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819086539	GF	On-Demand	Anodyne	TBXA2R	43	38
O=C(O)C[C@H](Cc1ccccc1)NS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819086539	GF	On-Demand	Anodyne	CPA1	40	39
O=C(O)C[C@H](Cc1ccccc1)NS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819086539	GF	On-Demand	Anodyne	CAPN1	37	41
O=C(O)C[C@H](Cc1ccccc1)NS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819086539	GF	On-Demand	Anodyne	CAPN2	54	32
O=C(O)C[C@H](Cc1ccccc1)NS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819086539	GF	On-Demand	Anodyne	MMP12	15	44
O=C(O)C[C@H](Cc1ccccc1)NS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819086539	GF	On-Demand	Anodyne	AMP1_PLAFQ	19	41
O=C(O)C[C@@H](Cc1ccccc1)NS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819086540	GF	On-Demand	Anodyne	MME	65	44
O=C(O)C[C@@H](Cc1ccccc1)NS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819086540	GF	On-Demand	Anodyne	TBXA2R	43	38
O=C(O)C[C@@H](Cc1ccccc1)NS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819086540	GF	On-Demand	Anodyne	CPA1	40	39
O=C(O)C[C@@H](Cc1ccccc1)NS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819086540	GF	On-Demand	Anodyne	CAPN1	37	41
O=C(O)C[C@@H](Cc1ccccc1)NS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819086540	GF	On-Demand	Anodyne	CAPN2	54	32
O=C(O)C[C@@H](Cc1ccccc1)NS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819086540	GF	On-Demand	Anodyne	MMP12	15	44
O=C(O)C[C@@H](Cc1ccccc1)NS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819086540	GF	On-Demand	Anodyne	AMP1_PLAFQ	19	41
CC[C@@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(F)cc1F	ZINC000819086543	GI	On-Demand	Anodyne	GPR119	47	55
CC[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(F)cc1F	ZINC000819086546	GI	On-Demand	Anodyne	GPR119	47	55
COc1cccc(OCCCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819086547	EG	On-Demand	Anodyne	ADRB2	59	42
COc1cccc(OCCCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819086547	EG	On-Demand	Anodyne	ADRB1	64	43
COc1cccc(OCCCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819086547	EG	On-Demand	Anodyne	DRD4	24	46
COc1cccc(OCCCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819086547	EG	On-Demand	Anodyne	ADRB3	68	43
COc1cccc(OCCCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819086547	EG	On-Demand	Anodyne	MTNR1A	22	48
COc1cccc(OCCCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819086547	EG	On-Demand	Anodyne	MTNR1B	25	48
COc1cccc(OCCCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819086558	GH	On-Demand	Anodyne	ADRB2	36	43
COc1cccc(OCCCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819086558	GH	On-Demand	Anodyne	ADRB1	39	41
COc1cccc(OCCCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819086558	GH	On-Demand	Anodyne	DRD4	16	45
COc1cccc(OCCCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819086558	GH	On-Demand	Anodyne	MTNR1A	20	47
COc1cccc(OCCCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819086558	GH	On-Demand	Anodyne	MTNR1B	22	47
COc1cccc(OCCCNC[C@H](O)c2ccccc2Br)c1	ZINC000819086559	GH	On-Demand	Anodyne	ADRB2	36	43
COc1cccc(OCCCNC[C@H](O)c2ccccc2Br)c1	ZINC000819086559	GH	On-Demand	Anodyne	ADRB1	39	41
COc1cccc(OCCCNC[C@H](O)c2ccccc2Br)c1	ZINC000819086559	GH	On-Demand	Anodyne	DRD4	16	45
COc1cccc(OCCCNC[C@H](O)c2ccccc2Br)c1	ZINC000819086559	GH	On-Demand	Anodyne	MTNR1A	20	47
COc1cccc(OCCCNC[C@H](O)c2ccccc2Br)c1	ZINC000819086559	GH	On-Demand	Anodyne	MTNR1B	22	47
N#Cc1ccc([C@H](O)CNCCCc2ccc(O)cc2)cc1	ZINC000819086571	CF	On-Demand	Mild	ADRB2	59	49
N#Cc1ccc([C@H](O)CNCCCc2ccc(O)cc2)cc1	ZINC000819086571	CF	On-Demand	Mild	ADRB1	55	47
N#Cc1ccc([C@H](O)CNCCCc2ccc(O)cc2)cc1	ZINC000819086571	CF	On-Demand	Mild	ADRB3	58	47
N#Cc1ccc([C@@H](O)CNCCCc2ccc(O)cc2)cc1	ZINC000819086572	CF	On-Demand	Mild	ADRB2	59	49
N#Cc1ccc([C@@H](O)CNCCCc2ccc(O)cc2)cc1	ZINC000819086572	CF	On-Demand	Mild	ADRB1	55	47
N#Cc1ccc([C@@H](O)CNCCCc2ccc(O)cc2)cc1	ZINC000819086572	CF	On-Demand	Mild	ADRB3	58	47
Oc1ccc(CCCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819086579	FH	On-Demand	Anodyne	ADRB2	78	50
Oc1ccc(CCCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819086579	FH	On-Demand	Anodyne	ADRB1	85	50
Oc1ccc(CCCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819086579	FH	On-Demand	Anodyne	ADRB3	93	51
Oc1ccc(CCCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819086579	FH	On-Demand	Anodyne	SLC6A5	15	49
Oc1ccc(CCCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819086580	FH	On-Demand	Anodyne	ADRB2	78	50
Oc1ccc(CCCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819086580	FH	On-Demand	Anodyne	ADRB1	85	50
Oc1ccc(CCCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819086580	FH	On-Demand	Anodyne	ADRB3	93	51
Oc1ccc(CCCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819086580	FH	On-Demand	Anodyne	SLC6A5	15	49
O[C@@H](CNCCCNc1ccccn1)c1ccc(OC(F)(F)F)cc1	ZINC000819086614	FG	On-Demand	Anodyne	ADRB3	24	44
O[C@H](CNCCCNc1ccccn1)c1ccc(OC(F)(F)F)cc1	ZINC000819086615	FG	On-Demand	Anodyne	ADRB3	24	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](O)c1ccc(Cl)cc1)C2	ZINC000819086634	FE	On-Demand	Anodyne	SLC6A3	34	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](O)c1ccc(Cl)cc1)C2	ZINC000819086635	FE	On-Demand	Anodyne	SLC6A3	34	40
Oc1ccc(CCCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819086653	DF	On-Demand	Anodyne	ADRB2	49	39
Oc1ccc(CCCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819086653	DF	On-Demand	Anodyne	ADRB1	49	46
Oc1ccc(CCCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819086653	DF	On-Demand	Anodyne	ADRB3	43	46
Oc1ccc(CCCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819086653	DF	On-Demand	Anodyne	SLC6A5	23	42
Oc1ccc(CCCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819086654	DF	On-Demand	Anodyne	ADRB2	49	39
Oc1ccc(CCCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819086654	DF	On-Demand	Anodyne	ADRB1	49	46
Oc1ccc(CCCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819086654	DF	On-Demand	Anodyne	ADRB3	43	46
Oc1ccc(CCCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819086654	DF	On-Demand	Anodyne	SLC6A5	23	42
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2ccc(O)cc2)cc1	ZINC000819086655	EE	On-Demand	Anodyne	ADRB2	92	58
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2ccc(O)cc2)cc1	ZINC000819086655	EE	On-Demand	Anodyne	ADRB1	81	47
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2ccc(O)cc2)cc1	ZINC000819086655	EE	On-Demand	Anodyne	ADRB3	155	45
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2ccc(O)cc2)cc1	ZINC000819086656	EE	On-Demand	Anodyne	ADRB2	92	58
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2ccc(O)cc2)cc1	ZINC000819086656	EE	On-Demand	Anodyne	ADRB1	81	47
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2ccc(O)cc2)cc1	ZINC000819086656	EE	On-Demand	Anodyne	ADRB3	155	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](O)c1ccc(Cl)cc1)C2	ZINC000819086672	FE	On-Demand	Anodyne	SLC6A3	34	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](O)c1ccc(Cl)cc1)C2	ZINC000819086673	FE	On-Demand	Anodyne	SLC6A3	34	40
CC(C)(C)OC(=O)N1CCN(S(=O)(=O)CCOCC2CC2)[C@@H](C(=O)O)C1	ZINC000819086675	GC	On-Demand	Anodyne	GPR119	33	40
CC(C)(C)OC(=O)N1CCN(S(=O)(=O)CCOCC2CC2)[C@H](C(=O)O)C1	ZINC000819086676	GC	On-Demand	Anodyne	GPR119	33	40
CCOC(=O)C1CCC(O)(CNCCc2ccc(NC(=O)OC)cc2)CC1	ZINC000819086679	GE	On-Demand	Anodyne	TIMP3	48	32
O[C@H](CNCCNc1nccc(C(F)(F)F)n1)c1cccnc1	ZINC000819086686	ED	On-Demand	Anodyne	ADRB2	25	44
O[C@H](CNCCNc1nccc(C(F)(F)F)n1)c1cccnc1	ZINC000819086686	ED	On-Demand	Anodyne	ADRB1	28	49
O[C@H](CNCCNc1nccc(C(F)(F)F)n1)c1cccnc1	ZINC000819086686	ED	On-Demand	Anodyne	ADRB3	98	49
O[C@@H](CNCCNc1nccc(C(F)(F)F)n1)c1cccnc1	ZINC000819086687	ED	On-Demand	Anodyne	ADRB2	25	44
O[C@@H](CNCCNc1nccc(C(F)(F)F)n1)c1cccnc1	ZINC000819086687	ED	On-Demand	Anodyne	ADRB1	28	49
O[C@@H](CNCCNc1nccc(C(F)(F)F)n1)c1cccnc1	ZINC000819086687	ED	On-Demand	Anodyne	ADRB3	98	49
COc1cccc(OCCCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819086694	EG	On-Demand	Anodyne	ADRB2	46	41
COc1cccc(OCCCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819086694	EG	On-Demand	Anodyne	ADRB1	51	41
COc1cccc(OCCCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819086694	EG	On-Demand	Anodyne	MTNR1A	20	47
COc1cccc(OCCCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819086694	EG	On-Demand	Anodyne	MTNR1B	22	47
COc1cccc(OCCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819086725	EF	On-Demand	Bother	ADRB2	42	40
COc1cccc(OCCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819086725	EF	On-Demand	Bother	ADRB1	54	41
COc1cccc(OCCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819086725	EF	On-Demand	Bother	ADRB3	63	41
COc1cccc(OCCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819086725	EF	On-Demand	Bother	CACNA1D	46	38
COc1cccc(OCCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819086725	EF	On-Demand	Bother	MTNR1A	17	45
COc1cccc(OCCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819086725	EF	On-Demand	Bother	MTNR1B	19	45
COc1cccc(OCCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819086725	EF	On-Demand	Bother	ACR	19	40
COc1cccc(OCCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819086726	EF	On-Demand	Bother	ADRB2	42	40
COc1cccc(OCCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819086726	EF	On-Demand	Bother	ADRB1	54	41
COc1cccc(OCCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819086726	EF	On-Demand	Bother	ADRB3	63	41
COc1cccc(OCCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819086726	EF	On-Demand	Bother	CACNA1D	46	38
COc1cccc(OCCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819086726	EF	On-Demand	Bother	MTNR1A	17	45
COc1cccc(OCCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819086726	EF	On-Demand	Bother	MTNR1B	19	45
COc1cccc(OCCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819086726	EF	On-Demand	Bother	ACR	19	40
COc1cccc(OCCCNC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819086748	EG	On-Demand	Anodyne	ADRB2	42	41
COc1cccc(OCCCNC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819086748	EG	On-Demand	Anodyne	ADRB1	40	41
COc1cccc(OCCCNC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819086748	EG	On-Demand	Anodyne	DRD4	18	41
COc1cccc(OCCCNC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819086748	EG	On-Demand	Anodyne	MTNR1A	15	45
COc1cccc(OCCCNC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819086748	EG	On-Demand	Anodyne	MTNR1B	17	45
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819086749	EG	On-Demand	Anodyne	ADRB2	42	41
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819086749	EG	On-Demand	Anodyne	ADRB1	40	41
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819086749	EG	On-Demand	Anodyne	DRD4	18	41
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819086749	EG	On-Demand	Anodyne	MTNR1A	15	45
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819086749	EG	On-Demand	Anodyne	MTNR1B	17	45
COc1cccc(OCCCNC[C@H](O)c2cccnc2)c1	ZINC000819086750	DE	On-Demand	Anodyne	ADRB2	55	57
COc1cccc(OCCCNC[C@H](O)c2cccnc2)c1	ZINC000819086750	DE	On-Demand	Anodyne	ADRB1	64	57
COc1cccc(OCCCNC[C@H](O)c2cccnc2)c1	ZINC000819086750	DE	On-Demand	Anodyne	ADRB3	133	58
COc1cccc(OCCCNC[C@H](O)c2cccnc2)c1	ZINC000819086750	DE	On-Demand	Anodyne	MTNR1A	16	46
COc1cccc(OCCCNC[C@H](O)c2cccnc2)c1	ZINC000819086750	DE	On-Demand	Anodyne	MTNR1B	18	46
COc1cccc(OCCCNC[C@@H](O)c2cccnc2)c1	ZINC000819086751	DE	On-Demand	Anodyne	ADRB2	55	57
COc1cccc(OCCCNC[C@@H](O)c2cccnc2)c1	ZINC000819086751	DE	On-Demand	Anodyne	ADRB1	64	57
COc1cccc(OCCCNC[C@@H](O)c2cccnc2)c1	ZINC000819086751	DE	On-Demand	Anodyne	ADRB3	133	58
COc1cccc(OCCCNC[C@@H](O)c2cccnc2)c1	ZINC000819086751	DE	On-Demand	Anodyne	MTNR1A	16	46
COc1cccc(OCCCNC[C@@H](O)c2cccnc2)c1	ZINC000819086751	DE	On-Demand	Anodyne	MTNR1B	18	46
COc1cccc(OCCCNCCC(=O)N(C)OC)c1	ZINC000819086752	CD	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCCNCCC(=O)N(C)OC)c1	ZINC000819086752	CD	On-Demand	Anodyne	MTNR1A	58	55
COc1cccc(OCCCNCCC(=O)N(C)OC)c1	ZINC000819086752	CD	On-Demand	Anodyne	MTNR1B	56	55
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819086760	EG	On-Demand	Anodyne	ADRB2	55	43
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819086760	EG	On-Demand	Anodyne	ADRB1	53	39
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819086760	EG	On-Demand	Anodyne	ADRB3	61	39
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819086760	EG	On-Demand	Anodyne	MTNR1A	16	46
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819086760	EG	On-Demand	Anodyne	MTNR1B	18	46
COc1cccc(OCCCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819086761	EG	On-Demand	Anodyne	ADRB2	55	43
COc1cccc(OCCCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819086761	EG	On-Demand	Anodyne	ADRB1	53	39
COc1cccc(OCCCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819086761	EG	On-Demand	Anodyne	ADRB3	61	39
COc1cccc(OCCCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819086761	EG	On-Demand	Anodyne	MTNR1A	16	46
COc1cccc(OCCCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819086761	EG	On-Demand	Anodyne	MTNR1B	18	46
C[C@@H](CC(=O)N1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1)n1cccn1	ZINC000819086764	GG	On-Demand	Anodyne	FAAH	21	46
CN(C)c1ccc(NC(=O)CCNCCCc2ccc(O)cc2)cc1	ZINC000819086780	EG	On-Demand	Anodyne	GRIA1	54	36
Oc1ccc(CCCNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819086785	EH	On-Demand	Anodyne	ADRB2	64	45
Oc1ccc(CCCNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819086785	EH	On-Demand	Anodyne	ADRB1	65	43
Oc1ccc(CCCNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819086785	EH	On-Demand	Anodyne	ADRB3	94	43
Oc1ccc(CCCNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819086785	EH	On-Demand	Anodyne	SLC6A5	15	41
Oc1ccc(CCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819086786	EH	On-Demand	Anodyne	ADRB2	64	45
Oc1ccc(CCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819086786	EH	On-Demand	Anodyne	ADRB1	65	43
Oc1ccc(CCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819086786	EH	On-Demand	Anodyne	ADRB3	94	43
Oc1ccc(CCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819086786	EH	On-Demand	Anodyne	SLC6A5	15	41
COc1cccc(OCCCNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819086807	DG	On-Demand	Anodyne	ADRB2	61	42
COc1cccc(OCCCNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819086807	DG	On-Demand	Anodyne	ADRB1	58	43
COc1cccc(OCCCNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819086807	DG	On-Demand	Anodyne	DRD4	20	47
COc1cccc(OCCCNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819086807	DG	On-Demand	Anodyne	ADRB3	61	43
COc1cccc(OCCCNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819086807	DG	On-Demand	Anodyne	MTNR1A	24	49
COc1cccc(OCCCNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819086807	DG	On-Demand	Anodyne	MTNR1B	28	49
COc1cccc(OCCCNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819086808	DG	On-Demand	Anodyne	ADRB2	61	42
COc1cccc(OCCCNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819086808	DG	On-Demand	Anodyne	ADRB1	58	43
COc1cccc(OCCCNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819086808	DG	On-Demand	Anodyne	DRD4	20	47
COc1cccc(OCCCNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819086808	DG	On-Demand	Anodyne	ADRB3	61	43
COc1cccc(OCCCNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819086808	DG	On-Demand	Anodyne	MTNR1A	24	49
COc1cccc(OCCCNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819086808	DG	On-Demand	Anodyne	MTNR1B	28	49
CSCC[C@@H](C)NC[C@@H](O)COc1c(C)ccc(C)c1C	ZINC000819086815	DG	On-Demand	Anodyne	ADRB2	21	43
CSCC[C@H](C)NC[C@@H](O)COc1c(C)ccc(C)c1C	ZINC000819086816	DG	On-Demand	Anodyne	ADRB2	21	43
CSCC[C@H](C)NC[C@H](O)COc1c(C)ccc(C)c1C	ZINC000819086818	DG	On-Demand	Anodyne	ADRB2	21	43
CSCC[C@@H](C)NC[C@H](O)COc1c(C)ccc(C)c1C	ZINC000819086819	DG	On-Demand	Anodyne	ADRB2	21	43
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086821	GH	On-Demand	Anodyne	GHRHR	53	33
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086821	GH	On-Demand	Anodyne	PGC	42	31
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086821	GH	On-Demand	Anodyne	TIMP3	43	32
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086821	GH	On-Demand	Anodyne	REN	40	35
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086821	GH	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086822	GH	On-Demand	Anodyne	GHRHR	53	33
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086822	GH	On-Demand	Anodyne	PGC	42	31
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086822	GH	On-Demand	Anodyne	TIMP3	43	32
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086822	GH	On-Demand	Anodyne	REN	40	35
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086822	GH	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086824	GH	On-Demand	Anodyne	GHRHR	53	33
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086824	GH	On-Demand	Anodyne	PGC	42	31
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086824	GH	On-Demand	Anodyne	TIMP3	43	32
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086824	GH	On-Demand	Anodyne	REN	40	35
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086824	GH	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086826	GH	On-Demand	Anodyne	GHRHR	53	33
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086826	GH	On-Demand	Anodyne	PGC	42	31
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086826	GH	On-Demand	Anodyne	TIMP3	43	32
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086826	GH	On-Demand	Anodyne	REN	40	35
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000819086826	GH	On-Demand	Anodyne	GPR119	29	40
CSCC[C@H](C)NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819086837	EG	On-Demand	Anodyne	ADRB2	21	48
CSCC[C@H](C)NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819086837	EG	On-Demand	Anodyne	ADRB1	23	48
CSCC[C@H](C)NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819086837	EG	On-Demand	Anodyne	PDS	57	44
CSCC[C@@H](C)NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819086838	EG	On-Demand	Anodyne	ADRB2	21	48
CSCC[C@@H](C)NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819086838	EG	On-Demand	Anodyne	ADRB1	23	48
CSCC[C@@H](C)NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819086838	EG	On-Demand	Anodyne	PDS	57	44
CSCC[C@H](C)NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819086840	EG	On-Demand	Anodyne	ADRB2	21	48
CSCC[C@H](C)NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819086840	EG	On-Demand	Anodyne	ADRB1	23	48
CSCC[C@H](C)NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819086840	EG	On-Demand	Anodyne	PDS	57	44
CSCC[C@@H](C)NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819086841	EG	On-Demand	Anodyne	ADRB2	21	48
CSCC[C@@H](C)NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819086841	EG	On-Demand	Anodyne	ADRB1	23	48
CSCC[C@@H](C)NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819086841	EG	On-Demand	Anodyne	PDS	57	44
COc1cccc(OCCCNCCS(C)(=O)=O)c1	ZINC000819086847	CD	On-Demand	Anodyne	DRD4	22	49
COc1cccc(OCCCNCCS(C)(=O)=O)c1	ZINC000819086847	CD	On-Demand	Anodyne	MTNR1A	46	55
COc1cccc(OCCCNCCS(C)(=O)=O)c1	ZINC000819086847	CD	On-Demand	Anodyne	MTNR1B	45	55
COc1cccc(OCCCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819086855	EF	On-Demand	Mild	ADRB2	42	44
COc1cccc(OCCCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819086855	EF	On-Demand	Mild	ADRB1	45	40
COc1cccc(OCCCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819086855	EF	On-Demand	Mild	DRD4	15	41
COc1cccc(OCCCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819086855	EF	On-Demand	Mild	ADRB3	42	40
COc1cccc(OCCCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819086855	EF	On-Demand	Mild	MTNR1A	16	45
COc1cccc(OCCCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819086855	EF	On-Demand	Mild	MTNR1B	18	45
COc1cccc(OCCCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819086856	EF	On-Demand	Mild	ADRB2	42	44
COc1cccc(OCCCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819086856	EF	On-Demand	Mild	ADRB1	45	40
COc1cccc(OCCCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819086856	EF	On-Demand	Mild	DRD4	15	41
COc1cccc(OCCCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819086856	EF	On-Demand	Mild	ADRB3	42	40
COc1cccc(OCCCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819086856	EF	On-Demand	Mild	MTNR1A	16	45
COc1cccc(OCCCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819086856	EF	On-Demand	Mild	MTNR1B	18	45
O=C(CCc1cccc(OC(F)F)c1)N1CCC([C@@H](O)c2ccccc2)CC1	ZINC000819086869	GI	On-Demand	Anodyne	GRIN2B	18	42
O=C(CCc1cccc(OC(F)F)c1)N1CCC([C@@H](O)c2ccccc2)CC1	ZINC000819086869	GI	On-Demand	Anodyne	C3AR1	46	45
O=C(CCc1cccc(OC(F)F)c1)N1CCC([C@H](O)c2ccccc2)CC1	ZINC000819086870	GI	On-Demand	Anodyne	GRIN2B	18	42
O=C(CCc1cccc(OC(F)F)c1)N1CCC([C@H](O)c2ccccc2)CC1	ZINC000819086870	GI	On-Demand	Anodyne	C3AR1	46	45
O=C(O)[C@@H](CC1CC1)NS(=O)(=O)c1ccc2ccccc2c1Br	ZINC000819086889	GG	On-Demand	Anodyne	MMP13	16	42
O=C(O)[C@@H](CC1CC1)NS(=O)(=O)c1ccc2ccccc2c1Br	ZINC000819086889	GG	On-Demand	Anodyne	TRY2_BOVIN	43	32
O=C(O)[C@@H](CC1CC1)NS(=O)(=O)c1ccc2ccccc2c1Br	ZINC000819086889	GG	On-Demand	Anodyne	MMP2	27	42
COc1cccc(OCCCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819086891	EF	On-Demand	Bother	ADRB2	46	41
COc1cccc(OCCCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819086891	EF	On-Demand	Bother	ADRB1	52	41
COc1cccc(OCCCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819086891	EF	On-Demand	Bother	ADRB3	54	41
COc1cccc(OCCCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819086891	EF	On-Demand	Bother	MTNR1A	20	46
COc1cccc(OCCCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819086891	EF	On-Demand	Bother	MTNR1B	23	46
COc1cccc(OCCCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819086891	EF	On-Demand	Bother	ACR	19	46
COc1cccc(OCCCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819086893	EF	On-Demand	Bother	ADRB2	46	41
COc1cccc(OCCCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819086893	EF	On-Demand	Bother	ADRB1	52	41
COc1cccc(OCCCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819086893	EF	On-Demand	Bother	ADRB3	54	41
COc1cccc(OCCCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819086893	EF	On-Demand	Bother	MTNR1A	20	46
COc1cccc(OCCCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819086893	EF	On-Demand	Bother	MTNR1B	23	46
COc1cccc(OCCCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819086893	EF	On-Demand	Bother	ACR	19	46
O=C(O)COC1CCN(S(=O)(=O)CCc2ccc(Cl)cc2)CC1	ZINC000819086914	FD	On-Demand	Anodyne	PTPN2	30	40
O=C(O)COC1CCN(S(=O)(=O)CCc2ccc(Cl)cc2)CC1	ZINC000819086914	FD	On-Demand	Anodyne	MMP12	15	41
COc1cccc(OCCCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819086918	DF	On-Demand	Anodyne	ADRB2	48	41
COc1cccc(OCCCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819086918	DF	On-Demand	Anodyne	ADRB1	55	42
COc1cccc(OCCCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819086918	DF	On-Demand	Anodyne	DRD4	17	40
COc1cccc(OCCCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819086918	DF	On-Demand	Anodyne	ADRB3	63	42
COc1cccc(OCCCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819086918	DF	On-Demand	Anodyne	MTNR1A	18	47
COc1cccc(OCCCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819086918	DF	On-Demand	Anodyne	MTNR1B	20	47
COc1cccc(OCCCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819086920	DF	On-Demand	Anodyne	ADRB2	48	41
COc1cccc(OCCCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819086920	DF	On-Demand	Anodyne	ADRB1	55	42
COc1cccc(OCCCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819086920	DF	On-Demand	Anodyne	DRD4	17	40
COc1cccc(OCCCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819086920	DF	On-Demand	Anodyne	ADRB3	63	42
COc1cccc(OCCCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819086920	DF	On-Demand	Anodyne	MTNR1A	18	47
COc1cccc(OCCCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819086920	DF	On-Demand	Anodyne	MTNR1B	20	47
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819086930	EG	On-Demand	Anodyne	ADRB2	44	41
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819086930	EG	On-Demand	Anodyne	ADRB1	44	41
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819086930	EG	On-Demand	Anodyne	DRD4	16	41
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819086930	EG	On-Demand	Anodyne	MTNR1A	15	45
COc1cccc(OCCCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819086930	EG	On-Demand	Anodyne	MTNR1B	17	45
COc1cccc(OCCCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819086932	EG	On-Demand	Anodyne	ADRB2	44	41
COc1cccc(OCCCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819086932	EG	On-Demand	Anodyne	ADRB1	44	41
COc1cccc(OCCCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819086932	EG	On-Demand	Anodyne	DRD4	16	41
COc1cccc(OCCCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819086932	EG	On-Demand	Anodyne	MTNR1A	15	45
COc1cccc(OCCCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819086932	EG	On-Demand	Anodyne	MTNR1B	17	45
Oc1ccc(CCCNC[C@H](O)c2ccccc2Br)cc1	ZINC000819086973	FG	On-Demand	Anodyne	ADRB2	64	46
Oc1ccc(CCCNC[C@H](O)c2ccccc2Br)cc1	ZINC000819086973	FG	On-Demand	Anodyne	ADRB1	59	46
Oc1ccc(CCCNC[C@H](O)c2ccccc2Br)cc1	ZINC000819086973	FG	On-Demand	Anodyne	ADRB3	51	45
Oc1ccc(CCCNC[C@H](O)c2ccccc2Br)cc1	ZINC000819086973	FG	On-Demand	Anodyne	SLC6A5	23	44
CSCC[C@@H](C)NC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819087001	EG	On-Demand	Anodyne	ADRB2	31	51
CSCC[C@H](C)NC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819087002	EG	On-Demand	Anodyne	ADRB2	31	51
CSCC[C@H](C)NC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819087003	EG	On-Demand	Anodyne	ADRB2	31	51
CSCC[C@@H](C)NC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819087004	EG	On-Demand	Anodyne	ADRB2	31	51
C[C@@H](CCNS(=O)(=O)CCc1ccc(Cl)cc1)C(=O)O	ZINC000819087023	DD	On-Demand	Anodyne	TBXA2R	43	35
C[C@@H](CCNS(=O)(=O)CCc1ccc(Cl)cc1)C(=O)O	ZINC000819087023	DD	On-Demand	Anodyne	TBXAS1	23	41
C[C@@H](CCNS(=O)(=O)CCc1ccc(Cl)cc1)C(=O)O	ZINC000819087023	DD	On-Demand	Anodyne	MMP12	15	49
C[C@H](CCNS(=O)(=O)CCc1ccc(Cl)cc1)C(=O)O	ZINC000819087024	DD	On-Demand	Anodyne	TBXA2R	43	35
C[C@H](CCNS(=O)(=O)CCc1ccc(Cl)cc1)C(=O)O	ZINC000819087024	DD	On-Demand	Anodyne	TBXAS1	23	41
C[C@H](CCNS(=O)(=O)CCc1ccc(Cl)cc1)C(=O)O	ZINC000819087024	DD	On-Demand	Anodyne	MMP12	15	49
CSCC[C@H](C)NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819087047	EE	On-Demand	Anodyne	ADRB2	15	41
CSCC[C@H](C)NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819087047	EE	On-Demand	Anodyne	ADRB1	18	41
CSCC[C@H](C)NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819087048	EE	On-Demand	Anodyne	ADRB2	15	41
CSCC[C@H](C)NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819087048	EE	On-Demand	Anodyne	ADRB1	18	41
CSCC[C@@H](C)NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819087049	EE	On-Demand	Anodyne	ADRB2	15	41
CSCC[C@@H](C)NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819087049	EE	On-Demand	Anodyne	ADRB1	18	41
CSCC[C@@H](C)NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819087050	EE	On-Demand	Anodyne	ADRB2	15	41
CSCC[C@@H](C)NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819087050	EE	On-Demand	Anodyne	ADRB1	18	41
O[C@@H](CN[C@H]1CC=CCC1)c1cccc(Cl)c1	ZINC000819087067	CG	On-Demand	Anodyne	ADRB1	37	45
O[C@@H](CN[C@H]1CC=CCC1)c1cccc(Cl)c1	ZINC000819087067	CG	On-Demand	Anodyne	ADRB3	52	49
O[C@@H](CN[C@H]1CC=CCC1)c1cccc(Cl)c1	ZINC000819087067	CG	On-Demand	Anodyne	CYP3A4	40	35
O[C@@H](CN[C@@H]1CC=CCC1)c1cccc(Cl)c1	ZINC000819087068	CG	On-Demand	Anodyne	ADRB1	37	45
O[C@@H](CN[C@@H]1CC=CCC1)c1cccc(Cl)c1	ZINC000819087068	CG	On-Demand	Anodyne	ADRB3	52	49
O[C@@H](CN[C@@H]1CC=CCC1)c1cccc(Cl)c1	ZINC000819087068	CG	On-Demand	Anodyne	CYP3A4	40	35
O[C@H](CN[C@H]1CC=CCC1)c1cccc(Cl)c1	ZINC000819087069	CG	On-Demand	Anodyne	ADRB1	37	45
O[C@H](CN[C@H]1CC=CCC1)c1cccc(Cl)c1	ZINC000819087069	CG	On-Demand	Anodyne	ADRB3	52	49
O[C@H](CN[C@H]1CC=CCC1)c1cccc(Cl)c1	ZINC000819087069	CG	On-Demand	Anodyne	CYP3A4	40	35
O[C@H](CN[C@@H]1CC=CCC1)c1cccc(Cl)c1	ZINC000819087070	CG	On-Demand	Anodyne	ADRB1	37	45
O[C@H](CN[C@@H]1CC=CCC1)c1cccc(Cl)c1	ZINC000819087070	CG	On-Demand	Anodyne	ADRB3	52	49
O[C@H](CN[C@@H]1CC=CCC1)c1cccc(Cl)c1	ZINC000819087070	CG	On-Demand	Anodyne	CYP3A4	40	35
Oc1ccc(CCCNC[C@@H](O)c2ccccc2Br)cc1	ZINC000819087074	FG	On-Demand	Anodyne	ADRB2	64	46
Oc1ccc(CCCNC[C@@H](O)c2ccccc2Br)cc1	ZINC000819087074	FG	On-Demand	Anodyne	ADRB1	59	46
Oc1ccc(CCCNC[C@@H](O)c2ccccc2Br)cc1	ZINC000819087074	FG	On-Demand	Anodyne	ADRB3	51	45
Oc1ccc(CCCNC[C@@H](O)c2ccccc2Br)cc1	ZINC000819087074	FG	On-Demand	Anodyne	SLC6A5	23	44
Oc1ccc(CCCNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819087095	DG	On-Demand	Anodyne	ADRB2	47	38
Oc1ccc(CCCNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819087095	DG	On-Demand	Anodyne	ADRB1	40	45
Oc1ccc(CCCNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819087095	DG	On-Demand	Anodyne	ADRB3	39	45
Oc1ccc(CCCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819087138	DG	On-Demand	Anodyne	ADRB2	97	48
Oc1ccc(CCCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819087138	DG	On-Demand	Anodyne	ADRB1	104	60
Oc1ccc(CCCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819087138	DG	On-Demand	Anodyne	ADRB3	134	60
Oc1ccc(CCCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819087138	DG	On-Demand	Anodyne	SLC6A5	21	44
Oc1ccc(CCCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819087139	DG	On-Demand	Anodyne	ADRB2	97	48
Oc1ccc(CCCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819087139	DG	On-Demand	Anodyne	ADRB1	104	60
Oc1ccc(CCCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819087139	DG	On-Demand	Anodyne	ADRB3	134	60
Oc1ccc(CCCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819087139	DG	On-Demand	Anodyne	SLC6A5	21	44
Oc1ccc(CCCNC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819087144	DG	On-Demand	Anodyne	ADRB2	56	40
Oc1ccc(CCCNC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819087144	DG	On-Demand	Anodyne	ADRB1	48	42
Oc1ccc(CCCNC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819087144	DG	On-Demand	Anodyne	ADRB3	31	42
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819087145	DG	On-Demand	Anodyne	ADRB2	56	40
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819087145	DG	On-Demand	Anodyne	ADRB1	48	42
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819087145	DG	On-Demand	Anodyne	ADRB3	31	42
COc1ccc(OC)c([C@H](O)CNCCCc2ccc(O)cc2)c1	ZINC000819087172	EF	On-Demand	Anodyne	ADRB2	80	56
COc1ccc(OC)c([C@H](O)CNCCCc2ccc(O)cc2)c1	ZINC000819087172	EF	On-Demand	Anodyne	ADRB1	78	60
COc1ccc(OC)c([C@H](O)CNCCCc2ccc(O)cc2)c1	ZINC000819087172	EF	On-Demand	Anodyne	ADRB3	60	60
COc1ccc(OC)c([C@H](O)CNCCCc2ccc(O)cc2)c1	ZINC000819087172	EF	On-Demand	Anodyne	SLC6A5	15	42
CSC[C@@H](C)NC[C@H](O)c1cc(C)cc(C)c1	ZINC000819087197	CF	On-Demand	Anodyne	ADRB2	15	45
CSC[C@@H](C)NC[C@@H](O)c1cc(C)cc(C)c1	ZINC000819087198	CF	On-Demand	Anodyne	ADRB2	15	45
O=C(O)[C@H](CC1CCOCC1)NS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819087203	GE	On-Demand	Anodyne	MMP2	56	38
O=C(O)[C@@H](CC1CCOCC1)NS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819087204	GE	On-Demand	Anodyne	MMP2	56	38
O=C(C(F)=C1CCC1)N(CCO)Cc1ccccc1	ZINC000819087215	CE	On-Demand	Anodyne	LIMK2	18	46
CSC[C@@H](C)NC[C@@H](O)c1ccc(C)cc1	ZINC000819087219	BE	On-Demand	Anodyne	ADRB2	16	67
CSC[C@@H](C)NC[C@@H](O)c1ccc(C)cc1	ZINC000819087219	BE	On-Demand	Anodyne	ADRB3	21	42
CSC[C@@H](C)NC[C@H](O)c1ccc(C)cc1	ZINC000819087221	BE	On-Demand	Anodyne	ADRB2	16	67
CSC[C@@H](C)NC[C@H](O)c1ccc(C)cc1	ZINC000819087221	BE	On-Demand	Anodyne	ADRB3	21	42
CSCC[C@@H](C)NC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819087253	DG	On-Demand	Anodyne	ADRB2	21	54
CSCC[C@@H](C)NC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819087254	DG	On-Demand	Anodyne	ADRB2	21	54
CSCC[C@H](C)NC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819087255	DG	On-Demand	Anodyne	ADRB2	21	54
CSCC[C@H](C)NC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819087256	DG	On-Demand	Anodyne	ADRB2	21	54
CSC[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819087257	CF	On-Demand	Anodyne	ADRB2	32	57
CSC[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819087257	CF	On-Demand	Anodyne	ADRB1	44	57
CSC[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819087257	CF	On-Demand	Anodyne	ADRB3	67	57
CSC[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819087260	CF	On-Demand	Anodyne	ADRB2	32	57
CSC[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819087260	CF	On-Demand	Anodyne	ADRB1	44	57
CSC[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819087260	CF	On-Demand	Anodyne	ADRB3	67	57
CSCC[C@@H](C)NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819087261	EE	On-Demand	Anodyne	ADRB2	46	70
CSCC[C@@H](C)NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819087261	EE	On-Demand	Anodyne	ADRB1	72	70
CSCC[C@@H](C)NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819087261	EE	On-Demand	Anodyne	ADRB3	43	51
CSCC[C@@H](C)NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819087262	EE	On-Demand	Anodyne	ADRB2	46	70
CSCC[C@@H](C)NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819087262	EE	On-Demand	Anodyne	ADRB1	72	70
CSCC[C@@H](C)NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819087262	EE	On-Demand	Anodyne	ADRB3	43	51
CSCC[C@H](C)NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819087263	EE	On-Demand	Anodyne	ADRB2	46	70
CSCC[C@H](C)NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819087263	EE	On-Demand	Anodyne	ADRB1	72	70
CSCC[C@H](C)NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819087263	EE	On-Demand	Anodyne	ADRB3	43	51
CSCC[C@H](C)NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819087264	EE	On-Demand	Anodyne	ADRB2	46	70
CSCC[C@H](C)NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819087264	EE	On-Demand	Anodyne	ADRB1	72	70
CSCC[C@H](C)NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819087264	EE	On-Demand	Anodyne	ADRB3	43	51
CSCC[C@H](C)NC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819087270	DG	On-Demand	Anodyne	ADRB2	21	52
CSCC[C@@H](C)NC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819087271	DG	On-Demand	Anodyne	ADRB2	21	52
CSCC[C@H](C)NC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819087272	DG	On-Demand	Anodyne	ADRB2	21	52
CSCC[C@@H](C)NC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819087273	DG	On-Demand	Anodyne	ADRB2	21	52
Oc1ccc(CCCNC[C@H](O)C2CC2)cc1	ZINC000819087339	BD	On-Demand	Anodyne	ADRB2	22	49
Oc1ccc(CCCNC[C@H](O)C2CC2)cc1	ZINC000819087339	BD	On-Demand	Anodyne	ADRB1	28	49
Oc1ccc(CCCNC[C@H](O)C2CC2)cc1	ZINC000819087339	BD	On-Demand	Anodyne	ADRB3	23	49
Oc1ccc(CCCNC[C@@H](O)C2CC2)cc1	ZINC000819087340	BD	On-Demand	Anodyne	ADRB2	22	49
Oc1ccc(CCCNC[C@@H](O)C2CC2)cc1	ZINC000819087340	BD	On-Demand	Anodyne	ADRB1	28	49
Oc1ccc(CCCNC[C@@H](O)C2CC2)cc1	ZINC000819087340	BD	On-Demand	Anodyne	ADRB3	23	49
Cc1ccccc1[C@@H](O)CNCCCc1ccc(O)cc1	ZINC000819087362	CF	On-Demand	Anodyne	ADRB2	87	46
Cc1ccccc1[C@@H](O)CNCCCc1ccc(O)cc1	ZINC000819087362	CF	On-Demand	Anodyne	ADRB1	77	48
Cc1ccccc1[C@@H](O)CNCCCc1ccc(O)cc1	ZINC000819087362	CF	On-Demand	Anodyne	GNRHR	15	46
Cc1ccccc1[C@@H](O)CNCCCc1ccc(O)cc1	ZINC000819087362	CF	On-Demand	Anodyne	ADRB3	66	48
Cc1ccccc1[C@@H](O)CNCCCc1ccc(O)cc1	ZINC000819087362	CF	On-Demand	Anodyne	GRIA1	50	37
Cc1ccccc1[C@@H](O)CNCCCc1ccc(O)cc1	ZINC000819087362	CF	On-Demand	Anodyne	SLC6A5	24	44
Oc1ccc(CCCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819087365	DG	On-Demand	Anodyne	ADRB2	71	52
Oc1ccc(CCCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819087365	DG	On-Demand	Anodyne	ADRB1	71	47
Oc1ccc(CCCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819087365	DG	On-Demand	Anodyne	ADRB3	80	47
Oc1ccc(CCCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819087365	DG	On-Demand	Anodyne	GRIA1	41	31
Oc1ccc(CCCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819087365	DG	On-Demand	Anodyne	SLC6A5	15	43
CSCC[C@@H](C)NCCC(=O)Nc1ccc(Cl)cc1	ZINC000819087393	DG	On-Demand	Anodyne	FPR1	28	42
CSCC[C@H](C)NCCC(=O)Nc1ccc(Cl)cc1	ZINC000819087394	DG	On-Demand	Anodyne	FPR1	28	42
CSC[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819087399	BD	On-Demand	Anodyne	ADRB2	27	41
CSC[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819087399	BD	On-Demand	Anodyne	ADRB1	30	57
CSC[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819087399	BD	On-Demand	Anodyne	ADRB3	83	57
CSC[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819087400	BD	On-Demand	Anodyne	ADRB2	27	41
CSC[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819087400	BD	On-Demand	Anodyne	ADRB1	30	57
CSC[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819087400	BD	On-Demand	Anodyne	ADRB3	83	57
CSCC[C@@H](C)NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819087435	DE	On-Demand	Bother	ADRB2	28	48
CSCC[C@@H](C)NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819087435	DE	On-Demand	Bother	ADRB1	41	37
CSCC[C@H](C)NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819087436	DE	On-Demand	Bother	ADRB2	28	48
CSCC[C@H](C)NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819087436	DE	On-Demand	Bother	ADRB1	41	37
CSCC[C@H](C)NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819087437	DE	On-Demand	Bother	ADRB2	28	48
CSCC[C@H](C)NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819087437	DE	On-Demand	Bother	ADRB1	41	37
CSCC[C@@H](C)NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819087438	DE	On-Demand	Bother	ADRB2	28	48
CSCC[C@@H](C)NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819087438	DE	On-Demand	Bother	ADRB1	41	37
CCCC[C@@H](COC)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819087444	CE	On-Demand	Bother	CACNA1C	51	39
CCCC[C@@H](COC)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819087444	CE	On-Demand	Bother	CACNA1D	79	39
CCCC[C@H](COC)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819087445	CE	On-Demand	Bother	CACNA1C	51	39
CCCC[C@H](COC)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819087445	CE	On-Demand	Bother	CACNA1D	79	39
CCCC[C@H](COC)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819087446	CE	On-Demand	Bother	CACNA1C	51	39
CCCC[C@H](COC)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819087446	CE	On-Demand	Bother	CACNA1D	79	39
CCCC[C@@H](COC)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819087447	CE	On-Demand	Bother	CACNA1C	51	39
CCCC[C@@H](COC)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819087447	CE	On-Demand	Bother	CACNA1D	79	39
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC([C@H](O)c2ccccc2)CC1	ZINC000819087454	GF	On-Demand	Anodyne	HTR1D	45	37
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC([C@H](O)c2ccccc2)CC1	ZINC000819087454	GF	On-Demand	Anodyne	KCNJ1	55	38
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC([C@@H](O)c2ccccc2)CC1	ZINC000819087455	GF	On-Demand	Anodyne	HTR1D	45	37
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC([C@@H](O)c2ccccc2)CC1	ZINC000819087455	GF	On-Demand	Anodyne	KCNJ1	55	38
CSCC[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000819087456	CE	On-Demand	Anodyne	MME	28	42
CSCC[C@H](C)NC[C@H](O)Cc1ccccc1	ZINC000819087456	CE	On-Demand	Anodyne	FPR1	39	40
CSCC[C@H](C)NC[C@@H](O)Cc1ccccc1	ZINC000819087457	CE	On-Demand	Anodyne	MME	28	42
CSCC[C@H](C)NC[C@@H](O)Cc1ccccc1	ZINC000819087457	CE	On-Demand	Anodyne	FPR1	39	40
CSCC[C@@H](C)NC[C@@H](O)Cc1ccccc1	ZINC000819087458	CE	On-Demand	Anodyne	MME	28	42
CSCC[C@@H](C)NC[C@@H](O)Cc1ccccc1	ZINC000819087458	CE	On-Demand	Anodyne	FPR1	39	40
CSCC[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000819087459	CE	On-Demand	Anodyne	MME	28	42
CSCC[C@@H](C)NC[C@H](O)Cc1ccccc1	ZINC000819087459	CE	On-Demand	Anodyne	FPR1	39	40
CSC[C@@H](C)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819087488	CF	On-Demand	Anodyne	ADRB2	16	55
CSC[C@@H](C)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819087489	CF	On-Demand	Anodyne	ADRB2	16	55
Oc1ccc(CCCNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819087495	DF	On-Demand	Anodyne	ADRB2	53	39
Oc1ccc(CCCNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819087495	DF	On-Demand	Anodyne	ADRB1	46	44
Oc1ccc(CCCNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819087495	DF	On-Demand	Anodyne	ADRB3	34	44
Oc1ccc(CCCNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819087495	DF	On-Demand	Anodyne	GRIA1	43	33
Oc1ccc(CCCNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819087495	DF	On-Demand	Anodyne	LEF	49	36
Oc1ccc(CCCNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819087496	DF	On-Demand	Anodyne	ADRB2	53	39
Oc1ccc(CCCNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819087496	DF	On-Demand	Anodyne	ADRB1	46	44
Oc1ccc(CCCNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819087496	DF	On-Demand	Anodyne	ADRB3	34	44
Oc1ccc(CCCNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819087496	DF	On-Demand	Anodyne	GRIA1	43	33
Oc1ccc(CCCNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819087496	DF	On-Demand	Anodyne	LEF	49	36
O[C@@H](CNCCCC1CC1)c1cccc(Cl)c1	ZINC000819087522	CG	On-Demand	Anodyne	ADRB2	58	44
O[C@@H](CNCCCC1CC1)c1cccc(Cl)c1	ZINC000819087522	CG	On-Demand	Anodyne	ADRB1	65	52
O[C@@H](CNCCCC1CC1)c1cccc(Cl)c1	ZINC000819087522	CG	On-Demand	Anodyne	ADRB3	75	52
O[C@H](CNCCCC1CC1)c1cccc(Cl)c1	ZINC000819087523	CG	On-Demand	Anodyne	ADRB2	58	44
O[C@H](CNCCCC1CC1)c1cccc(Cl)c1	ZINC000819087523	CG	On-Demand	Anodyne	ADRB1	65	52
O[C@H](CNCCCC1CC1)c1cccc(Cl)c1	ZINC000819087523	CG	On-Demand	Anodyne	ADRB3	75	52
Oc1ccc(CCCNC[C@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819087570	EH	On-Demand	Anodyne	ADRB2	53	43
Oc1ccc(CCCNC[C@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819087570	EH	On-Demand	Anodyne	ADRB1	54	43
Oc1ccc(CCCNC[C@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819087570	EH	On-Demand	Anodyne	ADRB3	49	43
Oc1ccc(CCCNC[C@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819087570	EH	On-Demand	Anodyne	SLC6A5	18	42
Oc1ccc(CCCNC[C@@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819087572	EH	On-Demand	Anodyne	ADRB2	53	43
Oc1ccc(CCCNC[C@@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819087572	EH	On-Demand	Anodyne	ADRB1	54	43
Oc1ccc(CCCNC[C@@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819087572	EH	On-Demand	Anodyne	ADRB3	49	43
Oc1ccc(CCCNC[C@@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819087572	EH	On-Demand	Anodyne	SLC6A5	18	42
CSCC[C@@H](C)NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819087578	DF	On-Demand	Anodyne	ADRB2	30	55
CSCC[C@@H](C)NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819087578	DF	On-Demand	Anodyne	ADRB1	29	55
CSCC[C@@H](C)NC[C@H](O)COc1ccc(SC)cc1	ZINC000819087581	DF	On-Demand	Anodyne	ADRB2	30	55
CSCC[C@@H](C)NC[C@H](O)COc1ccc(SC)cc1	ZINC000819087581	DF	On-Demand	Anodyne	ADRB1	29	55
CSCC[C@H](C)NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819087582	DF	On-Demand	Anodyne	ADRB2	30	55
CSCC[C@H](C)NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819087582	DF	On-Demand	Anodyne	ADRB1	29	55
CSCC[C@H](C)NC[C@H](O)COc1ccc(SC)cc1	ZINC000819087584	DF	On-Demand	Anodyne	ADRB2	30	55
CSCC[C@H](C)NC[C@H](O)COc1ccc(SC)cc1	ZINC000819087584	DF	On-Demand	Anodyne	ADRB1	29	55
C=CCC[C@@H](NS(=O)(=O)c1c(F)cc(C)cc1F)C(=O)O	ZINC000819087623	DD	On-Demand	Mild	ITGAV	59	46
C=CCC[C@H](NS(=O)(=O)c1c(F)cc(C)cc1F)C(=O)O	ZINC000819087626	DD	On-Demand	Mild	ITGAV	59	46
Oc1ccc(CCCNC[C@H](O)c2ccc(Br)cc2)cc1	ZINC000819087649	FG	On-Demand	Anodyne	ADRB2	64	56
Oc1ccc(CCCNC[C@H](O)c2ccc(Br)cc2)cc1	ZINC000819087649	FG	On-Demand	Anodyne	ADRB1	58	47
Oc1ccc(CCCNC[C@H](O)c2ccc(Br)cc2)cc1	ZINC000819087649	FG	On-Demand	Anodyne	ADRB3	68	47
Oc1ccc(CCCNC[C@@H](O)c2ccc(Br)cc2)cc1	ZINC000819087650	FG	On-Demand	Anodyne	ADRB2	64	56
Oc1ccc(CCCNC[C@@H](O)c2ccc(Br)cc2)cc1	ZINC000819087650	FG	On-Demand	Anodyne	ADRB1	58	47
Oc1ccc(CCCNC[C@@H](O)c2ccc(Br)cc2)cc1	ZINC000819087650	FG	On-Demand	Anodyne	ADRB3	68	47
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(OC)c1	ZINC000819087696	GH	On-Demand	Mild	PAPA1_CARPA	42	42
CN1C[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)CCC1=O	ZINC000819087710	DD	On-Demand	Anodyne	P2RX7	27	42
CN1C[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)CCC1=O	ZINC000819087711	DD	On-Demand	Anodyne	P2RX7	27	42
CN1C[C@H](NC[C@H](O)c2ccc(F)cc2Cl)CCC1=O	ZINC000819087712	DD	On-Demand	Anodyne	P2RX7	27	42
CN1C[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)CCC1=O	ZINC000819087713	DD	On-Demand	Anodyne	P2RX7	27	42
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087735	ED	On-Demand	Anodyne	HTR1A	57	50
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087735	ED	On-Demand	Anodyne	DRD2	42	50
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087735	ED	On-Demand	Anodyne	DRD4	46	38
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087735	ED	On-Demand	Anodyne	HTR2A	37	43
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087735	ED	On-Demand	Anodyne	DRD3	59	45
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087735	ED	On-Demand	Anodyne	HTR7	56	43
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087735	ED	On-Demand	Anodyne	PLD1	45	36
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087735	ED	On-Demand	Anodyne	PLD2	52	33
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087736	ED	On-Demand	Anodyne	HTR1A	57	50
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087736	ED	On-Demand	Anodyne	DRD2	42	50
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087736	ED	On-Demand	Anodyne	DRD4	46	38
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087736	ED	On-Demand	Anodyne	HTR2A	37	43
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087736	ED	On-Demand	Anodyne	DRD3	59	45
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087736	ED	On-Demand	Anodyne	HTR7	56	43
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087736	ED	On-Demand	Anodyne	PLD1	45	36
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087736	ED	On-Demand	Anodyne	PLD2	52	33
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087737	ED	On-Demand	Anodyne	HTR1A	57	50
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087737	ED	On-Demand	Anodyne	DRD2	42	50
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087737	ED	On-Demand	Anodyne	DRD4	46	38
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087737	ED	On-Demand	Anodyne	HTR2A	37	43
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087737	ED	On-Demand	Anodyne	DRD3	59	45
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087737	ED	On-Demand	Anodyne	HTR7	56	43
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087737	ED	On-Demand	Anodyne	PLD1	45	36
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087737	ED	On-Demand	Anodyne	PLD2	52	33
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087738	ED	On-Demand	Anodyne	HTR1A	57	50
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087738	ED	On-Demand	Anodyne	DRD2	42	50
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087738	ED	On-Demand	Anodyne	DRD4	46	38
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087738	ED	On-Demand	Anodyne	HTR2A	37	43
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087738	ED	On-Demand	Anodyne	DRD3	59	45
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087738	ED	On-Demand	Anodyne	HTR7	56	43
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087738	ED	On-Demand	Anodyne	PLD1	45	36
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2ccccc2)CC1	ZINC000819087738	ED	On-Demand	Anodyne	PLD2	52	33
CSC[C@@H](C)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819087830	DF	On-Demand	Anodyne	ADRB2	16	43
CSC[C@@H](C)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819087831	DF	On-Demand	Anodyne	ADRB2	16	43
CSCC[C@H](C)NC[C@H](O)CCc1ccccc1	ZINC000819087837	CF	On-Demand	Anodyne	MME	17	44
CSCC[C@@H](C)NC[C@@H](O)CCc1ccccc1	ZINC000819087838	CF	On-Demand	Anodyne	MME	17	44
CSCC[C@@H](C)NC[C@H](O)CCc1ccccc1	ZINC000819087839	CF	On-Demand	Anodyne	MME	17	44
CSCC[C@H](C)NC[C@@H](O)CCc1ccccc1	ZINC000819087840	CF	On-Demand	Anodyne	MME	17	44
CSC[C@@H](C)NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819087841	DF	On-Demand	Anodyne	ADRB2	18	41
CSC[C@@H](C)NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819087844	DF	On-Demand	Anodyne	ADRB2	18	41
O=S(=O)(C1CCOCC1)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819087847	FD	On-Demand	Anodyne	ADRB3	38	41
O=S(=O)(C1CCOCC1)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819087848	FD	On-Demand	Anodyne	ADRB3	38	41
COc1ccc(OC)c2c1CN(C(=O)Cc1cccc(NC(C)=O)c1)C[C@@H]2O	ZINC000819087873	GE	On-Demand	Anodyne	TSHR	61	31
Oc1ccc(CCCNC[C@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819087877	FH	On-Demand	Anodyne	ADRB2	61	46
Oc1ccc(CCCNC[C@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819087877	FH	On-Demand	Anodyne	ADRB1	53	44
Oc1ccc(CCCNC[C@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819087877	FH	On-Demand	Anodyne	ADRB3	59	44
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819087879	FH	On-Demand	Anodyne	ADRB2	61	46
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819087879	FH	On-Demand	Anodyne	ADRB1	53	44
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819087879	FH	On-Demand	Anodyne	ADRB3	59	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)Cc1ccccc1[N+](=O)[O-])C2	ZINC000819087880	FE	On-Demand	Bother	COLA	117	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)Cc1ccccc1[N+](=O)[O-])C2	ZINC000819087882	FE	On-Demand	Bother	COLA	117	37
Oc1ccc(CCCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819087943	CF	On-Demand	Anodyne	ADRB2	75	52
Oc1ccc(CCCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819087943	CF	On-Demand	Anodyne	ADRB1	67	47
Oc1ccc(CCCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819087943	CF	On-Demand	Anodyne	ADRB3	80	47
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819087944	CF	On-Demand	Anodyne	ADRB2	75	52
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819087944	CF	On-Demand	Anodyne	ADRB1	67	47
Oc1ccc(CCCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819087944	CF	On-Demand	Anodyne	ADRB3	80	47
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)c1cnn(CC2CC2)c1	ZINC000819087969	GE	On-Demand	Anodyne	F2	48	44
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)c1cnn(CC2CC2)c1	ZINC000819087969	GE	On-Demand	Anodyne	PLG	24	41
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)c1cnn(CC2CC2)c1	ZINC000819087969	GE	On-Demand	Anodyne	TRY2_BOVIN	99	43
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)c1cnn(CC2CC2)c1	ZINC000819087969	GE	On-Demand	Anodyne	TRY1_BOVIN	17	42
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)c1cnn(CC2CC2)c1	ZINC000819087969	GE	On-Demand	Anodyne	BDKRB1	18	40
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)c1cnn(CC2CC2)c1	ZINC000819087969	GE	On-Demand	Anodyne	MMP2	19	43
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)c1cnn(CC2CC2)c1	ZINC000819087969	GE	On-Demand	Anodyne	ACE2	20	40
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)c1cnn(CC2CC2)c1	ZINC000819087969	GE	On-Demand	Anodyne	ITGAV	53	35
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)c1cnn(CC2CC2)c1	ZINC000819087969	GE	On-Demand	Anodyne	ST14	102	43
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(C)c1	ZINC000819087990	FH	On-Demand	Mild	PAPA1_CARPA	45	42
CCN(C(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)c1ccccc1	ZINC000819088005	GH	On-Demand	Anodyne	PREP	23	44
CCN(C(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)c1ccccc1	ZINC000819088007	GH	On-Demand	Anodyne	PREP	23	44
COc1ccc(OC)c2c1CN(C(=O)Cc1cccc(NC(C)=O)c1)C[C@H]2O	ZINC000819088074	GE	On-Demand	Anodyne	TSHR	61	31
CSCC[C@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819088075	CG	On-Demand	Anodyne	ADRB2	26	54
CSCC[C@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819088075	CG	On-Demand	Anodyne	ADRB1	39	54
CSCC[C@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819088075	CG	On-Demand	Anodyne	ADRB3	60	54
CSCC[C@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819088076	CG	On-Demand	Anodyne	ADRB2	26	54
CSCC[C@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819088076	CG	On-Demand	Anodyne	ADRB1	39	54
CSCC[C@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819088076	CG	On-Demand	Anodyne	ADRB3	60	54
CSCC[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819088077	CG	On-Demand	Anodyne	ADRB2	26	54
CSCC[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819088077	CG	On-Demand	Anodyne	ADRB1	39	54
CSCC[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819088077	CG	On-Demand	Anodyne	ADRB3	60	54
CSCC[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819088078	CG	On-Demand	Anodyne	ADRB2	26	54
CSCC[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819088078	CG	On-Demand	Anodyne	ADRB1	39	54
CSCC[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819088078	CG	On-Demand	Anodyne	ADRB3	60	54
COc1ccc(OC)c2c1CN(C(=O)Cc1ccc(-n3cnnc3)cc1)C[C@@H]2O	ZINC000819088079	GD	On-Demand	Anodyne	KCNJ1	41	35
COc1ccc(OC)c2c1CN(C(=O)Cc1ccc(-n3cnnc3)cc1)C[C@H]2O	ZINC000819088080	GD	On-Demand	Anodyne	KCNJ1	41	35
O[C@@H](CNCCCC1CC1)c1ccc(OC(F)(F)F)cc1	ZINC000819088091	DG	On-Demand	Anodyne	ADRB3	28	42
O[C@H](CNCCCC1CC1)c1ccc(OC(F)(F)F)cc1	ZINC000819088092	DG	On-Demand	Anodyne	ADRB3	28	42
CSCC[C@H](C)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819088096	EF	On-Demand	Anodyne	GPR119	26	42
CSCC[C@@H](C)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819088097	EF	On-Demand	Anodyne	GPR119	26	42
CSCC[C@@H](C)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819088098	EF	On-Demand	Anodyne	GPR119	26	42
CSCC[C@H](C)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819088099	EF	On-Demand	Anodyne	GPR119	26	42
CSCC[C@@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819088114	EH	On-Demand	Anodyne	SLC1A1	19	40
CSCC[C@@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819088114	EH	On-Demand	Anodyne	SLC1A3	18	40
CSCC[C@@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819088114	EH	On-Demand	Anodyne	SLC1A2	32	40
CSCC[C@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819088115	EH	On-Demand	Anodyne	SLC1A1	19	40
CSCC[C@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819088115	EH	On-Demand	Anodyne	SLC1A3	18	40
CSCC[C@H](C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819088115	EH	On-Demand	Anodyne	SLC1A2	32	40
CSC[C@@H](C)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819088118	DF	On-Demand	Anodyne	ADRB2	15	68
CSC[C@@H](C)NC[C@H](O)c1ccc(Br)cc1	ZINC000819088121	DF	On-Demand	Anodyne	ADRB2	15	68
CSCC[C@@H](C)NCCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000819088126	DF	On-Demand	Bother	COLA	81	36
CSCC[C@H](C)NCCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000819088127	DF	On-Demand	Bother	COLA	81	36
CC[C@@H](NC[C@H](O)c1cccnc1)c1nccs1	ZINC000819088174	CE	On-Demand	Anodyne	ADRB2	17	43
CC[C@@H](NC[C@H](O)c1cccnc1)c1nccs1	ZINC000819088174	CE	On-Demand	Anodyne	ADRB1	21	44
CC[C@@H](NC[C@H](O)c1cccnc1)c1nccs1	ZINC000819088174	CE	On-Demand	Anodyne	ADRB3	69	44
CC[C@@H](NC[C@@H](O)c1cccnc1)c1nccs1	ZINC000819088177	CE	On-Demand	Anodyne	ADRB2	17	43
CC[C@@H](NC[C@@H](O)c1cccnc1)c1nccs1	ZINC000819088177	CE	On-Demand	Anodyne	ADRB1	21	44
CC[C@@H](NC[C@@H](O)c1cccnc1)c1nccs1	ZINC000819088177	CE	On-Demand	Anodyne	ADRB3	69	44
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)NCC3CCCC3)nn2)C1	ZINC000819088273	GF	On-Demand	Anodyne	CACNA1I	62	35
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)NCC3CCCC3)nn2)C1	ZINC000819088276	GF	On-Demand	Anodyne	CACNA1I	62	35
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)CN1CCOCC1	ZINC000819088278	DD	On-Demand	Anodyne	ADRB1	32	43
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)CN1CCOCC1	ZINC000819088278	DD	On-Demand	Anodyne	ADRB3	48	43
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)CN1CCOCC1	ZINC000819088278	DD	On-Demand	Anodyne	IGF1R	27	40
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)CN1CCOCC1	ZINC000819088278	DD	On-Demand	Anodyne	CYP3A4	46	37
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)CN1CCOCC1	ZINC000819088280	DD	On-Demand	Anodyne	ADRB1	32	43
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)CN1CCOCC1	ZINC000819088280	DD	On-Demand	Anodyne	ADRB3	48	43
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)CN1CCOCC1	ZINC000819088280	DD	On-Demand	Anodyne	IGF1R	27	40
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)CN1CCOCC1	ZINC000819088280	DD	On-Demand	Anodyne	CYP3A4	46	37
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)CN1CCOCC1	ZINC000819088282	DD	On-Demand	Anodyne	ADRB1	32	43
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)CN1CCOCC1	ZINC000819088282	DD	On-Demand	Anodyne	ADRB3	48	43
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)CN1CCOCC1	ZINC000819088282	DD	On-Demand	Anodyne	IGF1R	27	40
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)CN1CCOCC1	ZINC000819088282	DD	On-Demand	Anodyne	CYP3A4	46	37
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)CN1CCOCC1	ZINC000819088284	DD	On-Demand	Anodyne	ADRB1	32	43
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)CN1CCOCC1	ZINC000819088284	DD	On-Demand	Anodyne	ADRB3	48	43
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)CN1CCOCC1	ZINC000819088284	DD	On-Demand	Anodyne	IGF1R	27	40
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)CN1CCOCC1	ZINC000819088284	DD	On-Demand	Anodyne	CYP3A4	46	37
CC(C)n1ccc(CNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819088297	CF	On-Demand	Anodyne	ADRB1	29	42
CC(C)n1ccc(CNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819088297	CF	On-Demand	Anodyne	ADRB3	46	43
CC(C)n1ccc(CNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819088297	CF	On-Demand	Anodyne	CYP3A4	43	36
CC(C)n1ccc(CNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819088298	CF	On-Demand	Anodyne	ADRB1	29	42
CC(C)n1ccc(CNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819088298	CF	On-Demand	Anodyne	ADRB3	46	43
CC(C)n1ccc(CNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819088298	CF	On-Demand	Anodyne	CYP3A4	43	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)Nc2cccnc2)cc1	ZINC000819088307	GG	On-Demand	Anodyne	TRPV1	16	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)Nc2cccnc2)cc1	ZINC000819088307	GG	On-Demand	Anodyne	PRNP	50	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)Nc2cccnc2)cc1	ZINC000819088307	GG	On-Demand	Anodyne	RPS6KA3	21	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)Nc2cccnc2)cc1	ZINC000819088307	GG	On-Demand	Anodyne	NAMPT	33	71
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2cc(Cl)c(F)cc2[N+](=O)[O-])C1	ZINC000819088320	FD	On-Demand	Bother	SFRP1	42	34
CCc1nc2ccccc2n1CCNC[C@@H](O)c1cccc(Br)c1	ZINC000819088322	GH	On-Demand	Anodyne	ADRB3	20	41
CCc1nc2ccccc2n1CCNC[C@H](O)c1cccc(Br)c1	ZINC000819088323	GH	On-Demand	Anodyne	ADRB3	20	41
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819088349	FH	On-Demand	Anodyne	ADRB1	31	43
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819088349	FH	On-Demand	Anodyne	SLC6A3	30	42
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819088349	FH	On-Demand	Anodyne	GRIN2B	48	38
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819088349	FH	On-Demand	Anodyne	ADRB3	53	43
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819088349	FH	On-Demand	Anodyne	CCR1	38	42
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819088349	FH	On-Demand	Anodyne	EPHX2	17	47
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819088349	FH	On-Demand	Anodyne	CACNA1I	50	34
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819088349	FH	On-Demand	Anodyne	L3MBTL3	61	34
CC(C)n1ccc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000819088371	FF	On-Demand	Anodyne	GPR119	49	48
CC(C)n1ccc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000819088376	FF	On-Demand	Anodyne	GPR119	49	48
CN(C1CCOCC1)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819088385	GD	On-Demand	Anodyne	F2	25	46
CN(C1CCOCC1)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819088385	GD	On-Demand	Anodyne	ACE	19	46
CN(C1CCOCC1)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819088385	GD	On-Demand	Anodyne	MME	45	46
CN(C1CCOCC1)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819088385	GD	On-Demand	Anodyne	TRY2_BOVIN	76	41
CN(C1CCOCC1)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819088385	GD	On-Demand	Anodyne	TRY1_BOVIN	19	43
CN(C1CCOCC1)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819088385	GD	On-Demand	Anodyne	CPA1	23	41
CN(C1CCOCC1)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819088385	GD	On-Demand	Anodyne	MMP2	17	40
CN(C1CCOCC1)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819088385	GD	On-Demand	Anodyne	ACE2	60	46
COc1ccc(OC)c([C@H](O)CNC[C@@H](C)CN2CCOCC2)c1	ZINC000819088395	ED	On-Demand	Anodyne	PTGDS	19	43
COc1ccc(OC)c([C@H](O)CNC[C@H](C)CN2CCOCC2)c1	ZINC000819088397	ED	On-Demand	Anodyne	PTGDS	19	43
Cn1nccc1[C@H](NS(=O)(=O)c1ccc(CCCCl)cc1)C(=O)O	ZINC000819088418	FD	On-Demand	Reactive	MMP2	15	43
CSC[C@@H](C)NC[C@H](O)c1cccc2ccccc12	ZINC000819088420	CG	On-Demand	Anodyne	ADRB2	17	46
Cn1nccc1[C@@H](NS(=O)(=O)c1ccc(CCCCl)cc1)C(=O)O	ZINC000819088424	FD	On-Demand	Reactive	MMP2	15	43
CC(C)n1ccc(CNC[C@H](O)c2cccnc2)n1	ZINC000819088454	CD	On-Demand	Anodyne	ADRB2	22	44
CC(C)n1ccc(CNC[C@H](O)c2cccnc2)n1	ZINC000819088454	CD	On-Demand	Anodyne	ADRB1	23	44
CC(C)n1ccc(CNC[C@H](O)c2cccnc2)n1	ZINC000819088454	CD	On-Demand	Anodyne	ADRB3	89	47
CC(C)n1ccc(CNC[C@@H](O)c2cccnc2)n1	ZINC000819088457	CD	On-Demand	Anodyne	ADRB2	22	44
CC(C)n1ccc(CNC[C@@H](O)c2cccnc2)n1	ZINC000819088457	CD	On-Demand	Anodyne	ADRB1	23	44
CC(C)n1ccc(CNC[C@@H](O)c2cccnc2)n1	ZINC000819088457	CD	On-Demand	Anodyne	ADRB3	89	47
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(SC(F)F)cc1	ZINC000819088514	FH	On-Demand	Anodyne	SLC6A3	27	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCCC2CC2)c1	ZINC000819088552	CE	On-Demand	Bother	ADRB3	48	36
O=[N+]([O-])c1cccc([C@H](O)CNCCCC2CC2)c1	ZINC000819088555	CE	On-Demand	Bother	ADRB3	48	36
CSC[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819088588	CD	On-Demand	Bother	ADRB3	44	39
CSC[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819088588	CD	On-Demand	Bother	CACNA1D	42	34
CSC[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819088591	CD	On-Demand	Bother	ADRB3	44	39
CSC[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819088591	CD	On-Demand	Bother	CACNA1D	42	34
O[C@@H](CNCCCC1CC1)c1cccc2ccccc12	ZINC000819088626	CH	On-Demand	Anodyne	ADRB2	36	40
O[C@@H](CNCCCC1CC1)c1cccc2ccccc12	ZINC000819088626	CH	On-Demand	Anodyne	ADRB1	17	40
Cc1cc(F)ccc1[C@@H](O)CNCC1CCN(C(=O)c2ccccc2)CC1	ZINC000819088627	FG	On-Demand	Anodyne	GRIN2B	48	34
Cc1cc(F)ccc1[C@@H](O)CNCC1CCN(C(=O)c2ccccc2)CC1	ZINC000819088627	FG	On-Demand	Anodyne	CCR3	47	40
Cc1cc(F)ccc1[C@@H](O)CNCC1CCN(C(=O)c2ccccc2)CC1	ZINC000819088627	FG	On-Demand	Anodyne	L3MBTL3	43	33
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cc3ccccc3o2)CC1	ZINC000819088629	GH	On-Demand	Anodyne	GRIN2B	49	36
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cc3ccccc3o2)CC1	ZINC000819088629	GH	On-Demand	Anodyne	L3MBTL3	58	34
CSCC[C@@H](C)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819088665	DF	On-Demand	Anodyne	ADRB2	29	72
CSCC[C@@H](C)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819088665	DF	On-Demand	Anodyne	ADRB1	32	72
CSCC[C@@H](C)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819088665	DF	On-Demand	Anodyne	ADRB3	15	72
CSCC[C@@H](C)NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819088673	DF	On-Demand	Anodyne	ADRB2	29	72
CSCC[C@@H](C)NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819088673	DF	On-Demand	Anodyne	ADRB1	32	72
CSCC[C@@H](C)NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819088673	DF	On-Demand	Anodyne	ADRB3	15	72
N#Cc1ccc([C@@H](O)CNCC2CCN(C(=O)c3ccccc3)CC2)cc1	ZINC000819088675	FF	On-Demand	Mild	L3MBTL3	57	32
N#Cc1ccc([C@H](O)CNCC2CCN(C(=O)c3ccccc3)CC2)cc1	ZINC000819088678	FF	On-Demand	Mild	L3MBTL3	57	32
CSCC[C@H](C)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819088680	DF	On-Demand	Anodyne	ADRB2	29	72
CSCC[C@H](C)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819088680	DF	On-Demand	Anodyne	ADRB1	32	72
CSCC[C@H](C)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819088680	DF	On-Demand	Anodyne	ADRB3	15	72
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819088689	FH	On-Demand	Anodyne	ADRB2	29	40
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819088689	FH	On-Demand	Anodyne	ADRB1	57	49
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819088689	FH	On-Demand	Anodyne	SLC6A3	18	42
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819088689	FH	On-Demand	Anodyne	GRIN2B	42	37
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819088689	FH	On-Demand	Anodyne	ADRB3	78	49
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819088689	FH	On-Demand	Anodyne	NPY2R	22	40
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819088689	FH	On-Demand	Anodyne	EPHX2	17	44
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819088689	FH	On-Demand	Anodyne	CYP3A4	46	34
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819088689	FH	On-Demand	Anodyne	CACNA1I	52	41
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819088689	FH	On-Demand	Anodyne	SFRP1	22	41
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819088689	FH	On-Demand	Anodyne	L3MBTL3	54	37
CSCC[C@H](C)NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819088691	DF	On-Demand	Anodyne	ADRB2	29	72
CSCC[C@H](C)NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819088691	DF	On-Demand	Anodyne	ADRB1	32	72
CSCC[C@H](C)NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819088691	DF	On-Demand	Anodyne	ADRB3	15	72
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819088692	FH	On-Demand	Anodyne	ADRB2	29	40
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819088692	FH	On-Demand	Anodyne	ADRB1	57	49
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819088692	FH	On-Demand	Anodyne	SLC6A3	18	42
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819088692	FH	On-Demand	Anodyne	GRIN2B	42	37
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819088692	FH	On-Demand	Anodyne	ADRB3	78	49
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819088692	FH	On-Demand	Anodyne	NPY2R	22	40
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819088692	FH	On-Demand	Anodyne	EPHX2	17	44
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819088692	FH	On-Demand	Anodyne	CYP3A4	46	34
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819088692	FH	On-Demand	Anodyne	CACNA1I	52	41
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819088692	FH	On-Demand	Anodyne	SFRP1	22	41
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819088692	FH	On-Demand	Anodyne	L3MBTL3	54	37
CN1C[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)CCC1=O	ZINC000819088709	DD	On-Demand	Anodyne	ADRB3	22	41
CN1C[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)CCC1=O	ZINC000819088710	DD	On-Demand	Anodyne	ADRB3	22	41
CN1C[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)CCC1=O	ZINC000819088711	DD	On-Demand	Anodyne	ADRB3	22	41
CN1C[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)CCC1=O	ZINC000819088712	DD	On-Demand	Anodyne	ADRB3	22	41
Cn1nccc1[C@H](NS(=O)(=O)CCC(=O)OCc1ccccc1)C(=O)O	ZINC000819088714	GC	On-Demand	Anodyne	CYSP_TRYCR	41	34
Cn1nccc1[C@H](NS(=O)(=O)CCC(=O)OCc1ccccc1)C(=O)O	ZINC000819088714	GC	On-Demand	Anodyne	CAPN2	40	34
Cn1nccc1[C@@H](NS(=O)(=O)CCC(=O)OCc1ccccc1)C(=O)O	ZINC000819088718	GC	On-Demand	Anodyne	CYSP_TRYCR	41	34
Cn1nccc1[C@@H](NS(=O)(=O)CCC(=O)OCc1ccccc1)C(=O)O	ZINC000819088718	GC	On-Demand	Anodyne	CAPN2	40	34
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCc2ccccc2C1	ZINC000819088729	DE	On-Demand	Anodyne	DRD3	19	59
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCc2ccccc2C1	ZINC000819088729	DE	On-Demand	Anodyne	HTR7	25	45
C[C@@H](CNC[C@H](O)c1cccc2ccccc12)CN1CCOCC1	ZINC000819088730	EE	On-Demand	Anodyne	PTGDS	47	43
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCc2ccccc2C1	ZINC000819088731	DE	On-Demand	Anodyne	DRD3	19	59
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCc2ccccc2C1	ZINC000819088731	DE	On-Demand	Anodyne	HTR7	25	45
C[C@H](CNC[C@H](O)c1cccc2ccccc12)CN1CCOCC1	ZINC000819088732	EE	On-Demand	Anodyne	PTGDS	47	43
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCc2ccccc2C1	ZINC000819088733	DE	On-Demand	Anodyne	DRD3	19	59
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCc2ccccc2C1	ZINC000819088733	DE	On-Demand	Anodyne	HTR7	25	45
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCc2ccccc2C1	ZINC000819088735	DE	On-Demand	Anodyne	DRD3	19	59
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCc2ccccc2C1	ZINC000819088735	DE	On-Demand	Anodyne	HTR7	25	45
CN1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819088745	CD	On-Demand	Anodyne	ADRB1	39	42
CN1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819088745	CD	On-Demand	Anodyne	ADRB3	54	46
CN1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819088745	CD	On-Demand	Anodyne	IGF1R	32	43
CN1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819088745	CD	On-Demand	Anodyne	CYP3A4	53	40
CN1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819088746	CD	On-Demand	Anodyne	ADRB1	39	42
CN1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819088746	CD	On-Demand	Anodyne	ADRB3	54	46
CN1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819088746	CD	On-Demand	Anodyne	IGF1R	32	43
CN1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819088746	CD	On-Demand	Anodyne	CYP3A4	53	40
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)N1CCOCC1	ZINC000819088796	FD	On-Demand	Mild	PAPA1_CARPA	40	49
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)N1CCOCC1	ZINC000819088800	FD	On-Demand	Mild	PAPA1_CARPA	40	49
O[C@H](CN[C@@H]1CC=CCC1)c1cccnc1	ZINC000819088855	BD	On-Demand	Anodyne	ADRB3	65	48
O[C@@H](CN[C@@H]1CC=CCC1)c1cccnc1	ZINC000819088856	BD	On-Demand	Anodyne	ADRB3	65	48
O[C@H](CN[C@H]1CC=CCC1)c1cccnc1	ZINC000819088857	BD	On-Demand	Anodyne	ADRB3	65	48
O[C@@H](CN[C@H]1CC=CCC1)c1cccnc1	ZINC000819088858	BD	On-Demand	Anodyne	ADRB3	65	48
O[C@@H](CNCCCC1CC1)c1ccc(Cl)c(F)c1	ZINC000819088914	CG	On-Demand	Anodyne	ADRB2	31	42
O[C@@H](CNCCCC1CC1)c1ccc(Cl)c(F)c1	ZINC000819088914	CG	On-Demand	Anodyne	ADRB1	25	42
O[C@@H](CNCCCC1CC1)c1ccc(Cl)c(F)c1	ZINC000819088914	CG	On-Demand	Anodyne	ADRB3	24	42
O[C@H](CNCCCC1CC1)c1ccc(Cl)c(F)c1	ZINC000819088915	CG	On-Demand	Anodyne	ADRB2	31	42
O[C@H](CNCCCC1CC1)c1ccc(Cl)c(F)c1	ZINC000819088915	CG	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CNCCCC1CC1)c1ccc(Cl)c(F)c1	ZINC000819088915	CG	On-Demand	Anodyne	ADRB3	24	42
C[C@H](O)CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819088921	FG	On-Demand	Anodyne	CTSD	19	46
C[C@H](O)CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819088921	FG	On-Demand	Anodyne	CTSK	19	53
C[C@H](O)CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819088921	FG	On-Demand	Anodyne	PGA	20	40
C[C@H](O)CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819088921	FG	On-Demand	Anodyne	ECE1	26	46
C[C@H](O)CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819088921	FG	On-Demand	Anodyne	REN	59	47
C[C@H](O)CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819088921	FG	On-Demand	Anodyne	CTSE	15	40
C[C@H](O)CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819088922	FG	On-Demand	Anodyne	CTSD	19	46
C[C@H](O)CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819088922	FG	On-Demand	Anodyne	CTSK	19	53
C[C@H](O)CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819088922	FG	On-Demand	Anodyne	PGA	20	40
C[C@H](O)CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819088922	FG	On-Demand	Anodyne	ECE1	26	46
C[C@H](O)CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819088922	FG	On-Demand	Anodyne	REN	59	47
C[C@H](O)CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819088922	FG	On-Demand	Anodyne	CTSE	15	40
CCOc1cc(CCCNC[C@H](O)c2ccccc2C)ccc1OC	ZINC000819088926	EH	On-Demand	Anodyne	ADRB2	61	39
CCOc1cc(CCCNC[C@H](O)c2ccccc2C)ccc1OC	ZINC000819088926	EH	On-Demand	Anodyne	ADRB1	47	40
CCOc1cc(CCCNC[C@H](O)c2ccccc2C)ccc1OC	ZINC000819088926	EH	On-Demand	Anodyne	ADRB3	36	41
CCOc1cc(CCCNC[C@@H](O)c2ccccc2C)ccc1OC	ZINC000819088927	EH	On-Demand	Anodyne	ADRB2	61	39
CCOc1cc(CCCNC[C@@H](O)c2ccccc2C)ccc1OC	ZINC000819088927	EH	On-Demand	Anodyne	ADRB1	47	40
CCOc1cc(CCCNC[C@@H](O)c2ccccc2C)ccc1OC	ZINC000819088927	EH	On-Demand	Anodyne	ADRB3	36	41
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(OC3CC3)cc2)C1	ZINC000819088964	DD	On-Demand	Anodyne	MMP13	19	40
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(OC3CC3)cc2)C1	ZINC000819088964	DD	On-Demand	Anodyne	MMP2	18	40
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(OC3CC3)cc2)C1	ZINC000819088964	DD	On-Demand	Anodyne	SFRP1	54	32
C[C@@H](CNC[C@H](O)c1ccccc1F)CN1CCOCC1	ZINC000819088981	CD	On-Demand	Anodyne	PTGDS	20	44
C[C@H](CNC[C@H](O)c1ccccc1F)CN1CCOCC1	ZINC000819088982	CD	On-Demand	Anodyne	PTGDS	20	44
C[C@H](CNC[C@@H](O)c1ccccc1F)CN1CCOCC1	ZINC000819088983	CD	On-Demand	Anodyne	PTGDS	20	44
C[C@@H](CNC[C@@H](O)c1ccccc1F)CN1CCOCC1	ZINC000819088984	CD	On-Demand	Anodyne	PTGDS	20	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000819088989	FF	On-Demand	Anodyne	DRD2	15	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000819088989	FF	On-Demand	Anodyne	HRH2	38	50
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000819088989	FF	On-Demand	Anodyne	CHRM3	20	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccc(CN2CCCC2)c1	ZINC000819088989	FF	On-Demand	Anodyne	SIGMAR1	20	43
Cc1ccccc1[C@@H](O)CNCC1CCN(C(=O)c2ccccc2)CC1	ZINC000819088990	FG	On-Demand	Anodyne	CHRM2	15	41
Cc1ccccc1[C@@H](O)CNCC1CCN(C(=O)c2ccccc2)CC1	ZINC000819088990	FG	On-Demand	Anodyne	GRIN2B	51	38
Cc1ccccc1[C@@H](O)CNCC1CCN(C(=O)c2ccccc2)CC1	ZINC000819088990	FG	On-Demand	Anodyne	CCR8	32	40
Cc1ccccc1[C@@H](O)CNCC1CCN(C(=O)c2ccccc2)CC1	ZINC000819088990	FG	On-Demand	Anodyne	L3MBTL3	65	34
C[C@@H](CNC[C@H](O)c1cccc(C(F)(F)F)c1)CN1CCOCC1	ZINC000819088995	EE	On-Demand	Anodyne	CASR	17	42
C[C@H](CNC[C@H](O)c1cccc(C(F)(F)F)c1)CN1CCOCC1	ZINC000819088996	EE	On-Demand	Anodyne	CASR	17	42
C[C@H](CNC[C@@H](O)c1cccc(C(F)(F)F)c1)CN1CCOCC1	ZINC000819088997	EE	On-Demand	Anodyne	CASR	17	42
C[C@@H](CNC[C@@H](O)c1cccc(C(F)(F)F)c1)CN1CCOCC1	ZINC000819088998	EE	On-Demand	Anodyne	CASR	17	42
CCc1nncn1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819089003	CD	On-Demand	Anodyne	ADRB1	37	45
CCc1nncn1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819089003	CD	On-Demand	Anodyne	ADRB3	62	45
CCc1nncn1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819089004	CD	On-Demand	Anodyne	ADRB1	37	45
CCc1nncn1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819089004	CD	On-Demand	Anodyne	ADRB3	62	45
CCOC(=O)N1CCN(S(=O)(=O)N[C@@H](C(=O)O)c2ccnn2C)CC1	ZINC000819089023	GB	On-Demand	Anodyne	TGM2	28	41
CCOC(=O)N1CCN(S(=O)(=O)N[C@@H](C(=O)O)c2ccnn2C)CC1	ZINC000819089023	GB	On-Demand	Anodyne	F13A1	28	41
CC(=O)Nc1cccc(CC(=O)NCCNc2ccc(C(F)(F)F)cn2)c1	ZINC000819089027	GF	On-Demand	Anodyne	KIT	20	46
CC(=O)Nc1cccc(CC(=O)NCCNc2ccc(C(F)(F)F)cn2)c1	ZINC000819089027	GF	On-Demand	Anodyne	FLT1	22	40
CC(=O)Nc1cccc(CC(=O)NCCNc2ccc(C(F)(F)F)cn2)c1	ZINC000819089027	GF	On-Demand	Anodyne	KDR	20	46
CCOC(=O)N1CCN(S(=O)(=O)N[C@H](C(=O)O)c2ccnn2C)CC1	ZINC000819089029	GB	On-Demand	Anodyne	TGM2	28	41
CCOC(=O)N1CCN(S(=O)(=O)N[C@H](C(=O)O)c2ccnn2C)CC1	ZINC000819089029	GB	On-Demand	Anodyne	F13A1	28	41
O[C@H](CNCC1(c2ccc(Br)cc2)CCCC1)c1cccnc1	ZINC000819089033	GH	On-Demand	Anodyne	ADRB3	81	48
CC(C)n1ccc(CNC[C@H](O)c2cccc(F)c2)n1	ZINC000819089036	CE	On-Demand	Anodyne	ADRB3	15	40
CC(C)n1ccc(CNC[C@@H](O)c2cccc(F)c2)n1	ZINC000819089037	CE	On-Demand	Anodyne	ADRB3	15	40
O[C@@H](CNCC1(c2ccc(Br)cc2)CCCC1)c1cccnc1	ZINC000819089038	GH	On-Demand	Anodyne	ADRB3	81	48
C[C@@H](C(F)(F)F)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819089047	GF	On-Demand	Anodyne	F2	19	42
C[C@@H](C(F)(F)F)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819089047	GF	On-Demand	Anodyne	ACE	37	52
C[C@@H](C(F)(F)F)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819089047	GF	On-Demand	Anodyne	MME	96	52
C[C@@H](C(F)(F)F)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819089047	GF	On-Demand	Anodyne	FCER2	31	41
C[C@@H](C(F)(F)F)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819089047	GF	On-Demand	Anodyne	MMP13	21	44
C[C@@H](C(F)(F)F)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819089047	GF	On-Demand	Anodyne	TRY2_BOVIN	84	36
C[C@@H](C(F)(F)F)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819089047	GF	On-Demand	Anodyne	PAPA1_CARPA	22	45
C[C@@H](C(F)(F)F)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819089047	GF	On-Demand	Anodyne	CTSL	22	45
C[C@@H](C(F)(F)F)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819089047	GF	On-Demand	Anodyne	CPA1	41	45
C[C@@H](C(F)(F)F)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819089047	GF	On-Demand	Anodyne	TPH1	56	37
C[C@@H](C(F)(F)F)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819089047	GF	On-Demand	Anodyne	MMP2	30	43
C[C@@H](C(F)(F)F)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819089047	GF	On-Demand	Anodyne	ECE1	46	45
C[C@@H](C(F)(F)F)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819089047	GF	On-Demand	Anodyne	MMP9	21	45
C[C@@H](C(F)(F)F)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819089047	GF	On-Demand	Anodyne	ACE2	85	52
C[C@@H](C(F)(F)F)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819089047	GF	On-Demand	Anodyne	ADAMTS4	31	44
C[C@@H](C(F)(F)F)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819089047	GF	On-Demand	Anodyne	PIN1	43	41
C[C@@H](C(F)(F)F)S(=O)(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O	ZINC000819089047	GF	On-Demand	Anodyne	FPR1	49	34
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)c(F)c1	ZINC000819089084	GH	On-Demand	Mild	PAPA1_CARPA	40	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC=CCC1	ZINC000819089120	FG	On-Demand	Anodyne	CTSD	111	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC=CCC1	ZINC000819089120	FG	On-Demand	Anodyne	PGC	62	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC=CCC1	ZINC000819089120	FG	On-Demand	Anodyne	PAPA1_CARPA	34	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC=CCC1	ZINC000819089120	FG	On-Demand	Anodyne	CTSL	15	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC=CCC1	ZINC000819089120	FG	On-Demand	Anodyne	PGA	40	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC=CCC1	ZINC000819089120	FG	On-Demand	Anodyne	BACE2	55	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC=CCC1	ZINC000819089120	FG	On-Demand	Anodyne	REN	91	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC=CCC1	ZINC000819089120	FG	On-Demand	Anodyne	REN1	23	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC=CCC1	ZINC000819089120	FG	On-Demand	Anodyne	BACE1	82	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC=CCC1	ZINC000819089120	FG	On-Demand	Anodyne	FPR1	52	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC=CCC1	ZINC000819089120	FG	On-Demand	Anodyne	PLM1_PLAFA	35	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC=CCC1	ZINC000819089122	FG	On-Demand	Anodyne	CTSD	111	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC=CCC1	ZINC000819089122	FG	On-Demand	Anodyne	PGC	62	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC=CCC1	ZINC000819089122	FG	On-Demand	Anodyne	PAPA1_CARPA	34	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC=CCC1	ZINC000819089122	FG	On-Demand	Anodyne	CTSL	15	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC=CCC1	ZINC000819089122	FG	On-Demand	Anodyne	PGA	40	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC=CCC1	ZINC000819089122	FG	On-Demand	Anodyne	BACE2	55	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC=CCC1	ZINC000819089122	FG	On-Demand	Anodyne	REN	91	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC=CCC1	ZINC000819089122	FG	On-Demand	Anodyne	REN1	23	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC=CCC1	ZINC000819089122	FG	On-Demand	Anodyne	BACE1	82	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC=CCC1	ZINC000819089122	FG	On-Demand	Anodyne	FPR1	52	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC=CCC1	ZINC000819089122	FG	On-Demand	Anodyne	PLM1_PLAFA	35	41
O=S(=O)(C1CCOCC1)N1CCC(NC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819089133	GD	On-Demand	Anodyne	ADRB3	27	40
O=S(=O)(C1CCOCC1)N1CCC(NC[C@H](O)c2cccc(F)c2)CC1	ZINC000819089135	GD	On-Demand	Anodyne	ADRB3	27	40
CSCC[C@H](C)NCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819089163	EG	On-Demand	Anodyne	CYNT	37	48
CSCC[C@@H](C)NCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819089164	EG	On-Demand	Anodyne	CYNT	37	48
O=C(O)CCCCCCNS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819089169	EF	On-Demand	Anodyne	TBXA2R	51	41
O=C(O)CCCCCCNS(=O)(=O)CCc1ccc(Cl)cc1	ZINC000819089169	EF	On-Demand	Anodyne	TBXAS1	57	44
O[C@H](CNCCCC1CC1)c1cccnc1	ZINC000819089170	BD	On-Demand	Anodyne	ADRB2	29	48
O[C@H](CNCCCC1CC1)c1cccnc1	ZINC000819089170	BD	On-Demand	Anodyne	ADRB1	34	47
O[C@H](CNCCCC1CC1)c1cccnc1	ZINC000819089170	BD	On-Demand	Anodyne	ADRB3	113	49
O[C@@H](CNCCCC1CC1)c1cccnc1	ZINC000819089171	BD	On-Demand	Anodyne	ADRB2	29	48
O[C@@H](CNCCCC1CC1)c1cccnc1	ZINC000819089171	BD	On-Demand	Anodyne	ADRB1	34	47
O[C@@H](CNCCCC1CC1)c1cccnc1	ZINC000819089171	BD	On-Demand	Anodyne	ADRB3	113	49
CN(CCO)C(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819089180	FG	On-Demand	Anodyne	CTSK	15	51
CN(CCO)C(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819089180	FG	On-Demand	Anodyne	REN	38	40
CN(CCO)C(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819089181	FG	On-Demand	Anodyne	CTSK	15	51
CN(CCO)C(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819089181	FG	On-Demand	Anodyne	REN	38	40
CC[C@@H](CNC[C@H](O)c1cccnc1)Cc1cccc(Br)c1	ZINC000819089189	FH	On-Demand	Anodyne	ADRB2	20	41
CC[C@@H](CNC[C@H](O)c1cccnc1)Cc1cccc(Br)c1	ZINC000819089189	FH	On-Demand	Anodyne	ADRB1	23	43
CC[C@@H](CNC[C@H](O)c1cccnc1)Cc1cccc(Br)c1	ZINC000819089189	FH	On-Demand	Anodyne	ADRB3	85	43
CC[C@@H](CNC[C@@H](O)c1cccnc1)Cc1cccc(Br)c1	ZINC000819089191	FH	On-Demand	Anodyne	ADRB2	20	41
CC[C@@H](CNC[C@@H](O)c1cccnc1)Cc1cccc(Br)c1	ZINC000819089191	FH	On-Demand	Anodyne	ADRB1	23	43
CC[C@@H](CNC[C@@H](O)c1cccnc1)Cc1cccc(Br)c1	ZINC000819089191	FH	On-Demand	Anodyne	ADRB3	85	43
CCc1nncn1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819089194	CD	On-Demand	Anodyne	ADRB1	15	40
CCc1nncn1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819089194	CD	On-Demand	Anodyne	ADRB3	35	40
CCc1nncn1CCNC[C@H](O)c1cccc(F)c1	ZINC000819089195	CD	On-Demand	Anodyne	ADRB1	15	40
CCc1nncn1CCNC[C@H](O)c1cccc(F)c1	ZINC000819089195	CD	On-Demand	Anodyne	ADRB3	35	40
CCc1nncn1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819089226	DD	On-Demand	Bother	ADRB3	40	35
CCc1nncn1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819089227	DD	On-Demand	Bother	ADRB3	40	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(NC(=O)c2ccncc2)c1	ZINC000819089244	GG	On-Demand	Anodyne	TAAR1	40	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(NC(=O)c2ccncc2)c1	ZINC000819089244	GG	On-Demand	Anodyne	KCNK3	120	50
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(NC(=O)c2ccncc2)c1	ZINC000819089244	GG	On-Demand	Anodyne	KCNK9	79	38
Cn1nccc1[C@H](NS(=O)(=O)CCNC(=O)OCc1ccccc1)C(=O)O	ZINC000819089272	GC	On-Demand	Anodyne	CTSB	40	40
Cn1nccc1[C@H](NS(=O)(=O)CCNC(=O)OCc1ccccc1)C(=O)O	ZINC000819089272	GC	On-Demand	Anodyne	CYSP_TRYCR	50	36
Cn1nccc1[C@H](NS(=O)(=O)CCNC(=O)OCc1ccccc1)C(=O)O	ZINC000819089272	GC	On-Demand	Anodyne	CAPNS1	59	34
Cn1nccc1[C@H](NS(=O)(=O)CCNC(=O)OCc1ccccc1)C(=O)O	ZINC000819089272	GC	On-Demand	Anodyne	CAPN1	65	39
Cn1nccc1[C@H](NS(=O)(=O)CCNC(=O)OCc1ccccc1)C(=O)O	ZINC000819089272	GC	On-Demand	Anodyne	CAPN2	99	37
Cn1nccc1[C@H](NS(=O)(=O)CCNC(=O)OCc1ccccc1)C(=O)O	ZINC000819089272	GC	On-Demand	Anodyne	NPR	66	36
Cn1nccc1[C@@H](NS(=O)(=O)CCNC(=O)OCc1ccccc1)C(=O)O	ZINC000819089273	GC	On-Demand	Anodyne	CTSB	40	40
Cn1nccc1[C@@H](NS(=O)(=O)CCNC(=O)OCc1ccccc1)C(=O)O	ZINC000819089273	GC	On-Demand	Anodyne	CYSP_TRYCR	50	36
Cn1nccc1[C@@H](NS(=O)(=O)CCNC(=O)OCc1ccccc1)C(=O)O	ZINC000819089273	GC	On-Demand	Anodyne	CAPNS1	59	34
Cn1nccc1[C@@H](NS(=O)(=O)CCNC(=O)OCc1ccccc1)C(=O)O	ZINC000819089273	GC	On-Demand	Anodyne	CAPN1	65	39
Cn1nccc1[C@@H](NS(=O)(=O)CCNC(=O)OCc1ccccc1)C(=O)O	ZINC000819089273	GC	On-Demand	Anodyne	CAPN2	99	37
Cn1nccc1[C@@H](NS(=O)(=O)CCNC(=O)OCc1ccccc1)C(=O)O	ZINC000819089273	GC	On-Demand	Anodyne	NPR	66	36
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccccc2Cl)CC1	ZINC000819089287	FH	On-Demand	Anodyne	OPRL1	38	42
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccccc2Cl)CC1	ZINC000819089287	FH	On-Demand	Anodyne	GRIN2B	45	35
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccccc2Cl)CC1	ZINC000819089287	FH	On-Demand	Anodyne	ADRB3	17	44
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccccc2Cl)CC1	ZINC000819089287	FH	On-Demand	Anodyne	SIGMAR1	15	45
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccccc2Cl)CC1	ZINC000819089287	FH	On-Demand	Anodyne	NPY2R	19	40
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccccc2Cl)CC1	ZINC000819089287	FH	On-Demand	Anodyne	CACNA1I	51	36
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccccc2Cl)CC1	ZINC000819089287	FH	On-Demand	Anodyne	L3MBTL3	76	38
COC(=O)/C=C\c1ccc(S(=O)(=O)N[C@H](C)[C@H](C(=O)O)C(C)C)cc1	ZINC000819089322	FD	On-Demand	Anodyne	MMP13	41	46
COC(=O)/C=C\c1ccc(S(=O)(=O)N[C@H](C)[C@H](C(=O)O)C(C)C)cc1	ZINC000819089322	FD	On-Demand	Anodyne	MMP2	32	46
COC(=O)/C=C\c1ccc(S(=O)(=O)N[C@H](C)[C@H](C(=O)O)C(C)C)cc1	ZINC000819089322	FD	On-Demand	Anodyne	MMP3	17	46
COC(=O)/C=C\c1ccc(S(=O)(=O)N[C@H](C)[C@H](C(=O)O)C(C)C)cc1	ZINC000819089322	FD	On-Demand	Anodyne	MMP8	16	43
COC(=O)/C=C\c1ccc(S(=O)(=O)N[C@H](C)[C@H](C(=O)O)C(C)C)cc1	ZINC000819089322	FD	On-Demand	Anodyne	MMP9	15	43
COC(=O)/C=C\c1ccc(S(=O)(=O)N[C@H](C)[C@H](C(=O)O)C(C)C)cc1	ZINC000819089322	FD	On-Demand	Anodyne	MMP12	41	38
COC(=O)/C=C\c1ccc(S(=O)(=O)N[C@H](C)[C@H](C(=O)O)C(C)C)cc1	ZINC000819089322	FD	On-Demand	Anodyne	ADAMTS4	36	40
COC(=O)/C=C\c1ccc(S(=O)(=O)N[C@H](C)[C@@H](C(=O)O)C(C)C)cc1	ZINC000819089325	FD	On-Demand	Anodyne	MMP13	41	46
COC(=O)/C=C\c1ccc(S(=O)(=O)N[C@H](C)[C@@H](C(=O)O)C(C)C)cc1	ZINC000819089325	FD	On-Demand	Anodyne	MMP2	32	46
COC(=O)/C=C\c1ccc(S(=O)(=O)N[C@H](C)[C@@H](C(=O)O)C(C)C)cc1	ZINC000819089325	FD	On-Demand	Anodyne	MMP3	17	46
COC(=O)/C=C\c1ccc(S(=O)(=O)N[C@H](C)[C@@H](C(=O)O)C(C)C)cc1	ZINC000819089325	FD	On-Demand	Anodyne	MMP8	16	43
COC(=O)/C=C\c1ccc(S(=O)(=O)N[C@H](C)[C@@H](C(=O)O)C(C)C)cc1	ZINC000819089325	FD	On-Demand	Anodyne	MMP9	15	43
COC(=O)/C=C\c1ccc(S(=O)(=O)N[C@H](C)[C@@H](C(=O)O)C(C)C)cc1	ZINC000819089325	FD	On-Demand	Anodyne	MMP12	41	38
COC(=O)/C=C\c1ccc(S(=O)(=O)N[C@H](C)[C@@H](C(=O)O)C(C)C)cc1	ZINC000819089325	FD	On-Demand	Anodyne	ADAMTS4	36	40
CN1C[C@H](NC[C@H](O)c2cccnc2)CCC1=O	ZINC000819089353	BC	On-Demand	Anodyne	ADRB3	81	51
CN1C[C@@H](NC[C@@H](O)c2cccnc2)CCC1=O	ZINC000819089354	BC	On-Demand	Anodyne	ADRB3	81	51
CN1C[C@@H](NC[C@H](O)c2cccnc2)CCC1=O	ZINC000819089355	BC	On-Demand	Anodyne	ADRB3	81	51
CN1C[C@H](NC[C@@H](O)c2cccnc2)CCC1=O	ZINC000819089356	BC	On-Demand	Anodyne	ADRB3	81	51
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)c1cn2c(n1)CCCC2	ZINC000819089359	GE	On-Demand	Anodyne	F2	34	46
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)c1cn2c(n1)CCCC2	ZINC000819089359	GE	On-Demand	Anodyne	TRY2_BOVIN	106	44
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)c1cn2c(n1)CCCC2	ZINC000819089359	GE	On-Demand	Anodyne	TRY1_BOVIN	16	43
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)c1cn2c(n1)CCCC2	ZINC000819089359	GE	On-Demand	Anodyne	ACE2	28	41
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)c1cn2c(n1)CCCC2	ZINC000819089359	GE	On-Demand	Anodyne	ST14	53	40
CC[C@@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1nccs1	ZINC000819089385	FG	On-Demand	Anodyne	GPR119	42	44
CC[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1nccs1	ZINC000819089387	FG	On-Demand	Anodyne	GPR119	42	44
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(OC)cc1	ZINC000819089405	GH	On-Demand	Mild	PAPA1_CARPA	45	44
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(OC)cc1	ZINC000819089405	GH	On-Demand	Mild	CTSK	17	42
COc1ccc(OC)c([C@H](O)CNCC2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000819089454	GF	On-Demand	Anodyne	DRD2	19	43
COc1ccc(OC)c([C@H](O)CNCC2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000819089454	GF	On-Demand	Anodyne	GRIN2B	44	38
COc1ccc(OC)c([C@H](O)CNCC2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000819089454	GF	On-Demand	Anodyne	MMP13	15	40
COc1ccc(OC)c([C@H](O)CNCC2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000819089454	GF	On-Demand	Anodyne	CCR3	30	41
COc1ccc(OC)c([C@H](O)CNCC2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000819089454	GF	On-Demand	Anodyne	SLC18A3	15	43
COc1ccc(OC)c([C@H](O)CNCC2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000819089454	GF	On-Demand	Anodyne	L3MBTL3	41	34
Cn1nccc1[C@H](NS(=O)(=O)c1ccc(OC2CCCC2)cc1)C(=O)O	ZINC000819089455	GD	On-Demand	Anodyne	MMP13	31	43
Cn1nccc1[C@H](NS(=O)(=O)c1ccc(OC2CCCC2)cc1)C(=O)O	ZINC000819089455	GD	On-Demand	Anodyne	MMP2	26	43
Cn1nccc1[C@@H](NS(=O)(=O)c1ccc(OC2CCCC2)cc1)C(=O)O	ZINC000819089456	GD	On-Demand	Anodyne	MMP13	31	43
Cn1nccc1[C@@H](NS(=O)(=O)c1ccc(OC2CCCC2)cc1)C(=O)O	ZINC000819089456	GD	On-Demand	Anodyne	MMP2	26	43
CCc1nc2ccccc2n1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819089471	EG	On-Demand	Anodyne	SLC6A2	15	42
CCc1nc2ccccc2n1CCNC[C@H](O)c1cccc(F)c1	ZINC000819089473	EG	On-Demand	Anodyne	SLC6A2	15	42
C=CCC1(C(=O)Nc2ccc(-c3ccccc3)cc2F)CCOCC1	ZINC000819089520	EJ	On-Demand	Mild	DHODH	15	40
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2c(F)cccc2F)CC1	ZINC000819089531	FG	On-Demand	Anodyne	GRIN2B	49	38
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2c(F)cccc2F)CC1	ZINC000819089531	FG	On-Demand	Anodyne	EPHX2	15	47
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2c(F)cccc2F)CC1	ZINC000819089531	FG	On-Demand	Anodyne	L3MBTL3	59	36
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2c(F)cccc2F)CC1	ZINC000819089533	FG	On-Demand	Anodyne	GRIN2B	49	38
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2c(F)cccc2F)CC1	ZINC000819089533	FG	On-Demand	Anodyne	EPHX2	15	47
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2c(F)cccc2F)CC1	ZINC000819089533	FG	On-Demand	Anodyne	L3MBTL3	59	36
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(Cl)cc1	ZINC000819089536	GI	On-Demand	Mild	PAPA1_CARPA	43	42
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(Cl)cc1	ZINC000819089536	GI	On-Demand	Mild	CTSK	17	40
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(OC(F)(F)F)cc1	ZINC000819089561	EG	On-Demand	Anodyne	CTSS	17	45
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(OC(F)(F)F)cc1	ZINC000819089563	EG	On-Demand	Anodyne	CTSS	17	45
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(OC(F)(F)F)cc1	ZINC000819089565	EG	On-Demand	Anodyne	CTSS	17	45
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(OC(F)(F)F)cc1	ZINC000819089566	EG	On-Demand	Anodyne	CTSS	17	45
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(C)cc1	ZINC000819089598	FH	On-Demand	Mild	PAPA1_CARPA	44	43
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(C)cc1	ZINC000819089598	FH	On-Demand	Mild	CTSK	19	41
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(F)c1	ZINC000819089604	FH	On-Demand	Mild	PAPA1_CARPA	44	52
CC(C)n1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819089606	DE	On-Demand	Bother	CACNA1D	49	33
CC(C)n1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819089607	DE	On-Demand	Bother	CACNA1D	49	33
CON(C)C(=O)CCNCC1CCN(C(=O)c2ccccc2)CC1	ZINC000819089638	ED	On-Demand	Anodyne	GRIN2B	53	37
CON(C)C(=O)CCNCC1CCN(C(=O)c2ccccc2)CC1	ZINC000819089638	ED	On-Demand	Anodyne	L3MBTL3	61	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000819089644	GD	On-Demand	Anodyne	CCKAR	15	40
O=C(NCCCN1CCc2ccccc2C1)C(F)=C1CCC1	ZINC000819089653	DF	On-Demand	Anodyne	HTR1A	17	47
O=C(NCCCN1CCc2ccccc2C1)C(F)=C1CCC1	ZINC000819089653	DF	On-Demand	Anodyne	DRD2	15	43
O=C(NCCCN1CCc2ccccc2C1)C(F)=C1CCC1	ZINC000819089653	DF	On-Demand	Anodyne	DRD3	24	53
O=C(NCCCN1CCc2ccccc2C1)C(F)=C1CCC1	ZINC000819089653	DF	On-Demand	Anodyne	HTR7	30	52
O=C(NCCCN1CCc2ccccc2C1)C(F)=C1CCC1	ZINC000819089653	DF	On-Demand	Anodyne	NOD2	40	34
CN1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCC1=O	ZINC000819089666	CD	On-Demand	Anodyne	ADRB1	42	47
CN1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCC1=O	ZINC000819089666	CD	On-Demand	Anodyne	ADRB3	59	52
CN1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCC1=O	ZINC000819089666	CD	On-Demand	Anodyne	CYP3A4	50	39
CN1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CCC1=O	ZINC000819089668	CD	On-Demand	Anodyne	ADRB1	42	47
CN1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CCC1=O	ZINC000819089668	CD	On-Demand	Anodyne	ADRB3	59	52
CN1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CCC1=O	ZINC000819089668	CD	On-Demand	Anodyne	CYP3A4	50	39
CN1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCC1=O	ZINC000819089670	CD	On-Demand	Anodyne	ADRB1	42	47
CN1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCC1=O	ZINC000819089670	CD	On-Demand	Anodyne	ADRB3	59	52
CN1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCC1=O	ZINC000819089670	CD	On-Demand	Anodyne	CYP3A4	50	39
CN1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCC1=O	ZINC000819089672	CD	On-Demand	Anodyne	ADRB1	42	47
CN1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCC1=O	ZINC000819089672	CD	On-Demand	Anodyne	ADRB3	59	52
CN1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCC1=O	ZINC000819089672	CD	On-Demand	Anodyne	CYP3A4	50	39
Cn1nccc1[C@H](NS(=O)(=O)c1ccc(OC2CC2)cc1)C(=O)O	ZINC000819089683	FD	On-Demand	Anodyne	MMP13	36	41
Cn1nccc1[C@H](NS(=O)(=O)c1ccc(OC2CC2)cc1)C(=O)O	ZINC000819089683	FD	On-Demand	Anodyne	MMP2	28	41
Cn1nccc1[C@@H](NS(=O)(=O)c1ccc(OC2CC2)cc1)C(=O)O	ZINC000819089686	FD	On-Demand	Anodyne	MMP13	36	41
Cn1nccc1[C@@H](NS(=O)(=O)c1ccc(OC2CC2)cc1)C(=O)O	ZINC000819089686	FD	On-Demand	Anodyne	MMP2	28	41
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819089703	FG	On-Demand	Anodyne	SLC6A4	18	50
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819089703	FG	On-Demand	Anodyne	SLC6A3	48	50
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819089703	FG	On-Demand	Anodyne	GRIN2B	61	39
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819089703	FG	On-Demand	Anodyne	SLC18A3	19	42
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819089703	FG	On-Demand	Anodyne	L3MBTL3	67	34
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819089705	FG	On-Demand	Anodyne	SLC6A4	18	50
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819089705	FG	On-Demand	Anodyne	SLC6A3	48	50
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819089705	FG	On-Demand	Anodyne	GRIN2B	61	39
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819089705	FG	On-Demand	Anodyne	SLC18A3	19	42
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819089705	FG	On-Demand	Anodyne	L3MBTL3	67	34
CN1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1=O	ZINC000819089709	DD	On-Demand	Anodyne	RBP4	54	35
CN1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1=O	ZINC000819089711	DD	On-Demand	Anodyne	RBP4	54	35
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cc(C)cc(C)c1	ZINC000819089712	FI	On-Demand	Mild	PAPA1_CARPA	39	43
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819089717	EE	On-Demand	Anodyne	ADRB2	26	45
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819089717	EE	On-Demand	Anodyne	ADRB1	37	44
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819089717	EE	On-Demand	Anodyne	GRIN2B	47	46
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819089717	EE	On-Demand	Anodyne	ADRB3	111	46
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819089717	EE	On-Demand	Anodyne	PTAFR	20	44
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819089717	EE	On-Demand	Anodyne	C3AR1	40	40
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819089717	EE	On-Demand	Anodyne	SFRP1	23	40
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819089717	EE	On-Demand	Anodyne	SCD	22	40
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819089717	EE	On-Demand	Anodyne	L3MBTL3	51	34
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819089719	EE	On-Demand	Anodyne	ADRB2	26	45
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819089719	EE	On-Demand	Anodyne	ADRB1	37	44
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819089719	EE	On-Demand	Anodyne	GRIN2B	47	46
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819089719	EE	On-Demand	Anodyne	ADRB3	111	46
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819089719	EE	On-Demand	Anodyne	PTAFR	20	44
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819089719	EE	On-Demand	Anodyne	C3AR1	40	40
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819089719	EE	On-Demand	Anodyne	SFRP1	23	40
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819089719	EE	On-Demand	Anodyne	SCD	22	40
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819089719	EE	On-Demand	Anodyne	L3MBTL3	51	34
COc1ccnc(NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819089737	FD	On-Demand	Reactive	PAPA1_CARPA	44	44
COc1ccnc(NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819089744	FD	On-Demand	Reactive	PAPA1_CARPA	44	44
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cc(F)ccc2F)CC1	ZINC000819089761	FG	On-Demand	Anodyne	GRIN2B	48	35
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cc(F)ccc2F)CC1	ZINC000819089761	FG	On-Demand	Anodyne	ADRB3	15	40
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cc(F)ccc2F)CC1	ZINC000819089761	FG	On-Demand	Anodyne	CCR3	41	43
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cc(F)ccc2F)CC1	ZINC000819089761	FG	On-Demand	Anodyne	CACNA1I	41	34
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cc(F)ccc2F)CC1	ZINC000819089761	FG	On-Demand	Anodyne	L3MBTL3	51	34
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cc(F)ccc2F)CC1	ZINC000819089763	FG	On-Demand	Anodyne	GRIN2B	48	35
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cc(F)ccc2F)CC1	ZINC000819089763	FG	On-Demand	Anodyne	ADRB3	15	40
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cc(F)ccc2F)CC1	ZINC000819089763	FG	On-Demand	Anodyne	CCR3	41	43
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cc(F)ccc2F)CC1	ZINC000819089763	FG	On-Demand	Anodyne	CACNA1I	41	34
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cc(F)ccc2F)CC1	ZINC000819089763	FG	On-Demand	Anodyne	L3MBTL3	51	34
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819089792	GI	On-Demand	Anodyne	HTR4	43	38
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819089792	GI	On-Demand	Anodyne	GRIN2B	55	37
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819089792	GI	On-Demand	Anodyne	L3MBTL3	75	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccc(CN3CCCC3)c1)C2	ZINC000819089793	GF	On-Demand	Anodyne	HRH2	35	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccc(CN3CCCC3)c1)C2	ZINC000819089793	GF	On-Demand	Anodyne	SIGMAR1	21	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccc(CN3CCCC3)c1)C2	ZINC000819089799	GF	On-Demand	Anodyne	HRH2	35	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccc(CN3CCCC3)c1)C2	ZINC000819089799	GF	On-Demand	Anodyne	SIGMAR1	21	43
CN1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089806	GD	On-Demand	Anodyne	CTSD	97	46
CN1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089806	GD	On-Demand	Anodyne	PGC	63	40
CN1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089806	GD	On-Demand	Anodyne	PAPA1_CARPA	28	40
CN1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089806	GD	On-Demand	Anodyne	CCKAR	25	41
CN1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089806	GD	On-Demand	Anodyne	CTSL	15	40
CN1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089806	GD	On-Demand	Anodyne	PGA	36	40
CN1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089806	GD	On-Demand	Anodyne	BACE2	54	40
CN1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089806	GD	On-Demand	Anodyne	REN	91	45
CN1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089806	GD	On-Demand	Anodyne	REN1	28	42
CN1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089806	GD	On-Demand	Anodyne	BACE1	80	46
CN1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089806	GD	On-Demand	Anodyne	FPR1	49	38
CN1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089806	GD	On-Demand	Anodyne	PLM1_PLAFA	28	42
CN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089808	GD	On-Demand	Anodyne	CTSD	97	46
CN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089808	GD	On-Demand	Anodyne	PGC	63	40
CN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089808	GD	On-Demand	Anodyne	PAPA1_CARPA	28	40
CN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089808	GD	On-Demand	Anodyne	CCKAR	25	41
CN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089808	GD	On-Demand	Anodyne	CTSL	15	40
CN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089808	GD	On-Demand	Anodyne	PGA	36	40
CN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089808	GD	On-Demand	Anodyne	BACE2	54	40
CN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089808	GD	On-Demand	Anodyne	REN	91	45
CN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089808	GD	On-Demand	Anodyne	REN1	28	42
CN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089808	GD	On-Demand	Anodyne	BACE1	80	46
CN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089808	GD	On-Demand	Anodyne	FPR1	49	38
CN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819089808	GD	On-Demand	Anodyne	PLM1_PLAFA	28	42
C[C@H](CNC[C@H](O)c1c(F)cccc1F)CN1CCOCC1	ZINC000819089888	DD	On-Demand	Anodyne	PTGDS	19	41
C[C@H](CNC[C@@H](O)c1c(F)cccc1F)CN1CCOCC1	ZINC000819089890	DD	On-Demand	Anodyne	PTGDS	19	41
C[C@@H](CNC[C@@H](O)c1c(F)cccc1F)CN1CCOCC1	ZINC000819089892	DD	On-Demand	Anodyne	PTGDS	19	41
C[C@@H](CNC[C@H](O)c1c(F)cccc1F)CN1CCOCC1	ZINC000819089894	DD	On-Demand	Anodyne	PTGDS	19	41
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819089918	GI	On-Demand	Mild	PAPA1_CARPA	46	43
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819089918	GI	On-Demand	Mild	CTSL	18	43
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(F)cn2)CC1	ZINC000819089938	FE	On-Demand	Anodyne	GRIN2B	44	38
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(F)cn2)CC1	ZINC000819089939	FE	On-Demand	Anodyne	GRIN2B	44	38
CNC(=O)c1ccc(C)c(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819089960	CE	On-Demand	Anodyne	MAPK14	23	43
O=C1CCc2cc(NC(=O)C(F)=C3CCC3)ccc2N1	ZINC000819089961	CF	On-Demand	Anodyne	PKM	38	42
CNC(=O)c1ccc(C)c(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819089962	CE	On-Demand	Anodyne	MAPK14	23	43
CNC(=O)c1ccc(C)c(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819089964	CE	On-Demand	Anodyne	MAPK14	23	43
CNC(=O)c1ccc(C)c(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819089966	CE	On-Demand	Anodyne	MAPK14	23	43
COC(=O)c1ccc(S(=O)(=O)N[C@@H](C)[C@@H](C(=O)O)C(C)C)c(OC)c1	ZINC000819089978	FD	On-Demand	Anodyne	ITGAV	16	40
COC(=O)c1ccc(S(=O)(=O)N[C@@H](C)[C@@H](C(=O)O)C(C)C)c(OC)c1	ZINC000819089978	FD	On-Demand	Anodyne	ADAMTS4	24	41
COC(=O)c1ccc(S(=O)(=O)N[C@@H](C)[C@H](C(=O)O)C(C)C)c(OC)c1	ZINC000819089980	FD	On-Demand	Anodyne	ITGAV	16	40
COC(=O)c1ccc(S(=O)(=O)N[C@@H](C)[C@H](C(=O)O)C(C)C)c(OC)c1	ZINC000819089980	FD	On-Demand	Anodyne	ADAMTS4	24	41
COC(=O)c1ccc(S(=O)(=O)N[C@H](C)[C@H](C(=O)O)C(C)C)c(OC)c1	ZINC000819089982	FD	On-Demand	Anodyne	ITGAV	16	40
COC(=O)c1ccc(S(=O)(=O)N[C@H](C)[C@H](C(=O)O)C(C)C)c(OC)c1	ZINC000819089982	FD	On-Demand	Anodyne	ADAMTS4	24	41
COC(=O)c1ccc(S(=O)(=O)N[C@H](C)[C@@H](C(=O)O)C(C)C)c(OC)c1	ZINC000819089984	FD	On-Demand	Anodyne	ITGAV	16	40
COC(=O)c1ccc(S(=O)(=O)N[C@H](C)[C@@H](C(=O)O)C(C)C)c(OC)c1	ZINC000819089984	FD	On-Demand	Anodyne	ADAMTS4	24	41
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)CC1CCOCC1	ZINC000819089987	GE	On-Demand	Anodyne	MME	33	45
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)CC1CCOCC1	ZINC000819089987	GE	On-Demand	Anodyne	TRY2_BOVIN	88	44
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)CC1CCOCC1	ZINC000819089987	GE	On-Demand	Anodyne	CPA1	15	43
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)CC1CCOCC1	ZINC000819089987	GE	On-Demand	Anodyne	ECE1	24	40
O=C(O)[C@H](Cc1ccc2ccccc2c1)NS(=O)(=O)CC1CCOCC1	ZINC000819089987	GE	On-Demand	Anodyne	ACE2	56	45
Cc1nn(C)c(Cl)c1S(=O)(=O)N[C@@H](C(=O)O)c1ccnn1C	ZINC000819090007	EC	On-Demand	Anodyne	ITGAV	33	44
Cc1nn(C)c(Cl)c1S(=O)(=O)N[C@H](C(=O)O)c1ccnn1C	ZINC000819090008	EC	On-Demand	Anodyne	ITGAV	33	44
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819090045	GF	On-Demand	Bother	ADRB3	50	36
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819090046	GF	On-Demand	Bother	ADRB3	50	36
O=C(NCc1cccc(CN2CCCC2)c1)C(F)=C1CCC1	ZINC000819090055	DG	On-Demand	Anodyne	HRH2	33	44
O=C(NCc1cccc(CN2CCCC2)c1)C(F)=C1CCC1	ZINC000819090055	DG	On-Demand	Anodyne	CHRM3	18	43
O=C(NCc1cccc(CN2CCCC2)c1)C(F)=C1CCC1	ZINC000819090055	DG	On-Demand	Anodyne	SIGMAR1	21	42
O=C(NCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819090088	DE	On-Demand	Anodyne	HTR1A	84	58
O=C(NCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819090088	DE	On-Demand	Anodyne	DRD2	64	58
O=C(NCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819090088	DE	On-Demand	Anodyne	DRD4	53	49
O=C(NCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819090088	DE	On-Demand	Anodyne	ADRA1D	18	41
O=C(NCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819090088	DE	On-Demand	Anodyne	HTR2A	53	49
O=C(NCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819090088	DE	On-Demand	Anodyne	HTR2C	27	44
O=C(NCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819090088	DE	On-Demand	Anodyne	ADRA1A	21	46
O=C(NCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819090088	DE	On-Demand	Anodyne	DRD3	86	49
O=C(NCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819090088	DE	On-Demand	Anodyne	HTR7	82	49
O=C(NCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819090088	DE	On-Demand	Anodyne	PLD2	44	34
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819090092	GH	On-Demand	Anodyne	GRIN2B	41	34
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819090092	GH	On-Demand	Anodyne	CCR3	56	40
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819090092	GH	On-Demand	Anodyne	CACNA1I	53	35
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819090094	GH	On-Demand	Anodyne	GRIN2B	41	34
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819090094	GH	On-Demand	Anodyne	CCR3	56	40
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819090094	GH	On-Demand	Anodyne	CACNA1I	53	35
CCc1nc2ccccc2n1CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819090123	GE	On-Demand	Anodyne	ADRB3	50	35
CCc1nc2ccccc2n1CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819090125	GE	On-Demand	Anodyne	ADRB3	50	35
C[C@@H]1CCCC[C@@H]1C(=O)NCCNc1ccc(C#N)cn1	ZINC000819090133	CE	On-Demand	Mild	CTSK	17	42
C[C@@H]1CCCC[C@H]1C(=O)NCCNc1ccc(C#N)cn1	ZINC000819090134	CE	On-Demand	Mild	CTSK	17	42
CN1C[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCC1=O	ZINC000819090146	FD	On-Demand	Anodyne	GPR119	28	43
CN1C[C@@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCC1=O	ZINC000819090148	FD	On-Demand	Anodyne	GPR119	28	43
CN1C[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCC1=O	ZINC000819090150	FD	On-Demand	Anodyne	GPR119	28	43
CN1C[C@@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCC1=O	ZINC000819090152	FD	On-Demand	Anodyne	GPR119	28	43
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819090174	GH	On-Demand	Anodyne	SLC6A3	17	41
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819090174	GH	On-Demand	Anodyne	ADRB3	44	37
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819090175	GH	On-Demand	Anodyne	SLC6A3	17	41
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819090175	GH	On-Demand	Anodyne	ADRB3	44	37
C[C@@H](CNC[C@H](O)c1ccc(OC(F)(F)F)cc1)CN1CCOCC1	ZINC000819090180	FE	On-Demand	Anodyne	CTSS	15	43
C[C@@H](CNC[C@H](O)c1ccc(OC(F)(F)F)cc1)CN1CCOCC1	ZINC000819090180	FE	On-Demand	Anodyne	EPHX2	16	45
C[C@H](CNC[C@H](O)c1ccc(OC(F)(F)F)cc1)CN1CCOCC1	ZINC000819090181	FE	On-Demand	Anodyne	CTSS	15	43
C[C@H](CNC[C@H](O)c1ccc(OC(F)(F)F)cc1)CN1CCOCC1	ZINC000819090181	FE	On-Demand	Anodyne	EPHX2	16	45
C[C@H](CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)CN1CCOCC1	ZINC000819090182	FE	On-Demand	Anodyne	CTSS	15	43
C[C@H](CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)CN1CCOCC1	ZINC000819090182	FE	On-Demand	Anodyne	EPHX2	16	45
C[C@@H](CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)CN1CCOCC1	ZINC000819090183	FE	On-Demand	Anodyne	CTSS	15	43
C[C@@H](CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)CN1CCOCC1	ZINC000819090183	FE	On-Demand	Anodyne	EPHX2	16	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCN1CCc3ccccc3C1)C2	ZINC000819090196	GE	On-Demand	Anodyne	HTR1A	16	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCN1CCc3ccccc3C1)C2	ZINC000819090196	GE	On-Demand	Anodyne	DRD3	18	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCN1CCc3ccccc3C1)C2	ZINC000819090196	GE	On-Demand	Anodyne	HTR7	21	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCN1CCc3ccccc3C1)C2	ZINC000819090197	GE	On-Demand	Anodyne	HTR1A	16	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCN1CCc3ccccc3C1)C2	ZINC000819090197	GE	On-Demand	Anodyne	DRD3	18	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCN1CCc3ccccc3C1)C2	ZINC000819090197	GE	On-Demand	Anodyne	HTR7	21	42
CCc1ccc(N(CC)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819090202	FI	On-Demand	Mild	PAPA1_CARPA	53	44
CCc1ccc(N(CC)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819090202	FI	On-Demand	Mild	CTSK	19	40
CCc1ccc(N(CC)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819090203	FI	On-Demand	Mild	PAPA1_CARPA	53	44
CCc1ccc(N(CC)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819090203	FI	On-Demand	Mild	CTSK	19	40
CC(=O)N(c1ccc(NC(=O)C=C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090229	II	On-Demand	Anodyne	TGM2	18	45
CC(=O)N(c1ccc(NC(=O)C=C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090229	II	On-Demand	Anodyne	F13A1	28	45
CC(=O)N(c1ccc(NC(=O)C=C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@H]1C	ZINC000819090231	II	On-Demand	Anodyne	TGM2	18	45
CC(=O)N(c1ccc(NC(=O)C=C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@H]1C	ZINC000819090231	II	On-Demand	Anodyne	F13A1	28	45
CC(=O)N(c1ccc(NC(=O)C=C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@H]1C	ZINC000819090234	II	On-Demand	Anodyne	TGM2	18	45
CC(=O)N(c1ccc(NC(=O)C=C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@H]1C	ZINC000819090234	II	On-Demand	Anodyne	F13A1	28	45
CC(=O)N(c1ccc(NC(=O)C=C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@@H]1C	ZINC000819090236	II	On-Demand	Anodyne	TGM2	18	45
CC(=O)N(c1ccc(NC(=O)C=C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@@H]1C	ZINC000819090236	II	On-Demand	Anodyne	F13A1	28	45
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819090237	II	On-Demand	Anodyne	F2	45	46
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819090237	II	On-Demand	Anodyne	ACE	29	45
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819090237	II	On-Demand	Anodyne	FKBP1A	47	42
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819090237	II	On-Demand	Anodyne	OPRM1	28	40
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819090237	II	On-Demand	Anodyne	CELA1	26	48
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819090237	II	On-Demand	Anodyne	ELANE	39	43
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819090237	II	On-Demand	Anodyne	CTRA_BOVIN	63	34
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819090237	II	On-Demand	Anodyne	TRY1_BOVIN	61	34
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819090237	II	On-Demand	Anodyne	CTSG	43	34
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819090237	II	On-Demand	Anodyne	PREP	59	48
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819090237	II	On-Demand	Anodyne	CELA2A	51	34
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819090237	II	On-Demand	Anodyne	LGMN	97	49
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819090237	II	On-Demand	Anodyne	KLK5	25	43
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819090237	II	On-Demand	Anodyne	XIAP	42	39
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819090237	II	On-Demand	Anodyne	F13A1	43	36
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819090237	II	On-Demand	Anodyne	BRCA1	51	32
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819090237	II	On-Demand	Anodyne	SLC12A5	67	36
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819090237	II	On-Demand	Anodyne	TMPRSS11D	57	35
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090238	II	On-Demand	Anodyne	F2	45	46
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090238	II	On-Demand	Anodyne	ACE	29	45
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090238	II	On-Demand	Anodyne	FKBP1A	47	42
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090238	II	On-Demand	Anodyne	OPRM1	28	40
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090238	II	On-Demand	Anodyne	CELA1	26	48
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090238	II	On-Demand	Anodyne	ELANE	39	43
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090238	II	On-Demand	Anodyne	CTRA_BOVIN	63	34
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090238	II	On-Demand	Anodyne	TRY1_BOVIN	61	34
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090238	II	On-Demand	Anodyne	CTSG	43	34
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090238	II	On-Demand	Anodyne	PREP	59	48
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090238	II	On-Demand	Anodyne	CELA2A	51	34
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090238	II	On-Demand	Anodyne	LGMN	97	49
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090238	II	On-Demand	Anodyne	KLK5	25	43
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090238	II	On-Demand	Anodyne	XIAP	42	39
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090238	II	On-Demand	Anodyne	F13A1	43	36
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090238	II	On-Demand	Anodyne	BRCA1	51	32
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090238	II	On-Demand	Anodyne	SLC12A5	67	36
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090238	II	On-Demand	Anodyne	TMPRSS11D	57	35
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819090239	II	On-Demand	Anodyne	F2	45	46
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819090239	II	On-Demand	Anodyne	ACE	29	45
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819090239	II	On-Demand	Anodyne	FKBP1A	47	42
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819090239	II	On-Demand	Anodyne	OPRM1	28	40
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819090239	II	On-Demand	Anodyne	CELA1	26	48
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819090239	II	On-Demand	Anodyne	ELANE	39	43
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819090239	II	On-Demand	Anodyne	CTRA_BOVIN	63	34
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819090239	II	On-Demand	Anodyne	TRY1_BOVIN	61	34
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819090239	II	On-Demand	Anodyne	CTSG	43	34
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819090239	II	On-Demand	Anodyne	PREP	59	48
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819090239	II	On-Demand	Anodyne	CELA2A	51	34
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819090239	II	On-Demand	Anodyne	LGMN	97	49
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819090239	II	On-Demand	Anodyne	KLK5	25	43
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819090239	II	On-Demand	Anodyne	XIAP	42	39
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819090239	II	On-Demand	Anodyne	F13A1	43	36
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819090239	II	On-Demand	Anodyne	BRCA1	51	32
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819090239	II	On-Demand	Anodyne	SLC12A5	67	36
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819090239	II	On-Demand	Anodyne	TMPRSS11D	57	35
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819090240	II	On-Demand	Anodyne	F2	45	46
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819090240	II	On-Demand	Anodyne	ACE	29	45
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819090240	II	On-Demand	Anodyne	FKBP1A	47	42
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819090240	II	On-Demand	Anodyne	OPRM1	28	40
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819090240	II	On-Demand	Anodyne	CELA1	26	48
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819090240	II	On-Demand	Anodyne	ELANE	39	43
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819090240	II	On-Demand	Anodyne	CTRA_BOVIN	63	34
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819090240	II	On-Demand	Anodyne	TRY1_BOVIN	61	34
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819090240	II	On-Demand	Anodyne	CTSG	43	34
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819090240	II	On-Demand	Anodyne	PREP	59	48
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819090240	II	On-Demand	Anodyne	CELA2A	51	34
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819090240	II	On-Demand	Anodyne	LGMN	97	49
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819090240	II	On-Demand	Anodyne	KLK5	25	43
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819090240	II	On-Demand	Anodyne	XIAP	42	39
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819090240	II	On-Demand	Anodyne	F13A1	43	36
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819090240	II	On-Demand	Anodyne	BRCA1	51	32
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819090240	II	On-Demand	Anodyne	SLC12A5	67	36
CC(=O)N(c1ccc(NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819090240	II	On-Demand	Anodyne	TMPRSS11D	57	35
CC(=O)N(c1ccc(NC(=O)c2c(Cl)ccc(Cl)c2Cl)cc1)[C@H]1C[C@H]1C	ZINC000819090241	HK	On-Demand	Anodyne	TYK2	46	39
CC(=O)N(c1ccc(NC(=O)c2c(Cl)ccc(Cl)c2Cl)cc1)[C@@H]1C[C@@H]1C	ZINC000819090242	HK	On-Demand	Anodyne	TYK2	46	39
CC(=O)N(c1ccc(NC(=O)c2c(Cl)ccc(Cl)c2Cl)cc1)[C@H]1C[C@@H]1C	ZINC000819090243	HK	On-Demand	Anodyne	TYK2	46	39
CC(=O)N(c1ccc(NC(=O)c2c(Cl)ccc(Cl)c2Cl)cc1)[C@@H]1C[C@H]1C	ZINC000819090244	HK	On-Demand	Anodyne	TYK2	46	39
CC(=O)N(c1ccc(NC(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)[C@H]1C[C@@H]1C	ZINC000819090262	HI	On-Demand	Anodyne	GPR119	34	42
CC(=O)N(c1ccc(NC(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)[C@@H]1C[C@H]1C	ZINC000819090263	HI	On-Demand	Anodyne	GPR119	34	42
CC(=O)N(c1ccc(NC(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090264	HI	On-Demand	Anodyne	GPR119	34	42
CC(=O)N(c1ccc(NC(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)[C@H]1C[C@H]1C	ZINC000819090265	HI	On-Demand	Anodyne	GPR119	34	42
CC(=O)N(c1ccc(NC(=O)c2c(C(F)(F)F)ccnc2Cl)cc1)[C@H]1C[C@H]1C	ZINC000819090296	HJ	On-Demand	Anodyne	TYK2	68	40
CC(=O)N(c1ccc(NC(=O)c2c(C(F)(F)F)ccnc2Cl)cc1)[C@H]1C[C@@H]1C	ZINC000819090297	HJ	On-Demand	Anodyne	TYK2	68	40
CC(=O)N(c1ccc(NC(=O)c2c(C(F)(F)F)ccnc2Cl)cc1)[C@@H]1C[C@H]1C	ZINC000819090298	HJ	On-Demand	Anodyne	TYK2	68	40
CC(=O)N(c1ccc(NC(=O)c2c(C(F)(F)F)ccnc2Cl)cc1)[C@@H]1C[C@@H]1C	ZINC000819090299	HJ	On-Demand	Anodyne	TYK2	68	40
CCc1nc2ccccc2n1CCNC[C@@H](O)c1ccccc1	ZINC000819090335	DF	On-Demand	Anodyne	ADRB3	42	45
CCc1nc2ccccc2n1CCNC[C@H](O)c1ccccc1	ZINC000819090336	DF	On-Demand	Anodyne	ADRB3	42	45
CCc1nncn1CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819090341	FD	On-Demand	Anodyne	GPR119	41	45
CCc1nncn1CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819090342	FD	On-Demand	Anodyne	GPR119	41	45
C[C@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CN1CCOCC1	ZINC000819090361	GD	On-Demand	Anodyne	GPR119	23	41
C[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CN1CCOCC1	ZINC000819090362	GD	On-Demand	Anodyne	GPR119	23	41
C[C@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CN1CCOCC1	ZINC000819090363	GD	On-Demand	Anodyne	GPR119	23	41
C[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CN1CCOCC1	ZINC000819090364	GD	On-Demand	Anodyne	GPR119	23	41
C[C@@H](CNC[C@@H](O)c1cccnc1)CN1CCOCC1	ZINC000819090369	CC	On-Demand	Anodyne	ADRB2	21	43
C[C@@H](CNC[C@@H](O)c1cccnc1)CN1CCOCC1	ZINC000819090369	CC	On-Demand	Anodyne	ADRB1	24	43
C[C@@H](CNC[C@@H](O)c1cccnc1)CN1CCOCC1	ZINC000819090369	CC	On-Demand	Anodyne	ADRB3	87	43
C[C@@H](CNC[C@@H](O)c1cccnc1)CN1CCOCC1	ZINC000819090369	CC	On-Demand	Anodyne	CASR	23	41
C[C@H](CNC[C@H](O)c1cccnc1)CN1CCOCC1	ZINC000819090370	CC	On-Demand	Anodyne	ADRB2	21	43
C[C@H](CNC[C@H](O)c1cccnc1)CN1CCOCC1	ZINC000819090370	CC	On-Demand	Anodyne	ADRB1	24	43
C[C@H](CNC[C@H](O)c1cccnc1)CN1CCOCC1	ZINC000819090370	CC	On-Demand	Anodyne	ADRB3	87	43
C[C@H](CNC[C@H](O)c1cccnc1)CN1CCOCC1	ZINC000819090370	CC	On-Demand	Anodyne	CASR	23	41
C[C@H](CNC[C@@H](O)c1cccnc1)CN1CCOCC1	ZINC000819090371	CC	On-Demand	Anodyne	ADRB2	21	43
C[C@H](CNC[C@@H](O)c1cccnc1)CN1CCOCC1	ZINC000819090371	CC	On-Demand	Anodyne	ADRB1	24	43
C[C@H](CNC[C@@H](O)c1cccnc1)CN1CCOCC1	ZINC000819090371	CC	On-Demand	Anodyne	ADRB3	87	43
C[C@H](CNC[C@@H](O)c1cccnc1)CN1CCOCC1	ZINC000819090371	CC	On-Demand	Anodyne	CASR	23	41
C[C@@H](CNC[C@H](O)c1cccnc1)CN1CCOCC1	ZINC000819090372	CC	On-Demand	Anodyne	ADRB2	21	43
C[C@@H](CNC[C@H](O)c1cccnc1)CN1CCOCC1	ZINC000819090372	CC	On-Demand	Anodyne	ADRB1	24	43
C[C@@H](CNC[C@H](O)c1cccnc1)CN1CCOCC1	ZINC000819090372	CC	On-Demand	Anodyne	ADRB3	87	43
C[C@@H](CNC[C@H](O)c1cccnc1)CN1CCOCC1	ZINC000819090372	CC	On-Demand	Anodyne	CASR	23	41
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819090383	FG	On-Demand	Anodyne	ADRB1	33	40
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819090383	FG	On-Demand	Anodyne	SLC6A3	18	40
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819090383	FG	On-Demand	Anodyne	GRIN2B	46	35
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819090383	FG	On-Demand	Anodyne	ADRB3	48	38
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819090383	FG	On-Demand	Anodyne	L3MBTL3	53	34
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819090384	FG	On-Demand	Anodyne	ADRB1	33	40
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819090384	FG	On-Demand	Anodyne	SLC6A3	18	40
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819090384	FG	On-Demand	Anodyne	GRIN2B	46	35
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819090384	FG	On-Demand	Anodyne	ADRB3	48	38
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819090384	FG	On-Demand	Anodyne	L3MBTL3	53	34
CN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819090390	GD	On-Demand	Anodyne	CTSD	104	47
CN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819090390	GD	On-Demand	Anodyne	PGC	71	47
CN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819090390	GD	On-Demand	Anodyne	CMA1	30	41
CN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819090390	GD	On-Demand	Anodyne	PAPA1_CARPA	34	43
CN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819090390	GD	On-Demand	Anodyne	CCKAR	24	43
CN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819090390	GD	On-Demand	Anodyne	CTSK	16	44
CN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819090390	GD	On-Demand	Anodyne	CTSL	22	43
CN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819090390	GD	On-Demand	Anodyne	PGA	38	47
CN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819090390	GD	On-Demand	Anodyne	BACE2	55	45
CN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819090390	GD	On-Demand	Anodyne	REN	97	47
CN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819090390	GD	On-Demand	Anodyne	REN1	28	43
CN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819090390	GD	On-Demand	Anodyne	CTSE	30	45
CN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819090390	GD	On-Demand	Anodyne	BACE1	89	47
CN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819090390	GD	On-Demand	Anodyne	FPR1	50	39
CN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819090390	GD	On-Demand	Anodyne	PLM1_PLAFA	26	40
CN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819090390	GD	On-Demand	Anodyne	PLM2_PLAFA	57	34
CC(=O)N(c1ccc(NC(=O)c2ccc(-n3c(C)cnc3O)cc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090472	HH	On-Demand	Anodyne	PRNP	45	32
CC(=O)N(c1ccc(NC(=O)c2ccc(-n3c(C)cnc3O)cc2)cc1)[C@H]1C[C@@H]1C	ZINC000819090473	HH	On-Demand	Anodyne	PRNP	45	32
CC(=O)N(c1ccc(NC(=O)c2ccc(-n3c(C)cnc3O)cc2)cc1)[C@@H]1C[C@H]1C	ZINC000819090474	HH	On-Demand	Anodyne	PRNP	45	32
CC(=O)N(c1ccc(NC(=O)c2ccc(-n3c(C)cnc3O)cc2)cc1)[C@H]1C[C@H]1C	ZINC000819090475	HH	On-Demand	Anodyne	PRNP	45	32
CC(=O)N(c1ccc(NC(=O)c2ccc3c(c2)CCN3C)cc1)[C@@H]1C[C@@H]1C	ZINC000819090499	FH	On-Demand	Anodyne	HTR1F	19	40
CC(=O)N(c1ccc(NC(=O)c2ccc3c(c2)CCN3C)cc1)[C@H]1C[C@@H]1C	ZINC000819090500	FH	On-Demand	Anodyne	HTR1F	19	40
CC(=O)N(c1ccc(NC(=O)c2ccc3c(c2)CCN3C)cc1)[C@@H]1C[C@H]1C	ZINC000819090501	FH	On-Demand	Anodyne	HTR1F	19	40
CC(=O)N(c1ccc(NC(=O)c2ccc3c(c2)CCN3C)cc1)[C@H]1C[C@H]1C	ZINC000819090502	FH	On-Demand	Anodyne	HTR1F	19	40
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819090533	GF	On-Demand	Bother	GRIN2B	30	41
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819090533	GF	On-Demand	Bother	L3MBTL3	51	33
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819090534	GF	On-Demand	Bother	GRIN2B	30	41
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819090534	GF	On-Demand	Bother	L3MBTL3	51	33
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccccc2F)CC1	ZINC000819090535	FG	On-Demand	Anodyne	GRIN2B	53	38
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccccc2F)CC1	ZINC000819090535	FG	On-Demand	Anodyne	L3MBTL3	59	34
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccccc2F)CC1	ZINC000819090536	FG	On-Demand	Anodyne	GRIN2B	53	38
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccccc2F)CC1	ZINC000819090536	FG	On-Demand	Anodyne	L3MBTL3	59	34
C[C@@H](CNC[C@H](O)c1ccc([N+](=O)[O-])cc1)CN1CCOCC1	ZINC000819090538	DD	On-Demand	Bother	KCNJ1	20	46
C[C@H](CNC[C@H](O)c1ccc([N+](=O)[O-])cc1)CN1CCOCC1	ZINC000819090539	DD	On-Demand	Bother	KCNJ1	20	46
C[C@H](CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)CN1CCOCC1	ZINC000819090540	DD	On-Demand	Bother	KCNJ1	20	46
C[C@@H](CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)CN1CCOCC1	ZINC000819090541	DD	On-Demand	Bother	KCNJ1	20	46
CCc1nncn1CCNC[C@@H](O)c1ccccc1	ZINC000819090554	CD	On-Demand	Anodyne	ADRB2	16	43
CCc1nncn1CCNC[C@@H](O)c1ccccc1	ZINC000819090554	CD	On-Demand	Anodyne	ADRB3	60	40
CCc1nncn1CCNC[C@H](O)c1ccccc1	ZINC000819090555	CD	On-Demand	Anodyne	ADRB2	16	43
CCc1nncn1CCNC[C@H](O)c1ccccc1	ZINC000819090555	CD	On-Demand	Anodyne	ADRB3	60	40
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccccc2)CC1	ZINC000819090556	EF	On-Demand	Anodyne	SLC6A3	27	44
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccccc2)CC1	ZINC000819090556	EF	On-Demand	Anodyne	GRIN2B	60	42
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccccc2)CC1	ZINC000819090556	EF	On-Demand	Anodyne	ADRB3	52	39
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccccc2)CC1	ZINC000819090556	EF	On-Demand	Anodyne	EPHX2	15	51
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccccc2)CC1	ZINC000819090556	EF	On-Demand	Anodyne	SCD	17	41
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccccc2)CC1	ZINC000819090556	EF	On-Demand	Anodyne	ACHP_LYMST	19	44
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccccc2)CC1	ZINC000819090556	EF	On-Demand	Anodyne	L3MBTL3	79	38
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccccc2)CC1	ZINC000819090556	EF	On-Demand	Anodyne	Q8WSF8_APLCA	40	44
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccccc2)CC1	ZINC000819090557	EF	On-Demand	Anodyne	SLC6A3	27	44
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccccc2)CC1	ZINC000819090557	EF	On-Demand	Anodyne	GRIN2B	60	42
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccccc2)CC1	ZINC000819090557	EF	On-Demand	Anodyne	ADRB3	52	39
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccccc2)CC1	ZINC000819090557	EF	On-Demand	Anodyne	EPHX2	15	51
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccccc2)CC1	ZINC000819090557	EF	On-Demand	Anodyne	SCD	17	41
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccccc2)CC1	ZINC000819090557	EF	On-Demand	Anodyne	ACHP_LYMST	19	44
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccccc2)CC1	ZINC000819090557	EF	On-Demand	Anodyne	L3MBTL3	79	38
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccccc2)CC1	ZINC000819090557	EF	On-Demand	Anodyne	Q8WSF8_APLCA	40	44
Cn1nccc1[C@@H](NS(=O)(=O)c1cnn(CC2CC2)c1)C(=O)O	ZINC000819090564	EC	On-Demand	Anodyne	ITGAV	16	41
Cn1nccc1[C@H](NS(=O)(=O)c1cnn(CC2CC2)c1)C(=O)O	ZINC000819090565	EC	On-Demand	Anodyne	ITGAV	16	41
CCOC(=O)N1CCC(S(=O)(=O)N[C@@H](C(=O)O)c2ccnn2C)CC1	ZINC000819090588	FC	On-Demand	Anodyne	P2RY12	42	34
CCOC(=O)N1CCC(S(=O)(=O)N[C@H](C(=O)O)c2ccnn2C)CC1	ZINC000819090589	FC	On-Demand	Anodyne	P2RY12	42	34
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(F)cc2F)CC1	ZINC000819090594	FG	On-Demand	Anodyne	HTR2A	15	44
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(F)cc2F)CC1	ZINC000819090594	FG	On-Demand	Anodyne	GRIN2B	47	35
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(F)cc2F)CC1	ZINC000819090594	FG	On-Demand	Anodyne	ADRB3	15	40
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(F)cc2F)CC1	ZINC000819090594	FG	On-Demand	Anodyne	CCR3	43	41
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2ccc(F)cc2F)CC1	ZINC000819090594	FG	On-Demand	Anodyne	L3MBTL3	49	34
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(F)cc2F)CC1	ZINC000819090595	FG	On-Demand	Anodyne	HTR2A	15	44
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(F)cc2F)CC1	ZINC000819090595	FG	On-Demand	Anodyne	GRIN2B	47	35
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(F)cc2F)CC1	ZINC000819090595	FG	On-Demand	Anodyne	ADRB3	15	40
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(F)cc2F)CC1	ZINC000819090595	FG	On-Demand	Anodyne	CCR3	43	41
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2ccc(F)cc2F)CC1	ZINC000819090595	FG	On-Demand	Anodyne	L3MBTL3	49	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC(C)(C)c1ccccc1)C2	ZINC000819090608	EF	On-Demand	Anodyne	CACNA1G	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC(C)(C)c1ccccc1)C2	ZINC000819090609	EF	On-Demand	Anodyne	CACNA1G	15	40
O=C(c1ccccc1)N1CCC(CNC[C@H](O)C2CC2)CC1	ZINC000819090610	DD	On-Demand	Anodyne	GRIN2B	63	38
O=C(c1ccccc1)N1CCC(CNC[C@H](O)C2CC2)CC1	ZINC000819090610	DD	On-Demand	Anodyne	L3MBTL3	81	38
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)C2CC2)CC1	ZINC000819090611	DD	On-Demand	Anodyne	GRIN2B	63	38
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)C2CC2)CC1	ZINC000819090611	DD	On-Demand	Anodyne	L3MBTL3	81	38
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(CN2CCCC2)c1	ZINC000819090638	DF	On-Demand	Anodyne	HRH2	31	40
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(CN2CCCC2)c1	ZINC000819090638	DF	On-Demand	Anodyne	CHRM3	19	40
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(CN2CCCC2)c1	ZINC000819090638	DF	On-Demand	Anodyne	SIGMAR1	19	41
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(CN2CCCC2)c1	ZINC000819090639	DF	On-Demand	Anodyne	HRH2	31	40
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(CN2CCCC2)c1	ZINC000819090639	DF	On-Demand	Anodyne	CHRM3	19	40
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(CN2CCCC2)c1	ZINC000819090639	DF	On-Demand	Anodyne	SIGMAR1	19	41
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(CN2CCCC2)c1	ZINC000819090640	DF	On-Demand	Anodyne	HRH2	31	40
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(CN2CCCC2)c1	ZINC000819090640	DF	On-Demand	Anodyne	CHRM3	19	40
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(CN2CCCC2)c1	ZINC000819090640	DF	On-Demand	Anodyne	SIGMAR1	19	41
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(CN2CCCC2)c1	ZINC000819090641	DF	On-Demand	Anodyne	HRH2	31	40
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(CN2CCCC2)c1	ZINC000819090641	DF	On-Demand	Anodyne	CHRM3	19	40
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(CN2CCCC2)c1	ZINC000819090641	DF	On-Demand	Anodyne	SIGMAR1	19	41
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819090653	FG	On-Demand	Anodyne	ADRB1	35	42
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819090653	FG	On-Demand	Anodyne	SLC6A3	17	45
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819090653	FG	On-Demand	Anodyne	GRIN2B	48	40
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819090653	FG	On-Demand	Anodyne	ADRB3	53	42
O=C(c1ccccc1)N1CCC(CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819090653	FG	On-Demand	Anodyne	L3MBTL3	54	37
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819090654	FG	On-Demand	Anodyne	ADRB1	35	42
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819090654	FG	On-Demand	Anodyne	SLC6A3	17	45
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819090654	FG	On-Demand	Anodyne	GRIN2B	48	40
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819090654	FG	On-Demand	Anodyne	ADRB3	53	42
O=C(c1ccccc1)N1CCC(CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819090654	FG	On-Demand	Anodyne	L3MBTL3	54	37
CC(=O)N(c1ccc(NC(=O)c2ccnc(-n3ccnc3)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819090664	GG	On-Demand	Anodyne	NOS2	47	32
CC(=O)N(c1ccc(NC(=O)c2ccnc(-n3ccnc3)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819090665	GG	On-Demand	Anodyne	NOS2	47	32
CC(=O)N(c1ccc(NC(=O)c2ccnc(-n3ccnc3)c2)cc1)[C@H]1C[C@H]1C	ZINC000819090666	GG	On-Demand	Anodyne	NOS2	47	32
CC(=O)N(c1ccc(NC(=O)c2ccnc(-n3ccnc3)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819090667	GG	On-Demand	Anodyne	NOS2	47	32
O=C([C@@H]1CC(=O)N(C2CCCC2)C1)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819090669	GG	On-Demand	Anodyne	INHA	18	45
O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819090670	GG	On-Demand	Anodyne	INHA	18	45
COc1cccc([C@H](O)C(=O)Nc2ccc(N(C(C)=O)[C@H]3C[C@H]3C)cc2)c1	ZINC000819090675	FG	On-Demand	Anodyne	MTNR1A	19	49
COc1cccc([C@H](O)C(=O)Nc2ccc(N(C(C)=O)[C@H]3C[C@H]3C)cc2)c1	ZINC000819090675	FG	On-Demand	Anodyne	MTNR1B	26	49
COc1cccc([C@H](O)C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@H]3C)cc2)c1	ZINC000819090676	FG	On-Demand	Anodyne	MTNR1A	19	49
COc1cccc([C@H](O)C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@H]3C)cc2)c1	ZINC000819090676	FG	On-Demand	Anodyne	MTNR1B	26	49
COc1cccc([C@H](O)C(=O)Nc2ccc(N(C(C)=O)[C@H]3C[C@@H]3C)cc2)c1	ZINC000819090677	FG	On-Demand	Anodyne	MTNR1A	19	49
COc1cccc([C@H](O)C(=O)Nc2ccc(N(C(C)=O)[C@H]3C[C@@H]3C)cc2)c1	ZINC000819090677	FG	On-Demand	Anodyne	MTNR1B	26	49
COc1cccc([C@H](O)C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@@H]3C)cc2)c1	ZINC000819090678	FG	On-Demand	Anodyne	MTNR1A	19	49
COc1cccc([C@H](O)C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@@H]3C)cc2)c1	ZINC000819090678	FG	On-Demand	Anodyne	MTNR1B	26	49
N#CCCCCNC(=O)Nc1ccccc1CC(=O)O	ZINC000819090759	CE	On-Demand	Mild	CXCL8	38	40
N#CCCNS(=O)(=O)c1ccc(C(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819090760	GD	On-Demand	Mild	CTSK	24	44
N#CCCCS(=O)(=O)c1ccc(C(=O)N[C@H](C(=O)O)c2ccccc2)cc1	ZINC000819090772	GE	On-Demand	Mild	CA2	18	60
N#CCCCOc1cccc(NC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819090776	FH	On-Demand	Mild	ADRB1	29	41
N#CCCCOc1cccc(NC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819090776	FH	On-Demand	Mild	CCR3	24	43
N#CCCCOc1cccc(NC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819090776	FH	On-Demand	Mild	EPHX2	22	48
N#CCCN(C(=O)CN1CC[C@@H](C(=O)O)C1)c1ccccc1	ZINC000819090777	DD	On-Demand	Mild	SLC6A1	136	46
N#CCCN(C(=O)CN1CC[C@@H](C(=O)O)C1)c1ccccc1	ZINC000819090777	DD	On-Demand	Mild	CYP2J2	44	32
N#CCCN(C(=O)CN1CC[C@H](C(=O)O)C1)c1ccccc1	ZINC000819090778	DD	On-Demand	Mild	SLC6A1	136	46
N#CCCN(C(=O)CN1CC[C@H](C(=O)O)C1)c1ccccc1	ZINC000819090778	DD	On-Demand	Mild	CYP2J2	44	32
N#CCOc1cccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819090779	DC	On-Demand	Mild	DHODH	31	40
N#CCOc1cccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819090780	DC	On-Demand	Mild	DHODH	31	40
N#C/C=C(\c1ccc(F)cc1)N1CC[C@H](C(=O)O)C1	ZINC000819090781	CE	On-Demand	Reactive	SLC6A1	63	36
N#C/C=C(\c1ccc(F)cc1)N1CC[C@H](C(=O)O)C1	ZINC000819090781	CE	On-Demand	Reactive	SLC18A3	18	42
N#C/C=C(/c1ccc(F)cc1)N1CC[C@@H](C(=O)O)C1	ZINC000819090782	CE	On-Demand	Reactive	SLC6A1	63	36
N#C/C=C(/c1ccc(F)cc1)N1CC[C@@H](C(=O)O)C1	ZINC000819090782	CE	On-Demand	Reactive	SLC18A3	18	42
N#C/C=C(/c1ccc(F)cc1)N1CC[C@H](C(=O)O)C1	ZINC000819090783	CE	On-Demand	Reactive	SLC6A1	63	36
N#C/C=C(/c1ccc(F)cc1)N1CC[C@H](C(=O)O)C1	ZINC000819090783	CE	On-Demand	Reactive	SLC18A3	18	42
N#C/C=C(\c1ccc(F)cc1)N1CC[C@@H](C(=O)O)C1	ZINC000819090784	CE	On-Demand	Reactive	SLC6A1	63	36
N#C/C=C(\c1ccc(F)cc1)N1CC[C@@H](C(=O)O)C1	ZINC000819090784	CE	On-Demand	Reactive	SLC18A3	18	42
N#CCOc1ccc(CNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819090793	EF	On-Demand	Mild	FFAR1	22	41
N#CCOc1ccc(CNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819090793	EF	On-Demand	Mild	FFAR4	41	36
N#CCN1CCC(NC(=O)C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819090797	EC	On-Demand	Mild	DRD4	17	40
N#CCN1CCC(NC(=O)C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819090797	EC	On-Demand	Mild	SIGMAR1	17	45
N#CCOc1ccccc1C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819090798	CD	On-Demand	Mild	SLC6A1	107	38
N#CCOc1ccccc1C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819090798	CD	On-Demand	Mild	L3MBTL3	48	41
N#CCOc1ccccc1C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819090799	CD	On-Demand	Mild	SLC6A1	107	38
N#CCOc1ccccc1C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819090799	CD	On-Demand	Mild	L3MBTL3	48	41
N#CCc1ccc(OC[C@@H](O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819090801	ED	On-Demand	Mild	ABCB1	57	43
N#CCc1ccc(OC[C@@H](O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819090802	ED	On-Demand	Mild	ABCB1	57	43
N#CCc1ccc(OC[C@H](O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819090803	ED	On-Demand	Mild	ABCB1	57	43
N#CCc1ccc(OC[C@H](O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819090804	ED	On-Demand	Mild	ABCB1	57	43
N#CCOc1cccc(NC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819090805	EF	On-Demand	Mild	UL80	26	41
N#CCOc1cccc(NC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819090805	EF	On-Demand	Mild	ROCK2	25	41
N#CCOc1cccc(NC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819090805	EF	On-Demand	Mild	PDS	57	37
N#CCOc1cccc(NC(=O)NCC(=O)O)c1	ZINC000819090806	BC	On-Demand	Mild	ADRB1	36	41
N#CCOc1cccc(NC(=O)NCC(=O)O)c1	ZINC000819090806	BC	On-Demand	Mild	EPHX2	24	41
N#CCc1ccc(OC[C@@H](O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819090808	DC	On-Demand	Mild	LTA4H	18	43
N#CCc1ccc(OC[C@@H](O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819090808	DC	On-Demand	Mild	ABCB1	68	44
N#CCc1ccc(OC[C@@H](O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819090809	DC	On-Demand	Mild	LTA4H	18	43
N#CCc1ccc(OC[C@@H](O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819090809	DC	On-Demand	Mild	ABCB1	68	44
N#CCc1ccc(OC[C@H](O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819090810	DC	On-Demand	Mild	LTA4H	18	43
N#CCc1ccc(OC[C@H](O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819090810	DC	On-Demand	Mild	ABCB1	68	44
N#CCc1ccc(OC[C@H](O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819090811	DC	On-Demand	Mild	LTA4H	18	43
N#CCc1ccc(OC[C@H](O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819090811	DC	On-Demand	Mild	ABCB1	68	44
N#CCCn1cc(C(=O)CN2CCC[C@H]2C(=O)O)c2ccccc21	ZINC000819090812	EE	On-Demand	Mild	CNR1	18	42
N#CCCn1cc(C(=O)CN2CCC[C@H]2C(=O)O)c2ccccc21	ZINC000819090812	EE	On-Demand	Mild	SLC6A1	45	34
N#CCCn1cc(C(=O)CN2CCC[C@H]2C(=O)O)c2ccccc21	ZINC000819090812	EE	On-Demand	Mild	CNR2	24	42
N#CCCn1cc(C(=O)CN2CCC[C@@H]2C(=O)O)c2ccccc21	ZINC000819090813	EE	On-Demand	Mild	CNR1	18	42
N#CCCn1cc(C(=O)CN2CCC[C@@H]2C(=O)O)c2ccccc21	ZINC000819090813	EE	On-Demand	Mild	SLC6A1	45	34
N#CCCn1cc(C(=O)CN2CCC[C@@H]2C(=O)O)c2ccccc21	ZINC000819090813	EE	On-Demand	Mild	CNR2	24	42
N#CCCn1cc(C(=O)CN2CCC[C@@H](CC(=O)O)C2)c2ccccc21	ZINC000819090814	FF	On-Demand	Mild	CNR1	18	43
N#CCCn1cc(C(=O)CN2CCC[C@@H](CC(=O)O)C2)c2ccccc21	ZINC000819090814	FF	On-Demand	Mild	SLC6A1	43	31
N#CCCn1cc(C(=O)CN2CCC[C@@H](CC(=O)O)C2)c2ccccc21	ZINC000819090814	FF	On-Demand	Mild	CNR2	22	44
N#CCCn1cc(C(=O)CN2CCC[C@H](CC(=O)O)C2)c2ccccc21	ZINC000819090815	FF	On-Demand	Mild	CNR1	18	43
N#CCCn1cc(C(=O)CN2CCC[C@H](CC(=O)O)C2)c2ccccc21	ZINC000819090815	FF	On-Demand	Mild	SLC6A1	43	31
N#CCCn1cc(C(=O)CN2CCC[C@H](CC(=O)O)C2)c2ccccc21	ZINC000819090815	FF	On-Demand	Mild	CNR2	22	44
N#CCn1c(CN2CC[C@@H](C(=O)O)C2)nc2ccccc2c1=O	ZINC000819090816	DC	On-Demand	Mild	SLC6A1	94	38
N#CCn1c(CN2CC[C@H](C(=O)O)C2)nc2ccccc2c1=O	ZINC000819090817	DC	On-Demand	Mild	SLC6A1	94	38
N#C[C@H]1CN(C(=O)Nc2ccccc2CC(=O)O)CCN1C1CC1	ZINC000819090819	ED	On-Demand	Mild	RBP4	53	36
N#C[C@@H]1CN(C(=O)Nc2ccccc2CC(=O)O)CCN1C1CC1	ZINC000819090820	ED	On-Demand	Mild	RBP4	53	36
N#CCC(=O)Nc1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819090829	EF	On-Demand	Mild	LTA4H	35	40
N#CCC(=O)Nc1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819090829	EF	On-Demand	Mild	ACR	61	37
N#CCc1ccc(OCc2ccccc2NC(=O)NCC(=O)O)cc1	ZINC000819090831	EF	On-Demand	Mild	FFAR1	37	42
N#CCc1ccc(OCc2ccccc2NC(=O)NCC(=O)O)cc1	ZINC000819090831	EF	On-Demand	Mild	FFAR4	58	43
N#CCCCS(=O)(=O)c1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819090836	GE	On-Demand	Mild	CA2	29	51
N#CCCCS(=O)(=O)c1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819090836	GE	On-Demand	Mild	CA4	16	51
N#CCCCS(=O)(=O)c1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819090836	GE	On-Demand	Mild	CYNT	15	48
N#CCCCS(=O)(=O)c1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819090836	GE	On-Demand	Mild	NAMPT	52	38
N#CCCNS(=O)(=O)c1ccc(C(=O)NCCCC(=O)O)cc1	ZINC000819090837	EC	On-Demand	Mild	CA2	20	61
N#CCCNS(=O)(=O)c1ccc(C(=O)NCCCC(=O)O)cc1	ZINC000819090837	EC	On-Demand	Mild	TBXA2R	47	42
N#CCCNS(=O)(=O)c1ccc(C(=O)NCCCC(=O)O)cc1	ZINC000819090837	EC	On-Demand	Mild	TBXAS1	40	39
N#CCSc1ccccc1NC(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819090838	DD	On-Demand	Mild	SLC6A1	90	37
N#CCSc1ccccc1NC(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819090838	DD	On-Demand	Mild	KCNQ2	43	35
N#CCSc1ccccc1NC(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819090839	DD	On-Demand	Mild	SLC6A1	90	37
N#CCSc1ccccc1NC(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819090839	DD	On-Demand	Mild	KCNQ2	43	35
N#CCOc1cccc(NC(=O)NCCCC(=O)O)c1	ZINC000819090840	CD	On-Demand	Mild	ADRB1	46	44
N#CCOc1cccc(NC(=O)NCCCC(=O)O)c1	ZINC000819090840	CD	On-Demand	Mild	HRH2	33	44
N#CCOc1cccc(NC(=O)NCCCC(=O)O)c1	ZINC000819090840	CD	On-Demand	Mild	CCR3	25	42
N#CCOc1cccc(NC(=O)NCCCC(=O)O)c1	ZINC000819090840	CD	On-Demand	Mild	EPHX2	26	44
N#CCc1ccc(OCc2ccccc2NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819090847	GG	On-Demand	Mild	CYSLTR2	43	31
N#CCc1ccc(OCc2ccccc2NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819090848	GG	On-Demand	Mild	CYSLTR2	43	31
N#CCN1CCC(CNC(=O)C2=NN(c3ccccc3)[C@H](C(=O)O)C2)CC1	ZINC000819090853	FD	On-Demand	Mild	HTR4	48	38
N#CCN1CCC(CNC(=O)C2=NN(c3ccccc3)[C@H](C(=O)O)C2)CC1	ZINC000819090853	FD	On-Demand	Mild	CACNA1I	54	33
N#CCN1CCC(CNC(=O)C2=NN(c3ccccc3)[C@@H](C(=O)O)C2)CC1	ZINC000819090854	FD	On-Demand	Mild	HTR4	48	38
N#CCN1CCC(CNC(=O)C2=NN(c3ccccc3)[C@@H](C(=O)O)C2)CC1	ZINC000819090854	FD	On-Demand	Mild	CACNA1I	54	33
N#CCOc1ccccc1C(=O)NCCCC(=O)O	ZINC000819090857	CD	On-Demand	Mild	FOLH1	34	46
N#CCOc1ccccc1C(=O)NCCCC(=O)O	ZINC000819090857	CD	On-Demand	Mild	HCN1	62	33
N#CCOc1ccccc1C(=O)NCCCC(=O)O	ZINC000819090857	CD	On-Demand	Mild	HCN4	41	32
N#CCOc1ccc(CNC(=O)NCCC(=O)O)cc1	ZINC000819090867	CC	On-Demand	Mild	FFAR1	41	47
N#CCOc1ccc(CNC(=O)NCCC(=O)O)cc1	ZINC000819090867	CC	On-Demand	Mild	FFAR4	48	33
N#CCOc1cccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819090870	ED	On-Demand	Mild	CCR3	30	44
N#CCOc1cccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819090870	ED	On-Demand	Mild	EPHX2	18	40
N#CCOc1cccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819090871	ED	On-Demand	Mild	CCR3	30	44
N#CCOc1cccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819090871	ED	On-Demand	Mild	EPHX2	18	40
N#CCOc1cccc(NC(=O)NC2(C(=O)O)CCCC2)c1	ZINC000819090890	DE	On-Demand	Mild	EPHX2	38	45
N#CCCN(C(=O)CN1CC[C@@H](C(=O)O)C1)c1cccc(Cl)c1	ZINC000819090891	ED	On-Demand	Mild	SLC6A1	80	40
N#CCCN(C(=O)CN1CC[C@@H](C(=O)O)C1)c1cccc(Cl)c1	ZINC000819090891	ED	On-Demand	Mild	CCR5	15	43
N#CCCN(C(=O)CN1CC[C@H](C(=O)O)C1)c1cccc(Cl)c1	ZINC000819090892	ED	On-Demand	Mild	SLC6A1	80	40
N#CCCN(C(=O)CN1CC[C@H](C(=O)O)C1)c1cccc(Cl)c1	ZINC000819090892	ED	On-Demand	Mild	CCR5	15	43
N#CCSCCCN1CC[C@@H](C(=O)O)C1	ZINC000819090894	BD	On-Demand	Mild	SLC6A1	83	38
N#CCSCCCN1CC[C@H](C(=O)O)C1	ZINC000819090895	BD	On-Demand	Mild	SLC6A1	83	38
N#CCN1CCC(NC(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819090896	DD	On-Demand	Mild	DRD4	18	50
N#CCN1CCC(NC(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819090896	DD	On-Demand	Mild	SIGMAR1	18	53
N#CCN1CCC(NC(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819090896	DD	On-Demand	Mild	CCR3	37	43
N#CCN1CCC(NC(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819090896	DD	On-Demand	Mild	EPHX2	39	40
N#CN(Cc1ccc(C(=O)O)cc1)c1ccccc1	ZINC000819090898	CF	On-Demand	Anodyne	SRD5A2	16	41
N#CN(Cc1ccc(C(=O)O)cc1)c1ccccc1	ZINC000819090898	CF	On-Demand	Anodyne	LTA4H	15	40
N#CCOc1cccc(NC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819090900	DE	On-Demand	Mild	PDGFRB	25	41
N#CCOc1cccc(NC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819090900	DE	On-Demand	Mild	CCR3	35	52
N#CCOc1cccc(NC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819090900	DE	On-Demand	Mild	EPHX2	26	42
N#CCOc1cccc(NC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819090900	DE	On-Demand	Mild	DGAT1	21	41
N#CCOc1cccc(NC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819090901	DE	On-Demand	Mild	PDGFRB	25	41
N#CCOc1cccc(NC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819090901	DE	On-Demand	Mild	CCR3	35	52
N#CCOc1cccc(NC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819090901	DE	On-Demand	Mild	EPHX2	26	42
N#CCOc1cccc(NC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819090901	DE	On-Demand	Mild	DGAT1	21	41
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819090906	FG	On-Demand	Bother	ADRB2	64	47
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819090906	FG	On-Demand	Bother	ADRB1	72	45
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819090906	FG	On-Demand	Bother	ADRB3	117	45
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819090907	FG	On-Demand	Bother	ADRB2	64	47
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819090907	FG	On-Demand	Bother	ADRB1	72	45
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819090907	FG	On-Demand	Bother	ADRB3	117	45
N#CCc1ccc(OCc2cccc(NC(=O)NCC(=O)O)c2)cc1	ZINC000819090914	EF	On-Demand	Mild	FFAR1	60	47
N#CCc1ccc(OCc2cccc(NC(=O)NCC(=O)O)c2)cc1	ZINC000819090914	EF	On-Demand	Mild	FFAR4	44	41
N#CCOc1cccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819090920	FD	On-Demand	Mild	UL80	25	40
N#CCOc1cccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819090920	FD	On-Demand	Mild	PDS	51	37
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccccc1C(=O)N(C)C	ZINC000819090932	CG	On-Demand	Anodyne	CXCR1	51	35
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccccc1C(=O)N(C)C	ZINC000819090935	CG	On-Demand	Anodyne	CXCR1	51	35
Cn1cnnc1-c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819090954	GG	On-Demand	Mild	PAPA1_CARPA	36	40
Cn1cnnc1-c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819090954	GG	On-Demand	Mild	CTSV	43	33
Cn1cnnc1-c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819090957	GG	On-Demand	Mild	PAPA1_CARPA	36	40
Cn1cnnc1-c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819090957	GG	On-Demand	Mild	CTSV	43	33
COC(=O)c1ccc(S(=O)(=O)N[C@@H]2C[C@@H](C(=O)O)C2)c(OC)c1	ZINC000819090960	EC	On-Demand	Anodyne	SFRP1	42	33
N#CCCCS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819090980	FD	On-Demand	Mild	ACE	50	40
N#CCCCS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819090980	FD	On-Demand	Mild	PREP	53	45
N#CCCNS(=O)(=O)c1ccc(C(=O)N[C@H](C(=O)O)c2ccccc2)cc1	ZINC000819090996	GD	On-Demand	Mild	CA2	20	60
N#CCCNS(=O)(=O)c1ccc(C(=O)N[C@H](C(=O)O)c2ccccc2)cc1	ZINC000819090996	GD	On-Demand	Mild	LIMK2	16	40
N#CCCCCSCc1ccc(C(=O)O)cc1	ZINC000819091013	BG	On-Demand	Mild	CACNA2D1	21	40
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccc(Cl)cc1	ZINC000819091046	FG	On-Demand	Anodyne	ADRB1	33	41
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccc(Cl)cc1	ZINC000819091046	FG	On-Demand	Anodyne	ADRB3	54	44
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccc(Cl)cc1	ZINC000819091046	FG	On-Demand	Anodyne	IGF1R	29	40
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccc(Cl)cc1	ZINC000819091046	FG	On-Demand	Anodyne	CYP3A4	51	40
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccc(Cl)cc1	ZINC000819091048	FG	On-Demand	Anodyne	ADRB1	33	41
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccc(Cl)cc1	ZINC000819091048	FG	On-Demand	Anodyne	ADRB3	54	44
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccc(Cl)cc1	ZINC000819091048	FG	On-Demand	Anodyne	IGF1R	29	40
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccc(Cl)cc1	ZINC000819091048	FG	On-Demand	Anodyne	CYP3A4	51	40
N#CCCN(CCN1CCOCC1)C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819091050	FD	On-Demand	Mild	CASR	71	60
N#CCCN(CCN1CCOCC1)C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819091050	FD	On-Demand	Mild	EPHX2	21	42
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccc(Cl)cc1	ZINC000819091051	FG	On-Demand	Anodyne	ADRB1	33	41
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccc(Cl)cc1	ZINC000819091051	FG	On-Demand	Anodyne	ADRB3	54	44
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccc(Cl)cc1	ZINC000819091051	FG	On-Demand	Anodyne	IGF1R	29	40
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccc(Cl)cc1	ZINC000819091051	FG	On-Demand	Anodyne	CYP3A4	51	40
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccc(Cl)cc1	ZINC000819091053	FG	On-Demand	Anodyne	ADRB1	33	41
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccc(Cl)cc1	ZINC000819091053	FG	On-Demand	Anodyne	ADRB3	54	44
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccc(Cl)cc1	ZINC000819091053	FG	On-Demand	Anodyne	IGF1R	29	40
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccc(Cl)cc1	ZINC000819091053	FG	On-Demand	Anodyne	CYP3A4	51	40
CC(=O)N(c1ccc(NC(=O)CN(C)C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819091054	HH	On-Demand	Anodyne	F13A1	29	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccccc1Cn1cncn1)C2	ZINC000819091055	GD	On-Demand	Anodyne	HIS3	45	34
CC(=O)N(c1ccc(NC(=O)CN(C)C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819091056	HH	On-Demand	Anodyne	F13A1	29	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccccc1Cn1cncn1)C2	ZINC000819091058	GD	On-Demand	Anodyne	HIS3	45	34
CC(=O)N(c1ccc(NC(=O)CN(C)C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819091059	HH	On-Demand	Anodyne	F13A1	29	41
CC(=O)N(c1ccc(NC(=O)CN(C)C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819091060	HH	On-Demand	Anodyne	F13A1	29	41
N#C/C=C(/c1ccccc1)N1CC[C@H](C(=O)O)C1	ZINC000819091065	BD	On-Demand	Reactive	SLC6A1	117	41
COc1ccc(OC)c([C@H](O)CNCC2(c3cccc(F)c3)CC2)c1	ZINC000819091067	EG	On-Demand	Anodyne	SOAT1	15	42
COc1ccc(OC)c([C@H](O)CNCC2(c3cccc(F)c3)CC2)c1	ZINC000819091067	EG	On-Demand	Anodyne	ICMT	27	41
N#C/C=C(\c1ccccc1)N1CC[C@H](C(=O)O)C1	ZINC000819091068	BD	On-Demand	Reactive	SLC6A1	117	41
N#C/C=C(\c1ccccc1)N1CC[C@@H](C(=O)O)C1	ZINC000819091070	BD	On-Demand	Reactive	SLC6A1	117	41
N#C/C=C(/c1ccccc1)N1CC[C@@H](C(=O)O)C1	ZINC000819091073	BD	On-Demand	Reactive	SLC6A1	117	41
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2cccc(C(F)F)c2)C1	ZINC000819091074	DD	On-Demand	Anodyne	SFRP1	110	37
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2cccc(C(F)F)c2)C1	ZINC000819091074	DD	On-Demand	Anodyne	WNT3	70	34
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2(c3cccc(F)c3)CC2)CC1	ZINC000819091077	GG	On-Demand	Anodyne	GPR119	38	57
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2(c3cccc(F)c3)CC2)CC1	ZINC000819091079	GG	On-Demand	Anodyne	GPR119	38	57
CC(=O)N(c1ccc(NC(=O)c2cc(OCc3ccccc3)ccn2)cc1)[C@@H]1C[C@@H]1C	ZINC000819091083	HJ	On-Demand	Anodyne	TSHR	43	33
CC(=O)N(c1ccc(NC(=O)c2cc(OCc3ccccc3)ccn2)cc1)[C@@H]1C[C@@H]1C	ZINC000819091083	HJ	On-Demand	Anodyne	RAF1	51	37
CC(=O)N(c1ccc(NC(=O)c2cc(OCc3ccccc3)ccn2)cc1)[C@@H]1C[C@@H]1C	ZINC000819091083	HJ	On-Demand	Anodyne	GRM4	43	35
N#CCCCS(=O)(=O)c1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819091084	FD	On-Demand	Mild	L3MBTL3	55	38
N#CCCCS(=O)(=O)c1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819091086	FD	On-Demand	Mild	L3MBTL3	55	38
CC(=O)N(c1ccc(NC(=O)c2cc(OCc3ccccc3)ccn2)cc1)[C@@H]1C[C@H]1C	ZINC000819091093	HJ	On-Demand	Anodyne	TSHR	43	33
CC(=O)N(c1ccc(NC(=O)c2cc(OCc3ccccc3)ccn2)cc1)[C@@H]1C[C@H]1C	ZINC000819091093	HJ	On-Demand	Anodyne	RAF1	51	37
CC(=O)N(c1ccc(NC(=O)c2cc(OCc3ccccc3)ccn2)cc1)[C@@H]1C[C@H]1C	ZINC000819091093	HJ	On-Demand	Anodyne	GRM4	43	35
CC(=O)N(c1ccc(NC(=O)c2cc(OCc3ccccc3)ccn2)cc1)[C@H]1C[C@H]1C	ZINC000819091095	HJ	On-Demand	Anodyne	TSHR	43	33
CC(=O)N(c1ccc(NC(=O)c2cc(OCc3ccccc3)ccn2)cc1)[C@H]1C[C@H]1C	ZINC000819091095	HJ	On-Demand	Anodyne	RAF1	51	37
CC(=O)N(c1ccc(NC(=O)c2cc(OCc3ccccc3)ccn2)cc1)[C@H]1C[C@H]1C	ZINC000819091095	HJ	On-Demand	Anodyne	GRM4	43	35
CC(=O)N(c1ccc(NC(=O)c2cc(OCc3ccccc3)ccn2)cc1)[C@H]1C[C@@H]1C	ZINC000819091098	HJ	On-Demand	Anodyne	TSHR	43	33
CC(=O)N(c1ccc(NC(=O)c2cc(OCc3ccccc3)ccn2)cc1)[C@H]1C[C@@H]1C	ZINC000819091098	HJ	On-Demand	Anodyne	RAF1	51	37
CC(=O)N(c1ccc(NC(=O)c2cc(OCc3ccccc3)ccn2)cc1)[C@H]1C[C@@H]1C	ZINC000819091098	HJ	On-Demand	Anodyne	GRM4	43	35
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819091101	FG	On-Demand	Anodyne	RBP4	85	41
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819091101	FG	On-Demand	Anodyne	SCD1	24	49
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819091101	FG	On-Demand	Anodyne	SCD	23	47
CC(=O)N(c1ccc(NC(=O)c2c(O)cccc2Cl)cc1)[C@@H]1C[C@H]1C	ZINC000819091114	FI	On-Demand	Anodyne	TYK2	69	47
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819091118	FG	On-Demand	Bother	ADRB2	59	44
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819091118	FG	On-Demand	Bother	ADRB1	57	44
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819091118	FG	On-Demand	Bother	ADRB3	84	42
CC(=O)N(c1ccc(NC(=O)c2c(O)cccc2Cl)cc1)[C@H]1C[C@H]1C	ZINC000819091119	FI	On-Demand	Anodyne	TYK2	69	47
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819091120	FG	On-Demand	Bother	ADRB2	59	44
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819091120	FG	On-Demand	Bother	ADRB1	57	44
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819091120	FG	On-Demand	Bother	ADRB3	84	42
CC(=O)N(c1ccc(NC(=O)c2c(O)cccc2Cl)cc1)[C@@H]1C[C@@H]1C	ZINC000819091121	FI	On-Demand	Anodyne	TYK2	69	47
O=C1[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1c1ccc(Cl)cc1	ZINC000819091122	FG	On-Demand	Anodyne	ADRB3	15	41
CC(=O)N(c1ccc(NC(=O)c2c(O)cccc2Cl)cc1)[C@H]1C[C@@H]1C	ZINC000819091123	FI	On-Demand	Anodyne	TYK2	69	47
O=C1[C@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1c1ccc(Cl)cc1	ZINC000819091124	FG	On-Demand	Anodyne	ADRB3	15	41
CC(=O)N(c1ccc(NC(=O)c2cc(C(F)(F)F)cnc2Cl)cc1)[C@H]1C[C@H]1C	ZINC000819091130	HJ	On-Demand	Anodyne	ATF1	58	41
CC(=O)N(c1ccc(NC(=O)c2cc(C(F)(F)F)cnc2Cl)cc1)[C@H]1C[C@H]1C	ZINC000819091130	HJ	On-Demand	Anodyne	NFKB1	53	41
CC(=O)N(c1ccc(NC(=O)c2cc(C(F)(F)F)cnc2Cl)cc1)[C@@H]1C[C@@H]1C	ZINC000819091131	HJ	On-Demand	Anodyne	ATF1	58	41
CC(=O)N(c1ccc(NC(=O)c2cc(C(F)(F)F)cnc2Cl)cc1)[C@@H]1C[C@@H]1C	ZINC000819091131	HJ	On-Demand	Anodyne	NFKB1	53	41
CC(=O)N(c1ccc(NC(=O)c2cc(C(F)(F)F)cnc2Cl)cc1)[C@H]1C[C@@H]1C	ZINC000819091132	HJ	On-Demand	Anodyne	ATF1	58	41
CC(=O)N(c1ccc(NC(=O)c2cc(C(F)(F)F)cnc2Cl)cc1)[C@H]1C[C@@H]1C	ZINC000819091132	HJ	On-Demand	Anodyne	NFKB1	53	41
COc1c(F)cc(Br)cc1S(=O)(=O)N[C@@H]1C[C@@H](C(=O)O)C1	ZINC000819091133	GD	On-Demand	Anodyne	SFRP1	59	32
CC(=O)N(c1ccc(NC(=O)c2cc(C(F)(F)F)cnc2Cl)cc1)[C@@H]1C[C@H]1C	ZINC000819091134	HJ	On-Demand	Anodyne	ATF1	58	41
CC(=O)N(c1ccc(NC(=O)c2cc(C(F)(F)F)cnc2Cl)cc1)[C@@H]1C[C@H]1C	ZINC000819091134	HJ	On-Demand	Anodyne	NFKB1	53	41
CC(=O)N(c1ccc(NC(=O)/C(C#N)=C\c2ccc(F)cc2)cc1)[C@@H]1C[C@H]1C	ZINC000819091141	GI	On-Demand	Reactive	CA12	15	43
CC(=O)N(c1ccc(NC(=O)/C(C#N)=C/c2ccc(F)cc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819091144	GI	On-Demand	Reactive	CA12	15	43
CC(=O)N(c1ccc(NC(=O)/C(C#N)=C\c2ccc(F)cc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819091145	GI	On-Demand	Reactive	CA12	15	43
CC(=O)N(c1ccc(NC(=O)/C(C#N)=C/c2ccc(F)cc2)cc1)[C@@H]1C[C@H]1C	ZINC000819091146	GI	On-Demand	Reactive	CA12	15	43
N#CCSc1ccccc1NC(=O)CN1CCC[C@@H]1C(=O)O	ZINC000819091162	DD	On-Demand	Mild	ACE	42	36
N#CCSc1ccccc1NC(=O)CN1CCC[C@@H]1C(=O)O	ZINC000819091162	DD	On-Demand	Mild	KCNQ2	45	35
N#CCSc1ccccc1NC(=O)CN1CCC[C@@H]1C(=O)O	ZINC000819091162	DD	On-Demand	Mild	LGMN	65	36
N#CCSc1ccccc1NC(=O)CN1CCC[C@H]1C(=O)O	ZINC000819091163	DD	On-Demand	Mild	ACE	42	36
N#CCSc1ccccc1NC(=O)CN1CCC[C@H]1C(=O)O	ZINC000819091163	DD	On-Demand	Mild	KCNQ2	45	35
N#CCSc1ccccc1NC(=O)CN1CCC[C@H]1C(=O)O	ZINC000819091163	DD	On-Demand	Mild	LGMN	65	36
N#CCCn1cc(C(=O)CN2CC[C@@H](C(=O)O)C2)c2ccccc21	ZINC000819091165	EE	On-Demand	Mild	CNR1	19	44
N#CCCn1cc(C(=O)CN2CC[C@@H](C(=O)O)C2)c2ccccc21	ZINC000819091165	EE	On-Demand	Mild	SLC6A1	126	37
N#CCCn1cc(C(=O)CN2CC[C@@H](C(=O)O)C2)c2ccccc21	ZINC000819091165	EE	On-Demand	Mild	CNR2	24	44
N#CCCn1cc(C(=O)CN2CC[C@H](C(=O)O)C2)c2ccccc21	ZINC000819091166	EE	On-Demand	Mild	CNR1	19	44
N#CCCn1cc(C(=O)CN2CC[C@H](C(=O)O)C2)c2ccccc21	ZINC000819091166	EE	On-Demand	Mild	SLC6A1	126	37
N#CCCn1cc(C(=O)CN2CC[C@H](C(=O)O)C2)c2ccccc21	ZINC000819091166	EE	On-Demand	Mild	CNR2	24	44
N#CCCNS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819091167	GD	On-Demand	Mild	CA2	16	44
N#CCOc1ccccc1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819091175	DE	On-Demand	Mild	HCN1	73	36
N#CCOc1ccccc1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819091175	DE	On-Demand	Mild	HCN4	50	33
N#CCOc1ccccc1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819091175	DE	On-Demand	Mild	KCNK3	40	32
N#CCCNS(=O)(=O)c1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819091176	FC	On-Demand	Mild	SFRP1	62	37
N#CCCNS(=O)(=O)c1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819091176	FC	On-Demand	Mild	L3MBTL3	52	38
N#CCCNS(=O)(=O)c1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819091177	FC	On-Demand	Mild	SFRP1	62	37
N#CCCNS(=O)(=O)c1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819091177	FC	On-Demand	Mild	L3MBTL3	52	38
N#CCOc1cc(F)ccc1NC(=O)NCCCC(=O)O	ZINC000819091180	CD	On-Demand	Mild	FOLH1	20	40
N#C/C=C(\c1ccccc1)N1CCC(C(=O)O)CC1	ZINC000819091188	CE	On-Demand	Reactive	SLC6A1	63	37
N#C/C=C(\c1ccccc1)N1CCC(C(=O)O)CC1	ZINC000819091188	CE	On-Demand	Reactive	L3MBTL3	40	35
N#C/C=C(/c1ccccc1)N1CCC(C(=O)O)CC1	ZINC000819091189	CE	On-Demand	Reactive	SLC6A1	63	37
N#C/C=C(/c1ccccc1)N1CCC(C(=O)O)CC1	ZINC000819091189	CE	On-Demand	Reactive	L3MBTL3	40	35
N#CCOc1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819091190	FD	On-Demand	Mild	FFAR4	40	35
N#CCOc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819091197	CD	On-Demand	Mild	PDGFRB	27	41
N#CCOc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819091197	CD	On-Demand	Mild	CCR3	28	43
N#CCOc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819091197	CD	On-Demand	Mild	EPHX2	33	41
N#CCOc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819091198	CD	On-Demand	Mild	PDGFRB	27	41
N#CCOc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819091198	CD	On-Demand	Mild	CCR3	28	43
N#CCOc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819091198	CD	On-Demand	Mild	EPHX2	33	41
N#CCCn1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)n1	ZINC000819091204	CC	On-Demand	Mild	SLC6A1	49	34
N#CCCn1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)n1	ZINC000819091205	CC	On-Demand	Mild	SLC6A1	49	34
N#C/C=C(\c1ccc(F)cc1)N1CCC(C(=O)O)CC1	ZINC000819091209	CE	On-Demand	Reactive	SLC18A3	21	41
N#C/C=C(/c1ccc(F)cc1)N1CCC(C(=O)O)CC1	ZINC000819091210	CE	On-Demand	Reactive	SLC18A3	21	41
N#CCn1c(CN2CCC[C@@H]2C(=O)O)nc2ccccc2c1=O	ZINC000819091216	DC	On-Demand	Mild	Q8MHZ5_SHEEP	45	30
N#CCn1c(CN2CCC[C@H]2C(=O)O)nc2ccccc2c1=O	ZINC000819091217	DC	On-Demand	Mild	Q8MHZ5_SHEEP	45	30
N#CCNC(=O)CNc1cccc(CC(=O)O)c1	ZINC000819091218	BC	On-Demand	Mild	PAPA1_CARPA	35	41
N#CCNC(=O)CNc1cccc(CC(=O)O)c1	ZINC000819091218	BC	On-Demand	Mild	CTSK	17	41
N#CCNC(=O)CNc1cccc(CC(=O)O)c1	ZINC000819091218	BC	On-Demand	Mild	CTSL	28	46
N#CCNC(=O)CNc1cccc(CC(=O)O)c1	ZINC000819091218	BC	On-Demand	Mild	CTSS	22	46
N#CCNC(=O)CNc1cccc(CC(=O)O)c1	ZINC000819091218	BC	On-Demand	Mild	CTSV	53	37
N#CCc1cccc(C(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819091219	CE	On-Demand	Mild	PREP	46	41
N#CCc1cccc(C(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819091220	CE	On-Demand	Mild	PREP	46	41
N#CCCCS(=O)(=O)c1ccc(C(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819091238	GE	On-Demand	Mild	CTSK	25	44
N#CCCCOc1cccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819091239	ED	On-Demand	Mild	EPHX2	23	44
N#CCCCOc1cccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819091241	ED	On-Demand	Mild	EPHX2	23	44
N#CCN1CCC(CNC(=O)CSCC(=O)O)CC1	ZINC000819091242	CC	On-Demand	Mild	CACNA1I	45	34
N#CCCN(CCN1CCOCC1)C(=O)Nc1ccccc1CC(=O)O	ZINC000819091243	FD	On-Demand	Mild	CASR	69	51
Cc1cc(F)ccc1[C@@H](O)CNCCCCc1ccc([N+](=O)[O-])cc1	ZINC000819091275	EH	On-Demand	Bother	LEF	67	43
N#CCCn1ccc(NC(=O)Nc2cccc(CC(=O)O)c2)n1	ZINC000819091279	DE	On-Demand	Mild	CCKBR	16	45
N#CCOc1ccc(Cl)cc1CN1CCC[C@H](CC(=O)O)C1	ZINC000819091280	DF	On-Demand	Mild	PTGER1	45	40
N#CCOc1ccc(Cl)cc1CN1CCC[C@H](CC(=O)O)C1	ZINC000819091280	DF	On-Demand	Mild	PTGDR2	16	45
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(S(=O)(=O)C(F)(F)F)cc2)C1	ZINC000819091281	GD	On-Demand	Anodyne	SFRP1	136	40
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(S(=O)(=O)C(F)(F)F)cc2)C1	ZINC000819091281	GD	On-Demand	Anodyne	WNT3	89	40
N#CCOc1ccc(Cl)cc1CN1CCC[C@@H](CC(=O)O)C1	ZINC000819091289	DF	On-Demand	Mild	PTGER1	45	40
N#CCOc1ccc(Cl)cc1CN1CCC[C@@H](CC(=O)O)C1	ZINC000819091289	DF	On-Demand	Mild	PTGDR2	16	45
N#CC1CCN(C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819091291	CE	On-Demand	Mild	RBP4	48	41
N#C[C@H]1CN(C(=O)NCCC(=O)O)CCN1Cc1ccccc1	ZINC000819091301	DC	On-Demand	Mild	DPP4	20	44
N#C[C@H]1CN(C(=O)NCCC(=O)O)CCN1Cc1ccccc1	ZINC000819091301	DC	On-Demand	Mild	PREP	22	40
N#C[C@@H]1CN(C(=O)NCCC(=O)O)CCN1Cc1ccccc1	ZINC000819091305	DC	On-Demand	Mild	DPP4	20	44
N#C[C@@H]1CN(C(=O)NCCC(=O)O)CCN1Cc1ccccc1	ZINC000819091305	DC	On-Demand	Mild	PREP	22	40
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819091315	FH	On-Demand	Bother	LEF	48	38
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819091316	FH	On-Demand	Bother	LEF	48	38
N#C/C=C(/c1ccccc1)N1CCC[C@H](CC(=O)O)C1	ZINC000819091341	CF	On-Demand	Reactive	SLC6A1	48	40
N#C/C=C(/c1ccccc1)N1CCC[C@H](CC(=O)O)C1	ZINC000819091341	CF	On-Demand	Reactive	PREP	50	36
N#C/C=C(\c1ccccc1)N1CCC[C@@H](CC(=O)O)C1	ZINC000819091344	CF	On-Demand	Reactive	SLC6A1	48	40
N#C/C=C(\c1ccccc1)N1CCC[C@@H](CC(=O)O)C1	ZINC000819091344	CF	On-Demand	Reactive	PREP	50	36
N#C/C=C(\c1ccccc1)N1CCC[C@H](CC(=O)O)C1	ZINC000819091346	CF	On-Demand	Reactive	SLC6A1	48	40
N#C/C=C(\c1ccccc1)N1CCC[C@H](CC(=O)O)C1	ZINC000819091346	CF	On-Demand	Reactive	PREP	50	36
N#C/C=C(/c1ccccc1)N1CCC[C@@H](CC(=O)O)C1	ZINC000819091347	CF	On-Demand	Reactive	SLC6A1	48	40
N#C/C=C(/c1ccccc1)N1CCC[C@@H](CC(=O)O)C1	ZINC000819091347	CF	On-Demand	Reactive	PREP	50	36
N#CCCNS(=O)(=O)c1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819091349	GD	On-Demand	Mild	CA2	31	51
N#CCCNS(=O)(=O)c1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819091349	GD	On-Demand	Mild	CA1	20	51
N#CCCNS(=O)(=O)c1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819091349	GD	On-Demand	Mild	CA4	17	51
N#CCCNS(=O)(=O)c1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819091349	GD	On-Demand	Mild	CYNT	21	48
N#CCCNS(=O)(=O)c1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819091349	GD	On-Demand	Mild	LIMK2	17	41
N#CCCNS(=O)(=O)c1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819091349	GD	On-Demand	Mild	NAMPT	56	39
N#CCCNS(=O)(=O)c1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819091349	GD	On-Demand	Mild	A6YCJ1_9METZ	22	40
N#CCOc1ccc(CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819091356	CE	On-Demand	Mild	LTA4H	36	41
N#CCOc1ccc(CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819091356	CE	On-Demand	Mild	HRH3	25	45
N#CCOc1ccc(CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819091356	CE	On-Demand	Mild	SIGMAR1	22	47
N#CCOc1ccc(CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819091356	CE	On-Demand	Mild	CHEK2	24	42
N#CCOc1ccc(CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819091358	CE	On-Demand	Mild	LTA4H	36	41
N#CCOc1ccc(CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819091358	CE	On-Demand	Mild	HRH3	25	45
N#CCOc1ccc(CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819091358	CE	On-Demand	Mild	SIGMAR1	22	47
N#CCOc1ccc(CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819091358	CE	On-Demand	Mild	CHEK2	24	42
N#CCOc1cc(F)ccc1NC(=O)Nc1cccc(CC(=O)O)c1	ZINC000819091360	EF	On-Demand	Mild	PPIA	33	40
N#CCOc1ccccc1C(=O)OCc1ccc(C(=O)O)cc1	ZINC000819091361	DF	On-Demand	Mild	PTGER1	20	43
N#Cc1c(F)cccc1N1CCN(C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819091366	GF	On-Demand	Mild	CXCL8	23	42
N#Cc1c(F)cccc1N1CCN(C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819091366	GF	On-Demand	Mild	KCNQ2	70	38
N#CCn1c(CN2CCC[C@H](CC(=O)O)C2)nc2ccccc2c1=O	ZINC000819091377	ED	On-Demand	Mild	Q8MHZ5_SHEEP	70	37
N#CCn1c(CN2CCC[C@@H](CC(=O)O)C2)nc2ccccc2c1=O	ZINC000819091380	ED	On-Demand	Mild	Q8MHZ5_SHEEP	70	37
CC(=O)N(c1ccc(NC(=O)c2ccccc2OCC(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091408	GJ	On-Demand	Anodyne	KCNK3	52	38
CC(=O)N(c1ccc(NC(=O)c2ccccc2OCC(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091408	GJ	On-Demand	Anodyne	KCNK9	49	38
CC(=O)N(c1ccc(NC(=O)c2ccccc2OCC(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091409	GJ	On-Demand	Anodyne	KCNK3	52	38
CC(=O)N(c1ccc(NC(=O)c2ccccc2OCC(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091409	GJ	On-Demand	Anodyne	KCNK9	49	38
CC(=O)N(c1ccc(NC(=O)c2ccccc2OCC(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091410	GJ	On-Demand	Anodyne	KCNK3	52	38
CC(=O)N(c1ccc(NC(=O)c2ccccc2OCC(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091410	GJ	On-Demand	Anodyne	KCNK9	49	38
CC(=O)N(c1ccc(NC(=O)c2ccccc2OCC(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091411	GJ	On-Demand	Anodyne	KCNK3	52	38
CC(=O)N(c1ccc(NC(=O)c2ccccc2OCC(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091411	GJ	On-Demand	Anodyne	KCNK9	49	38
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1ccc(Cl)cc1	ZINC000819091488	EE	On-Demand	Anodyne	ADRB1	19	40
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1ccc(Cl)cc1	ZINC000819091488	EE	On-Demand	Anodyne	ADRB3	68	49
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1ccc(Cl)cc1	ZINC000819091489	EE	On-Demand	Anodyne	ADRB1	19	40
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1ccc(Cl)cc1	ZINC000819091489	EE	On-Demand	Anodyne	ADRB3	68	49
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1ccc(Cl)cc1	ZINC000819091490	EE	On-Demand	Anodyne	ADRB1	19	40
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1ccc(Cl)cc1	ZINC000819091490	EE	On-Demand	Anodyne	ADRB3	68	49
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1ccc(Cl)cc1	ZINC000819091491	EE	On-Demand	Anodyne	ADRB1	19	40
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1ccc(Cl)cc1	ZINC000819091491	EE	On-Demand	Anodyne	ADRB3	68	49
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(CCCCl)cc2)C1	ZINC000819091495	ED	On-Demand	Reactive	TBXA2R	21	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2cc3ccccc3o2)CC1	ZINC000819091496	GH	On-Demand	Anodyne	GPR119	32	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2cc3ccccc3o2)CC1	ZINC000819091497	GH	On-Demand	Anodyne	GPR119	32	44
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C1	ZINC000819091506	DC	On-Demand	Bother	SFRP1	90	35
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2cccc(F)c2[N+](=O)[O-])C1	ZINC000819091506	DC	On-Demand	Bother	WNT3	48	33
O[C@@H](CNCC1(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819091508	DG	On-Demand	Anodyne	ADRB2	20	40
O[C@@H](CNCC1(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819091508	DG	On-Demand	Anodyne	ADRB1	40	40
O[C@@H](CNCC1(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819091508	DG	On-Demand	Anodyne	ADRB3	99	41
O[C@H](CNCC1(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819091509	DG	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNCC1(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819091509	DG	On-Demand	Anodyne	ADRB1	40	40
O[C@H](CNCC1(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819091509	DG	On-Demand	Anodyne	ADRB3	99	41
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)C2CC2)cc1	ZINC000819091524	CE	On-Demand	Bother	KCNJ1	24	40
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)C2CC2)cc1	ZINC000819091526	CE	On-Demand	Bother	KCNJ1	24	40
CC(=O)N(c1ccc(NC(=O)c2ccc(CNC(=O)OC(C)(C)C)cc2)cc1)[C@H]1C[C@@H]1C	ZINC000819091530	IJ	On-Demand	Anodyne	GIPR	50	35
CC(=O)N(c1ccc(NC(=O)c2ccc(CNC(=O)OC(C)(C)C)cc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819091531	IJ	On-Demand	Anodyne	GIPR	50	35
CC(=O)N(c1ccc(NC(=O)c2ccc(CNC(=O)OC(C)(C)C)cc2)cc1)[C@@H]1C[C@H]1C	ZINC000819091532	IJ	On-Demand	Anodyne	GIPR	50	35
CC(=O)N(c1ccc(NC(=O)c2ccc(CNC(=O)OC(C)(C)C)cc2)cc1)[C@H]1C[C@H]1C	ZINC000819091533	IJ	On-Demand	Anodyne	GIPR	50	35
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819091536	FH	On-Demand	Bother	ADRB2	41	38
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819091538	FH	On-Demand	Bother	ADRB2	41	38
CC(=O)N(c1ccc(NC(=O)COc2ccc3c(C)cc(=O)oc3c2)cc1)[C@H]1C[C@@H]1C	ZINC000819091550	HH	On-Demand	Anodyne	MAOA	64	56
CC(=O)N(c1ccc(NC(=O)COc2ccc3c(C)cc(=O)oc3c2)cc1)[C@H]1C[C@@H]1C	ZINC000819091550	HH	On-Demand	Anodyne	MAOB	35	56
CC(=O)N(c1ccc(NC(=O)COc2ccc3c(C)cc(=O)oc3c2)cc1)[C@@H]1C[C@H]1C	ZINC000819091551	HH	On-Demand	Anodyne	MAOA	64	56
CC(=O)N(c1ccc(NC(=O)COc2ccc3c(C)cc(=O)oc3c2)cc1)[C@@H]1C[C@H]1C	ZINC000819091551	HH	On-Demand	Anodyne	MAOB	35	56
CC(=O)N(c1ccc(NC(=O)COc2ccc3c(C)cc(=O)oc3c2)cc1)[C@H]1C[C@H]1C	ZINC000819091552	HH	On-Demand	Anodyne	MAOA	64	56
CC(=O)N(c1ccc(NC(=O)COc2ccc3c(C)cc(=O)oc3c2)cc1)[C@H]1C[C@H]1C	ZINC000819091552	HH	On-Demand	Anodyne	MAOB	35	56
CC(=O)N(c1ccc(NC(=O)COc2ccc3c(C)cc(=O)oc3c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819091553	HH	On-Demand	Anodyne	MAOA	64	56
CC(=O)N(c1ccc(NC(=O)COc2ccc3c(C)cc(=O)oc3c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819091553	HH	On-Demand	Anodyne	MAOB	35	56
CC(=O)N(c1ccc(NC(=O)c2cc(Cl)nc3ccccc23)cc1)[C@H]1C[C@@H]1C	ZINC000819091565	GJ	On-Demand	Anodyne	NR2E3	63	34
CC(=O)N(c1ccc(NC(=O)c2cc(Cl)nc3ccccc23)cc1)[C@@H]1C[C@@H]1C	ZINC000819091568	GJ	On-Demand	Anodyne	NR2E3	63	34
CC(=O)N(c1ccc(NC(=O)c2cc(Cl)nc3ccccc23)cc1)[C@H]1C[C@H]1C	ZINC000819091570	GJ	On-Demand	Anodyne	NR2E3	63	34
CC(=O)N(c1ccc(NC(=O)c2cc(Cl)nc3ccccc23)cc1)[C@@H]1C[C@H]1C	ZINC000819091573	GJ	On-Demand	Anodyne	NR2E3	63	34
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	ELANE	36	43
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	CTRA_BOVIN	19	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	CASP3	23	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	BMP1	19	41
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	KLK3	72	35
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	CTSB	65	48
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	PAPA1_CARPA	81	42
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	CYSP_TRYCR	43	36
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	CTSK	38	47
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	CTSL	43	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	PGA	29	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	TIMP3	49	35
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	CAPNS1	67	39
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	CTSS	16	47
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	CAPN1	86	48
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	CASP1	32	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	CAPN2	129	48
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	PLAU	23	41
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	CASP6	22	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	CASP9	47	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	NPR	73	41
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	PSMB5	46	38
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	KDM1A	15	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819091578	II	On-Demand	Anodyne	Q6PRC7_IXORI	30	41
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	ELANE	36	43
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	CTRA_BOVIN	19	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	CASP3	23	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	BMP1	19	41
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	KLK3	72	35
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	CTSB	65	48
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	PAPA1_CARPA	81	42
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	CYSP_TRYCR	43	36
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	CTSK	38	47
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	CTSL	43	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	PGA	29	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	TIMP3	49	35
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	CAPNS1	67	39
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	CTSS	16	47
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	CAPN1	86	48
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	CASP1	32	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	CAPN2	129	48
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	PLAU	23	41
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	CASP6	22	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	CASP9	47	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	NPR	73	41
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	PSMB5	46	38
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	KDM1A	15	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819091579	II	On-Demand	Anodyne	Q6PRC7_IXORI	30	41
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	ELANE	36	43
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	CTRA_BOVIN	19	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	CASP3	23	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	BMP1	19	41
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	KLK3	72	35
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	CTSB	65	48
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	PAPA1_CARPA	81	42
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	CYSP_TRYCR	43	36
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	CTSK	38	47
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	CTSL	43	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	PGA	29	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	TIMP3	49	35
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	CAPNS1	67	39
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	CTSS	16	47
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	CAPN1	86	48
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	CASP1	32	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	CAPN2	129	48
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	PLAU	23	41
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	CASP6	22	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	CASP9	47	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	NPR	73	41
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	PSMB5	46	38
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	KDM1A	15	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819091580	II	On-Demand	Anodyne	Q6PRC7_IXORI	30	41
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	ELANE	36	43
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	CTRA_BOVIN	19	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	CASP3	23	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	BMP1	19	41
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	KLK3	72	35
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	CTSB	65	48
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	PAPA1_CARPA	81	42
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	CYSP_TRYCR	43	36
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	CTSK	38	47
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	CTSL	43	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	PGA	29	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	TIMP3	49	35
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	CAPNS1	67	39
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	CTSS	16	47
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	CAPN1	86	48
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	CASP1	32	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	CAPN2	129	48
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	PLAU	23	41
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	CASP6	22	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	CASP9	47	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	NPR	73	41
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	PSMB5	46	38
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	KDM1A	15	46
CC(=O)N(c1ccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819091581	II	On-Demand	Anodyne	Q6PRC7_IXORI	30	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccc(S(N)(=O)=O)c1)C2	ZINC000819091589	GC	On-Demand	Anodyne	CA5B	42	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccc(S(N)(=O)=O)c1)C2	ZINC000819091589	GC	On-Demand	Anodyne	CA5A	44	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccc(S(N)(=O)=O)c1)C2	ZINC000819091590	GC	On-Demand	Anodyne	CA5B	42	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccc(S(N)(=O)=O)c1)C2	ZINC000819091590	GC	On-Demand	Anodyne	CA5A	44	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccc(S(N)(=O)=O)c1	ZINC000819091611	FC	On-Demand	Anodyne	CA2	25	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccc(S(N)(=O)=O)c1	ZINC000819091611	FC	On-Demand	Anodyne	CA1	20	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccc(S(N)(=O)=O)c1	ZINC000819091611	FC	On-Demand	Anodyne	CA12	19	41
O[C@@H](CNCC1(c2cccc(F)c2)CC1)c1cccc(Cl)c1	ZINC000819091616	DH	On-Demand	Anodyne	ADRB1	26	42
O[C@@H](CNCC1(c2cccc(F)c2)CC1)c1cccc(Cl)c1	ZINC000819091616	DH	On-Demand	Anodyne	ADRB3	40	42
O[C@H](CNCC1(c2cccc(F)c2)CC1)c1cccc(Cl)c1	ZINC000819091617	DH	On-Demand	Anodyne	ADRB1	26	42
O[C@H](CNCC1(c2cccc(F)c2)CC1)c1cccc(Cl)c1	ZINC000819091617	DH	On-Demand	Anodyne	ADRB3	40	42
CC(=O)c1ccc(Cl)c(S(=O)(=O)N[C@@H]2C[C@@H](C(=O)O)C2)c1	ZINC000819091623	ED	On-Demand	Anodyne	SFRP1	52	34
O[C@@H](CNCC1(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819091627	DH	On-Demand	Anodyne	ADRB1	31	41
O[C@@H](CNCC1(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819091627	DH	On-Demand	Anodyne	ADRB3	53	41
O[C@H](CNCC1(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819091628	DH	On-Demand	Anodyne	ADRB1	31	41
O[C@H](CNCC1(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819091628	DH	On-Demand	Anodyne	ADRB3	53	41
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819091645	EE	On-Demand	Anodyne	MMP13	16	42
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819091645	EE	On-Demand	Anodyne	MMP2	17	42
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819091645	EE	On-Demand	Anodyne	EPHX2	19	40
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819091645	EE	On-Demand	Anodyne	SFRP1	46	31
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1	ZINC000819091651	HI	On-Demand	Anodyne	PAPA1_CARPA	34	43
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1	ZINC000819091651	HI	On-Demand	Anodyne	TIMP3	40	33
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1	ZINC000819091652	HI	On-Demand	Anodyne	PAPA1_CARPA	34	43
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1	ZINC000819091652	HI	On-Demand	Anodyne	TIMP3	40	33
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1	ZINC000819091653	HI	On-Demand	Anodyne	PAPA1_CARPA	34	43
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1	ZINC000819091653	HI	On-Demand	Anodyne	TIMP3	40	33
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1	ZINC000819091654	HI	On-Demand	Anodyne	PAPA1_CARPA	34	43
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1	ZINC000819091654	HI	On-Demand	Anodyne	TIMP3	40	33
COC(=O)/C=C\c1ccc(S(=O)(=O)N[C@@H]2C[C@@H](C(=O)O)C2)cc1	ZINC000819091694	ED	On-Demand	Anodyne	SFRP1	42	31
O=C(CCS(=O)(=O)N[C@@H]1C[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819091695	EC	On-Demand	Anodyne	KDM1A	16	40
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819091696	EG	On-Demand	Bother	ADRB2	57	44
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819091696	EG	On-Demand	Bother	ADRB1	64	51
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819091696	EG	On-Demand	Bother	ADRB3	109	51
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819091697	EG	On-Demand	Bother	ADRB2	57	44
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819091697	EG	On-Demand	Bother	ADRB1	64	51
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819091697	EG	On-Demand	Bother	ADRB3	109	51
Cc1noc(C)c1CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819091700	FF	On-Demand	Mild	PAPA1_CARPA	36	41
Cc1noc(C)c1CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819091701	FF	On-Demand	Mild	PAPA1_CARPA	36	41
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(Cl)nc2)C1	ZINC000819091715	CC	On-Demand	Anodyne	SFRP1	41	42
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819091738	GD	On-Demand	Anodyne	GRIN2B	39	50
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819091738	GD	On-Demand	Anodyne	PREP	33	45
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819091738	GD	On-Demand	Anodyne	TGM2	61	52
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819091738	GD	On-Demand	Anodyne	DPP7	21	40
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819091738	GD	On-Demand	Anodyne	F13A1	64	52
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819091738	GD	On-Demand	Anodyne	CCR8	36	46
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819091738	GD	On-Demand	Anodyne	SFRP1	56	33
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819091738	GD	On-Demand	Anodyne	SLC12A5	53	36
CC(=O)N(c1ccc(NC(=O)[C@H](C)Cc2ccc(F)cc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819091742	FI	On-Demand	Anodyne	TIMP3	44	39
CC(=O)N(c1ccc(NC(=O)[C@H](C)Cc2ccc(F)cc2)cc1)[C@H]1C[C@H]1C	ZINC000819091744	FI	On-Demand	Anodyne	TIMP3	44	39
CC(=O)N(c1ccc(NC(=O)[C@H](C)Cc2ccc(F)cc2)cc1)[C@@H]1C[C@H]1C	ZINC000819091746	FI	On-Demand	Anodyne	TIMP3	44	39
CC(=O)N(c1ccc(NC(=O)[C@H](C)Cc2ccc(F)cc2)cc1)[C@H]1C[C@@H]1C	ZINC000819091747	FI	On-Demand	Anodyne	TIMP3	44	39
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(SC(F)(F)F)cc2)C1	ZINC000819091784	FE	On-Demand	Anodyne	SFRP1	118	35
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(SC(F)(F)F)cc2)C1	ZINC000819091784	FE	On-Demand	Anodyne	WNT3	78	35
COc1ccc(OC)c([C@H](O)CNCCc2cc3ccccc3o2)c1	ZINC000819091808	EG	On-Demand	Anodyne	ADRB2	25	46
COc1ccc(OC)c([C@H](O)CNCCc2cc3ccccc3o2)c1	ZINC000819091808	EG	On-Demand	Anodyne	MTNR1A	18	40
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2cccc(S(F)(F)(F)(F)F)c2)C1	ZINC000819091813	GG	On-Demand	Reactive	SFRP1	118	36
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2cccc(S(F)(F)(F)(F)F)c2)C1	ZINC000819091813	GG	On-Demand	Reactive	WNT3	82	34
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819091832	FH	On-Demand	Bother	ADRB1	31	40
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819091832	FH	On-Demand	Bother	ADRB3	34	40
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819091838	FH	On-Demand	Bother	ADRB1	31	40
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819091838	FH	On-Demand	Bother	ADRB3	34	40
CS(=O)(=O)c1ccc([C@H](O)CNCC2(c3cccc(Cl)c3)CC2)cc1	ZINC000819091839	GG	On-Demand	Anodyne	ADRB3	41	39
CS(=O)(=O)c1ccc([C@@H](O)CNCC2(c3cccc(Cl)c3)CC2)cc1	ZINC000819091842	GG	On-Demand	Anodyne	ADRB3	41	39
NS(=O)(=O)c1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819091845	CD	On-Demand	Anodyne	CA2	54	41
NS(=O)(=O)c1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819091845	CD	On-Demand	Anodyne	CA1	46	41
NS(=O)(=O)c1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819091845	CD	On-Demand	Anodyne	CA7	44	41
NS(=O)(=O)c1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819091845	CD	On-Demand	Anodyne	CA5B	58	41
NS(=O)(=O)c1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819091845	CD	On-Demand	Anodyne	CA4	47	39
NS(=O)(=O)c1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819091845	CD	On-Demand	Anodyne	CA5A	61	41
NS(=O)(=O)c1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819091845	CD	On-Demand	Anodyne	CA12	30	40
NS(=O)(=O)c1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819091845	CD	On-Demand	Anodyne	P96878_MYCTU	17	40
N#Cc1ccc([C@@H](O)CNCCCCc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819091871	EG	On-Demand	Mild	ADRB2	43	40
N#Cc1ccc([C@@H](O)CNCCCCc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819091871	EG	On-Demand	Mild	ADRB1	41	40
N#Cc1ccc([C@@H](O)CNCCCCc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819091871	EG	On-Demand	Mild	ADRB3	50	40
N#Cc1ccc([C@@H](O)CNCCCCc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819091871	EG	On-Demand	Mild	KCNJ1	16	47
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819091872	IG	On-Demand	Anodyne	CPT1A	48	34
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819091873	IG	On-Demand	Anodyne	CPT1A	48	34
N#Cc1ccc([C@H](O)CNCCCCc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819091874	EG	On-Demand	Mild	ADRB2	43	40
N#Cc1ccc([C@H](O)CNCCCCc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819091874	EG	On-Demand	Mild	ADRB1	41	40
N#Cc1ccc([C@H](O)CNCCCCc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819091874	EG	On-Demand	Mild	ADRB3	50	40
N#Cc1ccc([C@H](O)CNCCCCc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819091874	EG	On-Demand	Mild	KCNJ1	16	47
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)cc1)[C@H]1C[C@H]1C	ZINC000819091875	IG	On-Demand	Anodyne	CPT1A	48	34
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819091876	IG	On-Demand	Anodyne	CPT1A	48	34
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C2CN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091883	FC	On-Demand	Anodyne	GRIN2B	19	42
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C2CN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091883	FC	On-Demand	Anodyne	CTSK	20	41
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C2CN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091883	FC	On-Demand	Anodyne	CTSL	25	41
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C2CN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091883	FC	On-Demand	Anodyne	PREP	25	41
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C2CN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091883	FC	On-Demand	Anodyne	TGM2	52	46
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C2CN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091883	FC	On-Demand	Anodyne	F13A1	54	46
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C2CN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091883	FC	On-Demand	Anodyne	SLC12A5	48	33
C[C@@H](Cc1cccs1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819091902	FG	On-Demand	Mild	PAPA1_CARPA	55	66
C[C@@H](Cc1cccs1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819091902	FG	On-Demand	Mild	CTSK	19	44
C[C@@H](Cc1cccs1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819091902	FG	On-Demand	Mild	CTSL	18	47
C[C@@H](Cc1cccs1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819091902	FG	On-Demand	Mild	CTSS	15	66
C[C@@H](Cc1cccs1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819091902	FG	On-Demand	Mild	CTSC	39	43
C[C@@H](Cc1cccs1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819091902	FG	On-Demand	Mild	FPR1	51	43
C[C@@H](Cc1cccs1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819091905	FG	On-Demand	Mild	PAPA1_CARPA	55	66
C[C@@H](Cc1cccs1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819091905	FG	On-Demand	Mild	CTSK	19	44
C[C@@H](Cc1cccs1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819091905	FG	On-Demand	Mild	CTSL	18	47
C[C@@H](Cc1cccs1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819091905	FG	On-Demand	Mild	CTSS	15	66
C[C@@H](Cc1cccs1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819091905	FG	On-Demand	Mild	CTSC	39	43
C[C@@H](Cc1cccs1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819091905	FG	On-Demand	Mild	FPR1	51	43
O[C@@H](CNCC1(c2cccc(Cl)c2)CC1)c1cccc(F)c1	ZINC000819091911	DH	On-Demand	Anodyne	ADRB3	37	40
O[C@H](CNCC1(c2cccc(Cl)c2)CC1)c1cccc(F)c1	ZINC000819091912	DH	On-Demand	Anodyne	ADRB3	37	40
Cc1oc(-c2ccccc2)nc1CC(=O)Oc1ccccc1C(=O)N1CCOCC1	ZINC000819091916	HG	On-Demand	Anodyne	PPARG	89	49
Cc1oc(-c2ccccc2)nc1CC(=O)Oc1ccccc1C(=O)N1CCOCC1	ZINC000819091916	HG	On-Demand	Anodyne	PPARA	95	43
Cc1oc(-c2ccccc2)nc1CC(=O)Oc1ccccc1C(=O)N1CCOCC1	ZINC000819091916	HG	On-Demand	Anodyne	PDE8B	64	41
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091922	GD	On-Demand	Anodyne	ACE	31	41
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091922	GD	On-Demand	Anodyne	SLC6A1	50	38
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091922	GD	On-Demand	Anodyne	CELA1	19	40
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091922	GD	On-Demand	Anodyne	GRIN2B	21	42
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091922	GD	On-Demand	Anodyne	CTSK	16	41
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091922	GD	On-Demand	Anodyne	PREP	49	49
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091922	GD	On-Demand	Anodyne	TGM2	51	47
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091922	GD	On-Demand	Anodyne	F13A1	51	47
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091922	GD	On-Demand	Anodyne	CCR8	35	42
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091922	GD	On-Demand	Anodyne	SFRP1	83	34
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091922	GD	On-Demand	Anodyne	WNT3	56	33
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091922	GD	On-Demand	Anodyne	SLC12A5	59	35
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091924	GD	On-Demand	Anodyne	ACE	31	41
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091924	GD	On-Demand	Anodyne	SLC6A1	50	38
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091924	GD	On-Demand	Anodyne	CELA1	19	40
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091924	GD	On-Demand	Anodyne	GRIN2B	21	42
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091924	GD	On-Demand	Anodyne	CTSK	16	41
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091924	GD	On-Demand	Anodyne	PREP	49	49
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091924	GD	On-Demand	Anodyne	TGM2	51	47
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091924	GD	On-Demand	Anodyne	F13A1	51	47
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091924	GD	On-Demand	Anodyne	CCR8	35	42
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091924	GD	On-Demand	Anodyne	SFRP1	83	34
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091924	GD	On-Demand	Anodyne	WNT3	56	33
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)C1	ZINC000819091924	GD	On-Demand	Anodyne	SLC12A5	59	35
O=C1OCc2ccc(S(=O)(=O)N[C@@H]3C[C@@H](C(=O)O)C3)cc21	ZINC000819091938	DC	On-Demand	Anodyne	SFRP1	61	32
O[C@@H](CNCC1(c2cccc(F)c2)CC1)c1cccnc1	ZINC000819091940	CF	On-Demand	Anodyne	ADRB2	18	44
O[C@@H](CNCC1(c2cccc(F)c2)CC1)c1cccnc1	ZINC000819091940	CF	On-Demand	Anodyne	ADRB1	20	44
O[C@@H](CNCC1(c2cccc(F)c2)CC1)c1cccnc1	ZINC000819091940	CF	On-Demand	Anodyne	ADRB3	77	46
O[C@H](CNCC1(c2cccc(F)c2)CC1)c1cccnc1	ZINC000819091942	CF	On-Demand	Anodyne	ADRB2	18	44
O[C@H](CNCC1(c2cccc(F)c2)CC1)c1cccnc1	ZINC000819091942	CF	On-Demand	Anodyne	ADRB1	20	44
O[C@H](CNCC1(c2cccc(F)c2)CC1)c1cccnc1	ZINC000819091942	CF	On-Demand	Anodyne	ADRB3	77	46
C[C@@H](Cc1cccs1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819091949	DF	On-Demand	Anodyne	PAPA1_CARPA	28	51
C[C@@H](Cc1cccs1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819091949	DF	On-Demand	Anodyne	FPR1	42	33
O[C@@H](CNCC1(c2cccs2)CCCCC1)c1cccnc1	ZINC000819091954	DH	On-Demand	Anodyne	ADRB2	20	40
O[C@@H](CNCC1(c2cccs2)CCCCC1)c1cccnc1	ZINC000819091954	DH	On-Demand	Anodyne	ADRB1	22	40
O[C@@H](CNCC1(c2cccs2)CCCCC1)c1cccnc1	ZINC000819091954	DH	On-Demand	Anodyne	ADRB3	87	42
O[C@H](CNCC1(c2cccs2)CCCCC1)c1cccnc1	ZINC000819091955	DH	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNCC1(c2cccs2)CCCCC1)c1cccnc1	ZINC000819091955	DH	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CNCC1(c2cccs2)CCCCC1)c1cccnc1	ZINC000819091955	DH	On-Demand	Anodyne	ADRB3	87	42
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2ccccc2)cc1	ZINC000819091964	DG	On-Demand	Bother	ADRB2	75	52
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2ccccc2)cc1	ZINC000819091964	DG	On-Demand	Bother	ADRB1	88	47
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2ccccc2)cc1	ZINC000819091964	DG	On-Demand	Bother	ADRB3	132	47
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2ccccc2)cc1	ZINC000819091966	DG	On-Demand	Bother	ADRB2	75	52
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2ccccc2)cc1	ZINC000819091966	DG	On-Demand	Bother	ADRB1	88	47
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2ccccc2)cc1	ZINC000819091966	DG	On-Demand	Bother	ADRB3	132	47
Cc1nccc(-c2cccc(NC(=O)/C=C/[C@H]3CCCO3)c2)n1	ZINC000819091968	DG	On-Demand	Anodyne	MAPK9	20	40
Cc1nccc(-c2cccc(NC(=O)/C=C/[C@H]3CCCO3)c2)n1	ZINC000819091968	DG	On-Demand	Anodyne	MAPK10	18	40
Cc1nccc(-c2cccc(NC(=O)/C=C\[C@@H]3CCCO3)c2)n1	ZINC000819091970	DG	On-Demand	Anodyne	MAPK9	20	40
Cc1nccc(-c2cccc(NC(=O)/C=C\[C@@H]3CCCO3)c2)n1	ZINC000819091970	DG	On-Demand	Anodyne	MAPK10	18	40
Cc1nccc(-c2cccc(NC(=O)/C=C/[C@@H]3CCCO3)c2)n1	ZINC000819091972	DG	On-Demand	Anodyne	MAPK9	20	40
Cc1nccc(-c2cccc(NC(=O)/C=C/[C@@H]3CCCO3)c2)n1	ZINC000819091972	DG	On-Demand	Anodyne	MAPK10	18	40
Cc1nccc(-c2cccc(NC(=O)/C=C\[C@H]3CCCO3)c2)n1	ZINC000819091973	DG	On-Demand	Anodyne	MAPK9	20	40
Cc1nccc(-c2cccc(NC(=O)/C=C\[C@H]3CCCO3)c2)n1	ZINC000819091973	DG	On-Demand	Anodyne	MAPK10	18	40
CC(=O)N(c1ccc(NC(=O)CCN2CCOCC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819091978	EE	On-Demand	Anodyne	EPHX2	25	42
CC(=O)N(c1ccc(NC(=O)CCN2CCOCC2)cc1)[C@H]1C[C@H]1C	ZINC000819091980	EE	On-Demand	Anodyne	EPHX2	25	42
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091981	GD	On-Demand	Anodyne	ACE	33	44
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091981	GD	On-Demand	Anodyne	FKBP1A	43	41
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091981	GD	On-Demand	Anodyne	CELA1	21	47
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091981	GD	On-Demand	Anodyne	CTRA_BOVIN	52	31
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091981	GD	On-Demand	Anodyne	TRY1_BOVIN	47	33
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091981	GD	On-Demand	Anodyne	CTSG	40	31
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091981	GD	On-Demand	Anodyne	DPP4	15	40
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091981	GD	On-Demand	Anodyne	PREP	58	47
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091981	GD	On-Demand	Anodyne	CELA2A	40	31
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091981	GD	On-Demand	Anodyne	LGMN	74	43
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091981	GD	On-Demand	Anodyne	TGM2	30	40
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091981	GD	On-Demand	Anodyne	KLK5	24	42
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091981	GD	On-Demand	Anodyne	F13A1	37	40
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091981	GD	On-Demand	Anodyne	SLC12A5	59	35
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091981	GD	On-Demand	Anodyne	TMPRSS11D	63	37
CC(=O)N(c1ccc(NC(=O)CCN2CCOCC2)cc1)[C@H]1C[C@@H]1C	ZINC000819091982	EE	On-Demand	Anodyne	EPHX2	25	42
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091983	GD	On-Demand	Anodyne	ACE	33	44
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091983	GD	On-Demand	Anodyne	FKBP1A	43	41
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091983	GD	On-Demand	Anodyne	CELA1	21	47
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091983	GD	On-Demand	Anodyne	CTRA_BOVIN	52	31
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091983	GD	On-Demand	Anodyne	TRY1_BOVIN	47	33
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091983	GD	On-Demand	Anodyne	CTSG	40	31
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091983	GD	On-Demand	Anodyne	DPP4	15	40
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091983	GD	On-Demand	Anodyne	PREP	58	47
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091983	GD	On-Demand	Anodyne	CELA2A	40	31
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091983	GD	On-Demand	Anodyne	LGMN	74	43
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091983	GD	On-Demand	Anodyne	TGM2	30	40
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091983	GD	On-Demand	Anodyne	KLK5	24	42
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091983	GD	On-Demand	Anodyne	F13A1	37	40
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091983	GD	On-Demand	Anodyne	SLC12A5	59	35
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)C[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819091983	GD	On-Demand	Anodyne	TMPRSS11D	63	37
CC(=O)N(c1ccc(NC(=O)CCN2CCOCC2)cc1)[C@@H]1C[C@H]1C	ZINC000819091984	EE	On-Demand	Anodyne	EPHX2	25	42
CC(=O)N(c1ccc(NC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)cc1)[C@@H]1C[C@H]1C	ZINC000819091986	IE	On-Demand	Anodyne	KCNA3	29	45
CC(=O)N(c1ccc(NC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)cc1)[C@@H]1C[C@@H]1C	ZINC000819091987	IE	On-Demand	Anodyne	KCNA3	29	45
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2cc(Br)ccc2[N+](=O)[O-])C1	ZINC000819091988	GD	On-Demand	Bother	SFRP1	61	32
CC(=O)N(c1ccc(NC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)cc1)[C@H]1C[C@H]1C	ZINC000819091989	IE	On-Demand	Anodyne	KCNA3	29	45
CC(=O)N(c1ccc(NC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)cc1)[C@H]1C[C@@H]1C	ZINC000819091991	IE	On-Demand	Anodyne	KCNA3	29	45
CC(=O)N(c1ccc(NC(=O)c2ccc(-n3ccnc3S)cc2)cc1)[C@@H]1C[C@H]1C	ZINC000819091993	HI	On-Demand	Anodyne	PRNP	53	36
CC(=O)N(c1ccc(NC(=O)c2ccc(-n3ccnc3S)cc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819091995	HI	On-Demand	Anodyne	PRNP	53	36
CC(=O)N(c1ccc(NC(=O)c2ccc(-n3ccnc3S)cc2)cc1)[C@H]1C[C@H]1C	ZINC000819091997	HI	On-Demand	Anodyne	PRNP	53	36
CC(=O)N(c1ccc(NC(=O)c2ccc(-n3ccnc3S)cc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092000	HI	On-Demand	Anodyne	PRNP	53	36
O=C(NCC(=O)Oc1ccccc1C(=O)N1CCOCC1)Nc1ccccc1	ZINC000819092007	GD	On-Demand	Anodyne	PIK3CA	24	40
O=C(NCC(=O)Oc1ccccc1C(=O)N1CCOCC1)Nc1ccccc1	ZINC000819092007	GD	On-Demand	Anodyne	MTOR	47	40
O=C(NCC(=O)Oc1ccccc1C(=O)N1CCOCC1)Nc1ccccc1	ZINC000819092007	GD	On-Demand	Anodyne	EPHX2	34	55
O=C(NCC(=O)Oc1ccccc1C(=O)N1CCOCC1)Nc1ccccc1	ZINC000819092007	GD	On-Demand	Anodyne	PIK3CG	20	40
O=C(NCC(=O)Oc1ccccc1C(=O)N1CCOCC1)Nc1ccccc1	ZINC000819092007	GD	On-Demand	Anodyne	HCN1	57	37
Cc1ccccc1[C@@H](O)CNCCCCc1ccc([N+](=O)[O-])cc1	ZINC000819092008	EH	On-Demand	Bother	ADRB2	52	41
Cc1ccccc1[C@@H](O)CNCCCCc1ccc([N+](=O)[O-])cc1	ZINC000819092008	EH	On-Demand	Bother	ADRB1	45	42
Cc1ccccc1[C@@H](O)CNCCCCc1ccc([N+](=O)[O-])cc1	ZINC000819092008	EH	On-Demand	Bother	ADRB3	46	42
C[C@@H](Cc1cccs1)NC(=O)C(F)=C1CCC1	ZINC000819092016	CG	On-Demand	Anodyne	CTSC	39	41
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1	ZINC000819092025	EJ	On-Demand	Mild	HDAC10	24	42
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1	ZINC000819092025	EJ	On-Demand	Mild	HDAC2	17	42
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1	ZINC000819092025	EJ	On-Demand	Mild	HDAC3	20	41
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1	ZINC000819092025	EJ	On-Demand	Mild	ENPP2	34	48
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1	ZINC000819092025	EJ	On-Demand	Mild	LASR	41	33
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1	ZINC000819092026	EJ	On-Demand	Mild	HDAC10	24	42
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1	ZINC000819092026	EJ	On-Demand	Mild	HDAC2	17	42
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1	ZINC000819092026	EJ	On-Demand	Mild	HDAC3	20	41
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1	ZINC000819092026	EJ	On-Demand	Mild	ENPP2	34	48
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1	ZINC000819092026	EJ	On-Demand	Mild	LASR	41	33
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1	ZINC000819092027	EJ	On-Demand	Mild	HDAC10	24	42
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1	ZINC000819092027	EJ	On-Demand	Mild	HDAC2	17	42
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1	ZINC000819092027	EJ	On-Demand	Mild	HDAC3	20	41
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1	ZINC000819092027	EJ	On-Demand	Mild	ENPP2	34	48
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1	ZINC000819092027	EJ	On-Demand	Mild	LASR	41	33
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1	ZINC000819092028	EJ	On-Demand	Mild	HDAC10	24	42
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1	ZINC000819092028	EJ	On-Demand	Mild	HDAC2	17	42
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1	ZINC000819092028	EJ	On-Demand	Mild	HDAC3	20	41
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1	ZINC000819092028	EJ	On-Demand	Mild	ENPP2	34	48
CCCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1	ZINC000819092028	EJ	On-Demand	Mild	LASR	41	33
CC(=O)N(c1ccc(NC(=O)c2cnc(Cl)c(Cl)c2)cc1)[C@H]1C[C@H]1C	ZINC000819092037	GI	On-Demand	Anodyne	TYK2	44	36
CC(=O)N(c1ccc(NC(=O)c2cnc(Cl)c(Cl)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092038	GI	On-Demand	Anodyne	TYK2	44	36
CC(=O)N(c1ccc(NC(=O)c2cnc(Cl)c(Cl)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819092039	GI	On-Demand	Anodyne	TYK2	44	36
CC(=O)N(c1ccc(NC(=O)c2cnc(Cl)c(Cl)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819092040	GI	On-Demand	Anodyne	TYK2	44	36
CC(=O)N(c1ccc(NC(=O)[C@H](F)C2CN(C(=O)OC(C)(C)C)C2)cc1)[C@H]1C[C@@H]1C	ZINC000819092041	HH	On-Demand	Anodyne	F13A1	15	40
CC(=O)N(c1ccc(NC(=O)[C@H](F)C2CN(C(=O)OC(C)(C)C)C2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092042	HH	On-Demand	Anodyne	F13A1	15	40
CC(=O)N(c1ccc(NC(=O)[C@H](F)C2CN(C(=O)OC(C)(C)C)C2)cc1)[C@@H]1C[C@H]1C	ZINC000819092043	HH	On-Demand	Anodyne	F13A1	15	40
CC(=O)N(c1ccc(NC(=O)[C@H](F)C2CN(C(=O)OC(C)(C)C)C2)cc1)[C@H]1C[C@H]1C	ZINC000819092044	HH	On-Demand	Anodyne	F13A1	15	40
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2ccc3nc(Cl)cnc3c2)C1	ZINC000819092046	ED	On-Demand	Anodyne	PLAU	15	40
CC(=O)N(c1ccc(NC(=O)C2=NN(Cc3ccc(F)cc3)C(=O)CC2)cc1)[C@@H]1C[C@H]1C	ZINC000819092050	IH	On-Demand	Anodyne	MLNR	40	34
CC(=O)N(c1ccc(NC(=O)C2=NN(Cc3ccc(F)cc3)C(=O)CC2)cc1)[C@H]1C[C@@H]1C	ZINC000819092052	IH	On-Demand	Anodyne	MLNR	40	34
CC(=O)N(c1ccc(NC(=O)C2=NN(Cc3ccc(F)cc3)C(=O)CC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092054	IH	On-Demand	Anodyne	MLNR	40	34
CC(=O)N(c1ccc(NC(=O)C2=NN(Cc3ccc(F)cc3)C(=O)CC2)cc1)[C@H]1C[C@H]1C	ZINC000819092056	IH	On-Demand	Anodyne	MLNR	40	34
COC(=O)c1ccc(Br)c(S(=O)(=O)N[C@@H]2C[C@@H](C(=O)O)C2)c1	ZINC000819092058	GD	On-Demand	Anodyne	SFRP1	40	35
O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819092063	II	On-Demand	Bother	SLC6A9	16	51
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	ACE	17	41
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	CELA1	15	47
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	MME	15	41
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	CASP3	15	45
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	KLK3	73	36
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	CTSB	61	45
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	PAPA1_CARPA	71	37
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	CYSP_TRYCR	48	38
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	CTSK	39	48
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	CTSL	46	39
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	TIMP3	63	36
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	CAPNS1	68	40
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	CTSS	18	44
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	CAPN1	80	43
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	CASP1	25	41
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	CAPN2	125	39
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	PLAU	31	41
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	NPR	75	39
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	PSMB5	47	42
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	KDM1A	15	48
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092071	HH	On-Demand	Anodyne	Q6PRC7_IXORI	48	40
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	ACE	17	41
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	CELA1	15	47
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	MME	15	41
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	CASP3	15	45
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	KLK3	73	36
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	CTSB	61	45
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	PAPA1_CARPA	71	37
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	CYSP_TRYCR	48	38
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	CTSK	39	48
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	CTSL	46	39
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	TIMP3	63	36
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	CAPNS1	68	40
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	CTSS	18	44
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	CAPN1	80	43
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	CASP1	25	41
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	CAPN2	125	39
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	PLAU	31	41
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	NPR	75	39
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	PSMB5	47	42
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	KDM1A	15	48
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092072	HH	On-Demand	Anodyne	Q6PRC7_IXORI	48	40
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	ACE	17	41
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	CELA1	15	47
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	MME	15	41
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	CASP3	15	45
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	KLK3	73	36
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	CTSB	61	45
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	PAPA1_CARPA	71	37
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	CYSP_TRYCR	48	38
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	CTSK	39	48
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	CTSL	46	39
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	TIMP3	63	36
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	CAPNS1	68	40
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	CTSS	18	44
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	CAPN1	80	43
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	CASP1	25	41
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	CAPN2	125	39
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	PLAU	31	41
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	NPR	75	39
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	PSMB5	47	42
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	KDM1A	15	48
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092073	HH	On-Demand	Anodyne	Q6PRC7_IXORI	48	40
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	ACE	17	41
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	CELA1	15	47
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	MME	15	41
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	CASP3	15	45
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	KLK3	73	36
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	CTSB	61	45
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	PAPA1_CARPA	71	37
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	CYSP_TRYCR	48	38
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	CTSK	39	48
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	CTSL	46	39
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	TIMP3	63	36
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	CAPNS1	68	40
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	CTSS	18	44
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	CAPN1	80	43
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	CASP1	25	41
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	CAPN2	125	39
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	PLAU	31	41
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	NPR	75	39
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	PSMB5	47	42
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	KDM1A	15	48
CC(=O)N(c1ccc(NC(=O)[C@H](C)NC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092074	HH	On-Demand	Anodyne	Q6PRC7_IXORI	48	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)[C@H]1C[C@@H]1C	ZINC000819092075	HH	On-Demand	Anodyne	GPR119	29	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)[C@@H]1C[C@H]1C	ZINC000819092076	HH	On-Demand	Anodyne	GPR119	29	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)[C@H]1C[C@H]1C	ZINC000819092077	HH	On-Demand	Anodyne	GPR119	29	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092078	HH	On-Demand	Anodyne	GPR119	29	40
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1	ZINC000819092081	ED	On-Demand	Bother	SFRP1	73	36
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])C1	ZINC000819092081	ED	On-Demand	Bother	WNT3	48	32
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2cccnc2)cc1	ZINC000819092082	DF	On-Demand	Bother	ADRB2	59	53
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2cccnc2)cc1	ZINC000819092082	DF	On-Demand	Bother	ADRB1	70	52
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2cccnc2)cc1	ZINC000819092082	DF	On-Demand	Bother	ADRB3	161	53
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819092083	DF	On-Demand	Bother	ADRB2	59	53
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819092083	DF	On-Demand	Bother	ADRB1	70	52
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819092083	DF	On-Demand	Bother	ADRB3	161	53
O=C(Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)Oc1ccccc1C(=O)N1CCOCC1	ZINC000819092095	JI	On-Demand	Anodyne	MTTP	29	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccnc1OCC(F)(F)F	ZINC000819092153	GF	On-Demand	Anodyne	SCN10A	23	46
CON(C)C(=O)CCNCCCCc1ccc([N+](=O)[O-])cc1	ZINC000819092157	DD	On-Demand	Bother	MMP8	23	41
CON(C)C(=O)CCNCCCCc1ccc([N+](=O)[O-])cc1	ZINC000819092157	DD	On-Demand	Bother	MMP1	18	41
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819092159	EG	On-Demand	Bother	ADRB2	55	44
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819092159	EG	On-Demand	Bother	ADRB1	47	41
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819092159	EG	On-Demand	Bother	ADRB3	66	39
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819092159	EG	On-Demand	Bother	LEF	50	41
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819092160	EG	On-Demand	Bother	ADRB2	55	44
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819092160	EG	On-Demand	Bother	ADRB1	47	41
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819092160	EG	On-Demand	Bother	ADRB3	66	39
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819092160	EG	On-Demand	Bother	LEF	50	41
O=C(NCCS(=O)(=O)N[C@@H]1C[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819092176	FC	On-Demand	Anodyne	CAPNS1	51	34
O=C(NCCS(=O)(=O)N[C@@H]1C[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819092176	FC	On-Demand	Anodyne	CAPN1	44	38
O=C(NCCS(=O)(=O)N[C@@H]1C[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819092176	FC	On-Demand	Anodyne	CAPN2	72	36
O=C(NCCS(=O)(=O)N[C@@H]1C[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819092176	FC	On-Demand	Anodyne	NPR	62	35
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(S(F)(F)(F)(F)F)cc2)C1	ZINC000819092177	GG	On-Demand	Reactive	SFRP1	63	33
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1)[C@@H]1C[C@H]1C	ZINC000819092239	II	On-Demand	Anodyne	GRIN2B	22	45
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1)[C@@H]1C[C@H]1C	ZINC000819092239	II	On-Demand	Anodyne	TGM2	42	45
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1)[C@@H]1C[C@H]1C	ZINC000819092239	II	On-Demand	Anodyne	F13A1	65	45
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1)[C@H]1C[C@H]1C	ZINC000819092240	II	On-Demand	Anodyne	GRIN2B	22	45
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1)[C@H]1C[C@H]1C	ZINC000819092240	II	On-Demand	Anodyne	TGM2	42	45
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1)[C@H]1C[C@H]1C	ZINC000819092240	II	On-Demand	Anodyne	F13A1	65	45
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092241	II	On-Demand	Anodyne	GRIN2B	22	45
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092241	II	On-Demand	Anodyne	TGM2	42	45
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092241	II	On-Demand	Anodyne	F13A1	65	45
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1)[C@H]1C[C@@H]1C	ZINC000819092242	II	On-Demand	Anodyne	GRIN2B	22	45
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1)[C@H]1C[C@@H]1C	ZINC000819092242	II	On-Demand	Anodyne	TGM2	42	45
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)cc1)[C@H]1C[C@@H]1C	ZINC000819092242	II	On-Demand	Anodyne	F13A1	65	45
CC(=O)N(c1ccc(NC(=O)CCC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092272	IJ	On-Demand	Anodyne	F13A1	20	41
CC(=O)N(c1ccc(NC(=O)CCC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092272	IJ	On-Demand	Anodyne	GPR119	43	46
CC(=O)N(c1ccc(NC(=O)CCC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@@H]1C	ZINC000819092273	IJ	On-Demand	Anodyne	F13A1	20	41
CC(=O)N(c1ccc(NC(=O)CCC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@@H]1C	ZINC000819092273	IJ	On-Demand	Anodyne	GPR119	43	46
CC(=O)N(c1ccc(NC(=O)CCC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@H]1C	ZINC000819092274	IJ	On-Demand	Anodyne	F13A1	20	41
CC(=O)N(c1ccc(NC(=O)CCC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@H]1C	ZINC000819092274	IJ	On-Demand	Anodyne	GPR119	43	46
CC(=O)N(c1ccc(NC(=O)CCC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@H]1C	ZINC000819092275	IJ	On-Demand	Anodyne	F13A1	20	41
CC(=O)N(c1ccc(NC(=O)CCC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@H]1C	ZINC000819092275	IJ	On-Demand	Anodyne	GPR119	43	46
O=C1[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)CCN1c1ccc(Cl)cc1	ZINC000819092301	FG	On-Demand	Anodyne	F10	15	41
O=C1[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)CCN1c1ccc(Cl)cc1	ZINC000819092301	FG	On-Demand	Anodyne	ADRB3	23	40
O=C1[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)CCN1c1ccc(Cl)cc1	ZINC000819092302	FG	On-Demand	Anodyne	F10	15	41
O=C1[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)CCN1c1ccc(Cl)cc1	ZINC000819092302	FG	On-Demand	Anodyne	ADRB3	23	40
O=C1[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)CCN1c1ccc(Cl)cc1	ZINC000819092303	FG	On-Demand	Anodyne	F10	15	41
O=C1[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)CCN1c1ccc(Cl)cc1	ZINC000819092303	FG	On-Demand	Anodyne	ADRB3	23	40
O=C1[C@H](NC[C@H](O)c2ccc(F)c(F)c2)CCN1c1ccc(Cl)cc1	ZINC000819092304	FG	On-Demand	Anodyne	F10	15	41
O=C1[C@H](NC[C@H](O)c2ccc(F)c(F)c2)CCN1c1ccc(Cl)cc1	ZINC000819092304	FG	On-Demand	Anodyne	ADRB3	23	40
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2cccc3ncccc23)C1	ZINC000819092325	DD	On-Demand	Anodyne	CCR8	65	39
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819092338	GF	On-Demand	Bother	ADRB2	53	56
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819092338	GF	On-Demand	Bother	ADRB1	52	46
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819092338	GF	On-Demand	Bother	ADRB3	98	42
CS(=O)(=O)c1ccc([C@H](O)CNCCCCc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819092339	GF	On-Demand	Bother	ADRB2	53	56
CS(=O)(=O)c1ccc([C@H](O)CNCCCCc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819092339	GF	On-Demand	Bother	ADRB1	52	46
CS(=O)(=O)c1ccc([C@H](O)CNCCCCc2ccc([N+](=O)[O-])cc2)cc1	ZINC000819092339	GF	On-Demand	Bother	ADRB3	98	42
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2cccc3c2CCCC3)C1	ZINC000819092340	DD	On-Demand	Anodyne	SFRP1	51	34
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819092346	GF	On-Demand	Anodyne	ITGAL	57	33
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819092346	GF	On-Demand	Anodyne	RBP4	89	44
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819092346	GF	On-Demand	Anodyne	SCD1	25	47
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819092346	GF	On-Demand	Anodyne	SCD	24	43
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819092347	GF	On-Demand	Anodyne	ITGAL	57	33
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819092347	GF	On-Demand	Anodyne	RBP4	89	44
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819092347	GF	On-Demand	Anodyne	SCD1	25	47
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819092347	GF	On-Demand	Anodyne	SCD	24	43
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819092348	GF	On-Demand	Anodyne	ITGAL	57	33
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819092348	GF	On-Demand	Anodyne	RBP4	89	44
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819092348	GF	On-Demand	Anodyne	SCD1	25	47
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819092348	GF	On-Demand	Anodyne	SCD	24	43
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819092349	GF	On-Demand	Anodyne	ITGAL	57	33
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819092349	GF	On-Demand	Anodyne	RBP4	89	44
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819092349	GF	On-Demand	Anodyne	SCD1	25	47
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819092349	GF	On-Demand	Anodyne	SCD	24	43
COC(=O)c1c(F)ccc(S(=O)(=O)N[C@@H]2C[C@@H](C(=O)O)C2)c1F	ZINC000819092354	EC	On-Demand	Anodyne	SFRP1	61	34
O[C@@H](CNCC1(c2cccc(F)c2)CC1)c1ccccc1Cl	ZINC000819092356	DH	On-Demand	Anodyne	OPRL1	19	41
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(NC(=O)C(F)(F)F)cc2)C1	ZINC000819092375	FD	On-Demand	Anodyne	IDO1	36	40
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(NC(=O)C(F)(F)F)cc2)C1	ZINC000819092375	FD	On-Demand	Anodyne	SFRP1	110	35
O=C(O)[C@@H]1C[C@@H](NS(=O)(=O)c2ccc(NC(=O)C(F)(F)F)cc2)C1	ZINC000819092375	FD	On-Demand	Anodyne	WNT3	69	34
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1	ZINC000819092421	II	On-Demand	Anodyne	PAPA1_CARPA	31	46
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1	ZINC000819092421	II	On-Demand	Anodyne	FPR1	42	44
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1	ZINC000819092422	II	On-Demand	Anodyne	PAPA1_CARPA	31	46
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1	ZINC000819092422	II	On-Demand	Anodyne	FPR1	42	44
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1	ZINC000819092423	II	On-Demand	Anodyne	PAPA1_CARPA	31	46
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1	ZINC000819092423	II	On-Demand	Anodyne	FPR1	42	44
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1	ZINC000819092424	II	On-Demand	Anodyne	PAPA1_CARPA	31	46
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1	ZINC000819092424	II	On-Demand	Anodyne	FPR1	42	44
CC(=O)N(c1ccc(NC(=O)c2cccc(C3OCCO3)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819092441	GH	On-Demand	Anodyne	KCNK3	57	35
CC(=O)N(c1ccc(NC(=O)c2cccc(C3OCCO3)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092442	GH	On-Demand	Anodyne	KCNK3	57	35
CC(=O)N(c1ccc(NC(=O)c2cccc(C3OCCO3)c2)cc1)[C@H]1C[C@H]1C	ZINC000819092443	GH	On-Demand	Anodyne	KCNK3	57	35
CC(=O)N(c1ccc(NC(=O)c2cccc(C3OCCO3)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819092444	GH	On-Demand	Anodyne	KCNK3	57	35
CC(=O)N(c1ccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)cc1)[C@@H]1C[C@@H]1C	ZINC000819092445	IK	On-Demand	Anodyne	TACR3	24	44
CC(=O)N(c1ccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)cc1)[C@H]1C[C@@H]1C	ZINC000819092446	IK	On-Demand	Anodyne	TACR3	24	44
CC(=O)N(c1ccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)cc1)[C@H]1C[C@H]1C	ZINC000819092447	IK	On-Demand	Anodyne	TACR3	24	44
CC(=O)N(c1ccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)cc1)[C@@H]1C[C@H]1C	ZINC000819092448	IK	On-Demand	Anodyne	TACR3	24	44
COc1ccc2c(C)c(CCC(=O)Nc3ccc(N(C(C)=O)[C@H]4C[C@H]4C)cc3)c(=O)oc2c1	ZINC000819092478	II	On-Demand	Anodyne	MAOB	27	41
COc1ccc2c(C)c(CCC(=O)Nc3ccc(N(C(C)=O)[C@H]4C[C@H]4C)cc3)c(=O)oc2c1	ZINC000819092478	II	On-Demand	Anodyne	MTNR1A	20	40
COc1ccc2c(C)c(CCC(=O)Nc3ccc(N(C(C)=O)[C@H]4C[C@H]4C)cc3)c(=O)oc2c1	ZINC000819092478	II	On-Demand	Anodyne	MTNR1B	23	40
COc1ccc2c(C)c(CCC(=O)Nc3ccc(N(C(C)=O)[C@@H]4C[C@H]4C)cc3)c(=O)oc2c1	ZINC000819092479	II	On-Demand	Anodyne	MAOB	27	41
COc1ccc2c(C)c(CCC(=O)Nc3ccc(N(C(C)=O)[C@@H]4C[C@H]4C)cc3)c(=O)oc2c1	ZINC000819092479	II	On-Demand	Anodyne	MTNR1A	20	40
COc1ccc2c(C)c(CCC(=O)Nc3ccc(N(C(C)=O)[C@@H]4C[C@H]4C)cc3)c(=O)oc2c1	ZINC000819092479	II	On-Demand	Anodyne	MTNR1B	23	40
COc1ccc2c(C)c(CCC(=O)Nc3ccc(N(C(C)=O)[C@@H]4C[C@@H]4C)cc3)c(=O)oc2c1	ZINC000819092480	II	On-Demand	Anodyne	MAOB	27	41
COc1ccc2c(C)c(CCC(=O)Nc3ccc(N(C(C)=O)[C@@H]4C[C@@H]4C)cc3)c(=O)oc2c1	ZINC000819092480	II	On-Demand	Anodyne	MTNR1A	20	40
COc1ccc2c(C)c(CCC(=O)Nc3ccc(N(C(C)=O)[C@@H]4C[C@@H]4C)cc3)c(=O)oc2c1	ZINC000819092480	II	On-Demand	Anodyne	MTNR1B	23	40
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819092505	EG	On-Demand	Bother	ADRB2	34	41
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819092505	EG	On-Demand	Bother	ADRB1	34	42
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819092505	EG	On-Demand	Bother	ADRB3	35	42
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2ccccc2F)cc1	ZINC000819092506	EG	On-Demand	Bother	ADRB2	34	41
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2ccccc2F)cc1	ZINC000819092506	EG	On-Demand	Bother	ADRB1	34	42
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2ccccc2F)cc1	ZINC000819092506	EG	On-Demand	Bother	ADRB3	35	42
COc1ccc2c(C)c(CCC(=O)Nc3ccc(N(C(C)=O)[C@H]4C[C@@H]4C)cc3)c(=O)oc2c1	ZINC000819092524	II	On-Demand	Anodyne	MAOB	27	41
COc1ccc2c(C)c(CCC(=O)Nc3ccc(N(C(C)=O)[C@H]4C[C@@H]4C)cc3)c(=O)oc2c1	ZINC000819092524	II	On-Demand	Anodyne	MTNR1A	20	40
COc1ccc2c(C)c(CCC(=O)Nc3ccc(N(C(C)=O)[C@H]4C[C@@H]4C)cc3)c(=O)oc2c1	ZINC000819092524	II	On-Demand	Anodyne	MTNR1B	23	40
CC(=O)N(c1ccc(NC(=O)c2nn(C)c(=O)c3ccccc23)cc1)[C@@H]1C[C@H]1C	ZINC000819092525	GF	On-Demand	Anodyne	IMDH_CRYPV	25	40
CC(=O)N(c1ccc(NC(=O)c2nn(C)c(=O)c3ccccc23)cc1)[C@H]1C[C@@H]1C	ZINC000819092526	GF	On-Demand	Anodyne	IMDH_CRYPV	25	40
CC(=O)N(c1ccc(NC(=O)c2nn(C)c(=O)c3ccccc23)cc1)[C@@H]1C[C@@H]1C	ZINC000819092527	GF	On-Demand	Anodyne	IMDH_CRYPV	25	40
CC(=O)N(c1ccc(NC(=O)c2nn(C)c(=O)c3ccccc23)cc1)[C@H]1C[C@H]1C	ZINC000819092528	GF	On-Demand	Anodyne	IMDH_CRYPV	25	40
C#CCSCCNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819092531	EF	On-Demand	Mild	CYNT	36	47
COc1ccc(OC)c([C@H](O)CNCC2(c3cccc(Cl)c3)CC2)c1	ZINC000819092547	FH	On-Demand	Anodyne	SOAT1	15	41
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)cc1)[C@@H]1C[C@@H]1C	ZINC000819092560	IH	On-Demand	Anodyne	LGMN	79	36
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)cc1)[C@H]1C[C@H]1C	ZINC000819092562	IH	On-Demand	Anodyne	LGMN	79	36
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)cc1)[C@@H]1C[C@H]1C	ZINC000819092564	IH	On-Demand	Anodyne	LGMN	79	36
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)cc1)[C@H]1C[C@@H]1C	ZINC000819092568	IH	On-Demand	Anodyne	LGMN	79	36
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCC2(c3cccc(F)c3)CC2)CC1	ZINC000819092592	GH	On-Demand	Anodyne	GPR119	20	44
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCC2(c3cccc(F)c3)CC2)CC1	ZINC000819092595	GH	On-Demand	Anodyne	GPR119	20	44
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cc3ccccc3o2)cc1	ZINC000819092616	FF	On-Demand	Anodyne	ADRB2	43	41
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cc3ccccc3o2)cc1	ZINC000819092616	FF	On-Demand	Anodyne	ADRB1	40	38
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cc3ccccc3o2)cc1	ZINC000819092616	FF	On-Demand	Anodyne	ADRB3	114	46
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cc3ccccc3o2)cc1	ZINC000819092619	FF	On-Demand	Anodyne	ADRB2	43	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cc3ccccc3o2)cc1	ZINC000819092619	FF	On-Demand	Anodyne	ADRB1	40	38
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cc3ccccc3o2)cc1	ZINC000819092619	FF	On-Demand	Anodyne	ADRB3	114	46
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819092623	FH	On-Demand	Bother	ADRB2	49	43
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819092623	FH	On-Demand	Bother	ADRB1	47	45
O=[N+]([O-])c1ccc(CCCCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819092623	FH	On-Demand	Bother	ADRB3	64	45
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819092626	FH	On-Demand	Bother	ADRB2	49	43
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819092626	FH	On-Demand	Bother	ADRB1	47	45
O=[N+]([O-])c1ccc(CCCCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819092626	FH	On-Demand	Bother	ADRB3	64	45
C[C@H]1C[C@@H](C)C[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819092637	CG	On-Demand	Bother	CACNA1C	55	37
C[C@H]1C[C@@H](C)C[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819092637	CG	On-Demand	Bother	CACNA1D	86	36
C[C@H]1C[C@@H](C)C[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819092643	CG	On-Demand	Bother	CACNA1C	55	37
C[C@H]1C[C@@H](C)C[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819092643	CG	On-Demand	Bother	CACNA1D	86	36
C#CCSCCNC[C@@H](O)c1cccnc1	ZINC000819092646	BD	On-Demand	Mild	ADRB2	24	44
C#CCSCCNC[C@@H](O)c1cccnc1	ZINC000819092646	BD	On-Demand	Mild	ADRB1	26	44
C#CCSCCNC[C@@H](O)c1cccnc1	ZINC000819092646	BD	On-Demand	Mild	ADRB3	96	46
C#CCSCCNC[C@H](O)c1cccnc1	ZINC000819092649	BD	On-Demand	Mild	ADRB2	24	44
C#CCSCCNC[C@H](O)c1cccnc1	ZINC000819092649	BD	On-Demand	Mild	ADRB1	26	44
C#CCSCCNC[C@H](O)c1cccnc1	ZINC000819092649	BD	On-Demand	Mild	ADRB3	96	46
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092675	HI	On-Demand	Anodyne	UL80	23	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092675	HI	On-Demand	Anodyne	PREP	33	44
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819092675	HI	On-Demand	Anodyne	CFTR	58	41
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092678	HI	On-Demand	Anodyne	UL80	23	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092678	HI	On-Demand	Anodyne	PREP	33	44
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092678	HI	On-Demand	Anodyne	CFTR	58	41
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092680	HI	On-Demand	Anodyne	UL80	23	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092680	HI	On-Demand	Anodyne	PREP	33	44
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819092680	HI	On-Demand	Anodyne	CFTR	58	41
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092682	HI	On-Demand	Anodyne	UL80	23	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092682	HI	On-Demand	Anodyne	PREP	33	44
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819092682	HI	On-Demand	Anodyne	CFTR	58	41
CCS(=O)(=O)N1CCN(c2ccc(C(=O)O)cn2)CC1	ZINC000819092695	CC	On-Demand	Anodyne	HDAC1	18	41
CCS(=O)(=O)N1CCN(c2ccc(C(=O)O)cn2)CC1	ZINC000819092695	CC	On-Demand	Anodyne	SORD	25	40
CCS(=O)(=O)N1CCN(c2ccc(C(=O)O)cn2)CC1	ZINC000819092695	CC	On-Demand	Anodyne	HPGDS	15	40
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819092708	GH	On-Demand	Anodyne	ADRB2	37	47
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819092708	GH	On-Demand	Anodyne	ADRB1	40	47
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819092708	GH	On-Demand	Anodyne	ADRB3	29	40
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819092708	GH	On-Demand	Anodyne	ABCB1	22	45
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819092710	GH	On-Demand	Anodyne	ADRB2	37	47
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819092710	GH	On-Demand	Anodyne	ADRB1	40	47
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819092710	GH	On-Demand	Anodyne	ADRB3	29	40
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819092710	GH	On-Demand	Anodyne	ABCB1	22	45
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H]1COc1ccc(Cl)cc1	ZINC000819092720	GH	On-Demand	Anodyne	OPRK1	20	52
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H]1COc1ccc(Cl)cc1	ZINC000819092720	GH	On-Demand	Anodyne	LTA4H	15	52
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H]1COc1ccc(Cl)cc1	ZINC000819092720	GH	On-Demand	Anodyne	CHRNA10	42	46
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H]1COc1ccc(Cl)cc1	ZINC000819092722	GH	On-Demand	Anodyne	OPRK1	20	52
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H]1COc1ccc(Cl)cc1	ZINC000819092722	GH	On-Demand	Anodyne	LTA4H	15	52
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H]1COc1ccc(Cl)cc1	ZINC000819092722	GH	On-Demand	Anodyne	CHRNA10	42	46
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)CC2CCCC2)CC1	ZINC000819092796	EG	On-Demand	Anodyne	ECE1	21	41
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)CC2CCCC2)CC1	ZINC000819092796	EG	On-Demand	Anodyne	REN	39	43
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)CC2CCCC2)CC1	ZINC000819092797	EG	On-Demand	Anodyne	ECE1	21	41
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)CC2CCCC2)CC1	ZINC000819092797	EG	On-Demand	Anodyne	REN	39	43
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092837	HH	On-Demand	Anodyne	CPT1A	55	36
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819092839	HH	On-Demand	Anodyne	CPT1A	55	36
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819092841	HH	On-Demand	Anodyne	CPT1A	55	36
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)cc1)[C@H]1C[C@H]1C	ZINC000819092842	HH	On-Demand	Anodyne	CPT1A	55	36
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(N)(=O)=O)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092898	HE	On-Demand	Anodyne	CPT1A	53	36
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(N)(=O)=O)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819092898	HE	On-Demand	Anodyne	CPT2	41	35
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(N)(=O)=O)c2)cc1)[C@H]1C[C@H]1C	ZINC000819092899	HE	On-Demand	Anodyne	CPT1A	53	36
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(N)(=O)=O)c2)cc1)[C@H]1C[C@H]1C	ZINC000819092899	HE	On-Demand	Anodyne	CPT2	41	35
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(N)(=O)=O)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819092900	HE	On-Demand	Anodyne	CPT1A	53	36
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(N)(=O)=O)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819092900	HE	On-Demand	Anodyne	CPT2	41	35
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(N)(=O)=O)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819092901	HE	On-Demand	Anodyne	CPT1A	53	36
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(N)(=O)=O)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819092901	HE	On-Demand	Anodyne	CPT2	41	35
COc1cccc(C2=NO[C@H](C(=O)Nc3ccc(N(C(C)=O)[C@@H]4C[C@@H]4C)cc3)C2)c1	ZINC000819092963	HH	On-Demand	Anodyne	MTNR1B	16	44
COc1cccc(C2=NO[C@H](C(=O)Nc3ccc(N(C(C)=O)[C@H]4C[C@H]4C)cc3)C2)c1	ZINC000819092964	HH	On-Demand	Anodyne	MTNR1B	16	44
COCCOc1cc(NC(=O)/C=C\[C@H]2CCCO2)ccc1OC	ZINC000819092972	DE	On-Demand	Anodyne	ENPP1	60	32
COCCOc1cc(NC(=O)/C=C/[C@H]2CCCO2)ccc1OC	ZINC000819092973	DE	On-Demand	Anodyne	ENPP1	60	32
COCCOc1cc(NC(=O)/C=C/[C@@H]2CCCO2)ccc1OC	ZINC000819092974	DE	On-Demand	Anodyne	ENPP1	60	32
COCCOc1cc(NC(=O)/C=C\[C@@H]2CCCO2)ccc1OC	ZINC000819092975	DE	On-Demand	Anodyne	ENPP1	60	32
Cc1ccc(OC[C@@H](O)CNC2CCC(NC(=O)OC(C)(C)C)CC2)cc1	ZINC000819093003	GG	On-Demand	Anodyne	ADRB2	39	49
Cc1ccc(OC[C@@H](O)CNC2CCC(NC(=O)OC(C)(C)C)CC2)cc1	ZINC000819093003	GG	On-Demand	Anodyne	ADRB1	49	45
Cc1ccc(OC[C@@H](O)CNC2CCC(NC(=O)OC(C)(C)C)CC2)cc1	ZINC000819093003	GG	On-Demand	Anodyne	ADRB3	33	43
Cc1ccc(OC[C@H](O)CNC2CCC(NC(=O)OC(C)(C)C)CC2)cc1	ZINC000819093004	GG	On-Demand	Anodyne	ADRB2	39	49
Cc1ccc(OC[C@H](O)CNC2CCC(NC(=O)OC(C)(C)C)CC2)cc1	ZINC000819093004	GG	On-Demand	Anodyne	ADRB1	49	45
Cc1ccc(OC[C@H](O)CNC2CCC(NC(=O)OC(C)(C)C)CC2)cc1	ZINC000819093004	GG	On-Demand	Anodyne	ADRB3	33	43
CNC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093026	FD	On-Demand	Mild	F2	33	45
CNC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093026	FD	On-Demand	Mild	PLG	25	45
CNC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093026	FD	On-Demand	Mild	PRSS1	18	45
CNC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093026	FD	On-Demand	Mild	CELA1	55	45
CNC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093026	FD	On-Demand	Mild	HLA-DRB3	62	38
CNC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093026	FD	On-Demand	Mild	CMA1	33	42
CNC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093026	FD	On-Demand	Mild	CTRA_BOVIN	40	31
CNC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093026	FD	On-Demand	Mild	TRY1_BOVIN	55	43
CNC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093026	FD	On-Demand	Mild	NTSR1	65	42
CNC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093026	FD	On-Demand	Mild	LGMN	82	35
CNC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093027	FD	On-Demand	Mild	F2	33	45
CNC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093027	FD	On-Demand	Mild	PLG	25	45
CNC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093027	FD	On-Demand	Mild	PRSS1	18	45
CNC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093027	FD	On-Demand	Mild	CELA1	55	45
CNC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093027	FD	On-Demand	Mild	HLA-DRB3	62	38
CNC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093027	FD	On-Demand	Mild	CMA1	33	42
CNC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093027	FD	On-Demand	Mild	CTRA_BOVIN	40	31
CNC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093027	FD	On-Demand	Mild	TRY1_BOVIN	55	43
CNC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093027	FD	On-Demand	Mild	NTSR1	65	42
CNC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093027	FD	On-Demand	Mild	LGMN	82	35
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819093052	GG	On-Demand	Bother	CACNA1C	47	36
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819093052	GG	On-Demand	Bother	CACNA1D	70	33
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819093053	GG	On-Demand	Bother	CACNA1C	47	36
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819093053	GG	On-Demand	Bother	CACNA1D	70	33
COc1cccc(C2=NO[C@H](C(=O)Nc3ccc(N(C(C)=O)[C@H]4C[C@@H]4C)cc3)C2)c1	ZINC000819093065	HH	On-Demand	Anodyne	MTNR1B	16	44
COc1cccc(C2=NO[C@H](C(=O)Nc3ccc(N(C(C)=O)[C@@H]4C[C@H]4C)cc3)C2)c1	ZINC000819093066	HH	On-Demand	Anodyne	MTNR1B	16	44
CC(=O)N(c1ccc(NC(=O)c2cc3ccccc3oc2=O)cc1)[C@@H]1C[C@H]1C	ZINC000819093071	GH	On-Demand	Anodyne	MAOB	16	61
CC(=O)N(c1ccc(NC(=O)c2cc3ccccc3oc2=O)cc1)[C@H]1C[C@@H]1C	ZINC000819093072	GH	On-Demand	Anodyne	MAOB	16	61
CC(=O)N(c1ccc(NC(=O)c2cc3ccccc3oc2=O)cc1)[C@@H]1C[C@@H]1C	ZINC000819093073	GH	On-Demand	Anodyne	MAOB	16	61
CC(=O)N(c1ccc(NC(=O)c2cc3ccccc3oc2=O)cc1)[C@H]1C[C@H]1C	ZINC000819093074	GH	On-Demand	Anodyne	MAOB	16	61
CC(=O)N(c1ccc(NC(=O)c2c(-c3ccc(F)cc3)noc2C)cc1)[C@H]1C[C@@H]1C	ZINC000819093093	HJ	On-Demand	Anodyne	GPBAR1	15	47
CC(=O)N(c1ccc(NC(=O)c2c(-c3ccc(F)cc3)noc2C)cc1)[C@@H]1C[C@@H]1C	ZINC000819093094	HJ	On-Demand	Anodyne	GPBAR1	15	47
CC(=O)N(c1ccc(NC(=O)c2c(-c3ccc(F)cc3)noc2C)cc1)[C@H]1C[C@H]1C	ZINC000819093095	HJ	On-Demand	Anodyne	GPBAR1	15	47
CC(=O)N(c1ccc(NC(=O)c2c(-c3ccc(F)cc3)noc2C)cc1)[C@@H]1C[C@H]1C	ZINC000819093096	HJ	On-Demand	Anodyne	GPBAR1	15	47
CC(=O)N(c1ccc(NC(=O)[C@@H]2C[C@H]2c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819093145	EI	On-Demand	Anodyne	NAMPT	21	46
CC(=O)N(c1ccc(NC(=O)[C@@H]2C[C@H]2c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819093146	EI	On-Demand	Anodyne	NAMPT	21	46
CC(=O)N(c1ccc(NC(=O)[C@@H]2C[C@H]2c2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819093147	EI	On-Demand	Anodyne	NAMPT	21	46
CC(=O)N(c1ccc(NC(=O)[C@@H]2C[C@H]2c2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819093148	EI	On-Demand	Anodyne	NAMPT	21	46
CC(=O)N(c1ccc(NC(=O)COc2cccc(C#N)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819093149	FG	On-Demand	Mild	ADORA2B	32	40
CC(=O)N(c1ccc(NC(=O)COc2cccc(C#N)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819093149	FG	On-Demand	Mild	MCHR1	26	40
CC(=O)N(c1ccc(NC(=O)COc2cccc(C#N)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819093150	FG	On-Demand	Mild	ADORA2B	32	40
CC(=O)N(c1ccc(NC(=O)COc2cccc(C#N)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819093150	FG	On-Demand	Mild	MCHR1	26	40
CC(=O)N(c1ccc(NC(=O)COc2cccc(C#N)c2)cc1)[C@H]1C[C@H]1C	ZINC000819093151	FG	On-Demand	Mild	ADORA2B	32	40
CC(=O)N(c1ccc(NC(=O)COc2cccc(C#N)c2)cc1)[C@H]1C[C@H]1C	ZINC000819093151	FG	On-Demand	Mild	MCHR1	26	40
CC(=O)N(c1ccc(NC(=O)COc2cccc(C#N)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819093152	FG	On-Demand	Mild	ADORA2B	32	40
CC(=O)N(c1ccc(NC(=O)COc2cccc(C#N)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819093152	FG	On-Demand	Mild	MCHR1	26	40
O=C(c1cc([N+](=O)[O-])ccc1N1CCCC1)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819093157	HI	On-Demand	Bother	SLC6A9	16	49
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819093158	HI	On-Demand	Anodyne	CTSK	23	44
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819093158	HI	On-Demand	Anodyne	TIMP3	40	34
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819093158	HI	On-Demand	Anodyne	REN	34	43
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819093158	HI	On-Demand	Anodyne	CAPN1	26	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819093158	HI	On-Demand	Anodyne	FPR1	56	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819093159	HI	On-Demand	Anodyne	CTSK	23	44
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819093159	HI	On-Demand	Anodyne	TIMP3	40	34
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819093159	HI	On-Demand	Anodyne	REN	34	43
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819093159	HI	On-Demand	Anodyne	CAPN1	26	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819093159	HI	On-Demand	Anodyne	FPR1	56	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819093160	HI	On-Demand	Anodyne	CTSK	23	44
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819093160	HI	On-Demand	Anodyne	TIMP3	40	34
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819093160	HI	On-Demand	Anodyne	REN	34	43
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819093160	HI	On-Demand	Anodyne	CAPN1	26	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819093160	HI	On-Demand	Anodyne	FPR1	56	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819093161	HI	On-Demand	Anodyne	CTSK	23	44
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819093161	HI	On-Demand	Anodyne	TIMP3	40	34
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819093161	HI	On-Demand	Anodyne	REN	34	43
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819093161	HI	On-Demand	Anodyne	CAPN1	26	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819093161	HI	On-Demand	Anodyne	FPR1	56	41
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccccc2OCC2CC2)c1	ZINC000819093176	EG	On-Demand	Bother	CACNA1D	40	39
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccccc2OCC2CC2)c1	ZINC000819093177	EG	On-Demand	Bother	CACNA1D	40	39
C#CCSCCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819093182	CE	On-Demand	Mild	ADRB1	17	40
C#CCSCCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819093183	CE	On-Demand	Mild	ADRB1	17	40
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)COc2ccccc2F)CC1	ZINC000819093206	GF	On-Demand	Anodyne	ADRB2	36	47
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)COc2ccccc2F)CC1	ZINC000819093206	GF	On-Demand	Anodyne	ADRB1	49	35
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)COc2ccccc2F)CC1	ZINC000819093206	GF	On-Demand	Anodyne	ADRB3	21	44
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)COc2ccccc2F)CC1	ZINC000819093206	GF	On-Demand	Anodyne	ABCB1	17	45
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)COc2ccccc2F)CC1	ZINC000819093207	GF	On-Demand	Anodyne	ADRB2	36	47
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)COc2ccccc2F)CC1	ZINC000819093207	GF	On-Demand	Anodyne	ADRB1	49	35
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)COc2ccccc2F)CC1	ZINC000819093207	GF	On-Demand	Anodyne	ADRB3	21	44
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)COc2ccccc2F)CC1	ZINC000819093207	GF	On-Demand	Anodyne	ABCB1	17	45
Cc1ccc(NCCCNC[C@H](O)c2cccnc2)c([N+](=O)[O-])c1	ZINC000819093229	EE	On-Demand	Bother	ADRB2	23	41
Cc1ccc(NCCCNC[C@H](O)c2cccnc2)c([N+](=O)[O-])c1	ZINC000819093229	EE	On-Demand	Bother	ADRB1	24	42
Cc1ccc(NCCCNC[C@H](O)c2cccnc2)c([N+](=O)[O-])c1	ZINC000819093229	EE	On-Demand	Bother	ADRB3	93	48
Cc1ccc(NCCCNC[C@@H](O)c2cccnc2)c([N+](=O)[O-])c1	ZINC000819093230	EE	On-Demand	Bother	ADRB2	23	41
Cc1ccc(NCCCNC[C@@H](O)c2cccnc2)c([N+](=O)[O-])c1	ZINC000819093230	EE	On-Demand	Bother	ADRB1	24	42
Cc1ccc(NCCCNC[C@@H](O)c2cccnc2)c([N+](=O)[O-])c1	ZINC000819093230	EE	On-Demand	Bother	ADRB3	93	48
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H]1COc1ccc(Cl)cc1	ZINC000819093237	EG	On-Demand	Anodyne	CHRNA10	56	49
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H]1COc1ccc(Cl)cc1	ZINC000819093238	EG	On-Demand	Anodyne	CHRNA10	56	49
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H]1COc1ccc(Cl)cc1	ZINC000819093239	EG	On-Demand	Anodyne	CHRNA10	56	49
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H]1COc1ccc(Cl)cc1	ZINC000819093240	EG	On-Demand	Anodyne	CHRNA10	56	49
COCCOc1cc(NC(=O)C(F)=C2CCC2)ccc1OC	ZINC000819093253	DG	On-Demand	Anodyne	MET	43	34
COCCOc1cc(NC(=O)C(F)=C2CCC2)ccc1OC	ZINC000819093253	DG	On-Demand	Anodyne	ENPP1	73	35
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(NC(=O)OC(C)(C)C)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819093303	IK	On-Demand	Anodyne	CPT1A	42	34
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(NC(=O)OC(C)(C)C)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819093304	IK	On-Demand	Anodyne	CPT1A	42	34
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(NC(=O)OC(C)(C)C)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819093305	IK	On-Demand	Anodyne	CPT1A	42	34
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(NC(=O)OC(C)(C)C)c2)cc1)[C@H]1C[C@H]1C	ZINC000819093306	IK	On-Demand	Anodyne	CPT1A	42	34
CC(=O)N(c1ccc(NC(=O)c2ccccc2N(C)C(=O)C2CC2)cc1)[C@@H]1C[C@H]1C	ZINC000819093315	HI	On-Demand	Anodyne	FASN	27	40
CC(=O)N(c1ccc(NC(=O)c2ccccc2N(C)C(=O)C2CC2)cc1)[C@H]1C[C@@H]1C	ZINC000819093316	HI	On-Demand	Anodyne	FASN	27	40
CC(=O)N(c1ccc(NC(=O)c2ccccc2N(C)C(=O)C2CC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819093317	HI	On-Demand	Anodyne	FASN	27	40
CC(=O)N(c1ccc(NC(=O)c2ccccc2N(C)C(=O)C2CC2)cc1)[C@H]1C[C@H]1C	ZINC000819093318	HI	On-Demand	Anodyne	FASN	27	40
O=C(c1cccnc1)N1CCC(C(=O)N2CCO[C@@H](c3ccc(Cl)cc3)C2)CC1	ZINC000819093319	HG	On-Demand	Anodyne	CCR1	17	41
CC(=O)N(c1ccc(NC(=O)c2cccc(C)c2NC(=O)c2ccncc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819093330	IJ	On-Demand	Anodyne	KCNK3	47	39
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819093333	GH	On-Demand	Anodyne	ADRB2	37	44
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819093333	GH	On-Demand	Anodyne	ADRB1	56	44
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819093333	GH	On-Demand	Anodyne	ADRB3	43	43
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819093334	GH	On-Demand	Anodyne	ADRB2	37	44
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819093334	GH	On-Demand	Anodyne	ADRB1	56	44
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819093334	GH	On-Demand	Anodyne	ADRB3	43	43
CC(=O)N(c1ccc(NC(=O)c2cccc(C)c2NC(=O)c2ccncc2)cc1)[C@H]1C[C@H]1C	ZINC000819093336	IJ	On-Demand	Anodyne	KCNK3	47	39
CC(=O)N(c1ccc(NC(=O)c2cccc(C)c2NC(=O)c2ccncc2)cc1)[C@H]1C[C@@H]1C	ZINC000819093338	IJ	On-Demand	Anodyne	KCNK3	47	39
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)COCc2ccccc2F)CC1	ZINC000819093339	GG	On-Demand	Anodyne	PAPA1_CARPA	20	42
CC(=O)N(c1ccc(NC(=O)c2cccc(C)c2NC(=O)c2ccncc2)cc1)[C@@H]1C[C@H]1C	ZINC000819093340	IJ	On-Demand	Anodyne	KCNK3	47	39
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)COCc2ccccc2F)CC1	ZINC000819093341	GG	On-Demand	Anodyne	PAPA1_CARPA	20	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccnc1-n1cccn1	ZINC000819093344	FD	On-Demand	Anodyne	AMP1_PLAFQ	18	41
C[C@H](Cc1ccco1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819093438	DE	On-Demand	Anodyne	FPR1	44	36
C[C@@H](Cc1ccco1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819093439	DE	On-Demand	Anodyne	FPR1	44	36
COCCOc1cc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)ccc1OC	ZINC000819093440	GF	On-Demand	Anodyne	ENPP1	70	34
COCCOc1cc(NC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)ccc1OC	ZINC000819093441	GF	On-Demand	Anodyne	ENPP1	70	34
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819093488	GF	On-Demand	Mild	ADRB2	31	45
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819093488	GF	On-Demand	Mild	ADRB1	41	45
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819093488	GF	On-Demand	Mild	ADRB3	25	41
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819093490	GF	On-Demand	Mild	ADRB2	31	45
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819093490	GF	On-Demand	Mild	ADRB1	41	45
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819093490	GF	On-Demand	Mild	ADRB3	25	41
Cc1nn(C)c(S(=O)(=O)NC[C@@H](Cc2cccnc2)C(=O)O)c1C(F)F	ZINC000819093494	GD	On-Demand	Anodyne	TBXAS1	38	40
Cc1nn(C)c(S(=O)(=O)NC[C@H](Cc2cccnc2)C(=O)O)c1C(F)F	ZINC000819093496	GD	On-Demand	Anodyne	TBXAS1	38	40
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@H]3C)cc2)n(C)c1	ZINC000819093513	IG	On-Demand	Anodyne	HRAS	40	31
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@@H]3C)cc2)n(C)c1	ZINC000819093516	IG	On-Demand	Anodyne	HRAS	40	31
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ccc(N(C(C)=O)[C@H]3C[C@H]3C)cc2)n(C)c1	ZINC000819093517	IG	On-Demand	Anodyne	HRAS	40	31
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2ccc(N(C(C)=O)[C@H]3C[C@@H]3C)cc2)n(C)c1	ZINC000819093520	IG	On-Demand	Anodyne	HRAS	40	31
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819093546	IJ	On-Demand	Anodyne	PRNP	42	39
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819093546	IJ	On-Demand	Anodyne	ABCB1B	24	41
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819093546	IJ	On-Demand	Anodyne	NR1H4	18	47
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819093546	IJ	On-Demand	Anodyne	SMO	15	45
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819093546	IJ	On-Demand	Anodyne	KCNK3	69	39
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819093547	IJ	On-Demand	Anodyne	PRNP	42	39
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819093547	IJ	On-Demand	Anodyne	ABCB1B	24	41
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819093547	IJ	On-Demand	Anodyne	NR1H4	18	47
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819093547	IJ	On-Demand	Anodyne	SMO	15	45
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819093547	IJ	On-Demand	Anodyne	KCNK3	69	39
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819093549	IJ	On-Demand	Anodyne	PRNP	42	39
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819093549	IJ	On-Demand	Anodyne	ABCB1B	24	41
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819093549	IJ	On-Demand	Anodyne	NR1H4	18	47
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819093549	IJ	On-Demand	Anodyne	SMO	15	45
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819093549	IJ	On-Demand	Anodyne	KCNK3	69	39
C=CCCn1cc(C(=O)N2CCC[C@H]2COc2ccc(Cl)cc2)nn1	ZINC000819093550	FG	On-Demand	Mild	CHRNA10	39	45
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819093551	IJ	On-Demand	Anodyne	PRNP	42	39
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819093551	IJ	On-Demand	Anodyne	ABCB1B	24	41
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819093551	IJ	On-Demand	Anodyne	NR1H4	18	47
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819093551	IJ	On-Demand	Anodyne	SMO	15	45
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819093551	IJ	On-Demand	Anodyne	KCNK3	69	39
CC(=O)N(c1ccc(NC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819093552	IH	On-Demand	Anodyne	POLG_HCV1	25	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819093552	IH	On-Demand	Anodyne	FPR1	40	35
CC(=O)N(c1ccc(NC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819093553	IH	On-Demand	Anodyne	POLG_HCV1	25	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819093553	IH	On-Demand	Anodyne	FPR1	40	35
CC(=O)N(c1ccc(NC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819093554	IH	On-Demand	Anodyne	POLG_HCV1	25	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819093554	IH	On-Demand	Anodyne	FPR1	40	35
CC(=O)N(c1ccc(NC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819093555	IH	On-Demand	Anodyne	POLG_HCV1	25	41
CC(=O)N(c1ccc(NC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819093555	IH	On-Demand	Anodyne	FPR1	40	35
O=C(COc1ccc2ccc(=O)oc2c1)N1CCO[C@@H](c2ccc(Cl)cc2)C1	ZINC000819093556	GG	On-Demand	Anodyne	MAOB	19	42
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819093557	HG	On-Demand	Anodyne	CA2	19	59
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819093557	HG	On-Demand	Anodyne	CA6	15	44
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819093557	HG	On-Demand	Anodyne	CA1	19	59
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819093557	HG	On-Demand	Anodyne	CA7	21	44
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819093557	HG	On-Demand	Anodyne	CPT1A	47	35
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819093557	HG	On-Demand	Anodyne	CA13	26	44
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819093557	HG	On-Demand	Anodyne	CA4	20	59
C=CCCn1cc(C(=O)N2CCC[C@@H]2COc2ccc(Cl)cc2)nn1	ZINC000819093558	FG	On-Demand	Mild	CHRNA10	39	45
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@H]1C[C@H]1C	ZINC000819093559	HG	On-Demand	Anodyne	CA2	19	59
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@H]1C[C@H]1C	ZINC000819093559	HG	On-Demand	Anodyne	CA6	15	44
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@H]1C[C@H]1C	ZINC000819093559	HG	On-Demand	Anodyne	CA1	19	59
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@H]1C[C@H]1C	ZINC000819093559	HG	On-Demand	Anodyne	CA7	21	44
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@H]1C[C@H]1C	ZINC000819093559	HG	On-Demand	Anodyne	CPT1A	47	35
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@H]1C[C@H]1C	ZINC000819093559	HG	On-Demand	Anodyne	CA13	26	44
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@H]1C[C@H]1C	ZINC000819093559	HG	On-Demand	Anodyne	CA4	20	59
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819093560	GH	On-Demand	Anodyne	PGC	48	30
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819093560	GH	On-Demand	Anodyne	CTSL	15	40
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819093560	GH	On-Demand	Anodyne	REN	47	37
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819093560	GH	On-Demand	Anodyne	FPR1	45	39
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819093561	HG	On-Demand	Anodyne	CA2	19	59
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819093561	HG	On-Demand	Anodyne	CA6	15	44
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819093561	HG	On-Demand	Anodyne	CA1	19	59
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819093561	HG	On-Demand	Anodyne	CA7	21	44
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819093561	HG	On-Demand	Anodyne	CPT1A	47	35
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819093561	HG	On-Demand	Anodyne	CA13	26	44
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819093561	HG	On-Demand	Anodyne	CA4	20	59
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819093562	GH	On-Demand	Anodyne	PGC	48	30
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819093562	GH	On-Demand	Anodyne	CTSL	15	40
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819093562	GH	On-Demand	Anodyne	REN	47	37
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819093562	GH	On-Demand	Anodyne	FPR1	45	39
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819093563	HG	On-Demand	Anodyne	CA2	19	59
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819093563	HG	On-Demand	Anodyne	CA6	15	44
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819093563	HG	On-Demand	Anodyne	CA1	19	59
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819093563	HG	On-Demand	Anodyne	CA7	21	44
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819093563	HG	On-Demand	Anodyne	CPT1A	47	35
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819093563	HG	On-Demand	Anodyne	CA13	26	44
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819093563	HG	On-Demand	Anodyne	CA4	20	59
CC(=O)N(c1ccc(NC(=O)c2ccc3c(c2)CCN3C(=O)OC(C)(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819093567	IJ	On-Demand	Anodyne	AVPR2	20	40
CC(=O)N(c1ccc(NC(=O)c2ccc3c(c2)CCN3C(=O)OC(C)(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819093571	IJ	On-Demand	Anodyne	AVPR2	20	40
CC(=O)N(c1ccc(NC(=O)c2ccc3c(c2)CCN3C(=O)OC(C)(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819093572	IJ	On-Demand	Anodyne	AVPR2	20	40
CC(=O)N(c1ccc(NC(=O)c2ccc3c(c2)CCN3C(=O)OC(C)(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819093574	IJ	On-Demand	Anodyne	AVPR2	20	40
CNC(=O)CN1CCC(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819093607	GC	On-Demand	Mild	PAPA1_CARPA	32	43
CNC(=O)CN1CCC(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819093610	GC	On-Demand	Mild	PAPA1_CARPA	32	43
C#CCSCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819093612	DD	On-Demand	Mild	ADRB2	19	60
C#CCSCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819093612	DD	On-Demand	Mild	ADRB1	61	60
C#CCSCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819093613	DD	On-Demand	Mild	ADRB2	19	60
C#CCSCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819093613	DD	On-Demand	Mild	ADRB1	61	60
CC(=O)N(c1ccc(NC(=O)c2cc(S(C)(=O)=O)ccc2Cl)cc1)[C@H]1C[C@H]1C	ZINC000819093665	HH	On-Demand	Anodyne	SHH	19	41
CC(=O)N(c1ccc(NC(=O)c2cc(S(C)(=O)=O)ccc2Cl)cc1)[C@H]1C[C@@H]1C	ZINC000819093666	HH	On-Demand	Anodyne	SHH	19	41
CC(=O)N(c1ccc(NC(=O)c2cc(S(C)(=O)=O)ccc2Cl)cc1)[C@@H]1C[C@H]1C	ZINC000819093667	HH	On-Demand	Anodyne	SHH	19	41
CC(=O)N(c1ccc(NC(=O)c2cc(S(C)(=O)=O)ccc2Cl)cc1)[C@@H]1C[C@@H]1C	ZINC000819093668	HH	On-Demand	Anodyne	SHH	19	41
C#CCSCCNC[C@@H](O)COc1ccc(SC)cc1	ZINC000819093680	DE	On-Demand	Mild	ADRB2	43	43
C#CCSCCNC[C@@H](O)COc1ccc(SC)cc1	ZINC000819093680	DE	On-Demand	Mild	ADRB1	63	43
C#CCSCCNC[C@@H](O)COc1ccc(SC)cc1	ZINC000819093680	DE	On-Demand	Mild	ADRB3	33	43
C#CCSCCNC[C@H](O)COc1ccc(SC)cc1	ZINC000819093681	DE	On-Demand	Mild	ADRB2	43	43
C#CCSCCNC[C@H](O)COc1ccc(SC)cc1	ZINC000819093681	DE	On-Demand	Mild	ADRB1	63	43
C#CCSCCNC[C@H](O)COc1ccc(SC)cc1	ZINC000819093681	DE	On-Demand	Mild	ADRB3	33	43
Cc1ccc(OC[C@@H](O)CNC2CCC(NC(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819093690	GG	On-Demand	Anodyne	ADRB2	23	43
Cc1ccc(OC[C@H](O)CNC2CCC(NC(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819093691	GG	On-Demand	Anodyne	ADRB2	23	43
COCCOc1cc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)ccc1OC	ZINC000819093698	GF	On-Demand	Anodyne	ENPP1	62	32
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819093706	GI	On-Demand	Anodyne	REN	40	37
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819093706	GI	On-Demand	Anodyne	FPR1	42	34
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2COc2ccc(Cl)cc2)c1	ZINC000819093712	GH	On-Demand	Anodyne	TSHR	53	36
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2COc2ccc(Cl)cc2)c1	ZINC000819093712	GH	On-Demand	Anodyne	OPRK1	23	44
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2COc2ccc(Cl)cc2)c1	ZINC000819093712	GH	On-Demand	Anodyne	LTA4H	22	48
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2COc2ccc(Cl)cc2)c1	ZINC000819093712	GH	On-Demand	Anodyne	CPT1A	31	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2COc2ccc(Cl)cc2)c1	ZINC000819093712	GH	On-Demand	Anodyne	ITGA4	46	40
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2COc2ccc(Cl)cc2)c1	ZINC000819093712	GH	On-Demand	Anodyne	CHRNA10	66	47
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2COc2ccc(Cl)cc2)c1	ZINC000819093712	GH	On-Demand	Anodyne	MCHR1	44	44
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2COc2ccc(Cl)cc2)c1	ZINC000819093713	GH	On-Demand	Anodyne	TSHR	53	36
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2COc2ccc(Cl)cc2)c1	ZINC000819093713	GH	On-Demand	Anodyne	OPRK1	23	44
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2COc2ccc(Cl)cc2)c1	ZINC000819093713	GH	On-Demand	Anodyne	LTA4H	22	48
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2COc2ccc(Cl)cc2)c1	ZINC000819093713	GH	On-Demand	Anodyne	CPT1A	31	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2COc2ccc(Cl)cc2)c1	ZINC000819093713	GH	On-Demand	Anodyne	ITGA4	46	40
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2COc2ccc(Cl)cc2)c1	ZINC000819093713	GH	On-Demand	Anodyne	CHRNA10	66	47
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2COc2ccc(Cl)cc2)c1	ZINC000819093713	GH	On-Demand	Anodyne	MCHR1	44	44
C[C@@H](CC(=O)N1CCC[C@@H]1COc1ccc(Cl)cc1)n1cccn1	ZINC000819093715	EH	On-Demand	Anodyne	DPP4	28	42
C[C@@H](CC(=O)N1CCC[C@@H]1COc1ccc(Cl)cc1)n1cccn1	ZINC000819093715	EH	On-Demand	Anodyne	CHRNA10	57	47
C[C@@H](CC(=O)N1CCC[C@H]1COc1ccc(Cl)cc1)n1cccn1	ZINC000819093716	EH	On-Demand	Anodyne	DPP4	28	42
C[C@@H](CC(=O)N1CCC[C@H]1COc1ccc(Cl)cc1)n1cccn1	ZINC000819093716	EH	On-Demand	Anodyne	CHRNA10	57	47
C[C@@H](Cc1ccco1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093724	EF	On-Demand	Mild	PAPA1_CARPA	55	47
C[C@@H](Cc1ccco1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093724	EF	On-Demand	Mild	CTSK	18	43
C[C@@H](Cc1ccco1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093724	EF	On-Demand	Mild	CTSL	18	47
C[C@@H](Cc1ccco1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093724	EF	On-Demand	Mild	REN	44	38
C[C@@H](Cc1ccco1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093724	EF	On-Demand	Mild	CTSS	15	47
C[C@@H](Cc1ccco1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093724	EF	On-Demand	Mild	FPR1	51	43
C[C@H](Cc1ccco1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093725	EF	On-Demand	Mild	PAPA1_CARPA	55	47
C[C@H](Cc1ccco1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093725	EF	On-Demand	Mild	CTSK	18	43
C[C@H](Cc1ccco1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093725	EF	On-Demand	Mild	CTSL	18	47
C[C@H](Cc1ccco1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093725	EF	On-Demand	Mild	REN	44	38
C[C@H](Cc1ccco1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093725	EF	On-Demand	Mild	CTSS	15	47
C[C@H](Cc1ccco1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093725	EF	On-Demand	Mild	FPR1	51	43
C[C@H](Cc1ccco1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093726	EF	On-Demand	Mild	PAPA1_CARPA	55	47
C[C@H](Cc1ccco1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093726	EF	On-Demand	Mild	CTSK	18	43
C[C@H](Cc1ccco1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093726	EF	On-Demand	Mild	CTSL	18	47
C[C@H](Cc1ccco1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093726	EF	On-Demand	Mild	REN	44	38
C[C@H](Cc1ccco1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093726	EF	On-Demand	Mild	CTSS	15	47
C[C@H](Cc1ccco1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093726	EF	On-Demand	Mild	FPR1	51	43
C[C@@H](Cc1ccco1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093727	EF	On-Demand	Mild	PAPA1_CARPA	55	47
C[C@@H](Cc1ccco1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093727	EF	On-Demand	Mild	CTSK	18	43
C[C@@H](Cc1ccco1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093727	EF	On-Demand	Mild	CTSL	18	47
C[C@@H](Cc1ccco1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093727	EF	On-Demand	Mild	REN	44	38
C[C@@H](Cc1ccco1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093727	EF	On-Demand	Mild	CTSS	15	47
C[C@@H](Cc1ccco1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819093727	EF	On-Demand	Mild	FPR1	51	43
C#CCSCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819093744	CE	On-Demand	Mild	ADRB2	40	40
C#CCSCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819093744	CE	On-Demand	Mild	ADRB1	48	47
C#CCSCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819093744	CE	On-Demand	Mild	ADRB3	54	47
C#CCSCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819093745	CE	On-Demand	Mild	ADRB2	40	40
C#CCSCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819093745	CE	On-Demand	Mild	ADRB1	48	47
C#CCSCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819093745	CE	On-Demand	Mild	ADRB3	54	47
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819093778	GI	On-Demand	Anodyne	CASR	43	43
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819093778	GI	On-Demand	Anodyne	CTSD	19	43
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819093778	GI	On-Demand	Anodyne	PAPA1_CARPA	28	50
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819093778	GI	On-Demand	Anodyne	ECE1	20	43
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819093778	GI	On-Demand	Anodyne	REN	37	41
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819093779	GI	On-Demand	Anodyne	CASR	43	43
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819093779	GI	On-Demand	Anodyne	CTSD	19	43
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819093779	GI	On-Demand	Anodyne	PAPA1_CARPA	28	50
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819093779	GI	On-Demand	Anodyne	ECE1	20	43
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819093779	GI	On-Demand	Anodyne	REN	37	41
CC(C)(C)OC(=O)NC1CCC(NC[C@@H](O)Cc2ccc(F)cc2)CC1	ZINC000819093787	FG	On-Demand	Anodyne	PAPA1_CARPA	28	47
CC(C)(C)OC(=O)NC1CCC(NC[C@H](O)Cc2ccc(F)cc2)CC1	ZINC000819093788	FG	On-Demand	Anodyne	PAPA1_CARPA	28	47
CC(C)(C)CCCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819093797	EG	On-Demand	Anodyne	GPR119	29	42
CC(C)(C)CCCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819093798	EG	On-Demand	Anodyne	GPR119	29	42
CC(C)(C)CCCNC[C@@H](O)c1cccnc1	ZINC000819093799	BF	On-Demand	Anodyne	ADRB2	32	49
CC(C)(C)CCCNC[C@@H](O)c1cccnc1	ZINC000819093799	BF	On-Demand	Anodyne	ADRB1	36	48
CC(C)(C)CCCNC[C@@H](O)c1cccnc1	ZINC000819093799	BF	On-Demand	Anodyne	ADRB3	114	49
CC(C)(C)CCCNC[C@H](O)c1cccnc1	ZINC000819093800	BF	On-Demand	Anodyne	ADRB2	32	49
CC(C)(C)CCCNC[C@H](O)c1cccnc1	ZINC000819093800	BF	On-Demand	Anodyne	ADRB1	36	48
CC(C)(C)CCCNC[C@H](O)c1cccnc1	ZINC000819093800	BF	On-Demand	Anodyne	ADRB3	114	49
CC(C)(C)CCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819093829	CG	On-Demand	Bother	ADRB3	44	38
CC(C)(C)CCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819093830	CG	On-Demand	Bother	ADRB3	44	38
O=C(O)c1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)nc1	ZINC000819093833	GD	On-Demand	Anodyne	TGM2	28	43
O=C(O)c1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)nc1	ZINC000819093833	GD	On-Demand	Anodyne	GCK	41	35
O=C(O)c1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)nc1	ZINC000819093833	GD	On-Demand	Anodyne	F13A1	22	43
O=C(O)c1ccc(N2CCN(S(=O)(=O)c3ccc4c(c3)CCC4)CC2)nc1	ZINC000819093833	GD	On-Demand	Anodyne	AKR1C3	67	39
COCCOc1cc(NC(=O)[C@@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)ccc1OC	ZINC000819093840	GE	On-Demand	Anodyne	ENPP1	71	34
COCCOc1cc(NC(=O)[C@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)ccc1OC	ZINC000819093841	GE	On-Demand	Anodyne	ENPP1	71	34
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(-n2cccn2)cc1	ZINC000819093843	CF	On-Demand	Anodyne	AMP1_PLAFQ	52	36
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(-n2cccn2)cc1	ZINC000819093844	CF	On-Demand	Anodyne	AMP1_PLAFQ	52	36
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(-n2cccn2)cc1	ZINC000819093845	CF	On-Demand	Anodyne	AMP1_PLAFQ	52	36
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(-n2cccn2)cc1	ZINC000819093846	CF	On-Demand	Anodyne	AMP1_PLAFQ	52	36
O=C(C(F)=C1CCC1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819093892	FF	On-Demand	Anodyne	ADRA1D	15	40
O=C(C(F)=C1CCC1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819093892	FF	On-Demand	Anodyne	CCR8	64	32
O=C(C(F)=C1CCC1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819093892	FF	On-Demand	Anodyne	SFRP1	139	39
O=C(C(F)=C1CCC1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819093892	FF	On-Demand	Anodyne	WNT3	95	39
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(CN2CCCCC2)c1	ZINC000819093899	DG	On-Demand	Anodyne	HRH2	45	44
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(CN2CCCCC2)c1	ZINC000819093899	DG	On-Demand	Anodyne	SIGMAR1	17	41
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(CN2CCCCC2)c1	ZINC000819093899	DG	On-Demand	Anodyne	CCR3	31	40
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(CN2CCCCC2)c1	ZINC000819093900	DG	On-Demand	Anodyne	HRH2	45	44
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(CN2CCCCC2)c1	ZINC000819093900	DG	On-Demand	Anodyne	SIGMAR1	17	41
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(CN2CCCCC2)c1	ZINC000819093900	DG	On-Demand	Anodyne	CCR3	31	40
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(CN2CCCCC2)c1	ZINC000819093901	DG	On-Demand	Anodyne	HRH2	45	44
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(CN2CCCCC2)c1	ZINC000819093901	DG	On-Demand	Anodyne	SIGMAR1	17	41
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(CN2CCCCC2)c1	ZINC000819093901	DG	On-Demand	Anodyne	CCR3	31	40
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(CN2CCCCC2)c1	ZINC000819093902	DG	On-Demand	Anodyne	HRH2	45	44
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(CN2CCCCC2)c1	ZINC000819093902	DG	On-Demand	Anodyne	SIGMAR1	17	41
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(CN2CCCCC2)c1	ZINC000819093902	DG	On-Demand	Anodyne	CCR3	31	40
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093917	GD	On-Demand	Anodyne	LTA4H	24	40
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093917	GD	On-Demand	Anodyne	MMP13	81	49
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093917	GD	On-Demand	Anodyne	ADAM17	87	49
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093917	GD	On-Demand	Anodyne	MMP2	40	47
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093917	GD	On-Demand	Anodyne	MMP3	47	47
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093917	GD	On-Demand	Anodyne	MMP8	16	40
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093917	GD	On-Demand	Anodyne	MMP14	32	47
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093917	GD	On-Demand	Anodyne	MMP9	38	49
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093917	GD	On-Demand	Anodyne	TGM2	46	42
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093917	GD	On-Demand	Anodyne	MMP10	18	44
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093917	GD	On-Demand	Anodyne	MMP7	47	39
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093917	GD	On-Demand	Anodyne	ADAMTS4	44	40
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093917	GD	On-Demand	Anodyne	MMP1	56	49
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093917	GD	On-Demand	Anodyne	F13A1	64	42
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093917	GD	On-Demand	Anodyne	FFAR1	25	41
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093917	GD	On-Demand	Anodyne	SLC12A5	46	35
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093918	GD	On-Demand	Anodyne	LTA4H	24	40
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093918	GD	On-Demand	Anodyne	MMP13	81	49
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093918	GD	On-Demand	Anodyne	ADAM17	87	49
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093918	GD	On-Demand	Anodyne	MMP2	40	47
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093918	GD	On-Demand	Anodyne	MMP3	47	47
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093918	GD	On-Demand	Anodyne	MMP8	16	40
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093918	GD	On-Demand	Anodyne	MMP14	32	47
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093918	GD	On-Demand	Anodyne	MMP9	38	49
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093918	GD	On-Demand	Anodyne	TGM2	46	42
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093918	GD	On-Demand	Anodyne	MMP10	18	44
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093918	GD	On-Demand	Anodyne	MMP7	47	39
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093918	GD	On-Demand	Anodyne	ADAMTS4	44	40
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093918	GD	On-Demand	Anodyne	MMP1	56	49
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093918	GD	On-Demand	Anodyne	F13A1	64	42
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093918	GD	On-Demand	Anodyne	FFAR1	25	41
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)C1	ZINC000819093918	GD	On-Demand	Anodyne	SLC12A5	46	35
COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)N1CC[C@@](O)(C(=O)O)C1	ZINC000819093956	GC	On-Demand	Anodyne	CPT1A	58	36
COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)N1CC[C@@](O)(C(=O)O)C1	ZINC000819093956	GC	On-Demand	Anodyne	CPT2	47	35
COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)N1CC[C@@](O)(C(=O)O)C1	ZINC000819093956	GC	On-Demand	Anodyne	CPT1B	54	36
COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)N1CC[C@](O)(C(=O)O)C1	ZINC000819093958	GC	On-Demand	Anodyne	CPT1A	58	36
COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)N1CC[C@](O)(C(=O)O)C1	ZINC000819093958	GC	On-Demand	Anodyne	CPT2	47	35
COC[C@@H](C)Oc1ccc(Cl)cc1S(=O)(=O)N1CC[C@](O)(C(=O)O)C1	ZINC000819093958	GC	On-Demand	Anodyne	CPT1B	54	36
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093960	DG	On-Demand	Anodyne	CHRM2	18	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093960	DG	On-Demand	Anodyne	CHRM1	15	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093960	DG	On-Demand	Anodyne	DRD2	15	50
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093960	DG	On-Demand	Anodyne	DRD4	40	50
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093960	DG	On-Demand	Anodyne	SLC6A1	104	34
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093960	DG	On-Demand	Anodyne	CHRM3	21	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093960	DG	On-Demand	Anodyne	SIGMAR1	50	47
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093960	DG	On-Demand	Anodyne	CCR3	39	46
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093960	DG	On-Demand	Anodyne	CCR2	16	43
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093960	DG	On-Demand	Anodyne	MCHR1	16	47
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093960	DG	On-Demand	Anodyne	CACNA1G	17	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093960	DG	On-Demand	Anodyne	BIRC2	47	51
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093961	DG	On-Demand	Anodyne	CHRM2	18	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093961	DG	On-Demand	Anodyne	CHRM1	15	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093961	DG	On-Demand	Anodyne	DRD2	15	50
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093961	DG	On-Demand	Anodyne	DRD4	40	50
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093961	DG	On-Demand	Anodyne	SLC6A1	104	34
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093961	DG	On-Demand	Anodyne	CHRM3	21	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093961	DG	On-Demand	Anodyne	SIGMAR1	50	47
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093961	DG	On-Demand	Anodyne	CCR3	39	46
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093961	DG	On-Demand	Anodyne	CCR2	16	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093961	DG	On-Demand	Anodyne	MCHR1	16	47
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093961	DG	On-Demand	Anodyne	CACNA1G	17	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819093961	DG	On-Demand	Anodyne	BIRC2	47	51
CCOC(=O)N[C@@H](CNC(=O)Cc1nsc2ccccc12)CC(C)C	ZINC000819093970	FG	On-Demand	Anodyne	HLA-DRB1	41	40
CCOC(=O)N[C@@H](CNC(=O)Cc1nsc2ccccc12)CC(C)C	ZINC000819093970	FG	On-Demand	Anodyne	CAPN2	82	35
CCOC(=O)N[C@H](CNC(=O)Cc1nsc2ccccc12)CC(C)C	ZINC000819093971	FG	On-Demand	Anodyne	HLA-DRB1	41	40
CCOC(=O)N[C@H](CNC(=O)Cc1nsc2ccccc12)CC(C)C	ZINC000819093971	FG	On-Demand	Anodyne	CAPN2	82	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093994	GF	On-Demand	Anodyne	DRD4	30	49
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093994	GF	On-Demand	Anodyne	ACHE	23	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093994	GF	On-Demand	Anodyne	SLC6A1	42	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093994	GF	On-Demand	Anodyne	SIGMAR1	33	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093994	GF	On-Demand	Anodyne	CCR2	16	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093994	GF	On-Demand	Anodyne	MCHR1	15	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093994	GF	On-Demand	Anodyne	BIRC2	46	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093995	GF	On-Demand	Anodyne	DRD4	30	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093995	GF	On-Demand	Anodyne	ACHE	23	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093995	GF	On-Demand	Anodyne	SLC6A1	42	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093995	GF	On-Demand	Anodyne	SIGMAR1	33	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093995	GF	On-Demand	Anodyne	CCR2	16	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093995	GF	On-Demand	Anodyne	MCHR1	15	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093995	GF	On-Demand	Anodyne	BIRC2	46	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093996	GF	On-Demand	Anodyne	DRD4	30	49
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093996	GF	On-Demand	Anodyne	ACHE	23	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093996	GF	On-Demand	Anodyne	SLC6A1	42	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093996	GF	On-Demand	Anodyne	SIGMAR1	33	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093996	GF	On-Demand	Anodyne	CCR2	16	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093996	GF	On-Demand	Anodyne	MCHR1	15	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093996	GF	On-Demand	Anodyne	BIRC2	46	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093997	GF	On-Demand	Anodyne	DRD4	30	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093997	GF	On-Demand	Anodyne	ACHE	23	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093997	GF	On-Demand	Anodyne	SLC6A1	42	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093997	GF	On-Demand	Anodyne	SIGMAR1	33	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093997	GF	On-Demand	Anodyne	CCR2	16	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093997	GF	On-Demand	Anodyne	MCHR1	15	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819093997	GF	On-Demand	Anodyne	BIRC2	46	46
O=C(/C=C/[C@H]1CCCO1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819094030	GD	On-Demand	Anodyne	CCR8	47	37
O=C(/C=C/[C@H]1CCCO1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819094030	GD	On-Demand	Anodyne	SFRP1	124	37
O=C(/C=C/[C@H]1CCCO1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819094030	GD	On-Demand	Anodyne	WNT3	87	37
O=C(/C=C\[C@H]1CCCO1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819094031	GD	On-Demand	Anodyne	CCR8	47	37
O=C(/C=C\[C@H]1CCCO1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819094031	GD	On-Demand	Anodyne	SFRP1	124	37
O=C(/C=C\[C@H]1CCCO1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819094031	GD	On-Demand	Anodyne	WNT3	87	37
O=C(/C=C\[C@@H]1CCCO1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819094032	GD	On-Demand	Anodyne	CCR8	47	37
O=C(/C=C\[C@@H]1CCCO1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819094032	GD	On-Demand	Anodyne	SFRP1	124	37
O=C(/C=C\[C@@H]1CCCO1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819094032	GD	On-Demand	Anodyne	WNT3	87	37
O=C(/C=C/[C@@H]1CCCO1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819094033	GD	On-Demand	Anodyne	CCR8	47	37
O=C(/C=C/[C@@H]1CCCO1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819094033	GD	On-Demand	Anodyne	SFRP1	124	37
O=C(/C=C/[C@@H]1CCCO1)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1	ZINC000819094033	GD	On-Demand	Anodyne	WNT3	87	37
Cc1cc(C(F)(F)F)ccc1S(=O)(=O)N1CC[C@](O)(C(=O)O)C1	ZINC000819094068	FD	On-Demand	Anodyne	CACNA1B	21	41
Cc1cc(C(F)(F)F)ccc1S(=O)(=O)N1CC[C@](O)(C(=O)O)C1	ZINC000819094068	FD	On-Demand	Anodyne	EPHX2	21	48
Cc1cc(C(F)(F)F)ccc1S(=O)(=O)N1CC[C@@](O)(C(=O)O)C1	ZINC000819094069	FD	On-Demand	Anodyne	CACNA1B	21	41
Cc1cc(C(F)(F)F)ccc1S(=O)(=O)N1CC[C@@](O)(C(=O)O)C1	ZINC000819094069	FD	On-Demand	Anodyne	EPHX2	21	48
CCOc1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)cc1Br	ZINC000819094070	GD	On-Demand	Anodyne	PDE5A	35	41
CCOc1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)cc1Br	ZINC000819094071	GD	On-Demand	Anodyne	PDE5A	35	41
O[C@@H](CNCc1cc(F)ccc1N1CCOCC1)c1cccc(Cl)c1	ZINC000819094092	FG	On-Demand	Anodyne	ADRB1	26	40
O[C@@H](CNCc1cc(F)ccc1N1CCOCC1)c1cccc(Cl)c1	ZINC000819094092	FG	On-Demand	Anodyne	ADRB3	41	40
O[C@H](CNCc1cc(F)ccc1N1CCOCC1)c1cccc(Cl)c1	ZINC000819094093	FG	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CNCc1cc(F)ccc1N1CCOCC1)c1cccc(Cl)c1	ZINC000819094093	FG	On-Demand	Anodyne	ADRB3	41	40
O=C(Nc1cccc(CN2CCCCC2)c1)C(F)=C1CCC1	ZINC000819094127	DI	On-Demand	Anodyne	HRH2	49	45
O=C(Nc1cccc(CN2CCCCC2)c1)C(F)=C1CCC1	ZINC000819094127	DI	On-Demand	Anodyne	SIGMAR1	19	41
O=C(Nc1cccc(CN2CCCCC2)c1)C(F)=C1CCC1	ZINC000819094127	DI	On-Demand	Anodyne	CCR3	29	40
O=C(Nc1cccc(CN2CCCCC2)c1)C(F)=C1CCC1	ZINC000819094127	DI	On-Demand	Anodyne	FAAH	20	42
O=C(Nc1cccc(CN2CCCCC2)c1)C(F)=C1CCC1	ZINC000819094127	DI	On-Demand	Anodyne	MCHR1	22	40
CC[C@@H](NC(=O)Cc1cccc(NC(C)=O)c1)c1ccccc1OC	ZINC000819094130	EG	On-Demand	Anodyne	TSHR	63	33
CC[C@@H](NC(=O)Cc1cccc(NC(C)=O)c1)c1ccccc1OC	ZINC000819094130	EG	On-Demand	Anodyne	ABCC8	19	40
CC[C@@H](NC(=O)Cc1cccc(NC(C)=O)c1)c1ccccc1OC	ZINC000819094130	EG	On-Demand	Anodyne	MTNR1A	33	42
CC[C@@H](NC(=O)Cc1cccc(NC(C)=O)c1)c1ccccc1OC	ZINC000819094130	EG	On-Demand	Anodyne	MTNR1B	41	42
CC[C@@H](NC(=O)Cc1cccc(NC(C)=O)c1)c1ccccc1OC	ZINC000819094130	EG	On-Demand	Anodyne	KCNK3	64	45
CC[C@@H](NC(=O)Cc1cccc(NC(C)=O)c1)c1ccccc1OC	ZINC000819094130	EG	On-Demand	Anodyne	KCNK9	54	45
CC[C@@H](NC(=O)Cc1cccc(NC(C)=O)c1)c1ccccc1OC	ZINC000819094130	EG	On-Demand	Anodyne	PDS	64	36
CC[C@H](NC(=O)Cc1cccc(NC(C)=O)c1)c1ccccc1OC	ZINC000819094131	EG	On-Demand	Anodyne	TSHR	63	33
CC[C@H](NC(=O)Cc1cccc(NC(C)=O)c1)c1ccccc1OC	ZINC000819094131	EG	On-Demand	Anodyne	ABCC8	19	40
CC[C@H](NC(=O)Cc1cccc(NC(C)=O)c1)c1ccccc1OC	ZINC000819094131	EG	On-Demand	Anodyne	MTNR1A	33	42
CC[C@H](NC(=O)Cc1cccc(NC(C)=O)c1)c1ccccc1OC	ZINC000819094131	EG	On-Demand	Anodyne	MTNR1B	41	42
CC[C@H](NC(=O)Cc1cccc(NC(C)=O)c1)c1ccccc1OC	ZINC000819094131	EG	On-Demand	Anodyne	KCNK3	64	45
CC[C@H](NC(=O)Cc1cccc(NC(C)=O)c1)c1ccccc1OC	ZINC000819094131	EG	On-Demand	Anodyne	KCNK9	54	45
CC[C@H](NC(=O)Cc1cccc(NC(C)=O)c1)c1ccccc1OC	ZINC000819094131	EG	On-Demand	Anodyne	PDS	64	36
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2cccc3c2CCCC3)C1	ZINC000819094134	EC	On-Demand	Anodyne	AKR1C3	49	36
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2cccc3c2CCCC3)C1	ZINC000819094135	EC	On-Demand	Anodyne	AKR1C3	49	36
O=C(O)[C@@]1(O)CCN(S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000819094140	EB	On-Demand	Bother	KCNJ1	28	43
O=C(O)[C@]1(O)CCN(S(=O)(=O)CCc2ccc([N+](=O)[O-])cc2)C1	ZINC000819094141	EB	On-Demand	Bother	KCNJ1	28	43
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819094150	FD	On-Demand	Anodyne	ADAM17	24	44
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819094150	FD	On-Demand	Anodyne	MMP3	22	44
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819094150	FD	On-Demand	Anodyne	MMP1	26	44
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819094151	FD	On-Demand	Anodyne	ADAM17	24	44
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819094151	FD	On-Demand	Anodyne	MMP3	22	44
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819094151	FD	On-Demand	Anodyne	MMP1	26	44
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)NCC3CCC3)nn2)C1	ZINC000819094156	FE	On-Demand	Anodyne	CACNA1I	62	35
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)NCC3CCC3)nn2)C1	ZINC000819094157	FE	On-Demand	Anodyne	CACNA1I	62	35
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1C(F)(F)F	ZINC000819094160	GH	On-Demand	Clean	ADRB1	53	36
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1C(F)(F)F	ZINC000819094161	GH	On-Demand	Clean	ADRB1	53	36
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094162	GF	On-Demand	Clean	ADRB2	54	58
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094162	GF	On-Demand	Clean	ADRB1	94	58
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094162	GF	On-Demand	Clean	GRIN1	29	43
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094162	GF	On-Demand	Clean	ADRB3	63	58
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094162	GF	On-Demand	Clean	ABCB1	27	41
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094163	GF	On-Demand	Clean	ADRB2	54	58
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094163	GF	On-Demand	Clean	ADRB1	94	58
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094163	GF	On-Demand	Clean	GRIN1	29	43
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094163	GF	On-Demand	Clean	ADRB3	63	58
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094163	GF	On-Demand	Clean	ABCB1	27	41
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)c1	ZINC000819094172	FF	On-Demand	Clean	ADRB2	42	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)c1	ZINC000819094172	FF	On-Demand	Clean	ADRB1	73	41
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)c1	ZINC000819094172	FF	On-Demand	Clean	ADRB3	48	41
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)c1	ZINC000819094172	FF	On-Demand	Clean	ABCB1	33	51
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)c1	ZINC000819094172	FF	On-Demand	Clean	PDS	56	37
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)c1	ZINC000819094173	FF	On-Demand	Clean	ADRB2	42	43
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)c1	ZINC000819094173	FF	On-Demand	Clean	ADRB1	73	41
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)c1	ZINC000819094173	FF	On-Demand	Clean	ADRB3	48	41
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)c1	ZINC000819094173	FF	On-Demand	Clean	ABCB1	33	51
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)c1	ZINC000819094173	FF	On-Demand	Clean	PDS	56	37
CC[C@@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1cc(F)ccc1F	ZINC000819094196	GI	On-Demand	Anodyne	GPR119	46	58
CC[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1cc(F)ccc1F	ZINC000819094199	GI	On-Demand	Anodyne	GPR119	46	58
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccccc2S(=O)(=O)NC2CC2)C1	ZINC000819094210	GB	On-Demand	Anodyne	CCR8	86	38
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccccc2S(=O)(=O)NC2CC2)C1	ZINC000819094210	GB	On-Demand	Anodyne	SFRP1	128	39
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccccc2S(=O)(=O)NC2CC2)C1	ZINC000819094210	GB	On-Demand	Anodyne	WNT3	83	34
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccccc2S(=O)(=O)NC2CC2)C1	ZINC000819094212	GB	On-Demand	Anodyne	CCR8	86	38
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccccc2S(=O)(=O)NC2CC2)C1	ZINC000819094212	GB	On-Demand	Anodyne	SFRP1	128	39
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccccc2S(=O)(=O)NC2CC2)C1	ZINC000819094212	GB	On-Demand	Anodyne	WNT3	83	34
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094237	GE	On-Demand	Clean	ADRB2	58	51
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094237	GE	On-Demand	Clean	ADRB1	87	51
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094237	GE	On-Demand	Clean	GRIN1	21	41
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094237	GE	On-Demand	Clean	ADRB3	65	51
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094237	GE	On-Demand	Clean	ABCB1	32	44
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094239	GE	On-Demand	Clean	ADRB2	58	51
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094239	GE	On-Demand	Clean	ADRB1	87	51
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094239	GE	On-Demand	Clean	GRIN1	21	41
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094239	GE	On-Demand	Clean	ADRB3	65	51
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094239	GE	On-Demand	Clean	ABCB1	32	44
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc3ncccc3c2)C1	ZINC000819094253	DC	On-Demand	Anodyne	AKR1C3	50	38
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc3ncccc3c2)C1	ZINC000819094255	DC	On-Demand	Anodyne	AKR1C3	50	38
CNS(=O)(=O)c1cccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)c1	ZINC000819094309	FA	On-Demand	Anodyne	AKR1C3	62	40
CNS(=O)(=O)c1cccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)c1	ZINC000819094310	FA	On-Demand	Anodyne	AKR1C3	62	40
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(OCC(F)(F)F)c1	ZINC000819094311	DG	On-Demand	Anodyne	EPHX2	20	41
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(OCC(F)(F)F)c1	ZINC000819094312	DG	On-Demand	Anodyne	EPHX2	20	41
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(OCC(F)(F)F)c1	ZINC000819094313	DG	On-Demand	Anodyne	EPHX2	20	41
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(OCC(F)(F)F)c1	ZINC000819094314	DG	On-Demand	Anodyne	EPHX2	20	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(OCC(F)(F)F)c1)C2	ZINC000819094335	GG	On-Demand	Anodyne	EPHX2	22	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(OCC(F)(F)F)c1)C2	ZINC000819094336	GG	On-Demand	Anodyne	EPHX2	22	41
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094374	EE	On-Demand	Anodyne	HTR1A	86	54
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094374	EE	On-Demand	Anodyne	DRD2	65	51
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094374	EE	On-Demand	Anodyne	DRD4	41	46
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094374	EE	On-Demand	Anodyne	ADRA1D	33	48
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094374	EE	On-Demand	Anodyne	HTR2A	66	48
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094374	EE	On-Demand	Anodyne	HTR2C	38	44
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094374	EE	On-Demand	Anodyne	SLC6A4	16	42
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094374	EE	On-Demand	Anodyne	ADRA1A	47	48
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094374	EE	On-Demand	Anodyne	ADRA1B	28	48
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094374	EE	On-Demand	Anodyne	DRD3	87	51
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094374	EE	On-Demand	Anodyne	HTR7	92	45
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094374	EE	On-Demand	Anodyne	SIGMAR1	15	41
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094374	EE	On-Demand	Anodyne	CYP2J2	44	32
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094375	EE	On-Demand	Anodyne	HTR1A	86	54
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094375	EE	On-Demand	Anodyne	DRD2	65	51
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094375	EE	On-Demand	Anodyne	DRD4	41	46
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094375	EE	On-Demand	Anodyne	ADRA1D	33	48
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094375	EE	On-Demand	Anodyne	HTR2A	66	48
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094375	EE	On-Demand	Anodyne	HTR2C	38	44
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094375	EE	On-Demand	Anodyne	SLC6A4	16	42
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094375	EE	On-Demand	Anodyne	ADRA1A	47	48
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094375	EE	On-Demand	Anodyne	ADRA1B	28	48
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094375	EE	On-Demand	Anodyne	DRD3	87	51
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094375	EE	On-Demand	Anodyne	HTR7	92	45
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094375	EE	On-Demand	Anodyne	SIGMAR1	15	41
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094375	EE	On-Demand	Anodyne	CYP2J2	44	32
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094376	EE	On-Demand	Anodyne	HTR1A	86	54
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094376	EE	On-Demand	Anodyne	DRD2	65	51
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094376	EE	On-Demand	Anodyne	DRD4	41	46
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094376	EE	On-Demand	Anodyne	ADRA1D	33	48
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094376	EE	On-Demand	Anodyne	HTR2A	66	48
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094376	EE	On-Demand	Anodyne	HTR2C	38	44
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094376	EE	On-Demand	Anodyne	SLC6A4	16	42
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094376	EE	On-Demand	Anodyne	ADRA1A	47	48
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094376	EE	On-Demand	Anodyne	ADRA1B	28	48
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094376	EE	On-Demand	Anodyne	DRD3	87	51
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094376	EE	On-Demand	Anodyne	HTR7	92	45
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094376	EE	On-Demand	Anodyne	SIGMAR1	15	41
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094376	EE	On-Demand	Anodyne	CYP2J2	44	32
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094377	EE	On-Demand	Anodyne	HTR1A	86	54
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094377	EE	On-Demand	Anodyne	DRD2	65	51
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094377	EE	On-Demand	Anodyne	DRD4	41	46
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094377	EE	On-Demand	Anodyne	ADRA1D	33	48
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094377	EE	On-Demand	Anodyne	HTR2A	66	48
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094377	EE	On-Demand	Anodyne	HTR2C	38	44
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094377	EE	On-Demand	Anodyne	SLC6A4	16	42
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094377	EE	On-Demand	Anodyne	ADRA1A	47	48
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094377	EE	On-Demand	Anodyne	ADRA1B	28	48
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094377	EE	On-Demand	Anodyne	DRD3	87	51
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094377	EE	On-Demand	Anodyne	HTR7	92	45
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094377	EE	On-Demand	Anodyne	SIGMAR1	15	41
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2)CC1	ZINC000819094377	EE	On-Demand	Anodyne	CYP2J2	44	32
COc1cccc(OC)c1OC[C@@H](O)CNCc1ccc(N2CC=CC2)cc1	ZINC000819094380	GF	On-Demand	Clean	ADRB2	35	42
COc1cccc(OC)c1OC[C@@H](O)CNCc1ccc(N2CC=CC2)cc1	ZINC000819094380	GF	On-Demand	Clean	ADRB1	39	40
COc1cccc(OC)c1OC[C@H](O)CNCc1ccc(N2CC=CC2)cc1	ZINC000819094381	GF	On-Demand	Clean	ADRB2	35	42
COc1cccc(OC)c1OC[C@H](O)CNCc1ccc(N2CC=CC2)cc1	ZINC000819094381	GF	On-Demand	Clean	ADRB1	39	40
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCC3CCCCC3)cc2)C1	ZINC000819094398	GD	On-Demand	Anodyne	MMP13	36	41
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCC3CCCCC3)cc2)C1	ZINC000819094398	GD	On-Demand	Anodyne	ADAM17	49	41
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCC3CCCCC3)cc2)C1	ZINC000819094398	GD	On-Demand	Anodyne	MMP2	16	41
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCC3CCCCC3)cc2)C1	ZINC000819094398	GD	On-Demand	Anodyne	MMP3	23	42
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCC3CCCCC3)cc2)C1	ZINC000819094399	GD	On-Demand	Anodyne	MMP13	36	41
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCC3CCCCC3)cc2)C1	ZINC000819094399	GD	On-Demand	Anodyne	ADAM17	49	41
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCC3CCCCC3)cc2)C1	ZINC000819094399	GD	On-Demand	Anodyne	MMP2	16	41
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCC3CCCCC3)cc2)C1	ZINC000819094399	GD	On-Demand	Anodyne	MMP3	23	42
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)c1	ZINC000819094430	FF	On-Demand	Clean	ADRB2	28	49
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)c1	ZINC000819094430	FF	On-Demand	Clean	ADRB1	49	49
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)c1	ZINC000819094430	FF	On-Demand	Clean	ADRB3	35	49
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)c1	ZINC000819094430	FF	On-Demand	Clean	PDS	23	46
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)c1	ZINC000819094431	FF	On-Demand	Clean	ADRB2	28	49
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)c1	ZINC000819094431	FF	On-Demand	Clean	ADRB1	49	49
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)c1	ZINC000819094431	FF	On-Demand	Clean	ADRB3	35	49
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)c1	ZINC000819094431	FF	On-Demand	Clean	PDS	23	46
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)c1cccc(F)c1	ZINC000819094432	DG	On-Demand	Clean	ADRB1	15	40
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)c1cccc(F)c1	ZINC000819094432	DG	On-Demand	Clean	ADRB3	25	40
O[C@H](CNCc1ccc(N2CC=CC2)cc1)c1cccc(F)c1	ZINC000819094433	DG	On-Demand	Clean	ADRB1	15	40
O[C@H](CNCc1ccc(N2CC=CC2)cc1)c1cccc(F)c1	ZINC000819094433	DG	On-Demand	Clean	ADRB3	25	40
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1c(Cl)cccc1Cl	ZINC000819094436	GH	On-Demand	Clean	ADRB1	26	42
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1c(Cl)cccc1Cl	ZINC000819094437	GH	On-Demand	Clean	ADRB1	26	42
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2cc3ccccc3o2)C1	ZINC000819094485	DC	On-Demand	Anodyne	LPL	45	35
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2cc3ccccc3o2)C1	ZINC000819094486	DC	On-Demand	Anodyne	LPL	45	35
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCC[C@H](S(C)(=O)=O)C2)cc1	ZINC000819094506	GD	On-Demand	Anodyne	ADRB3	26	42
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)cc1	ZINC000819094507	GD	On-Demand	Anodyne	ADRB3	26	42
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCC[C@@H](S(C)(=O)=O)C2)cc1	ZINC000819094508	GD	On-Demand	Anodyne	ADRB3	26	42
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCC[C@H](S(C)(=O)=O)C2)cc1	ZINC000819094509	GD	On-Demand	Anodyne	ADRB3	26	42
CCCCCOc1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)cc1	ZINC000819094537	FD	On-Demand	Anodyne	MMP13	67	47
CCCCCOc1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)cc1	ZINC000819094537	FD	On-Demand	Anodyne	PLA2G4A	26	43
CCCCCOc1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)cc1	ZINC000819094537	FD	On-Demand	Anodyne	ADAM17	61	47
CCCCCOc1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)cc1	ZINC000819094537	FD	On-Demand	Anodyne	MMP2	33	45
CCCCCOc1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)cc1	ZINC000819094537	FD	On-Demand	Anodyne	MMP3	43	48
CCCCCOc1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)cc1	ZINC000819094537	FD	On-Demand	Anodyne	MMP8	21	41
CCCCCOc1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)cc1	ZINC000819094537	FD	On-Demand	Anodyne	PLA2G4B	102	43
CCCCCOc1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)cc1	ZINC000819094537	FD	On-Demand	Anodyne	MMP9	32	48
CCCCCOc1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)cc1	ZINC000819094537	FD	On-Demand	Anodyne	MMP7	46	48
CCCCCOc1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)cc1	ZINC000819094537	FD	On-Demand	Anodyne	MMP1	46	47
CCCCCOc1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)cc1	ZINC000819094538	FD	On-Demand	Anodyne	MMP13	67	47
CCCCCOc1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)cc1	ZINC000819094538	FD	On-Demand	Anodyne	PLA2G4A	26	43
CCCCCOc1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)cc1	ZINC000819094538	FD	On-Demand	Anodyne	ADAM17	61	47
CCCCCOc1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)cc1	ZINC000819094538	FD	On-Demand	Anodyne	MMP2	33	45
CCCCCOc1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)cc1	ZINC000819094538	FD	On-Demand	Anodyne	MMP3	43	48
CCCCCOc1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)cc1	ZINC000819094538	FD	On-Demand	Anodyne	MMP8	21	41
CCCCCOc1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)cc1	ZINC000819094538	FD	On-Demand	Anodyne	PLA2G4B	102	43
CCCCCOc1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)cc1	ZINC000819094538	FD	On-Demand	Anodyne	MMP9	32	48
CCCCCOc1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)cc1	ZINC000819094538	FD	On-Demand	Anodyne	MMP7	46	48
CCCCCOc1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)cc1	ZINC000819094538	FD	On-Demand	Anodyne	MMP1	46	47
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2cccc(-n3cnnn3)c2)C1	ZINC000819094539	EA	On-Demand	Anodyne	AKR1C3	58	38
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2cccc(-n3cnnn3)c2)C1	ZINC000819094540	EA	On-Demand	Anodyne	AKR1C3	58	38
CCOC(=O)N[C@H](CNC(=O)Cc1cccc(NC(C)=O)c1)CC(C)C	ZINC000819094549	FE	On-Demand	Anodyne	CTSK	28	43
CCOC(=O)N[C@H](CNC(=O)Cc1cccc(NC(C)=O)c1)CC(C)C	ZINC000819094549	FE	On-Demand	Anodyne	CAPNS1	55	35
CCOC(=O)N[C@H](CNC(=O)Cc1cccc(NC(C)=O)c1)CC(C)C	ZINC000819094549	FE	On-Demand	Anodyne	MMP3	22	40
CCOC(=O)N[C@H](CNC(=O)Cc1cccc(NC(C)=O)c1)CC(C)C	ZINC000819094549	FE	On-Demand	Anodyne	HLA-DRB1	74	37
CCOC(=O)N[C@H](CNC(=O)Cc1cccc(NC(C)=O)c1)CC(C)C	ZINC000819094549	FE	On-Demand	Anodyne	CAPN1	68	38
CCOC(=O)N[C@H](CNC(=O)Cc1cccc(NC(C)=O)c1)CC(C)C	ZINC000819094549	FE	On-Demand	Anodyne	CAPN2	113	38
CCOC(=O)N[C@H](CNC(=O)Cc1cccc(NC(C)=O)c1)CC(C)C	ZINC000819094549	FE	On-Demand	Anodyne	NPR	66	34
CCOC(=O)N[C@H](CNC(=O)Cc1cccc(NC(C)=O)c1)CC(C)C	ZINC000819094549	FE	On-Demand	Anodyne	F2RL1	41	30
CCC(C)(C)c1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)cc1	ZINC000819094557	ED	On-Demand	Anodyne	HSD11B1	16	48
CCC(C)(C)c1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)cc1	ZINC000819094558	ED	On-Demand	Anodyne	HSD11B1	16	48
Cc1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)cc1Cl	ZINC000819094571	DC	On-Demand	Anodyne	AKR1C3	41	36
Cc1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)cc1Cl	ZINC000819094572	DC	On-Demand	Anodyne	AKR1C3	41	36
O=C(NCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819094575	EF	On-Demand	Anodyne	HTR1A	112	59
O=C(NCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819094575	EF	On-Demand	Anodyne	DRD2	90	55
O=C(NCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819094575	EF	On-Demand	Anodyne	DRD1	21	40
O=C(NCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819094575	EF	On-Demand	Anodyne	DRD4	59	49
O=C(NCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819094575	EF	On-Demand	Anodyne	ADRA1D	45	54
O=C(NCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819094575	EF	On-Demand	Anodyne	HTR2A	84	52
O=C(NCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819094575	EF	On-Demand	Anodyne	HTR2C	44	49
O=C(NCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819094575	EF	On-Demand	Anodyne	SLC6A4	19	46
O=C(NCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819094575	EF	On-Demand	Anodyne	ADRA1A	64	54
O=C(NCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819094575	EF	On-Demand	Anodyne	ADRA1B	40	54
O=C(NCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819094575	EF	On-Demand	Anodyne	DRD3	111	55
O=C(NCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819094575	EF	On-Demand	Anodyne	DRD5	18	42
O=C(NCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819094575	EF	On-Demand	Anodyne	HTR7	128	51
O=C(NCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819094575	EF	On-Demand	Anodyne	SIGMAR1	19	47
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094582	FF	On-Demand	Mild	ADRB2	39	42
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094582	FF	On-Demand	Mild	ADRB1	69	42
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094582	FF	On-Demand	Mild	ADRB3	43	42
N#CCc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094583	FF	On-Demand	Mild	ADRB2	39	42
N#CCc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094583	FF	On-Demand	Mild	ADRB1	69	42
N#CCc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094583	FF	On-Demand	Mild	ADRB3	43	42
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2cccc(S(F)(F)(F)(F)F)c2)C1	ZINC000819094590	GF	On-Demand	Reactive	AKR1C3	64	42
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2cccc(S(F)(F)(F)(F)F)c2)C1	ZINC000819094592	GF	On-Demand	Reactive	AKR1C3	64	42
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819094593	DF	On-Demand	Anodyne	DRD4	37	48
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819094593	DF	On-Demand	Anodyne	ACHE	21	41
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819094593	DF	On-Demand	Anodyne	SLC6A1	72	36
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819094593	DF	On-Demand	Anodyne	SIGMAR1	35	49
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819094593	DF	On-Demand	Anodyne	CCR3	28	46
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819094593	DF	On-Demand	Anodyne	BIRC2	37	45
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819094595	DF	On-Demand	Anodyne	DRD4	37	48
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819094595	DF	On-Demand	Anodyne	ACHE	21	41
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819094595	DF	On-Demand	Anodyne	SLC6A1	72	36
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819094595	DF	On-Demand	Anodyne	SIGMAR1	35	49
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819094595	DF	On-Demand	Anodyne	CCR3	28	46
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819094595	DF	On-Demand	Anodyne	BIRC2	37	45
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819094596	DF	On-Demand	Anodyne	DRD4	37	48
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819094596	DF	On-Demand	Anodyne	ACHE	21	41
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819094596	DF	On-Demand	Anodyne	SLC6A1	72	36
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819094596	DF	On-Demand	Anodyne	SIGMAR1	35	49
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819094596	DF	On-Demand	Anodyne	CCR3	28	46
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819094596	DF	On-Demand	Anodyne	BIRC2	37	45
Cc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)c(C)c1	ZINC000819094597	FG	On-Demand	Clean	ADRB2	27	44
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819094598	DF	On-Demand	Anodyne	DRD4	37	48
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819094598	DF	On-Demand	Anodyne	ACHE	21	41
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819094598	DF	On-Demand	Anodyne	SLC6A1	72	36
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819094598	DF	On-Demand	Anodyne	SIGMAR1	35	49
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819094598	DF	On-Demand	Anodyne	CCR3	28	46
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819094598	DF	On-Demand	Anodyne	BIRC2	37	45
Cc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)c(C)c1	ZINC000819094600	FG	On-Demand	Clean	ADRB2	27	44
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCc2cccnc2)c(Cl)c1	ZINC000819094601	FH	On-Demand	Anodyne	EGFR	46	44
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCc2cccnc2)c(Cl)c1	ZINC000819094601	FH	On-Demand	Anodyne	ERBB2	72	44
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCc2cccnc2)c(Cl)c1	ZINC000819094601	FH	On-Demand	Anodyne	CHRNA7	38	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCc2cccnc2)c(Cl)c1	ZINC000819094602	FH	On-Demand	Anodyne	EGFR	46	44
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCc2cccnc2)c(Cl)c1	ZINC000819094602	FH	On-Demand	Anodyne	ERBB2	72	44
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCc2cccnc2)c(Cl)c1	ZINC000819094602	FH	On-Demand	Anodyne	CHRNA7	38	41
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCc2cccnc2)c(Cl)c1	ZINC000819094603	FH	On-Demand	Anodyne	EGFR	46	44
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCc2cccnc2)c(Cl)c1	ZINC000819094603	FH	On-Demand	Anodyne	ERBB2	72	44
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCc2cccnc2)c(Cl)c1	ZINC000819094603	FH	On-Demand	Anodyne	CHRNA7	38	41
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCc2cccnc2)c(Cl)c1	ZINC000819094604	FH	On-Demand	Anodyne	EGFR	46	44
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCc2cccnc2)c(Cl)c1	ZINC000819094604	FH	On-Demand	Anodyne	ERBB2	72	44
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCc2cccnc2)c(Cl)c1	ZINC000819094604	FH	On-Demand	Anodyne	CHRNA7	38	41
COc1cccc(CS(=O)(=O)N2CC[C@](O)(C(=O)O)C2)c1	ZINC000819094605	DC	On-Demand	Anodyne	DRD4	42	32
COc1cccc(CS(=O)(=O)N2CC[C@](O)(C(=O)O)C2)c1	ZINC000819094605	DC	On-Demand	Anodyne	MMP13	21	42
COc1cccc(CS(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)c1	ZINC000819094608	DC	On-Demand	Anodyne	DRD4	42	32
COc1cccc(CS(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)c1	ZINC000819094608	DC	On-Demand	Anodyne	MMP13	21	42
O[C@H](CNCc1ccc(N2CC=CC2)cc1)CN1CCc2ccccc2C1	ZINC000819094623	FF	On-Demand	Clean	NOD2	40	34
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)CN1CCc2ccccc2C1	ZINC000819094627	FF	On-Demand	Clean	NOD2	40	34
CC[C@@H](NC(=O)C[S@@](=O)c1cccc(OC)c1)c1ccccc1OC	ZINC000819094633	FG	On-Demand	Anodyne	MTNR1A	31	40
CC[C@@H](NC(=O)C[S@@](=O)c1cccc(OC)c1)c1ccccc1OC	ZINC000819094633	FG	On-Demand	Anodyne	MTNR1B	35	40
CC[C@H](NC(=O)C[S@](=O)c1cccc(OC)c1)c1ccccc1OC	ZINC000819094634	FG	On-Demand	Anodyne	MTNR1A	31	40
CC[C@H](NC(=O)C[S@](=O)c1cccc(OC)c1)c1ccccc1OC	ZINC000819094634	FG	On-Demand	Anodyne	MTNR1B	35	40
CC[C@@H](NC(=O)C[S@](=O)c1cccc(OC)c1)c1ccccc1OC	ZINC000819094636	FG	On-Demand	Anodyne	MTNR1A	31	40
CC[C@@H](NC(=O)C[S@](=O)c1cccc(OC)c1)c1ccccc1OC	ZINC000819094636	FG	On-Demand	Anodyne	MTNR1B	35	40
CC[C@H](NC(=O)C[S@@](=O)c1cccc(OC)c1)c1ccccc1OC	ZINC000819094637	FG	On-Demand	Anodyne	MTNR1A	31	40
CC[C@H](NC(=O)C[S@@](=O)c1cccc(OC)c1)c1ccccc1OC	ZINC000819094637	FG	On-Demand	Anodyne	MTNR1B	35	40
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc2ccccc2c1	ZINC000819094647	FH	On-Demand	Clean	ADRB2	50	53
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc2ccccc2c1	ZINC000819094647	FH	On-Demand	Clean	ADRB1	69	43
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc2ccccc2c1	ZINC000819094647	FH	On-Demand	Clean	ADRB3	49	43
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc2ccccc2c1	ZINC000819094647	FH	On-Demand	Clean	CASR	41	37
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc2ccccc2c1	ZINC000819094649	FH	On-Demand	Clean	ADRB2	50	53
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc2ccccc2c1	ZINC000819094649	FH	On-Demand	Clean	ADRB1	69	43
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc2ccccc2c1	ZINC000819094649	FH	On-Demand	Clean	ADRB3	49	43
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc2ccccc2c1	ZINC000819094649	FH	On-Demand	Clean	CASR	41	37
O=C(O)[C@@]1(O)CCN(S(=O)(=O)CCc2cccc(Cl)c2)C1	ZINC000819094654	EC	On-Demand	Anodyne	SLC6A9	44	39
O=C(O)[C@]1(O)CCN(S(=O)(=O)CCc2cccc(Cl)c2)C1	ZINC000819094655	EC	On-Demand	Anodyne	SLC6A9	44	39
C=CCCn1cc(C(=O)Nc2ccc(OC)c(NC(=O)OC(C)(C)C)c2)nn1	ZINC000819094666	GG	On-Demand	Mild	ENPP1	65	30
C/C=C\c1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)c(OC)c1	ZINC000819094672	GH	On-Demand	Clean	ADRB2	17	59
C/C=C/c1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)c(OC)c1	ZINC000819094675	GH	On-Demand	Clean	ADRB2	17	59
C/C=C\c1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)c(OC)c1	ZINC000819094679	GH	On-Demand	Clean	ADRB2	17	59
Cc1ccc2cc(S(=O)(=O)N3CC[C@@](O)(C(=O)O)C3)ccc2c1	ZINC000819094680	ED	On-Demand	Anodyne	AKR1C3	42	40
C/C=C/c1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)c(OC)c1	ZINC000819094681	GH	On-Demand	Clean	ADRB2	17	59
Cc1ccc2cc(S(=O)(=O)N3CC[C@](O)(C(=O)O)C3)ccc2c1	ZINC000819094683	ED	On-Demand	Anodyne	AKR1C3	42	40
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc3c(c2)COC3)C1	ZINC000819094708	DB	On-Demand	Anodyne	AKR1C3	51	35
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc3c(c2)COC3)C1	ZINC000819094709	DB	On-Demand	Anodyne	AKR1C3	51	35
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCC(F)(F)F)cc2)C1	ZINC000819094749	FC	On-Demand	Anodyne	ADAM17	43	40
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc(Cl)cc1	ZINC000819094753	FG	On-Demand	Clean	ADRB2	47	47
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc(Cl)cc1	ZINC000819094753	FG	On-Demand	Clean	ADRB1	77	47
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc(Cl)cc1	ZINC000819094753	FG	On-Demand	Clean	GRIN1	26	47
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc(Cl)cc1	ZINC000819094753	FG	On-Demand	Clean	ADRB3	52	47
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc(Cl)cc1	ZINC000819094754	FG	On-Demand	Clean	ADRB2	47	47
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc(Cl)cc1	ZINC000819094754	FG	On-Demand	Clean	ADRB1	77	47
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc(Cl)cc1	ZINC000819094754	FG	On-Demand	Clean	GRIN1	26	47
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc(Cl)cc1	ZINC000819094754	FG	On-Demand	Clean	ADRB3	52	47
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094762	FF	On-Demand	Clean	ADRB2	52	44
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094762	FF	On-Demand	Clean	ADRB1	85	44
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094762	FF	On-Demand	Clean	ADRB3	60	44
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094762	FF	On-Demand	Clean	ABCB1	33	54
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094763	FF	On-Demand	Clean	ADRB2	52	44
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094763	FF	On-Demand	Clean	ADRB1	85	44
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094763	FF	On-Demand	Clean	ADRB3	60	44
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819094763	FF	On-Demand	Clean	ABCB1	33	54
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1Cl	ZINC000819094768	FG	On-Demand	Clean	ADRB2	32	48
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1Cl	ZINC000819094768	FG	On-Demand	Clean	ADRB1	45	37
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1Cl	ZINC000819094768	FG	On-Demand	Clean	ABCB1	41	36
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1Cl	ZINC000819094769	FG	On-Demand	Clean	ADRB2	32	48
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1Cl	ZINC000819094769	FG	On-Demand	Clean	ADRB1	45	37
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1Cl	ZINC000819094769	FG	On-Demand	Clean	ABCB1	41	36
CN(C)S(=O)(=O)c1cccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)c1	ZINC000819094781	GB	On-Demand	Anodyne	AKR1C3	62	40
CN(C)S(=O)(=O)c1cccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)c1	ZINC000819094782	GB	On-Demand	Anodyne	AKR1C3	62	40
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)c1ccc(Cl)cc1	ZINC000819094785	EH	On-Demand	Clean	DPP7	25	43
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCC(F)(F)F)cc2)C1	ZINC000819094796	FC	On-Demand	Anodyne	ADAM17	43	40
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COCc1ccccc1	ZINC000819094797	EF	On-Demand	Clean	ADRB1	18	41
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COCc1ccccc1	ZINC000819094799	EF	On-Demand	Clean	ADRB1	18	41
CCOc1cccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)c1	ZINC000819094814	DC	On-Demand	Anodyne	AKR1C3	57	38
CCOc1cccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)c1	ZINC000819094816	DC	On-Demand	Anodyne	AKR1C3	57	38
CS(=O)(=O)Nc1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)cc1F	ZINC000819094819	GB	On-Demand	Anodyne	TRPV1	101	39
CS(=O)(=O)Nc1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)cc1F	ZINC000819094822	GB	On-Demand	Anodyne	TRPV1	101	39
O=C(O)[C@@]1(O)CCN(S(=O)(=O)CCc2ccccc2[N+](=O)[O-])C1	ZINC000819094833	EB	On-Demand	Bother	COLA	100	35
O=C(O)[C@]1(O)CCN(S(=O)(=O)CCc2ccccc2[N+](=O)[O-])C1	ZINC000819094835	EB	On-Demand	Bother	COLA	100	35
CCCOc1cccc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)c1	ZINC000819094837	EG	On-Demand	Anodyne	EPHX2	22	41
CCCOc1cccc(NC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)c1	ZINC000819094840	EG	On-Demand	Anodyne	EPHX2	22	41
O=C(Nc1cccc(OCC(F)(F)F)c1)C(F)=C1CCC1	ZINC000819094842	DH	On-Demand	Anodyne	EPHX2	21	45
O=C(Nc1cccc(OCC(F)(F)F)c1)C(F)=C1CCC1	ZINC000819094842	DH	On-Demand	Anodyne	TAAR1	30	41
O[C@H](CNCc1cc(F)ccc1N1CCOCC1)c1cccnc1	ZINC000819094854	ED	On-Demand	Anodyne	ADRB3	76	42
O[C@@H](CNCc1cc(F)ccc1N1CCOCC1)c1cccnc1	ZINC000819094856	ED	On-Demand	Anodyne	ADRB3	76	42
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1	ZINC000819094861	DF	On-Demand	Clean	ADRB2	60	53
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1	ZINC000819094861	DF	On-Demand	Clean	ADRB1	84	51
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1	ZINC000819094861	DF	On-Demand	Clean	ADRB3	59	51
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1	ZINC000819094861	DF	On-Demand	Clean	ABCB1	29	40
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1	ZINC000819094862	DF	On-Demand	Clean	ADRB2	60	53
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1	ZINC000819094862	DF	On-Demand	Clean	ADRB1	84	51
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1	ZINC000819094862	DF	On-Demand	Clean	ADRB3	59	51
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1	ZINC000819094862	DF	On-Demand	Clean	ABCB1	29	40
COc1ccc(Cl)cc1S(=O)(=O)N1CC[C@](O)(C(=O)O)C1	ZINC000819094866	EC	On-Demand	Anodyne	CPT1A	99	46
COc1ccc(Cl)cc1S(=O)(=O)N1CC[C@](O)(C(=O)O)C1	ZINC000819094866	EC	On-Demand	Anodyne	CPT2	59	44
COc1ccc(Cl)cc1S(=O)(=O)N1CC[C@](O)(C(=O)O)C1	ZINC000819094866	EC	On-Demand	Anodyne	CPT1B	94	44
COc1ccc(Cl)cc1S(=O)(=O)N1CC[C@@](O)(C(=O)O)C1	ZINC000819094868	EC	On-Demand	Anodyne	CPT1A	99	46
COc1ccc(Cl)cc1S(=O)(=O)N1CC[C@@](O)(C(=O)O)C1	ZINC000819094868	EC	On-Demand	Anodyne	CPT2	59	44
COc1ccc(Cl)cc1S(=O)(=O)N1CC[C@@](O)(C(=O)O)C1	ZINC000819094868	EC	On-Demand	Anodyne	CPT1B	94	44
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819094881	GB	On-Demand	Anodyne	TGM2	42	37
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819094881	GB	On-Demand	Anodyne	F13A1	45	37
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819094881	GB	On-Demand	Anodyne	SFRP1	92	40
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819094881	GB	On-Demand	Anodyne	WNT3	42	31
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819094882	GB	On-Demand	Anodyne	TGM2	42	37
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819094882	GB	On-Demand	Anodyne	F13A1	45	37
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819094882	GB	On-Demand	Anodyne	SFRP1	92	40
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819094882	GB	On-Demand	Anodyne	WNT3	42	31
COc1ccc(OC)c([C@H](O)CNCCc2cc(C)cc(C)c2)c1	ZINC000819094886	EG	On-Demand	Anodyne	ADRB2	47	56
COc1ccc(OC)c([C@H](O)CNCCc2cc(C)cc(C)c2)c1	ZINC000819094886	EG	On-Demand	Anodyne	ADRB1	47	43
COc1ccc(OC)c([C@H](O)CNCCc2cc(C)cc(C)c2)c1	ZINC000819094886	EG	On-Demand	Anodyne	ADRB3	39	43
CCOC(=O)N[C@@H](CNC(=O)c1coc(=O)c2ccccc12)CC(C)C	ZINC000819094911	FF	On-Demand	Anodyne	CAPNS1	54	34
CCOC(=O)N[C@@H](CNC(=O)c1coc(=O)c2ccccc12)CC(C)C	ZINC000819094911	FF	On-Demand	Anodyne	HLA-DRB1	44	35
CCOC(=O)N[C@@H](CNC(=O)c1coc(=O)c2ccccc12)CC(C)C	ZINC000819094911	FF	On-Demand	Anodyne	CAPN1	62	35
CCOC(=O)N[C@@H](CNC(=O)c1coc(=O)c2ccccc12)CC(C)C	ZINC000819094911	FF	On-Demand	Anodyne	CAPN2	118	38
CCOC(=O)N[C@@H](CNC(=O)c1coc(=O)c2ccccc12)CC(C)C	ZINC000819094911	FF	On-Demand	Anodyne	NPR	47	32
CCOC(=O)N[C@H](CNC(=O)c1coc(=O)c2ccccc12)CC(C)C	ZINC000819094912	FF	On-Demand	Anodyne	CAPNS1	54	34
CCOC(=O)N[C@H](CNC(=O)c1coc(=O)c2ccccc12)CC(C)C	ZINC000819094912	FF	On-Demand	Anodyne	HLA-DRB1	44	35
CCOC(=O)N[C@H](CNC(=O)c1coc(=O)c2ccccc12)CC(C)C	ZINC000819094912	FF	On-Demand	Anodyne	CAPN1	62	35
CCOC(=O)N[C@H](CNC(=O)c1coc(=O)c2ccccc12)CC(C)C	ZINC000819094912	FF	On-Demand	Anodyne	CAPN2	118	38
CCOC(=O)N[C@H](CNC(=O)c1coc(=O)c2ccccc12)CC(C)C	ZINC000819094912	FF	On-Demand	Anodyne	NPR	47	32
COc1ccc(OC)c([C@H](O)CNCc2cc(F)ccc2N2CCOCC2)c1	ZINC000819094923	GF	On-Demand	Anodyne	TNIK	19	41
CCCOc1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819094924	CG	On-Demand	Anodyne	EPHX2	21	42
CCCOc1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819094925	CG	On-Demand	Anodyne	EPHX2	21	42
CCCOc1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819094926	CG	On-Demand	Anodyne	EPHX2	21	42
CCCOc1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819094927	CG	On-Demand	Anodyne	EPHX2	21	42
Cn1ncnc1COc1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)cc1	ZINC000819094933	GB	On-Demand	Anodyne	ADAM17	52	38
Cn1ncnc1COc1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)cc1	ZINC000819094934	GB	On-Demand	Anodyne	ADAM17	52	38
O=C1CCCc2cc(S(=O)(=O)N3CC[C@@](O)(C(=O)O)C3)ccc21	ZINC000819094945	EC	On-Demand	Anodyne	AKR1C3	54	36
O=C1CCCc2cc(S(=O)(=O)N3CC[C@](O)(C(=O)O)C3)ccc21	ZINC000819094946	EC	On-Demand	Anodyne	AKR1C3	54	36
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1ccc(N2CC=CC2)cc1	ZINC000819094952	FF	On-Demand	Clean	ADRB2	24	41
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1ccc(N2CC=CC2)cc1	ZINC000819094952	FF	On-Demand	Clean	ADRB1	47	37
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1ccc(N2CC=CC2)cc1	ZINC000819094952	FF	On-Demand	Clean	ADRB3	18	41
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1ccc(N2CC=CC2)cc1	ZINC000819094953	FF	On-Demand	Clean	ADRB2	24	41
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1ccc(N2CC=CC2)cc1	ZINC000819094953	FF	On-Demand	Clean	ADRB1	47	37
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1ccc(N2CC=CC2)cc1	ZINC000819094953	FF	On-Demand	Clean	ADRB3	18	41
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)c1ccc(OC(F)(F)F)cc1	ZINC000819094954	GH	On-Demand	Clean	ADRB2	15	40
O[C@H](CNCc1ccc(N2CC=CC2)cc1)c1ccc(OC(F)(F)F)cc1	ZINC000819094955	GH	On-Demand	Clean	ADRB2	15	40
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)c1cccc(Cl)c1	ZINC000819094956	EH	On-Demand	Clean	ADRB2	31	40
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)c1cccc(Cl)c1	ZINC000819094956	EH	On-Demand	Clean	ADRB1	45	47
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)c1cccc(Cl)c1	ZINC000819094956	EH	On-Demand	Clean	ADRB3	56	47
O[C@H](CNCc1ccc(N2CC=CC2)cc1)c1cccc(Cl)c1	ZINC000819094957	EH	On-Demand	Clean	ADRB2	31	40
O[C@H](CNCc1ccc(N2CC=CC2)cc1)c1cccc(Cl)c1	ZINC000819094957	EH	On-Demand	Clean	ADRB1	45	47
O[C@H](CNCc1ccc(N2CC=CC2)cc1)c1cccc(Cl)c1	ZINC000819094957	EH	On-Demand	Clean	ADRB3	56	47
NC(=O)C1CCN(C(=O)c2ccccc2NC(=O)C(F)=C2CCC2)CC1	ZINC000819094966	FE	On-Demand	Anodyne	L3MBTL3	53	42
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc(F)cc1	ZINC000819094988	EF	On-Demand	Clean	ADRB2	51	47
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc(F)cc1	ZINC000819094988	EF	On-Demand	Clean	ADRB1	82	47
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc(F)cc1	ZINC000819094988	EF	On-Demand	Clean	GRIN1	15	47
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc(F)cc1	ZINC000819094988	EF	On-Demand	Clean	ADRB3	55	47
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc(F)cc1	ZINC000819094988	EF	On-Demand	Clean	ABCB1	18	46
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc(F)cc1	ZINC000819094989	EF	On-Demand	Clean	ADRB2	51	47
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc(F)cc1	ZINC000819094989	EF	On-Demand	Clean	ADRB1	82	47
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc(F)cc1	ZINC000819094989	EF	On-Demand	Clean	GRIN1	15	47
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc(F)cc1	ZINC000819094989	EF	On-Demand	Clean	ADRB3	55	47
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc(F)cc1	ZINC000819094989	EF	On-Demand	Clean	ABCB1	18	46
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2cccc(S(=O)(=O)NC3CC3)c2)C1	ZINC000819095004	GB	On-Demand	Anodyne	AKR1C3	57	38
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2cccc(S(=O)(=O)NC3CC3)c2)C1	ZINC000819095004	GB	On-Demand	Anodyne	SFRP1	123	43
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2cccc(S(=O)(=O)NC3CC3)c2)C1	ZINC000819095004	GB	On-Demand	Anodyne	WNT3	78	33
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2cccc(S(=O)(=O)NC3CC3)c2)C1	ZINC000819095005	GB	On-Demand	Anodyne	AKR1C3	57	38
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2cccc(S(=O)(=O)NC3CC3)c2)C1	ZINC000819095005	GB	On-Demand	Anodyne	SFRP1	123	43
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2cccc(S(=O)(=O)NC3CC3)c2)C1	ZINC000819095005	GB	On-Demand	Anodyne	WNT3	78	33
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095028	FE	On-Demand	Clean	ADRB3	52	37
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095029	FE	On-Demand	Clean	ADRB3	52	37
CCOc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095036	FF	On-Demand	Clean	ADRB2	57	48
CCOc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095036	FF	On-Demand	Clean	ADRB1	80	48
CCOc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095036	FF	On-Demand	Clean	ADRB3	54	44
CCOc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095037	FF	On-Demand	Clean	ADRB2	57	48
CCOc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095037	FF	On-Demand	Clean	ADRB1	80	48
CCOc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095037	FF	On-Demand	Clean	ADRB3	54	44
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1cccc2ccccc12	ZINC000819095043	FH	On-Demand	Clean	ADRB2	40	58
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1cccc2ccccc12	ZINC000819095043	FH	On-Demand	Clean	ADRB1	52	36
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1cccc2ccccc12	ZINC000819095043	FH	On-Demand	Clean	ADRB3	27	53
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1cccc2ccccc12	ZINC000819095043	FH	On-Demand	Clean	ABCB1	45	39
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1cccc2ccccc12	ZINC000819095044	FH	On-Demand	Clean	ADRB2	40	58
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1cccc2ccccc12	ZINC000819095044	FH	On-Demand	Clean	ADRB1	52	36
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1cccc2ccccc12	ZINC000819095044	FH	On-Demand	Clean	ADRB3	27	53
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1cccc2ccccc12	ZINC000819095044	FH	On-Demand	Clean	ABCB1	45	39
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCC(F)F)cc2)C1	ZINC000819095053	FC	On-Demand	Anodyne	ADAM17	50	40
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCC(F)F)cc2)C1	ZINC000819095053	FC	On-Demand	Anodyne	F13A1	40	33
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCC(F)F)cc2)C1	ZINC000819095054	FC	On-Demand	Anodyne	ADAM17	50	40
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCC(F)F)cc2)C1	ZINC000819095054	FC	On-Demand	Anodyne	F13A1	40	33
CCOc1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)c(C)c1	ZINC000819095088	EC	On-Demand	Anodyne	TRPV4	47	37
CCOc1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)c(C)c1	ZINC000819095089	EC	On-Demand	Anodyne	TRPV4	47	37
Cc1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)cc1Br	ZINC000819095095	FC	On-Demand	Anodyne	AKR1C3	40	35
Cc1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)cc1Br	ZINC000819095096	FC	On-Demand	Anodyne	AKR1C3	40	35
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2cc(Cl)ccc2OCC2CCC2)C1	ZINC000819095106	GD	On-Demand	Anodyne	TRPV4	46	40
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2cc(Cl)ccc2OCC2CCC2)C1	ZINC000819095107	GD	On-Demand	Anodyne	TRPV4	46	40
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(OCC(F)(F)F)nc2)C1	ZINC000819095108	FC	On-Demand	Anodyne	GCK	55	32
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(OCC(F)(F)F)nc2)C1	ZINC000819095109	FC	On-Demand	Anodyne	GCK	55	32
CSc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095179	FG	On-Demand	Clean	ADRB2	45	43
CSc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095179	FG	On-Demand	Clean	ADRB1	72	43
CSc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095179	FG	On-Demand	Clean	ADRB3	48	42
CSc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095180	FG	On-Demand	Clean	ADRB2	45	43
CSc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095180	FG	On-Demand	Clean	ADRB1	72	43
CSc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095180	FG	On-Demand	Clean	ADRB3	48	42
O=C(O)c1cccc2c1CCN(S(=O)(=O)c1ccc3c(c1)CCCC3)C2	ZINC000819095197	FG	On-Demand	Anodyne	AKR1C3	94	58
O=C(O)c1cccc2c1CCN(S(=O)(=O)c1ccc3c(c1)CCCC3)C2	ZINC000819095197	FG	On-Demand	Anodyne	AKR1C1	15	50
COc1cccc([S@@](=O)CC(=O)NCc2ccc(OC(C)C)c(OC)c2)c1	ZINC000819095203	GF	On-Demand	Anodyne	MTNR1A	34	40
COc1cccc([S@@](=O)CC(=O)NCc2ccc(OC(C)C)c(OC)c2)c1	ZINC000819095203	GF	On-Demand	Anodyne	MTNR1B	37	40
C[C@H](CNC[C@@H](O)COc1cccc(Br)c1)CC1(C)OCCO1	ZINC000819095206	GF	On-Demand	Anodyne	ADRB2	30	44
C[C@H](CNC[C@@H](O)COc1cccc(Br)c1)CC1(C)OCCO1	ZINC000819095206	GF	On-Demand	Anodyne	ADRB1	34	41
C[C@@H](CNC[C@H](O)COc1cccc(Br)c1)CC1(C)OCCO1	ZINC000819095207	GF	On-Demand	Anodyne	ADRB2	30	44
C[C@@H](CNC[C@H](O)COc1cccc(Br)c1)CC1(C)OCCO1	ZINC000819095207	GF	On-Demand	Anodyne	ADRB1	34	41
C[C@@H](CNC[C@@H](O)COc1cccc(Br)c1)CC1(C)OCCO1	ZINC000819095208	GF	On-Demand	Anodyne	ADRB2	30	44
C[C@@H](CNC[C@@H](O)COc1cccc(Br)c1)CC1(C)OCCO1	ZINC000819095208	GF	On-Demand	Anodyne	ADRB1	34	41
C[C@H](CNC[C@H](O)COc1cccc(Br)c1)CC1(C)OCCO1	ZINC000819095209	GF	On-Demand	Anodyne	ADRB2	30	44
C[C@H](CNC[C@H](O)COc1cccc(Br)c1)CC1(C)OCCO1	ZINC000819095209	GF	On-Demand	Anodyne	ADRB1	34	41
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1OCc1ccncc1	ZINC000819095227	FG	On-Demand	Anodyne	ENPP1	57	32
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1OCc1ccncc1	ZINC000819095228	FG	On-Demand	Anodyne	ENPP1	57	32
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1OCc1ccncc1	ZINC000819095229	FG	On-Demand	Anodyne	ENPP1	57	32
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1OCc1ccncc1	ZINC000819095230	FG	On-Demand	Anodyne	ENPP1	57	32
COc1cc(CNC(=O)Cc2ccc(-n3cnnc3)cc2)ccc1OC(C)C	ZINC000819095245	GF	On-Demand	Anodyne	TRPV1	15	42
COc1cc(CNC(=O)Cc2ccc(-n3cnnc3)cc2)ccc1OC(C)C	ZINC000819095245	GF	On-Demand	Anodyne	MT-ND1	22	40
C[C@H](CNC[C@H](O)COc1ccccc1[N+](=O)[O-])CC1(C)OCCO1	ZINC000819095271	FD	On-Demand	Bother	ADRB2	21	42
C[C@H](CNC[C@H](O)COc1ccccc1[N+](=O)[O-])CC1(C)OCCO1	ZINC000819095271	FD	On-Demand	Bother	ADRB1	53	34
C[C@@H](CNC[C@H](O)COc1ccccc1[N+](=O)[O-])CC1(C)OCCO1	ZINC000819095272	FD	On-Demand	Bother	ADRB2	21	42
C[C@@H](CNC[C@H](O)COc1ccccc1[N+](=O)[O-])CC1(C)OCCO1	ZINC000819095272	FD	On-Demand	Bother	ADRB1	53	34
C[C@H](CNC[C@@H](O)COc1ccccc1[N+](=O)[O-])CC1(C)OCCO1	ZINC000819095273	FD	On-Demand	Bother	ADRB2	21	42
C[C@H](CNC[C@@H](O)COc1ccccc1[N+](=O)[O-])CC1(C)OCCO1	ZINC000819095273	FD	On-Demand	Bother	ADRB1	53	34
C[C@@H](CNC[C@@H](O)COc1ccccc1[N+](=O)[O-])CC1(C)OCCO1	ZINC000819095274	FD	On-Demand	Bother	ADRB2	21	42
C[C@@H](CNC[C@@H](O)COc1ccccc1[N+](=O)[O-])CC1(C)OCCO1	ZINC000819095274	FD	On-Demand	Bother	ADRB1	53	34
O[C@H](CNCc1nc(C(F)(F)F)cs1)c1cccnc1	ZINC000819095275	DE	On-Demand	Anodyne	ADRB2	24	46
O[C@H](CNCc1nc(C(F)(F)F)cs1)c1cccnc1	ZINC000819095275	DE	On-Demand	Anodyne	ADRB1	25	56
O[C@H](CNCc1nc(C(F)(F)F)cs1)c1cccnc1	ZINC000819095275	DE	On-Demand	Anodyne	ADRB3	101	56
O[C@@H](CNCc1nc(C(F)(F)F)cs1)c1cccnc1	ZINC000819095276	DE	On-Demand	Anodyne	ADRB2	24	46
O[C@@H](CNCc1nc(C(F)(F)F)cs1)c1cccnc1	ZINC000819095276	DE	On-Demand	Anodyne	ADRB1	25	56
O[C@@H](CNCc1nc(C(F)(F)F)cs1)c1cccnc1	ZINC000819095276	DE	On-Demand	Anodyne	ADRB3	101	56
COc1cc(CNC(=O)C(F)=C2CCC2)ccc1OC(C)C	ZINC000819095292	DH	On-Demand	Anodyne	MT-ND1	23	41
C#CCSCCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819095305	DD	On-Demand	Mild	ADRB2	27	42
C#CCSCCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819095305	DD	On-Demand	Mild	ADRB1	61	42
C#CCSCCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819095305	DD	On-Demand	Mild	ADRB3	15	41
C#CCSCCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819095306	DD	On-Demand	Mild	ADRB2	27	42
C#CCSCCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819095306	DD	On-Demand	Mild	ADRB1	61	42
C#CCSCCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819095306	DD	On-Demand	Mild	ADRB3	15	41
C[C@H](CNC[C@@H](O)COc1ccc(F)cc1)CC1(C)OCCO1	ZINC000819095310	ED	On-Demand	Anodyne	ADRB2	43	45
C[C@H](CNC[C@@H](O)COc1ccc(F)cc1)CC1(C)OCCO1	ZINC000819095310	ED	On-Demand	Anodyne	ADRB1	62	41
C[C@H](CNC[C@@H](O)COc1ccc(F)cc1)CC1(C)OCCO1	ZINC000819095310	ED	On-Demand	Anodyne	ADRB3	33	41
C[C@@H](CNC[C@H](O)COc1ccc(F)cc1)CC1(C)OCCO1	ZINC000819095311	ED	On-Demand	Anodyne	ADRB2	43	45
C[C@@H](CNC[C@H](O)COc1ccc(F)cc1)CC1(C)OCCO1	ZINC000819095311	ED	On-Demand	Anodyne	ADRB1	62	41
C[C@@H](CNC[C@H](O)COc1ccc(F)cc1)CC1(C)OCCO1	ZINC000819095311	ED	On-Demand	Anodyne	ADRB3	33	41
C[C@@H](CNC[C@@H](O)COc1ccc(F)cc1)CC1(C)OCCO1	ZINC000819095312	ED	On-Demand	Anodyne	ADRB2	43	45
C[C@@H](CNC[C@@H](O)COc1ccc(F)cc1)CC1(C)OCCO1	ZINC000819095312	ED	On-Demand	Anodyne	ADRB1	62	41
C[C@@H](CNC[C@@H](O)COc1ccc(F)cc1)CC1(C)OCCO1	ZINC000819095312	ED	On-Demand	Anodyne	ADRB3	33	41
C[C@H](CNC[C@H](O)COc1ccc(F)cc1)CC1(C)OCCO1	ZINC000819095313	ED	On-Demand	Anodyne	ADRB2	43	45
C[C@H](CNC[C@H](O)COc1ccc(F)cc1)CC1(C)OCCO1	ZINC000819095313	ED	On-Demand	Anodyne	ADRB1	62	41
C[C@H](CNC[C@H](O)COc1ccc(F)cc1)CC1(C)OCCO1	ZINC000819095313	ED	On-Demand	Anodyne	ADRB3	33	41
C#CCSCCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819095329	DD	On-Demand	Mild	ADRB2	41	47
C#CCSCCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819095329	DD	On-Demand	Mild	ADRB1	73	47
C#CCSCCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819095329	DD	On-Demand	Mild	ADRB3	42	47
C#CCSCCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819095330	DD	On-Demand	Mild	ADRB2	41	47
C#CCSCCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819095330	DD	On-Demand	Mild	ADRB1	73	47
C#CCSCCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819095330	DD	On-Demand	Mild	ADRB3	42	47
COc1cccc([S@@](=O)CC(=O)NNC(=O)C2CCCC2)c1	ZINC000819095352	DD	On-Demand	Reactive	DRD4	41	31
COc1cccc([S@@](=O)CC(=O)NNC(=O)C2CCCC2)c1	ZINC000819095352	DD	On-Demand	Reactive	NQO2	22	41
COc1cccc([S@@](=O)CC(=O)NNC(=O)C2CCCC2)c1	ZINC000819095352	DD	On-Demand	Reactive	MTNR1A	42	44
COc1cccc([S@@](=O)CC(=O)NNC(=O)C2CCCC2)c1	ZINC000819095352	DD	On-Demand	Reactive	MTNR1B	45	47
C[C@H](CNC[C@H](O)COc1ccccc1C(F)(F)F)CC1(C)OCCO1	ZINC000819095370	GF	On-Demand	Anodyne	ADRB2	23	45
C[C@H](CNC[C@H](O)COc1ccccc1C(F)(F)F)CC1(C)OCCO1	ZINC000819095370	GF	On-Demand	Anodyne	ADRB1	54	33
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2cc(Cl)ccc2OC(F)F)C1	ZINC000819095417	FD	On-Demand	Anodyne	CPT1A	49	36
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2cc(Cl)ccc2OC(F)F)C1	ZINC000819095417	FD	On-Demand	Anodyne	CPT2	42	36
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2cc(Cl)ccc2OC(F)F)C1	ZINC000819095417	FD	On-Demand	Anodyne	CPT1B	47	35
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2cc(Cl)ccc2OC(F)F)C1	ZINC000819095418	FD	On-Demand	Anodyne	CPT1A	49	36
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2cc(Cl)ccc2OC(F)F)C1	ZINC000819095418	FD	On-Demand	Anodyne	CPT2	42	36
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2cc(Cl)ccc2OC(F)F)C1	ZINC000819095418	FD	On-Demand	Anodyne	CPT1B	47	35
CC(C)c1cccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)c1	ZINC000819095429	DD	On-Demand	Anodyne	AKR1C3	62	40
CC(C)c1cccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)c1	ZINC000819095430	DD	On-Demand	Anodyne	AKR1C3	62	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(CN3CCCCC3)c1)C2	ZINC000819095460	GG	On-Demand	Anodyne	HRH2	48	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(CN3CCCCC3)c1)C2	ZINC000819095460	GG	On-Demand	Anodyne	SIGMAR1	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(CN3CCCCC3)c1)C2	ZINC000819095461	GG	On-Demand	Anodyne	HRH2	48	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(CN3CCCCC3)c1)C2	ZINC000819095461	GG	On-Demand	Anodyne	SIGMAR1	15	41
CCOc1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)c2ccccc12	ZINC000819095470	FD	On-Demand	Anodyne	CCR8	20	43
CCOc1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)c2ccccc12	ZINC000819095470	FD	On-Demand	Anodyne	HCN1	43	31
C[C@@H](CNC[C@H](O)COc1ccccc1C(F)(F)F)CC1(C)OCCO1	ZINC000819095471	GF	On-Demand	Anodyne	ADRB2	23	45
C[C@@H](CNC[C@H](O)COc1ccccc1C(F)(F)F)CC1(C)OCCO1	ZINC000819095471	GF	On-Demand	Anodyne	ADRB1	54	33
C[C@H](CNC[C@@H](O)COc1ccccc1C(F)(F)F)CC1(C)OCCO1	ZINC000819095472	GF	On-Demand	Anodyne	ADRB2	23	45
C[C@H](CNC[C@@H](O)COc1ccccc1C(F)(F)F)CC1(C)OCCO1	ZINC000819095472	GF	On-Demand	Anodyne	ADRB1	54	33
C[C@@H](CNC[C@@H](O)COc1ccccc1C(F)(F)F)CC1(C)OCCO1	ZINC000819095473	GF	On-Demand	Anodyne	ADRB2	23	45
C[C@@H](CNC[C@@H](O)COc1ccccc1C(F)(F)F)CC1(C)OCCO1	ZINC000819095473	GF	On-Demand	Anodyne	ADRB1	54	33
C[C@H](CNC[C@@H](O)COc1ccc(Br)cc1)CC1(C)OCCO1	ZINC000819095478	GF	On-Demand	Anodyne	ADRB2	35	45
C[C@H](CNC[C@@H](O)COc1ccc(Br)cc1)CC1(C)OCCO1	ZINC000819095478	GF	On-Demand	Anodyne	ADRB1	50	41
C[C@H](CNC[C@@H](O)COc1ccc(Br)cc1)CC1(C)OCCO1	ZINC000819095478	GF	On-Demand	Anodyne	ADRB3	28	41
C[C@@H](CNC[C@H](O)COc1ccc(Br)cc1)CC1(C)OCCO1	ZINC000819095479	GF	On-Demand	Anodyne	ADRB2	35	45
C[C@@H](CNC[C@H](O)COc1ccc(Br)cc1)CC1(C)OCCO1	ZINC000819095479	GF	On-Demand	Anodyne	ADRB1	50	41
C[C@@H](CNC[C@H](O)COc1ccc(Br)cc1)CC1(C)OCCO1	ZINC000819095479	GF	On-Demand	Anodyne	ADRB3	28	41
C[C@@H](CNC[C@@H](O)COc1ccc(Br)cc1)CC1(C)OCCO1	ZINC000819095480	GF	On-Demand	Anodyne	ADRB2	35	45
C[C@@H](CNC[C@@H](O)COc1ccc(Br)cc1)CC1(C)OCCO1	ZINC000819095480	GF	On-Demand	Anodyne	ADRB1	50	41
C[C@@H](CNC[C@@H](O)COc1ccc(Br)cc1)CC1(C)OCCO1	ZINC000819095480	GF	On-Demand	Anodyne	ADRB3	28	41
C[C@H](CNC[C@H](O)COc1ccc(Br)cc1)CC1(C)OCCO1	ZINC000819095481	GF	On-Demand	Anodyne	ADRB2	35	45
C[C@H](CNC[C@H](O)COc1ccc(Br)cc1)CC1(C)OCCO1	ZINC000819095481	GF	On-Demand	Anodyne	ADRB1	50	41
C[C@H](CNC[C@H](O)COc1ccc(Br)cc1)CC1(C)OCCO1	ZINC000819095481	GF	On-Demand	Anodyne	ADRB3	28	41
C#CCSCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819095482	DF	On-Demand	Mild	ADRB2	37	58
C#CCSCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819095482	DF	On-Demand	Mild	ADRB1	64	40
C#CCSCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819095482	DF	On-Demand	Mild	ADRB3	21	56
C#CCSCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819095482	DF	On-Demand	Mild	CYP2D6	16	44
C#CCSCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819095483	DF	On-Demand	Mild	ADRB2	37	58
C#CCSCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819095483	DF	On-Demand	Mild	ADRB1	64	40
C#CCSCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819095483	DF	On-Demand	Mild	ADRB3	21	56
C#CCSCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819095483	DF	On-Demand	Mild	CYP2D6	16	44
C[C@@H](CNC[C@H](O)COc1ccc(C(C)(C)C)cc1)CC1(C)OCCO1	ZINC000819095487	FG	On-Demand	Anodyne	ADRB2	33	44
C[C@@H](CNC[C@H](O)COc1ccc(C(C)(C)C)cc1)CC1(C)OCCO1	ZINC000819095487	FG	On-Demand	Anodyne	ADRB1	48	39
C[C@H](CNC[C@@H](O)COc1ccc(C(C)(C)C)cc1)CC1(C)OCCO1	ZINC000819095488	FG	On-Demand	Anodyne	ADRB2	33	44
C[C@H](CNC[C@@H](O)COc1ccc(C(C)(C)C)cc1)CC1(C)OCCO1	ZINC000819095488	FG	On-Demand	Anodyne	ADRB1	48	39
C[C@@H](CNC[C@@H](O)COc1ccc(C(C)(C)C)cc1)CC1(C)OCCO1	ZINC000819095489	FG	On-Demand	Anodyne	ADRB2	33	44
C[C@@H](CNC[C@@H](O)COc1ccc(C(C)(C)C)cc1)CC1(C)OCCO1	ZINC000819095489	FG	On-Demand	Anodyne	ADRB1	48	39
C[C@H](CNC[C@H](O)COc1ccc(C(C)(C)C)cc1)CC1(C)OCCO1	ZINC000819095490	FG	On-Demand	Anodyne	ADRB2	33	44
C[C@H](CNC[C@H](O)COc1ccc(C(C)(C)C)cc1)CC1(C)OCCO1	ZINC000819095490	FG	On-Demand	Anodyne	ADRB1	48	39
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819095493	EF	On-Demand	Anodyne	HTR1A	46	47
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819095493	EF	On-Demand	Anodyne	DRD2	57	42
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819095493	EF	On-Demand	Anodyne	DRD4	56	37
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819095493	EF	On-Demand	Anodyne	ACHE	37	44
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819095493	EF	On-Demand	Anodyne	HTR2A	44	49
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819095493	EF	On-Demand	Anodyne	DRD3	74	50
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819095493	EF	On-Demand	Anodyne	HTR7	35	50
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819095493	EF	On-Demand	Anodyne	SIGMAR1	66	47
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819095493	EF	On-Demand	Anodyne	BCHE	20	44
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819095493	EF	On-Demand	Anodyne	CCR3	25	42
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819095493	EF	On-Demand	Anodyne	CACNA1G	41	38
O=C(NCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819095493	EF	On-Demand	Anodyne	NPFFR1	43	37
O[C@@H](CNCc1nc(C(F)(F)F)cs1)c1ccccc1	ZINC000819095528	DF	On-Demand	Anodyne	ADRB3	35	43
O[C@H](CNCc1nc(C(F)(F)F)cs1)c1ccccc1	ZINC000819095529	DF	On-Demand	Anodyne	ADRB3	35	43
C[C@H](CNC[C@@H](O)COc1ccc(Cl)cc1)CC1(C)OCCO1	ZINC000819095530	EE	On-Demand	Anodyne	ADRB2	36	45
C[C@H](CNC[C@@H](O)COc1ccc(Cl)cc1)CC1(C)OCCO1	ZINC000819095530	EE	On-Demand	Anodyne	ADRB1	53	41
C[C@H](CNC[C@@H](O)COc1ccc(Cl)cc1)CC1(C)OCCO1	ZINC000819095530	EE	On-Demand	Anodyne	GRIN1	15	45
C[C@H](CNC[C@@H](O)COc1ccc(Cl)cc1)CC1(C)OCCO1	ZINC000819095530	EE	On-Demand	Anodyne	ADRB3	30	41
C[C@@H](CNC[C@H](O)COc1ccc(Cl)cc1)CC1(C)OCCO1	ZINC000819095531	EE	On-Demand	Anodyne	ADRB2	36	45
C[C@@H](CNC[C@H](O)COc1ccc(Cl)cc1)CC1(C)OCCO1	ZINC000819095531	EE	On-Demand	Anodyne	ADRB1	53	41
C[C@@H](CNC[C@H](O)COc1ccc(Cl)cc1)CC1(C)OCCO1	ZINC000819095531	EE	On-Demand	Anodyne	GRIN1	15	45
C[C@@H](CNC[C@H](O)COc1ccc(Cl)cc1)CC1(C)OCCO1	ZINC000819095531	EE	On-Demand	Anodyne	ADRB3	30	41
C[C@@H](CNC[C@@H](O)COc1ccc(Cl)cc1)CC1(C)OCCO1	ZINC000819095532	EE	On-Demand	Anodyne	ADRB2	36	45
C[C@@H](CNC[C@@H](O)COc1ccc(Cl)cc1)CC1(C)OCCO1	ZINC000819095532	EE	On-Demand	Anodyne	ADRB1	53	41
C[C@@H](CNC[C@@H](O)COc1ccc(Cl)cc1)CC1(C)OCCO1	ZINC000819095532	EE	On-Demand	Anodyne	GRIN1	15	45
C[C@@H](CNC[C@@H](O)COc1ccc(Cl)cc1)CC1(C)OCCO1	ZINC000819095532	EE	On-Demand	Anodyne	ADRB3	30	41
C[C@H](CNC[C@H](O)COc1ccc(Cl)cc1)CC1(C)OCCO1	ZINC000819095533	EE	On-Demand	Anodyne	ADRB2	36	45
C[C@H](CNC[C@H](O)COc1ccc(Cl)cc1)CC1(C)OCCO1	ZINC000819095533	EE	On-Demand	Anodyne	ADRB1	53	41
C[C@H](CNC[C@H](O)COc1ccc(Cl)cc1)CC1(C)OCCO1	ZINC000819095533	EE	On-Demand	Anodyne	GRIN1	15	45
C[C@H](CNC[C@H](O)COc1ccc(Cl)cc1)CC1(C)OCCO1	ZINC000819095533	EE	On-Demand	Anodyne	ADRB3	30	41
O=C(NNC(=O)C1CCCC1)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819095534	GG	On-Demand	Reactive	CNR1	58	36
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N(C)C)c(C)c2)c1	ZINC000819095543	EF	On-Demand	Anodyne	MTNR1A	22	45
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N(C)C)c(C)c2)c1	ZINC000819095543	EF	On-Demand	Anodyne	MTNR1B	28	45
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)CC1(C)OCCO1	ZINC000819095552	DF	On-Demand	Anodyne	ADRB1	37	43
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)CC1(C)OCCO1	ZINC000819095552	DF	On-Demand	Anodyne	ADRB3	51	43
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)CC1(C)OCCO1	ZINC000819095553	DF	On-Demand	Anodyne	ADRB1	37	43
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)CC1(C)OCCO1	ZINC000819095553	DF	On-Demand	Anodyne	ADRB3	51	43
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)CC1(C)OCCO1	ZINC000819095554	DF	On-Demand	Anodyne	ADRB1	37	43
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)CC1(C)OCCO1	ZINC000819095554	DF	On-Demand	Anodyne	ADRB3	51	43
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)CC1(C)OCCO1	ZINC000819095555	DF	On-Demand	Anodyne	ADRB1	37	43
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)CC1(C)OCCO1	ZINC000819095555	DF	On-Demand	Anodyne	ADRB3	51	43
C[C@@H](CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)CC1(C)OCCO1	ZINC000819095561	GG	On-Demand	Anodyne	ADRB2	30	41
C[C@@H](CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)CC1(C)OCCO1	ZINC000819095561	GG	On-Demand	Anodyne	ADRB1	41	37
C[C@@H](CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)CC1(C)OCCO1	ZINC000819095561	GG	On-Demand	Anodyne	GRIN1	29	46
C[C@@H](CNC[C@H](O)COc1ccc(Cl)c(Cl)c1)CC1(C)OCCO1	ZINC000819095562	GG	On-Demand	Anodyne	ADRB2	30	41
C[C@@H](CNC[C@H](O)COc1ccc(Cl)c(Cl)c1)CC1(C)OCCO1	ZINC000819095562	GG	On-Demand	Anodyne	ADRB1	41	37
C[C@@H](CNC[C@H](O)COc1ccc(Cl)c(Cl)c1)CC1(C)OCCO1	ZINC000819095562	GG	On-Demand	Anodyne	GRIN1	29	46
C[C@H](CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)CC1(C)OCCO1	ZINC000819095563	GG	On-Demand	Anodyne	ADRB2	30	41
C[C@H](CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)CC1(C)OCCO1	ZINC000819095563	GG	On-Demand	Anodyne	ADRB1	41	37
C[C@H](CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)CC1(C)OCCO1	ZINC000819095563	GG	On-Demand	Anodyne	GRIN1	29	46
C[C@H](CNC[C@H](O)COc1ccc(Cl)c(Cl)c1)CC1(C)OCCO1	ZINC000819095564	GG	On-Demand	Anodyne	ADRB2	30	41
C[C@H](CNC[C@H](O)COc1ccc(Cl)c(Cl)c1)CC1(C)OCCO1	ZINC000819095564	GG	On-Demand	Anodyne	ADRB1	41	37
C[C@H](CNC[C@H](O)COc1ccc(Cl)c(Cl)c1)CC1(C)OCCO1	ZINC000819095564	GG	On-Demand	Anodyne	GRIN1	29	46
C#CCSCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819095565	DF	On-Demand	Mild	ADRB2	47	56
C#CCSCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819095565	DF	On-Demand	Mild	ADRB1	64	43
C#CCSCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819095565	DF	On-Demand	Mild	ADRB3	36	43
C#CCSCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819095565	DF	On-Demand	Mild	CASR	40	37
C#CCSCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819095566	DF	On-Demand	Mild	ADRB2	47	56
C#CCSCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819095566	DF	On-Demand	Mild	ADRB1	64	43
C#CCSCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819095566	DF	On-Demand	Mild	ADRB3	36	43
C#CCSCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819095566	DF	On-Demand	Mild	CASR	40	37
C[C@H](CNC[C@@H](O)COc1cccc(C(F)(F)F)c1)CC1(C)OCCO1	ZINC000819095567	GF	On-Demand	Anodyne	ADRB2	21	42
C[C@H](CNC[C@@H](O)COc1cccc(C(F)(F)F)c1)CC1(C)OCCO1	ZINC000819095567	GF	On-Demand	Anodyne	ADRB1	23	40
C[C@H](CNC[C@@H](O)COc1cccc(C(F)(F)F)c1)CC1(C)OCCO1	ZINC000819095567	GF	On-Demand	Anodyne	PDS	45	41
C[C@@H](CNC[C@H](O)COc1cccc(C(F)(F)F)c1)CC1(C)OCCO1	ZINC000819095568	GF	On-Demand	Anodyne	ADRB2	21	42
C[C@@H](CNC[C@H](O)COc1cccc(C(F)(F)F)c1)CC1(C)OCCO1	ZINC000819095568	GF	On-Demand	Anodyne	ADRB1	23	40
C[C@@H](CNC[C@H](O)COc1cccc(C(F)(F)F)c1)CC1(C)OCCO1	ZINC000819095568	GF	On-Demand	Anodyne	PDS	45	41
C[C@@H](CNC[C@@H](O)COc1cccc(C(F)(F)F)c1)CC1(C)OCCO1	ZINC000819095569	GF	On-Demand	Anodyne	ADRB2	21	42
C[C@@H](CNC[C@@H](O)COc1cccc(C(F)(F)F)c1)CC1(C)OCCO1	ZINC000819095569	GF	On-Demand	Anodyne	ADRB1	23	40
C[C@@H](CNC[C@@H](O)COc1cccc(C(F)(F)F)c1)CC1(C)OCCO1	ZINC000819095569	GF	On-Demand	Anodyne	PDS	45	41
C[C@H](CNC[C@H](O)COc1cccc(C(F)(F)F)c1)CC1(C)OCCO1	ZINC000819095570	GF	On-Demand	Anodyne	ADRB2	21	42
C[C@H](CNC[C@H](O)COc1cccc(C(F)(F)F)c1)CC1(C)OCCO1	ZINC000819095570	GF	On-Demand	Anodyne	ADRB1	23	40
C[C@H](CNC[C@H](O)COc1cccc(C(F)(F)F)c1)CC1(C)OCCO1	ZINC000819095570	GF	On-Demand	Anodyne	PDS	45	41
N#Cc1ccc(CC(=O)N[C@H](C(=O)O)c2ccccc2)cc1	ZINC000819095571	CE	On-Demand	Mild	MME	34	41
N#Cc1ccc(CC(=O)N[C@H](C(=O)O)c2ccccc2)cc1	ZINC000819095571	CE	On-Demand	Mild	NAALAD2	22	42
N#Cc1ccc(CC(=O)N[C@H](C(=O)O)c2ccccc2)cc1	ZINC000819095571	CE	On-Demand	Mild	CTRB_BOVIN	49	40
N#Cc1ccc(C(=O)N2CCC[C@@H]2C(=O)O)s1	ZINC000819095580	CD	On-Demand	Mild	ACE	48	41
N#Cc1ccc(C(=O)N2CCC[C@@H]2C(=O)O)s1	ZINC000819095580	CD	On-Demand	Mild	PREP	83	44
N#Cc1ccc(C(=O)N2CCC[C@H]2C(=O)O)s1	ZINC000819095581	CD	On-Demand	Mild	ACE	48	41
N#Cc1ccc(C(=O)N2CCC[C@H]2C(=O)O)s1	ZINC000819095581	CD	On-Demand	Mild	PREP	83	44
N#Cc1c(NC(=O)CCN2CC[C@@H](C(=O)O)C2)sc2c1CCCC2	ZINC000819095582	EE	On-Demand	Mild	SLC6A1	109	36
N#Cc1c(NC(=O)CCN2CC[C@@H](C(=O)O)C2)sc2c1CCCC2	ZINC000819095582	EE	On-Demand	Mild	VIPR1	33	56
N#Cc1c(NC(=O)CCN2CC[C@H](C(=O)O)C2)sc2c1CCCC2	ZINC000819095583	EE	On-Demand	Mild	SLC6A1	109	36
N#Cc1c(NC(=O)CCN2CC[C@H](C(=O)O)C2)sc2c1CCCC2	ZINC000819095583	EE	On-Demand	Mild	VIPR1	33	56
N#Cc1cc(S(N)(=O)=O)ccc1NCCC(=O)O	ZINC000819095584	CC	On-Demand	Mild	CA2	104	50
N#Cc1cc(S(N)(=O)=O)ccc1NCCC(=O)O	ZINC000819095584	CC	On-Demand	Mild	CA1	84	50
N#Cc1cc(S(N)(=O)=O)ccc1NCCC(=O)O	ZINC000819095584	CC	On-Demand	Mild	CA7	55	40
N#Cc1cc(S(N)(=O)=O)ccc1NCCC(=O)O	ZINC000819095584	CC	On-Demand	Mild	CA5B	58	40
N#Cc1cc(S(N)(=O)=O)ccc1NCCC(=O)O	ZINC000819095584	CC	On-Demand	Mild	CA4	100	50
N#Cc1cc(S(N)(=O)=O)ccc1NCCC(=O)O	ZINC000819095584	CC	On-Demand	Mild	CA5A	62	40
N#Cc1cc(S(N)(=O)=O)ccc1NCCC(=O)O	ZINC000819095584	CC	On-Demand	Mild	CA14	45	47
N#Cc1cc(S(N)(=O)=O)ccc1NCCC(=O)O	ZINC000819095584	CC	On-Demand	Mild	CA12	49	47
N#Cc1cc(S(N)(=O)=O)ccc1NCCC(=O)O	ZINC000819095584	CC	On-Demand	Mild	CA9	52	42
N#Cc1cc(S(N)(=O)=O)ccc1NCCC(=O)O	ZINC000819095584	CC	On-Demand	Mild	NCE103	31	42
N#Cc1cc(S(N)(=O)=O)ccc1NCCC(=O)O	ZINC000819095584	CC	On-Demand	Mild	MTCA1	34	42
N#Cc1cc(S(N)(=O)=O)ccc1NCCC(=O)O	ZINC000819095584	CC	On-Demand	Mild	P96878_MYCTU	42	42
N#Cc1ccc(CN2CCCN(C(=O)Nc3ccccc3CC(=O)O)CC2)cc1	ZINC000819095585	GF	On-Demand	Mild	CCR3	21	43
N#Cc1ccc(CN2CCCN(C(=O)Nc3ccccc3CC(=O)O)CC2)cc1	ZINC000819095585	GF	On-Demand	Mild	FAAH	22	49
N#Cc1ccc(CC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819095587	CF	On-Demand	Mild	CTRB_BOVIN	48	36
N#Cc1ccc(CN2CCC(C(=O)O)CC2)c(OC(F)F)c1	ZINC000819095588	DE	On-Demand	Mild	CCR3	15	40
N#Cc1ccc(-c2nnc(CN3CC[C@@H](C(=O)O)C3)o2)cc1	ZINC000819095589	CD	On-Demand	Mild	SLC6A1	56	33
N#Cc1ccc(-c2nnc(CN3CC[C@@H](C(=O)O)C3)o2)cc1	ZINC000819095589	CD	On-Demand	Mild	S1PR1	20	47
N#Cc1ccc(-c2nnc(CN3CC[C@H](C(=O)O)C3)o2)cc1	ZINC000819095590	CD	On-Demand	Mild	SLC6A1	56	33
N#Cc1ccc(-c2nnc(CN3CC[C@H](C(=O)O)C3)o2)cc1	ZINC000819095590	CD	On-Demand	Mild	S1PR1	20	47
CCOc1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)c2ccccc12	ZINC000819095594	FD	On-Demand	Anodyne	CCR8	20	43
CCOc1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)c2ccccc12	ZINC000819095594	FD	On-Demand	Anodyne	HCN1	43	31
N#Cc1ccc(C(=O)NNC(=O)NCCCCCC(=O)O)cc1	ZINC000819095596	DD	On-Demand	Reactive	HDAC9	17	47
N#Cc1ccc(C(=O)NNC(=O)NCCCCCC(=O)O)cc1	ZINC000819095596	DD	On-Demand	Reactive	CTRB_BOVIN	46	33
N#Cc1cc(NC(=O)CSCC(=O)O)ccc1N1CCC(O)CC1	ZINC000819095602	ED	On-Demand	Mild	NPY2R	50	40
N#Cc1c(NC(=O)CCN2CCC[C@@H](CC(=O)O)C2)sc2c1CCCCC2	ZINC000819095604	GG	On-Demand	Mild	VIPR1	31	52
N#Cc1c(NC(=O)CCN2CCC[C@H](CC(=O)O)C2)sc2c1CCCCC2	ZINC000819095606	GG	On-Demand	Mild	VIPR1	31	52
N#Cc1ccc([C@H](O)CN2CCC[C@@H]2C(=O)O)cc1	ZINC000819095608	CD	On-Demand	Mild	HSD11B1	19	43
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc3c(c2)CCCO3)C1	ZINC000819095609	EC	On-Demand	Anodyne	PKM	38	43
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc3c(c2)CCCO3)C1	ZINC000819095609	EC	On-Demand	Anodyne	AKR1C3	48	33
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc3c(c2)CCCO3)C1	ZINC000819095610	EC	On-Demand	Anodyne	PKM	38	43
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc3c(c2)CCCO3)C1	ZINC000819095610	EC	On-Demand	Anodyne	AKR1C3	48	33
N#Cc1ccc([C@@H](O)CN2CCC[C@@H]2C(=O)O)cc1	ZINC000819095615	CD	On-Demand	Mild	HSD11B1	19	43
N#Cc1ccc([C@H](O)CN2CCC[C@H]2C(=O)O)cc1	ZINC000819095617	CD	On-Demand	Mild	HSD11B1	19	43
N#Cc1ccc([C@@H](O)CN2CCC[C@H]2C(=O)O)cc1	ZINC000819095619	CD	On-Demand	Mild	HSD11B1	19	43
N#Cc1c(NC(=O)CN2CC[C@@H](C(=O)O)C2)sc2c1CCCCC2	ZINC000819095621	EE	On-Demand	Mild	VIPR1	32	53
N#Cc1c(NC(=O)CN2CC[C@H](C(=O)O)C2)sc2c1CCCCC2	ZINC000819095622	EE	On-Demand	Mild	VIPR1	32	53
N#Cc1c(NC(=O)CN2CCC[C@H](CC(=O)O)C2)sc2c1CCCCC2	ZINC000819095627	GG	On-Demand	Mild	VIPR1	31	51
N#Cc1c(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)sc2c1CCCCC2	ZINC000819095631	GG	On-Demand	Mild	VIPR1	31	51
N#Cc1ccc(CCC(=O)N[C@H](C(=O)O)c2ccccc2)cc1	ZINC000819095634	DE	On-Demand	Mild	CTSG	19	42
N#Cc1ccc(CCC(=O)N[C@H](C(=O)O)c2ccccc2)cc1	ZINC000819095634	DE	On-Demand	Mild	CTRB1	18	42
N#Cc1ccc(CCC(=O)N[C@H](C(=O)O)c2ccccc2)cc1	ZINC000819095634	DE	On-Demand	Mild	NAALAD2	22	42
N#Cc1ccc(CCC(=O)N[C@H](C(=O)O)c2ccccc2)cc1	ZINC000819095634	DE	On-Demand	Mild	CELA2A	17	42
N#Cc1ccc(CCC(=O)N[C@H](C(=O)O)c2ccccc2)cc1	ZINC000819095634	DE	On-Demand	Mild	GSTP1	17	42
N#Cc1ccc(CCC(=O)N[C@H](C(=O)O)c2ccccc2)cc1	ZINC000819095634	DE	On-Demand	Mild	CTRB_BOVIN	50	42
N#Cc1ccc(CCC(=O)N[C@H](C(=O)O)c2ccccc2)cc1	ZINC000819095634	DE	On-Demand	Mild	VIPR1	21	40
N#Cc1ccc(CCC(=O)N[C@H](C(=O)O)c2ccccc2)cc1	ZINC000819095634	DE	On-Demand	Mild	FFAR1	40	44
N#Cc1c(NC(=O)CCN2CCC[C@H](CC(=O)O)C2)sc2c1CCC2	ZINC000819095636	FF	On-Demand	Mild	VIPR1	30	51
N#Cc1c(NC(=O)CCN2CCC[C@@H](CC(=O)O)C2)sc2c1CCC2	ZINC000819095639	FF	On-Demand	Mild	VIPR1	30	51
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc3c(c2)OCO3)C1	ZINC000819095642	DB	On-Demand	Anodyne	PKM	44	51
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc3c(c2)OCO3)C1	ZINC000819095644	DB	On-Demand	Anodyne	PKM	44	51
N#Cc1c(NC(=O)CCN2CC[C@@H](C(=O)O)C2)sc2c1CCCCC2	ZINC000819095647	FF	On-Demand	Mild	SLC6A1	98	35
N#Cc1c(NC(=O)CCN2CC[C@@H](C(=O)O)C2)sc2c1CCCCC2	ZINC000819095647	FF	On-Demand	Mild	VIPR1	33	55
N#Cc1c(NC(=O)CCN2CC[C@H](C(=O)O)C2)sc2c1CCCCC2	ZINC000819095649	FF	On-Demand	Mild	SLC6A1	98	35
N#Cc1c(NC(=O)CCN2CC[C@H](C(=O)O)C2)sc2c1CCCCC2	ZINC000819095649	FF	On-Demand	Mild	VIPR1	33	55
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(C(F)(F)F)nc2)C1	ZINC000819095657	EC	On-Demand	Anodyne	GCK	60	36
O=C(O)[C@]1(O)CCN(S(=O)(=O)c2ccc(C(F)(F)F)nc2)C1	ZINC000819095657	EC	On-Demand	Anodyne	GCKR	60	33
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(C(F)(F)F)nc2)C1	ZINC000819095658	EC	On-Demand	Anodyne	GCK	60	36
O=C(O)[C@@]1(O)CCN(S(=O)(=O)c2ccc(C(F)(F)F)nc2)C1	ZINC000819095658	EC	On-Demand	Anodyne	GCKR	60	33
N#Cc1ccc(C(=O)NNC(=O)NCCC(=O)O)cc1	ZINC000819095666	CB	On-Demand	Reactive	CTRB_BOVIN	45	35
N#Cc1cc(F)c(C(=O)N2CCC(C(=O)O)CC2)c(F)c1	ZINC000819095668	CD	On-Demand	Mild	L3MBTL3	78	43
O=C(O)[C@@]1(O)CCN(S(=O)(=O)Cc2ccc(OC(F)(F)F)cc2)C1	ZINC000819095675	FC	On-Demand	Anodyne	EPHX2	45	42
O=C(O)[C@]1(O)CCN(S(=O)(=O)Cc2ccc(OC(F)(F)F)cc2)C1	ZINC000819095676	FC	On-Demand	Anodyne	EPHX2	45	42
N#Cc1cc(CNc2cccc(CC(=O)O)c2)ccc1F	ZINC000819095686	CF	On-Demand	Mild	NR1H3	16	48
N#Cc1cc(CNc2cccc(CC(=O)O)c2)ccc1F	ZINC000819095686	CF	On-Demand	Mild	NR1H2	28	40
N#Cc1cc(CNc2cccc(CC(=O)O)c2)ccc1F	ZINC000819095686	CF	On-Demand	Mild	FFAR1	20	44
O=C(O)[C@@]1(O)CCN(S(=O)(=O)CCc2ccc(Cl)cc2)C1	ZINC000819095693	EC	On-Demand	Anodyne	PA	25	41
O=C(O)[C@]1(O)CCN(S(=O)(=O)CCc2ccc(Cl)cc2)C1	ZINC000819095695	EC	On-Demand	Anodyne	PA	25	41
CCOC(=O)N[C@H](CNC(=O)Cc1ccc(-n2cnnc2)cc1)CC(C)C	ZINC000819095696	FE	On-Demand	Anodyne	CAPN2	71	33
CCOC(=O)N[C@@H](CNC(=O)Cc1ccc(-n2cnnc2)cc1)CC(C)C	ZINC000819095698	FE	On-Demand	Anodyne	CAPN2	71	33
Cc1ccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)cc1C(F)(F)F	ZINC000819095699	FD	On-Demand	Anodyne	SFRP1	56	36
Cc1ccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)cc1C(F)(F)F	ZINC000819095700	FD	On-Demand	Anodyne	SFRP1	56	36
Cn1nnnc1-c1cccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)c1	ZINC000819095713	FB	On-Demand	Anodyne	CCR3	42	37
Cn1nnnc1-c1cccc(S(=O)(=O)N2CC[C@](O)(C(=O)O)C2)c1	ZINC000819095713	FB	On-Demand	Anodyne	AKR1C3	51	37
Cn1nnnc1-c1cccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)c1	ZINC000819095715	FB	On-Demand	Anodyne	CCR3	42	37
Cn1nnnc1-c1cccc(S(=O)(=O)N2CC[C@@](O)(C(=O)O)C2)c1	ZINC000819095715	FB	On-Demand	Anodyne	AKR1C3	51	37
N#Cc1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)s1	ZINC000819095732	CD	On-Demand	Mild	L3MBTL3	23	45
N#Cc1ccc(C(=O)N2CC[C@H](C(=O)O)C2)s1	ZINC000819095736	CD	On-Demand	Mild	L3MBTL3	23	45
COCCCOc1ccc(Cl)cc1S(=O)(=O)N1CC[C@@](O)(C(=O)O)C1	ZINC000819095739	GC	On-Demand	Anodyne	CPT1A	74	37
COCCCOc1ccc(Cl)cc1S(=O)(=O)N1CC[C@@](O)(C(=O)O)C1	ZINC000819095739	GC	On-Demand	Anodyne	CPT2	49	37
COCCCOc1ccc(Cl)cc1S(=O)(=O)N1CC[C@@](O)(C(=O)O)C1	ZINC000819095739	GC	On-Demand	Anodyne	CPT1B	69	36
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	ACE	64	53
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	MME	144	53
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	ANPEP	92	44
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	FCER2	49	34
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	FOLR1	49	32
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	CTSB	57	45
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	PAPA1_CARPA	59	47
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	CYSP_TRYCR	59	35
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	CTSF	47	35
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	CTSK	15	44
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	CTSL	54	47
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	CPA1	58	49
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	NPFFR2	49	38
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	C3AR1	53	33
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	ITGA4	48	30
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	NAALAD2	31	45
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	CAPNS1	52	37
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	ECE1	46	42
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	CTSS	31	47
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	CAPN1	54	53
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	CAPN2	32	45
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	ACE2	92	49
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	LAP3	45	39
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	CTSC	53	44
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	CTSV	54	39
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	PIN1	46	40
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	MMP1	15	45
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	FPR1	74	43
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	CTRB_BOVIN	61	38
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	BLA1_STEMA	82	40
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	NPFFR1	67	38
N#Cc1ccc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095740	DE	On-Demand	Mild	SLC46A1	48	31
COCCCOc1ccc(Cl)cc1S(=O)(=O)N1CC[C@](O)(C(=O)O)C1	ZINC000819095741	GC	On-Demand	Anodyne	CPT1A	74	37
COCCCOc1ccc(Cl)cc1S(=O)(=O)N1CC[C@](O)(C(=O)O)C1	ZINC000819095741	GC	On-Demand	Anodyne	CPT2	49	37
COCCCOc1ccc(Cl)cc1S(=O)(=O)N1CC[C@](O)(C(=O)O)C1	ZINC000819095741	GC	On-Demand	Anodyne	CPT1B	69	36
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	ACE	64	53
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	MME	144	53
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	ANPEP	92	44
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	FCER2	49	34
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	FOLR1	49	32
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	CTSB	57	45
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	PAPA1_CARPA	59	47
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	CYSP_TRYCR	59	35
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	CTSF	47	35
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	CTSK	15	44
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	CTSL	54	47
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	CPA1	58	49
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	NPFFR2	49	38
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	C3AR1	53	33
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	ITGA4	48	30
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	NAALAD2	31	45
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	CAPNS1	52	37
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	ECE1	46	42
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	CTSS	31	47
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	CAPN1	54	53
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	CAPN2	32	45
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	ACE2	92	49
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	LAP3	45	39
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	CTSC	53	44
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	CTSV	54	39
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	PIN1	46	40
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	MMP1	15	45
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	FPR1	74	43
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	CTRB_BOVIN	61	38
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	BLA1_STEMA	82	40
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	NPFFR1	67	38
N#Cc1ccc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)s1	ZINC000819095743	DE	On-Demand	Mild	SLC46A1	48	31
N#Cc1ccc(CCC(=O)NCCCC(=O)O)cc1	ZINC000819095747	CD	On-Demand	Mild	FFAR1	63	53
N#Cc1ccc(CCC(=O)NCCCC(=O)O)cc1	ZINC000819095747	CD	On-Demand	Mild	FFAR4	39	41
N#Cc1ccc(CCC(=O)N(CC(=O)O)c2ccc3c(c2)OCO3)cc1	ZINC000819095748	FE	On-Demand	Mild	FFAR1	28	40
N#Cc1ccc([C@H](O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819095751	CC	On-Demand	Mild	SLC6A1	80	40
N#Cc1ccc([C@@H](O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819095752	CC	On-Demand	Mild	SLC6A1	80	40
N#Cc1ccc([C@H](O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819095753	CC	On-Demand	Mild	SLC6A1	80	40
N#Cc1ccc([C@@H](O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819095754	CC	On-Demand	Mild	SLC6A1	80	40
N#Cc1ccc(CN2CCC[C@H](CC(=O)O)C2)c(OC(F)F)c1	ZINC000819095761	DF	On-Demand	Mild	CCR3	16	40
N#Cc1ccc(CN2CCC[C@@H](CC(=O)O)C2)c(OC(F)F)c1	ZINC000819095762	DF	On-Demand	Mild	CCR3	16	40
N#Cc1ccc(CC(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819095764	CE	On-Demand	Mild	CTSC	16	44
NC(=O)CCNCc1ccc(N2CC=CC2)cc1	ZINC000819095767	BD	On-Demand	Clean	DPP7	43	41
N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)NCCC(=O)O)cc1	ZINC000819095768	FF	On-Demand	Mild	FFAR1	28	40
N#Cc1ccc(CN(Cc2cccc(F)c2)C(=O)NCCC(=O)O)cc1	ZINC000819095768	FF	On-Demand	Mild	PTGES	28	48
O[C@H](CNCc1ccc(N2CC=CC2)cc1)CN1CCOCC1	ZINC000819095771	DC	On-Demand	Clean	STAT6	42	33
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)CN1CCOCC1	ZINC000819095772	DC	On-Demand	Clean	STAT6	42	33
N#Cc1ccc(C(=O)Nc2ccccc2CC(=O)O)s1	ZINC000819095776	CE	On-Demand	Mild	CXCL8	31	42
NC(=O)C1CCN(C(=O)c2ccccc2NC(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819095795	FD	On-Demand	Anodyne	L3MBTL3	48	38
NC(=O)C1CCN(C(=O)c2ccccc2NC(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819095796	FD	On-Demand	Anodyne	L3MBTL3	48	38
NC(=O)C1CCN(C(=O)c2ccccc2NC(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819095797	FD	On-Demand	Anodyne	L3MBTL3	48	38
NC(=O)C1CCN(C(=O)c2ccccc2NC(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819095798	FD	On-Demand	Anodyne	L3MBTL3	48	38
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1F	ZINC000819095805	EF	On-Demand	Clean	ADRB2	31	41
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1F	ZINC000819095805	EF	On-Demand	Clean	ADRB1	53	39
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1F	ZINC000819095806	EF	On-Demand	Clean	ADRB2	31	41
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccccc1F	ZINC000819095806	EF	On-Demand	Clean	ADRB1	53	39
N#Cc1ccc(CN2CCCN(C(=O)NCCC(=O)O)CC2)cc1	ZINC000819095828	ED	On-Demand	Mild	MLNR	16	41
C[C@H](CNC[C@@H](O)COc1ccc(-c2ccccc2)cc1)CC1(C)OCCO1	ZINC000819095829	GG	On-Demand	Anodyne	ADRB2	56	52
C[C@H](CNC[C@@H](O)COc1ccc(-c2ccccc2)cc1)CC1(C)OCCO1	ZINC000819095829	GG	On-Demand	Anodyne	ADRB1	77	42
C[C@H](CNC[C@@H](O)COc1ccc(-c2ccccc2)cc1)CC1(C)OCCO1	ZINC000819095829	GG	On-Demand	Anodyne	ADRB3	51	42
C[C@@H](CNC[C@H](O)COc1ccc(-c2ccccc2)cc1)CC1(C)OCCO1	ZINC000819095830	GG	On-Demand	Anodyne	ADRB2	56	52
C[C@@H](CNC[C@H](O)COc1ccc(-c2ccccc2)cc1)CC1(C)OCCO1	ZINC000819095830	GG	On-Demand	Anodyne	ADRB1	77	42
C[C@@H](CNC[C@H](O)COc1ccc(-c2ccccc2)cc1)CC1(C)OCCO1	ZINC000819095830	GG	On-Demand	Anodyne	ADRB3	51	42
C[C@H](CNC[C@H](O)COc1ccc(-c2ccccc2)cc1)CC1(C)OCCO1	ZINC000819095831	GG	On-Demand	Anodyne	ADRB2	56	52
C[C@H](CNC[C@H](O)COc1ccc(-c2ccccc2)cc1)CC1(C)OCCO1	ZINC000819095831	GG	On-Demand	Anodyne	ADRB1	77	42
C[C@H](CNC[C@H](O)COc1ccc(-c2ccccc2)cc1)CC1(C)OCCO1	ZINC000819095831	GG	On-Demand	Anodyne	ADRB3	51	42
C[C@@H](CNC[C@@H](O)COc1ccc(-c2ccccc2)cc1)CC1(C)OCCO1	ZINC000819095833	GG	On-Demand	Anodyne	ADRB2	56	52
C[C@@H](CNC[C@@H](O)COc1ccc(-c2ccccc2)cc1)CC1(C)OCCO1	ZINC000819095833	GG	On-Demand	Anodyne	ADRB1	77	42
C[C@@H](CNC[C@@H](O)COc1ccc(-c2ccccc2)cc1)CC1(C)OCCO1	ZINC000819095833	GG	On-Demand	Anodyne	ADRB3	51	42
N#Cc1ccc(CCC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819095846	CD	On-Demand	Mild	FFAR1	22	40
N#Cc1ccc(CCC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819095846	CD	On-Demand	Mild	GPBAR1	28	42
N#Cc1ccc(CCC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819095864	CD	On-Demand	Mild	FFAR1	22	40
N#Cc1ccc(CCC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819095864	CD	On-Demand	Mild	GPBAR1	28	42
N#Cc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095865	EE	On-Demand	Mild	ADRB2	41	43
N#Cc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095865	EE	On-Demand	Mild	ADRB1	74	43
N#Cc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095865	EE	On-Demand	Mild	ADRB3	43	43
N#Cc1cc(F)c(C(=O)Nc2cccc(CC(=O)O)c2)c(F)c1	ZINC000819095866	DF	On-Demand	Mild	KCNK3	60	37
N#Cc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095871	EE	On-Demand	Mild	ADRB2	41	43
N#Cc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095871	EE	On-Demand	Mild	ADRB1	74	43
N#Cc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819095871	EE	On-Demand	Mild	ADRB3	43	43
C[C@H](CNC[C@H](O)COc1ccccc1F)CC1(C)OCCO1	ZINC000819095873	ED	On-Demand	Anodyne	ADRB2	26	46
C[C@H](CNC[C@H](O)COc1ccccc1F)CC1(C)OCCO1	ZINC000819095873	ED	On-Demand	Anodyne	ADRB1	54	39
C[C@@H](CNC[C@H](O)COc1ccccc1F)CC1(C)OCCO1	ZINC000819095876	ED	On-Demand	Anodyne	ADRB2	26	46
C[C@@H](CNC[C@H](O)COc1ccccc1F)CC1(C)OCCO1	ZINC000819095876	ED	On-Demand	Anodyne	ADRB1	54	39
C[C@H](CNC[C@@H](O)COc1ccccc1F)CC1(C)OCCO1	ZINC000819095877	ED	On-Demand	Anodyne	ADRB2	26	46
C[C@H](CNC[C@@H](O)COc1ccccc1F)CC1(C)OCCO1	ZINC000819095877	ED	On-Demand	Anodyne	ADRB1	54	39
C[C@@H](CNC[C@@H](O)COc1ccccc1F)CC1(C)OCCO1	ZINC000819095878	ED	On-Demand	Anodyne	ADRB2	26	46
C[C@@H](CNC[C@@H](O)COc1ccccc1F)CC1(C)OCCO1	ZINC000819095878	ED	On-Demand	Anodyne	ADRB1	54	39
O[C@H](CNCc1ccc(N2CC=CC2)cc1)c1cccnc1	ZINC000819095879	CE	On-Demand	Clean	ADRB2	26	44
O[C@H](CNCc1ccc(N2CC=CC2)cc1)c1cccnc1	ZINC000819095879	CE	On-Demand	Clean	ADRB1	27	42
O[C@H](CNCc1ccc(N2CC=CC2)cc1)c1cccnc1	ZINC000819095879	CE	On-Demand	Clean	ADRB3	101	48
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)c1cccnc1	ZINC000819095881	CE	On-Demand	Clean	ADRB2	26	44
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)c1cccnc1	ZINC000819095881	CE	On-Demand	Clean	ADRB1	27	42
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)c1cccnc1	ZINC000819095881	CE	On-Demand	Clean	ADRB3	101	48
C[C@@H](CNC[C@@H](O)COc1ccc(C#N)cc1)CC1(C)OCCO1	ZINC000819095889	ED	On-Demand	Mild	ADRB2	31	43
C[C@@H](CNC[C@@H](O)COc1ccc(C#N)cc1)CC1(C)OCCO1	ZINC000819095889	ED	On-Demand	Mild	ADRB1	51	39
C[C@H](CNC[C@@H](O)COc1ccc(C#N)cc1)CC1(C)OCCO1	ZINC000819095891	ED	On-Demand	Mild	ADRB2	31	43
C[C@H](CNC[C@@H](O)COc1ccc(C#N)cc1)CC1(C)OCCO1	ZINC000819095891	ED	On-Demand	Mild	ADRB1	51	39
C[C@H](CNC[C@H](O)COc1ccc(C#N)cc1)CC1(C)OCCO1	ZINC000819095894	ED	On-Demand	Mild	ADRB2	31	43
C[C@H](CNC[C@H](O)COc1ccc(C#N)cc1)CC1(C)OCCO1	ZINC000819095894	ED	On-Demand	Mild	ADRB1	51	39
C[C@@H](CNC[C@H](O)COc1ccc(C#N)cc1)CC1(C)OCCO1	ZINC000819095896	ED	On-Demand	Mild	ADRB2	31	43
C[C@@H](CNC[C@H](O)COc1ccc(C#N)cc1)CC1(C)OCCO1	ZINC000819095896	ED	On-Demand	Mild	ADRB1	51	39
N#Cc1ccc(C(=O)N2CCC(C(=O)O)CC2)s1	ZINC000819095899	CD	On-Demand	Mild	L3MBTL3	61	50
N#Cc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1ccccc1CC(=O)O	ZINC000819095907	FD	On-Demand	Mild	COLA	101	37
N#Cc1ccc(CC(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819095914	CD	On-Demand	Mild	DPP4	15	42
N#Cc1ccc(CC(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819095914	CD	On-Demand	Mild	MLNR	18	43
N#Cc1ccc(CC(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819095918	CD	On-Demand	Mild	DPP4	15	42
N#Cc1ccc(CC(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819095918	CD	On-Demand	Mild	MLNR	18	43
CS(=O)(=O)c1ccc([C@H](O)CNCc2nc(C(F)(F)F)cs2)cc1	ZINC000819095919	GE	On-Demand	Anodyne	PTGS2	30	42
CS(=O)(=O)c1ccc([C@H](O)CNCc2nc(C(F)(F)F)cs2)cc1	ZINC000819095919	GE	On-Demand	Anodyne	ADRB3	33	42
CS(=O)(=O)c1ccc([C@H](O)CNCc2nc(C(F)(F)F)cs2)cc1	ZINC000819095919	GE	On-Demand	Anodyne	TRPV1	80	35
N#Cc1c(NC(=O)CCN2CCC[C@H](CC(=O)O)C2)sc2c1CCCC2	ZINC000819095920	GG	On-Demand	Mild	VIPR1	32	53
CS(=O)(=O)c1ccc([C@@H](O)CNCc2nc(C(F)(F)F)cs2)cc1	ZINC000819095922	GE	On-Demand	Anodyne	PTGS2	30	42
CS(=O)(=O)c1ccc([C@@H](O)CNCc2nc(C(F)(F)F)cs2)cc1	ZINC000819095922	GE	On-Demand	Anodyne	ADRB3	33	42
CS(=O)(=O)c1ccc([C@@H](O)CNCc2nc(C(F)(F)F)cs2)cc1	ZINC000819095922	GE	On-Demand	Anodyne	TRPV1	80	35
N#Cc1c(NC(=O)CCN2CCC[C@@H](CC(=O)O)C2)sc2c1CCCC2	ZINC000819095923	GG	On-Demand	Mild	VIPR1	32	53
N#Cc1ccc(CCC(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819095926	CD	On-Demand	Mild	ACE	66	51
N#Cc1ccc(CCC(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819095926	CD	On-Demand	Mild	FKBP1A	48	38
N#Cc1ccc(CCC(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819095926	CD	On-Demand	Mild	CPT1A	16	43
N#Cc1ccc(CCC(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819095926	CD	On-Demand	Mild	DPP4	49	54
N#Cc1ccc(CCC(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819095926	CD	On-Demand	Mild	PREP	123	52
N#Cc1ccc(CCC(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819095926	CD	On-Demand	Mild	LGMN	71	36
N#Cc1ccc(CCC(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819095926	CD	On-Demand	Mild	FFAR1	29	40
N#Cc1cc(F)c(C(=O)N2CC[C@@H](C(=O)O)C2)c(F)c1	ZINC000819095931	CD	On-Demand	Mild	L3MBTL3	56	38
N#Cc1cc(F)c(C(=O)N2CC[C@H](C(=O)O)C2)c(F)c1	ZINC000819095935	CD	On-Demand	Mild	L3MBTL3	56	38
N#Cc1c[nH]c(C(=O)Nc2cccc(CC(=O)O)c2)c1	ZINC000819095979	CD	On-Demand	Mild	KCNK3	63	37
O[C@@H](CNCc1nc(C(F)(F)F)cs1)c1ccc(OC(F)(F)F)cc1	ZINC000819095989	GH	On-Demand	Anodyne	ADRB3	19	40
N#Cc1cc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)ccc1Cl	ZINC000819095990	FE	On-Demand	Mild	RPA1	43	32
N#Cc1cc(C(F)(F)F)ccc1S(=O)(=O)Nc1ccccc1CC(=O)O	ZINC000819095995	GG	On-Demand	Mild	PTGDR	18	41
N#Cc1cc(C(F)(F)F)ccc1S(=O)(=O)Nc1ccccc1CC(=O)O	ZINC000819095995	GG	On-Demand	Mild	PTGDR2	29	42
N#Cc1ccc(CC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819096001	CE	On-Demand	Mild	CA5A	15	44
N#Cc1ccc(CC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819096001	CE	On-Demand	Mild	TPSAB1	15	40
N#Cc1ccc(CC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819096001	CE	On-Demand	Mild	CTRB_BOVIN	49	39
N#Cc1ccc(C(=O)NCC(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819096004	ED	On-Demand	Mild	DPP4	23	52
N#Cc1ccc(C(=O)NCC(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819096004	ED	On-Demand	Mild	PREP	23	42
N#Cc1ccc(C(=O)NCC(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819096007	ED	On-Demand	Mild	DPP4	23	52
N#Cc1ccc(C(=O)NCC(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819096007	ED	On-Demand	Mild	PREP	23	42
CC[C@@H]1CCC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819096014	CG	On-Demand	Bother	CACNA1D	51	35
N#Cc1ccc(CN2CCCN(C(=O)NCc3ccc(C(=O)O)cc3)CC2)cc1	ZINC000819096018	GF	On-Demand	Mild	LTA4H	18	42
N#Cc1ccc(CN2CCCN(C(=O)NCc3ccc(C(=O)O)cc3)CC2)cc1	ZINC000819096018	GF	On-Demand	Mild	MLNR	17	41
CC[C@@H]1CCC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819096019	CG	On-Demand	Bother	CACNA1D	51	35
N#Cc1ccc(CCC(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819096022	DE	On-Demand	Mild	VIPR1	23	40
N#Cc1ccc(CCC(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819096022	DE	On-Demand	Mild	FFAR1	26	40
CC[C@@H]1CCC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819096023	CG	On-Demand	Bother	CACNA1D	51	35
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	ACE	52	49
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	FOLH1	17	49
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	MME	134	49
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	ANPEP	72	40
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	CMA1	17	40
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	CTRA_BOVIN	18	40
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	CTSB	52	42
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	PAPA1_CARPA	59	46
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	CYSP_TRYCR	42	37
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	CTSF	73	34
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	CTSL	45	46
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	CPA1	67	45
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	ITGA4	53	33
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	NAALAD2	35	49
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	ECE1	50	44
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	CTSS	27	46
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	CAPN1	44	55
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	CAPN2	15	42
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	ACE2	95	45
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	CTSC	40	40
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	CTSV	60	41
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	PIN1	49	38
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	FPR1	77	42
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	CTRB_BOVIN	54	40
N#Cc1cc(F)c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c(F)c1	ZINC000819096024	EE	On-Demand	Mild	BLA1_STEMA	85	41
CC[C@@H]1CCC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819096025	CG	On-Demand	Bother	CACNA1D	51	35
N#Cc1ccc(C(=O)NNC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819096026	DB	On-Demand	Reactive	SLC6A1	60	34
N#Cc1ccc(C(=O)NNC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819096027	DB	On-Demand	Reactive	SLC6A1	60	34
N#Cc1c[nH]c(C(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819096029	BC	On-Demand	Mild	PREP	37	40
N#Cc1c[nH]c(C(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819096030	BC	On-Demand	Mild	PREP	37	40
N#Cc1cc(S(N)(=O)=O)ccc1N1CC[C@@H](C(=O)O)C1	ZINC000819096033	CC	On-Demand	Mild	CA2	24	41
N#Cc1cc(S(N)(=O)=O)ccc1N1CC[C@@H](C(=O)O)C1	ZINC000819096033	CC	On-Demand	Mild	CA1	18	40
N#Cc1cc(S(N)(=O)=O)ccc1N1CC[C@@H](C(=O)O)C1	ZINC000819096033	CC	On-Demand	Mild	CA7	30	40
N#Cc1cc(S(N)(=O)=O)ccc1N1CC[C@H](C(=O)O)C1	ZINC000819096034	CC	On-Demand	Mild	CA2	24	41
N#Cc1cc(S(N)(=O)=O)ccc1N1CC[C@H](C(=O)O)C1	ZINC000819096034	CC	On-Demand	Mild	CA1	18	40
N#Cc1cc(S(N)(=O)=O)ccc1N1CC[C@H](C(=O)O)C1	ZINC000819096034	CC	On-Demand	Mild	CA7	30	40
N#Cc1ccc(CN(CC(=O)O)c2ccc3nc(O)[nH]c3c2)cc1	ZINC000819096035	DE	On-Demand	Mild	TYMS	55	35
N#Cc1cc(C(F)(F)F)ccc1C(=O)OCC(=O)O	ZINC000819096036	CD	On-Demand	Mild	PTGDR2	32	45
N#Cc1cc(C(F)(F)F)ccc1C(=O)OCC(=O)O	ZINC000819096036	CD	On-Demand	Mild	LIPG	44	35
N#Cc1cc(F)c(C(=O)Nc2ccccc2CC(=O)O)c(F)c1	ZINC000819096037	DF	On-Demand	Mild	CXCL8	32	48
N#Cc1c(NC(=O)CCN2CC[C@H](C(=O)O)C2)sc2c1CCC2	ZINC000819096038	ED	On-Demand	Mild	SLC6A1	109	36
N#Cc1c(NC(=O)CCN2CC[C@H](C(=O)O)C2)sc2c1CCC2	ZINC000819096038	ED	On-Demand	Mild	VIPR1	32	53
N#Cc1c(NC(=O)CCN2CC[C@@H](C(=O)O)C2)sc2c1CCC2	ZINC000819096039	ED	On-Demand	Mild	SLC6A1	109	36
N#Cc1c(NC(=O)CCN2CC[C@@H](C(=O)O)C2)sc2c1CCC2	ZINC000819096039	ED	On-Demand	Mild	VIPR1	32	53
N#Cc1ccc(CCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819096040	DF	On-Demand	Mild	TPSAB1	15	43
N#Cc1ccc(CCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819096040	DF	On-Demand	Mild	FFAR1	36	43
N#Cc1cc(S(N)(=O)=O)ccc1NCCCC(=O)O	ZINC000819096042	CC	On-Demand	Mild	CA2	84	52
N#Cc1cc(S(N)(=O)=O)ccc1NCCCC(=O)O	ZINC000819096042	CC	On-Demand	Mild	CA1	67	52
N#Cc1cc(S(N)(=O)=O)ccc1NCCCC(=O)O	ZINC000819096042	CC	On-Demand	Mild	CA7	45	38
N#Cc1cc(S(N)(=O)=O)ccc1NCCCC(=O)O	ZINC000819096042	CC	On-Demand	Mild	CA5B	53	38
N#Cc1cc(S(N)(=O)=O)ccc1NCCCC(=O)O	ZINC000819096042	CC	On-Demand	Mild	CA4	80	52
N#Cc1cc(S(N)(=O)=O)ccc1NCCCC(=O)O	ZINC000819096042	CC	On-Demand	Mild	CA5A	56	38
N#Cc1cc(S(N)(=O)=O)ccc1NCCCC(=O)O	ZINC000819096042	CC	On-Demand	Mild	CA14	36	40
N#Cc1cc(S(N)(=O)=O)ccc1NCCCC(=O)O	ZINC000819096042	CC	On-Demand	Mild	CA12	37	40
N#Cc1cc(S(N)(=O)=O)ccc1NCCCC(=O)O	ZINC000819096042	CC	On-Demand	Mild	CA9	37	40
N#Cc1cc(S(N)(=O)=O)ccc1NCCCC(=O)O	ZINC000819096042	CC	On-Demand	Mild	NCE103	36	40
N#Cc1cc(S(N)(=O)=O)ccc1NCCCC(=O)O	ZINC000819096042	CC	On-Demand	Mild	P96878_MYCTU	44	37
N#Cc1ccc(C(=O)NCc2ccc(C(=O)O)cc2)s1	ZINC000819096044	CE	On-Demand	Mild	MAPK9	20	40
N#Cc1ccc(C(=O)NCc2ccc(C(=O)O)cc2)s1	ZINC000819096044	CE	On-Demand	Mild	MAPK8	16	40
N#Cc1ccc(CN2CC[C@@H](C(=O)O)C2)c(OC(F)F)c1	ZINC000819096053	CE	On-Demand	Mild	SLC6A1	96	33
N#Cc1ccc(CN2CC[C@H](C(=O)O)C2)c(OC(F)F)c1	ZINC000819096054	CE	On-Demand	Mild	SLC6A1	96	33
N#Cc1ccc(C(=O)NNC(=O)NCCCC(=O)O)cc1	ZINC000819096066	CC	On-Demand	Reactive	CTRB_BOVIN	45	34
N#Cc1cc(F)c(S(=O)(=O)Nc2ccccc2CC(=O)O)c(F)c1	ZINC000819096072	FE	On-Demand	Mild	CXCL8	35	46
N#Cc1cc(F)c(S(=O)(=O)Nc2ccccc2CC(=O)O)c(F)c1	ZINC000819096072	FE	On-Demand	Mild	FFAR4	19	41
N#Cc1cc(S(N)(=O)=O)ccc1NCCCCCC(=O)O	ZINC000819096081	DD	On-Demand	Mild	CA2	66	47
N#Cc1cc(S(N)(=O)=O)ccc1NCCCCCC(=O)O	ZINC000819096081	DD	On-Demand	Mild	CA1	53	47
N#Cc1cc(S(N)(=O)=O)ccc1NCCCCCC(=O)O	ZINC000819096081	DD	On-Demand	Mild	CA5B	40	37
N#Cc1cc(S(N)(=O)=O)ccc1NCCCCCC(=O)O	ZINC000819096081	DD	On-Demand	Mild	CA4	65	47
N#Cc1cc(S(N)(=O)=O)ccc1NCCCCCC(=O)O	ZINC000819096081	DD	On-Demand	Mild	CA5A	42	37
N#Cc1cc(S(=O)(=O)Nc2ccccc2CC(=O)O)ccc1Cl	ZINC000819096118	FF	On-Demand	Mild	CXCL8	33	45
N#Cc1cc(S(=O)(=O)Nc2ccccc2CC(=O)O)ccc1Cl	ZINC000819096118	FF	On-Demand	Mild	PRTN3	44	33
N#Cc1cc(S(=O)(=O)Nc2ccccc2CC(=O)O)ccc1Cl	ZINC000819096118	FF	On-Demand	Mild	CCR2	19	42
N#Cc1cc(S(=O)(=O)Nc2ccccc2CC(=O)O)ccc1Cl	ZINC000819096118	FF	On-Demand	Mild	PTGDR2	32	48
N#Cc1ccc(C(=O)NNC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819096119	ED	On-Demand	Reactive	CTRB_BOVIN	49	38
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	ACE	56	48
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	MME	136	48
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	ANPEP	71	40
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	CTSB	37	41
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	PAPA1_CARPA	49	45
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	CCKAR	15	45
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	CTSL	40	45
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	CPA1	61	44
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	PYGL	17	43
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	ITGA4	54	32
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	NAALAD2	25	43
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	ECE1	65	42
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	CTSS	23	45
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	CAPN1	30	48
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	ACE2	103	44
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	CTSV	50	40
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	PIN1	46	35
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	FPR1	73	39
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	CTRB_BOVIN	54	39
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	BLA1_STEMA	88	46
N#Cc1c[nH]c(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096127	CD	On-Demand	Mild	BRCA1	43	32
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	ACE	56	48
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	MME	136	48
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	ANPEP	71	40
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	CTSB	37	41
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	PAPA1_CARPA	49	45
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	CCKAR	15	45
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	CTSL	40	45
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	CPA1	61	44
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	PYGL	17	43
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	ITGA4	54	32
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	NAALAD2	25	43
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	ECE1	65	42
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	CTSS	23	45
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	CAPN1	30	48
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	ACE2	103	44
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	CTSV	50	40
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	PIN1	46	35
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	FPR1	73	39
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	CTRB_BOVIN	54	39
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	BLA1_STEMA	88	46
N#Cc1c[nH]c(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819096128	CD	On-Demand	Mild	BRCA1	43	32
N#Cc1ccc([C@@H](O)CS(=O)(=O)Cc2ccc(C(=O)O)cc2)cc1	ZINC000819096129	ED	On-Demand	Mild	CTRB_BOVIN	47	33
N#Cc1ccc([C@H](O)CS(=O)(=O)Cc2ccc(C(=O)O)cc2)cc1	ZINC000819096130	ED	On-Demand	Mild	CTRB_BOVIN	47	33
N#Cc1ccc(C(=O)Nc2cccc(CC(=O)O)c2)s1	ZINC000819096132	CE	On-Demand	Mild	KCNK3	55	37
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1cccc(C(F)(F)F)c1	ZINC000819096166	GH	On-Demand	Clean	ADRB1	42	40
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1cccc(C(F)(F)F)c1	ZINC000819096166	GH	On-Demand	Clean	PDS	64	45
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1cccc(C(F)(F)F)c1	ZINC000819096167	GH	On-Demand	Clean	ADRB1	42	40
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1cccc(C(F)(F)F)c1	ZINC000819096167	GH	On-Demand	Clean	PDS	64	45
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1cccc2[nH]ccc12	ZINC000819096182	FG	On-Demand	Clean	ADRB2	20	57
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1cccc2[nH]ccc12	ZINC000819096182	FG	On-Demand	Clean	ADRB1	28	57
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1cccc2[nH]ccc12	ZINC000819096182	FG	On-Demand	Clean	ADRB3	16	57
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1cccc2[nH]ccc12	ZINC000819096183	FG	On-Demand	Clean	ADRB2	20	57
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1cccc2[nH]ccc12	ZINC000819096183	FG	On-Demand	Clean	ADRB1	28	57
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1cccc2[nH]ccc12	ZINC000819096183	FG	On-Demand	Clean	ADRB3	16	57
COC[C@@H](O)CNCc1ccc(N2CC=CC2)cc1	ZINC000819096186	CD	On-Demand	Clean	ADRB1	20	44
Cc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819096200	EF	On-Demand	Clean	ADRB2	55	50
Cc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819096200	EF	On-Demand	Clean	ADRB1	79	47
Cc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819096200	EF	On-Demand	Clean	GRIN1	20	41
Cc1ccc(OC[C@@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819096200	EF	On-Demand	Clean	ADRB3	53	47
Cc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819096201	EF	On-Demand	Clean	ADRB2	55	50
Cc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819096201	EF	On-Demand	Clean	ADRB1	79	47
Cc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819096201	EF	On-Demand	Clean	GRIN1	20	41
Cc1ccc(OC[C@H](O)CNCc2ccc(N3CC=CC3)cc2)cc1	ZINC000819096201	EF	On-Demand	Clean	ADRB3	53	47
O[C@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc2c(c1)OCO2	ZINC000819096222	FE	On-Demand	Clean	ADRB1	48	39
O[C@@H](CNCc1ccc(N2CC=CC2)cc1)COc1ccc2c(c1)OCO2	ZINC000819096223	FE	On-Demand	Clean	ADRB1	48	39
O[C@H](CNCc1nc(C(F)(F)F)cs1)c1ccc(OC(F)(F)F)cc1	ZINC000819096226	GH	On-Demand	Anodyne	ADRB3	19	40
C[C@@H](CNC[C@@H](O)COc1c(Cl)cccc1Cl)CC1(C)OCCO1	ZINC000819096228	GG	On-Demand	Anodyne	ADRB2	18	40
C[C@@H](CNC[C@H](O)COc1c(Cl)cccc1Cl)CC1(C)OCCO1	ZINC000819096229	GG	On-Demand	Anodyne	ADRB2	18	40
C[C@H](CNC[C@@H](O)COc1c(Cl)cccc1Cl)CC1(C)OCCO1	ZINC000819096230	GG	On-Demand	Anodyne	ADRB2	18	40
C[C@H](CNC[C@H](O)COc1c(Cl)cccc1Cl)CC1(C)OCCO1	ZINC000819096231	GG	On-Demand	Anodyne	ADRB2	18	40
C[C@@H](CNC[C@H](O)COc1cccc2[nH]ccc12)CC1(C)OCCO1	ZINC000819096241	EE	On-Demand	Anodyne	ADRB2	18	60
C[C@@H](CNC[C@H](O)COc1cccc2[nH]ccc12)CC1(C)OCCO1	ZINC000819096241	EE	On-Demand	Anodyne	ADRB1	31	60
C[C@H](CNC[C@H](O)COc1cccc2[nH]ccc12)CC1(C)OCCO1	ZINC000819096242	EE	On-Demand	Anodyne	ADRB2	18	60
C[C@H](CNC[C@H](O)COc1cccc2[nH]ccc12)CC1(C)OCCO1	ZINC000819096242	EE	On-Demand	Anodyne	ADRB1	31	60
C[C@@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)CC1(C)OCCO1	ZINC000819096243	EE	On-Demand	Anodyne	ADRB2	18	60
C[C@@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)CC1(C)OCCO1	ZINC000819096243	EE	On-Demand	Anodyne	ADRB1	31	60
C[C@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)CC1(C)OCCO1	ZINC000819096244	EE	On-Demand	Anodyne	ADRB2	18	60
C[C@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)CC1(C)OCCO1	ZINC000819096244	EE	On-Demand	Anodyne	ADRB1	31	60
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1OCc1cccnc1	ZINC000819096245	FG	On-Demand	Anodyne	PTAFR	26	41
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1OCc1cccnc1	ZINC000819096245	FG	On-Demand	Anodyne	CHRNA7	41	37
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1OCc1cccnc1	ZINC000819096245	FG	On-Demand	Anodyne	ENPP1	52	33
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1OCc1cccnc1	ZINC000819096246	FG	On-Demand	Anodyne	PTAFR	26	41
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1OCc1cccnc1	ZINC000819096246	FG	On-Demand	Anodyne	CHRNA7	41	37
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1OCc1cccnc1	ZINC000819096246	FG	On-Demand	Anodyne	ENPP1	52	33
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1OCc1cccnc1	ZINC000819096247	FG	On-Demand	Anodyne	PTAFR	26	41
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1OCc1cccnc1	ZINC000819096247	FG	On-Demand	Anodyne	CHRNA7	41	37
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1OCc1cccnc1	ZINC000819096247	FG	On-Demand	Anodyne	ENPP1	52	33
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1OCc1cccnc1	ZINC000819096248	FG	On-Demand	Anodyne	PTAFR	26	41
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1OCc1cccnc1	ZINC000819096248	FG	On-Demand	Anodyne	CHRNA7	41	37
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1OCc1cccnc1	ZINC000819096248	FG	On-Demand	Anodyne	ENPP1	52	33
C#CCSCCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819096268	DD	On-Demand	Mild	ADRB2	40	46
C#CCSCCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819096268	DD	On-Demand	Mild	ADRB1	67	43
C#CCSCCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819096268	DD	On-Demand	Mild	ADRB3	37	41
C#CCSCCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819096268	DD	On-Demand	Mild	ABCB1	19	47
C#CCSCCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819096269	DD	On-Demand	Mild	ADRB2	40	46
C#CCSCCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819096269	DD	On-Demand	Mild	ADRB1	67	43
C#CCSCCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819096269	DD	On-Demand	Mild	ADRB3	37	41
C#CCSCCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819096269	DD	On-Demand	Mild	ABCB1	19	47
C#CCSCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819096288	EE	On-Demand	Mild	ADRB2	28	40
C#CCSCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819096288	EE	On-Demand	Mild	ADRB1	41	43
C#CCSCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819096288	EE	On-Demand	Mild	PDS	47	40
C#CCSCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819096289	EE	On-Demand	Mild	ADRB2	28	40
C#CCSCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819096289	EE	On-Demand	Mild	ADRB1	41	43
C#CCSCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819096289	EE	On-Demand	Mild	PDS	47	40
C#CCSCCNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819096301	DD	On-Demand	Mild	ADRB2	45	44
C#CCSCCNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819096301	DD	On-Demand	Mild	ADRB1	77	44
C#CCSCCNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819096301	DD	On-Demand	Mild	ADRB3	43	44
C#CCSCCNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819096302	DD	On-Demand	Mild	ADRB2	45	44
C#CCSCCNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819096302	DD	On-Demand	Mild	ADRB1	77	44
C#CCSCCNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819096302	DD	On-Demand	Mild	ADRB3	43	44
COc1cc(CNC(=O)Cc2cccc(NC(C)=O)c2)ccc1OC(C)C	ZINC000819096303	FG	On-Demand	Anodyne	TSHR	63	35
COc1cc(CNC(=O)Cc2cccc(NC(C)=O)c2)ccc1OC(C)C	ZINC000819096303	FG	On-Demand	Anodyne	TRPV1	16	44
COc1cc(CNC(=O)Cc2cccc(NC(C)=O)c2)ccc1OC(C)C	ZINC000819096303	FG	On-Demand	Anodyne	ROCK2	24	48
COc1cc(CNC(=O)Cc2cccc(NC(C)=O)c2)ccc1OC(C)C	ZINC000819096303	FG	On-Demand	Anodyne	MT-ND1	22	40
COc1cc(CNC(=O)Cc2cccc(NC(C)=O)c2)ccc1OC(C)C	ZINC000819096303	FG	On-Demand	Anodyne	ENPP1	67	33
COc1cc(CNC(=O)Cc2cccc(NC(C)=O)c2)ccc1OC(C)C	ZINC000819096303	FG	On-Demand	Anodyne	KCNK3	59	41
COc1cc(CNC(=O)Cc2cccc(NC(C)=O)c2)ccc1OC(C)C	ZINC000819096303	FG	On-Demand	Anodyne	KCNK9	54	41
O[C@@H](CNCc1nc(C(F)(F)F)cs1)c1cccc(Cl)c1	ZINC000819096305	EH	On-Demand	Anodyne	ADRB1	31	44
O[C@@H](CNCc1nc(C(F)(F)F)cs1)c1cccc(Cl)c1	ZINC000819096305	EH	On-Demand	Anodyne	ADRB3	54	44
O[C@H](CNCc1nc(C(F)(F)F)cs1)c1cccc(Cl)c1	ZINC000819096306	EH	On-Demand	Anodyne	ADRB1	31	44
O[C@H](CNCc1nc(C(F)(F)F)cs1)c1cccc(Cl)c1	ZINC000819096306	EH	On-Demand	Anodyne	ADRB3	54	44
C=C(C)C(C)(C)C(=O)NCc1ccc(OC(C)C)c(OC)c1	ZINC000819096335	DH	On-Demand	Mild	TRPV1	21	40
C=C(C)C(C)(C)C(=O)NCc1ccc(OC(C)C)c(OC)c1	ZINC000819096335	DH	On-Demand	Mild	MT-ND1	25	45
C[C@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CC1(C)OCCO1	ZINC000819096336	GE	On-Demand	Anodyne	GPR119	20	40
C[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CC1(C)OCCO1	ZINC000819096337	GE	On-Demand	Anodyne	GPR119	20	40
C[C@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CC1(C)OCCO1	ZINC000819096338	GE	On-Demand	Anodyne	GPR119	20	40
C[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CC1(C)OCCO1	ZINC000819096339	GE	On-Demand	Anodyne	GPR119	20	40
C[C@@H](CNC[C@H](O)COc1ccccc1)CC1(C)OCCO1	ZINC000819096351	DD	On-Demand	Anodyne	ADRB2	59	60
C[C@@H](CNC[C@H](O)COc1ccccc1)CC1(C)OCCO1	ZINC000819096351	DD	On-Demand	Anodyne	ADRB1	79	45
C[C@@H](CNC[C@H](O)COc1ccccc1)CC1(C)OCCO1	ZINC000819096351	DD	On-Demand	Anodyne	ADRB3	49	45
C[C@@H](CNC[C@H](O)COc1ccccc1)CC1(C)OCCO1	ZINC000819096351	DD	On-Demand	Anodyne	ABCB1	15	45
C[C@H](CNC[C@H](O)COc1ccccc1)CC1(C)OCCO1	ZINC000819096352	DD	On-Demand	Anodyne	ADRB2	59	60
C[C@H](CNC[C@H](O)COc1ccccc1)CC1(C)OCCO1	ZINC000819096352	DD	On-Demand	Anodyne	ADRB1	79	45
C[C@H](CNC[C@H](O)COc1ccccc1)CC1(C)OCCO1	ZINC000819096352	DD	On-Demand	Anodyne	ADRB3	49	45
C[C@H](CNC[C@H](O)COc1ccccc1)CC1(C)OCCO1	ZINC000819096352	DD	On-Demand	Anodyne	ABCB1	15	45
C[C@@H](CNC[C@@H](O)COc1ccccc1)CC1(C)OCCO1	ZINC000819096353	DD	On-Demand	Anodyne	ADRB2	59	60
C[C@@H](CNC[C@@H](O)COc1ccccc1)CC1(C)OCCO1	ZINC000819096353	DD	On-Demand	Anodyne	ADRB1	79	45
C[C@@H](CNC[C@@H](O)COc1ccccc1)CC1(C)OCCO1	ZINC000819096353	DD	On-Demand	Anodyne	ADRB3	49	45
C[C@@H](CNC[C@@H](O)COc1ccccc1)CC1(C)OCCO1	ZINC000819096353	DD	On-Demand	Anodyne	ABCB1	15	45
C[C@H](CNC[C@@H](O)COc1ccccc1)CC1(C)OCCO1	ZINC000819096354	DD	On-Demand	Anodyne	ADRB2	59	60
C[C@H](CNC[C@@H](O)COc1ccccc1)CC1(C)OCCO1	ZINC000819096354	DD	On-Demand	Anodyne	ADRB1	79	45
C[C@H](CNC[C@@H](O)COc1ccccc1)CC1(C)OCCO1	ZINC000819096354	DD	On-Demand	Anodyne	ADRB3	49	45
C[C@H](CNC[C@@H](O)COc1ccccc1)CC1(C)OCCO1	ZINC000819096354	DD	On-Demand	Anodyne	ABCB1	15	45
C#CCSCCNC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819096364	DE	On-Demand	Mild	ADRB2	20	45
C#CCSCCNC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819096364	DE	On-Demand	Mild	ADRB1	45	35
C#CCSCCNC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819096365	DE	On-Demand	Mild	ADRB2	20	45
C#CCSCCNC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819096365	DE	On-Demand	Mild	ADRB1	45	35
CSc1ccc(OC[C@@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819096400	FF	On-Demand	Anodyne	ADRB2	30	43
CSc1ccc(OC[C@@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819096400	FF	On-Demand	Anodyne	ADRB1	46	39
CSc1ccc(OC[C@@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819096401	FF	On-Demand	Anodyne	ADRB2	30	43
CSc1ccc(OC[C@@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819096401	FF	On-Demand	Anodyne	ADRB1	46	39
CSc1ccc(OC[C@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819096402	FF	On-Demand	Anodyne	ADRB2	30	43
CSc1ccc(OC[C@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819096402	FF	On-Demand	Anodyne	ADRB1	46	39
CSc1ccc(OC[C@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819096403	FF	On-Demand	Anodyne	ADRB2	30	43
CSc1ccc(OC[C@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819096403	FF	On-Demand	Anodyne	ADRB1	46	39
C[C@@H](CNC[C@H](O)COc1ccc2ccccc2c1)CC1(C)OCCO1	ZINC000819096420	FF	On-Demand	Anodyne	ADRB2	44	56
C[C@@H](CNC[C@H](O)COc1ccc2ccccc2c1)CC1(C)OCCO1	ZINC000819096420	FF	On-Demand	Anodyne	ADRB1	50	39
C[C@H](CNC[C@H](O)COc1ccc2ccccc2c1)CC1(C)OCCO1	ZINC000819096421	FF	On-Demand	Anodyne	ADRB2	44	56
C[C@H](CNC[C@H](O)COc1ccc2ccccc2c1)CC1(C)OCCO1	ZINC000819096421	FF	On-Demand	Anodyne	ADRB1	50	39
C[C@H](CNC[C@@H](O)COc1ccc2ccccc2c1)CC1(C)OCCO1	ZINC000819096422	FF	On-Demand	Anodyne	ADRB2	44	56
C[C@H](CNC[C@@H](O)COc1ccc2ccccc2c1)CC1(C)OCCO1	ZINC000819096422	FF	On-Demand	Anodyne	ADRB1	50	39
C[C@@H](CNC[C@@H](O)COc1ccc2ccccc2c1)CC1(C)OCCO1	ZINC000819096423	FF	On-Demand	Anodyne	ADRB2	44	56
C[C@@H](CNC[C@@H](O)COc1ccc2ccccc2c1)CC1(C)OCCO1	ZINC000819096423	FF	On-Demand	Anodyne	ADRB1	50	39
Cc1ccc(OC[C@H](O)CNC[C@@H](C)CC2(C)OCCO2)c(C)c1	ZINC000819096528	EE	On-Demand	Anodyne	ADRB2	18	45
Cc1ccc(OC[C@H](O)CNC[C@H](C)CC2(C)OCCO2)c(C)c1	ZINC000819096529	EE	On-Demand	Anodyne	ADRB2	18	45
Cc1ccc(OC[C@@H](O)CNC[C@@H](C)CC2(C)OCCO2)c(C)c1	ZINC000819096530	EE	On-Demand	Anodyne	ADRB2	18	45
Cc1ccc(OC[C@@H](O)CNC[C@H](C)CC2(C)OCCO2)c(C)c1	ZINC000819096531	EE	On-Demand	Anodyne	ADRB2	18	45
C#CCSCCNC[C@H](O)COc1ccccc1C(C)C	ZINC000819096532	DF	On-Demand	Mild	ADRB2	38	47
C#CCSCCNC[C@H](O)COc1ccccc1C(C)C	ZINC000819096532	DF	On-Demand	Mild	ADRB1	62	39
C#CCSCCNC[C@H](O)COc1ccccc1C(C)C	ZINC000819096532	DF	On-Demand	Mild	ADRB3	16	41
C#CCSCCNC[C@H](O)COc1ccccc1C(C)C	ZINC000819096532	DF	On-Demand	Mild	ABCB1	19	46
C#CCSCCNC[C@@H](O)COc1ccccc1C(C)C	ZINC000819096533	DF	On-Demand	Mild	ADRB2	38	47
C#CCSCCNC[C@@H](O)COc1ccccc1C(C)C	ZINC000819096533	DF	On-Demand	Mild	ADRB1	62	39
C#CCSCCNC[C@@H](O)COc1ccccc1C(C)C	ZINC000819096533	DF	On-Demand	Mild	ADRB3	16	41
C#CCSCCNC[C@@H](O)COc1ccccc1C(C)C	ZINC000819096533	DF	On-Demand	Mild	ABCB1	19	46
C[C@H](CNC[C@@H](O)COc1ccc(CC#N)cc1)CC1(C)OCCO1	ZINC000819096535	ED	On-Demand	Mild	ADRB2	36	41
C[C@H](CNC[C@@H](O)COc1ccc(CC#N)cc1)CC1(C)OCCO1	ZINC000819096535	ED	On-Demand	Mild	ADRB1	56	41
C[C@H](CNC[C@@H](O)COc1ccc(CC#N)cc1)CC1(C)OCCO1	ZINC000819096535	ED	On-Demand	Mild	ADRB3	35	41
C[C@@H](CNC[C@@H](O)COc1ccc(CC#N)cc1)CC1(C)OCCO1	ZINC000819096536	ED	On-Demand	Mild	ADRB2	36	41
C[C@@H](CNC[C@@H](O)COc1ccc(CC#N)cc1)CC1(C)OCCO1	ZINC000819096536	ED	On-Demand	Mild	ADRB1	56	41
C[C@@H](CNC[C@@H](O)COc1ccc(CC#N)cc1)CC1(C)OCCO1	ZINC000819096536	ED	On-Demand	Mild	ADRB3	35	41
C[C@H](CNC[C@H](O)COc1ccc(CC#N)cc1)CC1(C)OCCO1	ZINC000819096537	ED	On-Demand	Mild	ADRB2	36	41
C[C@H](CNC[C@H](O)COc1ccc(CC#N)cc1)CC1(C)OCCO1	ZINC000819096537	ED	On-Demand	Mild	ADRB1	56	41
C[C@H](CNC[C@H](O)COc1ccc(CC#N)cc1)CC1(C)OCCO1	ZINC000819096537	ED	On-Demand	Mild	ADRB3	35	41
C[C@@H](CNC[C@H](O)COc1ccc(CC#N)cc1)CC1(C)OCCO1	ZINC000819096538	ED	On-Demand	Mild	ADRB2	36	41
C[C@@H](CNC[C@H](O)COc1ccc(CC#N)cc1)CC1(C)OCCO1	ZINC000819096538	ED	On-Demand	Mild	ADRB1	56	41
C[C@@H](CNC[C@H](O)COc1ccc(CC#N)cc1)CC1(C)OCCO1	ZINC000819096538	ED	On-Demand	Mild	ADRB3	35	41
COc1cc(CNC(=O)CCc2cccc(OC(F)F)c2)ccc1OC(C)C	ZINC000819096544	GI	On-Demand	Anodyne	MTNR1A	21	40
COc1cc(CNC(=O)CCc2cccc(OC(F)F)c2)ccc1OC(C)C	ZINC000819096544	GI	On-Demand	Anodyne	MTNR1B	26	43
C[C@@H](CNCCC(=O)Nc1ccccc1[N+](=O)[O-])CC1(C)OCCO1	ZINC000819096574	FE	On-Demand	Bother	COLA	69	34
C[C@H](CNCCC(=O)Nc1ccccc1[N+](=O)[O-])CC1(C)OCCO1	ZINC000819096575	FE	On-Demand	Bother	COLA	69	34
O=C(CCNCc1ccc(N2CC=CC2)cc1)Nc1cccnc1	ZINC000819096588	DF	On-Demand	Clean	NAMPT	45	44
C#CCSCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819096592	EE	On-Demand	Mild	ADRB2	29	41
C#CCSCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819096592	EE	On-Demand	Mild	ADRB1	64	41
C#CCSCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819096593	EE	On-Demand	Mild	ADRB2	29	41
C#CCSCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819096593	EE	On-Demand	Mild	ADRB1	64	41
COc1cc(Br)c(S(=O)(=O)N2CCc3c(cccc3C(=O)O)C2)cc1OC	ZINC000819096600	JF	On-Demand	Anodyne	AKR1C3	70	56
O=C(CCNCc1ccc(N2CC=CC2)cc1)Nc1ccc(Cl)cc1	ZINC000819096620	FH	On-Demand	Clean	DPP7	32	45
CCOc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c(C)c1	ZINC000819096630	FD	On-Demand	Anodyne	TRPV4	45	37
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1cnn(C)c1	ZINC000819096648	FE	On-Demand	Anodyne	GPR119	46	43
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1cnn(C)c1	ZINC000819096650	FE	On-Demand	Anodyne	GPR119	46	43
CON(C)C(=O)CCN[C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000819096707	ED	On-Demand	Anodyne	HTR1A	41	42
CON(C)C(=O)CCN[C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000819096707	ED	On-Demand	Anodyne	DRD3	36	42
CON(C)C(=O)CCN[C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000819096707	ED	On-Demand	Anodyne	HTR7	48	39
CON(C)C(=O)CCN[C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000819096708	ED	On-Demand	Anodyne	HTR1A	41	42
CON(C)C(=O)CCN[C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000819096708	ED	On-Demand	Anodyne	DRD3	36	42
CON(C)C(=O)CCN[C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000819096708	ED	On-Demand	Anodyne	HTR7	48	39
C[C@H](CNC[C@H](O)COc1ccccc1Cl)CC1(C)OCCO1	ZINC000819096709	EE	On-Demand	Anodyne	ADRB2	29	51
C[C@H](CNC[C@H](O)COc1ccccc1Cl)CC1(C)OCCO1	ZINC000819096709	EE	On-Demand	Anodyne	ADRB1	51	33
C[C@@H](CNC[C@H](O)COc1ccccc1Cl)CC1(C)OCCO1	ZINC000819096710	EE	On-Demand	Anodyne	ADRB2	29	51
C[C@@H](CNC[C@H](O)COc1ccccc1Cl)CC1(C)OCCO1	ZINC000819096710	EE	On-Demand	Anodyne	ADRB1	51	33
C[C@H](CNC[C@@H](O)COc1ccccc1Cl)CC1(C)OCCO1	ZINC000819096711	EE	On-Demand	Anodyne	ADRB2	29	51
C[C@H](CNC[C@@H](O)COc1ccccc1Cl)CC1(C)OCCO1	ZINC000819096711	EE	On-Demand	Anodyne	ADRB1	51	33
C[C@@H](CNC[C@@H](O)COc1ccccc1Cl)CC1(C)OCCO1	ZINC000819096712	EE	On-Demand	Anodyne	ADRB2	29	51
C[C@@H](CNC[C@@H](O)COc1ccccc1Cl)CC1(C)OCCO1	ZINC000819096712	EE	On-Demand	Anodyne	ADRB1	51	33
O[C@@H](CNCc1nc(C(F)(F)F)cs1)c1ccc(F)c(F)c1	ZINC000819096713	EG	On-Demand	Anodyne	TRPV1	48	33
O[C@H](CNCc1nc(C(F)(F)F)cs1)c1ccc(F)c(F)c1	ZINC000819096714	EG	On-Demand	Anodyne	TRPV1	48	33
O=C(Cc1ccc(-n2cnnc2)cc1)NNC(=O)C1CCCC1	ZINC000819096717	DD	On-Demand	Reactive	HTR1D	43	37
COc1cc(CNC(=O)C[C@H](C)n2cccn2)ccc1OC(C)C	ZINC000819096735	EF	On-Demand	Anodyne	ENPP1	61	32
COc1cc(CNC(=O)C[C@@H](C)n2cccn2)ccc1OC(C)C	ZINC000819096736	EF	On-Demand	Anodyne	ENPP1	61	32
Cc1ccc(OC[C@@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819096749	DE	On-Demand	Anodyne	ADRB2	42	52
Cc1ccc(OC[C@@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819096749	DE	On-Demand	Anodyne	ADRB1	54	41
Cc1ccc(OC[C@@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819096749	DE	On-Demand	Anodyne	ADRB3	30	41
Cc1ccc(OC[C@@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819096750	DE	On-Demand	Anodyne	ADRB2	42	52
Cc1ccc(OC[C@@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819096750	DE	On-Demand	Anodyne	ADRB1	54	41
Cc1ccc(OC[C@@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819096750	DE	On-Demand	Anodyne	ADRB3	30	41
Cc1ccc(OC[C@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819096751	DE	On-Demand	Anodyne	ADRB2	42	52
Cc1ccc(OC[C@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819096751	DE	On-Demand	Anodyne	ADRB1	54	41
Cc1ccc(OC[C@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819096751	DE	On-Demand	Anodyne	ADRB3	30	41
Cc1ccc(OC[C@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819096752	DE	On-Demand	Anodyne	ADRB2	42	52
Cc1ccc(OC[C@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819096752	DE	On-Demand	Anodyne	ADRB1	54	41
Cc1ccc(OC[C@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819096752	DE	On-Demand	Anodyne	ADRB3	30	41
O=C(O)c1cccc2c1CCN(S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)C2	ZINC000819096753	HH	On-Demand	Anodyne	AKR1C3	84	61
O=C(O)c1cccc2c1CCN(S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)C2	ZINC000819096753	HH	On-Demand	Anodyne	SFRP1	36	40
C[C@H](CNC[C@@H](O)c1cccnc1)CC1(C)OCCO1	ZINC000819096754	CD	On-Demand	Anodyne	ADRB2	22	44
C[C@H](CNC[C@@H](O)c1cccnc1)CC1(C)OCCO1	ZINC000819096754	CD	On-Demand	Anodyne	ADRB1	23	44
C[C@H](CNC[C@@H](O)c1cccnc1)CC1(C)OCCO1	ZINC000819096754	CD	On-Demand	Anodyne	ADRB3	91	44
C[C@H](CNC[C@H](O)c1cccnc1)CC1(C)OCCO1	ZINC000819096755	CD	On-Demand	Anodyne	ADRB2	22	44
C[C@H](CNC[C@H](O)c1cccnc1)CC1(C)OCCO1	ZINC000819096755	CD	On-Demand	Anodyne	ADRB1	23	44
C[C@H](CNC[C@H](O)c1cccnc1)CC1(C)OCCO1	ZINC000819096755	CD	On-Demand	Anodyne	ADRB3	91	44
C[C@@H](CNC[C@H](O)c1cccnc1)CC1(C)OCCO1	ZINC000819096756	CD	On-Demand	Anodyne	ADRB2	22	44
C[C@@H](CNC[C@H](O)c1cccnc1)CC1(C)OCCO1	ZINC000819096756	CD	On-Demand	Anodyne	ADRB1	23	44
C[C@@H](CNC[C@H](O)c1cccnc1)CC1(C)OCCO1	ZINC000819096756	CD	On-Demand	Anodyne	ADRB3	91	44
C[C@@H](CNC[C@@H](O)c1cccnc1)CC1(C)OCCO1	ZINC000819096757	CD	On-Demand	Anodyne	ADRB2	22	44
C[C@@H](CNC[C@@H](O)c1cccnc1)CC1(C)OCCO1	ZINC000819096757	CD	On-Demand	Anodyne	ADRB1	23	44
C[C@@H](CNC[C@@H](O)c1cccnc1)CC1(C)OCCO1	ZINC000819096757	CD	On-Demand	Anodyne	ADRB3	91	44
CCOc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1OCC	ZINC000819096778	GD	On-Demand	Anodyne	HCN1	44	33
CCOc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1OCC	ZINC000819096778	GD	On-Demand	Anodyne	HCN4	41	31
CCC(C)(C)c1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819096792	FF	On-Demand	Anodyne	HSD11B1	17	50
CCC(C)(C)c1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819096792	FF	On-Demand	Anodyne	F13A1	45	37
Cc1ccccc1[C@@H](O)CN[C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000819096809	FF	On-Demand	Anodyne	HTR1A	22	44
Cc1ccccc1[C@@H](O)CN[C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000819096809	FF	On-Demand	Anodyne	HTR2A	17	43
Cc1ccccc1[C@@H](O)CN[C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000819096809	FF	On-Demand	Anodyne	ABCB1	40	41
Cc1ccccc1[C@@H](O)CN[C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000819096813	FF	On-Demand	Anodyne	HTR1A	22	44
Cc1ccccc1[C@@H](O)CN[C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000819096813	FF	On-Demand	Anodyne	HTR2A	17	43
Cc1ccccc1[C@@H](O)CN[C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000819096813	FF	On-Demand	Anodyne	ABCB1	40	41
COC(=O)c1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)o1	ZINC000819096818	EC	On-Demand	Anodyne	LPL	45	34
COc1cc(F)c(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c(F)c1	ZINC000819096821	FD	On-Demand	Anodyne	PKM	26	51
COC(=O)c1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c(C)c1	ZINC000819096841	FD	On-Demand	Anodyne	EPHX2	16	51
COc1cccc(CS(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c1	ZINC000819096855	ED	On-Demand	Anodyne	DRD4	42	32
COc1cccc(CS(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c1	ZINC000819096855	ED	On-Demand	Anodyne	MMP13	28	45
COc1cccc(CS(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c1	ZINC000819096855	ED	On-Demand	Anodyne	MMP9	15	45
COC(=O)c1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cn1	ZINC000819096871	FC	On-Demand	Anodyne	TGM2	31	40
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819096877	EE	On-Demand	Anodyne	HTR1A	43	57
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819096877	EE	On-Demand	Anodyne	DRD2	30	57
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819096877	EE	On-Demand	Anodyne	DRD4	47	40
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819096877	EE	On-Demand	Anodyne	HTR2A	28	45
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819096877	EE	On-Demand	Anodyne	HTR2C	15	44
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819096877	EE	On-Demand	Anodyne	DRD3	40	45
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819096877	EE	On-Demand	Anodyne	HTR7	37	41
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819096877	EE	On-Demand	Anodyne	PLD2	60	36
O=C(NCCN1CCN(c2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819096877	EE	On-Demand	Anodyne	SLC27A1	45	41
CNS(=O)(=O)c1cccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c1	ZINC000819096888	GB	On-Demand	Anodyne	F13A1	47	41
CNS(=O)(=O)c1cccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c1	ZINC000819096888	GB	On-Demand	Anodyne	AKR1C3	58	39
Cc1cc(C(N)=O)ccc1NC(=O)C[C@@H](C)n1cccn1	ZINC000819096898	CD	On-Demand	Anodyne	SLC1A3	17	41
Cc1cc(C(N)=O)ccc1NC(=O)C[C@H](C)n1cccn1	ZINC000819096899	CD	On-Demand	Anodyne	SLC1A3	17	41
O=C(O)c1ccc2nc(CNS(=O)(=O)NC3CC3)[nH]c2c1	ZINC000819096921	DC	On-Demand	Anodyne	GRIN2B	18	40
CC(C)(C)OC(=O)CCNC[C@@H](O)c1cccnc1	ZINC000819096936	CD	On-Demand	Anodyne	ADRB2	36	47
CC(C)(C)OC(=O)CCNC[C@@H](O)c1cccnc1	ZINC000819096936	CD	On-Demand	Anodyne	ADRB1	49	48
CC(C)(C)OC(=O)CCNC[C@@H](O)c1cccnc1	ZINC000819096936	CD	On-Demand	Anodyne	ADRB3	127	46
CC(C)(C)OC(=O)CCNC[C@H](O)c1cccnc1	ZINC000819096937	CD	On-Demand	Anodyne	ADRB2	36	47
CC(C)(C)OC(=O)CCNC[C@H](O)c1cccnc1	ZINC000819096937	CD	On-Demand	Anodyne	ADRB1	49	48
CC(C)(C)OC(=O)CCNC[C@H](O)c1cccnc1	ZINC000819096937	CD	On-Demand	Anodyne	ADRB3	127	46
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(OCC(=O)N2CCCC2)c1	ZINC000819096949	EE	On-Demand	Anodyne	CPT1A	101	43
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(OCC(=O)N2CCCC2)c1	ZINC000819096949	EE	On-Demand	Anodyne	CPT2	42	34
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(OCC(=O)N2CCCC2)c1	ZINC000819096949	EE	On-Demand	Anodyne	EPHX2	19	42
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(OCC(=O)N2CCCC2)c1	ZINC000819096950	EE	On-Demand	Anodyne	CPT1A	101	43
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(OCC(=O)N2CCCC2)c1	ZINC000819096950	EE	On-Demand	Anodyne	CPT2	42	34
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(OCC(=O)N2CCCC2)c1	ZINC000819096950	EE	On-Demand	Anodyne	EPHX2	19	42
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(OCC(=O)N2CCCC2)c1	ZINC000819096951	EE	On-Demand	Anodyne	CPT1A	101	43
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(OCC(=O)N2CCCC2)c1	ZINC000819096951	EE	On-Demand	Anodyne	CPT2	42	34
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(OCC(=O)N2CCCC2)c1	ZINC000819096951	EE	On-Demand	Anodyne	EPHX2	19	42
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(OCC(=O)N2CCCC2)c1	ZINC000819096952	EE	On-Demand	Anodyne	CPT1A	101	43
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(OCC(=O)N2CCCC2)c1	ZINC000819096952	EE	On-Demand	Anodyne	CPT2	42	34
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(OCC(=O)N2CCCC2)c1	ZINC000819096952	EE	On-Demand	Anodyne	EPHX2	19	42
CON(C)C(=O)CCN[C@@H](C)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819096968	ED	On-Demand	Anodyne	DRD4	30	41
CON(C)C(=O)CCN[C@H](C)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819096969	ED	On-Demand	Anodyne	DRD4	30	41
CON(C)C(=O)CCN[C@@H](C)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819096970	ED	On-Demand	Anodyne	DRD4	30	41
CON(C)C(=O)CCN[C@H](C)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819096971	ED	On-Demand	Anodyne	DRD4	30	41
Cc1cccc([C@@H](C)CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819096985	GH	On-Demand	Anodyne	GPR119	54	50
Cc1cccc([C@@H](C)CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819096985	GH	On-Demand	Anodyne	SFRP1	21	40
Cc1cccc([C@@H](C)CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819096986	GH	On-Demand	Anodyne	GPR119	54	50
Cc1cccc([C@@H](C)CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819096986	GH	On-Demand	Anodyne	SFRP1	21	40
CC(C)(C)OC(=O)CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819096994	ED	On-Demand	Anodyne	ADRB2	19	41
CC(C)(C)OC(=O)CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819096995	ED	On-Demand	Anodyne	ADRB2	19	41
Cn1cc(S(=O)(=O)N2CCC(NC[C@H](O)c3ccccc3Cl)CC2)cn1	ZINC000819097007	GD	On-Demand	Anodyne	ADRB3	18	42
C[C@@H](CNC[C@H](O)COc1cccc2ccccc12)CC1(C)OCCO1	ZINC000819097062	FF	On-Demand	Anodyne	ADRB2	32	64
C[C@@H](CNC[C@H](O)COc1cccc2ccccc12)CC1(C)OCCO1	ZINC000819097062	FF	On-Demand	Anodyne	ADRB1	53	39
C[C@H](CNC[C@@H](O)COc1cccc2ccccc12)CC1(C)OCCO1	ZINC000819097064	FF	On-Demand	Anodyne	ADRB2	32	64
C[C@H](CNC[C@@H](O)COc1cccc2ccccc12)CC1(C)OCCO1	ZINC000819097064	FF	On-Demand	Anodyne	ADRB1	53	39
C[C@@H](CNC[C@@H](O)COc1cccc2ccccc12)CC1(C)OCCO1	ZINC000819097066	FF	On-Demand	Anodyne	ADRB2	32	64
C[C@@H](CNC[C@@H](O)COc1cccc2ccccc12)CC1(C)OCCO1	ZINC000819097066	FF	On-Demand	Anodyne	ADRB1	53	39
C[C@H](CNC[C@H](O)COc1cccc2ccccc12)CC1(C)OCCO1	ZINC000819097069	FF	On-Demand	Anodyne	ADRB2	32	64
C[C@H](CNC[C@H](O)COc1cccc2ccccc12)CC1(C)OCCO1	ZINC000819097069	FF	On-Demand	Anodyne	ADRB1	53	39
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H](C)CC2(C)OCCO2)c1	ZINC000819097075	FE	On-Demand	Anodyne	ADRB2	36	45
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H](C)CC2(C)OCCO2)c1	ZINC000819097075	FE	On-Demand	Anodyne	ADRB1	58	40
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H](C)CC2(C)OCCO2)c1	ZINC000819097075	FE	On-Demand	Anodyne	ABCB1	22	48
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](C)CC2(C)OCCO2)c1	ZINC000819097077	FE	On-Demand	Anodyne	ADRB2	36	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](C)CC2(C)OCCO2)c1	ZINC000819097077	FE	On-Demand	Anodyne	ADRB1	58	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@H](C)CC2(C)OCCO2)c1	ZINC000819097077	FE	On-Demand	Anodyne	ABCB1	22	48
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](C)CC2(C)OCCO2)c1	ZINC000819097078	FE	On-Demand	Anodyne	ADRB2	36	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](C)CC2(C)OCCO2)c1	ZINC000819097078	FE	On-Demand	Anodyne	ADRB1	58	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H](C)CC2(C)OCCO2)c1	ZINC000819097078	FE	On-Demand	Anodyne	ABCB1	22	48
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H](C)CC2(C)OCCO2)c1	ZINC000819097081	FE	On-Demand	Anodyne	ADRB2	36	45
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H](C)CC2(C)OCCO2)c1	ZINC000819097081	FE	On-Demand	Anodyne	ADRB1	58	40
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H](C)CC2(C)OCCO2)c1	ZINC000819097081	FE	On-Demand	Anodyne	ABCB1	22	48
Cc1cc(C(N)=O)ccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819097089	FF	On-Demand	Mild	PAPA1_CARPA	42	43
Cc1cc(C(N)=O)ccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819097093	FF	On-Demand	Mild	PAPA1_CARPA	42	43
CCCCCOc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097139	GF	On-Demand	Anodyne	MMP13	81	48
CCCCCOc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097139	GF	On-Demand	Anodyne	PLA2G4A	24	42
CCCCCOc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097139	GF	On-Demand	Anodyne	ADAM17	61	48
CCCCCOc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097139	GF	On-Demand	Anodyne	MMP2	33	45
CCCCCOc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097139	GF	On-Demand	Anodyne	MMP3	55	45
CCCCCOc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097139	GF	On-Demand	Anodyne	MMP8	27	43
CCCCCOc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097139	GF	On-Demand	Anodyne	MMP14	15	40
CCCCCOc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097139	GF	On-Demand	Anodyne	PLA2G4B	101	42
CCCCCOc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097139	GF	On-Demand	Anodyne	MMP9	41	48
CCCCCOc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097139	GF	On-Demand	Anodyne	TGM2	44	38
CCCCCOc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097139	GF	On-Demand	Anodyne	MMP7	53	45
CCCCCOc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097139	GF	On-Demand	Anodyne	MMP1	58	46
CCCCCOc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097139	GF	On-Demand	Anodyne	F13A1	57	38
C[C@H](CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1)CC1(C)OCCO1	ZINC000819097143	FD	On-Demand	Bother	ADRB2	26	46
C[C@H](CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1)CC1(C)OCCO1	ZINC000819097143	FD	On-Demand	Bother	ADRB1	28	46
C[C@H](CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1)CC1(C)OCCO1	ZINC000819097143	FD	On-Demand	Bother	ADRB3	18	46
C[C@@H](CNC[C@H](O)COc1cccc([N+](=O)[O-])c1)CC1(C)OCCO1	ZINC000819097144	FD	On-Demand	Bother	ADRB2	26	46
C[C@@H](CNC[C@H](O)COc1cccc([N+](=O)[O-])c1)CC1(C)OCCO1	ZINC000819097144	FD	On-Demand	Bother	ADRB1	28	46
C[C@@H](CNC[C@H](O)COc1cccc([N+](=O)[O-])c1)CC1(C)OCCO1	ZINC000819097144	FD	On-Demand	Bother	ADRB3	18	46
C[C@@H](CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1)CC1(C)OCCO1	ZINC000819097145	FD	On-Demand	Bother	ADRB2	26	46
C[C@@H](CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1)CC1(C)OCCO1	ZINC000819097145	FD	On-Demand	Bother	ADRB1	28	46
C[C@@H](CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1)CC1(C)OCCO1	ZINC000819097145	FD	On-Demand	Bother	ADRB3	18	46
C[C@H](CNC[C@H](O)COc1cccc([N+](=O)[O-])c1)CC1(C)OCCO1	ZINC000819097146	FD	On-Demand	Bother	ADRB2	26	46
C[C@H](CNC[C@H](O)COc1cccc([N+](=O)[O-])c1)CC1(C)OCCO1	ZINC000819097146	FD	On-Demand	Bother	ADRB1	28	46
C[C@H](CNC[C@H](O)COc1cccc([N+](=O)[O-])c1)CC1(C)OCCO1	ZINC000819097146	FD	On-Demand	Bother	ADRB3	18	46
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819097166	FD	On-Demand	Anodyne	ADRB2	47	58
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819097166	FD	On-Demand	Anodyne	ADRB1	82	58
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819097166	FD	On-Demand	Anodyne	GRIN1	22	41
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819097166	FD	On-Demand	Anodyne	ADRB3	51	55
CCC(=O)Nc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097193	FD	On-Demand	Anodyne	CA2	17	47
CCC(=O)Nc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097193	FD	On-Demand	Anodyne	TGM2	80	50
CCC(=O)Nc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097193	FD	On-Demand	Anodyne	F13A1	111	50
CCC(=O)Nc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097193	FD	On-Demand	Anodyne	NAMPT	33	44
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819097209	FD	On-Demand	Anodyne	ADRB2	47	58
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819097209	FD	On-Demand	Anodyne	ADRB1	82	58
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819097209	FD	On-Demand	Anodyne	GRIN1	22	41
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819097209	FD	On-Demand	Anodyne	ADRB3	51	55
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819097210	FD	On-Demand	Anodyne	ADRB2	47	58
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819097210	FD	On-Demand	Anodyne	ADRB1	82	58
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819097210	FD	On-Demand	Anodyne	GRIN1	22	41
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819097210	FD	On-Demand	Anodyne	ADRB3	51	55
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819097211	FD	On-Demand	Anodyne	ADRB2	47	58
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819097211	FD	On-Demand	Anodyne	ADRB1	82	58
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819097211	FD	On-Demand	Anodyne	GRIN1	22	41
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819097211	FD	On-Demand	Anodyne	ADRB3	51	55
C#CCSCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819097218	DD	On-Demand	Mild	ADRB2	29	49
C#CCSCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819097218	DD	On-Demand	Mild	ADRB1	50	49
C#CCSCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819097218	DD	On-Demand	Mild	ADRB3	26	49
C#CCSCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819097219	DD	On-Demand	Mild	ADRB2	29	49
C#CCSCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819097219	DD	On-Demand	Mild	ADRB1	50	49
C#CCSCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819097219	DD	On-Demand	Mild	ADRB3	26	49
CC(=O)Nc1cccc(CC(=O)NNC(=O)C2CCCC2)c1	ZINC000819097246	DD	On-Demand	Reactive	SIGMAR1	16	40
CC(=O)Nc1cccc(CC(=O)NNC(=O)C2CCCC2)c1	ZINC000819097246	DD	On-Demand	Reactive	CCR3	30	41
CC(=O)Nc1cccc(CC(=O)NNC(=O)C2CCCC2)c1	ZINC000819097246	DD	On-Demand	Reactive	EPHX2	16	41
O=C1CCc2cc(OC[C@@H](O)CNCc3ccc(N4CC=CC4)cc3)ccc2N1	ZINC000819097254	GE	On-Demand	Clean	ADRB1	46	38
O=C1CCc2cc(OC[C@H](O)CNCc3ccc(N4CC=CC4)cc3)ccc2N1	ZINC000819097255	GE	On-Demand	Clean	ADRB1	46	38
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097260	FE	On-Demand	Anodyne	HTR1A	31	44
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097260	FE	On-Demand	Anodyne	DRD2	43	42
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097260	FE	On-Demand	Anodyne	DRD4	51	38
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097260	FE	On-Demand	Anodyne	ACHE	41	42
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097260	FE	On-Demand	Anodyne	HTR2A	30	43
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097260	FE	On-Demand	Anodyne	DRD3	59	49
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097260	FE	On-Demand	Anodyne	HTR7	17	44
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097260	FE	On-Demand	Anodyne	SIGMAR1	62	42
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097260	FE	On-Demand	Anodyne	CCR3	28	44
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097260	FE	On-Demand	Anodyne	CYP2J2	45	32
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097261	FE	On-Demand	Anodyne	HTR1A	31	44
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097261	FE	On-Demand	Anodyne	DRD2	43	42
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097261	FE	On-Demand	Anodyne	DRD4	51	38
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097261	FE	On-Demand	Anodyne	ACHE	41	42
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097261	FE	On-Demand	Anodyne	HTR2A	30	43
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097261	FE	On-Demand	Anodyne	DRD3	59	49
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097261	FE	On-Demand	Anodyne	HTR7	17	44
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097261	FE	On-Demand	Anodyne	SIGMAR1	62	42
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097261	FE	On-Demand	Anodyne	CCR3	28	44
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097261	FE	On-Demand	Anodyne	CYP2J2	45	32
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097262	FE	On-Demand	Anodyne	HTR1A	31	44
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097262	FE	On-Demand	Anodyne	DRD2	43	42
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097262	FE	On-Demand	Anodyne	DRD4	51	38
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097262	FE	On-Demand	Anodyne	ACHE	41	42
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097262	FE	On-Demand	Anodyne	HTR2A	30	43
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097262	FE	On-Demand	Anodyne	DRD3	59	49
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097262	FE	On-Demand	Anodyne	HTR7	17	44
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097262	FE	On-Demand	Anodyne	SIGMAR1	62	42
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097262	FE	On-Demand	Anodyne	CCR3	28	44
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097262	FE	On-Demand	Anodyne	CYP2J2	45	32
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097263	FE	On-Demand	Anodyne	HTR1A	31	44
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097263	FE	On-Demand	Anodyne	DRD2	43	42
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097263	FE	On-Demand	Anodyne	DRD4	51	38
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097263	FE	On-Demand	Anodyne	ACHE	41	42
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097263	FE	On-Demand	Anodyne	HTR2A	30	43
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097263	FE	On-Demand	Anodyne	DRD3	59	49
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097263	FE	On-Demand	Anodyne	HTR7	17	44
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097263	FE	On-Demand	Anodyne	SIGMAR1	62	42
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097263	FE	On-Demand	Anodyne	CCR3	28	44
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(Cc2ccccc2)CC1	ZINC000819097263	FE	On-Demand	Anodyne	CYP2J2	45	32
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819097264	FE	On-Demand	Anodyne	ADRB2	38	43
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819097264	FE	On-Demand	Anodyne	ADRB1	66	42
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819097264	FE	On-Demand	Anodyne	ADRB3	36	41
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819097265	FE	On-Demand	Anodyne	ADRB2	38	43
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819097265	FE	On-Demand	Anodyne	ADRB1	66	42
CC(=O)c1ccc(OC[C@H](O)CNC[C@H](C)CC2(C)OCCO2)cc1	ZINC000819097265	FE	On-Demand	Anodyne	ADRB3	36	41
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819097266	FE	On-Demand	Anodyne	ADRB2	38	43
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819097266	FE	On-Demand	Anodyne	ADRB1	66	42
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819097266	FE	On-Demand	Anodyne	ADRB3	36	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819097267	FE	On-Demand	Anodyne	ADRB2	38	43
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819097267	FE	On-Demand	Anodyne	ADRB1	66	42
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H](C)CC2(C)OCCO2)cc1	ZINC000819097267	FE	On-Demand	Anodyne	ADRB3	36	41
C#CCSCCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819097273	DD	On-Demand	Mild	ADRB2	51	59
C#CCSCCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819097273	DD	On-Demand	Mild	ADRB1	90	59
C#CCSCCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819097273	DD	On-Demand	Mild	GRIN1	18	42
C#CCSCCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819097273	DD	On-Demand	Mild	ADRB3	54	59
C#CCSCCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819097274	DD	On-Demand	Mild	ADRB2	51	59
C#CCSCCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819097274	DD	On-Demand	Mild	ADRB1	90	59
C#CCSCCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819097274	DD	On-Demand	Mild	GRIN1	18	42
C#CCSCCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819097274	DD	On-Demand	Mild	ADRB3	54	59
C[C@H](CNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1)CC1(C)OCCO1	ZINC000819097275	GG	On-Demand	Anodyne	CYNT	24	43
C[C@@H](CNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1)CC1(C)OCCO1	ZINC000819097276	GG	On-Demand	Anodyne	CYNT	24	43
COc1ccc(OC)c([C@H](O)CNCCC(=O)OC(C)(C)C)c1	ZINC000819097287	EE	On-Demand	Anodyne	ADRB2	23	49
COc1ccc(OC)c([C@H](O)CNCCC(=O)OC(C)(C)C)c1	ZINC000819097287	EE	On-Demand	Anodyne	MTNR1A	24	41
CC(C)(C)OC(=O)CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819097301	FE	On-Demand	Anodyne	GPR119	33	43
CC(C)(C)OC(=O)CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819097302	FE	On-Demand	Anodyne	GPR119	33	43
CCOc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c2ccccc12	ZINC000819097354	GE	On-Demand	Anodyne	CCR8	21	43
CCOc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c2ccccc12	ZINC000819097354	GE	On-Demand	Anodyne	HCN1	44	33
CCOc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c2ccccc12	ZINC000819097354	GE	On-Demand	Anodyne	HCN4	41	32
COC(=O)/C=C\c1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097358	GD	On-Demand	Anodyne	TGM2	56	36
COC(=O)/C=C\c1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097358	GD	On-Demand	Anodyne	F13A1	71	42
Cn1cc(S(=O)(=O)N2CCC(NC[C@H](O)c3cccc(F)c3)CC2)cn1	ZINC000819097359	GD	On-Demand	Anodyne	ADRB3	32	44
Cn1cc(S(=O)(=O)N2CCC(NC[C@@H](O)c3cccc(F)c3)CC2)cn1	ZINC000819097361	GD	On-Demand	Anodyne	ADRB3	32	44
CS(=O)(=O)c1ccc(S(=O)(=O)N2CCC3(CC2)C[C@@H]3C(=O)O)cn1	ZINC000819097363	FC	On-Demand	Anodyne	GCK	56	32
CS(=O)(=O)c1ccc(S(=O)(=O)N2CCC3(CC2)C[C@@H]3C(=O)O)cn1	ZINC000819097363	FC	On-Demand	Anodyne	GCKR	45	31
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097365	ED	On-Demand	Anodyne	HTR1A	26	51
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097365	ED	On-Demand	Anodyne	DRD2	22	51
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097365	ED	On-Demand	Anodyne	DRD4	43	37
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097365	ED	On-Demand	Anodyne	HTR2A	19	41
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097365	ED	On-Demand	Anodyne	DRD3	27	41
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097365	ED	On-Demand	Anodyne	PLD1	44	37
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097365	ED	On-Demand	Anodyne	PLD2	64	37
CS(=O)(=O)c1ccc(S(=O)(=O)N2CCC3(CC2)C[C@H]3C(=O)O)cn1	ZINC000819097366	FC	On-Demand	Anodyne	GCK	56	32
CS(=O)(=O)c1ccc(S(=O)(=O)N2CCC3(CC2)C[C@H]3C(=O)O)cn1	ZINC000819097366	FC	On-Demand	Anodyne	GCKR	45	31
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097367	ED	On-Demand	Anodyne	HTR1A	26	51
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097367	ED	On-Demand	Anodyne	DRD2	22	51
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097367	ED	On-Demand	Anodyne	DRD4	43	37
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097367	ED	On-Demand	Anodyne	HTR2A	19	41
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097367	ED	On-Demand	Anodyne	DRD3	27	41
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097367	ED	On-Demand	Anodyne	PLD1	44	37
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097367	ED	On-Demand	Anodyne	PLD2	64	37
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097369	ED	On-Demand	Anodyne	HTR1A	26	51
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097369	ED	On-Demand	Anodyne	DRD2	22	51
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097369	ED	On-Demand	Anodyne	DRD4	43	37
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097369	ED	On-Demand	Anodyne	HTR2A	19	41
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097369	ED	On-Demand	Anodyne	DRD3	27	41
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097369	ED	On-Demand	Anodyne	PLD1	44	37
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097369	ED	On-Demand	Anodyne	PLD2	64	37
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097371	ED	On-Demand	Anodyne	HTR1A	26	51
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097371	ED	On-Demand	Anodyne	DRD2	22	51
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097371	ED	On-Demand	Anodyne	DRD4	43	37
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097371	ED	On-Demand	Anodyne	HTR2A	19	41
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097371	ED	On-Demand	Anodyne	DRD3	27	41
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097371	ED	On-Demand	Anodyne	PLD1	44	37
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819097371	ED	On-Demand	Anodyne	PLD2	64	37
COc1cccc([S@@](=O)CC(=O)Nc2ccccc2C(=O)NC(C)C)c1	ZINC000819097385	FF	On-Demand	Anodyne	MTNR1B	30	42
COc1cccc([S@@](=O)CC(=O)Nc2ccccc2C(=O)NC(C)C)c1	ZINC000819097385	FF	On-Demand	Anodyne	KCNK3	40	34
Cc1cccc([C@@H](C)CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819097387	DG	On-Demand	Bother	CACNA1C	52	39
Cc1cccc([C@@H](C)CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819097387	DG	On-Demand	Bother	CACNA1D	84	39
Cc1cccc([C@@H](C)CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819097391	DG	On-Demand	Bother	CACNA1C	52	39
Cc1cccc([C@@H](C)CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819097391	DG	On-Demand	Bother	CACNA1D	84	39
CC(C)(C)OC(=O)CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819097410	EF	On-Demand	Anodyne	ADRB3	32	50
CC(C)(C)OC(=O)CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819097412	EF	On-Demand	Anodyne	ADRB3	32	50
COC(=O)c1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c(Cl)c1	ZINC000819097422	GD	On-Demand	Anodyne	F13A1	22	41
COC(=O)c1ccc(OC)c(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c1	ZINC000819097436	GC	On-Demand	Anodyne	CPT1A	67	38
COC(=O)c1ccc(OC)c(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c1	ZINC000819097436	GC	On-Demand	Anodyne	CPT2	50	38
COC(=O)c1ccc(OC)c(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c1	ZINC000819097436	GC	On-Demand	Anodyne	CPT1B	55	38
COCCc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097448	FD	On-Demand	Anodyne	TGM2	46	38
COCCc1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cc1	ZINC000819097448	FD	On-Demand	Anodyne	F13A1	47	36
COc1ccccc1-n1cc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cn1	ZINC000819097455	GD	On-Demand	Anodyne	HTR1A	16	40
COc1ccccc1-n1cc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)cn1	ZINC000819097455	GD	On-Demand	Anodyne	ADRA1D	15	40
C=CCNC(=O)c1cccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c1	ZINC000819097464	GC	On-Demand	Mild	DRD4	41	32
C=CCNC(=O)c1cccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c1	ZINC000819097464	GC	On-Demand	Mild	TGM2	78	42
C=CCNC(=O)c1cccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c1	ZINC000819097464	GC	On-Demand	Mild	F13A1	81	42
C=CCNC(=O)c1cccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c1	ZINC000819097464	GC	On-Demand	Mild	AKR1C3	60	40
CC(C)(C)OC(=O)CCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819097512	EG	On-Demand	Anodyne	ADRB2	25	42
CC(C)(C)OC(=O)CCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819097512	EG	On-Demand	Anodyne	ADRB3	47	39
CC(C)(C)OC(=O)CCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819097513	EG	On-Demand	Anodyne	ADRB2	25	42
CC(C)(C)OC(=O)CCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819097513	EG	On-Demand	Anodyne	ADRB3	47	39
Cc1cccc([C@@H](C)CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819097516	EF	On-Demand	Anodyne	ADRB3	46	38
Cc1cccc([C@@H](C)CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819097517	EF	On-Demand	Anodyne	ADRB3	46	38
Cc1ccccc1[C@@H](O)CNCCC(=O)OC(C)(C)C	ZINC000819097529	CE	On-Demand	Anodyne	ADRB2	18	47
CN(C1CC1)S(=O)(=O)NCc1nc2ccc(C(=O)O)cc2[nH]1	ZINC000819097549	DC	On-Demand	Anodyne	GRIN2B	19	41
Cn1cc(S(=O)(=O)N2CCC(NC[C@H](O)c3ccc(Cl)cc3)CC2)cn1	ZINC000819097561	GD	On-Demand	Anodyne	ADRB3	29	43
Cn1cc(S(=O)(=O)N2CCC(NC[C@H](O)c3ccc(Cl)cc3)CC2)cn1	ZINC000819097561	GD	On-Demand	Anodyne	SLC6A9	20	46
COc1ccc(OC)c([C@H](O)CNCCc2ccc(C)c(OC)c2)c1	ZINC000819097585	EF	On-Demand	Anodyne	ADRB2	63	58
COc1ccc(OC)c([C@H](O)CNCCc2ccc(C)c(OC)c2)c1	ZINC000819097585	EF	On-Demand	Anodyne	ADRB1	66	46
COc1ccc(OC)c([C@H](O)CNCCc2ccc(C)c(OC)c2)c1	ZINC000819097585	EF	On-Demand	Anodyne	ADRB3	57	48
CC(C)(C)OC(=O)CCNC[C@@H](O)c1cccc(Br)c1	ZINC000819097601	EF	On-Demand	Anodyne	ADRB3	56	40
CC(C)(C)OC(=O)CCNC[C@H](O)c1cccc(Br)c1	ZINC000819097602	EF	On-Demand	Anodyne	ADRB3	56	40
CC[C@@H](NC[C@H](O)c1cccnc1)c1ccncc1	ZINC000819097608	CE	On-Demand	Anodyne	ADRB2	19	40
CC[C@@H](NC[C@H](O)c1cccnc1)c1ccncc1	ZINC000819097608	CE	On-Demand	Anodyne	ADRB1	21	47
CC[C@@H](NC[C@H](O)c1cccnc1)c1ccncc1	ZINC000819097608	CE	On-Demand	Anodyne	ADRB3	73	47
CC[C@@H](NC[C@@H](O)c1cccnc1)c1ccncc1	ZINC000819097610	CE	On-Demand	Anodyne	ADRB2	19	40
CC[C@@H](NC[C@@H](O)c1cccnc1)c1ccncc1	ZINC000819097610	CE	On-Demand	Anodyne	ADRB1	21	47
CC[C@@H](NC[C@@H](O)c1cccnc1)c1ccncc1	ZINC000819097610	CE	On-Demand	Anodyne	ADRB3	73	47
O[C@@H](CNCC1(c2ccccc2Br)CC1)c1cccnc1	ZINC000819097612	EG	On-Demand	Anodyne	ADRB2	17	40
O[C@@H](CNCC1(c2ccccc2Br)CC1)c1cccnc1	ZINC000819097612	EG	On-Demand	Anodyne	ADRB1	19	40
O[C@@H](CNCC1(c2ccccc2Br)CC1)c1cccnc1	ZINC000819097612	EG	On-Demand	Anodyne	ADRB3	77	41
O[C@H](CNCC1(c2ccccc2Br)CC1)c1cccnc1	ZINC000819097613	EG	On-Demand	Anodyne	ADRB2	17	40
O[C@H](CNCC1(c2ccccc2Br)CC1)c1cccnc1	ZINC000819097613	EG	On-Demand	Anodyne	ADRB1	19	40
O[C@H](CNCC1(c2ccccc2Br)CC1)c1cccnc1	ZINC000819097613	EG	On-Demand	Anodyne	ADRB3	77	41
CC(C)(C)OC(=O)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819097619	CF	On-Demand	Anodyne	ADRB2	57	44
CC(C)(C)OC(=O)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819097619	CF	On-Demand	Anodyne	ADRB1	66	54
CC(C)(C)OC(=O)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819097619	CF	On-Demand	Anodyne	ADRB3	86	54
CC(C)(C)OC(=O)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819097619	CF	On-Demand	Anodyne	CYP3A4	46	34
CC(C)(C)OC(=O)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819097620	CF	On-Demand	Anodyne	ADRB2	57	44
CC(C)(C)OC(=O)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819097620	CF	On-Demand	Anodyne	ADRB1	66	54
CC(C)(C)OC(=O)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819097620	CF	On-Demand	Anodyne	ADRB3	86	54
CC(C)(C)OC(=O)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819097620	CF	On-Demand	Anodyne	CYP3A4	46	34
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCNC(=O)C3)cc2)c1	ZINC000819097665	GD	On-Demand	Anodyne	DRD4	42	35
CC[C@@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccncc1	ZINC000819097668	FG	On-Demand	Anodyne	GPR119	51	44
CC[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccncc1	ZINC000819097669	FG	On-Demand	Anodyne	GPR119	51	44
C=CCC1(C(=O)Nc2cccc(CN(C)C(=O)OC(C)(C)C)c2)CCOCC1	ZINC000819097680	GI	On-Demand	Mild	LIMK2	18	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819097689	II	On-Demand	Anodyne	F2	45	46
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819097689	II	On-Demand	Anodyne	ACE	29	45
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819097689	II	On-Demand	Anodyne	FKBP1A	47	42
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819097689	II	On-Demand	Anodyne	OPRM1	28	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819097689	II	On-Demand	Anodyne	CELA1	26	48
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819097689	II	On-Demand	Anodyne	ELANE	39	43
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819097689	II	On-Demand	Anodyne	CTRA_BOVIN	63	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819097689	II	On-Demand	Anodyne	TRY1_BOVIN	61	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819097689	II	On-Demand	Anodyne	CTSG	43	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819097689	II	On-Demand	Anodyne	PREP	59	48
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819097689	II	On-Demand	Anodyne	CELA2A	51	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819097689	II	On-Demand	Anodyne	LGMN	97	49
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819097689	II	On-Demand	Anodyne	KLK5	25	43
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819097689	II	On-Demand	Anodyne	XIAP	42	39
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819097689	II	On-Demand	Anodyne	F13A1	43	36
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819097689	II	On-Demand	Anodyne	BRCA1	51	32
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819097689	II	On-Demand	Anodyne	SLC12A5	67	36
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819097689	II	On-Demand	Anodyne	TMPRSS11D	57	35
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097690	II	On-Demand	Anodyne	F2	45	46
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097690	II	On-Demand	Anodyne	ACE	29	45
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097690	II	On-Demand	Anodyne	FKBP1A	47	42
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097690	II	On-Demand	Anodyne	OPRM1	28	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097690	II	On-Demand	Anodyne	CELA1	26	48
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097690	II	On-Demand	Anodyne	ELANE	39	43
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097690	II	On-Demand	Anodyne	CTRA_BOVIN	63	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097690	II	On-Demand	Anodyne	TRY1_BOVIN	61	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097690	II	On-Demand	Anodyne	CTSG	43	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097690	II	On-Demand	Anodyne	PREP	59	48
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097690	II	On-Demand	Anodyne	CELA2A	51	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097690	II	On-Demand	Anodyne	LGMN	97	49
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097690	II	On-Demand	Anodyne	KLK5	25	43
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097690	II	On-Demand	Anodyne	XIAP	42	39
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097690	II	On-Demand	Anodyne	F13A1	43	36
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097690	II	On-Demand	Anodyne	BRCA1	51	32
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097690	II	On-Demand	Anodyne	SLC12A5	67	36
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097690	II	On-Demand	Anodyne	TMPRSS11D	57	35
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819097691	II	On-Demand	Anodyne	F2	45	46
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819097691	II	On-Demand	Anodyne	ACE	29	45
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819097691	II	On-Demand	Anodyne	FKBP1A	47	42
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819097691	II	On-Demand	Anodyne	OPRM1	28	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819097691	II	On-Demand	Anodyne	CELA1	26	48
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819097691	II	On-Demand	Anodyne	ELANE	39	43
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819097691	II	On-Demand	Anodyne	CTRA_BOVIN	63	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819097691	II	On-Demand	Anodyne	TRY1_BOVIN	61	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819097691	II	On-Demand	Anodyne	CTSG	43	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819097691	II	On-Demand	Anodyne	PREP	59	48
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819097691	II	On-Demand	Anodyne	CELA2A	51	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819097691	II	On-Demand	Anodyne	LGMN	97	49
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819097691	II	On-Demand	Anodyne	KLK5	25	43
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819097691	II	On-Demand	Anodyne	XIAP	42	39
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819097691	II	On-Demand	Anodyne	F13A1	43	36
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819097691	II	On-Demand	Anodyne	BRCA1	51	32
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819097691	II	On-Demand	Anodyne	SLC12A5	67	36
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819097691	II	On-Demand	Anodyne	TMPRSS11D	57	35
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819097692	II	On-Demand	Anodyne	F2	45	46
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819097692	II	On-Demand	Anodyne	ACE	29	45
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819097692	II	On-Demand	Anodyne	FKBP1A	47	42
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819097692	II	On-Demand	Anodyne	OPRM1	28	40
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819097692	II	On-Demand	Anodyne	CELA1	26	48
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819097692	II	On-Demand	Anodyne	ELANE	39	43
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819097692	II	On-Demand	Anodyne	CTRA_BOVIN	63	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819097692	II	On-Demand	Anodyne	TRY1_BOVIN	61	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819097692	II	On-Demand	Anodyne	CTSG	43	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819097692	II	On-Demand	Anodyne	PREP	59	48
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819097692	II	On-Demand	Anodyne	CELA2A	51	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819097692	II	On-Demand	Anodyne	LGMN	97	49
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819097692	II	On-Demand	Anodyne	KLK5	25	43
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819097692	II	On-Demand	Anodyne	XIAP	42	39
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819097692	II	On-Demand	Anodyne	F13A1	43	36
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819097692	II	On-Demand	Anodyne	BRCA1	51	32
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819097692	II	On-Demand	Anodyne	SLC12A5	67	36
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819097692	II	On-Demand	Anodyne	TMPRSS11D	57	35
CC(=O)N(c1ccc(NC(=O)c2cc(C)n(-c3ccccn3)c2C)cc1)[C@@H]1C[C@H]1C	ZINC000819097693	HJ	On-Demand	Clean	GRM4	40	37
CC(=O)N(c1ccc(NC(=O)c2cc(C)n(-c3ccccn3)c2C)cc1)[C@H]1C[C@@H]1C	ZINC000819097694	HJ	On-Demand	Clean	GRM4	40	37
CC(=O)N(c1ccc(NC(=O)c2cc(C)n(-c3ccccn3)c2C)cc1)[C@@H]1C[C@@H]1C	ZINC000819097695	HJ	On-Demand	Clean	GRM4	40	37
CC(=O)N(c1ccc(NC(=O)c2cc(C)n(-c3ccccn3)c2C)cc1)[C@H]1C[C@H]1C	ZINC000819097696	HJ	On-Demand	Clean	GRM4	40	37
COc1cccc([S@@](=O)CC(=O)NCCNc2ncccn2)c1	ZINC000819097722	EC	On-Demand	Anodyne	MTNR1A	51	41
COc1cccc([S@@](=O)CC(=O)NCCNc2ncccn2)c1	ZINC000819097722	EC	On-Demand	Anodyne	MTNR1B	47	41
O=C(O)c1ccc2nc(CNS(=O)(=O)CCC3CC3)[nH]c2c1	ZINC000819097729	DD	On-Demand	Anodyne	GRIN2B	24	41
CC(C)(C)OC(=O)CCNC[C@@H](O)c1cccc(F)c1	ZINC000819097733	CE	On-Demand	Anodyne	ADRB1	37	47
CC(C)(C)OC(=O)CCNC[C@@H](O)c1cccc(F)c1	ZINC000819097733	CE	On-Demand	Anodyne	ADRB3	52	47
CC(C)(C)OC(=O)CCNC[C@H](O)c1cccc(F)c1	ZINC000819097735	CE	On-Demand	Anodyne	ADRB1	37	47
CC(C)(C)OC(=O)CCNC[C@H](O)c1cccc(F)c1	ZINC000819097735	CE	On-Demand	Anodyne	ADRB3	52	47
Cn1cc(S(=O)(=O)N2CCC(NC[C@@H](O)c3ccc(C#N)cc3)CC2)cn1	ZINC000819097738	GC	On-Demand	Mild	ADRB3	19	42
Cn1cc(S(=O)(=O)N2CCC(NC[C@H](O)c3ccc(C#N)cc3)CC2)cn1	ZINC000819097742	GC	On-Demand	Mild	ADRB3	19	42
Cn1cc(S(=O)(=O)N2CCC(NC[C@H](O)c3cccc(Cl)c3)CC2)cn1	ZINC000819097754	GD	On-Demand	Anodyne	ADRB2	15	42
Cn1cc(S(=O)(=O)N2CCC(NC[C@H](O)c3cccc(Cl)c3)CC2)cn1	ZINC000819097754	GD	On-Demand	Anodyne	ADRB1	36	44
Cn1cc(S(=O)(=O)N2CCC(NC[C@H](O)c3cccc(Cl)c3)CC2)cn1	ZINC000819097754	GD	On-Demand	Anodyne	ADRB3	61	45
Cn1cc(S(=O)(=O)N2CCC(NC[C@H](O)c3cccc(Cl)c3)CC2)cn1	ZINC000819097754	GD	On-Demand	Anodyne	SLC6A9	27	45
Cn1cc(S(=O)(=O)N2CCC(NC[C@H](O)c3cccc(Cl)c3)CC2)cn1	ZINC000819097754	GD	On-Demand	Anodyne	CYP3A4	51	39
Cn1cc(S(=O)(=O)N2CCC(NC[C@@H](O)c3cccc(Cl)c3)CC2)cn1	ZINC000819097756	GD	On-Demand	Anodyne	ADRB2	15	42
Cn1cc(S(=O)(=O)N2CCC(NC[C@@H](O)c3cccc(Cl)c3)CC2)cn1	ZINC000819097756	GD	On-Demand	Anodyne	ADRB1	36	44
Cn1cc(S(=O)(=O)N2CCC(NC[C@@H](O)c3cccc(Cl)c3)CC2)cn1	ZINC000819097756	GD	On-Demand	Anodyne	ADRB3	61	45
Cn1cc(S(=O)(=O)N2CCC(NC[C@@H](O)c3cccc(Cl)c3)CC2)cn1	ZINC000819097756	GD	On-Demand	Anodyne	SLC6A9	27	45
Cn1cc(S(=O)(=O)N2CCC(NC[C@@H](O)c3cccc(Cl)c3)CC2)cn1	ZINC000819097756	GD	On-Demand	Anodyne	CYP3A4	51	39
COc1cc(CNC(=O)/C=C\[C@@H]2CCCO2)ccc1OCc1cccnc1	ZINC000819097803	FG	On-Demand	Anodyne	PTAFR	30	44
COc1cc(CNC(=O)/C=C/[C@@H]2CCCO2)ccc1OCc1cccnc1	ZINC000819097805	FG	On-Demand	Anodyne	PTAFR	30	44
COc1cc(CNC(=O)/C=C/[C@H]2CCCO2)ccc1OCc1cccnc1	ZINC000819097806	FG	On-Demand	Anodyne	PTAFR	30	44
COc1cc(CNC(=O)/C=C\[C@H]2CCCO2)ccc1OCc1cccnc1	ZINC000819097807	FG	On-Demand	Anodyne	PTAFR	30	44
Cn1cc(S(=O)(=O)N2CCC(NC[C@H](O)c3ccccc3)CC2)cn1	ZINC000819097833	FC	On-Demand	Anodyne	ADRB1	22	40
Cn1cc(S(=O)(=O)N2CCC(NC[C@H](O)c3ccccc3)CC2)cn1	ZINC000819097833	FC	On-Demand	Anodyne	ADRB3	47	45
Cn1cc(S(=O)(=O)N2CCC(NC[C@@H](O)c3ccccc3)CC2)cn1	ZINC000819097835	FC	On-Demand	Anodyne	ADRB1	22	40
Cn1cc(S(=O)(=O)N2CCC(NC[C@@H](O)c3ccccc3)CC2)cn1	ZINC000819097835	FC	On-Demand	Anodyne	ADRB3	47	45
Cn1cc(S(=O)(=O)N2CCC(NC[C@H](O)c3ccc(F)cc3)CC2)cn1	ZINC000819097865	GD	On-Demand	Anodyne	ADRB3	24	43
Cn1cc(S(=O)(=O)N2CCC(NC[C@@H](O)c3ccc(F)cc3)CC2)cn1	ZINC000819097866	GD	On-Demand	Anodyne	ADRB3	24	43
CC(C)(C)OC(=O)CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819097871	CF	On-Demand	Anodyne	ADRB2	20	42
CC(C)(C)OC(=O)CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819097871	CF	On-Demand	Anodyne	ADRB1	28	43
CC(C)(C)OC(=O)CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819097871	CF	On-Demand	Anodyne	ADRB3	38	43
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@H]1C	ZINC000819097879	HI	On-Demand	Anodyne	EPHX2	20	41
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@H]1C	ZINC000819097879	HI	On-Demand	Anodyne	F13A1	18	41
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@H]1C	ZINC000819097879	HI	On-Demand	Anodyne	GPR119	37	43
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097880	HI	On-Demand	Anodyne	EPHX2	20	41
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097880	HI	On-Demand	Anodyne	F13A1	18	41
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097880	HI	On-Demand	Anodyne	GPR119	37	43
C[C@H](NC[C@H](O)c1ccc(F)cc1Cl)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819097886	GG	On-Demand	Anodyne	DRD4	24	43
C[C@H](NC[C@H](O)c1ccc(F)cc1Cl)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819097887	GG	On-Demand	Anodyne	DRD4	24	43
O=C(O)c1ccc2nc(CNS(=O)(=O)C3CC3)[nH]c2c1	ZINC000819097894	CC	On-Demand	Anodyne	GRIN2B	19	41
COc1cc(CNC(=O)C(F)=C2CCC2)ccc1OCc1cccnc1	ZINC000819097905	FH	On-Demand	Anodyne	PTAFR	20	40
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@H]1C	ZINC000819097910	HI	On-Demand	Anodyne	EPHX2	20	41
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@H]1C	ZINC000819097910	HI	On-Demand	Anodyne	F13A1	18	41
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@H]1C	ZINC000819097910	HI	On-Demand	Anodyne	GPR119	37	43
Cc1ccccc1[C@@H](O)CNC1CCN(S(=O)(=O)c2cnn(C)c2)CC1	ZINC000819097911	GD	On-Demand	Anodyne	ADRB3	15	42
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@@H]1C	ZINC000819097914	HI	On-Demand	Anodyne	EPHX2	20	41
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@@H]1C	ZINC000819097914	HI	On-Demand	Anodyne	F13A1	18	41
CC(=O)N(c1ccc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@@H]1C	ZINC000819097914	HI	On-Demand	Anodyne	GPR119	37	43
CS(=O)(=O)c1ccc(S(=O)(=O)N2CCC3(CC2)C[C@@H]3C(=O)O)cc1F	ZINC000819097935	GD	On-Demand	Anodyne	PKM	44	39
CS(=O)(=O)c1ccc(S(=O)(=O)N2CCC3(CC2)C[C@H]3C(=O)O)cc1F	ZINC000819097938	GD	On-Demand	Anodyne	PKM	44	39
CC(C)(C)OC(=O)CCNC[C@@H](O)c1ccc(Br)cc1	ZINC000819097957	EF	On-Demand	Anodyne	ADRB2	17	52
CC(C)(C)OC(=O)CCNC[C@@H](O)c1ccc(Br)cc1	ZINC000819097957	EF	On-Demand	Anodyne	ADRB3	16	40
CC(C)(C)OC(=O)CCNC[C@H](O)c1ccc(Br)cc1	ZINC000819097958	EF	On-Demand	Anodyne	ADRB2	17	52
CC(C)(C)OC(=O)CCNC[C@H](O)c1ccc(Br)cc1	ZINC000819097958	EF	On-Demand	Anodyne	ADRB3	16	40
CC(=O)N(c1ccc(NC(=O)c2ccc(CN3CCCCC3=O)cc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819097962	HI	On-Demand	Anodyne	NOD2	45	38
CC(=O)N(c1ccc(NC(=O)c2ccc(CN3CCCCC3=O)cc2)cc1)[C@H]1C[C@H]1C	ZINC000819097964	HI	On-Demand	Anodyne	NOD2	45	38
O=C(O)[C@H]1CC12CCN(S(=O)(=O)c1cccc(-c3nnco3)c1)CC2	ZINC000819097966	FD	On-Demand	Anodyne	AKR1C3	47	34
CC(=O)N(c1ccc(NC(=O)c2ccc(CN3CCCCC3=O)cc2)cc1)[C@H]1C[C@@H]1C	ZINC000819097967	HI	On-Demand	Anodyne	NOD2	45	38
O=C(O)[C@@H]1CC12CCN(S(=O)(=O)c1cccc(-c3nnco3)c1)CC2	ZINC000819097968	FD	On-Demand	Anodyne	AKR1C3	47	34
CC(=O)N(c1ccc(NC(=O)c2ccc(CN3CCCCC3=O)cc2)cc1)[C@@H]1C[C@H]1C	ZINC000819097969	HI	On-Demand	Anodyne	NOD2	45	38
C[C@@H](NC[C@@H](O)c1ccccc1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819098005	EF	On-Demand	Anodyne	DRD4	23	45
C[C@@H](NC[C@@H](O)c1ccccc1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819098005	EF	On-Demand	Anodyne	SLC6A3	19	40
C[C@@H](NC[C@@H](O)c1ccccc1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819098007	EF	On-Demand	Anodyne	DRD4	23	45
C[C@@H](NC[C@@H](O)c1ccccc1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819098007	EF	On-Demand	Anodyne	SLC6A3	19	40
Cc1cccc([C@@H](C)CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819098022	CH	On-Demand	Anodyne	ADRB1	16	42
Cc1cccc([C@@H](C)CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819098022	CH	On-Demand	Anodyne	ADRB3	24	42
Cc1cccc([C@@H](C)CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819098025	CH	On-Demand	Anodyne	ADRB1	16	42
Cc1cccc([C@@H](C)CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819098025	CH	On-Demand	Anodyne	ADRB3	24	42
CC(=O)N(c1ccc(NC(=O)c2csc(-c3ccccn3)n2)cc1)[C@@H]1C[C@H]1C	ZINC000819098029	GI	On-Demand	Anodyne	GRM4	59	38
CC(=O)N(c1ccc(NC(=O)c2csc(-c3ccccn3)n2)cc1)[C@H]1C[C@@H]1C	ZINC000819098030	GI	On-Demand	Anodyne	GRM4	59	38
CC(=O)N(c1ccc(NC(=O)c2csc(-c3ccccn3)n2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098031	GI	On-Demand	Anodyne	GRM4	59	38
CC(=O)N(c1ccc(NC(=O)c2csc(-c3ccccn3)n2)cc1)[C@H]1C[C@H]1C	ZINC000819098032	GI	On-Demand	Anodyne	GRM4	59	38
O=C(c1cc(OCc2ccccc2)ccn1)N1CCCc2c(OC(F)F)cccc21	ZINC000819098045	HJ	On-Demand	Anodyne	PTGER1	45	38
O=C(O)c1ccc2nc(CNS(=O)(=O)CCC3CCCCC3)[nH]c2c1	ZINC000819098086	FF	On-Demand	Anodyne	GRIN2B	15	40
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2ccc(F)cc2Cl)CC1	ZINC000819098106	FF	On-Demand	Anodyne	P2RX7	57	40
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2ccc(F)cc2Cl)CC1	ZINC000819098107	FF	On-Demand	Anodyne	P2RX7	57	40
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2ccc(F)cc2Cl)CC1	ZINC000819098108	FF	On-Demand	Anodyne	P2RX7	57	40
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2ccc(F)cc2Cl)CC1	ZINC000819098109	FF	On-Demand	Anodyne	P2RX7	57	40
N#Cc1cccc(OCC(=O)N2CCCc3c(OC(F)F)cccc32)c1	ZINC000819098134	FH	On-Demand	Mild	AR	27	41
N#Cc1cccc(OCC(=O)N2CCCc3c(OC(F)F)cccc32)c1	ZINC000819098134	FH	On-Demand	Mild	CPT1A	29	41
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)cc1)[C@@H]1C[C@@H]1C	ZINC000819098149	IK	On-Demand	Anodyne	METAP1	43	36
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)cc1)[C@H]1C[C@@H]1C	ZINC000819098152	IK	On-Demand	Anodyne	METAP1	43	36
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)cc1)[C@H]1C[C@H]1C	ZINC000819098154	IK	On-Demand	Anodyne	METAP1	43	36
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)cc1)[C@@H]1C[C@H]1C	ZINC000819098157	IK	On-Demand	Anodyne	METAP1	43	36
COc1cccc(Oc2ncccc2CNCCC(=O)N(C)OC)c1	ZINC000819098183	EE	On-Demand	Anodyne	P2RY1	17	41
CC(=O)N(c1ccc(NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819098226	HK	On-Demand	Anodyne	TAAR1	43	40
CC(=O)N(c1ccc(NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819098226	HK	On-Demand	Anodyne	KCNK3	98	39
CC(=O)N(c1ccc(NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819098226	HK	On-Demand	Anodyne	KCNK9	52	38
CC(=O)N(c1ccc(NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819098227	HK	On-Demand	Anodyne	TAAR1	43	40
CC(=O)N(c1ccc(NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819098227	HK	On-Demand	Anodyne	KCNK3	98	39
CC(=O)N(c1ccc(NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819098227	HK	On-Demand	Anodyne	KCNK9	52	38
CC(=O)N(c1ccc(NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1)[C@H]1C[C@H]1C	ZINC000819098228	HK	On-Demand	Anodyne	TAAR1	43	40
CC(=O)N(c1ccc(NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1)[C@H]1C[C@H]1C	ZINC000819098228	HK	On-Demand	Anodyne	KCNK3	98	39
CC(=O)N(c1ccc(NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1)[C@H]1C[C@H]1C	ZINC000819098228	HK	On-Demand	Anodyne	KCNK9	52	38
CC(=O)N(c1ccc(NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098229	HK	On-Demand	Anodyne	TAAR1	43	40
CC(=O)N(c1ccc(NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098229	HK	On-Demand	Anodyne	KCNK3	98	39
CC(=O)N(c1ccc(NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098229	HK	On-Demand	Anodyne	KCNK9	52	38
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@@H]1C[C@H]1C	ZINC000819098234	HE	On-Demand	Anodyne	CA2	46	43
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@@H]1C[C@H]1C	ZINC000819098234	HE	On-Demand	Anodyne	CA1	40	43
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@@H]1C[C@H]1C	ZINC000819098234	HE	On-Demand	Anodyne	CA4	44	43
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@@H]1C[C@H]1C	ZINC000819098234	HE	On-Demand	Anodyne	CA9	33	43
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@@H]1C[C@H]1C	ZINC000819098234	HE	On-Demand	Anodyne	MTCA1	42	37
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@@H]1C[C@H]1C	ZINC000819098234	HE	On-Demand	Anodyne	P96878_MYCTU	52	37
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@@H]1C[C@@H]1C	ZINC000819098235	HE	On-Demand	Anodyne	CA2	46	43
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@@H]1C[C@@H]1C	ZINC000819098235	HE	On-Demand	Anodyne	CA1	40	43
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@@H]1C[C@@H]1C	ZINC000819098235	HE	On-Demand	Anodyne	CA4	44	43
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@@H]1C[C@@H]1C	ZINC000819098235	HE	On-Demand	Anodyne	CA9	33	43
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@@H]1C[C@@H]1C	ZINC000819098235	HE	On-Demand	Anodyne	MTCA1	42	37
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@@H]1C[C@@H]1C	ZINC000819098235	HE	On-Demand	Anodyne	P96878_MYCTU	52	37
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@H]1C[C@@H]1C	ZINC000819098236	HE	On-Demand	Anodyne	CA2	46	43
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@H]1C[C@@H]1C	ZINC000819098236	HE	On-Demand	Anodyne	CA1	40	43
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@H]1C[C@@H]1C	ZINC000819098236	HE	On-Demand	Anodyne	CA4	44	43
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@H]1C[C@@H]1C	ZINC000819098236	HE	On-Demand	Anodyne	CA9	33	43
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@H]1C[C@@H]1C	ZINC000819098236	HE	On-Demand	Anodyne	MTCA1	42	37
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@H]1C[C@@H]1C	ZINC000819098236	HE	On-Demand	Anodyne	P96878_MYCTU	52	37
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@H]1C[C@H]1C	ZINC000819098237	HE	On-Demand	Anodyne	CA2	46	43
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@H]1C[C@H]1C	ZINC000819098237	HE	On-Demand	Anodyne	CA1	40	43
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@H]1C[C@H]1C	ZINC000819098237	HE	On-Demand	Anodyne	CA4	44	43
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@H]1C[C@H]1C	ZINC000819098237	HE	On-Demand	Anodyne	CA9	33	43
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@H]1C[C@H]1C	ZINC000819098237	HE	On-Demand	Anodyne	MTCA1	42	37
CC(=O)N(c1ccc(NC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1)[C@H]1C[C@H]1C	ZINC000819098237	HE	On-Demand	Anodyne	P96878_MYCTU	52	37
CC(=O)N(c1ccc(NC(=O)c2ccc(OC(F)(F)Cl)cc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098251	HJ	On-Demand	Anodyne	SHH	40	36
CC(=O)N(c1ccc(NC(=O)c2ccc(OC(F)(F)Cl)cc2)cc1)[C@@H]1C[C@H]1C	ZINC000819098252	HJ	On-Demand	Anodyne	SHH	40	36
CC(=O)N(c1ccc(NC(=O)c2ccc(OC(F)(F)Cl)cc2)cc1)[C@H]1C[C@@H]1C	ZINC000819098253	HJ	On-Demand	Anodyne	SHH	40	36
CC(=O)N(c1ccc(NC(=O)c2ccc(OC(F)(F)Cl)cc2)cc1)[C@H]1C[C@H]1C	ZINC000819098254	HJ	On-Demand	Anodyne	SHH	40	36
O=C(c1ccc(-n2cccc2)nc1)N1CCCc2c(OC(F)F)cccc21	ZINC000819098279	FI	On-Demand	Anodyne	AVPR2	21	40
O=C1O[C@@H](c2ccccc2)Cc2cc(C(=O)N3CCCc4c(OC(F)F)cccc43)ccc21	ZINC000819098280	IK	On-Demand	Anodyne	AVPR2	42	39
Cc1ccccc1CN1CCCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819098298	EF	On-Demand	Anodyne	SLC6A1	41	34
Cc1ccccc1CN1CCCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819098299	EF	On-Demand	Anodyne	SLC6A1	41	34
Cc1ccccc1CN1CCCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819098300	EF	On-Demand	Anodyne	SLC6A1	41	34
Cc1ccccc1CN1CCCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819098301	EF	On-Demand	Anodyne	SLC6A1	41	34
Cc1cccc([C@@H](C)CNC[C@@H](O)c2ccccc2)c1	ZINC000819098313	CG	On-Demand	Anodyne	ADRB2	24	41
Cc1cccc([C@@H](C)CNC[C@@H](O)c2ccccc2)c1	ZINC000819098313	CG	On-Demand	Anodyne	ADRB3	60	39
Cc1cccc([C@@H](C)CNC[C@@H](O)c2ccccc2)c1	ZINC000819098313	CG	On-Demand	Anodyne	AOC3	16	45
Cc1cccc([C@@H](C)CNC[C@H](O)c2ccccc2)c1	ZINC000819098315	CG	On-Demand	Anodyne	ADRB2	24	41
Cc1cccc([C@@H](C)CNC[C@H](O)c2ccccc2)c1	ZINC000819098315	CG	On-Demand	Anodyne	ADRB3	60	39
Cc1cccc([C@@H](C)CNC[C@H](O)c2ccccc2)c1	ZINC000819098315	CG	On-Demand	Anodyne	AOC3	16	45
O=C(O)c1ccc2nc(CNS(=O)(=O)CC3CCCCC3)[nH]c2c1	ZINC000819098316	FE	On-Demand	Anodyne	TXN	17	40
C[C@@H](NC[C@@H](O)c1cc2ccccc2o1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819098317	GG	On-Demand	Anodyne	SIGMAR1	27	43
C[C@@H](NC[C@@H](O)c1cc2ccccc2o1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819098318	GG	On-Demand	Anodyne	SIGMAR1	27	43
CC(C)(C)OC(=O)CCNC[C@@H](O)c1ccc(F)cc1	ZINC000819098326	CE	On-Demand	Anodyne	ADRB2	19	42
CC(C)(C)OC(=O)CCNC[C@@H](O)c1ccc(F)cc1	ZINC000819098326	CE	On-Demand	Anodyne	ADRB3	22	40
CC(C)(C)OC(=O)CCNC[C@H](O)c1ccc(F)cc1	ZINC000819098327	CE	On-Demand	Anodyne	ADRB2	19	42
CC(C)(C)OC(=O)CCNC[C@H](O)c1ccc(F)cc1	ZINC000819098327	CE	On-Demand	Anodyne	ADRB3	22	40
Cc1cccc([C@@H](C)CNC[C@@H](O)c2cccnc2)c1	ZINC000819098342	CF	On-Demand	Anodyne	ADRB2	27	43
Cc1cccc([C@@H](C)CNC[C@@H](O)c2cccnc2)c1	ZINC000819098342	CF	On-Demand	Anodyne	ADRB1	28	43
Cc1cccc([C@@H](C)CNC[C@@H](O)c2cccnc2)c1	ZINC000819098342	CF	On-Demand	Anodyne	ADRB3	100	48
Cc1cccc([C@@H](C)CNC[C@@H](O)c2cccnc2)c1	ZINC000819098342	CF	On-Demand	Anodyne	KCNA5	21	43
Cc1cccc([C@@H](C)CNC[C@H](O)c2cccnc2)c1	ZINC000819098343	CF	On-Demand	Anodyne	ADRB2	27	43
Cc1cccc([C@@H](C)CNC[C@H](O)c2cccnc2)c1	ZINC000819098343	CF	On-Demand	Anodyne	ADRB1	28	43
Cc1cccc([C@@H](C)CNC[C@H](O)c2cccnc2)c1	ZINC000819098343	CF	On-Demand	Anodyne	ADRB3	100	48
Cc1cccc([C@@H](C)CNC[C@H](O)c2cccnc2)c1	ZINC000819098343	CF	On-Demand	Anodyne	KCNA5	21	43
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2C(=O)NC(C)C)c1	ZINC000819098351	FF	On-Demand	Anodyne	NR1H4	18	50
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2C(=O)NC(C)C)c1	ZINC000819098351	FF	On-Demand	Anodyne	KCNK3	81	39
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2C(=O)NC(C)C)c1	ZINC000819098351	FF	On-Demand	Anodyne	KCNK9	64	39
C[C@H](NC[C@H](O)c1cc(F)ccc1F)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819098367	GF	On-Demand	Anodyne	DRD4	26	44
C[C@H](NC[C@H](O)c1cc(F)ccc1F)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819098367	GF	On-Demand	Anodyne	SIGMAR1	21	41
C[C@H](NC[C@H](O)c1cc(F)ccc1F)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819098368	GF	On-Demand	Anodyne	DRD4	26	44
C[C@H](NC[C@H](O)c1cc(F)ccc1F)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819098368	GF	On-Demand	Anodyne	SIGMAR1	21	41
CN(CC1CC1)S(=O)(=O)NCc1nc2ccc(C(=O)O)cc2[nH]1	ZINC000819098374	EC	On-Demand	Anodyne	GRIN2B	18	43
CC[C@@H](NC[C@H](O)c1ccccc1)c1ccncc1	ZINC000819098377	CF	On-Demand	Anodyne	AOC3	15	45
CC[C@@H](NC[C@@H](O)c1ccccc1)c1ccncc1	ZINC000819098379	CF	On-Demand	Anodyne	AOC3	15	45
O=C1O[C@H](c2ccccc2)Cc2cc(C(=O)N3CCCc4c(OC(F)F)cccc43)ccc21	ZINC000819098381	IK	On-Demand	Anodyne	AVPR2	42	39
CC(=O)N(c1ccc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819098413	GI	On-Demand	Bother	TAAR1	25	41
CC(=O)N(c1ccc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098414	GI	On-Demand	Bother	TAAR1	25	41
CC(=O)N(c1ccc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819098415	GI	On-Demand	Bother	TAAR1	25	41
CC(=O)N(c1ccc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)cc1)[C@H]1C[C@H]1C	ZINC000819098416	GI	On-Demand	Bother	TAAR1	25	41
CC(=O)N(c1ccc(NC(=O)c2ccc(C)cn2)cc1)[C@H]1C[C@H]1C	ZINC000819098417	DG	On-Demand	Anodyne	FLT3	24	43
CC(=O)N(c1ccc(NC(=O)c2ccc(C)cn2)cc1)[C@@H]1C[C@H]1C	ZINC000819098418	DG	On-Demand	Anodyne	FLT3	24	43
CC(=O)N(c1ccc(NC(=O)c2ccc(C)cn2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098419	DG	On-Demand	Anodyne	FLT3	24	43
CC(=O)N(c1ccc(NC(=O)c2ccc(C)cn2)cc1)[C@H]1C[C@@H]1C	ZINC000819098420	DG	On-Demand	Anodyne	FLT3	24	43
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@H]3C)cc2)cc1	ZINC000819098436	GI	On-Demand	Anodyne	PRNP	44	35
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@@H]3C)cc2)cc1	ZINC000819098437	GI	On-Demand	Anodyne	PRNP	44	35
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(N(C(C)=O)[C@H]3C[C@H]3C)cc2)cc1	ZINC000819098438	GI	On-Demand	Anodyne	PRNP	44	35
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(N(C(C)=O)[C@H]3C[C@@H]3C)cc2)cc1	ZINC000819098439	GI	On-Demand	Anodyne	PRNP	44	35
CC(=O)N(c1ccc(NC(=O)/C(=C\c2ccco2)NC(=O)c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819098442	II	On-Demand	Anodyne	ADAM12	25	43
CC(=O)N(c1ccc(NC(=O)/C(=C/c2ccco2)NC(=O)c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098443	II	On-Demand	Anodyne	ADAM12	25	43
CC(=O)N(c1ccc(NC(=O)/C(=C\c2ccco2)NC(=O)c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098444	II	On-Demand	Anodyne	ADAM12	25	43
CC(=O)N(c1ccc(NC(=O)/C(=C/c2ccco2)NC(=O)c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819098445	II	On-Demand	Anodyne	ADAM12	25	43
CCOc1ccc(/C=C(/C#N)C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@@H]3C)cc2)cc1	ZINC000819098454	HI	On-Demand	Reactive	CA12	15	46
CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@H]3C)cc2)cc1	ZINC000819098455	HI	On-Demand	Reactive	CA12	15	46
CCOc1ccc(/C=C(\C#N)C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@@H]3C)cc2)cc1	ZINC000819098456	HI	On-Demand	Reactive	CA12	15	46
CCOc1ccc(/C=C(/C#N)C(=O)Nc2ccc(N(C(C)=O)[C@@H]3C[C@H]3C)cc2)cc1	ZINC000819098457	HI	On-Demand	Reactive	CA12	15	46
CC(C)(C)OC(=O)CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819098486	DF	On-Demand	Anodyne	ADRB2	26	43
CC(C)(C)OC(=O)CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819098486	DF	On-Demand	Anodyne	ADRB1	27	43
CC(C)(C)OC(=O)CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819098487	DF	On-Demand	Anodyne	ADRB2	26	43
CC(C)(C)OC(=O)CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819098487	DF	On-Demand	Anodyne	ADRB1	27	43
O=C(O)c1ccc2nc(CNS(=O)(=O)CCC3CCCC3)[nH]c2c1	ZINC000819098496	FE	On-Demand	Anodyne	GRIN2B	19	40
O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)C(F)=C1CCC1	ZINC000819098502	EG	On-Demand	Anodyne	CPT1A	56	41
CC(C)(C)OC(=O)CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819098507	DD	On-Demand	Bother	CACNA1C	46	34
CC(C)(C)OC(=O)CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819098507	DD	On-Demand	Bother	ADRB3	45	40
CC(C)(C)OC(=O)CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819098507	DD	On-Demand	Bother	CACNA1D	68	34
CC(C)(C)OC(=O)CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819098508	DD	On-Demand	Bother	CACNA1C	46	34
CC(C)(C)OC(=O)CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819098508	DD	On-Demand	Bother	ADRB3	45	40
CC(C)(C)OC(=O)CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819098508	DD	On-Demand	Bother	CACNA1D	68	34
CC(=O)N(c1ccc(NC(=O)c2cc(=O)c3ccc(F)cc3o2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098556	GH	On-Demand	Anodyne	KCNH2	15	52
CC(=O)N(c1ccc(NC(=O)c2cc(=O)c3ccc(F)cc3o2)cc1)[C@@H]1C[C@H]1C	ZINC000819098557	GH	On-Demand	Anodyne	KCNH2	15	52
CC(=O)N(c1ccc(NC(=O)c2cc(=O)c3ccc(F)cc3o2)cc1)[C@H]1C[C@@H]1C	ZINC000819098558	GH	On-Demand	Anodyne	KCNH2	15	52
CC(=O)N(c1ccc(NC(=O)c2cc(=O)c3ccc(F)cc3o2)cc1)[C@H]1C[C@H]1C	ZINC000819098559	GH	On-Demand	Anodyne	KCNH2	15	52
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)cc1)[C@@H]1C[C@@H]1C	ZINC000819098600	GF	On-Demand	Anodyne	ELANE	41	41
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)cc1)[C@H]1C[C@H]1C	ZINC000819098601	GF	On-Demand	Anodyne	ELANE	41	41
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)cc1)[C@H]1C[C@@H]1C	ZINC000819098602	GF	On-Demand	Anodyne	ELANE	41	41
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)cc1)[C@@H]1C[C@H]1C	ZINC000819098603	GF	On-Demand	Anodyne	ELANE	41	41
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)cc1)[C@@H]1C[C@@H]1C	ZINC000819098612	IK	On-Demand	Anodyne	TACR3	20	46
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)cc1)[C@@H]1C[C@@H]1C	ZINC000819098612	IK	On-Demand	Anodyne	NR2E3	59	31
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)cc1)[C@@H]1C[C@@H]1C	ZINC000819098612	IK	On-Demand	Anodyne	MT-CO2	42	40
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)cc1)[C@H]1C[C@@H]1C	ZINC000819098613	IK	On-Demand	Anodyne	TACR3	20	46
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)cc1)[C@H]1C[C@@H]1C	ZINC000819098613	IK	On-Demand	Anodyne	NR2E3	59	31
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)cc1)[C@H]1C[C@@H]1C	ZINC000819098613	IK	On-Demand	Anodyne	MT-CO2	42	40
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)cc1)[C@H]1C[C@H]1C	ZINC000819098614	IK	On-Demand	Anodyne	TACR3	20	46
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)cc1)[C@H]1C[C@H]1C	ZINC000819098614	IK	On-Demand	Anodyne	NR2E3	59	31
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)cc1)[C@H]1C[C@H]1C	ZINC000819098614	IK	On-Demand	Anodyne	MT-CO2	42	40
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)cc1)[C@@H]1C[C@H]1C	ZINC000819098615	IK	On-Demand	Anodyne	TACR3	20	46
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)cc1)[C@@H]1C[C@H]1C	ZINC000819098615	IK	On-Demand	Anodyne	NR2E3	59	31
CC(=O)N(c1ccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)cc1)[C@@H]1C[C@H]1C	ZINC000819098615	IK	On-Demand	Anodyne	MT-CO2	42	40
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(C)(=O)=O)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098620	HG	On-Demand	Anodyne	CPT1A	57	36
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(C)(=O)=O)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098620	HG	On-Demand	Anodyne	CPT2	41	36
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(C)(=O)=O)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819098621	HG	On-Demand	Anodyne	CPT1A	57	36
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(C)(=O)=O)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819098621	HG	On-Demand	Anodyne	CPT2	41	36
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(C)(=O)=O)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819098622	HG	On-Demand	Anodyne	CPT1A	57	36
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(C)(=O)=O)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819098622	HG	On-Demand	Anodyne	CPT2	41	36
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(C)(=O)=O)c2)cc1)[C@H]1C[C@H]1C	ZINC000819098623	HG	On-Demand	Anodyne	CPT1A	57	36
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(C)(=O)=O)c2)cc1)[C@H]1C[C@H]1C	ZINC000819098623	HG	On-Demand	Anodyne	CPT2	41	36
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1	ZINC000819098656	GH	On-Demand	Anodyne	TIMP3	47	34
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1	ZINC000819098657	GH	On-Demand	Anodyne	TIMP3	47	34
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1	ZINC000819098658	GH	On-Demand	Anodyne	TIMP3	47	34
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1	ZINC000819098659	GH	On-Demand	Anodyne	TIMP3	47	34
CC(=O)N(c1ccc(NC(=O)c2cccc(Cl)c2O)cc1)[C@@H]1C[C@@H]1C	ZINC000819098685	FI	On-Demand	Anodyne	NR2E3	63	34
CC(=O)N(c1ccc(NC(=O)c2cccc(Cl)c2O)cc1)[C@@H]1C[C@@H]1C	ZINC000819098685	FI	On-Demand	Anodyne	SMO	20	41
CC(=O)N(c1ccc(NC(=O)c2cccc(Cl)c2O)cc1)[C@H]1C[C@H]1C	ZINC000819098686	FI	On-Demand	Anodyne	NR2E3	63	34
CC(=O)N(c1ccc(NC(=O)c2cccc(Cl)c2O)cc1)[C@H]1C[C@H]1C	ZINC000819098686	FI	On-Demand	Anodyne	SMO	20	41
CC(=O)N(c1ccc(NC(=O)c2cccc(Cl)c2O)cc1)[C@H]1C[C@@H]1C	ZINC000819098687	FI	On-Demand	Anodyne	NR2E3	63	34
CC(=O)N(c1ccc(NC(=O)c2cccc(Cl)c2O)cc1)[C@H]1C[C@@H]1C	ZINC000819098687	FI	On-Demand	Anodyne	SMO	20	41
CC(=O)N(c1ccc(NC(=O)c2cccc(Cl)c2O)cc1)[C@@H]1C[C@H]1C	ZINC000819098688	FI	On-Demand	Anodyne	NR2E3	63	34
CC(=O)N(c1ccc(NC(=O)c2cccc(Cl)c2O)cc1)[C@@H]1C[C@H]1C	ZINC000819098688	FI	On-Demand	Anodyne	SMO	20	41
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098691	HI	On-Demand	Anodyne	LTA4H	24	42
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098691	HI	On-Demand	Anodyne	HDAC2	17	42
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098691	HI	On-Demand	Anodyne	CAPN1	30	41
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098691	HI	On-Demand	Anodyne	CAPN2	34	41
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098691	HI	On-Demand	Anodyne	NPR	60	36
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098691	HI	On-Demand	Anodyne	KDM1A	17	42
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819098692	HI	On-Demand	Anodyne	LTA4H	24	42
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819098692	HI	On-Demand	Anodyne	HDAC2	17	42
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819098692	HI	On-Demand	Anodyne	CAPN1	30	41
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819098692	HI	On-Demand	Anodyne	CAPN2	34	41
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819098692	HI	On-Demand	Anodyne	NPR	60	36
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819098692	HI	On-Demand	Anodyne	KDM1A	17	42
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819098693	HI	On-Demand	Anodyne	LTA4H	24	42
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819098693	HI	On-Demand	Anodyne	HDAC2	17	42
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819098693	HI	On-Demand	Anodyne	CAPN1	30	41
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819098693	HI	On-Demand	Anodyne	CAPN2	34	41
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819098693	HI	On-Demand	Anodyne	NPR	60	36
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819098693	HI	On-Demand	Anodyne	KDM1A	17	42
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819098694	HI	On-Demand	Anodyne	LTA4H	24	42
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819098694	HI	On-Demand	Anodyne	HDAC2	17	42
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819098694	HI	On-Demand	Anodyne	CAPN1	30	41
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819098694	HI	On-Demand	Anodyne	CAPN2	34	41
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819098694	HI	On-Demand	Anodyne	NPR	60	36
CC(=O)N(c1ccc(NC(=O)CCCNC(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819098694	HI	On-Demand	Anodyne	KDM1A	17	42
CC(=O)N(c1ccc(NC(=O)Cn2c(SC(F)F)nc3ccccc32)cc1)[C@@H]1C[C@H]1C	ZINC000819098699	IJ	On-Demand	Anodyne	IMDH_CRYPV	34	41
CC(=O)N(c1ccc(NC(=O)Cn2c(SC(F)F)nc3ccccc32)cc1)[C@H]1C[C@@H]1C	ZINC000819098700	IJ	On-Demand	Anodyne	IMDH_CRYPV	34	41
CC(=O)N(c1ccc(NC(=O)Cn2c(SC(F)F)nc3ccccc32)cc1)[C@@H]1C[C@@H]1C	ZINC000819098701	IJ	On-Demand	Anodyne	IMDH_CRYPV	34	41
CC(=O)N(c1ccc(NC(=O)Cn2c(SC(F)F)nc3ccccc32)cc1)[C@H]1C[C@H]1C	ZINC000819098702	IJ	On-Demand	Anodyne	IMDH_CRYPV	34	41
CC(=O)N(c1ccc(NC(=O)CCCCN2CCCC2)cc1)[C@H]1C[C@@H]1C	ZINC000819098713	FH	On-Demand	Anodyne	CHRNA7	23	54
CC(=O)N(c1ccc(NC(=O)CCCCN2CCCC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098714	FH	On-Demand	Anodyne	CHRNA7	23	54
CC(=O)N(c1ccc(NC(=O)CCCCN2CCCC2)cc1)[C@@H]1C[C@H]1C	ZINC000819098715	FH	On-Demand	Anodyne	CHRNA7	23	54
CC(=O)N(c1ccc(NC(=O)CCCCN2CCCC2)cc1)[C@H]1C[C@H]1C	ZINC000819098716	FH	On-Demand	Anodyne	CHRNA7	23	54
CC(=O)N(c1ccc(NC(=O)/C=C/c2cccc(O)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098734	FH	On-Demand	Anodyne	MMP2	16	63
CC(=O)N(c1ccc(NC(=O)/C=C/c2cccc(O)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098734	FH	On-Demand	Anodyne	MMP9	15	63
CC(=O)N(c1ccc(NC(=O)/C=C\c2cccc(O)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098735	FH	On-Demand	Anodyne	MMP2	16	63
CC(=O)N(c1ccc(NC(=O)/C=C\c2cccc(O)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098735	FH	On-Demand	Anodyne	MMP9	15	63
CC(=O)N(c1ccc(NC(=O)/C=C/c2cccc(O)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819098736	FH	On-Demand	Anodyne	MMP2	16	63
CC(=O)N(c1ccc(NC(=O)/C=C/c2cccc(O)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819098736	FH	On-Demand	Anodyne	MMP9	15	63
CC(=O)N(c1ccc(NC(=O)/C=C\c2cccc(O)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819098737	FH	On-Demand	Anodyne	MMP2	16	63
CC(=O)N(c1ccc(NC(=O)/C=C\c2cccc(O)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819098737	FH	On-Demand	Anodyne	MMP9	15	63
CC(=O)CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1	ZINC000819098752	FI	On-Demand	Anodyne	HDAC10	24	43
CC(=O)CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1	ZINC000819098752	FI	On-Demand	Anodyne	HDAC2	17	43
CC(=O)CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1	ZINC000819098752	FI	On-Demand	Anodyne	HDAC3	21	41
CC(=O)CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1	ZINC000819098753	FI	On-Demand	Anodyne	HDAC10	24	43
CC(=O)CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1	ZINC000819098753	FI	On-Demand	Anodyne	HDAC2	17	43
CC(=O)CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1	ZINC000819098753	FI	On-Demand	Anodyne	HDAC3	21	41
CC(=O)CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1	ZINC000819098754	FI	On-Demand	Anodyne	HDAC10	24	43
CC(=O)CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1	ZINC000819098754	FI	On-Demand	Anodyne	HDAC2	17	43
CC(=O)CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1	ZINC000819098754	FI	On-Demand	Anodyne	HDAC3	21	41
CC(=O)CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1	ZINC000819098755	FI	On-Demand	Anodyne	HDAC10	24	43
CC(=O)CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1	ZINC000819098755	FI	On-Demand	Anodyne	HDAC2	17	43
CC(=O)CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1	ZINC000819098755	FI	On-Demand	Anodyne	HDAC3	21	41
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccc3c(c2)OCO3)cc1)[C@@H]1C[C@@H]1C	ZINC000819098768	GH	On-Demand	Anodyne	DYRK2	59	36
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccc3c(c2)OCO3)cc1)[C@@H]1C[C@@H]1C	ZINC000819098769	GH	On-Demand	Anodyne	DYRK2	59	36
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccc3c(c2)OCO3)cc1)[C@@H]1C[C@H]1C	ZINC000819098770	GH	On-Demand	Anodyne	DYRK2	59	36
O=C(/C=C\c1ccccc1)N1CCC(C(=O)N2CCCc3c(OC(F)F)cccc32)CC1	ZINC000819098772	IJ	On-Demand	Anodyne	ITGAL	73	39
O=C(/C=C/c1ccccc1)N1CCC(C(=O)N2CCCc3c(OC(F)F)cccc32)CC1	ZINC000819098773	IJ	On-Demand	Anodyne	ITGAL	73	39
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccc(O)cc2)cc1)[C@@H]1C[C@H]1C	ZINC000819098778	FH	On-Demand	Anodyne	MMP2	15	60
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccc(O)cc2)cc1)[C@@H]1C[C@H]1C	ZINC000819098778	FH	On-Demand	Anodyne	MMP9	15	60
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccc(O)cc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098779	FH	On-Demand	Anodyne	MMP2	15	60
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccc(O)cc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098779	FH	On-Demand	Anodyne	MMP9	15	60
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccc(O)cc2)cc1)[C@@H]1C[C@H]1C	ZINC000819098780	FH	On-Demand	Anodyne	MMP2	15	60
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccc(O)cc2)cc1)[C@@H]1C[C@H]1C	ZINC000819098780	FH	On-Demand	Anodyne	MMP9	15	60
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccc(O)cc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098781	FH	On-Demand	Anodyne	MMP2	15	60
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccc(O)cc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098781	FH	On-Demand	Anodyne	MMP9	15	60
CC(=O)N(c1ccc(NC(=O)CCN(C)C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098880	HI	On-Demand	Anodyne	F13A1	28	43
CC(=O)N(c1ccc(NC(=O)CCN(C)C(=O)OCc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819098881	HI	On-Demand	Anodyne	F13A1	28	43
CC(=O)N(c1ccc(NC(=O)CCN(C)C(=O)OCc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819098882	HI	On-Demand	Anodyne	F13A1	28	43
CC(=O)N(c1ccc(NC(=O)CCN(C)C(=O)OCc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819098883	HI	On-Demand	Anodyne	F13A1	28	43
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819098889	IG	On-Demand	Anodyne	CPT1A	53	35
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819098889	IG	On-Demand	Anodyne	CPT2	41	35
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819098889	IG	On-Demand	Anodyne	CPT1B	40	34
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819098890	IG	On-Demand	Anodyne	CPT1A	53	35
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819098890	IG	On-Demand	Anodyne	CPT2	41	35
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819098890	IG	On-Demand	Anodyne	CPT1B	40	34
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098891	IG	On-Demand	Anodyne	CPT1A	53	35
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098891	IG	On-Demand	Anodyne	CPT2	41	35
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098891	IG	On-Demand	Anodyne	CPT1B	40	34
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1)[C@H]1C[C@H]1C	ZINC000819098892	IG	On-Demand	Anodyne	CPT1A	53	35
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1)[C@H]1C[C@H]1C	ZINC000819098892	IG	On-Demand	Anodyne	CPT2	41	35
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)cc1)[C@H]1C[C@H]1C	ZINC000819098892	IG	On-Demand	Anodyne	CPT1B	40	34
CC(=O)N(c1ccc(NC(=O)c2cc(Br)ncc2Cl)cc1)[C@H]1C[C@H]1C	ZINC000819098901	HJ	On-Demand	Anodyne	NR2E3	60	34
CC(=O)N(c1ccc(NC(=O)c2cc(Br)ncc2Cl)cc1)[C@@H]1C[C@@H]1C	ZINC000819098902	HJ	On-Demand	Anodyne	NR2E3	60	34
CC(=O)N(c1ccc(NC(=O)c2cc(Br)ncc2Cl)cc1)[C@H]1C[C@@H]1C	ZINC000819098903	HJ	On-Demand	Anodyne	NR2E3	60	34
CC(=O)N(c1ccc(NC(=O)c2cc(Br)ncc2Cl)cc1)[C@@H]1C[C@H]1C	ZINC000819098904	HJ	On-Demand	Anodyne	NR2E3	60	34
O=C(c1cnc(Cl)c(Cl)c1)N1CCCc2c(OC(F)F)cccc21	ZINC000819098905	FJ	On-Demand	Anodyne	GPBAR1	33	40
C=CCNS(=O)(=O)c1cc(C(=O)N2CCCc3c(OC(F)F)cccc32)ccc1F	ZINC000819098914	IG	On-Demand	Mild	AVPR2	42	36
CC(=O)N(c1ccc(NC(=O)Cn2c(S)nc3ccccc3c2=O)cc1)[C@@H]1C[C@H]1C	ZINC000819098927	HG	On-Demand	Anodyne	IMDH_CRYPV	43	38
CC(=O)N(c1ccc(NC(=O)Cn2c(S)nc3ccccc3c2=O)cc1)[C@H]1C[C@@H]1C	ZINC000819098928	HG	On-Demand	Anodyne	IMDH_CRYPV	43	38
CC(=O)N(c1ccc(NC(=O)Cn2c(S)nc3ccccc3c2=O)cc1)[C@@H]1C[C@@H]1C	ZINC000819098929	HG	On-Demand	Anodyne	IMDH_CRYPV	43	38
CC(=O)N(c1ccc(NC(=O)Cn2c(S)nc3ccccc3c2=O)cc1)[C@H]1C[C@H]1C	ZINC000819098930	HG	On-Demand	Anodyne	IMDH_CRYPV	43	38
CC(=O)N(c1ccc(NC(=O)CCCCNC(=O)OC(C)(C)C)cc1)[C@H]1C[C@H]1C	ZINC000819098935	HI	On-Demand	Anodyne	HDAC10	17	42
CC(=O)N(c1ccc(NC(=O)CCCCNC(=O)OC(C)(C)C)cc1)[C@@H]1C[C@H]1C	ZINC000819098936	HI	On-Demand	Anodyne	HDAC10	17	42
CC(=O)N(c1ccc(NC(=O)CCCCNC(=O)OC(C)(C)C)cc1)[C@@H]1C[C@@H]1C	ZINC000819098937	HI	On-Demand	Anodyne	HDAC10	17	42
CC(=O)N(c1ccc(NC(=O)CCCCNC(=O)OC(C)(C)C)cc1)[C@H]1C[C@@H]1C	ZINC000819098938	HI	On-Demand	Anodyne	HDAC10	17	42
Cc1ccc(C(=O)N2CCCc3c(OC(F)F)cccc32)c(Cl)n1	ZINC000819098939	FI	On-Demand	Anodyne	AVPR2	45	37
CC(=O)N(c1ccc(NC(=O)CC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)[C@H]1C[C@H]1C	ZINC000819098944	II	On-Demand	Anodyne	GPR119	31	43
CC(=O)N(c1ccc(NC(=O)CC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)[C@H]1C[C@@H]1C	ZINC000819098945	II	On-Demand	Anodyne	GPR119	31	43
CC(=O)N(c1ccc(NC(=O)CC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)[C@@H]1C[C@H]1C	ZINC000819098946	II	On-Demand	Anodyne	GPR119	31	43
CC(=O)N(c1ccc(NC(=O)CC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098947	II	On-Demand	Anodyne	GPR119	31	43
O=C(c1ccc(CS(=O)(=O)C(F)F)cc1)N1CCCc2c(OC(F)F)cccc21	ZINC000819098973	II	On-Demand	Anodyne	AVPR2	54	38
CC(=O)N(c1ccc(NC(=O)c2cccc(NS(C)(=O)=O)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819098991	HG	On-Demand	Anodyne	KCNK3	88	38
CC(=O)N(c1ccc(NC(=O)c2cccc(NS(C)(=O)=O)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819098991	HG	On-Demand	Anodyne	KCNK9	45	36
CC(=O)N(c1ccc(NC(=O)c2cccc(NS(C)(=O)=O)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819098992	HG	On-Demand	Anodyne	KCNK3	88	38
CC(=O)N(c1ccc(NC(=O)c2cccc(NS(C)(=O)=O)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819098992	HG	On-Demand	Anodyne	KCNK9	45	36
CC(=O)N(c1ccc(NC(=O)c2cccc(NS(C)(=O)=O)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098993	HG	On-Demand	Anodyne	KCNK3	88	38
CC(=O)N(c1ccc(NC(=O)c2cccc(NS(C)(=O)=O)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098993	HG	On-Demand	Anodyne	KCNK9	45	36
CC(=O)N(c1ccc(NC(=O)c2cccc(NS(C)(=O)=O)c2)cc1)[C@H]1C[C@H]1C	ZINC000819098994	HG	On-Demand	Anodyne	KCNK3	88	38
CC(=O)N(c1ccc(NC(=O)c2cccc(NS(C)(=O)=O)c2)cc1)[C@H]1C[C@H]1C	ZINC000819098994	HG	On-Demand	Anodyne	KCNK9	45	36
CC(=O)N(c1ccc(NC(=O)[C@H](OC2CCCC2)c2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819098995	HK	On-Demand	Anodyne	TIMP3	47	34
CC(=O)N(c1ccc(NC(=O)[C@H](OC2CCCC2)c2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819098995	HK	On-Demand	Anodyne	AMY2	42	29
CC(=O)N(c1ccc(NC(=O)[C@H](OC2CCCC2)c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098996	HK	On-Demand	Anodyne	TIMP3	47	34
CC(=O)N(c1ccc(NC(=O)[C@H](OC2CCCC2)c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819098996	HK	On-Demand	Anodyne	AMY2	42	29
CC(=O)N(c1ccc(NC(=O)[C@H](OC2CCCC2)c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819098997	HK	On-Demand	Anodyne	TIMP3	47	34
CC(=O)N(c1ccc(NC(=O)[C@H](OC2CCCC2)c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819098997	HK	On-Demand	Anodyne	AMY2	42	29
CC(=O)N(c1ccc(NC(=O)[C@H](OC2CCCC2)c2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819098998	HK	On-Demand	Anodyne	TIMP3	47	34
CC(=O)N(c1ccc(NC(=O)[C@H](OC2CCCC2)c2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819098998	HK	On-Demand	Anodyne	AMY2	42	29
CC(=O)N(c1ccc(NC(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)[C@H]1C[C@H]1C	ZINC000819099008	HH	On-Demand	Anodyne	GPR119	29	40
CC(=O)N(c1ccc(NC(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)[C@H]1C[C@@H]1C	ZINC000819099009	HH	On-Demand	Anodyne	GPR119	29	40
CC(=O)N(c1ccc(NC(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)[C@@H]1C[C@H]1C	ZINC000819099010	HH	On-Demand	Anodyne	GPR119	29	40
CC(=O)N(c1ccc(NC(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099011	HH	On-Demand	Anodyne	GPR119	29	40
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1	ZINC000819099091	DI	On-Demand	Anodyne	HDAC10	24	42
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1	ZINC000819099091	DI	On-Demand	Anodyne	HDAC2	17	42
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1	ZINC000819099091	DI	On-Demand	Anodyne	HDAC3	20	41
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1	ZINC000819099091	DI	On-Demand	Anodyne	ENPP2	34	48
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@@H]2C)cc1	ZINC000819099091	DI	On-Demand	Anodyne	LASR	41	33
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1	ZINC000819099092	DI	On-Demand	Anodyne	HDAC10	24	42
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1	ZINC000819099092	DI	On-Demand	Anodyne	HDAC2	17	42
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1	ZINC000819099092	DI	On-Demand	Anodyne	HDAC3	20	41
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1	ZINC000819099092	DI	On-Demand	Anodyne	ENPP2	34	48
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@H]2C)cc1	ZINC000819099092	DI	On-Demand	Anodyne	LASR	41	33
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1	ZINC000819099093	DI	On-Demand	Anodyne	HDAC10	24	42
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1	ZINC000819099093	DI	On-Demand	Anodyne	HDAC2	17	42
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1	ZINC000819099093	DI	On-Demand	Anodyne	HDAC3	20	41
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1	ZINC000819099093	DI	On-Demand	Anodyne	ENPP2	34	48
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@H]2C[C@@H]2C)cc1	ZINC000819099093	DI	On-Demand	Anodyne	LASR	41	33
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1	ZINC000819099094	DI	On-Demand	Anodyne	HDAC10	24	42
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1	ZINC000819099094	DI	On-Demand	Anodyne	HDAC2	17	42
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1	ZINC000819099094	DI	On-Demand	Anodyne	HDAC3	20	41
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1	ZINC000819099094	DI	On-Demand	Anodyne	ENPP2	34	48
CCCCCCC(=O)Nc1ccc(N(C(C)=O)[C@@H]2C[C@H]2C)cc1	ZINC000819099094	DI	On-Demand	Anodyne	LASR	41	33
CC(=O)N(c1ccc(NC(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099099	II	On-Demand	Anodyne	PRNP	45	44
CC(=O)N(c1ccc(NC(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)cc1)[C@H]1C[C@@H]1C	ZINC000819099100	II	On-Demand	Anodyne	PRNP	45	44
CC(=O)N(c1ccc(NC(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)cc1)[C@H]1C[C@H]1C	ZINC000819099101	II	On-Demand	Anodyne	PRNP	45	44
CC(=O)N(c1ccc(NC(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)cc1)[C@@H]1C[C@H]1C	ZINC000819099102	II	On-Demand	Anodyne	PRNP	45	44
CC(C)(C)OC(=O)NCc1cccc(C(=O)N2CCCc3c(OC(F)F)cccc32)c1	ZINC000819099116	IJ	On-Demand	Anodyne	AVPR2	40	43
CC(=O)N(c1ccc(NC(=O)c2ccc(C(F)(F)F)nc2Cl)cc1)[C@H]1C[C@H]1C	ZINC000819099141	HJ	On-Demand	Anodyne	SHH	23	45
CC(=O)N(c1ccc(NC(=O)c2ccc(C(F)(F)F)nc2Cl)cc1)[C@H]1C[C@@H]1C	ZINC000819099142	HJ	On-Demand	Anodyne	SHH	23	45
CC(=O)N(c1ccc(NC(=O)c2ccc(C(F)(F)F)nc2Cl)cc1)[C@@H]1C[C@H]1C	ZINC000819099143	HJ	On-Demand	Anodyne	SHH	23	45
CC(=O)N(c1ccc(NC(=O)c2ccc(C(F)(F)F)nc2Cl)cc1)[C@@H]1C[C@@H]1C	ZINC000819099144	HJ	On-Demand	Anodyne	SHH	23	45
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)NC(C)C)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819099211	IH	On-Demand	Anodyne	CPT1A	45	34
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)NC(C)C)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099212	IH	On-Demand	Anodyne	CPT1A	45	34
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)NC(C)C)c2)cc1)[C@H]1C[C@H]1C	ZINC000819099213	IH	On-Demand	Anodyne	CPT1A	45	34
CC(=O)N(c1ccc(NC(=O)c2ccc(F)c(S(=O)(=O)NC(C)C)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819099214	IH	On-Demand	Anodyne	CPT1A	45	34
O=C(c1ccc(C2SCCCS2)cc1)N1CCCc2c(OC(F)F)cccc21	ZINC000819099270	HK	On-Demand	Anodyne	AVPR2	46	37
CC(=O)N(c1ccc(NC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099279	IH	On-Demand	Anodyne	F13A1	19	40
CC(=O)N(c1ccc(NC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099279	IH	On-Demand	Anodyne	GPR119	38	40
CC(=O)N(c1ccc(NC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@H]1C	ZINC000819099280	IH	On-Demand	Anodyne	F13A1	19	40
CC(=O)N(c1ccc(NC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@H]1C	ZINC000819099280	IH	On-Demand	Anodyne	GPR119	38	40
CC(=O)N(c1ccc(NC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@H]1C	ZINC000819099281	IH	On-Demand	Anodyne	F13A1	19	40
CC(=O)N(c1ccc(NC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@H]1C	ZINC000819099281	IH	On-Demand	Anodyne	GPR119	38	40
CC(=O)N(c1ccc(NC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@@H]1C	ZINC000819099282	IH	On-Demand	Anodyne	F13A1	19	40
CC(=O)N(c1ccc(NC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@@H]1C	ZINC000819099282	IH	On-Demand	Anodyne	GPR119	38	40
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCCc3c(OC(F)F)cccc32)C1	ZINC000819099287	GH	On-Demand	Anodyne	GPR119	34	43
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCCc3c(OC(F)F)cccc32)C1	ZINC000819099287	GH	On-Demand	Anodyne	SFRP1	20	43
CC(=O)N(c1ccc(NC(=O)C(O)(c2ccccc2)c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819099304	HI	On-Demand	Anodyne	NPY2R	47	38
CC(=O)N(c1ccc(NC(=O)C(O)(c2ccccc2)c2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819099305	HI	On-Demand	Anodyne	NPY2R	47	38
CC(=O)N(c1ccc(NC(=O)C(O)(c2ccccc2)c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099306	HI	On-Demand	Anodyne	NPY2R	47	38
CC(=O)N(c1ccc(NC(=O)C(O)(c2ccccc2)c2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819099307	HI	On-Demand	Anodyne	NPY2R	47	38
O=C(c1ccc(S(=O)(=O)C(F)F)cc1)N1CCCc2c(OC(F)F)cccc21	ZINC000819099400	HH	On-Demand	Anodyne	AVPR2	44	37
CC(=O)N(c1ccc(NC(=O)CCN2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@H]1C	ZINC000819099417	IG	On-Demand	Anodyne	F13A1	16	41
CC(=O)N(c1ccc(NC(=O)CCN2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099419	IG	On-Demand	Anodyne	F13A1	16	41
CC(=O)N(c1ccc(NC(=O)CCN2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@H]1C	ZINC000819099420	IG	On-Demand	Anodyne	F13A1	16	41
CC(=O)N(c1ccc(NC(=O)CCN2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@@H]1C	ZINC000819099421	IG	On-Demand	Anodyne	F13A1	16	41
O[C@H](CN[C@@H]1CCCN(c2ccccc2Cl)C1)c1cccnc1	ZINC000819099428	EG	On-Demand	Anodyne	ADRB3	61	45
O[C@H](CN[C@@H]1CCCN(c2ccccc2Cl)C1)c1cccnc1	ZINC000819099428	EG	On-Demand	Anodyne	PIM1	17	40
CC(=O)N(c1ccc(NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099429	II	On-Demand	Anodyne	EPHX2	15	43
CC(=O)N(c1ccc(NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099429	II	On-Demand	Anodyne	F13A1	20	41
CC(=O)N(c1ccc(NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099429	II	On-Demand	Anodyne	GPR119	46	45
CC(=O)N(c1ccc(NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@H]1C	ZINC000819099430	II	On-Demand	Anodyne	EPHX2	15	43
CC(=O)N(c1ccc(NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@H]1C	ZINC000819099430	II	On-Demand	Anodyne	F13A1	20	41
CC(=O)N(c1ccc(NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@H]1C	ZINC000819099430	II	On-Demand	Anodyne	GPR119	46	45
CC(=O)N(c1ccc(NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@H]1C	ZINC000819099431	II	On-Demand	Anodyne	EPHX2	15	43
CC(=O)N(c1ccc(NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@H]1C	ZINC000819099431	II	On-Demand	Anodyne	F13A1	20	41
CC(=O)N(c1ccc(NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@H]1C	ZINC000819099431	II	On-Demand	Anodyne	GPR119	46	45
O[C@H](CN[C@H]1CCCN(c2ccccc2Cl)C1)c1cccnc1	ZINC000819099432	EG	On-Demand	Anodyne	ADRB3	61	45
O[C@H](CN[C@H]1CCCN(c2ccccc2Cl)C1)c1cccnc1	ZINC000819099432	EG	On-Demand	Anodyne	PIM1	17	40
O[C@@H](CN[C@@H]1CCCN(c2ccccc2Cl)C1)c1cccnc1	ZINC000819099433	EG	On-Demand	Anodyne	ADRB3	61	45
O[C@@H](CN[C@@H]1CCCN(c2ccccc2Cl)C1)c1cccnc1	ZINC000819099433	EG	On-Demand	Anodyne	PIM1	17	40
O[C@@H](CN[C@H]1CCCN(c2ccccc2Cl)C1)c1cccnc1	ZINC000819099434	EG	On-Demand	Anodyne	ADRB3	61	45
O[C@@H](CN[C@H]1CCCN(c2ccccc2Cl)C1)c1cccnc1	ZINC000819099434	EG	On-Demand	Anodyne	PIM1	17	40
CC(=O)N(c1ccc(NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@@H]1C	ZINC000819099435	II	On-Demand	Anodyne	EPHX2	15	43
CC(=O)N(c1ccc(NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@@H]1C	ZINC000819099435	II	On-Demand	Anodyne	F13A1	20	41
CC(=O)N(c1ccc(NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@@H]1C	ZINC000819099435	II	On-Demand	Anodyne	GPR119	46	45
CCCCSCC(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819099443	EI	On-Demand	Anodyne	EST1_PIG	40	34
Cc1cc(F)ccc1[C@@H](O)CNCCc1c[nH]c2c(C)cccc12	ZINC000819099492	EH	On-Demand	Anodyne	ADRB2	48	55
Cc1cc(F)ccc1[C@@H](O)CNCCc1c[nH]c2c(C)cccc12	ZINC000819099492	EH	On-Demand	Anodyne	ADRB1	34	55
Cc1cc(F)ccc1[C@@H](O)CNCCc1c[nH]c2c(C)cccc12	ZINC000819099492	EH	On-Demand	Anodyne	ADRB3	28	48
Cc1cc(F)ccc1[C@@H](O)CNCCc1c[nH]c2c(C)cccc12	ZINC000819099492	EH	On-Demand	Anodyne	MPO	81	41
Cc1ccc(C(=O)N2CCCc3c(OC(F)F)cccc32)cc1NC(=O)OC(C)(C)C	ZINC000819099539	IK	On-Demand	Anodyne	AVPR2	72	42
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)[C@@H]1C[C@H]1C	ZINC000819099546	GF	On-Demand	Anodyne	PRNP	46	38
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)[C@@H]1C[C@H]1C	ZINC000819099546	GF	On-Demand	Anodyne	MTOR	74	40
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)[C@@H]1C[C@H]1C	ZINC000819099546	GF	On-Demand	Anodyne	DGAT1	40	44
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)[C@@H]1C[C@H]1C	ZINC000819099546	GF	On-Demand	Anodyne	HPGDS	15	44
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099548	GF	On-Demand	Anodyne	PRNP	46	38
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099548	GF	On-Demand	Anodyne	MTOR	74	40
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099548	GF	On-Demand	Anodyne	DGAT1	40	44
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099548	GF	On-Demand	Anodyne	HPGDS	15	44
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)[C@H]1C[C@H]1C	ZINC000819099550	GF	On-Demand	Anodyne	PRNP	46	38
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)[C@H]1C[C@H]1C	ZINC000819099550	GF	On-Demand	Anodyne	MTOR	74	40
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)[C@H]1C[C@H]1C	ZINC000819099550	GF	On-Demand	Anodyne	DGAT1	40	44
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)[C@H]1C[C@H]1C	ZINC000819099550	GF	On-Demand	Anodyne	HPGDS	15	44
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C1CCCCC1	ZINC000819099551	FH	On-Demand	Anodyne	GPR119	36	46
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)[C@H]1C[C@@H]1C	ZINC000819099552	GF	On-Demand	Anodyne	PRNP	46	38
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)[C@H]1C[C@@H]1C	ZINC000819099552	GF	On-Demand	Anodyne	MTOR	74	40
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)[C@H]1C[C@@H]1C	ZINC000819099552	GF	On-Demand	Anodyne	DGAT1	40	44
CC(=O)N(c1ccc(NC(=O)c2ccc(N3CCOCC3)nc2)cc1)[C@H]1C[C@@H]1C	ZINC000819099552	GF	On-Demand	Anodyne	HPGDS	15	44
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C1CCCCC1	ZINC000819099556	FH	On-Demand	Anodyne	GPR119	36	46
CON(C)C(=O)CCN[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000819099566	EE	On-Demand	Anodyne	SLC6A1	51	34
CON(C)C(=O)CCN[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000819099566	EE	On-Demand	Anodyne	KCNQ2	40	35
CON(C)C(=O)CCN[C@H]1CCCN(c2ccccc2Cl)C1	ZINC000819099567	EE	On-Demand	Anodyne	SLC6A1	51	34
CON(C)C(=O)CCN[C@H]1CCCN(c2ccccc2Cl)C1	ZINC000819099567	EE	On-Demand	Anodyne	KCNQ2	40	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ncc(-c2ccccc2)o1	ZINC000819099570	FF	On-Demand	Anodyne	PDE8B	46	30
COc1cc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)ccc1Cl	ZINC000819099571	FD	On-Demand	Anodyne	PKM	20	40
C#CCNC(=O)CCNCc1cccnc1Oc1cccc(S(C)(=O)=O)c1	ZINC000819099594	GD	On-Demand	Mild	NR1H3	43	36
COC(=O)C1(c2ccc(S(=O)(=O)N3CCC(OC)(C(=O)O)CC3)cc2)CC1	ZINC000819099630	GD	On-Demand	Anodyne	TGM2	53	35
COC(=O)C1(c2ccc(S(=O)(=O)N3CCC(OC)(C(=O)O)CC3)cc2)CC1	ZINC000819099630	GD	On-Demand	Anodyne	F13A1	61	38
CC(=O)N(c1ccc(NC(=O)c2cc(C)ccc2N2CCCC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099640	GJ	On-Demand	Anodyne	TAAR1	24	40
CC(=O)N(c1ccc(NC(=O)c2cc(C)ccc2N2CCCC2)cc1)[C@H]1C[C@H]1C	ZINC000819099644	GJ	On-Demand	Anodyne	TAAR1	24	40
CC(=O)N(c1ccc(NC(=O)c2cc(C)ccc2N2CCCC2)cc1)[C@H]1C[C@@H]1C	ZINC000819099646	GJ	On-Demand	Anodyne	TAAR1	24	40
CC(=O)N(c1ccc(NC(=O)c2cc(C)ccc2N2CCCC2)cc1)[C@@H]1C[C@H]1C	ZINC000819099647	GJ	On-Demand	Anodyne	TAAR1	24	40
CC(=O)N(c1ccc(NC(=O)c2cccnc2S)cc1)[C@@H]1C[C@H]1C	ZINC000819099687	EG	On-Demand	Anodyne	G2YM83_BOTF4	47	36
CC(=O)N(c1ccc(NC(=O)c2cccnc2S)cc1)[C@H]1C[C@H]1C	ZINC000819099688	EG	On-Demand	Anodyne	G2YM83_BOTF4	47	36
CC(=O)N(c1ccc(NC(=O)c2cccnc2S)cc1)[C@@H]1C[C@@H]1C	ZINC000819099690	EG	On-Demand	Anodyne	G2YM83_BOTF4	47	36
CC(=O)N(c1ccc(NC(=O)c2cccnc2S)cc1)[C@H]1C[C@@H]1C	ZINC000819099692	EG	On-Demand	Anodyne	G2YM83_BOTF4	47	36
CC[C@@H]1CCCC[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819099705	FH	On-Demand	Mild	PAPA1_CARPA	38	48
CC[C@@H]1CCCC[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819099707	FH	On-Demand	Mild	PAPA1_CARPA	38	48
CC[C@@H]1CCCC[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819099709	FH	On-Demand	Mild	PAPA1_CARPA	38	48
CC[C@@H]1CCCC[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819099711	FH	On-Demand	Mild	PAPA1_CARPA	38	48
CC(=O)N(c1ccc(NC(=O)[C@H](F)Cc2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819099718	FH	On-Demand	Anodyne	TIMP3	67	39
CC(=O)N(c1ccc(NC(=O)[C@H](F)Cc2ccccc2)cc1)[C@H]1C[C@@H]1C	ZINC000819099719	FH	On-Demand	Anodyne	TIMP3	67	39
CC(=O)N(c1ccc(NC(=O)[C@H](F)Cc2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099721	FH	On-Demand	Anodyne	TIMP3	67	39
CC(=O)N(c1ccc(NC(=O)[C@H](F)Cc2ccccc2)cc1)[C@H]1C[C@H]1C	ZINC000819099723	FH	On-Demand	Anodyne	TIMP3	67	39
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3c(C)cccc23)c1	ZINC000819099732	FG	On-Demand	Anodyne	ADRB2	46	53
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3c(C)cccc23)c1	ZINC000819099732	FG	On-Demand	Anodyne	ADRB1	44	53
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3c(C)cccc23)c1	ZINC000819099732	FG	On-Demand	Anodyne	ADRB3	40	52
O=[N+]([O-])c1cccc([C@@H](O)CNCCCOC2CCOCC2)c1	ZINC000819099750	DD	On-Demand	Bother	ADRB3	37	43
O=[N+]([O-])c1cccc([C@H](O)CNCCCOC2CCOCC2)c1	ZINC000819099751	DD	On-Demand	Bother	ADRB3	37	43
O=C(Cc1nsc2ccccc12)NCc1ccc(N2CCCC2)cc1	ZINC000819099761	FH	On-Demand	Clean	HTR1A	23	44
O=C(Cc1nsc2ccccc12)NCc1ccc(N2CCCC2)cc1	ZINC000819099761	FH	On-Demand	Clean	DRD2	26	42
O=C(Cc1nsc2ccccc12)NCc1ccc(N2CCCC2)cc1	ZINC000819099761	FH	On-Demand	Clean	LIPA	42	29
O=C(CCc1cccc(OC(F)F)c1)NCc1ccc(N2CCCC2)cc1	ZINC000819099762	FI	On-Demand	Clean	PLA2G4A	29	45
O=C(/C=C/[C@@H]1CCCO1)NCCc1cccc2ccccc12	ZINC000819099774	CG	On-Demand	Anodyne	NQO2	32	41
O=C(/C=C\[C@@H]1CCCO1)NCCc1cccc2ccccc12	ZINC000819099775	CG	On-Demand	Anodyne	NQO2	32	41
O=C(/C=C\[C@H]1CCCO1)NCCc1cccc2ccccc12	ZINC000819099776	CG	On-Demand	Anodyne	NQO2	32	41
O=C(/C=C/[C@H]1CCCO1)NCCc1cccc2ccccc12	ZINC000819099777	CG	On-Demand	Anodyne	NQO2	32	41
CN(C)C1(CNC[C@H](O)c2cccc(F)c2)Cc2ccccc2C1	ZINC000819099799	EF	On-Demand	Anodyne	ADRB1	22	43
CN(C)C1(CNC[C@H](O)c2cccc(F)c2)Cc2ccccc2C1	ZINC000819099799	EF	On-Demand	Anodyne	SLC6A2	15	42
CN(C)C1(CNC[C@H](O)c2cccc(F)c2)Cc2ccccc2C1	ZINC000819099799	EF	On-Demand	Anodyne	ADRB3	43	32
CN(C)C1(CNC[C@@H](O)c2cccc(F)c2)Cc2ccccc2C1	ZINC000819099800	EF	On-Demand	Anodyne	ADRB1	22	43
CN(C)C1(CNC[C@@H](O)c2cccc(F)c2)Cc2ccccc2C1	ZINC000819099800	EF	On-Demand	Anodyne	SLC6A2	15	42
CN(C)C1(CNC[C@@H](O)c2cccc(F)c2)Cc2ccccc2C1	ZINC000819099800	EF	On-Demand	Anodyne	ADRB3	43	32
O=C1[C@H](NC[C@H](O)c2cc(F)ccc2F)CCCN1c1ccccc1Cl	ZINC000819099819	GG	On-Demand	Anodyne	P2RX7	28	42
O=C1[C@@H](NC[C@@H](O)c2cc(F)ccc2F)CCCN1c1ccccc1Cl	ZINC000819099820	GG	On-Demand	Anodyne	P2RX7	28	42
O=C1[C@H](NC[C@@H](O)c2cc(F)ccc2F)CCCN1c1ccccc1Cl	ZINC000819099821	GG	On-Demand	Anodyne	P2RX7	28	42
O=C1[C@@H](NC[C@H](O)c2cc(F)ccc2F)CCCN1c1ccccc1Cl	ZINC000819099822	GG	On-Demand	Anodyne	P2RX7	28	42
CN(C)C1(CNC[C@@H](O)c2cccnc2)Cc2ccccc2C1	ZINC000819099833	DD	On-Demand	Anodyne	ADRB2	21	43
CN(C)C1(CNC[C@@H](O)c2cccnc2)Cc2ccccc2C1	ZINC000819099833	DD	On-Demand	Anodyne	ADRB1	26	43
CN(C)C1(CNC[C@@H](O)c2cccnc2)Cc2ccccc2C1	ZINC000819099833	DD	On-Demand	Anodyne	ADRB3	94	46
CN(C)C1(CNC[C@H](O)c2cccnc2)Cc2ccccc2C1	ZINC000819099834	DD	On-Demand	Anodyne	ADRB2	21	43
CN(C)C1(CNC[C@H](O)c2cccnc2)Cc2ccccc2C1	ZINC000819099834	DD	On-Demand	Anodyne	ADRB1	26	43
CN(C)C1(CNC[C@H](O)c2cccnc2)Cc2ccccc2C1	ZINC000819099834	DD	On-Demand	Anodyne	ADRB3	94	46
COC(=O)c1cc(Cl)ccc1S(=O)(=O)N1CCC(OC)(C(=O)O)CC1	ZINC000819099847	GD	On-Demand	Anodyne	CPT2	41	35
COC(=O)c1cc(Cl)ccc1S(=O)(=O)N1CCC(OC)(C(=O)O)CC1	ZINC000819099847	GD	On-Demand	Anodyne	SLC6A9	48	38
O=C(NCc1cccnc1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819099853	ED	On-Demand	Anodyne	CHRNA7	45	36
O=C(NCc1cccnc1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819099853	ED	On-Demand	Anodyne	NAMPT	82	45
O=C(NCc1cccnc1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819099854	ED	On-Demand	Anodyne	CHRNA7	45	36
O=C(NCc1cccnc1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819099854	ED	On-Demand	Anodyne	NAMPT	82	45
O=C(NCc1cccnc1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819099855	ED	On-Demand	Anodyne	CHRNA7	45	36
O=C(NCc1cccnc1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819099855	ED	On-Demand	Anodyne	NAMPT	82	45
O=C(NCc1cccnc1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819099856	ED	On-Demand	Anodyne	CHRNA7	45	36
O=C(NCc1cccnc1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819099856	ED	On-Demand	Anodyne	NAMPT	82	45
COc1ccc(Cl)cc1S(=O)(=O)N1CCC(OC)(C(=O)O)CC1	ZINC000819099892	FD	On-Demand	Anodyne	CPT1A	99	46
COc1ccc(Cl)cc1S(=O)(=O)N1CCC(OC)(C(=O)O)CC1	ZINC000819099892	FD	On-Demand	Anodyne	CPT2	59	45
COc1ccc(Cl)cc1S(=O)(=O)N1CCC(OC)(C(=O)O)CC1	ZINC000819099892	FD	On-Demand	Anodyne	CPT1B	92	45
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N(C)C)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819099918	IH	On-Demand	Anodyne	CPT1A	46	35
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N(C)C)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819099920	IH	On-Demand	Anodyne	CPT1A	46	35
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N(C)C)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099922	IH	On-Demand	Anodyne	CPT1A	46	35
CC(=O)N(c1ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N(C)C)c2)cc1)[C@H]1C[C@H]1C	ZINC000819099924	IH	On-Demand	Anodyne	CPT1A	46	35
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000819099925	GG	On-Demand	Anodyne	KCNQ2	58	34
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CCCN(c2ccccc2Cl)C1	ZINC000819099927	GG	On-Demand	Anodyne	KCNQ2	58	34
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000819099929	GG	On-Demand	Anodyne	KCNQ2	58	34
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@H]1CCCN(c2ccccc2Cl)C1	ZINC000819099931	GG	On-Demand	Anodyne	KCNQ2	58	34
COC(=O)c1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c(F)c1	ZINC000819099953	GC	On-Demand	Anodyne	F13A1	22	42
CC(=O)N(c1ccc(NC(=O)/C(C#N)=C\c2ccc(O)cc2)cc1)[C@@H]1C[C@H]1C	ZINC000819099964	GH	On-Demand	Reactive	CA12	16	53
CC(=O)N(c1ccc(NC(=O)/C(C#N)=C/c2ccc(O)cc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099968	GH	On-Demand	Reactive	CA12	16	53
CC(=O)N(c1ccc(NC(=O)/C(C#N)=C\c2ccc(O)cc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099970	GH	On-Demand	Reactive	CA12	16	53
CC(=O)N(c1ccc(NC(=O)/C(C#N)=C/c2ccc(O)cc2)cc1)[C@@H]1C[C@H]1C	ZINC000819099972	GH	On-Demand	Reactive	CA12	16	53
CC(=O)N(c1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099973	IG	On-Demand	Anodyne	LPL	54	43
CC(=O)N(c1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cc1)[C@@H]1C[C@@H]1C	ZINC000819099973	IG	On-Demand	Anodyne	LIPG	22	43
CC(=O)N(c1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cc1)[C@H]1C[C@H]1C	ZINC000819099974	IG	On-Demand	Anodyne	LPL	54	43
CC(=O)N(c1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cc1)[C@H]1C[C@H]1C	ZINC000819099974	IG	On-Demand	Anodyne	LIPG	22	43
CC(=O)N(c1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cc1)[C@H]1C[C@@H]1C	ZINC000819099975	IG	On-Demand	Anodyne	LPL	54	43
CC(=O)N(c1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cc1)[C@H]1C[C@@H]1C	ZINC000819099975	IG	On-Demand	Anodyne	LIPG	22	43
CC(=O)N(c1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cc1)[C@@H]1C[C@H]1C	ZINC000819099976	IG	On-Demand	Anodyne	LPL	54	43
CC(=O)N(c1ccc(NC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cc1)[C@@H]1C[C@H]1C	ZINC000819099976	IG	On-Demand	Anodyne	LIPG	22	43
CC(=O)N(c1ccc(NC(=O)C[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@H]1C	ZINC000819100036	IJ	On-Demand	Anodyne	GPR119	40	43
CC(=O)N(c1ccc(NC(=O)C[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1)[C@H]1C[C@@H]1C	ZINC000819100037	IJ	On-Demand	Anodyne	GPR119	40	43
COc1cc(S(=O)(=O)N[C@H](CN2CCOCC2)C(=O)O)ccc1Cl	ZINC000819100056	GC	On-Demand	Anodyne	MMP13	34	53
COc1cc(S(=O)(=O)N[C@H](CN2CCOCC2)C(=O)O)ccc1Cl	ZINC000819100056	GC	On-Demand	Anodyne	TRY2_BOVIN	48	36
COc1cc(S(=O)(=O)N[C@H](CN2CCOCC2)C(=O)O)ccc1Cl	ZINC000819100056	GC	On-Demand	Anodyne	MMP2	28	51
COc1cc(S(=O)(=O)N[C@H](CN2CCOCC2)C(=O)O)ccc1Cl	ZINC000819100056	GC	On-Demand	Anodyne	MMP3	15	40
COc1cc(S(=O)(=O)N[C@H](CN2CCOCC2)C(=O)O)ccc1Cl	ZINC000819100056	GC	On-Demand	Anodyne	MMP9	15	40
COc1cc(S(=O)(=O)N[C@H](CN2CCOCC2)C(=O)O)ccc1Cl	ZINC000819100056	GC	On-Demand	Anodyne	ITGAV	47	39
COc1cc(S(=O)(=O)N[C@@H](CN2CCOCC2)C(=O)O)ccc1Cl	ZINC000819100057	GC	On-Demand	Anodyne	MMP13	34	53
COc1cc(S(=O)(=O)N[C@@H](CN2CCOCC2)C(=O)O)ccc1Cl	ZINC000819100057	GC	On-Demand	Anodyne	TRY2_BOVIN	48	36
COc1cc(S(=O)(=O)N[C@@H](CN2CCOCC2)C(=O)O)ccc1Cl	ZINC000819100057	GC	On-Demand	Anodyne	MMP2	28	51
COc1cc(S(=O)(=O)N[C@@H](CN2CCOCC2)C(=O)O)ccc1Cl	ZINC000819100057	GC	On-Demand	Anodyne	MMP3	15	40
COc1cc(S(=O)(=O)N[C@@H](CN2CCOCC2)C(=O)O)ccc1Cl	ZINC000819100057	GC	On-Demand	Anodyne	MMP9	15	40
COc1cc(S(=O)(=O)N[C@@H](CN2CCOCC2)C(=O)O)ccc1Cl	ZINC000819100057	GC	On-Demand	Anodyne	ITGAV	47	39
COc1cccc([S@@](=O)CC(=O)NCc2ccc(N3CCCC3)cc2)c1	ZINC000819100069	FF	On-Demand	Clean	DRD4	50	41
COc1cccc([S@@](=O)CC(=O)NCc2ccc(N3CCCC3)cc2)c1	ZINC000819100069	FF	On-Demand	Clean	MTNR1A	43	39
COc1cccc([S@@](=O)CC(=O)NCc2ccc(N3CCCC3)cc2)c1	ZINC000819100069	FF	On-Demand	Clean	MTNR1B	42	39
CN(C)C1(CNC[C@H](O)c2ccccc2)Cc2ccccc2C1	ZINC000819100099	DE	On-Demand	Anodyne	ADRB3	55	38
CN(C)C1(CNC[C@H](O)c2ccccc2)Cc2ccccc2C1	ZINC000819100099	DE	On-Demand	Anodyne	AOC3	22	43
CN(C)C1(CNC[C@@H](O)c2ccccc2)Cc2ccccc2C1	ZINC000819100100	DE	On-Demand	Anodyne	ADRB3	55	38
CN(C)C1(CNC[C@@H](O)c2ccccc2)Cc2ccccc2C1	ZINC000819100100	DE	On-Demand	Anodyne	AOC3	22	43
COc1cccc([C@H](NCCC(=O)N(C)OC)c2ccccc2Cl)c1	ZINC000819100104	FG	On-Demand	Anodyne	DRD4	46	39
COc1cccc([C@H](NCCC(=O)N(C)OC)c2ccccc2Cl)c1	ZINC000819100104	FG	On-Demand	Anodyne	MTNR1A	28	40
COc1cccc([C@H](NCCC(=O)N(C)OC)c2ccccc2Cl)c1	ZINC000819100104	FG	On-Demand	Anodyne	MTNR1B	27	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100110	GF	On-Demand	Anodyne	DRD2	20	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100110	GF	On-Demand	Anodyne	DRD4	28	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100110	GF	On-Demand	Anodyne	HTR2A	16	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100110	GF	On-Demand	Anodyne	OPRM1	15	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100110	GF	On-Demand	Anodyne	LTA4H	21	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100110	GF	On-Demand	Anodyne	SIGMAR1	44	56
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100110	GF	On-Demand	Anodyne	CCR5	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100110	GF	On-Demand	Anodyne	MCHR1	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100110	GF	On-Demand	Anodyne	CACNA1G	23	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100110	GF	On-Demand	Anodyne	BIRC2	55	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100111	GF	On-Demand	Anodyne	DRD2	20	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100111	GF	On-Demand	Anodyne	DRD4	28	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100111	GF	On-Demand	Anodyne	HTR2A	16	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100111	GF	On-Demand	Anodyne	OPRM1	15	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100111	GF	On-Demand	Anodyne	LTA4H	21	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100111	GF	On-Demand	Anodyne	SIGMAR1	44	56
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100111	GF	On-Demand	Anodyne	CCR5	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100111	GF	On-Demand	Anodyne	MCHR1	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100111	GF	On-Demand	Anodyne	CACNA1G	23	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(CCc3ccccc3)CC1)C2	ZINC000819100111	GF	On-Demand	Anodyne	BIRC2	55	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1(c3ccccc3)CCOCC1)C2	ZINC000819100131	GF	On-Demand	Anodyne	KCNA3	48	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1(c3ccccc3)CCOCC1)C2	ZINC000819100132	GF	On-Demand	Anodyne	KCNA3	48	38
CC(C)[C@H]1CC[C@@H](C)C[C@H]1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819100141	CG	On-Demand	Anodyne	TRPM8	17	46
CC(C)[C@H]1CC[C@@H](C)C[C@H]1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819100142	CG	On-Demand	Anodyne	TRPM8	17	46
CC(C)[C@H]1CC[C@@H](C)C[C@H]1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819100143	CG	On-Demand	Anodyne	TRPM8	17	46
CC(C)[C@H]1CC[C@@H](C)C[C@H]1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819100144	CG	On-Demand	Anodyne	TRPM8	17	46
CC(=O)N(c1ccc(NC(=O)C[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100148	IJ	On-Demand	Anodyne	GPR119	40	43
CC(=O)N(c1ccc(NC(=O)C[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1)[C@@H]1C[C@H]1C	ZINC000819100149	IJ	On-Demand	Anodyne	GPR119	40	43
N#Cc1ccc(NC(=O)C(=O)NCC(=O)O)cc1C(F)(F)F	ZINC000819100160	DC	On-Demand	Mild	AR	63	48
N#Cc1ccc(NC(=O)C(=O)NCC(=O)O)cc1C(F)(F)F	ZINC000819100160	DC	On-Demand	Mild	DHODH	36	44
N#Cc1ccc(CS(=O)(=O)CC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819100172	FD	On-Demand	Mild	CTRB_BOVIN	44	32
N#Cc1ccc(CS(=O)(=O)CC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819100172	FD	On-Demand	Mild	TMPRSS11D	79	41
N#Cc1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1Cl	ZINC000819100180	FE	On-Demand	Mild	RPA1	41	31
N#Cc1ccc(NCCNC(=O)Nc2ccccc2CC(=O)O)nc1	ZINC000819100182	ED	On-Demand	Mild	ADRB1	44	34
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819100183	EI	On-Demand	Anodyne	HDAC8	37	47
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819100183	EI	On-Demand	Anodyne	MMP2	17	57
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819100183	EI	On-Demand	Anodyne	HDAC1	20	40
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819100183	EI	On-Demand	Anodyne	HDAC6	21	47
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819100183	EI	On-Demand	Anodyne	MMP9	16	57
N#Cc1ccc(CN2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)cc1	ZINC000819100184	GF	On-Demand	Mild	CCR3	23	45
N#Cc1ccc(CN2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)cc1	ZINC000819100184	GF	On-Demand	Mild	MLNR	25	43
N#Cc1ccc(CN2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)cc1	ZINC000819100184	GF	On-Demand	Mild	FAAH	27	53
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100185	EI	On-Demand	Anodyne	HDAC8	37	47
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100185	EI	On-Demand	Anodyne	MMP2	17	57
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100185	EI	On-Demand	Anodyne	HDAC1	20	40
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100185	EI	On-Demand	Anodyne	HDAC6	21	47
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100185	EI	On-Demand	Anodyne	MMP9	16	57
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100188	EI	On-Demand	Anodyne	HDAC8	37	47
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100188	EI	On-Demand	Anodyne	MMP2	17	57
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100188	EI	On-Demand	Anodyne	HDAC1	20	40
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100188	EI	On-Demand	Anodyne	HDAC6	21	47
CC(=O)N(c1ccc(NC(=O)/C=C\c2ccccc2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100188	EI	On-Demand	Anodyne	MMP9	16	57
N#Cc1ccc(NC(=S)N2CCC[C@@H](CC(=O)O)C2)cc1Cl	ZINC000819100189	EG	On-Demand	Mild	NPY2R	43	40
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819100191	EI	On-Demand	Anodyne	HDAC8	37	47
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819100191	EI	On-Demand	Anodyne	MMP2	17	57
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819100191	EI	On-Demand	Anodyne	HDAC1	20	40
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819100191	EI	On-Demand	Anodyne	HDAC6	21	47
CC(=O)N(c1ccc(NC(=O)/C=C/c2ccccc2)cc1)[C@@H]1C[C@H]1C	ZINC000819100191	EI	On-Demand	Anodyne	MMP9	16	57
N#Cc1ccc(NC(=S)N2CCC[C@H](CC(=O)O)C2)cc1Cl	ZINC000819100192	EG	On-Demand	Mild	NPY2R	43	40
N#Cc1ccc(CNC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100196	CC	On-Demand	Mild	SLC6A1	57	34
N#Cc1ccc(CNC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100196	CC	On-Demand	Mild	GPBAR1	27	41
N#Cc1ccc(CNC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100202	CC	On-Demand	Mild	SLC6A1	57	34
N#Cc1ccc(CNC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100202	CC	On-Demand	Mild	GPBAR1	27	41
N#Cc1ccc(CS(=O)(=O)CC(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819100213	EC	On-Demand	Mild	ACE	49	41
N#Cc1ccc(CS(=O)(=O)CC(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819100213	EC	On-Demand	Mild	DPP4	25	45
N#Cc1ccc(CS(=O)(=O)CC(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819100213	EC	On-Demand	Mild	PREP	77	39
N#Cc1ccc(CS(=O)(=O)CC(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819100213	EC	On-Demand	Mild	LGMN	47	32
N#Cc1ccc(CS(=O)(=O)CC(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819100213	EC	On-Demand	Mild	TMPRSS11D	64	43
N#Cc1ccc(CS(=O)(=O)CC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819100219	EC	On-Demand	Mild	ACE	49	41
N#Cc1ccc(CS(=O)(=O)CC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819100219	EC	On-Demand	Mild	DPP4	25	45
N#Cc1ccc(CS(=O)(=O)CC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819100219	EC	On-Demand	Mild	PREP	77	39
N#Cc1ccc(CS(=O)(=O)CC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819100219	EC	On-Demand	Mild	LGMN	47	32
N#Cc1ccc(CS(=O)(=O)CC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819100219	EC	On-Demand	Mild	TMPRSS11D	64	43
N#Cc1ccc(Cl)cc1NC(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819100223	DD	On-Demand	Mild	SLC6A1	76	37
N#Cc1ccc(Cl)cc1NC(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819100224	DD	On-Demand	Mild	SLC6A1	76	37
CC(=O)N(c1ccc(NC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)cc1)[C@@H]1C[C@H]1C	ZINC000819100243	GG	On-Demand	Anodyne	INHA	23	53
CC(=O)N(c1ccc(NC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)cc1)[C@H]1C[C@H]1C	ZINC000819100244	GG	On-Demand	Anodyne	INHA	23	53
CC(=O)N(c1ccc(NC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)cc1)[C@H]1C[C@@H]1C	ZINC000819100246	GG	On-Demand	Anodyne	INHA	23	53
CC(=O)N(c1ccc(NC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100248	GG	On-Demand	Anodyne	INHA	23	53
CC(=O)N(c1ccc(NC(=O)Cc2cc(-c3ccccc3)on2)cc1)[C@H]1C[C@@H]1C	ZINC000819100263	GI	On-Demand	Anodyne	GRM7	64	34
CC(=O)N(c1ccc(NC(=O)Cc2cc(-c3ccccc3)on2)cc1)[C@@H]1C[C@H]1C	ZINC000819100264	GI	On-Demand	Anodyne	GRM7	64	34
CC(=O)N(c1ccc(NC(=O)Cc2cc(-c3ccccc3)on2)cc1)[C@H]1C[C@H]1C	ZINC000819100266	GI	On-Demand	Anodyne	GRM7	64	34
CC(=O)N(c1ccc(NC(=O)Cc2cc(-c3ccccc3)on2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100267	GI	On-Demand	Anodyne	GRM7	64	34
N#Cc1ccc(Oc2ccc(C(=O)N3CCC[C@@H](CC(=O)O)C3)cc2)nc1	ZINC000819100272	FG	On-Demand	Mild	HRH3	16	47
N#Cc1ccc(Oc2ccc(C(=O)N3CCC[C@H](CC(=O)O)C3)cc2)nc1	ZINC000819100279	FG	On-Demand	Mild	HRH3	16	47
N#Cc1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819100282	DD	On-Demand	Mild	DHODH	26	45
N#Cc1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819100282	DD	On-Demand	Mild	CTRB_BOVIN	46	34
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)[C@@H]1C[C@H]1C	ZINC000819100286	II	On-Demand	Anodyne	GRIN2B	23	44
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)[C@@H]1C[C@H]1C	ZINC000819100286	II	On-Demand	Anodyne	TGM2	43	44
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)[C@@H]1C[C@H]1C	ZINC000819100286	II	On-Demand	Anodyne	F13A1	63	44
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)[C@H]1C[C@H]1C	ZINC000819100287	II	On-Demand	Anodyne	GRIN2B	23	44
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)[C@H]1C[C@H]1C	ZINC000819100287	II	On-Demand	Anodyne	TGM2	43	44
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)[C@H]1C[C@H]1C	ZINC000819100287	II	On-Demand	Anodyne	F13A1	63	44
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)[C@H]1C[C@@H]1C	ZINC000819100288	II	On-Demand	Anodyne	GRIN2B	23	44
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)[C@H]1C[C@@H]1C	ZINC000819100288	II	On-Demand	Anodyne	TGM2	43	44
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)[C@H]1C[C@@H]1C	ZINC000819100288	II	On-Demand	Anodyne	F13A1	63	44
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100289	II	On-Demand	Anodyne	GRIN2B	23	44
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100289	II	On-Demand	Anodyne	TGM2	43	44
CC(=O)N(c1ccc(NC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100289	II	On-Demand	Anodyne	F13A1	63	44
N#Cc1ccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819100292	CC	On-Demand	Mild	DHODH	31	54
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100304	IK	On-Demand	Anodyne	AVPR2	22	40
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100304	IK	On-Demand	Anodyne	NR1H4	17	45
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100304	IK	On-Demand	Anodyne	KCNK3	102	47
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100304	IK	On-Demand	Anodyne	KCNK9	59	47
N#Cc1ccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100306	CC	On-Demand	Mild	DHODH	31	54
N#Cc1ccc(NC(=O)C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1Cl	ZINC000819100309	FD	On-Demand	Mild	ACE	38	45
N#Cc1ccc(NC(=O)C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1Cl	ZINC000819100309	FD	On-Demand	Mild	DHODH	17	40
N#Cc1ccc(NC(=O)C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1Cl	ZINC000819100309	FD	On-Demand	Mild	MME	99	45
N#Cc1ccc(NC(=O)C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1Cl	ZINC000819100309	FD	On-Demand	Mild	ANPEP	65	39
N#Cc1ccc(NC(=O)C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1Cl	ZINC000819100309	FD	On-Demand	Mild	PAPA1_CARPA	34	40
N#Cc1ccc(NC(=O)C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1Cl	ZINC000819100309	FD	On-Demand	Mild	CTSL	27	41
N#Cc1ccc(NC(=O)C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1Cl	ZINC000819100309	FD	On-Demand	Mild	CPA1	43	42
N#Cc1ccc(NC(=O)C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1Cl	ZINC000819100309	FD	On-Demand	Mild	ITGA4	82	36
N#Cc1ccc(NC(=O)C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1Cl	ZINC000819100309	FD	On-Demand	Mild	NAALAD2	30	43
N#Cc1ccc(NC(=O)C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1Cl	ZINC000819100309	FD	On-Demand	Mild	CTSS	15	41
N#Cc1ccc(NC(=O)C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1Cl	ZINC000819100309	FD	On-Demand	Mild	CAPN1	20	48
N#Cc1ccc(NC(=O)C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1Cl	ZINC000819100309	FD	On-Demand	Mild	MMP9	15	40
N#Cc1ccc(NC(=O)C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1Cl	ZINC000819100309	FD	On-Demand	Mild	ACE2	68	42
N#Cc1ccc(NC(=O)C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1Cl	ZINC000819100309	FD	On-Demand	Mild	CTSV	33	40
N#Cc1ccc(NC(=O)C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1Cl	ZINC000819100309	FD	On-Demand	Mild	FPR1	70	43
N#Cc1ccc(NC(=O)C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1Cl	ZINC000819100309	FD	On-Demand	Mild	CTRB_BOVIN	49	36
N#Cc1ccc(NC(=O)C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1Cl	ZINC000819100309	FD	On-Demand	Mild	BLA1_STEMA	82	43
N#Cc1ccc(NC(=O)C(=O)N[C@H](Cc2ccccc2)C(=O)O)cc1Cl	ZINC000819100309	FD	On-Demand	Mild	GPR142	41	33
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819100320	IK	On-Demand	Anodyne	AVPR2	22	40
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819100320	IK	On-Demand	Anodyne	NR1H4	17	45
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819100320	IK	On-Demand	Anodyne	KCNK3	102	47
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819100320	IK	On-Demand	Anodyne	KCNK9	59	47
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)[C@H]1C[C@H]1C	ZINC000819100323	IK	On-Demand	Anodyne	AVPR2	22	40
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)[C@H]1C[C@H]1C	ZINC000819100323	IK	On-Demand	Anodyne	NR1H4	17	45
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)[C@H]1C[C@H]1C	ZINC000819100323	IK	On-Demand	Anodyne	KCNK3	102	47
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)[C@H]1C[C@H]1C	ZINC000819100323	IK	On-Demand	Anodyne	KCNK9	59	47
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819100326	IK	On-Demand	Anodyne	AVPR2	22	40
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819100326	IK	On-Demand	Anodyne	NR1H4	17	45
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819100326	IK	On-Demand	Anodyne	KCNK3	102	47
CC(=O)N(c1ccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819100326	IK	On-Demand	Anodyne	KCNK9	59	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3nc(C)cs3)CC1)C2	ZINC000819100329	GD	On-Demand	Anodyne	NPBWR1	67	34
N#Cc1ccc(NNC(=O)CSCC(=O)O)cc1C(F)(F)F	ZINC000819100331	ED	On-Demand	Reactive	AR	66	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3nc(C)cs3)CC1)C2	ZINC000819100338	GD	On-Demand	Anodyne	NPBWR1	67	34
O[C@@H](CNCCOc1ncc(C(F)(F)F)cc1Cl)c1ccccc1	ZINC000819100349	FG	On-Demand	Anodyne	ADRB2	20	41
O[C@@H](CNCCOc1ncc(C(F)(F)F)cc1Cl)c1ccccc1	ZINC000819100349	FG	On-Demand	Anodyne	ADRB1	39	46
O[C@@H](CNCCOc1ncc(C(F)(F)F)cc1Cl)c1ccccc1	ZINC000819100349	FG	On-Demand	Anodyne	ADRB3	55	46
O[C@H](CNCCOc1ncc(C(F)(F)F)cc1Cl)c1ccccc1	ZINC000819100354	FG	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNCCOc1ncc(C(F)(F)F)cc1Cl)c1ccccc1	ZINC000819100354	FG	On-Demand	Anodyne	ADRB1	39	46
O[C@H](CNCCOc1ncc(C(F)(F)F)cc1Cl)c1ccccc1	ZINC000819100354	FG	On-Demand	Anodyne	ADRB3	55	46
N#Cc1ccc(F)c(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819100355	EF	On-Demand	Mild	CXCL8	30	44
N#Cc1ccc(F)c(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819100355	EF	On-Demand	Mild	CCR3	16	43
O=C1[C@H](NC[C@H](O)c2ccc(F)c(F)c2)CCCN1c1ccccc1Cl	ZINC000819100362	GG	On-Demand	Anodyne	KCNQ2	27	40
O=C1[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)CCCN1c1ccccc1Cl	ZINC000819100365	GG	On-Demand	Anodyne	KCNQ2	27	40
O=C1[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)CCCN1c1ccccc1Cl	ZINC000819100369	GG	On-Demand	Anodyne	KCNQ2	27	40
O=C1[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)CCCN1c1ccccc1Cl	ZINC000819100372	GG	On-Demand	Anodyne	KCNQ2	27	40
CC(=O)N(c1ccc(NC(=O)c2ccccc2COc2cccc(C=O)c2)cc1)[C@H]1C[C@H]1C	ZINC000819100373	IK	On-Demand	Anodyne	OPRL1	16	43
N#Cc1ccc(CNC(=O)Nc2ccccc2CC(=O)O)c(F)c1	ZINC000819100379	EF	On-Demand	Mild	CXCL8	29	44
N#Cc1ccc(CNC(=O)Nc2ccccc2CC(=O)O)c(F)c1	ZINC000819100379	EF	On-Demand	Mild	FFAR4	20	45
CCOc1cccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c1	ZINC000819100381	ED	On-Demand	Anodyne	PKM	23	42
CCOc1cccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c1	ZINC000819100381	ED	On-Demand	Anodyne	AKR1C3	56	39
N#Cc1ccc(OCCNC(=O)C(=O)Nc2cccc(CC(=O)O)c2)cc1	ZINC000819100388	FD	On-Demand	Mild	PLA2G4B	25	40
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819100391	GI	On-Demand	Mild	PAPA1_CARPA	36	46
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819100391	GI	On-Demand	Mild	TRPM8	15	44
CC(C)[C@H]1CC[C@@H](C)C[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819100393	GI	On-Demand	Mild	PAPA1_CARPA	36	46
CC(C)[C@H]1CC[C@@H](C)C[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819100393	GI	On-Demand	Mild	TRPM8	15	44
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819100395	GI	On-Demand	Mild	PAPA1_CARPA	36	46
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819100395	GI	On-Demand	Mild	TRPM8	15	44
CC(C)[C@H]1CC[C@@H](C)C[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819100398	GI	On-Demand	Mild	PAPA1_CARPA	36	46
CC(C)[C@H]1CC[C@@H](C)C[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819100398	GI	On-Demand	Mild	TRPM8	15	44
N#Cc1ccc(NC(=O)C(=O)NCCC(=O)O)cc1C(F)(F)F	ZINC000819100429	ED	On-Demand	Mild	AR	59	47
N#Cc1ccc(NC(=O)C(=O)NCCC(=O)O)cc1C(F)(F)F	ZINC000819100429	ED	On-Demand	Mild	GCGR	24	41
N#Cc1ccc(NC(=O)C(=O)NCCC(=O)O)cc1C(F)(F)F	ZINC000819100429	ED	On-Demand	Mild	DHODH	29	43
N#Cc1ccc(CNC(=O)CS(=O)(=O)Cc2ccc(C(=O)O)cc2)cc1	ZINC000819100436	FD	On-Demand	Mild	CTRB_BOVIN	44	32
N#Cc1ccc(CNC(=O)CS(=O)(=O)Cc2ccc(C(=O)O)cc2)cc1	ZINC000819100436	FD	On-Demand	Mild	TMPRSS11D	79	41
N#Cc1ccc(Nc2cccc(C(=O)N3CCC[C@@H](CC(=O)O)C3)c2)cc1	ZINC000819100439	FH	On-Demand	Mild	HRH3	20	40
N#Cc1ccc(Nc2cccc(C(=O)N3CCC[C@@H](CC(=O)O)C3)c2)cc1	ZINC000819100439	FH	On-Demand	Mild	MAP3K12	29	42
N#Cc1ccc(Nc2cccc(C(=O)N3CCC[C@H](CC(=O)O)C3)c2)cc1	ZINC000819100444	FH	On-Demand	Mild	HRH3	20	40
N#Cc1ccc(Nc2cccc(C(=O)N3CCC[C@H](CC(=O)O)C3)c2)cc1	ZINC000819100444	FH	On-Demand	Mild	MAP3K12	29	42
N#Cc1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1C(F)(F)F	ZINC000819100460	GF	On-Demand	Mild	AR	59	46
N#Cc1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1C(F)(F)F	ZINC000819100460	GF	On-Demand	Mild	DHODH	25	41
O=C1C[C@H](NC[C@H](O)c2ccc(Cl)cc2)CN1CCOc1ccccc1	ZINC000819100462	FF	On-Demand	Anodyne	ADRB3	26	44
O=C1C[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CN1CCOc1ccccc1	ZINC000819100464	FF	On-Demand	Anodyne	ADRB3	26	44
N#Cc1ccc(N2CCC(NC(=O)NCCC(=O)O)CC2)nc1	ZINC000819100466	DC	On-Demand	Mild	HPGDS	21	40
N#Cc1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819100472	DE	On-Demand	Mild	PLA2G4A	31	40
N#Cc1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819100472	DE	On-Demand	Mild	PLA2G4B	65	44
N#Cc1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819100472	DE	On-Demand	Mild	CTRB_BOVIN	46	34
N#Cc1ccc(F)c(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819100476	CD	On-Demand	Mild	SLC6A1	66	35
N#Cc1ccc(F)c(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819100476	CD	On-Demand	Mild	EPHX2	25	55
N#Cc1ccc(F)c(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819100478	CD	On-Demand	Mild	SLC6A1	66	35
N#Cc1ccc(F)c(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819100478	CD	On-Demand	Mild	EPHX2	25	55
N#Cc1ccc(OC[C@@H](O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819100479	DD	On-Demand	Mild	ABCB1	55	43
N#Cc1ccc(OC[C@@H](O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819100480	DD	On-Demand	Mild	ABCB1	55	43
N#Cc1ccc(OC[C@H](O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819100481	DD	On-Demand	Mild	ABCB1	55	43
N#Cc1ccc(OC[C@H](O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819100482	DD	On-Demand	Mild	ABCB1	55	43
N#Cc1ccc(CSc2ccccc2C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819100484	FG	On-Demand	Mild	SLC6A1	56	32
N#Cc1ccc(CSc2ccccc2C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100486	FG	On-Demand	Mild	SLC6A1	56	32
N#Cc1ccc(NC(=O)CCN2CCC[C@H](CC(=O)O)C2)cc1Cl	ZINC000819100488	EF	On-Demand	Mild	CCR3	40	34
N#Cc1ccc(NC(=O)CCN2CCC[C@@H](CC(=O)O)C2)cc1Cl	ZINC000819100491	EF	On-Demand	Mild	CCR3	40	34
N#Cc1ccc(OCCCN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819100492	DF	On-Demand	Mild	SLC6A1	74	37
N#Cc1ccc(OCCCN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819100492	DF	On-Demand	Mild	LTA4H	43	45
N#Cc1ccc(OCCCN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819100492	DF	On-Demand	Mild	HRH3	110	53
N#Cc1ccc(OCCCN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819100492	DF	On-Demand	Mild	SIGMAR1	19	46
N#Cc1ccc(OCCCN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819100492	DF	On-Demand	Mild	CCR3	16	44
N#Cc1ccc(OCCCN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819100492	DF	On-Demand	Mild	PPARD	18	49
N#Cc1ccc(OCCCN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819100492	DF	On-Demand	Mild	PSMB1	40	35
N#Cc1ccc(OCCCN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819100492	DF	On-Demand	Mild	MEN1	59	51
N#Cc1ccc(OCCCN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819100496	DF	On-Demand	Mild	SLC6A1	74	37
N#Cc1ccc(OCCCN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819100496	DF	On-Demand	Mild	LTA4H	43	45
N#Cc1ccc(OCCCN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819100496	DF	On-Demand	Mild	HRH3	110	53
N#Cc1ccc(OCCCN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819100496	DF	On-Demand	Mild	SIGMAR1	19	46
N#Cc1ccc(OCCCN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819100496	DF	On-Demand	Mild	CCR3	16	44
N#Cc1ccc(OCCCN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819100496	DF	On-Demand	Mild	PPARD	18	49
N#Cc1ccc(OCCCN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819100496	DF	On-Demand	Mild	PSMB1	40	35
N#Cc1ccc(OCCCN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819100496	DF	On-Demand	Mild	MEN1	59	51
N#Cc1ccc(OCCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100498	CD	On-Demand	Mild	DRD2	15	42
N#Cc1ccc(OCCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100498	CD	On-Demand	Mild	HRH2	19	49
N#Cc1ccc(OCCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100498	CD	On-Demand	Mild	HTR2A	16	42
N#Cc1ccc(OCCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100498	CD	On-Demand	Mild	SLC6A1	161	44
N#Cc1ccc(OCCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100498	CD	On-Demand	Mild	HRH1	16	43
N#Cc1ccc(OCCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100498	CD	On-Demand	Mild	LTA4H	48	51
N#Cc1ccc(OCCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100498	CD	On-Demand	Mild	CYSLTR2	51	31
N#Cc1ccc(OCCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100498	CD	On-Demand	Mild	HRH3	103	60
N#Cc1ccc(OCCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100498	CD	On-Demand	Mild	SIGMAR1	25	50
N#Cc1ccc(OCCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100498	CD	On-Demand	Mild	CYP2J2	44	31
N#Cc1ccc(OCCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100498	CD	On-Demand	Mild	PSMB1	40	36
N#Cc1ccc(OCCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100498	CD	On-Demand	Mild	MEN1	64	54
N#Cc1ccc(OCCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100501	CD	On-Demand	Mild	DRD2	15	42
N#Cc1ccc(OCCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100501	CD	On-Demand	Mild	HRH2	19	49
N#Cc1ccc(OCCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100501	CD	On-Demand	Mild	HTR2A	16	42
N#Cc1ccc(OCCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100501	CD	On-Demand	Mild	SLC6A1	161	44
N#Cc1ccc(OCCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100501	CD	On-Demand	Mild	HRH1	16	43
N#Cc1ccc(OCCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100501	CD	On-Demand	Mild	LTA4H	48	51
N#Cc1ccc(OCCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100501	CD	On-Demand	Mild	CYSLTR2	51	31
N#Cc1ccc(OCCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100501	CD	On-Demand	Mild	HRH3	103	60
N#Cc1ccc(OCCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100501	CD	On-Demand	Mild	SIGMAR1	25	50
N#Cc1ccc(OCCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100501	CD	On-Demand	Mild	CYP2J2	44	31
N#Cc1ccc(OCCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100501	CD	On-Demand	Mild	PSMB1	40	36
N#Cc1ccc(OCCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100501	CD	On-Demand	Mild	MEN1	64	54
N#Cc1ccc(CSc2ccccc2C(=O)NCCCC(=O)O)cc1	ZINC000819100510	FG	On-Demand	Mild	MME	19	43
N#Cc1ccc(CSc2ccccc2C(=O)NCCCC(=O)O)cc1	ZINC000819100510	FG	On-Demand	Mild	CTRB_BOVIN	45	34
N#Cc1ccc(CSc2ccccc2C(=O)NCCCC(=O)O)cc1	ZINC000819100510	FG	On-Demand	Mild	FFAR1	24	40
N#Cc1ccc(CNCCCCCC(=O)O)c(F)c1	ZINC000819100515	CE	On-Demand	Mild	FFAR1	16	52
N#Cc1ccc(CNCCCCCC(=O)O)c(F)c1	ZINC000819100515	CE	On-Demand	Mild	FFAR4	20	41
C[C@@H](CC(=O)N(C)C1CCN(C(=O)OC(C)(C)C)CC1)n1cccn1	ZINC000819100530	FF	On-Demand	Anodyne	GPR119	36	42
N#Cc1ccc(OCCNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819100542	EE	On-Demand	Mild	ADRB1	44	39
N#Cc1ccc(NC(=S)Nc2ccccc2CC(=O)O)cc1Cl	ZINC000819100546	EH	On-Demand	Mild	CXCL8	31	43
N#Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819100547	FD	On-Demand	Reactive	UL80	18	42
N#Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819100547	FD	On-Demand	Reactive	PLA2G4B	60	38
N#Cc1ccc(N2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)nc1	ZINC000819100555	FD	On-Demand	Mild	SMO	24	45
N#Cc1ccc(N2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)nc1	ZINC000819100555	FD	On-Demand	Mild	DGAT1	26	43
CC(=O)N(c1ccc(NC(=O)c2ccccc2COc2cccc(C=O)c2)cc1)[C@@H]1C[C@@H]1C	ZINC000819100556	IK	On-Demand	Anodyne	OPRL1	16	43
CC(=O)N(c1ccc(NC(=O)c2ccccc2COc2cccc(C=O)c2)cc1)[C@H]1C[C@@H]1C	ZINC000819100558	IK	On-Demand	Anodyne	OPRL1	16	43
CC(=O)N(c1ccc(NC(=O)c2ccccc2COc2cccc(C=O)c2)cc1)[C@@H]1C[C@H]1C	ZINC000819100559	IK	On-Demand	Anodyne	OPRL1	16	43
N#Cc1ccc(OCC(=O)NNC(=O)NCCCC(=O)O)cc1	ZINC000819100565	DC	On-Demand	Reactive	PLA2G4B	48	35
N#Cc1ccc(NCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819100573	DD	On-Demand	Mild	CTRB_BOVIN	46	35
N#Cc1ccc(N2CCC[C@@H]2C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819100576	EE	On-Demand	Mild	PREP	57	40
N#Cc1ccc(N2CCC[C@@H]2C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819100577	EE	On-Demand	Mild	PREP	57	40
N#Cc1ccc(N2CCC[C@H]2C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819100578	EE	On-Demand	Mild	PREP	57	40
N#Cc1ccc(N2CCC[C@H]2C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819100580	EE	On-Demand	Mild	PREP	57	40
N#Cc1ccc(F)c(CNC(=O)Nc2cccc(CC(=O)O)c2)c1	ZINC000819100582	EF	On-Demand	Mild	CCR3	28	46
N#Cc1ccc(F)c(CNC(=O)Nc2cccc(CC(=O)O)c2)c1	ZINC000819100582	EF	On-Demand	Mild	MCHR1	27	42
N#Cc1ccc(OCCNC(=O)Nc2cccc(CC(=O)O)c2)cc1	ZINC000819100588	EE	On-Demand	Mild	ADRB1	45	41
N#Cc1ccc(OCCNC(=O)Nc2cccc(CC(=O)O)c2)cc1	ZINC000819100588	EE	On-Demand	Mild	HRH2	32	45
N#Cc1ccc(OCCNC(=O)Nc2cccc(CC(=O)O)c2)cc1	ZINC000819100588	EE	On-Demand	Mild	CCR3	25	45
N#Cc1ccc(OCCNC(=O)Nc2cccc(CC(=O)O)c2)cc1	ZINC000819100588	EE	On-Demand	Mild	PLA2G4B	31	40
N#Cc1ccc(CN2CCN(C(=O)NCCC(=O)O)CC2)cc1	ZINC000819100592	DC	On-Demand	Mild	MLNR	22	44
N#Cc1ccc(CN2CCN(C(=O)NCCC(=O)O)CC2)cc1	ZINC000819100592	DC	On-Demand	Mild	FAAH	17	46
N#Cc1ccc(CN2CCN(C(=O)NCCC(=O)O)CC2)cc1	ZINC000819100592	DC	On-Demand	Mild	KCNJ1	17	43
N#Cc1ccc(CSCC(=O)N(CC(=O)O)c2ccc3c(c2)OCO3)cc1	ZINC000819100594	GF	On-Demand	Mild	GSK3A	21	42
N#Cc1ccc(N2CCC(NC(=O)Nc3ccccc3CC(=O)O)CC2)nc1	ZINC000819100602	GE	On-Demand	Mild	SMO	15	44
N#Cc1ccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1Cl	ZINC000819100604	DD	On-Demand	Mild	PGR	16	40
N#Cc1ccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1Cl	ZINC000819100604	DD	On-Demand	Mild	SLC6A1	138	39
N#Cc1ccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1Cl	ZINC000819100604	DD	On-Demand	Mild	DHODH	16	40
N#Cc1ccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1Cl	ZINC000819100604	DD	On-Demand	Mild	MAPK1	22	40
N#Cc1ccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1Cl	ZINC000819100604	DD	On-Demand	Mild	TERT	17	41
N#Cc1ccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)cc1Cl	ZINC000819100606	DD	On-Demand	Mild	PGR	16	40
N#Cc1ccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)cc1Cl	ZINC000819100606	DD	On-Demand	Mild	SLC6A1	138	39
N#Cc1ccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)cc1Cl	ZINC000819100606	DD	On-Demand	Mild	DHODH	16	40
N#Cc1ccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)cc1Cl	ZINC000819100606	DD	On-Demand	Mild	MAPK1	22	40
N#Cc1ccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)cc1Cl	ZINC000819100606	DD	On-Demand	Mild	TERT	17	41
N#Cc1ccc(CNC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819100608	DD	On-Demand	Mild	CCR3	34	42
N#Cc1ccc(CNC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819100610	DD	On-Demand	Mild	CCR3	34	42
N#Cc1ccc(OC[C@H](O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100617	CC	On-Demand	Mild	ADRB1	21	41
N#Cc1ccc(OC[C@H](O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100617	CC	On-Demand	Mild	SLC6A1	66	37
N#Cc1ccc(OC[C@H](O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100617	CC	On-Demand	Mild	ACOX1	44	32
N#Cc1ccc(OC[C@H](O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100617	CC	On-Demand	Mild	ABCB1	65	44
N#Cc1ccc(OC[C@H](O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100617	CC	On-Demand	Mild	MEN1	41	40
N#Cc1ccc(OC[C@@H](O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100620	CC	On-Demand	Mild	ADRB1	21	41
N#Cc1ccc(OC[C@@H](O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100620	CC	On-Demand	Mild	SLC6A1	66	37
N#Cc1ccc(OC[C@@H](O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100620	CC	On-Demand	Mild	ACOX1	44	32
N#Cc1ccc(OC[C@@H](O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100620	CC	On-Demand	Mild	ABCB1	65	44
N#Cc1ccc(OC[C@@H](O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819100620	CC	On-Demand	Mild	MEN1	41	40
N#Cc1ccc(OC[C@H](O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100621	CC	On-Demand	Mild	ADRB1	21	41
N#Cc1ccc(OC[C@H](O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100621	CC	On-Demand	Mild	SLC6A1	66	37
N#Cc1ccc(OC[C@H](O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100621	CC	On-Demand	Mild	ACOX1	44	32
N#Cc1ccc(OC[C@H](O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100621	CC	On-Demand	Mild	ABCB1	65	44
N#Cc1ccc(OC[C@H](O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100621	CC	On-Demand	Mild	MEN1	41	40
N#Cc1ccc(OC[C@@H](O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100622	CC	On-Demand	Mild	ADRB1	21	41
N#Cc1ccc(OC[C@@H](O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100622	CC	On-Demand	Mild	SLC6A1	66	37
N#Cc1ccc(OC[C@@H](O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100622	CC	On-Demand	Mild	ACOX1	44	32
N#Cc1ccc(OC[C@@H](O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100622	CC	On-Demand	Mild	ABCB1	65	44
N#Cc1ccc(OC[C@@H](O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819100622	CC	On-Demand	Mild	MEN1	41	40
N#Cc1ccc(NCC(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819100626	DD	On-Demand	Mild	DPP4	25	42
N#Cc1ccc(NCC(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819100631	DD	On-Demand	Mild	DPP4	25	42
N#Cc1ccc(OCc2cccc(C(=O)N3CCC[C@@H](CC(=O)O)C3)c2)cc1	ZINC000819100637	GG	On-Demand	Mild	MAOB	17	41
N#Cc1ccc(OCc2cccc(C(=O)N3CCC[C@@H](CC(=O)O)C3)c2)cc1	ZINC000819100637	GG	On-Demand	Mild	HRH3	20	41
N#Cc1ccc(OCc2cccc(C(=O)N3CCC[C@@H](CC(=O)O)C3)c2)cc1	ZINC000819100637	GG	On-Demand	Mild	GYS1	43	44
N#Cc1ccc(OCc2cccc(C(=O)N3CCC[C@@H](CC(=O)O)C3)c2)cc1	ZINC000819100637	GG	On-Demand	Mild	FFAR1	48	36
N#Cc1ccc(OCc2cccc(C(=O)N3CCC[C@H](CC(=O)O)C3)c2)cc1	ZINC000819100640	GG	On-Demand	Mild	MAOB	17	41
N#Cc1ccc(OCc2cccc(C(=O)N3CCC[C@H](CC(=O)O)C3)c2)cc1	ZINC000819100640	GG	On-Demand	Mild	HRH3	20	41
N#Cc1ccc(OCc2cccc(C(=O)N3CCC[C@H](CC(=O)O)C3)c2)cc1	ZINC000819100640	GG	On-Demand	Mild	GYS1	43	44
N#Cc1ccc(OCc2cccc(C(=O)N3CCC[C@H](CC(=O)O)C3)c2)cc1	ZINC000819100640	GG	On-Demand	Mild	FFAR1	48	36
N#Cc1ccc(NC(=O)C(=O)NCCCC(=O)O)cc1Cl	ZINC000819100643	DD	On-Demand	Mild	DHODH	15	40
N#Cc1ccc(CS(=O)(=O)CC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819100645	FD	On-Demand	Mild	CTRB_BOVIN	45	33
N#Cc1ccc(F)c(CNC(=O)N2CCC(C(=O)O)CC2)c1	ZINC000819100648	DD	On-Demand	Mild	EPHX2	28	62
N#Cc1ccc(NCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819100649	DE	On-Demand	Mild	CTRB_BOVIN	50	37
N#Cc1ccc(OC[C@H](O)CS(=O)(=O)Cc2ccc(C(=O)O)cc2)cc1	ZINC000819100650	GD	On-Demand	Mild	CTRB_BOVIN	45	33
N#Cc1ccc(OC[C@@H](O)CS(=O)(=O)Cc2ccc(C(=O)O)cc2)cc1	ZINC000819100651	GD	On-Demand	Mild	CTRB_BOVIN	45	33
N#Cc1ccc(Cc2cnc(NC(=O)N3CCC[C@H]3C(=O)O)s2)cc1	ZINC000819100667	FF	On-Demand	Mild	PREP	59	35
N#Cc1ccc(Cc2cnc(NC(=O)N3CCC[C@@H]3C(=O)O)s2)cc1	ZINC000819100668	FF	On-Demand	Mild	PREP	59	35
N#Cc1ccc(Cl)c(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819100672	FE	On-Demand	Mild	RPA1	45	32
N#Cc1ccc(CN2CCN(C(=O)NCCCCCC(=O)O)CC2)cc1	ZINC000819100673	FE	On-Demand	Mild	MLNR	22	43
N#Cc1ccc(OCCNC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819100677	EE	On-Demand	Mild	HRH2	15	42
N#Cc1ccc(OCCNC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819100677	EE	On-Demand	Mild	PLA2G4B	54	38
N#Cc1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)c(F)c1	ZINC000819100678	FD	On-Demand	Mild	CXCL8	28	42
N#Cc1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)c(F)c1	ZINC000819100678	FD	On-Demand	Mild	FFAR4	16	43
N#Cc1ccc(OC2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)cc1	ZINC000819100679	GG	On-Demand	Mild	PRSS2	41	31
N#Cc1ccc(OC2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)cc1	ZINC000819100679	GG	On-Demand	Mild	CCR3	30	42
N#Cc1ccc(OC2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)cc1	ZINC000819100679	GG	On-Demand	Mild	EPHX2	23	55
N#Cc1ccc(N2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)c(F)c1	ZINC000819100680	GF	On-Demand	Mild	KCNQ2	58	35
N#Cc1ccc(N2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)c(F)c1	ZINC000819100680	GF	On-Demand	Mild	NPY2R	94	40
N#Cc1ccc(N2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)c(F)c1	ZINC000819100680	GF	On-Demand	Mild	CCR3	16	42
N#Cc1ccc(N2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)c(F)c1	ZINC000819100680	GF	On-Demand	Mild	SLC6A9	21	49
O[C@@H](CN[C@@H]1CCCN(c2ccccc2Cl)C1)c1ccccc1	ZINC000819100688	EH	On-Demand	Anodyne	KCNQ2	53	36
O[C@@H](CN[C@H]1CCCN(c2ccccc2Cl)C1)c1ccccc1	ZINC000819100689	EH	On-Demand	Anodyne	KCNQ2	53	36
O[C@H](CN[C@H]1CCCN(c2ccccc2Cl)C1)c1ccccc1	ZINC000819100690	EH	On-Demand	Anodyne	KCNQ2	53	36
O[C@H](CN[C@@H]1CCCN(c2ccccc2Cl)C1)c1ccccc1	ZINC000819100691	EH	On-Demand	Anodyne	KCNQ2	53	36
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(NC(=O)c2cccnc2)c1	ZINC000819100730	FF	On-Demand	Anodyne	NAMPT	51	40
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(NC(=O)c2cccnc2)c1	ZINC000819100730	FF	On-Demand	Anodyne	KCNK3	45	35
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(NC(=O)c2cccnc2)c1	ZINC000819100731	FF	On-Demand	Anodyne	NAMPT	51	40
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(NC(=O)c2cccnc2)c1	ZINC000819100731	FF	On-Demand	Anodyne	KCNK3	45	35
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(NC(=O)c2cccnc2)c1	ZINC000819100732	FF	On-Demand	Anodyne	NAMPT	51	40
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(NC(=O)c2cccnc2)c1	ZINC000819100732	FF	On-Demand	Anodyne	KCNK3	45	35
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(NC(=O)c2cccnc2)c1	ZINC000819100733	FF	On-Demand	Anodyne	NAMPT	51	40
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(NC(=O)c2cccnc2)c1	ZINC000819100733	FF	On-Demand	Anodyne	KCNK3	45	35
CS(=O)(=O)c1cccc(Oc2ncccc2CNC[C@H](O)C2CC2)c1	ZINC000819100738	FE	On-Demand	Anodyne	NR1H3	40	34
CS(=O)(=O)c1cccc(Oc2ncccc2CNC[C@@H](O)C2CC2)c1	ZINC000819100739	FE	On-Demand	Anodyne	NR1H3	40	34
O=C(NCc1cccnc1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819100769	EE	On-Demand	Anodyne	CHRNA7	46	37
O=C(NCc1cccnc1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819100769	EE	On-Demand	Anodyne	SCD	19	42
O=C(NCc1cccnc1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819100769	EE	On-Demand	Anodyne	NAMPT	90	45
Cc1ccccc1[C@@H](O)CNCCc1c[nH]c2c(C)cccc12	ZINC000819100782	DH	On-Demand	Anodyne	ADRB2	53	57
Cc1ccccc1[C@@H](O)CNCCc1c[nH]c2c(C)cccc12	ZINC000819100782	DH	On-Demand	Anodyne	ADRB1	32	55
Cc1ccccc1[C@@H](O)CNCCc1c[nH]c2c(C)cccc12	ZINC000819100782	DH	On-Demand	Anodyne	ADRB3	28	46
CN(C(=O)c1cc2c(cn1)OCCO2)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819100786	GE	On-Demand	Anodyne	GPR119	49	45
O[C@@H](CNCCCOC1CCOCC1)c1cccc(Br)c1	ZINC000819100829	FF	On-Demand	Anodyne	ADRB3	37	42
O[C@H](CNCCCOC1CCOCC1)c1cccc(Br)c1	ZINC000819100830	FF	On-Demand	Anodyne	ADRB3	37	42
COc1ccc(OC)c([C@H](O)CNCC2(N(C)C)Cc3ccccc3C2)c1	ZINC000819100835	FE	On-Demand	Anodyne	MTNR1A	16	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCNC(=O)c1ccccc1Cl	ZINC000819100854	GE	On-Demand	Anodyne	ECR	49	39
C[C@@H]1CCCC[C@H]1C(=O)NCc1ccc(N2CCCC2)cc1	ZINC000819100855	DH	On-Demand	Clean	CTSK	18	45
C[C@@H]1CCCC[C@@H]1C(=O)NCc1ccc(N2CCCC2)cc1	ZINC000819100857	DH	On-Demand	Clean	CTSK	18	45
O[C@@H](CNCCCOC1CCOCC1)c1cccc(F)c1	ZINC000819100877	CE	On-Demand	Anodyne	ADRB3	35	42
O[C@H](CNCCCOC1CCOCC1)c1cccc(F)c1	ZINC000819100878	CE	On-Demand	Anodyne	ADRB3	35	42
COC(=O)c1ccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c(OC)c1	ZINC000819100893	GC	On-Demand	Anodyne	CPT2	40	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000819100901	FF	On-Demand	Anodyne	ACACB	17	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000819100901	FF	On-Demand	Anodyne	CACNA1I	44	32
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H]1CCN(c2ccccc2)C1	ZINC000819100902	FF	On-Demand	Anodyne	ACACB	17	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H]1CCN(c2ccccc2)C1	ZINC000819100902	FF	On-Demand	Anodyne	CACNA1I	44	32
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000819100937	GG	On-Demand	Anodyne	DRD2	17	46
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000819100937	GG	On-Demand	Anodyne	KCNQ2	60	35
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CCCN(c2ccccc2Cl)C1	ZINC000819100938	GG	On-Demand	Anodyne	DRD2	17	46
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CCCN(c2ccccc2Cl)C1	ZINC000819100938	GG	On-Demand	Anodyne	KCNQ2	60	35
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000819100939	GG	On-Demand	Anodyne	DRD2	17	46
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000819100939	GG	On-Demand	Anodyne	KCNQ2	60	35
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H]1CCCN(c2ccccc2Cl)C1	ZINC000819100940	GG	On-Demand	Anodyne	DRD2	17	46
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H]1CCCN(c2ccccc2Cl)C1	ZINC000819100940	GG	On-Demand	Anodyne	KCNQ2	60	35
CCN(C)C(=O)c1cccc(S(=O)(=O)N2CCC(OC)(C(=O)O)CC2)c1	ZINC000819100946	GD	On-Demand	Anodyne	AKR1C3	64	45
COc1cccc(OC)c1S(=O)(=O)N1CCC(OC)(C(=O)O)CC1	ZINC000819100953	FC	On-Demand	Anodyne	ALS	41	35
CCn1cc(NC(=O)/C=C\[C@@H]2CCCO2)cn1	ZINC000819100980	BD	On-Demand	Anodyne	PANC	50	32
CCn1cc(NC(=O)/C=C\[C@H]2CCCO2)cn1	ZINC000819100981	BD	On-Demand	Anodyne	PANC	50	32
CCn1cc(NC(=O)/C=C/[C@H]2CCCO2)cn1	ZINC000819100982	BD	On-Demand	Anodyne	PANC	50	32
CCn1cc(NC(=O)/C=C/[C@@H]2CCCO2)cn1	ZINC000819100983	BD	On-Demand	Anodyne	PANC	50	32
COc1ccc(OC)c([C@H](O)CNCCCOC2CCOCC2)c1	ZINC000819101005	ED	On-Demand	Anodyne	ADRB2	15	41
O=C(O)[C@H](CN1CCOCC1)NS(=O)(=O)c1ccc(OC2CC2)cc1	ZINC000819101038	FC	On-Demand	Anodyne	MMP13	54	55
O=C(O)[C@H](CN1CCOCC1)NS(=O)(=O)c1ccc(OC2CC2)cc1	ZINC000819101038	FC	On-Demand	Anodyne	MMP2	42	53
O=C(O)[C@H](CN1CCOCC1)NS(=O)(=O)c1ccc(OC2CC2)cc1	ZINC000819101038	FC	On-Demand	Anodyne	MMP3	22	46
O=C(O)[C@H](CN1CCOCC1)NS(=O)(=O)c1ccc(OC2CC2)cc1	ZINC000819101038	FC	On-Demand	Anodyne	MMP9	24	46
O=C(O)[C@@H](CN1CCOCC1)NS(=O)(=O)c1ccc(OC2CC2)cc1	ZINC000819101040	FC	On-Demand	Anodyne	MMP13	54	55
O=C(O)[C@@H](CN1CCOCC1)NS(=O)(=O)c1ccc(OC2CC2)cc1	ZINC000819101040	FC	On-Demand	Anodyne	MMP2	42	53
O=C(O)[C@@H](CN1CCOCC1)NS(=O)(=O)c1ccc(OC2CC2)cc1	ZINC000819101040	FC	On-Demand	Anodyne	MMP3	22	46
O=C(O)[C@@H](CN1CCOCC1)NS(=O)(=O)c1ccc(OC2CC2)cc1	ZINC000819101040	FC	On-Demand	Anodyne	MMP9	24	46
O=C(O)[C@H](CN1CCOCC1)NS(=O)(=O)c1ccc2ccccc2c1F	ZINC000819101044	GD	On-Demand	Anodyne	TRY2_BOVIN	55	39
O=C(O)[C@H](CN1CCOCC1)NS(=O)(=O)c1ccc2ccccc2c1F	ZINC000819101044	GD	On-Demand	Anodyne	MMP2	17	52
O=C(O)[C@@H](CN1CCOCC1)NS(=O)(=O)c1ccc2ccccc2c1F	ZINC000819101056	GD	On-Demand	Anodyne	TRY2_BOVIN	55	39
O=C(O)[C@@H](CN1CCOCC1)NS(=O)(=O)c1ccc2ccccc2c1F	ZINC000819101056	GD	On-Demand	Anodyne	MMP2	17	52
O[C@@H](CNCCCOC1CCOCC1)c1cccc2ccccc12	ZINC000819101067	EG	On-Demand	Anodyne	ADRB2	35	41
O[C@@H](CNCCCOC1CCOCC1)c1cccc2ccccc12	ZINC000819101067	EG	On-Demand	Anodyne	ADRB1	27	41
CN(C(=O)Cc1ccc(-n2cnnc2)cc1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819101102	GF	On-Demand	Anodyne	GPR119	60	51
CN(C)C1(CNC[C@H](O)c2ccc(Cl)cc2)Cc2ccccc2C1	ZINC000819101103	EG	On-Demand	Anodyne	ADRB3	40	35
CN(C)C1(CNC[C@H](O)c2ccc(Cl)cc2)Cc2ccccc2C1	ZINC000819101103	EG	On-Demand	Anodyne	UTS2	47	35
O[C@@H](CNCCCOC1CCOCC1)c1ccc(Cl)cc1	ZINC000819101104	DF	On-Demand	Anodyne	ADRB2	32	44
O[C@@H](CNCCCOC1CCOCC1)c1ccc(Cl)cc1	ZINC000819101104	DF	On-Demand	Anodyne	ADRB1	31	40
O[C@@H](CNCCCOC1CCOCC1)c1ccc(Cl)cc1	ZINC000819101104	DF	On-Demand	Anodyne	ADRB3	23	40
O[C@H](CNCCOc1ncc(C(F)(F)F)cc1Cl)c1cccnc1	ZINC000819101109	FF	On-Demand	Anodyne	ADRB2	27	52
O[C@H](CNCCOc1ncc(C(F)(F)F)cc1Cl)c1cccnc1	ZINC000819101109	FF	On-Demand	Anodyne	ADRB1	43	55
O[C@H](CNCCOc1ncc(C(F)(F)F)cc1Cl)c1cccnc1	ZINC000819101109	FF	On-Demand	Anodyne	ADRB3	108	55
O[C@@H](CNCCOc1ncc(C(F)(F)F)cc1Cl)c1cccnc1	ZINC000819101110	FF	On-Demand	Anodyne	ADRB2	27	52
O[C@@H](CNCCOc1ncc(C(F)(F)F)cc1Cl)c1cccnc1	ZINC000819101110	FF	On-Demand	Anodyne	ADRB1	43	55
O[C@@H](CNCCOc1ncc(C(F)(F)F)cc1Cl)c1cccnc1	ZINC000819101110	FF	On-Demand	Anodyne	ADRB3	108	55
CN(C(=O)c1coc(=O)c2ccccc12)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819101115	GG	On-Demand	Anodyne	CCR8	25	41
CN(C(=O)c1coc(=O)c2ccccc12)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819101115	GG	On-Demand	Anodyne	GPR119	44	42
CN(C)C1(CNC[C@H](O)c2cccc(Br)c2)Cc2ccccc2C1	ZINC000819101139	GG	On-Demand	Anodyne	ADRB3	43	32
CN(C)C1(CNC[C@@H](O)c2cccc(Br)c2)Cc2ccccc2C1	ZINC000819101140	GG	On-Demand	Anodyne	ADRB3	43	32
CN(C)C1(CNC[C@H](O)c2cccc(Cl)c2)Cc2ccccc2C1	ZINC000819101149	EG	On-Demand	Anodyne	ADRB2	17	45
CN(C)C1(CNC[C@H](O)c2cccc(Cl)c2)Cc2ccccc2C1	ZINC000819101149	EG	On-Demand	Anodyne	ADRB1	44	48
CN(C)C1(CNC[C@H](O)c2cccc(Cl)c2)Cc2ccccc2C1	ZINC000819101149	EG	On-Demand	Anodyne	ADRB3	72	46
CN(C)C1(CNC[C@@H](O)c2cccc(Cl)c2)Cc2ccccc2C1	ZINC000819101150	EG	On-Demand	Anodyne	ADRB2	17	45
CN(C)C1(CNC[C@@H](O)c2cccc(Cl)c2)Cc2ccccc2C1	ZINC000819101150	EG	On-Demand	Anodyne	ADRB1	44	48
CN(C)C1(CNC[C@@H](O)c2cccc(Cl)c2)Cc2ccccc2C1	ZINC000819101150	EG	On-Demand	Anodyne	ADRB3	72	46
O[C@@H](CNCCCOC1CCOCC1)c1ccc(Cl)cc1Cl	ZINC000819101151	EG	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CNCCCOC1CCOCC1)c1ccc(Cl)cc1Cl	ZINC000819101151	EG	On-Demand	Anodyne	ADRB1	17	40
O[C@H](CNCCCOC1CCOCC1)c1ccc(Cl)cc1Cl	ZINC000819101152	EG	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CNCCCOC1CCOCC1)c1ccc(Cl)cc1Cl	ZINC000819101152	EG	On-Demand	Anodyne	ADRB1	17	40
CN(C)C(=O)c1cc(NC(=O)C(F)=C2CCC2)ccc1Cl	ZINC000819101164	DG	On-Demand	Anodyne	ENV	40	34
O=C1[C@H](NC[C@H](O)c2cccc(F)c2)CCCN1c1ccccc1Cl	ZINC000819101171	FG	On-Demand	Anodyne	KCNQ2	42	40
O=C1[C@H](NC[C@H](O)c2cccc(F)c2)CCCN1c1ccccc1Cl	ZINC000819101171	FG	On-Demand	Anodyne	P2RX7	21	41
O=C1[C@@H](NC[C@@H](O)c2cccc(F)c2)CCCN1c1ccccc1Cl	ZINC000819101172	FG	On-Demand	Anodyne	KCNQ2	42	40
O=C1[C@@H](NC[C@@H](O)c2cccc(F)c2)CCCN1c1ccccc1Cl	ZINC000819101172	FG	On-Demand	Anodyne	P2RX7	21	41
O=C1[C@H](NC[C@@H](O)c2cccc(F)c2)CCCN1c1ccccc1Cl	ZINC000819101173	FG	On-Demand	Anodyne	KCNQ2	42	40
O=C1[C@H](NC[C@@H](O)c2cccc(F)c2)CCCN1c1ccccc1Cl	ZINC000819101173	FG	On-Demand	Anodyne	P2RX7	21	41
O=C1[C@@H](NC[C@H](O)c2cccc(F)c2)CCCN1c1ccccc1Cl	ZINC000819101174	FG	On-Demand	Anodyne	KCNQ2	42	40
O=C1[C@@H](NC[C@H](O)c2cccc(F)c2)CCCN1c1ccccc1Cl	ZINC000819101174	FG	On-Demand	Anodyne	P2RX7	21	41
O[C@@H](CNCCCOC1CCOCC1)c1cccnc1	ZINC000819101175	CD	On-Demand	Anodyne	ADRB2	36	48
O[C@@H](CNCCCOC1CCOCC1)c1cccnc1	ZINC000819101175	CD	On-Demand	Anodyne	ADRB1	41	48
O[C@@H](CNCCCOC1CCOCC1)c1cccnc1	ZINC000819101175	CD	On-Demand	Anodyne	ADRB3	105	51
O[C@H](CNCCCOC1CCOCC1)c1cccnc1	ZINC000819101176	CD	On-Demand	Anodyne	ADRB2	36	48
O[C@H](CNCCCOC1CCOCC1)c1cccnc1	ZINC000819101176	CD	On-Demand	Anodyne	ADRB1	41	48
O[C@H](CNCCCOC1CCOCC1)c1cccnc1	ZINC000819101176	CD	On-Demand	Anodyne	ADRB3	105	51
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1	ZINC000819101192	EG	On-Demand	Anodyne	NPY2R	49	45
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1	ZINC000819101192	EG	On-Demand	Anodyne	GRM4	22	40
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1	ZINC000819101193	EG	On-Demand	Anodyne	NPY2R	49	45
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1	ZINC000819101193	EG	On-Demand	Anodyne	GRM4	22	40
O[C@@H](CNCCOc1ncc(C(F)(F)F)cc1Cl)c1cccc(F)c1	ZINC000819101209	GH	On-Demand	Anodyne	ADRB1	29	41
O[C@@H](CNCCOc1ncc(C(F)(F)F)cc1Cl)c1cccc(F)c1	ZINC000819101209	GH	On-Demand	Anodyne	ADRB3	35	41
O[C@H](CNCCOc1ncc(C(F)(F)F)cc1Cl)c1cccc(F)c1	ZINC000819101210	GH	On-Demand	Anodyne	ADRB1	29	41
O[C@H](CNCCOc1ncc(C(F)(F)F)cc1Cl)c1cccc(F)c1	ZINC000819101210	GH	On-Demand	Anodyne	ADRB3	35	41
O=C1C[C@@H](NC[C@H](O)c2cccnc2)CN1CCOc1ccccc1	ZINC000819101215	ED	On-Demand	Anodyne	ADRB2	16	42
O=C1C[C@@H](NC[C@H](O)c2cccnc2)CN1CCOc1ccccc1	ZINC000819101215	ED	On-Demand	Anodyne	ADRB1	26	42
O=C1C[C@@H](NC[C@H](O)c2cccnc2)CN1CCOc1ccccc1	ZINC000819101215	ED	On-Demand	Anodyne	ADRB3	67	45
O=C1C[C@H](NC[C@@H](O)c2cccnc2)CN1CCOc1ccccc1	ZINC000819101216	ED	On-Demand	Anodyne	ADRB2	16	42
O=C1C[C@H](NC[C@@H](O)c2cccnc2)CN1CCOc1ccccc1	ZINC000819101216	ED	On-Demand	Anodyne	ADRB1	26	42
O=C1C[C@H](NC[C@@H](O)c2cccnc2)CN1CCOc1ccccc1	ZINC000819101216	ED	On-Demand	Anodyne	ADRB3	67	45
O=C1C[C@@H](NC[C@@H](O)c2cccnc2)CN1CCOc1ccccc1	ZINC000819101217	ED	On-Demand	Anodyne	ADRB2	16	42
O=C1C[C@@H](NC[C@@H](O)c2cccnc2)CN1CCOc1ccccc1	ZINC000819101217	ED	On-Demand	Anodyne	ADRB1	26	42
O=C1C[C@@H](NC[C@@H](O)c2cccnc2)CN1CCOc1ccccc1	ZINC000819101217	ED	On-Demand	Anodyne	ADRB3	67	45
O=C1C[C@H](NC[C@H](O)c2cccnc2)CN1CCOc1ccccc1	ZINC000819101218	ED	On-Demand	Anodyne	ADRB2	16	42
O=C1C[C@H](NC[C@H](O)c2cccnc2)CN1CCOc1ccccc1	ZINC000819101218	ED	On-Demand	Anodyne	ADRB1	26	42
O=C1C[C@H](NC[C@H](O)c2cccnc2)CN1CCOc1ccccc1	ZINC000819101218	ED	On-Demand	Anodyne	ADRB3	67	45
O=C(NCCNC(=O)c1ccccc1Cl)C(F)=C1CCC1	ZINC000819101225	DF	On-Demand	Anodyne	ECR	43	40
O[C@@H](CNCCCOC1CCOCC1)c1cccc(Cl)c1	ZINC000819101238	DF	On-Demand	Anodyne	ADRB2	50	45
O[C@@H](CNCCCOC1CCOCC1)c1cccc(Cl)c1	ZINC000819101238	DF	On-Demand	Anodyne	ADRB1	63	47
O[C@@H](CNCCCOC1CCOCC1)c1cccc(Cl)c1	ZINC000819101238	DF	On-Demand	Anodyne	ADRB3	63	47
O[C@@H](CNCCCOC1CCOCC1)c1cccc(Cl)c1	ZINC000819101238	DF	On-Demand	Anodyne	CYP3A4	47	39
O[C@H](CNCCCOC1CCOCC1)c1cccc(Cl)c1	ZINC000819101239	DF	On-Demand	Anodyne	ADRB2	50	45
O[C@H](CNCCCOC1CCOCC1)c1cccc(Cl)c1	ZINC000819101239	DF	On-Demand	Anodyne	ADRB1	63	47
O[C@H](CNCCCOC1CCOCC1)c1cccc(Cl)c1	ZINC000819101239	DF	On-Demand	Anodyne	ADRB3	63	47
O[C@H](CNCCCOC1CCOCC1)c1cccc(Cl)c1	ZINC000819101239	DF	On-Demand	Anodyne	CYP3A4	47	39
O=C(NCc1ccc(N2CCCC2)cc1)c1cc2c(cn1)OCCO2	ZINC000819101252	EE	On-Demand	Clean	STAT6	43	36
O=C(NCc1ccc(N2CCCC2)cc1)c1cc2c(cn1)OCCO2	ZINC000819101252	EE	On-Demand	Clean	NAMPT	52	38
O[C@@H](CNCCCOC1CCOCC1)c1ccc(F)cc1	ZINC000819101267	CE	On-Demand	Anodyne	ADRB3	16	40
O[C@H](CNCCCOC1CCOCC1)c1ccc(F)cc1	ZINC000819101268	CE	On-Demand	Anodyne	ADRB3	16	40
O=C(/C=C/[C@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101277	EF	On-Demand	Anodyne	CHRM1	15	40
O=C(/C=C/[C@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101277	EF	On-Demand	Anodyne	DRD2	15	42
O=C(/C=C/[C@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101277	EF	On-Demand	Anodyne	DRD4	28	53
O=C(/C=C/[C@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101277	EF	On-Demand	Anodyne	HTR2A	17	53
O=C(/C=C/[C@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101277	EF	On-Demand	Anodyne	SIGMAR1	48	43
O=C(/C=C/[C@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101277	EF	On-Demand	Anodyne	CCR3	20	41
O=C(/C=C/[C@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101277	EF	On-Demand	Anodyne	CYP2J2	46	33
O=C(/C=C/[C@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101277	EF	On-Demand	Anodyne	BIRC2	28	41
O=C(/C=C\[C@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101278	EF	On-Demand	Anodyne	CHRM1	15	40
O=C(/C=C\[C@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101278	EF	On-Demand	Anodyne	DRD2	15	42
O=C(/C=C\[C@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101278	EF	On-Demand	Anodyne	DRD4	28	53
O=C(/C=C\[C@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101278	EF	On-Demand	Anodyne	HTR2A	17	53
O=C(/C=C\[C@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101278	EF	On-Demand	Anodyne	SIGMAR1	48	43
O=C(/C=C\[C@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101278	EF	On-Demand	Anodyne	CCR3	20	41
O=C(/C=C\[C@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101278	EF	On-Demand	Anodyne	CYP2J2	46	33
O=C(/C=C\[C@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101278	EF	On-Demand	Anodyne	BIRC2	28	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101279	EF	On-Demand	Anodyne	CHRM1	15	40
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101279	EF	On-Demand	Anodyne	DRD2	15	42
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101279	EF	On-Demand	Anodyne	DRD4	28	53
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101279	EF	On-Demand	Anodyne	HTR2A	17	53
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101279	EF	On-Demand	Anodyne	SIGMAR1	48	43
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101279	EF	On-Demand	Anodyne	CCR3	20	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101279	EF	On-Demand	Anodyne	CYP2J2	46	33
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101279	EF	On-Demand	Anodyne	BIRC2	28	41
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101280	EF	On-Demand	Anodyne	CHRM1	15	40
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101280	EF	On-Demand	Anodyne	DRD2	15	42
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101280	EF	On-Demand	Anodyne	DRD4	28	53
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101280	EF	On-Demand	Anodyne	HTR2A	17	53
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101280	EF	On-Demand	Anodyne	SIGMAR1	48	43
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101280	EF	On-Demand	Anodyne	CCR3	20	41
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101280	EF	On-Demand	Anodyne	CYP2J2	46	33
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(CCc2ccccc2)CC1	ZINC000819101280	EF	On-Demand	Anodyne	BIRC2	28	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1cccc3ccccc13)C2	ZINC000819101282	FG	On-Demand	Anodyne	NQO2	37	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1cccc3ccccc13)C2	ZINC000819101282	FG	On-Demand	Anodyne	MTNR1A	57	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1cccc3ccccc13)C2	ZINC000819101282	FG	On-Demand	Anodyne	MTNR1B	38	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1cccc3ccccc13)C2	ZINC000819101283	FG	On-Demand	Anodyne	NQO2	37	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1cccc3ccccc13)C2	ZINC000819101283	FG	On-Demand	Anodyne	MTNR1A	57	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1cccc3ccccc13)C2	ZINC000819101283	FG	On-Demand	Anodyne	MTNR1B	38	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000819101304	FF	On-Demand	Anodyne	KCNA3	49	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC1(c2ccccc2)CCOCC1	ZINC000819101304	FF	On-Demand	Anodyne	ICMT	57	38
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1CCOc1ccccc1	ZINC000819101332	FF	On-Demand	Anodyne	ADRB1	36	48
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1CCOc1ccccc1	ZINC000819101332	FF	On-Demand	Anodyne	ADRB3	54	49
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1CCOc1ccccc1	ZINC000819101332	FF	On-Demand	Anodyne	CYP3A4	41	32
O=C1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CN1CCOc1ccccc1	ZINC000819101333	FF	On-Demand	Anodyne	ADRB1	36	48
O=C1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CN1CCOc1ccccc1	ZINC000819101333	FF	On-Demand	Anodyne	ADRB3	54	49
O=C1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CN1CCOc1ccccc1	ZINC000819101333	FF	On-Demand	Anodyne	CYP3A4	41	32
O=C1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CN1CCOc1ccccc1	ZINC000819101334	FF	On-Demand	Anodyne	ADRB1	36	48
O=C1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CN1CCOc1ccccc1	ZINC000819101334	FF	On-Demand	Anodyne	ADRB3	54	49
O=C1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CN1CCOc1ccccc1	ZINC000819101334	FF	On-Demand	Anodyne	CYP3A4	41	32
O=C1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CN1CCOc1ccccc1	ZINC000819101335	FF	On-Demand	Anodyne	ADRB1	36	48
O=C1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CN1CCOc1ccccc1	ZINC000819101335	FF	On-Demand	Anodyne	ADRB3	54	49
O=C1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CN1CCOc1ccccc1	ZINC000819101335	FF	On-Demand	Anodyne	CYP3A4	41	32
O[C@@H](CNCCCOC1CCOCC1)c1ccc(Cl)c(F)c1	ZINC000819101365	EF	On-Demand	Anodyne	ADRB2	32	43
O[C@@H](CNCCCOC1CCOCC1)c1ccc(Cl)c(F)c1	ZINC000819101365	EF	On-Demand	Anodyne	ADRB1	25	43
O[C@@H](CNCCCOC1CCOCC1)c1ccc(Cl)c(F)c1	ZINC000819101365	EF	On-Demand	Anodyne	ADRB3	21	43
O[C@@H](CNCCCOC1CCOCC1)c1ccc(Cl)c(F)c1	ZINC000819101365	EF	On-Demand	Anodyne	MAPK1	41	37
O[C@H](CNCCCOC1CCOCC1)c1ccc(Cl)c(F)c1	ZINC000819101366	EF	On-Demand	Anodyne	ADRB2	32	43
O[C@H](CNCCCOC1CCOCC1)c1ccc(Cl)c(F)c1	ZINC000819101366	EF	On-Demand	Anodyne	ADRB1	25	43
O[C@H](CNCCCOC1CCOCC1)c1ccc(Cl)c(F)c1	ZINC000819101366	EF	On-Demand	Anodyne	ADRB3	21	43
O[C@H](CNCCCOC1CCOCC1)c1ccc(Cl)c(F)c1	ZINC000819101366	EF	On-Demand	Anodyne	MAPK1	41	37
O=C1C[C@H](NC[C@H](O)c2ccc(F)cc2)CN1CCOc1ccccc1	ZINC000819101372	FE	On-Demand	Anodyne	SLC6A3	26	43
O=C1C[C@@H](NC[C@@H](O)c2ccc(F)cc2)CN1CCOc1ccccc1	ZINC000819101373	FE	On-Demand	Anodyne	SLC6A3	26	43
O=C1C[C@@H](NC[C@H](O)c2ccc(F)cc2)CN1CCOc1ccccc1	ZINC000819101374	FE	On-Demand	Anodyne	SLC6A3	26	43
O=C1C[C@H](NC[C@@H](O)c2ccc(F)cc2)CN1CCOc1ccccc1	ZINC000819101375	FE	On-Demand	Anodyne	SLC6A3	26	43
CN(C)C1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)Cc2ccccc2C1	ZINC000819101380	FE	On-Demand	Bother	CACNA1C	58	37
CN(C)C1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)Cc2ccccc2C1	ZINC000819101380	FE	On-Demand	Bother	ADRB3	50	33
CN(C)C1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)Cc2ccccc2C1	ZINC000819101380	FE	On-Demand	Bother	CACNA1D	88	37
CN(C)C1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)Cc2ccccc2C1	ZINC000819101381	FE	On-Demand	Bother	CACNA1C	58	37
CN(C)C1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)Cc2ccccc2C1	ZINC000819101381	FE	On-Demand	Bother	ADRB3	50	33
CN(C)C1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)Cc2ccccc2C1	ZINC000819101381	FE	On-Demand	Bother	CACNA1D	88	37
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCCC3)cc2)c1	ZINC000819101388	FG	On-Demand	Clean	HTR1D	22	40
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCCC3)cc2)c1	ZINC000819101388	FG	On-Demand	Clean	HTR1B	21	40
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCCC3)cc2)c1	ZINC000819101388	FG	On-Demand	Clean	PTGIR	15	42
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCCC3)cc2)c1	ZINC000819101388	FG	On-Demand	Clean	KCNQ2	44	41
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCCC3)cc2)c1	ZINC000819101388	FG	On-Demand	Clean	TAAR1	27	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819101394	GF	On-Demand	Anodyne	DRD2	23	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819101394	GF	On-Demand	Anodyne	DRD4	26	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819101394	GF	On-Demand	Anodyne	HTR2A	16	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819101394	GF	On-Demand	Anodyne	OPRM1	17	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819101394	GF	On-Demand	Anodyne	DRD3	16	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819101394	GF	On-Demand	Anodyne	HTR4	28	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819101394	GF	On-Demand	Anodyne	LTA4H	22	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819101394	GF	On-Demand	Anodyne	SIGMAR1	49	57
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819101394	GF	On-Demand	Anodyne	CACNA1B	18	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819101394	GF	On-Demand	Anodyne	FPR1	45	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819101394	GF	On-Demand	Anodyne	CACNA1G	28	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819101394	GF	On-Demand	Anodyne	BIRC2	37	41
CN(C(=O)Cc1nsc2ccccc12)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819101397	GH	On-Demand	Anodyne	GPR119	48	43
CO[C@@H](CS(=O)(=O)N[C@H](CN1CCOCC1)C(=O)O)c1ccccc1	ZINC000819101411	FC	On-Demand	Anodyne	CASR	50	39
CO[C@@H](CS(=O)(=O)N[C@@H](CN1CCOCC1)C(=O)O)c1ccccc1	ZINC000819101412	FC	On-Demand	Anodyne	CASR	50	39
CCC[C@H](CCc1ccccc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819101426	GH	On-Demand	Anodyne	ADRB3	46	48
CCC[C@@H](CCc1ccccc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819101427	GH	On-Demand	Anodyne	ADRB3	46	48
CCC[C@@H](CCc1ccccc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819101428	GH	On-Demand	Anodyne	ADRB3	46	48
CCC[C@H](CCc1ccccc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819101429	GH	On-Demand	Anodyne	ADRB3	46	48
CCC[C@@H](CCc1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819101470	DH	On-Demand	Mild	CTSG	15	40
CCC[C@@H](CCc1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819101470	DH	On-Demand	Mild	CTRB_BOVIN	53	41
CCC[C@H](CCc1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819101471	DH	On-Demand	Mild	CTSG	15	40
CCC[C@H](CCc1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819101471	DH	On-Demand	Mild	CTRB_BOVIN	53	41
CCC[C@H](CCc1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819101472	DH	On-Demand	Mild	CTSG	15	40
CCC[C@H](CCc1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819101472	DH	On-Demand	Mild	CTRB_BOVIN	53	41
CCC[C@@H](CCc1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819101473	DH	On-Demand	Mild	CTSG	15	40
CCC[C@@H](CCc1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819101473	DH	On-Demand	Mild	CTRB_BOVIN	53	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(N3CCCC3)cc1)C2	ZINC000819101476	FF	On-Demand	Clean	VHL	50	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(N3CCCC3)cc1)C2	ZINC000819101477	FF	On-Demand	Clean	VHL	50	35
Cc1oc(-c2ccccc2)nc1CC(=O)OCc1c(Cl)nc2ccccn12	ZINC000819101533	GI	On-Demand	Anodyne	PPARG	80	41
Cc1oc(-c2ccccc2)nc1CC(=O)OCc1c(Cl)nc2ccccn12	ZINC000819101533	GI	On-Demand	Anodyne	PPARA	87	41
Cc1oc(-c2ccccc2)nc1CC(=O)OCc1c(Cl)nc2ccccn12	ZINC000819101533	GI	On-Demand	Anodyne	PDE8B	60	34
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819101549	FE	On-Demand	Bother	ADRB2	61	42
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819101549	FE	On-Demand	Bother	ADRB1	56	41
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819101549	FE	On-Demand	Bother	ADRB3	71	42
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819101550	FE	On-Demand	Bother	ADRB2	61	42
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819101550	FE	On-Demand	Bother	ADRB1	56	41
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819101550	FE	On-Demand	Bother	ADRB3	71	42
Cc1ccccc1[C@@H](O)CNCCc1cccc(C(=O)N(C)C)c1	ZINC000819101573	EF	On-Demand	Anodyne	ADRB2	74	42
Cc1ccccc1[C@@H](O)CNCCc1cccc(C(=O)N(C)C)c1	ZINC000819101573	EF	On-Demand	Anodyne	ADRB1	61	42
Cc1ccccc1[C@@H](O)CNCCc1cccc(C(=O)N(C)C)c1	ZINC000819101573	EF	On-Demand	Anodyne	ADRB3	53	42
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819101576	FG	On-Demand	Anodyne	ADRB2	48	41
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819101576	FG	On-Demand	Anodyne	ADRB1	47	42
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819101576	FG	On-Demand	Anodyne	ADRB3	36	43
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819101577	FG	On-Demand	Anodyne	ADRB2	48	41
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819101577	FG	On-Demand	Anodyne	ADRB1	47	42
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819101577	FG	On-Demand	Anodyne	ADRB3	36	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCNS(=O)(=O)Cc1ccccc1	ZINC000819101578	GD	On-Demand	Anodyne	PAPA1_CARPA	28	40
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819101618	GH	On-Demand	Anodyne	ADRB2	58	41
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819101618	GH	On-Demand	Anodyne	ADRB1	57	47
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819101618	GH	On-Demand	Anodyne	ADRB3	43	49
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819101618	GH	On-Demand	Anodyne	UL54	41	31
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819101619	GH	On-Demand	Anodyne	ADRB2	58	41
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819101619	GH	On-Demand	Anodyne	ADRB1	57	47
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819101619	GH	On-Demand	Anodyne	ADRB3	43	49
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819101619	GH	On-Demand	Anodyne	UL54	41	31
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1	ZINC000819101636	EF	On-Demand	Mild	NPY2R	57	45
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCCN1c1ccccc1Cl	ZINC000819101650	EF	On-Demand	Anodyne	ADRB3	58	42
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCCN1c1ccccc1Cl	ZINC000819101651	EF	On-Demand	Anodyne	ADRB3	58	42
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCCN1c1ccccc1Cl	ZINC000819101652	EF	On-Demand	Anodyne	ADRB3	58	42
O=C1[C@H](NC[C@H](O)c2cccnc2)CCCN1c1ccccc1Cl	ZINC000819101653	EF	On-Demand	Anodyne	ADRB3	58	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCCOC2CCOCC2)cc1	ZINC000819101658	FD	On-Demand	Anodyne	ADRB2	34	48
CS(=O)(=O)c1ccc([C@@H](O)CNCCCOC2CCOCC2)cc1	ZINC000819101658	FD	On-Demand	Anodyne	ADRB1	29	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCCOC2CCOCC2)cc1	ZINC000819101658	FD	On-Demand	Anodyne	ADRB3	36	40
CS(=O)(=O)c1ccc([C@H](O)CNCCCOC2CCOCC2)cc1	ZINC000819101659	FD	On-Demand	Anodyne	ADRB2	34	48
CS(=O)(=O)c1ccc([C@H](O)CNCCCOC2CCOCC2)cc1	ZINC000819101659	FD	On-Demand	Anodyne	ADRB1	29	40
CS(=O)(=O)c1ccc([C@H](O)CNCCCOC2CCOCC2)cc1	ZINC000819101659	FD	On-Demand	Anodyne	ADRB3	36	40
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2F)CCCN1c1ccccc1Cl	ZINC000819101673	GG	On-Demand	Anodyne	P2RX7	28	42
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2F)CCCN1c1ccccc1Cl	ZINC000819101674	GG	On-Demand	Anodyne	P2RX7	28	42
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2F)CCCN1c1ccccc1Cl	ZINC000819101675	GG	On-Demand	Anodyne	P2RX7	28	42
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2F)CCCN1c1ccccc1Cl	ZINC000819101676	GG	On-Demand	Anodyne	P2RX7	28	42
CN1CCC[C@H](CNC[C@@H](O)c2cccnc2)[C@@H]1c1cccs1	ZINC000819101694	EF	On-Demand	Anodyne	ADRB1	22	40
CN1CCC[C@H](CNC[C@@H](O)c2cccnc2)[C@@H]1c1cccs1	ZINC000819101694	EF	On-Demand	Anodyne	ADRB3	84	42
CN1CCC[C@H](CNC[C@@H](O)c2cccnc2)[C@H]1c1cccs1	ZINC000819101695	EF	On-Demand	Anodyne	ADRB1	22	40
CN1CCC[C@H](CNC[C@@H](O)c2cccnc2)[C@H]1c1cccs1	ZINC000819101695	EF	On-Demand	Anodyne	ADRB3	84	42
CN1CCC[C@H](CNC[C@H](O)c2cccnc2)[C@H]1c1cccs1	ZINC000819101696	EF	On-Demand	Anodyne	ADRB1	22	40
CN1CCC[C@H](CNC[C@H](O)c2cccnc2)[C@H]1c1cccs1	ZINC000819101696	EF	On-Demand	Anodyne	ADRB3	84	42
CN1CCC[C@H](CNC[C@H](O)c2cccnc2)[C@@H]1c1cccs1	ZINC000819101697	EF	On-Demand	Anodyne	ADRB1	22	40
CN1CCC[C@H](CNC[C@H](O)c2cccnc2)[C@@H]1c1cccs1	ZINC000819101697	EF	On-Demand	Anodyne	ADRB3	84	42
O[C@@H](CNCCCOC1CCOCC1)c1ccccc1	ZINC000819101702	CD	On-Demand	Anodyne	ADRB2	42	40
O[C@@H](CNCCCOC1CCOCC1)c1ccccc1	ZINC000819101702	CD	On-Demand	Anodyne	ADRB1	48	41
O[C@@H](CNCCCOC1CCOCC1)c1ccccc1	ZINC000819101702	CD	On-Demand	Anodyne	ADRB3	42	50
O[C@H](CNCCCOC1CCOCC1)c1ccccc1	ZINC000819101703	CD	On-Demand	Anodyne	ADRB2	42	40
O[C@H](CNCCCOC1CCOCC1)c1ccccc1	ZINC000819101703	CD	On-Demand	Anodyne	ADRB1	48	41
O[C@H](CNCCCOC1CCOCC1)c1ccccc1	ZINC000819101703	CD	On-Demand	Anodyne	ADRB3	42	50
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2)CCCN1c1ccccc1Cl	ZINC000819101716	FG	On-Demand	Anodyne	P2RX7	16	41
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2)CCCN1c1ccccc1Cl	ZINC000819101717	FG	On-Demand	Anodyne	P2RX7	16	41
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2)CCCN1c1ccccc1Cl	ZINC000819101718	FG	On-Demand	Anodyne	P2RX7	16	41
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2)CCCN1c1ccccc1Cl	ZINC000819101719	FG	On-Demand	Anodyne	P2RX7	16	41
C=CCC1(C(=O)NCCNS(=O)(=O)Cc2ccccc2)CCOCC1	ZINC000819101746	FD	On-Demand	Mild	TMPRSS11D	40	32
Cc1ccc(N2CC[C@H](NC[C@H](O)c3ccccc3Cl)C2=O)cc1	ZINC000819101774	EG	On-Demand	Anodyne	OPRL1	41	36
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819101775	EE	On-Demand	Anodyne	ADRB2	62	42
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819101775	EE	On-Demand	Anodyne	ADRB1	54	42
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819101775	EE	On-Demand	Anodyne	ADRB3	45	42
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819101776	EE	On-Demand	Anodyne	ADRB2	62	42
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819101776	EE	On-Demand	Anodyne	ADRB1	54	42
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819101776	EE	On-Demand	Anodyne	ADRB3	45	42
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819101792	EF	On-Demand	Anodyne	ADRB2	34	41
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819101793	EF	On-Demand	Anodyne	ADRB2	34	41
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819101796	GD	On-Demand	Anodyne	ADRB2	30	41
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819101796	GD	On-Demand	Anodyne	ADRB1	42	38
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819101796	GD	On-Demand	Anodyne	ADRB3	26	40
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819101797	GD	On-Demand	Anodyne	ADRB2	30	41
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819101797	GD	On-Demand	Anodyne	ADRB1	42	38
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819101797	GD	On-Demand	Anodyne	ADRB3	26	40
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819101798	GD	On-Demand	Anodyne	ADRB2	30	41
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819101798	GD	On-Demand	Anodyne	ADRB1	42	38
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819101798	GD	On-Demand	Anodyne	ADRB3	26	40
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819101799	GD	On-Demand	Anodyne	ADRB2	30	41
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819101799	GD	On-Demand	Anodyne	ADRB1	42	38
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819101799	GD	On-Demand	Anodyne	ADRB3	26	40
CC(=O)Nc1cccc(CC(=O)N(C)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819101830	GG	On-Demand	Anodyne	GPR119	51	51
O=C(/C=C/[C@@H]1CCCO1)NCC1(c2ccccc2)CCOCC1	ZINC000819101831	DF	On-Demand	Anodyne	KCNA3	46	38
O=C(/C=C\[C@@H]1CCCO1)NCC1(c2ccccc2)CCOCC1	ZINC000819101832	DF	On-Demand	Anodyne	KCNA3	46	38
O=C(/C=C/[C@H]1CCCO1)NCC1(c2ccccc2)CCOCC1	ZINC000819101833	DF	On-Demand	Anodyne	KCNA3	46	38
O=C(/C=C\[C@H]1CCCO1)NCC1(c2ccccc2)CCOCC1	ZINC000819101834	DF	On-Demand	Anodyne	KCNA3	46	38
O[C@@H](CNCCCOC1CCOCC1)c1cccc(C(F)(F)F)c1	ZINC000819101841	EF	On-Demand	Anodyne	ADRB1	35	41
O[C@@H](CNCCCOC1CCOCC1)c1cccc(C(F)(F)F)c1	ZINC000819101841	EF	On-Demand	Anodyne	ADRB3	30	40
O[C@H](CNCCCOC1CCOCC1)c1cccc(C(F)(F)F)c1	ZINC000819101842	EF	On-Demand	Anodyne	ADRB1	35	41
O[C@H](CNCCCOC1CCOCC1)c1cccc(C(F)(F)F)c1	ZINC000819101842	EF	On-Demand	Anodyne	ADRB3	30	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCCS(=O)(=O)Cc1ccccc1	ZINC000819101846	GE	On-Demand	Anodyne	TACR3	15	41
O=C(NCC1(c2ccccc2)CCOCC1)C(F)=C1CCC1	ZINC000819101851	DG	On-Demand	Anodyne	KCNA3	43	41
O=C(NCC1(c2ccccc2)CCOCC1)C(F)=C1CCC1	ZINC000819101851	DG	On-Demand	Anodyne	ICMT	57	38
O=C(NC1CCN(CCc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819101859	DG	On-Demand	Anodyne	CHRM1	21	42
O=C(NC1CCN(CCc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819101859	DG	On-Demand	Anodyne	DRD2	24	46
O=C(NC1CCN(CCc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819101859	DG	On-Demand	Anodyne	DRD4	30	55
O=C(NC1CCN(CCc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819101859	DG	On-Demand	Anodyne	HTR2A	24	55
O=C(NC1CCN(CCc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819101859	DG	On-Demand	Anodyne	OPRM1	17	47
O=C(NC1CCN(CCc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819101859	DG	On-Demand	Anodyne	CHRM3	23	41
O=C(NC1CCN(CCc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819101859	DG	On-Demand	Anodyne	LTA4H	21	43
O=C(NC1CCN(CCc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819101859	DG	On-Demand	Anodyne	SIGMAR1	64	64
O=C(NC1CCN(CCc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819101859	DG	On-Demand	Anodyne	CCR3	35	41
O=C(NC1CCN(CCc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819101859	DG	On-Demand	Anodyne	CACNA1G	28	43
O=C(NC1CCN(CCc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819101859	DG	On-Demand	Anodyne	BIRC2	62	47
O[C@@H](CNCCCOC1CCOCC1)c1ccc(F)c(F)c1	ZINC000819101873	DE	On-Demand	Anodyne	ADRB2	37	40
O[C@H](CNCCCOC1CCOCC1)c1ccc(F)c(F)c1	ZINC000819101874	DE	On-Demand	Anodyne	ADRB2	37	40
CN1CCC[C@H](CNC[C@H](O)c2cccc(Cl)c2)[C@H]1c1cccs1	ZINC000819101878	FI	On-Demand	Anodyne	ADRB1	27	40
CN1CCC[C@H](CNC[C@H](O)c2cccc(Cl)c2)[C@H]1c1cccs1	ZINC000819101878	FI	On-Demand	Anodyne	ADRB3	43	40
CN1CCC[C@H](CNC[C@H](O)c2cccc(Cl)c2)[C@@H]1c1cccs1	ZINC000819101879	FI	On-Demand	Anodyne	ADRB1	27	40
CN1CCC[C@H](CNC[C@H](O)c2cccc(Cl)c2)[C@@H]1c1cccs1	ZINC000819101879	FI	On-Demand	Anodyne	ADRB3	43	40
CN1CCC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)[C@H]1c1cccs1	ZINC000819101880	FI	On-Demand	Anodyne	ADRB1	27	40
CN1CCC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)[C@H]1c1cccs1	ZINC000819101880	FI	On-Demand	Anodyne	ADRB3	43	40
CN1CCC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)[C@@H]1c1cccs1	ZINC000819101881	FI	On-Demand	Anodyne	ADRB1	27	40
CN1CCC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)[C@@H]1c1cccs1	ZINC000819101881	FI	On-Demand	Anodyne	ADRB3	43	40
COCCOc1ccc(CNC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819101901	GE	On-Demand	Anodyne	VHL	40	31
COCCOc1ccc(CNC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819101902	GE	On-Demand	Anodyne	VHL	40	31
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1cc(O)nc2ccccc12	ZINC000819101967	FE	On-Demand	Anodyne	ACACB	15	43
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1cc(O)nc2ccccc12	ZINC000819101967	FE	On-Demand	Anodyne	METG	81	38
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1cc(O)nc2ccccc12	ZINC000819101968	FE	On-Demand	Anodyne	ACACB	15	43
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1cc(O)nc2ccccc12	ZINC000819101968	FE	On-Demand	Anodyne	METG	81	38
C[C@H](CC(=O)NCC(=O)NCc1ccccc1)n1cccn1	ZINC000819101982	DD	On-Demand	Anodyne	MME	15	43
C[C@@H](CC(=O)NCC(=O)NCc1ccccc1)n1cccn1	ZINC000819101983	DD	On-Demand	Anodyne	MME	15	43
Cc1ccc(N2CC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819102018	EG	On-Demand	Anodyne	ADRB1	35	41
Cc1ccc(N2CC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819102018	EG	On-Demand	Anodyne	ADRB3	55	44
Cc1ccc(N2CC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819102018	EG	On-Demand	Anodyne	IGF1R	31	42
Cc1ccc(N2CC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819102018	EG	On-Demand	Anodyne	CYP3A4	53	42
Cc1ccc(N2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819102019	EG	On-Demand	Anodyne	ADRB1	35	41
Cc1ccc(N2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819102019	EG	On-Demand	Anodyne	ADRB3	55	44
Cc1ccc(N2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819102019	EG	On-Demand	Anodyne	IGF1R	31	42
Cc1ccc(N2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819102019	EG	On-Demand	Anodyne	CYP3A4	53	42
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819102020	GG	On-Demand	Anodyne	ADRB2	60	42
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819102020	GG	On-Demand	Anodyne	ADRB1	58	45
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819102020	GG	On-Demand	Anodyne	ADRB3	86	48
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819102021	GG	On-Demand	Anodyne	ADRB2	60	42
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819102021	GG	On-Demand	Anodyne	ADRB1	58	45
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819102021	GG	On-Demand	Anodyne	ADRB3	86	48
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102022	GE	On-Demand	Anodyne	ADRB2	31	49
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102022	GE	On-Demand	Anodyne	ADRB1	54	49
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102022	GE	On-Demand	Anodyne	ADRB3	36	40
COCCc1ccc(OC[C@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102023	GE	On-Demand	Anodyne	ADRB2	31	49
COCCc1ccc(OC[C@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102023	GE	On-Demand	Anodyne	ADRB1	54	49
COCCc1ccc(OC[C@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102023	GE	On-Demand	Anodyne	ADRB3	36	40
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102024	GE	On-Demand	Anodyne	ADRB2	31	49
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102024	GE	On-Demand	Anodyne	ADRB1	54	49
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102024	GE	On-Demand	Anodyne	ADRB3	36	40
COCCc1ccc(OC[C@@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102025	GE	On-Demand	Anodyne	ADRB2	31	49
COCCc1ccc(OC[C@@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102025	GE	On-Demand	Anodyne	ADRB1	54	49
COCCc1ccc(OC[C@@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102025	GE	On-Demand	Anodyne	ADRB3	36	40
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819102059	GG	On-Demand	Anodyne	ADRB2	75	43
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819102059	GG	On-Demand	Anodyne	ADRB1	75	45
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819102059	GG	On-Demand	Anodyne	ADRB3	88	51
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819102060	GG	On-Demand	Anodyne	ADRB2	75	43
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819102060	GG	On-Demand	Anodyne	ADRB1	75	45
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819102060	GG	On-Demand	Anodyne	ADRB3	88	51
CSc1ccc(OC[C@@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102063	GF	On-Demand	Anodyne	ADRB2	22	41
CSc1ccc(OC[C@@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102064	GF	On-Demand	Anodyne	ADRB2	22	41
CSc1ccc(OC[C@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102065	GF	On-Demand	Anodyne	ADRB2	22	41
CSc1ccc(OC[C@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102066	GF	On-Demand	Anodyne	ADRB2	22	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)NCC(N)=O)c1	ZINC000819102080	GC	On-Demand	Anodyne	KCNK3	48	33
O=C(Nc1cccc(N2CCCS2(=O)=O)c1)C(F)=C1CCC1	ZINC000819102090	DF	On-Demand	Anodyne	CDK1	17	40
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccc(CC#N)cc3)C2=O)cc1	ZINC000819102094	GE	On-Demand	Mild	ADRB2	24	40
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccc(CC#N)cc3)C2=O)cc1	ZINC000819102094	GE	On-Demand	Mild	ADRB1	32	40
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccc(CC#N)cc3)C2=O)cc1	ZINC000819102094	GE	On-Demand	Mild	ADRB3	22	42
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccc(CC#N)cc3)C2=O)cc1	ZINC000819102095	GE	On-Demand	Mild	ADRB2	24	40
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccc(CC#N)cc3)C2=O)cc1	ZINC000819102095	GE	On-Demand	Mild	ADRB1	32	40
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccc(CC#N)cc3)C2=O)cc1	ZINC000819102095	GE	On-Demand	Mild	ADRB3	22	42
O=C(O)[C@H](NS(=O)(=O)c1ccc(SC(F)(F)F)cc1)[C@@H]1CCCOC1	ZINC000819102100	GE	On-Demand	Anodyne	MMP13	21	46
O=C(O)[C@H](NS(=O)(=O)c1ccc(SC(F)(F)F)cc1)[C@@H]1CCCOC1	ZINC000819102100	GE	On-Demand	Anodyne	MMP2	16	46
O=C(O)[C@@H](NS(=O)(=O)c1ccc(SC(F)(F)F)cc1)[C@H]1CCCOC1	ZINC000819102101	GE	On-Demand	Anodyne	MMP13	21	46
O=C(O)[C@@H](NS(=O)(=O)c1ccc(SC(F)(F)F)cc1)[C@H]1CCCOC1	ZINC000819102101	GE	On-Demand	Anodyne	MMP2	16	46
O=C(O)[C@H](NS(=O)(=O)c1ccc(SC(F)(F)F)cc1)[C@H]1CCCOC1	ZINC000819102102	GE	On-Demand	Anodyne	MMP13	21	46
O=C(O)[C@H](NS(=O)(=O)c1ccc(SC(F)(F)F)cc1)[C@H]1CCCOC1	ZINC000819102102	GE	On-Demand	Anodyne	MMP2	16	46
O=C(O)[C@@H](NS(=O)(=O)c1ccc(SC(F)(F)F)cc1)[C@@H]1CCCOC1	ZINC000819102103	GE	On-Demand	Anodyne	MMP13	21	46
O=C(O)[C@@H](NS(=O)(=O)c1ccc(SC(F)(F)F)cc1)[C@@H]1CCCOC1	ZINC000819102103	GE	On-Demand	Anodyne	MMP2	16	46
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C(F)=C2CCC2)cc1	ZINC000819102145	EG	On-Demand	Anodyne	ELANE	29	41
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C(F)=C2CCC2)cc1	ZINC000819102145	EG	On-Demand	Anodyne	MMP1	25	42
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102158	GE	On-Demand	Anodyne	ADRB2	23	41
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102158	GE	On-Demand	Anodyne	ABCB1	18	42
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102159	GE	On-Demand	Anodyne	ADRB2	23	41
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102159	GE	On-Demand	Anodyne	ABCB1	18	42
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102160	GE	On-Demand	Anodyne	ADRB2	23	41
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102160	GE	On-Demand	Anodyne	ABCB1	18	42
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102161	GE	On-Demand	Anodyne	ADRB2	23	41
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819102161	GE	On-Demand	Anodyne	ABCB1	18	42
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccc(F)cc3)C2=O)cc1	ZINC000819102168	FE	On-Demand	Anodyne	ADRB2	32	43
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccc(F)cc3)C2=O)cc1	ZINC000819102168	FE	On-Demand	Anodyne	ADRB1	41	40
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccc(F)cc3)C2=O)cc1	ZINC000819102168	FE	On-Demand	Anodyne	ADRB3	27	40
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccc(F)cc3)C2=O)cc1	ZINC000819102170	FE	On-Demand	Anodyne	ADRB2	32	43
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccc(F)cc3)C2=O)cc1	ZINC000819102170	FE	On-Demand	Anodyne	ADRB1	41	40
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccc(F)cc3)C2=O)cc1	ZINC000819102170	FE	On-Demand	Anodyne	ADRB3	27	40
O=C(NC1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1)C1CC1	ZINC000819102178	CD	On-Demand	Anodyne	EPHX2	17	41
O=C(NC1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1)C1CC1	ZINC000819102179	CD	On-Demand	Anodyne	EPHX2	17	41
O=C(NC1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1)C1CC1	ZINC000819102180	CD	On-Demand	Anodyne	EPHX2	17	41
O=C(NC1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1)C1CC1	ZINC000819102181	CD	On-Demand	Anodyne	EPHX2	17	41
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cc3ccccc3o2)c1	ZINC000819102189	FG	On-Demand	Anodyne	ADRB3	39	40
O=C(O)[C@H](CN1CCOCC1)NS(=O)(=O)CCC1CCCCC1	ZINC000819102190	EC	On-Demand	Anodyne	PGA5	42	33
O=C(O)[C@@H](CN1CCOCC1)NS(=O)(=O)CCC1CCCCC1	ZINC000819102191	EC	On-Demand	Anodyne	PGA5	42	33
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccccc3[N+](=O)[O-])C2=O)cc1	ZINC000819102194	GE	On-Demand	Bother	ADRB2	19	41
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccccc3[N+](=O)[O-])C2=O)cc1	ZINC000819102195	GE	On-Demand	Bother	ADRB2	19	41
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819102203	EF	On-Demand	Anodyne	ADRB2	42	39
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819102203	EF	On-Demand	Anodyne	ADRB1	40	41
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819102203	EF	On-Demand	Anodyne	ADRB3	40	41
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819102204	EF	On-Demand	Anodyne	ADRB2	42	39
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819102204	EF	On-Demand	Anodyne	ADRB1	40	41
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819102204	EF	On-Demand	Anodyne	ADRB3	40	41
Cc1ccc(N2CC[C@H](NC[C@@H](O)c3cccnc3)C2=O)cc1	ZINC000819102205	DD	On-Demand	Anodyne	ADRB2	15	42
Cc1ccc(N2CC[C@H](NC[C@@H](O)c3cccnc3)C2=O)cc1	ZINC000819102205	DD	On-Demand	Anodyne	ADRB1	18	42
Cc1ccc(N2CC[C@H](NC[C@@H](O)c3cccnc3)C2=O)cc1	ZINC000819102205	DD	On-Demand	Anodyne	ADRB3	72	47
Cc1ccc(N2CC[C@H](NC[C@H](O)c3cccnc3)C2=O)cc1	ZINC000819102207	DD	On-Demand	Anodyne	ADRB2	15	42
Cc1ccc(N2CC[C@H](NC[C@H](O)c3cccnc3)C2=O)cc1	ZINC000819102207	DD	On-Demand	Anodyne	ADRB1	18	42
Cc1ccc(N2CC[C@H](NC[C@H](O)c3cccnc3)C2=O)cc1	ZINC000819102207	DD	On-Demand	Anodyne	ADRB3	72	47
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819102209	DE	On-Demand	Anodyne	ADRB2	90	49
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819102209	DE	On-Demand	Anodyne	ADRB1	99	50
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819102209	DE	On-Demand	Anodyne	ADRB3	143	53
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819102210	DE	On-Demand	Anodyne	ADRB2	90	49
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819102210	DE	On-Demand	Anodyne	ADRB1	99	50
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819102210	DE	On-Demand	Anodyne	ADRB3	143	53
Cc1ccc(N2CC[C@H](NC[C@H](O)c3ccccc3)C2=O)cc1	ZINC000819102220	DE	On-Demand	Anodyne	ADRB3	37	40
Cc1ccc(N2CC[C@H](NC[C@H](O)c3ccccc3)C2=O)cc1	ZINC000819102220	DE	On-Demand	Anodyne	BIRC8	44	31
Cc1ccc(N2CC[C@H](NC[C@@H](O)c3ccccc3)C2=O)cc1	ZINC000819102221	DE	On-Demand	Anodyne	ADRB3	37	40
Cc1ccc(N2CC[C@H](NC[C@@H](O)c3ccccc3)C2=O)cc1	ZINC000819102221	DE	On-Demand	Anodyne	BIRC8	44	31
CC(=O)Nc1cccc(CC(=O)NCCNS(=O)(=O)Cc2ccccc2)c1	ZINC000819102222	GD	On-Demand	Anodyne	KCNK3	59	35
O=C(O)[C@H](CN1CCOCC1)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000819102225	FC	On-Demand	Anodyne	MMP13	27	55
O=C(O)[C@H](CN1CCOCC1)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000819102225	FC	On-Demand	Anodyne	MMP2	31	51
O=C(O)[C@H](CN1CCOCC1)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000819102225	FC	On-Demand	Anodyne	MMP3	16	47
O=C(O)[C@@H](CN1CCOCC1)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000819102226	FC	On-Demand	Anodyne	MMP13	27	55
O=C(O)[C@@H](CN1CCOCC1)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000819102226	FC	On-Demand	Anodyne	MMP2	31	51
O=C(O)[C@@H](CN1CCOCC1)NS(=O)(=O)c1ccc(C2CC2)cc1	ZINC000819102226	FC	On-Demand	Anodyne	MMP3	16	47
CC(C)n1ncc2cc(NC(=O)Cn3cc(C(=O)O)c4ccccc43)cnc21	ZINC000819102231	GG	On-Demand	Anodyne	CNR2	18	41
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819102262	EF	On-Demand	Anodyne	ADRB2	71	45
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819102262	EF	On-Demand	Anodyne	ADRB1	60	48
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819102262	EF	On-Demand	Anodyne	ADRB3	88	48
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819102263	EF	On-Demand	Anodyne	ADRB2	71	45
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819102263	EF	On-Demand	Anodyne	ADRB1	60	48
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819102263	EF	On-Demand	Anodyne	ADRB3	88	48
C[C@@H]1CCCC[C@H]1C(=O)NCCNS(=O)(=O)Cc1ccccc1	ZINC000819102407	EE	On-Demand	Anodyne	TMPRSS11D	94	35
C[C@@H]1CCCC[C@@H]1C(=O)NCCNS(=O)(=O)Cc1ccccc1	ZINC000819102410	EE	On-Demand	Anodyne	TMPRSS11D	94	35
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819102415	EF	On-Demand	Anodyne	ADRB2	47	41
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819102415	EF	On-Demand	Anodyne	ADRB1	45	43
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819102415	EF	On-Demand	Anodyne	ADRB3	39	43
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819102416	EF	On-Demand	Anodyne	ADRB2	47	41
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819102416	EF	On-Demand	Anodyne	ADRB1	45	43
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819102416	EF	On-Demand	Anodyne	ADRB3	39	43
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819102427	GH	On-Demand	Anodyne	SLC1A1	18	41
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819102427	GH	On-Demand	Anodyne	SLC1A2	30	41
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819102428	GH	On-Demand	Anodyne	SLC1A1	18	41
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819102428	GH	On-Demand	Anodyne	SLC1A2	30	41
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2ccccc2Cl)c1	ZINC000819102445	EG	On-Demand	Anodyne	ADRB2	32	40
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819102448	EE	On-Demand	Anodyne	ADRB2	81	45
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819102448	EE	On-Demand	Anodyne	ADRB1	71	43
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819102448	EE	On-Demand	Anodyne	ADRB3	96	45
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819102449	EE	On-Demand	Anodyne	ADRB2	81	45
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819102449	EE	On-Demand	Anodyne	ADRB1	71	43
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819102449	EE	On-Demand	Anodyne	ADRB3	96	45
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819102465	GG	On-Demand	Anodyne	ADRB2	53	38
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819102465	GG	On-Demand	Anodyne	ADRB1	52	41
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819102465	GG	On-Demand	Anodyne	ADRB3	50	44
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819102466	GG	On-Demand	Anodyne	ADRB2	53	38
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819102466	GG	On-Demand	Anodyne	ADRB1	52	41
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819102466	GG	On-Demand	Anodyne	ADRB3	50	44
Cc1ccc(N2CC[C@H](NC[C@H](O)c3cccc(C(F)(F)F)c3)C2=O)cc1	ZINC000819102489	GG	On-Demand	Anodyne	CCR2	41	38
Cc1ccc(N2CC[C@H](NC[C@@H](O)c3cccc(C(F)(F)F)c3)C2=O)cc1	ZINC000819102490	GG	On-Demand	Anodyne	CCR2	41	38
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819102491	GD	On-Demand	Anodyne	ADRB2	75	43
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819102491	GD	On-Demand	Anodyne	ADRB1	71	40
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819102491	GD	On-Demand	Anodyne	ADRB3	136	43
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819102492	GD	On-Demand	Anodyne	ADRB2	75	43
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819102492	GD	On-Demand	Anodyne	ADRB1	71	40
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819102492	GD	On-Demand	Anodyne	ADRB3	136	43
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819102494	ED	On-Demand	Anodyne	ADRB2	27	41
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819102494	ED	On-Demand	Anodyne	ADRB3	54	41
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819102495	ED	On-Demand	Anodyne	ADRB2	27	41
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819102495	ED	On-Demand	Anodyne	ADRB3	54	41
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819102549	FF	On-Demand	Bother	CACNA1D	46	32
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819102550	FF	On-Demand	Bother	CACNA1D	46	32
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819102557	EF	On-Demand	Anodyne	ADRB2	90	46
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819102557	EF	On-Demand	Anodyne	ADRB1	91	61
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819102557	EF	On-Demand	Anodyne	ADRB3	124	64
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819102558	EF	On-Demand	Anodyne	ADRB2	90	46
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819102558	EF	On-Demand	Anodyne	ADRB1	91	61
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819102558	EF	On-Demand	Anodyne	ADRB3	124	64
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819102601	DD	On-Demand	Anodyne	ADRB2	30	49
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819102601	DD	On-Demand	Anodyne	ADRB1	38	45
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819102601	DD	On-Demand	Anodyne	ADRB3	110	49
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819102601	DD	On-Demand	Anodyne	KCNA5	20	41
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819102602	DD	On-Demand	Anodyne	ADRB2	30	49
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819102602	DD	On-Demand	Anodyne	ADRB1	38	45
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819102602	DD	On-Demand	Anodyne	ADRB3	110	49
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819102602	DD	On-Demand	Anodyne	KCNA5	20	41
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819102615	EF	On-Demand	Anodyne	ADRB2	63	42
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819102615	EF	On-Demand	Anodyne	ADRB1	51	43
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819102615	EF	On-Demand	Anodyne	ADRB3	42	43
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819102616	EF	On-Demand	Anodyne	ADRB2	63	42
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819102616	EF	On-Demand	Anodyne	ADRB1	51	43
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819102616	EF	On-Demand	Anodyne	ADRB3	42	43
Cc1ccc2cc(S(=O)(=O)N[C@@H](CN3CCOCC3)C(=O)O)ccc2c1	ZINC000819102625	GD	On-Demand	Anodyne	F2	31	45
Cc1ccc2cc(S(=O)(=O)N[C@@H](CN3CCOCC3)C(=O)O)ccc2c1	ZINC000819102625	GD	On-Demand	Anodyne	MMP13	31	52
Cc1ccc2cc(S(=O)(=O)N[C@@H](CN3CCOCC3)C(=O)O)ccc2c1	ZINC000819102625	GD	On-Demand	Anodyne	TRY2_BOVIN	77	45
Cc1ccc2cc(S(=O)(=O)N[C@@H](CN3CCOCC3)C(=O)O)ccc2c1	ZINC000819102625	GD	On-Demand	Anodyne	MMP2	28	52
Cc1ccc2cc(S(=O)(=O)N[C@@H](CN3CCOCC3)C(=O)O)ccc2c1	ZINC000819102625	GD	On-Demand	Anodyne	MMP12	30	40
Cc1ccc2cc(S(=O)(=O)N[C@@H](CN3CCOCC3)C(=O)O)ccc2c1	ZINC000819102625	GD	On-Demand	Anodyne	ITGAV	45	37
Cc1ccc2cc(S(=O)(=O)N[C@H](CN3CCOCC3)C(=O)O)ccc2c1	ZINC000819102626	GD	On-Demand	Anodyne	F2	31	45
Cc1ccc2cc(S(=O)(=O)N[C@H](CN3CCOCC3)C(=O)O)ccc2c1	ZINC000819102626	GD	On-Demand	Anodyne	MMP13	31	52
Cc1ccc2cc(S(=O)(=O)N[C@H](CN3CCOCC3)C(=O)O)ccc2c1	ZINC000819102626	GD	On-Demand	Anodyne	TRY2_BOVIN	77	45
Cc1ccc2cc(S(=O)(=O)N[C@H](CN3CCOCC3)C(=O)O)ccc2c1	ZINC000819102626	GD	On-Demand	Anodyne	MMP2	28	52
Cc1ccc2cc(S(=O)(=O)N[C@H](CN3CCOCC3)C(=O)O)ccc2c1	ZINC000819102626	GD	On-Demand	Anodyne	MMP12	30	40
Cc1ccc2cc(S(=O)(=O)N[C@H](CN3CCOCC3)C(=O)O)ccc2c1	ZINC000819102626	GD	On-Demand	Anodyne	ITGAV	45	37
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCNC(=O)C2)c1	ZINC000819102627	GC	On-Demand	Anodyne	F13A1	41	37
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCNC(=O)C2)c1	ZINC000819102627	GC	On-Demand	Anodyne	AKR1C3	50	39
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCNC(=O)C2)c1	ZINC000819102628	GC	On-Demand	Anodyne	F13A1	41	37
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCNC(=O)C2)c1	ZINC000819102628	GC	On-Demand	Anodyne	AKR1C3	50	39
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCNC(=O)C2)c1	ZINC000819102629	GC	On-Demand	Anodyne	F13A1	41	37
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCNC(=O)C2)c1	ZINC000819102629	GC	On-Demand	Anodyne	AKR1C3	50	39
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCNC(=O)C2)c1	ZINC000819102630	GC	On-Demand	Anodyne	F13A1	41	37
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCNC(=O)C2)c1	ZINC000819102630	GC	On-Demand	Anodyne	AKR1C3	50	39
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819102643	EG	On-Demand	Anodyne	UL54	54	33
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C(C)(C)CN(C)C	ZINC000819102683	CF	On-Demand	Anodyne	ADRB2	18	49
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C(C)(C)CN(C)C	ZINC000819102683	CF	On-Demand	Anodyne	ADRB1	37	49
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C(C)(C)CN(C)C	ZINC000819102683	CF	On-Demand	Anodyne	ADRB3	53	49
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(C)(C)CN(C)C	ZINC000819102685	CF	On-Demand	Anodyne	ADRB2	18	49
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(C)(C)CN(C)C	ZINC000819102685	CF	On-Demand	Anodyne	ADRB1	37	49
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(C)(C)CN(C)C	ZINC000819102685	CF	On-Demand	Anodyne	ADRB3	53	49
NC(=O)CNC(=O)c1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819102694	DC	On-Demand	Anodyne	KCNK3	54	33
NC(=O)CNC(=O)c1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819102695	DC	On-Demand	Anodyne	KCNK3	54	33
NC(=O)CNC(=O)c1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819102696	DC	On-Demand	Anodyne	KCNK3	54	33
NC(=O)CNC(=O)c1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819102697	DC	On-Demand	Anodyne	KCNK3	54	33
O=C(/C=C\[C@@H]1CCCO1)NCCn1ccnc1	ZINC000819102700	BC	On-Demand	Anodyne	QPCT	15	40
O=C(/C=C\[C@H]1CCCO1)NCCn1ccnc1	ZINC000819102701	BC	On-Demand	Anodyne	QPCT	15	40
O=C(/C=C/[C@H]1CCCO1)NCCn1ccnc1	ZINC000819102702	BC	On-Demand	Anodyne	QPCT	15	40
O=C(/C=C/[C@@H]1CCCO1)NCCn1ccnc1	ZINC000819102703	BC	On-Demand	Anodyne	QPCT	15	40
CON(C)C(=O)CCNCc1cc(C(F)(F)F)ccc1N1CCN(C)CC1	ZINC000819102704	GD	On-Demand	Anodyne	LIPG	41	33
C[C@@H](NC[C@@H](O)c1ccccc1)C(C)(C)CN(C)C	ZINC000819102719	CE	On-Demand	Anodyne	ADRB2	21	40
C[C@@H](NC[C@@H](O)c1ccccc1)C(C)(C)CN(C)C	ZINC000819102719	CE	On-Demand	Anodyne	ADRB1	16	44
C[C@@H](NC[C@@H](O)c1ccccc1)C(C)(C)CN(C)C	ZINC000819102719	CE	On-Demand	Anodyne	ADRB3	31	44
C[C@@H](NC[C@@H](O)c1ccccc1)C(C)(C)CN(C)C	ZINC000819102719	CE	On-Demand	Anodyne	AOC3	20	44
C[C@H](NC[C@H](O)c1ccccc1)C(C)(C)CN(C)C	ZINC000819102720	CE	On-Demand	Anodyne	ADRB2	21	40
C[C@H](NC[C@H](O)c1ccccc1)C(C)(C)CN(C)C	ZINC000819102720	CE	On-Demand	Anodyne	ADRB1	16	44
C[C@H](NC[C@H](O)c1ccccc1)C(C)(C)CN(C)C	ZINC000819102720	CE	On-Demand	Anodyne	ADRB3	31	44
C[C@H](NC[C@H](O)c1ccccc1)C(C)(C)CN(C)C	ZINC000819102720	CE	On-Demand	Anodyne	AOC3	20	44
CN(C)C(=O)Nc1cccc(CNCCS(C)(=O)=O)c1	ZINC000819102737	CC	On-Demand	Anodyne	NOS1	22	41
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819102738	GH	On-Demand	Anodyne	CCR2	27	40
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819102739	GH	On-Demand	Anodyne	CCR2	27	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(C(=O)NCC(N)=O)c1)C2	ZINC000819102762	GC	On-Demand	Anodyne	CCR2	49	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(C(=O)NCC(N)=O)c1)C2	ZINC000819102763	GC	On-Demand	Anodyne	CCR2	49	34
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccc3ccccc23)c1	ZINC000819102770	FG	On-Demand	Anodyne	ADRB2	80	44
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccc3ccccc23)c1	ZINC000819102770	FG	On-Demand	Anodyne	ADRB1	63	43
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccc3ccccc23)c1	ZINC000819102770	FG	On-Demand	Anodyne	ADRB3	58	42
O=C(/C=C\[C@@H]1CCCO1)NCCNS(=O)(=O)Cc1ccccc1	ZINC000819102779	EC	On-Demand	Anodyne	TMPRSS11D	50	31
O=C(/C=C/[C@@H]1CCCO1)NCCNS(=O)(=O)Cc1ccccc1	ZINC000819102780	EC	On-Demand	Anodyne	TMPRSS11D	50	31
O=C(/C=C\[C@H]1CCCO1)NCCNS(=O)(=O)Cc1ccccc1	ZINC000819102781	EC	On-Demand	Anodyne	TMPRSS11D	50	31
O=C(/C=C/[C@H]1CCCO1)NCCNS(=O)(=O)Cc1ccccc1	ZINC000819102782	EC	On-Demand	Anodyne	TMPRSS11D	50	31
COC(=O)C1(NC(=O)CN2C(=O)S/C(=C/c3cccs3)C2=O)CCCCC1	ZINC000819102829	HF	On-Demand	Anodyne	AKR1B1	42	38
COC(=O)C1(NC(=O)CN2C(=O)S/C(=C\c3cccs3)C2=O)CCCCC1	ZINC000819102830	HF	On-Demand	Anodyne	AKR1B1	42	38
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)NCCCC(N)=O)nn2)C1	ZINC000819102845	GC	On-Demand	Anodyne	SSTR2	41	33
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)NCCCC(N)=O)nn2)C1	ZINC000819102845	GC	On-Demand	Anodyne	PREP	17	41
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)NCCCC(N)=O)nn2)C1	ZINC000819102846	GC	On-Demand	Anodyne	SSTR2	41	33
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)NCCCC(N)=O)nn2)C1	ZINC000819102846	GC	On-Demand	Anodyne	PREP	17	41
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819102907	GH	On-Demand	Anodyne	ADRB3	34	41
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819102908	GH	On-Demand	Anodyne	ADRB3	34	41
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819102910	EG	On-Demand	Anodyne	ADRB1	47	46
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819102910	EG	On-Demand	Anodyne	ADRB3	60	46
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819102911	EG	On-Demand	Anodyne	ADRB1	47	46
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819102911	EG	On-Demand	Anodyne	ADRB3	60	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1(N3CCSCC3)CCCC1)C2	ZINC000819102913	GE	On-Demand	Anodyne	HCN1	42	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1(N3CCSCC3)CCCC1)C2	ZINC000819102913	GE	On-Demand	Anodyne	HCN4	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1(N3CCSCC3)CCCC1)C2	ZINC000819102914	GE	On-Demand	Anodyne	HCN1	42	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1(N3CCSCC3)CCCC1)C2	ZINC000819102914	GE	On-Demand	Anodyne	HCN4	40	31
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819102915	GG	On-Demand	Anodyne	ADRB2	60	40
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819102915	GG	On-Demand	Anodyne	ADRB1	51	39
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819102915	GG	On-Demand	Anodyne	ADRB3	44	42
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccccc2Br)c1	ZINC000819102916	GG	On-Demand	Anodyne	ADRB2	60	40
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccccc2Br)c1	ZINC000819102916	GG	On-Demand	Anodyne	ADRB1	51	39
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccccc2Br)c1	ZINC000819102916	GG	On-Demand	Anodyne	ADRB3	44	42
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819102926	GG	On-Demand	Anodyne	ADRB2	66	43
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819102926	GG	On-Demand	Anodyne	ADRB1	57	42
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819102926	GG	On-Demand	Anodyne	ADRB3	74	45
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819102927	GG	On-Demand	Anodyne	ADRB2	66	43
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819102927	GG	On-Demand	Anodyne	ADRB1	57	42
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819102927	GG	On-Demand	Anodyne	ADRB3	74	45
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819102951	FE	On-Demand	Bother	ADRB2	47	41
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819102951	FE	On-Demand	Bother	ADRB1	53	43
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819102951	FE	On-Demand	Bother	ADRB3	83	46
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819102951	FE	On-Demand	Bother	CACNA1D	48	33
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819102952	FE	On-Demand	Bother	ADRB2	47	41
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819102952	FE	On-Demand	Bother	ADRB1	53	43
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819102952	FE	On-Demand	Bother	ADRB3	83	46
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819102952	FE	On-Demand	Bother	CACNA1D	48	33
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819102960	EF	On-Demand	Anodyne	ADRB2	80	45
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819102960	EF	On-Demand	Anodyne	ADRB1	77	48
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819102960	EF	On-Demand	Anodyne	ADRB3	98	52
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819102960	EF	On-Demand	Anodyne	UL54	71	35
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819102960	EF	On-Demand	Anodyne	UTS2	42	32
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc(C(=O)N(C)C)c1	ZINC000819102961	EF	On-Demand	Anodyne	ADRB2	55	42
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc(C(=O)N(C)C)c1	ZINC000819102961	EF	On-Demand	Anodyne	ADRB1	45	40
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc(C(=O)N(C)C)c1	ZINC000819102961	EF	On-Demand	Anodyne	ADRB3	35	40
O=C(NCCn1ccnc1)C(F)=C1CCC1	ZINC000819102963	BD	On-Demand	Anodyne	TBXAS1	47	41
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819102964	EF	On-Demand	Anodyne	ADRB2	66	42
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819102964	EF	On-Demand	Anodyne	ADRB1	60	44
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819102964	EF	On-Demand	Anodyne	ADRB3	50	46
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819102982	DF	On-Demand	Anodyne	ADRB2	43	37
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819102982	DF	On-Demand	Anodyne	ADRB1	44	36
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819102982	DF	On-Demand	Anodyne	ADRB3	65	38
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819102982	DF	On-Demand	Anodyne	NPY5R	33	42
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819102984	DF	On-Demand	Anodyne	ADRB2	43	37
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819102984	DF	On-Demand	Anodyne	ADRB1	44	36
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819102984	DF	On-Demand	Anodyne	ADRB3	65	38
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819102984	DF	On-Demand	Anodyne	NPY5R	33	42
NC(=O)CNC(=O)c1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819102997	DD	On-Demand	Anodyne	KCNK3	82	35
NC(=O)CNC(=O)c1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819102997	DD	On-Demand	Anodyne	KCNK9	44	35
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(Oc2ccccc2)c1	ZINC000819103003	DH	On-Demand	Anodyne	AMP1_PLAFQ	23	42
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(Oc2ccccc2)c1	ZINC000819103003	DH	On-Demand	Anodyne	CRTM	51	44
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(Oc2ccccc2)c1	ZINC000819103004	DH	On-Demand	Anodyne	AMP1_PLAFQ	23	42
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(Oc2ccccc2)c1	ZINC000819103004	DH	On-Demand	Anodyne	CRTM	51	44
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(Oc2ccccc2)c1	ZINC000819103005	DH	On-Demand	Anodyne	AMP1_PLAFQ	23	42
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(Oc2ccccc2)c1	ZINC000819103005	DH	On-Demand	Anodyne	CRTM	51	44
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(Oc2ccccc2)c1	ZINC000819103006	DH	On-Demand	Anodyne	AMP1_PLAFQ	23	42
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(Oc2ccccc2)c1	ZINC000819103006	DH	On-Demand	Anodyne	CRTM	51	44
COc1ccc2[nH]cc(C3=CCN(C(=O)C(F)=C4CCC4)CC3)c2c1	ZINC000819103038	EI	On-Demand	Anodyne	HTR1A	15	50
COc1ccc2[nH]cc(C3=CCN(C(=O)C(F)=C4CCC4)CC3)c2c1	ZINC000819103038	EI	On-Demand	Anodyne	HTR1D	20	50
COc1ccc2[nH]cc(C3=CCN(C(=O)C(F)=C4CCC4)CC3)c2c1	ZINC000819103038	EI	On-Demand	Anodyne	HTR1B	16	50
COc1ccc2[nH]cc(C3=CCN(C(=O)C(F)=C4CCC4)CC3)c2c1	ZINC000819103038	EI	On-Demand	Anodyne	SLC6A4	16	63
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)Cc1cccs1	ZINC000819103043	DH	On-Demand	Anodyne	ADRB2	28	41
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)Cc1cccs1	ZINC000819103043	DH	On-Demand	Anodyne	ADRB1	41	43
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)Cc1cccs1	ZINC000819103043	DH	On-Demand	Anodyne	ADRB3	60	43
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)Cc1cccs1	ZINC000819103044	DH	On-Demand	Anodyne	ADRB2	28	41
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)Cc1cccs1	ZINC000819103044	DH	On-Demand	Anodyne	ADRB1	41	43
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)Cc1cccs1	ZINC000819103044	DH	On-Demand	Anodyne	ADRB3	60	43
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)Cc1cccs1	ZINC000819103045	DH	On-Demand	Anodyne	ADRB2	28	41
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)Cc1cccs1	ZINC000819103045	DH	On-Demand	Anodyne	ADRB1	41	43
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)Cc1cccs1	ZINC000819103045	DH	On-Demand	Anodyne	ADRB3	60	43
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)Cc1cccs1	ZINC000819103046	DH	On-Demand	Anodyne	ADRB2	28	41
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)Cc1cccs1	ZINC000819103046	DH	On-Demand	Anodyne	ADRB1	41	43
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)Cc1cccs1	ZINC000819103046	DH	On-Demand	Anodyne	ADRB3	60	43
C[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Cc1cccs1	ZINC000819103074	GH	On-Demand	Anodyne	GPR119	40	46
C[C@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Cc1cccs1	ZINC000819103075	GH	On-Demand	Anodyne	GPR119	40	46
C[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Cc1cccs1	ZINC000819103076	GH	On-Demand	Anodyne	GPR119	40	46
C[C@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Cc1cccs1	ZINC000819103077	GH	On-Demand	Anodyne	GPR119	40	46
O=C(NCc1cccc(COCc2ccccc2)c1)C(F)=C1CCC1	ZINC000819103078	EI	On-Demand	Anodyne	PDS	53	35
O=C(NCc1ccc(COCc2ccccc2)cc1)C(F)=C1CCC1	ZINC000819103085	EI	On-Demand	Anodyne	PDS	51	35
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819103091	DD	On-Demand	Anodyne	ADRB2	69	66
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819103091	DD	On-Demand	Anodyne	ADRB1	81	57
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819103091	DD	On-Demand	Anodyne	ADRB3	166	66
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819103091	DD	On-Demand	Anodyne	KCNA5	21	45
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819103092	DD	On-Demand	Anodyne	ADRB2	69	66
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819103092	DD	On-Demand	Anodyne	ADRB1	81	57
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819103092	DD	On-Demand	Anodyne	ADRB3	166	66
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819103092	DD	On-Demand	Anodyne	KCNA5	21	45
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3cccc4[nH]ccc34)C2=O)cc1	ZINC000819103118	GF	On-Demand	Anodyne	ADRB2	22	60
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3cccc4[nH]ccc34)C2=O)cc1	ZINC000819103118	GF	On-Demand	Anodyne	ADRB1	26	60
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3cccc4[nH]ccc34)C2=O)cc1	ZINC000819103118	GF	On-Demand	Anodyne	HTR1A	17	60
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3cccc4[nH]ccc34)C2=O)cc1	ZINC000819103118	GF	On-Demand	Anodyne	SLC6A4	21	45
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3cccc4[nH]ccc34)C2=O)cc1	ZINC000819103118	GF	On-Demand	Anodyne	ADRB3	15	52
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3cccc4[nH]ccc34)C2=O)cc1	ZINC000819103119	GF	On-Demand	Anodyne	ADRB2	22	60
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3cccc4[nH]ccc34)C2=O)cc1	ZINC000819103119	GF	On-Demand	Anodyne	ADRB1	26	60
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3cccc4[nH]ccc34)C2=O)cc1	ZINC000819103119	GF	On-Demand	Anodyne	HTR1A	17	60
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3cccc4[nH]ccc34)C2=O)cc1	ZINC000819103119	GF	On-Demand	Anodyne	SLC6A4	21	45
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3cccc4[nH]ccc34)C2=O)cc1	ZINC000819103119	GF	On-Demand	Anodyne	ADRB3	15	52
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccnc1Oc1ccccc1)C2	ZINC000819103153	GH	On-Demand	Anodyne	P2RY1	46	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccnc1Oc1ccccc1)C2	ZINC000819103154	GH	On-Demand	Anodyne	P2RY1	46	39
Cc1ccc(N2CC[C@H](NC[C@@H](O)CCc3ccccc3)C2=O)cc1	ZINC000819103171	EF	On-Demand	Anodyne	ACE	49	38
Cc1ccc(N2CC[C@H](NC[C@H](O)CCc3ccccc3)C2=O)cc1	ZINC000819103172	EF	On-Demand	Anodyne	ACE	49	38
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819103185	GG	On-Demand	Anodyne	ADRB2	68	44
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819103185	GG	On-Demand	Anodyne	ADRB1	66	46
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819103185	GG	On-Demand	Anodyne	ADRB3	95	48
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819103186	GG	On-Demand	Anodyne	ADRB2	68	44
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819103186	GG	On-Demand	Anodyne	ADRB1	66	46
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819103186	GG	On-Demand	Anodyne	ADRB3	95	48
Cn1cnc(S(=O)(=O)N2CCC(Oc3ccc(C(=O)O)cc3)CC2)c1Cl	ZINC000819103251	GE	On-Demand	Anodyne	HRH1	30	44
Cn1cnc(S(=O)(=O)N2CCC(Oc3ccc(C(=O)O)cc3)CC2)c1Cl	ZINC000819103251	GE	On-Demand	Anodyne	PRSS2	60	34
Cn1cnc(S(=O)(=O)N2CCC(Oc3ccc(C(=O)O)cc3)CC2)c1Cl	ZINC000819103251	GE	On-Demand	Anodyne	CCR3	32	45
Cn1cnc(S(=O)(=O)N2CCC(Oc3ccc(C(=O)O)cc3)CC2)c1Cl	ZINC000819103251	GE	On-Demand	Anodyne	EPHX2	18	42
C[C@H](NC[C@H](O)c1cccnc1)C(C)(C)CN(C)C	ZINC000819103306	CD	On-Demand	Anodyne	ADRB2	24	42
C[C@H](NC[C@H](O)c1cccnc1)C(C)(C)CN(C)C	ZINC000819103306	CD	On-Demand	Anodyne	ADRB1	25	49
C[C@H](NC[C@H](O)c1cccnc1)C(C)(C)CN(C)C	ZINC000819103306	CD	On-Demand	Anodyne	ADRB3	80	49
C[C@@H](NC[C@@H](O)c1cccnc1)C(C)(C)CN(C)C	ZINC000819103308	CD	On-Demand	Anodyne	ADRB2	24	42
C[C@@H](NC[C@@H](O)c1cccnc1)C(C)(C)CN(C)C	ZINC000819103308	CD	On-Demand	Anodyne	ADRB1	25	49
C[C@@H](NC[C@@H](O)c1cccnc1)C(C)(C)CN(C)C	ZINC000819103308	CD	On-Demand	Anodyne	ADRB3	80	49
O=C(O)[C@@H](CN1CCOCC1)NS(=O)(=O)c1cccc2ccoc12	ZINC000819103317	FC	On-Demand	Anodyne	ITGAV	40	37
O=C(O)[C@H](CN1CCOCC1)NS(=O)(=O)c1cccc2ccoc12	ZINC000819103318	FC	On-Demand	Anodyne	ITGAV	40	37
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819103333	EF	On-Demand	Anodyne	ADRB1	25	41
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819103333	EF	On-Demand	Anodyne	ADRB3	33	41
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819103334	EF	On-Demand	Anodyne	ADRB1	25	41
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819103334	EF	On-Demand	Anodyne	ADRB3	33	41
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C(C)(C)CN(C)C	ZINC000819103359	FF	On-Demand	Anodyne	GPR119	33	43
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C(C)(C)CN(C)C	ZINC000819103360	FF	On-Demand	Anodyne	GPR119	33	43
COc1ccc(OC)c([C@H](O)CNCCc2cccc(C(=O)N(C)C)c2)c1	ZINC000819103372	FE	On-Demand	Anodyne	ADRB2	67	48
COc1ccc(OC)c([C@H](O)CNCCc2cccc(C(=O)N(C)C)c2)c1	ZINC000819103372	FE	On-Demand	Anodyne	ADRB1	65	49
COc1ccc(OC)c([C@H](O)CNCCc2cccc(C(=O)N(C)C)c2)c1	ZINC000819103372	FE	On-Demand	Anodyne	ADRB3	51	49
COc1ccc(OC)c([C@H](O)CNCCc2cccc(C(=O)N(C)C)c2)c1	ZINC000819103372	FE	On-Demand	Anodyne	MTNR1A	59	45
COc1ccc(OC)c([C@H](O)CNCCc2cccc(C(=O)N(C)C)c2)c1	ZINC000819103372	FE	On-Demand	Anodyne	MTNR1B	57	39
O=C(O)c1ccc(OC2CCN(S(=O)(=O)/C=C/c3ccccc3)CC2)cc1	ZINC000819103391	GG	On-Demand	Anodyne	PRSS2	57	32
O=C(O)c1ccc(OC2CCN(S(=O)(=O)/C=C/c3ccccc3)CC2)cc1	ZINC000819103391	GG	On-Demand	Anodyne	EPHX2	18	47
O=C(O)c1ccc(OC2CCN(S(=O)(=O)/C=C\c3ccccc3)CC2)cc1	ZINC000819103394	GG	On-Demand	Anodyne	PRSS2	57	32
O=C(O)c1ccc(OC2CCN(S(=O)(=O)/C=C\c3ccccc3)CC2)cc1	ZINC000819103394	GG	On-Demand	Anodyne	EPHX2	18	47
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103399	GE	On-Demand	Anodyne	ADRB2	32	49
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103399	GE	On-Demand	Anodyne	ADRB1	64	49
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103399	GE	On-Demand	Anodyne	TSHR	40	30
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103399	GE	On-Demand	Anodyne	ADRB3	41	43
O=C(O)c1ccc(N2CCC(NS(=O)(=O)CC[C@H]3CCOC3)CC2)nc1	ZINC000819103410	GD	On-Demand	Anodyne	SFRP1	17	42
O=C(O)c1ccc(N2CCC(NS(=O)(=O)CC[C@H]3CCOC3)CC2)nc1	ZINC000819103410	GD	On-Demand	Anodyne	HPGDS	28	46
O=C(O)c1ccc(N2CCC(NS(=O)(=O)CC[C@@H]3CCOC3)CC2)nc1	ZINC000819103411	GD	On-Demand	Anodyne	SFRP1	17	42
O=C(O)c1ccc(N2CCC(NS(=O)(=O)CC[C@@H]3CCOC3)CC2)nc1	ZINC000819103411	GD	On-Demand	Anodyne	HPGDS	28	46
O=C(O)c1ccc(OC2CCN(S(=O)(=O)C[C@@H]3CCOC3)CC2)cc1	ZINC000819103427	FD	On-Demand	Anodyne	HRH1	18	41
O=C(O)c1ccc(OC2CCN(S(=O)(=O)C[C@@H]3CCOC3)CC2)cc1	ZINC000819103427	FD	On-Demand	Anodyne	PRSS2	59	33
O=C(O)c1ccc(OC2CCN(S(=O)(=O)C[C@@H]3CCOC3)CC2)cc1	ZINC000819103427	FD	On-Demand	Anodyne	CCR3	20	42
O=C(O)c1ccc(OC2CCN(S(=O)(=O)C[C@H]3CCOC3)CC2)cc1	ZINC000819103428	FD	On-Demand	Anodyne	HRH1	18	41
O=C(O)c1ccc(OC2CCN(S(=O)(=O)C[C@H]3CCOC3)CC2)cc1	ZINC000819103428	FD	On-Demand	Anodyne	PRSS2	59	33
O=C(O)c1ccc(OC2CCN(S(=O)(=O)C[C@H]3CCOC3)CC2)cc1	ZINC000819103428	FD	On-Demand	Anodyne	CCR3	20	42
CC(=O)Nc1ccccc1CNC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819103430	GF	On-Demand	Anodyne	GPR119	23	40
CC(=O)Nc1ccccc1CNC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819103431	GF	On-Demand	Anodyne	GPR119	23	40
CC(=O)N1CCN(CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819103449	GC	On-Demand	Mild	PAPA1_CARPA	44	52
CC(=O)N1CCN(CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819103450	GC	On-Demand	Mild	PAPA1_CARPA	44	52
COc1ccc2[nH]cc(C3=CCN(C(=O)/C=C/[C@H]4CCCO4)CC3)c2c1	ZINC000819103457	FH	On-Demand	Anodyne	HTR1D	22	52
COc1ccc2[nH]cc(C3=CCN(C(=O)/C=C/[C@H]4CCCO4)CC3)c2c1	ZINC000819103457	FH	On-Demand	Anodyne	HTR1B	19	45
COc1ccc2[nH]cc(C3=CCN(C(=O)/C=C/[C@H]4CCCO4)CC3)c2c1	ZINC000819103457	FH	On-Demand	Anodyne	SLC6A4	15	55
COc1ccc2[nH]cc(C3=CCN(C(=O)/C=C\[C@H]4CCCO4)CC3)c2c1	ZINC000819103458	FH	On-Demand	Anodyne	HTR1D	22	52
COc1ccc2[nH]cc(C3=CCN(C(=O)/C=C\[C@H]4CCCO4)CC3)c2c1	ZINC000819103458	FH	On-Demand	Anodyne	HTR1B	19	45
COc1ccc2[nH]cc(C3=CCN(C(=O)/C=C\[C@H]4CCCO4)CC3)c2c1	ZINC000819103458	FH	On-Demand	Anodyne	SLC6A4	15	55
COc1ccc2[nH]cc(C3=CCN(C(=O)/C=C\[C@@H]4CCCO4)CC3)c2c1	ZINC000819103459	FH	On-Demand	Anodyne	HTR1D	22	52
COc1ccc2[nH]cc(C3=CCN(C(=O)/C=C\[C@@H]4CCCO4)CC3)c2c1	ZINC000819103459	FH	On-Demand	Anodyne	HTR1B	19	45
COc1ccc2[nH]cc(C3=CCN(C(=O)/C=C\[C@@H]4CCCO4)CC3)c2c1	ZINC000819103459	FH	On-Demand	Anodyne	SLC6A4	15	55
COc1ccc2[nH]cc(C3=CCN(C(=O)/C=C/[C@@H]4CCCO4)CC3)c2c1	ZINC000819103460	FH	On-Demand	Anodyne	HTR1D	22	52
COc1ccc2[nH]cc(C3=CCN(C(=O)/C=C/[C@@H]4CCCO4)CC3)c2c1	ZINC000819103460	FH	On-Demand	Anodyne	HTR1B	19	45
COc1ccc2[nH]cc(C3=CCN(C(=O)/C=C/[C@@H]4CCCO4)CC3)c2c1	ZINC000819103460	FH	On-Demand	Anodyne	SLC6A4	15	55
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103489	GE	On-Demand	Anodyne	ADRB2	32	49
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103489	GE	On-Demand	Anodyne	ADRB1	64	49
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103489	GE	On-Demand	Anodyne	TSHR	40	30
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103489	GE	On-Demand	Anodyne	ADRB3	41	43
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103493	GE	On-Demand	Anodyne	ADRB2	32	49
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103493	GE	On-Demand	Anodyne	ADRB1	64	49
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103493	GE	On-Demand	Anodyne	TSHR	40	30
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103493	GE	On-Demand	Anodyne	ADRB3	41	43
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103496	GE	On-Demand	Anodyne	ADRB2	32	49
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103496	GE	On-Demand	Anodyne	ADRB1	64	49
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103496	GE	On-Demand	Anodyne	TSHR	40	30
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103496	GE	On-Demand	Anodyne	ADRB3	41	43
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819103499	EE	On-Demand	Mild	ADRB2	64	43
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819103499	EE	On-Demand	Mild	ADRB1	59	42
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819103499	EE	On-Demand	Mild	ADRB3	69	45
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819103504	EE	On-Demand	Mild	ADRB2	64	43
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819103504	EE	On-Demand	Mild	ADRB1	59	42
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819103504	EE	On-Demand	Mild	ADRB3	69	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(-n2cccn2)c1	ZINC000819103516	EF	On-Demand	Anodyne	AMP1_PLAFQ	26	45
O=C(NCC1(N2CCSCC2)CCCC1)C(F)=C1CCC1	ZINC000819103525	DF	On-Demand	Anodyne	HCN1	53	32
O=C(NCC1(N2CCSCC2)CCCC1)C(F)=C1CCC1	ZINC000819103525	DF	On-Demand	Anodyne	HCN4	51	32
C[C@@H](CC(=O)NCCNS(=O)(=O)Cc1ccccc1)n1cccn1	ZINC000819103539	FD	On-Demand	Anodyne	TMPRSS11D	40	34
C[C@H](CC(=O)NCCNS(=O)(=O)Cc1ccccc1)n1cccn1	ZINC000819103542	FD	On-Demand	Anodyne	TMPRSS11D	40	34
Cc1nn(-c2ccc(C(=O)Nc3c(C)nn(-c4ccccc4)c3C)cc2)c(C)c1CCC(=O)O	ZINC000819103552	JJ	On-Demand	Anodyne	P2RX7	15	48
Cc1nn(-c2ccc(C(=O)Nc3c(C)nn(-c4ccccc4)c3C)cc2)c(C)c1CCC(=O)O	ZINC000819103552	JJ	On-Demand	Anodyne	PRNP	40	34
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819103577	FF	On-Demand	Bother	MMP8	16	41
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819103581	FF	On-Demand	Bother	MMP8	16	41
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819103601	FG	On-Demand	Anodyne	ADRB2	69	43
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819103601	FG	On-Demand	Anodyne	ADRB1	58	48
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819103601	FG	On-Demand	Anodyne	ADRB3	71	48
C[C@H](CNCCC(=O)Nc1ccc(N(C)C)cc1)Cc1cccs1	ZINC000819103603	EH	On-Demand	Anodyne	CA5B	28	42
C[C@H](CNCCC(=O)Nc1ccc(N(C)C)cc1)Cc1cccs1	ZINC000819103603	EH	On-Demand	Anodyne	CA5A	28	42
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819103604	FG	On-Demand	Anodyne	ADRB2	69	43
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819103604	FG	On-Demand	Anodyne	ADRB1	58	48
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819103604	FG	On-Demand	Anodyne	ADRB3	71	48
C[C@@H](CNCCC(=O)Nc1ccc(N(C)C)cc1)Cc1cccs1	ZINC000819103605	EH	On-Demand	Anodyne	CA5B	28	42
C[C@@H](CNCCC(=O)Nc1ccc(N(C)C)cc1)Cc1cccs1	ZINC000819103605	EH	On-Demand	Anodyne	CA5A	28	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc3ccccc3n1)C2	ZINC000819103607	FF	On-Demand	Anodyne	ALOX5AP	51	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc3ccccc3n1)C2	ZINC000819103609	FF	On-Demand	Anodyne	ALOX5AP	51	38
O=C(O)c1ccc(OC2CCN(S(=O)(=O)c3ccc(Cl)nc3)CC2)cc1	ZINC000819103617	GF	On-Demand	Anodyne	HRH1	36	45
O=C(O)c1ccc(OC2CCN(S(=O)(=O)c3ccc(Cl)nc3)CC2)cc1	ZINC000819103617	GF	On-Demand	Anodyne	CCR3	37	46
O=C(O)c1ccc(OC2CCN(S(=O)(=O)c3ccc(Cl)nc3)CC2)cc1	ZINC000819103617	GF	On-Demand	Anodyne	EPHX2	20	44
O=C(O)c1ccc(OC2CCN(S(=O)(=O)c3ccc(Cl)nc3)CC2)cc1	ZINC000819103617	GF	On-Demand	Anodyne	TGM2	61	40
O=C(O)c1ccc(OC2CCN(S(=O)(=O)c3ccc(Cl)nc3)CC2)cc1	ZINC000819103617	GF	On-Demand	Anodyne	GCK	57	33
O=C(O)c1ccc(OC2CCN(S(=O)(=O)c3ccc(Cl)nc3)CC2)cc1	ZINC000819103617	GF	On-Demand	Anodyne	F13A1	48	34
O=C(O)c1ccc(OC2CCN(S(=O)(=O)c3ccc(Cl)nc3)CC2)cc1	ZINC000819103617	GF	On-Demand	Anodyne	GCKR	73	32
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819103627	GG	On-Demand	Anodyne	ADRB2	73	45
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819103627	GG	On-Demand	Anodyne	ADRB1	63	42
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819103627	GG	On-Demand	Anodyne	ADRB3	82	45
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819103628	GG	On-Demand	Anodyne	ADRB2	73	45
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819103628	GG	On-Demand	Anodyne	ADRB1	63	42
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819103628	GG	On-Demand	Anodyne	ADRB3	82	45
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819103648	EE	On-Demand	Anodyne	ADRB2	67	44
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819103648	EE	On-Demand	Anodyne	ADRB1	66	51
CN(C)C(=O)c1cccc(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819103648	EE	On-Demand	Anodyne	ADRB3	105	51
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819103650	EE	On-Demand	Anodyne	ADRB2	67	44
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819103650	EE	On-Demand	Anodyne	ADRB1	66	51
CN(C)C(=O)c1cccc(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819103650	EE	On-Demand	Anodyne	ADRB3	105	51
CN(C)C(=O)Nc1cccc(CNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819103661	FG	On-Demand	Anodyne	ADRB2	27	40
CN(C)C(=O)Nc1cccc(CNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819103663	FG	On-Demand	Anodyne	ADRB2	27	40
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)c1	ZINC000819103683	GE	On-Demand	Anodyne	ADRB2	23	41
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)c1	ZINC000819103683	GE	On-Demand	Anodyne	ABCB1	27	46
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)c1	ZINC000819103684	GE	On-Demand	Anodyne	ADRB2	23	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)c1	ZINC000819103684	GE	On-Demand	Anodyne	ABCB1	27	46
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)c1	ZINC000819103685	GE	On-Demand	Anodyne	ADRB2	23	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)c1	ZINC000819103685	GE	On-Demand	Anodyne	ABCB1	27	46
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)c1	ZINC000819103686	GE	On-Demand	Anodyne	ADRB2	23	41
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)c1	ZINC000819103686	GE	On-Demand	Anodyne	ABCB1	27	46
COCCCN(C)CCNC[C@H](O)c1cccc(F)c1	ZINC000819103697	CD	On-Demand	Anodyne	ADRB1	29	41
COCCCN(C)CCNC[C@H](O)c1cccc(F)c1	ZINC000819103697	CD	On-Demand	Anodyne	ADRB3	33	41
COCCCN(C)CCNC[C@@H](O)c1cccc(F)c1	ZINC000819103698	CD	On-Demand	Anodyne	ADRB1	29	41
COCCCN(C)CCNC[C@@H](O)c1cccc(F)c1	ZINC000819103698	CD	On-Demand	Anodyne	ADRB3	33	41
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103707	GF	On-Demand	Anodyne	CELA1	17	41
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103707	GF	On-Demand	Anodyne	CTSD	104	45
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103707	GF	On-Demand	Anodyne	PGC	67	38
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103707	GF	On-Demand	Anodyne	CMA1	33	43
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103707	GF	On-Demand	Anodyne	CTRA_BOVIN	41	31
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103707	GF	On-Demand	Anodyne	PAPA1_CARPA	28	40
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103707	GF	On-Demand	Anodyne	CCKAR	23	42
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103707	GF	On-Demand	Anodyne	CTSL	15	40
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103707	GF	On-Demand	Anodyne	BACE2	62	43
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103707	GF	On-Demand	Anodyne	CELA2A	48	31
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103707	GF	On-Demand	Anodyne	REN	97	48
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103707	GF	On-Demand	Anodyne	REN1	34	43
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103707	GF	On-Demand	Anodyne	BACE1	91	45
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103707	GF	On-Demand	Anodyne	FPR1	49	39
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103707	GF	On-Demand	Anodyne	Q82323_9DELA	73	32
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103708	GF	On-Demand	Anodyne	CELA1	17	41
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103708	GF	On-Demand	Anodyne	CTSD	104	45
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103708	GF	On-Demand	Anodyne	PGC	67	38
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103708	GF	On-Demand	Anodyne	CMA1	33	43
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103708	GF	On-Demand	Anodyne	CTRA_BOVIN	41	31
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103708	GF	On-Demand	Anodyne	PAPA1_CARPA	28	40
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103708	GF	On-Demand	Anodyne	CCKAR	23	42
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103708	GF	On-Demand	Anodyne	CTSL	15	40
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103708	GF	On-Demand	Anodyne	BACE2	62	43
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103708	GF	On-Demand	Anodyne	CELA2A	48	31
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103708	GF	On-Demand	Anodyne	REN	97	48
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103708	GF	On-Demand	Anodyne	REN1	34	43
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103708	GF	On-Demand	Anodyne	BACE1	91	45
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103708	GF	On-Demand	Anodyne	FPR1	49	39
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCN1C	ZINC000819103708	GF	On-Demand	Anodyne	Q82323_9DELA	73	32
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccccc3Cl)C2=O)cc1	ZINC000819103733	FF	On-Demand	Anodyne	ADRB2	29	45
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccccc3Cl)C2=O)cc1	ZINC000819103733	FF	On-Demand	Anodyne	ADRB1	23	43
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccccc3Cl)C2=O)cc1	ZINC000819103733	FF	On-Demand	Anodyne	ADRB3	15	42
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccccc3Cl)C2=O)cc1	ZINC000819103736	FF	On-Demand	Anodyne	ADRB2	29	45
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccccc3Cl)C2=O)cc1	ZINC000819103736	FF	On-Demand	Anodyne	ADRB1	23	43
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccccc3Cl)C2=O)cc1	ZINC000819103736	FF	On-Demand	Anodyne	ADRB3	15	42
C[C@@H]1C[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCN1C	ZINC000819103737	FE	On-Demand	Anodyne	GPR119	28	42
C[C@@H]1C[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCN1C	ZINC000819103739	FE	On-Demand	Anodyne	GPR119	28	42
O=C(CCc1cccc(OC(F)F)c1)NCC(=O)NCc1ccccc1	ZINC000819103753	FF	On-Demand	Anodyne	PLA2G4A	28	44
O=C(CCc1cccc(OC(F)F)c1)NCC(=O)NCc1ccccc1	ZINC000819103753	FF	On-Demand	Anodyne	AMP1_PLAFQ	31	41
O=C(CCc1cccc(OC(F)F)c1)NCC(=O)NCc1ccccc1	ZINC000819103753	FF	On-Demand	Anodyne	FFAR1	20	40
O=C(CCc1cccc(OC(F)F)c1)NCC(=O)NCc1ccccc1	ZINC000819103753	FF	On-Demand	Anodyne	CRTM	53	41
O=C(CCc1cccc(OC(F)F)c1)NCC(=O)NCc1ccccc1	ZINC000819103753	FF	On-Demand	Anodyne	PDS	70	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(NC(=O)C2CC2)CC1	ZINC000819103756	FD	On-Demand	Anodyne	EPHX2	24	44
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103761	FE	On-Demand	Anodyne	ADRB2	36	47
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103761	FE	On-Demand	Anodyne	ADRB1	44	39
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103761	FE	On-Demand	Anodyne	ADRB3	28	42
Cc1ccc(OC[C@@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103762	FE	On-Demand	Anodyne	ADRB2	36	47
Cc1ccc(OC[C@@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103762	FE	On-Demand	Anodyne	ADRB1	44	39
Cc1ccc(OC[C@@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103762	FE	On-Demand	Anodyne	ADRB3	28	42
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103763	FE	On-Demand	Anodyne	ADRB2	36	47
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103763	FE	On-Demand	Anodyne	ADRB1	44	39
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103763	FE	On-Demand	Anodyne	ADRB3	28	42
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103764	FE	On-Demand	Anodyne	ADRB2	36	47
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103764	FE	On-Demand	Anodyne	ADRB1	44	39
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819103764	FE	On-Demand	Anodyne	ADRB3	28	42
O=C(CC1CC1)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Br	ZINC000819103769	IE	On-Demand	Reactive	EPHX2	18	40
O=C(CC1CC1)NNC(=O)c1ccccc1SCC(=O)NC1CCCCCCC1	ZINC000819103786	HH	On-Demand	Reactive	CNR2	16	41
O=C(Cc1cccc(OCc2ccc(Cl)cc2)c1)NNC(=O)CC1CC1	ZINC000819103790	FG	On-Demand	Reactive	MAOB	48	40
O=C(Cc1cccc(OCc2ccc(Cl)cc2)c1)NNC(=O)CC1CC1	ZINC000819103790	FG	On-Demand	Reactive	PTGER1	48	37
O=C(Cc1cccc(OCc2ccc(Cl)cc2)c1)NNC(=O)CC1CC1	ZINC000819103790	FG	On-Demand	Reactive	FFAR1	51	42
O=C(Cc1cccc(OCc2ccc(Cl)cc2)c1)NNC(=O)CC1CC1	ZINC000819103790	FG	On-Demand	Reactive	PDS	40	35
C[C@@](O)(C(=O)NNC(=O)CC1CC1)c1cccc(C(F)(F)F)c1	ZINC000819103791	ED	On-Demand	Reactive	CACNA1B	46	33
C[C@@](O)(C(=O)NNC(=O)CC1CC1)c1cccc(C(F)(F)F)c1	ZINC000819103791	ED	On-Demand	Reactive	CCR2	75	40
N#Cc1cccc(OCC(=O)NNC(=O)CC2CC2)c1	ZINC000819103829	CC	On-Demand	Reactive	CHRNA10	33	47
N#Cc1cccc(OCC(=O)NNC(=O)CC2CC2)c1	ZINC000819103829	CC	On-Demand	Reactive	MCHR1	15	40
C[C@H](NC(=O)c1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819103834	CC	On-Demand	Reactive	ACE	21	40
C[C@H](NC(=O)c1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819103834	CC	On-Demand	Reactive	CTSB	19	43
C[C@H](NC(=O)c1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819103834	CC	On-Demand	Reactive	CTRB1	47	38
C[C@@H](NC(=O)c1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819103836	CC	On-Demand	Reactive	ACE	21	40
C[C@@H](NC(=O)c1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819103836	CC	On-Demand	Reactive	CTSB	19	43
C[C@@H](NC(=O)c1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819103836	CC	On-Demand	Reactive	CTRB1	47	38
O=C(CC1CC1)NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819103846	FD	On-Demand	Reactive	PSEN2	61	35
O=C(CC1CC1)NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819103846	FD	On-Demand	Reactive	MMP13	41	45
O=C(CC1CC1)NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819103846	FD	On-Demand	Reactive	MMP2	44	45
O=C(CC1CC1)NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819103846	FD	On-Demand	Reactive	MMP3	17	45
O=C(CC1CC1)NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819103846	FD	On-Demand	Reactive	MMP8	21	45
O=C(CC1CC1)NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819103846	FD	On-Demand	Reactive	MMP14	39	45
O=C(CC1CC1)NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819103846	FD	On-Demand	Reactive	PSEN1	47	35
O=C(CC1CC1)NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819103846	FD	On-Demand	Reactive	MMP10	67	36
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000819103852	FH	On-Demand	Anodyne	KCNQ2	52	37
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000819103852	FH	On-Demand	Anodyne	KCNK3	107	43
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000819103852	FH	On-Demand	Anodyne	KCNK9	60	41
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000819103854	FH	On-Demand	Anodyne	KCNQ2	52	37
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000819103854	FH	On-Demand	Anodyne	KCNK3	107	43
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000819103854	FH	On-Demand	Anodyne	KCNK9	60	41
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000819103855	FH	On-Demand	Anodyne	KCNQ2	52	37
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000819103855	FH	On-Demand	Anodyne	KCNK3	107	43
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000819103855	FH	On-Demand	Anodyne	KCNK9	60	41
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000819103856	FH	On-Demand	Anodyne	KCNQ2	52	37
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000819103856	FH	On-Demand	Anodyne	KCNK3	107	43
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(NC(=O)c2ccccc2)c1	ZINC000819103856	FH	On-Demand	Anodyne	KCNK9	60	41
O=C(CC1CC1)NNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000819103874	HF	On-Demand	Reactive	SERPINE1	24	50
O=C(CC1CC1)NNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000819103874	HF	On-Demand	Reactive	LIPG	54	40
CCO[C@@H]1C[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C12CCCCC2	ZINC000819103908	EG	On-Demand	Bother	CACNA1D	55	32
CCO[C@@H]1C[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C12CCCCC2	ZINC000819103910	EG	On-Demand	Bother	CACNA1D	55	32
CCO[C@@H]1C[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C12CCCCC2	ZINC000819103912	EG	On-Demand	Bother	CACNA1D	55	32
CCO[C@@H]1C[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C12CCCCC2	ZINC000819103913	EG	On-Demand	Bother	CACNA1D	55	32
O=C(CCc1ccccn1)NNC(=O)CC1CC1	ZINC000819103914	BC	On-Demand	Reactive	GRIN2B	26	55
C[C@@H]1CCCCN1[C@H](C)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819103937	GF	On-Demand	Mild	PAPA1_CARPA	41	47
O=C(CC1CC1)NNC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	ZINC000819103939	FC	On-Demand	Reactive	CCR8	44	34
O=C(CC1CC1)NNC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	ZINC000819103939	FC	On-Demand	Reactive	SFRP1	70	36
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)N1CCCC[C@H]1C	ZINC000819103940	GF	On-Demand	Mild	PAPA1_CARPA	41	47
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)N1CCCC[C@H]1C	ZINC000819103942	GF	On-Demand	Mild	PAPA1_CARPA	41	47
C[C@@H]1CCCCN1[C@H](C)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819103944	GF	On-Demand	Mild	PAPA1_CARPA	41	47
CC(C)(C)OC(=O)N[C@@H](C(=O)NNC(=O)CC1CC1)c1ccccc1	ZINC000819103948	EE	On-Demand	Reactive	PGC	50	32
CC(C)(C)OC(=O)N[C@@H](C(=O)NNC(=O)CC1CC1)c1ccccc1	ZINC000819103948	EE	On-Demand	Reactive	PAPA1_CARPA	37	42
CC(C)(C)OC(=O)N[C@@H](C(=O)NNC(=O)CC1CC1)c1ccccc1	ZINC000819103948	EE	On-Demand	Reactive	CTSK	23	49
CC(C)(C)OC(=O)N[C@@H](C(=O)NNC(=O)CC1CC1)c1ccccc1	ZINC000819103948	EE	On-Demand	Reactive	TACR3	18	40
CC(C)(C)OC(=O)N[C@@H](C(=O)NNC(=O)CC1CC1)c1ccccc1	ZINC000819103948	EE	On-Demand	Reactive	REN	61	42
CC(C)(C)OC(=O)N[C@@H](C(=O)NNC(=O)CC1CC1)c1ccccc1	ZINC000819103948	EE	On-Demand	Reactive	FPR1	48	41
CC(C)[C@H]1CC[C@@H](C)C[C@H]1OCC(=O)NNC(=O)CC1CC1	ZINC000819103967	DE	On-Demand	Reactive	SERPINE1	46	46
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OCC(=O)NNC(=O)CC1CC1	ZINC000819103970	DE	On-Demand	Reactive	SERPINE1	46	46
O=C(CC1CC1)NNC(=O)c1ncccc1Cl	ZINC000819103971	CD	On-Demand	Reactive	TYK2	43	33
COC(=O)Nc1ccc(C(=O)N2CCCc3c(OC(F)F)cccc32)cc1	ZINC000819103977	GI	On-Demand	Anodyne	AVPR2	106	48
COC(=O)Nc1ccc(C(=O)N2CCCc3c(OC(F)F)cccc32)cc1	ZINC000819103977	GI	On-Demand	Anodyne	AVPR1A	50	44
C[C@@](O)(C(=O)NNC(=O)CC1CC1)c1ccccc1C(F)(F)F	ZINC000819103995	ED	On-Demand	Reactive	KCNJ11	25	40
C[C@@](O)(C(=O)NNC(=O)CC1CC1)c1ccccc1C(F)(F)F	ZINC000819103995	ED	On-Demand	Reactive	RBP4	72	33
C[C@@](O)(C(=O)NNC(=O)CC1CC1)c1ccccc1C(F)(F)F	ZINC000819103995	ED	On-Demand	Reactive	SFRP1	87	37
C[C@@](O)(C(=O)NNC(=O)CC1CC1)c1ccccc1C(F)(F)F	ZINC000819103995	ED	On-Demand	Reactive	WNT3	56	33
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000819104002	GD	On-Demand	Reactive	EPHX2	24	47
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000819104002	GD	On-Demand	Reactive	TGM2	77	45
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000819104002	GD	On-Demand	Reactive	F13A1	74	42
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000819104002	GD	On-Demand	Reactive	L3MBTL3	35	47
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000819104002	GD	On-Demand	Reactive	NAMPT	37	43
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	ZINC000819104031	FC	On-Demand	Reactive	LGMN	72	34
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	ZINC000819104033	FC	On-Demand	Reactive	LGMN	72	34
O=C(c1cc(Cl)ncc1Cl)N1CCCc2c(OC(F)F)cccc21	ZINC000819104045	FJ	On-Demand	Anodyne	GPBAR1	40	41
CC(C)(C)OC(=O)NCc1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819104066	EE	On-Demand	Reactive	CACNA1I	40	31
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1C(=O)c1ccccc1O	ZINC000819104072	EC	On-Demand	Reactive	F2	35	41
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1C(=O)c1ccccc1O	ZINC000819104072	EC	On-Demand	Reactive	PREP	85	37
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1C(=O)c1ccccc1O	ZINC000819104072	EC	On-Demand	Reactive	LGMN	65	37
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1O	ZINC000819104074	EC	On-Demand	Reactive	F2	35	41
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1O	ZINC000819104074	EC	On-Demand	Reactive	PREP	85	37
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1O	ZINC000819104074	EC	On-Demand	Reactive	LGMN	65	37
COc1ccc(-n2cnnc2SCC(=O)NNC(=O)c2cc(-c3ccccc3)on2)cc1	ZINC000819104093	JE	On-Demand	Reactive	RPA1	16	40
Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccccc1C(=O)Nc1ccc(Cl)cc1	ZINC000819104117	IK	On-Demand	Anodyne	PPARG	75	44
Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccccc1C(=O)Nc1ccc(Cl)cc1	ZINC000819104117	IK	On-Demand	Anodyne	PPARA	81	44
Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccccc1C(=O)Nc1ccc(Cl)cc1	ZINC000819104117	IK	On-Demand	Anodyne	F10	23	44
Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccccc1C(=O)Nc1ccc(Cl)cc1	ZINC000819104117	IK	On-Demand	Anodyne	PDE8B	60	35
Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccccc1C(=O)Nc1ccc(Cl)cc1	ZINC000819104117	IK	On-Demand	Anodyne	NR2E3	65	36
Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccccc1C(=O)Nc1ccc(Cl)cc1	ZINC000819104117	IK	On-Demand	Anodyne	SMO	21	57
Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccccc1C(=O)Nc1ccc(Cl)cc1	ZINC000819104117	IK	On-Demand	Anodyne	IMDH_CRYPV	40	39
O=C1CCCCN1Cc1ccc(C(=O)N2CCCc3c(OC(F)F)cccc32)cc1	ZINC000819104124	HI	On-Demand	Anodyne	AVPR2	60	39
Cc1ccc(C(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1	ZINC000819104140	EE	On-Demand	Anodyne	L3MBTL3	82	42
Cc1ccc(C(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1	ZINC000819104142	EE	On-Demand	Anodyne	L3MBTL3	82	42
Cc1ccc(C(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1	ZINC000819104143	EE	On-Demand	Anodyne	L3MBTL3	82	42
Cc1ccc(C(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1	ZINC000819104145	EE	On-Demand	Anodyne	L3MBTL3	82	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	F2	37	44
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	TSHR	75	37
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	FKBP1A	46	39
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	OPRM1	26	43
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	OPRK1	20	43
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	ELANE	40	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	HCRTR1	15	41
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	CMA1	35	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	MMP13	30	41
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	CCR3	26	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	CPT1A	23	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	HDAC8	23	47
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	DPP4	18	45
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	PREP	63	36
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	MTNR1A	47	44
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	MTNR1B	50	44
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	MMP2	16	41
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	MMP3	40	41
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	MMP8	18	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	LGMN	55	38
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	CFTR	59	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	MMP9	30	41
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	MMP1	34	41
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	MCHR1	28	43
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104164	GF	On-Demand	Anodyne	BRCA1	61	34
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819104166	HD	On-Demand	Reactive	MMP13	36	47
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819104166	HD	On-Demand	Reactive	ITGA4	29	48
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819104166	HD	On-Demand	Reactive	CAPNS1	21	43
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819104166	HD	On-Demand	Reactive	MMP2	18	43
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819104166	HD	On-Demand	Reactive	MMP3	34	47
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819104166	HD	On-Demand	Reactive	CAPN1	15	55
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819104166	HD	On-Demand	Reactive	MMP9	26	43
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819104166	HD	On-Demand	Reactive	MMP7	44	47
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819104166	HD	On-Demand	Reactive	MMP1	47	47
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	F2	37	44
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	TSHR	75	37
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	FKBP1A	46	39
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	OPRM1	26	43
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	OPRK1	20	43
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	ELANE	40	42
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	HCRTR1	15	41
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	CMA1	35	40
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	MMP13	30	41
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	CCR3	26	42
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	CPT1A	23	40
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	HDAC8	23	47
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	DPP4	18	45
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	PREP	63	36
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	MTNR1A	47	44
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	MTNR1B	50	44
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	MMP2	16	41
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	MMP3	40	41
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	MMP8	18	40
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	LGMN	55	38
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	CFTR	59	40
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	MMP9	30	41
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	MMP1	34	41
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	MCHR1	28	43
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819104168	GF	On-Demand	Anodyne	BRCA1	61	34
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819104170	HD	On-Demand	Reactive	MMP13	36	47
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819104170	HD	On-Demand	Reactive	ITGA4	29	48
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819104170	HD	On-Demand	Reactive	CAPNS1	21	43
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819104170	HD	On-Demand	Reactive	MMP2	18	43
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819104170	HD	On-Demand	Reactive	MMP3	34	47
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819104170	HD	On-Demand	Reactive	CAPN1	15	55
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819104170	HD	On-Demand	Reactive	MMP9	26	43
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819104170	HD	On-Demand	Reactive	MMP7	44	47
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819104170	HD	On-Demand	Reactive	MMP1	47	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC(=O)NCc1ccccc1	ZINC000819104180	ED	On-Demand	Anodyne	PAPA1_CARPA	28	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC(=O)NCc1ccccc1	ZINC000819104180	ED	On-Demand	Anodyne	FPR1	44	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC(=O)NCc1ccccc1	ZINC000819104180	ED	On-Demand	Anodyne	CACNA1G	15	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC(=O)NCc1ccccc1	ZINC000819104180	ED	On-Demand	Anodyne	PDS	41	33
C[C@@H](C(F)(F)F)S(=O)(=O)N1CCC(Oc2ccc(C(=O)O)cc2)CC1	ZINC000819104233	GF	On-Demand	Anodyne	PRSS2	60	35
C[C@@H](C(F)(F)F)S(=O)(=O)N1CCC(Oc2ccc(C(=O)O)cc2)CC1	ZINC000819104233	GF	On-Demand	Anodyne	HRH3	25	42
C[C@@H](C(F)(F)F)S(=O)(=O)N1CCC(Oc2ccc(C(=O)O)cc2)CC1	ZINC000819104233	GF	On-Demand	Anodyne	EPHX2	28	44
C[C@@H](C(F)(F)F)S(=O)(=O)N1CCC(Oc2ccc(C(=O)O)cc2)CC1	ZINC000819104233	GF	On-Demand	Anodyne	SCD1	16	40
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccccc3F)C2=O)cc1	ZINC000819104241	FE	On-Demand	Anodyne	ADRB2	29	43
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccccc3F)C2=O)cc1	ZINC000819104241	FE	On-Demand	Anodyne	ADRB1	25	43
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccccc3F)C2=O)cc1	ZINC000819104241	FE	On-Demand	Anodyne	ADRB3	17	42
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccccc3F)C2=O)cc1	ZINC000819104251	FE	On-Demand	Anodyne	ADRB2	29	43
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccccc3F)C2=O)cc1	ZINC000819104251	FE	On-Demand	Anodyne	ADRB1	25	43
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccccc3F)C2=O)cc1	ZINC000819104251	FE	On-Demand	Anodyne	ADRB3	17	42
COc1ccc(OC)c([C@H](O)CNCc2cc(O)nc3ccccc23)c1	ZINC000819104271	FF	On-Demand	Anodyne	ADRB2	23	44
COc1ccc(OC)c([C@H](O)CNCc2cc(O)nc3ccccc23)c1	ZINC000819104271	FF	On-Demand	Anodyne	METG	75	41
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccc(C#N)cc3)C2=O)cc1	ZINC000819104278	FE	On-Demand	Mild	ADRB2	21	41
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccc(C#N)cc3)C2=O)cc1	ZINC000819104279	FE	On-Demand	Mild	ADRB2	21	41
O=C(Nc1ccc(CC(=O)N2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819104289	EE	On-Demand	Anodyne	EPHX2	21	40
O=C(CNC(=O)C(F)=C1CCC1)NCc1ccccc1	ZINC000819104303	CD	On-Demand	Anodyne	CA5B	19	42
O=C(CNC(=O)C(F)=C1CCC1)NCc1ccccc1	ZINC000819104303	CD	On-Demand	Anodyne	CA5A	22	42
O=C(CNC(=O)C(F)=C1CCC1)NCc1ccccc1	ZINC000819104303	CD	On-Demand	Anodyne	PDS	41	33
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(-n2cccn2)cc1	ZINC000819104306	CE	On-Demand	Anodyne	AMP1_PLAFQ	50	34
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(-n2cccn2)cc1	ZINC000819104307	CE	On-Demand	Anodyne	AMP1_PLAFQ	50	34
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(-n2cccn2)cc1	ZINC000819104308	CE	On-Demand	Anodyne	AMP1_PLAFQ	50	34
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(-n2cccn2)cc1	ZINC000819104309	CE	On-Demand	Anodyne	AMP1_PLAFQ	50	34
O=C(CC1CC1)NNC(=O)c1nn(-c2ccc(F)c(F)c2)c2c1CCC2	ZINC000819104347	FE	On-Demand	Reactive	CNR1	50	31
CN(C)S(=O)(=O)c1cc(C(=O)N2CCCc3c(OC(F)F)cccc32)ccc1Cl	ZINC000819104351	IH	On-Demand	Anodyne	AVPR2	48	36
O=C(CCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NNC(=O)CC1CC1	ZINC000819104356	ID	On-Demand	Reactive	SFRP1	116	38
O=C(CCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NNC(=O)CC1CC1	ZINC000819104356	ID	On-Demand	Reactive	WNT3	72	33
CCOC(=O)Nc1ccc(C(=O)N2CCCc3c(OC(F)F)cccc32)cc1	ZINC000819104361	GI	On-Demand	Anodyne	AVPR2	106	46
CCOC(=O)Nc1ccc(C(=O)N2CCCc3c(OC(F)F)cccc32)cc1	ZINC000819104361	GI	On-Demand	Anodyne	AVPR1A	47	43
CCOC(=O)Nc1ccc(C(=O)N2CCCc3c(OC(F)F)cccc32)cc1	ZINC000819104361	GI	On-Demand	Anodyne	ACR	40	34
CC(C)(C)OC(=O)NCc1cc(C(=O)N2CCCc3c(OC(F)F)cccc32)ccn1	ZINC000819104365	II	On-Demand	Anodyne	AVPR2	39	41
O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCCc2c(OC(F)F)cccc21	ZINC000819104374	GH	On-Demand	Bother	AVPR2	24	48
O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)C(F)=C1CCC1	ZINC000819104402	DH	On-Demand	Bother	KCNMA1	18	42
CCC(=O)c1cc(C(=O)N2CCCc3c(OC(F)F)cccc32)ccc1F	ZINC000819104404	GJ	On-Demand	Anodyne	AVPR2	64	40
O=C(O)c1ccc(OC2CCN(S(=O)(=O)c3c[nH]nc3Cl)CC2)cc1	ZINC000819104405	GD	On-Demand	Anodyne	HRH1	37	45
O=C(O)c1ccc(OC2CCN(S(=O)(=O)c3c[nH]nc3Cl)CC2)cc1	ZINC000819104405	GD	On-Demand	Anodyne	CCR3	40	41
O=C(O)c1ccc(OC2CCN(S(=O)(=O)c3c[nH]nc3Cl)CC2)cc1	ZINC000819104405	GD	On-Demand	Anodyne	EPHX2	19	45
O=C(O)c1ccc(OC2CCN(S(=O)(=O)C(F)F)CC2)cc1	ZINC000819104415	ED	On-Demand	Anodyne	PRSS2	59	35
O=C(O)c1ccc(OC2CCN(S(=O)(=O)C(F)F)CC2)cc1	ZINC000819104415	ED	On-Demand	Anodyne	CCR3	23	40
O=C(O)c1ccc(OC2CCN(S(=O)(=O)C(F)F)CC2)cc1	ZINC000819104415	ED	On-Demand	Anodyne	EPHX2	25	42
O=C(CCCn1ccnc1)NNC(=O)CC1CC1	ZINC000819104420	CC	On-Demand	Reactive	TBXAS1	50	49
O=C(CCCn1ccnc1)NNC(=O)CC1CC1	ZINC000819104420	CC	On-Demand	Reactive	QPCT	40	40
CC(C)(C)OC(=O)N1CCc2cc(C(=O)N3CCCc4c(OC(F)F)cccc43)ccc21	ZINC000819104426	IK	On-Demand	Anodyne	AVPR2	56	42
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Cc1cccs1	ZINC000819104439	CG	On-Demand	Anodyne	ADRB1	17	41
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Cc1cccs1	ZINC000819104439	CG	On-Demand	Anodyne	ADRB3	27	41
O=C(c1cc(Cl)nc(N2CCCC2)c1)N1CCCc2c(OC(F)F)cccc21	ZINC000819104440	HJ	On-Demand	Anodyne	TAAR1	19	40
C[C@H](CNC[C@H](O)c1cccc(F)c1)Cc1cccs1	ZINC000819104441	CG	On-Demand	Anodyne	ADRB1	17	41
C[C@H](CNC[C@H](O)c1cccc(F)c1)Cc1cccs1	ZINC000819104441	CG	On-Demand	Anodyne	ADRB3	27	41
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Cc1cccs1	ZINC000819104442	CG	On-Demand	Anodyne	ADRB1	17	41
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Cc1cccs1	ZINC000819104442	CG	On-Demand	Anodyne	ADRB3	27	41
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Cc1cccs1	ZINC000819104443	CG	On-Demand	Anodyne	ADRB1	17	41
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Cc1cccs1	ZINC000819104443	CG	On-Demand	Anodyne	ADRB3	27	41
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)COc2ccc(F)cc2)CC1	ZINC000819104453	FD	On-Demand	Anodyne	CPT1A	55	37
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)COc2ccc(F)cc2)CC1	ZINC000819104453	FD	On-Demand	Anodyne	CPT2	40	33
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)COc2ccc(F)cc2)CC1	ZINC000819104455	FD	On-Demand	Anodyne	CPT1A	55	37
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)COc2ccc(F)cc2)CC1	ZINC000819104455	FD	On-Demand	Anodyne	CPT2	40	33
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)COc2ccc(F)cc2)CC1	ZINC000819104456	FD	On-Demand	Anodyne	CPT1A	55	37
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)COc2ccc(F)cc2)CC1	ZINC000819104456	FD	On-Demand	Anodyne	CPT2	40	33
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)COc2ccc(F)cc2)CC1	ZINC000819104457	FD	On-Demand	Anodyne	CPT1A	55	37
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)COc2ccc(F)cc2)CC1	ZINC000819104457	FD	On-Demand	Anodyne	CPT2	40	33
C=CC(=O)NCc1ccc(C(=O)N2CCCc3c(OC(F)F)cccc32)cc1	ZINC000819104470	GH	On-Demand	Anodyne	AVPR2	57	45
O[C@@H](CN[C@@H]1C[C@H]1C1CCCCC1)c1ccccc1	ZINC000819104483	CG	On-Demand	Anodyne	MGAM	15	50
O[C@H](CN[C@@H]1C[C@@H]1C1CCCCC1)c1ccccc1	ZINC000819104485	CG	On-Demand	Anodyne	MGAM	15	50
O[C@H](CN[C@@H]1C[C@H]1C1CCCCC1)c1ccccc1	ZINC000819104486	CG	On-Demand	Anodyne	MGAM	15	50
O[C@@H](CN[C@H]1C[C@@H]1C1CCCCC1)c1ccccc1	ZINC000819104487	CG	On-Demand	Anodyne	MGAM	15	50
O[C@H](CN[C@H]1C[C@@H]1C1CCCCC1)c1ccccc1	ZINC000819104488	CG	On-Demand	Anodyne	MGAM	15	50
O[C@@H](CN[C@H]1C[C@H]1C1CCCCC1)c1ccccc1	ZINC000819104490	CG	On-Demand	Anodyne	MGAM	15	50
O[C@H](CN[C@H]1C[C@H]1C1CCCCC1)c1ccccc1	ZINC000819104491	CG	On-Demand	Anodyne	MGAM	15	50
O[C@@H](CN[C@@H]1C[C@@H]1C1CCCCC1)c1ccccc1	ZINC000819104493	CG	On-Demand	Anodyne	MGAM	15	50
CC(=O)Nc1ccccc1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819104495	GF	On-Demand	Anodyne	CCR8	36	41
CC(=O)Nc1ccccc1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819104495	GF	On-Demand	Anodyne	GPR119	47	55
CC(=O)Nc1ccccc1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819104497	GF	On-Demand	Anodyne	CCR8	36	41
CC(=O)Nc1ccccc1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819104497	GF	On-Demand	Anodyne	GPR119	47	55
O=C([C@H]1CC(c2ccccc2)=NO1)N1CCCc2c(OC(F)F)cccc21	ZINC000819104498	FH	On-Demand	Anodyne	LUCI_PHOPY	50	34
CC(=O)Nc1cccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819104499	GF	On-Demand	Mild	PAPA1_CARPA	60	52
CC(=O)Nc1cccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819104499	GF	On-Demand	Mild	CCKAR	46	41
CC(=O)Nc1cccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819104499	GF	On-Demand	Mild	CTSK	18	44
CC(=O)Nc1cccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819104499	GF	On-Demand	Mild	CTSL	33	52
CC(=O)Nc1cccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819104499	GF	On-Demand	Mild	REN	27	41
CC(=O)Nc1cccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819104499	GF	On-Demand	Mild	FURIN	48	32
CC(=O)Nc1cccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819104499	GF	On-Demand	Mild	CTSS	25	52
CC(=O)Nc1cccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819104499	GF	On-Demand	Mild	CTSV	48	34
CC(=O)Nc1cccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819104499	GF	On-Demand	Mild	FPR1	49	40
CC(=O)Nc1cccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819104500	GF	On-Demand	Mild	PAPA1_CARPA	60	52
CC(=O)Nc1cccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819104500	GF	On-Demand	Mild	CCKAR	46	41
CC(=O)Nc1cccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819104500	GF	On-Demand	Mild	CTSK	18	44
CC(=O)Nc1cccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819104500	GF	On-Demand	Mild	CTSL	33	52
CC(=O)Nc1cccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819104500	GF	On-Demand	Mild	REN	27	41
CC(=O)Nc1cccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819104500	GF	On-Demand	Mild	FURIN	48	32
CC(=O)Nc1cccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819104500	GF	On-Demand	Mild	CTSS	25	52
CC(=O)Nc1cccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819104500	GF	On-Demand	Mild	CTSV	48	34
CC(=O)Nc1cccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819104500	GF	On-Demand	Mild	FPR1	49	40
O=C([C@@H]1CC(c2ccccc2)=NO1)N1CCCc2c(OC(F)F)cccc21	ZINC000819104503	FH	On-Demand	Anodyne	LUCI_PHOPY	50	34
O=C(CC1CC1)NNC(=O)[C@@H](NC(=O)Cc1ccc(Br)cc1)c1ccccc1	ZINC000819104507	IF	On-Demand	Reactive	YARS	22	43
O=C(CC1CC1)NNC(=O)[C@H](NC(=O)Cc1ccc(Br)cc1)c1ccccc1	ZINC000819104509	IF	On-Demand	Reactive	YARS	22	43
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2cccc(Br)c2)c1	ZINC000819104520	HG	On-Demand	Reactive	TAAR1	41	41
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2cccc(Br)c2)c1	ZINC000819104520	HG	On-Demand	Reactive	KCNK3	110	42
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2cccc(Br)c2)c1	ZINC000819104520	HG	On-Demand	Reactive	KCNK9	60	42
O=C(CCc1ccc2c(c1)OCCO2)NNC(=O)CC1CC1	ZINC000819104557	DD	On-Demand	Reactive	NOS2	50	32
O=C(CCc1ccc2c(c1)OCCO2)NNC(=O)CC1CC1	ZINC000819104557	DD	On-Demand	Reactive	LUXR	55	53
O=C(CC1CC1)NNC(=O)c1ccccc1Oc1ccccc1	ZINC000819104558	DG	On-Demand	Reactive	HCN1	51	32
O=C(CC1CC1)NNC(=O)c1ccccc1Oc1ccccc1	ZINC000819104558	DG	On-Demand	Reactive	HCN4	40	31
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)CC1CC1	ZINC000819104578	FE	On-Demand	Reactive	OPRM1	23	43
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)CC1CC1	ZINC000819104578	FE	On-Demand	Reactive	OPRD1	74	41
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)CC1CC1	ZINC000819104578	FE	On-Demand	Reactive	HDAC8	15	44
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)CC1CC1	ZINC000819104578	FE	On-Demand	Reactive	PREP	31	45
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)CC1CC1	ZINC000819104578	FE	On-Demand	Reactive	CFTR	66	36
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)CC1CC1	ZINC000819104578	FE	On-Demand	Reactive	ADAM9	63	36
Cc1ccc(C(=O)N2CCCc3c(OC(F)F)cccc32)c(Br)n1	ZINC000819104592	GI	On-Demand	Anodyne	AVPR2	44	35
NC(=O)c1ccc(Oc2ccc(C(=O)NNC(=O)CC3CC3)cc2)cc1	ZINC000819104598	FE	On-Demand	Reactive	PLG	19	47
NC(=O)c1ccc(Oc2ccc(C(=O)NNC(=O)CC3CC3)cc2)cc1	ZINC000819104598	FE	On-Demand	Reactive	PLAU	39	47
NC(=O)c1ccc(Oc2ccc(C(=O)NNC(=O)CC3CC3)cc2)cc1	ZINC000819104598	FE	On-Demand	Reactive	ST14	34	47
N#Cc1ccc(Oc2cccc(C(=O)NNC(=O)CC3CC3)c2)cc1	ZINC000819104599	EF	On-Demand	Reactive	PFKFB3	62	35
O=C(Nc1ccc(C(=O)N2CCCc3c(OC(F)F)cccc32)cc1)OCC(F)(F)F	ZINC000819104601	IJ	On-Demand	Anodyne	AVPR2	88	46
O=C(Nc1ccc(C(=O)N2CCCc3c(OC(F)F)cccc32)cc1)OCC(F)(F)F	ZINC000819104601	IJ	On-Demand	Anodyne	AVPR1A	42	41
O=C(Nc1ccc(C(=O)N2CCCc3c(OC(F)F)cccc32)cc1)OCC(F)(F)F	ZINC000819104601	IJ	On-Demand	Anodyne	TAAR1	20	41
O=C(CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12)NNC(=O)CC1CC1	ZINC000819104603	GH	On-Demand	Reactive	GNRHR	43	36
O=C(CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12)NNC(=O)CC1CC1	ZINC000819104603	GH	On-Demand	Reactive	TSPO	16	42
COc1ccc2[nH]c(C(=O)NNC(=O)CC3CC3)cc2c1	ZINC000819104612	CD	On-Demand	Reactive	GRIN2B	17	43
COc1ccc2[nH]c(C(=O)NNC(=O)CC3CC3)cc2c1	ZINC000819104612	CD	On-Demand	Reactive	PYGL	78	42
COc1ccc2[nH]c(C(=O)NNC(=O)CC3CC3)cc2c1	ZINC000819104612	CD	On-Demand	Reactive	MTNR1A	44	35
COc1ccc2[nH]c(C(=O)NNC(=O)CC3CC3)cc2c1	ZINC000819104612	CD	On-Demand	Reactive	TUBB2B	48	50
COc1ccc2[nH]c(C(=O)NNC(=O)CC3CC3)cc2c1	ZINC000819104612	CD	On-Demand	Reactive	FPR2	16	44
CS(=O)(=O)c1ccc(OCCCCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819104613	FD	On-Demand	Reactive	MMP13	46	39
CS(=O)(=O)c1ccc(OCCCCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819104613	FD	On-Demand	Reactive	ADAM17	40	35
CS(=O)(=O)c1ccc(OCCCCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819104613	FD	On-Demand	Reactive	PLA2G4B	43	34
CS(=O)(=O)c1ccc(OCCCCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819104613	FD	On-Demand	Reactive	MMP1	34	42
O=C(c1ccc(C2SCCS2)cc1)N1CCCc2c(OC(F)F)cccc21	ZINC000819104617	HK	On-Demand	Anodyne	AVPR2	50	37
C#CCNC(=O)CCN[C@H]1CCOc2cc(OC)ccc21	ZINC000819104623	CD	On-Demand	Mild	MTNR1A	92	39
C#CCNC(=O)CCN[C@H]1CCOc2cc(OC)ccc21	ZINC000819104623	CD	On-Demand	Mild	MTNR1B	80	38
C#CCNC(=O)CCN[C@@H]1CCOc2cc(OC)ccc21	ZINC000819104624	CD	On-Demand	Mild	MTNR1A	92	39
C#CCNC(=O)CCN[C@@H]1CCOc2cc(OC)ccc21	ZINC000819104624	CD	On-Demand	Mild	MTNR1B	80	38
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000819104647	DD	On-Demand	Reactive	F2	55	43
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000819104647	DD	On-Demand	Reactive	ACE	38	42
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000819104647	DD	On-Demand	Reactive	CELA1	24	41
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000819104647	DD	On-Demand	Reactive	ELANE	44	38
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000819104647	DD	On-Demand	Reactive	TRY1_BOVIN	47	37
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000819104647	DD	On-Demand	Reactive	DPP4	15	49
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000819104647	DD	On-Demand	Reactive	PREP	113	49
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000819104647	DD	On-Demand	Reactive	LGMN	72	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000819104647	DD	On-Demand	Reactive	XIAP	42	38
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000819104647	DD	On-Demand	Reactive	BRCA1	43	30
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000819104647	DD	On-Demand	Reactive	TMPRSS11D	64	35
CC(=O)Nc1ccccc1CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819104657	FD	On-Demand	Anodyne	CTSF	43	32
CC(=O)Nc1ccccc1CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819104658	FD	On-Demand	Anodyne	CTSF	43	32
O=C(CNC(=O)c1ccccc1)NNC(=O)CC1CC1	ZINC000819104722	CC	On-Demand	Reactive	GRIN2B	24	45
O=C(CNC(=O)c1ccccc1)NNC(=O)CC1CC1	ZINC000819104722	CC	On-Demand	Reactive	CCR2	67	40
O=C(CC1CC1)NNC(=O)c1oc2ccccc2c1COc1ccccc1	ZINC000819104724	FH	On-Demand	Reactive	GRIN2B	20	40
CN(C1CCOCC1)S(=O)(=O)N1CCC(Oc2ccc(C(=O)O)cc2)CC1	ZINC000819104725	GD	On-Demand	Anodyne	PRSS2	75	39
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCCC2)c1	ZINC000819104730	DD	On-Demand	Reactive	DRD2	18	46
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCCC2)c1	ZINC000819104730	DD	On-Demand	Reactive	DRD4	32	42
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCCC2)c1	ZINC000819104730	DD	On-Demand	Reactive	ACHE	31	44
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCCC2)c1	ZINC000819104730	DD	On-Demand	Reactive	HRH2	31	41
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCCC2)c1	ZINC000819104730	DD	On-Demand	Reactive	CHRM3	24	41
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCCC2)c1	ZINC000819104730	DD	On-Demand	Reactive	SIGMAR1	35	45
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCCC2)c1	ZINC000819104730	DD	On-Demand	Reactive	CCR3	30	43
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCCC2)c1	ZINC000819104730	DD	On-Demand	Reactive	BDKRB1	47	48
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCCC2)c1	ZINC000819104730	DD	On-Demand	Reactive	CCR2	23	43
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCCC2)c1	ZINC000819104730	DD	On-Demand	Reactive	MCHR1	31	45
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCCC2)c1	ZINC000819104730	DD	On-Demand	Reactive	CACNA1I	26	42
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCCC2)c1	ZINC000819104730	DD	On-Demand	Reactive	L3MBTL3	16	40
O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCCc2c(OC(F)F)cccc21	ZINC000819104731	GI	On-Demand	Bother	AVPR2	42	41
Cc1ccc(C(=O)N2CCCc3c(OC(F)F)cccc32)cc1C#N	ZINC000819104732	EI	On-Demand	Mild	AVPR2	57	38
O=C(O)c1ccc(OC2CCN(S(=O)(=O)CC3CC3)CC2)cc1	ZINC000819104754	ED	On-Demand	Anodyne	HRH1	27	46
O=C(O)c1ccc(OC2CCN(S(=O)(=O)CC3CC3)CC2)cc1	ZINC000819104754	ED	On-Demand	Anodyne	PRSS2	62	36
O=C(O)c1ccc(OC2CCN(S(=O)(=O)CC3CC3)CC2)cc1	ZINC000819104754	ED	On-Demand	Anodyne	CCR3	28	47
O=C(O)c1ccc(OC2CCN(S(=O)(=O)CC3CC3)CC2)cc1	ZINC000819104754	ED	On-Demand	Anodyne	EPHX2	22	43
O[C@H](CN[C@@H]1C[C@@H]1C1CCCCC1)c1ccc(F)cc1	ZINC000819104768	CG	On-Demand	Anodyne	SLC6A3	15	43
O[C@H](CN[C@@H]1C[C@H]1C1CCCCC1)c1ccc(F)cc1	ZINC000819104769	CG	On-Demand	Anodyne	SLC6A3	15	43
O[C@H](CN[C@H]1C[C@@H]1C1CCCCC1)c1ccc(F)cc1	ZINC000819104770	CG	On-Demand	Anodyne	SLC6A3	15	43
O[C@H](CN[C@H]1C[C@H]1C1CCCCC1)c1ccc(F)cc1	ZINC000819104771	CG	On-Demand	Anodyne	SLC6A3	15	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000819104782	FD	On-Demand	Anodyne	GPR119	24	42
O=C(O)c1ccc(OC2CCN(S(=O)(=O)c3cccnc3Cl)CC2)cc1	ZINC000819104804	GF	On-Demand	Anodyne	HRH1	37	45
O=C(O)c1ccc(OC2CCN(S(=O)(=O)c3cccnc3Cl)CC2)cc1	ZINC000819104804	GF	On-Demand	Anodyne	PRSS2	50	31
O=C(O)c1ccc(OC2CCN(S(=O)(=O)c3cccnc3Cl)CC2)cc1	ZINC000819104804	GF	On-Demand	Anodyne	CCR3	39	46
O=C(O)c1ccc(OC2CCN(S(=O)(=O)c3cccnc3Cl)CC2)cc1	ZINC000819104804	GF	On-Demand	Anodyne	EPHX2	29	43
C[C@@H](CNC[C@H](O)c1cccnc1)Cc1cccs1	ZINC000819104805	CF	On-Demand	Anodyne	ADRB2	23	45
C[C@@H](CNC[C@H](O)c1cccnc1)Cc1cccs1	ZINC000819104805	CF	On-Demand	Anodyne	ADRB1	25	45
C[C@@H](CNC[C@H](O)c1cccnc1)Cc1cccs1	ZINC000819104805	CF	On-Demand	Anodyne	ADRB3	93	45
C[C@@H](CNC[C@@H](O)c1cccnc1)Cc1cccs1	ZINC000819104806	CF	On-Demand	Anodyne	ADRB2	23	45
C[C@@H](CNC[C@@H](O)c1cccnc1)Cc1cccs1	ZINC000819104806	CF	On-Demand	Anodyne	ADRB1	25	45
C[C@@H](CNC[C@@H](O)c1cccnc1)Cc1cccs1	ZINC000819104806	CF	On-Demand	Anodyne	ADRB3	93	45
O=C(CC1CC1)NNC(=O)[C@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	ZINC000819104808	FD	On-Demand	Reactive	P2RX7	18	40
C[C@H](CNC[C@@H](O)c1cccnc1)Cc1cccs1	ZINC000819104809	CF	On-Demand	Anodyne	ADRB2	23	45
C[C@H](CNC[C@@H](O)c1cccnc1)Cc1cccs1	ZINC000819104809	CF	On-Demand	Anodyne	ADRB1	25	45
C[C@H](CNC[C@@H](O)c1cccnc1)Cc1cccs1	ZINC000819104809	CF	On-Demand	Anodyne	ADRB3	93	45
O=C(CC1CC1)NNC(=O)[C@@H]1CC(=O)N(c2ccc(Cl)c(F)c2)C1	ZINC000819104810	FD	On-Demand	Reactive	P2RX7	18	40
C[C@H](CNC[C@H](O)c1cccnc1)Cc1cccs1	ZINC000819104811	CF	On-Demand	Anodyne	ADRB2	23	45
C[C@H](CNC[C@H](O)c1cccnc1)Cc1cccs1	ZINC000819104811	CF	On-Demand	Anodyne	ADRB1	25	45
C[C@H](CNC[C@H](O)c1cccnc1)Cc1cccs1	ZINC000819104811	CF	On-Demand	Anodyne	ADRB3	93	45
Cc1ccc(C(=O)N2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819104834	DF	On-Demand	Anodyne	L3MBTL3	58	38
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCCc3c(OC(F)F)cccc32)C1	ZINC000819104838	GH	On-Demand	Anodyne	GPR119	34	43
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCCc3c(OC(F)F)cccc32)C1	ZINC000819104838	GH	On-Demand	Anodyne	SFRP1	20	43
O=C([C@@H]1CC(=O)N(C2CCCC2)C1)N1CCCc2c(OC(F)F)cccc21	ZINC000819104842	GG	On-Demand	Anodyne	INHA	17	41
O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CCCc2c(OC(F)F)cccc21	ZINC000819104845	GG	On-Demand	Anodyne	INHA	17	41
Cc1csc([C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C2CC2)n1	ZINC000819104896	GH	On-Demand	Anodyne	GPR119	33	42
Cc1csc([C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C2CC2)n1	ZINC000819104897	GH	On-Demand	Anodyne	GPR119	33	42
COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819104939	GC	On-Demand	Reactive	NPBWR1	43	30
COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819104940	GC	On-Demand	Reactive	NPBWR1	43	30
CN(CC(=O)N1CCCc2c(OC(F)F)cccc21)C(=O)OCc1ccccc1	ZINC000819104941	HH	On-Demand	Anodyne	SLC12A5	54	33
CC(C)(C)OC(=O)NCC[C@@H](O)CNC1CC(c2cccc(Cl)c2)C1	ZINC000819104945	FG	On-Demand	Anodyne	MDM2	53	37
CC(C)(C)OC(=O)NCC[C@H](O)CNC1CC(c2cccc(Cl)c2)C1	ZINC000819104946	FG	On-Demand	Anodyne	MDM2	53	37
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819104958	GH	On-Demand	Anodyne	DRD2	15	44
CC(C)(C)OC(=O)NCCC(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819104960	FG	On-Demand	Anodyne	DRD2	16	48
Cc1cc(C)nc(-n2nc(C)c(CC(=O)NNC(=O)CC3CC3)c2C)n1	ZINC000819104995	FD	On-Demand	Reactive	P2RX7	22	43
CC(C)(C)OC(=O)NCc1ccc(C(=O)N2CCCc3c(OC(F)F)cccc32)cc1	ZINC000819105012	IJ	On-Demand	Anodyne	AVPR2	69	45
O=C(CC1CC1)NNC(=O)c1cnc2ccccn12	ZINC000819105033	CC	On-Demand	Reactive	EPHB3	23	50
CN(CCCC(=O)NNC(=O)CC1CC1)C1=NS(=O)(=O)c2ccccc21	ZINC000819105050	GC	On-Demand	Reactive	KCNA3	29	46
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105053	IH	On-Demand	Anodyne	CTRA_BOVIN	56	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105053	IH	On-Demand	Anodyne	KLK3	70	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105053	IH	On-Demand	Anodyne	CTSB	55	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105053	IH	On-Demand	Anodyne	PAPA1_CARPA	55	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105053	IH	On-Demand	Anodyne	CYSP_TRYCR	50	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105053	IH	On-Demand	Anodyne	CTSG	41	32
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105053	IH	On-Demand	Anodyne	CTSL	48	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105053	IH	On-Demand	Anodyne	CAPNS1	59	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105053	IH	On-Demand	Anodyne	CELA2A	51	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105053	IH	On-Demand	Anodyne	MMP11	42	30
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105053	IH	On-Demand	Anodyne	CAPN1	68	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105053	IH	On-Demand	Anodyne	CAPN2	110	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105053	IH	On-Demand	Anodyne	TGM2	23	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105053	IH	On-Demand	Anodyne	NPR	51	31
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105054	IH	On-Demand	Anodyne	CTRA_BOVIN	56	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105054	IH	On-Demand	Anodyne	KLK3	70	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105054	IH	On-Demand	Anodyne	CTSB	55	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105054	IH	On-Demand	Anodyne	PAPA1_CARPA	55	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105054	IH	On-Demand	Anodyne	CYSP_TRYCR	50	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105054	IH	On-Demand	Anodyne	CTSG	41	32
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105054	IH	On-Demand	Anodyne	CTSL	48	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105054	IH	On-Demand	Anodyne	CAPNS1	59	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105054	IH	On-Demand	Anodyne	CELA2A	51	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105054	IH	On-Demand	Anodyne	MMP11	42	30
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105054	IH	On-Demand	Anodyne	CAPN1	68	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105054	IH	On-Demand	Anodyne	CAPN2	110	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105054	IH	On-Demand	Anodyne	TGM2	23	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCc2c(OC(F)F)cccc21	ZINC000819105054	IH	On-Demand	Anodyne	NPR	51	31
O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N1CCCc2c(OC(F)F)cccc21	ZINC000819105056	II	On-Demand	Anodyne	AVPR2	40	37
O=C(CCNC(=O)Nc1ccc(Br)cc1)NNC(=O)CC1CC1	ZINC000819105067	GD	On-Demand	Reactive	EPHX2	16	43
O=C(O)c1ccc(OC2CCN(S(=O)(=O)CBr)CC2)cc1	ZINC000819105077	GD	On-Demand	Reactive	CHRM2	15	40
O=C(O)c1ccc(OC2CCN(S(=O)(=O)CBr)CC2)cc1	ZINC000819105077	GD	On-Demand	Reactive	HRH1	22	42
O=C(O)c1ccc(OC2CCN(S(=O)(=O)CBr)CC2)cc1	ZINC000819105077	GD	On-Demand	Reactive	PRSS2	68	37
O=C(O)c1ccc(OC2CCN(S(=O)(=O)CBr)CC2)cc1	ZINC000819105077	GD	On-Demand	Reactive	CCR3	24	43
O=C(O)c1ccc(OC2CCN(S(=O)(=O)CBr)CC2)cc1	ZINC000819105077	GD	On-Demand	Reactive	EPHX2	26	45
O=C(NNC(=O)c1cc(-c2ccccc2)on1)c1cn(Cc2ccccc2)nn1	ZINC000819105102	GE	On-Demand	Reactive	HDAC10	22	44
O=C(NNC(=O)c1cc(-c2ccccc2)on1)c1cn(Cc2ccccc2)nn1	ZINC000819105102	GE	On-Demand	Reactive	CDC7	18	42
CN(C)S(=O)(=O)c1cc(C(=O)N2CCCc3c(OC(F)F)cccc32)ccc1F	ZINC000819105112	IG	On-Demand	Anodyne	AVPR2	42	35
C#CCOc1ccc(C(=O)N2CCCc3c(OC(F)F)cccc32)cc1	ZINC000819105114	FH	On-Demand	Mild	AVPR2	51	38
COc1cccc([C@H](O)C(=O)NNC(=O)CC2CC2)c1	ZINC000819105132	CC	On-Demand	Reactive	MTNR1A	41	40
COc1cccc([C@H](O)C(=O)NNC(=O)CC2CC2)c1	ZINC000819105132	CC	On-Demand	Reactive	MTNR1B	39	40
NS(=O)(=O)c1ccc(N2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819105136	FD	On-Demand	Anodyne	CA2	28	40
NS(=O)(=O)c1ccc(N2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819105136	FD	On-Demand	Anodyne	CA1	23	40
NS(=O)(=O)c1ccc(N2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819105136	FD	On-Demand	Anodyne	CA12	25	40
NS(=O)(=O)c1ccc(N2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819105136	FD	On-Demand	Anodyne	CA9	25	40
O=C(CC1CC1)NNC(=O)CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2	ZINC000819105137	DD	On-Demand	Reactive	BOTA	30	43
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819105149	IC	On-Demand	Reactive	EPHX2	27	43
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819105149	IC	On-Demand	Reactive	TGM2	76	41
Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819105149	IC	On-Demand	Reactive	F13A1	81	41
CC(C)(C)OC(=O)N[C@@H](C(=O)NNC(=O)CC1CC1)c1cccc(Cl)c1	ZINC000819105174	GF	On-Demand	Reactive	FPR1	40	36
O=C(O)c1ccc(OC2CCN(S(=O)(=O)CC3CCOCC3)CC2)cc1	ZINC000819105175	GD	On-Demand	Anodyne	HRH1	20	44
O=C(O)c1ccc(OC2CCN(S(=O)(=O)CC3CCOCC3)CC2)cc1	ZINC000819105175	GD	On-Demand	Anodyne	PRSS2	58	34
O=C(O)c1ccc(OC2CCN(S(=O)(=O)CC3CCOCC3)CC2)cc1	ZINC000819105175	GD	On-Demand	Anodyne	CCR3	22	44
O=C(NC1CCN(C(=O)c2ccccc2F)CC1)C(F)=C1CCC1	ZINC000819105215	EF	On-Demand	Anodyne	EPHX2	20	41
O=C(NC1CCN(C(=O)c2ccccc2F)CC1)C(F)=C1CCC1	ZINC000819105215	EF	On-Demand	Anodyne	L3MBTL3	42	41
Cn1cc(S(=O)(=O)N2CCC(Oc3ccc(C(=O)O)cc3)CC2)nc1Cl	ZINC000819105220	GE	On-Demand	Anodyne	HRH1	30	44
Cn1cc(S(=O)(=O)N2CCC(Oc3ccc(C(=O)O)cc3)CC2)nc1Cl	ZINC000819105220	GE	On-Demand	Anodyne	PRSS2	55	35
Cn1cc(S(=O)(=O)N2CCC(Oc3ccc(C(=O)O)cc3)CC2)nc1Cl	ZINC000819105220	GE	On-Demand	Anodyne	CCR3	31	45
Cn1cc(S(=O)(=O)N2CCC(Oc3ccc(C(=O)O)cc3)CC2)nc1Cl	ZINC000819105220	GE	On-Demand	Anodyne	EPHX2	15	42
O[C@H](CN[C@@H]1C[C@H]1C1CCCCC1)c1cccnc1	ZINC000819105228	CF	On-Demand	Anodyne	ADRB1	22	42
O[C@H](CN[C@@H]1C[C@H]1C1CCCCC1)c1cccnc1	ZINC000819105228	CF	On-Demand	Anodyne	ADRB3	67	43
O[C@H](CN[C@@H]1C[C@@H]1C1CCCCC1)c1cccnc1	ZINC000819105230	CF	On-Demand	Anodyne	ADRB1	22	42
O[C@H](CN[C@@H]1C[C@@H]1C1CCCCC1)c1cccnc1	ZINC000819105230	CF	On-Demand	Anodyne	ADRB3	67	43
O[C@H](CN[C@H]1C[C@H]1C1CCCCC1)c1cccnc1	ZINC000819105231	CF	On-Demand	Anodyne	ADRB1	22	42
O[C@H](CN[C@H]1C[C@H]1C1CCCCC1)c1cccnc1	ZINC000819105231	CF	On-Demand	Anodyne	ADRB3	67	43
O[C@H](CN[C@H]1C[C@@H]1C1CCCCC1)c1cccnc1	ZINC000819105232	CF	On-Demand	Anodyne	ADRB1	22	42
O[C@H](CN[C@H]1C[C@@H]1C1CCCCC1)c1cccnc1	ZINC000819105232	CF	On-Demand	Anodyne	ADRB3	67	43
CCCNC(=O)c1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819105241	DF	On-Demand	Anodyne	KCNK3	70	36
CCCNC(=O)c1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819105242	DF	On-Demand	Anodyne	KCNK3	70	36
CCCNC(=O)c1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819105243	DF	On-Demand	Anodyne	KCNK3	70	36
CCCNC(=O)c1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819105244	DF	On-Demand	Anodyne	KCNK3	70	36
C[C@@H]1CCCCN1Cc1ccc(CNC(=O)/C=C\[C@H]2CCCO2)cc1	ZINC000819105247	EG	On-Demand	Anodyne	HRH3	22	41
C[C@@H]1CCCCN1Cc1ccc(CNC(=O)/C=C/[C@@H]2CCCO2)cc1	ZINC000819105248	EG	On-Demand	Anodyne	HRH3	22	41
C[C@@H]1CCCCN1Cc1ccc(CNC(=O)/C=C\[C@@H]2CCCO2)cc1	ZINC000819105249	EG	On-Demand	Anodyne	HRH3	22	41
C[C@@H]1CCCCN1Cc1ccc(CNC(=O)/C=C/[C@H]2CCCO2)cc1	ZINC000819105250	EG	On-Demand	Anodyne	HRH3	22	41
CCC(CC)c1cc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)on1	ZINC000819105261	GH	On-Demand	Anodyne	GPR119	34	44
CCC(CC)c1cc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)on1	ZINC000819105262	GH	On-Demand	Anodyne	GPR119	34	44
C[C@H](CNC[C@H](O)c1ccccc1)Cc1cccs1	ZINC000819105337	CG	On-Demand	Anodyne	ADRB2	15	41
C[C@@H](CNC[C@H](O)c1ccccc1)Cc1cccs1	ZINC000819105338	CG	On-Demand	Anodyne	ADRB2	15	41
C[C@@H](CNC[C@@H](O)c1ccccc1)Cc1cccs1	ZINC000819105339	CG	On-Demand	Anodyne	ADRB2	15	41
C[C@H](CNC[C@@H](O)c1ccccc1)Cc1cccs1	ZINC000819105340	CG	On-Demand	Anodyne	ADRB2	15	41
COCCCN(C)CCNC[C@H](O)c1cccnc1	ZINC000819105391	CC	On-Demand	Anodyne	ADRB2	29	48
COCCCN(C)CCNC[C@H](O)c1cccnc1	ZINC000819105391	CC	On-Demand	Anodyne	ADRB1	31	49
COCCCN(C)CCNC[C@H](O)c1cccnc1	ZINC000819105391	CC	On-Demand	Anodyne	ADRB3	99	52
COCCCN(C)CCNC[C@H](O)c1cccnc1	ZINC000819105391	CC	On-Demand	Anodyne	KCNA5	15	41
COCCCN(C)CCNC[C@@H](O)c1cccnc1	ZINC000819105392	CC	On-Demand	Anodyne	ADRB2	29	48
COCCCN(C)CCNC[C@@H](O)c1cccnc1	ZINC000819105392	CC	On-Demand	Anodyne	ADRB1	31	49
COCCCN(C)CCNC[C@@H](O)c1cccnc1	ZINC000819105392	CC	On-Demand	Anodyne	ADRB3	99	52
COCCCN(C)CCNC[C@@H](O)c1cccnc1	ZINC000819105392	CC	On-Demand	Anodyne	KCNA5	15	41
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2cnc3cc(OC)ccn23)cc1	ZINC000819105416	GF	On-Demand	Anodyne	UL80	42	38
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2cnc3cc(OC)ccn23)cc1	ZINC000819105416	GF	On-Demand	Anodyne	CFTR	45	38
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2cnc3cc(OC)ccn23)cc1	ZINC000819105417	GF	On-Demand	Anodyne	UL80	42	38
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2cnc3cc(OC)ccn23)cc1	ZINC000819105417	GF	On-Demand	Anodyne	CFTR	45	38
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccccc3)C2=O)cc1	ZINC000819105422	EE	On-Demand	Anodyne	ADRB2	51	43
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccccc3)C2=O)cc1	ZINC000819105422	EE	On-Demand	Anodyne	ADRB1	60	42
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccccc3)C2=O)cc1	ZINC000819105422	EE	On-Demand	Anodyne	ADRB3	44	46
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccccc3)C2=O)cc1	ZINC000819105424	EE	On-Demand	Anodyne	ADRB2	51	43
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccccc3)C2=O)cc1	ZINC000819105424	EE	On-Demand	Anodyne	ADRB1	60	42
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccccc3)C2=O)cc1	ZINC000819105424	EE	On-Demand	Anodyne	ADRB3	44	46
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C[C@@H](C)n2cccn2)cc1	ZINC000819105451	FE	On-Demand	Anodyne	F2	21	43
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C[C@@H](C)n2cccn2)cc1	ZINC000819105451	FE	On-Demand	Anodyne	ELANE	55	39
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C[C@@H](C)n2cccn2)cc1	ZINC000819105451	FE	On-Demand	Anodyne	UL80	46	38
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C[C@@H](C)n2cccn2)cc1	ZINC000819105451	FE	On-Demand	Anodyne	HDAC8	15	41
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C[C@@H](C)n2cccn2)cc1	ZINC000819105451	FE	On-Demand	Anodyne	DPP4	29	43
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C[C@@H](C)n2cccn2)cc1	ZINC000819105451	FE	On-Demand	Anodyne	PREP	55	37
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C[C@@H](C)n2cccn2)cc1	ZINC000819105451	FE	On-Demand	Anodyne	LGMN	68	41
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C[C@@H](C)n2cccn2)cc1	ZINC000819105451	FE	On-Demand	Anodyne	CFTR	51	37
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C[C@@H](C)n2cccn2)cc1	ZINC000819105451	FE	On-Demand	Anodyne	PFKFB3	41	34
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C[C@H](C)n2cccn2)cc1	ZINC000819105452	FE	On-Demand	Anodyne	F2	21	43
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C[C@H](C)n2cccn2)cc1	ZINC000819105452	FE	On-Demand	Anodyne	ELANE	55	39
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C[C@H](C)n2cccn2)cc1	ZINC000819105452	FE	On-Demand	Anodyne	UL80	46	38
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C[C@H](C)n2cccn2)cc1	ZINC000819105452	FE	On-Demand	Anodyne	HDAC8	15	41
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C[C@H](C)n2cccn2)cc1	ZINC000819105452	FE	On-Demand	Anodyne	DPP4	29	43
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C[C@H](C)n2cccn2)cc1	ZINC000819105452	FE	On-Demand	Anodyne	PREP	55	37
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C[C@H](C)n2cccn2)cc1	ZINC000819105452	FE	On-Demand	Anodyne	LGMN	68	41
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C[C@H](C)n2cccn2)cc1	ZINC000819105452	FE	On-Demand	Anodyne	CFTR	51	37
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)C[C@H](C)n2cccn2)cc1	ZINC000819105452	FE	On-Demand	Anodyne	PFKFB3	41	34
CN(C[C@@H](O)CNCc1cc(O)nc2ccccc12)C(=O)OC(C)(C)C	ZINC000819105474	FE	On-Demand	Anodyne	METG	65	33
Cc1cccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)c1	ZINC000819105478	DD	On-Demand	Anodyne	FBP1	16	40
Cc1cccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)c1	ZINC000819105479	DD	On-Demand	Anodyne	FBP1	16	40
CCCNC(=O)c1cccc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819105483	FF	On-Demand	Anodyne	DRD4	40	31
CCCNC(=O)c1cccc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819105483	FF	On-Demand	Anodyne	KCNK3	59	33
O=C(Cc1cnn(-c2ccccc2)c1)Nc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2	ZINC000819105495	JI	On-Demand	Anodyne	KIT	19	41
O=C(Cc1cnn(-c2ccccc2)c1)Nc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2	ZINC000819105495	JI	On-Demand	Anodyne	HCAR2	21	47
O=C(Cc1cnn(-c2ccccc2)c1)Nc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2	ZINC000819105495	JI	On-Demand	Anodyne	BRAF	17	41
COC(=O)C1(NC(=O)c2ccc(OCc3ccccc3)c(OC)c2)CCCCC1	ZINC000819105505	GH	On-Demand	Anodyne	PTGER1	59	37
COC(=O)C1(NC(=O)c2ccc(OCc3ccccc3)c(OC)c2)CCCCC1	ZINC000819105505	GH	On-Demand	Anodyne	NTSR2	27	42
COC(=O)C1(NC(=O)c2ccc(OCc3ccccc3)c(OC)c2)CCCCC1	ZINC000819105505	GH	On-Demand	Anodyne	CTSK	19	44
COC(=O)C1(NC(=O)c2ccc(OCc3ccccc3)c(OC)c2)CCCCC1	ZINC000819105505	GH	On-Demand	Anodyne	SLC6A5	20	52
COC(=O)C1(NC(=O)c2ccc(OCc3ccccc3)c(OC)c2)CCCCC1	ZINC000819105505	GH	On-Demand	Anodyne	SLC12A5	61	36
N#Cc1ccc([C@@H](O)CNC2CC(c3cccc(Cl)c3)C2)cc1	ZINC000819105573	EH	On-Demand	Mild	ADRB3	22	43
N#Cc1ccc([C@H](O)CNC2CC(c3cccc(Cl)c3)C2)cc1	ZINC000819105574	EH	On-Demand	Mild	ADRB3	22	43
CN(C[C@H](O)CNCc1cc(O)nc2ccccc12)C(=O)OC(C)(C)C	ZINC000819105575	FE	On-Demand	Anodyne	METG	65	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccc(-n2cccn2)cc1	ZINC000819105579	FE	On-Demand	Anodyne	AMP1_PLAFQ	45	49
COCCCN(C)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819105625	DD	On-Demand	Anodyne	ADRB2	53	40
COCCCN(C)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819105625	DD	On-Demand	Anodyne	ADRB1	58	47
COCCCN(C)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819105625	DD	On-Demand	Anodyne	ADRB3	66	48
COCCCN(C)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819105626	DD	On-Demand	Anodyne	ADRB2	53	40
COCCCN(C)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819105626	DD	On-Demand	Anodyne	ADRB1	58	47
COCCCN(C)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819105626	DD	On-Demand	Anodyne	ADRB3	66	48
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819105640	EG	On-Demand	Mild	PAPA1_CARPA	45	46
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819105640	EG	On-Demand	Mild	CTSK	18	46
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819105640	EG	On-Demand	Mild	FPR1	46	41
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819105641	EG	On-Demand	Mild	PAPA1_CARPA	45	46
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819105641	EG	On-Demand	Mild	CTSK	18	46
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819105641	EG	On-Demand	Mild	FPR1	46	41
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819105642	EG	On-Demand	Mild	PAPA1_CARPA	45	46
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819105642	EG	On-Demand	Mild	CTSK	18	46
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819105642	EG	On-Demand	Mild	FPR1	46	41
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819105643	EG	On-Demand	Mild	PAPA1_CARPA	45	46
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819105643	EG	On-Demand	Mild	CTSK	18	46
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819105643	EG	On-Demand	Mild	FPR1	46	41
O=C(NC1CCN(c2ncccn2)CC1)c1coc(=O)c2ccccc12	ZINC000819105688	FD	On-Demand	Anodyne	INHA	59	36
O=C(NC1CCN(c2ncccn2)CC1)c1coc(=O)c2ccccc12	ZINC000819105688	FD	On-Demand	Anodyne	CNR2	23	45
CCCNC(=O)c1cccc(NC(=O)[C@@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)c1	ZINC000819105725	FE	On-Demand	Anodyne	DRD4	40	31
CCCNC(=O)c1cccc(NC(=O)[C@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)c1	ZINC000819105726	FE	On-Demand	Anodyne	DRD4	40	31
O[C@H](CNC1CC(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819105740	DI	On-Demand	Anodyne	ADRB3	40	42
O[C@@H](CNC1CC(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819105741	DI	On-Demand	Anodyne	ADRB3	40	42
CCCNC(=O)c1cccc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)c1	ZINC000819105749	FF	On-Demand	Anodyne	DRD4	40	31
CCCNC(=O)c1cccc(NC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)c1	ZINC000819105750	FF	On-Demand	Anodyne	DRD4	40	31
C=C(C)C(C)(C)C(=O)NCC(=O)NCc1ccccc1	ZINC000819105780	CE	On-Demand	Mild	CA5B	16	43
C=C(C)C(C)(C)C(=O)NCC(=O)NCc1ccccc1	ZINC000819105780	CE	On-Demand	Mild	CA5A	19	43
C=C(C)C(C)(C)C(=O)NCC(=O)NCc1ccccc1	ZINC000819105780	CE	On-Demand	Mild	PDS	42	34
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3cccc(C)c3)C2=O)cc1	ZINC000819105812	FE	On-Demand	Anodyne	ADRB2	33	49
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3cccc(C)c3)C2=O)cc1	ZINC000819105812	FE	On-Demand	Anodyne	ADRB1	31	49
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3cccc(C)c3)C2=O)cc1	ZINC000819105812	FE	On-Demand	Anodyne	ADRB3	25	40
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3cccc(C)c3)C2=O)cc1	ZINC000819105813	FE	On-Demand	Anodyne	ADRB2	33	49
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3cccc(C)c3)C2=O)cc1	ZINC000819105813	FE	On-Demand	Anodyne	ADRB1	31	49
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3cccc(C)c3)C2=O)cc1	ZINC000819105813	FE	On-Demand	Anodyne	ADRB3	25	40
CON(C)C(=O)CCNCc1cc(O)nc2ccccc12	ZINC000819105830	CD	On-Demand	Anodyne	METG	85	39
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(OCc2cccnc2)cc1	ZINC000819105857	FH	On-Demand	Anodyne	PTAFR	22	41
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(OCc2cccnc2)cc1	ZINC000819105857	FH	On-Demand	Anodyne	VCP	43	35
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(OCc2cccnc2)cc1	ZINC000819105858	FH	On-Demand	Anodyne	PTAFR	22	41
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(OCc2cccnc2)cc1	ZINC000819105858	FH	On-Demand	Anodyne	VCP	43	35
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(OCc2cccnc2)cc1	ZINC000819105859	FH	On-Demand	Anodyne	PTAFR	22	41
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(OCc2cccnc2)cc1	ZINC000819105859	FH	On-Demand	Anodyne	VCP	43	35
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(OCc2cccnc2)cc1	ZINC000819105860	FH	On-Demand	Anodyne	PTAFR	22	41
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(OCc2cccnc2)cc1	ZINC000819105860	FH	On-Demand	Anodyne	VCP	43	35
CCCNC(=O)c1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819105891	CG	On-Demand	Anodyne	DRD4	42	32
CCCNC(=O)c1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819105891	CG	On-Demand	Anodyne	KCNK3	98	37
CCCNC(=O)c1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819105891	CG	On-Demand	Anodyne	KCNK9	60	37
CCC(CC)c1cc(CNC[C@H](O)c2cccc(Cl)c2)on1	ZINC000819105892	DI	On-Demand	Anodyne	ADRB3	38	41
CCC(CC)c1cc(CNC[C@@H](O)c2cccc(Cl)c2)on1	ZINC000819105893	DI	On-Demand	Anodyne	ADRB3	38	41
CCC(CC)c1cc(CNC[C@H](O)c2cccnc2)on1	ZINC000819105923	CF	On-Demand	Anodyne	ADRB2	19	40
CCC(CC)c1cc(CNC[C@H](O)c2cccnc2)on1	ZINC000819105923	CF	On-Demand	Anodyne	ADRB1	22	43
CCC(CC)c1cc(CNC[C@H](O)c2cccnc2)on1	ZINC000819105923	CF	On-Demand	Anodyne	ADRB3	83	43
CCC(CC)c1cc(CNC[C@@H](O)c2cccnc2)on1	ZINC000819105924	CF	On-Demand	Anodyne	ADRB2	19	40
CCC(CC)c1cc(CNC[C@@H](O)c2cccnc2)on1	ZINC000819105924	CF	On-Demand	Anodyne	ADRB1	22	43
CCC(CC)c1cc(CNC[C@@H](O)c2cccnc2)on1	ZINC000819105924	CF	On-Demand	Anodyne	ADRB3	83	43
CCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819105926	ED	On-Demand	Anodyne	MMP13	52	45
CCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819105926	ED	On-Demand	Anodyne	ADAM17	25	41
CCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819105926	ED	On-Demand	Anodyne	MMP1	17	45
CCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819105927	ED	On-Demand	Anodyne	MMP13	52	45
CCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819105927	ED	On-Demand	Anodyne	ADAM17	25	41
CCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819105927	ED	On-Demand	Anodyne	MMP1	17	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(-n3cccn3)cc1)C2	ZINC000819106019	FE	On-Demand	Anodyne	VHL	48	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(-n3cccn3)cc1)C2	ZINC000819106020	FE	On-Demand	Anodyne	VHL	48	31
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2C[C@@]2(C)c2ccccc2)CC1	ZINC000819106041	FG	On-Demand	Anodyne	GPR119	38	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@@]2(C)c2ccccc2)CC1	ZINC000819106042	FG	On-Demand	Anodyne	GPR119	38	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@]2(C)c2ccccc2)CC1	ZINC000819106043	FG	On-Demand	Anodyne	GPR119	38	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2C[C@]2(C)c2ccccc2)CC1	ZINC000819106044	FG	On-Demand	Anodyne	GPR119	38	47
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2cc3c(cn2)OCCO3)cc1	ZINC000819106069	GE	On-Demand	Anodyne	UL80	40	37
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2cc3c(cn2)OCCO3)cc1	ZINC000819106069	GE	On-Demand	Anodyne	CFTR	40	37
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2cc3c(cn2)OCCO3)cc1	ZINC000819106070	GE	On-Demand	Anodyne	UL80	40	37
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2cc3c(cn2)OCCO3)cc1	ZINC000819106070	GE	On-Demand	Anodyne	CFTR	40	37
N#Cc1ccc(OCCNC[C@H](O)c2cccnc2)cc1	ZINC000819106083	CD	On-Demand	Mild	ADRB2	35	65
N#Cc1ccc(OCCNC[C@H](O)c2cccnc2)cc1	ZINC000819106083	CD	On-Demand	Mild	ADRB1	46	65
N#Cc1ccc(OCCNC[C@H](O)c2cccnc2)cc1	ZINC000819106083	CD	On-Demand	Mild	ADRB3	113	68
N#Cc1ccc(OCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819106084	CD	On-Demand	Mild	ADRB2	35	65
N#Cc1ccc(OCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819106084	CD	On-Demand	Mild	ADRB1	46	65
N#Cc1ccc(OCCNC[C@@H](O)c2cccnc2)cc1	ZINC000819106084	CD	On-Demand	Mild	ADRB3	113	68
N#Cc1cccc(OCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106175	CD	On-Demand	Mild	ESR1	44	40
N#Cc1cccc(OCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106175	CD	On-Demand	Mild	HRH2	41	49
N#Cc1cccc(OCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106175	CD	On-Demand	Mild	SLC6A1	167	43
N#Cc1cccc(OCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106175	CD	On-Demand	Mild	HRH1	17	49
N#Cc1cccc(OCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106175	CD	On-Demand	Mild	ESR2	31	40
N#Cc1cccc(OCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106175	CD	On-Demand	Mild	LTA4H	53	53
N#Cc1cccc(OCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106175	CD	On-Demand	Mild	CYSLTR2	47	32
N#Cc1cccc(OCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106175	CD	On-Demand	Mild	HRH3	40	49
N#Cc1cccc(OCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106175	CD	On-Demand	Mild	SIGMAR1	19	40
N#Cc1cccc(OCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106175	CD	On-Demand	Mild	CCR3	22	49
N#Cc1cccc(OCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106175	CD	On-Demand	Mild	CPT1A	16	40
N#Cc1cccc(OCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106175	CD	On-Demand	Mild	CHRNA10	52	49
N#Cc1cccc(OCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106175	CD	On-Demand	Mild	PSMB1	41	37
N#Cc1cccc(OCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106175	CD	On-Demand	Mild	MEN1	46	39
N#Cc1cccc(OCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106176	CD	On-Demand	Mild	ESR1	44	40
N#Cc1cccc(OCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106176	CD	On-Demand	Mild	HRH2	41	49
N#Cc1cccc(OCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106176	CD	On-Demand	Mild	SLC6A1	167	43
N#Cc1cccc(OCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106176	CD	On-Demand	Mild	HRH1	17	49
N#Cc1cccc(OCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106176	CD	On-Demand	Mild	ESR2	31	40
N#Cc1cccc(OCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106176	CD	On-Demand	Mild	LTA4H	53	53
N#Cc1cccc(OCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106176	CD	On-Demand	Mild	CYSLTR2	47	32
N#Cc1cccc(OCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106176	CD	On-Demand	Mild	HRH3	40	49
N#Cc1cccc(OCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106176	CD	On-Demand	Mild	SIGMAR1	19	40
N#Cc1cccc(OCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106176	CD	On-Demand	Mild	CCR3	22	49
N#Cc1cccc(OCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106176	CD	On-Demand	Mild	CPT1A	16	40
N#Cc1cccc(OCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106176	CD	On-Demand	Mild	CHRNA10	52	49
N#Cc1cccc(OCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106176	CD	On-Demand	Mild	PSMB1	41	37
N#Cc1cccc(OCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106176	CD	On-Demand	Mild	MEN1	46	39
N#Cc1ccc(Oc2ccc(NC(=O)C(=O)N3CC[C@H](C(=O)O)C3)cc2)cc1	ZINC000819106177	GE	On-Demand	Mild	DHODH	25	48
N#Cc1ccc(Oc2ccc(NC(=O)C(=O)N3CC[C@H](C(=O)O)C3)cc2)cc1	ZINC000819106177	GE	On-Demand	Mild	PFKFB3	64	36
N#Cc1ccc(Oc2ccc(NC(=O)C(=O)N3CC[C@@H](C(=O)O)C3)cc2)cc1	ZINC000819106178	GE	On-Demand	Mild	DHODH	25	48
N#Cc1ccc(Oc2ccc(NC(=O)C(=O)N3CC[C@@H](C(=O)O)C3)cc2)cc1	ZINC000819106178	GE	On-Demand	Mild	PFKFB3	64	36
N#Cc1cccc(Oc2ccc(NC(=O)C(=O)N3CC[C@@H](C(=O)O)C3)cn2)c1	ZINC000819106179	GD	On-Demand	Mild	DGAT1	16	40
N#Cc1cccc(Oc2ccc(NC(=O)C(=O)N3CC[C@H](C(=O)O)C3)cn2)c1	ZINC000819106180	GD	On-Demand	Mild	DGAT1	16	40
N#Cc1ccc(Oc2ccc(NC(=O)NCCC(=O)O)cn2)cc1	ZINC000819106181	EE	On-Demand	Mild	ADRB1	50	42
N#Cc1cccc(C(=O)NNC(=O)CN2CCC(C(=O)O)CC2)c1	ZINC000819106184	EC	On-Demand	Reactive	DRD4	40	31
N#Cc1cccc(C(=O)NNC(=O)CN2CCC(C(=O)O)CC2)c1	ZINC000819106184	EC	On-Demand	Reactive	CCR3	17	42
N#Cc1cccc(CC(=O)NCCCCCC(=O)O)c1	ZINC000819106187	CD	On-Demand	Mild	HDAC8	15	40
N#Cc1cccc(CC(=O)NCCCCCC(=O)O)c1	ZINC000819106187	CD	On-Demand	Mild	FFAR1	25	48
N#Cc1cccc(Oc2ccc(NC(=O)NCC(=O)O)cn2)c1	ZINC000819106188	DD	On-Demand	Mild	ADRB1	45	37
N#Cc1ccccc1-c1ccccc1C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819106193	DF	On-Demand	Mild	SLC6A1	89	37
N#Cc1ccccc1-c1ccccc1C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819106193	DF	On-Demand	Mild	L3MBTL3	55	40
N#Cc1ccccc1-c1ccccc1C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819106194	DF	On-Demand	Mild	SLC6A1	89	37
N#Cc1ccccc1-c1ccccc1C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819106194	DF	On-Demand	Mild	L3MBTL3	55	40
N#Cc1ccc(Oc2ccc(NC(=O)NCCCC(=O)O)cc2)cc1	ZINC000819106195	EG	On-Demand	Mild	ADRB1	44	39
N#Cc1ccc(Oc2ccc(NC(=O)NCCCC(=O)O)cc2)cc1	ZINC000819106195	EG	On-Demand	Mild	LTA4H	37	49
N#Cc1ccc(Oc2ccc(NC(=O)NCCCC(=O)O)cc2)cc1	ZINC000819106195	EG	On-Demand	Mild	CA1	38	41
N#Cc1ccc(Oc2ccc(NC(=O)NCCCC(=O)O)cc2)cc1	ZINC000819106195	EG	On-Demand	Mild	CA12	19	51
N#Cc1ccc(Oc2ccc(NC(=O)NCCCC(=O)O)cc2)cc1	ZINC000819106195	EG	On-Demand	Mild	CA9	20	51
N#Cc1ccc(Oc2ccc(NC(=O)NCCCC(=O)O)cc2)cc1	ZINC000819106195	EG	On-Demand	Mild	NCE103	19	41
N#Cc1ccc(Oc2ccc(NC(=O)NCCCC(=O)O)cc2)cc1	ZINC000819106195	EG	On-Demand	Mild	PFKFB3	66	37
N#Cc1cccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819106196	CC	On-Demand	Mild	DHODH	25	41
N#Cc1cccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819106196	CC	On-Demand	Mild	CCR3	18	45
N#Cc1cccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819106197	CC	On-Demand	Mild	DHODH	25	41
N#Cc1cccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819106197	CC	On-Demand	Mild	CCR3	18	45
N#Cc1ccccc1CSCCNC(=O)Nc1ccccc1CC(=O)O	ZINC000819106198	FG	On-Demand	Mild	ADRB1	43	33
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	ACE	46	48
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	MME	120	46
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	ANPEP	59	38
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	CMA1	28	40
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	PTGER3	36	41
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	CTSB	42	42
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	PAPA1_CARPA	50	40
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	CTSL	41	47
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	CPA1	46	44
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	ITGA4	56	33
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	NAALAD2	24	42
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	ECE1	41	44
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	CTSS	21	47
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	CAPN1	30	43
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	CAPN2	20	42
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	ACE2	100	46
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	MMP1	16	56
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	FPR1	74	38
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	CTRB_BOVIN	52	38
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	FFAR1	28	45
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	BLA1_STEMA	79	48
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	BRCA1	50	31
N#Cc1cccc(OCC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106199	DD	On-Demand	Mild	PDS	61	50
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	ACE	46	48
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	MME	120	46
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	ANPEP	59	38
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	CMA1	28	40
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	PTGER3	36	41
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	CTSB	42	42
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	PAPA1_CARPA	50	40
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	CTSL	41	47
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	CPA1	46	44
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	ITGA4	56	33
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	NAALAD2	24	42
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	ECE1	41	44
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	CTSS	21	47
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	CAPN1	30	43
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	CAPN2	20	42
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	ACE2	100	46
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	MMP1	16	56
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	FPR1	74	38
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	CTRB_BOVIN	52	38
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	FFAR1	28	45
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	BLA1_STEMA	79	48
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	BRCA1	50	31
N#Cc1cccc(OCC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106200	DD	On-Demand	Mild	PDS	61	50
N#Cc1cccc(-c2nnc(CN3CCC(C(=O)O)CC3)o2)c1	ZINC000819106205	DD	On-Demand	Mild	CCR3	15	41
N#Cc1cccc(-c2nnc(CN3CCC(C(=O)O)CC3)o2)c1	ZINC000819106205	DD	On-Demand	Mild	MCHR1	29	43
N#Cc1ccc(Oc2cccc(NC(=O)NCC(=O)O)c2)cc1	ZINC000819106206	DF	On-Demand	Mild	CA1	26	48
N#Cc1ccc(Oc2cccc(NC(=O)NCC(=O)O)c2)cc1	ZINC000819106206	DF	On-Demand	Mild	RAF1	27	44
N#Cc1ccc(Oc2cccc(NC(=O)NCC(=O)O)c2)cc1	ZINC000819106206	DF	On-Demand	Mild	F13A1	15	43
N#Cc1ccc(Oc2cccc(NC(=O)NCC(=O)O)c2)cc1	ZINC000819106206	DF	On-Demand	Mild	PFKFB3	65	38
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCC[C@H]3C(=O)O)CC2)cc1	ZINC000819106207	GD	On-Demand	Mild	ACE	27	40
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCC[C@H]3C(=O)O)CC2)cc1	ZINC000819106207	GD	On-Demand	Mild	PREP	50	36
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCC[C@H]3C(=O)O)CC2)cc1	ZINC000819106207	GD	On-Demand	Mild	SFRP1	46	38
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCC[C@H]3C(=O)O)CC2)cc1	ZINC000819106207	GD	On-Demand	Mild	WNT3	41	35
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCC[C@@H]3C(=O)O)CC2)cc1	ZINC000819106208	GD	On-Demand	Mild	ACE	27	40
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCC[C@@H]3C(=O)O)CC2)cc1	ZINC000819106208	GD	On-Demand	Mild	PREP	50	36
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCC[C@@H]3C(=O)O)CC2)cc1	ZINC000819106208	GD	On-Demand	Mild	SFRP1	46	38
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CCC[C@@H]3C(=O)O)CC2)cc1	ZINC000819106208	GD	On-Demand	Mild	WNT3	41	35
N#Cc1cccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819106209	DD	On-Demand	Mild	CCR3	17	44
N#Cc1ccccc1N1CCC(NC(=O)CSCC(=O)O)CC1	ZINC000819106213	ED	On-Demand	Mild	DRD4	15	47
N#Cc1ccccc1N1CCN(C(=O)C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819106214	GD	On-Demand	Mild	KCNQ2	69	40
N#Cc1cccc(-c2nnc(CN3CCC[C@H](CC(=O)O)C3)o2)c1	ZINC000819106215	EE	On-Demand	Mild	CCR3	19	41
N#Cc1cccc(-c2nnc(CN3CCC[C@@H](CC(=O)O)C3)o2)c1	ZINC000819106216	EE	On-Demand	Mild	CCR3	19	41
N#Cc1cccc(OCC(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819106217	DE	On-Demand	Mild	UL80	17	40
N#Cc1cccc(OCC(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819106217	DE	On-Demand	Mild	PLA2G4B	61	40
N#Cc1cccc(OCC(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819106217	DE	On-Demand	Mild	ACR	23	43
N#Cc1cccc(OCC(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819106217	DE	On-Demand	Mild	FFAR1	20	45
N#Cc1cccc(NNC(=O)NCCCC(=O)O)c1	ZINC000819106218	CD	On-Demand	Reactive	CCR3	17	46
N#Cc1cccc(Oc2ccc(NC(=O)NCCCC(=O)O)cn2)c1	ZINC000819106222	EF	On-Demand	Mild	ADRB1	49	41
N#Cc1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)c(F)c1	ZINC000819106223	EE	On-Demand	Mild	CXCL8	29	44
N#Cc1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)c(F)c1	ZINC000819106223	EE	On-Demand	Mild	FFAR4	20	42
O=C(NCc1ccc(-n2cccn2)cc1)C(F)=C1CCC1	ZINC000819106224	CF	On-Demand	Anodyne	AMP1_PLAFQ	62	36
N#Cc1ccc(Oc2ccc(NC(=O)NCCCC(=O)O)cn2)cc1	ZINC000819106233	EF	On-Demand	Mild	ADRB1	48	41
N#Cc1ccccc1COc1cccc(C(=O)NCCCC(=O)O)c1	ZINC000819106235	EF	On-Demand	Mild	DRD4	46	36
N#Cc1ccccc1COc1cccc(C(=O)NCCCC(=O)O)c1	ZINC000819106235	EF	On-Demand	Mild	DRD3	17	40
N#Cc1ccccc1COc1cccc(C(=O)NCCCC(=O)O)c1	ZINC000819106235	EF	On-Demand	Mild	PTGER3	48	36
N#Cc1ccccc1COc1cccc(C(=O)NCCCC(=O)O)c1	ZINC000819106235	EF	On-Demand	Mild	FFAR4	50	34
N#Cc1ccc(Oc2ccc(NC(=O)NCC(=O)O)cc2)cc1	ZINC000819106237	DF	On-Demand	Mild	LTA4H	28	44
N#Cc1ccc(Oc2ccc(NC(=O)NCC(=O)O)cc2)cc1	ZINC000819106237	DF	On-Demand	Mild	CA1	37	41
N#Cc1ccc(Oc2ccc(NC(=O)NCC(=O)O)cc2)cc1	ZINC000819106237	DF	On-Demand	Mild	F7	15	42
N#Cc1ccc(Oc2ccc(NC(=O)NCC(=O)O)cc2)cc1	ZINC000819106237	DF	On-Demand	Mild	CA12	18	52
N#Cc1ccc(Oc2ccc(NC(=O)NCC(=O)O)cc2)cc1	ZINC000819106237	DF	On-Demand	Mild	CA9	19	52
N#Cc1ccc(Oc2ccc(NC(=O)NCC(=O)O)cc2)cc1	ZINC000819106237	DF	On-Demand	Mild	PFKFB3	70	42
N#Cc1ccccc1N1CCCN(C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819106239	GF	On-Demand	Mild	KCNQ2	78	44
N#Cc1cccc(NC(=O)CS(=O)(=O)Cc2ccc(C(=O)O)cc2)c1	ZINC000819106241	FD	On-Demand	Mild	CCR3	16	45
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819106245	GG	On-Demand	Mild	ADAM17	34	45
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819106245	GG	On-Demand	Mild	DPP4	18	40
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819106247	GG	On-Demand	Mild	ADAM17	34	45
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819106247	GG	On-Demand	Mild	DPP4	18	40
N#Cc1ccccc1/C=C\C(=O)N1CCC[C@@H]1C(=O)O	ZINC000819106248	CD	On-Demand	Mild	ACE	49	43
N#Cc1ccccc1/C=C\C(=O)N1CCC[C@@H]1C(=O)O	ZINC000819106248	CD	On-Demand	Mild	DPP4	39	43
N#Cc1ccccc1/C=C\C(=O)N1CCC[C@@H]1C(=O)O	ZINC000819106248	CD	On-Demand	Mild	PREP	82	51
N#Cc1ccccc1/C=C/C(=O)N1CCC[C@@H]1C(=O)O	ZINC000819106250	CD	On-Demand	Mild	ACE	49	43
N#Cc1ccccc1/C=C/C(=O)N1CCC[C@@H]1C(=O)O	ZINC000819106250	CD	On-Demand	Mild	DPP4	39	43
N#Cc1ccccc1/C=C/C(=O)N1CCC[C@@H]1C(=O)O	ZINC000819106250	CD	On-Demand	Mild	PREP	82	51
N#Cc1ccccc1CN1C(=O)CN(CN2CCC[C@@H](CC(=O)O)C2)C1=O	ZINC000819106254	FD	On-Demand	Mild	DPP4	15	42
N#Cc1ccccc1CN1C(=O)CN(CN2CCC[C@H](CC(=O)O)C2)C1=O	ZINC000819106255	FD	On-Demand	Mild	DPP4	15	42
N#Cc1cccc(OCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106256	CE	On-Demand	Mild	ESR1	43	40
N#Cc1cccc(OCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106256	CE	On-Demand	Mild	HRH2	36	42
N#Cc1cccc(OCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106256	CE	On-Demand	Mild	SLC6A1	91	37
N#Cc1cccc(OCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106256	CE	On-Demand	Mild	ESR2	31	40
N#Cc1cccc(OCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106256	CE	On-Demand	Mild	LTA4H	53	47
N#Cc1cccc(OCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106256	CE	On-Demand	Mild	HRH3	39	42
N#Cc1cccc(OCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106256	CE	On-Demand	Mild	CCR3	26	47
N#Cc1cccc(OCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106256	CE	On-Demand	Mild	PPARD	19	44
N#Cc1cccc(OCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106256	CE	On-Demand	Mild	CHRNA10	62	51
N#Cc1cccc(OCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106256	CE	On-Demand	Mild	PSMB1	41	37
N#Cc1cccc(OCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106256	CE	On-Demand	Mild	MEN1	40	37
N#Cc1cccc(OCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106261	CE	On-Demand	Mild	ESR1	43	40
N#Cc1cccc(OCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106261	CE	On-Demand	Mild	HRH2	36	42
N#Cc1cccc(OCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106261	CE	On-Demand	Mild	SLC6A1	91	37
N#Cc1cccc(OCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106261	CE	On-Demand	Mild	ESR2	31	40
N#Cc1cccc(OCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106261	CE	On-Demand	Mild	LTA4H	53	47
N#Cc1cccc(OCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106261	CE	On-Demand	Mild	HRH3	39	42
N#Cc1cccc(OCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106261	CE	On-Demand	Mild	CCR3	26	47
N#Cc1cccc(OCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106261	CE	On-Demand	Mild	PPARD	19	44
N#Cc1cccc(OCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106261	CE	On-Demand	Mild	CHRNA10	62	51
N#Cc1cccc(OCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106261	CE	On-Demand	Mild	PSMB1	41	37
N#Cc1cccc(OCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106261	CE	On-Demand	Mild	MEN1	40	37
N#Cc1ccccc1COc1cccc(C(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819106263	FF	On-Demand	Mild	SLC6A1	93	39
N#Cc1ccccc1COc1cccc(C(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819106265	FF	On-Demand	Mild	SLC6A1	93	39
N#Cc1cccc(COc2ccc(NC(=O)NCC(=O)O)cc2F)c1	ZINC000819106266	EE	On-Demand	Mild	ADRB1	41	33
N#Cc1cccc(COc2ccc(NC(=O)NCC(=O)O)cc2F)c1	ZINC000819106266	EE	On-Demand	Mild	CCR3	15	41
N#Cc1cccc(COc2ccc(NC(=O)NCC(=O)O)cc2F)c1	ZINC000819106266	EE	On-Demand	Mild	MET	19	42
N#Cc1cccc(COc2ccc(NC(=O)NCC(=O)O)cc2F)c1	ZINC000819106266	EE	On-Demand	Mild	MCHR1	18	43
N#Cc1cccc(COc2ccc(NC(=O)NCC(=O)O)cc2F)c1	ZINC000819106266	EE	On-Demand	Mild	FFAR1	25	49
N#Cc1cccc(OCC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106268	CD	On-Demand	Mild	ACE	50	43
N#Cc1cccc(OCC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106268	CD	On-Demand	Mild	FKBP1A	44	36
N#Cc1cccc(OCC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106268	CD	On-Demand	Mild	CPT1A	147	55
N#Cc1cccc(OCC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106268	CD	On-Demand	Mild	CPT2	64	52
N#Cc1cccc(OCC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106268	CD	On-Demand	Mild	DPP4	34	44
N#Cc1cccc(OCC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106268	CD	On-Demand	Mild	PREP	106	41
N#Cc1cccc(OCC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106268	CD	On-Demand	Mild	LGMN	58	36
N#Cc1cccc(OCC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106268	CD	On-Demand	Mild	CHRNA10	75	52
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2nsc3ccccc23)cc1	ZINC000819106275	GG	On-Demand	Anodyne	HCRTR1	15	42
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2nsc3ccccc23)cc1	ZINC000819106275	GG	On-Demand	Anodyne	DPP4	15	42
COc1ccc(NC(=O)[C@H]2CCCN2C(=O)Cc2nsc3ccccc23)cc1	ZINC000819106275	GG	On-Demand	Anodyne	PREP	46	38
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2nsc3ccccc23)cc1	ZINC000819106276	GG	On-Demand	Anodyne	HCRTR1	15	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2nsc3ccccc23)cc1	ZINC000819106276	GG	On-Demand	Anodyne	DPP4	15	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)Cc2nsc3ccccc23)cc1	ZINC000819106276	GG	On-Demand	Anodyne	PREP	46	38
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819106278	FF	On-Demand	Mild	ACE	50	43
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819106278	FF	On-Demand	Mild	SLC6A1	31	41
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819106278	FF	On-Demand	Mild	ADAM17	40	49
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819106278	FF	On-Demand	Mild	CPT1A	45	40
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819106278	FF	On-Demand	Mild	CPT2	41	34
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819106278	FF	On-Demand	Mild	DPP4	37	44
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819106278	FF	On-Demand	Mild	PREP	96	48
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819106278	FF	On-Demand	Mild	LGMN	50	36
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819106280	FF	On-Demand	Mild	ACE	50	43
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819106280	FF	On-Demand	Mild	SLC6A1	31	41
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819106280	FF	On-Demand	Mild	ADAM17	40	49
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819106280	FF	On-Demand	Mild	CPT1A	45	40
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819106280	FF	On-Demand	Mild	CPT2	41	34
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819106280	FF	On-Demand	Mild	DPP4	37	44
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819106280	FF	On-Demand	Mild	PREP	96	48
N#Cc1ccccc1COc1ccc(C(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819106280	FF	On-Demand	Mild	LGMN	50	36
N#Cc1ccccc1COc1cccc(C(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106282	FF	On-Demand	Mild	ACE	47	40
N#Cc1ccccc1COc1cccc(C(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106282	FF	On-Demand	Mild	SLC6A1	52	40
N#Cc1ccccc1COc1cccc(C(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106282	FF	On-Demand	Mild	CPT1A	62	39
N#Cc1ccccc1COc1cccc(C(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106282	FF	On-Demand	Mild	CPT2	42	36
N#Cc1ccccc1COc1cccc(C(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106282	FF	On-Demand	Mild	DPP4	34	42
N#Cc1ccccc1COc1cccc(C(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106282	FF	On-Demand	Mild	PREP	94	48
N#Cc1ccccc1COc1cccc(C(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106282	FF	On-Demand	Mild	LGMN	56	35
N#Cc1ccccc1COc1cccc(C(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106282	FF	On-Demand	Mild	CFTR	42	36
N#Cc1ccccc1COc1cccc(C(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106282	FF	On-Demand	Mild	CHRNA10	54	38
N#Cc1ccc(Oc2ccc(NC(=O)NCCC(=O)O)cc2Cl)cc1	ZINC000819106284	FH	On-Demand	Mild	ADRB1	42	36
N#Cc1ccc(Oc2ccc(NC(=O)NCCC(=O)O)cc2Cl)cc1	ZINC000819106284	FH	On-Demand	Mild	Q25615_ONCVO	17	42
N#Cc1cccc(NNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819106299	DE	On-Demand	Reactive	CCR3	15	42
N#Cc1cccc(OCCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106301	DF	On-Demand	Mild	DRD2	19	47
N#Cc1cccc(OCCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106301	DF	On-Demand	Mild	HRH2	39	47
N#Cc1cccc(OCCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106301	DF	On-Demand	Mild	SLC6A1	87	36
N#Cc1cccc(OCCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106301	DF	On-Demand	Mild	SLC6A4	15	41
N#Cc1cccc(OCCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106301	DF	On-Demand	Mild	DRD3	15	47
N#Cc1cccc(OCCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106301	DF	On-Demand	Mild	LTA4H	27	42
N#Cc1cccc(OCCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106301	DF	On-Demand	Mild	HRH3	95	47
N#Cc1cccc(OCCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106301	DF	On-Demand	Mild	SIGMAR1	23	44
N#Cc1cccc(OCCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106301	DF	On-Demand	Mild	NPY1R	40	33
N#Cc1cccc(OCCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106301	DF	On-Demand	Mild	CCR3	28	51
N#Cc1cccc(OCCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106301	DF	On-Demand	Mild	PPARD	22	45
N#Cc1cccc(OCCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106301	DF	On-Demand	Mild	EPHX2	17	44
N#Cc1cccc(OCCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106301	DF	On-Demand	Mild	CHRNA10	56	50
N#Cc1cccc(OCCCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106301	DF	On-Demand	Mild	MEN1	52	43
N#Cc1cccc(OCCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106302	DF	On-Demand	Mild	DRD2	19	47
N#Cc1cccc(OCCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106302	DF	On-Demand	Mild	HRH2	39	47
N#Cc1cccc(OCCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106302	DF	On-Demand	Mild	SLC6A1	87	36
N#Cc1cccc(OCCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106302	DF	On-Demand	Mild	SLC6A4	15	41
N#Cc1cccc(OCCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106302	DF	On-Demand	Mild	DRD3	15	47
N#Cc1cccc(OCCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106302	DF	On-Demand	Mild	LTA4H	27	42
N#Cc1cccc(OCCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106302	DF	On-Demand	Mild	HRH3	95	47
N#Cc1cccc(OCCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106302	DF	On-Demand	Mild	SIGMAR1	23	44
N#Cc1cccc(OCCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106302	DF	On-Demand	Mild	NPY1R	40	33
N#Cc1cccc(OCCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106302	DF	On-Demand	Mild	CCR3	28	51
N#Cc1cccc(OCCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106302	DF	On-Demand	Mild	PPARD	22	45
N#Cc1cccc(OCCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106302	DF	On-Demand	Mild	EPHX2	17	44
N#Cc1cccc(OCCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106302	DF	On-Demand	Mild	CHRNA10	56	50
N#Cc1cccc(OCCCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106302	DF	On-Demand	Mild	MEN1	52	43
N#Cc1cccc(CC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819106304	CD	On-Demand	Mild	CCR3	18	40
N#Cc1cccc(CC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819106304	CD	On-Demand	Mild	MLNR	29	45
N#Cc1cccc(CC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819106304	CD	On-Demand	Mild	DPP7	17	46
N#Cc1cccc(CC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819106309	CD	On-Demand	Mild	CCR3	18	40
N#Cc1cccc(CC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819106309	CD	On-Demand	Mild	MLNR	29	45
N#Cc1cccc(CC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819106309	CD	On-Demand	Mild	DPP7	17	46
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	HTR1A	34	51
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	DRD2	42	45
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	DRD4	41	31
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	HRH2	48	51
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	HTR2A	34	45
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	SLC6A1	64	35
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	SLC6A4	22	44
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	HRH1	30	60
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	DRD3	34	45
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	AVPR1B	47	37
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	KCNH2	21	40
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	LTA4H	46	54
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	HRH3	108	57
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	SIGMAR1	39	42
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	NPY1R	45	35
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	CCR3	28	60
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	CPT1A	20	40
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	EPHX2	25	45
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	CHRNA10	53	50
N#Cc1cccc(OCCCN2CCC(C(=O)O)CC2)c1	ZINC000819106311	CE	On-Demand	Mild	MEN1	60	49
N#Cc1cccc(NC(=O)C[S@@](=O)Cc2ccc(C(=O)O)cc2)c1	ZINC000819106313	EE	On-Demand	Mild	CCR3	15	42
N#Cc1cccc(NC(=O)C[S@](=O)Cc2ccc(C(=O)O)cc2)c1	ZINC000819106315	EE	On-Demand	Mild	CCR3	15	42
N#Cc1cccc(OCC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819106316	CC	On-Demand	Mild	CPT1A	122	49
N#Cc1cccc(OCC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819106316	CC	On-Demand	Mild	CPT2	50	41
N#Cc1cccc(OCC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819106316	CC	On-Demand	Mild	CHRNA10	48	46
N#Cc1cccc(OCC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819106318	CC	On-Demand	Mild	CPT1A	122	49
N#Cc1cccc(OCC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819106318	CC	On-Demand	Mild	CPT2	50	41
N#Cc1cccc(OCC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819106318	CC	On-Demand	Mild	CHRNA10	48	46
N#Cc1cccc(CC(=O)Nc2cccc(CC(=O)O)c2)c1	ZINC000819106324	CE	On-Demand	Mild	CCR3	16	47
N#Cc1cccc(OCC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819106329	DD	On-Demand	Mild	UL80	31	49
N#Cc1cccc(OCC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819106329	DD	On-Demand	Mild	PLA2G4B	60	40
N#Cc1cccc(OCC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819106329	DD	On-Demand	Mild	FFAR1	18	45
N#Cc1cccc(OCC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819106329	DD	On-Demand	Mild	PDS	63	53
N#Cc1cccc(C(=O)NNC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106333	ED	On-Demand	Reactive	CCR3	17	40
N#Cc1cccc(C(=O)NNC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106335	ED	On-Demand	Reactive	CCR3	17	40
N#Cc1cccc(NC(=O)CCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106339	DE	On-Demand	Mild	CCR3	57	59
N#Cc1cccc(NC(=O)CCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106339	DE	On-Demand	Mild	MCHR1	48	44
N#Cc1cccc(NC(=O)CCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106340	DE	On-Demand	Mild	CCR3	57	59
N#Cc1cccc(NC(=O)CCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106340	DE	On-Demand	Mild	MCHR1	48	44
N#Cc1cccc(OCc2ccoc2C(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106341	FG	On-Demand	Mild	CHRNA10	19	42
N#Cc1cccc(OCc2ccoc2C(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106342	FG	On-Demand	Mild	CHRNA10	19	42
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(NS(C)(=O)=O)c1	ZINC000819106363	ED	On-Demand	Anodyne	KCNQ2	48	34
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(NS(C)(=O)=O)c1	ZINC000819106364	ED	On-Demand	Anodyne	KCNQ2	48	34
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(NS(C)(=O)=O)c1	ZINC000819106365	ED	On-Demand	Anodyne	KCNQ2	48	34
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(NS(C)(=O)=O)c1	ZINC000819106366	ED	On-Demand	Anodyne	KCNQ2	48	34
N#Cc1cccc(CC(=O)N[C@H](C(=O)O)c2ccccc2)c1	ZINC000819106396	CE	On-Demand	Mild	CTSL	18	43
N#Cc1cccc(CC(=O)N[C@H](C(=O)O)c2ccccc2)c1	ZINC000819106396	CE	On-Demand	Mild	GSTP1	16	42
N#Cc1ccccc1COc1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819106398	FF	On-Demand	Mild	SLC6A1	80	40
N#Cc1ccccc1COc1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819106398	FF	On-Demand	Mild	LTA4H	17	40
N#Cc1ccccc1COc1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819106398	FF	On-Demand	Mild	HRH3	20	40
N#Cc1ccccc1COc1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819106398	FF	On-Demand	Mild	ADAM17	48	47
N#Cc1ccccc1COc1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819106398	FF	On-Demand	Mild	SLC18A3	23	44
N#Cc1ccccc1COc1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819106398	FF	On-Demand	Mild	L3MBTL3	61	36
N#Cc1ccccc1COc1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819106400	FF	On-Demand	Mild	SLC6A1	80	40
N#Cc1ccccc1COc1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819106400	FF	On-Demand	Mild	LTA4H	17	40
N#Cc1ccccc1COc1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819106400	FF	On-Demand	Mild	HRH3	20	40
N#Cc1ccccc1COc1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819106400	FF	On-Demand	Mild	ADAM17	48	47
N#Cc1ccccc1COc1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819106400	FF	On-Demand	Mild	SLC18A3	23	44
N#Cc1ccccc1COc1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819106400	FF	On-Demand	Mild	L3MBTL3	61	36
N#Cc1cccc(CC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106401	CD	On-Demand	Mild	CCR3	18	43
N#Cc1cccc(CC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106401	CD	On-Demand	Mild	PREP	42	34
N#Cc1cccc(CC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106401	CD	On-Demand	Mild	MLNR	17	41
N#Cc1cccc(CC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106402	CD	On-Demand	Mild	CCR3	18	43
N#Cc1cccc(CC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106402	CD	On-Demand	Mild	PREP	42	34
N#Cc1cccc(CC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106402	CD	On-Demand	Mild	MLNR	17	41
N#Cc1cccc(C(=O)NNC(=O)CN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106403	EC	On-Demand	Reactive	CCR3	21	45
N#Cc1cccc(C(=O)NNC(=O)CN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106405	EC	On-Demand	Reactive	CCR3	21	45
N#Cc1cccc(C(=O)NNC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106407	DB	On-Demand	Reactive	SLC6A1	113	37
N#Cc1cccc(C(=O)NNC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106407	DB	On-Demand	Reactive	CCR3	18	41
N#Cc1cccc(C(=O)NNC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819106409	DB	On-Demand	Reactive	SLC6A1	113	37
N#Cc1cccc(C(=O)NNC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819106409	DB	On-Demand	Reactive	CCR3	18	41
N#Cc1ccccc1/C=C\C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819106410	CD	On-Demand	Mild	SLC6A1	81	37
N#Cc1ccccc1/C=C\C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819106410	CD	On-Demand	Mild	ITGAL	50	42
N#Cc1ccccc1/C=C/C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819106411	CD	On-Demand	Mild	SLC6A1	81	37
N#Cc1ccccc1/C=C/C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819106411	CD	On-Demand	Mild	ITGAL	50	42
N#Cc1ccccc1/C=C\C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819106412	CD	On-Demand	Mild	SLC6A1	81	37
N#Cc1ccccc1/C=C\C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819106412	CD	On-Demand	Mild	ITGAL	50	42
N#Cc1ccccc1/C=C/C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819106413	CD	On-Demand	Mild	SLC6A1	81	37
N#Cc1ccccc1/C=C/C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819106413	CD	On-Demand	Mild	ITGAL	50	42
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	ACE	60	55
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	FOLH1	17	43
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	MME	151	52
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	ANPEP	72	40
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	CMA1	29	42
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	FCER2	47	35
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	CTSB	55	44
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	PAPA1_CARPA	65	48
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	CYSP_TRYCR	47	34
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	CTSF	46	34
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	CTSL	56	57
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	CPA1	73	48
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	NPFFR2	23	40
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	ITGA4	59	35
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	NAALAD2	32	47
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	CAPNS1	43	36
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	MMP2	15	49
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	ECE1	56	44
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	CTSS	25	57
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	CAPN1	50	49
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	MMP9	18	45
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	ACE2	106	50
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	CTSC	41	40
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	CTSV	46	40
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	MMP1	21	43
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	FPR1	81	42
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	CTRB_BOVIN	62	39
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	FFAR1	25	47
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	BLA1_STEMA	85	48
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	BRCA1	43	30
N#Cc1cccc(CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106414	DD	On-Demand	Mild	NPFFR1	32	40
O=C(CNC(=O)Nc1ccccc1)Nc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2	ZINC000819106415	IG	On-Demand	Anodyne	KIT	19	43
O=C(CNC(=O)Nc1ccccc1)Nc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2	ZINC000819106415	IG	On-Demand	Anodyne	F7	23	47
O=C(CNC(=O)Nc1ccccc1)Nc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2	ZINC000819106415	IG	On-Demand	Anodyne	BRAF	17	43
O=C(CNC(=O)Nc1ccccc1)Nc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2	ZINC000819106415	IG	On-Demand	Anodyne	NR2E3	43	30
O=C(CNC(=O)Nc1ccccc1)Nc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2	ZINC000819106415	IG	On-Demand	Anodyne	KCNK3	56	36
O=C(CNC(=O)Nc1ccccc1)Nc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2	ZINC000819106415	IG	On-Demand	Anodyne	KCNK9	43	32
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	ACE	60	55
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	FOLH1	17	43
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	MME	151	52
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	ANPEP	72	40
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	CMA1	29	42
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	FCER2	47	35
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	CTSB	55	44
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	PAPA1_CARPA	65	48
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	CYSP_TRYCR	47	34
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	CTSF	46	34
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	CTSL	56	57
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	CPA1	73	48
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	NPFFR2	23	40
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	ITGA4	59	35
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	NAALAD2	32	47
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	CAPNS1	43	36
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	MMP2	15	49
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	ECE1	56	44
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	CTSS	25	57
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	CAPN1	50	49
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	MMP9	18	45
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	ACE2	106	50
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	CTSC	41	40
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	CTSV	46	40
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	MMP1	21	43
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	FPR1	81	42
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	CTRB_BOVIN	62	39
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	FFAR1	25	47
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	BLA1_STEMA	85	48
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	BRCA1	43	30
N#Cc1cccc(CC(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819106416	DD	On-Demand	Mild	NPFFR1	32	40
N#Cc1cccc(SCC(=O)O)c1	ZINC000819106417	AD	On-Demand	Mild	FFAR1	18	49
N#Cc1cccc(Oc2ccc(NC(=O)N3CC[C@@H](C(=O)O)C3)cn2)c1	ZINC000819106420	FF	On-Demand	Mild	DGAT1	21	41
N#Cc1cccc(Oc2ccc(NC(=O)N3CC[C@H](C(=O)O)C3)cn2)c1	ZINC000819106422	FF	On-Demand	Mild	DGAT1	21	41
N#Cc1cccc(CC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819106423	CE	On-Demand	Mild	CXCL8	26	40
N#Cc1cccc(CC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819106423	CE	On-Demand	Mild	KCNQ2	22	40
N#Cc1cccc(CC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819106423	CE	On-Demand	Mild	CCR3	16	48
N#Cc1cccc(CC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819106423	CE	On-Demand	Mild	FFAR1	15	44
N#Cc1cccc(CC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106425	CD	On-Demand	Mild	ACE	61	47
N#Cc1cccc(CC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106425	CD	On-Demand	Mild	FKBP1A	40	36
N#Cc1cccc(CC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106425	CD	On-Demand	Mild	OPRK1	17	40
N#Cc1cccc(CC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106425	CD	On-Demand	Mild	MME	17	43
N#Cc1cccc(CC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106425	CD	On-Demand	Mild	CCR3	17	40
N#Cc1cccc(CC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106425	CD	On-Demand	Mild	CPT2	42	36
N#Cc1cccc(CC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106425	CD	On-Demand	Mild	DPP4	46	52
N#Cc1cccc(CC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106425	CD	On-Demand	Mild	PREP	125	45
N#Cc1cccc(CC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106425	CD	On-Demand	Mild	LGMN	66	38
N#Cc1cccc(CC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819106425	CD	On-Demand	Mild	TMPRSS11D	51	37
N#Cc1cccc(CC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819106427	CD	On-Demand	Mild	ACE	61	47
N#Cc1cccc(CC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819106427	CD	On-Demand	Mild	FKBP1A	40	36
N#Cc1cccc(CC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819106427	CD	On-Demand	Mild	OPRK1	17	40
N#Cc1cccc(CC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819106427	CD	On-Demand	Mild	MME	17	43
N#Cc1cccc(CC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819106427	CD	On-Demand	Mild	CCR3	17	40
N#Cc1cccc(CC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819106427	CD	On-Demand	Mild	CPT2	42	36
N#Cc1cccc(CC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819106427	CD	On-Demand	Mild	DPP4	46	52
N#Cc1cccc(CC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819106427	CD	On-Demand	Mild	PREP	125	45
N#Cc1cccc(CC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819106427	CD	On-Demand	Mild	LGMN	66	38
N#Cc1cccc(CC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819106427	CD	On-Demand	Mild	TMPRSS11D	51	37
N#Cc1cccc(OCCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106428	CD	On-Demand	Mild	HTR1A	17	47
N#Cc1cccc(OCCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106428	CD	On-Demand	Mild	DRD2	27	43
N#Cc1cccc(OCCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106428	CD	On-Demand	Mild	DRD4	15	41
N#Cc1cccc(OCCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106428	CD	On-Demand	Mild	HRH2	42	54
N#Cc1cccc(OCCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106428	CD	On-Demand	Mild	HTR2A	25	42
N#Cc1cccc(OCCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106428	CD	On-Demand	Mild	SLC6A1	163	43
N#Cc1cccc(OCCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106428	CD	On-Demand	Mild	SLC6A4	18	43
N#Cc1cccc(OCCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106428	CD	On-Demand	Mild	HRH1	16	56
N#Cc1cccc(OCCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106428	CD	On-Demand	Mild	DRD3	19	43
N#Cc1cccc(OCCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106428	CD	On-Demand	Mild	LTA4H	31	47
N#Cc1cccc(OCCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106428	CD	On-Demand	Mild	CYSLTR2	49	34
N#Cc1cccc(OCCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106428	CD	On-Demand	Mild	HRH3	88	54
N#Cc1cccc(OCCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106428	CD	On-Demand	Mild	SIGMAR1	26	43
N#Cc1cccc(OCCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106428	CD	On-Demand	Mild	NPY1R	40	35
N#Cc1cccc(OCCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106428	CD	On-Demand	Mild	CCR3	23	56
N#Cc1cccc(OCCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106428	CD	On-Demand	Mild	EPHX2	20	42
N#Cc1cccc(OCCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106428	CD	On-Demand	Mild	CHRNA10	50	48
N#Cc1cccc(OCCCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106428	CD	On-Demand	Mild	MEN1	56	45
N#Cc1cccc(OCCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106429	CD	On-Demand	Mild	HTR1A	17	47
N#Cc1cccc(OCCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106429	CD	On-Demand	Mild	DRD2	27	43
N#Cc1cccc(OCCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106429	CD	On-Demand	Mild	DRD4	15	41
N#Cc1cccc(OCCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106429	CD	On-Demand	Mild	HRH2	42	54
N#Cc1cccc(OCCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106429	CD	On-Demand	Mild	HTR2A	25	42
N#Cc1cccc(OCCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106429	CD	On-Demand	Mild	SLC6A1	163	43
N#Cc1cccc(OCCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106429	CD	On-Demand	Mild	SLC6A4	18	43
N#Cc1cccc(OCCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106429	CD	On-Demand	Mild	HRH1	16	56
N#Cc1cccc(OCCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106429	CD	On-Demand	Mild	DRD3	19	43
N#Cc1cccc(OCCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106429	CD	On-Demand	Mild	LTA4H	31	47
N#Cc1cccc(OCCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106429	CD	On-Demand	Mild	CYSLTR2	49	34
N#Cc1cccc(OCCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106429	CD	On-Demand	Mild	HRH3	88	54
N#Cc1cccc(OCCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106429	CD	On-Demand	Mild	SIGMAR1	26	43
N#Cc1cccc(OCCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106429	CD	On-Demand	Mild	NPY1R	40	35
N#Cc1cccc(OCCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106429	CD	On-Demand	Mild	CCR3	23	56
N#Cc1cccc(OCCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106429	CD	On-Demand	Mild	EPHX2	20	42
N#Cc1cccc(OCCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106429	CD	On-Demand	Mild	CHRNA10	50	48
N#Cc1cccc(OCCCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106429	CD	On-Demand	Mild	MEN1	56	45
N#Cc1ccccc1-c1ccccc1C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819106430	FH	On-Demand	Mild	MTTP	25	45
N#Cc1cccc(Oc2ccc(NC(=O)NCCC(=O)O)cn2)c1	ZINC000819106432	EE	On-Demand	Mild	ADRB1	50	42
N#Cc1ccc(Oc2cccc(C(=O)N3CCC[C@@H](CC(=O)O)C3)c2)cc1	ZINC000819106436	FH	On-Demand	Mild	HRH3	27	46
N#Cc1ccc(Oc2cccc(C(=O)N3CCC[C@@H](CC(=O)O)C3)c2)cc1	ZINC000819106436	FH	On-Demand	Mild	CPT1A	16	43
N#Cc1ccc(Oc2cccc(C(=O)N3CCC[C@@H](CC(=O)O)C3)c2)cc1	ZINC000819106436	FH	On-Demand	Mild	PREP	44	40
N#Cc1ccc(Oc2cccc(C(=O)N3CCC[C@@H](CC(=O)O)C3)c2)cc1	ZINC000819106436	FH	On-Demand	Mild	MMP9	15	50
N#Cc1ccc(Oc2cccc(C(=O)N3CCC[C@@H](CC(=O)O)C3)c2)cc1	ZINC000819106436	FH	On-Demand	Mild	PFKFB3	43	33
N#Cc1ccc(Oc2cccc(C(=O)N3CCC[C@H](CC(=O)O)C3)c2)cc1	ZINC000819106438	FH	On-Demand	Mild	HRH3	27	46
N#Cc1ccc(Oc2cccc(C(=O)N3CCC[C@H](CC(=O)O)C3)c2)cc1	ZINC000819106438	FH	On-Demand	Mild	CPT1A	16	43
N#Cc1ccc(Oc2cccc(C(=O)N3CCC[C@H](CC(=O)O)C3)c2)cc1	ZINC000819106438	FH	On-Demand	Mild	PREP	44	40
N#Cc1ccc(Oc2cccc(C(=O)N3CCC[C@H](CC(=O)O)C3)c2)cc1	ZINC000819106438	FH	On-Demand	Mild	MMP9	15	50
N#Cc1ccc(Oc2cccc(C(=O)N3CCC[C@H](CC(=O)O)C3)c2)cc1	ZINC000819106438	FH	On-Demand	Mild	PFKFB3	43	33
N#Cc1cccc(CC(=O)NCC(=O)O)c1	ZINC000819106441	BC	On-Demand	Mild	FFAR1	16	48
N#Cc1ccccc1COc1ccc(C(=O)NCCCC(=O)O)cc1	ZINC000819106444	EF	On-Demand	Mild	DRD3	21	40
N#Cc1ccccc1COc1ccc(C(=O)NCCCC(=O)O)cc1	ZINC000819106444	EF	On-Demand	Mild	CYSLTR1	16	43
N#Cc1ccccc1COc1ccc(C(=O)NCCCC(=O)O)cc1	ZINC000819106444	EF	On-Demand	Mild	CYSLTR2	56	34
N#Cc1ccccc1COc1ccc(C(=O)NCCCC(=O)O)cc1	ZINC000819106444	EF	On-Demand	Mild	PTGER3	40	34
N#Cc1ccccc1COc1ccc(C(=O)NCCCC(=O)O)cc1	ZINC000819106444	EF	On-Demand	Mild	ADAM17	33	45
N#Cc1ccccc1COc1ccc(C(=O)NCCCC(=O)O)cc1	ZINC000819106444	EF	On-Demand	Mild	FFAR1	35	42
N#Cc1ccccc1COc1ccc(C(=O)NCCCC(=O)O)cc1	ZINC000819106444	EF	On-Demand	Mild	FFAR4	62	40
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CC[C@H](C(=O)O)C3)CC2)cc1	ZINC000819106445	GC	On-Demand	Mild	EPHX2	21	43
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CC[C@H](C(=O)O)C3)CC2)cc1	ZINC000819106445	GC	On-Demand	Mild	TGM2	44	42
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CC[C@H](C(=O)O)C3)CC2)cc1	ZINC000819106445	GC	On-Demand	Mild	F13A1	55	42
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CC[C@@H](C(=O)O)C3)CC2)cc1	ZINC000819106446	GC	On-Demand	Mild	EPHX2	21	43
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CC[C@@H](C(=O)O)C3)CC2)cc1	ZINC000819106446	GC	On-Demand	Mild	TGM2	44	42
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)N3CC[C@@H](C(=O)O)C3)CC2)cc1	ZINC000819106446	GC	On-Demand	Mild	F13A1	55	42
N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@H]3C(=O)O)cc2)cc1	ZINC000819106450	FG	On-Demand	Mild	ACE	46	38
N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@H]3C(=O)O)cc2)cc1	ZINC000819106450	FG	On-Demand	Mild	UL80	37	41
N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@H]3C(=O)O)cc2)cc1	ZINC000819106450	FG	On-Demand	Mild	DPP4	19	52
N#Cc1ccc(Oc2ccc(NC(=O)N3CCC[C@H]3C(=O)O)cc2)cc1	ZINC000819106450	FG	On-Demand	Mild	PFKFB3	78	39
N#Cc1cccc(Oc2ccc(NC(=O)NCC(=O)O)cc2)c1	ZINC000819106452	DF	On-Demand	Mild	LTA4H	30	45
N#Cc1cccc(Oc2ccc(NC(=O)NCC(=O)O)cc2)c1	ZINC000819106452	DF	On-Demand	Mild	CA1	45	45
N#Cc1cccc(Oc2ccc(NC(=O)NCC(=O)O)cc2)c1	ZINC000819106452	DF	On-Demand	Mild	RAF1	33	41
N#Cc1cccc(Oc2ccc(NC(=O)NCC(=O)O)cc2)c1	ZINC000819106452	DF	On-Demand	Mild	F7	15	44
N#Cc1cccc(Oc2ccc(NC(=O)NCC(=O)O)cc2)c1	ZINC000819106452	DF	On-Demand	Mild	ACR	21	48
N#Cc1cccc(Oc2ccc(NC(=O)NCC(=O)O)cc2)c1	ZINC000819106452	DF	On-Demand	Mild	CA12	21	45
N#Cc1cccc(Oc2ccc(NC(=O)NCC(=O)O)cc2)c1	ZINC000819106452	DF	On-Demand	Mild	CA9	22	45
N#Cc1cccc(Oc2ccc(NC(=O)NCC(=O)O)cc2)c1	ZINC000819106452	DF	On-Demand	Mild	MCHR1	19	42
N#Cc1cccc(Oc2ccc(NC(=O)NCC(=O)O)cc2)c1	ZINC000819106452	DF	On-Demand	Mild	PFKFB3	74	40
N#Cc1cccc(NNC(=O)NCCC(=O)O)c1	ZINC000819106454	BC	On-Demand	Reactive	CCR3	15	44
N#Cc1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1C(F)(F)F	ZINC000819106455	GG	On-Demand	Mild	AR	54	43
N#Cc1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1C(F)(F)F	ZINC000819106455	GG	On-Demand	Mild	PRTN3	51	33
N#Cc1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1C(F)(F)F	ZINC000819106455	GG	On-Demand	Mild	SFRP1	110	34
N#Cc1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1C(F)(F)F	ZINC000819106455	GG	On-Demand	Mild	WNT3	75	32
N#Cc1cccc(OCC(=O)N[C@H](C(=O)O)c2ccccc2)c1	ZINC000819106456	DD	On-Demand	Mild	PDS	28	46
N#Cc1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)c([N+](=O)[O-])c1	ZINC000819106458	FD	On-Demand	Mild	COLA	79	32
N#Cc1cccc(-c2nnc(CN3CC[C@@H](C(=O)O)C3)o2)c1	ZINC000819106461	CD	On-Demand	Mild	SLC6A1	65	36
N#Cc1cccc(-c2nnc(CN3CC[C@@H](C(=O)O)C3)o2)c1	ZINC000819106461	CD	On-Demand	Mild	S1PR4	16	40
N#Cc1cccc(-c2nnc(CN3CC[C@@H](C(=O)O)C3)o2)c1	ZINC000819106461	CD	On-Demand	Mild	S1PR1	22	40
N#Cc1cccc(-c2nnc(CN3CC[C@@H](C(=O)O)C3)o2)c1	ZINC000819106461	CD	On-Demand	Mild	MCHR1	28	40
N#Cc1cccc(-c2nnc(CN3CC[C@@H](C(=O)O)C3)o2)c1	ZINC000819106461	CD	On-Demand	Mild	PDE8B	42	30
N#Cc1cccc(-c2nnc(CN3CC[C@H](C(=O)O)C3)o2)c1	ZINC000819106462	CD	On-Demand	Mild	SLC6A1	65	36
N#Cc1cccc(-c2nnc(CN3CC[C@H](C(=O)O)C3)o2)c1	ZINC000819106462	CD	On-Demand	Mild	S1PR4	16	40
N#Cc1cccc(-c2nnc(CN3CC[C@H](C(=O)O)C3)o2)c1	ZINC000819106462	CD	On-Demand	Mild	S1PR1	22	40
N#Cc1cccc(-c2nnc(CN3CC[C@H](C(=O)O)C3)o2)c1	ZINC000819106462	CD	On-Demand	Mild	MCHR1	28	40
N#Cc1cccc(-c2nnc(CN3CC[C@H](C(=O)O)C3)o2)c1	ZINC000819106462	CD	On-Demand	Mild	PDE8B	42	30
N#Cc1cccc(CC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819106466	CE	On-Demand	Mild	UL80	28	41
N#Cc1cccc(CC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819106466	CE	On-Demand	Mild	CA5A	15	43
N#Cc1cccc(CC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819106466	CE	On-Demand	Mild	FURIN	46	34
N#Cc1cccc(CC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819106466	CE	On-Demand	Mild	CTRB_BOVIN	46	35
N#Cc1cccc(CC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819106466	CE	On-Demand	Mild	PDS	33	44
N#Cc1cccc(CC(=O)NCCC(=O)O)c1	ZINC000819106467	BC	On-Demand	Mild	MME	19	42
N#Cc1cccc(CC(=O)NCCC(=O)O)c1	ZINC000819106467	BC	On-Demand	Mild	FFAR1	39	52
N#Cc1ccc(S(=O)(=O)NCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819106470	FD	On-Demand	Mild	CA2	15	45
N#Cc1ccc(S(=O)(=O)NCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819106470	FD	On-Demand	Mild	TBXA2R	16	42
N#Cc1ccc(S(=O)(=O)NCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819106470	FD	On-Demand	Mild	CTRB_BOVIN	45	33
N#Cc1cccc(OCCCCC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106474	EF	On-Demand	Mild	CYSLTR2	46	33
N#Cc1cccc(OCCCCC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106474	EF	On-Demand	Mild	PPARD	19	43
N#Cc1cccc(OCCCCC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106474	EF	On-Demand	Mild	CHRNA10	32	45
N#Cc1cccc(OCCCCC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106476	EF	On-Demand	Mild	CYSLTR2	46	33
N#Cc1cccc(OCCCCC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106476	EF	On-Demand	Mild	PPARD	19	43
N#Cc1cccc(OCCCCC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106476	EF	On-Demand	Mild	CHRNA10	32	45
N#Cc1cccc(CNC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106477	CC	On-Demand	Mild	SLC6A1	83	35
N#Cc1cccc(CNC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106477	CC	On-Demand	Mild	CHRM3	15	45
N#Cc1cccc(CNC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106477	CC	On-Demand	Mild	SIGMAR1	17	45
N#Cc1cccc(CNC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106477	CC	On-Demand	Mild	CCR3	25	47
N#Cc1cccc(CNC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106477	CC	On-Demand	Mild	MCHR1	40	44
N#Cc1cccc(CNC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819106478	CC	On-Demand	Mild	SLC6A1	83	35
N#Cc1cccc(CNC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819106478	CC	On-Demand	Mild	CHRM3	15	45
N#Cc1cccc(CNC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819106478	CC	On-Demand	Mild	SIGMAR1	17	45
N#Cc1cccc(CNC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819106478	CC	On-Demand	Mild	CCR3	25	47
N#Cc1cccc(CNC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819106478	CC	On-Demand	Mild	MCHR1	40	44
N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@H](C(=O)O)C3)cc2)cc1	ZINC000819106480	FG	On-Demand	Mild	DHODH	18	45
N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@H](C(=O)O)C3)cc2)cc1	ZINC000819106480	FG	On-Demand	Mild	PDGFRB	38	42
N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@H](C(=O)O)C3)cc2)cc1	ZINC000819106480	FG	On-Demand	Mild	S1PR2	17	43
N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@H](C(=O)O)C3)cc2)cc1	ZINC000819106480	FG	On-Demand	Mild	EPHX2	28	40
N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@H](C(=O)O)C3)cc2)cc1	ZINC000819106480	FG	On-Demand	Mild	PFKFB3	70	38
N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@@H](C(=O)O)C3)cc2)cc1	ZINC000819106482	FG	On-Demand	Mild	DHODH	18	45
N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@@H](C(=O)O)C3)cc2)cc1	ZINC000819106482	FG	On-Demand	Mild	PDGFRB	38	42
N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@@H](C(=O)O)C3)cc2)cc1	ZINC000819106482	FG	On-Demand	Mild	S1PR2	17	43
N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@@H](C(=O)O)C3)cc2)cc1	ZINC000819106482	FG	On-Demand	Mild	EPHX2	28	40
N#Cc1ccc(Oc2ccc(NC(=O)N3CC[C@@H](C(=O)O)C3)cc2)cc1	ZINC000819106482	FG	On-Demand	Mild	PFKFB3	70	38
N#Cc1cccc(OCc2cccc(C(=O)N3CCC[C@@H](CC(=O)O)C3)c2)c1	ZINC000819106483	GG	On-Demand	Mild	GYS1	35	41
N#Cc1cccc(OCc2cccc(C(=O)N3CCC[C@@H](CC(=O)O)C3)c2)c1	ZINC000819106483	GG	On-Demand	Mild	CHRNA10	29	43
N#Cc1cccc(OCc2cccc(C(=O)N3CCC[C@@H](CC(=O)O)C3)c2)c1	ZINC000819106483	GG	On-Demand	Mild	MAP3K12	27	40
N#Cc1cccc(OCc2cccc(C(=O)N3CCC[C@H](CC(=O)O)C3)c2)c1	ZINC000819106485	GG	On-Demand	Mild	GYS1	35	41
N#Cc1cccc(OCc2cccc(C(=O)N3CCC[C@H](CC(=O)O)C3)c2)c1	ZINC000819106485	GG	On-Demand	Mild	CHRNA10	29	43
N#Cc1cccc(OCc2cccc(C(=O)N3CCC[C@H](CC(=O)O)C3)c2)c1	ZINC000819106485	GG	On-Demand	Mild	MAP3K12	27	40
N#Cc1cccc(OCCCN2CCC[C@H]2C(=O)O)c1	ZINC000819106486	CD	On-Demand	Mild	HRH2	36	42
N#Cc1cccc(OCCCN2CCC[C@H]2C(=O)O)c1	ZINC000819106486	CD	On-Demand	Mild	SLC6A1	26	42
N#Cc1cccc(OCCCN2CCC[C@H]2C(=O)O)c1	ZINC000819106486	CD	On-Demand	Mild	HTR3A	17	40
N#Cc1cccc(OCCCN2CCC[C@H]2C(=O)O)c1	ZINC000819106486	CD	On-Demand	Mild	LTA4H	20	45
N#Cc1cccc(OCCCN2CCC[C@H]2C(=O)O)c1	ZINC000819106486	CD	On-Demand	Mild	HRH3	67	48
N#Cc1cccc(OCCCN2CCC[C@H]2C(=O)O)c1	ZINC000819106486	CD	On-Demand	Mild	PPARD	17	44
N#Cc1cccc(OCCCN2CCC[C@H]2C(=O)O)c1	ZINC000819106486	CD	On-Demand	Mild	PREP	49	36
N#Cc1cccc(OCCCN2CCC[C@H]2C(=O)O)c1	ZINC000819106486	CD	On-Demand	Mild	CHRNA10	83	54
N#Cc1cccc(OCCCN2CCC[C@H]2C(=O)O)c1	ZINC000819106486	CD	On-Demand	Mild	MEN1	50	41
N#Cc1cccc(OCCCN2CCC[C@@H]2C(=O)O)c1	ZINC000819106488	CD	On-Demand	Mild	HRH2	36	42
N#Cc1cccc(OCCCN2CCC[C@@H]2C(=O)O)c1	ZINC000819106488	CD	On-Demand	Mild	SLC6A1	26	42
N#Cc1cccc(OCCCN2CCC[C@@H]2C(=O)O)c1	ZINC000819106488	CD	On-Demand	Mild	HTR3A	17	40
N#Cc1cccc(OCCCN2CCC[C@@H]2C(=O)O)c1	ZINC000819106488	CD	On-Demand	Mild	LTA4H	20	45
N#Cc1cccc(OCCCN2CCC[C@@H]2C(=O)O)c1	ZINC000819106488	CD	On-Demand	Mild	HRH3	67	48
N#Cc1cccc(OCCCN2CCC[C@@H]2C(=O)O)c1	ZINC000819106488	CD	On-Demand	Mild	PPARD	17	44
N#Cc1cccc(OCCCN2CCC[C@@H]2C(=O)O)c1	ZINC000819106488	CD	On-Demand	Mild	PREP	49	36
N#Cc1cccc(OCCCN2CCC[C@@H]2C(=O)O)c1	ZINC000819106488	CD	On-Demand	Mild	CHRNA10	83	54
N#Cc1cccc(OCCCN2CCC[C@@H]2C(=O)O)c1	ZINC000819106488	CD	On-Demand	Mild	MEN1	50	41
N#Cc1cccc(OCC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106491	DD	On-Demand	Mild	CPT1A	113	46
N#Cc1cccc(OCC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106491	DD	On-Demand	Mild	CPT2	48	39
N#Cc1cccc(OCC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106491	DD	On-Demand	Mild	CHRNA10	43	48
N#Cc1cccc(OCC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106493	DD	On-Demand	Mild	CPT1A	113	46
N#Cc1cccc(OCC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106493	DD	On-Demand	Mild	CPT2	48	39
N#Cc1cccc(OCC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106493	DD	On-Demand	Mild	CHRNA10	43	48
N#Cc1cccc(OCCCN2CCO[C@H](C(=O)O)C2)c1	ZINC000819106494	CD	On-Demand	Mild	HRH2	40	46
N#Cc1cccc(OCCCN2CCO[C@H](C(=O)O)C2)c1	ZINC000819106494	CD	On-Demand	Mild	AVPR1B	41	36
N#Cc1cccc(OCCCN2CCO[C@H](C(=O)O)C2)c1	ZINC000819106494	CD	On-Demand	Mild	CYSLTR2	57	36
N#Cc1cccc(OCCCN2CCO[C@H](C(=O)O)C2)c1	ZINC000819106494	CD	On-Demand	Mild	HRH3	64	46
N#Cc1cccc(OCCCN2CCO[C@H](C(=O)O)C2)c1	ZINC000819106494	CD	On-Demand	Mild	SIGMAR1	16	41
N#Cc1cccc(OCCCN2CCO[C@H](C(=O)O)C2)c1	ZINC000819106494	CD	On-Demand	Mild	EPHX2	23	45
N#Cc1cccc(OCCCN2CCO[C@H](C(=O)O)C2)c1	ZINC000819106494	CD	On-Demand	Mild	CHRNA10	39	46
N#Cc1cccc(OCCCN2CCO[C@H](C(=O)O)C2)c1	ZINC000819106494	CD	On-Demand	Mild	MEN1	46	39
N#Cc1cccc(OCCCN2CCO[C@@H](C(=O)O)C2)c1	ZINC000819106496	CD	On-Demand	Mild	HRH2	40	46
N#Cc1cccc(OCCCN2CCO[C@@H](C(=O)O)C2)c1	ZINC000819106496	CD	On-Demand	Mild	AVPR1B	41	36
N#Cc1cccc(OCCCN2CCO[C@@H](C(=O)O)C2)c1	ZINC000819106496	CD	On-Demand	Mild	CYSLTR2	57	36
N#Cc1cccc(OCCCN2CCO[C@@H](C(=O)O)C2)c1	ZINC000819106496	CD	On-Demand	Mild	HRH3	64	46
N#Cc1cccc(OCCCN2CCO[C@@H](C(=O)O)C2)c1	ZINC000819106496	CD	On-Demand	Mild	SIGMAR1	16	41
N#Cc1cccc(OCCCN2CCO[C@@H](C(=O)O)C2)c1	ZINC000819106496	CD	On-Demand	Mild	EPHX2	23	45
N#Cc1cccc(OCCCN2CCO[C@@H](C(=O)O)C2)c1	ZINC000819106496	CD	On-Demand	Mild	CHRNA10	39	46
N#Cc1cccc(OCCCN2CCO[C@@H](C(=O)O)C2)c1	ZINC000819106496	CD	On-Demand	Mild	MEN1	46	39
N#Cc1cccc(COc2ccc(NC(=O)NCC(=O)O)cc2Cl)c1	ZINC000819106500	FF	On-Demand	Mild	EGFR	53	44
N#Cc1cccc(COc2ccc(NC(=O)NCC(=O)O)cc2Cl)c1	ZINC000819106500	FF	On-Demand	Mild	PPIA	35	40
N#Cc1cccc(COc2ccc(NC(=O)NCC(=O)O)cc2Cl)c1	ZINC000819106500	FF	On-Demand	Mild	ERBB2	89	44
N#Cc1cccc(COc2ccc(NC(=O)NCC(=O)O)cc2Cl)c1	ZINC000819106500	FF	On-Demand	Mild	PTGER1	40	36
N#Cc1cccc(COc2ccc(NC(=O)NCC(=O)O)cc2Cl)c1	ZINC000819106500	FF	On-Demand	Mild	MCHR1	19	41
N#Cc1cccc(COc2ccc(NC(=O)NCC(=O)O)cc2Cl)c1	ZINC000819106500	FF	On-Demand	Mild	FFAR1	18	47
N#Cc1cccc(CC(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819106501	CF	On-Demand	Mild	PTGER1	15	41
N#Cc1cccc(CC(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819106501	CF	On-Demand	Mild	CTRB_BOVIN	45	33
N#Cc1cccc(CC(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819106501	CF	On-Demand	Mild	FFAR1	15	48
N#Cc1cccc(CC(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819106501	CF	On-Demand	Mild	SLC12A5	64	48
O=C(O)C[C@]1(NS(=O)(=O)c2ccccc2C(F)(F)F)CCCOC1	ZINC000819106508	FE	On-Demand	Anodyne	SFRP1	78	35
O=C(O)C[C@]1(NS(=O)(=O)c2ccccc2C(F)(F)F)CCCOC1	ZINC000819106508	FE	On-Demand	Anodyne	WNT3	53	34
O=C(O)C[C@@]1(NS(=O)(=O)c2ccccc2C(F)(F)F)CCCOC1	ZINC000819106509	FE	On-Demand	Anodyne	SFRP1	78	35
O=C(O)C[C@@]1(NS(=O)(=O)c2ccccc2C(F)(F)F)CCCOC1	ZINC000819106509	FE	On-Demand	Anodyne	WNT3	53	34
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCOc2ccc(C#N)cc2)CC1	ZINC000819106512	GF	On-Demand	Mild	TRPV4	29	41
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCOc2ccc(C#N)cc2)CC1	ZINC000819106512	GF	On-Demand	Mild	GPR119	28	43
N#Cc1ccccc1COc1cccc(CNCCC(=O)O)c1	ZINC000819106517	DF	On-Demand	Mild	ADRB1	41	37
N#Cc1ccccc1COc1cccc(CNCCC(=O)O)c1	ZINC000819106517	DF	On-Demand	Mild	PTGER3	49	36
N#Cc1ccccc1COc1cccc(CNCCC(=O)O)c1	ZINC000819106517	DF	On-Demand	Mild	FFAR1	57	45
N#Cc1ccccc1COc1cccc(CNCCC(=O)O)c1	ZINC000819106517	DF	On-Demand	Mild	FFAR4	59	41
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2C[C@H]2c2ccc(C)cc2)cc1	ZINC000819106522	GH	On-Demand	Anodyne	UL80	44	37
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2C[C@H]2c2ccc(C)cc2)cc1	ZINC000819106522	GH	On-Demand	Anodyne	NPBWR1	55	33
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)cc1	ZINC000819106524	GH	On-Demand	Anodyne	UL80	44	37
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)cc1	ZINC000819106524	GH	On-Demand	Anodyne	NPBWR1	55	33
N#Cc1cccc(CNC(=O)CS(=O)(=O)Cc2ccc(C(=O)O)cc2)c1	ZINC000819106526	FD	On-Demand	Mild	TMPRSS11D	94	39
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2C[C@@H]2c2ccc(C)cc2)cc1	ZINC000819106527	GH	On-Demand	Anodyne	UL80	44	37
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2C[C@@H]2c2ccc(C)cc2)cc1	ZINC000819106527	GH	On-Demand	Anodyne	NPBWR1	55	33
N#Cc1cccc(NC(=O)CCN2CCC[C@@H]2C(=O)O)c1	ZINC000819106529	CD	On-Demand	Mild	ACE	18	42
N#Cc1cccc(NC(=O)CCN2CCC[C@@H]2C(=O)O)c1	ZINC000819106529	CD	On-Demand	Mild	CCR3	25	48
N#Cc1cccc(NC(=O)CCN2CCC[C@@H]2C(=O)O)c1	ZINC000819106529	CD	On-Demand	Mild	ITGA4	47	32
N#Cc1cccc(NC(=O)CCN2CCC[C@@H]2C(=O)O)c1	ZINC000819106529	CD	On-Demand	Mild	MCHR1	46	43
N#Cc1cccc(NC(=O)CCN2CCC[C@H]2C(=O)O)c1	ZINC000819106530	CD	On-Demand	Mild	ACE	18	42
N#Cc1cccc(NC(=O)CCN2CCC[C@H]2C(=O)O)c1	ZINC000819106530	CD	On-Demand	Mild	CCR3	25	48
N#Cc1cccc(NC(=O)CCN2CCC[C@H]2C(=O)O)c1	ZINC000819106530	CD	On-Demand	Mild	ITGA4	47	32
N#Cc1cccc(NC(=O)CCN2CCC[C@H]2C(=O)O)c1	ZINC000819106530	CD	On-Demand	Mild	MCHR1	46	43
N#Cc1cccc(COc2cccc(NC(=O)C(=O)N3CC[C@H](C(=O)O)C3)c2)c1	ZINC000819106531	GE	On-Demand	Mild	CCR3	27	41
N#Cc1cccc(COc2cccc(NC(=O)C(=O)N3CC[C@@H](C(=O)O)C3)c2)c1	ZINC000819106532	GE	On-Demand	Mild	CCR3	27	41
N#Cc1cccc(CNc2cccc(CC(=O)O)c2)c1	ZINC000819106533	CF	On-Demand	Mild	FFAR1	21	44
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)cc1	ZINC000819106534	GH	On-Demand	Anodyne	UL80	44	37
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)cc1	ZINC000819106534	GH	On-Demand	Anodyne	NPBWR1	55	33
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCOc2ccc(C#N)cc2)CC1	ZINC000819106538	GF	On-Demand	Mild	TRPV4	29	41
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCOc2ccc(C#N)cc2)CC1	ZINC000819106538	GF	On-Demand	Mild	GPR119	28	43
N#Cc1cccc(CC(=O)N2CCC(C(=O)O)CC2)c1	ZINC000819106547	CD	On-Demand	Mild	CCR3	22	42
N#Cc1cccc(CC(=O)N2CCC(C(=O)O)CC2)c1	ZINC000819106547	CD	On-Demand	Mild	MLNR	30	46
N#Cc1cccc(OCC(=O)NCCCC(=O)O)c1	ZINC000819106548	CC	On-Demand	Mild	PTGER3	25	42
N#Cc1cccc(OCC(=O)NCCCC(=O)O)c1	ZINC000819106548	CC	On-Demand	Mild	MTNR1A	24	42
N#Cc1cccc(OCC(=O)NCCCC(=O)O)c1	ZINC000819106548	CC	On-Demand	Mild	MTNR1B	19	42
N#Cc1cccc(OCC(=O)NCCCC(=O)O)c1	ZINC000819106548	CC	On-Demand	Mild	PLA2G4B	54	37
N#Cc1cccc(OCC(=O)NCCCC(=O)O)c1	ZINC000819106548	CC	On-Demand	Mild	FFAR1	37	49
N#Cc1cccc(OCC(=O)NCCCC(=O)O)c1	ZINC000819106548	CC	On-Demand	Mild	PDS	34	47
N#Cc1cccc(OC2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)c1	ZINC000819106551	GG	On-Demand	Mild	HRH1	19	43
N#Cc1cccc(OC2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)c1	ZINC000819106551	GG	On-Demand	Mild	CCR3	47	46
N#Cc1cccc(OC2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)c1	ZINC000819106551	GG	On-Demand	Mild	EPHX2	22	59
N#Cc1cccc(OC2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)c1	ZINC000819106551	GG	On-Demand	Mild	TNKS	27	42
N#Cc1cccc(CNC(=O)CN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106552	DD	On-Demand	Mild	CCR3	38	52
N#Cc1cccc(CNC(=O)CN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819106552	DD	On-Demand	Mild	MCHR1	33	40
N#Cc1cccc(CNC(=O)CN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106560	DD	On-Demand	Mild	CCR3	38	52
N#Cc1cccc(CNC(=O)CN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819106560	DD	On-Demand	Mild	MCHR1	33	40
N#Cc1cccc(CC(=O)NCCCC(=O)O)c1	ZINC000819106562	BD	On-Demand	Mild	FFAR1	32	50
N#Cc1cccc(CC(=O)NCCCC(=O)O)c1	ZINC000819106562	BD	On-Demand	Mild	POLG_WNV	40	29
N#Cc1cccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106567	CD	On-Demand	Mild	SLC6A1	150	37
N#Cc1cccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106567	CD	On-Demand	Mild	CASR	15	46
N#Cc1cccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106567	CD	On-Demand	Mild	CCR3	37	52
N#Cc1cccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106567	CD	On-Demand	Mild	TERT	15	40
N#Cc1cccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819106567	CD	On-Demand	Mild	MCHR1	57	46
N#Cc1cccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106568	CD	On-Demand	Mild	SLC6A1	150	37
N#Cc1cccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106568	CD	On-Demand	Mild	CASR	15	46
N#Cc1cccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106568	CD	On-Demand	Mild	CCR3	37	52
N#Cc1cccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106568	CD	On-Demand	Mild	TERT	15	40
N#Cc1cccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)c1	ZINC000819106568	CD	On-Demand	Mild	MCHR1	57	46
CCCc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819106580	ED	On-Demand	Anodyne	MMP13	16	41
N#Cc1cccc(CC(=O)OCC(=O)O)c1	ZINC000819106583	BC	On-Demand	Mild	FFAR1	23	50
CCCc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819106585	ED	On-Demand	Anodyne	MMP13	16	41
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccccc3C)C2=O)cc1	ZINC000819106627	FE	On-Demand	Anodyne	ADRB2	32	47
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccccc3C)C2=O)cc1	ZINC000819106627	FE	On-Demand	Anodyne	ADRB1	24	44
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccccc3C)C2=O)cc1	ZINC000819106627	FE	On-Demand	Anodyne	ADRB3	17	43
Cc1ccc(N2CC[C@H](NC[C@@H](O)COc3ccccc3C)C2=O)cc1	ZINC000819106627	FE	On-Demand	Anodyne	ABCB1	45	37
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccccc3C)C2=O)cc1	ZINC000819106629	FE	On-Demand	Anodyne	ADRB2	32	47
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccccc3C)C2=O)cc1	ZINC000819106629	FE	On-Demand	Anodyne	ADRB1	24	44
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccccc3C)C2=O)cc1	ZINC000819106629	FE	On-Demand	Anodyne	ADRB3	17	43
Cc1ccc(N2CC[C@H](NC[C@H](O)COc3ccccc3C)C2=O)cc1	ZINC000819106629	FE	On-Demand	Anodyne	ABCB1	45	37
CC(C)(C)OC(=O)CS(=O)(=O)CCNCc1cc(O)nc2ccccc12	ZINC000819106643	GD	On-Demand	Anodyne	METG	83	40
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819106665	GF	On-Demand	Anodyne	ADRB2	32	44
CCOc1ccc(OC[C@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819106666	GF	On-Demand	Anodyne	ADRB2	32	44
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819106667	GF	On-Demand	Anodyne	ADRB2	32	44
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819106668	GF	On-Demand	Anodyne	ADRB2	32	44
O=C(Nc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2)c1cn(Cc2ccccc2)nn1	ZINC000819106693	JH	On-Demand	Anodyne	KIT	19	41
O=C(Nc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2)c1cn(Cc2ccccc2)nn1	ZINC000819106693	JH	On-Demand	Anodyne	GRM4	23	43
O=C(Nc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2)c1cn(Cc2ccccc2)nn1	ZINC000819106693	JH	On-Demand	Anodyne	BRAF	17	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(F)cc1C(F)(F)F)C2	ZINC000819106694	GG	On-Demand	Anodyne	P2RX7	77	55
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(F)cc1C(F)(F)F)C2	ZINC000819106695	GG	On-Demand	Anodyne	P2RX7	77	55
O=C(NC1CCN(c2ccc(C(F)(F)F)cn2)CC1)C(F)=C1CCC1	ZINC000819106699	FH	On-Demand	Anodyne	HPGDS	28	45
Cc1ccc2cccc(S(=O)(=O)N[C@]3(CC(=O)O)CCCOC3)c2n1	ZINC000819106715	FD	On-Demand	Anodyne	BDKRB2	53	32
Cc1ccc2cccc(S(=O)(=O)N[C@@]3(CC(=O)O)CCCOC3)c2n1	ZINC000819106716	FD	On-Demand	Anodyne	BDKRB2	53	32
C[C@@H]1CCCCN1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819106719	FF	On-Demand	Mild	PAPA1_CARPA	41	48
C[C@H]1CCCCN1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819106720	FF	On-Demand	Mild	PAPA1_CARPA	41	48
C[C@@H]1CCCCN1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819106722	FF	On-Demand	Mild	PAPA1_CARPA	41	48
C[C@H]1CCCCN1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819106725	FF	On-Demand	Mild	PAPA1_CARPA	41	48
CCN(C(=O)/C=C/[C@@H]1CCCO1)[C@H](C)c1cccc(OC)c1	ZINC000819106755	DG	On-Demand	Anodyne	OPRD1	15	44
CCN(C(=O)/C=C/[C@@H]1CCCO1)[C@@H](C)c1cccc(OC)c1	ZINC000819106756	DG	On-Demand	Anodyne	OPRD1	15	44
CCN(C(=O)/C=C\[C@@H]1CCCO1)[C@@H](C)c1cccc(OC)c1	ZINC000819106757	DG	On-Demand	Anodyne	OPRD1	15	44
CCN(C(=O)/C=C\[C@@H]1CCCO1)[C@H](C)c1cccc(OC)c1	ZINC000819106759	DG	On-Demand	Anodyne	OPRD1	15	44
O=C(O)C[C@]1(NS(=O)(=O)c2cccnc2)CCCOC1	ZINC000819106764	DC	On-Demand	Anodyne	TBXAS1	44	37
O=C(O)C[C@@]1(NS(=O)(=O)c2cccnc2)CCCOC1	ZINC000819106765	DC	On-Demand	Anodyne	TBXAS1	44	37
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1cc(O)nc2ccccc12	ZINC000819106771	FE	On-Demand	Anodyne	METG	73	35
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1cc(O)nc2ccccc12	ZINC000819106772	FE	On-Demand	Anodyne	METG	73	35
COCCCN(C)CCNC[C@H](O)c1ccccc1	ZINC000819106793	CD	On-Demand	Anodyne	ADRB2	26	40
COCCCN(C)CCNC[C@H](O)c1ccccc1	ZINC000819106793	CD	On-Demand	Anodyne	ADRB1	34	40
COCCCN(C)CCNC[C@H](O)c1ccccc1	ZINC000819106793	CD	On-Demand	Anodyne	ADRB3	40	41
COCCCN(C)CCNC[C@H](O)c1ccccc1	ZINC000819106793	CD	On-Demand	Anodyne	AOC3	20	43
COCCCN(C)CCNC[C@@H](O)c1ccccc1	ZINC000819106795	CD	On-Demand	Anodyne	ADRB2	26	40
COCCCN(C)CCNC[C@@H](O)c1ccccc1	ZINC000819106795	CD	On-Demand	Anodyne	ADRB1	34	40
COCCCN(C)CCNC[C@@H](O)c1ccccc1	ZINC000819106795	CD	On-Demand	Anodyne	ADRB3	40	41
COCCCN(C)CCNC[C@@H](O)c1ccccc1	ZINC000819106795	CD	On-Demand	Anodyne	AOC3	20	43
N#Cc1ccc(OCCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819106819	FG	On-Demand	Mild	ADRB2	19	40
N#Cc1ccc(OCCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819106819	FG	On-Demand	Mild	ADRB1	22	41
N#Cc1ccc(OCCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819106819	FG	On-Demand	Mild	ADRB3	21	41
N#Cc1ccc(OCCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819106826	FG	On-Demand	Mild	ADRB2	19	40
N#Cc1ccc(OCCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819106826	FG	On-Demand	Mild	ADRB1	22	41
N#Cc1ccc(OCCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819106826	FG	On-Demand	Mild	ADRB3	21	41
O=C(O)[C@H](NS(=O)(=O)c1ccc(OC2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000819106841	GE	On-Demand	Anodyne	MMP13	36	56
O=C(O)[C@H](NS(=O)(=O)c1ccc(OC2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000819106841	GE	On-Demand	Anodyne	MMP2	25	56
O=C(O)[C@H](NS(=O)(=O)c1ccc(OC2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000819106841	GE	On-Demand	Anodyne	MMP3	16	49
O=C(O)[C@@H](NS(=O)(=O)c1ccc(OC2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000819106843	GE	On-Demand	Anodyne	MMP13	36	56
O=C(O)[C@@H](NS(=O)(=O)c1ccc(OC2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000819106843	GE	On-Demand	Anodyne	MMP2	25	56
O=C(O)[C@@H](NS(=O)(=O)c1ccc(OC2CCCC2)cc1)[C@@H]1CCCOC1	ZINC000819106843	GE	On-Demand	Anodyne	MMP3	16	49
O=C(O)[C@@H](NS(=O)(=O)c1ccc(OC2CCCC2)cc1)[C@H]1CCCOC1	ZINC000819106844	GE	On-Demand	Anodyne	MMP13	36	56
O=C(O)[C@@H](NS(=O)(=O)c1ccc(OC2CCCC2)cc1)[C@H]1CCCOC1	ZINC000819106844	GE	On-Demand	Anodyne	MMP2	25	56
O=C(O)[C@@H](NS(=O)(=O)c1ccc(OC2CCCC2)cc1)[C@H]1CCCOC1	ZINC000819106844	GE	On-Demand	Anodyne	MMP3	16	49
O=C(O)[C@H](NS(=O)(=O)c1ccc(OC2CCCC2)cc1)[C@H]1CCCOC1	ZINC000819106845	GE	On-Demand	Anodyne	MMP13	36	56
O=C(O)[C@H](NS(=O)(=O)c1ccc(OC2CCCC2)cc1)[C@H]1CCCOC1	ZINC000819106845	GE	On-Demand	Anodyne	MMP2	25	56
O=C(O)[C@H](NS(=O)(=O)c1ccc(OC2CCCC2)cc1)[C@H]1CCCOC1	ZINC000819106845	GE	On-Demand	Anodyne	MMP3	16	49
O=C(/C=C/[C@H]1CCCO1)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000819106846	FF	On-Demand	Anodyne	HPGDS	27	44
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000819106851	FF	On-Demand	Anodyne	HPGDS	27	44
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000819106855	FF	On-Demand	Anodyne	HPGDS	27	44
O=C(/C=C\[C@H]1CCCO1)NC1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000819106860	FF	On-Demand	Anodyne	HPGDS	27	44
C=CCCn1cc(C(=O)N2CCC[C@H]2C(=O)Nc2ccc(OC)cc2)nn1	ZINC000819106863	FE	On-Demand	Mild	TRHR	41	31
C=CCCn1cc(C(=O)N2CCC[C@H]2C(=O)Nc2ccc(OC)cc2)nn1	ZINC000819106863	FE	On-Demand	Mild	LGMN	43	39
C=CCCn1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2ccc(OC)cc2)nn1	ZINC000819106864	FE	On-Demand	Mild	TRHR	41	31
C=CCCn1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2ccc(OC)cc2)nn1	ZINC000819106864	FE	On-Demand	Mild	LGMN	43	39
O[C@H](CNC1CC(c2cccc(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819106895	EI	On-Demand	Anodyne	ADRB3	34	40
O[C@@H](CNC1CC(c2cccc(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819106897	EI	On-Demand	Anodyne	ADRB3	34	40
CSC1(CNC[C@@H](O)c2cccnc2)CCOCC1	ZINC000819106902	CD	On-Demand	Anodyne	ADRB1	20	40
CSC1(CNC[C@@H](O)c2cccnc2)CCOCC1	ZINC000819106902	CD	On-Demand	Anodyne	ADRB3	79	41
CSC1(CNC[C@H](O)c2cccnc2)CCOCC1	ZINC000819106904	CD	On-Demand	Anodyne	ADRB1	20	40
CSC1(CNC[C@H](O)c2cccnc2)CCOCC1	ZINC000819106904	CD	On-Demand	Anodyne	ADRB3	79	41
N#Cc1ccc(OCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819106918	FG	On-Demand	Mild	ADRB1	18	43
N#Cc1ccc(OCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819106918	FG	On-Demand	Mild	ADRB3	17	43
N#Cc1ccc(OCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819106921	FG	On-Demand	Mild	ADRB1	18	43
N#Cc1ccc(OCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819106921	FG	On-Demand	Mild	ADRB3	17	43
O=C(NCc1ccc(F)cc1C(F)(F)F)C(F)=C1CCC1	ZINC000819106976	DH	On-Demand	Anodyne	P2RX7	34	51
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@H]2C)cc1	ZINC000819107024	EG	On-Demand	Anodyne	F2	15	43
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@H]2C)cc1	ZINC000819107024	EG	On-Demand	Anodyne	MMP13	27	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@H]2C)cc1	ZINC000819107024	EG	On-Demand	Anodyne	UL80	52	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@H]2C)cc1	ZINC000819107024	EG	On-Demand	Anodyne	HDAC8	15	46
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@H]2C)cc1	ZINC000819107024	EG	On-Demand	Anodyne	MMP3	35	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@H]2C)cc1	ZINC000819107024	EG	On-Demand	Anodyne	MMP8	19	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@H]2C)cc1	ZINC000819107024	EG	On-Demand	Anodyne	LGMN	29	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@H]2C)cc1	ZINC000819107024	EG	On-Demand	Anodyne	CFTR	40	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@H]2C)cc1	ZINC000819107024	EG	On-Demand	Anodyne	MMP9	24	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@H]2C)cc1	ZINC000819107024	EG	On-Demand	Anodyne	MMP7	33	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@H]2C)cc1	ZINC000819107024	EG	On-Demand	Anodyne	MMP1	29	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@H]2C)cc1	ZINC000819107025	EG	On-Demand	Anodyne	F2	15	43
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@H]2C)cc1	ZINC000819107025	EG	On-Demand	Anodyne	MMP13	27	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@H]2C)cc1	ZINC000819107025	EG	On-Demand	Anodyne	UL80	52	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@H]2C)cc1	ZINC000819107025	EG	On-Demand	Anodyne	HDAC8	15	46
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@H]2C)cc1	ZINC000819107025	EG	On-Demand	Anodyne	MMP3	35	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@H]2C)cc1	ZINC000819107025	EG	On-Demand	Anodyne	MMP8	19	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@H]2C)cc1	ZINC000819107025	EG	On-Demand	Anodyne	LGMN	29	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@H]2C)cc1	ZINC000819107025	EG	On-Demand	Anodyne	CFTR	40	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@H]2C)cc1	ZINC000819107025	EG	On-Demand	Anodyne	MMP9	24	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@H]2C)cc1	ZINC000819107025	EG	On-Demand	Anodyne	MMP7	33	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@H]2C)cc1	ZINC000819107025	EG	On-Demand	Anodyne	MMP1	29	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@@H]2C)cc1	ZINC000819107026	EG	On-Demand	Anodyne	F2	15	43
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@@H]2C)cc1	ZINC000819107026	EG	On-Demand	Anodyne	MMP13	27	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@@H]2C)cc1	ZINC000819107026	EG	On-Demand	Anodyne	UL80	52	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@@H]2C)cc1	ZINC000819107026	EG	On-Demand	Anodyne	HDAC8	15	46
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@@H]2C)cc1	ZINC000819107026	EG	On-Demand	Anodyne	MMP3	35	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@@H]2C)cc1	ZINC000819107026	EG	On-Demand	Anodyne	MMP8	19	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@@H]2C)cc1	ZINC000819107026	EG	On-Demand	Anodyne	LGMN	29	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@@H]2C)cc1	ZINC000819107026	EG	On-Demand	Anodyne	CFTR	40	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@@H]2C)cc1	ZINC000819107026	EG	On-Demand	Anodyne	MMP9	24	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@@H]2C)cc1	ZINC000819107026	EG	On-Demand	Anodyne	MMP7	33	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCC[C@@H]2C)cc1	ZINC000819107026	EG	On-Demand	Anodyne	MMP1	29	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@@H]2C)cc1	ZINC000819107027	EG	On-Demand	Anodyne	F2	15	43
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@@H]2C)cc1	ZINC000819107027	EG	On-Demand	Anodyne	MMP13	27	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@@H]2C)cc1	ZINC000819107027	EG	On-Demand	Anodyne	UL80	52	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@@H]2C)cc1	ZINC000819107027	EG	On-Demand	Anodyne	HDAC8	15	46
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@@H]2C)cc1	ZINC000819107027	EG	On-Demand	Anodyne	MMP3	35	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@@H]2C)cc1	ZINC000819107027	EG	On-Demand	Anodyne	MMP8	19	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@@H]2C)cc1	ZINC000819107027	EG	On-Demand	Anodyne	LGMN	29	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@@H]2C)cc1	ZINC000819107027	EG	On-Demand	Anodyne	CFTR	40	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@@H]2C)cc1	ZINC000819107027	EG	On-Demand	Anodyne	MMP9	24	40
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@@H]2C)cc1	ZINC000819107027	EG	On-Demand	Anodyne	MMP7	33	42
COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)[C@H]2CCCC[C@@H]2C)cc1	ZINC000819107027	EG	On-Demand	Anodyne	MMP1	29	42
O=C(NC1CCN(C(=O)C(F)=C2CCC2)CC1)C1CC1	ZINC000819107028	CD	On-Demand	Anodyne	EPHX2	30	42
O=C(O)C[C@@]1(NS(=O)(=O)c2ccc(Cl)c3ccccc23)CCCOC1	ZINC000819107031	GF	On-Demand	Anodyne	BDKRB2	42	31
O=C(O)C[C@]1(NS(=O)(=O)c2ccc(Cl)c3ccccc23)CCCOC1	ZINC000819107032	GF	On-Demand	Anodyne	BDKRB2	42	31
CSC1(CNC[C@H](O)c2cccc(Cl)c2)CCOCC1	ZINC000819107043	DF	On-Demand	Anodyne	ADRB1	27	40
CSC1(CNC[C@H](O)c2cccc(Cl)c2)CCOCC1	ZINC000819107043	DF	On-Demand	Anodyne	ADRB3	42	40
CSC1(CNC[C@@H](O)c2cccc(Cl)c2)CCOCC1	ZINC000819107044	DF	On-Demand	Anodyne	ADRB1	27	40
CSC1(CNC[C@@H](O)c2cccc(Cl)c2)CCOCC1	ZINC000819107044	DF	On-Demand	Anodyne	ADRB3	42	40
O=C(O)C[C@@]1(NS(=O)(=O)c2ccc(OCC(F)(F)F)cc2)CCCOC1	ZINC000819107057	GD	On-Demand	Anodyne	MMP13	31	45
O=C(O)C[C@]1(NS(=O)(=O)c2ccc(OCC(F)(F)F)cc2)CCCOC1	ZINC000819107058	GD	On-Demand	Anodyne	MMP13	31	45
COCCc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107063	FD	On-Demand	Anodyne	MMP13	24	41
COCCc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107064	FD	On-Demand	Anodyne	MMP13	24	41
C[C@H](CN1CCOCC1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819107075	FD	On-Demand	Mild	PAPA1_CARPA	37	45
C[C@H](CN1CCOCC1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819107075	FD	On-Demand	Mild	CTSS	17	48
C[C@H](CN1CCOCC1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819107077	FD	On-Demand	Mild	PAPA1_CARPA	37	45
C[C@H](CN1CCOCC1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819107077	FD	On-Demand	Mild	CTSS	17	48
O=C(O)C[C@@]1(NS(=O)(=O)N2CCc3ccccc3C2)CCCOC1	ZINC000819107085	FC	On-Demand	Anodyne	AKR1C3	52	39
O=C(O)C[C@]1(NS(=O)(=O)N2CCc3ccccc3C2)CCCOC1	ZINC000819107088	FC	On-Demand	Anodyne	AKR1C3	52	39
Cc1cc(F)ccc1[C@@H](O)CNCCOc1ccc(C#N)cc1	ZINC000819107091	DF	On-Demand	Mild	DRD4	17	42
NS(=O)(=O)c1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107132	GB	On-Demand	Anodyne	CA2	65	40
NS(=O)(=O)c1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107132	GB	On-Demand	Anodyne	CA1	57	40
NS(=O)(=O)c1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107132	GB	On-Demand	Anodyne	CA5B	46	35
NS(=O)(=O)c1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107132	GB	On-Demand	Anodyne	CA4	68	39
NS(=O)(=O)c1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107132	GB	On-Demand	Anodyne	CA5A	48	35
NS(=O)(=O)c1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107132	GB	On-Demand	Anodyne	CA9	35	40
NS(=O)(=O)c1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107132	GB	On-Demand	Anodyne	P96878_MYCTU	42	33
NS(=O)(=O)c1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107135	GB	On-Demand	Anodyne	CA2	65	40
NS(=O)(=O)c1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107135	GB	On-Demand	Anodyne	CA1	57	40
NS(=O)(=O)c1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107135	GB	On-Demand	Anodyne	CA5B	46	35
NS(=O)(=O)c1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107135	GB	On-Demand	Anodyne	CA4	68	39
NS(=O)(=O)c1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107135	GB	On-Demand	Anodyne	CA5A	48	35
NS(=O)(=O)c1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107135	GB	On-Demand	Anodyne	CA9	35	40
NS(=O)(=O)c1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107135	GB	On-Demand	Anodyne	P96878_MYCTU	42	33
O=C(O)C[C@@]1(NS(=O)(=O)c2ccc(OC3CCCC3)cc2)CCOC1	ZINC000819107137	FD	On-Demand	Anodyne	MMP13	33	42
O=C(O)C[C@]1(NS(=O)(=O)c2ccc(OC3CCCC3)cc2)CCOC1	ZINC000819107139	FD	On-Demand	Anodyne	MMP13	33	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(C(=O)Cc2ccccc2)CC1	ZINC000819107141	GD	On-Demand	Anodyne	FPR1	43	34
COc1ccc(OC)c([C@H](O)CNC2CC(c3cccc(Cl)c3)C2)c1	ZINC000819107174	FH	On-Demand	Anodyne	ADRB3	21	43
O=C(O)C[C@]1(NS(=O)(=O)c2ccc(SC(F)(F)F)cc2)CCOC1	ZINC000819107187	GE	On-Demand	Anodyne	MMP13	15	48
O=C(O)C[C@@]1(NS(=O)(=O)c2ccc(SC(F)(F)F)cc2)CCOC1	ZINC000819107188	GE	On-Demand	Anodyne	MMP13	15	48
O=C(O)C[C@@]1(NS(=O)(=O)c2ccc3ccccc3c2)CCCOC1	ZINC000819107268	EE	On-Demand	Anodyne	F2	18	42
O=C(O)C[C@@]1(NS(=O)(=O)c2ccc3ccccc3c2)CCCOC1	ZINC000819107268	EE	On-Demand	Anodyne	MMP13	18	43
O=C(O)C[C@@]1(NS(=O)(=O)c2ccc3ccccc3c2)CCCOC1	ZINC000819107268	EE	On-Demand	Anodyne	TRY2_BOVIN	60	36
O=C(O)C[C@]1(NS(=O)(=O)c2ccc3ccccc3c2)CCCOC1	ZINC000819107269	EE	On-Demand	Anodyne	F2	18	42
O=C(O)C[C@]1(NS(=O)(=O)c2ccc3ccccc3c2)CCCOC1	ZINC000819107269	EE	On-Demand	Anodyne	MMP13	18	43
O=C(O)C[C@]1(NS(=O)(=O)c2ccc3ccccc3c2)CCCOC1	ZINC000819107269	EE	On-Demand	Anodyne	TRY2_BOVIN	60	36
O=[N+]([O-])c1cccc([C@H](O)CNC2CC(c3cccc(Cl)c3)C2)c1	ZINC000819107375	EH	On-Demand	Bother	CACNA1C	53	36
O=[N+]([O-])c1cccc([C@H](O)CNC2CC(c3cccc(Cl)c3)C2)c1	ZINC000819107375	EH	On-Demand	Bother	ADRB3	39	43
O=[N+]([O-])c1cccc([C@H](O)CNC2CC(c3cccc(Cl)c3)C2)c1	ZINC000819107375	EH	On-Demand	Bother	CACNA1D	85	35
O=[N+]([O-])c1cccc([C@@H](O)CNC2CC(c3cccc(Cl)c3)C2)c1	ZINC000819107376	EH	On-Demand	Bother	CACNA1C	53	36
O=[N+]([O-])c1cccc([C@@H](O)CNC2CC(c3cccc(Cl)c3)C2)c1	ZINC000819107376	EH	On-Demand	Bother	ADRB3	39	43
O=[N+]([O-])c1cccc([C@@H](O)CNC2CC(c3cccc(Cl)c3)C2)c1	ZINC000819107376	EH	On-Demand	Bother	CACNA1D	85	35
Cc1cnc([C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C2CC2)s1	ZINC000819107381	GH	On-Demand	Anodyne	GPR119	45	40
Cc1cnc([C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C2CC2)s1	ZINC000819107382	GH	On-Demand	Anodyne	GPR119	45	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCOc2ccc(C#N)cc2)CC1	ZINC000819107385	GF	On-Demand	Mild	MMP13	18	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCOc2ccc(C#N)cc2)CC1	ZINC000819107385	GF	On-Demand	Mild	GPR119	55	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCOc2ccc(C#N)cc2)CC1	ZINC000819107386	GF	On-Demand	Mild	MMP13	18	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCOc2ccc(C#N)cc2)CC1	ZINC000819107386	GF	On-Demand	Mild	GPR119	55	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCN(c3ccccc3C#N)CC1)C2	ZINC000819107401	GE	On-Demand	Mild	SSTR1	53	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCN(c3ccccc3C#N)CC1)C2	ZINC000819107402	GE	On-Demand	Mild	SSTR1	53	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(C(=O)Cc3ccccc3)CC1)C2	ZINC000819107404	GD	On-Demand	Anodyne	PREP	50	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(C(=O)Cc3ccccc3)CC1)C2	ZINC000819107405	GD	On-Demand	Anodyne	PREP	50	35
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(F)cc1C(F)(F)F	ZINC000819107408	DG	On-Demand	Anodyne	P2RX7	22	47
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(F)cc1C(F)(F)F	ZINC000819107409	DG	On-Demand	Anodyne	P2RX7	22	47
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(F)cc1C(F)(F)F	ZINC000819107410	DG	On-Demand	Anodyne	P2RX7	22	47
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(F)cc1C(F)(F)F	ZINC000819107411	DG	On-Demand	Anodyne	P2RX7	22	47
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)N1CCC[C@@H](C)C1	ZINC000819107413	GF	On-Demand	Mild	PAPA1_CARPA	38	47
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)N1CCC[C@@H](C)C1	ZINC000819107414	GF	On-Demand	Mild	PAPA1_CARPA	38	47
O=C(O)C[C@@]1(NS(=O)(=O)c2ccc(OCC(F)F)cc2)CCCOC1	ZINC000819107484	GD	On-Demand	Anodyne	MMP13	32	45
O=C(O)C[C@]1(NS(=O)(=O)c2ccc(OCC(F)F)cc2)CCCOC1	ZINC000819107485	GD	On-Demand	Anodyne	MMP13	32	45
O=C(O)C[C@]1(NS(=O)(=O)c2ccc(OC3CCCC3)cc2)CCCOC1	ZINC000819107504	GE	On-Demand	Anodyne	MMP13	25	43
O=C(O)C[C@@]1(NS(=O)(=O)c2ccc(OC3CCCC3)cc2)CCCOC1	ZINC000819107505	GE	On-Demand	Anodyne	MMP13	25	43
COCCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107515	FD	On-Demand	Anodyne	MMP13	52	43
COCCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107515	FD	On-Demand	Anodyne	ADAM17	20	42
COCCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107515	FD	On-Demand	Anodyne	MMP2	24	42
COCCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107515	FD	On-Demand	Anodyne	MMP8	20	42
COCCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107515	FD	On-Demand	Anodyne	MMP9	22	42
COCCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107515	FD	On-Demand	Anodyne	MMP1	20	43
COCCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107516	FD	On-Demand	Anodyne	MMP13	52	43
COCCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107516	FD	On-Demand	Anodyne	ADAM17	20	42
COCCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107516	FD	On-Demand	Anodyne	MMP2	24	42
COCCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107516	FD	On-Demand	Anodyne	MMP8	20	42
COCCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107516	FD	On-Demand	Anodyne	MMP9	22	42
COCCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107516	FD	On-Demand	Anodyne	MMP1	20	43
COC(=O)c1c(C)n(C2CC2)c2ccc(OC(=O)c3cn(Cc4ccccc4)nn3)cc12	ZINC000819107526	IH	On-Demand	Anodyne	PLA2G2A	58	41
Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2	ZINC000819107534	JJ	On-Demand	Anodyne	PPARG	73	45
Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2	ZINC000819107534	JJ	On-Demand	Anodyne	PPARA	78	45
Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2	ZINC000819107534	JJ	On-Demand	Anodyne	PDE8B	57	34
Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2	ZINC000819107534	JJ	On-Demand	Anodyne	NR2E3	52	32
Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2	ZINC000819107534	JJ	On-Demand	Anodyne	SMO	17	45
COC(=O)c1c(C)n(C2CC2)c2ccc(OC(=O)CNC(=O)Nc3ccccc3)cc12	ZINC000819107627	HH	On-Demand	Anodyne	PFKFB3	48	33
CCCCCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107630	GF	On-Demand	Anodyne	MMP13	51	49
CCCCCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107630	GF	On-Demand	Anodyne	ADAM17	15	49
CCCCCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107630	GF	On-Demand	Anodyne	MMP2	18	43
CCCCCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107630	GF	On-Demand	Anodyne	PLA2G4B	91	40
CCCCCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107630	GF	On-Demand	Anodyne	MMP9	18	49
CCCCCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107630	GF	On-Demand	Anodyne	MMP1	20	43
CCCCCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107631	GF	On-Demand	Anodyne	MMP13	51	49
CCCCCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107631	GF	On-Demand	Anodyne	ADAM17	15	49
CCCCCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107631	GF	On-Demand	Anodyne	MMP2	18	43
CCCCCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107631	GF	On-Demand	Anodyne	PLA2G4B	91	40
CCCCCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107631	GF	On-Demand	Anodyne	MMP9	18	49
CCCCCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107631	GF	On-Demand	Anodyne	MMP1	20	43
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(C#N)cc2)cc1	ZINC000819107663	FD	On-Demand	Mild	ADRB2	24	41
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(C#N)cc2)cc1	ZINC000819107663	FD	On-Demand	Mild	ADRB1	33	42
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(C#N)cc2)cc1	ZINC000819107663	FD	On-Demand	Mild	ADRB3	46	45
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(C#N)cc2)cc1	ZINC000819107663	FD	On-Demand	Mild	CTSF	53	35
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(C#N)cc2)cc1	ZINC000819107663	FD	On-Demand	Mild	LOX1.1	28	41
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(C#N)cc2)cc1	ZINC000819107663	FD	On-Demand	Mild	O49150_SOLTU	32	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(C#N)cc2)cc1	ZINC000819107664	FD	On-Demand	Mild	ADRB2	24	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(C#N)cc2)cc1	ZINC000819107664	FD	On-Demand	Mild	ADRB1	33	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(C#N)cc2)cc1	ZINC000819107664	FD	On-Demand	Mild	ADRB3	46	45
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(C#N)cc2)cc1	ZINC000819107664	FD	On-Demand	Mild	CTSF	53	35
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(C#N)cc2)cc1	ZINC000819107664	FD	On-Demand	Mild	LOX1.1	28	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(C#N)cc2)cc1	ZINC000819107664	FD	On-Demand	Mild	O49150_SOLTU	32	41
Cc1ccccc1[C@@H](O)CNCCOc1ccc(C#N)cc1	ZINC000819107690	CF	On-Demand	Mild	ADRB2	19	42
Cc1ccccc1[C@@H](O)CNCCOc1ccc(C#N)cc1	ZINC000819107690	CF	On-Demand	Mild	ADRB1	28	42
Cc1ccccc1[C@@H](O)CNCCOc1ccc(C#N)cc1	ZINC000819107690	CF	On-Demand	Mild	DRD4	18	41
Cc1ccccc1[C@@H](O)CNCCOc1ccc(C#N)cc1	ZINC000819107690	CF	On-Demand	Mild	ADRB3	19	42
O=C(O)C[C@@]1(NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])CCCOC1	ZINC000819107747	FD	On-Demand	Bother	COLA	94	34
O=C(O)C[C@]1(NS(=O)(=O)CCc2ccccc2[N+](=O)[O-])CCCOC1	ZINC000819107748	FD	On-Demand	Bother	COLA	94	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCCN(c2ccccc2C#N)CC1	ZINC000819107771	GF	On-Demand	Mild	SSTR1	17	42
CCCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107868	FD	On-Demand	Anodyne	MMP13	53	46
CCCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107868	FD	On-Demand	Anodyne	ADAM17	20	46
CCCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107868	FD	On-Demand	Anodyne	MMP2	20	40
CCCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107868	FD	On-Demand	Anodyne	MMP8	16	40
CCCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107868	FD	On-Demand	Anodyne	PLA2G4B	46	33
CCCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107868	FD	On-Demand	Anodyne	MMP9	18	46
CCCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107868	FD	On-Demand	Anodyne	MMP1	21	43
CCCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107869	FD	On-Demand	Anodyne	MMP13	53	46
CCCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107869	FD	On-Demand	Anodyne	ADAM17	20	46
CCCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107869	FD	On-Demand	Anodyne	MMP2	20	40
CCCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107869	FD	On-Demand	Anodyne	MMP8	16	40
CCCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107869	FD	On-Demand	Anodyne	PLA2G4B	46	33
CCCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107869	FD	On-Demand	Anodyne	MMP9	18	46
CCCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)cc1	ZINC000819107869	FD	On-Demand	Anodyne	MMP1	21	43
O=C(O)C[C@@]1(NS(=O)(=O)c2ccc(-c3ccccc3)cc2)CCCOC1	ZINC000819107892	GF	On-Demand	Anodyne	MMP13	29	43
O=C(O)C[C@@]1(NS(=O)(=O)c2ccc(-c3ccccc3)cc2)CCCOC1	ZINC000819107892	GF	On-Demand	Anodyne	MMP2	20	41
O=C(O)C[C@]1(NS(=O)(=O)c2ccc(-c3ccccc3)cc2)CCCOC1	ZINC000819107893	GF	On-Demand	Anodyne	MMP13	29	43
O=C(O)C[C@]1(NS(=O)(=O)c2ccc(-c3ccccc3)cc2)CCCOC1	ZINC000819107893	GF	On-Demand	Anodyne	MMP2	20	41
O=C(O)C[C@@]1(NS(=O)(=O)c2ccc(CC(F)(F)F)cc2)CCCOC1	ZINC000819107894	GE	On-Demand	Anodyne	MMP13	15	40
O=C(O)C[C@]1(NS(=O)(=O)c2ccc(CC(F)(F)F)cc2)CCCOC1	ZINC000819107895	GE	On-Demand	Anodyne	MMP13	15	40
O=C(O)C[C@]1(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)CCCOC1	ZINC000819107900	GD	On-Demand	Anodyne	MMP13	36	46
O=C(O)C[C@]1(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)CCCOC1	ZINC000819107900	GD	On-Demand	Anodyne	MMP2	41	46
O=C(O)C[C@]1(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)CCCOC1	ZINC000819107900	GD	On-Demand	Anodyne	MMP8	17	46
O=C(O)C[C@@]1(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)CCCOC1	ZINC000819107901	GD	On-Demand	Anodyne	MMP13	36	46
O=C(O)C[C@@]1(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)CCCOC1	ZINC000819107901	GD	On-Demand	Anodyne	MMP2	41	46
O=C(O)C[C@@]1(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)CCCOC1	ZINC000819107901	GD	On-Demand	Anodyne	MMP8	17	46
CCOc1ccc(S(=O)(=O)N[C@]2(CC(=O)O)CCCOC2)c2ccccc12	ZINC000819107908	GF	On-Demand	Anodyne	CCR8	45	41
CCOc1ccc(S(=O)(=O)N[C@@]2(CC(=O)O)CCCOC2)c2ccccc12	ZINC000819107909	GF	On-Demand	Anodyne	CCR8	45	41
N#Cc1ccc(OCCNC[C@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819107946	FG	On-Demand	Mild	ADRB3	16	42
N#Cc1ccc(OCCNC[C@@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819107947	FG	On-Demand	Mild	ADRB3	16	42
CON(C)C(=O)CCNCc1ccc(Oc2ccccc2F)c(F)c1	ZINC000819107954	FG	On-Demand	Anodyne	LEF	50	32
O[C@@H](CNCC1(c2cccc(C(F)(F)F)c2)CCC1)c1cccnc1	ZINC000819107991	FH	On-Demand	Anodyne	ADRB2	19	43
O[C@@H](CNCC1(c2cccc(C(F)(F)F)c2)CCC1)c1cccnc1	ZINC000819107991	FH	On-Demand	Anodyne	ADRB3	78	43
O[C@H](CNCC1(c2cccc(C(F)(F)F)c2)CCC1)c1cccnc1	ZINC000819107992	FH	On-Demand	Anodyne	ADRB2	19	43
O[C@H](CNCC1(c2cccc(C(F)(F)F)c2)CCC1)c1cccnc1	ZINC000819107992	FH	On-Demand	Anodyne	ADRB3	78	43
COc1ccc(OC)c([C@H](O)CNCCOc2ccc(C#N)cc2)c1	ZINC000819108003	EE	On-Demand	Mild	ADRB2	22	44
COc1ccc(OC)c([C@H](O)CNCCOc2ccc(C#N)cc2)c1	ZINC000819108003	EE	On-Demand	Mild	ADRB1	27	40
COc1ccc(OC)c([C@H](O)CNCCOc2ccc(C#N)cc2)c1	ZINC000819108003	EE	On-Demand	Mild	ADRB3	18	40
O=C(O)C[C@]1(NS(=O)(=O)c2ccc(Cl)cc2)CCCOC1	ZINC000819108019	ED	On-Demand	Anodyne	TBXA2R	44	35
O=C(O)C[C@]1(NS(=O)(=O)c2ccc(Cl)cc2)CCCOC1	ZINC000819108019	ED	On-Demand	Anodyne	MMP13	18	53
O=C(O)C[C@@]1(NS(=O)(=O)c2ccc(Cl)cc2)CCCOC1	ZINC000819108020	ED	On-Demand	Anodyne	TBXA2R	44	35
O=C(O)C[C@@]1(NS(=O)(=O)c2ccc(Cl)cc2)CCCOC1	ZINC000819108020	ED	On-Demand	Anodyne	MMP13	18	53
COc1ccc(Cl)cc1S(=O)(=O)N[C@]1(CC(=O)O)CCCOC1	ZINC000819108066	FD	On-Demand	Anodyne	CPT1A	85	43
COc1ccc(Cl)cc1S(=O)(=O)N[C@]1(CC(=O)O)CCCOC1	ZINC000819108066	FD	On-Demand	Anodyne	CPT2	47	37
COc1ccc(Cl)cc1S(=O)(=O)N[C@]1(CC(=O)O)CCCOC1	ZINC000819108066	FD	On-Demand	Anodyne	CPT1B	85	38
COc1ccc(Cl)cc1S(=O)(=O)N[C@]1(CC(=O)O)CCCOC1	ZINC000819108066	FD	On-Demand	Anodyne	PTGDR2	45	37
COc1ccc(Cl)cc1S(=O)(=O)N[C@@]1(CC(=O)O)CCCOC1	ZINC000819108067	FD	On-Demand	Anodyne	CPT1A	85	43
COc1ccc(Cl)cc1S(=O)(=O)N[C@@]1(CC(=O)O)CCCOC1	ZINC000819108067	FD	On-Demand	Anodyne	CPT2	47	37
COc1ccc(Cl)cc1S(=O)(=O)N[C@@]1(CC(=O)O)CCCOC1	ZINC000819108067	FD	On-Demand	Anodyne	CPT1B	85	38
COc1ccc(Cl)cc1S(=O)(=O)N[C@@]1(CC(=O)O)CCCOC1	ZINC000819108067	FD	On-Demand	Anodyne	PTGDR2	45	37
N#Cc1ccc(OCCNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819108074	FG	On-Demand	Mild	ADRB2	17	42
N#Cc1ccc(OCCNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819108074	FG	On-Demand	Mild	ADRB1	37	45
N#Cc1ccc(OCCNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819108074	FG	On-Demand	Mild	ADRB3	35	45
N#Cc1ccc(OCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819108075	FG	On-Demand	Mild	ADRB2	17	42
N#Cc1ccc(OCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819108075	FG	On-Demand	Mild	ADRB1	37	45
N#Cc1ccc(OCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819108075	FG	On-Demand	Mild	ADRB3	35	45
O=C(O)C[C@@]1(NS(=O)(=O)Cc2ccc(OC(F)(F)F)cc2)CCCOC1	ZINC000819108118	GE	On-Demand	Anodyne	MMP13	22	42
O=C(O)C[C@@]1(NS(=O)(=O)Cc2ccc(OC(F)(F)F)cc2)CCCOC1	ZINC000819108118	GE	On-Demand	Anodyne	MMP2	30	42
O=C(O)C[C@]1(NS(=O)(=O)Cc2ccc(OC(F)(F)F)cc2)CCCOC1	ZINC000819108119	GE	On-Demand	Anodyne	MMP13	22	42
O=C(O)C[C@]1(NS(=O)(=O)Cc2ccc(OC(F)(F)F)cc2)CCCOC1	ZINC000819108119	GE	On-Demand	Anodyne	MMP2	30	42
COC(=O)C1(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)CCCCC1	ZINC000819108159	GH	On-Demand	Anodyne	METAP1	46	40
COC(=O)C1(NC(=O)c2cc(-c3ccccn3)nc3ccccc23)CCCCC1	ZINC000819108159	GH	On-Demand	Anodyne	TACR3	24	51
O=C(O)C[C@]1(NS(=O)(=O)c2ccc(Br)cc2)CCCOC1	ZINC000819108206	GD	On-Demand	Anodyne	MMP13	20	44
O=C(O)C[C@@]1(NS(=O)(=O)c2ccc(Br)cc2)CCCOC1	ZINC000819108207	GD	On-Demand	Anodyne	MMP13	20	44
CN(C)c1ccc(N2CCC(NC[C@H](O)c3ccc(F)cn3)CC2)cc1	ZINC000819108219	FF	On-Demand	Anodyne	ADRB3	18	40
CN(C)c1ccc(N2CCC(NC[C@@H](O)c3ccc(F)cn3)CC2)cc1	ZINC000819108220	FF	On-Demand	Anodyne	ADRB3	18	40
CC(=O)c1cccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c1	ZINC000819108223	GE	On-Demand	Anodyne	AKR1C3	71	45
CC(=O)c1cccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c1	ZINC000819108223	GE	On-Demand	Anodyne	SFRP1	18	43
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CC[C@@H]3CCC[C@@H]3C2)cc1	ZINC000819108233	EF	On-Demand	Anodyne	ADRB3	18	42
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CC[C@H]3CCC[C@@H]3C2)cc1	ZINC000819108234	EF	On-Demand	Anodyne	ADRB3	18	42
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CC[C@@H]3CCC[C@H]3C2)cc1	ZINC000819108235	EF	On-Demand	Anodyne	ADRB3	18	42
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CC[C@H]3CCC[C@H]3C2)cc1	ZINC000819108236	EF	On-Demand	Anodyne	ADRB3	18	42
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)CC1	ZINC000819108237	IH	On-Demand	Anodyne	EPHX2	19	43
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)CC1	ZINC000819108237	IH	On-Demand	Anodyne	TRPV4	16	40
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)CC1	ZINC000819108237	IH	On-Demand	Anodyne	SFRP1	108	40
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(Cl)cc2C(F)(F)F)CC1	ZINC000819108237	IH	On-Demand	Anodyne	WNT3	68	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)Cc1csc3ccccc13)C2	ZINC000819108243	FH	On-Demand	Anodyne	FFAR2	43	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)Cc1csc3ccccc13)C2	ZINC000819108244	FH	On-Demand	Anodyne	FFAR2	43	32
CN(C)c1ccc(N2CCC(NC[C@@H](O)c3cc4ccccc4o3)CC2)cc1	ZINC000819108247	GH	On-Demand	Anodyne	ADRB3	20	41
O=C(NCc1cccc(OCC(F)(F)F)c1)C(F)=C1CCC1	ZINC000819108253	DH	On-Demand	Anodyne	PDS	70	42
Cc1ccc(OC[C@H](O)CNC2CCN(c3ccc(N(C)C)cc3)CC2)cc1	ZINC000819108288	GG	On-Demand	Anodyne	ADRB2	35	49
Cc1ccc(OC[C@H](O)CNC2CCN(c3ccc(N(C)C)cc3)CC2)cc1	ZINC000819108288	GG	On-Demand	Anodyne	ADRB1	44	50
Cc1ccc(OC[C@H](O)CNC2CCN(c3ccc(N(C)C)cc3)CC2)cc1	ZINC000819108288	GG	On-Demand	Anodyne	ADRB3	39	51
Cc1ccc(OC[C@@H](O)CNC2CCN(c3ccc(N(C)C)cc3)CC2)cc1	ZINC000819108289	GG	On-Demand	Anodyne	ADRB2	35	49
Cc1ccc(OC[C@@H](O)CNC2CCN(c3ccc(N(C)C)cc3)CC2)cc1	ZINC000819108289	GG	On-Demand	Anodyne	ADRB1	44	50
Cc1ccc(OC[C@@H](O)CNC2CCN(c3ccc(N(C)C)cc3)CC2)cc1	ZINC000819108289	GG	On-Demand	Anodyne	ADRB3	39	51
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(OCC(F)(F)F)c1	ZINC000819108369	EF	On-Demand	Anodyne	PDS	42	36
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(OCC(F)(F)F)c1	ZINC000819108370	EF	On-Demand	Anodyne	PDS	42	36
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(OCC(F)(F)F)c1	ZINC000819108371	EF	On-Demand	Anodyne	PDS	42	36
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(OCC(F)(F)F)c1	ZINC000819108372	EF	On-Demand	Anodyne	PDS	42	36
CN(C)c1ccc(N2CCC(NC[C@H](O)CN(C)C3CC3)CC2)cc1	ZINC000819108382	ED	On-Demand	Anodyne	ADRB3	22	40
CN(C)c1ccc(N2CCC(NC[C@@H](O)CN(C)C3CC3)CC2)cc1	ZINC000819108383	ED	On-Demand	Anodyne	ADRB3	22	40
CCOC(=O)CC[C@H](O)CNC1CCN(c2ccc(N(C)C)cc2)CC1	ZINC000819108393	FE	On-Demand	Anodyne	ADRB2	17	40
CCOC(=O)CC[C@H](O)CNC1CCN(c2ccc(N(C)C)cc2)CC1	ZINC000819108393	FE	On-Demand	Anodyne	ADRB3	21	44
CCOC(=O)CC[C@@H](O)CNC1CCN(c2ccc(N(C)C)cc2)CC1	ZINC000819108394	FE	On-Demand	Anodyne	ADRB2	17	40
CCOC(=O)CC[C@@H](O)CNC1CCN(c2ccc(N(C)C)cc2)CC1	ZINC000819108394	FE	On-Demand	Anodyne	ADRB3	21	44
Cc1cc(C)c(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c(C)c1	ZINC000819108397	GG	On-Demand	Anodyne	EPHX2	29	54
Cc1cc(C)c(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c(C)c1	ZINC000819108397	GG	On-Demand	Anodyne	RAPGEF4	37	40
COc1ccc(OC)c([C@H](O)CNC[C@@H](C)Oc2cccc(C)c2)c1	ZINC000819108399	EG	On-Demand	Anodyne	MTNR1A	28	49
COc1ccc(OC)c([C@H](O)CNC[C@@H](C)Oc2cccc(C)c2)c1	ZINC000819108399	EG	On-Demand	Anodyne	MTNR1B	30	49
COc1ccc(OC)c([C@H](O)CNC[C@H](C)Oc2cccc(C)c2)c1	ZINC000819108400	EG	On-Demand	Anodyne	MTNR1A	28	49
COc1ccc(OC)c([C@H](O)CNC[C@H](C)Oc2cccc(C)c2)c1	ZINC000819108400	EG	On-Demand	Anodyne	MTNR1B	30	49
C[C@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108431	GH	On-Demand	Mild	KLK3	57	32
C[C@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108431	GH	On-Demand	Mild	PAPA1_CARPA	72	50
C[C@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108431	GH	On-Demand	Mild	CCKAR	53	40
C[C@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108431	GH	On-Demand	Mild	CTSK	27	44
C[C@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108431	GH	On-Demand	Mild	CTSL	32	50
C[C@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108431	GH	On-Demand	Mild	CAPNS1	46	30
C[C@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108431	GH	On-Demand	Mild	REN	44	40
C[C@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108431	GH	On-Demand	Mild	CTSS	19	50
C[C@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108431	GH	On-Demand	Mild	CAPN1	27	43
C[C@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108431	GH	On-Demand	Mild	CAPN2	44	33
C[C@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108431	GH	On-Demand	Mild	FPR1	55	46
C[C@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108432	GH	On-Demand	Mild	KLK3	57	32
C[C@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108432	GH	On-Demand	Mild	PAPA1_CARPA	72	50
C[C@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108432	GH	On-Demand	Mild	CCKAR	53	40
C[C@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108432	GH	On-Demand	Mild	CTSK	27	44
C[C@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108432	GH	On-Demand	Mild	CTSL	32	50
C[C@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108432	GH	On-Demand	Mild	CAPNS1	46	30
C[C@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108432	GH	On-Demand	Mild	REN	44	40
C[C@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108432	GH	On-Demand	Mild	CTSS	19	50
C[C@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108432	GH	On-Demand	Mild	CAPN1	27	43
C[C@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108432	GH	On-Demand	Mild	CAPN2	44	33
C[C@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108432	GH	On-Demand	Mild	FPR1	55	46
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108433	GH	On-Demand	Mild	KLK3	57	32
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108433	GH	On-Demand	Mild	PAPA1_CARPA	72	50
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108433	GH	On-Demand	Mild	CCKAR	53	40
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108433	GH	On-Demand	Mild	CTSK	27	44
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108433	GH	On-Demand	Mild	CTSL	32	50
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108433	GH	On-Demand	Mild	CAPNS1	46	30
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108433	GH	On-Demand	Mild	REN	44	40
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108433	GH	On-Demand	Mild	CTSS	19	50
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108433	GH	On-Demand	Mild	CAPN1	27	43
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108433	GH	On-Demand	Mild	CAPN2	44	33
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108433	GH	On-Demand	Mild	FPR1	55	46
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108434	GH	On-Demand	Mild	KLK3	57	32
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108434	GH	On-Demand	Mild	PAPA1_CARPA	72	50
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108434	GH	On-Demand	Mild	CCKAR	53	40
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108434	GH	On-Demand	Mild	CTSK	27	44
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108434	GH	On-Demand	Mild	CTSL	32	50
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108434	GH	On-Demand	Mild	CAPNS1	46	30
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108434	GH	On-Demand	Mild	REN	44	40
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108434	GH	On-Demand	Mild	CTSS	19	50
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108434	GH	On-Demand	Mild	CAPN1	27	43
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108434	GH	On-Demand	Mild	CAPN2	44	33
C[C@@H](Cc1ccccc1Cl)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108434	GH	On-Demand	Mild	FPR1	55	46
O=C(Cc1nsc2ccccc12)NCCc1ccc(N2CCCCC2)cc1	ZINC000819108458	GI	On-Demand	Anodyne	HTR1A	21	43
O=C(Cc1nsc2ccccc12)NCCc1ccc(N2CCCCC2)cc1	ZINC000819108458	GI	On-Demand	Anodyne	DRD2	25	41
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCCN1c1ccc(OC(F)F)cc1	ZINC000819108465	GF	On-Demand	Anodyne	ADRB3	54	44
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCCN1c1ccc(OC(F)F)cc1	ZINC000819108466	GF	On-Demand	Anodyne	ADRB3	54	44
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCCN1c1ccc(OC(F)F)cc1	ZINC000819108467	GF	On-Demand	Anodyne	ADRB3	54	44
O=C1[C@H](NC[C@H](O)c2cccnc2)CCCN1c1ccc(OC(F)F)cc1	ZINC000819108468	GF	On-Demand	Anodyne	ADRB3	54	44
Cc1cnc(CNC[C@@H](O)c2cccnc2)s1	ZINC000819108480	BD	On-Demand	Anodyne	ADRB2	22	49
Cc1cnc(CNC[C@@H](O)c2cccnc2)s1	ZINC000819108480	BD	On-Demand	Anodyne	ADRB1	26	49
Cc1cnc(CNC[C@@H](O)c2cccnc2)s1	ZINC000819108480	BD	On-Demand	Anodyne	ADRB3	95	49
Cc1cnc(CNC[C@H](O)c2cccnc2)s1	ZINC000819108481	BD	On-Demand	Anodyne	ADRB2	22	49
Cc1cnc(CNC[C@H](O)c2cccnc2)s1	ZINC000819108481	BD	On-Demand	Anodyne	ADRB1	26	49
Cc1cnc(CNC[C@H](O)c2cccnc2)s1	ZINC000819108481	BD	On-Demand	Anodyne	ADRB3	95	49
COC[C@@H](C)OC[C@H](O)CNC1CCN(c2ccc(N(C)C)cc2)CC1	ZINC000819108484	FD	On-Demand	Anodyne	ADRB2	15	41
COC[C@@H](C)OC[C@H](O)CNC1CCN(c2ccc(N(C)C)cc2)CC1	ZINC000819108484	FD	On-Demand	Anodyne	ADRB3	23	40
COC[C@@H](C)OC[C@@H](O)CNC1CCN(c2ccc(N(C)C)cc2)CC1	ZINC000819108485	FD	On-Demand	Anodyne	ADRB2	15	41
COC[C@@H](C)OC[C@@H](O)CNC1CCN(c2ccc(N(C)C)cc2)CC1	ZINC000819108485	FD	On-Demand	Anodyne	ADRB3	23	40
CC(C)c1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819108487	GG	On-Demand	Anodyne	TGM2	47	36
O[C@H](CN[C@@H]1CC[C@@H]2CCC[C@H]2C1)c1ccc(F)cc1	ZINC000819108489	CG	On-Demand	Anodyne	SLC6A3	15	52
O[C@H](CN[C@@H]1CC[C@H]2CCC[C@H]2C1)c1ccc(F)cc1	ZINC000819108490	CG	On-Demand	Anodyne	SLC6A3	15	52
O[C@H](CN[C@@H]1CC[C@@H]2CCC[C@@H]2C1)c1ccc(F)cc1	ZINC000819108491	CG	On-Demand	Anodyne	SLC6A3	15	52
O[C@H](CN[C@@H]1CC[C@H]2CCC[C@@H]2C1)c1ccc(F)cc1	ZINC000819108492	CG	On-Demand	Anodyne	SLC6A3	15	52
CN(C)c1ccc(N2CCC(NC[C@@H](O)COc3ccc(C#N)cc3)CC2)cc1	ZINC000819108504	GF	On-Demand	Mild	ADRB2	29	45
CN(C)c1ccc(N2CCC(NC[C@@H](O)COc3ccc(C#N)cc3)CC2)cc1	ZINC000819108504	GF	On-Demand	Mild	ADRB1	38	46
CN(C)c1ccc(N2CCC(NC[C@@H](O)COc3ccc(C#N)cc3)CC2)cc1	ZINC000819108504	GF	On-Demand	Mild	ADRB3	33	51
CN(C)c1ccc(N2CCC(NC[C@H](O)COc3ccc(C#N)cc3)CC2)cc1	ZINC000819108505	GF	On-Demand	Mild	ADRB2	29	45
CN(C)c1ccc(N2CCC(NC[C@H](O)COc3ccc(C#N)cc3)CC2)cc1	ZINC000819108505	GF	On-Demand	Mild	ADRB1	38	46
CN(C)c1ccc(N2CCC(NC[C@H](O)COc3ccc(C#N)cc3)CC2)cc1	ZINC000819108505	GF	On-Demand	Mild	ADRB3	33	51
C[C@@H](CCc1cccn1C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819108584	DG	On-Demand	Anodyne	ADRB2	16	51
C[C@@H](CCc1cccn1C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819108584	DG	On-Demand	Anodyne	ADRB1	34	51
C[C@@H](CCc1cccn1C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819108584	DG	On-Demand	Anodyne	ADRB3	52	51
C[C@@H](CCc1cccn1C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819108585	DG	On-Demand	Anodyne	ADRB2	16	51
C[C@@H](CCc1cccn1C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819108585	DG	On-Demand	Anodyne	ADRB1	34	51
C[C@@H](CCc1cccn1C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819108585	DG	On-Demand	Anodyne	ADRB3	52	51
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1	ZINC000819108586	GD	On-Demand	Anodyne	PKM	54	59
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)CC1	ZINC000819108599	IH	On-Demand	Anodyne	EPHX2	20	45
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)CC1	ZINC000819108599	IH	On-Demand	Anodyne	LIPG	49	38
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)CC1	ZINC000819108599	IH	On-Demand	Anodyne	SFRP1	45	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cnn(Cc3ccccc3)c1)C2	ZINC000819108605	GE	On-Demand	Anodyne	PANC	54	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cnn(Cc3ccccc3)c1)C2	ZINC000819108606	GE	On-Demand	Anodyne	PANC	54	40
C[C@@H](CCc1cccn1C)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819108623	GF	On-Demand	Anodyne	GPR119	38	45
C[C@@H](CCc1cccn1C)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819108624	GF	On-Demand	Anodyne	GPR119	38	45
C[C@@H](CCc1cccn1C)NC[C@@H](O)c1ccccc1	ZINC000819108630	CF	On-Demand	Anodyne	ADRB2	19	49
C[C@@H](CCc1cccn1C)NC[C@@H](O)c1ccccc1	ZINC000819108630	CF	On-Demand	Anodyne	ADRB1	17	46
C[C@@H](CCc1cccn1C)NC[C@@H](O)c1ccccc1	ZINC000819108630	CF	On-Demand	Anodyne	ADRB3	40	46
C[C@@H](CCc1cccn1C)NC[C@H](O)c1ccccc1	ZINC000819108631	CF	On-Demand	Anodyne	ADRB2	19	49
C[C@@H](CCc1cccn1C)NC[C@H](O)c1ccccc1	ZINC000819108631	CF	On-Demand	Anodyne	ADRB1	17	46
C[C@@H](CCc1cccn1C)NC[C@H](O)c1ccccc1	ZINC000819108631	CF	On-Demand	Anodyne	ADRB3	40	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccc(OCc2ccccn2)c1	ZINC000819108640	GG	On-Demand	Anodyne	PDS	49	34
Cc1ccc(OC[C@H](O)CNC2CCN(c3ccc(N(C)C)cc3)CC2)c(C)c1	ZINC000819108653	GG	On-Demand	Anodyne	ADRB2	25	45
Cc1ccc(OC[C@H](O)CNC2CCN(c3ccc(N(C)C)cc3)CC2)c(C)c1	ZINC000819108653	GG	On-Demand	Anodyne	ADRB1	17	45
Cc1ccc(OC[C@H](O)CNC2CCN(c3ccc(N(C)C)cc3)CC2)c(C)c1	ZINC000819108653	GG	On-Demand	Anodyne	ADRB3	27	42
Cc1ccc(OC[C@@H](O)CNC2CCN(c3ccc(N(C)C)cc3)CC2)c(C)c1	ZINC000819108654	GG	On-Demand	Anodyne	ADRB2	25	45
Cc1ccc(OC[C@@H](O)CNC2CCN(c3ccc(N(C)C)cc3)CC2)c(C)c1	ZINC000819108654	GG	On-Demand	Anodyne	ADRB1	17	45
Cc1ccc(OC[C@@H](O)CNC2CCN(c3ccc(N(C)C)cc3)CC2)c(C)c1	ZINC000819108654	GG	On-Demand	Anodyne	ADRB3	27	42
Cc1cnc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000819108667	FF	On-Demand	Anodyne	GPR119	57	44
Cc1cnc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000819108668	FF	On-Demand	Anodyne	GPR119	57	44
CN(C)c1ccc(N2CCC(NC[C@H](O)Cc3ccc(F)cc3)CC2)cc1	ZINC000819108679	FG	On-Demand	Anodyne	ADRB3	23	41
CN(C)c1ccc(N2CCC(NC[C@@H](O)Cc3ccc(F)cc3)CC2)cc1	ZINC000819108680	FG	On-Demand	Anodyne	ADRB3	23	41
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H](CC1CC1)c1ccccc1	ZINC000819108692	EG	On-Demand	Anodyne	REN	45	39
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H](CC1CC1)c1ccccc1	ZINC000819108693	EG	On-Demand	Anodyne	REN	45	39
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H](CC1CC1)c1ccccc1	ZINC000819108694	EG	On-Demand	Anodyne	REN	45	39
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H](CC1CC1)c1ccccc1	ZINC000819108695	EG	On-Demand	Anodyne	REN	45	39
O[C@H](CN[C@@H]1CC[C@H]2CCC[C@H]2C1)c1cccnc1	ZINC000819108743	CF	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CN[C@@H]1CC[C@H]2CCC[C@H]2C1)c1cccnc1	ZINC000819108743	CF	On-Demand	Anodyne	ADRB3	78	48
O[C@H](CN[C@@H]1CC[C@H]2CCC[C@@H]2C1)c1cccnc1	ZINC000819108744	CF	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CN[C@@H]1CC[C@H]2CCC[C@@H]2C1)c1cccnc1	ZINC000819108744	CF	On-Demand	Anodyne	ADRB3	78	48
O[C@H](CN[C@@H]1CC[C@@H]2CCC[C@@H]2C1)c1cccnc1	ZINC000819108745	CF	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CN[C@@H]1CC[C@@H]2CCC[C@@H]2C1)c1cccnc1	ZINC000819108745	CF	On-Demand	Anodyne	ADRB3	78	48
O[C@H](CN[C@@H]1CC[C@@H]2CCC[C@H]2C1)c1cccnc1	ZINC000819108746	CF	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CN[C@@H]1CC[C@@H]2CCC[C@H]2C1)c1cccnc1	ZINC000819108746	CF	On-Demand	Anodyne	ADRB3	78	48
CN(C)c1ccc(N2CCC(NC[C@@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000819108764	FF	On-Demand	Mild	ADRB3	18	47
CN(C)c1ccc(N2CCC(NC[C@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000819108765	FF	On-Demand	Mild	ADRB3	18	47
O=C(NCc1cnn(Cc2ccccc2)c1)C(F)=C1CCC1	ZINC000819108774	CF	On-Demand	Anodyne	PANC	48	38
CN(C)c1ccc(N2CCC(NC[C@H](O)COc3ccccc3F)CC2)cc1	ZINC000819108784	GF	On-Demand	Anodyne	ADRB2	34	55
CN(C)c1ccc(N2CCC(NC[C@H](O)COc3ccccc3F)CC2)cc1	ZINC000819108784	GF	On-Demand	Anodyne	ADRB1	27	55
CN(C)c1ccc(N2CCC(NC[C@H](O)COc3ccccc3F)CC2)cc1	ZINC000819108784	GF	On-Demand	Anodyne	ADRB3	33	55
CN(C)c1ccc(N2CCC(NC[C@H](O)COc3ccccc3F)CC2)cc1	ZINC000819108784	GF	On-Demand	Anodyne	ABCB1	21	40
CN(C)c1ccc(N2CCC(NC[C@@H](O)COc3ccccc3F)CC2)cc1	ZINC000819108785	GF	On-Demand	Anodyne	ADRB2	34	55
CN(C)c1ccc(N2CCC(NC[C@@H](O)COc3ccccc3F)CC2)cc1	ZINC000819108785	GF	On-Demand	Anodyne	ADRB1	27	55
CN(C)c1ccc(N2CCC(NC[C@@H](O)COc3ccccc3F)CC2)cc1	ZINC000819108785	GF	On-Demand	Anodyne	ADRB3	33	55
CN(C)c1ccc(N2CCC(NC[C@@H](O)COc3ccccc3F)CC2)cc1	ZINC000819108785	GF	On-Demand	Anodyne	ABCB1	21	40
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)CC1	ZINC000819108787	IH	On-Demand	Anodyne	SFRP1	129	45
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(Cl)c(C(F)(F)F)c2)CC1	ZINC000819108787	IH	On-Demand	Anodyne	WNT3	82	33
C=C(C)C(C)(C)C(=O)N[C@H](C)Cc1ccccc1Cl	ZINC000819108788	CH	On-Demand	Mild	CXCL8	48	38
C=C(C)C(C)(C)C(=O)N[C@@H](C)Cc1ccccc1Cl	ZINC000819108789	CH	On-Demand	Mild	CXCL8	48	38
CN(C)c1ccc(N2CCC(NC[C@H](O)COCc3cccs3)CC2)cc1	ZINC000819108796	GF	On-Demand	Anodyne	ADRB2	18	45
CN(C)c1ccc(N2CCC(NC[C@H](O)COCc3cccs3)CC2)cc1	ZINC000819108796	GF	On-Demand	Anodyne	ADRB1	15	45
CN(C)c1ccc(N2CCC(NC[C@H](O)COCc3cccs3)CC2)cc1	ZINC000819108796	GF	On-Demand	Anodyne	ADRB3	25	45
CN(C)c1ccc(N2CCC(NC[C@@H](O)COCc3cccs3)CC2)cc1	ZINC000819108797	GF	On-Demand	Anodyne	ADRB2	18	45
CN(C)c1ccc(N2CCC(NC[C@@H](O)COCc3cccs3)CC2)cc1	ZINC000819108797	GF	On-Demand	Anodyne	ADRB1	15	45
CN(C)c1ccc(N2CCC(NC[C@@H](O)COCc3cccs3)CC2)cc1	ZINC000819108797	GF	On-Demand	Anodyne	ADRB3	25	45
COC(=O)C1(NC(=O)c2cc(S(=O)(=O)Nc3ccc(C)c(C)c3)ccc2Cl)CCCCC1	ZINC000819108814	JI	On-Demand	Anodyne	PKM	35	42
O=C(NCc1cccc(OCc2ccccn2)c1)C(F)=C1CCC1	ZINC000819108815	EH	On-Demand	Anodyne	PDS	56	37
CC(=O)Nc1cccc(CC(=O)NCCc2ccc(N3CCCCC3)cc2)c1	ZINC000819108820	GH	On-Demand	Anodyne	PTGIR	15	43
CC(=O)Nc1cccc(CC(=O)NCCc2ccc(N3CCCCC3)cc2)c1	ZINC000819108820	GH	On-Demand	Anodyne	TAAR1	24	40
CC(=O)Nc1cccc(CC(=O)NCCc2ccc(N3CCCCC3)cc2)c1	ZINC000819108820	GH	On-Demand	Anodyne	NCE103	15	42
CN(C)c1ccc(N2CCC(NC[C@H](O)c3cccc4ccccc34)CC2)cc1	ZINC000819108834	GI	On-Demand	Anodyne	ADRB3	20	43
O=C(NCCc1ccc(N2CCCCC2)cc1)c1coc(=O)c2ccccc12	ZINC000819108859	GH	On-Demand	Anodyne	CTSK	20	40
O=C(NCCc1ccc(N2CCCCC2)cc1)c1coc(=O)c2ccccc12	ZINC000819108859	GH	On-Demand	Anodyne	CTSL	17	40
COc1ccc(Cl)cc1S(=O)(=O)N1CCC(n2cccc2C(=O)O)CC1	ZINC000819108866	GF	On-Demand	Anodyne	ADRA1D	19	41
COc1ccc(Cl)cc1S(=O)(=O)N1CCC(n2cccc2C(=O)O)CC1	ZINC000819108866	GF	On-Demand	Anodyne	ADRA1B	16	41
COc1ccc(Cl)cc1S(=O)(=O)N1CCC(n2cccc2C(=O)O)CC1	ZINC000819108866	GF	On-Demand	Anodyne	CPT1A	87	43
COc1ccc(Cl)cc1S(=O)(=O)N1CCC(n2cccc2C(=O)O)CC1	ZINC000819108866	GF	On-Demand	Anodyne	CPT2	56	42
COc1ccc(Cl)cc1S(=O)(=O)N1CCC(n2cccc2C(=O)O)CC1	ZINC000819108866	GF	On-Demand	Anodyne	CPT1B	77	41
COCc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108888	FG	On-Demand	Mild	PAPA1_CARPA	65	51
COCc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108888	FG	On-Demand	Mild	CCKAR	48	38
COCc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108888	FG	On-Demand	Mild	CTSK	22	45
COCc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108888	FG	On-Demand	Mild	CTSL	20	51
COCc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108888	FG	On-Demand	Mild	CTSS	15	51
COCc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108888	FG	On-Demand	Mild	FPR1	46	40
COCc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108889	FG	On-Demand	Mild	PAPA1_CARPA	65	51
COCc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108889	FG	On-Demand	Mild	CCKAR	48	38
COCc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108889	FG	On-Demand	Mild	CTSK	22	45
COCc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108889	FG	On-Demand	Mild	CTSL	20	51
COCc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108889	FG	On-Demand	Mild	CTSS	15	51
COCc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819108889	FG	On-Demand	Mild	FPR1	46	40
COc1cc(CNC(=O)C(F)=C2CCC2)ccc1OCC(=O)N(C)C	ZINC000819108896	FE	On-Demand	Anodyne	PDE6A	41	32
COc1cc(CNC(=O)C(F)=C2CCC2)ccc1OCC(=O)N(C)C	ZINC000819108896	FE	On-Demand	Anodyne	DRTS_TRYCR	42	29
CN(C)c1ccc(N2CCC(NCCC(=O)Nc3cccnc3)CC2)cc1	ZINC000819108916	FF	On-Demand	Anodyne	CHRNA7	17	42
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1	ZINC000819108917	HG	On-Demand	Anodyne	AKR1C3	53	37
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1	ZINC000819108917	HG	On-Demand	Anodyne	SFRP1	29	40
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2cc3ccccc3o2)CC1	ZINC000819108930	FF	On-Demand	Anodyne	LPL	45	35
N#Cc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1Cl	ZINC000819108932	GF	On-Demand	Mild	PGR	15	41
N#Cc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1Cl	ZINC000819108932	GF	On-Demand	Mild	AKR1C3	44	37
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819108947	GE	On-Demand	Anodyne	EPHX2	24	42
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819108947	GE	On-Demand	Anodyne	TGM2	85	42
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819108947	GE	On-Demand	Anodyne	F13A1	98	43
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819108947	GE	On-Demand	Anodyne	IDO1	28	40
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819108947	GE	On-Demand	Anodyne	NAMPT	34	42
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(NC(=O)Nc2ccccc2)cc1	ZINC000819108963	GI	On-Demand	Anodyne	F7	23	40
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(NC(=O)Nc2ccccc2)cc1	ZINC000819108965	GI	On-Demand	Anodyne	F7	23	40
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2c(F)cccc2Cl)CC1	ZINC000819108966	GG	On-Demand	Anodyne	EPHX2	17	45
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2c(F)cccc2Cl)CC1	ZINC000819108966	GG	On-Demand	Anodyne	PKM	23	47
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(NC(=O)Nc2ccccc2)cc1	ZINC000819108967	GI	On-Demand	Anodyne	F7	23	40
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(NC(=O)Nc2ccccc2)cc1	ZINC000819108969	GI	On-Demand	Anodyne	F7	23	40
CN1CCN(C(=O)c2ccc(CNC(=O)/C=C/[C@@H]3CCCO3)cc2)CC1	ZINC000819108988	FD	On-Demand	Anodyne	L3MBTL3	52	41
CN1CCN(C(=O)c2ccc(CNC(=O)/C=C\[C@H]3CCCO3)cc2)CC1	ZINC000819108990	FD	On-Demand	Anodyne	L3MBTL3	52	41
CN1CCN(C(=O)c2ccc(CNC(=O)/C=C/[C@H]3CCCO3)cc2)CC1	ZINC000819108992	FD	On-Demand	Anodyne	L3MBTL3	52	41
CN1CCN(C(=O)c2ccc(CNC(=O)/C=C\[C@@H]3CCCO3)cc2)CC1	ZINC000819108994	FD	On-Demand	Anodyne	L3MBTL3	52	41
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819109043	HG	On-Demand	Anodyne	EPHX2	16	41
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819109043	HG	On-Demand	Anodyne	RBP4	74	38
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819109043	HG	On-Demand	Anodyne	SFRP1	128	44
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819109043	HG	On-Demand	Anodyne	WNT3	83	34
Cc1c(C)c(C)c(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c(C)c1C	ZINC000819109052	HH	On-Demand	Anodyne	EPHX2	22	44
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000819109053	HF	On-Demand	Bother	EPHX2	16	43
Cc1cc(C#N)ccc1S(=O)(=O)N1CCC(n2cccc2C(=O)O)CC1	ZINC000819109054	FE	On-Demand	Mild	EPHX2	23	44
CC(=O)N1CCc2cc(S(=O)(=O)N3CCC(n4cccc4C(=O)O)CC3)ccc21	ZINC000819109055	HE	On-Demand	Anodyne	AKR1C3	54	34
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(OC3CC3)cc2)CC1	ZINC000819109056	GF	On-Demand	Anodyne	TGM2	40	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000819109073	FE	On-Demand	Anodyne	FPR1	41	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cnn(Cc2ccccc2)c1	ZINC000819109073	FE	On-Demand	Anodyne	PANC	56	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccnc1N1CCCC1	ZINC000819109087	EF	On-Demand	Anodyne	KCNQ2	43	33
COC(=O)C1(NC(=O)c2cc(Cl)nc3ccccc23)CCCCC1	ZINC000819109118	EG	On-Demand	Anodyne	NTSR2	28	44
COC(=O)C1(NC(=O)c2cc(Cl)nc3ccccc23)CCCCC1	ZINC000819109118	EG	On-Demand	Anodyne	TACR3	25	47
CC(=O)N1CCc2ccc(S(=O)(=O)N3CCC(n4cccc4C(=O)O)CC3)cc21	ZINC000819109171	HE	On-Demand	Anodyne	AKR1C3	56	35
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc3ncccc3c2)CC1	ZINC000819109180	GF	On-Demand	Anodyne	AKR1C3	33	40
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NC[C@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819109193	GG	On-Demand	Bother	CACNA1C	55	36
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NC[C@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819109193	GG	On-Demand	Bother	CACNA1D	82	36
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819109194	GG	On-Demand	Bother	CACNA1C	55	36
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819109194	GG	On-Demand	Bother	CACNA1D	82	36
NS(=O)(=O)c1cccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c1	ZINC000819109204	HC	On-Demand	Anodyne	CA2	18	40
NS(=O)(=O)c1cccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c1	ZINC000819109204	HC	On-Demand	Anodyne	CA1	17	40
NS(=O)(=O)c1cccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c1	ZINC000819109204	HC	On-Demand	Anodyne	AKR1C3	57	39
NC(=O)c1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109210	GD	On-Demand	Anodyne	TGM2	54	38
NC(=O)c1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109210	GD	On-Demand	Anodyne	F13A1	44	34
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NC[C@@H](O)c1ccc(F)cn1)C2	ZINC000819109213	FF	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NC[C@H](O)c1ccc(F)cn1)C2	ZINC000819109214	FF	On-Demand	Anodyne	GPR119	26	41
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819109215	HG	On-Demand	Anodyne	CNR1	15	42
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819109215	HG	On-Demand	Anodyne	HSD11B1	19	46
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819109215	HG	On-Demand	Anodyne	TGM2	47	42
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819109215	HG	On-Demand	Anodyne	SFRP1	85	44
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2cccc(C(F)F)c2)CC1	ZINC000819109217	GG	On-Demand	Anodyne	AKR1C3	54	37
Nc1cccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c1	ZINC000819109220	ED	On-Demand	Anodyne	PKM	26	49
Nc1cccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c1	ZINC000819109220	ED	On-Demand	Anodyne	AKR1C3	57	39
COC(=O)c1ccc(C)c(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c1	ZINC000819109225	HE	On-Demand	Anodyne	EPHX2	29	49
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2c(F)cc(F)cc2F)CC1	ZINC000819109232	GF	On-Demand	Anodyne	EPHX2	23	40
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2c(F)cc(F)cc2F)CC1	ZINC000819109232	GF	On-Demand	Anodyne	PKM	26	42
O=C(O)c1cccn1C1CCN(S(=O)(=O)Cc2ccc(F)cc2F)CC1	ZINC000819109239	GF	On-Demand	Anodyne	HTR2A	17	44
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1	ZINC000819109241	GG	On-Demand	Anodyne	AKR1C3	64	38
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(-n3cccc3)cc2)CC1	ZINC000819109242	GG	On-Demand	Anodyne	TGM2	45	35
Cc1cnc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819109243	CE	On-Demand	Bother	CACNA1D	55	33
Cc1cnc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819109244	CE	On-Demand	Bother	CACNA1D	55	33
N#Cc1cc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)ccc1Cl	ZINC000819109259	GF	On-Demand	Mild	AKR1C3	42	35
CC1(CS(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)CCCCC1	ZINC000819109260	FG	On-Demand	Anodyne	OXTR	63	38
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109266	FD	On-Demand	Reactive	PLG	19	40
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109266	FD	On-Demand	Reactive	FKBP1A	42	38
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109266	FD	On-Demand	Reactive	SLC6A1	55	37
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109266	FD	On-Demand	Reactive	CELA1	20	45
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109266	FD	On-Demand	Reactive	GRIN2B	46	50
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109266	FD	On-Demand	Reactive	CTSK	17	43
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109266	FD	On-Demand	Reactive	CTSL	18	40
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109266	FD	On-Demand	Reactive	PREP	67	53
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109266	FD	On-Demand	Reactive	LGMN	70	42
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109266	FD	On-Demand	Reactive	TGM2	47	42
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109266	FD	On-Demand	Reactive	DPP7	73	46
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109266	FD	On-Demand	Reactive	F13A1	41	42
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109266	FD	On-Demand	Reactive	BIRC2	15	49
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109266	FD	On-Demand	Reactive	SLC12A5	63	41
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109267	FD	On-Demand	Reactive	PLG	19	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109267	FD	On-Demand	Reactive	FKBP1A	42	38
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109267	FD	On-Demand	Reactive	SLC6A1	55	37
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109267	FD	On-Demand	Reactive	CELA1	20	45
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109267	FD	On-Demand	Reactive	GRIN2B	46	50
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109267	FD	On-Demand	Reactive	CTSK	17	43
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109267	FD	On-Demand	Reactive	CTSL	18	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109267	FD	On-Demand	Reactive	PREP	67	53
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109267	FD	On-Demand	Reactive	LGMN	70	42
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109267	FD	On-Demand	Reactive	TGM2	47	42
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109267	FD	On-Demand	Reactive	DPP7	73	46
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109267	FD	On-Demand	Reactive	F13A1	41	42
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109267	FD	On-Demand	Reactive	BIRC2	15	49
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819109267	FD	On-Demand	Reactive	SLC12A5	63	41
O=C(CC1CC1)NNC(=O)C[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819109268	FF	On-Demand	Reactive	ALOX5	30	40
O=C(CC1CC1)NNC(=O)C[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819109268	FF	On-Demand	Reactive	MAOB	19	40
O=C(CC1CC1)NNC(=O)C[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819109268	FF	On-Demand	Reactive	LTA4H	35	44
O=C(CC1CC1)NNC(=O)C[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819109268	FF	On-Demand	Reactive	ADAM17	31	45
O=C(CC1CC1)NNC(=O)C[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819109268	FF	On-Demand	Reactive	FFAR1	66	45
O=C(CC1CC1)NNC(=O)C[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819109269	FF	On-Demand	Reactive	ALOX5	30	40
O=C(CC1CC1)NNC(=O)C[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819109269	FF	On-Demand	Reactive	MAOB	19	40
O=C(CC1CC1)NNC(=O)C[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819109269	FF	On-Demand	Reactive	LTA4H	35	44
O=C(CC1CC1)NNC(=O)C[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819109269	FF	On-Demand	Reactive	ADAM17	31	45
O=C(CC1CC1)NNC(=O)C[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819109269	FF	On-Demand	Reactive	FFAR1	66	45
O=C(CC1CC1)NNC(=O)c1cc2cc(Cl)ccc2[nH]1	ZINC000819109274	CE	On-Demand	Reactive	CYP51A1	25	45
O=C(CC1CC1)NNC(=O)c1cc2cc(Cl)ccc2[nH]1	ZINC000819109274	CE	On-Demand	Reactive	PYGL	111	57
O=C(CC1CC1)NNC(=O)c1cc2cc(Cl)ccc2[nH]1	ZINC000819109274	CE	On-Demand	Reactive	PYGM	32	47
O=C(CC1CC1)NNC(=O)c1cc2cc(Cl)ccc2[nH]1	ZINC000819109274	CE	On-Demand	Reactive	PYK	27	41
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	ZINC000819109284	HD	On-Demand	Reactive	EPHX2	37	46
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	ZINC000819109284	HD	On-Demand	Reactive	AKR1C3	43	34
O=C(CCc1nc(O)c2ccccc2n1)NNC(=O)CC1CC1	ZINC000819109292	DD	On-Demand	Reactive	TNKS	66	37
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)c2cccc(Br)c2)cc1O	ZINC000819109294	IF	On-Demand	Reactive	KCNK3	86	34
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)c2cccc(Br)c2)cc1O	ZINC000819109294	IF	On-Demand	Reactive	KCNK9	44	34
O=C(CC1CC1)NNC(=O)c1ccn(-c2ccc(Cl)cc2Cl)n1	ZINC000819109295	FF	On-Demand	Reactive	CNR1	55	34
Cc1oc(-c2cccs2)nc1C(=O)NNC(=O)CC1CC1	ZINC000819109315	DE	On-Demand	Reactive	PPARA	26	40
O=C(CC1CC1)NNC(=O)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1	ZINC000819109317	GI	On-Demand	Reactive	SLC1A1	15	40
O=C(CC1CC1)NNC(=O)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1	ZINC000819109317	GI	On-Demand	Reactive	SLC1A3	17	40
O=C(CC1CC1)NNC(=O)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1	ZINC000819109317	GI	On-Demand	Reactive	CCR2	55	42
O=C(CC1CC1)NNC(=O)c1cc(F)ccc1-c1cccc(C(F)(F)F)c1	ZINC000819109317	GI	On-Demand	Reactive	SLC1A2	23	40
O=C(CC1CC1)NNC(=O)[C@@H]1CC[C@H](C(=O)NNC(=O)CC2CC2)N1Cc1ccccc1	ZINC000819109327	IC	On-Demand	Reactive	SIGMAR1	28	42
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819109337	GB	On-Demand	Reactive	MMP13	44	50
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819109337	GB	On-Demand	Reactive	ADAM17	33	54
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819109337	GB	On-Demand	Reactive	MMP2	20	53
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819109337	GB	On-Demand	Reactive	MMP3	52	46
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819109337	GB	On-Demand	Reactive	MMP8	19	42
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819109337	GB	On-Demand	Reactive	MMP7	37	46
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819109337	GB	On-Demand	Reactive	MMP1	43	46
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)NNC(=O)CC2CC2)C1	ZINC000819109344	ED	On-Demand	Reactive	GPR119	39	40
Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)CC1CC1	ZINC000819109345	GC	On-Demand	Reactive	CNR2	18	44
Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)CC1CC1	ZINC000819109345	GC	On-Demand	Reactive	NR1H4	17	43
Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)CC1CC1	ZINC000819109345	GC	On-Demand	Reactive	EPHX2	21	40
Cc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)CC1CC1	ZINC000819109345	GC	On-Demand	Reactive	MERTK	31	40
CN(Cc1csc2ccccc12)C(=O)C(F)=C1CCC1	ZINC000819109348	CI	On-Demand	Anodyne	FFAR2	61	35
CCCc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109350	GG	On-Demand	Anodyne	TGM2	51	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CC[C@@H]3CCC[C@H]3C2)CC1	ZINC000819109352	FH	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CC[C@@H]3CCC[C@@H]3C2)CC1	ZINC000819109353	FH	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CC[C@H]3CCC[C@@H]3C2)CC1	ZINC000819109354	FH	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CC[C@H]3CCC[C@H]3C2)CC1	ZINC000819109357	FH	On-Demand	Anodyne	GPR119	36	42
Cc1ccc(-n2ncc(C(=O)NNC(=O)CC3CC3)c2C)cc1	ZINC000819109361	DE	On-Demand	Reactive	P2RY12	30	40
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819109377	ED	On-Demand	Reactive	PAPA1_CARPA	34	56
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819109377	ED	On-Demand	Reactive	FPR1	22	45
CN1CCN(C(=O)c2ccc(CNC(=O)C(F)=C3CCC3)cc2)CC1	ZINC000819109384	EE	On-Demand	Anodyne	L3MBTL3	45	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1c1ccsc1	ZINC000819109395	EG	On-Demand	Anodyne	NPBWR1	89	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1c1ccsc1	ZINC000819109396	EG	On-Demand	Anodyne	NPBWR1	89	34
O=C(CCNC(=O)NC12CC3CC(CC(C3)C1)C2)NNC(=O)CC1CC1	ZINC000819109397	FD	On-Demand	Reactive	EPHX2	104	59
O=C(CCCc1cccc(Br)c1)NNC(=O)CC1CC1	ZINC000819109400	EF	On-Demand	Reactive	LUXR	20	47
CC(=O)c1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109406	GE	On-Demand	Anodyne	TGM2	52	38
CC(=O)c1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109406	GE	On-Demand	Anodyne	F13A1	40	32
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc3nc(O)oc3c2)CC1	ZINC000819109456	GE	On-Demand	Anodyne	AKR1C3	46	34
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(OC(F)F)c1	ZINC000819109458	DG	On-Demand	Anodyne	KCNQ2	54	40
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(OC(F)F)c1	ZINC000819109459	DG	On-Demand	Anodyne	KCNQ2	54	40
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(OC(F)F)c1	ZINC000819109460	DG	On-Demand	Anodyne	KCNQ2	54	40
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(OC(F)F)c1	ZINC000819109461	DG	On-Demand	Anodyne	KCNQ2	54	40
O=C(CC1CC1)NNC(=O)CN1CCN(Cc2ccccc2)CC1	ZINC000819109466	EC	On-Demand	Reactive	CHRM2	18	43
O=C(CC1CC1)NNC(=O)CN1CCN(Cc2ccccc2)CC1	ZINC000819109466	EC	On-Demand	Reactive	DRD2	35	47
O=C(CC1CC1)NNC(=O)CN1CCN(Cc2ccccc2)CC1	ZINC000819109466	EC	On-Demand	Reactive	DRD4	89	46
O=C(CC1CC1)NNC(=O)CN1CCN(Cc2ccccc2)CC1	ZINC000819109466	EC	On-Demand	Reactive	ACHE	57	49
O=C(CC1CC1)NNC(=O)CN1CCN(Cc2ccccc2)CC1	ZINC000819109466	EC	On-Demand	Reactive	DRD3	22	46
O=C(CC1CC1)NNC(=O)CN1CCN(Cc2ccccc2)CC1	ZINC000819109466	EC	On-Demand	Reactive	SLC6A3	16	42
O=C(CC1CC1)NNC(=O)CN1CCN(Cc2ccccc2)CC1	ZINC000819109466	EC	On-Demand	Reactive	CHRM3	19	40
O=C(CC1CC1)NNC(=O)CN1CCN(Cc2ccccc2)CC1	ZINC000819109466	EC	On-Demand	Reactive	GRIN2B	50	42
O=C(CC1CC1)NNC(=O)CN1CCN(Cc2ccccc2)CC1	ZINC000819109466	EC	On-Demand	Reactive	LTA4H	26	45
O=C(CC1CC1)NNC(=O)CN1CCN(Cc2ccccc2)CC1	ZINC000819109466	EC	On-Demand	Reactive	SIGMAR1	87	54
O=C(CC1CC1)NNC(=O)CN1CCN(Cc2ccccc2)CC1	ZINC000819109466	EC	On-Demand	Reactive	BCHE	18	40
O=C(CC1CC1)NNC(=O)CN1CCN(Cc2ccccc2)CC1	ZINC000819109466	EC	On-Demand	Reactive	CCR3	25	40
O=C(CC1CC1)NNC(=O)CN1CCN(Cc2ccccc2)CC1	ZINC000819109466	EC	On-Demand	Reactive	FAAH	17	41
O=C(CC1CC1)NNC(=O)CN1CCN(Cc2ccccc2)CC1	ZINC000819109466	EC	On-Demand	Reactive	MCHR1	20	40
O=C(CC1CC1)NNC(=O)CN1CCN(Cc2ccccc2)CC1	ZINC000819109466	EC	On-Demand	Reactive	NPFFR1	41	37
CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)NNC(=O)CC2CC2)c1	ZINC000819109472	FF	On-Demand	Reactive	IMDH_CRYPV	45	43
O=C(CC1CC1)NNC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1	ZINC000819109474	HG	On-Demand	Reactive	PRKCQ	24	44
O=C(CCN1c2ccccc2Sc2ccccc21)NNC(=O)CC1CC1	ZINC000819109478	FH	On-Demand	Reactive	BCHE	17	43
O=C(CC1CC1)NNC(=O)c1ccccc1OCc1cscn1	ZINC000819109491	EE	On-Demand	Reactive	HCN1	47	32
O=C(CC1CC1)NNC(=O)c1ccccc1OCc1cscn1	ZINC000819109491	EE	On-Demand	Reactive	HCN4	40	32
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccco2)c1	ZINC000819109505	EE	On-Demand	Reactive	KISS1R	44	35
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccco2)c1	ZINC000819109505	EE	On-Demand	Reactive	KCNK3	90	56
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccco2)c1	ZINC000819109505	EE	On-Demand	Reactive	KCNK9	41	36
O=C(CCOc1cccc(F)c1)NNC(=O)CC1CC1	ZINC000819109511	CD	On-Demand	Reactive	CHRNA10	29	42
O=C(CC1CC1)NNC(=O)c1cc(Oc2cccc(Br)c2)ccn1	ZINC000819109516	GG	On-Demand	Reactive	RAF1	57	42
CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)NNC(=O)CC2CC2)c1	ZINC000819109528	HD	On-Demand	Reactive	SLC6A9	17	41
O=C(CC1CC1)NNC(=O)C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1	ZINC000819109531	HF	On-Demand	Reactive	MPL	29	41
O=C(CC1CC1)NNC(=O)C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1	ZINC000819109531	HF	On-Demand	Reactive	CXCR3	21	42
O=C(CC1CC1)NNC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1	ZINC000819109539	FH	On-Demand	Reactive	ALPL	44	36
O=C(CC1CC1)NNC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1	ZINC000819109539	FH	On-Demand	Reactive	DPP8	49	35
O=C(CC1CC1)NNC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1	ZINC000819109539	FH	On-Demand	Reactive	DPP9	47	35
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819109560	HG	On-Demand	Anodyne	MMP13	21	40
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819109560	HG	On-Demand	Anodyne	MMP2	29	40
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819109560	HG	On-Demand	Anodyne	MMP14	18	40
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819109560	HG	On-Demand	Anodyne	EPHX2	33	55
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819109560	HG	On-Demand	Anodyne	SFRP1	56	42
Cc1cc(F)ccc1[C@@H](O)CNC1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C	ZINC000819109562	GH	On-Demand	Anodyne	GPR119	21	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109566	FC	On-Demand	Reactive	FKBP1A	30	55
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109566	FC	On-Demand	Reactive	MMP13	47	45
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109566	FC	On-Demand	Reactive	ADAM17	38	43
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109566	FC	On-Demand	Reactive	ITGA4	37	51
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109566	FC	On-Demand	Reactive	PREP	45	36
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109566	FC	On-Demand	Reactive	CAPNS1	25	51
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109566	FC	On-Demand	Reactive	MMP2	23	44
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109566	FC	On-Demand	Reactive	MMP3	54	45
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109566	FC	On-Demand	Reactive	MMP8	33	46
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109566	FC	On-Demand	Reactive	CAPN1	22	58
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109566	FC	On-Demand	Reactive	MMP9	30	44
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109566	FC	On-Demand	Reactive	MMP12	15	46
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109566	FC	On-Demand	Reactive	MMP7	55	45
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109566	FC	On-Demand	Reactive	MMP1	54	48
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109566	FC	On-Demand	Reactive	SFRP1	90	36
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109566	FC	On-Demand	Reactive	WNT3	75	34
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109567	FC	On-Demand	Reactive	FKBP1A	30	55
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109567	FC	On-Demand	Reactive	MMP13	47	45
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109567	FC	On-Demand	Reactive	ADAM17	38	43
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109567	FC	On-Demand	Reactive	ITGA4	37	51
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109567	FC	On-Demand	Reactive	PREP	45	36
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109567	FC	On-Demand	Reactive	CAPNS1	25	51
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109567	FC	On-Demand	Reactive	MMP2	23	44
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109567	FC	On-Demand	Reactive	MMP3	54	45
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109567	FC	On-Demand	Reactive	MMP8	33	46
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109567	FC	On-Demand	Reactive	CAPN1	22	58
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109567	FC	On-Demand	Reactive	MMP9	30	44
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109567	FC	On-Demand	Reactive	MMP12	15	46
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109567	FC	On-Demand	Reactive	MMP7	55	45
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109567	FC	On-Demand	Reactive	MMP1	54	48
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109567	FC	On-Demand	Reactive	SFRP1	90	36
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819109567	FC	On-Demand	Reactive	WNT3	75	34
O=C(CNC(=O)c1ccccn1)NNC(=O)CC1CC1	ZINC000819109568	CB	On-Demand	Reactive	GRM4	55	38
CON(C)C(=O)CCNC[C@@H](C)Oc1cccc(C)c1	ZINC000819109572	CD	On-Demand	Anodyne	MTNR1A	16	44
CON(C)C(=O)CCNC[C@@H](C)Oc1cccc(C)c1	ZINC000819109572	CD	On-Demand	Anodyne	MTNR1B	18	44
CON(C)C(=O)CCNC[C@H](C)Oc1cccc(C)c1	ZINC000819109573	CD	On-Demand	Anodyne	MTNR1A	16	44
CON(C)C(=O)CCNC[C@H](C)Oc1cccc(C)c1	ZINC000819109573	CD	On-Demand	Anodyne	MTNR1B	18	44
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819109586	HG	On-Demand	Anodyne	CACNA1B	63	43
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819109586	HG	On-Demand	Anodyne	PKM	23	49
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819109586	HG	On-Demand	Anodyne	AKR1C3	63	39
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819109586	HG	On-Demand	Anodyne	SFRP1	92	44
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819109586	HG	On-Demand	Anodyne	WNT3	45	31
N#Cc1cc(F)ccc1S(=O)(=O)N1CCC(n2cccc2C(=O)O)CC1	ZINC000819109595	GE	On-Demand	Mild	TRPV4	43	37
COC(=O)C1(NC(=O)c2cc(C)n(Cc3ccccc3)c2C)CCCCC1	ZINC000819109619	FH	On-Demand	Anodyne	TACR2	40	32
COC(=O)C1(NC(=O)c2cc(C)n(Cc3ccccc3)c2C)CCCCC1	ZINC000819109619	FH	On-Demand	Anodyne	PLA2G2A	60	37
COC(=O)C1(NC(=O)c2cc(C)n(Cc3ccccc3)c2C)CCCCC1	ZINC000819109619	FH	On-Demand	Anodyne	SLC12A5	64	36
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NCCC(=O)Nc1cccc(F)c1)C2	ZINC000819109620	GH	On-Demand	Anodyne	GPR119	21	40
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000819109628	GG	On-Demand	Anodyne	TRY2_BOVIN	46	38
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000819109628	GG	On-Demand	Anodyne	PKM	29	48
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000819109628	GG	On-Demand	Anodyne	AKR1C3	49	55
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc3c(c2)CCO3)CC1	ZINC000819109629	GE	On-Demand	Anodyne	PKM	40	45
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc3c(c2)CCO3)CC1	ZINC000819109629	GE	On-Demand	Anodyne	AKR1C3	52	33
O=C(O)c1cccn1C1CCN(S(=O)(=O)Cc2ccccc2Cl)CC1	ZINC000819109630	GG	On-Demand	Anodyne	PTPN2	39	41
O=C(O)c1cccn1C1CCN(S(=O)(=O)Cc2ccccc2Cl)CC1	ZINC000819109630	GG	On-Demand	Anodyne	PTPN1	30	41
O=C(/C=C/[C@@H]1CCCO1)NCc1cnn(Cc2ccccc2)c1	ZINC000819109640	DE	On-Demand	Anodyne	PANC	48	38
O=C(/C=C\[C@@H]1CCCO1)NCc1cnn(Cc2ccccc2)c1	ZINC000819109642	DE	On-Demand	Anodyne	PANC	48	38
O=C(/C=C/[C@H]1CCCO1)NCc1cnn(Cc2ccccc2)c1	ZINC000819109643	DE	On-Demand	Anodyne	PANC	48	38
O=C(/C=C\[C@H]1CCCO1)NCc1cnn(Cc2ccccc2)c1	ZINC000819109645	DE	On-Demand	Anodyne	PANC	48	38
Nc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109653	ED	On-Demand	Anodyne	TGM2	61	37
Nc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109653	ED	On-Demand	Anodyne	F13A1	54	37
CN(C(=O)N1CCC(n2cccc2C(=O)O)CC1)C1CCCCC1	ZINC000819109661	EG	On-Demand	Anodyne	L3MBTL3	46	37
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(C3CC3)cc2)CC1	ZINC000819109688	FG	On-Demand	Anodyne	TGM2	42	36
CN(C)c1ccc(N2CCC(NC[C@H](O)Cc3cccc(Cl)c3)CC2)cc1	ZINC000819109694	GH	On-Demand	Anodyne	ADRB3	28	46
CN(C)c1ccc(N2CCC(NC[C@@H](O)Cc3cccc(Cl)c3)CC2)cc1	ZINC000819109696	GH	On-Demand	Anodyne	ADRB3	28	46
Cc1ccc2cccnc2c1S(=O)(=O)N1CCC(n2cccc2C(=O)O)CC1	ZINC000819109697	GG	On-Demand	Anodyne	C0L093_TOBAC	49	32
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000819109710	HF	On-Demand	Bother	EPHX2	15	44
O=C1OCc2ccc(S(=O)(=O)N3CCC(n4cccc4C(=O)O)CC3)cc21	ZINC000819109712	GD	On-Demand	Anodyne	AKR1C3	42	33
CN(C)c1ccc(N2CCC(NC[C@@H](O)CC(F)(F)F)CC2)cc1	ZINC000819109713	EF	On-Demand	Anodyne	ADRB3	20	41
CN(C)c1ccc(N2CCC(NC[C@H](O)CC(F)(F)F)CC2)cc1	ZINC000819109714	EF	On-Demand	Anodyne	ADRB3	20	41
CN(C)c1ccc(N2CCC(NC[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)cc1	ZINC000819109716	GF	On-Demand	Bother	ADRB3	26	47
CN(C)c1ccc(N2CCC(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)cc1	ZINC000819109717	GF	On-Demand	Bother	ADRB3	26	47
CN(C)c1ccc(N2CCC(NC[C@H](O)COC3CCOCC3)CC2)cc1	ZINC000819109724	GD	On-Demand	Anodyne	ADRB3	25	40
CN(C)c1ccc(N2CCC(NC[C@@H](O)COC3CCOCC3)CC2)cc1	ZINC000819109726	GD	On-Demand	Anodyne	ADRB3	25	40
Cc1cc2c(cc1S(=O)(=O)N1CCC(n3cccc3C(=O)O)CC1)OCO2	ZINC000819109727	GE	On-Demand	Anodyne	EPHX2	23	47
Cc1cnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)s1	ZINC000819109728	GG	On-Demand	Anodyne	CTSD	76	42
Cc1cnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)s1	ZINC000819109728	GG	On-Demand	Anodyne	PGC	59	37
Cc1cnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)s1	ZINC000819109728	GG	On-Demand	Anodyne	PAPA1_CARPA	31	42
Cc1cnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)s1	ZINC000819109728	GG	On-Demand	Anodyne	BACE2	48	40
Cc1cnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)s1	ZINC000819109728	GG	On-Demand	Anodyne	REN	81	45
Cc1cnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)s1	ZINC000819109728	GG	On-Demand	Anodyne	REN1	23	43
Cc1cnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)s1	ZINC000819109728	GG	On-Demand	Anodyne	BACE1	81	43
Cc1cnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)s1	ZINC000819109728	GG	On-Demand	Anodyne	FPR1	49	40
Cc1cnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)s1	ZINC000819109728	GG	On-Demand	Anodyne	CYP3A4	41	35
Cc1cnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)s1	ZINC000819109728	GG	On-Demand	Anodyne	PLM2_PLAFA	48	32
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc(C(F)F)cc2)CC1	ZINC000819109729	GG	On-Demand	Anodyne	TGM2	44	35
CSc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109740	GF	On-Demand	Anodyne	TGM2	44	34
CSc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109740	GF	On-Demand	Anodyne	F13A1	41	32
N#Cc1cc(Cl)ccc1S(=O)(=O)N1CCC(n2cccc2C(=O)O)CC1	ZINC000819109744	GF	On-Demand	Mild	TRPV4	52	44
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1	ZINC000819109750	HE	On-Demand	Anodyne	PKM	50	54
COC(=O)c1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)o1	ZINC000819109755	GD	On-Demand	Anodyne	LPL	44	34
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)[C@@H]2CCCO2)c1	ZINC000819109766	ED	On-Demand	Reactive	KCNK3	56	40
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)[C@H]2CCCO2)c1	ZINC000819109767	ED	On-Demand	Reactive	KCNK3	56	40
O=C(CC1CC1)NNC(=O)c1sccc1NC(=O)Cc1ccc(Br)cc1	ZINC000819109768	IG	On-Demand	Reactive	FAS	34	42
O=C(CCCOc1ccc2c(c1)CCCC2)NNC(=O)CC1CC1	ZINC000819109774	EF	On-Demand	Reactive	PPARG	32	45
O=C(CCCOc1ccc2c(c1)CCCC2)NNC(=O)CC1CC1	ZINC000819109774	EF	On-Demand	Reactive	PPARA	22	46
O=C(CCCOc1ccc2c(c1)CCCC2)NNC(=O)CC1CC1	ZINC000819109774	EF	On-Demand	Reactive	HRH3	15	43
O=C(CCCOc1ccc2c(c1)CCCC2)NNC(=O)CC1CC1	ZINC000819109774	EF	On-Demand	Reactive	PPARD	48	39
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccc(Cl)cc1Cl	ZINC000819109776	HI	On-Demand	Reactive	CPT1A	70	36
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccc(Cl)cc1Cl	ZINC000819109776	HI	On-Demand	Reactive	CPT2	40	32
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccc(Cl)cc1Cl	ZINC000819109776	HI	On-Demand	Reactive	CPT1B	67	33
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccc(Cl)cc1Cl	ZINC000819109776	HI	On-Demand	Reactive	PTGDR	27	42
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccc(Cl)cc1Cl	ZINC000819109776	HI	On-Demand	Reactive	PTGDR2	17	42
O=C(CC1CC1)NNC(=O)c1sccc1S(=O)(=O)N1CCc2ccccc2C1	ZINC000819109778	HE	On-Demand	Reactive	AKR1C3	53	42
Nc1ncnc2c1ncn2CC(=O)NNC(=O)CC1CC1	ZINC000819109789	CB	On-Demand	Reactive	AHCY	93	47
Nc1ncnc2c1ncn2CC(=O)NNC(=O)CC1CC1	ZINC000819109789	CB	On-Demand	Reactive	ADCY5	39	55
Nc1ncnc2c1ncn2CC(=O)NNC(=O)CC1CC1	ZINC000819109789	CB	On-Demand	Reactive	OXGR1	122	42
Nc1ncnc2c1ncn2CC(=O)NNC(=O)CC1CC1	ZINC000819109789	CB	On-Demand	Reactive	DOT1L	57	37
O=C(CC1CC1)NNC(=O)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000819109809	HG	On-Demand	Reactive	ACACB	15	45
O=C(CC1CC1)NNC(=O)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000819109809	HG	On-Demand	Reactive	TACR3	19	45
CCCN(CC)c1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819109810	DE	On-Demand	Reactive	ESRRG	21	44
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)CC1CC1	ZINC000819109816	GD	On-Demand	Reactive	EPHX2	18	42
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)CC1CC1	ZINC000819109816	GD	On-Demand	Reactive	TGM2	75	40
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)CC1CC1	ZINC000819109816	GD	On-Demand	Reactive	F13A1	74	41
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)CC1CC1	ZINC000819109816	GD	On-Demand	Reactive	NAMPT	41	41
O=C(CC1CC1)NNC(=O)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000819109819	ED	On-Demand	Reactive	P2RX7	43	50
O=C(CC1CC1)NNC(=O)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000819109820	ED	On-Demand	Reactive	P2RX7	43	50
O=C(CC1CC1)NNC(=O)C1(c2cccc(C(F)(F)F)c2)CCCCC1	ZINC000819109834	FH	On-Demand	Reactive	CCR2	57	36
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)CC1CC1	ZINC000819109847	FC	On-Demand	Reactive	TBXA2R	43	35
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)CC1CC1	ZINC000819109847	FC	On-Demand	Reactive	LEF	30	41
CC(C)(C)C(=O)Nc1ccc(F)c(C(=O)NNC(=O)CC2CC2)c1	ZINC000819109867	EE	On-Demand	Reactive	NPY2R	26	42
O=C(CC1CC1)NNC(=O)[C@H]1CC(c2ccc(Cl)cc2Cl)=NO1	ZINC000819109868	FE	On-Demand	Reactive	ALPL	41	33
O=C(CC1CC1)NNC(=O)[C@@H]1CC(c2ccc(Cl)cc2Cl)=NO1	ZINC000819109869	FE	On-Demand	Reactive	ALPL	41	33
O=C(CC1CC1)NNC(=O)c1c[nH]c(C(=O)N2CCCC2)c1	ZINC000819109870	DC	On-Demand	Reactive	L3MBTL3	71	34
O=C(CC1CC1)NNC(=O)C1(Cc2ccc(Cl)cc2)CC1	ZINC000819109876	DF	On-Demand	Reactive	PA	27	40
O=C(CC1CC1)NNC(=O)Cn1c(Cc2ccccc2)nc2ccccc21	ZINC000819109878	FF	On-Demand	Reactive	MAOA	17	48
O=C(CC1CC1)NNC(=O)Cn1c(Cc2ccccc2)nc2ccccc21	ZINC000819109878	FF	On-Demand	Reactive	PDE6D	52	34
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1	ZINC000819109880	HD	On-Demand	Reactive	EPHX2	42	51
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1	ZINC000819109880	HD	On-Demand	Reactive	ADAMTS4	49	32
COC(=O)N[C@H](CC(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819109909	CC	On-Demand	Reactive	CTSK	24	42
COC(=O)N[C@H](CC(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819109909	CC	On-Demand	Reactive	CAPNS1	54	34
COC(=O)N[C@H](CC(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819109909	CC	On-Demand	Reactive	CAPN1	78	52
COC(=O)N[C@H](CC(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819109909	CC	On-Demand	Reactive	CAPN2	89	37
COC(=O)N[C@H](CC(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819109909	CC	On-Demand	Reactive	FPR1	40	37
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819109910	IG	On-Demand	Reactive	CACNA1B	47	33
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819109910	IG	On-Demand	Reactive	CCR2	81	46
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819109910	IG	On-Demand	Reactive	SFRP1	42	36
O=C(CCCNC(=O)NC1CCCCC1)NNC(=O)CC1CC1	ZINC000819109915	DD	On-Demand	Reactive	EPHX2	20	58
O=C(CC1CC1)NNC(=O)c1ccc(OCC2CC2)cc1	ZINC000819109936	CE	On-Demand	Reactive	GRIN2B	17	55
O=C(CC1CC1)NNC(=O)c1ccc(Oc2ccc(F)cc2)cc1	ZINC000819109948	EG	On-Demand	Reactive	SSTR3	15	40
O=C(CC1CC1)NNC(=O)c1ccc(Oc2ccc(F)cc2)cc1	ZINC000819109948	EG	On-Demand	Reactive	PLAU	30	41
O=C(CC1CC1)NNC(=O)c1ccc(Oc2ccc(F)cc2)cc1	ZINC000819109948	EG	On-Demand	Reactive	ST14	27	41
C[C@H]1CCC[C@H](C)N1C(=O)N1CCC(n2cccc2C(=O)O)CC1	ZINC000819109956	EG	On-Demand	Anodyne	L3MBTL3	52	34
CCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109960	GF	On-Demand	Anodyne	CHRM2	18	42
CCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109960	GF	On-Demand	Anodyne	MMP13	68	49
CCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109960	GF	On-Demand	Anodyne	ADAM17	65	43
CCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109960	GF	On-Demand	Anodyne	MMP2	26	40
CCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109960	GF	On-Demand	Anodyne	MMP3	50	40
CCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109960	GF	On-Demand	Anodyne	MMP8	18	40
CCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109960	GF	On-Demand	Anodyne	MMP9	28	40
CCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109960	GF	On-Demand	Anodyne	TGM2	52	36
CCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109960	GF	On-Demand	Anodyne	MMP7	50	40
CCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109960	GF	On-Demand	Anodyne	MMP1	57	40
CCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819109960	GF	On-Demand	Anodyne	F13A1	46	35
O=C(O)c1cccn1C1CCN(S(=O)(=O)Cc2ccccc2[N+](=O)[O-])CC1	ZINC000819109961	GE	On-Demand	Bother	COLA	101	37
COc1ccc(C)cc1S(=O)(=O)N1CCC(n2cccc2C(=O)O)CC1	ZINC000819109982	GF	On-Demand	Anodyne	CPT1A	31	41
COc1ccc(C)cc1S(=O)(=O)N1CCC(n2cccc2C(=O)O)CC1	ZINC000819109982	GF	On-Demand	Anodyne	EPHX2	24	43
COc1cccc(CS(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c1	ZINC000819109983	GE	On-Demand	Anodyne	DRD4	40	30
COc1cccc(CS(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c1	ZINC000819109983	GE	On-Demand	Anodyne	PTPN2	43	35
Cc1c(F)cccc1S(=O)(=O)N1CCC(n2cccc2C(=O)O)CC1	ZINC000819110003	FF	On-Demand	Anodyne	EPHX2	19	41
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819110004	GE	On-Demand	Bother	AKR1C3	60	46
CNC(=O)c1cc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cn1C	ZINC000819110013	GC	On-Demand	Anodyne	AKR1C3	44	38
N#Cc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c(Cl)c1	ZINC000819110014	GF	On-Demand	Mild	TRPV4	43	42
CCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c(C)c1	ZINC000819110029	GF	On-Demand	Anodyne	EPHX2	27	45
O=C(O)c1cccn1C1CCN(S(=O)(=O)N2CCc3ccccc3C2)CC1	ZINC000819110033	GE	On-Demand	Anodyne	AKR1C3	61	44
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2c(F)cccc2[N+](=O)[O-])CC1	ZINC000819110045	GE	On-Demand	Bother	PKM	20	43
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000819110046	GE	On-Demand	Bother	EPHX2	15	43
COCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110047	HE	On-Demand	Anodyne	CHRM2	20	43
COCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110047	HE	On-Demand	Anodyne	MMP13	75	42
COCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110047	HE	On-Demand	Anodyne	ADAM17	56	42
COCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110047	HE	On-Demand	Anodyne	MMP2	33	42
COCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110047	HE	On-Demand	Anodyne	MMP3	57	42
COCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110047	HE	On-Demand	Anodyne	MMP8	23	41
COCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110047	HE	On-Demand	Anodyne	MMP9	36	41
COCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110047	HE	On-Demand	Anodyne	TGM2	49	37
COCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110047	HE	On-Demand	Anodyne	MMP7	54	41
COCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110047	HE	On-Demand	Anodyne	MMP1	62	41
COCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110047	HE	On-Demand	Anodyne	F13A1	40	33
CC(C)c1cccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c1	ZINC000819110048	GG	On-Demand	Anodyne	AKR1C3	54	37
COC(=O)c1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110053	GD	On-Demand	Anodyne	CHRM2	15	45
COC(=O)c1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110053	GD	On-Demand	Anodyne	MMP13	25	41
COC(=O)c1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110053	GD	On-Demand	Anodyne	MMP3	28	41
COC(=O)c1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110053	GD	On-Demand	Anodyne	MMP9	20	41
COC(=O)c1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110053	GD	On-Demand	Anodyne	EPHX2	16	43
COC(=O)c1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110053	GD	On-Demand	Anodyne	TGM2	66	39
COC(=O)c1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110053	GD	On-Demand	Anodyne	MMP7	33	41
COC(=O)c1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110053	GD	On-Demand	Anodyne	MMP1	28	41
COC(=O)c1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110053	GD	On-Demand	Anodyne	F13A1	60	35
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NC[C@H](O)c1cc(F)ccc1F)C2	ZINC000819110056	GH	On-Demand	Anodyne	GPR119	23	44
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NC[C@@H](O)c1cc(F)ccc1F)C2	ZINC000819110057	GH	On-Demand	Anodyne	GPR119	23	44
O=C(CC1CC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCc3ccccc32)c1	ZINC000819110061	HE	On-Demand	Reactive	CPT1A	20	51
O=C(CC1CC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCc3ccccc32)c1	ZINC000819110061	HE	On-Demand	Reactive	AKR1C3	62	42
O=C(CC1CC1)NNC(=O)CN(Cc1cccnc1)c1ccccc1	ZINC000819110071	EE	On-Demand	Reactive	NAMPT	43	44
O=C(CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1)NNC(=O)CC1CC1	ZINC000819110084	IG	On-Demand	Reactive	HCRTR2	17	59
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1	ZINC000819110092	HG	On-Demand	Reactive	PRNP	40	35
O=C(CC1CC1)NNC(=O)c1ccccc1Cn1cncn1	ZINC000819110098	CC	On-Demand	Reactive	HIS3	53	38
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000819110120	GE	On-Demand	Reactive	LIMK2	28	46
O=C(CC1CC1)NNC(=O)c1cc(Cc2ccccc2)[nH]n1	ZINC000819110128	CD	On-Demand	Reactive	VCP	52	33
O=C(CC1CC1)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)c(F)c1	ZINC000819110130	HE	On-Demand	Reactive	PRTN3	52	38
O=C(CC1CC1)NNC(=O)c1ccc(OCc2ccncc2)cc1	ZINC000819110137	EE	On-Demand	Reactive	ADAM17	21	47
O=C(CC1CC1)NNC(=O)c1ccc(OCc2ccncc2)cc1	ZINC000819110137	EE	On-Demand	Reactive	SLC6A5	38	45
O=C(CC1CC1)NNC(=O)C1(c2cccc(C(F)(F)F)c2)CCCC1	ZINC000819110148	FG	On-Demand	Reactive	CCR2	61	37
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1	ZINC000819110155	ID	On-Demand	Reactive	EPHX2	46	47
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1	ZINC000819110155	ID	On-Demand	Reactive	SFRP1	40	38
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(F)cc1	ZINC000819110161	DF	On-Demand	Bother	ADRB2	35	43
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(F)cc1	ZINC000819110161	DF	On-Demand	Bother	ADRB3	53	39
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(F)cc1	ZINC000819110161	DF	On-Demand	Bother	COLA	107	43
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(F)cc1	ZINC000819110162	DF	On-Demand	Bother	ADRB2	35	43
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(F)cc1	ZINC000819110162	DF	On-Demand	Bother	ADRB3	53	39
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(F)cc1	ZINC000819110162	DF	On-Demand	Bother	COLA	107	43
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCc1ccccc1[N+](=O)[O-]	ZINC000819110167	FE	On-Demand	Bother	COLA	115	43
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCc1ccccc1[N+](=O)[O-]	ZINC000819110168	FE	On-Demand	Bother	COLA	115	43
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819110170	FH	On-Demand	Anodyne	ADRB1	24	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819110170	FH	On-Demand	Anodyne	ADRB3	35	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819110170	FH	On-Demand	Anodyne	PAPA1_CARPA	31	45
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819110171	FH	On-Demand	Anodyne	ADRB1	24	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819110171	FH	On-Demand	Anodyne	ADRB3	35	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819110171	FH	On-Demand	Anodyne	PAPA1_CARPA	31	45
C[C@@H](CNC[C@@H](O)c1ccc(F)c(F)c1)Oc1cccc(F)c1	ZINC000819110177	EG	On-Demand	Anodyne	ADRB1	24	41
C[C@@H](CNC[C@@H](O)c1ccc(F)c(F)c1)Oc1cccc(F)c1	ZINC000819110177	EG	On-Demand	Anodyne	ADRB3	34	41
C[C@H](CNC[C@H](O)c1ccc(F)c(F)c1)Oc1cccc(F)c1	ZINC000819110178	EG	On-Demand	Anodyne	ADRB1	24	41
C[C@H](CNC[C@H](O)c1ccc(F)c(F)c1)Oc1cccc(F)c1	ZINC000819110178	EG	On-Demand	Anodyne	ADRB3	34	41
C[C@@H](CNC[C@H](O)c1ccc(F)c(F)c1)Oc1cccc(F)c1	ZINC000819110179	EG	On-Demand	Anodyne	ADRB1	24	41
C[C@@H](CNC[C@H](O)c1ccc(F)c(F)c1)Oc1cccc(F)c1	ZINC000819110179	EG	On-Demand	Anodyne	ADRB3	34	41
C[C@H](CNC[C@@H](O)c1ccc(F)c(F)c1)Oc1cccc(F)c1	ZINC000819110180	EG	On-Demand	Anodyne	ADRB1	24	41
C[C@H](CNC[C@@H](O)c1ccc(F)c(F)c1)Oc1cccc(F)c1	ZINC000819110180	EG	On-Demand	Anodyne	ADRB3	34	41
CCOc1ccccc1C(=O)NNC(=O)CC1CC1	ZINC000819110198	CD	On-Demand	Reactive	KCNA3	39	44
CCOc1ccccc1C(=O)NNC(=O)CC1CC1	ZINC000819110198	CD	On-Demand	Reactive	HCN1	92	46
CCOc1ccccc1C(=O)NNC(=O)CC1CC1	ZINC000819110198	CD	On-Demand	Reactive	HCN4	68	46
CCOc1ccccc1C(=O)NNC(=O)CC1CC1	ZINC000819110198	CD	On-Demand	Reactive	KCNK3	48	47
CCOc1ccccc1C(=O)NNC(=O)CC1CC1	ZINC000819110198	CD	On-Demand	Reactive	KCNK9	41	47
O=C(CC1CC1)NNC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1	ZINC000819110210	FD	On-Demand	Reactive	GRIN2B	27	45
O=C(CC1CC1)NNC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1	ZINC000819110210	FD	On-Demand	Reactive	PREP	24	40
O=C(CC1CC1)NNC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1	ZINC000819110210	FD	On-Demand	Reactive	TGM2	27	40
O=C(CC1CC1)NNC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1	ZINC000819110210	FD	On-Demand	Reactive	F13A1	33	40
O=C(CC1CC1)NNC(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1	ZINC000819110210	FD	On-Demand	Reactive	SLC12A5	68	37
O=C(CC1CC1)NNC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1	ZINC000819110212	FD	On-Demand	Reactive	GRIN2B	27	45
O=C(CC1CC1)NNC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1	ZINC000819110212	FD	On-Demand	Reactive	PREP	24	40
O=C(CC1CC1)NNC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1	ZINC000819110212	FD	On-Demand	Reactive	TGM2	27	40
O=C(CC1CC1)NNC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1	ZINC000819110212	FD	On-Demand	Reactive	F13A1	33	40
O=C(CC1CC1)NNC(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1	ZINC000819110212	FD	On-Demand	Reactive	SLC12A5	68	37
O=C(CSc1nccn1-c1ccc(C(F)(F)F)cc1)NNC(=O)CC1CC1	ZINC000819110228	GF	On-Demand	Reactive	MCHR1	15	41
O=C(CC1CC1)NNC(=O)C1CCN(C(=O)c2ccc(Cl)s2)CC1	ZINC000819110240	FE	On-Demand	Reactive	L3MBTL3	17	43
O=C(CC1CC1)NNC(=O)c1ccc(C2CCC2)cc1	ZINC000819110243	CF	On-Demand	Reactive	CCR1	15	41
O=C(CC1CC1)NNC(=O)c1ccc(C2CCC2)cc1	ZINC000819110243	CF	On-Demand	Reactive	DGAT1	40	47
O=C(CC1CC1)NNC(=O)c1cc(-c2ccco2)n(-c2ccc(Cl)cc2)n1	ZINC000819110245	GG	On-Demand	Reactive	RPA1	70	39
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1	ZINC000819110253	HD	On-Demand	Reactive	EPHX2	42	45
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1	ZINC000819110253	HD	On-Demand	Reactive	TGM2	45	34
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1	ZINC000819110253	HD	On-Demand	Reactive	F13A1	47	34
Cc1ccccc1[C@@H](O)CNC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819110271	FH	On-Demand	Anodyne	PAPA1_CARPA	36	42
Cc1ccccc1[C@@H](O)CNC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819110271	FH	On-Demand	Anodyne	SOAT1	24	63
Cc1ccccc1[C@@H](O)CNC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819110271	FH	On-Demand	Anodyne	FPR1	45	39
Cc1ccccc1[C@@H](O)CNC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819110271	FH	On-Demand	Anodyne	CTSA	48	32
Cc1ccccc1[C@@H](O)CNC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819110275	FH	On-Demand	Anodyne	PAPA1_CARPA	36	42
Cc1ccccc1[C@@H](O)CNC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819110275	FH	On-Demand	Anodyne	SOAT1	24	63
Cc1ccccc1[C@@H](O)CNC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819110275	FH	On-Demand	Anodyne	FPR1	45	39
Cc1ccccc1[C@@H](O)CNC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819110275	FH	On-Demand	Anodyne	CTSA	48	32
O=C(CCCOc1cccnc1)NNC(=O)CC1CC1	ZINC000819110279	CD	On-Demand	Reactive	CHRNA7	20	40
CCCCCCCC(=O)NNC(=O)CC1CC1	ZINC000819110281	BE	On-Demand	Reactive	LUXR	35	44
CCCCCCCC(=O)NNC(=O)CC1CC1	ZINC000819110281	BE	On-Demand	Reactive	TRAR	15	44
CCCCCCCC(=O)NNC(=O)CC1CC1	ZINC000819110281	BE	On-Demand	Reactive	LASR	65	44
CCCCCCCC(=O)NNC(=O)CC1CC1	ZINC000819110281	BE	On-Demand	Reactive	NOD1	49	38
CCCCCCCC(=O)NNC(=O)CC1CC1	ZINC000819110281	BE	On-Demand	Reactive	CQSS	59	36
CCS(=O)(=O)NC1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819110288	DD	On-Demand	Anodyne	SFRP1	45	32
CCS(=O)(=O)NC1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819110288	DD	On-Demand	Anodyne	WNT3	51	32
O=C(CC1CC1)NNC(=O)c1cccnc1Nc1cccc(C(F)(F)F)c1	ZINC000819110290	GG	On-Demand	Reactive	KDR	17	43
O=C(CC1CC1)NNC(=O)c1cccnc1Nc1cccc(C(F)(F)F)c1	ZINC000819110290	GG	On-Demand	Reactive	CCR2	49	37
O=C(CC1CC1)NNC(=O)c1cccnc1Nc1cccc(C(F)(F)F)c1	ZINC000819110290	GG	On-Demand	Reactive	LYN	19	40
O=C(CC1CC1)NNC(=O)c1cccnc1Nc1cccc(C(F)(F)F)c1	ZINC000819110290	GG	On-Demand	Reactive	TEK	25	40
O=C(CC1CC1)NNC(=O)c1cccnc1Nc1cccc(C(F)(F)F)c1	ZINC000819110290	GG	On-Demand	Reactive	BTK	23	43
O=C(CC1CC1)NNC(=O)c1cccnc1Nc1cccc(C(F)(F)F)c1	ZINC000819110290	GG	On-Demand	Reactive	BRAF	17	40
O=C(CC1CC1)NNC(=O)c1ccc(-c2ccccc2)nc1O	ZINC000819110296	DE	On-Demand	Reactive	VCP	55	39
C[C@@H](CNC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1)S(C)(=O)=O	ZINC000819110300	FE	On-Demand	Anodyne	PAPA1_CARPA	35	41
C[C@@H](CNC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1)S(C)(=O)=O	ZINC000819110300	FE	On-Demand	Anodyne	CTSK	19	51
C[C@@H](CNC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1)S(C)(=O)=O	ZINC000819110300	FE	On-Demand	Anodyne	SOAT1	17	56
C[C@@H](CNC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1)S(C)(=O)=O	ZINC000819110300	FE	On-Demand	Anodyne	FPR1	48	38
C[C@H](CNC[C@H](NC(=O)OC(C)(C)C)c1ccccc1)S(C)(=O)=O	ZINC000819110301	FE	On-Demand	Anodyne	PAPA1_CARPA	35	41
C[C@H](CNC[C@H](NC(=O)OC(C)(C)C)c1ccccc1)S(C)(=O)=O	ZINC000819110301	FE	On-Demand	Anodyne	CTSK	19	51
C[C@H](CNC[C@H](NC(=O)OC(C)(C)C)c1ccccc1)S(C)(=O)=O	ZINC000819110301	FE	On-Demand	Anodyne	SOAT1	17	56
C[C@H](CNC[C@H](NC(=O)OC(C)(C)C)c1ccccc1)S(C)(=O)=O	ZINC000819110301	FE	On-Demand	Anodyne	FPR1	48	38
C[C@H](CNC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1)S(C)(=O)=O	ZINC000819110302	FE	On-Demand	Anodyne	PAPA1_CARPA	35	41
C[C@H](CNC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1)S(C)(=O)=O	ZINC000819110302	FE	On-Demand	Anodyne	CTSK	19	51
C[C@H](CNC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1)S(C)(=O)=O	ZINC000819110302	FE	On-Demand	Anodyne	SOAT1	17	56
C[C@H](CNC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1)S(C)(=O)=O	ZINC000819110302	FE	On-Demand	Anodyne	FPR1	48	38
C[C@@H](CNC[C@H](NC(=O)OC(C)(C)C)c1ccccc1)S(C)(=O)=O	ZINC000819110303	FE	On-Demand	Anodyne	PAPA1_CARPA	35	41
C[C@@H](CNC[C@H](NC(=O)OC(C)(C)C)c1ccccc1)S(C)(=O)=O	ZINC000819110303	FE	On-Demand	Anodyne	CTSK	19	51
C[C@@H](CNC[C@H](NC(=O)OC(C)(C)C)c1ccccc1)S(C)(=O)=O	ZINC000819110303	FE	On-Demand	Anodyne	SOAT1	17	56
C[C@@H](CNC[C@H](NC(=O)OC(C)(C)C)c1ccccc1)S(C)(=O)=O	ZINC000819110303	FE	On-Demand	Anodyne	FPR1	48	38
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)CN1CCOCC1)c1ccccc1	ZINC000819110314	GD	On-Demand	Anodyne	CASR	37	40
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)CN1CCOCC1)c1ccccc1	ZINC000819110317	GD	On-Demand	Anodyne	CASR	37	40
CC(C)(C)OC(=O)N[C@@H](CNCCC(=O)Nc1cccnc1)c1ccccc1	ZINC000819110322	GG	On-Demand	Anodyne	ADRB3	35	41
O=C(CC1CC1)NNC(=O)Cn1ccnc1	ZINC000819110325	BB	On-Demand	Reactive	TBXAS1	37	40
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1	ZINC000819110326	HH	On-Demand	Reactive	PRNP	31	42
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1	ZINC000819110326	HH	On-Demand	Reactive	CACNA1I	66	41
C[C@@]1(C(=O)NNC(=O)CC2CC2)CCN(C(=O)OCc2ccccc2)C1	ZINC000819110331	FD	On-Demand	Reactive	GRIN2B	32	45
C[C@@]1(C(=O)NNC(=O)CC2CC2)CCN(C(=O)OCc2ccccc2)C1	ZINC000819110331	FD	On-Demand	Reactive	TIMP3	47	32
C[C@@]1(C(=O)NNC(=O)CC2CC2)CCN(C(=O)OCc2ccccc2)C1	ZINC000819110331	FD	On-Demand	Reactive	PREP	25	40
C[C@@]1(C(=O)NNC(=O)CC2CC2)CCN(C(=O)OCc2ccccc2)C1	ZINC000819110331	FD	On-Demand	Reactive	TGM2	29	40
C[C@@]1(C(=O)NNC(=O)CC2CC2)CCN(C(=O)OCc2ccccc2)C1	ZINC000819110331	FD	On-Demand	Reactive	F13A1	34	40
C[C@@]1(C(=O)NNC(=O)CC2CC2)CCN(C(=O)OCc2ccccc2)C1	ZINC000819110331	FD	On-Demand	Reactive	SLC12A5	71	39
O=C(CNC(=O)c1cc(-c2ccccc2)on1)NNC(=O)CC1CC1	ZINC000819110344	ED	On-Demand	Reactive	HDAC10	19	52
O=C(CCSc1ccc(Br)cc1)NNC(=O)CC1CC1	ZINC000819110347	FF	On-Demand	Reactive	FAS	41	45
O=C(Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)NNC(=O)CC1CC1	ZINC000819110349	HE	On-Demand	Reactive	ADRB2	15	41
O=C(Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)NNC(=O)CC1CC1	ZINC000819110349	HE	On-Demand	Reactive	ADRB3	40	41
O=C(Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)NNC(=O)CC1CC1	ZINC000819110349	HE	On-Demand	Reactive	TBXA2R	19	43
O=C(Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)NNC(=O)CC1CC1	ZINC000819110349	HE	On-Demand	Reactive	HTR6	16	40
O=C(Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)NNC(=O)CC1CC1	ZINC000819110349	HE	On-Demand	Reactive	LIMK2	25	44
O=C(CC1CC1)NNC(=O)c1cc(-c2ccccc2)cc(Cl)c1O	ZINC000819110354	EG	On-Demand	Reactive	AKR1C2	75	53
O=C(CC1CC1)NNC(=O)c1cc(-c2ccccc2)cc(Cl)c1O	ZINC000819110354	EG	On-Demand	Reactive	AKR1C1	73	53
COc1cccc(/C=C(/CC(=O)NNC(=O)CC2CC2)c2nc3ccccc3s2)c1	ZINC000819110368	HI	On-Demand	Reactive	ETHR	17	41
COc1cccc(/C=C(\CC(=O)NNC(=O)CC2CC2)c2nc3ccccc3s2)c1	ZINC000819110369	HI	On-Demand	Reactive	ETHR	17	41
CS(=O)(=O)c1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110379	HD	On-Demand	Anodyne	TGM2	53	35
CS(=O)(=O)c1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110379	HD	On-Demand	Anodyne	F13A1	48	33
N#CCc1cccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c1	ZINC000819110383	FE	On-Demand	Mild	AKR1C3	51	35
C[C@@H]1CCCCN1CCCCNC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819110384	FF	On-Demand	Anodyne	HRH3	15	44
C[C@H]1CCCCN1CCCCNC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819110385	FF	On-Demand	Anodyne	HRH3	15	44
C[C@@H]1CCN(C(=O)N2CCC(n3cccc3C(=O)O)CC2)C1	ZINC000819110386	DE	On-Demand	Anodyne	L3MBTL3	41	33
C[C@H]1CCN(C(=O)N2CCC(n3cccc3C(=O)O)CC2)C1	ZINC000819110387	DE	On-Demand	Anodyne	L3MBTL3	41	33
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2cccc3ccccc23)CC1	ZINC000819110396	GG	On-Demand	Anodyne	HTR6	23	52
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2cccc3ccccc23)CC1	ZINC000819110396	GG	On-Demand	Anodyne	CCR8	40	32
Cc1cccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c1Cl	ZINC000819110397	GG	On-Demand	Anodyne	EPHX2	24	41
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc3c(c2)CCCO3)CC1	ZINC000819110401	GF	On-Demand	Anodyne	PKM	40	43
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc3c(c2)CCCO3)CC1	ZINC000819110401	GF	On-Demand	Anodyne	AKR1C3	47	34
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c(F)c1	ZINC000819110403	HE	On-Demand	Anodyne	EPHX2	26	42
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c(F)c1	ZINC000819110403	HE	On-Demand	Anodyne	F13A1	23	43
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc3c(c2)OCO3)CC1	ZINC000819110411	GD	On-Demand	Anodyne	PKM	47	51
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc3c(c2)COC3)CC1	ZINC000819110412	GE	On-Demand	Anodyne	AKR1C3	49	35
Cc1cnc2c(S(=O)(=O)N3CCC(n4cccc4C(=O)O)CC3)cccc2c1	ZINC000819110418	GG	On-Demand	Anodyne	EPHX2	18	40
CCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110456	GG	On-Demand	Anodyne	CHRM2	18	41
CCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110456	GG	On-Demand	Anodyne	MMP13	64	44
CCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110456	GG	On-Demand	Anodyne	ADAM17	55	42
CCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110456	GG	On-Demand	Anodyne	MMP2	27	44
CCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110456	GG	On-Demand	Anodyne	MMP3	46	44
CCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110456	GG	On-Demand	Anodyne	PLA2G4B	47	31
CCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110456	GG	On-Demand	Anodyne	TGM2	42	33
CCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110456	GG	On-Demand	Anodyne	MMP7	47	43
CCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110456	GG	On-Demand	Anodyne	MMP1	50	44
CCCOc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110456	GG	On-Demand	Anodyne	F13A1	40	33
Cc1ccc(C(=O)N(C)C)cc1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819110463	FF	On-Demand	Anodyne	MAPK11	20	41
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NCCC(=O)Nc1cccnc1)C2	ZINC000819110468	FF	On-Demand	Anodyne	GPR119	25	41
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NCCC(=O)Nc1cccnc1)C2	ZINC000819110468	FF	On-Demand	Anodyne	NAMPT	18	43
O=C(O)c1cccn1C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1	ZINC000819110475	FF	On-Demand	Anodyne	AKR1C3	64	38
CON(C)C(=O)CCNC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819110476	FE	On-Demand	Anodyne	CTSK	15	48
CON(C)C(=O)CCNC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819110476	FE	On-Demand	Anodyne	FPR1	42	34
CON(C)C(=O)CCNC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819110477	FE	On-Demand	Anodyne	CTSK	15	48
CON(C)C(=O)CCNC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819110477	FE	On-Demand	Anodyne	FPR1	42	34
Cc1cc(F)ccc1[C@@H](O)CNCC1(N2CCCCC2)CCN(C)CC1	ZINC000819110494	FF	On-Demand	Anodyne	HCN1	57	36
Cc1cc(F)ccc1[C@@H](O)CNCC1(N2CCCCC2)CCN(C)CC1	ZINC000819110494	FF	On-Demand	Anodyne	HCN4	47	31
CC(C)(C)OC(=O)N[C@@H](CNCCS(C)(=O)=O)c1ccccc1	ZINC000819110506	ED	On-Demand	Anodyne	PAPA1_CARPA	34	41
CC(C)(C)OC(=O)N[C@@H](CNCCS(C)(=O)=O)c1ccccc1	ZINC000819110506	ED	On-Demand	Anodyne	CTSK	16	51
CC(C)(C)OC(=O)N[C@@H](CNCCS(C)(=O)=O)c1ccccc1	ZINC000819110506	ED	On-Demand	Anodyne	TACR3	18	45
CC(C)(C)OC(=O)N[C@@H](CNCCS(C)(=O)=O)c1ccccc1	ZINC000819110506	ED	On-Demand	Anodyne	FPR1	44	36
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819110514	DG	On-Demand	Bother	ADRB2	66	39
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819110514	DG	On-Demand	Bother	ADRB1	73	55
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819110514	DG	On-Demand	Bother	ADRB3	99	58
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819110514	DG	On-Demand	Bother	COLA	103	42
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819110515	DG	On-Demand	Bother	ADRB2	66	39
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819110515	DG	On-Demand	Bother	ADRB1	73	55
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819110515	DG	On-Demand	Bother	ADRB3	99	58
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819110515	DG	On-Demand	Bother	COLA	103	42
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819110535	FG	On-Demand	Bother	ADRB3	54	41
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819110535	FG	On-Demand	Bother	COLA	100	45
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819110536	FG	On-Demand	Bother	ADRB3	54	41
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819110536	FG	On-Demand	Bother	COLA	100	45
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccccc2[N+](=O)[O-])cc1	ZINC000819110537	EE	On-Demand	Bother	ADRB1	27	41
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccccc2[N+](=O)[O-])cc1	ZINC000819110537	EE	On-Demand	Bother	ADRB3	46	41
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccccc2[N+](=O)[O-])cc1	ZINC000819110537	EE	On-Demand	Bother	COLA	112	44
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccccc2[N+](=O)[O-])cc1	ZINC000819110538	EE	On-Demand	Bother	ADRB1	27	41
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccccc2[N+](=O)[O-])cc1	ZINC000819110538	EE	On-Demand	Bother	ADRB3	46	41
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccccc2[N+](=O)[O-])cc1	ZINC000819110538	EE	On-Demand	Bother	COLA	112	44
CC(=O)N1CCCc2cc(S(=O)(=O)N3CCC(n4cccc4C(=O)O)CC3)ccc21	ZINC000819110550	IF	On-Demand	Anodyne	AKR1C3	52	33
COCCc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110552	GE	On-Demand	Anodyne	TGM2	54	41
COCCc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1	ZINC000819110552	GE	On-Demand	Anodyne	F13A1	41	35
N#Cc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c(F)c1	ZINC000819110555	GE	On-Demand	Mild	TRPV4	40	39
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NCCC(=O)Nc1ccccc1F)C2	ZINC000819110562	GH	On-Demand	Anodyne	GPR119	19	44
CCOc1cccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)c1	ZINC000819110564	GF	On-Demand	Anodyne	AKR1C3	51	35
COc1ccc(OC)c([C@H](O)CNCC2(N3CCCCC3)CCN(C)CC2)c1	ZINC000819110565	GE	On-Demand	Anodyne	HCN1	62	42
COc1ccc(OC)c([C@H](O)CNCC2(N3CCCCC3)CCN(C)CC2)c1	ZINC000819110565	GE	On-Demand	Anodyne	HCN4	51	37
O=C(O)c1cccn1C1CCN(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000819110566	GE	On-Demand	Bother	MMP8	21	40
O=C(O)c1cccn1C1CCN(S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000819110566	GE	On-Demand	Bother	MMP1	18	40
CC(C)(C)OC(=O)N[C@@H](CNCCC(=O)Nc1ccccc1)c1ccccc1	ZINC000819110567	GH	On-Demand	Anodyne	LTA4H	18	41
CC(C)(C)OC(=O)N[C@@H](CNCCC(=O)Nc1ccccc1)c1ccccc1	ZINC000819110567	GH	On-Demand	Anodyne	PAPA1_CARPA	34	42
CC(C)(C)OC(=O)N[C@@H](CNCCC(=O)Nc1ccccc1)c1ccccc1	ZINC000819110567	GH	On-Demand	Anodyne	CTSK	15	49
CC(C)(C)OC(=O)N[C@@H](CNCCC(=O)Nc1ccccc1)c1ccccc1	ZINC000819110567	GH	On-Demand	Anodyne	SOAT1	19	52
CC(C)(C)OC(=O)N[C@@H](CNCCC(=O)Nc1ccccc1)c1ccccc1	ZINC000819110567	GH	On-Demand	Anodyne	FPR1	43	35
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(F)cn1	ZINC000819110577	DD	On-Demand	Bother	COLA	88	37
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(F)cn1	ZINC000819110578	DD	On-Demand	Bother	COLA	88	37
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccccc1)c1ccccc1	ZINC000819110581	FH	On-Demand	Anodyne	ADRB3	40	38
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccccc1)c1ccccc1	ZINC000819110581	FH	On-Demand	Anodyne	PAPA1_CARPA	37	44
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccccc1)c1ccccc1	ZINC000819110581	FH	On-Demand	Anodyne	CTSK	20	56
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccccc1)c1ccccc1	ZINC000819110581	FH	On-Demand	Anodyne	SOAT1	15	58
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccccc1)c1ccccc1	ZINC000819110581	FH	On-Demand	Anodyne	FPR1	48	39
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccccc1)c1ccccc1	ZINC000819110582	FH	On-Demand	Anodyne	ADRB3	40	38
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccccc1)c1ccccc1	ZINC000819110582	FH	On-Demand	Anodyne	PAPA1_CARPA	37	44
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccccc1)c1ccccc1	ZINC000819110582	FH	On-Demand	Anodyne	CTSK	20	56
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccccc1)c1ccccc1	ZINC000819110582	FH	On-Demand	Anodyne	SOAT1	15	58
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccccc1)c1ccccc1	ZINC000819110582	FH	On-Demand	Anodyne	FPR1	48	39
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2ccccc2[N+](=O)[O-])CC1	ZINC000819110588	GF	On-Demand	Bother	COLA	98	36
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2ccccc2[N+](=O)[O-])CC1	ZINC000819110588	GF	On-Demand	Bother	GPR119	47	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2ccccc2[N+](=O)[O-])CC1	ZINC000819110589	GF	On-Demand	Bother	COLA	98	36
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2ccccc2[N+](=O)[O-])CC1	ZINC000819110589	GF	On-Demand	Bother	GPR119	47	49
O=[N+]([O-])c1ccc(S(=O)(=O)CCNCCc2ccccc2[N+](=O)[O-])cc1	ZINC000819110590	GE	On-Demand	Bother	COLA	108	45
Cc1ccc(CNC(=O)C2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1F	ZINC000819110600	FF	On-Demand	Anodyne	EPHX2	24	46
Cc1ccc(CNC(=O)C2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1F	ZINC000819110601	FF	On-Demand	Anodyne	EPHX2	24	46
Cc1ccc(CNC(=O)C2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1F	ZINC000819110602	FF	On-Demand	Anodyne	EPHX2	24	46
Cc1ccc(CNC(=O)C2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1F	ZINC000819110603	FF	On-Demand	Anodyne	EPHX2	24	46
CN1CCC(CNC[C@@H](O)c2cc3ccccc3o2)(N2CCCCC2)CC1	ZINC000819110604	FG	On-Demand	Anodyne	HCN1	53	36
CON(C)C(=O)CCNCCc1ccccc1[N+](=O)[O-]	ZINC000819110605	CD	On-Demand	Bother	COLA	123	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819110618	EE	On-Demand	Bother	ADRB2	37	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819110618	EE	On-Demand	Bother	ADRB1	43	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819110618	EE	On-Demand	Bother	ADRB3	71	43
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819110618	EE	On-Demand	Bother	COLA	111	42
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819110619	EE	On-Demand	Bother	ADRB2	37	40
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819110619	EE	On-Demand	Bother	ADRB1	43	41
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819110619	EE	On-Demand	Bother	ADRB3	71	43
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819110619	EE	On-Demand	Bother	COLA	111	42
C[C@H](CNC[C@H](O)c1cccc(F)c1)Oc1cccc(F)c1	ZINC000819110620	DG	On-Demand	Anodyne	ADRB2	19	40
C[C@H](CNC[C@H](O)c1cccc(F)c1)Oc1cccc(F)c1	ZINC000819110620	DG	On-Demand	Anodyne	ADRB1	35	48
C[C@H](CNC[C@H](O)c1cccc(F)c1)Oc1cccc(F)c1	ZINC000819110620	DG	On-Demand	Anodyne	ADRB3	51	48
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1cccc(F)c1	ZINC000819110621	DG	On-Demand	Anodyne	ADRB2	19	40
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1cccc(F)c1	ZINC000819110621	DG	On-Demand	Anodyne	ADRB1	35	48
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1cccc(F)c1	ZINC000819110621	DG	On-Demand	Anodyne	ADRB3	51	48
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Oc1cccc(F)c1	ZINC000819110622	DG	On-Demand	Anodyne	ADRB2	19	40
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Oc1cccc(F)c1	ZINC000819110622	DG	On-Demand	Anodyne	ADRB1	35	48
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Oc1cccc(F)c1	ZINC000819110622	DG	On-Demand	Anodyne	ADRB3	51	48
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1cccc(F)c1	ZINC000819110623	DG	On-Demand	Anodyne	ADRB2	19	40
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1cccc(F)c1	ZINC000819110623	DG	On-Demand	Anodyne	ADRB1	35	48
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1cccc(F)c1	ZINC000819110623	DG	On-Demand	Anodyne	ADRB3	51	48
Cc1cc(C)cc(C[C@@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819110624	EG	On-Demand	Bother	ADRB2	47	40
Cc1cc(C)cc(C[C@@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819110624	EG	On-Demand	Bother	ADRB1	34	46
Cc1cc(C)cc(C[C@@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819110624	EG	On-Demand	Bother	ADRB3	62	46
Cc1cc(C)cc(C[C@@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819110624	EG	On-Demand	Bother	CACNA1D	59	34
Cc1cc(C)cc(C[C@@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819110625	EG	On-Demand	Bother	ADRB2	47	40
Cc1cc(C)cc(C[C@@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819110625	EG	On-Demand	Bother	ADRB1	34	46
Cc1cc(C)cc(C[C@@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819110625	EG	On-Demand	Bother	ADRB3	62	46
Cc1cc(C)cc(C[C@@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819110625	EG	On-Demand	Bother	CACNA1D	59	34
Cc1cc(C)cc(C[C@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819110626	EG	On-Demand	Bother	ADRB2	47	40
Cc1cc(C)cc(C[C@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819110626	EG	On-Demand	Bother	ADRB1	34	46
Cc1cc(C)cc(C[C@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819110626	EG	On-Demand	Bother	ADRB3	62	46
Cc1cc(C)cc(C[C@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819110626	EG	On-Demand	Bother	CACNA1D	59	34
Cc1cc(C)cc(C[C@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819110627	EG	On-Demand	Bother	ADRB2	47	40
Cc1cc(C)cc(C[C@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819110627	EG	On-Demand	Bother	ADRB1	34	46
Cc1cc(C)cc(C[C@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819110627	EG	On-Demand	Bother	ADRB3	62	46
Cc1cc(C)cc(C[C@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819110627	EG	On-Demand	Bother	CACNA1D	59	34
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1cccnc1	ZINC000819110636	CD	On-Demand	Bother	ADRB2	41	51
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1cccnc1	ZINC000819110636	CD	On-Demand	Bother	ADRB1	45	52
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1cccnc1	ZINC000819110636	CD	On-Demand	Bother	ADRB3	141	52
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1cccnc1	ZINC000819110636	CD	On-Demand	Bother	COLA	93	34
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1cccnc1	ZINC000819110637	CD	On-Demand	Bother	ADRB2	41	51
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1cccnc1	ZINC000819110637	CD	On-Demand	Bother	ADRB1	45	52
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1cccnc1	ZINC000819110637	CD	On-Demand	Bother	ADRB3	141	52
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1cccnc1	ZINC000819110637	CD	On-Demand	Bother	COLA	93	34
CN1CCC(CNC[C@@H](O)c2ccc(F)cn2)(N2CCCCC2)CC1	ZINC000819110638	FD	On-Demand	Anodyne	HCN1	57	36
CN1CCC(CNC[C@@H](O)c2ccc(F)cn2)(N2CCCCC2)CC1	ZINC000819110638	FD	On-Demand	Anodyne	HCN4	48	31
CN1CCC(CNC[C@H](O)c2ccc(F)cn2)(N2CCCCC2)CC1	ZINC000819110639	FD	On-Demand	Anodyne	HCN1	57	36
CN1CCC(CNC[C@H](O)c2ccc(F)cn2)(N2CCCCC2)CC1	ZINC000819110639	FD	On-Demand	Anodyne	HCN4	48	31
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(F)cc1F	ZINC000819110640	DF	On-Demand	Bother	ADRB2	32	41
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(F)cc1F	ZINC000819110640	DF	On-Demand	Bother	ADRB1	25	41
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(F)cc1F	ZINC000819110640	DF	On-Demand	Bother	COLA	103	45
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(F)cc1F	ZINC000819110641	DF	On-Demand	Bother	ADRB2	32	41
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(F)cc1F	ZINC000819110641	DF	On-Demand	Bother	ADRB1	25	41
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(F)cc1F	ZINC000819110641	DF	On-Demand	Bother	COLA	103	45
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NC[C@H](O)COc1ccccc1F)C2	ZINC000819110645	GG	On-Demand	Anodyne	ADRB2	27	44
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NC[C@H](O)COc1ccccc1F)C2	ZINC000819110645	GG	On-Demand	Anodyne	ADRB3	16	42
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NC[C@H](O)COc1ccccc1F)C2	ZINC000819110645	GG	On-Demand	Anodyne	ABCB1	15	41
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NC[C@H](O)COc1ccccc1F)C2	ZINC000819110645	GG	On-Demand	Anodyne	GPR119	19	42
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NC[C@@H](O)COc1ccccc1F)C2	ZINC000819110646	GG	On-Demand	Anodyne	ADRB2	27	44
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NC[C@@H](O)COc1ccccc1F)C2	ZINC000819110646	GG	On-Demand	Anodyne	ADRB3	16	42
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NC[C@@H](O)COc1ccccc1F)C2	ZINC000819110646	GG	On-Demand	Anodyne	ABCB1	15	41
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NC[C@@H](O)COc1ccccc1F)C2	ZINC000819110646	GG	On-Demand	Anodyne	GPR119	19	42
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819110651	DG	On-Demand	Bother	ADRB2	34	43
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819110651	DG	On-Demand	Bother	ADRB1	36	40
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819110651	DG	On-Demand	Bother	ADRB3	51	42
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819110651	DG	On-Demand	Bother	COLA	108	43
Cc1ccccc1[C@@H](O)CNCCc1ccccc1[N+](=O)[O-]	ZINC000819110666	DF	On-Demand	Bother	COLA	118	37
CC(C)(C)OC(=O)N[C@@H](CNCC1(O)CCOCC1)c1ccccc1	ZINC000819110668	FE	On-Demand	Anodyne	CTSK	19	46
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1cc(F)ccc1F	ZINC000819110674	DF	On-Demand	Bother	COLA	98	41
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1cc(F)ccc1F	ZINC000819110675	DF	On-Demand	Bother	COLA	98	41
Cc1ccc(C(=O)N(C)C)cc1NC(=O)C(F)=C1CCC1	ZINC000819110692	CG	On-Demand	Anodyne	MAPK11	15	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819110693	GG	On-Demand	Mild	PAPA1_CARPA	38	43
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819110693	GG	On-Demand	Mild	CTSG	17	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819110693	GG	On-Demand	Mild	CTRB1	16	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819110693	GG	On-Demand	Mild	CELA2A	15	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819110693	GG	On-Demand	Mild	CTRB_BOVIN	61	37
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819110695	GG	On-Demand	Mild	PAPA1_CARPA	38	43
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819110695	GG	On-Demand	Mild	CTSG	17	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819110695	GG	On-Demand	Mild	CTRB1	16	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819110695	GG	On-Demand	Mild	CELA2A	15	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819110695	GG	On-Demand	Mild	CTRB_BOVIN	61	37
C[C@@H](CNCCC(=O)Nc1ccc(N(C)C)cc1)Oc1cccc(F)c1	ZINC000819110703	FG	On-Demand	Anodyne	LTA4H	33	41
C[C@@H](CNCCC(=O)Nc1ccc(N(C)C)cc1)Oc1cccc(F)c1	ZINC000819110703	FG	On-Demand	Anodyne	MTNR1B	19	44
C[C@H](CNCCC(=O)Nc1ccc(N(C)C)cc1)Oc1cccc(F)c1	ZINC000819110704	FG	On-Demand	Anodyne	LTA4H	33	41
C[C@H](CNCCC(=O)Nc1ccc(N(C)C)cc1)Oc1cccc(F)c1	ZINC000819110704	FG	On-Demand	Anodyne	MTNR1B	19	44
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cn1cccn1)c1ccccc1	ZINC000819110713	FE	On-Demand	Anodyne	REN	19	43
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cn1cccn1)c1ccccc1	ZINC000819110713	FE	On-Demand	Anodyne	AMP1_PLAFQ	18	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cn1cccn1)c1ccccc1	ZINC000819110714	FE	On-Demand	Anodyne	REN	19	43
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cn1cccn1)c1ccccc1	ZINC000819110714	FE	On-Demand	Anodyne	AMP1_PLAFQ	18	41
CN1CCC(CNC[C@H](O)c2ccc(F)cc2Cl)(N2CCCCC2)CC1	ZINC000819110720	GG	On-Demand	Anodyne	HCN1	44	35
CN1CCC(CNC[C@@H](O)c2ccc(F)cc2Cl)(N2CCCCC2)CC1	ZINC000819110721	GG	On-Demand	Anodyne	HCN1	44	35
CN(C)c1ccc(NC(=O)CCNCCc2ccccc2[N+](=O)[O-])cc1	ZINC000819110728	FF	On-Demand	Bother	COLA	119	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@](C)(O)C(F)(F)F)c1ccccc1	ZINC000819110729	FG	On-Demand	Anodyne	PAPA1_CARPA	34	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@](C)(O)C(F)(F)F)c1ccccc1	ZINC000819110729	FG	On-Demand	Anodyne	CTSK	16	51
CC(C)(C)OC(=O)N[C@@H](CNC[C@](C)(O)C(F)(F)F)c1ccccc1	ZINC000819110729	FG	On-Demand	Anodyne	FPR1	44	36
CC(C)(C)OC(=O)N[C@@H](CNC[C@@](C)(O)C(F)(F)F)c1ccccc1	ZINC000819110732	FG	On-Demand	Anodyne	PAPA1_CARPA	34	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@@](C)(O)C(F)(F)F)c1ccccc1	ZINC000819110732	FG	On-Demand	Anodyne	CTSK	16	51
CC(C)(C)OC(=O)N[C@@H](CNC[C@@](C)(O)C(F)(F)F)c1ccccc1	ZINC000819110732	FG	On-Demand	Anodyne	FPR1	44	36
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)CC(F)(F)F)c1ccccc1	ZINC000819110756	FG	On-Demand	Anodyne	PAPA1_CARPA	33	40
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)CC(F)(F)F)c1ccccc1	ZINC000819110756	FG	On-Demand	Anodyne	CTSK	16	50
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)CC(F)(F)F)c1ccccc1	ZINC000819110756	FG	On-Demand	Anodyne	FPR1	43	35
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)CC(F)(F)F)c1ccccc1	ZINC000819110757	FG	On-Demand	Anodyne	PAPA1_CARPA	33	40
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)CC(F)(F)F)c1ccccc1	ZINC000819110757	FG	On-Demand	Anodyne	CTSK	16	50
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)CC(F)(F)F)c1ccccc1	ZINC000819110757	FG	On-Demand	Anodyne	FPR1	43	35
Cc1ccc(N2CCC[C@@H](NC[C@H](O)c3ccccc3)C2=O)cc1	ZINC000819110760	DF	On-Demand	Anodyne	XIAP	46	34
Cc1ccc(N2CCC[C@@H](NC[C@H](O)c3ccccc3)C2=O)cc1	ZINC000819110760	DF	On-Demand	Anodyne	BIRC8	45	33
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)c3ccccc3)C2=O)cc1	ZINC000819110763	DF	On-Demand	Anodyne	XIAP	46	34
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)c3ccccc3)C2=O)cc1	ZINC000819110763	DF	On-Demand	Anodyne	BIRC8	45	33
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819110764	FG	On-Demand	Bother	COLA	100	38
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819110765	FG	On-Demand	Bother	COLA	100	38
C[C@H](CNC[C@](C)(O)CNC(=O)OC(C)(C)C)Oc1cccc(F)c1	ZINC000819110771	FE	On-Demand	Anodyne	PAPA1_CARPA	18	40
C[C@H](CNC[C@@](C)(O)CNC(=O)OC(C)(C)C)Oc1cccc(F)c1	ZINC000819110772	FE	On-Demand	Anodyne	PAPA1_CARPA	18	40
C[C@@H](CNC[C@@](C)(O)CNC(=O)OC(C)(C)C)Oc1cccc(F)c1	ZINC000819110773	FE	On-Demand	Anodyne	PAPA1_CARPA	18	40
C[C@@H](CNC[C@](C)(O)CNC(=O)OC(C)(C)C)Oc1cccc(F)c1	ZINC000819110774	FE	On-Demand	Anodyne	PAPA1_CARPA	18	40
C[C@H](CNC[C@H](O)c1ccc(F)cc1)Oc1cccc(F)c1	ZINC000819110781	DG	On-Demand	Anodyne	ADRB1	23	40
C[C@H](CNC[C@H](O)c1ccc(F)cc1)Oc1cccc(F)c1	ZINC000819110781	DG	On-Demand	Anodyne	ADRB3	35	40
C[C@@H](CNC[C@H](O)c1ccc(F)cc1)Oc1cccc(F)c1	ZINC000819110782	DG	On-Demand	Anodyne	ADRB1	23	40
C[C@@H](CNC[C@H](O)c1ccc(F)cc1)Oc1cccc(F)c1	ZINC000819110782	DG	On-Demand	Anodyne	ADRB3	35	40
C[C@H](CNC[C@@H](O)c1ccc(F)cc1)Oc1cccc(F)c1	ZINC000819110783	DG	On-Demand	Anodyne	ADRB1	23	40
C[C@H](CNC[C@@H](O)c1ccc(F)cc1)Oc1cccc(F)c1	ZINC000819110783	DG	On-Demand	Anodyne	ADRB3	35	40
C[C@@H](CNC[C@@H](O)c1ccc(F)cc1)Oc1cccc(F)c1	ZINC000819110784	DG	On-Demand	Anodyne	ADRB1	23	40
C[C@@H](CNC[C@@H](O)c1ccc(F)cc1)Oc1cccc(F)c1	ZINC000819110784	DG	On-Demand	Anodyne	ADRB3	35	40
Cc1cc([C@@H]2CCCN2C(=O)C(F)=C2CCC2)on1	ZINC000819110786	CG	On-Demand	Anodyne	KCNA5	18	45
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccccc3)C2=O)cc1	ZINC000819110789	FF	On-Demand	Anodyne	ADRB2	44	44
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccccc3)C2=O)cc1	ZINC000819110789	FF	On-Demand	Anodyne	ADRB1	55	41
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccccc3)C2=O)cc1	ZINC000819110789	FF	On-Demand	Anodyne	ADRB3	37	45
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccccc3)C2=O)cc1	ZINC000819110792	FF	On-Demand	Anodyne	ADRB2	44	44
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccccc3)C2=O)cc1	ZINC000819110792	FF	On-Demand	Anodyne	ADRB1	55	41
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccccc3)C2=O)cc1	ZINC000819110792	FF	On-Demand	Anodyne	ADRB3	37	45
COc1ccc(OC)c([C@H](O)CNC[C@@H](C)Oc2cccc(F)c2)c1	ZINC000819110799	EF	On-Demand	Anodyne	MTNR1A	24	47
COc1ccc(OC)c([C@H](O)CNC[C@@H](C)Oc2cccc(F)c2)c1	ZINC000819110799	EF	On-Demand	Anodyne	MTNR1B	26	47
COc1ccc(OC)c([C@H](O)CNC[C@H](C)Oc2cccc(F)c2)c1	ZINC000819110800	EF	On-Demand	Anodyne	MTNR1A	24	47
COc1ccc(OC)c([C@H](O)CNC[C@H](C)Oc2cccc(F)c2)c1	ZINC000819110800	EF	On-Demand	Anodyne	MTNR1B	26	47
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819110813	EF	On-Demand	Bother	ADRB1	24	43
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819110813	EF	On-Demand	Bother	ADRB3	36	43
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819110813	EF	On-Demand	Bother	CACNA1D	56	36
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819110814	EF	On-Demand	Bother	ADRB1	24	43
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819110814	EF	On-Demand	Bother	ADRB3	36	43
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819110814	EF	On-Demand	Bother	CACNA1D	56	36
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819110815	EF	On-Demand	Bother	ADRB1	24	43
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819110815	EF	On-Demand	Bother	ADRB3	36	43
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819110815	EF	On-Demand	Bother	CACNA1D	56	36
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819110816	EF	On-Demand	Bother	ADRB1	24	43
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819110816	EF	On-Demand	Bother	ADRB3	36	43
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819110816	EF	On-Demand	Bother	CACNA1D	56	36
N#Cc1ccccc1OCc1cccc(C(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819110837	GG	On-Demand	Mild	HRH3	16	42
N#Cc1ccccc1OCc1cccc(C(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819110838	GG	On-Demand	Mild	HRH3	16	42
CN1CCC(CNC[C@H](O)c2cccc(F)c2)(N2CCCCC2)CC1	ZINC000819110862	EE	On-Demand	Anodyne	HCN1	44	35
CN1CCC(CNC[C@@H](O)c2cccc(F)c2)(N2CCCCC2)CC1	ZINC000819110863	EE	On-Demand	Anodyne	HCN1	44	35
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819110864	CE	On-Demand	Anodyne	ADRB2	28	47
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819110864	CE	On-Demand	Anodyne	ADRB1	42	51
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819110864	CE	On-Demand	Anodyne	ADRB3	108	51
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819110864	CE	On-Demand	Anodyne	KCNA5	17	41
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819110865	CE	On-Demand	Anodyne	ADRB2	28	47
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819110865	CE	On-Demand	Anodyne	ADRB1	42	51
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819110865	CE	On-Demand	Anodyne	ADRB3	108	51
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819110865	CE	On-Demand	Anodyne	KCNA5	17	41
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819110866	CE	On-Demand	Anodyne	ADRB2	28	47
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819110866	CE	On-Demand	Anodyne	ADRB1	42	51
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819110866	CE	On-Demand	Anodyne	ADRB3	108	51
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819110866	CE	On-Demand	Anodyne	KCNA5	17	41
C[C@H](CNC[C@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819110867	CE	On-Demand	Anodyne	ADRB2	28	47
C[C@H](CNC[C@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819110867	CE	On-Demand	Anodyne	ADRB1	42	51
C[C@H](CNC[C@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819110867	CE	On-Demand	Anodyne	ADRB3	108	51
C[C@H](CNC[C@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819110867	CE	On-Demand	Anodyne	KCNA5	17	41
NC(=O)[C@@H](NC(=O)NCCC(=O)O)c1ccccc1	ZINC000819110876	CB	On-Demand	Anodyne	MME	24	40
NC(=O)[C@@H](NC(=O)NCCC(=O)O)c1ccccc1	ZINC000819110876	CB	On-Demand	Anodyne	C3AR1	59	37
NC(=O)[C@@H](NC(=O)NCCC(=O)O)c1ccccc1	ZINC000819110876	CB	On-Demand	Anodyne	NAALAD2	41	50
C[C@@H]1C[C@H](NC[C@H](O)c2ccc(F)cc2)C(=O)N1c1ccccc1	ZINC000819110880	EF	On-Demand	Anodyne	SLC6A3	18	42
C[C@@H]1C[C@H](NC[C@@H](O)c2ccc(F)cc2)C(=O)N1c1ccccc1	ZINC000819110882	EF	On-Demand	Anodyne	SLC6A3	18	42
NC(=O)[C@H](NC(=O)NCCC(=O)O)c1ccccc1	ZINC000819110884	CB	On-Demand	Anodyne	MME	24	40
NC(=O)[C@H](NC(=O)NCCC(=O)O)c1ccccc1	ZINC000819110884	CB	On-Demand	Anodyne	C3AR1	59	37
NC(=O)[C@H](NC(=O)NCCC(=O)O)c1ccccc1	ZINC000819110884	CB	On-Demand	Anodyne	NAALAD2	41	50
N#Cc1ccccc1NC(=S)N1CC[C@H](C(=O)O)C1	ZINC000819110885	CD	On-Demand	Mild	SLC6A1	65	35
N#Cc1ccccc1NC(=S)N1CC[C@@H](C(=O)O)C1	ZINC000819110889	CD	On-Demand	Mild	SLC6A1	65	35
N#Cc1ccc(S(=O)(=O)N2CCC(n3cccc3C(=O)O)CC2)cc1F	ZINC000819110896	GE	On-Demand	Mild	AKR1C3	40	37
Cc1ccc(N2CCC[C@@H](NC[C@H](O)c3cccnc3)C2=O)cc1	ZINC000819110898	EE	On-Demand	Anodyne	ADRB2	15	43
Cc1ccc(N2CCC[C@@H](NC[C@H](O)c3cccnc3)C2=O)cc1	ZINC000819110898	EE	On-Demand	Anodyne	ADRB1	17	42
Cc1ccc(N2CCC[C@@H](NC[C@H](O)c3cccnc3)C2=O)cc1	ZINC000819110898	EE	On-Demand	Anodyne	ADRB3	73	45
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819110899	FD	On-Demand	Anodyne	SLC6A1	43	32
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819110899	FD	On-Demand	Anodyne	CCR3	21	40
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819110899	FD	On-Demand	Anodyne	P2RY14	42	33
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)c3cccnc3)C2=O)cc1	ZINC000819110900	EE	On-Demand	Anodyne	ADRB2	15	43
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)c3cccnc3)C2=O)cc1	ZINC000819110900	EE	On-Demand	Anodyne	ADRB1	17	42
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)c3cccnc3)C2=O)cc1	ZINC000819110900	EE	On-Demand	Anodyne	ADRB3	73	45
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819110901	FD	On-Demand	Anodyne	SLC6A1	43	32
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819110901	FD	On-Demand	Anodyne	CCR3	21	40
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819110901	FD	On-Demand	Anodyne	P2RY14	42	33
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819110903	FD	On-Demand	Anodyne	SLC6A1	43	32
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819110903	FD	On-Demand	Anodyne	CCR3	21	40
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819110903	FD	On-Demand	Anodyne	P2RY14	42	33
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819110905	FD	On-Demand	Anodyne	SLC6A1	43	32
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819110905	FD	On-Demand	Anodyne	CCR3	21	40
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819110905	FD	On-Demand	Anodyne	P2RY14	42	33
Cc1cc(C)cc(C[C@@H](C)NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819110923	EG	On-Demand	Bother	ADRB2	45	37
Cc1cc(C)cc(C[C@@H](C)NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819110923	EG	On-Demand	Bother	ADRB1	19	44
Cc1cc(C)cc(C[C@@H](C)NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819110923	EG	On-Demand	Bother	ADRB3	40	41
Cc1cc(C)cc(C[C@@H](C)NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819110925	EG	On-Demand	Bother	ADRB2	45	37
Cc1cc(C)cc(C[C@@H](C)NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819110925	EG	On-Demand	Bother	ADRB1	19	44
Cc1cc(C)cc(C[C@@H](C)NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819110925	EG	On-Demand	Bother	ADRB3	40	41
Cc1cc(C)cc(C[C@H](C)NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819110927	EG	On-Demand	Bother	ADRB2	45	37
Cc1cc(C)cc(C[C@H](C)NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819110927	EG	On-Demand	Bother	ADRB1	19	44
Cc1cc(C)cc(C[C@H](C)NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819110927	EG	On-Demand	Bother	ADRB3	40	41
Cc1cc(C)cc(C[C@H](C)NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819110929	EG	On-Demand	Bother	ADRB2	45	37
Cc1cc(C)cc(C[C@H](C)NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819110929	EG	On-Demand	Bother	ADRB1	19	44
Cc1cc(C)cc(C[C@H](C)NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819110929	EG	On-Demand	Bother	ADRB3	40	41
N#Cc1ccccc1OCC(=O)NNC(=O)NCCC(=O)O	ZINC000819110952	DB	On-Demand	Reactive	ADRB1	56	43
N#Cc1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819110956	DF	On-Demand	Mild	ADRB1	58	47
N#Cc1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819110956	DF	On-Demand	Mild	LTA4H	30	43
N#Cc1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819110956	DF	On-Demand	Mild	CA1	37	42
N#Cc1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819110956	DF	On-Demand	Mild	F7	17	44
N#Cc1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819110956	DF	On-Demand	Mild	CA12	16	45
N#Cc1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819110956	DF	On-Demand	Mild	CA9	19	45
N#Cc1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819110956	DF	On-Demand	Mild	NCE103	17	45
N#Cc1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819110956	DF	On-Demand	Mild	P96878_MYCTU	15	40
N#Cc1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819110956	DF	On-Demand	Mild	PFKFB3	54	38
N#Cc1ccccc1Oc1ccc(NC(=O)NCCC(=O)O)cc1F	ZINC000819110963	EG	On-Demand	Mild	ADRB1	60	48
N#Cc1ccccc1Oc1ccc(NC(=O)NCCC(=O)O)cc1F	ZINC000819110963	EG	On-Demand	Mild	MET	62	39
N#Cc1ccccc1Oc1ccc(NC(=O)NCCC(=O)O)cc1F	ZINC000819110963	EG	On-Demand	Mild	EZH2	29	46
N#Cc1ccccc1OCc1ccc(C(=O)NCCCC(=O)O)o1	ZINC000819110974	EE	On-Demand	Mild	ADRB1	46	35
N#Cc1ccccc1OCc1ccc(C(=O)NCCCC(=O)O)o1	ZINC000819110974	EE	On-Demand	Mild	PTGER3	16	43
N#Cc1ccccc1OCc1ccc(C(=O)NCCCC(=O)O)o1	ZINC000819110974	EE	On-Demand	Mild	FFAR1	15	40
NC(=O)[C@H]1CCC[C@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110977	DD	On-Demand	Anodyne	NPY1R	30	42
NC(=O)[C@H]1CCC[C@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110977	DD	On-Demand	Anodyne	CCKAR	15	41
NC(=O)[C@H]1CCC[C@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110977	DD	On-Demand	Anodyne	CCR3	26	41
NC(=O)[C@H]1CCC[C@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110977	DD	On-Demand	Anodyne	CCKBR	24	41
NC(=O)[C@H]1CCC[C@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110977	DD	On-Demand	Anodyne	EPHX2	29	46
NC(=O)[C@@H]1CCC[C@@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110979	DD	On-Demand	Anodyne	NPY1R	30	42
NC(=O)[C@@H]1CCC[C@@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110979	DD	On-Demand	Anodyne	CCKAR	15	41
NC(=O)[C@@H]1CCC[C@@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110979	DD	On-Demand	Anodyne	CCR3	26	41
NC(=O)[C@@H]1CCC[C@@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110979	DD	On-Demand	Anodyne	CCKBR	24	41
NC(=O)[C@@H]1CCC[C@@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110979	DD	On-Demand	Anodyne	EPHX2	29	46
NC(=O)[C@H]1CCC[C@@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110981	DD	On-Demand	Anodyne	NPY1R	30	42
NC(=O)[C@H]1CCC[C@@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110981	DD	On-Demand	Anodyne	CCKAR	15	41
NC(=O)[C@H]1CCC[C@@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110981	DD	On-Demand	Anodyne	CCR3	26	41
NC(=O)[C@H]1CCC[C@@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110981	DD	On-Demand	Anodyne	CCKBR	24	41
NC(=O)[C@H]1CCC[C@@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110981	DD	On-Demand	Anodyne	EPHX2	29	46
NC(=O)[C@@H]1CCC[C@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110983	DD	On-Demand	Anodyne	NPY1R	30	42
NC(=O)[C@@H]1CCC[C@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110983	DD	On-Demand	Anodyne	CCKAR	15	41
NC(=O)[C@@H]1CCC[C@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110983	DD	On-Demand	Anodyne	CCR3	26	41
NC(=O)[C@@H]1CCC[C@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110983	DD	On-Demand	Anodyne	CCKBR	24	41
NC(=O)[C@@H]1CCC[C@H](NC(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819110983	DD	On-Demand	Anodyne	EPHX2	29	46
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NCCC(=O)O)c1	ZINC000819110989	EC	On-Demand	Anodyne	HRH2	36	44
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NCCC(=O)O)c1	ZINC000819110989	EC	On-Demand	Anodyne	NPY1R	44	38
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NCCC(=O)O)c1	ZINC000819110989	EC	On-Demand	Anodyne	CCR3	60	41
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NCCC(=O)O)c1	ZINC000819110990	EC	On-Demand	Anodyne	HRH2	36	44
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NCCC(=O)O)c1	ZINC000819110990	EC	On-Demand	Anodyne	NPY1R	44	38
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NCCC(=O)O)c1	ZINC000819110990	EC	On-Demand	Anodyne	CCR3	60	41
N#Cc1ccsc1C(=O)N1CCC[C@@H]1C(=O)O	ZINC000819110998	CD	On-Demand	Mild	ACE	44	39
N#Cc1ccsc1C(=O)N1CCC[C@@H]1C(=O)O	ZINC000819110998	CD	On-Demand	Mild	SLC6A1	19	41
N#Cc1ccsc1C(=O)N1CCC[C@@H]1C(=O)O	ZINC000819110998	CD	On-Demand	Mild	PREP	67	45
N#Cc1ccsc1C(=O)N1CCC[C@H]1C(=O)O	ZINC000819110999	CD	On-Demand	Mild	ACE	44	39
N#Cc1ccsc1C(=O)N1CCC[C@H]1C(=O)O	ZINC000819110999	CD	On-Demand	Mild	SLC6A1	19	41
N#Cc1ccsc1C(=O)N1CCC[C@H]1C(=O)O	ZINC000819110999	CD	On-Demand	Mild	PREP	67	45
N#Cc1ccccc1Oc1ccc(NC(=O)C(=O)NCC(=O)O)cc1F	ZINC000819111000	FD	On-Demand	Mild	ADRB1	46	39
N#Cc1ccccc1Oc1ccc(NC(=O)C(=O)NCC(=O)O)cc1F	ZINC000819111000	FD	On-Demand	Mild	MET	58	39
N#Cc1ccccc1Oc1ccc(NC(=O)C(=O)NCC(=O)O)cc1F	ZINC000819111000	FD	On-Demand	Mild	EZH2	27	44
N#Cc1ccccc1OCC(=O)NNC(=O)NCCCC(=O)O	ZINC000819111006	DC	On-Demand	Reactive	ADRB1	54	42
NC(=O)[C@@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1ccccc1	ZINC000819111007	ED	On-Demand	Anodyne	ANPEP	18	59
NC(=O)[C@@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1ccccc1	ZINC000819111007	ED	On-Demand	Anodyne	FURIN	57	39
NC(=O)[C@@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1ccccc1	ZINC000819111007	ED	On-Demand	Anodyne	MTTP	29	42
NC(=O)[C@@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1ccccc1	ZINC000819111007	ED	On-Demand	Anodyne	TPSAB1	18	46
NC(=O)[C@@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1ccccc1	ZINC000819111007	ED	On-Demand	Anodyne	PROC	65	37
NC(=O)[C@@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1ccccc1	ZINC000819111007	ED	On-Demand	Anodyne	TMPRSS11D	78	37
NC(=O)[C@@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1ccccc1	ZINC000819111007	ED	On-Demand	Anodyne	PDS	41	33
NC(=O)[C@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1ccccc1	ZINC000819111008	ED	On-Demand	Anodyne	ANPEP	18	59
NC(=O)[C@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1ccccc1	ZINC000819111008	ED	On-Demand	Anodyne	FURIN	57	39
NC(=O)[C@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1ccccc1	ZINC000819111008	ED	On-Demand	Anodyne	MTTP	29	42
NC(=O)[C@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1ccccc1	ZINC000819111008	ED	On-Demand	Anodyne	TPSAB1	18	46
NC(=O)[C@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1ccccc1	ZINC000819111008	ED	On-Demand	Anodyne	PROC	65	37
NC(=O)[C@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1ccccc1	ZINC000819111008	ED	On-Demand	Anodyne	TMPRSS11D	78	37
NC(=O)[C@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1ccccc1	ZINC000819111008	ED	On-Demand	Anodyne	PDS	41	33
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	ACE	49	48
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	MME	131	48
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	ANPEP	85	42
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	FCER2	46	33
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	CTSB	46	43
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	PAPA1_CARPA	56	45
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	CYSP_TRYCR	42	32
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	CTSL	46	45
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	CPA1	54	44
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	NPFFR2	43	34
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	ITGA4	54	33
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	NAALAD2	25	43
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	CAPNS1	47	36
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	ECE1	37	40
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	CTSS	27	45
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	CAPN1	47	51
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	ACE2	90	44
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	CTSC	43	40
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	CTSV	53	40
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	PIN1	45	38
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	FPR1	71	42
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	CTRB_BOVIN	65	41
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	BLA1_STEMA	83	40
N#Cc1csc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111009	DE	On-Demand	Mild	NPFFR1	57	34
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	ACE	49	48
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	MME	131	48
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	ANPEP	85	42
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	FCER2	46	33
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	CTSB	46	43
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	PAPA1_CARPA	56	45
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	CYSP_TRYCR	42	32
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	CTSL	46	45
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	CPA1	54	44
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	NPFFR2	43	34
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	ITGA4	54	33
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	NAALAD2	25	43
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	CAPNS1	47	36
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	ECE1	37	40
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	CTSS	27	45
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	CAPN1	47	51
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	ACE2	90	44
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	CTSC	43	40
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	CTSV	53	40
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	PIN1	45	38
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	FPR1	71	42
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	CTRB_BOVIN	65	41
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	BLA1_STEMA	83	40
N#Cc1csc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)c1	ZINC000819111010	DE	On-Demand	Mild	NPFFR1	57	34
N#Cc1ccccc1Sc1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819111011	FG	On-Demand	Mild	SLC18A3	23	41
N#Cc1ccccc1Sc1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819111011	FG	On-Demand	Mild	L3MBTL3	70	38
N#Cc1ccccc1Sc1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819111012	FG	On-Demand	Mild	SLC18A3	23	41
N#Cc1ccccc1Sc1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819111012	FG	On-Demand	Mild	L3MBTL3	70	38
NC(=O)[C@H]1CCCN(CCCNC(=O)N2CCC[C@@H](CC(=O)O)C2)C1	ZINC000819111013	FC	On-Demand	Anodyne	SLC6A1	84	37
NC(=O)[C@H]1CCCN(CCCNC(=O)N2CCC[C@H](CC(=O)O)C2)C1	ZINC000819111014	FC	On-Demand	Anodyne	SLC6A1	84	37
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CCC[C@@H](CC(=O)O)C2)C1	ZINC000819111015	FC	On-Demand	Anodyne	SLC6A1	84	37
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CCC[C@H](CC(=O)O)C2)C1	ZINC000819111016	FC	On-Demand	Anodyne	SLC6A1	84	37
N#Cc1ccccc1OCc1ccc(C(=O)N2CCC[C@@H]2C(=O)O)o1	ZINC000819111018	EE	On-Demand	Mild	ACE	46	40
N#Cc1ccccc1OCc1ccc(C(=O)N2CCC[C@@H]2C(=O)O)o1	ZINC000819111018	EE	On-Demand	Mild	PREP	96	41
N#Cc1ccccc1OCc1ccc(C(=O)N2CCC[C@@H]2C(=O)O)o1	ZINC000819111018	EE	On-Demand	Mild	LGMN	68	36
O=[N+]([O-])c1ccccc1CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819111027	FE	On-Demand	Bother	ADRB2	56	50
O=[N+]([O-])c1ccccc1CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819111027	FE	On-Demand	Bother	ADRB1	79	50
O=[N+]([O-])c1ccccc1CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819111027	FE	On-Demand	Bother	ADRB3	47	50
O=[N+]([O-])c1ccccc1CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819111027	FE	On-Demand	Bother	COLA	107	34
O=[N+]([O-])c1ccccc1CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819111027	FE	On-Demand	Bother	ABCB1	23	43
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819111029	FE	On-Demand	Bother	ADRB2	56	50
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819111029	FE	On-Demand	Bother	ADRB1	79	50
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819111029	FE	On-Demand	Bother	ADRB3	47	50
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819111029	FE	On-Demand	Bother	COLA	107	34
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819111029	FE	On-Demand	Bother	ABCB1	23	43
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NCCCC(=O)O)cc2)C1	ZINC000819111030	FD	On-Demand	Clean	PROC	40	36
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NCCCC(=O)O)cc2)C1	ZINC000819111032	FD	On-Demand	Clean	PROC	40	36
N#Cc1ccccc1Oc1ccc(NC(=O)CSCC(=O)O)cc1F	ZINC000819111033	FG	On-Demand	Mild	ADRB1	44	36
N#Cc1ccccc1Oc1ccc(NC(=O)CSCC(=O)O)cc1F	ZINC000819111033	FG	On-Demand	Mild	KDR	18	42
N#Cc1ccccc1Oc1ccc(NC(=O)CSCC(=O)O)cc1F	ZINC000819111033	FG	On-Demand	Mild	MET	70	42
N#Cc1ccccc1Oc1ccc(NC(=O)CSCC(=O)O)cc1F	ZINC000819111033	FG	On-Demand	Mild	EZH2	27	43
N#Cc1ccccc1OCc1ccc(C(=O)NCc2ccc(C(=O)O)cc2)o1	ZINC000819111039	GG	On-Demand	Mild	ADRB1	43	40
NC(=O)[C@H]1CCCCC[C@@H]1NC(=O)Nc1cccc(CC(=O)O)c1	ZINC000819111057	ED	On-Demand	Anodyne	CCR3	31	45
NC(=O)[C@@H]1CCCCC[C@@H]1NC(=O)Nc1cccc(CC(=O)O)c1	ZINC000819111059	ED	On-Demand	Anodyne	CCR3	31	45
NC(=O)[C@H]1CCCCC[C@H]1NC(=O)Nc1cccc(CC(=O)O)c1	ZINC000819111061	ED	On-Demand	Anodyne	CCR3	31	45
NC(=O)[C@@H]1CCCCC[C@H]1NC(=O)Nc1cccc(CC(=O)O)c1	ZINC000819111062	ED	On-Demand	Anodyne	CCR3	31	45
NC(=O)[C@H](CNC(=O)Nc1ccccc1CC(=O)O)Cc1ccccc1Cl	ZINC000819111067	GE	On-Demand	Anodyne	CXCL8	55	48
NC(=O)[C@@H](CNC(=O)Nc1ccccc1CC(=O)O)Cc1ccccc1Cl	ZINC000819111069	GE	On-Demand	Anodyne	CXCL8	55	48
N#Cc1ccccc1Oc1ccc(NC(=O)C(=O)NCCCC(=O)O)cc1F	ZINC000819111072	GE	On-Demand	Mild	ADRB1	48	38
N#Cc1ccccc1Oc1ccc(NC(=O)C(=O)NCCCC(=O)O)cc1F	ZINC000819111072	GE	On-Demand	Mild	MET	50	36
N#Cc1ccccc1Oc1ccc(NC(=O)C(=O)NCCCC(=O)O)cc1F	ZINC000819111072	GE	On-Demand	Mild	EZH2	28	44
Cc1ccc(C(=O)N(C)C)cc1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819111075	DE	On-Demand	Anodyne	MAPK11	24	43
Cc1ccc(C(=O)N(C)C)cc1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819111076	DE	On-Demand	Anodyne	MAPK11	24	43
Cc1ccc(C(=O)N(C)C)cc1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819111077	DE	On-Demand	Anodyne	MAPK11	24	43
Cc1ccc(C(=O)N(C)C)cc1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819111078	DE	On-Demand	Anodyne	MAPK11	24	43
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1cccc(F)c1	ZINC000819111088	DF	On-Demand	Bother	ADRB1	38	44
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1cccc(F)c1	ZINC000819111088	DF	On-Demand	Bother	ADRB3	74	44
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1cccc(F)c1	ZINC000819111088	DF	On-Demand	Bother	COLA	103	40
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819111089	DF	On-Demand	Bother	ADRB1	38	44
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819111089	DF	On-Demand	Bother	ADRB3	74	44
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819111089	DF	On-Demand	Bother	COLA	103	40
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccccc1F	ZINC000819111091	DF	On-Demand	Bother	ADRB2	18	43
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccccc1F	ZINC000819111091	DF	On-Demand	Bother	ADRB1	15	43
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccccc1F	ZINC000819111091	DF	On-Demand	Bother	COLA	108	38
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccccc1F	ZINC000819111093	DF	On-Demand	Bother	ADRB2	18	43
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccccc1F	ZINC000819111093	DF	On-Demand	Bother	ADRB1	15	43
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccccc1F	ZINC000819111093	DF	On-Demand	Bother	COLA	108	38
C[C@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1cccc(F)c1	ZINC000819111095	GG	On-Demand	Anodyne	GPR119	51	59
C[C@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1cccc(F)c1	ZINC000819111097	GG	On-Demand	Anodyne	GPR119	51	59
N#Cc1ccccc1Sc1ccc(C(=O)NCCC(=O)O)cc1	ZINC000819111098	EF	On-Demand	Mild	GCGR	82	40
N#Cc1ccccc1Sc1ccc(C(=O)NCCC(=O)O)cc1	ZINC000819111098	EF	On-Demand	Mild	GIPR	68	36
C[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1cccc(F)c1	ZINC000819111099	GG	On-Demand	Anodyne	GPR119	51	59
N#Cc1csc(C(=O)Nc2cccc(CC(=O)O)c2)c1	ZINC000819111100	CE	On-Demand	Mild	KCNK3	53	39
C[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1cccc(F)c1	ZINC000819111101	GG	On-Demand	Anodyne	GPR119	51	59
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](C(=O)O)C3)cc2)C1	ZINC000819111102	FD	On-Demand	Clean	SLC6A1	74	33
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](C(=O)O)C3)cc2)C1	ZINC000819111102	FD	On-Demand	Clean	DPP7	48	32
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](C(=O)O)C3)cc2)C1	ZINC000819111104	FD	On-Demand	Clean	SLC6A1	74	33
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@H](C(=O)O)C3)cc2)C1	ZINC000819111104	FD	On-Demand	Clean	DPP7	48	32
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](C(=O)O)C3)cc2)C1	ZINC000819111106	FD	On-Demand	Clean	SLC6A1	74	33
NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](C(=O)O)C3)cc2)C1	ZINC000819111106	FD	On-Demand	Clean	DPP7	48	32
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](C(=O)O)C3)cc2)C1	ZINC000819111108	FD	On-Demand	Clean	SLC6A1	74	33
NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)N3CC[C@@H](C(=O)O)C3)cc2)C1	ZINC000819111108	FD	On-Demand	Clean	DPP7	48	32
NC(=O)C1CCN(C(=O)C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819111110	EB	On-Demand	Anodyne	CXCL8	28	40
N#Cc1cccnc1N1CCN(C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819111118	FD	On-Demand	Mild	P2RY12	21	49
N#Cc1cccnc1N1CCN(C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819111118	FD	On-Demand	Mild	TRPV1	15	59
N#Cc1cccnc1N1CCN(C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819111118	FD	On-Demand	Mild	FAAH	17	40
CN1CCC(CNC[C@H](O)c2cccc(Cl)c2)(N2CCCCC2)CC1	ZINC000819111125	FF	On-Demand	Anodyne	ADRB1	26	40
CN1CCC(CNC[C@H](O)c2cccc(Cl)c2)(N2CCCCC2)CC1	ZINC000819111125	FF	On-Demand	Anodyne	ADRB3	40	40
CN1CCC(CNC[C@H](O)c2cccc(Cl)c2)(N2CCCCC2)CC1	ZINC000819111125	FF	On-Demand	Anodyne	HCN1	44	35
CN1CCC(CNC[C@@H](O)c2cccc(Cl)c2)(N2CCCCC2)CC1	ZINC000819111127	FF	On-Demand	Anodyne	ADRB1	26	40
CN1CCC(CNC[C@@H](O)c2cccc(Cl)c2)(N2CCCCC2)CC1	ZINC000819111127	FF	On-Demand	Anodyne	ADRB3	40	40
CN1CCC(CNC[C@@H](O)c2cccc(Cl)c2)(N2CCCCC2)CC1	ZINC000819111127	FF	On-Demand	Anodyne	HCN1	44	35
NC(=O)[C@H]1CCCN(CCCNC(=O)NCCC(=O)O)C1	ZINC000819111130	DB	On-Demand	Anodyne	SLC6A1	105	38
NC(=O)[C@@H]1CCCN(CCCNC(=O)NCCC(=O)O)C1	ZINC000819111132	DB	On-Demand	Anodyne	SLC6A1	105	38
N#Cc1ccccc1OCC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819111134	DE	On-Demand	Mild	ADRB1	42	38
N#Cc1ccccc1OCC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819111134	DE	On-Demand	Mild	XDH	31	47
N#Cc1ccccc1OCC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819111134	DE	On-Demand	Mild	PTGER1	20	44
COc1ccc(OC)c([C@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819111135	EE	On-Demand	Bother	ADRB2	35	48
COc1ccc(OC)c([C@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819111135	EE	On-Demand	Bother	ADRB1	35	41
COc1ccc(OC)c([C@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819111135	EE	On-Demand	Bother	COLA	100	41
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819111136	GD	On-Demand	Anodyne	CCR3	34	47
Cc1cc(C)cc(C[C@@H](C)NC[C@H](O)c2ccccc2)c1	ZINC000819111137	CH	On-Demand	Anodyne	ADRB2	57	44
Cc1cc(C)cc(C[C@@H](C)NC[C@H](O)c2ccccc2)c1	ZINC000819111137	CH	On-Demand	Anodyne	ADRB1	39	60
Cc1cc(C)cc(C[C@@H](C)NC[C@H](O)c2ccccc2)c1	ZINC000819111137	CH	On-Demand	Anodyne	ADRB3	84	60
Cc1cc(C)cc(C[C@@H](C)NC[C@H](O)c2ccccc2)c1	ZINC000819111137	CH	On-Demand	Anodyne	AOC3	15	44
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819111138	GD	On-Demand	Anodyne	CCR3	34	47
Cc1cc(C)cc(C[C@H](C)NC[C@H](O)c2ccccc2)c1	ZINC000819111139	CH	On-Demand	Anodyne	ADRB2	57	44
Cc1cc(C)cc(C[C@H](C)NC[C@H](O)c2ccccc2)c1	ZINC000819111139	CH	On-Demand	Anodyne	ADRB1	39	60
Cc1cc(C)cc(C[C@H](C)NC[C@H](O)c2ccccc2)c1	ZINC000819111139	CH	On-Demand	Anodyne	ADRB3	84	60
Cc1cc(C)cc(C[C@H](C)NC[C@H](O)c2ccccc2)c1	ZINC000819111139	CH	On-Demand	Anodyne	AOC3	15	44
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819111140	GD	On-Demand	Anodyne	CCR3	34	47
Cc1cc(C)cc(C[C@H](C)NC[C@@H](O)c2ccccc2)c1	ZINC000819111141	CH	On-Demand	Anodyne	ADRB2	57	44
Cc1cc(C)cc(C[C@H](C)NC[C@@H](O)c2ccccc2)c1	ZINC000819111141	CH	On-Demand	Anodyne	ADRB1	39	60
Cc1cc(C)cc(C[C@H](C)NC[C@@H](O)c2ccccc2)c1	ZINC000819111141	CH	On-Demand	Anodyne	ADRB3	84	60
Cc1cc(C)cc(C[C@H](C)NC[C@@H](O)c2ccccc2)c1	ZINC000819111141	CH	On-Demand	Anodyne	AOC3	15	44
Cc1cc(C)cc(C[C@@H](C)NC[C@@H](O)c2ccccc2)c1	ZINC000819111142	CH	On-Demand	Anodyne	ADRB2	57	44
Cc1cc(C)cc(C[C@@H](C)NC[C@@H](O)c2ccccc2)c1	ZINC000819111142	CH	On-Demand	Anodyne	ADRB1	39	60
Cc1cc(C)cc(C[C@@H](C)NC[C@@H](O)c2ccccc2)c1	ZINC000819111142	CH	On-Demand	Anodyne	ADRB3	84	60
Cc1cc(C)cc(C[C@@H](C)NC[C@@H](O)c2ccccc2)c1	ZINC000819111142	CH	On-Demand	Anodyne	AOC3	15	44
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819111143	GD	On-Demand	Anodyne	CCR3	34	47
C[C@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1cccc(F)c1	ZINC000819111144	FE	On-Demand	Anodyne	ADRB3	52	38
C[C@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1cccc(F)c1	ZINC000819111146	FE	On-Demand	Anodyne	ADRB3	52	38
C[C@@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1cccc(F)c1	ZINC000819111148	FE	On-Demand	Anodyne	ADRB3	52	38
C[C@@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1cccc(F)c1	ZINC000819111150	FE	On-Demand	Anodyne	ADRB3	52	38
NC(=O)[C@H](NC(=O)NCCCC(=O)O)c1ccccc1	ZINC000819111152	CC	On-Demand	Anodyne	FOLH1	31	42
NC(=O)[C@H](NC(=O)NCCCC(=O)O)c1ccccc1	ZINC000819111152	CC	On-Demand	Anodyne	MME	18	43
NC(=O)[C@H](NC(=O)NCCCC(=O)O)c1ccccc1	ZINC000819111152	CC	On-Demand	Anodyne	NPFFR2	50	40
NC(=O)[C@H](NC(=O)NCCCC(=O)O)c1ccccc1	ZINC000819111152	CC	On-Demand	Anodyne	C3AR1	68	41
NC(=O)[C@H](NC(=O)NCCCC(=O)O)c1ccccc1	ZINC000819111152	CC	On-Demand	Anodyne	NAALAD2	25	48
NC(=O)[C@H](NC(=O)NCCCC(=O)O)c1ccccc1	ZINC000819111152	CC	On-Demand	Anodyne	FURIN	50	34
NC(=O)[C@H](NC(=O)NCCCC(=O)O)c1ccccc1	ZINC000819111152	CC	On-Demand	Anodyne	POLG_WNV	68	33
NC(=O)[C@H](NC(=O)NCCCC(=O)O)c1ccccc1	ZINC000819111152	CC	On-Demand	Anodyne	NPFFR1	71	40
NC(=O)[C@@H](NC(=O)NCCCC(=O)O)c1ccccc1	ZINC000819111154	CC	On-Demand	Anodyne	FOLH1	31	42
NC(=O)[C@@H](NC(=O)NCCCC(=O)O)c1ccccc1	ZINC000819111154	CC	On-Demand	Anodyne	MME	18	43
NC(=O)[C@@H](NC(=O)NCCCC(=O)O)c1ccccc1	ZINC000819111154	CC	On-Demand	Anodyne	NPFFR2	50	40
NC(=O)[C@@H](NC(=O)NCCCC(=O)O)c1ccccc1	ZINC000819111154	CC	On-Demand	Anodyne	C3AR1	68	41
NC(=O)[C@@H](NC(=O)NCCCC(=O)O)c1ccccc1	ZINC000819111154	CC	On-Demand	Anodyne	NAALAD2	25	48
NC(=O)[C@@H](NC(=O)NCCCC(=O)O)c1ccccc1	ZINC000819111154	CC	On-Demand	Anodyne	FURIN	50	34
NC(=O)[C@@H](NC(=O)NCCCC(=O)O)c1ccccc1	ZINC000819111154	CC	On-Demand	Anodyne	POLG_WNV	68	33
NC(=O)[C@@H](NC(=O)NCCCC(=O)O)c1ccccc1	ZINC000819111154	CC	On-Demand	Anodyne	NPFFR1	71	40
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819111158	FG	On-Demand	Bother	ADRB2	23	42
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819111158	FG	On-Demand	Bother	ADRB3	32	42
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819111158	FG	On-Demand	Bother	COLA	106	41
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819111159	FG	On-Demand	Bother	ADRB2	23	42
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819111159	FG	On-Demand	Bother	ADRB3	32	42
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819111159	FG	On-Demand	Bother	COLA	106	41
CCS(=O)(=O)NC1CCN(C(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819111161	GC	On-Demand	Anodyne	CCR8	40	35
CCS(=O)(=O)NC1CCN(C(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819111161	GC	On-Demand	Anodyne	SFRP1	66	36
CCS(=O)(=O)NC1CCN(C(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819111161	GC	On-Demand	Anodyne	WNT3	68	35
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccc(F)cc3)C2=O)cc1	ZINC000819111170	FF	On-Demand	Anodyne	ADRB2	27	44
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccc(F)cc3)C2=O)cc1	ZINC000819111176	FF	On-Demand	Anodyne	ADRB2	27	44
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1c(F)cccc1F)c1ccccc1	ZINC000819111179	GH	On-Demand	Anodyne	PAPA1_CARPA	31	44
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1c(F)cccc1F)c1ccccc1	ZINC000819111179	GH	On-Demand	Anodyne	FPR1	41	35
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1c(F)cccc1F)c1ccccc1	ZINC000819111180	GH	On-Demand	Anodyne	PAPA1_CARPA	31	44
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1c(F)cccc1F)c1ccccc1	ZINC000819111180	GH	On-Demand	Anodyne	FPR1	41	35
NC(=O)C1CCC(NC(=O)Nc2cccc(CC(=O)O)c2)CC1	ZINC000819111183	DD	On-Demand	Anodyne	SIGMAR1	15	41
NC(=O)C1CCC(NC(=O)Nc2cccc(CC(=O)O)c2)CC1	ZINC000819111183	DD	On-Demand	Anodyne	NPY1R	28	48
NC(=O)C1CCC(NC(=O)Nc2cccc(CC(=O)O)c2)CC1	ZINC000819111183	DD	On-Demand	Anodyne	CCKBR	19	43
NC(=O)C1CCC(NC(=O)Nc2cccc(CC(=O)O)c2)CC1	ZINC000819111183	DD	On-Demand	Anodyne	EPHX2	45	45
CC(C)(C)OC(=O)N[C@@H](CNCCC(=O)NC(N)=O)c1ccccc1	ZINC000819111184	FD	On-Demand	Anodyne	FPR1	42	34
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CC[C@H](C(=O)O)C2)C1	ZINC000819111185	EB	On-Demand	Anodyne	SLC6A1	168	46
NC(=O)[C@H]1CCCN(CCCNC(=O)N2CC[C@@H](C(=O)O)C2)C1	ZINC000819111193	EB	On-Demand	Anodyne	SLC6A1	168	46
NC(=O)[C@H]1CCCN(CCCNC(=O)N2CC[C@H](C(=O)O)C2)C1	ZINC000819111195	EB	On-Demand	Anodyne	SLC6A1	168	46
NC(=O)[C@@H]1CCCN(CCCNC(=O)N2CC[C@@H](C(=O)O)C2)C1	ZINC000819111197	EB	On-Demand	Anodyne	SLC6A1	168	46
NC(=O)[C@H]1CCCN(CCCNC(=O)Nc2ccccc2CC(=O)O)C1	ZINC000819111199	FD	On-Demand	Anodyne	SLC6A1	171	46
NC(=O)[C@H]1CCCN(CCCNC(=O)Nc2ccccc2CC(=O)O)C1	ZINC000819111199	FD	On-Demand	Anodyne	CCR3	46	48
NC(=O)[C@@H]1CCCN(CCCNC(=O)Nc2ccccc2CC(=O)O)C1	ZINC000819111200	FD	On-Demand	Anodyne	SLC6A1	171	46
NC(=O)[C@@H]1CCCN(CCCNC(=O)Nc2ccccc2CC(=O)O)C1	ZINC000819111200	FD	On-Demand	Anodyne	CCR3	46	48
NC(=O)C1(c2ccccc2)CCN(C(=O)NCCC(=O)O)CC1	ZINC000819111201	DC	On-Demand	Anodyne	TACR2	15	42
NC(=O)C1(c2ccccc2)CCN(C(=O)NCCC(=O)O)CC1	ZINC000819111201	DC	On-Demand	Anodyne	EPHX2	15	44
NC(=O)[C@@H](c1ccc(F)cc1)N1CC[C@H](C(=O)O)C1	ZINC000819111205	CC	On-Demand	Anodyne	SLC6A1	63	40
NC(=O)[C@H](c1ccc(F)cc1)N1CC[C@@H](C(=O)O)C1	ZINC000819111206	CC	On-Demand	Anodyne	SLC6A1	63	40
NC(=O)[C@@H](c1ccc(F)cc1)N1CC[C@@H](C(=O)O)C1	ZINC000819111207	CC	On-Demand	Anodyne	SLC6A1	63	40
NC(=O)[C@H](c1ccc(F)cc1)N1CC[C@H](C(=O)O)C1	ZINC000819111208	CC	On-Demand	Anodyne	SLC6A1	63	40
N#Cc1ccccc1N1CCN(C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819111209	FF	On-Demand	Mild	KCNQ2	72	42
N#Cc1ccccc1N1CCN(C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819111209	FF	On-Demand	Mild	RBP4	24	41
N#Cc1ccccc1OCc1ccc(C(=O)N[C@H](C(=O)O)c2ccccc2)o1	ZINC000819111211	GG	On-Demand	Mild	ADRB1	42	33
NC(=O)[C@H]1CC(C(=O)N2CCC[C@@H]2C(=O)O)=NN1c1ccccc1	ZINC000819111215	EC	On-Demand	Anodyne	ACE	49	39
NC(=O)[C@H]1CC(C(=O)N2CCC[C@@H]2C(=O)O)=NN1c1ccccc1	ZINC000819111215	EC	On-Demand	Anodyne	TRHR	45	38
NC(=O)[C@H]1CC(C(=O)N2CCC[C@@H]2C(=O)O)=NN1c1ccccc1	ZINC000819111215	EC	On-Demand	Anodyne	PREP	75	37
NC(=O)[C@@H]1CC(C(=O)N2CCC[C@@H]2C(=O)O)=NN1c1ccccc1	ZINC000819111216	EC	On-Demand	Anodyne	ACE	49	39
NC(=O)[C@@H]1CC(C(=O)N2CCC[C@@H]2C(=O)O)=NN1c1ccccc1	ZINC000819111216	EC	On-Demand	Anodyne	TRHR	45	38
NC(=O)[C@@H]1CC(C(=O)N2CCC[C@@H]2C(=O)O)=NN1c1ccccc1	ZINC000819111216	EC	On-Demand	Anodyne	PREP	75	37
NC(=O)[C@H]1CC(C(=O)N2CCC[C@H]2C(=O)O)=NN1c1ccccc1	ZINC000819111217	EC	On-Demand	Anodyne	ACE	49	39
NC(=O)[C@H]1CC(C(=O)N2CCC[C@H]2C(=O)O)=NN1c1ccccc1	ZINC000819111217	EC	On-Demand	Anodyne	TRHR	45	38
NC(=O)[C@H]1CC(C(=O)N2CCC[C@H]2C(=O)O)=NN1c1ccccc1	ZINC000819111217	EC	On-Demand	Anodyne	PREP	75	37
NC(=O)[C@@H]1CC(C(=O)N2CCC[C@H]2C(=O)O)=NN1c1ccccc1	ZINC000819111218	EC	On-Demand	Anodyne	ACE	49	39
NC(=O)[C@@H]1CC(C(=O)N2CCC[C@H]2C(=O)O)=NN1c1ccccc1	ZINC000819111218	EC	On-Demand	Anodyne	TRHR	45	38
NC(=O)[C@@H]1CC(C(=O)N2CCC[C@H]2C(=O)O)=NN1c1ccccc1	ZINC000819111218	EC	On-Demand	Anodyne	PREP	75	37
N#Cc1ccccc1OCC(=O)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819111219	FD	On-Demand	Reactive	ADRB1	47	42
N#Cc1ccccc1OCC(=O)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819111219	FD	On-Demand	Reactive	UL80	24	40
NC(=O)[C@@H]1CCC[C@@H](NC(=O)NCCCCCC(=O)O)C1	ZINC000819111226	CC	On-Demand	Anodyne	EPHX2	30	50
CN1CCC(CNC[C@H](O)c2ccccc2C(F)(F)F)(N2CCCCC2)CC1	ZINC000819111228	GG	On-Demand	Anodyne	HCN1	65	38
CN1CCC(CNC[C@H](O)c2ccccc2C(F)(F)F)(N2CCCCC2)CC1	ZINC000819111228	GG	On-Demand	Anodyne	HCN4	50	32
CN1CCC(CNC[C@@H](O)c2ccccc2C(F)(F)F)(N2CCCCC2)CC1	ZINC000819111229	GG	On-Demand	Anodyne	HCN1	65	38
CN1CCC(CNC[C@@H](O)c2ccccc2C(F)(F)F)(N2CCCCC2)CC1	ZINC000819111229	GG	On-Demand	Anodyne	HCN4	50	32
NC(=O)[C@@H]1CCC[C@H](NC(=O)NCCCCCC(=O)O)C1	ZINC000819111230	CC	On-Demand	Anodyne	EPHX2	30	50
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1cccc(F)c1	ZINC000819111231	DH	On-Demand	Anodyne	ADRB2	18	47
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1cccc(F)c1	ZINC000819111231	DH	On-Demand	Anodyne	ADRB1	43	51
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1cccc(F)c1	ZINC000819111231	DH	On-Demand	Anodyne	ADRB3	63	51
NC(=O)[C@H]1CCC[C@H](NC(=O)NCCCCCC(=O)O)C1	ZINC000819111232	CC	On-Demand	Anodyne	EPHX2	30	50
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1cccc(F)c1	ZINC000819111233	DH	On-Demand	Anodyne	ADRB2	18	47
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1cccc(F)c1	ZINC000819111233	DH	On-Demand	Anodyne	ADRB1	43	51
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1cccc(F)c1	ZINC000819111233	DH	On-Demand	Anodyne	ADRB3	63	51
NC(=O)[C@H]1CCC[C@@H](NC(=O)NCCCCCC(=O)O)C1	ZINC000819111234	CC	On-Demand	Anodyne	EPHX2	30	50
N#Cc1cccnc1NCCNC(=O)NCCCC(=O)O	ZINC000819111235	CC	On-Demand	Mild	ADRB1	42	32
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1cccc(F)c1	ZINC000819111236	DH	On-Demand	Anodyne	ADRB2	18	47
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1cccc(F)c1	ZINC000819111236	DH	On-Demand	Anodyne	ADRB1	43	51
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1cccc(F)c1	ZINC000819111236	DH	On-Demand	Anodyne	ADRB3	63	51
N#Cc1cccnc1N1CCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000819111237	DD	On-Demand	Mild	HTR1A	21	43
N#Cc1cccnc1N1CCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000819111237	DD	On-Demand	Mild	DRD2	22	48
N#Cc1cccnc1N1CCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000819111237	DD	On-Demand	Mild	DRD4	52	56
N#Cc1cccnc1N1CCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000819111237	DD	On-Demand	Mild	DRD3	15	41
N#Cc1cccnc1N1CCN(Cc2ccc(C(=O)O)cc2)CC1	ZINC000819111237	DD	On-Demand	Mild	FAAH	15	41
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1cccc(F)c1	ZINC000819111238	DH	On-Demand	Anodyne	ADRB2	18	47
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1cccc(F)c1	ZINC000819111238	DH	On-Demand	Anodyne	ADRB1	43	51
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1cccc(F)c1	ZINC000819111238	DH	On-Demand	Anodyne	ADRB3	63	51
C[C@H](CNC[C@H](O)c1ccc([N+](=O)[O-])cc1)Oc1cccc(F)c1	ZINC000819111239	EF	On-Demand	Bother	ADRB1	19	40
C[C@@H](CNC[C@H](O)c1ccc([N+](=O)[O-])cc1)Oc1cccc(F)c1	ZINC000819111240	EF	On-Demand	Bother	ADRB1	19	40
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NCC(=O)O)c1	ZINC000819111241	DC	On-Demand	Anodyne	HRH2	28	41
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NCC(=O)O)c1	ZINC000819111241	DC	On-Demand	Anodyne	CCR3	58	41
C[C@H](CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)Oc1cccc(F)c1	ZINC000819111242	EF	On-Demand	Bother	ADRB1	19	40
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NCC(=O)O)c1	ZINC000819111243	DC	On-Demand	Anodyne	HRH2	28	41
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NCC(=O)O)c1	ZINC000819111243	DC	On-Demand	Anodyne	CCR3	58	41
C[C@@H](CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)Oc1cccc(F)c1	ZINC000819111244	EF	On-Demand	Bother	ADRB1	19	40
NC(=O)C1CCC(NC(=O)NCCCCCC(=O)O)CC1	ZINC000819111258	CC	On-Demand	Anodyne	EPHX2	28	50
N#Cc1ccccc1Oc1ccc(NC(=O)N2CCO[C@H](C(=O)O)C2)cc1F	ZINC000819111260	GF	On-Demand	Mild	ADRB1	40	33
N#Cc1ccccc1Oc1ccc(NC(=O)N2CCO[C@H](C(=O)O)C2)cc1F	ZINC000819111260	GF	On-Demand	Mild	MET	44	37
N#Cc1ccccc1Oc1ccc(NC(=O)N2CCO[C@H](C(=O)O)C2)cc1F	ZINC000819111260	GF	On-Demand	Mild	EZH2	28	45
N#Cc1ccccc1Oc1ccc(NC(=O)N2CCO[C@@H](C(=O)O)C2)cc1F	ZINC000819111273	GF	On-Demand	Mild	ADRB1	40	33
N#Cc1ccccc1Oc1ccc(NC(=O)N2CCO[C@@H](C(=O)O)C2)cc1F	ZINC000819111273	GF	On-Demand	Mild	MET	44	37
N#Cc1ccccc1Oc1ccc(NC(=O)N2CCO[C@@H](C(=O)O)C2)cc1F	ZINC000819111273	GF	On-Demand	Mild	EZH2	28	45
NC(=O)[C@@H]1CCC[C@H](NC(=O)Nc2ccccc2CC(=O)O)C1	ZINC000819111279	DD	On-Demand	Anodyne	CXCL8	28	40
NC(=O)[C@@H]1CCC[C@H](NC(=O)Nc2ccccc2CC(=O)O)C1	ZINC000819111279	DD	On-Demand	Anodyne	EPHX2	17	45
NC(=O)[C@H]1CCC[C@@H](NC(=O)Nc2ccccc2CC(=O)O)C1	ZINC000819111281	DD	On-Demand	Anodyne	CXCL8	28	40
NC(=O)[C@H]1CCC[C@@H](NC(=O)Nc2ccccc2CC(=O)O)C1	ZINC000819111281	DD	On-Demand	Anodyne	EPHX2	17	45
CN1CCC(CNC[C@H](O)c2ccccc2)(N2CCCCC2)CC1	ZINC000819111282	EE	On-Demand	Anodyne	HCN1	77	41
CN1CCC(CNC[C@H](O)c2ccccc2)(N2CCCCC2)CC1	ZINC000819111282	EE	On-Demand	Anodyne	HCN4	53	35
NC(=O)[C@H]1CCC[C@H](NC(=O)Nc2ccccc2CC(=O)O)C1	ZINC000819111283	DD	On-Demand	Anodyne	CXCL8	28	40
NC(=O)[C@H]1CCC[C@H](NC(=O)Nc2ccccc2CC(=O)O)C1	ZINC000819111283	DD	On-Demand	Anodyne	EPHX2	17	45
CN1CCC(CNC[C@@H](O)c2ccccc2)(N2CCCCC2)CC1	ZINC000819111284	EE	On-Demand	Anodyne	HCN1	77	41
CN1CCC(CNC[C@@H](O)c2ccccc2)(N2CCCCC2)CC1	ZINC000819111284	EE	On-Demand	Anodyne	HCN4	53	35
NC(=O)[C@@H]1CCC[C@@H](NC(=O)Nc2ccccc2CC(=O)O)C1	ZINC000819111285	DD	On-Demand	Anodyne	CXCL8	28	40
NC(=O)[C@@H]1CCC[C@@H](NC(=O)Nc2ccccc2CC(=O)O)C1	ZINC000819111285	DD	On-Demand	Anodyne	EPHX2	17	45
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccccc1F)c1ccccc1	ZINC000819111287	FH	On-Demand	Anodyne	PAPA1_CARPA	33	46
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccccc1F)c1ccccc1	ZINC000819111287	FH	On-Demand	Anodyne	SOAT1	20	56
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccccc1F)c1ccccc1	ZINC000819111287	FH	On-Demand	Anodyne	FPR1	44	37
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccccc1F)c1ccccc1	ZINC000819111287	FH	On-Demand	Anodyne	CTSA	45	32
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccccc1F)c1ccccc1	ZINC000819111289	FH	On-Demand	Anodyne	PAPA1_CARPA	33	46
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccccc1F)c1ccccc1	ZINC000819111289	FH	On-Demand	Anodyne	SOAT1	20	56
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccccc1F)c1ccccc1	ZINC000819111289	FH	On-Demand	Anodyne	FPR1	44	37
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccccc1F)c1ccccc1	ZINC000819111289	FH	On-Demand	Anodyne	CTSA	45	32
N#Cc1ccccc1Oc1ccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819111290	GE	On-Demand	Mild	DHODH	22	46
N#Cc1ccccc1Oc1ccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819111292	GE	On-Demand	Mild	DHODH	22	46
NC(=O)[C@@H]1CCCC[C@H]1NC(=O)Nc1cccc(CC(=O)O)c1	ZINC000819111296	DD	On-Demand	Anodyne	CCR3	35	46
NC(=O)[C@@H]1CCCC[C@H]1NC(=O)Nc1cccc(CC(=O)O)c1	ZINC000819111296	DD	On-Demand	Anodyne	CCKBR	18	41
NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)Nc1cccc(CC(=O)O)c1	ZINC000819111298	DD	On-Demand	Anodyne	CCR3	35	46
NC(=O)[C@@H]1CCCC[C@@H]1NC(=O)Nc1cccc(CC(=O)O)c1	ZINC000819111298	DD	On-Demand	Anodyne	CCKBR	18	41
NC(=O)[C@H]1CCCC[C@H]1NC(=O)Nc1cccc(CC(=O)O)c1	ZINC000819111300	DD	On-Demand	Anodyne	CCR3	35	46
NC(=O)[C@H]1CCCC[C@H]1NC(=O)Nc1cccc(CC(=O)O)c1	ZINC000819111300	DD	On-Demand	Anodyne	CCKBR	18	41
NC(=O)[C@H]1CCCC[C@@H]1NC(=O)Nc1cccc(CC(=O)O)c1	ZINC000819111301	DD	On-Demand	Anodyne	CCR3	35	46
NC(=O)[C@H]1CCCC[C@@H]1NC(=O)Nc1cccc(CC(=O)O)c1	ZINC000819111301	DD	On-Demand	Anodyne	CCKBR	18	41
N#Cc1cccnc1NCCNC(=O)NCCC(=O)O	ZINC000819111313	CC	On-Demand	Mild	ADRB1	43	32
NC(=NOCc1ccc(C(=O)O)cc1)c1ccc(N2CCC(O)CC2)cc1	ZINC000819111315	FE	On-Demand	Mild	SLC12A5	44	31
Cc1cc(C)cc(C[C@H](C)NC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819111316	DG	On-Demand	Mild	ADRB2	43	36
Cc1cc(C)cc(C[C@H](C)NC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819111316	DG	On-Demand	Mild	ADRB1	17	43
Cc1cc(C)cc(C[C@H](C)NC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819111318	DG	On-Demand	Mild	ADRB2	43	36
Cc1cc(C)cc(C[C@H](C)NC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819111318	DG	On-Demand	Mild	ADRB1	17	43
Cc1cc(C)cc(C[C@@H](C)NC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819111320	DG	On-Demand	Mild	ADRB2	43	36
Cc1cc(C)cc(C[C@@H](C)NC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819111320	DG	On-Demand	Mild	ADRB1	17	43
Cc1cc(C)cc(C[C@@H](C)NC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819111322	DG	On-Demand	Mild	ADRB2	43	36
Cc1cc(C)cc(C[C@@H](C)NC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819111322	DG	On-Demand	Mild	ADRB1	17	43
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819111327	FG	On-Demand	Bother	ADRB2	32	40
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819111327	FG	On-Demand	Bother	ADRB3	41	47
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819111327	FG	On-Demand	Bother	COLA	90	37
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819111329	FG	On-Demand	Bother	ADRB2	32	40
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819111329	FG	On-Demand	Bother	ADRB3	41	47
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819111329	FG	On-Demand	Bother	COLA	90	37
NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)NCCC(=O)O)c2)C1	ZINC000819111330	FC	On-Demand	Anodyne	HRH2	34	48
NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)NCCC(=O)O)c2)C1	ZINC000819111330	FC	On-Demand	Anodyne	SLC6A1	121	34
NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)NCCC(=O)O)c2)C1	ZINC000819111330	FC	On-Demand	Anodyne	NPFFR1	44	38
Cc1cc(C)cc(C[C@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819111331	FF	On-Demand	Anodyne	ADRB2	50	41
Cc1cc(C)cc(C[C@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819111331	FF	On-Demand	Anodyne	ADRB1	29	44
Cc1cc(C)cc(C[C@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819111331	FF	On-Demand	Anodyne	ADRB3	55	44
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)NCCC(=O)O)c2)C1	ZINC000819111332	FC	On-Demand	Anodyne	HRH2	34	48
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)NCCC(=O)O)c2)C1	ZINC000819111332	FC	On-Demand	Anodyne	SLC6A1	121	34
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)NCCC(=O)O)c2)C1	ZINC000819111332	FC	On-Demand	Anodyne	NPFFR1	44	38
Cc1cc(C)cc(C[C@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819111334	FF	On-Demand	Anodyne	ADRB2	50	41
Cc1cc(C)cc(C[C@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819111334	FF	On-Demand	Anodyne	ADRB1	29	44
Cc1cc(C)cc(C[C@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819111334	FF	On-Demand	Anodyne	ADRB3	55	44
Cc1cc(C)cc(C[C@@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819111336	FF	On-Demand	Anodyne	ADRB2	50	41
Cc1cc(C)cc(C[C@@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819111336	FF	On-Demand	Anodyne	ADRB1	29	44
Cc1cc(C)cc(C[C@@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819111336	FF	On-Demand	Anodyne	ADRB3	55	44
Cc1cc(C)cc(C[C@@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819111337	FF	On-Demand	Anodyne	ADRB2	50	41
Cc1cc(C)cc(C[C@@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819111337	FF	On-Demand	Anodyne	ADRB1	29	44
Cc1cc(C)cc(C[C@@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819111337	FF	On-Demand	Anodyne	ADRB3	55	44
NC(=O)[C@@H]1CC[C@H](CNC(=O)NCc2ccc(C(=O)O)cc2)O1	ZINC000819111345	DC	On-Demand	Anodyne	PROC	50	34
NC(=O)[C@H]1CC[C@@H](CNC(=O)NCc2ccc(C(=O)O)cc2)O1	ZINC000819111347	DC	On-Demand	Anodyne	PROC	50	34
NC(=O)[C@@H]1CC[C@@H](CNC(=O)NCc2ccc(C(=O)O)cc2)O1	ZINC000819111349	DC	On-Demand	Anodyne	PROC	50	34
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccc(F)c(F)c1)c1ccccc1	ZINC000819111350	GH	On-Demand	Anodyne	PAPA1_CARPA	30	40
NC(=O)[C@H]1CC[C@H](CNC(=O)NCc2ccc(C(=O)O)cc2)O1	ZINC000819111351	DC	On-Demand	Anodyne	PROC	50	34
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccc(F)c(F)c1)c1ccccc1	ZINC000819111352	GH	On-Demand	Anodyne	PAPA1_CARPA	30	40
NC(=O)[C@H](c1ccccc1)N1CCN(C(=O)NCCCC(=O)O)CC1	ZINC000819111356	EC	On-Demand	Anodyne	NPFFR2	42	37
NC(=O)[C@H](c1ccccc1)N1CCN(C(=O)NCCCC(=O)O)CC1	ZINC000819111356	EC	On-Demand	Anodyne	C3AR1	50	37
NC(=O)[C@H](c1ccccc1)N1CCN(C(=O)NCCCC(=O)O)CC1	ZINC000819111356	EC	On-Demand	Anodyne	POLG_WNV	54	30
NC(=O)[C@H](c1ccccc1)N1CCN(C(=O)NCCCC(=O)O)CC1	ZINC000819111356	EC	On-Demand	Anodyne	NPFFR1	68	37
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819111357	GG	On-Demand	Bother	ADRB3	40	38
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819111357	GG	On-Demand	Bother	COLA	104	38
NC(=O)[C@@H](c1ccccc1)N1CCN(C(=O)NCCCC(=O)O)CC1	ZINC000819111358	EC	On-Demand	Anodyne	NPFFR2	42	37
NC(=O)[C@@H](c1ccccc1)N1CCN(C(=O)NCCCC(=O)O)CC1	ZINC000819111358	EC	On-Demand	Anodyne	C3AR1	50	37
NC(=O)[C@@H](c1ccccc1)N1CCN(C(=O)NCCCC(=O)O)CC1	ZINC000819111358	EC	On-Demand	Anodyne	POLG_WNV	54	30
NC(=O)[C@@H](c1ccccc1)N1CCN(C(=O)NCCCC(=O)O)CC1	ZINC000819111358	EC	On-Demand	Anodyne	NPFFR1	68	37
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819111359	GG	On-Demand	Bother	ADRB3	40	38
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819111359	GG	On-Demand	Bother	COLA	104	38
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819111370	EG	On-Demand	Bother	ADRB1	30	40
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819111370	EG	On-Demand	Bother	ADRB3	40	41
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819111370	EG	On-Demand	Bother	COLA	96	38
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819111371	EG	On-Demand	Bother	ADRB1	30	40
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819111371	EG	On-Demand	Bother	ADRB3	40	41
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819111371	EG	On-Demand	Bother	COLA	96	38
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccc(F)cc1)c1ccccc1	ZINC000819111372	GH	On-Demand	Anodyne	PGC	51	35
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccc(F)cc1)c1ccccc1	ZINC000819111372	GH	On-Demand	Anodyne	PAPA1_CARPA	37	51
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccc(F)cc1)c1ccccc1	ZINC000819111372	GH	On-Demand	Anodyne	CTSK	17	50
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccc(F)cc1)c1ccccc1	ZINC000819111372	GH	On-Demand	Anodyne	CTSL	15	51
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccc(F)cc1)c1ccccc1	ZINC000819111372	GH	On-Demand	Anodyne	REN	59	39
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccc(F)cc1)c1ccccc1	ZINC000819111372	GH	On-Demand	Anodyne	FPR1	51	40
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccc(F)cc1)c1ccccc1	ZINC000819111373	GH	On-Demand	Anodyne	PGC	51	35
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccc(F)cc1)c1ccccc1	ZINC000819111373	GH	On-Demand	Anodyne	PAPA1_CARPA	37	51
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccc(F)cc1)c1ccccc1	ZINC000819111373	GH	On-Demand	Anodyne	CTSK	17	50
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccc(F)cc1)c1ccccc1	ZINC000819111373	GH	On-Demand	Anodyne	CTSL	15	51
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccc(F)cc1)c1ccccc1	ZINC000819111373	GH	On-Demand	Anodyne	REN	59	39
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccc(F)cc1)c1ccccc1	ZINC000819111373	GH	On-Demand	Anodyne	FPR1	51	40
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccccc3F)C2=O)cc1	ZINC000819111379	FF	On-Demand	Anodyne	ADRB2	23	41
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccccc3F)C2=O)cc1	ZINC000819111383	FF	On-Demand	Anodyne	ADRB2	23	41
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccc(C#N)cc3)C2=O)cc1	ZINC000819111390	GE	On-Demand	Mild	ADRB2	20	42
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccc(C#N)cc3)C2=O)cc1	ZINC000819111391	GE	On-Demand	Mild	ADRB2	20	42
N#Cc1cnn(-c2ccccc2)c1NC(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819111395	ED	On-Demand	Mild	SLC6A1	72	35
N#Cc1cnn(-c2ccccc2)c1NC(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819111396	ED	On-Demand	Mild	SLC6A1	72	35
N#Cc1cnc2c(F)cc(F)cc2c1NCCC(=O)O	ZINC000819111402	CE	On-Demand	Mild	MAP3K8	107	46
N#Cc1cccnc1N1CCN(C(=O)NCCC(=O)O)CC1	ZINC000819111403	DC	On-Demand	Mild	P2RY12	29	45
N#Cc1ccccc1Oc1ccc(NC(=O)NCCCC(=O)O)cc1F	ZINC000819111404	FG	On-Demand	Mild	ADRB1	58	47
N#Cc1ccccc1Oc1ccc(NC(=O)NCCCC(=O)O)cc1F	ZINC000819111404	FG	On-Demand	Mild	MET	52	38
N#Cc1ccccc1Oc1ccc(NC(=O)NCCCC(=O)O)cc1F	ZINC000819111404	FG	On-Demand	Mild	EZH2	28	44
N#Cc1ccccc1OCCN1CCC[C@H](CC(=O)O)C1	ZINC000819111405	CE	On-Demand	Mild	ADRB1	41	31
N#Cc1ccccc1OCCN1CCC[C@H](CC(=O)O)C1	ZINC000819111405	CE	On-Demand	Mild	SLC6A1	140	41
N#Cc1ccccc1OCCN1CCC[C@H](CC(=O)O)C1	ZINC000819111405	CE	On-Demand	Mild	LTA4H	25	44
N#Cc1ccccc1OCCN1CCC[C@@H](CC(=O)O)C1	ZINC000819111406	CE	On-Demand	Mild	ADRB1	41	31
N#Cc1ccccc1OCCN1CCC[C@@H](CC(=O)O)C1	ZINC000819111406	CE	On-Demand	Mild	SLC6A1	140	41
N#Cc1ccccc1OCCN1CCC[C@@H](CC(=O)O)C1	ZINC000819111406	CE	On-Demand	Mild	LTA4H	25	44
N#Cc1ccccc1NC(=S)Nc1ccccc1CC(=O)O	ZINC000819111407	DF	On-Demand	Mild	CXCL8	35	42
N=C(NOCc1ccc(C(=O)O)cc1)c1cccnc1	ZINC000819111410	CD	On-Demand	Anodyne	TBXAS1	58	39
N=C(NOCc1ccc(C(=O)O)cc1)c1cccnc1	ZINC000819111410	CD	On-Demand	Anodyne	NAMPT	20	40
N#Cc1ccccc1Sc1ccccc1C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819111423	FG	On-Demand	Mild	SLC6A1	65	33
N#Cc1ccccc1Sc1ccccc1C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819111425	FG	On-Demand	Mild	SLC6A1	65	33
N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1F	ZINC000819111428	FG	On-Demand	Mild	ADRB1	41	34
N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1F	ZINC000819111428	FG	On-Demand	Mild	SLC6A1	41	32
N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1F	ZINC000819111428	FG	On-Demand	Mild	MET	67	39
N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1F	ZINC000819111428	FG	On-Demand	Mild	EZH2	28	44
N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1F	ZINC000819111431	FG	On-Demand	Mild	ADRB1	41	34
N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1F	ZINC000819111431	FG	On-Demand	Mild	SLC6A1	41	32
N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1F	ZINC000819111431	FG	On-Demand	Mild	MET	67	39
N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1F	ZINC000819111431	FG	On-Demand	Mild	EZH2	28	44
NC(=O)[C@H]1CC(C(=O)N2CCC[C@@H]2C(=O)O)=NN1c1ccc(F)cc1	ZINC000819111444	EC	On-Demand	Anodyne	TRHR	45	36
NC(=O)[C@@H]1CC(C(=O)N2CCC[C@@H]2C(=O)O)=NN1c1ccc(F)cc1	ZINC000819111445	EC	On-Demand	Anodyne	TRHR	45	36
NC(=O)[C@H]1CC(C(=O)N2CCC[C@H]2C(=O)O)=NN1c1ccc(F)cc1	ZINC000819111446	EC	On-Demand	Anodyne	TRHR	45	36
NC(=O)[C@@H]1CC(C(=O)N2CCC[C@H]2C(=O)O)=NN1c1ccc(F)cc1	ZINC000819111448	EC	On-Demand	Anodyne	TRHR	45	36
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccccc1Br	ZINC000819111449	FG	On-Demand	Bother	COLA	115	37
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccccc1Br	ZINC000819111450	FG	On-Demand	Bother	COLA	115	37
NC(=O)C1CCC(NC(=O)C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819111451	EC	On-Demand	Anodyne	CXCL8	29	40
N#Cc1ccnc(N2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)c1	ZINC000819111453	FD	On-Demand	Mild	SMO	16	40
N#Cc1ccccc1Sc1ccc(C(=O)N2CCC(C(=O)O)CC2)cc1	ZINC000819111459	FH	On-Demand	Mild	L3MBTL3	84	40
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(F)cc1Cl	ZINC000819111465	EG	On-Demand	Bother	COLA	96	38
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819111467	EG	On-Demand	Bother	COLA	96	38
CN1CCC(CNC[C@H](O)c2ccccc2Cl)(N2CCCCC2)CC1	ZINC000819111468	FF	On-Demand	Anodyne	HCN1	76	40
CN1CCC(CNC[C@H](O)c2ccccc2Cl)(N2CCCCC2)CC1	ZINC000819111468	FF	On-Demand	Anodyne	HCN4	53	34
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cc(F)ccc1F)c1ccccc1	ZINC000819111472	GH	On-Demand	Anodyne	PAPA1_CARPA	30	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cc(F)ccc1F)c1ccccc1	ZINC000819111472	GH	On-Demand	Anodyne	FPR1	41	37
N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819111473	FG	On-Demand	Mild	ADRB1	43	35
N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819111473	FG	On-Demand	Mild	PDGFRB	36	40
N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819111473	FG	On-Demand	Mild	LTA4H	26	41
N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819111473	FG	On-Demand	Mild	PFKFB3	51	38
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1cc(F)ccc1F)c1ccccc1	ZINC000819111474	GH	On-Demand	Anodyne	PAPA1_CARPA	30	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1cc(F)ccc1F)c1ccccc1	ZINC000819111474	GH	On-Demand	Anodyne	FPR1	41	37
N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819111475	FG	On-Demand	Mild	ADRB1	43	35
N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819111475	FG	On-Demand	Mild	PDGFRB	36	40
N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819111475	FG	On-Demand	Mild	LTA4H	26	41
N#Cc1ccccc1Oc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819111475	FG	On-Demand	Mild	PFKFB3	51	38
N#Cc1cnc2c(F)cc(F)cc2c1NCCCC(=O)O	ZINC000819111477	CF	On-Demand	Mild	MAP3K8	94	45
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)Cc3ccccc3)C2=O)cc1	ZINC000819111482	EF	On-Demand	Anodyne	ACE	47	40
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)Cc3ccccc3)C2=O)cc1	ZINC000819111482	EF	On-Demand	Anodyne	MME	35	40
Cc1ccc(N2CCC[C@@H](NC[C@H](O)Cc3ccccc3)C2=O)cc1	ZINC000819111483	EF	On-Demand	Anodyne	ACE	47	40
Cc1ccc(N2CCC[C@@H](NC[C@H](O)Cc3ccccc3)C2=O)cc1	ZINC000819111483	EF	On-Demand	Anodyne	MME	35	40
NC(=O)[C@@H](c1ccccc1)N1CC[C@@H](C(=O)O)C1	ZINC000819111486	BC	On-Demand	Anodyne	SLC6A1	99	45
NC(=O)[C@H](c1ccccc1)N1CC[C@@H](C(=O)O)C1	ZINC000819111487	BC	On-Demand	Anodyne	SLC6A1	99	45
NC(=O)[C@H](c1ccccc1)N1CC[C@H](C(=O)O)C1	ZINC000819111489	BC	On-Demand	Anodyne	SLC6A1	99	45
NC(=O)[C@@H](c1ccccc1)N1CC[C@H](C(=O)O)C1	ZINC000819111490	BC	On-Demand	Anodyne	SLC6A1	99	45
N#Cc1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1F	ZINC000819111496	EF	On-Demand	Mild	ADRB1	55	45
N#Cc1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1F	ZINC000819111496	EF	On-Demand	Mild	MET	70	39
N#Cc1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1F	ZINC000819111496	EF	On-Demand	Mild	EZH2	28	45
COc1ccc(OC)c([C@H](O)CNCc2cc(OC)nc3ccccc23)c1	ZINC000819111497	FG	On-Demand	Anodyne	METG	67	40
N#Cc1cccnc1NCCNC(=O)Nc1ccccc1CC(=O)O	ZINC000819111501	ED	On-Demand	Mild	ADRB1	47	36
N#Cc1csc(C(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819111511	CD	On-Demand	Mild	ACE	39	40
N#Cc1csc(C(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819111511	CD	On-Demand	Mild	PREP	40	41
N#Cc1csc(C(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819111513	CD	On-Demand	Mild	ACE	39	40
N#Cc1csc(C(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819111513	CD	On-Demand	Mild	PREP	40	41
N#Cc1ccsc1C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819111514	CD	On-Demand	Mild	SLC18A3	17	43
N#Cc1ccsc1C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819111514	CD	On-Demand	Mild	L3MBTL3	40	35
N#Cc1ccsc1C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819111516	CD	On-Demand	Mild	SLC18A3	17	43
N#Cc1ccsc1C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819111516	CD	On-Demand	Mild	L3MBTL3	40	35
N#Cc1ccccc1OCCN1CC[C@@H](C(=O)O)C1	ZINC000819111522	CD	On-Demand	Mild	ADRB1	41	32
N#Cc1ccccc1OCCN1CC[C@@H](C(=O)O)C1	ZINC000819111522	CD	On-Demand	Mild	HTR1A	18	41
N#Cc1ccccc1OCCN1CC[C@@H](C(=O)O)C1	ZINC000819111522	CD	On-Demand	Mild	DRD2	17	41
N#Cc1ccccc1OCCN1CC[C@@H](C(=O)O)C1	ZINC000819111522	CD	On-Demand	Mild	HRH2	24	43
N#Cc1ccccc1OCCN1CC[C@@H](C(=O)O)C1	ZINC000819111522	CD	On-Demand	Mild	HTR2A	16	41
N#Cc1ccccc1OCCN1CC[C@@H](C(=O)O)C1	ZINC000819111522	CD	On-Demand	Mild	SLC6A1	182	49
N#Cc1ccccc1OCCN1CC[C@@H](C(=O)O)C1	ZINC000819111522	CD	On-Demand	Mild	LTA4H	31	49
N#Cc1ccccc1OCCN1CC[C@@H](C(=O)O)C1	ZINC000819111522	CD	On-Demand	Mild	HTR7	20	42
N#Cc1ccccc1OCCN1CC[C@@H](C(=O)O)C1	ZINC000819111522	CD	On-Demand	Mild	CYP2J2	45	32
N#Cc1ccccc1OCCN1CC[C@H](C(=O)O)C1	ZINC000819111524	CD	On-Demand	Mild	ADRB1	41	32
N#Cc1ccccc1OCCN1CC[C@H](C(=O)O)C1	ZINC000819111524	CD	On-Demand	Mild	HTR1A	18	41
N#Cc1ccccc1OCCN1CC[C@H](C(=O)O)C1	ZINC000819111524	CD	On-Demand	Mild	DRD2	17	41
N#Cc1ccccc1OCCN1CC[C@H](C(=O)O)C1	ZINC000819111524	CD	On-Demand	Mild	HRH2	24	43
N#Cc1ccccc1OCCN1CC[C@H](C(=O)O)C1	ZINC000819111524	CD	On-Demand	Mild	HTR2A	16	41
N#Cc1ccccc1OCCN1CC[C@H](C(=O)O)C1	ZINC000819111524	CD	On-Demand	Mild	SLC6A1	182	49
N#Cc1ccccc1OCCN1CC[C@H](C(=O)O)C1	ZINC000819111524	CD	On-Demand	Mild	LTA4H	31	49
N#Cc1ccccc1OCCN1CC[C@H](C(=O)O)C1	ZINC000819111524	CD	On-Demand	Mild	HTR7	20	42
N#Cc1ccccc1OCCN1CC[C@H](C(=O)O)C1	ZINC000819111524	CD	On-Demand	Mild	CYP2J2	45	32
NC(=O)C1CCC(NC(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819111530	DD	On-Demand	Anodyne	CXCL8	30	42
N#Cc1ccccc1Oc1ccc(NC(=O)C(=O)NCCC(=O)O)cc1F	ZINC000819111532	FE	On-Demand	Mild	ADRB1	49	39
N#Cc1ccccc1Oc1ccc(NC(=O)C(=O)NCCC(=O)O)cc1F	ZINC000819111532	FE	On-Demand	Mild	MET	55	38
N#Cc1ccccc1Oc1ccc(NC(=O)C(=O)NCCC(=O)O)cc1F	ZINC000819111532	FE	On-Demand	Mild	EZH2	28	45
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccc(F)cc1F)c1ccccc1	ZINC000819111540	GH	On-Demand	Anodyne	PAPA1_CARPA	30	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccc(F)cc1F)c1ccccc1	ZINC000819111540	GH	On-Demand	Anodyne	FPR1	41	36
NC(=O)[C@@H]1CC(C(=O)NCc2ccc(C(=O)O)cc2)=NN1c1ccccc1	ZINC000819111541	FD	On-Demand	Anodyne	NAMPT	36	40
NC(=O)[C@@H]1CC(C(=O)NCc2ccc(C(=O)O)cc2)=NN1c1ccccc1	ZINC000819111541	FD	On-Demand	Anodyne	TMPRSS11D	59	33
NC(=O)[C@H]1CC(C(=O)NCc2ccc(C(=O)O)cc2)=NN1c1ccccc1	ZINC000819111542	FD	On-Demand	Anodyne	NAMPT	36	40
NC(=O)[C@H]1CC(C(=O)NCc2ccc(C(=O)O)cc2)=NN1c1ccccc1	ZINC000819111542	FD	On-Demand	Anodyne	TMPRSS11D	59	33
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	ACE	44	43
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	OPRM1	54	46
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	OPRD1	45	46
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	MME	138	56
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	ANPEP	103	41
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	TACR1	20	60
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	CXCL8	40	43
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	MC4R	36	41
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	FCER2	109	46
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	CASP3	16	42
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	CTSB	40	44
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	PAPA1_CARPA	52	39
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	CYSP_TRYCR	55	37
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	CCKAR	69	41
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	CTSL	43	47
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	CPA1	59	41
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	NPFFR2	78	45
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	TIMP3	78	38
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	NAALAD2	34	48
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	MC3R	58	41
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	MC5R	63	35
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	CAPNS1	61	34
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	MMP2	20	45
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	MMP3	27	46
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	HLA-DRB1	82	42
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	MMP11	74	36
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	CCKBR	42	43
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	CAPN1	72	44
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	MMP9	27	62
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	CAPN2	53	42
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	ACE2	72	40
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	MC1R	81	41
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	LAP3	59	38
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	MMP1	34	62
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	FPR1	70	46
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	BLA1_STEMA	78	44
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	KISS1R	64	32
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	QRFPR	54	39
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	NPFFR1	85	48
NC(=O)[C@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111543	ED	On-Demand	Anodyne	GPR142	58	35
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccc(F)cc1F)c1ccccc1	ZINC000819111544	GH	On-Demand	Anodyne	PAPA1_CARPA	30	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccc(F)cc1F)c1ccccc1	ZINC000819111544	GH	On-Demand	Anodyne	FPR1	41	36
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	ACE	44	43
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	OPRM1	54	46
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	OPRD1	45	46
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	MME	138	56
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	ANPEP	103	41
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	TACR1	20	60
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	CXCL8	40	43
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	MC4R	36	41
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	FCER2	109	46
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	CASP3	16	42
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	CTSB	40	44
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	PAPA1_CARPA	52	39
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	CYSP_TRYCR	55	37
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	CCKAR	69	41
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	CTSL	43	47
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	CPA1	59	41
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	NPFFR2	78	45
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	TIMP3	78	38
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	NAALAD2	34	48
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	MC3R	58	41
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	MC5R	63	35
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	CAPNS1	61	34
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	MMP2	20	45
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	MMP3	27	46
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	HLA-DRB1	82	42
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	MMP11	74	36
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	CCKBR	42	43
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	CAPN1	72	44
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	MMP9	27	62
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	CAPN2	53	42
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	ACE2	72	40
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	MC1R	81	41
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	LAP3	59	38
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	MMP1	34	62
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	FPR1	70	46
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	BLA1_STEMA	78	44
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	KISS1R	64	32
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	QRFPR	54	39
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	NPFFR1	85	48
NC(=O)[C@@H](Cc1ccccc1)NC(=O)Nc1ccccc1CC(=O)O	ZINC000819111545	ED	On-Demand	Anodyne	GPR142	58	35
N#Cc1ccccc1Oc1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819111549	EG	On-Demand	Mild	ADRB1	62	51
N#Cc1ccccc1Oc1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819111549	EG	On-Demand	Mild	FOLH1	16	40
N#Cc1ccccc1Oc1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819111549	EG	On-Demand	Mild	LTA4H	33	48
N#Cc1ccccc1Oc1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819111549	EG	On-Demand	Mild	CA1	40	42
N#Cc1ccccc1Oc1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819111549	EG	On-Demand	Mild	CA12	17	44
N#Cc1ccccc1Oc1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819111549	EG	On-Demand	Mild	CA9	18	44
N#Cc1ccccc1Oc1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819111549	EG	On-Demand	Mild	NCE103	18	44
N#Cc1ccccc1Oc1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819111549	EG	On-Demand	Mild	PFKFB3	51	34
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819111567	FD	On-Demand	Anodyne	ACE	56	42
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819111567	FD	On-Demand	Anodyne	FKBP1A	26	50
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819111567	FD	On-Demand	Anodyne	CCR3	22	40
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819111567	FD	On-Demand	Anodyne	PREP	64	38
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819111568	FD	On-Demand	Anodyne	ACE	56	42
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819111568	FD	On-Demand	Anodyne	FKBP1A	26	50
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819111568	FD	On-Demand	Anodyne	CCR3	22	40
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819111568	FD	On-Demand	Anodyne	PREP	64	38
CC[C@@H](O)CNC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819111569	DF	On-Demand	Anodyne	PAPA1_CARPA	37	42
CC[C@@H](O)CNC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819111569	DF	On-Demand	Anodyne	CTSK	27	53
CC[C@@H](O)CNC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819111569	DF	On-Demand	Anodyne	TACR3	44	35
CC[C@@H](O)CNC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819111569	DF	On-Demand	Anodyne	SOAT1	19	56
CC[C@@H](O)CNC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819111569	DF	On-Demand	Anodyne	FPR1	45	37
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819111570	FD	On-Demand	Anodyne	ACE	56	42
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819111570	FD	On-Demand	Anodyne	FKBP1A	26	50
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819111570	FD	On-Demand	Anodyne	CCR3	22	40
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819111570	FD	On-Demand	Anodyne	PREP	64	38
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819111571	FD	On-Demand	Anodyne	ACE	56	42
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819111571	FD	On-Demand	Anodyne	FKBP1A	26	50
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819111571	FD	On-Demand	Anodyne	CCR3	22	40
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819111571	FD	On-Demand	Anodyne	PREP	64	38
CC[C@@H](O)CNC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819111572	DF	On-Demand	Anodyne	PAPA1_CARPA	37	42
CC[C@@H](O)CNC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819111572	DF	On-Demand	Anodyne	CTSK	27	53
CC[C@@H](O)CNC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819111572	DF	On-Demand	Anodyne	TACR3	44	35
CC[C@@H](O)CNC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819111572	DF	On-Demand	Anodyne	SOAT1	19	56
CC[C@@H](O)CNC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819111572	DF	On-Demand	Anodyne	FPR1	45	37
O=C(/C=C\[C@H]1CCCO1)N1CC=C(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819111600	EH	On-Demand	Anodyne	HTR1D	19	51
O=C(/C=C\[C@H]1CCCO1)N1CC=C(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819111600	EH	On-Demand	Anodyne	SLC6A4	17	51
O=C(/C=C\[C@@H]1CCCO1)N1CC=C(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819111601	EH	On-Demand	Anodyne	HTR1D	19	51
O=C(/C=C\[C@@H]1CCCO1)N1CC=C(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819111601	EH	On-Demand	Anodyne	SLC6A4	17	51
O=C(/C=C/[C@H]1CCCO1)N1CC=C(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819111602	EH	On-Demand	Anodyne	HTR1D	19	51
O=C(/C=C/[C@H]1CCCO1)N1CC=C(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819111602	EH	On-Demand	Anodyne	SLC6A4	17	51
O=C(/C=C/[C@@H]1CCCO1)N1CC=C(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819111604	EH	On-Demand	Anodyne	HTR1D	19	51
O=C(/C=C/[C@@H]1CCCO1)N1CC=C(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819111604	EH	On-Demand	Anodyne	SLC6A4	17	51
NC(=O)[C@H](CNC(=O)Nc1ccccc1CC(=O)O)Cc1ccc(F)cc1	ZINC000819111606	FD	On-Demand	Anodyne	MME	66	54
NC(=O)[C@H](CNC(=O)Nc1ccccc1CC(=O)O)Cc1ccc(F)cc1	ZINC000819111606	FD	On-Demand	Anodyne	ANPEP	76	35
NC(=O)[C@H](CNC(=O)Nc1ccccc1CC(=O)O)Cc1ccc(F)cc1	ZINC000819111606	FD	On-Demand	Anodyne	CXCL8	28	40
NC(=O)[C@H](CNC(=O)Nc1ccccc1CC(=O)O)Cc1ccc(F)cc1	ZINC000819111606	FD	On-Demand	Anodyne	CPA1	38	40
NC(=O)[C@H](CNC(=O)Nc1ccccc1CC(=O)O)Cc1ccc(F)cc1	ZINC000819111606	FD	On-Demand	Anodyne	AMP1_PLAFQ	21	41
NC(=O)[C@@H](CNC(=O)Nc1ccccc1CC(=O)O)Cc1ccc(F)cc1	ZINC000819111607	FD	On-Demand	Anodyne	MME	66	54
NC(=O)[C@@H](CNC(=O)Nc1ccccc1CC(=O)O)Cc1ccc(F)cc1	ZINC000819111607	FD	On-Demand	Anodyne	ANPEP	76	35
NC(=O)[C@@H](CNC(=O)Nc1ccccc1CC(=O)O)Cc1ccc(F)cc1	ZINC000819111607	FD	On-Demand	Anodyne	CXCL8	28	40
NC(=O)[C@@H](CNC(=O)Nc1ccccc1CC(=O)O)Cc1ccc(F)cc1	ZINC000819111607	FD	On-Demand	Anodyne	CPA1	38	40
NC(=O)[C@@H](CNC(=O)Nc1ccccc1CC(=O)O)Cc1ccc(F)cc1	ZINC000819111607	FD	On-Demand	Anodyne	AMP1_PLAFQ	21	41
C[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)C(=O)N1c1ccccc1	ZINC000819111623	EG	On-Demand	Anodyne	ADRB3	44	41
C[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)C(=O)N1c1ccccc1	ZINC000819111623	EG	On-Demand	Anodyne	CYP3A4	48	36
C[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)C(=O)N1c1ccccc1	ZINC000819111625	EG	On-Demand	Anodyne	ADRB3	44	41
C[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)C(=O)N1c1ccccc1	ZINC000819111625	EG	On-Demand	Anodyne	CYP3A4	48	36
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1cccc(Br)c1	ZINC000819111631	FG	On-Demand	Bother	ADRB2	34	41
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1cccc(Br)c1	ZINC000819111631	FG	On-Demand	Bother	ADRB1	37	40
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1cccc(Br)c1	ZINC000819111631	FG	On-Demand	Bother	ADRB3	63	43
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1cccc(Br)c1	ZINC000819111631	FG	On-Demand	Bother	COLA	113	37
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1cccc(Br)c1	ZINC000819111632	FG	On-Demand	Bother	ADRB2	34	41
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1cccc(Br)c1	ZINC000819111632	FG	On-Demand	Bother	ADRB1	37	40
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1cccc(Br)c1	ZINC000819111632	FG	On-Demand	Bother	ADRB3	63	43
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1cccc(Br)c1	ZINC000819111632	FG	On-Demand	Bother	COLA	113	37
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)C(C)(C)C)c1ccccc1	ZINC000819111647	EG	On-Demand	Anodyne	PAPA1_CARPA	37	43
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)C(C)(C)C)c1ccccc1	ZINC000819111647	EG	On-Demand	Anodyne	CTSK	19	54
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)C(C)(C)C)c1ccccc1	ZINC000819111647	EG	On-Demand	Anodyne	FPR1	45	38
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)C(C)(C)C)c1ccccc1	ZINC000819111649	EG	On-Demand	Anodyne	PAPA1_CARPA	37	43
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)C(C)(C)C)c1ccccc1	ZINC000819111649	EG	On-Demand	Anodyne	CTSK	19	54
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)C(C)(C)C)c1ccccc1	ZINC000819111649	EG	On-Demand	Anodyne	FPR1	45	38
CN1CCC(CNC[C@H](O)c2cc(F)ccc2F)(N2CCCCC2)CC1	ZINC000819111662	FF	On-Demand	Anodyne	HCN1	58	36
CN1CCC(CNC[C@H](O)c2cc(F)ccc2F)(N2CCCCC2)CC1	ZINC000819111662	FF	On-Demand	Anodyne	HCN4	48	31
CN1CCC(CNC[C@@H](O)c2cc(F)ccc2F)(N2CCCCC2)CC1	ZINC000819111663	FF	On-Demand	Anodyne	HCN1	58	36
CN1CCC(CNC[C@@H](O)c2cc(F)ccc2F)(N2CCCCC2)CC1	ZINC000819111663	FF	On-Demand	Anodyne	HCN4	48	31
O=[N+]([O-])c1cnn(C[C@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819111664	EC	On-Demand	Bother	COLA	64	33
O=[N+]([O-])c1cnn(C[C@@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819111665	EC	On-Demand	Bother	COLA	64	33
Cc1ccc(OC[C@@H](O)CNC2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)cc1	ZINC000819111668	GG	On-Demand	Anodyne	ADRB2	30	45
Cc1ccc(OC[C@@H](O)CNC2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)cc1	ZINC000819111668	GG	On-Demand	Anodyne	ADRB1	43	40
Cc1ccc(OC[C@@H](O)CNC2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)cc1	ZINC000819111668	GG	On-Demand	Anodyne	ADRB3	27	41
Cc1ccc(OC[C@H](O)CNC2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)cc1	ZINC000819111669	GG	On-Demand	Anodyne	ADRB2	30	45
Cc1ccc(OC[C@H](O)CNC2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)cc1	ZINC000819111669	GG	On-Demand	Anodyne	ADRB1	43	40
Cc1ccc(OC[C@H](O)CNC2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)cc1	ZINC000819111669	GG	On-Demand	Anodyne	ADRB3	27	41
Cc1ccc(CNC(=O)C2CCN(C(=O)C(F)=C3CCC3)CC2)cc1F	ZINC000819111680	FG	On-Demand	Anodyne	EPHX2	28	45
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccccc1Cl	ZINC000819111683	DG	On-Demand	Bother	COLA	107	36
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccc(CC#N)cc3)C2=O)cc1	ZINC000819111684	GF	On-Demand	Mild	ADRB2	23	41
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccc(CC#N)cc3)C2=O)cc1	ZINC000819111684	GF	On-Demand	Mild	ADRB1	31	41
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccc(CC#N)cc3)C2=O)cc1	ZINC000819111684	GF	On-Demand	Mild	ADRB3	19	41
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccc(CC#N)cc3)C2=O)cc1	ZINC000819111686	GF	On-Demand	Mild	ADRB2	23	41
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccc(CC#N)cc3)C2=O)cc1	ZINC000819111686	GF	On-Demand	Mild	ADRB1	31	41
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccc(CC#N)cc3)C2=O)cc1	ZINC000819111686	GF	On-Demand	Mild	ADRB3	19	41
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCc2ccccc2[N+](=O)[O-])CC1	ZINC000819111688	GF	On-Demand	Bother	COLA	53	35
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCc2ccccc2[N+](=O)[O-])CC1	ZINC000819111689	GF	On-Demand	Bother	COLA	53	35
CN1CCC(CNC[C@H](O)c2ccc(F)cc2F)(N2CCCCC2)CC1	ZINC000819111700	FF	On-Demand	Anodyne	HCN1	58	36
CN1CCC(CNC[C@H](O)c2ccc(F)cc2F)(N2CCCCC2)CC1	ZINC000819111700	FF	On-Demand	Anodyne	HCN4	48	31
CN1CCC(CNC[C@@H](O)c2ccc(F)cc2F)(N2CCCCC2)CC1	ZINC000819111701	FF	On-Demand	Anodyne	HCN1	58	36
CN1CCC(CNC[C@@H](O)c2ccc(F)cc2F)(N2CCCCC2)CC1	ZINC000819111701	FF	On-Demand	Anodyne	HCN4	48	31
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819111706	FE	On-Demand	Bother	ADRB2	46	58
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819111706	FE	On-Demand	Bother	ADRB1	73	58
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819111706	FE	On-Demand	Bother	ADRB3	47	58
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819111706	FE	On-Demand	Bother	COLA	87	39
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819111706	FE	On-Demand	Bother	ABCB1	15	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819111707	FE	On-Demand	Bother	ADRB2	46	58
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819111707	FE	On-Demand	Bother	ADRB1	73	58
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819111707	FE	On-Demand	Bother	ADRB3	47	58
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819111707	FE	On-Demand	Bother	COLA	87	39
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCc2ccccc2[N+](=O)[O-])c1	ZINC000819111707	FE	On-Demand	Bother	ABCB1	15	43
CN1CCC(CNC[C@H](O)c2cccc3ccccc23)(N2CCCCC2)CC1	ZINC000819111716	GG	On-Demand	Anodyne	HCN1	70	39
CN1CCC(CNC[C@H](O)c2cccc3ccccc23)(N2CCCCC2)CC1	ZINC000819111716	GG	On-Demand	Anodyne	HCN4	52	33
COC(=O)C1(NC(=O)c2cc(S(=O)(=O)Nc3ccccc3F)ccc2Cl)CCCCC1	ZINC000819111720	JH	On-Demand	Anodyne	PRTN3	45	32
COC(=O)C1(NC(=O)c2cc(S(=O)(=O)Nc3ccccc3F)ccc2Cl)CCCCC1	ZINC000819111720	JH	On-Demand	Anodyne	CCR2	15	40
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819111723	DF	On-Demand	Bother	ADRB3	52	40
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819111723	DF	On-Demand	Bother	COLA	100	38
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819111724	DF	On-Demand	Bother	ADRB3	52	40
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819111724	DF	On-Demand	Bother	COLA	100	38
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(F)c1	ZINC000819111745	CF	On-Demand	Anodyne	ADRB1	41	45
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(F)c1	ZINC000819111745	CF	On-Demand	Anodyne	ADRB3	56	48
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(F)c1	ZINC000819111745	CF	On-Demand	Anodyne	AOC3	20	40
C[C@H](CNC[C@H](O)c1ccccc1)Oc1cccc(F)c1	ZINC000819111746	CF	On-Demand	Anodyne	ADRB1	41	45
C[C@H](CNC[C@H](O)c1ccccc1)Oc1cccc(F)c1	ZINC000819111746	CF	On-Demand	Anodyne	ADRB3	56	48
C[C@H](CNC[C@H](O)c1ccccc1)Oc1cccc(F)c1	ZINC000819111746	CF	On-Demand	Anodyne	AOC3	20	40
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1cccc(F)c1	ZINC000819111747	CF	On-Demand	Anodyne	ADRB1	41	45
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1cccc(F)c1	ZINC000819111747	CF	On-Demand	Anodyne	ADRB3	56	48
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1cccc(F)c1	ZINC000819111747	CF	On-Demand	Anodyne	AOC3	20	40
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(F)c1	ZINC000819111748	CF	On-Demand	Anodyne	ADRB1	41	45
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(F)c1	ZINC000819111748	CF	On-Demand	Anodyne	ADRB3	56	48
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(F)c1	ZINC000819111748	CF	On-Demand	Anodyne	AOC3	20	40
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3cccc4[nH]ccc34)C2=O)cc1	ZINC000819111749	GG	On-Demand	Anodyne	ADRB2	20	59
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3cccc4[nH]ccc34)C2=O)cc1	ZINC000819111749	GG	On-Demand	Anodyne	ADRB1	27	59
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3cccc4[nH]ccc34)C2=O)cc1	ZINC000819111749	GG	On-Demand	Anodyne	HTR1A	16	59
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3cccc4[nH]ccc34)C2=O)cc1	ZINC000819111749	GG	On-Demand	Anodyne	SLC6A4	20	43
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3cccc4[nH]ccc34)C2=O)cc1	ZINC000819111752	GG	On-Demand	Anodyne	ADRB2	20	59
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3cccc4[nH]ccc34)C2=O)cc1	ZINC000819111752	GG	On-Demand	Anodyne	ADRB1	27	59
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3cccc4[nH]ccc34)C2=O)cc1	ZINC000819111752	GG	On-Demand	Anodyne	HTR1A	16	59
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3cccc4[nH]ccc34)C2=O)cc1	ZINC000819111752	GG	On-Demand	Anodyne	SLC6A4	20	43
CN1CCC(CNC[C@H](O)c2ccc(F)cc2)(N2CCCCC2)CC1	ZINC000819111761	EE	On-Demand	Anodyne	HCN1	59	38
CN1CCC(CNC[C@H](O)c2ccc(F)cc2)(N2CCCCC2)CC1	ZINC000819111761	EE	On-Demand	Anodyne	HCN4	48	32
CN1CCC(CNC[C@@H](O)c2ccc(F)cc2)(N2CCCCC2)CC1	ZINC000819111762	EE	On-Demand	Anodyne	HCN1	59	38
CN1CCC(CNC[C@@H](O)c2ccc(F)cc2)(N2CCCCC2)CC1	ZINC000819111762	EE	On-Demand	Anodyne	HCN4	48	32
CN1CCC(CNC[C@@H](O)c2c(F)cccc2F)(N2CCCCC2)CC1	ZINC000819111763	FF	On-Demand	Anodyne	HCN1	50	37
CN1CCC(CNC[C@H](O)c2c(F)cccc2F)(N2CCCCC2)CC1	ZINC000819111764	FF	On-Demand	Anodyne	HCN1	50	37
Cc1cc(C)cc(C[C@@H](C)NC[C@@H](O)c2cccnc2)c1	ZINC000819111773	CF	On-Demand	Anodyne	ADRB2	50	46
Cc1cc(C)cc(C[C@@H](C)NC[C@@H](O)c2cccnc2)c1	ZINC000819111773	CF	On-Demand	Anodyne	ADRB1	39	63
Cc1cc(C)cc(C[C@@H](C)NC[C@@H](O)c2cccnc2)c1	ZINC000819111773	CF	On-Demand	Anodyne	ADRB3	98	63
Cc1cc(C)cc(C[C@H](C)NC[C@@H](O)c2cccnc2)c1	ZINC000819111774	CF	On-Demand	Anodyne	ADRB2	50	46
Cc1cc(C)cc(C[C@H](C)NC[C@@H](O)c2cccnc2)c1	ZINC000819111774	CF	On-Demand	Anodyne	ADRB1	39	63
Cc1cc(C)cc(C[C@H](C)NC[C@@H](O)c2cccnc2)c1	ZINC000819111774	CF	On-Demand	Anodyne	ADRB3	98	63
Cc1cc(C)cc(C[C@@H](C)NC[C@H](O)c2cccnc2)c1	ZINC000819111775	CF	On-Demand	Anodyne	ADRB2	50	46
Cc1cc(C)cc(C[C@@H](C)NC[C@H](O)c2cccnc2)c1	ZINC000819111775	CF	On-Demand	Anodyne	ADRB1	39	63
Cc1cc(C)cc(C[C@@H](C)NC[C@H](O)c2cccnc2)c1	ZINC000819111775	CF	On-Demand	Anodyne	ADRB3	98	63
Cc1cc(C)cc(C[C@H](C)NC[C@H](O)c2cccnc2)c1	ZINC000819111776	CF	On-Demand	Anodyne	ADRB2	50	46
Cc1cc(C)cc(C[C@H](C)NC[C@H](O)c2cccnc2)c1	ZINC000819111776	CF	On-Demand	Anodyne	ADRB1	39	63
Cc1cc(C)cc(C[C@H](C)NC[C@H](O)c2cccnc2)c1	ZINC000819111776	CF	On-Demand	Anodyne	ADRB3	98	63
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(Br)cc1	ZINC000819111779	FG	On-Demand	Bother	ADRB3	40	40
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(Br)cc1	ZINC000819111779	FG	On-Demand	Bother	COLA	115	43
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(Br)cc1	ZINC000819111780	FG	On-Demand	Bother	ADRB3	40	40
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(Br)cc1	ZINC000819111780	FG	On-Demand	Bother	COLA	115	43
CN(C[C@@H](O)CNCCc1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000819111781	FD	On-Demand	Bother	COLA	121	41
CN(C[C@H](O)CNCCc1ccccc1[N+](=O)[O-])C(=O)OC(C)(C)C	ZINC000819111782	FD	On-Demand	Bother	COLA	121	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111802	FG	On-Demand	Anodyne	MME	53	37
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111802	FG	On-Demand	Anodyne	ANPEP	41	32
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111802	FG	On-Demand	Anodyne	CTSD	21	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111802	FG	On-Demand	Anodyne	PGC	55	39
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111802	FG	On-Demand	Anodyne	PAPA1_CARPA	62	52
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111802	FG	On-Demand	Anodyne	CTSK	28	58
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111802	FG	On-Demand	Anodyne	CTSL	27	52
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111802	FG	On-Demand	Anodyne	PGA	32	40
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111802	FG	On-Demand	Anodyne	TACR3	20	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111802	FG	On-Demand	Anodyne	CAPNS1	50	30
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111802	FG	On-Demand	Anodyne	SOAT1	16	55
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111802	FG	On-Demand	Anodyne	REN	72	44
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111802	FG	On-Demand	Anodyne	REN1	20	43
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111802	FG	On-Demand	Anodyne	CAPN1	53	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111802	FG	On-Demand	Anodyne	CAPN2	45	32
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111802	FG	On-Demand	Anodyne	FPR1	61	46
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111803	FG	On-Demand	Anodyne	MME	53	37
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111803	FG	On-Demand	Anodyne	ANPEP	41	32
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111803	FG	On-Demand	Anodyne	CTSD	21	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111803	FG	On-Demand	Anodyne	PGC	55	39
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111803	FG	On-Demand	Anodyne	PAPA1_CARPA	62	52
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111803	FG	On-Demand	Anodyne	CTSK	28	58
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111803	FG	On-Demand	Anodyne	CTSL	27	52
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111803	FG	On-Demand	Anodyne	PGA	32	40
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111803	FG	On-Demand	Anodyne	TACR3	20	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111803	FG	On-Demand	Anodyne	CAPNS1	50	30
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111803	FG	On-Demand	Anodyne	SOAT1	16	55
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111803	FG	On-Demand	Anodyne	REN	72	44
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111803	FG	On-Demand	Anodyne	REN1	20	43
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111803	FG	On-Demand	Anodyne	CAPN1	53	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111803	FG	On-Demand	Anodyne	CAPN2	45	32
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccccc1)c1ccccc1	ZINC000819111803	FG	On-Demand	Anodyne	FPR1	61	46
CN1CCC(CNC[C@H](O)c2ccc(Cl)cc2)(N2CCCCC2)CC1	ZINC000819111814	FF	On-Demand	Anodyne	HCN1	44	35
C[C@@](O)(CNCCc1ccccc1[N+](=O)[O-])c1ccc(Br)cc1F	ZINC000819111819	GH	On-Demand	Bother	COLA	112	37
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccccc2[N+](=O)[O-])cc1	ZINC000819111838	FD	On-Demand	Bother	ADRB2	46	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccccc2[N+](=O)[O-])cc1	ZINC000819111838	FD	On-Demand	Bother	ADRB3	92	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccccc2[N+](=O)[O-])cc1	ZINC000819111838	FD	On-Demand	Bother	COLA	128	43
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccccc2[N+](=O)[O-])cc1	ZINC000819111839	FD	On-Demand	Bother	ADRB2	46	43
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccccc2[N+](=O)[O-])cc1	ZINC000819111839	FD	On-Demand	Bother	ADRB3	92	40
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccccc2[N+](=O)[O-])cc1	ZINC000819111839	FD	On-Demand	Bother	COLA	128	43
C[C@@H](CNC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)Oc1cccc(F)c1	ZINC000819111841	GG	On-Demand	Anodyne	GPR119	23	47
C[C@H](CNC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)Oc1cccc(F)c1	ZINC000819111842	GG	On-Demand	Anodyne	GPR119	23	47
C[C@H](CNC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)Oc1cccc(F)c1	ZINC000819111843	GG	On-Demand	Anodyne	GPR119	23	47
C[C@@H](CNC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)Oc1cccc(F)c1	ZINC000819111844	GG	On-Demand	Anodyne	GPR119	23	47
CN1CCC(CNC[C@@H](O)c2cccnc2)(N2CCCCC2)CC1	ZINC000819111846	ED	On-Demand	Anodyne	ADRB3	82	46
CN1CCC(CNC[C@@H](O)c2cccnc2)(N2CCCCC2)CC1	ZINC000819111846	ED	On-Demand	Anodyne	HCN1	44	35
CN1CCC(CNC[C@H](O)c2cccnc2)(N2CCCCC2)CC1	ZINC000819111847	ED	On-Demand	Anodyne	ADRB3	82	46
CN1CCC(CNC[C@H](O)c2cccnc2)(N2CCCCC2)CC1	ZINC000819111847	ED	On-Demand	Anodyne	HCN1	44	35
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)C1CC1)c1ccccc1	ZINC000819111852	DF	On-Demand	Anodyne	PGC	50	32
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)C1CC1)c1ccccc1	ZINC000819111852	DF	On-Demand	Anodyne	PAPA1_CARPA	33	40
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)C1CC1)c1ccccc1	ZINC000819111852	DF	On-Demand	Anodyne	CTSK	16	50
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)C1CC1)c1ccccc1	ZINC000819111852	DF	On-Demand	Anodyne	REN	56	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)C1CC1)c1ccccc1	ZINC000819111852	DF	On-Demand	Anodyne	FPR1	46	39
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)C1CC1)c1ccccc1	ZINC000819111854	DF	On-Demand	Anodyne	PGC	50	32
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)C1CC1)c1ccccc1	ZINC000819111854	DF	On-Demand	Anodyne	PAPA1_CARPA	33	40
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)C1CC1)c1ccccc1	ZINC000819111854	DF	On-Demand	Anodyne	CTSK	16	50
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)C1CC1)c1ccccc1	ZINC000819111854	DF	On-Demand	Anodyne	REN	56	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)C1CC1)c1ccccc1	ZINC000819111854	DF	On-Demand	Anodyne	FPR1	46	39
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2=O)c1	ZINC000819111855	GF	On-Demand	Anodyne	ADRB2	20	42
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2=O)c1	ZINC000819111855	GF	On-Demand	Anodyne	ABCB1	20	45
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2=O)c1	ZINC000819111856	GF	On-Demand	Anodyne	ADRB2	20	42
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2=O)c1	ZINC000819111856	GF	On-Demand	Anodyne	ABCB1	20	45
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2=O)c1	ZINC000819111857	GF	On-Demand	Anodyne	ADRB2	20	42
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2=O)c1	ZINC000819111857	GF	On-Demand	Anodyne	ABCB1	20	45
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2=O)c1	ZINC000819111858	GF	On-Demand	Anodyne	ADRB2	20	42
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2=O)c1	ZINC000819111858	GF	On-Demand	Anodyne	ABCB1	20	45
C[C@H](CNC[C@H](O)c1ccc(Cl)cc1)Oc1cccc(F)c1	ZINC000819111863	DH	On-Demand	Anodyne	ADRB1	32	42
C[C@H](CNC[C@H](O)c1ccc(Cl)cc1)Oc1cccc(F)c1	ZINC000819111863	DH	On-Demand	Anodyne	ADRB3	49	42
C[C@@H](CNC[C@H](O)c1ccc(Cl)cc1)Oc1cccc(F)c1	ZINC000819111864	DH	On-Demand	Anodyne	ADRB1	32	42
C[C@@H](CNC[C@H](O)c1ccc(Cl)cc1)Oc1cccc(F)c1	ZINC000819111864	DH	On-Demand	Anodyne	ADRB3	49	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccc(F)cc1)c1ccccc1	ZINC000819111866	FH	On-Demand	Anodyne	ADRB3	21	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccc(F)cc1)c1ccccc1	ZINC000819111866	FH	On-Demand	Anodyne	PAPA1_CARPA	34	43
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccc(F)cc1)c1ccccc1	ZINC000819111866	FH	On-Demand	Anodyne	CTSK	15	49
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccc(F)cc1)c1ccccc1	ZINC000819111866	FH	On-Demand	Anodyne	FPR1	41	36
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccc(F)cc1)c1ccccc1	ZINC000819111867	FH	On-Demand	Anodyne	ADRB3	21	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccc(F)cc1)c1ccccc1	ZINC000819111867	FH	On-Demand	Anodyne	PAPA1_CARPA	34	43
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccc(F)cc1)c1ccccc1	ZINC000819111867	FH	On-Demand	Anodyne	CTSK	15	49
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccc(F)cc1)c1ccccc1	ZINC000819111867	FH	On-Demand	Anodyne	FPR1	41	36
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccccc1[N+](=O)[O-]	ZINC000819111873	DF	On-Demand	Bother	COLA	105	40
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1c(F)cccc1F	ZINC000819111895	DF	On-Demand	Bother	COLA	110	36
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1c(F)cccc1F	ZINC000819111896	DF	On-Demand	Bother	COLA	110	36
CN1CCC(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)(N2CCCCC2)CC1	ZINC000819111912	GE	On-Demand	Bother	HCN1	43	35
CC(C)(C)C(=O)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819111920	DE	On-Demand	Reactive	CRTM	40	37
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1ccc(F)cc1Cl)C2	ZINC000819111946	EG	On-Demand	Anodyne	SLC6A3	16	44
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1ccc(F)cc1Cl)C2	ZINC000819111947	EG	On-Demand	Anodyne	SLC6A3	16	44
CN1CCC(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)(N2CCCCC2)CC1	ZINC000819112013	GE	On-Demand	Bother	HCN1	43	35
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819112014	FH	On-Demand	Bother	ADRB1	36	40
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819112014	FH	On-Demand	Bother	ADRB3	24	42
O=[N+]([O-])c1ccccc1CCNC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819112014	FH	On-Demand	Bother	COLA	96	41
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819112015	FH	On-Demand	Bother	ADRB1	36	40
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819112015	FH	On-Demand	Bother	ADRB3	24	42
O=[N+]([O-])c1ccccc1CCNC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819112015	FH	On-Demand	Bother	COLA	96	41
CN1CCC(CNC[C@H](O)c2ccccc2F)(N2CCCCC2)CC1	ZINC000819112016	EE	On-Demand	Anodyne	HCN1	75	39
CN1CCC(CNC[C@H](O)c2ccccc2F)(N2CCCCC2)CC1	ZINC000819112016	EE	On-Demand	Anodyne	HCN4	52	34
CN1CCC(CNC[C@@H](O)c2ccccc2F)(N2CCCCC2)CC1	ZINC000819112017	EE	On-Demand	Anodyne	HCN1	75	39
CN1CCC(CNC[C@@H](O)c2ccccc2F)(N2CCCCC2)CC1	ZINC000819112017	EE	On-Demand	Anodyne	HCN4	52	34
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819112020	FF	On-Demand	Anodyne	ADRB2	21	44
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819112020	FF	On-Demand	Anodyne	ADRB1	27	44
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819112020	FF	On-Demand	Anodyne	ADRB3	97	45
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819112020	FF	On-Demand	Anodyne	KCNA5	25	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819112021	FF	On-Demand	Anodyne	ADRB2	21	44
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819112021	FF	On-Demand	Anodyne	ADRB1	27	44
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819112021	FF	On-Demand	Anodyne	ADRB3	97	45
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819112021	FF	On-Demand	Anodyne	KCNA5	25	41
O=C(NCCOc1cccc(Cl)c1)C(F)=C1CCC1	ZINC000819112030	CG	On-Demand	Anodyne	HRH2	26	42
O=C(NCCOc1cccc(Cl)c1)C(F)=C1CCC1	ZINC000819112030	CG	On-Demand	Anodyne	PDS	59	39
Cc1ccccc1[C@@H](O)CNCC1(N2CCCCC2)CCN(C)CC1	ZINC000819112031	EF	On-Demand	Anodyne	HCN1	76	40
Cc1ccccc1[C@@H](O)CNCC1(N2CCCCC2)CCN(C)CC1	ZINC000819112031	EF	On-Demand	Anodyne	HCN4	53	34
C[C@@H]1C[C@H](NC[C@H](O)c2cccnc2)C(=O)N1c1ccccc1	ZINC000819112037	DD	On-Demand	Anodyne	ADRB3	63	41
C[C@@H]1C[C@H](NC[C@@H](O)c2cccnc2)C(=O)N1c1ccccc1	ZINC000819112039	DD	On-Demand	Anodyne	ADRB3	63	41
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819112041	GF	On-Demand	Anodyne	ADRB2	21	42
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819112042	GF	On-Demand	Anodyne	ADRB2	21	42
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819112043	GF	On-Demand	Anodyne	ADRB2	21	42
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2=O)cc1	ZINC000819112044	GF	On-Demand	Anodyne	ADRB2	21	42
COc1ccc(OC)c([C@H](O)CNC[C@@H](C)Oc2cccc(Cl)c2)c1	ZINC000819112052	FG	On-Demand	Anodyne	ADRB2	18	43
COc1ccc(OC)c([C@H](O)CNC[C@@H](C)Oc2cccc(Cl)c2)c1	ZINC000819112052	FG	On-Demand	Anodyne	ADRB1	30	46
COc1ccc(OC)c([C@H](O)CNC[C@@H](C)Oc2cccc(Cl)c2)c1	ZINC000819112052	FG	On-Demand	Anodyne	ADRB3	40	42
COc1ccc(OC)c([C@H](O)CNC[C@@H](C)Oc2cccc(Cl)c2)c1	ZINC000819112052	FG	On-Demand	Anodyne	MTNR1A	29	49
COc1ccc(OC)c([C@H](O)CNC[C@@H](C)Oc2cccc(Cl)c2)c1	ZINC000819112052	FG	On-Demand	Anodyne	MTNR1B	30	49
COc1ccc(OC)c([C@H](O)CNC[C@H](C)Oc2cccc(Cl)c2)c1	ZINC000819112053	FG	On-Demand	Anodyne	ADRB2	18	43
COc1ccc(OC)c([C@H](O)CNC[C@H](C)Oc2cccc(Cl)c2)c1	ZINC000819112053	FG	On-Demand	Anodyne	ADRB1	30	46
COc1ccc(OC)c([C@H](O)CNC[C@H](C)Oc2cccc(Cl)c2)c1	ZINC000819112053	FG	On-Demand	Anodyne	ADRB3	40	42
COc1ccc(OC)c([C@H](O)CNC[C@H](C)Oc2cccc(Cl)c2)c1	ZINC000819112053	FG	On-Demand	Anodyne	MTNR1A	29	49
COc1ccc(OC)c([C@H](O)CNC[C@H](C)Oc2cccc(Cl)c2)c1	ZINC000819112053	FG	On-Demand	Anodyne	MTNR1B	30	49
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819112059	FH	On-Demand	Anodyne	MTNR1A	20	50
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819112059	FH	On-Demand	Anodyne	MTNR1B	22	50
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819112059	FH	On-Demand	Anodyne	PDS	40	38
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819112060	FH	On-Demand	Anodyne	MTNR1A	20	50
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819112060	FH	On-Demand	Anodyne	MTNR1B	22	50
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819112060	FH	On-Demand	Anodyne	PDS	40	38
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819112061	FH	On-Demand	Anodyne	MTNR1A	20	50
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819112061	FH	On-Demand	Anodyne	MTNR1B	22	50
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819112061	FH	On-Demand	Anodyne	PDS	40	38
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819112062	FH	On-Demand	Anodyne	MTNR1A	20	50
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819112062	FH	On-Demand	Anodyne	MTNR1B	22	50
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819112062	FH	On-Demand	Anodyne	PDS	40	38
O=C(O)[C@H](CNS(=O)(=O)c1ccc(F)c(Cl)c1)C1CCOCC1	ZINC000819112063	FD	On-Demand	Anodyne	LEF	25	46
O=C(O)[C@@H](CNS(=O)(=O)c1ccc(F)c(Cl)c1)C1CCOCC1	ZINC000819112064	FD	On-Demand	Anodyne	LEF	25	46
CN(C1CC1)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112067	GE	On-Demand	Anodyne	HTR1D	40	53
CN(C1CC1)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112067	GE	On-Demand	Anodyne	HTR1B	32	53
CN(C1CC1)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112067	GE	On-Demand	Anodyne	SLC6A4	15	42
CN(C1CC1)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112067	GE	On-Demand	Anodyne	HTR1F	93	47
CN(C1CC1)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112067	GE	On-Demand	Anodyne	CCR2	24	42
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CC4CCC4)CC3)c2c1	ZINC000819112090	GG	On-Demand	Anodyne	HTR1D	34	45
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CC4CCC4)CC3)c2c1	ZINC000819112090	GG	On-Demand	Anodyne	HTR1B	28	44
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CC4CCC4)CC3)c2c1	ZINC000819112090	GG	On-Demand	Anodyne	HTR1F	86	44
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CC4CCC4)CC3)c2c1	ZINC000819112090	GG	On-Demand	Anodyne	CCR2	22	44
C[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819112103	FH	On-Demand	Mild	GHRHR	40	32
C[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819112103	FH	On-Demand	Mild	PAPA1_CARPA	40	44
C[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819112103	FH	On-Demand	Mild	FPR1	42	35
CN(C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112105	FD	On-Demand	Anodyne	HTR1A	15	48
CN(C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112105	FD	On-Demand	Anodyne	HTR1D	40	52
CN(C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112105	FD	On-Demand	Anodyne	HTR1B	33	52
CN(C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112105	FD	On-Demand	Anodyne	HTR1F	97	48
CN(C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112105	FD	On-Demand	Anodyne	CCR2	26	43
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccccc4)CC3)c2c1	ZINC000819112110	GG	On-Demand	Anodyne	HTR1A	17	48
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccccc4)CC3)c2c1	ZINC000819112110	GG	On-Demand	Anodyne	HTR1D	44	46
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccccc4)CC3)c2c1	ZINC000819112110	GG	On-Demand	Anodyne	HTR1B	36	46
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccccc4)CC3)c2c1	ZINC000819112110	GG	On-Demand	Anodyne	SLC6A4	15	40
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccccc4)CC3)c2c1	ZINC000819112110	GG	On-Demand	Anodyne	HTR1F	94	46
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccccc4)CC3)c2c1	ZINC000819112110	GG	On-Demand	Anodyne	CCR2	27	45
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccccc4)CC3)c2c1	ZINC000819112110	GG	On-Demand	Anodyne	AKR1C3	58	42
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccccc4)CC3)c2c1	ZINC000819112110	GG	On-Demand	Anodyne	SFRP1	22	41
O=C(O)[C@@H](CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)C1CCOCC1	ZINC000819112111	FD	On-Demand	Bother	LUXR	16	41
O=C(O)[C@H](CNS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)C1CCOCC1	ZINC000819112112	FD	On-Demand	Bother	LUXR	16	41
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccc(C#N)cc3)C2)cc1	ZINC000819112113	FF	On-Demand	Mild	ADRB2	30	45
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccc(C#N)cc3)C2)cc1	ZINC000819112113	FF	On-Demand	Mild	ADRB1	33	42
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccc(C#N)cc3)C2)cc1	ZINC000819112113	FF	On-Demand	Mild	ADRB3	22	43
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccc(C#N)cc3)C2)cc1	ZINC000819112116	FF	On-Demand	Mild	ADRB2	30	45
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccc(C#N)cc3)C2)cc1	ZINC000819112116	FF	On-Demand	Mild	ADRB1	33	42
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccc(C#N)cc3)C2)cc1	ZINC000819112116	FF	On-Demand	Mild	ADRB3	22	43
O=C(Nc1cccc(OC(F)F)c1)C(F)=C1CCC1	ZINC000819112123	CH	On-Demand	Anodyne	GRM4	16	50
O=C(Nc1cccc(OC(F)F)c1)C(F)=C1CCC1	ZINC000819112123	CH	On-Demand	Anodyne	TAAR1	27	45
COc1cccc(O[C@H](C)CNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819112136	EG	On-Demand	Anodyne	MTNR1A	32	55
COc1cccc(O[C@H](C)CNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819112136	EG	On-Demand	Anodyne	MTNR1B	32	55
COc1cccc(O[C@@H](C)CNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819112137	EG	On-Demand	Anodyne	MTNR1A	32	55
COc1cccc(O[C@@H](C)CNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819112137	EG	On-Demand	Anodyne	MTNR1B	32	55
COc1cccc(O[C@H](C)CNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819112138	EG	On-Demand	Anodyne	MTNR1A	32	55
COc1cccc(O[C@H](C)CNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819112138	EG	On-Demand	Anodyne	MTNR1B	32	55
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819112139	EG	On-Demand	Anodyne	MTNR1A	32	55
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819112139	EG	On-Demand	Anodyne	MTNR1B	32	55
CCOc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819112158	EG	On-Demand	Anodyne	ADRB2	44	44
CCOc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819112158	EG	On-Demand	Anodyne	ADRB1	61	45
CCOc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819112159	EG	On-Demand	Anodyne	ADRB2	44	44
CCOc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819112159	EG	On-Demand	Anodyne	ADRB1	61	45
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819112162	DF	On-Demand	Anodyne	ADRB2	24	72
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819112162	DF	On-Demand	Anodyne	ADRB1	31	72
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819112162	DF	On-Demand	Anodyne	HTR1A	17	72
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819112162	DF	On-Demand	Anodyne	SLC6A4	20	44
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819112162	DF	On-Demand	Anodyne	ADRB3	16	61
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819112164	DF	On-Demand	Anodyne	ADRB2	24	72
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819112164	DF	On-Demand	Anodyne	ADRB1	31	72
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819112164	DF	On-Demand	Anodyne	HTR1A	17	72
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819112164	DF	On-Demand	Anodyne	SLC6A4	20	44
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819112164	DF	On-Demand	Anodyne	ADRB3	16	61
CC(=O)c1cccc(OC[C@@H](O)CNCc2c(C)cccc2F)c1	ZINC000819112180	EF	On-Demand	Anodyne	ADRB2	30	46
CC(=O)c1cccc(OC[C@@H](O)CNCc2c(C)cccc2F)c1	ZINC000819112180	EF	On-Demand	Anodyne	ADRB1	48	41
CC(=O)c1cccc(OC[C@@H](O)CNCc2c(C)cccc2F)c1	ZINC000819112180	EF	On-Demand	Anodyne	ABCB1	27	52
CC(=O)c1cccc(OC[C@@H](O)CNCc2c(C)cccc2F)c1	ZINC000819112180	EF	On-Demand	Anodyne	PDS	51	35
CC(=O)c1cccc(OC[C@H](O)CNCc2c(C)cccc2F)c1	ZINC000819112181	EF	On-Demand	Anodyne	ADRB2	30	46
CC(=O)c1cccc(OC[C@H](O)CNCc2c(C)cccc2F)c1	ZINC000819112181	EF	On-Demand	Anodyne	ADRB1	48	41
CC(=O)c1cccc(OC[C@H](O)CNCc2c(C)cccc2F)c1	ZINC000819112181	EF	On-Demand	Anodyne	ABCB1	27	52
CC(=O)c1cccc(OC[C@H](O)CNCc2c(C)cccc2F)c1	ZINC000819112181	EF	On-Demand	Anodyne	PDS	51	35
CS[C@@H]1CC[C@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819112192	DF	On-Demand	Anodyne	ADRB2	33	44
CS[C@@H]1CC[C@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819112192	DF	On-Demand	Anodyne	ADRB1	47	44
CS[C@@H]1CC[C@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819112192	DF	On-Demand	Anodyne	ADRB3	31	44
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819112193	DF	On-Demand	Anodyne	ADRB2	33	44
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819112193	DF	On-Demand	Anodyne	ADRB1	47	44
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819112193	DF	On-Demand	Anodyne	ADRB3	31	44
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccccc3F)C2)cc1	ZINC000819112228	FG	On-Demand	Anodyne	ADRB2	35	48
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccccc3F)C2)cc1	ZINC000819112228	FG	On-Demand	Anodyne	ADRB1	26	48
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccccc3F)C2)cc1	ZINC000819112228	FG	On-Demand	Anodyne	ADRB3	22	47
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccccc3F)C2)cc1	ZINC000819112228	FG	On-Demand	Anodyne	ABCB1	30	40
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccccc3F)C2)cc1	ZINC000819112229	FG	On-Demand	Anodyne	ADRB2	35	48
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccccc3F)C2)cc1	ZINC000819112229	FG	On-Demand	Anodyne	ADRB1	26	48
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccccc3F)C2)cc1	ZINC000819112229	FG	On-Demand	Anodyne	ADRB3	22	47
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccccc3F)C2)cc1	ZINC000819112229	FG	On-Demand	Anodyne	ABCB1	30	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(OC(F)F)c1)C2	ZINC000819112254	FG	On-Demand	Anodyne	EPHX2	17	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(OC(F)F)c1)C2	ZINC000819112255	FG	On-Demand	Anodyne	EPHX2	17	46
CCCCN(C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112259	GG	On-Demand	Anodyne	HTR1D	39	45
CCCCN(C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112259	GG	On-Demand	Anodyne	HTR1B	32	45
CCCCN(C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112259	GG	On-Demand	Anodyne	HTR1F	84	42
CCCCN(C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112259	GG	On-Demand	Anodyne	CCR2	23	43
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccsc4)CC3)c2c1	ZINC000819112260	GG	On-Demand	Anodyne	HTR1D	29	47
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccsc4)CC3)c2c1	ZINC000819112260	GG	On-Demand	Anodyne	HTR1B	23	47
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccsc4)CC3)c2c1	ZINC000819112260	GG	On-Demand	Anodyne	HTR1F	79	47
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccsc4)CC3)c2c1	ZINC000819112260	GG	On-Demand	Anodyne	CCR2	21	43
C[C@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1cccc(Cl)c1	ZINC000819112333	GF	On-Demand	Anodyne	ADRB2	31	42
C[C@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1cccc(Cl)c1	ZINC000819112333	GF	On-Demand	Anodyne	ADRB1	50	42
C[C@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1cccc(Cl)c1	ZINC000819112333	GF	On-Demand	Anodyne	ADRB3	79	42
C[C@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1cccc(Cl)c1	ZINC000819112336	GF	On-Demand	Anodyne	ADRB2	31	42
C[C@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1cccc(Cl)c1	ZINC000819112336	GF	On-Demand	Anodyne	ADRB1	50	42
C[C@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1cccc(Cl)c1	ZINC000819112336	GF	On-Demand	Anodyne	ADRB3	79	42
C[C@@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1cccc(Cl)c1	ZINC000819112337	GF	On-Demand	Anodyne	ADRB2	31	42
C[C@@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1cccc(Cl)c1	ZINC000819112337	GF	On-Demand	Anodyne	ADRB1	50	42
C[C@@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1cccc(Cl)c1	ZINC000819112337	GF	On-Demand	Anodyne	ADRB3	79	42
C[C@@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1cccc(Cl)c1	ZINC000819112339	GF	On-Demand	Anodyne	ADRB2	31	42
C[C@@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1cccc(Cl)c1	ZINC000819112339	GF	On-Demand	Anodyne	ADRB1	50	42
C[C@@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1cccc(Cl)c1	ZINC000819112339	GF	On-Demand	Anodyne	ADRB3	79	42
Cn1cccc1S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112352	GF	On-Demand	Anodyne	HTR1D	43	46
Cn1cccc1S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112352	GF	On-Demand	Anodyne	HTR1B	38	46
Cn1cccc1S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112352	GF	On-Demand	Anodyne	HTR1F	96	46
Cn1cccc1S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112352	GF	On-Demand	Anodyne	CCR2	22	42
C=CCCS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112355	FF	On-Demand	Mild	HTR1D	30	44
C=CCCS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112355	FF	On-Demand	Mild	HTR1B	24	44
C=CCCS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112355	FF	On-Demand	Mild	HTR1F	81	42
C=CCCS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112355	FF	On-Demand	Mild	CCR2	23	43
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1ccccc1Cl	ZINC000819112380	DG	On-Demand	Anodyne	ADRB1	32	40
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1ccccc1Cl	ZINC000819112380	DG	On-Demand	Anodyne	ADRB3	58	38
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1ccccc1Cl	ZINC000819112380	DG	On-Demand	Anodyne	AOC3	15	41
C[C@H](CNC[C@H](O)c1ccccc1)Oc1ccccc1Cl	ZINC000819112382	DG	On-Demand	Anodyne	ADRB1	32	40
C[C@H](CNC[C@H](O)c1ccccc1)Oc1ccccc1Cl	ZINC000819112382	DG	On-Demand	Anodyne	ADRB3	58	38
C[C@H](CNC[C@H](O)c1ccccc1)Oc1ccccc1Cl	ZINC000819112382	DG	On-Demand	Anodyne	AOC3	15	41
COc1cccc(O[C@H](C)CNCCC(=O)N(C)OC)c1	ZINC000819112392	CD	On-Demand	Anodyne	DRD4	41	31
COc1cccc(O[C@H](C)CNCCC(=O)N(C)OC)c1	ZINC000819112392	CD	On-Demand	Anodyne	MTNR1A	58	56
COc1cccc(O[C@H](C)CNCCC(=O)N(C)OC)c1	ZINC000819112392	CD	On-Demand	Anodyne	MTNR1B	54	56
COc1cccc(O[C@@H](C)CNCCC(=O)N(C)OC)c1	ZINC000819112394	CD	On-Demand	Anodyne	DRD4	41	31
COc1cccc(O[C@@H](C)CNCCC(=O)N(C)OC)c1	ZINC000819112394	CD	On-Demand	Anodyne	MTNR1A	58	56
COc1cccc(O[C@@H](C)CNCCC(=O)N(C)OC)c1	ZINC000819112394	CD	On-Demand	Anodyne	MTNR1B	54	56
O=C1CCCc2cc(S(=O)(=O)NC[C@H](C(=O)O)C3CCOCC3)ccc2N1	ZINC000819112395	GD	On-Demand	Anodyne	PKM	31	43
O=C1CCCc2cc(S(=O)(=O)NC[C@@H](C(=O)O)C3CCOCC3)ccc2N1	ZINC000819112396	GD	On-Demand	Anodyne	PKM	31	43
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4cccnc4)CC3)c2c1	ZINC000819112404	GF	On-Demand	Anodyne	HTR1D	32	41
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4cccnc4)CC3)c2c1	ZINC000819112404	GF	On-Demand	Anodyne	HTR1B	25	41
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4cccnc4)CC3)c2c1	ZINC000819112404	GF	On-Demand	Anodyne	HTR1F	85	41
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4cccnc4)CC3)c2c1	ZINC000819112404	GF	On-Demand	Anodyne	CCR2	25	43
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4cccnc4)CC3)c2c1	ZINC000819112404	GF	On-Demand	Anodyne	AKR1C3	46	35
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)Cc4ccon4)CC3)c2c1	ZINC000819112411	GF	On-Demand	Anodyne	HTR1D	26	42
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)Cc4ccon4)CC3)c2c1	ZINC000819112411	GF	On-Demand	Anodyne	HTR1B	23	41
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)Cc4ccon4)CC3)c2c1	ZINC000819112411	GF	On-Demand	Anodyne	HTR1F	80	40
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)Cc4ccon4)CC3)c2c1	ZINC000819112411	GF	On-Demand	Anodyne	CCR2	19	44
C[C@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1ccccc1F	ZINC000819112423	GG	On-Demand	Anodyne	GPR119	48	57
C[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1ccccc1F	ZINC000819112424	GG	On-Demand	Anodyne	GPR119	48	57
C[C@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1ccccc1F	ZINC000819112425	GG	On-Demand	Anodyne	GPR119	48	57
C[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1ccccc1F	ZINC000819112426	GG	On-Demand	Anodyne	GPR119	48	57
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1ccc(F)cc1	ZINC000819112434	CF	On-Demand	Anodyne	ADRB1	28	41
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1ccc(F)cc1	ZINC000819112434	CF	On-Demand	Anodyne	ADRB3	41	39
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1ccc(F)cc1	ZINC000819112434	CF	On-Demand	Anodyne	AOC3	20	43
C[C@H](CNC[C@H](O)c1ccccc1)Oc1ccc(F)cc1	ZINC000819112435	CF	On-Demand	Anodyne	ADRB1	28	41
C[C@H](CNC[C@H](O)c1ccccc1)Oc1ccc(F)cc1	ZINC000819112435	CF	On-Demand	Anodyne	ADRB3	41	39
C[C@H](CNC[C@H](O)c1ccccc1)Oc1ccc(F)cc1	ZINC000819112435	CF	On-Demand	Anodyne	AOC3	20	43
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1ccc(F)cc1	ZINC000819112436	CF	On-Demand	Anodyne	ADRB1	28	41
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1ccc(F)cc1	ZINC000819112436	CF	On-Demand	Anodyne	ADRB3	41	39
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1ccc(F)cc1	ZINC000819112436	CF	On-Demand	Anodyne	AOC3	20	43
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1ccc(F)cc1	ZINC000819112437	CF	On-Demand	Anodyne	ADRB1	28	41
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1ccc(F)cc1	ZINC000819112437	CF	On-Demand	Anodyne	ADRB3	41	39
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1ccc(F)cc1	ZINC000819112437	CF	On-Demand	Anodyne	AOC3	20	43
C[C@H](CNC[C@@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1F	ZINC000819112442	EH	On-Demand	Anodyne	ADRB2	15	41
C[C@H](CNC[C@@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1F	ZINC000819112442	EH	On-Demand	Anodyne	ADRB1	16	41
C[C@H](CNC[C@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1F	ZINC000819112443	EH	On-Demand	Anodyne	ADRB2	15	41
C[C@H](CNC[C@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1F	ZINC000819112443	EH	On-Demand	Anodyne	ADRB1	16	41
C[C@@H](CNC[C@@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1F	ZINC000819112444	EH	On-Demand	Anodyne	ADRB2	15	41
C[C@@H](CNC[C@@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1F	ZINC000819112444	EH	On-Demand	Anodyne	ADRB1	16	41
C[C@@H](CNC[C@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1F	ZINC000819112445	EH	On-Demand	Anodyne	ADRB2	15	41
C[C@@H](CNC[C@H](O)c1ccc(Cl)c(F)c1)Oc1ccccc1F	ZINC000819112445	EH	On-Demand	Anodyne	ADRB1	16	41
CCNC(=O)COc1ccc(CNC(=O)C(F)=C2CCC2)cc1OC	ZINC000819112450	FE	On-Demand	Anodyne	DRTS_TRYCR	42	29
O=S(=O)(c1ccc(CCNC[C@H](O)c2cccnc2)s1)N1CCCCC1	ZINC000819112454	GE	On-Demand	Anodyne	ADRB2	31	45
O=S(=O)(c1ccc(CCNC[C@H](O)c2cccnc2)s1)N1CCCCC1	ZINC000819112454	GE	On-Demand	Anodyne	ADRB1	39	43
O=S(=O)(c1ccc(CCNC[C@H](O)c2cccnc2)s1)N1CCCCC1	ZINC000819112454	GE	On-Demand	Anodyne	ADRB3	132	63
O=S(=O)(c1ccc(CCNC[C@H](O)c2cccnc2)s1)N1CCCCC1	ZINC000819112454	GE	On-Demand	Anodyne	NAMPT	19	41
O=S(=O)(c1ccc(CCNC[C@@H](O)c2cccnc2)s1)N1CCCCC1	ZINC000819112455	GE	On-Demand	Anodyne	ADRB2	31	45
O=S(=O)(c1ccc(CCNC[C@@H](O)c2cccnc2)s1)N1CCCCC1	ZINC000819112455	GE	On-Demand	Anodyne	ADRB1	39	43
O=S(=O)(c1ccc(CCNC[C@@H](O)c2cccnc2)s1)N1CCCCC1	ZINC000819112455	GE	On-Demand	Anodyne	ADRB3	132	63
O=S(=O)(c1ccc(CCNC[C@@H](O)c2cccnc2)s1)N1CCCCC1	ZINC000819112455	GE	On-Demand	Anodyne	NAMPT	19	41
CS[C@H]1CC[C@@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000819112481	FH	On-Demand	Anodyne	CYNT	35	45
CS[C@H]1CC[C@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000819112482	FH	On-Demand	Anodyne	CYNT	35	45
CS[C@@H]1CC[C@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000819112484	FH	On-Demand	Anodyne	CYNT	35	45
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819112524	GH	On-Demand	Anodyne	ADRB2	18	46
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819112524	GH	On-Demand	Anodyne	MTNR1A	31	54
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819112524	GH	On-Demand	Anodyne	MTNR1B	31	54
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819112525	GH	On-Demand	Anodyne	ADRB2	18	46
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819112525	GH	On-Demand	Anodyne	MTNR1A	31	54
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819112525	GH	On-Demand	Anodyne	MTNR1B	31	54
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819112526	GH	On-Demand	Anodyne	ADRB2	18	46
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819112526	GH	On-Demand	Anodyne	MTNR1A	31	54
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819112526	GH	On-Demand	Anodyne	MTNR1B	31	54
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819112527	GH	On-Demand	Anodyne	ADRB2	18	46
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819112527	GH	On-Demand	Anodyne	MTNR1A	31	54
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819112527	GH	On-Demand	Anodyne	MTNR1B	31	54
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819112530	GG	On-Demand	Anodyne	ADRB2	27	68
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819112530	GG	On-Demand	Anodyne	ADRB1	29	68
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819112530	GG	On-Demand	Anodyne	HTR1A	17	68
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819112530	GG	On-Demand	Anodyne	SLC6A4	19	43
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819112530	GG	On-Demand	Anodyne	ADRB3	22	55
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819112531	GG	On-Demand	Anodyne	ADRB2	27	68
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819112531	GG	On-Demand	Anodyne	ADRB1	29	68
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819112531	GG	On-Demand	Anodyne	HTR1A	17	68
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819112531	GG	On-Demand	Anodyne	SLC6A4	19	43
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819112531	GG	On-Demand	Anodyne	ADRB3	22	55
COC(=O)c1ccc(S(=O)(=O)NC[C@H](C(=O)O)C2CCOCC2)cc1	ZINC000819112536	FC	On-Demand	Anodyne	MMP13	26	40
COC(=O)c1ccc(S(=O)(=O)NC[C@H](C(=O)O)C2CCOCC2)cc1	ZINC000819112536	FC	On-Demand	Anodyne	MMP2	23	40
COC(=O)c1ccc(S(=O)(=O)NC[C@@H](C(=O)O)C2CCOCC2)cc1	ZINC000819112537	FC	On-Demand	Anodyne	MMP13	26	40
COC(=O)c1ccc(S(=O)(=O)NC[C@@H](C(=O)O)C2CCOCC2)cc1	ZINC000819112537	FC	On-Demand	Anodyne	MMP2	23	40
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)[C@H]4CCOC4)CC3)c2c1	ZINC000819112539	GE	On-Demand	Anodyne	HTR1D	26	43
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)[C@H]4CCOC4)CC3)c2c1	ZINC000819112539	GE	On-Demand	Anodyne	HTR1B	22	43
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)[C@H]4CCOC4)CC3)c2c1	ZINC000819112539	GE	On-Demand	Anodyne	HTR1F	81	43
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)[C@H]4CCOC4)CC3)c2c1	ZINC000819112539	GE	On-Demand	Anodyne	CCR2	19	41
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)[C@@H]4CCOC4)CC3)c2c1	ZINC000819112540	GE	On-Demand	Anodyne	HTR1D	26	43
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)[C@@H]4CCOC4)CC3)c2c1	ZINC000819112540	GE	On-Demand	Anodyne	HTR1B	22	43
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)[C@@H]4CCOC4)CC3)c2c1	ZINC000819112540	GE	On-Demand	Anodyne	HTR1F	81	43
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)[C@@H]4CCOC4)CC3)c2c1	ZINC000819112540	GE	On-Demand	Anodyne	CCR2	19	41
O=C(O)[C@H](CNS(=O)(=O)c1ccc(F)c(C(F)(F)F)c1)C1CCOCC1	ZINC000819112541	GE	On-Demand	Anodyne	LEF	24	45
O=C(O)[C@H](CNS(=O)(=O)c1ccc(F)c(C(F)(F)F)c1)C1CCOCC1	ZINC000819112541	GE	On-Demand	Anodyne	SFRP1	125	39
O=C(O)[C@H](CNS(=O)(=O)c1ccc(F)c(C(F)(F)F)c1)C1CCOCC1	ZINC000819112541	GE	On-Demand	Anodyne	WNT3	84	39
O=C(O)[C@@H](CNS(=O)(=O)c1ccc(F)c(C(F)(F)F)c1)C1CCOCC1	ZINC000819112542	GE	On-Demand	Anodyne	LEF	24	45
O=C(O)[C@@H](CNS(=O)(=O)c1ccc(F)c(C(F)(F)F)c1)C1CCOCC1	ZINC000819112542	GE	On-Demand	Anodyne	SFRP1	125	39
O=C(O)[C@@H](CNS(=O)(=O)c1ccc(F)c(C(F)(F)F)c1)C1CCOCC1	ZINC000819112542	GE	On-Demand	Anodyne	WNT3	84	39
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cc3ccccc3o2)c1	ZINC000819112545	EH	On-Demand	Anodyne	MTNR1A	37	50
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cc3ccccc3o2)c1	ZINC000819112545	EH	On-Demand	Anodyne	MTNR1B	36	50
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cc3ccccc3o2)c1	ZINC000819112546	EH	On-Demand	Anodyne	MTNR1A	37	50
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cc3ccccc3o2)c1	ZINC000819112546	EH	On-Demand	Anodyne	MTNR1B	36	50
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COCC(C)C)C2)cc1	ZINC000819112567	DF	On-Demand	Anodyne	ADRB2	16	40
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COCC(C)C)C2)cc1	ZINC000819112567	DF	On-Demand	Anodyne	ADRB1	15	40
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COCC(C)C)C2)cc1	ZINC000819112568	DF	On-Demand	Anodyne	ADRB2	16	40
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COCC(C)C)C2)cc1	ZINC000819112568	DF	On-Demand	Anodyne	ADRB1	15	40
Cn1nccc1S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112570	GE	On-Demand	Anodyne	HTR1D	36	45
Cn1nccc1S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112570	GE	On-Demand	Anodyne	HTR1B	32	45
Cn1nccc1S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112570	GE	On-Demand	Anodyne	HTR1F	98	45
Cn1nccc1S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112570	GE	On-Demand	Anodyne	CCR2	21	43
C[C@H](CNC[C@H](O)c1cccc(F)c1)Oc1cccc(Cl)c1	ZINC000819112579	DH	On-Demand	Anodyne	ADRB2	15	44
C[C@H](CNC[C@H](O)c1cccc(F)c1)Oc1cccc(Cl)c1	ZINC000819112579	DH	On-Demand	Anodyne	ADRB1	39	48
C[C@H](CNC[C@H](O)c1cccc(F)c1)Oc1cccc(Cl)c1	ZINC000819112579	DH	On-Demand	Anodyne	ADRB3	61	48
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1cccc(Cl)c1	ZINC000819112580	DH	On-Demand	Anodyne	ADRB2	15	44
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1cccc(Cl)c1	ZINC000819112580	DH	On-Demand	Anodyne	ADRB1	39	48
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1cccc(Cl)c1	ZINC000819112580	DH	On-Demand	Anodyne	ADRB3	61	48
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Oc1cccc(Cl)c1	ZINC000819112581	DH	On-Demand	Anodyne	ADRB2	15	44
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Oc1cccc(Cl)c1	ZINC000819112581	DH	On-Demand	Anodyne	ADRB1	39	48
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Oc1cccc(Cl)c1	ZINC000819112581	DH	On-Demand	Anodyne	ADRB3	61	48
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1cccc(Cl)c1	ZINC000819112582	DH	On-Demand	Anodyne	ADRB2	15	44
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1cccc(Cl)c1	ZINC000819112582	DH	On-Demand	Anodyne	ADRB1	39	48
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1cccc(Cl)c1	ZINC000819112582	DH	On-Demand	Anodyne	ADRB3	61	48
CC(=O)Nc1ccc(S(=O)(=O)NC[C@H](C(=O)O)C2CCOCC2)cc1	ZINC000819112602	FD	On-Demand	Anodyne	CA2	16	45
CC(=O)Nc1ccc(S(=O)(=O)NC[C@H](C(=O)O)C2CCOCC2)cc1	ZINC000819112602	FD	On-Demand	Anodyne	CA4	17	45
CC(=O)Nc1ccc(S(=O)(=O)NC[C@H](C(=O)O)C2CCOCC2)cc1	ZINC000819112602	FD	On-Demand	Anodyne	IDO1	33	42
CC(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C(=O)O)C2CCOCC2)cc1	ZINC000819112603	FD	On-Demand	Anodyne	CA2	16	45
CC(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C(=O)O)C2CCOCC2)cc1	ZINC000819112603	FD	On-Demand	Anodyne	CA4	17	45
CC(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C(=O)O)C2CCOCC2)cc1	ZINC000819112603	FD	On-Demand	Anodyne	IDO1	33	42
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1Cl	ZINC000819112606	DF	On-Demand	Anodyne	ADRB2	23	44
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1Cl	ZINC000819112606	DF	On-Demand	Anodyne	ADRB1	33	44
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1Cl	ZINC000819112606	DF	On-Demand	Anodyne	ADRB3	96	44
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1Cl	ZINC000819112607	DF	On-Demand	Anodyne	ADRB2	23	44
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1Cl	ZINC000819112607	DF	On-Demand	Anodyne	ADRB1	33	44
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1Cl	ZINC000819112607	DF	On-Demand	Anodyne	ADRB3	96	44
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1Cl	ZINC000819112608	DF	On-Demand	Anodyne	ADRB2	23	44
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1Cl	ZINC000819112608	DF	On-Demand	Anodyne	ADRB1	33	44
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1Cl	ZINC000819112608	DF	On-Demand	Anodyne	ADRB3	96	44
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1Cl	ZINC000819112609	DF	On-Demand	Anodyne	ADRB2	23	44
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1Cl	ZINC000819112609	DF	On-Demand	Anodyne	ADRB1	33	44
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1Cl	ZINC000819112609	DF	On-Demand	Anodyne	ADRB3	96	44
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccccc2)c1	ZINC000819112610	DF	On-Demand	Anodyne	ADRB2	37	42
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccccc2)c1	ZINC000819112610	DF	On-Demand	Anodyne	ADRB1	48	44
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccccc2)c1	ZINC000819112610	DF	On-Demand	Anodyne	ADRB3	67	49
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccccc2)c1	ZINC000819112610	DF	On-Demand	Anodyne	MTNR1A	42	58
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccccc2)c1	ZINC000819112610	DF	On-Demand	Anodyne	MTNR1B	43	58
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccccc2)c1	ZINC000819112610	DF	On-Demand	Anodyne	AOC3	19	53
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccccc2)c1	ZINC000819112611	DF	On-Demand	Anodyne	ADRB2	37	42
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccccc2)c1	ZINC000819112611	DF	On-Demand	Anodyne	ADRB1	48	44
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccccc2)c1	ZINC000819112611	DF	On-Demand	Anodyne	ADRB3	67	49
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccccc2)c1	ZINC000819112611	DF	On-Demand	Anodyne	MTNR1A	42	58
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccccc2)c1	ZINC000819112611	DF	On-Demand	Anodyne	MTNR1B	43	58
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccccc2)c1	ZINC000819112611	DF	On-Demand	Anodyne	AOC3	19	53
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccccc2)c1	ZINC000819112612	DF	On-Demand	Anodyne	ADRB2	37	42
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccccc2)c1	ZINC000819112612	DF	On-Demand	Anodyne	ADRB1	48	44
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccccc2)c1	ZINC000819112612	DF	On-Demand	Anodyne	ADRB3	67	49
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccccc2)c1	ZINC000819112612	DF	On-Demand	Anodyne	MTNR1A	42	58
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccccc2)c1	ZINC000819112612	DF	On-Demand	Anodyne	MTNR1B	43	58
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccccc2)c1	ZINC000819112612	DF	On-Demand	Anodyne	AOC3	19	53
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819112623	EE	On-Demand	Bother	ADRB2	22	41
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819112623	EE	On-Demand	Bother	ADRB1	21	41
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819112623	EE	On-Demand	Bother	ADRB3	17	40
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819112623	EE	On-Demand	Bother	PDS	17	45
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819112624	EE	On-Demand	Bother	ADRB2	22	41
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819112624	EE	On-Demand	Bother	ADRB1	21	41
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819112624	EE	On-Demand	Bother	ADRB3	17	40
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819112624	EE	On-Demand	Bother	PDS	17	45
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccccc1F	ZINC000819112651	DG	On-Demand	Anodyne	ADRB1	21	45
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccccc1F	ZINC000819112652	DG	On-Demand	Anodyne	ADRB1	21	45
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccccc1F	ZINC000819112653	DG	On-Demand	Anodyne	ADRB1	21	45
C[C@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccccc1F	ZINC000819112654	DG	On-Demand	Anodyne	ADRB1	21	45
COc1cccc(OC)c1OC[C@H](O)CN[C@H]1CC[C@@H](SC)C1	ZINC000819112681	EE	On-Demand	Anodyne	ADRB2	32	45
COc1cccc(OC)c1OC[C@H](O)CN[C@H]1CC[C@@H](SC)C1	ZINC000819112681	EE	On-Demand	Anodyne	ADRB1	29	45
COc1cccc(OC)c1OC[C@H](O)CN[C@H]1CC[C@@H](SC)C1	ZINC000819112681	EE	On-Demand	Anodyne	ADRB3	18	40
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1CC[C@H](SC)C1	ZINC000819112682	EE	On-Demand	Anodyne	ADRB2	32	45
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1CC[C@H](SC)C1	ZINC000819112682	EE	On-Demand	Anodyne	ADRB1	29	45
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1CC[C@H](SC)C1	ZINC000819112682	EE	On-Demand	Anodyne	ADRB3	18	40
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1CC[C@@H](SC)C1	ZINC000819112683	EE	On-Demand	Anodyne	ADRB2	32	45
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1CC[C@@H](SC)C1	ZINC000819112683	EE	On-Demand	Anodyne	ADRB1	29	45
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1CC[C@@H](SC)C1	ZINC000819112683	EE	On-Demand	Anodyne	ADRB3	18	40
COc1cccc(OC)c1OC[C@H](O)CN[C@H]1CC[C@H](SC)C1	ZINC000819112684	EE	On-Demand	Anodyne	ADRB2	32	45
COc1cccc(OC)c1OC[C@H](O)CN[C@H]1CC[C@H](SC)C1	ZINC000819112684	EE	On-Demand	Anodyne	ADRB1	29	45
COc1cccc(OC)c1OC[C@H](O)CN[C@H]1CC[C@H](SC)C1	ZINC000819112684	EE	On-Demand	Anodyne	ADRB3	18	40
CS[C@@H]1CC[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819112696	EE	On-Demand	Bother	ADRB2	26	44
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819112697	EE	On-Demand	Bother	ADRB2	26	44
CS[C@@H]1CC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819112700	DE	On-Demand	Mild	ADRB2	29	42
CS[C@@H]1CC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819112700	DE	On-Demand	Mild	ADRB1	38	47
CS[C@@H]1CC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819112700	DE	On-Demand	Mild	ADRB3	25	41
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819112701	DE	On-Demand	Mild	ADRB2	29	42
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819112701	DE	On-Demand	Mild	ADRB1	38	47
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819112701	DE	On-Demand	Mild	ADRB3	25	41
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccccc2)c1	ZINC000819112713	DF	On-Demand	Anodyne	ADRB2	37	42
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccccc2)c1	ZINC000819112713	DF	On-Demand	Anodyne	ADRB1	48	44
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccccc2)c1	ZINC000819112713	DF	On-Demand	Anodyne	ADRB3	67	49
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccccc2)c1	ZINC000819112713	DF	On-Demand	Anodyne	MTNR1A	42	58
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccccc2)c1	ZINC000819112713	DF	On-Demand	Anodyne	MTNR1B	43	58
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccccc2)c1	ZINC000819112713	DF	On-Demand	Anodyne	AOC3	19	53
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccccc2F)c1	ZINC000819112748	DF	On-Demand	Anodyne	MTNR1A	28	53
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccccc2F)c1	ZINC000819112748	DF	On-Demand	Anodyne	MTNR1B	29	53
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccccc2F)c1	ZINC000819112749	DF	On-Demand	Anodyne	MTNR1A	28	53
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccccc2F)c1	ZINC000819112749	DF	On-Demand	Anodyne	MTNR1B	29	53
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccccc2F)c1	ZINC000819112750	DF	On-Demand	Anodyne	MTNR1A	28	53
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccccc2F)c1	ZINC000819112750	DF	On-Demand	Anodyne	MTNR1B	29	53
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccccc2F)c1	ZINC000819112751	DF	On-Demand	Anodyne	MTNR1A	28	53
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccccc2F)c1	ZINC000819112751	DF	On-Demand	Anodyne	MTNR1B	29	53
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819112757	EG	On-Demand	Anodyne	MTNR1A	23	51
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819112757	EG	On-Demand	Anodyne	MTNR1B	25	51
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819112758	EG	On-Demand	Anodyne	MTNR1A	23	51
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819112758	EG	On-Demand	Anodyne	MTNR1B	25	51
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819112759	EG	On-Demand	Anodyne	MTNR1A	23	51
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819112759	EG	On-Demand	Anodyne	MTNR1B	25	51
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819112760	EG	On-Demand	Anodyne	MTNR1A	23	51
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819112760	EG	On-Demand	Anodyne	MTNR1B	25	51
C[C@H](CNC[C@H](O)c1ccc([N+](=O)[O-])cc1)Oc1cccc(Cl)c1	ZINC000819112788	FG	On-Demand	Bother	ADRB1	40	43
C[C@H](CNC[C@H](O)c1ccc([N+](=O)[O-])cc1)Oc1cccc(Cl)c1	ZINC000819112788	FG	On-Demand	Bother	ADRB3	62	43
C[C@@H](CNC[C@H](O)c1ccc([N+](=O)[O-])cc1)Oc1cccc(Cl)c1	ZINC000819112789	FG	On-Demand	Bother	ADRB1	40	43
C[C@@H](CNC[C@H](O)c1ccc([N+](=O)[O-])cc1)Oc1cccc(Cl)c1	ZINC000819112789	FG	On-Demand	Bother	ADRB3	62	43
C[C@H](CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)Oc1cccc(Cl)c1	ZINC000819112790	FG	On-Demand	Bother	ADRB1	40	43
C[C@H](CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)Oc1cccc(Cl)c1	ZINC000819112790	FG	On-Demand	Bother	ADRB3	62	43
C[C@@H](CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)Oc1cccc(Cl)c1	ZINC000819112791	FG	On-Demand	Bother	ADRB1	40	43
C[C@@H](CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)Oc1cccc(Cl)c1	ZINC000819112791	FG	On-Demand	Bother	ADRB3	62	43
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccc(F)cc1	ZINC000819112844	DH	On-Demand	Anodyne	ADRB2	25	46
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccc(F)cc1	ZINC000819112844	DH	On-Demand	Anodyne	ADRB1	44	48
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccc(F)cc1	ZINC000819112844	DH	On-Demand	Anodyne	ADRB3	62	48
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccc(F)cc1	ZINC000819112845	DH	On-Demand	Anodyne	ADRB2	25	46
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccc(F)cc1	ZINC000819112845	DH	On-Demand	Anodyne	ADRB1	44	48
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccc(F)cc1	ZINC000819112845	DH	On-Demand	Anodyne	ADRB3	62	48
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccc(F)cc1	ZINC000819112846	DH	On-Demand	Anodyne	ADRB2	25	46
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccc(F)cc1	ZINC000819112846	DH	On-Demand	Anodyne	ADRB1	44	48
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccc(F)cc1	ZINC000819112846	DH	On-Demand	Anodyne	ADRB3	62	48
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccc(F)cc1	ZINC000819112847	DH	On-Demand	Anodyne	ADRB2	25	46
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccc(F)cc1	ZINC000819112847	DH	On-Demand	Anodyne	ADRB1	44	48
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccc(F)cc1	ZINC000819112847	DH	On-Demand	Anodyne	ADRB3	62	48
CS[C@@H]1CC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819112879	EG	On-Demand	Anodyne	ADRB2	30	46
CS[C@@H]1CC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819112879	EG	On-Demand	Anodyne	ADRB1	26	41
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819112880	EG	On-Demand	Anodyne	ADRB2	30	46
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819112880	EG	On-Demand	Anodyne	ADRB1	26	41
COC(=O)C1(NC(=O)c2ccc3c(=O)n(-c4ccccc4)c(O)nc3c2)CCCCC1	ZINC000819112906	HF	On-Demand	Anodyne	HPD	45	36
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)c3ccc(F)c(F)c3)C2)cc1	ZINC000819112927	EH	On-Demand	Anodyne	ADRB3	18	40
Cc1ccc(N2CCC[C@@H](NC[C@H](O)c3ccc(F)c(F)c3)C2)cc1	ZINC000819112928	EH	On-Demand	Anodyne	ADRB3	18	40
CCN(CC)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112931	GF	On-Demand	Anodyne	HTR1A	15	46
CCN(CC)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112931	GF	On-Demand	Anodyne	HTR1D	41	47
CCN(CC)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112931	GF	On-Demand	Anodyne	HTR1B	33	47
CCN(CC)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112931	GF	On-Demand	Anodyne	HTR1F	94	46
CCN(CC)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819112931	GF	On-Demand	Anodyne	CCR2	27	45
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccccc3)C2)cc1	ZINC000819112938	EF	On-Demand	Anodyne	ADRB2	47	49
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccccc3)C2)cc1	ZINC000819112938	EF	On-Demand	Anodyne	ADRB1	56	49
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccccc3)C2)cc1	ZINC000819112938	EF	On-Demand	Anodyne	ADRB3	45	51
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccccc3)C2)cc1	ZINC000819112939	EF	On-Demand	Anodyne	ADRB2	47	49
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccccc3)C2)cc1	ZINC000819112939	EF	On-Demand	Anodyne	ADRB1	56	49
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccccc3)C2)cc1	ZINC000819112939	EF	On-Demand	Anodyne	ADRB3	45	51
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819112956	GE	On-Demand	Anodyne	PTGS2	15	42
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819112956	GE	On-Demand	Anodyne	ADRB3	59	42
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819112956	GE	On-Demand	Anodyne	MTNR1A	33	53
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819112956	GE	On-Demand	Anodyne	MTNR1B	32	53
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819112957	GE	On-Demand	Anodyne	PTGS2	15	42
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819112957	GE	On-Demand	Anodyne	ADRB3	59	42
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819112957	GE	On-Demand	Anodyne	MTNR1A	33	53
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819112957	GE	On-Demand	Anodyne	MTNR1B	32	53
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819112958	GE	On-Demand	Anodyne	PTGS2	15	42
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819112958	GE	On-Demand	Anodyne	ADRB3	59	42
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819112958	GE	On-Demand	Anodyne	MTNR1A	33	53
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819112958	GE	On-Demand	Anodyne	MTNR1B	32	53
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819112959	GE	On-Demand	Anodyne	PTGS2	15	42
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819112959	GE	On-Demand	Anodyne	ADRB3	59	42
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819112959	GE	On-Demand	Anodyne	MTNR1A	33	53
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819112959	GE	On-Demand	Anodyne	MTNR1B	32	53
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccccc2C)c1	ZINC000819112980	DG	On-Demand	Anodyne	ADRB2	18	40
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccccc2C)c1	ZINC000819112980	DG	On-Demand	Anodyne	MTNR1A	31	54
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccccc2C)c1	ZINC000819112980	DG	On-Demand	Anodyne	MTNR1B	31	54
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccccc2C)c1	ZINC000819112981	DG	On-Demand	Anodyne	ADRB2	18	40
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccccc2C)c1	ZINC000819112981	DG	On-Demand	Anodyne	MTNR1A	31	54
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccccc2C)c1	ZINC000819112981	DG	On-Demand	Anodyne	MTNR1B	31	54
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccccc2C)c1	ZINC000819112982	DG	On-Demand	Anodyne	ADRB2	18	40
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccccc2C)c1	ZINC000819112982	DG	On-Demand	Anodyne	MTNR1A	31	54
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccccc2C)c1	ZINC000819112982	DG	On-Demand	Anodyne	MTNR1B	31	54
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccccc2C)c1	ZINC000819112983	DG	On-Demand	Anodyne	ADRB2	18	40
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccccc2C)c1	ZINC000819112983	DG	On-Demand	Anodyne	MTNR1A	31	54
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccccc2C)c1	ZINC000819112983	DG	On-Demand	Anodyne	MTNR1B	31	54
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccc(CC#N)cc3)C2)cc1	ZINC000819113001	GG	On-Demand	Mild	ADRB2	29	43
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccc(CC#N)cc3)C2)cc1	ZINC000819113001	GG	On-Demand	Mild	ADRB1	36	43
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccc(CC#N)cc3)C2)cc1	ZINC000819113001	GG	On-Demand	Mild	ADRB3	26	46
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccc(CC#N)cc3)C2)cc1	ZINC000819113002	GG	On-Demand	Mild	ADRB2	29	43
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccc(CC#N)cc3)C2)cc1	ZINC000819113002	GG	On-Demand	Mild	ADRB1	36	43
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccc(CC#N)cc3)C2)cc1	ZINC000819113002	GG	On-Demand	Mild	ADRB3	26	46
COCC(=O)NC1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819113019	GD	On-Demand	Mild	PAPA1_CARPA	31	40
COCC(=O)NC1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819113020	GD	On-Demand	Mild	PAPA1_CARPA	31	40
CS[C@H]1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819113040	CG	On-Demand	Anodyne	ADRB3	17	43
CS[C@H]1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819113041	CG	On-Demand	Anodyne	ADRB3	17	43
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(F)cc1	ZINC000819113054	EF	On-Demand	Bother	CACNA1C	47	35
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(F)cc1	ZINC000819113054	EF	On-Demand	Bother	CACNA1D	74	35
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(F)cc1	ZINC000819113055	EF	On-Demand	Bother	CACNA1C	47	35
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(F)cc1	ZINC000819113055	EF	On-Demand	Bother	CACNA1D	74	35
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(F)cc1	ZINC000819113056	EF	On-Demand	Bother	CACNA1C	47	35
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(F)cc1	ZINC000819113056	EF	On-Demand	Bother	CACNA1D	74	35
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(F)cc1	ZINC000819113057	EF	On-Demand	Bother	CACNA1C	47	35
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(F)cc1	ZINC000819113057	EF	On-Demand	Bother	CACNA1D	74	35
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1F	ZINC000819113065	CE	On-Demand	Anodyne	ADRB2	22	44
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1F	ZINC000819113065	CE	On-Demand	Anodyne	ADRB1	27	45
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1F	ZINC000819113065	CE	On-Demand	Anodyne	ADRB3	91	45
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1F	ZINC000819113066	CE	On-Demand	Anodyne	ADRB2	22	44
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1F	ZINC000819113066	CE	On-Demand	Anodyne	ADRB1	27	45
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1F	ZINC000819113066	CE	On-Demand	Anodyne	ADRB3	91	45
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1F	ZINC000819113067	CE	On-Demand	Anodyne	ADRB2	22	44
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1F	ZINC000819113067	CE	On-Demand	Anodyne	ADRB1	27	45
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1F	ZINC000819113067	CE	On-Demand	Anodyne	ADRB3	91	45
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1F	ZINC000819113068	CE	On-Demand	Anodyne	ADRB2	22	44
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1F	ZINC000819113068	CE	On-Demand	Anodyne	ADRB1	27	45
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1F	ZINC000819113068	CE	On-Demand	Anodyne	ADRB3	91	45
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](SC)C2)cc1	ZINC000819113073	EF	On-Demand	Anodyne	ADRB2	35	43
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](SC)C2)cc1	ZINC000819113073	EF	On-Demand	Anodyne	ADRB1	41	46
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](SC)C2)cc1	ZINC000819113073	EF	On-Demand	Anodyne	ADRB3	24	44
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](SC)C2)cc1	ZINC000819113074	EF	On-Demand	Anodyne	ADRB2	35	43
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](SC)C2)cc1	ZINC000819113074	EF	On-Demand	Anodyne	ADRB1	41	46
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](SC)C2)cc1	ZINC000819113074	EF	On-Demand	Anodyne	ADRB3	24	44
CCOc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](SC)C2)cc1	ZINC000819113075	EF	On-Demand	Anodyne	ADRB2	35	43
CCOc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](SC)C2)cc1	ZINC000819113075	EF	On-Demand	Anodyne	ADRB1	41	46
CCOc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](SC)C2)cc1	ZINC000819113075	EF	On-Demand	Anodyne	ADRB3	24	44
CCOc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](SC)C2)cc1	ZINC000819113076	EF	On-Demand	Anodyne	ADRB2	35	43
CCOc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](SC)C2)cc1	ZINC000819113076	EF	On-Demand	Anodyne	ADRB1	41	46
CCOc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](SC)C2)cc1	ZINC000819113076	EF	On-Demand	Anodyne	ADRB3	24	44
Cc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113081	DF	On-Demand	Anodyne	ADRB2	46	51
Cc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113081	DF	On-Demand	Anodyne	ADRB1	64	43
Cc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113081	DF	On-Demand	Anodyne	ADRB3	34	43
Cc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113082	DF	On-Demand	Anodyne	ADRB2	46	51
Cc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113082	DF	On-Demand	Anodyne	ADRB1	64	43
Cc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113082	DF	On-Demand	Anodyne	ADRB3	34	43
O=S(=O)(c1ccc(CCNC[C@@H](O)c2ccccc2)s1)N1CCCCC1	ZINC000819113085	GF	On-Demand	Anodyne	ADRB2	24	41
O=S(=O)(c1ccc(CCNC[C@@H](O)c2ccccc2)s1)N1CCCCC1	ZINC000819113085	GF	On-Demand	Anodyne	ADRB1	36	40
O=S(=O)(c1ccc(CCNC[C@@H](O)c2ccccc2)s1)N1CCCCC1	ZINC000819113085	GF	On-Demand	Anodyne	ADRB3	90	46
O=S(=O)(c1ccc(CCNC[C@H](O)c2ccccc2)s1)N1CCCCC1	ZINC000819113086	GF	On-Demand	Anodyne	ADRB2	24	41
O=S(=O)(c1ccc(CCNC[C@H](O)c2ccccc2)s1)N1CCCCC1	ZINC000819113086	GF	On-Demand	Anodyne	ADRB1	36	40
O=S(=O)(c1ccc(CCNC[C@H](O)c2ccccc2)s1)N1CCCCC1	ZINC000819113086	GF	On-Demand	Anodyne	ADRB3	90	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113087	EE	On-Demand	Anodyne	ADRB2	48	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113087	EE	On-Demand	Anodyne	ADRB1	77	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113087	EE	On-Demand	Anodyne	ADRB3	43	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113087	EE	On-Demand	Anodyne	ABCB1	23	44
COC(=O)c1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113088	EE	On-Demand	Anodyne	ADRB2	48	46
COC(=O)c1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113088	EE	On-Demand	Anodyne	ADRB1	77	46
COC(=O)c1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113088	EE	On-Demand	Anodyne	ADRB3	43	46
COC(=O)c1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113088	EE	On-Demand	Anodyne	ABCB1	23	44
CS[C@@H]1CC[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819113095	FF	On-Demand	Anodyne	GPR119	26	41
CS[C@@H]1CC[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819113098	FF	On-Demand	Anodyne	GPR119	26	41
CS[C@@H]1CC[C@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819113104	FI	On-Demand	Anodyne	SLC6A3	21	40
CS[C@@H]1CC[C@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819113105	FI	On-Demand	Anodyne	SLC6A3	21	40
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccoc4)CC3)c2c1	ZINC000819113120	FG	On-Demand	Anodyne	HTR1D	31	43
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccoc4)CC3)c2c1	ZINC000819113120	FG	On-Demand	Anodyne	HTR1B	24	43
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccoc4)CC3)c2c1	ZINC000819113120	FG	On-Demand	Anodyne	HTR1F	80	43
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccoc4)CC3)c2c1	ZINC000819113120	FG	On-Demand	Anodyne	CCR2	21	45
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccoc4)CC3)c2c1	ZINC000819113120	FG	On-Demand	Anodyne	AKR1C3	40	32
O=C(O)[C@@H](CNS(=O)(=O)c1cccc(Cl)c1Cl)C1CCOCC1	ZINC000819113121	GE	On-Demand	Anodyne	ITGAV	21	46
O=C(O)[C@H](CNS(=O)(=O)c1cccc(Cl)c1Cl)C1CCOCC1	ZINC000819113122	GE	On-Demand	Anodyne	ITGAV	21	46
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819113123	DF	On-Demand	Anodyne	ADRB2	22	40
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819113123	DF	On-Demand	Anodyne	MTNR1A	31	54
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819113123	DF	On-Demand	Anodyne	MTNR1B	32	54
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819113124	DF	On-Demand	Anodyne	ADRB2	22	40
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819113124	DF	On-Demand	Anodyne	MTNR1A	31	54
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819113124	DF	On-Demand	Anodyne	MTNR1B	32	54
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819113125	DF	On-Demand	Anodyne	ADRB2	22	40
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819113125	DF	On-Demand	Anodyne	MTNR1A	31	54
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819113125	DF	On-Demand	Anodyne	MTNR1B	32	54
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819113126	DF	On-Demand	Anodyne	ADRB2	22	40
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819113126	DF	On-Demand	Anodyne	MTNR1A	31	54
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819113126	DF	On-Demand	Anodyne	MTNR1B	32	54
COc1cccc(O[C@H](C)CNCCS(C)(=O)=O)c1	ZINC000819113159	CD	On-Demand	Anodyne	NQO2	20	42
COc1cccc(O[C@H](C)CNCCS(C)(=O)=O)c1	ZINC000819113159	CD	On-Demand	Anodyne	MTNR1A	52	58
COc1cccc(O[C@H](C)CNCCS(C)(=O)=O)c1	ZINC000819113159	CD	On-Demand	Anodyne	MTNR1B	51	58
COc1cccc(O[C@@H](C)CNCCS(C)(=O)=O)c1	ZINC000819113160	CD	On-Demand	Anodyne	NQO2	20	42
COc1cccc(O[C@@H](C)CNCCS(C)(=O)=O)c1	ZINC000819113160	CD	On-Demand	Anodyne	MTNR1A	52	58
COc1cccc(O[C@@H](C)CNCCS(C)(=O)=O)c1	ZINC000819113160	CD	On-Demand	Anodyne	MTNR1B	51	58
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819113167	EG	On-Demand	Anodyne	ADRB1	36	41
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819113167	EG	On-Demand	Anodyne	ADRB3	54	41
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819113167	EG	On-Demand	Anodyne	MTNR1A	32	54
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819113167	EG	On-Demand	Anodyne	MTNR1B	32	54
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819113169	EG	On-Demand	Anodyne	ADRB1	36	41
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819113169	EG	On-Demand	Anodyne	ADRB3	54	41
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819113169	EG	On-Demand	Anodyne	MTNR1A	32	54
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819113169	EG	On-Demand	Anodyne	MTNR1B	32	54
CC(=O)Nc1ccc2c(Cn3cc(S(=O)(=O)N4CCCC4)ccc3=O)cc(=O)oc2c1	ZINC000819113175	ID	On-Demand	Anodyne	LPL	45	35
COC[C@]1(C(=O)O)CCCN(S(=O)(=O)/C=C\c2ccc(Cl)cc2)C1	ZINC000819113178	FE	On-Demand	Anodyne	PA	24	42
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113179	EF	On-Demand	Bother	CACNA1C	49	38
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113179	EF	On-Demand	Bother	ADRB3	43	37
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113179	EF	On-Demand	Bother	CACNA1D	76	38
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113179	EF	On-Demand	Bother	MTNR1A	26	51
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113179	EF	On-Demand	Bother	MTNR1B	28	51
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113179	EF	On-Demand	Bother	AKR1C2	15	44
COC[C@]1(C(=O)O)CCCN(S(=O)(=O)/C=C/c2ccc(Cl)cc2)C1	ZINC000819113181	FE	On-Demand	Anodyne	PA	24	42
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113182	EF	On-Demand	Bother	CACNA1C	49	38
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113182	EF	On-Demand	Bother	ADRB3	43	37
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113182	EF	On-Demand	Bother	CACNA1D	76	38
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113182	EF	On-Demand	Bother	MTNR1A	26	51
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113182	EF	On-Demand	Bother	MTNR1B	28	51
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113182	EF	On-Demand	Bother	AKR1C2	15	44
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113184	EF	On-Demand	Bother	CACNA1C	49	38
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113184	EF	On-Demand	Bother	ADRB3	43	37
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113184	EF	On-Demand	Bother	CACNA1D	76	38
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113184	EF	On-Demand	Bother	MTNR1A	26	51
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113184	EF	On-Demand	Bother	MTNR1B	28	51
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113184	EF	On-Demand	Bother	AKR1C2	15	44
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113186	EF	On-Demand	Bother	CACNA1C	49	38
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113186	EF	On-Demand	Bother	ADRB3	43	37
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113186	EF	On-Demand	Bother	CACNA1D	76	38
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113186	EF	On-Demand	Bother	MTNR1A	26	51
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113186	EF	On-Demand	Bother	MTNR1B	28	51
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819113186	EF	On-Demand	Bother	AKR1C2	15	44
COC(=O)C1(NC(=O)Cn2c(S)nnc2-c2ccc(Cl)cc2)CCCCC1	ZINC000819113191	HF	On-Demand	Anodyne	HSD11B1	24	40
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COC(C)C)C2)cc1	ZINC000819113193	DE	On-Demand	Anodyne	ADRB2	20	40
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COC(C)C)C2)cc1	ZINC000819113193	DE	On-Demand	Anodyne	ADRB1	17	40
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COC(C)C)C2)cc1	ZINC000819113197	DE	On-Demand	Anodyne	ADRB2	20	40
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COC(C)C)C2)cc1	ZINC000819113197	DE	On-Demand	Anodyne	ADRB1	17	40
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4cnc[nH]4)CC3)c2c1	ZINC000819113205	FE	On-Demand	Anodyne	HTR1D	25	42
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4cnc[nH]4)CC3)c2c1	ZINC000819113205	FE	On-Demand	Anodyne	HTR1B	22	42
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4cnc[nH]4)CC3)c2c1	ZINC000819113205	FE	On-Demand	Anodyne	HTR1F	93	42
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4cnc[nH]4)CC3)c2c1	ZINC000819113205	FE	On-Demand	Anodyne	CCR2	22	44
CS[C@@H]1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819113226	EG	On-Demand	Anodyne	ADRB2	39	57
CS[C@@H]1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819113226	EG	On-Demand	Anodyne	ADRB1	34	42
CS[C@@H]1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819113226	EG	On-Demand	Anodyne	ADRB3	25	41
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819113227	EG	On-Demand	Anodyne	ADRB2	39	57
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819113227	EG	On-Demand	Anodyne	ADRB1	34	42
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819113227	EG	On-Demand	Anodyne	ADRB3	25	41
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccccc3[N+](=O)[O-])C2)cc1	ZINC000819113230	GF	On-Demand	Bother	ADRB2	29	44
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccccc3[N+](=O)[O-])C2)cc1	ZINC000819113230	GF	On-Demand	Bother	ADRB1	19	44
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113231	EF	On-Demand	Anodyne	ADRB2	50	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113231	EF	On-Demand	Anodyne	ADRB1	85	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113231	EF	On-Demand	Anodyne	GRIN1	23	47
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113231	EF	On-Demand	Anodyne	ADRB3	50	53
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113231	EF	On-Demand	Anodyne	ABCB1	19	41
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccccc3[N+](=O)[O-])C2)cc1	ZINC000819113232	GF	On-Demand	Bother	ADRB2	29	44
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccccc3[N+](=O)[O-])C2)cc1	ZINC000819113232	GF	On-Demand	Bother	ADRB1	19	44
CC(=O)Nc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113234	EF	On-Demand	Anodyne	ADRB2	50	55
CC(=O)Nc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113234	EF	On-Demand	Anodyne	ADRB1	85	55
CC(=O)Nc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113234	EF	On-Demand	Anodyne	GRIN1	23	47
CC(=O)Nc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113234	EF	On-Demand	Anodyne	ADRB3	50	53
CC(=O)Nc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113234	EF	On-Demand	Anodyne	ABCB1	19	41
CS[C@H]1CC[C@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819113243	CF	On-Demand	Anodyne	HDAC11	15	40
CS[C@H]1CC[C@@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819113245	CF	On-Demand	Anodyne	HDAC11	15	40
CS[C@@H]1CC[C@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819113247	CF	On-Demand	Anodyne	HDAC11	15	40
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819113274	FH	On-Demand	Anodyne	MTNR1A	22	50
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819113274	FH	On-Demand	Anodyne	MTNR1B	24	50
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819113275	FH	On-Demand	Anodyne	MTNR1A	22	50
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819113275	FH	On-Demand	Anodyne	MTNR1B	24	50
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819113277	FH	On-Demand	Anodyne	MTNR1A	22	50
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819113277	FH	On-Demand	Anodyne	MTNR1B	24	50
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](SC)C2)cc1	ZINC000819113314	EE	On-Demand	Anodyne	ADRB2	41	58
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](SC)C2)cc1	ZINC000819113314	EE	On-Demand	Anodyne	ADRB1	64	58
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](SC)C2)cc1	ZINC000819113314	EE	On-Demand	Anodyne	ADRB3	44	42
COCCc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](SC)C2)cc1	ZINC000819113315	EE	On-Demand	Anodyne	ADRB2	41	58
COCCc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](SC)C2)cc1	ZINC000819113315	EE	On-Demand	Anodyne	ADRB1	64	58
COCCc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](SC)C2)cc1	ZINC000819113315	EE	On-Demand	Anodyne	ADRB3	44	42
COCCc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](SC)C2)cc1	ZINC000819113316	EE	On-Demand	Anodyne	ADRB2	41	58
COCCc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](SC)C2)cc1	ZINC000819113316	EE	On-Demand	Anodyne	ADRB1	64	58
COCCc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](SC)C2)cc1	ZINC000819113316	EE	On-Demand	Anodyne	ADRB3	44	42
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](SC)C2)cc1	ZINC000819113317	EE	On-Demand	Anodyne	ADRB2	41	58
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](SC)C2)cc1	ZINC000819113317	EE	On-Demand	Anodyne	ADRB1	64	58
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](SC)C2)cc1	ZINC000819113317	EE	On-Demand	Anodyne	ADRB3	44	42
COC[C@]1(C(=O)O)CCCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819113322	GF	On-Demand	Anodyne	APP	40	36
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819113333	DF	On-Demand	Anodyne	ADRB2	30	45
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819113333	DF	On-Demand	Anodyne	ADRB1	39	43
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819113333	DF	On-Demand	Anodyne	ADRB3	29	43
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819113333	DF	On-Demand	Anodyne	ABCB1	15	44
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819113333	DF	On-Demand	Anodyne	PDS	64	38
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819113334	DF	On-Demand	Anodyne	ADRB2	30	45
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819113334	DF	On-Demand	Anodyne	ADRB1	39	43
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819113334	DF	On-Demand	Anodyne	ADRB3	29	43
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819113334	DF	On-Demand	Anodyne	ABCB1	15	44
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819113334	DF	On-Demand	Anodyne	PDS	64	38
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819113342	FH	On-Demand	Anodyne	MTNR1A	22	50
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819113342	FH	On-Demand	Anodyne	MTNR1B	24	50
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C[C@@H]4CCOC4)CC3)c2c1	ZINC000819113349	GE	On-Demand	Anodyne	HTR1D	23	42
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C[C@@H]4CCOC4)CC3)c2c1	ZINC000819113349	GE	On-Demand	Anodyne	HTR1B	19	41
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C[C@@H]4CCOC4)CC3)c2c1	ZINC000819113349	GE	On-Demand	Anodyne	HTR1F	62	40
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C[C@@H]4CCOC4)CC3)c2c1	ZINC000819113349	GE	On-Demand	Anodyne	CCR2	17	41
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C[C@H]4CCOC4)CC3)c2c1	ZINC000819113350	GE	On-Demand	Anodyne	HTR1D	23	42
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C[C@H]4CCOC4)CC3)c2c1	ZINC000819113350	GE	On-Demand	Anodyne	HTR1B	19	41
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C[C@H]4CCOC4)CC3)c2c1	ZINC000819113350	GE	On-Demand	Anodyne	HTR1F	62	40
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C[C@H]4CCOC4)CC3)c2c1	ZINC000819113350	GE	On-Demand	Anodyne	CCR2	17	41
O=C(O)[C@@H](CNS(=O)(=O)c1c(Cl)cccc1Cl)C1CCOCC1	ZINC000819113355	GE	On-Demand	Anodyne	ITGAV	15	43
O=C(O)[C@H](CNS(=O)(=O)c1c(Cl)cccc1Cl)C1CCOCC1	ZINC000819113356	GE	On-Demand	Anodyne	ITGAV	15	43
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(Cl)c1	ZINC000819113367	DF	On-Demand	Anodyne	ADRB2	31	45
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(Cl)c1	ZINC000819113367	DF	On-Demand	Anodyne	ADRB1	62	48
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(Cl)c1	ZINC000819113367	DF	On-Demand	Anodyne	ADRB3	135	48
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(Cl)c1	ZINC000819113368	DF	On-Demand	Anodyne	ADRB2	31	45
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(Cl)c1	ZINC000819113368	DF	On-Demand	Anodyne	ADRB1	62	48
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(Cl)c1	ZINC000819113368	DF	On-Demand	Anodyne	ADRB3	135	48
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(Cl)c1	ZINC000819113369	DF	On-Demand	Anodyne	ADRB2	31	45
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(Cl)c1	ZINC000819113369	DF	On-Demand	Anodyne	ADRB1	62	48
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(Cl)c1	ZINC000819113369	DF	On-Demand	Anodyne	ADRB3	135	48
C[C@H](CNC[C@H](O)c1cccnc1)Oc1cccc(Cl)c1	ZINC000819113370	DF	On-Demand	Anodyne	ADRB2	31	45
C[C@H](CNC[C@H](O)c1cccnc1)Oc1cccc(Cl)c1	ZINC000819113370	DF	On-Demand	Anodyne	ADRB1	62	48
C[C@H](CNC[C@H](O)c1cccnc1)Oc1cccc(Cl)c1	ZINC000819113370	DF	On-Demand	Anodyne	ADRB3	135	48
CS[C@@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113378	GG	On-Demand	Anodyne	CTSD	101	46
CS[C@@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113378	GG	On-Demand	Anodyne	PGC	60	38
CS[C@@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113378	GG	On-Demand	Anodyne	PAPA1_CARPA	35	42
CS[C@@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113378	GG	On-Demand	Anodyne	BACE2	61	46
CS[C@@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113378	GG	On-Demand	Anodyne	REN	85	50
CS[C@@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113378	GG	On-Demand	Anodyne	REN1	20	44
CS[C@@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113378	GG	On-Demand	Anodyne	BACE1	91	49
CS[C@@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113378	GG	On-Demand	Anodyne	FPR1	51	40
CS[C@@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113378	GG	On-Demand	Anodyne	PLM1_PLAFA	31	40
CS[C@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113380	GG	On-Demand	Anodyne	CTSD	101	46
CS[C@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113380	GG	On-Demand	Anodyne	PGC	60	38
CS[C@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113380	GG	On-Demand	Anodyne	PAPA1_CARPA	35	42
CS[C@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113380	GG	On-Demand	Anodyne	BACE2	61	46
CS[C@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113380	GG	On-Demand	Anodyne	REN	85	50
CS[C@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113380	GG	On-Demand	Anodyne	REN1	20	44
CS[C@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113380	GG	On-Demand	Anodyne	BACE1	91	49
CS[C@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113380	GG	On-Demand	Anodyne	FPR1	51	40
CS[C@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113380	GG	On-Demand	Anodyne	PLM1_PLAFA	31	40
CS[C@H]1CC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113382	GG	On-Demand	Anodyne	CTSD	101	46
CS[C@H]1CC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113382	GG	On-Demand	Anodyne	PGC	60	38
CS[C@H]1CC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113382	GG	On-Demand	Anodyne	PAPA1_CARPA	35	42
CS[C@H]1CC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113382	GG	On-Demand	Anodyne	BACE2	61	46
CS[C@H]1CC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113382	GG	On-Demand	Anodyne	REN	85	50
CS[C@H]1CC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113382	GG	On-Demand	Anodyne	REN1	20	44
CS[C@H]1CC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113382	GG	On-Demand	Anodyne	BACE1	91	49
CS[C@H]1CC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113382	GG	On-Demand	Anodyne	FPR1	51	40
CS[C@H]1CC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819113382	GG	On-Demand	Anodyne	PLM1_PLAFA	31	40
C[C@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccc(F)cc1	ZINC000819113387	DG	On-Demand	Anodyne	ADRB2	21	40
C[C@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccc(F)cc1	ZINC000819113387	DG	On-Demand	Anodyne	ADRB1	29	45
C[C@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccc(F)cc1	ZINC000819113387	DG	On-Demand	Anodyne	ADRB3	44	45
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccc(F)cc1	ZINC000819113388	DG	On-Demand	Anodyne	ADRB2	21	40
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccc(F)cc1	ZINC000819113388	DG	On-Demand	Anodyne	ADRB1	29	45
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccc(F)cc1	ZINC000819113388	DG	On-Demand	Anodyne	ADRB3	44	45
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccc(F)cc1	ZINC000819113390	DG	On-Demand	Anodyne	ADRB2	21	40
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccc(F)cc1	ZINC000819113390	DG	On-Demand	Anodyne	ADRB1	29	45
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccc(F)cc1	ZINC000819113390	DG	On-Demand	Anodyne	ADRB3	44	45
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccc(F)cc1	ZINC000819113392	DG	On-Demand	Anodyne	ADRB2	21	40
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccc(F)cc1	ZINC000819113392	DG	On-Demand	Anodyne	ADRB1	29	45
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccc(F)cc1	ZINC000819113392	DG	On-Demand	Anodyne	ADRB3	44	45
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3cccc([N+](=O)[O-])c3)C2)cc1	ZINC000819113400	GF	On-Demand	Bother	ADRB2	23	42
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3cccc([N+](=O)[O-])c3)C2)cc1	ZINC000819113400	GF	On-Demand	Bother	ADRB1	20	42
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3cccc([N+](=O)[O-])c3)C2)cc1	ZINC000819113400	GF	On-Demand	Bother	ADRB3	20	40
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3cccc([N+](=O)[O-])c3)C2)cc1	ZINC000819113402	GF	On-Demand	Bother	ADRB2	23	42
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3cccc([N+](=O)[O-])c3)C2)cc1	ZINC000819113402	GF	On-Demand	Bother	ADRB1	20	42
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3cccc([N+](=O)[O-])c3)C2)cc1	ZINC000819113402	GF	On-Demand	Bother	ADRB3	20	40
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccnc2)c1	ZINC000819113411	DE	On-Demand	Anodyne	ADRB2	34	46
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccnc2)c1	ZINC000819113411	DE	On-Demand	Anodyne	ADRB1	45	52
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccnc2)c1	ZINC000819113411	DE	On-Demand	Anodyne	ADRB3	113	52
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccnc2)c1	ZINC000819113411	DE	On-Demand	Anodyne	KCNA5	19	41
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccnc2)c1	ZINC000819113411	DE	On-Demand	Anodyne	MTNR1A	25	52
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccnc2)c1	ZINC000819113411	DE	On-Demand	Anodyne	MTNR1B	27	52
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccnc2)c1	ZINC000819113412	DE	On-Demand	Anodyne	ADRB2	34	46
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccnc2)c1	ZINC000819113412	DE	On-Demand	Anodyne	ADRB1	45	52
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccnc2)c1	ZINC000819113412	DE	On-Demand	Anodyne	ADRB3	113	52
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccnc2)c1	ZINC000819113412	DE	On-Demand	Anodyne	KCNA5	19	41
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccnc2)c1	ZINC000819113412	DE	On-Demand	Anodyne	MTNR1A	25	52
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccnc2)c1	ZINC000819113412	DE	On-Demand	Anodyne	MTNR1B	27	52
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccnc2)c1	ZINC000819113414	DE	On-Demand	Anodyne	ADRB2	34	46
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccnc2)c1	ZINC000819113414	DE	On-Demand	Anodyne	ADRB1	45	52
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccnc2)c1	ZINC000819113414	DE	On-Demand	Anodyne	ADRB3	113	52
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccnc2)c1	ZINC000819113414	DE	On-Demand	Anodyne	KCNA5	19	41
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccnc2)c1	ZINC000819113414	DE	On-Demand	Anodyne	MTNR1A	25	52
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccnc2)c1	ZINC000819113414	DE	On-Demand	Anodyne	MTNR1B	27	52
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccnc2)c1	ZINC000819113416	DE	On-Demand	Anodyne	ADRB2	34	46
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccnc2)c1	ZINC000819113416	DE	On-Demand	Anodyne	ADRB1	45	52
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccnc2)c1	ZINC000819113416	DE	On-Demand	Anodyne	ADRB3	113	52
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccnc2)c1	ZINC000819113416	DE	On-Demand	Anodyne	KCNA5	19	41
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccnc2)c1	ZINC000819113416	DE	On-Demand	Anodyne	MTNR1A	25	52
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccnc2)c1	ZINC000819113416	DE	On-Demand	Anodyne	MTNR1B	27	52
C[C@@H](CNC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)Oc1ccc(F)cc1	ZINC000819113417	GG	On-Demand	Anodyne	GPR119	27	41
C[C@H](CNC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)Oc1ccc(F)cc1	ZINC000819113420	GG	On-Demand	Anodyne	GPR119	27	41
C[C@H](CNC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)Oc1ccc(F)cc1	ZINC000819113422	GG	On-Demand	Anodyne	GPR119	27	41
C[C@@H](CNC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)Oc1ccc(F)cc1	ZINC000819113424	GG	On-Demand	Anodyne	GPR119	27	41
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccccc1F	ZINC000819113427	DH	On-Demand	Anodyne	ADRB2	18	44
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccccc1F	ZINC000819113427	DH	On-Demand	Anodyne	ADRB1	39	46
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccccc1F	ZINC000819113427	DH	On-Demand	Anodyne	ADRB3	61	46
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccccc1F	ZINC000819113428	DH	On-Demand	Anodyne	ADRB2	18	44
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccccc1F	ZINC000819113428	DH	On-Demand	Anodyne	ADRB1	39	46
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccccc1F	ZINC000819113428	DH	On-Demand	Anodyne	ADRB3	61	46
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccccc1F	ZINC000819113430	DH	On-Demand	Anodyne	ADRB2	18	44
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccccc1F	ZINC000819113430	DH	On-Demand	Anodyne	ADRB1	39	46
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)Oc1ccccc1F	ZINC000819113430	DH	On-Demand	Anodyne	ADRB3	61	46
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccccc1F	ZINC000819113431	DH	On-Demand	Anodyne	ADRB2	18	44
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccccc1F	ZINC000819113431	DH	On-Demand	Anodyne	ADRB1	39	46
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)Oc1ccccc1F	ZINC000819113431	DH	On-Demand	Anodyne	ADRB3	61	46
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccc4c(c3)OCO4)C2)cc1	ZINC000819113446	GF	On-Demand	Anodyne	ADRB2	23	42
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COc3ccc4c(c3)OCO4)C2)cc1	ZINC000819113446	GF	On-Demand	Anodyne	ADRB3	18	42
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccc4c(c3)OCO4)C2)cc1	ZINC000819113448	GF	On-Demand	Anodyne	ADRB2	23	42
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COc3ccc4c(c3)OCO4)C2)cc1	ZINC000819113448	GF	On-Demand	Anodyne	ADRB3	18	42
O=C(O)[C@H](CNS(=O)(=O)c1ccc(F)cc1C(F)(F)F)C1CCOCC1	ZINC000819113458	GE	On-Demand	Anodyne	SFRP1	78	36
O=C(O)[C@H](CNS(=O)(=O)c1ccc(F)cc1C(F)(F)F)C1CCOCC1	ZINC000819113458	GE	On-Demand	Anodyne	WNT3	43	36
O=C(O)[C@@H](CNS(=O)(=O)c1ccc(F)cc1C(F)(F)F)C1CCOCC1	ZINC000819113460	GE	On-Demand	Anodyne	SFRP1	78	36
O=C(O)[C@@H](CNS(=O)(=O)c1ccc(F)cc1C(F)(F)F)C1CCOCC1	ZINC000819113460	GE	On-Demand	Anodyne	WNT3	43	36
C[C@@H](CNCCC(=O)Nc1ccc(N(C)C)cc1)Oc1ccc(F)cc1	ZINC000819113470	FG	On-Demand	Anodyne	NPY5R	19	40
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113471	DG	On-Demand	Anodyne	ADRB2	36	47
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113471	DG	On-Demand	Anodyne	ADRB1	61	49
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113471	DG	On-Demand	Anodyne	ADRB3	83	48
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113471	DG	On-Demand	Anodyne	AOC3	15	40
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113471	DG	On-Demand	Anodyne	PDS	43	45
C[C@H](CNCCC(=O)Nc1ccc(N(C)C)cc1)Oc1ccc(F)cc1	ZINC000819113472	FG	On-Demand	Anodyne	NPY5R	19	40
C[C@H](CNC[C@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113473	DG	On-Demand	Anodyne	ADRB2	36	47
C[C@H](CNC[C@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113473	DG	On-Demand	Anodyne	ADRB1	61	49
C[C@H](CNC[C@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113473	DG	On-Demand	Anodyne	ADRB3	83	48
C[C@H](CNC[C@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113473	DG	On-Demand	Anodyne	AOC3	15	40
C[C@H](CNC[C@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113473	DG	On-Demand	Anodyne	PDS	43	45
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113475	DG	On-Demand	Anodyne	ADRB2	36	47
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113475	DG	On-Demand	Anodyne	ADRB1	61	49
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113475	DG	On-Demand	Anodyne	ADRB3	83	48
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113475	DG	On-Demand	Anodyne	AOC3	15	40
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113475	DG	On-Demand	Anodyne	PDS	43	45
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113476	DG	On-Demand	Anodyne	ADRB2	36	47
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113476	DG	On-Demand	Anodyne	ADRB1	61	49
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113476	DG	On-Demand	Anodyne	ADRB3	83	48
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113476	DG	On-Demand	Anodyne	AOC3	15	40
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(Cl)c1	ZINC000819113476	DG	On-Demand	Anodyne	PDS	43	45
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113495	GG	On-Demand	Anodyne	ADRB2	39	53
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113495	GG	On-Demand	Anodyne	ADRB1	57	53
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113495	GG	On-Demand	Anodyne	ADRB3	40	44
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113498	GG	On-Demand	Anodyne	ADRB2	39	53
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113498	GG	On-Demand	Anodyne	ADRB1	57	53
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113498	GG	On-Demand	Anodyne	ADRB3	40	44
COCCc1ccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113500	GG	On-Demand	Anodyne	ADRB2	39	53
COCCc1ccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113500	GG	On-Demand	Anodyne	ADRB1	57	53
COCCc1ccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113500	GG	On-Demand	Anodyne	ADRB3	40	44
COCCc1ccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113501	GG	On-Demand	Anodyne	ADRB2	39	53
COCCc1ccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113501	GG	On-Demand	Anodyne	ADRB1	57	53
COCCc1ccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113501	GG	On-Demand	Anodyne	ADRB3	40	44
O=C(/C=C/[C@H]1CCCO1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000819113533	ED	On-Demand	Bother	SSTR1	42	41
O=C(/C=C/[C@@H]1CCCO1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000819113534	ED	On-Demand	Bother	SSTR1	42	41
O=C(/C=C\[C@H]1CCCO1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000819113535	ED	On-Demand	Bother	SSTR1	42	41
O=C(/C=C\[C@@H]1CCCO1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000819113536	ED	On-Demand	Bother	SSTR1	42	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113554	EF	On-Demand	Anodyne	ADRB2	42	43
CC(=O)c1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113554	EF	On-Demand	Anodyne	ADRB1	69	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113554	EF	On-Demand	Anodyne	ADRB3	36	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113554	EF	On-Demand	Anodyne	ABCB1	25	54
CC(=O)c1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113555	EF	On-Demand	Anodyne	ADRB2	42	43
CC(=O)c1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113555	EF	On-Demand	Anodyne	ADRB1	69	40
CC(=O)c1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113555	EF	On-Demand	Anodyne	ADRB3	36	40
CC(=O)c1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113555	EF	On-Demand	Anodyne	ABCB1	25	54
CS[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819113578	CG	On-Demand	Anodyne	ADRB1	31	45
CS[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819113578	CG	On-Demand	Anodyne	ADRB3	49	47
CS[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819113578	CG	On-Demand	Anodyne	CYP3A4	41	35
CS[C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819113581	CG	On-Demand	Anodyne	ADRB1	31	45
CS[C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819113581	CG	On-Demand	Anodyne	ADRB3	49	47
CS[C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819113581	CG	On-Demand	Anodyne	CYP3A4	41	35
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(Cl)c1	ZINC000819113604	FG	On-Demand	Bother	ADRB1	40	46
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(Cl)c1	ZINC000819113604	FG	On-Demand	Bother	ADRB3	65	46
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(Cl)c1	ZINC000819113604	FG	On-Demand	Bother	CACNA1D	56	34
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(Cl)c1	ZINC000819113607	FG	On-Demand	Bother	ADRB1	40	46
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(Cl)c1	ZINC000819113607	FG	On-Demand	Bother	ADRB3	65	46
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(Cl)c1	ZINC000819113607	FG	On-Demand	Bother	CACNA1D	56	34
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(Cl)c1	ZINC000819113609	FG	On-Demand	Bother	ADRB1	40	46
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(Cl)c1	ZINC000819113609	FG	On-Demand	Bother	ADRB3	65	46
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(Cl)c1	ZINC000819113609	FG	On-Demand	Bother	CACNA1D	56	34
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(Cl)c1	ZINC000819113611	FG	On-Demand	Bother	ADRB1	40	46
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(Cl)c1	ZINC000819113611	FG	On-Demand	Bother	ADRB3	65	46
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(Cl)c1	ZINC000819113611	FG	On-Demand	Bother	CACNA1D	56	34
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](SC)C2)cc1	ZINC000819113612	EE	On-Demand	Anodyne	ADRB2	38	46
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](SC)C2)cc1	ZINC000819113612	EE	On-Demand	Anodyne	ADRB1	56	43
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](SC)C2)cc1	ZINC000819113612	EE	On-Demand	Anodyne	ADRB3	38	45
CN(CC1CC1)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819113613	GF	On-Demand	Anodyne	HTR1D	40	47
CN(CC1CC1)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819113613	GF	On-Demand	Anodyne	HTR1B	33	47
CN(CC1CC1)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819113613	GF	On-Demand	Anodyne	HTR1F	87	44
CN(CC1CC1)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819113613	GF	On-Demand	Anodyne	CCR2	21	42
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](SC)C2)cc1	ZINC000819113614	EE	On-Demand	Anodyne	ADRB2	38	46
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](SC)C2)cc1	ZINC000819113614	EE	On-Demand	Anodyne	ADRB1	56	43
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](SC)C2)cc1	ZINC000819113614	EE	On-Demand	Anodyne	ADRB3	38	45
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC[C@H](SC)C2)cc1	ZINC000819113616	EE	On-Demand	Anodyne	ADRB2	38	46
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC[C@H](SC)C2)cc1	ZINC000819113616	EE	On-Demand	Anodyne	ADRB1	56	43
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC[C@H](SC)C2)cc1	ZINC000819113616	EE	On-Demand	Anodyne	ADRB3	38	45
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](SC)C2)cc1	ZINC000819113618	EE	On-Demand	Anodyne	ADRB2	38	46
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](SC)C2)cc1	ZINC000819113618	EE	On-Demand	Anodyne	ADRB1	56	43
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](SC)C2)cc1	ZINC000819113618	EE	On-Demand	Anodyne	ADRB3	38	45
CS[C@H]1CC[C@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819113620	CE	On-Demand	Anodyne	ADRB2	16	42
CS[C@H]1CC[C@@H](NC[C@H](O)COCc2ccccc2)C1	ZINC000819113622	CE	On-Demand	Anodyne	ADRB2	16	42
COCCc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113623	EF	On-Demand	Anodyne	ADRB2	47	56
COCCc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113623	EF	On-Demand	Anodyne	ADRB1	74	56
COCCc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113623	EF	On-Demand	Anodyne	GRIN1	15	42
COCCc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113623	EF	On-Demand	Anodyne	ADRB3	46	46
COCCc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113624	EF	On-Demand	Anodyne	ADRB2	47	56
COCCc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113624	EF	On-Demand	Anodyne	ADRB1	74	56
COCCc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113624	EF	On-Demand	Anodyne	GRIN1	15	42
COCCc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819113624	EF	On-Demand	Anodyne	ADRB3	46	46
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819113641	EG	On-Demand	Anodyne	ADRB1	24	40
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819113641	EG	On-Demand	Anodyne	ADRB3	38	40
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819113641	EG	On-Demand	Anodyne	MTNR1A	25	52
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819113641	EG	On-Demand	Anodyne	MTNR1B	27	52
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819113642	EG	On-Demand	Anodyne	ADRB1	24	40
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819113642	EG	On-Demand	Anodyne	ADRB3	38	40
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819113642	EG	On-Demand	Anodyne	MTNR1A	25	52
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819113642	EG	On-Demand	Anodyne	MTNR1B	27	52
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819113643	EG	On-Demand	Anodyne	ADRB1	24	40
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819113643	EG	On-Demand	Anodyne	ADRB3	38	40
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819113643	EG	On-Demand	Anodyne	MTNR1A	25	52
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819113643	EG	On-Demand	Anodyne	MTNR1B	27	52
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819113644	EG	On-Demand	Anodyne	ADRB1	24	40
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819113644	EG	On-Demand	Anodyne	ADRB3	38	40
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819113644	EG	On-Demand	Anodyne	MTNR1A	25	52
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819113644	EG	On-Demand	Anodyne	MTNR1B	27	52
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819113650	EG	On-Demand	Anodyne	MTNR1A	23	51
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819113650	EG	On-Demand	Anodyne	MTNR1B	25	51
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819113651	EG	On-Demand	Anodyne	MTNR1A	23	51
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819113651	EG	On-Demand	Anodyne	MTNR1B	25	51
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819113652	EG	On-Demand	Anodyne	MTNR1A	23	51
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819113652	EG	On-Demand	Anodyne	MTNR1B	25	51
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819113653	EG	On-Demand	Anodyne	MTNR1A	23	51
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819113653	EG	On-Demand	Anodyne	MTNR1B	25	51
Cn1cnc(S(=O)(=O)N2CCC(c3c[nH]c4ccc(C(=O)O)cc34)CC2)c1	ZINC000819113654	GE	On-Demand	Anodyne	HTR1D	31	45
Cn1cnc(S(=O)(=O)N2CCC(c3c[nH]c4ccc(C(=O)O)cc34)CC2)c1	ZINC000819113654	GE	On-Demand	Anodyne	HTR1B	27	45
Cn1cnc(S(=O)(=O)N2CCC(c3c[nH]c4ccc(C(=O)O)cc34)CC2)c1	ZINC000819113654	GE	On-Demand	Anodyne	HTR1F	93	45
Cn1cnc(S(=O)(=O)N2CCC(c3c[nH]c4ccc(C(=O)O)cc34)CC2)c1	ZINC000819113654	GE	On-Demand	Anodyne	CCR2	18	44
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)c3cccnc3)C2)cc1	ZINC000819113658	DF	On-Demand	Anodyne	ADRB3	79	51
Cc1ccc(N2CCC[C@@H](NC[C@H](O)c3cccnc3)C2)cc1	ZINC000819113659	DF	On-Demand	Anodyne	ADRB3	79	51
COc1cccc(O[C@@H](C)CNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819113685	FG	On-Demand	Anodyne	ADRB1	15	43
COc1cccc(O[C@@H](C)CNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819113685	FG	On-Demand	Anodyne	LTA4H	32	42
COc1cccc(O[C@@H](C)CNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819113685	FG	On-Demand	Anodyne	MTNR1A	44	54
COc1cccc(O[C@@H](C)CNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819113685	FG	On-Demand	Anodyne	MTNR1B	43	54
COc1cccc(O[C@@H](C)CNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819113685	FG	On-Demand	Anodyne	ACR	16	41
COc1cccc(O[C@H](C)CNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819113686	FG	On-Demand	Anodyne	ADRB1	15	43
COc1cccc(O[C@H](C)CNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819113686	FG	On-Demand	Anodyne	LTA4H	32	42
COc1cccc(O[C@H](C)CNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819113686	FG	On-Demand	Anodyne	MTNR1A	44	54
COc1cccc(O[C@H](C)CNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819113686	FG	On-Demand	Anodyne	MTNR1B	43	54
COc1cccc(O[C@H](C)CNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819113686	FG	On-Demand	Anodyne	ACR	16	41
Cc1ccc(N2CCC[C@@H](NCCS(=O)(=O)c3ccccc3)C2)cc1	ZINC000819113687	FG	On-Demand	Anodyne	ITGA4	27	40
C[C@H](CNC[C@](C)(O)CNC(=O)OC(C)(C)C)Oc1cccc(Cl)c1	ZINC000819113697	FF	On-Demand	Anodyne	PDS	60	38
C[C@H](CNC[C@@](C)(O)CNC(=O)OC(C)(C)C)Oc1cccc(Cl)c1	ZINC000819113698	FF	On-Demand	Anodyne	PDS	60	38
C[C@@H](CNC[C@@](C)(O)CNC(=O)OC(C)(C)C)Oc1cccc(Cl)c1	ZINC000819113699	FF	On-Demand	Anodyne	PDS	60	38
C[C@@H](CNC[C@](C)(O)CNC(=O)OC(C)(C)C)Oc1cccc(Cl)c1	ZINC000819113700	FF	On-Demand	Anodyne	PDS	60	38
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819113701	FH	On-Demand	Anodyne	ADRB1	24	40
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819113701	FH	On-Demand	Anodyne	ADRB3	38	40
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819113701	FH	On-Demand	Anodyne	MTNR1A	19	49
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819113701	FH	On-Demand	Anodyne	MTNR1B	19	49
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819113702	FH	On-Demand	Anodyne	ADRB1	24	40
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819113702	FH	On-Demand	Anodyne	ADRB3	38	40
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819113702	FH	On-Demand	Anodyne	MTNR1A	19	49
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819113702	FH	On-Demand	Anodyne	MTNR1B	19	49
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819113703	FH	On-Demand	Anodyne	ADRB1	24	40
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819113703	FH	On-Demand	Anodyne	ADRB3	38	40
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819113703	FH	On-Demand	Anodyne	MTNR1A	19	49
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819113703	FH	On-Demand	Anodyne	MTNR1B	19	49
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819113704	FH	On-Demand	Anodyne	ADRB1	24	40
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819113704	FH	On-Demand	Anodyne	ADRB3	38	40
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819113704	FH	On-Demand	Anodyne	MTNR1A	19	49
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819113704	FH	On-Demand	Anodyne	MTNR1B	19	49
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C[C@@H]4CCCO4)CC3)c2c1	ZINC000819113709	GF	On-Demand	Anodyne	HTR1D	28	43
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C[C@@H]4CCCO4)CC3)c2c1	ZINC000819113709	GF	On-Demand	Anodyne	HTR1B	22	42
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C[C@@H]4CCCO4)CC3)c2c1	ZINC000819113709	GF	On-Demand	Anodyne	HTR1F	73	42
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C[C@@H]4CCCO4)CC3)c2c1	ZINC000819113709	GF	On-Demand	Anodyne	CCR2	19	44
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C[C@H]4CCCO4)CC3)c2c1	ZINC000819113710	GF	On-Demand	Anodyne	HTR1D	28	43
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C[C@H]4CCCO4)CC3)c2c1	ZINC000819113710	GF	On-Demand	Anodyne	HTR1B	22	42
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C[C@H]4CCCO4)CC3)c2c1	ZINC000819113710	GF	On-Demand	Anodyne	HTR1F	73	42
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C[C@H]4CCCO4)CC3)c2c1	ZINC000819113710	GF	On-Demand	Anodyne	CCR2	19	44
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113711	GF	On-Demand	Anodyne	ADRB2	37	44
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113711	GF	On-Demand	Anodyne	ADRB1	50	40
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113711	GF	On-Demand	Anodyne	ADRB3	37	44
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113712	GF	On-Demand	Anodyne	ADRB2	37	44
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113712	GF	On-Demand	Anodyne	ADRB1	50	40
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113712	GF	On-Demand	Anodyne	ADRB3	37	44
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113713	GF	On-Demand	Anodyne	ADRB2	37	44
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113713	GF	On-Demand	Anodyne	ADRB1	50	40
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113713	GF	On-Demand	Anodyne	ADRB3	37	44
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113714	GF	On-Demand	Anodyne	ADRB2	37	44
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113714	GF	On-Demand	Anodyne	ADRB1	50	40
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819113714	GF	On-Demand	Anodyne	ADRB3	37	44
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819113717	EG	On-Demand	Anodyne	ADRB2	27	49
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819113717	EG	On-Demand	Anodyne	ADRB1	49	51
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819113717	EG	On-Demand	Anodyne	ADRB3	72	52
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819113717	EG	On-Demand	Anodyne	MTNR1A	29	53
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819113717	EG	On-Demand	Anodyne	MTNR1B	30	53
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819113718	EG	On-Demand	Anodyne	ADRB2	27	49
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819113718	EG	On-Demand	Anodyne	ADRB1	49	51
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819113718	EG	On-Demand	Anodyne	ADRB3	72	52
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819113718	EG	On-Demand	Anodyne	MTNR1A	29	53
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819113718	EG	On-Demand	Anodyne	MTNR1B	30	53
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819113729	EG	On-Demand	Anodyne	ADRB2	41	57
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819113729	EG	On-Demand	Anodyne	ADRB1	36	57
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819113729	EG	On-Demand	Anodyne	ADRB3	24	57
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819113729	EG	On-Demand	Anodyne	CYP2D6	15	42
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819113731	EG	On-Demand	Anodyne	ADRB2	41	57
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819113731	EG	On-Demand	Anodyne	ADRB1	36	57
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819113731	EG	On-Demand	Anodyne	ADRB3	24	57
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819113731	EG	On-Demand	Anodyne	CYP2D6	15	42
C[C@H](CNC[C@H](O)c1ccc(F)cc1)Oc1ccc(F)cc1	ZINC000819113769	DG	On-Demand	Anodyne	AOC3	16	44
C[C@@H](CNC[C@H](O)c1ccc(F)cc1)Oc1ccc(F)cc1	ZINC000819113770	DG	On-Demand	Anodyne	AOC3	16	44
C[C@H](CNC[C@@H](O)c1ccc(F)cc1)Oc1ccc(F)cc1	ZINC000819113771	DG	On-Demand	Anodyne	AOC3	16	44
C[C@@H](CNC[C@@H](O)c1ccc(F)cc1)Oc1ccc(F)cc1	ZINC000819113772	DG	On-Demand	Anodyne	AOC3	16	44
CS[C@@H]1CC[C@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819113793	EE	On-Demand	Anodyne	ADRB2	43	58
CS[C@@H]1CC[C@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819113793	EE	On-Demand	Anodyne	ADRB1	75	58
CS[C@@H]1CC[C@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819113793	EE	On-Demand	Anodyne	ADRB3	51	48
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819113794	EE	On-Demand	Anodyne	ADRB2	43	58
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819113794	EE	On-Demand	Anodyne	ADRB1	75	58
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819113794	EE	On-Demand	Anodyne	ADRB3	51	48
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819113819	EG	On-Demand	Anodyne	ADRB2	27	49
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819113819	EG	On-Demand	Anodyne	ADRB1	49	51
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819113819	EG	On-Demand	Anodyne	ADRB3	72	52
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819113819	EG	On-Demand	Anodyne	MTNR1A	29	53
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819113819	EG	On-Demand	Anodyne	MTNR1B	30	53
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819113820	EG	On-Demand	Anodyne	ADRB2	27	49
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819113820	EG	On-Demand	Anodyne	ADRB1	49	51
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819113820	EG	On-Demand	Anodyne	ADRB3	72	52
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819113820	EG	On-Demand	Anodyne	MTNR1A	29	53
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819113820	EG	On-Demand	Anodyne	MTNR1B	30	53
COCCCS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819113833	GE	On-Demand	Anodyne	HTR1A	15	46
COCCCS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819113833	GE	On-Demand	Anodyne	HTR1D	38	46
COCCCS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819113833	GE	On-Demand	Anodyne	HTR1B	31	46
COCCCS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819113833	GE	On-Demand	Anodyne	HTR1F	93	46
COCCCS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819113833	GE	On-Demand	Anodyne	CCR2	21	42
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)N4CCOCC4)CC3)c2c1	ZINC000819113836	GD	On-Demand	Anodyne	HTR1D	32	46
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)N4CCOCC4)CC3)c2c1	ZINC000819113836	GD	On-Demand	Anodyne	HTR1B	26	45
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)N4CCOCC4)CC3)c2c1	ZINC000819113836	GD	On-Demand	Anodyne	HTR1F	87	45
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)N4CCOCC4)CC3)c2c1	ZINC000819113836	GD	On-Demand	Anodyne	CCR2	26	45
O=C(O)[C@H](CNS(=O)(=O)c1ccc(OC2CCCC2)cc1)C1CCOCC1	ZINC000819113837	GE	On-Demand	Anodyne	MMP13	28	40
O=C(O)[C@H](CNS(=O)(=O)c1ccc(OC2CCCC2)cc1)C1CCOCC1	ZINC000819113837	GE	On-Demand	Anodyne	MMP2	20	40
O=C(O)[C@@H](CNS(=O)(=O)c1ccc(OC2CCCC2)cc1)C1CCOCC1	ZINC000819113838	GE	On-Demand	Anodyne	MMP13	28	40
O=C(O)[C@@H](CNS(=O)(=O)c1ccc(OC2CCCC2)cc1)C1CCOCC1	ZINC000819113838	GE	On-Demand	Anodyne	MMP2	20	40
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccccc2Br)c1	ZINC000819113843	GH	On-Demand	Anodyne	MTNR1A	28	53
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccccc2Br)c1	ZINC000819113843	GH	On-Demand	Anodyne	MTNR1B	29	53
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccccc2Br)c1	ZINC000819113844	GH	On-Demand	Anodyne	MTNR1A	28	53
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccccc2Br)c1	ZINC000819113844	GH	On-Demand	Anodyne	MTNR1B	29	53
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccccc2Br)c1	ZINC000819113845	GH	On-Demand	Anodyne	MTNR1A	28	53
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccccc2Br)c1	ZINC000819113845	GH	On-Demand	Anodyne	MTNR1B	29	53
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccccc2Br)c1	ZINC000819113846	GH	On-Demand	Anodyne	MTNR1A	28	53
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccccc2Br)c1	ZINC000819113846	GH	On-Demand	Anodyne	MTNR1B	29	53
Cn1cc(S(=O)(=O)N2CCC(c3c[nH]c4ccc(C(=O)O)cc34)CC2)cn1	ZINC000819113889	GE	On-Demand	Anodyne	HTR1D	37	45
Cn1cc(S(=O)(=O)N2CCC(c3c[nH]c4ccc(C(=O)O)cc34)CC2)cn1	ZINC000819113889	GE	On-Demand	Anodyne	HTR1B	30	45
Cn1cc(S(=O)(=O)N2CCC(c3c[nH]c4ccc(C(=O)O)cc34)CC2)cn1	ZINC000819113889	GE	On-Demand	Anodyne	HTR1F	96	45
Cn1cc(S(=O)(=O)N2CCC(c3c[nH]c4ccc(C(=O)O)cc34)CC2)cn1	ZINC000819113889	GE	On-Demand	Anodyne	CCR2	22	45
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)N4CCCC4)CC3)c2c1	ZINC000819113892	GE	On-Demand	Anodyne	HTR1A	15	47
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)N4CCCC4)CC3)c2c1	ZINC000819113892	GE	On-Demand	Anodyne	HTR1D	38	47
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)N4CCCC4)CC3)c2c1	ZINC000819113892	GE	On-Demand	Anodyne	HTR1B	31	47
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)N4CCCC4)CC3)c2c1	ZINC000819113892	GE	On-Demand	Anodyne	SLC6A4	15	42
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)N4CCCC4)CC3)c2c1	ZINC000819113892	GE	On-Demand	Anodyne	HTR1F	95	47
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)N4CCCC4)CC3)c2c1	ZINC000819113892	GE	On-Demand	Anodyne	CCR2	28	47
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)N4CCCC4)CC3)c2c1	ZINC000819113892	GE	On-Demand	Anodyne	L3MBTL3	53	36
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113893	GG	On-Demand	Anodyne	ADRB2	28	43
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113893	GG	On-Demand	Anodyne	ADRB1	33	43
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113893	GG	On-Demand	Anodyne	ADRB3	32	43
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113893	GG	On-Demand	Anodyne	ACOX1	50	33
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113893	GG	On-Demand	Anodyne	ABCB1	29	48
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113894	GG	On-Demand	Anodyne	ADRB2	28	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113894	GG	On-Demand	Anodyne	ADRB1	33	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113894	GG	On-Demand	Anodyne	ADRB3	32	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113894	GG	On-Demand	Anodyne	ACOX1	50	33
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113894	GG	On-Demand	Anodyne	ABCB1	29	48
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113895	GG	On-Demand	Anodyne	ADRB2	28	43
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113895	GG	On-Demand	Anodyne	ADRB1	33	43
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113895	GG	On-Demand	Anodyne	ADRB3	32	43
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113895	GG	On-Demand	Anodyne	ACOX1	50	33
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113895	GG	On-Demand	Anodyne	ABCB1	29	48
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113896	GG	On-Demand	Anodyne	ADRB2	28	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113896	GG	On-Demand	Anodyne	ADRB1	33	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113896	GG	On-Demand	Anodyne	ADRB3	32	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113896	GG	On-Demand	Anodyne	ACOX1	50	33
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819113896	GG	On-Demand	Anodyne	ABCB1	29	48
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CC4CC4)CC3)c2c1	ZINC000819113897	FF	On-Demand	Anodyne	HTR1D	35	46
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CC4CC4)CC3)c2c1	ZINC000819113897	FF	On-Demand	Anodyne	HTR1B	28	46
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CC4CC4)CC3)c2c1	ZINC000819113897	FF	On-Demand	Anodyne	HTR1F	89	45
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CC4CC4)CC3)c2c1	ZINC000819113897	FF	On-Demand	Anodyne	CCR2	22	45
Cc1ccc(N2CCC[C@@H](NC[C@H](O)c3ccccc3)C2)cc1	ZINC000819113915	DG	On-Demand	Anodyne	ADRB3	37	42
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)c3ccccc3)C2)cc1	ZINC000819113916	DG	On-Demand	Anodyne	ADRB3	37	42
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819113917	DG	On-Demand	Anodyne	ADRB2	22	44
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819113917	DG	On-Demand	Anodyne	ADRB3	42	36
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819113917	DG	On-Demand	Anodyne	MTNR1A	32	55
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819113917	DG	On-Demand	Anodyne	MTNR1B	31	55
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819113918	DG	On-Demand	Anodyne	ADRB2	22	44
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819113918	DG	On-Demand	Anodyne	ADRB3	42	36
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819113918	DG	On-Demand	Anodyne	MTNR1A	32	55
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819113918	DG	On-Demand	Anodyne	MTNR1B	31	55
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1F	ZINC000819113921	EF	On-Demand	Bother	ADRB3	41	35
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1F	ZINC000819113922	EF	On-Demand	Bother	ADRB3	41	35
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1F	ZINC000819113923	EF	On-Demand	Bother	ADRB3	41	35
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1F	ZINC000819113924	EF	On-Demand	Bother	ADRB3	41	35
C[C@@H](CNC[C@H](O)c1ccc(Cl)cc1)Oc1ccccc1F	ZINC000819113925	DH	On-Demand	Anodyne	ADRB1	17	40
C[C@H](CNC[C@H](O)c1ccc(Cl)cc1)Oc1ccccc1F	ZINC000819113926	DH	On-Demand	Anodyne	ADRB1	17	40
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1ccccc1F	ZINC000819113927	CF	On-Demand	Anodyne	ADRB1	21	40
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1ccccc1F	ZINC000819113927	CF	On-Demand	Anodyne	ADRB3	46	38
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1ccccc1F	ZINC000819113927	CF	On-Demand	Anodyne	AOC3	15	41
C[C@H](CNC[C@H](O)c1ccccc1)Oc1ccccc1F	ZINC000819113928	CF	On-Demand	Anodyne	ADRB1	21	40
C[C@H](CNC[C@H](O)c1ccccc1)Oc1ccccc1F	ZINC000819113928	CF	On-Demand	Anodyne	ADRB3	46	38
C[C@H](CNC[C@H](O)c1ccccc1)Oc1ccccc1F	ZINC000819113928	CF	On-Demand	Anodyne	AOC3	15	41
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1ccccc1F	ZINC000819113929	CF	On-Demand	Anodyne	ADRB1	21	40
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1ccccc1F	ZINC000819113929	CF	On-Demand	Anodyne	ADRB3	46	38
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1ccccc1F	ZINC000819113929	CF	On-Demand	Anodyne	AOC3	15	41
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1ccccc1F	ZINC000819113930	CF	On-Demand	Anodyne	ADRB1	21	40
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1ccccc1F	ZINC000819113930	CF	On-Demand	Anodyne	ADRB3	46	38
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1ccccc1F	ZINC000819113930	CF	On-Demand	Anodyne	AOC3	15	41
CS[C@@H]1CC[C@H](NC[C@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819113933	FF	On-Demand	Anodyne	ADRB2	44	43
CS[C@@H]1CC[C@H](NC[C@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819113933	FF	On-Demand	Anodyne	ADRB1	71	49
CS[C@@H]1CC[C@H](NC[C@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819113933	FF	On-Demand	Anodyne	ADRB3	51	41
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819113934	FF	On-Demand	Anodyne	ADRB2	44	43
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819113934	FF	On-Demand	Anodyne	ADRB1	71	49
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)C1	ZINC000819113934	FF	On-Demand	Anodyne	ADRB3	51	41
C[C@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1ccc(F)cc1	ZINC000819113983	FE	On-Demand	Anodyne	PTGS2	34	41
C[C@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1ccc(F)cc1	ZINC000819113984	FE	On-Demand	Anodyne	PTGS2	34	41
C[C@@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1ccc(F)cc1	ZINC000819113985	FE	On-Demand	Anodyne	PTGS2	34	41
C[C@@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1ccc(F)cc1	ZINC000819113986	FE	On-Demand	Anodyne	PTGS2	34	41
COc1cccc(OC)c1OC[C@@H](O)CNCc1c(C)cccc1F	ZINC000819114004	EF	On-Demand	Anodyne	ADRB2	25	46
COc1cccc(OC)c1OC[C@H](O)CNCc1c(C)cccc1F	ZINC000819114005	EF	On-Demand	Anodyne	ADRB2	25	46
C[C@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1ccc(F)cc1	ZINC000819114016	GG	On-Demand	Anodyne	GPR119	55	53
C[C@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1ccc(F)cc1	ZINC000819114017	GG	On-Demand	Anodyne	GPR119	55	53
C[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1ccc(F)cc1	ZINC000819114018	GG	On-Demand	Anodyne	GPR119	55	53
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819114019	DG	On-Demand	Anodyne	ADRB2	22	44
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819114019	DG	On-Demand	Anodyne	ADRB3	42	36
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819114019	DG	On-Demand	Anodyne	MTNR1A	32	55
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819114019	DG	On-Demand	Anodyne	MTNR1B	31	55
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819114020	DG	On-Demand	Anodyne	ADRB2	22	44
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819114020	DG	On-Demand	Anodyne	ADRB3	42	36
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819114020	DG	On-Demand	Anodyne	MTNR1A	32	55
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819114020	DG	On-Demand	Anodyne	MTNR1B	31	55
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccccc2Cl)c1	ZINC000819114041	EG	On-Demand	Anodyne	ADRB2	16	45
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccccc2Cl)c1	ZINC000819114041	EG	On-Demand	Anodyne	MTNR1A	30	53
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccccc2Cl)c1	ZINC000819114041	EG	On-Demand	Anodyne	MTNR1B	31	53
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccccc2Cl)c1	ZINC000819114042	EG	On-Demand	Anodyne	ADRB2	16	45
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccccc2Cl)c1	ZINC000819114042	EG	On-Demand	Anodyne	MTNR1A	30	53
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccccc2Cl)c1	ZINC000819114042	EG	On-Demand	Anodyne	MTNR1B	31	53
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CCC4CC4)CC3)c2c1	ZINC000819114052	GG	On-Demand	Anodyne	HTR1D	33	45
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CCC4CC4)CC3)c2c1	ZINC000819114052	GG	On-Demand	Anodyne	HTR1B	26	45
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CCC4CC4)CC3)c2c1	ZINC000819114052	GG	On-Demand	Anodyne	HTR1F	86	44
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CCC4CC4)CC3)c2c1	ZINC000819114052	GG	On-Demand	Anodyne	CCR2	22	44
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)Cc4ccccc4)CC3)c2c1	ZINC000819114053	GH	On-Demand	Anodyne	HTR1A	16	48
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)Cc4ccccc4)CC3)c2c1	ZINC000819114053	GH	On-Demand	Anodyne	HTR1D	45	47
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)Cc4ccccc4)CC3)c2c1	ZINC000819114053	GH	On-Demand	Anodyne	HTR1B	38	47
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)Cc4ccccc4)CC3)c2c1	ZINC000819114053	GH	On-Demand	Anodyne	SLC6A4	15	42
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)Cc4ccccc4)CC3)c2c1	ZINC000819114053	GH	On-Demand	Anodyne	HTR1F	93	44
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)Cc4ccccc4)CC3)c2c1	ZINC000819114053	GH	On-Demand	Anodyne	PTPN2	42	37
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)Cc4ccccc4)CC3)c2c1	ZINC000819114053	GH	On-Demand	Anodyne	CCR2	26	44
Cc1ccc(N2CCC[C@@H](NC[C@H](O)c3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000819114057	GF	On-Demand	Anodyne	ADRB3	21	43
Cc1ccc(N2CCC[C@@H](NC[C@H](O)c3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000819114057	GF	On-Demand	Anodyne	GPR119	19	41
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000819114059	GF	On-Demand	Anodyne	ADRB3	21	43
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000819114059	GF	On-Demand	Anodyne	GPR119	19	41
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)Cc3ccccc3)C2)cc1	ZINC000819114060	DG	On-Demand	Anodyne	ITGA4	30	40
Cc1ccc(N2CCC[C@@H](NC[C@H](O)Cc3ccccc3)C2)cc1	ZINC000819114063	DG	On-Demand	Anodyne	ITGA4	30	40
Cc1ccc(F)c(S(=O)(=O)NC[C@@H](C(=O)O)C2CCOCC2)c1	ZINC000819114076	ED	On-Demand	Anodyne	LEF	20	44
Cc1ccc(F)c(S(=O)(=O)NC[C@H](C(=O)O)C2CCOCC2)c1	ZINC000819114077	ED	On-Demand	Anodyne	LEF	20	44
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CCCF)CC3)c2c1	ZINC000819114078	FF	On-Demand	Anodyne	HTR1D	36	50
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CCCF)CC3)c2c1	ZINC000819114078	FF	On-Demand	Anodyne	HTR1B	29	50
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CCCF)CC3)c2c1	ZINC000819114078	FF	On-Demand	Anodyne	HTR1F	82	45
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CCCF)CC3)c2c1	ZINC000819114078	FF	On-Demand	Anodyne	CCR2	25	43
O=C(O)[C@H](CNS(=O)(=O)c1ccc(F)cc1)C1CCOCC1	ZINC000819114079	ED	On-Demand	Anodyne	MMP13	20	43
O=C(O)[C@H](CNS(=O)(=O)c1ccc(F)cc1)C1CCOCC1	ZINC000819114079	ED	On-Demand	Anodyne	MMP2	16	41
O=C(O)[C@@H](CNS(=O)(=O)c1ccc(F)cc1)C1CCOCC1	ZINC000819114080	ED	On-Demand	Anodyne	MMP13	20	43
O=C(O)[C@@H](CNS(=O)(=O)c1ccc(F)cc1)C1CCOCC1	ZINC000819114080	ED	On-Demand	Anodyne	MMP2	16	41
COc1cccc(O[C@H](C)CNC[C@H](O)C2CC2)c1	ZINC000819114097	CD	On-Demand	Anodyne	MTNR1A	46	60
COc1cccc(O[C@H](C)CNC[C@H](O)C2CC2)c1	ZINC000819114097	CD	On-Demand	Anodyne	MTNR1B	42	60
COc1cccc(O[C@H](C)CNC[C@@H](O)C2CC2)c1	ZINC000819114098	CD	On-Demand	Anodyne	MTNR1A	46	60
COc1cccc(O[C@H](C)CNC[C@@H](O)C2CC2)c1	ZINC000819114098	CD	On-Demand	Anodyne	MTNR1B	42	60
COc1cccc(O[C@@H](C)CNC[C@H](O)C2CC2)c1	ZINC000819114099	CD	On-Demand	Anodyne	MTNR1A	46	60
COc1cccc(O[C@@H](C)CNC[C@H](O)C2CC2)c1	ZINC000819114099	CD	On-Demand	Anodyne	MTNR1B	42	60
COc1cccc(O[C@@H](C)CNC[C@@H](O)C2CC2)c1	ZINC000819114100	CD	On-Demand	Anodyne	MTNR1A	46	60
COc1cccc(O[C@@H](C)CNC[C@@H](O)C2CC2)c1	ZINC000819114100	CD	On-Demand	Anodyne	MTNR1B	42	60
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819114103	EF	On-Demand	Mild	MTNR1A	21	51
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819114103	EF	On-Demand	Mild	MTNR1B	23	51
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819114104	EF	On-Demand	Mild	MTNR1A	21	51
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819114104	EF	On-Demand	Mild	MTNR1B	23	51
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819114105	EF	On-Demand	Mild	MTNR1A	21	51
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819114105	EF	On-Demand	Mild	MTNR1B	23	51
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819114106	EF	On-Demand	Mild	MTNR1A	21	51
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819114106	EF	On-Demand	Mild	MTNR1B	23	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(OC(F)F)c1	ZINC000819114117	EG	On-Demand	Anodyne	TAAR1	23	42
O=C(CC1CC1)NNC(=O)c1ccccc1NC(=O)c1ccccc1	ZINC000819114131	EE	On-Demand	Reactive	NR1H4	16	43
O=C(CC1CC1)NNC(=O)c1ccccc1NC(=O)c1ccccc1	ZINC000819114131	EE	On-Demand	Reactive	CCR8	56	39
O=C(CC1CC1)NNC(=O)c1ccccc1NC(=O)c1ccccc1	ZINC000819114131	EE	On-Demand	Reactive	KCNK3	47	38
C[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Oc1ccc(F)cc1	ZINC000819114133	GG	On-Demand	Anodyne	GPR119	55	53
CC(=O)CCc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819114144	FG	On-Demand	Anodyne	ADRB2	47	45
CC(=O)CCc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819114144	FG	On-Demand	Anodyne	ADRB1	81	46
CC(=O)CCc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819114144	FG	On-Demand	Anodyne	GRIN1	16	43
CC(=O)CCc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819114144	FG	On-Demand	Anodyne	ADRB3	51	45
CC(=O)CCc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819114144	FG	On-Demand	Anodyne	ABCB1	40	43
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819114146	FG	On-Demand	Anodyne	ADRB2	47	45
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819114146	FG	On-Demand	Anodyne	ADRB1	81	46
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819114146	FG	On-Demand	Anodyne	GRIN1	16	43
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819114146	FG	On-Demand	Anodyne	ADRB3	51	45
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819114146	FG	On-Demand	Anodyne	ABCB1	40	43
CSc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](SC)C2)cc1	ZINC000819114148	EG	On-Demand	Anodyne	ADRB2	32	42
CSc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](SC)C2)cc1	ZINC000819114148	EG	On-Demand	Anodyne	ADRB1	38	45
CSc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](SC)C2)cc1	ZINC000819114148	EG	On-Demand	Anodyne	ADRB3	25	43
CCCc1c(C(=O)NNC(=O)CC2CC2)cnn1-c1ccccc1	ZINC000819114149	EE	On-Demand	Reactive	GPR142	42	35
CSc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](SC)C2)cc1	ZINC000819114150	EG	On-Demand	Anodyne	ADRB2	32	42
CSc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](SC)C2)cc1	ZINC000819114150	EG	On-Demand	Anodyne	ADRB1	38	45
CSc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](SC)C2)cc1	ZINC000819114150	EG	On-Demand	Anodyne	ADRB3	25	43
CSc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](SC)C2)cc1	ZINC000819114151	EG	On-Demand	Anodyne	ADRB2	32	42
CSc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](SC)C2)cc1	ZINC000819114151	EG	On-Demand	Anodyne	ADRB1	38	45
CSc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](SC)C2)cc1	ZINC000819114151	EG	On-Demand	Anodyne	ADRB3	25	43
CSc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](SC)C2)cc1	ZINC000819114153	EG	On-Demand	Anodyne	ADRB2	32	42
CSc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](SC)C2)cc1	ZINC000819114153	EG	On-Demand	Anodyne	ADRB1	38	45
CSc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](SC)C2)cc1	ZINC000819114153	EG	On-Demand	Anodyne	ADRB3	25	43
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccc(F)cc1	ZINC000819114154	CE	On-Demand	Anodyne	ADRB2	26	48
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccc(F)cc1	ZINC000819114154	CE	On-Demand	Anodyne	ADRB1	30	48
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccc(F)cc1	ZINC000819114154	CE	On-Demand	Anodyne	ADRB3	98	48
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccc(F)cc1	ZINC000819114157	CE	On-Demand	Anodyne	ADRB2	26	48
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccc(F)cc1	ZINC000819114157	CE	On-Demand	Anodyne	ADRB1	30	48
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccc(F)cc1	ZINC000819114157	CE	On-Demand	Anodyne	ADRB3	98	48
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccc(F)cc1	ZINC000819114159	CE	On-Demand	Anodyne	ADRB2	26	48
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccc(F)cc1	ZINC000819114159	CE	On-Demand	Anodyne	ADRB1	30	48
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccc(F)cc1	ZINC000819114159	CE	On-Demand	Anodyne	ADRB3	98	48
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccc(F)cc1	ZINC000819114161	CE	On-Demand	Anodyne	ADRB2	26	48
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccc(F)cc1	ZINC000819114161	CE	On-Demand	Anodyne	ADRB1	30	48
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccc(F)cc1	ZINC000819114161	CE	On-Demand	Anodyne	ADRB3	98	48
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819114174	EG	On-Demand	Anodyne	ADRB2	24	42
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819114174	EG	On-Demand	Anodyne	ADRB1	21	42
CS[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819114174	EG	On-Demand	Anodyne	PDS	53	43
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819114175	EG	On-Demand	Anodyne	ADRB2	24	42
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819114175	EG	On-Demand	Anodyne	ADRB1	21	42
CS[C@@H]1CC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819114175	EG	On-Demand	Anodyne	PDS	53	43
O=C(CC1CC1)NNC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc3C2)c1	ZINC000819114176	HD	On-Demand	Reactive	PPARD	15	58
O=C(CC1CC1)NNC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc3C2)c1	ZINC000819114176	HD	On-Demand	Reactive	AKR1C3	94	66
O=C(CCOc1ccc(F)cc1)NNC(=O)CC1CC1	ZINC000819114180	CD	On-Demand	Reactive	LTA4H	16	44
O=C(CC1CC1)NNC(=O)c1ccc(C(=O)NC2CC2)cc1	ZINC000819114184	DD	On-Demand	Reactive	PLG	18	41
O=C(CC1CC1)NNC(=O)c1ccc(C(=O)NC2CC2)cc1	ZINC000819114184	DD	On-Demand	Reactive	MAPK11	31	49
O=C(CC1CC1)NNC(=O)c1ccc(C(=O)NC2CC2)cc1	ZINC000819114184	DD	On-Demand	Reactive	MAPK14	39	49
O=C(CC1CC1)NNC(=O)c1ccc(C(=O)NC2CC2)cc1	ZINC000819114184	DD	On-Demand	Reactive	ST14	18	41
O=C(CC1CC1)NNC(=O)c1ccc(C(=O)NC2CC2)cc1	ZINC000819114184	DD	On-Demand	Reactive	TTK	17	40
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(NC(=O)Cc2ccccc2F)c1	ZINC000819114217	GH	On-Demand	Anodyne	KCNQ2	53	39
O=C(CC1CC1)NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000819114218	EC	On-Demand	Reactive	SLC6A9	15	52
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(NC(=O)Cc2ccccc2F)c1	ZINC000819114219	GH	On-Demand	Anodyne	KCNQ2	53	39
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(NC(=O)Cc2ccccc2F)c1	ZINC000819114220	GH	On-Demand	Anodyne	KCNQ2	53	39
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(NC(=O)Cc2ccccc2F)c1	ZINC000819114222	GH	On-Demand	Anodyne	KCNQ2	53	39
COC[C@]1(C(=O)O)CCCN(S(=O)(=O)/C=C\c2ccccc2Cl)C1	ZINC000819114230	FE	On-Demand	Anodyne	PA	19	42
COC[C@]1(C(=O)O)CCCN(S(=O)(=O)/C=C/c2ccccc2Cl)C1	ZINC000819114233	FE	On-Demand	Anodyne	PA	19	42
C[C@@H](CNC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)Oc1ccccc1F	ZINC000819114240	GG	On-Demand	Anodyne	GPR119	22	44
C[C@H](CNC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)Oc1ccccc1F	ZINC000819114241	GG	On-Demand	Anodyne	GPR119	22	44
C[C@H](CNC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)Oc1ccccc1F	ZINC000819114242	GG	On-Demand	Anodyne	GPR119	22	44
C[C@@H](CNC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)Oc1ccccc1F	ZINC000819114244	GG	On-Demand	Anodyne	GPR119	22	44
O=C(CC1CC1)NNC(=O)c1sc(-c2ccco2)nc1-c1ccccc1	ZINC000819114268	FH	On-Demand	Reactive	VCP	22	45
CCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C(=O)NNC(=O)CC1CC1	ZINC000819114273	HC	On-Demand	Reactive	PDE5A	36	46
CCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C(=O)NNC(=O)CC1CC1	ZINC000819114273	HC	On-Demand	Reactive	HCN1	55	38
CCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1C(=O)NNC(=O)CC1CC1	ZINC000819114273	HC	On-Demand	Reactive	HCN4	41	32
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1C(=O)Cc1cccs1	ZINC000819114287	ED	On-Demand	Reactive	F2	21	42
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1C(=O)Cc1cccs1	ZINC000819114287	ED	On-Demand	Reactive	PREP	86	38
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1C(=O)Cc1cccs1	ZINC000819114287	ED	On-Demand	Reactive	LGMN	51	33
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)Cc1cccs1	ZINC000819114288	ED	On-Demand	Reactive	F2	21	42
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)Cc1cccs1	ZINC000819114288	ED	On-Demand	Reactive	PREP	86	38
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)Cc1cccs1	ZINC000819114288	ED	On-Demand	Reactive	LGMN	51	33
O=C(CSCc1ccc(Cl)cc1Cl)NNC(=O)CC1CC1	ZINC000819114304	EG	On-Demand	Reactive	P2RX7	36	43
O=C(CSCc1ccc(Cl)cc1Cl)NNC(=O)CC1CC1	ZINC000819114304	EG	On-Demand	Reactive	EPHX2	15	41
O=C(Cc1csc(NC(=O)c2ccccc2)n1)NNC(=O)CC1CC1	ZINC000819114314	FD	On-Demand	Reactive	DGAT1	15	42
O=C(CCc1cc(C(F)(F)F)ccc1Br)NNC(=O)CC1CC1	ZINC000819114318	GG	On-Demand	Reactive	LIPG	22	40
CCCCSCC(=O)NNC(=O)CC1CC1	ZINC000819114327	BD	On-Demand	Reactive	CES1	17	42
CCCCSCC(=O)NNC(=O)CC1CC1	ZINC000819114327	BD	On-Demand	Reactive	EST1_PIG	49	42
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000819114341	ED	On-Demand	Reactive	SLC6A1	60	34
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000819114341	ED	On-Demand	Reactive	PREP	65	41
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000819114341	ED	On-Demand	Reactive	DPP7	57	41
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000819114341	ED	On-Demand	Reactive	BIRC2	15	45
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000819114342	ED	On-Demand	Reactive	SLC6A1	60	34
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000819114342	ED	On-Demand	Reactive	PREP	65	41
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000819114342	ED	On-Demand	Reactive	DPP7	57	41
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000819114342	ED	On-Demand	Reactive	BIRC2	15	45
O=C(CC1CC1)NNC(=O)C[C@H](O)Cc1ccccc1	ZINC000819114344	CC	On-Demand	Reactive	MME	80	37
O=C(CC1CC1)NNC(=O)C[C@H](O)Cc1ccccc1	ZINC000819114344	CC	On-Demand	Reactive	CPA1	43	37
O=C(CC1CC1)NNC(=O)C[C@H](O)Cc1ccccc1	ZINC000819114344	CC	On-Demand	Reactive	CAPN1	43	35
O=C(CC1CC1)NNC(=O)C[C@@H](O)Cc1ccccc1	ZINC000819114345	CC	On-Demand	Reactive	MME	80	37
O=C(CC1CC1)NNC(=O)C[C@@H](O)Cc1ccccc1	ZINC000819114345	CC	On-Demand	Reactive	CPA1	43	37
O=C(CC1CC1)NNC(=O)C[C@@H](O)Cc1ccccc1	ZINC000819114345	CC	On-Demand	Reactive	CAPN1	43	35
Cc1cc(-c2cc(C(=O)NNC(=O)CC3CC3)c3cnn(C(C)C)c3n2)c(C)s1	ZINC000819114346	HH	On-Demand	Reactive	EZH2	17	49
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccc(Cl)cc1	ZINC000819114372	GG	On-Demand	Reactive	PTGER1	52	36
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccc(Cl)cc1	ZINC000819114372	GG	On-Demand	Reactive	CPT1A	58	35
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccc(Cl)cc1	ZINC000819114372	GG	On-Demand	Reactive	SLC6A5	33	41
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccc(Cl)cc1	ZINC000819114372	GG	On-Demand	Reactive	CPT1B	51	35
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccc(Cl)cc1	ZINC000819114372	GG	On-Demand	Reactive	PTGDR	17	40
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccc(Cl)cc1	ZINC000819114372	GG	On-Demand	Reactive	PTGDR2	18	40
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccc(Cl)cc1	ZINC000819114372	GG	On-Demand	Reactive	ADCYAP1R1	44	38
O=C(CC1CC1)NNC(=O)c1ccccc1NC(=O)c1cccc(Br)c1	ZINC000819114378	HG	On-Demand	Reactive	KCNK3	47	34
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819114383	ED	On-Demand	Reactive	HTR1A	118	55
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819114383	ED	On-Demand	Reactive	DRD2	85	55
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819114383	ED	On-Demand	Reactive	DRD4	59	45
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819114383	ED	On-Demand	Reactive	ADRA1D	22	41
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819114383	ED	On-Demand	Reactive	HTR2A	74	55
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819114383	ED	On-Demand	Reactive	HTR2C	32	46
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819114383	ED	On-Demand	Reactive	SLC6A1	78	35
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819114383	ED	On-Demand	Reactive	SLC6A4	15	44
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819114383	ED	On-Demand	Reactive	ADRA1A	32	45
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819114383	ED	On-Demand	Reactive	HRH1	15	45
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819114383	ED	On-Demand	Reactive	ADRA1B	20	45
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819114383	ED	On-Demand	Reactive	DRD3	93	52
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819114383	ED	On-Demand	Reactive	DRD5	18	46
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819114383	ED	On-Demand	Reactive	HTR7	141	53
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819114383	ED	On-Demand	Reactive	SIGMAR1	38	49
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819114383	ED	On-Demand	Reactive	CACNA1G	23	46
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819114383	ED	On-Demand	Reactive	ADAM10	30	40
O=C(CCCN1CCN(c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819114383	ED	On-Demand	Reactive	CYP2J2	50	36
N#Cc1cccc(S(=O)(=O)NC[C@H](C(=O)O)C2CCOCC2)c1	ZINC000819114395	EC	On-Demand	Mild	ITGA4	51	36
N#Cc1cccc(S(=O)(=O)NC[C@@H](C(=O)O)C2CCOCC2)c1	ZINC000819114397	EC	On-Demand	Mild	ITGA4	51	36
CSc1ccc(S(=O)(=O)NC[C@H](C(=O)O)C2CCOCC2)cc1	ZINC000819114408	FD	On-Demand	Anodyne	MMP13	21	47
CSc1ccc(S(=O)(=O)NC[C@H](C(=O)O)C2CCOCC2)cc1	ZINC000819114408	FD	On-Demand	Anodyne	MMP2	18	47
CSc1ccc(S(=O)(=O)NC[C@@H](C(=O)O)C2CCOCC2)cc1	ZINC000819114409	FD	On-Demand	Anodyne	MMP13	21	47
CSc1ccc(S(=O)(=O)NC[C@@H](C(=O)O)C2CCOCC2)cc1	ZINC000819114409	FD	On-Demand	Anodyne	MMP2	18	47
C[C@H](CNC[C@H](O)c1ccc(F)cc1)Oc1cccc(Cl)c1	ZINC000819114415	DH	On-Demand	Anodyne	ADRB2	25	41
C[C@H](CNC[C@H](O)c1ccc(F)cc1)Oc1cccc(Cl)c1	ZINC000819114415	DH	On-Demand	Anodyne	ADRB1	43	45
C[C@H](CNC[C@H](O)c1ccc(F)cc1)Oc1cccc(Cl)c1	ZINC000819114415	DH	On-Demand	Anodyne	ADRB3	59	45
C[C@@H](CNC[C@H](O)c1ccc(F)cc1)Oc1cccc(Cl)c1	ZINC000819114416	DH	On-Demand	Anodyne	ADRB2	25	41
C[C@@H](CNC[C@H](O)c1ccc(F)cc1)Oc1cccc(Cl)c1	ZINC000819114416	DH	On-Demand	Anodyne	ADRB1	43	45
C[C@@H](CNC[C@H](O)c1ccc(F)cc1)Oc1cccc(Cl)c1	ZINC000819114416	DH	On-Demand	Anodyne	ADRB3	59	45
C[C@H](CNC[C@@H](O)c1ccc(F)cc1)Oc1cccc(Cl)c1	ZINC000819114417	DH	On-Demand	Anodyne	ADRB2	25	41
C[C@H](CNC[C@@H](O)c1ccc(F)cc1)Oc1cccc(Cl)c1	ZINC000819114417	DH	On-Demand	Anodyne	ADRB1	43	45
C[C@H](CNC[C@@H](O)c1ccc(F)cc1)Oc1cccc(Cl)c1	ZINC000819114417	DH	On-Demand	Anodyne	ADRB3	59	45
C[C@@H](CNC[C@@H](O)c1ccc(F)cc1)Oc1cccc(Cl)c1	ZINC000819114418	DH	On-Demand	Anodyne	ADRB2	25	41
C[C@@H](CNC[C@@H](O)c1ccc(F)cc1)Oc1cccc(Cl)c1	ZINC000819114418	DH	On-Demand	Anodyne	ADRB1	43	45
C[C@@H](CNC[C@@H](O)c1ccc(F)cc1)Oc1cccc(Cl)c1	ZINC000819114418	DH	On-Demand	Anodyne	ADRB3	59	45
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819114433	FH	On-Demand	Anodyne	MTNR1A	19	49
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819114433	FH	On-Demand	Anodyne	MTNR1B	22	49
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819114434	FH	On-Demand	Anodyne	MTNR1A	19	49
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819114434	FH	On-Demand	Anodyne	MTNR1B	22	49
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819114436	FH	On-Demand	Anodyne	MTNR1A	19	49
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819114436	FH	On-Demand	Anodyne	MTNR1B	22	49
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819114438	FH	On-Demand	Anodyne	MTNR1A	19	49
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819114438	FH	On-Demand	Anodyne	MTNR1B	22	49
C[C@H](CC(=O)NNC(=O)CC1CC1)NC(=O)OC(C)(C)C	ZINC000819114442	CD	On-Demand	Reactive	CTSK	17	46
C[C@@H](CC(=O)NNC(=O)CC1CC1)NC(=O)OC(C)(C)C	ZINC000819114443	CD	On-Demand	Reactive	CTSK	17	46
CC[C@@H](C)CS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819114444	GG	On-Demand	Anodyne	HTR1D	32	45
CC[C@@H](C)CS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819114444	GG	On-Demand	Anodyne	HTR1B	26	45
CC[C@@H](C)CS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819114444	GG	On-Demand	Anodyne	HTR1F	88	44
CC[C@@H](C)CS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819114444	GG	On-Demand	Anodyne	CCR2	26	46
O=C(CCCOc1ccc(I)cc1)NNC(=O)CC1CC1	ZINC000819114445	HE	On-Demand	Reactive	TRAR	16	41
CC[C@H](C)CS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819114446	GG	On-Demand	Anodyne	HTR1D	32	45
CC[C@H](C)CS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819114446	GG	On-Demand	Anodyne	HTR1B	26	45
CC[C@H](C)CS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819114446	GG	On-Demand	Anodyne	HTR1F	88	44
CC[C@H](C)CS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819114446	GG	On-Demand	Anodyne	CCR2	26	46
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)Cc2ccccc2)cc1	ZINC000819114455	FE	On-Demand	Reactive	CA2	19	41
O=C(CC1CC1)NNC(=O)CC1(CC(=O)Nc2nccs2)CCCCC1	ZINC000819114460	GF	On-Demand	Reactive	MAP1	80	38
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819114470	DE	On-Demand	Anodyne	MTNR1A	18	49
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819114470	DE	On-Demand	Anodyne	MTNR1B	20	49
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819114471	DE	On-Demand	Anodyne	MTNR1A	18	49
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819114471	DE	On-Demand	Anodyne	MTNR1B	20	49
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819114473	DE	On-Demand	Anodyne	MTNR1A	18	49
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819114473	DE	On-Demand	Anodyne	MTNR1B	20	49
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819114475	DE	On-Demand	Anodyne	MTNR1A	18	49
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819114475	DE	On-Demand	Anodyne	MTNR1B	20	49
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819114477	EG	On-Demand	Anodyne	MTNR1A	25	51
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819114477	EG	On-Demand	Anodyne	MTNR1B	27	51
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819114479	EG	On-Demand	Anodyne	MTNR1A	25	51
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819114479	EG	On-Demand	Anodyne	MTNR1B	27	51
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819114481	EG	On-Demand	Anodyne	MTNR1A	25	51
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819114481	EG	On-Demand	Anodyne	MTNR1B	27	51
COc1cccc(O[C@H](C)CNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819114483	EG	On-Demand	Anodyne	MTNR1A	25	51
COc1cccc(O[C@H](C)CNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819114483	EG	On-Demand	Anodyne	MTNR1B	27	51
CCCN(C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819114485	GF	On-Demand	Anodyne	HTR1A	16	44
CCCN(C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819114485	GF	On-Demand	Anodyne	HTR1D	45	47
CCCN(C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819114485	GF	On-Demand	Anodyne	HTR1B	37	47
CCCN(C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819114485	GF	On-Demand	Anodyne	HTR1F	88	44
CCCN(C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819114485	GF	On-Demand	Anodyne	CCR2	23	44
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)N4CCCCC4)CC3)c2c1	ZINC000819114488	GF	On-Demand	Anodyne	HTR1A	15	47
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)N4CCCCC4)CC3)c2c1	ZINC000819114488	GF	On-Demand	Anodyne	HTR1D	36	47
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)N4CCCCC4)CC3)c2c1	ZINC000819114488	GF	On-Demand	Anodyne	HTR1B	29	47
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)N4CCCCC4)CC3)c2c1	ZINC000819114488	GF	On-Demand	Anodyne	SLC6A4	15	44
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)N4CCCCC4)CC3)c2c1	ZINC000819114488	GF	On-Demand	Anodyne	HTR1F	93	47
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)N4CCCCC4)CC3)c2c1	ZINC000819114488	GF	On-Demand	Anodyne	CCR2	27	46
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)N4CCCCC4)CC3)c2c1	ZINC000819114488	GF	On-Demand	Anodyne	L3MBTL3	41	35
COc1cccc([C@H](C)C(=O)NNC(=O)CC2CC2)c1	ZINC000819114496	CD	On-Demand	Reactive	MTNR1A	45	43
COc1cccc([C@H](C)C(=O)NNC(=O)CC2CC2)c1	ZINC000819114496	CD	On-Demand	Reactive	MTNR1B	43	43
COc1cccc([C@@H](C)C(=O)NNC(=O)CC2CC2)c1	ZINC000819114497	CD	On-Demand	Reactive	MTNR1A	45	43
COc1cccc([C@@H](C)C(=O)NNC(=O)CC2CC2)c1	ZINC000819114497	CD	On-Demand	Reactive	MTNR1B	43	43
C[C@H](CNC[C@H](O)c1ccc(C#N)cc1)Oc1cccc(Cl)c1	ZINC000819114511	EG	On-Demand	Mild	ADRB1	36	42
C[C@H](CNC[C@H](O)c1ccc(C#N)cc1)Oc1cccc(Cl)c1	ZINC000819114511	EG	On-Demand	Mild	ADRB3	50	42
C[C@H](CNC[C@@H](O)c1ccc(C#N)cc1)Oc1cccc(Cl)c1	ZINC000819114519	EG	On-Demand	Mild	ADRB1	36	42
C[C@H](CNC[C@@H](O)c1ccc(C#N)cc1)Oc1cccc(Cl)c1	ZINC000819114519	EG	On-Demand	Mild	ADRB3	50	42
C[C@@H](CNC[C@@H](O)c1ccc(C#N)cc1)Oc1cccc(Cl)c1	ZINC000819114521	EG	On-Demand	Mild	ADRB1	36	42
C[C@@H](CNC[C@@H](O)c1ccc(C#N)cc1)Oc1cccc(Cl)c1	ZINC000819114521	EG	On-Demand	Mild	ADRB3	50	42
C[C@@H](CNC[C@H](O)c1ccc(C#N)cc1)Oc1cccc(Cl)c1	ZINC000819114523	EG	On-Demand	Mild	ADRB1	36	42
C[C@@H](CNC[C@H](O)c1ccc(C#N)cc1)Oc1cccc(Cl)c1	ZINC000819114523	EG	On-Demand	Mild	ADRB3	50	42
O=C(CCCOc1ccc(Cl)cc1)NNC(=O)CC1CC1	ZINC000819114538	DE	On-Demand	Reactive	EBP	15	40
O=C(CCCOc1ccc(Cl)cc1)NNC(=O)CC1CC1	ZINC000819114538	DE	On-Demand	Reactive	TRAR	16	41
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C4CC4)CC3)c2c1	ZINC000819114545	EF	On-Demand	Anodyne	HTR1A	15	48
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C4CC4)CC3)c2c1	ZINC000819114545	EF	On-Demand	Anodyne	HTR1D	34	48
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C4CC4)CC3)c2c1	ZINC000819114545	EF	On-Demand	Anodyne	HTR1B	27	48
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C4CC4)CC3)c2c1	ZINC000819114545	EF	On-Demand	Anodyne	HTR1F	96	48
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)C4CC4)CC3)c2c1	ZINC000819114545	EF	On-Demand	Anodyne	CCR2	25	45
Cc1cc(F)ccc1S(=O)(=O)NC[C@@H](C(=O)O)C1CCOCC1	ZINC000819114546	ED	On-Demand	Anodyne	LEF	15	44
Cc1cc(F)ccc1S(=O)(=O)NC[C@H](C(=O)O)C1CCOCC1	ZINC000819114548	ED	On-Demand	Anodyne	LEF	15	44
COc1ccc(-c2nc(C(=O)NNC(=O)CC3CC3)cs2)cc1OC	ZINC000819114582	FE	On-Demand	Reactive	PPARD	21	43
COc1ccc(-c2nc(C(=O)NNC(=O)CC3CC3)cs2)cc1OC	ZINC000819114582	FE	On-Demand	Reactive	STK17B	40	38
O=C(CCSc1ccnc2cc(Cl)ccc12)NNC(=O)CC1CC1	ZINC000819114588	FG	On-Demand	Reactive	HRP1_PLAFA	103	41
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819114596	ED	On-Demand	Reactive	F2	42	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819114596	ED	On-Demand	Reactive	FKBP1A	41	38
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819114596	ED	On-Demand	Reactive	CELA1	23	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819114596	ED	On-Demand	Reactive	PREP	96	53
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819114596	ED	On-Demand	Reactive	LGMN	71	39
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819114596	ED	On-Demand	Reactive	TMPRSS11D	52	35
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819114597	ED	On-Demand	Reactive	F2	42	40
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819114597	ED	On-Demand	Reactive	FKBP1A	41	38
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819114597	ED	On-Demand	Reactive	CELA1	23	40
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819114597	ED	On-Demand	Reactive	PREP	96	53
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819114597	ED	On-Demand	Reactive	LGMN	71	39
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819114597	ED	On-Demand	Reactive	TMPRSS11D	52	35
O=C(CC1CC1)NNC(=O)c1nn(-c2ccc(Cl)cc2Cl)c2c1CCC2	ZINC000819114600	GG	On-Demand	Reactive	CNR1	94	51
O=C(CC1CC1)NNC(=O)c1nn(-c2ccc(Cl)cc2Cl)c2c1CCC2	ZINC000819114600	GG	On-Demand	Reactive	CNR2	33	50
Cc1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819114619	CD	On-Demand	Reactive	VIPR1	18	43
Cc1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819114619	CD	On-Demand	Reactive	FFAR1	23	42
O=C(CC1CC1)NNC(=O)c1cccc(OCc2cccc(Cl)c2)c1	ZINC000819114623	FG	On-Demand	Reactive	MAOB	46	43
O=C(CC1CC1)NNC(=O)c1cccc(OCc2cccc(Cl)c2)c1	ZINC000819114623	FG	On-Demand	Reactive	SLC6A5	22	42
O=C(CC1CC1)NNC(=O)c1cccc(OCc2cccc(Cl)c2)c1	ZINC000819114623	FG	On-Demand	Reactive	FFAR1	41	36
O=C(CC1CC1)NNC(=O)c1cccc(OCc2cccc(Cl)c2)c1	ZINC000819114623	FG	On-Demand	Reactive	ADCYAP1R1	44	39
NC(=O)CC[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCO2)C(=O)NNC(=O)CC1CC1	ZINC000819114635	IB	On-Demand	Reactive	TRY2_BOVIN	52	34
NC(=O)CC[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCO2)C(=O)NNC(=O)CC1CC1	ZINC000819114635	IB	On-Demand	Reactive	ST14	83	34
NC(=O)CC[C@H](NS(=O)(=O)c1ccc2c(c1)OCCO2)C(=O)NNC(=O)CC1CC1	ZINC000819114636	IB	On-Demand	Reactive	TRY2_BOVIN	52	34
NC(=O)CC[C@H](NS(=O)(=O)c1ccc2c(c1)OCCO2)C(=O)NNC(=O)CC1CC1	ZINC000819114636	IB	On-Demand	Reactive	ST14	83	34
O=C(CCCOCc1ccccc1)NNC(=O)CC1CC1	ZINC000819114654	CD	On-Demand	Reactive	GBA	21	41
O=C(CCCOCc1ccccc1)NNC(=O)CC1CC1	ZINC000819114654	CD	On-Demand	Reactive	GBA2	48	41
O=C(CCCOCc1ccccc1)NNC(=O)CC1CC1	ZINC000819114654	CD	On-Demand	Reactive	NAAA	24	41
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)[C@H]2Cc3ccccc3O2)c1	ZINC000819114660	GE	On-Demand	Reactive	KCNK3	40	37
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)[C@@H]2Cc3ccccc3O2)c1	ZINC000819114661	GE	On-Demand	Reactive	KCNK3	40	37
O=C(CC1CC1)NNC(=O)c1cccc2[nH]c(-c3cccs3)nc12	ZINC000819114666	EF	On-Demand	Reactive	PARP2	60	37
O=C(CC1CC1)NNC(=O)c1cccc2[nH]c(-c3cccs3)nc12	ZINC000819114666	EF	On-Demand	Reactive	PARP1	54	38
O=C(CC1CC1)NNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1	ZINC000819114669	FF	On-Demand	Reactive	PRKCQ	15	41
O=C(CC1CC1)NNC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1	ZINC000819114669	FF	On-Demand	Reactive	TAAR1	17	54
O=C(CC1CC1)NNC(=O)c1ccccc1-c1nc(-c2cccc(Cl)c2)no1	ZINC000819114670	GH	On-Demand	Reactive	GRM5	20	43
O=C(CCc1nc(-c2ccncc2)no1)NNC(=O)CC1CC1	ZINC000819114688	DD	On-Demand	Reactive	HCAR2	24	46
CCCCCS(=O)(=O)CC(=O)NNC(=O)CC1CC1	ZINC000819114690	CC	On-Demand	Reactive	EST1_PIG	25	43
O=C(CC1CC1)NNC(=O)c1ccc(-n2cnc3ccccc32)cc1	ZINC000819114697	EF	On-Demand	Reactive	F9	43	41
O=C(CC1CC1)NNC(=O)c1ccc(-n2cnc3ccccc32)cc1	ZINC000819114697	EF	On-Demand	Reactive	HPGD	44	42
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1	ZINC000819114704	FE	On-Demand	Reactive	TRPV1	35	52
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1	ZINC000819114704	FE	On-Demand	Reactive	GPBAR1	19	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1	ZINC000819114704	FE	On-Demand	Reactive	SFRP1	47	33
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(c2ncccc2C(F)(F)F)C1	ZINC000819114705	FE	On-Demand	Reactive	TRPV1	35	52
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(c2ncccc2C(F)(F)F)C1	ZINC000819114705	FE	On-Demand	Reactive	GPBAR1	19	40
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(c2ncccc2C(F)(F)F)C1	ZINC000819114705	FE	On-Demand	Reactive	SFRP1	47	33
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)CC2CC2)c1	ZINC000819114709	HC	On-Demand	Reactive	SLC6A9	19	42
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819114722	GG	On-Demand	Anodyne	ADRB2	32	44
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819114722	GG	On-Demand	Anodyne	ADRB1	42	40
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819114722	GG	On-Demand	Anodyne	ADRB3	32	43
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819114722	GG	On-Demand	Anodyne	ABCB1	23	45
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819114723	GG	On-Demand	Anodyne	ADRB2	32	44
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819114723	GG	On-Demand	Anodyne	ADRB1	42	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819114723	GG	On-Demand	Anodyne	ADRB3	32	43
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819114723	GG	On-Demand	Anodyne	ABCB1	23	45
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819114725	GG	On-Demand	Anodyne	ADRB2	32	44
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819114725	GG	On-Demand	Anodyne	ADRB1	42	40
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819114725	GG	On-Demand	Anodyne	ADRB3	32	43
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819114725	GG	On-Demand	Anodyne	ABCB1	23	45
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819114726	GG	On-Demand	Anodyne	ADRB2	32	44
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819114726	GG	On-Demand	Anodyne	ADRB1	42	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819114726	GG	On-Demand	Anodyne	ADRB3	32	43
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819114726	GG	On-Demand	Anodyne	ABCB1	23	45
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819114727	EF	On-Demand	Bother	MTNR1A	30	52
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819114727	EF	On-Demand	Bother	MTNR1B	29	52
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000819114728	HC	On-Demand	Reactive	MMP13	44	42
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000819114728	HC	On-Demand	Reactive	APP	41	36
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000819114728	HC	On-Demand	Reactive	ADAM17	32	54
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000819114728	HC	On-Demand	Reactive	MMP2	21	53
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000819114728	HC	On-Demand	Reactive	MMP3	51	41
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000819114728	HC	On-Demand	Reactive	MMP8	19	41
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000819114728	HC	On-Demand	Reactive	MMP1	43	42
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819114729	EF	On-Demand	Bother	MTNR1A	30	52
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819114729	EF	On-Demand	Bother	MTNR1B	29	52
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819114730	EF	On-Demand	Bother	MTNR1A	30	52
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819114730	EF	On-Demand	Bother	MTNR1B	29	52
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819114731	EF	On-Demand	Bother	MTNR1A	30	52
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819114731	EF	On-Demand	Bother	MTNR1B	29	52
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000819114732	HC	On-Demand	Reactive	MMP13	44	42
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000819114732	HC	On-Demand	Reactive	APP	41	36
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000819114732	HC	On-Demand	Reactive	ADAM17	32	54
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000819114732	HC	On-Demand	Reactive	MMP2	21	53
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000819114732	HC	On-Demand	Reactive	MMP3	51	41
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000819114732	HC	On-Demand	Reactive	MMP8	19	41
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000819114732	HC	On-Demand	Reactive	MMP1	43	42
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819114738	GH	On-Demand	Anodyne	ADRB1	28	40
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819114738	GH	On-Demand	Anodyne	ADRB3	42	40
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819114738	GH	On-Demand	Anodyne	MTNR1A	29	53
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819114738	GH	On-Demand	Anodyne	MTNR1B	29	53
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819114739	GH	On-Demand	Anodyne	ADRB1	28	40
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819114739	GH	On-Demand	Anodyne	ADRB3	42	40
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819114739	GH	On-Demand	Anodyne	MTNR1A	29	53
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819114739	GH	On-Demand	Anodyne	MTNR1B	29	53
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819114741	GH	On-Demand	Anodyne	ADRB1	28	40
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819114741	GH	On-Demand	Anodyne	ADRB3	42	40
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819114741	GH	On-Demand	Anodyne	MTNR1A	29	53
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819114741	GH	On-Demand	Anodyne	MTNR1B	29	53
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819114742	GH	On-Demand	Anodyne	ADRB1	28	40
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819114742	GH	On-Demand	Anodyne	ADRB3	42	40
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819114742	GH	On-Demand	Anodyne	MTNR1A	29	53
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819114742	GH	On-Demand	Anodyne	MTNR1B	29	53
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(OC(F)F)c1	ZINC000819114749	CF	On-Demand	Anodyne	TAAR1	24	42
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(OC(F)F)c1	ZINC000819114750	CF	On-Demand	Anodyne	TAAR1	24	42
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(OC(F)F)c1	ZINC000819114752	CF	On-Demand	Anodyne	TAAR1	24	42
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(OC(F)F)c1	ZINC000819114753	CF	On-Demand	Anodyne	TAAR1	24	42
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819114759	DF	On-Demand	Anodyne	ADRB1	29	45
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819114759	DF	On-Demand	Anodyne	ADRB3	41	45
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819114759	DF	On-Demand	Anodyne	MTNR1A	28	53
COc1cccc(O[C@H](C)CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819114759	DF	On-Demand	Anodyne	MTNR1B	29	53
O=C(COc1cc(C(F)(F)F)cc(C(F)(F)F)c1)NNC(=O)CC1CC1	ZINC000819114760	GG	On-Demand	Reactive	TACR1	21	45
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819114761	DF	On-Demand	Anodyne	ADRB1	29	45
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819114761	DF	On-Demand	Anodyne	ADRB3	41	45
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819114761	DF	On-Demand	Anodyne	MTNR1A	28	53
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819114761	DF	On-Demand	Anodyne	MTNR1B	29	53
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819114762	DF	On-Demand	Anodyne	ADRB1	29	45
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819114762	DF	On-Demand	Anodyne	ADRB3	41	45
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819114762	DF	On-Demand	Anodyne	MTNR1A	28	53
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819114762	DF	On-Demand	Anodyne	MTNR1B	29	53
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819114763	DF	On-Demand	Anodyne	ADRB1	29	45
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819114763	DF	On-Demand	Anodyne	ADRB3	41	45
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819114763	DF	On-Demand	Anodyne	MTNR1A	28	53
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819114763	DF	On-Demand	Anodyne	MTNR1B	29	53
Cc1cccc(C(=O)NNC(=O)CC2CC2)c1NC(=O)c1ccncc1	ZINC000819114784	FE	On-Demand	Reactive	LCK	25	48
Cc1cccc(C(=O)NNC(=O)CC2CC2)c1NC(=O)c1ccncc1	ZINC000819114784	FE	On-Demand	Reactive	SHH	40	39
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4cccs4)CC3)c2c1	ZINC000819114785	GG	On-Demand	Anodyne	HTR1D	27	42
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4cccs4)CC3)c2c1	ZINC000819114785	GG	On-Demand	Anodyne	HTR1B	24	42
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4cccs4)CC3)c2c1	ZINC000819114785	GG	On-Demand	Anodyne	HTR1F	84	42
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4cccs4)CC3)c2c1	ZINC000819114785	GG	On-Demand	Anodyne	CCR2	24	44
CCN(Cc1ccccc1)c1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819114793	FG	On-Demand	Reactive	ESRRG	20	41
COCCS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819114800	FE	On-Demand	Anodyne	HTR1D	39	47
COCCS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819114800	FE	On-Demand	Anodyne	HTR1B	32	47
COCCS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819114800	FE	On-Demand	Anodyne	HTR1F	95	46
COCCS(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819114800	FE	On-Demand	Anodyne	CCR2	22	43
C[C@H](CNC[C@H](O)c1ccccc1F)Oc1cccc(Cl)c1	ZINC000819114802	DH	On-Demand	Anodyne	ADRB1	28	43
C[C@H](CNC[C@H](O)c1ccccc1F)Oc1cccc(Cl)c1	ZINC000819114802	DH	On-Demand	Anodyne	ADRB3	40	43
C[C@@H](CNC[C@H](O)c1ccccc1F)Oc1cccc(Cl)c1	ZINC000819114803	DH	On-Demand	Anodyne	ADRB1	28	43
C[C@@H](CNC[C@H](O)c1ccccc1F)Oc1cccc(Cl)c1	ZINC000819114803	DH	On-Demand	Anodyne	ADRB3	40	43
C[C@H](CNC[C@@H](O)c1ccccc1F)Oc1cccc(Cl)c1	ZINC000819114805	DH	On-Demand	Anodyne	ADRB1	28	43
C[C@H](CNC[C@@H](O)c1ccccc1F)Oc1cccc(Cl)c1	ZINC000819114805	DH	On-Demand	Anodyne	ADRB3	40	43
C[C@@H](CNC[C@@H](O)c1ccccc1F)Oc1cccc(Cl)c1	ZINC000819114806	DH	On-Demand	Anodyne	ADRB1	28	43
C[C@@H](CNC[C@@H](O)c1ccccc1F)Oc1cccc(Cl)c1	ZINC000819114806	DH	On-Demand	Anodyne	ADRB3	40	43
O=C(CCCc1ccccn1)NNC(=O)CC1CC1	ZINC000819114814	CD	On-Demand	Reactive	GRIN2B	20	47
C[C@@H]1CCN(S(=O)(=O)N2CCC(c3c[nH]c4ccc(C(=O)O)cc34)CC2)C1	ZINC000819114826	GF	On-Demand	Anodyne	HTR1D	30	46
C[C@@H]1CCN(S(=O)(=O)N2CCC(c3c[nH]c4ccc(C(=O)O)cc34)CC2)C1	ZINC000819114826	GF	On-Demand	Anodyne	HTR1B	27	46
C[C@@H]1CCN(S(=O)(=O)N2CCC(c3c[nH]c4ccc(C(=O)O)cc34)CC2)C1	ZINC000819114826	GF	On-Demand	Anodyne	HTR1F	92	46
C[C@@H]1CCN(S(=O)(=O)N2CCC(c3c[nH]c4ccc(C(=O)O)cc34)CC2)C1	ZINC000819114826	GF	On-Demand	Anodyne	CCR2	25	44
C[C@H]1CCN(S(=O)(=O)N2CCC(c3c[nH]c4ccc(C(=O)O)cc34)CC2)C1	ZINC000819114828	GF	On-Demand	Anodyne	HTR1D	30	46
C[C@H]1CCN(S(=O)(=O)N2CCC(c3c[nH]c4ccc(C(=O)O)cc34)CC2)C1	ZINC000819114828	GF	On-Demand	Anodyne	HTR1B	27	46
C[C@H]1CCN(S(=O)(=O)N2CCC(c3c[nH]c4ccc(C(=O)O)cc34)CC2)C1	ZINC000819114828	GF	On-Demand	Anodyne	HTR1F	92	46
C[C@H]1CCN(S(=O)(=O)N2CCC(c3c[nH]c4ccc(C(=O)O)cc34)CC2)C1	ZINC000819114828	GF	On-Demand	Anodyne	CCR2	25	44
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccco4)CC3)c2c1	ZINC000819114835	FG	On-Demand	Anodyne	HTR1D	27	43
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccco4)CC3)c2c1	ZINC000819114835	FG	On-Demand	Anodyne	HTR1B	23	43
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccco4)CC3)c2c1	ZINC000819114835	FG	On-Demand	Anodyne	HTR1F	84	43
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)c4ccco4)CC3)c2c1	ZINC000819114835	FG	On-Demand	Anodyne	CCR2	22	43
Cc1ccc(N2CCC[C@@H](NCCC(=O)Nc3ccccc3F)C2)cc1	ZINC000819114838	FH	On-Demand	Anodyne	KCNQ2	48	35
CC(=O)CCc1ccc(OCc2cccc(C(=O)NNC(=O)CC3CC3)c2)cc1	ZINC000819114843	GG	On-Demand	Reactive	PTGER3	43	32
CC(=O)CCc1ccc(OCc2cccc(C(=O)NNC(=O)CC3CC3)c2)cc1	ZINC000819114843	GG	On-Demand	Reactive	GYS1	45	36
CC(=O)CCc1ccc(OCc2cccc(C(=O)NNC(=O)CC3CC3)c2)cc1	ZINC000819114843	GG	On-Demand	Reactive	FFAR1	77	49
CC(=O)CCc1ccc(OCc2cccc(C(=O)NNC(=O)CC3CC3)c2)cc1	ZINC000819114843	GG	On-Demand	Reactive	FFAR4	46	44
O=C(CC1CC1)NNC(=O)c1ccccc1Nc1ccccc1	ZINC000819114857	DF	On-Demand	Reactive	AKR1C3	24	41
O=C(CC1CC1)NNC(=O)c1ccccc1Nc1ccccc1	ZINC000819114857	DF	On-Demand	Reactive	AKR1C2	38	50
O=C(CCn1cncn1)NNC(=O)CC1CC1	ZINC000819114858	BB	On-Demand	Reactive	HIS3	71	40
Cc1cc(OCCCC(=O)NNC(=O)CC2CC2)ccc1Cl	ZINC000819114861	DF	On-Demand	Reactive	PPARD	24	40
Cc1cc(OCCCC(=O)NNC(=O)CC2CC2)ccc1Cl	ZINC000819114861	DF	On-Demand	Reactive	MCL1	25	42
CC(C)[C@H](CCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819114875	DF	On-Demand	Reactive	ACE	61	40
CC(C)[C@H](CCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819114875	DF	On-Demand	Reactive	MME	50	39
CC(C)[C@H](CCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819114875	DF	On-Demand	Reactive	CAPN1	40	35
CC(C)[C@H](CCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819114875	DF	On-Demand	Reactive	CASP1	27	40
CC(C)c1cccc(-c2ccc(C(=O)NNC(=O)CC3CC3)o2)c1	ZINC000819114880	EH	On-Demand	Reactive	S1PR4	20	42
O=C(CC1CC1)NNC(=O)[C@H]1CSCN1C(=O)C1CCCC1	ZINC000819114883	ED	On-Demand	Reactive	PREP	17	40
O=C(CC1CC1)NNC(=O)[C@@H]1CSCN1C(=O)C1CCCC1	ZINC000819114884	ED	On-Demand	Reactive	PREP	17	40
O=C(CC1CC1)NNC(=O)C1CCN(C(=O)c2ccc(Br)cc2)CC1	ZINC000819114894	HE	On-Demand	Reactive	L3MBTL3	92	43
O=C(CC1CC1)NNC(=O)c1sc(-c2ccccc2)cc1OCC(=O)N1CCCCC1	ZINC000819114899	IG	On-Demand	Reactive	CPT1A	52	35
O=C(CC1CC1)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000819114900	ID	On-Demand	Reactive	PRTN3	47	34
Cc1ccc(-n2nc(C(=O)NNC(=O)CC3CC3)c3c2CCC3)c(C)c1	ZINC000819114903	FF	On-Demand	Reactive	CNR1	53	37
Cn1cc(-c2cccc(C(=O)NNC(=O)CC3CC3)c2)cn1	ZINC000819114904	CD	On-Demand	Reactive	TYRO3	22	41
CCOc1ccccc1CCC(=O)NNC(=O)CC1CC1	ZINC000819114905	CD	On-Demand	Reactive	HCN1	43	32
CCOc1ccccc1CCC(=O)NNC(=O)CC1CC1	ZINC000819114905	CD	On-Demand	Reactive	HCN4	41	32
C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)NNC(=O)CC3CC3)cc2[N+](=O)[O-])C1	ZINC000819114907	FF	On-Demand	Reactive	TAAR1	17	46
O=C(CC1CC1)NNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819114912	HF	On-Demand	Reactive	OPRD1	65	38
O=C(CC1CC1)NNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819114912	HF	On-Demand	Reactive	PREP	29	44
O=C(CC1CC1)NNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819114912	HF	On-Demand	Reactive	CFTR	70	46
O=C(CC1CC1)NNC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819114912	HF	On-Demand	Reactive	ADAM9	41	32
O=C(CC1CC1)NNC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819114913	HF	On-Demand	Reactive	OPRD1	65	38
O=C(CC1CC1)NNC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819114913	HF	On-Demand	Reactive	PREP	29	44
O=C(CC1CC1)NNC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819114913	HF	On-Demand	Reactive	CFTR	70	46
O=C(CC1CC1)NNC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819114913	HF	On-Demand	Reactive	ADAM9	41	32
CC(C)(C)CNC(=O)c1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819114922	EE	On-Demand	Reactive	CACNA1I	55	37
O=C(Cc1ccc(Cl)c(Cl)c1)NNC(=O)CC1CC1	ZINC000819114927	DE	On-Demand	Reactive	OPRK1	25	42
O=C(Cc1ccc(Cl)c(Cl)c1)NNC(=O)CC1CC1	ZINC000819114927	DE	On-Demand	Reactive	SIGMAR1	19	49
O=C(Cc1ccc(Cl)c(Cl)c1)NNC(=O)CC1CC1	ZINC000819114927	DE	On-Demand	Reactive	P2RX7	21	45
O=C(CC1CC1)NNC(=O)c1ccccc1S(=O)(=O)N1CCCCC1	ZINC000819114932	FD	On-Demand	Reactive	EPHX2	29	45
O=C(CC1CC1)NNC(=O)c1ccccc1S(=O)(=O)N1CCCCC1	ZINC000819114932	FD	On-Demand	Reactive	CCR8	67	35
O=C(CC1CC1)NNC(=O)C1(S(=O)(=O)c2ccc(Br)cc2)CCCC1	ZINC000819114942	IE	On-Demand	Reactive	MMP13	43	41
O=C(CC1CC1)NNC(=O)C1(S(=O)(=O)c2ccc(Br)cc2)CCCC1	ZINC000819114942	IE	On-Demand	Reactive	MMP2	41	36
O=C(CC1CC1)NNC(=O)C1(S(=O)(=O)c2ccc(Br)cc2)CCCC1	ZINC000819114942	IE	On-Demand	Reactive	MMP10	57	32
COc1ccc(CC(=O)NCc2ccc(C(=O)NNC(=O)CC3CC3)cc2)cc1	ZINC000819114955	GE	On-Demand	Reactive	CA9	23	52
COc1ccc(CC(=O)NCc2ccc(C(=O)NNC(=O)CC3CC3)cc2)cc1	ZINC000819114955	GE	On-Demand	Reactive	MMP1	17	43
CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)NNC(=O)CC3CC3)ccc2F)CC1	ZINC000819114963	IC	On-Demand	Reactive	CNR2	16	41
O=C(CCC(=O)c1ccc2ccccc2c1)NNC(=O)CC1CC1	ZINC000819114972	DF	On-Demand	Reactive	HDAC8	23	41
O=C(CNc1cccc(C(F)(F)F)c1)NNC(=O)CC1CC1	ZINC000819114975	DE	On-Demand	Reactive	CCR2	98	42
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CC2CC2)c(OC)c1	ZINC000819114985	GD	On-Demand	Reactive	LGMN	65	38
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CC2CC2)c(OC)c1	ZINC000819114986	GD	On-Demand	Reactive	LGMN	65	38
O=C(CC1CC1)NNC(=O)c1c[nH]c2ncccc12	ZINC000819114987	CD	On-Demand	Reactive	CDC7	44	37
O=C(CC1CC1)NNC(=O)c1cc(-c2ccccc2)nc2c1cnn2Cc1ccccc1	ZINC000819114988	IH	On-Demand	Reactive	VCP	59	37
O=C(CC1CC1)NNC(=O)c1ccccc1OCc1ccncc1	ZINC000819114999	EE	On-Demand	Reactive	PPIA	38	42
O=C(CC1CC1)NNC(=O)c1ccccc1OCc1ccncc1	ZINC000819114999	EE	On-Demand	Reactive	HCN1	54	39
O=C(CC1CC1)NNC(=O)c1ccccc1OCc1ccncc1	ZINC000819114999	EE	On-Demand	Reactive	HCN4	42	32
Cc1c(NC(=O)[C@H](C)SCC(=O)NNC(=O)CC2CC2)c(=O)n(-c2ccccc2)n1C	ZINC000819115003	ID	On-Demand	Reactive	FPR2	60	45
Cc1c(NC(=O)[C@@H](C)SCC(=O)NNC(=O)CC2CC2)c(=O)n(-c2ccccc2)n1C	ZINC000819115004	ID	On-Demand	Reactive	FPR2	60	45
O=C(CC1CC1)NNC(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1	ZINC000819115005	FF	On-Demand	Reactive	CNR1	55	43
O=C(COc1cccc([N+](=O)[O-])c1)NNC(=O)CC1CC1	ZINC000819115016	CC	On-Demand	Reactive	CACNA1C	56	41
O=C(COc1cccc([N+](=O)[O-])c1)NNC(=O)CC1CC1	ZINC000819115016	CC	On-Demand	Reactive	CACNA1D	89	41
O=C(COc1cccc([N+](=O)[O-])c1)NNC(=O)CC1CC1	ZINC000819115016	CC	On-Demand	Reactive	ACR	15	46
O=C(COc1cccc([N+](=O)[O-])c1)NNC(=O)CC1CC1	ZINC000819115016	CC	On-Demand	Reactive	LUXR	16	41
O=C(COc1cccc([N+](=O)[O-])c1)NNC(=O)CC1CC1	ZINC000819115016	CC	On-Demand	Reactive	TRAR	33	42
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819115024	FH	On-Demand	Anodyne	MTNR1A	22	51
COc1cccc(O[C@H](C)CNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819115024	FH	On-Demand	Anodyne	MTNR1B	25	51
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819115025	FH	On-Demand	Anodyne	MTNR1A	22	51
COc1cccc(O[C@H](C)CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819115025	FH	On-Demand	Anodyne	MTNR1B	25	51
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819115026	FH	On-Demand	Anodyne	MTNR1A	22	51
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819115026	FH	On-Demand	Anodyne	MTNR1B	25	51
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819115027	FH	On-Demand	Anodyne	MTNR1A	22	51
COc1cccc(O[C@@H](C)CNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819115027	FH	On-Demand	Anodyne	MTNR1B	25	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819115028	GF	On-Demand	Anodyne	ADRB2	41	52
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819115028	GF	On-Demand	Anodyne	ADRB1	72	52
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819115028	GF	On-Demand	Anodyne	ADRB3	52	43
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819115028	GF	On-Demand	Anodyne	ACOX1	42	35
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819115029	GF	On-Demand	Anodyne	ADRB2	41	52
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819115029	GF	On-Demand	Anodyne	ADRB1	72	52
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819115029	GF	On-Demand	Anodyne	ADRB3	52	43
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819115029	GF	On-Demand	Anodyne	ACOX1	42	35
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819115030	GF	On-Demand	Anodyne	ADRB2	41	52
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819115030	GF	On-Demand	Anodyne	ADRB1	72	52
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819115030	GF	On-Demand	Anodyne	ADRB3	52	43
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819115030	GF	On-Demand	Anodyne	ACOX1	42	35
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819115031	GF	On-Demand	Anodyne	ADRB2	41	52
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819115031	GF	On-Demand	Anodyne	ADRB1	72	52
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819115031	GF	On-Demand	Anodyne	ADRB3	52	43
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCCN(c3ccc(C)cc3)C2)cc1	ZINC000819115031	GF	On-Demand	Anodyne	ACOX1	42	35
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CCCCF)CC3)c2c1	ZINC000819115032	GG	On-Demand	Anodyne	HTR1D	32	47
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CCCCF)CC3)c2c1	ZINC000819115032	GG	On-Demand	Anodyne	HTR1B	25	47
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CCCCF)CC3)c2c1	ZINC000819115032	GG	On-Demand	Anodyne	HTR1F	78	44
O=C(O)c1ccc2[nH]cc(C3CCN(S(=O)(=O)CCCCF)CC3)c2c1	ZINC000819115032	GG	On-Demand	Anodyne	CCR2	23	43
Cc1ccc(N2CCC[C@@H](NC[C@@H](O)COCc3ccccc3)C2)cc1	ZINC000819115035	FG	On-Demand	Anodyne	ADRB3	18	41
Cc1ccc(N2CCC[C@@H](NC[C@H](O)COCc3ccccc3)C2)cc1	ZINC000819115036	FG	On-Demand	Anodyne	ADRB3	18	41
COc1ccccc1COC[C@H](O)CN[C@@H]1CCCN(c2ccc(C)cc2)C1	ZINC000819115047	GG	On-Demand	Anodyne	ADRB2	17	42
COc1ccccc1COC[C@@H](O)CN[C@@H]1CCCN(c2ccc(C)cc2)C1	ZINC000819115048	GG	On-Demand	Anodyne	ADRB2	17	42
COc1ccccc1COC[C@H](O)CN[C@H]1CCCN(c2ccc(C)cc2)C1	ZINC000819115049	GG	On-Demand	Anodyne	ADRB2	17	42
COc1ccccc1COC[C@@H](O)CN[C@H]1CCCN(c2ccc(C)cc2)C1	ZINC000819115050	GG	On-Demand	Anodyne	ADRB2	17	42
COCC[C@@H](C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819115063	GF	On-Demand	Anodyne	HTR1D	33	44
COCC[C@@H](C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819115063	GF	On-Demand	Anodyne	HTR1B	28	44
COCC[C@@H](C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819115063	GF	On-Demand	Anodyne	HTR1F	86	44
COCC[C@@H](C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819115063	GF	On-Demand	Anodyne	CCR2	26	43
COCC[C@H](C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819115064	GF	On-Demand	Anodyne	HTR1D	33	44
COCC[C@H](C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819115064	GF	On-Demand	Anodyne	HTR1B	28	44
COCC[C@H](C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819115064	GF	On-Demand	Anodyne	HTR1F	86	44
COCC[C@H](C)S(=O)(=O)N1CCC(c2c[nH]c3ccc(C(=O)O)cc23)CC1	ZINC000819115064	GF	On-Demand	Anodyne	CCR2	26	43
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819115079	FF	On-Demand	Anodyne	ADRB2	17	45
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819115079	FF	On-Demand	Anodyne	MTNR1A	37	55
COc1cccc(O[C@H](C)CNC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819115079	FF	On-Demand	Anodyne	MTNR1B	39	55
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819115080	FF	On-Demand	Anodyne	ADRB2	17	45
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819115080	FF	On-Demand	Anodyne	MTNR1A	37	55
COc1cccc(O[C@@H](C)CNC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819115080	FF	On-Demand	Anodyne	MTNR1B	39	55
COc1cccc(O[C@H](C)CNC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819115081	FF	On-Demand	Anodyne	ADRB2	17	45
COc1cccc(O[C@H](C)CNC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819115081	FF	On-Demand	Anodyne	MTNR1A	37	55
COc1cccc(O[C@H](C)CNC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819115081	FF	On-Demand	Anodyne	MTNR1B	39	55
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819115082	FF	On-Demand	Anodyne	ADRB2	17	45
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819115082	FF	On-Demand	Anodyne	MTNR1A	37	55
COc1cccc(O[C@@H](C)CNC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819115082	FF	On-Demand	Anodyne	MTNR1B	39	55
CC(=O)Nc1cccc(CC(=O)NNC(=O)C(C)(C)C)c1	ZINC000819115122	CD	On-Demand	Reactive	KCNK3	41	33
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(Cl)cc23)c1	ZINC000819115124	FH	On-Demand	Anodyne	ADRB2	25	46
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(Cl)cc23)c1	ZINC000819115124	FH	On-Demand	Anodyne	ADRB1	31	43
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(Cl)cc23)c1	ZINC000819115124	FH	On-Demand	Anodyne	HTR1D	29	48
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(Cl)cc23)c1	ZINC000819115124	FH	On-Demand	Anodyne	ADRB3	32	53
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(Cl)cc23)c1	ZINC000819115124	FH	On-Demand	Anodyne	MPO	52	39
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(Cl)cc23)c1	ZINC000819115124	FH	On-Demand	Anodyne	HTR1E	15	40
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(Cl)cc23)c1	ZINC000819115124	FH	On-Demand	Anodyne	MTNR1A	27	50
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc(Cl)cc23)c1	ZINC000819115124	FH	On-Demand	Anodyne	MTNR1B	18	50
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1ccc(Cl)cc1Cl)C2	ZINC000819115127	EH	On-Demand	Anodyne	SLC6A3	20	46
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1ccc(Cl)cc1Cl)C2	ZINC000819115128	EH	On-Demand	Anodyne	SLC6A3	20	46
Cc1ccc2cccnc2c1S(=O)(=O)NC[C@H](C(=O)O)C1CCOCC1	ZINC000819115149	GD	On-Demand	Anodyne	C0L093_TOBAC	58	33
Cc1ccc2cccnc2c1S(=O)(=O)NC[C@@H](C(=O)O)C1CCOCC1	ZINC000819115150	GD	On-Demand	Anodyne	C0L093_TOBAC	58	33
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1ccccc1Cl	ZINC000819115160	DG	On-Demand	Anodyne	ADRB1	32	40
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1ccccc1Cl	ZINC000819115160	DG	On-Demand	Anodyne	ADRB3	58	38
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1ccccc1Cl	ZINC000819115160	DG	On-Demand	Anodyne	AOC3	15	41
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1ccccc1Cl	ZINC000819115161	DG	On-Demand	Anodyne	ADRB1	32	40
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1ccccc1Cl	ZINC000819115161	DG	On-Demand	Anodyne	ADRB3	58	38
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1ccccc1Cl	ZINC000819115161	DG	On-Demand	Anodyne	AOC3	15	41
Cc1ccccc1O[C@H](C)CNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819115162	DG	On-Demand	Anodyne	ADRB2	15	42
Cc1ccccc1O[C@H](C)CNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819115163	DG	On-Demand	Anodyne	ADRB2	15	42
CCC(=O)Nc1ccc(S(=O)(=O)NC[C@H](C(=O)O)C2CCOCC2)cc1	ZINC000819115166	GD	On-Demand	Anodyne	CA2	17	45
CCC(=O)Nc1ccc(S(=O)(=O)NC[C@@H](C(=O)O)C2CCOCC2)cc1	ZINC000819115167	GD	On-Demand	Anodyne	CA2	17	45
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C2	ZINC000819115191	GF	On-Demand	Anodyne	GPR119	26	40
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C2	ZINC000819115192	GF	On-Demand	Anodyne	GPR119	26	40
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819115213	DF	On-Demand	Anodyne	ADRB1	38	45
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819115213	DF	On-Demand	Anodyne	CHRM1	17	51
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819115213	DF	On-Demand	Anodyne	SLC6A3	24	51
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819115213	DF	On-Demand	Anodyne	ADRB3	57	48
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819115213	DF	On-Demand	Anodyne	GLRA1	41	31
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819115213	DF	On-Demand	Anodyne	CYP3A4	48	37
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819115214	DF	On-Demand	Anodyne	ADRB1	38	45
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819115214	DF	On-Demand	Anodyne	CHRM1	17	51
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819115214	DF	On-Demand	Anodyne	SLC6A3	24	51
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819115214	DF	On-Demand	Anodyne	ADRB3	57	48
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819115214	DF	On-Demand	Anodyne	GLRA1	41	31
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819115214	DF	On-Demand	Anodyne	CYP3A4	48	37
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2c[nH]c3ccc(Cl)cc23)cc1	ZINC000819115219	GG	On-Demand	Anodyne	ADRB2	25	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2c[nH]c3ccc(Cl)cc23)cc1	ZINC000819115219	GG	On-Demand	Anodyne	ADRB1	32	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2c[nH]c3ccc(Cl)cc23)cc1	ZINC000819115219	GG	On-Demand	Anodyne	ADRB3	63	57
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2c[nH]c3ccc(Cl)cc23)cc1	ZINC000819115219	GG	On-Demand	Anodyne	MPO	61	39
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2c[nH]c3ccc(Cl)cc23)cc1	ZINC000819115219	GG	On-Demand	Anodyne	HTR6	17	41
CS(=O)(=O)c1ccc([C@H](O)CNCCc2c[nH]c3ccc(Cl)cc23)cc1	ZINC000819115220	GG	On-Demand	Anodyne	ADRB2	25	43
CS(=O)(=O)c1ccc([C@H](O)CNCCc2c[nH]c3ccc(Cl)cc23)cc1	ZINC000819115220	GG	On-Demand	Anodyne	ADRB1	32	43
CS(=O)(=O)c1ccc([C@H](O)CNCCc2c[nH]c3ccc(Cl)cc23)cc1	ZINC000819115220	GG	On-Demand	Anodyne	ADRB3	63	57
CS(=O)(=O)c1ccc([C@H](O)CNCCc2c[nH]c3ccc(Cl)cc23)cc1	ZINC000819115220	GG	On-Demand	Anodyne	MPO	61	39
CS(=O)(=O)c1ccc([C@H](O)CNCCc2c[nH]c3ccc(Cl)cc23)cc1	ZINC000819115220	GG	On-Demand	Anodyne	HTR6	17	41
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1ccc(Br)cc1)C2	ZINC000819115225	FG	On-Demand	Anodyne	CHRM1	16	50
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1ccc(Br)cc1)C2	ZINC000819115225	FG	On-Demand	Anodyne	SLC6A3	17	50
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1ccc(Br)cc1)C2	ZINC000819115226	FG	On-Demand	Anodyne	CHRM1	16	50
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1ccc(Br)cc1)C2	ZINC000819115226	FG	On-Demand	Anodyne	SLC6A3	17	50
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819115229	GG	On-Demand	Anodyne	HTR1D	31	43
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819115229	GG	On-Demand	Anodyne	CCKAR	50	38
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819115229	GG	On-Demand	Anodyne	MPO	48	38
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819115230	GG	On-Demand	Anodyne	HTR1D	31	43
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819115230	GG	On-Demand	Anodyne	CCKAR	50	38
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819115230	GG	On-Demand	Anodyne	MPO	48	38
Cc1ccccc1O[C@H](C)CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819115257	GG	On-Demand	Anodyne	GPR119	47	49
Cc1ccccc1O[C@H](C)CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819115258	GG	On-Demand	Anodyne	GPR119	47	49
CSc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819115260	EG	On-Demand	Anodyne	ADRB2	38	42
CSc1ccc(OC[C@@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819115260	EG	On-Demand	Anodyne	ADRB1	52	38
CSc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819115261	EG	On-Demand	Anodyne	ADRB2	38	42
CSc1ccc(OC[C@H](O)CNCc2c(C)cccc2F)cc1	ZINC000819115261	EG	On-Demand	Anodyne	ADRB1	52	38
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819115275	GG	On-Demand	Anodyne	HTR1D	38	46
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819115275	GG	On-Demand	Anodyne	NQO2	18	48
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819115275	GG	On-Demand	Anodyne	MPO	62	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819115275	GG	On-Demand	Anodyne	MAPT	15	43
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819115276	GG	On-Demand	Anodyne	HTR1D	38	46
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819115276	GG	On-Demand	Anodyne	NQO2	18	48
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819115276	GG	On-Demand	Anodyne	MPO	62	42
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819115276	GG	On-Demand	Anodyne	MAPT	15	43
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1Cl	ZINC000819115291	FG	On-Demand	Bother	ADRB3	46	39
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1Cl	ZINC000819115292	FG	On-Demand	Bother	ADRB3	46	39
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1Cl	ZINC000819115293	FG	On-Demand	Bother	ADRB3	46	39
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1Cl	ZINC000819115294	FG	On-Demand	Bother	ADRB3	46	39
Cc1ccccc1O[C@H](C)CNCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819115346	FG	On-Demand	Anodyne	ADRB1	41	34
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1cccnc1)C2	ZINC000819115385	CD	On-Demand	Anodyne	ADRB1	22	42
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1cccnc1)C2	ZINC000819115385	CD	On-Demand	Anodyne	ADRB3	83	47
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1cccnc1)C2	ZINC000819115385	CD	On-Demand	Anodyne	GLRA1	45	45
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1cccnc1)C2	ZINC000819115386	CD	On-Demand	Anodyne	ADRB1	22	42
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1cccnc1)C2	ZINC000819115386	CD	On-Demand	Anodyne	ADRB3	83	47
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1cccnc1)C2	ZINC000819115386	CD	On-Demand	Anodyne	GLRA1	45	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccc(NS(C)(=O)=O)cc1	ZINC000819115399	GD	On-Demand	Anodyne	TRPV1	32	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccc(NS(C)(=O)=O)cc1	ZINC000819115399	GD	On-Demand	Anodyne	PTPRB	40	38
C#CCCCNCCC(=O)Nc1ccccc1	ZINC000819115404	BE	On-Demand	Mild	LTA4H	23	40
C#CCCCNCCC(=O)Nc1ccccc1	ZINC000819115404	BE	On-Demand	Mild	HDAC10	21	49
C#CCCCNCCC(=O)Nc1ccccc1	ZINC000819115404	BE	On-Demand	Mild	HDAC2	18	49
C#CCCCNCCC(=O)Nc1ccccc1	ZINC000819115404	BE	On-Demand	Mild	HDAC3	19	49
C#CCCCNCCC(=O)Nc1ccccc1	ZINC000819115404	BE	On-Demand	Mild	HDAC6	17	49
C#CCCCNC[C@H](O)COc1ccc(OCC)cc1	ZINC000819115411	CD	On-Demand	Mild	ADRB2	57	52
C#CCCCNC[C@H](O)COc1ccc(OCC)cc1	ZINC000819115411	CD	On-Demand	Mild	ADRB1	77	50
C#CCCCNC[C@H](O)COc1ccc(OCC)cc1	ZINC000819115411	CD	On-Demand	Mild	ADRB3	47	50
C#CCCCNC[C@@H](O)COc1ccc(OCC)cc1	ZINC000819115412	CD	On-Demand	Mild	ADRB2	57	52
C#CCCCNC[C@@H](O)COc1ccc(OCC)cc1	ZINC000819115412	CD	On-Demand	Mild	ADRB1	77	50
C#CCCCNC[C@@H](O)COc1ccc(OCC)cc1	ZINC000819115412	CD	On-Demand	Mild	ADRB3	47	50
C[C@@H](CNC[C@H](O)c1cccnc1)Sc1ccccc1	ZINC000819115413	CF	On-Demand	Anodyne	ADRB2	26	47
C[C@@H](CNC[C@H](O)c1cccnc1)Sc1ccccc1	ZINC000819115413	CF	On-Demand	Anodyne	ADRB1	28	45
C[C@@H](CNC[C@H](O)c1cccnc1)Sc1ccccc1	ZINC000819115413	CF	On-Demand	Anodyne	ADRB3	102	48
C[C@H](CNC[C@H](O)c1cccnc1)Sc1ccccc1	ZINC000819115414	CF	On-Demand	Anodyne	ADRB2	26	47
C[C@H](CNC[C@H](O)c1cccnc1)Sc1ccccc1	ZINC000819115414	CF	On-Demand	Anodyne	ADRB1	28	45
C[C@H](CNC[C@H](O)c1cccnc1)Sc1ccccc1	ZINC000819115414	CF	On-Demand	Anodyne	ADRB3	102	48
C[C@H](CNC[C@@H](O)c1cccnc1)Sc1ccccc1	ZINC000819115415	CF	On-Demand	Anodyne	ADRB2	26	47
C[C@H](CNC[C@@H](O)c1cccnc1)Sc1ccccc1	ZINC000819115415	CF	On-Demand	Anodyne	ADRB1	28	45
C[C@H](CNC[C@@H](O)c1cccnc1)Sc1ccccc1	ZINC000819115415	CF	On-Demand	Anodyne	ADRB3	102	48
C[C@@H](CNC[C@@H](O)c1cccnc1)Sc1ccccc1	ZINC000819115416	CF	On-Demand	Anodyne	ADRB2	26	47
C[C@@H](CNC[C@@H](O)c1cccnc1)Sc1ccccc1	ZINC000819115416	CF	On-Demand	Anodyne	ADRB1	28	45
C[C@@H](CNC[C@@H](O)c1cccnc1)Sc1ccccc1	ZINC000819115416	CF	On-Demand	Anodyne	ADRB3	102	48
C#CCCCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819115423	CF	On-Demand	Mild	ADRB2	15	40
C#CCCCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819115423	CF	On-Demand	Mild	CASR	40	36
C#CCCCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819115424	CF	On-Demand	Mild	ADRB2	15	40
C#CCCCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819115424	CF	On-Demand	Mild	CASR	40	36
CON(C)C(=O)CCNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819115431	DE	On-Demand	Anodyne	HTR1A	19	43
CON(C)C(=O)CCNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819115431	DE	On-Demand	Anodyne	HTR1D	62	43
CON(C)C(=O)CCNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819115431	DE	On-Demand	Anodyne	HTR1B	39	41
CON(C)C(=O)CCNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819115431	DE	On-Demand	Anodyne	MPO	76	44
CON(C)C(=O)CCNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819115431	DE	On-Demand	Anodyne	MAPT	15	43
C#CCCCNC[C@H](O)COc1c(C)ccc(C)c1C	ZINC000819115491	CE	On-Demand	Mild	ADRB2	26	41
C#CCCCNC[C@@H](O)COc1c(C)ccc(C)c1C	ZINC000819115493	CE	On-Demand	Mild	ADRB2	26	41
Cc1ccccc1O[C@H](C)CNC[C@@H](O)c1cccnc1	ZINC000819115508	CE	On-Demand	Anodyne	ADRB2	25	45
Cc1ccccc1O[C@H](C)CNC[C@@H](O)c1cccnc1	ZINC000819115508	CE	On-Demand	Anodyne	ADRB1	27	45
Cc1ccccc1O[C@H](C)CNC[C@@H](O)c1cccnc1	ZINC000819115508	CE	On-Demand	Anodyne	ADRB3	91	48
Cc1ccccc1O[C@H](C)CNC[C@H](O)c1cccnc1	ZINC000819115515	CE	On-Demand	Anodyne	ADRB2	25	45
Cc1ccccc1O[C@H](C)CNC[C@H](O)c1cccnc1	ZINC000819115515	CE	On-Demand	Anodyne	ADRB1	27	45
Cc1ccccc1O[C@H](C)CNC[C@H](O)c1cccnc1	ZINC000819115515	CE	On-Demand	Anodyne	ADRB3	91	48
N#Cc1cncc(S(=O)(=O)NC[C@@H](C(=O)O)C2CCOCC2)c1	ZINC000819115547	EC	On-Demand	Mild	ITGA4	44	34
N#Cc1cncc(S(=O)(=O)NC[C@H](C(=O)O)C2CCOCC2)c1	ZINC000819115548	EC	On-Demand	Mild	ITGA4	44	34
C#CCCCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819115579	CD	On-Demand	Mild	ADRB2	49	50
C#CCCCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819115579	CD	On-Demand	Mild	ADRB1	79	50
C#CCCCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819115579	CD	On-Demand	Mild	ADRB3	47	50
C#CCCCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819115580	CD	On-Demand	Mild	ADRB2	49	50
C#CCCCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819115580	CD	On-Demand	Mild	ADRB1	79	50
C#CCCCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819115580	CD	On-Demand	Mild	ADRB3	47	50
C#CCCCNCCC(=O)Nc1cccc(Cl)c1	ZINC000819115585	CF	On-Demand	Mild	AGPAT2	23	43
C#CCCCNCCC(=O)Nc1cccc(Cl)c1	ZINC000819115585	CF	On-Demand	Mild	KCNK3	21	40
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Sc1ccccc1	ZINC000819115586	DH	On-Demand	Anodyne	ADRB1	23	45
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Sc1ccccc1	ZINC000819115586	DH	On-Demand	Anodyne	ADRB3	37	45
C[C@H](CNC[C@H](O)c1cccc(F)c1)Sc1ccccc1	ZINC000819115587	DH	On-Demand	Anodyne	ADRB1	23	45
C[C@H](CNC[C@H](O)c1cccc(F)c1)Sc1ccccc1	ZINC000819115587	DH	On-Demand	Anodyne	ADRB3	37	45
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Sc1ccccc1	ZINC000819115588	DH	On-Demand	Anodyne	ADRB1	23	45
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Sc1ccccc1	ZINC000819115588	DH	On-Demand	Anodyne	ADRB3	37	45
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Sc1ccccc1	ZINC000819115589	DH	On-Demand	Anodyne	ADRB1	23	45
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Sc1ccccc1	ZINC000819115589	DH	On-Demand	Anodyne	ADRB3	37	45
CS(=O)(=O)Nc1ccc(CNC(=O)/C=C\[C@@H]2CCCO2)cc1	ZINC000819115617	DD	On-Demand	Anodyne	TRPV1	19	45
CS(=O)(=O)Nc1ccc(CNC(=O)/C=C/[C@H]2CCCO2)cc1	ZINC000819115618	DD	On-Demand	Anodyne	TRPV1	19	45
CS(=O)(=O)Nc1ccc(CNC(=O)/C=C\[C@H]2CCCO2)cc1	ZINC000819115619	DD	On-Demand	Anodyne	TRPV1	19	45
CS(=O)(=O)Nc1ccc(CNC(=O)/C=C/[C@@H]2CCCO2)cc1	ZINC000819115620	DD	On-Demand	Anodyne	TRPV1	19	45
CON(C)C(=O)CCN[C@H](C)COCc1ccccc1	ZINC000819115626	CD	On-Demand	Anodyne	CAPN2	47	34
CON(C)C(=O)CCN[C@H](C)COCc1ccccc1	ZINC000819115626	CD	On-Demand	Anodyne	NPR	54	32
CON(C)C(=O)CCN[C@@H](C)COCc1ccccc1	ZINC000819115627	CD	On-Demand	Anodyne	CAPN2	47	34
CON(C)C(=O)CCN[C@@H](C)COCc1ccccc1	ZINC000819115627	CD	On-Demand	Anodyne	NPR	54	32
C#CCNC(=O)CCN[C@@H](C)COCc1ccccc1	ZINC000819115632	CD	On-Demand	Mild	CTSK	21	40
C#CCNC(=O)CCN[C@@H](C)COCc1ccccc1	ZINC000819115632	CD	On-Demand	Mild	CAPNS1	43	32
C#CCNC(=O)CCN[C@@H](C)COCc1ccccc1	ZINC000819115632	CD	On-Demand	Mild	CAPN1	48	42
C#CCNC(=O)CCN[C@@H](C)COCc1ccccc1	ZINC000819115632	CD	On-Demand	Mild	CAPN2	70	34
C#CCNC(=O)CCN[C@@H](C)COCc1ccccc1	ZINC000819115632	CD	On-Demand	Mild	NPR	48	33
C#CCNC(=O)CCN[C@H](C)COCc1ccccc1	ZINC000819115633	CD	On-Demand	Mild	CTSK	21	40
C#CCNC(=O)CCN[C@H](C)COCc1ccccc1	ZINC000819115633	CD	On-Demand	Mild	CAPNS1	43	32
C#CCNC(=O)CCN[C@H](C)COCc1ccccc1	ZINC000819115633	CD	On-Demand	Mild	CAPN1	48	42
C#CCNC(=O)CCN[C@H](C)COCc1ccccc1	ZINC000819115633	CD	On-Demand	Mild	CAPN2	70	34
C#CCNC(=O)CCN[C@H](C)COCc1ccccc1	ZINC000819115633	CD	On-Demand	Mild	NPR	48	33
C[C@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Sc1ccccc1	ZINC000819115648	GH	On-Demand	Anodyne	GPR119	44	50
C[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Sc1ccccc1	ZINC000819115649	GH	On-Demand	Anodyne	GPR119	44	50
C[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Sc1ccccc1	ZINC000819115650	GH	On-Demand	Anodyne	GPR119	44	50
C[C@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)Sc1ccccc1	ZINC000819115651	GH	On-Demand	Anodyne	GPR119	44	50
C#CCCCNCCC(=O)Nc1cccc(Br)c1	ZINC000819115652	DF	On-Demand	Mild	EGFR	24	40
C#CCCCNCCC(=O)Nc1cccc(Br)c1	ZINC000819115652	DF	On-Demand	Mild	HDAC2	17	43
C#CCCCNCCC(=O)Nc1cccc(Br)c1	ZINC000819115652	DF	On-Demand	Mild	HDAC6	26	40
C#CCCCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819115658	DD	On-Demand	Mild	GPR119	29	41
C#CCCCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819115659	DD	On-Demand	Mild	GPR119	29	41
C#CCCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819115660	DG	On-Demand	Mild	ADRB2	66	50
C#CCCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819115660	DG	On-Demand	Mild	ADRB1	98	50
C#CCCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819115660	DG	On-Demand	Mild	ADRB3	65	50
C#CCCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819115661	DG	On-Demand	Mild	ADRB2	66	50
C#CCCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819115661	DG	On-Demand	Mild	ADRB1	98	50
C#CCCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819115661	DG	On-Demand	Mild	ADRB3	65	50
C#CCCCNC[C@H](O)c1ccc(C)cc1	ZINC000819115664	BE	On-Demand	Mild	ADRB2	17	41
C#CCCCNC[C@@H](O)c1ccc(C)cc1	ZINC000819115665	BE	On-Demand	Mild	ADRB2	17	41
CC(=O)Nc1cccc(CC(=O)NCCSC(F)(F)F)c1	ZINC000819115666	DF	On-Demand	Anodyne	KCNK3	56	33
CC(=O)Nc1cccc(CC(=O)NCCSC(F)(F)F)c1	ZINC000819115666	DF	On-Demand	Anodyne	KCNK9	48	32
Cc1ccccc1[C@@H](O)CN[C@H](C)COCc1ccccc1	ZINC000819115667	CG	On-Demand	Anodyne	ADRB2	24	43
Cc1ccccc1[C@@H](O)CN[C@@H](C)COCc1ccccc1	ZINC000819115668	CG	On-Demand	Anodyne	ADRB2	24	43
CCOC(=O)Nc1ccc(NC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819115686	GI	On-Demand	Anodyne	LTA4H	28	41
CCOC(=O)Nc1ccc(NC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819115686	GI	On-Demand	Anodyne	MTNR1A	17	47
CCOC(=O)Nc1ccc(NC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819115686	GI	On-Demand	Anodyne	MTNR1B	22	49
CCOC(=O)Nc1ccc(NC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819115686	GI	On-Demand	Anodyne	PDS	44	34
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1cccc3ccccc13)C2	ZINC000819115688	DG	On-Demand	Anodyne	HTR3A	35	45
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1cccc3ccccc13)C2	ZINC000819115688	DG	On-Demand	Anodyne	GLRA1	45	36
C#CCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819115700	BE	On-Demand	Mild	ADRB2	49	44
C#CCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819115700	BE	On-Demand	Mild	ADRB1	56	50
C#CCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819115700	BE	On-Demand	Mild	ADRB3	62	50
C#CCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819115701	BE	On-Demand	Mild	ADRB2	49	44
C#CCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819115701	BE	On-Demand	Mild	ADRB1	56	50
C#CCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819115701	BE	On-Demand	Mild	ADRB3	62	50
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccccc1Cl	ZINC000819115720	DH	On-Demand	Anodyne	ADRB1	28	44
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccccc1Cl	ZINC000819115720	DH	On-Demand	Anodyne	SLC6A2	16	41
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccccc1Cl	ZINC000819115720	DH	On-Demand	Anodyne	ADRB3	42	44
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccccc1Cl	ZINC000819115721	DH	On-Demand	Anodyne	ADRB1	28	44
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccccc1Cl	ZINC000819115721	DH	On-Demand	Anodyne	SLC6A2	16	41
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccccc1Cl	ZINC000819115721	DH	On-Demand	Anodyne	ADRB3	42	44
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccccc1Cl	ZINC000819115722	DH	On-Demand	Anodyne	ADRB1	28	44
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccccc1Cl	ZINC000819115722	DH	On-Demand	Anodyne	SLC6A2	16	41
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccccc1Cl	ZINC000819115722	DH	On-Demand	Anodyne	ADRB3	42	44
C[C@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccccc1Cl	ZINC000819115723	DH	On-Demand	Anodyne	ADRB1	28	44
C[C@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccccc1Cl	ZINC000819115723	DH	On-Demand	Anodyne	SLC6A2	16	41
C[C@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccccc1Cl	ZINC000819115723	DH	On-Demand	Anodyne	ADRB3	42	44
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1ccccc1Br)C2	ZINC000819115726	FG	On-Demand	Anodyne	HTR3A	30	41
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1ccccc1Br)C2	ZINC000819115726	FG	On-Demand	Anodyne	SLC6A3	15	45
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1ccccc1Br)C2	ZINC000819115726	FG	On-Demand	Anodyne	GLRA1	43	32
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1ccccc1Br)C2	ZINC000819115727	FG	On-Demand	Anodyne	HTR3A	30	41
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1ccccc1Br)C2	ZINC000819115727	FG	On-Demand	Anodyne	SLC6A3	15	45
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1ccccc1Br)C2	ZINC000819115727	FG	On-Demand	Anodyne	GLRA1	43	32
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1ccc(OC(F)(F)F)cc1)C2	ZINC000819115728	FG	On-Demand	Anodyne	GLRA1	42	31
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1ccc(OC(F)(F)F)cc1)C2	ZINC000819115729	FG	On-Demand	Anodyne	GLRA1	42	31
COc1ccc(OC)c([C@H](O)CNC[C@@H](C)Oc2ccccc2C)c1	ZINC000819115762	EG	On-Demand	Anodyne	ADRB2	17	48
COc1ccc(OC)c([C@H](O)CNC[C@H](C)Oc2ccccc2C)c1	ZINC000819115763	EG	On-Demand	Anodyne	ADRB2	17	48
C#CCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819115804	CF	On-Demand	Mild	ADRB2	16	40
C#CCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819115805	CF	On-Demand	Mild	ADRB2	16	40
COc1ccc(OC)c([C@H](O)CNC[C@@H](C)C(=O)OC(C)C)c1	ZINC000819115814	ED	On-Demand	Anodyne	MTNR1A	20	42
COc1ccc(OC)c([C@H](O)CNC[C@H](C)C(=O)OC(C)C)c1	ZINC000819115815	ED	On-Demand	Anodyne	MTNR1A	20	42
C#CCCCNC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819115817	CD	On-Demand	Mild	ADRB2	58	52
C#CCCCNC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819115817	CD	On-Demand	Mild	ADRB1	90	52
C#CCCCNC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819115817	CD	On-Demand	Mild	ADRB3	54	52
C#CCCCNC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819115817	CD	On-Demand	Mild	ABCB1	15	50
C#CCCCNC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819115818	CD	On-Demand	Mild	ADRB2	58	52
C#CCCCNC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819115818	CD	On-Demand	Mild	ADRB1	90	52
C#CCCCNC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819115818	CD	On-Demand	Mild	ADRB3	54	52
C#CCCCNC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819115818	CD	On-Demand	Mild	ABCB1	15	50
C#CCCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819115841	DE	On-Demand	Mild	ADRB2	35	42
C#CCCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819115841	DE	On-Demand	Mild	ADRB1	48	43
C#CCCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819115841	DE	On-Demand	Mild	PDS	47	41
C#CCCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819115842	DE	On-Demand	Mild	ADRB2	35	42
C#CCCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819115842	DE	On-Demand	Mild	ADRB1	48	43
C#CCCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819115842	DE	On-Demand	Mild	PDS	47	41
C#CCCCNC[C@H](O)COc1ccccc1C(C)C	ZINC000819115847	CF	On-Demand	Mild	ADRB2	49	50
C#CCCCNC[C@H](O)COc1ccccc1C(C)C	ZINC000819115847	CF	On-Demand	Mild	ADRB1	66	39
C#CCCCNC[C@H](O)COc1ccccc1C(C)C	ZINC000819115847	CF	On-Demand	Mild	ADRB3	23	43
C#CCCCNC[C@H](O)COc1ccccc1C(C)C	ZINC000819115847	CF	On-Demand	Mild	ABCB1	21	48
C#CCCCNC[C@@H](O)COc1ccccc1C(C)C	ZINC000819115848	CF	On-Demand	Mild	ADRB2	49	50
C#CCCCNC[C@@H](O)COc1ccccc1C(C)C	ZINC000819115848	CF	On-Demand	Mild	ADRB1	66	39
C#CCCCNC[C@@H](O)COc1ccccc1C(C)C	ZINC000819115848	CF	On-Demand	Mild	ADRB3	23	43
C#CCCCNC[C@@H](O)COc1ccccc1C(C)C	ZINC000819115848	CF	On-Demand	Mild	ABCB1	21	48
C#CCCCNC[C@@H](O)COc1ccc(SC)cc1	ZINC000819115860	CE	On-Demand	Mild	ADRB2	50	47
C#CCCCNC[C@@H](O)COc1ccc(SC)cc1	ZINC000819115860	CE	On-Demand	Mild	ADRB1	71	47
C#CCCCNC[C@@H](O)COc1ccc(SC)cc1	ZINC000819115860	CE	On-Demand	Mild	ADRB3	42	47
C#CCCCNC[C@H](O)COc1ccc(SC)cc1	ZINC000819115861	CE	On-Demand	Mild	ADRB2	50	47
C#CCCCNC[C@H](O)COc1ccc(SC)cc1	ZINC000819115861	CE	On-Demand	Mild	ADRB1	71	47
C#CCCCNC[C@H](O)COc1ccc(SC)cc1	ZINC000819115861	CE	On-Demand	Mild	ADRB3	42	47
C#CCCCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819115862	CD	On-Demand	Mild	ADRB2	38	45
C#CCCCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819115862	CD	On-Demand	Mild	ADRB1	65	42
C#CCCCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819115862	CD	On-Demand	Mild	ADRB3	25	43
C#CCCCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819115863	CD	On-Demand	Mild	ADRB2	38	45
C#CCCCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819115863	CD	On-Demand	Mild	ADRB1	65	42
C#CCCCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819115863	CD	On-Demand	Mild	ADRB3	25	43
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1ccc(Cl)c(F)c1)C2	ZINC000819115894	EG	On-Demand	Anodyne	SLC6A3	27	47
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1ccc(Cl)c(F)c1)C2	ZINC000819115895	EG	On-Demand	Anodyne	SLC6A3	27	47
Cc1ccccc1[C@@H](O)CNC1C[C@@H]2CCC[C@H](C1)N2C	ZINC000819115928	CF	On-Demand	Anodyne	CHRM1	17	47
Cc1ccccc1[C@@H](O)CNC1C[C@@H]2CCC[C@H](C1)N2C	ZINC000819115928	CF	On-Demand	Anodyne	HTR3A	32	41
Cc1ccccc1[C@@H](O)CNC1C[C@@H]2CCC[C@H](C1)N2C	ZINC000819115928	CF	On-Demand	Anodyne	SLC6A3	18	47
Cc1ccccc1[C@@H](O)CNC1C[C@@H]2CCC[C@H](C1)N2C	ZINC000819115928	CF	On-Demand	Anodyne	GLRA1	44	32
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1ccc(F)cn1)C2	ZINC000819115945	CD	On-Demand	Anodyne	SLC6A3	15	43
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1ccc(F)cn1)C2	ZINC000819115946	CD	On-Demand	Anodyne	SLC6A3	15	43
CN(C[C@@H](O)CNCCc1c[nH]c2ccc(Cl)cc12)C(=O)OC(C)(C)C	ZINC000819115955	GG	On-Demand	Anodyne	HTR1D	28	40
CN(C[C@@H](O)CNCCc1c[nH]c2ccc(Cl)cc12)C(=O)OC(C)(C)C	ZINC000819115955	GG	On-Demand	Anodyne	MPO	47	37
CN(C[C@H](O)CNCCc1c[nH]c2ccc(Cl)cc12)C(=O)OC(C)(C)C	ZINC000819115956	GG	On-Demand	Anodyne	HTR1D	28	40
CN(C[C@H](O)CNCCc1c[nH]c2ccc(Cl)cc12)C(=O)OC(C)(C)C	ZINC000819115956	GG	On-Demand	Anodyne	MPO	47	37
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819115959	DE	On-Demand	Bother	CACNA1C	48	37
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819115959	DE	On-Demand	Bother	CACNA1D	73	34
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819115959	DE	On-Demand	Bother	GLRA1	42	31
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819115960	DE	On-Demand	Bother	CACNA1C	48	37
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819115960	DE	On-Demand	Bother	CACNA1D	73	34
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819115960	DE	On-Demand	Bother	GLRA1	42	31
CC(C)(C)C(=O)NNC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819115971	GF	On-Demand	Reactive	CNR1	55	34
COc1ccc(OC)c([C@H](O)CNC[C@@H](C)Oc2ccccc2OC)c1	ZINC000819115991	FF	On-Demand	Anodyne	ADRB2	20	53
COc1ccc(OC)c([C@H](O)CNC[C@@H](C)Oc2ccccc2OC)c1	ZINC000819115991	FF	On-Demand	Anodyne	MTNR1A	15	41
COc1ccc(OC)c([C@H](O)CNC[C@@H](C)Oc2ccccc2OC)c1	ZINC000819115991	FF	On-Demand	Anodyne	MTNR1B	16	40
COc1ccc(OC)c([C@H](O)CNC[C@H](C)Oc2ccccc2OC)c1	ZINC000819115992	FF	On-Demand	Anodyne	ADRB2	20	53
COc1ccc(OC)c([C@H](O)CNC[C@H](C)Oc2ccccc2OC)c1	ZINC000819115992	FF	On-Demand	Anodyne	MTNR1A	15	41
COc1ccc(OC)c([C@H](O)CNC[C@H](C)Oc2ccccc2OC)c1	ZINC000819115992	FF	On-Demand	Anodyne	MTNR1B	16	40
C#CCCCNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819116006	CD	On-Demand	Mild	ADRB2	53	48
C#CCCCNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819116006	CD	On-Demand	Mild	ADRB1	83	47
C#CCCCNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819116006	CD	On-Demand	Mild	ADRB3	48	47
C#CCCCNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819116006	CD	On-Demand	Mild	ABCB1	17	62
C#CCCCNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819116007	CD	On-Demand	Mild	ADRB2	53	48
C#CCCCNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819116007	CD	On-Demand	Mild	ADRB1	83	47
C#CCCCNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819116007	CD	On-Demand	Mild	ADRB3	48	47
C#CCCCNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819116007	CD	On-Demand	Mild	ABCB1	17	62
C#CCCCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819116009	CD	On-Demand	Mild	ADRB2	58	63
C#CCCCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819116009	CD	On-Demand	Mild	ADRB1	97	63
C#CCCCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819116009	CD	On-Demand	Mild	GRIN1	22	44
C#CCCCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819116009	CD	On-Demand	Mild	ADRB3	60	62
C#CCCCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819116010	CD	On-Demand	Mild	ADRB2	58	63
C#CCCCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819116010	CD	On-Demand	Mild	ADRB1	97	63
C#CCCCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819116010	CD	On-Demand	Mild	GRIN1	22	44
C#CCCCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819116010	CD	On-Demand	Mild	ADRB3	60	62
C#CCCCNCCC(=O)Nc1ccc(Cl)cc1	ZINC000819116011	CF	On-Demand	Mild	AGPAT2	18	43
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(OCc2ccccc2)c1	ZINC000819116015	EH	On-Demand	Anodyne	PDS	49	35
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(OCc2ccccc2)c1	ZINC000819116016	EH	On-Demand	Anodyne	PDS	49	35
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(OCc2ccccc2)c1	ZINC000819116017	EH	On-Demand	Anodyne	PDS	49	35
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(OCc2ccccc2)c1	ZINC000819116018	EH	On-Demand	Anodyne	PDS	49	35
C#CCCCNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819116019	DF	On-Demand	Mild	CYNT	44	50
C#CCCCNC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819116026	CE	On-Demand	Mild	ADRB2	26	48
C#CCCCNC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819116026	CE	On-Demand	Mild	ADRB1	45	37
C#CCCCNC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819116027	CE	On-Demand	Mild	ADRB2	26	48
C#CCCCNC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819116027	CE	On-Demand	Mild	ADRB1	45	37
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Sc1ccccc1	ZINC000819116036	EG	On-Demand	Bother	ADRB3	51	38
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Sc1ccccc1	ZINC000819116037	EG	On-Demand	Bother	ADRB3	51	38
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Sc1ccccc1	ZINC000819116038	EG	On-Demand	Bother	ADRB3	51	38
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Sc1ccccc1	ZINC000819116039	EG	On-Demand	Bother	ADRB3	51	38
C[C@H](CNC[C@H](O)c1ccccc1)Sc1ccccc1	ZINC000819116052	CG	On-Demand	Anodyne	ADRB2	16	45
C[C@H](CNC[C@H](O)c1ccccc1)Sc1ccccc1	ZINC000819116052	CG	On-Demand	Anodyne	ADRB3	44	43
C[C@H](CNC[C@H](O)c1ccccc1)Sc1ccccc1	ZINC000819116052	CG	On-Demand	Anodyne	AOC3	15	47
C[C@H](CNC[C@@H](O)c1ccccc1)Sc1ccccc1	ZINC000819116053	CG	On-Demand	Anodyne	ADRB2	16	45
C[C@H](CNC[C@@H](O)c1ccccc1)Sc1ccccc1	ZINC000819116053	CG	On-Demand	Anodyne	ADRB3	44	43
C[C@H](CNC[C@@H](O)c1ccccc1)Sc1ccccc1	ZINC000819116053	CG	On-Demand	Anodyne	AOC3	15	47
C[C@@H](CNC[C@@H](O)c1ccccc1)Sc1ccccc1	ZINC000819116054	CG	On-Demand	Anodyne	ADRB2	16	45
C[C@@H](CNC[C@@H](O)c1ccccc1)Sc1ccccc1	ZINC000819116054	CG	On-Demand	Anodyne	ADRB3	44	43
C[C@@H](CNC[C@@H](O)c1ccccc1)Sc1ccccc1	ZINC000819116054	CG	On-Demand	Anodyne	AOC3	15	47
C[C@@H](CNC[C@H](O)c1ccccc1)Sc1ccccc1	ZINC000819116055	CG	On-Demand	Anodyne	ADRB2	16	45
C[C@@H](CNC[C@H](O)c1ccccc1)Sc1ccccc1	ZINC000819116055	CG	On-Demand	Anodyne	ADRB3	44	43
C[C@@H](CNC[C@H](O)c1ccccc1)Sc1ccccc1	ZINC000819116055	CG	On-Demand	Anodyne	AOC3	15	47
C#CCCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819116060	CF	On-Demand	Mild	ADRB2	56	60
C#CCCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819116060	CF	On-Demand	Mild	ADRB1	74	45
C#CCCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819116060	CF	On-Demand	Mild	ADRB3	44	45
C#CCCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819116060	CF	On-Demand	Mild	CASR	43	38
C#CCCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819116061	CF	On-Demand	Mild	ADRB2	56	60
C#CCCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819116061	CF	On-Demand	Mild	ADRB1	74	45
C#CCCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819116061	CF	On-Demand	Mild	ADRB3	44	45
C#CCCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819116061	CF	On-Demand	Mild	CASR	43	38
C#CCCCNC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819116068	CD	On-Demand	Mild	ADRB2	41	46
C#CCCCNC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819116068	CD	On-Demand	Mild	ADRB1	59	38
C#CCCCNC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819116068	CD	On-Demand	Mild	ADRB3	22	42
C#CCCCNC[C@H](O)COc1c(OC)cccc1OC	ZINC000819116069	CD	On-Demand	Mild	ADRB2	41	46
C#CCCCNC[C@H](O)COc1c(OC)cccc1OC	ZINC000819116069	CD	On-Demand	Mild	ADRB1	59	38
C#CCCCNC[C@H](O)COc1c(OC)cccc1OC	ZINC000819116069	CD	On-Demand	Mild	ADRB3	22	42
C#CCCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819116082	DE	On-Demand	Mild	ADRB2	37	45
C#CCCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819116082	DE	On-Demand	Mild	ADRB1	67	41
C#CCCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819116082	DE	On-Demand	Mild	ADRB3	20	41
C#CCCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819116083	DE	On-Demand	Mild	ADRB2	37	45
C#CCCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819116083	DE	On-Demand	Mild	ADRB1	67	41
C#CCCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819116083	DE	On-Demand	Mild	ADRB3	20	41
C#CCCCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819116084	CF	On-Demand	Mild	ADRB2	54	48
C#CCCCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819116084	CF	On-Demand	Mild	ADRB1	71	48
C#CCCCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819116084	CF	On-Demand	Mild	ADRB3	42	48
C#CCCCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819116085	CF	On-Demand	Mild	ADRB2	54	48
C#CCCCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819116085	CF	On-Demand	Mild	ADRB1	71	48
C#CCCCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819116085	CF	On-Demand	Mild	ADRB3	42	48
C#CCCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819116112	BD	On-Demand	Mild	ADRB3	40	36
C#CCCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819116113	BD	On-Demand	Mild	ADRB3	40	36
O=C(O)[C@H](CNS(=O)(=O)c1ccc(Cl)cc1Cl)C1CCOCC1	ZINC000819116158	GE	On-Demand	Anodyne	ITGAV	16	44
O=C(O)[C@@H](CNS(=O)(=O)c1ccc(Cl)cc1Cl)C1CCOCC1	ZINC000819116160	GE	On-Demand	Anodyne	ITGAV	16	44
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1ccc(F)c(Br)c1)C2	ZINC000819116168	FG	On-Demand	Anodyne	SLC6A3	15	42
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1ccc(F)c(Br)c1)C2	ZINC000819116174	FG	On-Demand	Anodyne	SLC6A3	15	42
CCOC(=O)Nc1ccc(NC(=O)[C@H]2C[C@@H]2c2ccc(C)cc2)cc1	ZINC000819116177	EI	On-Demand	Anodyne	KDM1A	21	49
CCOC(=O)Nc1ccc(NC(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)cc1	ZINC000819116179	EI	On-Demand	Anodyne	KDM1A	21	49
CCOC(=O)Nc1ccc(NC(=O)[C@H]2C[C@H]2c2ccc(C)cc2)cc1	ZINC000819116181	EI	On-Demand	Anodyne	KDM1A	21	49
CCOC(=O)Nc1ccc(NC(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)cc1	ZINC000819116183	EI	On-Demand	Anodyne	KDM1A	21	49
C#CCCCNC[C@@H](O)c1cccnc1	ZINC000819116187	BD	On-Demand	Mild	ADRB2	27	48
C#CCCCNC[C@@H](O)c1cccnc1	ZINC000819116187	BD	On-Demand	Mild	ADRB1	30	47
C#CCCCNC[C@@H](O)c1cccnc1	ZINC000819116187	BD	On-Demand	Mild	ADRB3	104	48
C#CCCCNC[C@H](O)c1cccnc1	ZINC000819116188	BD	On-Demand	Mild	ADRB2	27	48
C#CCCCNC[C@H](O)c1cccnc1	ZINC000819116188	BD	On-Demand	Mild	ADRB1	30	47
C#CCCCNC[C@H](O)c1cccnc1	ZINC000819116188	BD	On-Demand	Mild	ADRB3	104	48
C#CCCCNCCC(=O)Nc1cccc(F)c1	ZINC000819116192	BE	On-Demand	Mild	KCNK3	25	40
Cc1cc(N2CC[C@H](NC[C@H](O)c3cccnc3)C2=O)n(C)n1	ZINC000819116200	DC	On-Demand	Anodyne	ADRB3	50	41
Cc1ccccc1O[C@H](C)CNC[C@H](O)c1cccc(F)c1	ZINC000819116203	DG	On-Demand	Anodyne	ADRB1	21	45
Cc1ccccc1O[C@H](C)CNC[C@H](O)c1cccc(F)c1	ZINC000819116203	DG	On-Demand	Anodyne	SLC6A2	16	41
Cc1ccccc1O[C@H](C)CNC[C@@H](O)c1cccc(F)c1	ZINC000819116205	DG	On-Demand	Anodyne	ADRB1	21	45
Cc1ccccc1O[C@H](C)CNC[C@@H](O)c1cccc(F)c1	ZINC000819116205	DG	On-Demand	Anodyne	SLC6A2	16	41
Cc1cc(N2CC[C@H](NC[C@@H](O)c3cccnc3)C2=O)n(C)n1	ZINC000819116206	DC	On-Demand	Anodyne	ADRB3	50	41
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1ccccc1C(F)(F)F)C2	ZINC000819116218	EG	On-Demand	Anodyne	CHRM1	15	40
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1ccccc1C(F)(F)F)C2	ZINC000819116218	EG	On-Demand	Anodyne	GLRA1	42	34
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1ccccc1C(F)(F)F)C2	ZINC000819116220	EG	On-Demand	Anodyne	CHRM1	15	40
CN1[C@H]2CCC[C@H]1CC(NC[C@H](O)c1ccccc1C(F)(F)F)C2	ZINC000819116220	EG	On-Demand	Anodyne	GLRA1	42	34
CC[C@@H](O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819116244	CF	On-Demand	Anodyne	HTR1A	16	46
CC[C@@H](O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819116244	CF	On-Demand	Anodyne	HTR1D	53	48
CC[C@@H](O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819116244	CF	On-Demand	Anodyne	HTR1B	35	46
CC[C@@H](O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819116244	CF	On-Demand	Anodyne	SLC6A4	15	53
CC[C@@H](O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819116244	CF	On-Demand	Anodyne	MPO	97	53
CC[C@@H](O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819116244	CF	On-Demand	Anodyne	HTR1E	15	40
CC[C@@H](O)CNCCc1c[nH]c2ccc(Cl)cc12	ZINC000819116244	CF	On-Demand	Anodyne	MAPT	15	42
O=C(NCCCCN1CCOCC1)C(F)=C1CCC1	ZINC000819116253	CD	On-Demand	Anodyne	EPHX2	19	42
COC(=O)c1ccc(S(=O)(=O)NC[C@H](C(=O)O)C2CCOCC2)cc1C	ZINC000819116254	GD	On-Demand	Anodyne	LEF	18	44
COC(=O)c1ccc(S(=O)(=O)NC[C@@H](C(=O)O)C2CCOCC2)cc1C	ZINC000819116255	GD	On-Demand	Anodyne	LEF	18	44
C#CCCCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819116301	CD	On-Demand	Mild	ADRB2	51	48
C#CCCCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819116301	CD	On-Demand	Mild	ADRB1	77	45
C#CCCCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819116301	CD	On-Demand	Mild	ADRB3	43	45
C#CCCCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819116301	CD	On-Demand	Mild	ABCB1	21	49
C#CCCCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819116302	CD	On-Demand	Mild	ADRB2	51	48
C#CCCCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819116302	CD	On-Demand	Mild	ADRB1	77	45
C#CCCCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819116302	CD	On-Demand	Mild	ADRB3	43	45
C#CCCCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819116302	CD	On-Demand	Mild	ABCB1	21	49
C#CCCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819116327	CF	On-Demand	Mild	ADRB2	44	62
C#CCCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819116327	CF	On-Demand	Mild	ADRB1	67	40
C#CCCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819116327	CF	On-Demand	Mild	ADRB3	27	60
C#CCCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819116327	CF	On-Demand	Mild	CASR	40	38
C#CCCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819116327	CF	On-Demand	Mild	CYP2D6	21	46
C#CCCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819116327	CF	On-Demand	Mild	ABCB1	17	45
C#CCCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819116328	CF	On-Demand	Mild	ADRB2	44	62
C#CCCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819116328	CF	On-Demand	Mild	ADRB1	67	40
C#CCCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819116328	CF	On-Demand	Mild	ADRB3	27	60
C#CCCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819116328	CF	On-Demand	Mild	CASR	40	38
C#CCCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819116328	CF	On-Demand	Mild	CYP2D6	21	46
C#CCCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819116328	CF	On-Demand	Mild	ABCB1	17	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cc(C(=O)NC3CC3)ccc1C)C2	ZINC000819116338	GF	On-Demand	Anodyne	MAPK11	38	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cc(C(=O)NC3CC3)ccc1C)C2	ZINC000819116338	GF	On-Demand	Anodyne	MAPK14	52	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cc(C(=O)NC3CC3)ccc1C)C2	ZINC000819116338	GF	On-Demand	Anodyne	MAPK13	47	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cc(C(=O)NC3CC3)ccc1C)C2	ZINC000819116339	GF	On-Demand	Anodyne	MAPK11	38	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cc(C(=O)NC3CC3)ccc1C)C2	ZINC000819116339	GF	On-Demand	Anodyne	MAPK14	52	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cc(C(=O)NC3CC3)ccc1C)C2	ZINC000819116339	GF	On-Demand	Anodyne	MAPK13	47	35
C#CCCCNC[C@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819116346	DG	On-Demand	Mild	ADRB2	26	45
C#CCCCNC[C@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819116346	DG	On-Demand	Mild	ADRB1	53	32
C#CCCCNC[C@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819116346	DG	On-Demand	Mild	VDR	18	43
C#CCCCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819116347	DG	On-Demand	Mild	ADRB2	26	45
C#CCCCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819116347	DG	On-Demand	Mild	ADRB1	53	32
C#CCCCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819116347	DG	On-Demand	Mild	VDR	18	43
C#CCCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819116348	CD	On-Demand	Mild	ADRB2	26	63
C#CCCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819116348	CD	On-Demand	Mild	ADRB1	66	63
C#CCCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819116348	CD	On-Demand	Mild	CYP2D6	15	42
C#CCCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819116349	CD	On-Demand	Mild	ADRB2	26	63
C#CCCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819116349	CD	On-Demand	Mild	ADRB1	66	63
C#CCCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819116349	CD	On-Demand	Mild	CYP2D6	15	42
Cc1ccccc1O[C@H](C)CNC[C@@H](O)c1ccccc1	ZINC000819116403	CG	On-Demand	Anodyne	ADRB2	19	48
Cc1ccccc1O[C@H](C)CNC[C@@H](O)c1ccccc1	ZINC000819116403	CG	On-Demand	Anodyne	ADRB1	24	41
Cc1ccccc1O[C@H](C)CNC[C@@H](O)c1ccccc1	ZINC000819116403	CG	On-Demand	Anodyne	ADRB3	50	39
Cc1ccccc1O[C@H](C)CNC[C@@H](O)c1ccccc1	ZINC000819116403	CG	On-Demand	Anodyne	AOC3	15	43
Cc1ccccc1O[C@H](C)CNC[C@H](O)c1ccccc1	ZINC000819116405	CG	On-Demand	Anodyne	ADRB2	19	48
Cc1ccccc1O[C@H](C)CNC[C@H](O)c1ccccc1	ZINC000819116405	CG	On-Demand	Anodyne	ADRB1	24	41
Cc1ccccc1O[C@H](C)CNC[C@H](O)c1ccccc1	ZINC000819116405	CG	On-Demand	Anodyne	ADRB3	50	39
Cc1ccccc1O[C@H](C)CNC[C@H](O)c1ccccc1	ZINC000819116405	CG	On-Demand	Anodyne	AOC3	15	43
O=C(O)[C@H](CNS(=O)(=O)c1ccc(C(F)(F)F)c(F)c1)C1CCOCC1	ZINC000819116444	GE	On-Demand	Anodyne	SFRP1	133	41
O=C(O)[C@H](CNS(=O)(=O)c1ccc(C(F)(F)F)c(F)c1)C1CCOCC1	ZINC000819116444	GE	On-Demand	Anodyne	WNT3	89	41
O=C(O)[C@@H](CNS(=O)(=O)c1ccc(C(F)(F)F)c(F)c1)C1CCOCC1	ZINC000819116445	GE	On-Demand	Anodyne	SFRP1	133	41
O=C(O)[C@@H](CNS(=O)(=O)c1ccc(C(F)(F)F)c(F)c1)C1CCOCC1	ZINC000819116445	GE	On-Demand	Anodyne	WNT3	89	41
Cc1ccccc1O[C@H](C)CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819116460	EF	On-Demand	Bother	CACNA1C	43	36
Cc1ccccc1O[C@H](C)CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819116460	EF	On-Demand	Bother	ADRB3	45	36
Cc1ccccc1O[C@H](C)CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819116460	EF	On-Demand	Bother	CACNA1D	68	36
Cc1ccccc1O[C@H](C)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819116461	EF	On-Demand	Bother	CACNA1C	43	36
Cc1ccccc1O[C@H](C)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819116461	EF	On-Demand	Bother	ADRB3	45	36
Cc1ccccc1O[C@H](C)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819116461	EF	On-Demand	Bother	CACNA1D	68	36
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1cc3ccccc3o1)C2	ZINC000819116475	DG	On-Demand	Anodyne	HTR3A	35	42
CN1[C@H]2CCC[C@H]1CC(NC[C@@H](O)c1cc3ccccc3o1)C2	ZINC000819116475	DG	On-Demand	Anodyne	GLRA1	44	36
O[C@@H](CNCCc1c[nH]c2ccc(Cl)cc12)C1CC1	ZINC000819116485	CF	On-Demand	Anodyne	HTR1D	65	41
O[C@@H](CNCCc1c[nH]c2ccc(Cl)cc12)C1CC1	ZINC000819116485	CF	On-Demand	Anodyne	HTR1B	52	44
O[C@@H](CNCCc1c[nH]c2ccc(Cl)cc12)C1CC1	ZINC000819116485	CF	On-Demand	Anodyne	SLC6A4	15	51
O[C@@H](CNCCc1c[nH]c2ccc(Cl)cc12)C1CC1	ZINC000819116485	CF	On-Demand	Anodyne	MPO	77	44
O[C@H](CNCCc1c[nH]c2ccc(Cl)cc12)C1CC1	ZINC000819116486	CF	On-Demand	Anodyne	HTR1D	65	41
O[C@H](CNCCc1c[nH]c2ccc(Cl)cc12)C1CC1	ZINC000819116486	CF	On-Demand	Anodyne	HTR1B	52	44
O[C@H](CNCCc1c[nH]c2ccc(Cl)cc12)C1CC1	ZINC000819116486	CF	On-Demand	Anodyne	SLC6A4	15	51
O[C@H](CNCCc1c[nH]c2ccc(Cl)cc12)C1CC1	ZINC000819116486	CF	On-Demand	Anodyne	MPO	77	44
C#CCCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819116503	CD	On-Demand	Mild	ADRB2	41	53
C#CCCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819116503	CD	On-Demand	Mild	ADRB1	65	53
C#CCCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819116503	CD	On-Demand	Mild	ADRB3	36	53
C#CCCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819116504	CD	On-Demand	Mild	ADRB2	41	53
C#CCCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819116504	CD	On-Demand	Mild	ADRB1	65	53
C#CCCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819116504	CD	On-Demand	Mild	ADRB3	36	53
C#CCCCNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819116533	EG	On-Demand	Mild	ADRB2	64	53
C#CCCCNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819116533	EG	On-Demand	Mild	ADRB1	92	53
C#CCCCNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819116533	EG	On-Demand	Mild	ADRB3	58	53
C#CCCCNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819116534	EG	On-Demand	Mild	ADRB2	64	53
C#CCCCNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819116534	EG	On-Demand	Mild	ADRB1	92	53
C#CCCCNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819116534	EG	On-Demand	Mild	ADRB3	58	53
C#CCCCNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819116543	CG	On-Demand	Mild	HDAC10	17	58
C#CCCCNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819116543	CG	On-Demand	Mild	KCNK3	19	43
C#CCCCNC[C@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819116548	FG	On-Demand	Mild	SLC6A3	15	40
C#CCCCNC[C@@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819116549	FG	On-Demand	Mild	SLC6A3	15	40
C#CCCCNC[C@@H](O)COc1ccc(Cl)cc1Br	ZINC000819116569	EF	On-Demand	Mild	ADRB2	18	40
C#CCCCNC[C@H](O)COc1ccc(Cl)cc1Br	ZINC000819116570	EF	On-Demand	Mild	ADRB2	18	40
C[C@@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Sc1ccccc1	ZINC000819116579	FF	On-Demand	Anodyne	ADRB3	37	41
C[C@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Sc1ccccc1	ZINC000819116580	FF	On-Demand	Anodyne	ADRB3	37	41
C[C@@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Sc1ccccc1	ZINC000819116581	FF	On-Demand	Anodyne	ADRB3	37	41
C[C@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Sc1ccccc1	ZINC000819116582	FF	On-Demand	Anodyne	ADRB3	37	41
C#CCCCNC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819116603	CD	On-Demand	Mild	ADRB1	50	39
C#CCCCNC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819116604	CD	On-Demand	Mild	ADRB1	50	39
C#CCCCNC[C@H](O)COCc1ccc(OC)cc1	ZINC000819116650	CD	On-Demand	Mild	ADRB2	35	55
C#CCCCNC[C@H](O)COCc1ccc(OC)cc1	ZINC000819116650	CD	On-Demand	Mild	ADRB1	43	55
C#CCCCNC[C@H](O)COCc1ccc(OC)cc1	ZINC000819116650	CD	On-Demand	Mild	ADRB3	31	55
C#CCCCNC[C@@H](O)COCc1ccc(OC)cc1	ZINC000819116651	CD	On-Demand	Mild	ADRB2	35	55
C#CCCCNC[C@@H](O)COCc1ccc(OC)cc1	ZINC000819116651	CD	On-Demand	Mild	ADRB1	43	55
C#CCCCNC[C@@H](O)COCc1ccc(OC)cc1	ZINC000819116651	CD	On-Demand	Mild	ADRB3	31	55
C#CCCCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819116678	DH	On-Demand	Mild	LTA4H	57	53
C#CCCCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819116678	DH	On-Demand	Mild	CA1	17	40
C#CCCCNCCC(=O)Nc1cccnc1	ZINC000819116689	BD	On-Demand	Mild	NAMPT	19	42
CS(=O)(=O)Nc1ccc(CNC(=O)C(F)=C2CCC2)cc1	ZINC000819116721	DE	On-Demand	Anodyne	TRPV1	35	52
COc1cccc([S@@](=O)CC(=O)NCCSC(F)(F)F)c1	ZINC000819116736	EE	On-Demand	Anodyne	MTNR1A	45	43
COc1cccc([S@@](=O)CC(=O)NCCSC(F)(F)F)c1	ZINC000819116736	EE	On-Demand	Anodyne	MTNR1B	42	43
C#CCCCNC[C@@H](O)COc1ccc(/C=C/C)cc1OC	ZINC000819116777	DE	On-Demand	Mild	ADRB2	22	67
C#CCCCNC[C@@H](O)COc1ccc(/C=C/C)cc1OC	ZINC000819116777	DE	On-Demand	Mild	ADRB1	17	67
C#CCCCNC[C@@H](O)COc1ccc(/C=C\C)cc1OC	ZINC000819116778	DE	On-Demand	Mild	ADRB2	22	67
C#CCCCNC[C@@H](O)COc1ccc(/C=C\C)cc1OC	ZINC000819116778	DE	On-Demand	Mild	ADRB1	17	67
C#CCCCNC[C@H](O)COc1ccc(/C=C\C)cc1OC	ZINC000819116779	DE	On-Demand	Mild	ADRB2	22	67
C#CCCCNC[C@H](O)COc1ccc(/C=C\C)cc1OC	ZINC000819116779	DE	On-Demand	Mild	ADRB1	17	67
C#CCCCNC[C@H](O)COc1ccc(/C=C/C)cc1OC	ZINC000819116780	DE	On-Demand	Mild	ADRB2	22	67
C#CCCCNC[C@H](O)COc1ccc(/C=C/C)cc1OC	ZINC000819116780	DE	On-Demand	Mild	ADRB1	17	67
O=C(CCc1cccc(OC(F)F)c1)NCCSC(F)(F)F	ZINC000819116790	EH	On-Demand	Anodyne	PDS	45	35
C#CCCCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819116791	DD	On-Demand	Mild	ADRB1	47	39
C#CCCCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819116791	DD	On-Demand	Mild	ADRB3	27	40
C#CCCCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819116792	DD	On-Demand	Mild	ADRB1	47	39
C#CCCCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819116792	DD	On-Demand	Mild	ADRB3	27	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(NS(C)(=O)=O)cc1)C2	ZINC000819116813	GD	On-Demand	Anodyne	TRPV1	24	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(NS(C)(=O)=O)cc1)C2	ZINC000819116814	GD	On-Demand	Anodyne	TRPV1	24	45
NC(=O)CCOc1ccc(NC(=O)C(=O)N2CCO[C@@H](C(=O)O)C2)cc1	ZINC000819116826	FB	On-Demand	Anodyne	CYSLTR2	45	33
NC(=O)CCOc1ccc(NC(=O)C(=O)N2CCO[C@H](C(=O)O)C2)cc1	ZINC000819116827	FB	On-Demand	Anodyne	CYSLTR2	45	33
NC(=O)CC1CCN(C(=O)C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819116831	EC	On-Demand	Anodyne	GRIN2B	41	35
NC(=O)CC1CCN(C(=O)C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819116831	EC	On-Demand	Anodyne	CCR3	16	41
NC(=O)N1CCC[C@H]1C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116835	CB	On-Demand	Anodyne	PREP	57	47
NC(=O)N1CCC[C@H]1C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116836	CB	On-Demand	Anodyne	PREP	57	47
NC(=O)COc1cccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819116838	FC	On-Demand	Anodyne	CCR3	31	42
NC(=O)COc1cccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819116838	FC	On-Demand	Anodyne	EPHX2	17	42
NC(=O)COc1cccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819116839	FC	On-Demand	Anodyne	CCR3	31	42
NC(=O)COc1cccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819116839	FC	On-Demand	Anodyne	EPHX2	17	42
NC(=O)CNC(=O)c1cccc(NC(=O)C(=O)NCCC(=O)O)c1	ZINC000819116840	EA	On-Demand	Anodyne	KCNK3	88	37
NC(=O)CNC(=O)c1cccc(NC(=O)C(=O)NCCC(=O)O)c1	ZINC000819116840	EA	On-Demand	Anodyne	KCNK9	42	37
NC(=O)CSc1ccccc1NC(=O)N1CCC[C@H]1C(=O)O	ZINC000819116841	DD	On-Demand	Anodyne	F2	52	39
NC(=O)CSc1ccccc1NC(=O)N1CCC[C@H]1C(=O)O	ZINC000819116841	DD	On-Demand	Anodyne	ACE	69	43
NC(=O)CSc1ccccc1NC(=O)N1CCC[C@H]1C(=O)O	ZINC000819116841	DD	On-Demand	Anodyne	FKBP1A	30	44
NC(=O)CSc1ccccc1NC(=O)N1CCC[C@H]1C(=O)O	ZINC000819116841	DD	On-Demand	Anodyne	MME	17	44
NC(=O)CSc1ccccc1NC(=O)N1CCC[C@H]1C(=O)O	ZINC000819116841	DD	On-Demand	Anodyne	KCNQ2	51	34
NC(=O)CSc1ccccc1NC(=O)N1CCC[C@H]1C(=O)O	ZINC000819116841	DD	On-Demand	Anodyne	TRY1_BOVIN	57	39
NC(=O)CSc1ccccc1NC(=O)N1CCC[C@H]1C(=O)O	ZINC000819116841	DD	On-Demand	Anodyne	PREP	61	39
NC(=O)CSc1ccccc1NC(=O)N1CCC[C@H]1C(=O)O	ZINC000819116841	DD	On-Demand	Anodyne	LGMN	70	40
NC(=O)CSc1ccccc1NC(=O)N1CCC[C@H]1C(=O)O	ZINC000819116841	DD	On-Demand	Anodyne	HCRTR2	17	41
NC(=O)CSc1ccccc1NC(=O)N1CCC[C@H]1C(=O)O	ZINC000819116841	DD	On-Demand	Anodyne	TMPRSS11D	62	34
NC(=O)CS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819116850	GD	On-Demand	Anodyne	CA2	19	51
NC(=O)COc1ccccc1C(=O)OCc1ccc(C(=O)O)cc1	ZINC000819116851	ED	On-Demand	Anodyne	PTGER1	25	48
NC(=O)COc1ccccc1C(=O)OCc1ccc(C(=O)O)cc1	ZINC000819116851	ED	On-Demand	Anodyne	ACR	24	40
NC(=O)N1CCC[C@H]1C(=O)NCCCCCC(=O)O	ZINC000819116856	CC	On-Demand	Anodyne	F2	47	44
NC(=O)N1CCC[C@H]1C(=O)NCCCCCC(=O)O	ZINC000819116856	CC	On-Demand	Anodyne	FKBP1A	15	44
NC(=O)N1CCC[C@H]1C(=O)NCCCCCC(=O)O	ZINC000819116856	CC	On-Demand	Anodyne	TRY1_BOVIN	49	36
NC(=O)N1CCC[C@H]1C(=O)NCCCCCC(=O)O	ZINC000819116856	CC	On-Demand	Anodyne	NTSR1	64	33
NC(=O)N1CCC[C@H]1C(=O)NCCCCCC(=O)O	ZINC000819116856	CC	On-Demand	Anodyne	NTSR2	60	31
NC(=O)N1CCC[C@H]1C(=O)NCCCCCC(=O)O	ZINC000819116856	CC	On-Demand	Anodyne	TPP2	39	52
NC(=O)N1CCC[C@H]1C(=O)NCCCCCC(=O)O	ZINC000819116856	CC	On-Demand	Anodyne	TMPRSS11D	42	36
NC(=O)COc1cccc(NC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819116859	ED	On-Demand	Anodyne	LTA4H	17	40
NC(=O)COc1cccc(NC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819116859	ED	On-Demand	Anodyne	UL80	30	44
NC(=O)COc1cccc(NC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819116859	ED	On-Demand	Anodyne	ROCK2	29	42
NC(=O)COc1cccc(NC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819116859	ED	On-Demand	Anodyne	PLA2G4B	50	34
NC(=O)COc1cccc(NC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819116859	ED	On-Demand	Anodyne	EPHX2	31	42
NC(=O)COc1cccc(NC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819116859	ED	On-Demand	Anodyne	PDS	57	39
NC(=O)COc1ccccc1C(=O)Nc1ccccc1CC(=O)O	ZINC000819116863	ED	On-Demand	Anodyne	PLA2G1B	50	35
NC(=O)COc1ccccc1C(=O)Nc1ccccc1CC(=O)O	ZINC000819116863	ED	On-Demand	Anodyne	CXCL8	36	41
NC(=O)COc1ccccc1C(=O)Nc1ccccc1CC(=O)O	ZINC000819116863	ED	On-Demand	Anodyne	KCNK3	50	39
NC(=O)COc1ccccc1C(=O)Nc1ccccc1CC(=O)O	ZINC000819116863	ED	On-Demand	Anodyne	KCNK9	47	39
NC(=O)NC1CCC(C(=O)OCc2ccc(C(=O)O)cc2)CC1	ZINC000819116867	DD	On-Demand	Anodyne	PLG	18	41
NC(=O)NC1CCC(C(=O)OCc2ccc(C(=O)O)cc2)CC1	ZINC000819116867	DD	On-Demand	Anodyne	FKBP1A	15	41
NC(=O)NC1CCC(C(=O)OCc2ccc(C(=O)O)cc2)CC1	ZINC000819116867	DD	On-Demand	Anodyne	LTA4H	20	41
NC(=O)NC1CCC(C(=O)OCc2ccc(C(=O)O)cc2)CC1	ZINC000819116867	DD	On-Demand	Anodyne	EPHX2	19	40
NC(=O)NC1CCC(C(=O)OCc2ccc(C(=O)O)cc2)CC1	ZINC000819116867	DD	On-Demand	Anodyne	ST14	18	41
NC(=O)CCSc1ccccc1NC(=O)NCC(=O)O	ZINC000819116868	CC	On-Demand	Anodyne	F7	15	40
NC(=O)CSc1ccccc1NC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116872	FE	On-Demand	Anodyne	HDAC1	20	44
NC(=O)CSc1ccccc1NC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116872	FE	On-Demand	Anodyne	FURIN	46	35
NC(=O)CSc1ccccc1NC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116872	FE	On-Demand	Anodyne	PROC	44	34
NC(=O)CSc1ccccc1NC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116872	FE	On-Demand	Anodyne	TMPRSS11D	61	34
NC(=O)COc1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819116876	DC	On-Demand	Anodyne	HRH2	31	42
NC(=O)COc1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819116876	DC	On-Demand	Anodyne	CPT1A	43	38
NC(=O)COc1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819116876	DC	On-Demand	Anodyne	EPHX2	21	42
NC(=O)COc1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819116876	DC	On-Demand	Anodyne	DPP7	29	40
NC(=O)COc1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819116876	DC	On-Demand	Anodyne	PDS	43	34
NC(=O)CS(=O)(=O)c1ccc(C(=O)N2CCC(C(=O)O)CC2)cc1	ZINC000819116878	FB	On-Demand	Anodyne	L3MBTL3	91	46
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	F2	23	45
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	KLKB1	23	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	ACE	62	49
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	OPRM1	82	52
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	OPRD1	85	52
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	FOLH1	55	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	MME	175	60
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	LTA4H	18	44
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	ANPEP	94	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	TACR1	27	56
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	CTSD	26	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	MC4R	68	43
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	CMA1	23	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	FCER2	107	43
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	GRB2	85	43
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	CASP3	21	46
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	BMP1	16	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	TACR2	35	47
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	RNPEP	42	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	PTPN2	20	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	NPY1R	31	43
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	KLK3	85	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	CTSB	91	50
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	PAPA1_CARPA	99	51
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	CYSP_TRYCR	82	43
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	CCKAR	80	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	CTSK	32	49
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	CTSL	85	50
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	CPA1	50	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	PGA	45	39
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	F2R	31	45
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	NPFFR2	88	49
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	TIMP3	76	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	C3AR1	89	43
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	HLA-A	31	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	CTRB1	30	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	TACR3	32	53
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	NAALAD2	32	47
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	MC3R	84	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	MC5R	78	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	CAPNS1	75	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	MMP2	35	44
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	MMP3	58	44
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	MMP8	34	49
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	GRIA1	114	54
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	HLA-DRB1	100	45
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	REN	65	44
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	PCSK5	62	47
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	FURIN	104	48
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	PTPRA	67	38
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	PTPN1	25	49
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	CCKBR	52	45
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	CTSS	36	50
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	GHSR	22	43
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	CAPN1	138	47
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	MMP9	37	49
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	CASP1	33	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	CAPN2	141	47
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	ACE2	78	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	MC1R	130	45
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	PLAU	43	35
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	F7	26	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	CASP9	44	35
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	BACE1	16	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	LAP3	41	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	CTSV	55	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	ST14	57	44
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	PROC	38	46
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	MMP1	51	50
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	FPR1	87	61
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	CTRB_BOVIN	46	34
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	NPR	86	43
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	AMP1_PLAFQ	57	47
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	SIRT1	28	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	PSMB5	48	43
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	BLA1_STEMA	77	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	KISS1R	81	38
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	POLG_WNV	88	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	QRFPR	64	47
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	PSMB8	62	37
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	NPFFR1	102	50
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	TMPRSS11D	47	39
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	TMPRSS6	67	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116879	CC	On-Demand	Anodyne	HPN	60	44
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	F2	23	45
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	KLKB1	23	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	ACE	62	49
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	OPRM1	82	52
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	OPRD1	85	52
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	FOLH1	55	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	MME	175	60
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	LTA4H	18	44
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	ANPEP	94	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	TACR1	27	56
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	CTSD	26	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	MC4R	68	43
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	CMA1	23	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	FCER2	107	43
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	GRB2	85	43
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	CASP3	21	46
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	BMP1	16	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	TACR2	35	47
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	RNPEP	42	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	PTPN2	20	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	NPY1R	31	43
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	KLK3	85	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	CTSB	91	50
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	PAPA1_CARPA	99	51
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	CYSP_TRYCR	82	43
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	CCKAR	80	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	CTSK	32	49
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	CTSL	85	50
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	CPA1	50	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	PGA	45	39
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	F2R	31	45
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	NPFFR2	88	49
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	TIMP3	76	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	C3AR1	89	43
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	HLA-A	31	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	CTRB1	30	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	TACR3	32	53
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	NAALAD2	32	47
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	MC3R	84	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	MC5R	78	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	CAPNS1	75	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	MMP2	35	44
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	MMP3	58	44
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	MMP8	34	49
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	GRIA1	114	54
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	HLA-DRB1	100	45
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	REN	65	44
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	PCSK5	62	47
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	FURIN	104	48
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	PTPRA	67	38
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	PTPN1	25	49
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	CCKBR	52	45
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	CTSS	36	50
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	GHSR	22	43
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	CAPN1	138	47
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	MMP9	37	49
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	CASP1	33	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	CAPN2	141	47
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	ACE2	78	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	MC1R	130	45
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	PLAU	43	35
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	F7	26	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	CASP9	44	35
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	BACE1	16	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	LAP3	41	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	CTSV	55	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	ST14	57	44
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	PROC	38	46
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	MMP1	51	50
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	FPR1	87	61
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	CTRB_BOVIN	46	34
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	NPR	86	43
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	AMP1_PLAFQ	57	47
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	SIRT1	28	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	PSMB5	48	43
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	BLA1_STEMA	77	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	KISS1R	81	38
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	POLG_WNV	88	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	QRFPR	64	47
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	PSMB8	62	37
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	NPFFR1	102	50
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	TMPRSS11D	47	39
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	TMPRSS6	67	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCC(=O)O	ZINC000819116880	CC	On-Demand	Anodyne	HPN	60	44
NC(=O)CCOc1ccc(NC(=O)C(=O)NCC(=O)O)cc1	ZINC000819116881	DB	On-Demand	Anodyne	LTA4H	34	41
NC(=O)CCOc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819116883	CC	On-Demand	Anodyne	CA2	17	43
NC(=O)CCOc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819116883	CC	On-Demand	Anodyne	ADRB1	24	40
NC(=O)CCOc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819116883	CC	On-Demand	Anodyne	LTA4H	36	43
NC(=O)CCOc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819116883	CC	On-Demand	Anodyne	CA1	49	43
NC(=O)CCOc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819116883	CC	On-Demand	Anodyne	EPHX2	15	46
NC(=O)CCOc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819116883	CC	On-Demand	Anodyne	CA12	27	43
NC(=O)CCOc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819116883	CC	On-Demand	Anodyne	CA9	28	43
NC(=O)CCOc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819116883	CC	On-Demand	Anodyne	NCE103	20	43
NC(=O)CCN(Cc1ccccc1)C(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819116884	EC	On-Demand	Anodyne	SLC6A1	123	45
NC(=O)CCN(Cc1ccccc1)C(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819116884	EC	On-Demand	Anodyne	CCR5	32	41
NC(=O)CCN(Cc1ccccc1)C(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819116884	EC	On-Demand	Anodyne	CYP2J2	44	31
NC(=O)CCN(Cc1ccccc1)C(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819116884	EC	On-Demand	Anodyne	WNT3A	46	40
NC(=O)CCN(Cc1ccccc1)C(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819116885	EC	On-Demand	Anodyne	SLC6A1	123	45
NC(=O)CCN(Cc1ccccc1)C(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819116885	EC	On-Demand	Anodyne	CCR5	32	41
NC(=O)CCN(Cc1ccccc1)C(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819116885	EC	On-Demand	Anodyne	CYP2J2	44	31
NC(=O)CCN(Cc1ccccc1)C(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819116885	EC	On-Demand	Anodyne	WNT3A	46	40
NC(=O)CCOc1ccccc1NC(=O)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116888	EB	On-Demand	Anodyne	SLC6A1	42	33
NC(=O)CCOc1ccccc1NC(=O)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116889	EB	On-Demand	Anodyne	SLC6A1	42	33
NC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819116891	FC	On-Demand	Anodyne	LTA4H	44	38
NC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819116891	FC	On-Demand	Anodyne	UL80	21	41
NC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819116891	FC	On-Demand	Anodyne	PLA2G4B	54	38
NC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819116891	FC	On-Demand	Anodyne	ACR	60	36
NC(=O)COc1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819116891	FC	On-Demand	Anodyne	TPSAB1	16	41
NC(=O)C[C@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819116892	DD	On-Demand	Anodyne	F2	27	41
NC(=O)C[C@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819116892	DD	On-Demand	Anodyne	FURIN	43	37
NC(=O)C[C@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819116892	DD	On-Demand	Anodyne	DPP7	56	38
NC(=O)C[C@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819116892	DD	On-Demand	Anodyne	TPSAB1	16	46
NC(=O)C[C@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819116892	DD	On-Demand	Anodyne	PROC	58	41
NC(=O)C[C@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819116892	DD	On-Demand	Anodyne	TMPRSS11D	71	36
NC(=O)C[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819116893	DD	On-Demand	Anodyne	F2	27	41
NC(=O)C[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819116893	DD	On-Demand	Anodyne	FURIN	43	37
NC(=O)C[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819116893	DD	On-Demand	Anodyne	DPP7	56	38
NC(=O)C[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819116893	DD	On-Demand	Anodyne	TPSAB1	16	46
NC(=O)C[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819116893	DD	On-Demand	Anodyne	PROC	58	41
NC(=O)C[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819116893	DD	On-Demand	Anodyne	TMPRSS11D	71	36
NC(=O)Cc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819116894	CD	On-Demand	Anodyne	ALOX5	15	43
NC(=O)Cc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819116894	CD	On-Demand	Anodyne	MAOB	58	41
NC(=O)Cc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819116894	CD	On-Demand	Anodyne	SRD5A2	19	63
NC(=O)Cc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819116894	CD	On-Demand	Anodyne	PTGER2	23	50
NC(=O)Cc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819116894	CD	On-Demand	Anodyne	CYSLTR1	24	53
NC(=O)Cc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819116894	CD	On-Demand	Anodyne	FOLH1	19	45
NC(=O)Cc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819116894	CD	On-Demand	Anodyne	LTA4H	23	40
NC(=O)Cc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819116894	CD	On-Demand	Anodyne	PTGER1	57	50
NC(=O)Cc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819116894	CD	On-Demand	Anodyne	PTGER4	20	50
NC(=O)Cc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819116894	CD	On-Demand	Anodyne	UL80	24	45
NC(=O)Cc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819116894	CD	On-Demand	Anodyne	PLA2G2A	46	39
NC(=O)Cc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819116894	CD	On-Demand	Anodyne	PLA2G4B	53	38
NC(=O)Cc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819116894	CD	On-Demand	Anodyne	NR1H3	16	45
NC(=O)Cc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819116894	CD	On-Demand	Anodyne	ACR	62	53
NC(=O)Cc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819116894	CD	On-Demand	Anodyne	FFAR1	69	51
NC(=O)Cc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819116894	CD	On-Demand	Anodyne	FFAR4	40	43
NC(=O)Cc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819116894	CD	On-Demand	Anodyne	PDS	43	34
NC(=O)Cc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819116894	CD	On-Demand	Anodyne	KLK_PIG	45	35
NC(=O)COc1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819116895	FD	On-Demand	Anodyne	HRH2	23	40
NC(=O)COc1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819116895	FD	On-Demand	Anodyne	ROCK1	15	41
NC(=O)COc1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819116895	FD	On-Demand	Anodyne	ROCK2	29	42
NC(=O)COc1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819116895	FD	On-Demand	Anodyne	PDS	62	39
NC(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)c1ccccc1)c1ccccc1	ZINC000819116896	ED	On-Demand	Anodyne	MME	17	40
NC(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)c1ccccc1)c1ccccc1	ZINC000819116896	ED	On-Demand	Anodyne	C3AR1	48	36
NC(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)c1ccccc1)c1ccccc1	ZINC000819116896	ED	On-Demand	Anodyne	NAALAD2	20	43
NC(=O)N[C@@H](CC(=O)N[C@H](C(=O)O)c1ccccc1)c1ccccc1	ZINC000819116896	ED	On-Demand	Anodyne	GSTP1	16	40
NC(=O)N[C@H](CC(=O)N[C@H](C(=O)O)c1ccccc1)c1ccccc1	ZINC000819116897	ED	On-Demand	Anodyne	MME	17	40
NC(=O)N[C@H](CC(=O)N[C@H](C(=O)O)c1ccccc1)c1ccccc1	ZINC000819116897	ED	On-Demand	Anodyne	C3AR1	48	36
NC(=O)N[C@H](CC(=O)N[C@H](C(=O)O)c1ccccc1)c1ccccc1	ZINC000819116897	ED	On-Demand	Anodyne	NAALAD2	20	43
NC(=O)N[C@H](CC(=O)N[C@H](C(=O)O)c1ccccc1)c1ccccc1	ZINC000819116897	ED	On-Demand	Anodyne	GSTP1	16	40
NC(=O)CC(=O)Nc1ccccc1CC(=O)O	ZINC000819116900	BC	On-Demand	Anodyne	CXCL8	41	49
NC(=O)COc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819116902	DC	On-Demand	Anodyne	PDGFRB	42	40
NC(=O)COc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819116902	DC	On-Demand	Anodyne	EPHX2	49	38
NC(=O)COc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819116903	DC	On-Demand	Anodyne	PDGFRB	42	40
NC(=O)COc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819116903	DC	On-Demand	Anodyne	EPHX2	49	38
NC(=O)CCOc1ccc(NC(=O)N2CCO[C@@H](C(=O)O)C2)cc1	ZINC000819116904	EC	On-Demand	Anodyne	CYSLTR2	45	33
NC(=O)CCOc1ccc(NC(=O)N2CCO[C@H](C(=O)O)C2)cc1	ZINC000819116905	EC	On-Demand	Anodyne	CYSLTR2	45	33
NC(=O)CCNC(=O)c1ccccc1NCc1ccc(C(=O)O)cc1	ZINC000819116906	ED	On-Demand	Anodyne	HDAC1	35	42
NC(=O)CCNC(=O)c1ccccc1NCc1ccc(C(=O)O)cc1	ZINC000819116906	ED	On-Demand	Anodyne	FURIN	41	36
NC(=O)CCNC(=O)c1ccc(F)c(NCc2ccc(C(=O)O)cc2)c1	ZINC000819116910	FD	On-Demand	Anodyne	GCGR	40	35
NC(=O)CCNC(=O)c1ccc(F)c(NCc2ccc(C(=O)O)cc2)c1	ZINC000819116910	FD	On-Demand	Anodyne	KDM4E	23	41
NC(=O)CCOc1ccc(NC(=O)N2CCC(C(=O)O)CC2)cc1	ZINC000819116912	ED	On-Demand	Anodyne	PDGFRB	52	42
NC(=O)CCOc1ccc(NC(=O)N2CCC(C(=O)O)CC2)cc1	ZINC000819116912	ED	On-Demand	Anodyne	LTA4H	41	44
NC(=O)CCOc1ccc(NC(=O)N2CCC(C(=O)O)CC2)cc1	ZINC000819116912	ED	On-Demand	Anodyne	HRH3	15	42
NC(=O)CCOc1ccc(NC(=O)N2CCC(C(=O)O)CC2)cc1	ZINC000819116912	ED	On-Demand	Anodyne	EPHX2	44	46
NC(=O)CCNC(=O)c1cccc(NC(=O)NC2(C(=O)O)CCCC2)c1	ZINC000819116913	FC	On-Demand	Anodyne	EPHX2	23	48
NC(=O)CCNC(=O)c1cccc(NC(=O)NC2(C(=O)O)CCCC2)c1	ZINC000819116913	FC	On-Demand	Anodyne	KCNK3	71	33
NC(=O)N[C@@H](CC(=O)OCc1ccc(C(=O)O)cc1)c1ccccc1	ZINC000819116921	EE	On-Demand	Anodyne	KLK3	56	35
NC(=O)N[C@H](CC(=O)OCc1ccc(C(=O)O)cc1)c1ccccc1	ZINC000819116922	EE	On-Demand	Anodyne	KLK3	56	35
NC(=O)CCOc1ccc(NC(=O)C(=O)N2CCC(C(=O)O)CC2)cc1	ZINC000819116925	FC	On-Demand	Anodyne	LTA4H	34	42
NC(=O)CNc1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819116927	ED	On-Demand	Anodyne	ACR	59	37
NC(=O)C1CCN(c2ncccc2CNC(=O)NCCC(=O)O)CC1	ZINC000819116930	EC	On-Demand	Anodyne	SCN10A	16	41
NC(=O)C1CCN(c2ncccc2CNC(=O)NCCC(=O)O)CC1	ZINC000819116930	EC	On-Demand	Anodyne	SIRT3	48	32
NC(=O)C1CCN(c2ncccc2CNC(=O)NCCC(=O)O)CC1	ZINC000819116930	EC	On-Demand	Anodyne	SIRT2	45	32
NC(=O)C1CCN(c2ncccc2CNC(=O)NCCC(=O)O)CC1	ZINC000819116930	EC	On-Demand	Anodyne	SIRT1	41	32
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	F2	96	47
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	PLG	58	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	PRSS1	27	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	ACE	100	45
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	OPRM1	51	47
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	OPRD1	37	43
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	GHRHR	51	37
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	P2RY12	125	39
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	MME	88	45
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	TACR1	21	43
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	TRHR	51	46
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	PGC	46	31
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	MC4R	93	39
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	CTRA_BOVIN	41	32
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	TRY2_BOVIN	104	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	TRY1_BOVIN	84	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	NTSR1	47	35
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	CTSL	31	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	CACNA1B	30	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	NPFFR2	79	39
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	CYP51A1	21	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	DPP4	15	44
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	PREP	48	50
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	MC3R	46	34
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	MC5R	53	34
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	REN	82	39
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	REN1	40	33
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	PLAT	20	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	CCKBR	31	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	CAPN1	48	43
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	CTSE	48	31
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	ACE2	65	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	DPP7	61	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	ST14	111	38
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	PROC	38	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	FPR1	21	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	POLG_WNV	45	29
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	QRFPR	40	33
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	BRCA1	60	33
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	NPFFR1	74	36
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	TMPRSS11D	59	36
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116931	EC	On-Demand	Anodyne	TMPRSS6	48	33
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	F2	96	47
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	PLG	58	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	PRSS1	27	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	ACE	100	45
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	OPRM1	51	47
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	OPRD1	37	43
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	GHRHR	51	37
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	P2RY12	125	39
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	MME	88	45
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	TACR1	21	43
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	TRHR	51	46
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	PGC	46	31
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	MC4R	93	39
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	CTRA_BOVIN	41	32
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	TRY2_BOVIN	104	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	TRY1_BOVIN	84	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	NTSR1	47	35
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	CTSL	31	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	CACNA1B	30	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	NPFFR2	79	39
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	CYP51A1	21	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	DPP4	15	44
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	PREP	48	50
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	MC3R	46	34
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	MC5R	53	34
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	REN	82	39
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	REN1	40	33
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	PLAT	20	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	CCKBR	31	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	CAPN1	48	43
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	CTSE	48	31
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	ACE2	65	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	DPP7	61	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	ST14	111	38
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	PROC	38	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	FPR1	21	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	POLG_WNV	45	29
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	QRFPR	40	33
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	BRCA1	60	33
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	NPFFR1	74	36
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	TMPRSS11D	59	36
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116932	EC	On-Demand	Anodyne	TMPRSS6	48	33
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	F2	96	47
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	PLG	58	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	PRSS1	27	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	ACE	100	45
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	OPRM1	51	47
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	OPRD1	37	43
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	GHRHR	51	37
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	P2RY12	125	39
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	MME	88	45
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	TACR1	21	43
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	TRHR	51	46
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	PGC	46	31
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	MC4R	93	39
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	CTRA_BOVIN	41	32
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	TRY2_BOVIN	104	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	TRY1_BOVIN	84	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	NTSR1	47	35
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	CTSL	31	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	CACNA1B	30	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	NPFFR2	79	39
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	CYP51A1	21	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	DPP4	15	44
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	PREP	48	50
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	MC3R	46	34
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	MC5R	53	34
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	REN	82	39
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	REN1	40	33
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	PLAT	20	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	CCKBR	31	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	CAPN1	48	43
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	CTSE	48	31
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	ACE2	65	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	DPP7	61	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	ST14	111	38
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	PROC	38	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	FPR1	21	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	POLG_WNV	45	29
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	QRFPR	40	33
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	BRCA1	60	33
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	NPFFR1	74	36
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	TMPRSS11D	59	36
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819116933	EC	On-Demand	Anodyne	TMPRSS6	48	33
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	F2	96	47
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	PLG	58	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	PRSS1	27	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	ACE	100	45
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	OPRM1	51	47
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	OPRD1	37	43
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	GHRHR	51	37
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	P2RY12	125	39
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	MME	88	45
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	TACR1	21	43
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	TRHR	51	46
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	PGC	46	31
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	MC4R	93	39
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	CTRA_BOVIN	41	32
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	TRY2_BOVIN	104	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	TRY1_BOVIN	84	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	NTSR1	47	35
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	CTSL	31	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	CACNA1B	30	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	NPFFR2	79	39
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	CYP51A1	21	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	DPP4	15	44
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	PREP	48	50
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	MC3R	46	34
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	MC5R	53	34
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	REN	82	39
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	REN1	40	33
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	PLAT	20	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	CCKBR	31	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	CAPN1	48	43
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	CTSE	48	31
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	ACE2	65	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	DPP7	61	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	ST14	111	38
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	PROC	38	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	FPR1	21	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	POLG_WNV	45	29
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	QRFPR	40	33
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	BRCA1	60	33
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	NPFFR1	74	36
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	TMPRSS11D	59	36
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819116934	EC	On-Demand	Anodyne	TMPRSS6	48	33
NC(=O)COc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819116939	CC	On-Demand	Anodyne	CA2	16	44
NC(=O)COc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819116939	CC	On-Demand	Anodyne	LTA4H	27	44
NC(=O)COc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819116939	CC	On-Demand	Anodyne	CA1	49	44
NC(=O)COc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819116939	CC	On-Demand	Anodyne	ACR	43	33
NC(=O)COc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819116939	CC	On-Demand	Anodyne	CA12	25	44
NC(=O)COc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819116939	CC	On-Demand	Anodyne	CA9	27	44
NC(=O)COc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819116939	CC	On-Demand	Anodyne	NCE103	20	44
NC(=O)COc1cccc(NC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819116941	ED	On-Demand	Anodyne	CCR3	37	53
NC(=O)COc1cccc(NC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819116941	ED	On-Demand	Anodyne	EPHX2	27	44
NC(=O)COc1cccc(NC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819116942	ED	On-Demand	Anodyne	CCR3	37	53
NC(=O)COc1cccc(NC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819116942	ED	On-Demand	Anodyne	EPHX2	27	44
NC(=O)COc1cccc(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819116943	ED	On-Demand	Anodyne	SRD5A2	17	55
NC(=O)COc1cccc(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819116943	ED	On-Demand	Anodyne	UL80	24	40
NC(=O)COc1cccc(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819116943	ED	On-Demand	Anodyne	PLA2G4B	61	43
NC(=O)COc1cccc(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819116943	ED	On-Demand	Anodyne	ACR	48	50
NC(=O)CNC(=O)c1ccc(CNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819116946	GC	On-Demand	Anodyne	CA2	15	43
NC(=O)CNC(=O)c1ccc(CNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819116946	GC	On-Demand	Anodyne	HDAC1	39	50
NC(=O)CNC(=O)c1ccc(CNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819116946	GC	On-Demand	Anodyne	HDAC2	29	45
NC(=O)CNC(=O)c1ccc(CNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819116946	GC	On-Demand	Anodyne	FURIN	47	36
NC(=O)CNC(=O)c1ccc(CNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819116946	GC	On-Demand	Anodyne	TPSAB1	15	43
NC(=O)CNC(=O)c1ccc(CNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819116946	GC	On-Demand	Anodyne	PROC	55	37
NC(=O)N1CCC[C@H]1C(=O)N1CCO[C@@H](C(=O)O)C1	ZINC000819116947	CA	On-Demand	Anodyne	PREP	46	40
NC(=O)N1CCC[C@H]1C(=O)N1CCO[C@H](C(=O)O)C1	ZINC000819116948	CA	On-Demand	Anodyne	PREP	46	40
NC(=O)CNS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2C(=O)O)o1	ZINC000819116949	EA	On-Demand	Anodyne	ACE	48	38
NC(=O)CNS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2C(=O)O)o1	ZINC000819116949	EA	On-Demand	Anodyne	LGMN	57	34
NC(=O)CNS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2C(=O)O)o1	ZINC000819116949	EA	On-Demand	Anodyne	TMPRSS11D	55	33
NC(=O)CNS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2C(=O)O)o1	ZINC000819116950	EA	On-Demand	Anodyne	ACE	48	38
NC(=O)CNS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2C(=O)O)o1	ZINC000819116950	EA	On-Demand	Anodyne	LGMN	57	34
NC(=O)CNS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2C(=O)O)o1	ZINC000819116950	EA	On-Demand	Anodyne	TMPRSS11D	55	33
NC(=O)COc1cccc(CNC(=O)Nc2cccc(CC(=O)O)c2)c1	ZINC000819116952	FD	On-Demand	Anodyne	HRH2	28	41
NC(=O)COc1cccc(CNC(=O)Nc2cccc(CC(=O)O)c2)c1	ZINC000819116952	FD	On-Demand	Anodyne	ROCK1	15	42
NC(=O)COc1cccc(CNC(=O)Nc2cccc(CC(=O)O)c2)c1	ZINC000819116952	FD	On-Demand	Anodyne	ROCK2	35	47
NC(=O)COc1cccc(CNC(=O)Nc2cccc(CC(=O)O)c2)c1	ZINC000819116952	FD	On-Demand	Anodyne	PLA2G4B	19	43
NC(=O)COc1cccc(CNC(=O)Nc2cccc(CC(=O)O)c2)c1	ZINC000819116952	FD	On-Demand	Anodyne	NAMPT	26	41
NC(=O)COc1cccc(CNC(=O)Nc2cccc(CC(=O)O)c2)c1	ZINC000819116952	FD	On-Demand	Anodyne	PDS	52	36
NC(=O)COc1cccc(NC(=O)NC2(C(=O)O)CCCC2)c1	ZINC000819116953	DD	On-Demand	Anodyne	EPHX2	34	45
NC(=O)N1CCC[C@H]1C(=O)N1CCC(C(=O)O)CC1	ZINC000819116954	CB	On-Demand	Anodyne	PREP	71	53
NC(=O)N1CCC[C@H]1C(=O)N1CCC(C(=O)O)CC1	ZINC000819116954	CB	On-Demand	Anodyne	WNT3	43	34
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	F2	74	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	PLG	57	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	PRSS1	22	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	ACE	119	46
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	SLC6A1	61	34
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	OPRM1	53	54
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	OPRD1	43	45
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	GHRHR	58	34
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	P2RY12	115	35
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	MME	109	46
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	TACR1	23	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	TRHR	26	45
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	MC4R	102	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	FCER2	51	33
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	TRY2_BOVIN	109	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	TRY1_BOVIN	56	39
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	CYSP_TRYCR	46	38
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	CACNA1B	34	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	CCR1	28	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	NPFFR2	76	36
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	CYP51A1	24	47
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	TIMP3	48	33
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	PREP	25	51
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	NAALAD2	23	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	MC3R	50	36
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	MC5R	58	36
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	CAPNS1	63	32
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	MMP3	15	46
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	HLA-DRB1	45	33
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	REN	41	36
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	CAPN1	59	54
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	ACE2	74	38
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	DPP7	63	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	ST14	120	44
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	FPR1	27	44
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	AMP1_PLAFQ	27	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	CALCRL	29	46
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	BLA1_STEMA	68	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	BRCA1	44	31
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	NPFFR1	76	36
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116955	DC	On-Demand	Anodyne	TMPRSS6	50	35
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	F2	74	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	PLG	57	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	PRSS1	22	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	ACE	119	46
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	SLC6A1	61	34
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	OPRM1	53	54
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	OPRD1	43	45
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	GHRHR	58	34
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	P2RY12	115	35
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	MME	109	46
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	TACR1	23	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	TRHR	26	45
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	MC4R	102	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	FCER2	51	33
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	TRY2_BOVIN	109	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	TRY1_BOVIN	56	39
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	CYSP_TRYCR	46	38
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	CACNA1B	34	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	CCR1	28	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	NPFFR2	76	36
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	CYP51A1	24	47
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	TIMP3	48	33
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	PREP	25	51
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	NAALAD2	23	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	MC3R	50	36
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	MC5R	58	36
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	CAPNS1	63	32
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	MMP3	15	46
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	HLA-DRB1	45	33
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	REN	41	36
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	CAPN1	59	54
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	ACE2	74	38
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	DPP7	63	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	ST14	120	44
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	FPR1	27	44
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	AMP1_PLAFQ	27	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	CALCRL	29	46
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	BLA1_STEMA	68	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	BRCA1	44	31
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	NPFFR1	76	36
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116956	DC	On-Demand	Anodyne	TMPRSS6	50	35
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	F2	74	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	PLG	57	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	PRSS1	22	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	ACE	119	46
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	SLC6A1	61	34
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	OPRM1	53	54
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	OPRD1	43	45
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	GHRHR	58	34
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	P2RY12	115	35
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	MME	109	46
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	TACR1	23	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	TRHR	26	45
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	MC4R	102	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	FCER2	51	33
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	TRY2_BOVIN	109	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	TRY1_BOVIN	56	39
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	CYSP_TRYCR	46	38
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	CACNA1B	34	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	CCR1	28	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	NPFFR2	76	36
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	CYP51A1	24	47
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	TIMP3	48	33
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	PREP	25	51
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	NAALAD2	23	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	MC3R	50	36
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	MC5R	58	36
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	CAPNS1	63	32
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	MMP3	15	46
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	HLA-DRB1	45	33
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	REN	41	36
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	CAPN1	59	54
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	ACE2	74	38
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	DPP7	63	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	ST14	120	44
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	FPR1	27	44
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	AMP1_PLAFQ	27	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	CALCRL	29	46
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	BLA1_STEMA	68	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	BRCA1	44	31
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	NPFFR1	76	36
NC(=O)N[C@@H](Cc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819116957	DC	On-Demand	Anodyne	TMPRSS6	50	35
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	F2	74	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	PLG	57	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	PRSS1	22	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	ACE	119	46
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	SLC6A1	61	34
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	OPRM1	53	54
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	OPRD1	43	45
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	GHRHR	58	34
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	P2RY12	115	35
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	MME	109	46
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	TACR1	23	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	TRHR	26	45
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	MC4R	102	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	FCER2	51	33
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	TRY2_BOVIN	109	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	TRY1_BOVIN	56	39
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	CYSP_TRYCR	46	38
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	CACNA1B	34	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	CCR1	28	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	NPFFR2	76	36
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	CYP51A1	24	47
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	TIMP3	48	33
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	PREP	25	51
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	NAALAD2	23	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	MC3R	50	36
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	MC5R	58	36
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	CAPNS1	63	32
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	MMP3	15	46
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	HLA-DRB1	45	33
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	REN	41	36
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	CAPN1	59	54
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	ACE2	74	38
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	DPP7	63	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	ST14	120	44
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	FPR1	27	44
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	AMP1_PLAFQ	27	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	CALCRL	29	46
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	BLA1_STEMA	68	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	BRCA1	44	31
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	NPFFR1	76	36
NC(=O)N[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819116958	DC	On-Demand	Anodyne	TMPRSS6	50	35
NC(=O)CS(=O)(=O)c1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819116959	EB	On-Demand	Anodyne	L3MBTL3	76	42
NC(=O)CS(=O)(=O)c1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819116960	EB	On-Demand	Anodyne	L3MBTL3	76	42
NC(=O)NC(=O)CCCN1CCC[C@H](CC(=O)O)C1	ZINC000819116963	CC	On-Demand	Anodyne	SLC6A1	58	34
NC(=O)NC(=O)CCCN1CCC[C@@H](CC(=O)O)C1	ZINC000819116964	CC	On-Demand	Anodyne	SLC6A1	58	34
NC(=O)CCOc1ccc(NC(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819116965	ED	On-Demand	Anodyne	PDGFRB	46	39
NC(=O)CCOc1ccc(NC(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819116965	ED	On-Demand	Anodyne	LTA4H	39	41
NC(=O)CCOc1ccc(NC(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819116965	ED	On-Demand	Anodyne	EPHX2	24	52
NC(=O)CCOc1ccc(NC(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819116966	ED	On-Demand	Anodyne	PDGFRB	46	39
NC(=O)CCOc1ccc(NC(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819116966	ED	On-Demand	Anodyne	LTA4H	39	41
NC(=O)CCOc1ccc(NC(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819116966	ED	On-Demand	Anodyne	EPHX2	24	52
NC(=O)CCOc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819116967	DC	On-Demand	Anodyne	PDGFRB	46	39
NC(=O)CCOc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819116967	DC	On-Demand	Anodyne	LTA4H	43	41
NC(=O)CCOc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819116967	DC	On-Demand	Anodyne	HRH3	21	42
NC(=O)CCOc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819116967	DC	On-Demand	Anodyne	EPHX2	36	42
NC(=O)CCOc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819116968	DC	On-Demand	Anodyne	PDGFRB	46	39
NC(=O)CCOc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819116968	DC	On-Demand	Anodyne	LTA4H	43	41
NC(=O)CCOc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819116968	DC	On-Demand	Anodyne	HRH3	21	42
NC(=O)CCOc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819116968	DC	On-Demand	Anodyne	EPHX2	36	42
NC(=O)COc1ccc(NC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819116973	ED	On-Demand	Anodyne	LTA4H	47	41
NC(=O)COc1ccc(NC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819116973	ED	On-Demand	Anodyne	CA1	41	39
NC(=O)COc1ccc(NC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819116973	ED	On-Demand	Anodyne	UL80	24	42
NC(=O)COc1ccc(NC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819116973	ED	On-Demand	Anodyne	ROCK2	19	44
NC(=O)COc1ccc(NC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819116973	ED	On-Demand	Anodyne	PLA2G4B	60	38
NC(=O)COc1ccc(NC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819116973	ED	On-Demand	Anodyne	EPHX2	28	46
NC(=O)COc1ccc(NC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819116973	ED	On-Demand	Anodyne	F7	29	42
NC(=O)COc1ccc(NC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819116973	ED	On-Demand	Anodyne	ACR	61	37
NC(=O)COc1ccc(NC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819116973	ED	On-Demand	Anodyne	CA12	21	49
NC(=O)COc1ccc(NC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819116973	ED	On-Demand	Anodyne	TPSAB1	17	43
NC(=O)COc1ccc(NC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819116973	ED	On-Demand	Anodyne	CA9	24	49
NC(=O)COc1ccc(NC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819116973	ED	On-Demand	Anodyne	NCE103	20	51
NC(=O)COc1ccc(NC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819116973	ED	On-Demand	Anodyne	NAMPT	35	44
NC(=O)CCCNC(=O)C(=O)Nc1ccccc1CC(=O)O	ZINC000819116976	DB	On-Demand	Anodyne	CXCL8	35	41
NC(=O)C[C@H]1CCCN(C(=O)C(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819116978	EC	On-Demand	Anodyne	CCR3	32	42
NC(=O)C[C@@H]1CCCN(C(=O)C(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819116979	EC	On-Demand	Anodyne	CCR3	32	42
NC(=O)COc1cccc(NC(=O)NCC(=O)O)c1	ZINC000819116982	CB	On-Demand	Anodyne	CA1	27	41
NC(=O)COc1cccc(NC(=O)NCC(=O)O)c1	ZINC000819116982	CB	On-Demand	Anodyne	EPHX2	26	44
NC(=O)COc1cccc(NC(=O)NCC(=O)O)c1	ZINC000819116982	CB	On-Demand	Anodyne	F7	19	42
NC(=O)COc1cccc(NC(=O)NCC(=O)O)c1	ZINC000819116982	CB	On-Demand	Anodyne	F13A1	21	41
NC(=O)COc1cccc(NC(=O)NCC(=O)O)c1	ZINC000819116982	CB	On-Demand	Anodyne	PDS	41	33
NC(=O)CCOc1ccc(NC(=O)NC2(C(=O)O)CCCC2)cc1	ZINC000819116983	ED	On-Demand	Anodyne	EPHX2	32	41
NC(=O)Cn1cc(C(=O)Nc2ccccc2CC(=O)O)nn1	ZINC000819116984	DB	On-Demand	Anodyne	CXCL8	29	40
NC(=O)CCOc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819116985	CC	On-Demand	Anodyne	CA2	17	44
NC(=O)CCOc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819116985	CC	On-Demand	Anodyne	LTA4H	37	42
NC(=O)CCOc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819116985	CC	On-Demand	Anodyne	CA1	48	40
NC(=O)CCOc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819116985	CC	On-Demand	Anodyne	FAAH	21	40
NC(=O)CCOc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819116985	CC	On-Demand	Anodyne	EPHX2	15	47
NC(=O)CCOc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819116985	CC	On-Demand	Anodyne	F7	26	44
NC(=O)CCOc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819116985	CC	On-Demand	Anodyne	ACR	43	33
NC(=O)CCOc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819116985	CC	On-Demand	Anodyne	CA12	26	44
NC(=O)CCOc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819116985	CC	On-Demand	Anodyne	CA9	28	44
NC(=O)CCOc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819116985	CC	On-Demand	Anodyne	NCE103	20	44
NC(=O)Cn1cc(C(=O)Nc2cccc(CC(=O)O)c2)nn1	ZINC000819116989	DB	On-Demand	Anodyne	KCNK3	42	36
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	F2	38	47
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	PLG	27	46
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	CA2	20	47
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	KLKB1	26	46
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	PRSS1	17	44
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	ACE	47	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	OPRM1	68	48
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	OPRD1	62	44
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	F10	16	46
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	MME	144	52
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	ANPEP	84	37
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	TACR1	24	48
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	CTSD	17	47
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	MC4R	41	38
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	FCER2	108	48
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	GRB2	43	35
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	NPY1R	30	45
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	CTSB	64	44
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	TRY2_BOVIN	44	34
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	PAPA1_CARPA	84	48
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	CYSP_TRYCR	66	38
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	CTSK	23	48
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	CTSL	73	48
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	CPA1	43	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	CACNA1B	49	34
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	F2R	43	35
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	NPFFR2	66	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	TIMP3	82	47
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	TACR3	22	48
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	MC3R	46	35
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	CAPNS1	66	37
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	MMP2	19	43
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	MMP3	27	52
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	MMP8	25	48
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	GRIA1	65	45
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	ECE1	30	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	HLA-DRB1	61	37
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	REN	23	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	F11	38	44
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	PCSK5	49	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	FURIN	83	54
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	CTSS	31	48
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	CAPN1	88	47
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	MMP9	29	48
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	CAPN2	74	43
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	ACE2	67	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	MC1R	69	38
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	PLAU	18	44
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	F7	41	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	CTSV	54	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	TPSAB1	17	40
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	PROC	83	58
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	MMP1	37	55
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	FPR1	74	53
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	CTRB_BOVIN	56	35
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	NPR	50	37
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	AMP1_PLAFQ	62	48
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	PSMB5	47	41
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	BLA1_STEMA	71	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	KISS1R	73	38
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	POLG_WNV	58	36
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	QRFPR	51	36
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	NPFFR1	80	42
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	TMPRSS11D	103	48
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	GPR142	56	35
NC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116990	ED	On-Demand	Anodyne	PDS	40	32
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	F2	38	47
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	PLG	27	46
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	CA2	20	47
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	KLKB1	26	46
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	PRSS1	17	44
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	ACE	47	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	OPRM1	68	48
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	OPRD1	62	44
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	F10	16	46
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	MME	144	52
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	ANPEP	84	37
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	TACR1	24	48
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	CTSD	17	47
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	MC4R	41	38
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	FCER2	108	48
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	GRB2	43	35
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	NPY1R	30	45
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	CTSB	64	44
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	TRY2_BOVIN	44	34
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	PAPA1_CARPA	84	48
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	CYSP_TRYCR	66	38
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	CTSK	23	48
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	CTSL	73	48
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	CPA1	43	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	CACNA1B	49	34
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	F2R	43	35
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	NPFFR2	66	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	TIMP3	82	47
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	TACR3	22	48
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	MC3R	46	35
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	CAPNS1	66	37
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	MMP2	19	43
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	MMP3	27	52
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	MMP8	25	48
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	GRIA1	65	45
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	ECE1	30	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	HLA-DRB1	61	37
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	REN	23	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	F11	38	44
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	PCSK5	49	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	FURIN	83	54
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	CTSS	31	48
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	CAPN1	88	47
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	MMP9	29	48
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	CAPN2	74	43
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	ACE2	67	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	MC1R	69	38
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	PLAU	18	44
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	F7	41	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	CTSV	54	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	TPSAB1	17	40
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	PROC	83	58
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	MMP1	37	55
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	FPR1	74	53
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	CTRB_BOVIN	56	35
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	NPR	50	37
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	AMP1_PLAFQ	62	48
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	PSMB5	47	41
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	BLA1_STEMA	71	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	KISS1R	73	38
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	POLG_WNV	58	36
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	QRFPR	51	36
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	NPFFR1	80	42
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	TMPRSS11D	103	48
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	GPR142	56	35
NC(=O)N[C@H](Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819116991	ED	On-Demand	Anodyne	PDS	40	32
NC(=O)Cn1cc(C(=O)N2CCC[C@@H]2C(=O)O)nn1	ZINC000819116992	CA	On-Demand	Anodyne	ACE	49	39
NC(=O)Cn1cc(C(=O)N2CCC[C@@H]2C(=O)O)nn1	ZINC000819116992	CA	On-Demand	Anodyne	PREP	42	35
NC(=O)Cn1cc(C(=O)N2CCC[C@H]2C(=O)O)nn1	ZINC000819116993	CA	On-Demand	Anodyne	ACE	49	39
NC(=O)Cn1cc(C(=O)N2CCC[C@H]2C(=O)O)nn1	ZINC000819116993	CA	On-Demand	Anodyne	PREP	42	35
NC(=O)CCNC(=O)c1cccc(NC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819116994	GD	On-Demand	Anodyne	CCR3	36	43
NC(=O)CCNC(=O)c1cccc(NC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819116995	GD	On-Demand	Anodyne	CCR3	36	43
NC(=O)COc1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819117004	FD	On-Demand	Anodyne	HRH2	26	47
NC(=O)COc1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819117004	FD	On-Demand	Anodyne	MMP13	21	56
NC(=O)COc1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819117004	FD	On-Demand	Anodyne	UL80	28	43
NC(=O)COc1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819117004	FD	On-Demand	Anodyne	PLA2G4B	58	38
NC(=O)COc1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819117004	FD	On-Demand	Anodyne	FURIN	50	34
NC(=O)COc1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819117004	FD	On-Demand	Anodyne	PDS	72	43
NC(=O)COc1ccc(NC(=O)NC2(C(=O)O)CCCC2)cc1	ZINC000819117011	DD	On-Demand	Anodyne	EPHX2	32	45
NC(=O)CCOc1ccccc1NC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819117016	FD	On-Demand	Anodyne	HDAC1	29	53
NC(=O)CCOc1ccccc1NC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819117016	FD	On-Demand	Anodyne	FURIN	41	36
NC(=O)CNC(=S)Nc1ccccc1CC(=O)O	ZINC000819117017	CC	On-Demand	Anodyne	CXCL8	36	43
NC(=O)COc1cccc(CNC(=O)NCCC(=O)O)c1	ZINC000819117018	CB	On-Demand	Anodyne	HRH2	27	47
NC(=O)COc1cccc(CNC(=O)NCCC(=O)O)c1	ZINC000819117018	CB	On-Demand	Anodyne	FFAR1	37	43
NC(=O)COc1cccc(CNC(=O)NCCC(=O)O)c1	ZINC000819117018	CB	On-Demand	Anodyne	PDS	61	38
NC(=O)CCn1c(-c2cccs2)nn(CN2CC[C@H](C(=O)O)C2)c1=S	ZINC000819117021	GD	On-Demand	Anodyne	SLC6A1	89	39
NC(=O)CCn1c(-c2cccs2)nn(CN2CC[C@@H](C(=O)O)C2)c1=S	ZINC000819117022	GD	On-Demand	Anodyne	SLC6A1	89	39
NC(=O)CCN(C(=O)CN1CC[C@@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819117024	EC	On-Demand	Anodyne	SLC6A1	100	39
NC(=O)CCN(C(=O)CN1CC[C@@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819117024	EC	On-Demand	Anodyne	WNT3A	47	35
NC(=O)CCN(C(=O)CN1CC[C@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819117025	EC	On-Demand	Anodyne	SLC6A1	100	39
NC(=O)CCN(C(=O)CN1CC[C@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819117025	EC	On-Demand	Anodyne	WNT3A	47	35
NC(=O)Cn1cc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cn1	ZINC000819117028	EB	On-Demand	Anodyne	PANC	55	42
NC(=O)CS(=O)(=O)c1ccc(C(=O)NCC(=O)O)cc1	ZINC000819117029	DA	On-Demand	Anodyne	CA2	44	68
NC(=O)CS(=O)(=O)c1ccc(C(=O)NCC(=O)O)cc1	ZINC000819117029	DA	On-Demand	Anodyne	CA1	25	68
NC(=O)CS(=O)(=O)c1ccc(C(=O)NCC(=O)O)cc1	ZINC000819117029	DA	On-Demand	Anodyne	CA4	31	68
NC(=O)CS(=O)(=O)c1ccc(C(=O)NCC(=O)O)cc1	ZINC000819117029	DA	On-Demand	Anodyne	CA14	15	43
NC(=O)CCOc1ccccc1NC(=O)N1CC[C@H](C(=O)O)C1	ZINC000819117031	DC	On-Demand	Anodyne	SLC6A1	61	34
NC(=O)CCOc1ccccc1NC(=O)N1CC[C@H](C(=O)O)C1	ZINC000819117031	DC	On-Demand	Anodyne	RBP4	60	37
NC(=O)CCOc1ccccc1NC(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819117032	DC	On-Demand	Anodyne	SLC6A1	61	34
NC(=O)CCOc1ccccc1NC(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819117032	DC	On-Demand	Anodyne	RBP4	60	37
NC(=O)COc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819117033	CB	On-Demand	Anodyne	CA2	18	41
NC(=O)COc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819117033	CB	On-Demand	Anodyne	LTA4H	20	41
NC(=O)COc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819117033	CB	On-Demand	Anodyne	CA1	50	41
NC(=O)COc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819117033	CB	On-Demand	Anodyne	EPHX2	15	42
NC(=O)COc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819117033	CB	On-Demand	Anodyne	F7	25	41
NC(=O)COc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819117033	CB	On-Demand	Anodyne	ACR	50	36
NC(=O)COc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819117033	CB	On-Demand	Anodyne	CA12	28	41
NC(=O)COc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819117033	CB	On-Demand	Anodyne	CA9	28	41
NC(=O)COc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819117033	CB	On-Demand	Anodyne	NCE103	26	42
NC(=O)COc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819117033	CB	On-Demand	Anodyne	MTCA1	24	40
NC(=O)COc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819117033	CB	On-Demand	Anodyne	P96878_MYCTU	23	40
NC(=O)N1CCC[C@H]1C(=O)NCCCC(=O)O	ZINC000819117034	BB	On-Demand	Anodyne	F2	51	46
NC(=O)N1CCC[C@H]1C(=O)NCCCC(=O)O	ZINC000819117034	BB	On-Demand	Anodyne	ACE	16	40
NC(=O)N1CCC[C@H]1C(=O)NCCCC(=O)O	ZINC000819117034	BB	On-Demand	Anodyne	FKBP1A	17	46
NC(=O)N1CCC[C@H]1C(=O)NCCCC(=O)O	ZINC000819117034	BB	On-Demand	Anodyne	HLA-DRB3	40	31
NC(=O)N1CCC[C@H]1C(=O)NCCCC(=O)O	ZINC000819117034	BB	On-Demand	Anodyne	TRY1_BOVIN	54	37
NC(=O)N1CCC[C@H]1C(=O)NCCCC(=O)O	ZINC000819117034	BB	On-Demand	Anodyne	NTSR1	46	33
NC(=O)N1CCC[C@H]1C(=O)NCCCC(=O)O	ZINC000819117034	BB	On-Demand	Anodyne	NTSR2	43	32
NC(=O)N1CCC[C@H]1C(=O)NCCCC(=O)O	ZINC000819117034	BB	On-Demand	Anodyne	SLC5A1	20	40
NC(=O)N1CCC[C@H]1C(=O)NCCCC(=O)O	ZINC000819117034	BB	On-Demand	Anodyne	TPP2	42	51
NC(=O)N1CCC[C@H]1C(=O)NCCCC(=O)O	ZINC000819117034	BB	On-Demand	Anodyne	TMPRSS11D	54	35
NC(=O)CCNC(=O)c1cccc(NC(=O)NCC(=O)O)c1	ZINC000819117035	DB	On-Demand	Anodyne	PRMT3	40	40
NC(=O)CCNC(=O)c1cccc(NC(=O)NCC(=O)O)c1	ZINC000819117035	DB	On-Demand	Anodyne	KCNK3	91	37
NC(=O)CCNC(=O)c1cccc(NC(=O)NCC(=O)O)c1	ZINC000819117035	DB	On-Demand	Anodyne	KCNK9	42	37
NC(=O)COc1ccc(NC(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819117036	ED	On-Demand	Anodyne	PDGFRB	44	40
NC(=O)COc1ccc(NC(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819117037	ED	On-Demand	Anodyne	PDGFRB	44	40
NC(=O)COc1cccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819117038	EB	On-Demand	Anodyne	CPT1A	41	40
NC(=O)COc1cccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819117038	EB	On-Demand	Anodyne	EPHX2	25	42
NC(=O)COc1cccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819117039	EB	On-Demand	Anodyne	CPT1A	41	40
NC(=O)COc1cccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819117039	EB	On-Demand	Anodyne	EPHX2	25	42
NC(=O)C1CCN(c2ccccc2NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)CC1	ZINC000819117040	GC	On-Demand	Anodyne	KCNQ2	75	43
NC(=O)C1CCN(c2ccccc2NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)CC1	ZINC000819117041	GC	On-Demand	Anodyne	KCNQ2	75	43
NC(=O)COc1cccc(CNC(=O)N2CCC(C(=O)O)CC2)c1	ZINC000819117042	EC	On-Demand	Anodyne	HRH2	29	40
NC(=O)COc1cccc(CNC(=O)N2CCC(C(=O)O)CC2)c1	ZINC000819117042	EC	On-Demand	Anodyne	GRIN2B	19	40
NC(=O)COc1cccc(CNC(=O)N2CCC(C(=O)O)CC2)c1	ZINC000819117042	EC	On-Demand	Anodyne	CPT1A	47	38
NC(=O)COc1cccc(CNC(=O)N2CCC(C(=O)O)CC2)c1	ZINC000819117042	EC	On-Demand	Anodyne	EPHX2	25	47
NC(=O)COc1cccc(CNC(=O)N2CCC(C(=O)O)CC2)c1	ZINC000819117042	EC	On-Demand	Anodyne	PDS	46	35
NC(=O)COc1ccc(CNCc2ccc(C(=O)O)cc2)cc1	ZINC000819117047	DD	On-Demand	Anodyne	SRD5A2	17	44
NC(=O)COc1ccc(CNCc2ccc(C(=O)O)cc2)cc1	ZINC000819117047	DD	On-Demand	Anodyne	LTA4H	45	43
NC(=O)COc1ccc(CNCc2ccc(C(=O)O)cc2)cc1	ZINC000819117047	DD	On-Demand	Anodyne	UL80	15	42
NC(=O)COc1ccc(CNCc2ccc(C(=O)O)cc2)cc1	ZINC000819117047	DD	On-Demand	Anodyne	PLA2G4A	32	43
NC(=O)COc1ccc(CNCc2ccc(C(=O)O)cc2)cc1	ZINC000819117047	DD	On-Demand	Anodyne	PLA2G4B	68	44
NC(=O)COc1ccc(CNc2cccc(CC(=O)O)c2)cc1	ZINC000819117050	DD	On-Demand	Anodyne	UL80	16	44
NC(=O)COc1ccc(CNc2cccc(CC(=O)O)c2)cc1	ZINC000819117050	DD	On-Demand	Anodyne	PLA2G4B	38	45
NC(=O)COc1ccc(CNc2cccc(CC(=O)O)c2)cc1	ZINC000819117050	DD	On-Demand	Anodyne	NR1H3	19	43
NC(=O)COc1ccc(CNc2cccc(CC(=O)O)c2)cc1	ZINC000819117050	DD	On-Demand	Anodyne	NR1H2	27	43
NC(=O)COc1ccc(CNc2cccc(CC(=O)O)c2)cc1	ZINC000819117050	DD	On-Demand	Anodyne	FFAR1	48	42
NC(=O)COc1ccc(CNc2cccc(CC(=O)O)c2)cc1	ZINC000819117050	DD	On-Demand	Anodyne	DRTS_TRYCR	44	32
NC(=O)CS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819117056	EB	On-Demand	Anodyne	ACE	53	41
NC(=O)CS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819117056	EB	On-Demand	Anodyne	PREP	56	48
NC(=O)CS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819117056	EB	On-Demand	Anodyne	SFRP1	45	38
NC(=O)CS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819117056	EB	On-Demand	Anodyne	WNT3	45	38
NC(=O)CS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2C(=O)O)cc1	ZINC000819117056	EB	On-Demand	Anodyne	TMPRSS11D	56	33
NC(=O)CS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819117057	EB	On-Demand	Anodyne	ACE	53	41
NC(=O)CS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819117057	EB	On-Demand	Anodyne	PREP	56	48
NC(=O)CS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819117057	EB	On-Demand	Anodyne	SFRP1	45	38
NC(=O)CS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819117057	EB	On-Demand	Anodyne	WNT3	45	38
NC(=O)CS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819117057	EB	On-Demand	Anodyne	TMPRSS11D	56	33
NC(=O)Cc1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819117058	FC	On-Demand	Anodyne	F3	44	33
NC(=O)Cc1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819117058	FC	On-Demand	Anodyne	FURIN	41	33
NC(=O)Cc1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819117058	FC	On-Demand	Anodyne	TPSAB1	17	45
NC(=O)[C@H]1CN(C(=O)NCc2ccc(C(=O)O)cc2)CCO1	ZINC000819117063	DB	On-Demand	Anodyne	TPSAB1	16	47
NC(=O)[C@H]1CN(C(=O)NCc2ccc(C(=O)O)cc2)CCO1	ZINC000819117063	DB	On-Demand	Anodyne	PROC	48	32
NC(=O)[C@H]1CN(C(=O)NCc2ccc(C(=O)O)cc2)CCO1	ZINC000819117063	DB	On-Demand	Anodyne	TMPRSS11D	40	33
NC(=O)[C@@H]1CN(C(=O)NCc2ccc(C(=O)O)cc2)CCO1	ZINC000819117064	DB	On-Demand	Anodyne	TPSAB1	16	47
NC(=O)[C@@H]1CN(C(=O)NCc2ccc(C(=O)O)cc2)CCO1	ZINC000819117064	DB	On-Demand	Anodyne	PROC	48	32
NC(=O)[C@@H]1CN(C(=O)NCc2ccc(C(=O)O)cc2)CCO1	ZINC000819117064	DB	On-Demand	Anodyne	TMPRSS11D	40	33
NC(=O)[C@H]1CN(C(=O)Nc2ccccc2CC(=O)O)CCO1	ZINC000819117071	DC	On-Demand	Anodyne	RBP4	46	35
NC(=O)[C@@H]1CN(C(=O)Nc2ccccc2CC(=O)O)CCO1	ZINC000819117072	DC	On-Demand	Anodyne	RBP4	46	35
NC(=O)NC(=O)CCCN1CC[C@@H](C(=O)O)C1	ZINC000819117073	BB	On-Demand	Anodyne	SLC6A1	135	40
NC(=O)NC(=O)CCCN1CC[C@H](C(=O)O)C1	ZINC000819117074	BB	On-Demand	Anodyne	SLC6A1	135	40
NC(=O)COc1ccc(CNC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819117078	EB	On-Demand	Anodyne	LTA4H	30	45
NC(=O)COc1ccc(CNC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819117079	EB	On-Demand	Anodyne	LTA4H	30	45
NC(=O)CCN(Cc1ccccc1)C(=O)NCCC(=O)O	ZINC000819117080	CC	On-Demand	Anodyne	MME	18	41
NC(=O)CCN(Cc1ccccc1)C(=O)NCCC(=O)O	ZINC000819117080	CC	On-Demand	Anodyne	PTGES	15	43
NC(=O)CSc1ccccc1NC(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819117081	DD	On-Demand	Anodyne	SLC6A1	63	35
NC(=O)CSc1ccccc1NC(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819117081	DD	On-Demand	Anodyne	KCNQ2	56	35
NC(=O)CSc1ccccc1NC(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819117081	DD	On-Demand	Anodyne	RBP4	45	37
NC(=O)CSc1ccccc1NC(=O)N1CC[C@H](C(=O)O)C1	ZINC000819117082	DD	On-Demand	Anodyne	SLC6A1	63	35
NC(=O)CSc1ccccc1NC(=O)N1CC[C@H](C(=O)O)C1	ZINC000819117082	DD	On-Demand	Anodyne	KCNQ2	56	35
NC(=O)CSc1ccccc1NC(=O)N1CC[C@H](C(=O)O)C1	ZINC000819117082	DD	On-Demand	Anodyne	RBP4	45	37
NC(=O)CS(=O)(=O)c1ccc(C(=O)NCCC(=O)O)cc1	ZINC000819117083	DB	On-Demand	Anodyne	CA2	40	69
NC(=O)CS(=O)(=O)c1ccc(C(=O)NCCC(=O)O)cc1	ZINC000819117083	DB	On-Demand	Anodyne	GCGR	69	35
NC(=O)CS(=O)(=O)c1ccc(C(=O)NCCC(=O)O)cc1	ZINC000819117083	DB	On-Demand	Anodyne	CA1	24	69
NC(=O)CS(=O)(=O)c1ccc(C(=O)NCCC(=O)O)cc1	ZINC000819117083	DB	On-Demand	Anodyne	CA4	27	69
NC(=O)CS(=O)(=O)c1ccc(C(=O)NCCC(=O)O)cc1	ZINC000819117083	DB	On-Demand	Anodyne	GIPR	61	35
NC(=O)CS(=O)(=O)c1ccc(C(=O)NCCC(=O)O)cc1	ZINC000819117083	DB	On-Demand	Anodyne	CYNT	24	41
NC(=O)COc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819117086	DC	On-Demand	Anodyne	CCR3	19	43
NC(=O)COc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819117086	DC	On-Demand	Anodyne	CPT1A	59	41
NC(=O)COc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819117086	DC	On-Demand	Anodyne	FAAH	17	40
NC(=O)COc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819117086	DC	On-Demand	Anodyne	EPHX2	37	44
NC(=O)COc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819117086	DC	On-Demand	Anodyne	LIMK2	42	41
NC(=O)COc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819117087	DC	On-Demand	Anodyne	CCR3	19	43
NC(=O)COc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819117087	DC	On-Demand	Anodyne	CPT1A	59	41
NC(=O)COc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819117087	DC	On-Demand	Anodyne	FAAH	17	40
NC(=O)COc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819117087	DC	On-Demand	Anodyne	EPHX2	37	44
NC(=O)COc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819117087	DC	On-Demand	Anodyne	LIMK2	42	41
NC(=O)CCn1c(-c2ccco2)nn(CN2CC[C@H](C(=O)O)C2)c1=S	ZINC000819117090	FC	On-Demand	Anodyne	SLC6A1	94	34
NC(=O)CCn1c(-c2ccco2)nn(CN2CC[C@@H](C(=O)O)C2)c1=S	ZINC000819117091	FC	On-Demand	Anodyne	SLC6A1	94	34
NC(=O)CCN(Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819117092	FD	On-Demand	Anodyne	FURIN	43	36
NC(=O)CCN(Cc1ccccc1)C(=O)NCc1ccc(C(=O)O)cc1	ZINC000819117092	FD	On-Demand	Anodyne	TMPRSS11D	67	33
NC(=O)CCOc1ccc(NC(=O)Nc2cccc(CC(=O)O)c2)cc1	ZINC000819117093	FE	On-Demand	Anodyne	CA2	15	45
NC(=O)CCOc1ccc(NC(=O)Nc2cccc(CC(=O)O)c2)cc1	ZINC000819117093	FE	On-Demand	Anodyne	TSHR	40	30
NC(=O)CCOc1ccc(NC(=O)Nc2cccc(CC(=O)O)c2)cc1	ZINC000819117093	FE	On-Demand	Anodyne	PPIA	37	40
NC(=O)CCOc1ccc(NC(=O)Nc2cccc(CC(=O)O)c2)cc1	ZINC000819117093	FE	On-Demand	Anodyne	LTA4H	42	42
NC(=O)CCOc1ccc(NC(=O)Nc2cccc(CC(=O)O)c2)cc1	ZINC000819117093	FE	On-Demand	Anodyne	CA1	49	45
NC(=O)CCOc1ccc(NC(=O)Nc2cccc(CC(=O)O)c2)cc1	ZINC000819117093	FE	On-Demand	Anodyne	PLA2G4B	46	42
NC(=O)CCOc1ccc(NC(=O)Nc2cccc(CC(=O)O)c2)cc1	ZINC000819117093	FE	On-Demand	Anodyne	EPHX2	24	43
NC(=O)CCOc1ccc(NC(=O)Nc2cccc(CC(=O)O)c2)cc1	ZINC000819117093	FE	On-Demand	Anodyne	CA12	27	45
NC(=O)CCOc1ccc(NC(=O)Nc2cccc(CC(=O)O)c2)cc1	ZINC000819117093	FE	On-Demand	Anodyne	CA9	28	45
NC(=O)CCOc1ccc(NC(=O)Nc2cccc(CC(=O)O)c2)cc1	ZINC000819117093	FE	On-Demand	Anodyne	NCE103	21	41
NC(=O)CCOc1ccc(NC(=O)Nc2cccc(CC(=O)O)c2)cc1	ZINC000819117093	FE	On-Demand	Anodyne	P96878_MYCTU	15	41
NC(=O)C[C@@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1cccc(Cl)c1	ZINC000819117099	GE	On-Demand	Anodyne	ADRB1	19	47
NC(=O)C[C@@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1cccc(Cl)c1	ZINC000819117099	GE	On-Demand	Anodyne	ADRB3	26	47
NC(=O)C[C@@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1cccc(Cl)c1	ZINC000819117099	GE	On-Demand	Anodyne	PTGER4	22	44
NC(=O)C[C@@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1cccc(Cl)c1	ZINC000819117099	GE	On-Demand	Anodyne	FURIN	41	35
NC(=O)C[C@@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1cccc(Cl)c1	ZINC000819117099	GE	On-Demand	Anodyne	PROC	43	34
NC(=O)C[C@@H](NC(=O)NCc1ccc(C(=O)O)cc1)c1cccc(Cl)c1	ZINC000819117099	GE	On-Demand	Anodyne	PDS	53	37
NC(=O)COc1cccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819117100	FC	On-Demand	Anodyne	UL80	29	43
NC(=O)COc1cccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819117100	FC	On-Demand	Anodyne	PLA2G4B	49	34
NC(=O)COc1cccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819117100	FC	On-Demand	Anodyne	PDS	57	38
NC(=O)CCOc1ccccc1NC(=O)N1CCC[C@H](CC(=O)O)C1	ZINC000819117103	ED	On-Demand	Anodyne	RBP4	44	33
NC(=O)CCOc1ccccc1NC(=O)N1CCC[C@@H](CC(=O)O)C1	ZINC000819117104	ED	On-Demand	Anodyne	RBP4	44	33
NC(=O)CSc1ccccc1NC(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819117105	EC	On-Demand	Anodyne	SLC6A1	106	38
NC(=O)CSc1ccccc1NC(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819117105	EC	On-Demand	Anodyne	KCNQ2	51	36
NC(=O)CSc1ccccc1NC(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819117106	EC	On-Demand	Anodyne	SLC6A1	106	38
NC(=O)CSc1ccccc1NC(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819117106	EC	On-Demand	Anodyne	KCNQ2	51	36
NC(=O)C[C@@H](NC(=O)Nc1cccc(CC(=O)O)c1)c1cccc(Cl)c1	ZINC000819117112	GF	On-Demand	Anodyne	ADRB1	17	41
NC(=O)C[C@@H](NC(=O)Nc1cccc(CC(=O)O)c1)c1cccc(Cl)c1	ZINC000819117112	GF	On-Demand	Anodyne	ADRB3	21	43
NC(=O)N1CCC[C@@H](C(=O)OCc2ccc(C(=O)O)cc2)C1	ZINC000819117113	DD	On-Demand	Anodyne	FKBP1A	52	42
NC(=O)N1CCC[C@@H](C(=O)OCc2ccc(C(=O)O)cc2)C1	ZINC000819117113	DD	On-Demand	Anodyne	SLC6A1	46	34
NC(=O)N1CCC[C@@H](C(=O)OCc2ccc(C(=O)O)cc2)C1	ZINC000819117113	DD	On-Demand	Anodyne	PREP	45	44
NC(=O)N1CCC[C@@H](C(=O)OCc2ccc(C(=O)O)cc2)C1	ZINC000819117113	DD	On-Demand	Anodyne	LGMN	43	32
NC(=O)N1CCC[C@@H](C(=O)OCc2ccc(C(=O)O)cc2)C1	ZINC000819117113	DD	On-Demand	Anodyne	DPP7	45	38
NC(=O)N1CCC[C@H](C(=O)OCc2ccc(C(=O)O)cc2)C1	ZINC000819117114	DD	On-Demand	Anodyne	FKBP1A	52	42
NC(=O)N1CCC[C@H](C(=O)OCc2ccc(C(=O)O)cc2)C1	ZINC000819117114	DD	On-Demand	Anodyne	SLC6A1	46	34
NC(=O)N1CCC[C@H](C(=O)OCc2ccc(C(=O)O)cc2)C1	ZINC000819117114	DD	On-Demand	Anodyne	PREP	45	44
NC(=O)N1CCC[C@H](C(=O)OCc2ccc(C(=O)O)cc2)C1	ZINC000819117114	DD	On-Demand	Anodyne	LGMN	43	32
NC(=O)N1CCC[C@H](C(=O)OCc2ccc(C(=O)O)cc2)C1	ZINC000819117114	DD	On-Demand	Anodyne	DPP7	45	38
NC(=O)COc1cccc(NC(=O)NCCC(=O)O)c1	ZINC000819117115	CC	On-Demand	Anodyne	ADRB1	22	40
NC(=O)COc1cccc(NC(=O)NCCC(=O)O)c1	ZINC000819117115	CC	On-Demand	Anodyne	HRH2	28	42
NC(=O)COc1cccc(NC(=O)NCCC(=O)O)c1	ZINC000819117115	CC	On-Demand	Anodyne	EPHX2	24	42
NC(=O)C[C@@H](NC(=O)Nc1ccccc1CC(=O)O)c1cccc(Cl)c1	ZINC000819117120	GF	On-Demand	Anodyne	CXCL8	30	43
NC(=O)COc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819117153	DC	On-Demand	Anodyne	ADRB2	35	45
NC(=O)COc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819117153	DC	On-Demand	Anodyne	ADRB1	50	51
NC(=O)COc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819117153	DC	On-Demand	Anodyne	ADRB3	117	51
NC(=O)COc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819117154	DC	On-Demand	Anodyne	ADRB2	35	45
NC(=O)COc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819117154	DC	On-Demand	Anodyne	ADRB1	50	51
NC(=O)COc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819117154	DC	On-Demand	Anodyne	ADRB3	117	51
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2cc(C(=O)OC)ccc2OC)C1	ZINC000819117181	GC	On-Demand	Anodyne	CPT1A	73	36
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2cc(C(=O)OC)ccc2OC)C1	ZINC000819117181	GC	On-Demand	Anodyne	CPT2	48	36
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2cc(C(=O)OC)ccc2OC)C1	ZINC000819117181	GC	On-Demand	Anodyne	CPT1B	59	36
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2cc(C(=O)OC)ccc2OC)C1	ZINC000819117182	GC	On-Demand	Anodyne	CPT1A	73	36
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2cc(C(=O)OC)ccc2OC)C1	ZINC000819117182	GC	On-Demand	Anodyne	CPT2	48	36
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2cc(C(=O)OC)ccc2OC)C1	ZINC000819117182	GC	On-Demand	Anodyne	CPT1B	59	36
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819117191	EG	On-Demand	Anodyne	GRIN2B	20	47
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819117191	EG	On-Demand	Anodyne	SIGMAR1	20	44
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819117191	EG	On-Demand	Anodyne	C3AR1	51	50
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819117191	EG	On-Demand	Anodyne	EPHX2	28	42
O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819117191	EG	On-Demand	Anodyne	CCR8	40	33
Cc1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819117204	EF	On-Demand	Anodyne	ADRB2	37	44
Cc1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819117204	EF	On-Demand	Anodyne	ADRB1	51	40
Cc1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819117205	EF	On-Demand	Anodyne	ADRB2	37	44
Cc1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819117205	EF	On-Demand	Anodyne	ADRB1	51	40
Cc1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819117206	EF	On-Demand	Anodyne	ADRB2	37	44
Cc1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819117206	EF	On-Demand	Anodyne	ADRB1	51	40
Cc1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819117207	EF	On-Demand	Anodyne	ADRB2	37	44
Cc1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819117207	EF	On-Demand	Anodyne	ADRB1	51	40
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc3c(c2)N(C)CCC3)C1	ZINC000819117208	FD	On-Demand	Anodyne	AKR1C3	43	35
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc3c(c2)N(C)CCC3)C1	ZINC000819117209	FD	On-Demand	Anodyne	AKR1C3	43	35
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819117229	FF	On-Demand	Anodyne	MTNR1A	17	43
COc1ccc(O[C@@H](C)CNC[C@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819117231	FF	On-Demand	Anodyne	MTNR1A	17	43
COc1ccc(O[C@@H](C)CNC[C@H](O)c2cccnc2)cc1	ZINC000819117236	DE	On-Demand	Anodyne	ADRB2	32	51
COc1ccc(O[C@@H](C)CNC[C@H](O)c2cccnc2)cc1	ZINC000819117236	DE	On-Demand	Anodyne	ADRB1	32	51
COc1ccc(O[C@@H](C)CNC[C@H](O)c2cccnc2)cc1	ZINC000819117236	DE	On-Demand	Anodyne	ADRB3	103	51
COc1ccc(O[C@@H](C)CNC[C@H](O)c2cccnc2)cc1	ZINC000819117236	DE	On-Demand	Anodyne	KCNA5	19	42
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2cccnc2)cc1	ZINC000819117237	DE	On-Demand	Anodyne	ADRB2	32	51
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2cccnc2)cc1	ZINC000819117237	DE	On-Demand	Anodyne	ADRB1	32	51
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2cccnc2)cc1	ZINC000819117237	DE	On-Demand	Anodyne	ADRB3	103	51
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2cccnc2)cc1	ZINC000819117237	DE	On-Demand	Anodyne	KCNA5	19	42
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)C1	ZINC000819117242	GD	On-Demand	Bother	TRPV4	43	35
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2Cl)C1	ZINC000819117243	GD	On-Demand	Bother	TRPV4	43	35
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819117256	DF	On-Demand	Anodyne	ADRB2	19	43
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819117256	DF	On-Demand	Anodyne	ADRB1	25	44
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819117256	DF	On-Demand	Anodyne	ADRB3	39	44
COc1ccc(O[C@@H](C)CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819117257	DF	On-Demand	Anodyne	ADRB2	19	43
COc1ccc(O[C@@H](C)CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819117257	DF	On-Demand	Anodyne	ADRB1	25	44
COc1ccc(O[C@@H](C)CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819117257	DF	On-Demand	Anodyne	ADRB3	39	44
NC(=O)COc1cccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819117260	GE	On-Demand	Anodyne	ADRB1	31	42
NC(=O)COc1cccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819117260	GE	On-Demand	Anodyne	GRIN2B	15	41
NC(=O)COc1cccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819117260	GE	On-Demand	Anodyne	ADRB3	31	40
NC(=O)COc1cccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819117260	GE	On-Demand	Anodyne	PDS	49	34
NC(=O)COc1cccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819117261	GE	On-Demand	Anodyne	ADRB1	31	42
NC(=O)COc1cccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819117261	GE	On-Demand	Anodyne	GRIN2B	15	41
NC(=O)COc1cccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819117261	GE	On-Demand	Anodyne	ADRB3	31	40
NC(=O)COc1cccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819117261	GE	On-Demand	Anodyne	PDS	49	34
COc1ccc(O[C@@H](C)CNCCC(=O)Nc2ccc(N(C)C)cc2)cc1	ZINC000819117306	FG	On-Demand	Anodyne	MTNR1A	17	45
COc1ccc(O[C@@H](C)CNCCC(=O)Nc2ccc(N(C)C)cc2)cc1	ZINC000819117306	FG	On-Demand	Anodyne	MTNR1B	22	45
O[C@@H](CNC[C@@H]1OCCc2sccc21)COc1ccc(F)cc1	ZINC000819117308	EF	On-Demand	Anodyne	ADRB1	55	40
O[C@H](CNC[C@@H]1OCCc2sccc21)COc1ccc(F)cc1	ZINC000819117309	EF	On-Demand	Anodyne	ADRB1	55	40
O[C@H](CNC[C@H]1OCCc2sccc21)COc1ccc(F)cc1	ZINC000819117310	EF	On-Demand	Anodyne	ADRB1	55	40
O[C@@H](CNC[C@H]1OCCc2sccc21)COc1ccc(F)cc1	ZINC000819117311	EF	On-Demand	Anodyne	ADRB1	55	40
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(Cl)nc2)C1	ZINC000819117320	EC	On-Demand	Anodyne	GCKR	61	32
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(Cl)nc2)C1	ZINC000819117321	EC	On-Demand	Anodyne	GCKR	61	32
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819117329	EF	On-Demand	Bother	CACNA1C	41	39
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819117329	EF	On-Demand	Bother	CACNA1D	62	39
COc1ccc(O[C@@H](C)CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819117330	EF	On-Demand	Bother	CACNA1C	41	39
COc1ccc(O[C@@H](C)CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819117330	EF	On-Demand	Bother	CACNA1D	62	39
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819117337	GE	On-Demand	Anodyne	ADRB2	43	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819117337	GE	On-Demand	Anodyne	ADRB1	78	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819117337	GE	On-Demand	Anodyne	ADRB3	50	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819117338	GE	On-Demand	Anodyne	ADRB2	43	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819117338	GE	On-Demand	Anodyne	ADRB1	78	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819117338	GE	On-Demand	Anodyne	ADRB3	50	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819117339	GE	On-Demand	Anodyne	ADRB2	43	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819117339	GE	On-Demand	Anodyne	ADRB1	78	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819117339	GE	On-Demand	Anodyne	ADRB3	50	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819117340	GE	On-Demand	Anodyne	ADRB2	43	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819117340	GE	On-Demand	Anodyne	ADRB1	78	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819117340	GE	On-Demand	Anodyne	ADRB3	50	50
COC(=O)C1(NC(=O)c2cccc(S(=O)(=O)NCc3ccc4c(c3)OCO4)c2)CCCCC1	ZINC000819117348	JE	On-Demand	Anodyne	BMP1	56	37
O[C@@H](CNC[C@H]1OCCc2sccc21)COc1ccccc1Cl	ZINC000819117349	FG	On-Demand	Anodyne	ADRB2	21	46
O[C@@H](CNC[C@@H]1OCCc2sccc21)COc1ccccc1Cl	ZINC000819117350	FG	On-Demand	Anodyne	ADRB2	21	46
O[C@H](CNC[C@H]1OCCc2sccc21)COc1ccccc1Cl	ZINC000819117351	FG	On-Demand	Anodyne	ADRB2	21	46
O[C@H](CNC[C@@H]1OCCc2sccc21)COc1ccccc1Cl	ZINC000819117352	FG	On-Demand	Anodyne	ADRB2	21	46
O[C@@H](CNC[C@H]1OCCc2sccc21)COc1ccccc1C(F)(F)F	ZINC000819117357	GG	On-Demand	Anodyne	ADRB1	47	33
O[C@@H](CNC[C@@H]1OCCc2sccc21)COc1ccccc1C(F)(F)F	ZINC000819117358	GG	On-Demand	Anodyne	ADRB1	47	33
O[C@H](CNC[C@H]1OCCc2sccc21)COc1ccccc1C(F)(F)F	ZINC000819117359	GG	On-Demand	Anodyne	ADRB1	47	33
O[C@H](CNC[C@@H]1OCCc2sccc21)COc1ccccc1C(F)(F)F	ZINC000819117360	GG	On-Demand	Anodyne	ADRB1	47	33
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCC2CC2)CC1	ZINC000819117371	DF	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCC2CC2)CC1	ZINC000819117372	DF	On-Demand	Anodyne	GPR119	26	40
CS(=O)(=O)c1ccc([C@@H](O)CNCc2cccc(OCC(N)=O)c2)cc1	ZINC000819117403	GC	On-Demand	Anodyne	ADRB1	31	42
CS(=O)(=O)c1ccc([C@@H](O)CNCc2cccc(OCC(N)=O)c2)cc1	ZINC000819117403	GC	On-Demand	Anodyne	ADRB3	56	38
CS(=O)(=O)c1ccc([C@H](O)CNCc2cccc(OCC(N)=O)c2)cc1	ZINC000819117404	GC	On-Demand	Anodyne	ADRB1	31	42
CS(=O)(=O)c1ccc([C@H](O)CNCc2cccc(OCC(N)=O)c2)cc1	ZINC000819117404	GC	On-Demand	Anodyne	ADRB3	56	38
COc1ccc(O[C@@H](C)CNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819117418	EG	On-Demand	Anodyne	ADRB3	23	40
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2ccccc2)cc1	ZINC000819117446	DF	On-Demand	Anodyne	ADRB2	32	45
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2ccccc2)cc1	ZINC000819117446	DF	On-Demand	Anodyne	ADRB1	33	42
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2ccccc2)cc1	ZINC000819117446	DF	On-Demand	Anodyne	ADRB3	45	53
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2ccccc2)cc1	ZINC000819117446	DF	On-Demand	Anodyne	AOC3	21	53
COc1ccc(O[C@@H](C)CNC[C@H](O)c2ccccc2)cc1	ZINC000819117448	DF	On-Demand	Anodyne	ADRB2	32	45
COc1ccc(O[C@@H](C)CNC[C@H](O)c2ccccc2)cc1	ZINC000819117448	DF	On-Demand	Anodyne	ADRB1	33	42
COc1ccc(O[C@@H](C)CNC[C@H](O)c2ccccc2)cc1	ZINC000819117448	DF	On-Demand	Anodyne	ADRB3	45	53
COc1ccc(O[C@@H](C)CNC[C@H](O)c2ccccc2)cc1	ZINC000819117448	DF	On-Demand	Anodyne	AOC3	21	53
O[C@H](CNCCC1CC1)c1ccc(OC(F)(F)F)cc1	ZINC000819117454	CG	On-Demand	Anodyne	ADRB3	24	44
O[C@@H](CNCCC1CC1)c1ccc(OC(F)(F)F)cc1	ZINC000819117455	CG	On-Demand	Anodyne	ADRB3	24	44
NC(=O)COc1cccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819117464	FE	On-Demand	Anodyne	ADRB1	27	44
NC(=O)COc1cccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819117464	FE	On-Demand	Anodyne	ADRB3	31	40
NC(=O)COc1cccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819117464	FE	On-Demand	Anodyne	PDS	51	44
NC(=O)COc1cccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819117465	FE	On-Demand	Anodyne	ADRB1	27	44
NC(=O)COc1cccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819117465	FE	On-Demand	Anodyne	ADRB3	31	40
NC(=O)COc1cccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819117465	FE	On-Demand	Anodyne	PDS	51	44
COc1ccc(O[C@@H](C)CNCCC(=O)N(C)OC)cc1	ZINC000819117469	CD	On-Demand	Anodyne	MTNR1A	19	42
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819117471	GE	On-Demand	Anodyne	ADRB3	33	45
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819117471	GE	On-Demand	Anodyne	MMP2	22	40
COc1ccc(O[C@@H](C)CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819117473	GE	On-Demand	Anodyne	ADRB3	33	45
COc1ccc(O[C@@H](C)CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819117473	GE	On-Demand	Anodyne	MMP2	22	40
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1OCC(N)=O	ZINC000819117494	DD	On-Demand	Anodyne	ENPP1	65	31
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1OCC(N)=O	ZINC000819117495	DD	On-Demand	Anodyne	ENPP1	65	31
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1OCC(N)=O	ZINC000819117496	DD	On-Demand	Anodyne	ENPP1	65	31
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1OCC(N)=O	ZINC000819117497	DD	On-Demand	Anodyne	ENPP1	65	31
O[C@@H](CNC[C@H]1OCCc2sccc21)COc1ccc2ccccc2c1	ZINC000819117498	FH	On-Demand	Anodyne	ADRB2	31	47
O[C@H](CNC[C@@H]1OCCc2sccc21)COc1ccc2ccccc2c1	ZINC000819117500	FH	On-Demand	Anodyne	ADRB2	31	47
O[C@H](CNC[C@H]1OCCc2sccc21)COc1ccc2ccccc2c1	ZINC000819117501	FH	On-Demand	Anodyne	ADRB2	31	47
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819117518	GH	On-Demand	Anodyne	ADRB2	19	43
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819117518	GH	On-Demand	Anodyne	ADRB3	39	40
COc1ccc(O[C@@H](C)CNC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819117519	GH	On-Demand	Anodyne	ADRB2	19	43
COc1ccc(O[C@@H](C)CNC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819117519	GH	On-Demand	Anodyne	ADRB3	39	40
Cc1ccccc1[C@@H](O)CNCc1cccc(OCC(N)=O)c1	ZINC000819117528	DD	On-Demand	Anodyne	ADRB1	26	42
Cc1ccccc1[C@@H](O)CNCc1cccc(OCC(N)=O)c1	ZINC000819117528	DD	On-Demand	Anodyne	PDS	65	37
O[C@@H](CNC[C@@H]1OCCc2sccc21)COc1cccc(C(F)(F)F)c1	ZINC000819117534	GG	On-Demand	Anodyne	ADRB1	17	41
O[C@@H](CNC[C@@H]1OCCc2sccc21)COc1cccc(C(F)(F)F)c1	ZINC000819117534	GG	On-Demand	Anodyne	PDS	42	36
O[C@H](CNC[C@@H]1OCCc2sccc21)COc1cccc(C(F)(F)F)c1	ZINC000819117535	GG	On-Demand	Anodyne	ADRB1	17	41
O[C@H](CNC[C@@H]1OCCc2sccc21)COc1cccc(C(F)(F)F)c1	ZINC000819117535	GG	On-Demand	Anodyne	PDS	42	36
O[C@H](CNC[C@H]1OCCc2sccc21)COc1cccc(C(F)(F)F)c1	ZINC000819117536	GG	On-Demand	Anodyne	ADRB1	17	41
O[C@H](CNC[C@H]1OCCc2sccc21)COc1cccc(C(F)(F)F)c1	ZINC000819117536	GG	On-Demand	Anodyne	PDS	42	36
O[C@@H](CNC[C@H]1OCCc2sccc21)COc1cccc(C(F)(F)F)c1	ZINC000819117537	GG	On-Demand	Anodyne	ADRB1	17	41
O[C@@H](CNC[C@H]1OCCc2sccc21)COc1cccc(C(F)(F)F)c1	ZINC000819117537	GG	On-Demand	Anodyne	PDS	42	36
N#CCc1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819117546	FE	On-Demand	Mild	ADRB1	53	39
N#CCc1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819117547	FE	On-Demand	Mild	ADRB1	53	39
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819117548	FE	On-Demand	Mild	ADRB1	53	39
N#CCc1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819117549	FE	On-Demand	Mild	ADRB1	53	39
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819117550	GE	On-Demand	Anodyne	MMP13	49	39
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819117550	GE	On-Demand	Anodyne	APP	42	36
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819117550	GE	On-Demand	Anodyne	ADAM17	36	40
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819117550	GE	On-Demand	Anodyne	MMP3	36	40
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819117550	GE	On-Demand	Anodyne	MMP9	27	40
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819117550	GE	On-Demand	Anodyne	MMP7	40	37
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819117550	GE	On-Demand	Anodyne	MMP1	41	40
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819117551	GE	On-Demand	Anodyne	MMP13	49	39
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819117551	GE	On-Demand	Anodyne	APP	42	36
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819117551	GE	On-Demand	Anodyne	ADAM17	36	40
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819117551	GE	On-Demand	Anodyne	MMP3	36	40
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819117551	GE	On-Demand	Anodyne	MMP9	27	40
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819117551	GE	On-Demand	Anodyne	MMP7	40	37
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CCCC3)cc2)C1	ZINC000819117551	GE	On-Demand	Anodyne	MMP1	41	40
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)/C=C\c2cccc(Cl)c2)C1	ZINC000819117554	FE	On-Demand	Anodyne	MDM2	51	32
COC[C@]1(C(=O)O)CCN(S(=O)(=O)/C=C\c2cccc(Cl)c2)C1	ZINC000819117555	FE	On-Demand	Anodyne	MDM2	51	32
COC[C@]1(C(=O)O)CCN(S(=O)(=O)/C=C/c2cccc(Cl)c2)C1	ZINC000819117556	FE	On-Demand	Anodyne	MDM2	51	32
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)/C=C/c2cccc(Cl)c2)C1	ZINC000819117557	FE	On-Demand	Anodyne	MDM2	51	32
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1OCCc2sccc21	ZINC000819117563	GE	On-Demand	Anodyne	ADRB2	18	40
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1OCCc2sccc21	ZINC000819117563	GE	On-Demand	Anodyne	ADRB1	21	41
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1OCCc2sccc21	ZINC000819117564	GE	On-Demand	Anodyne	ADRB2	18	40
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1OCCc2sccc21	ZINC000819117564	GE	On-Demand	Anodyne	ADRB1	21	41
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1OCCc2sccc21	ZINC000819117565	GE	On-Demand	Anodyne	ADRB2	18	40
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1OCCc2sccc21	ZINC000819117565	GE	On-Demand	Anodyne	ADRB1	21	41
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1OCCc2sccc21	ZINC000819117566	GE	On-Demand	Anodyne	ADRB2	18	40
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1OCCc2sccc21	ZINC000819117566	GE	On-Demand	Anodyne	ADRB1	21	41
O[C@H](CNCCC1CC1)c1cccnc1	ZINC000819117584	BD	On-Demand	Anodyne	ADRB2	29	47
O[C@H](CNCCC1CC1)c1cccnc1	ZINC000819117584	BD	On-Demand	Anodyne	ADRB1	36	48
O[C@H](CNCCC1CC1)c1cccnc1	ZINC000819117584	BD	On-Demand	Anodyne	ADRB3	116	49
O[C@@H](CNCCC1CC1)c1cccnc1	ZINC000819117585	BD	On-Demand	Anodyne	ADRB2	29	47
O[C@@H](CNCCC1CC1)c1cccnc1	ZINC000819117585	BD	On-Demand	Anodyne	ADRB1	36	48
O[C@@H](CNCCC1CC1)c1cccnc1	ZINC000819117585	BD	On-Demand	Anodyne	ADRB3	116	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H]2OCCc3sccc32)CC1	ZINC000819117588	GF	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2OCCc3sccc32)CC1	ZINC000819117589	GF	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H]2OCCc3sccc32)CC1	ZINC000819117590	GF	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2OCCc3sccc32)CC1	ZINC000819117591	GF	On-Demand	Anodyne	GPR119	29	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)c1	ZINC000819117592	FF	On-Demand	Anodyne	ABCB1	17	42
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)c1	ZINC000819117593	FF	On-Demand	Anodyne	ABCB1	17	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)c1	ZINC000819117594	FF	On-Demand	Anodyne	ABCB1	17	42
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)c1	ZINC000819117595	FF	On-Demand	Anodyne	ABCB1	17	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCSC1	ZINC000819117596	FF	On-Demand	Anodyne	CTSD	104	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCSC1	ZINC000819117596	FF	On-Demand	Anodyne	PGC	60	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCSC1	ZINC000819117596	FF	On-Demand	Anodyne	PAPA1_CARPA	32	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCSC1	ZINC000819117596	FF	On-Demand	Anodyne	BACE2	53	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCSC1	ZINC000819117596	FF	On-Demand	Anodyne	REN	87	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCSC1	ZINC000819117596	FF	On-Demand	Anodyne	REN1	23	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCSC1	ZINC000819117596	FF	On-Demand	Anodyne	BACE1	79	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCSC1	ZINC000819117596	FF	On-Demand	Anodyne	FPR1	51	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCSC1	ZINC000819117596	FF	On-Demand	Anodyne	PLM1_PLAFA	34	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCSC1	ZINC000819117596	FF	On-Demand	Anodyne	PLM2_PLAFA	55	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCSC1	ZINC000819117596	FF	On-Demand	Anodyne	Q82323_9DELA	63	31
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCSC1	ZINC000819117597	FF	On-Demand	Anodyne	CTSD	104	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCSC1	ZINC000819117597	FF	On-Demand	Anodyne	PGC	60	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCSC1	ZINC000819117597	FF	On-Demand	Anodyne	PAPA1_CARPA	32	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCSC1	ZINC000819117597	FF	On-Demand	Anodyne	BACE2	53	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCSC1	ZINC000819117597	FF	On-Demand	Anodyne	REN	87	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCSC1	ZINC000819117597	FF	On-Demand	Anodyne	REN1	23	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCSC1	ZINC000819117597	FF	On-Demand	Anodyne	BACE1	79	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCSC1	ZINC000819117597	FF	On-Demand	Anodyne	FPR1	51	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCSC1	ZINC000819117597	FF	On-Demand	Anodyne	PLM1_PLAFA	34	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCSC1	ZINC000819117597	FF	On-Demand	Anodyne	PLM2_PLAFA	55	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCSC1	ZINC000819117597	FF	On-Demand	Anodyne	Q82323_9DELA	63	31
O=C(CC1CC1)NNC(=O)c1c[nH]nc1-c1ccccn1	ZINC000819117628	CD	On-Demand	Reactive	TGFBR1	22	41
O=C(CC1CC1)NNC(=O)c1ccc(OCC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819117632	IG	On-Demand	Reactive	UL80	23	42
O=C(CC1CC1)NNC(=O)c1ccc(OCC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819117632	IG	On-Demand	Reactive	CCR2	60	38
O=C(CC1CC1)NNC(=O)c1ccc(OCC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819117632	IG	On-Demand	Reactive	EPHX2	18	44
O=C(CC1CC1)NNC(=O)c1ccc(OCC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819117632	IG	On-Demand	Reactive	MCHR1	29	44
O=C(CC1CC1)NNC(=O)c1ccc(OCC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819117632	IG	On-Demand	Reactive	EPHA3	18	42
O=C(CC1CC1)NNC(=O)c1ccc(OCC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819117632	IG	On-Demand	Reactive	BTK	20	40
O=C(CC1CC1)NNC(=O)c1ccc(OCC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819117632	IG	On-Demand	Reactive	HIF1A	15	44
O=C(CC1CC1)NNC(=O)c1ccc(OCC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819117632	IG	On-Demand	Reactive	KCNK3	23	42
NS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2CC2)c(F)c1	ZINC000819117643	DC	On-Demand	Reactive	CA2	71	45
NS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2CC2)c(F)c1	ZINC000819117643	DC	On-Demand	Reactive	CA1	51	45
NS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2CC2)c(F)c1	ZINC000819117643	DC	On-Demand	Reactive	CA7	51	43
NS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2CC2)c(F)c1	ZINC000819117643	DC	On-Demand	Reactive	CA5B	57	42
NS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2CC2)c(F)c1	ZINC000819117643	DC	On-Demand	Reactive	CA4	65	45
NS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2CC2)c(F)c1	ZINC000819117643	DC	On-Demand	Reactive	CA5A	61	42
NS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2CC2)c(F)c1	ZINC000819117643	DC	On-Demand	Reactive	CA14	28	43
NS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2CC2)c(F)c1	ZINC000819117643	DC	On-Demand	Reactive	CA12	32	43
NS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2CC2)c(F)c1	ZINC000819117643	DC	On-Demand	Reactive	CA9	36	44
NS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2CC2)c(F)c1	ZINC000819117643	DC	On-Demand	Reactive	NCE103	42	39
CC(=O)N[C@@H](CC(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819117647	CC	On-Demand	Reactive	CAPN1	39	50
O=C(CC1CC1)NNC(=O)c1cc(Oc2ccccc2)ccc1O	ZINC000819117653	EF	On-Demand	Reactive	THRA	37	40
O=C(CC1CC1)NNC(=O)c1cc(Oc2ccccc2)ccc1O	ZINC000819117653	EF	On-Demand	Reactive	THRB	52	40
O=C(CC1CC1)NNC(=O)c1cc(C(F)(F)F)ccc1Sc1cccc(F)c1	ZINC000819117664	HJ	On-Demand	Reactive	CCR2	56	38
CCCC[C@@H](C)C(=O)NNC(=O)CC1CC1	ZINC000819117666	BD	On-Demand	Reactive	NOD1	42	35
CCCC[C@H](C)C(=O)NNC(=O)CC1CC1	ZINC000819117667	BD	On-Demand	Reactive	NOD1	42	35
CCCc1c(C(=O)NNC(=O)CC2CC2)cnn1-c1ccc(C)cc1	ZINC000819117668	EF	On-Demand	Reactive	GPR142	41	34
CC[C@@H](C)c1ccccc1N1C[C@@H](C(=O)NNC(=O)CC2CC2)CC1=O	ZINC000819117679	FF	On-Demand	Reactive	KCNQ2	52	34
CC[C@@H](C)c1ccccc1N1C[C@H](C(=O)NNC(=O)CC2CC2)CC1=O	ZINC000819117680	FF	On-Demand	Reactive	KCNQ2	52	34
Cc1nn(-c2ccc(S(N)(=O)=O)cc2)c(C)c1CCC(=O)NNC(=O)CC1CC1	ZINC000819117698	HD	On-Demand	Reactive	CA2	41	39
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)NNC(=O)CC2CC2)C1	ZINC000819117699	ED	On-Demand	Reactive	GPR119	39	40
O=C(CC1CC1)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1	ZINC000819117709	HE	On-Demand	Reactive	CNR2	15	65
O=C(CC1CC1)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1	ZINC000819117709	HE	On-Demand	Reactive	EPHX2	34	40
O=C(CC1CC1)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1	ZINC000819117709	HE	On-Demand	Reactive	CACNA1I	55	40
O=C(CC1CC1)NNC(=O)c1ccccc1NC(=O)c1ccc(Oc2ccccc2)cc1	ZINC000819117713	II	On-Demand	Reactive	GRIN2B	18	41
O=C(CC1CC1)NNC(=O)c1ccccc1NC(=O)c1ccc(Oc2ccccc2)cc1	ZINC000819117713	II	On-Demand	Reactive	CYSLTR2	45	34
O=C(CC1CC1)NNC(=O)c1ccccc1NC(=O)c1ccc(Oc2ccccc2)cc1	ZINC000819117713	II	On-Demand	Reactive	DGAT1	18	41
CCOC(=O)N[C@H]1CCCN(C(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819117730	FF	On-Demand	Anodyne	C3AR1	39	40
CCOC(=O)N[C@H]1CCCN(C(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819117730	FF	On-Demand	Anodyne	FAAH	27	44
CCOC(=O)N[C@H]1CCCN(C(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819117730	FF	On-Demand	Anodyne	BIRC2	25	40
O[C@H](CNC[C@@H]1C[C@@H]1c1ccc(F)cc1)c1ccc(Cl)cc1	ZINC000819117795	DH	On-Demand	Anodyne	SLC6A3	21	40
O[C@H](CNC[C@H]1C[C@H]1c1ccc(F)cc1)c1ccc(Cl)cc1	ZINC000819117797	DH	On-Demand	Anodyne	SLC6A3	21	40
O[C@H](CNC[C@@H]1C[C@H]1c1ccc(F)cc1)c1ccc(Cl)cc1	ZINC000819117799	DH	On-Demand	Anodyne	SLC6A3	21	40
O[C@@H](CNC[C@H]1C[C@H]1c1ccc(F)cc1)c1ccc(Cl)cc1	ZINC000819117801	DH	On-Demand	Anodyne	SLC6A3	21	40
CCCc1c(C(=O)NNC(=O)CC2CC2)cnn1-c1cccc(C)c1	ZINC000819117802	EF	On-Demand	Reactive	GPR142	41	34
O[C@@H](CNC[C@H]1C[C@@H]1c1ccc(F)cc1)c1ccc(Cl)cc1	ZINC000819117803	DH	On-Demand	Anodyne	SLC6A3	21	40
O[C@@H](CNC[C@@H]1C[C@@H]1c1ccc(F)cc1)c1ccc(Cl)cc1	ZINC000819117805	DH	On-Demand	Anodyne	SLC6A3	21	40
O[C@@H](CNC[C@@H]1C[C@H]1c1ccc(F)cc1)c1ccc(Cl)cc1	ZINC000819117807	DH	On-Demand	Anodyne	SLC6A3	21	40
O[C@H](CNC[C@H]1C[C@@H]1c1ccc(F)cc1)c1ccc(Cl)cc1	ZINC000819117810	DH	On-Demand	Anodyne	SLC6A3	21	40
O=C(CC1CC1)NNC(=O)c1cc(S(=O)(=O)N2CCc3ccccc3C2)ccc1Cl	ZINC000819117826	IF	On-Demand	Reactive	BDKRB1	15	40
O=C(CC1CC1)NNC(=O)c1cc(S(=O)(=O)N2CCc3ccccc3C2)ccc1Cl	ZINC000819117826	IF	On-Demand	Reactive	AKR1C3	72	48
COc1ccc(Cl)cc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819117827	IF	On-Demand	Reactive	CPT1A	58	41
COc1ccc(Cl)cc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819117827	IF	On-Demand	Reactive	CPT2	40	33
COc1ccc(Cl)cc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819117827	IF	On-Demand	Reactive	CCR2	24	44
COc1ccc(Cl)cc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819117827	IF	On-Demand	Reactive	CPT1B	44	37
COc1ccc(Cl)cc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819117827	IF	On-Demand	Reactive	PTGDR	31	41
COc1ccc(Cl)cc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819117827	IF	On-Demand	Reactive	PTGDR2	32	41
COc1ccc(Cl)cc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819117827	IF	On-Demand	Reactive	QRFPR	22	42
O=C(CC1CC1)NNC(=O)c1c[nH]c2cccnc12	ZINC000819117834	CD	On-Demand	Reactive	HTR1F	61	37
CCCNC(=O)c1cccc(CNC(=O)[C@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)c1	ZINC000819117835	GE	On-Demand	Anodyne	DRD4	40	30
CCCNC(=O)c1cccc(CNC(=O)[C@@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)c1	ZINC000819117838	GE	On-Demand	Anodyne	DRD4	40	30
CC(C)(C)Cc1nc(-c2ccc(C(=O)NNC(=O)CC3CC3)cc2)no1	ZINC000819117841	FF	On-Demand	Reactive	S1PR4	21	40
CC(C)(C)Cc1nc(-c2ccc(C(=O)NNC(=O)CC3CC3)cc2)no1	ZINC000819117841	FF	On-Demand	Reactive	S1PR5	22	40
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819117842	FG	On-Demand	Anodyne	CCR2	41	41
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819117842	FG	On-Demand	Anodyne	HPGD	16	44
O=C(CC1CC1)NNC(=O)c1cccc(Nc2ncccn2)c1	ZINC000819117853	DD	On-Demand	Reactive	TYK2	15	47
O=C(CC1CC1)NNC(=O)c1cccc(Nc2ncccn2)c1	ZINC000819117853	DD	On-Demand	Reactive	BTK	28	41
O=C(CC1CC1)NNC(=O)c1cccc(Nc2ncccn2)c1	ZINC000819117853	DD	On-Demand	Reactive	TXK	45	39
O=C(COc1ccc(O)cc1)NNC(=O)CC1CC1	ZINC000819117859	CC	On-Demand	Reactive	GRIN2B	17	44
O=C(COc1ccc(O)cc1)NNC(=O)CC1CC1	ZINC000819117859	CC	On-Demand	Reactive	TRAR	33	40
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)NNC(=O)CC1CC1	ZINC000819117862	ED	On-Demand	Reactive	MTNR1B	17	57
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)NNC(=O)CC1CC1	ZINC000819117862	ED	On-Demand	Reactive	TRPM8	25	40
Cc1ccc(NC(=O)CSCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819117866	ED	On-Demand	Reactive	FUCA1	17	40
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819117891	ED	On-Demand	Reactive	FKBP1A	25	40
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819117891	ED	On-Demand	Reactive	ELANE	47	43
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819117891	ED	On-Demand	Reactive	MMP13	33	41
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819117891	ED	On-Demand	Reactive	PREP	52	43
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819117891	ED	On-Demand	Reactive	MMP3	43	41
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819117891	ED	On-Demand	Reactive	MMP8	19	41
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819117891	ED	On-Demand	Reactive	LGMN	72	43
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819117891	ED	On-Demand	Reactive	MMP7	38	41
COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819117891	ED	On-Demand	Reactive	MMP1	40	44
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819117892	ED	On-Demand	Reactive	FKBP1A	25	40
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819117892	ED	On-Demand	Reactive	ELANE	47	43
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819117892	ED	On-Demand	Reactive	MMP13	33	41
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819117892	ED	On-Demand	Reactive	PREP	52	43
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819117892	ED	On-Demand	Reactive	MMP3	43	41
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819117892	ED	On-Demand	Reactive	MMP8	19	41
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819117892	ED	On-Demand	Reactive	LGMN	72	43
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819117892	ED	On-Demand	Reactive	MMP7	38	41
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819117892	ED	On-Demand	Reactive	MMP1	40	44
CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819117898	HE	On-Demand	Reactive	MMP13	21	40
CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819117898	HE	On-Demand	Reactive	MMP3	22	40
CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819117898	HE	On-Demand	Reactive	EPHX2	41	63
CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819117898	HE	On-Demand	Reactive	TGM2	65	36
CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819117898	HE	On-Demand	Reactive	MMP7	19	40
CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819117898	HE	On-Demand	Reactive	MMP1	23	40
CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819117898	HE	On-Demand	Reactive	F13A1	63	34
CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(C(=O)NNC(=O)CC3CC3)cc2)cc1	ZINC000819117902	ID	On-Demand	Reactive	CA2	20	45
CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(C(=O)NNC(=O)CC3CC3)cc2)cc1	ZINC000819117902	ID	On-Demand	Reactive	CA1	19	45
CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(C(=O)NNC(=O)CC3CC3)cc2)cc1	ZINC000819117902	ID	On-Demand	Reactive	CA9	22	44
O=C(CC1CC1)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1	ZINC000819117911	HF	On-Demand	Reactive	PRTN3	61	39
O=C(CC1CC1)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1	ZINC000819117911	HF	On-Demand	Reactive	CCR8	41	32
O=C(CC1CC1)NNC(=O)c1cccc(NS(=O)(=O)C(F)(F)F)c1	ZINC000819117914	FD	On-Demand	Reactive	CCR2	45	36
O=C(CC1CC1)NNC(=O)c1ccccc1OCc1cccc(Br)c1	ZINC000819117918	HH	On-Demand	Reactive	PPIA	21	40
O=C(CC1CC1)NNC(=O)c1ccccc1OCc1cccc(Br)c1	ZINC000819117918	HH	On-Demand	Reactive	HCN1	50	38
O=C(CC1CC1)NNC(=O)c1ccccc1OCc1cccc(Br)c1	ZINC000819117918	HH	On-Demand	Reactive	HCN4	42	33
O=C(CC1CC1)NNC(=O)c1occc1COc1ccccc1	ZINC000819117923	DE	On-Demand	Reactive	GRIN2B	19	40
O=C(CCCCc1ccc(Br)cc1)NNC(=O)CC1CC1	ZINC000819117928	FG	On-Demand	Reactive	TRAR	23	42
O=C(CSc1nnc(-c2cccnc2)n1-c1ccccc1)NNC(=O)CC1CC1	ZINC000819117930	HE	On-Demand	Reactive	VCP	70	37
O=C(CC1CC1)NNC(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O	ZINC000819117931	FC	On-Demand	Reactive	SIGMAR1	20	40
O=C(CC1CC1)NNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1	ZINC000819117933	HD	On-Demand	Reactive	MMP3	34	49
O=C(CC1CC1)NNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1	ZINC000819117933	HD	On-Demand	Reactive	MMP8	37	49
O=C(CC1CC1)NNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1	ZINC000819117933	HD	On-Demand	Reactive	ADAM9	58	38
O=C(CC1CC1)NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1	ZINC000819117934	HD	On-Demand	Reactive	MMP3	34	49
O=C(CC1CC1)NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1	ZINC000819117934	HD	On-Demand	Reactive	MMP8	37	49
O=C(CC1CC1)NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1	ZINC000819117934	HD	On-Demand	Reactive	ADAM9	58	38
O=C(CC1CC1)NNC(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1	ZINC000819117943	GI	On-Demand	Reactive	RAF1	24	41
O=C(CC1CC1)NNC(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1	ZINC000819117943	GI	On-Demand	Reactive	CCR2	86	45
O=C(CC1CC1)NNC(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1	ZINC000819117943	GI	On-Demand	Reactive	PDS	40	37
O=C(CC1CC1)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2-c2ccccc2)c1	ZINC000819117945	IH	On-Demand	Reactive	ST14	58	35
CON(C)C(=O)CCN[C@@H](c1ccc2c(c1)OCCO2)c1ccccc1Cl	ZINC000819117976	GG	On-Demand	Anodyne	KCNQ2	21	41
CON(C)C(=O)CCN[C@H](c1ccc2c(c1)OCCO2)c1ccccc1Cl	ZINC000819117978	GG	On-Demand	Anodyne	KCNQ2	21	41
C[C@@H](Oc1ccccc1Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819117979	FF	On-Demand	Reactive	SLC5A4	43	34
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	ACE	29	42
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	OPRM1	30	40
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	MME	62	35
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	ANPEP	45	35
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	PAPA1_CARPA	37	44
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	CYSP_TRYCR	53	40
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	CTSL	40	44
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	TIMP3	74	40
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	CTRB1	20	41
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	CTSS	22	48
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	CAPN1	42	36
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	MMP9	15	42
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	ACE2	47	33
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	CTSV	22	40
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	MMP1	16	42
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	PSMB5	51	41
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	BLA1_STEMA	53	36
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	PSMB8	21	41
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	NPFFR1	43	36
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118021	FD	On-Demand	Reactive	GPR142	43	36
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	ACE	29	42
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	OPRM1	30	40
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	MME	62	35
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	ANPEP	45	35
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	PAPA1_CARPA	37	44
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	CYSP_TRYCR	53	40
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	CTSL	40	44
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	TIMP3	74	40
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	CTRB1	20	41
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	CTSS	22	48
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	CAPN1	42	36
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	MMP9	15	42
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	ACE2	47	33
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	CTSV	22	40
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	MMP1	16	42
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	PSMB5	51	41
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	BLA1_STEMA	53	36
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	PSMB8	21	41
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	NPFFR1	43	36
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000819118023	FD	On-Demand	Reactive	GPR142	43	36
O=C(CC1CC1)NNC(=O)c1ccc(-c2ccc(C(F)(F)F)cc2)o1	ZINC000819118032	FH	On-Demand	Reactive	LUXR	15	44
O=C(CCSCc1nc(O)c2ccccc2n1)NNC(=O)CC1CC1	ZINC000819118042	FD	On-Demand	Reactive	TNKS	70	39
COc1ccc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)cc1OCC(N)=O	ZINC000819118057	GD	On-Demand	Anodyne	ENPP1	67	33
CCCCCCCCC(=O)NNC(=O)CC1CC1	ZINC000819118064	CF	On-Demand	Reactive	LUXR	35	44
CCCCCCCCC(=O)NNC(=O)CC1CC1	ZINC000819118064	CF	On-Demand	Reactive	TRAR	15	44
CCCCCCCCC(=O)NNC(=O)CC1CC1	ZINC000819118064	CF	On-Demand	Reactive	LASR	65	44
CCCCCCCCC(=O)NNC(=O)CC1CC1	ZINC000819118064	CF	On-Demand	Reactive	NOD1	49	38
CCCCCCCCC(=O)NNC(=O)CC1CC1	ZINC000819118064	CF	On-Demand	Reactive	CQSS	59	36
O=C(CCc1ccc(-c2ccccc2)o1)NNC(=O)CC1CC1	ZINC000819118074	DF	On-Demand	Reactive	CYP2E1	18	40
COC[C@]1(C(=O)O)CCCN(S(=O)(=O)c2ccc3c(c2)N(C)CCC3)C1	ZINC000819118095	GD	On-Demand	Anodyne	AKR1C3	44	35
O=C(CCc1cccc(C(F)(F)F)c1)NNC(=O)CC1CC1	ZINC000819118099	DF	On-Demand	Reactive	PTGFR	31	41
O=C(CCc1cccc(C(F)(F)F)c1)NNC(=O)CC1CC1	ZINC000819118099	DF	On-Demand	Reactive	TACR1	30	40
O=C(CCc1cccc(C(F)(F)F)c1)NNC(=O)CC1CC1	ZINC000819118099	DF	On-Demand	Reactive	CCR2	75	39
O=C(CCc1cccc(C(F)(F)F)c1)NNC(=O)CC1CC1	ZINC000819118099	DF	On-Demand	Reactive	LUXR	37	58
O=C(CCc1cccc(C(F)(F)F)c1)NNC(=O)CC1CC1	ZINC000819118099	DF	On-Demand	Reactive	TRAR	17	40
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819118121	FH	On-Demand	Anodyne	ADRB2	15	40
COc1ccc(O[C@@H](C)CNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819118122	FH	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CNCCn1cccc1)c1ccc(Cl)c(F)c1	ZINC000819118131	CF	On-Demand	Anodyne	ADRB1	16	40
O[C@@H](CNCCn1cccc1)c1ccc(Cl)c(F)c1	ZINC000819118131	CF	On-Demand	Anodyne	ADRB3	21	40
O[C@H](CNCCn1cccc1)c1ccc(Cl)c(F)c1	ZINC000819118132	CF	On-Demand	Anodyne	ADRB1	16	40
O[C@H](CNCCn1cccc1)c1ccc(Cl)c(F)c1	ZINC000819118132	CF	On-Demand	Anodyne	ADRB3	21	40
O=C(CC1CC1)NNC(=O)C(Cc1ccccc1)Cc1ccccc1	ZINC000819118158	EG	On-Demand	Reactive	ACE	74	41
O=C(CC1CC1)NNC(=O)C(Cc1ccccc1)Cc1ccccc1	ZINC000819118158	EG	On-Demand	Reactive	MME	154	42
O=C(CC1CC1)NNC(=O)C(Cc1ccccc1)Cc1ccccc1	ZINC000819118158	EG	On-Demand	Reactive	ANPEP	93	42
O=C(CC1CC1)NNC(=O)C(Cc1ccccc1)Cc1ccccc1	ZINC000819118158	EG	On-Demand	Reactive	CPA1	77	41
O=C(CC1CC1)NNC(=O)C(Cc1ccccc1)Cc1ccccc1	ZINC000819118158	EG	On-Demand	Reactive	TIMP3	51	33
O=C(CC1CC1)NNC(=O)C(Cc1ccccc1)Cc1ccccc1	ZINC000819118158	EG	On-Demand	Reactive	CAPNS1	51	33
O=C(CC1CC1)NNC(=O)C(Cc1ccccc1)Cc1ccccc1	ZINC000819118158	EG	On-Demand	Reactive	CAPN1	60	36
O=C(CC1CC1)NNC(=O)C(Cc1ccccc1)Cc1ccccc1	ZINC000819118158	EG	On-Demand	Reactive	CAPN2	54	32
O=C(CC1CC1)NNC(=O)C(Cc1ccccc1)Cc1ccccc1	ZINC000819118158	EG	On-Demand	Reactive	ACE2	61	37
O=C(CC1CC1)NNC(=O)C(Cc1ccccc1)Cc1ccccc1	ZINC000819118158	EG	On-Demand	Reactive	LAP3	46	35
O=C(CC1CC1)NNC(=O)C(Cc1ccccc1)Cc1ccccc1	ZINC000819118158	EG	On-Demand	Reactive	AMP1_PLAFQ	43	40
O=C(CC1CC1)NNC(=O)C[C@H]1CCc2ccccc21	ZINC000819118173	CE	On-Demand	Reactive	PPARD	17	40
O=C(CC1CC1)NNC(=O)C[C@@H]1CCc2ccccc21	ZINC000819118175	CE	On-Demand	Reactive	PPARD	17	40
O[C@H](CNC[C@H]1C[C@H]1c1ccc(F)cc1)c1ccccc1	ZINC000819118176	CG	On-Demand	Anodyne	SLC6A3	17	43
O[C@H](CNC[C@@H]1C[C@@H]1c1ccc(F)cc1)c1ccccc1	ZINC000819118178	CG	On-Demand	Anodyne	SLC6A3	17	43
O[C@H](CNC[C@H]1C[C@@H]1c1ccc(F)cc1)c1ccccc1	ZINC000819118180	CG	On-Demand	Anodyne	SLC6A3	17	43
O=C(CC1CC1)NNC(=O)c1cc(Cl)nc2ccccc12	ZINC000819118181	DE	On-Demand	Reactive	ACACB	15	44
O[C@H](CNC[C@@H]1C[C@H]1c1ccc(F)cc1)c1ccccc1	ZINC000819118182	CG	On-Demand	Anodyne	SLC6A3	17	43
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccccc1	ZINC000819118185	FF	On-Demand	Reactive	ACHE	23	48
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccccc1	ZINC000819118185	FF	On-Demand	Reactive	PDGFRB	15	40
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccccc1	ZINC000819118185	FF	On-Demand	Reactive	PTGER1	59	37
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccccc1	ZINC000819118185	FF	On-Demand	Reactive	MTNR1B	20	48
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccccc1	ZINC000819118185	FF	On-Demand	Reactive	SLC6A5	35	42
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccccc1	ZINC000819118185	FF	On-Demand	Reactive	HCRTR2	22	40
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccccc1	ZINC000819118185	FF	On-Demand	Reactive	ADCYAP1R1	43	40
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccccc1	ZINC000819118185	FF	On-Demand	Reactive	ACKR3	40	34
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)CC1CC1	ZINC000819118192	FC	On-Demand	Reactive	TBXA2R	17	47
O=C(CC1CC1)NNC(=O)Cn1c(-c2cscn2)nc2ccccc21	ZINC000819118202	FE	On-Demand	Reactive	PDE6D	54	32
O=C(CC1CC1)NNC(=O)Cn1c(-c2cscn2)nc2ccccc21	ZINC000819118202	FE	On-Demand	Reactive	IMDH_CRYPV	48	64
O=C(CC1CC1)NNC(=O)c1cccn1Cc1ccccc1	ZINC000819118207	CE	On-Demand	Reactive	ACHE	24	40
O=C(CC1CC1)NNC(=O)c1cccn1Cc1ccccc1	ZINC000819118207	CE	On-Demand	Reactive	SIGMAR1	25	41
O[C@@H](CNCCn1cccc1)c1ccccc1	ZINC000819118219	BD	On-Demand	Anodyne	ADRB2	30	54
O[C@@H](CNCCn1cccc1)c1ccccc1	ZINC000819118219	BD	On-Demand	Anodyne	ADRB1	37	41
O[C@@H](CNCCn1cccc1)c1ccccc1	ZINC000819118219	BD	On-Demand	Anodyne	ADRB3	66	45
O[C@@H](CNCCn1cccc1)c1ccccc1	ZINC000819118219	BD	On-Demand	Anodyne	AOC3	15	49
O[C@H](CNCCn1cccc1)c1ccccc1	ZINC000819118220	BD	On-Demand	Anodyne	ADRB2	30	54
O[C@H](CNCCn1cccc1)c1ccccc1	ZINC000819118220	BD	On-Demand	Anodyne	ADRB1	37	41
O[C@H](CNCCn1cccc1)c1ccccc1	ZINC000819118220	BD	On-Demand	Anodyne	ADRB3	66	45
O[C@H](CNCCn1cccc1)c1ccccc1	ZINC000819118220	BD	On-Demand	Anodyne	AOC3	15	49
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1	ZINC000819118235	CE	On-Demand	Reactive	MDM2	52	32
O=C(CC1CC1)NNC(=O)[C@H]1C[C@@H]1c1cccc(Cl)c1	ZINC000819118236	CE	On-Demand	Reactive	MDM2	52	32
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000819118237	CE	On-Demand	Reactive	MDM2	52	32
O=C(CC1CC1)NNC(=O)[C@H]1C[C@H]1c1cccc(Cl)c1	ZINC000819118239	CE	On-Demand	Reactive	MDM2	52	32
NS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2CC2)nc1	ZINC000819118248	CB	On-Demand	Reactive	CA2	51	39
NS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2CC2)nc1	ZINC000819118248	CB	On-Demand	Reactive	CA7	41	36
NS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2CC2)nc1	ZINC000819118248	CB	On-Demand	Reactive	CA5B	51	36
NS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2CC2)nc1	ZINC000819118248	CB	On-Demand	Reactive	CA4	42	35
NS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2CC2)nc1	ZINC000819118248	CB	On-Demand	Reactive	CA5A	54	36
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)c(C)c1	ZINC000819118251	HD	On-Demand	Reactive	EPHX2	47	65
O=C(CC1CC1)NNC(=O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000819118273	FE	On-Demand	Reactive	LIPG	46	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819118278	FE	On-Demand	Anodyne	MAPK14	15	44
O=C(CC1CC1)NNC(=O)c1c(O)cccc1Cl	ZINC000819118280	CD	On-Demand	Reactive	TYK2	43	38
CCC(CC)(CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)SC	ZINC000819118288	FH	On-Demand	Anodyne	GPR119	26	42
CCC(CC)(CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)SC	ZINC000819118290	FH	On-Demand	Anodyne	GPR119	26	42
O=C(CC1CC1)NNC(=O)c1ccnc(Oc2ccc(F)cc2F)c1	ZINC000819118299	EF	On-Demand	Reactive	MAPK11	25	40
O=C(CC1CC1)NNC(=O)c1ccnc(Oc2ccc(F)cc2F)c1	ZINC000819118299	EF	On-Demand	Reactive	MAPK14	15	40
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1	ZINC000819118306	ID	On-Demand	Reactive	EPHX2	35	63
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1	ZINC000819118306	ID	On-Demand	Reactive	PKM	44	50
O=C(CC1CC1)NNC(=O)[C@@H](O)Cc1ccccc1	ZINC000819118313	CC	On-Demand	Reactive	ACE	65	37
O=C(CC1CC1)NNC(=O)[C@@H](O)Cc1ccccc1	ZINC000819118313	CC	On-Demand	Reactive	MME	118	38
O=C(CC1CC1)NNC(=O)[C@@H](O)Cc1ccccc1	ZINC000819118313	CC	On-Demand	Reactive	CPA1	43	39
O=C(CC1CC1)NNC(=O)[C@@H](O)Cc1ccccc1	ZINC000819118313	CC	On-Demand	Reactive	TIMP3	40	32
O=C(CC1CC1)NNC(=O)[C@@H](O)Cc1ccccc1	ZINC000819118313	CC	On-Demand	Reactive	CAPNS1	42	33
O=C(CC1CC1)NNC(=O)[C@@H](O)Cc1ccccc1	ZINC000819118313	CC	On-Demand	Reactive	CAPN1	61	35
O=C(CC1CC1)NNC(=O)[C@@H](O)Cc1ccccc1	ZINC000819118313	CC	On-Demand	Reactive	CAPN2	57	33
O=C(CC1CC1)NNC(=O)[C@@H](O)Cc1ccccc1	ZINC000819118313	CC	On-Demand	Reactive	AMP1_PLAFQ	40	40
O=C(CC1CC1)NNC(=O)[C@@H]1CC(=O)N(C2CC2)C1	ZINC000819118316	CB	On-Demand	Reactive	INHA	19	43
O=C(CC1CC1)NNC(=O)[C@H]1CC(=O)N(C2CC2)C1	ZINC000819118317	CB	On-Demand	Reactive	INHA	19	43
O=C(Cc1ccc(OCc2ccccn2)cc1)NNC(=O)CC1CC1	ZINC000819118318	EE	On-Demand	Reactive	SMO	21	42
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	F2	70	45
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	PRSS1	25	43
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	ACE	43	49
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	FKBP1A	81	48
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	OPRM1	31	41
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	OPRD1	19	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	CELA1	35	59
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	GRIN2B	26	43
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	ELANE	37	45
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	CTRA_BOVIN	63	34
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	TRY1_BOVIN	74	37
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	CTSG	44	34
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	CTSK	16	56
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	CPT2	40	34
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	PREP	103	63
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	CELA2A	52	34
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	LGMN	97	57
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	DPP7	28	42
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	KLK5	29	50
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	XIAP	44	41
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	BRCA1	52	32
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	SLC12A5	73	43
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	Q9NAW4_PLAFA	37	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118319	FE	On-Demand	Reactive	TMPRSS11D	67	39
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	F2	70	45
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	PRSS1	25	43
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	ACE	43	49
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	FKBP1A	81	48
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	OPRM1	31	41
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	OPRD1	19	40
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	CELA1	35	59
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	GRIN2B	26	43
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	ELANE	37	45
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	CTRA_BOVIN	63	34
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	TRY1_BOVIN	74	37
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	CTSG	44	34
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	CTSK	16	56
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	CPT2	40	34
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	PREP	103	63
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	CELA2A	52	34
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	LGMN	97	57
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	DPP7	28	42
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	KLK5	29	50
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	XIAP	44	41
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	BRCA1	52	32
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	SLC12A5	73	43
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	Q9NAW4_PLAFA	37	40
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819118320	FE	On-Demand	Reactive	TMPRSS11D	67	39
O=C(CC1CC1)NNC(=O)c1cccnc1Oc1ccc(Cl)cc1Cl	ZINC000819118321	GH	On-Demand	Reactive	UGCG	42	49
O=C(CC1CC1)NNC(=O)c1cccnc1Oc1ccc(Cl)cc1Cl	ZINC000819118321	GH	On-Demand	Reactive	GPBAR1	27	42
CC(C)(C)OC(=O)N1CCC(Cc2ccccc2C(=O)NNC(=O)CC2CC2)CC1	ZINC000819118331	HG	On-Demand	Reactive	CHRM2	15	40
CC(C)(C)OC(=O)N1CCC(Cc2ccccc2C(=O)NNC(=O)CC2CC2)CC1	ZINC000819118331	HG	On-Demand	Reactive	GRIN2B	46	42
CC(C)(C)OC(=O)N1CCC(Cc2ccccc2C(=O)NNC(=O)CC2CC2)CC1	ZINC000819118331	HG	On-Demand	Reactive	CCR8	70	39
CC(C)(C)OC(=O)N1CCC(Cc2ccccc2C(=O)NNC(=O)CC2CC2)CC1	ZINC000819118331	HG	On-Demand	Reactive	GPR119	49	49
O=C(CC1CC1)NNC(=O)c1cccc(S(=O)(=O)NCC2CC2)c1	ZINC000819118357	FC	On-Demand	Reactive	NPY5R	20	46
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000819118363	HE	On-Demand	Reactive	F2	22	40
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000819118363	HE	On-Demand	Reactive	CHRM5	15	41
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000819118363	HE	On-Demand	Reactive	TRY2_BOVIN	63	39
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000819118363	HE	On-Demand	Reactive	EPHX2	40	52
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000819118363	HE	On-Demand	Reactive	PKM	20	45
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000819118363	HE	On-Demand	Reactive	TGM2	60	41
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000819118363	HE	On-Demand	Reactive	F13A1	60	41
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1	ZINC000819118363	HE	On-Demand	Reactive	AKR1C3	18	58
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1	ZINC000819118364	HH	On-Demand	Reactive	NMT1	25	40
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc2ccccc2c1	ZINC000819118365	HH	On-Demand	Reactive	NMT1	25	40
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1	ZINC000819118366	HH	On-Demand	Reactive	NMT1	25	40
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc2ccccc2c1	ZINC000819118367	HH	On-Demand	Reactive	NMT1	25	40
CC(C)(C)OC(=O)N1CCC(Nc2ccccc2)(C(=O)NNC(=O)CC2CC2)CC1	ZINC000819118374	HF	On-Demand	Reactive	GPR119	41	40
CC(C)(C)OC(=O)N1CCC(Nc2ccccc2)(C(=O)NNC(=O)CC2CC2)CC1	ZINC000819118374	HF	On-Demand	Reactive	SFRP1	15	41
COc1ccccc1/C=C(/C(=O)NNC(=O)CC1CC1)c1ccccc1	ZINC000819118398	FG	On-Demand	Reactive	TLR4	20	47
CCOc1ccc(-c2nc(C)c(C(=O)NNC(=O)CC3CC3)s2)cc1	ZINC000819118399	FG	On-Demand	Reactive	PPARG	15	46
CCOc1ccc(-c2nc(C)c(C(=O)NNC(=O)CC3CC3)s2)cc1	ZINC000819118399	FG	On-Demand	Reactive	PPARA	24	43
CCOc1ccc(-c2nc(C)c(C(=O)NNC(=O)CC3CC3)s2)cc1	ZINC000819118399	FG	On-Demand	Reactive	PPARD	37	46
CC(C)(C(=O)NNC(=O)CC1CC1)c1ccc(Cl)cc1	ZINC000819118403	CF	On-Demand	Reactive	CCR1	18	42
O=C(CC1CC1)NNC(=O)c1ccc(OC2CCCCC2)cc1	ZINC000819118404	DF	On-Demand	Reactive	EPHX2	15	40
C[C@H](CCOc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819118413	CE	On-Demand	Reactive	GRIN2B	25	42
C[C@@H](CCOc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819118414	CE	On-Demand	Reactive	GRIN2B	25	42
O=C(CCCCC(=O)c1ccc(F)cc1)NNC(=O)CC1CC1	ZINC000819118423	DF	On-Demand	Reactive	HDAC8	32	40
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(Br)c1	ZINC000819118424	GG	On-Demand	Bother	CACNA1D	51	34
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(Br)c1	ZINC000819118425	GG	On-Demand	Bother	CACNA1D	51	34
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(Br)c1	ZINC000819118426	GG	On-Demand	Bother	CACNA1D	51	34
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(Br)c1	ZINC000819118427	GG	On-Demand	Bother	CACNA1D	51	34
O[C@H](CNC[C@@H]1C[C@@H]1c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000819118460	DH	On-Demand	Anodyne	ADRB1	26	41
O[C@H](CNC[C@@H]1C[C@@H]1c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000819118460	DH	On-Demand	Anodyne	ADRB3	41	41
O[C@H](CNC[C@H]1C[C@H]1c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000819118462	DH	On-Demand	Anodyne	ADRB1	26	41
O[C@H](CNC[C@H]1C[C@H]1c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000819118462	DH	On-Demand	Anodyne	ADRB3	41	41
O[C@H](CNC[C@@H]1C[C@H]1c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000819118464	DH	On-Demand	Anodyne	ADRB1	26	41
O[C@H](CNC[C@@H]1C[C@H]1c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000819118464	DH	On-Demand	Anodyne	ADRB3	41	41
O[C@H](CNC[C@H]1C[C@@H]1c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000819118466	DH	On-Demand	Anodyne	ADRB1	26	41
O[C@H](CNC[C@H]1C[C@@H]1c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000819118466	DH	On-Demand	Anodyne	ADRB3	41	41
O=C(CC1CC1)NNC(=O)c1ccc(-c2cccc(OC(F)(F)F)c2)s1	ZINC000819118469	GH	On-Demand	Reactive	HSD17B2	47	39
O=[S@@]1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819118477	CD	On-Demand	Anodyne	ADRB1	37	46
O=[S@@]1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819118477	CD	On-Demand	Anodyne	ADRB3	53	50
O=[S@@]1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819118477	CD	On-Demand	Anodyne	CYP3A4	46	35
O=[S@@]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819118478	CD	On-Demand	Anodyne	ADRB1	37	46
O=[S@@]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819118478	CD	On-Demand	Anodyne	ADRB3	53	50
O=[S@@]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819118478	CD	On-Demand	Anodyne	CYP3A4	46	35
O=[S@@]1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819118479	CD	On-Demand	Anodyne	ADRB1	37	46
O=[S@@]1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819118479	CD	On-Demand	Anodyne	ADRB3	53	50
O=[S@@]1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819118479	CD	On-Demand	Anodyne	CYP3A4	46	35
O=[S@@]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819118480	CD	On-Demand	Anodyne	ADRB1	37	46
O=[S@@]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819118480	CD	On-Demand	Anodyne	ADRB3	53	50
O=[S@@]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819118480	CD	On-Demand	Anodyne	CYP3A4	46	35
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1	ZINC000819118488	HC	On-Demand	Reactive	EPHX2	35	65
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1	ZINC000819118488	HC	On-Demand	Reactive	PKM	47	55
O=C(CC1CC1)NNC(=O)c1cccc(S(=O)(=O)N2CCc3sccc3C2)c1	ZINC000819118502	HE	On-Demand	Reactive	AKR1C3	76	65
O[C@@H](CNCCn1cccc1)c1cccc(F)c1	ZINC000819118517	BD	On-Demand	Anodyne	ADRB2	20	42
O[C@@H](CNCCn1cccc1)c1cccc(F)c1	ZINC000819118517	BD	On-Demand	Anodyne	ADRB1	21	44
O[C@@H](CNCCn1cccc1)c1cccc(F)c1	ZINC000819118517	BD	On-Demand	Anodyne	ADRB3	40	44
O[C@H](CNCCn1cccc1)c1cccc(F)c1	ZINC000819118519	BD	On-Demand	Anodyne	ADRB2	20	42
O[C@H](CNCCn1cccc1)c1cccc(F)c1	ZINC000819118519	BD	On-Demand	Anodyne	ADRB1	21	44
O[C@H](CNCCn1cccc1)c1cccc(F)c1	ZINC000819118519	BD	On-Demand	Anodyne	ADRB3	40	44
O[C@H](CNC[C@@H]1C[C@@H]1c1ccc(F)cc1)COc1ccccc1	ZINC000819118520	DF	On-Demand	Anodyne	ADRB2	44	50
O[C@H](CNC[C@@H]1C[C@@H]1c1ccc(F)cc1)COc1ccccc1	ZINC000819118520	DF	On-Demand	Anodyne	ADRB1	70	49
O[C@H](CNC[C@@H]1C[C@@H]1c1ccc(F)cc1)COc1ccccc1	ZINC000819118520	DF	On-Demand	Anodyne	ADRB3	41	49
C[C@H](CC(=O)NNC(=O)CC1CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819118521	FF	On-Demand	Reactive	GPR119	39	48
C[C@@H](CC(=O)NNC(=O)CC1CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819118522	FF	On-Demand	Reactive	GPR119	39	48
O[C@H](CNC[C@H]1C[C@H]1c1ccc(F)cc1)COc1ccccc1	ZINC000819118525	DF	On-Demand	Anodyne	ADRB2	44	50
O[C@H](CNC[C@H]1C[C@H]1c1ccc(F)cc1)COc1ccccc1	ZINC000819118525	DF	On-Demand	Anodyne	ADRB1	70	49
O[C@H](CNC[C@H]1C[C@H]1c1ccc(F)cc1)COc1ccccc1	ZINC000819118525	DF	On-Demand	Anodyne	ADRB3	41	49
O[C@H](CNC[C@H]1C[C@@H]1c1ccc(F)cc1)COc1ccccc1	ZINC000819118527	DF	On-Demand	Anodyne	ADRB2	44	50
O[C@H](CNC[C@H]1C[C@@H]1c1ccc(F)cc1)COc1ccccc1	ZINC000819118527	DF	On-Demand	Anodyne	ADRB1	70	49
O[C@H](CNC[C@H]1C[C@@H]1c1ccc(F)cc1)COc1ccccc1	ZINC000819118527	DF	On-Demand	Anodyne	ADRB3	41	49
O[C@H](CNC[C@@H]1C[C@H]1c1ccc(F)cc1)COc1ccccc1	ZINC000819118529	DF	On-Demand	Anodyne	ADRB2	44	50
O[C@H](CNC[C@@H]1C[C@H]1c1ccc(F)cc1)COc1ccccc1	ZINC000819118529	DF	On-Demand	Anodyne	ADRB1	70	49
O[C@H](CNC[C@@H]1C[C@H]1c1ccc(F)cc1)COc1ccccc1	ZINC000819118529	DF	On-Demand	Anodyne	ADRB3	41	49
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118531	GF	On-Demand	Anodyne	ITGAL	77	37
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118531	GF	On-Demand	Anodyne	CACNA1B	54	37
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118531	GF	On-Demand	Anodyne	CCR2	49	42
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118531	GF	On-Demand	Anodyne	RBP4	23	54
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118531	GF	On-Demand	Anodyne	L3MBTL3	40	40
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118531	GF	On-Demand	Anodyne	HPGD	15	40
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118533	GF	On-Demand	Anodyne	ITGAL	77	37
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118533	GF	On-Demand	Anodyne	CACNA1B	54	37
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118533	GF	On-Demand	Anodyne	CCR2	49	42
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118533	GF	On-Demand	Anodyne	RBP4	23	54
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118533	GF	On-Demand	Anodyne	L3MBTL3	40	40
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118533	GF	On-Demand	Anodyne	HPGD	15	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118534	ID	On-Demand	Reactive	MMP13	60	48
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118534	ID	On-Demand	Reactive	ADAM17	45	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118534	ID	On-Demand	Reactive	ITGA4	31	41
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118534	ID	On-Demand	Reactive	CAPNS1	22	45
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118534	ID	On-Demand	Reactive	MMP2	28	45
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118534	ID	On-Demand	Reactive	MMP3	67	48
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118534	ID	On-Demand	Reactive	MMP8	31	41
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118534	ID	On-Demand	Reactive	CAPN1	17	57
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118534	ID	On-Demand	Reactive	MMP9	30	41
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118534	ID	On-Demand	Reactive	MMP7	69	48
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118534	ID	On-Demand	Reactive	MMP1	66	52
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118535	GF	On-Demand	Anodyne	ITGAL	77	37
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118535	GF	On-Demand	Anodyne	CACNA1B	54	37
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118535	GF	On-Demand	Anodyne	CCR2	49	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118535	GF	On-Demand	Anodyne	RBP4	23	54
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118535	GF	On-Demand	Anodyne	L3MBTL3	40	40
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118535	GF	On-Demand	Anodyne	HPGD	15	40
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118536	ID	On-Demand	Reactive	MMP13	60	48
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118536	ID	On-Demand	Reactive	ADAM17	45	40
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118536	ID	On-Demand	Reactive	ITGA4	31	41
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118536	ID	On-Demand	Reactive	CAPNS1	22	45
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118536	ID	On-Demand	Reactive	MMP2	28	45
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118536	ID	On-Demand	Reactive	MMP3	67	48
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118536	ID	On-Demand	Reactive	MMP8	31	41
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118536	ID	On-Demand	Reactive	CAPN1	17	57
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118536	ID	On-Demand	Reactive	MMP9	30	41
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118536	ID	On-Demand	Reactive	MMP7	69	48
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1	ZINC000819118536	ID	On-Demand	Reactive	MMP1	66	52
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118537	GF	On-Demand	Anodyne	ITGAL	77	37
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118537	GF	On-Demand	Anodyne	CACNA1B	54	37
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118537	GF	On-Demand	Anodyne	CCR2	49	42
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118537	GF	On-Demand	Anodyne	RBP4	23	54
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118537	GF	On-Demand	Anodyne	L3MBTL3	40	40
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819118537	GF	On-Demand	Anodyne	HPGD	15	40
O=C(CC1CC1)NNC(=O)[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819118538	DD	On-Demand	Reactive	CCR2	79	41
O=C(CC1CC1)NNC(=O)[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819118539	DD	On-Demand	Reactive	CCR2	79	41
COc1ccc2cc([C@H](C)C(=O)NNC(=O)CC3CC3)ccc2c1	ZINC000819118548	EF	On-Demand	Reactive	MTNR1A	49	39
CS(=O)(=O)c1ccc([C@@H](O)CNCCn2cccc2)cc1	ZINC000819118549	DD	On-Demand	Anodyne	ADRB2	33	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCn2cccc2)cc1	ZINC000819118549	DD	On-Demand	Anodyne	ADRB3	82	40
CS(=O)(=O)c1ccc([C@H](O)CNCCn2cccc2)cc1	ZINC000819118551	DD	On-Demand	Anodyne	ADRB2	33	43
CS(=O)(=O)c1ccc([C@H](O)CNCCn2cccc2)cc1	ZINC000819118551	DD	On-Demand	Anodyne	ADRB3	82	40
CCC(CC)(CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccccc1	ZINC000819118557	GG	On-Demand	Anodyne	ADRB3	28	40
CCC(CC)(CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccccc1	ZINC000819118557	GG	On-Demand	Anodyne	CTSF	51	37
CCC(CC)(CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccccc1	ZINC000819118559	GG	On-Demand	Anodyne	ADRB3	28	40
CCC(CC)(CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccccc1	ZINC000819118559	GG	On-Demand	Anodyne	CTSF	51	37
O[C@@H](CNCCn1cccc1)c1cccc(Br)c1	ZINC000819118560	DF	On-Demand	Anodyne	ADRB2	20	42
O[C@@H](CNCCn1cccc1)c1cccc(Br)c1	ZINC000819118560	DF	On-Demand	Anodyne	ADRB1	22	40
O[C@@H](CNCCn1cccc1)c1cccc(Br)c1	ZINC000819118560	DF	On-Demand	Anodyne	ADRB3	35	42
O[C@H](CNCCn1cccc1)c1cccc(Br)c1	ZINC000819118561	DF	On-Demand	Anodyne	ADRB2	20	42
O[C@H](CNCCn1cccc1)c1cccc(Br)c1	ZINC000819118561	DF	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CNCCn1cccc1)c1cccc(Br)c1	ZINC000819118561	DF	On-Demand	Anodyne	ADRB3	35	42
O[C@H](CNCCn1cccc1)c1cccnc1	ZINC000819118572	BD	On-Demand	Anodyne	ADRB2	34	58
O[C@H](CNCCn1cccc1)c1cccnc1	ZINC000819118572	BD	On-Demand	Anodyne	ADRB1	36	52
O[C@H](CNCCn1cccc1)c1cccnc1	ZINC000819118572	BD	On-Demand	Anodyne	ADRB3	119	59
O[C@@H](CNCCn1cccc1)c1cccnc1	ZINC000819118574	BD	On-Demand	Anodyne	ADRB2	34	58
O[C@@H](CNCCn1cccc1)c1cccnc1	ZINC000819118574	BD	On-Demand	Anodyne	ADRB1	36	52
O[C@@H](CNCCn1cccc1)c1cccnc1	ZINC000819118574	BD	On-Demand	Anodyne	ADRB3	119	59
C[C@@H](CC(=O)NNC(=O)CC1CC1)c1cccnc1	ZINC000819118578	CD	On-Demand	Reactive	KCNA5	28	47
C[C@H](CC(=O)NNC(=O)CC1CC1)c1cccnc1	ZINC000819118579	CD	On-Demand	Reactive	KCNA5	28	47
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(Br)c(F)c1	ZINC000819118588	IF	On-Demand	Reactive	PREP	32	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(Br)c(F)c1	ZINC000819118588	IF	On-Demand	Reactive	LGMN	46	34
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)c1ccc(Br)c(F)c1	ZINC000819118592	IF	On-Demand	Reactive	PREP	32	40
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)c1ccc(Br)c(F)c1	ZINC000819118592	IF	On-Demand	Reactive	LGMN	46	34
COc1cc(C(=O)NNC(=O)CC2CC2)cc(Cl)c1O	ZINC000819118616	CD	On-Demand	Reactive	CACNA1I	49	35
Cc1cc(F)ccc1S(=O)(=O)Nc1ccccc1C(=O)NNC(=O)CC1CC1	ZINC000819118618	HE	On-Demand	Reactive	CCR8	73	38
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819118619	HE	On-Demand	Reactive	HCN1	49	34
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819118619	HE	On-Demand	Reactive	HCN4	43	34
O=C(CC1CC1)NNC(=O)C1(Cc2ccccc2)CCC1	ZINC000819118622	CE	On-Demand	Reactive	SLC12A5	49	37
O=C(CC1CC1)NNC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1	ZINC000819118628	IF	On-Demand	Reactive	SGK1	45	32
O=C(Cc1ccc(NC(=O)c2cccc(Br)c2)cc1)NNC(=O)CC1CC1	ZINC000819118632	IG	On-Demand	Reactive	KCNK3	70	34
O=C(CCn1ccnc1)NNC(=O)CC1CC1	ZINC000819118634	BC	On-Demand	Reactive	TBXAS1	42	44
CCCOc1ccc(C(=O)CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819118638	EE	On-Demand	Reactive	PLA2G4B	62	35
O=C(CC1CC1)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1Cl	ZINC000819118640	FD	On-Demand	Reactive	CDK1	18	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(OC)c(OCC(N)=O)c1)C2	ZINC000819118668	GD	On-Demand	Anodyne	ENPP1	70	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(OC)c(OCC(N)=O)c1)C2	ZINC000819118669	GD	On-Demand	Anodyne	ENPP1	70	33
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819118673	EG	On-Demand	Anodyne	ADRB2	17	43
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819118673	EG	On-Demand	Anodyne	ADRB3	26	41
COc1ccc(O[C@@H](C)CNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819118675	EG	On-Demand	Anodyne	ADRB2	17	43
COc1ccc(O[C@@H](C)CNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819118675	EG	On-Demand	Anodyne	ADRB3	26	41
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)c1	ZINC000819118677	FE	On-Demand	Bother	ADRB1	20	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)c1	ZINC000819118678	FE	On-Demand	Bother	ADRB1	20	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)c1	ZINC000819118679	FE	On-Demand	Bother	ADRB1	20	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)c1	ZINC000819118680	FE	On-Demand	Bother	ADRB1	20	43
O[C@@H](CNC[C@@H]1OCCc2sccc21)COc1cccc2ccccc12	ZINC000819118685	FH	On-Demand	Anodyne	ADRB2	25	52
O[C@@H](CNC[C@@H]1OCCc2sccc21)COc1cccc2ccccc12	ZINC000819118685	FH	On-Demand	Anodyne	ADRB1	43	35
O[C@@H](CNC[C@H]1OCCc2sccc21)COc1cccc2ccccc12	ZINC000819118686	FH	On-Demand	Anodyne	ADRB2	25	52
O[C@@H](CNC[C@H]1OCCc2sccc21)COc1cccc2ccccc12	ZINC000819118686	FH	On-Demand	Anodyne	ADRB1	43	35
O[C@H](CNC[C@H]1OCCc2sccc21)COc1cccc2ccccc12	ZINC000819118687	FH	On-Demand	Anodyne	ADRB2	25	52
O[C@H](CNC[C@H]1OCCc2sccc21)COc1cccc2ccccc12	ZINC000819118687	FH	On-Demand	Anodyne	ADRB1	43	35
O[C@H](CNC[C@@H]1OCCc2sccc21)COc1cccc2ccccc12	ZINC000819118688	FH	On-Demand	Anodyne	ADRB2	25	52
O[C@H](CNC[C@@H]1OCCc2sccc21)COc1cccc2ccccc12	ZINC000819118688	FH	On-Demand	Anodyne	ADRB1	43	35
COCCc1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819118697	GF	On-Demand	Anodyne	ADRB2	38	50
COCCc1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819118697	GF	On-Demand	Anodyne	ADRB1	66	50
COCCc1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819118697	GF	On-Demand	Anodyne	ADRB3	43	44
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819118698	GF	On-Demand	Anodyne	ADRB2	38	50
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819118698	GF	On-Demand	Anodyne	ADRB1	66	50
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819118698	GF	On-Demand	Anodyne	ADRB3	43	44
COCCc1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819118699	GF	On-Demand	Anodyne	ADRB2	38	50
COCCc1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819118699	GF	On-Demand	Anodyne	ADRB1	66	50
COCCc1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819118699	GF	On-Demand	Anodyne	ADRB3	43	44
COCCc1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819118700	GF	On-Demand	Anodyne	ADRB2	38	50
COCCc1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819118700	GF	On-Demand	Anodyne	ADRB1	66	50
COCCc1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819118700	GF	On-Demand	Anodyne	ADRB3	43	44
NC(=O)COc1cccc(CNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819118709	FE	On-Demand	Anodyne	ADRB1	21	40
NC(=O)COc1cccc(CNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819118709	FE	On-Demand	Anodyne	NR1H3	27	41
NC(=O)COc1cccc(CNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819118709	FE	On-Demand	Anodyne	PDS	66	38
NC(=O)COc1cccc(CNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819118710	FE	On-Demand	Anodyne	ADRB1	21	40
NC(=O)COc1cccc(CNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819118710	FE	On-Demand	Anodyne	NR1H3	27	41
NC(=O)COc1cccc(CNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819118710	FE	On-Demand	Anodyne	PDS	66	38
N#Cc1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819118711	EE	On-Demand	Mild	ADRB1	44	35
N#Cc1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819118712	EE	On-Demand	Mild	ADRB1	44	35
N#Cc1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819118713	EE	On-Demand	Mild	ADRB1	44	35
N#Cc1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819118714	EE	On-Demand	Mild	ADRB1	44	35
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(/C=C\C(=O)OC)cc2)C1	ZINC000819118715	GC	On-Demand	Anodyne	F13A1	46	38
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(/C=C\C(=O)OC)cc2)C1	ZINC000819118716	GC	On-Demand	Anodyne	F13A1	46	38
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(/C=C/C(=O)OC)cc2)C1	ZINC000819118717	GC	On-Demand	Anodyne	F13A1	46	38
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(/C=C/C(=O)OC)cc2)C1	ZINC000819118718	GC	On-Demand	Anodyne	F13A1	46	38
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819118719	GE	On-Demand	Anodyne	ADRB2	40	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819118719	GE	On-Demand	Anodyne	ADRB1	65	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819118719	GE	On-Demand	Anodyne	ADRB3	39	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819118720	GE	On-Demand	Anodyne	ADRB2	40	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819118720	GE	On-Demand	Anodyne	ADRB1	65	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819118720	GE	On-Demand	Anodyne	ADRB3	39	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819118721	GE	On-Demand	Anodyne	ADRB2	40	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819118721	GE	On-Demand	Anodyne	ADRB1	65	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819118721	GE	On-Demand	Anodyne	ADRB3	39	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819118722	GE	On-Demand	Anodyne	ADRB2	40	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819118722	GE	On-Demand	Anodyne	ADRB1	65	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819118722	GE	On-Demand	Anodyne	ADRB3	39	42
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819118727	EG	On-Demand	Anodyne	ADRB2	36	48
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819118727	EG	On-Demand	Anodyne	ADRB1	49	48
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819118727	EG	On-Demand	Anodyne	ADRB3	71	51
COc1ccc(O[C@@H](C)CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819118728	EG	On-Demand	Anodyne	ADRB2	36	48
COc1ccc(O[C@@H](C)CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819118728	EG	On-Demand	Anodyne	ADRB1	49	48
COc1ccc(O[C@@H](C)CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819118728	EG	On-Demand	Anodyne	ADRB3	71	51
CCC(CC)(CNC[C@H](O)COc1cccc2[nH]ccc12)SC	ZINC000819118748	EG	On-Demand	Anodyne	ADRB2	22	61
CCC(CC)(CNC[C@H](O)COc1cccc2[nH]ccc12)SC	ZINC000819118748	EG	On-Demand	Anodyne	ADRB1	38	61
CCC(CC)(CNC[C@H](O)COc1cccc2[nH]ccc12)SC	ZINC000819118748	EG	On-Demand	Anodyne	CYP2D6	17	45
CCC(CC)(CNC[C@@H](O)COc1cccc2[nH]ccc12)SC	ZINC000819118749	EG	On-Demand	Anodyne	ADRB2	22	61
CCC(CC)(CNC[C@@H](O)COc1cccc2[nH]ccc12)SC	ZINC000819118749	EG	On-Demand	Anodyne	ADRB1	38	61
CCC(CC)(CNC[C@@H](O)COc1cccc2[nH]ccc12)SC	ZINC000819118749	EG	On-Demand	Anodyne	CYP2D6	17	45
CC[C@@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1c(C)nn(C)c1C	ZINC000819118750	GG	On-Demand	Anodyne	GPR119	28	40
CC[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1c(C)nn(C)c1C	ZINC000819118751	GG	On-Demand	Anodyne	GPR119	28	40
O[C@@H](CNCCn1cccc1)c1ccc(F)cc1	ZINC000819118756	BD	On-Demand	Anodyne	ADRB2	18	43
O[C@H](CNCCn1cccc1)c1ccc(F)cc1	ZINC000819118757	BD	On-Demand	Anodyne	ADRB2	18	43
O=[N+]([O-])c1cccc([C@@H](O)CNCCn2cccc2)c1	ZINC000819118761	CD	On-Demand	Bother	ADRB3	37	41
O=[N+]([O-])c1cccc([C@H](O)CNCCn2cccc2)c1	ZINC000819118762	CD	On-Demand	Bother	ADRB3	37	41
CCC(CC)(CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819118763	CG	On-Demand	Anodyne	ADRB2	22	44
CCC(CC)(CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819118763	CG	On-Demand	Anodyne	ADRB1	25	44
CCC(CC)(CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819118763	CG	On-Demand	Anodyne	ADRB3	94	45
CCC(CC)(CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819118763	CG	On-Demand	Anodyne	KCNA5	26	43
CCC(CC)(CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819118764	CG	On-Demand	Anodyne	ADRB2	22	44
CCC(CC)(CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819118764	CG	On-Demand	Anodyne	ADRB1	25	44
CCC(CC)(CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819118764	CG	On-Demand	Anodyne	ADRB3	94	45
CCC(CC)(CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819118764	CG	On-Demand	Anodyne	KCNA5	26	43
O[C@H](CNC[C@H]1C[C@H]1c1ccc(F)cc1)COc1ccc(F)cc1	ZINC000819118773	EG	On-Demand	Anodyne	ADRB2	35	42
O[C@H](CNC[C@H]1C[C@H]1c1ccc(F)cc1)COc1ccc(F)cc1	ZINC000819118773	EG	On-Demand	Anodyne	ADRB1	59	43
O[C@H](CNC[C@H]1C[C@H]1c1ccc(F)cc1)COc1ccc(F)cc1	ZINC000819118773	EG	On-Demand	Anodyne	ADRB3	34	42
O[C@H](CNC[C@H]1C[C@@H]1c1ccc(F)cc1)COc1ccc(F)cc1	ZINC000819118774	EG	On-Demand	Anodyne	ADRB2	35	42
O[C@H](CNC[C@H]1C[C@@H]1c1ccc(F)cc1)COc1ccc(F)cc1	ZINC000819118774	EG	On-Demand	Anodyne	ADRB1	59	43
O[C@H](CNC[C@H]1C[C@@H]1c1ccc(F)cc1)COc1ccc(F)cc1	ZINC000819118774	EG	On-Demand	Anodyne	ADRB3	34	42
O[C@H](CNC[C@@H]1C[C@@H]1c1ccc(F)cc1)COc1ccc(F)cc1	ZINC000819118775	EG	On-Demand	Anodyne	ADRB2	35	42
O[C@H](CNC[C@@H]1C[C@@H]1c1ccc(F)cc1)COc1ccc(F)cc1	ZINC000819118775	EG	On-Demand	Anodyne	ADRB1	59	43
O[C@H](CNC[C@@H]1C[C@@H]1c1ccc(F)cc1)COc1ccc(F)cc1	ZINC000819118775	EG	On-Demand	Anodyne	ADRB3	34	42
O[C@H](CNC[C@@H]1C[C@H]1c1ccc(F)cc1)COc1ccc(F)cc1	ZINC000819118776	EG	On-Demand	Anodyne	ADRB2	35	42
O[C@H](CNC[C@@H]1C[C@H]1c1ccc(F)cc1)COc1ccc(F)cc1	ZINC000819118776	EG	On-Demand	Anodyne	ADRB1	59	43
O[C@H](CNC[C@@H]1C[C@H]1c1ccc(F)cc1)COc1ccc(F)cc1	ZINC000819118776	EG	On-Demand	Anodyne	ADRB3	34	42
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(Br)c1	ZINC000819118778	FH	On-Demand	Anodyne	ADRB1	40	43
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(Br)c1	ZINC000819118778	FH	On-Demand	Anodyne	ADRB3	56	41
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(Br)c1	ZINC000819118778	FH	On-Demand	Anodyne	AOC3	15	40
C[C@H](CNC[C@H](O)c1ccccc1)Oc1cccc(Br)c1	ZINC000819118779	FH	On-Demand	Anodyne	ADRB1	40	43
C[C@H](CNC[C@H](O)c1ccccc1)Oc1cccc(Br)c1	ZINC000819118779	FH	On-Demand	Anodyne	ADRB3	56	41
C[C@H](CNC[C@H](O)c1ccccc1)Oc1cccc(Br)c1	ZINC000819118779	FH	On-Demand	Anodyne	AOC3	15	40
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1cccc(Br)c1	ZINC000819118780	FH	On-Demand	Anodyne	ADRB1	40	43
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1cccc(Br)c1	ZINC000819118780	FH	On-Demand	Anodyne	ADRB3	56	41
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1cccc(Br)c1	ZINC000819118780	FH	On-Demand	Anodyne	AOC3	15	40
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(Br)c1	ZINC000819118781	FH	On-Demand	Anodyne	ADRB1	40	43
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(Br)c1	ZINC000819118781	FH	On-Demand	Anodyne	ADRB3	56	41
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(Br)c1	ZINC000819118781	FH	On-Demand	Anodyne	AOC3	15	40
CCOC(=O)N[C@H]1CCCN(C(=O)C[S@](=O)c2cccc(OC)c2)C1	ZINC000819118847	FD	On-Demand	Anodyne	MTNR1B	15	43
CCOC(=O)N[C@H]1CCCN(C(=O)C[S@@](=O)c2cccc(OC)c2)C1	ZINC000819118850	FD	On-Demand	Anodyne	MTNR1B	15	43
CCCNC(=O)c1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819118853	DF	On-Demand	Anodyne	DRD4	42	32
O[C@@H](CNCCn1cccc1)c1ccc(Cl)cc1	ZINC000819118898	CE	On-Demand	Anodyne	ADRB2	17	43
O[C@@H](CNCCn1cccc1)c1ccc(Cl)cc1	ZINC000819118898	CE	On-Demand	Anodyne	ADRB1	21	40
O[C@@H](CNCCn1cccc1)c1ccc(Cl)cc1	ZINC000819118898	CE	On-Demand	Anodyne	ADRB3	28	40
O[C@@H](CNCCn1cccc1)c1ccc(OC(F)(F)F)cc1	ZINC000819118918	DF	On-Demand	Anodyne	ADRB2	23	40
O[C@@H](CNCCn1cccc1)c1ccc(OC(F)(F)F)cc1	ZINC000819118918	DF	On-Demand	Anodyne	ADRB3	31	47
O[C@H](CNCCn1cccc1)c1ccc(OC(F)(F)F)cc1	ZINC000819118922	DF	On-Demand	Anodyne	ADRB2	23	40
O[C@H](CNCCn1cccc1)c1ccc(OC(F)(F)F)cc1	ZINC000819118922	DF	On-Demand	Anodyne	ADRB3	31	47
O[C@H](CNC[C@@H]1OCCc2sccc21)COc1cccc2[nH]ccc12	ZINC000819118931	FF	On-Demand	Anodyne	ADRB1	21	52
O[C@H](CNC[C@H]1OCCc2sccc21)COc1cccc2[nH]ccc12	ZINC000819118933	FF	On-Demand	Anodyne	ADRB1	21	52
O[C@@H](CNC[C@H]1OCCc2sccc21)COc1cccc2[nH]ccc12	ZINC000819118935	FF	On-Demand	Anodyne	ADRB1	21	52
O[C@@H](CNC[C@@H]1OCCc2sccc21)COc1cccc2[nH]ccc12	ZINC000819118937	FF	On-Demand	Anodyne	ADRB1	21	52
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccc(C(=O)NC3CC3)c1)C2	ZINC000819118958	GE	On-Demand	Anodyne	CCR2	54	37
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCC2CC2)CC1	ZINC000819118959	DE	On-Demand	Anodyne	GPR119	37	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccc(C(=O)NC3CC3)c1)C2	ZINC000819118960	GE	On-Demand	Anodyne	CCR2	54	37
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCC2CC2)CC1	ZINC000819118961	DE	On-Demand	Anodyne	GPR119	37	44
O[C@H](CNCCC1CC1)c1cccc(Cl)c1	ZINC000819118969	BF	On-Demand	Anodyne	ADRB2	48	40
O[C@H](CNCCC1CC1)c1cccc(Cl)c1	ZINC000819118969	BF	On-Demand	Anodyne	ADRB1	65	54
O[C@H](CNCCC1CC1)c1cccc(Cl)c1	ZINC000819118969	BF	On-Demand	Anodyne	ADRB3	83	54
O[C@@H](CNCCC1CC1)c1cccc(Cl)c1	ZINC000819118971	BF	On-Demand	Anodyne	ADRB2	48	40
O[C@@H](CNCCC1CC1)c1cccc(Cl)c1	ZINC000819118971	BF	On-Demand	Anodyne	ADRB1	65	54
O[C@@H](CNCCC1CC1)c1cccc(Cl)c1	ZINC000819118971	BF	On-Demand	Anodyne	ADRB3	83	54
O=[N+]([O-])c1cccc([C@H](O)CNCCC2CC2)c1	ZINC000819119023	CE	On-Demand	Bother	ADRB3	54	38
O=[N+]([O-])c1cccc([C@@H](O)CNCCC2CC2)c1	ZINC000819119024	CE	On-Demand	Bother	ADRB3	54	38
O[C@@H](CNCCn1cccc1)c1ccc(Br)cc1	ZINC000819119048	DF	On-Demand	Anodyne	ADRB2	16	48
O[C@H](CNCCn1cccc1)c1ccc(Br)cc1	ZINC000819119049	DF	On-Demand	Anodyne	ADRB2	16	48
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(Br)c1	ZINC000819119098	FF	On-Demand	Anodyne	ADRB2	27	46
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(Br)c1	ZINC000819119098	FF	On-Demand	Anodyne	ADRB1	39	49
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(Br)c1	ZINC000819119098	FF	On-Demand	Anodyne	ADRB3	101	49
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(Br)c1	ZINC000819119098	FF	On-Demand	Anodyne	KCNA5	17	46
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(Br)c1	ZINC000819119099	FF	On-Demand	Anodyne	ADRB2	27	46
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(Br)c1	ZINC000819119099	FF	On-Demand	Anodyne	ADRB1	39	49
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(Br)c1	ZINC000819119099	FF	On-Demand	Anodyne	ADRB3	101	49
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(Br)c1	ZINC000819119099	FF	On-Demand	Anodyne	KCNA5	17	46
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(Br)c1	ZINC000819119100	FF	On-Demand	Anodyne	ADRB2	27	46
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(Br)c1	ZINC000819119100	FF	On-Demand	Anodyne	ADRB1	39	49
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(Br)c1	ZINC000819119100	FF	On-Demand	Anodyne	ADRB3	101	49
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(Br)c1	ZINC000819119100	FF	On-Demand	Anodyne	KCNA5	17	46
C[C@H](CNC[C@H](O)c1cccnc1)Oc1cccc(Br)c1	ZINC000819119101	FF	On-Demand	Anodyne	ADRB2	27	46
C[C@H](CNC[C@H](O)c1cccnc1)Oc1cccc(Br)c1	ZINC000819119101	FF	On-Demand	Anodyne	ADRB1	39	49
C[C@H](CNC[C@H](O)c1cccnc1)Oc1cccc(Br)c1	ZINC000819119101	FF	On-Demand	Anodyne	ADRB3	101	49
C[C@H](CNC[C@H](O)c1cccnc1)Oc1cccc(Br)c1	ZINC000819119101	FF	On-Demand	Anodyne	KCNA5	17	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2nnnn2C2CC2)CC1	ZINC000819119143	FD	On-Demand	Anodyne	GPR119	28	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2nnnn2C2CC2)CC1	ZINC000819119144	FD	On-Demand	Anodyne	GPR119	28	43
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2cc(C(C)=O)ccc2Cl)C1	ZINC000819119158	GD	On-Demand	Anodyne	TRPV4	47	38
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2cc(C(C)=O)ccc2Cl)C1	ZINC000819119159	GD	On-Demand	Anodyne	TRPV4	47	38
O[C@H](CNCCC1CC1)c1ccc(Cl)c(F)c1	ZINC000819119192	CF	On-Demand	Anodyne	ADRB2	18	40
O[C@H](CNCCC1CC1)c1ccc(Cl)c(F)c1	ZINC000819119192	CF	On-Demand	Anodyne	ADRB1	19	40
O[C@@H](CNCCC1CC1)c1ccc(Cl)c(F)c1	ZINC000819119193	CF	On-Demand	Anodyne	ADRB2	18	40
O[C@@H](CNCCC1CC1)c1ccc(Cl)c(F)c1	ZINC000819119193	CF	On-Demand	Anodyne	ADRB1	19	40
O[C@H](CNC[C@H]1OCCc2sccc21)COc1ccc(Cl)c(Cl)c1	ZINC000819119199	GH	On-Demand	Anodyne	GRIN1	22	45
O[C@H](CNC[C@@H]1OCCc2sccc21)COc1ccc(Cl)c(Cl)c1	ZINC000819119201	GH	On-Demand	Anodyne	GRIN1	22	45
O[C@@H](CNC[C@H]1OCCc2sccc21)COc1ccc(Cl)c(Cl)c1	ZINC000819119203	GH	On-Demand	Anodyne	GRIN1	22	45
O[C@@H](CNC[C@@H]1OCCc2sccc21)COc1ccc(Cl)c(Cl)c1	ZINC000819119204	GH	On-Demand	Anodyne	GRIN1	22	45
O[C@@H](CNC[C@H]1OCCc2sccc21)COc1ccccc1F	ZINC000819119236	EF	On-Demand	Anodyne	ADRB1	52	37
O[C@@H](CNC[C@@H]1OCCc2sccc21)COc1ccccc1F	ZINC000819119239	EF	On-Demand	Anodyne	ADRB1	52	37
O[C@H](CNC[C@H]1OCCc2sccc21)COc1ccccc1F	ZINC000819119241	EF	On-Demand	Anodyne	ADRB1	52	37
O[C@H](CNC[C@@H]1OCCc2sccc21)COc1ccccc1F	ZINC000819119243	EF	On-Demand	Anodyne	ADRB1	52	37
CCCNC(=O)c1cccc(CNC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)c1	ZINC000819119256	GE	On-Demand	Anodyne	DRD4	40	30
CCCNC(=O)c1cccc(CNC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)c1	ZINC000819119258	GE	On-Demand	Anodyne	DRD4	40	30
O[C@@H](CNCc1nnnn1C1CC1)c1ccccc1Cl	ZINC000819119265	CD	On-Demand	Anodyne	OPRL1	43	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819119275	GF	On-Demand	Anodyne	ADRB2	41	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819119275	GF	On-Demand	Anodyne	ADRB1	72	44
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819119275	GF	On-Demand	Anodyne	ADRB3	49	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819119275	GF	On-Demand	Anodyne	ABCB1	22	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819119277	GF	On-Demand	Anodyne	ADRB2	41	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819119277	GF	On-Demand	Anodyne	ADRB1	72	44
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819119277	GF	On-Demand	Anodyne	ADRB3	49	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819119277	GF	On-Demand	Anodyne	ABCB1	22	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819119280	GF	On-Demand	Anodyne	ADRB2	41	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819119280	GF	On-Demand	Anodyne	ADRB1	72	44
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819119280	GF	On-Demand	Anodyne	ADRB3	49	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819119280	GF	On-Demand	Anodyne	ABCB1	22	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819119282	GF	On-Demand	Anodyne	ADRB2	41	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819119282	GF	On-Demand	Anodyne	ADRB1	72	44
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819119282	GF	On-Demand	Anodyne	ADRB3	49	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819119282	GF	On-Demand	Anodyne	ABCB1	22	43
CCC(=O)Nc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819119289	GH	On-Demand	Mild	PAPA1_CARPA	47	51
CCC(=O)Nc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819119289	GH	On-Demand	Mild	CTSK	26	46
CCC(=O)Nc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819119289	GH	On-Demand	Mild	HDAC8	21	44
CCC(=O)Nc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819119289	GH	On-Demand	Mild	HDAC11	41	33
CCC(=O)Nc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819119289	GH	On-Demand	Mild	FPR1	43	39
CCC(=O)Nc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819119291	GH	On-Demand	Mild	PAPA1_CARPA	47	51
CCC(=O)Nc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819119291	GH	On-Demand	Mild	CTSK	26	46
CCC(=O)Nc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819119291	GH	On-Demand	Mild	HDAC8	21	44
CCC(=O)Nc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819119291	GH	On-Demand	Mild	HDAC11	41	33
CCC(=O)Nc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819119291	GH	On-Demand	Mild	FPR1	43	39
CCOC(=O)N[C@H]1CCCN(C(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819119307	FD	On-Demand	Anodyne	HRH3	15	40
CCOC(=O)N[C@H]1CCCN(C(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819119307	FD	On-Demand	Anodyne	BIRC2	25	42
CCOC(=O)N[C@H]1CCCN(C(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)C1	ZINC000819119328	GH	On-Demand	Anodyne	P2RY12	87	36
CCOC(=O)N[C@H]1CCCN(C(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)C1	ZINC000819119328	GH	On-Demand	Anodyne	CCKAR	40	33
CCOC(=O)N[C@H]1CCCN(C(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)C1	ZINC000819119328	GH	On-Demand	Anodyne	FAAH	20	40
O[C@@H](CNCCn1cccc1)c1ccc(Cl)cc1Cl	ZINC000819119339	CG	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CNCCn1cccc1)c1ccc(Cl)cc1Cl	ZINC000819119339	CG	On-Demand	Anodyne	ADRB3	17	40
O[C@H](CNCCn1cccc1)c1ccc(Cl)cc1Cl	ZINC000819119340	CG	On-Demand	Anodyne	ADRB1	20	40
O[C@H](CNCCn1cccc1)c1ccc(Cl)cc1Cl	ZINC000819119340	CG	On-Demand	Anodyne	ADRB3	17	40
O[C@@H](CNCCn1cccc1)c1cccc(C(F)(F)F)c1	ZINC000819119343	CF	On-Demand	Anodyne	ADRB2	16	40
O[C@@H](CNCCn1cccc1)c1cccc(C(F)(F)F)c1	ZINC000819119343	CF	On-Demand	Anodyne	ADRB3	29	40
O[C@H](CNCCn1cccc1)c1cccc(C(F)(F)F)c1	ZINC000819119344	CF	On-Demand	Anodyne	ADRB2	16	40
O[C@H](CNCCn1cccc1)c1cccc(C(F)(F)F)c1	ZINC000819119344	CF	On-Demand	Anodyne	ADRB3	29	40
O[C@H](CNCc1nnnn1C1CC1)c1cccc(Cl)c1	ZINC000819119350	CD	On-Demand	Anodyne	ADRB3	40	41
O[C@H](CNCc1nnnn1C1CC1)c1cccc(Cl)c1	ZINC000819119350	CD	On-Demand	Anodyne	CYP3A4	46	34
O[C@@H](CNCc1nnnn1C1CC1)c1cccc(Cl)c1	ZINC000819119351	CD	On-Demand	Anodyne	ADRB3	40	41
O[C@@H](CNCc1nnnn1C1CC1)c1cccc(Cl)c1	ZINC000819119351	CD	On-Demand	Anodyne	CYP3A4	46	34
COc1ccc(OC)c([C@H](O)CNCCn2cccc2)c1	ZINC000819119386	CD	On-Demand	Anodyne	ADRB2	23	48
CCC(CC)(CNC[C@H](O)c1cccc(Cl)c1)SC	ZINC000819119387	DH	On-Demand	Anodyne	ADRB1	32	46
CCC(CC)(CNC[C@H](O)c1cccc(Cl)c1)SC	ZINC000819119387	DH	On-Demand	Anodyne	ADRB3	48	46
CCC(CC)(CNC[C@@H](O)c1cccc(Cl)c1)SC	ZINC000819119388	DH	On-Demand	Anodyne	ADRB1	32	46
CCC(CC)(CNC[C@@H](O)c1cccc(Cl)c1)SC	ZINC000819119388	DH	On-Demand	Anodyne	ADRB3	48	46
O=C(CCN1CCOCC1)Nc1cc(NC(=O)C(F)=C2CCC2)ccc1F	ZINC000819119389	GF	On-Demand	Anodyne	CHRNA7	15	42
O=C(CCN1CCOCC1)Nc1cc(NC(=O)C(F)=C2CCC2)ccc1F	ZINC000819119389	GF	On-Demand	Anodyne	EPHX2	24	44
O[C@@H](CNCCn1cccc1)c1cccc(Cl)c1	ZINC000819119396	CE	On-Demand	Anodyne	ADRB2	44	38
O[C@@H](CNCCn1cccc1)c1cccc(Cl)c1	ZINC000819119396	CE	On-Demand	Anodyne	ADRB1	54	57
O[C@@H](CNCCn1cccc1)c1cccc(Cl)c1	ZINC000819119396	CE	On-Demand	Anodyne	ADRB3	73	57
O[C@H](CNCCn1cccc1)c1cccc(Cl)c1	ZINC000819119397	CE	On-Demand	Anodyne	ADRB2	44	38
O[C@H](CNCCn1cccc1)c1cccc(Cl)c1	ZINC000819119397	CE	On-Demand	Anodyne	ADRB1	54	57
O[C@H](CNCCn1cccc1)c1cccc(Cl)c1	ZINC000819119397	CE	On-Demand	Anodyne	ADRB3	73	57
CC(=O)Nc1cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1C	ZINC000819119417	GG	On-Demand	Mild	PAPA1_CARPA	45	43
CC(=O)Nc1cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1C	ZINC000819119418	GG	On-Demand	Mild	PAPA1_CARPA	45	43
O[C@@H](CNC[C@@H]1OCCc2sccc21)COc1ccc(Br)cc1	ZINC000819119447	GG	On-Demand	Anodyne	ADRB1	42	40
O[C@H](CNC[C@@H]1OCCc2sccc21)COc1ccc(Br)cc1	ZINC000819119448	GG	On-Demand	Anodyne	ADRB1	42	40
O[C@H](CNC[C@H]1OCCc2sccc21)COc1ccc(Br)cc1	ZINC000819119449	GG	On-Demand	Anodyne	ADRB1	42	40
O[C@@H](CNC[C@H]1OCCc2sccc21)COc1ccc(Br)cc1	ZINC000819119450	GG	On-Demand	Anodyne	ADRB1	42	40
CCOc1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819119474	FF	On-Demand	Anodyne	ADRB1	50	37
CCOc1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819119475	FF	On-Demand	Anodyne	ADRB1	50	37
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819119476	FF	On-Demand	Anodyne	ADRB1	50	37
CCOc1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819119477	FF	On-Demand	Anodyne	ADRB1	50	37
NC(=O)COc1cccc(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819119485	FE	On-Demand	Anodyne	ADRB1	22	41
NC(=O)COc1cccc(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819119485	FE	On-Demand	Anodyne	PDS	54	41
NC(=O)COc1cccc(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819119486	FE	On-Demand	Anodyne	ADRB1	22	41
NC(=O)COc1cccc(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819119486	FE	On-Demand	Anodyne	PDS	54	41
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CC3)cc2)C1	ZINC000819119531	FD	On-Demand	Anodyne	MMP13	55	39
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CC3)cc2)C1	ZINC000819119531	FD	On-Demand	Anodyne	APP	40	35
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CC3)cc2)C1	ZINC000819119531	FD	On-Demand	Anodyne	ADAM17	39	40
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CC3)cc2)C1	ZINC000819119531	FD	On-Demand	Anodyne	MMP3	44	36
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CC3)cc2)C1	ZINC000819119531	FD	On-Demand	Anodyne	MMP7	45	36
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CC3)cc2)C1	ZINC000819119531	FD	On-Demand	Anodyne	MMP1	45	36
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CC3)cc2)C1	ZINC000819119532	FD	On-Demand	Anodyne	MMP13	55	39
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CC3)cc2)C1	ZINC000819119532	FD	On-Demand	Anodyne	APP	40	35
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CC3)cc2)C1	ZINC000819119532	FD	On-Demand	Anodyne	ADAM17	39	40
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CC3)cc2)C1	ZINC000819119532	FD	On-Demand	Anodyne	MMP3	44	36
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CC3)cc2)C1	ZINC000819119532	FD	On-Demand	Anodyne	MMP7	45	36
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(OC3CC3)cc2)C1	ZINC000819119532	FD	On-Demand	Anodyne	MMP1	45	36
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(NC(=O)OC)cc2)C1	ZINC000819119533	FC	On-Demand	Anodyne	TGM2	69	44
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(NC(=O)OC)cc2)C1	ZINC000819119533	FC	On-Demand	Anodyne	F13A1	103	45
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(NC(=O)OC)cc2)C1	ZINC000819119533	FC	On-Demand	Anodyne	NAMPT	37	42
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(NC(=O)OC)cc2)C1	ZINC000819119534	FC	On-Demand	Anodyne	TGM2	69	44
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(NC(=O)OC)cc2)C1	ZINC000819119534	FC	On-Demand	Anodyne	F13A1	103	45
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2ccc(NC(=O)OC)cc2)C1	ZINC000819119534	FC	On-Demand	Anodyne	NAMPT	37	42
COc1ccc(O[C@@H](C)CNC[C@@H](O)c2ccc(C)cc2)cc1	ZINC000819119543	DG	On-Demand	Anodyne	ADRB3	16	41
COc1ccc(O[C@@H](C)CNC[C@H](O)c2ccc(C)cc2)cc1	ZINC000819119544	DG	On-Demand	Anodyne	ADRB3	16	41
CCOC(=O)N[C@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819119567	GE	On-Demand	Mild	PAPA1_CARPA	31	40
CCOC(=O)N[C@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819119569	GE	On-Demand	Mild	PAPA1_CARPA	31	40
CCOC(=O)N[C@H]1CCCN(C(=O)[C@H](CC)Cc2ccccc2C)C1	ZINC000819119570	EG	On-Demand	Anodyne	ACE	25	42
CCOC(=O)N[C@H]1CCCN(C(=O)[C@@H](CC)Cc2ccccc2C)C1	ZINC000819119573	EG	On-Demand	Anodyne	ACE	25	42
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(F)c(NC(=O)CCN2CCOCC2)c1	ZINC000819119580	GE	On-Demand	Anodyne	EPHX2	23	42
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(F)c(NC(=O)CCN2CCOCC2)c1	ZINC000819119581	GE	On-Demand	Anodyne	EPHX2	23	42
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(F)c(NC(=O)CCN2CCOCC2)c1	ZINC000819119582	GE	On-Demand	Anodyne	EPHX2	23	42
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(F)c(NC(=O)CCN2CCOCC2)c1	ZINC000819119583	GE	On-Demand	Anodyne	EPHX2	23	42
CCC(CC)(CNC[C@@H](O)c1cccnc1)SC	ZINC000819119596	CF	On-Demand	Anodyne	ADRB2	21	43
CCC(CC)(CNC[C@@H](O)c1cccnc1)SC	ZINC000819119596	CF	On-Demand	Anodyne	ADRB1	23	43
CCC(CC)(CNC[C@@H](O)c1cccnc1)SC	ZINC000819119596	CF	On-Demand	Anodyne	ADRB3	89	43
CCC(CC)(CNC[C@H](O)c1cccnc1)SC	ZINC000819119597	CF	On-Demand	Anodyne	ADRB2	21	43
CCC(CC)(CNC[C@H](O)c1cccnc1)SC	ZINC000819119597	CF	On-Demand	Anodyne	ADRB1	23	43
CCC(CC)(CNC[C@H](O)c1cccnc1)SC	ZINC000819119597	CF	On-Demand	Anodyne	ADRB3	89	43
CCC(CC)(CNC[C@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819119612	DH	On-Demand	Mild	CTRB_BOVIN	45	31
CCC(CC)(CNC[C@@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819119613	DH	On-Demand	Mild	CTRB_BOVIN	45	31
O=C(/C=C\[C@@H]1CCCO1)NCCc1ccc(OCc2ccccc2)cc1	ZINC000819119616	FH	On-Demand	Anodyne	FFAR1	31	44
O=C(/C=C/[C@H]1CCCO1)NCCc1ccc(OCc2ccccc2)cc1	ZINC000819119617	FH	On-Demand	Anodyne	FFAR1	31	44
O=C(/C=C\[C@H]1CCCO1)NCCc1ccc(OCc2ccccc2)cc1	ZINC000819119618	FH	On-Demand	Anodyne	FFAR1	31	44
O=C(/C=C/[C@@H]1CCCO1)NCCc1ccc(OCc2ccccc2)cc1	ZINC000819119619	FH	On-Demand	Anodyne	FFAR1	31	44
O=C(CCNC[C@H]1C[C@@H]1c1ccc(F)cc1)Nc1ccccc1	ZINC000819119622	DH	On-Demand	Anodyne	KDM1A	23	40
O=C(CCNC[C@@H]1C[C@@H]1c1ccc(F)cc1)Nc1ccccc1	ZINC000819119623	DH	On-Demand	Anodyne	KDM1A	23	40
O=C(CCNC[C@H]1C[C@H]1c1ccc(F)cc1)Nc1ccccc1	ZINC000819119624	DH	On-Demand	Anodyne	KDM1A	23	40
O=C(CCNC[C@@H]1C[C@H]1c1ccc(F)cc1)Nc1ccccc1	ZINC000819119625	DH	On-Demand	Anodyne	KDM1A	23	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCOC2CCC2)cc1	ZINC000819119642	DD	On-Demand	Anodyne	ADRB2	40	47
CS(=O)(=O)c1ccc([C@@H](O)CNCCOC2CCC2)cc1	ZINC000819119642	DD	On-Demand	Anodyne	ADRB1	44	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCOC2CCC2)cc1	ZINC000819119642	DD	On-Demand	Anodyne	ADRB3	68	42
CS(=O)(=O)c1ccc([C@H](O)CNCCOC2CCC2)cc1	ZINC000819119643	DD	On-Demand	Anodyne	ADRB2	40	47
CS(=O)(=O)c1ccc([C@H](O)CNCCOC2CCC2)cc1	ZINC000819119643	DD	On-Demand	Anodyne	ADRB1	44	42
CS(=O)(=O)c1ccc([C@H](O)CNCCOC2CCC2)cc1	ZINC000819119643	DD	On-Demand	Anodyne	ADRB3	68	42
CSc1ccc(OC[C@H](O)CNCCOC2CCC2)cc1	ZINC000819119652	DE	On-Demand	Anodyne	ADRB2	57	51
CSc1ccc(OC[C@H](O)CNCCOC2CCC2)cc1	ZINC000819119652	DE	On-Demand	Anodyne	ADRB1	83	53
CSc1ccc(OC[C@H](O)CNCCOC2CCC2)cc1	ZINC000819119652	DE	On-Demand	Anodyne	ADRB3	56	45
CSc1ccc(OC[C@@H](O)CNCCOC2CCC2)cc1	ZINC000819119653	DE	On-Demand	Anodyne	ADRB2	57	51
CSc1ccc(OC[C@@H](O)CNCCOC2CCC2)cc1	ZINC000819119653	DE	On-Demand	Anodyne	ADRB1	83	53
CSc1ccc(OC[C@@H](O)CNCCOC2CCC2)cc1	ZINC000819119653	DE	On-Demand	Anodyne	ADRB3	56	45
O[C@@H](CNCCOC1CCC1)COc1ccc(-c2ccccc2)cc1	ZINC000819119654	EG	On-Demand	Anodyne	ADRB2	75	56
O[C@@H](CNCCOC1CCC1)COc1ccc(-c2ccccc2)cc1	ZINC000819119654	EG	On-Demand	Anodyne	ADRB1	116	59
O[C@@H](CNCCOC1CCC1)COc1ccc(-c2ccccc2)cc1	ZINC000819119654	EG	On-Demand	Anodyne	ADRB3	86	54
O[C@H](CNCCOC1CCC1)COc1ccc(-c2ccccc2)cc1	ZINC000819119655	EG	On-Demand	Anodyne	ADRB2	75	56
O[C@H](CNCCOC1CCC1)COc1ccc(-c2ccccc2)cc1	ZINC000819119655	EG	On-Demand	Anodyne	ADRB1	116	59
O[C@H](CNCCOC1CCC1)COc1ccc(-c2ccccc2)cc1	ZINC000819119655	EG	On-Demand	Anodyne	ADRB3	86	54
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(C2CC2)C2CC2)CC1	ZINC000819119676	FG	On-Demand	Anodyne	GPR119	36	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(C2CC2)C2CC2)CC1	ZINC000819119677	FG	On-Demand	Anodyne	GPR119	36	44
O[C@H](CNCCOC1CCC1)COc1cccc2[nH]ccc12	ZINC000819119688	DE	On-Demand	Anodyne	ADRB2	38	70
O[C@H](CNCCOC1CCC1)COc1cccc2[nH]ccc12	ZINC000819119688	DE	On-Demand	Anodyne	ADRB1	75	61
O[C@H](CNCCOC1CCC1)COc1cccc2[nH]ccc12	ZINC000819119688	DE	On-Demand	Anodyne	HTR1A	20	70
O[C@H](CNCCOC1CCC1)COc1cccc2[nH]ccc12	ZINC000819119688	DE	On-Demand	Anodyne	SLC6A4	21	47
O[C@H](CNCCOC1CCC1)COc1cccc2[nH]ccc12	ZINC000819119688	DE	On-Demand	Anodyne	ADRB3	28	61
O[C@@H](CNCCOC1CCC1)COc1cccc2[nH]ccc12	ZINC000819119689	DE	On-Demand	Anodyne	ADRB2	38	70
O[C@@H](CNCCOC1CCC1)COc1cccc2[nH]ccc12	ZINC000819119689	DE	On-Demand	Anodyne	ADRB1	75	61
O[C@@H](CNCCOC1CCC1)COc1cccc2[nH]ccc12	ZINC000819119689	DE	On-Demand	Anodyne	HTR1A	20	70
O[C@@H](CNCCOC1CCC1)COc1cccc2[nH]ccc12	ZINC000819119689	DE	On-Demand	Anodyne	SLC6A4	21	47
O[C@@H](CNCCOC1CCC1)COc1cccc2[nH]ccc12	ZINC000819119689	DE	On-Demand	Anodyne	ADRB3	28	61
CC(=O)c1cccc(OC[C@@H](O)CNCCOC2CCC2)c1	ZINC000819119692	DD	On-Demand	Anodyne	ADRB2	62	55
CC(=O)c1cccc(OC[C@@H](O)CNCCOC2CCC2)c1	ZINC000819119692	DD	On-Demand	Anodyne	ADRB1	105	55
CC(=O)c1cccc(OC[C@@H](O)CNCCOC2CCC2)c1	ZINC000819119692	DD	On-Demand	Anodyne	ADRB3	71	46
CC(=O)c1cccc(OC[C@@H](O)CNCCOC2CCC2)c1	ZINC000819119692	DD	On-Demand	Anodyne	ABCB1	24	48
CC(=O)c1cccc(OC[C@H](O)CNCCOC2CCC2)c1	ZINC000819119693	DD	On-Demand	Anodyne	ADRB2	62	55
CC(=O)c1cccc(OC[C@H](O)CNCCOC2CCC2)c1	ZINC000819119693	DD	On-Demand	Anodyne	ADRB1	105	55
CC(=O)c1cccc(OC[C@H](O)CNCCOC2CCC2)c1	ZINC000819119693	DD	On-Demand	Anodyne	ADRB3	71	46
CC(=O)c1cccc(OC[C@H](O)CNCCOC2CCC2)c1	ZINC000819119693	DD	On-Demand	Anodyne	ABCB1	24	48
O[C@@H](CNCCOC1CCC1)c1cccc(C(F)(F)F)c1	ZINC000819119699	DF	On-Demand	Anodyne	ADRB1	49	48
O[C@@H](CNCCOC1CCC1)c1cccc(C(F)(F)F)c1	ZINC000819119699	DF	On-Demand	Anodyne	ADRB3	46	42
O[C@H](CNCCOC1CCC1)c1cccc(C(F)(F)F)c1	ZINC000819119700	DF	On-Demand	Anodyne	ADRB1	49	48
O[C@H](CNCCOC1CCC1)c1cccc(C(F)(F)F)c1	ZINC000819119700	DF	On-Demand	Anodyne	ADRB3	46	42
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819119713	FF	On-Demand	Anodyne	ADRB1	55	38
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819119715	FF	On-Demand	Anodyne	ADRB1	55	38
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819119717	FF	On-Demand	Anodyne	ADRB1	55	38
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819119719	FF	On-Demand	Anodyne	ADRB1	55	38
CCc1cnc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000819119741	FF	On-Demand	Anodyne	GPR119	52	44
CCc1cnc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000819119744	FF	On-Demand	Anodyne	GPR119	52	44
O=C1c2ccccc2C(=O)N1C[C@H](O)CNCCOC1CCC1	ZINC000819119746	DC	On-Demand	Anodyne	ADRB1	28	43
O=C1c2ccccc2C(=O)N1C[C@@H](O)CNCCOC1CCC1	ZINC000819119749	DC	On-Demand	Anodyne	ADRB1	28	43
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCOC1CCC1	ZINC000819119751	DD	On-Demand	Bother	ADRB2	47	46
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCOC1CCC1	ZINC000819119751	DD	On-Demand	Bother	ADRB1	80	47
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCOC1CCC1	ZINC000819119751	DD	On-Demand	Bother	ADRB3	46	43
O[C@@H](CNC[C@@H]1OCCc2sccc21)COc1ccc(Cl)cc1	ZINC000819119781	FG	On-Demand	Anodyne	ADRB1	47	40
O[C@H](CNC[C@@H]1OCCc2sccc21)COc1ccc(Cl)cc1	ZINC000819119782	FG	On-Demand	Anodyne	ADRB1	47	40
O[C@H](CNC[C@H]1OCCc2sccc21)COc1ccc(Cl)cc1	ZINC000819119783	FG	On-Demand	Anodyne	ADRB1	47	40
O[C@@H](CNC[C@H]1OCCc2sccc21)COc1ccc(Cl)cc1	ZINC000819119784	FG	On-Demand	Anodyne	ADRB1	47	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC[C@H]1OCCc2sccc21	ZINC000819119798	FE	On-Demand	Bother	ADRB1	43	34
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC[C@@H]1OCCc2sccc21	ZINC000819119799	FE	On-Demand	Bother	ADRB1	43	34
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC[C@H]1OCCc2sccc21	ZINC000819119800	FE	On-Demand	Bother	ADRB1	43	34
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC[C@@H]1OCCc2sccc21	ZINC000819119801	FE	On-Demand	Bother	ADRB1	43	34
COC[C@]1(C(=O)O)CCN(S(=O)(=O)c2cccc(C(F)F)c2)C1	ZINC000819119823	ED	On-Demand	Anodyne	AKR1C3	50	35
COC[C@@]1(C(=O)O)CCN(S(=O)(=O)c2cccc(C(F)F)c2)C1	ZINC000819119824	ED	On-Demand	Anodyne	AKR1C3	50	35
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCOC1CCC1	ZINC000819119829	DD	On-Demand	Bother	ADRB2	47	46
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCOC1CCC1	ZINC000819119829	DD	On-Demand	Bother	ADRB1	80	47
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCOC1CCC1	ZINC000819119829	DD	On-Demand	Bother	ADRB3	46	43
O[C@H](CN[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccnc1	ZINC000819119830	FF	On-Demand	Clean	ADRB3	56	49
O[C@H](CN[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccnc1	ZINC000819119831	FF	On-Demand	Clean	ADRB3	56	49
O[C@@H](CN[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccnc1	ZINC000819119832	FF	On-Demand	Clean	ADRB3	56	49
O[C@@H](CN[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)c1cccnc1	ZINC000819119833	FF	On-Demand	Clean	ADRB3	56	49
O=C(CCNCCOC1CCC1)Nc1cccc(Cl)c1	ZINC000819119853	CF	On-Demand	Anodyne	ADRB1	17	52
O[C@H](CNCCOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819119854	EF	On-Demand	Anodyne	ADRB2	57	52
O[C@H](CNCCOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819119854	EF	On-Demand	Anodyne	ADRB1	87	53
O[C@H](CNCCOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819119854	EF	On-Demand	Anodyne	HRH1	23	44
O[C@H](CNCCOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819119854	EF	On-Demand	Anodyne	GRIN1	27	47
O[C@H](CNCCOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819119854	EF	On-Demand	Anodyne	ADRB3	58	45
O[C@H](CNCCOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819119854	EF	On-Demand	Anodyne	CCR3	24	46
O[C@@H](CNCCOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819119855	EF	On-Demand	Anodyne	ADRB2	57	52
O[C@@H](CNCCOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819119855	EF	On-Demand	Anodyne	ADRB1	87	53
O[C@@H](CNCCOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819119855	EF	On-Demand	Anodyne	HRH1	23	44
O[C@@H](CNCCOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819119855	EF	On-Demand	Anodyne	GRIN1	27	47
O[C@@H](CNCCOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819119855	EF	On-Demand	Anodyne	ADRB3	58	45
O[C@@H](CNCCOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819119855	EF	On-Demand	Anodyne	CCR3	24	46
O[C@@H](CNCCOC1CCC1)c1ccccc1Br	ZINC000819119864	DF	On-Demand	Anodyne	ADRB1	27	46
O[C@H](CNCCOC1CCC1)c1ccccc1Br	ZINC000819119865	DF	On-Demand	Anodyne	ADRB1	27	46
O[C@H](CNCCOC1CCC1)Cc1ccc(F)cc1	ZINC000819119874	CD	On-Demand	Anodyne	ADRB1	32	48
O[C@@H](CNCCOC1CCC1)Cc1ccc(F)cc1	ZINC000819119875	CD	On-Demand	Anodyne	ADRB1	32	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCOC2CCC2)CC1	ZINC000819119880	EE	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCOC2CCC2)CC1	ZINC000819119881	EE	On-Demand	Anodyne	GPR119	32	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCOC2CCC2)c1	ZINC000819119884	CD	On-Demand	Bother	ADRB1	51	45
O=[N+]([O-])c1cccc([C@@H](O)CNCCOC2CCC2)c1	ZINC000819119884	CD	On-Demand	Bother	ADRB3	54	45
O=[N+]([O-])c1cccc([C@@H](O)CNCCOC2CCC2)c1	ZINC000819119884	CD	On-Demand	Bother	CACNA1D	42	33
O=[N+]([O-])c1cccc([C@H](O)CNCCOC2CCC2)c1	ZINC000819119885	CD	On-Demand	Bother	ADRB1	51	45
O=[N+]([O-])c1cccc([C@H](O)CNCCOC2CCC2)c1	ZINC000819119885	CD	On-Demand	Bother	ADRB3	54	45
O=[N+]([O-])c1cccc([C@H](O)CNCCOC2CCC2)c1	ZINC000819119885	CD	On-Demand	Bother	CACNA1D	42	33
O=C(CCNCCOC1CCC1)Nc1ccccc1	ZINC000819119899	CE	On-Demand	Anodyne	ADRB1	16	48
O=C(CCNCCOC1CCC1)Nc1ccccc1	ZINC000819119899	CE	On-Demand	Anodyne	TIMP3	54	33
O=C(CCNCCOC1CCC1)Nc1ccccc1	ZINC000819119899	CE	On-Demand	Anodyne	HDAC8	16	44
O=C(CCNCCOC1CCC1)Nc1ccccc1	ZINC000819119899	CE	On-Demand	Anodyne	HDAC10	38	44
O=C(CCNCCOC1CCC1)Nc1ccccc1	ZINC000819119899	CE	On-Demand	Anodyne	HDAC2	25	44
O=C(CCNCCOC1CCC1)Nc1ccccc1	ZINC000819119899	CE	On-Demand	Anodyne	HDAC3	29	44
O=C(CCNCCOC1CCC1)Nc1ccccc1	ZINC000819119899	CE	On-Demand	Anodyne	HDAC6	30	44
O=C(CCNCCOC1CCC1)Nc1ccccc1	ZINC000819119899	CE	On-Demand	Anodyne	HDAC11	34	44
O[C@H](CNCCOC1CCC1)COc1cc(Cl)ccc1Cl	ZINC000819119919	EF	On-Demand	Anodyne	ADRB2	33	50
O[C@H](CNCCOC1CCC1)COc1cc(Cl)ccc1Cl	ZINC000819119919	EF	On-Demand	Anodyne	ADRB1	60	51
O[C@@H](CNCCOC1CCC1)COc1cc(Cl)ccc1Cl	ZINC000819119920	EF	On-Demand	Anodyne	ADRB2	33	50
O[C@@H](CNCCOC1CCC1)COc1cc(Cl)ccc1Cl	ZINC000819119920	EF	On-Demand	Anodyne	ADRB1	60	51
O=C(/C=C/[C@H]1CCCO1)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000819119932	FE	On-Demand	Anodyne	C3AR1	49	46
O=C(/C=C/[C@H]1CCCO1)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000819119932	FE	On-Demand	Anodyne	EPHX2	19	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000819119933	FE	On-Demand	Anodyne	C3AR1	49	46
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000819119933	FE	On-Demand	Anodyne	EPHX2	19	41
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000819119934	FE	On-Demand	Anodyne	C3AR1	49	46
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000819119934	FE	On-Demand	Anodyne	EPHX2	19	41
O=C(/C=C\[C@H]1CCCO1)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000819119935	FE	On-Demand	Anodyne	C3AR1	49	46
O=C(/C=C\[C@H]1CCCO1)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000819119935	FE	On-Demand	Anodyne	EPHX2	19	41
COc1cccc([S@@](=O)CC(=O)Nc2cccc(CN3CCOC3=O)c2)c1	ZINC000819119947	GE	On-Demand	Anodyne	HRH2	18	40
O[C@@H](CNC[C@@H]1OCCc2sccc21)COc1ccccc1	ZINC000819119948	DE	On-Demand	Anodyne	ADRB2	47	46
O[C@@H](CNC[C@@H]1OCCc2sccc21)COc1ccccc1	ZINC000819119948	DE	On-Demand	Anodyne	ADRB1	69	42
O[C@@H](CNC[C@@H]1OCCc2sccc21)COc1ccccc1	ZINC000819119948	DE	On-Demand	Anodyne	ADRB3	45	42
O[C@H](CNC[C@@H]1OCCc2sccc21)COc1ccccc1	ZINC000819119949	DE	On-Demand	Anodyne	ADRB2	47	46
O[C@H](CNC[C@@H]1OCCc2sccc21)COc1ccccc1	ZINC000819119949	DE	On-Demand	Anodyne	ADRB1	69	42
O[C@H](CNC[C@@H]1OCCc2sccc21)COc1ccccc1	ZINC000819119949	DE	On-Demand	Anodyne	ADRB3	45	42
O[C@H](CNC[C@H]1OCCc2sccc21)COc1ccccc1	ZINC000819119950	DE	On-Demand	Anodyne	ADRB2	47	46
O[C@H](CNC[C@H]1OCCc2sccc21)COc1ccccc1	ZINC000819119950	DE	On-Demand	Anodyne	ADRB1	69	42
O[C@H](CNC[C@H]1OCCc2sccc21)COc1ccccc1	ZINC000819119950	DE	On-Demand	Anodyne	ADRB3	45	42
O[C@@H](CNC[C@H]1OCCc2sccc21)COc1ccccc1	ZINC000819119951	DE	On-Demand	Anodyne	ADRB2	47	46
O[C@@H](CNC[C@H]1OCCc2sccc21)COc1ccccc1	ZINC000819119951	DE	On-Demand	Anodyne	ADRB1	69	42
O[C@@H](CNC[C@H]1OCCc2sccc21)COc1ccccc1	ZINC000819119951	DE	On-Demand	Anodyne	ADRB3	45	42
O[C@H](CNC[C@@H]1OCCc2sccc21)c1cccc(Cl)c1	ZINC000819119952	DG	On-Demand	Anodyne	ADRB1	27	40
O[C@H](CNC[C@@H]1OCCc2sccc21)c1cccc(Cl)c1	ZINC000819119952	DG	On-Demand	Anodyne	ADRB3	40	42
O[C@@H](CNC[C@@H]1OCCc2sccc21)c1cccc(Cl)c1	ZINC000819119953	DG	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNC[C@@H]1OCCc2sccc21)c1cccc(Cl)c1	ZINC000819119953	DG	On-Demand	Anodyne	ADRB3	40	42
O[C@H](CNC[C@H]1OCCc2sccc21)c1cccc(Cl)c1	ZINC000819119954	DG	On-Demand	Anodyne	ADRB1	27	40
O[C@H](CNC[C@H]1OCCc2sccc21)c1cccc(Cl)c1	ZINC000819119954	DG	On-Demand	Anodyne	ADRB3	40	42
O[C@@H](CNC[C@H]1OCCc2sccc21)c1cccc(Cl)c1	ZINC000819119955	DG	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNC[C@H]1OCCc2sccc21)c1cccc(Cl)c1	ZINC000819119955	DG	On-Demand	Anodyne	ADRB3	40	42
CSc1ccc(OC[C@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819119968	FG	On-Demand	Anodyne	ADRB1	40	35
CSc1ccc(OC[C@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819119969	FG	On-Demand	Anodyne	ADRB1	40	35
CSc1ccc(OC[C@@H](O)CNC[C@@H]2OCCc3sccc32)cc1	ZINC000819119970	FG	On-Demand	Anodyne	ADRB1	40	35
CSc1ccc(OC[C@@H](O)CNC[C@H]2OCCc3sccc32)cc1	ZINC000819119971	FG	On-Demand	Anodyne	ADRB1	40	35
O=C(CCNCCOC1CCC1)Nc1cccc(C(F)(F)F)c1	ZINC000819120010	EG	On-Demand	Anodyne	HDAC10	17	54
O=C(CCNCCOC1CCC1)Nc1cccc(C(F)(F)F)c1	ZINC000819120010	EG	On-Demand	Anodyne	HDAC6	15	54
O[C@@H](CCc1ccccc1)CNCCOC1CCC1	ZINC000819120011	CE	On-Demand	Anodyne	ADRB2	37	44
O[C@@H](CCc1ccccc1)CNCCOC1CCC1	ZINC000819120011	CE	On-Demand	Anodyne	ADRB1	64	44
O[C@@H](CCc1ccccc1)CNCCOC1CCC1	ZINC000819120011	CE	On-Demand	Anodyne	SLC18A2	45	37
O[C@@H](CCc1ccccc1)CNCCOC1CCC1	ZINC000819120011	CE	On-Demand	Anodyne	ADRB3	41	41
O[C@H](CCc1ccccc1)CNCCOC1CCC1	ZINC000819120012	CE	On-Demand	Anodyne	ADRB2	37	44
O[C@H](CCc1ccccc1)CNCCOC1CCC1	ZINC000819120012	CE	On-Demand	Anodyne	ADRB1	64	44
O[C@H](CCc1ccccc1)CNCCOC1CCC1	ZINC000819120012	CE	On-Demand	Anodyne	SLC18A2	45	37
O[C@H](CCc1ccccc1)CNCCOC1CCC1	ZINC000819120012	CE	On-Demand	Anodyne	ADRB3	41	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cc(Cl)ccc1OC)C2	ZINC000819120032	FF	On-Demand	Anodyne	P2RX7	56	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cc(Cl)ccc1OC)C2	ZINC000819120033	FF	On-Demand	Anodyne	P2RX7	56	38
O[C@H](CNCCOC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819120034	EF	On-Demand	Anodyne	ADRB2	46	48
O[C@H](CNCCOC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819120034	EF	On-Demand	Anodyne	ADRB1	71	61
O[C@H](CNCCOC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819120034	EF	On-Demand	Anodyne	ADRB3	45	42
O[C@H](CNCCOC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819120034	EF	On-Demand	Anodyne	PDS	46	39
O[C@@H](CNCCOC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819120035	EF	On-Demand	Anodyne	ADRB2	46	48
O[C@@H](CNCCOC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819120035	EF	On-Demand	Anodyne	ADRB1	71	61
O[C@@H](CNCCOC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819120035	EF	On-Demand	Anodyne	ADRB3	45	42
O[C@@H](CNCCOC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819120035	EF	On-Demand	Anodyne	PDS	46	39
O[C@@H](CNCCOC1CCC1)c1ccc(Br)cc1	ZINC000819120038	DF	On-Demand	Anodyne	ADRB1	28	44
O[C@@H](CNCCOC1CCC1)c1ccc(Br)cc1	ZINC000819120038	DF	On-Demand	Anodyne	ADRB3	22	41
O[C@H](CNCCOC1CCC1)c1ccc(Br)cc1	ZINC000819120039	DF	On-Demand	Anodyne	ADRB1	28	44
O[C@H](CNCCOC1CCC1)c1ccc(Br)cc1	ZINC000819120039	DF	On-Demand	Anodyne	ADRB3	22	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(OC(C)C)nc1)C2	ZINC000819120053	FE	On-Demand	Anodyne	VHL	58	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(OC(C)C)nc1)C2	ZINC000819120054	FE	On-Demand	Anodyne	VHL	58	32
O[C@@H](CNCCOC1CCC1)COCc1ccc(Cl)cc1	ZINC000819120057	DE	On-Demand	Anodyne	ADRB2	22	42
O[C@@H](CNCCOC1CCC1)COCc1ccc(Cl)cc1	ZINC000819120057	DE	On-Demand	Anodyne	ADRB1	50	49
O[C@@H](CNCCOC1CCC1)COCc1ccc(Cl)cc1	ZINC000819120057	DE	On-Demand	Anodyne	ADRB3	25	40
O[C@H](CNCCOC1CCC1)COCc1ccc(Cl)cc1	ZINC000819120058	DE	On-Demand	Anodyne	ADRB2	22	42
O[C@H](CNCCOC1CCC1)COCc1ccc(Cl)cc1	ZINC000819120058	DE	On-Demand	Anodyne	ADRB1	50	49
O[C@H](CNCCOC1CCC1)COCc1ccc(Cl)cc1	ZINC000819120058	DE	On-Demand	Anodyne	ADRB3	25	40
O[C@@H](CNCCOC1CCC1)COCc1ccccc1Cl	ZINC000819120059	DE	On-Demand	Anodyne	ADRB2	17	44
O[C@@H](CNCCOC1CCC1)COCc1ccccc1Cl	ZINC000819120059	DE	On-Demand	Anodyne	ADRB1	39	51
O[C@@H](CNCCOC1CCC1)COCc1ccccc1Cl	ZINC000819120059	DE	On-Demand	Anodyne	ADRB3	17	40
O[C@H](CNCCOC1CCC1)COCc1ccccc1Cl	ZINC000819120060	DE	On-Demand	Anodyne	ADRB2	17	44
O[C@H](CNCCOC1CCC1)COCc1ccccc1Cl	ZINC000819120060	DE	On-Demand	Anodyne	ADRB1	39	51
O[C@H](CNCCOC1CCC1)COCc1ccccc1Cl	ZINC000819120060	DE	On-Demand	Anodyne	ADRB3	17	40
O=C1CCc2cc(OC[C@@H](O)CNCCOC3CCC3)ccc2N1	ZINC000819120065	ED	On-Demand	Anodyne	ADRB2	33	44
O=C1CCc2cc(OC[C@@H](O)CNCCOC3CCC3)ccc2N1	ZINC000819120065	ED	On-Demand	Anodyne	ADRB1	60	45
O=C1CCc2cc(OC[C@@H](O)CNCCOC3CCC3)ccc2N1	ZINC000819120065	ED	On-Demand	Anodyne	ADRB3	38	41
O=C1CCc2cc(OC[C@H](O)CNCCOC3CCC3)ccc2N1	ZINC000819120066	ED	On-Demand	Anodyne	ADRB2	33	44
O=C1CCc2cc(OC[C@H](O)CNCCOC3CCC3)ccc2N1	ZINC000819120066	ED	On-Demand	Anodyne	ADRB1	60	45
O=C1CCc2cc(OC[C@H](O)CNCCOC3CCC3)ccc2N1	ZINC000819120066	ED	On-Demand	Anodyne	ADRB3	38	41
O=C(CCNCCOC1CCC1)Nc1cccnc1	ZINC000819120095	CD	On-Demand	Anodyne	NAMPT	26	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCOc1ccc3c(c1)OCO3)C2	ZINC000819120103	GD	On-Demand	Anodyne	EDNRB	56	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCOc1ccc3c(c1)OCO3)C2	ZINC000819120103	GD	On-Demand	Anodyne	EDNRA	55	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCOc1ccc3c(c1)OCO3)C2	ZINC000819120103	GD	On-Demand	Anodyne	BMP1	56	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCOc1ccc3c(c1)OCO3)C2	ZINC000819120103	GD	On-Demand	Anodyne	NOS2	41	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCOc1ccc3c(c1)OCO3)C2	ZINC000819120104	GD	On-Demand	Anodyne	EDNRB	56	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCOc1ccc3c(c1)OCO3)C2	ZINC000819120104	GD	On-Demand	Anodyne	EDNRA	55	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCOc1ccc3c(c1)OCO3)C2	ZINC000819120104	GD	On-Demand	Anodyne	BMP1	56	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCOc1ccc3c(c1)OCO3)C2	ZINC000819120104	GD	On-Demand	Anodyne	NOS2	41	32
O[C@H](CNCCOC1CCC1)COc1ccc(Cl)cc1Cl	ZINC000819120106	EF	On-Demand	Anodyne	ADRB2	30	49
O[C@H](CNCCOC1CCC1)COc1ccc(Cl)cc1Cl	ZINC000819120106	EF	On-Demand	Anodyne	ADRB1	55	50
O[C@@H](CNCCOC1CCC1)COc1ccc(Cl)cc1Cl	ZINC000819120107	EF	On-Demand	Anodyne	ADRB2	30	49
O[C@@H](CNCCOC1CCC1)COc1ccc(Cl)cc1Cl	ZINC000819120107	EF	On-Demand	Anodyne	ADRB1	55	50
O=[N+]([O-])c1cccc([C@@H](O)CNCC(C2CC2)C2CC2)c1	ZINC000819120108	CF	On-Demand	Bother	CACNA1D	43	33
O=[N+]([O-])c1cccc([C@H](O)CNCC(C2CC2)C2CC2)c1	ZINC000819120109	CF	On-Demand	Bother	CACNA1D	43	33
O[C@H](CNCCOC1CCC1)COc1cc(F)cc(Br)c1	ZINC000819120114	FE	On-Demand	Anodyne	ADRB2	19	47
O[C@H](CNCCOC1CCC1)COc1cc(F)cc(Br)c1	ZINC000819120114	FE	On-Demand	Anodyne	ADRB1	41	48
O[C@@H](CNCCOC1CCC1)COc1cc(F)cc(Br)c1	ZINC000819120115	FE	On-Demand	Anodyne	ADRB2	19	47
O[C@@H](CNCCOC1CCC1)COc1cc(F)cc(Br)c1	ZINC000819120115	FE	On-Demand	Anodyne	ADRB1	41	48
O[C@@H](CNCCOC1CCC1)Cc1ccccc1C(F)(F)F	ZINC000819120122	DF	On-Demand	Anodyne	ADRB1	18	41
O[C@H](CNCCOC1CCC1)Cc1ccccc1C(F)(F)F	ZINC000819120123	DF	On-Demand	Anodyne	ADRB1	18	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCOc1ccc2c(c1)OCO2	ZINC000819120126	FD	On-Demand	Anodyne	BMP1	26	40
O=c1onc(-c2ccccc2)n1C[C@@H](O)CNCCOC1CCC1	ZINC000819120133	ED	On-Demand	Anodyne	ADRB1	15	41
O=c1onc(-c2ccccc2)n1C[C@H](O)CNCCOC1CCC1	ZINC000819120134	ED	On-Demand	Anodyne	ADRB1	15	41
O[C@@H](CNCCOC1CCC1)COCc1ccccc1F	ZINC000819120177	CD	On-Demand	Anodyne	ADRB1	37	51
O[C@H](CNCCOC1CCC1)COCc1ccccc1F	ZINC000819120178	CD	On-Demand	Anodyne	ADRB1	37	51
O[C@@H](CNCCOC1CCC1)c1ccc(Cl)cc1Cl	ZINC000819120194	DG	On-Demand	Anodyne	ADRB1	32	42
O[C@@H](CNCCOC1CCC1)c1ccc(Cl)cc1Cl	ZINC000819120194	DG	On-Demand	Anodyne	ADRB3	24	42
O[C@H](CNCCOC1CCC1)c1ccc(Cl)cc1Cl	ZINC000819120195	DG	On-Demand	Anodyne	ADRB1	32	42
O[C@H](CNCCOC1CCC1)c1ccc(Cl)cc1Cl	ZINC000819120195	DG	On-Demand	Anodyne	ADRB3	24	42
O[C@@H](CNCCOC1CCC1)Cn1c2ccccc2c2ccccc21	ZINC000819120200	EG	On-Demand	Anodyne	ADRB1	19	40
O[C@H](CNCCOC1CCC1)Cn1c2ccccc2c2ccccc21	ZINC000819120201	EG	On-Demand	Anodyne	ADRB1	19	40
NC(=O)c1cc(S(=O)(=O)NCC(=O)Nc2cccc(CC(=O)O)c2)c[nH]1	ZINC000819120210	GB	On-Demand	Anodyne	CA4	15	40
Cc1ccccc1CN1CCC(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819120215	GF	On-Demand	Anodyne	DRD4	19	52
Cc1ccccc1CN1CCC(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819120215	GF	On-Demand	Anodyne	SIGMAR1	19	42
Cc1ccccc1CN1CCC(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819120215	GF	On-Demand	Anodyne	SSTR5	35	42
C[C@H]1CN(c2ccc(NC(=O)C[C@@H](C)n3cccn3)cc2F)C[C@@H](C)O1	ZINC000819120216	FG	On-Demand	Anodyne	NPY2R	75	37
C[C@H]1CN(c2ccc(NC(=O)C[C@H](C)n3cccn3)cc2F)C[C@@H](C)O1	ZINC000819120219	FG	On-Demand	Anodyne	NPY2R	75	37
C[C@@H](CNC[C@H](O)C1CC1)Oc1ccc(Cl)cc1	ZINC000819120236	CE	On-Demand	Anodyne	EBP	19	50
C[C@@H](CNC[C@@H](O)C1CC1)Oc1ccc(Cl)cc1	ZINC000819120237	CE	On-Demand	Anodyne	EBP	19	50
C[C@H](CNC[C@@H](O)C1CC1)Oc1ccc(Cl)cc1	ZINC000819120238	CE	On-Demand	Anodyne	EBP	19	50
C[C@H](CNC[C@H](O)C1CC1)Oc1ccc(Cl)cc1	ZINC000819120239	CE	On-Demand	Anodyne	EBP	19	50
COC(=O)C1(NC(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)CCCCC1	ZINC000819120261	GG	On-Demand	Anodyne	CTSB	18	45
COC(=O)C1(NC(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)CCCCC1	ZINC000819120261	GG	On-Demand	Anodyne	CTSK	27	58
O[C@@H](CNCCOC1CCC1)c1ccc(C(F)(F)F)cc1	ZINC000819120291	DF	On-Demand	Anodyne	ADRB1	22	47
O[C@@H](CNCCOC1CCC1)c1ccc(C(F)(F)F)cc1	ZINC000819120291	DF	On-Demand	Anodyne	ADRB3	16	40
O[C@H](CNCCOC1CCC1)c1ccc(C(F)(F)F)cc1	ZINC000819120295	DF	On-Demand	Anodyne	ADRB1	22	47
O[C@H](CNCCOC1CCC1)c1ccc(C(F)(F)F)cc1	ZINC000819120295	DF	On-Demand	Anodyne	ADRB3	16	40
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccc(Cl)cc1	ZINC000819120296	DF	On-Demand	Anodyne	ADRB2	27	48
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccc(Cl)cc1	ZINC000819120296	DF	On-Demand	Anodyne	ADRB1	43	48
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccc(Cl)cc1	ZINC000819120296	DF	On-Demand	Anodyne	ADRB3	110	48
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccc(Cl)cc1	ZINC000819120300	DF	On-Demand	Anodyne	ADRB2	27	48
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccc(Cl)cc1	ZINC000819120300	DF	On-Demand	Anodyne	ADRB1	43	48
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccc(Cl)cc1	ZINC000819120300	DF	On-Demand	Anodyne	ADRB3	110	48
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccc(Cl)cc1	ZINC000819120302	DF	On-Demand	Anodyne	ADRB2	27	48
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccc(Cl)cc1	ZINC000819120302	DF	On-Demand	Anodyne	ADRB1	43	48
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccc(Cl)cc1	ZINC000819120302	DF	On-Demand	Anodyne	ADRB3	110	48
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccc(Cl)cc1	ZINC000819120305	DF	On-Demand	Anodyne	ADRB2	27	48
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccc(Cl)cc1	ZINC000819120305	DF	On-Demand	Anodyne	ADRB1	43	48
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccc(Cl)cc1	ZINC000819120305	DF	On-Demand	Anodyne	ADRB3	110	48
COc1ncccc1NC(=O)C(F)=C1CCC1	ZINC000819120321	BE	On-Demand	Anodyne	P2RY1	41	39
O=C(C(F)=C1CCC1)N1CCN(CC(=O)N2CCc3ccccc32)CC1	ZINC000819120324	FE	On-Demand	Anodyne	DRD4	19	56
NC(=O)NCc1ccc(C(=O)OC[C@H]2CCCN2CC(=O)O)cc1	ZINC000819120326	EC	On-Demand	Anodyne	PROC	48	31
NC(=O)NCc1ccc(C(=O)OC[C@H]2CCCN2CC(=O)O)cc1	ZINC000819120326	EC	On-Demand	Anodyne	TMPRSS11D	61	35
NC(=O)NCc1ccc(C(=O)OC[C@@H]2CCCN2CC(=O)O)cc1	ZINC000819120330	EC	On-Demand	Anodyne	PROC	48	31
NC(=O)NCc1ccc(C(=O)OC[C@@H]2CCCN2CC(=O)O)cc1	ZINC000819120330	EC	On-Demand	Anodyne	TMPRSS11D	61	35
NC(=O)c1ccc(CNC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819120333	ED	On-Demand	Anodyne	TPSAB1	22	42
NC(=O)c1ccc(CNC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819120333	ED	On-Demand	Anodyne	PROC	55	33
O[C@@H](CNCC(C1CC1)C1CC1)c1cccc(Cl)c1	ZINC000819120343	CG	On-Demand	Anodyne	ADRB1	45	46
O[C@@H](CNCC(C1CC1)C1CC1)c1cccc(Cl)c1	ZINC000819120343	CG	On-Demand	Anodyne	ADRB3	57	46
O[C@H](CNCC(C1CC1)C1CC1)c1cccc(Cl)c1	ZINC000819120345	CG	On-Demand	Anodyne	ADRB1	45	46
O[C@H](CNCC(C1CC1)C1CC1)c1cccc(Cl)c1	ZINC000819120345	CG	On-Demand	Anodyne	ADRB3	57	46
NC(=O)c1cc(NC(=O)N2CCC[C@H](CC(=O)O)C2)ccc1F	ZINC000819120346	DD	On-Demand	Anodyne	CCR3	34	40
NC(=O)c1cc(NC(=O)N2CCC[C@H](CC(=O)O)C2)ccc1F	ZINC000819120346	DD	On-Demand	Anodyne	EPHX2	17	45
NC(=O)c1cc(NC(=O)N2CCC[C@@H](CC(=O)O)C2)ccc1F	ZINC000819120350	DD	On-Demand	Anodyne	CCR3	34	40
NC(=O)c1cc(NC(=O)N2CCC[C@@H](CC(=O)O)C2)ccc1F	ZINC000819120350	DD	On-Demand	Anodyne	EPHX2	17	45
CC[C@H](C)NC(=O)c1cccc(CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819120352	GF	On-Demand	Anodyne	FPR1	43	34
C[C@@H]1C[C@@H]1N1C[C@H](NC[C@@H](O)c2cccnc2)CC1=O	ZINC000819120397	CC	On-Demand	Anodyne	ADRB3	66	45
C[C@@H]1C[C@@H]1N1C[C@@H](NC[C@H](O)c2cccnc2)CC1=O	ZINC000819120399	CC	On-Demand	Anodyne	ADRB3	66	45
C[C@@H]1C[C@@H]1N1C[C@@H](NC[C@@H](O)c2cccnc2)CC1=O	ZINC000819120401	CC	On-Demand	Anodyne	ADRB3	66	45
C[C@@H]1C[C@@H]1N1C[C@H](NC[C@H](O)c2cccnc2)CC1=O	ZINC000819120402	CC	On-Demand	Anodyne	ADRB3	66	45
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1[C@@H]1C[C@H]1c1ccccc1	ZINC000819120404	FG	On-Demand	Anodyne	ADRB1	28	43
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1[C@@H]1C[C@H]1c1ccccc1	ZINC000819120404	FG	On-Demand	Anodyne	ADRB3	45	46
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1[C@@H]1C[C@H]1c1ccccc1	ZINC000819120404	FG	On-Demand	Anodyne	HSD17B2	23	50
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1[C@@H]1C[C@H]1c1ccccc1	ZINC000819120404	FG	On-Demand	Anodyne	CYP3A4	42	33
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1[C@H]1C[C@H]1c1ccccc1	ZINC000819120406	FG	On-Demand	Anodyne	ADRB1	28	43
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1[C@H]1C[C@H]1c1ccccc1	ZINC000819120406	FG	On-Demand	Anodyne	ADRB3	45	46
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1[C@H]1C[C@H]1c1ccccc1	ZINC000819120406	FG	On-Demand	Anodyne	HSD17B2	23	50
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1[C@H]1C[C@H]1c1ccccc1	ZINC000819120406	FG	On-Demand	Anodyne	CYP3A4	42	33
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1[C@@H]1C[C@@H]1c1ccccc1	ZINC000819120408	FG	On-Demand	Anodyne	ADRB1	28	43
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1[C@@H]1C[C@@H]1c1ccccc1	ZINC000819120408	FG	On-Demand	Anodyne	ADRB3	45	46
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1[C@@H]1C[C@@H]1c1ccccc1	ZINC000819120408	FG	On-Demand	Anodyne	HSD17B2	23	50
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1[C@@H]1C[C@@H]1c1ccccc1	ZINC000819120408	FG	On-Demand	Anodyne	CYP3A4	42	33
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1[C@H]1C[C@@H]1c1ccccc1	ZINC000819120411	FG	On-Demand	Anodyne	ADRB1	28	43
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1[C@H]1C[C@@H]1c1ccccc1	ZINC000819120411	FG	On-Demand	Anodyne	ADRB3	45	46
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1[C@H]1C[C@@H]1c1ccccc1	ZINC000819120411	FG	On-Demand	Anodyne	HSD17B2	23	50
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1[C@H]1C[C@@H]1c1ccccc1	ZINC000819120411	FG	On-Demand	Anodyne	CYP3A4	42	33
NC(=O)c1c[nH]c(C(=O)N2CCC(C(=O)O)CC2)c1	ZINC000819120412	CC	On-Demand	Anodyne	L3MBTL3	77	37
NC(=O)c1cc(N2CCCCC2)ccc1NCc1ccc(C(=O)O)cc1	ZINC000819120413	FG	On-Demand	Anodyne	STAT6	64	47
C[C@@H](O)CC(C)(C)CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819120420	FE	On-Demand	Anodyne	GPR119	36	45
C[C@@H](O)CC(C)(C)CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819120424	FE	On-Demand	Anodyne	GPR119	36	45
C[C@H](CNC[C@H](O)c1ccccc1)c1ccc(F)cc1F	ZINC000819120434	CG	On-Demand	Anodyne	ADRB3	50	39
OC1CCN(c2ccc(CNC[C@H](O)c3ccccc3)cc2F)CC1	ZINC000819120437	EF	On-Demand	Clean	NPY2R	69	38
C[C@@H](CNC[C@H](O)c1ccccc1)c1ccc(F)cc1F	ZINC000819120438	CG	On-Demand	Anodyne	ADRB3	50	39
OC1CCN(c2ccc(CNC[C@@H](O)c3ccccc3)cc2F)CC1	ZINC000819120439	EF	On-Demand	Clean	NPY2R	69	38
C[C@H](CNC[C@@H](O)c1ccccc1)c1ccc(F)cc1F	ZINC000819120442	CG	On-Demand	Anodyne	ADRB3	50	39
C[C@@H](CNC[C@@H](O)c1ccccc1)c1ccc(F)cc1F	ZINC000819120446	CG	On-Demand	Anodyne	ADRB3	50	39
NC(=O)c1ccc(CN(C(=O)NCCC(=O)O)C2CC2)cc1	ZINC000819120448	DC	On-Demand	Anodyne	GCGR	44	51
NC(=O)c1ccc(CN(C(=O)NCCC(=O)O)C2CC2)cc1	ZINC000819120448	DC	On-Demand	Anodyne	GIPR	67	50
CCc1cnc(CNC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)s1	ZINC000819120482	GD	On-Demand	Clean	ACOX1	67	31
CCc1cnc(CNC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)s1	ZINC000819120484	GD	On-Demand	Clean	ACOX1	67	31
O[C@@H](CNCCOC1CCC1)COc1ccc2ccccc2c1	ZINC000819120501	DF	On-Demand	Anodyne	ADRB2	69	57
O[C@@H](CNCCOC1CCC1)COc1ccc2ccccc2c1	ZINC000819120501	DF	On-Demand	Anodyne	ADRB1	96	53
O[C@@H](CNCCOC1CCC1)COc1ccc2ccccc2c1	ZINC000819120501	DF	On-Demand	Anodyne	ADRB3	67	47
O[C@@H](CNCCOC1CCC1)COc1ccc2ccccc2c1	ZINC000819120501	DF	On-Demand	Anodyne	CASR	40	37
O[C@@H](CNCCOC1CCC1)COc1ccc2ccccc2c1	ZINC000819120501	DF	On-Demand	Anodyne	CYP2D6	17	41
O[C@H](CNCCOC1CCC1)COc1ccc2ccccc2c1	ZINC000819120504	DF	On-Demand	Anodyne	ADRB2	69	57
O[C@H](CNCCOC1CCC1)COc1ccc2ccccc2c1	ZINC000819120504	DF	On-Demand	Anodyne	ADRB1	96	53
O[C@H](CNCCOC1CCC1)COc1ccc2ccccc2c1	ZINC000819120504	DF	On-Demand	Anodyne	ADRB3	67	47
O[C@H](CNCCOC1CCC1)COc1ccc2ccccc2c1	ZINC000819120504	DF	On-Demand	Anodyne	CASR	40	37
O[C@H](CNCCOC1CCC1)COc1ccc2ccccc2c1	ZINC000819120504	DF	On-Demand	Anodyne	CYP2D6	17	41
CC(=O)c1ccc(OC[C@@H](O)CNCCOC2CCC2)cc1	ZINC000819120505	DD	On-Demand	Anodyne	ADRB2	62	55
CC(=O)c1ccc(OC[C@@H](O)CNCCOC2CCC2)cc1	ZINC000819120505	DD	On-Demand	Anodyne	ADRB1	101	56
CC(=O)c1ccc(OC[C@@H](O)CNCCOC2CCC2)cc1	ZINC000819120505	DD	On-Demand	Anodyne	ADRB3	69	49
CC(=O)c1ccc(OC[C@@H](O)CNCCOC2CCC2)cc1	ZINC000819120505	DD	On-Demand	Anodyne	ABCB1	18	59
CC(=O)c1ccc(OC[C@H](O)CNCCOC2CCC2)cc1	ZINC000819120506	DD	On-Demand	Anodyne	ADRB2	62	55
CC(=O)c1ccc(OC[C@H](O)CNCCOC2CCC2)cc1	ZINC000819120506	DD	On-Demand	Anodyne	ADRB1	101	56
CC(=O)c1ccc(OC[C@H](O)CNCCOC2CCC2)cc1	ZINC000819120506	DD	On-Demand	Anodyne	ADRB3	69	49
CC(=O)c1ccc(OC[C@H](O)CNCCOC2CCC2)cc1	ZINC000819120506	DD	On-Demand	Anodyne	ABCB1	18	59
NC(=O)Nc1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819120508	DE	On-Demand	Anodyne	PRSS1	15	46
NC(=O)Nc1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819120508	DE	On-Demand	Anodyne	PPIA	21	42
NC(=O)Nc1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819120508	DE	On-Demand	Anodyne	F3	40	35
NC(=O)Nc1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819120508	DE	On-Demand	Anodyne	ACR	74	44
NC(=O)Nc1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819120508	DE	On-Demand	Anodyne	NOD1	15	40
NC(=O)Nc1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819120508	DE	On-Demand	Anodyne	NOD2	41	40
NC(=O)c1ccc(NC(=O)CCN2CCO[C@@H](C(=O)O)C2)cc1Cl	ZINC000819120520	FC	On-Demand	Anodyne	PTPRF	46	35
NC(=O)c1ccc(NC(=O)CCN2CCO[C@H](C(=O)O)C2)cc1Cl	ZINC000819120522	FC	On-Demand	Anodyne	PTPRF	46	35
NC(=O)c1cc(NC(=O)N2CC[C@@H](C(=O)O)C2)ccc1F	ZINC000819120526	CC	On-Demand	Anodyne	SLC6A1	44	36
NC(=O)c1cc(NC(=O)N2CC[C@@H](C(=O)O)C2)ccc1F	ZINC000819120526	CC	On-Demand	Anodyne	EPHX2	24	41
NC(=O)c1cc(NC(=O)N2CC[C@H](C(=O)O)C2)ccc1F	ZINC000819120528	CC	On-Demand	Anodyne	SLC6A1	44	36
NC(=O)c1cc(NC(=O)N2CC[C@H](C(=O)O)C2)ccc1F	ZINC000819120528	CC	On-Demand	Anodyne	EPHX2	24	41
NC(=O)c1ccc(CNC(=O)N2CCC(C(=O)O)CC2)cn1	ZINC000819120532	DC	On-Demand	Anodyne	EPHX2	15	48
NC(=O)c1ccc(CNC(=O)N2CCC(C(=O)O)CC2)cn1	ZINC000819120532	DC	On-Demand	Anodyne	NAMPT	40	38
NC(=O)c1ccc(NC(=O)CCN2CCC(C(=O)O)CC2)cc1Cl	ZINC000819120533	FD	On-Demand	Anodyne	SLC6A1	47	39
NC(=O)c1ccc(NC(=O)CCN2CCC(C(=O)O)CC2)cc1Cl	ZINC000819120533	FD	On-Demand	Anodyne	TERT	18	45
NC(=O)Nc1ccc(C(=O)OCc2cn(CC(=O)O)nn2)cc1	ZINC000819120541	DC	On-Demand	Anodyne	ACR	59	37
NC(=O)c1ccc(CNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819120542	ED	On-Demand	Anodyne	CXCL8	34	40
NC(=O)c1ccc(CNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819120542	ED	On-Demand	Anodyne	HDAC1	31	49
NC(=O)c1ccc(CNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819120542	ED	On-Demand	Anodyne	HDAC2	25	40
NC(=O)c1ccc(CNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819120542	ED	On-Demand	Anodyne	FURIN	53	37
NC(=O)c1ccc(CNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819120542	ED	On-Demand	Anodyne	PROC	56	38
NC(=O)c1c(NC(=O)CCN2CC[C@H](C(=O)O)C2)sc2c1CCCC2	ZINC000819120544	FD	On-Demand	Anodyne	SLC6A1	108	34
NC(=O)c1c(NC(=O)CCN2CC[C@@H](C(=O)O)C2)sc2c1CCCC2	ZINC000819120548	FD	On-Demand	Anodyne	SLC6A1	108	34
NC(=O)c1cc(NC(=O)NCC(=O)O)ccc1Cl	ZINC000819120553	CC	On-Demand	Anodyne	F7	23	45
NC(=O)c1cc(NC(=O)NCC(=O)O)ccc1Cl	ZINC000819120553	CC	On-Demand	Anodyne	PRMT3	63	39
NC(=O)c1cc(NC(=O)NCC(=O)O)ccc1Cl	ZINC000819120553	CC	On-Demand	Anodyne	IMDH_CRYPV	29	49
NC(=O)Nc1cccc(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819120569	DE	On-Demand	Anodyne	PPIA	29	44
NC(=O)Nc1cccc(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819120569	DE	On-Demand	Anodyne	ACR	46	38
NC(=O)Nc1cccc(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819120569	DE	On-Demand	Anodyne	AKR1C3	38	41
NC(=O)Nc1cccc(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819120569	DE	On-Demand	Anodyne	KCNK3	80	37
NC(=O)Nc1cccc(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819120569	DE	On-Demand	Anodyne	KCNK9	43	33
NC(=O)c1c[nH]c(C(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819120570	CB	On-Demand	Anodyne	L3MBTL3	56	35
NC(=O)c1c[nH]c(C(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819120571	CB	On-Demand	Anodyne	L3MBTL3	56	35
NC(=O)c1ccc(NCc2ccc(C(=O)O)cc2)cc1F	ZINC000819120575	CE	On-Demand	Anodyne	UL80	22	46
NC(=O)c1ccc(NCc2ccc(C(=O)O)cc2)cc1F	ZINC000819120575	CE	On-Demand	Anodyne	STAT6	53	37
NC(=O)c1ccc(NCc2ccc(C(=O)O)cc2)cc1F	ZINC000819120575	CE	On-Demand	Anodyne	DRTS_TRYCR	47	35
NC(=O)c1ccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819120576	CC	On-Demand	Anodyne	EPHX2	16	46
NC(=O)c1ccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819120576	CC	On-Demand	Anodyne	DPP7	55	35
NC(=O)c1ccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819120576	CC	On-Demand	Anodyne	TPSAB1	17	48
NC(=O)c1ccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819120576	CC	On-Demand	Anodyne	PROC	62	34
NC(=O)c1ccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819120576	CC	On-Demand	Anodyne	L3MBTL3	43	34
NC(=O)c1ccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819120576	CC	On-Demand	Anodyne	NAMPT	39	41
NC(=O)c1ccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819120576	CC	On-Demand	Anodyne	TMPRSS11D	62	33
NC(=O)c1ccc(CNC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819120577	CC	On-Demand	Anodyne	EPHX2	16	46
NC(=O)c1ccc(CNC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819120577	CC	On-Demand	Anodyne	DPP7	55	35
NC(=O)c1ccc(CNC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819120577	CC	On-Demand	Anodyne	TPSAB1	17	48
NC(=O)c1ccc(CNC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819120577	CC	On-Demand	Anodyne	PROC	62	34
NC(=O)c1ccc(CNC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819120577	CC	On-Demand	Anodyne	L3MBTL3	43	34
NC(=O)c1ccc(CNC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819120577	CC	On-Demand	Anodyne	NAMPT	39	41
NC(=O)c1ccc(CNC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819120577	CC	On-Demand	Anodyne	TMPRSS11D	62	33
NC(=O)c1ccc(NC(=O)NCc2ccc(C(=O)O)cc2)c(F)c1	ZINC000819120579	ED	On-Demand	Anodyne	TRPV1	19	43
NC(=O)c1ccc(NC(=O)N2CCC[C@H](CC(=O)O)C2)cc1F	ZINC000819120580	DD	On-Demand	Anodyne	EPHX2	15	45
NC(=O)c1ccc(NC(=O)N2CCC[C@@H](CC(=O)O)C2)cc1F	ZINC000819120581	DD	On-Demand	Anodyne	EPHX2	15	45
NC(=O)c1ccc(N2CCN(C(=O)NCc3ccc(C(=O)O)cc3)CC2)nc1	ZINC000819120582	GC	On-Demand	Anodyne	HDAC1	16	46
NC(=O)c1ccc(N2CCN(C(=O)NCc3ccc(C(=O)O)cc3)CC2)nc1	ZINC000819120582	GC	On-Demand	Anodyne	SCD1	18	43
NC(=O)c1ccc(N2CCN(C(=O)NCc3ccc(C(=O)O)cc3)CC2)nc1	ZINC000819120582	GC	On-Demand	Anodyne	SCD	16	43
NC(=O)c1ccc(N2CCN(C(=O)NCc3ccc(C(=O)O)cc3)CC2)nc1	ZINC000819120582	GC	On-Demand	Anodyne	SMO	15	53
NC(=O)c1ccc(NC(=O)CCN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819120585	ED	On-Demand	Anodyne	SLC6A1	54	33
NC(=O)c1ccc(NC(=O)CCN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819120585	ED	On-Demand	Anodyne	CCR3	59	39
NC(=O)c1ccc(NC(=O)CCN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819120586	ED	On-Demand	Anodyne	SLC6A1	54	33
NC(=O)c1ccc(NC(=O)CCN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819120586	ED	On-Demand	Anodyne	CCR3	59	39
NC(=O)c1cc(NC(=O)NCc2ccc(C(=O)O)cc2)ccc1Cl	ZINC000819120589	EE	On-Demand	Anodyne	ROCK2	17	50
NC(=O)c1cc(NC(=O)NCc2ccc(C(=O)O)cc2)ccc1Cl	ZINC000819120589	EE	On-Demand	Anodyne	EPHX2	17	45
NC(=O)c1cc(NC(=O)NCc2ccc(C(=O)O)cc2)ccc1Cl	ZINC000819120589	EE	On-Demand	Anodyne	F7	24	51
NC(=O)c1cc(NC(=O)NCc2ccc(C(=O)O)cc2)ccc1Cl	ZINC000819120589	EE	On-Demand	Anodyne	NCE103	16	43
NC(=O)c1cc(NC(=O)NCc2ccc(C(=O)O)cc2)ccc1Cl	ZINC000819120589	EE	On-Demand	Anodyne	PRMT3	49	39
NC(=O)c1cc(NC(=O)NCc2ccc(C(=O)O)cc2)ccc1Cl	ZINC000819120589	EE	On-Demand	Anodyne	IMDH_CRYPV	38	49
NC(=O)c1cc(NC(=O)NCc2ccc(C(=O)O)cc2)ccc1Cl	ZINC000819120589	EE	On-Demand	Anodyne	NAMPT	28	40
NC(=O)c1cc(NC(=O)NCc2ccc(C(=O)O)cc2)ccc1Cl	ZINC000819120589	EE	On-Demand	Anodyne	RPA1	65	34
NC(=O)NCCCCC(=O)N1CCC[C@@H]1C(=O)O	ZINC000819120590	CB	On-Demand	Anodyne	F2	18	40
NC(=O)NCCCCC(=O)N1CCC[C@@H]1C(=O)O	ZINC000819120590	CB	On-Demand	Anodyne	ACE	56	56
NC(=O)NCCCCC(=O)N1CCC[C@@H]1C(=O)O	ZINC000819120590	CB	On-Demand	Anodyne	PREP	57	51
NC(=O)NCCCCC(=O)N1CCC[C@@H]1C(=O)O	ZINC000819120590	CB	On-Demand	Anodyne	MVD	15	45
NC(=O)NCCCCC(=O)N1CCC[C@@H]1C(=O)O	ZINC000819120590	CB	On-Demand	Anodyne	SLC5A1	19	40
NC(=O)NCCCCC(=O)N1CCC[C@@H]1C(=O)O	ZINC000819120590	CB	On-Demand	Anodyne	TPP2	30	41
NC(=O)NCCCCC(=O)N1CCC[C@H]1C(=O)O	ZINC000819120591	CB	On-Demand	Anodyne	F2	18	40
NC(=O)NCCCCC(=O)N1CCC[C@H]1C(=O)O	ZINC000819120591	CB	On-Demand	Anodyne	ACE	56	56
NC(=O)NCCCCC(=O)N1CCC[C@H]1C(=O)O	ZINC000819120591	CB	On-Demand	Anodyne	PREP	57	51
NC(=O)NCCCCC(=O)N1CCC[C@H]1C(=O)O	ZINC000819120591	CB	On-Demand	Anodyne	MVD	15	45
NC(=O)NCCCCC(=O)N1CCC[C@H]1C(=O)O	ZINC000819120591	CB	On-Demand	Anodyne	SLC5A1	19	40
NC(=O)NCCCCC(=O)N1CCC[C@H]1C(=O)O	ZINC000819120591	CB	On-Demand	Anodyne	TPP2	30	41
NC(=O)c1ccc(NC(=O)Nc2cccc(CC(=O)O)c2)c(F)c1	ZINC000819120593	EE	On-Demand	Anodyne	PPIA	32	42
NC(=O)c1ccc(NC(=O)Nc2cccc(CC(=O)O)c2)c(F)c1	ZINC000819120593	EE	On-Demand	Anodyne	CCR3	25	46
NC(=O)c1ccc(NC(=O)Nc2cccc(CC(=O)O)c2)c(F)c1	ZINC000819120593	EE	On-Demand	Anodyne	CA5B	20	41
NC(=O)c1ccc(NC(=O)Nc2cccc(CC(=O)O)c2)c(F)c1	ZINC000819120593	EE	On-Demand	Anodyne	CA5A	23	41
NC(=O)c1ccc(NC(=O)Nc2cccc(CC(=O)O)c2)c(F)c1	ZINC000819120593	EE	On-Demand	Anodyne	ROCK2	30	49
NC(=O)c1ccc(NC(=O)NCC(=O)O)cc1F	ZINC000819120597	CC	On-Demand	Anodyne	F7	23	47
NC(=O)c1ccc(NC(=O)NCC(=O)O)cc1F	ZINC000819120597	CC	On-Demand	Anodyne	PRMT3	63	39
NC(=O)Nc1ccc(C(=O)OC[C@H]2CCCN2CC(=O)O)cc1	ZINC000819120599	DC	On-Demand	Anodyne	ACR	57	36
NC(=O)Nc1ccc(C(=O)OC[C@@H]2CCCN2CC(=O)O)cc1	ZINC000819120600	DC	On-Demand	Anodyne	ACR	57	36
NC(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819120601	CD	On-Demand	Anodyne	SRD5A2	18	43
NC(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819120601	CD	On-Demand	Anodyne	ACR	43	37
NC(=O)c1ccc(CN(C(=O)NCCCC(=O)O)C2CC2)cc1	ZINC000819120603	DD	On-Demand	Anodyne	GCGR	27	45
NC(=O)c1ccc(CN(C(=O)NCCCC(=O)O)C2CC2)cc1	ZINC000819120603	DD	On-Demand	Anodyne	GIPR	50	44
NC(=O)c1ccc(-c2nc(CN3CC[C@@H](C(=O)O)C3)cs2)cc1	ZINC000819120608	ED	On-Demand	Anodyne	SLC6A1	76	35
NC(=O)c1ccc(-c2nc(CN3CC[C@@H](C(=O)O)C3)cs2)cc1	ZINC000819120608	ED	On-Demand	Anodyne	S1PR1	36	42
NC(=O)c1ccc(-c2nc(CN3CC[C@H](C(=O)O)C3)cs2)cc1	ZINC000819120610	ED	On-Demand	Anodyne	SLC6A1	76	35
NC(=O)c1ccc(-c2nc(CN3CC[C@H](C(=O)O)C3)cs2)cc1	ZINC000819120610	ED	On-Demand	Anodyne	S1PR1	36	42
NC(=O)c1ccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)cn1	ZINC000819120612	CB	On-Demand	Anodyne	NAMPT	42	37
NC(=O)c1ccc(CNC(=O)N2CC[C@H](C(=O)O)C2)cn1	ZINC000819120613	CB	On-Demand	Anodyne	NAMPT	42	37
O=C(c1coc(=O)c2ccccc12)N1CCC(C2CCCCC2)CC1	ZINC000819120697	EI	On-Demand	Anodyne	L3MBTL3	68	49
C=CCCn1cc(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(OC)c2)nn1	ZINC000819120701	GG	On-Demand	Mild	ENPP1	65	30
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2cccc(Cl)c2Cl)CC1	ZINC000819120739	GG	On-Demand	Anodyne	P2RX7	31	43
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2cccc(Cl)c2Cl)CC1	ZINC000819120739	GG	On-Demand	Anodyne	L3MBTL3	59	38
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(Cl)c2Cl)CC1	ZINC000819120741	GG	On-Demand	Anodyne	P2RX7	31	43
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(Cl)c2Cl)CC1	ZINC000819120741	GG	On-Demand	Anodyne	L3MBTL3	59	38
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2cccc(Cl)c2Cl)CC1	ZINC000819120745	GG	On-Demand	Anodyne	P2RX7	31	43
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2cccc(Cl)c2Cl)CC1	ZINC000819120745	GG	On-Demand	Anodyne	L3MBTL3	59	38
NC(=O)c1ccc(N2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)cc1	ZINC000819120746	GD	On-Demand	Anodyne	PRNP	43	38
NC(=O)c1ccc(N2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)cc1	ZINC000819120746	GD	On-Demand	Anodyne	FAAH	15	41
O=C(CCNCCOC1CCC1)Nc1cccc(Br)c1	ZINC000819120748	EF	On-Demand	Anodyne	HDAC2	15	40
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(Cl)c2Cl)CC1	ZINC000819120749	GG	On-Demand	Anodyne	P2RX7	31	43
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(Cl)c2Cl)CC1	ZINC000819120749	GG	On-Demand	Anodyne	L3MBTL3	59	38
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(C(=O)N2CCOCC2)c1	ZINC000819120753	ED	On-Demand	Anodyne	ITGAL	44	35
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(C(=O)N2CCOCC2)c1	ZINC000819120753	ED	On-Demand	Anodyne	EPHX2	20	53
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(C(=O)N2CCOCC2)c1	ZINC000819120758	ED	On-Demand	Anodyne	ITGAL	44	35
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(C(=O)N2CCOCC2)c1	ZINC000819120758	ED	On-Demand	Anodyne	EPHX2	20	53
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(C(=O)N2CCOCC2)c1	ZINC000819120763	ED	On-Demand	Anodyne	ITGAL	44	35
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(C(=O)N2CCOCC2)c1	ZINC000819120763	ED	On-Demand	Anodyne	EPHX2	20	53
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(C(=O)N2CCOCC2)c1	ZINC000819120767	ED	On-Demand	Anodyne	ITGAL	44	35
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(C(=O)N2CCOCC2)c1	ZINC000819120767	ED	On-Demand	Anodyne	EPHX2	20	53
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819120773	DH	On-Demand	Anodyne	PDS	47	34
O[C@@H](CNCCOC1CCC1)c1ccc(OC(F)(F)F)cc1	ZINC000819120806	DF	On-Demand	Anodyne	ADRB1	35	42
O[C@@H](CNCCOC1CCC1)c1ccc(OC(F)(F)F)cc1	ZINC000819120806	DF	On-Demand	Anodyne	ADRB3	28	42
O[C@H](CNCCOC1CCC1)c1ccc(OC(F)(F)F)cc1	ZINC000819120808	DF	On-Demand	Anodyne	ADRB1	35	42
O[C@H](CNCCOC1CCC1)c1ccc(OC(F)(F)F)cc1	ZINC000819120808	DF	On-Demand	Anodyne	ADRB3	28	42
O[C@@H](CNCCOC1CCC1)c1ccccc1C(F)(F)F	ZINC000819120809	DF	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CNCCOC1CCC1)c1ccccc1C(F)(F)F	ZINC000819120810	DF	On-Demand	Anodyne	ADRB1	22	40
CS(=O)(=O)c1ccc([C@H](O)CNCCCCC2CCCC2)cc1	ZINC000819120823	EG	On-Demand	Anodyne	ADRB2	38	47
CS(=O)(=O)c1ccc([C@H](O)CNCCCCC2CCCC2)cc1	ZINC000819120823	EG	On-Demand	Anodyne	ADRB1	30	42
CS(=O)(=O)c1ccc([C@H](O)CNCCCCC2CCCC2)cc1	ZINC000819120823	EG	On-Demand	Anodyne	ADRB3	60	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCC2CCCC2)cc1	ZINC000819120825	EG	On-Demand	Anodyne	ADRB2	38	47
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCC2CCCC2)cc1	ZINC000819120825	EG	On-Demand	Anodyne	ADRB1	30	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCC2CCCC2)cc1	ZINC000819120825	EG	On-Demand	Anodyne	ADRB3	60	42
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120835	ED	On-Demand	Anodyne	PIK3CA	20	43
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120835	ED	On-Demand	Anodyne	MTOR	35	43
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120835	ED	On-Demand	Anodyne	EPHX2	16	53
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120835	ED	On-Demand	Anodyne	PIK3CG	19	43
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120835	ED	On-Demand	Anodyne	L3MBTL3	67	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120837	ED	On-Demand	Anodyne	PIK3CA	20	43
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120837	ED	On-Demand	Anodyne	MTOR	35	43
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120837	ED	On-Demand	Anodyne	EPHX2	16	53
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120837	ED	On-Demand	Anodyne	PIK3CG	19	43
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120837	ED	On-Demand	Anodyne	L3MBTL3	67	41
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120839	ED	On-Demand	Anodyne	PIK3CA	20	43
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120839	ED	On-Demand	Anodyne	MTOR	35	43
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120839	ED	On-Demand	Anodyne	EPHX2	16	53
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120839	ED	On-Demand	Anodyne	PIK3CG	19	43
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120839	ED	On-Demand	Anodyne	L3MBTL3	67	41
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120841	ED	On-Demand	Anodyne	PIK3CA	20	43
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120841	ED	On-Demand	Anodyne	MTOR	35	43
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120841	ED	On-Demand	Anodyne	EPHX2	16	53
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120841	ED	On-Demand	Anodyne	PIK3CG	19	43
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819120841	ED	On-Demand	Anodyne	L3MBTL3	67	41
NC(=O)NCc1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819120892	ED	On-Demand	Anodyne	FURIN	40	32
NC(=O)NCc1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819120892	ED	On-Demand	Anodyne	TPSAB1	23	41
NC(=O)c1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819120894	FC	On-Demand	Anodyne	HDAC1	27	42
NC(=O)c1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819120894	FC	On-Demand	Anodyne	FURIN	52	36
NC(=O)c1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819120894	FC	On-Demand	Anodyne	PROC	46	36
NC(=O)c1ccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1Cl	ZINC000819120907	ED	On-Demand	Anodyne	SLC6A1	158	46
NC(=O)c1ccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1Cl	ZINC000819120907	ED	On-Demand	Anodyne	MAPK1	22	40
NC(=O)c1ccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1Cl	ZINC000819120907	ED	On-Demand	Anodyne	TERT	17	41
NC(=O)c1ccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)cc1Cl	ZINC000819120911	ED	On-Demand	Anodyne	SLC6A1	158	46
NC(=O)c1ccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)cc1Cl	ZINC000819120911	ED	On-Demand	Anodyne	MAPK1	22	40
NC(=O)c1ccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)cc1Cl	ZINC000819120911	ED	On-Demand	Anodyne	TERT	17	41
Cc1cc(N2CC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819120921	ED	On-Demand	Anodyne	ADRB1	27	41
Cc1cc(N2CC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819120921	ED	On-Demand	Anodyne	ADRB3	43	41
Cc1cc(N2CC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819120921	ED	On-Demand	Anodyne	IGF1R	31	41
Cc1cc(N2CC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819120921	ED	On-Demand	Anodyne	CYP3A4	51	39
NC(=O)c1ccc(CNCc2ccc(C(=O)O)cc2)cc1	ZINC000819120924	CD	On-Demand	Anodyne	SRD5A2	15	41
NC(=O)c1ccc(N2CCN(C(=O)NCCC(=O)O)CC2)nc1	ZINC000819120926	DB	On-Demand	Anodyne	SCD1	17	42
NC(=O)c1ccc(N2CCN(C(=O)NCCC(=O)O)CC2)nc1	ZINC000819120926	DB	On-Demand	Anodyne	SCD	15	42
Cc1cc(N2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819120927	ED	On-Demand	Anodyne	ADRB1	27	41
Cc1cc(N2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819120927	ED	On-Demand	Anodyne	ADRB3	43	41
Cc1cc(N2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819120927	ED	On-Demand	Anodyne	IGF1R	31	41
Cc1cc(N2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819120927	ED	On-Demand	Anodyne	CYP3A4	51	39
NC(=O)c1ccc(OCCC(=O)OCC(=O)O)cc1	ZINC000819120938	CC	On-Demand	Anodyne	LTA4H	23	40
NC(=O)c1ccc(OCCC(=O)OCC(=O)O)cc1	ZINC000819120938	CC	On-Demand	Anodyne	PLA2G4B	87	38
NC(=O)c1ccc(OCCC(=O)OCC(=O)O)cc1	ZINC000819120938	CC	On-Demand	Anodyne	ACR	30	41
NC(=O)c1ccc(OCCC(=O)OCC(=O)O)cc1	ZINC000819120938	CC	On-Demand	Anodyne	SLC47A1	18	41
NC(=O)c1ccc(CNC(=O)NCc2ccc(C(=O)O)cc2)cn1	ZINC000819120941	EC	On-Demand	Anodyne	NAMPT	23	41
NC(=O)c1cc(NC(=O)NCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819120944	ED	On-Demand	Anodyne	EPHX2	17	41
NC(=O)c1cc(NC(=O)NCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819120944	ED	On-Demand	Anodyne	F7	23	40
NC(=O)c1cc(NC(=O)NCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819120944	ED	On-Demand	Anodyne	PRMT3	49	38
NC(=O)c1ccc(NC(=S)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819120946	DD	On-Demand	Anodyne	NPY2R	21	40
NC(=O)c1ccc(NC(=S)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819120948	DD	On-Demand	Anodyne	NPY2R	21	40
NC(=O)c1ccc(N2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)nc1	ZINC000819120956	GD	On-Demand	Anodyne	HDAC1	22	52
NC(=O)c1ccc(N2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)nc1	ZINC000819120956	GD	On-Demand	Anodyne	SMO	19	50
NC(=O)c1ccc(N2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)nc1	ZINC000819120956	GD	On-Demand	Anodyne	DGAT1	31	45
C[C@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccc(Cl)cc1	ZINC000819120959	DH	On-Demand	Anodyne	ADRB1	30	43
C[C@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccc(Cl)cc1	ZINC000819120959	DH	On-Demand	Anodyne	SLC6A2	15	44
C[C@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccc(Cl)cc1	ZINC000819120959	DH	On-Demand	Anodyne	ADRB3	48	43
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccc(Cl)cc1	ZINC000819120962	DH	On-Demand	Anodyne	ADRB1	30	43
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccc(Cl)cc1	ZINC000819120962	DH	On-Demand	Anodyne	SLC6A2	15	44
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccc(Cl)cc1	ZINC000819120962	DH	On-Demand	Anodyne	ADRB3	48	43
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccc(Cl)cc1	ZINC000819120965	DH	On-Demand	Anodyne	ADRB1	30	43
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccc(Cl)cc1	ZINC000819120965	DH	On-Demand	Anodyne	SLC6A2	15	44
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccc(Cl)cc1	ZINC000819120965	DH	On-Demand	Anodyne	ADRB3	48	43
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccc(Cl)cc1	ZINC000819120968	DH	On-Demand	Anodyne	ADRB1	30	43
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccc(Cl)cc1	ZINC000819120968	DH	On-Demand	Anodyne	SLC6A2	15	44
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccc(Cl)cc1	ZINC000819120968	DH	On-Demand	Anodyne	ADRB3	48	43
NC(=O)c1cc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819120969	FC	On-Demand	Anodyne	STAT6	47	31
NC(=O)c1ccc(NC(=O)NC2(C(=O)O)CCCC2)cc1F	ZINC000819120994	DD	On-Demand	Anodyne	RARA	15	40
NC(=O)c1ccc(NC(=O)CCN2CCC[C@H](CC(=O)O)C2)cc1Cl	ZINC000819120996	FD	On-Demand	Anodyne	SLC6A1	74	39
NC(=O)c1ccc(NC(=O)CCN2CCC[C@H](CC(=O)O)C2)cc1Cl	ZINC000819120996	FD	On-Demand	Anodyne	CCR3	42	34
NC(=O)c1ccc(NC(=O)CCN2CCC[C@@H](CC(=O)O)C2)cc1Cl	ZINC000819120997	FD	On-Demand	Anodyne	SLC6A1	74	39
NC(=O)c1ccc(NC(=O)CCN2CCC[C@@H](CC(=O)O)C2)cc1Cl	ZINC000819120997	FD	On-Demand	Anodyne	CCR3	42	34
NC(=O)c1ccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819121000	DC	On-Demand	Anodyne	SLC6A1	154	40
NC(=O)c1ccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819121000	DC	On-Demand	Anodyne	LTA4H	28	40
NC(=O)c1ccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819121000	DC	On-Demand	Anodyne	TERT	16	41
NC(=O)c1ccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819121000	DC	On-Demand	Anodyne	CYP2J2	43	30
NC(=O)c1ccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819121002	DC	On-Demand	Anodyne	SLC6A1	154	40
NC(=O)c1ccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819121002	DC	On-Demand	Anodyne	LTA4H	28	40
NC(=O)c1ccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819121002	DC	On-Demand	Anodyne	TERT	16	41
NC(=O)c1ccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819121002	DC	On-Demand	Anodyne	CYP2J2	43	30
NC(=O)c1cc(NC(=O)NCCC(=O)O)ccc1Cl	ZINC000819121004	CD	On-Demand	Anodyne	PRMT3	51	33
NC(=O)c1cc(NC(=O)NCCC(=O)O)ccc1Cl	ZINC000819121004	CD	On-Demand	Anodyne	IMDH_CRYPV	23	47
O[C@@H](CNCCOC1CCC1)c1cccc2ccccc12	ZINC000819121005	CG	On-Demand	Anodyne	ADRB2	30	40
O[C@@H](CNCCOC1CCC1)c1cccc2ccccc12	ZINC000819121005	CG	On-Demand	Anodyne	ADRB1	35	40
O[C@@H](CNCCOC1CCC1)c1cccc2ccccc12	ZINC000819121005	CG	On-Demand	Anodyne	ADRB3	15	40
O[C@H](CNCCOC1CCC1)Cc1ccc(C(F)(F)F)cc1	ZINC000819121007	DF	On-Demand	Anodyne	ADRB1	23	51
O[C@@H](CNCCOC1CCC1)Cc1ccc(C(F)(F)F)cc1	ZINC000819121008	DF	On-Demand	Anodyne	ADRB1	23	51
NC(=O)c1c(Cl)cccc1NC(=O)C1=NN(c2ccccc2)[C@H](C(=O)O)C1	ZINC000819121010	GE	On-Demand	Anodyne	EPHB3	45	32
NC(=O)c1c(Cl)cccc1NC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)O)C1	ZINC000819121012	GE	On-Demand	Anodyne	EPHB3	45	32
CC(=O)Nc1ccc(OC[C@@H](O)CNCCOC2CCC2)cc1	ZINC000819121022	DD	On-Demand	Anodyne	ADRB2	64	60
CC(=O)Nc1ccc(OC[C@@H](O)CNCCOC2CCC2)cc1	ZINC000819121022	DD	On-Demand	Anodyne	ADRB1	112	65
CC(=O)Nc1ccc(OC[C@@H](O)CNCCOC2CCC2)cc1	ZINC000819121022	DD	On-Demand	Anodyne	GRIN1	20	42
CC(=O)Nc1ccc(OC[C@@H](O)CNCCOC2CCC2)cc1	ZINC000819121022	DD	On-Demand	Anodyne	ADRB3	75	60
CC(=O)Nc1ccc(OC[C@H](O)CNCCOC2CCC2)cc1	ZINC000819121023	DD	On-Demand	Anodyne	ADRB2	64	60
CC(=O)Nc1ccc(OC[C@H](O)CNCCOC2CCC2)cc1	ZINC000819121023	DD	On-Demand	Anodyne	ADRB1	112	65
CC(=O)Nc1ccc(OC[C@H](O)CNCCOC2CCC2)cc1	ZINC000819121023	DD	On-Demand	Anodyne	GRIN1	20	42
CC(=O)Nc1ccc(OC[C@H](O)CNCCOC2CCC2)cc1	ZINC000819121023	DD	On-Demand	Anodyne	ADRB3	75	60
CN(C)C1(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCCC1	ZINC000819121024	FF	On-Demand	Mild	PAPA1_CARPA	45	51
O[C@@H](CNCCOC1CCC1)Cc1ccc2ccccc2c1	ZINC000819121028	CF	On-Demand	Anodyne	ADRB2	26	42
O[C@@H](CNCCOC1CCC1)Cc1ccc2ccccc2c1	ZINC000819121028	CF	On-Demand	Anodyne	ADRB1	48	45
O[C@@H](CNCCOC1CCC1)Cc1ccc2ccccc2c1	ZINC000819121028	CF	On-Demand	Anodyne	ADRB3	31	40
O[C@@H](CNCCOC1CCC1)Cc1ccc2ccccc2c1	ZINC000819121028	CF	On-Demand	Anodyne	CASR	39	43
NC(=O)c1ccc(CN(C(=O)NCc2ccc(C(=O)O)cc2)C2CC2)cc1	ZINC000819121029	FE	On-Demand	Anodyne	GCGR	24	42
NC(=O)c1ccc(CN(C(=O)NCc2ccc(C(=O)O)cc2)C2CC2)cc1	ZINC000819121029	FE	On-Demand	Anodyne	PROC	52	33
NC(=O)c1ccc(CN(C(=O)NCc2ccc(C(=O)O)cc2)C2CC2)cc1	ZINC000819121029	FE	On-Demand	Anodyne	GIPR	56	41
NC(=O)c1ccc(CN(C(=O)NCc2ccc(C(=O)O)cc2)C2CC2)cc1	ZINC000819121029	FE	On-Demand	Anodyne	TMPRSS11D	46	34
O[C@H](CNCCOC1CCC1)Cc1ccc2ccccc2c1	ZINC000819121032	CF	On-Demand	Anodyne	ADRB2	26	42
O[C@H](CNCCOC1CCC1)Cc1ccc2ccccc2c1	ZINC000819121032	CF	On-Demand	Anodyne	ADRB1	48	45
O[C@H](CNCCOC1CCC1)Cc1ccc2ccccc2c1	ZINC000819121032	CF	On-Demand	Anodyne	ADRB3	31	40
O[C@H](CNCCOC1CCC1)Cc1ccc2ccccc2c1	ZINC000819121032	CF	On-Demand	Anodyne	CASR	39	43
NC(=O)c1cc(C(=O)N2CC[C@H](C(=O)O)C2)c[nH]1	ZINC000819121041	CB	On-Demand	Anodyne	L3MBTL3	73	38
NC(=O)c1cc(C(=O)N2CC[C@@H](C(=O)O)C2)c[nH]1	ZINC000819121042	CB	On-Demand	Anodyne	L3MBTL3	73	38
NC(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819121051	ED	On-Demand	Anodyne	SRD5A2	17	50
NC(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819121051	ED	On-Demand	Anodyne	PLA2G4A	32	43
NC(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819121051	ED	On-Demand	Anodyne	PLA2G4B	68	47
NC(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819121051	ED	On-Demand	Anodyne	ACR	33	45
NC(=O)c1ccc(CNC(=O)Nc2cccc(CC(=O)O)c2)cn1	ZINC000819121052	ED	On-Demand	Anodyne	ROCK2	26	43
NC(=O)c1ccc(CNC(=O)Nc2cccc(CC(=O)O)c2)cn1	ZINC000819121052	ED	On-Demand	Anodyne	NAMPT	43	47
NC(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1Cl	ZINC000819121053	GD	On-Demand	Anodyne	RPA1	45	33
NC(=O)c1ccc(NC(=S)Nc2ccccc2CC(=O)O)cc1	ZINC000819121054	EE	On-Demand	Anodyne	CXCL8	34	40
NC(=O)c1ccc(NC(=S)Nc2ccccc2CC(=O)O)cc1	ZINC000819121054	EE	On-Demand	Anodyne	ACR	48	39
NC(=O)c1ccc(NC(=S)Nc2ccccc2CC(=O)O)cc1	ZINC000819121054	EE	On-Demand	Anodyne	PPO2	23	41
NC(=O)c1c[nH]c(C(=O)N2CCC[C@@H]2C(=O)O)c1	ZINC000819121056	CB	On-Demand	Anodyne	ACE	50	40
NC(=O)c1c[nH]c(C(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819121057	CB	On-Demand	Anodyne	ACE	50	40
NC(=O)c1cc(NC(=O)NCC(=O)O)ccc1F	ZINC000819121058	CC	On-Demand	Anodyne	F7	22	40
NC(=O)c1cc(NC(=O)NCC(=O)O)ccc1F	ZINC000819121058	CC	On-Demand	Anodyne	PRMT3	63	39
NC(=O)NC[C@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819121061	EC	On-Demand	Anodyne	F2	33	41
NC(=O)NC[C@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819121061	EC	On-Demand	Anodyne	DPP7	40	35
NC(=O)NC[C@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819121061	EC	On-Demand	Anodyne	TPSAB1	16	46
NC(=O)NC[C@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819121061	EC	On-Demand	Anodyne	PROC	50	39
NC(=O)NC[C@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819121061	EC	On-Demand	Anodyne	CACNA1I	44	33
NC(=O)NC[C@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819121061	EC	On-Demand	Anodyne	TMPRSS11D	67	36
NC(=O)NC[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819121062	EC	On-Demand	Anodyne	F2	33	41
NC(=O)NC[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819121062	EC	On-Demand	Anodyne	DPP7	40	35
NC(=O)NC[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819121062	EC	On-Demand	Anodyne	TPSAB1	16	46
NC(=O)NC[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819121062	EC	On-Demand	Anodyne	PROC	50	39
NC(=O)NC[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819121062	EC	On-Demand	Anodyne	CACNA1I	44	33
NC(=O)NC[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)O)cc2)C1	ZINC000819121062	EC	On-Demand	Anodyne	TMPRSS11D	67	36
NC(=O)c1ccc(CNC(=O)N2CCC[C@@H](CC(=O)O)C2)cn1	ZINC000819121065	DC	On-Demand	Anodyne	F2	15	47
NC(=O)c1ccc(CNC(=O)N2CCC[C@H](CC(=O)O)C2)cn1	ZINC000819121066	DC	On-Demand	Anodyne	F2	15	47
NC(=O)c1ccc(CNC(=O)Nc2ccccc2CC(=O)O)cn1	ZINC000819121067	ED	On-Demand	Anodyne	NAMPT	32	47
NC(=O)c1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)nc1	ZINC000819121070	CB	On-Demand	Anodyne	L3MBTL3	61	53
NC(=O)c1ccc(C(=O)N2CC[C@H](C(=O)O)C2)nc1	ZINC000819121071	CB	On-Demand	Anodyne	L3MBTL3	61	53
NC(=O)[C@@H]1Cc2ccccc2CN1CCC(=O)O	ZINC000819121072	BC	On-Demand	Anodyne	ACE	22	46
NC(=O)[C@@H]1Cc2ccccc2CN1CCC(=O)O	ZINC000819121072	BC	On-Demand	Anodyne	HTR7	17	45
NC(=O)[C@@H]1Cc2ccccc2CN1CCC(=O)O	ZINC000819121072	BC	On-Demand	Anodyne	PREP	25	42
NC(=O)[C@@H]1Cc2ccccc2CN1CCC(=O)O	ZINC000819121072	BC	On-Demand	Anodyne	CFTR	40	34
NC(=O)[C@@H]1Cc2ccccc2CN1CCC(=O)O	ZINC000819121072	BC	On-Demand	Anodyne	ADAM9	55	36
NC(=O)c1cc(NC(=O)N2CCC[C@H]2C(=O)O)ccc1Cl	ZINC000819121078	DD	On-Demand	Anodyne	ACE	47	37
NC(=O)c1cc(NC(=O)N2CCC[C@H]2C(=O)O)ccc1Cl	ZINC000819121078	DD	On-Demand	Anodyne	UL80	41	44
NC(=O)c1cc(NC(=O)N2CCC[C@@H]2C(=O)O)ccc1Cl	ZINC000819121082	DD	On-Demand	Anodyne	ACE	47	37
NC(=O)c1cc(NC(=O)N2CCC[C@@H]2C(=O)O)ccc1Cl	ZINC000819121082	DD	On-Demand	Anodyne	UL80	41	44
NC(=O)c1cc(S(=O)(=O)NCC(=O)Nc2ccccc2CC(=O)O)c[nH]1	ZINC000819121084	GB	On-Demand	Anodyne	CA5A	44	35
NC(=O)c1cc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)ccc1Cl	ZINC000819121085	GD	On-Demand	Anodyne	IMDH_CRYPV	23	43
NC(=O)c1cc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)ccc1Cl	ZINC000819121085	GD	On-Demand	Anodyne	RPA1	51	34
NC(=O)c1cc(NC(=O)N2CC[C@@H](C(=O)O)C2)ccc1Cl	ZINC000819121087	DD	On-Demand	Anodyne	NPY2R	34	40
NC(=O)c1cc(NC(=O)N2CC[C@@H](C(=O)O)C2)ccc1Cl	ZINC000819121087	DD	On-Demand	Anodyne	EPHX2	27	43
NC(=O)c1cc(NC(=O)N2CC[C@H](C(=O)O)C2)ccc1Cl	ZINC000819121089	DD	On-Demand	Anodyne	NPY2R	34	40
NC(=O)c1cc(NC(=O)N2CC[C@H](C(=O)O)C2)ccc1Cl	ZINC000819121089	DD	On-Demand	Anodyne	EPHX2	27	43
NC(=O)c1ccc(CN(C(=O)Nc2ccccc2CC(=O)O)C2CC2)cc1	ZINC000819121107	FF	On-Demand	Anodyne	GCGR	22	41
NC(=O)c1ccc(CN(C(=O)Nc2ccccc2CC(=O)O)C2CC2)cc1	ZINC000819121107	FF	On-Demand	Anodyne	GIPR	38	41
NC(=O)c1ccc(CNC(=O)NCCC(=O)O)cc1	ZINC000819121110	CC	On-Demand	Anodyne	FURIN	41	33
NC(=O)c1ccc(CNC(=O)NCCC(=O)O)cc1	ZINC000819121110	CC	On-Demand	Anodyne	TPSAB1	18	40
NC(=O)c1ccc(CNC(=O)NCCC(=O)O)cc1	ZINC000819121110	CC	On-Demand	Anodyne	PROC	56	35
NC(=O)c1cc(NC(=O)N2CCC[C@H](CC(=O)O)C2)ccc1Cl	ZINC000819121111	EE	On-Demand	Anodyne	EPHX2	15	44
NC(=O)c1cc(NC(=O)N2CCC[C@@H](CC(=O)O)C2)ccc1Cl	ZINC000819121112	EE	On-Demand	Anodyne	EPHX2	15	44
CCSCC[C@@H](C)NC[C@@H](O)c1cc(C)cc(C)c1	ZINC000819121121	CG	On-Demand	Anodyne	ADRB2	15	42
CCSCC[C@H](C)NC[C@@H](O)c1cc(C)cc(C)c1	ZINC000819121122	CG	On-Demand	Anodyne	ADRB2	15	42
CCSCC[C@H](C)NC[C@H](O)c1cc(C)cc(C)c1	ZINC000819121123	CG	On-Demand	Anodyne	ADRB2	15	42
CCSCC[C@@H](C)NC[C@H](O)c1cc(C)cc(C)c1	ZINC000819121124	CG	On-Demand	Anodyne	ADRB2	15	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCNC(=O)c1cccs1)C2	ZINC000819121161	FD	On-Demand	Anodyne	SIRT3	32	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCNC(=O)c1cccs1)C2	ZINC000819121161	FD	On-Demand	Anodyne	SIRT2	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCNC(=O)c1cccs1)C2	ZINC000819121161	FD	On-Demand	Anodyne	SIRT1	32	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCNC(=O)c1cccs1)C2	ZINC000819121162	FD	On-Demand	Anodyne	SIRT3	32	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCNC(=O)c1cccs1)C2	ZINC000819121162	FD	On-Demand	Anodyne	SIRT2	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCNC(=O)c1cccs1)C2	ZINC000819121162	FD	On-Demand	Anodyne	SIRT1	32	40
OC1CCN(c2ccc(CNC[C@H](O)c3cccc(Cl)c3)cc2F)CC1	ZINC000819121166	GG	On-Demand	Clean	ADRB1	29	45
OC1CCN(c2ccc(CNC[C@H](O)c3cccc(Cl)c3)cc2F)CC1	ZINC000819121166	GG	On-Demand	Clean	ADRB3	46	45
OC1CCN(c2ccc(CNC[C@H](O)c3cccc(Cl)c3)cc2F)CC1	ZINC000819121166	GG	On-Demand	Clean	IGF1R	24	40
OC1CCN(c2ccc(CNC[C@H](O)c3cccc(Cl)c3)cc2F)CC1	ZINC000819121166	GG	On-Demand	Clean	CYP3A4	46	40
OC1CCN(c2ccc(CNC[C@@H](O)c3cccc(Cl)c3)cc2F)CC1	ZINC000819121167	GG	On-Demand	Clean	ADRB1	29	45
OC1CCN(c2ccc(CNC[C@@H](O)c3cccc(Cl)c3)cc2F)CC1	ZINC000819121167	GG	On-Demand	Clean	ADRB3	46	45
OC1CCN(c2ccc(CNC[C@@H](O)c3cccc(Cl)c3)cc2F)CC1	ZINC000819121167	GG	On-Demand	Clean	IGF1R	24	40
OC1CCN(c2ccc(CNC[C@@H](O)c3cccc(Cl)c3)cc2F)CC1	ZINC000819121167	GG	On-Demand	Clean	CYP3A4	46	40
O=C(CCNCc1ccc(N2CCC(O)CC2)c(F)c1)Nc1cccc(F)c1	ZINC000819121185	GG	On-Demand	Clean	NPY2R	61	35
O=C(CCNCc1ccc(N2CCC(O)CC2)c(F)c1)Nc1cccc(F)c1	ZINC000819121185	GG	On-Demand	Clean	CCR3	53	38
C[C@@H](OC[C@@H](O)CNCCOC1CCC1)c1ccc(Cl)cc1	ZINC000819121229	EF	On-Demand	Anodyne	ADRB1	28	48
C[C@@H](OC[C@H](O)CNCCOC1CCC1)c1ccc(Cl)cc1	ZINC000819121231	EF	On-Demand	Anodyne	ADRB1	28	48
O[C@@H](CNCCOC1CCC1)c1ccc(Cl)c(F)c1	ZINC000819121253	CF	On-Demand	Anodyne	ADRB2	33	42
O[C@@H](CNCCOC1CCC1)c1ccc(Cl)c(F)c1	ZINC000819121253	CF	On-Demand	Anodyne	ADRB1	38	42
O[C@@H](CNCCOC1CCC1)c1ccc(Cl)c(F)c1	ZINC000819121253	CF	On-Demand	Anodyne	ADRB3	31	42
O[C@H](CNCCOC1CCC1)c1ccc(Cl)c(F)c1	ZINC000819121255	CF	On-Demand	Anodyne	ADRB2	33	42
O[C@H](CNCCOC1CCC1)c1ccc(Cl)c(F)c1	ZINC000819121255	CF	On-Demand	Anodyne	ADRB1	38	42
O[C@H](CNCCOC1CCC1)c1ccc(Cl)c(F)c1	ZINC000819121255	CF	On-Demand	Anodyne	ADRB3	31	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819121275	GH	On-Demand	Anodyne	PRNP	30	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819121275	GH	On-Demand	Anodyne	NR1H4	15	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819121275	GH	On-Demand	Anodyne	TAAR1	45	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819121275	GH	On-Demand	Anodyne	KCNK3	138	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819121275	GH	On-Demand	Anodyne	KCNK9	89	47
O[C@H](CNCCOC1CCC1)COc1c(Cl)cccc1Cl	ZINC000819121279	EF	On-Demand	Anodyne	ADRB2	41	49
O[C@H](CNCCOC1CCC1)COc1c(Cl)cccc1Cl	ZINC000819121279	EF	On-Demand	Anodyne	ADRB1	65	53
O[C@H](CNCCOC1CCC1)COc1c(Cl)cccc1Cl	ZINC000819121279	EF	On-Demand	Anodyne	ADRB3	39	40
O[C@@H](CNCCOC1CCC1)COc1c(Cl)cccc1Cl	ZINC000819121280	EF	On-Demand	Anodyne	ADRB2	41	49
O[C@@H](CNCCOC1CCC1)COc1c(Cl)cccc1Cl	ZINC000819121280	EF	On-Demand	Anodyne	ADRB1	65	53
O[C@@H](CNCCOC1CCC1)COc1c(Cl)cccc1Cl	ZINC000819121280	EF	On-Demand	Anodyne	ADRB3	39	40
O[C@H](CNCCOC1CCC1)CO[C@H]1CCCc2ccccc21	ZINC000819121293	DF	On-Demand	Anodyne	ADRB1	28	43
O[C@@H](CNCCOC1CCC1)CO[C@H]1CCCc2ccccc21	ZINC000819121295	DF	On-Demand	Anodyne	ADRB1	28	43
O[C@@H](CNCCOC1CCC1)CO[C@@H]1CCCc2ccccc21	ZINC000819121297	DF	On-Demand	Anodyne	ADRB1	28	43
O[C@H](CNCCOC1CCC1)CO[C@@H]1CCCc2ccccc21	ZINC000819121299	DF	On-Demand	Anodyne	ADRB1	28	43
COc1ccc(OC)c([C@H](O)CNCCOC2CCC2)c1	ZINC000819121303	CD	On-Demand	Anodyne	ADRB2	21	44
COc1ccc(OC)c([C@H](O)CNCCOC2CCC2)c1	ZINC000819121303	CD	On-Demand	Anodyne	ADRB1	31	43
COc1ccc(OC)c([C@H](O)CNCCOC2CCC2)c1	ZINC000819121303	CD	On-Demand	Anodyne	ADRB3	24	41
O[C@H](CNCCOC1CCC1)Cc1cccc(Cl)c1	ZINC000819121305	CE	On-Demand	Anodyne	ADRB2	18	52
O[C@H](CNCCOC1CCC1)Cc1cccc(Cl)c1	ZINC000819121305	CE	On-Demand	Anodyne	ADRB1	47	52
O[C@H](CNCCOC1CCC1)Cc1cccc(Cl)c1	ZINC000819121305	CE	On-Demand	Anodyne	ADRB3	34	41
O[C@@H](CNCCOC1CCC1)Cc1cccc(Cl)c1	ZINC000819121306	CE	On-Demand	Anodyne	ADRB2	18	52
O[C@@H](CNCCOC1CCC1)Cc1cccc(Cl)c1	ZINC000819121306	CE	On-Demand	Anodyne	ADRB1	47	52
O[C@@H](CNCCOC1CCC1)Cc1cccc(Cl)c1	ZINC000819121306	CE	On-Demand	Anodyne	ADRB3	34	41
COc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819121328	FG	On-Demand	Mild	PAPA1_CARPA	45	48
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCOC2CCC2)c1	ZINC000819121337	DD	On-Demand	Bother	ADRB2	44	50
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCOC2CCC2)c1	ZINC000819121337	DD	On-Demand	Bother	ADRB1	78	50
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCOC2CCC2)c1	ZINC000819121337	DD	On-Demand	Bother	ADRB3	52	50
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCOC2CCC2)c1	ZINC000819121338	DD	On-Demand	Bother	ADRB2	44	50
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCOC2CCC2)c1	ZINC000819121338	DD	On-Demand	Bother	ADRB1	78	50
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCOC2CCC2)c1	ZINC000819121338	DD	On-Demand	Bother	ADRB3	52	50
O[C@@H](CNCCOC1CCC1)c1cccc(Cl)c1	ZINC000819121340	CF	On-Demand	Anodyne	ADRB2	53	44
O[C@@H](CNCCOC1CCC1)c1cccc(Cl)c1	ZINC000819121340	CF	On-Demand	Anodyne	ADRB1	76	57
O[C@@H](CNCCOC1CCC1)c1cccc(Cl)c1	ZINC000819121340	CF	On-Demand	Anodyne	ADRB3	78	57
O[C@@H](CNCCOC1CCC1)c1cccc(Cl)c1	ZINC000819121340	CF	On-Demand	Anodyne	CYP3A4	43	38
O[C@H](CNCCOC1CCC1)c1cccc(Cl)c1	ZINC000819121341	CF	On-Demand	Anodyne	ADRB2	53	44
O[C@H](CNCCOC1CCC1)c1cccc(Cl)c1	ZINC000819121341	CF	On-Demand	Anodyne	ADRB1	76	57
O[C@H](CNCCOC1CCC1)c1cccc(Cl)c1	ZINC000819121341	CF	On-Demand	Anodyne	ADRB3	78	57
O[C@H](CNCCOC1CCC1)c1cccc(Cl)c1	ZINC000819121341	CF	On-Demand	Anodyne	CYP3A4	43	38
O[C@@H](CN[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)COc1ccccc1	ZINC000819121359	GG	On-Demand	Clean	ADRB2	34	45
O[C@@H](CN[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)COc1ccccc1	ZINC000819121359	GG	On-Demand	Clean	ADRB1	50	45
O[C@@H](CN[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)COc1ccccc1	ZINC000819121359	GG	On-Demand	Clean	ADRB3	38	51
O[C@H](CN[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)COc1ccccc1	ZINC000819121361	GG	On-Demand	Clean	ADRB2	34	45
O[C@H](CN[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)COc1ccccc1	ZINC000819121361	GG	On-Demand	Clean	ADRB1	50	45
O[C@H](CN[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)COc1ccccc1	ZINC000819121361	GG	On-Demand	Clean	ADRB3	38	51
O[C@H](CN[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)COc1ccccc1	ZINC000819121363	GG	On-Demand	Clean	ADRB2	34	45
O[C@H](CN[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)COc1ccccc1	ZINC000819121363	GG	On-Demand	Clean	ADRB1	50	45
O[C@H](CN[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)COc1ccccc1	ZINC000819121363	GG	On-Demand	Clean	ADRB3	38	51
O[C@@H](CN[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)COc1ccccc1	ZINC000819121365	GG	On-Demand	Clean	ADRB2	34	45
O[C@@H](CN[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)COc1ccccc1	ZINC000819121365	GG	On-Demand	Clean	ADRB1	50	45
O[C@@H](CN[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)COc1ccccc1	ZINC000819121365	GG	On-Demand	Clean	ADRB3	38	51
COc1cccc([S@](=O)CC(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)c1	ZINC000819121387	GE	On-Demand	Anodyne	MTNR1B	17	41
COc1cccc([S@](=O)CC(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)c1	ZINC000819121387	GE	On-Demand	Anodyne	EPHX2	20	41
COc1cccc([S@@](=O)CC(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)c1	ZINC000819121388	GE	On-Demand	Anodyne	MTNR1B	17	41
COc1cccc([S@@](=O)CC(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)c1	ZINC000819121388	GE	On-Demand	Anodyne	EPHX2	20	41
COC(=O)c1ccc(CCNC(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccccc2)cc1	ZINC000819121403	IG	On-Demand	Anodyne	OPRM1	30	55
COC(=O)c1ccc(CCNC(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccccc2)cc1	ZINC000819121403	IG	On-Demand	Anodyne	OPRD1	74	47
COC(=O)c1ccc(CCNC(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccccc2)cc1	ZINC000819121403	IG	On-Demand	Anodyne	PREP	15	41
COC(=O)c1ccc(CCNC(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccccc2)cc1	ZINC000819121403	IG	On-Demand	Anodyne	MMP3	19	40
COC(=O)c1ccc(CCNC(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccccc2)cc1	ZINC000819121403	IG	On-Demand	Anodyne	MMP8	16	40
COC(=O)c1ccc(CCNC(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccccc2)cc1	ZINC000819121403	IG	On-Demand	Anodyne	CFTR	89	51
COC(=O)c1ccc(CCNC(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccccc2)cc1	ZINC000819121403	IG	On-Demand	Anodyne	ADAM9	65	40
COC(=O)c1ccc(CCNC(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccccc2)cc1	ZINC000819121403	IG	On-Demand	Anodyne	MMP1	15	40
OC1CCN(Cc2ccccc2CNC[C@H](O)c2cc(F)ccc2F)CC1	ZINC000819121416	GF	On-Demand	Anodyne	SIGMAR1	16	44
OC1CCN(Cc2ccccc2CNC[C@@H](O)c2cc(F)ccc2F)CC1	ZINC000819121417	GF	On-Demand	Anodyne	SIGMAR1	16	44
OC1CCN(c2ccc(CNC[C@@H](O)COc3ccccc3)cc2F)CC1	ZINC000819121422	FE	On-Demand	Clean	ADRB2	42	42
OC1CCN(c2ccc(CNC[C@@H](O)COc3ccccc3)cc2F)CC1	ZINC000819121422	FE	On-Demand	Clean	ADRB1	72	41
OC1CCN(c2ccc(CNC[C@@H](O)COc3ccccc3)cc2F)CC1	ZINC000819121422	FE	On-Demand	Clean	ADRB3	52	44
OC1CCN(c2ccc(CNC[C@H](O)COc3ccccc3)cc2F)CC1	ZINC000819121423	FE	On-Demand	Clean	ADRB2	42	42
OC1CCN(c2ccc(CNC[C@H](O)COc3ccccc3)cc2F)CC1	ZINC000819121423	FE	On-Demand	Clean	ADRB1	72	41
OC1CCN(c2ccc(CNC[C@H](O)COc3ccccc3)cc2F)CC1	ZINC000819121423	FE	On-Demand	Clean	ADRB3	52	44
Cc1ccccc1CN1CCC(NC(=O)C(F)=C2CCC2)CC1	ZINC000819121444	DG	On-Demand	Anodyne	CHRM1	18	40
Cc1ccccc1CN1CCC(NC(=O)C(F)=C2CCC2)CC1	ZINC000819121444	DG	On-Demand	Anodyne	DRD4	22	57
Cc1ccccc1CN1CCC(NC(=O)C(F)=C2CCC2)CC1	ZINC000819121444	DG	On-Demand	Anodyne	SIGMAR1	24	48
Cc1ccccc1CN1CCC(NC(=O)C(F)=C2CCC2)CC1	ZINC000819121444	DG	On-Demand	Anodyne	CCR3	27	40
OC1CCN(Cc2ccccc2CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819121449	FG	On-Demand	Anodyne	SIGMAR1	19	40
Cc1ccccc1CN1CCC(NC(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819121452	EF	On-Demand	Anodyne	DRD4	21	54
Cc1ccccc1CN1CCC(NC(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819121452	EF	On-Demand	Anodyne	SIGMAR1	18	46
Cc1ccccc1CN1CCC(NC(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819121453	EF	On-Demand	Anodyne	DRD4	21	54
Cc1ccccc1CN1CCC(NC(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819121453	EF	On-Demand	Anodyne	SIGMAR1	18	46
Cc1ccccc1CN1CCC(NC(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819121454	EF	On-Demand	Anodyne	DRD4	21	54
Cc1ccccc1CN1CCC(NC(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819121454	EF	On-Demand	Anodyne	SIGMAR1	18	46
Cc1ccccc1CN1CCC(NC(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819121455	EF	On-Demand	Anodyne	DRD4	21	54
Cc1ccccc1CN1CCC(NC(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819121455	EF	On-Demand	Anodyne	SIGMAR1	18	46
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(C2CCCCC2)CC1	ZINC000819121466	FH	On-Demand	Anodyne	KCNJ1	62	43
O[C@H](CNCC1CCC2(CC1)OCCO2)Cc1cccc(Cl)c1	ZINC000819121489	EF	On-Demand	Anodyne	C5AR1	32	40
O[C@H](CN[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)Cc1ccccc1	ZINC000819121509	GG	On-Demand	Clean	ADRB3	18	41
O[C@@H](CN[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)Cc1ccccc1	ZINC000819121512	GG	On-Demand	Clean	ADRB3	18	41
O[C@H](CN[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1)Cc1ccccc1	ZINC000819121516	GG	On-Demand	Clean	ADRB3	18	41
O[C@@H](CN[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1)Cc1ccccc1	ZINC000819121520	GG	On-Demand	Clean	ADRB3	18	41
O[C@H](CNCCOC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819121542	EF	On-Demand	Anodyne	ADRB2	47	46
O[C@H](CNCCOC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819121542	EF	On-Demand	Anodyne	ADRB1	76	48
O[C@H](CNCCOC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819121542	EF	On-Demand	Anodyne	ADRB3	38	41
O[C@@H](CNCCOC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819121544	EF	On-Demand	Anodyne	ADRB2	47	46
O[C@@H](CNCCOC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819121544	EF	On-Demand	Anodyne	ADRB1	76	48
O[C@@H](CNCCOC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819121544	EF	On-Demand	Anodyne	ADRB3	38	41
N#CCc1ccc(OC[C@@H](O)CNCCOC2CCC2)cc1	ZINC000819121548	DD	On-Demand	Mild	ADRB2	54	49
N#CCc1ccc(OC[C@@H](O)CNCCOC2CCC2)cc1	ZINC000819121548	DD	On-Demand	Mild	ADRB1	92	54
N#CCc1ccc(OC[C@@H](O)CNCCOC2CCC2)cc1	ZINC000819121548	DD	On-Demand	Mild	ADRB3	57	47
N#CCc1ccc(OC[C@H](O)CNCCOC2CCC2)cc1	ZINC000819121549	DD	On-Demand	Mild	ADRB2	54	49
N#CCc1ccc(OC[C@H](O)CNCCOC2CCC2)cc1	ZINC000819121549	DD	On-Demand	Mild	ADRB1	92	54
N#CCc1ccc(OC[C@H](O)CNCCOC2CCC2)cc1	ZINC000819121549	DD	On-Demand	Mild	ADRB3	57	47
O[C@@H](CNCCOC1CCC1)COc1cccc2ccccc12	ZINC000819121598	DF	On-Demand	Anodyne	ADRB2	64	61
O[C@@H](CNCCOC1CCC1)COc1cccc2ccccc12	ZINC000819121598	DF	On-Demand	Anodyne	ADRB1	96	56
O[C@@H](CNCCOC1CCC1)COc1cccc2ccccc12	ZINC000819121598	DF	On-Demand	Anodyne	HTR1A	15	56
O[C@@H](CNCCOC1CCC1)COc1cccc2ccccc12	ZINC000819121598	DF	On-Demand	Anodyne	ADRB3	55	56
O[C@@H](CNCCOC1CCC1)COc1cccc2ccccc12	ZINC000819121598	DF	On-Demand	Anodyne	CYP2D6	21	48
O[C@@H](CNCCOC1CCC1)COc1cccc2ccccc12	ZINC000819121598	DF	On-Demand	Anodyne	ABCB1	20	43
O[C@H](CNCCOC1CCC1)COc1cccc2ccccc12	ZINC000819121599	DF	On-Demand	Anodyne	ADRB2	64	61
O[C@H](CNCCOC1CCC1)COc1cccc2ccccc12	ZINC000819121599	DF	On-Demand	Anodyne	ADRB1	96	56
O[C@H](CNCCOC1CCC1)COc1cccc2ccccc12	ZINC000819121599	DF	On-Demand	Anodyne	HTR1A	15	56
O[C@H](CNCCOC1CCC1)COc1cccc2ccccc12	ZINC000819121599	DF	On-Demand	Anodyne	ADRB3	55	56
O[C@H](CNCCOC1CCC1)COc1cccc2ccccc12	ZINC000819121599	DF	On-Demand	Anodyne	CYP2D6	21	48
O[C@H](CNCCOC1CCC1)COc1cccc2ccccc12	ZINC000819121599	DF	On-Demand	Anodyne	ABCB1	20	43
CC(=O)Nc1cccc(CC(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)c1	ZINC000819121607	GF	On-Demand	Anodyne	EPHX2	37	47
CC(=O)Nc1cccc(CC(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)c1	ZINC000819121607	GF	On-Demand	Anodyne	MCHR1	20	41
CC(=O)Nc1cccc(CC(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)c1	ZINC000819121607	GF	On-Demand	Anodyne	CCR8	45	34
CC(=O)Nc1cccc(CC(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)c1	ZINC000819121607	GF	On-Demand	Anodyne	GPR119	18	41
CC(=O)Nc1cccc(CC(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)c1	ZINC000819121607	GF	On-Demand	Anodyne	SFRP1	51	36
CC(=O)Nc1cccc(CC(=O)N2CCC(NC(=O)OC(C)(C)C)CC2)c1	ZINC000819121607	GF	On-Demand	Anodyne	WNT3	42	34
O=C(CCNCc1ccc(N2CCC(O)CC2)c(F)c1)Nc1ccccc1	ZINC000819121646	FF	On-Demand	Clean	NPY2R	70	40
O[C@H](CNCCOC1CCC1)Cc1ccccc1	ZINC000819121659	BD	On-Demand	Anodyne	ADRB2	26	44
O[C@H](CNCCOC1CCC1)Cc1ccccc1	ZINC000819121659	BD	On-Demand	Anodyne	ADRB1	48	47
O[C@H](CNCCOC1CCC1)Cc1ccccc1	ZINC000819121659	BD	On-Demand	Anodyne	ADRB3	27	40
O[C@H](CNCCOC1CCC1)Cc1ccccc1	ZINC000819121659	BD	On-Demand	Anodyne	TIMP3	59	36
O[C@@H](CNCCOC1CCC1)Cc1ccccc1	ZINC000819121665	BD	On-Demand	Anodyne	ADRB2	26	44
O[C@@H](CNCCOC1CCC1)Cc1ccccc1	ZINC000819121665	BD	On-Demand	Anodyne	ADRB1	48	47
O[C@@H](CNCCOC1CCC1)Cc1ccccc1	ZINC000819121665	BD	On-Demand	Anodyne	ADRB3	27	40
O[C@@H](CNCCOC1CCC1)Cc1ccccc1	ZINC000819121665	BD	On-Demand	Anodyne	TIMP3	59	36
O[C@@H](CNCC(C1CC1)C1CC1)c1cccnc1	ZINC000819121667	BE	On-Demand	Anodyne	ADRB2	21	45
O[C@@H](CNCC(C1CC1)C1CC1)c1cccnc1	ZINC000819121667	BE	On-Demand	Anodyne	ADRB1	23	44
O[C@@H](CNCC(C1CC1)C1CC1)c1cccnc1	ZINC000819121667	BE	On-Demand	Anodyne	ADRB3	94	46
O[C@H](CNCC(C1CC1)C1CC1)c1cccnc1	ZINC000819121669	BE	On-Demand	Anodyne	ADRB2	21	45
O[C@H](CNCC(C1CC1)C1CC1)c1cccnc1	ZINC000819121669	BE	On-Demand	Anodyne	ADRB1	23	44
O[C@H](CNCC(C1CC1)C1CC1)c1cccnc1	ZINC000819121669	BE	On-Demand	Anodyne	ADRB3	94	46
O[C@H](CNCCOC1CCC1)COc1ccc(Cl)cc1Br	ZINC000819121679	GG	On-Demand	Anodyne	ADRB2	24	48
O[C@H](CNCCOC1CCC1)COc1ccc(Cl)cc1Br	ZINC000819121679	GG	On-Demand	Anodyne	ADRB1	49	49
O[C@@H](CNCCOC1CCC1)COc1ccc(Cl)cc1Br	ZINC000819121681	GG	On-Demand	Anodyne	ADRB2	24	48
O[C@@H](CNCCOC1CCC1)COc1ccc(Cl)cc1Br	ZINC000819121681	GG	On-Demand	Anodyne	ADRB1	49	49
O=C1C[C@H](NC[C@H](O)c2ccc(F)cc2Cl)CN1[C@H]1C[C@@H]1c1ccccc1	ZINC000819121705	GG	On-Demand	Anodyne	SMO	16	40
O=C1C[C@H](NC[C@H](O)c2ccc(F)cc2Cl)CN1[C@H]1C[C@H]1c1ccccc1	ZINC000819121708	GG	On-Demand	Anodyne	SMO	16	40
O=C1C[C@H](NC[C@H](O)c2ccc(F)cc2Cl)CN1[C@@H]1C[C@H]1c1ccccc1	ZINC000819121710	GG	On-Demand	Anodyne	SMO	16	40
O=C1C[C@H](NC[C@H](O)c2ccc(F)cc2Cl)CN1[C@@H]1C[C@@H]1c1ccccc1	ZINC000819121713	GG	On-Demand	Anodyne	SMO	16	40
OC1CCN(Cc2ccccc2CNC[C@H](O)c2cccnc2)CC1	ZINC000819121720	ED	On-Demand	Anodyne	ADRB3	80	44
OC1CCN(Cc2ccccc2CNC[C@@H](O)c2cccnc2)CC1	ZINC000819121722	ED	On-Demand	Anodyne	ADRB3	80	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCNC(=O)c1cccs1	ZINC000819121724	FD	On-Demand	Anodyne	PAPA1_CARPA	26	42
N#Cc1ccc(OC[C@@H](O)CNCCOC2CCC2)cc1	ZINC000819121740	CD	On-Demand	Mild	ADRB2	52	51
N#Cc1ccc(OC[C@@H](O)CNCCOC2CCC2)cc1	ZINC000819121740	CD	On-Demand	Mild	ADRB1	86	52
N#Cc1ccc(OC[C@@H](O)CNCCOC2CCC2)cc1	ZINC000819121740	CD	On-Demand	Mild	ADRB3	51	45
N#Cc1ccc(OC[C@H](O)CNCCOC2CCC2)cc1	ZINC000819121745	CD	On-Demand	Mild	ADRB2	52	51
N#Cc1ccc(OC[C@H](O)CNCCOC2CCC2)cc1	ZINC000819121745	CD	On-Demand	Mild	ADRB1	86	52
N#Cc1ccc(OC[C@H](O)CNCCOC2CCC2)cc1	ZINC000819121745	CD	On-Demand	Mild	ADRB3	51	45
Cc1ccc(OC[C@@H](O)CNCCOC2CCC2)c(C)c1	ZINC000819121747	CE	On-Demand	Anodyne	ADRB2	39	49
Cc1ccc(OC[C@@H](O)CNCCOC2CCC2)c(C)c1	ZINC000819121747	CE	On-Demand	Anodyne	ADRB1	57	50
Cc1ccc(OC[C@H](O)CNCCOC2CCC2)c(C)c1	ZINC000819121749	CE	On-Demand	Anodyne	ADRB2	39	49
Cc1ccc(OC[C@H](O)CNCCOC2CCC2)c(C)c1	ZINC000819121749	CE	On-Demand	Anodyne	ADRB1	57	50
C[C@@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)c1cccc(-n2ccnc2)c1	ZINC000819121753	FF	On-Demand	Anodyne	CYP26A1	47	33
CON(C)C(=O)CCNCc1ccccc1CN1CCC(O)CC1	ZINC000819121756	ED	On-Demand	Anodyne	SIGMAR1	23	40
C[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)c1cccc(-n2ccnc2)c1	ZINC000819121761	FF	On-Demand	Anodyne	CYP26A1	47	33
COc1cccc([S@@](=O)CC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819121766	GE	On-Demand	Anodyne	MTNR1A	20	44
COc1cccc([S@@](=O)CC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819121766	GE	On-Demand	Anodyne	MTNR1B	25	44
COc1cccc([S@@](=O)CC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819121766	GE	On-Demand	Anodyne	EPHX2	22	44
COc1cccc([S@@](=O)CC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819121766	GE	On-Demand	Anodyne	GPR119	41	42
OC1CCN(Cc2ccccc2CNC[C@@H](O)C2CC2)CC1	ZINC000819121780	DD	On-Demand	Anodyne	SIGMAR1	16	44
OC1CCN(Cc2ccccc2CNC[C@H](O)C2CC2)CC1	ZINC000819121781	DD	On-Demand	Anodyne	SIGMAR1	16	44
C=C(Cl)CSc1nc(C)c(CC(=O)Nc2cccc(C)n2)s1	ZINC000819121813	FI	On-Demand	Mild	GRM5	15	42
CC(C)(C)OC(=O)NC1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819121822	GE	On-Demand	Anodyne	GPR119	26	42
CC(C)(C)OC(=O)NC1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819121822	GE	On-Demand	Anodyne	KCNJ1	49	36
C[C@H]1CN(c2ccc(NC(=O)c3cc4c(cn3)OCCO4)cc2F)C[C@@H](C)O1	ZINC000819121829	GF	On-Demand	Anodyne	NPY2R	68	36
C[C@H]1CN(c2ccc(NC(=O)c3cc4c(cn3)OCCO4)cc2F)C[C@H](C)O1	ZINC000819121831	GF	On-Demand	Anodyne	NPY2R	68	36
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819121836	DF	On-Demand	Anodyne	PIK3CA	17	42
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819121836	DF	On-Demand	Anodyne	MTOR	30	42
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819121836	DF	On-Demand	Anodyne	EPHX2	25	60
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819121836	DF	On-Demand	Anodyne	PIK3CG	15	42
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819121836	DF	On-Demand	Anodyne	L3MBTL3	43	36
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CC(=O)N2CCc3ccccc32)CC1	ZINC000819121871	FD	On-Demand	Anodyne	DRD4	18	50
O=C(/C=C\[C@H]1CCCO1)N1CCN(CC(=O)N2CCc3ccccc32)CC1	ZINC000819121874	FD	On-Demand	Anodyne	DRD4	18	50
CCOCCCNC(=O)c1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819121876	EG	On-Demand	Anodyne	DRD4	41	32
CCOCCCNC(=O)c1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819121876	EG	On-Demand	Anodyne	KCNK3	77	34
CCOCCCNC(=O)c1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819121876	EG	On-Demand	Anodyne	KCNK9	53	34
O=C(/C=C/[C@H]1CCCO1)N1CCN(CC(=O)N2CCc3ccccc32)CC1	ZINC000819121877	FD	On-Demand	Anodyne	DRD4	18	50
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CC(=O)N2CCc3ccccc32)CC1	ZINC000819121880	FD	On-Demand	Anodyne	DRD4	18	50
OC1CCN(Cc2ccccc2CNC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819121884	FF	On-Demand	Anodyne	SLC6A4	15	46
OC1CCN(Cc2ccccc2CNC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819121884	FF	On-Demand	Anodyne	SLC6A3	36	46
OC1CCN(Cc2ccccc2CNC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819121884	FF	On-Demand	Anodyne	SIGMAR1	22	50
OC1CCN(Cc2ccccc2CNC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819121885	FF	On-Demand	Anodyne	SLC6A4	15	46
OC1CCN(Cc2ccccc2CNC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819121885	FF	On-Demand	Anodyne	SLC6A3	36	46
OC1CCN(Cc2ccccc2CNC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819121885	FF	On-Demand	Anodyne	SIGMAR1	22	50
C[C@@H]1C[C@H](NC[C@@H](O)c2cccnc2)C(=O)N1c1cnn(C)c1	ZINC000819121907	DC	On-Demand	Anodyne	ADRB3	51	41
C[C@@H]1C[C@H](NC[C@H](O)c2cccnc2)C(=O)N1c1cnn(C)c1	ZINC000819121912	DC	On-Demand	Anodyne	ADRB3	51	41
C=CCC1(C(=O)Nc2cccc(OCC#N)c2)CCOCC1	ZINC000819121922	DF	On-Demand	Mild	EPHX2	17	40
C=CCC1(C(=O)Nc2cccc(OCC#N)c2)CCOCC1	ZINC000819121922	DF	On-Demand	Mild	LIMK2	22	43
NC(=O)CNC(=O)c1ccc(CNC(=O)C(F)=C2CCC2)cc1	ZINC000819121929	DC	On-Demand	Anodyne	PROC	42	32
COCC(=O)N1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819121958	GC	On-Demand	Mild	PAPA1_CARPA	34	45
COCC(=O)N1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819121959	GC	On-Demand	Mild	PAPA1_CARPA	34	45
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1cccc(C#N)c1	ZINC000819121979	FG	On-Demand	Mild	GPR119	39	47
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1cccc(C#N)c1	ZINC000819121981	FG	On-Demand	Mild	GPR119	39	47
OC1CCN(c2ccc(CNC[C@H](O)COc3ccccc3F)cc2F)CC1	ZINC000819121986	GE	On-Demand	Clean	ADRB2	20	41
OC1CCN(c2ccc(CNC[C@H](O)COc3ccccc3F)cc2F)CC1	ZINC000819121986	GE	On-Demand	Clean	ADRB1	27	42
OC1CCN(c2ccc(CNC[C@H](O)COc3ccccc3F)cc2F)CC1	ZINC000819121986	GE	On-Demand	Clean	ADRB3	17	41
OC1CCN(c2ccc(CNC[C@@H](O)COc3ccccc3F)cc2F)CC1	ZINC000819121987	GE	On-Demand	Clean	ADRB2	20	41
OC1CCN(c2ccc(CNC[C@@H](O)COc3ccccc3F)cc2F)CC1	ZINC000819121987	GE	On-Demand	Clean	ADRB1	27	42
OC1CCN(c2ccc(CNC[C@@H](O)COc3ccccc3F)cc2F)CC1	ZINC000819121987	GE	On-Demand	Clean	ADRB3	17	41
Cn1ncnc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819122008	CD	On-Demand	Anodyne	ADRB1	28	41
Cn1ncnc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819122008	CD	On-Demand	Anodyne	ADRB3	42	41
Cn1ncnc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819122009	CD	On-Demand	Anodyne	ADRB1	28	41
Cn1ncnc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819122009	CD	On-Demand	Anodyne	ADRB3	42	41
OC1CCN(Cc2ccccc2CNC[C@H](O)c2ccccc2Cl)CC1	ZINC000819122016	FG	On-Demand	Anodyne	OPRL1	40	41
OC1CCN(Cc2ccccc2CNC[C@H](O)c2ccccc2Cl)CC1	ZINC000819122016	FG	On-Demand	Anodyne	SIGMAR1	21	44
OC1CCN(Cc2ccccc2CNC[C@H](O)c2ccccc2Cl)CC1	ZINC000819122016	FG	On-Demand	Anodyne	Q2TU57_MAIZE	19	42
C[C@@H]1C[C@@H]1N1C[C@@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1=O	ZINC000819122051	GD	On-Demand	Anodyne	GPR119	31	42
C[C@@H]1C[C@@H]1N1C[C@@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1=O	ZINC000819122052	GD	On-Demand	Anodyne	GPR119	31	42
C[C@@H]1C[C@@H]1N1C[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1=O	ZINC000819122053	GD	On-Demand	Anodyne	GPR119	31	42
C[C@@H]1C[C@@H]1N1C[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1=O	ZINC000819122054	GD	On-Demand	Anodyne	GPR119	31	42
CN1CCN(c2cccc(Cl)c2CNCCC#N)CC1	ZINC000819122077	CE	On-Demand	Mild	DRD3	24	49
CN1CCN(c2cccc(Cl)c2CNCCC#N)CC1	ZINC000819122077	CE	On-Demand	Mild	PAK1	43	36
C#CCNC(=O)CCN[C@@H](c1ccccc1Cl)c1ccc(OC)cc1OC	ZINC000819122085	GG	On-Demand	Mild	MTNR1A	42	35
C#CCNC(=O)CCN[C@H](c1ccccc1Cl)c1ccc(OC)cc1OC	ZINC000819122086	GG	On-Demand	Mild	MTNR1A	42	35
C[C@H](CNC[C@@H](O)c1cccnc1)c1ccc(F)cc1F	ZINC000819122088	CF	On-Demand	Anodyne	ADRB2	24	42
C[C@H](CNC[C@@H](O)c1cccnc1)c1ccc(F)cc1F	ZINC000819122088	CF	On-Demand	Anodyne	ADRB1	26	43
C[C@H](CNC[C@@H](O)c1cccnc1)c1ccc(F)cc1F	ZINC000819122088	CF	On-Demand	Anodyne	ADRB3	93	44
C[C@H](CNC[C@H](O)c1cccnc1)c1ccc(F)cc1F	ZINC000819122089	CF	On-Demand	Anodyne	ADRB2	24	42
C[C@H](CNC[C@H](O)c1cccnc1)c1ccc(F)cc1F	ZINC000819122089	CF	On-Demand	Anodyne	ADRB1	26	43
C[C@H](CNC[C@H](O)c1cccnc1)c1ccc(F)cc1F	ZINC000819122089	CF	On-Demand	Anodyne	ADRB3	93	44
C[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(F)cc1F	ZINC000819122090	CF	On-Demand	Anodyne	ADRB2	24	42
C[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(F)cc1F	ZINC000819122090	CF	On-Demand	Anodyne	ADRB1	26	43
C[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(F)cc1F	ZINC000819122090	CF	On-Demand	Anodyne	ADRB3	93	44
C[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(F)cc1F	ZINC000819122091	CF	On-Demand	Anodyne	ADRB2	24	42
C[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(F)cc1F	ZINC000819122091	CF	On-Demand	Anodyne	ADRB1	26	43
C[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(F)cc1F	ZINC000819122091	CF	On-Demand	Anodyne	ADRB3	93	44
O[C@@H](CNCCCCC1CCCC1)c1cccnc1	ZINC000819122096	CG	On-Demand	Anodyne	ADRB2	34	52
O[C@@H](CNCCCCC1CCCC1)c1cccnc1	ZINC000819122096	CG	On-Demand	Anodyne	ADRB1	41	51
O[C@@H](CNCCCCC1CCCC1)c1cccnc1	ZINC000819122096	CG	On-Demand	Anodyne	ADRB3	119	53
O[C@@H](CNCCCCC1CCCC1)c1cccnc1	ZINC000819122096	CG	On-Demand	Anodyne	BMP1	25	40
O[C@H](CNCCCCC1CCCC1)c1cccnc1	ZINC000819122097	CG	On-Demand	Anodyne	ADRB2	34	52
O[C@H](CNCCCCC1CCCC1)c1cccnc1	ZINC000819122097	CG	On-Demand	Anodyne	ADRB1	41	51
O[C@H](CNCCCCC1CCCC1)c1cccnc1	ZINC000819122097	CG	On-Demand	Anodyne	ADRB3	119	53
O[C@H](CNCCCCC1CCCC1)c1cccnc1	ZINC000819122097	CG	On-Demand	Anodyne	BMP1	25	40
O=C1C[C@H](NC[C@H](O)c2ccc(Cl)cc2)CN1[C@@H]1C[C@H]1c1ccccc1	ZINC000819122102	FG	On-Demand	Anodyne	ADRB3	19	41
O=C1C[C@H](NC[C@H](O)c2ccc(Cl)cc2)CN1[C@H]1C[C@H]1c1ccccc1	ZINC000819122103	FG	On-Demand	Anodyne	ADRB3	19	41
O=C1C[C@H](NC[C@H](O)c2ccc(Cl)cc2)CN1[C@@H]1C[C@@H]1c1ccccc1	ZINC000819122104	FG	On-Demand	Anodyne	ADRB3	19	41
O=C1C[C@H](NC[C@H](O)c2ccc(Cl)cc2)CN1[C@H]1C[C@@H]1c1ccccc1	ZINC000819122105	FG	On-Demand	Anodyne	ADRB3	19	41
CC(=O)Nc1cccc(CC(=O)N2CCC(C3CCCCC3)CC2)c1	ZINC000819122120	EI	On-Demand	Anodyne	CCR3	41	40
CC(=O)Nc1cccc(CC(=O)N2CCC(C3CCCCC3)CC2)c1	ZINC000819122120	EI	On-Demand	Anodyne	EPHX2	30	43
CC(=O)Nc1cccc(CC(=O)N2CCC(C3CCCCC3)CC2)c1	ZINC000819122120	EI	On-Demand	Anodyne	ST14	44	35
CC(=O)Nc1cccc(CC(=O)N2CCC(C3CCCCC3)CC2)c1	ZINC000819122120	EI	On-Demand	Anodyne	P2RY14	42	32
O=C(CCNCc1ccc(N2CCC(O)CC2)c(F)c1)Nc1ccccc1F	ZINC000819122138	GG	On-Demand	Clean	KCNQ2	35	40
OC1CCN(c2ccc(CNC[C@@H](O)COc3ccc(F)cc3)cc2F)CC1	ZINC000819122146	GE	On-Demand	Clean	ADRB1	60	43
OC1CCN(c2ccc(CNC[C@@H](O)COc3ccc(F)cc3)cc2F)CC1	ZINC000819122146	GE	On-Demand	Clean	ADRB3	39	43
OC1CCN(c2ccc(CNC[C@H](O)COc3ccc(F)cc3)cc2F)CC1	ZINC000819122147	GE	On-Demand	Clean	ADRB1	60	43
OC1CCN(c2ccc(CNC[C@H](O)COc3ccc(F)cc3)cc2F)CC1	ZINC000819122147	GE	On-Demand	Clean	ADRB3	39	43
Cn1ncnc1CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819122148	CD	On-Demand	Anodyne	CTSV	23	40
Cn1ncnc1CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819122149	CD	On-Demand	Anodyne	CTSV	23	40
C[C@@H](O)CC(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000819122153	CD	On-Demand	Anodyne	ADRB2	23	43
C[C@@H](O)CC(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000819122153	CD	On-Demand	Anodyne	ADRB1	24	46
C[C@@H](O)CC(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000819122153	CD	On-Demand	Anodyne	ADRB3	92	46
C[C@@H](O)CC(C)(C)CNC[C@H](O)c1cccnc1	ZINC000819122155	CD	On-Demand	Anodyne	ADRB2	23	43
C[C@@H](O)CC(C)(C)CNC[C@H](O)c1cccnc1	ZINC000819122155	CD	On-Demand	Anodyne	ADRB1	24	46
C[C@@H](O)CC(C)(C)CNC[C@H](O)c1cccnc1	ZINC000819122155	CD	On-Demand	Anodyne	ADRB3	92	46
OC1CCN(Cc2ccccc2CNC[C@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819122168	GG	On-Demand	Anodyne	SIGMAR1	19	41
OC1CCN(Cc2ccccc2CNC[C@@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819122169	GG	On-Demand	Anodyne	SIGMAR1	19	41
CC[C@@H](O)CNCc1ccc(N2CCC(O)CC2)c(F)c1	ZINC000819122172	CD	On-Demand	Clean	NPY2R	48	36
CC[C@H](O)CNCc1ccc(N2CCC(O)CC2)c(F)c1	ZINC000819122173	CD	On-Demand	Clean	NPY2R	48	36
COCCc1ccc(OC[C@@H](O)CNCC2CCC3(CC2)OCCO3)cc1	ZINC000819122174	GE	On-Demand	Anodyne	ADRB2	37	55
COCCc1ccc(OC[C@@H](O)CNCC2CCC3(CC2)OCCO3)cc1	ZINC000819122174	GE	On-Demand	Anodyne	ADRB1	68	55
COCCc1ccc(OC[C@@H](O)CNCC2CCC3(CC2)OCCO3)cc1	ZINC000819122174	GE	On-Demand	Anodyne	GRIN1	23	40
COCCc1ccc(OC[C@@H](O)CNCC2CCC3(CC2)OCCO3)cc1	ZINC000819122174	GE	On-Demand	Anodyne	ADRB3	46	45
COCCc1ccc(OC[C@H](O)CNCC2CCC3(CC2)OCCO3)cc1	ZINC000819122175	GE	On-Demand	Anodyne	ADRB2	37	55
COCCc1ccc(OC[C@H](O)CNCC2CCC3(CC2)OCCO3)cc1	ZINC000819122175	GE	On-Demand	Anodyne	ADRB1	68	55
COCCc1ccc(OC[C@H](O)CNCC2CCC3(CC2)OCCO3)cc1	ZINC000819122175	GE	On-Demand	Anodyne	GRIN1	23	40
COCCc1ccc(OC[C@H](O)CNCC2CCC3(CC2)OCCO3)cc1	ZINC000819122175	GE	On-Demand	Anodyne	ADRB3	46	45
OC1CCN(Cc2ccccc2CNC[C@H](O)c2ccc(F)cc2F)CC1	ZINC000819122179	GF	On-Demand	Anodyne	SIGMAR1	15	44
OC1CCN(Cc2ccccc2CNC[C@@H](O)c2ccc(F)cc2F)CC1	ZINC000819122180	GF	On-Demand	Anodyne	SIGMAR1	15	44
CC(C)(C)OC(=O)N1CCC(NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819122219	GH	On-Demand	Anodyne	GRIN2B	26	41
CC(C)(C)OC(=O)N1CCC(NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819122219	GH	On-Demand	Anodyne	CCR8	22	40
CC(C)(C)OC(=O)N1CCC(NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819122219	GH	On-Demand	Anodyne	GPR119	43	47
CC(C)(C)OC(=O)NC1CCN(C(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819122220	GH	On-Demand	Anodyne	C3AR1	49	45
CC(C)(C)OC(=O)NC1CCN(C(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819122220	GH	On-Demand	Anodyne	FAAH	21	42
CC(C)(C)OC(=O)NC1CCN(C(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819122220	GH	On-Demand	Anodyne	CCR8	45	36
C[C@@H]1C[C@@H]1N1C[C@@H](NC[C@H](O)c2ccc(F)cc2)CC1=O	ZINC000819122221	CD	On-Demand	Anodyne	SLC6A3	15	40
C[C@@H]1C[C@@H]1N1C[C@H](NC[C@@H](O)c2ccc(F)cc2)CC1=O	ZINC000819122222	CD	On-Demand	Anodyne	SLC6A3	15	40
C[C@@H]1C[C@@H]1N1C[C@H](NC[C@H](O)c2ccc(F)cc2)CC1=O	ZINC000819122223	CD	On-Demand	Anodyne	SLC6A3	15	40
C[C@@H]1C[C@@H]1N1C[C@@H](NC[C@@H](O)c2ccc(F)cc2)CC1=O	ZINC000819122224	CD	On-Demand	Anodyne	SLC6A3	15	40
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C(F)=C1CCC1	ZINC000819122226	FE	On-Demand	Anodyne	TGM2	57	38
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C(F)=C1CCC1	ZINC000819122226	FE	On-Demand	Anodyne	F13A1	60	42
O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)C(F)=C1CCC1	ZINC000819122226	FE	On-Demand	Anodyne	NAMPT	83	52
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819122231	GE	On-Demand	Anodyne	PIK3CA	18	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819122231	GE	On-Demand	Anodyne	MTOR	40	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819122231	GE	On-Demand	Anodyne	EPHX2	23	50
CC(C)(C)OC(=O)N1CCC(NC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819122237	GE	On-Demand	Anodyne	EPHX2	24	44
CC(C)(C)OC(=O)N1CCC(NC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819122237	GE	On-Demand	Anodyne	GPR119	59	53
Cc1ccc(OC[C@@H](O)CNCc2ccc(N3CCC(O)CC3)c(F)c2)cc1	ZINC000819122247	GF	On-Demand	Clean	ADRB2	35	41
Cc1ccc(OC[C@@H](O)CNCc2ccc(N3CCC(O)CC3)c(F)c2)cc1	ZINC000819122247	GF	On-Demand	Clean	ADRB1	58	39
C[C@H]1CN(c2ccc(NC(=O)C(F)=C3CCC3)cc2F)C[C@H](C)O1	ZINC000819122249	EH	On-Demand	Anodyne	NPY2R	66	35
Cc1ccc(OC[C@H](O)CNCc2ccc(N3CCC(O)CC3)c(F)c2)cc1	ZINC000819122250	GF	On-Demand	Clean	ADRB2	35	41
Cc1ccc(OC[C@H](O)CNCc2ccc(N3CCC(O)CC3)c(F)c2)cc1	ZINC000819122250	GF	On-Demand	Clean	ADRB1	58	39
C[C@H]1CN(c2ccc(NC(=O)C(F)=C3CCC3)cc2F)C[C@@H](C)O1	ZINC000819122251	EH	On-Demand	Anodyne	NPY2R	66	35
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1ccc(Cl)cc1	ZINC000819122275	DG	On-Demand	Anodyne	ADRB1	41	41
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1ccc(Cl)cc1	ZINC000819122275	DG	On-Demand	Anodyne	ADRB3	59	52
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1ccc(Cl)cc1	ZINC000819122275	DG	On-Demand	Anodyne	AOC3	15	43
C[C@H](CNC[C@H](O)c1ccccc1)Oc1ccc(Cl)cc1	ZINC000819122277	DG	On-Demand	Anodyne	ADRB1	41	41
C[C@H](CNC[C@H](O)c1ccccc1)Oc1ccc(Cl)cc1	ZINC000819122277	DG	On-Demand	Anodyne	ADRB3	59	52
C[C@H](CNC[C@H](O)c1ccccc1)Oc1ccc(Cl)cc1	ZINC000819122277	DG	On-Demand	Anodyne	AOC3	15	43
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1ccc(Cl)cc1	ZINC000819122279	DG	On-Demand	Anodyne	ADRB1	41	41
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1ccc(Cl)cc1	ZINC000819122279	DG	On-Demand	Anodyne	ADRB3	59	52
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1ccc(Cl)cc1	ZINC000819122279	DG	On-Demand	Anodyne	AOC3	15	43
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1ccc(Cl)cc1	ZINC000819122281	DG	On-Demand	Anodyne	ADRB1	41	41
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1ccc(Cl)cc1	ZINC000819122281	DG	On-Demand	Anodyne	ADRB3	59	52
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1ccc(Cl)cc1	ZINC000819122281	DG	On-Demand	Anodyne	AOC3	15	43
CC[C@H](C)NC(=O)c1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819122322	DG	On-Demand	Anodyne	PDS	44	34
CON(C)C(=O)CCNCc1ccc(-c2cccnc2)cc1	ZINC000819122323	CE	On-Demand	Anodyne	CYP11B2	29	40
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1ccc(Br)cc1	ZINC000819122351	FH	On-Demand	Anodyne	ADRB2	18	49
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1ccc(Br)cc1	ZINC000819122351	FH	On-Demand	Anodyne	ADRB1	24	41
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1ccc(Br)cc1	ZINC000819122351	FH	On-Demand	Anodyne	AOC3	15	43
C[C@H](CNC[C@H](O)c1ccccc1)Oc1ccc(Br)cc1	ZINC000819122353	FH	On-Demand	Anodyne	ADRB2	18	49
C[C@H](CNC[C@H](O)c1ccccc1)Oc1ccc(Br)cc1	ZINC000819122353	FH	On-Demand	Anodyne	ADRB1	24	41
C[C@H](CNC[C@H](O)c1ccccc1)Oc1ccc(Br)cc1	ZINC000819122353	FH	On-Demand	Anodyne	AOC3	15	43
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1ccc(Br)cc1	ZINC000819122354	FH	On-Demand	Anodyne	ADRB2	18	49
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1ccc(Br)cc1	ZINC000819122354	FH	On-Demand	Anodyne	ADRB1	24	41
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1ccc(Br)cc1	ZINC000819122354	FH	On-Demand	Anodyne	AOC3	15	43
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1ccc(Br)cc1	ZINC000819122355	FH	On-Demand	Anodyne	ADRB2	18	49
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1ccc(Br)cc1	ZINC000819122355	FH	On-Demand	Anodyne	ADRB1	24	41
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1ccc(Br)cc1	ZINC000819122355	FH	On-Demand	Anodyne	AOC3	15	43
C[C@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1ccc(Cl)cc1	ZINC000819122363	GF	On-Demand	Anodyne	PTGS2	18	41
C[C@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1ccc(Cl)cc1	ZINC000819122364	GF	On-Demand	Anodyne	PTGS2	18	41
C[C@@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1ccc(Cl)cc1	ZINC000819122366	GF	On-Demand	Anodyne	PTGS2	18	41
C[C@@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Oc1ccc(Cl)cc1	ZINC000819122367	GF	On-Demand	Anodyne	PTGS2	18	41
OC1CCN(Cc2ccccc2CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819122383	FG	On-Demand	Anodyne	ADRB1	34	41
OC1CCN(Cc2ccccc2CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819122383	FG	On-Demand	Anodyne	ADRB3	44	45
OC1CCN(Cc2ccccc2CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819122383	FG	On-Demand	Anodyne	CYP3A4	43	39
OC1CCN(Cc2ccccc2CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819122384	FG	On-Demand	Anodyne	ADRB1	34	41
OC1CCN(Cc2ccccc2CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819122384	FG	On-Demand	Anodyne	ADRB3	44	45
OC1CCN(Cc2ccccc2CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819122384	FG	On-Demand	Anodyne	CYP3A4	43	39
N#Cc1ccc(OC[C@@H](O)CNCc2ccc(N3CCC(O)CC3)c(F)c2)cc1	ZINC000819122393	GE	On-Demand	Mild	ADRB1	47	38
N#Cc1ccc(OC[C@H](O)CNCc2ccc(N3CCC(O)CC3)c(F)c2)cc1	ZINC000819122394	GE	On-Demand	Mild	ADRB1	47	38
OC1CCN(Cc2ccccc2CNC[C@H](O)c2ccccc2)CC1	ZINC000819122395	EE	On-Demand	Anodyne	SLC6A3	19	41
OC1CCN(Cc2ccccc2CNC[C@H](O)c2ccccc2)CC1	ZINC000819122395	EE	On-Demand	Anodyne	SIGMAR1	24	40
OC1CCN(Cc2ccccc2CNC[C@@H](O)c2ccccc2)CC1	ZINC000819122396	EE	On-Demand	Anodyne	SLC6A3	19	41
OC1CCN(Cc2ccccc2CNC[C@@H](O)c2ccccc2)CC1	ZINC000819122396	EE	On-Demand	Anodyne	SIGMAR1	24	40
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2Cl)cc1	ZINC000819122438	HF	On-Demand	Reactive	GRM4	19	49
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2Cl)cc1	ZINC000819122438	HF	On-Demand	Reactive	PRTN3	51	32
O=C(CC1CC1)NNC(=O)c1cnn2ccccc12	ZINC000819122439	CC	On-Demand	Reactive	JAK3	19	42
O=C(CC1CC1)NNC(=O)c1cnn2ccccc12	ZINC000819122439	CC	On-Demand	Reactive	JAK1	15	42
O=C(CC1CC1)NNC(=O)c1cnn2ccccc12	ZINC000819122439	CC	On-Demand	Reactive	TYK2	23	42
O=C(CC1CC1)NNC(=O)c1cnn2ccccc12	ZINC000819122439	CC	On-Demand	Reactive	EPHB3	37	50
O=C(CNC(=O)NC1CCCCC1)NNC(=O)CC1CC1	ZINC000819122443	CC	On-Demand	Reactive	EPHX2	17	48
O=C(CSc1nnc(-c2ccco2)n1Cc1ccco1)NNC(=O)CC1CC1	ZINC000819122456	HE	On-Demand	Reactive	HCRTR2	18	53
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000819122463	IG	On-Demand	Reactive	F2	43	48
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000819122463	IG	On-Demand	Reactive	PRSS1	15	48
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000819122463	IG	On-Demand	Reactive	CELA1	24	47
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000819122463	IG	On-Demand	Reactive	PREP	68	47
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000819122463	IG	On-Demand	Reactive	LGMN	81	43
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000819122463	IG	On-Demand	Reactive	KLK5	23	40
Cc1c(NC(=O)CSCC(=O)NNC(=O)CC2CC2)c(=O)n(-c2ccccc2)n1C	ZINC000819122472	ID	On-Demand	Reactive	FPR2	54	50
C[C@H]1CN(c2ccc(NC(=O)Cc3nsc4ccccc34)cc2F)C[C@H](C)O1	ZINC000819122494	GI	On-Demand	Anodyne	NPY2R	65	41
C[C@H]1CN(c2ccc(NC(=O)Cc3nsc4ccccc34)cc2F)C[C@H](C)O1	ZINC000819122494	GI	On-Demand	Anodyne	IMDH_CRYPV	28	41
O=C(CC1CC1)NNC(=O)c1cccc(OCc2ccc(Cl)cc2)c1	ZINC000819122495	FG	On-Demand	Reactive	SLC6A5	33	42
C[C@H]1CN(c2ccc(NC(=O)Cc3nsc4ccccc34)cc2F)C[C@@H](C)O1	ZINC000819122497	GI	On-Demand	Anodyne	NPY2R	65	41
C[C@H]1CN(c2ccc(NC(=O)Cc3nsc4ccccc34)cc2F)C[C@@H](C)O1	ZINC000819122497	GI	On-Demand	Anodyne	IMDH_CRYPV	28	41
O=C(CC1CC1)NNC(=O)[C@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122506	FG	On-Demand	Reactive	MAOB	18	40
O=C(CC1CC1)NNC(=O)[C@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122506	FG	On-Demand	Reactive	LTA4H	28	43
O=C(CC1CC1)NNC(=O)[C@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122506	FG	On-Demand	Reactive	ADAM17	34	47
O=C(CC1CC1)NNC(=O)[C@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122506	FG	On-Demand	Reactive	FFAR1	34	40
O=C(CC1CC1)NNC(=O)[C@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122506	FG	On-Demand	Reactive	KDM1A	18	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccccc1COCc1ccccc1	ZINC000819122507	GI	On-Demand	Anodyne	CTSK	19	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccccc1COCc1ccccc1	ZINC000819122507	GI	On-Demand	Anodyne	CTSL	23	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccccc1COCc1ccccc1	ZINC000819122507	GI	On-Demand	Anodyne	FPR1	44	36
O=C(CC1CC1)NNC(=O)[C@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122508	FG	On-Demand	Reactive	MAOB	18	40
O=C(CC1CC1)NNC(=O)[C@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122508	FG	On-Demand	Reactive	LTA4H	28	43
O=C(CC1CC1)NNC(=O)[C@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122508	FG	On-Demand	Reactive	ADAM17	34	47
O=C(CC1CC1)NNC(=O)[C@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122508	FG	On-Demand	Reactive	FFAR1	34	40
O=C(CC1CC1)NNC(=O)[C@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122508	FG	On-Demand	Reactive	KDM1A	18	40
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122510	FG	On-Demand	Reactive	MAOB	18	40
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122510	FG	On-Demand	Reactive	LTA4H	28	43
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122510	FG	On-Demand	Reactive	ADAM17	34	47
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122510	FG	On-Demand	Reactive	FFAR1	34	40
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122510	FG	On-Demand	Reactive	KDM1A	18	40
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122512	FG	On-Demand	Reactive	MAOB	18	40
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122512	FG	On-Demand	Reactive	LTA4H	28	43
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122512	FG	On-Demand	Reactive	ADAM17	34	47
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122512	FG	On-Demand	Reactive	FFAR1	34	40
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819122512	FG	On-Demand	Reactive	KDM1A	18	40
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CC3CC3)c2)CC1	ZINC000819122522	HC	On-Demand	Reactive	TGM2	62	40
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CC3CC3)c2)CC1	ZINC000819122522	HC	On-Demand	Reactive	ST14	52	33
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CC3CC3)c2)CC1	ZINC000819122522	HC	On-Demand	Reactive	F13A1	59	40
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CC3CC3)c2)CC1	ZINC000819122522	HC	On-Demand	Reactive	AKR1C3	64	43
O=C(CC1CC1)NNC(=O)c1ccccc1NC(=O)c1ccccc1Br	ZINC000819122540	HG	On-Demand	Reactive	CCR8	55	34
C=CCCn1cc(C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)nn1	ZINC000819122546	FF	On-Demand	Mild	NPY2R	53	33
C=CCCn1cc(C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)nn1	ZINC000819122547	FF	On-Demand	Mild	NPY2R	53	33
C=CCCn1cc(C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)nn1	ZINC000819122548	FF	On-Demand	Mild	NPY2R	53	33
CC(C)(C)OC(=O)N1CCC(NC(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819122553	FD	On-Demand	Anodyne	GPR119	48	44
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1OCC(=O)NC1CC1	ZINC000819122554	FE	On-Demand	Anodyne	ENPP1	55	31
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1OCC(=O)NC1CC1	ZINC000819122555	FE	On-Demand	Anodyne	ENPP1	55	31
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1OCC(=O)NC1CC1	ZINC000819122556	FE	On-Demand	Anodyne	ENPP1	55	31
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1OCC(=O)NC1CC1	ZINC000819122557	FE	On-Demand	Anodyne	ENPP1	55	31
O=C1C[C@H](NC[C@H](O)c2ccc(F)cc2)CN1[C@@H]1C[C@H]1c1ccccc1	ZINC000819122562	FF	On-Demand	Anodyne	SLC6A3	18	46
O=C1C[C@H](NC[C@H](O)c2ccc(F)cc2)CN1[C@H]1C[C@H]1c1ccccc1	ZINC000819122563	FF	On-Demand	Anodyne	SLC6A3	18	46
O=C1C[C@H](NC[C@H](O)c2ccc(F)cc2)CN1[C@@H]1C[C@@H]1c1ccccc1	ZINC000819122564	FF	On-Demand	Anodyne	SLC6A3	18	46
O=C1C[C@H](NC[C@H](O)c2ccc(F)cc2)CN1[C@H]1C[C@@H]1c1ccccc1	ZINC000819122565	FF	On-Demand	Anodyne	SLC6A3	18	46
C[C@@H](CNC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)c1ccc(F)cc1F	ZINC000819122570	GH	On-Demand	Anodyne	GPR119	22	45
C[C@H](CNC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)c1ccc(F)cc1F	ZINC000819122571	GH	On-Demand	Anodyne	GPR119	22	45
C[C@H](CNC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)c1ccc(F)cc1F	ZINC000819122572	GH	On-Demand	Anodyne	GPR119	22	45
C[C@@H](CNC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)c1ccc(F)cc1F	ZINC000819122573	GH	On-Demand	Anodyne	GPR119	22	45
C=C(C)C(C)(C)C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	ZINC000819122579	EH	On-Demand	Mild	NPY2R	88	42
C=C(C)C(C)(C)C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	ZINC000819122580	EH	On-Demand	Mild	NPY2R	88	42
C=C(C)C(C)(C)C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	ZINC000819122581	EH	On-Demand	Mild	NPY2R	88	42
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(Cl)c(F)c1	ZINC000819122582	CG	On-Demand	Anodyne	ENV	49	45
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(Cl)c(F)c1	ZINC000819122584	CG	On-Demand	Anodyne	ENV	49	45
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(Cl)c(F)c1	ZINC000819122585	CG	On-Demand	Anodyne	ENV	49	45
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(Cl)c(F)c1	ZINC000819122587	CG	On-Demand	Anodyne	ENV	49	45
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccc(Br)cc1	ZINC000819122594	FF	On-Demand	Anodyne	ADRB2	26	48
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccc(Br)cc1	ZINC000819122594	FF	On-Demand	Anodyne	ADRB1	29	48
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccc(Br)cc1	ZINC000819122594	FF	On-Demand	Anodyne	ADRB3	95	48
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccc(Br)cc1	ZINC000819122595	FF	On-Demand	Anodyne	ADRB2	26	48
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccc(Br)cc1	ZINC000819122595	FF	On-Demand	Anodyne	ADRB1	29	48
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccc(Br)cc1	ZINC000819122595	FF	On-Demand	Anodyne	ADRB3	95	48
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccc(Br)cc1	ZINC000819122597	FF	On-Demand	Anodyne	ADRB2	26	48
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccc(Br)cc1	ZINC000819122597	FF	On-Demand	Anodyne	ADRB1	29	48
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccc(Br)cc1	ZINC000819122597	FF	On-Demand	Anodyne	ADRB3	95	48
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccc(Br)cc1	ZINC000819122598	FF	On-Demand	Anodyne	ADRB2	26	48
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccc(Br)cc1	ZINC000819122598	FF	On-Demand	Anodyne	ADRB1	29	48
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccc(Br)cc1	ZINC000819122598	FF	On-Demand	Anodyne	ADRB3	95	48
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819122611	GG	On-Demand	Anodyne	CCKAR	15	43
CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819122611	GG	On-Demand	Anodyne	FPR1	45	34
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819122627	FD	On-Demand	Anodyne	TGM2	75	44
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819122627	FD	On-Demand	Anodyne	F13A1	71	41
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819122627	FD	On-Demand	Anodyne	NAMPT	77	46
C[C@@H](O)CC(C)(C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819122629	CF	On-Demand	Anodyne	ADRB2	19	47
C[C@@H](O)CC(C)(C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819122629	CF	On-Demand	Anodyne	ADRB1	39	47
C[C@@H](O)CC(C)(C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819122629	CF	On-Demand	Anodyne	ADRB3	55	47
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819122631	FD	On-Demand	Anodyne	TGM2	75	44
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819122631	FD	On-Demand	Anodyne	F13A1	71	41
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819122631	FD	On-Demand	Anodyne	NAMPT	77	46
C[C@@H](O)CC(C)(C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819122632	CF	On-Demand	Anodyne	ADRB2	19	47
C[C@@H](O)CC(C)(C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819122632	CF	On-Demand	Anodyne	ADRB1	39	47
C[C@@H](O)CC(C)(C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819122632	CF	On-Demand	Anodyne	ADRB3	55	47
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819122633	FD	On-Demand	Anodyne	TGM2	75	44
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819122633	FD	On-Demand	Anodyne	F13A1	71	41
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819122633	FD	On-Demand	Anodyne	NAMPT	77	46
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819122636	FD	On-Demand	Anodyne	TGM2	75	44
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819122636	FD	On-Demand	Anodyne	F13A1	71	41
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819122636	FD	On-Demand	Anodyne	NAMPT	77	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(Cc3ccccc3C)CC1)C2	ZINC000819122648	GF	On-Demand	Anodyne	DRD4	18	49
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(Cc3ccccc3C)CC1)C2	ZINC000819122648	GF	On-Demand	Anodyne	SIGMAR1	17	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(Cc3ccccc3C)CC1)C2	ZINC000819122651	GF	On-Demand	Anodyne	DRD4	18	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(Cc3ccccc3C)CC1)C2	ZINC000819122651	GF	On-Demand	Anodyne	SIGMAR1	17	43
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NNC(=O)CC2CC2)cc1OC	ZINC000819122692	IG	On-Demand	Reactive	TSHR	42	33
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NNC(=O)CC2CC2)cc1OC	ZINC000819122692	IG	On-Demand	Reactive	DRD4	26	41
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NNC(=O)CC2CC2)cc1OC	ZINC000819122692	IG	On-Demand	Reactive	ACHE	22	43
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NNC(=O)CC2CC2)cc1OC	ZINC000819122692	IG	On-Demand	Reactive	CPT1A	43	30
O=C(CC1CC1)NNC(=O)c1cnn(Cc2ccccc2Cl)c1	ZINC000819122702	EE	On-Demand	Reactive	PANC	50	37
O=C(CC1CC1)NNC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1	ZINC000819122713	GG	On-Demand	Reactive	LIPE	27	57
O=C(CC1CC1)NNC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1	ZINC000819122713	GG	On-Demand	Reactive	SLC6A5	31	40
OC1CCN(c2ccc(CNC[C@H](O)c3cccnc3)cc2F)CC1	ZINC000819122732	EE	On-Demand	Clean	ADRB1	23	41
OC1CCN(c2ccc(CNC[C@H](O)c3cccnc3)cc2F)CC1	ZINC000819122732	EE	On-Demand	Clean	ADRB3	89	45
OC1CCN(c2ccc(CNC[C@@H](O)c3cccnc3)cc2F)CC1	ZINC000819122734	EE	On-Demand	Clean	ADRB1	23	41
OC1CCN(c2ccc(CNC[C@@H](O)c3cccnc3)cc2F)CC1	ZINC000819122734	EE	On-Demand	Clean	ADRB3	89	45
O=C(CC1CC1)NNC(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12	ZINC000819122741	FH	On-Demand	Reactive	DHODH	32	48
O=C(CC1CC1)NNC(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12	ZINC000819122741	FH	On-Demand	Reactive	ACACB	15	48
O=C(CC1CC1)NNC(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12	ZINC000819122741	FH	On-Demand	Reactive	TACR3	31	47
O=C(CC1CC1)NNC(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12	ZINC000819122741	FH	On-Demand	Reactive	VCP	52	43
O=C(/C=C\[C@H]1CCCO1)Nc1cc(Cl)ccc1C(=O)N1CCCC1	ZINC000819122756	EG	On-Demand	Anodyne	L3MBTL3	42	35
O=C(CC1CC1)NNC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1	ZINC000819122757	FE	On-Demand	Reactive	ST14	52	34
O=C(CC1CC1)NNC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1	ZINC000819122757	FE	On-Demand	Reactive	AKR1C3	22	43
O=C(CC1CC1)NNC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1	ZINC000819122757	FE	On-Demand	Reactive	KCNK3	43	36
O=C(/C=C/[C@H]1CCCO1)Nc1cc(Cl)ccc1C(=O)N1CCCC1	ZINC000819122758	EG	On-Demand	Anodyne	L3MBTL3	42	35
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(Cl)ccc1C(=O)N1CCCC1	ZINC000819122760	EG	On-Demand	Anodyne	L3MBTL3	42	35
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(Cl)ccc1C(=O)N1CCCC1	ZINC000819122762	EG	On-Demand	Anodyne	L3MBTL3	42	35
O=C(CC1CC1)NNC(=O)C1CC(OCc2ccccc2)C1	ZINC000819122781	DD	On-Demand	Reactive	CAPN1	23	42
O=C(CC1CC1)NNC(=O)C1CC(OCc2ccccc2)C1	ZINC000819122781	DD	On-Demand	Reactive	VCP	45	33
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819122787	ED	On-Demand	Reactive	CTSD	22	49
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819122787	ED	On-Demand	Reactive	CTSK	17	47
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819122787	ED	On-Demand	Reactive	ECE1	45	49
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819122787	ED	On-Demand	Reactive	PGA5	24	42
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819122787	ED	On-Demand	Reactive	POLG_HCV1	28	48
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819122788	ED	On-Demand	Reactive	CTSD	22	49
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819122788	ED	On-Demand	Reactive	CTSK	17	47
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819122788	ED	On-Demand	Reactive	ECE1	45	49
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819122788	ED	On-Demand	Reactive	PGA5	24	42
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819122788	ED	On-Demand	Reactive	POLG_HCV1	28	48
Cc1ccc(C(=O)CCCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819122797	DE	On-Demand	Reactive	HDAC8	24	40
Cc1ccc(C(=O)CCCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819122797	DE	On-Demand	Reactive	CYP2J2	46	40
O=C(CC1CC1)NNC(=O)c1cccc(-n2cccn2)c1	ZINC000819122814	CD	On-Demand	Reactive	AMP1_PLAFQ	49	41
CCCCSCCC(=O)NNC(=O)CC1CC1	ZINC000819122815	CD	On-Demand	Reactive	EST1_PIG	40	35
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2cccnc2)c1	ZINC000819122842	ED	On-Demand	Reactive	ABL1	15	46
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2cccnc2)c1	ZINC000819122842	ED	On-Demand	Reactive	RPS6KA3	31	41
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2cccnc2)c1	ZINC000819122842	ED	On-Demand	Reactive	CSF1R	23	50
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2cccnc2)c1	ZINC000819122842	ED	On-Demand	Reactive	BTK	26	42
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2cccnc2)c1	ZINC000819122842	ED	On-Demand	Reactive	TAAR1	40	36
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2cccnc2)c1	ZINC000819122842	ED	On-Demand	Reactive	NAMPT	20	43
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2cccnc2)c1	ZINC000819122842	ED	On-Demand	Reactive	KCNK3	99	43
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2cccnc2)c1	ZINC000819122842	ED	On-Demand	Reactive	KCNK9	48	38
NS(=O)(=O)c1cc(C(=O)NNC(=O)CC2CC2)ccc1F	ZINC000819122844	DC	On-Demand	Reactive	CA2	26	43
O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)NNC(=O)CC1CC1	ZINC000819122864	FG	On-Demand	Reactive	HDAC8	25	49
O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)NNC(=O)CC1CC1	ZINC000819122864	FG	On-Demand	Reactive	HAO1	44	34
O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)NNC(=O)CC1CC1	ZINC000819122864	FG	On-Demand	Reactive	CYP2J2	45	33
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)n1cnnn1	ZINC000819122865	DC	On-Demand	Reactive	MME	49	33
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)n1cnnn1	ZINC000819122867	DC	On-Demand	Reactive	MME	49	33
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122872	GE	On-Demand	Reactive	MME	50	42
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122872	GE	On-Demand	Reactive	PGC	62	39
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122872	GE	On-Demand	Reactive	PAPA1_CARPA	60	48
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122872	GE	On-Demand	Reactive	CCKAR	58	39
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122872	GE	On-Demand	Reactive	CTSK	34	53
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122872	GE	On-Demand	Reactive	CTSL	37	48
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122872	GE	On-Demand	Reactive	PGA	36	41
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122872	GE	On-Demand	Reactive	TACR3	19	43
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122872	GE	On-Demand	Reactive	CAPNS1	68	32
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122872	GE	On-Demand	Reactive	REN	86	47
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122872	GE	On-Demand	Reactive	REN1	25	41
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122872	GE	On-Demand	Reactive	CTSS	18	48
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122872	GE	On-Demand	Reactive	CAPN1	64	39
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122872	GE	On-Demand	Reactive	CAPN2	44	31
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122872	GE	On-Demand	Reactive	KLK5	32	43
CC(C)(C)OC(=O)N[C@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122872	GE	On-Demand	Reactive	FPR1	55	46
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122873	GE	On-Demand	Reactive	MME	50	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122873	GE	On-Demand	Reactive	PGC	62	39
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122873	GE	On-Demand	Reactive	PAPA1_CARPA	60	48
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122873	GE	On-Demand	Reactive	CCKAR	58	39
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122873	GE	On-Demand	Reactive	CTSK	34	53
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122873	GE	On-Demand	Reactive	CTSL	37	48
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122873	GE	On-Demand	Reactive	PGA	36	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122873	GE	On-Demand	Reactive	TACR3	19	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122873	GE	On-Demand	Reactive	CAPNS1	68	32
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122873	GE	On-Demand	Reactive	REN	86	47
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122873	GE	On-Demand	Reactive	REN1	25	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122873	GE	On-Demand	Reactive	CTSS	18	48
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122873	GE	On-Demand	Reactive	CAPN1	64	39
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122873	GE	On-Demand	Reactive	CAPN2	44	31
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122873	GE	On-Demand	Reactive	KLK5	32	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)NNC(=O)CC1CC1)Cc1ccccc1	ZINC000819122873	GE	On-Demand	Reactive	FPR1	55	46
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1	ZINC000819122876	ED	On-Demand	Reactive	F2	43	41
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1	ZINC000819122876	ED	On-Demand	Reactive	ACE	30	42
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1	ZINC000819122876	ED	On-Demand	Reactive	FKBP1A	26	52
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1	ZINC000819122876	ED	On-Demand	Reactive	OPRM1	23	42
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1	ZINC000819122876	ED	On-Demand	Reactive	ELANE	26	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1	ZINC000819122876	ED	On-Demand	Reactive	PREP	80	39
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1	ZINC000819122876	ED	On-Demand	Reactive	LGMN	66	39
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)Nc1ccccc1	ZINC000819122876	ED	On-Demand	Reactive	XIAP	39	41
O=C(CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12)NNC(=O)CC1CC1	ZINC000819122878	GH	On-Demand	Reactive	GNRHR	43	35
O=C(CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12)NNC(=O)CC1CC1	ZINC000819122878	GH	On-Demand	Reactive	TSPO	30	45
CC(C)(C)OC(=O)N1CCC(CCC(=O)NNC(=O)CC2CC2)CC1	ZINC000819122880	FE	On-Demand	Reactive	GPR119	43	42
COCCOc1cc(C(=O)NNC(=O)CC2CC2)nc2ccccc12	ZINC000819122881	ED	On-Demand	Reactive	ADAM17	65	38
O=C(CC1CC1)NNC(=O)c1ccc(OCc2cccnc2)cc1	ZINC000819122885	EE	On-Demand	Reactive	GRIN2B	26	41
O=C(CC1CC1)NNC(=O)c1ccc(OCc2cccnc2)cc1	ZINC000819122885	EE	On-Demand	Reactive	CHRNA7	45	43
O=C(CC1CC1)NNC(=O)c1ccc(OCc2cccnc2)cc1	ZINC000819122885	EE	On-Demand	Reactive	ADAM17	28	42
O=C(CC1CC1)NNC(=O)c1ccc(OCc2cccnc2)cc1	ZINC000819122885	EE	On-Demand	Reactive	SLC6A5	34	52
O=C(CC1CC1)NNC(=O)c1ccc(OCc2cccnc2)cc1	ZINC000819122885	EE	On-Demand	Reactive	VCP	40	40
O=C(CC1CC1)NNC(=O)c1ccc(OCc2cccnc2)cc1	ZINC000819122885	EE	On-Demand	Reactive	NAMPT	33	40
CC(C)(C)OC(=O)N1CCC(n2cccc2C(=O)NNC(=O)CC2CC2)CC1	ZINC000819122898	GF	On-Demand	Reactive	GPR119	50	43
O=C(CC1CC1)NNC(=O)c1ccc(N2CCCC2)nc1	ZINC000819122903	CD	On-Demand	Reactive	HDAC1	18	41
O=C(CC1CC1)NNC(=O)c1ccc(N2CCCC2)nc1	ZINC000819122903	CD	On-Demand	Reactive	FASN	17	44
O=C(CC1CC1)NNC(=O)c1ccc(N2CCCC2)nc1	ZINC000819122903	CD	On-Demand	Reactive	HPGDS	29	53
COc1cccc(C2(C(=O)NNC(=O)CC3CC3)CC2)c1	ZINC000819122920	CD	On-Demand	Reactive	MTNR1A	41	38
C=CCOc1ccc(C(F)(F)F)cc1C(=O)NNC(=O)CC1CC1	ZINC000819122940	EF	On-Demand	Reactive	LIPG	49	44
Cc1ccc(-n2nc(C)c(CC(=O)NNC(=O)CC3CC3)c2C)cc1Cl	ZINC000819122981	FF	On-Demand	Reactive	P2RX7	42	48
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCC2CCCC2)c1	ZINC000819122989	DH	On-Demand	Bother	ADRB1	44	39
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCC2CCCC2)c1	ZINC000819122989	DH	On-Demand	Bother	ADRB3	55	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCC2CCCC2)c1	ZINC000819122989	DH	On-Demand	Bother	CACNA1D	42	34
O=[N+]([O-])c1cccc([C@H](O)CNCCCCC2CCCC2)c1	ZINC000819122991	DH	On-Demand	Bother	ADRB1	44	39
O=[N+]([O-])c1cccc([C@H](O)CNCCCCC2CCCC2)c1	ZINC000819122991	DH	On-Demand	Bother	ADRB3	55	40
O=[N+]([O-])c1cccc([C@H](O)CNCCCCC2CCCC2)c1	ZINC000819122991	DH	On-Demand	Bother	CACNA1D	42	34
O=C(CN1CCCCCC1)Nc1ccc(NC(=O)C(F)=C2CCC2)cc1	ZINC000819123005	FH	On-Demand	Anodyne	CHRNA7	16	44
COc1ccc(Nc2nc(C(=O)NNC(=O)CC3CC3)cs2)cc1	ZINC000819123008	EE	On-Demand	Reactive	TRPC6	69	59
COc1ccc(Nc2nc(C(=O)NNC(=O)CC3CC3)cs2)cc1	ZINC000819123008	EE	On-Demand	Reactive	TRPC3	62	59
C[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)C(=O)N1c1cnn(C)c1	ZINC000819123028	ED	On-Demand	Anodyne	CYP3A4	49	37
C[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)C(=O)N1c1cnn(C)c1	ZINC000819123029	ED	On-Demand	Anodyne	CYP3A4	49	37
Cc1n[nH]c(C)c1NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819123043	GJ	On-Demand	Anodyne	REN	51	38
Cc1n[nH]c(C)c1NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819123045	GJ	On-Demand	Anodyne	REN	51	38
O=C(CCCCN1CCOCC1)NNC(=O)CC1CC1	ZINC000819123047	CC	On-Demand	Reactive	PAOX	20	49
O=C(CCCCN1CCOCC1)NNC(=O)CC1CC1	ZINC000819123047	CC	On-Demand	Reactive	EPHX2	17	44
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCOCC2)c1	ZINC000819123051	DD	On-Demand	Reactive	DRD4	24	40
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCOCC2)c1	ZINC000819123051	DD	On-Demand	Reactive	ACHE	26	42
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCOCC2)c1	ZINC000819123051	DD	On-Demand	Reactive	AVPR1B	16	44
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCOCC2)c1	ZINC000819123051	DD	On-Demand	Reactive	CHRM3	19	43
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCOCC2)c1	ZINC000819123051	DD	On-Demand	Reactive	SIGMAR1	28	43
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCOCC2)c1	ZINC000819123051	DD	On-Demand	Reactive	CCR3	20	41
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCOCC2)c1	ZINC000819123051	DD	On-Demand	Reactive	MCHR1	20	45
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCOCC2)c1	ZINC000819123051	DD	On-Demand	Reactive	CACNA1I	19	40
O=C(CC1CC1)NNC(=O)c1ccccc1OCc1ccccc1Br	ZINC000819123056	HH	On-Demand	Reactive	HCN1	53	33
O=C(CC1CC1)NNC(=O)c1ccccc1OCc1ccccc1Br	ZINC000819123056	HH	On-Demand	Reactive	HCN4	42	32
O=C(CC1CC1)NNC(=O)c1ccc(COC(F)(F)F)cc1	ZINC000819123062	DE	On-Demand	Reactive	SLC6A5	34	40
CCN(C(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)C1CCCC1	ZINC000819123078	GG	On-Demand	Anodyne	GPR119	16	40
CCN(C(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)C1CCCC1	ZINC000819123080	GG	On-Demand	Anodyne	GPR119	16	40
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)CC2CC2)c1	ZINC000819123084	GB	On-Demand	Reactive	CCR2	80	45
CC(=O)Nc1cccc(CC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819123090	GF	On-Demand	Anodyne	SIGMAR1	19	46
CC(=O)Nc1cccc(CC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819123090	GF	On-Demand	Anodyne	EPHX2	45	47
CC(=O)Nc1cccc(CC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819123090	GF	On-Demand	Anodyne	MCHR1	32	42
CC(=O)Nc1cccc(CC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819123090	GF	On-Demand	Anodyne	CCR8	34	41
CC(=O)Nc1cccc(CC(=O)NC2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819123090	GF	On-Demand	Anodyne	GPR119	50	52
C[C@H](CNC[C@H](O)c1ccc([N+](=O)[O-])cc1)Oc1ccc(Cl)cc1	ZINC000819123094	FG	On-Demand	Bother	ADRB3	19	40
C[C@@H](CNC[C@H](O)c1ccc([N+](=O)[O-])cc1)Oc1ccc(Cl)cc1	ZINC000819123096	FG	On-Demand	Bother	ADRB3	19	40
C[C@H](CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)Oc1ccc(Cl)cc1	ZINC000819123098	FG	On-Demand	Bother	ADRB3	19	40
C[C@@H](CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)Oc1ccc(Cl)cc1	ZINC000819123099	FG	On-Demand	Bother	ADRB3	19	40
C[C@@H]1CCCCN1Cc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1	ZINC000819123100	EH	On-Demand	Anodyne	HRH3	40	41
C[C@@H]1CCCCN1Cc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1	ZINC000819123102	EH	On-Demand	Anodyne	HRH3	40	41
C[C@@H]1CCCCN1Cc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1	ZINC000819123103	EH	On-Demand	Anodyne	HRH3	40	41
C[C@@H]1CCCCN1Cc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1	ZINC000819123104	EH	On-Demand	Anodyne	HRH3	40	41
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	ZINC000819123109	ID	On-Demand	Reactive	MMP7	43	39
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	ZINC000819123109	ID	On-Demand	Reactive	MMP1	40	39
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	ZINC000819123111	ID	On-Demand	Reactive	MMP7	43	39
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1	ZINC000819123111	ID	On-Demand	Reactive	MMP1	40	39
O=C(CCCOc1ccc2c(c1)CCC2)NNC(=O)CC1CC1	ZINC000819123115	DE	On-Demand	Reactive	PPARG	30	42
O=C(CCCOc1ccc2c(c1)CCC2)NNC(=O)CC1CC1	ZINC000819123115	DE	On-Demand	Reactive	PPARA	20	44
O=C(CCCOc1ccc2c(c1)CCC2)NNC(=O)CC1CC1	ZINC000819123115	DE	On-Demand	Reactive	HRH3	15	43
O=C(CCCOc1ccc2c(c1)CCC2)NNC(=O)CC1CC1	ZINC000819123115	DE	On-Demand	Reactive	PPARD	48	39
C[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)CC1CC1	ZINC000819123123	CD	On-Demand	Reactive	ACE	21	43
C[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)CC1CC1	ZINC000819123123	CD	On-Demand	Reactive	MME	41	43
C[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)CC1CC1	ZINC000819123123	CD	On-Demand	Reactive	ACE2	57	40
C[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)CC1CC1	ZINC000819123123	CD	On-Demand	Reactive	LEF	58	33
O=C(CC1CC1)NNC(=O)c1cc2cc(Cl)sc2[nH]1	ZINC000819123129	CE	On-Demand	Reactive	PYGL	44	52
O=C(CCCc1nc(-c2ccc(F)cc2)no1)NNC(=O)CC1CC1	ZINC000819123134	EE	On-Demand	Reactive	SPHK1	36	42
O=C(CCCc1nc(-c2ccc(F)cc2)no1)NNC(=O)CC1CC1	ZINC000819123134	EE	On-Demand	Reactive	HCAR2	23	42
O=C(COc1cc(Cl)cc(Cl)c1)NNC(=O)CC1CC1	ZINC000819123145	DE	On-Demand	Reactive	CACNA1I	57	38
O=C(CC1CC1)NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819123153	FC	On-Demand	Reactive	CELA1	19	42
O=C(CC1CC1)NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819123153	FC	On-Demand	Reactive	GRIN2B	57	53
O=C(CC1CC1)NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819123153	FC	On-Demand	Reactive	PREP	36	45
O=C(CC1CC1)NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819123153	FC	On-Demand	Reactive	LGMN	52	37
O=C(CC1CC1)NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819123153	FC	On-Demand	Reactive	TGM2	44	44
O=C(CC1CC1)NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819123153	FC	On-Demand	Reactive	F13A1	48	44
O=C(CC1CC1)NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819123153	FC	On-Demand	Reactive	CCR8	21	40
O=C(CC1CC1)NNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819123153	FC	On-Demand	Reactive	SLC12A5	53	36
O=C(CC1CC1)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1	ZINC000819123166	GE	On-Demand	Reactive	LIMK2	28	46
C[C@@H](NC(=O)CCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819123168	DD	On-Demand	Reactive	ACE	53	38
C[C@@H](NC(=O)CCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819123168	DD	On-Demand	Reactive	GRIN2B	23	42
C[C@@H](NC(=O)CCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819123168	DD	On-Demand	Reactive	MME	55	38
C[C@@H](NC(=O)CCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819123168	DD	On-Demand	Reactive	CTSB	23	41
C[C@@H](NC(=O)CCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819123168	DD	On-Demand	Reactive	PGA	24	42
C[C@@H](NC(=O)CCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819123168	DD	On-Demand	Reactive	CTRB1	22	40
C[C@@H](NC(=O)CCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819123168	DD	On-Demand	Reactive	CAPN1	56	38
C[C@@H](NC(=O)CCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819123168	DD	On-Demand	Reactive	CASP1	28	47
C[C@@H](NC(=O)CCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819123168	DD	On-Demand	Reactive	PSMB5	27	45
C[C@@H](NC(=O)CCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819123168	DD	On-Demand	Reactive	Q6PRC7_IXORI	44	33
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819123177	HD	On-Demand	Reactive	MMP13	29	40
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819123177	HD	On-Demand	Reactive	MMP3	23	40
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819123177	HD	On-Demand	Reactive	EPHX2	40	62
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819123177	HD	On-Demand	Reactive	TGM2	68	38
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819123177	HD	On-Demand	Reactive	MMP7	31	40
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819123177	HD	On-Demand	Reactive	MMP1	31	40
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819123177	HD	On-Demand	Reactive	F13A1	65	35
COc1cccc(C[C@@H](O)C(=O)NNC(=O)CC2CC2)c1	ZINC000819123185	CC	On-Demand	Reactive	MTNR1A	38	40
COc1cccc(C[C@@H](O)C(=O)NNC(=O)CC2CC2)c1	ZINC000819123185	CC	On-Demand	Reactive	MTNR1B	35	40
COc1cccc(C[C@H](O)C(=O)NNC(=O)CC2CC2)c1	ZINC000819123186	CC	On-Demand	Reactive	MTNR1A	38	40
COc1cccc(C[C@H](O)C(=O)NNC(=O)CC2CC2)c1	ZINC000819123186	CC	On-Demand	Reactive	MTNR1B	35	40
O=C(CC1CC1)NNC(=O)c1ccc(N2CCOCC2)c(F)c1	ZINC000819123188	DD	On-Demand	Reactive	SLC6A9	18	44
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	ZINC000819123193	GE	On-Demand	Reactive	SLC6A1	47	32
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	ZINC000819123194	GE	On-Demand	Reactive	SLC6A1	47	32
O=C(CC1CC1)NNC(=O)c1ccccc1OC1CCC1	ZINC000819123195	CE	On-Demand	Reactive	HCN1	58	34
O=C(CC1CC1)NNC(=O)c1ccccc1OC1CCC1	ZINC000819123195	CE	On-Demand	Reactive	HCN4	51	34
O=C(CC1CC1)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl	ZINC000819123208	ID	On-Demand	Reactive	NR1H4	15	40
O=C(CC1CC1)NNC(=O)c1cccc(-c2noc(C3CC3)n2)c1	ZINC000819123214	EE	On-Demand	Reactive	CPT1A	24	40
O=C(CC1CC1)NNC(=O)c1cccc(-c2noc(C3CC3)n2)c1	ZINC000819123214	EE	On-Demand	Reactive	GRM5	20	45
O=C(CC1CC1)NNC(=O)c1cccc(-c2noc(C3CC3)n2)c1	ZINC000819123214	EE	On-Demand	Reactive	ETHR	51	43
CC1(C)C[C@@H]1C(=O)NNC(=O)CC1CC1	ZINC000819123220	BC	On-Demand	Reactive	DPEP1	101	39
O=C(/C=C/c1ccccc1F)NNC(=O)CC1CC1	ZINC000819123231	CD	On-Demand	Reactive	KCNQ2	42	43
O=C(/C=C\c1ccccc1F)NNC(=O)CC1CC1	ZINC000819123232	CD	On-Demand	Reactive	KCNQ2	42	43
CO/C(=C\c1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819123242	CD	On-Demand	Reactive	TLR4	22	42
CO/C(=C/c1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819123243	CD	On-Demand	Reactive	TLR4	22	42
C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819123245	HE	On-Demand	Reactive	AKR1C3	44	47
CN1C(=O)CC[C@@H](C(=O)NNC(=O)CC2CC2)[C@@H]1c1ccc(C(F)(F)F)cc1	ZINC000819123270	GF	On-Demand	Reactive	P2RX7	30	44
CN1C(=O)CC[C@@H](C(=O)NNC(=O)CC2CC2)[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000819123272	GF	On-Demand	Reactive	P2RX7	30	44
CN1C(=O)CC[C@H](C(=O)NNC(=O)CC2CC2)[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000819123274	GF	On-Demand	Reactive	P2RX7	30	44
CN1C(=O)CC[C@H](C(=O)NNC(=O)CC2CC2)[C@@H]1c1ccc(C(F)(F)F)cc1	ZINC000819123276	GF	On-Demand	Reactive	P2RX7	30	44
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819123280	HG	On-Demand	Reactive	DRD4	25	41
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819123280	HG	On-Demand	Reactive	ACHE	17	43
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819123280	HG	On-Demand	Reactive	SIGMAR1	25	47
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819123280	HG	On-Demand	Reactive	PDK1	40	39
C#CCN1CCC[C@H]1C(=O)NNC(=O)CC1CC1	ZINC000819123286	BC	On-Demand	Reactive	HSD11B1	43	35
CCOc1ccccc1Oc1ccccc1C(=O)NNC(=O)CC1CC1	ZINC000819123298	FG	On-Demand	Reactive	HCN1	83	41
CCOc1ccccc1Oc1ccccc1C(=O)NNC(=O)CC1CC1	ZINC000819123298	FG	On-Demand	Reactive	HCN4	61	41
CCOc1ccccc1Oc1ccccc1C(=O)NNC(=O)CC1CC1	ZINC000819123298	FG	On-Demand	Reactive	KCNK3	33	41
CCOc1ccccc1Oc1ccccc1C(=O)NNC(=O)CC1CC1	ZINC000819123298	FG	On-Demand	Reactive	KCNK9	29	41
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)c1	ZINC000819123308	GH	On-Demand	Anodyne	NPY2R	71	39
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)c1	ZINC000819123310	GH	On-Demand	Anodyne	NPY2R	71	39
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)c1	ZINC000819123312	GH	On-Demand	Anodyne	NPY2R	71	39
O=C(CC1CC1)NNC(=O)C1(c2ccc(OCc3ccccc3)cc2)CCOCC1	ZINC000819123320	HG	On-Demand	Reactive	LTA4H	24	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	ZINC000819123369	GE	On-Demand	Anodyne	ITGAL	42	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N2CCOCC2)c1	ZINC000819123369	GE	On-Demand	Anodyne	EPHX2	27	52
O=C(CC1CC1)NNC(=O)c1cnc(Oc2ccccc2)cn1	ZINC000819123372	DD	On-Demand	Reactive	GRIN2B	23	40
C[C@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(F)cc1F	ZINC000819123375	GH	On-Demand	Anodyne	GPR119	51	58
C[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(F)cc1F	ZINC000819123377	GH	On-Demand	Anodyne	GPR119	51	58
C[C@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(F)cc1F	ZINC000819123379	GH	On-Demand	Anodyne	GPR119	51	58
C[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(F)cc1F	ZINC000819123381	GH	On-Demand	Anodyne	GPR119	51	58
O=C(CC1CC1)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)cc1	ZINC000819123399	GE	On-Demand	Reactive	PRTN3	62	40
O=C(CC1CC1)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)cc1	ZINC000819123399	GE	On-Demand	Reactive	CCR8	44	32
CCCOc1ccc(C(=O)NNC(=O)CC2CC2)c(OC2CCCC2)c1	ZINC000819123401	FG	On-Demand	Reactive	ADRB3	16	40
COc1cc(I)c(Cl)cc1C(=O)NNC(=O)CC1CC1	ZINC000819123415	HF	On-Demand	Reactive	HTR4	78	44
COc1cccc(C2=NO[C@H](C(=O)NNC(=O)CC3CC3)C2)c1	ZINC000819123422	DD	On-Demand	Reactive	LUCI_PHOPY	49	50
COc1cccc(C2=NO[C@@H](C(=O)NNC(=O)CC3CC3)C2)c1	ZINC000819123423	DD	On-Demand	Reactive	LUCI_PHOPY	49	50
O=C1C[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)CN1[C@@H]1C[C@H]1c1ccccc1	ZINC000819123438	GG	On-Demand	Anodyne	HSD17B2	17	41
O=C1C[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)CN1[C@@H]1C[C@@H]1c1ccccc1	ZINC000819123441	GG	On-Demand	Anodyne	HSD17B2	17	41
O=C1C[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)CN1[C@H]1C[C@H]1c1ccccc1	ZINC000819123442	GG	On-Demand	Anodyne	HSD17B2	17	41
O=C1C[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)CN1[C@H]1C[C@@H]1c1ccccc1	ZINC000819123443	GG	On-Demand	Anodyne	HSD17B2	17	41
O=C(CC1CC1)NNC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000819123450	GF	On-Demand	Reactive	CHRM2	19	44
O=C(CC1CC1)NNC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000819123450	GF	On-Demand	Reactive	CCR8	44	31
O=C(CC1CC1)NNC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000819123450	GF	On-Demand	Reactive	L3MBTL3	43	44
O=C(CC1CC1)NNC(=O)c1cc(-c2ccccc2)n(-c2ccccc2)n1	ZINC000819123451	FG	On-Demand	Reactive	RPA1	111	45
O=C(CC1CC1)NNC(=O)/C(=C\c1ccco1)NC(=O)c1ccccc1	ZINC000819123459	FD	On-Demand	Reactive	ADAM12	36	44
O=C(CC1CC1)NNC(=O)/C(=C/c1ccco1)NC(=O)c1ccccc1	ZINC000819123460	FD	On-Demand	Reactive	ADAM12	36	44
N#Cc1ccccc1Oc1ccccc1C(=O)NNC(=O)CC1CC1	ZINC000819123466	EF	On-Demand	Reactive	EZH2	33	43
O=C(CC1CC1)NNC(=O)C[C@H]1CCOc2ccccc21	ZINC000819123474	CD	On-Demand	Reactive	TRAR	45	33
O=C(CC1CC1)NNC(=O)C[C@@H]1CCOc2ccccc21	ZINC000819123475	CD	On-Demand	Reactive	TRAR	45	33
O=C(CCCCc1ccc(Cl)c(Cl)c1)NNC(=O)CC1CC1	ZINC000819123480	EH	On-Demand	Reactive	SIGMAR1	15	41
Cc1sc2ncnc(N3CCC(C(=O)NNC(=O)CC4CC4)CC3)c2c1C	ZINC000819123487	GE	On-Demand	Reactive	SIRT3	59	39
Cc1sc2ncnc(N3CCC(C(=O)NNC(=O)CC4CC4)CC3)c2c1C	ZINC000819123487	GE	On-Demand	Reactive	SIRT2	52	33
Cc1sc2ncnc(N3CCC(C(=O)NNC(=O)CC4CC4)CC3)c2c1C	ZINC000819123487	GE	On-Demand	Reactive	SIRT1	50	32
O=C(CC1CC1)NNC(=O)Cn1ccc2ccc(Cl)cc21	ZINC000819123493	DE	On-Demand	Reactive	NPY5R	17	56
COc1ccc(OC)c([C@H](O)CNC[C@@H](OC)c2cccc(Cl)c2)c1	ZINC000819123503	FG	On-Demand	Anodyne	ADRB2	15	44
COc1ccc(OC)c([C@H](O)CNC[C@@H](OC)c2cccc(Cl)c2)c1	ZINC000819123503	FG	On-Demand	Anodyne	ADRB1	29	46
COc1ccc(OC)c([C@H](O)CNC[C@@H](OC)c2cccc(Cl)c2)c1	ZINC000819123503	FG	On-Demand	Anodyne	ADRB3	42	46
COc1ccc(OC)c([C@H](O)CNC[C@H](OC)c2cccc(Cl)c2)c1	ZINC000819123504	FG	On-Demand	Anodyne	ADRB2	15	44
COc1ccc(OC)c([C@H](O)CNC[C@H](OC)c2cccc(Cl)c2)c1	ZINC000819123504	FG	On-Demand	Anodyne	ADRB1	29	46
COc1ccc(OC)c([C@H](O)CNC[C@H](OC)c2cccc(Cl)c2)c1	ZINC000819123504	FG	On-Demand	Anodyne	ADRB3	42	46
CC(C)(C)OC(=O)NC1CCN(C(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819123507	FF	On-Demand	Anodyne	INHA	32	41
CC(C)(C)OC(=O)NC1CCN(C(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819123507	FF	On-Demand	Anodyne	CCR8	78	38
CC(C)(C)OC(=O)NC1CCN(C(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819123507	FF	On-Demand	Anodyne	SFRP1	58	35
C[C@@H]1C[C@@H]1N1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819123509	DD	On-Demand	Anodyne	ADRB1	30	44
C[C@@H]1C[C@@H]1N1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819123509	DD	On-Demand	Anodyne	ADRB3	48	46
C[C@@H]1C[C@@H]1N1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819123509	DD	On-Demand	Anodyne	CYP3A4	47	36
C[C@@H]1C[C@@H]1N1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819123510	DD	On-Demand	Anodyne	ADRB1	30	44
C[C@@H]1C[C@@H]1N1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819123510	DD	On-Demand	Anodyne	ADRB3	48	46
C[C@@H]1C[C@@H]1N1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819123510	DD	On-Demand	Anodyne	CYP3A4	47	36
C[C@@H]1C[C@@H]1N1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819123511	DD	On-Demand	Anodyne	ADRB1	30	44
C[C@@H]1C[C@@H]1N1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819123511	DD	On-Demand	Anodyne	ADRB3	48	46
C[C@@H]1C[C@@H]1N1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819123511	DD	On-Demand	Anodyne	CYP3A4	47	36
C[C@@H]1C[C@@H]1N1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819123512	DD	On-Demand	Anodyne	ADRB1	30	44
C[C@@H]1C[C@@H]1N1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819123512	DD	On-Demand	Anodyne	ADRB3	48	46
C[C@@H]1C[C@@H]1N1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819123512	DD	On-Demand	Anodyne	CYP3A4	47	36
C=CCC1(C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CCOCC1	ZINC000819123548	GH	On-Demand	Mild	NPY2R	52	36
C=CCC1(C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCOCC1	ZINC000819123549	GH	On-Demand	Mild	NPY2R	52	36
C=CCC1(C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCOCC1	ZINC000819123550	GH	On-Demand	Mild	NPY2R	52	36
CC(C)(C)OC(=O)NC1CCN(C(=O)Cc2nsc3ccccc23)CC1	ZINC000819123553	GG	On-Demand	Anodyne	DRD2	18	41
CC(C)(C)OC(=O)NC1CCN(C(=O)Cc2nsc3ccccc23)CC1	ZINC000819123553	GG	On-Demand	Anodyne	CCR8	64	36
CC(C)(C)OC(=O)NC1CCN(C(=O)Cc2nsc3ccccc23)CC1	ZINC000819123553	GG	On-Demand	Anodyne	SFRP1	42	36
COc1ccc([C@@H](NC[C@H](O)C2CC2)c2cccc(S(C)(=O)=O)c2)cc1	ZINC000819123563	GF	On-Demand	Anodyne	ADRB3	17	46
COc1ccc([C@@H](NC[C@@H](O)C2CC2)c2cccc(S(C)(=O)=O)c2)cc1	ZINC000819123564	GF	On-Demand	Anodyne	ADRB3	17	46
O=C1C[C@H](NC[C@H](O)c2cccnc2)CN1[C@@H]1C[C@@H]1c1ccccc1	ZINC000819123576	ED	On-Demand	Anodyne	ADRB3	53	44
O=C1C[C@H](NC[C@H](O)c2cccnc2)CN1[C@@H]1C[C@H]1c1ccccc1	ZINC000819123577	ED	On-Demand	Anodyne	ADRB3	53	44
O=C1C[C@H](NC[C@H](O)c2cccnc2)CN1[C@H]1C[C@@H]1c1ccccc1	ZINC000819123578	ED	On-Demand	Anodyne	ADRB3	53	44
O=C1C[C@H](NC[C@H](O)c2cccnc2)CN1[C@H]1C[C@H]1c1ccccc1	ZINC000819123579	ED	On-Demand	Anodyne	ADRB3	53	44
CC(C)(C)OC(=O)N1CCC(NC(=O)Cc2nsc3ccccc23)CC1	ZINC000819123581	GG	On-Demand	Anodyne	EPHX2	23	43
CC(C)(C)OC(=O)N1CCC(NC(=O)Cc2nsc3ccccc23)CC1	ZINC000819123581	GG	On-Demand	Anodyne	CCR8	58	44
CC(C)(C)OC(=O)N1CCC(NC(=O)Cc2nsc3ccccc23)CC1	ZINC000819123581	GG	On-Demand	Anodyne	GPR119	45	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(Cl)c(F)c1)C2	ZINC000819123582	EG	On-Demand	Anodyne	ENV	45	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(Cl)c(F)c1)C2	ZINC000819123583	EG	On-Demand	Anodyne	ENV	45	39
C[C@@H]1C[C@H]1N1C[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CC1=O	ZINC000819123588	DD	On-Demand	Anodyne	ADRB3	19	41
C[C@@H]1C[C@@H]1N1C[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CC1=O	ZINC000819123589	DD	On-Demand	Anodyne	ADRB3	19	41
C[C@@H]1C[C@H]1N1C[C@H](NC[C@H](O)c2ccc(Cl)cc2)CC1=O	ZINC000819123590	DD	On-Demand	Anodyne	ADRB3	19	41
C[C@@H]1C[C@@H]1N1C[C@H](NC[C@H](O)c2ccc(Cl)cc2)CC1=O	ZINC000819123591	DD	On-Demand	Anodyne	ADRB3	19	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1(c3ccc(F)cc3)CC1)C2	ZINC000819123619	FF	On-Demand	Anodyne	KCNA3	40	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1(c3ccc(F)cc3)CC1)C2	ZINC000819123619	FF	On-Demand	Anodyne	CACNA1G	17	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1(c3ccc(F)cc3)CC1)C2	ZINC000819123620	FF	On-Demand	Anodyne	KCNA3	40	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1(c3ccc(F)cc3)CC1)C2	ZINC000819123620	FF	On-Demand	Anodyne	CACNA1G	17	42
CC(C)(C)OC(=O)N1CCC(NC(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819123621	FF	On-Demand	Anodyne	INHA	47	33
CC(C)(C)OC(=O)N1CCC(NC(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819123621	FF	On-Demand	Anodyne	EPHX2	20	46
CC(C)(C)OC(=O)N1CCC(NC(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819123621	FF	On-Demand	Anodyne	CCR8	90	49
CC(C)(C)OC(=O)N1CCC(NC(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819123621	FF	On-Demand	Anodyne	GPR119	40	41
CC(C)(C)OC(=O)N1CCC(NC(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819123621	FF	On-Demand	Anodyne	SFRP1	25	40
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(Cl)cc1	ZINC000819123640	FG	On-Demand	Bother	ADRB1	31	42
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(Cl)cc1	ZINC000819123640	FG	On-Demand	Bother	ADRB3	51	42
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(Cl)cc1	ZINC000819123640	FG	On-Demand	Bother	CACNA1D	41	35
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(Cl)cc1	ZINC000819123641	FG	On-Demand	Bother	ADRB1	31	42
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(Cl)cc1	ZINC000819123641	FG	On-Demand	Bother	ADRB3	51	42
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(Cl)cc1	ZINC000819123641	FG	On-Demand	Bother	CACNA1D	41	35
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(Cl)cc1	ZINC000819123642	FG	On-Demand	Bother	ADRB1	31	42
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(Cl)cc1	ZINC000819123642	FG	On-Demand	Bother	ADRB3	51	42
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(Cl)cc1	ZINC000819123642	FG	On-Demand	Bother	CACNA1D	41	35
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(Cl)cc1	ZINC000819123643	FG	On-Demand	Bother	ADRB1	31	42
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(Cl)cc1	ZINC000819123643	FG	On-Demand	Bother	ADRB3	51	42
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccc(Cl)cc1	ZINC000819123643	FG	On-Demand	Bother	CACNA1D	41	35
O=C(Nc1cccc(C(=O)N2CCOCC2)c1)C(F)=C1CCC1	ZINC000819123644	DF	On-Demand	Anodyne	EPHX2	24	57
O=C(Nc1cccc(C(=O)N2CCOCC2)c1)C(F)=C1CCC1	ZINC000819123644	DF	On-Demand	Anodyne	AKR1C3	15	41
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819123645	GE	On-Demand	Anodyne	ITGAL	43	35
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819123646	GE	On-Demand	Anodyne	ITGAL	43	35
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819123647	GE	On-Demand	Anodyne	ITGAL	43	35
C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819123648	GE	On-Demand	Anodyne	ITGAL	43	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819123664	GE	On-Demand	Anodyne	EPHX2	17	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819123664	GE	On-Demand	Anodyne	GPR119	34	41
COC(=O)c1ccc(CCNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2Cl)cc1	ZINC000819123697	HE	On-Demand	Anodyne	CA2	26	52
COC(=O)c1ccc(CCNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2Cl)cc1	ZINC000819123697	HE	On-Demand	Anodyne	CA1	26	52
COC(=O)c1ccc(CCNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2Cl)cc1	ZINC000819123697	HE	On-Demand	Anodyne	CA4	20	52
COC(=O)c1ccc(CCNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2Cl)cc1	ZINC000819123697	HE	On-Demand	Anodyne	CA14	15	44
COC(=O)c1ccc(CCNC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)cc1	ZINC000819123708	IG	On-Demand	Anodyne	CA2	18	45
COC(=O)c1ccc(CCNC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)cc1	ZINC000819123708	IG	On-Demand	Anodyne	CA1	17	42
COC(=O)c1ccc(CCNC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)cc1	ZINC000819123708	IG	On-Demand	Anodyne	KCNA5	16	44
COC(=O)c1ccc(CCNC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)cc1	ZINC000819123708	IG	On-Demand	Anodyne	CA5B	17	40
O[C@H](CNCCc1nc(C(F)(F)F)cs1)c1cccc(Cl)c1	ZINC000819123711	FH	On-Demand	Anodyne	ADRB1	49	51
O[C@H](CNCCc1nc(C(F)(F)F)cs1)c1cccc(Cl)c1	ZINC000819123711	FH	On-Demand	Anodyne	ADRB3	92	51
O[C@@H](CNCCc1nc(C(F)(F)F)cs1)c1cccc(Cl)c1	ZINC000819123712	FH	On-Demand	Anodyne	ADRB1	49	51
O[C@@H](CNCCc1nc(C(F)(F)F)cs1)c1cccc(Cl)c1	ZINC000819123712	FH	On-Demand	Anodyne	ADRB3	92	51
O[C@@H](CNCCC(F)(F)F)c1ccc(Cl)c(F)c1	ZINC000819123719	CG	On-Demand	Anodyne	ADRB2	15	41
O[C@@H](CNCCC(F)(F)F)c1ccc(Cl)c(F)c1	ZINC000819123719	CG	On-Demand	Anodyne	ADRB1	15	41
O[C@H](CNCCC(F)(F)F)c1ccc(Cl)c(F)c1	ZINC000819123720	CG	On-Demand	Anodyne	ADRB2	15	41
O[C@H](CNCCC(F)(F)F)c1ccc(Cl)c(F)c1	ZINC000819123720	CG	On-Demand	Anodyne	ADRB1	15	41
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc2nc(O)[nH]c2c1	ZINC000819123721	DE	On-Demand	Anodyne	KCNQ2	46	35
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc2nc(O)[nH]c2c1	ZINC000819123722	DE	On-Demand	Anodyne	KCNQ2	46	35
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc2nc(O)[nH]c2c1	ZINC000819123723	DE	On-Demand	Anodyne	KCNQ2	46	35
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc2nc(O)[nH]c2c1	ZINC000819123724	DE	On-Demand	Anodyne	KCNQ2	46	35
CCSCC[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819123745	CF	On-Demand	Bother	ADRB1	28	41
CCSCC[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819123745	CF	On-Demand	Bother	ADRB3	55	41
CCSCC[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819123745	CF	On-Demand	Bother	CACNA1D	55	35
CCSCC[C@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819123746	CF	On-Demand	Bother	ADRB1	28	41
CCSCC[C@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819123746	CF	On-Demand	Bother	ADRB3	55	41
CCSCC[C@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819123746	CF	On-Demand	Bother	CACNA1D	55	35
CCSCC[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819123747	CF	On-Demand	Bother	ADRB1	28	41
CCSCC[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819123747	CF	On-Demand	Bother	ADRB3	55	41
CCSCC[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819123747	CF	On-Demand	Bother	CACNA1D	55	35
CCSCC[C@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819123748	CF	On-Demand	Bother	ADRB1	28	41
CCSCC[C@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819123748	CF	On-Demand	Bother	ADRB3	55	41
CCSCC[C@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819123748	CF	On-Demand	Bother	CACNA1D	55	35
O=C(/C=C/[C@H]1CCCO1)Nc1ccccc1NC(=O)N1CCCC1	ZINC000819123749	EF	On-Demand	Anodyne	RBP4	50	42
O=C(/C=C\[C@H]1CCCO1)Nc1ccccc1NC(=O)N1CCCC1	ZINC000819123750	EF	On-Demand	Anodyne	RBP4	50	42
O=C(/C=C\[C@@H]1CCCO1)Nc1ccccc1NC(=O)N1CCCC1	ZINC000819123751	EF	On-Demand	Anodyne	RBP4	50	42
O=C(/C=C/[C@@H]1CCCO1)Nc1ccccc1NC(=O)N1CCCC1	ZINC000819123752	EF	On-Demand	Anodyne	RBP4	50	42
CCSCC[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819123757	CG	On-Demand	Anodyne	ADRB2	41	37
CCSCC[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819123757	CG	On-Demand	Anodyne	ADRB1	46	57
CCSCC[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819123757	CG	On-Demand	Anodyne	ADRB3	71	57
CCSCC[C@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819123758	CG	On-Demand	Anodyne	ADRB2	41	37
CCSCC[C@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819123758	CG	On-Demand	Anodyne	ADRB1	46	57
CCSCC[C@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819123758	CG	On-Demand	Anodyne	ADRB3	71	57
CCSCC[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819123759	CG	On-Demand	Anodyne	ADRB2	41	37
CCSCC[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819123759	CG	On-Demand	Anodyne	ADRB1	46	57
CCSCC[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819123759	CG	On-Demand	Anodyne	ADRB3	71	57
CCSCC[C@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819123760	CG	On-Demand	Anodyne	ADRB2	41	37
CCSCC[C@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819123760	CG	On-Demand	Anodyne	ADRB1	46	57
CCSCC[C@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819123760	CG	On-Demand	Anodyne	ADRB3	71	57
COc1cccc([S@@](=O)CC(=O)NC2CCC3(CC2)OCCO3)c1	ZINC000819123763	FD	On-Demand	Anodyne	C5AR1	16	45
C[C@H](CC(=O)Oc1ccc(NC(=O)C2CC2)cc1)n1cccn1	ZINC000819123767	DF	On-Demand	Anodyne	PFKFB3	56	37
O[C@H](CNCCc1nc(C(F)(F)F)cs1)c1ccccc1	ZINC000819123773	DG	On-Demand	Anodyne	ADRB2	28	46
O[C@H](CNCCc1nc(C(F)(F)F)cs1)c1ccccc1	ZINC000819123773	DG	On-Demand	Anodyne	ADRB1	32	42
O[C@H](CNCCc1nc(C(F)(F)F)cs1)c1ccccc1	ZINC000819123773	DG	On-Demand	Anodyne	ADRB3	89	46
O[C@@H](CNCCc1nc(C(F)(F)F)cs1)c1ccccc1	ZINC000819123774	DG	On-Demand	Anodyne	ADRB2	28	46
O[C@@H](CNCCc1nc(C(F)(F)F)cs1)c1ccccc1	ZINC000819123774	DG	On-Demand	Anodyne	ADRB1	32	42
O[C@@H](CNCCc1nc(C(F)(F)F)cs1)c1ccccc1	ZINC000819123774	DG	On-Demand	Anodyne	ADRB3	89	46
COc1cccc([S@@](=O)CC(=O)NCCS(C)(=O)=O)c1	ZINC000819123783	DB	On-Demand	Anodyne	DRD4	41	31
COc1cccc([S@@](=O)CC(=O)NCCS(C)(=O)=O)c1	ZINC000819123783	DB	On-Demand	Anodyne	MTNR1A	65	42
COc1cccc([S@@](=O)CC(=O)NCCS(C)(=O)=O)c1	ZINC000819123783	DB	On-Demand	Anodyne	MTNR1B	59	42
O[C@@H](CNCCC(F)(F)F)c1cccc(Cl)c1	ZINC000819123881	CF	On-Demand	Anodyne	ADRB2	41	39
O[C@@H](CNCCC(F)(F)F)c1cccc(Cl)c1	ZINC000819123881	CF	On-Demand	Anodyne	ADRB1	54	55
O[C@@H](CNCCC(F)(F)F)c1cccc(Cl)c1	ZINC000819123881	CF	On-Demand	Anodyne	ADRB3	70	55
O[C@H](CNCCC(F)(F)F)c1cccc(Cl)c1	ZINC000819123882	CF	On-Demand	Anodyne	ADRB2	41	39
O[C@H](CNCCC(F)(F)F)c1cccc(Cl)c1	ZINC000819123882	CF	On-Demand	Anodyne	ADRB1	54	55
O[C@H](CNCCC(F)(F)F)c1cccc(Cl)c1	ZINC000819123882	CF	On-Demand	Anodyne	ADRB3	70	55
O=C(Nc1ccccc1NC(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819123895	DH	On-Demand	Anodyne	KCNQ2	45	33
O=C(Nc1ccccc1NC(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819123895	DH	On-Demand	Anodyne	RBP4	52	36
O[C@H](CNCCc1nc(C(F)(F)F)cs1)c1ccc(F)c(F)c1	ZINC000819123923	FG	On-Demand	Anodyne	ADRB3	38	42
O[C@@H](CNCCc1nc(C(F)(F)F)cs1)c1ccc(F)c(F)c1	ZINC000819123924	FG	On-Demand	Anodyne	ADRB3	38	42
COc1cccc([S@@](=O)CC(=O)Oc2ccc(NC(=O)C3CC3)cc2)c1	ZINC000819123931	FF	On-Demand	Anodyne	MTNR1A	42	60
COc1cccc([S@@](=O)CC(=O)Oc2ccc(NC(=O)C3CC3)cc2)c1	ZINC000819123931	FF	On-Demand	Anodyne	MTNR1B	43	60
COc1cccc([S@@](=O)CC(=O)Oc2ccc(NC(=O)C3CC3)cc2)c1	ZINC000819123931	FF	On-Demand	Anodyne	ACR	49	41
O[C@H](CNCCc1nc(C(F)(F)F)cs1)c1cccc(F)c1	ZINC000819123943	EG	On-Demand	Anodyne	ADRB1	23	41
O[C@H](CNCCc1nc(C(F)(F)F)cs1)c1cccc(F)c1	ZINC000819123943	EG	On-Demand	Anodyne	ADRB3	69	41
O[C@@H](CNCCc1nc(C(F)(F)F)cs1)c1cccc(F)c1	ZINC000819123944	EG	On-Demand	Anodyne	ADRB1	23	41
O[C@@H](CNCCc1nc(C(F)(F)F)cs1)c1cccc(F)c1	ZINC000819123944	EG	On-Demand	Anodyne	ADRB3	69	41
O[C@H](CNCCc1nc(C(F)(F)F)cs1)c1cccc(C(F)(F)F)c1	ZINC000819123953	GI	On-Demand	Anodyne	ADRB2	23	44
O[C@H](CNCCc1nc(C(F)(F)F)cs1)c1cccc(C(F)(F)F)c1	ZINC000819123953	GI	On-Demand	Anodyne	ADRB3	62	44
O[C@@H](CNCCc1nc(C(F)(F)F)cs1)c1cccc(C(F)(F)F)c1	ZINC000819123954	GI	On-Demand	Anodyne	ADRB2	23	44
O[C@@H](CNCCc1nc(C(F)(F)F)cs1)c1cccc(C(F)(F)F)c1	ZINC000819123954	GI	On-Demand	Anodyne	ADRB3	62	44
O=C(NCc1ccccc1[N+](=O)[O-])C(F)=C1CCC1	ZINC000819124025	CF	On-Demand	Bother	COLA	110	36
Cc1nc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)sc1C	ZINC000819124031	FG	On-Demand	Mild	PAPA1_CARPA	39	46
Cc1nc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)sc1C	ZINC000819124032	FG	On-Demand	Mild	PAPA1_CARPA	39	46
CC(=O)Nc1cccc(CC(=O)Oc2ccc(NC(=O)C3CC3)cc2)c1	ZINC000819124039	FG	On-Demand	Anodyne	TSHR	62	34
CC(=O)Nc1cccc(CC(=O)Oc2ccc(NC(=O)C3CC3)cc2)c1	ZINC000819124039	FG	On-Demand	Anodyne	MTNR1A	27	50
CC(=O)Nc1cccc(CC(=O)Oc2ccc(NC(=O)C3CC3)cc2)c1	ZINC000819124039	FG	On-Demand	Anodyne	MTNR1B	25	50
CCSCC[C@H](C)NC[C@H](O)c1cccnc1	ZINC000819124040	CE	On-Demand	Anodyne	ADRB1	29	55
CCSCC[C@H](C)NC[C@H](O)c1cccnc1	ZINC000819124040	CE	On-Demand	Anodyne	ADRB3	71	55
CCSCC[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819124041	CE	On-Demand	Anodyne	ADRB1	29	55
CCSCC[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819124041	CE	On-Demand	Anodyne	ADRB3	71	55
CCSCC[C@H](C)NC[C@@H](O)c1cccnc1	ZINC000819124042	CE	On-Demand	Anodyne	ADRB1	29	55
CCSCC[C@H](C)NC[C@@H](O)c1cccnc1	ZINC000819124042	CE	On-Demand	Anodyne	ADRB3	71	55
CCSCC[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819124043	CE	On-Demand	Anodyne	ADRB1	29	55
CCSCC[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819124043	CE	On-Demand	Anodyne	ADRB3	71	55
O=C(Oc1ccc(NC(=O)C2CC2)cc1)c1cc2c(cn1)OCCO2	ZINC000819124046	EE	On-Demand	Anodyne	ACR	41	33
CS(=O)(=O)c1ccc([C@H](O)CNCCc2nc(C(F)(F)F)cs2)cc1	ZINC000819124055	GE	On-Demand	Anodyne	ADRB2	26	43
CS(=O)(=O)c1ccc([C@H](O)CNCCc2nc(C(F)(F)F)cs2)cc1	ZINC000819124055	GE	On-Demand	Anodyne	PTGS2	25	41
CS(=O)(=O)c1ccc([C@H](O)CNCCc2nc(C(F)(F)F)cs2)cc1	ZINC000819124055	GE	On-Demand	Anodyne	ADRB3	85	43
CS(=O)(=O)c1ccc([C@H](O)CNCCc2nc(C(F)(F)F)cs2)cc1	ZINC000819124055	GE	On-Demand	Anodyne	TRPV1	76	35
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2nc(C(F)(F)F)cs2)cc1	ZINC000819124056	GE	On-Demand	Anodyne	ADRB2	26	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2nc(C(F)(F)F)cs2)cc1	ZINC000819124056	GE	On-Demand	Anodyne	PTGS2	25	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2nc(C(F)(F)F)cs2)cc1	ZINC000819124056	GE	On-Demand	Anodyne	ADRB3	85	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2nc(C(F)(F)F)cs2)cc1	ZINC000819124056	GE	On-Demand	Anodyne	TRPV1	76	35
O=C(Nc1ccc(F)cc1)NC1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819124090	EG	On-Demand	Anodyne	CCR3	29	40
O=C(Nc1ccc(F)cc1)NC1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819124090	EG	On-Demand	Anodyne	EPHX2	59	49
O=C(Nc1ccc(F)cc1)NC1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819124090	EG	On-Demand	Anodyne	CXCR3	15	40
CCSCC[C@@H](C)NC[C@H](O)c1cccc2ccccc12	ZINC000819124093	DH	On-Demand	Anodyne	ADRB2	17	44
CCSCC[C@@H](C)NC[C@H](O)c1cccc2ccccc12	ZINC000819124093	DH	On-Demand	Anodyne	ADRB1	15	42
CCSCC[C@@H](C)NC[C@H](O)c1cccc2ccccc12	ZINC000819124093	DH	On-Demand	Anodyne	ADRB3	25	42
CCSCC[C@H](C)NC[C@H](O)c1cccc2ccccc12	ZINC000819124094	DH	On-Demand	Anodyne	ADRB2	17	44
CCSCC[C@H](C)NC[C@H](O)c1cccc2ccccc12	ZINC000819124094	DH	On-Demand	Anodyne	ADRB1	15	42
CCSCC[C@H](C)NC[C@H](O)c1cccc2ccccc12	ZINC000819124094	DH	On-Demand	Anodyne	ADRB3	25	42
C=CCCn1cc(C(=O)NCCCN2CCN(C(=O)OC(C)(C)C)CC2)nn1	ZINC000819124099	GD	On-Demand	Mild	DRD2	20	40
C=CCCn1cc(C(=O)NCCCN2CCN(C(=O)OC(C)(C)C)CC2)nn1	ZINC000819124099	GD	On-Demand	Mild	DRD3	39	40
CC(=O)Nc1cccc(CC(=O)NC2CCC3(CC2)OCCO3)c1	ZINC000819124116	ED	On-Demand	Anodyne	SIGMAR1	17	42
O=C(/C=C\[C@@H]1CCCO1)Nc1ncc(Cc2ccccc2)s1	ZINC000819124163	DG	On-Demand	Anodyne	CDK5	49	45
O=C(/C=C\[C@@H]1CCCO1)Nc1ncc(Cc2ccccc2)s1	ZINC000819124163	DG	On-Demand	Anodyne	SCD	31	43
O=C(/C=C\[C@@H]1CCCO1)Nc1ncc(Cc2ccccc2)s1	ZINC000819124163	DG	On-Demand	Anodyne	MGEA5	34	41
O=C(/C=C/[C@H]1CCCO1)Nc1ncc(Cc2ccccc2)s1	ZINC000819124164	DG	On-Demand	Anodyne	CDK5	49	45
O=C(/C=C/[C@H]1CCCO1)Nc1ncc(Cc2ccccc2)s1	ZINC000819124164	DG	On-Demand	Anodyne	SCD	31	43
O=C(/C=C/[C@H]1CCCO1)Nc1ncc(Cc2ccccc2)s1	ZINC000819124164	DG	On-Demand	Anodyne	MGEA5	34	41
O=C(/C=C\[C@H]1CCCO1)Nc1ncc(Cc2ccccc2)s1	ZINC000819124165	DG	On-Demand	Anodyne	CDK5	49	45
O=C(/C=C\[C@H]1CCCO1)Nc1ncc(Cc2ccccc2)s1	ZINC000819124165	DG	On-Demand	Anodyne	SCD	31	43
O=C(/C=C\[C@H]1CCCO1)Nc1ncc(Cc2ccccc2)s1	ZINC000819124165	DG	On-Demand	Anodyne	MGEA5	34	41
O=C(/C=C/[C@@H]1CCCO1)Nc1ncc(Cc2ccccc2)s1	ZINC000819124166	DG	On-Demand	Anodyne	CDK5	49	45
O=C(/C=C/[C@@H]1CCCO1)Nc1ncc(Cc2ccccc2)s1	ZINC000819124166	DG	On-Demand	Anodyne	SCD	31	43
O=C(/C=C/[C@@H]1CCCO1)Nc1ncc(Cc2ccccc2)s1	ZINC000819124166	DG	On-Demand	Anodyne	MGEA5	34	41
O[C@H](CNCCc1nc(C(F)(F)F)cs1)c1cccc(Br)c1	ZINC000819124168	GH	On-Demand	Anodyne	ADRB3	59	38
O[C@@H](CNCCc1nc(C(F)(F)F)cs1)c1cccc(Br)c1	ZINC000819124169	GH	On-Demand	Anodyne	ADRB3	59	38
COc1ccccc1-c1noc([C@H](C)NCCS(C)(=O)=O)n1	ZINC000819124170	ED	On-Demand	Anodyne	LUCI_PHOPE	33	46
COc1ccccc1-c1noc([C@@H](C)NCCS(C)(=O)=O)n1	ZINC000819124171	ED	On-Demand	Anodyne	LUCI_PHOPE	33	46
CCSCC[C@@H](C)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819124175	FG	On-Demand	Anodyne	GPR119	25	42
CCSCC[C@H](C)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819124176	FG	On-Demand	Anodyne	GPR119	25	42
CCSCC[C@H](C)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819124177	FG	On-Demand	Anodyne	GPR119	25	42
CCSCC[C@@H](C)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819124178	FG	On-Demand	Anodyne	GPR119	25	42
CCSCC[C@@H](C)NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819124179	EH	On-Demand	Anodyne	ADRB2	18	42
CCSCC[C@H](C)NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819124180	EH	On-Demand	Anodyne	ADRB2	18	42
CCSCC[C@@H](C)NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819124181	EH	On-Demand	Anodyne	ADRB2	18	42
CCSCC[C@H](C)NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819124182	EH	On-Demand	Anodyne	ADRB2	18	42
CCOC(=O)N1CCC(C(=O)NCCc2ccc(C(=O)OC)cc2)CC1	ZINC000819124188	FE	On-Demand	Anodyne	MTNR1A	19	40
CCOC(=O)N1CCC(C(=O)NCCc2ccc(C(=O)OC)cc2)CC1	ZINC000819124188	FE	On-Demand	Anodyne	MTNR1B	16	44
CCOC(=O)N1CCC(C(=O)NCCc2ccc(C(=O)OC)cc2)CC1	ZINC000819124188	FE	On-Demand	Anodyne	EPHX2	16	44
CCOC(=O)N1CCC(C(=O)NCCc2ccc(C(=O)OC)cc2)CC1	ZINC000819124188	FE	On-Demand	Anodyne	CCR8	23	43
C[C@@H](Cn1cncn1)NC(=O)C(F)=C1CCC1	ZINC000819124191	BD	On-Demand	Anodyne	HIS3	86	40
O[C@H](CNCCc1nc(C(F)(F)F)cs1)c1ccc(C(F)(F)F)cc1	ZINC000819124193	GI	On-Demand	Anodyne	ADRB3	28	46
O[C@@H](CNCCc1nc(C(F)(F)F)cs1)c1ccc(C(F)(F)F)cc1	ZINC000819124194	GI	On-Demand	Anodyne	ADRB3	28	46
O[C@@H](CNCCc1nc(C(F)(F)F)cs1)c1cccnc1	ZINC000819124209	DE	On-Demand	Anodyne	ADRB2	34	47
O[C@@H](CNCCc1nc(C(F)(F)F)cs1)c1cccnc1	ZINC000819124209	DE	On-Demand	Anodyne	ADRB1	39	55
O[C@@H](CNCCc1nc(C(F)(F)F)cs1)c1cccnc1	ZINC000819124209	DE	On-Demand	Anodyne	ADRB3	131	52
O[C@H](CNCCc1nc(C(F)(F)F)cs1)c1cccnc1	ZINC000819124210	DE	On-Demand	Anodyne	ADRB2	34	47
O[C@H](CNCCc1nc(C(F)(F)F)cs1)c1cccnc1	ZINC000819124210	DE	On-Demand	Anodyne	ADRB1	39	55
O[C@H](CNCCc1nc(C(F)(F)F)cs1)c1cccnc1	ZINC000819124210	DE	On-Demand	Anodyne	ADRB3	131	52
COc1cc(CNC(=O)C(F)=C2CCC2)ccc1OCC(N)=O	ZINC000819124223	DD	On-Demand	Anodyne	MT-ND1	23	42
COc1cc(CNC(=O)C(F)=C2CCC2)ccc1OCC(N)=O	ZINC000819124223	DD	On-Demand	Anodyne	DRTS_TRYCR	48	33
C[C@H](NC[C@H](O)c1cccnc1)c1nc(C(C)(C)C)no1	ZINC000819124231	CE	On-Demand	Anodyne	ADRB2	16	40
C[C@H](NC[C@H](O)c1cccnc1)c1nc(C(C)(C)C)no1	ZINC000819124231	CE	On-Demand	Anodyne	ADRB1	18	47
C[C@H](NC[C@H](O)c1cccnc1)c1nc(C(C)(C)C)no1	ZINC000819124231	CE	On-Demand	Anodyne	ADRB3	65	47
C[C@@H](NC[C@@H](O)c1cccnc1)c1nc(C(C)(C)C)no1	ZINC000819124233	CE	On-Demand	Anodyne	ADRB2	16	40
C[C@@H](NC[C@@H](O)c1cccnc1)c1nc(C(C)(C)C)no1	ZINC000819124233	CE	On-Demand	Anodyne	ADRB1	18	47
C[C@@H](NC[C@@H](O)c1cccnc1)c1nc(C(C)(C)C)no1	ZINC000819124233	CE	On-Demand	Anodyne	ADRB3	65	47
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1nc(C(C)(C)C)no1	ZINC000819124242	GG	On-Demand	Anodyne	GPR119	26	40
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1nc(C(C)(C)C)no1	ZINC000819124243	GG	On-Demand	Anodyne	GPR119	26	40
O[C@H](CNCCC(F)(F)F)c1cccnc1	ZINC000819124252	BD	On-Demand	Anodyne	ADRB2	31	50
O[C@H](CNCCC(F)(F)F)c1cccnc1	ZINC000819124252	BD	On-Demand	Anodyne	ADRB1	35	51
O[C@H](CNCCC(F)(F)F)c1cccnc1	ZINC000819124252	BD	On-Demand	Anodyne	ADRB3	116	51
O[C@@H](CNCCC(F)(F)F)c1cccnc1	ZINC000819124253	BD	On-Demand	Anodyne	ADRB2	31	50
O[C@@H](CNCCC(F)(F)F)c1cccnc1	ZINC000819124253	BD	On-Demand	Anodyne	ADRB1	35	51
O[C@@H](CNCCC(F)(F)F)c1cccnc1	ZINC000819124253	BD	On-Demand	Anodyne	ADRB3	116	51
O[C@@H](CNCCC(F)(F)F)c1ccc(OC(F)(F)F)cc1	ZINC000819124256	DG	On-Demand	Anodyne	ADRB3	26	46
O[C@H](CNCCC(F)(F)F)c1ccc(OC(F)(F)F)cc1	ZINC000819124257	DG	On-Demand	Anodyne	ADRB3	26	46
COc1ccccc1-c1noc([C@@H](C)NC[C@H](O)c2cccnc2)n1	ZINC000819124271	EF	On-Demand	Anodyne	ADRB1	17	42
COc1ccccc1-c1noc([C@@H](C)NC[C@H](O)c2cccnc2)n1	ZINC000819124271	EF	On-Demand	Anodyne	ADRB3	58	42
COc1ccccc1-c1noc([C@@H](C)NC[C@H](O)c2cccnc2)n1	ZINC000819124271	EF	On-Demand	Anodyne	LUCI_PHOPE	30	42
COc1ccccc1-c1noc([C@@H](C)NC[C@@H](O)c2cccnc2)n1	ZINC000819124272	EF	On-Demand	Anodyne	ADRB1	17	42
COc1ccccc1-c1noc([C@@H](C)NC[C@@H](O)c2cccnc2)n1	ZINC000819124272	EF	On-Demand	Anodyne	ADRB3	58	42
COc1ccccc1-c1noc([C@@H](C)NC[C@@H](O)c2cccnc2)n1	ZINC000819124272	EF	On-Demand	Anodyne	LUCI_PHOPE	30	42
COc1ccccc1-c1noc([C@H](C)NC[C@@H](O)c2cccnc2)n1	ZINC000819124273	EF	On-Demand	Anodyne	ADRB1	17	42
COc1ccccc1-c1noc([C@H](C)NC[C@@H](O)c2cccnc2)n1	ZINC000819124273	EF	On-Demand	Anodyne	ADRB3	58	42
COc1ccccc1-c1noc([C@H](C)NC[C@@H](O)c2cccnc2)n1	ZINC000819124273	EF	On-Demand	Anodyne	LUCI_PHOPE	30	42
COc1ccccc1-c1noc([C@H](C)NC[C@H](O)c2cccnc2)n1	ZINC000819124274	EF	On-Demand	Anodyne	ADRB1	17	42
COc1ccccc1-c1noc([C@H](C)NC[C@H](O)c2cccnc2)n1	ZINC000819124274	EF	On-Demand	Anodyne	ADRB3	58	42
COc1ccccc1-c1noc([C@H](C)NC[C@H](O)c2cccnc2)n1	ZINC000819124274	EF	On-Demand	Anodyne	LUCI_PHOPE	30	42
O=C(Nc1ccc(F)cc1)NC1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819124275	FF	On-Demand	Anodyne	EPHX2	57	46
O=C(Nc1ccc(F)cc1)NC1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819124276	FF	On-Demand	Anodyne	EPHX2	57	46
O=C(Nc1ccc(F)cc1)NC1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819124277	FF	On-Demand	Anodyne	EPHX2	57	46
O=C(Nc1ccc(F)cc1)NC1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819124278	FF	On-Demand	Anodyne	EPHX2	57	46
Cc1cc(N2CCC[C@@H](NC[C@H](O)c3cccnc3)C2=O)n(C)n1	ZINC000819124291	EC	On-Demand	Anodyne	ADRB3	53	40
Cc1cc(N2CCC[C@H](NC[C@H](O)c3cccnc3)C2=O)n(C)n1	ZINC000819124292	EC	On-Demand	Anodyne	ADRB3	53	40
Cc1cc(N2CCC[C@@H](NC[C@@H](O)c3cccnc3)C2=O)n(C)n1	ZINC000819124293	EC	On-Demand	Anodyne	ADRB3	53	40
Cc1cc(N2CCC[C@H](NC[C@@H](O)c3cccnc3)C2=O)n(C)n1	ZINC000819124294	EC	On-Demand	Anodyne	ADRB3	53	40
CCSCC[C@H](C)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819124297	DH	On-Demand	Anodyne	ADRB3	17	40
CCSCC[C@H](C)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819124298	DH	On-Demand	Anodyne	ADRB3	17	40
CCSCC[C@@H](C)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819124299	DH	On-Demand	Anodyne	ADRB3	17	40
CCSCC[C@@H](C)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819124300	DH	On-Demand	Anodyne	ADRB3	17	40
O=C(NC1CCC2(CC1)OCCO2)c1coc(=O)c2ccccc12	ZINC000819124315	EE	On-Demand	Anodyne	INHA	53	34
C[C@@H](Cn1cncn1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819124322	FD	On-Demand	Mild	PAPA1_CARPA	37	44
C[C@@H](Cn1cncn1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819124322	FD	On-Demand	Mild	HIS3	60	34
C[C@@H](Cn1cncn1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819124323	FD	On-Demand	Mild	PAPA1_CARPA	37	44
C[C@@H](Cn1cncn1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819124323	FD	On-Demand	Mild	HIS3	60	34
C=C(Cl)CSc1nc(C)c(CC(=O)N[C@@H](C)Cn2cncn2)s1	ZINC000819124363	FF	On-Demand	Mild	HIS3	78	36
C=C(Cl)CSc1nc(C)c(CC(=O)N[C@H](C)Cn2cncn2)s1	ZINC000819124364	FF	On-Demand	Mild	HIS3	78	36
C=C(Cl)CSc1nc(C)c(CC(=O)NCc2ccccc2[N+](=O)[O-])s1	ZINC000819124371	GI	On-Demand	Mild	COLA	77	32
COc1cc(CNC(=O)C(F)=C2CCC2)ccc1OCC(F)(F)F	ZINC000819124389	EH	On-Demand	Anodyne	MT-ND1	24	42
COc1cc(CNC(=O)C(F)=C2CCC2)ccc1OCC(F)(F)F	ZINC000819124389	EH	On-Demand	Anodyne	DRTS_TRYCR	43	29
CCSCC[C@@H](C)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819124419	EH	On-Demand	Anodyne	ADRB2	15	59
CCSCC[C@H](C)NC[C@H](O)c1ccc(Br)cc1	ZINC000819124420	EH	On-Demand	Anodyne	ADRB2	15	59
CCSCC[C@@H](C)NC[C@H](O)c1ccc(Br)cc1	ZINC000819124421	EH	On-Demand	Anodyne	ADRB2	15	59
CCSCC[C@H](C)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819124422	EH	On-Demand	Anodyne	ADRB2	15	59
C[C@@H](CC(=O)NCCCN1CCN(C(=O)OC(C)(C)C)CC1)n1cccn1	ZINC000819124458	GD	On-Demand	Anodyne	DRD2	17	42
C[C@H](CC(=O)NCCCN1CCN(C(=O)OC(C)(C)C)CC1)n1cccn1	ZINC000819124459	GD	On-Demand	Anodyne	DRD2	17	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ncc(Cc3ccccc3)s1)C2	ZINC000819124460	GH	On-Demand	Anodyne	CDK5	36	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ncc(Cc3ccccc3)s1)C2	ZINC000819124460	GH	On-Demand	Anodyne	MGEA5	34	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ncc(Cc3ccccc3)s1)C2	ZINC000819124461	GH	On-Demand	Anodyne	CDK5	36	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ncc(Cc3ccccc3)s1)C2	ZINC000819124461	GH	On-Demand	Anodyne	MGEA5	34	42
CN(C)c1c(Cl)cccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819124464	GH	On-Demand	Mild	PAPA1_CARPA	45	44
CN(C)c1c(Cl)cccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819124465	GH	On-Demand	Mild	PAPA1_CARPA	45	44
O=[N+]([O-])c1cccc([C@H](O)CNCCc2nc(C(F)(F)F)cs2)c1	ZINC000819124466	FF	On-Demand	Bother	ADRB3	79	39
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2nc(C(F)(F)F)cs2)c1	ZINC000819124467	FF	On-Demand	Bother	ADRB3	79	39
O=C(CCc1cccc(OC(F)F)c1)NC1CCC2(CC1)OCCO2	ZINC000819124491	FG	On-Demand	Anodyne	C5AR1	21	40
O=C(CCc1cccc(OC(F)F)c1)NC1CCC2(CC1)OCCO2	ZINC000819124491	FG	On-Demand	Anodyne	LUXR	42	42
C[C@@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccc(F)cc1F	ZINC000819124503	FF	On-Demand	Anodyne	PTGS2	31	40
C[C@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccc(F)cc1F	ZINC000819124504	FF	On-Demand	Anodyne	PTGS2	31	40
C[C@@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccc(F)cc1F	ZINC000819124505	FF	On-Demand	Anodyne	PTGS2	31	40
C[C@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccc(F)cc1F	ZINC000819124506	FF	On-Demand	Anodyne	PTGS2	31	40
COC(=O)c1ccc(CCNC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)cc1	ZINC000819124512	FE	On-Demand	Bother	CACNA1D	46	36
Cc1cc(N2CCC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819124525	FE	On-Demand	Anodyne	ADRB1	24	40
Cc1cc(N2CCC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819124525	FE	On-Demand	Anodyne	ADRB3	40	40
Cc1cc(N2CCC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819124525	FE	On-Demand	Anodyne	IGF1R	30	40
Cc1cc(N2CCC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819124525	FE	On-Demand	Anodyne	CYP3A4	50	38
Cc1cc(N2CCC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819124526	FE	On-Demand	Anodyne	ADRB1	24	40
Cc1cc(N2CCC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819124526	FE	On-Demand	Anodyne	ADRB3	40	40
Cc1cc(N2CCC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819124526	FE	On-Demand	Anodyne	IGF1R	30	40
Cc1cc(N2CCC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819124526	FE	On-Demand	Anodyne	CYP3A4	50	38
Cc1cc(N2CCC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819124527	FE	On-Demand	Anodyne	ADRB1	24	40
Cc1cc(N2CCC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819124527	FE	On-Demand	Anodyne	ADRB3	40	40
Cc1cc(N2CCC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819124527	FE	On-Demand	Anodyne	IGF1R	30	40
Cc1cc(N2CCC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819124527	FE	On-Demand	Anodyne	CYP3A4	50	38
Cc1cc(N2CCC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819124528	FE	On-Demand	Anodyne	ADRB1	24	40
Cc1cc(N2CCC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819124528	FE	On-Demand	Anodyne	ADRB3	40	40
Cc1cc(N2CCC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819124528	FE	On-Demand	Anodyne	IGF1R	30	40
Cc1cc(N2CCC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)n(C)n1	ZINC000819124528	FE	On-Demand	Anodyne	CYP3A4	50	38
O[C@H](CNCCc1nc(C(F)(F)F)cs1)c1ccc(F)cc1	ZINC000819124538	EG	On-Demand	Anodyne	ADRB3	36	44
O[C@@H](CNCCc1nc(C(F)(F)F)cs1)c1ccc(F)cc1	ZINC000819124539	EG	On-Demand	Anodyne	ADRB3	36	44
O=C(Cc1nsc2ccccc12)NC1CCC2(CC1)OCCO2	ZINC000819124551	EF	On-Demand	Anodyne	C5AR1	36	44
O=C(/C=C/[C@H]1CCCO1)NCc1ccccc1[N+](=O)[O-]	ZINC000819124569	CD	On-Demand	Bother	COLA	85	32
O=C(/C=C/[C@@H]1CCCO1)NCc1ccccc1[N+](=O)[O-]	ZINC000819124570	CD	On-Demand	Bother	COLA	85	32
O=C(/C=C\[C@@H]1CCCO1)NCc1ccccc1[N+](=O)[O-]	ZINC000819124571	CD	On-Demand	Bother	COLA	85	32
O=C(/C=C\[C@H]1CCCO1)NCc1ccccc1[N+](=O)[O-]	ZINC000819124572	CD	On-Demand	Bother	COLA	85	32
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)c1ccc(F)cc1F	ZINC000819124579	DH	On-Demand	Anodyne	ADRB1	20	41
C[C@H](CNC[C@H](O)c1cccc(F)c1)c1ccc(F)cc1F	ZINC000819124580	DH	On-Demand	Anodyne	ADRB1	20	41
C[C@@H](CNC[C@H](O)c1cccc(F)c1)c1ccc(F)cc1F	ZINC000819124581	DH	On-Demand	Anodyne	ADRB1	20	41
C[C@H](CNC[C@@H](O)c1cccc(F)c1)c1ccc(F)cc1F	ZINC000819124582	DH	On-Demand	Anodyne	ADRB1	20	41
CCSCC[C@H](C)NC[C@@H](O)c1ccc(C)cc1	ZINC000819124609	CG	On-Demand	Anodyne	ADRB2	16	58
CCSCC[C@@H](C)NC[C@H](O)c1ccc(C)cc1	ZINC000819124610	CG	On-Demand	Anodyne	ADRB2	16	58
CCSCC[C@@H](C)NC[C@@H](O)c1ccc(C)cc1	ZINC000819124611	CG	On-Demand	Anodyne	ADRB2	16	58
CCSCC[C@H](C)NC[C@H](O)c1ccc(C)cc1	ZINC000819124612	CG	On-Demand	Anodyne	ADRB2	16	58
NC(=O)c1cn(CC(=O)OCc2ccc(C(=O)O)cc2)c2ccccc12	ZINC000819124636	FE	On-Demand	Anodyne	FABI	46	34
NC(=O)c1ncn2c(C(=O)OCC(=O)O)cc(-c3ccco3)nc12	ZINC000819124637	EC	On-Demand	Anodyne	ADORA2A	52	39
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819124640	FF	On-Demand	Anodyne	CA2	17	48
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819124640	FF	On-Demand	Anodyne	ADRB1	41	35
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819124640	FF	On-Demand	Anodyne	FOLH1	17	40
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819124640	FF	On-Demand	Anodyne	LTA4H	36	51
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819124640	FF	On-Demand	Anodyne	CA1	53	48
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819124640	FF	On-Demand	Anodyne	CA12	25	48
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819124640	FF	On-Demand	Anodyne	CA9	27	48
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCCCC(=O)O)cc1	ZINC000819124640	FF	On-Demand	Anodyne	NCE103	24	48
NC(=O)c1cnc(NCc2ccc(C(=O)O)cc2)c(Cl)c1	ZINC000819124641	DE	On-Demand	Anodyne	STAT6	54	42
NC(=O)c1cn(CC(=O)NC2(C(=O)O)CCCCC2)c2ccccc12	ZINC000819124642	ED	On-Demand	Anodyne	CNR1	16	42
NC(=O)c1cn(CC(=O)NC2(C(=O)O)CCCCC2)c2ccccc12	ZINC000819124642	ED	On-Demand	Anodyne	CNR2	23	41
NC(=O)c1cccc(CS(=O)(=O)Cc2ccc(C(=O)O)cc2)c1	ZINC000819124646	ED	On-Demand	Anodyne	TRY2_BOVIN	56	32
NC(=O)c1cccc(CS(=O)(=O)Cc2ccc(C(=O)O)cc2)c1	ZINC000819124646	ED	On-Demand	Anodyne	TMPRSS11D	70	34
NS(=O)(=O)N1CCC(C(=O)NCCCC(=O)O)CC1	ZINC000819124647	CA	On-Demand	Anodyne	EPHX2	24	40
NC(=S)c1ccc(C(=O)NCCCCCC(=O)O)cc1	ZINC000819124648	CD	On-Demand	Anodyne	FOLH1	37	47
NC(=S)c1ccc(C(=O)NCCCCCC(=O)O)cc1	ZINC000819124648	CD	On-Demand	Anodyne	HDAC8	15	42
NC(=S)c1ccc(C(=O)NCCCCCC(=O)O)cc1	ZINC000819124648	CD	On-Demand	Anodyne	HDAC6	18	47
NC(=S)c1ccc(C(=O)NCCCCCC(=O)O)cc1	ZINC000819124648	CD	On-Demand	Anodyne	HDAC9	24	42
NC(=O)c1cn(CC(=O)NCCCC(=O)O)c2ccccc12	ZINC000819124649	DC	On-Demand	Anodyne	CNR2	20	40
NC(=O)c1cccc(OCCC(=O)OCC(=O)O)c1	ZINC000819124652	CC	On-Demand	Anodyne	KCNH2	40	38
NC(=O)c1cccc(OCCC(=O)OCC(=O)O)c1	ZINC000819124652	CC	On-Demand	Anodyne	PLA2G4B	38	42
NC(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819124653	CC	On-Demand	Anodyne	SLC6A1	65	34
NC(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819124653	CC	On-Demand	Anodyne	F10	20	43
NC(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819124653	CC	On-Demand	Anodyne	GRIN2B	22	41
NC(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819124653	CC	On-Demand	Anodyne	TRY2_BOVIN	59	35
NC(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819124653	CC	On-Demand	Anodyne	PREP	18	40
NC(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819124653	CC	On-Demand	Anodyne	EPHX2	21	46
NC(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819124653	CC	On-Demand	Anodyne	TPSAB1	34	40
NC(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819124653	CC	On-Demand	Anodyne	ST14	92	37
NC(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819124653	CC	On-Demand	Anodyne	TMPRSS11D	54	32
NC(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819124654	CC	On-Demand	Anodyne	SLC6A1	65	34
NC(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819124654	CC	On-Demand	Anodyne	F10	20	43
NC(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819124654	CC	On-Demand	Anodyne	GRIN2B	22	41
NC(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819124654	CC	On-Demand	Anodyne	TRY2_BOVIN	59	35
NC(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819124654	CC	On-Demand	Anodyne	PREP	18	40
NC(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819124654	CC	On-Demand	Anodyne	EPHX2	21	46
NC(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819124654	CC	On-Demand	Anodyne	TPSAB1	34	40
NC(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819124654	CC	On-Demand	Anodyne	ST14	92	37
NC(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819124654	CC	On-Demand	Anodyne	TMPRSS11D	54	32
NS(=O)(=O)c1cc(C(=O)N2CC[C@@H](C(=O)O)C2)ccc1F	ZINC000819124656	DC	On-Demand	Anodyne	L3MBTL3	73	38
NS(=O)(=O)c1cc(C(=O)N2CC[C@H](C(=O)O)C2)ccc1F	ZINC000819124657	DC	On-Demand	Anodyne	L3MBTL3	73	38
NS(=O)(=O)[C@@H]1CCN(C(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819124662	EC	On-Demand	Anodyne	CCR3	27	41
NS(=O)(=O)[C@@H]1CCN(C(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819124662	EC	On-Demand	Anodyne	ST14	46	34
NS(=O)(=O)[C@@H]1CCN(C(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819124662	EC	On-Demand	Anodyne	P2RY14	45	36
NS(=O)(=O)[C@H]1CCN(C(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819124663	EC	On-Demand	Anodyne	CCR3	27	41
NS(=O)(=O)[C@H]1CCN(C(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819124663	EC	On-Demand	Anodyne	ST14	46	34
NS(=O)(=O)[C@H]1CCN(C(=O)Nc2cccc(CC(=O)O)c2)C1	ZINC000819124663	EC	On-Demand	Anodyne	P2RY14	45	36
NC(=O)c1ccsc1NC(=O)CCN1CC[C@@H](C(=O)O)C1	ZINC000819124665	DC	On-Demand	Anodyne	SLC6A1	150	40
NC(=O)c1ccsc1NC(=O)CCN1CC[C@H](C(=O)O)C1	ZINC000819124666	DC	On-Demand	Anodyne	SLC6A1	150	40
N=C(CC(=O)Nc1ccccc1Cl)NOCc1ccc(C(=O)O)cc1	ZINC000819124667	FG	On-Demand	Anodyne	HCAR2	15	43
NC(=O)c1cnc(N2CC[C@H](C(=O)O)C2)c(Cl)c1	ZINC000819124668	CC	On-Demand	Anodyne	MPL	35	44
NC(=O)c1cnc(N2CC[C@H](C(=O)O)C2)c(Cl)c1	ZINC000819124668	CC	On-Demand	Anodyne	CXCR3	29	51
NC(=O)c1cnc(N2CC[C@@H](C(=O)O)C2)c(Cl)c1	ZINC000819124669	CC	On-Demand	Anodyne	MPL	35	44
NC(=O)c1cnc(N2CC[C@@H](C(=O)O)C2)c(Cl)c1	ZINC000819124669	CC	On-Demand	Anodyne	CXCR3	29	51
NS(=O)(=O)c1cc(C(=O)OCc2ccc(C(=O)O)cc2)ccc1Cl	ZINC000819124670	FE	On-Demand	Anodyne	CA2	46	52
NS(=O)(=O)c1cc(C(=O)OCc2ccc(C(=O)O)cc2)ccc1Cl	ZINC000819124670	FE	On-Demand	Anodyne	CA6	30	46
NS(=O)(=O)c1cc(C(=O)OCc2ccc(C(=O)O)cc2)ccc1Cl	ZINC000819124670	FE	On-Demand	Anodyne	CA1	39	52
NS(=O)(=O)c1cc(C(=O)OCc2ccc(C(=O)O)cc2)ccc1Cl	ZINC000819124670	FE	On-Demand	Anodyne	CA7	32	49
NS(=O)(=O)c1cc(C(=O)OCc2ccc(C(=O)O)cc2)ccc1Cl	ZINC000819124670	FE	On-Demand	Anodyne	CA13	48	49
NS(=O)(=O)c1cc(C(=O)OCc2ccc(C(=O)O)cc2)ccc1Cl	ZINC000819124670	FE	On-Demand	Anodyne	CA4	43	52
NS(=O)(=O)c1cc(C(=O)OCc2ccc(C(=O)O)cc2)ccc1Cl	ZINC000819124670	FE	On-Demand	Anodyne	CA12	19	46
NS(=O)(=O)c1cc(C(=O)OCc2ccc(C(=O)O)cc2)ccc1Cl	ZINC000819124670	FE	On-Demand	Anodyne	CA9	15	43
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)s1	ZINC000819124671	ED	On-Demand	Anodyne	CA2	20	44
NC(=O)c1cccnc1N1CCN(C(=O)NCCC(=O)O)CC1	ZINC000819124672	DB	On-Demand	Anodyne	SIRT3	48	33
NC(=O)c1cccnc1N1CCN(C(=O)NCCC(=O)O)CC1	ZINC000819124672	DB	On-Demand	Anodyne	SIRT2	46	31
NC(=O)c1cccnc1N1CCN(C(=O)NCCC(=O)O)CC1	ZINC000819124672	DB	On-Demand	Anodyne	SIRT1	40	31
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	CA2	50	76
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	ACE	57	45
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	F10	19	48
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	MME	133	45
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	ANPEP	74	41
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	CTRA_BOVIN	28	43
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	FCER2	73	35
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	CA1	34	76
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	CTSB	36	42
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	PAPA1_CARPA	43	41
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	CYSP_TRYCR	41	41
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	CTSL	38	44
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	CPA1	49	50
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	CTRB1	28	40
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	NAALAD2	26	42
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	CA4	44	76
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	FPGS	44	32
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	ECE1	56	39
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	CTSS	18	41
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	CAPN1	54	46
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	MMP9	15	45
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	ACE2	82	42
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	PIN1	61	45
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	MMP1	17	45
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	FPR1	75	40
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	CTRB_BOVIN	58	36
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	BLA1_STEMA	84	44
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	KISS1R	54	34
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	ERAP2	51	37
NS(=O)(=O)c1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124675	FC	On-Demand	Anodyne	NPFFR1	42	38
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	CA2	50	76
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	ACE	57	45
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	F10	19	48
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	MME	133	45
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	ANPEP	74	41
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	CTRA_BOVIN	28	43
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	FCER2	73	35
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	CA1	34	76
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	CTSB	36	42
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	PAPA1_CARPA	43	41
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	CYSP_TRYCR	41	41
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	CTSL	38	44
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	CPA1	49	50
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	CTRB1	28	40
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	NAALAD2	26	42
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	CA4	44	76
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	FPGS	44	32
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	ECE1	56	39
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	CTSS	18	41
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	CAPN1	54	46
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	MMP9	15	45
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	ACE2	82	42
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	PIN1	61	45
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	MMP1	17	45
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	FPR1	75	40
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	CTRB_BOVIN	58	36
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	BLA1_STEMA	84	44
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	KISS1R	54	34
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	ERAP2	51	37
NS(=O)(=O)c1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)ccc1F	ZINC000819124676	FC	On-Demand	Anodyne	NPFFR1	42	38
NC(=O)c1cn(CC(=O)N2CC[C@H](C(=O)O)C2)c2ccccc12	ZINC000819124679	DC	On-Demand	Anodyne	CNR1	21	44
NC(=O)c1cn(CC(=O)N2CC[C@H](C(=O)O)C2)c2ccccc12	ZINC000819124679	DC	On-Demand	Anodyne	SLC6A1	73	33
NC(=O)c1cn(CC(=O)N2CC[C@H](C(=O)O)C2)c2ccccc12	ZINC000819124679	DC	On-Demand	Anodyne	CNR2	23	40
NC(=O)c1cn(CC(=O)N2CC[C@H](C(=O)O)C2)c2ccccc12	ZINC000819124679	DC	On-Demand	Anodyne	TPSAB1	21	41
NC(=O)c1cn(CC(=O)N2CC[C@@H](C(=O)O)C2)c2ccccc12	ZINC000819124680	DC	On-Demand	Anodyne	CNR1	21	44
NC(=O)c1cn(CC(=O)N2CC[C@@H](C(=O)O)C2)c2ccccc12	ZINC000819124680	DC	On-Demand	Anodyne	SLC6A1	73	33
NC(=O)c1cn(CC(=O)N2CC[C@@H](C(=O)O)C2)c2ccccc12	ZINC000819124680	DC	On-Demand	Anodyne	CNR2	23	40
NC(=O)c1cn(CC(=O)N2CC[C@@H](C(=O)O)C2)c2ccccc12	ZINC000819124680	DC	On-Demand	Anodyne	TPSAB1	21	41
NS(=O)(=O)Cc1cccc(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819124683	ED	On-Demand	Anodyne	FOLH1	17	45
NS(=O)(=O)c1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819124684	CB	On-Demand	Anodyne	CA2	54	57
NS(=O)(=O)c1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819124684	CB	On-Demand	Anodyne	CA1	35	50
NS(=O)(=O)c1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819124684	CB	On-Demand	Anodyne	CA7	34	50
NS(=O)(=O)c1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819124684	CB	On-Demand	Anodyne	SLC18A3	16	40
NS(=O)(=O)c1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819124684	CB	On-Demand	Anodyne	CA4	34	50
NS(=O)(=O)c1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819124684	CB	On-Demand	Anodyne	CA14	25	50
NS(=O)(=O)c1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819124684	CB	On-Demand	Anodyne	CA12	28	50
NS(=O)(=O)c1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819124684	CB	On-Demand	Anodyne	CA9	29	50
NS(=O)(=O)c1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819124684	CB	On-Demand	Anodyne	NCE103	16	50
NS(=O)(=O)c1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819124684	CB	On-Demand	Anodyne	L3MBTL3	92	46
NS(=O)(=O)c1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819124685	CB	On-Demand	Anodyne	CA2	54	57
NS(=O)(=O)c1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819124685	CB	On-Demand	Anodyne	CA1	35	50
NS(=O)(=O)c1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819124685	CB	On-Demand	Anodyne	CA7	34	50
NS(=O)(=O)c1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819124685	CB	On-Demand	Anodyne	SLC18A3	16	40
NS(=O)(=O)c1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819124685	CB	On-Demand	Anodyne	CA4	34	50
NS(=O)(=O)c1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819124685	CB	On-Demand	Anodyne	CA14	25	50
NS(=O)(=O)c1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819124685	CB	On-Demand	Anodyne	CA12	28	50
NS(=O)(=O)c1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819124685	CB	On-Demand	Anodyne	CA9	29	50
NS(=O)(=O)c1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819124685	CB	On-Demand	Anodyne	NCE103	16	50
NS(=O)(=O)c1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819124685	CB	On-Demand	Anodyne	L3MBTL3	92	46
NS(=O)(=O)[C@H]1CCN(C(=O)Nc2ccccc2CC(=O)O)C1	ZINC000819124686	EC	On-Demand	Anodyne	RBP4	50	38
NS(=O)(=O)[C@H]1CCN(C(=O)Nc2ccccc2CC(=O)O)C1	ZINC000819124686	EC	On-Demand	Anodyne	CCR8	60	38
NS(=O)(=O)[C@@H]1CCN(C(=O)Nc2ccccc2CC(=O)O)C1	ZINC000819124687	EC	On-Demand	Anodyne	RBP4	50	38
NS(=O)(=O)[C@@H]1CCN(C(=O)Nc2ccccc2CC(=O)O)C1	ZINC000819124687	EC	On-Demand	Anodyne	CCR8	60	38
NC(=O)c1ccccc1Oc1ccc(NC(=O)NC2(C(=O)O)CCCC2)cc1	ZINC000819124688	GG	On-Demand	Anodyne	CA1	44	45
NC(=O)c1ccccc1Oc1ccc(NC(=O)NC2(C(=O)O)CCCC2)cc1	ZINC000819124688	GG	On-Demand	Anodyne	EPHX2	15	45
NC(=O)c1ccccc1Oc1ccc(NC(=O)NC2(C(=O)O)CCCC2)cc1	ZINC000819124688	GG	On-Demand	Anodyne	CA12	21	45
NC(=O)c1ccccc1Oc1ccc(NC(=O)NC2(C(=O)O)CCCC2)cc1	ZINC000819124688	GG	On-Demand	Anodyne	CA9	22	45
NC(=O)c1ccccc1Oc1ccc(NC(=O)NC2(C(=O)O)CCCC2)cc1	ZINC000819124688	GG	On-Demand	Anodyne	NCE103	15	40
NS(=O)(=O)c1cc(F)cc(NC(=O)NC2(C(=O)O)CCCC2)c1	ZINC000819124691	EC	On-Demand	Anodyne	CA2	17	42
NS(=O)(=O)c1cc(F)cc(NC(=O)NC2(C(=O)O)CCCC2)c1	ZINC000819124691	EC	On-Demand	Anodyne	CA4	18	41
NS(=O)(=O)c1cc(F)cc(NC(=O)NC2(C(=O)O)CCCC2)c1	ZINC000819124691	EC	On-Demand	Anodyne	CA12	17	42
NS(=O)(=O)c1cc(F)cc(NC(=O)NC2(C(=O)O)CCCC2)c1	ZINC000819124691	EC	On-Demand	Anodyne	CA9	17	42
NS(=O)(=O)c1cc(F)cc(NC(=O)NC2(C(=O)O)CCCC2)c1	ZINC000819124691	EC	On-Demand	Anodyne	MTCA1	41	41
NS(=O)(=O)c1cc(F)cc(NC(=O)NC2(C(=O)O)CCCC2)c1	ZINC000819124691	EC	On-Demand	Anodyne	P96878_MYCTU	50	41
NC(=O)c1nccnc1C(=O)N1CCC(C(=O)O)CC1	ZINC000819124692	CB	On-Demand	Anodyne	L3MBTL3	50	34
NC(=S)c1ccc(C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819124693	DD	On-Demand	Anodyne	L3MBTL3	67	41
NC(=S)c1ccc(C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819124694	DD	On-Demand	Anodyne	L3MBTL3	67	41
NC(=O)c1ccccc1Oc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819124695	FF	On-Demand	Anodyne	SLC6A1	54	33
NC(=O)c1ccccc1Oc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819124695	FF	On-Demand	Anodyne	PDGFRB	30	42
NC(=O)c1ccccc1Oc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819124695	FF	On-Demand	Anodyne	EPHX2	30	40
NC(=O)c1ccccc1Oc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819124696	FF	On-Demand	Anodyne	SLC6A1	54	33
NC(=O)c1ccccc1Oc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819124696	FF	On-Demand	Anodyne	PDGFRB	30	42
NC(=O)c1ccccc1Oc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819124696	FF	On-Demand	Anodyne	EPHX2	30	40
NS(=O)(=O)c1cc(C(=O)OCc2ccc(C(=O)O)cc2)cs1	ZINC000819124697	ED	On-Demand	Anodyne	CA2	22	53
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819124698	EE	On-Demand	Anodyne	CA2	17	47
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819124698	EE	On-Demand	Anodyne	ADRB1	43	36
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819124698	EE	On-Demand	Anodyne	LTA4H	37	49
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819124698	EE	On-Demand	Anodyne	CA1	54	47
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819124698	EE	On-Demand	Anodyne	CA12	25	47
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819124698	EE	On-Demand	Anodyne	PDGFRA	41	37
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819124698	EE	On-Demand	Anodyne	CA9	27	47
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819124698	EE	On-Demand	Anodyne	F13A1	22	40
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCCC(=O)O)cc1	ZINC000819124698	EE	On-Demand	Anodyne	NCE103	21	47
NS(=O)(=O)N1CCC(C(=O)OCc2ccc(C(=O)O)cc2)CC1	ZINC000819124699	EC	On-Demand	Anodyne	FKBP1A	36	41
N=C(CC(=O)N1CCCCC1)NOCc1ccc(C(=O)O)cc1	ZINC000819124700	DD	On-Demand	Anodyne	DPP7	46	37
NS(=O)(=O)CCNC(=O)C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819124701	EA	On-Demand	Anodyne	CA5A	43	37
NC(=O)c1ccccc1Oc1ncccc1C(=O)OCC(=O)O	ZINC000819124702	DD	On-Demand	Anodyne	PLA2G1B	44	32
NS(=O)(=O)c1cc(C(=O)N2CC[C@@H](C(=O)O)C2)ccc1Br	ZINC000819124706	GC	On-Demand	Anodyne	L3MBTL3	74	42
NS(=O)(=O)c1cc(C(=O)N2CC[C@H](C(=O)O)C2)ccc1Br	ZINC000819124707	GC	On-Demand	Anodyne	L3MBTL3	74	42
NS(=O)(=O)c1c(NCc2ccc(C(=O)O)cc2)cccc1[N+](=O)[O-]	ZINC000819124714	FD	On-Demand	Bother	CA2	37	44
NS(=O)(=O)c1c(NCc2ccc(C(=O)O)cc2)cccc1[N+](=O)[O-]	ZINC000819124714	FD	On-Demand	Bother	CA1	30	42
NS(=O)(=O)c1c(NCc2ccc(C(=O)O)cc2)cccc1[N+](=O)[O-]	ZINC000819124714	FD	On-Demand	Bother	CA7	20	40
NS(=O)(=O)c1c(NCc2ccc(C(=O)O)cc2)cccc1[N+](=O)[O-]	ZINC000819124714	FD	On-Demand	Bother	DRTS_TOXGO	15	45
NS(=O)(=O)c1c(NCc2ccc(C(=O)O)cc2)cccc1[N+](=O)[O-]	ZINC000819124714	FD	On-Demand	Bother	CA4	29	40
NS(=O)(=O)c1c(NCc2ccc(C(=O)O)cc2)cccc1[N+](=O)[O-]	ZINC000819124714	FD	On-Demand	Bother	CA12	15	40
NS(=O)(=O)c1c(NCc2ccc(C(=O)O)cc2)cccc1[N+](=O)[O-]	ZINC000819124714	FD	On-Demand	Bother	CYNT	21	40
NC(=O)c1cn(CC(=O)N2CCC[C@H](CC(=O)O)C2)c2ccccc12	ZINC000819124715	ED	On-Demand	Anodyne	CNR1	17	44
NC(=O)c1cn(CC(=O)N2CCC[C@@H](CC(=O)O)C2)c2ccccc12	ZINC000819124716	ED	On-Demand	Anodyne	CNR1	17	44
NC(=O)c1ccccc1OCCC(=O)OCC(=O)O	ZINC000819124720	CC	On-Demand	Anodyne	PLA2G1B	59	33
NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](CC(=O)O)C2)ccc1Cl	ZINC000819124725	FD	On-Demand	Anodyne	CA2	15	46
NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](CC(=O)O)C2)ccc1Cl	ZINC000819124725	FD	On-Demand	Anodyne	CA6	20	40
NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](CC(=O)O)C2)ccc1Cl	ZINC000819124725	FD	On-Demand	Anodyne	CA1	15	46
NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](CC(=O)O)C2)ccc1Cl	ZINC000819124725	FD	On-Demand	Anodyne	CA7	19	44
NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](CC(=O)O)C2)ccc1Cl	ZINC000819124725	FD	On-Demand	Anodyne	CA13	36	44
NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](CC(=O)O)C2)ccc1Cl	ZINC000819124725	FD	On-Demand	Anodyne	CA4	16	46
NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](CC(=O)O)C2)ccc1Cl	ZINC000819124725	FD	On-Demand	Anodyne	L3MBTL3	42	33
NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](CC(=O)O)C2)ccc1Cl	ZINC000819124726	FD	On-Demand	Anodyne	CA2	15	46
NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](CC(=O)O)C2)ccc1Cl	ZINC000819124726	FD	On-Demand	Anodyne	CA6	20	40
NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](CC(=O)O)C2)ccc1Cl	ZINC000819124726	FD	On-Demand	Anodyne	CA1	15	46
NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](CC(=O)O)C2)ccc1Cl	ZINC000819124726	FD	On-Demand	Anodyne	CA7	19	44
NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](CC(=O)O)C2)ccc1Cl	ZINC000819124726	FD	On-Demand	Anodyne	CA13	36	44
NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](CC(=O)O)C2)ccc1Cl	ZINC000819124726	FD	On-Demand	Anodyne	CA4	16	46
NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](CC(=O)O)C2)ccc1Cl	ZINC000819124726	FD	On-Demand	Anodyne	L3MBTL3	42	33
NC(=O)c1cccc(CNC(=O)NCCC(=O)O)c1	ZINC000819124730	CC	On-Demand	Anodyne	ROCK2	17	47
NS(=O)(=O)Cc1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819124731	ED	On-Demand	Anodyne	CA2	17	52
NS(=O)(=O)c1cc(NCCC(=O)O)cc([N+](=O)[O-])c1	ZINC000819124732	CC	On-Demand	Bother	CA2	68	47
NS(=O)(=O)c1cc(NCCC(=O)O)cc([N+](=O)[O-])c1	ZINC000819124732	CC	On-Demand	Bother	CA1	55	47
NS(=O)(=O)c1cc(NCCC(=O)O)cc([N+](=O)[O-])c1	ZINC000819124732	CC	On-Demand	Bother	CA5B	43	35
NS(=O)(=O)c1cc(NCCC(=O)O)cc([N+](=O)[O-])c1	ZINC000819124732	CC	On-Demand	Bother	CA4	67	44
NS(=O)(=O)c1cc(NCCC(=O)O)cc([N+](=O)[O-])c1	ZINC000819124732	CC	On-Demand	Bother	CA5A	49	35
NS(=O)(=O)c1cc(NCCC(=O)O)cc([N+](=O)[O-])c1	ZINC000819124732	CC	On-Demand	Bother	CA14	29	47
NS(=O)(=O)c1cc(NCCC(=O)O)cc([N+](=O)[O-])c1	ZINC000819124732	CC	On-Demand	Bother	CA12	37	47
NS(=O)(=O)c1cc(NCCC(=O)O)cc([N+](=O)[O-])c1	ZINC000819124732	CC	On-Demand	Bother	CA9	35	47
NS(=O)(=O)c1cc(NCCC(=O)O)cc([N+](=O)[O-])c1	ZINC000819124732	CC	On-Demand	Bother	MTCA1	30	44
NS(=O)(=O)c1cc(NCCC(=O)O)cc([N+](=O)[O-])c1	ZINC000819124732	CC	On-Demand	Bother	P96878_MYCTU	34	44
NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](CC(=O)O)C2)ccc1F	ZINC000819124733	EC	On-Demand	Anodyne	L3MBTL3	40	33
NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](CC(=O)O)C2)ccc1F	ZINC000819124734	EC	On-Demand	Anodyne	L3MBTL3	40	33
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819124735	ED	On-Demand	Anodyne	CA2	17	48
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819124735	ED	On-Demand	Anodyne	LTA4H	37	46
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819124735	ED	On-Demand	Anodyne	CA1	56	48
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819124735	ED	On-Demand	Anodyne	F7	23	47
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819124735	ED	On-Demand	Anodyne	CA12	27	48
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819124735	ED	On-Demand	Anodyne	PDGFRA	43	38
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819124735	ED	On-Demand	Anodyne	CA9	28	48
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819124735	ED	On-Demand	Anodyne	F13A1	23	42
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819124735	ED	On-Demand	Anodyne	NCE103	25	45
NC(=O)c1ccccc1Oc1ccc(NC(=O)NCC(=O)O)cc1	ZINC000819124735	ED	On-Demand	Anodyne	P96878_MYCTU	15	43
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@H](CC(=O)O)C2)cc1Cl	ZINC000819124736	FD	On-Demand	Anodyne	CA7	15	40
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@H](CC(=O)O)C2)cc1Cl	ZINC000819124736	FD	On-Demand	Anodyne	CA13	27	40
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@H](CC(=O)O)C2)cc1Cl	ZINC000819124736	FD	On-Demand	Anodyne	L3MBTL3	40	33
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1Cl	ZINC000819124737	FD	On-Demand	Anodyne	CA7	15	40
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1Cl	ZINC000819124737	FD	On-Demand	Anodyne	CA13	27	40
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1Cl	ZINC000819124737	FD	On-Demand	Anodyne	L3MBTL3	40	33
NC(=O)c1cccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819124739	EC	On-Demand	Anodyne	ST14	40	36
NC(=O)c1cccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819124740	EC	On-Demand	Anodyne	ST14	40	36
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1F	ZINC000819124741	EC	On-Demand	Anodyne	CA2	43	67
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1F	ZINC000819124741	EC	On-Demand	Anodyne	FOLH1	20	41
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1F	ZINC000819124741	EC	On-Demand	Anodyne	CA1	27	67
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1F	ZINC000819124741	EC	On-Demand	Anodyne	CA4	35	67
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819124742	EC	On-Demand	Anodyne	CA2	52	54
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819124742	EC	On-Demand	Anodyne	CA1	35	44
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819124742	EC	On-Demand	Anodyne	CA7	28	44
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819124742	EC	On-Demand	Anodyne	CA4	41	44
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819124742	EC	On-Demand	Anodyne	CA14	17	44
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819124742	EC	On-Demand	Anodyne	CA9	21	44
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819124742	EC	On-Demand	Anodyne	NCE103	15	44
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819124742	EC	On-Demand	Anodyne	L3MBTL3	61	39
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819124743	EC	On-Demand	Anodyne	CA2	52	54
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819124743	EC	On-Demand	Anodyne	CA1	35	44
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819124743	EC	On-Demand	Anodyne	CA7	28	44
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819124743	EC	On-Demand	Anodyne	CA4	41	44
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819124743	EC	On-Demand	Anodyne	CA14	17	44
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819124743	EC	On-Demand	Anodyne	CA9	21	44
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819124743	EC	On-Demand	Anodyne	NCE103	15	44
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819124743	EC	On-Demand	Anodyne	L3MBTL3	61	39
NC(=O)c1ccccc1Oc1ncccc1C(=O)OCc1ccc(C(=O)O)cc1	ZINC000819124744	GG	On-Demand	Anodyne	PPIA	40	43
NC(=O)c1ccccc1Oc1ncccc1C(=O)OCc1ccc(C(=O)O)cc1	ZINC000819124744	GG	On-Demand	Anodyne	PTGER1	17	40
NS(=O)(=O)c1cc(C(=O)N[C@H](C(=O)O)c2ccccc2)ccc1F	ZINC000819124745	FD	On-Demand	Anodyne	CA2	37	74
NS(=O)(=O)c1cc(C(=O)N[C@H](C(=O)O)c2ccccc2)ccc1F	ZINC000819124745	FD	On-Demand	Anodyne	CA1	22	74
NS(=O)(=O)c1cc(C(=O)N[C@H](C(=O)O)c2ccccc2)ccc1F	ZINC000819124745	FD	On-Demand	Anodyne	CA4	31	74
NS(=O)(=O)c1cc(C(=O)N[C@H](C(=O)O)c2ccccc2)ccc1F	ZINC000819124745	FD	On-Demand	Anodyne	MTTP	73	33
NS(=O)(=O)c1c(NCCC(=O)O)cccc1[N+](=O)[O-]	ZINC000819124747	CC	On-Demand	Bother	CA2	25	42
NS(=O)(=O)c1c(NCCC(=O)O)cccc1[N+](=O)[O-]	ZINC000819124747	CC	On-Demand	Bother	CA1	18	42
NS(=O)(=O)c1c(NCCC(=O)O)cccc1[N+](=O)[O-]	ZINC000819124747	CC	On-Demand	Bother	COLA	66	32
NS(=O)(=O)c1c(NCCC(=O)O)cccc1[N+](=O)[O-]	ZINC000819124747	CC	On-Demand	Bother	CA4	27	41
NC(=S)c1ccc(C(=O)NCCCC(=O)O)cc1	ZINC000819124748	CC	On-Demand	Anodyne	FOLH1	31	46
NC(=O)c1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819124754	ED	On-Demand	Anodyne	PPIA	15	41
NC(=O)c1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819124754	ED	On-Demand	Anodyne	ROCK2	24	50
NC(=O)c1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819124754	ED	On-Demand	Anodyne	FURIN	41	33
NC(=O)c1ccccc1Oc1ccc(NC(=O)N2CCO[C@H](C(=O)O)C2)cc1	ZINC000819124755	GD	On-Demand	Anodyne	PDGFRB	26	41
NC(=O)c1ccccc1Oc1ccc(NC(=O)N2CCO[C@@H](C(=O)O)C2)cc1	ZINC000819124756	GD	On-Demand	Anodyne	PDGFRB	26	41
NC(=O)c1cccnc1N1CCN(C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819124759	GD	On-Demand	Anodyne	PDGFRB	30	40
NC(=O)c1cccnc1N1CCN(C(=O)Nc2ccccc2CC(=O)O)CC1	ZINC000819124759	GD	On-Demand	Anodyne	TRPV1	16	47
NS(=O)(=O)Cc1cccc(C(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819124760	DC	On-Demand	Anodyne	SLC6A1	55	34
NS(=O)(=O)Cc1cccc(C(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819124760	DC	On-Demand	Anodyne	TRY2_BOVIN	64	35
NS(=O)(=O)Cc1cccc(C(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819124760	DC	On-Demand	Anodyne	ST14	80	37
NS(=O)(=O)Cc1cccc(C(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819124760	DC	On-Demand	Anodyne	L3MBTL3	59	42
NS(=O)(=O)Cc1cccc(C(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819124761	DC	On-Demand	Anodyne	SLC6A1	55	34
NS(=O)(=O)Cc1cccc(C(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819124761	DC	On-Demand	Anodyne	TRY2_BOVIN	64	35
NS(=O)(=O)Cc1cccc(C(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819124761	DC	On-Demand	Anodyne	ST14	80	37
NS(=O)(=O)Cc1cccc(C(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819124761	DC	On-Demand	Anodyne	L3MBTL3	59	42
NC(=O)c1nccnc1C(=O)Nc1cccc(CC(=O)O)c1	ZINC000819124762	DC	On-Demand	Anodyne	KCNK3	70	40
NS(=O)(=O)c1c(NCCCC(=O)O)cccc1[N+](=O)[O-]	ZINC000819124764	DC	On-Demand	Bother	CA2	19	43
NS(=O)(=O)c1c(NCCCC(=O)O)cccc1[N+](=O)[O-]	ZINC000819124764	DC	On-Demand	Bother	COLA	46	31
NS(=O)(=O)c1c(NCCCC(=O)O)cccc1[N+](=O)[O-]	ZINC000819124764	DC	On-Demand	Bother	CA4	18	43
NC(=O)c1cccnc1N1CCN(C(=O)Nc2cccc(CC(=O)O)c2)CC1	ZINC000819124767	GD	On-Demand	Anodyne	PDGFRB	48	41
NC(=O)c1cccnc1N1CCN(C(=O)Nc2cccc(CC(=O)O)c2)CC1	ZINC000819124767	GD	On-Demand	Anodyne	TRPV1	15	48
NC(=O)c1cccnc1N1CCN(C(=O)Nc2cccc(CC(=O)O)c2)CC1	ZINC000819124767	GD	On-Demand	Anodyne	FAAH	24	41
NC(=O)c1cccnc1N1CCN(C(=O)Nc2cccc(CC(=O)O)c2)CC1	ZINC000819124767	GD	On-Demand	Anodyne	P2RY14	44	35
NC(=O)c1cccnc1N1CCN(C(=O)Nc2cccc(CC(=O)O)c2)CC1	ZINC000819124767	GD	On-Demand	Anodyne	LIMK2	26	43
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)o1	ZINC000819124778	EC	On-Demand	Anodyne	CA2	24	46
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)o1	ZINC000819124778	EC	On-Demand	Anodyne	CA1	16	46
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)o1	ZINC000819124778	EC	On-Demand	Anodyne	CA4	19	46
NS(=O)(=O)c1cc(C(=O)NCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819124780	FD	On-Demand	Anodyne	CA2	63	59
NS(=O)(=O)c1cc(C(=O)NCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819124780	FD	On-Demand	Anodyne	CA6	20	40
NS(=O)(=O)c1cc(C(=O)NCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819124780	FD	On-Demand	Anodyne	CA1	46	59
NS(=O)(=O)c1cc(C(=O)NCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819124780	FD	On-Demand	Anodyne	CA7	24	43
NS(=O)(=O)c1cc(C(=O)NCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819124780	FD	On-Demand	Anodyne	TRPV1	15	42
NS(=O)(=O)c1cc(C(=O)NCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819124780	FD	On-Demand	Anodyne	CA5B	21	42
NS(=O)(=O)c1cc(C(=O)NCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819124780	FD	On-Demand	Anodyne	CA4	48	59
NS(=O)(=O)c1cc(C(=O)NCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819124780	FD	On-Demand	Anodyne	CA5A	24	42
NS(=O)(=O)c1cc(C(=O)NCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819124780	FD	On-Demand	Anodyne	CA14	18	43
NS(=O)(=O)c1cc(C(=O)NCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819124780	FD	On-Demand	Anodyne	CA12	20	44
NS(=O)(=O)c1cc(C(=O)NCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819124780	FD	On-Demand	Anodyne	CA9	27	50
NS(=O)(=O)c1cc(C(=O)NCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819124780	FD	On-Demand	Anodyne	CYNT	27	54
NS(=O)(=O)c1cc(C(=O)NCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819124780	FD	On-Demand	Anodyne	NAMPT	53	40
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1Br	ZINC000819124783	GD	On-Demand	Anodyne	CA2	40	68
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1Br	ZINC000819124783	GD	On-Demand	Anodyne	CA1	26	68
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1Br	ZINC000819124783	GD	On-Demand	Anodyne	HDAC8	15	41
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1Br	ZINC000819124783	GD	On-Demand	Anodyne	CA4	33	68
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1Br	ZINC000819124783	GD	On-Demand	Anodyne	HDAC1	15	41
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1Br	ZINC000819124783	GD	On-Demand	Anodyne	HDAC6	15	41
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1Br	ZINC000819124783	GD	On-Demand	Anodyne	HDAC9	25	41
NC(=S)c1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819124784	CC	On-Demand	Anodyne	SLC6A1	65	35
NC(=S)c1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819124784	CC	On-Demand	Anodyne	SLC18A3	22	44
NC(=S)c1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819124784	CC	On-Demand	Anodyne	L3MBTL3	94	48
NC(=S)c1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819124785	CC	On-Demand	Anodyne	SLC6A1	65	35
NC(=S)c1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819124785	CC	On-Demand	Anodyne	SLC18A3	22	44
NC(=S)c1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819124785	CC	On-Demand	Anodyne	L3MBTL3	94	48
NS(=O)(=O)Cc1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819124786	GD	On-Demand	Anodyne	CA2	22	50
NS(=O)(=O)Cc1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819124786	GD	On-Demand	Anodyne	CA7	15	40
NS(=O)(=O)Cc1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819124786	GD	On-Demand	Anodyne	CA5B	39	40
NS(=O)(=O)Cc1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819124786	GD	On-Demand	Anodyne	CA4	19	44
NS(=O)(=O)Cc1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819124786	GD	On-Demand	Anodyne	CA5A	45	40
NS(=O)(=O)Cc1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819124786	GD	On-Demand	Anodyne	CA12	18	47
NS(=O)(=O)Cc1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819124786	GD	On-Demand	Anodyne	NCE103	19	47
NS(=O)(=O)Cc1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819124786	GD	On-Demand	Anodyne	P96878_MYCTU	15	47
NS(=O)(=O)Cc1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819124786	GD	On-Demand	Anodyne	NAMPT	28	46
NS(=O)(=O)c1cc(C(=O)NCCCC(=O)O)ccc1F	ZINC000819124787	DC	On-Demand	Anodyne	CA2	49	73
NS(=O)(=O)c1cc(C(=O)NCCCC(=O)O)ccc1F	ZINC000819124787	DC	On-Demand	Anodyne	CA1	32	73
NS(=O)(=O)c1cc(C(=O)NCCCC(=O)O)ccc1F	ZINC000819124787	DC	On-Demand	Anodyne	CA4	43	73
NS(=O)(=O)c1cc(C(=O)NCCCC(=O)O)ccc1F	ZINC000819124787	DC	On-Demand	Anodyne	CA9	15	40
NC(=O)c1cn(CC(=O)N2CCC[C@@H]2C(=O)O)c2ccccc12	ZINC000819124793	DC	On-Demand	Anodyne	F2	31	40
NC(=O)c1cn(CC(=O)N2CCC[C@@H]2C(=O)O)c2ccccc12	ZINC000819124793	DC	On-Demand	Anodyne	ACE	54	42
NC(=O)c1cn(CC(=O)N2CCC[C@@H]2C(=O)O)c2ccccc12	ZINC000819124793	DC	On-Demand	Anodyne	CNR1	19	42
NC(=O)c1cn(CC(=O)N2CCC[C@@H]2C(=O)O)c2ccccc12	ZINC000819124793	DC	On-Demand	Anodyne	CNR2	22	40
NC(=O)c1cn(CC(=O)N2CCC[C@@H]2C(=O)O)c2ccccc12	ZINC000819124793	DC	On-Demand	Anodyne	PREP	81	38
NC(=O)c1cn(CC(=O)N2CCC[C@@H]2C(=O)O)c2ccccc12	ZINC000819124793	DC	On-Demand	Anodyne	TMPRSS11D	55	32
NC(=O)c1cn(CC(=O)N2CCC[C@H]2C(=O)O)c2ccccc12	ZINC000819124794	DC	On-Demand	Anodyne	F2	31	40
NC(=O)c1cn(CC(=O)N2CCC[C@H]2C(=O)O)c2ccccc12	ZINC000819124794	DC	On-Demand	Anodyne	ACE	54	42
NC(=O)c1cn(CC(=O)N2CCC[C@H]2C(=O)O)c2ccccc12	ZINC000819124794	DC	On-Demand	Anodyne	CNR1	19	42
NC(=O)c1cn(CC(=O)N2CCC[C@H]2C(=O)O)c2ccccc12	ZINC000819124794	DC	On-Demand	Anodyne	CNR2	22	40
NC(=O)c1cn(CC(=O)N2CCC[C@H]2C(=O)O)c2ccccc12	ZINC000819124794	DC	On-Demand	Anodyne	PREP	81	38
NC(=O)c1cn(CC(=O)N2CCC[C@H]2C(=O)O)c2ccccc12	ZINC000819124794	DC	On-Demand	Anodyne	TMPRSS11D	55	32
NC(=O)c1cn(CC(=O)NCc2ccc(C(=O)O)cc2)c2ccccc12	ZINC000819124797	FD	On-Demand	Anodyne	F2	18	42
NC(=O)c1cn(CC(=O)NCc2ccc(C(=O)O)cc2)c2ccccc12	ZINC000819124797	FD	On-Demand	Anodyne	CNR1	16	47
NC(=O)c1cn(CC(=O)NCc2ccc(C(=O)O)cc2)c2ccccc12	ZINC000819124797	FD	On-Demand	Anodyne	FURIN	40	32
NC(=O)c1cn(CC(=O)NCc2ccc(C(=O)O)cc2)c2ccccc12	ZINC000819124797	FD	On-Demand	Anodyne	TMPRSS11D	43	33
NC(=O)c1cccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819124798	DB	On-Demand	Anodyne	NPY2R	21	40
NC(=O)c1cccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819124798	DB	On-Demand	Anodyne	ST14	49	36
NC(=O)c1cccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819124798	DB	On-Demand	Anodyne	KCNK3	43	40
NC(=O)c1cccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819124799	DB	On-Demand	Anodyne	NPY2R	21	40
NC(=O)c1cccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819124799	DB	On-Demand	Anodyne	ST14	49	36
NC(=O)c1cccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819124799	DB	On-Demand	Anodyne	KCNK3	43	40
N=C1NC(=O)[C@@H](CC(=O)N2CCC[C@H]2C(=O)O)S1	ZINC000819124802	CB	On-Demand	Anodyne	ACE	47	46
N=C1NC(=O)[C@@H](CC(=O)N2CCC[C@@H]2C(=O)O)S1	ZINC000819124803	CB	On-Demand	Anodyne	ACE	47	46
N=C1NC(=O)[C@H](CC(=O)N2CCC[C@@H]2C(=O)O)S1	ZINC000819124804	CB	On-Demand	Anodyne	ACE	47	46
N=C1NC(=O)[C@H](CC(=O)N2CCC[C@H]2C(=O)O)S1	ZINC000819124805	CB	On-Demand	Anodyne	ACE	47	46
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1Cl	ZINC000819124806	ED	On-Demand	Anodyne	CA2	53	90
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1Cl	ZINC000819124806	ED	On-Demand	Anodyne	CA6	27	42
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1Cl	ZINC000819124806	ED	On-Demand	Anodyne	CA1	41	90
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1Cl	ZINC000819124806	ED	On-Demand	Anodyne	CA7	34	46
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1Cl	ZINC000819124806	ED	On-Demand	Anodyne	CA13	44	46
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1Cl	ZINC000819124806	ED	On-Demand	Anodyne	CA4	45	90
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1Cl	ZINC000819124806	ED	On-Demand	Anodyne	CA5A	17	41
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1Cl	ZINC000819124806	ED	On-Demand	Anodyne	CA12	16	42
NS(=O)(=O)c1cc(C(=O)NCCCCCC(=O)O)ccc1Cl	ZINC000819124806	ED	On-Demand	Anodyne	CA9	15	42
NC(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819124807	ED	On-Demand	Anodyne	F10	20	44
NC(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819124807	ED	On-Demand	Anodyne	PTGER4	15	42
NC(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819124807	ED	On-Demand	Anodyne	ROCK2	20	52
NC(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819124807	ED	On-Demand	Anodyne	FURIN	50	35
NC(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819124807	ED	On-Demand	Anodyne	PROC	56	38
NC(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819124807	ED	On-Demand	Anodyne	NPFFR1	43	32
NC(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819124807	ED	On-Demand	Anodyne	TMPRSS11D	80	36
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819124814	ED	On-Demand	Anodyne	CA2	164	72
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819124814	ED	On-Demand	Anodyne	CA6	26	66
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819124814	ED	On-Demand	Anodyne	CA1	136	72
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819124814	ED	On-Demand	Anodyne	CA7	82	66
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819124814	ED	On-Demand	Anodyne	CA13	37	44
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819124814	ED	On-Demand	Anodyne	CA5B	53	42
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819124814	ED	On-Demand	Anodyne	CA4	116	72
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819124814	ED	On-Demand	Anodyne	CA5A	56	42
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819124814	ED	On-Demand	Anodyne	CA14	71	59
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819124814	ED	On-Demand	Anodyne	CA12	97	66
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819124814	ED	On-Demand	Anodyne	CA9	106	72
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819124814	ED	On-Demand	Anodyne	CAH_METTE	35	44
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819124814	ED	On-Demand	Anodyne	CYNT	47	47
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819124814	ED	On-Demand	Anodyne	NCE103	28	66
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819124814	ED	On-Demand	Anodyne	CA15	22	44
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819124814	ED	On-Demand	Anodyne	MTCA1	45	38
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819124814	ED	On-Demand	Anodyne	P96878_MYCTU	56	38
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819124814	ED	On-Demand	Anodyne	A6YCJ1_9METZ	27	47
NC(=S)c1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819124815	DD	On-Demand	Anodyne	CA2	20	54
NC(=S)c1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819124815	DD	On-Demand	Anodyne	PPARA	15	43
NC(=S)c1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819124815	DD	On-Demand	Anodyne	HDAC1	17	50
NC(=S)c1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819124815	DD	On-Demand	Anodyne	HDAC2	19	53
NC(=S)c1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819124815	DD	On-Demand	Anodyne	TPSAB1	22	49
NC(=S)c1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819124815	DD	On-Demand	Anodyne	CYNT	15	50
NC(=S)c1ccc(C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819124815	DD	On-Demand	Anodyne	RPA1	50	36
NC(=S)c1ccc(C(=O)NCCC(=O)O)cc1	ZINC000819124816	CC	On-Demand	Anodyne	CA2	15	62
NC(=S)c1ccc(C(=O)NCCC(=O)O)cc1	ZINC000819124816	CC	On-Demand	Anodyne	GCGR	86	39
NC(=S)c1ccc(C(=O)NCCC(=O)O)cc1	ZINC000819124816	CC	On-Demand	Anodyne	FOLH1	25	42
NC(=S)c1ccc(C(=O)NCCC(=O)O)cc1	ZINC000819124816	CC	On-Demand	Anodyne	GIPR	71	37
NS(=O)(=O)c1cc(F)cc(NC(=O)NCCC(=O)O)c1	ZINC000819124817	DC	On-Demand	Anodyne	CA2	61	52
NS(=O)(=O)c1cc(F)cc(NC(=O)NCCC(=O)O)c1	ZINC000819124817	DC	On-Demand	Anodyne	CA1	56	52
NS(=O)(=O)c1cc(F)cc(NC(=O)NCCC(=O)O)c1	ZINC000819124817	DC	On-Demand	Anodyne	CA7	22	45
NS(=O)(=O)c1cc(F)cc(NC(=O)NCCC(=O)O)c1	ZINC000819124817	DC	On-Demand	Anodyne	CA4	67	52
NS(=O)(=O)c1cc(F)cc(NC(=O)NCCC(=O)O)c1	ZINC000819124817	DC	On-Demand	Anodyne	CA14	20	45
NS(=O)(=O)c1cc(F)cc(NC(=O)NCCC(=O)O)c1	ZINC000819124817	DC	On-Demand	Anodyne	CA12	38	45
NS(=O)(=O)c1cc(F)cc(NC(=O)NCCC(=O)O)c1	ZINC000819124817	DC	On-Demand	Anodyne	NCE103	21	45
NS(=O)(=O)c1cc(F)cc(NC(=O)NCCC(=O)O)c1	ZINC000819124817	DC	On-Demand	Anodyne	MTCA1	45	44
NS(=O)(=O)c1cc(F)cc(NC(=O)NCCC(=O)O)c1	ZINC000819124817	DC	On-Demand	Anodyne	P96878_MYCTU	58	44
NS(=O)(=O)c1ccc(C(=O)NCCC(=O)O)cc1Cl	ZINC000819124818	DC	On-Demand	Anodyne	CA2	67	80
NS(=O)(=O)c1ccc(C(=O)NCCC(=O)O)cc1Cl	ZINC000819124818	DC	On-Demand	Anodyne	GCGR	77	39
NS(=O)(=O)c1ccc(C(=O)NCCC(=O)O)cc1Cl	ZINC000819124818	DC	On-Demand	Anodyne	CA1	50	80
NS(=O)(=O)c1ccc(C(=O)NCCC(=O)O)cc1Cl	ZINC000819124818	DC	On-Demand	Anodyne	CA7	34	45
NS(=O)(=O)c1ccc(C(=O)NCCC(=O)O)cc1Cl	ZINC000819124818	DC	On-Demand	Anodyne	CA13	44	45
NS(=O)(=O)c1ccc(C(=O)NCCC(=O)O)cc1Cl	ZINC000819124818	DC	On-Demand	Anodyne	CA4	61	80
NS(=O)(=O)c1ccc(C(=O)NCCC(=O)O)cc1Cl	ZINC000819124818	DC	On-Demand	Anodyne	CA12	20	45
NS(=O)(=O)c1ccc(C(=O)NCCC(=O)O)cc1Cl	ZINC000819124818	DC	On-Demand	Anodyne	CA9	20	45
NS(=O)(=O)c1ccc(C(=O)NCCC(=O)O)cc1Cl	ZINC000819124818	DC	On-Demand	Anodyne	GIPR	51	34
NS(=O)(=O)c1ccc(C(=O)NCCC(=O)O)cc1Cl	ZINC000819124818	DC	On-Demand	Anodyne	CYNT	25	40
NS(=O)(=O)c1ccc(C(=O)NCCC(=O)O)cc1Cl	ZINC000819124818	DC	On-Demand	Anodyne	A6YCJ1_9METZ	15	42
NC(=O)c1cnn2cc(CNc3cccc(CC(=O)O)c3)cnc12	ZINC000819124819	ED	On-Demand	Anodyne	NR1H3	19	42
NC(=O)c1cnn2cc(CNc3cccc(CC(=O)O)c3)cnc12	ZINC000819124819	ED	On-Demand	Anodyne	NR1H2	33	42
NC(=O)c1cnn2cc(CNc3cccc(CC(=O)O)c3)cnc12	ZINC000819124819	ED	On-Demand	Anodyne	STAT6	49	34
NC(=O)c1cccc(CSCc2ccc(C(=O)O)cc2)c1	ZINC000819124820	DF	On-Demand	Anodyne	RARA	41	34
NC(=O)c1cccc(CSCc2ccc(C(=O)O)cc2)c1	ZINC000819124820	DF	On-Demand	Anodyne	CACNA2D1	19	40
NC(=O)c1cccc(CSCc2ccc(C(=O)O)cc2)c1	ZINC000819124820	DF	On-Demand	Anodyne	FOLH1	20	40
NC(=O)c1ccccc1N1CC[C@H](NC(=O)Nc2ccccc2CC(=O)O)C1	ZINC000819124827	GD	On-Demand	Anodyne	KCNQ2	64	38
NC(=O)c1ccccc1N1CC[C@@H](NC(=O)Nc2ccccc2CC(=O)O)C1	ZINC000819124828	GD	On-Demand	Anodyne	KCNQ2	64	38
NS(=O)(=O)c1cc(C(=O)OCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819124829	FD	On-Demand	Anodyne	CA2	33	46
NS(=O)(=O)c1cc(C(=O)OCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819124829	FD	On-Demand	Anodyne	CA1	25	46
NS(=O)(=O)c1cc(C(=O)OCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819124829	FD	On-Demand	Anodyne	CA7	17	40
NS(=O)(=O)c1cc(C(=O)OCc2ccc(C(=O)O)cc2)ccc1F	ZINC000819124829	FD	On-Demand	Anodyne	CA4	26	46
NS(=O)(=O)c1cc(C(=O)N2CC[C@@H](C(=O)O)C2)ccc1Cl	ZINC000819124830	EC	On-Demand	Anodyne	CA2	17	45
NS(=O)(=O)c1cc(C(=O)N2CC[C@@H](C(=O)O)C2)ccc1Cl	ZINC000819124830	EC	On-Demand	Anodyne	CA6	22	43
NS(=O)(=O)c1cc(C(=O)N2CC[C@@H](C(=O)O)C2)ccc1Cl	ZINC000819124830	EC	On-Demand	Anodyne	CA1	16	45
NS(=O)(=O)c1cc(C(=O)N2CC[C@@H](C(=O)O)C2)ccc1Cl	ZINC000819124830	EC	On-Demand	Anodyne	CA7	22	45
NS(=O)(=O)c1cc(C(=O)N2CC[C@@H](C(=O)O)C2)ccc1Cl	ZINC000819124830	EC	On-Demand	Anodyne	CA13	39	45
NS(=O)(=O)c1cc(C(=O)N2CC[C@@H](C(=O)O)C2)ccc1Cl	ZINC000819124830	EC	On-Demand	Anodyne	CA4	16	45
NS(=O)(=O)c1cc(C(=O)N2CC[C@@H](C(=O)O)C2)ccc1Cl	ZINC000819124830	EC	On-Demand	Anodyne	L3MBTL3	71	38
NS(=O)(=O)c1cc(C(=O)N2CC[C@H](C(=O)O)C2)ccc1Cl	ZINC000819124831	EC	On-Demand	Anodyne	CA2	17	45
NS(=O)(=O)c1cc(C(=O)N2CC[C@H](C(=O)O)C2)ccc1Cl	ZINC000819124831	EC	On-Demand	Anodyne	CA6	22	43
NS(=O)(=O)c1cc(C(=O)N2CC[C@H](C(=O)O)C2)ccc1Cl	ZINC000819124831	EC	On-Demand	Anodyne	CA1	16	45
NS(=O)(=O)c1cc(C(=O)N2CC[C@H](C(=O)O)C2)ccc1Cl	ZINC000819124831	EC	On-Demand	Anodyne	CA7	22	45
NS(=O)(=O)c1cc(C(=O)N2CC[C@H](C(=O)O)C2)ccc1Cl	ZINC000819124831	EC	On-Demand	Anodyne	CA13	39	45
NS(=O)(=O)c1cc(C(=O)N2CC[C@H](C(=O)O)C2)ccc1Cl	ZINC000819124831	EC	On-Demand	Anodyne	CA4	16	45
NS(=O)(=O)c1cc(C(=O)N2CC[C@H](C(=O)O)C2)ccc1Cl	ZINC000819124831	EC	On-Demand	Anodyne	L3MBTL3	71	38
NS(=O)(=O)c1cc(F)cc(NC(=O)NCC(=O)O)c1	ZINC000819124832	CB	On-Demand	Anodyne	CA2	70	47
NS(=O)(=O)c1cc(F)cc(NC(=O)NCC(=O)O)c1	ZINC000819124832	CB	On-Demand	Anodyne	CA1	58	47
NS(=O)(=O)c1cc(F)cc(NC(=O)NCC(=O)O)c1	ZINC000819124832	CB	On-Demand	Anodyne	CA4	76	47
NS(=O)(=O)c1cc(F)cc(NC(=O)NCC(=O)O)c1	ZINC000819124832	CB	On-Demand	Anodyne	CA5A	44	35
NS(=O)(=O)c1cc(F)cc(NC(=O)NCC(=O)O)c1	ZINC000819124832	CB	On-Demand	Anodyne	CA12	38	46
NS(=O)(=O)c1cc(F)cc(NC(=O)NCC(=O)O)c1	ZINC000819124832	CB	On-Demand	Anodyne	CA9	38	40
NS(=O)(=O)c1cc(F)cc(NC(=O)NCC(=O)O)c1	ZINC000819124832	CB	On-Demand	Anodyne	NCE103	20	41
NS(=O)(=O)c1cc(F)cc(NC(=O)NCC(=O)O)c1	ZINC000819124832	CB	On-Demand	Anodyne	MTCA1	46	46
NS(=O)(=O)c1cc(F)cc(NC(=O)NCC(=O)O)c1	ZINC000819124832	CB	On-Demand	Anodyne	P96878_MYCTU	58	46
NC(=O)c1sccc1NC(=O)CSCC(=O)O	ZINC000819124835	CC	On-Demand	Anodyne	FAS	46	48
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124838	FE	On-Demand	Anodyne	HTR1A	35	44
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124838	FE	On-Demand	Anodyne	DRD2	50	45
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124838	FE	On-Demand	Anodyne	DRD4	55	38
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124838	FE	On-Demand	Anodyne	ACHE	42	42
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124838	FE	On-Demand	Anodyne	HTR2A	28	43
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124838	FE	On-Demand	Anodyne	DRD3	70	45
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124838	FE	On-Demand	Anodyne	HTR7	17	42
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124838	FE	On-Demand	Anodyne	SIGMAR1	61	42
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124838	FE	On-Demand	Anodyne	BCHE	19	41
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124838	FE	On-Demand	Anodyne	CCR3	22	46
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124838	FE	On-Demand	Anodyne	CYP2J2	45	32
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124839	FE	On-Demand	Anodyne	HTR1A	35	44
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124839	FE	On-Demand	Anodyne	DRD2	50	45
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124839	FE	On-Demand	Anodyne	DRD4	55	38
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124839	FE	On-Demand	Anodyne	ACHE	42	42
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124839	FE	On-Demand	Anodyne	HTR2A	28	43
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124839	FE	On-Demand	Anodyne	DRD3	70	45
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124839	FE	On-Demand	Anodyne	HTR7	17	42
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124839	FE	On-Demand	Anodyne	SIGMAR1	61	42
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124839	FE	On-Demand	Anodyne	BCHE	19	41
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124839	FE	On-Demand	Anodyne	CCR3	22	46
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124839	FE	On-Demand	Anodyne	CYP2J2	45	32
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124840	FE	On-Demand	Anodyne	HTR1A	35	44
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124840	FE	On-Demand	Anodyne	DRD2	50	45
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124840	FE	On-Demand	Anodyne	DRD4	55	38
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124840	FE	On-Demand	Anodyne	ACHE	42	42
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124840	FE	On-Demand	Anodyne	HTR2A	28	43
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124840	FE	On-Demand	Anodyne	DRD3	70	45
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124840	FE	On-Demand	Anodyne	HTR7	17	42
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124840	FE	On-Demand	Anodyne	SIGMAR1	61	42
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124840	FE	On-Demand	Anodyne	BCHE	19	41
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124840	FE	On-Demand	Anodyne	CCR3	22	46
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124840	FE	On-Demand	Anodyne	CYP2J2	45	32
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124841	FE	On-Demand	Anodyne	HTR1A	35	44
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124841	FE	On-Demand	Anodyne	DRD2	50	45
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124841	FE	On-Demand	Anodyne	DRD4	55	38
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124841	FE	On-Demand	Anodyne	ACHE	42	42
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124841	FE	On-Demand	Anodyne	HTR2A	28	43
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124841	FE	On-Demand	Anodyne	DRD3	70	45
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124841	FE	On-Demand	Anodyne	HTR7	17	42
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124841	FE	On-Demand	Anodyne	SIGMAR1	61	42
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124841	FE	On-Demand	Anodyne	BCHE	19	41
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124841	FE	On-Demand	Anodyne	CCR3	22	46
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000819124841	FE	On-Demand	Anodyne	CYP2J2	45	32
CCOc1cc(F)ccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819124860	GH	On-Demand	Mild	PAPA1_CARPA	41	47
CCOc1cc(F)ccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819124861	GH	On-Demand	Mild	PAPA1_CARPA	41	47
NS(=O)(=O)Cc1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819124884	DC	On-Demand	Anodyne	L3MBTL3	82	43
NS(=O)(=O)Cc1ccc(C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819124885	DC	On-Demand	Anodyne	L3MBTL3	82	43
NC(=O)c1cn(CC(=O)N[C@H](C(=O)O)c2ccccc2)c2ccccc12	ZINC000819124890	FD	On-Demand	Anodyne	CNR2	21	40
NS(=O)(=O)c1ccc(C(=O)N2CC[C@H](C(=O)O)C2)o1	ZINC000819124892	CB	On-Demand	Anodyne	L3MBTL3	20	47
NS(=O)(=O)c1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)o1	ZINC000819124901	CB	On-Demand	Anodyne	L3MBTL3	20	47
NS(=O)(=O)c1cc(NCc2ccc(C(=O)O)cc2)cc([N+](=O)[O-])c1	ZINC000819124903	FD	On-Demand	Bother	CA2	96	54
NS(=O)(=O)c1cc(NCc2ccc(C(=O)O)cc2)cc([N+](=O)[O-])c1	ZINC000819124903	FD	On-Demand	Bother	CA1	77	48
NS(=O)(=O)c1cc(NCc2ccc(C(=O)O)cc2)cc([N+](=O)[O-])c1	ZINC000819124903	FD	On-Demand	Bother	CA7	43	45
NS(=O)(=O)c1cc(NCc2ccc(C(=O)O)cc2)cc([N+](=O)[O-])c1	ZINC000819124903	FD	On-Demand	Bother	CA13	26	43
NS(=O)(=O)c1cc(NCc2ccc(C(=O)O)cc2)cc([N+](=O)[O-])c1	ZINC000819124903	FD	On-Demand	Bother	CA5B	49	39
NS(=O)(=O)c1cc(NCc2ccc(C(=O)O)cc2)cc([N+](=O)[O-])c1	ZINC000819124903	FD	On-Demand	Bother	CA4	69	45
NS(=O)(=O)c1cc(NCc2ccc(C(=O)O)cc2)cc([N+](=O)[O-])c1	ZINC000819124903	FD	On-Demand	Bother	CA5A	57	39
NS(=O)(=O)c1cc(NCc2ccc(C(=O)O)cc2)cc([N+](=O)[O-])c1	ZINC000819124903	FD	On-Demand	Bother	CA14	33	42
NS(=O)(=O)c1cc(NCc2ccc(C(=O)O)cc2)cc([N+](=O)[O-])c1	ZINC000819124903	FD	On-Demand	Bother	MMP8	23	43
NS(=O)(=O)c1cc(NCc2ccc(C(=O)O)cc2)cc([N+](=O)[O-])c1	ZINC000819124903	FD	On-Demand	Bother	CA12	48	45
NS(=O)(=O)c1cc(NCc2ccc(C(=O)O)cc2)cc([N+](=O)[O-])c1	ZINC000819124903	FD	On-Demand	Bother	CA9	54	45
NS(=O)(=O)c1cc(NCc2ccc(C(=O)O)cc2)cc([N+](=O)[O-])c1	ZINC000819124903	FD	On-Demand	Bother	MMP1	16	43
NS(=O)(=O)c1cc(NCc2ccc(C(=O)O)cc2)cc([N+](=O)[O-])c1	ZINC000819124903	FD	On-Demand	Bother	CYNT	44	47
NS(=O)(=O)c1cc(NCc2ccc(C(=O)O)cc2)cc([N+](=O)[O-])c1	ZINC000819124903	FD	On-Demand	Bother	NCE103	19	45
NS(=O)(=O)c1cc(NCc2ccc(C(=O)O)cc2)cc([N+](=O)[O-])c1	ZINC000819124903	FD	On-Demand	Bother	MTCA1	29	43
NS(=O)(=O)c1cc(NCc2ccc(C(=O)O)cc2)cc([N+](=O)[O-])c1	ZINC000819124903	FD	On-Demand	Bother	P96878_MYCTU	34	43
NS(=O)(=O)c1cc(C(=O)NCCCC(=O)O)ccc1Br	ZINC000819124906	FC	On-Demand	Anodyne	CA2	48	75
NS(=O)(=O)c1cc(C(=O)NCCCC(=O)O)ccc1Br	ZINC000819124906	FC	On-Demand	Anodyne	CA1	33	75
NS(=O)(=O)c1cc(C(=O)NCCCC(=O)O)ccc1Br	ZINC000819124906	FC	On-Demand	Anodyne	CA4	44	75
NS(=O)(=O)c1ccc(C(=O)NCCCC(=O)O)o1	ZINC000819124908	CB	On-Demand	Anodyne	CA2	38	57
NS(=O)(=O)c1ccc(C(=O)NCCCC(=O)O)o1	ZINC000819124908	CB	On-Demand	Anodyne	CA1	35	57
NS(=O)(=O)c1ccc(C(=O)NCCCC(=O)O)o1	ZINC000819124908	CB	On-Demand	Anodyne	CA4	34	57
NS(=O)(=O)c1ccc(C(=O)NCCCC(=O)O)o1	ZINC000819124908	CB	On-Demand	Anodyne	CA12	17	41
NS(=O)(=O)c1ccc(C(=O)NCCCC(=O)O)o1	ZINC000819124908	CB	On-Demand	Anodyne	NCE103	18	41
NS(=O)(=O)c1cc(C(=O)NCCC(=O)O)ccc1Br	ZINC000819124913	FC	On-Demand	Anodyne	CA2	64	76
NS(=O)(=O)c1cc(C(=O)NCCC(=O)O)ccc1Br	ZINC000819124913	FC	On-Demand	Anodyne	GCGR	69	36
NS(=O)(=O)c1cc(C(=O)NCCC(=O)O)ccc1Br	ZINC000819124913	FC	On-Demand	Anodyne	CA1	45	76
NS(=O)(=O)c1cc(C(=O)NCCC(=O)O)ccc1Br	ZINC000819124913	FC	On-Demand	Anodyne	CA7	20	40
NS(=O)(=O)c1cc(C(=O)NCCC(=O)O)ccc1Br	ZINC000819124913	FC	On-Demand	Anodyne	CA4	60	76
NS(=O)(=O)c1cc(C(=O)NCCC(=O)O)ccc1Br	ZINC000819124913	FC	On-Demand	Anodyne	GIPR	45	33
NS(=O)(=O)c1cc(C(=O)NCCC(=O)O)ccc1Br	ZINC000819124913	FC	On-Demand	Anodyne	CYNT	24	41
NC(=O)c1ccsc1NC(=O)CCN1CCC[C@@H](CC(=O)O)C1	ZINC000819124923	ED	On-Demand	Anodyne	SLC6A1	46	34
NC(=O)c1ccsc1NC(=O)CCN1CCC[C@H](CC(=O)O)C1	ZINC000819124925	ED	On-Demand	Anodyne	SLC6A1	46	34
N=C1NC(=O)[C@@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124927	DC	On-Demand	Anodyne	ACE	47	51
N=C1NC(=O)[C@@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124927	DC	On-Demand	Anodyne	MME	108	44
N=C1NC(=O)[C@@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124927	DC	On-Demand	Anodyne	ANPEP	51	36
N=C1NC(=O)[C@@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124927	DC	On-Demand	Anodyne	CMA1	19	40
N=C1NC(=O)[C@@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124927	DC	On-Demand	Anodyne	CPA1	49	41
N=C1NC(=O)[C@@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124927	DC	On-Demand	Anodyne	NPFFR2	41	36
N=C1NC(=O)[C@@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124927	DC	On-Demand	Anodyne	NAALAD2	24	42
N=C1NC(=O)[C@@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124927	DC	On-Demand	Anodyne	GRIA1	41	37
N=C1NC(=O)[C@@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124927	DC	On-Demand	Anodyne	CAPN1	33	43
N=C1NC(=O)[C@@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124927	DC	On-Demand	Anodyne	ACE2	87	44
N=C1NC(=O)[C@@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124927	DC	On-Demand	Anodyne	FPR1	71	38
N=C1NC(=O)[C@@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124927	DC	On-Demand	Anodyne	BLA1_STEMA	74	39
N=C1NC(=O)[C@@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124927	DC	On-Demand	Anodyne	NPFFR1	63	36
N=C1NC(=O)[C@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124930	DC	On-Demand	Anodyne	ACE	47	51
N=C1NC(=O)[C@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124930	DC	On-Demand	Anodyne	MME	108	44
N=C1NC(=O)[C@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124930	DC	On-Demand	Anodyne	ANPEP	51	36
N=C1NC(=O)[C@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124930	DC	On-Demand	Anodyne	CMA1	19	40
N=C1NC(=O)[C@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124930	DC	On-Demand	Anodyne	CPA1	49	41
N=C1NC(=O)[C@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124930	DC	On-Demand	Anodyne	NPFFR2	41	36
N=C1NC(=O)[C@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124930	DC	On-Demand	Anodyne	NAALAD2	24	42
N=C1NC(=O)[C@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124930	DC	On-Demand	Anodyne	GRIA1	41	37
N=C1NC(=O)[C@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124930	DC	On-Demand	Anodyne	CAPN1	33	43
N=C1NC(=O)[C@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124930	DC	On-Demand	Anodyne	ACE2	87	44
N=C1NC(=O)[C@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124930	DC	On-Demand	Anodyne	FPR1	71	38
N=C1NC(=O)[C@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124930	DC	On-Demand	Anodyne	BLA1_STEMA	74	39
N=C1NC(=O)[C@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124930	DC	On-Demand	Anodyne	NPFFR1	63	36
N=C1NC(=O)[C@@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124931	DC	On-Demand	Anodyne	ACE	47	51
N=C1NC(=O)[C@@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124931	DC	On-Demand	Anodyne	MME	108	44
N=C1NC(=O)[C@@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124931	DC	On-Demand	Anodyne	ANPEP	51	36
N=C1NC(=O)[C@@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124931	DC	On-Demand	Anodyne	CMA1	19	40
N=C1NC(=O)[C@@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124931	DC	On-Demand	Anodyne	CPA1	49	41
N=C1NC(=O)[C@@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124931	DC	On-Demand	Anodyne	NPFFR2	41	36
N=C1NC(=O)[C@@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124931	DC	On-Demand	Anodyne	NAALAD2	24	42
N=C1NC(=O)[C@@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124931	DC	On-Demand	Anodyne	GRIA1	41	37
N=C1NC(=O)[C@@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124931	DC	On-Demand	Anodyne	CAPN1	33	43
N=C1NC(=O)[C@@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124931	DC	On-Demand	Anodyne	ACE2	87	44
N=C1NC(=O)[C@@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124931	DC	On-Demand	Anodyne	FPR1	71	38
N=C1NC(=O)[C@@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124931	DC	On-Demand	Anodyne	BLA1_STEMA	74	39
N=C1NC(=O)[C@@H](CC(=O)N[C@@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124931	DC	On-Demand	Anodyne	NPFFR1	63	36
N=C1NC(=O)[C@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124933	DC	On-Demand	Anodyne	ACE	47	51
N=C1NC(=O)[C@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124933	DC	On-Demand	Anodyne	MME	108	44
N=C1NC(=O)[C@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124933	DC	On-Demand	Anodyne	ANPEP	51	36
N=C1NC(=O)[C@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124933	DC	On-Demand	Anodyne	CMA1	19	40
N=C1NC(=O)[C@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124933	DC	On-Demand	Anodyne	CPA1	49	41
N=C1NC(=O)[C@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124933	DC	On-Demand	Anodyne	NPFFR2	41	36
N=C1NC(=O)[C@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124933	DC	On-Demand	Anodyne	NAALAD2	24	42
N=C1NC(=O)[C@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124933	DC	On-Demand	Anodyne	GRIA1	41	37
N=C1NC(=O)[C@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124933	DC	On-Demand	Anodyne	CAPN1	33	43
N=C1NC(=O)[C@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124933	DC	On-Demand	Anodyne	ACE2	87	44
N=C1NC(=O)[C@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124933	DC	On-Demand	Anodyne	FPR1	71	38
N=C1NC(=O)[C@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124933	DC	On-Demand	Anodyne	BLA1_STEMA	74	39
N=C1NC(=O)[C@H](CC(=O)N[C@H](Cc2ccccc2)C(=O)O)S1	ZINC000819124933	DC	On-Demand	Anodyne	NPFFR1	63	36
NC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819124945	EC	On-Demand	Anodyne	PPIA	19	40
NC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819124945	EC	On-Demand	Anodyne	AKR1C3	32	41
NC(=O)c1cccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819124945	EC	On-Demand	Anodyne	KCNK3	70	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819124952	GH	On-Demand	Anodyne	CHRNA7	36	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(OCCn2cncn2)c1	ZINC000819124968	GE	On-Demand	Anodyne	EPHX2	18	43
CC(=O)Nc1cccc(CC(=O)Nc2cc(Cl)ccc2C(=O)NC(C)C)c1	ZINC000819124973	GH	On-Demand	Anodyne	KCNQ2	17	41
CC(C)(C)N1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819124987	DE	On-Demand	Anodyne	ADRB1	34	47
CC(C)(C)N1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819124987	DE	On-Demand	Anodyne	ADRB3	51	49
CC(C)(C)N1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819124987	DE	On-Demand	Anodyne	CYP3A4	50	39
CC(C)(C)N1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819124988	DE	On-Demand	Anodyne	ADRB1	34	47
CC(C)(C)N1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819124988	DE	On-Demand	Anodyne	ADRB3	51	49
CC(C)(C)N1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819124988	DE	On-Demand	Anodyne	CYP3A4	50	39
CC(C)(C)N1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819124989	DE	On-Demand	Anodyne	ADRB1	34	47
CC(C)(C)N1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819124989	DE	On-Demand	Anodyne	ADRB3	51	49
CC(C)(C)N1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819124989	DE	On-Demand	Anodyne	CYP3A4	50	39
CC(C)(C)N1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819124991	DE	On-Demand	Anodyne	ADRB1	34	47
CC(C)(C)N1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819124991	DE	On-Demand	Anodyne	ADRB3	51	49
CC(C)(C)N1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819124991	DE	On-Demand	Anodyne	CYP3A4	50	39
COC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc2ccccc12	ZINC000819125016	EH	On-Demand	Anodyne	ADRB2	22	41
COC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc2ccccc12	ZINC000819125016	EH	On-Demand	Anodyne	ADRB1	21	40
COC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc2ccccc12	ZINC000819125016	EH	On-Demand	Anodyne	ADRB3	20	43
COC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc2ccccc12	ZINC000819125017	EH	On-Demand	Anodyne	ADRB2	22	41
COC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc2ccccc12	ZINC000819125017	EH	On-Demand	Anodyne	ADRB1	21	40
COC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc2ccccc12	ZINC000819125017	EH	On-Demand	Anodyne	ADRB3	20	43
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccncc2)CC1	ZINC000819125028	DD	On-Demand	Anodyne	DRD4	19	41
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccncc2)CC1	ZINC000819125028	DD	On-Demand	Anodyne	SIGMAR1	22	50
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccncc2)CC1	ZINC000819125028	DD	On-Demand	Anodyne	SSTR5	51	37
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccncc2)CC1	ZINC000819125028	DD	On-Demand	Anodyne	MCHR1	35	40
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccncc2)CC1	ZINC000819125030	DD	On-Demand	Anodyne	DRD4	19	41
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccncc2)CC1	ZINC000819125030	DD	On-Demand	Anodyne	SIGMAR1	22	50
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccncc2)CC1	ZINC000819125030	DD	On-Demand	Anodyne	SSTR5	51	37
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccncc2)CC1	ZINC000819125030	DD	On-Demand	Anodyne	MCHR1	35	40
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccncc2)CC1	ZINC000819125031	DD	On-Demand	Anodyne	DRD4	19	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccncc2)CC1	ZINC000819125031	DD	On-Demand	Anodyne	SIGMAR1	22	50
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccncc2)CC1	ZINC000819125031	DD	On-Demand	Anodyne	SSTR5	51	37
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccncc2)CC1	ZINC000819125031	DD	On-Demand	Anodyne	MCHR1	35	40
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccncc2)CC1	ZINC000819125033	DD	On-Demand	Anodyne	DRD4	19	41
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccncc2)CC1	ZINC000819125033	DD	On-Demand	Anodyne	SIGMAR1	22	50
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccncc2)CC1	ZINC000819125033	DD	On-Demand	Anodyne	SSTR5	51	37
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccncc2)CC1	ZINC000819125033	DD	On-Demand	Anodyne	MCHR1	35	40
COC[C@H](Cc1ccccc1)NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819125045	FF	On-Demand	Anodyne	LTA4H	36	40
COC[C@H](Cc1ccccc1)NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819125045	FF	On-Demand	Anodyne	TIMP3	44	41
COC[C@@H](Cc1ccccc1)NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819125046	FF	On-Demand	Anodyne	LTA4H	36	40
COC[C@@H](Cc1ccccc1)NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819125046	FF	On-Demand	Anodyne	TIMP3	44	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(Cc3ccncc3)CC1)C2	ZINC000819125047	GE	On-Demand	Anodyne	SIGMAR1	21	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(Cc3ccncc3)CC1)C2	ZINC000819125047	GE	On-Demand	Anodyne	SSTR5	48	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(Cc3ccncc3)CC1)C2	ZINC000819125047	GE	On-Demand	Anodyne	PDK1	26	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(Cc3ccncc3)CC1)C2	ZINC000819125049	GE	On-Demand	Anodyne	SIGMAR1	21	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(Cc3ccncc3)CC1)C2	ZINC000819125049	GE	On-Demand	Anodyne	SSTR5	48	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(Cc3ccncc3)CC1)C2	ZINC000819125049	GE	On-Demand	Anodyne	PDK1	26	40
O[C@@H](CNCCCc1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819125060	EH	On-Demand	Anodyne	ADRB2	40	49
O[C@@H](CNCCCc1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819125060	EH	On-Demand	Anodyne	ADRB1	56	49
O[C@@H](CNCCCc1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819125060	EH	On-Demand	Anodyne	ADRB3	129	51
O[C@H](CNCCCc1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819125062	EH	On-Demand	Anodyne	ADRB2	40	49
O[C@H](CNCCCc1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819125062	EH	On-Demand	Anodyne	ADRB1	56	49
O[C@H](CNCCCc1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819125062	EH	On-Demand	Anodyne	ADRB3	129	51
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cnn(C[C@@H]3CCCO3)c1)C2	ZINC000819125072	FD	On-Demand	Anodyne	PANC	53	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cnn(C[C@@H]3CCCO3)c1)C2	ZINC000819125074	FD	On-Demand	Anodyne	PANC	53	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cnn(C[C@H]3CCCO3)c1)C2	ZINC000819125077	FD	On-Demand	Anodyne	PANC	53	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cnn(C[C@H]3CCCO3)c1)C2	ZINC000819125079	FD	On-Demand	Anodyne	PANC	53	35
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125096	FE	On-Demand	Anodyne	HTR1A	87	56
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125096	FE	On-Demand	Anodyne	DRD2	69	48
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125096	FE	On-Demand	Anodyne	DRD1	15	44
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125096	FE	On-Demand	Anodyne	DRD4	43	44
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125096	FE	On-Demand	Anodyne	ADRA1D	21	45
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125096	FE	On-Demand	Anodyne	HTR2A	61	50
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125096	FE	On-Demand	Anodyne	HTR2C	33	46
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125096	FE	On-Demand	Anodyne	ADRA1A	34	45
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125096	FE	On-Demand	Anodyne	ADRA1B	17	45
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125096	FE	On-Demand	Anodyne	DRD3	94	50
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125096	FE	On-Demand	Anodyne	HTR7	92	43
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125096	FE	On-Demand	Anodyne	SIGMAR1	15	41
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125096	FE	On-Demand	Anodyne	CYP2J2	44	32
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125098	FE	On-Demand	Anodyne	HTR1A	87	56
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125098	FE	On-Demand	Anodyne	DRD2	69	48
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125098	FE	On-Demand	Anodyne	DRD1	15	44
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125098	FE	On-Demand	Anodyne	DRD4	43	44
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125098	FE	On-Demand	Anodyne	ADRA1D	21	45
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125098	FE	On-Demand	Anodyne	HTR2A	61	50
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125098	FE	On-Demand	Anodyne	HTR2C	33	46
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125098	FE	On-Demand	Anodyne	ADRA1A	34	45
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125098	FE	On-Demand	Anodyne	ADRA1B	17	45
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125098	FE	On-Demand	Anodyne	DRD3	94	50
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125098	FE	On-Demand	Anodyne	HTR7	92	43
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125098	FE	On-Demand	Anodyne	SIGMAR1	15	41
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125098	FE	On-Demand	Anodyne	CYP2J2	44	32
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125101	FE	On-Demand	Anodyne	HTR1A	87	56
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125101	FE	On-Demand	Anodyne	DRD2	69	48
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125101	FE	On-Demand	Anodyne	DRD1	15	44
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125101	FE	On-Demand	Anodyne	DRD4	43	44
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125101	FE	On-Demand	Anodyne	ADRA1D	21	45
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125101	FE	On-Demand	Anodyne	HTR2A	61	50
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125101	FE	On-Demand	Anodyne	HTR2C	33	46
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125101	FE	On-Demand	Anodyne	ADRA1A	34	45
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125101	FE	On-Demand	Anodyne	ADRA1B	17	45
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125101	FE	On-Demand	Anodyne	DRD3	94	50
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125101	FE	On-Demand	Anodyne	HTR7	92	43
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125101	FE	On-Demand	Anodyne	SIGMAR1	15	41
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125101	FE	On-Demand	Anodyne	CYP2J2	44	32
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125102	FE	On-Demand	Anodyne	HTR1A	87	56
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125102	FE	On-Demand	Anodyne	DRD2	69	48
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125102	FE	On-Demand	Anodyne	DRD1	15	44
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125102	FE	On-Demand	Anodyne	DRD4	43	44
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125102	FE	On-Demand	Anodyne	ADRA1D	21	45
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125102	FE	On-Demand	Anodyne	HTR2A	61	50
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125102	FE	On-Demand	Anodyne	HTR2C	33	46
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125102	FE	On-Demand	Anodyne	ADRA1A	34	45
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125102	FE	On-Demand	Anodyne	ADRA1B	17	45
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125102	FE	On-Demand	Anodyne	DRD3	94	50
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125102	FE	On-Demand	Anodyne	HTR7	92	43
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125102	FE	On-Demand	Anodyne	SIGMAR1	15	41
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(c2ccccc2)CC1	ZINC000819125102	FE	On-Demand	Anodyne	CYP2J2	44	32
COCCn1cc(NC(=O)C(F)=C2CCC2)cn1	ZINC000819125107	CD	On-Demand	Anodyne	PANC	46	32
COC(=O)c1ccc(CCNC(=O)Cn2cnc3sc(-c4ccccc4)cc3c2=O)cc1	ZINC000819125114	IG	On-Demand	Anodyne	F2	15	43
COC(=O)c1ccc(CCNC(=O)Cn2cnc3sc(-c4ccccc4)cc3c2=O)cc1	ZINC000819125114	IG	On-Demand	Anodyne	ADRB3	25	40
CCO[C@@H](CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1)C(C)C	ZINC000819125115	DF	On-Demand	Bother	ADRB3	50	37
CCO[C@@H](CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1)C(C)C	ZINC000819125115	DF	On-Demand	Bother	CACNA1D	53	36
CCO[C@@H](CCNC[C@H](O)c1cccc([N+](=O)[O-])c1)C(C)C	ZINC000819125116	DF	On-Demand	Bother	ADRB3	50	37
CCO[C@@H](CCNC[C@H](O)c1cccc([N+](=O)[O-])c1)C(C)C	ZINC000819125116	DF	On-Demand	Bother	CACNA1D	53	36
O=C(CNC[C@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125149	FF	On-Demand	Anodyne	SLC6A4	19	44
O=C(CNC[C@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125149	FF	On-Demand	Anodyne	SLC6A3	44	44
O=C(CNC[C@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125149	FF	On-Demand	Anodyne	GRIN2B	88	48
O=C(CNC[C@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125149	FF	On-Demand	Anodyne	SIGMAR1	27	51
O=C(CNC[C@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125149	FF	On-Demand	Anodyne	CCR3	80	48
O=C(CNC[C@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125149	FF	On-Demand	Anodyne	C3AR1	32	41
O=C(CNC[C@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125149	FF	On-Demand	Anodyne	GRIN2C	26	48
O=C(CNC[C@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125149	FF	On-Demand	Anodyne	AMP1_PLAFQ	19	49
O=C(CNC[C@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125149	FF	On-Demand	Anodyne	CACNA1G	40	36
O=C(CNC[C@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125149	FF	On-Demand	Anodyne	SCD	25	40
O=C(CNC[C@@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125151	FF	On-Demand	Anodyne	SLC6A4	19	44
O=C(CNC[C@@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125151	FF	On-Demand	Anodyne	SLC6A3	44	44
O=C(CNC[C@@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125151	FF	On-Demand	Anodyne	GRIN2B	88	48
O=C(CNC[C@@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125151	FF	On-Demand	Anodyne	SIGMAR1	27	51
O=C(CNC[C@@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125151	FF	On-Demand	Anodyne	CCR3	80	48
O=C(CNC[C@@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125151	FF	On-Demand	Anodyne	C3AR1	32	41
O=C(CNC[C@@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125151	FF	On-Demand	Anodyne	GRIN2C	26	48
O=C(CNC[C@@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125151	FF	On-Demand	Anodyne	AMP1_PLAFQ	19	49
O=C(CNC[C@@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125151	FF	On-Demand	Anodyne	CACNA1G	40	36
O=C(CNC[C@@H](O)c1ccc(F)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819125151	FF	On-Demand	Anodyne	SCD	25	40
CCOc1cc(NC(=O)/C=C/[C@H]2CCCO2)ccc1OC	ZINC000819125162	CF	On-Demand	Anodyne	SSTR5	22	40
CCOc1cc(NC(=O)/C=C/[C@H]2CCCO2)ccc1OC	ZINC000819125162	CF	On-Demand	Anodyne	ENPP1	62	33
CCOc1cc(NC(=O)/C=C\[C@H]2CCCO2)ccc1OC	ZINC000819125163	CF	On-Demand	Anodyne	SSTR5	22	40
CCOc1cc(NC(=O)/C=C\[C@H]2CCCO2)ccc1OC	ZINC000819125163	CF	On-Demand	Anodyne	ENPP1	62	33
CCOc1cc(NC(=O)/C=C\[C@@H]2CCCO2)ccc1OC	ZINC000819125164	CF	On-Demand	Anodyne	SSTR5	22	40
CCOc1cc(NC(=O)/C=C\[C@@H]2CCCO2)ccc1OC	ZINC000819125164	CF	On-Demand	Anodyne	ENPP1	62	33
CCOc1cc(NC(=O)/C=C/[C@@H]2CCCO2)ccc1OC	ZINC000819125165	CF	On-Demand	Anodyne	SSTR5	22	40
CCOc1cc(NC(=O)/C=C/[C@@H]2CCCO2)ccc1OC	ZINC000819125165	CF	On-Demand	Anodyne	ENPP1	62	33
CN1CCCN(c2ccc(NC(=O)C(F)=C3CCC3)cc2)CC1	ZINC000819125166	DG	On-Demand	Anodyne	PRNP	39	46
CCOc1cc(NC(=O)[C@@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)ccc1OC	ZINC000819125175	FF	On-Demand	Anodyne	ENPP1	72	35
CCOc1cc(NC(=O)[C@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)ccc1OC	ZINC000819125176	FF	On-Demand	Anodyne	ENPP1	72	35
O=C(/C=C\[C@H]1CCCO1)N1CCC(Oc2ccc(F)cc2F)CC1	ZINC000819125195	EG	On-Demand	Anodyne	SCD1	27	40
O=C(/C=C\[C@@H]1CCCO1)N1CCC(Oc2ccc(F)cc2F)CC1	ZINC000819125197	EG	On-Demand	Anodyne	SCD1	27	40
O=C(/C=C/[C@H]1CCCO1)N1CCC(Oc2ccc(F)cc2F)CC1	ZINC000819125199	EG	On-Demand	Anodyne	SCD1	27	40
O=C(/C=C/[C@@H]1CCCO1)N1CCC(Oc2ccc(F)cc2F)CC1	ZINC000819125200	EG	On-Demand	Anodyne	SCD1	27	40
CN(C)[C@@H](CNC[C@@H](O)c1c(F)cccc1F)c1ccc(Cl)cc1	ZINC000819125232	FH	On-Demand	Anodyne	UTS2	41	32
CN(C)[C@@H](CNC[C@H](O)c1c(F)cccc1F)c1ccc(Cl)cc1	ZINC000819125238	FH	On-Demand	Anodyne	UTS2	41	32
COC(=O)c1ccc(CCNC(=O)c2cc3ccccc3oc2=O)cc1	ZINC000819125240	FF	On-Demand	Anodyne	MAOB	23	56
COC(=O)c1ccc(CCNC(=O)c2cc3ccccc3oc2=O)cc1	ZINC000819125240	FF	On-Demand	Anodyne	ABCG2	27	42
CCOc1cc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)ccc1OC	ZINC000819125247	FF	On-Demand	Anodyne	ENPP1	63	34
CSc1ccc(F)cc1CNC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819125271	GH	On-Demand	Anodyne	GPR119	36	50
CSc1ccc(F)cc1CNC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819125273	GH	On-Demand	Anodyne	GPR119	36	50
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccccc1OC1CCCC1)C2	ZINC000819125276	GG	On-Demand	Anodyne	P2RX7	23	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccccc1OC1CCCC1)C2	ZINC000819125280	GG	On-Demand	Anodyne	P2RX7	23	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819125283	FE	On-Demand	Anodyne	SIGMAR1	23	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819125283	FE	On-Demand	Anodyne	SSTR5	56	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819125283	FE	On-Demand	Anodyne	MCHR1	40	41
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1	ZINC000819125304	FE	On-Demand	Anodyne	CCR2	24	42
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1	ZINC000819125308	FE	On-Demand	Anodyne	CCR2	24	42
CN1CCCN(c2ccc(NC(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)cc2)CC1	ZINC000819125310	GF	On-Demand	Anodyne	PRNP	21	40
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1	ZINC000819125311	FE	On-Demand	Anodyne	CCR2	24	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1	ZINC000819125315	FE	On-Demand	Anodyne	CCR2	24	42
CC(C)c1ccc(OC2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1	ZINC000819125336	EH	On-Demand	Anodyne	PRSS2	59	31
CC(C)c1ccc(OC2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1	ZINC000819125340	EH	On-Demand	Anodyne	PRSS2	59	31
CC(C)c1ccc(OC2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1	ZINC000819125343	EH	On-Demand	Anodyne	PRSS2	59	31
CCO[C@@H](CCNC[C@@H](O)c1cccc(Br)c1)C(C)C	ZINC000819125345	EH	On-Demand	Anodyne	ADRB3	41	37
CC(C)c1ccc(OC2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1	ZINC000819125346	EH	On-Demand	Anodyne	PRSS2	59	31
CCO[C@@H](CCNC[C@H](O)c1cccc(Br)c1)C(C)C	ZINC000819125348	EH	On-Demand	Anodyne	ADRB3	41	37
O=C(/C=C\[C@H]1CCCO1)N1CCCc2cc(Cl)ccc21	ZINC000819125353	CG	On-Demand	Anodyne	CNR1	52	33
O=C(/C=C\[C@H]1CCCO1)N1CCCc2cc(Cl)ccc21	ZINC000819125353	CG	On-Demand	Anodyne	AVPR2	17	47
O=C(/C=C/[C@H]1CCCO1)N1CCCc2cc(Cl)ccc21	ZINC000819125355	CG	On-Demand	Anodyne	CNR1	52	33
O=C(/C=C/[C@H]1CCCO1)N1CCCc2cc(Cl)ccc21	ZINC000819125355	CG	On-Demand	Anodyne	AVPR2	17	47
O=C(/C=C/[C@@H]1CCCO1)N1CCCc2cc(Cl)ccc21	ZINC000819125358	CG	On-Demand	Anodyne	CNR1	52	33
O=C(/C=C/[C@@H]1CCCO1)N1CCCc2cc(Cl)ccc21	ZINC000819125358	CG	On-Demand	Anodyne	AVPR2	17	47
O=C(/C=C\[C@@H]1CCCO1)N1CCCc2cc(Cl)ccc21	ZINC000819125362	CG	On-Demand	Anodyne	CNR1	52	33
O=C(/C=C\[C@@H]1CCCO1)N1CCCc2cc(Cl)ccc21	ZINC000819125362	CG	On-Demand	Anodyne	AVPR2	17	47
CCCN(CC)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819125363	CF	On-Demand	Anodyne	ADRB1	44	47
CCCN(CC)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819125363	CF	On-Demand	Anodyne	ADRB3	61	47
CCCN(CC)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819125364	CF	On-Demand	Anodyne	ADRB1	44	47
CCCN(CC)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819125364	CF	On-Demand	Anodyne	ADRB3	61	47
COc1ccc(OC)c([C@H](O)CNCc2cc(N(C)C)nc3ccccc23)c1	ZINC000819125365	GG	On-Demand	Anodyne	METG	56	39
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(OCc2cccnc2)c1	ZINC000819125372	DG	On-Demand	Anodyne	CHRNA7	44	41
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(OCc2cccnc2)c1	ZINC000819125375	DG	On-Demand	Anodyne	CHRNA7	44	41
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(OCc2cccnc2)c1	ZINC000819125378	DG	On-Demand	Anodyne	CHRNA7	44	41
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(OCc2cccnc2)c1	ZINC000819125381	DG	On-Demand	Anodyne	CHRNA7	44	41
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCSCC3)cc2)c1	ZINC000819125384	GG	On-Demand	Clean	PTGIR	15	41
COc1ccc(OC2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1	ZINC000819125388	EF	On-Demand	Anodyne	PRSS2	76	33
COc1ccc(OC2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1	ZINC000819125388	EF	On-Demand	Anodyne	EPHX2	17	48
COc1ccc(OC2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1	ZINC000819125391	EF	On-Demand	Anodyne	PRSS2	76	33
COc1ccc(OC2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1	ZINC000819125391	EF	On-Demand	Anodyne	EPHX2	17	48
COc1ccc(OC2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1	ZINC000819125394	EF	On-Demand	Anodyne	PRSS2	76	33
COc1ccc(OC2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1	ZINC000819125394	EF	On-Demand	Anodyne	EPHX2	17	48
COc1ccc(OC2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1	ZINC000819125397	EF	On-Demand	Anodyne	PRSS2	76	33
COc1ccc(OC2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1	ZINC000819125397	EF	On-Demand	Anodyne	EPHX2	17	48
CN1CCCN(c2ccc(NC(=O)c3cc4c(cn3)OCCO4)cc2)CC1	ZINC000819125402	FE	On-Demand	Anodyne	HTR1B	18	45
CN1CCCN(c2ccc(NC(=O)c3cc4c(cn3)OCCO4)cc2)CC1	ZINC000819125402	FE	On-Demand	Anodyne	LCK	25	47
CN1CCCN(c2ccc(NC(=O)c3cc4c(cn3)OCCO4)cc2)CC1	ZINC000819125402	FE	On-Demand	Anodyne	PRNP	41	46
CN1CCCN(c2ccc(NC(=O)c3cc4c(cn3)OCCO4)cc2)CC1	ZINC000819125402	FE	On-Demand	Anodyne	FLT3	31	41
CN1CCCN(c2ccc(NC(=O)c3cc4c(cn3)OCCO4)cc2)CC1	ZINC000819125402	FE	On-Demand	Anodyne	CSF1R	27	41
CN1CCCN(c2ccc(NC(=O)c3cc4c(cn3)OCCO4)cc2)CC1	ZINC000819125402	FE	On-Demand	Anodyne	AURKA	17	41
COC(=O)c1ccsc1N1CC[C@@H](NC[C@H](O)c2ccccc2)C1=O	ZINC000819125409	FD	On-Demand	Anodyne	ADRB3	44	38
COC(=O)c1ccsc1N1CC[C@H](NC[C@H](O)c2ccccc2)C1=O	ZINC000819125413	FD	On-Demand	Anodyne	ADRB3	44	38
COC(=O)c1ccsc1N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1=O	ZINC000819125416	FD	On-Demand	Anodyne	ADRB3	44	38
COC(=O)c1ccsc1N1CC[C@H](NC[C@@H](O)c2ccccc2)C1=O	ZINC000819125419	FD	On-Demand	Anodyne	ADRB3	44	38
C=C(C)C(C)(C)C(=O)NCc1cccc(OC(C)C)c1	ZINC000819125471	CH	On-Demand	Mild	AMP1_PLAFQ	18	41
C=C(C)C(C)(C)C(=O)NCc1cccc(OC(C)C)c1	ZINC000819125471	CH	On-Demand	Mild	PDS	57	37
COc1ccc(OC2CCN(C(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)CC2)cc1	ZINC000819125482	GF	On-Demand	Anodyne	HRH3	15	41
COc1ccc(OC2CCN(C(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)CC2)cc1	ZINC000819125482	GF	On-Demand	Anodyne	EPHX2	24	53
COc1ccc(OC2CCN(C(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)CC2)cc1	ZINC000819125482	GF	On-Demand	Anodyne	NPBWR1	63	34
CCOc1cc(NC(=O)C(F)=C2CCC2)ccc1OC	ZINC000819125485	CG	On-Demand	Anodyne	ENPP1	74	39
CCOc1cc(NC(=O)C(F)=C2CCC2)ccc1OC	ZINC000819125485	CG	On-Demand	Anodyne	KCNK3	36	41
CCOc1cc(NC(=O)C(F)=C2CCC2)ccc1OC	ZINC000819125485	CG	On-Demand	Anodyne	KCNK9	28	41
CCCn1cc(NC(=O)C[S@](=O)c2cccc(OC)c2)ccc1=O	ZINC000819125499	EE	On-Demand	Anodyne	MTNR1A	28	47
CCCn1cc(NC(=O)C[S@](=O)c2cccc(OC)c2)ccc1=O	ZINC000819125499	EE	On-Demand	Anodyne	MTNR1B	33	47
CCCn1cc(NC(=O)C[S@@](=O)c2cccc(OC)c2)ccc1=O	ZINC000819125501	EE	On-Demand	Anodyne	MTNR1A	28	47
CCCn1cc(NC(=O)C[S@@](=O)c2cccc(OC)c2)ccc1=O	ZINC000819125501	EE	On-Demand	Anodyne	MTNR1B	33	47
CC(C)(C)N1C[C@H](NC[C@@H](O)c2cccnc2)CC1=O	ZINC000819125520	CD	On-Demand	Anodyne	ADRB1	23	40
CC(C)(C)N1C[C@H](NC[C@@H](O)c2cccnc2)CC1=O	ZINC000819125520	CD	On-Demand	Anodyne	ADRB3	77	48
CC(C)(C)N1C[C@H](NC[C@H](O)c2cccnc2)CC1=O	ZINC000819125521	CD	On-Demand	Anodyne	ADRB1	23	40
CC(C)(C)N1C[C@H](NC[C@H](O)c2cccnc2)CC1=O	ZINC000819125521	CD	On-Demand	Anodyne	ADRB3	77	48
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819125522	FG	On-Demand	Anodyne	HTR1A	48	47
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819125522	FG	On-Demand	Anodyne	DRD2	62	41
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819125522	FG	On-Demand	Anodyne	DRD4	56	38
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819125522	FG	On-Demand	Anodyne	ACHE	39	46
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819125522	FG	On-Demand	Anodyne	HTR2A	39	49
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819125522	FG	On-Demand	Anodyne	DRD3	83	53
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819125522	FG	On-Demand	Anodyne	HTR7	33	47
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819125522	FG	On-Demand	Anodyne	SIGMAR1	65	47
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819125522	FG	On-Demand	Anodyne	BCHE	22	46
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819125522	FG	On-Demand	Anodyne	CCR3	18	44
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819125522	FG	On-Demand	Anodyne	CACNA1G	42	38
O=C(NCCCCN1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819125522	FG	On-Demand	Anodyne	NPFFR1	43	37
CC(C)(C)N1C[C@@H](NC[C@@H](O)c2cccnc2)CC1=O	ZINC000819125523	CD	On-Demand	Anodyne	ADRB1	23	40
CC(C)(C)N1C[C@@H](NC[C@@H](O)c2cccnc2)CC1=O	ZINC000819125523	CD	On-Demand	Anodyne	ADRB3	77	48
CC(C)(C)N1C[C@@H](NC[C@H](O)c2cccnc2)CC1=O	ZINC000819125524	CD	On-Demand	Anodyne	ADRB1	23	40
CC(C)(C)N1C[C@@H](NC[C@H](O)c2cccnc2)CC1=O	ZINC000819125524	CD	On-Demand	Anodyne	ADRB3	77	48
O=C(NC1CCN(Cc2ccncc2)CC1)C(F)=C1CCC1	ZINC000819125526	DF	On-Demand	Anodyne	DRD4	22	44
O=C(NC1CCN(Cc2ccncc2)CC1)C(F)=C1CCC1	ZINC000819125526	DF	On-Demand	Anodyne	SIGMAR1	28	47
O=C(NC1CCN(Cc2ccncc2)CC1)C(F)=C1CCC1	ZINC000819125526	DF	On-Demand	Anodyne	SSTR5	51	38
O=C(NC1CCN(Cc2ccncc2)CC1)C(F)=C1CCC1	ZINC000819125526	DF	On-Demand	Anodyne	MCHR1	41	40
O=C(NC1CCN(Cc2ccncc2)CC1)C(F)=C1CCC1	ZINC000819125526	DF	On-Demand	Anodyne	CACNA1G	17	40
CC[C@@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C1CCOCC1	ZINC000819125544	FF	On-Demand	Anodyne	GPR119	25	40
CC[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C1CCOCC1	ZINC000819125545	FF	On-Demand	Anodyne	GPR119	25	40
O=C(NCc1ccc(F)cc1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819125554	EG	On-Demand	Anodyne	EPHX2	20	40
O=C(NCc1ccc(F)cc1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819125554	EG	On-Demand	Anodyne	CACNA1G	44	44
Cc1ccc(NC(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1Cl	ZINC000819125559	GG	On-Demand	Anodyne	NPY2R	31	40
Cc1ccc(NC(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1Cl	ZINC000819125559	GG	On-Demand	Anodyne	CCR2	15	51
Cc1ccc(NC(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1Cl	ZINC000819125559	GG	On-Demand	Anodyne	EPHX2	26	46
Cc1ccc(NC(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1Cl	ZINC000819125560	GG	On-Demand	Anodyne	NPY2R	31	40
Cc1ccc(NC(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1Cl	ZINC000819125560	GG	On-Demand	Anodyne	CCR2	15	51
Cc1ccc(NC(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1Cl	ZINC000819125560	GG	On-Demand	Anodyne	EPHX2	26	46
Cc1ccc(NC(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1Cl	ZINC000819125561	GG	On-Demand	Anodyne	NPY2R	31	40
Cc1ccc(NC(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1Cl	ZINC000819125561	GG	On-Demand	Anodyne	CCR2	15	51
Cc1ccc(NC(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1Cl	ZINC000819125561	GG	On-Demand	Anodyne	EPHX2	26	46
Cc1ccc(NC(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1Cl	ZINC000819125562	GG	On-Demand	Anodyne	NPY2R	31	40
Cc1ccc(NC(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1Cl	ZINC000819125562	GG	On-Demand	Anodyne	CCR2	15	51
Cc1ccc(NC(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1Cl	ZINC000819125562	GG	On-Demand	Anodyne	EPHX2	26	46
Cc1cc(F)ccc1[C@@H](O)CNCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819125572	GG	On-Demand	Anodyne	GRIN2B	79	40
Cc1cc(F)ccc1[C@@H](O)CNCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819125572	GG	On-Demand	Anodyne	CCR3	92	49
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCN(C)CC3)cc2)c1	ZINC000819125581	GF	On-Demand	Anodyne	HTR1A	15	54
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCN(C)CC3)cc2)c1	ZINC000819125581	GF	On-Demand	Anodyne	HTR1D	27	40
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCN(C)CC3)cc2)c1	ZINC000819125581	GF	On-Demand	Anodyne	HTR1B	40	40
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCN(C)CC3)cc2)c1	ZINC000819125581	GF	On-Demand	Anodyne	LCK	20	43
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCN(C)CC3)cc2)c1	ZINC000819125581	GF	On-Demand	Anodyne	PRNP	39	45
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCN(C)CC3)cc2)c1	ZINC000819125581	GF	On-Demand	Anodyne	FLT3	19	41
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCN(C)CC3)cc2)c1	ZINC000819125581	GF	On-Demand	Anodyne	AURKA	16	40
O=C(Nc1cnn(C[C@H]2CCCO2)c1)C(F)=C1CCC1	ZINC000819125588	CE	On-Demand	Anodyne	PANC	52	34
O=C(Nc1cnn(C[C@@H]2CCCO2)c1)C(F)=C1CCC1	ZINC000819125591	CE	On-Demand	Anodyne	PANC	52	34
O=C(CNC[C@H](O)c1ccccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819125595	FF	On-Demand	Anodyne	GRIN2B	83	43
O=C(CNC[C@H](O)c1ccccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819125595	FF	On-Demand	Anodyne	SIGMAR1	29	41
O=C(CNC[C@H](O)c1ccccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819125595	FF	On-Demand	Anodyne	CCR3	50	48
O=C(CNC[C@@H](O)c1ccccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819125597	FF	On-Demand	Anodyne	GRIN2B	83	43
O=C(CNC[C@@H](O)c1ccccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819125597	FF	On-Demand	Anodyne	SIGMAR1	29	41
O=C(CNC[C@@H](O)c1ccccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819125597	FF	On-Demand	Anodyne	CCR3	50	48
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1C	ZINC000819125604	FH	On-Demand	Mild	PAPA1_CARPA	54	45
CC(C)(C)NC(=O)c1cccc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819125615	GG	On-Demand	Anodyne	KCNK3	82	36
CC(C)(C)NC(=O)c1cccc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819125615	GG	On-Demand	Anodyne	KCNK9	45	35
CCO[C@@H](CCNC[C@@H](O)c1ccccc1)C(C)C	ZINC000819125627	CF	On-Demand	Anodyne	ADRB2	33	48
CCO[C@@H](CCNC[C@@H](O)c1ccccc1)C(C)C	ZINC000819125627	CF	On-Demand	Anodyne	ADRB1	41	41
CCO[C@@H](CCNC[C@@H](O)c1ccccc1)C(C)C	ZINC000819125627	CF	On-Demand	Anodyne	ADRB3	61	49
CCO[C@@H](CCNC[C@@H](O)c1ccccc1)C(C)C	ZINC000819125627	CF	On-Demand	Anodyne	AOC3	15	43
CCO[C@@H](CCNC[C@H](O)c1ccccc1)C(C)C	ZINC000819125630	CF	On-Demand	Anodyne	ADRB2	33	48
CCO[C@@H](CCNC[C@H](O)c1ccccc1)C(C)C	ZINC000819125630	CF	On-Demand	Anodyne	ADRB1	41	41
CCO[C@@H](CCNC[C@H](O)c1ccccc1)C(C)C	ZINC000819125630	CF	On-Demand	Anodyne	ADRB3	61	49
CCO[C@@H](CCNC[C@H](O)c1ccccc1)C(C)C	ZINC000819125630	CF	On-Demand	Anodyne	AOC3	15	43
O=C(NC1CCN(Cc2ccccn2)CC1)C(F)=C1CCC1	ZINC000819125660	DF	On-Demand	Anodyne	DRD4	15	57
O=C(NC1CCN(Cc2ccccn2)CC1)C(F)=C1CCC1	ZINC000819125660	DF	On-Demand	Anodyne	SIGMAR1	18	43
O=C(NC1CCN(Cc2ccccn2)CC1)C(F)=C1CCC1	ZINC000819125660	DF	On-Demand	Anodyne	SSTR5	42	34
CN1CCCN(c2ccc(NC(=O)Cc3ccc(-n4cnnc4)cc3)cc2)CC1	ZINC000819125677	GF	On-Demand	Anodyne	HTR1D	26	44
CN1CCCN(c2ccc(NC(=O)Cc3ccc(-n4cnnc4)cc3)cc2)CC1	ZINC000819125677	GF	On-Demand	Anodyne	HTR1B	30	42
CN1CCCN(c2ccc(NC(=O)Cc3ccc(-n4cnnc4)cc3)cc2)CC1	ZINC000819125677	GF	On-Demand	Anodyne	LCK	17	40
CN1CCCN(c2ccc(NC(=O)Cc3ccc(-n4cnnc4)cc3)cc2)CC1	ZINC000819125677	GF	On-Demand	Anodyne	PRNP	39	43
O=C(CNC[C@@H](O)c1cc2ccccc2o1)N1CCC(Cc2ccccc2)CC1	ZINC000819125687	GH	On-Demand	Anodyne	GRIN2B	74	43
O=C(CNC[C@@H](O)c1cc2ccccc2o1)N1CCC(Cc2ccccc2)CC1	ZINC000819125687	GH	On-Demand	Anodyne	CCR3	30	40
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccccn2)CC1	ZINC000819125691	DD	On-Demand	Anodyne	MCHR1	15	40
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccccn2)CC1	ZINC000819125693	DD	On-Demand	Anodyne	MCHR1	15	40
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccccn2)CC1	ZINC000819125695	DD	On-Demand	Anodyne	MCHR1	15	40
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccccn2)CC1	ZINC000819125697	DD	On-Demand	Anodyne	MCHR1	15	40
CSc1ccc(F)cc1CNC[C@H](O)c1cccnc1	ZINC000819125698	CF	On-Demand	Anodyne	ADRB2	22	44
CSc1ccc(F)cc1CNC[C@H](O)c1cccnc1	ZINC000819125698	CF	On-Demand	Anodyne	ADRB1	23	44
CSc1ccc(F)cc1CNC[C@H](O)c1cccnc1	ZINC000819125698	CF	On-Demand	Anodyne	ADRB3	89	44
CSc1ccc(F)cc1CNC[C@@H](O)c1cccnc1	ZINC000819125699	CF	On-Demand	Anodyne	ADRB2	22	44
CSc1ccc(F)cc1CNC[C@@H](O)c1cccnc1	ZINC000819125699	CF	On-Demand	Anodyne	ADRB1	23	44
CSc1ccc(F)cc1CNC[C@@H](O)c1cccnc1	ZINC000819125699	CF	On-Demand	Anodyne	ADRB3	89	44
Cc1cc(F)ccc1[C@@H](O)CNCc1cc(N(C)C)nc2ccccc12	ZINC000819125704	FH	On-Demand	Anodyne	METG	44	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1csc3ccccc13)C2	ZINC000819125707	FG	On-Demand	Anodyne	MTNR1A	20	54
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1csc3ccccc13)C2	ZINC000819125709	FG	On-Demand	Anodyne	MTNR1A	20	54
COC(=O)c1ccsc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819125726	GF	On-Demand	Anodyne	ADRB1	39	43
COC(=O)c1ccsc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819125726	GF	On-Demand	Anodyne	ADRB3	65	44
COC(=O)c1ccsc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819125726	GF	On-Demand	Anodyne	CYP3A4	48	36
COC(=O)c1ccsc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819125728	GF	On-Demand	Anodyne	ADRB1	39	43
COC(=O)c1ccsc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819125728	GF	On-Demand	Anodyne	ADRB3	65	44
COC(=O)c1ccsc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819125728	GF	On-Demand	Anodyne	CYP3A4	48	36
COC(=O)c1ccsc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819125730	GF	On-Demand	Anodyne	ADRB1	39	43
COC(=O)c1ccsc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819125730	GF	On-Demand	Anodyne	ADRB3	65	44
COC(=O)c1ccsc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819125730	GF	On-Demand	Anodyne	CYP3A4	48	36
COC(=O)c1ccsc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819125732	GF	On-Demand	Anodyne	ADRB1	39	43
COC(=O)c1ccsc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819125732	GF	On-Demand	Anodyne	ADRB3	65	44
COC(=O)c1ccsc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819125732	GF	On-Demand	Anodyne	CYP3A4	48	36
CCn1cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1=O	ZINC000819125741	FE	On-Demand	Mild	PAPA1_CARPA	43	46
CCn1cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1=O	ZINC000819125741	FE	On-Demand	Mild	CTSK	17	41
CCn1cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1=O	ZINC000819125742	FE	On-Demand	Mild	PAPA1_CARPA	43	46
CCn1cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1=O	ZINC000819125742	FE	On-Demand	Mild	CTSK	17	41
O=C(CC1CC1)NNC(=O)c1cc(Oc2ccccc2)ccn1	ZINC000819125767	DE	On-Demand	Reactive	RAF1	63	37
COC(=O)c1ccc(CCNC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)cc1	ZINC000819125768	JG	On-Demand	Anodyne	CA2	17	48
COC(=O)c1ccc(CCNC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)cc1	ZINC000819125768	JG	On-Demand	Anodyne	CA1	16	48
COC(=O)c1ccc(CCNC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)cc1	ZINC000819125768	JG	On-Demand	Anodyne	TGM2	36	46
COC(=O)c1ccc(CCNC(=O)c2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)cc1	ZINC000819125768	JG	On-Demand	Anodyne	NAMPT	31	42
O=C(CC1CC1)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819125778	GC	On-Demand	Reactive	CNR2	21	50
O=C(CC1CC1)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819125778	GC	On-Demand	Reactive	NR1H4	16	41
CC(C)c1onc(-c2c(Cl)cccc2Cl)c1C(=O)NNC(=O)CC1CC1	ZINC000819125783	GI	On-Demand	Reactive	NR1H4	84	42
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000819125817	IE	On-Demand	Reactive	Q9NAW4_PLAFA	28	44
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2c(Cl)cccc2Cl)CC1	ZINC000819125822	IE	On-Demand	Reactive	EPHX2	43	52
O=C(CC1CC1)NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	ZINC000819125823	FC	On-Demand	Reactive	CCR8	68	34
O=C(Cc1ccc(NC(=O)c2ccc(Br)cc2)cc1)NNC(=O)CC1CC1	ZINC000819125826	IG	On-Demand	Reactive	TRAR	17	40
O=C(CC1CC1)NNC(=O)c1cccnc1N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819125827	IF	On-Demand	Reactive	HTR1A	19	41
O=C(CC1CC1)NNC(=O)c1cccnc1N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819125827	IF	On-Demand	Reactive	DRD2	23	41
O=C(CC1CC1)NNC(=O)c1cccnc1N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819125827	IF	On-Demand	Reactive	DRD4	36	49
O=C(CC1CC1)NNC(=O)c1cccnc1N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819125827	IF	On-Demand	Reactive	ACHE	15	40
O=C(CC1CC1)NNC(=O)c1cccnc1N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819125827	IF	On-Demand	Reactive	HTR2A	15	42
O=C(CC1CC1)NNC(=O)c1cccnc1N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819125827	IF	On-Demand	Reactive	SIGMAR1	19	45
O=C(CC1CC1)NNC(=O)c1cccnc1N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819125827	IF	On-Demand	Reactive	CCR3	15	40
O=C(CC1CC1)NNC(=O)c1cccnc1N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819125827	IF	On-Demand	Reactive	FAAH	18	43
O=C(CC1CC1)NNC(=O)c1cccnc1N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819125827	IF	On-Demand	Reactive	CXCR3	29	40
O=C(CC1CC1)NNC(=O)c1cccnc1N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819125827	IF	On-Demand	Reactive	MCHR1	19	40
O=C(CC1CC1)NNC(=O)CC12C[C@H]3C[C@@H](CC(F)(C3)C1)C2	ZINC000819125852	DF	On-Demand	Reactive	BOTA	30	41
O=C(CC1CC1)NNC(=O)c1ccc(Oc2cccnc2)cc1	ZINC000819125853	DE	On-Demand	Reactive	CHRNA7	30	40
O=C(CC1CC1)NNC(=O)c1ccn(-c2ccc(Cl)c(Cl)c2)n1	ZINC000819125855	FF	On-Demand	Reactive	RPA1	51	33
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1	ZINC000819125868	GF	On-Demand	Reactive	LGMN	43	37
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1	ZINC000819125869	GF	On-Demand	Reactive	LGMN	43	37
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1	ZINC000819125870	GF	On-Demand	Reactive	LGMN	43	37
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1	ZINC000819125871	GF	On-Demand	Reactive	LGMN	43	37
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1	ZINC000819125879	HD	On-Demand	Reactive	EPHX2	37	46
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1	ZINC000819125879	HD	On-Demand	Reactive	AKR1C3	43	34
CCCCCCC(=O)NNC(=O)CC1CC1	ZINC000819125889	BD	On-Demand	Reactive	LUXR	35	44
CCCCCCC(=O)NNC(=O)CC1CC1	ZINC000819125889	BD	On-Demand	Reactive	TRAR	15	44
CCCCCCC(=O)NNC(=O)CC1CC1	ZINC000819125889	BD	On-Demand	Reactive	LASR	65	44
CCCCCCC(=O)NNC(=O)CC1CC1	ZINC000819125889	BD	On-Demand	Reactive	NOD1	49	38
CCCCCCC(=O)NNC(=O)CC1CC1	ZINC000819125889	BD	On-Demand	Reactive	CQSS	59	36
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	ZINC000819125900	FC	On-Demand	Reactive	ACHE	22	42
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	ZINC000819125900	FC	On-Demand	Reactive	CHRM3	19	40
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	ZINC000819125900	FC	On-Demand	Reactive	SIGMAR1	24	42
O=C(CC1CC1)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	ZINC000819125900	FC	On-Demand	Reactive	CCR3	15	40
O=C(CCc1cccc(Br)c1)NNC(=O)CC1CC1	ZINC000819125906	EE	On-Demand	Reactive	LUXR	34	55
CCC(CC)(C(=O)NNC(=O)CC1CC1)c1ccc(Cl)cc1	ZINC000819125908	DG	On-Demand	Reactive	CCR1	15	41
O=C(CC1CC1)NNC(=O)c1sccc1S(=O)(=O)NC1CCCCCC1	ZINC000819125914	GE	On-Demand	Reactive	CCR8	50	38
O=C(COCCNC(=O)c1ccccc1)NNC(=O)CC1CC1	ZINC000819125936	DC	On-Demand	Reactive	GRIN2B	21	45
CCO[C@@H](CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)C(C)C	ZINC000819125939	EE	On-Demand	Anodyne	ADRB2	19	41
CCO[C@@H](CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)C(C)C	ZINC000819125939	EE	On-Demand	Anodyne	ADRB3	47	38
CCO[C@@H](CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)C(C)C	ZINC000819125942	EE	On-Demand	Anodyne	ADRB2	19	41
CCO[C@@H](CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)C(C)C	ZINC000819125942	EE	On-Demand	Anodyne	ADRB3	47	38
N#Cc1cccc(NC(=O)CSc2ccccc2C(=O)NNC(=O)CC2CC2)c1	ZINC000819125949	HF	On-Demand	Reactive	CCR3	16	42
O=C(CCCn1cncn1)NNC(=O)CC1CC1	ZINC000819125951	CC	On-Demand	Reactive	HIS3	51	38
CSc1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819125968	CD	On-Demand	Reactive	CCR2	17	40
CCO[C@@H](CCNC[C@@H](O)c1cccc(Cl)c1)C(C)C	ZINC000819125997	CG	On-Demand	Anodyne	ADRB2	44	41
CCO[C@@H](CCNC[C@@H](O)c1cccc(Cl)c1)C(C)C	ZINC000819125997	CG	On-Demand	Anodyne	ADRB1	56	49
CCO[C@@H](CCNC[C@@H](O)c1cccc(Cl)c1)C(C)C	ZINC000819125997	CG	On-Demand	Anodyne	ADRB3	71	49
CCO[C@@H](CCNC[C@H](O)c1cccc(Cl)c1)C(C)C	ZINC000819125998	CG	On-Demand	Anodyne	ADRB2	44	41
CCO[C@@H](CCNC[C@H](O)c1cccc(Cl)c1)C(C)C	ZINC000819125998	CG	On-Demand	Anodyne	ADRB1	56	49
CCO[C@@H](CCNC[C@H](O)c1cccc(Cl)c1)C(C)C	ZINC000819125998	CG	On-Demand	Anodyne	ADRB3	71	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000819126015	GE	On-Demand	Anodyne	HRH2	22	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000819126015	GE	On-Demand	Anodyne	CHRM3	18	42
COC(=O)c1ccc(CCNC(=O)c2cc(Cl)nc3ccccc23)cc1	ZINC000819126029	FH	On-Demand	Anodyne	BCHE	59	35
COC(=O)c1ccc(CCNC(=O)c2cc(Cl)nc3ccccc23)cc1	ZINC000819126029	FH	On-Demand	Anodyne	ACACB	15	42
COC(=O)c1ccc(CCNC(=O)c2cc(Cl)nc3ccccc23)cc1	ZINC000819126029	FH	On-Demand	Anodyne	TACR3	24	51
COC(=O)c1ccc(CCNC(=O)c2cc(Cl)nc3ccccc23)cc1	ZINC000819126029	FH	On-Demand	Anodyne	SLC6A5	29	42
COC(=O)c1ccc(CCNC(=O)c2cc(Cl)nc3ccccc23)cc1	ZINC000819126029	FH	On-Demand	Anodyne	ABCG2	33	42
CCO[C@@H](CCNC[C@@H](O)c1ccc(Cl)c(F)c1)C(C)C	ZINC000819126030	DH	On-Demand	Anodyne	ADRB2	20	42
CCO[C@@H](CCNC[C@@H](O)c1ccc(Cl)c(F)c1)C(C)C	ZINC000819126030	DH	On-Demand	Anodyne	ADRB1	20	42
CCO[C@@H](CCNC[C@H](O)c1ccc(Cl)c(F)c1)C(C)C	ZINC000819126031	DH	On-Demand	Anodyne	ADRB2	20	42
CCO[C@@H](CCNC[C@H](O)c1ccc(Cl)c(F)c1)C(C)C	ZINC000819126031	DH	On-Demand	Anodyne	ADRB1	20	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(Cc3cccc(F)c3)CC1)C2	ZINC000819126044	GG	On-Demand	Anodyne	GRIN2B	42	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(Cc3cccc(F)c3)CC1)C2	ZINC000819126044	GG	On-Demand	Anodyne	CCR3	47	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(Cc3cccc(F)c3)CC1)C2	ZINC000819126045	GG	On-Demand	Anodyne	GRIN2B	42	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(Cc3cccc(F)c3)CC1)C2	ZINC000819126045	GG	On-Demand	Anodyne	CCR3	47	40
CCCOc1ccccc1Oc1ncccc1CNC(=O)C(F)=C1CCC1	ZINC000819126064	FJ	On-Demand	Anodyne	P2RY1	26	40
O=C(CC1CC1)NNC(=O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O	ZINC000819126067	GD	On-Demand	Reactive	MAOA	20	60
O=C(CC1CC1)NNC(=O)[C@H](O)Cc1cccc(C(F)(F)F)c1	ZINC000819126069	ED	On-Demand	Reactive	CCR2	76	40
O=C(CC1CC1)NNC(=O)[C@@H](O)Cc1cccc(C(F)(F)F)c1	ZINC000819126071	ED	On-Demand	Reactive	CCR2	76	40
COC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819126092	GG	On-Demand	Anodyne	ADRB3	31	42
COC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819126093	GG	On-Demand	Anodyne	ADRB3	31	42
COC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819126096	GG	On-Demand	Anodyne	ADRB3	31	42
COC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819126098	GG	On-Demand	Anodyne	ADRB3	31	42
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819126104	FD	On-Demand	Reactive	CAPN1	18	43
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819126104	FD	On-Demand	Reactive	EPHX2	43	59
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819126104	FD	On-Demand	Reactive	TGM2	82	41
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819126104	FD	On-Demand	Reactive	F13A1	86	41
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819126104	FD	On-Demand	Reactive	AKR1C3	40	36
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819126104	FD	On-Demand	Reactive	SFRP1	46	40
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819126104	FD	On-Demand	Reactive	NAMPT	31	40
O=C(CC1CC1)NNC(=O)c1cc(-c2cccc(Cl)c2)no1	ZINC000819126107	DF	On-Demand	Reactive	VCP	19	42
COC[C@H](Cc1ccccc1)NCCC(=O)N(C)OC	ZINC000819126160	CD	On-Demand	Anodyne	MME	54	42
COC[C@H](Cc1ccccc1)NCCC(=O)N(C)OC	ZINC000819126160	CD	On-Demand	Anodyne	PAPA1_CARPA	40	33
COC[C@@H](Cc1ccccc1)NCCC(=O)N(C)OC	ZINC000819126165	CD	On-Demand	Anodyne	MME	54	42
COC[C@@H](Cc1ccccc1)NCCC(=O)N(C)OC	ZINC000819126165	CD	On-Demand	Anodyne	PAPA1_CARPA	40	33
CN(C)[C@@H](CNC[C@H](O)c1ccccc1)c1ccc(Cl)cc1	ZINC000819126178	DG	On-Demand	Anodyne	AOC3	28	46
CN(C)[C@@H](CNC[C@@H](O)c1ccccc1)c1ccc(Cl)cc1	ZINC000819126181	DG	On-Demand	Anodyne	AOC3	28	46
O=C(CCCC(=O)c1ccc(Br)cc1)NNC(=O)CC1CC1	ZINC000819126185	FF	On-Demand	Reactive	HDAC8	34	52
COc1ccc2c(-c3ccccc3)c(C(=O)NNC(=O)CC3CC3)oc2c1	ZINC000819126190	FH	On-Demand	Reactive	MTNR1A	35	40
COc1ccc2c(-c3ccccc3)c(C(=O)NNC(=O)CC3CC3)oc2c1	ZINC000819126190	FH	On-Demand	Reactive	MTNR1B	32	40
COC[C@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126193	GF	On-Demand	Anodyne	PGC	50	34
COC[C@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126193	GF	On-Demand	Anodyne	AMY2	44	31
COC[C@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126193	GF	On-Demand	Anodyne	REN	73	38
COC[C@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126193	GF	On-Demand	Anodyne	CCR8	27	40
COC[C@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126193	GF	On-Demand	Anodyne	GPR119	39	47
COC[C@@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126197	GF	On-Demand	Anodyne	PGC	50	34
COC[C@@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126197	GF	On-Demand	Anodyne	AMY2	44	31
COC[C@@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126197	GF	On-Demand	Anodyne	REN	73	38
COC[C@@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126197	GF	On-Demand	Anodyne	CCR8	27	40
COC[C@@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126197	GF	On-Demand	Anodyne	GPR119	39	47
COC[C@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126200	GF	On-Demand	Anodyne	PGC	50	34
COC[C@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126200	GF	On-Demand	Anodyne	AMY2	44	31
COC[C@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126200	GF	On-Demand	Anodyne	REN	73	38
COC[C@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126200	GF	On-Demand	Anodyne	CCR8	27	40
COC[C@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126200	GF	On-Demand	Anodyne	GPR119	39	47
COC[C@@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126205	GF	On-Demand	Anodyne	PGC	50	34
COC[C@@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126205	GF	On-Demand	Anodyne	AMY2	44	31
COC[C@@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126205	GF	On-Demand	Anodyne	REN	73	38
COC[C@@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126205	GF	On-Demand	Anodyne	CCR8	27	40
COC[C@@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819126205	GF	On-Demand	Anodyne	GPR119	39	47
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2cccs2)c1	ZINC000819126225	EF	On-Demand	Reactive	NOS1	40	42
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2cccs2)c1	ZINC000819126225	EF	On-Demand	Reactive	KCNK3	91	56
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2cccs2)c1	ZINC000819126225	EF	On-Demand	Reactive	KCNK9	48	56
O=C(CNC[C@H](O)c1ccc(F)cn1)N1CCC(Cc2ccccc2)CC1	ZINC000819126243	FE	On-Demand	Anodyne	GRIN2B	79	40
O=C(CNC[C@H](O)c1ccc(F)cn1)N1CCC(Cc2ccccc2)CC1	ZINC000819126243	FE	On-Demand	Anodyne	CCR3	51	43
O=C(CNC[C@@H](O)c1ccc(F)cn1)N1CCC(Cc2ccccc2)CC1	ZINC000819126245	FE	On-Demand	Anodyne	GRIN2B	79	40
O=C(CNC[C@@H](O)c1ccc(F)cn1)N1CCC(Cc2ccccc2)CC1	ZINC000819126245	FE	On-Demand	Anodyne	CCR3	51	43
CCCCN(CC)c1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126246	DF	On-Demand	Reactive	ESRRG	20	43
O=C(CC1CC1)NNC(=O)c1nc(-c2ccccc2)n(-c2cccc(C(F)(F)F)c2)n1	ZINC000819126249	IH	On-Demand	Reactive	CCR2	63	37
O=C(CNC[C@H](O)c1ccc(Cl)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819126250	GG	On-Demand	Anodyne	SLC6A3	21	44
O=C(CNC[C@H](O)c1ccc(Cl)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819126250	GG	On-Demand	Anodyne	GRIN2B	76	48
O=C(CNC[C@H](O)c1ccc(Cl)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819126250	GG	On-Demand	Anodyne	ADRB3	40	38
O=C(CNC[C@H](O)c1ccc(Cl)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819126250	GG	On-Demand	Anodyne	SIGMAR1	25	44
O=C(CNC[C@H](O)c1ccc(Cl)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819126250	GG	On-Demand	Anodyne	CCR3	33	48
O=C(CNC[C@H](O)c1ccc(Cl)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819126250	GG	On-Demand	Anodyne	C3AR1	36	41
O=C(CNC[C@H](O)c1ccc(Cl)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000819126250	GG	On-Demand	Anodyne	GRIN2C	21	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CC(=O)N(C(C)(C)C)C2)CC1	ZINC000819126273	GD	On-Demand	Anodyne	GPR119	29	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CC(=O)N(C(C)(C)C)C2)CC1	ZINC000819126275	GD	On-Demand	Anodyne	GPR119	29	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CC(=O)N(C(C)(C)C)C2)CC1	ZINC000819126277	GD	On-Demand	Anodyne	GPR119	29	44
CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)CC1CC1)n2C	ZINC000819126278	HC	On-Demand	Reactive	CNR2	16	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CC(=O)N(C(C)(C)C)C2)CC1	ZINC000819126279	GD	On-Demand	Anodyne	GPR119	29	44
O=C(COc1ccc2c(c1)CCC(=O)N2)NNC(=O)CC1CC1	ZINC000819126280	DC	On-Demand	Reactive	GRIN2B	15	48
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)NNC(=O)CC1CC1)=NO2	ZINC000819126283	GD	On-Demand	Reactive	GPR119	34	53
COC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819126288	EE	On-Demand	Bother	ADRB1	31	49
COC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819126288	EE	On-Demand	Bother	CACNA1C	50	41
COC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819126288	EE	On-Demand	Bother	ADRB3	55	49
COC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819126288	EE	On-Demand	Bother	CACNA1D	76	41
COC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819126290	EE	On-Demand	Bother	ADRB1	31	49
COC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819126290	EE	On-Demand	Bother	CACNA1C	50	41
COC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819126290	EE	On-Demand	Bother	ADRB3	55	49
COC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819126290	EE	On-Demand	Bother	CACNA1D	76	41
COC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819126292	EE	On-Demand	Bother	ADRB1	31	49
COC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819126292	EE	On-Demand	Bother	CACNA1C	50	41
COC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819126292	EE	On-Demand	Bother	ADRB3	55	49
COC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819126292	EE	On-Demand	Bother	CACNA1D	76	41
COC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819126293	EE	On-Demand	Bother	ADRB1	31	49
COC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819126293	EE	On-Demand	Bother	CACNA1C	50	41
COC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819126293	EE	On-Demand	Bother	ADRB3	55	49
COC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819126293	EE	On-Demand	Bother	CACNA1D	76	41
N#Cc1ccccc1Oc1ccc(C(=O)NNC(=O)CC2CC2)cc1Cl	ZINC000819126295	FH	On-Demand	Reactive	EZH2	65	56
O=C(CC1CC1)NNC(=O)c1ccc(-c2cccc3cccnc23)cc1	ZINC000819126299	EG	On-Demand	Reactive	HCRTR1	16	41
O=C(CC1CC1)NNC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccc(Cl)cc1	ZINC000819126303	HH	On-Demand	Reactive	DRD4	32	40
O=C(CC1CC1)NNC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccc(Cl)cc1	ZINC000819126303	HH	On-Demand	Reactive	SLC6A4	18	48
O=C(CC1CC1)NNC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccc(Cl)cc1	ZINC000819126303	HH	On-Demand	Reactive	SLC6A3	35	48
O=C(CC1CC1)NNC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccc(Cl)cc1	ZINC000819126303	HH	On-Demand	Reactive	MC4R	22	49
O=C(CC1CC1)NNC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H]1c1ccc(Cl)cc1	ZINC000819126303	HH	On-Demand	Reactive	SIGMAR1	31	45
CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)CC2CC2)c1	ZINC000819126307	FC	On-Demand	Reactive	ST14	51	33
O=C(COc1ccc(-c2ccccc2)cc1Cl)NNC(=O)CC1CC1	ZINC000819126310	FG	On-Demand	Reactive	PTGDR2	16	40
O=C(COc1ccc(-c2ccccc2)cc1Cl)NNC(=O)CC1CC1	ZINC000819126310	FG	On-Demand	Reactive	VCP	52	39
O=C(CC1CC1)NNC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1	ZINC000819126311	GG	On-Demand	Reactive	CCR2	63	37
COc1cccc([C@H]2C[C@@H]2C(=O)NNC(=O)CC2CC2)c1	ZINC000819126316	CD	On-Demand	Reactive	MTNR1A	39	40
COc1cccc([C@H]2C[C@@H]2C(=O)NNC(=O)CC2CC2)c1	ZINC000819126316	CD	On-Demand	Reactive	MTNR1B	36	40
COc1cccc([C@H]2C[C@H]2C(=O)NNC(=O)CC2CC2)c1	ZINC000819126318	CD	On-Demand	Reactive	MTNR1A	39	40
COc1cccc([C@H]2C[C@H]2C(=O)NNC(=O)CC2CC2)c1	ZINC000819126318	CD	On-Demand	Reactive	MTNR1B	36	40
C[C@H](CCNC[C@@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819126327	EH	On-Demand	Anodyne	ADRB2	30	50
C[C@H](CCNC[C@@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819126327	EH	On-Demand	Anodyne	ADRB1	36	45
C[C@H](CCNC[C@@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819126327	EH	On-Demand	Anodyne	ADRB3	114	50
C[C@H](CCNC[C@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819126328	EH	On-Demand	Anodyne	ADRB2	30	50
C[C@H](CCNC[C@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819126328	EH	On-Demand	Anodyne	ADRB1	36	45
C[C@H](CCNC[C@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819126328	EH	On-Demand	Anodyne	ADRB3	114	50
C[C@@H](CCNC[C@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819126329	EH	On-Demand	Anodyne	ADRB2	30	50
C[C@@H](CCNC[C@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819126329	EH	On-Demand	Anodyne	ADRB1	36	45
C[C@@H](CCNC[C@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819126329	EH	On-Demand	Anodyne	ADRB3	114	50
C[C@@H](CCNC[C@@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819126330	EH	On-Demand	Anodyne	ADRB2	30	50
C[C@@H](CCNC[C@@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819126330	EH	On-Demand	Anodyne	ADRB1	36	45
C[C@@H](CCNC[C@@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819126330	EH	On-Demand	Anodyne	ADRB3	114	50
O=C(NCc1cccc(N2CCOC2=O)c1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819126347	GH	On-Demand	Anodyne	P2RX7	15	40
CCOc1ccccc1Oc1ccc(CNC(=O)C(F)=C2CCC2)cn1	ZINC000819126355	FI	On-Demand	Anodyne	HCN1	44	32
CCOc1ccccc1Oc1ccc(CNC(=O)C(F)=C2CCC2)cn1	ZINC000819126355	FI	On-Demand	Anodyne	HCN4	40	31
COc1ccc(OC2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819126366	DG	On-Demand	Anodyne	CHRM2	45	36
COc1ccc(OC2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819126366	DG	On-Demand	Anodyne	PRSS2	57	33
COc1ccc(OC2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819126366	DG	On-Demand	Anodyne	HRH3	30	40
COc1ccc(OC2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819126366	DG	On-Demand	Anodyne	EPHX2	18	47
C[C@@H](CCNC[C@H](O)c1cccc([N+](=O)[O-])c1)N(C)Cc1ccccc1	ZINC000819126397	FG	On-Demand	Bother	ADRB3	58	38
C[C@@H](CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1)N(C)Cc1ccccc1	ZINC000819126398	FG	On-Demand	Bother	ADRB3	58	38
C[C@H](CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1)N(C)Cc1ccccc1	ZINC000819126399	FG	On-Demand	Bother	ADRB3	58	38
C[C@H](CCNC[C@H](O)c1cccc([N+](=O)[O-])c1)N(C)Cc1ccccc1	ZINC000819126400	FG	On-Demand	Bother	ADRB3	58	38
COC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819126401	FD	On-Demand	Anodyne	ADRB1	24	40
COC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819126401	FD	On-Demand	Anodyne	ADRB3	52	52
COC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819126402	FD	On-Demand	Anodyne	ADRB1	24	40
COC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819126402	FD	On-Demand	Anodyne	ADRB3	52	52
COC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819126403	FD	On-Demand	Anodyne	ADRB1	24	40
COC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819126403	FD	On-Demand	Anodyne	ADRB3	52	52
COC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819126404	FD	On-Demand	Anodyne	ADRB1	24	40
COC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819126404	FD	On-Demand	Anodyne	ADRB3	52	52
O=C(NCCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819126405	EG	On-Demand	Anodyne	HTR1A	115	63
O=C(NCCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819126405	EG	On-Demand	Anodyne	DRD2	92	52
O=C(NCCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819126405	EG	On-Demand	Anodyne	DRD1	21	42
O=C(NCCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819126405	EG	On-Demand	Anodyne	DRD4	61	47
O=C(NCCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819126405	EG	On-Demand	Anodyne	ADRA1D	36	51
O=C(NCCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819126405	EG	On-Demand	Anodyne	HTR2A	80	55
O=C(NCCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819126405	EG	On-Demand	Anodyne	HTR2C	41	52
O=C(NCCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819126405	EG	On-Demand	Anodyne	SLC6A4	18	44
O=C(NCCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819126405	EG	On-Demand	Anodyne	ADRA1A	52	51
O=C(NCCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819126405	EG	On-Demand	Anodyne	ADRA1B	31	51
O=C(NCCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819126405	EG	On-Demand	Anodyne	DRD3	117	55
O=C(NCCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819126405	EG	On-Demand	Anodyne	DRD5	18	42
O=C(NCCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819126405	EG	On-Demand	Anodyne	HTR7	123	48
O=C(NCCCCN1CCN(c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819126405	EG	On-Demand	Anodyne	SIGMAR1	19	47
CC(=O)Nc1cccc(CC(=O)N2CCCc3cc(C(C)C)ccc32)c1	ZINC000819126411	FI	On-Demand	Anodyne	EIF2AK3	56	36
CCOc1ccccc1C(=O)N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819126434	EF	On-Demand	Anodyne	HCN1	74	41
CCOc1ccccc1C(=O)N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819126434	EF	On-Demand	Anodyne	HCN4	59	40
CC(C)(C)OC(=O)N1CCC(OCC(=O)NNC(=O)CC2CC2)CC1	ZINC000819126443	FD	On-Demand	Reactive	GPR119	48	46
O=C(CC12CC3CC(CC(C3)C1)C2)NCC(=O)NNC(=O)CC1CC1	ZINC000819126444	ED	On-Demand	Reactive	BOTA	29	50
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1	ZINC000819126445	HD	On-Demand	Reactive	EPHX2	42	47
O=C(CC1CC1)NNC(=O)c1cncc(-c2ccc(Cl)cc2)c1	ZINC000819126472	EF	On-Demand	Reactive	SCN2A	23	52
O=C(CC1CC1)NNC(=O)c1cncc(-c2ccc(Cl)cc2)c1	ZINC000819126472	EF	On-Demand	Reactive	SCN10A	67	53
Cc1cc(OCC(=O)NNC(=O)CC2CC2)ccc1C(C)C	ZINC000819126474	DE	On-Demand	Reactive	THRA	37	40
Cc1cc(OCC(=O)NNC(=O)CC2CC2)ccc1C(C)C	ZINC000819126474	DE	On-Demand	Reactive	THRB	38	40
COC(=O)c1ccc(CCNC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1	ZINC000819126483	GH	On-Demand	Anodyne	DRD4	41	32
COC(=O)c1ccc(CCNC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1	ZINC000819126483	GH	On-Demand	Anodyne	NQO2	28	42
COC(=O)c1ccc(CCNC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1	ZINC000819126483	GH	On-Demand	Anodyne	KDM4E	20	41
COC(=O)c1ccc(CCNC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1	ZINC000819126483	GH	On-Demand	Anodyne	KCNK3	85	37
COC(=O)c1ccc(CCNC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)cc1	ZINC000819126483	GH	On-Demand	Anodyne	KCNK9	53	35
O=C(CC1CC1)NNC(=O)Cn1cccc(C(F)(F)F)c1=O	ZINC000819126502	DC	On-Demand	Reactive	RBP4	41	32
CCCOc1ccc(C(=O)NNC(=O)CC2CC2)c(OCc2ccccc2)c1	ZINC000819126504	GH	On-Demand	Reactive	MAOB	23	40
N#Cc1ccc([C@H](O)CNCCCc2ccc(Cl)cc2Cl)cc1	ZINC000819126507	EI	On-Demand	Mild	ADRB2	25	40
N#Cc1ccc([C@H](O)CNCCCc2ccc(Cl)cc2Cl)cc1	ZINC000819126507	EI	On-Demand	Mild	ADRB1	24	40
N#Cc1ccc([C@H](O)CNCCCc2ccc(Cl)cc2Cl)cc1	ZINC000819126507	EI	On-Demand	Mild	ADRB3	22	40
N#Cc1ccc([C@@H](O)CNCCCc2ccc(Cl)cc2Cl)cc1	ZINC000819126509	EI	On-Demand	Mild	ADRB2	25	40
N#Cc1ccc([C@@H](O)CNCCCc2ccc(Cl)cc2Cl)cc1	ZINC000819126509	EI	On-Demand	Mild	ADRB1	24	40
N#Cc1ccc([C@@H](O)CNCCCc2ccc(Cl)cc2Cl)cc1	ZINC000819126509	EI	On-Demand	Mild	ADRB3	22	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	ZINC000819126516	FD	On-Demand	Reactive	LGMN	56	32
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	ZINC000819126517	FD	On-Demand	Reactive	LGMN	56	32
COC(=O)c1ccc(CCNC(=O)c2cc(C)n(Cc3ccccc3)c2C)cc1	ZINC000819126523	GH	On-Demand	Anodyne	AGTR1	45	42
COC(=O)c1ccc(CCNC(=O)c2cc(C)n(Cc3ccccc3)c2C)cc1	ZINC000819126523	GH	On-Demand	Anodyne	PLA2G2A	58	38
COC(=O)c1ccc(CCNC(=O)c2cc(C)n(Cc3ccccc3)c2C)cc1	ZINC000819126523	GH	On-Demand	Anodyne	HDAC6	16	43
O=C(CC1CC1)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000819126530	GD	On-Demand	Reactive	CACNA1I	56	41
CC(C)(C)OC(=O)N[C@@H](C(=O)NNC(=O)CC1CC1)C1CCOCC1	ZINC000819126536	FD	On-Demand	Reactive	POLG_HCV1	21	43
O=C(CC1CC1)NNC(=O)c1ccccc1NCc1ccccc1	ZINC000819126546	DF	On-Demand	Reactive	GRIN2B	29	41
O=C(CC1CC1)NNC(=O)c1ccccc1NCc1ccccc1	ZINC000819126546	DF	On-Demand	Reactive	VCP	41	35
O=C(COCC(=O)NNC(=O)CC1CC1)NCc1cccnc1	ZINC000819126548	DB	On-Demand	Reactive	GRIN2B	16	40
O=C(COCC(=O)NNC(=O)CC1CC1)NCc1cccnc1	ZINC000819126548	DB	On-Demand	Reactive	CHRNA7	45	38
O=C(COCC(=O)NNC(=O)CC1CC1)NCc1cccnc1	ZINC000819126548	DB	On-Demand	Reactive	NAMPT	62	42
CCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)CC3CC3)c2)cc1	ZINC000819126552	HE	On-Demand	Reactive	ALPL	15	45
O=C(CC1CC1)NNC(=O)c1ccc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1	ZINC000819126557	IF	On-Demand	Reactive	PIK3C3	44	31
O=C(NCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819126562	DD	On-Demand	Anodyne	HTR1A	38	55
O=C(NCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819126562	DD	On-Demand	Anodyne	DRD2	25	55
O=C(NCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819126562	DD	On-Demand	Anodyne	DRD4	42	32
O=C(NCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819126562	DD	On-Demand	Anodyne	DRD3	26	45
O=C(CC1CC1)NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819126567	FD	On-Demand	Reactive	TGM2	43	33
O=C(CC1CC1)NNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819126567	FD	On-Demand	Reactive	F13A1	40	34
CN(C)CCOc1ccc(NC(=O)C(F)=C2CCC2)cc1	ZINC000819126572	CF	On-Demand	Anodyne	ESRRG	45	33
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1	ZINC000819126583	FD	On-Demand	Reactive	CCR3	52	39
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1	ZINC000819126583	FD	On-Demand	Reactive	MLNR	27	40
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1	ZINC000819126583	FD	On-Demand	Reactive	DPP7	44	33
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1	ZINC000819126585	FD	On-Demand	Reactive	CCR3	52	39
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1	ZINC000819126585	FD	On-Demand	Reactive	MLNR	27	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1	ZINC000819126585	FD	On-Demand	Reactive	DPP7	44	33
COc1ccc(-c2cnc(CCC(=O)NNC(=O)CC3CC3)o2)cc1	ZINC000819126587	EE	On-Demand	Reactive	PDK1	40	35
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1	ZINC000819126595	FE	On-Demand	Reactive	CA2	23	43
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1	ZINC000819126595	FE	On-Demand	Reactive	CA1	17	43
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1	ZINC000819126595	FE	On-Demand	Reactive	CA4	16	40
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1	ZINC000819126595	FE	On-Demand	Reactive	LIMK2	40	48
O=C(CC1CC1)NNC(=O)c1cc2c(Cl)c(Cl)ccc2[nH]1	ZINC000819126596	EG	On-Demand	Reactive	PYGL	42	37
COC(=O)c1ccsc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1=O	ZINC000819126619	GF	On-Demand	Anodyne	ADRB3	18	42
COC(=O)c1ccsc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1=O	ZINC000819126621	GF	On-Demand	Anodyne	ADRB3	18	42
O=C(CC1CC1)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1	ZINC000819126628	IG	On-Demand	Reactive	PRTN3	49	36
O=C(CC1CC1)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1	ZINC000819126628	IG	On-Demand	Reactive	CCR2	19	45
O=C(CC1CC1)NNC(=O)c1cc(Br)ccc1OCc1ccccc1	ZINC000819126630	HH	On-Demand	Reactive	PTGER1	57	42
O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)NNC(=O)CC1CC1	ZINC000819126632	IC	On-Demand	Reactive	TGM2	75	45
O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)NNC(=O)CC1CC1	ZINC000819126632	IC	On-Demand	Reactive	F13A1	81	45
C=CCOc1ccccc1C(=O)NNC(=O)CC1CC1	ZINC000819126633	CD	On-Demand	Reactive	HCN1	60	35
C=CCOc1ccccc1C(=O)NNC(=O)CC1CC1	ZINC000819126633	CD	On-Demand	Reactive	HCN4	43	34
CC(=O)CCCCCCC(=O)NNC(=O)CC1CC1	ZINC000819126635	CD	On-Demand	Reactive	PAOX	46	41
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	ACE	122	42
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	OPRM1	58	39
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	OPRD1	53	39
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	MME	192	42
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	LTA4H	17	40
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	ANPEP	76	38
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	FCER2	74	38
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	CTSB	61	40
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	PAPA1_CARPA	57	39
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	CYSP_TRYCR	53	38
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	CTSL	46	41
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	CPA1	64	41
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	TIMP3	79	37
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	CAPNS1	86	37
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	MMP8	25	40
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	HLA-DRB1	42	32
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	REN	50	38
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	CAPN1	115	44
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	MMP9	26	40
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	CAPN2	85	39
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	ACE2	108	41
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	FPR1	77	40
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	NPR	70	38
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	AMP1_PLAFQ	47	39
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	BLA1_STEMA	55	40
C[C@@H](Cc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819126647	CD	On-Demand	Reactive	BRCA1	45	32
CCCOc1c(Cl)cc(C(=O)NNC(=O)CC2CC2)cc1OCC	ZINC000819126650	FG	On-Demand	Reactive	CACNA1I	41	32
CCOc1cccnc1C(=O)NNC(=O)CC1CC1	ZINC000819126651	CD	On-Demand	Reactive	HCN1	49	33
CCOc1cccnc1C(=O)NNC(=O)CC1CC1	ZINC000819126651	CD	On-Demand	Reactive	HCN4	43	33
O=C(CC1CC1)NNC(=O)c1ccnc(C(F)(F)F)c1	ZINC000819126658	CD	On-Demand	Reactive	CCR2	43	36
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126660	GC	On-Demand	Reactive	LGMN	74	34
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126660	GC	On-Demand	Reactive	TMPRSS11D	42	32
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126661	GC	On-Demand	Reactive	LGMN	74	34
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126661	GC	On-Demand	Reactive	TMPRSS11D	42	32
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126662	GC	On-Demand	Reactive	LGMN	74	34
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126662	GC	On-Demand	Reactive	TMPRSS11D	42	32
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126663	GC	On-Demand	Reactive	LGMN	74	34
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126663	GC	On-Demand	Reactive	TMPRSS11D	42	32
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC000819126668	DD	On-Demand	Reactive	SLC6A1	86	34
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC000819126668	DD	On-Demand	Reactive	SIGMAR1	18	43
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC000819126668	DD	On-Demand	Reactive	CHRNA7	41	35
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC000819126669	DD	On-Demand	Reactive	SLC6A1	86	34
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC000819126669	DD	On-Demand	Reactive	SIGMAR1	18	43
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC000819126669	DD	On-Demand	Reactive	CHRNA7	41	35
C[C@H]1[C@H](c2ccccc2)[C@@H]1C(=O)NNC(=O)CC1CC1	ZINC000819126670	CD	On-Demand	Reactive	HDAC4	28	40
C[C@@H]1[C@H](C(=O)NNC(=O)CC2CC2)[C@@H]1c1ccccc1	ZINC000819126671	CD	On-Demand	Reactive	HDAC4	28	40
C[C@@H]1[C@@H](C(=O)NNC(=O)CC2CC2)[C@@H]1c1ccccc1	ZINC000819126672	CD	On-Demand	Reactive	HDAC4	28	40
C[C@@H]1[C@H](C(=O)NNC(=O)CC2CC2)[C@H]1c1ccccc1	ZINC000819126673	CD	On-Demand	Reactive	HDAC4	28	40
O=C(CCCc1ccc(Cl)c(Cl)c1)NNC(=O)CC1CC1	ZINC000819126676	EG	On-Demand	Reactive	SIGMAR1	16	42
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccc(Br)o2)c1	ZINC000819126684	HF	On-Demand	Reactive	KCNK3	81	36
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccc(Br)o2)c1	ZINC000819126684	HF	On-Demand	Reactive	KCNK9	40	35
O=C(CCNC(=O)N1CCc2ccccc2C1)NNC(=O)CC1CC1	ZINC000819126685	ED	On-Demand	Reactive	PREP	24	40
CCCN(CC)C(=O)c1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126686	EE	On-Demand	Reactive	OPRD1	33	41
O=C(CNC(=O)c1c(F)cccc1Cl)NNC(=O)CC1CC1	ZINC000819126691	ED	On-Demand	Reactive	PPIA	23	40
O=C(COc1ccc2ccccc2c1Br)NNC(=O)CC1CC1	ZINC000819126707	GF	On-Demand	Reactive	KCNJ11	25	41
O=C(COc1ccc2ccccc2c1Br)NNC(=O)CC1CC1	ZINC000819126707	GF	On-Demand	Reactive	NCEH1	54	48
O=C(CSCc1cccnc1)NNC(=O)CC1CC1	ZINC000819126738	CD	On-Demand	Reactive	CHRNA7	51	40
O=C(NCc1cccc(CN2CCOCC2)c1)C(F)=C1CCC1	ZINC000819126741	DF	On-Demand	Anodyne	CHRM3	16	42
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(CN2CCOCC2)c1	ZINC000819126759	ED	On-Demand	Anodyne	CHRM3	17	43
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(CN2CCOCC2)c1	ZINC000819126760	ED	On-Demand	Anodyne	CHRM3	17	43
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(CN2CCOCC2)c1	ZINC000819126761	ED	On-Demand	Anodyne	CHRM3	17	43
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(CN2CCOCC2)c1	ZINC000819126762	ED	On-Demand	Anodyne	CHRM3	17	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(OCc3cccnc3)c1)C2	ZINC000819126775	GG	On-Demand	Anodyne	CHRNA7	41	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(OCc3cccnc3)c1)C2	ZINC000819126776	GG	On-Demand	Anodyne	CHRNA7	41	43
O=C(/C=C/[C@@H]1CCCO1)N1CCC(Cc2cccc(F)c2)CC1	ZINC000819126781	DG	On-Demand	Anodyne	GRIN2B	44	47
O=C(/C=C/[C@@H]1CCCO1)N1CCC(Cc2cccc(F)c2)CC1	ZINC000819126781	DG	On-Demand	Anodyne	CCR3	44	39
O=C(/C=C\[C@H]1CCCO1)N1CCC(Cc2cccc(F)c2)CC1	ZINC000819126782	DG	On-Demand	Anodyne	GRIN2B	44	47
O=C(/C=C\[C@H]1CCCO1)N1CCC(Cc2cccc(F)c2)CC1	ZINC000819126782	DG	On-Demand	Anodyne	CCR3	44	39
O=C(/C=C/[C@H]1CCCO1)N1CCC(Cc2cccc(F)c2)CC1	ZINC000819126783	DG	On-Demand	Anodyne	GRIN2B	44	47
O=C(/C=C/[C@H]1CCCO1)N1CCC(Cc2cccc(F)c2)CC1	ZINC000819126783	DG	On-Demand	Anodyne	CCR3	44	39
O=C(/C=C\[C@@H]1CCCO1)N1CCC(Cc2cccc(F)c2)CC1	ZINC000819126784	DG	On-Demand	Anodyne	GRIN2B	44	47
O=C(/C=C\[C@@H]1CCCO1)N1CCC(Cc2cccc(F)c2)CC1	ZINC000819126784	DG	On-Demand	Anodyne	CCR3	44	39
CCO[C@@H](CCNC[C@@H](O)c1cccnc1)C(C)C	ZINC000819126798	CE	On-Demand	Anodyne	ADRB2	32	48
CCO[C@@H](CCNC[C@@H](O)c1cccnc1)C(C)C	ZINC000819126798	CE	On-Demand	Anodyne	ADRB1	43	48
CCO[C@@H](CCNC[C@@H](O)c1cccnc1)C(C)C	ZINC000819126798	CE	On-Demand	Anodyne	ADRB3	122	48
CCO[C@@H](CCNC[C@H](O)c1cccnc1)C(C)C	ZINC000819126799	CE	On-Demand	Anodyne	ADRB2	32	48
CCO[C@@H](CCNC[C@H](O)c1cccnc1)C(C)C	ZINC000819126799	CE	On-Demand	Anodyne	ADRB1	43	48
CCO[C@@H](CCNC[C@H](O)c1cccnc1)C(C)C	ZINC000819126799	CE	On-Demand	Anodyne	ADRB3	122	48
C[C@H](CCNC[C@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819126804	DF	On-Demand	Anodyne	ADRB2	37	49
C[C@H](CCNC[C@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819126804	DF	On-Demand	Anodyne	ADRB1	42	45
C[C@H](CCNC[C@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819126804	DF	On-Demand	Anodyne	ADRB3	118	51
C[C@H](CCNC[C@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819126804	DF	On-Demand	Anodyne	KCNA5	22	40
C[C@@H](CCNC[C@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819126805	DF	On-Demand	Anodyne	ADRB2	37	49
C[C@@H](CCNC[C@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819126805	DF	On-Demand	Anodyne	ADRB1	42	45
C[C@@H](CCNC[C@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819126805	DF	On-Demand	Anodyne	ADRB3	118	51
C[C@@H](CCNC[C@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819126805	DF	On-Demand	Anodyne	KCNA5	22	40
C[C@@H](CCNC[C@@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819126806	DF	On-Demand	Anodyne	ADRB2	37	49
C[C@@H](CCNC[C@@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819126806	DF	On-Demand	Anodyne	ADRB1	42	45
C[C@@H](CCNC[C@@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819126806	DF	On-Demand	Anodyne	ADRB3	118	51
C[C@@H](CCNC[C@@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819126806	DF	On-Demand	Anodyne	KCNA5	22	40
C[C@H](CCNC[C@@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819126807	DF	On-Demand	Anodyne	ADRB2	37	49
C[C@H](CCNC[C@@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819126807	DF	On-Demand	Anodyne	ADRB1	42	45
C[C@H](CCNC[C@@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819126807	DF	On-Demand	Anodyne	ADRB3	118	51
C[C@H](CCNC[C@@H](O)c1cccnc1)N(C)Cc1ccccc1	ZINC000819126807	DF	On-Demand	Anodyne	KCNA5	22	40
COCCn1cc(NC(=O)/C=C/[C@@H]2CCCO2)cn1	ZINC000819126810	CD	On-Demand	Anodyne	PANC	52	34
COCCn1cc(NC(=O)/C=C\[C@@H]2CCCO2)cn1	ZINC000819126812	CD	On-Demand	Anodyne	PANC	52	34
COCCn1cc(NC(=O)/C=C/[C@H]2CCCO2)cn1	ZINC000819126813	CD	On-Demand	Anodyne	PANC	52	34
CC(C)(C)NC(=O)c1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819126815	DH	On-Demand	Anodyne	TAAR1	40	39
CC(C)(C)NC(=O)c1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819126815	DH	On-Demand	Anodyne	KCNK3	105	39
CC(C)(C)NC(=O)c1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819126815	DH	On-Demand	Anodyne	KCNK9	66	39
O=C(CC1CC1)NNC(=O)c1ccccc1OCc1cn2ccccc2n1	ZINC000819126817	FE	On-Demand	Reactive	HCN1	53	32
O=C(CC1CC1)NNC(=O)c1ccccc1OCc1cn2ccccc2n1	ZINC000819126817	FE	On-Demand	Reactive	HCN4	42	32
O=C(CC1CC1)NNC(=O)c1cnc(Cc2ccccc2)s1	ZINC000819126821	DE	On-Demand	Reactive	CDK5	31	43
Cc1oc(-c2ccccc2)nc1CC(=O)NNC(=O)CC1CC1	ZINC000819126827	DE	On-Demand	Reactive	PPARG	95	47
Cc1oc(-c2ccccc2)nc1CC(=O)NNC(=O)CC1CC1	ZINC000819126827	DE	On-Demand	Reactive	PPARA	104	48
Cc1oc(-c2ccccc2)nc1CC(=O)NNC(=O)CC1CC1	ZINC000819126827	DE	On-Demand	Reactive	PDE8B	74	46
O=C(CC1CC1)NNC(=O)c1ccc(C(=O)c2cccc(O)c2)cc1	ZINC000819126828	EE	On-Demand	Reactive	HSD17B1	28	45
O=C(CC1CC1)NNC(=O)c1ccc(C(=O)c2cccc(O)c2)cc1	ZINC000819126828	EE	On-Demand	Reactive	HSD17B2	30	45
Cc1cccc(NC(=O)NCC(=O)NNC(=O)CC2CC2)c1	ZINC000819126830	DD	On-Demand	Reactive	CCKAR	28	47
Cc1cccc(NC(=O)NCC(=O)NNC(=O)CC2CC2)c1	ZINC000819126830	DD	On-Demand	Reactive	CCKBR	45	40
Cc1cccc(NC(=O)NCC(=O)NNC(=O)CC2CC2)c1	ZINC000819126830	DD	On-Demand	Reactive	EPHX2	15	46
Cc1cccc(NC(=O)NCC(=O)NNC(=O)CC2CC2)c1	ZINC000819126830	DD	On-Demand	Reactive	KCNK3	60	39
Cc1cccc(NC(=O)NCC(=O)NNC(=O)CC2CC2)c1	ZINC000819126830	DD	On-Demand	Reactive	KCNK9	43	39
Cc1nn(-c2ccc(Cl)c(Cl)c2)c(C)c1CC(=O)NNC(=O)CC1CC1	ZINC000819126835	GG	On-Demand	Reactive	P2RX7	39	52
Cc1nn(-c2ccc(Cl)c(Cl)c2)c(C)c1CC(=O)NNC(=O)CC1CC1	ZINC000819126835	GG	On-Demand	Reactive	RPA1	60	35
NC(=O)CS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126838	EB	On-Demand	Reactive	CA2	18	40
O=C(CCSCc1ccccc1)NNC(=O)CC1CC1	ZINC000819126852	CE	On-Demand	Reactive	CACNA2D1	25	45
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)NCc1cccc(Br)c1	ZINC000819126853	HE	On-Demand	Reactive	F2	43	54
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)NCc1cccc(Br)c1	ZINC000819126853	HE	On-Demand	Reactive	PREP	55	46
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)NCc1cccc(Br)c1	ZINC000819126853	HE	On-Demand	Reactive	LGMN	70	47
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)NCc1cccc(Br)c1	ZINC000819126853	HE	On-Demand	Reactive	TMPRSS11D	56	33
O=C(CC1CC1)NNC(=O)CC12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2	ZINC000819126854	FG	On-Demand	Reactive	BOTA	30	41
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)Nc2ccc(Cl)c(Cl)c2)c1	ZINC000819126856	HI	On-Demand	Reactive	RAF1	27	40
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)Nc2ccc(Cl)c(Cl)c2)c1	ZINC000819126856	HI	On-Demand	Reactive	EPHX2	22	49
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)Nc2ccc(Cl)c(Cl)c2)c1	ZINC000819126856	HI	On-Demand	Reactive	IMDH_CRYPV	36	40
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)Nc2ccc(Cl)c(Cl)c2)c1	ZINC000819126856	HI	On-Demand	Reactive	KCNK3	67	36
CC(C)n1ncc2c(C(=O)NNC(=O)CC3CC3)cc(-c3ccccc3)nc21	ZINC000819126858	GG	On-Demand	Reactive	P2RY12	64	33
CC(C)n1ncc2c(C(=O)NNC(=O)CC3CC3)cc(-c3ccccc3)nc21	ZINC000819126858	GG	On-Demand	Reactive	VCP	54	39
CC(C)n1ncc2c(C(=O)NNC(=O)CC3CC3)cc(-c3ccccc3)nc21	ZINC000819126858	GG	On-Demand	Reactive	EZH2	17	46
CCOc1ccc(-n2c(SCC(=O)NNC(=O)CC3CC3)nnc2-c2ccco2)cc1	ZINC000819126859	IF	On-Demand	Reactive	CACNA2D1	51	36
O=C(CC1CC1)NNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1	ZINC000819126861	FF	On-Demand	Reactive	VCP	53	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(Br)c(F)c2)C1	ZINC000819126864	IE	On-Demand	Reactive	L3MBTL3	43	36
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)c2ccc(Br)c(F)c2)C1	ZINC000819126865	IE	On-Demand	Reactive	L3MBTL3	43	36
O=C(CSc1nnc(-c2cccnc2)n1Cc1ccco1)NNC(=O)CC1CC1	ZINC000819126868	HE	On-Demand	Reactive	HCRTR2	17	49
O=C(CC1CC1)NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccccc1)C2=O	ZINC000819126872	GE	On-Demand	Reactive	ACHE	22	54
O=C(CC1CC1)NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccccc1)C2=O	ZINC000819126872	GE	On-Demand	Reactive	SIGMAR1	15	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCN1CCN(c2ncccn2)CC1	ZINC000819126878	GC	On-Demand	Anodyne	HTR1A	49	50
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCN1CCN(c2ncccn2)CC1	ZINC000819126878	GC	On-Demand	Anodyne	DRD2	39	50
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCN1CCN(c2ncccn2)CC1	ZINC000819126878	GC	On-Demand	Anodyne	DRD4	44	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCN1CCN(c2ncccn2)CC1	ZINC000819126878	GC	On-Demand	Anodyne	DRD3	55	40
CCCn1cc(NC(=O)CCc2cccc(OC(F)F)c2)ccc1=O	ZINC000819126879	FG	On-Demand	Anodyne	MTNR1B	16	43
COC(=O)c1ccsc1N1CC[C@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000819126880	FD	On-Demand	Anodyne	ADRB1	21	42
COC(=O)c1ccsc1N1CC[C@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000819126880	FD	On-Demand	Anodyne	ADRB3	69	42
COC(=O)c1ccsc1N1CC[C@@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000819126882	FD	On-Demand	Anodyne	ADRB1	21	42
COC(=O)c1ccsc1N1CC[C@@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000819126882	FD	On-Demand	Anodyne	ADRB3	69	42
O=C(CC1CC1)NNC(=O)c1cn(-c2ccc(Cl)c(Cl)c2)cn1	ZINC000819126883	FF	On-Demand	Reactive	RPA1	48	32
COC(=O)c1ccsc1N1CC[C@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000819126884	FD	On-Demand	Anodyne	ADRB1	21	42
COC(=O)c1ccsc1N1CC[C@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000819126884	FD	On-Demand	Anodyne	ADRB3	69	42
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126886	HD	On-Demand	Reactive	FKBP1A	15	45
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126886	HD	On-Demand	Reactive	MMP13	56	51
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126886	HD	On-Demand	Reactive	ADAM17	44	39
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126886	HD	On-Demand	Reactive	CAPNS1	22	46
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126886	HD	On-Demand	Reactive	MMP2	26	41
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126886	HD	On-Demand	Reactive	MMP3	58	51
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126886	HD	On-Demand	Reactive	MMP8	24	41
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126886	HD	On-Demand	Reactive	CAPN1	15	43
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126886	HD	On-Demand	Reactive	MMP9	27	41
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126886	HD	On-Demand	Reactive	MMP7	65	51
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126886	HD	On-Demand	Reactive	MMP1	62	51
COC(=O)c1ccsc1N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000819126887	FD	On-Demand	Anodyne	ADRB1	21	42
COC(=O)c1ccsc1N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000819126887	FD	On-Demand	Anodyne	ADRB3	69	42
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126889	HD	On-Demand	Reactive	FKBP1A	15	45
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126889	HD	On-Demand	Reactive	MMP13	56	51
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126889	HD	On-Demand	Reactive	ADAM17	44	39
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126889	HD	On-Demand	Reactive	CAPNS1	22	46
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126889	HD	On-Demand	Reactive	MMP2	26	41
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126889	HD	On-Demand	Reactive	MMP3	58	51
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126889	HD	On-Demand	Reactive	MMP8	24	41
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126889	HD	On-Demand	Reactive	CAPN1	15	43
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126889	HD	On-Demand	Reactive	MMP9	27	41
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126889	HD	On-Demand	Reactive	MMP7	65	51
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819126889	HD	On-Demand	Reactive	MMP1	62	51
O=C(CC1CC1)NNC(=O)c1cnnc(-c2ccccc2)c1	ZINC000819126891	CD	On-Demand	Reactive	VCP	55	39
O=C(CC1CC1)NNC(=O)C1CCN(c2nc3ccccc3s2)CC1	ZINC000819126896	FE	On-Demand	Reactive	LTA4H	26	42
Cc1nn(-c2ccc(Cl)cc2Cl)c(C)c1CC(=O)NNC(=O)CC1CC1	ZINC000819126899	GG	On-Demand	Reactive	CNR1	87	48
Cc1nn(-c2ccc(Cl)cc2Cl)c(C)c1CC(=O)NNC(=O)CC1CC1	ZINC000819126899	GG	On-Demand	Reactive	CNR2	25	42
Cc1nn(-c2ccc(Cl)cc2Cl)c(C)c1CC(=O)NNC(=O)CC1CC1	ZINC000819126899	GG	On-Demand	Reactive	P2RX7	60	50
Cc1ccccc1[C@@H](O)CNCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819126932	FG	On-Demand	Anodyne	CHRM2	17	41
Cc1ccccc1[C@@H](O)CNCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819126932	FG	On-Demand	Anodyne	ACHE	15	41
Cc1ccccc1[C@@H](O)CNCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819126932	FG	On-Demand	Anodyne	GRIN2B	83	46
Cc1ccccc1[C@@H](O)CNCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819126932	FG	On-Demand	Anodyne	SIGMAR1	26	42
Cc1ccccc1[C@@H](O)CNCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819126932	FG	On-Demand	Anodyne	CCR3	43	47
Cc1ccccc1[C@@H](O)CNCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819126932	FG	On-Demand	Anodyne	GRIN2C	24	42
O=C(CC1CC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000819126947	IG	On-Demand	Reactive	CACNA1B	57	36
O=C(CC1CC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000819126947	IG	On-Demand	Reactive	BDKRB1	21	40
O=C(CC1CC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000819126947	IG	On-Demand	Reactive	PRTN3	48	35
O=C(CC1CC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000819126947	IG	On-Demand	Reactive	CCR2	70	42
O=C(CC1CC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000819126947	IG	On-Demand	Reactive	SFRP1	79	33
O=C(CC1CC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccc(C(F)(F)F)c1	ZINC000819126947	IG	On-Demand	Reactive	WNT3	55	31
COC[C@@H](NC[C@@H](O)c1cccnc1)c1ccco1	ZINC000819126956	CD	On-Demand	Anodyne	ADRB1	18	43
COC[C@@H](NC[C@@H](O)c1cccnc1)c1ccco1	ZINC000819126956	CD	On-Demand	Anodyne	ADRB3	51	46
COC[C@@H](NC[C@H](O)c1cccnc1)c1ccco1	ZINC000819126958	CD	On-Demand	Anodyne	ADRB1	18	43
COC[C@@H](NC[C@H](O)c1cccnc1)c1ccco1	ZINC000819126958	CD	On-Demand	Anodyne	ADRB3	51	46
COC[C@H](NC[C@@H](O)c1cccnc1)c1ccco1	ZINC000819126959	CD	On-Demand	Anodyne	ADRB1	18	43
COC[C@H](NC[C@@H](O)c1cccnc1)c1ccco1	ZINC000819126959	CD	On-Demand	Anodyne	ADRB3	51	46
COC[C@H](NC[C@H](O)c1cccnc1)c1ccco1	ZINC000819126960	CD	On-Demand	Anodyne	ADRB1	18	43
COC[C@H](NC[C@H](O)c1cccnc1)c1ccco1	ZINC000819126960	CD	On-Demand	Anodyne	ADRB3	51	46
CN(C)CCOc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1	ZINC000819126963	DE	On-Demand	Anodyne	ESRRG	43	32
CN(C)CCOc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1	ZINC000819126964	DE	On-Demand	Anodyne	ESRRG	43	32
CN(C)CCOc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1	ZINC000819126965	DE	On-Demand	Anodyne	ESRRG	43	32
CN(C)CCOc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1	ZINC000819126966	DE	On-Demand	Anodyne	ESRRG	43	32
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2ncccn2)CC1	ZINC000819126967	EC	On-Demand	Anodyne	HTR1A	22	52
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2ncccn2)CC1	ZINC000819126968	EC	On-Demand	Anodyne	HTR1A	22	52
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2ncccn2)CC1	ZINC000819126969	EC	On-Demand	Anodyne	HTR1A	22	52
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2ncccn2)CC1	ZINC000819126970	EC	On-Demand	Anodyne	HTR1A	22	52
O=C(CNC[C@H](O)c1cccc(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819126971	FF	On-Demand	Anodyne	ADRB1	29	41
O=C(CNC[C@H](O)c1cccc(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819126971	FF	On-Demand	Anodyne	SLC6A3	17	43
O=C(CNC[C@H](O)c1cccc(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819126971	FF	On-Demand	Anodyne	GRIN2B	81	41
O=C(CNC[C@H](O)c1cccc(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819126971	FF	On-Demand	Anodyne	ADRB3	44	41
O=C(CNC[C@H](O)c1cccc(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819126971	FF	On-Demand	Anodyne	SIGMAR1	21	40
O=C(CNC[C@H](O)c1cccc(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819126971	FF	On-Demand	Anodyne	CCR3	73	46
O=C(CNC[C@H](O)c1cccc(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819126971	FF	On-Demand	Anodyne	GRIN2C	22	40
O=C(CNC[C@@H](O)c1cccc(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819126972	FF	On-Demand	Anodyne	ADRB1	29	41
O=C(CNC[C@@H](O)c1cccc(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819126972	FF	On-Demand	Anodyne	SLC6A3	17	43
O=C(CNC[C@@H](O)c1cccc(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819126972	FF	On-Demand	Anodyne	GRIN2B	81	41
O=C(CNC[C@@H](O)c1cccc(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819126972	FF	On-Demand	Anodyne	ADRB3	44	41
O=C(CNC[C@@H](O)c1cccc(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819126972	FF	On-Demand	Anodyne	SIGMAR1	21	40
O=C(CNC[C@@H](O)c1cccc(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819126972	FF	On-Demand	Anodyne	CCR3	73	46
O=C(CNC[C@@H](O)c1cccc(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819126972	FF	On-Demand	Anodyne	GRIN2C	22	40
O=C(CC1CC1)NNC(=O)c1cccc(NS(=O)(=O)c2ccc(F)c(F)c2)c1	ZINC000819126981	HE	On-Demand	Reactive	ST14	45	33
CC(C)(C(=O)NNC(=O)CC1CC1)c1ccc(OC(F)(F)F)cc1	ZINC000819126993	EF	On-Demand	Reactive	EPHX2	37	44
O=C(CNC[C@H](O)c1ccc(F)cc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127004	GG	On-Demand	Anodyne	GRIN2B	81	43
O=C(CNC[C@H](O)c1ccc(F)cc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127004	GG	On-Demand	Anodyne	SIGMAR1	26	41
O=C(CNC[C@H](O)c1ccc(F)cc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127004	GG	On-Demand	Anodyne	CCR3	82	52
O=C(CNC[C@H](O)c1ccc(F)cc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127004	GG	On-Demand	Anodyne	GRIN2C	24	41
O=C(CNC[C@H](O)c1ccc(F)cc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127004	GG	On-Demand	Anodyne	AMP1_PLAFQ	16	46
O=C(CNC[C@@H](O)c1ccc(F)cc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127005	GG	On-Demand	Anodyne	GRIN2B	81	43
O=C(CNC[C@@H](O)c1ccc(F)cc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127005	GG	On-Demand	Anodyne	SIGMAR1	26	41
O=C(CNC[C@@H](O)c1ccc(F)cc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127005	GG	On-Demand	Anodyne	CCR3	82	52
O=C(CNC[C@@H](O)c1ccc(F)cc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127005	GG	On-Demand	Anodyne	GRIN2C	24	41
O=C(CNC[C@@H](O)c1ccc(F)cc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127005	GG	On-Demand	Anodyne	AMP1_PLAFQ	16	46
O=C(CNCC1(O)CCCCC1)N1CCC(Cc2ccccc2)CC1	ZINC000819127006	EF	On-Demand	Anodyne	GRIN2B	77	45
O=C(CNCC1(O)CCCCC1)N1CCC(Cc2ccccc2)CC1	ZINC000819127006	EF	On-Demand	Anodyne	SIGMAR1	20	40
O=C(CNCC1(O)CCCCC1)N1CCC(Cc2ccccc2)CC1	ZINC000819127006	EF	On-Demand	Anodyne	CCR3	45	42
O=C(CNCC1(O)CCCCC1)N1CCC(Cc2ccccc2)CC1	ZINC000819127006	EF	On-Demand	Anodyne	PREP	40	35
O=C(CNCC1(O)CCCCC1)N1CCC(Cc2ccccc2)CC1	ZINC000819127006	EF	On-Demand	Anodyne	CTSS	18	42
O=C(CNC[C@H](O)c1c(F)cccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127013	GG	On-Demand	Anodyne	GRIN2B	80	43
O=C(CNC[C@H](O)c1c(F)cccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127013	GG	On-Demand	Anodyne	CCR3	53	44
O=C(CNC[C@@H](O)c1c(F)cccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127014	GG	On-Demand	Anodyne	GRIN2B	80	43
O=C(CNC[C@@H](O)c1c(F)cccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127014	GG	On-Demand	Anodyne	CCR3	53	44
O=C(NCc1ccc(F)cc1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819127031	FE	On-Demand	Anodyne	EPHX2	16	40
O=C(NCc1ccc(F)cc1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819127032	FE	On-Demand	Anodyne	EPHX2	16	40
O=C(NCc1ccc(F)cc1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819127033	FE	On-Demand	Anodyne	EPHX2	16	40
O=C(NCc1ccc(F)cc1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819127034	FE	On-Demand	Anodyne	EPHX2	16	40
C[C@H]1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819127043	FI	On-Demand	Mild	GHRHR	41	32
C[C@H]1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819127043	FI	On-Demand	Mild	PAPA1_CARPA	40	42
C[C@H]1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819127043	FI	On-Demand	Mild	CTSK	17	41
C[C@@H]1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819127044	FI	On-Demand	Mild	GHRHR	41	32
C[C@@H]1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819127044	FI	On-Demand	Mild	PAPA1_CARPA	40	42
C[C@@H]1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819127044	FI	On-Demand	Mild	CTSK	17	41
C[C@H]1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819127045	FI	On-Demand	Mild	GHRHR	41	32
C[C@H]1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819127045	FI	On-Demand	Mild	PAPA1_CARPA	40	42
C[C@H]1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819127045	FI	On-Demand	Mild	CTSK	17	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1)C2	ZINC000819127059	GG	On-Demand	Anodyne	KCNK3	46	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(C(=O)NC(C)(C)C)c1)C2	ZINC000819127060	GG	On-Demand	Anodyne	KCNK3	46	34
CC(C)c1ccc2c(c1)CCCN2C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819127098	FH	On-Demand	Anodyne	EIF2AK3	60	35
CC(C)(C)NC(=O)c1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819127101	DF	On-Demand	Anodyne	KCNK3	81	37
CC(C)(C)NC(=O)c1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819127101	DF	On-Demand	Anodyne	KCNK9	42	37
CC(C)(C)NC(=O)c1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819127102	DF	On-Demand	Anodyne	KCNK3	81	37
CC(C)(C)NC(=O)c1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819127102	DF	On-Demand	Anodyne	KCNK9	42	37
CC(C)(C)NC(=O)c1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819127103	DF	On-Demand	Anodyne	KCNK3	81	37
CC(C)(C)NC(=O)c1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819127103	DF	On-Demand	Anodyne	KCNK9	42	37
CC(C)(C)NC(=O)c1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819127104	DF	On-Demand	Anodyne	KCNK3	81	37
CC(C)(C)NC(=O)c1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819127104	DF	On-Demand	Anodyne	KCNK9	42	37
O=C(Cc1nsc2ccccc12)NCc1ccc(N2CCSCC2)cc1	ZINC000819127117	GH	On-Demand	Clean	HTR1A	20	41
CC(=O)Nc1cccc(CC(=O)NCc2cccc(OC(C)C)c2)c1	ZINC000819127128	EG	On-Demand	Anodyne	MTNR1A	42	40
CC(=O)Nc1cccc(CC(=O)NCc2cccc(OC(C)C)c2)c1	ZINC000819127128	EG	On-Demand	Anodyne	MTNR1B	43	40
CC(=O)Nc1cccc(CC(=O)NCc2cccc(OC(C)C)c2)c1	ZINC000819127128	EG	On-Demand	Anodyne	ROCK2	36	42
CC(=O)Nc1cccc(CC(=O)NCc2cccc(OC(C)C)c2)c1	ZINC000819127128	EG	On-Demand	Anodyne	AMP1_PLAFQ	22	40
CC(=O)Nc1cccc(CC(=O)NCc2cccc(OC(C)C)c2)c1	ZINC000819127128	EG	On-Demand	Anodyne	KCNK3	94	37
CC(=O)Nc1cccc(CC(=O)NCc2cccc(OC(C)C)c2)c1	ZINC000819127128	EG	On-Demand	Anodyne	KCNK9	63	37
CC(=O)Nc1cccc(CC(=O)NCc2cccc(OC(C)C)c2)c1	ZINC000819127128	EG	On-Demand	Anodyne	PDS	55	34
O=C(CNC[C@H](O)c1ccccc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127138	FF	On-Demand	Anodyne	SLC6A3	20	40
O=C(CNC[C@H](O)c1ccccc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127138	FF	On-Demand	Anodyne	GRIN2B	91	50
O=C(CNC[C@H](O)c1ccccc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127138	FF	On-Demand	Anodyne	ADRB3	49	38
O=C(CNC[C@H](O)c1ccccc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127138	FF	On-Demand	Anodyne	SIGMAR1	26	45
O=C(CNC[C@H](O)c1ccccc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127138	FF	On-Demand	Anodyne	CCR3	38	46
O=C(CNC[C@H](O)c1ccccc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127138	FF	On-Demand	Anodyne	CCR5	19	40
O=C(CNC[C@H](O)c1ccccc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127138	FF	On-Demand	Anodyne	GRIN2C	25	45
O=C(CNC[C@H](O)c1ccccc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127138	FF	On-Demand	Anodyne	AMP1_PLAFQ	15	51
O=C(CNC[C@@H](O)c1ccccc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127139	FF	On-Demand	Anodyne	SLC6A3	20	40
O=C(CNC[C@@H](O)c1ccccc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127139	FF	On-Demand	Anodyne	GRIN2B	91	50
O=C(CNC[C@@H](O)c1ccccc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127139	FF	On-Demand	Anodyne	ADRB3	49	38
O=C(CNC[C@@H](O)c1ccccc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127139	FF	On-Demand	Anodyne	SIGMAR1	26	45
O=C(CNC[C@@H](O)c1ccccc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127139	FF	On-Demand	Anodyne	CCR3	38	46
O=C(CNC[C@@H](O)c1ccccc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127139	FF	On-Demand	Anodyne	CCR5	19	40
O=C(CNC[C@@H](O)c1ccccc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127139	FF	On-Demand	Anodyne	GRIN2C	25	45
O=C(CNC[C@@H](O)c1ccccc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127139	FF	On-Demand	Anodyne	AMP1_PLAFQ	15	51
O=C(CNC[C@H](O)c1ccc(F)c(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127142	GG	On-Demand	Anodyne	ADRB2	15	46
O=C(CNC[C@H](O)c1ccc(F)c(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127142	GG	On-Demand	Anodyne	GRIN2B	79	43
O=C(CNC[C@H](O)c1ccc(F)c(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127142	GG	On-Demand	Anodyne	SIGMAR1	16	42
O=C(CNC[C@H](O)c1ccc(F)c(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127142	GG	On-Demand	Anodyne	CCR3	47	46
O=C(CNC[C@H](O)c1ccc(F)c(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127142	GG	On-Demand	Anodyne	GRIN2C	23	42
O=C(CNC[C@@H](O)c1ccc(F)c(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127143	GG	On-Demand	Anodyne	ADRB2	15	46
O=C(CNC[C@@H](O)c1ccc(F)c(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127143	GG	On-Demand	Anodyne	GRIN2B	79	43
O=C(CNC[C@@H](O)c1ccc(F)c(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127143	GG	On-Demand	Anodyne	SIGMAR1	16	42
O=C(CNC[C@@H](O)c1ccc(F)c(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127143	GG	On-Demand	Anodyne	CCR3	47	46
O=C(CNC[C@@H](O)c1ccc(F)c(F)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127143	GG	On-Demand	Anodyne	GRIN2C	23	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)c1ccc2ccccc2c1	ZINC000819127144	FF	On-Demand	Reactive	CASP1	24	40
O=C(CNC[C@H](O)c1cccc([N+](=O)[O-])c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127158	GF	On-Demand	Bother	GRIN2B	65	44
O=C(CNC[C@H](O)c1cccc([N+](=O)[O-])c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127158	GF	On-Demand	Bother	CCR3	29	42
O=C(CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127159	GF	On-Demand	Bother	GRIN2B	65	44
O=C(CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127159	GF	On-Demand	Bother	CCR3	29	42
O=C(CNC[C@@H](O)C1CC1)N1CCC(Cc2ccccc2)CC1	ZINC000819127160	DD	On-Demand	Anodyne	GRIN2B	93	47
O=C(CNC[C@@H](O)C1CC1)N1CCC(Cc2ccccc2)CC1	ZINC000819127160	DD	On-Demand	Anodyne	SIGMAR1	25	43
O=C(CNC[C@@H](O)C1CC1)N1CCC(Cc2ccccc2)CC1	ZINC000819127160	DD	On-Demand	Anodyne	CCR3	38	43
O=C(CNC[C@@H](O)C1CC1)N1CCC(Cc2ccccc2)CC1	ZINC000819127160	DD	On-Demand	Anodyne	GRIN2C	24	43
O=C(CNC[C@@H](O)C1CC1)N1CCC(Cc2ccccc2)CC1	ZINC000819127160	DD	On-Demand	Anodyne	AMP1_PLAFQ	15	51
O=C(CNC[C@H](O)C1CC1)N1CCC(Cc2ccccc2)CC1	ZINC000819127161	DD	On-Demand	Anodyne	GRIN2B	93	47
O=C(CNC[C@H](O)C1CC1)N1CCC(Cc2ccccc2)CC1	ZINC000819127161	DD	On-Demand	Anodyne	SIGMAR1	25	43
O=C(CNC[C@H](O)C1CC1)N1CCC(Cc2ccccc2)CC1	ZINC000819127161	DD	On-Demand	Anodyne	CCR3	38	43
O=C(CNC[C@H](O)C1CC1)N1CCC(Cc2ccccc2)CC1	ZINC000819127161	DD	On-Demand	Anodyne	GRIN2C	24	43
O=C(CNC[C@H](O)C1CC1)N1CCC(Cc2ccccc2)CC1	ZINC000819127161	DD	On-Demand	Anodyne	AMP1_PLAFQ	15	51
N#Cc1ccc([C@H](O)CNCC(=O)N2CCC(Cc3ccccc3)CC2)cc1	ZINC000819127190	GF	On-Demand	Mild	GRIN2B	69	46
N#Cc1ccc([C@H](O)CNCC(=O)N2CCC(Cc3ccccc3)CC2)cc1	ZINC000819127190	GF	On-Demand	Mild	CCR3	36	46
N#Cc1ccc([C@H](O)CNCC(=O)N2CCC(Cc3ccccc3)CC2)cc1	ZINC000819127190	GF	On-Demand	Mild	GRIN2C	25	42
N#Cc1ccc([C@@H](O)CNCC(=O)N2CCC(Cc3ccccc3)CC2)cc1	ZINC000819127191	GF	On-Demand	Mild	GRIN2B	69	46
N#Cc1ccc([C@@H](O)CNCC(=O)N2CCC(Cc3ccccc3)CC2)cc1	ZINC000819127191	GF	On-Demand	Mild	CCR3	36	46
N#Cc1ccc([C@@H](O)CNCC(=O)N2CCC(Cc3ccccc3)CC2)cc1	ZINC000819127191	GF	On-Demand	Mild	GRIN2C	25	42
CCO[C@@H](CCNC[C@H](O)c1ccc(Cl)cc1)C(C)C	ZINC000819127231	CG	On-Demand	Anodyne	ADRB1	20	44
CCO[C@@H](CCNC[C@H](O)c1ccc(Cl)cc1)C(C)C	ZINC000819127231	CG	On-Demand	Anodyne	ADRB3	30	44
CCOc1ccccc1C(=O)N1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819127241	FE	On-Demand	Anodyne	HCN1	59	39
CCOc1ccccc1C(=O)N1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819127241	FE	On-Demand	Anodyne	HCN4	51	39
CCOc1ccccc1C(=O)N1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819127241	FE	On-Demand	Anodyne	L3MBTL3	44	38
CCOc1ccccc1C(=O)N1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819127242	FE	On-Demand	Anodyne	HCN1	59	39
CCOc1ccccc1C(=O)N1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819127242	FE	On-Demand	Anodyne	HCN4	51	39
CCOc1ccccc1C(=O)N1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819127242	FE	On-Demand	Anodyne	L3MBTL3	44	38
CCOc1ccccc1C(=O)N1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819127243	FE	On-Demand	Anodyne	HCN1	59	39
CCOc1ccccc1C(=O)N1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819127243	FE	On-Demand	Anodyne	HCN4	51	39
CCOc1ccccc1C(=O)N1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819127243	FE	On-Demand	Anodyne	L3MBTL3	44	38
CCOc1ccccc1C(=O)N1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819127244	FE	On-Demand	Anodyne	HCN1	59	39
CCOc1ccccc1C(=O)N1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819127244	FE	On-Demand	Anodyne	HCN4	51	39
CCOc1ccccc1C(=O)N1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819127244	FE	On-Demand	Anodyne	L3MBTL3	44	38
CCO[C@@H](CCNC[C@H](O)c1ccc(C)cc1)C(C)C	ZINC000819127247	CG	On-Demand	Anodyne	ADRB2	15	49
CCO[C@@H](CCNC[C@@H](O)c1ccc(C)cc1)C(C)C	ZINC000819127248	CG	On-Demand	Anodyne	ADRB2	15	49
CS(=O)(=O)c1ccc([C@H](O)CNCC2CCC(C(F)(F)F)CC2)cc1	ZINC000819127259	GG	On-Demand	Anodyne	CTSK	15	41
CS(=O)(=O)c1ccc([C@@H](O)CNCC2CCC(C(F)(F)F)CC2)cc1	ZINC000819127260	GG	On-Demand	Anodyne	CTSK	15	41
CCOc1cc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)ccc1OC	ZINC000819127266	FF	On-Demand	Anodyne	SSTR5	17	40
CCOc1cc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)ccc1OC	ZINC000819127266	FF	On-Demand	Anodyne	ENPP1	71	35
CCOc1cc(NC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)ccc1OC	ZINC000819127267	FF	On-Demand	Anodyne	SSTR5	17	40
CCOc1cc(NC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)ccc1OC	ZINC000819127267	FF	On-Demand	Anodyne	ENPP1	71	35
C=CCCn1cc(C(=O)NCc2cccc(OC(C)C)c2)nn1	ZINC000819127268	DF	On-Demand	Mild	MMP13	24	44
O=C(/C=C/[C@@H]1CCCO1)Nc1cnn(C[C@@H]2CCCO2)c1	ZINC000819127290	CD	On-Demand	Anodyne	PANC	50	32
O=C(/C=C/[C@@H]1CCCO1)Nc1cnn(C[C@H]2CCCO2)c1	ZINC000819127291	CD	On-Demand	Anodyne	PANC	50	32
O=C(/C=C\[C@@H]1CCCO1)Nc1cnn(C[C@@H]2CCCO2)c1	ZINC000819127292	CD	On-Demand	Anodyne	PANC	50	32
O=C(/C=C\[C@@H]1CCCO1)Nc1cnn(C[C@H]2CCCO2)c1	ZINC000819127293	CD	On-Demand	Anodyne	PANC	50	32
O=C(Nc1cccc(OCCn2cncn2)c1)C(F)=C1CCC1	ZINC000819127294	DF	On-Demand	Anodyne	HMOX2	18	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cnn(C[C@H]2CCCO2)c1	ZINC000819127300	FD	On-Demand	Anodyne	PANC	60	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	ZINC000819127301	FD	On-Demand	Anodyne	PANC	60	39
CCO[C@@H](CCNC[C@@H](O)c1cccc(F)c1)C(C)C	ZINC000819127304	CF	On-Demand	Anodyne	ADRB1	29	48
CCO[C@@H](CCNC[C@@H](O)c1cccc(F)c1)C(C)C	ZINC000819127304	CF	On-Demand	Anodyne	ADRB3	43	48
CCO[C@@H](CCNC[C@H](O)c1cccc(F)c1)C(C)C	ZINC000819127305	CF	On-Demand	Anodyne	ADRB1	29	48
CCO[C@@H](CCNC[C@H](O)c1cccc(F)c1)C(C)C	ZINC000819127305	CF	On-Demand	Anodyne	ADRB3	43	48
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(OCCn2cncn2)c1	ZINC000819127324	EE	On-Demand	Anodyne	EPHX2	15	41
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(OCCn2cncn2)c1	ZINC000819127325	EE	On-Demand	Anodyne	EPHX2	15	41
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(OCCn2cncn2)c1	ZINC000819127326	EE	On-Demand	Anodyne	EPHX2	15	41
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(OCCn2cncn2)c1	ZINC000819127327	EE	On-Demand	Anodyne	EPHX2	15	41
O=C(CNC[C@H](O)c1cc(F)ccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127358	GG	On-Demand	Anodyne	GRIN2B	80	43
O=C(CNC[C@H](O)c1cc(F)ccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127358	GG	On-Demand	Anodyne	SIGMAR1	27	41
O=C(CNC[C@H](O)c1cc(F)ccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127358	GG	On-Demand	Anodyne	CCR3	82	55
O=C(CNC[C@H](O)c1cc(F)ccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127358	GG	On-Demand	Anodyne	GRIN2C	24	43
O=C(CNC[C@H](O)c1cc(F)ccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127358	GG	On-Demand	Anodyne	AMP1_PLAFQ	16	46
O=C(CNC[C@@H](O)c1cc(F)ccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127359	GG	On-Demand	Anodyne	GRIN2B	80	43
O=C(CNC[C@@H](O)c1cc(F)ccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127359	GG	On-Demand	Anodyne	SIGMAR1	27	41
O=C(CNC[C@@H](O)c1cc(F)ccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127359	GG	On-Demand	Anodyne	CCR3	82	55
O=C(CNC[C@@H](O)c1cc(F)ccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127359	GG	On-Demand	Anodyne	GRIN2C	24	43
O=C(CNC[C@@H](O)c1cc(F)ccc1F)N1CCC(Cc2ccccc2)CC1	ZINC000819127359	GG	On-Demand	Anodyne	AMP1_PLAFQ	16	46
COC[C@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(C)o1	ZINC000819127365	GF	On-Demand	Anodyne	GPR119	43	42
COC[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(C)o1	ZINC000819127366	GF	On-Demand	Anodyne	GPR119	43	42
COC[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(C)o1	ZINC000819127367	GF	On-Demand	Anodyne	GPR119	43	42
COC[C@@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(C)o1	ZINC000819127368	GF	On-Demand	Anodyne	GPR119	43	42
COC[C@@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccco1	ZINC000819127372	FF	On-Demand	Anodyne	GPR119	40	44
COC[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccco1	ZINC000819127373	FF	On-Demand	Anodyne	GPR119	40	44
COC[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccco1	ZINC000819127374	FF	On-Demand	Anodyne	GPR119	40	44
COC[C@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccco1	ZINC000819127375	FF	On-Demand	Anodyne	GPR119	40	44
O=C(CNC[C@H](O)c1ccccc1Cl)N1CCC(Cc2ccccc2)CC1	ZINC000819127407	GG	On-Demand	Anodyne	CHRM2	15	41
O=C(CNC[C@H](O)c1ccccc1Cl)N1CCC(Cc2ccccc2)CC1	ZINC000819127407	GG	On-Demand	Anodyne	DRD4	15	41
O=C(CNC[C@H](O)c1ccccc1Cl)N1CCC(Cc2ccccc2)CC1	ZINC000819127407	GG	On-Demand	Anodyne	OPRL1	35	40
O=C(CNC[C@H](O)c1ccccc1Cl)N1CCC(Cc2ccccc2)CC1	ZINC000819127407	GG	On-Demand	Anodyne	GRIN2B	78	43
O=C(CNC[C@H](O)c1ccccc1Cl)N1CCC(Cc2ccccc2)CC1	ZINC000819127407	GG	On-Demand	Anodyne	SIGMAR1	32	41
O=C(CNC[C@H](O)c1ccccc1Cl)N1CCC(Cc2ccccc2)CC1	ZINC000819127407	GG	On-Demand	Anodyne	CCR3	44	47
CC(C)(C)N1C[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CC1=O	ZINC000819127411	DE	On-Demand	Anodyne	ADRB3	20	45
CC(C)(C)N1C[C@H](NC[C@H](O)c2ccc(Cl)cc2)CC1=O	ZINC000819127412	DE	On-Demand	Anodyne	ADRB3	20	45
CON(C)C(=O)CCNCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819127415	ED	On-Demand	Anodyne	ACHE	16	42
CON(C)C(=O)CCNCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819127415	ED	On-Demand	Anodyne	GRIN2B	79	44
CON(C)C(=O)CCNCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819127415	ED	On-Demand	Anodyne	SIGMAR1	18	43
CON(C)C(=O)CCNCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819127415	ED	On-Demand	Anodyne	CCR3	39	41
CON(C)C(=O)CCNCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819127415	ED	On-Demand	Anodyne	CCR5	21	40
COC(=O)c1ccc(CCNC(=O)c2ccc3c(=O)n(CCc4ccccc4)c(S)nc3c2)cc1	ZINC000819127467	JH	On-Demand	Anodyne	PDE2A	17	40
COC(=O)c1ccc(CCNC(=O)c2ccc3c(=O)n(CCc4ccccc4)c(S)nc3c2)cc1	ZINC000819127467	JH	On-Demand	Anodyne	HDAC6	15	49
COC(=O)c1ccc(CCNC(=O)c2ccc3c(=O)n(CCc4ccccc4)c(S)nc3c2)cc1	ZINC000819127467	JH	On-Demand	Anodyne	POLR1A	51	32
O=[N+]([O-])c1cccc([C@H](O)CNCC2CCC(C(F)(F)F)CC2)c1	ZINC000819127470	EH	On-Demand	Bother	CACNA1D	59	38
O=[N+]([O-])c1cccc([C@@H](O)CNCC2CCC(C(F)(F)F)CC2)c1	ZINC000819127471	EH	On-Demand	Bother	CACNA1D	59	38
O=C(NCc1ccnc(N2CCN(c3ccc(F)cc3)CC2)c1)C(F)=C1CCC1	ZINC000819127517	GH	On-Demand	Anodyne	SLC27A1	44	38
NC(=O)C1CCN(Cc2cccc(NC(=O)C(F)=C3CCC3)c2)CC1	ZINC000819127530	EF	On-Demand	Anodyne	HRH2	31	40
NC(=O)C1CCN(Cc2cccc(NC(=O)C(F)=C3CCC3)c2)CC1	ZINC000819127530	EF	On-Demand	Anodyne	SIGMAR1	22	46
NC(=O)C1CCN(Cc2cccc(NC(=O)C(F)=C3CCC3)c2)CC1	ZINC000819127530	EF	On-Demand	Anodyne	CCR3	50	42
NC(=O)C1CCN(Cc2cccc(NC(=O)C(F)=C3CCC3)c2)CC1	ZINC000819127530	EF	On-Demand	Anodyne	MCHR1	26	41
CN1CCCN(c2ccc(NC(=O)Cc3nsc4ccccc34)cc2)CC1	ZINC000819127547	GH	On-Demand	Anodyne	HTR1A	24	44
CN1CCCN(c2ccc(NC(=O)Cc3nsc4ccccc34)cc2)CC1	ZINC000819127547	GH	On-Demand	Anodyne	DRD2	26	44
CN1CCCN(c2ccc(NC(=O)Cc3nsc4ccccc34)cc2)CC1	ZINC000819127547	GH	On-Demand	Anodyne	PRNP	39	44
C=CCCn1cc(C(=O)Nc2ccc(N3CCCN(C)CC3)cc2)nn1	ZINC000819127549	FE	On-Demand	Mild	PRNP	41	45
COC(=O)c1ccc(CCNC(=O)c2ccc[n+]([O-])c2)cc1	ZINC000819127550	DD	On-Demand	Anodyne	CA2	18	47
COC(=O)c1ccc(CCNC(=O)c2ccc[n+]([O-])c2)cc1	ZINC000819127550	DD	On-Demand	Anodyne	CA1	17	47
CSc1ccc(F)cc1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819127575	GH	On-Demand	Anodyne	GPR119	56	64
CSc1ccc(F)cc1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819127576	GH	On-Demand	Anodyne	GPR119	56	64
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2cccnc2)CC1	ZINC000819127580	DD	On-Demand	Anodyne	L3MBTL3	42	35
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2cccnc2)CC1	ZINC000819127582	DD	On-Demand	Anodyne	L3MBTL3	42	35
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2cccnc2)CC1	ZINC000819127583	DD	On-Demand	Anodyne	L3MBTL3	42	35
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2cccnc2)CC1	ZINC000819127584	DD	On-Demand	Anodyne	L3MBTL3	42	35
Cc1nc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cs1	ZINC000819127585	FF	On-Demand	Mild	PAPA1_CARPA	46	49
Cc1nc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cs1	ZINC000819127587	FF	On-Demand	Mild	PAPA1_CARPA	46	49
CC(C)(C)N1C[C@H](NC[C@H](O)c2ccc(C#N)cc2)CC1=O	ZINC000819127613	DD	On-Demand	Mild	CTRB_BOVIN	43	30
CC(C)(C)N1C[C@@H](NC[C@H](O)c2ccc(C#N)cc2)CC1=O	ZINC000819127614	DD	On-Demand	Mild	CTRB_BOVIN	43	30
CC(C)(C)N1C[C@H](NC[C@@H](O)c2ccc(C#N)cc2)CC1=O	ZINC000819127615	DD	On-Demand	Mild	CTRB_BOVIN	43	30
CC(C)(C)N1C[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)CC1=O	ZINC000819127617	DD	On-Demand	Mild	CTRB_BOVIN	43	30
CC(C)(C)N1C[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1=O	ZINC000819127633	FD	On-Demand	Anodyne	ADRB3	17	46
CC(C)(C)N1C[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1=O	ZINC000819127634	FD	On-Demand	Anodyne	ADRB3	17	46
CC(C)(C)N1C[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1=O	ZINC000819127635	FD	On-Demand	Anodyne	ADRB3	17	46
CC(C)(C)N1C[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1=O	ZINC000819127637	FD	On-Demand	Anodyne	ADRB3	17	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)Cc1cccc(C(F)(F)F)c1)C2	ZINC000819127644	GH	On-Demand	Anodyne	TACR1	35	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)Cc1cccc(C(F)(F)F)c1)C2	ZINC000819127644	GH	On-Demand	Anodyne	CCR2	91	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)Cc1cccc(C(F)(F)F)c1)C2	ZINC000819127646	GH	On-Demand	Anodyne	TACR1	35	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)Cc1cccc(C(F)(F)F)c1)C2	ZINC000819127646	GH	On-Demand	Anodyne	CCR2	91	41
CON(C)C(=O)CCNC[C@@H](c1ccc(Cl)cc1)N(C)C	ZINC000819127652	DD	On-Demand	Anodyne	UTS2	42	33
CON(C)C(=O)CCNC[C@H](c1ccc(Cl)cc1)N(C)C	ZINC000819127653	DD	On-Demand	Anodyne	UTS2	42	33
CCCN(CC)CCNC[C@H](O)c1cccnc1	ZINC000819127658	CD	On-Demand	Anodyne	ADRB2	26	47
CCCN(CC)CCNC[C@H](O)c1cccnc1	ZINC000819127658	CD	On-Demand	Anodyne	ADRB1	28	47
CCCN(CC)CCNC[C@H](O)c1cccnc1	ZINC000819127658	CD	On-Demand	Anodyne	ADRB3	101	49
CCCN(CC)CCNC[C@H](O)c1cccnc1	ZINC000819127658	CD	On-Demand	Anodyne	CYP51A1	20	49
CCCN(CC)CCNC[C@@H](O)c1cccnc1	ZINC000819127659	CD	On-Demand	Anodyne	ADRB2	26	47
CCCN(CC)CCNC[C@@H](O)c1cccnc1	ZINC000819127659	CD	On-Demand	Anodyne	ADRB1	28	47
CCCN(CC)CCNC[C@@H](O)c1cccnc1	ZINC000819127659	CD	On-Demand	Anodyne	ADRB3	101	49
CCCN(CC)CCNC[C@@H](O)c1cccnc1	ZINC000819127659	CD	On-Demand	Anodyne	CYP51A1	20	49
CC(C)(C)N1C[C@@H](NC[C@H](O)c2cccc(Br)c2)CC1=O	ZINC000819127661	FE	On-Demand	Anodyne	ADRB3	22	40
CC(C)(C)N1C[C@H](NC[C@H](O)c2cccc(Br)c2)CC1=O	ZINC000819127662	FE	On-Demand	Anodyne	ADRB3	22	40
CC(C)(C)N1C[C@@H](NC[C@@H](O)c2cccc(Br)c2)CC1=O	ZINC000819127663	FE	On-Demand	Anodyne	ADRB3	22	40
CC(C)(C)N1C[C@H](NC[C@@H](O)c2cccc(Br)c2)CC1=O	ZINC000819127664	FE	On-Demand	Anodyne	ADRB3	22	40
O=C(CNC[C@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127687	FE	On-Demand	Anodyne	ADRB2	24	46
O=C(CNC[C@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127687	FE	On-Demand	Anodyne	ADRB1	31	43
O=C(CNC[C@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127687	FE	On-Demand	Anodyne	GRIN2B	80	45
O=C(CNC[C@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127687	FE	On-Demand	Anodyne	ADRB3	103	46
O=C(CNC[C@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127687	FE	On-Demand	Anodyne	PTAFR	29	52
O=C(CNC[C@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127687	FE	On-Demand	Anodyne	CCR3	28	40
O=C(CNC[C@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127687	FE	On-Demand	Anodyne	CHRNA7	41	39
O=C(CNC[C@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127687	FE	On-Demand	Anodyne	C3AR1	49	49
O=C(CNC[C@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127687	FE	On-Demand	Anodyne	GRIN2C	19	40
O=C(CNC[C@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127687	FE	On-Demand	Anodyne	SCD	34	41
O=C(CNC[C@@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127688	FE	On-Demand	Anodyne	ADRB2	24	46
O=C(CNC[C@@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127688	FE	On-Demand	Anodyne	ADRB1	31	43
O=C(CNC[C@@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127688	FE	On-Demand	Anodyne	GRIN2B	80	45
O=C(CNC[C@@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127688	FE	On-Demand	Anodyne	ADRB3	103	46
O=C(CNC[C@@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127688	FE	On-Demand	Anodyne	PTAFR	29	52
O=C(CNC[C@@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127688	FE	On-Demand	Anodyne	CCR3	28	40
O=C(CNC[C@@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127688	FE	On-Demand	Anodyne	CHRNA7	41	39
O=C(CNC[C@@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127688	FE	On-Demand	Anodyne	C3AR1	49	49
O=C(CNC[C@@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127688	FE	On-Demand	Anodyne	GRIN2C	19	40
O=C(CNC[C@@H](O)c1cccnc1)N1CCC(Cc2ccccc2)CC1	ZINC000819127688	FE	On-Demand	Anodyne	SCD	34	41
COC(=O)c1ccsc1N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1=O	ZINC000819127710	GE	On-Demand	Anodyne	ADRB3	29	40
COC(=O)c1ccsc1N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1=O	ZINC000819127711	GE	On-Demand	Anodyne	ADRB3	29	40
COC(=O)c1ccsc1N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1=O	ZINC000819127712	GE	On-Demand	Anodyne	ADRB3	29	40
COC(=O)c1ccsc1N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1=O	ZINC000819127713	GE	On-Demand	Anodyne	ADRB3	29	40
CC(=O)Nc1cccc(CC(=O)N(CCc2ccccc2)CCN(C)C)c1	ZINC000819127727	FF	On-Demand	Anodyne	KCNK3	42	35
Cn1cccc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819127740	FF	On-Demand	Anodyne	CTSD	71	43
Cn1cccc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819127740	FF	On-Demand	Anodyne	PGC	59	38
Cn1cccc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819127740	FF	On-Demand	Anodyne	PAPA1_CARPA	32	44
Cn1cccc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819127740	FF	On-Demand	Anodyne	BACE2	49	39
Cn1cccc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819127740	FF	On-Demand	Anodyne	TACR3	15	40
Cn1cccc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819127740	FF	On-Demand	Anodyne	REN	75	47
Cn1cccc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819127740	FF	On-Demand	Anodyne	REN1	20	45
Cn1cccc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819127740	FF	On-Demand	Anodyne	BACE1	74	43
Cn1cccc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819127740	FF	On-Demand	Anodyne	FPR1	50	40
COC(=O)c1ccc(CCNC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1	ZINC000819127761	HH	On-Demand	Clean	CTSL	22	40
COC(=O)c1ccc(CCNC(=O)c2cc(C)n(-c3ccc(OC)cc3)c2C)cc1	ZINC000819127761	HH	On-Demand	Clean	SLC6A5	18	43
CON(C)C(=O)CCNCc1cc(N(C)C)nc2ccccc12	ZINC000819127793	DD	On-Demand	Anodyne	METG	79	38
COC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819127819	FG	On-Demand	Anodyne	ADRB2	25	51
COC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819127819	FG	On-Demand	Anodyne	ADRB1	19	40
COC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819127819	FG	On-Demand	Anodyne	ADRB3	29	41
COC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819127820	FG	On-Demand	Anodyne	ADRB2	25	51
COC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819127820	FG	On-Demand	Anodyne	ADRB1	19	40
COC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819127820	FG	On-Demand	Anodyne	ADRB3	29	41
COC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819127822	FG	On-Demand	Anodyne	ADRB2	25	51
COC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819127822	FG	On-Demand	Anodyne	ADRB1	19	40
COC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819127822	FG	On-Demand	Anodyne	ADRB3	29	41
COC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819127823	FG	On-Demand	Anodyne	ADRB2	25	51
COC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819127823	FG	On-Demand	Anodyne	ADRB1	19	40
COC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819127823	FG	On-Demand	Anodyne	ADRB3	29	41
CN(C)[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819127837	DF	On-Demand	Anodyne	ADRB2	21	42
CN(C)[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819127837	DF	On-Demand	Anodyne	ADRB1	28	42
CN(C)[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819127837	DF	On-Demand	Anodyne	ADRB3	92	49
CN(C)[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819127839	DF	On-Demand	Anodyne	ADRB2	21	42
CN(C)[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819127839	DF	On-Demand	Anodyne	ADRB1	28	42
CN(C)[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819127839	DF	On-Demand	Anodyne	ADRB3	92	49
CSc1ccc(F)cc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819127841	EI	On-Demand	Anodyne	ADRB2	21	42
CSc1ccc(F)cc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819127841	EI	On-Demand	Anodyne	ADRB1	36	44
CSc1ccc(F)cc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819127841	EI	On-Demand	Anodyne	ADRB3	48	44
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127842	GG	On-Demand	Anodyne	ADRB2	33	41
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127842	GG	On-Demand	Anodyne	ADRB1	57	48
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127842	GG	On-Demand	Anodyne	SLC6A3	15	43
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127842	GG	On-Demand	Anodyne	GRIN2B	76	41
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127842	GG	On-Demand	Anodyne	ADRB3	74	48
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127842	GG	On-Demand	Anodyne	SIGMAR1	21	50
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127842	GG	On-Demand	Anodyne	CCR3	45	48
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127842	GG	On-Demand	Anodyne	CCR5	18	44
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127842	GG	On-Demand	Anodyne	C3AR1	37	41
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127842	GG	On-Demand	Anodyne	CYP3A4	45	34
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127842	GG	On-Demand	Anodyne	GRIN2C	22	40
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127843	GG	On-Demand	Anodyne	ADRB2	33	41
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127843	GG	On-Demand	Anodyne	ADRB1	57	48
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127843	GG	On-Demand	Anodyne	SLC6A3	15	43
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127843	GG	On-Demand	Anodyne	GRIN2B	76	41
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127843	GG	On-Demand	Anodyne	ADRB3	74	48
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127843	GG	On-Demand	Anodyne	SIGMAR1	21	50
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127843	GG	On-Demand	Anodyne	CCR3	45	48
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127843	GG	On-Demand	Anodyne	CCR5	18	44
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127843	GG	On-Demand	Anodyne	C3AR1	37	41
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127843	GG	On-Demand	Anodyne	CYP3A4	45	34
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCC(Cc2ccccc2)CC1	ZINC000819127843	GG	On-Demand	Anodyne	GRIN2C	22	40
CSc1ccc(F)cc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819127845	EI	On-Demand	Anodyne	ADRB2	21	42
CSc1ccc(F)cc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819127845	EI	On-Demand	Anodyne	ADRB1	36	44
CSc1ccc(F)cc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819127845	EI	On-Demand	Anodyne	ADRB3	48	44
Cc1ccc(OC[C@@H](O)CNCC(C)(C)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819127880	FF	On-Demand	Anodyne	ADRB2	27	48
Cc1ccc(OC[C@@H](O)CNCC(C)(C)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819127880	FF	On-Demand	Anodyne	VDR	17	40
Cc1ccc(OC[C@H](O)CNCC(C)(C)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819127881	FF	On-Demand	Anodyne	ADRB2	27	48
Cc1ccc(OC[C@H](O)CNCC(C)(C)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819127881	FF	On-Demand	Anodyne	VDR	17	40
COC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819127895	DE	On-Demand	Mild	ADRB3	26	48
COC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819127895	DE	On-Demand	Mild	CTRB_BOVIN	50	35
COC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819127896	DE	On-Demand	Mild	ADRB3	26	48
COC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819127896	DE	On-Demand	Mild	CTRB_BOVIN	50	35
COC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819127898	DE	On-Demand	Mild	ADRB3	26	48
COC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819127898	DE	On-Demand	Mild	CTRB_BOVIN	50	35
COC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819127900	DE	On-Demand	Mild	ADRB3	26	48
COC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819127900	DE	On-Demand	Mild	CTRB_BOVIN	50	35
O[C@H](CNCc1c(F)cccc1OC(F)F)c1cccnc1	ZINC000819127903	DF	On-Demand	Anodyne	ADRB1	20	43
O[C@H](CNCc1c(F)cccc1OC(F)F)c1cccnc1	ZINC000819127903	DF	On-Demand	Anodyne	ADRB3	74	43
O[C@@H](CNCc1c(F)cccc1OC(F)F)c1cccnc1	ZINC000819127904	DF	On-Demand	Anodyne	ADRB1	20	43
O[C@@H](CNCc1c(F)cccc1OC(F)F)c1cccnc1	ZINC000819127904	DF	On-Demand	Anodyne	ADRB3	74	43
O[C@@H](CNCCc1cc(F)ccc1F)c1ccc(OC(F)(F)F)cc1	ZINC000819127923	FH	On-Demand	Anodyne	ADRB2	31	44
O[C@@H](CNCCc1cc(F)ccc1F)c1ccc(OC(F)(F)F)cc1	ZINC000819127923	FH	On-Demand	Anodyne	ADRB3	38	42
O[C@H](CNCCc1cc(F)ccc1F)c1ccc(OC(F)(F)F)cc1	ZINC000819127924	FH	On-Demand	Anodyne	ADRB2	31	44
O[C@H](CNCCc1cc(F)ccc1F)c1ccc(OC(F)(F)F)cc1	ZINC000819127924	FH	On-Demand	Anodyne	ADRB3	38	42
O[C@@H](CNCCc1cc(F)ccc1F)c1cccc(F)c1	ZINC000819127925	CF	On-Demand	Anodyne	ADRB2	42	44
O[C@@H](CNCCc1cc(F)ccc1F)c1cccc(F)c1	ZINC000819127925	CF	On-Demand	Anodyne	ADRB1	42	46
O[C@@H](CNCCc1cc(F)ccc1F)c1cccc(F)c1	ZINC000819127925	CF	On-Demand	Anodyne	ADRB3	74	47
O[C@H](CNCCc1cc(F)ccc1F)c1cccc(F)c1	ZINC000819127926	CF	On-Demand	Anodyne	ADRB2	42	44
O[C@H](CNCCc1cc(F)ccc1F)c1cccc(F)c1	ZINC000819127926	CF	On-Demand	Anodyne	ADRB1	42	46
O[C@H](CNCCc1cc(F)ccc1F)c1cccc(F)c1	ZINC000819127926	CF	On-Demand	Anodyne	ADRB3	74	47
O[C@@H](CNCCc1cc(F)ccc1F)c1cccnc1	ZINC000819127935	CE	On-Demand	Anodyne	ADRB2	45	51
O[C@@H](CNCCc1cc(F)ccc1F)c1cccnc1	ZINC000819127935	CE	On-Demand	Anodyne	ADRB1	49	55
O[C@@H](CNCCc1cc(F)ccc1F)c1cccnc1	ZINC000819127935	CE	On-Demand	Anodyne	ADRB3	136	55
O[C@H](CNCCc1cc(F)ccc1F)c1cccnc1	ZINC000819127936	CE	On-Demand	Anodyne	ADRB2	45	51
O[C@H](CNCCc1cc(F)ccc1F)c1cccnc1	ZINC000819127936	CE	On-Demand	Anodyne	ADRB1	49	55
O[C@H](CNCCc1cc(F)ccc1F)c1cccnc1	ZINC000819127936	CE	On-Demand	Anodyne	ADRB3	136	55
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cc(F)ccc2F)cc1	ZINC000819127946	DF	On-Demand	Bother	ADRB2	22	41
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cc(F)ccc2F)cc1	ZINC000819127947	DF	On-Demand	Bother	ADRB2	22	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCc2ccccc2)c1	ZINC000819127958	DE	On-Demand	Bother	ADRB2	52	46
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCc2ccccc2)c1	ZINC000819127958	DE	On-Demand	Bother	ADRB1	61	46
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCc2ccccc2)c1	ZINC000819127958	DE	On-Demand	Bother	CACNA1C	29	44
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCc2ccccc2)c1	ZINC000819127958	DE	On-Demand	Bother	ADRB3	76	46
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCc2ccccc2)c1	ZINC000819127958	DE	On-Demand	Bother	CACNA1D	49	44
O=[N+]([O-])c1cccc([C@H](O)CNCCOCc2ccccc2)c1	ZINC000819127959	DE	On-Demand	Bother	ADRB2	52	46
O=[N+]([O-])c1cccc([C@H](O)CNCCOCc2ccccc2)c1	ZINC000819127959	DE	On-Demand	Bother	ADRB1	61	46
O=[N+]([O-])c1cccc([C@H](O)CNCCOCc2ccccc2)c1	ZINC000819127959	DE	On-Demand	Bother	CACNA1C	29	44
O=[N+]([O-])c1cccc([C@H](O)CNCCOCc2ccccc2)c1	ZINC000819127959	DE	On-Demand	Bother	ADRB3	76	46
O=[N+]([O-])c1cccc([C@H](O)CNCCOCc2ccccc2)c1	ZINC000819127959	DE	On-Demand	Bother	CACNA1D	49	44
Cc1cc(F)ccc1[C@@H](O)CNC1CCN(CCOC(C)C)CC1	ZINC000819127975	EF	On-Demand	Anodyne	SLC6A3	27	40
O[C@@H](CNCCc1cc(F)ccc1F)c1cccc(Cl)c1	ZINC000819127984	DG	On-Demand	Anodyne	ADRB2	62	43
O[C@@H](CNCCc1cc(F)ccc1F)c1cccc(Cl)c1	ZINC000819127984	DG	On-Demand	Anodyne	ADRB1	68	56
O[C@@H](CNCCc1cc(F)ccc1F)c1cccc(Cl)c1	ZINC000819127984	DG	On-Demand	Anodyne	ADRB3	91	58
O[C@H](CNCCc1cc(F)ccc1F)c1cccc(Cl)c1	ZINC000819127985	DG	On-Demand	Anodyne	ADRB2	62	43
O[C@H](CNCCc1cc(F)ccc1F)c1cccc(Cl)c1	ZINC000819127985	DG	On-Demand	Anodyne	ADRB1	68	56
O[C@H](CNCCc1cc(F)ccc1F)c1cccc(Cl)c1	ZINC000819127985	DG	On-Demand	Anodyne	ADRB3	91	58
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](C)c1ccccc1	ZINC000819127998	GH	On-Demand	Anodyne	GRIN2B	17	43
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](C)c1ccccc1	ZINC000819127998	GH	On-Demand	Anodyne	CCR8	21	40
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)[C@@H](C)c1ccccc1	ZINC000819127998	GH	On-Demand	Anodyne	GPR119	48	52
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)[C@H](C)c1ccccc1	ZINC000819127999	GH	On-Demand	Anodyne	GRIN2B	17	43
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)[C@H](C)c1ccccc1	ZINC000819127999	GH	On-Demand	Anodyne	CCR8	21	40
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)[C@H](C)c1ccccc1	ZINC000819127999	GH	On-Demand	Anodyne	GPR119	48	52
O[C@@H](CNCCOCc1ccccc1)c1ccc(Br)cc1	ZINC000819128004	FG	On-Demand	Anodyne	ADRB2	54	53
O[C@@H](CNCCOCc1ccccc1)c1ccc(Br)cc1	ZINC000819128004	FG	On-Demand	Anodyne	ADRB1	51	53
O[C@@H](CNCCOCc1ccccc1)c1ccc(Br)cc1	ZINC000819128004	FG	On-Demand	Anodyne	ADRB3	54	53
O[C@H](CNCCOCc1ccccc1)c1ccc(Br)cc1	ZINC000819128005	FG	On-Demand	Anodyne	ADRB2	54	53
O[C@H](CNCCOCc1ccccc1)c1ccc(Br)cc1	ZINC000819128005	FG	On-Demand	Anodyne	ADRB1	51	53
O[C@H](CNCCOCc1ccccc1)c1ccc(Br)cc1	ZINC000819128005	FG	On-Demand	Anodyne	ADRB3	54	53
C[C@@H](CC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)n1cccn1	ZINC000819128024	GG	On-Demand	Clean	STAT6	46	31
C[C@H](CC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F)n1cccn1	ZINC000819128025	GG	On-Demand	Clean	STAT6	46	31
C=CCC1(C(=O)Nc2ccc(N3CCCN(C)CC3)cc2)CCOCC1	ZINC000819128036	FG	On-Demand	Mild	PRNP	33	43
CCOC(=O)CCCCCCNC(=O)[C@H]1CCCC[C@H]1C	ZINC000819128048	CG	On-Demand	Anodyne	EPHX2	16	49
CCOC(=O)CCCCCCNC(=O)[C@H]1CCCC[C@@H]1C	ZINC000819128049	CG	On-Demand	Anodyne	EPHX2	16	49
CCOC(=O)CCCCCCNC(=O)[C@@H]1CCCC[C@H]1C	ZINC000819128050	CG	On-Demand	Anodyne	EPHX2	16	49
CCOC(=O)CCCCCCNC(=O)[C@@H]1CCCC[C@@H]1C	ZINC000819128051	CG	On-Demand	Anodyne	EPHX2	16	49
C[C@@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)c1cccc(-n2cccn2)c1	ZINC000819128062	FF	On-Demand	Anodyne	AMP1_PLAFQ	53	41
C[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)c1cccc(-n2cccn2)c1	ZINC000819128065	FF	On-Demand	Anodyne	AMP1_PLAFQ	53	41
CCC(CC)(CNC[C@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819128077	EG	On-Demand	Anodyne	ADRB3	42	37
CCC(CC)(CNC[C@@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819128078	EG	On-Demand	Anodyne	ADRB3	42	37
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCCN(C)CC2)cc1	ZINC000819128084	DG	On-Demand	Mild	PRNP	40	47
COC(=O)c1ccc(CCNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)cc1	ZINC000819128085	JF	On-Demand	Anodyne	DRD4	45	37
COC(=O)c1ccc(CCNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)cc1	ZINC000819128085	JF	On-Demand	Anodyne	CA1	17	58
COC(=O)c1ccc(CCNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)cc1	ZINC000819128085	JF	On-Demand	Anodyne	CA7	18	40
COC(=O)c1ccc(CCNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)cc1	ZINC000819128085	JF	On-Demand	Anodyne	EPHX2	16	41
COC(=O)c1ccc(CCNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)cc1	ZINC000819128085	JF	On-Demand	Anodyne	TGM2	24	43
COC(=O)c1ccc(CCNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)cc1	ZINC000819128085	JF	On-Demand	Anodyne	CACNA1I	51	38
COC(=O)c1ccc(CCNC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)cc1	ZINC000819128085	JF	On-Demand	Anodyne	NAMPT	21	41
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	CA2	27	52
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	PRSS1	19	46
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	ADRB1	36	44
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	DRD3	22	45
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	GCGR	39	43
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	PPARA	15	44
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	ADRB3	55	40
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	MME	54	41
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	NQO2	18	43
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	CA1	18	49
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	CTSL	27	44
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	HDAC8	16	48
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	PRNP	23	41
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	CA5B	16	40
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	MTNR1B	21	41
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	MMP2	18	42
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	MMP3	22	42
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	HDAC1	26	49
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	HDAC2	21	59
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	HDAC6	20	59
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	FAAH	33	47
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	PLM2_PLAFA	21	43
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	HAO1	40	31
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	CRTM	29	48
COC(=O)c1ccc(CCNC(=O)c2ccc(-c3ccccc3)cc2)cc1	ZINC000819128097	FI	On-Demand	Anodyne	KDM4E	22	44
O=C(/C=C/[C@@H]1CCCO1)NCCC(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000819128151	GD	On-Demand	Anodyne	SSTR1	29	41
O=C(/C=C\[C@H]1CCCO1)NCCC(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000819128152	GD	On-Demand	Anodyne	SSTR1	29	41
O=C(/C=C/[C@H]1CCCO1)NCCC(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000819128153	GD	On-Demand	Anodyne	SSTR1	29	41
O=C(/C=C\[C@@H]1CCCO1)NCCC(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000819128154	GD	On-Demand	Anodyne	SSTR1	29	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000819128161	GI	On-Demand	Anodyne	SCD	33	48
O=C(/C=C/[C@H]1CCCO1)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000819128162	GI	On-Demand	Anodyne	SCD	33	48
O=C(/C=C/[C@@H]1CCCO1)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000819128163	GI	On-Demand	Anodyne	SCD	33	48
O=C(/C=C\[C@H]1CCCO1)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1	ZINC000819128164	GI	On-Demand	Anodyne	SCD	33	48
O[C@@H](CNCCc1cc(F)ccc1F)c1ccc(C(F)(F)F)cc1	ZINC000819128173	EH	On-Demand	Anodyne	ADRB2	21	43
O[C@H](CNCCc1cc(F)ccc1F)c1ccc(C(F)(F)F)cc1	ZINC000819128174	EH	On-Demand	Anodyne	ADRB2	21	43
O[C@@H](CNCCc1cc(F)ccc1F)c1ccc(F)c(F)c1	ZINC000819128201	DG	On-Demand	Anodyne	ADRB2	33	47
O[C@@H](CNCCc1cc(F)ccc1F)c1ccc(F)c(F)c1	ZINC000819128201	DG	On-Demand	Anodyne	ADRB3	40	43
O[C@H](CNCCc1cc(F)ccc1F)c1ccc(F)c(F)c1	ZINC000819128202	DG	On-Demand	Anodyne	ADRB2	33	47
O[C@H](CNCCc1cc(F)ccc1F)c1ccc(F)c(F)c1	ZINC000819128202	DG	On-Demand	Anodyne	ADRB3	40	43
O[C@@H](CNCCc1cc(F)ccc1F)c1ccc(Cl)c(F)c1	ZINC000819128203	EH	On-Demand	Anodyne	ADRB2	28	44
O[C@@H](CNCCc1cc(F)ccc1F)c1ccc(Cl)c(F)c1	ZINC000819128203	EH	On-Demand	Anodyne	ADRB1	24	41
O[C@@H](CNCCc1cc(F)ccc1F)c1ccc(Cl)c(F)c1	ZINC000819128203	EH	On-Demand	Anodyne	ADRB3	32	42
O[C@H](CNCCc1cc(F)ccc1F)c1ccc(Cl)c(F)c1	ZINC000819128204	EH	On-Demand	Anodyne	ADRB2	28	44
O[C@H](CNCCc1cc(F)ccc1F)c1ccc(Cl)c(F)c1	ZINC000819128204	EH	On-Demand	Anodyne	ADRB1	24	41
O[C@H](CNCCc1cc(F)ccc1F)c1ccc(Cl)c(F)c1	ZINC000819128204	EH	On-Demand	Anodyne	ADRB3	32	42
CCC(CC)(CNC[C@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819128232	FH	On-Demand	Anodyne	ADRB1	21	42
CCC(CC)(CNC[C@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819128232	FH	On-Demand	Anodyne	ADRB3	27	42
CCC(CC)(CNC[C@@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819128233	FH	On-Demand	Anodyne	ADRB1	21	42
CCC(CC)(CNC[C@@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819128233	FH	On-Demand	Anodyne	ADRB3	27	42
CCO[C@@H](CCNC[C@@H](O)c1cccc(F)c1)C1CCCC1	ZINC000819128260	DG	On-Demand	Anodyne	ADRB1	34	42
CCO[C@@H](CCNC[C@@H](O)c1cccc(F)c1)C1CCCC1	ZINC000819128260	DG	On-Demand	Anodyne	ADRB3	46	42
CCO[C@@H](CCNC[C@H](O)c1cccc(F)c1)C1CCCC1	ZINC000819128263	DG	On-Demand	Anodyne	ADRB1	34	42
CCO[C@@H](CCNC[C@H](O)c1cccc(F)c1)C1CCCC1	ZINC000819128263	DG	On-Demand	Anodyne	ADRB3	46	42
O[C@H](CNCCOCc1ccccc1)c1cc2ccccc2o1	ZINC000819128267	DG	On-Demand	Anodyne	ADRB2	33	44
O[C@H](CNCCOCc1ccccc1)c1cc2ccccc2o1	ZINC000819128267	DG	On-Demand	Anodyne	ADRB1	29	44
O[C@H](CNCCOCc1ccccc1)c1cc2ccccc2o1	ZINC000819128267	DG	On-Demand	Anodyne	ADRB3	28	44
Cn1cccc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819128301	CD	On-Demand	Bother	CACNA1D	49	33
Cn1cccc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819128303	CD	On-Demand	Bother	CACNA1D	49	33
CCO[C@@H](CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)C1CCCC1	ZINC000819128306	FF	On-Demand	Anodyne	ADRB2	19	42
CCO[C@@H](CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)C1CCCC1	ZINC000819128306	FF	On-Demand	Anodyne	ADRB3	41	38
CN1CCCN(c2ccc(NC(=O)c3coc(=O)c4ccccc34)cc2)CC1	ZINC000819128307	GG	On-Demand	Anodyne	HTR1B	15	49
CN1CCCN(c2ccc(NC(=O)c3coc(=O)c4ccccc34)cc2)CC1	ZINC000819128307	GG	On-Demand	Anodyne	LCK	20	42
CN1CCCN(c2ccc(NC(=O)c3coc(=O)c4ccccc34)cc2)CC1	ZINC000819128307	GG	On-Demand	Anodyne	PRNP	43	51
CCO[C@@H](CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)C1CCCC1	ZINC000819128308	FF	On-Demand	Anodyne	ADRB2	19	42
CCO[C@@H](CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)C1CCCC1	ZINC000819128308	FF	On-Demand	Anodyne	ADRB3	41	38
CN1CCCN(c2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cc2)CC1	ZINC000819128320	EF	On-Demand	Anodyne	PRNP	38	43
CN1CCCN(c2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cc2)CC1	ZINC000819128320	EF	On-Demand	Anodyne	MTOR	25	43
CN1CCCN(c2ccc(NC(=O)/C=C\[C@H]3CCCO3)cc2)CC1	ZINC000819128322	EF	On-Demand	Anodyne	PRNP	38	43
CN1CCCN(c2ccc(NC(=O)/C=C\[C@H]3CCCO3)cc2)CC1	ZINC000819128322	EF	On-Demand	Anodyne	MTOR	25	43
O[C@@H](CNC1CCN(C2CCCCC2)CC1)c1cccc2ccccc12	ZINC000819128323	FI	On-Demand	Anodyne	SIGMAR1	15	44
CN1CCCN(c2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cc2)CC1	ZINC000819128324	EF	On-Demand	Anodyne	PRNP	38	43
CN1CCCN(c2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cc2)CC1	ZINC000819128324	EF	On-Demand	Anodyne	MTOR	25	43
CN1CCCN(c2ccc(NC(=O)/C=C/[C@H]3CCCO3)cc2)CC1	ZINC000819128325	EF	On-Demand	Anodyne	PRNP	38	43
CN1CCCN(c2ccc(NC(=O)/C=C/[C@H]3CCCO3)cc2)CC1	ZINC000819128325	EF	On-Demand	Anodyne	MTOR	25	43
Cc1ccccc1[C@@H](O)CNC1CCN(CCOC(C)C)CC1	ZINC000819128334	DF	On-Demand	Anodyne	SLC6A3	20	43
O=C(/C=C\[C@@H]1CCCO1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819128338	EH	On-Demand	Anodyne	CDK5	46	37
O=C(/C=C\[C@@H]1CCCO1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819128338	EH	On-Demand	Anodyne	SCD	31	40
CN(C[C@@H](O)CNCc1cc(N(C)C)nc2ccccc12)C(=O)OC(C)(C)C	ZINC000819128339	GF	On-Demand	Anodyne	METG	50	31
O=C(/C=C/[C@H]1CCCO1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819128340	EH	On-Demand	Anodyne	CDK5	46	37
O=C(/C=C/[C@H]1CCCO1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819128340	EH	On-Demand	Anodyne	SCD	31	40
CN(C[C@H](O)CNCc1cc(N(C)C)nc2ccccc12)C(=O)OC(C)(C)C	ZINC000819128341	GF	On-Demand	Anodyne	METG	50	31
O=C(/C=C/[C@@H]1CCCO1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819128342	EH	On-Demand	Anodyne	CDK5	46	37
O=C(/C=C/[C@@H]1CCCO1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819128342	EH	On-Demand	Anodyne	SCD	31	40
O=C(/C=C\[C@H]1CCCO1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819128343	EH	On-Demand	Anodyne	CDK5	46	37
O=C(/C=C\[C@H]1CCCO1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819128343	EH	On-Demand	Anodyne	SCD	31	40
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCCN(C)CC2)cc1	ZINC000819128356	EH	On-Demand	Anodyne	LCK	17	42
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCCN(C)CC2)cc1	ZINC000819128356	EH	On-Demand	Anodyne	PRNP	38	45
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCCN(C)CC2)cc1	ZINC000819128356	EH	On-Demand	Anodyne	MTOR	21	42
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCCN(C)CC2)cc1	ZINC000819128356	EH	On-Demand	Anodyne	HCK	17	42
COc1ccc(OC)c([C@H](O)CNC2CCN(CCOC(C)C)CC2)c1	ZINC000819128357	FE	On-Demand	Anodyne	EHMT2	43	30
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCCN(C)CC2)cc1	ZINC000819128363	EH	On-Demand	Anodyne	LCK	17	42
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCCN(C)CC2)cc1	ZINC000819128363	EH	On-Demand	Anodyne	PRNP	38	45
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCCN(C)CC2)cc1	ZINC000819128363	EH	On-Demand	Anodyne	MTOR	21	42
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCCN(C)CC2)cc1	ZINC000819128363	EH	On-Demand	Anodyne	HCK	17	42
C[C@@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)c1ccc(-n2cccn2)cc1	ZINC000819128371	FF	On-Demand	Anodyne	AMP1_PLAFQ	63	50
C=CCC1(C(=O)Nc2ncc(Cc3cccc(OC)c3)s2)CCOCC1	ZINC000819128372	FI	On-Demand	Mild	SCD1	38	41
C=CCC1(C(=O)Nc2ncc(Cc3cccc(OC)c3)s2)CCOCC1	ZINC000819128372	FI	On-Demand	Mild	SCD	35	50
O=C(/C=C\[C@@H]1CCCO1)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000819128376	EI	On-Demand	Anodyne	SCD1	38	49
O=C(/C=C\[C@@H]1CCCO1)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000819128376	EI	On-Demand	Anodyne	SCD	33	49
O=C(/C=C\[C@H]1CCCO1)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000819128377	EI	On-Demand	Anodyne	SCD1	38	49
O=C(/C=C\[C@H]1CCCO1)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000819128377	EI	On-Demand	Anodyne	SCD	33	49
O=C(/C=C/[C@H]1CCCO1)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000819128378	EI	On-Demand	Anodyne	SCD1	38	49
O=C(/C=C/[C@H]1CCCO1)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000819128378	EI	On-Demand	Anodyne	SCD	33	49
O=C(/C=C/[C@@H]1CCCO1)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000819128379	EI	On-Demand	Anodyne	SCD1	38	49
O=C(/C=C/[C@@H]1CCCO1)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000819128379	EI	On-Demand	Anodyne	SCD	33	49
O[C@@H](CNCCOCc1ccccc1)c1ccc(F)cn1	ZINC000819128382	CE	On-Demand	Anodyne	ADRB2	18	41
O[C@@H](CNCCOCc1ccccc1)c1ccc(F)cn1	ZINC000819128382	CE	On-Demand	Anodyne	ADRB1	21	42
O[C@@H](CNCCOCc1ccccc1)c1ccc(F)cn1	ZINC000819128382	CE	On-Demand	Anodyne	ADRB3	26	42
O[C@H](CNCCOCc1ccccc1)c1ccc(F)cn1	ZINC000819128383	CE	On-Demand	Anodyne	ADRB2	18	41
O[C@H](CNCCOCc1ccccc1)c1ccc(F)cn1	ZINC000819128383	CE	On-Demand	Anodyne	ADRB1	21	42
O[C@H](CNCCOCc1ccccc1)c1ccc(F)cn1	ZINC000819128383	CE	On-Demand	Anodyne	ADRB3	26	42
Cc1cc(F)ccc1[C@@H](O)CNCCOCc1ccccc1	ZINC000819128385	DF	On-Demand	Anodyne	ADRB2	66	47
Cc1cc(F)ccc1[C@@H](O)CNCCOCc1ccccc1	ZINC000819128385	DF	On-Demand	Anodyne	ADRB1	51	47
Cc1cc(F)ccc1[C@@H](O)CNCCOCc1ccccc1	ZINC000819128385	DF	On-Demand	Anodyne	ADRB3	39	47
COc1ccc(-c2csc(NC(=O)/C=C\[C@@H]3CCCO3)n2)cc1	ZINC000819128406	EG	On-Demand	Anodyne	MAOB	17	46
COc1ccc(-c2csc(NC(=O)/C=C/[C@H]3CCCO3)n2)cc1	ZINC000819128407	EG	On-Demand	Anodyne	MAOB	17	46
COc1ccc(-c2csc(NC(=O)/C=C\[C@H]3CCCO3)n2)cc1	ZINC000819128408	EG	On-Demand	Anodyne	MAOB	17	46
COc1ccc(-c2csc(NC(=O)/C=C/[C@@H]3CCCO3)n2)cc1	ZINC000819128409	EG	On-Demand	Anodyne	MAOB	17	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccon2)CC1	ZINC000819128410	ED	On-Demand	Anodyne	GPR119	49	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccon2)CC1	ZINC000819128411	ED	On-Demand	Anodyne	GPR119	49	46
O=C(/C=C/[C@@H]1CCCO1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000819128414	FH	On-Demand	Anodyne	SCD1	37	42
O=C(/C=C/[C@@H]1CCCO1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000819128414	FH	On-Demand	Anodyne	SCD	32	48
C[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)c1ccc(-n2cccn2)cc1	ZINC000819128417	FF	On-Demand	Anodyne	AMP1_PLAFQ	63	50
C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819128423	FD	On-Demand	Mild	PAPA1_CARPA	32	40
C[C@@H]1CC[C@@H](C(N)=O)CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819128424	FD	On-Demand	Mild	PAPA1_CARPA	32	40
O[C@@H](CNCc1c(F)cccc1OC(F)F)c1cccc(Cl)c1	ZINC000819128434	EH	On-Demand	Anodyne	ADRB1	29	43
O[C@@H](CNCc1c(F)cccc1OC(F)F)c1cccc(Cl)c1	ZINC000819128434	EH	On-Demand	Anodyne	ADRB3	45	43
O[C@H](CNCc1c(F)cccc1OC(F)F)c1cccc(Cl)c1	ZINC000819128435	EH	On-Demand	Anodyne	ADRB1	29	43
O[C@H](CNCc1c(F)cccc1OC(F)F)c1cccc(Cl)c1	ZINC000819128435	EH	On-Demand	Anodyne	ADRB3	45	43
CCC(CC)(CNC[C@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819128438	EF	On-Demand	Anodyne	ADRB2	21	40
CCC(CC)(CNC[C@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819128438	EF	On-Demand	Anodyne	ADRB1	25	42
CCC(CC)(CNC[C@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819128438	EF	On-Demand	Anodyne	ADRB3	93	42
CCC(CC)(CNC[C@@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819128439	EF	On-Demand	Anodyne	ADRB2	21	40
CCC(CC)(CNC[C@@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819128439	EF	On-Demand	Anodyne	ADRB1	25	42
CCC(CC)(CNC[C@@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819128439	EF	On-Demand	Anodyne	ADRB3	93	42
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(Oc2ccc(F)cc2)nc1	ZINC000819128452	EG	On-Demand	Anodyne	MLNR	20	40
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(Oc2ccc(F)cc2)nc1	ZINC000819128453	EG	On-Demand	Anodyne	MLNR	20	40
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(Oc2ccc(F)cc2)nc1	ZINC000819128454	EG	On-Demand	Anodyne	MLNR	20	40
COC(=O)c1ccc(CCNC(=O)c2cc(S(=O)(=O)N(C)c3ccccc3)ccc2Cl)cc1	ZINC000819128465	JH	On-Demand	Anodyne	CA2	23	47
COC(=O)c1ccc(CCNC(=O)c2cc(S(=O)(=O)N(C)c3ccccc3)ccc2Cl)cc1	ZINC000819128465	JH	On-Demand	Anodyne	CA1	22	47
COC(=O)c1ccc(CCNC(=O)c2cc(S(=O)(=O)N(C)c3ccccc3)ccc2Cl)cc1	ZINC000819128465	JH	On-Demand	Anodyne	CA4	18	47
COC(=O)c1ccc(CCNC(=O)c2cc(S(=O)(=O)N(C)c3ccccc3)ccc2Cl)cc1	ZINC000819128465	JH	On-Demand	Anodyne	CA9	15	41
COC(=O)c1ccc(CCNC(=O)c2cc(S(=O)(=O)N(C)c3ccccc3)ccc2Cl)cc1	ZINC000819128465	JH	On-Demand	Anodyne	LIMK2	24	48
O=C(/C=C/[C@H]1CCCO1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000819128484	FH	On-Demand	Anodyne	SCD1	37	42
O=C(/C=C/[C@H]1CCCO1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000819128484	FH	On-Demand	Anodyne	SCD	32	48
O=C(/C=C\[C@@H]1CCCO1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000819128486	FH	On-Demand	Anodyne	SCD1	37	42
O=C(/C=C\[C@@H]1CCCO1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000819128486	FH	On-Demand	Anodyne	SCD	32	48
O=C(/C=C\[C@H]1CCCO1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000819128488	FH	On-Demand	Anodyne	SCD1	37	42
O=C(/C=C\[C@H]1CCCO1)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000819128488	FH	On-Demand	Anodyne	SCD	32	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(C(N)=O)o2)CC1	ZINC000819128490	FD	On-Demand	Anodyne	GPR119	43	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(C(N)=O)o2)CC1	ZINC000819128492	FD	On-Demand	Anodyne	GPR119	43	46
Cc1ccc(OC[C@@H](O)CNCC(C)(C)NC(=O)OC(C)(C)C)cc1	ZINC000819128495	FF	On-Demand	Anodyne	ADRB2	54	54
Cc1ccc(OC[C@@H](O)CNCC(C)(C)NC(=O)OC(C)(C)C)cc1	ZINC000819128495	FF	On-Demand	Anodyne	ADRB1	70	46
Cc1ccc(OC[C@@H](O)CNCC(C)(C)NC(=O)OC(C)(C)C)cc1	ZINC000819128495	FF	On-Demand	Anodyne	ADRB3	41	42
Cc1ccc(OC[C@@H](O)CNCC(C)(C)NC(=O)OC(C)(C)C)cc1	ZINC000819128495	FF	On-Demand	Anodyne	ABCB1	16	41
Cc1ccc(OC[C@H](O)CNCC(C)(C)NC(=O)OC(C)(C)C)cc1	ZINC000819128497	FF	On-Demand	Anodyne	ADRB2	54	54
Cc1ccc(OC[C@H](O)CNCC(C)(C)NC(=O)OC(C)(C)C)cc1	ZINC000819128497	FF	On-Demand	Anodyne	ADRB1	70	46
Cc1ccc(OC[C@H](O)CNCC(C)(C)NC(=O)OC(C)(C)C)cc1	ZINC000819128497	FF	On-Demand	Anodyne	ADRB3	41	42
Cc1ccc(OC[C@H](O)CNCC(C)(C)NC(=O)OC(C)(C)C)cc1	ZINC000819128497	FF	On-Demand	Anodyne	ABCB1	16	41
Cc1ccccc1[C@@H](O)CNCc1cc(N(C)C)nc2ccccc12	ZINC000819128513	EG	On-Demand	Anodyne	METG	64	35
O[C@@H](CNCCOCc1ccccc1)c1ccccc1Br	ZINC000819128539	FG	On-Demand	Anodyne	ADRB2	41	47
O[C@@H](CNCCOCc1ccccc1)c1ccccc1Br	ZINC000819128539	FG	On-Demand	Anodyne	ADRB1	39	47
O[C@@H](CNCCOCc1ccccc1)c1ccccc1Br	ZINC000819128539	FG	On-Demand	Anodyne	ADRB3	32	47
O[C@H](CNCCOCc1ccccc1)c1ccccc1Br	ZINC000819128540	FG	On-Demand	Anodyne	ADRB2	41	47
O[C@H](CNCCOCc1ccccc1)c1ccccc1Br	ZINC000819128540	FG	On-Demand	Anodyne	ADRB1	39	47
O[C@H](CNCCOCc1ccccc1)c1ccccc1Br	ZINC000819128540	FG	On-Demand	Anodyne	ADRB3	32	47
O[C@@H](CNCCc1cc(F)ccc1F)c1ccc(Cl)cc1	ZINC000819128553	DG	On-Demand	Anodyne	ADRB2	31	48
O[C@@H](CNCCc1cc(F)ccc1F)c1ccc(Cl)cc1	ZINC000819128553	DG	On-Demand	Anodyne	ADRB1	31	42
O[C@@H](CNCCc1cc(F)ccc1F)c1ccc(Cl)cc1	ZINC000819128553	DG	On-Demand	Anodyne	ADRB3	43	43
O=C(/C=C\[C@H]1CCCO1)NCCOc1cccc(C(F)(F)F)c1	ZINC000819128554	EF	On-Demand	Anodyne	HRH2	19	41
O=C(/C=C\[C@H]1CCCO1)NCCOc1cccc(C(F)(F)F)c1	ZINC000819128554	EF	On-Demand	Anodyne	PDS	43	42
O=C(/C=C\[C@@H]1CCCO1)NCCOc1cccc(C(F)(F)F)c1	ZINC000819128556	EF	On-Demand	Anodyne	HRH2	19	41
O=C(/C=C\[C@@H]1CCCO1)NCCOc1cccc(C(F)(F)F)c1	ZINC000819128556	EF	On-Demand	Anodyne	PDS	43	42
O=C(/C=C/[C@H]1CCCO1)NCCOc1cccc(C(F)(F)F)c1	ZINC000819128558	EF	On-Demand	Anodyne	HRH2	19	41
O=C(/C=C/[C@H]1CCCO1)NCCOc1cccc(C(F)(F)F)c1	ZINC000819128558	EF	On-Demand	Anodyne	PDS	43	42
CCO[C@@H](CCNC[C@H](O)c1cccnc1)C1CCCC1	ZINC000819128571	CF	On-Demand	Anodyne	ADRB2	26	45
CCO[C@@H](CCNC[C@H](O)c1cccnc1)C1CCCC1	ZINC000819128571	CF	On-Demand	Anodyne	ADRB1	34	47
CCO[C@@H](CCNC[C@H](O)c1cccnc1)C1CCCC1	ZINC000819128571	CF	On-Demand	Anodyne	ADRB3	108	49
CCO[C@@H](CCNC[C@@H](O)c1cccnc1)C1CCCC1	ZINC000819128572	CF	On-Demand	Anodyne	ADRB2	26	45
CCO[C@@H](CCNC[C@@H](O)c1cccnc1)C1CCCC1	ZINC000819128572	CF	On-Demand	Anodyne	ADRB1	34	47
CCO[C@@H](CCNC[C@@H](O)c1cccnc1)C1CCCC1	ZINC000819128572	CF	On-Demand	Anodyne	ADRB3	108	49
COC(=O)c1ccc(CCNC(=O)Cn2c(S)nc3ccccc3c2=O)cc1	ZINC000819128587	GD	On-Demand	Anodyne	F2	20	44
O[C@@H](CNCCOCc1ccccc1)c1ccc(OC(F)(F)F)cc1	ZINC000819128597	FG	On-Demand	Anodyne	ADRB2	57	48
O[C@@H](CNCCOCc1ccccc1)c1ccc(OC(F)(F)F)cc1	ZINC000819128597	FG	On-Demand	Anodyne	ADRB1	61	48
O[C@@H](CNCCOCc1ccccc1)c1ccc(OC(F)(F)F)cc1	ZINC000819128597	FG	On-Demand	Anodyne	ADRB3	66	51
O[C@H](CNCCOCc1ccccc1)c1ccc(OC(F)(F)F)cc1	ZINC000819128598	FG	On-Demand	Anodyne	ADRB2	57	48
O[C@H](CNCCOCc1ccccc1)c1ccc(OC(F)(F)F)cc1	ZINC000819128598	FG	On-Demand	Anodyne	ADRB1	61	48
O[C@H](CNCCOCc1ccccc1)c1ccc(OC(F)(F)F)cc1	ZINC000819128598	FG	On-Demand	Anodyne	ADRB3	66	51
O[C@@H](CNCCc1cc(F)ccc1F)c1ccc(F)cc1	ZINC000819128602	CF	On-Demand	Anodyne	ADRB2	38	50
O[C@@H](CNCCc1cc(F)ccc1F)c1ccc(F)cc1	ZINC000819128602	CF	On-Demand	Anodyne	ADRB3	47	42
O[C@H](CNCCc1cc(F)ccc1F)c1ccc(F)cc1	ZINC000819128603	CF	On-Demand	Anodyne	ADRB2	38	50
O[C@H](CNCCc1cc(F)ccc1F)c1ccc(F)cc1	ZINC000819128603	CF	On-Demand	Anodyne	ADRB3	47	42
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCOCc2ccccc2)CC1	ZINC000819128608	GF	On-Demand	Anodyne	SLC12A5	62	37
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCOCc2ccccc2)CC1	ZINC000819128609	GF	On-Demand	Anodyne	SLC12A5	62	37
O=C(/C=C\[C@@H]1CCCO1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000819128612	FH	On-Demand	Anodyne	SCD1	36	44
O=C(/C=C\[C@@H]1CCCO1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000819128612	FH	On-Demand	Anodyne	SCD	31	44
O=C(/C=C/[C@H]1CCCO1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000819128613	FH	On-Demand	Anodyne	SCD1	36	44
O=C(/C=C/[C@H]1CCCO1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000819128613	FH	On-Demand	Anodyne	SCD	31	44
O=C(/C=C\[C@H]1CCCO1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000819128614	FH	On-Demand	Anodyne	SCD1	36	44
O=C(/C=C\[C@H]1CCCO1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000819128614	FH	On-Demand	Anodyne	SCD	31	44
O=C(/C=C/[C@@H]1CCCO1)NCCOc1cccc(C(F)(F)F)c1	ZINC000819128615	EF	On-Demand	Anodyne	HRH2	19	41
O=C(/C=C/[C@@H]1CCCO1)NCCOc1cccc(C(F)(F)F)c1	ZINC000819128615	EF	On-Demand	Anodyne	PDS	43	42
O=C(/C=C/[C@@H]1CCCO1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000819128638	FH	On-Demand	Anodyne	SCD1	36	44
O=C(/C=C/[C@@H]1CCCO1)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000819128638	FH	On-Demand	Anodyne	SCD	31	44
O=C(NCCC(=O)N1CCN(c2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819128642	FE	On-Demand	Anodyne	SSTR1	26	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000819128656	FE	On-Demand	Anodyne	SIGMAR1	15	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000819128656	FE	On-Demand	Anodyne	SSTR5	47	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000819128656	FE	On-Demand	Anodyne	MCHR1	22	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2cc(F)ccc2F)CC1	ZINC000819128670	GG	On-Demand	Anodyne	DPP4	18	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2cc(F)ccc2F)CC1	ZINC000819128670	GG	On-Demand	Anodyne	GPR119	49	65
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2cc(F)ccc2F)CC1	ZINC000819128671	GG	On-Demand	Anodyne	DPP4	18	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2cc(F)ccc2F)CC1	ZINC000819128671	GG	On-Demand	Anodyne	GPR119	49	65
CN(C)c1ccc(NC(=O)CCNCCOCc2ccccc2)cc1	ZINC000819128700	EF	On-Demand	Anodyne	LTA4H	44	43
Cn1cccc1CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819128710	EF	On-Demand	Anodyne	ADRB2	37	40
Cn1cccc1CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819128710	EF	On-Demand	Anodyne	ADRB1	43	39
Cn1cccc1CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819128710	EF	On-Demand	Anodyne	GRIN1	28	44
COc1ccc(OC)c([C@H](O)CNCCc2cc(F)ccc2F)c1	ZINC000819128711	EF	On-Demand	Anodyne	ADRB2	26	51
Cn1cccc1CNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819128713	EF	On-Demand	Anodyne	ADRB2	37	40
Cn1cccc1CNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819128713	EF	On-Demand	Anodyne	ADRB1	43	39
Cn1cccc1CNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819128713	EF	On-Demand	Anodyne	GRIN1	28	44
O[C@@H](CNCCc1cc(F)ccc1F)c1ccc(Br)cc1	ZINC000819128719	FH	On-Demand	Anodyne	ADRB2	25	50
O[C@H](CNCCc1cc(F)ccc1F)c1ccc(Br)cc1	ZINC000819128720	FH	On-Demand	Anodyne	ADRB2	25	50
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCc2cc(F)ccc2F)CC1	ZINC000819128724	GG	On-Demand	Anodyne	GPR119	25	48
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCc2cc(F)ccc2F)CC1	ZINC000819128726	GG	On-Demand	Anodyne	GPR119	25	48
C=C(C)C(C)(C)C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F	ZINC000819128734	FH	On-Demand	Mild	STAT6	55	33
CCO[C@@H](CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000819128758	EG	On-Demand	Bother	CACNA1C	42	41
CCO[C@@H](CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000819128758	EG	On-Demand	Bother	ADRB3	54	38
CCO[C@@H](CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000819128758	EG	On-Demand	Bother	CACNA1D	64	35
CCO[C@@H](CCNC[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000819128761	EG	On-Demand	Bother	CACNA1C	42	41
CCO[C@@H](CCNC[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000819128761	EG	On-Demand	Bother	ADRB3	54	38
CCO[C@@H](CCNC[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000819128761	EG	On-Demand	Bother	CACNA1D	64	35
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cc(F)ccc2F)c1	ZINC000819128780	DF	On-Demand	Bother	ADRB1	30	44
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cc(F)ccc2F)c1	ZINC000819128780	DF	On-Demand	Bother	ADRB3	59	44
O=C(C(F)=C1CCC1)N1CCC(Oc2ccc(F)cc2F)CC1	ZINC000819128799	EH	On-Demand	Anodyne	SCD1	33	41
NC(=O)C1CCN(Cc2cccc(NC(=O)/C=C/[C@@H]3CCCO3)c2)CC1	ZINC000819128824	FE	On-Demand	Anodyne	SIGMAR1	15	42
NC(=O)C1CCN(Cc2cccc(NC(=O)/C=C\[C@H]3CCCO3)c2)CC1	ZINC000819128825	FE	On-Demand	Anodyne	SIGMAR1	15	42
NC(=O)C1CCN(Cc2cccc(NC(=O)/C=C/[C@H]3CCCO3)c2)CC1	ZINC000819128826	FE	On-Demand	Anodyne	SIGMAR1	15	42
NC(=O)C1CCN(Cc2cccc(NC(=O)/C=C\[C@@H]3CCCO3)c2)CC1	ZINC000819128827	FE	On-Demand	Anodyne	SIGMAR1	15	42
COC(=O)c1ccc(CCNC(=O)c2cnc(Cl)c(Cl)c2)cc1	ZINC000819128830	FG	On-Demand	Anodyne	SCNN1A	18	40
COC(=O)c1ccc(CCNC(=O)c2cnc(Cl)c(Cl)c2)cc1	ZINC000819128830	FG	On-Demand	Anodyne	SCN10A	22	40
COC(=O)c1ccc(CCNC(=O)c2cnc(Cl)c(Cl)c2)cc1	ZINC000819128830	FG	On-Demand	Anodyne	CXCR3	26	44
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cc(F)ccc2F)c1	ZINC000819128855	DF	On-Demand	Bother	ADRB1	30	44
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cc(F)ccc2F)c1	ZINC000819128855	DF	On-Demand	Bother	ADRB3	59	44
Cc1ccccc1[C@@H](O)CNCCOCc1ccccc1	ZINC000819128857	CF	On-Demand	Anodyne	ADRB2	65	49
Cc1ccccc1[C@@H](O)CNCCOCc1ccccc1	ZINC000819128857	CF	On-Demand	Anodyne	ADRB1	56	49
Cc1ccccc1[C@@H](O)CNCCOCc1ccccc1	ZINC000819128857	CF	On-Demand	Anodyne	ADRB3	46	49
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(C3CCCCC3)CC2)cc1	ZINC000819128858	GF	On-Demand	Anodyne	CHRM2	26	42
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(C3CCCCC3)CC2)cc1	ZINC000819128858	GF	On-Demand	Anodyne	ADRA1D	25	42
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(C3CCCCC3)CC2)cc1	ZINC000819128858	GF	On-Demand	Anodyne	ADRA1A	18	42
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(C3CCCCC3)CC2)cc1	ZINC000819128858	GF	On-Demand	Anodyne	ADRA1B	20	42
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(C3CCCCC3)CC2)cc1	ZINC000819128858	GF	On-Demand	Anodyne	ADRB3	30	42
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(C3CCCCC3)CC2)cc1	ZINC000819128859	GF	On-Demand	Anodyne	CHRM2	26	42
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(C3CCCCC3)CC2)cc1	ZINC000819128859	GF	On-Demand	Anodyne	ADRA1D	25	42
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(C3CCCCC3)CC2)cc1	ZINC000819128859	GF	On-Demand	Anodyne	ADRA1A	18	42
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(C3CCCCC3)CC2)cc1	ZINC000819128859	GF	On-Demand	Anodyne	ADRA1B	20	42
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(C3CCCCC3)CC2)cc1	ZINC000819128859	GF	On-Demand	Anodyne	ADRB3	30	42
O[C@@H](CNCCc1cc(F)ccc1F)c1ccccc1F	ZINC000819128893	CF	On-Demand	Anodyne	ADRB2	31	43
O[C@@H](CNCCc1cc(F)ccc1F)c1ccccc1F	ZINC000819128893	CF	On-Demand	Anodyne	ADRB1	24	43
O[C@@H](CNCCc1cc(F)ccc1F)c1ccccc1F	ZINC000819128893	CF	On-Demand	Anodyne	ADRB3	23	40
O[C@H](CNCCc1cc(F)ccc1F)c1ccccc1F	ZINC000819128894	CF	On-Demand	Anodyne	ADRB2	31	43
O[C@H](CNCCc1cc(F)ccc1F)c1ccccc1F	ZINC000819128894	CF	On-Demand	Anodyne	ADRB1	24	43
O[C@H](CNCCc1cc(F)ccc1F)c1ccccc1F	ZINC000819128894	CF	On-Demand	Anodyne	ADRB3	23	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCOCc2ccccc2)CC1	ZINC000819128896	GF	On-Demand	Anodyne	GPR119	47	48
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCOCc2ccccc2)CC1	ZINC000819128897	GF	On-Demand	Anodyne	GPR119	47	48
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cc(F)ccc2F)cc1	ZINC000819128898	FE	On-Demand	Anodyne	ADRB2	45	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cc(F)ccc2F)cc1	ZINC000819128898	FE	On-Demand	Anodyne	ADRB3	87	45
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cc(F)ccc2F)cc1	ZINC000819128899	FE	On-Demand	Anodyne	ADRB2	45	44
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cc(F)ccc2F)cc1	ZINC000819128899	FE	On-Demand	Anodyne	ADRB3	87	45
O=C(/C=C\[C@@H]1CCCO1)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1	ZINC000819128902	GI	On-Demand	Anodyne	SCD1	40	61
O=C(/C=C\[C@@H]1CCCO1)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1	ZINC000819128902	GI	On-Demand	Anodyne	SCD	41	61
O=C(/C=C\[C@H]1CCCO1)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1	ZINC000819128903	GI	On-Demand	Anodyne	SCD1	40	61
O=C(/C=C\[C@H]1CCCO1)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1	ZINC000819128903	GI	On-Demand	Anodyne	SCD	41	61
O=C(/C=C/[C@H]1CCCO1)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1	ZINC000819128904	GI	On-Demand	Anodyne	SCD1	40	61
O=C(/C=C/[C@H]1CCCO1)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1	ZINC000819128904	GI	On-Demand	Anodyne	SCD	41	61
O=C(/C=C/[C@@H]1CCCO1)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1	ZINC000819128905	GI	On-Demand	Anodyne	SCD1	40	61
O=C(/C=C/[C@@H]1CCCO1)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1	ZINC000819128905	GI	On-Demand	Anodyne	SCD	41	61
O[C@@H](CNCCOCc1ccccc1)c1ccc(Cl)c(F)c1	ZINC000819128916	DG	On-Demand	Anodyne	ADRB2	56	50
O[C@@H](CNCCOCc1ccccc1)c1ccc(Cl)c(F)c1	ZINC000819128916	DG	On-Demand	Anodyne	ADRB1	51	50
O[C@@H](CNCCOCc1ccccc1)c1ccc(Cl)c(F)c1	ZINC000819128916	DG	On-Demand	Anodyne	ADRB3	60	50
O[C@H](CNCCOCc1ccccc1)c1ccc(Cl)c(F)c1	ZINC000819128917	DG	On-Demand	Anodyne	ADRB2	56	50
O[C@H](CNCCOCc1ccccc1)c1ccc(Cl)c(F)c1	ZINC000819128917	DG	On-Demand	Anodyne	ADRB1	51	50
O[C@H](CNCCOCc1ccccc1)c1ccc(Cl)c(F)c1	ZINC000819128917	DG	On-Demand	Anodyne	ADRB3	60	50
Cc1cc(F)ccc1[C@@H](O)CNCc1ccc(C(N)=O)o1	ZINC000819128933	CD	On-Demand	Anodyne	LEF	46	32
O[C@@H](CNCCc1cc(F)ccc1F)c1ccccc1	ZINC000819128934	CF	On-Demand	Anodyne	ADRB2	47	50
O[C@@H](CNCCc1cc(F)ccc1F)c1ccccc1	ZINC000819128934	CF	On-Demand	Anodyne	ADRB1	49	44
O[C@@H](CNCCc1cc(F)ccc1F)c1ccccc1	ZINC000819128934	CF	On-Demand	Anodyne	ADRB3	89	45
O[C@H](CNCCc1cc(F)ccc1F)c1ccccc1	ZINC000819128935	CF	On-Demand	Anodyne	ADRB2	47	50
O[C@H](CNCCc1cc(F)ccc1F)c1ccccc1	ZINC000819128935	CF	On-Demand	Anodyne	ADRB1	49	44
O[C@H](CNCCc1cc(F)ccc1F)c1ccccc1	ZINC000819128935	CF	On-Demand	Anodyne	ADRB3	89	45
O[C@@H](CNCCOCc1ccccc1)c1ccc(F)c(Br)c1	ZINC000819128938	FG	On-Demand	Anodyne	ADRB2	56	50
O[C@@H](CNCCOCc1ccccc1)c1ccc(F)c(Br)c1	ZINC000819128938	FG	On-Demand	Anodyne	ADRB1	48	50
O[C@@H](CNCCOCc1ccccc1)c1ccc(F)c(Br)c1	ZINC000819128938	FG	On-Demand	Anodyne	ADRB3	56	50
O[C@H](CNCCOCc1ccccc1)c1ccc(F)c(Br)c1	ZINC000819128939	FG	On-Demand	Anodyne	ADRB2	56	50
O[C@H](CNCCOCc1ccccc1)c1ccc(F)c(Br)c1	ZINC000819128939	FG	On-Demand	Anodyne	ADRB1	48	50
O[C@H](CNCCOCc1ccccc1)c1ccc(F)c(Br)c1	ZINC000819128939	FG	On-Demand	Anodyne	ADRB3	56	50
CCO[C@@H](CCNC[C@@H](O)c1ccc(C)cc1)C1CCCC1	ZINC000819128962	DH	On-Demand	Anodyne	ADRB2	16	43
CCO[C@@H](CCNC[C@H](O)c1ccc(C)cc1)C1CCCC1	ZINC000819128963	DH	On-Demand	Anodyne	ADRB2	16	43
O[C@@H](CNCCOCc1ccccc1)c1ccc(F)cc1Cl	ZINC000819129003	DG	On-Demand	Anodyne	ADRB2	53	44
O[C@@H](CNCCOCc1ccccc1)c1ccc(F)cc1Cl	ZINC000819129003	DG	On-Demand	Anodyne	ADRB1	47	44
O[C@@H](CNCCOCc1ccccc1)c1ccc(F)cc1Cl	ZINC000819129003	DG	On-Demand	Anodyne	ADRB3	31	44
O[C@H](CNCCOCc1ccccc1)c1ccc(F)cc1Cl	ZINC000819129004	DG	On-Demand	Anodyne	ADRB2	53	44
O[C@H](CNCCOCc1ccccc1)c1ccc(F)cc1Cl	ZINC000819129004	DG	On-Demand	Anodyne	ADRB1	47	44
O[C@H](CNCCOCc1ccccc1)c1ccc(F)cc1Cl	ZINC000819129004	DG	On-Demand	Anodyne	ADRB3	31	44
O[C@@H](CNCCc1cc(F)ccc1F)c1cccc(C(F)(F)F)c1	ZINC000819129012	EH	On-Demand	Anodyne	ADRB2	29	40
O[C@@H](CNCCc1cc(F)ccc1F)c1cccc(C(F)(F)F)c1	ZINC000819129012	EH	On-Demand	Anodyne	ADRB1	28	42
O[C@@H](CNCCc1cc(F)ccc1F)c1cccc(C(F)(F)F)c1	ZINC000819129012	EH	On-Demand	Anodyne	ADRB3	49	43
O[C@H](CNCCc1cc(F)ccc1F)c1cccc(C(F)(F)F)c1	ZINC000819129013	EH	On-Demand	Anodyne	ADRB2	29	40
O[C@H](CNCCc1cc(F)ccc1F)c1cccc(C(F)(F)F)c1	ZINC000819129013	EH	On-Demand	Anodyne	ADRB1	28	42
O[C@H](CNCCc1cc(F)ccc1F)c1cccc(C(F)(F)F)c1	ZINC000819129013	EH	On-Demand	Anodyne	ADRB3	49	43
O[C@@H](CNCCc1cc(F)ccc1F)c1ccc(F)cc1F	ZINC000819129018	DG	On-Demand	Anodyne	ADRB2	33	40
O[C@@H](CNCCc1cc(F)ccc1F)c1ccc(F)cc1F	ZINC000819129018	DG	On-Demand	Anodyne	ADRB1	27	40
O[C@H](CNCCc1cc(F)ccc1F)c1ccc(F)cc1F	ZINC000819129019	DG	On-Demand	Anodyne	ADRB2	33	40
O[C@H](CNCCc1cc(F)ccc1F)c1ccc(F)cc1F	ZINC000819129019	DG	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNCCOCc1ccccc1)c1cccc(Cl)c1	ZINC000819129028	DG	On-Demand	Anodyne	ADRB2	80	55
O[C@@H](CNCCOCc1ccccc1)c1cccc(Cl)c1	ZINC000819129028	DG	On-Demand	Anodyne	ADRB1	87	55
O[C@@H](CNCCOCc1ccccc1)c1cccc(Cl)c1	ZINC000819129028	DG	On-Demand	Anodyne	ADRB3	102	55
O[C@H](CNCCOCc1ccccc1)c1cccc(Cl)c1	ZINC000819129029	DG	On-Demand	Anodyne	ADRB2	80	55
O[C@H](CNCCOCc1ccccc1)c1cccc(Cl)c1	ZINC000819129029	DG	On-Demand	Anodyne	ADRB1	87	55
O[C@H](CNCCOCc1ccccc1)c1cccc(Cl)c1	ZINC000819129029	DG	On-Demand	Anodyne	ADRB3	102	55
CSc1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819129036	CD	On-Demand	Anodyne	ADRB2	27	40
CSc1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819129037	CD	On-Demand	Anodyne	ADRB2	27	40
CCO[C@@H](CCNC[C@@H](O)c1ccccc1)C1CCCC1	ZINC000819129063	CG	On-Demand	Anodyne	ADRB2	23	40
CCO[C@@H](CCNC[C@@H](O)c1ccccc1)C1CCCC1	ZINC000819129063	CG	On-Demand	Anodyne	ADRB1	35	41
CCO[C@@H](CCNC[C@@H](O)c1ccccc1)C1CCCC1	ZINC000819129063	CG	On-Demand	Anodyne	ADRB3	61	41
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ccon2)c1	ZINC000819129064	CD	On-Demand	Bother	ADRB2	15	46
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2ccon2)c1	ZINC000819129064	CD	On-Demand	Bother	ADRB1	18	46
CCO[C@@H](CCNC[C@H](O)c1ccccc1)C1CCCC1	ZINC000819129066	CG	On-Demand	Anodyne	ADRB2	23	40
CCO[C@@H](CCNC[C@H](O)c1ccccc1)C1CCCC1	ZINC000819129066	CG	On-Demand	Anodyne	ADRB1	35	41
CCO[C@@H](CCNC[C@H](O)c1ccccc1)C1CCCC1	ZINC000819129066	CG	On-Demand	Anodyne	ADRB3	61	41
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ccon2)c1	ZINC000819129070	CD	On-Demand	Bother	ADRB2	15	46
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2ccon2)c1	ZINC000819129070	CD	On-Demand	Bother	ADRB1	18	46
O[C@@H](CNCCOCc1ccccc1)c1cccnc1	ZINC000819129095	CD	On-Demand	Anodyne	ADRB2	53	57
O[C@@H](CNCCOCc1ccccc1)c1cccnc1	ZINC000819129095	CD	On-Demand	Anodyne	ADRB1	69	62
O[C@@H](CNCCOCc1ccccc1)c1cccnc1	ZINC000819129095	CD	On-Demand	Anodyne	ADRB3	146	62
O[C@H](CNCCOCc1ccccc1)c1cccnc1	ZINC000819129096	CD	On-Demand	Anodyne	ADRB2	53	57
O[C@H](CNCCOCc1ccccc1)c1cccnc1	ZINC000819129096	CD	On-Demand	Anodyne	ADRB1	69	62
O[C@H](CNCCOCc1ccccc1)c1cccnc1	ZINC000819129096	CD	On-Demand	Anodyne	ADRB3	146	62
O[C@@H](CNCCOCc1ccccc1)c1ccccc1C(F)(F)F	ZINC000819129098	EH	On-Demand	Anodyne	ADRB2	33	44
O[C@@H](CNCCOCc1ccccc1)c1ccccc1C(F)(F)F	ZINC000819129098	EH	On-Demand	Anodyne	ADRB1	37	44
O[C@@H](CNCCOCc1ccccc1)c1ccccc1C(F)(F)F	ZINC000819129098	EH	On-Demand	Anodyne	ADRB3	34	44
O[C@H](CNCCOCc1ccccc1)c1ccccc1C(F)(F)F	ZINC000819129099	EH	On-Demand	Anodyne	ADRB2	33	44
O[C@H](CNCCOCc1ccccc1)c1ccccc1C(F)(F)F	ZINC000819129099	EH	On-Demand	Anodyne	ADRB1	37	44
O[C@H](CNCCOCc1ccccc1)c1ccccc1C(F)(F)F	ZINC000819129099	EH	On-Demand	Anodyne	ADRB3	34	44
O[C@@H](CNCCc1cc(F)ccc1F)c1cccc(Br)c1	ZINC000819129108	FH	On-Demand	Anodyne	ADRB2	31	42
O[C@@H](CNCCc1cc(F)ccc1F)c1cccc(Br)c1	ZINC000819129108	FH	On-Demand	Anodyne	ADRB1	29	43
O[C@@H](CNCCc1cc(F)ccc1F)c1cccc(Br)c1	ZINC000819129108	FH	On-Demand	Anodyne	ADRB3	55	44
O[C@H](CNCCc1cc(F)ccc1F)c1cccc(Br)c1	ZINC000819129109	FH	On-Demand	Anodyne	ADRB2	31	42
O[C@H](CNCCc1cc(F)ccc1F)c1cccc(Br)c1	ZINC000819129109	FH	On-Demand	Anodyne	ADRB1	29	43
O[C@H](CNCCc1cc(F)ccc1F)c1cccc(Br)c1	ZINC000819129109	FH	On-Demand	Anodyne	ADRB3	55	44
O[C@@H](CNCCc1cc(F)ccc1F)c1ccccc1Cl	ZINC000819129118	DG	On-Demand	Anodyne	ADRB1	32	40
O[C@@H](CNCCc1cc(F)ccc1F)c1ccccc1Cl	ZINC000819129118	DG	On-Demand	Anodyne	ADRB3	24	43
O[C@@H](CNCCc1cc(F)ccc1F)c1ccc(F)c(Br)c1	ZINC000819129127	FH	On-Demand	Anodyne	ADRB2	29	43
O[C@@H](CNCCc1cc(F)ccc1F)c1ccc(F)c(Br)c1	ZINC000819129127	FH	On-Demand	Anodyne	ADRB3	28	40
O[C@H](CNCCc1cc(F)ccc1F)c1ccc(F)c(Br)c1	ZINC000819129128	FH	On-Demand	Anodyne	ADRB2	29	43
O[C@H](CNCCc1cc(F)ccc1F)c1ccc(F)c(Br)c1	ZINC000819129128	FH	On-Demand	Anodyne	ADRB3	28	40
Cc1ccc(NCCCNC[C@H](O)c2cccc(Cl)c2)nc1	ZINC000819129149	DG	On-Demand	Anodyne	ADRB1	50	45
Cc1ccc(NCCCNC[C@H](O)c2cccc(Cl)c2)nc1	ZINC000819129149	DG	On-Demand	Anodyne	ADRB3	63	45
Cc1ccc(NCCCNC[C@@H](O)c2cccc(Cl)c2)nc1	ZINC000819129150	DG	On-Demand	Anodyne	ADRB1	50	45
Cc1ccc(NCCCNC[C@@H](O)c2cccc(Cl)c2)nc1	ZINC000819129150	DG	On-Demand	Anodyne	ADRB3	63	45
O=C1[C@H](NC[C@H](O)c2ccccc2Cl)CCN1C1CCOCC1	ZINC000819129156	ED	On-Demand	Anodyne	OPRL1	42	37
O=C1[C@@H](NC[C@H](O)c2ccccc2Cl)CCN1C1CCOCC1	ZINC000819129157	ED	On-Demand	Anodyne	OPRL1	42	37
Cc1ccc(NCCCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)nc1	ZINC000819129158	FG	On-Demand	Anodyne	ADRB3	16	41
Cc1ccc(NCCCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)nc1	ZINC000819129159	FG	On-Demand	Anodyne	ADRB3	16	41
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(C(=O)C(F)=C2CCC2)C1	ZINC000819129160	FG	On-Demand	Anodyne	F10	18	43
O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(C(=O)C(F)=C2CCC2)C1	ZINC000819129161	FG	On-Demand	Anodyne	F10	18	43
Cc1nc(NC(=O)c2cc3c(cn2)OCCO3)sc1-c1nnc(S)n1C	ZINC000819129163	GD	On-Demand	Anodyne	PIK3CG	16	40
Cc1ccc(NCCCNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)nc1	ZINC000819129212	GF	On-Demand	Anodyne	GPR119	53	42
Cc1ccc(NCCCNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)nc1	ZINC000819129213	GF	On-Demand	Anodyne	GPR119	53	42
CN1C(=O)N[C@]2(CCC[C@@H]2CNC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819129220	FD	On-Demand	Anodyne	CYP3A4	45	34
CN1C(=O)N[C@]2(CCC[C@H]2CNC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819129221	FD	On-Demand	Anodyne	CYP3A4	45	34
CN1C(=O)N[C@]2(CCC[C@@H]2CNC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819129222	FD	On-Demand	Anodyne	CYP3A4	45	34
CN1C(=O)N[C@]2(CCC[C@H]2CNC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819129223	FD	On-Demand	Anodyne	CYP3A4	45	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)C2	ZINC000819129249	FF	On-Demand	Bother	CACNA1D	40	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)C2	ZINC000819129250	FF	On-Demand	Bother	CACNA1D	40	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)C2	ZINC000819129251	FF	On-Demand	Bother	CACNA1D	40	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)C2	ZINC000819129252	FF	On-Demand	Bother	CACNA1D	40	35
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1ccon1	ZINC000819129276	CD	On-Demand	Bother	ADRB1	53	35
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1ccon1	ZINC000819129277	CD	On-Demand	Bother	ADRB1	53	35
O=C(NC[C@H]1Cc2ccccc21)C(F)=C1CCC1	ZINC000819129286	BF	On-Demand	Anodyne	MTNR1B	16	46
O=C(NC[C@@H]1Cc2ccccc21)C(F)=C1CCC1	ZINC000819129287	BF	On-Demand	Anodyne	MTNR1B	16	46
C=CCC1(C(=O)Nc2nc(C)c(-c3ccccc3)s2)CCOCC1	ZINC000819129323	EI	On-Demand	Mild	PIK3CG	18	40
C=CCC1(C(=O)Nc2nc(C)c(-c3ccccc3)s2)CCOCC1	ZINC000819129323	EI	On-Demand	Mild	PI4KB	39	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819129334	CD	On-Demand	Anodyne	ADRB2	38	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819129334	CD	On-Demand	Anodyne	ADRB1	63	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819129334	CD	On-Demand	Anodyne	ADRB3	34	40
CC(=O)c1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819129335	CD	On-Demand	Anodyne	ADRB2	38	42
CC(=O)c1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819129335	CD	On-Demand	Anodyne	ADRB1	63	41
CC(=O)c1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819129335	CD	On-Demand	Anodyne	ADRB3	34	40
O=C(Nc1ccc(Cl)cn1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819129372	FF	On-Demand	Anodyne	F10	30	46
O=C(Nc1ccc(Cl)cn1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819129373	FF	On-Demand	Anodyne	F10	30	46
O=C(Nc1ccc(Cl)cn1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819129374	FF	On-Demand	Anodyne	F10	30	46
O=C(Nc1ccc(Cl)cn1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819129375	FF	On-Demand	Anodyne	F10	30	46
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(C(=O)/C=C/[C@H]2CCCO2)C1	ZINC000819129376	FF	On-Demand	Anodyne	F10	22	41
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(C(=O)/C=C/[C@@H]2CCCO2)C1	ZINC000819129377	FF	On-Demand	Anodyne	F10	22	41
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(C(=O)/C=C\[C@@H]2CCCO2)C1	ZINC000819129378	FF	On-Demand	Anodyne	F10	22	41
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(C(=O)/C=C\[C@H]2CCCO2)C1	ZINC000819129379	FF	On-Demand	Anodyne	F10	22	41
Cc1ccc(NCCCNC[C@H](O)c2cccnc2)nc1	ZINC000819129385	CD	On-Demand	Anodyne	ADRB2	25	46
Cc1ccc(NCCCNC[C@H](O)c2cccnc2)nc1	ZINC000819129385	CD	On-Demand	Anodyne	ADRB1	29	46
Cc1ccc(NCCCNC[C@H](O)c2cccnc2)nc1	ZINC000819129385	CD	On-Demand	Anodyne	ADRB3	99	49
Cc1ccc(NCCCNC[C@@H](O)c2cccnc2)nc1	ZINC000819129386	CD	On-Demand	Anodyne	ADRB2	25	46
Cc1ccc(NCCCNC[C@@H](O)c2cccnc2)nc1	ZINC000819129386	CD	On-Demand	Anodyne	ADRB1	29	46
Cc1ccc(NCCCNC[C@@H](O)c2cccnc2)nc1	ZINC000819129386	CD	On-Demand	Anodyne	ADRB3	99	49
Cc1nc(NC(=O)/C=C/[C@H]2CCCO2)sc1-c1ccccc1	ZINC000819129387	DH	On-Demand	Anodyne	PIK3CG	20	43
Cc1nc(NC(=O)/C=C\[C@H]2CCCO2)sc1-c1ccccc1	ZINC000819129388	DH	On-Demand	Anodyne	PIK3CG	20	43
Cc1nc(NC(=O)/C=C\[C@@H]2CCCO2)sc1-c1ccccc1	ZINC000819129389	DH	On-Demand	Anodyne	PIK3CG	20	43
Cc1nc(NC(=O)/C=C/[C@@H]2CCCO2)sc1-c1ccccc1	ZINC000819129390	DH	On-Demand	Anodyne	PIK3CG	20	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1Cc3ccccc31)C2	ZINC000819129438	EE	On-Demand	Anodyne	MTNR1A	19	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1Cc3ccccc31)C2	ZINC000819129438	EE	On-Demand	Anodyne	MTNR1B	24	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1Cc3ccccc31)C2	ZINC000819129439	EE	On-Demand	Anodyne	MTNR1A	19	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1Cc3ccccc31)C2	ZINC000819129439	EE	On-Demand	Anodyne	MTNR1B	24	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1Cc3ccccc31)C2	ZINC000819129440	EE	On-Demand	Anodyne	MTNR1A	19	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1Cc3ccccc31)C2	ZINC000819129440	EE	On-Demand	Anodyne	MTNR1B	24	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1Cc3ccccc31)C2	ZINC000819129441	EE	On-Demand	Anodyne	MTNR1A	19	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1Cc3ccccc31)C2	ZINC000819129441	EE	On-Demand	Anodyne	MTNR1B	24	41
CCOc1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819129472	CD	On-Demand	Anodyne	ADRB2	37	44
CCOc1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819129472	CD	On-Demand	Anodyne	ADRB1	50	44
CCOc1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819129472	CD	On-Demand	Anodyne	ADRB3	29	40
CCOc1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819129473	CD	On-Demand	Anodyne	ADRB2	37	44
CCOc1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819129473	CD	On-Demand	Anodyne	ADRB1	50	44
CCOc1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819129473	CD	On-Demand	Anodyne	ADRB3	29	40
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc([N+](=O)[O-])c1	ZINC000819129482	CF	On-Demand	Bother	KCNQ2	49	36
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc([N+](=O)[O-])c1	ZINC000819129483	CF	On-Demand	Bother	KCNQ2	49	36
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc([N+](=O)[O-])c1	ZINC000819129484	CF	On-Demand	Bother	KCNQ2	49	36
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc([N+](=O)[O-])c1	ZINC000819129485	CF	On-Demand	Bother	KCNQ2	49	36
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1C1CCOCC1	ZINC000819129506	ED	On-Demand	Anodyne	ADRB1	30	43
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1C1CCOCC1	ZINC000819129506	ED	On-Demand	Anodyne	ADRB3	46	44
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1C1CCOCC1	ZINC000819129506	ED	On-Demand	Anodyne	IGF1R	30	41
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1C1CCOCC1	ZINC000819129506	ED	On-Demand	Anodyne	CYP3A4	53	41
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1C1CCOCC1	ZINC000819129507	ED	On-Demand	Anodyne	ADRB1	30	43
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1C1CCOCC1	ZINC000819129507	ED	On-Demand	Anodyne	ADRB3	46	44
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1C1CCOCC1	ZINC000819129507	ED	On-Demand	Anodyne	IGF1R	30	41
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1C1CCOCC1	ZINC000819129507	ED	On-Demand	Anodyne	CYP3A4	53	41
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1C1CCOCC1	ZINC000819129508	ED	On-Demand	Anodyne	ADRB1	30	43
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1C1CCOCC1	ZINC000819129508	ED	On-Demand	Anodyne	ADRB3	46	44
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1C1CCOCC1	ZINC000819129508	ED	On-Demand	Anodyne	IGF1R	30	41
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1C1CCOCC1	ZINC000819129508	ED	On-Demand	Anodyne	CYP3A4	53	41
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1C1CCOCC1	ZINC000819129509	ED	On-Demand	Anodyne	ADRB1	30	43
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1C1CCOCC1	ZINC000819129509	ED	On-Demand	Anodyne	ADRB3	46	44
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1C1CCOCC1	ZINC000819129509	ED	On-Demand	Anodyne	IGF1R	30	41
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1C1CCOCC1	ZINC000819129509	ED	On-Demand	Anodyne	CYP3A4	53	41
O[C@H](CNCc1ccon1)c1cccc(Cl)c1	ZINC000819129517	CE	On-Demand	Anodyne	ADRB1	27	43
O[C@H](CNCc1ccon1)c1cccc(Cl)c1	ZINC000819129517	CE	On-Demand	Anodyne	ADRB3	41	43
O[C@@H](CNCc1ccon1)c1cccc(Cl)c1	ZINC000819129518	CE	On-Demand	Anodyne	ADRB1	27	43
O[C@@H](CNCc1ccon1)c1cccc(Cl)c1	ZINC000819129518	CE	On-Demand	Anodyne	ADRB3	41	43
COC(=O)c1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819129529	DC	On-Demand	Anodyne	ADRB2	44	45
COC(=O)c1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819129529	DC	On-Demand	Anodyne	ADRB1	68	45
COC(=O)c1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819129529	DC	On-Demand	Anodyne	ADRB3	42	45
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819129530	DC	On-Demand	Anodyne	ADRB2	44	45
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819129530	DC	On-Demand	Anodyne	ADRB1	68	45
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819129530	DC	On-Demand	Anodyne	ADRB3	42	45
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccon2)c1	ZINC000819129541	CD	On-Demand	Anodyne	ADRB2	28	44
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccon2)c1	ZINC000819129541	CD	On-Demand	Anodyne	ADRB1	45	39
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccon2)c1	ZINC000819129541	CD	On-Demand	Anodyne	ABCB1	17	45
CC(=O)c1cccc(OC[C@H](O)CNCc2ccon2)c1	ZINC000819129542	CD	On-Demand	Anodyne	ADRB2	28	44
CC(=O)c1cccc(OC[C@H](O)CNCc2ccon2)c1	ZINC000819129542	CD	On-Demand	Anodyne	ADRB1	45	39
CC(=O)c1cccc(OC[C@H](O)CNCc2ccon2)c1	ZINC000819129542	CD	On-Demand	Anodyne	ABCB1	17	45
O=C(Cc1nsc2ccccc12)NCc1ccc(N2CCOCC2)c(F)c1	ZINC000819129592	GG	On-Demand	Clean	PRKDC	54	33
C[C@H](O)c1ccc(CNC[C@@H](O)COCc2ccccc2)cc1	ZINC000819129614	DE	On-Demand	Anodyne	ADRB2	32	45
C[C@H](O)c1ccc(CNC[C@H](O)COCc2ccccc2)cc1	ZINC000819129616	DE	On-Demand	Anodyne	ADRB2	32	45
C/C=C\c1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)c(OC)c1	ZINC000819129617	FG	On-Demand	Anodyne	ADRB2	22	67
C/C=C\c1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)c(OC)c1	ZINC000819129617	FG	On-Demand	Anodyne	ADRB1	15	67
C/C=C\c1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)c(OC)c1	ZINC000819129619	FG	On-Demand	Anodyne	ADRB2	22	67
C/C=C\c1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)c(OC)c1	ZINC000819129619	FG	On-Demand	Anodyne	ADRB1	15	67
C/C=C/c1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)c(OC)c1	ZINC000819129621	FG	On-Demand	Anodyne	ADRB2	22	67
C/C=C/c1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)c(OC)c1	ZINC000819129621	FG	On-Demand	Anodyne	ADRB1	15	67
C/C=C/c1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)c(OC)c1	ZINC000819129623	FG	On-Demand	Anodyne	ADRB2	22	67
C/C=C/c1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)c(OC)c1	ZINC000819129623	FG	On-Demand	Anodyne	ADRB1	15	67
Cc1ccc(NCCCNC[C@H](O)c2cccc(F)c2)nc1	ZINC000819129631	DF	On-Demand	Anodyne	ADRB1	24	40
Cc1ccc(NCCCNC[C@H](O)c2cccc(F)c2)nc1	ZINC000819129631	DF	On-Demand	Anodyne	ADRB3	33	40
Cc1ccc(NCCCNC[C@@H](O)c2cccc(F)c2)nc1	ZINC000819129632	DF	On-Demand	Anodyne	ADRB1	24	40
Cc1ccc(NCCCNC[C@@H](O)c2cccc(F)c2)nc1	ZINC000819129632	DF	On-Demand	Anodyne	ADRB3	33	40
O=C(CCNCc1ccon1)Nc1cccc(C(F)(F)F)c1	ZINC000819129633	DF	On-Demand	Anodyne	KDR	16	40
Cn1ccnc1-c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129656	GH	On-Demand	Mild	PAPA1_CARPA	36	40
Cn1ccnc1-c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129658	GH	On-Demand	Mild	PAPA1_CARPA	36	40
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819129674	FE	On-Demand	Anodyne	ADRB1	47	39
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819129674	FE	On-Demand	Anodyne	ADRB3	35	41
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819129676	FE	On-Demand	Anodyne	ADRB1	47	39
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819129676	FE	On-Demand	Anodyne	ADRB3	35	41
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819129680	EE	On-Demand	Mild	ADRB2	44	48
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819129680	EE	On-Demand	Mild	ADRB1	61	48
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819129680	EE	On-Demand	Mild	ADRB3	40	44
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819129681	EE	On-Demand	Mild	ADRB2	44	48
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819129681	EE	On-Demand	Mild	ADRB1	61	48
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819129681	EE	On-Demand	Mild	ADRB3	40	44
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819129694	DE	On-Demand	Anodyne	ADRB2	59	51
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819129694	DE	On-Demand	Anodyne	ADRB1	78	51
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819129694	DE	On-Demand	Anodyne	GRIN1	19	52
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819129694	DE	On-Demand	Anodyne	ADRB3	50	47
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819129695	DE	On-Demand	Anodyne	ADRB2	59	51
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819129695	DE	On-Demand	Anodyne	ADRB1	78	51
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819129695	DE	On-Demand	Anodyne	GRIN1	19	52
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819129695	DE	On-Demand	Anodyne	ADRB3	50	47
COc1cccc(C(NCCC(=O)N(C)OC)c2cccc(OC)c2)c1	ZINC000819129707	FF	On-Demand	Anodyne	DRD4	42	32
COc1cccc(C(NCCC(=O)N(C)OC)c2cccc(OC)c2)c1	ZINC000819129707	FF	On-Demand	Anodyne	MTNR1A	52	44
COc1cccc(C(NCCC(=O)N(C)OC)c2cccc(OC)c2)c1	ZINC000819129707	FF	On-Demand	Anodyne	MTNR1B	51	44
COc1cccc(C(NCCC(=O)N(C)OC)c2cccc(OC)c2)c1	ZINC000819129707	FF	On-Demand	Anodyne	AOC3	16	47
O=C1[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)CCN1C1CCOCC1	ZINC000819129735	FD	On-Demand	Anodyne	MAPK1	48	39
O=C1[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)CCN1C1CCOCC1	ZINC000819129736	FD	On-Demand	Anodyne	MAPK1	48	39
O=C1[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)CCN1C1CCOCC1	ZINC000819129737	FD	On-Demand	Anodyne	MAPK1	48	39
O=C1[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)CCN1C1CCOCC1	ZINC000819129738	FD	On-Demand	Anodyne	MAPK1	48	39
O=C(/C=C\[C@@H]1CCCO1)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000819129773	EH	On-Demand	Anodyne	CDK5	46	37
O=C(/C=C\[C@@H]1CCCO1)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000819129773	EH	On-Demand	Anodyne	SCD	33	46
O=C(/C=C\[C@H]1CCCO1)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000819129774	EH	On-Demand	Anodyne	CDK5	46	37
O=C(/C=C\[C@H]1CCCO1)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000819129774	EH	On-Demand	Anodyne	SCD	33	46
O=C(/C=C/[C@H]1CCCO1)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000819129775	EH	On-Demand	Anodyne	CDK5	46	37
O=C(/C=C/[C@H]1CCCO1)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000819129775	EH	On-Demand	Anodyne	SCD	33	46
O=C(/C=C/[C@@H]1CCCO1)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000819129776	EH	On-Demand	Anodyne	CDK5	46	37
O=C(/C=C/[C@@H]1CCCO1)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000819129776	EH	On-Demand	Anodyne	SCD	33	46
COc1ccc(OC)c([C@H](O)CNCCCNc2ccc(C)cn2)c1	ZINC000819129812	EF	On-Demand	Anodyne	LUCI_LUCLA	17	46
O=C(Cc1ccc(-n2cnnc2)cc1)NCc1ccc(N2CCOCC2)c(F)c1	ZINC000819129815	GE	On-Demand	Clean	NOS2	41	33
O=C(Cc1ccc(-n2cnnc2)cc1)NCc1ccc(N2CCOCC2)c(F)c1	ZINC000819129815	GE	On-Demand	Clean	STAT6	46	33
COC(=O)c1ccc(CCNC(=O)c2ccc3c(c2)-c2ccccc2C3)cc1	ZINC000819129860	FI	On-Demand	Anodyne	DRD4	40	31
COC(=O)c1ccc(CCNC(=O)c2ccc3c(c2)-c2ccccc2C3)cc1	ZINC000819129860	FI	On-Demand	Anodyne	DRD3	17	48
COC(=O)c1ccc(CCNC(=O)c2ccc3c(c2)-c2ccccc2C3)cc1	ZINC000819129860	FI	On-Demand	Anodyne	TRPA1	21	40
COC(=O)Nc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129882	GG	On-Demand	Mild	PAPA1_CARPA	55	50
COC(=O)Nc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129882	GG	On-Demand	Mild	CTSK	21	47
COC(=O)Nc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129882	GG	On-Demand	Mild	CTSL	22	50
COC(=O)Nc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129882	GG	On-Demand	Mild	HDAC8	17	43
COC(=O)Nc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129882	GG	On-Demand	Mild	HDAC10	46	38
COC(=O)Nc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129882	GG	On-Demand	Mild	HDAC1	16	60
COC(=O)Nc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129882	GG	On-Demand	Mild	CTSS	17	53
COC(=O)Nc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129882	GG	On-Demand	Mild	HDAC11	51	38
COC(=O)Nc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129882	GG	On-Demand	Mild	FPR1	44	39
COC(=O)Nc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129883	GG	On-Demand	Mild	PAPA1_CARPA	55	50
COC(=O)Nc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129883	GG	On-Demand	Mild	CTSK	21	47
COC(=O)Nc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129883	GG	On-Demand	Mild	CTSL	22	50
COC(=O)Nc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129883	GG	On-Demand	Mild	HDAC8	17	43
COC(=O)Nc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129883	GG	On-Demand	Mild	HDAC10	46	38
COC(=O)Nc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129883	GG	On-Demand	Mild	HDAC1	16	60
COC(=O)Nc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129883	GG	On-Demand	Mild	CTSS	17	53
COC(=O)Nc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129883	GG	On-Demand	Mild	HDAC11	51	38
COC(=O)Nc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819129883	GG	On-Demand	Mild	FPR1	44	39
C[C@H](O)c1ccc(CNCCC(=O)Nc2cc(F)cc(F)c2)cc1	ZINC000819129897	EG	On-Demand	Anodyne	LEF	72	36
O=C1C[C@H](NC[C@H](O)c2ccc(F)cc2Cl)CN1C1CC1	ZINC000819129898	DD	On-Demand	Anodyne	P2RX7	22	51
O=C1C[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)CN1C1CC1	ZINC000819129899	DD	On-Demand	Anodyne	P2RX7	22	51
O=C1C[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)CN1C1CC1	ZINC000819129900	DD	On-Demand	Anodyne	P2RX7	22	51
O=C1C[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)CN1C1CC1	ZINC000819129901	DD	On-Demand	Anodyne	P2RX7	22	51
C[C@H](O)c1ccc(CNCCS(=O)(=O)c2ccc(F)cc2)cc1	ZINC000819129911	EE	On-Demand	Anodyne	LEF	44	39
O[C@H](CNCc1ccon1)COc1ccccc1C(F)(F)F	ZINC000819129920	DE	On-Demand	Anodyne	ADRB2	17	40
O[C@H](CNCc1ccon1)COc1ccccc1C(F)(F)F	ZINC000819129920	DE	On-Demand	Anodyne	ADRB1	52	33
O[C@@H](CNCc1ccon1)COc1ccccc1C(F)(F)F	ZINC000819129921	DE	On-Demand	Anodyne	ADRB2	17	40
O[C@@H](CNCc1ccon1)COc1ccccc1C(F)(F)F	ZINC000819129921	DE	On-Demand	Anodyne	ADRB1	52	33
Cc1ccc(NCCCNC[C@H](O)c2ccccc2)nc1	ZINC000819129928	CF	On-Demand	Anodyne	ADRB2	19	43
Cc1ccc(NCCCNC[C@H](O)c2ccccc2)nc1	ZINC000819129928	CF	On-Demand	Anodyne	ADRB3	50	40
Cc1ccc(NCCCNC[C@@H](O)c2ccccc2)nc1	ZINC000819129929	CF	On-Demand	Anodyne	ADRB2	19	43
Cc1ccc(NCCCNC[C@@H](O)c2ccccc2)nc1	ZINC000819129929	CF	On-Demand	Anodyne	ADRB3	50	40
C[C@H](O)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819129932	CD	On-Demand	Anodyne	ADRB2	35	46
C[C@H](O)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819129932	CD	On-Demand	Anodyne	ADRB1	36	49
C[C@H](O)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819129932	CD	On-Demand	Anodyne	ADRB3	111	51
C[C@H](O)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819129932	CD	On-Demand	Anodyne	KCNA5	20	40
C[C@H](O)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819129933	CD	On-Demand	Anodyne	ADRB2	35	46
C[C@H](O)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819129933	CD	On-Demand	Anodyne	ADRB1	36	49
C[C@H](O)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819129933	CD	On-Demand	Anodyne	ADRB3	111	51
C[C@H](O)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819129933	CD	On-Demand	Anodyne	KCNA5	20	40
C[C@H](O)c1ccc(CNC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819129956	FG	On-Demand	Anodyne	ADRB2	32	40
C[C@H](O)c1ccc(CNC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819129958	FG	On-Demand	Anodyne	ADRB2	32	40
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819129963	FH	On-Demand	Anodyne	ADRB2	28	43
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819129964	FH	On-Demand	Anodyne	ADRB2	28	43
Cn1ccnc1-c1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819130002	CG	On-Demand	Anodyne	CCR3	28	43
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819130011	FG	On-Demand	Anodyne	ADRB2	54	71
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819130011	FG	On-Demand	Anodyne	ADRB1	66	42
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819130011	FG	On-Demand	Anodyne	ADRB3	35	62
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819130011	FG	On-Demand	Anodyne	CASR	40	38
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819130011	FG	On-Demand	Anodyne	CYP2D6	19	45
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819130011	FG	On-Demand	Anodyne	ABCB1	22	42
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819130013	FG	On-Demand	Anodyne	ADRB2	54	71
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819130013	FG	On-Demand	Anodyne	ADRB1	66	42
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819130013	FG	On-Demand	Anodyne	ADRB3	35	62
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819130013	FG	On-Demand	Anodyne	CASR	40	38
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819130013	FG	On-Demand	Anodyne	CYP2D6	19	45
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819130013	FG	On-Demand	Anodyne	ABCB1	22	42
CN1C(=O)N[C@]2(CCC[C@@H]2CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819130016	FC	On-Demand	Bother	CACNA1C	55	35
CN1C(=O)N[C@]2(CCC[C@@H]2CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819130016	FC	On-Demand	Bother	CACNA1D	82	34
CN1C(=O)N[C@]2(CCC[C@H]2CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819130018	FC	On-Demand	Bother	CACNA1C	55	35
CN1C(=O)N[C@]2(CCC[C@H]2CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819130018	FC	On-Demand	Bother	CACNA1D	82	34
O=C1C[C@H](NC[C@H](O)c2ccccc2Cl)CN1C1CC1	ZINC000819130019	CD	On-Demand	Anodyne	OPRL1	43	39
O=C1C[C@@H](NC[C@H](O)c2ccccc2Cl)CN1C1CC1	ZINC000819130020	CD	On-Demand	Anodyne	OPRL1	43	39
CN1C(=O)N[C@]2(CCC[C@@H]2CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819130021	FC	On-Demand	Bother	CACNA1C	55	35
CN1C(=O)N[C@]2(CCC[C@@H]2CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819130021	FC	On-Demand	Bother	CACNA1D	82	34
CN1C(=O)N[C@]2(CCC[C@H]2CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819130023	FC	On-Demand	Bother	CACNA1C	55	35
CN1C(=O)N[C@]2(CCC[C@H]2CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819130023	FC	On-Demand	Bother	CACNA1D	82	34
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2)cc1	ZINC000819130037	DE	On-Demand	Anodyne	ADRB2	76	68
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2)cc1	ZINC000819130037	DE	On-Demand	Anodyne	ADRB1	94	53
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2)cc1	ZINC000819130037	DE	On-Demand	Anodyne	ADRB3	66	53
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2)cc1	ZINC000819130037	DE	On-Demand	Anodyne	CASR	29	42
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2)cc1	ZINC000819130037	DE	On-Demand	Anodyne	ABCB1	21	46
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2)cc1	ZINC000819130037	DE	On-Demand	Anodyne	PDS	55	40
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2)cc1	ZINC000819130039	DE	On-Demand	Anodyne	ADRB2	76	68
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2)cc1	ZINC000819130039	DE	On-Demand	Anodyne	ADRB1	94	53
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2)cc1	ZINC000819130039	DE	On-Demand	Anodyne	ADRB3	66	53
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2)cc1	ZINC000819130039	DE	On-Demand	Anodyne	CASR	29	42
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2)cc1	ZINC000819130039	DE	On-Demand	Anodyne	ABCB1	21	46
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2)cc1	ZINC000819130039	DE	On-Demand	Anodyne	PDS	55	40
O=C1C[C@H](NC[C@H](O)c2ccc(F)c(F)c2)CN1C1CC1	ZINC000819130041	CD	On-Demand	Anodyne	ADRB3	19	40
O=C1C[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)CN1C1CC1	ZINC000819130042	CD	On-Demand	Anodyne	ADRB3	19	40
O=C1C[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)CN1C1CC1	ZINC000819130044	CD	On-Demand	Anodyne	ADRB3	19	40
O=C1C[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)CN1C1CC1	ZINC000819130046	CD	On-Demand	Anodyne	ADRB3	19	40
CN1C(=O)N[C@]2(CCC[C@@H]2CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000819130048	FC	On-Demand	Bother	SLC27A4	41	31
CN1C(=O)N[C@]2(CCC[C@H]2CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000819130050	FC	On-Demand	Bother	SLC27A4	41	31
CN1C(=O)N[C@]2(CCC[C@@H]2CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000819130053	FC	On-Demand	Bother	SLC27A4	41	31
CN1C(=O)N[C@]2(CCC[C@H]2CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000819130055	FC	On-Demand	Bother	SLC27A4	41	31
C[C@H](O)c1ccc(CNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819130059	CF	On-Demand	Anodyne	ADRB2	19	42
C[C@H](O)c1ccc(CNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819130063	CF	On-Demand	Anodyne	ADRB2	19	42
C[C@H](O)c1ccc(CNC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819130065	EE	On-Demand	Anodyne	NOD2	42	36
C[C@H](O)c1ccc(CNC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819130071	EE	On-Demand	Anodyne	NOD2	42	36
O[C@H](CNCc1ccon1)COc1cccc2[nH]ccc12	ZINC000819130110	CD	On-Demand	Anodyne	ADRB1	28	58
O[C@@H](CNCc1ccon1)COc1cccc2[nH]ccc12	ZINC000819130111	CD	On-Demand	Anodyne	ADRB1	28	58
C[C@H](O)c1ccc(CNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819130121	DF	On-Demand	Anodyne	LEF	63	38
C[C@H](O)c1ccc(CNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819130123	DF	On-Demand	Anodyne	LEF	63	38
C[C@H](O)c1ccc(CNC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819130125	DG	On-Demand	Anodyne	LEF	48	37
C[C@H](O)c1ccc(CNC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819130127	DG	On-Demand	Anodyne	LEF	48	37
O=C(NCCCCOCCc1ccccc1)C(F)=C1CCC1	ZINC000819130133	DH	On-Demand	Anodyne	AMP1_PLAFQ	20	41
C[C@H](O)c1ccc(CNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819130155	DG	On-Demand	Anodyne	ADRB2	20	42
C[C@H](O)c1ccc(CNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819130155	DG	On-Demand	Anodyne	ADRB1	19	42
C[C@H](O)c1ccc(CNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819130155	DG	On-Demand	Anodyne	ADRB3	24	42
O=C1C[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)CN1C1CC1	ZINC000819130164	EE	On-Demand	Anodyne	ADRB3	15	40
O=C1C[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)CN1C1CC1	ZINC000819130164	EE	On-Demand	Anodyne	CCR2	47	35
O=C1C[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)CN1C1CC1	ZINC000819130165	EE	On-Demand	Anodyne	ADRB3	15	40
O=C1C[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)CN1C1CC1	ZINC000819130165	EE	On-Demand	Anodyne	CCR2	47	35
O=C1C[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)CN1C1CC1	ZINC000819130166	EE	On-Demand	Anodyne	ADRB3	15	40
O=C1C[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)CN1C1CC1	ZINC000819130166	EE	On-Demand	Anodyne	CCR2	47	35
O=C1C[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)CN1C1CC1	ZINC000819130167	EE	On-Demand	Anodyne	ADRB3	15	40
O=C1C[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)CN1C1CC1	ZINC000819130167	EE	On-Demand	Anodyne	CCR2	47	35
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819130172	EE	On-Demand	Bother	ADRB2	40	46
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819130172	EE	On-Demand	Bother	ADRB1	60	38
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819130172	EE	On-Demand	Bother	ADRB3	29	42
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819130172	EE	On-Demand	Bother	COLA	61	32
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819130172	EE	On-Demand	Bother	ABCB1	15	41
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819130175	EE	On-Demand	Bother	ADRB2	40	46
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819130175	EE	On-Demand	Bother	ADRB1	60	38
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819130175	EE	On-Demand	Bother	ADRB3	29	42
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819130175	EE	On-Demand	Bother	COLA	61	32
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819130175	EE	On-Demand	Bother	ABCB1	15	41
COc1cccc(OC)c1OC[C@H](O)CNCc1ccon1	ZINC000819130204	DD	On-Demand	Anodyne	ADRB2	23	42
COc1cccc(OC)c1OC[C@@H](O)CNCc1ccon1	ZINC000819130206	DD	On-Demand	Anodyne	ADRB2	23	42
C[C@H](O)c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819130210	CF	On-Demand	Anodyne	ADRB2	42	49
C[C@H](O)c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819130210	CF	On-Demand	Anodyne	ADRB1	36	44
C[C@H](O)c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819130210	CF	On-Demand	Anodyne	ADRB3	58	44
C[C@H](O)c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819130210	CF	On-Demand	Anodyne	AOC3	16	47
C[C@H](O)c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819130211	CF	On-Demand	Anodyne	ADRB2	42	49
C[C@H](O)c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819130211	CF	On-Demand	Anodyne	ADRB1	36	44
C[C@H](O)c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819130211	CF	On-Demand	Anodyne	ADRB3	58	44
C[C@H](O)c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819130211	CF	On-Demand	Anodyne	AOC3	16	47
Cn1ccnc1-c1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819130214	CF	On-Demand	Anodyne	CCR3	21	43
Cn1ccnc1-c1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819130215	CF	On-Demand	Anodyne	CCR3	21	43
Cn1ccnc1-c1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819130216	CF	On-Demand	Anodyne	CCR3	21	43
Cn1ccnc1-c1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819130217	CF	On-Demand	Anodyne	CCR3	21	43
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819130220	EF	On-Demand	Anodyne	ADRB2	32	65
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819130220	EF	On-Demand	Anodyne	ADRB1	39	65
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819130220	EF	On-Demand	Anodyne	ADRB3	20	65
N#CCc1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819130238	CD	On-Demand	Mild	ADRB2	31	42
N#CCc1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819130238	CD	On-Demand	Mild	ADRB1	49	42
N#CCc1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819130238	CD	On-Demand	Mild	ADRB3	33	42
N#CCc1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819130239	CD	On-Demand	Mild	ADRB2	31	42
N#CCc1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819130239	CD	On-Demand	Mild	ADRB1	49	42
N#CCc1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819130239	CD	On-Demand	Mild	ADRB3	33	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccon1	ZINC000819130253	FE	On-Demand	Anodyne	CTSD	79	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccon1	ZINC000819130253	FE	On-Demand	Anodyne	PGC	55	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccon1	ZINC000819130253	FE	On-Demand	Anodyne	PAPA1_CARPA	32	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccon1	ZINC000819130253	FE	On-Demand	Anodyne	TACR3	15	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccon1	ZINC000819130253	FE	On-Demand	Anodyne	REN	77	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccon1	ZINC000819130253	FE	On-Demand	Anodyne	REN1	26	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccon1	ZINC000819130253	FE	On-Demand	Anodyne	BACE1	83	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccon1	ZINC000819130253	FE	On-Demand	Anodyne	FPR1	48	39
Cc1ccccc1[C@@H](O)CNCCCOC1CCN(Cc2ccccc2)CC1	ZINC000819130322	GH	On-Demand	Anodyne	ADRB2	46	39
Cc1ccccc1[C@@H](O)CNCCCOC1CCN(Cc2ccccc2)CC1	ZINC000819130322	GH	On-Demand	Anodyne	ACHE	40	44
Cc1ccccc1[C@@H](O)CNCCCOC1CCN(Cc2ccccc2)CC1	ZINC000819130322	GH	On-Demand	Anodyne	SIGMAR1	45	55
CC(C)c1nnc(CNC[C@@H](O)c2cccc(Cl)c2)s1	ZINC000819130330	DG	On-Demand	Anodyne	ADRB2	17	40
CC(C)c1nnc(CNC[C@@H](O)c2cccc(Cl)c2)s1	ZINC000819130330	DG	On-Demand	Anodyne	ADRB1	36	44
CC(C)c1nnc(CNC[C@@H](O)c2cccc(Cl)c2)s1	ZINC000819130330	DG	On-Demand	Anodyne	ADRB3	54	43
CC(C)c1nnc(CNC[C@H](O)c2cccc(Cl)c2)s1	ZINC000819130331	DG	On-Demand	Anodyne	ADRB2	17	40
CC(C)c1nnc(CNC[C@H](O)c2cccc(Cl)c2)s1	ZINC000819130331	DG	On-Demand	Anodyne	ADRB1	36	44
CC(C)c1nnc(CNC[C@H](O)c2cccc(Cl)c2)s1	ZINC000819130331	DG	On-Demand	Anodyne	ADRB3	54	43
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccccc1F	ZINC000819130346	GH	On-Demand	Anodyne	SLC6A3	23	44
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccccc1F	ZINC000819130346	GH	On-Demand	Anodyne	SIGMAR1	43	55
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccccc1F	ZINC000819130347	GH	On-Demand	Anodyne	SLC6A3	23	44
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccccc1F	ZINC000819130347	GH	On-Demand	Anodyne	SIGMAR1	43	55
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(C)(C)S(C)(=O)=O)CC1	ZINC000819130361	GD	On-Demand	Anodyne	GPR119	48	48
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(C)(C)S(C)(=O)=O)CC1	ZINC000819130362	GD	On-Demand	Anodyne	GPR119	48	48
OC1(CNCCCOC2CCN(Cc3ccccc3)CC2)CCCCC1	ZINC000819130386	FG	On-Demand	Anodyne	ACHE	42	39
OC1(CNCCCOC2CCN(Cc3ccccc3)CC2)CCCCC1	ZINC000819130386	FG	On-Demand	Anodyne	SIGMAR1	61	57
OC1(CNCCCOC2CCN(Cc3ccccc3)CC2)CCCCC1	ZINC000819130386	FG	On-Demand	Anodyne	CACNA1G	15	41
CN1CCC[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1=O	ZINC000819130388	FD	On-Demand	Anodyne	GPR119	32	45
CN1CCC[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1=O	ZINC000819130390	FD	On-Demand	Anodyne	GPR119	32	45
CNC(=O)Cn1cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cn1	ZINC000819130395	GD	On-Demand	Mild	PAPA1_CARPA	38	44
CNC(=O)Cn1cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cn1	ZINC000819130396	GD	On-Demand	Mild	PAPA1_CARPA	38	44
CS(=O)(=O)CC1(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819130397	FE	On-Demand	Anodyne	ADRB3	40	39
CS(=O)(=O)CC1(CNC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819130398	FE	On-Demand	Anodyne	ADRB3	40	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cnn(CC(=O)NC2CC2)c1	ZINC000819130399	FD	On-Demand	Anodyne	PANC	54	36
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819130416	EF	On-Demand	Anodyne	ADRB2	32	65
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819130416	EF	On-Demand	Anodyne	ADRB1	39	65
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819130416	EF	On-Demand	Anodyne	ADRB3	20	65
O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cc2c(cn1)OCCO2	ZINC000819130422	FD	On-Demand	Clean	SCN10A	21	40
O=C(NCc1ccc(N2CCOCC2)c(F)c1)c1cc2c(cn1)OCCO2	ZINC000819130422	FD	On-Demand	Clean	STAT6	44	33
C[C@@H](CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)n1cccn1	ZINC000819130424	EE	On-Demand	Clean	NPY2R	63	34
C[C@H](CC(=O)NCc1ccc(N2CCOCC2)c(F)c1)n1cccn1	ZINC000819130425	EE	On-Demand	Clean	NPY2R	63	34
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819130426	ED	On-Demand	Anodyne	ADRB2	31	42
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819130426	ED	On-Demand	Anodyne	ADRB1	46	42
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819130426	ED	On-Demand	Anodyne	BMP1	41	41
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819130429	ED	On-Demand	Anodyne	ADRB2	31	42
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819130429	ED	On-Demand	Anodyne	ADRB1	46	42
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819130429	ED	On-Demand	Anodyne	BMP1	41	41
C[C@H](O)c1ccc(CNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819130456	DG	On-Demand	Anodyne	ADRB2	21	46
C[C@H](O)c1ccc(CNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819130456	DG	On-Demand	Anodyne	ADRB1	16	46
C[C@H](O)c1ccc(CNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819130458	DG	On-Demand	Anodyne	ADRB2	21	46
C[C@H](O)c1ccc(CNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819130458	DG	On-Demand	Anodyne	ADRB1	16	46
COc1ccccc1COC[C@@H](O)CNCc1ccc([C@@H](C)O)cc1	ZINC000819130472	EE	On-Demand	Anodyne	ADRB2	27	40
COc1ccccc1COC[C@@H](O)CNCc1ccc([C@@H](C)O)cc1	ZINC000819130472	EE	On-Demand	Anodyne	ADRB1	19	43
COc1ccccc1COC[C@H](O)CNCc1ccc([C@@H](C)O)cc1	ZINC000819130473	EE	On-Demand	Anodyne	ADRB2	27	40
COc1ccccc1COC[C@H](O)CNCc1ccc([C@@H](C)O)cc1	ZINC000819130473	EE	On-Demand	Anodyne	ADRB1	19	43
COc1ccccc1COC[C@H](O)CNCc1ccc([C@H](C)O)cc1	ZINC000819130474	EE	On-Demand	Anodyne	ADRB2	27	40
COc1ccccc1COC[C@H](O)CNCc1ccc([C@H](C)O)cc1	ZINC000819130474	EE	On-Demand	Anodyne	ADRB1	19	43
COc1ccccc1COC[C@@H](O)CNCc1ccc([C@H](C)O)cc1	ZINC000819130475	EE	On-Demand	Anodyne	ADRB2	27	40
COc1ccccc1COC[C@@H](O)CNCc1ccc([C@H](C)O)cc1	ZINC000819130475	EE	On-Demand	Anodyne	ADRB1	19	43
COc1cccc(C(NCCS(C)(=O)=O)c2cccc(OC)c2)c1	ZINC000819130498	EE	On-Demand	Anodyne	MTNR1A	39	43
COc1cccc(C(NCCS(C)(=O)=O)c2cccc(OC)c2)c1	ZINC000819130498	EE	On-Demand	Anodyne	MTNR1B	36	43
C[C@H](O)c1ccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819130500	EH	On-Demand	Anodyne	ADRB2	29	45
C[C@H](O)c1ccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819130500	EH	On-Demand	Anodyne	CCR2	25	43
C[C@H](O)c1ccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819130500	EH	On-Demand	Anodyne	PDS	42	37
C[C@H](O)c1ccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819130502	EH	On-Demand	Anodyne	ADRB2	29	45
C[C@H](O)c1ccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819130502	EH	On-Demand	Anodyne	CCR2	25	43
C[C@H](O)c1ccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819130502	EH	On-Demand	Anodyne	PDS	42	37
C[C@H](O)c1ccc(CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819130505	DG	On-Demand	Anodyne	ADRB2	15	40
C[C@H](O)c1ccc(CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819130505	DG	On-Demand	Anodyne	ADRB1	25	40
C[C@H](O)c1ccc(CNC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819130505	DG	On-Demand	Anodyne	ADRB3	29	42
NS(=O)(=O)c1cnn(CCC(=O)NCCCC(=O)O)c1	ZINC000819130506	DA	On-Demand	Anodyne	CA2	31	49
NS(=O)(=O)c1cnn(CCC(=O)NCCCC(=O)O)c1	ZINC000819130506	DA	On-Demand	Anodyne	CA1	29	49
NS(=O)(=O)c1cnn(CCC(=O)NCCCC(=O)O)c1	ZINC000819130506	DA	On-Demand	Anodyne	CA4	39	49
C[C@H](O)c1ccc(CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819130507	DG	On-Demand	Anodyne	ADRB2	15	40
C[C@H](O)c1ccc(CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819130507	DG	On-Demand	Anodyne	ADRB1	25	40
C[C@H](O)c1ccc(CNC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819130507	DG	On-Demand	Anodyne	ADRB3	29	42
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819130510	EE	On-Demand	Bother	ADRB2	40	51
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819130510	EE	On-Demand	Bother	ADRB1	53	51
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819130510	EE	On-Demand	Bother	ADRB3	38	51
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819130510	EE	On-Demand	Bother	CACNA1D	62	35
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819130510	EE	On-Demand	Bother	PDS	51	50
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CN1CCC[C@H](CC(=O)O)C1	ZINC000819130511	GC	On-Demand	Anodyne	CA7	23	48
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819130512	EE	On-Demand	Bother	ADRB2	40	51
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819130512	EE	On-Demand	Bother	ADRB1	53	51
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819130512	EE	On-Demand	Bother	ADRB3	38	51
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819130512	EE	On-Demand	Bother	CACNA1D	62	35
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819130512	EE	On-Demand	Bother	PDS	51	50
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CN1CCC[C@@H](CC(=O)O)C1	ZINC000819130513	GC	On-Demand	Anodyne	CA7	23	48
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CC(=O)N(C3CC3)C2)CC1	ZINC000819130518	FD	On-Demand	Anodyne	GPR119	30	43
NS(=O)(=O)c1ccc(CNC(=O)Nc2ccccc2CC(=O)O)s1	ZINC000819130519	FD	On-Demand	Anodyne	CA2	19	42
NS(=O)(=O)c1ccc(CNC(=O)Nc2ccccc2CC(=O)O)s1	ZINC000819130519	FD	On-Demand	Anodyne	CA5B	56	35
NS(=O)(=O)c1ccc(CNC(=O)Nc2ccccc2CC(=O)O)s1	ZINC000819130519	FD	On-Demand	Anodyne	CA5A	60	35
NS(=O)(=O)c1ccc(CNC(=O)Nc2ccccc2CC(=O)O)s1	ZINC000819130519	FD	On-Demand	Anodyne	CA12	15	42
NS(=O)(=O)c1ccc(CC(=O)OCc2ccc(C(=O)O)cc2)s1	ZINC000819130520	FD	On-Demand	Anodyne	CA2	19	42
Nc1nc(CN2CCC[C@H](CC(=O)O)C2)nc2ccccc12	ZINC000819130521	DD	On-Demand	Anodyne	SLC6A1	41	33
Nc1nc(CN2CCC[C@@H](CC(=O)O)C2)nc2ccccc12	ZINC000819130522	DD	On-Demand	Anodyne	SLC6A1	41	33
NS(=O)(=O)c1ccsc1C(=O)OCc1ccc(C(=O)O)cc1	ZINC000819130523	ED	On-Demand	Anodyne	CA2	22	43
NS(=O)(=O)c1ccsc1C(=O)OCc1ccc(C(=O)O)cc1	ZINC000819130523	ED	On-Demand	Anodyne	CA1	15	43
NS(=O)(=O)c1ccsc1C(=O)OCc1ccc(C(=O)O)cc1	ZINC000819130523	ED	On-Demand	Anodyne	CA4	23	43
NS(=O)(=O)c1cccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130525	FC	On-Demand	Anodyne	CA2	40	57
NS(=O)(=O)c1cccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130525	FC	On-Demand	Anodyne	CA1	33	49
NS(=O)(=O)c1cccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130525	FC	On-Demand	Anodyne	CA5B	43	36
NS(=O)(=O)c1cccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130525	FC	On-Demand	Anodyne	CA4	48	55
NS(=O)(=O)c1cccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130525	FC	On-Demand	Anodyne	CA5A	49	36
NS(=O)(=O)c1cccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130525	FC	On-Demand	Anodyne	CA12	17	49
NS(=O)(=O)c1cccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130525	FC	On-Demand	Anodyne	ST14	42	36
NS(=O)(=O)c1cccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130525	FC	On-Demand	Anodyne	CA9	19	49
NS(=O)(=O)c1cccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130526	FC	On-Demand	Anodyne	CA2	40	57
NS(=O)(=O)c1cccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130526	FC	On-Demand	Anodyne	CA1	33	49
NS(=O)(=O)c1cccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130526	FC	On-Demand	Anodyne	CA5B	43	36
NS(=O)(=O)c1cccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130526	FC	On-Demand	Anodyne	CA4	48	55
NS(=O)(=O)c1cccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130526	FC	On-Demand	Anodyne	CA5A	49	36
NS(=O)(=O)c1cccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130526	FC	On-Demand	Anodyne	CA12	17	49
NS(=O)(=O)c1cccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130526	FC	On-Demand	Anodyne	ST14	42	36
NS(=O)(=O)c1cccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130526	FC	On-Demand	Anodyne	CA9	19	49
NS(=O)(=O)c1ccc(SCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130527	GD	On-Demand	Anodyne	CA2	107	54
NS(=O)(=O)c1ccc(SCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130527	GD	On-Demand	Anodyne	CA6	21	54
NS(=O)(=O)c1ccc(SCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130527	GD	On-Demand	Anodyne	CA1	86	54
NS(=O)(=O)c1ccc(SCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130527	GD	On-Demand	Anodyne	CA7	62	54
NS(=O)(=O)c1ccc(SCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130527	GD	On-Demand	Anodyne	CA13	38	54
NS(=O)(=O)c1ccc(SCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130527	GD	On-Demand	Anodyne	CA4	69	54
NS(=O)(=O)c1ccc(SCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130527	GD	On-Demand	Anodyne	CA5A	41	37
NS(=O)(=O)c1ccc(SCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130527	GD	On-Demand	Anodyne	CA14	41	41
NS(=O)(=O)c1ccc(SCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130527	GD	On-Demand	Anodyne	CA12	58	54
NS(=O)(=O)c1ccc(SCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130527	GD	On-Demand	Anodyne	CA9	66	54
NS(=O)(=O)c1ccc(SCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130527	GD	On-Demand	Anodyne	CYNT	27	40
NS(=O)(=O)c1ccc(SCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130527	GD	On-Demand	Anodyne	NCE103	19	54
NS(=O)(=O)c1ccc(SCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130527	GD	On-Demand	Anodyne	A6YCJ1_9METZ	21	40
NS(=O)(=O)c1ccc(NCCC(=O)N2CCC[C@H]2C(=O)O)c([N+](=O)[O-])c1	ZINC000819130528	GC	On-Demand	Bother	CA2	21	55
NS(=O)(=O)c1ccc(NCCC(=O)N2CCC[C@H]2C(=O)O)c([N+](=O)[O-])c1	ZINC000819130528	GC	On-Demand	Bother	ACE	42	40
NS(=O)(=O)c1ccc(NCCC(=O)N2CCC[C@H]2C(=O)O)c([N+](=O)[O-])c1	ZINC000819130528	GC	On-Demand	Bother	CA1	20	48
NS(=O)(=O)c1ccc(NCCC(=O)N2CCC[C@H]2C(=O)O)c([N+](=O)[O-])c1	ZINC000819130528	GC	On-Demand	Bother	CA4	21	48
NS(=O)(=O)c1ccc(NCCC(=O)N2CCC[C@H]2C(=O)O)c([N+](=O)[O-])c1	ZINC000819130528	GC	On-Demand	Bother	LGMN	51	32
NS(=O)(=O)c1ccc(CCNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130529	GD	On-Demand	Anodyne	CA2	169	73
NS(=O)(=O)c1ccc(CCNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130529	GD	On-Demand	Anodyne	CA6	26	44
NS(=O)(=O)c1ccc(CCNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130529	GD	On-Demand	Anodyne	CA1	145	73
NS(=O)(=O)c1ccc(CCNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130529	GD	On-Demand	Anodyne	CA7	77	64
NS(=O)(=O)c1ccc(CCNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130529	GD	On-Demand	Anodyne	CA13	34	44
NS(=O)(=O)c1ccc(CCNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130529	GD	On-Demand	Anodyne	CA5B	85	64
NS(=O)(=O)c1ccc(CCNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130529	GD	On-Demand	Anodyne	CA4	136	73
NS(=O)(=O)c1ccc(CCNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130529	GD	On-Demand	Anodyne	CA5A	90	64
NS(=O)(=O)c1ccc(CCNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130529	GD	On-Demand	Anodyne	CA14	55	62
NS(=O)(=O)c1ccc(CCNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130529	GD	On-Demand	Anodyne	CA12	98	73
NS(=O)(=O)c1ccc(CCNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130529	GD	On-Demand	Anodyne	CA9	112	73
NS(=O)(=O)c1ccc(CCNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130529	GD	On-Demand	Anodyne	CAH_METTE	27	41
NS(=O)(=O)c1ccc(CCNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130529	GD	On-Demand	Anodyne	CYNT	41	48
NS(=O)(=O)c1ccc(CCNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130529	GD	On-Demand	Anodyne	NCE103	43	69
NS(=O)(=O)c1ccc(CCNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130529	GD	On-Demand	Anodyne	CA15	19	42
NS(=O)(=O)c1ccc(CCNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130529	GD	On-Demand	Anodyne	MTCA1	58	51
NS(=O)(=O)c1ccc(CCNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130529	GD	On-Demand	Anodyne	P96878_MYCTU	75	51
NS(=O)(=O)c1ccc(CCNC(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130529	GD	On-Demand	Anodyne	A6YCJ1_9METZ	27	54
NS(=O)(=O)c1ccc(F)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130534	FD	On-Demand	Anodyne	CA2	102	53
NS(=O)(=O)c1ccc(F)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130534	FD	On-Demand	Anodyne	CA6	22	49
NS(=O)(=O)c1ccc(F)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130534	FD	On-Demand	Anodyne	CA1	77	50
NS(=O)(=O)c1ccc(F)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130534	FD	On-Demand	Anodyne	CA7	51	49
NS(=O)(=O)c1ccc(F)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130534	FD	On-Demand	Anodyne	CA5B	48	40
NS(=O)(=O)c1ccc(F)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130534	FD	On-Demand	Anodyne	CA4	88	53
NS(=O)(=O)c1ccc(F)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130534	FD	On-Demand	Anodyne	CA5A	51	40
NS(=O)(=O)c1ccc(F)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130534	FD	On-Demand	Anodyne	CA14	33	43
NS(=O)(=O)c1ccc(F)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130534	FD	On-Demand	Anodyne	CA12	47	49
NS(=O)(=O)c1ccc(F)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130534	FD	On-Demand	Anodyne	CA9	51	50
NS(=O)(=O)c1ccc(F)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130534	FD	On-Demand	Anodyne	NCE103	32	49
NS(=O)(=O)c1cnn(CC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130535	EB	On-Demand	Anodyne	CA2	77	50
NS(=O)(=O)c1cnn(CC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130535	EB	On-Demand	Anodyne	CA1	59	49
NS(=O)(=O)c1cnn(CC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130535	EB	On-Demand	Anodyne	CA7	32	49
NS(=O)(=O)c1cnn(CC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130535	EB	On-Demand	Anodyne	CA5B	47	49
NS(=O)(=O)c1cnn(CC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130535	EB	On-Demand	Anodyne	CA4	59	50
NS(=O)(=O)c1cnn(CC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130535	EB	On-Demand	Anodyne	CA5A	49	49
NS(=O)(=O)c1cnn(CC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130535	EB	On-Demand	Anodyne	CA14	30	44
NS(=O)(=O)c1cnn(CC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130535	EB	On-Demand	Anodyne	CA12	33	47
NS(=O)(=O)c1cnn(CC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130535	EB	On-Demand	Anodyne	CA9	38	49
NS(=O)(=O)c1cnn(CC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130535	EB	On-Demand	Anodyne	CYNT	20	46
NS(=O)(=O)c1cnn(CC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130535	EB	On-Demand	Anodyne	NCE103	17	44
NS(=O)(=O)c1cnn(CC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130535	EB	On-Demand	Anodyne	NAMPT	63	38
NS(=O)(=O)c1ccc(F)c(C(=O)NCCC(=O)O)c1	ZINC000819130536	CB	On-Demand	Anodyne	CA2	124	62
NS(=O)(=O)c1ccc(F)c(C(=O)NCCC(=O)O)c1	ZINC000819130536	CB	On-Demand	Anodyne	TBXA2R	44	36
NS(=O)(=O)c1ccc(F)c(C(=O)NCCC(=O)O)c1	ZINC000819130536	CB	On-Demand	Anodyne	CA6	22	40
NS(=O)(=O)c1ccc(F)c(C(=O)NCCC(=O)O)c1	ZINC000819130536	CB	On-Demand	Anodyne	CA1	98	62
NS(=O)(=O)c1ccc(F)c(C(=O)NCCC(=O)O)c1	ZINC000819130536	CB	On-Demand	Anodyne	CA7	68	42
NS(=O)(=O)c1ccc(F)c(C(=O)NCCC(=O)O)c1	ZINC000819130536	CB	On-Demand	Anodyne	CA13	21	40
NS(=O)(=O)c1ccc(F)c(C(=O)NCCC(=O)O)c1	ZINC000819130536	CB	On-Demand	Anodyne	CA5B	65	42
NS(=O)(=O)c1ccc(F)c(C(=O)NCCC(=O)O)c1	ZINC000819130536	CB	On-Demand	Anodyne	CA4	121	62
NS(=O)(=O)c1ccc(F)c(C(=O)NCCC(=O)O)c1	ZINC000819130536	CB	On-Demand	Anodyne	CA5A	69	42
NS(=O)(=O)c1ccc(F)c(C(=O)NCCC(=O)O)c1	ZINC000819130536	CB	On-Demand	Anodyne	CA14	45	42
NS(=O)(=O)c1ccc(F)c(C(=O)NCCC(=O)O)c1	ZINC000819130536	CB	On-Demand	Anodyne	CA12	60	42
NS(=O)(=O)c1ccc(F)c(C(=O)NCCC(=O)O)c1	ZINC000819130536	CB	On-Demand	Anodyne	CA9	60	47
NS(=O)(=O)c1ccc(F)c(C(=O)NCCC(=O)O)c1	ZINC000819130536	CB	On-Demand	Anodyne	CAH_METTE	43	40
NS(=O)(=O)c1ccc(F)c(C(=O)NCCC(=O)O)c1	ZINC000819130536	CB	On-Demand	Anodyne	NCE103	58	40
NS(=O)(=O)c1ccc(F)c(C(=O)NCCC(=O)O)c1	ZINC000819130536	CB	On-Demand	Anodyne	CA15	23	40
NS(=O)(=O)c1ccc(F)c(C(=O)NCCC(=O)O)c1	ZINC000819130536	CB	On-Demand	Anodyne	MTCA1	67	35
NS(=O)(=O)c1ccc(F)c(C(=O)NCCC(=O)O)c1	ZINC000819130536	CB	On-Demand	Anodyne	P96878_MYCTU	59	35
NS(=O)(=O)c1ccc(F)c(C(=O)NCCC(=O)O)c1	ZINC000819130536	CB	On-Demand	Anodyne	A6YCJ1_9METZ	25	42
NS(=O)(=O)c1ccc(N2CCN(C(=O)NCCC(=O)O)CC2)cc1	ZINC000819130538	FB	On-Demand	Anodyne	CA2	93	54
NS(=O)(=O)c1ccc(N2CCN(C(=O)NCCC(=O)O)CC2)cc1	ZINC000819130538	FB	On-Demand	Anodyne	CA1	80	54
NS(=O)(=O)c1ccc(N2CCN(C(=O)NCCC(=O)O)CC2)cc1	ZINC000819130538	FB	On-Demand	Anodyne	CA7	51	39
NS(=O)(=O)c1ccc(N2CCN(C(=O)NCCC(=O)O)CC2)cc1	ZINC000819130538	FB	On-Demand	Anodyne	CA5B	47	37
NS(=O)(=O)c1ccc(N2CCN(C(=O)NCCC(=O)O)CC2)cc1	ZINC000819130538	FB	On-Demand	Anodyne	CA4	72	54
NS(=O)(=O)c1ccc(N2CCN(C(=O)NCCC(=O)O)CC2)cc1	ZINC000819130538	FB	On-Demand	Anodyne	CA5A	49	37
NS(=O)(=O)c1ccc(N2CCN(C(=O)NCCC(=O)O)CC2)cc1	ZINC000819130538	FB	On-Demand	Anodyne	CA14	37	43
NS(=O)(=O)c1ccc(N2CCN(C(=O)NCCC(=O)O)CC2)cc1	ZINC000819130538	FB	On-Demand	Anodyne	CA12	53	43
NS(=O)(=O)c1ccc(N2CCN(C(=O)NCCC(=O)O)CC2)cc1	ZINC000819130538	FB	On-Demand	Anodyne	CA9	53	43
NS(=O)(=O)c1ccc(N2CCN(C(=O)NCCC(=O)O)CC2)cc1	ZINC000819130538	FB	On-Demand	Anodyne	NCE103	20	43
NS(=O)(=O)c1ccc(N2CCN(C(=O)NCCC(=O)O)CC2)cc1	ZINC000819130538	FB	On-Demand	Anodyne	P96878_MYCTU	43	35
NS(=O)(=O)c1cccc(NC(=O)CN(CC(=O)O)c2ccccc2)c1	ZINC000819130540	FC	On-Demand	Anodyne	CA2	107	76
NS(=O)(=O)c1cccc(NC(=O)CN(CC(=O)O)c2ccccc2)c1	ZINC000819130540	FC	On-Demand	Anodyne	CA1	97	70
NS(=O)(=O)c1cccc(NC(=O)CN(CC(=O)O)c2ccccc2)c1	ZINC000819130540	FC	On-Demand	Anodyne	CA7	41	47
NS(=O)(=O)c1cccc(NC(=O)CN(CC(=O)O)c2ccccc2)c1	ZINC000819130540	FC	On-Demand	Anodyne	CA5B	71	47
NS(=O)(=O)c1cccc(NC(=O)CN(CC(=O)O)c2ccccc2)c1	ZINC000819130540	FC	On-Demand	Anodyne	CA4	129	76
NS(=O)(=O)c1cccc(NC(=O)CN(CC(=O)O)c2ccccc2)c1	ZINC000819130540	FC	On-Demand	Anodyne	CA5A	77	47
NS(=O)(=O)c1cccc(NC(=O)CN(CC(=O)O)c2ccccc2)c1	ZINC000819130540	FC	On-Demand	Anodyne	CA14	25	47
NS(=O)(=O)c1cccc(NC(=O)CN(CC(=O)O)c2ccccc2)c1	ZINC000819130540	FC	On-Demand	Anodyne	CA12	48	70
NS(=O)(=O)c1cccc(NC(=O)CN(CC(=O)O)c2ccccc2)c1	ZINC000819130540	FC	On-Demand	Anodyne	CA9	52	70
NS(=O)(=O)c1cccc(NC(=O)CN(CC(=O)O)c2ccccc2)c1	ZINC000819130540	FC	On-Demand	Anodyne	TTK	24	42
NS(=O)(=O)c1cccc(NC(=O)CN(CC(=O)O)c2ccccc2)c1	ZINC000819130540	FC	On-Demand	Anodyne	MTCA1	47	45
NS(=O)(=O)c1cccc(NC(=O)CN(CC(=O)O)c2ccccc2)c1	ZINC000819130540	FC	On-Demand	Anodyne	P96878_MYCTU	60	45
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130543	FC	On-Demand	Anodyne	F2	15	40
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130543	FC	On-Demand	Anodyne	CA2	77	50
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130543	FC	On-Demand	Anodyne	CA1	67	44
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130543	FC	On-Demand	Anodyne	CA7	32	44
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130543	FC	On-Demand	Anodyne	CA5B	33	44
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130543	FC	On-Demand	Anodyne	CA4	62	50
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130543	FC	On-Demand	Anodyne	CA5A	30	44
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130543	FC	On-Demand	Anodyne	CA12	43	42
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130543	FC	On-Demand	Anodyne	PROC	41	33
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130543	FC	On-Demand	Anodyne	CA9	45	44
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130543	FC	On-Demand	Anodyne	NAMPT	42	37
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130543	FC	On-Demand	Anodyne	TMPRSS11D	53	33
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130544	FC	On-Demand	Anodyne	F2	15	40
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130544	FC	On-Demand	Anodyne	CA2	77	50
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130544	FC	On-Demand	Anodyne	CA1	67	44
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130544	FC	On-Demand	Anodyne	CA7	32	44
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130544	FC	On-Demand	Anodyne	CA5B	33	44
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130544	FC	On-Demand	Anodyne	CA4	62	50
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130544	FC	On-Demand	Anodyne	CA5A	30	44
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130544	FC	On-Demand	Anodyne	CA12	43	42
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130544	FC	On-Demand	Anodyne	PROC	41	33
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130544	FC	On-Demand	Anodyne	CA9	45	44
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130544	FC	On-Demand	Anodyne	NAMPT	42	37
NS(=O)(=O)c1ccc(CNC(=S)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130544	FC	On-Demand	Anodyne	TMPRSS11D	53	33
NS(=O)(=O)c1ccc(CCC(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819130545	FD	On-Demand	Anodyne	CA2	118	53
NS(=O)(=O)c1ccc(CCC(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819130545	FD	On-Demand	Anodyne	CA6	21	41
NS(=O)(=O)c1ccc(CCC(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819130545	FD	On-Demand	Anodyne	CA1	100	45
NS(=O)(=O)c1ccc(CCC(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819130545	FD	On-Demand	Anodyne	CA7	62	45
NS(=O)(=O)c1ccc(CCC(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819130545	FD	On-Demand	Anodyne	CA13	22	41
NS(=O)(=O)c1ccc(CCC(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819130545	FD	On-Demand	Anodyne	CA5B	55	45
NS(=O)(=O)c1ccc(CCC(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819130545	FD	On-Demand	Anodyne	CA4	95	45
NS(=O)(=O)c1ccc(CCC(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819130545	FD	On-Demand	Anodyne	CA5A	57	45
NS(=O)(=O)c1ccc(CCC(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819130545	FD	On-Demand	Anodyne	CA14	46	42
NS(=O)(=O)c1ccc(CCC(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819130545	FD	On-Demand	Anodyne	CA12	64	43
NS(=O)(=O)c1ccc(CCC(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819130545	FD	On-Demand	Anodyne	CA9	73	45
NS(=O)(=O)c1ccc(CCC(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819130545	FD	On-Demand	Anodyne	CAH_METTE	23	41
NS(=O)(=O)c1ccc(CCC(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819130545	FD	On-Demand	Anodyne	NCE103	24	53
NS(=O)(=O)c1ccc(CCC(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819130545	FD	On-Demand	Anodyne	CA15	18	41
NS(=O)(=O)c1ccc(CCC(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819130545	FD	On-Demand	Anodyne	P96878_MYCTU	50	39
NS(=O)(=O)c1ccc(CCC(=O)NC2(C(=O)O)CCCCC2)cc1	ZINC000819130545	FD	On-Demand	Anodyne	A6YCJ1_9METZ	25	42
Nc1nc(Cl)cc(N2CCC[C@H](CC(=O)O)C2)n1	ZINC000819130546	CD	On-Demand	Anodyne	HRH4	44	40
Nc1nc(Cl)cc(N2CCC[C@@H](CC(=O)O)C2)n1	ZINC000819130547	CD	On-Demand	Anodyne	HRH4	44	40
NS(=O)(=O)c1cccc(CNC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130548	FC	On-Demand	Anodyne	F2	27	43
NS(=O)(=O)c1cccc(CNC(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130548	FC	On-Demand	Anodyne	TMPRSS11D	45	32
NS(=O)(=O)c1cccc(CNC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130549	FC	On-Demand	Anodyne	F2	27	43
NS(=O)(=O)c1cccc(CNC(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130549	FC	On-Demand	Anodyne	TMPRSS11D	45	32
NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NCCCC(=O)O	ZINC000819130550	FB	On-Demand	Anodyne	CA2	42	47
NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NCCCC(=O)O	ZINC000819130550	FB	On-Demand	Anodyne	CA1	39	47
NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NCCCC(=O)O	ZINC000819130550	FB	On-Demand	Anodyne	CA5B	50	34
NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NCCCC(=O)O	ZINC000819130550	FB	On-Demand	Anodyne	CA4	44	47
NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NCCCC(=O)O	ZINC000819130550	FB	On-Demand	Anodyne	CA5A	52	34
NS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccccc1CC(=O)O	ZINC000819130553	FC	On-Demand	Anodyne	CA2	42	49
NS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccccc1CC(=O)O	ZINC000819130553	FC	On-Demand	Anodyne	CXCL8	36	43
NS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccccc1CC(=O)O	ZINC000819130553	FC	On-Demand	Anodyne	CA1	34	47
NS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccccc1CC(=O)O	ZINC000819130553	FC	On-Demand	Anodyne	CA7	15	45
NS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccccc1CC(=O)O	ZINC000819130553	FC	On-Demand	Anodyne	CA4	46	48
NS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccccc1CC(=O)O	ZINC000819130553	FC	On-Demand	Anodyne	CA5A	43	36
NS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccccc1CC(=O)O	ZINC000819130553	FC	On-Demand	Anodyne	PRTN3	44	33
NS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccccc1CC(=O)O	ZINC000819130553	FC	On-Demand	Anodyne	CA12	24	45
NS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccccc1CC(=O)O	ZINC000819130553	FC	On-Demand	Anodyne	CA9	23	47
NS(=O)(=O)c1ccccc1S(=O)(=O)Nc1ccccc1CC(=O)O	ZINC000819130553	FC	On-Demand	Anodyne	CYNT	18	45
NS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(C(=O)O)cc2)s1	ZINC000819130554	FD	On-Demand	Anodyne	CA2	37	45
NS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(C(=O)O)cc2)s1	ZINC000819130554	FD	On-Demand	Anodyne	CA1	20	45
NS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(C(=O)O)cc2)s1	ZINC000819130554	FD	On-Demand	Anodyne	CA4	19	45
NS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(C(=O)O)cc2)s1	ZINC000819130554	FD	On-Demand	Anodyne	CA14	15	41
NS(=O)(=O)c1ccc(CNC(=O)NCc2ccc(C(=O)O)cc2)s1	ZINC000819130554	FD	On-Demand	Anodyne	CYNT	18	42
NS(=O)(=O)c1cnn(CC(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130557	EB	On-Demand	Anodyne	CA2	52	47
NS(=O)(=O)c1cnn(CC(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130557	EB	On-Demand	Anodyne	CA1	35	45
NS(=O)(=O)c1cnn(CC(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130557	EB	On-Demand	Anodyne	CA7	27	43
NS(=O)(=O)c1cnn(CC(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130557	EB	On-Demand	Anodyne	CA4	42	47
NS(=O)(=O)c1cnn(CC(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130557	EB	On-Demand	Anodyne	CA12	21	43
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130560	FC	On-Demand	Anodyne	CA2	51	46
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130560	FC	On-Demand	Anodyne	SLC6A1	46	35
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130560	FC	On-Demand	Anodyne	CA1	50	46
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130560	FC	On-Demand	Anodyne	CA7	36	44
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130560	FC	On-Demand	Anodyne	CA5B	47	44
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130560	FC	On-Demand	Anodyne	CA4	64	46
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130560	FC	On-Demand	Anodyne	CA5A	53	44
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130560	FC	On-Demand	Anodyne	MAPK1	21	40
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130560	FC	On-Demand	Anodyne	CA12	22	42
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130560	FC	On-Demand	Anodyne	CA9	24	44
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130561	FC	On-Demand	Anodyne	CA2	51	46
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130561	FC	On-Demand	Anodyne	SLC6A1	46	35
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130561	FC	On-Demand	Anodyne	CA1	50	46
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130561	FC	On-Demand	Anodyne	CA7	36	44
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130561	FC	On-Demand	Anodyne	CA5B	47	44
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130561	FC	On-Demand	Anodyne	CA4	64	46
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130561	FC	On-Demand	Anodyne	CA5A	53	44
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130561	FC	On-Demand	Anodyne	MAPK1	21	40
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130561	FC	On-Demand	Anodyne	CA12	22	42
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130561	FC	On-Demand	Anodyne	CA9	24	44
NS(=O)(=O)c1cnn(CCC(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130564	FC	On-Demand	Anodyne	CA2	33	45
NS(=O)(=O)c1cnn(CCC(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130564	FC	On-Demand	Anodyne	CA1	23	44
NS(=O)(=O)c1cnn(CCC(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130564	FC	On-Demand	Anodyne	CA7	17	41
NS(=O)(=O)c1cnn(CCC(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130564	FC	On-Demand	Anodyne	CA4	28	45
NS(=O)(=O)c1cccc(NC(=O)CCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130565	FC	On-Demand	Anodyne	CA2	35	54
NS(=O)(=O)c1cccc(NC(=O)CCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130565	FC	On-Demand	Anodyne	CA1	28	51
NS(=O)(=O)c1cccc(NC(=O)CCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130565	FC	On-Demand	Anodyne	CCR3	42	39
NS(=O)(=O)c1cccc(NC(=O)CCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130565	FC	On-Demand	Anodyne	CA4	44	53
NS(=O)(=O)c1cccc(NC(=O)CCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130565	FC	On-Demand	Anodyne	ST14	44	38
NS(=O)(=O)c1cccc(NC(=O)CCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130565	FC	On-Demand	Anodyne	CA9	15	51
NS(=O)(=O)c1cccc(NC(=O)CCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130566	FC	On-Demand	Anodyne	CA2	35	54
NS(=O)(=O)c1cccc(NC(=O)CCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130566	FC	On-Demand	Anodyne	CA1	28	51
NS(=O)(=O)c1cccc(NC(=O)CCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130566	FC	On-Demand	Anodyne	CCR3	42	39
NS(=O)(=O)c1cccc(NC(=O)CCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130566	FC	On-Demand	Anodyne	CA4	44	53
NS(=O)(=O)c1cccc(NC(=O)CCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130566	FC	On-Demand	Anodyne	ST14	44	38
NS(=O)(=O)c1cccc(NC(=O)CCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130566	FC	On-Demand	Anodyne	CA9	15	51
NS(=O)(=O)c1ccc(OCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130569	DC	On-Demand	Anodyne	CA2	45	57
NS(=O)(=O)c1ccc(OCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130569	DC	On-Demand	Anodyne	ESR1	56	37
NS(=O)(=O)c1ccc(OCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130569	DC	On-Demand	Anodyne	SLC6A1	159	43
NS(=O)(=O)c1ccc(OCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130569	DC	On-Demand	Anodyne	LTA4H	68	57
NS(=O)(=O)c1ccc(OCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130569	DC	On-Demand	Anodyne	CA1	37	57
NS(=O)(=O)c1ccc(OCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130569	DC	On-Demand	Anodyne	CA7	40	57
NS(=O)(=O)c1ccc(OCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130569	DC	On-Demand	Anodyne	HRH3	44	58
NS(=O)(=O)c1ccc(OCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130569	DC	On-Demand	Anodyne	CA4	32	43
NS(=O)(=O)c1ccc(OCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130569	DC	On-Demand	Anodyne	CA12	32	57
NS(=O)(=O)c1ccc(OCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130569	DC	On-Demand	Anodyne	CA9	32	57
NS(=O)(=O)c1ccc(OCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130569	DC	On-Demand	Anodyne	PSMB2	41	38
NS(=O)(=O)c1ccc(OCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130569	DC	On-Demand	Anodyne	PSMB1	45	39
NS(=O)(=O)c1ccc(OCCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130569	DC	On-Demand	Anodyne	MEN1	31	46
NS(=O)(=O)c1ccc(OCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130570	DC	On-Demand	Anodyne	CA2	45	57
NS(=O)(=O)c1ccc(OCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130570	DC	On-Demand	Anodyne	ESR1	56	37
NS(=O)(=O)c1ccc(OCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130570	DC	On-Demand	Anodyne	SLC6A1	159	43
NS(=O)(=O)c1ccc(OCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130570	DC	On-Demand	Anodyne	LTA4H	68	57
NS(=O)(=O)c1ccc(OCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130570	DC	On-Demand	Anodyne	CA1	37	57
NS(=O)(=O)c1ccc(OCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130570	DC	On-Demand	Anodyne	CA7	40	57
NS(=O)(=O)c1ccc(OCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130570	DC	On-Demand	Anodyne	HRH3	44	58
NS(=O)(=O)c1ccc(OCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130570	DC	On-Demand	Anodyne	CA4	32	43
NS(=O)(=O)c1ccc(OCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130570	DC	On-Demand	Anodyne	CA12	32	57
NS(=O)(=O)c1ccc(OCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130570	DC	On-Demand	Anodyne	CA9	32	57
NS(=O)(=O)c1ccc(OCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130570	DC	On-Demand	Anodyne	PSMB2	41	38
NS(=O)(=O)c1ccc(OCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130570	DC	On-Demand	Anodyne	PSMB1	45	39
NS(=O)(=O)c1ccc(OCCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130570	DC	On-Demand	Anodyne	MEN1	31	46
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	CA2	179	55
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	CXCL8	36	43
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	CA6	34	46
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	CA1	153	55
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	CA7	78	49
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	CA13	32	44
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	CA5B	79	49
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	CA4	158	55
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	CA5A	86	49
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	CA14	54	49
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	PRTN3	62	40
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	CA12	98	55
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	ALPL	18	44
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	CA9	114	55
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	CYNT	61	48
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	NCE103	44	46
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	LIMK2	34	42
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	CA15	20	46
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	MTCA1	60	46
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	P96878_MYCTU	68	47
NS(=O)(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130573	FC	On-Demand	Anodyne	MTCA2	20	46
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130575	GD	On-Demand	Anodyne	CA2	42	48
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130575	GD	On-Demand	Anodyne	CA1	43	48
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130575	GD	On-Demand	Anodyne	CA7	32	41
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130575	GD	On-Demand	Anodyne	CA5B	34	41
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130575	GD	On-Demand	Anodyne	CA4	56	48
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130575	GD	On-Demand	Anodyne	CA5A	38	41
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130575	GD	On-Demand	Anodyne	CA9	18	41
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130576	GD	On-Demand	Anodyne	CA2	42	48
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130576	GD	On-Demand	Anodyne	CA1	43	48
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130576	GD	On-Demand	Anodyne	CA7	32	41
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130576	GD	On-Demand	Anodyne	CA5B	34	41
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130576	GD	On-Demand	Anodyne	CA4	56	48
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130576	GD	On-Demand	Anodyne	CA5A	38	41
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130576	GD	On-Demand	Anodyne	CA9	18	41
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819130577	EB	On-Demand	Anodyne	CA2	38	43
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819130577	EB	On-Demand	Anodyne	CA1	30	41
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819130577	EB	On-Demand	Anodyne	CA7	33	40
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819130577	EB	On-Demand	Anodyne	CA5B	34	40
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819130577	EB	On-Demand	Anodyne	CA4	32	41
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819130577	EB	On-Demand	Anodyne	CA5A	35	40
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819130577	EB	On-Demand	Anodyne	EPHX2	23	44
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819130577	EB	On-Demand	Anodyne	ST14	67	35
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819130577	EB	On-Demand	Anodyne	CA9	19	40
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819130577	EB	On-Demand	Anodyne	SFRP1	49	34
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819130577	EB	On-Demand	Anodyne	NAMPT	64	44
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819130578	EB	On-Demand	Anodyne	CA2	38	43
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819130578	EB	On-Demand	Anodyne	CA1	30	41
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819130578	EB	On-Demand	Anodyne	CA7	33	40
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819130578	EB	On-Demand	Anodyne	CA5B	34	40
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819130578	EB	On-Demand	Anodyne	CA4	32	41
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819130578	EB	On-Demand	Anodyne	CA5A	35	40
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819130578	EB	On-Demand	Anodyne	EPHX2	23	44
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819130578	EB	On-Demand	Anodyne	ST14	67	35
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819130578	EB	On-Demand	Anodyne	CA9	19	40
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819130578	EB	On-Demand	Anodyne	SFRP1	49	34
NS(=O)(=O)c1cccc(CNC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819130578	EB	On-Demand	Anodyne	NAMPT	64	44
NS(=O)(=O)c1cnc(NCCC(=O)O)s1	ZINC000819130581	CB	On-Demand	Anodyne	CA2	15	42
NS(=O)(=O)c1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130584	GC	On-Demand	Anodyne	CA2	151	60
NS(=O)(=O)c1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130584	GC	On-Demand	Anodyne	CA6	25	41
NS(=O)(=O)c1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130584	GC	On-Demand	Anodyne	CA1	128	60
NS(=O)(=O)c1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130584	GC	On-Demand	Anodyne	CA7	68	60
NS(=O)(=O)c1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130584	GC	On-Demand	Anodyne	CA13	29	41
NS(=O)(=O)c1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130584	GC	On-Demand	Anodyne	CA5B	82	60
NS(=O)(=O)c1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130584	GC	On-Demand	Anodyne	CA4	126	57
NS(=O)(=O)c1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130584	GC	On-Demand	Anodyne	CA5A	88	60
NS(=O)(=O)c1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130584	GC	On-Demand	Anodyne	CA14	48	49
NS(=O)(=O)c1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130584	GC	On-Demand	Anodyne	CA12	83	56
NS(=O)(=O)c1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130584	GC	On-Demand	Anodyne	CA9	95	60
NS(=O)(=O)c1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130584	GC	On-Demand	Anodyne	CYNT	38	44
NS(=O)(=O)c1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130584	GC	On-Demand	Anodyne	NCE103	34	43
NS(=O)(=O)c1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130584	GC	On-Demand	Anodyne	MTCA1	52	54
NS(=O)(=O)c1ccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819130584	GC	On-Demand	Anodyne	P96878_MYCTU	67	54
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCO[C@@H](C(=O)O)C2)c1	ZINC000819130585	GB	On-Demand	Anodyne	CA2	39	47
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCO[C@@H](C(=O)O)C2)c1	ZINC000819130585	GB	On-Demand	Anodyne	CA1	41	47
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCO[C@@H](C(=O)O)C2)c1	ZINC000819130585	GB	On-Demand	Anodyne	CA7	26	42
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCO[C@@H](C(=O)O)C2)c1	ZINC000819130585	GB	On-Demand	Anodyne	CA5B	39	42
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCO[C@@H](C(=O)O)C2)c1	ZINC000819130585	GB	On-Demand	Anodyne	CA4	47	44
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCO[C@@H](C(=O)O)C2)c1	ZINC000819130585	GB	On-Demand	Anodyne	CA5A	44	42
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCO[C@@H](C(=O)O)C2)c1	ZINC000819130585	GB	On-Demand	Anodyne	CA12	18	40
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCO[C@@H](C(=O)O)C2)c1	ZINC000819130585	GB	On-Demand	Anodyne	CA9	20	47
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCO[C@H](C(=O)O)C2)c1	ZINC000819130586	GB	On-Demand	Anodyne	CA2	39	47
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCO[C@H](C(=O)O)C2)c1	ZINC000819130586	GB	On-Demand	Anodyne	CA1	41	47
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCO[C@H](C(=O)O)C2)c1	ZINC000819130586	GB	On-Demand	Anodyne	CA7	26	42
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCO[C@H](C(=O)O)C2)c1	ZINC000819130586	GB	On-Demand	Anodyne	CA5B	39	42
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCO[C@H](C(=O)O)C2)c1	ZINC000819130586	GB	On-Demand	Anodyne	CA4	47	44
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCO[C@H](C(=O)O)C2)c1	ZINC000819130586	GB	On-Demand	Anodyne	CA5A	44	42
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCO[C@H](C(=O)O)C2)c1	ZINC000819130586	GB	On-Demand	Anodyne	CA12	18	40
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCO[C@H](C(=O)O)C2)c1	ZINC000819130586	GB	On-Demand	Anodyne	CA9	20	47
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC(C(=O)O)CC2)c1	ZINC000819130587	GC	On-Demand	Anodyne	CA2	59	47
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC(C(=O)O)CC2)c1	ZINC000819130587	GC	On-Demand	Anodyne	CA1	58	47
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC(C(=O)O)CC2)c1	ZINC000819130587	GC	On-Demand	Anodyne	CA7	41	46
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC(C(=O)O)CC2)c1	ZINC000819130587	GC	On-Demand	Anodyne	CA5B	48	46
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC(C(=O)O)CC2)c1	ZINC000819130587	GC	On-Demand	Anodyne	CA4	72	47
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC(C(=O)O)CC2)c1	ZINC000819130587	GC	On-Demand	Anodyne	CA5A	55	46
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC(C(=O)O)CC2)c1	ZINC000819130587	GC	On-Demand	Anodyne	CA12	28	43
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC(C(=O)O)CC2)c1	ZINC000819130587	GC	On-Demand	Anodyne	CA9	29	46
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130590	FE	On-Demand	Anodyne	CA2	114	51
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130590	FE	On-Demand	Anodyne	CA6	35	50
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130590	FE	On-Demand	Anodyne	CA1	92	51
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130590	FE	On-Demand	Anodyne	CA7	67	50
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130590	FE	On-Demand	Anodyne	CA13	55	38
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130590	FE	On-Demand	Anodyne	CA5B	45	43
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130590	FE	On-Demand	Anodyne	CA4	95	51
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130590	FE	On-Demand	Anodyne	CA5A	48	43
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130590	FE	On-Demand	Anodyne	CA14	39	41
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130590	FE	On-Demand	Anodyne	CA12	53	51
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130590	FE	On-Demand	Anodyne	CA9	57	51
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130590	FE	On-Demand	Anodyne	CAH_METTE	43	38
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCc2ccc(C(=O)O)cc2)c1	ZINC000819130590	FE	On-Demand	Anodyne	NCE103	32	50
Nc1ccc(F)c(NC(=O)CCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130593	CD	On-Demand	Anodyne	SLC6A1	151	42
Nc1ccc(F)c(NC(=O)CCN2CC[C@H](C(=O)O)C2)c1	ZINC000819130594	CD	On-Demand	Anodyne	SLC6A1	151	42
NS(=O)(=O)c1cccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)c1	ZINC000819130596	EC	On-Demand	Anodyne	CA2	45	54
NS(=O)(=O)c1cccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)c1	ZINC000819130596	EC	On-Demand	Anodyne	SLC6A1	147	37
NS(=O)(=O)c1cccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)c1	ZINC000819130596	EC	On-Demand	Anodyne	CA1	39	54
NS(=O)(=O)c1cccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)c1	ZINC000819130596	EC	On-Demand	Anodyne	CA5B	47	36
NS(=O)(=O)c1cccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)c1	ZINC000819130596	EC	On-Demand	Anodyne	CA4	51	52
NS(=O)(=O)c1cccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)c1	ZINC000819130596	EC	On-Demand	Anodyne	CA5A	54	36
NS(=O)(=O)c1cccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)c1	ZINC000819130596	EC	On-Demand	Anodyne	CA12	20	47
NS(=O)(=O)c1cccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)c1	ZINC000819130596	EC	On-Demand	Anodyne	ST14	47	41
NS(=O)(=O)c1cccc(NC(=O)CCN2CC[C@H](C(=O)O)C2)c1	ZINC000819130596	EC	On-Demand	Anodyne	CA9	22	54
NS(=O)(=O)c1cccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130597	EC	On-Demand	Anodyne	CA2	45	54
NS(=O)(=O)c1cccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130597	EC	On-Demand	Anodyne	SLC6A1	147	37
NS(=O)(=O)c1cccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130597	EC	On-Demand	Anodyne	CA1	39	54
NS(=O)(=O)c1cccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130597	EC	On-Demand	Anodyne	CA5B	47	36
NS(=O)(=O)c1cccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130597	EC	On-Demand	Anodyne	CA4	51	52
NS(=O)(=O)c1cccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130597	EC	On-Demand	Anodyne	CA5A	54	36
NS(=O)(=O)c1cccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130597	EC	On-Demand	Anodyne	CA12	20	47
NS(=O)(=O)c1cccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130597	EC	On-Demand	Anodyne	ST14	47	41
NS(=O)(=O)c1cccc(NC(=O)CCN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130597	EC	On-Demand	Anodyne	CA9	22	54
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130598	FB	On-Demand	Anodyne	CA2	72	50
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130598	FB	On-Demand	Anodyne	CA1	65	50
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130598	FB	On-Demand	Anodyne	CA7	33	40
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130598	FB	On-Demand	Anodyne	CA5B	29	40
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130598	FB	On-Demand	Anodyne	CA4	68	50
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130598	FB	On-Demand	Anodyne	CA5A	33	40
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130598	FB	On-Demand	Anodyne	CA12	45	38
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130598	FB	On-Demand	Anodyne	CA9	44	45
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130598	FB	On-Demand	Anodyne	F13A1	47	34
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130598	FB	On-Demand	Anodyne	MTCA1	46	44
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130598	FB	On-Demand	Anodyne	P96878_MYCTU	58	44
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130599	FB	On-Demand	Anodyne	CA2	72	50
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130599	FB	On-Demand	Anodyne	CA1	65	50
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130599	FB	On-Demand	Anodyne	CA7	33	40
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130599	FB	On-Demand	Anodyne	CA5B	29	40
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130599	FB	On-Demand	Anodyne	CA4	68	50
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130599	FB	On-Demand	Anodyne	CA5A	33	40
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130599	FB	On-Demand	Anodyne	CA12	45	38
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130599	FB	On-Demand	Anodyne	CA9	44	45
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130599	FB	On-Demand	Anodyne	F13A1	47	34
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130599	FB	On-Demand	Anodyne	MTCA1	46	44
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130599	FB	On-Demand	Anodyne	P96878_MYCTU	58	44
NS(=O)(=O)c1cccc(CNC(=O)NCCC(=O)O)c1	ZINC000819130600	DB	On-Demand	Anodyne	CA2	93	56
NS(=O)(=O)c1cccc(CNC(=O)NCCC(=O)O)c1	ZINC000819130600	DB	On-Demand	Anodyne	CA1	80	56
NS(=O)(=O)c1cccc(CNC(=O)NCCC(=O)O)c1	ZINC000819130600	DB	On-Demand	Anodyne	CA7	49	52
NS(=O)(=O)c1cccc(CNC(=O)NCCC(=O)O)c1	ZINC000819130600	DB	On-Demand	Anodyne	CA5B	66	46
NS(=O)(=O)c1cccc(CNC(=O)NCCC(=O)O)c1	ZINC000819130600	DB	On-Demand	Anodyne	CA4	86	56
NS(=O)(=O)c1cccc(CNC(=O)NCCC(=O)O)c1	ZINC000819130600	DB	On-Demand	Anodyne	CA5A	70	46
NS(=O)(=O)c1cccc(CNC(=O)NCCC(=O)O)c1	ZINC000819130600	DB	On-Demand	Anodyne	CA14	31	56
NS(=O)(=O)c1cccc(CNC(=O)NCCC(=O)O)c1	ZINC000819130600	DB	On-Demand	Anodyne	FBP1	31	42
NS(=O)(=O)c1cccc(CNC(=O)NCCC(=O)O)c1	ZINC000819130600	DB	On-Demand	Anodyne	CA12	46	56
NS(=O)(=O)c1cccc(CNC(=O)NCCC(=O)O)c1	ZINC000819130600	DB	On-Demand	Anodyne	CA9	48	56
NS(=O)(=O)c1cccc(CNC(=O)NCCC(=O)O)c1	ZINC000819130600	DB	On-Demand	Anodyne	TTK	17	41
NS(=O)(=O)c1cccc(CNC(=O)NCCC(=O)O)c1	ZINC000819130600	DB	On-Demand	Anodyne	NCE103	40	45
NS(=O)(=O)c1cccc(CNC(=O)NCCC(=O)O)c1	ZINC000819130600	DB	On-Demand	Anodyne	MTCA1	30	50
NS(=O)(=O)c1cccc(CNC(=O)NCCC(=O)O)c1	ZINC000819130600	DB	On-Demand	Anodyne	P96878_MYCTU	40	50
NS(=O)(=O)c1cccc(CNC(=O)NCCC(=O)O)c1	ZINC000819130600	DB	On-Demand	Anodyne	NAMPT	31	46
NS(=O)(=O)c1cnn(CC(=O)NCCCC(=O)O)c1	ZINC000819130601	CA	On-Demand	Anodyne	CA2	38	51
NS(=O)(=O)c1cnn(CC(=O)NCCCC(=O)O)c1	ZINC000819130601	CA	On-Demand	Anodyne	CA1	33	51
NS(=O)(=O)c1cnn(CC(=O)NCCCC(=O)O)c1	ZINC000819130601	CA	On-Demand	Anodyne	CA4	46	51
Nc1cccc2c1C(=O)N(CN1CC[C@@H](C(=O)O)C1)C2=O	ZINC000819130602	CC	On-Demand	Anodyne	SLC6A1	123	36
Nc1cccc2c1C(=O)N(CN1CC[C@H](C(=O)O)C1)C2=O	ZINC000819130603	CC	On-Demand	Anodyne	SLC6A1	123	36
NS(=O)(=O)c1ccc(F)c(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130604	GD	On-Demand	Anodyne	CA2	101	51
NS(=O)(=O)c1ccc(F)c(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130604	GD	On-Demand	Anodyne	CXCL8	29	43
NS(=O)(=O)c1ccc(F)c(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130604	GD	On-Demand	Anodyne	CA1	82	51
NS(=O)(=O)c1ccc(F)c(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130604	GD	On-Demand	Anodyne	CA7	52	51
NS(=O)(=O)c1ccc(F)c(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130604	GD	On-Demand	Anodyne	CA5B	75	51
NS(=O)(=O)c1ccc(F)c(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130604	GD	On-Demand	Anodyne	CA4	105	48
NS(=O)(=O)c1ccc(F)c(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130604	GD	On-Demand	Anodyne	CA5A	81	51
NS(=O)(=O)c1ccc(F)c(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130604	GD	On-Demand	Anodyne	CA14	34	40
NS(=O)(=O)c1ccc(F)c(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130604	GD	On-Demand	Anodyne	CA12	54	51
NS(=O)(=O)c1ccc(F)c(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130604	GD	On-Demand	Anodyne	CA9	56	51
NS(=O)(=O)c1ccc(F)c(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130604	GD	On-Demand	Anodyne	NCE103	33	41
NS(=O)(=O)c1ccc(F)c(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130604	GD	On-Demand	Anodyne	MTCA1	48	48
NS(=O)(=O)c1ccc(F)c(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130604	GD	On-Demand	Anodyne	P96878_MYCTU	61	48
NS(=O)(=O)c1ccc(F)c(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130604	GD	On-Demand	Anodyne	NAMPT	18	44
NS(=O)(=O)c1ccccc1OCc1ccc(C(=O)O)cc1	ZINC000819130611	DD	On-Demand	Anodyne	CA2	48	44
NS(=O)(=O)c1ccccc1OCc1ccc(C(=O)O)cc1	ZINC000819130611	DD	On-Demand	Anodyne	SRD5A2	15	49
NS(=O)(=O)c1ccccc1OCc1ccc(C(=O)O)cc1	ZINC000819130611	DD	On-Demand	Anodyne	PPIA	39	45
NS(=O)(=O)c1ccccc1OCc1ccc(C(=O)O)cc1	ZINC000819130611	DD	On-Demand	Anodyne	PTGER1	59	54
NS(=O)(=O)c1ccccc1OCc1ccc(C(=O)O)cc1	ZINC000819130611	DD	On-Demand	Anodyne	CA1	33	44
NS(=O)(=O)c1ccccc1OCc1ccc(C(=O)O)cc1	ZINC000819130611	DD	On-Demand	Anodyne	CA7	30	44
NS(=O)(=O)c1ccccc1OCc1ccc(C(=O)O)cc1	ZINC000819130611	DD	On-Demand	Anodyne	CA4	33	44
NS(=O)(=O)c1ccccc1OCc1ccc(C(=O)O)cc1	ZINC000819130611	DD	On-Demand	Anodyne	ACR	34	40
NS(=O)(=O)c1ccccc1OCc1ccc(C(=O)O)cc1	ZINC000819130611	DD	On-Demand	Anodyne	CA12	23	44
NS(=O)(=O)c1ccccc1OCc1ccc(C(=O)O)cc1	ZINC000819130611	DD	On-Demand	Anodyne	CA9	24	44
NS(=O)(=O)c1ccccc1OCc1ccc(C(=O)O)cc1	ZINC000819130611	DD	On-Demand	Anodyne	CYNT	24	42
NS(=O)(=O)c1ccccc1OCc1ccc(C(=O)O)cc1	ZINC000819130611	DD	On-Demand	Anodyne	KLK_PIG	45	38
O=C(/C=C/[C@@H]1CCCO1)Nc1ncc(Cc2ccccc2F)s1	ZINC000819130614	EH	On-Demand	Anodyne	CDK5	44	38
O=C(/C=C\[C@H]1CCCO1)Nc1ncc(Cc2ccccc2F)s1	ZINC000819130617	EH	On-Demand	Anodyne	CDK5	44	38
O=C(/C=C/[C@H]1CCCO1)Nc1ncc(Cc2ccccc2F)s1	ZINC000819130619	EH	On-Demand	Anodyne	CDK5	44	38
O=C(/C=C\[C@@H]1CCCO1)Nc1ncc(Cc2ccccc2F)s1	ZINC000819130621	EH	On-Demand	Anodyne	CDK5	44	38
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000819130631	EE	On-Demand	Anodyne	ACHE	43	40
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000819130631	EE	On-Demand	Anodyne	SLC6A3	18	42
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000819130631	EE	On-Demand	Anodyne	SIGMAR1	49	59
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000819130632	EE	On-Demand	Anodyne	ACHE	43	40
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000819130632	EE	On-Demand	Anodyne	SLC6A3	18	42
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000819130632	EE	On-Demand	Anodyne	SIGMAR1	49	59
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130639	FB	On-Demand	Anodyne	CA2	98	56
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130639	FB	On-Demand	Anodyne	CA1	84	54
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130639	FB	On-Demand	Anodyne	CA7	51	54
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130639	FB	On-Demand	Anodyne	CA5B	51	54
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130639	FB	On-Demand	Anodyne	CA4	69	55
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130639	FB	On-Demand	Anodyne	CA5A	52	54
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130639	FB	On-Demand	Anodyne	CA14	44	45
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130639	FB	On-Demand	Anodyne	MMP2	17	40
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130639	FB	On-Demand	Anodyne	CA12	56	50
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130639	FB	On-Demand	Anodyne	CA9	63	56
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130639	FB	On-Demand	Anodyne	CYNT	20	43
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130639	FB	On-Demand	Anodyne	NCE103	24	47
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130639	FB	On-Demand	Anodyne	P96878_MYCTU	20	47
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130639	FB	On-Demand	Anodyne	A6YCJ1_9METZ	24	48
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819130655	GF	On-Demand	Anodyne	SLC6A3	21	44
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819130655	GF	On-Demand	Anodyne	SIGMAR1	33	49
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819130656	GF	On-Demand	Anodyne	SLC6A3	21	44
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cn1	ZINC000819130656	GF	On-Demand	Anodyne	SIGMAR1	33	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cnn(CC(=O)NC3CC3)c1)C2	ZINC000819130688	GC	On-Demand	Anodyne	PANC	45	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cnn(CC(=O)NC3CC3)c1)C2	ZINC000819130691	GC	On-Demand	Anodyne	PANC	45	31
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(OCCCC#N)c1	ZINC000819130693	FG	On-Demand	Mild	EPHX2	19	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H]1Cc2ccccc21	ZINC000819130695	DE	On-Demand	Anodyne	MTNR1A	15	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H]1Cc2ccccc21	ZINC000819130695	DE	On-Demand	Anodyne	MTNR1B	19	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H]1Cc2ccccc21	ZINC000819130696	DE	On-Demand	Anodyne	MTNR1A	15	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H]1Cc2ccccc21	ZINC000819130696	DE	On-Demand	Anodyne	MTNR1B	19	44
N#CCCCOc1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819130715	DG	On-Demand	Mild	EPHX2	17	42
N#CCCCOc1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819130717	DG	On-Demand	Mild	EPHX2	17	42
N#CCCCOc1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819130718	DG	On-Demand	Mild	EPHX2	17	42
N#CCCCOc1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819130720	DG	On-Demand	Mild	EPHX2	17	42
O=C(/C=C\[C@@H]1CCCO1)NC[C@H]1Cc2ccccc21	ZINC000819130735	CE	On-Demand	Anodyne	MTNR1B	16	41
O=C(/C=C/[C@@H]1CCCO1)NC[C@H]1Cc2ccccc21	ZINC000819130736	CE	On-Demand	Anodyne	MTNR1B	16	41
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H]1Cc2ccccc21	ZINC000819130737	CE	On-Demand	Anodyne	MTNR1B	16	41
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H]1Cc2ccccc21	ZINC000819130739	CE	On-Demand	Anodyne	MTNR1B	16	41
C=C(C)C(C)(C)C(=O)NCc1ccc(Cl)nc1	ZINC000819130771	CF	On-Demand	Mild	NACHRBETA2	29	46
CS(=O)(=O)CC1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819130773	ED	On-Demand	Bother	ADRB3	42	34
CS(=O)(=O)CC1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819130775	ED	On-Demand	Bother	ADRB3	42	34
N#Cc1ccc([C@@H](O)CNCCCOC2CCN(Cc3ccccc3)CC2)cc1	ZINC000819130794	GG	On-Demand	Mild	ADRB2	42	40
N#Cc1ccc([C@@H](O)CNCCCOC2CCN(Cc3ccccc3)CC2)cc1	ZINC000819130794	GG	On-Demand	Mild	ACHE	26	42
N#Cc1ccc([C@@H](O)CNCCCOC2CCN(Cc3ccccc3)CC2)cc1	ZINC000819130794	GG	On-Demand	Mild	SLC6A3	21	47
N#Cc1ccc([C@@H](O)CNCCCOC2CCN(Cc3ccccc3)CC2)cc1	ZINC000819130794	GG	On-Demand	Mild	SIGMAR1	32	51
N#Cc1ccc([C@H](O)CNCCCOC2CCN(Cc3ccccc3)CC2)cc1	ZINC000819130795	GG	On-Demand	Mild	ADRB2	42	40
N#Cc1ccc([C@H](O)CNCCCOC2CCN(Cc3ccccc3)CC2)cc1	ZINC000819130795	GG	On-Demand	Mild	ACHE	26	42
N#Cc1ccc([C@H](O)CNCCCOC2CCN(Cc3ccccc3)CC2)cc1	ZINC000819130795	GG	On-Demand	Mild	SLC6A3	21	47
N#Cc1ccc([C@H](O)CNCCCOC2CCN(Cc3ccccc3)CC2)cc1	ZINC000819130795	GG	On-Demand	Mild	SIGMAR1	32	51
COc1ccc(OC)c([C@H](O)CNCCC2CCN(CC(F)(F)F)CC2)c1	ZINC000819130813	GF	On-Demand	Anodyne	HPGDS	31	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CC(=O)N(C3CC3)C2)CC1	ZINC000819130816	FD	On-Demand	Anodyne	GPR119	30	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CC(=O)N(C3CC3)C2)CC1	ZINC000819130817	FD	On-Demand	Anodyne	GPR119	30	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CC(=O)N(C3CC3)C2)CC1	ZINC000819130818	FD	On-Demand	Anodyne	GPR119	30	43
C[C@H](O)c1ccc(CNC[C@H](O)CCc2ccccc2)cc1	ZINC000819130821	CF	On-Demand	Anodyne	ADRB2	30	43
C[C@H](O)c1ccc(CNC[C@H](O)CCc2ccccc2)cc1	ZINC000819130821	CF	On-Demand	Anodyne	ADRB1	22	40
C[C@H](O)c1ccc(CNC[C@@H](O)CCc2ccccc2)cc1	ZINC000819130822	CF	On-Demand	Anodyne	ADRB2	30	43
C[C@H](O)c1ccc(CNC[C@@H](O)CCc2ccccc2)cc1	ZINC000819130822	CF	On-Demand	Anodyne	ADRB1	22	40
C[C@H](O)c1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819130824	DE	On-Demand	Bother	CACNA1C	43	35
C[C@H](O)c1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819130824	DE	On-Demand	Bother	ADRB3	48	35
C[C@H](O)c1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819130824	DE	On-Demand	Bother	CACNA1D	72	35
C[C@H](O)c1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819130826	DE	On-Demand	Bother	CACNA1C	43	35
C[C@H](O)c1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819130826	DE	On-Demand	Bother	ADRB3	48	35
C[C@H](O)c1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819130826	DE	On-Demand	Bother	CACNA1D	72	35
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819130838	FE	On-Demand	Anodyne	ADRB2	63	52
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819130838	FE	On-Demand	Anodyne	ADRB1	89	52
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819130838	FE	On-Demand	Anodyne	GRIN1	17	42
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819130838	FE	On-Demand	Anodyne	ADRB3	63	52
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819130838	FE	On-Demand	Anodyne	ABCB1	15	47
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819130839	FE	On-Demand	Anodyne	ADRB2	63	52
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819130839	FE	On-Demand	Anodyne	ADRB1	89	52
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819130839	FE	On-Demand	Anodyne	GRIN1	17	42
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819130839	FE	On-Demand	Anodyne	ADRB3	63	52
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819130839	FE	On-Demand	Anodyne	ABCB1	15	47
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819130840	FE	On-Demand	Anodyne	ADRB2	63	52
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819130840	FE	On-Demand	Anodyne	ADRB1	89	52
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819130840	FE	On-Demand	Anodyne	GRIN1	17	42
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819130840	FE	On-Demand	Anodyne	ADRB3	63	52
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819130840	FE	On-Demand	Anodyne	ABCB1	15	47
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819130841	FE	On-Demand	Anodyne	ADRB2	63	52
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819130841	FE	On-Demand	Anodyne	ADRB1	89	52
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819130841	FE	On-Demand	Anodyne	GRIN1	17	42
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819130841	FE	On-Demand	Anodyne	ADRB3	63	52
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819130841	FE	On-Demand	Anodyne	ABCB1	15	47
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819130854	FH	On-Demand	Anodyne	ADRB2	28	41
C[C@H](O)c1ccc(CNC[C@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819130855	FH	On-Demand	Anodyne	ADRB2	28	41
Cc1ccc(C(=O)N2CCN(C(=O)C(F)=C3CCC3)CC2)cc1F	ZINC000819130858	EF	On-Demand	Anodyne	L3MBTL3	42	34
C[C@H](O)c1ccc(CNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819130859	DF	On-Demand	Anodyne	LEF	40	32
C[C@H](O)c1ccc(CNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819130861	DF	On-Demand	Anodyne	LEF	40	32
Cc1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)c(C)c1	ZINC000819130867	EF	On-Demand	Anodyne	ADRB2	29	50
Cc1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)c(C)c1	ZINC000819130868	EF	On-Demand	Anodyne	ADRB2	29	50
Cc1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)c(C)c1	ZINC000819130869	EF	On-Demand	Anodyne	ADRB2	29	50
Cc1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)c(C)c1	ZINC000819130870	EF	On-Demand	Anodyne	ADRB2	29	50
N#C[C@@H]1CCC[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819130885	BD	On-Demand	Mild	ADRB3	67	42
N#C[C@@H]1CCC[C@@H]1NC[C@H](O)c1cccnc1	ZINC000819130886	BD	On-Demand	Mild	ADRB3	67	42
N#C[C@@H]1CCC[C@H]1NC[C@H](O)c1cccnc1	ZINC000819130887	BD	On-Demand	Mild	ADRB3	67	42
N#C[C@@H]1CCC[C@@H]1NC[C@@H](O)c1cccnc1	ZINC000819130888	BD	On-Demand	Mild	ADRB3	67	42
C[C@H](O)c1ccc(CNC[C@@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819130891	FH	On-Demand	Anodyne	ADRB2	36	44
C[C@H](O)c1ccc(CNC[C@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819130892	FH	On-Demand	Anodyne	ADRB2	36	44
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc(Br)c2)cc1	ZINC000819130895	GG	On-Demand	Anodyne	ADRB2	45	49
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc(Br)c2)cc1	ZINC000819130895	GG	On-Demand	Anodyne	ADRB1	56	45
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc(Br)c2)cc1	ZINC000819130895	GG	On-Demand	Anodyne	ADRB3	38	41
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc(Br)c2)cc1	ZINC000819130895	GG	On-Demand	Anodyne	PDS	69	46
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc(Br)c2)cc1	ZINC000819130896	GG	On-Demand	Anodyne	ADRB2	45	49
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc(Br)c2)cc1	ZINC000819130896	GG	On-Demand	Anodyne	ADRB1	56	45
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc(Br)c2)cc1	ZINC000819130896	GG	On-Demand	Anodyne	ADRB3	38	41
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc(Br)c2)cc1	ZINC000819130896	GG	On-Demand	Anodyne	PDS	69	46
CSc1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819130903	EF	On-Demand	Anodyne	ADRB2	46	49
CSc1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819130903	EF	On-Demand	Anodyne	ADRB1	64	49
CSc1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819130903	EF	On-Demand	Anodyne	ADRB3	42	45
CSc1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819130904	EF	On-Demand	Anodyne	ADRB2	46	49
CSc1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819130904	EF	On-Demand	Anodyne	ADRB1	64	49
CSc1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819130904	EF	On-Demand	Anodyne	ADRB3	42	45
CSc1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819130905	EF	On-Demand	Anodyne	ADRB2	46	49
CSc1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819130905	EF	On-Demand	Anodyne	ADRB1	64	49
CSc1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819130905	EF	On-Demand	Anodyne	ADRB3	42	45
CSc1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819130906	EF	On-Demand	Anodyne	ADRB2	46	49
CSc1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819130906	EF	On-Demand	Anodyne	ADRB1	64	49
CSc1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819130906	EF	On-Demand	Anodyne	ADRB3	42	45
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130914	FB	On-Demand	Anodyne	CA2	98	56
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130914	FB	On-Demand	Anodyne	CA1	84	54
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130914	FB	On-Demand	Anodyne	CA7	51	54
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130914	FB	On-Demand	Anodyne	CA5B	51	54
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130914	FB	On-Demand	Anodyne	CA4	69	55
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130914	FB	On-Demand	Anodyne	CA5A	52	54
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130914	FB	On-Demand	Anodyne	CA14	44	45
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130914	FB	On-Demand	Anodyne	MMP2	17	40
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130914	FB	On-Demand	Anodyne	CA12	56	50
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130914	FB	On-Demand	Anodyne	CA9	63	56
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130914	FB	On-Demand	Anodyne	CYNT	20	43
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130914	FB	On-Demand	Anodyne	NCE103	24	47
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130914	FB	On-Demand	Anodyne	P96878_MYCTU	20	47
NS(=O)(=O)c1ccc(CCNC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130914	FB	On-Demand	Anodyne	A6YCJ1_9METZ	24	48
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@@H]2C(=O)O)c1	ZINC000819130916	FC	On-Demand	Anodyne	CA2	49	46
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@@H]2C(=O)O)c1	ZINC000819130916	FC	On-Demand	Anodyne	CA1	49	46
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@@H]2C(=O)O)c1	ZINC000819130916	FC	On-Demand	Anodyne	CA7	38	44
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@@H]2C(=O)O)c1	ZINC000819130916	FC	On-Demand	Anodyne	CA5B	46	44
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@@H]2C(=O)O)c1	ZINC000819130916	FC	On-Demand	Anodyne	CA4	60	46
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@@H]2C(=O)O)c1	ZINC000819130916	FC	On-Demand	Anodyne	CA5A	53	44
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@@H]2C(=O)O)c1	ZINC000819130916	FC	On-Demand	Anodyne	CA12	24	42
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@@H]2C(=O)O)c1	ZINC000819130916	FC	On-Demand	Anodyne	CA9	25	44
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@H]2C(=O)O)c1	ZINC000819130918	FC	On-Demand	Anodyne	CA2	49	46
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@H]2C(=O)O)c1	ZINC000819130918	FC	On-Demand	Anodyne	CA1	49	46
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@H]2C(=O)O)c1	ZINC000819130918	FC	On-Demand	Anodyne	CA7	38	44
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@H]2C(=O)O)c1	ZINC000819130918	FC	On-Demand	Anodyne	CA5B	46	44
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@H]2C(=O)O)c1	ZINC000819130918	FC	On-Demand	Anodyne	CA4	60	46
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@H]2C(=O)O)c1	ZINC000819130918	FC	On-Demand	Anodyne	CA5A	53	44
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@H]2C(=O)O)c1	ZINC000819130918	FC	On-Demand	Anodyne	CA12	24	42
NS(=O)(=O)c1ccc(Cl)c(NC(=O)CN2CCC[C@H]2C(=O)O)c1	ZINC000819130918	FC	On-Demand	Anodyne	CA9	25	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130921	FD	On-Demand	Anodyne	CA2	23	42
NS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130921	FD	On-Demand	Anodyne	CA1	21	42
NS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130921	FD	On-Demand	Anodyne	CA4	24	42
NS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130922	FD	On-Demand	Anodyne	CA2	23	42
NS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130922	FD	On-Demand	Anodyne	CA1	21	42
NS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819130922	FD	On-Demand	Anodyne	CA4	24	42
NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819130924	GB	On-Demand	Anodyne	SLC6A9	29	47
NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819130925	GB	On-Demand	Anodyne	SLC6A9	29	47
NS(=O)(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130926	FD	On-Demand	Anodyne	CA2	116	55
NS(=O)(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130926	FD	On-Demand	Anodyne	CA6	20	55
NS(=O)(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130926	FD	On-Demand	Anodyne	CA1	94	55
NS(=O)(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130926	FD	On-Demand	Anodyne	CA7	68	55
NS(=O)(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130926	FD	On-Demand	Anodyne	CA5B	44	37
NS(=O)(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130926	FD	On-Demand	Anodyne	CA4	73	55
NS(=O)(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130926	FD	On-Demand	Anodyne	CA5A	46	37
NS(=O)(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130926	FD	On-Demand	Anodyne	CA14	47	42
NS(=O)(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130926	FD	On-Demand	Anodyne	PLA2G4B	64	44
NS(=O)(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130926	FD	On-Demand	Anodyne	CA12	69	55
NS(=O)(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130926	FD	On-Demand	Anodyne	CA9	76	55
NS(=O)(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130926	FD	On-Demand	Anodyne	CYNT	28	40
NS(=O)(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130926	FD	On-Demand	Anodyne	NCE103	19	55
NS(=O)(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130926	FD	On-Demand	Anodyne	MTCA1	31	40
NS(=O)(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130926	FD	On-Demand	Anodyne	P96878_MYCTU	37	40
NS(=O)(=O)c1ccc(OCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130926	FD	On-Demand	Anodyne	A6YCJ1_9METZ	21	41
NS(=O)(=O)c1ccc(CNC(=O)NCCC(=O)O)s1	ZINC000819130929	DB	On-Demand	Anodyne	CA2	22	40
NS(=O)(=O)c1ccc(CNC(=O)NCCC(=O)O)s1	ZINC000819130929	DB	On-Demand	Anodyne	CA1	16	45
NS(=O)(=O)c1ccc(CNC(=O)NCCC(=O)O)s1	ZINC000819130929	DB	On-Demand	Anodyne	CA4	22	45
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	CA2	156	69
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	MAOB	18	40
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	SRD5A2	19	59
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	LTA4H	34	41
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	CA6	25	64
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	CA1	128	69
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	CA7	86	69
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	MMP13	28	45
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	ADAM17	32	45
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	CA13	38	43
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	CA5B	52	41
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	CA4	100	64
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	CA5A	55	41
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	CA14	68	47
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	MMP14	20	45
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	PLA2G4B	60	42
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	MMP9	17	45
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	ACR	39	50
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	CA12	99	69
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	ADAMTS4	44	46
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	CA9	110	69
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	MMP1	15	42
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	CAH_METTE	29	43
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	FFAR1	39	44
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	CYNT	44	45
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	NCE103	29	64
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	FFAR4	42	35
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	CA15	16	43
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	MTCA1	43	44
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	P96878_MYCTU	54	44
NS(=O)(=O)c1ccc(OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130930	DD	On-Demand	Anodyne	A6YCJ1_9METZ	24	45
NS(=O)(=O)c1ccc(CNC(=S)Nc2ccccc2CC(=O)O)cc1	ZINC000819130932	GD	On-Demand	Anodyne	CA2	161	60
NS(=O)(=O)c1ccc(CNC(=S)Nc2ccccc2CC(=O)O)cc1	ZINC000819130932	GD	On-Demand	Anodyne	CA6	27	41
NS(=O)(=O)c1ccc(CNC(=S)Nc2ccccc2CC(=O)O)cc1	ZINC000819130932	GD	On-Demand	Anodyne	CA1	135	60
NS(=O)(=O)c1ccc(CNC(=S)Nc2ccccc2CC(=O)O)cc1	ZINC000819130932	GD	On-Demand	Anodyne	CA7	73	60
NS(=O)(=O)c1ccc(CNC(=S)Nc2ccccc2CC(=O)O)cc1	ZINC000819130932	GD	On-Demand	Anodyne	CA13	30	41
NS(=O)(=O)c1ccc(CNC(=S)Nc2ccccc2CC(=O)O)cc1	ZINC000819130932	GD	On-Demand	Anodyne	CA5B	82	60
NS(=O)(=O)c1ccc(CNC(=S)Nc2ccccc2CC(=O)O)cc1	ZINC000819130932	GD	On-Demand	Anodyne	CA4	132	57
NS(=O)(=O)c1ccc(CNC(=S)Nc2ccccc2CC(=O)O)cc1	ZINC000819130932	GD	On-Demand	Anodyne	CA5A	88	60
NS(=O)(=O)c1ccc(CNC(=S)Nc2ccccc2CC(=O)O)cc1	ZINC000819130932	GD	On-Demand	Anodyne	CA14	60	49
NS(=O)(=O)c1ccc(CNC(=S)Nc2ccccc2CC(=O)O)cc1	ZINC000819130932	GD	On-Demand	Anodyne	CA12	90	56
NS(=O)(=O)c1ccc(CNC(=S)Nc2ccccc2CC(=O)O)cc1	ZINC000819130932	GD	On-Demand	Anodyne	CA9	105	60
NS(=O)(=O)c1ccc(CNC(=S)Nc2ccccc2CC(=O)O)cc1	ZINC000819130932	GD	On-Demand	Anodyne	CYNT	38	44
NS(=O)(=O)c1ccc(CNC(=S)Nc2ccccc2CC(=O)O)cc1	ZINC000819130932	GD	On-Demand	Anodyne	NCE103	34	43
NS(=O)(=O)c1ccc(CNC(=S)Nc2ccccc2CC(=O)O)cc1	ZINC000819130932	GD	On-Demand	Anodyne	MTCA1	52	54
NS(=O)(=O)c1ccc(CNC(=S)Nc2ccccc2CC(=O)O)cc1	ZINC000819130932	GD	On-Demand	Anodyne	P96878_MYCTU	67	54
NS(=O)(=O)c1ccc(CNC(=S)Nc2ccccc2CC(=O)O)cc1	ZINC000819130932	GD	On-Demand	Anodyne	NAMPT	37	48
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130935	EC	On-Demand	Anodyne	CA2	97	57
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130935	EC	On-Demand	Anodyne	CA1	76	57
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130935	EC	On-Demand	Anodyne	CA7	52	39
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130935	EC	On-Demand	Anodyne	CA5B	54	39
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130935	EC	On-Demand	Anodyne	CA4	91	57
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130935	EC	On-Demand	Anodyne	CA5A	57	39
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130935	EC	On-Demand	Anodyne	CA12	42	40
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130935	EC	On-Demand	Anodyne	CA9	44	44
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130935	EC	On-Demand	Anodyne	NCE103	62	41
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130935	EC	On-Demand	Anodyne	MTCA1	58	34
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130935	EC	On-Demand	Anodyne	P96878_MYCTU	50	34
NS(=O)(=O)c1ccc(F)c(C(=O)OCc2ccc(C(=O)O)cc2)c1F	ZINC000819130936	FD	On-Demand	Anodyne	CA2	19	53
NS(=O)(=O)c1ccc(F)c(C(=O)OCc2ccc(C(=O)O)cc2)c1F	ZINC000819130936	FD	On-Demand	Anodyne	CA4	17	53
NS(=O)(=O)c1ccc(CCN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130937	ED	On-Demand	Anodyne	CA2	75	47
NS(=O)(=O)c1ccc(CCN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130937	ED	On-Demand	Anodyne	SLC6A1	50	33
NS(=O)(=O)c1ccc(CCN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130937	ED	On-Demand	Anodyne	CA1	68	43
NS(=O)(=O)c1ccc(CCN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130937	ED	On-Demand	Anodyne	CA7	40	43
NS(=O)(=O)c1ccc(CCN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130937	ED	On-Demand	Anodyne	HRH3	18	49
NS(=O)(=O)c1ccc(CCN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130937	ED	On-Demand	Anodyne	CA4	57	46
NS(=O)(=O)c1ccc(CCN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130937	ED	On-Demand	Anodyne	CA12	45	43
NS(=O)(=O)c1ccc(CCN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130937	ED	On-Demand	Anodyne	CA9	51	43
NS(=O)(=O)c1ccc(CCN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130937	ED	On-Demand	Anodyne	NCE103	19	47
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130938	ED	On-Demand	Anodyne	CA2	75	47
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130938	ED	On-Demand	Anodyne	SLC6A1	50	33
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130938	ED	On-Demand	Anodyne	CA1	68	43
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130938	ED	On-Demand	Anodyne	CA7	40	43
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130938	ED	On-Demand	Anodyne	HRH3	18	49
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130938	ED	On-Demand	Anodyne	CA4	57	46
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130938	ED	On-Demand	Anodyne	CA12	45	43
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130938	ED	On-Demand	Anodyne	CA9	51	43
NS(=O)(=O)c1ccc(CCN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130938	ED	On-Demand	Anodyne	NCE103	19	47
NS(=O)(=O)c1ccc(NCc2ccc(C(=O)O)cc2)cc1C(F)(F)F	ZINC000819130941	FF	On-Demand	Anodyne	CA2	43	51
NS(=O)(=O)c1ccc(NCc2ccc(C(=O)O)cc2)cc1C(F)(F)F	ZINC000819130941	FF	On-Demand	Anodyne	CA1	34	51
NS(=O)(=O)c1ccc(NCc2ccc(C(=O)O)cc2)cc1C(F)(F)F	ZINC000819130941	FF	On-Demand	Anodyne	UL80	23	44
NS(=O)(=O)c1ccc(NCc2ccc(C(=O)O)cc2)cc1C(F)(F)F	ZINC000819130941	FF	On-Demand	Anodyne	CA9	21	40
NS(=O)(=O)c1cccnc1NCCC(=O)O	ZINC000819130942	BB	On-Demand	Anodyne	CA2	34	45
NS(=O)(=O)c1cccnc1NCCC(=O)O	ZINC000819130942	BB	On-Demand	Anodyne	CA1	24	45
NS(=O)(=O)c1cccnc1NCCC(=O)O	ZINC000819130942	BB	On-Demand	Anodyne	CA4	36	43
NS(=O)(=O)c1cccnc1NCCC(=O)O	ZINC000819130942	BB	On-Demand	Anodyne	CA14	16	45
NS(=O)(=O)c1cccnc1NCCC(=O)O	ZINC000819130942	BB	On-Demand	Anodyne	CA12	15	45
Nc1nc(N)nc(CN2CC[C@@H](C(=O)O)C2)n1	ZINC000819130943	BA	On-Demand	Anodyne	SLC6A1	86	36
Nc1nc(N)nc(CN2CC[C@H](C(=O)O)C2)n1	ZINC000819130944	BA	On-Demand	Anodyne	SLC6A1	86	36
NS(=O)(=O)c1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130945	FD	On-Demand	Anodyne	CA2	95	53
NS(=O)(=O)c1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130945	FD	On-Demand	Anodyne	CA1	81	56
NS(=O)(=O)c1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130945	FD	On-Demand	Anodyne	CA7	44	49
NS(=O)(=O)c1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130945	FD	On-Demand	Anodyne	CA5B	77	49
NS(=O)(=O)c1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130945	FD	On-Demand	Anodyne	CA4	92	53
NS(=O)(=O)c1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130945	FD	On-Demand	Anodyne	CA5A	84	49
NS(=O)(=O)c1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130945	FD	On-Demand	Anodyne	CA14	28	45
NS(=O)(=O)c1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130945	FD	On-Demand	Anodyne	CA12	52	56
NS(=O)(=O)c1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130945	FD	On-Demand	Anodyne	CA9	55	56
NS(=O)(=O)c1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130945	FD	On-Demand	Anodyne	TTK	29	46
NS(=O)(=O)c1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130945	FD	On-Demand	Anodyne	NCE103	33	47
NS(=O)(=O)c1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130945	FD	On-Demand	Anodyne	MTCA1	44	56
NS(=O)(=O)c1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130945	FD	On-Demand	Anodyne	P96878_MYCTU	59	56
NS(=O)(=O)c1cccc(CNC(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130945	FD	On-Demand	Anodyne	NAMPT	50	52
NS(=O)(=O)c1cnn(CC(=O)NCCC(=O)O)c1	ZINC000819130946	CA	On-Demand	Anodyne	CA2	45	49
NS(=O)(=O)c1cnn(CC(=O)NCCC(=O)O)c1	ZINC000819130946	CA	On-Demand	Anodyne	CA1	39	49
NS(=O)(=O)c1cnn(CC(=O)NCCC(=O)O)c1	ZINC000819130946	CA	On-Demand	Anodyne	CA4	57	49
NS(=O)(=O)c1cnn(CC(=O)NCCC(=O)O)c1	ZINC000819130946	CA	On-Demand	Anodyne	CA5A	40	37
NS(=O)(=O)c1cnn(CC(=O)NCCC(=O)O)c1	ZINC000819130946	CA	On-Demand	Anodyne	CA12	15	40
NS(=O)(=O)c1cnn(CC(=O)NCCC(=O)O)c1	ZINC000819130946	CA	On-Demand	Anodyne	CA9	17	40
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130948	EB	On-Demand	Anodyne	CA2	58	56
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130948	EB	On-Demand	Anodyne	SLC6A1	101	35
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130948	EB	On-Demand	Anodyne	CA1	50	50
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130948	EB	On-Demand	Anodyne	CA5B	49	38
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130948	EB	On-Demand	Anodyne	CA4	65	55
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130948	EB	On-Demand	Anodyne	CA5A	57	38
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130948	EB	On-Demand	Anodyne	MAPK1	21	40
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130948	EB	On-Demand	Anodyne	CA12	27	50
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130948	EB	On-Demand	Anodyne	ST14	45	38
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819130948	EB	On-Demand	Anodyne	CA9	30	50
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130949	EB	On-Demand	Anodyne	CA2	58	56
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130949	EB	On-Demand	Anodyne	SLC6A1	101	35
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130949	EB	On-Demand	Anodyne	CA1	50	50
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130949	EB	On-Demand	Anodyne	CA5B	49	38
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130949	EB	On-Demand	Anodyne	CA4	65	55
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130949	EB	On-Demand	Anodyne	CA5A	57	38
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130949	EB	On-Demand	Anodyne	MAPK1	21	40
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130949	EB	On-Demand	Anodyne	CA12	27	50
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130949	EB	On-Demand	Anodyne	ST14	45	38
NS(=O)(=O)c1cccc(NC(=O)CN2CC[C@H](C(=O)O)C2)c1	ZINC000819130949	EB	On-Demand	Anodyne	CA9	30	50
Nc1nc(NCc2ccc(C(=O)O)cc2)ncc1[N+](=O)[O-]	ZINC000819130950	CD	On-Demand	Bother	DHFR	15	50
Nc1nc(NCc2ccc(C(=O)O)cc2)ncc1[N+](=O)[O-]	ZINC000819130950	CD	On-Demand	Bother	GSTM2	22	41
Nc1nc(NCc2ccc(C(=O)O)cc2)ncc1[N+](=O)[O-]	ZINC000819130950	CD	On-Demand	Bother	DRTS_TOXGO	19	50
Nc1nc(NCc2ccc(C(=O)O)cc2)ncc1[N+](=O)[O-]	ZINC000819130950	CD	On-Demand	Bother	PRKCQ	30	48
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130951	EB	On-Demand	Anodyne	CA2	44	41
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130951	EB	On-Demand	Anodyne	CA1	34	40
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130951	EB	On-Demand	Anodyne	CA7	35	41
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130951	EB	On-Demand	Anodyne	MMP13	22	45
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130951	EB	On-Demand	Anodyne	CPT1A	76	53
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130951	EB	On-Demand	Anodyne	CPT2	46	36
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130951	EB	On-Demand	Anodyne	MMP9	15	45
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130951	EB	On-Demand	Anodyne	CA12	31	41
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130951	EB	On-Demand	Anodyne	CA9	33	41
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130951	EB	On-Demand	Anodyne	MMP1	15	45
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130952	EB	On-Demand	Anodyne	CA2	44	41
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130952	EB	On-Demand	Anodyne	CA1	34	40
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130952	EB	On-Demand	Anodyne	CA7	35	41
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130952	EB	On-Demand	Anodyne	MMP13	22	45
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130952	EB	On-Demand	Anodyne	CPT1A	76	53
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130952	EB	On-Demand	Anodyne	CPT2	46	36
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130952	EB	On-Demand	Anodyne	MMP9	15	45
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130952	EB	On-Demand	Anodyne	CA12	31	41
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130952	EB	On-Demand	Anodyne	CA9	33	41
NS(=O)(=O)c1ccc(OCC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130952	EB	On-Demand	Anodyne	MMP1	15	45
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130957	EB	On-Demand	Anodyne	CA2	117	61
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130957	EB	On-Demand	Anodyne	SLC6A1	77	34
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130957	EB	On-Demand	Anodyne	CA1	102	61
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130957	EB	On-Demand	Anodyne	CA7	57	49
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130957	EB	On-Demand	Anodyne	CA5B	58	49
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130957	EB	On-Demand	Anodyne	CA4	102	51
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130957	EB	On-Demand	Anodyne	CA5A	62	49
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130957	EB	On-Demand	Anodyne	CA14	45	49
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130957	EB	On-Demand	Anodyne	CA12	68	49
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130957	EB	On-Demand	Anodyne	CA9	70	61
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130957	EB	On-Demand	Anodyne	F13A1	60	35
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130957	EB	On-Demand	Anodyne	MTCA1	50	44
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130957	EB	On-Demand	Anodyne	P96878_MYCTU	64	44
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130958	EB	On-Demand	Anodyne	CA2	117	61
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130958	EB	On-Demand	Anodyne	SLC6A1	77	34
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130958	EB	On-Demand	Anodyne	CA1	102	61
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130958	EB	On-Demand	Anodyne	CA7	57	49
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130958	EB	On-Demand	Anodyne	CA5B	58	49
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130958	EB	On-Demand	Anodyne	CA4	102	51
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130958	EB	On-Demand	Anodyne	CA5A	62	49
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130958	EB	On-Demand	Anodyne	CA14	45	49
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130958	EB	On-Demand	Anodyne	CA12	68	49
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130958	EB	On-Demand	Anodyne	CA9	70	61
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130958	EB	On-Demand	Anodyne	F13A1	60	35
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130958	EB	On-Demand	Anodyne	MTCA1	50	44
NS(=O)(=O)c1ccc(NC(=O)CN2CC[C@H](C(=O)O)C2)cc1	ZINC000819130958	EB	On-Demand	Anodyne	P96878_MYCTU	64	44
Nc1ccc(F)c(NC(=O)CCN2CCC(C(=O)O)CC2)c1	ZINC000819130959	DD	On-Demand	Anodyne	SLC6A1	43	35
NS(=O)(=O)c1ccc(Cl)c(C(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819130962	EC	On-Demand	Anodyne	CA2	24	43
NS(=O)(=O)c1ccc(Cl)c(C(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819130962	EC	On-Demand	Anodyne	CA9	15	43
NS(=O)(=O)c1ccc(Cl)c(C(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819130963	EC	On-Demand	Anodyne	CA2	24	43
NS(=O)(=O)c1ccc(Cl)c(C(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819130963	EC	On-Demand	Anodyne	CA9	15	43
Nc1nc(CN2CCC[C@H](CC(=O)O)C2)nc(Nc2ccc(F)cc2)n1	ZINC000819130964	FE	On-Demand	Anodyne	CCR3	84	37
Nc1nc(CN2CCC[C@@H](CC(=O)O)C2)nc(Nc2ccc(F)cc2)n1	ZINC000819130965	FE	On-Demand	Anodyne	CCR3	84	37
Nc1nc(CN2CC[C@@H](C(=O)O)C2)nc2ccccc12	ZINC000819130969	CD	On-Demand	Anodyne	SLC6A1	139	40
Nc1nc(CN2CC[C@@H](C(=O)O)C2)nc2ccccc12	ZINC000819130969	CD	On-Demand	Anodyne	S1PR1	19	42
Nc1nc(CN2CC[C@@H](C(=O)O)C2)nc2ccccc12	ZINC000819130969	CD	On-Demand	Anodyne	S1PR5	21	42
Nc1nc(CN2CC[C@H](C(=O)O)C2)nc2ccccc12	ZINC000819130970	CD	On-Demand	Anodyne	SLC6A1	139	40
Nc1nc(CN2CC[C@H](C(=O)O)C2)nc2ccccc12	ZINC000819130970	CD	On-Demand	Anodyne	S1PR1	19	42
Nc1nc(CN2CC[C@H](C(=O)O)C2)nc2ccccc12	ZINC000819130970	CD	On-Demand	Anodyne	S1PR5	21	42
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819130971	FB	On-Demand	Anodyne	CA7	28	52
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CN1CC[C@@H](C(=O)O)C1	ZINC000819130971	FB	On-Demand	Anodyne	EIF2AK3	43	32
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819130972	FB	On-Demand	Anodyne	CA7	28	52
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CN1CC[C@H](C(=O)O)C1	ZINC000819130972	FB	On-Demand	Anodyne	EIF2AK3	43	32
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130978	EB	On-Demand	Anodyne	CA2	76	52
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130978	EB	On-Demand	Anodyne	DHODH	15	41
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130978	EB	On-Demand	Anodyne	CA1	67	52
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130978	EB	On-Demand	Anodyne	CA7	44	41
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130978	EB	On-Demand	Anodyne	CA5B	29	41
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130978	EB	On-Demand	Anodyne	CA4	65	52
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130978	EB	On-Demand	Anodyne	CA5A	34	41
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130978	EB	On-Demand	Anodyne	CA14	39	41
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130978	EB	On-Demand	Anodyne	EPHX2	18	40
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130978	EB	On-Demand	Anodyne	CA12	50	45
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130978	EB	On-Demand	Anodyne	CA9	52	45
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130978	EB	On-Demand	Anodyne	F13A1	57	37
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130978	EB	On-Demand	Anodyne	MTCA1	51	45
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819130978	EB	On-Demand	Anodyne	P96878_MYCTU	64	45
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130979	EB	On-Demand	Anodyne	CA2	76	52
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130979	EB	On-Demand	Anodyne	DHODH	15	41
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130979	EB	On-Demand	Anodyne	CA1	67	52
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130979	EB	On-Demand	Anodyne	CA7	44	41
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130979	EB	On-Demand	Anodyne	CA5B	29	41
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130979	EB	On-Demand	Anodyne	CA4	65	52
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130979	EB	On-Demand	Anodyne	CA5A	34	41
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130979	EB	On-Demand	Anodyne	CA14	39	41
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130979	EB	On-Demand	Anodyne	EPHX2	18	40
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130979	EB	On-Demand	Anodyne	CA12	50	45
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130979	EB	On-Demand	Anodyne	CA9	52	45
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130979	EB	On-Demand	Anodyne	F13A1	57	37
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130979	EB	On-Demand	Anodyne	MTCA1	51	45
NS(=O)(=O)c1ccc(NC(=O)C(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819130979	EB	On-Demand	Anodyne	P96878_MYCTU	64	45
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	CA2	182	63
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	CA6	32	55
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	CA1	158	60
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	CA7	80	55
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	CA13	38	40
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	CA5B	61	52
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	CA4	131	60
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	CA5A	64	52
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	CA14	68	55
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	PTPRB	15	40
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	CA12	107	60
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	TPSAB1	15	40
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	CA9	119	63
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	CAH_METTE	29	40
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	UREA_CANEN	26	42
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	CYNT	56	55
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	NCE103	37	55
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	CA15	18	40
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	MTCA1	60	60
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	P96878_MYCTU	77	60
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	NAMPT	74	44
NS(=O)(=O)c1ccc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130982	GC	On-Demand	Anodyne	A6YCJ1_9METZ	31	47
NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130983	FC	On-Demand	Anodyne	CA2	157	60
NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130983	FC	On-Demand	Anodyne	CA6	21	53
NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130983	FC	On-Demand	Anodyne	CA1	133	58
NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130983	FC	On-Demand	Anodyne	CA7	79	57
NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130983	FC	On-Demand	Anodyne	UL80	15	42
NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130983	FC	On-Demand	Anodyne	CA13	37	41
NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130983	FC	On-Demand	Anodyne	CA5B	58	57
NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130983	FC	On-Demand	Anodyne	CA4	102	60
NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130983	FC	On-Demand	Anodyne	CA5A	61	57
NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130983	FC	On-Demand	Anodyne	CA14	68	51
NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130983	FC	On-Demand	Anodyne	PLA2G4B	61	41
NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130983	FC	On-Demand	Anodyne	CA12	96	58
NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130983	FC	On-Demand	Anodyne	CA9	104	58
NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130983	FC	On-Demand	Anodyne	AOC3	15	41
NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130983	FC	On-Demand	Anodyne	CYNT	40	53
NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130983	FC	On-Demand	Anodyne	NCE103	29	53
NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130983	FC	On-Demand	Anodyne	MTCA1	40	45
NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130983	FC	On-Demand	Anodyne	P96878_MYCTU	53	45
NS(=O)(=O)c1ccc(OCC(=O)NCc2ccc(C(=O)O)cc2)cc1	ZINC000819130983	FC	On-Demand	Anodyne	A6YCJ1_9METZ	25	48
NS(=O)(=O)c1ccc(NCCC(=O)O)c2ncccc12	ZINC000819130984	CC	On-Demand	Anodyne	CA2	15	40
NS(=O)(=O)c1ccc(NCCC(=O)O)c2ncccc12	ZINC000819130984	CC	On-Demand	Anodyne	CA4	18	40
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	CA2	119	56
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	CA6	18	48
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	CA1	94	53
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	CA7	52	52
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	CA5B	67	52
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	CA4	96	53
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	CA5A	72	52
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	CA14	38	53
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	FURIN	46	34
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	FBP1	23	40
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	CA12	53	53
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	ALPL	16	52
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	CA9	63	53
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	TTK	18	48
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	AKR1C3	20	40
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	CYNT	29	49
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	NCE103	37	48
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	MTCA1	35	53
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	P96878_MYCTU	45	53
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	NAMPT	65	46
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	TMPRSS11D	58	37
NS(=O)(=O)c1cccc(CNC(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130986	FD	On-Demand	Anodyne	A6YCJ1_9METZ	18	41
NS(=O)(=O)c1cccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130987	GC	On-Demand	Anodyne	CA2	78	47
NS(=O)(=O)c1cccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130987	GC	On-Demand	Anodyne	CA1	66	47
NS(=O)(=O)c1cccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130987	GC	On-Demand	Anodyne	CA7	34	47
NS(=O)(=O)c1cccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130987	GC	On-Demand	Anodyne	CA5B	75	47
NS(=O)(=O)c1cccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130987	GC	On-Demand	Anodyne	CA4	77	43
NS(=O)(=O)c1cccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130987	GC	On-Demand	Anodyne	CA5A	81	47
NS(=O)(=O)c1cccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130987	GC	On-Demand	Anodyne	CA14	18	42
NS(=O)(=O)c1cccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130987	GC	On-Demand	Anodyne	CA12	38	45
NS(=O)(=O)c1cccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130987	GC	On-Demand	Anodyne	CA9	51	43
NS(=O)(=O)c1cccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130987	GC	On-Demand	Anodyne	TTK	27	45
NS(=O)(=O)c1cccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130987	GC	On-Demand	Anodyne	MTCA1	16	45
NS(=O)(=O)c1cccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130987	GC	On-Demand	Anodyne	P96878_MYCTU	23	45
NS(=O)(=O)c1cccc(CNC(=O)C(=O)Nc2ccccc2CC(=O)O)c1	ZINC000819130987	GC	On-Demand	Anodyne	NAMPT	21	42
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCC(=O)O)c1	ZINC000819130988	DC	On-Demand	Anodyne	CA2	128	65
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCC(=O)O)c1	ZINC000819130988	DC	On-Demand	Anodyne	TBXA2R	41	33
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCC(=O)O)c1	ZINC000819130988	DC	On-Demand	Anodyne	CA1	105	65
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCC(=O)O)c1	ZINC000819130988	DC	On-Demand	Anodyne	CA7	63	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCC(=O)O)c1	ZINC000819130988	DC	On-Demand	Anodyne	CA5B	60	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCC(=O)O)c1	ZINC000819130988	DC	On-Demand	Anodyne	CA4	125	65
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCC(=O)O)c1	ZINC000819130988	DC	On-Demand	Anodyne	CA5A	64	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCC(=O)O)c1	ZINC000819130988	DC	On-Demand	Anodyne	CA14	50	41
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCC(=O)O)c1	ZINC000819130988	DC	On-Demand	Anodyne	CA12	60	42
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCC(=O)O)c1	ZINC000819130988	DC	On-Demand	Anodyne	CA9	60	47
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCC(=O)O)c1	ZINC000819130988	DC	On-Demand	Anodyne	CAH_METTE	42	39
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCC(=O)O)c1	ZINC000819130988	DC	On-Demand	Anodyne	NCE103	64	43
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCC(=O)O)c1	ZINC000819130988	DC	On-Demand	Anodyne	MTCA1	50	35
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCC(=O)O)c1	ZINC000819130988	DC	On-Demand	Anodyne	P96878_MYCTU	58	43
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCC(=O)O)c1	ZINC000819130988	DC	On-Demand	Anodyne	A6YCJ1_9METZ	27	41
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130991	FD	On-Demand	Anodyne	CA2	146	65
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130991	FD	On-Demand	Anodyne	CA6	39	49
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130991	FD	On-Demand	Anodyne	CA1	118	65
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130991	FD	On-Demand	Anodyne	CA7	73	50
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130991	FD	On-Demand	Anodyne	CA13	55	41
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130991	FD	On-Demand	Anodyne	CA5B	64	50
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130991	FD	On-Demand	Anodyne	CA4	120	65
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130991	FD	On-Demand	Anodyne	CA5A	68	50
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130991	FD	On-Demand	Anodyne	CA14	56	48
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130991	FD	On-Demand	Anodyne	CA12	71	53
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130991	FD	On-Demand	Anodyne	CA9	80	53
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130991	FD	On-Demand	Anodyne	CAH_METTE	44	38
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130991	FD	On-Demand	Anodyne	CYNT	45	56
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130991	FD	On-Demand	Anodyne	NCE103	59	49
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130991	FD	On-Demand	Anodyne	MTCA1	34	42
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130991	FD	On-Demand	Anodyne	P96878_MYCTU	43	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130991	FD	On-Demand	Anodyne	NAMPT	74	39
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130991	FD	On-Demand	Anodyne	RPA1	68	46
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCc2ccc(C(=O)O)cc2)c1	ZINC000819130991	FD	On-Demand	Anodyne	A6YCJ1_9METZ	32	45
Nc1nc(CN2CCC[C@@H]2C(=O)O)nc(Nc2ccc(F)cc2)n1	ZINC000819130992	ED	On-Demand	Anodyne	STAT6	51	34
Nc1nc(CN2CCC[C@H]2C(=O)O)nc(Nc2ccc(F)cc2)n1	ZINC000819130993	ED	On-Demand	Anodyne	STAT6	51	34
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130995	ED	On-Demand	Anodyne	CA2	111	59
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130995	ED	On-Demand	Anodyne	CA1	92	59
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130995	ED	On-Demand	Anodyne	CA7	53	43
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130995	ED	On-Demand	Anodyne	CA13	15	40
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130995	ED	On-Demand	Anodyne	CA5B	58	43
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130995	ED	On-Demand	Anodyne	CA4	109	59
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130995	ED	On-Demand	Anodyne	CA5A	62	43
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130995	ED	On-Demand	Anodyne	CA14	41	40
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130995	ED	On-Demand	Anodyne	CA12	49	41
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130995	ED	On-Demand	Anodyne	CA9	49	45
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130995	ED	On-Demand	Anodyne	NCE103	69	41
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130995	ED	On-Demand	Anodyne	MTCA1	60	34
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCCCCC(=O)O)c1	ZINC000819130995	ED	On-Demand	Anodyne	P96878_MYCTU	61	34
NS(=O)(=O)c1ccc(CCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130996	FD	On-Demand	Anodyne	CA2	136	59
NS(=O)(=O)c1ccc(CCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130996	FD	On-Demand	Anodyne	CA6	22	58
NS(=O)(=O)c1ccc(CCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130996	FD	On-Demand	Anodyne	CA1	113	58
NS(=O)(=O)c1ccc(CCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130996	FD	On-Demand	Anodyne	CA7	72	58
NS(=O)(=O)c1ccc(CCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130996	FD	On-Demand	Anodyne	CA13	34	45
NS(=O)(=O)c1ccc(CCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130996	FD	On-Demand	Anodyne	CA5B	51	43
NS(=O)(=O)c1ccc(CCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130996	FD	On-Demand	Anodyne	CA4	93	58
NS(=O)(=O)c1ccc(CCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130996	FD	On-Demand	Anodyne	CA5A	53	43
NS(=O)(=O)c1ccc(CCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130996	FD	On-Demand	Anodyne	CA14	50	43
NS(=O)(=O)c1ccc(CCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130996	FD	On-Demand	Anodyne	CA12	78	58
NS(=O)(=O)c1ccc(CCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130996	FD	On-Demand	Anodyne	CA9	91	58
NS(=O)(=O)c1ccc(CCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130996	FD	On-Demand	Anodyne	CAH_METTE	25	45
NS(=O)(=O)c1ccc(CCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130996	FD	On-Demand	Anodyne	CYNT	35	46
NS(=O)(=O)c1ccc(CCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130996	FD	On-Demand	Anodyne	NCE103	24	59
NS(=O)(=O)c1ccc(CCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130996	FD	On-Demand	Anodyne	CA15	15	45
NS(=O)(=O)c1ccc(CCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130996	FD	On-Demand	Anodyne	P96878_MYCTU	48	39
NS(=O)(=O)c1ccc(CCC(=O)OCc2ccc(C(=O)O)cc2)cc1	ZINC000819130996	FD	On-Demand	Anodyne	A6YCJ1_9METZ	25	49
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130997	GC	On-Demand	Anodyne	CA2	78	59
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130997	GC	On-Demand	Anodyne	CA1	67	50
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130997	GC	On-Demand	Anodyne	CA7	40	50
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130997	GC	On-Demand	Anodyne	CA5B	38	50
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130997	GC	On-Demand	Anodyne	CA4	56	59
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130997	GC	On-Demand	Anodyne	CA5A	37	50
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130997	GC	On-Demand	Anodyne	CA14	31	42
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130997	GC	On-Demand	Anodyne	MMP2	61	44
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130997	GC	On-Demand	Anodyne	MMP3	16	44
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130997	GC	On-Demand	Anodyne	CA12	45	48
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130997	GC	On-Demand	Anodyne	CA9	49	55
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130997	GC	On-Demand	Anodyne	CYNT	19	40
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130997	GC	On-Demand	Anodyne	NCE103	21	44
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130997	GC	On-Demand	Anodyne	P96878_MYCTU	19	44
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819130997	GC	On-Demand	Anodyne	A6YCJ1_9METZ	23	45
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130998	GC	On-Demand	Anodyne	CA2	78	59
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130998	GC	On-Demand	Anodyne	CA1	67	50
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130998	GC	On-Demand	Anodyne	CA7	40	50
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130998	GC	On-Demand	Anodyne	CA5B	38	50
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130998	GC	On-Demand	Anodyne	CA4	56	59
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130998	GC	On-Demand	Anodyne	CA5A	37	50
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130998	GC	On-Demand	Anodyne	CA14	31	42
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130998	GC	On-Demand	Anodyne	MMP2	61	44
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130998	GC	On-Demand	Anodyne	MMP3	16	44
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130998	GC	On-Demand	Anodyne	CA12	45	48
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130998	GC	On-Demand	Anodyne	CA9	49	55
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130998	GC	On-Demand	Anodyne	CYNT	19	40
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130998	GC	On-Demand	Anodyne	NCE103	21	44
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130998	GC	On-Demand	Anodyne	P96878_MYCTU	19	44
NS(=O)(=O)c1ccc(CCNC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819130998	GC	On-Demand	Anodyne	A6YCJ1_9METZ	23	45
Nc1ccc(F)c(NC(=O)CCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130999	DD	On-Demand	Anodyne	SLC6A1	70	36
Nc1ccc(F)c(NC(=O)CCN2CCC[C@H](CC(=O)O)C2)c1	ZINC000819130999	DD	On-Demand	Anodyne	CCR3	50	34
Nc1ccc(F)c(NC(=O)CCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819131000	DD	On-Demand	Anodyne	SLC6A1	70	36
Nc1ccc(F)c(NC(=O)CCN2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819131000	DD	On-Demand	Anodyne	CCR3	50	34
NS(=O)(=O)c1ccc(OCC(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819131005	FC	On-Demand	Anodyne	CA2	27	40
NS(=O)(=O)c1ccc(OCC(=O)N2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819131005	FC	On-Demand	Anodyne	CPT1A	50	50
NS(=O)(=O)c1ccc(OCC(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819131006	FC	On-Demand	Anodyne	CA2	27	40
NS(=O)(=O)c1ccc(OCC(=O)N2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819131006	FC	On-Demand	Anodyne	CPT1A	50	50
Nc1nc(CN2CC[C@@H](C(=O)O)C2)nc(Nc2ccc(F)cc2)n1	ZINC000819131007	ED	On-Demand	Anodyne	SLC6A1	93	37
Nc1nc(CN2CC[C@@H](C(=O)O)C2)nc(Nc2ccc(F)cc2)n1	ZINC000819131007	ED	On-Demand	Anodyne	STAT6	56	34
Nc1nc(CN2CC[C@H](C(=O)O)C2)nc(Nc2ccc(F)cc2)n1	ZINC000819131008	ED	On-Demand	Anodyne	SLC6A1	93	37
Nc1nc(CN2CC[C@H](C(=O)O)C2)nc(Nc2ccc(F)cc2)n1	ZINC000819131008	ED	On-Demand	Anodyne	STAT6	56	34
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCC(=O)O)c1	ZINC000819131010	DC	On-Demand	Anodyne	CA2	139	63
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCC(=O)O)c1	ZINC000819131010	DC	On-Demand	Anodyne	TBXA2R	42	34
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCC(=O)O)c1	ZINC000819131010	DC	On-Demand	Anodyne	CA1	114	63
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCC(=O)O)c1	ZINC000819131010	DC	On-Demand	Anodyne	CA7	72	46
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCC(=O)O)c1	ZINC000819131010	DC	On-Demand	Anodyne	CA13	26	40
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCC(=O)O)c1	ZINC000819131010	DC	On-Demand	Anodyne	CA5B	66	46
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCC(=O)O)c1	ZINC000819131010	DC	On-Demand	Anodyne	CA4	138	63
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCC(=O)O)c1	ZINC000819131010	DC	On-Demand	Anodyne	CA5A	70	46
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCC(=O)O)c1	ZINC000819131010	DC	On-Demand	Anodyne	CA14	56	45
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCC(=O)O)c1	ZINC000819131010	DC	On-Demand	Anodyne	CA12	67	45
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCC(=O)O)c1	ZINC000819131010	DC	On-Demand	Anodyne	CA9	68	49
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCC(=O)O)c1	ZINC000819131010	DC	On-Demand	Anodyne	CAH_METTE	48	40
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCC(=O)O)c1	ZINC000819131010	DC	On-Demand	Anodyne	CYNT	45	40
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCC(=O)O)c1	ZINC000819131010	DC	On-Demand	Anodyne	NCE103	64	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCC(=O)O)c1	ZINC000819131010	DC	On-Demand	Anodyne	CA15	30	40
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCC(=O)O)c1	ZINC000819131010	DC	On-Demand	Anodyne	MTCA1	55	36
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCC(=O)O)c1	ZINC000819131010	DC	On-Demand	Anodyne	P96878_MYCTU	64	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)NCCC(=O)O)c1	ZINC000819131010	DC	On-Demand	Anodyne	A6YCJ1_9METZ	34	43
NS(=O)(=O)c1cccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819131012	FB	On-Demand	Anodyne	CA2	27	51
NS(=O)(=O)c1cccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819131012	FB	On-Demand	Anodyne	CA1	21	44
NS(=O)(=O)c1cccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819131012	FB	On-Demand	Anodyne	CA4	31	49
NS(=O)(=O)c1cccc(NC(=O)C(=O)N2CCC[C@@H](CC(=O)O)C2)c1	ZINC000819131012	FB	On-Demand	Anodyne	ST14	43	38
NS(=O)(=O)c1cccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819131013	FB	On-Demand	Anodyne	CA2	27	51
NS(=O)(=O)c1cccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819131013	FB	On-Demand	Anodyne	CA1	21	44
NS(=O)(=O)c1cccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819131013	FB	On-Demand	Anodyne	CA4	31	49
NS(=O)(=O)c1cccc(NC(=O)C(=O)N2CCC[C@H](CC(=O)O)C2)c1	ZINC000819131013	FB	On-Demand	Anodyne	ST14	43	38
NS(=O)(=O)c1ccc(OCC(=O)NCCC(=O)O)cc1	ZINC000819131015	DB	On-Demand	Anodyne	CA2	152	60
NS(=O)(=O)c1ccc(OCC(=O)NCCC(=O)O)cc1	ZINC000819131015	DB	On-Demand	Anodyne	CA1	134	60
NS(=O)(=O)c1ccc(OCC(=O)NCCC(=O)O)cc1	ZINC000819131015	DB	On-Demand	Anodyne	CA7	81	49
NS(=O)(=O)c1ccc(OCC(=O)NCCC(=O)O)cc1	ZINC000819131015	DB	On-Demand	Anodyne	CA5B	67	49
NS(=O)(=O)c1ccc(OCC(=O)NCCC(=O)O)cc1	ZINC000819131015	DB	On-Demand	Anodyne	CA4	119	60
NS(=O)(=O)c1ccc(OCC(=O)NCCC(=O)O)cc1	ZINC000819131015	DB	On-Demand	Anodyne	CA5A	71	49
NS(=O)(=O)c1ccc(OCC(=O)NCCC(=O)O)cc1	ZINC000819131015	DB	On-Demand	Anodyne	CA14	62	46
NS(=O)(=O)c1ccc(OCC(=O)NCCC(=O)O)cc1	ZINC000819131015	DB	On-Demand	Anodyne	MMP14	15	43
NS(=O)(=O)c1ccc(OCC(=O)NCCC(=O)O)cc1	ZINC000819131015	DB	On-Demand	Anodyne	CA12	89	51
NS(=O)(=O)c1ccc(OCC(=O)NCCC(=O)O)cc1	ZINC000819131015	DB	On-Demand	Anodyne	CA9	93	51
NS(=O)(=O)c1ccc(OCC(=O)NCCC(=O)O)cc1	ZINC000819131015	DB	On-Demand	Anodyne	CYNT	40	38
NS(=O)(=O)c1ccc(OCC(=O)NCCC(=O)O)cc1	ZINC000819131015	DB	On-Demand	Anodyne	NCE103	31	51
NS(=O)(=O)c1ccc(OCC(=O)NCCC(=O)O)cc1	ZINC000819131015	DB	On-Demand	Anodyne	MTCA1	48	44
NS(=O)(=O)c1ccc(OCC(=O)NCCC(=O)O)cc1	ZINC000819131015	DB	On-Demand	Anodyne	P96878_MYCTU	60	44
NS(=O)(=O)c1ccc(OCC(=O)NCCC(=O)O)cc1	ZINC000819131015	DB	On-Demand	Anodyne	A6YCJ1_9METZ	28	43
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819131016	FB	On-Demand	Anodyne	CA2	85	57
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819131016	FB	On-Demand	Anodyne	SLC6A1	108	35
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819131016	FB	On-Demand	Anodyne	CA1	73	55
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819131016	FB	On-Demand	Anodyne	CA7	47	52
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819131016	FB	On-Demand	Anodyne	CA5B	46	52
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819131016	FB	On-Demand	Anodyne	CA4	61	53
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819131016	FB	On-Demand	Anodyne	CA5A	46	52
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819131016	FB	On-Demand	Anodyne	CA14	38	48
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819131016	FB	On-Demand	Anodyne	MMP2	43	42
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819131016	FB	On-Demand	Anodyne	MMP3	15	42
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819131016	FB	On-Demand	Anodyne	CA12	48	48
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819131016	FB	On-Demand	Anodyne	CA9	53	57
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819131016	FB	On-Demand	Anodyne	CYNT	20	42
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819131016	FB	On-Demand	Anodyne	NCE103	22	45
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819131016	FB	On-Demand	Anodyne	P96878_MYCTU	17	45
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@@H](C(=O)O)C2)cc1	ZINC000819131016	FB	On-Demand	Anodyne	A6YCJ1_9METZ	23	46
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819131017	FB	On-Demand	Anodyne	CA2	85	57
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819131017	FB	On-Demand	Anodyne	SLC6A1	108	35
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819131017	FB	On-Demand	Anodyne	CA1	73	55
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819131017	FB	On-Demand	Anodyne	CA7	47	52
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819131017	FB	On-Demand	Anodyne	CA5B	46	52
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819131017	FB	On-Demand	Anodyne	CA4	61	53
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819131017	FB	On-Demand	Anodyne	CA5A	46	52
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819131017	FB	On-Demand	Anodyne	CA14	38	48
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819131017	FB	On-Demand	Anodyne	MMP2	43	42
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819131017	FB	On-Demand	Anodyne	MMP3	15	42
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819131017	FB	On-Demand	Anodyne	CA12	48	48
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819131017	FB	On-Demand	Anodyne	CA9	53	57
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819131017	FB	On-Demand	Anodyne	CYNT	20	42
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819131017	FB	On-Demand	Anodyne	NCE103	22	45
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819131017	FB	On-Demand	Anodyne	P96878_MYCTU	17	45
NS(=O)(=O)c1ccc(CCNC(=O)CCN2CC[C@H](C(=O)O)C2)cc1	ZINC000819131017	FB	On-Demand	Anodyne	A6YCJ1_9METZ	23	46
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819131018	FC	On-Demand	Anodyne	CA2	92	57
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819131018	FC	On-Demand	Anodyne	CA1	79	57
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819131018	FC	On-Demand	Anodyne	CA7	37	45
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819131018	FC	On-Demand	Anodyne	CA5B	44	45
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819131018	FC	On-Demand	Anodyne	CA4	87	53
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819131018	FC	On-Demand	Anodyne	CA5A	50	45
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819131018	FC	On-Demand	Anodyne	CA14	31	45
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819131018	FC	On-Demand	Anodyne	CA12	51	43
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819131018	FC	On-Demand	Anodyne	CA9	52	51
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819131018	FC	On-Demand	Anodyne	F13A1	43	34
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819131018	FC	On-Demand	Anodyne	MTCA1	46	44
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@H](CC(=O)O)C2)cc1	ZINC000819131018	FC	On-Demand	Anodyne	P96878_MYCTU	58	44
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819131019	FC	On-Demand	Anodyne	CA2	92	57
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819131019	FC	On-Demand	Anodyne	CA1	79	57
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819131019	FC	On-Demand	Anodyne	CA7	37	45
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819131019	FC	On-Demand	Anodyne	CA5B	44	45
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819131019	FC	On-Demand	Anodyne	CA4	87	53
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819131019	FC	On-Demand	Anodyne	CA5A	50	45
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819131019	FC	On-Demand	Anodyne	CA14	31	45
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819131019	FC	On-Demand	Anodyne	CA12	51	43
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819131019	FC	On-Demand	Anodyne	CA9	52	51
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819131019	FC	On-Demand	Anodyne	F13A1	43	34
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819131019	FC	On-Demand	Anodyne	MTCA1	46	44
NS(=O)(=O)c1ccc(NC(=O)CN2CCC[C@@H](CC(=O)O)C2)cc1	ZINC000819131019	FC	On-Demand	Anodyne	P96878_MYCTU	58	44
Nc1c(O)nc(O)nc1C(=O)N1CCC[C@H]1C(=O)O	ZINC000819131020	CB	On-Demand	Anodyne	ACE	36	43
Nc1c(O)nc(O)nc1C(=O)N1CCC[C@@H]1C(=O)O	ZINC000819131021	CB	On-Demand	Anodyne	ACE	36	43
O=C1[C@H](NC[C@H](O)c2ccccc2)CCN1C1CCOCC1	ZINC000819131030	DD	On-Demand	Anodyne	BIRC8	53	31
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCN1C1CCOCC1	ZINC000819131031	DD	On-Demand	Anodyne	BIRC8	53	31
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCN1C1CCOCC1	ZINC000819131032	DD	On-Demand	Anodyne	BIRC8	53	31
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCN1C1CCOCC1	ZINC000819131033	DD	On-Demand	Anodyne	BIRC8	53	31
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819131055	DD	On-Demand	Anodyne	ADRB2	46	57
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819131055	DD	On-Demand	Anodyne	ADRB1	80	57
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819131055	DD	On-Demand	Anodyne	GRIN1	24	40
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819131055	DD	On-Demand	Anodyne	ADRB3	49	54
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819131056	DD	On-Demand	Anodyne	ADRB2	46	57
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819131056	DD	On-Demand	Anodyne	ADRB1	80	57
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819131056	DD	On-Demand	Anodyne	GRIN1	24	40
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819131056	DD	On-Demand	Anodyne	ADRB3	49	54
Cc1ccc(NCCCNC[C@H](O)c2cccc3ccccc23)nc1	ZINC000819131057	EH	On-Demand	Anodyne	METG	72	36
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819131077	DD	On-Demand	Anodyne	ADRB2	44	47
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819131077	DD	On-Demand	Anodyne	ADRB1	72	47
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819131077	DD	On-Demand	Anodyne	GRIN1	21	40
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819131077	DD	On-Demand	Anodyne	ADRB3	48	47
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ccon2)cc1	ZINC000819131077	DD	On-Demand	Anodyne	ABCB1	17	42
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819131078	DD	On-Demand	Anodyne	ADRB2	44	47
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819131078	DD	On-Demand	Anodyne	ADRB1	72	47
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819131078	DD	On-Demand	Anodyne	GRIN1	21	40
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819131078	DD	On-Demand	Anodyne	ADRB3	48	47
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ccon2)cc1	ZINC000819131078	DD	On-Demand	Anodyne	ABCB1	17	42
COC(=O)c1ccc(CCNC(=O)c2ccc(S(=O)(=O)N(C)OC)cc2)cc1	ZINC000819131079	HD	On-Demand	Anodyne	CA2	39	55
COC(=O)c1ccc(CCNC(=O)c2ccc(S(=O)(=O)N(C)OC)cc2)cc1	ZINC000819131079	HD	On-Demand	Anodyne	BMP1	24	43
COC(=O)c1ccc(CCNC(=O)c2ccc(S(=O)(=O)N(C)OC)cc2)cc1	ZINC000819131079	HD	On-Demand	Anodyne	CA1	31	55
COC(=O)c1ccc(CCNC(=O)c2ccc(S(=O)(=O)N(C)OC)cc2)cc1	ZINC000819131079	HD	On-Demand	Anodyne	CA7	15	50
COC(=O)c1ccc(CCNC(=O)c2ccc(S(=O)(=O)N(C)OC)cc2)cc1	ZINC000819131079	HD	On-Demand	Anodyne	CA4	18	55
COC(=O)c1ccc(CCNC(=O)c2ccc(S(=O)(=O)N(C)OC)cc2)cc1	ZINC000819131079	HD	On-Demand	Anodyne	CA14	17	50
COC(=O)c1ccc(CCNC(=O)c2ccc(S(=O)(=O)N(C)OC)cc2)cc1	ZINC000819131079	HD	On-Demand	Anodyne	CA12	16	55
COC(=O)c1ccc(CCNC(=O)c2ccc(S(=O)(=O)N(C)OC)cc2)cc1	ZINC000819131079	HD	On-Demand	Anodyne	CA9	21	55
COC(=O)c1ccc(CCNC(=O)c2ccc(S(=O)(=O)N(C)OC)cc2)cc1	ZINC000819131079	HD	On-Demand	Anodyne	CYNT	21	52
COC(=O)c1ccc(CCNC(=O)c2ccc(S(=O)(=O)N(C)OC)cc2)cc1	ZINC000819131079	HD	On-Demand	Anodyne	A6YCJ1_9METZ	17	55
O=C(Nc1ccc(Cl)cn1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819131091	FG	On-Demand	Anodyne	F10	26	48
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2F)cc1	ZINC000819131127	DE	On-Demand	Anodyne	ADRB2	44	51
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2F)cc1	ZINC000819131127	DE	On-Demand	Anodyne	ADRB1	70	41
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2F)cc1	ZINC000819131127	DE	On-Demand	Anodyne	ADRB3	27	42
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2F)cc1	ZINC000819131127	DE	On-Demand	Anodyne	ABCB1	18	42
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2F)cc1	ZINC000819131130	DE	On-Demand	Anodyne	ADRB2	44	51
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2F)cc1	ZINC000819131130	DE	On-Demand	Anodyne	ADRB1	70	41
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2F)cc1	ZINC000819131130	DE	On-Demand	Anodyne	ADRB3	27	42
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2F)cc1	ZINC000819131130	DE	On-Demand	Anodyne	ABCB1	18	42
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819131141	EF	On-Demand	Anodyne	ADRB2	56	51
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819131141	EF	On-Demand	Anodyne	ADRB1	77	51
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819131141	EF	On-Demand	Anodyne	GRIN1	27	52
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819131141	EF	On-Demand	Anodyne	ADRB3	52	47
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819131142	EF	On-Demand	Anodyne	ADRB2	56	51
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819131142	EF	On-Demand	Anodyne	ADRB1	77	51
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819131142	EF	On-Demand	Anodyne	GRIN1	27	52
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819131142	EF	On-Demand	Anodyne	ADRB3	52	47
C[C@H](O)c1ccc(CNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819131144	DG	On-Demand	Anodyne	ADRB2	19	54
C[C@H](O)c1ccc(CNCCC(=O)Nc2cccnc2)cc1	ZINC000819131177	CE	On-Demand	Anodyne	ADRB3	44	42
C[C@H](O)c1ccc(CNCCC(=O)Nc2cccnc2)cc1	ZINC000819131177	CE	On-Demand	Anodyne	NAMPT	34	41
C[C@H](O)c1ccc(CNCCC(N)=O)cc1	ZINC000819131179	BC	On-Demand	Anodyne	LEF	48	34
COc1cccc(C(NC[C@H](O)C2CC2)c2cccc(OC)c2)c1	ZINC000819131184	EG	On-Demand	Anodyne	MTNR1A	21	42
COc1cccc(C(NC[C@H](O)C2CC2)c2cccc(OC)c2)c1	ZINC000819131184	EG	On-Demand	Anodyne	MTNR1B	25	42
COc1cccc(C(NC[C@@H](O)C2CC2)c2cccc(OC)c2)c1	ZINC000819131185	EG	On-Demand	Anodyne	MTNR1A	21	42
COc1cccc(C(NC[C@@H](O)C2CC2)c2cccc(OC)c2)c1	ZINC000819131185	EG	On-Demand	Anodyne	MTNR1B	25	42
COC(=O)Nc1cccc(NC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)c1	ZINC000819131186	FI	On-Demand	Anodyne	KCNK3	80	38
COC(=O)Nc1cccc(NC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)c1	ZINC000819131186	FI	On-Demand	Anodyne	KCNK9	65	38
C[C@H](O)c1ccc(CNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819131214	DF	On-Demand	Anodyne	LEF	51	36
C[C@H](O)c1ccc(CNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819131216	DF	On-Demand	Anodyne	LEF	51	36
C[C@H](O)c1ccc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819131232	ED	On-Demand	Anodyne	ADRB2	15	42
C[C@H](O)c1ccc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819131233	ED	On-Demand	Anodyne	ADRB2	15	42
O=C1C[C@H](NC[C@@H](O)c2ccccc2)CN1C1CC1	ZINC000819131240	CD	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C1C[C@H](NC[C@H](O)c2ccccc2)CN1C1CC1	ZINC000819131241	CD	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C1C[C@@H](NC[C@H](O)c2ccccc2)CN1C1CC1	ZINC000819131242	CD	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C1C[C@@H](NC[C@@H](O)c2ccccc2)CN1C1CC1	ZINC000819131243	CD	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C1C[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)CN1C1CC1	ZINC000819131254	DD	On-Demand	Anodyne	ADRB3	19	40
O=C1C[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)CN1C1CC1	ZINC000819131255	DD	On-Demand	Anodyne	ADRB3	19	40
O=C1C[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)CN1C1CC1	ZINC000819131256	DD	On-Demand	Anodyne	ADRB3	19	40
O=C1C[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)CN1C1CC1	ZINC000819131257	DD	On-Demand	Anodyne	ADRB3	19	40
COC[C@@H](O)CNCc1ccc([C@H](C)O)cc1	ZINC000819131265	BC	On-Demand	Anodyne	ADRB2	25	42
COC[C@@H](O)CNCc1ccc([C@H](C)O)cc1	ZINC000819131265	BC	On-Demand	Anodyne	ADRB1	22	42
COC[C@@H](O)CNCc1ccc([C@@H](C)O)cc1	ZINC000819131267	BC	On-Demand	Anodyne	ADRB2	25	42
COC[C@@H](O)CNCc1ccc([C@@H](C)O)cc1	ZINC000819131267	BC	On-Demand	Anodyne	ADRB1	22	42
C[C@H](O)c1ccc(CNCCC(=O)Nc2cccc(Br)c2)cc1	ZINC000819131273	GH	On-Demand	Anodyne	EGFR	23	42
C[C@H](O)c1ccc(CNCCC(=O)Nc2cccc(Br)c2)cc1	ZINC000819131273	GH	On-Demand	Anodyne	HDAC10	17	40
C[C@H](O)c1ccc(CNCCC(=O)Nc2cccc(Br)c2)cc1	ZINC000819131273	GH	On-Demand	Anodyne	LEF	43	30
C[C@H](O)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819131274	CE	On-Demand	Anodyne	ADRB2	20	41
C[C@H](O)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819131274	CE	On-Demand	Anodyne	MME	46	34
C[C@H](O)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819131276	CE	On-Demand	Anodyne	ADRB2	20	41
C[C@H](O)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819131276	CE	On-Demand	Anodyne	MME	46	34
O=C1C[C@H](NC[C@H](O)c2cccnc2)CN1C1CC1	ZINC000819131283	CC	On-Demand	Anodyne	ADRB3	77	49
O=C1C[C@@H](NC[C@@H](O)c2cccnc2)CN1C1CC1	ZINC000819131284	CC	On-Demand	Anodyne	ADRB3	77	49
O=C1C[C@H](NC[C@@H](O)c2cccnc2)CN1C1CC1	ZINC000819131285	CC	On-Demand	Anodyne	ADRB3	77	49
O=C1C[C@@H](NC[C@H](O)c2cccnc2)CN1C1CC1	ZINC000819131286	CC	On-Demand	Anodyne	ADRB3	77	49
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819131293	GE	On-Demand	Clean	PRKDC	16	41
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819131293	GE	On-Demand	Clean	NPY2R	73	35
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819131293	GE	On-Demand	Clean	EPHX2	18	45
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819131293	GE	On-Demand	Clean	PIK3CB	29	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1CCc1ccccc1)C2	ZINC000819131294	FG	On-Demand	Anodyne	FKBP1A	47	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1CCc1ccccc1)C2	ZINC000819131294	FG	On-Demand	Anodyne	SLC18A2	45	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1CCc1ccccc1)C2	ZINC000819131294	FG	On-Demand	Anodyne	PREP	78	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H]1CCc1ccccc1)C2	ZINC000819131295	FG	On-Demand	Anodyne	FKBP1A	47	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H]1CCc1ccccc1)C2	ZINC000819131295	FG	On-Demand	Anodyne	SLC18A2	45	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H]1CCc1ccccc1)C2	ZINC000819131295	FG	On-Demand	Anodyne	PREP	78	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1CCc1ccccc1)C2	ZINC000819131296	FG	On-Demand	Anodyne	FKBP1A	47	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1CCc1ccccc1)C2	ZINC000819131296	FG	On-Demand	Anodyne	SLC18A2	45	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1CCc1ccccc1)C2	ZINC000819131296	FG	On-Demand	Anodyne	PREP	78	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H]1CCc1ccccc1)C2	ZINC000819131297	FG	On-Demand	Anodyne	FKBP1A	47	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H]1CCc1ccccc1)C2	ZINC000819131297	FG	On-Demand	Anodyne	SLC18A2	45	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H]1CCc1ccccc1)C2	ZINC000819131297	FG	On-Demand	Anodyne	PREP	78	37
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819131300	FH	On-Demand	Anodyne	ADRB2	51	50
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819131300	FH	On-Demand	Anodyne	ADRB1	67	50
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819131300	FH	On-Demand	Anodyne	ADRB3	44	46
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819131301	FH	On-Demand	Anodyne	ADRB2	51	50
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819131301	FH	On-Demand	Anodyne	ADRB1	67	50
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819131301	FH	On-Demand	Anodyne	ADRB3	44	46
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)cc1	ZINC000819131304	GH	On-Demand	Anodyne	ADRB2	73	58
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)cc1	ZINC000819131304	GH	On-Demand	Anodyne	ADRB1	99	49
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)cc1	ZINC000819131304	GH	On-Demand	Anodyne	ADRB3	74	46
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)cc1	ZINC000819131304	GH	On-Demand	Anodyne	ABCB1	15	46
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)cc1	ZINC000819131306	GH	On-Demand	Anodyne	ADRB2	73	58
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)cc1	ZINC000819131306	GH	On-Demand	Anodyne	ADRB1	99	49
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)cc1	ZINC000819131306	GH	On-Demand	Anodyne	ADRB3	74	46
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)cc1	ZINC000819131306	GH	On-Demand	Anodyne	ABCB1	15	46
Cc1ncsc1-c1nc2ccccc2n1CC(=O)NNC(=O)CC1CC1	ZINC000819131320	FE	On-Demand	Reactive	IMDH_CRYPV	40	43
O=C(CC1CC1)NNC(=O)c1cc(-c2ccncc2)nc2ccc(Br)cc12	ZINC000819131322	IH	On-Demand	Reactive	PRS	87	50
O=C(CC1CC1)NNC(=O)c1cc2c(ccc3ccccc32)[nH]1	ZINC000819131324	DF	On-Demand	Reactive	PYGL	52	35
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1	ZINC000819131337	FD	On-Demand	Reactive	FKBP1A	15	42
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1	ZINC000819131337	FD	On-Demand	Reactive	MMP13	15	43
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1	ZINC000819131337	FD	On-Demand	Reactive	MMP7	20	43
O=C(CC1CC1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1	ZINC000819131337	FD	On-Demand	Reactive	MMP1	18	43
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccs1	ZINC000819131338	FD	On-Demand	Reactive	FKBP1A	15	42
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccs1	ZINC000819131338	FD	On-Demand	Reactive	MMP13	15	43
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccs1	ZINC000819131338	FD	On-Demand	Reactive	MMP7	20	43
O=C(CC1CC1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccs1	ZINC000819131338	FD	On-Demand	Reactive	MMP1	18	43
O=C(CNS(=O)(=O)c1c[nH]c2ncccc12)NNC(=O)CC1CC1	ZINC000819131343	FB	On-Demand	Reactive	CDC7	40	36
O=C(CC1CC1)NNC(=O)c1cc2ccccc2n1Cc1ccccc1F	ZINC000819131344	FG	On-Demand	Reactive	ECE1	18	49
O=C(CC1CC1)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819131347	GD	On-Demand	Reactive	CNR2	16	50
O=C(CC1CC1)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819131347	GD	On-Demand	Reactive	EPHX2	29	41
O=C(CC1CC1)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819131347	GD	On-Demand	Reactive	CACNA1I	45	33
COC(=O)c1cn(CC(=O)NNC(=O)CC2CC2)c2ccccc12	ZINC000819131353	ED	On-Demand	Reactive	CNR1	24	42
COC(=O)c1cn(CC(=O)NNC(=O)CC2CC2)c2ccccc12	ZINC000819131353	ED	On-Demand	Reactive	CNR2	35	42
Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)CC2CC2)CC1	ZINC000819131357	GC	On-Demand	Reactive	EPHX2	33	43
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819131363	GE	On-Demand	Reactive	PGC	45	30
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819131363	GE	On-Demand	Reactive	REN	48	40
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CC1CC1	ZINC000819131363	GE	On-Demand	Reactive	FPR1	44	38
O=C(CC1CC1)NNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1	ZINC000819131364	ED	On-Demand	Reactive	PDE4D	15	41
C[C@H]1CCCCN1CCOc1ccccc1C(=O)NNC(=O)CC1CC1	ZINC000819131368	FF	On-Demand	Reactive	HCN1	73	37
C[C@H]1CCCCN1CCOc1ccccc1C(=O)NNC(=O)CC1CC1	ZINC000819131368	FF	On-Demand	Reactive	HCN4	55	37
C[C@@H]1CCCCN1CCOc1ccccc1C(=O)NNC(=O)CC1CC1	ZINC000819131369	FF	On-Demand	Reactive	HCN1	73	37
C[C@@H]1CCCCN1CCOc1ccccc1C(=O)NNC(=O)CC1CC1	ZINC000819131369	FF	On-Demand	Reactive	HCN4	55	37
O=C(CNC(=O)NCc1ccc(F)cc1)NNC(=O)CC1CC1	ZINC000819131372	DC	On-Demand	Reactive	CCR3	18	46
O=C(CNC(=O)NCc1ccc(F)cc1)NNC(=O)CC1CC1	ZINC000819131372	DC	On-Demand	Reactive	TPSAB1	16	40
O=C(CCCCC(=O)c1ccccc1)NNC(=O)CC1CC1	ZINC000819131374	DE	On-Demand	Reactive	HDAC8	40	48
O=C(CCCCC(=O)c1ccccc1)NNC(=O)CC1CC1	ZINC000819131374	DE	On-Demand	Reactive	HDAC1	16	56
O=C(CCCCC(=O)c1ccccc1)NNC(=O)CC1CC1	ZINC000819131374	DE	On-Demand	Reactive	CYP2J2	49	34
O=C(COc1ccc(C(=O)c2ccccc2)cc1)NNC(=O)CC1CC1	ZINC000819131381	FE	On-Demand	Reactive	GRIN2B	26	44
O=C(COc1ccc(C(=O)c2ccccc2)cc1)NNC(=O)CC1CC1	ZINC000819131381	FE	On-Demand	Reactive	PLA2G4B	41	35
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1c1ccccc1	ZINC000819131387	CD	On-Demand	Reactive	PREP	65	38
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819131388	CD	On-Demand	Reactive	PREP	65	38
O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)NNC(=O)CC1CC1	ZINC000819131390	HE	On-Demand	Reactive	EPHX2	18	44
O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)NNC(=O)CC1CC1	ZINC000819131390	HE	On-Demand	Reactive	TGM2	74	39
O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)NNC(=O)CC1CC1	ZINC000819131390	HE	On-Demand	Reactive	F13A1	73	40
O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)NNC(=O)CC1CC1	ZINC000819131390	HE	On-Demand	Reactive	NAMPT	42	43
O=C(CC1CC1)NNC(=O)c1cc(OCc2ccccc2)ccc1O	ZINC000819131414	EF	On-Demand	Reactive	MAOB	30	44
O=C(CC1CC1)NNC(=O)c1cc(OCc2ccccc2)ccc1O	ZINC000819131414	EF	On-Demand	Reactive	LTA4H	18	41
O=C(CC1CC1)NNC(=O)c1cc(OCc2ccccc2)ccc1O	ZINC000819131414	EF	On-Demand	Reactive	FFAR1	43	37
O=C(CC1CC1)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1	ZINC000819131420	GE	On-Demand	Reactive	ST14	41	37
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	ZINC000819131430	GD	On-Demand	Reactive	MAP1	59	34
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	ZINC000819131430	GD	On-Demand	Reactive	GCK	23	41
O=C(CCCNC(=O)OCc1ccccc1)NNC(=O)CC1CC1	ZINC000819131438	ED	On-Demand	Reactive	KLK3	62	34
O=C(CCCNC(=O)OCc1ccccc1)NNC(=O)CC1CC1	ZINC000819131438	ED	On-Demand	Reactive	CTSB	37	42
O=C(CCCNC(=O)OCc1ccccc1)NNC(=O)CC1CC1	ZINC000819131438	ED	On-Demand	Reactive	CTSK	29	42
O=C(CCCNC(=O)OCc1ccccc1)NNC(=O)CC1CC1	ZINC000819131438	ED	On-Demand	Reactive	CTSL	33	42
O=C(CCCNC(=O)OCc1ccccc1)NNC(=O)CC1CC1	ZINC000819131438	ED	On-Demand	Reactive	PREP	24	45
O=C(CCCNC(=O)OCc1ccccc1)NNC(=O)CC1CC1	ZINC000819131438	ED	On-Demand	Reactive	CAPNS1	52	32
O=C(CCCNC(=O)OCc1ccccc1)NNC(=O)CC1CC1	ZINC000819131438	ED	On-Demand	Reactive	HDAC2	15	50
O=C(CCCNC(=O)OCc1ccccc1)NNC(=O)CC1CC1	ZINC000819131438	ED	On-Demand	Reactive	CAPN1	56	47
O=C(CCCNC(=O)OCc1ccccc1)NNC(=O)CC1CC1	ZINC000819131438	ED	On-Demand	Reactive	CAPN2	89	47
O=C(CCCNC(=O)OCc1ccccc1)NNC(=O)CC1CC1	ZINC000819131438	ED	On-Demand	Reactive	TGM2	36	40
O=C(CCCNC(=O)OCc1ccccc1)NNC(=O)CC1CC1	ZINC000819131438	ED	On-Demand	Reactive	KLK5	38	40
O=C(CCCNC(=O)OCc1ccccc1)NNC(=O)CC1CC1	ZINC000819131438	ED	On-Demand	Reactive	NPR	63	38
O=C(CCCNC(=O)OCc1ccccc1)NNC(=O)CC1CC1	ZINC000819131438	ED	On-Demand	Reactive	F13A1	25	40
O=C(CCCNC(=O)OCc1ccccc1)NNC(=O)CC1CC1	ZINC000819131438	ED	On-Demand	Reactive	NAAA	30	41
O=C(CCCNC(=O)OCc1ccccc1)NNC(=O)CC1CC1	ZINC000819131438	ED	On-Demand	Reactive	POLG_WNV	42	38
O=C(CC1CC1)NNC(=O)CC1CCC(c2ccccc2)CC1	ZINC000819131439	DG	On-Demand	Reactive	GRIN2B	22	46
O=C(CC1CC1)NNC(=O)CC1CCC(c2ccccc2)CC1	ZINC000819131439	DG	On-Demand	Reactive	SIGMAR1	17	41
O=C(CC1CC1)NNC(=O)CC1CCC(c2ccccc2)CC1	ZINC000819131439	DG	On-Demand	Reactive	CCR1	16	40
O=C(CC1CC1)NNC(=O)CC1CCC(c2ccccc2)CC1	ZINC000819131439	DG	On-Demand	Reactive	SLC18A3	45	39
O=C(CC1CC1)NNC(=O)CC1CCC(c2ccccc2)CC1	ZINC000819131439	DG	On-Demand	Reactive	DGAT1	57	43
CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1C(=O)NNC(=O)CC1CC1	ZINC000819131456	FE	On-Demand	Reactive	GHSR	18	49
CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1C(=O)NNC(=O)CC1CC1	ZINC000819131457	FE	On-Demand	Reactive	GHSR	18	49
O=C(COc1cccc(NC(=O)C2CC2)c1)NNC(=O)CC1CC1	ZINC000819131461	ED	On-Demand	Reactive	EPHX2	25	47
O=C(COc1cccc(NC(=O)C2CC2)c1)NNC(=O)CC1CC1	ZINC000819131461	ED	On-Demand	Reactive	TYK2	45	37
O=C(COc1cccc(NC(=O)C2CC2)c1)NNC(=O)CC1CC1	ZINC000819131461	ED	On-Demand	Reactive	KCNK3	15	40
Cc1cc(C)cc(C(=O)N2CCCC[C@H]2C(=O)NNC(=O)CC2CC2)c1	ZINC000819131466	FE	On-Demand	Reactive	PREP	46	40
Cc1cc(C)cc(C(=O)N2CCCC[C@H]2C(=O)NNC(=O)CC2CC2)c1	ZINC000819131466	FE	On-Demand	Reactive	LGMN	58	35
Cc1cc(C)cc(C(=O)N2CCCC[C@@H]2C(=O)NNC(=O)CC2CC2)c1	ZINC000819131469	FE	On-Demand	Reactive	PREP	46	40
Cc1cc(C)cc(C(=O)N2CCCC[C@@H]2C(=O)NNC(=O)CC2CC2)c1	ZINC000819131469	FE	On-Demand	Reactive	LGMN	58	35
O=C(CC1CC1)NNC(=O)c1cc2ccc(OCc3ccccc3)cc2[nH]1	ZINC000819131472	FG	On-Demand	Reactive	MAOB	19	41
O=C(CC1CC1)NNC(=O)c1cc2ccc(OCc3ccccc3)cc2[nH]1	ZINC000819131472	FG	On-Demand	Reactive	GRIN2B	51	46
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	ZINC000819131484	HD	On-Demand	Reactive	EPHX2	39	45
CCCCCCn1nc(C(=O)NNC(=O)CC2CC2)c2ccccc2c1=O	ZINC000819131486	FF	On-Demand	Reactive	CNR2	20	43
C[C@H](O)c1ccc(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819131488	EH	On-Demand	Anodyne	ADRB2	15	40
C[C@H](O)c1ccc(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819131492	EH	On-Demand	Anodyne	ADRB2	15	40
O=C(CC1CC1)NNC(=O)c1cccc(N2CCCS2(=O)=O)c1	ZINC000819131501	EC	On-Demand	Reactive	CDK1	17	40
COC(=O)c1ccc(CCNC(=O)c2ccc(SC(F)(F)F)cc2)cc1	ZINC000819131502	GI	On-Demand	Anodyne	GCGR	21	43
C[C@H](O)c1ccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819131515	FG	On-Demand	Anodyne	ADRB3	18	45
C[C@H](O)c1ccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819131518	FG	On-Demand	Anodyne	ADRB3	18	45
C[C@H](O)c1ccc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819131523	GF	On-Demand	Anodyne	GPR119	51	51
C[C@H](O)c1ccc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819131525	GF	On-Demand	Anodyne	GPR119	51	51
O=C(CC1CC1)NNC(=O)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1O	ZINC000819131536	ID	On-Demand	Reactive	HSD17B1	17	44
CC(C)(C)OC(=O)N1CCC(SCC(=O)NNC(=O)CC2CC2)CC1	ZINC000819131541	FE	On-Demand	Reactive	GPR119	41	41
CCNC(=O)CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819131552	ED	On-Demand	Mild	PAPA1_CARPA	39	49
CCNC(=O)CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819131552	ED	On-Demand	Mild	CTSK	15	44
CCNC(=O)CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819131554	ED	On-Demand	Mild	PAPA1_CARPA	39	49
CCNC(=O)CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819131554	ED	On-Demand	Mild	CTSK	15	44
C[C@H](O)c1ccc(CNC[C@@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819131564	EH	On-Demand	Anodyne	ADRB2	20	49
C[C@H](O)c1ccc(CNC[C@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819131566	EH	On-Demand	Anodyne	ADRB2	20	49
CCOC[C@H](O)CNCc1ccc([C@@H](C)O)cc1	ZINC000819131571	CD	On-Demand	Anodyne	ADRB2	18	40
CCOC[C@H](O)CNCc1ccc([C@H](C)O)cc1	ZINC000819131574	CD	On-Demand	Anodyne	ADRB2	18	40
O=C(CC1CC1)NNC(=O)c1ccccc1SCC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000819131576	IG	On-Demand	Reactive	CNR2	24	40
O=C(CC1CC1)NNC(=O)c1ccccc1SCC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000819131576	IG	On-Demand	Reactive	EPHX2	51	45
COC(=O)Nc1cccc(NC(=O)C2(c3ccc(C)cc3)CCC2)c1	ZINC000819131590	EI	On-Demand	Anodyne	KCNK3	79	37
COC(=O)Nc1cccc(NC(=O)C2(c3ccc(C)cc3)CCC2)c1	ZINC000819131590	EI	On-Demand	Anodyne	KCNK9	62	37
C[C@H](O)c1ccc(CNCCC(=O)Nc2ccc(Br)cc2)cc1	ZINC000819131604	GH	On-Demand	Anodyne	LEF	40	32
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819131605	EF	On-Demand	Anodyne	ADRB2	45	53
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819131605	EF	On-Demand	Anodyne	ADRB1	65	36
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819131605	EF	On-Demand	Anodyne	ADRB3	32	42
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819131605	EF	On-Demand	Anodyne	CASR	30	40
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819131605	EF	On-Demand	Anodyne	ABCB1	25	42
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819131608	EF	On-Demand	Anodyne	ADRB2	45	53
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819131608	EF	On-Demand	Anodyne	ADRB1	65	36
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819131608	EF	On-Demand	Anodyne	ADRB3	32	42
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819131608	EF	On-Demand	Anodyne	CASR	30	40
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819131608	EF	On-Demand	Anodyne	ABCB1	25	42
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)NNC(=O)CC1CC1	ZINC000819131618	GG	On-Demand	Reactive	PGC	46	32
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)NNC(=O)CC1CC1	ZINC000819131618	GG	On-Demand	Reactive	PAPA1_CARPA	31	40
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)NNC(=O)CC1CC1	ZINC000819131618	GG	On-Demand	Reactive	CTSK	15	47
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)NNC(=O)CC1CC1	ZINC000819131618	GG	On-Demand	Reactive	REN	55	41
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)NNC(=O)CC1CC1	ZINC000819131618	GG	On-Demand	Reactive	FPR1	47	39
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)c1	ZINC000819131639	HD	On-Demand	Reactive	EPHX2	40	53
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)c1	ZINC000819131639	HD	On-Demand	Reactive	ST14	44	32
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)c1	ZINC000819131639	HD	On-Demand	Reactive	AKR1C3	62	40
O=C(CC1CC1)NNC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1-n1cccc1	ZINC000819131641	HG	On-Demand	Reactive	CCR2	44	35
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)CC3CC3)cc2)cc1	ZINC000819131645	HE	On-Demand	Reactive	LIMK2	29	42
O=C(CC1CC1)NNC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819131646	FG	On-Demand	Reactive	F10	39	52
O=C(CC1CC1)NNC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819131646	FG	On-Demand	Reactive	NR1H4	15	42
O=C(CC1CC1)NNC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819131646	FG	On-Demand	Reactive	HDAC1	36	45
O=C(CC1CC1)NNC(=O)c1ccccc1CCc1ccccc1	ZINC000819131660	DG	On-Demand	Reactive	SLC6A5	29	40
C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)NNC(=O)CC1CC1	ZINC000819131663	EF	On-Demand	Reactive	CACNA1I	46	37
O=C(CC1CC1)NNC(=O)c1ccn(Cc2ccccc2)n1	ZINC000819131671	CD	On-Demand	Reactive	SIGMAR1	24	44
O=C(CC1CC1)NNC(=O)c1cccc(C(=O)Nc2ccccc2)c1	ZINC000819131688	EF	On-Demand	Reactive	MAPK14	15	48
O=C(CC1CC1)NNC(=O)c1cccc(C(=O)Nc2ccccc2)c1	ZINC000819131688	EF	On-Demand	Reactive	PRNP	32	44
O=C(CC1CC1)NNC(=O)c1cccc(C(=O)Nc2ccccc2)c1	ZINC000819131688	EF	On-Demand	Reactive	PLAU	15	46
O=C(CC1CC1)NNC(=O)c1cccc(C(=O)Nc2ccccc2)c1	ZINC000819131688	EF	On-Demand	Reactive	TAAR1	35	43
O=C(CC1CC1)NNC(=O)c1cccc(C(=O)Nc2ccccc2)c1	ZINC000819131688	EF	On-Demand	Reactive	DGAT1	37	43
O=C(CC1CC1)NNC(=O)c1cccc(C(=O)Nc2ccccc2)c1	ZINC000819131688	EF	On-Demand	Reactive	KCNK3	118	46
O=C(CC1CC1)NNC(=O)c1cccc(C(=O)Nc2ccccc2)c1	ZINC000819131688	EF	On-Demand	Reactive	KCNK9	62	45
O=C(CS[C@@H](c1ccccc1)c1ccc(Cl)cc1)NNC(=O)CC1CC1	ZINC000819131698	GI	On-Demand	Reactive	SLC6A3	16	53
O=C(CS[C@H](c1ccccc1)c1ccc(Cl)cc1)NNC(=O)CC1CC1	ZINC000819131699	GI	On-Demand	Reactive	SLC6A3	16	53
O=C(CC1CC1)NNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1	ZINC000819131700	FF	On-Demand	Reactive	TAAR1	22	52
O=C(CC1CC1)NNC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1	ZINC000819131700	FF	On-Demand	Reactive	AKR1C3	18	44
O=C(Cc1csc(NC(=O)Cc2cccs2)n1)NNC(=O)CC1CC1	ZINC000819131708	GD	On-Demand	Reactive	CA5B	31	43
O=C(Cc1csc(NC(=O)Cc2cccs2)n1)NNC(=O)CC1CC1	ZINC000819131708	GD	On-Demand	Reactive	CA5A	31	43
N#Cc1cc(Cl)c(C(=O)NNC(=O)CC2CC2)c(Cl)c1	ZINC000819131709	DE	On-Demand	Reactive	TYK2	24	45
O=C(CC1CC1)NNC(=O)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl	ZINC000819131723	HD	On-Demand	Reactive	CCR8	63	34
O=C(CC1CC1)NNC(=O)c1ccccc1COc1ccccc1	ZINC000819131733	DF	On-Demand	Reactive	OPRL1	16	41
O=C(CC1CC1)NNC(=O)c1ccccc1COc1ccccc1	ZINC000819131733	DF	On-Demand	Reactive	GRIN2B	25	43
O=C(CC1CC1)NNC(=O)c1nc(-c2ccccc2)oc1-c1ccccc1	ZINC000819131737	FH	On-Demand	Reactive	PDE8B	51	32
O=C(CC1CC1)NNC(=O)c1nc(-c2ccccc2)oc1-c1ccccc1	ZINC000819131737	FH	On-Demand	Reactive	VCP	40	36
O=C(CC1CC1)NNC(=O)c1ccc(N2CCCc3ccccc32)cc1	ZINC000819131738	EG	On-Demand	Reactive	AVPR2	34	42
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)Cc2ccc(Br)cc2)c1	ZINC000819131746	IG	On-Demand	Reactive	KCNK3	64	33
O=C(CC1CC1)NNC(=O)[C@@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1	ZINC000819131766	HG	On-Demand	Reactive	P2RX7	27	44
O=C(CC1CC1)NNC(=O)[C@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1	ZINC000819131767	HG	On-Demand	Reactive	P2RX7	27	44
O=C(CC1CC1)NNC(=O)[C@@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1	ZINC000819131768	HG	On-Demand	Reactive	P2RX7	27	44
O=C(CC1CC1)NNC(=O)[C@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1	ZINC000819131769	HG	On-Demand	Reactive	P2RX7	27	44
O=C(CC1CC1)NNC(=O)c1cc(-c2nc3ccccc3s2)nc2ccccc12	ZINC000819131775	HI	On-Demand	Reactive	ACACB	15	46
O=C(CC1CC1)NNC(=O)c1cc(-c2nc3ccccc3s2)nc2ccccc12	ZINC000819131775	HI	On-Demand	Reactive	TACR3	20	43
O=C(CC1CC1)NNC(=O)c1ccccc1N1CCCCC1	ZINC000819131784	DE	On-Demand	Reactive	KCNQ2	71	41
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1O	ZINC000819131787	HH	On-Demand	Reactive	MAOB	19	42
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819131789	IE	On-Demand	Reactive	CACNA1B	61	42
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819131789	IE	On-Demand	Reactive	BDKRB1	26	47
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819131789	IE	On-Demand	Reactive	CCR2	63	38
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819131789	IE	On-Demand	Reactive	EPHX2	44	52
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819131789	IE	On-Demand	Reactive	PKM	15	47
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819131789	IE	On-Demand	Reactive	AKR1C3	52	35
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819131789	IE	On-Demand	Reactive	SFRP1	86	42
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819131789	IE	On-Demand	Reactive	WNT3	42	31
O=C(CC1CC1)NNC(=O)C1(c2ccc(Cl)cc2)CCCCC1	ZINC000819131790	EG	On-Demand	Reactive	AVPR1A	35	43
Cc1cccc(C(=O)NNC(=O)CC2CC2)c1NC(=O)c1ccccc1F	ZINC000819131793	FF	On-Demand	Reactive	CCR8	49	32
C[C@@H](CC(=O)NNC(=O)CC1CC1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819131798	FF	On-Demand	Reactive	GPR119	18	40
C[C@H](CC(=O)NNC(=O)CC1CC1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819131799	FF	On-Demand	Reactive	GPR119	18	40
C[C@H](CC(=O)NNC(=O)CC1CC1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819131800	FF	On-Demand	Reactive	GPR119	18	40
C[C@@H](CC(=O)NNC(=O)CC1CC1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819131801	FF	On-Demand	Reactive	GPR119	18	40
O=C(CC1CC1)NNC(=O)c1cc(=O)c2cc(Br)ccc2[nH]1	ZINC000819131809	FD	On-Demand	Reactive	PYK	51	33
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819131856	EE	On-Demand	Anodyne	ADRB2	54	48
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819131856	EE	On-Demand	Anodyne	ADRB1	85	48
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819131856	EE	On-Demand	Anodyne	GRIN1	15	40
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819131856	EE	On-Demand	Anodyne	ADRB3	58	47
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819131856	EE	On-Demand	Anodyne	ABCB1	18	58
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819131857	EE	On-Demand	Anodyne	ADRB2	54	48
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819131857	EE	On-Demand	Anodyne	ADRB1	85	48
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819131857	EE	On-Demand	Anodyne	GRIN1	15	40
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819131857	EE	On-Demand	Anodyne	ADRB3	58	47
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819131857	EE	On-Demand	Anodyne	ABCB1	18	58
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819131858	EE	On-Demand	Anodyne	ADRB2	54	48
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819131858	EE	On-Demand	Anodyne	ADRB1	85	48
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819131858	EE	On-Demand	Anodyne	GRIN1	15	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819131858	EE	On-Demand	Anodyne	ADRB3	58	47
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819131858	EE	On-Demand	Anodyne	ABCB1	18	58
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819131859	EE	On-Demand	Anodyne	ADRB2	54	48
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819131859	EE	On-Demand	Anodyne	ADRB1	85	48
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819131859	EE	On-Demand	Anodyne	GRIN1	15	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819131859	EE	On-Demand	Anodyne	ADRB3	58	47
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819131859	EE	On-Demand	Anodyne	ABCB1	18	58
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H]1CCc1ccccc1	ZINC000819131872	CG	On-Demand	Anodyne	SLC18A2	54	42
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H]1CCc1ccccc1	ZINC000819131872	CG	On-Demand	Anodyne	PREP	80	38
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H]1CCc1ccccc1	ZINC000819131873	CG	On-Demand	Anodyne	SLC18A2	54	42
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H]1CCc1ccccc1	ZINC000819131873	CG	On-Demand	Anodyne	PREP	80	38
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H]1CCc1ccccc1	ZINC000819131874	CG	On-Demand	Anodyne	SLC18A2	54	42
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H]1CCc1ccccc1	ZINC000819131874	CG	On-Demand	Anodyne	PREP	80	38
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H]1CCc1ccccc1	ZINC000819131875	CG	On-Demand	Anodyne	SLC18A2	54	42
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H]1CCc1ccccc1	ZINC000819131875	CG	On-Demand	Anodyne	PREP	80	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1cccc(OC)c1OC)C2	ZINC000819131893	GE	On-Demand	Anodyne	NQO2	24	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1cccc(OC)c1OC)C2	ZINC000819131893	GE	On-Demand	Anodyne	MTNR1A	41	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1cccc(OC)c1OC)C2	ZINC000819131894	GE	On-Demand	Anodyne	NQO2	24	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1cccc(OC)c1OC)C2	ZINC000819131894	GE	On-Demand	Anodyne	MTNR1A	41	42
O=C1C[C@H](NC[C@@H](O)c2ccc(F)cc2)CN1C1CC1	ZINC000819131911	CD	On-Demand	Anodyne	SLC6A3	24	46
O=C1C[C@H](NC[C@H](O)c2ccc(F)cc2)CN1C1CC1	ZINC000819131913	CD	On-Demand	Anodyne	SLC6A3	24	46
O=C1C[C@@H](NC[C@H](O)c2ccc(F)cc2)CN1C1CC1	ZINC000819131915	CD	On-Demand	Anodyne	SLC6A3	24	46
O=C1C[C@@H](NC[C@@H](O)c2ccc(F)cc2)CN1C1CC1	ZINC000819131917	CD	On-Demand	Anodyne	SLC6A3	24	46
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CC3CC3)c2)C1	ZINC000819131931	GD	On-Demand	Reactive	AKR1C3	60	41
C[C@@H](Cc1cccc(Cl)c1)C(=O)NNC(=O)CC1CC1	ZINC000819131940	CE	On-Demand	Reactive	CTSL	20	45
C[C@@H](Cc1cccc(Cl)c1)C(=O)NNC(=O)CC1CC1	ZINC000819131940	CE	On-Demand	Reactive	CTSV	36	42
O=C(CC1CC1)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1	ZINC000819131943	GE	On-Demand	Reactive	ST14	45	36
COc1ccc(-c2nc(C)c(C(=O)NNC(=O)CC3CC3)s2)cc1	ZINC000819131960	EF	On-Demand	Reactive	PPARA	23	50
COc1ccc(-c2nc(C)c(C(=O)NNC(=O)CC3CC3)s2)cc1	ZINC000819131960	EF	On-Demand	Reactive	PPARD	37	45
O=C(CC1CC1)NNC(=O)[C@@H]1CC(=O)N(C2CCCCC2)C1	ZINC000819131961	DD	On-Demand	Reactive	INHA	24	52
O=C(CC1CC1)NNC(=O)[C@H]1CC(=O)N(C2CCCCC2)C1	ZINC000819131962	DD	On-Demand	Reactive	INHA	24	52
O=C(CC1CC1)NNC(=O)c1cc(=O)c2ccccc2o1	ZINC000819131965	CD	On-Demand	Reactive	BCHE	30	42
O=C(CC1CC1)NNC(=O)c1ccc(Oc2ccccc2)nc1	ZINC000819131966	DE	On-Demand	Reactive	GRIN2B	24	42
O=C(CC1CC1)NNC(=O)c1ccc(Oc2ccccc2)nc1	ZINC000819131966	DE	On-Demand	Reactive	HPGDS	15	52
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	ACE	47	38
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	OPRM1	49	43
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	OPRD1	43	42
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	MME	103	39
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	FCER2	76	40
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	PAPA1_CARPA	45	38
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	CYSP_TRYCR	40	39
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	NPFFR2	25	52
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	TIMP3	93	41
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	CAPNS1	63	34
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	GRIA1	45	37
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	CAPN1	53	44
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	MMP9	20	41
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	CAPN2	52	31
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	EPHX2	16	42
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	ACE2	52	37
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	MMP1	26	41
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	FPR1	45	45
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	QRFPR	24	45
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131967	HF	On-Demand	Reactive	NPFFR1	44	52
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	ACE	47	38
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	OPRM1	49	43
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	OPRD1	43	42
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	MME	103	39
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	FCER2	76	40
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	PAPA1_CARPA	45	38
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	CYSP_TRYCR	40	39
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	NPFFR2	25	52
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	TIMP3	93	41
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	CAPNS1	63	34
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	GRIA1	45	37
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	CAPN1	53	44
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	MMP9	20	41
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	CAPN2	52	31
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	EPHX2	16	42
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	ACE2	52	37
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	MMP1	26	41
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	FPR1	45	45
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	QRFPR	24	45
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819131968	HF	On-Demand	Reactive	NPFFR1	44	52
O=C(CC1CC1)NNC(=O)CC12CC3CC(C1)CC(CC(=O)NNC(=O)CC1CC1)(C3)C2	ZINC000819131971	IE	On-Demand	Reactive	BOTA	33	47
Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)NNC(=O)CC1CC1	ZINC000819131982	EE	On-Demand	Reactive	P2RX7	38	53
O=C(CC1CC1)NNC(=O)c1cn(Cc2ccccc2)c2ccccc12	ZINC000819131983	EG	On-Demand	Reactive	CNR1	24	53
O=C(CC1CC1)NNC(=O)c1cn(Cc2ccccc2)c2ccccc12	ZINC000819131983	EG	On-Demand	Reactive	CNR2	34	53
O=C(CC1CC1)NNC(=O)c1cn(Cc2ccccc2)c2ccccc12	ZINC000819131983	EG	On-Demand	Reactive	TPSAB1	20	41
Cc1nc2cc(C(=O)NNC(=O)CC3CC3)ccc2n1-c1ccccc1	ZINC000819131986	EF	On-Demand	Reactive	HPD	40	35
O=C(Cc1ccc(OCCOc2ccccc2)cc1)NNC(=O)CC1CC1	ZINC000819131992	FF	On-Demand	Reactive	GRIN2B	35	45
O=C(Cc1ccc(OCCOc2ccccc2)cc1)NNC(=O)CC1CC1	ZINC000819131992	FF	On-Demand	Reactive	LTA4H	77	42
O=C(Cc1ccc(OCCOc2ccccc2)cc1)NNC(=O)CC1CC1	ZINC000819131992	FF	On-Demand	Reactive	PPARD	19	41
O=C(CC1CC1)NNC(=O)CC12C[C@@H]3C[C@H](C1)CC(C(=O)NNC(=O)CC1CC1)(C3)C2	ZINC000819131993	ID	On-Demand	Reactive	BOTA	30	41
O=C(COCCc1ccccc1)NNC(=O)CC1CC1	ZINC000819132005	CD	On-Demand	Reactive	GRIN2B	34	41
O=C(COCCc1ccccc1)NNC(=O)CC1CC1	ZINC000819132005	CD	On-Demand	Reactive	VCP	43	33
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	ACE	23	50
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	SSTR2	42	41
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	OPRM1	21	57
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	MME	30	47
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	EDNRB	55	38
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	EDNRA	51	57
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	TACR1	42	54
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	MC4R	58	49
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	TACR2	16	53
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	CTSB	15	47
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	CCKAR	135	48
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	CTSL	26	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	BRS3	33	54
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	TIMP3	40	49
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	NMBR	42	49
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	MC3R	77	45
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	MC5R	83	45
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	MMP2	32	51
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	MMP8	45	51
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	MMP14	25	49
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	GRPR	86	44
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	ECE1	70	47
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	SSTR3	34	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	MMP11	88	41
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	CCKBR	106	48
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	GHSR	69	57
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	MMP9	31	51
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	MC1R	110	49
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	C5AR1	44	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	MMP7	21	44
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	MMP1	25	48
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	NPR	31	47
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	ADAM12	15	48
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	KISS1R	77	37
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	ERAP2	43	38
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	PSMB8	27	44
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819132017	ED	On-Demand	Reactive	HPN	21	42
O=C(CCc1nc2cc(C(F)(F)F)ccc2s1)NNC(=O)CC1CC1	ZINC000819132028	FG	On-Demand	Reactive	AKR1B1	16	44
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC000819132037	GF	On-Demand	Reactive	L3MBTL3	59	35
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC000819132038	GF	On-Demand	Reactive	L3MBTL3	59	35
NS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2CC2)cc1[N+](=O)[O-]	ZINC000819132039	EB	On-Demand	Reactive	CA2	20	40
CS(=O)(=O)Nc1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819132041	DC	On-Demand	Reactive	NR3C2	18	40
CS(=O)(=O)Nc1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819132041	DC	On-Demand	Reactive	KCNK3	44	33
O=C(CC1CC1)NNC(=O)c1csc(S(=O)(=O)N2CCc3ccccc3C2)c1	ZINC000819132054	HE	On-Demand	Reactive	AKR1C3	68	47
CC(=O)[C@@H](C)CCCCC(=O)NNC(=O)CC1CC1	ZINC000819132055	CD	On-Demand	Reactive	NOD1	43	34
CC(=O)[C@H](C)CCCCC(=O)NNC(=O)CC1CC1	ZINC000819132056	CD	On-Demand	Reactive	NOD1	43	34
CCOc1ccccc1-c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819132066	EG	On-Demand	Reactive	PTGER1	28	43
CCOc1ccccc1-c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819132066	EG	On-Demand	Reactive	HCN1	49	33
CCOc1ccccc1-c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819132066	EG	On-Demand	Reactive	HCN4	42	33
CCOc1ccccc1-c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819132066	EG	On-Demand	Reactive	KCNK3	26	40
CCOc1ccccc1-c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819132066	EG	On-Demand	Reactive	KCNK9	19	40
CCn1c(=O)n(CC(=O)NNC(=O)CC2CC2)c2ccccc21	ZINC000819132075	DC	On-Demand	Reactive	OPRL1	15	43
O=C(CC1CC1)NNC(=O)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819132076	GF	On-Demand	Reactive	MTTP	25	43
O=C(CC1CC1)NNC(=O)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819132076	GF	On-Demand	Reactive	EPHX2	31	45
O=C(CC1CC1)NNC(=O)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819132076	GF	On-Demand	Reactive	MCHR1	16	41
O=C(CC1CC1)NNC(=O)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819132076	GF	On-Demand	Reactive	MLYCD	19	44
O=C(CC1CC1)NNC(=O)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819132076	GF	On-Demand	Reactive	SFRP1	37	43
O=C(CC1CC1)NNC(=O)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819132076	GF	On-Demand	Reactive	L3MBTL3	88	41
O=C(CC1CC1)NNC(=O)c1ccccc1S(=O)(=O)N1CCOCC1	ZINC000819132079	FC	On-Demand	Reactive	CNR2	17	47
O=C(CC1CC1)NNC(=O)c1ccccc1S(=O)(=O)N1CCOCC1	ZINC000819132079	FC	On-Demand	Reactive	NR1H4	17	41
O=C(CC1CC1)NNC(=O)c1ccccc1S(=O)(=O)N1CCOCC1	ZINC000819132079	FC	On-Demand	Reactive	CCR8	52	36
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CC3CC3)cc2)CC1	ZINC000819132080	HC	On-Demand	Reactive	TGM2	88	41
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CC3CC3)cc2)CC1	ZINC000819132080	HC	On-Demand	Reactive	F13A1	86	41
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2C(=O)NNC(=O)CC2CC2)CC1	ZINC000819132086	FE	On-Demand	Reactive	GPR119	33	43
NS(=O)(=O)Cc1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819132093	DC	On-Demand	Reactive	ST14	40	35
O=C(CC1CC1)NNC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1	ZINC000819132097	GD	On-Demand	Reactive	CPT1A	19	44
O=C(CC1CC1)NNC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1	ZINC000819132097	GD	On-Demand	Reactive	AKR1C3	65	45
O=C(CNC(=O)c1ccc2c(c1)OCO2)NNC(=O)CC1CC1	ZINC000819132099	DC	On-Demand	Reactive	CCR2	39	44
O=C(CC1CC1)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(F)c(Cl)c2)cc1	ZINC000819132114	IF	On-Demand	Reactive	PKM	17	43
C#CCNC(=O)CCNC(c1cccc(OC)c1)c1cccc(OC)c1	ZINC000819132122	FF	On-Demand	Mild	DRD4	42	32
C#CCNC(=O)CCNC(c1cccc(OC)c1)c1cccc(OC)c1	ZINC000819132122	FF	On-Demand	Mild	MTNR1A	76	45
C#CCNC(=O)CCNC(c1cccc(OC)c1)c1cccc(OC)c1	ZINC000819132122	FF	On-Demand	Mild	MTNR1B	68	45
C[C@H](O)c1ccc(CNCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)cc1	ZINC000819132123	GH	On-Demand	Anodyne	TRPV1	24	42
C[C@H](O)c1ccc(CNCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)cc1	ZINC000819132123	GH	On-Demand	Anodyne	CYNT	39	46
O=C(/C=C\[C@@H]1CCCO1)N1CCCCC[C@H]1c1ccccc1	ZINC000819132125	CH	On-Demand	Anodyne	CPT1A	66	34
O=C(/C=C\[C@@H]1CCCO1)N1CCCCC[C@@H]1c1ccccc1	ZINC000819132126	CH	On-Demand	Anodyne	CPT1A	66	34
O=C(/C=C/[C@@H]1CCCO1)N1CCCCC[C@H]1c1ccccc1	ZINC000819132127	CH	On-Demand	Anodyne	CPT1A	66	34
O=C(/C=C/[C@@H]1CCCO1)N1CCCCC[C@@H]1c1ccccc1	ZINC000819132128	CH	On-Demand	Anodyne	CPT1A	66	34
C[C@H](O)c1ccc(CNC[C@@H](O)COCc2ccccc2Cl)cc1	ZINC000819132133	EG	On-Demand	Anodyne	ADRB1	15	41
C[C@H](O)c1ccc(CNC[C@H](O)COCc2ccccc2Cl)cc1	ZINC000819132135	EG	On-Demand	Anodyne	ADRB1	15	41
C[C@H](O)c1ccc(CNC[C@H](O)COC2CCOCC2)cc1	ZINC000819132145	DD	On-Demand	Anodyne	ADRB1	17	41
C[C@H](O)c1ccc(CNC[C@@H](O)COC2CCOCC2)cc1	ZINC000819132148	DD	On-Demand	Anodyne	ADRB1	17	41
C=C(C)C(C)(C)C(=O)NCc1ccc(N2CCOCC2)c(F)c1	ZINC000819132153	DF	On-Demand	Mild	STAT6	44	33
Cc1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132156	DF	On-Demand	Anodyne	ADRB2	59	58
Cc1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132156	DF	On-Demand	Anodyne	ADRB1	75	52
Cc1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132156	DF	On-Demand	Anodyne	GRIN1	15	42
Cc1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132156	DF	On-Demand	Anodyne	ADRB3	50	48
Cc1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132157	DF	On-Demand	Anodyne	ADRB2	59	58
Cc1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132157	DF	On-Demand	Anodyne	ADRB1	75	52
Cc1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132157	DF	On-Demand	Anodyne	GRIN1	15	42
Cc1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132157	DF	On-Demand	Anodyne	ADRB3	50	48
Cc1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132158	DF	On-Demand	Anodyne	ADRB2	59	58
Cc1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132158	DF	On-Demand	Anodyne	ADRB1	75	52
Cc1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132158	DF	On-Demand	Anodyne	GRIN1	15	42
Cc1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132158	DF	On-Demand	Anodyne	ADRB3	50	48
Cc1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132159	DF	On-Demand	Anodyne	ADRB2	59	58
Cc1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132159	DF	On-Demand	Anodyne	ADRB1	75	52
Cc1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132159	DF	On-Demand	Anodyne	GRIN1	15	42
Cc1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132159	DF	On-Demand	Anodyne	ADRB3	50	48
COc1cccc(OC)c1OC[C@@H](O)CNCc1ccc([C@@H](C)O)cc1	ZINC000819132176	FE	On-Demand	Anodyne	ADRB2	44	49
COc1cccc(OC)c1OC[C@@H](O)CNCc1ccc([C@@H](C)O)cc1	ZINC000819132176	FE	On-Demand	Anodyne	ADRB1	46	42
COc1cccc(OC)c1OC[C@@H](O)CNCc1ccc([C@@H](C)O)cc1	ZINC000819132176	FE	On-Demand	Anodyne	ADRB3	27	42
COc1cccc(OC)c1OC[C@H](O)CNCc1ccc([C@@H](C)O)cc1	ZINC000819132177	FE	On-Demand	Anodyne	ADRB2	44	49
COc1cccc(OC)c1OC[C@H](O)CNCc1ccc([C@@H](C)O)cc1	ZINC000819132177	FE	On-Demand	Anodyne	ADRB1	46	42
COc1cccc(OC)c1OC[C@H](O)CNCc1ccc([C@@H](C)O)cc1	ZINC000819132177	FE	On-Demand	Anodyne	ADRB3	27	42
COc1cccc(OC)c1OC[C@H](O)CNCc1ccc([C@H](C)O)cc1	ZINC000819132178	FE	On-Demand	Anodyne	ADRB2	44	49
COc1cccc(OC)c1OC[C@H](O)CNCc1ccc([C@H](C)O)cc1	ZINC000819132178	FE	On-Demand	Anodyne	ADRB1	46	42
COc1cccc(OC)c1OC[C@H](O)CNCc1ccc([C@H](C)O)cc1	ZINC000819132178	FE	On-Demand	Anodyne	ADRB3	27	42
COc1cccc(OC)c1OC[C@@H](O)CNCc1ccc([C@H](C)O)cc1	ZINC000819132179	FE	On-Demand	Anodyne	ADRB2	44	49
COc1cccc(OC)c1OC[C@@H](O)CNCc1ccc([C@H](C)O)cc1	ZINC000819132179	FE	On-Demand	Anodyne	ADRB1	46	42
COc1cccc(OC)c1OC[C@@H](O)CNCc1ccc([C@H](C)O)cc1	ZINC000819132179	FE	On-Demand	Anodyne	ADRB3	27	42
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)c1	ZINC000819132180	EE	On-Demand	Anodyne	ADRB2	52	48
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)c1	ZINC000819132180	EE	On-Demand	Anodyne	ADRB1	79	43
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)c1	ZINC000819132180	EE	On-Demand	Anodyne	ADRB3	54	43
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)c1	ZINC000819132180	EE	On-Demand	Anodyne	ABCB1	24	48
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)c1	ZINC000819132180	EE	On-Demand	Anodyne	PDS	79	38
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)c1	ZINC000819132181	EE	On-Demand	Anodyne	ADRB2	52	48
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)c1	ZINC000819132181	EE	On-Demand	Anodyne	ADRB1	79	43
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)c1	ZINC000819132181	EE	On-Demand	Anodyne	ADRB3	54	43
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)c1	ZINC000819132181	EE	On-Demand	Anodyne	ABCB1	24	48
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)c1	ZINC000819132181	EE	On-Demand	Anodyne	PDS	79	38
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)c1	ZINC000819132182	EE	On-Demand	Anodyne	ADRB2	52	48
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)c1	ZINC000819132182	EE	On-Demand	Anodyne	ADRB1	79	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)c1	ZINC000819132182	EE	On-Demand	Anodyne	ADRB3	54	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)c1	ZINC000819132182	EE	On-Demand	Anodyne	ABCB1	24	48
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)c1	ZINC000819132182	EE	On-Demand	Anodyne	PDS	79	38
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)c1	ZINC000819132183	EE	On-Demand	Anodyne	ADRB2	52	48
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)c1	ZINC000819132183	EE	On-Demand	Anodyne	ADRB1	79	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)c1	ZINC000819132183	EE	On-Demand	Anodyne	ADRB3	54	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)c1	ZINC000819132183	EE	On-Demand	Anodyne	ABCB1	24	48
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)c1	ZINC000819132183	EE	On-Demand	Anodyne	PDS	79	38
O=C1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819132188	CD	On-Demand	Anodyne	ADRB1	35	46
O=C1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819132188	CD	On-Demand	Anodyne	ADRB3	52	52
O=C1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819132188	CD	On-Demand	Anodyne	CYP3A4	49	37
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819132189	CD	On-Demand	Anodyne	ADRB1	35	46
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819132189	CD	On-Demand	Anodyne	ADRB3	52	52
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819132189	CD	On-Demand	Anodyne	CYP3A4	49	37
O=C1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819132190	CD	On-Demand	Anodyne	ADRB1	35	46
O=C1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819132190	CD	On-Demand	Anodyne	ADRB3	52	52
O=C1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819132190	CD	On-Demand	Anodyne	CYP3A4	49	37
O=C1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819132191	CD	On-Demand	Anodyne	ADRB1	35	46
O=C1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819132191	CD	On-Demand	Anodyne	ADRB3	52	52
O=C1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819132191	CD	On-Demand	Anodyne	CYP3A4	49	37
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819132198	FG	On-Demand	Anodyne	ADRB2	43	47
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819132198	FG	On-Demand	Anodyne	ADRB1	52	44
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819132198	FG	On-Demand	Anodyne	CASR	28	40
C[C@H](O)c1ccc(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819132198	FG	On-Demand	Anodyne	PDS	81	52
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819132199	FG	On-Demand	Anodyne	ADRB2	43	47
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819132199	FG	On-Demand	Anodyne	ADRB1	52	44
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819132199	FG	On-Demand	Anodyne	CASR	28	40
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819132199	FG	On-Demand	Anodyne	PDS	81	52
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CC(=O)N(C3CC3)C2)cc1	ZINC000819132200	EC	On-Demand	Anodyne	ADRB3	18	42
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CC(=O)N(C3CC3)C2)cc1	ZINC000819132201	EC	On-Demand	Anodyne	ADRB3	18	42
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CC(=O)N(C3CC3)C2)cc1	ZINC000819132202	EC	On-Demand	Anodyne	ADRB3	18	42
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CC(=O)N(C3CC3)C2)cc1	ZINC000819132203	EC	On-Demand	Anodyne	ADRB3	18	42
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(Br)cc2)cc1	ZINC000819132212	GG	On-Demand	Anodyne	ADRB2	55	51
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(Br)cc2)cc1	ZINC000819132212	GG	On-Demand	Anodyne	ADRB1	70	51
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(Br)cc2)cc1	ZINC000819132212	GG	On-Demand	Anodyne	ADRB3	45	47
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(Br)cc2)cc1	ZINC000819132213	GG	On-Demand	Anodyne	ADRB2	55	51
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(Br)cc2)cc1	ZINC000819132213	GG	On-Demand	Anodyne	ADRB1	70	51
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(Br)cc2)cc1	ZINC000819132213	GG	On-Demand	Anodyne	ADRB3	45	47
C[C@H](O)c1ccc(CNCCC(=O)Nc2ccccc2[N+](=O)[O-])cc1	ZINC000819132223	EF	On-Demand	Bother	COLA	95	36
C[C@H](O)c1ccc(CNCCC(=O)Nc2cccc(Cl)c2)cc1	ZINC000819132235	EH	On-Demand	Anodyne	LEF	62	35
C[C@H](O)c1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819132242	DG	On-Demand	Anodyne	ADRB2	54	47
C[C@H](O)c1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819132242	DG	On-Demand	Anodyne	ADRB1	53	50
C[C@H](O)c1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819132242	DG	On-Demand	Anodyne	ADRB3	69	50
C[C@H](O)c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819132244	DG	On-Demand	Anodyne	ADRB2	54	47
C[C@H](O)c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819132244	DG	On-Demand	Anodyne	ADRB1	53	50
C[C@H](O)c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819132244	DG	On-Demand	Anodyne	ADRB3	69	50
C[C@H](O)c1ccc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819132256	FH	On-Demand	Anodyne	KDR	16	42
C[C@H](O)c1ccc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819132256	FH	On-Demand	Anodyne	CCR2	31	42
C[C@H](O)c1ccc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819132256	FH	On-Demand	Anodyne	PDS	40	37
C[C@H](O)c1ccc(CNCCC(=O)Nc2ccccc2F)cc1	ZINC000819132305	DF	On-Demand	Anodyne	LEF	61	33
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132307	FE	On-Demand	Anodyne	ADRB2	59	63
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132307	FE	On-Demand	Anodyne	ADRB1	95	63
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132307	FE	On-Demand	Anodyne	GRIN1	29	44
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132307	FE	On-Demand	Anodyne	ADRB3	62	62
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132309	FE	On-Demand	Anodyne	ADRB2	59	63
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132309	FE	On-Demand	Anodyne	ADRB1	95	63
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132309	FE	On-Demand	Anodyne	GRIN1	29	44
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132309	FE	On-Demand	Anodyne	ADRB3	62	62
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132312	FE	On-Demand	Anodyne	ADRB2	59	63
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132312	FE	On-Demand	Anodyne	ADRB1	95	63
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132312	FE	On-Demand	Anodyne	GRIN1	29	44
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132312	FE	On-Demand	Anodyne	ADRB3	62	62
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132314	FE	On-Demand	Anodyne	ADRB2	59	63
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132314	FE	On-Demand	Anodyne	ADRB1	95	63
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132314	FE	On-Demand	Anodyne	GRIN1	29	44
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132314	FE	On-Demand	Anodyne	ADRB3	62	62
O[C@H](CNC[C@@H]1SCCc2ccccc21)c1cccc(Cl)c1	ZINC000819132315	EH	On-Demand	Anodyne	ADRB1	28	41
O[C@H](CNC[C@@H]1SCCc2ccccc21)c1cccc(Cl)c1	ZINC000819132315	EH	On-Demand	Anodyne	ADRB3	41	41
O[C@H](CNC[C@H]1SCCc2ccccc21)c1cccc(Cl)c1	ZINC000819132319	EH	On-Demand	Anodyne	ADRB1	28	41
O[C@H](CNC[C@H]1SCCc2ccccc21)c1cccc(Cl)c1	ZINC000819132319	EH	On-Demand	Anodyne	ADRB3	41	41
O[C@@H](CNC[C@@H]1SCCc2ccccc21)c1cccc(Cl)c1	ZINC000819132320	EH	On-Demand	Anodyne	ADRB1	28	41
O[C@@H](CNC[C@@H]1SCCc2ccccc21)c1cccc(Cl)c1	ZINC000819132320	EH	On-Demand	Anodyne	ADRB3	41	41
O[C@@H](CNC[C@H]1SCCc2ccccc21)c1cccc(Cl)c1	ZINC000819132322	EH	On-Demand	Anodyne	ADRB1	28	41
O[C@@H](CNC[C@H]1SCCc2ccccc21)c1cccc(Cl)c1	ZINC000819132322	EH	On-Demand	Anodyne	ADRB3	41	41
CN(C)[C@@H]1CCC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819132323	ED	On-Demand	Anodyne	ADRB3	19	41
CN(C)[C@@H]1CCC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819132324	ED	On-Demand	Anodyne	ADRB3	19	41
CN(C)[C@@H]1CCC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819132326	ED	On-Demand	Anodyne	ADRB3	19	41
CN(C)[C@@H]1CCC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819132327	ED	On-Demand	Anodyne	ADRB3	19	41
O=C1C[C@H](NC[C@H](O)c2ccc(Cl)cc2)CN1C1CC1	ZINC000819132347	CD	On-Demand	Anodyne	ADRB3	20	46
O=C1C[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CN1C1CC1	ZINC000819132348	CD	On-Demand	Anodyne	ADRB3	20	46
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)c1ccncc1	ZINC000819132369	CF	On-Demand	Anodyne	ADRB1	17	41
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)c1ccncc1	ZINC000819132369	CF	On-Demand	Anodyne	ADRB3	28	41
C[C@@H](CNC[C@H](O)c1cccc(F)c1)c1ccncc1	ZINC000819132370	CF	On-Demand	Anodyne	ADRB1	17	41
C[C@@H](CNC[C@H](O)c1cccc(F)c1)c1ccncc1	ZINC000819132370	CF	On-Demand	Anodyne	ADRB3	28	41
C[C@H](CNC[C@@H](O)c1cccc(F)c1)c1ccncc1	ZINC000819132371	CF	On-Demand	Anodyne	ADRB1	17	41
C[C@H](CNC[C@@H](O)c1cccc(F)c1)c1ccncc1	ZINC000819132371	CF	On-Demand	Anodyne	ADRB3	28	41
C[C@H](CNC[C@H](O)c1cccc(F)c1)c1ccncc1	ZINC000819132373	CF	On-Demand	Anodyne	ADRB1	17	41
C[C@H](CNC[C@H](O)c1cccc(F)c1)c1ccncc1	ZINC000819132373	CF	On-Demand	Anodyne	ADRB3	28	41
CON(C)C(=O)CCNC[C@H](Cc1ccccc1)c1ccccc1	ZINC000819132376	EG	On-Demand	Anodyne	MME	43	37
CON(C)C(=O)CCNC[C@@H](Cc1ccccc1)c1ccccc1	ZINC000819132377	EG	On-Demand	Anodyne	MME	43	37
O[C@@H](CNC[C@H]1SCCc2ccccc21)c1cccnc1	ZINC000819132398	DF	On-Demand	Anodyne	ADRB2	20	40
O[C@@H](CNC[C@H]1SCCc2ccccc21)c1cccnc1	ZINC000819132398	DF	On-Demand	Anodyne	ADRB3	82	42
O[C@H](CNC[C@H]1SCCc2ccccc21)c1cccnc1	ZINC000819132399	DF	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNC[C@H]1SCCc2ccccc21)c1cccnc1	ZINC000819132399	DF	On-Demand	Anodyne	ADRB3	82	42
O[C@@H](CNC[C@@H]1SCCc2ccccc21)c1cccnc1	ZINC000819132400	DF	On-Demand	Anodyne	ADRB2	20	40
O[C@@H](CNC[C@@H]1SCCc2ccccc21)c1cccnc1	ZINC000819132400	DF	On-Demand	Anodyne	ADRB3	82	42
O[C@H](CNC[C@@H]1SCCc2ccccc21)c1cccnc1	ZINC000819132401	DF	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNC[C@@H]1SCCc2ccccc21)c1cccnc1	ZINC000819132401	DF	On-Demand	Anodyne	ADRB3	82	42
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccncc1	ZINC000819132410	DE	On-Demand	Bother	CACNA1D	44	38
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccncc1	ZINC000819132411	DE	On-Demand	Bother	CACNA1D	44	38
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccncc1	ZINC000819132412	DE	On-Demand	Bother	CACNA1D	44	38
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccncc1	ZINC000819132413	DE	On-Demand	Bother	CACNA1D	44	38
CC(=O)CCc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132414	EE	On-Demand	Anodyne	ADRB2	50	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132414	EE	On-Demand	Anodyne	ADRB1	80	51
CC(=O)CCc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132414	EE	On-Demand	Anodyne	ADRB3	61	44
CC(=O)CCc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132414	EE	On-Demand	Anodyne	ABCB1	26	48
CC(=O)CCc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132415	EE	On-Demand	Anodyne	ADRB2	50	42
CC(=O)CCc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132415	EE	On-Demand	Anodyne	ADRB1	80	51
CC(=O)CCc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132415	EE	On-Demand	Anodyne	ADRB3	61	44
CC(=O)CCc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132415	EE	On-Demand	Anodyne	ABCB1	26	48
C[C@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccncc1	ZINC000819132430	FF	On-Demand	Anodyne	GPR119	56	47
C[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccncc1	ZINC000819132431	FF	On-Demand	Anodyne	GPR119	56	47
C[C@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccncc1	ZINC000819132432	FF	On-Demand	Anodyne	GPR119	56	47
C[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccncc1	ZINC000819132433	FF	On-Demand	Anodyne	GPR119	56	47
C=CCc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)c(OC)c1	ZINC000819132467	EE	On-Demand	Mild	ADRB2	18	50
C=CCc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)c(OC)c1	ZINC000819132467	EE	On-Demand	Mild	ADRB1	15	50
C=CCc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)c(OC)c1	ZINC000819132467	EE	On-Demand	Mild	ADRB3	15	40
C=CCc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)c(OC)c1	ZINC000819132468	EE	On-Demand	Mild	ADRB2	18	50
C=CCc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)c(OC)c1	ZINC000819132468	EE	On-Demand	Mild	ADRB1	15	50
C=CCc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)c(OC)c1	ZINC000819132468	EE	On-Demand	Mild	ADRB3	15	40
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819132486	FG	On-Demand	Anodyne	ADRB2	44	50
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819132486	FG	On-Demand	Anodyne	ADRB1	68	38
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819132486	FG	On-Demand	Anodyne	ADRB3	27	41
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819132486	FG	On-Demand	Anodyne	ABCB1	22	43
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819132489	FG	On-Demand	Anodyne	ADRB2	44	50
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819132489	FG	On-Demand	Anodyne	ADRB1	68	38
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819132489	FG	On-Demand	Anodyne	ADRB3	27	41
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819132489	FG	On-Demand	Anodyne	ABCB1	22	43
C[C@H](O)c1ccc(CNCCC(=O)Nc2ccccc2)cc1	ZINC000819132502	CF	On-Demand	Anodyne	LTA4H	33	43
C[C@H](O)c1ccc(CNCCC(=O)Nc2ccccc2)cc1	ZINC000819132502	CF	On-Demand	Anodyne	HDAC10	15	41
C[C@H](O)c1ccc(CNCCC(=O)Nc2cccc(F)c2)cc1	ZINC000819132507	DF	On-Demand	Anodyne	LEF	67	36
CCOc1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132514	EF	On-Demand	Anodyne	ADRB2	61	56
CCOc1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132514	EF	On-Demand	Anodyne	ADRB1	77	56
CCOc1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132514	EF	On-Demand	Anodyne	GRIN1	17	40
CCOc1ccc(OC[C@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132514	EF	On-Demand	Anodyne	ADRB3	50	48
CCOc1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132516	EF	On-Demand	Anodyne	ADRB2	61	56
CCOc1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132516	EF	On-Demand	Anodyne	ADRB1	77	56
CCOc1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132516	EF	On-Demand	Anodyne	GRIN1	17	40
CCOc1ccc(OC[C@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132516	EF	On-Demand	Anodyne	ADRB3	50	48
CCOc1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132517	EF	On-Demand	Anodyne	ADRB2	61	56
CCOc1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132517	EF	On-Demand	Anodyne	ADRB1	77	56
CCOc1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132517	EF	On-Demand	Anodyne	GRIN1	17	40
CCOc1ccc(OC[C@@H](O)CNCc2ccc([C@@H](C)O)cc2)cc1	ZINC000819132517	EF	On-Demand	Anodyne	ADRB3	50	48
CCOc1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132519	EF	On-Demand	Anodyne	ADRB2	61	56
CCOc1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132519	EF	On-Demand	Anodyne	ADRB1	77	56
CCOc1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132519	EF	On-Demand	Anodyne	GRIN1	17	40
CCOc1ccc(OC[C@@H](O)CNCc2ccc([C@H](C)O)cc2)cc1	ZINC000819132519	EF	On-Demand	Anodyne	ADRB3	50	48
Cc1ccccc1[C@@H](OC[C@H](O)CNC1CCC(C)(O)CC1)c1ccccc1	ZINC000819132526	GH	On-Demand	Anodyne	ADRB2	15	43
C[C@H](O)c1ccc(CNC[C@H](O)c2ccc(Br)cc2)cc1	ZINC000819132528	FG	On-Demand	Anodyne	ADRB2	17	57
Cc1ccccc1[C@@H](OC[C@@H](O)CNC1CCC(C)(O)CC1)c1ccccc1	ZINC000819132529	GH	On-Demand	Anodyne	ADRB2	15	43
C[C@H](O)c1ccc(CNC[C@@H](O)c2ccc(Br)cc2)cc1	ZINC000819132531	FG	On-Demand	Anodyne	ADRB2	17	57
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132532	DD	On-Demand	Anodyne	ADRB2	39	42
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132532	DD	On-Demand	Anodyne	ADRB1	57	44
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132532	DD	On-Demand	Anodyne	ADRB3	43	47
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132534	DD	On-Demand	Anodyne	ADRB2	39	42
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132534	DD	On-Demand	Anodyne	ADRB1	57	44
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132534	DD	On-Demand	Anodyne	ADRB3	43	47
C[C@@H](CNCCS(C)(=O)=O)c1ccncc1	ZINC000819132537	BC	On-Demand	Anodyne	GRIA4	17	41
C[C@H](CNCCS(C)(=O)=O)c1ccncc1	ZINC000819132539	BC	On-Demand	Anodyne	GRIA4	17	41
C[C@H](O)c1ccc(CNC[C@@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819132544	FG	On-Demand	Anodyne	LEF	41	33
C[C@H](O)c1ccc(CNC[C@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819132547	FG	On-Demand	Anodyne	LEF	41	33
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819132551	FG	On-Demand	Anodyne	ADRB2	67	62
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819132551	FG	On-Demand	Anodyne	ADRB1	75	45
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819132551	FG	On-Demand	Anodyne	ADRB3	52	45
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819132551	FG	On-Demand	Anodyne	CASR	43	40
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819132551	FG	On-Demand	Anodyne	CYP2D6	17	40
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819132551	FG	On-Demand	Anodyne	PDS	45	36
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819132554	FG	On-Demand	Anodyne	ADRB2	67	62
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819132554	FG	On-Demand	Anodyne	ADRB1	75	45
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819132554	FG	On-Demand	Anodyne	ADRB3	52	45
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819132554	FG	On-Demand	Anodyne	CASR	43	40
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819132554	FG	On-Demand	Anodyne	CYP2D6	17	40
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819132554	FG	On-Demand	Anodyne	PDS	45	36
O=C1C[C@H](NC[C@@H](O)c2cccc(Br)c2)CN1C1CC1	ZINC000819132560	ED	On-Demand	Anodyne	INHA	16	44
O=C1C[C@H](NC[C@H](O)c2cccc(Br)c2)CN1C1CC1	ZINC000819132561	ED	On-Demand	Anodyne	INHA	16	44
O=C1C[C@@H](NC[C@H](O)c2cccc(Br)c2)CN1C1CC1	ZINC000819132563	ED	On-Demand	Anodyne	INHA	16	44
CCOc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132564	DE	On-Demand	Anodyne	ADRB2	44	46
CCOc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132564	DE	On-Demand	Anodyne	ADRB1	53	47
CCOc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132564	DE	On-Demand	Anodyne	ADRB3	36	48
O=C1C[C@@H](NC[C@@H](O)c2cccc(Br)c2)CN1C1CC1	ZINC000819132565	ED	On-Demand	Anodyne	INHA	16	44
CCOc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132566	DE	On-Demand	Anodyne	ADRB2	44	46
CCOc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132566	DE	On-Demand	Anodyne	ADRB1	53	47
CCOc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132566	DE	On-Demand	Anodyne	ADRB3	36	48
COc1ccccc1COC[C@@H](O)CNC1CCC(C)(O)CC1	ZINC000819132594	DD	On-Demand	Anodyne	ADRB2	21	45
COc1ccccc1COC[C@@H](O)CNC1CCC(C)(O)CC1	ZINC000819132594	DD	On-Demand	Anodyne	ADRB1	15	45
COc1ccccc1COC[C@@H](O)CNC1CCC(C)(O)CC1	ZINC000819132594	DD	On-Demand	Anodyne	ADRB3	16	40
COc1ccccc1COC[C@H](O)CNC1CCC(C)(O)CC1	ZINC000819132596	DD	On-Demand	Anodyne	ADRB2	21	45
COc1ccccc1COC[C@H](O)CNC1CCC(C)(O)CC1	ZINC000819132596	DD	On-Demand	Anodyne	ADRB1	15	45
COc1ccccc1COC[C@H](O)CNC1CCC(C)(O)CC1	ZINC000819132596	DD	On-Demand	Anodyne	ADRB3	16	40
C#Cc1cccc(NC(=O)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819132597	GE	On-Demand	Mild	PAPA1_CARPA	47	45
C#Cc1cccc(NC(=O)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819132597	GE	On-Demand	Mild	CTSL	17	46
C#Cc1cccc(NC(=O)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819132601	GE	On-Demand	Mild	PAPA1_CARPA	47	45
C#Cc1cccc(NC(=O)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819132601	GE	On-Demand	Mild	CTSL	17	46
C[C@H](O)c1ccc(CNC[C@H](O)COc2cc(F)cc(Br)c2)cc1	ZINC000819132611	GG	On-Demand	Anodyne	ADRB2	27	42
C[C@H](O)c1ccc(CNC[C@H](O)COc2cc(F)cc(Br)c2)cc1	ZINC000819132611	GG	On-Demand	Anodyne	ADRB1	37	40
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cc(F)cc(Br)c2)cc1	ZINC000819132613	GG	On-Demand	Anodyne	ADRB2	27	42
C[C@H](O)c1ccc(CNC[C@@H](O)COc2cc(F)cc(Br)c2)cc1	ZINC000819132613	GG	On-Demand	Anodyne	ADRB1	37	40
C[C@H](O)c1ccc(CNCCC(=O)Nc2ccc(Cl)cc2)cc1	ZINC000819132616	EH	On-Demand	Anodyne	LEF	48	39
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)c1	ZINC000819132644	DD	On-Demand	Anodyne	ADRB2	32	47
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)c1	ZINC000819132644	DD	On-Demand	Anodyne	ADRB1	48	42
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)c1	ZINC000819132644	DD	On-Demand	Anodyne	ADRB3	36	47
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)c1	ZINC000819132644	DD	On-Demand	Anodyne	ABCB1	19	45
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)c1	ZINC000819132644	DD	On-Demand	Anodyne	PDS	44	34
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(C)(O)CC2)c1	ZINC000819132645	DD	On-Demand	Anodyne	ADRB2	32	47
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(C)(O)CC2)c1	ZINC000819132645	DD	On-Demand	Anodyne	ADRB1	48	42
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(C)(O)CC2)c1	ZINC000819132645	DD	On-Demand	Anodyne	ADRB3	36	47
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(C)(O)CC2)c1	ZINC000819132645	DD	On-Demand	Anodyne	ABCB1	19	45
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(C)(O)CC2)c1	ZINC000819132645	DD	On-Demand	Anodyne	PDS	44	34
COCCc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132704	ED	On-Demand	Anodyne	ADRB2	49	58
COCCc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132704	ED	On-Demand	Anodyne	ADRB1	75	58
COCCc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132704	ED	On-Demand	Anodyne	ADRB3	54	45
Cc1c(F)cccc1NC(=O)CCNCc1ccc([C@H](C)O)cc1	ZINC000819132705	EG	On-Demand	Anodyne	LEF	61	32
COCCc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132706	ED	On-Demand	Anodyne	ADRB2	49	58
COCCc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132706	ED	On-Demand	Anodyne	ADRB1	75	58
COCCc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132706	ED	On-Demand	Anodyne	ADRB3	54	45
Cc1c(F)cccc1NC(=O)CCNCc1ccc([C@@H](C)O)cc1	ZINC000819132711	EG	On-Demand	Anodyne	LEF	61	32
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000819132716	EI	On-Demand	Anodyne	KCNA5	19	41
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000819132718	EI	On-Demand	Anodyne	KCNA5	19	41
C[C@@H](CNC[C@H](O)c1ccccc1)c1ccncc1	ZINC000819132720	CF	On-Demand	Anodyne	ADRB2	16	41
C[C@@H](CNC[C@H](O)c1ccccc1)c1ccncc1	ZINC000819132720	CF	On-Demand	Anodyne	ADRB3	48	40
C[C@@H](CNC[C@H](O)c1ccccc1)c1ccncc1	ZINC000819132720	CF	On-Demand	Anodyne	AOC3	16	46
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000819132721	EI	On-Demand	Anodyne	KCNA5	19	41
C[C@H](CNC[C@H](O)c1ccccc1)c1ccncc1	ZINC000819132722	CF	On-Demand	Anodyne	ADRB2	16	41
C[C@H](CNC[C@H](O)c1ccccc1)c1ccncc1	ZINC000819132722	CF	On-Demand	Anodyne	ADRB3	48	40
C[C@H](CNC[C@H](O)c1ccccc1)c1ccncc1	ZINC000819132722	CF	On-Demand	Anodyne	AOC3	16	46
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000819132723	EI	On-Demand	Anodyne	KCNA5	19	41
C[C@H](CNC[C@@H](O)c1ccccc1)c1ccncc1	ZINC000819132724	CF	On-Demand	Anodyne	ADRB2	16	41
C[C@H](CNC[C@@H](O)c1ccccc1)c1ccncc1	ZINC000819132724	CF	On-Demand	Anodyne	ADRB3	48	40
C[C@H](CNC[C@@H](O)c1ccccc1)c1ccncc1	ZINC000819132724	CF	On-Demand	Anodyne	AOC3	16	46
COC(=O)Nc1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819132725	CF	On-Demand	Anodyne	KCNK3	83	35
COC(=O)Nc1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819132725	CF	On-Demand	Anodyne	KCNK9	57	35
C[C@@H](CNC[C@@H](O)c1ccccc1)c1ccncc1	ZINC000819132726	CF	On-Demand	Anodyne	ADRB2	16	41
C[C@@H](CNC[C@@H](O)c1ccccc1)c1ccncc1	ZINC000819132726	CF	On-Demand	Anodyne	ADRB3	48	40
C[C@@H](CNC[C@@H](O)c1ccccc1)c1ccncc1	ZINC000819132726	CF	On-Demand	Anodyne	AOC3	16	46
COC(=O)Nc1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819132727	CF	On-Demand	Anodyne	KCNK3	83	35
COC(=O)Nc1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819132727	CF	On-Demand	Anodyne	KCNK9	57	35
COC(=O)Nc1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819132729	CF	On-Demand	Anodyne	KCNK3	83	35
COC(=O)Nc1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819132729	CF	On-Demand	Anodyne	KCNK9	57	35
COC(=O)Nc1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819132731	CF	On-Demand	Anodyne	KCNK3	83	35
COC(=O)Nc1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819132731	CF	On-Demand	Anodyne	KCNK9	57	35
C[C@H](O)c1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819132743	CF	On-Demand	Anodyne	ADRB2	36	41
C[C@H](O)c1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819132743	CF	On-Demand	Anodyne	ADRB1	30	47
C[C@H](O)c1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819132743	CF	On-Demand	Anodyne	ADRB3	41	47
C[C@H](O)c1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819132747	CF	On-Demand	Anodyne	ADRB2	36	41
C[C@H](O)c1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819132747	CF	On-Demand	Anodyne	ADRB1	30	47
C[C@H](O)c1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819132747	CF	On-Demand	Anodyne	ADRB3	41	47
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819132772	EE	On-Demand	Mild	ADRB2	47	49
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819132772	EE	On-Demand	Mild	ADRB1	70	49
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819132772	EE	On-Demand	Mild	ADRB3	42	45
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819132774	EE	On-Demand	Mild	ADRB2	47	49
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819132774	EE	On-Demand	Mild	ADRB1	70	49
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819132774	EE	On-Demand	Mild	ADRB3	42	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCCC[C@@H]1c1ccccc1)C2	ZINC000819132776	FH	On-Demand	Anodyne	CPT1A	49	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCCC[C@H]1c1ccccc1)C2	ZINC000819132777	FH	On-Demand	Anodyne	CPT1A	49	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCCC[C@@H]1c1ccccc1)C2	ZINC000819132778	FH	On-Demand	Anodyne	CPT1A	49	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCCC[C@H]1c1ccccc1)C2	ZINC000819132779	FH	On-Demand	Anodyne	CPT1A	49	34
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819132796	FH	On-Demand	Anodyne	ADRB2	54	46
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819132796	FH	On-Demand	Anodyne	ADRB1	66	46
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819132796	FH	On-Demand	Anodyne	GRIN1	32	50
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819132796	FH	On-Demand	Anodyne	ADRB3	48	44
C[C@H](O)c1ccc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819132796	FH	On-Demand	Anodyne	PDS	26	44
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819132797	FH	On-Demand	Anodyne	ADRB2	54	46
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819132797	FH	On-Demand	Anodyne	ADRB1	66	46
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819132797	FH	On-Demand	Anodyne	GRIN1	32	50
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819132797	FH	On-Demand	Anodyne	ADRB3	48	44
C[C@H](O)c1ccc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819132797	FH	On-Demand	Anodyne	PDS	26	44
Cc1ccc(C(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1F	ZINC000819132798	EE	On-Demand	Anodyne	L3MBTL3	63	36
Cc1ccc(C(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1F	ZINC000819132799	EE	On-Demand	Anodyne	L3MBTL3	63	36
Cc1ccc(C(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1F	ZINC000819132800	EE	On-Demand	Anodyne	L3MBTL3	63	36
Cc1ccc(C(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1F	ZINC000819132801	EE	On-Demand	Anodyne	L3MBTL3	63	36
C[C@H](O)c1ccc(CNC[C@H](O)COC(c2ccccc2)c2ccccc2)cc1	ZINC000819132810	GH	On-Demand	Anodyne	ADRB2	25	45
C[C@H](O)c1ccc(CNC[C@H](O)COC(c2ccccc2)c2ccccc2)cc1	ZINC000819132810	GH	On-Demand	Anodyne	CASR	25	49
C[C@H](O)c1ccc(CNC[C@@H](O)COC(c2ccccc2)c2ccccc2)cc1	ZINC000819132813	GH	On-Demand	Anodyne	ADRB2	25	45
C[C@H](O)c1ccc(CNC[C@@H](O)COC(c2ccccc2)c2ccccc2)cc1	ZINC000819132813	GH	On-Demand	Anodyne	CASR	25	49
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)C(F)=C1CCC1	ZINC000819132848	EI	On-Demand	Anodyne	CNR2	15	46
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)C(F)=C1CCC1	ZINC000819132848	EI	On-Demand	Anodyne	MAPK14	47	39
Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)C(F)=C1CCC1	ZINC000819132848	EI	On-Demand	Anodyne	MAPK13	53	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCSC1	ZINC000819132857	GF	On-Demand	Anodyne	CTSD	105	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCSC1	ZINC000819132857	GF	On-Demand	Anodyne	PGC	62	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCSC1	ZINC000819132857	GF	On-Demand	Anodyne	CMA1	29	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCSC1	ZINC000819132857	GF	On-Demand	Anodyne	PAPA1_CARPA	31	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCSC1	ZINC000819132857	GF	On-Demand	Anodyne	BACE2	51	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCSC1	ZINC000819132857	GF	On-Demand	Anodyne	REN	98	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCSC1	ZINC000819132857	GF	On-Demand	Anodyne	REN1	28	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCSC1	ZINC000819132857	GF	On-Demand	Anodyne	BACE1	80	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCSC1	ZINC000819132857	GF	On-Demand	Anodyne	FPR1	50	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCSC1	ZINC000819132857	GF	On-Demand	Anodyne	PLM1_PLAFA	32	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCSC1	ZINC000819132857	GF	On-Demand	Anodyne	PLM2_PLAFA	48	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCSC1	ZINC000819132858	GF	On-Demand	Anodyne	CTSD	105	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCSC1	ZINC000819132858	GF	On-Demand	Anodyne	PGC	62	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCSC1	ZINC000819132858	GF	On-Demand	Anodyne	CMA1	29	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCSC1	ZINC000819132858	GF	On-Demand	Anodyne	PAPA1_CARPA	31	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCSC1	ZINC000819132858	GF	On-Demand	Anodyne	BACE2	51	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCSC1	ZINC000819132858	GF	On-Demand	Anodyne	REN	98	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCSC1	ZINC000819132858	GF	On-Demand	Anodyne	REN1	28	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCSC1	ZINC000819132858	GF	On-Demand	Anodyne	BACE1	80	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCSC1	ZINC000819132858	GF	On-Demand	Anodyne	FPR1	50	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCSC1	ZINC000819132858	GF	On-Demand	Anodyne	PLM1_PLAFA	32	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCSC1	ZINC000819132858	GF	On-Demand	Anodyne	PLM2_PLAFA	48	34
Cc1cc(OC[C@H](O)CNC2CCC(C)(O)CC2)c(C(C)C)cc1Cl	ZINC000819132882	FH	On-Demand	Anodyne	ADRB2	15	50
Cc1cc(OC[C@@H](O)CNC2CCC(C)(O)CC2)c(C(C)C)cc1Cl	ZINC000819132884	FH	On-Demand	Anodyne	ADRB2	15	50
CCC(CC)C(=O)N1CCC(NC(=O)C(F)=C2CCC2)CC1	ZINC000819132927	DF	On-Demand	Anodyne	EPHX2	26	45
CS(=O)(=O)CC1(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819132943	DD	On-Demand	Anodyne	ADRB2	46	39
CS(=O)(=O)CC1(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819132943	DD	On-Demand	Anodyne	ADRB1	57	45
CS(=O)(=O)CC1(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819132943	DD	On-Demand	Anodyne	ADRB3	87	49
Cc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132946	CE	On-Demand	Anodyne	ADRB2	42	52
Cc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132946	CE	On-Demand	Anodyne	ADRB1	53	47
Cc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132946	CE	On-Demand	Anodyne	ADRB3	35	48
CS(=O)(=O)CC1(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819132947	DD	On-Demand	Anodyne	ADRB2	46	39
CS(=O)(=O)CC1(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819132947	DD	On-Demand	Anodyne	ADRB1	57	45
CS(=O)(=O)CC1(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819132947	DD	On-Demand	Anodyne	ADRB3	87	49
Cc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132948	CE	On-Demand	Anodyne	ADRB2	42	52
Cc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132948	CE	On-Demand	Anodyne	ADRB1	53	47
Cc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819132948	CE	On-Demand	Anodyne	ADRB3	35	48
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(F)=C1CCC1	ZINC000819132970	EG	On-Demand	Anodyne	DRD4	25	46
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(F)=C1CCC1	ZINC000819132970	EG	On-Demand	Anodyne	KCNH2	17	43
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(F)=C1CCC1	ZINC000819132970	EG	On-Demand	Anodyne	SIGMAR1	27	62
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(F)=C1CCC1	ZINC000819132970	EG	On-Demand	Anodyne	SSTR5	55	41
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(F)=C1CCC1	ZINC000819132970	EG	On-Demand	Anodyne	CCR3	44	47
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)C(F)=C1CCC1	ZINC000819132970	EG	On-Demand	Anodyne	MCHR1	54	53
CS(=O)(=O)CC1(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819132973	FE	On-Demand	Anodyne	ADRB3	27	42
CS(=O)(=O)CC1(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819132975	FE	On-Demand	Anodyne	ADRB3	27	42
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133008	EF	On-Demand	Anodyne	DRD4	24	44
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133008	EF	On-Demand	Anodyne	KCNH2	17	44
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133008	EF	On-Demand	Anodyne	SIGMAR1	36	54
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133008	EF	On-Demand	Anodyne	SSTR5	47	39
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133008	EF	On-Demand	Anodyne	CCR3	63	50
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133008	EF	On-Demand	Anodyne	MLNR	43	38
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133008	EF	On-Demand	Anodyne	MCHR1	48	48
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133008	EF	On-Demand	Anodyne	CACNA1G	32	45
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133009	EF	On-Demand	Anodyne	DRD4	24	44
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133009	EF	On-Demand	Anodyne	KCNH2	17	44
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133009	EF	On-Demand	Anodyne	SIGMAR1	36	54
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133009	EF	On-Demand	Anodyne	SSTR5	47	39
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133009	EF	On-Demand	Anodyne	CCR3	63	50
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133009	EF	On-Demand	Anodyne	MLNR	43	38
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133009	EF	On-Demand	Anodyne	MCHR1	48	48
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133009	EF	On-Demand	Anodyne	CACNA1G	32	45
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133010	EF	On-Demand	Anodyne	DRD4	24	44
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133010	EF	On-Demand	Anodyne	KCNH2	17	44
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133010	EF	On-Demand	Anodyne	SIGMAR1	36	54
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133010	EF	On-Demand	Anodyne	SSTR5	47	39
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133010	EF	On-Demand	Anodyne	CCR3	63	50
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133010	EF	On-Demand	Anodyne	MLNR	43	38
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133010	EF	On-Demand	Anodyne	MCHR1	48	48
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133010	EF	On-Demand	Anodyne	CACNA1G	32	45
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133011	EF	On-Demand	Anodyne	DRD4	24	44
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133011	EF	On-Demand	Anodyne	KCNH2	17	44
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133011	EF	On-Demand	Anodyne	SIGMAR1	36	54
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133011	EF	On-Demand	Anodyne	SSTR5	47	39
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133011	EF	On-Demand	Anodyne	CCR3	63	50
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133011	EF	On-Demand	Anodyne	MLNR	43	38
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133011	EF	On-Demand	Anodyne	MCHR1	48	48
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133011	EF	On-Demand	Anodyne	CACNA1G	32	45
COc1cccc(OC)c1OC[C@@H](O)CNC1CCC(C)(O)CC1	ZINC000819133042	ED	On-Demand	Anodyne	ADRB2	41	49
COc1cccc(OC)c1OC[C@@H](O)CNC1CCC(C)(O)CC1	ZINC000819133042	ED	On-Demand	Anodyne	ADRB1	32	49
COc1cccc(OC)c1OC[C@@H](O)CNC1CCC(C)(O)CC1	ZINC000819133042	ED	On-Demand	Anodyne	ADRB3	25	44
COc1cccc(OC)c1OC[C@H](O)CNC1CCC(C)(O)CC1	ZINC000819133043	ED	On-Demand	Anodyne	ADRB2	41	49
COc1cccc(OC)c1OC[C@H](O)CNC1CCC(C)(O)CC1	ZINC000819133043	ED	On-Demand	Anodyne	ADRB1	32	49
COc1cccc(OC)c1OC[C@H](O)CNC1CCC(C)(O)CC1	ZINC000819133043	ED	On-Demand	Anodyne	ADRB3	25	44
C[C@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccncc1	ZINC000819133047	ED	On-Demand	Anodyne	ADRB3	39	41
C[C@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccncc1	ZINC000819133048	ED	On-Demand	Anodyne	ADRB3	39	41
C[C@@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccncc1	ZINC000819133049	ED	On-Demand	Anodyne	ADRB3	39	41
C[C@@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccncc1	ZINC000819133050	ED	On-Demand	Anodyne	ADRB3	39	41
COC(=O)c1ccc(CCNC(=O)C2CCN(S(=O)(=O)/C=C\c3ccccc3)CC2)cc1	ZINC000819133086	JF	On-Demand	Anodyne	EPHX2	20	51
CC(C)c1nnc(CNC[C@@H](O)c2ccccc2)s1	ZINC000819133125	CE	On-Demand	Anodyne	ADRB2	16	41
CC(C)c1nnc(CNC[C@@H](O)c2ccccc2)s1	ZINC000819133125	CE	On-Demand	Anodyne	ADRB3	46	39
CC(C)c1nnc(CNC[C@H](O)c2ccccc2)s1	ZINC000819133126	CE	On-Demand	Anodyne	ADRB2	16	41
CC(C)c1nnc(CNC[C@H](O)c2ccccc2)s1	ZINC000819133126	CE	On-Demand	Anodyne	ADRB3	46	39
O=C(NCc1ccc(Cl)nc1)C(F)=C1CCC1	ZINC000819133191	CF	On-Demand	Anodyne	NACHRBETA2	40	43
CN1CCC[C@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000819133203	BC	On-Demand	Anodyne	ADRB1	21	41
CN1CCC[C@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000819133203	BC	On-Demand	Anodyne	ADRB3	80	45
CN1CCC[C@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000819133204	BC	On-Demand	Anodyne	ADRB1	21	41
CN1CCC[C@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000819133204	BC	On-Demand	Anodyne	ADRB3	80	45
CC(=O)Nc1cccc(CC(=O)Nc2cc(F)c(N3CCCC3)c(F)c2)c1	ZINC000819133208	FH	On-Demand	Anodyne	KCNQ2	59	48
CC(=O)Nc1cccc(CC(=O)Nc2cc(F)c(N3CCCC3)c(F)c2)c1	ZINC000819133208	FH	On-Demand	Anodyne	TAAR1	27	42
O[C@@H](CNCCC1CCN(CC(F)(F)F)CC1)c1cccc(Cl)c1	ZINC000819133220	FH	On-Demand	Anodyne	ADRB1	47	47
O[C@@H](CNCCC1CCN(CC(F)(F)F)CC1)c1cccc(Cl)c1	ZINC000819133220	FH	On-Demand	Anodyne	ADRB3	58	47
O[C@H](CNCCC1CCN(CC(F)(F)F)CC1)c1cccc(Cl)c1	ZINC000819133221	FH	On-Demand	Anodyne	ADRB1	47	47
O[C@H](CNCCC1CCN(CC(F)(F)F)CC1)c1cccc(Cl)c1	ZINC000819133221	FH	On-Demand	Anodyne	ADRB3	58	47
CS(=O)(=O)CC1(CNC[C@@H](O)c2cccc(Br)c2)CC1	ZINC000819133231	FD	On-Demand	Anodyne	ADRB3	49	38
CS(=O)(=O)CC1(CNC[C@H](O)c2cccc(Br)c2)CC1	ZINC000819133232	FD	On-Demand	Anodyne	ADRB3	49	38
C[C@@H]1CCCC[C@@H]1C(=O)NCc1ccc(Cl)nc1	ZINC000819133247	CG	On-Demand	Anodyne	NACHRBETA2	45	44
C[C@@H]1CCCC[C@H]1C(=O)NCc1ccc(Cl)nc1	ZINC000819133248	CG	On-Demand	Anodyne	NACHRBETA2	45	44
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819133264	GD	On-Demand	Anodyne	ACE	42	43
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819133264	GD	On-Demand	Anodyne	CELA1	18	42
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819133264	GD	On-Demand	Anodyne	MME	30	43
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819133264	GD	On-Demand	Anodyne	CTSD	106	47
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819133264	GD	On-Demand	Anodyne	PGC	72	47
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819133264	GD	On-Demand	Anodyne	CMA1	35	44
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819133264	GD	On-Demand	Anodyne	PAPA1_CARPA	31	42
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819133264	GD	On-Demand	Anodyne	CCKAR	24	45
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819133264	GD	On-Demand	Anodyne	CTSK	16	43
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819133264	GD	On-Demand	Anodyne	CTSL	22	42
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819133264	GD	On-Demand	Anodyne	PGA	37	47
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819133264	GD	On-Demand	Anodyne	BACE2	53	46
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819133264	GD	On-Demand	Anodyne	REN	110	49
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819133264	GD	On-Demand	Anodyne	REN1	41	42
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819133264	GD	On-Demand	Anodyne	CTSE	43	47
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819133264	GD	On-Demand	Anodyne	BACE1	88	46
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819133264	GD	On-Demand	Anodyne	FPR1	49	40
CN1CCC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819133264	GD	On-Demand	Anodyne	PLM1_PLAFA	22	40
O[C@@H](CNCCC1CCN(CC(F)(F)F)CC1)c1cccnc1	ZINC000819133269	EE	On-Demand	Anodyne	ADRB2	24	45
O[C@@H](CNCCC1CCN(CC(F)(F)F)CC1)c1cccnc1	ZINC000819133269	EE	On-Demand	Anodyne	ADRB1	27	45
O[C@@H](CNCCC1CCN(CC(F)(F)F)CC1)c1cccnc1	ZINC000819133269	EE	On-Demand	Anodyne	ADRB3	95	45
O[C@H](CNCCC1CCN(CC(F)(F)F)CC1)c1cccnc1	ZINC000819133270	EE	On-Demand	Anodyne	ADRB2	24	45
O[C@H](CNCCC1CCN(CC(F)(F)F)CC1)c1cccnc1	ZINC000819133270	EE	On-Demand	Anodyne	ADRB1	27	45
O[C@H](CNCCC1CCN(CC(F)(F)F)CC1)c1cccnc1	ZINC000819133270	EE	On-Demand	Anodyne	ADRB3	95	45
Cc1ccccc1[C@@H](O)CNCC(=O)N(C)C1CCCCC1	ZINC000819133321	DE	On-Demand	Anodyne	AMY2	43	29
CN1CCC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1=O	ZINC000819133331	DD	On-Demand	Anodyne	CCR2	42	36
CN1CCC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1=O	ZINC000819133332	DD	On-Demand	Anodyne	CCR2	42	36
CN(C)[C@@H]1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819133366	FG	On-Demand	Anodyne	ADRB2	32	41
CN(C)[C@@H]1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819133366	FG	On-Demand	Anodyne	ADRB1	34	44
CN(C)[C@@H]1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819133366	FG	On-Demand	Anodyne	ADRB3	24	40
CN(C)[C@@H]1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819133366	FG	On-Demand	Anodyne	CCR3	15	48
CN(C)[C@@H]1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819133367	FG	On-Demand	Anodyne	ADRB2	32	41
CN(C)[C@@H]1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819133367	FG	On-Demand	Anodyne	ADRB1	34	44
CN(C)[C@@H]1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819133367	FG	On-Demand	Anodyne	ADRB3	24	40
CN(C)[C@@H]1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819133367	FG	On-Demand	Anodyne	CCR3	15	48
CN(C)[C@@H]1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819133368	FG	On-Demand	Anodyne	ADRB2	32	41
CN(C)[C@@H]1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819133368	FG	On-Demand	Anodyne	ADRB1	34	44
CN(C)[C@@H]1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819133368	FG	On-Demand	Anodyne	ADRB3	24	40
CN(C)[C@@H]1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819133368	FG	On-Demand	Anodyne	CCR3	15	48
CN(C)[C@@H]1CCC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819133369	FG	On-Demand	Anodyne	ADRB2	32	41
CN(C)[C@@H]1CCC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819133369	FG	On-Demand	Anodyne	ADRB1	34	44
CN(C)[C@@H]1CCC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819133369	FG	On-Demand	Anodyne	ADRB3	24	40
CN(C)[C@@H]1CCC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819133369	FG	On-Demand	Anodyne	CCR3	15	48
COc1cccc([S@@](=O)CC(=O)Nc2cc(F)c(N3CCCC3)c(F)c2)c1	ZINC000819133384	GG	On-Demand	Anodyne	DRD4	43	33
COc1cccc([S@@](=O)CC(=O)Nc2cc(F)c(N3CCCC3)c(F)c2)c1	ZINC000819133384	GG	On-Demand	Anodyne	TAAR1	33	41
CC(=O)Nc1cccc(CC(=O)N(CC(=O)N(C)C)CC(F)(F)F)c1	ZINC000819133386	FD	On-Demand	Anodyne	KCNK3	40	34
C/C=C/c1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)c(OC)c1	ZINC000819133393	EF	On-Demand	Anodyne	ADRB2	15	61
C/C=C/c1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)c(OC)c1	ZINC000819133393	EF	On-Demand	Anodyne	ADRB3	15	40
C/C=C\c1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)c(OC)c1	ZINC000819133394	EF	On-Demand	Anodyne	ADRB2	15	61
C/C=C\c1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)c(OC)c1	ZINC000819133394	EF	On-Demand	Anodyne	ADRB3	15	40
C/C=C/c1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)c(OC)c1	ZINC000819133395	EF	On-Demand	Anodyne	ADRB2	15	61
C/C=C/c1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)c(OC)c1	ZINC000819133395	EF	On-Demand	Anodyne	ADRB3	15	40
C/C=C\c1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)c(OC)c1	ZINC000819133396	EF	On-Demand	Anodyne	ADRB2	15	61
C/C=C\c1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)c(OC)c1	ZINC000819133396	EF	On-Demand	Anodyne	ADRB3	15	40
Cc1nc(NC(=O)/C=C\[C@@H]2CCCO2)sc1Cc1ccc(F)cc1	ZINC000819133441	EH	On-Demand	Anodyne	CCR3	35	41
Cc1nc(NC(=O)/C=C/[C@@H]2CCCO2)sc1Cc1ccc(F)cc1	ZINC000819133442	EH	On-Demand	Anodyne	CCR3	35	41
Cc1nc(NC(=O)/C=C\[C@H]2CCCO2)sc1Cc1ccc(F)cc1	ZINC000819133443	EH	On-Demand	Anodyne	CCR3	35	41
Cc1nc(NC(=O)/C=C/[C@H]2CCCO2)sc1Cc1ccc(F)cc1	ZINC000819133444	EH	On-Demand	Anodyne	CCR3	35	41
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000819133449	FF	On-Demand	Anodyne	ADRB2	54	46
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000819133449	FF	On-Demand	Anodyne	ADRB1	57	46
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000819133449	FF	On-Demand	Anodyne	ACHE	31	46
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000819133449	FF	On-Demand	Anodyne	SLC6A3	21	47
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000819133449	FF	On-Demand	Anodyne	ADRB3	122	46
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000819133449	FF	On-Demand	Anodyne	SIGMAR1	30	51
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000819133449	FF	On-Demand	Anodyne	BCHE	16	46
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000819133450	FF	On-Demand	Anodyne	ADRB2	54	46
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000819133450	FF	On-Demand	Anodyne	ADRB1	57	46
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000819133450	FF	On-Demand	Anodyne	ACHE	31	46
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000819133450	FF	On-Demand	Anodyne	SLC6A3	21	47
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000819133450	FF	On-Demand	Anodyne	ADRB3	122	46
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000819133450	FF	On-Demand	Anodyne	SIGMAR1	30	51
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccnc1	ZINC000819133450	FF	On-Demand	Anodyne	BCHE	16	46
CCCNC(=O)c1ccc(Cl)cc1NC(=O)c1cc2c(cn1)OCCO2	ZINC000819133451	GF	On-Demand	Anodyne	F10	24	42
CCCNC(=O)c1ccc(Cl)cc1NC(=O)c1cc2c(cn1)OCCO2	ZINC000819133451	GF	On-Demand	Anodyne	SLC6A9	45	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133456	GF	On-Demand	Anodyne	DRD4	30	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133456	GF	On-Demand	Anodyne	KCNH2	20	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133456	GF	On-Demand	Anodyne	SIGMAR1	37	53
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133456	GF	On-Demand	Anodyne	SSTR5	53	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133456	GF	On-Demand	Anodyne	CCR3	69	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133456	GF	On-Demand	Anodyne	MLNR	54	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133456	GF	On-Demand	Anodyne	MCHR1	52	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819133456	GF	On-Demand	Anodyne	CACNA1G	48	45
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819133463	DG	On-Demand	Anodyne	DRD4	29	46
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819133463	DG	On-Demand	Anodyne	ACHE	15	42
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819133463	DG	On-Demand	Anodyne	KCNH2	16	44
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819133463	DG	On-Demand	Anodyne	CHRM3	16	42
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819133463	DG	On-Demand	Anodyne	SIGMAR1	43	60
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819133463	DG	On-Demand	Anodyne	SSTR5	48	41
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819133463	DG	On-Demand	Anodyne	CCR3	89	53
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819133463	DG	On-Demand	Anodyne	MLNR	54	40
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819133463	DG	On-Demand	Anodyne	MCHR1	54	53
O=C(NC1CCN(Cc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819133463	DG	On-Demand	Anodyne	CACNA1G	46	50
C[C@@H]1C[C@H]1c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819133495	GH	On-Demand	Mild	PAPA1_CARPA	43	45
C[C@@H]1C[C@H]1c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819133496	GH	On-Demand	Mild	PAPA1_CARPA	43	45
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)c1ccncc1	ZINC000819133534	CG	On-Demand	Anodyne	ADRB2	17	43
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)c1ccncc1	ZINC000819133534	CG	On-Demand	Anodyne	ADRB1	41	44
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)c1ccncc1	ZINC000819133534	CG	On-Demand	Anodyne	ADRB3	60	44
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)c1ccncc1	ZINC000819133535	CG	On-Demand	Anodyne	ADRB2	17	43
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)c1ccncc1	ZINC000819133535	CG	On-Demand	Anodyne	ADRB1	41	44
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)c1ccncc1	ZINC000819133535	CG	On-Demand	Anodyne	ADRB3	60	44
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)c1ccncc1	ZINC000819133536	CG	On-Demand	Anodyne	ADRB2	17	43
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)c1ccncc1	ZINC000819133536	CG	On-Demand	Anodyne	ADRB1	41	44
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)c1ccncc1	ZINC000819133536	CG	On-Demand	Anodyne	ADRB3	60	44
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)c1ccncc1	ZINC000819133537	CG	On-Demand	Anodyne	ADRB2	17	43
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)c1ccncc1	ZINC000819133537	CG	On-Demand	Anodyne	ADRB1	41	44
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)c1ccncc1	ZINC000819133537	CG	On-Demand	Anodyne	ADRB3	60	44
O=C(Cc1nsc2ccccc12)Nc1cc(F)c(N2CCCC2)c(F)c1	ZINC000819133589	FI	On-Demand	Anodyne	IMDH_CRYPV	26	40
Cc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)c(C)c1	ZINC000819133597	DE	On-Demand	Anodyne	ADRB2	28	46
Cc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)c(C)c1	ZINC000819133597	DE	On-Demand	Anodyne	ADRB1	20	46
Cc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)c(C)c1	ZINC000819133598	DE	On-Demand	Anodyne	ADRB2	28	46
Cc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)c(C)c1	ZINC000819133598	DE	On-Demand	Anodyne	ADRB1	20	46
COc1ccc(OC)c([C@H](O)CNCCN2CCC(N(C)C)CC2)c1	ZINC000819133617	FD	On-Demand	Anodyne	ADRB2	21	44
COc1ccc(OC)c([C@H](O)CNCCN2CCC(N(C)C)CC2)c1	ZINC000819133617	FD	On-Demand	Anodyne	DRD4	40	31
CN(CCNC[C@H](O)c1ccc(Cl)cc1)Cc1ccc(F)cc1	ZINC000819133633	EG	On-Demand	Anodyne	ADRB2	19	40
CN(CCNC[C@H](O)c1ccc(Cl)cc1)Cc1ccc(F)cc1	ZINC000819133633	EG	On-Demand	Anodyne	ADRB1	27	42
CN(CCNC[C@H](O)c1ccc(Cl)cc1)Cc1ccc(F)cc1	ZINC000819133633	EG	On-Demand	Anodyne	ADRB3	40	42
CN(CCNC[C@H](O)c1ccc(Cl)cc1)Cc1ccc(F)cc1	ZINC000819133633	EG	On-Demand	Anodyne	UL54	59	35
CN(CCNC[C@H](O)c1ccc(Cl)cc1)Cc1ccc(F)cc1	ZINC000819133633	EG	On-Demand	Anodyne	LEF	37	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(-n2cccn2)c(F)c1	ZINC000819133646	FF	On-Demand	Anodyne	NPY2R	45	35
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(C3CCCC3)CC2)cc1	ZINC000819133691	FE	On-Demand	Anodyne	CHRM2	24	41
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(C3CCCC3)CC2)cc1	ZINC000819133691	FE	On-Demand	Anodyne	ADRA1D	29	42
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(C3CCCC3)CC2)cc1	ZINC000819133691	FE	On-Demand	Anodyne	ADRA1A	20	42
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(C3CCCC3)CC2)cc1	ZINC000819133691	FE	On-Demand	Anodyne	ADRA1B	23	42
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(C3CCCC3)CC2)cc1	ZINC000819133691	FE	On-Demand	Anodyne	ADRB3	29	43
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(C3CCCC3)CC2)cc1	ZINC000819133693	FE	On-Demand	Anodyne	CHRM2	24	41
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(C3CCCC3)CC2)cc1	ZINC000819133693	FE	On-Demand	Anodyne	ADRA1D	29	42
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(C3CCCC3)CC2)cc1	ZINC000819133693	FE	On-Demand	Anodyne	ADRA1A	20	42
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(C3CCCC3)CC2)cc1	ZINC000819133693	FE	On-Demand	Anodyne	ADRA1B	23	42
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(C3CCCC3)CC2)cc1	ZINC000819133693	FE	On-Demand	Anodyne	ADRB3	29	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2(CS(C)(=O)=O)CC2)CC1	ZINC000819133694	GD	On-Demand	Anodyne	GPR119	38	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2(CS(C)(=O)=O)CC2)CC1	ZINC000819133697	GD	On-Demand	Anodyne	GPR119	38	44
O=C(CCc1cccc(OC(F)F)c1)NCc1ccc(Cl)nc1	ZINC000819133698	EH	On-Demand	Anodyne	PDS	68	36
O[C@@H](CNCCC1CCN(CC(F)(F)F)CC1)c1ccccc1	ZINC000819133707	EF	On-Demand	Anodyne	SLC6A3	24	45
O[C@@H](CNCCC1CCN(CC(F)(F)F)CC1)c1ccccc1	ZINC000819133707	EF	On-Demand	Anodyne	HPGDS	34	42
O[C@H](CNCCC1CCN(CC(F)(F)F)CC1)c1ccccc1	ZINC000819133709	EF	On-Demand	Anodyne	SLC6A3	24	45
O[C@H](CNCCC1CCN(CC(F)(F)F)CC1)c1ccccc1	ZINC000819133709	EF	On-Demand	Anodyne	HPGDS	34	42
O[C@@H](CNCCC1CCN(CC(F)(F)F)CC1)c1ccc(F)cc1	ZINC000819133713	EG	On-Demand	Anodyne	SLC6A3	26	44
O[C@H](CNCCC1CCN(CC(F)(F)F)CC1)c1ccc(F)cc1	ZINC000819133715	EG	On-Demand	Anodyne	SLC6A3	26	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2CCN(C3CCCC3)CC2)CC1	ZINC000819133753	GF	On-Demand	Anodyne	GPR119	24	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2CCN(C3CCCC3)CC2)CC1	ZINC000819133755	GF	On-Demand	Anodyne	GPR119	24	40
CC(C)c1nnc(CNC[C@@H](O)c2cccc(F)c2)s1	ZINC000819133775	CF	On-Demand	Anodyne	ADRB1	16	43
CC(C)c1nnc(CNC[C@@H](O)c2cccc(F)c2)s1	ZINC000819133775	CF	On-Demand	Anodyne	ADRB3	25	43
CC(C)c1nnc(CNC[C@H](O)c2cccc(F)c2)s1	ZINC000819133776	CF	On-Demand	Anodyne	ADRB1	16	43
CC(C)c1nnc(CNC[C@H](O)c2cccc(F)c2)s1	ZINC000819133776	CF	On-Demand	Anodyne	ADRB3	25	43
CN1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819133798	CD	On-Demand	Anodyne	ADRB1	36	43
CN1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819133798	CD	On-Demand	Anodyne	ADRB3	52	45
CN1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819133798	CD	On-Demand	Anodyne	IGF1R	31	42
CN1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819133798	CD	On-Demand	Anodyne	CYP3A4	51	39
CN1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819133799	CD	On-Demand	Anodyne	ADRB1	36	43
CN1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819133799	CD	On-Demand	Anodyne	ADRB3	52	45
CN1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819133799	CD	On-Demand	Anodyne	IGF1R	31	42
CN1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819133799	CD	On-Demand	Anodyne	CYP3A4	51	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(Cn2cccnc2=O)c1	ZINC000819133805	GE	On-Demand	Anodyne	CCKAR	18	40
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccc(F)c1	ZINC000819133806	GH	On-Demand	Anodyne	ADRB2	48	40
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccc(F)c1	ZINC000819133806	GH	On-Demand	Anodyne	ADRB1	51	40
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccc(F)c1	ZINC000819133806	GH	On-Demand	Anodyne	DRD4	28	42
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccc(F)c1	ZINC000819133806	GH	On-Demand	Anodyne	SLC6A4	15	48
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccc(F)c1	ZINC000819133806	GH	On-Demand	Anodyne	SLC6A3	37	48
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccc(F)c1	ZINC000819133806	GH	On-Demand	Anodyne	ADRB3	52	40
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccc(F)c1	ZINC000819133806	GH	On-Demand	Anodyne	SIGMAR1	39	51
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccc(F)c1	ZINC000819133807	GH	On-Demand	Anodyne	ADRB2	48	40
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccc(F)c1	ZINC000819133807	GH	On-Demand	Anodyne	ADRB1	51	40
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccc(F)c1	ZINC000819133807	GH	On-Demand	Anodyne	DRD4	28	42
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccc(F)c1	ZINC000819133807	GH	On-Demand	Anodyne	SLC6A4	15	48
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccc(F)c1	ZINC000819133807	GH	On-Demand	Anodyne	SLC6A3	37	48
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccc(F)c1	ZINC000819133807	GH	On-Demand	Anodyne	ADRB3	52	40
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1cccc(F)c1	ZINC000819133807	GH	On-Demand	Anodyne	SIGMAR1	39	51
O=C(NCc1ccc(Cl)nc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819133808	EH	On-Demand	Anodyne	NACHRBETA2	35	40
COc1cc(CNC(=O)C(F)=C2CCC2)ccc1OCCO	ZINC000819133809	DE	On-Demand	Anodyne	MT-ND1	23	40
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819133836	ED	On-Demand	Anodyne	ADRB2	50	57
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819133836	ED	On-Demand	Anodyne	ADRB1	85	57
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819133836	ED	On-Demand	Anodyne	ADRB3	60	49
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819133837	ED	On-Demand	Anodyne	ADRB2	50	57
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819133837	ED	On-Demand	Anodyne	ADRB1	85	57
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819133837	ED	On-Demand	Anodyne	ADRB3	60	49
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133889	FF	On-Demand	Anodyne	DRD4	20	44
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133889	FF	On-Demand	Anodyne	KCNH2	16	41
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133889	FF	On-Demand	Anodyne	SIGMAR1	21	56
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133889	FF	On-Demand	Anodyne	SSTR5	50	37
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133889	FF	On-Demand	Anodyne	CCR3	39	45
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133889	FF	On-Demand	Anodyne	MCHR1	49	51
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133890	FF	On-Demand	Anodyne	DRD4	20	44
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133890	FF	On-Demand	Anodyne	KCNH2	16	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133890	FF	On-Demand	Anodyne	SIGMAR1	21	56
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133890	FF	On-Demand	Anodyne	SSTR5	50	37
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133890	FF	On-Demand	Anodyne	CCR3	39	45
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133890	FF	On-Demand	Anodyne	MCHR1	49	51
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133891	FF	On-Demand	Anodyne	DRD4	20	44
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133891	FF	On-Demand	Anodyne	KCNH2	16	41
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133891	FF	On-Demand	Anodyne	SIGMAR1	21	56
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133891	FF	On-Demand	Anodyne	SSTR5	50	37
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133891	FF	On-Demand	Anodyne	CCR3	39	45
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133891	FF	On-Demand	Anodyne	MCHR1	49	51
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133892	FF	On-Demand	Anodyne	DRD4	20	44
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133892	FF	On-Demand	Anodyne	KCNH2	16	41
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133892	FF	On-Demand	Anodyne	SIGMAR1	21	56
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133892	FF	On-Demand	Anodyne	SSTR5	50	37
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133892	FF	On-Demand	Anodyne	CCR3	39	45
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819133892	FF	On-Demand	Anodyne	MCHR1	49	51
Cc1cccc(NC(=O)Nc2cccc(CNC(=O)/C=C/[C@@H]3CCCO3)c2)c1	ZINC000819133907	GH	On-Demand	Anodyne	CCKAR	19	42
Cc1cccc(NC(=O)Nc2cccc(CNC(=O)/C=C/[C@@H]3CCCO3)c2)c1	ZINC000819133907	GH	On-Demand	Anodyne	KCNK3	45	35
Cc1cccc(NC(=O)Nc2cccc(CNC(=O)/C=C/[C@H]3CCCO3)c2)c1	ZINC000819133908	GH	On-Demand	Anodyne	CCKAR	19	42
Cc1cccc(NC(=O)Nc2cccc(CNC(=O)/C=C/[C@H]3CCCO3)c2)c1	ZINC000819133908	GH	On-Demand	Anodyne	KCNK3	45	35
Cc1cccc(NC(=O)Nc2cccc(CNC(=O)/C=C\[C@H]3CCCO3)c2)c1	ZINC000819133909	GH	On-Demand	Anodyne	CCKAR	19	42
Cc1cccc(NC(=O)Nc2cccc(CNC(=O)/C=C\[C@H]3CCCO3)c2)c1	ZINC000819133909	GH	On-Demand	Anodyne	KCNK3	45	35
Cc1cccc(NC(=O)Nc2cccc(CNC(=O)/C=C\[C@@H]3CCCO3)c2)c1	ZINC000819133910	GH	On-Demand	Anodyne	CCKAR	19	42
Cc1cccc(NC(=O)Nc2cccc(CNC(=O)/C=C\[C@@H]3CCCO3)c2)c1	ZINC000819133910	GH	On-Demand	Anodyne	KCNK3	45	35
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H](C)c1ccc(F)cc1	ZINC000819133917	GI	On-Demand	Mild	PAPA1_CARPA	42	49
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H](C)c1ccc(F)cc1	ZINC000819133917	GI	On-Demand	Mild	CTSK	25	41
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H](C)c1ccc(F)cc1	ZINC000819133917	GI	On-Demand	Mild	CTSS	15	49
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H](C)c1ccc(F)cc1	ZINC000819133918	GI	On-Demand	Mild	PAPA1_CARPA	42	49
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H](C)c1ccc(F)cc1	ZINC000819133918	GI	On-Demand	Mild	CTSK	25	41
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H](C)c1ccc(F)cc1	ZINC000819133918	GI	On-Demand	Mild	CTSS	15	49
CN(CCNC[C@H](O)c1cccnc1)Cc1ccc(F)cc1	ZINC000819133933	DD	On-Demand	Anodyne	ADRB2	36	48
CN(CCNC[C@H](O)c1cccnc1)Cc1ccc(F)cc1	ZINC000819133933	DD	On-Demand	Anodyne	ADRB1	48	46
CN(CCNC[C@H](O)c1cccnc1)Cc1ccc(F)cc1	ZINC000819133933	DD	On-Demand	Anodyne	ADRB3	135	49
CN(CCNC[C@H](O)c1cccnc1)Cc1ccc(F)cc1	ZINC000819133933	DD	On-Demand	Anodyne	KCNA5	20	43
O=C(Nc1ccc(Cl)c(C(=O)NC2CC2)c1)C(F)=C1CCC1	ZINC000819133934	DH	On-Demand	Anodyne	ENV	46	41
CN(CCNC[C@@H](O)c1cccnc1)Cc1ccc(F)cc1	ZINC000819133935	DD	On-Demand	Anodyne	ADRB2	36	48
CN(CCNC[C@@H](O)c1cccnc1)Cc1ccc(F)cc1	ZINC000819133935	DD	On-Demand	Anodyne	ADRB1	48	46
CN(CCNC[C@@H](O)c1cccnc1)Cc1ccc(F)cc1	ZINC000819133935	DD	On-Demand	Anodyne	ADRB3	135	49
CN(CCNC[C@@H](O)c1cccnc1)Cc1ccc(F)cc1	ZINC000819133935	DD	On-Demand	Anodyne	KCNA5	20	43
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000819133962	FG	On-Demand	Anodyne	ADRB2	53	41
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000819133962	FG	On-Demand	Anodyne	ADRB1	57	41
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000819133962	FG	On-Demand	Anodyne	ACHE	44	40
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000819133962	FG	On-Demand	Anodyne	SLC6A3	39	47
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000819133962	FG	On-Demand	Anodyne	ADRB3	55	41
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000819133962	FG	On-Demand	Anodyne	SIGMAR1	51	59
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000819133963	FG	On-Demand	Anodyne	ADRB2	53	41
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000819133963	FG	On-Demand	Anodyne	ADRB1	57	41
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000819133963	FG	On-Demand	Anodyne	ACHE	44	40
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000819133963	FG	On-Demand	Anodyne	SLC6A3	39	47
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000819133963	FG	On-Demand	Anodyne	ADRB3	55	41
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000819133963	FG	On-Demand	Anodyne	SIGMAR1	51	59
CNC(=O)Cn1cc(NC(=O)/C=C\[C@H]2CCCO2)cn1	ZINC000819133968	CC	On-Demand	Anodyne	PANC	45	31
CNC(=O)Cn1cc(NC(=O)/C=C/[C@H]2CCCO2)cn1	ZINC000819133970	CC	On-Demand	Anodyne	PANC	45	31
CNC(=O)Cn1cc(NC(=O)/C=C\[C@@H]2CCCO2)cn1	ZINC000819133972	CC	On-Demand	Anodyne	PANC	45	31
CNC(=O)Cn1cc(NC(=O)/C=C/[C@@H]2CCCO2)cn1	ZINC000819133973	CC	On-Demand	Anodyne	PANC	45	31
O[C@@H](CNCCC1CCN(CC(F)(F)F)CC1)c1cccc(F)c1	ZINC000819133995	EG	On-Demand	Anodyne	SLC6A3	18	40
O[C@@H](CNCCC1CCN(CC(F)(F)F)CC1)c1cccc(F)c1	ZINC000819133995	EG	On-Demand	Anodyne	HPGDS	34	44
O[C@H](CNCCC1CCN(CC(F)(F)F)CC1)c1cccc(F)c1	ZINC000819133997	EG	On-Demand	Anodyne	SLC6A3	18	40
O[C@H](CNCCC1CCN(CC(F)(F)F)CC1)c1cccc(F)c1	ZINC000819133997	EG	On-Demand	Anodyne	HPGDS	34	44
O[C@H](CNCCC1CCN(CC(F)(F)F)CC1)c1cc2ccccc2o1	ZINC000819134067	FH	On-Demand	Anodyne	ACHE	17	46
CCCNC(=O)c1ccc(Cl)cc1NC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819134080	GH	On-Demand	Anodyne	RORC	29	40
CCc1nc2cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc2o1	ZINC000819134089	GH	On-Demand	Mild	PAPA1_CARPA	37	41
COc1ccc(OC)c([C@H](O)CNCCN(C)Cc2ccc(F)cc2)c1	ZINC000819134110	FF	On-Demand	Anodyne	ADRB2	30	46
COc1ccc(OC)c([C@H](O)CNCCN(C)Cc2ccc(F)cc2)c1	ZINC000819134110	FF	On-Demand	Anodyne	ADRB1	28	42
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1cc(F)c(N2CCCC2)c(F)c1	ZINC000819134135	GG	On-Demand	Anodyne	KCNQ2	27	42
Cc1cccc(CNC(=O)C(F)=C2CCC2)n1	ZINC000819134148	BE	On-Demand	Anodyne	PDE8B	42	37
COC(=O)c1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819134151	ED	On-Demand	Anodyne	ADRB2	48	45
COC(=O)c1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819134151	ED	On-Demand	Anodyne	ADRB1	70	44
COC(=O)c1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819134151	ED	On-Demand	Anodyne	ADRB3	53	49
COC(=O)c1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819134152	ED	On-Demand	Anodyne	ADRB2	48	45
COC(=O)c1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819134152	ED	On-Demand	Anodyne	ADRB1	70	44
COC(=O)c1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819134152	ED	On-Demand	Anodyne	ADRB3	53	49
C=C(Cl)CSc1nc(C)c(CC(=O)NCc2cccc(C)n2)s1	ZINC000819134163	FH	On-Demand	Mild	NPY1R	23	40
C[C@H](CNC[C@H](O)c1cccnc1)c1ccncc1	ZINC000819134174	CD	On-Demand	Anodyne	ADRB2	26	45
C[C@H](CNC[C@H](O)c1cccnc1)c1ccncc1	ZINC000819134174	CD	On-Demand	Anodyne	ADRB1	27	45
C[C@H](CNC[C@H](O)c1cccnc1)c1ccncc1	ZINC000819134174	CD	On-Demand	Anodyne	ADRB3	98	47
C[C@H](CNC[C@@H](O)c1cccnc1)c1ccncc1	ZINC000819134175	CD	On-Demand	Anodyne	ADRB2	26	45
C[C@H](CNC[C@@H](O)c1cccnc1)c1ccncc1	ZINC000819134175	CD	On-Demand	Anodyne	ADRB1	27	45
C[C@H](CNC[C@@H](O)c1cccnc1)c1ccncc1	ZINC000819134175	CD	On-Demand	Anodyne	ADRB3	98	47
C[C@@H](CNC[C@@H](O)c1cccnc1)c1ccncc1	ZINC000819134176	CD	On-Demand	Anodyne	ADRB2	26	45
C[C@@H](CNC[C@@H](O)c1cccnc1)c1ccncc1	ZINC000819134176	CD	On-Demand	Anodyne	ADRB1	27	45
C[C@@H](CNC[C@@H](O)c1cccnc1)c1ccncc1	ZINC000819134176	CD	On-Demand	Anodyne	ADRB3	98	47
C[C@@H](CNC[C@H](O)c1cccnc1)c1ccncc1	ZINC000819134177	CD	On-Demand	Anodyne	ADRB2	26	45
C[C@@H](CNC[C@H](O)c1cccnc1)c1ccncc1	ZINC000819134177	CD	On-Demand	Anodyne	ADRB1	27	45
C[C@@H](CNC[C@H](O)c1cccnc1)c1ccncc1	ZINC000819134177	CD	On-Demand	Anodyne	ADRB3	98	47
C[C@@H](CC(=O)NCc1ccc(Cl)nc1)n1cccn1	ZINC000819134262	CE	On-Demand	Anodyne	NACHRBETA2	50	41
C[C@H](CC(=O)NCc1ccc(Cl)nc1)n1cccn1	ZINC000819134263	CE	On-Demand	Anodyne	NACHRBETA2	50	41
CSc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819134273	EE	On-Demand	Anodyne	ADRB2	33	45
CSc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819134273	EE	On-Demand	Anodyne	ADRB1	42	45
CSc1ccc(OC[C@@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819134273	EE	On-Demand	Anodyne	ADRB3	28	45
CSc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819134277	EE	On-Demand	Anodyne	ADRB2	33	45
CSc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819134277	EE	On-Demand	Anodyne	ADRB1	42	45
CSc1ccc(OC[C@H](O)CNC2CCC(C)(O)CC2)cc1	ZINC000819134277	EE	On-Demand	Anodyne	ADRB3	28	45
COC(=O)c1ccc(CCNC(=O)c2ccc(NS(=O)(=O)/C=C\c3ccccc3)cc2)cc1	ZINC000819134291	JH	On-Demand	Anodyne	CA2	15	46
COC(=O)c1ccc(CCNC(=O)c2ccc(NS(=O)(=O)/C=C\c3ccccc3)cc2)cc1	ZINC000819134291	JH	On-Demand	Anodyne	ADRB2	18	40
COC(=O)c1ccc(CCNC(=O)c2ccc(NS(=O)(=O)/C=C\c3ccccc3)cc2)cc1	ZINC000819134291	JH	On-Demand	Anodyne	ADRB1	22	40
COC(=O)c1ccc(CCNC(=O)c2ccc(NS(=O)(=O)/C=C\c3ccccc3)cc2)cc1	ZINC000819134291	JH	On-Demand	Anodyne	ADRB3	30	40
COC(=O)c1ccc(CCNC(=O)c2ccc(NS(=O)(=O)/C=C\c3ccccc3)cc2)cc1	ZINC000819134291	JH	On-Demand	Anodyne	PTPRB	49	40
CN1CCC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1=O	ZINC000819134307	DD	On-Demand	Anodyne	RBP4	50	36
CN1CCC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1=O	ZINC000819134308	DD	On-Demand	Anodyne	RBP4	50	36
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1Cl	ZINC000819134409	DG	On-Demand	Anodyne	ADRB2	16	41
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1Cl	ZINC000819134409	DG	On-Demand	Anodyne	ADRB1	22	41
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1Cl	ZINC000819134409	DG	On-Demand	Anodyne	ADRB3	77	41
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1Cl	ZINC000819134410	DG	On-Demand	Anodyne	ADRB2	16	41
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1Cl	ZINC000819134410	DG	On-Demand	Anodyne	ADRB1	22	41
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1Cl	ZINC000819134410	DG	On-Demand	Anodyne	ADRB3	77	41
CN(CCNC[C@@H](O)c1cccc(Cl)c1)Cc1ccc(F)cc1	ZINC000819134412	EG	On-Demand	Anodyne	ADRB2	61	42
CN(CCNC[C@@H](O)c1cccc(Cl)c1)Cc1ccc(F)cc1	ZINC000819134412	EG	On-Demand	Anodyne	ADRB1	70	52
CN(CCNC[C@@H](O)c1cccc(Cl)c1)Cc1ccc(F)cc1	ZINC000819134412	EG	On-Demand	Anodyne	ADRB3	97	56
CN(CCNC[C@@H](O)c1cccc(Cl)c1)Cc1ccc(F)cc1	ZINC000819134412	EG	On-Demand	Anodyne	UL54	48	33
CN(CCNC[C@H](O)c1cccc(Cl)c1)Cc1ccc(F)cc1	ZINC000819134413	EG	On-Demand	Anodyne	ADRB2	61	42
CN(CCNC[C@H](O)c1cccc(Cl)c1)Cc1ccc(F)cc1	ZINC000819134413	EG	On-Demand	Anodyne	ADRB1	70	52
CN(CCNC[C@H](O)c1cccc(Cl)c1)Cc1ccc(F)cc1	ZINC000819134413	EG	On-Demand	Anodyne	ADRB3	97	56
CN(CCNC[C@H](O)c1cccc(Cl)c1)Cc1ccc(F)cc1	ZINC000819134413	EG	On-Demand	Anodyne	UL54	48	33
CN(CCNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1	ZINC000819134423	EE	On-Demand	Bother	MMP8	26	43
CN(CCNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1	ZINC000819134423	EE	On-Demand	Bother	MMP1	23	43
CN(CCNC[C@H](O)c1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1	ZINC000819134424	EE	On-Demand	Bother	MMP8	26	43
CN(CCNC[C@H](O)c1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1	ZINC000819134424	EE	On-Demand	Bother	MMP1	23	43
CS(=O)(=O)CC1(CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819134453	DD	On-Demand	Anodyne	ADRB1	26	40
CS(=O)(=O)CC1(CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819134453	DD	On-Demand	Anodyne	ADRB3	52	43
CS(=O)(=O)CC1(CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819134454	DD	On-Demand	Anodyne	ADRB1	26	40
CS(=O)(=O)CC1(CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819134454	DD	On-Demand	Anodyne	ADRB3	52	43
O[C@@H](CNCCC1CCN(CC(F)(F)F)CC1)c1ccc(F)c(F)c1	ZINC000819134463	FG	On-Demand	Anodyne	SLC6A3	17	44
O[C@H](CNCCC1CCN(CC(F)(F)F)CC1)c1ccc(F)c(F)c1	ZINC000819134464	FG	On-Demand	Anodyne	SLC6A3	17	44
C=C(C)C(C)(C)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1OC	ZINC000819134479	GH	On-Demand	Mild	FPR1	40	34
C=C(C)C(C)(C)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1OC	ZINC000819134480	GH	On-Demand	Mild	FPR1	40	34
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134491	GH	On-Demand	Anodyne	ADRB2	54	40
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134491	GH	On-Demand	Anodyne	ADRB1	44	40
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134491	GH	On-Demand	Anodyne	DRD2	16	48
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134491	GH	On-Demand	Anodyne	DRD4	33	42
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134491	GH	On-Demand	Anodyne	ACHE	32	43
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134491	GH	On-Demand	Anodyne	SLC6A4	24	53
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134491	GH	On-Demand	Anodyne	SLC6A3	64	53
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134491	GH	On-Demand	Anodyne	CHRM3	19	41
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134491	GH	On-Demand	Anodyne	ADRB3	36	40
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134491	GH	On-Demand	Anodyne	SIGMAR1	50	57
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134491	GH	On-Demand	Anodyne	BCHE	15	45
O[C@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134491	GH	On-Demand	Anodyne	CACNA1G	37	40
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134492	GH	On-Demand	Anodyne	ADRB2	54	40
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134492	GH	On-Demand	Anodyne	ADRB1	44	40
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134492	GH	On-Demand	Anodyne	DRD2	16	48
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134492	GH	On-Demand	Anodyne	DRD4	33	42
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134492	GH	On-Demand	Anodyne	ACHE	32	43
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134492	GH	On-Demand	Anodyne	SLC6A4	24	53
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134492	GH	On-Demand	Anodyne	SLC6A3	64	53
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134492	GH	On-Demand	Anodyne	CHRM3	19	41
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134492	GH	On-Demand	Anodyne	ADRB3	36	40
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134492	GH	On-Demand	Anodyne	SIGMAR1	50	57
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134492	GH	On-Demand	Anodyne	BCHE	15	45
O[C@@H](CNCCCOC1CCN(Cc2ccccc2)CC1)c1ccc(F)cc1	ZINC000819134492	GH	On-Demand	Anodyne	CACNA1G	37	40
COc1cccc([S@@](=O)CC(=O)NCCCN(C)C(=O)OC(C)(C)C)c1	ZINC000819134543	GE	On-Demand	Anodyne	MTNR1A	38	41
COc1cccc([S@@](=O)CC(=O)NCCCN(C)C(=O)OC(C)(C)C)c1	ZINC000819134543	GE	On-Demand	Anodyne	MTNR1B	35	41
COc1cccc([S@@](=O)CC(=O)NCCN2C(=O)CSC2=O)c1	ZINC000819134574	FC	On-Demand	Anodyne	DRD4	46	35
CN(CCNC[C@@H](O)c1cc(F)ccc1F)Cc1ccc(F)cc1	ZINC000819134620	EF	On-Demand	Anodyne	LEF	47	34
CN(CCNC[C@H](O)c1cc(F)ccc1F)Cc1ccc(F)cc1	ZINC000819134621	EF	On-Demand	Anodyne	LEF	47	34
CN(CCNC[C@@H](O)c1ccc(F)c(F)c1)Cc1ccc(F)cc1	ZINC000819134624	EF	On-Demand	Anodyne	ADRB2	30	43
CN(CCNC[C@@H](O)c1ccc(F)c(F)c1)Cc1ccc(F)cc1	ZINC000819134624	EF	On-Demand	Anodyne	ADRB3	43	38
CN(CCNC[C@H](O)c1ccc(F)c(F)c1)Cc1ccc(F)cc1	ZINC000819134625	EF	On-Demand	Anodyne	ADRB2	30	43
CN(CCNC[C@H](O)c1ccc(F)c(F)c1)Cc1ccc(F)cc1	ZINC000819134625	EF	On-Demand	Anodyne	ADRB3	43	38
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(OCCc2ccccc2)c1	ZINC000819134673	EH	On-Demand	Anodyne	EPHX2	19	41
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(OCCc2ccccc2)c1	ZINC000819134674	EH	On-Demand	Anodyne	EPHX2	19	41
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(OCCc2ccccc2)c1	ZINC000819134675	EH	On-Demand	Anodyne	EPHX2	19	41
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(OCCc2ccccc2)c1	ZINC000819134676	EH	On-Demand	Anodyne	EPHX2	19	41
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1F	ZINC000819134724	DF	On-Demand	Anodyne	ADRB2	18	41
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1F	ZINC000819134724	DF	On-Demand	Anodyne	ADRB1	22	41
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1F	ZINC000819134724	DF	On-Demand	Anodyne	ADRB3	84	41
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1F	ZINC000819134725	DF	On-Demand	Anodyne	ADRB2	18	41
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1F	ZINC000819134725	DF	On-Demand	Anodyne	ADRB1	22	41
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1F	ZINC000819134725	DF	On-Demand	Anodyne	ADRB3	84	41
COC(=O)c1ccc(CCNC(=O)c2cccc(S(=O)(=O)NCc3ccc4c(c3)OCO4)c2)cc1	ZINC000819134731	JF	On-Demand	Anodyne	BMP1	65	47
COC(=O)c1ccc(CCNC(=O)c2cccc(S(=O)(=O)NCc3ccc4c(c3)OCO4)c2)cc1	ZINC000819134731	JF	On-Demand	Anodyne	KCNA5	16	41
CN(CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)Cc1ccc(F)cc1	ZINC000819134737	FH	On-Demand	Anodyne	ADRB2	23	40
CN(CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)Cc1ccc(F)cc1	ZINC000819134737	FH	On-Demand	Anodyne	ADRB3	51	39
CN(CCNC[C@H](O)c1cccc(C(F)(F)F)c1)Cc1ccc(F)cc1	ZINC000819134738	FH	On-Demand	Anodyne	ADRB2	23	40
CN(CCNC[C@H](O)c1cccc(C(F)(F)F)c1)Cc1ccc(F)cc1	ZINC000819134738	FH	On-Demand	Anodyne	ADRB3	51	39
CN(CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Cc1ccc(F)cc1	ZINC000819134770	EE	On-Demand	Bother	ADRB3	52	39
CN(CCNC[C@H](O)c1cccc([N+](=O)[O-])c1)Cc1ccc(F)cc1	ZINC000819134771	EE	On-Demand	Bother	ADRB3	52	39
CN(CCNCCC(=O)Nc1ccc(N(C)C)cc1)Cc1ccc(F)cc1	ZINC000819134929	FF	On-Demand	Anodyne	LTA4H	20	47
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819134932	GF	On-Demand	Anodyne	DRD4	25	43
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819134932	GF	On-Demand	Anodyne	ACHE	30	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819134932	GF	On-Demand	Anodyne	SIGMAR1	32	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819134933	GF	On-Demand	Anodyne	DRD4	25	43
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819134933	GF	On-Demand	Anodyne	ACHE	30	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819134933	GF	On-Demand	Anodyne	SIGMAR1	32	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819134934	GF	On-Demand	Anodyne	DRD4	25	43
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819134934	GF	On-Demand	Anodyne	ACHE	30	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819134934	GF	On-Demand	Anodyne	SIGMAR1	32	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819134935	GF	On-Demand	Anodyne	DRD4	25	43
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819134935	GF	On-Demand	Anodyne	ACHE	30	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819134935	GF	On-Demand	Anodyne	SIGMAR1	32	40
CN(CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Cc1ccc(F)cc1	ZINC000819134941	GD	On-Demand	Anodyne	ADRB2	22	42
CN(CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)Cc1ccc(F)cc1	ZINC000819134941	GD	On-Demand	Anodyne	ADRB3	51	39
CN(CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Cc1ccc(F)cc1	ZINC000819134942	GD	On-Demand	Anodyne	ADRB2	22	42
CN(CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)Cc1ccc(F)cc1	ZINC000819134942	GD	On-Demand	Anodyne	ADRB3	51	39
Cc1ccccc1[C@@H](O)CNCCN(C)Cc1ccc(F)cc1	ZINC000819134945	DF	On-Demand	Anodyne	LEF	41	32
CCOc1cc(C)ccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819134947	GH	On-Demand	Mild	PAPA1_CARPA	40	44
CCOc1cc(C)ccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819134948	GH	On-Demand	Mild	PAPA1_CARPA	40	44
COC(=O)c1ccc(CCNC(=O)c2cc(S(=O)(=O)NCC(C)C)c(Cl)cc2Cl)cc1	ZINC000819134949	JH	On-Demand	Anodyne	ADRB3	42	36
CN(CCNC[C@@H](O)c1ccc(Br)cc1)Cc1ccc(F)cc1	ZINC000819134962	GG	On-Demand	Anodyne	ADRB2	16	43
CN(CCNC[C@H](O)c1ccc(Br)cc1)Cc1ccc(F)cc1	ZINC000819134963	GG	On-Demand	Anodyne	ADRB2	16	43
CN(CCNC[C@@H](O)c1ccccc1)Cc1ccc(F)cc1	ZINC000819134987	DF	On-Demand	Anodyne	ADRB2	43	48
CN(CCNC[C@@H](O)c1ccccc1)Cc1ccc(F)cc1	ZINC000819134987	DF	On-Demand	Anodyne	ADRB1	52	41
CN(CCNC[C@@H](O)c1ccccc1)Cc1ccc(F)cc1	ZINC000819134987	DF	On-Demand	Anodyne	ADRB3	86	46
CN(CCNC[C@@H](O)c1ccccc1)Cc1ccc(F)cc1	ZINC000819134987	DF	On-Demand	Anodyne	AOC3	17	40
CN(CCNC[C@H](O)c1ccccc1)Cc1ccc(F)cc1	ZINC000819134988	DF	On-Demand	Anodyne	ADRB2	43	48
CN(CCNC[C@H](O)c1ccccc1)Cc1ccc(F)cc1	ZINC000819134988	DF	On-Demand	Anodyne	ADRB1	52	41
CN(CCNC[C@H](O)c1ccccc1)Cc1ccc(F)cc1	ZINC000819134988	DF	On-Demand	Anodyne	ADRB3	86	46
CN(CCNC[C@H](O)c1ccccc1)Cc1ccc(F)cc1	ZINC000819134988	DF	On-Demand	Anodyne	AOC3	17	40
CN(C)[C@@H]1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819135026	CF	On-Demand	Anodyne	ADRB1	36	46
CN(C)[C@@H]1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819135026	CF	On-Demand	Anodyne	ADRB3	55	52
CN(C)[C@@H]1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819135026	CF	On-Demand	Anodyne	IGF1R	24	40
CN(C)[C@@H]1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819135026	CF	On-Demand	Anodyne	CYP3A4	41	40
CN(C)[C@@H]1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819135027	CF	On-Demand	Anodyne	ADRB1	36	46
CN(C)[C@@H]1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819135027	CF	On-Demand	Anodyne	ADRB3	55	52
CN(C)[C@@H]1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819135027	CF	On-Demand	Anodyne	IGF1R	24	40
CN(C)[C@@H]1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819135027	CF	On-Demand	Anodyne	CYP3A4	41	40
CN(C)[C@@H]1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819135028	CF	On-Demand	Anodyne	ADRB1	36	46
CN(C)[C@@H]1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819135028	CF	On-Demand	Anodyne	ADRB3	55	52
CN(C)[C@@H]1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819135028	CF	On-Demand	Anodyne	IGF1R	24	40
CN(C)[C@@H]1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819135028	CF	On-Demand	Anodyne	CYP3A4	41	40
CN(C)[C@@H]1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819135029	CF	On-Demand	Anodyne	ADRB1	36	46
CN(C)[C@@H]1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819135029	CF	On-Demand	Anodyne	ADRB3	55	52
CN(C)[C@@H]1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819135029	CF	On-Demand	Anodyne	IGF1R	24	40
CN(C)[C@@H]1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819135029	CF	On-Demand	Anodyne	CYP3A4	41	40
CN(CCNC[C@@H](O)c1ccc(Cl)c(F)c1)Cc1ccc(F)cc1	ZINC000819135062	FG	On-Demand	Anodyne	ADRB2	23	40
CN(CCNC[C@H](O)c1ccc(Cl)c(F)c1)Cc1ccc(F)cc1	ZINC000819135063	FG	On-Demand	Anodyne	ADRB2	23	40
CN(CCNC[C@@H](O)c1ccc(C(F)(F)F)cc1)Cc1ccc(F)cc1	ZINC000819135064	FH	On-Demand	Anodyne	PLA2G7	46	34
CN(CCNC[C@H](O)c1ccc(C(F)(F)F)cc1)Cc1ccc(F)cc1	ZINC000819135065	FH	On-Demand	Anodyne	PLA2G7	46	34
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccccc1Br	ZINC000819135066	FH	On-Demand	Anodyne	ADRB1	17	44
C[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccccc1Br	ZINC000819135067	FH	On-Demand	Anodyne	ADRB1	17	44
C[C@H](CNC[C@@H](O)c1cccc(F)c1)Oc1ccccc1Br	ZINC000819135068	FH	On-Demand	Anodyne	ADRB1	17	44
C[C@H](CNC[C@H](O)c1cccc(F)c1)Oc1ccccc1Br	ZINC000819135069	FH	On-Demand	Anodyne	ADRB1	17	44
O=C(C#Cc1ccc2c(c1)OCO2)NCc1ccc(C(=O)O)cc1	ZINC000819135087	DD	On-Demand	Mild	NOS2	80	34
O=C(C(=O)N1CCC[C@H]1C(=O)O)c1ccc(F)cc1	ZINC000819135089	CD	On-Demand	Anodyne	ACE	59	54
O=C(C(=O)N1CCC[C@H]1C(=O)O)c1ccc(F)cc1	ZINC000819135089	CD	On-Demand	Anodyne	FKBP1A	49	43
O=C(C(=O)N1CCC[C@H]1C(=O)O)c1ccc(F)cc1	ZINC000819135089	CD	On-Demand	Anodyne	SLC6A1	42	35
O=C(C(=O)N1CCC[C@H]1C(=O)O)c1ccc(F)cc1	ZINC000819135089	CD	On-Demand	Anodyne	ELANE	20	40
O=C(C(=O)N1CCC[C@H]1C(=O)O)c1ccc(F)cc1	ZINC000819135089	CD	On-Demand	Anodyne	PREP	72	42
O=C(C(=O)N1CCC[C@@H]1C(=O)O)c1ccc(F)cc1	ZINC000819135090	CD	On-Demand	Anodyne	ACE	59	54
O=C(C(=O)N1CCC[C@@H]1C(=O)O)c1ccc(F)cc1	ZINC000819135090	CD	On-Demand	Anodyne	FKBP1A	49	43
O=C(C(=O)N1CCC[C@@H]1C(=O)O)c1ccc(F)cc1	ZINC000819135090	CD	On-Demand	Anodyne	SLC6A1	42	35
O=C(C(=O)N1CCC[C@@H]1C(=O)O)c1ccc(F)cc1	ZINC000819135090	CD	On-Demand	Anodyne	ELANE	20	40
O=C(C(=O)N1CCC[C@@H]1C(=O)O)c1ccc(F)cc1	ZINC000819135090	CD	On-Demand	Anodyne	PREP	72	42
O=C(C#Cc1ccc2c(c1)OCO2)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135105	ED	On-Demand	Mild	ACE	57	45
O=C(C#Cc1ccc2c(c1)OCO2)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135105	ED	On-Demand	Mild	MME	131	54
O=C(C#Cc1ccc2c(c1)OCO2)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135105	ED	On-Demand	Mild	ANPEP	63	38
O=C(C#Cc1ccc2c(c1)OCO2)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135105	ED	On-Demand	Mild	FCER2	40	31
O=C(C#Cc1ccc2c(c1)OCO2)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135105	ED	On-Demand	Mild	CTSB	25	41
O=C(C#Cc1ccc2c(c1)OCO2)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135105	ED	On-Demand	Mild	PAPA1_CARPA	40	36
O=C(C#Cc1ccc2c(c1)OCO2)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135105	ED	On-Demand	Mild	CTSL	26	41
O=C(C#Cc1ccc2c(c1)OCO2)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135105	ED	On-Demand	Mild	CPA1	48	42
O=C(C#Cc1ccc2c(c1)OCO2)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135105	ED	On-Demand	Mild	NPFFR2	43	38
O=C(C#Cc1ccc2c(c1)OCO2)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135105	ED	On-Demand	Mild	NAALAD2	24	41
O=C(C#Cc1ccc2c(c1)OCO2)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135105	ED	On-Demand	Mild	ECE1	55	40
O=C(C#Cc1ccc2c(c1)OCO2)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135105	ED	On-Demand	Mild	CAPN1	50	45
O=C(C#Cc1ccc2c(c1)OCO2)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135105	ED	On-Demand	Mild	ACE2	89	42
O=C(C#Cc1ccc2c(c1)OCO2)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135105	ED	On-Demand	Mild	MMP1	15	52
O=C(C#Cc1ccc2c(c1)OCO2)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135105	ED	On-Demand	Mild	FPR1	77	40
O=C(C#Cc1ccc2c(c1)OCO2)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135105	ED	On-Demand	Mild	BLA1_STEMA	79	40
O=C(C#Cc1ccc2c(c1)OCO2)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135105	ED	On-Demand	Mild	NPFFR1	62	38
O=C(C#Cc1ccc2c(c1)OCO2)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135106	ED	On-Demand	Mild	ACE	57	45
O=C(C#Cc1ccc2c(c1)OCO2)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135106	ED	On-Demand	Mild	MME	131	54
O=C(C#Cc1ccc2c(c1)OCO2)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135106	ED	On-Demand	Mild	ANPEP	63	38
O=C(C#Cc1ccc2c(c1)OCO2)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135106	ED	On-Demand	Mild	FCER2	40	31
O=C(C#Cc1ccc2c(c1)OCO2)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135106	ED	On-Demand	Mild	CTSB	25	41
O=C(C#Cc1ccc2c(c1)OCO2)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135106	ED	On-Demand	Mild	PAPA1_CARPA	40	36
O=C(C#Cc1ccc2c(c1)OCO2)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135106	ED	On-Demand	Mild	CTSL	26	41
O=C(C#Cc1ccc2c(c1)OCO2)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135106	ED	On-Demand	Mild	CPA1	48	42
O=C(C#Cc1ccc2c(c1)OCO2)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135106	ED	On-Demand	Mild	NPFFR2	43	38
O=C(C#Cc1ccc2c(c1)OCO2)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135106	ED	On-Demand	Mild	NAALAD2	24	41
O=C(C#Cc1ccc2c(c1)OCO2)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135106	ED	On-Demand	Mild	ECE1	55	40
O=C(C#Cc1ccc2c(c1)OCO2)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135106	ED	On-Demand	Mild	CAPN1	50	45
O=C(C#Cc1ccc2c(c1)OCO2)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135106	ED	On-Demand	Mild	ACE2	89	42
O=C(C#Cc1ccc2c(c1)OCO2)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135106	ED	On-Demand	Mild	MMP1	15	52
O=C(C#Cc1ccc2c(c1)OCO2)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135106	ED	On-Demand	Mild	FPR1	77	40
O=C(C#Cc1ccc2c(c1)OCO2)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135106	ED	On-Demand	Mild	BLA1_STEMA	79	40
O=C(C#Cc1ccc2c(c1)OCO2)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135106	ED	On-Demand	Mild	NPFFR1	62	38
O=C(C=NOCc1ccc(C(=O)O)cc1)Nc1cccc(F)c1	ZINC000819135107	DF	On-Demand	Mild	KCNK3	23	40
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)NCc1ccc(C(=O)O)cc1	ZINC000819135108	GE	On-Demand	Anodyne	HDAC1	15	42
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)NCc1ccc(C(=O)O)cc1	ZINC000819135108	GE	On-Demand	Anodyne	TPSAB1	16	41
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)NCc1ccc(C(=O)O)cc1	ZINC000819135108	GE	On-Demand	Anodyne	TMPRSS11D	50	32
O=C(C[C@H](C(=O)O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819135112	EE	On-Demand	Anodyne	FURIN	48	35
O=C(C[C@H](C(=O)O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819135112	EE	On-Demand	Anodyne	TPSAB1	15	42
O=C(C[C@@H](C(=O)O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819135113	EE	On-Demand	Anodyne	FURIN	48	35
O=C(C[C@@H](C(=O)O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819135113	EE	On-Demand	Anodyne	TPSAB1	15	42
O=C(C=NOCc1ccc(C(=O)O)cc1)Nc1ccc(F)cc1	ZINC000819135122	DF	On-Demand	Mild	LTA4H	20	43
O=C(C=NOCc1ccc(C(=O)O)cc1)Nc1ccc(F)cc1	ZINC000819135122	DF	On-Demand	Mild	TGM2	15	41
O=C(C=NOCc1ccc(C(=O)O)cc1)Nc1ccc(F)cc1	ZINC000819135122	DF	On-Demand	Mild	F13A1	30	41
O=C(C[C@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135123	CC	On-Demand	Anodyne	ACE	74	50
O=C(C[C@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135123	CC	On-Demand	Anodyne	MME	128	46
O=C(C[C@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135123	CC	On-Demand	Anodyne	ANPEP	63	39
O=C(C[C@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135123	CC	On-Demand	Anodyne	FCER2	41	35
O=C(C[C@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135123	CC	On-Demand	Anodyne	CTSB	20	41
O=C(C[C@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135123	CC	On-Demand	Anodyne	CPA1	57	43
O=C(C[C@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135123	CC	On-Demand	Anodyne	ITGA4	45	40
O=C(C[C@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135123	CC	On-Demand	Anodyne	NAALAD2	25	43
O=C(C[C@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135123	CC	On-Demand	Anodyne	ECE1	40	40
O=C(C[C@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135123	CC	On-Demand	Anodyne	CAPN1	69	42
O=C(C[C@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135123	CC	On-Demand	Anodyne	MMP9	15	40
O=C(C[C@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135123	CC	On-Demand	Anodyne	ACE2	99	46
O=C(C[C@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135123	CC	On-Demand	Anodyne	FPR1	79	39
O=C(C[C@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135123	CC	On-Demand	Anodyne	BLA1_STEMA	76	44
O=C(C[C@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135123	CC	On-Demand	Anodyne	BRCA1	44	31
O=C(C[C@@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135124	CC	On-Demand	Anodyne	ACE	74	50
O=C(C[C@@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135124	CC	On-Demand	Anodyne	MME	128	46
O=C(C[C@@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135124	CC	On-Demand	Anodyne	ANPEP	63	39
O=C(C[C@@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135124	CC	On-Demand	Anodyne	FCER2	41	35
O=C(C[C@@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135124	CC	On-Demand	Anodyne	CTSB	20	41
O=C(C[C@@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135124	CC	On-Demand	Anodyne	CPA1	57	43
O=C(C[C@@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135124	CC	On-Demand	Anodyne	ITGA4	45	40
O=C(C[C@@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135124	CC	On-Demand	Anodyne	NAALAD2	25	43
O=C(C[C@@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135124	CC	On-Demand	Anodyne	ECE1	40	40
O=C(C[C@@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135124	CC	On-Demand	Anodyne	CAPN1	69	42
O=C(C[C@@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135124	CC	On-Demand	Anodyne	MMP9	15	40
O=C(C[C@@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135124	CC	On-Demand	Anodyne	ACE2	99	46
O=C(C[C@@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135124	CC	On-Demand	Anodyne	FPR1	79	39
O=C(C[C@@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135124	CC	On-Demand	Anodyne	BLA1_STEMA	76	44
O=C(C[C@@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135124	CC	On-Demand	Anodyne	BRCA1	44	31
O=C(C[C@@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135125	CC	On-Demand	Anodyne	ACE	74	50
O=C(C[C@@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135125	CC	On-Demand	Anodyne	MME	128	46
O=C(C[C@@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135125	CC	On-Demand	Anodyne	ANPEP	63	39
O=C(C[C@@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135125	CC	On-Demand	Anodyne	FCER2	41	35
O=C(C[C@@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135125	CC	On-Demand	Anodyne	CTSB	20	41
O=C(C[C@@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135125	CC	On-Demand	Anodyne	CPA1	57	43
O=C(C[C@@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135125	CC	On-Demand	Anodyne	ITGA4	45	40
O=C(C[C@@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135125	CC	On-Demand	Anodyne	NAALAD2	25	43
O=C(C[C@@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135125	CC	On-Demand	Anodyne	ECE1	40	40
O=C(C[C@@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135125	CC	On-Demand	Anodyne	CAPN1	69	42
O=C(C[C@@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135125	CC	On-Demand	Anodyne	MMP9	15	40
O=C(C[C@@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135125	CC	On-Demand	Anodyne	ACE2	99	46
O=C(C[C@@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135125	CC	On-Demand	Anodyne	FPR1	79	39
O=C(C[C@@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135125	CC	On-Demand	Anodyne	BLA1_STEMA	76	44
O=C(C[C@@H]1COC(=O)C1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819135125	CC	On-Demand	Anodyne	BRCA1	44	31
O=C(C[C@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135126	CC	On-Demand	Anodyne	ACE	74	50
O=C(C[C@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135126	CC	On-Demand	Anodyne	MME	128	46
O=C(C[C@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135126	CC	On-Demand	Anodyne	ANPEP	63	39
O=C(C[C@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135126	CC	On-Demand	Anodyne	FCER2	41	35
O=C(C[C@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135126	CC	On-Demand	Anodyne	CTSB	20	41
O=C(C[C@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135126	CC	On-Demand	Anodyne	CPA1	57	43
O=C(C[C@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135126	CC	On-Demand	Anodyne	ITGA4	45	40
O=C(C[C@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135126	CC	On-Demand	Anodyne	NAALAD2	25	43
O=C(C[C@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135126	CC	On-Demand	Anodyne	ECE1	40	40
O=C(C[C@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135126	CC	On-Demand	Anodyne	CAPN1	69	42
O=C(C[C@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135126	CC	On-Demand	Anodyne	MMP9	15	40
O=C(C[C@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135126	CC	On-Demand	Anodyne	ACE2	99	46
O=C(C[C@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135126	CC	On-Demand	Anodyne	FPR1	79	39
O=C(C[C@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135126	CC	On-Demand	Anodyne	BLA1_STEMA	76	44
O=C(C[C@H]1COC(=O)C1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135126	CC	On-Demand	Anodyne	BRCA1	44	31
O=C(CC1(C(=O)O)CCCC1)NCc1ccc(C(=O)O)cc1	ZINC000819135127	DE	On-Demand	Anodyne	RARA	41	32
O=C(C[C@@]1(C(=O)O)CCSC1)NCc1ccc(C(=O)O)cc1	ZINC000819135148	DD	On-Demand	Anodyne	RARA	40	32
O=C(C[C@]1(C(=O)O)CCSC1)NCc1ccc(C(=O)O)cc1	ZINC000819135149	DD	On-Demand	Anodyne	RARA	40	32
O=C(C[C@H]1CCCO1)OCc1ccc(C(=O)O)cc1	ZINC000819135150	CD	On-Demand	Anodyne	SLC12A5	45	34
O=C(C[C@@H]1CCCO1)OCc1ccc(C(=O)O)cc1	ZINC000819135153	CD	On-Demand	Anodyne	SLC12A5	45	34
O=C(CC1(CO)CC1)OCc1ccc(C(=O)O)cc1	ZINC000819135156	CD	On-Demand	Anodyne	SLC12A5	56	34
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	ACE	66	52
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	OPRM1	25	40
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	OPRD1	24	40
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	MME	119	45
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	ANPEP	62	38
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	CMA1	45	44
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	CTSB	21	40
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	CYSP_TRYCR	50	34
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	CPA1	50	41
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	ITGA4	37	40
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	NAALAD2	31	45
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	CAPNS1	47	36
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	ECE1	43	40
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	CAPN1	47	42
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	CAPN2	29	40
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	ACE2	94	45
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	FPR1	66	39
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	BLA1_STEMA	77	44
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	BRCA1	55	36
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	NPFFR1	53	32
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819135164	GE	On-Demand	Anodyne	GPR142	40	33
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](C(=O)O)c1ccccc1	ZINC000819135166	GE	On-Demand	Anodyne	NAALAD2	21	43
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)N[C@H](C(=O)O)c1ccccc1	ZINC000819135166	GE	On-Demand	Anodyne	GSTP1	17	41
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1Br	ZINC000819135174	GG	On-Demand	Bother	ADRB3	41	35
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1Br	ZINC000819135176	GG	On-Demand	Bother	ADRB3	41	35
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1Br	ZINC000819135178	GG	On-Demand	Bother	ADRB3	41	35
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1Br	ZINC000819135180	GG	On-Demand	Bother	ADRB3	41	35
CN(CCNC[C@@H](O)c1cccc(Br)c1)Cc1ccc(F)cc1	ZINC000819135182	GG	On-Demand	Anodyne	ADRB3	61	39
CN(CCNC[C@H](O)c1cccc(Br)c1)Cc1ccc(F)cc1	ZINC000819135184	GG	On-Demand	Anodyne	ADRB3	61	39
O=C(CC1(C(=O)O)CCCCC1)NCc1ccc(C(=O)O)cc1	ZINC000819135193	DE	On-Demand	Anodyne	RARA	40	31
Nc1ncnc2c1ncn2CC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819135199	EC	On-Demand	Anodyne	AHCY	84	47
Nc1ncnc2c1ncn2CC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819135199	EC	On-Demand	Anodyne	OXGR1	94	35
O=C(C[C@H]1CCCCO1)OCc1ccc(C(=O)O)cc1	ZINC000819135208	CE	On-Demand	Anodyne	SLC12A5	45	34
O=C(C[C@@H]1CCCCO1)OCc1ccc(C(=O)O)cc1	ZINC000819135210	CE	On-Demand	Anodyne	SLC12A5	45	34
O=C(C[C@@H]1C(=O)Nc2ccccc21)OCc1ccc(C(=O)O)cc1	ZINC000819135225	EF	On-Demand	Anodyne	PLG	45	31
O=C(C[C@@H]1C(=O)Nc2ccccc21)OCc1ccc(C(=O)O)cc1	ZINC000819135225	EF	On-Demand	Anodyne	TRYP_PIG	41	31
O=C(C[C@H]1C(=O)Nc2ccccc21)OCc1ccc(C(=O)O)cc1	ZINC000819135227	EF	On-Demand	Anodyne	PLG	45	31
O=C(C[C@H]1C(=O)Nc2ccccc21)OCc1ccc(C(=O)O)cc1	ZINC000819135227	EF	On-Demand	Anodyne	TRYP_PIG	41	31
Nc1ncnc2c1ncn2CC(=O)OCC(=O)O	ZINC000819135231	CB	On-Demand	Anodyne	AHCY	98	54
Nc1ncnc2c1ncn2CC(=O)OCC(=O)O	ZINC000819135231	CB	On-Demand	Anodyne	OXGR1	108	38
Nc1ncnc2c1ncn2CC(=O)OCC(=O)O	ZINC000819135231	CB	On-Demand	Anodyne	DOT1L	41	38
Nc1nsc(N2CCN(C(=O)Nc3ccccc3CC(=O)O)CC2)n1	ZINC000819135236	FD	On-Demand	Anodyne	FAAH	18	56
O=C(C=NOCc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819135239	CF	On-Demand	Mild	PPIA	30	44
O=C(C=NOCc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819135239	CF	On-Demand	Mild	LTA4H	25	40
Nc1nsc(N2CCN(C(=O)Nc3cccc(CC(=O)O)c3)CC2)n1	ZINC000819135248	FD	On-Demand	Anodyne	FAAH	25	55
Nc1nsc(N2CCN(C(=O)Nc3cccc(CC(=O)O)c3)CC2)n1	ZINC000819135248	FD	On-Demand	Anodyne	P2RY14	45	35
O=C(C=NOCc1ccc(C(=O)O)cc1)Nc1cccc([N+](=O)[O-])c1	ZINC000819135253	EE	On-Demand	Mild	PPIA	19	47
O=C(CCC(=O)N1CCC[C@@H]1C(=O)O)Nc1nnc(C2CC2)o1	ZINC000819135260	DC	On-Demand	Anodyne	ACE	33	46
O=C(CCC(=O)N1CCC[C@H]1C(=O)O)Nc1nnc(C2CC2)o1	ZINC000819135262	DC	On-Demand	Anodyne	ACE	33	46
O=C(CC1(C(=O)O)CCCCCC1)NCc1ccc(C(=O)O)cc1	ZINC000819135267	EF	On-Demand	Anodyne	RARA	40	31
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1OCc1cn2ccccc2n1	ZINC000819135292	GH	On-Demand	Anodyne	ENPP1	49	30
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1OCc1cn2ccccc2n1	ZINC000819135293	GH	On-Demand	Anodyne	ENPP1	49	30
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1OCc1cn2ccccc2n1	ZINC000819135294	GH	On-Demand	Anodyne	ENPP1	49	30
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1OCc1cn2ccccc2n1	ZINC000819135295	GH	On-Demand	Anodyne	ENPP1	49	30
O=C1[C@@H](NC[C@H](O)c2cccc(F)c2)CCN1CCCc1ccccc1	ZINC000819135296	FF	On-Demand	Anodyne	SIGMAR1	15	41
O=C1[C@H](NC[C@H](O)c2cccc(F)c2)CCN1CCCc1ccccc1	ZINC000819135297	FF	On-Demand	Anodyne	SIGMAR1	15	41
O=C1[C@@H](NC[C@@H](O)c2cccc(F)c2)CCN1CCCc1ccccc1	ZINC000819135298	FF	On-Demand	Anodyne	SIGMAR1	15	41
O=C1[C@H](NC[C@@H](O)c2cccc(F)c2)CCN1CCCc1ccccc1	ZINC000819135299	FF	On-Demand	Anodyne	SIGMAR1	15	41
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819135320	DG	On-Demand	Anodyne	ADRB1	16	49
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819135321	DG	On-Demand	Anodyne	ADRB1	16	49
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819135326	EG	On-Demand	Anodyne	ADRB2	43	36
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819135326	EG	On-Demand	Anodyne	ADRB1	17	48
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819135326	EG	On-Demand	Anodyne	ADRB3	34	40
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819135327	EG	On-Demand	Anodyne	ADRB2	43	36
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819135327	EG	On-Demand	Anodyne	ADRB1	17	48
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819135327	EG	On-Demand	Anodyne	ADRB3	34	40
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCN1CCCc1ccccc1	ZINC000819135350	EF	On-Demand	Anodyne	SLC6A3	22	41
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCN1CCCc1ccccc1	ZINC000819135350	EF	On-Demand	Anodyne	SIGMAR1	26	40
O=C1[C@H](NC[C@H](O)c2ccccc2)CCN1CCCc1ccccc1	ZINC000819135351	EF	On-Demand	Anodyne	SLC6A3	22	41
O=C1[C@H](NC[C@H](O)c2ccccc2)CCN1CCCc1ccccc1	ZINC000819135351	EF	On-Demand	Anodyne	SIGMAR1	26	40
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCN1CCCc1ccccc1	ZINC000819135352	EF	On-Demand	Anodyne	SLC6A3	22	41
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCN1CCCc1ccccc1	ZINC000819135352	EF	On-Demand	Anodyne	SIGMAR1	26	40
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCN1CCCc1ccccc1	ZINC000819135353	EF	On-Demand	Anodyne	SLC6A3	22	41
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCN1CCCc1ccccc1	ZINC000819135353	EF	On-Demand	Anodyne	SIGMAR1	26	40
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1Br	ZINC000819135402	FF	On-Demand	Anodyne	ADRB2	21	44
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1Br	ZINC000819135402	FF	On-Demand	Anodyne	ADRB1	26	44
C[C@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1Br	ZINC000819135402	FF	On-Demand	Anodyne	ADRB3	88	44
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1Br	ZINC000819135403	FF	On-Demand	Anodyne	ADRB2	21	44
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1Br	ZINC000819135403	FF	On-Demand	Anodyne	ADRB1	26	44
C[C@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1Br	ZINC000819135403	FF	On-Demand	Anodyne	ADRB3	88	44
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1Br	ZINC000819135404	FF	On-Demand	Anodyne	ADRB2	21	44
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1Br	ZINC000819135404	FF	On-Demand	Anodyne	ADRB1	26	44
C[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1Br	ZINC000819135404	FF	On-Demand	Anodyne	ADRB3	88	44
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1Br	ZINC000819135405	FF	On-Demand	Anodyne	ADRB2	21	44
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1Br	ZINC000819135405	FF	On-Demand	Anodyne	ADRB1	26	44
C[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1Br	ZINC000819135405	FF	On-Demand	Anodyne	ADRB3	88	44
COC(=O)[C@@H]1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819135449	FD	On-Demand	Mild	PAPA1_CARPA	35	43
COC(=O)[C@@H]1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819135450	FD	On-Demand	Mild	PAPA1_CARPA	35	43
COC(=O)[C@H]1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819135451	FD	On-Demand	Mild	PAPA1_CARPA	35	43
COC(=O)[C@H]1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819135452	FD	On-Demand	Mild	PAPA1_CARPA	35	43
Cc1cc(F)ccc1[C@@H](O)CNCCN(C)Cc1ccc(F)cc1	ZINC000819135483	EG	On-Demand	Anodyne	LEF	50	34
O=C1[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1CCCc1ccccc1	ZINC000819135504	FG	On-Demand	Anodyne	SLC6A3	23	43
O=C1[C@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1CCCc1ccccc1	ZINC000819135505	FG	On-Demand	Anodyne	SLC6A3	23	43
O=C1[C@@H](NC[C@@H](O)c2cc3ccccc3o2)CCN1CCCc1ccccc1	ZINC000819135528	GG	On-Demand	Anodyne	SIGMAR1	15	43
O=C1[C@H](NC[C@@H](O)c2cc3ccccc3o2)CCN1CCCc1ccccc1	ZINC000819135529	GG	On-Demand	Anodyne	SIGMAR1	15	43
CC[C@@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1	ZINC000819135540	FF	On-Demand	Bother	CACNA1D	45	31
CC[C@@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1	ZINC000819135541	FF	On-Demand	Bother	CACNA1D	45	31
COc1ccccc1N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819135576	FG	On-Demand	Mild	PAPA1_CARPA	57	48
COc1ccccc1N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819135576	FG	On-Demand	Mild	CTSK	18	42
COc1ccccc1N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819135576	FG	On-Demand	Mild	CTSL	16	48
COc1ccccc1N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819135577	FG	On-Demand	Mild	PAPA1_CARPA	57	48
COc1ccccc1N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819135577	FG	On-Demand	Mild	CTSK	18	42
COc1ccccc1N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819135577	FG	On-Demand	Mild	CTSL	16	48
O=C(CC1CC1)NNC(=O)c1cc(Cl)nc(Cl)c1	ZINC000819135648	CD	On-Demand	Reactive	CACNA1I	41	33
O=C(Cc1nsc2ccccc12)NCCN1C(=O)CSC1=O	ZINC000819135689	ED	On-Demand	Anodyne	DRD2	16	53
O=C(Nc1ccc(C(=O)NC2CCCC2)cc1)C(F)=C1CCC1	ZINC000819135692	DH	On-Demand	Anodyne	EPHX2	29	40
CN(CCNC[C@@H](O)c1ccc(F)cc1)Cc1ccc(F)cc1	ZINC000819135695	DF	On-Demand	Anodyne	ADRB2	30	44
CN(CCNC[C@@H](O)c1ccc(F)cc1)Cc1ccc(F)cc1	ZINC000819135695	DF	On-Demand	Anodyne	ADRB3	41	38
CN(CCNC[C@H](O)c1ccc(F)cc1)Cc1ccc(F)cc1	ZINC000819135698	DF	On-Demand	Anodyne	ADRB2	30	44
CN(CCNC[C@H](O)c1ccc(F)cc1)Cc1ccc(F)cc1	ZINC000819135698	DF	On-Demand	Anodyne	ADRB3	41	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(Cc1ccccc1OC)C1CC1)C2	ZINC000819135708	FG	On-Demand	Anodyne	MBTPS1	55	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(Cc1ccccc1OC)C1CC1)C2	ZINC000819135712	FG	On-Demand	Anodyne	MBTPS1	55	40
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819135724	GC	On-Demand	Reactive	ADAM17	25	44
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819135724	GC	On-Demand	Reactive	EPHX2	36	47
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819135724	GC	On-Demand	Reactive	TGM2	56	34
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)cc1	ZINC000819135724	GC	On-Demand	Reactive	F13A1	58	34
O=C(CC1CC1)NNC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1Cl	ZINC000819135729	HG	On-Demand	Reactive	PRKCQ	15	41
O=C(CC1CC1)NNC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1	ZINC000819135731	FE	On-Demand	Reactive	LIMK2	36	44
O=C(Cc1ccccc1)NCC(=O)NNC(=O)CC1CC1	ZINC000819135732	CC	On-Demand	Reactive	SIGMAR1	16	41
O=C(Cc1ccccc1)NCC(=O)NNC(=O)CC1CC1	ZINC000819135732	CC	On-Demand	Reactive	CA5B	29	41
O=C(Cc1ccccc1)NCC(=O)NNC(=O)CC1CC1	ZINC000819135732	CC	On-Demand	Reactive	CA5A	33	41
O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819135741	HC	On-Demand	Reactive	TGM2	84	46
O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819135741	HC	On-Demand	Reactive	F13A1	90	46
O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819135741	HC	On-Demand	Reactive	CCR8	43	39
O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)CC1CC1	ZINC000819135741	HC	On-Demand	Reactive	SFRP1	42	39
N#CCCCn1cc(C(=O)NNC(=O)CC2CC2)c2ccccc21	ZINC000819135749	DF	On-Demand	Reactive	CNR1	22	42
N#CCCCn1cc(C(=O)NNC(=O)CC2CC2)c2ccccc21	ZINC000819135749	DF	On-Demand	Reactive	CNR2	35	42
O=C(CCCOc1ccc2c(c1)OCO2)NNC(=O)CC1CC1	ZINC000819135751	DD	On-Demand	Reactive	EDNRB	59	41
O=C(CCCOc1ccc2c(c1)OCO2)NNC(=O)CC1CC1	ZINC000819135751	DD	On-Demand	Reactive	EDNRA	55	41
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1	ZINC000819135765	FF	On-Demand	Reactive	EPHX2	41	46
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1	ZINC000819135765	FF	On-Demand	Reactive	CA9	15	44
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1	ZINC000819135765	FF	On-Demand	Reactive	DGAT1	42	45
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1	ZINC000819135765	FF	On-Demand	Reactive	KCNK3	41	36
O=C(CC1CC1)NNC(=O)c1ccc(Br)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819135769	ID	On-Demand	Reactive	CNR2	18	62
O=C(COCc1cccnc1)NNC(=O)CC1CC1	ZINC000819135778	CC	On-Demand	Reactive	GRIN2B	18	43
O=C(COCc1cccnc1)NNC(=O)CC1CC1	ZINC000819135778	CC	On-Demand	Reactive	CHRNA7	49	40
O=C(COCc1cccnc1)NNC(=O)CC1CC1	ZINC000819135778	CC	On-Demand	Reactive	ACHP_LYMST	24	40
COc1cccc(C(=O)c2ccc(C(=O)NNC(=O)CC3CC3)cc2)c1	ZINC000819135780	FE	On-Demand	Reactive	DRD4	48	36
COc1cccc(C(=O)c2ccc(C(=O)NNC(=O)CC3CC3)cc2)c1	ZINC000819135780	FE	On-Demand	Reactive	MTNR1B	31	52
CN(CCNC[C@@H](O)c1ccc(F)cc1F)Cc1ccc(F)cc1	ZINC000819135788	EF	On-Demand	Anodyne	LEF	40	32
CN(CCNC[C@H](O)c1ccc(F)cc1F)Cc1ccc(F)cc1	ZINC000819135791	EF	On-Demand	Anodyne	LEF	40	32
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1ccccc1Br	ZINC000819135794	FH	On-Demand	Anodyne	ADRB1	20	40
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1ccccc1Br	ZINC000819135794	FH	On-Demand	Anodyne	ADRB3	46	38
C[C@@H](CNC[C@H](O)c1ccccc1)Oc1ccccc1Br	ZINC000819135794	FH	On-Demand	Anodyne	AOC3	15	41
C[C@H](CNC[C@H](O)c1ccccc1)Oc1ccccc1Br	ZINC000819135797	FH	On-Demand	Anodyne	ADRB1	20	40
C[C@H](CNC[C@H](O)c1ccccc1)Oc1ccccc1Br	ZINC000819135797	FH	On-Demand	Anodyne	ADRB3	46	38
C[C@H](CNC[C@H](O)c1ccccc1)Oc1ccccc1Br	ZINC000819135797	FH	On-Demand	Anodyne	AOC3	15	41
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1ccccc1Br	ZINC000819135800	FH	On-Demand	Anodyne	ADRB1	20	40
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1ccccc1Br	ZINC000819135800	FH	On-Demand	Anodyne	ADRB3	46	38
C[C@H](CNC[C@@H](O)c1ccccc1)Oc1ccccc1Br	ZINC000819135800	FH	On-Demand	Anodyne	AOC3	15	41
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1ccccc1Br	ZINC000819135802	FH	On-Demand	Anodyne	ADRB1	20	40
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1ccccc1Br	ZINC000819135802	FH	On-Demand	Anodyne	ADRB3	46	38
C[C@@H](CNC[C@@H](O)c1ccccc1)Oc1ccccc1Br	ZINC000819135802	FH	On-Demand	Anodyne	AOC3	15	41
CN(CCNC[C@@H](O)c1cccc(F)c1)Cc1ccc(F)cc1	ZINC000819135811	DF	On-Demand	Anodyne	ADRB2	41	41
CN(CCNC[C@@H](O)c1cccc(F)c1)Cc1ccc(F)cc1	ZINC000819135811	DF	On-Demand	Anodyne	ADRB1	46	48
CN(CCNC[C@@H](O)c1cccc(F)c1)Cc1ccc(F)cc1	ZINC000819135811	DF	On-Demand	Anodyne	ADRB3	75	48
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1CCCc1ccccc1	ZINC000819135813	FG	On-Demand	Anodyne	ADRB1	51	43
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1CCCc1ccccc1	ZINC000819135813	FG	On-Demand	Anodyne	ADRB3	62	43
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1CCCc1ccccc1	ZINC000819135813	FG	On-Demand	Anodyne	CYP3A4	46	34
CN(CCNC[C@H](O)c1cccc(F)c1)Cc1ccc(F)cc1	ZINC000819135814	DF	On-Demand	Anodyne	ADRB2	41	41
CN(CCNC[C@H](O)c1cccc(F)c1)Cc1ccc(F)cc1	ZINC000819135814	DF	On-Demand	Anodyne	ADRB1	46	48
CN(CCNC[C@H](O)c1cccc(F)c1)Cc1ccc(F)cc1	ZINC000819135814	DF	On-Demand	Anodyne	ADRB3	75	48
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1CCCc1ccccc1	ZINC000819135815	FG	On-Demand	Anodyne	ADRB1	51	43
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1CCCc1ccccc1	ZINC000819135815	FG	On-Demand	Anodyne	ADRB3	62	43
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1CCCc1ccccc1	ZINC000819135815	FG	On-Demand	Anodyne	CYP3A4	46	34
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1CCCc1ccccc1	ZINC000819135816	FG	On-Demand	Anodyne	ADRB1	51	43
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1CCCc1ccccc1	ZINC000819135816	FG	On-Demand	Anodyne	ADRB3	62	43
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1CCCc1ccccc1	ZINC000819135816	FG	On-Demand	Anodyne	CYP3A4	46	34
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(OCc2ccccn2)c1	ZINC000819135817	FH	On-Demand	Anodyne	KCNQ2	52	39
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1CCCc1ccccc1	ZINC000819135818	FG	On-Demand	Anodyne	ADRB1	51	43
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1CCCc1ccccc1	ZINC000819135818	FG	On-Demand	Anodyne	ADRB3	62	43
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1CCCc1ccccc1	ZINC000819135818	FG	On-Demand	Anodyne	CYP3A4	46	34
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(OCc2ccccn2)c1	ZINC000819135819	FH	On-Demand	Anodyne	KCNQ2	52	39
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(OCc2ccccn2)c1	ZINC000819135822	FH	On-Demand	Anodyne	KCNQ2	52	39
CC[C@@H](CNCCS(C)(=O)=O)Oc1cccc(C)c1	ZINC000819135824	CD	On-Demand	Anodyne	PDS	36	41
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(OCc2ccccn2)c1	ZINC000819135825	FH	On-Demand	Anodyne	KCNQ2	52	39
O=C1[C@@H](NC[C@H](O)c2cc(F)ccc2F)CCN1CCCc1ccccc1	ZINC000819135832	FF	On-Demand	Anodyne	SIGMAR1	18	42
O=C1[C@H](NC[C@H](O)c2cc(F)ccc2F)CCN1CCCc1ccccc1	ZINC000819135833	FF	On-Demand	Anodyne	SIGMAR1	18	42
O=C1[C@@H](NC[C@@H](O)c2cc(F)ccc2F)CCN1CCCc1ccccc1	ZINC000819135834	FF	On-Demand	Anodyne	SIGMAR1	18	42
O=C1[C@H](NC[C@@H](O)c2cc(F)ccc2F)CCN1CCCc1ccccc1	ZINC000819135835	FF	On-Demand	Anodyne	SIGMAR1	18	42
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCCCCC2)cc1	ZINC000819135838	EG	On-Demand	Anodyne	L3MBTL3	86	42
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)N2CCCCCC2)cc1	ZINC000819135839	EG	On-Demand	Anodyne	L3MBTL3	86	42
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCCCCC2)cc1	ZINC000819135840	EG	On-Demand	Anodyne	L3MBTL3	86	42
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)N2CCCCCC2)cc1	ZINC000819135841	EG	On-Demand	Anodyne	L3MBTL3	86	42
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(C)c1	ZINC000819135843	DF	On-Demand	Anodyne	ADRB2	22	45
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(C)c1	ZINC000819135843	DF	On-Demand	Anodyne	ADRB1	31	45
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(C)c1	ZINC000819135843	DF	On-Demand	Anodyne	ADRB3	92	48
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(C)c1	ZINC000819135845	DF	On-Demand	Anodyne	ADRB2	22	45
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(C)c1	ZINC000819135845	DF	On-Demand	Anodyne	ADRB1	31	45
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(C)c1	ZINC000819135845	DF	On-Demand	Anodyne	ADRB3	92	48
O=C(CC1CC1)NNC(=O)c1ccc2ncn(-c3ccc(Cl)cc3)c2c1	ZINC000819135852	FG	On-Demand	Reactive	HPGD	37	48
O=C(CC1CC1)NNC(=O)c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1Cl	ZINC000819135875	IG	On-Demand	Reactive	BDKRB1	30	41
CCOc1ccc(C(=O)NCC(=O)NNC(=O)CC2CC2)cc1OCC	ZINC000819135878	FD	On-Demand	Reactive	SSTR5	41	36
CCOc1ccc(C(=O)NCC(=O)NNC(=O)CC2CC2)cc1OCC	ZINC000819135878	FD	On-Demand	Reactive	CCR2	58	39
CCOc1ccc(C(=O)NCC(=O)NNC(=O)CC2CC2)cc1OCC	ZINC000819135878	FD	On-Demand	Reactive	CACNA1I	50	36
O=C(CC1CC1)NNC(=O)c1cncc(-c2ccccc2)c1	ZINC000819135895	CE	On-Demand	Reactive	F11	15	41
O=C(CC1CC1)NNC(=O)c1cncc(-c2ccccc2)c1	ZINC000819135895	CE	On-Demand	Reactive	SCN10A	42	46
O=C(CC1CC1)NNC(=O)c1c(F)cccc1F	ZINC000819135903	CD	On-Demand	Reactive	DAC	21	40
CCCCCOc1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819135905	DF	On-Demand	Reactive	GRIN2B	16	43
CCCCCOc1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819135905	DF	On-Demand	Reactive	CYSLTR2	42	32
CCCCCOc1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819135905	DF	On-Demand	Reactive	PLA2G4A	30	40
CCCCCOc1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819135905	DF	On-Demand	Reactive	LPAR2	29	41
CCCCCOc1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819135905	DF	On-Demand	Reactive	S1PR3	21	41
CCCCCOc1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819135905	DF	On-Demand	Reactive	PLA2G4B	103	46
CCCCCOc1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819135905	DF	On-Demand	Reactive	LSS	19	41
CCCCCOc1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819135905	DF	On-Demand	Reactive	FAAH	23	40
CCCCCOc1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819135905	DF	On-Demand	Reactive	S1PR2	27	41
CCCCCOc1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819135905	DF	On-Demand	Reactive	SLC6A5	37	44
O=C(CC1CC1)NNC(=O)c1ccc(N2CCc3ccccc3C2)cc1	ZINC000819135910	EF	On-Demand	Reactive	NOD2	44	36
COc1cc2c(cc1OC)CN(CC(=O)NNC(=O)CC1CC1)CC2	ZINC000819135925	ED	On-Demand	Reactive	SLC18A2	48	36
COc1cc2c(cc1OC)CN(CC(=O)NNC(=O)CC1CC1)CC2	ZINC000819135925	ED	On-Demand	Reactive	ABCB1B	66	41
COc1cc2c(cc1OC)CN(CC(=O)NNC(=O)CC1CC1)CC2	ZINC000819135925	ED	On-Demand	Reactive	ABCB1	25	49
COc1cc2c(cc1OC)CN(CC(=O)NNC(=O)CC1CC1)CC2	ZINC000819135925	ED	On-Demand	Reactive	HCRTR2	15	43
COc1cc2c(cc1OC)CN(CC(=O)NNC(=O)CC1CC1)CC2	ZINC000819135925	ED	On-Demand	Reactive	ABCG2	34	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)CC1	ZINC000819135945	FF	On-Demand	Anodyne	GPR119	31	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCCc3[nH]ccc32)CC1	ZINC000819135946	FF	On-Demand	Anodyne	GPR119	31	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCCc3[nH]ccc32)CC1	ZINC000819135947	FF	On-Demand	Anodyne	GPR119	31	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCCc3[nH]ccc32)CC1	ZINC000819135948	FF	On-Demand	Anodyne	GPR119	31	42
NS(=O)(=O)Cc1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819135957	DC	On-Demand	Reactive	CA2	19	41
C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1	ZINC000819135966	EG	On-Demand	Anodyne	TRPC6	15	40
C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1	ZINC000819135966	EG	On-Demand	Anodyne	TRPC3	16	40
C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1	ZINC000819135967	EG	On-Demand	Anodyne	TRPC6	15	40
C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1	ZINC000819135967	EG	On-Demand	Anodyne	TRPC3	16	40
C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1	ZINC000819135968	EG	On-Demand	Anodyne	TRPC6	15	40
C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1	ZINC000819135968	EG	On-Demand	Anodyne	TRPC3	16	40
C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1	ZINC000819135969	EG	On-Demand	Anodyne	TRPC6	15	40
C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1	ZINC000819135969	EG	On-Demand	Anodyne	TRPC3	16	40
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(C(=O)N2CCCCC2)c1	ZINC000819135976	EF	On-Demand	Anodyne	L3MBTL3	67	42
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(C(=O)N2CCCCC2)c1	ZINC000819135977	EF	On-Demand	Anodyne	L3MBTL3	67	42
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(C(=O)N2CCCCC2)c1	ZINC000819135978	EF	On-Demand	Anodyne	L3MBTL3	67	42
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(C(=O)N2CCCCC2)c1	ZINC000819135980	EF	On-Demand	Anodyne	L3MBTL3	67	42
CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)CC3CC3)cc2[N+](=O)[O-])CC1	ZINC000819135990	GC	On-Demand	Reactive	TAAR1	17	45
O=C(CC1CC1)NNC(=O)c1cnc(-c2ccc3c(c2)OCO3)s1	ZINC000819135992	EE	On-Demand	Reactive	CLK4	55	35
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NCCc2ccc(C(=O)OC)cc2)c1	ZINC000819136000	JE	On-Demand	Anodyne	CA2	23	50
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NCCc2ccc(C(=O)OC)cc2)c1	ZINC000819136000	JE	On-Demand	Anodyne	TBXA2R	46	39
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NCCc2ccc(C(=O)OC)cc2)c1	ZINC000819136000	JE	On-Demand	Anodyne	CA1	23	50
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NCCc2ccc(C(=O)OC)cc2)c1	ZINC000819136000	JE	On-Demand	Anodyne	CA4	17	50
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NCCc2ccc(C(=O)OC)cc2)c1	ZINC000819136000	JE	On-Demand	Anodyne	CA9	23	40
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NCCc2ccc(C(=O)OC)cc2)c1	ZINC000819136000	JE	On-Demand	Anodyne	CYNT	18	41
COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NCCc2ccc(C(=O)OC)cc2)c1	ZINC000819136000	JE	On-Demand	Anodyne	A6YCJ1_9METZ	16	43
O=C(CC1CC1)NNC(=O)c1ccc2nc(-c3ccccc3)oc2c1	ZINC000819136002	EG	On-Demand	Reactive	VCP	52	37
O=C(CC1CC1)NNC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819136010	CF	On-Demand	Reactive	GRIN2B	19	42
O=C(CC1CC1)NNC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819136010	CF	On-Demand	Reactive	PRNP	28	41
O=C(CC1CC1)NNC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819136010	CF	On-Demand	Reactive	DGAT1	33	43
O=C(CC1CC1)NNC(=O)c1cn(Cc2ccccc2)nc1-c1ccccc1	ZINC000819136014	FG	On-Demand	Reactive	SIGMAR1	19	41
O=C(CC1CC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	ZINC000819136034	ID	On-Demand	Reactive	NOS2	68	32
Cc1nc2ccc(C(=O)NNC(=O)CC3CC3)cc2s1	ZINC000819136048	CE	On-Demand	Reactive	LCK	31	56
Cc1nc2ccc(C(=O)NNC(=O)CC3CC3)cc2s1	ZINC000819136048	CE	On-Demand	Reactive	CSNK1D	29	42
CCC(=O)Nc1ccccc1C(=O)NNC(=O)CC1CC1	ZINC000819136052	CD	On-Demand	Reactive	CCR8	47	35
CCn1c(CCC(=O)NNC(=O)CC2CC2)nc2cc(S(=O)(=O)N(C)C)ccc21	ZINC000819136055	HD	On-Demand	Reactive	CNR2	26	43
NC(=O)Nc1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819136058	CC	On-Demand	Reactive	ACR	44	33
O=C(CCCSc1ccc(Br)cc1)NNC(=O)CC1CC1	ZINC000819136063	FG	On-Demand	Reactive	FAS	38	43
O=C(CC1CC1)NNC(=O)c1nn(-c2cc(C(F)(F)F)ccc2Cl)c2c1CCC2	ZINC000819136069	IH	On-Demand	Reactive	CNR1	52	32
O=C(CC1CC1)NNC(=O)c1cnn2c(-c3ccccc3)ccnc12	ZINC000819136077	ED	On-Demand	Reactive	BRAF	21	40
O=C(CCC(=O)N1CCN(C2c3ccccc3-c3ccccc32)CC1)NNC(=O)CC1CC1	ZINC000819136080	IF	On-Demand	Reactive	SSTR1	40	40
O=C(CC1CC1)NNC(=O)C1(S(=O)(=O)c2ccccc2)CC1	ZINC000819136085	DC	On-Demand	Reactive	MMP13	34	41
O=C(CC1CC1)NNC(=O)C1(S(=O)(=O)c2ccccc2)CC1	ZINC000819136085	DC	On-Demand	Reactive	MMP10	46	38
O=C(CC1CC1)NNC(=O)Cn1c(-c2cccc(Cl)c2Cl)nc2ccccc21	ZINC000819136097	HH	On-Demand	Reactive	PDE6D	48	33
O=C(CC1CC1)NNC(=O)Cn1c(-c2cccc(Cl)c2Cl)nc2ccccc21	ZINC000819136097	HH	On-Demand	Reactive	IMDH_CRYPV	37	50
O=C(Cc1cccc(OCc2cccnc2)c1)NNC(=O)CC1CC1	ZINC000819136099	EE	On-Demand	Reactive	PTAFR	17	40
O=C(Cc1cccc(OCc2cccnc2)c1)NNC(=O)CC1CC1	ZINC000819136099	EE	On-Demand	Reactive	CHRNA7	43	36
O=C(CC1CC1)NNC(=O)c1cccc(Oc2ccccc2)c1	ZINC000819136102	DG	On-Demand	Reactive	DRD4	40	32
O=C(CC1CC1)NNC(=O)c1cccc(Oc2ccccc2)c1	ZINC000819136102	DG	On-Demand	Reactive	GRIN2B	22	40
O=C(CC1CC1)NNC(=O)c1cccc(Oc2ccccc2)c1	ZINC000819136102	DG	On-Demand	Reactive	CRTM	48	38
O=C(CC1CC1)NNC(=O)c1ccc(Cn2cncn2)cc1	ZINC000819136104	CC	On-Demand	Reactive	HIS3	70	35
O=C(CC1CC1)NNC(=O)c1ccccc1NC(=O)c1cccs1	ZINC000819136111	EF	On-Demand	Reactive	STK33	25	40
O=C(CC1CC1)NNC(=O)c1ccc2c(ccn2Cc2ccccc2)c1	ZINC000819136112	EG	On-Demand	Reactive	SIGMAR1	16	41
N#Cc1ccc(C(=O)NNC(=O)CC2CC2)o1	ZINC000819136125	BC	On-Demand	Reactive	CSF1R	22	42
O=C(Nc1ccc(C(=O)N2CCCCCC2)cc1)C(F)=C1CCC1	ZINC000819136126	EI	On-Demand	Anodyne	EPHX2	15	44
O=C(Nc1ccc(C(=O)N2CCCCCC2)cc1)C(F)=C1CCC1	ZINC000819136126	EI	On-Demand	Anodyne	MLYCD	19	45
O=C(Nc1ccc(C(=O)N2CCCCCC2)cc1)C(F)=C1CCC1	ZINC000819136126	EI	On-Demand	Anodyne	L3MBTL3	72	41
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccc3nc[nH]c3c2)c1	ZINC000819136136	GE	On-Demand	Reactive	KCNK3	91	37
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccc3nc[nH]c3c2)c1	ZINC000819136136	GE	On-Demand	Reactive	KCNK9	42	36
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)CC2CC2)cc1	ZINC000819136137	ID	On-Demand	Reactive	KCNMA1	19	42
C[C@@H](Oc1ccc(C(=O)NNC(=O)CC2CC2)cc1)c1ccccc1	ZINC000819136141	EG	On-Demand	Reactive	GRIN2B	16	40
O=C(CC1CC1)NNC(=O)C[C@@H]1CCc2ccccc2C1	ZINC000819136145	CE	On-Demand	Reactive	PTGIR	33	46
O=C(CC1CC1)NNC(=O)C[C@@H]1CCc2ccccc2C1	ZINC000819136145	CE	On-Demand	Reactive	PREP	32	49
O=C(CC1CC1)NNC(=O)C[C@H]1CCc2ccccc2C1	ZINC000819136146	CE	On-Demand	Reactive	PTGIR	33	46
O=C(CC1CC1)NNC(=O)C[C@H]1CCc2ccccc2C1	ZINC000819136146	CE	On-Demand	Reactive	PREP	32	49
O=C(Cc1cncn1Cc1ccccc1)NNC(=O)CC1CC1	ZINC000819136149	DD	On-Demand	Reactive	CYP11B1	17	50
CC(=O)Nc1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819136150	CD	On-Demand	Reactive	CCR3	19	40
CC(=O)Nc1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819136150	CD	On-Demand	Reactive	KCNK3	106	41
CC(=O)Nc1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819136150	CD	On-Demand	Reactive	KCNK9	59	41
CN1C(=O)CC[C@@H]1C(=O)NNC(=O)CC1CC1	ZINC000819136157	BB	On-Demand	Reactive	P2RX7	28	48
CN1C(=O)CC[C@H]1C(=O)NNC(=O)CC1CC1	ZINC000819136159	BB	On-Demand	Reactive	P2RX7	28	48
O=C(CC1CC1)NNC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1ccccc1	ZINC000819136162	HF	On-Demand	Reactive	CCR2	16	47
O=C(CC1CC1)NNC(=O)c1ccc(Cl)cc1NS(=O)(=O)c1ccccc1	ZINC000819136162	HF	On-Demand	Reactive	MCL1	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(C(=O)N3CCCCC3)c1)C2	ZINC000819136181	GG	On-Demand	Anodyne	EPHX2	17	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(C(=O)N3CCCCC3)c1)C2	ZINC000819136181	GG	On-Demand	Anodyne	L3MBTL3	41	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(C(=O)N3CCCCC3)c1)C2	ZINC000819136182	GG	On-Demand	Anodyne	EPHX2	17	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(C(=O)N3CCCCC3)c1)C2	ZINC000819136182	GG	On-Demand	Anodyne	L3MBTL3	41	37
C[C@@H](Cc1ccncc1)NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819136193	FF	On-Demand	Anodyne	GPR119	26	43
C[C@@H](Cc1ccncc1)NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819136194	FF	On-Demand	Anodyne	GPR119	26	43
C[C@@H](Oc1ccccc1C#N)C(=O)NNC(=O)CC1CC1	ZINC000819136219	CD	On-Demand	Reactive	ADRB1	41	32
COc1cccc([S@@](=O)CC(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000819136220	EE	On-Demand	Anodyne	MTNR1A	31	56
COc1cccc([S@@](=O)CC(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000819136220	EE	On-Demand	Anodyne	MTNR1B	34	56
COc1cccc([S@@](=O)CC(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000819136220	EE	On-Demand	Anodyne	PDS	64	40
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CC3CC3)cc2)C1	ZINC000819136224	GD	On-Demand	Reactive	TGM2	50	36
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CC3CC3)cc2)C1	ZINC000819136224	GD	On-Demand	Reactive	F13A1	40	35
COc1cccc([S@@](=O)CC(=O)N[C@H](C)COc2ccccc2)c1	ZINC000819136225	EE	On-Demand	Anodyne	MTNR1A	31	56
COc1cccc([S@@](=O)CC(=O)N[C@H](C)COc2ccccc2)c1	ZINC000819136225	EE	On-Demand	Anodyne	MTNR1B	34	56
COc1cccc([S@@](=O)CC(=O)N[C@H](C)COc2ccccc2)c1	ZINC000819136225	EE	On-Demand	Anodyne	PDS	64	40
COc1ccc(Cn2cc(C(=O)NNC(=O)CC3CC3)cn2)cc1OC	ZINC000819136228	FD	On-Demand	Reactive	SSTR5	51	36
COc1ccc(Cn2cc(C(=O)NNC(=O)CC3CC3)cn2)cc1OC	ZINC000819136228	FD	On-Demand	Reactive	PANC	43	34
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1cc2ccccc2o1	ZINC000819136235	CG	On-Demand	Anodyne	ADRB1	15	40
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccccc1Cl	ZINC000819136238	CF	On-Demand	Anodyne	ADRB2	21	49
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccccc1Cl	ZINC000819136238	CF	On-Demand	Anodyne	ADRB1	17	43
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccccc1Cl	ZINC000819136238	CF	On-Demand	Anodyne	ADRB3	43	41
O=C(CC1CC1)NNC(=O)c1cc(Cl)cc([N+](=O)[O-])c1	ZINC000819136246	CD	On-Demand	Reactive	CACNA1I	59	36
O=C(CC1CC1)NNC(=O)C[C@H](Cc1ccccc1)c1ccccc1	ZINC000819136248	EG	On-Demand	Reactive	MME	69	38
O=C(CC1CC1)NNC(=O)C[C@H](Cc1ccccc1)c1ccccc1	ZINC000819136248	EG	On-Demand	Reactive	CAPN1	42	36
O=C(CC1CC1)NNC(=O)C[C@@H](Cc1ccccc1)c1ccccc1	ZINC000819136250	EG	On-Demand	Reactive	MME	69	38
O=C(CC1CC1)NNC(=O)C[C@@H](Cc1ccccc1)c1ccccc1	ZINC000819136250	EG	On-Demand	Reactive	CAPN1	42	36
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000819136251	EF	On-Demand	Anodyne	ADRB2	18	41
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000819136251	EF	On-Demand	Anodyne	ADRB1	35	41
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000819136251	EF	On-Demand	Anodyne	TSHR	44	33
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000819136251	EF	On-Demand	Anodyne	ADRB3	24	40
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000819136251	EF	On-Demand	Anodyne	LTA4H	31	46
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000819136251	EF	On-Demand	Anodyne	MTNR1A	29	53
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000819136251	EF	On-Demand	Anodyne	MTNR1B	34	53
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000819136251	EF	On-Demand	Anodyne	KCNK3	60	37
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000819136251	EF	On-Demand	Anodyne	KCNK9	40	33
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)COc2ccccc2)c1	ZINC000819136251	EF	On-Demand	Anodyne	PDS	93	40
CC(C)(C)OC(=O)N1CCCc2cc(C(=O)NNC(=O)CC3CC3)ccc21	ZINC000819136256	FF	On-Demand	Reactive	GPR119	26	43
CC(=O)Nc1cccc(CC(=O)N[C@H](C)COc2ccccc2)c1	ZINC000819136259	EF	On-Demand	Anodyne	ADRB2	18	41
CC(=O)Nc1cccc(CC(=O)N[C@H](C)COc2ccccc2)c1	ZINC000819136259	EF	On-Demand	Anodyne	ADRB1	35	41
CC(=O)Nc1cccc(CC(=O)N[C@H](C)COc2ccccc2)c1	ZINC000819136259	EF	On-Demand	Anodyne	TSHR	44	33
CC(=O)Nc1cccc(CC(=O)N[C@H](C)COc2ccccc2)c1	ZINC000819136259	EF	On-Demand	Anodyne	ADRB3	24	40
CC(=O)Nc1cccc(CC(=O)N[C@H](C)COc2ccccc2)c1	ZINC000819136259	EF	On-Demand	Anodyne	LTA4H	31	46
CC(=O)Nc1cccc(CC(=O)N[C@H](C)COc2ccccc2)c1	ZINC000819136259	EF	On-Demand	Anodyne	MTNR1A	29	53
CC(=O)Nc1cccc(CC(=O)N[C@H](C)COc2ccccc2)c1	ZINC000819136259	EF	On-Demand	Anodyne	MTNR1B	34	53
CC(=O)Nc1cccc(CC(=O)N[C@H](C)COc2ccccc2)c1	ZINC000819136259	EF	On-Demand	Anodyne	KCNK3	60	37
CC(=O)Nc1cccc(CC(=O)N[C@H](C)COc2ccccc2)c1	ZINC000819136259	EF	On-Demand	Anodyne	KCNK9	40	33
CC(=O)Nc1cccc(CC(=O)N[C@H](C)COc2ccccc2)c1	ZINC000819136259	EF	On-Demand	Anodyne	PDS	93	40
C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819136280	GD	On-Demand	Reactive	BDKRB1	22	40
C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819136280	GD	On-Demand	Reactive	AKR1C3	60	43
C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819136281	GD	On-Demand	Reactive	BDKRB1	22	40
C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819136281	GD	On-Demand	Reactive	AKR1C3	60	43
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)CCN1CCCc1ccccc1	ZINC000819136298	GG	On-Demand	Anodyne	SIGMAR1	18	41
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2Cl)CCN1CCCc1ccccc1	ZINC000819136299	GG	On-Demand	Anodyne	SIGMAR1	18	41
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)CCN1CCCc1ccccc1	ZINC000819136300	GG	On-Demand	Anodyne	SIGMAR1	18	41
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)CCN1CCCc1ccccc1	ZINC000819136301	GG	On-Demand	Anodyne	SIGMAR1	18	41
O=C(CC1CC1)NNC(=O)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819136309	EH	On-Demand	Reactive	DRD4	43	38
O=C(CC1CC1)NNC(=O)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819136309	EH	On-Demand	Reactive	CFTR	29	40
O=C(CC1CC1)NNC(=O)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819136309	EH	On-Demand	Reactive	PLAU	29	41
O=C(CC1CC1)NNC(=O)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819136309	EH	On-Demand	Reactive	ST14	23	41
O=C(CC1CC1)NNC(=O)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819136309	EH	On-Demand	Reactive	CRTM	32	42
O=C(Cc1ccc2c(c1)OCCO2)NNC(=O)CC1CC1	ZINC000819136312	CC	On-Demand	Reactive	NOS2	72	33
O=C(Cc1ccc2c(c1)OCCO2)NNC(=O)CC1CC1	ZINC000819136312	CC	On-Demand	Reactive	LUXR	47	44
CC(=O)N[C@@H](CC(=O)NNC(=O)CC1CC1)c1ccccc1	ZINC000819136313	DD	On-Demand	Reactive	CCR5	19	44
O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O)NNC(=O)CC1CC1	ZINC000819136319	HE	On-Demand	Reactive	BCL2A1	53	36
O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O)NNC(=O)CC1CC1	ZINC000819136320	HE	On-Demand	Reactive	BCL2A1	53	36
O=C(CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)CC1CC1	ZINC000819136362	FC	On-Demand	Reactive	TBXA2R	42	34
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	ACE	21	43
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	MME	27	42
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	EDNRB	40	36
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	EDNRA	36	50
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	TACR1	31	59
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	MC4R	68	49
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	CCKAR	108	56
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	CTSL	23	45
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	BRS3	31	54
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	TIMP3	15	43
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	NMBR	22	44
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	MC3R	69	49
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	MC5R	66	38
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	MMP2	28	47
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	MMP8	36	45
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	MMP14	26	46
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	GRPR	64	33
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	ECE1	65	42
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	LNPEP	20	42
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	SSTR3	31	42
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	MMP11	96	37
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	CCKBR	77	46
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	GHSR	57	45
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	MMP9	28	45
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	MC1R	98	49
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	MMP1	20	42
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	NPR	27	41
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	KISS1R	86	47
O=C(CC1CC1)NNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136373	IG	On-Demand	Reactive	ERAP2	47	43
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	ACE	21	43
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	MME	27	42
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	EDNRB	40	36
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	EDNRA	36	50
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	TACR1	31	59
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	MC4R	68	49
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	CCKAR	108	56
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	CTSL	23	45
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	BRS3	31	54
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	TIMP3	15	43
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	NMBR	22	44
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	MC3R	69	49
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	MC5R	66	38
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	MMP2	28	47
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	MMP8	36	45
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	MMP14	26	46
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	GRPR	64	33
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	ECE1	65	42
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	LNPEP	20	42
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	SSTR3	31	42
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	MMP11	96	37
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	CCKBR	77	46
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	GHSR	57	45
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	MMP9	28	45
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	MC1R	98	49
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	MMP1	20	42
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	NPR	27	41
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	KISS1R	86	47
O=C(CC1CC1)NNC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1ccc(Cl)cc1	ZINC000819136374	IG	On-Demand	Reactive	ERAP2	47	43
C[C@@H](Cc1ccccc1)n1cccc1C(=O)NNC(=O)CC1CC1	ZINC000819136385	EF	On-Demand	Reactive	ACE	44	36
C[C@@H](Cc1ccccc1)n1cccc1C(=O)NNC(=O)CC1CC1	ZINC000819136385	EF	On-Demand	Reactive	MME	61	36
O=C(CC1CC1)NNC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1	ZINC000819136389	FG	On-Demand	Reactive	CCR2	56	39
O=C(CC1CC1)NNC(=O)c1ccc(-c2ccc(Cl)cc2)s1	ZINC000819136408	EH	On-Demand	Reactive	MAPK11	21	49
O=C(CC1CC1)NNC(=O)c1ccc(Oc2cccc(Cl)c2)cc1	ZINC000819136425	EH	On-Demand	Reactive	SLC6A5	26	41
CCOc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)CC3CC3)cc2)cc1	ZINC000819136427	HE	On-Demand	Reactive	LIMK2	26	41
O=C(CC1CC1)NNC(=O)c1cccc(C(=O)NC2CC2)c1	ZINC000819136429	DD	On-Demand	Reactive	PLG	17	43
O=C(CC1CC1)NNC(=O)c1cccc(C(=O)NC2CC2)c1	ZINC000819136429	DD	On-Demand	Reactive	MAPK11	32	45
O=C(CC1CC1)NNC(=O)c1cccc(C(=O)NC2CC2)c1	ZINC000819136429	DD	On-Demand	Reactive	MAPK14	45	45
O=C(CC1CC1)NNC(=O)c1cccc(C(=O)NC2CC2)c1	ZINC000819136429	DD	On-Demand	Reactive	CCR2	37	41
O=C(CC1CC1)NNC(=O)c1cccc(C(=O)NC2CC2)c1	ZINC000819136429	DD	On-Demand	Reactive	PLAU	22	40
O=C(CC1CC1)NNC(=O)c1cccc(C(=O)NC2CC2)c1	ZINC000819136429	DD	On-Demand	Reactive	ST14	16	43
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)CC2CC2)ccc1OC	ZINC000819136432	GD	On-Demand	Reactive	CPT1A	58	34
CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)CC2CC2)ccc1OC	ZINC000819136432	GD	On-Demand	Reactive	CPT1B	59	33
CCOc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CC3CC3)c2)cc1	ZINC000819136444	HE	On-Demand	Reactive	ST14	34	41
O=C(CC1CC1)NNC(=O)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819136451	HD	On-Demand	Reactive	CACNA1D	45	35
O=C(CCCCCNC(=O)NC1CCCCC1)NNC(=O)CC1CC1	ZINC000819136464	FE	On-Demand	Reactive	EPHX2	27	60
Cc1nc(C(C)(C)c2ccccc2)sc1C(=O)NNC(=O)CC1CC1	ZINC000819136474	FG	On-Demand	Reactive	SCD1	17	40
Cc1nc(C(C)(C)c2ccccc2)sc1C(=O)NNC(=O)CC1CC1	ZINC000819136474	FG	On-Demand	Reactive	SCD	15	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	ACE	34	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	CELA1	21	47
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	ELANE	39	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	MME	42	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	CTSD	21	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	CTRA_BOVIN	41	31
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	CASP3	22	56
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	BMP1	27	57
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	KLK3	86	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	CTSB	88	53
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	PAPA1_CARPA	92	49
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	CYSP_TRYCR	57	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	NTSR1	40	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	CTSK	59	57
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	CTSL	68	53
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	PGA	25	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	PREP	17	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	CAPNS1	85	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	ECE1	44	37
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	HLA-DRB1	49	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	REN	45	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	CTSS	34	57
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	CAPN1	110	60
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	CASP1	32	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	CTRC	15	47
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	CAPN2	162	49
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	ACE2	47	37
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	CASP6	15	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	CASP9	42	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	POLG_HCV1	22	47
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	NPR	83	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	R1A_CVHSA	21	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	CASP10	38	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	PSMB5	56	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819136478	FE	On-Demand	Reactive	Q6PRC7_IXORI	45	44
O=C(CC1CC1)NNC(=O)c1ccc(Oc2ccccc2)cn1	ZINC000819136494	DE	On-Demand	Reactive	GRIN2B	22	41
O=C(COCCOc1ccccc1)NNC(=O)CC1CC1	ZINC000819136518	CD	On-Demand	Reactive	GRIN2B	28	46
O=S(=O)(Cc1ccon1)NCCNC[C@H](O)c1cccc(F)c1	ZINC000819136522	EC	On-Demand	Anodyne	ADRB3	48	39
O=S(=O)(Cc1ccon1)NCCNC[C@@H](O)c1cccc(F)c1	ZINC000819136524	EC	On-Demand	Anodyne	ADRB3	48	39
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)COc2ccc(Cl)cc2)CC1	ZINC000819136536	GE	On-Demand	Anodyne	CPT1A	54	39
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)COc2ccc(Cl)cc2)CC1	ZINC000819136536	GE	On-Demand	Anodyne	CPT2	42	37
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)COc2ccc(Cl)cc2)CC1	ZINC000819136538	GE	On-Demand	Anodyne	CPT1A	54	39
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)COc2ccc(Cl)cc2)CC1	ZINC000819136538	GE	On-Demand	Anodyne	CPT2	42	37
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)COc2ccc(Cl)cc2)CC1	ZINC000819136540	GE	On-Demand	Anodyne	CPT1A	54	39
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)COc2ccc(Cl)cc2)CC1	ZINC000819136540	GE	On-Demand	Anodyne	CPT2	42	37
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)COc2ccc(Cl)cc2)CC1	ZINC000819136542	GE	On-Demand	Anodyne	CPT1A	54	39
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)COc2ccc(Cl)cc2)CC1	ZINC000819136542	GE	On-Demand	Anodyne	CPT2	42	37
C[C@@H](Cc1ccncc1)NC[C@H](O)c1cccc2ccccc12	ZINC000819136548	DG	On-Demand	Anodyne	ADRB1	25	45
C[C@@H](Cc1ccncc1)NC[C@H](O)c1cccc2ccccc12	ZINC000819136548	DG	On-Demand	Anodyne	ADRB3	40	38
CC[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(C)c1	ZINC000819136551	EG	On-Demand	Bother	CACNA1C	55	36
CC[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(C)c1	ZINC000819136551	EG	On-Demand	Bother	CACNA1D	83	34
CC[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(C)c1	ZINC000819136551	EG	On-Demand	Bother	PDS	15	43
CC[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(C)c1	ZINC000819136554	EG	On-Demand	Bother	CACNA1C	55	36
CC[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(C)c1	ZINC000819136554	EG	On-Demand	Bother	CACNA1D	83	34
CC[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(C)c1	ZINC000819136554	EG	On-Demand	Bother	PDS	15	43
O=C(CSc1cccc(C(F)(F)F)c1)NNC(=O)CC1CC1	ZINC000819136556	EF	On-Demand	Reactive	CCR2	78	38
O=C(CC1CC1)NNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819136559	ID	On-Demand	Reactive	MMP13	32	42
O=C(CC1CC1)NNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819136559	ID	On-Demand	Reactive	ADAM17	35	41
O=C(CC1CC1)NNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819136559	ID	On-Demand	Reactive	MMP2	20	42
O=C(CC1CC1)NNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819136559	ID	On-Demand	Reactive	MMP3	53	63
O=C(CC1CC1)NNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819136559	ID	On-Demand	Reactive	MMP8	51	63
O=C(CC1CC1)NNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819136559	ID	On-Demand	Reactive	MMP9	23	41
O=C(CC1CC1)NNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819136559	ID	On-Demand	Reactive	ADAM9	59	41
O=C(CC1CC1)NNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819136559	ID	On-Demand	Reactive	MMP7	37	42
O=C(CC1CC1)NNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819136559	ID	On-Demand	Reactive	MMP1	43	42
O=C(CC1CC1)NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819136561	ID	On-Demand	Reactive	MMP13	32	42
O=C(CC1CC1)NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819136561	ID	On-Demand	Reactive	ADAM17	35	41
O=C(CC1CC1)NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819136561	ID	On-Demand	Reactive	MMP2	20	42
O=C(CC1CC1)NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819136561	ID	On-Demand	Reactive	MMP3	53	63
O=C(CC1CC1)NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819136561	ID	On-Demand	Reactive	MMP8	51	63
O=C(CC1CC1)NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819136561	ID	On-Demand	Reactive	MMP9	23	41
O=C(CC1CC1)NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819136561	ID	On-Demand	Reactive	ADAM9	59	41
O=C(CC1CC1)NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819136561	ID	On-Demand	Reactive	MMP7	37	42
O=C(CC1CC1)NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1	ZINC000819136561	ID	On-Demand	Reactive	MMP1	43	42
O=S(=O)(Cc1ccon1)NCCNC[C@H](O)c1ccccc1	ZINC000819136574	EC	On-Demand	Anodyne	ADRB3	67	38
O=S(=O)(Cc1ccon1)NCCNC[C@@H](O)c1ccccc1	ZINC000819136575	EC	On-Demand	Anodyne	ADRB3	67	38
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819136582	CE	On-Demand	Mild	ADRB1	17	45
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819136583	CE	On-Demand	Mild	ADRB1	17	45
CC[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1C	ZINC000819136601	EG	On-Demand	Bother	CACNA1D	59	34
CC[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1ccccc1C	ZINC000819136602	EG	On-Demand	Bother	CACNA1D	59	34
CC[C@@H](CNCCC(=O)N(C)OC)Oc1cccc(C)c1	ZINC000819136611	CE	On-Demand	Anodyne	PDS	42	40
CC(C)(C)OC(=O)N1CCN(CCNC(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819136613	GD	On-Demand	Anodyne	HTR1A	18	41
CC(C)(C)OC(=O)N1CCN(CCNC(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819136613	GD	On-Demand	Anodyne	DRD2	15	41
CC(C)(C)OC(=O)N1CCN(CCNC(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819136613	GD	On-Demand	Anodyne	DRD4	44	34
CC(C)(C)OC(=O)N1CCN(CCNC(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819136613	GD	On-Demand	Anodyne	DRD3	34	41
CC(C)(C)OC(=O)N1CCN(CCNC(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819136613	GD	On-Demand	Anodyne	GPR119	32	40
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc2[nH]ccc12	ZINC000819136622	EF	On-Demand	Anodyne	ADRB2	17	69
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc2[nH]ccc12	ZINC000819136622	EF	On-Demand	Anodyne	ADRB1	24	69
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc2[nH]ccc12	ZINC000819136622	EF	On-Demand	Anodyne	HTR1A	16	69
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc2[nH]ccc12	ZINC000819136622	EF	On-Demand	Anodyne	SLC6A4	19	43
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc2[nH]ccc12	ZINC000819136623	EF	On-Demand	Anodyne	ADRB2	17	69
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc2[nH]ccc12	ZINC000819136623	EF	On-Demand	Anodyne	ADRB1	24	69
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc2[nH]ccc12	ZINC000819136623	EF	On-Demand	Anodyne	HTR1A	16	69
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc2[nH]ccc12	ZINC000819136623	EF	On-Demand	Anodyne	SLC6A4	19	43
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc2[nH]ccc12	ZINC000819136624	EF	On-Demand	Anodyne	ADRB2	17	69
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc2[nH]ccc12	ZINC000819136624	EF	On-Demand	Anodyne	ADRB1	24	69
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc2[nH]ccc12	ZINC000819136624	EF	On-Demand	Anodyne	HTR1A	16	69
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc2[nH]ccc12	ZINC000819136624	EF	On-Demand	Anodyne	SLC6A4	19	43
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc2[nH]ccc12	ZINC000819136625	EF	On-Demand	Anodyne	ADRB2	17	69
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc2[nH]ccc12	ZINC000819136625	EF	On-Demand	Anodyne	ADRB1	24	69
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc2[nH]ccc12	ZINC000819136625	EF	On-Demand	Anodyne	HTR1A	16	69
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc2[nH]ccc12	ZINC000819136625	EF	On-Demand	Anodyne	SLC6A4	19	43
C[C@@H](Cc1ccncc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819136657	FF	On-Demand	Anodyne	GPR119	56	47
C[C@@H](Cc1ccncc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819136659	FF	On-Demand	Anodyne	GPR119	56	47
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1CCCc1ccccc1	ZINC000819136670	ED	On-Demand	Anodyne	ADRB2	24	43
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1CCCc1ccccc1	ZINC000819136670	ED	On-Demand	Anodyne	ADRB1	24	42
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1CCCc1ccccc1	ZINC000819136670	ED	On-Demand	Anodyne	ADRB3	90	50
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1CCCc1ccccc1	ZINC000819136670	ED	On-Demand	Anodyne	PTAFR	17	42
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1CCCc1ccccc1	ZINC000819136671	ED	On-Demand	Anodyne	ADRB2	24	43
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1CCCc1ccccc1	ZINC000819136671	ED	On-Demand	Anodyne	ADRB1	24	42
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1CCCc1ccccc1	ZINC000819136671	ED	On-Demand	Anodyne	ADRB3	90	50
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1CCCc1ccccc1	ZINC000819136671	ED	On-Demand	Anodyne	PTAFR	17	42
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1CCCc1ccccc1	ZINC000819136672	ED	On-Demand	Anodyne	ADRB2	24	43
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1CCCc1ccccc1	ZINC000819136672	ED	On-Demand	Anodyne	ADRB1	24	42
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1CCCc1ccccc1	ZINC000819136672	ED	On-Demand	Anodyne	ADRB3	90	50
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1CCCc1ccccc1	ZINC000819136672	ED	On-Demand	Anodyne	PTAFR	17	42
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1CCCc1ccccc1	ZINC000819136673	ED	On-Demand	Anodyne	ADRB2	24	43
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1CCCc1ccccc1	ZINC000819136673	ED	On-Demand	Anodyne	ADRB1	24	42
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1CCCc1ccccc1	ZINC000819136673	ED	On-Demand	Anodyne	ADRB3	90	50
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1CCCc1ccccc1	ZINC000819136673	ED	On-Demand	Anodyne	PTAFR	17	42
O=C1[C@H](NCC2(O)CCCCC2)CCN1CCCc1ccccc1	ZINC000819136680	EF	On-Demand	Anodyne	ACE	29	41
O=C1[C@H](NCC2(O)CCCCC2)CCN1CCCc1ccccc1	ZINC000819136680	EF	On-Demand	Anodyne	PREP	40	36
O=C1[C@@H](NCC2(O)CCCCC2)CCN1CCCc1ccccc1	ZINC000819136681	EF	On-Demand	Anodyne	ACE	29	41
O=C1[C@@H](NCC2(O)CCCCC2)CCN1CCCc1ccccc1	ZINC000819136681	EF	On-Demand	Anodyne	PREP	40	36
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1cc(F)ccc1F	ZINC000819136684	CF	On-Demand	Anodyne	ADRB2	16	43
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1cc(F)ccc1F	ZINC000819136684	CF	On-Demand	Anodyne	ADRB3	41	38
C[C@@H](Cc1ccncc1)NC[C@H](O)c1cc(F)ccc1F	ZINC000819136685	CF	On-Demand	Anodyne	ADRB2	16	43
C[C@@H](Cc1ccncc1)NC[C@H](O)c1cc(F)ccc1F	ZINC000819136685	CF	On-Demand	Anodyne	ADRB3	41	38
C=C(C)C(C)(C)C(=O)N[C@H](C)COc1ccccc1	ZINC000819136690	CG	On-Demand	Mild	ACE2	41	33
C=C(C)C(C)(C)C(=O)N[C@H](C)COc1ccccc1	ZINC000819136690	CG	On-Demand	Mild	PDS	60	38
C=C(C)C(C)(C)C(=O)N[C@@H](C)COc1ccccc1	ZINC000819136691	CG	On-Demand	Mild	ACE2	41	33
C=C(C)C(C)(C)C(=O)N[C@@H](C)COc1ccccc1	ZINC000819136691	CG	On-Demand	Mild	PDS	60	38
O=C1[C@@H](NC[C@H](O)c2ccccc2F)CCN1CCCc1ccccc1	ZINC000819136721	FF	On-Demand	Anodyne	SIGMAR1	21	41
O=C1[C@H](NC[C@H](O)c2ccccc2F)CCN1CCCc1ccccc1	ZINC000819136722	FF	On-Demand	Anodyne	SIGMAR1	21	41
O=C1[C@@H](NC[C@@H](O)c2ccccc2F)CCN1CCCc1ccccc1	ZINC000819136723	FF	On-Demand	Anodyne	SIGMAR1	21	41
O=C1[C@H](NC[C@@H](O)c2ccccc2F)CCN1CCCc1ccccc1	ZINC000819136724	FF	On-Demand	Anodyne	SIGMAR1	21	41
COC(=O)c1ccc(CCNC(=O)c2cc(S(=O)(=O)NC3CC3)c(Cl)cc2Cl)cc1	ZINC000819136759	JG	On-Demand	Anodyne	CCR8	42	35
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(Oc2ccccc2)c(F)c1	ZINC000819136766	FJ	On-Demand	Anodyne	KCNQ2	55	39
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(Oc2ccccc2)c(F)c1	ZINC000819136767	FJ	On-Demand	Anodyne	KCNQ2	55	39
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(Oc2ccccc2)c(F)c1	ZINC000819136768	FJ	On-Demand	Anodyne	KCNQ2	55	39
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(Oc2ccccc2)c(F)c1	ZINC000819136769	FJ	On-Demand	Anodyne	KCNQ2	55	39
C[C@@H](Cc1ccncc1)NC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819136826	DD	On-Demand	Anodyne	REN	20	41
C[C@@H](Cc1ccncc1)NC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819136829	DD	On-Demand	Anodyne	REN	20	41
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819136872	DE	On-Demand	Bother	ADRB2	47	39
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819136872	DE	On-Demand	Bother	ADRB1	35	48
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819136872	DE	On-Demand	Bother	ADRB3	65	48
C[C@@H](Cc1ccncc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819136873	DE	On-Demand	Bother	ADRB2	47	39
C[C@@H](Cc1ccncc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819136873	DE	On-Demand	Bother	ADRB1	35	48
C[C@@H](Cc1ccncc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819136873	DE	On-Demand	Bother	ADRB3	65	48
CC[C@@H](CNC[C@@H](O)C1CC1)Oc1cccc(C)c1	ZINC000819136885	CF	On-Demand	Anodyne	PDS	27	40
CC[C@@H](CNC[C@H](O)C1CC1)Oc1cccc(C)c1	ZINC000819136886	CF	On-Demand	Anodyne	PDS	27	40
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	ZINC000819136894	FE	On-Demand	Anodyne	PTK6	31	40
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	ZINC000819136895	FE	On-Demand	Anodyne	PTK6	31	40
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	ZINC000819136896	FE	On-Demand	Anodyne	PTK6	31	40
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1	ZINC000819136897	FE	On-Demand	Anodyne	PTK6	31	40
COCCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819136934	EF	On-Demand	Anodyne	ADRB2	31	53
COCCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819136934	EF	On-Demand	Anodyne	ADRB1	50	53
COCCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819136934	EF	On-Demand	Anodyne	ADRB3	28	43
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819136935	EF	On-Demand	Anodyne	ADRB2	31	53
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819136935	EF	On-Demand	Anodyne	ADRB1	50	53
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819136935	EF	On-Demand	Anodyne	ADRB3	28	43
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819136936	EF	On-Demand	Anodyne	ADRB2	31	53
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819136936	EF	On-Demand	Anodyne	ADRB1	50	53
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819136936	EF	On-Demand	Anodyne	ADRB3	28	43
COCCc1ccc(OC[C@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819136937	EF	On-Demand	Anodyne	ADRB2	31	53
COCCc1ccc(OC[C@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819136937	EF	On-Demand	Anodyne	ADRB1	50	53
COCCc1ccc(OC[C@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819136937	EF	On-Demand	Anodyne	ADRB3	28	43
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819136956	DG	On-Demand	Anodyne	ADRB2	15	42
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819136956	DG	On-Demand	Anodyne	ADRB1	15	40
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819136956	DG	On-Demand	Anodyne	ADRB3	41	38
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccc(F)cc1Cl	ZINC000819136957	DG	On-Demand	Anodyne	ADRB2	15	42
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccc(F)cc1Cl	ZINC000819136957	DG	On-Demand	Anodyne	ADRB1	15	40
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccc(F)cc1Cl	ZINC000819136957	DG	On-Demand	Anodyne	ADRB3	41	38
CC[C@@H](CNCCS(=O)(=O)CC)Oc1cccc(C)c1	ZINC000819136964	CE	On-Demand	Anodyne	PDS	47	41
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1C	ZINC000819136966	DF	On-Demand	Anodyne	ADRB2	19	44
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1C	ZINC000819136966	DF	On-Demand	Anodyne	ADRB1	22	44
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1C	ZINC000819136966	DF	On-Demand	Anodyne	ADRB3	80	46
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1C	ZINC000819136968	DF	On-Demand	Anodyne	ADRB2	19	44
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1C	ZINC000819136968	DF	On-Demand	Anodyne	ADRB1	22	44
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1C	ZINC000819136968	DF	On-Demand	Anodyne	ADRB3	80	46
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819137002	FG	On-Demand	Anodyne	ADRB2	45	37
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819137002	FG	On-Demand	Anodyne	ADRB1	18	43
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819137002	FG	On-Demand	Anodyne	ADRB3	39	41
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819137003	FG	On-Demand	Anodyne	ADRB2	45	37
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819137003	FG	On-Demand	Anodyne	ADRB1	18	43
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819137003	FG	On-Demand	Anodyne	ADRB3	39	41
O=C1[C@H](NC[C@H](O)c2cccc3ccccc23)CCN1CCCc1ccccc1	ZINC000819137018	GH	On-Demand	Anodyne	SIGMAR1	18	41
O=C1[C@@H](NC[C@H](O)c2cccc3ccccc23)CCN1CCCc1ccccc1	ZINC000819137019	GH	On-Demand	Anodyne	SIGMAR1	18	41
CON(C)C(=O)CCN[C@H]1CCN(CCCc2ccccc2)C1=O	ZINC000819137026	ED	On-Demand	Anodyne	SIGMAR1	22	41
CON(C)C(=O)CCN[C@@H]1CCN(CCCc2ccccc2)C1=O	ZINC000819137027	ED	On-Demand	Anodyne	SIGMAR1	22	41
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccccc1	ZINC000819137042	CE	On-Demand	Anodyne	ADRB2	49	42
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccccc1	ZINC000819137042	CE	On-Demand	Anodyne	ADRB1	32	64
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccccc1	ZINC000819137042	CE	On-Demand	Anodyne	ADRB3	74	64
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccccc1	ZINC000819137042	CE	On-Demand	Anodyne	AOC3	15	44
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccccc1	ZINC000819137045	CE	On-Demand	Anodyne	ADRB2	49	42
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccccc1	ZINC000819137045	CE	On-Demand	Anodyne	ADRB1	32	64
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccccc1	ZINC000819137045	CE	On-Demand	Anodyne	ADRB3	74	64
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccccc1	ZINC000819137045	CE	On-Demand	Anodyne	AOC3	15	44
O=S(=O)(Cc1ccon1)NCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819137050	FD	On-Demand	Anodyne	ADRB1	40	46
O=S(=O)(Cc1ccon1)NCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819137050	FD	On-Demand	Anodyne	ADRB3	73	46
O=S(=O)(Cc1ccon1)NCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819137051	FD	On-Demand	Anodyne	ADRB1	40	46
O=S(=O)(Cc1ccon1)NCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819137051	FD	On-Demand	Anodyne	ADRB3	73	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	ZINC000819137144	GG	On-Demand	Anodyne	NPY2R	26	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	ZINC000819137144	GG	On-Demand	Anodyne	PREP	18	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)N2CCCCC2)c1	ZINC000819137144	GG	On-Demand	Anodyne	EPHX2	19	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCc2[nH]ccc21	ZINC000819137152	GG	On-Demand	Anodyne	CTSD	82	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCc2[nH]ccc21	ZINC000819137152	GG	On-Demand	Anodyne	PGC	60	35
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCc2[nH]ccc21	ZINC000819137152	GG	On-Demand	Anodyne	CCKAR	44	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCc2[nH]ccc21	ZINC000819137152	GG	On-Demand	Anodyne	BACE2	43	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCc2[nH]ccc21	ZINC000819137152	GG	On-Demand	Anodyne	REN	87	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCc2[nH]ccc21	ZINC000819137152	GG	On-Demand	Anodyne	REN1	20	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCc2[nH]ccc21	ZINC000819137152	GG	On-Demand	Anodyne	BACE1	71	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCc2[nH]ccc21	ZINC000819137152	GG	On-Demand	Anodyne	FPR1	47	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCc2[nH]ccc21	ZINC000819137153	GG	On-Demand	Anodyne	CTSD	82	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCc2[nH]ccc21	ZINC000819137153	GG	On-Demand	Anodyne	PGC	60	35
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCc2[nH]ccc21	ZINC000819137153	GG	On-Demand	Anodyne	CCKAR	44	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCc2[nH]ccc21	ZINC000819137153	GG	On-Demand	Anodyne	BACE2	43	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCc2[nH]ccc21	ZINC000819137153	GG	On-Demand	Anodyne	REN	87	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCc2[nH]ccc21	ZINC000819137153	GG	On-Demand	Anodyne	REN1	20	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCc2[nH]ccc21	ZINC000819137153	GG	On-Demand	Anodyne	BACE1	71	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCc2[nH]ccc21	ZINC000819137153	GG	On-Demand	Anodyne	FPR1	47	39
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)c1cccc(Cl)c1	ZINC000819137184	CG	On-Demand	Anodyne	ADRB1	26	42
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)c1cccc(Cl)c1	ZINC000819137184	CG	On-Demand	Anodyne	ADRB3	41	46
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)c1cccc(Cl)c1	ZINC000819137184	CG	On-Demand	Anodyne	CYP3A4	51	39
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)c1cccc(Cl)c1	ZINC000819137185	CG	On-Demand	Anodyne	ADRB1	26	42
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)c1cccc(Cl)c1	ZINC000819137185	CG	On-Demand	Anodyne	ADRB3	41	46
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)c1cccc(Cl)c1	ZINC000819137185	CG	On-Demand	Anodyne	CYP3A4	51	39
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)c1cccc(Cl)c1	ZINC000819137186	CG	On-Demand	Anodyne	ADRB1	26	42
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)c1cccc(Cl)c1	ZINC000819137186	CG	On-Demand	Anodyne	ADRB3	41	46
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)c1cccc(Cl)c1	ZINC000819137186	CG	On-Demand	Anodyne	CYP3A4	51	39
O[C@H](CN[C@H]1CCCc2[nH]ccc21)c1cccc(Cl)c1	ZINC000819137187	CG	On-Demand	Anodyne	ADRB1	26	42
O[C@H](CN[C@H]1CCCc2[nH]ccc21)c1cccc(Cl)c1	ZINC000819137187	CG	On-Demand	Anodyne	ADRB3	41	46
O[C@H](CN[C@H]1CCCc2[nH]ccc21)c1cccc(Cl)c1	ZINC000819137187	CG	On-Demand	Anodyne	CYP3A4	51	39
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819137192	ED	On-Demand	Anodyne	ADRB2	48	39
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819137192	ED	On-Demand	Anodyne	ADRB1	28	47
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819137192	ED	On-Demand	Anodyne	ADRB3	51	47
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819137192	ED	On-Demand	Anodyne	CYSP_TRYCR	19	41
C[C@@H](Cc1ccncc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819137192	ED	On-Demand	Anodyne	CTSF	41	41
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819137193	ED	On-Demand	Anodyne	ADRB2	48	39
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819137193	ED	On-Demand	Anodyne	ADRB1	28	47
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819137193	ED	On-Demand	Anodyne	ADRB3	51	47
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819137193	ED	On-Demand	Anodyne	CYSP_TRYCR	19	41
C[C@@H](Cc1ccncc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819137193	ED	On-Demand	Anodyne	CTSF	41	41
C=CCCn1cc(C(=O)NCCN2CCN(C(=O)OC(C)(C)C)CC2)nn1	ZINC000819137194	GD	On-Demand	Mild	DRD4	40	31
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)C(F)=C1CCC1	ZINC000819137215	DH	On-Demand	Anodyne	EPHX2	15	44
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)C(F)=C1CCC1	ZINC000819137215	DH	On-Demand	Anodyne	L3MBTL3	49	41
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)C(F)=C1CCC1	ZINC000819137215	DH	On-Demand	Anodyne	KCNK3	44	36
O=C1[C@@H](NC[C@@H](O)C2CC2)CCN1CCCc1ccccc1	ZINC000819137222	DD	On-Demand	Anodyne	SIGMAR1	21	44
O=C1[C@H](NC[C@@H](O)C2CC2)CCN1CCCc1ccccc1	ZINC000819137223	DD	On-Demand	Anodyne	SIGMAR1	21	44
O=C1[C@@H](NC[C@H](O)C2CC2)CCN1CCCc1ccccc1	ZINC000819137224	DD	On-Demand	Anodyne	SIGMAR1	21	44
O=C1[C@H](NC[C@H](O)C2CC2)CCN1CCCc1ccccc1	ZINC000819137225	DD	On-Demand	Anodyne	SIGMAR1	21	44
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2)CCN1CCCc1ccccc1	ZINC000819137236	FF	On-Demand	Anodyne	SLC6A4	15	46
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2)CCN1CCCc1ccccc1	ZINC000819137236	FF	On-Demand	Anodyne	SLC6A3	41	46
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2)CCN1CCCc1ccccc1	ZINC000819137236	FF	On-Demand	Anodyne	SIGMAR1	25	48
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2)CCN1CCCc1ccccc1	ZINC000819137237	FF	On-Demand	Anodyne	SLC6A4	15	46
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2)CCN1CCCc1ccccc1	ZINC000819137237	FF	On-Demand	Anodyne	SLC6A3	41	46
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2)CCN1CCCc1ccccc1	ZINC000819137237	FF	On-Demand	Anodyne	SIGMAR1	25	48
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2)CCN1CCCc1ccccc1	ZINC000819137238	FF	On-Demand	Anodyne	SLC6A4	15	46
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2)CCN1CCCc1ccccc1	ZINC000819137238	FF	On-Demand	Anodyne	SLC6A3	41	46
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2)CCN1CCCc1ccccc1	ZINC000819137238	FF	On-Demand	Anodyne	SIGMAR1	25	48
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2)CCN1CCCc1ccccc1	ZINC000819137239	FF	On-Demand	Anodyne	SLC6A4	15	46
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2)CCN1CCCc1ccccc1	ZINC000819137239	FF	On-Demand	Anodyne	SLC6A3	41	46
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2)CCN1CCCc1ccccc1	ZINC000819137239	FF	On-Demand	Anodyne	SIGMAR1	25	48
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2F)CCN1CCCc1ccccc1	ZINC000819137280	FF	On-Demand	Anodyne	SIGMAR1	17	42
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2F)CCN1CCCc1ccccc1	ZINC000819137281	FF	On-Demand	Anodyne	SIGMAR1	17	42
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2F)CCN1CCCc1ccccc1	ZINC000819137282	FF	On-Demand	Anodyne	SIGMAR1	17	42
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2F)CCN1CCCc1ccccc1	ZINC000819137283	FF	On-Demand	Anodyne	SIGMAR1	17	42
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cc2ccccc2o1	ZINC000819137311	FH	On-Demand	Anodyne	ADRB3	15	42
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cc2ccccc2o1	ZINC000819137311	FH	On-Demand	Anodyne	CYP3A4	43	36
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cc2ccccc2o1	ZINC000819137312	FH	On-Demand	Anodyne	ADRB3	15	42
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cc2ccccc2o1	ZINC000819137312	FH	On-Demand	Anodyne	CYP3A4	43	36
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1ccccc1	ZINC000819137333	DG	On-Demand	Anodyne	SLC6A3	21	52
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1ccccc1	ZINC000819137333	DG	On-Demand	Anodyne	L3MBTL3	93	39
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1ccccc1	ZINC000819137334	DG	On-Demand	Anodyne	SLC6A3	21	52
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1ccccc1	ZINC000819137334	DG	On-Demand	Anodyne	L3MBTL3	93	39
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N(C)C(C)C)c(F)c2)c1	ZINC000819137338	GG	On-Demand	Anodyne	MTNR1A	20	41
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N(C)C(C)C)c(F)c2)c1	ZINC000819137338	GG	On-Demand	Anodyne	MTNR1B	25	41
Cc1nccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819137349	ED	On-Demand	Mild	PAPA1_CARPA	49	47
Cc1nccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819137350	ED	On-Demand	Mild	PAPA1_CARPA	49	47
C[S@](=O)c1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819137356	EE	On-Demand	Bother	CACNA1D	52	32
C[S@](=O)c1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819137357	EE	On-Demand	Bother	CACNA1D	52	32
C[S@@](=O)c1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819137358	EE	On-Demand	Bother	CACNA1D	52	32
C[S@@](=O)c1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819137359	EE	On-Demand	Bother	CACNA1D	52	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(C(=O)c3ccsc3)CC1)C2	ZINC000819137362	GD	On-Demand	Anodyne	NPBWR1	91	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(C(=O)c3ccsc3)CC1)C2	ZINC000819137363	GD	On-Demand	Anodyne	NPBWR1	91	33
C[C@@H]1C[C@H](NCCC(=O)Nc2ccc(N(C)C)cc2)CCN1Cc1ccccc1	ZINC000819137371	GH	On-Demand	Anodyne	LTA4H	32	40
C[C@H]1C[C@H](NCCC(=O)Nc2ccc(N(C)C)cc2)CCN1Cc1ccccc1	ZINC000819137373	GH	On-Demand	Anodyne	LTA4H	32	40
O[C@H](CNC1CCC(N2CCCCC2)CC1)Cc1ccc(F)cc1	ZINC000819137385	EG	On-Demand	Anodyne	L3MBTL3	58	34
O[C@@H](CNC1CCC(N2CCCCC2)CC1)Cc1ccc(F)cc1	ZINC000819137386	EG	On-Demand	Anodyne	L3MBTL3	58	34
O=C(CCNC1CCC(N2CCCCC2)CC1)Nc1cc(F)cc(F)c1	ZINC000819137389	FH	On-Demand	Anodyne	L3MBTL3	63	35
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819137395	DG	On-Demand	Anodyne	ADRB1	46	44
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819137395	DG	On-Demand	Anodyne	ADRB3	69	48
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819137395	DG	On-Demand	Anodyne	IGF1R	27	41
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819137395	DG	On-Demand	Anodyne	CYP3A4	50	41
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819137396	DG	On-Demand	Anodyne	ADRB1	46	44
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819137396	DG	On-Demand	Anodyne	ADRB3	69	48
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819137396	DG	On-Demand	Anodyne	IGF1R	27	41
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819137396	DG	On-Demand	Anodyne	CYP3A4	50	41
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819137397	DG	On-Demand	Anodyne	ADRB1	46	44
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819137397	DG	On-Demand	Anodyne	ADRB3	69	48
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819137397	DG	On-Demand	Anodyne	IGF1R	27	41
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819137397	DG	On-Demand	Anodyne	CYP3A4	50	41
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819137398	DG	On-Demand	Anodyne	ADRB1	46	44
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819137398	DG	On-Demand	Anodyne	ADRB3	69	48
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819137398	DG	On-Demand	Anodyne	IGF1R	27	41
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819137398	DG	On-Demand	Anodyne	CYP3A4	50	41
C#CCNC(=O)CCNC[C@H](CC)Oc1cccc(C(F)(F)F)c1	ZINC000819137402	EF	On-Demand	Mild	PDS	73	45
C#CCNC(=O)CCNC[C@@H](CC)Oc1cccc(C(F)(F)F)c1	ZINC000819137403	EF	On-Demand	Mild	PDS	73	45
CCC1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819137452	CE	On-Demand	Bother	CACNA1D	53	33
CCC1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819137453	CE	On-Demand	Bother	CACNA1D	53	33
O=C1[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1c1cccc(Cl)c1	ZINC000819137462	FG	On-Demand	Anodyne	ADRB1	27	41
O=C1[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1c1cccc(Cl)c1	ZINC000819137462	FG	On-Demand	Anodyne	ADRB3	43	41
O=C1[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1c1cccc(Cl)c1	ZINC000819137462	FG	On-Demand	Anodyne	CYP3A4	45	34
O=C1[C@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1c1cccc(Cl)c1	ZINC000819137463	FG	On-Demand	Anodyne	ADRB1	27	41
O=C1[C@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1c1cccc(Cl)c1	ZINC000819137463	FG	On-Demand	Anodyne	ADRB3	43	41
O=C1[C@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1c1cccc(Cl)c1	ZINC000819137463	FG	On-Demand	Anodyne	CYP3A4	45	34
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137465	GI	On-Demand	Mild	F2	36	46
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137465	GI	On-Demand	Mild	PLG	29	42
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137465	GI	On-Demand	Mild	PRSS1	20	46
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137465	GI	On-Demand	Mild	GHRHR	42	33
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137465	GI	On-Demand	Mild	CELA1	26	46
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137465	GI	On-Demand	Mild	CMA1	34	43
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137465	GI	On-Demand	Mild	CTRA_BOVIN	40	32
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137465	GI	On-Demand	Mild	PRCP	19	52
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137465	GI	On-Demand	Mild	PAPA1_CARPA	38	42
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137465	GI	On-Demand	Mild	TRY1_BOVIN	63	44
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137465	GI	On-Demand	Mild	CCKAR	25	41
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137465	GI	On-Demand	Mild	NTSR1	36	40
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137465	GI	On-Demand	Mild	PREP	33	46
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137465	GI	On-Demand	Mild	CELA2A	40	32
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137465	GI	On-Demand	Mild	REN	43	35
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137465	GI	On-Demand	Mild	LGMN	57	33
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137465	GI	On-Demand	Mild	FPR1	43	36
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137466	GI	On-Demand	Mild	F2	36	46
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137466	GI	On-Demand	Mild	PLG	29	42
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137466	GI	On-Demand	Mild	PRSS1	20	46
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137466	GI	On-Demand	Mild	GHRHR	42	33
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137466	GI	On-Demand	Mild	CELA1	26	46
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137466	GI	On-Demand	Mild	CMA1	34	43
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137466	GI	On-Demand	Mild	CTRA_BOVIN	40	32
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137466	GI	On-Demand	Mild	PRCP	19	52
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137466	GI	On-Demand	Mild	PAPA1_CARPA	38	42
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137466	GI	On-Demand	Mild	TRY1_BOVIN	63	44
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137466	GI	On-Demand	Mild	CCKAR	25	41
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137466	GI	On-Demand	Mild	NTSR1	36	40
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137466	GI	On-Demand	Mild	PREP	33	46
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137466	GI	On-Demand	Mild	CELA2A	40	32
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137466	GI	On-Demand	Mild	REN	43	35
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137466	GI	On-Demand	Mild	LGMN	57	33
Cc1ccccc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819137466	GI	On-Demand	Mild	FPR1	43	36
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819137475	FH	On-Demand	Anodyne	HTR1D	22	41
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819137475	FH	On-Demand	Anodyne	HTR1B	23	41
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819137475	FH	On-Demand	Anodyne	KCNQ2	76	53
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819137475	FH	On-Demand	Anodyne	NPY2R	118	44
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819137475	FH	On-Demand	Anodyne	TAAR1	33	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1c1ccccc1C)C2	ZINC000819137484	FH	On-Demand	Anodyne	WNT3	40	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H]1c1ccccc1C)C2	ZINC000819137485	FH	On-Demand	Anodyne	WNT3	40	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1c1ccccc1C)C2	ZINC000819137486	FH	On-Demand	Anodyne	WNT3	40	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H]1c1ccccc1C)C2	ZINC000819137487	FH	On-Demand	Anodyne	WNT3	40	33
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819137488	FF	On-Demand	Anodyne	ADRB2	30	40
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819137488	FF	On-Demand	Anodyne	ADRB1	56	45
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819137488	FF	On-Demand	Anodyne	ADRB3	35	44
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819137489	FF	On-Demand	Anodyne	ADRB2	30	40
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819137489	FF	On-Demand	Anodyne	ADRB1	56	45
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819137489	FF	On-Demand	Anodyne	ADRB3	35	44
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819137490	FF	On-Demand	Anodyne	ADRB2	30	40
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819137490	FF	On-Demand	Anodyne	ADRB1	56	45
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819137490	FF	On-Demand	Anodyne	ADRB3	35	44
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819137491	FF	On-Demand	Anodyne	ADRB2	30	40
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819137491	FF	On-Demand	Anodyne	ADRB1	56	45
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819137491	FF	On-Demand	Anodyne	ADRB3	35	44
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2)CCN1c1cccc(Cl)c1	ZINC000819137499	EF	On-Demand	Anodyne	ADRB3	40	37
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2)CCN1c1cccc(Cl)c1	ZINC000819137499	EF	On-Demand	Anodyne	CYP3A4	46	34
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2)CCN1c1cccc(Cl)c1	ZINC000819137500	EF	On-Demand	Anodyne	ADRB3	40	37
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2)CCN1c1cccc(Cl)c1	ZINC000819137500	EF	On-Demand	Anodyne	CYP3A4	46	34
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2)CCN1c1cccc(Cl)c1	ZINC000819137501	EF	On-Demand	Anodyne	ADRB3	40	37
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2)CCN1c1cccc(Cl)c1	ZINC000819137501	EF	On-Demand	Anodyne	CYP3A4	46	34
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2)CCN1c1cccc(Cl)c1	ZINC000819137502	EF	On-Demand	Anodyne	ADRB3	40	37
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2)CCN1c1cccc(Cl)c1	ZINC000819137502	EF	On-Demand	Anodyne	CYP3A4	46	34
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819137509	DE	On-Demand	Mild	ADRB2	16	40
N#Cc1ccc(OC[C@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819137510	DE	On-Demand	Mild	ADRB2	16	40
N#Cc1ccc(OC[C@@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819137511	DE	On-Demand	Mild	ADRB2	16	40
N#Cc1ccc(OC[C@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819137512	DE	On-Demand	Mild	ADRB2	16	40
CC[C@@H](CNCCS(=O)(=O)CC)Oc1cccc(C(F)(F)F)c1	ZINC000819137542	FF	On-Demand	Anodyne	PDS	66	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cc(F)ccc1Br)C2	ZINC000819137574	GG	On-Demand	Anodyne	P2RX7	38	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cc(F)ccc1Br)C2	ZINC000819137575	GG	On-Demand	Anodyne	P2RX7	38	43
CN(C)c1ccc(NC(=O)CCNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819137590	FG	On-Demand	Anodyne	L3MBTL3	60	36
C[S@](=O)c1ccc(CNC[C@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819137596	GG	On-Demand	Anodyne	LEF	47	34
C[S@@](=O)c1ccc(CNC[C@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819137597	GG	On-Demand	Anodyne	LEF	47	34
C[S@@](=O)c1ccc(CNC[C@@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819137598	GG	On-Demand	Anodyne	LEF	47	34
C[S@](=O)c1ccc(CNC[C@@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819137599	GG	On-Demand	Anodyne	LEF	47	34
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)cc1	ZINC000819137602	EG	On-Demand	Anodyne	ADRB1	27	41
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)cc1	ZINC000819137602	EG	On-Demand	Anodyne	ADRB3	46	41
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)cc1	ZINC000819137602	EG	On-Demand	Anodyne	CYP3A4	49	39
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)cc1	ZINC000819137603	EG	On-Demand	Anodyne	ADRB1	27	41
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)cc1	ZINC000819137603	EG	On-Demand	Anodyne	ADRB3	46	41
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)cc1	ZINC000819137603	EG	On-Demand	Anodyne	CYP3A4	49	39
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)cc1	ZINC000819137604	EG	On-Demand	Anodyne	ADRB1	27	41
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)cc1	ZINC000819137604	EG	On-Demand	Anodyne	ADRB3	46	41
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)cc1	ZINC000819137604	EG	On-Demand	Anodyne	CYP3A4	49	39
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)cc1	ZINC000819137605	EG	On-Demand	Anodyne	ADRB1	27	41
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)cc1	ZINC000819137605	EG	On-Demand	Anodyne	ADRB3	46	41
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)cc1	ZINC000819137605	EG	On-Demand	Anodyne	CYP3A4	49	39
CS(=O)(=O)c1ccc([C@@H](O)CNCCn2c(O)nc3ccccc32)cc1	ZINC000819137621	GD	On-Demand	Anodyne	ADRB3	69	38
CS(=O)(=O)c1ccc([C@H](O)CNCCn2c(O)nc3ccccc32)cc1	ZINC000819137622	GD	On-Demand	Anodyne	ADRB3	69	38
C[S@@](=O)c1ccc(CNC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819137625	GF	On-Demand	Anodyne	GPR119	21	46
C[S@](=O)c1ccc(CNC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819137626	GF	On-Demand	Anodyne	GPR119	21	46
C[S@](=O)c1ccc(CNC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819137627	GF	On-Demand	Anodyne	GPR119	21	46
C[S@@](=O)c1ccc(CNC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819137628	GF	On-Demand	Anodyne	GPR119	21	46
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc([N+](=O)[O-])cc1	ZINC000819137630	CD	On-Demand	Bother	SLC27A4	48	31
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc([N+](=O)[O-])cc1	ZINC000819137630	CD	On-Demand	Bother	LUXR	17	41
O=C(/C=C\[C@H]1CCCO1)NCc1ccc([N+](=O)[O-])cc1	ZINC000819137631	CD	On-Demand	Bother	SLC27A4	48	31
O=C(/C=C\[C@H]1CCCO1)NCc1ccc([N+](=O)[O-])cc1	ZINC000819137631	CD	On-Demand	Bother	LUXR	17	41
O=C(/C=C/[C@H]1CCCO1)NCc1ccc([N+](=O)[O-])cc1	ZINC000819137632	CD	On-Demand	Bother	SLC27A4	48	31
O=C(/C=C/[C@H]1CCCO1)NCc1ccc([N+](=O)[O-])cc1	ZINC000819137632	CD	On-Demand	Bother	LUXR	17	41
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc([N+](=O)[O-])cc1	ZINC000819137633	CD	On-Demand	Bother	SLC27A4	48	31
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc([N+](=O)[O-])cc1	ZINC000819137633	CD	On-Demand	Bother	LUXR	17	41
O=C(/C=C/[C@@H]1CCCO1)Nc1cnn(Cc2ccccc2)c1	ZINC000819137641	CF	On-Demand	Anodyne	ITK	17	46
O=C(/C=C/[C@@H]1CCCO1)Nc1cnn(Cc2ccccc2)c1	ZINC000819137641	CF	On-Demand	Anodyne	PANC	62	46
O=C(/C=C\[C@H]1CCCO1)Nc1cnn(Cc2ccccc2)c1	ZINC000819137642	CF	On-Demand	Anodyne	ITK	17	46
O=C(/C=C\[C@H]1CCCO1)Nc1cnn(Cc2ccccc2)c1	ZINC000819137642	CF	On-Demand	Anodyne	PANC	62	46
O=C(/C=C\[C@@H]1CCCO1)Nc1cnn(Cc2ccccc2)c1	ZINC000819137643	CF	On-Demand	Anodyne	ITK	17	46
O=C(/C=C\[C@@H]1CCCO1)Nc1cnn(Cc2ccccc2)c1	ZINC000819137643	CF	On-Demand	Anodyne	PANC	62	46
O=C(/C=C/[C@H]1CCCO1)Nc1cnn(Cc2ccccc2)c1	ZINC000819137644	CF	On-Demand	Anodyne	ITK	17	46
O=C(/C=C/[C@H]1CCCO1)Nc1cnn(Cc2ccccc2)c1	ZINC000819137644	CF	On-Demand	Anodyne	PANC	62	46
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(NC(=O)c2ccccn2)c1	ZINC000819137647	FF	On-Demand	Anodyne	GRM4	62	43
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(NC(=O)c2ccccn2)c1	ZINC000819137647	FF	On-Demand	Anodyne	KCNK3	27	45
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(NC(=O)c2ccccn2)c1	ZINC000819137648	FF	On-Demand	Anodyne	GRM4	62	43
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(NC(=O)c2ccccn2)c1	ZINC000819137648	FF	On-Demand	Anodyne	KCNK3	27	45
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(NC(=O)c2ccccn2)c1	ZINC000819137649	FF	On-Demand	Anodyne	GRM4	62	43
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(NC(=O)c2ccccn2)c1	ZINC000819137649	FF	On-Demand	Anodyne	KCNK3	27	45
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(NC(=O)c2ccccn2)c1	ZINC000819137650	FF	On-Demand	Anodyne	GRM4	62	43
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(NC(=O)c2ccccn2)c1	ZINC000819137650	FF	On-Demand	Anodyne	KCNK3	27	45
C[C@H](NC[C@H](O)c1cccnc1)c1nc(Cc2ccccc2)no1	ZINC000819137658	DE	On-Demand	Anodyne	ADRB2	22	41
C[C@H](NC[C@H](O)c1cccnc1)c1nc(Cc2ccccc2)no1	ZINC000819137658	DE	On-Demand	Anodyne	ADRB1	25	48
C[C@H](NC[C@H](O)c1cccnc1)c1nc(Cc2ccccc2)no1	ZINC000819137658	DE	On-Demand	Anodyne	ADRB3	87	48
C[C@@H](NC[C@@H](O)c1cccnc1)c1nc(Cc2ccccc2)no1	ZINC000819137660	DE	On-Demand	Anodyne	ADRB2	22	41
C[C@@H](NC[C@@H](O)c1cccnc1)c1nc(Cc2ccccc2)no1	ZINC000819137660	DE	On-Demand	Anodyne	ADRB1	25	48
C[C@@H](NC[C@@H](O)c1cccnc1)c1nc(Cc2ccccc2)no1	ZINC000819137660	DE	On-Demand	Anodyne	ADRB3	87	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccccc1N1CCC(O)CC1)C2	ZINC000819137664	GE	On-Demand	Anodyne	KCNQ2	68	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccccc1N1CCC(O)CC1)C2	ZINC000819137665	GE	On-Demand	Anodyne	KCNQ2	68	38
CC[C@@H](CNC[C@@H](O)c1ccc(F)cn1)Oc1cccc(C(F)(F)F)c1	ZINC000819137668	FH	On-Demand	Anodyne	PDS	52	43
CC[C@@H](CNC[C@H](O)c1ccc(F)cn1)Oc1cccc(C(F)(F)F)c1	ZINC000819137669	FH	On-Demand	Anodyne	PDS	52	43
C[S@](=O)c1ccc(CNC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819137678	EG	On-Demand	Anodyne	LEF	44	34
C[S@@](=O)c1ccc(CNC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819137679	EG	On-Demand	Anodyne	LEF	44	34
C[S@@](=O)c1ccc(CNC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819137680	EG	On-Demand	Anodyne	LEF	44	34
C[S@](=O)c1ccc(CNC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819137681	EG	On-Demand	Anodyne	LEF	44	34
Oc1nc2ccccc2n1CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819137697	GF	On-Demand	Anodyne	ADRB3	25	42
Oc1nc2ccccc2n1CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819137698	GF	On-Demand	Anodyne	ADRB3	25	42
O=C(CCNC1CCC(N2CCCCC2)CC1)Nc1cccnc1	ZINC000819137711	EF	On-Demand	Anodyne	CHRNA7	47	44
O=C(CCNC1CCC(N2CCCCC2)CC1)Nc1cccnc1	ZINC000819137711	EF	On-Demand	Anodyne	L3MBTL3	55	34
O=C(CCNC1CCC(N2CCCCC2)CC1)Nc1cccnc1	ZINC000819137711	EF	On-Demand	Anodyne	NAMPT	31	42
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819137712	EG	On-Demand	Anodyne	ADRB1	31	41
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819137712	EG	On-Demand	Anodyne	ADRB3	52	45
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819137712	EG	On-Demand	Anodyne	IGF1R	27	40
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819137712	EG	On-Demand	Anodyne	CYP3A4	50	40
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819137713	EG	On-Demand	Anodyne	ADRB1	31	41
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819137713	EG	On-Demand	Anodyne	ADRB3	52	45
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819137713	EG	On-Demand	Anodyne	IGF1R	27	40
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819137713	EG	On-Demand	Anodyne	CYP3A4	50	40
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819137714	EG	On-Demand	Anodyne	ADRB1	31	41
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819137714	EG	On-Demand	Anodyne	ADRB3	52	45
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819137714	EG	On-Demand	Anodyne	IGF1R	27	40
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819137714	EG	On-Demand	Anodyne	CYP3A4	50	40
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819137715	EG	On-Demand	Anodyne	ADRB1	31	41
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819137715	EG	On-Demand	Anodyne	ADRB3	52	45
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819137715	EG	On-Demand	Anodyne	IGF1R	27	40
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819137715	EG	On-Demand	Anodyne	CYP3A4	50	40
C[C@@H]1C[C@H](NC[C@@H](O)c2cc3ccccc3o2)CCN1Cc1ccccc1	ZINC000819137721	FI	On-Demand	Anodyne	SIGMAR1	24	44
C[C@H]1C[C@H](NC[C@@H](O)c2cc3ccccc3o2)CCN1Cc1ccccc1	ZINC000819137726	FI	On-Demand	Anodyne	SIGMAR1	24	44
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc(C(F)(F)F)c1	ZINC000819137789	FG	On-Demand	Anodyne	PDS	41	37
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc(C(F)(F)F)c1	ZINC000819137790	FG	On-Demand	Anodyne	PDS	41	37
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc(C(F)(F)F)c1	ZINC000819137791	FG	On-Demand	Anodyne	PDS	41	37
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc(C(F)(F)F)c1	ZINC000819137792	FG	On-Demand	Anodyne	PDS	41	37
C=CCC1(C(=O)Nc2ccc(N3CCCC3)c(F)c2)CCOCC1	ZINC000819137799	EH	On-Demand	Mild	NPY2R	74	42
O=C1[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)CCN1c1cccc(Cl)c1	ZINC000819137814	FG	On-Demand	Anodyne	ADRB3	41	38
O=C1[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)CCN1c1cccc(Cl)c1	ZINC000819137814	FG	On-Demand	Anodyne	CYP3A4	45	34
O=C1[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)CCN1c1cccc(Cl)c1	ZINC000819137815	FG	On-Demand	Anodyne	ADRB3	41	38
O=C1[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)CCN1c1cccc(Cl)c1	ZINC000819137815	FG	On-Demand	Anodyne	CYP3A4	45	34
O=C1[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)CCN1c1cccc(Cl)c1	ZINC000819137816	FG	On-Demand	Anodyne	ADRB3	41	38
O=C1[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)CCN1c1cccc(Cl)c1	ZINC000819137816	FG	On-Demand	Anodyne	CYP3A4	45	34
O=C1[C@H](NC[C@H](O)c2ccc(F)c(F)c2)CCN1c1cccc(Cl)c1	ZINC000819137817	FG	On-Demand	Anodyne	ADRB3	41	38
O=C1[C@H](NC[C@H](O)c2ccc(F)c(F)c2)CCN1c1cccc(Cl)c1	ZINC000819137817	FG	On-Demand	Anodyne	CYP3A4	45	34
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(c2cccc(Cl)c2)C1=O	ZINC000819137818	EG	On-Demand	Anodyne	CYP3A4	46	34
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(c2cccc(Cl)c2)C1=O	ZINC000819137820	EG	On-Demand	Anodyne	CYP3A4	46	34
C[C@@H]1C[C@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)CCN1Cc1ccccc1	ZINC000819137850	GF	On-Demand	Anodyne	SIGMAR1	21	41
C[C@@H]1C[C@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)CCN1Cc1ccccc1	ZINC000819137852	GF	On-Demand	Anodyne	SIGMAR1	21	41
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COCc1ccccc1	ZINC000819137855	EF	On-Demand	Anodyne	ADRB2	20	41
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COCc1ccccc1	ZINC000819137855	EF	On-Demand	Anodyne	ADRB1	18	41
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COCc1ccccc1	ZINC000819137855	EF	On-Demand	Anodyne	L3MBTL3	44	34
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819137860	GG	On-Demand	Anodyne	PTPN1	37	47
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819137861	GG	On-Demand	Anodyne	PTPN1	37	47
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819137862	GG	On-Demand	Anodyne	PTPN1	37	47
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819137863	GG	On-Demand	Anodyne	PTPN1	37	47
C[C@H]1C[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)CCN1Cc1ccccc1	ZINC000819137864	GI	On-Demand	Anodyne	ADRB3	15	44
C[C@H]1C[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)CCN1Cc1ccccc1	ZINC000819137864	GI	On-Demand	Anodyne	SLC6A5	27	40
C[C@H]1C[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)CCN1Cc1ccccc1	ZINC000819137867	GI	On-Demand	Anodyne	ADRB3	15	44
C[C@H]1C[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)CCN1Cc1ccccc1	ZINC000819137867	GI	On-Demand	Anodyne	SLC6A5	27	40
C[S@](=O)c1ccc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819137870	GF	On-Demand	Anodyne	GPR119	46	54
C[S@@](=O)c1ccc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819137871	GF	On-Demand	Anodyne	GPR119	46	54
C[S@](=O)c1ccc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819137872	GF	On-Demand	Anodyne	GPR119	46	54
C[S@@](=O)c1ccc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819137873	GF	On-Demand	Anodyne	GPR119	46	54
CC[C@@H](CNCCC(=O)N(C)OC)Oc1cccc(C(F)(F)F)c1	ZINC000819137875	EF	On-Demand	Anodyne	PDS	64	44
Cc1c(F)cccc1NC(=O)CCNC1CCC(N2CCCCC2)CC1	ZINC000819137884	FH	On-Demand	Anodyne	L3MBTL3	45	33
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCN1c1cccc(Cl)c1	ZINC000819137887	EF	On-Demand	Anodyne	ADRB3	62	43
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCN1c1cccc(Cl)c1	ZINC000819137887	EF	On-Demand	Anodyne	CYP3A4	47	36
O=C1[C@H](NC[C@H](O)c2ccccc2)CCN1c1cccc(Cl)c1	ZINC000819137888	EF	On-Demand	Anodyne	ADRB3	62	43
O=C1[C@H](NC[C@H](O)c2ccccc2)CCN1c1cccc(Cl)c1	ZINC000819137888	EF	On-Demand	Anodyne	CYP3A4	47	36
CN(C(=O)c1ccccc1NC(=O)c1cc2c(cn1)OCCO2)C1CCCCC1	ZINC000819137902	GH	On-Demand	Anodyne	G2YM83_BOTF4	65	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccccc1N1CCC(O)CC1	ZINC000819137908	GE	On-Demand	Anodyne	KCNQ2	69	40
O=C(CCNC1CCC(N2CCCCC2)CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000819137913	FG	On-Demand	Bother	L3MBTL3	48	38
C[C@H](NC[C@H](O)c1cccnc1)c1noc(Cc2ccccc2)n1	ZINC000819137920	DE	On-Demand	Anodyne	ADRB2	19	40
C[C@H](NC[C@H](O)c1cccnc1)c1noc(Cc2ccccc2)n1	ZINC000819137920	DE	On-Demand	Anodyne	ADRB1	21	46
C[C@H](NC[C@H](O)c1cccnc1)c1noc(Cc2ccccc2)n1	ZINC000819137920	DE	On-Demand	Anodyne	ADRB3	74	46
C[C@@H](NC[C@@H](O)c1cccnc1)c1noc(Cc2ccccc2)n1	ZINC000819137922	DE	On-Demand	Anodyne	ADRB2	19	40
C[C@@H](NC[C@@H](O)c1cccnc1)c1noc(Cc2ccccc2)n1	ZINC000819137922	DE	On-Demand	Anodyne	ADRB1	21	46
C[C@@H](NC[C@@H](O)c1cccnc1)c1noc(Cc2ccccc2)n1	ZINC000819137922	DE	On-Demand	Anodyne	ADRB3	74	46
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccccc1C(F)(F)F	ZINC000819137938	FG	On-Demand	Anodyne	ADRB2	15	45
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccccc1C(F)(F)F	ZINC000819137938	FG	On-Demand	Anodyne	ADRB1	19	45
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccccc1C(F)(F)F	ZINC000819137939	FG	On-Demand	Anodyne	ADRB2	15	45
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccccc1C(F)(F)F	ZINC000819137939	FG	On-Demand	Anodyne	ADRB1	19	45
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccccc1C(F)(F)F	ZINC000819137940	FG	On-Demand	Anodyne	ADRB2	15	45
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccccc1C(F)(F)F	ZINC000819137940	FG	On-Demand	Anodyne	ADRB1	19	45
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccccc1C(F)(F)F	ZINC000819137941	FG	On-Demand	Anodyne	ADRB2	15	45
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccccc1C(F)(F)F	ZINC000819137941	FG	On-Demand	Anodyne	ADRB1	19	45
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	CHRM1	15	63
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	DRD2	23	46
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	DRD4	52	62
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	ACHE	38	50
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	HRH2	32	45
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	DRD3	20	44
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	KCNH2	17	53
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	HTR4	23	43
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	CHRM3	24	63
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	SIGMAR1	40	64
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	SSTR5	77	40
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	CCR3	46	46
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	MLNR	17	40
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	MTNR1A	33	41
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	MTNR1B	35	41
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	FAAH	33	46
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	PDK1	52	41
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	CXCR3	21	44
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	MCHR1	62	56
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	CACNA1G	32	48
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	CCR8	31	56
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	EG	On-Demand	Mild	HPGDS	27	44
CNC(=O)COc1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819137988	DD	On-Demand	Anodyne	PDS	62	39
COc1cccc([S@@](=O)CC(=O)Nc2ccc(CN3CCOC3=O)cc2)c1	ZINC000819138023	GE	On-Demand	Anodyne	MTNR1A	17	42
COc1cccc([S@@](=O)CC(=O)Nc2ccc(CN3CCOC3=O)cc2)c1	ZINC000819138023	GE	On-Demand	Anodyne	MTNR1B	23	42
C[C@@H]1CC[C@@H](C)C1NC[C@H](O)COc1ccc(F)cc1	ZINC000819138026	CF	On-Demand	Anodyne	ADRB2	48	44
C[C@@H]1CC[C@@H](C)C1NC[C@H](O)COc1ccc(F)cc1	ZINC000819138026	CF	On-Demand	Anodyne	ADRB1	59	42
C[C@@H]1CC[C@@H](C)C1NC[C@H](O)COc1ccc(F)cc1	ZINC000819138026	CF	On-Demand	Anodyne	ADRB3	36	41
C[C@H]1CC[C@@H](C)[C@@H]1NC[C@H](O)COc1ccc(F)cc1	ZINC000819138027	CF	On-Demand	Anodyne	ADRB2	48	44
C[C@H]1CC[C@@H](C)[C@@H]1NC[C@H](O)COc1ccc(F)cc1	ZINC000819138027	CF	On-Demand	Anodyne	ADRB1	59	42
C[C@H]1CC[C@@H](C)[C@@H]1NC[C@H](O)COc1ccc(F)cc1	ZINC000819138027	CF	On-Demand	Anodyne	ADRB3	36	41
C[C@H]1CC[C@@H](C)[C@@H]1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819138028	CF	On-Demand	Anodyne	ADRB2	48	44
C[C@H]1CC[C@@H](C)[C@@H]1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819138028	CF	On-Demand	Anodyne	ADRB1	59	42
C[C@H]1CC[C@@H](C)[C@@H]1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819138028	CF	On-Demand	Anodyne	ADRB3	36	41
C[C@@H]1CC[C@@H](C)C1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819138029	CF	On-Demand	Anodyne	ADRB2	48	44
C[C@@H]1CC[C@@H](C)C1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819138029	CF	On-Demand	Anodyne	ADRB1	59	42
C[C@@H]1CC[C@@H](C)C1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819138029	CF	On-Demand	Anodyne	ADRB3	36	41
O[C@@H](CNCCOc1c(Cl)cc(Cl)cc1Cl)c1cccnc1	ZINC000819138034	FH	On-Demand	Anodyne	ADRB2	35	57
O[C@@H](CNCCOc1c(Cl)cc(Cl)cc1Cl)c1cccnc1	ZINC000819138034	FH	On-Demand	Anodyne	ADRB1	54	57
O[C@@H](CNCCOc1c(Cl)cc(Cl)cc1Cl)c1cccnc1	ZINC000819138034	FH	On-Demand	Anodyne	ADRB3	122	57
O[C@H](CNCCOc1c(Cl)cc(Cl)cc1Cl)c1cccnc1	ZINC000819138035	FH	On-Demand	Anodyne	ADRB2	35	57
O[C@H](CNCCOc1c(Cl)cc(Cl)cc1Cl)c1cccnc1	ZINC000819138035	FH	On-Demand	Anodyne	ADRB1	54	57
O[C@H](CNCCOc1c(Cl)cc(Cl)cc1Cl)c1cccnc1	ZINC000819138035	FH	On-Demand	Anodyne	ADRB3	122	57
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138037	EG	On-Demand	Mild	ADRB1	19	40
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138037	EG	On-Demand	Mild	ADRB3	34	46
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138037	EG	On-Demand	Mild	CYP3A4	47	38
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138038	EG	On-Demand	Mild	ADRB1	19	40
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138038	EG	On-Demand	Mild	ADRB3	34	46
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138038	EG	On-Demand	Mild	CYP3A4	47	38
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138039	EG	On-Demand	Mild	ADRB1	19	40
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138039	EG	On-Demand	Mild	ADRB3	34	46
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138039	EG	On-Demand	Mild	CYP3A4	47	38
N#Cc1ccc([C@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138040	EG	On-Demand	Mild	ADRB1	19	40
N#Cc1ccc([C@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138040	EG	On-Demand	Mild	ADRB3	34	46
N#Cc1ccc([C@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138040	EG	On-Demand	Mild	CYP3A4	47	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cnn(Cc3ccccc3)c1)C2	ZINC000819138050	FF	On-Demand	Anodyne	ITK	16	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cnn(Cc3ccccc3)c1)C2	ZINC000819138050	FF	On-Demand	Anodyne	PANC	64	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cnn(Cc3ccccc3)c1)C2	ZINC000819138051	FF	On-Demand	Anodyne	ITK	16	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cnn(Cc3ccccc3)c1)C2	ZINC000819138051	FF	On-Demand	Anodyne	PANC	64	47
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1cccc(Cl)c1	ZINC000819138056	EH	On-Demand	Anodyne	ADRB1	37	47
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1cccc(Cl)c1	ZINC000819138056	EH	On-Demand	Anodyne	ADRB3	56	49
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1cccc(Cl)c1	ZINC000819138056	EH	On-Demand	Anodyne	IGF1R	29	47
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1cccc(Cl)c1	ZINC000819138056	EH	On-Demand	Anodyne	CYP3A4	54	47
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1cccc(Cl)c1	ZINC000819138056	EH	On-Demand	Anodyne	L3MBTL3	53	35
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1cccc(Cl)c1	ZINC000819138057	EH	On-Demand	Anodyne	ADRB1	37	47
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1cccc(Cl)c1	ZINC000819138057	EH	On-Demand	Anodyne	ADRB3	56	49
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1cccc(Cl)c1	ZINC000819138057	EH	On-Demand	Anodyne	IGF1R	29	47
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1cccc(Cl)c1	ZINC000819138057	EH	On-Demand	Anodyne	CYP3A4	54	47
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1cccc(Cl)c1	ZINC000819138057	EH	On-Demand	Anodyne	L3MBTL3	53	35
CC(=O)Nc1cccc(CC(=O)Nc2cc(N3CCCC3=O)ccc2F)c1	ZINC000819138059	FG	On-Demand	Anodyne	KCNQ2	25	43
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)c1	ZINC000819138073	FG	On-Demand	Bother	ADRB3	45	44
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)c1	ZINC000819138073	FG	On-Demand	Bother	CYP3A4	48	39
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)c1	ZINC000819138074	FG	On-Demand	Bother	ADRB3	45	44
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)c1	ZINC000819138074	FG	On-Demand	Bother	CYP3A4	48	39
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)c1	ZINC000819138075	FG	On-Demand	Bother	ADRB3	45	44
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)c1	ZINC000819138075	FG	On-Demand	Bother	CYP3A4	48	39
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)c1	ZINC000819138076	FG	On-Demand	Bother	ADRB3	45	44
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)c1	ZINC000819138076	FG	On-Demand	Bother	CYP3A4	48	39
CN1CCC(N(C)c2ccc(NC(=O)c3cc4c(cn3)OCCO4)cc2)CC1	ZINC000819138088	GF	On-Demand	Anodyne	HTR1F	38	40
CC[C@@H](CNCCS(C)(=O)=O)Oc1cccc(C(F)(F)F)c1	ZINC000819138102	EE	On-Demand	Anodyne	PDS	58	45
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(c2cccc(Cl)c2)C1	ZINC000819138105	EH	On-Demand	Anodyne	ADRB3	28	44
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(c2cccc(Cl)c2)C1	ZINC000819138105	EH	On-Demand	Anodyne	CYP3A4	49	39
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(c2cccc(Cl)c2)C1	ZINC000819138106	EH	On-Demand	Anodyne	ADRB3	28	44
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(c2cccc(Cl)c2)C1	ZINC000819138106	EH	On-Demand	Anodyne	CYP3A4	49	39
Oc1nc2ccccc2n1CCNC[C@H](O)c1cccnc1	ZINC000819138112	CD	On-Demand	Anodyne	ADRB2	30	46
Oc1nc2ccccc2n1CCNC[C@H](O)c1cccnc1	ZINC000819138112	CD	On-Demand	Anodyne	ADRB1	28	45
Oc1nc2ccccc2n1CCNC[C@H](O)c1cccnc1	ZINC000819138112	CD	On-Demand	Anodyne	ADRB3	102	54
Oc1nc2ccccc2n1CCNC[C@@H](O)c1cccnc1	ZINC000819138113	CD	On-Demand	Anodyne	ADRB2	30	46
Oc1nc2ccccc2n1CCNC[C@@H](O)c1cccnc1	ZINC000819138113	CD	On-Demand	Anodyne	ADRB1	28	45
Oc1nc2ccccc2n1CCNC[C@@H](O)c1cccnc1	ZINC000819138113	CD	On-Demand	Anodyne	ADRB3	102	54
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138121	FG	On-Demand	Bother	ADRB3	30	41
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138121	FG	On-Demand	Bother	CYP3A4	43	36
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138122	FG	On-Demand	Bother	ADRB3	30	41
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138122	FG	On-Demand	Bother	CYP3A4	43	36
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138123	FG	On-Demand	Bother	ADRB3	30	41
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138123	FG	On-Demand	Bother	CYP3A4	43	36
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138124	FG	On-Demand	Bother	ADRB3	30	41
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138124	FG	On-Demand	Bother	CYP3A4	43	36
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1cccc2ccccc12	ZINC000819138131	FI	On-Demand	Anodyne	L3MBTL3	72	40
Cc1cc(OC(C)C)ccc1NC(=O)C(F)=C1CCC1	ZINC000819138140	CI	On-Demand	Anodyne	THRB	20	40
C=CCCn1cc(C(=O)Nc2ccc(N3CCCC3)c(F)c2)nn1	ZINC000819138181	EF	On-Demand	Mild	NPY2R	72	36
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccccc1F	ZINC000819138182	DF	On-Demand	Anodyne	ADRB2	17	47
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccccc1F	ZINC000819138182	DF	On-Demand	Anodyne	ADRB1	24	47
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccccc1F	ZINC000819138183	DF	On-Demand	Anodyne	ADRB2	17	47
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccccc1F	ZINC000819138183	DF	On-Demand	Anodyne	ADRB1	24	47
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccccc1F	ZINC000819138184	DF	On-Demand	Anodyne	ADRB2	17	47
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccccc1F	ZINC000819138184	DF	On-Demand	Anodyne	ADRB1	24	47
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccccc1F	ZINC000819138187	DF	On-Demand	Anodyne	ADRB2	17	47
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccccc1F	ZINC000819138187	DF	On-Demand	Anodyne	ADRB1	24	47
Cc1cc(OC(C)C)ccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819138191	GI	On-Demand	Mild	PAPA1_CARPA	43	43
COc1cccc([S@](=O)CC(=O)N(C)c2ccc(C)c(C)c2)c1	ZINC000819138192	EG	On-Demand	Anodyne	MTNR1A	24	41
COc1cccc([S@](=O)CC(=O)N(C)c2ccc(C)c(C)c2)c1	ZINC000819138192	EG	On-Demand	Anodyne	MTNR1B	26	41
COc1cccc([S@](=O)CC(=O)N(C)c2ccc(C)c(C)c2)c1	ZINC000819138192	EG	On-Demand	Anodyne	HSD17B2	24	42
Cc1cc(OC(C)C)ccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819138193	GI	On-Demand	Mild	PAPA1_CARPA	43	43
COc1cccc([S@@](=O)CC(=O)N(C)c2ccc(C)c(C)c2)c1	ZINC000819138194	EG	On-Demand	Anodyne	MTNR1A	24	41
COc1cccc([S@@](=O)CC(=O)N(C)c2ccc(C)c(C)c2)c1	ZINC000819138194	EG	On-Demand	Anodyne	MTNR1B	26	41
COc1cccc([S@@](=O)CC(=O)N(C)c2ccc(C)c(C)c2)c1	ZINC000819138194	EG	On-Demand	Anodyne	HSD17B2	24	42
O=C(/C=C/[C@@H]1CCCO1)Nc1ccccc1N1CCC(O)CC1	ZINC000819138214	DE	On-Demand	Anodyne	KCNQ2	71	39
O=C(/C=C\[C@@H]1CCCO1)Nc1ccccc1N1CCC(O)CC1	ZINC000819138216	DE	On-Demand	Anodyne	KCNQ2	71	39
O=C(/C=C/[C@H]1CCCO1)Nc1ccccc1N1CCC(O)CC1	ZINC000819138217	DE	On-Demand	Anodyne	KCNQ2	71	39
O=C(/C=C\[C@H]1CCCO1)Nc1ccccc1N1CCC(O)CC1	ZINC000819138219	DE	On-Demand	Anodyne	KCNQ2	71	39
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819138231	FI	On-Demand	Anodyne	TACR1	15	43
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819138231	FI	On-Demand	Anodyne	L3MBTL3	44	33
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819138234	FI	On-Demand	Anodyne	TACR1	15	43
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819138234	FI	On-Demand	Anodyne	L3MBTL3	44	33
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccsc2)CC1	ZINC000819138245	DD	On-Demand	Anodyne	L3MBTL3	44	35
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccsc2)CC1	ZINC000819138247	DD	On-Demand	Anodyne	L3MBTL3	44	35
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccsc2)CC1	ZINC000819138248	DD	On-Demand	Anodyne	L3MBTL3	44	35
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccsc2)CC1	ZINC000819138249	DD	On-Demand	Anodyne	L3MBTL3	44	35
CCC1(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819138252	CG	On-Demand	Anodyne	ADRB1	33	46
CCC1(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819138252	CG	On-Demand	Anodyne	ADRB3	47	46
CCC1(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819138255	CG	On-Demand	Anodyne	ADRB1	33	46
CCC1(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819138255	CG	On-Demand	Anodyne	ADRB3	47	46
COCCc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138273	GG	On-Demand	Anodyne	ADRB2	46	56
COCCc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138273	GG	On-Demand	Anodyne	ADRB1	69	59
COCCc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138273	GG	On-Demand	Anodyne	ADRB3	49	45
COCCc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138273	GG	On-Demand	Anodyne	HRH3	18	40
COCCc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138275	GG	On-Demand	Anodyne	ADRB2	46	56
COCCc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138275	GG	On-Demand	Anodyne	ADRB1	69	59
COCCc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138275	GG	On-Demand	Anodyne	ADRB3	49	45
COCCc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138275	GG	On-Demand	Anodyne	HRH3	18	40
C[C@@H]1C[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)CCN1Cc1ccccc1	ZINC000819138279	FG	On-Demand	Bother	SIGMAR1	15	48
C[C@@H]1C[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCN1Cc1ccccc1	ZINC000819138282	FG	On-Demand	Bother	SIGMAR1	15	48
N#CCc1ccc(OC[C@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819138302	EE	On-Demand	Mild	ADRB1	31	40
N#CCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819138305	EE	On-Demand	Mild	ADRB1	31	40
N#CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819138308	EE	On-Demand	Mild	ADRB1	31	40
N#CCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819138312	EE	On-Demand	Mild	ADRB1	31	40
COc1cc(C)ccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819138326	FH	On-Demand	Mild	PAPA1_CARPA	45	46
COc1cc(C)ccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819138326	FH	On-Demand	Mild	CTSL	17	44
COc1cc(C)ccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819138328	FH	On-Demand	Mild	PAPA1_CARPA	45	46
COc1cc(C)ccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819138328	FH	On-Demand	Mild	CTSL	17	44
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCN1c1cccc(Cl)c1	ZINC000819138336	EF	On-Demand	Anodyne	ADRB3	62	43
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCN1c1cccc(Cl)c1	ZINC000819138336	EF	On-Demand	Anodyne	CYP3A4	47	36
CN1CCC(N(C)c2ccc(NC(=O)c3coc(=O)c4ccccc34)cc2)CC1	ZINC000819138371	GH	On-Demand	Anodyne	HTR1F	40	35
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138400	GF	On-Demand	Anodyne	ADRB1	26	41
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138400	GF	On-Demand	Anodyne	ADRB3	46	47
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138400	GF	On-Demand	Anodyne	CCR5	18	41
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138400	GF	On-Demand	Anodyne	CYP3A4	47	38
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138401	GF	On-Demand	Anodyne	ADRB1	26	41
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138401	GF	On-Demand	Anodyne	ADRB3	46	47
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138401	GF	On-Demand	Anodyne	CCR5	18	41
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138401	GF	On-Demand	Anodyne	CYP3A4	47	38
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138402	GF	On-Demand	Anodyne	ADRB1	26	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138402	GF	On-Demand	Anodyne	ADRB3	46	47
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138402	GF	On-Demand	Anodyne	CCR5	18	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138402	GF	On-Demand	Anodyne	CYP3A4	47	38
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138403	GF	On-Demand	Anodyne	ADRB1	26	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138403	GF	On-Demand	Anodyne	ADRB3	46	47
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138403	GF	On-Demand	Anodyne	CCR5	18	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2)cc1	ZINC000819138403	GF	On-Demand	Anodyne	CYP3A4	47	38
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@H]1CCN(c2cccc(Cl)c2)C1	ZINC000819138417	GF	On-Demand	Anodyne	DRD3	16	40
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1CCN(c2cccc(Cl)c2)C1	ZINC000819138418	GF	On-Demand	Anodyne	DRD3	16	40
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CCN(c2cccc(Cl)c2)C1	ZINC000819138419	GF	On-Demand	Anodyne	DRD3	16	40
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CCN(c2cccc(Cl)c2)C1	ZINC000819138420	GF	On-Demand	Anodyne	DRD3	16	40
COc1ccc(OC)c([C@H](O)CNCCn2c(O)nc3ccccc32)c1	ZINC000819138434	FE	On-Demand	Anodyne	ADRB2	25	44
Cc1cc(C)cc(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819138442	FH	On-Demand	Mild	PAPA1_CARPA	44	42
Cc1cc(C)cc(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819138442	FH	On-Demand	Mild	CTSK	15	42
Cc1cc(C)cc(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819138443	FH	On-Demand	Mild	PAPA1_CARPA	44	42
Cc1cc(C)cc(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819138443	FH	On-Demand	Mild	CTSK	15	42
O=C(/C=C\[C@H]1CCCO1)N1CCCN(c2ccccc2)CC1	ZINC000819138444	DE	On-Demand	Anodyne	ITGAL	54	32
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(c2ccccc2)CC1	ZINC000819138445	DE	On-Demand	Anodyne	ITGAL	54	32
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(c2ccccc2)CC1	ZINC000819138446	DE	On-Demand	Anodyne	ITGAL	54	32
O=C(/C=C/[C@H]1CCCO1)N1CCCN(c2ccccc2)CC1	ZINC000819138447	DE	On-Demand	Anodyne	ITGAL	54	32
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)cn1	ZINC000819138455	EF	On-Demand	Anodyne	CYP3A4	41	36
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)cn1	ZINC000819138456	EF	On-Demand	Anodyne	CYP3A4	41	36
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)cn1	ZINC000819138457	EF	On-Demand	Anodyne	CYP3A4	41	36
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)cn1	ZINC000819138458	EF	On-Demand	Anodyne	CYP3A4	41	36
O=C(NCc1cccc(NC(=O)C2CCCC2)c1)C(F)=C1CCC1	ZINC000819138465	EH	On-Demand	Anodyne	NMT1	29	40
CC(=O)Nc1cccc2c1CCCN2C(=O)C(F)=C1CCC1	ZINC000819138476	DG	On-Demand	Anodyne	KCNQ2	62	33
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1ccc(F)cc1F	ZINC000819138507	FI	On-Demand	Anodyne	ADRB3	15	42
O[C@H](CNCc1csc(CCc2ccccc2)n1)c1ccc(F)cc1F	ZINC000819138509	FI	On-Demand	Anodyne	ADRB3	15	42
CON(C)C(=O)CCN[C@@H]1CCN(c2cccc(Cl)c2)C1	ZINC000819138525	DD	On-Demand	Anodyne	NPY1R	23	46
CON(C)C(=O)CCN[C@H]1CCN(c2cccc(Cl)c2)C1	ZINC000819138527	DD	On-Demand	Anodyne	NPY1R	23	46
COc1cccc([S@](=O)CC(=O)N2CCCN(c3ccc(C)cc3)CC2)c1	ZINC000819138528	GF	On-Demand	Anodyne	DRD4	49	47
COc1cccc([S@](=O)CC(=O)N2CCCN(c3ccc(C)cc3)CC2)c1	ZINC000819138528	GF	On-Demand	Anodyne	CCKAR	29	44
COc1cccc([S@@](=O)CC(=O)N2CCCN(c3ccc(C)cc3)CC2)c1	ZINC000819138531	GF	On-Demand	Anodyne	DRD4	49	47
COc1cccc([S@@](=O)CC(=O)N2CCCN(c3ccc(C)cc3)CC2)c1	ZINC000819138531	GF	On-Demand	Anodyne	CCKAR	29	44
O=[N+]([O-])c1ccc([C@@H](O)CNCc2nccn2CCCc2ccccc2)cc1	ZINC000819138535	GG	On-Demand	Bother	SLC29A1	20	44
O=[N+]([O-])c1ccc([C@H](O)CNCc2nccn2CCCc2ccccc2)cc1	ZINC000819138537	GG	On-Demand	Bother	SLC29A1	20	44
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1ccccc1Cl	ZINC000819138583	FI	On-Demand	Anodyne	ADRB3	21	42
CC[C@@H](NC[C@H](O)c1ccc(Cl)cc1Cl)C(=O)N1CCOCC1	ZINC000819138585	FE	On-Demand	Anodyne	MC4R	61	40
CC[C@@H](NC[C@@H](O)c1ccc(Cl)cc1Cl)C(=O)N1CCOCC1	ZINC000819138590	FE	On-Demand	Anodyne	MC4R	61	40
C[S@](=O)c1ccc(CNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819138595	EF	On-Demand	Anodyne	LEF	60	39
C[S@@](=O)c1ccc(CNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819138596	EF	On-Demand	Anodyne	LEF	60	39
C[S@@](=O)c1ccc(CNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819138598	EF	On-Demand	Anodyne	LEF	60	39
C[S@](=O)c1ccc(CNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819138599	EF	On-Demand	Anodyne	LEF	60	39
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819138607	EI	On-Demand	Anodyne	MAOB	16	40
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819138607	EI	On-Demand	Anodyne	ERBB2	17	42
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819138609	EI	On-Demand	Anodyne	MAOB	16	40
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819138609	EI	On-Demand	Anodyne	ERBB2	17	42
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819138610	EI	On-Demand	Anodyne	MAOB	16	40
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819138610	EI	On-Demand	Anodyne	ERBB2	17	42
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819138611	EI	On-Demand	Anodyne	MAOB	16	40
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819138611	EI	On-Demand	Anodyne	ERBB2	17	42
O=C(Nc1cnn(Cc2ccccc2)c1)C(F)=C1CCC1	ZINC000819138615	CG	On-Demand	Anodyne	ITK	22	53
O=C(Nc1cnn(Cc2ccccc2)c1)C(F)=C1CCC1	ZINC000819138615	CG	On-Demand	Anodyne	PANC	59	44
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2[nH]ccc12	ZINC000819138616	FG	On-Demand	Anodyne	ADRB2	33	79
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2[nH]ccc12	ZINC000819138616	FG	On-Demand	Anodyne	ADRB1	34	79
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2[nH]ccc12	ZINC000819138616	FG	On-Demand	Anodyne	HTR1A	21	79
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2[nH]ccc12	ZINC000819138616	FG	On-Demand	Anodyne	SLC6A4	21	47
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2[nH]ccc12	ZINC000819138616	FG	On-Demand	Anodyne	ADRB3	26	58
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2[nH]ccc12	ZINC000819138617	FG	On-Demand	Anodyne	ADRB2	33	79
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2[nH]ccc12	ZINC000819138617	FG	On-Demand	Anodyne	ADRB1	34	79
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2[nH]ccc12	ZINC000819138617	FG	On-Demand	Anodyne	HTR1A	21	79
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2[nH]ccc12	ZINC000819138617	FG	On-Demand	Anodyne	SLC6A4	21	47
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2[nH]ccc12	ZINC000819138617	FG	On-Demand	Anodyne	ADRB3	26	58
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(C(=O)c2ccsc2)CC1	ZINC000819138622	GD	On-Demand	Anodyne	NPBWR1	89	34
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1cccc(Cl)c1	ZINC000819138635	FI	On-Demand	Anodyne	ADRB2	38	42
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1cccc(Cl)c1	ZINC000819138635	FI	On-Demand	Anodyne	ADRB1	50	48
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1cccc(Cl)c1	ZINC000819138635	FI	On-Demand	Anodyne	ADRB3	81	48
O[C@H](CNCc1csc(CCc2ccccc2)n1)c1cccc(Cl)c1	ZINC000819138636	FI	On-Demand	Anodyne	ADRB2	38	42
O[C@H](CNCc1csc(CCc2ccccc2)n1)c1cccc(Cl)c1	ZINC000819138636	FI	On-Demand	Anodyne	ADRB1	50	48
O[C@H](CNCc1csc(CCc2ccccc2)n1)c1cccc(Cl)c1	ZINC000819138636	FI	On-Demand	Anodyne	ADRB3	81	48
CC[C@@H](NC[C@H](O)c1cccnc1)C(=O)N1CCOCC1	ZINC000819138697	CC	On-Demand	Anodyne	ADRB1	21	46
CC[C@@H](NC[C@H](O)c1cccnc1)C(=O)N1CCOCC1	ZINC000819138697	CC	On-Demand	Anodyne	ADRB3	79	46
CC[C@@H](NC[C@H](O)c1cccnc1)C(=O)N1CCOCC1	ZINC000819138697	CC	On-Demand	Anodyne	CASR	31	41
CC[C@@H](NC[C@@H](O)c1cccnc1)C(=O)N1CCOCC1	ZINC000819138699	CC	On-Demand	Anodyne	ADRB1	21	46
CC[C@@H](NC[C@@H](O)c1cccnc1)C(=O)N1CCOCC1	ZINC000819138699	CC	On-Demand	Anodyne	ADRB3	79	46
CC[C@@H](NC[C@@H](O)c1cccnc1)C(=O)N1CCOCC1	ZINC000819138699	CC	On-Demand	Anodyne	CASR	31	41
Cc1ccc(N2CCCN(C(=O)Cc3ccc(-n4cnnc4)cc3)CC2)cc1	ZINC000819138729	GF	On-Demand	Anodyne	KCNJ1	64	41
CO[C@@H](C)c1nc(CNC[C@H](O)c2cccc(F)c2)cs1	ZINC000819138734	DF	On-Demand	Anodyne	ADRB3	22	42
CO[C@@H](C)c1nc(CNC[C@@H](O)c2cccc(F)c2)cs1	ZINC000819138735	DF	On-Demand	Anodyne	ADRB3	22	42
CN(C)c1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1Cl	ZINC000819138767	GH	On-Demand	Mild	PAPA1_CARPA	40	42
CN(C)c1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1Cl	ZINC000819138769	GH	On-Demand	Mild	PAPA1_CARPA	40	42
Cc1ccc(N2CCCN(C(=O)c3cc4c(cn3)OCCO4)CC2)cc1	ZINC000819138800	FF	On-Demand	Anodyne	CCKAR	46	51
CC[C@@H](CNC[C@@H](O)C1CC1)Oc1cccc(C(F)(F)F)c1	ZINC000819138801	DG	On-Demand	Anodyne	PDS	53	44
CC[C@@H](CNC[C@H](O)C1CC1)Oc1cccc(C(F)(F)F)c1	ZINC000819138806	DG	On-Demand	Anodyne	PDS	53	44
O[C@H](CN[C@@H]1CCCn2ncnc21)c1cccc(Cl)c1	ZINC000819138809	CE	On-Demand	Anodyne	ADRB1	28	41
O[C@H](CN[C@@H]1CCCn2ncnc21)c1cccc(Cl)c1	ZINC000819138809	CE	On-Demand	Anodyne	ADRB3	45	42
O[C@H](CN[C@@H]1CCCn2ncnc21)c1cccc(Cl)c1	ZINC000819138809	CE	On-Demand	Anodyne	CYP3A4	48	36
O[C@@H](CN[C@@H]1CCCn2ncnc21)c1cccc(Cl)c1	ZINC000819138811	CE	On-Demand	Anodyne	ADRB1	28	41
O[C@@H](CN[C@@H]1CCCn2ncnc21)c1cccc(Cl)c1	ZINC000819138811	CE	On-Demand	Anodyne	ADRB3	45	42
O[C@@H](CN[C@@H]1CCCn2ncnc21)c1cccc(Cl)c1	ZINC000819138811	CE	On-Demand	Anodyne	CYP3A4	48	36
O[C@H](CN[C@H]1CCCn2ncnc21)c1cccc(Cl)c1	ZINC000819138813	CE	On-Demand	Anodyne	ADRB1	28	41
O[C@H](CN[C@H]1CCCn2ncnc21)c1cccc(Cl)c1	ZINC000819138813	CE	On-Demand	Anodyne	ADRB3	45	42
O[C@H](CN[C@H]1CCCn2ncnc21)c1cccc(Cl)c1	ZINC000819138813	CE	On-Demand	Anodyne	CYP3A4	48	36
O[C@@H](CN[C@H]1CCCn2ncnc21)c1cccc(Cl)c1	ZINC000819138815	CE	On-Demand	Anodyne	ADRB1	28	41
O[C@@H](CN[C@H]1CCCn2ncnc21)c1cccc(Cl)c1	ZINC000819138815	CE	On-Demand	Anodyne	ADRB3	45	42
O[C@@H](CN[C@H]1CCCn2ncnc21)c1cccc(Cl)c1	ZINC000819138815	CE	On-Demand	Anodyne	CYP3A4	48	36
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138821	DF	On-Demand	Anodyne	ADRB1	45	42
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138821	DF	On-Demand	Anodyne	ADRB3	98	52
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138821	DF	On-Demand	Anodyne	IGF1R	27	40
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138821	DF	On-Demand	Anodyne	C3AR1	35	40
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138821	DF	On-Demand	Anodyne	CYP3A4	49	40
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138822	DF	On-Demand	Anodyne	ADRB1	45	42
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138822	DF	On-Demand	Anodyne	ADRB3	98	52
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138822	DF	On-Demand	Anodyne	IGF1R	27	40
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138822	DF	On-Demand	Anodyne	C3AR1	35	40
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138822	DF	On-Demand	Anodyne	CYP3A4	49	40
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138823	DF	On-Demand	Anodyne	ADRB1	45	42
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138823	DF	On-Demand	Anodyne	ADRB3	98	52
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138823	DF	On-Demand	Anodyne	IGF1R	27	40
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138823	DF	On-Demand	Anodyne	C3AR1	35	40
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138823	DF	On-Demand	Anodyne	CYP3A4	49	40
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138824	DF	On-Demand	Anodyne	ADRB1	45	42
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138824	DF	On-Demand	Anodyne	ADRB3	98	52
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138824	DF	On-Demand	Anodyne	IGF1R	27	40
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138824	DF	On-Demand	Anodyne	C3AR1	35	40
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819138824	DF	On-Demand	Anodyne	CYP3A4	49	40
CSc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138825	GH	On-Demand	Anodyne	ADRB2	32	44
CSc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138825	GH	On-Demand	Anodyne	ADRB1	41	47
CSc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138825	GH	On-Demand	Anodyne	ADRB3	29	45
CO[C@@H](C)c1nc(CNC[C@H](O)c2cccnc2)cs1	ZINC000819138826	CE	On-Demand	Anodyne	ADRB2	23	47
CO[C@@H](C)c1nc(CNC[C@H](O)c2cccnc2)cs1	ZINC000819138826	CE	On-Demand	Anodyne	ADRB1	26	47
CO[C@@H](C)c1nc(CNC[C@H](O)c2cccnc2)cs1	ZINC000819138826	CE	On-Demand	Anodyne	ADRB3	93	47
CO[C@@H](C)c1nc(CNC[C@@H](O)c2cccnc2)cs1	ZINC000819138827	CE	On-Demand	Anodyne	ADRB2	23	47
CO[C@@H](C)c1nc(CNC[C@@H](O)c2cccnc2)cs1	ZINC000819138827	CE	On-Demand	Anodyne	ADRB1	26	47
CO[C@@H](C)c1nc(CNC[C@@H](O)c2cccnc2)cs1	ZINC000819138827	CE	On-Demand	Anodyne	ADRB3	93	47
CSc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138828	GH	On-Demand	Anodyne	ADRB2	32	44
CSc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138828	GH	On-Demand	Anodyne	ADRB1	41	47
CSc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138828	GH	On-Demand	Anodyne	ADRB3	29	45
CC(=O)Nc1cccc(CC(=O)N(Cc2ccc(N(C)C)cc2)C(C)C)c1	ZINC000819138829	FH	On-Demand	Clean	NR1H4	17	40
CN(C)c1ccc(NC(=O)c2cc3c(cn2)OCCO3)cc1Cl	ZINC000819138836	EF	On-Demand	Anodyne	GRM4	54	42
CN(C)c1ccc(NC(=O)c2cc3c(cn2)OCCO3)cc1Cl	ZINC000819138836	EF	On-Demand	Anodyne	TYK2	41	33
CN(C)c1ccc(NC(=O)c2cc3c(cn2)OCCO3)cc1Cl	ZINC000819138836	EF	On-Demand	Anodyne	SHH	17	42
C[C@@H]1C[C@H](NC[C@H](O)c2ccc(F)cc2Cl)CCN1Cc1ccccc1	ZINC000819138846	GI	On-Demand	Anodyne	SIGMAR1	21	46
C[C@@H]1C[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)CCN1Cc1ccccc1	ZINC000819138847	GI	On-Demand	Anodyne	SIGMAR1	21	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cnn(Cc2ccccc2)c1	ZINC000819138850	FF	On-Demand	Anodyne	ITK	18	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cnn(Cc2ccccc2)c1	ZINC000819138850	FF	On-Demand	Anodyne	PANC	67	49
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N(C)C3CCN(C)CC3)cc2)c1	ZINC000819138855	GG	On-Demand	Anodyne	HTR1D	20	40
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N(C)C3CCN(C)CC3)cc2)c1	ZINC000819138855	GG	On-Demand	Anodyne	HTR1F	32	40
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N(C)C3CCN(C)CC3)cc2)c1	ZINC000819138855	GG	On-Demand	Anodyne	MCHR1	40	42
O=C(CCNC1CCC(N2CCCCC2)CC1)Nc1cccc(Cl)c1	ZINC000819138860	FI	On-Demand	Anodyne	NPY2R	16	40
O=C(CCNC1CCC(N2CCCCC2)CC1)Nc1cccc(Cl)c1	ZINC000819138860	FI	On-Demand	Anodyne	MCHR1	32	41
O=C(CCNC1CCC(N2CCCCC2)CC1)Nc1cccc(Cl)c1	ZINC000819138860	FI	On-Demand	Anodyne	L3MBTL3	66	37
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(C(F)(F)F)c1	ZINC000819138867	FH	On-Demand	Anodyne	ADRB2	19	41
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(C(F)(F)F)c1	ZINC000819138867	FH	On-Demand	Anodyne	ADRB1	26	43
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(C(F)(F)F)c1	ZINC000819138867	FH	On-Demand	Anodyne	ADRB3	85	43
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(C(F)(F)F)c1	ZINC000819138867	FH	On-Demand	Anodyne	PDS	50	42
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(C(F)(F)F)c1	ZINC000819138869	FH	On-Demand	Anodyne	ADRB2	19	41
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(C(F)(F)F)c1	ZINC000819138869	FH	On-Demand	Anodyne	ADRB1	26	43
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(C(F)(F)F)c1	ZINC000819138869	FH	On-Demand	Anodyne	ADRB3	85	43
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(C(F)(F)F)c1	ZINC000819138869	FH	On-Demand	Anodyne	PDS	50	42
O=C(CCNC1CCC(N2CCCCC2)CC1)Nc1ccc(Cl)cc1	ZINC000819138881	FI	On-Demand	Anodyne	EPHX2	19	41
O=C(CCNC1CCC(N2CCCCC2)CC1)Nc1ccc(Cl)cc1	ZINC000819138881	FI	On-Demand	Anodyne	MCHR1	19	41
O=C(CCNC1CCC(N2CCCCC2)CC1)Nc1ccc(Cl)cc1	ZINC000819138881	FI	On-Demand	Anodyne	L3MBTL3	77	37
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1cccc(Cl)c1	ZINC000819138888	EE	On-Demand	Anodyne	ADRB1	39	40
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1cccc(Cl)c1	ZINC000819138888	EE	On-Demand	Anodyne	ADRB3	85	42
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1cccc(Cl)c1	ZINC000819138888	EE	On-Demand	Anodyne	CYP3A4	46	35
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1cccc(Cl)c1	ZINC000819138889	EE	On-Demand	Anodyne	ADRB1	39	40
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1cccc(Cl)c1	ZINC000819138889	EE	On-Demand	Anodyne	ADRB3	85	42
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1cccc(Cl)c1	ZINC000819138889	EE	On-Demand	Anodyne	CYP3A4	46	35
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1cccc(Cl)c1	ZINC000819138890	EE	On-Demand	Anodyne	ADRB1	39	40
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1cccc(Cl)c1	ZINC000819138890	EE	On-Demand	Anodyne	ADRB3	85	42
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1cccc(Cl)c1	ZINC000819138890	EE	On-Demand	Anodyne	CYP3A4	46	35
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1cccc(Cl)c1	ZINC000819138891	EE	On-Demand	Anodyne	ADRB1	39	40
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1cccc(Cl)c1	ZINC000819138891	EE	On-Demand	Anodyne	ADRB3	85	42
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1cccc(Cl)c1	ZINC000819138891	EE	On-Demand	Anodyne	CYP3A4	46	35
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)C1CC1	ZINC000819138894	CE	On-Demand	Anodyne	ADRB3	15	43
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)C1CC1	ZINC000819138896	CE	On-Demand	Anodyne	ADRB3	15	43
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)C1CC1	ZINC000819138897	CE	On-Demand	Anodyne	ADRB3	15	43
O=C(Nc1ccccc1N1CCC(O)CC1)C(F)=C1CCC1	ZINC000819138911	DF	On-Demand	Anodyne	KCNQ2	79	45
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819138913	FH	On-Demand	Anodyne	ADRB1	29	41
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819138913	FH	On-Demand	Anodyne	ADRB3	50	43
O[C@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819138913	FH	On-Demand	Anodyne	CYP3A4	48	39
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819138914	FH	On-Demand	Anodyne	ADRB1	29	41
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819138914	FH	On-Demand	Anodyne	ADRB3	50	43
O[C@@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819138914	FH	On-Demand	Anodyne	CYP3A4	48	39
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819138915	FH	On-Demand	Anodyne	ADRB1	29	41
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819138915	FH	On-Demand	Anodyne	ADRB3	50	43
O[C@@H](CN[C@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819138915	FH	On-Demand	Anodyne	CYP3A4	48	39
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819138916	FH	On-Demand	Anodyne	ADRB1	29	41
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819138916	FH	On-Demand	Anodyne	ADRB3	50	43
O[C@H](CN[C@@H]1CCN(c2cccc(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819138916	FH	On-Demand	Anodyne	CYP3A4	48	39
O=S(=O)(CCNC1CCC(N2CCCCC2)CC1)c1ccc(F)cc1	ZINC000819138921	FF	On-Demand	Anodyne	L3MBTL3	45	34
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCN1c1cccc(Cl)c1	ZINC000819138922	EF	On-Demand	Anodyne	ADRB3	62	43
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCN1c1cccc(Cl)c1	ZINC000819138922	EF	On-Demand	Anodyne	CYP3A4	47	36
C=CCCn1cc(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)nn1	ZINC000819138925	FE	On-Demand	Mild	DRD2	17	45
C=CCCn1cc(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)nn1	ZINC000819138925	FE	On-Demand	Mild	DRD4	43	33
C=CCCn1cc(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)nn1	ZINC000819138925	FE	On-Demand	Mild	ACHE	20	46
C=CCCn1cc(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)nn1	ZINC000819138925	FE	On-Demand	Mild	HRH2	34	41
C=CCCn1cc(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)nn1	ZINC000819138925	FE	On-Demand	Mild	DRD3	21	43
C=CCCn1cc(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)nn1	ZINC000819138925	FE	On-Demand	Mild	KCNH2	16	51
C=CCCn1cc(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)nn1	ZINC000819138925	FE	On-Demand	Mild	HTR4	23	42
C=CCCn1cc(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)nn1	ZINC000819138925	FE	On-Demand	Mild	SIGMAR1	25	55
C=CCCn1cc(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)nn1	ZINC000819138925	FE	On-Demand	Mild	SSTR5	68	39
C=CCCn1cc(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)nn1	ZINC000819138925	FE	On-Demand	Mild	CCR3	35	44
C=CCCn1cc(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)nn1	ZINC000819138925	FE	On-Demand	Mild	PDE4B	62	36
C=CCCn1cc(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)nn1	ZINC000819138925	FE	On-Demand	Mild	FAAH	31	41
C=CCCn1cc(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)nn1	ZINC000819138925	FE	On-Demand	Mild	PDK1	51	40
C=CCCn1cc(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)nn1	ZINC000819138925	FE	On-Demand	Mild	MCHR1	52	53
C=CCCn1cc(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)nn1	ZINC000819138925	FE	On-Demand	Mild	CCR8	26	51
C=CCCn1cc(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)nn1	ZINC000819138925	FE	On-Demand	Mild	HPGDS	31	43
CS(=O)(=O)c1ccc([C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138932	GF	On-Demand	Anodyne	CHRM2	26	41
CS(=O)(=O)c1ccc([C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138932	GF	On-Demand	Anodyne	ADRA1D	29	42
CS(=O)(=O)c1ccc([C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138932	GF	On-Demand	Anodyne	ADRA1A	21	42
CS(=O)(=O)c1ccc([C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138932	GF	On-Demand	Anodyne	ADRA1B	23	42
CS(=O)(=O)c1ccc([C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138932	GF	On-Demand	Anodyne	ADRB3	25	41
CS(=O)(=O)c1ccc([C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138932	GF	On-Demand	Anodyne	L3MBTL3	57	36
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138935	GF	On-Demand	Anodyne	CHRM2	26	41
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138935	GF	On-Demand	Anodyne	ADRA1D	29	42
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138935	GF	On-Demand	Anodyne	ADRA1A	21	42
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138935	GF	On-Demand	Anodyne	ADRA1B	23	42
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138935	GF	On-Demand	Anodyne	ADRB3	25	41
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819138935	GF	On-Demand	Anodyne	L3MBTL3	57	36
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1cccc(Cl)c1	ZINC000819138942	FG	On-Demand	Anodyne	ADRB1	35	42
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1cccc(Cl)c1	ZINC000819138942	FG	On-Demand	Anodyne	ADRB3	52	45
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1cccc(Cl)c1	ZINC000819138942	FG	On-Demand	Anodyne	IGF1R	30	40
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1cccc(Cl)c1	ZINC000819138942	FG	On-Demand	Anodyne	CYP3A4	52	40
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819138943	GE	On-Demand	Anodyne	CACNA1I	71	52
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1cccc(Cl)c1	ZINC000819138944	FG	On-Demand	Anodyne	ADRB1	35	42
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1cccc(Cl)c1	ZINC000819138944	FG	On-Demand	Anodyne	ADRB3	52	45
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1cccc(Cl)c1	ZINC000819138944	FG	On-Demand	Anodyne	IGF1R	30	40
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1cccc(Cl)c1	ZINC000819138944	FG	On-Demand	Anodyne	CYP3A4	52	40
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819138945	GE	On-Demand	Anodyne	CACNA1I	71	52
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1cccc(Cl)c1	ZINC000819138946	FG	On-Demand	Anodyne	ADRB1	35	42
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1cccc(Cl)c1	ZINC000819138946	FG	On-Demand	Anodyne	ADRB3	52	45
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1cccc(Cl)c1	ZINC000819138946	FG	On-Demand	Anodyne	IGF1R	30	40
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1cccc(Cl)c1	ZINC000819138946	FG	On-Demand	Anodyne	CYP3A4	52	40
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1cccc(Cl)c1	ZINC000819138947	FG	On-Demand	Anodyne	ADRB1	35	42
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1cccc(Cl)c1	ZINC000819138947	FG	On-Demand	Anodyne	ADRB3	52	45
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1cccc(Cl)c1	ZINC000819138947	FG	On-Demand	Anodyne	IGF1R	30	40
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1cccc(Cl)c1	ZINC000819138947	FG	On-Demand	Anodyne	CYP3A4	52	40
COc1ccc(N2CCCN(C(=O)c3cc(Br)oc3C)CC2)cc1	ZINC000819138953	GH	On-Demand	Clean	CCKAR	29	41
O[C@H](CNC1CCC(N2CCCCC2)CC1)Cc1ccccc1	ZINC000819138960	DF	On-Demand	Anodyne	L3MBTL3	75	37
O[C@@H](CNC1CCC(N2CCCCC2)CC1)Cc1ccccc1	ZINC000819138963	DF	On-Demand	Anodyne	L3MBTL3	75	37
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1cccc(C(F)(F)F)c1	ZINC000819139009	FI	On-Demand	Anodyne	TACR1	22	47
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1cccc(C(F)(F)F)c1	ZINC000819139009	FI	On-Demand	Anodyne	CCR2	50	40
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1cccc(C(F)(F)F)c1	ZINC000819139013	FI	On-Demand	Anodyne	TACR1	22	47
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1cccc(C(F)(F)F)c1	ZINC000819139013	FI	On-Demand	Anodyne	CCR2	50	40
O[C@@H](CNCc1nccn1CCCc1ccccc1)c1cccc(Cl)c1	ZINC000819139029	FH	On-Demand	Anodyne	ADRB1	45	44
O[C@@H](CNCc1nccn1CCCc1ccccc1)c1cccc(Cl)c1	ZINC000819139029	FH	On-Demand	Anodyne	ADRB3	59	44
O[C@H](CNCc1nccn1CCCc1ccccc1)c1cccc(Cl)c1	ZINC000819139032	FH	On-Demand	Anodyne	ADRB1	45	44
O[C@H](CNCc1nccn1CCCc1ccccc1)c1cccc(Cl)c1	ZINC000819139032	FH	On-Demand	Anodyne	ADRB3	59	44
Cc1cc(F)ccc1[C@@H](O)CNCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000819139054	GE	On-Demand	Anodyne	CACNA1I	58	48
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc(Br)c1	ZINC000819139065	FG	On-Demand	Anodyne	ADRB2	17	41
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc(Br)c1	ZINC000819139065	FG	On-Demand	Anodyne	ADRB1	20	41
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819139068	GF	On-Demand	Anodyne	CACNA1I	77	52
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc(Br)c1	ZINC000819139071	FG	On-Demand	Anodyne	ADRB2	17	41
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc(Br)c1	ZINC000819139071	FG	On-Demand	Anodyne	ADRB1	20	41
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819139075	GF	On-Demand	Anodyne	CACNA1I	77	52
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc(Br)c1	ZINC000819139077	FG	On-Demand	Anodyne	ADRB2	17	41
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc(Br)c1	ZINC000819139077	FG	On-Demand	Anodyne	ADRB1	20	41
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc(Br)c1	ZINC000819139083	FG	On-Demand	Anodyne	ADRB2	17	41
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc(Br)c1	ZINC000819139083	FG	On-Demand	Anodyne	ADRB1	20	41
CC(C)(C)NC(=O)CN1CCC(CNCC2(O)CCCCC2)CC1	ZINC000819139094	ED	On-Demand	Anodyne	CACNA1I	46	49
CC[C@@H](NC[C@H](O)c1ccc(OC(F)(F)F)cc1)C(=O)N1CCOCC1	ZINC000819139109	GD	On-Demand	Anodyne	CTSS	22	47
CC[C@@H](NC[C@H](O)c1ccc(OC(F)(F)F)cc1)C(=O)N1CCOCC1	ZINC000819139109	GD	On-Demand	Anodyne	EPHX2	41	44
CC[C@@H](NC[C@@H](O)c1ccc(OC(F)(F)F)cc1)C(=O)N1CCOCC1	ZINC000819139111	GD	On-Demand	Anodyne	CTSS	22	47
CC[C@@H](NC[C@@H](O)c1ccc(OC(F)(F)F)cc1)C(=O)N1CCOCC1	ZINC000819139111	GD	On-Demand	Anodyne	EPHX2	41	44
COc1ccc(N2CCCN(C(=O)Cc3nsc4ccccc34)CC2)cc1	ZINC000819139115	GH	On-Demand	Clean	HTR1A	27	46
COc1ccc(N2CCCN(C(=O)Cc3nsc4ccccc34)CC2)cc1	ZINC000819139115	GH	On-Demand	Clean	DRD2	23	46
CCOc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139136	GG	On-Demand	Anodyne	ADRB2	39	46
CCOc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139136	GG	On-Demand	Anodyne	ADRB1	47	49
CCOc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139136	GG	On-Demand	Anodyne	ADRB3	32	47
CCOc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139137	GG	On-Demand	Anodyne	ADRB2	39	46
CCOc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139137	GG	On-Demand	Anodyne	ADRB1	47	49
CCOc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139137	GG	On-Demand	Anodyne	ADRB3	32	47
COc1ccc(N2CCCN(C(=O)c3coc(=O)c4ccccc34)CC2)cc1	ZINC000819139143	GG	On-Demand	Clean	CCKAR	31	41
O[C@@H](CNCc1nccn1CCc1ccccc1)c1cccnc1	ZINC000819139156	DE	On-Demand	Anodyne	ADRB2	33	50
O[C@@H](CNCc1nccn1CCc1ccccc1)c1cccnc1	ZINC000819139156	DE	On-Demand	Anodyne	ADRB1	40	44
O[C@@H](CNCc1nccn1CCc1ccccc1)c1cccnc1	ZINC000819139156	DE	On-Demand	Anodyne	ADRB3	116	47
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2=O)cc1	ZINC000819139163	FF	On-Demand	Mild	CYP3A4	42	33
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(c3cccc(Cl)c3)C2=O)cc1	ZINC000819139165	FF	On-Demand	Mild	CYP3A4	42	33
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2=O)cc1	ZINC000819139168	FF	On-Demand	Mild	CYP3A4	42	33
N#Cc1ccc([C@H](O)CN[C@H]2CCN(c3cccc(Cl)c3)C2=O)cc1	ZINC000819139170	FF	On-Demand	Mild	CYP3A4	42	33
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1cccc(Br)c1	ZINC000819139183	GH	On-Demand	Anodyne	L3MBTL3	51	35
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1cccc(Br)c1	ZINC000819139184	GH	On-Demand	Anodyne	L3MBTL3	51	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1c1cccc(F)c1)C2	ZINC000819139209	FG	On-Demand	Anodyne	CCR5	49	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H]1c1cccc(F)c1)C2	ZINC000819139210	FG	On-Demand	Anodyne	CCR5	49	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1c1cccc(F)c1)C2	ZINC000819139211	FG	On-Demand	Anodyne	CCR5	49	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H]1c1cccc(F)c1)C2	ZINC000819139212	FG	On-Demand	Anodyne	CCR5	49	31
COC(=O)Cn1cc(NC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cn1	ZINC000819139250	FC	On-Demand	Anodyne	PANC	50	32
COC(=O)Cn1cc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cn1	ZINC000819139251	FC	On-Demand	Anodyne	PANC	50	32
CO[C@@H](C)c1nc(CNC[C@H](O)c2cccc(Cl)c2)cs1	ZINC000819139252	EG	On-Demand	Anodyne	ADRB1	36	43
CO[C@@H](C)c1nc(CNC[C@H](O)c2cccc(Cl)c2)cs1	ZINC000819139252	EG	On-Demand	Anodyne	ADRB3	54	43
CO[C@@H](C)c1nc(CNC[C@@H](O)c2cccc(Cl)c2)cs1	ZINC000819139253	EG	On-Demand	Anodyne	ADRB1	36	43
CO[C@@H](C)c1nc(CNC[C@@H](O)c2cccc(Cl)c2)cs1	ZINC000819139253	EG	On-Demand	Anodyne	ADRB3	54	43
CO[C@@H](C)c1nc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cs1	ZINC000819139260	EF	On-Demand	Bother	CACNA1D	46	34
CO[C@@H](C)c1nc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cs1	ZINC000819139261	EF	On-Demand	Bother	CACNA1D	46	34
C[C@@H]1CCCC[C@@H]1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1	ZINC000819139273	FF	On-Demand	Clean	TMPRSS11D	45	33
C[C@@H]1CCCC[C@H]1C(=O)NCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1	ZINC000819139274	FF	On-Demand	Clean	TMPRSS11D	45	33
C[C@@H]1CCCC[C@@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	ZINC000819139275	FF	On-Demand	Clean	TMPRSS11D	45	33
C[C@@H]1CCCC[C@H]1C(=O)NCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1	ZINC000819139276	FF	On-Demand	Clean	TMPRSS11D	45	33
O[C@@H](CNCc1nccn1CCCc1ccccc1)c1ccccc1	ZINC000819139291	EG	On-Demand	Anodyne	ADRB2	17	41
O[C@H](CNCc1nccn1CCCc1ccccc1)c1ccccc1	ZINC000819139292	EG	On-Demand	Anodyne	ADRB2	17	41
CC[C@@H](NC[C@@H](O)c1cc2ccccc2o1)C(=O)N1CCOCC1	ZINC000819139317	ED	On-Demand	Anodyne	TRY2_BOVIN	59	39
CC(=O)Nc1cccc(CC(=O)N(C)c2ccc(C)cc2C)c1	ZINC000819139330	DG	On-Demand	Anodyne	KCNK3	60	36
CC(=O)Nc1cccc(CC(=O)N(C)c2ccc(C)cc2C)c1	ZINC000819139330	DG	On-Demand	Anodyne	KCNK9	46	36
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819139331	FE	On-Demand	Anodyne	ADRB1	27	41
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819139331	FE	On-Demand	Anodyne	ADRB3	43	41
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819139331	FE	On-Demand	Anodyne	CACNA1I	62	48
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819139332	FE	On-Demand	Anodyne	ADRB1	27	41
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819139332	FE	On-Demand	Anodyne	ADRB3	43	41
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819139332	FE	On-Demand	Anodyne	CACNA1I	62	48
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H](c1cccnc1)C(C)C	ZINC000819139337	DH	On-Demand	Anodyne	ADRB3	50	39
Cc1cc(F)ccc1[C@@H](O)CNC[C@H](c1cccnc1)C(C)C	ZINC000819139338	DH	On-Demand	Anodyne	ADRB3	50	39
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1ccc(Br)cc1	ZINC000819139341	GH	On-Demand	Anodyne	L3MBTL3	65	35
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1ccc(Br)cc1	ZINC000819139342	GH	On-Demand	Anodyne	L3MBTL3	65	35
N#Cc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139372	FF	On-Demand	Mild	ADRB2	29	47
N#Cc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139372	FF	On-Demand	Mild	ADRB1	39	50
N#Cc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139372	FF	On-Demand	Mild	ADRB3	25	43
N#Cc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139373	FF	On-Demand	Mild	ADRB2	29	47
N#Cc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139373	FF	On-Demand	Mild	ADRB1	39	50
N#Cc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139373	FF	On-Demand	Mild	ADRB3	25	43
COc1cccc([S@@](=O)CC(=O)NCC2CCCCCCC2)c1	ZINC000819139375	EG	On-Demand	Anodyne	DRD4	42	32
COc1cccc([S@@](=O)CC(=O)NCC2CCCCCCC2)c1	ZINC000819139375	EG	On-Demand	Anodyne	MTNR1A	54	40
COc1cccc([S@@](=O)CC(=O)NCC2CCCCCCC2)c1	ZINC000819139375	EG	On-Demand	Anodyne	MTNR1B	49	40
O[C@@H](CNCc1nccn1CCc1ccccc1)c1cccc(F)c1	ZINC000819139386	EG	On-Demand	Anodyne	ADRB1	27	41
O[C@@H](CNCc1nccn1CCc1ccccc1)c1cccc(F)c1	ZINC000819139386	EG	On-Demand	Anodyne	ADRB3	58	41
O[C@H](CNCc1nccn1CCc1ccccc1)c1cccc(F)c1	ZINC000819139387	EG	On-Demand	Anodyne	ADRB1	27	41
O[C@H](CNCc1nccn1CCc1ccccc1)c1cccc(F)c1	ZINC000819139387	EG	On-Demand	Anodyne	ADRB3	58	41
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819139394	ED	On-Demand	Anodyne	ADRB1	32	43
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819139394	ED	On-Demand	Anodyne	ADRB3	101	43
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819139394	ED	On-Demand	Anodyne	CACNA1I	45	46
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819139395	ED	On-Demand	Anodyne	ADRB1	32	43
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819139395	ED	On-Demand	Anodyne	ADRB3	101	43
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819139395	ED	On-Demand	Anodyne	CACNA1I	45	46
O=C(CCNC1CCC(N2CCCCC2)CC1)Nc1cccc(F)c1	ZINC000819139400	EH	On-Demand	Anodyne	MCHR1	19	40
O=C(CCNC1CCC(N2CCCCC2)CC1)Nc1cccc(F)c1	ZINC000819139400	EH	On-Demand	Anodyne	L3MBTL3	66	37
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2ccccc2)CC1	ZINC000819139401	ED	On-Demand	Anodyne	SLC6A3	23	44
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2ccccc2)CC1	ZINC000819139401	ED	On-Demand	Anodyne	GRIN2B	31	41
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2ccccc2)CC1	ZINC000819139401	ED	On-Demand	Anodyne	ADRB3	55	38
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2ccccc2)CC1	ZINC000819139401	ED	On-Demand	Anodyne	CACNA1I	62	51
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2ccccc2)CC1	ZINC000819139402	ED	On-Demand	Anodyne	SLC6A3	23	44
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2ccccc2)CC1	ZINC000819139402	ED	On-Demand	Anodyne	GRIN2B	31	41
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2ccccc2)CC1	ZINC000819139402	ED	On-Demand	Anodyne	ADRB3	55	38
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2ccccc2)CC1	ZINC000819139402	ED	On-Demand	Anodyne	CACNA1I	62	51
COc1ccc(N2CCCN(C(=O)[C@@H]3CCCO[C@@H]3C(C)C)CC2)cc1	ZINC000819139417	FG	On-Demand	Clean	NPBWR1	79	34
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1ccc(Cl)cc1	ZINC000819139424	FI	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1ccc(Cl)cc1	ZINC000819139424	FI	On-Demand	Anodyne	ADRB3	44	48
O=C1[C@@H](NC[C@@H](O)c2cccc(F)c2)CCN1c1cccc(Cl)c1	ZINC000819139445	EF	On-Demand	Anodyne	ADRB3	44	40
O=C1[C@@H](NC[C@@H](O)c2cccc(F)c2)CCN1c1cccc(Cl)c1	ZINC000819139445	EF	On-Demand	Anodyne	CYP3A4	47	36
O=C1[C@H](NC[C@@H](O)c2cccc(F)c2)CCN1c1cccc(Cl)c1	ZINC000819139446	EF	On-Demand	Anodyne	ADRB3	44	40
O=C1[C@H](NC[C@@H](O)c2cccc(F)c2)CCN1c1cccc(Cl)c1	ZINC000819139446	EF	On-Demand	Anodyne	CYP3A4	47	36
O=C1[C@@H](NC[C@H](O)c2cccc(F)c2)CCN1c1cccc(Cl)c1	ZINC000819139447	EF	On-Demand	Anodyne	ADRB3	44	40
O=C1[C@@H](NC[C@H](O)c2cccc(F)c2)CCN1c1cccc(Cl)c1	ZINC000819139447	EF	On-Demand	Anodyne	CYP3A4	47	36
O=C1[C@H](NC[C@H](O)c2cccc(F)c2)CCN1c1cccc(Cl)c1	ZINC000819139448	EF	On-Demand	Anodyne	ADRB3	44	40
O=C1[C@H](NC[C@H](O)c2cccc(F)c2)CCN1c1cccc(Cl)c1	ZINC000819139448	EF	On-Demand	Anodyne	CYP3A4	47	36
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccc2ccccc2c1	ZINC000819139473	EH	On-Demand	Anodyne	ADRB2	26	50
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccc2ccccc2c1	ZINC000819139474	EH	On-Demand	Anodyne	ADRB2	26	50
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccc2ccccc2c1	ZINC000819139475	EH	On-Demand	Anodyne	ADRB2	26	50
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccc2ccccc2c1	ZINC000819139476	EH	On-Demand	Anodyne	ADRB2	26	50
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819139486	GG	On-Demand	Anodyne	DRD4	44	36
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819139486	GG	On-Demand	Anodyne	KCNQ2	58	41
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819139486	GG	On-Demand	Anodyne	NPY2R	98	49
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819139486	GG	On-Demand	Anodyne	GALR2	39	40
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819139486	GG	On-Demand	Anodyne	MCHR1	15	42
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819139486	GG	On-Demand	Anodyne	TAAR1	48	48
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1ccc(F)c(F)c1	ZINC000819139487	FI	On-Demand	Anodyne	ADRB2	21	42
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1ccc(F)c(F)c1	ZINC000819139487	FI	On-Demand	Anodyne	ADRB3	40	45
O[C@H](CNCc1csc(CCc2ccccc2)n1)c1ccc(F)c(F)c1	ZINC000819139491	FI	On-Demand	Anodyne	ADRB2	21	42
O[C@H](CNCc1csc(CCc2ccccc2)n1)c1ccc(F)c(F)c1	ZINC000819139491	FI	On-Demand	Anodyne	ADRB3	40	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCCn3ncnc32)CC1	ZINC000819139511	FD	On-Demand	Anodyne	GPR119	44	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCCn3ncnc32)CC1	ZINC000819139512	FD	On-Demand	Anodyne	GPR119	44	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCCn3ncnc32)CC1	ZINC000819139513	FD	On-Demand	Anodyne	GPR119	44	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCCn3ncnc32)CC1	ZINC000819139516	FD	On-Demand	Anodyne	GPR119	44	40
O=C(NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1)C(F)=C1CCC1	ZINC000819139552	FI	On-Demand	Anodyne	DRD4	25	61
O=C(NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1)C(F)=C1CCC1	ZINC000819139552	FI	On-Demand	Anodyne	ACHE	23	46
O=C(NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1)C(F)=C1CCC1	ZINC000819139552	FI	On-Demand	Anodyne	HRH2	16	41
O=C(NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1)C(F)=C1CCC1	ZINC000819139552	FI	On-Demand	Anodyne	KCNH2	15	41
O=C(NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1)C(F)=C1CCC1	ZINC000819139552	FI	On-Demand	Anodyne	CHRM3	20	48
O=C(NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1)C(F)=C1CCC1	ZINC000819139552	FI	On-Demand	Anodyne	TACR1	17	41
O=C(NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1)C(F)=C1CCC1	ZINC000819139552	FI	On-Demand	Anodyne	SIGMAR1	28	64
O=C(NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1)C(F)=C1CCC1	ZINC000819139552	FI	On-Demand	Anodyne	SSTR5	45	38
O=C(NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1)C(F)=C1CCC1	ZINC000819139552	FI	On-Demand	Anodyne	CACNA1B	21	49
O=C(NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1)C(F)=C1CCC1	ZINC000819139552	FI	On-Demand	Anodyne	CCR3	27	44
O=C(NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1)C(F)=C1CCC1	ZINC000819139552	FI	On-Demand	Anodyne	BDKRB1	37	43
O=C(NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1)C(F)=C1CCC1	ZINC000819139552	FI	On-Demand	Anodyne	CCR2	77	48
O=C(NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1)C(F)=C1CCC1	ZINC000819139552	FI	On-Demand	Anodyne	SLC6A5	32	45
O=C(NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1)C(F)=C1CCC1	ZINC000819139552	FI	On-Demand	Anodyne	CXCR3	19	49
O=C(NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1)C(F)=C1CCC1	ZINC000819139552	FI	On-Demand	Anodyne	MCHR1	50	45
O=C(NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1)C(F)=C1CCC1	ZINC000819139552	FI	On-Demand	Anodyne	CACNA1G	35	41
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCc3[nH]ccc32)c1	ZINC000819139559	EF	On-Demand	Anodyne	ADRB2	19	41
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCc3[nH]ccc32)c1	ZINC000819139561	EF	On-Demand	Anodyne	ADRB2	19	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)c1	ZINC000819139562	EF	On-Demand	Anodyne	ADRB2	19	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCc3[nH]ccc32)c1	ZINC000819139563	EF	On-Demand	Anodyne	ADRB2	19	41
CO[C@@H](C)c1nc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cs1	ZINC000819139599	GF	On-Demand	Anodyne	GPR119	33	43
CO[C@@H](C)c1nc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cs1	ZINC000819139602	GF	On-Demand	Anodyne	GPR119	33	43
COC(=O)c1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139626	GF	On-Demand	Anodyne	ADRB2	44	44
COC(=O)c1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139626	GF	On-Demand	Anodyne	ADRB1	62	46
COC(=O)c1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139626	GF	On-Demand	Anodyne	ADRB3	49	48
COC(=O)c1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139626	GF	On-Demand	Anodyne	ABCB1	18	42
COC(=O)c1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139626	GF	On-Demand	Anodyne	L3MBTL3	80	38
COC(=O)c1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139627	GF	On-Demand	Anodyne	ADRB2	44	44
COC(=O)c1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139627	GF	On-Demand	Anodyne	ADRB1	62	46
COC(=O)c1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139627	GF	On-Demand	Anodyne	ADRB3	49	48
COC(=O)c1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139627	GF	On-Demand	Anodyne	ABCB1	18	42
COC(=O)c1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819139627	GF	On-Demand	Anodyne	L3MBTL3	80	38
CS(=O)(=O)c1ccc([C@@H](O)CNCc2nccn2CCc2ccccc2)cc1	ZINC000819139636	GE	On-Demand	Anodyne	ADRB3	70	39
CS(=O)(=O)c1ccc([C@H](O)CNCc2nccn2CCc2ccccc2)cc1	ZINC000819139637	GE	On-Demand	Anodyne	ADRB3	70	39
O=[N+]([O-])c1cccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819139655	GF	On-Demand	Bother	ADRB2	24	40
O=[N+]([O-])c1cccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819139655	GF	On-Demand	Bother	ADRB1	27	40
O=[N+]([O-])c1cccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819139655	GF	On-Demand	Bother	ADRB3	25	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819139656	GF	On-Demand	Bother	ADRB2	24	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819139656	GF	On-Demand	Bother	ADRB1	27	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819139656	GF	On-Demand	Bother	ADRB3	25	40
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2cc(F)ccc2F)CC1	ZINC000819139669	GE	On-Demand	Anodyne	CACNA1I	75	52
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2cc(F)ccc2F)CC1	ZINC000819139670	GE	On-Demand	Anodyne	CACNA1I	75	52
Cc1ccccc1[C@@H](O)CNCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000819139671	FE	On-Demand	Anodyne	CACNA1I	58	49
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2ccccc2F)CC1	ZINC000819139683	FE	On-Demand	Anodyne	CACNA1I	57	48
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2ccccc2F)CC1	ZINC000819139684	FE	On-Demand	Anodyne	CACNA1I	57	48
CON(C)C(=O)CCNC[C@H](c1cccnc1)C(C)C	ZINC000819139687	CD	On-Demand	Anodyne	ADRB3	49	41
CON(C)C(=O)CCNC[C@H](c1cccnc1)C(C)C	ZINC000819139687	CD	On-Demand	Anodyne	KCNA5	25	46
CON(C)C(=O)CCNC[C@@H](c1cccnc1)C(C)C	ZINC000819139688	CD	On-Demand	Anodyne	ADRB3	49	41
CON(C)C(=O)CCNC[C@@H](c1cccnc1)C(C)C	ZINC000819139688	CD	On-Demand	Anodyne	KCNA5	25	46
COc1ccc(OC)c([C@H](O)CNC[C@H](c2cccnc2)C(C)C)c1	ZINC000819139695	EG	On-Demand	Anodyne	ADRB2	19	41
COc1ccc(OC)c([C@H](O)CNC[C@H](c2cccnc2)C(C)C)c1	ZINC000819139695	EG	On-Demand	Anodyne	ADRB1	24	46
COc1ccc(OC)c([C@H](O)CNC[C@H](c2cccnc2)C(C)C)c1	ZINC000819139695	EG	On-Demand	Anodyne	ADRB3	47	46
COc1ccc(OC)c([C@H](O)CNC[C@@H](c2cccnc2)C(C)C)c1	ZINC000819139696	EG	On-Demand	Anodyne	ADRB2	19	41
COc1ccc(OC)c([C@H](O)CNC[C@@H](c2cccnc2)C(C)C)c1	ZINC000819139696	EG	On-Demand	Anodyne	ADRB1	24	46
COc1ccc(OC)c([C@H](O)CNC[C@@H](c2cccnc2)C(C)C)c1	ZINC000819139696	EG	On-Demand	Anodyne	ADRB3	47	46
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2ccc(C#N)cc2)CC1	ZINC000819139706	FD	On-Demand	Mild	CACNA1I	45	47
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2ccc(C#N)cc2)CC1	ZINC000819139707	FD	On-Demand	Mild	CACNA1I	45	47
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1Cl	ZINC000819139709	FG	On-Demand	Anodyne	ADRB2	40	53
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1Cl	ZINC000819139709	FG	On-Demand	Anodyne	ADRB1	33	53
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1Cl	ZINC000819139709	FG	On-Demand	Anodyne	ADRB3	26	40
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1Cl	ZINC000819139709	FG	On-Demand	Anodyne	ABCB1	34	51
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1Cl	ZINC000819139710	FG	On-Demand	Anodyne	ADRB2	40	53
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1Cl	ZINC000819139710	FG	On-Demand	Anodyne	ADRB1	33	53
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1Cl	ZINC000819139710	FG	On-Demand	Anodyne	ADRB3	26	40
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1Cl	ZINC000819139710	FG	On-Demand	Anodyne	ABCB1	34	51
Cc1ccccc1[C@@H](O)CNCC1CCN(CCC(C)C)CC1	ZINC000819139715	DG	On-Demand	Anodyne	HTR4	48	41
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1ccccc1	ZINC000819139816	EH	On-Demand	Anodyne	ADRB2	24	46
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1ccccc1	ZINC000819139816	EH	On-Demand	Anodyne	ADRB3	66	54
O[C@H](CNCc1csc(CCc2ccccc2)n1)c1ccccc1	ZINC000819139817	EH	On-Demand	Anodyne	ADRB2	24	46
O[C@H](CNCc1csc(CCc2ccccc2)n1)c1ccccc1	ZINC000819139817	EH	On-Demand	Anodyne	ADRB3	66	54
O=C1[C@@H](NC[C@H](O)c2ccccc2Cl)CCN1c1cccc(Cl)c1	ZINC000819139857	FG	On-Demand	Anodyne	OPRL1	40	36
O=C1[C@H](NC[C@H](O)c2ccccc2Cl)CCN1c1cccc(Cl)c1	ZINC000819139858	FG	On-Demand	Anodyne	OPRL1	40	36
CON(C)C(=O)CCN[C@@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1	ZINC000819139861	FD	On-Demand	Anodyne	PDS	15	41
CON(C)C(=O)CCN[C@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1	ZINC000819139862	FD	On-Demand	Anodyne	PDS	15	41
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccccc1	ZINC000819139865	CE	On-Demand	Anodyne	ADRB2	39	45
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccccc1	ZINC000819139865	CE	On-Demand	Anodyne	ADRB1	55	43
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccccc1	ZINC000819139865	CE	On-Demand	Anodyne	ADRB3	29	51
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccccc1	ZINC000819139866	CE	On-Demand	Anodyne	ADRB2	39	45
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccccc1	ZINC000819139866	CE	On-Demand	Anodyne	ADRB1	55	43
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccccc1	ZINC000819139866	CE	On-Demand	Anodyne	ADRB3	29	51
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccccc1	ZINC000819139867	CE	On-Demand	Anodyne	ADRB2	39	45
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccccc1	ZINC000819139867	CE	On-Demand	Anodyne	ADRB1	55	43
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccccc1	ZINC000819139867	CE	On-Demand	Anodyne	ADRB3	29	51
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccccc1	ZINC000819139868	CE	On-Demand	Anodyne	ADRB2	39	45
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccccc1	ZINC000819139868	CE	On-Demand	Anodyne	ADRB1	55	43
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccccc1	ZINC000819139868	CE	On-Demand	Anodyne	ADRB3	29	51
Cn1nc(CC(=O)NNC(=O)CC2CC2)c2ccccc2c1=O	ZINC000819139876	DC	On-Demand	Reactive	IMDH_CRYPV	40	57
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000819139892	EE	On-Demand	Reactive	AVPR2	37	42
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000819139892	EE	On-Demand	Reactive	AVPR1A	20	41
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000819139892	EE	On-Demand	Reactive	GRIN2B	16	40
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000819139892	EE	On-Demand	Reactive	PRNP	69	46
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000819139892	EE	On-Demand	Reactive	HDAC2	15	46
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000819139892	EE	On-Demand	Reactive	PLAU	18	42
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000819139892	EE	On-Demand	Reactive	SMO	16	45
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000819139892	EE	On-Demand	Reactive	DGAT1	46	41
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000819139892	EE	On-Demand	Reactive	NOD2	41	34
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)c2ccccc2)cc1	ZINC000819139892	EE	On-Demand	Reactive	KCNK3	70	42
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819139898	DF	On-Demand	Anodyne	ADRB2	28	48
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819139898	DF	On-Demand	Anodyne	ADRB1	34	40
CCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)CC1CC1	ZINC000819139899	ED	On-Demand	Reactive	HCN1	51	34
CCOc1cn(-c2ccccc2)nc1C(=O)NNC(=O)CC1CC1	ZINC000819139899	ED	On-Demand	Reactive	HCN4	43	34
Cc1ccc(OC[C@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819139901	DF	On-Demand	Anodyne	ADRB2	28	48
Cc1ccc(OC[C@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819139901	DF	On-Demand	Anodyne	ADRB1	34	40
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819139903	DF	On-Demand	Anodyne	ADRB2	28	48
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819139903	DF	On-Demand	Anodyne	ADRB1	34	40
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819139906	DF	On-Demand	Anodyne	ADRB2	28	48
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819139906	DF	On-Demand	Anodyne	ADRB1	34	40
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819139924	CH	On-Demand	Mild	KCNQ2	55	34
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819139924	CH	On-Demand	Mild	NPY2R	114	51
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819139924	CH	On-Demand	Mild	TAAR1	27	41
COc1ccc(N2CCCN(C(=O)Cc3ccc(-n4cnnc4)cc3)CC2)cc1	ZINC000819139932	GF	On-Demand	Clean	KCNJ1	62	39
O[C@@H](CNCc1nccn1CCCc1ccccc1)c1cccnc1	ZINC000819139953	EF	On-Demand	Anodyne	ADRB2	31	46
O[C@@H](CNCc1nccn1CCCc1ccccc1)c1cccnc1	ZINC000819139953	EF	On-Demand	Anodyne	ADRB1	32	41
O[C@@H](CNCc1nccn1CCCc1ccccc1)c1cccnc1	ZINC000819139953	EF	On-Demand	Anodyne	ADRB3	100	48
O[C@H](CNCc1nccn1CCCc1ccccc1)c1cccnc1	ZINC000819139962	EF	On-Demand	Anodyne	ADRB2	31	46
O[C@H](CNCc1nccn1CCCc1ccccc1)c1cccnc1	ZINC000819139962	EF	On-Demand	Anodyne	ADRB1	32	41
O[C@H](CNCc1nccn1CCCc1ccccc1)c1cccnc1	ZINC000819139962	EF	On-Demand	Anodyne	ADRB3	100	48
O=C1C[C@H](NC[C@@H](O)c2ccccc2)CN1c1cccc(C(F)(F)F)c1	ZINC000819139965	FG	On-Demand	Anodyne	ADRB3	19	41
O=C1C[C@H](NC[C@@H](O)c2ccccc2)CN1c1cccc(C(F)(F)F)c1	ZINC000819139965	FG	On-Demand	Anodyne	PDS	26	42
O=C1C[C@@H](NC[C@@H](O)c2ccccc2)CN1c1cccc(C(F)(F)F)c1	ZINC000819139966	FG	On-Demand	Anodyne	ADRB3	19	41
O=C1C[C@@H](NC[C@@H](O)c2ccccc2)CN1c1cccc(C(F)(F)F)c1	ZINC000819139966	FG	On-Demand	Anodyne	PDS	26	42
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2ccc(F)cn2)CC1	ZINC000819139967	FD	On-Demand	Anodyne	CACNA1I	64	48
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2ccc(F)cn2)CC1	ZINC000819139967	FD	On-Demand	Anodyne	SLC27A1	41	34
O=C1C[C@H](NC[C@H](O)c2ccccc2)CN1c1cccc(C(F)(F)F)c1	ZINC000819139969	FG	On-Demand	Anodyne	ADRB3	19	41
O=C1C[C@H](NC[C@H](O)c2ccccc2)CN1c1cccc(C(F)(F)F)c1	ZINC000819139969	FG	On-Demand	Anodyne	PDS	26	42
O=C1C[C@@H](NC[C@H](O)c2ccccc2)CN1c1cccc(C(F)(F)F)c1	ZINC000819139971	FG	On-Demand	Anodyne	ADRB3	19	41
O=C1C[C@@H](NC[C@H](O)c2ccccc2)CN1c1cccc(C(F)(F)F)c1	ZINC000819139971	FG	On-Demand	Anodyne	PDS	26	42
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2ccc(F)cn2)CC1	ZINC000819139976	FD	On-Demand	Anodyne	CACNA1I	64	48
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2ccc(F)cn2)CC1	ZINC000819139976	FD	On-Demand	Anodyne	SLC27A1	41	34
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2CCCc3[nH]ccc32)c1	ZINC000819139978	EE	On-Demand	Bother	ADRB1	15	40
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@H]2CCCc3[nH]ccc32)c1	ZINC000819139980	EE	On-Demand	Bother	ADRB1	15	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@H]2CCCc3[nH]ccc32)c1	ZINC000819139982	EE	On-Demand	Bother	ADRB1	15	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)c1	ZINC000819139985	EE	On-Demand	Bother	ADRB1	15	40
COC(=O)c1ccc(CCNC(=O)CCc2c(C)c3ccc(OC)cc3oc2=O)cc1	ZINC000819139992	HG	On-Demand	Anodyne	MAOA	16	46
COC(=O)c1ccc(CCNC(=O)CCc2c(C)c3ccc(OC)cc3oc2=O)cc1	ZINC000819139992	HG	On-Demand	Anodyne	MAOB	46	46
COC(=O)c1ccc(CCNC(=O)CCc2c(C)c3ccc(OC)cc3oc2=O)cc1	ZINC000819139992	HG	On-Demand	Anodyne	MTNR1A	72	44
COC(=O)c1ccc(CCNC(=O)CCc2c(C)c3ccc(OC)cc3oc2=O)cc1	ZINC000819139992	HG	On-Demand	Anodyne	MTNR1B	63	44
COC(=O)c1ccc(CCNC(=O)CCc2c(C)c3ccc(OC)cc3oc2=O)cc1	ZINC000819139992	HG	On-Demand	Anodyne	NQO1	40	45
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1	ZINC000819139993	FE	On-Demand	Reactive	RBP4	54	35
COC(=O)C1(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCCCC1	ZINC000819140002	GF	On-Demand	Mild	PAPA1_CARPA	40	49
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(C(=O)Nc2ccccc2F)C1	ZINC000819140006	FE	On-Demand	Reactive	RBP4	54	35
COC(=O)C1(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCCCC1	ZINC000819140007	GF	On-Demand	Mild	PAPA1_CARPA	40	49
O=C(CC1CC1)NNC(=O)c1ccc2c(c1)Cc1ccccc1-2	ZINC000819140041	DF	On-Demand	Reactive	SLC1A1	17	40
O=C(CC1CC1)NNC(=O)c1ccc2c(c1)Cc1ccccc1-2	ZINC000819140041	DF	On-Demand	Reactive	SLC1A3	20	40
C[C@H](CNC(=O)CCc1cccc(OC(F)F)c1)N1CCCCC1	ZINC000819140043	EG	On-Demand	Anodyne	HRH2	31	41
O=[N+]([O-])c1ccc([C@@H](O)CNCc2csc(CCc3ccccc3)n2)cc1	ZINC000819140046	GH	On-Demand	Bother	ADRB3	33	49
O=[N+]([O-])c1ccc([C@H](O)CNCc2csc(CCc3ccccc3)n2)cc1	ZINC000819140048	GH	On-Demand	Bother	ADRB3	33	49
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1ccc(F)cc1F	ZINC000819140053	EG	On-Demand	Anodyne	L3MBTL3	44	32
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1ccc(F)cc1F	ZINC000819140057	EG	On-Demand	Anodyne	L3MBTL3	44	32
O[C@H](CNC1CCC(N2CCCCC2)CC1)COCc1ccccc1	ZINC000819140065	EF	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNC1CCC(N2CCCCC2)CC1)COCc1ccccc1	ZINC000819140065	EF	On-Demand	Anodyne	ADRB1	18	41
O[C@H](CNC1CCC(N2CCCCC2)CC1)COCc1ccccc1	ZINC000819140065	EF	On-Demand	Anodyne	L3MBTL3	44	34
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(C)cc1C	ZINC000819140103	FI	On-Demand	Mild	PAPA1_CARPA	42	40
O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)CC1CC1	ZINC000819140104	GD	On-Demand	Reactive	F2	23	45
O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)CC1CC1	ZINC000819140104	GD	On-Demand	Reactive	TBXA2R	16	46
O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)CC1CC1	ZINC000819140104	GD	On-Demand	Reactive	HTR7	18	46
O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)CC1CC1	ZINC000819140104	GD	On-Demand	Reactive	TRY2_BOVIN	65	41
O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)CC1CC1	ZINC000819140104	GD	On-Demand	Reactive	NPY5R	15	56
Cc1nn(-c2ccc(C(F)(F)F)cn2)c(C)c1CC(=O)NNC(=O)CC1CC1	ZINC000819140107	GE	On-Demand	Reactive	P2RX7	21	44
O=[N+]([O-])c1cccc([C@@H](O)CNCc2nccn2CCc2ccccc2)c1	ZINC000819140112	FF	On-Demand	Bother	ADRB3	41	36
O=[N+]([O-])c1cccc([C@H](O)CNCc2nccn2CCc2ccccc2)c1	ZINC000819140118	FF	On-Demand	Bother	ADRB3	41	36
O=C(CC1CC1)NNC(=O)c1cc(-c2ccccc2)ccc1Cl	ZINC000819140120	EH	On-Demand	Reactive	AKR1C2	46	38
O=C(CC1CC1)NNC(=O)c1cc(-c2ccccc2)ccc1Cl	ZINC000819140120	EH	On-Demand	Reactive	DGAT1	16	40
O=C(CC1CC1)NNC(=O)c1cc(-c2ccccc2)ccc1Cl	ZINC000819140120	EH	On-Demand	Reactive	AKR1C1	50	38
O=C(CC1CC1)NNC(=O)c1ccc(Oc2ccccc2)cc1	ZINC000819140122	DG	On-Demand	Reactive	GRIN2B	24	48
O=C(CC1CC1)NNC(=O)c1ccc(Oc2ccccc2)cc1	ZINC000819140122	DG	On-Demand	Reactive	LTA4H	44	41
O=C(CC1CC1)NNC(=O)c1ccc(Oc2ccccc2)cc1	ZINC000819140122	DG	On-Demand	Reactive	MMP13	21	40
O=C(CC1CC1)NNC(=O)c1ccc(Oc2ccccc2)cc1	ZINC000819140122	DG	On-Demand	Reactive	DGAT1	17	41
Cc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819140125	EG	On-Demand	Anodyne	ADRB2	40	51
Cc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819140125	EG	On-Demand	Anodyne	ADRB1	47	49
Cc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819140125	EG	On-Demand	Anodyne	ADRB3	32	47
Cc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819140125	EG	On-Demand	Anodyne	HRH3	15	51
Cc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819140129	EG	On-Demand	Anodyne	ADRB2	40	51
Cc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819140129	EG	On-Demand	Anodyne	ADRB1	47	49
Cc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819140129	EG	On-Demand	Anodyne	ADRB3	32	47
Cc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819140129	EG	On-Demand	Anodyne	HRH3	15	51
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)CC1CC1	ZINC000819140145	GF	On-Demand	Reactive	DRD4	23	45
C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@@H]1C(=O)NNC(=O)CC1CC1	ZINC000819140148	GF	On-Demand	Reactive	DRD4	23	45
C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@H]1C(=O)NNC(=O)CC1CC1	ZINC000819140150	GF	On-Demand	Reactive	DRD4	23	45
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@H]1C(=O)NNC(=O)CC1CC1	ZINC000819140153	GF	On-Demand	Reactive	DRD4	23	45
O=C(CC1CC1)NNC(=O)c1ccccc1OCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819140155	IG	On-Demand	Reactive	KDR	17	43
O=C(CC1CC1)NNC(=O)c1ccccc1OCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819140155	IG	On-Demand	Reactive	MTTP	48	38
O=C(CC1CC1)NNC(=O)c1ccccc1OCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819140155	IG	On-Demand	Reactive	CCR2	40	38
O=C(CC1CC1)NNC(=O)c1ccccc1OCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819140155	IG	On-Demand	Reactive	KCNK3	62	45
O=C(CC1CC1)NNC(=O)c1ccccc1OCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819140155	IG	On-Demand	Reactive	KCNK9	53	45
O[C@H](CNCc1csc(CCc2ccccc2)n1)c1cccnc1	ZINC000819140173	EG	On-Demand	Anodyne	ADRB2	36	53
O[C@H](CNCc1csc(CCc2ccccc2)n1)c1cccnc1	ZINC000819140173	EG	On-Demand	Anodyne	ADRB1	37	48
O[C@H](CNCc1csc(CCc2ccccc2)n1)c1cccnc1	ZINC000819140173	EG	On-Demand	Anodyne	ADRB3	122	53
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1cccnc1	ZINC000819140174	EG	On-Demand	Anodyne	ADRB2	36	53
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1cccnc1	ZINC000819140174	EG	On-Demand	Anodyne	ADRB1	37	48
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1cccnc1	ZINC000819140174	EG	On-Demand	Anodyne	ADRB3	122	53
CC(C)(C)OC(=O)N1CCCN(C(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819140183	GH	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CCCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819140197	GE	On-Demand	Anodyne	GPR119	47	45
CC(C)(C)OC(=O)N1CCCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819140197	GE	On-Demand	Anodyne	KCNJ1	59	40
O=C(CC1CC1)NNC(=O)c1nc2ccccc2s1	ZINC000819140207	CD	On-Demand	Reactive	ST14	45	32
O=C(CC1CC1)NNC(=O)c1nc2ccccc2s1	ZINC000819140207	CD	On-Demand	Reactive	TMPRSS6	58	32
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)CC1	ZINC000819140211	IE	On-Demand	Reactive	EPHX2	48	51
C[C@@]1(C(=O)NNC(=O)CC2CC2)CCCN1C(=O)c1ccccc1	ZINC000819140218	ED	On-Demand	Reactive	SLC12A5	57	37
O=C(CC1CC1)NNC(=O)c1ccc(-c2noc(-c3ccc(F)cc3)n2)cc1	ZINC000819140222	GG	On-Demand	Reactive	S1PR4	35	42
O=C(CC1CC1)NNC(=O)c1ccc(-c2noc(-c3ccc(F)cc3)n2)cc1	ZINC000819140222	GG	On-Demand	Reactive	S1PR1	29	42
O=C(CC1CC1)NNC(=O)c1ccc(-c2noc(-c3ccc(F)cc3)n2)cc1	ZINC000819140222	GG	On-Demand	Reactive	S1PR5	47	42
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819140225	GD	On-Demand	Reactive	APP	52	36
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819140225	GD	On-Demand	Reactive	ADAM17	17	41
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819140225	GD	On-Demand	Reactive	EPHX2	44	51
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819140225	GD	On-Demand	Reactive	TGM2	71	41
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819140225	GD	On-Demand	Reactive	F13A1	73	37
COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819140227	ID	On-Demand	Reactive	KCNMA1	19	41
O=C(CC1CC1)NNC(=O)c1c2c(nc3ccccc13)/C(=C/c1cccs1)CC2	ZINC000819140235	HI	On-Demand	Reactive	TACR3	47	36
O=C(CC1CC1)NNC(=O)c1c2c(nc3ccccc13)/C(=C\c1cccs1)CC2	ZINC000819140236	HI	On-Demand	Reactive	TACR3	47	36
O=C(CC1CC1)NNC(=O)c1ccc(C2CCCCC2)cc1	ZINC000819140239	DG	On-Demand	Reactive	DGAT1	36	49
O=C(CC1CC1)NNC(=O)c1ccccc1OCc1ccc(Br)cc1	ZINC000819140264	HH	On-Demand	Reactive	HCN1	54	39
O=C(CC1CC1)NNC(=O)c1ccccc1OCc1ccc(Br)cc1	ZINC000819140264	HH	On-Demand	Reactive	HCN4	42	32
O=C(CC1CC1)NNC(=O)c1cccc(S(=O)(=O)NC2CC2)c1	ZINC000819140268	EC	On-Demand	Reactive	SFRP1	76	36
O=C(CC1CC1)NNC(=O)c1cc(-c2ccccc2)ns1	ZINC000819140280	DE	On-Demand	Reactive	VCP	47	39
Cc1noc(C2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)n1	ZINC000819140281	CD	On-Demand	Anodyne	ETHR	57	37
Cc1noc(C2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)n1	ZINC000819140285	CD	On-Demand	Anodyne	ETHR	57	37
Cc1noc(C2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)n1	ZINC000819140286	CD	On-Demand	Anodyne	ETHR	57	37
Cc1noc(C2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)n1	ZINC000819140287	CD	On-Demand	Anodyne	ETHR	57	37
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)OCC(F)(F)F)cc1	ZINC000819140299	FE	On-Demand	Reactive	ACR	30	40
CN(C(=O)c1ccc(C(=O)NNC(=O)CC2CC2)cc1)c1ccccc1	ZINC000819140308	FF	On-Demand	Reactive	OPRD1	21	48
O[C@H](CNC[C@H]1CCC[C@H](C(F)(F)F)C1)c1cccc(Cl)c1	ZINC000819140310	EI	On-Demand	Anodyne	ADRB1	32	41
O[C@H](CNC[C@H]1CCC[C@H](C(F)(F)F)C1)c1cccc(Cl)c1	ZINC000819140310	EI	On-Demand	Anodyne	ADRB3	43	41
O[C@H](CNC[C@H]1CCC[C@@H](C(F)(F)F)C1)c1cccc(Cl)c1	ZINC000819140312	EI	On-Demand	Anodyne	ADRB1	32	41
O[C@H](CNC[C@H]1CCC[C@@H](C(F)(F)F)C1)c1cccc(Cl)c1	ZINC000819140312	EI	On-Demand	Anodyne	ADRB3	43	41
O[C@H](CNC[C@@H]1CCC[C@H](C(F)(F)F)C1)c1cccc(Cl)c1	ZINC000819140315	EI	On-Demand	Anodyne	ADRB1	32	41
O[C@H](CNC[C@@H]1CCC[C@H](C(F)(F)F)C1)c1cccc(Cl)c1	ZINC000819140315	EI	On-Demand	Anodyne	ADRB3	43	41
O[C@H](CNC[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1cccc(Cl)c1	ZINC000819140317	EI	On-Demand	Anodyne	ADRB1	32	41
O[C@H](CNC[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1cccc(Cl)c1	ZINC000819140317	EI	On-Demand	Anodyne	ADRB3	43	41
CCCn1c(CCC(=O)NNC(=O)CC2CC2)nc2cc(S(N)(=O)=O)ccc21	ZINC000819140318	HC	On-Demand	Reactive	CNR2	24	45
O[C@H](CNC[C@H]1CSCCS1)COc1ccc2ccccc2c1	ZINC000819140319	EG	On-Demand	Anodyne	ADRB2	36	51
O[C@H](CNC[C@H]1CSCCS1)COc1ccc2ccccc2c1	ZINC000819140319	EG	On-Demand	Anodyne	ADRB1	52	40
O[C@H](CNC[C@H]1CSCCS1)COc1ccc2ccccc2c1	ZINC000819140319	EG	On-Demand	Anodyne	ADRB3	35	41
O[C@@H](CNC[C@@H]1CSCCS1)COc1ccc2ccccc2c1	ZINC000819140321	EG	On-Demand	Anodyne	ADRB2	36	51
O[C@@H](CNC[C@@H]1CSCCS1)COc1ccc2ccccc2c1	ZINC000819140321	EG	On-Demand	Anodyne	ADRB1	52	40
O[C@@H](CNC[C@@H]1CSCCS1)COc1ccc2ccccc2c1	ZINC000819140321	EG	On-Demand	Anodyne	ADRB3	35	41
O[C@H](CNC[C@@H]1CSCCS1)COc1ccc2ccccc2c1	ZINC000819140322	EG	On-Demand	Anodyne	ADRB2	36	51
O[C@H](CNC[C@@H]1CSCCS1)COc1ccc2ccccc2c1	ZINC000819140322	EG	On-Demand	Anodyne	ADRB1	52	40
O[C@H](CNC[C@@H]1CSCCS1)COc1ccc2ccccc2c1	ZINC000819140322	EG	On-Demand	Anodyne	ADRB3	35	41
O[C@@H](CNC[C@H]1CSCCS1)COc1ccc2ccccc2c1	ZINC000819140324	EG	On-Demand	Anodyne	ADRB2	36	51
O[C@@H](CNC[C@H]1CSCCS1)COc1ccc2ccccc2c1	ZINC000819140324	EG	On-Demand	Anodyne	ADRB1	52	40
O[C@@H](CNC[C@H]1CSCCS1)COc1ccc2ccccc2c1	ZINC000819140324	EG	On-Demand	Anodyne	ADRB3	35	41
N#Cc1cc(Cl)ccc1Oc1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819140355	FH	On-Demand	Reactive	EZH2	43	35
O=C(CC1CC1)NNC(=O)c1cc(S(=O)(=O)Nc2ccccc2Cl)ccc1O	ZINC000819140401	HE	On-Demand	Reactive	GRM4	15	41
O=C(CC1CC1)NNC(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O	ZINC000819140402	ID	On-Demand	Reactive	HSD17B1	21	46
O=C(CC1CC1)NNC(=O)C1CCC(NC(=O)C2CCCC2)CC1	ZINC000819140409	ED	On-Demand	Reactive	EPHX2	18	40
O=C(CC1CC1)NNC(=O)[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000819140411	DC	On-Demand	Reactive	DRD4	30	40
O=C(CC1CC1)NNC(=O)[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000819140411	DC	On-Demand	Reactive	SIGMAR1	72	43
O=C(CC1CC1)NNC(=O)[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000819140411	DC	On-Demand	Reactive	NPFFR1	43	38
O=C(CC1CC1)NNC(=O)[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000819140412	DC	On-Demand	Reactive	DRD4	30	40
O=C(CC1CC1)NNC(=O)[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000819140412	DC	On-Demand	Reactive	SIGMAR1	72	43
O=C(CC1CC1)NNC(=O)[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000819140412	DC	On-Demand	Reactive	NPFFR1	43	38
O=C(COCc1ccccn1)NNC(=O)CC1CC1	ZINC000819140426	CC	On-Demand	Reactive	GRIN2B	24	40
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000819140430	HH	On-Demand	Reactive	ESRRA	15	45
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000819140430	HH	On-Demand	Reactive	CPT1A	43	33
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000819140430	HH	On-Demand	Reactive	PTGDR	20	40
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000819140430	HH	On-Demand	Reactive	PTGDR2	15	40
O=C(CC1CC1)NNC(=O)c1cc(-c2ccccc2)no1	ZINC000819140433	CD	On-Demand	Reactive	VCP	57	39
O=C(COc1ccc(Cl)cc1C1CCCCC1)NNC(=O)CC1CC1	ZINC000819140445	FH	On-Demand	Reactive	PTGDR2	22	68
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)CC1CC1	ZINC000819140464	HD	On-Demand	Reactive	ACE	16	41
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)CC1CC1	ZINC000819140464	HD	On-Demand	Reactive	MME	22	41
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)CC1CC1	ZINC000819140464	HD	On-Demand	Reactive	EDNRA	24	46
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)CC1CC1	ZINC000819140464	HD	On-Demand	Reactive	TACR1	15	43
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)CC1CC1	ZINC000819140464	HD	On-Demand	Reactive	BRS3	26	43
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)CC1CC1	ZINC000819140464	HD	On-Demand	Reactive	MC5R	51	37
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)CC1CC1	ZINC000819140464	HD	On-Demand	Reactive	MMP2	17	41
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)CC1CC1	ZINC000819140464	HD	On-Demand	Reactive	MMP8	30	41
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)CC1CC1	ZINC000819140464	HD	On-Demand	Reactive	GRPR	64	36
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)CC1CC1	ZINC000819140464	HD	On-Demand	Reactive	ECE1	42	41
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)CC1CC1	ZINC000819140464	HD	On-Demand	Reactive	GHSR	16	46
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)CC1CC1	ZINC000819140464	HD	On-Demand	Reactive	MMP9	15	41
CC(=O)N[C@@H](Cc1c[nH]c2ccc(Br)cc12)C(=O)NNC(=O)CC1CC1	ZINC000819140464	HD	On-Demand	Reactive	MC1R	53	38
O=C(CC1CC1)NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	ZINC000819140473	HD	On-Demand	Reactive	CASP3	20	47
O=C(CC1CC1)NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O	ZINC000819140473	HD	On-Demand	Reactive	CASP6	15	47
O=C(CC1CC1)NNC(=O)[C@@H]1CCN(c2ccccc2Cl)C1	ZINC000819140477	DE	On-Demand	Reactive	DRD3	17	43
O=C(CC1CC1)NNC(=O)[C@H]1CCN(c2ccccc2Cl)C1	ZINC000819140479	DE	On-Demand	Reactive	DRD3	17	43
O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)CC1CC1	ZINC000819140482	GD	On-Demand	Reactive	EPHX2	18	44
O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)CC1CC1	ZINC000819140482	GD	On-Demand	Reactive	TGM2	74	39
O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)CC1CC1	ZINC000819140482	GD	On-Demand	Reactive	F13A1	73	40
O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)CC1CC1	ZINC000819140482	GD	On-Demand	Reactive	NAMPT	42	43
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	ZINC000819140508	GD	On-Demand	Reactive	MMP13	18	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	ZINC000819140508	GD	On-Demand	Reactive	MMP3	19	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	ZINC000819140508	GD	On-Demand	Reactive	EPHX2	15	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	ZINC000819140508	GD	On-Demand	Reactive	MMP7	21	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	ZINC000819140508	GD	On-Demand	Reactive	MMP1	22	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	ZINC000819140508	GD	On-Demand	Reactive	F13A1	44	38
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	ZINC000819140510	GD	On-Demand	Reactive	MMP13	18	40
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	ZINC000819140510	GD	On-Demand	Reactive	MMP3	19	40
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	ZINC000819140510	GD	On-Demand	Reactive	EPHX2	15	40
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	ZINC000819140510	GD	On-Demand	Reactive	MMP7	21	40
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	ZINC000819140510	GD	On-Demand	Reactive	MMP1	22	40
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	ZINC000819140510	GD	On-Demand	Reactive	F13A1	44	38
O=C(CC1CC1)NNC(=O)[C@H](F)Cc1ccccc1	ZINC000819140527	CD	On-Demand	Reactive	ACE	55	37
O=C(CC1CC1)NNC(=O)[C@H](F)Cc1ccccc1	ZINC000819140527	CD	On-Demand	Reactive	MME	104	37
O=C(CC1CC1)NNC(=O)[C@H](F)Cc1ccccc1	ZINC000819140527	CD	On-Demand	Reactive	TIMP3	40	32
O=C(CC1CC1)NNC(=O)[C@H](F)Cc1ccccc1	ZINC000819140527	CD	On-Demand	Reactive	CAPN1	54	36
O=C(CC1CC1)NNC(=O)[C@H](F)Cc1ccccc1	ZINC000819140527	CD	On-Demand	Reactive	CAPN2	44	31
O=C(CC1CC1)NNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819140529	CD	On-Demand	Reactive	ACE	55	37
O=C(CC1CC1)NNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819140529	CD	On-Demand	Reactive	MME	104	37
O=C(CC1CC1)NNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819140529	CD	On-Demand	Reactive	TIMP3	40	32
O=C(CC1CC1)NNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819140529	CD	On-Demand	Reactive	CAPN1	54	36
O=C(CC1CC1)NNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819140529	CD	On-Demand	Reactive	CAPN2	44	31
O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)CC1CC1	ZINC000819140530	HD	On-Demand	Reactive	MMP9	25	40
O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)CC1CC1	ZINC000819140530	HD	On-Demand	Reactive	EPHX2	30	42
N#Cc1cccc(CC(=O)NNC(=O)CC2CC2)c1	ZINC000819140534	CD	On-Demand	Reactive	CCR3	16	41
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1ccc(F)cc1	ZINC000819140540	FH	On-Demand	Anodyne	ADRB2	23	40
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1ccc(F)cc1	ZINC000819140540	FH	On-Demand	Anodyne	ADRB3	38	52
O[C@H](CNCc1csc(CCc2ccccc2)n1)c1ccc(F)cc1	ZINC000819140541	FH	On-Demand	Anodyne	ADRB2	23	40
O[C@H](CNCc1csc(CCc2ccccc2)n1)c1ccc(F)cc1	ZINC000819140541	FH	On-Demand	Anodyne	ADRB3	38	52
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)c2cccc(Br)c2)cc1	ZINC000819140542	HG	On-Demand	Reactive	PRNP	46	40
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)c2cccc(Br)c2)cc1	ZINC000819140542	HG	On-Demand	Reactive	KCNK3	84	37
O=C(CC1CC1)NNC(=O)c1ccc(NC(=O)c2cccc(Br)c2)cc1	ZINC000819140542	HG	On-Demand	Reactive	KCNK9	40	35
CC(=O)Nc1cccc(CC(=O)Nc2ccc(CN3CCOC3=O)cc2)c1	ZINC000819140582	FF	On-Demand	Anodyne	TSHR	47	30
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819140588	FG	On-Demand	Anodyne	HTR1D	22	40
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819140588	FG	On-Demand	Anodyne	HTR1B	20	40
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819140588	FG	On-Demand	Anodyne	KCNQ2	40	46
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819140588	FG	On-Demand	Anodyne	NPY2R	84	41
CNC(=O)COc1cccc(CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819140591	GD	On-Demand	Anodyne	PDS	46	32
COc1cccc(Oc2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cc2)c1	ZINC000819140605	EI	On-Demand	Anodyne	RAF1	21	46
COc1cccc(Oc2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cc2)c1	ZINC000819140605	EI	On-Demand	Anodyne	MTNR1A	22	62
COc1cccc(Oc2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cc2)c1	ZINC000819140605	EI	On-Demand	Anodyne	MTNR1B	30	62
COc1cccc(Oc2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cc2)c1	ZINC000819140605	EI	On-Demand	Anodyne	PFKFB3	60	33
COc1cccc(Oc2ccc(NC(=O)/C=C/[C@H]3CCCO3)cc2)c1	ZINC000819140607	EI	On-Demand	Anodyne	RAF1	21	46
COc1cccc(Oc2ccc(NC(=O)/C=C/[C@H]3CCCO3)cc2)c1	ZINC000819140607	EI	On-Demand	Anodyne	MTNR1A	22	62
COc1cccc(Oc2ccc(NC(=O)/C=C/[C@H]3CCCO3)cc2)c1	ZINC000819140607	EI	On-Demand	Anodyne	MTNR1B	30	62
COc1cccc(Oc2ccc(NC(=O)/C=C/[C@H]3CCCO3)cc2)c1	ZINC000819140607	EI	On-Demand	Anodyne	PFKFB3	60	33
O=C1[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCN1c1cccc(Cl)c1	ZINC000819140608	GF	On-Demand	Bother	ADRB3	38	40
O=C1[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCN1c1cccc(Cl)c1	ZINC000819140608	GF	On-Demand	Bother	CYP3A4	45	34
COc1cccc(Oc2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cc2)c1	ZINC000819140609	EI	On-Demand	Anodyne	RAF1	21	46
COc1cccc(Oc2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cc2)c1	ZINC000819140609	EI	On-Demand	Anodyne	MTNR1A	22	62
COc1cccc(Oc2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cc2)c1	ZINC000819140609	EI	On-Demand	Anodyne	MTNR1B	30	62
COc1cccc(Oc2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cc2)c1	ZINC000819140609	EI	On-Demand	Anodyne	PFKFB3	60	33
O=C1[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCN1c1cccc(Cl)c1	ZINC000819140610	GF	On-Demand	Bother	ADRB3	38	40
O=C1[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCN1c1cccc(Cl)c1	ZINC000819140610	GF	On-Demand	Bother	CYP3A4	45	34
COc1cccc(Oc2ccc(NC(=O)/C=C\[C@H]3CCCO3)cc2)c1	ZINC000819140611	EI	On-Demand	Anodyne	RAF1	21	46
COc1cccc(Oc2ccc(NC(=O)/C=C\[C@H]3CCCO3)cc2)c1	ZINC000819140611	EI	On-Demand	Anodyne	MTNR1A	22	62
COc1cccc(Oc2ccc(NC(=O)/C=C\[C@H]3CCCO3)cc2)c1	ZINC000819140611	EI	On-Demand	Anodyne	MTNR1B	30	62
COc1cccc(Oc2ccc(NC(=O)/C=C\[C@H]3CCCO3)cc2)c1	ZINC000819140611	EI	On-Demand	Anodyne	PFKFB3	60	33
CC[C@@H](NC[C@H](O)c1ccc(Cl)cc1)C(=O)N1CCOCC1	ZINC000819140612	ED	On-Demand	Anodyne	CCR1	33	42
O=C1[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)CCN1c1cccc(Cl)c1	ZINC000819140613	GF	On-Demand	Bother	ADRB3	38	40
O=C1[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)CCN1c1cccc(Cl)c1	ZINC000819140613	GF	On-Demand	Bother	CYP3A4	45	34
O=C1[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)CCN1c1cccc(Cl)c1	ZINC000819140615	GF	On-Demand	Bother	ADRB3	38	40
O=C1[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)CCN1c1cccc(Cl)c1	ZINC000819140615	GF	On-Demand	Bother	CYP3A4	45	34
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819140630	EF	On-Demand	Anodyne	ADRB2	20	40
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819140631	EF	On-Demand	Anodyne	ADRB2	20	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819140632	EF	On-Demand	Anodyne	ADRB2	20	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819140633	EF	On-Demand	Anodyne	ADRB2	20	40
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819140648	DG	On-Demand	Anodyne	NPY2R	81	42
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819140649	DG	On-Demand	Anodyne	NPY2R	81	42
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819140650	DG	On-Demand	Anodyne	NPY2R	81	42
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819140651	DG	On-Demand	Anodyne	NPY2R	81	42
O=C(Nc1ccc(N2CCCC2)c(F)c1)C(F)=C1CCC1	ZINC000819140652	CH	On-Demand	Anodyne	KCNQ2	40	34
O=C(Nc1ccc(N2CCCC2)c(F)c1)C(F)=C1CCC1	ZINC000819140652	CH	On-Demand	Anodyne	NPY2R	92	41
COc1cccc(OC)c1OC[C@@H](O)CN[C@H]1CCCc2[nH]ccc21	ZINC000819140660	EE	On-Demand	Anodyne	ADRB2	19	48
COc1cccc(OC)c1OC[C@@H](O)CN[C@H]1CCCc2[nH]ccc21	ZINC000819140660	EE	On-Demand	Anodyne	ADRB1	23	48
COc1cccc(OC)c1OC[C@H](O)CN[C@H]1CCCc2[nH]ccc21	ZINC000819140662	EE	On-Demand	Anodyne	ADRB2	19	48
COc1cccc(OC)c1OC[C@H](O)CN[C@H]1CCCc2[nH]ccc21	ZINC000819140662	EE	On-Demand	Anodyne	ADRB1	23	48
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1CCCc2[nH]ccc21	ZINC000819140664	EE	On-Demand	Anodyne	ADRB2	19	48
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1CCCc2[nH]ccc21	ZINC000819140664	EE	On-Demand	Anodyne	ADRB1	23	48
COc1cccc(OC)c1OC[C@@H](O)CN[C@@H]1CCCc2[nH]ccc21	ZINC000819140666	EE	On-Demand	Anodyne	ADRB2	19	48
COc1cccc(OC)c1OC[C@@H](O)CN[C@@H]1CCCc2[nH]ccc21	ZINC000819140666	EE	On-Demand	Anodyne	ADRB1	23	48
O=C(CNC(=O)Nc1ccccc1)NNC(=O)CC1CC1	ZINC000819140682	CC	On-Demand	Reactive	CCR3	23	43
O=C(CNC(=O)Nc1ccccc1)NNC(=O)CC1CC1	ZINC000819140682	CC	On-Demand	Reactive	EPHX2	17	44
O=C(CNC(=O)Nc1ccccc1)NNC(=O)CC1CC1	ZINC000819140682	CC	On-Demand	Reactive	F7	22	40
O=C(CC1CC1)NNC(=O)c1nnn(-c2cccc(C(F)(F)F)c2)c1C1CC1	ZINC000819140683	GF	On-Demand	Reactive	CCR2	68	37
O=C(Nc1ccc(N2CCCC2)c(F)c1)c1cc2c(cn1)OCCO2	ZINC000819140691	EF	On-Demand	Anodyne	NPY2R	93	39
O=C(Nc1ccc(N2CCCC2)c(F)c1)c1cc2c(cn1)OCCO2	ZINC000819140691	EF	On-Demand	Anodyne	DGAT1	17	44
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1	ZINC000819140705	HE	On-Demand	Reactive	CELA1	22	49
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1	ZINC000819140705	HE	On-Demand	Reactive	CTRA_BOVIN	53	32
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1	ZINC000819140705	HE	On-Demand	Reactive	TRY1_BOVIN	55	33
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1	ZINC000819140705	HE	On-Demand	Reactive	CTSG	40	32
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1	ZINC000819140705	HE	On-Demand	Reactive	PREP	51	49
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1	ZINC000819140705	HE	On-Demand	Reactive	CELA2A	41	32
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1	ZINC000819140705	HE	On-Demand	Reactive	LGMN	101	61
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1	ZINC000819140705	HE	On-Demand	Reactive	KLK5	25	42
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1	ZINC000819140705	HE	On-Demand	Reactive	TMPRSS11D	44	35
O=C(CC1CC1)NNC(=O)c1ccc2c(c1)CCCC(=O)N2	ZINC000819140713	DD	On-Demand	Reactive	HDAC9	20	46
C[C@H]1CC[C@@H](C)[C@@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819140733	CG	On-Demand	Anodyne	ADRB1	37	45
C[C@H]1CC[C@@H](C)[C@@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819140733	CG	On-Demand	Anodyne	ADRB3	55	49
C[C@H]1CC[C@@H](C)[C@@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819140733	CG	On-Demand	Anodyne	IGF1R	29	40
C[C@H]1CC[C@@H](C)[C@@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819140733	CG	On-Demand	Anodyne	CYP3A4	50	40
C[C@@H]1CC[C@@H](C)C1NC[C@H](O)c1cccc(Cl)c1	ZINC000819140734	CG	On-Demand	Anodyne	ADRB1	37	45
C[C@@H]1CC[C@@H](C)C1NC[C@H](O)c1cccc(Cl)c1	ZINC000819140734	CG	On-Demand	Anodyne	ADRB3	55	49
C[C@@H]1CC[C@@H](C)C1NC[C@H](O)c1cccc(Cl)c1	ZINC000819140734	CG	On-Demand	Anodyne	IGF1R	29	40
C[C@@H]1CC[C@@H](C)C1NC[C@H](O)c1cccc(Cl)c1	ZINC000819140734	CG	On-Demand	Anodyne	CYP3A4	50	40
O=C(CCCCCc1ccc(I)cc1)NNC(=O)CC1CC1	ZINC000819140737	HG	On-Demand	Reactive	LUXR	16	42
O=C(CC1CC1)NNC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000819140738	FG	On-Demand	Reactive	CCR2	55	38
O=C(CC1CC1)NNC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000819140738	FG	On-Demand	Reactive	CACNA1I	23	48
CCCOc1ccc(-c2nc(C(=O)NNC(=O)CC3CC3)cs2)cc1	ZINC000819140743	FG	On-Demand	Reactive	PPARD	29	43
O=C(CC1CC1)NNC(=O)c1ccc(NS(=O)(=O)c2cc(Cl)ccc2Cl)cc1	ZINC000819140744	IG	On-Demand	Reactive	SGK1	49	40
C=CCC1(C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)CCOCC1	ZINC000819140782	FJ	On-Demand	Mild	NPY2R	52	46
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OC1CCCC1	ZINC000819140806	EF	On-Demand	Reactive	PDE4A	42	59
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OC1CCCC1	ZINC000819140806	EF	On-Demand	Reactive	PDE4B	22	59
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OC1CCCC1	ZINC000819140806	EF	On-Demand	Reactive	PDE4D	32	59
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OC1CCCC1	ZINC000819140806	EF	On-Demand	Reactive	PDE4C	19	59
O=C(CC1CC1)NNC(=O)c1cn(Cc2ccccc2)nc1-c1ccc(Cl)cc1	ZINC000819140823	HH	On-Demand	Reactive	DRD4	28	42
O=C(CC1CC1)NNC(=O)c1cn(Cc2ccccc2)nc1-c1ccc(Cl)cc1	ZINC000819140823	HH	On-Demand	Reactive	SIGMAR1	18	41
O=C(CC1CC1)NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1	ZINC000819140842	IH	On-Demand	Reactive	GRIN2B	51	48
O=C(CC1CC1)NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1	ZINC000819140842	IH	On-Demand	Reactive	WDR5	32	41
O=C(CCc1ccccc1Cl)NNC(=O)CC1CC1	ZINC000819140849	CE	On-Demand	Reactive	P2RX7	16	41
O=C(CC1CC1)NNC(=O)c1ccc(C#Cc2ccccc2)cc1	ZINC000819140901	DF	On-Demand	Reactive	GRIN2B	15	42
O=C(CC1CC1)NNC(=O)c1ccc(C#Cc2ccccc2)cc1	ZINC000819140901	DF	On-Demand	Reactive	FFAR1	21	42
O=C(CC1CC1)NNC(=O)c1ccc(OCC2CCCCC2)cc1	ZINC000819140909	EG	On-Demand	Reactive	GRIN2B	15	51
O=C(CC1CC1)NNC(=O)c1ccc(OCC2CCCCC2)cc1	ZINC000819140909	EG	On-Demand	Reactive	HPGD	18	42
O=C(CC1CC1)NNC(=O)c1cc(Br)c2ccccc2c1	ZINC000819140910	EG	On-Demand	Reactive	KCNJ11	16	40
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819140913	ED	On-Demand	Reactive	DRD4	21	48
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819140913	ED	On-Demand	Reactive	ACHE	15	40
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819140913	ED	On-Demand	Reactive	SLC6A1	136	42
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819140913	ED	On-Demand	Reactive	SIGMAR1	28	49
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819140913	ED	On-Demand	Reactive	CCR3	73	43
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819140913	ED	On-Demand	Reactive	MLNR	29	41
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819140913	ED	On-Demand	Reactive	CACNA1G	29	43
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819140914	ED	On-Demand	Reactive	DRD4	21	48
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819140914	ED	On-Demand	Reactive	ACHE	15	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819140914	ED	On-Demand	Reactive	SLC6A1	136	42
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819140914	ED	On-Demand	Reactive	SIGMAR1	28	49
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819140914	ED	On-Demand	Reactive	CCR3	73	43
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819140914	ED	On-Demand	Reactive	MLNR	29	41
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819140914	ED	On-Demand	Reactive	CACNA1G	29	43
NC(=O)c1cn(CC(=O)NNC(=O)CC2CC2)c2ccccc12	ZINC000819140919	DC	On-Demand	Reactive	CNR1	18	42
NC(=O)c1cn(CC(=O)NNC(=O)CC2CC2)c2ccccc12	ZINC000819140919	DC	On-Demand	Reactive	CNR2	26	41
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1	ZINC000819140921	GE	On-Demand	Reactive	PRTN3	51	33
O=C(CC1CC1)NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1	ZINC000819140921	GE	On-Demand	Reactive	LIMK2	25	49
O=C(CNC(=O)c1cccc(O)c1)NNC(=O)CC1CC1	ZINC000819140930	CC	On-Demand	Reactive	CCR2	77	43
COc1cccc(Nc2ccccc2C(=O)NNC(=O)CC2CC2)c1	ZINC000819140935	EF	On-Demand	Reactive	CCR3	16	42
COc1cccc(Nc2ccccc2C(=O)NNC(=O)CC2CC2)c1	ZINC000819140935	EF	On-Demand	Reactive	MTNR1A	29	45
COc1cccc(Nc2ccccc2C(=O)NNC(=O)CC2CC2)c1	ZINC000819140935	EF	On-Demand	Reactive	MTNR1B	32	45
COc1cccc(Nc2ccccc2C(=O)NNC(=O)CC2CC2)c1	ZINC000819140935	EF	On-Demand	Reactive	AKR1C3	36	59
COc1cccc(Nc2ccccc2C(=O)NNC(=O)CC2CC2)c1	ZINC000819140935	EF	On-Demand	Reactive	AKR1C2	69	42
COc1cccc(Nc2ccccc2C(=O)NNC(=O)CC2CC2)c1	ZINC000819140935	EF	On-Demand	Reactive	KCNK3	49	38
COc1cccc(Nc2ccccc2C(=O)NNC(=O)CC2CC2)c1	ZINC000819140935	EF	On-Demand	Reactive	KCNK9	41	38
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1	ZINC000819140936	FC	On-Demand	Reactive	EPHX2	36	45
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1	ZINC000819140936	FC	On-Demand	Reactive	TGM2	56	35
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1	ZINC000819140936	FC	On-Demand	Reactive	F13A1	52	34
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1	ZINC000819140936	FC	On-Demand	Reactive	NAMPT	77	46
O=C(CC1CC1)NNC(=O)c1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819140943	EE	On-Demand	Reactive	GRIN2B	17	40
O=C(CC1CC1)NNC(=O)c1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819140943	EE	On-Demand	Reactive	PRNP	51	43
O=C(CC1CC1)NNC(=O)c1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819140943	EE	On-Demand	Reactive	HDAC1	15	41
O=C(CC1CC1)NNC(=O)c1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819140943	EE	On-Demand	Reactive	HDAC2	16	51
O=C(CC1CC1)NNC(=O)c1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819140943	EE	On-Demand	Reactive	PLAU	15	46
O=C(CC1CC1)NNC(=O)c1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819140943	EE	On-Demand	Reactive	DGAT1	40	41
O=C(CC1CC1)NNC(=O)c1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819140943	EE	On-Demand	Reactive	KCNK3	77	43
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819140949	HC	On-Demand	Reactive	MMP1	23	41
O=C(CC1CC1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819140950	HC	On-Demand	Reactive	MMP1	23	41
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1	ZINC000819140955	GD	On-Demand	Reactive	EPHX2	41	62
O=C(CSc1nnc(COc2ccccc2)n1-c1ccccc1)NNC(=O)CC1CC1	ZINC000819140959	IF	On-Demand	Reactive	VCP	89	56
O=C(CC1CC1)NNC(=O)C1CCN(C(=O)Nc2ccccc2)CC1	ZINC000819140960	ED	On-Demand	Reactive	EPHX2	46	41
CN(C(=O)c1cccc(C(=O)NNC(=O)CC2CC2)c1)c1ccccc1	ZINC000819140983	FF	On-Demand	Reactive	OPRD1	18	43
O=C(CC1CC1)NNC(=O)CC(Cc1ccccc1)Cc1ccccc1	ZINC000819140988	FG	On-Demand	Reactive	ACE	43	35
O=C(CC1CC1)NNC(=O)CC(Cc1ccccc1)Cc1ccccc1	ZINC000819140988	FG	On-Demand	Reactive	MME	87	38
O=C(CC1CC1)NNC(=O)CC(Cc1ccccc1)Cc1ccccc1	ZINC000819140988	FG	On-Demand	Reactive	CPA1	49	38
O=C(CC1CC1)NNC(=O)CC(Cc1ccccc1)Cc1ccccc1	ZINC000819140988	FG	On-Demand	Reactive	CAPN1	49	36
N#Cc1c(Cl)cccc1Oc1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819141004	FH	On-Demand	Reactive	EZH2	43	45
CC[C@@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1CCOCC1	ZINC000819141043	FD	On-Demand	Anodyne	ITGAL	40	31
CC[C@@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1CCOCC1	ZINC000819141043	FD	On-Demand	Anodyne	CASR	27	42
CC[C@@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1CCOCC1	ZINC000819141043	FD	On-Demand	Anodyne	MTTP	26	40
CC[C@@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1CCOCC1	ZINC000819141043	FD	On-Demand	Anodyne	CCR2	27	46
CC[C@@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1CCOCC1	ZINC000819141043	FD	On-Demand	Anodyne	EPHX2	18	40
CC[C@@H](NC[C@@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1CCOCC1	ZINC000819141045	FD	On-Demand	Anodyne	ITGAL	40	31
CC[C@@H](NC[C@@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1CCOCC1	ZINC000819141045	FD	On-Demand	Anodyne	CASR	27	42
CC[C@@H](NC[C@@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1CCOCC1	ZINC000819141045	FD	On-Demand	Anodyne	MTTP	26	40
CC[C@@H](NC[C@@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1CCOCC1	ZINC000819141045	FD	On-Demand	Anodyne	CCR2	27	46
CC[C@@H](NC[C@@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1CCOCC1	ZINC000819141045	FD	On-Demand	Anodyne	EPHX2	18	40
CC[C@@H](NC[C@H](O)c1ccccc1)C(=O)N1CCOCC1	ZINC000819141047	CC	On-Demand	Anodyne	P2RY12	53	40
CC[C@@H](NC[C@H](O)c1ccccc1)C(=O)N1CCOCC1	ZINC000819141047	CC	On-Demand	Anodyne	CASR	45	36
CC[C@@H](NC[C@H](O)c1ccccc1)C(=O)N1CCOCC1	ZINC000819141047	CC	On-Demand	Anodyne	CTSS	24	43
CC[C@@H](NC[C@@H](O)c1ccccc1)C(=O)N1CCOCC1	ZINC000819141049	CC	On-Demand	Anodyne	P2RY12	53	40
CC[C@@H](NC[C@@H](O)c1ccccc1)C(=O)N1CCOCC1	ZINC000819141049	CC	On-Demand	Anodyne	CASR	45	36
CC[C@@H](NC[C@@H](O)c1ccccc1)C(=O)N1CCOCC1	ZINC000819141049	CC	On-Demand	Anodyne	CTSS	24	43
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cc(C)ccc1C	ZINC000819141053	FI	On-Demand	Mild	PAPA1_CARPA	39	41
CC[C@@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)C(=O)N1CCOCC1	ZINC000819141055	FC	On-Demand	Anodyne	TRY2_BOVIN	44	38
CC[C@@H](NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)C(=O)N1CCOCC1	ZINC000819141057	FC	On-Demand	Anodyne	TRY2_BOVIN	44	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCN(c3ccccc3)CC1)C2	ZINC000819141059	FF	On-Demand	Anodyne	SSTR1	53	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCN(c3ccccc3)CC1)C2	ZINC000819141059	FF	On-Demand	Anodyne	ADAM10	56	52
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCN(c3ccccc3)CC1)C2	ZINC000819141060	FF	On-Demand	Anodyne	SSTR1	53	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCN(c3ccccc3)CC1)C2	ZINC000819141060	FF	On-Demand	Anodyne	ADAM10	56	52
O=C(NCc1cccc(NC(=O)N2CCCC2)c1)C(F)=C1CCC1	ZINC000819141067	EG	On-Demand	Anodyne	P2RY14	47	36
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1cc(F)ccc1F	ZINC000819141086	FI	On-Demand	Anodyne	ADRB3	15	42
O[C@H](CNCc1csc(CCc2ccccc2)n1)c1cc(F)ccc1F	ZINC000819141087	FI	On-Demand	Anodyne	ADRB3	15	42
CC(C)(C)OC(=O)N1CCCN(C(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819141096	FD	On-Demand	Anodyne	GPR119	35	40
O=C(CC1CC1)NNC(=O)c1ccc([C@H]2CCCOC2)cc1	ZINC000819141106	DE	On-Demand	Reactive	DGAT1	19	40
O=C(CC1CC1)NNC(=O)c1ccc([C@@H]2CCCOC2)cc1	ZINC000819141107	DE	On-Demand	Reactive	DGAT1	19	40
O=C(CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12)NNC(=O)CC1CC1	ZINC000819141110	GH	On-Demand	Reactive	GNRHR	29	42
O=C(CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12)NNC(=O)CC1CC1	ZINC000819141110	GH	On-Demand	Reactive	TSPO	32	49
O=C(CC1CC1)NNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000819141119	DD	On-Demand	Reactive	GABRA1	18	52
O=C(CC1CC1)NNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000819141119	DD	On-Demand	Reactive	GABRA5	15	52
O=C(CC1CC1)NNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000819141119	DD	On-Demand	Reactive	GABRA2	16	52
C[C@H]1CC[C@@H](C)[C@@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819141126	CG	On-Demand	Anodyne	ADRB1	37	45
C[C@H]1CC[C@@H](C)[C@@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819141126	CG	On-Demand	Anodyne	ADRB3	55	49
C[C@H]1CC[C@@H](C)[C@@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819141126	CG	On-Demand	Anodyne	IGF1R	29	40
C[C@H]1CC[C@@H](C)[C@@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819141126	CG	On-Demand	Anodyne	CYP3A4	50	40
C[C@@H]1CC[C@@H](C)C1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819141127	CG	On-Demand	Anodyne	ADRB1	37	45
C[C@@H]1CC[C@@H](C)C1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819141127	CG	On-Demand	Anodyne	ADRB3	55	49
C[C@@H]1CC[C@@H](C)C1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819141127	CG	On-Demand	Anodyne	IGF1R	29	40
C[C@@H]1CC[C@@H](C)C1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819141127	CG	On-Demand	Anodyne	CYP3A4	50	40
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819141128	EE	On-Demand	Anodyne	ADRB2	30	53
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819141128	EE	On-Demand	Anodyne	ADRB1	61	53
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819141128	EE	On-Demand	Anodyne	ADRB3	36	46
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819141129	EE	On-Demand	Anodyne	ADRB2	30	53
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819141129	EE	On-Demand	Anodyne	ADRB1	61	53
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819141129	EE	On-Demand	Anodyne	ADRB3	36	46
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819141130	EE	On-Demand	Anodyne	ADRB2	30	53
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819141130	EE	On-Demand	Anodyne	ADRB1	61	53
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819141130	EE	On-Demand	Anodyne	ADRB3	36	46
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819141131	EE	On-Demand	Anodyne	ADRB2	30	53
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819141131	EE	On-Demand	Anodyne	ADRB1	61	53
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819141131	EE	On-Demand	Anodyne	ADRB3	36	46
O=C1C[C@@H](NC[C@@H](O)c2cccnc2)CN1c1cccc(C(F)(F)F)c1	ZINC000819141150	FF	On-Demand	Anodyne	ADRB3	65	44
O=C1C[C@H](NC[C@@H](O)c2cccnc2)CN1c1cccc(C(F)(F)F)c1	ZINC000819141151	FF	On-Demand	Anodyne	ADRB3	65	44
O=C1C[C@H](NC[C@H](O)c2cccnc2)CN1c1cccc(C(F)(F)F)c1	ZINC000819141152	FF	On-Demand	Anodyne	ADRB3	65	44
O=C1C[C@@H](NC[C@H](O)c2cccnc2)CN1c1cccc(C(F)(F)F)c1	ZINC000819141153	FF	On-Demand	Anodyne	ADRB3	65	44
O=C(CCN1CCOCC1)Nc1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819141214	GE	On-Demand	Anodyne	CASR	35	42
O=C(CCN1CCOCC1)Nc1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819141214	GE	On-Demand	Anodyne	EPHX2	23	44
Cc1nc(SCC(=O)NNC(=O)CC2CC2)[nH]c1Cc1ccccc1	ZINC000819141235	FE	On-Demand	Reactive	GRIN2B	44	34
Cc1nc(SCC(=O)NNC(=O)CC2CC2)[nH]c1Cc1ccccc1	ZINC000819141235	FE	On-Demand	Reactive	ENPP1	62	35
O=C(CSc1ncnc2scc(-c3ccccc3)c12)NNC(=O)CC1CC1	ZINC000819141238	GG	On-Demand	Reactive	TGM2	15	43
C[C@H]1CC[C@@H](C)[C@@H]1NC[C@@H](O)c1ccc(Cl)cc1	ZINC000819141257	CG	On-Demand	Anodyne	ADRB3	18	45
C[C@H]1CC[C@H](C)C1NC[C@@H](O)c1ccc(Cl)cc1	ZINC000819141258	CG	On-Demand	Anodyne	ADRB3	18	45
C[C@@H]1CC[C@@H](C)C1NC[C@H](O)c1ccc(Cl)cc1	ZINC000819141259	CG	On-Demand	Anodyne	ADRB3	18	45
C[C@H]1CC[C@@H](C)[C@@H]1NC[C@H](O)c1ccc(Cl)cc1	ZINC000819141260	CG	On-Demand	Anodyne	ADRB3	18	45
C[C@@H]1CC[C@@H](C)C1NC[C@@H](O)c1ccc(Cl)cc1	ZINC000819141261	CG	On-Demand	Anodyne	ADRB3	18	45
C[C@H]1CC[C@H](C)C1NC[C@H](O)c1ccc(Cl)cc1	ZINC000819141262	CG	On-Demand	Anodyne	ADRB3	18	45
CCC1(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819141274	BD	On-Demand	Anodyne	ADRB2	22	44
CCC1(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819141274	BD	On-Demand	Anodyne	ADRB1	23	44
CCC1(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819141274	BD	On-Demand	Anodyne	ADRB3	90	44
CCC1(CNC[C@H](O)c2cccnc2)CC1	ZINC000819141275	BD	On-Demand	Anodyne	ADRB2	22	44
CCC1(CNC[C@H](O)c2cccnc2)CC1	ZINC000819141275	BD	On-Demand	Anodyne	ADRB1	23	44
CCC1(CNC[C@H](O)c2cccnc2)CC1	ZINC000819141275	BD	On-Demand	Anodyne	ADRB3	90	44
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819141298	EC	On-Demand	Reactive	CA2	142	54
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819141298	EC	On-Demand	Reactive	CA6	21	48
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819141298	EC	On-Demand	Reactive	CA1	122	48
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819141298	EC	On-Demand	Reactive	CA7	81	48
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819141298	EC	On-Demand	Reactive	CA13	30	48
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819141298	EC	On-Demand	Reactive	CA5B	59	45
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819141298	EC	On-Demand	Reactive	CA4	107	48
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819141298	EC	On-Demand	Reactive	CA5A	62	45
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819141298	EC	On-Demand	Reactive	CA14	62	42
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819141298	EC	On-Demand	Reactive	CA12	84	48
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819141298	EC	On-Demand	Reactive	CA9	95	50
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819141298	EC	On-Demand	Reactive	CAH_METTE	27	48
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819141298	EC	On-Demand	Reactive	CYNT	32	42
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819141298	EC	On-Demand	Reactive	NCE103	22	54
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819141298	EC	On-Demand	Reactive	CA15	15	48
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819141298	EC	On-Demand	Reactive	MTCA1	40	42
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819141298	EC	On-Demand	Reactive	P96878_MYCTU	52	42
NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819141298	EC	On-Demand	Reactive	A6YCJ1_9METZ	27	45
O=C(CC1CC1)NNC(=O)CC1(CNC(=O)OCc2ccccc2)CCCCC1	ZINC000819141300	HG	On-Demand	Reactive	CTSK	29	44
O=C(CC1CC1)NNC(=O)CC1(CNC(=O)OCc2ccccc2)CCCCC1	ZINC000819141300	HG	On-Demand	Reactive	PREP	20	41
O=C(CC1CC1)NNC(=O)CC1(CNC(=O)OCc2ccccc2)CCCCC1	ZINC000819141300	HG	On-Demand	Reactive	CAPNS1	41	31
O=C(CC1CC1)NNC(=O)CC1(CNC(=O)OCc2ccccc2)CCCCC1	ZINC000819141300	HG	On-Demand	Reactive	CAPN1	34	40
O=C(CC1CC1)NNC(=O)CC1(CNC(=O)OCc2ccccc2)CCCCC1	ZINC000819141300	HG	On-Demand	Reactive	CAPN2	46	38
O=C(CC1CC1)NNC(=O)CC1(CNC(=O)OCc2ccccc2)CCCCC1	ZINC000819141300	HG	On-Demand	Reactive	NPR	56	32
O=C(CC1CC1)NNC(=O)CC1(CNC(=O)OCc2ccccc2)CCCCC1	ZINC000819141300	HG	On-Demand	Reactive	SLC12A5	65	41
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819141301	FE	On-Demand	Anodyne	ADRB2	42	47
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819141301	FE	On-Demand	Anodyne	ADRB1	77	47
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819141301	FE	On-Demand	Anodyne	ADRB3	53	47
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819141301	FE	On-Demand	Anodyne	ABCB1	18	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819141303	FE	On-Demand	Anodyne	ADRB2	42	47
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819141303	FE	On-Demand	Anodyne	ADRB1	77	47
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819141303	FE	On-Demand	Anodyne	ADRB3	53	47
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819141303	FE	On-Demand	Anodyne	ABCB1	18	42
O=C(CC1CC1)NNC(=O)c1ccc(-c2ccc(Br)cc2)s1	ZINC000819141304	GH	On-Demand	Reactive	MAPK11	19	40
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819141305	FE	On-Demand	Anodyne	ADRB2	42	47
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819141305	FE	On-Demand	Anodyne	ADRB1	77	47
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819141305	FE	On-Demand	Anodyne	ADRB3	53	47
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819141305	FE	On-Demand	Anodyne	ABCB1	18	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819141307	FE	On-Demand	Anodyne	ADRB2	42	47
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819141307	FE	On-Demand	Anodyne	ADRB1	77	47
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819141307	FE	On-Demand	Anodyne	ADRB3	53	47
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819141307	FE	On-Demand	Anodyne	ABCB1	18	42
O=C(CC1CC1)NNC(=O)c1cccn2c(O)nnc12	ZINC000819141308	CB	On-Demand	Reactive	POLR1A	62	33
O=C(COc1ccc(C(=O)c2ccc(Cl)cc2)cc1)NNC(=O)CC1CC1	ZINC000819141312	GF	On-Demand	Reactive	LSS	18	44
O=C(COc1ccc(C(=O)c2ccc(Cl)cc2)cc1)NNC(=O)CC1CC1	ZINC000819141312	GF	On-Demand	Reactive	TRAR	31	48
C=CCC1(C(=O)Nc2cccc(COc3ccccc3)c2)CCOCC1	ZINC000819141324	FJ	On-Demand	Mild	ALOX5	23	40
C=CCC1(C(=O)Nc2cccc(COc3ccccc3)c2)CCOCC1	ZINC000819141324	FJ	On-Demand	Mild	DRTS_LEIMA	37	41
C=CCC1(C(=O)Nc2cccc(COc3ccccc3)c2)CCOCC1	ZINC000819141324	FJ	On-Demand	Mild	DYR_PNECA	17	41
C=CCC1(C(=O)Nc2cccc(COc3ccccc3)c2)CCOCC1	ZINC000819141324	FJ	On-Demand	Mild	FFAR1	41	42
C=CCC1(C(=O)Nc2cccc(COc3ccccc3)c2)CCOCC1	ZINC000819141324	FJ	On-Demand	Mild	LIMK2	19	42
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)CCn2ccnc2)c1	ZINC000819141326	FD	On-Demand	Reactive	KCNK3	49	36
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1CSCCS1	ZINC000819141329	FD	On-Demand	Anodyne	ADRB2	23	40
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1CSCCS1	ZINC000819141329	FD	On-Demand	Anodyne	ADRB1	27	41
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1CSCCS1	ZINC000819141330	FD	On-Demand	Anodyne	ADRB2	23	40
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1CSCCS1	ZINC000819141330	FD	On-Demand	Anodyne	ADRB1	27	41
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1CSCCS1	ZINC000819141331	FD	On-Demand	Anodyne	ADRB2	23	40
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1CSCCS1	ZINC000819141331	FD	On-Demand	Anodyne	ADRB1	27	41
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1CSCCS1	ZINC000819141332	FD	On-Demand	Anodyne	ADRB2	23	40
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1CSCCS1	ZINC000819141332	FD	On-Demand	Anodyne	ADRB1	27	41
CC[C@@H](NC[C@H](O)c1ccc(C(F)(F)F)cc1)C(=O)N1CCOCC1	ZINC000819141337	FD	On-Demand	Anodyne	MTTP	22	41
CC[C@@H](NC[C@H](O)c1ccc(C(F)(F)F)cc1)C(=O)N1CCOCC1	ZINC000819141337	FD	On-Demand	Anodyne	CTSS	15	41
CC[C@@H](NC[C@H](O)c1ccc(C(F)(F)F)cc1)C(=O)N1CCOCC1	ZINC000819141337	FD	On-Demand	Anodyne	EPHX2	23	44
CC[C@@H](CNCCC(=O)N(C)OC)Oc1cccc(F)c1	ZINC000819141338	CD	On-Demand	Anodyne	PDS	47	41
CC[C@@H](NC[C@@H](O)c1ccc(C(F)(F)F)cc1)C(=O)N1CCOCC1	ZINC000819141341	FD	On-Demand	Anodyne	MTTP	22	41
CC[C@@H](NC[C@@H](O)c1ccc(C(F)(F)F)cc1)C(=O)N1CCOCC1	ZINC000819141341	FD	On-Demand	Anodyne	CTSS	15	41
CC[C@@H](NC[C@@H](O)c1ccc(C(F)(F)F)cc1)C(=O)N1CCOCC1	ZINC000819141341	FD	On-Demand	Anodyne	EPHX2	23	44
O=C(/C=C/c1ccc(O)c(O)c1)NNC(=O)CC1CC1	ZINC000819141360	CD	On-Demand	Reactive	HDAC8	15	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCCN(C(=O)c2ccsc2)CC1	ZINC000819141362	GE	On-Demand	Anodyne	NPBWR1	88	33
O=C(/C=C\c1ccc(O)c(O)c1)NNC(=O)CC1CC1	ZINC000819141363	CD	On-Demand	Reactive	HDAC8	15	40
O[C@H](CNC[C@@H]1CSCCS1)COc1cccc2[nH]ccc12	ZINC000819141367	EE	On-Demand	Anodyne	ADRB2	15	58
O[C@H](CNC[C@@H]1CSCCS1)COc1cccc2[nH]ccc12	ZINC000819141367	EE	On-Demand	Anodyne	ADRB1	27	58
O[C@H](CNC[C@@H]1CSCCS1)COc1cccc2[nH]ccc12	ZINC000819141367	EE	On-Demand	Anodyne	HTR1A	16	58
O[C@H](CNC[C@@H]1CSCCS1)COc1cccc2[nH]ccc12	ZINC000819141367	EE	On-Demand	Anodyne	SLC6A4	19	41
O[C@H](CNC[C@H]1CSCCS1)COc1cccc2[nH]ccc12	ZINC000819141371	EE	On-Demand	Anodyne	ADRB2	15	58
O[C@H](CNC[C@H]1CSCCS1)COc1cccc2[nH]ccc12	ZINC000819141371	EE	On-Demand	Anodyne	ADRB1	27	58
O[C@H](CNC[C@H]1CSCCS1)COc1cccc2[nH]ccc12	ZINC000819141371	EE	On-Demand	Anodyne	HTR1A	16	58
O[C@H](CNC[C@H]1CSCCS1)COc1cccc2[nH]ccc12	ZINC000819141371	EE	On-Demand	Anodyne	SLC6A4	19	41
COc1ccc(C(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)c2ccccc12	ZINC000819141372	HF	On-Demand	Reactive	CHRM2	18	40
COc1ccc(C(=O)N2CCC(C(=O)NNC(=O)CC3CC3)CC2)c2ccccc12	ZINC000819141372	HF	On-Demand	Reactive	L3MBTL3	28	45
O[C@@H](CNC[C@@H]1CSCCS1)COc1cccc2[nH]ccc12	ZINC000819141373	EE	On-Demand	Anodyne	ADRB2	15	58
O[C@@H](CNC[C@@H]1CSCCS1)COc1cccc2[nH]ccc12	ZINC000819141373	EE	On-Demand	Anodyne	ADRB1	27	58
O[C@@H](CNC[C@@H]1CSCCS1)COc1cccc2[nH]ccc12	ZINC000819141373	EE	On-Demand	Anodyne	HTR1A	16	58
O[C@@H](CNC[C@@H]1CSCCS1)COc1cccc2[nH]ccc12	ZINC000819141373	EE	On-Demand	Anodyne	SLC6A4	19	41
O[C@@H](CNC[C@H]1CSCCS1)COc1cccc2[nH]ccc12	ZINC000819141375	EE	On-Demand	Anodyne	ADRB2	15	58
O[C@@H](CNC[C@H]1CSCCS1)COc1cccc2[nH]ccc12	ZINC000819141375	EE	On-Demand	Anodyne	ADRB1	27	58
O[C@@H](CNC[C@H]1CSCCS1)COc1cccc2[nH]ccc12	ZINC000819141375	EE	On-Demand	Anodyne	HTR1A	16	58
O[C@@H](CNC[C@H]1CSCCS1)COc1cccc2[nH]ccc12	ZINC000819141375	EE	On-Demand	Anodyne	SLC6A4	19	41
O=C(CC1CC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000819141403	HD	On-Demand	Reactive	PRTN3	47	34
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CSCCS2)c1	ZINC000819141413	EE	On-Demand	Anodyne	ADRB2	31	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CSCCS2)c1	ZINC000819141413	EE	On-Demand	Anodyne	ADRB1	59	38
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CSCCS2)c1	ZINC000819141413	EE	On-Demand	Anodyne	ABCB1	18	45
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)c1	ZINC000819141416	EE	On-Demand	Anodyne	ADRB2	31	42
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)c1	ZINC000819141416	EE	On-Demand	Anodyne	ADRB1	59	38
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)c1	ZINC000819141416	EE	On-Demand	Anodyne	ABCB1	18	45
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CSCCS2)c1	ZINC000819141417	EE	On-Demand	Anodyne	ADRB2	31	42
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CSCCS2)c1	ZINC000819141417	EE	On-Demand	Anodyne	ADRB1	59	38
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CSCCS2)c1	ZINC000819141417	EE	On-Demand	Anodyne	ABCB1	18	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CSCCS2)c1	ZINC000819141418	EE	On-Demand	Anodyne	ADRB2	31	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CSCCS2)c1	ZINC000819141418	EE	On-Demand	Anodyne	ADRB1	59	38
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CSCCS2)c1	ZINC000819141418	EE	On-Demand	Anodyne	ABCB1	18	45
O[C@@H](CNCc1nccn1CCCc1ccccc1)c1ccc(Cl)cc1	ZINC000819141439	FH	On-Demand	Anodyne	ADRB3	20	42
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccccc1Cl	ZINC000819141449	GG	On-Demand	Reactive	PDE4D	16	47
COc1cc(C(=O)NNC(=O)CC2CC2)ccc1OCc1ccccc1Cl	ZINC000819141449	GG	On-Demand	Reactive	ADCYAP1R1	43	39
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1C(=O)C(F)(F)F	ZINC000819141461	DC	On-Demand	Reactive	CELA1	44	35
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)C(F)(F)F	ZINC000819141462	DC	On-Demand	Reactive	CELA1	44	35
O=C(COc1ccc2cc(Br)ccc2c1)NNC(=O)CC1CC1	ZINC000819141463	GF	On-Demand	Reactive	NCEH1	17	40
O=C(COc1ccc2cc(Br)ccc2c1)NNC(=O)CC1CC1	ZINC000819141463	GF	On-Demand	Reactive	TRAR	41	45
CC[C@@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1CCOCC1	ZINC000819141467	ED	On-Demand	Anodyne	ADRB1	32	46
CC[C@@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1CCOCC1	ZINC000819141467	ED	On-Demand	Anodyne	ADRB3	51	46
CC[C@@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1CCOCC1	ZINC000819141467	ED	On-Demand	Anodyne	IGF1R	29	42
CC[C@@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1CCOCC1	ZINC000819141467	ED	On-Demand	Anodyne	CYP3A4	50	39
CC[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C(=O)N1CCOCC1	ZINC000819141470	ED	On-Demand	Anodyne	ADRB1	32	46
CC[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C(=O)N1CCOCC1	ZINC000819141470	ED	On-Demand	Anodyne	ADRB3	51	46
CC[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C(=O)N1CCOCC1	ZINC000819141470	ED	On-Demand	Anodyne	IGF1R	29	42
CC[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C(=O)N1CCOCC1	ZINC000819141470	ED	On-Demand	Anodyne	CYP3A4	50	39
O[C@H](CNCc1csc(CCc2ccccc2)n1)c1ccc(F)cn1	ZINC000819141477	FG	On-Demand	Anodyne	ADRB3	17	43
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1ccc(F)cn1	ZINC000819141478	FG	On-Demand	Anodyne	ADRB3	17	43
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1cccc(F)c1	ZINC000819141505	FH	On-Demand	Anodyne	ADRB2	25	41
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1cccc(F)c1	ZINC000819141505	FH	On-Demand	Anodyne	ADRB1	27	42
O[C@@H](CNCc1csc(CCc2ccccc2)n1)c1cccc(F)c1	ZINC000819141505	FH	On-Demand	Anodyne	ADRB3	59	47
O=C(CC1CC1)NNC(=O)c1cccc(Nc2ccccc2)c1	ZINC000819141506	DF	On-Demand	Reactive	AKR1C3	32	51
O=C(CC1CC1)NNC(=O)c1cccc(Nc2ccccc2)c1	ZINC000819141506	DF	On-Demand	Reactive	KCNK3	73	38
O[C@H](CNCc1csc(CCc2ccccc2)n1)c1cccc(F)c1	ZINC000819141507	FH	On-Demand	Anodyne	ADRB2	25	41
O[C@H](CNCc1csc(CCc2ccccc2)n1)c1cccc(F)c1	ZINC000819141507	FH	On-Demand	Anodyne	ADRB1	27	42
O[C@H](CNCc1csc(CCc2ccccc2)n1)c1cccc(F)c1	ZINC000819141507	FH	On-Demand	Anodyne	ADRB3	59	47
O=[N+]([O-])c1cccc([C@@H](O)CNCc2csc(CCc3ccccc3)n2)c1	ZINC000819141513	GH	On-Demand	Bother	ADRB3	59	47
O=[N+]([O-])c1cccc([C@H](O)CNCc2csc(CCc3ccccc3)n2)c1	ZINC000819141515	GH	On-Demand	Bother	ADRB3	59	47
O=C(CC1CC1)NNC(=O)c1nn(-c2ccc(Cl)cc2)c2c1CCCCC2	ZINC000819141516	GG	On-Demand	Reactive	CNR1	53	33
O=C(CC1CC1)NNC(=O)c1nn(-c2ccc(Cl)cc2)c2c1CCCCC2	ZINC000819141516	GG	On-Demand	Reactive	GABRA2	15	40
CC(=O)Nc1cccc(CC(=O)N2CCCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819141528	GF	On-Demand	Anodyne	TGM2	20	41
CC(=O)Nc1cccc(CC(=O)N2CCCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819141528	GF	On-Demand	Anodyne	F13A1	33	41
CC(=O)Nc1cccc(CC(=O)N2CCCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819141528	GF	On-Demand	Anodyne	GPR119	39	45
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)N1CCCCC1	ZINC000819141552	FF	On-Demand	Mild	PAPA1_CARPA	41	51
CO[C@@H]1C[C@@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1(C)C	ZINC000819141555	FE	On-Demand	Anodyne	GPR119	21	41
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)N1CCCCC1	ZINC000819141556	FF	On-Demand	Mild	PAPA1_CARPA	41	51
CO[C@@H]1C[C@@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1(C)C	ZINC000819141557	FE	On-Demand	Anodyne	GPR119	21	41
Cc1ccc(N2CCCN(C(=O)Cc3nsc4ccccc34)CC2)cc1	ZINC000819141558	FH	On-Demand	Anodyne	HTR1A	19	40
Cc1ccc(N2CCCN(C(=O)Cc3nsc4ccccc34)CC2)cc1	ZINC000819141558	FH	On-Demand	Anodyne	DRD2	23	40
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)c1	ZINC000819141584	GI	On-Demand	Anodyne	HTR1A	15	43
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)c1	ZINC000819141584	GI	On-Demand	Anodyne	DRD2	19	41
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)c1	ZINC000819141584	GI	On-Demand	Anodyne	CNR1	50	31
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)c1	ZINC000819141584	GI	On-Demand	Anodyne	HTR1D	21	41
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)c1	ZINC000819141584	GI	On-Demand	Anodyne	HTR1B	24	41
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)c1	ZINC000819141584	GI	On-Demand	Anodyne	OPRK1	19	47
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)c1	ZINC000819141584	GI	On-Demand	Anodyne	KCNQ2	77	53
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)c1	ZINC000819141584	GI	On-Demand	Anodyne	NPY2R	95	57
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)c1	ZINC000819141584	GI	On-Demand	Anodyne	TAAR1	35	46
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)c1	ZINC000819141584	GI	On-Demand	Anodyne	IMDH_CRYPV	29	40
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)c1	ZINC000819141584	GI	On-Demand	Anodyne	RORC	31	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3nc(C)no3)CC1)C2	ZINC000819141613	FD	On-Demand	Anodyne	ETHR	52	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3nc(C)no3)CC1)C2	ZINC000819141615	FD	On-Demand	Anodyne	ETHR	52	33
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(NC(=O)N2CCCC2)c1	ZINC000819141625	EF	On-Demand	Anodyne	P2RY14	44	34
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(NC(=O)N2CCCC2)c1	ZINC000819141627	EF	On-Demand	Anodyne	P2RY14	44	34
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(NC(=O)N2CCCC2)c1	ZINC000819141630	EF	On-Demand	Anodyne	P2RY14	44	34
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(NC(=O)N2CCCC2)c1	ZINC000819141632	EF	On-Demand	Anodyne	P2RY14	44	34
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccc(Br)cc1	ZINC000819141666	FG	On-Demand	Anodyne	ADRB1	31	40
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccc(Br)cc1	ZINC000819141670	FG	On-Demand	Anodyne	ADRB1	31	40
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccc(Br)cc1	ZINC000819141672	FG	On-Demand	Anodyne	ADRB1	31	40
O[C@@H](CNC[C@@H]1CSCCS1)c1cccnc1	ZINC000819141674	CD	On-Demand	Anodyne	ADRB2	21	41
O[C@@H](CNC[C@@H]1CSCCS1)c1cccnc1	ZINC000819141674	CD	On-Demand	Anodyne	ADRB1	23	41
O[C@@H](CNC[C@@H]1CSCCS1)c1cccnc1	ZINC000819141674	CD	On-Demand	Anodyne	ADRB3	92	44
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccc(Br)cc1	ZINC000819141675	FG	On-Demand	Anodyne	ADRB1	31	40
O[C@H](CNC[C@H]1CSCCS1)c1cccnc1	ZINC000819141678	CD	On-Demand	Anodyne	ADRB2	21	41
O[C@H](CNC[C@H]1CSCCS1)c1cccnc1	ZINC000819141678	CD	On-Demand	Anodyne	ADRB1	23	41
O[C@H](CNC[C@H]1CSCCS1)c1cccnc1	ZINC000819141678	CD	On-Demand	Anodyne	ADRB3	92	44
O[C@@H](CNC[C@H]1CSCCS1)c1cccnc1	ZINC000819141680	CD	On-Demand	Anodyne	ADRB2	21	41
O[C@@H](CNC[C@H]1CSCCS1)c1cccnc1	ZINC000819141680	CD	On-Demand	Anodyne	ADRB1	23	41
O[C@@H](CNC[C@H]1CSCCS1)c1cccnc1	ZINC000819141680	CD	On-Demand	Anodyne	ADRB3	92	44
O[C@H](CNC[C@@H]1CSCCS1)c1cccnc1	ZINC000819141682	CD	On-Demand	Anodyne	ADRB2	21	41
O[C@H](CNC[C@@H]1CSCCS1)c1cccnc1	ZINC000819141682	CD	On-Demand	Anodyne	ADRB1	23	41
O[C@H](CNC[C@@H]1CSCCS1)c1cccnc1	ZINC000819141682	CD	On-Demand	Anodyne	ADRB3	92	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCN(c3ccc(C)cc3)CC1)C2	ZINC000819141683	GF	On-Demand	Anodyne	ADAM10	35	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCN(c3ccc(C)cc3)CC1)C2	ZINC000819141687	GF	On-Demand	Anodyne	ADAM10	35	43
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141695	GH	On-Demand	Anodyne	DRD4	23	48
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141695	GH	On-Demand	Anodyne	ACHE	18	42
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141695	GH	On-Demand	Anodyne	CHRM3	17	46
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141695	GH	On-Demand	Anodyne	SIGMAR1	22	58
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141695	GH	On-Demand	Anodyne	SSTR5	44	37
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141695	GH	On-Demand	Anodyne	CCR3	25	41
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141695	GH	On-Demand	Anodyne	CCR2	75	46
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141695	GH	On-Demand	Anodyne	SLC6A5	31	43
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141695	GH	On-Demand	Anodyne	CXCR3	15	43
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141695	GH	On-Demand	Anodyne	MCHR1	43	41
CCC(=O)N1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819141697	GE	On-Demand	Mild	PAPA1_CARPA	34	45
CCC(=O)N1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819141697	GE	On-Demand	Mild	CTSK	15	42
CC[C@@H](CNC[C@@H](O)c1ccc(F)cn1)Oc1cccc(F)c1	ZINC000819141698	DF	On-Demand	Anodyne	PDS	33	41
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141699	GH	On-Demand	Anodyne	DRD4	23	48
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141699	GH	On-Demand	Anodyne	ACHE	18	42
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141699	GH	On-Demand	Anodyne	CHRM3	17	46
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141699	GH	On-Demand	Anodyne	SIGMAR1	22	58
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141699	GH	On-Demand	Anodyne	SSTR5	44	37
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141699	GH	On-Demand	Anodyne	CCR3	25	41
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141699	GH	On-Demand	Anodyne	CCR2	75	46
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141699	GH	On-Demand	Anodyne	SLC6A5	31	43
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141699	GH	On-Demand	Anodyne	CXCR3	15	43
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141699	GH	On-Demand	Anodyne	MCHR1	43	41
CCC(=O)N1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819141700	GE	On-Demand	Mild	PAPA1_CARPA	34	45
CCC(=O)N1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819141700	GE	On-Demand	Mild	CTSK	15	42
CC[C@@H](CNC[C@H](O)c1ccc(F)cn1)Oc1cccc(F)c1	ZINC000819141701	DF	On-Demand	Anodyne	PDS	33	41
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141702	GH	On-Demand	Anodyne	DRD4	23	48
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141702	GH	On-Demand	Anodyne	ACHE	18	42
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141702	GH	On-Demand	Anodyne	CHRM3	17	46
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141702	GH	On-Demand	Anodyne	SIGMAR1	22	58
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141702	GH	On-Demand	Anodyne	SSTR5	44	37
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141702	GH	On-Demand	Anodyne	CCR3	25	41
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141702	GH	On-Demand	Anodyne	CCR2	75	46
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141702	GH	On-Demand	Anodyne	SLC6A5	31	43
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141702	GH	On-Demand	Anodyne	CXCR3	15	43
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141702	GH	On-Demand	Anodyne	MCHR1	43	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141706	GH	On-Demand	Anodyne	DRD4	23	48
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141706	GH	On-Demand	Anodyne	ACHE	18	42
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141706	GH	On-Demand	Anodyne	CHRM3	17	46
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141706	GH	On-Demand	Anodyne	SIGMAR1	22	58
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141706	GH	On-Demand	Anodyne	SSTR5	44	37
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141706	GH	On-Demand	Anodyne	CCR3	25	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141706	GH	On-Demand	Anodyne	CCR2	75	46
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141706	GH	On-Demand	Anodyne	SLC6A5	31	43
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141706	GH	On-Demand	Anodyne	CXCR3	15	43
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819141706	GH	On-Demand	Anodyne	MCHR1	43	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(-c3ccccc3)cn1)C2	ZINC000819141742	FH	On-Demand	Anodyne	LUCI_LUCLA	36	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(-c3ccccc3)cn1)C2	ZINC000819141745	FH	On-Demand	Anodyne	LUCI_LUCLA	36	42
O=C(Cc1nsc2ccccc12)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819141757	FI	On-Demand	Anodyne	KCNQ2	60	41
O=C(Cc1nsc2ccccc12)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819141757	FI	On-Demand	Anodyne	NPY2R	101	42
O=C(Cc1nsc2ccccc12)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819141757	FI	On-Demand	Anodyne	IMDH_CRYPV	28	43
C[C@@H]1CC[C@@H](C)C1NC[C@@H](O)CCc1ccccc1	ZINC000819141759	CG	On-Demand	Anodyne	SLC18A2	48	38
C[C@H]1CC[C@@H](C)[C@@H]1NC[C@@H](O)CCc1ccccc1	ZINC000819141761	CG	On-Demand	Anodyne	SLC18A2	48	38
C[C@@H]1CC[C@@H](C)C1NC[C@H](O)CCc1ccccc1	ZINC000819141763	CG	On-Demand	Anodyne	SLC18A2	48	38
C[C@H]1CC[C@@H](C)[C@@H]1NC[C@H](O)CCc1ccccc1	ZINC000819141765	CG	On-Demand	Anodyne	SLC18A2	48	38
CC[C@@H](NC[C@H](O)c1cccc2ccccc12)C(=O)N1CCOCC1	ZINC000819141782	EE	On-Demand	Anodyne	TRY2_BOVIN	62	40
CC[C@@H](NC[C@H](O)c1cccc2ccccc12)C(=O)N1CCOCC1	ZINC000819141782	EE	On-Demand	Anodyne	ADCY5	16	40
CC[C@@H](NC[C@H](O)c1cccc2ccccc12)C(=O)N1CCOCC1	ZINC000819141782	EE	On-Demand	Anodyne	PTGDS	31	40
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccc(Cl)cc1	ZINC000819141820	DG	On-Demand	Anodyne	ADRB1	31	40
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccc(Cl)cc1	ZINC000819141821	DG	On-Demand	Anodyne	ADRB1	31	40
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccc(Cl)cc1	ZINC000819141823	DG	On-Demand	Anodyne	ADRB1	31	40
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccc(Cl)cc1	ZINC000819141824	DG	On-Demand	Anodyne	ADRB1	31	40
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2ccccc2Cl)CC1	ZINC000819141850	GF	On-Demand	Anodyne	HTR4	41	36
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2ccccc2Cl)CC1	ZINC000819141850	GF	On-Demand	Anodyne	CACNA1I	69	53
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2ccc(F)cc2F)CC1	ZINC000819141851	GE	On-Demand	Anodyne	CACNA1I	62	49
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2ccc(F)cc2F)CC1	ZINC000819141852	GE	On-Demand	Anodyne	CACNA1I	62	49
NC(=O)CCNC1CCC(N2CCCCC2)CC1	ZINC000819141878	CD	On-Demand	Anodyne	DPP7	15	42
NC(=O)CCNC1CCC(N2CCCCC2)CC1	ZINC000819141878	CD	On-Demand	Anodyne	L3MBTL3	58	37
CC[C@@H](CNCCS(C)(=O)=O)Oc1cccc(F)c1	ZINC000819141905	CD	On-Demand	Anodyne	PDS	41	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccccc1Cn1cncn1)C2	ZINC000819141910	FE	On-Demand	Anodyne	HIS3	45	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccccc1Cn1cncn1)C2	ZINC000819141911	FE	On-Demand	Anodyne	HIS3	45	34
CC[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819141923	EG	On-Demand	Bother	ADRB1	16	40
CC[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819141923	EG	On-Demand	Bother	ADRB3	21	40
CC[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819141923	EG	On-Demand	Bother	CACNA1D	54	36
CC[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819141923	EG	On-Demand	Bother	PDS	15	42
CC[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819141925	EG	On-Demand	Bother	ADRB1	16	40
CC[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819141925	EG	On-Demand	Bother	ADRB3	21	40
CC[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819141925	EG	On-Demand	Bother	CACNA1D	54	36
CC[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)Oc1cccc(F)c1	ZINC000819141925	EG	On-Demand	Bother	PDS	15	42
O[C@@H](CNC[C@@H]1CSCCS1)COc1cccc(C(F)(F)F)c1	ZINC000819141926	FF	On-Demand	Anodyne	ADRB1	23	42
O[C@@H](CNC[C@@H]1CSCCS1)COc1cccc(C(F)(F)F)c1	ZINC000819141926	FF	On-Demand	Anodyne	PDS	43	37
O[C@@H](CNC[C@H]1CSCCS1)COc1cccc(C(F)(F)F)c1	ZINC000819141927	FF	On-Demand	Anodyne	ADRB1	23	42
O[C@@H](CNC[C@H]1CSCCS1)COc1cccc(C(F)(F)F)c1	ZINC000819141927	FF	On-Demand	Anodyne	PDS	43	37
O[C@H](CNC[C@H]1CSCCS1)COc1cccc(C(F)(F)F)c1	ZINC000819141928	FF	On-Demand	Anodyne	ADRB1	23	42
O[C@H](CNC[C@H]1CSCCS1)COc1cccc(C(F)(F)F)c1	ZINC000819141928	FF	On-Demand	Anodyne	PDS	43	37
O[C@H](CNC[C@@H]1CSCCS1)COc1cccc(C(F)(F)F)c1	ZINC000819141929	FF	On-Demand	Anodyne	ADRB1	23	42
O[C@H](CNC[C@@H]1CSCCS1)COc1cccc(C(F)(F)F)c1	ZINC000819141929	FF	On-Demand	Anodyne	PDS	43	37
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1F	ZINC000819141983	FF	On-Demand	Anodyne	ADRB2	39	52
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1F	ZINC000819141983	FF	On-Demand	Anodyne	ADRB1	33	52
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1F	ZINC000819141983	FF	On-Demand	Anodyne	ADRB3	26	50
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1F	ZINC000819141983	FF	On-Demand	Anodyne	ABCB1	33	50
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1F	ZINC000819141984	FF	On-Demand	Anodyne	ADRB2	39	52
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1F	ZINC000819141984	FF	On-Demand	Anodyne	ADRB1	33	52
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1F	ZINC000819141984	FF	On-Demand	Anodyne	ADRB3	26	50
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1F	ZINC000819141984	FF	On-Demand	Anodyne	ABCB1	33	50
CC(C)(C)NC(=O)CN1CCC(CNCCS(C)(=O)=O)CC1	ZINC000819141987	EC	On-Demand	Anodyne	CACNA1H	17	42
CC(C)(C)NC(=O)CN1CCC(CNCCS(C)(=O)=O)CC1	ZINC000819141987	EC	On-Demand	Anodyne	CACNA1I	46	51
C=CCCn1cc(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819141988	FE	On-Demand	Mild	CCKAR	31	43
N#Cc1ccc([C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142005	EF	On-Demand	Mild	L3MBTL3	43	33
N#Cc1ccc([C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142006	EF	On-Demand	Mild	L3MBTL3	43	33
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc(Cl)cc1	ZINC000819142032	FG	On-Demand	Anodyne	ADRB2	33	46
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc(Cl)cc1	ZINC000819142032	FG	On-Demand	Anodyne	ADRB1	50	49
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc(Cl)cc1	ZINC000819142032	FG	On-Demand	Anodyne	ADRB3	38	45
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc(Cl)cc1	ZINC000819142032	FG	On-Demand	Anodyne	EBP	17	41
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc(Cl)cc1	ZINC000819142033	FG	On-Demand	Anodyne	ADRB2	33	46
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc(Cl)cc1	ZINC000819142033	FG	On-Demand	Anodyne	ADRB1	50	49
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc(Cl)cc1	ZINC000819142033	FG	On-Demand	Anodyne	ADRB3	38	45
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc(Cl)cc1	ZINC000819142033	FG	On-Demand	Anodyne	EBP	17	41
O[C@@H](CNCc1nccn1CCc1ccccc1)c1ccc(Cl)cc1	ZINC000819142044	FH	On-Demand	Anodyne	ADRB1	24	43
O[C@@H](CNCc1nccn1CCc1ccccc1)c1ccc(Cl)cc1	ZINC000819142044	FH	On-Demand	Anodyne	ADRB3	38	43
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819142046	FG	On-Demand	Anodyne	ADRB2	32	45
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819142046	FG	On-Demand	Anodyne	ADRB1	47	41
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819142046	FG	On-Demand	Anodyne	ADRB3	39	45
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819142046	FG	On-Demand	Anodyne	ACOX1	44	32
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819142046	FG	On-Demand	Anodyne	ABCB1	34	46
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819142046	FG	On-Demand	Anodyne	L3MBTL3	63	38
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819142048	FG	On-Demand	Anodyne	ADRB2	32	45
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819142048	FG	On-Demand	Anodyne	ADRB1	47	41
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819142048	FG	On-Demand	Anodyne	ADRB3	39	45
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819142048	FG	On-Demand	Anodyne	ACOX1	44	32
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819142048	FG	On-Demand	Anodyne	ABCB1	34	46
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819142048	FG	On-Demand	Anodyne	L3MBTL3	63	38
CC[C@@H](CNC[C@@H](O)C1CC1)Oc1cccc(F)c1	ZINC000819142052	CE	On-Demand	Anodyne	PDS	25	41
CC[C@@H](CNC[C@H](O)C1CC1)Oc1cccc(F)c1	ZINC000819142056	CE	On-Demand	Anodyne	PDS	25	41
COc1ccc(N2CCCN(C(=O)[C@H]3CCCC[C@H]3C)CC2)cc1	ZINC000819142068	EH	On-Demand	Clean	SSTR1	40	37
COc1ccc(N2CCCN(C(=O)[C@H]3CCCC[C@H]3C)CC2)cc1	ZINC000819142068	EH	On-Demand	Clean	NPBWR1	85	36
COc1ccc(N2CCCN(C(=O)[C@H]3CCCC[C@@H]3C)CC2)cc1	ZINC000819142072	EH	On-Demand	Clean	SSTR1	40	37
COc1ccc(N2CCCN(C(=O)[C@H]3CCCC[C@@H]3C)CC2)cc1	ZINC000819142072	EH	On-Demand	Clean	NPBWR1	85	36
COc1ccc(N2CCCN(C(=O)[C@@H]3CCCC[C@@H]3C)CC2)cc1	ZINC000819142074	EH	On-Demand	Clean	SSTR1	40	37
COc1ccc(N2CCCN(C(=O)[C@@H]3CCCC[C@@H]3C)CC2)cc1	ZINC000819142074	EH	On-Demand	Clean	NPBWR1	85	36
COc1ccc(N2CCCN(C(=O)[C@@H]3CCCC[C@H]3C)CC2)cc1	ZINC000819142078	EH	On-Demand	Clean	SSTR1	40	37
COc1ccc(N2CCCN(C(=O)[C@@H]3CCCC[C@H]3C)CC2)cc1	ZINC000819142078	EH	On-Demand	Clean	NPBWR1	85	36
COc1ccc(N2CCCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819142081	GF	On-Demand	Clean	HTR1A	19	44
COc1ccc(N2CCCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819142081	GF	On-Demand	Clean	TSHR	40	31
COc1ccc(N2CCCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819142081	GF	On-Demand	Clean	DRD4	44	37
COc1ccc(N2CCCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819142081	GF	On-Demand	Clean	HTR1B	32	42
COc1ccc(N2CCCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819142081	GF	On-Demand	Clean	MMP13	20	40
COc1ccc(N2CCCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819142081	GF	On-Demand	Clean	CCR3	15	41
COc1ccc(N2CCCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819142081	GF	On-Demand	Clean	MMP3	18	40
COc1ccc(N2CCCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819142081	GF	On-Demand	Clean	MMP9	23	40
COc1ccc(N2CCCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819142081	GF	On-Demand	Clean	MMP1	23	40
O=C(CCN1C(=O)NC2(CCCC2)C1=O)OCc1ccc(C(=O)O)cc1	ZINC000819142083	FD	On-Demand	Anodyne	SLC12A5	58	33
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142091	GF	On-Demand	Bother	ADRB2	34	48
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142091	GF	On-Demand	Bother	ADRB1	26	48
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142091	GF	On-Demand	Bother	ADRA1D	32	43
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142091	GF	On-Demand	Bother	ADRA1A	23	43
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142091	GF	On-Demand	Bother	ADRA1B	26	43
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142091	GF	On-Demand	Bother	ADRB3	23	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142091	GF	On-Demand	Bother	ABCB1	29	49
O=C(CCN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819142093	EE	On-Demand	Anodyne	SLC6A1	163	48
O=C(CCN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819142093	EE	On-Demand	Anodyne	KCNQ2	50	38
O=C(CCN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819142093	EE	On-Demand	Anodyne	CCR3	17	47
O=C(CCN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819142093	EE	On-Demand	Anodyne	RBP4	91	40
O=C(CCN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819142093	EE	On-Demand	Anodyne	CACNA1G	40	36
O=C(CCN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819142093	EE	On-Demand	Anodyne	CYP2J2	44	31
O=C(CCN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819142093	EE	On-Demand	Anodyne	SFRP1	62	41
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142094	GF	On-Demand	Bother	ADRB2	34	48
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142094	GF	On-Demand	Bother	ADRB1	26	48
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142094	GF	On-Demand	Bother	ADRA1D	32	43
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142094	GF	On-Demand	Bother	ADRA1A	23	43
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142094	GF	On-Demand	Bother	ADRA1B	26	43
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142094	GF	On-Demand	Bother	ADRB3	23	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142094	GF	On-Demand	Bother	ABCB1	29	49
O=C(CCN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819142098	EE	On-Demand	Anodyne	SLC6A1	163	48
O=C(CCN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819142098	EE	On-Demand	Anodyne	KCNQ2	50	38
O=C(CCN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819142098	EE	On-Demand	Anodyne	CCR3	17	47
O=C(CCN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819142098	EE	On-Demand	Anodyne	RBP4	91	40
O=C(CCN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819142098	EE	On-Demand	Anodyne	CACNA1G	40	36
O=C(CCN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819142098	EE	On-Demand	Anodyne	CYP2J2	44	31
O=C(CCN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819142098	EE	On-Demand	Anodyne	SFRP1	62	41
CC[C@@H](CNC[C@@H](O)c1ccccc1F)Oc1cccc(F)c1	ZINC000819142102	DG	On-Demand	Anodyne	PDS	66	43
O=C(CCNC(=O)c1ccc(F)cc1)OCc1ccc(C(=O)O)cc1	ZINC000819142103	EE	On-Demand	Anodyne	GCGR	52	36
CC[C@@H](CNC[C@H](O)c1ccccc1F)Oc1cccc(F)c1	ZINC000819142106	DG	On-Demand	Anodyne	PDS	66	43
O=C(CCN1CCOCC1)NCc1ccc(C(=O)O)cc1	ZINC000819142118	CC	On-Demand	Anodyne	CNR2	16	42
O=C(CCN1CCOCC1)NCc1ccc(C(=O)O)cc1	ZINC000819142118	CC	On-Demand	Anodyne	HTR7	20	42
O=C(CCN1CCOCC1)NCc1ccc(C(=O)O)cc1	ZINC000819142118	CC	On-Demand	Anodyne	EPHX2	21	44
O=C(CCN1CCOCC1)NCc1ccc(C(=O)O)cc1	ZINC000819142118	CC	On-Demand	Anodyne	TPSAB1	16	42
O=C(CCN1CCOCC1)NCc1ccc(C(=O)O)cc1	ZINC000819142118	CC	On-Demand	Anodyne	DPOL_VZVD	23	40
O=C(CCN1CCOCC1)NCc1ccc(C(=O)O)cc1	ZINC000819142118	CC	On-Demand	Anodyne	CYP2J2	47	34
O=C(CCN1CCOCC1)NCc1ccc(C(=O)O)cc1	ZINC000819142118	CC	On-Demand	Anodyne	HPGDS	24	42
O=C(CCCc1nc2ccccc2[nH]1)NCc1ccc(C(=O)O)cc1	ZINC000819142120	EF	On-Demand	Anodyne	ACHE	35	40
O=C(CCCc1nc2ccccc2[nH]1)NCc1ccc(C(=O)O)cc1	ZINC000819142120	EF	On-Demand	Anodyne	BCHE	48	38
O=C(CCCc1nc2ccccc2[nH]1)NCc1ccc(C(=O)O)cc1	ZINC000819142120	EF	On-Demand	Anodyne	HDAC1	15	41
O=C(CCCc1nc2ccccc2[nH]1)NCc1ccc(C(=O)O)cc1	ZINC000819142120	EF	On-Demand	Anodyne	PIN1	25	41
O=C(CCCc1nc2ccccc2[nH]1)NCc1ccc(C(=O)O)cc1	ZINC000819142120	EF	On-Demand	Anodyne	PARP3	24	41
O=C(CCCc1nc2ccccc2[nH]1)NCc1ccc(C(=O)O)cc1	ZINC000819142120	EF	On-Demand	Anodyne	SUCNR1	31	43
O=C(CCN1CC[C@H](C(=O)O)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000819142122	DD	On-Demand	Bother	SLC6A1	154	40
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142123	GF	On-Demand	Anodyne	ADRB2	50	56
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142123	GF	On-Demand	Anodyne	ADRB1	84	56
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142123	GF	On-Demand	Anodyne	ADRB3	61	46
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142123	GF	On-Demand	Anodyne	L3MBTL3	51	33
O=C(CCN1CC[C@@H](C(=O)O)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000819142126	DD	On-Demand	Bother	SLC6A1	154	40
O=C(CCCNC(=O)c1cccnc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819142127	ED	On-Demand	Anodyne	FOLH1	28	41
O=C(CCCNC(=O)c1cccnc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819142127	ED	On-Demand	Anodyne	TBXA2R	35	41
O=C(CCCNC(=O)c1cccnc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819142127	ED	On-Demand	Anodyne	TBXAS1	84	42
O=C(CCCNC(=O)c1cccnc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819142127	ED	On-Demand	Anodyne	PTAFR	26	45
O=C(CCCNC(=O)c1cccnc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819142127	ED	On-Demand	Anodyne	KCNA5	20	40
O=C(CCCNC(=O)c1cccnc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819142127	ED	On-Demand	Anodyne	C3AR1	55	39
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142128	GF	On-Demand	Anodyne	ADRB2	50	56
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142128	GF	On-Demand	Anodyne	ADRB1	84	56
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142128	GF	On-Demand	Anodyne	ADRB3	61	46
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142128	GF	On-Demand	Anodyne	L3MBTL3	51	33
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1c(F)cccc1F	ZINC000819142131	EG	On-Demand	Anodyne	L3MBTL3	69	35
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1c(F)cccc1F	ZINC000819142133	EG	On-Demand	Anodyne	L3MBTL3	69	35
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1	ZINC000819142135	EF	On-Demand	Anodyne	ADRB2	48	51
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1	ZINC000819142135	EF	On-Demand	Anodyne	ADRB1	67	51
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1	ZINC000819142135	EF	On-Demand	Anodyne	ADRB3	53	51
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1	ZINC000819142135	EF	On-Demand	Anodyne	ABCB1	28	48
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1	ZINC000819142135	EF	On-Demand	Anodyne	L3MBTL3	48	37
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1	ZINC000819142137	EF	On-Demand	Anodyne	ADRB2	48	51
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1	ZINC000819142137	EF	On-Demand	Anodyne	ADRB1	67	51
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1	ZINC000819142137	EF	On-Demand	Anodyne	ADRB3	53	51
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1	ZINC000819142137	EF	On-Demand	Anodyne	ABCB1	28	48
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccccc1	ZINC000819142137	EF	On-Demand	Anodyne	L3MBTL3	48	37
O=C(CCCNC(=O)c1cccnc1)NC1(C(=O)O)CCCC1	ZINC000819142139	DD	On-Demand	Anodyne	TBXA2R	36	40
O=C(CCCNC(=O)c1cccnc1)NC1(C(=O)O)CCCC1	ZINC000819142139	DD	On-Demand	Anodyne	TBXAS1	73	41
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819142144	GD	On-Demand	Bother	CACNA1I	49	46
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819142146	GD	On-Demand	Bother	CACNA1I	49	46
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819142155	FE	On-Demand	Anodyne	SLC6A3	30	45
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819142155	FE	On-Demand	Anodyne	CACNA1I	58	49
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819142157	FE	On-Demand	Anodyne	SLC6A3	30	45
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819142157	FE	On-Demand	Anodyne	CACNA1I	58	49
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccccc1OC(C)C)C2	ZINC000819142158	FF	On-Demand	Anodyne	P2RX7	33	43
O=C(CCNC(=O)c1ccco1)OCc1ccc(C(=O)O)cc1	ZINC000819142159	DD	On-Demand	Anodyne	NPR	43	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccccc1OC(C)C)C2	ZINC000819142160	FF	On-Demand	Anodyne	P2RX7	33	43
O=C(CCCN1C(=O)CCC1=O)OCc1ccc(C(=O)O)cc1	ZINC000819142168	DD	On-Demand	Anodyne	PTGER4	47	37
O=C(CCCN1C(=O)CCC1=O)OCc1ccc(C(=O)O)cc1	ZINC000819142168	DD	On-Demand	Anodyne	CYP2J2	43	31
O=C(CCCn1ccnc1)NC1(C(=O)O)CCCCC1	ZINC000819142171	CD	On-Demand	Anodyne	TBXAS1	53	60
O=C(CCCn1ccnc1)NC1(C(=O)O)CCCCC1	ZINC000819142171	CD	On-Demand	Anodyne	QPCT	41	41
O=C(CCN1CCC[C@@H]1C(=O)O)Nc1ccccc1C(F)(F)F	ZINC000819142175	EF	On-Demand	Anodyne	KCNQ2	53	38
O=C(CCN1CCC[C@@H]1C(=O)O)Nc1ccccc1C(F)(F)F	ZINC000819142175	EF	On-Demand	Anodyne	P2RX7	38	40
O=C(CCN1CCC[C@@H]1C(=O)O)Nc1ccccc1C(F)(F)F	ZINC000819142175	EF	On-Demand	Anodyne	RBP4	89	40
O=C(CCN1CCC[C@@H]1C(=O)O)Nc1ccccc1C(F)(F)F	ZINC000819142175	EF	On-Demand	Anodyne	SFRP1	101	39
O=C(CCN1CCC[C@@H]1C(=O)O)Nc1ccccc1C(F)(F)F	ZINC000819142175	EF	On-Demand	Anodyne	WNT3	76	39
O=C(CCN1CCC[C@H]1C(=O)O)Nc1ccccc1C(F)(F)F	ZINC000819142177	EF	On-Demand	Anodyne	KCNQ2	53	38
O=C(CCN1CCC[C@H]1C(=O)O)Nc1ccccc1C(F)(F)F	ZINC000819142177	EF	On-Demand	Anodyne	P2RX7	38	40
O=C(CCN1CCC[C@H]1C(=O)O)Nc1ccccc1C(F)(F)F	ZINC000819142177	EF	On-Demand	Anodyne	RBP4	89	40
O=C(CCN1CCC[C@H]1C(=O)O)Nc1ccccc1C(F)(F)F	ZINC000819142177	EF	On-Demand	Anodyne	SFRP1	101	39
O=C(CCN1CCC[C@H]1C(=O)O)Nc1ccccc1C(F)(F)F	ZINC000819142177	EF	On-Demand	Anodyne	WNT3	76	39
O=C(CCN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CC1	ZINC000819142180	ED	On-Demand	Anodyne	DRD2	15	43
O=C(CCN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CC1	ZINC000819142180	ED	On-Demand	Anodyne	DRD4	24	44
O=C(CCN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CC1	ZINC000819142180	ED	On-Demand	Anodyne	SLC6A1	162	42
O=C(CCN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CC1	ZINC000819142180	ED	On-Demand	Anodyne	SIGMAR1	17	43
O=C(CCN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CC1	ZINC000819142181	ED	On-Demand	Anodyne	DRD2	15	43
O=C(CCN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CC1	ZINC000819142181	ED	On-Demand	Anodyne	DRD4	24	44
O=C(CCN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CC1	ZINC000819142181	ED	On-Demand	Anodyne	SLC6A1	162	42
O=C(CCN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CC1	ZINC000819142181	ED	On-Demand	Anodyne	SIGMAR1	17	43
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142198	ED	On-Demand	Mild	ADRB2	34	42
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142198	ED	On-Demand	Mild	ADRB1	63	42
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142198	ED	On-Demand	Mild	ADRB3	41	42
O=C(CCCc1ccccc1)NNC(=O)N1CCO[C@@H](C(=O)O)C1	ZINC000819142202	EC	On-Demand	Reactive	PREP	49	42
N#CCc1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142203	ED	On-Demand	Mild	ADRB2	34	42
N#CCc1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142203	ED	On-Demand	Mild	ADRB1	63	42
N#CCc1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142203	ED	On-Demand	Mild	ADRB3	41	42
O=C(CCCc1ccccc1)NNC(=O)N1CCO[C@H](C(=O)O)C1	ZINC000819142205	EC	On-Demand	Reactive	PREP	49	42
N#CCc1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142206	ED	On-Demand	Mild	ADRB2	34	42
N#CCc1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142206	ED	On-Demand	Mild	ADRB1	63	42
N#CCc1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142206	ED	On-Demand	Mild	ADRB3	41	42
N#CCc1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142207	ED	On-Demand	Mild	ADRB2	34	42
N#CCc1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142207	ED	On-Demand	Mild	ADRB1	63	42
N#CCc1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142207	ED	On-Demand	Mild	ADRB3	41	42
O=C(CCCNC(=O)c1cccnc1)NCc1ccc(C(=O)O)cc1	ZINC000819142208	ED	On-Demand	Anodyne	TBXA2R	48	48
O=C(CCCNC(=O)c1cccnc1)NCc1ccc(C(=O)O)cc1	ZINC000819142208	ED	On-Demand	Anodyne	TBXAS1	101	48
O=C(CCCNC(=O)c1cccnc1)NCc1ccc(C(=O)O)cc1	ZINC000819142208	ED	On-Demand	Anodyne	PTAFR	24	48
O=C(CCCNC(=O)c1cccnc1)NCc1ccc(C(=O)O)cc1	ZINC000819142208	ED	On-Demand	Anodyne	HDAC1	19	44
O=C(CCCNC(=O)c1cccnc1)NCc1ccc(C(=O)O)cc1	ZINC000819142208	ED	On-Demand	Anodyne	HDAC6	17	42
O=C(CCCNC(=O)c1cccnc1)NCc1ccc(C(=O)O)cc1	ZINC000819142208	ED	On-Demand	Anodyne	NAMPT	83	41
O=C(CCN1CCC(C(=O)O)CC1)Nc1ccccc1C(F)(F)F	ZINC000819142211	EF	On-Demand	Anodyne	SLC6A1	82	41
O=C(CCN1CCC(C(=O)O)CC1)Nc1ccccc1C(F)(F)F	ZINC000819142211	EF	On-Demand	Anodyne	KCNQ2	57	39
O=C(CCN1CCC(C(=O)O)CC1)Nc1ccccc1C(F)(F)F	ZINC000819142211	EF	On-Demand	Anodyne	SIGMAR1	20	47
O=C(CCN1CCC(C(=O)O)CC1)Nc1ccccc1C(F)(F)F	ZINC000819142211	EF	On-Demand	Anodyne	PRCP	21	42
O=C(CCN1CCC(C(=O)O)CC1)Nc1ccccc1C(F)(F)F	ZINC000819142211	EF	On-Demand	Anodyne	CCR3	26	51
O=C(CCN1CCC(C(=O)O)CC1)Nc1ccccc1C(F)(F)F	ZINC000819142211	EF	On-Demand	Anodyne	CCR2	27	40
O=C(CCN1CCC(C(=O)O)CC1)Nc1ccccc1C(F)(F)F	ZINC000819142211	EF	On-Demand	Anodyne	EPHX2	16	42
O=C(CCN1CCC(C(=O)O)CC1)Nc1ccccc1C(F)(F)F	ZINC000819142211	EF	On-Demand	Anodyne	RBP4	91	41
O=C(CCN1CCC(C(=O)O)CC1)Nc1ccccc1C(F)(F)F	ZINC000819142211	EF	On-Demand	Anodyne	CACNA1G	46	39
O=C(CCN1CCC(C(=O)O)CC1)Nc1ccccc1C(F)(F)F	ZINC000819142211	EF	On-Demand	Anodyne	CYP2J2	45	32
O=C(CCN1CCC(C(=O)O)CC1)Nc1ccccc1C(F)(F)F	ZINC000819142211	EF	On-Demand	Anodyne	SFRP1	86	44
O=C(CCN1CCC(C(=O)O)CC1)Nc1ccccc1C(F)(F)F	ZINC000819142211	EF	On-Demand	Anodyne	WNT3	48	33
O=C(CCNS(=O)(=O)c1ccccc1)OCc1ccc(C(=O)O)cc1	ZINC000819142214	FD	On-Demand	Anodyne	CA2	22	46
O=C(CCNS(=O)(=O)c1ccccc1)OCc1ccc(C(=O)O)cc1	ZINC000819142214	FD	On-Demand	Anodyne	TBXA2R	45	37
O=C(CCNS(=O)(=O)c1ccccc1)OCc1ccc(C(=O)O)cc1	ZINC000819142214	FD	On-Demand	Anodyne	CA1	20	46
O=C(CCNS(=O)(=O)c1ccccc1)OCc1ccc(C(=O)O)cc1	ZINC000819142214	FD	On-Demand	Anodyne	CA4	17	46
O=C(CCCNS(=O)(=O)c1ccc(F)cc1)NC1(C(=O)O)CCCC1	ZINC000819142216	FD	On-Demand	Anodyne	TBXA2R	44	39
O=C(CCN1C(=O)COc2ccccc21)OCc1ccc(C(=O)O)cc1	ZINC000819142231	FE	On-Demand	Anodyne	PTGER4	42	35
O=C(CCN1C(=O)COc2ccccc21)OCc1ccc(C(=O)O)cc1	ZINC000819142231	FE	On-Demand	Anodyne	CYP2J2	44	32
O=C(CCCOc1ccc2c(c1)OCO2)NC1(C(=O)O)CCCC1	ZINC000819142233	EE	On-Demand	Anodyne	EDNRB	74	40
O=C(CCCOc1ccc2c(c1)OCO2)NC1(C(=O)O)CCCC1	ZINC000819142233	EE	On-Demand	Anodyne	EDNRA	72	42
O=C(CCCOc1ccc2c(c1)OCO2)NC1(C(=O)O)CCCC1	ZINC000819142233	EE	On-Demand	Anodyne	LTB4R	29	40
O=C(CCCOc1ccc2c(c1)OCO2)NC1(C(=O)O)CCCC1	ZINC000819142233	EE	On-Demand	Anodyne	LTB4R2	44	38
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142237	FD	On-Demand	Anodyne	ADRB2	44	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142237	FD	On-Demand	Anodyne	ADRB1	83	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142237	FD	On-Demand	Anodyne	ADRB3	54	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142238	FD	On-Demand	Anodyne	ADRB2	44	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142238	FD	On-Demand	Anodyne	ADRB1	83	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142238	FD	On-Demand	Anodyne	ADRB3	54	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142239	FD	On-Demand	Anodyne	ADRB2	44	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142239	FD	On-Demand	Anodyne	ADRB1	83	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142239	FD	On-Demand	Anodyne	ADRB3	54	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142241	FD	On-Demand	Anodyne	ADRB2	44	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142241	FD	On-Demand	Anodyne	ADRB1	83	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142241	FD	On-Demand	Anodyne	ADRB3	54	54
O=C(CCN1CC[C@H](C(=O)O)C1)NC1CCCC1	ZINC000819142243	CC	On-Demand	Anodyne	SLC6A1	139	39
O=C(CCN1CC[C@H](C(=O)O)C1)NC1CCCC1	ZINC000819142243	CC	On-Demand	Anodyne	EPHX2	15	40
O=C(CCN1CC[C@@H](C(=O)O)C1)NC1CCCC1	ZINC000819142244	CC	On-Demand	Anodyne	SLC6A1	139	39
O=C(CCN1CC[C@@H](C(=O)O)C1)NC1CCCC1	ZINC000819142244	CC	On-Demand	Anodyne	EPHX2	15	40
O=C(CCN1CC[C@@H](C(=O)O)C1)NN1C(=O)NC2(CCCCC2)C1=O	ZINC000819142247	FC	On-Demand	Anodyne	SLC6A1	151	38
O=C(CCN1CC[C@H](C(=O)O)C1)NN1C(=O)NC2(CCCCC2)C1=O	ZINC000819142254	FC	On-Demand	Anodyne	SLC6A1	151	38
O=C(CCNS(=O)(=O)c1cccnc1)OCc1ccc(C(=O)O)cc1	ZINC000819142262	FD	On-Demand	Anodyne	TBXA2R	44	46
O=C(CCNS(=O)(=O)c1cccnc1)OCc1ccc(C(=O)O)cc1	ZINC000819142262	FD	On-Demand	Anodyne	TBXAS1	84	47
O=C(CCNS(=O)(=O)c1cccnc1)OCc1ccc(C(=O)O)cc1	ZINC000819142262	FD	On-Demand	Anodyne	NAMPT	38	47
O=C(CCN1C(=O)CCC1=O)OCc1ccc(C(=O)O)cc1	ZINC000819142266	DC	On-Demand	Anodyne	PTGER4	47	37
O=C(CCN1CC[C@@H](C(=O)O)C1)Nc1ccc(N2CCCC2=O)cc1	ZINC000819142270	ED	On-Demand	Anodyne	SLC6A1	151	37
O=C(CCN1CC[C@H](C(=O)O)C1)Nc1ccc(N2CCCC2=O)cc1	ZINC000819142273	ED	On-Demand	Anodyne	SLC6A1	151	37
O=C(CC[C@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142275	DB	On-Demand	Anodyne	ACE	64	55
O=C(CC[C@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142275	DB	On-Demand	Anodyne	OPRM1	18	41
O=C(CC[C@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142275	DB	On-Demand	Anodyne	MME	124	45
O=C(CC[C@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142275	DB	On-Demand	Anodyne	ANPEP	59	37
O=C(CC[C@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142275	DB	On-Demand	Anodyne	CMA1	17	43
O=C(CC[C@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142275	DB	On-Demand	Anodyne	CTSB	17	40
O=C(CC[C@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142275	DB	On-Demand	Anodyne	CPA1	60	42
O=C(CC[C@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142275	DB	On-Demand	Anodyne	TIMP3	74	35
O=C(CC[C@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142275	DB	On-Demand	Anodyne	NAALAD2	31	45
O=C(CC[C@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142275	DB	On-Demand	Anodyne	ECE1	50	39
O=C(CC[C@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142275	DB	On-Demand	Anodyne	CAPN1	27	42
O=C(CC[C@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142275	DB	On-Demand	Anodyne	MMP9	15	41
O=C(CC[C@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142275	DB	On-Demand	Anodyne	CAPN2	15	40
O=C(CC[C@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142275	DB	On-Demand	Anodyne	ACE2	98	45
O=C(CC[C@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142275	DB	On-Demand	Anodyne	FPR1	71	39
O=C(CC[C@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142275	DB	On-Demand	Anodyne	BLA1_STEMA	77	50
O=C(CC[C@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142275	DB	On-Demand	Anodyne	BRCA1	45	34
O=C(CC[C@@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142277	DB	On-Demand	Anodyne	ACE	64	55
O=C(CC[C@@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142277	DB	On-Demand	Anodyne	OPRM1	18	41
O=C(CC[C@@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142277	DB	On-Demand	Anodyne	MME	124	45
O=C(CC[C@@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142277	DB	On-Demand	Anodyne	ANPEP	59	37
O=C(CC[C@@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142277	DB	On-Demand	Anodyne	CMA1	17	43
O=C(CC[C@@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142277	DB	On-Demand	Anodyne	CTSB	17	40
O=C(CC[C@@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142277	DB	On-Demand	Anodyne	CPA1	60	42
O=C(CC[C@@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142277	DB	On-Demand	Anodyne	TIMP3	74	35
O=C(CC[C@@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142277	DB	On-Demand	Anodyne	NAALAD2	31	45
O=C(CC[C@@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142277	DB	On-Demand	Anodyne	ECE1	50	39
O=C(CC[C@@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142277	DB	On-Demand	Anodyne	CAPN1	27	42
O=C(CC[C@@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142277	DB	On-Demand	Anodyne	MMP9	15	41
O=C(CC[C@@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142277	DB	On-Demand	Anodyne	CAPN2	15	40
O=C(CC[C@@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142277	DB	On-Demand	Anodyne	ACE2	98	45
O=C(CC[C@@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142277	DB	On-Demand	Anodyne	FPR1	71	39
O=C(CC[C@@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142277	DB	On-Demand	Anodyne	BLA1_STEMA	77	50
O=C(CC[C@@H]1NC(=O)NC1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142277	DB	On-Demand	Anodyne	BRCA1	45	34
O=C(CCCc1nnc(-c2ccccc2)o1)N[C@H](C(=O)O)c1ccccc1	ZINC000819142279	FG	On-Demand	Anodyne	C3AR1	54	38
O=C(CCCc1nnc(-c2ccccc2)o1)N[C@H](C(=O)O)c1ccccc1	ZINC000819142279	FG	On-Demand	Anodyne	NAALAD2	19	41
O=C(CCCc1nnc(-c2ccccc2)o1)N[C@H](C(=O)O)c1ccccc1	ZINC000819142279	FG	On-Demand	Anodyne	CES1	17	41
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	ACE	67	58
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	OPRM1	23	41
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	OPRD1	22	41
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	FOLH1	30	40
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	MME	141	50
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	ANPEP	70	38
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	CMA1	33	45
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	FCER2	42	32
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	CTSB	29	42
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	PAPA1_CARPA	41	34
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	CYSP_TRYCR	45	33
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	CPA1	58	45
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	NPFFR2	46	33
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	HDAC10	18	43
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	NAALAD2	34	50
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	MMP2	23	46
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	MMP3	31	50
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	MMP8	15	50
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	ALDH1A1	52	39
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	ECE1	42	43
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	CAPN1	60	43
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	MMP9	32	51
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	ACE2	104	50
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	MMP7	22	44
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	MMP1	31	51
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	FPR1	75	40
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	BLA1_STEMA	81	45
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	BRCA1	57	39
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819142282	GD	On-Demand	Anodyne	NPFFR1	58	39
O=C(CCCc1nnc(-c2ccccc2)o1)NCc1ccc(C(=O)O)cc1	ZINC000819142284	FG	On-Demand	Anodyne	FAAH	30	42
O=C(CCCc1nnc(-c2ccccc2)o1)NCc1ccc(C(=O)O)cc1	ZINC000819142284	FG	On-Demand	Anodyne	FURIN	43	34
O=C(CCCc1nnc(-c2ccccc2)o1)NCc1ccc(C(=O)O)cc1	ZINC000819142284	FG	On-Demand	Anodyne	CES1	26	42
O=C(CCCc1nnc(-c2ccccc2)o1)NCc1ccc(C(=O)O)cc1	ZINC000819142284	FG	On-Demand	Anodyne	PTPN22	29	41
O=C(CCCc1nnc(-c2ccccc2)o1)NCc1ccc(C(=O)O)cc1	ZINC000819142284	FG	On-Demand	Anodyne	TNKS	20	42
O=C(CCCc1nnc(-c2ccccc2)o1)NCc1ccc(C(=O)O)cc1	ZINC000819142284	FG	On-Demand	Anodyne	SUCNR1	52	44
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](C(=O)O)c1ccccc1	ZINC000819142286	FE	On-Demand	Anodyne	NAALAD2	21	45
O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@H](C(=O)O)c1ccccc1	ZINC000819142286	FE	On-Demand	Anodyne	MMP9	16	40
O=C(CCN1CCO[C@@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819142302	ED	On-Demand	Anodyne	RBP4	85	41
O=C(CCN1CCO[C@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819142304	ED	On-Demand	Anodyne	RBP4	85	41
O=C(CC[C@H]1NC(=O)NC1=O)N[C@H](C(=O)O)c1ccccc1	ZINC000819142315	DB	On-Demand	Anodyne	NAALAD2	19	40
O=C(CC[C@H]1NC(=O)NC1=O)N[C@H](C(=O)O)c1ccccc1	ZINC000819142315	DB	On-Demand	Anodyne	GSTP1	17	43
O=C(CC[C@@H]1NC(=O)NC1=O)N[C@H](C(=O)O)c1ccccc1	ZINC000819142317	DB	On-Demand	Anodyne	NAALAD2	19	40
O=C(CC[C@@H]1NC(=O)NC1=O)N[C@H](C(=O)O)c1ccccc1	ZINC000819142317	DB	On-Demand	Anodyne	GSTP1	17	43
O=C(CCC1CCOCC1)OCc1ccc(C(=O)O)cc1	ZINC000819142320	CF	On-Demand	Anodyne	CYP2J2	45	32
O=C(CCNC(=O)c1ccc(F)cc1)NC1(C(=O)O)CCCCC1	ZINC000819142323	ED	On-Demand	Anodyne	NTSR2	18	41
O=C(CCCc1cccs1)NNC(=O)N1CCO[C@@H](C(=O)O)C1	ZINC000819142325	EC	On-Demand	Reactive	PTPRF	22	49
O=C(CCCc1cccs1)NNC(=O)N1CCO[C@H](C(=O)O)C1	ZINC000819142327	EC	On-Demand	Reactive	PTPRF	22	49
O=C(CCN1CC[C@@H](C(=O)O)C1)NC(=O)NCC(F)(F)F	ZINC000819142337	DC	On-Demand	Anodyne	SLC6A1	66	32
O=C(CCN1CC[C@H](C(=O)O)C1)NC(=O)NCC(F)(F)F	ZINC000819142339	DC	On-Demand	Anodyne	SLC6A1	66	32
O=C(CCN1CC[C@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819142340	ED	On-Demand	Anodyne	SLC6A1	140	37
O=C(CCN1CC[C@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819142340	ED	On-Demand	Anodyne	MTOR	70	37
O=C(CCN1CC[C@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819142340	ED	On-Demand	Anodyne	EPHX2	23	47
O=C(CCN1CC[C@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819142340	ED	On-Demand	Anodyne	TERT	17	42
O=C(CCN1CC[C@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819142340	ED	On-Demand	Anodyne	STAT6	52	33
O=C(CCN1CC[C@@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819142343	ED	On-Demand	Anodyne	SLC6A1	140	37
O=C(CCN1CC[C@@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819142343	ED	On-Demand	Anodyne	MTOR	70	37
O=C(CCN1CC[C@@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819142343	ED	On-Demand	Anodyne	EPHX2	23	47
O=C(CCN1CC[C@@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819142343	ED	On-Demand	Anodyne	TERT	17	42
O=C(CCN1CC[C@@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819142343	ED	On-Demand	Anodyne	STAT6	52	33
O=C(CCCNC(=O)c1cccnc1)NC1(C(=O)O)CCCCC1	ZINC000819142347	ED	On-Demand	Anodyne	TBXAS1	70	41
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819142370	EE	On-Demand	Anodyne	ADRB2	27	42
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819142370	EE	On-Demand	Anodyne	ADRB1	42	37
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819142370	EE	On-Demand	Anodyne	ADRB3	22	46
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819142371	EE	On-Demand	Anodyne	ADRB2	27	42
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819142371	EE	On-Demand	Anodyne	ADRB1	42	37
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819142371	EE	On-Demand	Anodyne	ADRB3	22	46
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819142372	EE	On-Demand	Anodyne	ADRB2	27	42
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819142372	EE	On-Demand	Anodyne	ADRB1	42	37
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCc3[nH]ccc32)cc1	ZINC000819142372	EE	On-Demand	Anodyne	ADRB3	22	46
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819142373	EE	On-Demand	Anodyne	ADRB2	27	42
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819142373	EE	On-Demand	Anodyne	ADRB1	42	37
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000819142373	EE	On-Demand	Anodyne	ADRB3	22	46
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(NC(=O)CCN2CCOCC2)c1	ZINC000819142375	GD	On-Demand	Anodyne	EPHX2	20	42
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(NC(=O)CCN2CCOCC2)c1	ZINC000819142376	GD	On-Demand	Anodyne	EPHX2	20	42
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(NC(=O)CCN2CCOCC2)c1	ZINC000819142377	GD	On-Demand	Anodyne	EPHX2	20	42
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(NC(=O)CCN2CCOCC2)c1	ZINC000819142378	GD	On-Demand	Anodyne	EPHX2	20	42
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccccc1Cl	ZINC000819142394	DG	On-Demand	Anodyne	ADRB2	18	47
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccccc1Cl	ZINC000819142394	DG	On-Demand	Anodyne	ADRB1	23	47
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccccc1Cl	ZINC000819142395	DG	On-Demand	Anodyne	ADRB2	18	47
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccccc1Cl	ZINC000819142395	DG	On-Demand	Anodyne	ADRB1	23	47
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccccc1Cl	ZINC000819142396	DG	On-Demand	Anodyne	ADRB2	18	47
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccccc1Cl	ZINC000819142396	DG	On-Demand	Anodyne	ADRB1	23	47
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccccc1Cl	ZINC000819142397	DG	On-Demand	Anodyne	ADRB2	18	47
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccccc1Cl	ZINC000819142397	DG	On-Demand	Anodyne	ADRB1	23	47
C=CCC1(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)CCOCC1	ZINC000819142407	FG	On-Demand	Mild	DRD4	38	54
C=CCC1(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)CCOCC1	ZINC000819142407	FG	On-Demand	Mild	ACHE	24	47
C=CCC1(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)CCOCC1	ZINC000819142407	FG	On-Demand	Mild	HRH2	27	40
C=CCC1(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)CCOCC1	ZINC000819142407	FG	On-Demand	Mild	KCNH2	16	49
C=CCC1(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)CCOCC1	ZINC000819142407	FG	On-Demand	Mild	SIGMAR1	42	56
C=CCC1(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)CCOCC1	ZINC000819142407	FG	On-Demand	Mild	SSTR5	69	36
C=CCC1(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)CCOCC1	ZINC000819142407	FG	On-Demand	Mild	MMP13	18	47
C=CCC1(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)CCOCC1	ZINC000819142407	FG	On-Demand	Mild	CCR3	46	45
C=CCC1(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)CCOCC1	ZINC000819142407	FG	On-Demand	Mild	FAAH	25	44
C=CCC1(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)CCOCC1	ZINC000819142407	FG	On-Demand	Mild	PDK1	51	39
C=CCC1(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)CCOCC1	ZINC000819142407	FG	On-Demand	Mild	MCHR1	54	55
C=CCC1(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)CCOCC1	ZINC000819142407	FG	On-Demand	Mild	CACNA1G	21	41
C=CCC1(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)CCOCC1	ZINC000819142407	FG	On-Demand	Mild	CCR8	30	49
C#CCNC(=O)CCN[C@@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1	ZINC000819142408	FD	On-Demand	Mild	CCR2	51	35
C#CCNC(=O)CCN[C@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1	ZINC000819142409	FD	On-Demand	Mild	CCR2	51	35
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccc(F)cc1	ZINC000819142412	DF	On-Demand	Anodyne	ADRB2	23	42
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccc(F)cc1	ZINC000819142412	DF	On-Demand	Anodyne	ADRB1	34	42
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccc(F)cc1	ZINC000819142413	DF	On-Demand	Anodyne	ADRB2	23	42
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccc(F)cc1	ZINC000819142413	DF	On-Demand	Anodyne	ADRB1	34	42
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccc(F)cc1	ZINC000819142414	DF	On-Demand	Anodyne	ADRB2	23	42
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1ccc(F)cc1	ZINC000819142414	DF	On-Demand	Anodyne	ADRB1	34	42
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccc(F)cc1	ZINC000819142415	DF	On-Demand	Anodyne	ADRB2	23	42
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1ccc(F)cc1	ZINC000819142415	DF	On-Demand	Anodyne	ADRB1	34	42
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc2ccccc12	ZINC000819142416	EH	On-Demand	Anodyne	ADRB2	23	53
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc2ccccc12	ZINC000819142416	EH	On-Demand	Anodyne	ADRB1	23	53
O[C@@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc2ccccc12	ZINC000819142416	EH	On-Demand	Anodyne	CYP2D6	15	44
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc2ccccc12	ZINC000819142417	EH	On-Demand	Anodyne	ADRB2	23	53
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc2ccccc12	ZINC000819142417	EH	On-Demand	Anodyne	ADRB1	23	53
O[C@@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc2ccccc12	ZINC000819142417	EH	On-Demand	Anodyne	CYP2D6	15	44
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc2ccccc12	ZINC000819142418	EH	On-Demand	Anodyne	ADRB2	23	53
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc2ccccc12	ZINC000819142418	EH	On-Demand	Anodyne	ADRB1	23	53
O[C@H](CN[C@@H]1CCCc2[nH]ccc21)COc1cccc2ccccc12	ZINC000819142418	EH	On-Demand	Anodyne	CYP2D6	15	44
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc2ccccc12	ZINC000819142419	EH	On-Demand	Anodyne	ADRB2	23	53
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc2ccccc12	ZINC000819142419	EH	On-Demand	Anodyne	ADRB1	23	53
O[C@H](CN[C@H]1CCCc2[nH]ccc21)COc1cccc2ccccc12	ZINC000819142419	EH	On-Demand	Anodyne	CYP2D6	15	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(N3CCCC3)c(F)c1)C2	ZINC000819142420	GG	On-Demand	Anodyne	NPY2R	78	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(N3CCCC3)c(F)c1)C2	ZINC000819142421	GG	On-Demand	Anodyne	NPY2R	78	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819142431	FG	On-Demand	Anodyne	NPY2R	95	41
O[C@@H](CNCc1nccn1CCc1ccccc1)c1cccc(C(F)(F)F)c1	ZINC000819142480	GH	On-Demand	Anodyne	ADRB3	40	38
O[C@H](CNCc1nccn1CCc1ccccc1)c1cccc(C(F)(F)F)c1	ZINC000819142481	GH	On-Demand	Anodyne	ADRB3	40	38
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1ccccc1Br	ZINC000819142482	GH	On-Demand	Anodyne	L3MBTL3	57	36
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1ccccc1Br	ZINC000819142483	GH	On-Demand	Anodyne	L3MBTL3	57	36
Cc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)c(C)c1	ZINC000819142485	FG	On-Demand	Anodyne	ADRB2	29	45
Cc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)c(C)c1	ZINC000819142485	FG	On-Demand	Anodyne	ADRB1	21	43
Cc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)c(C)c1	ZINC000819142485	FG	On-Demand	Anodyne	ABCB1	17	42
Cc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)c(C)c1	ZINC000819142486	FG	On-Demand	Anodyne	ADRB2	29	45
Cc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)c(C)c1	ZINC000819142486	FG	On-Demand	Anodyne	ADRB1	21	43
Cc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)c(C)c1	ZINC000819142486	FG	On-Demand	Anodyne	ABCB1	17	42
CC(=O)Nc1cccc(CC(=O)NCC2CCCCCCC2)c1	ZINC000819142488	DH	On-Demand	Anodyne	CCR3	53	37
CC(=O)Nc1cccc(CC(=O)NCC2CCCCCCC2)c1	ZINC000819142488	DH	On-Demand	Anodyne	CACNA1I	52	38
CC(=O)Nc1cccc(CC(=O)NCC2CCCCCCC2)c1	ZINC000819142488	DH	On-Demand	Anodyne	KCNK3	53	40
CC(=O)Nc1cccc(CC(=O)NCC2CCCCCCC2)c1	ZINC000819142488	DH	On-Demand	Anodyne	KCNK9	43	33
CCOc1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142504	EE	On-Demand	Anodyne	ADRB2	42	41
CCOc1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142504	EE	On-Demand	Anodyne	ADRB1	59	41
CCOc1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142504	EE	On-Demand	Anodyne	ADRB3	38	41
CCOc1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142506	EE	On-Demand	Anodyne	ADRB2	42	41
CCOc1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142506	EE	On-Demand	Anodyne	ADRB1	59	41
CCOc1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142506	EE	On-Demand	Anodyne	ADRB3	38	41
CCOc1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142507	EE	On-Demand	Anodyne	ADRB2	42	41
CCOc1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142507	EE	On-Demand	Anodyne	ADRB1	59	41
CCOc1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142507	EE	On-Demand	Anodyne	ADRB3	38	41
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142508	EE	On-Demand	Anodyne	ADRB2	42	41
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142508	EE	On-Demand	Anodyne	ADRB1	59	41
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142508	EE	On-Demand	Anodyne	ADRB3	38	41
CNC(=O)[C@@H](C)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819142535	GF	On-Demand	Anodyne	CTSD	20	43
CNC(=O)[C@@H](C)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819142535	GF	On-Demand	Anodyne	CTSK	19	52
CNC(=O)[C@@H](C)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819142535	GF	On-Demand	Anodyne	ECE1	28	43
CNC(=O)[C@@H](C)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819142535	GF	On-Demand	Anodyne	REN	56	45
CNC(=O)[C@@H](C)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819142539	GF	On-Demand	Anodyne	CTSD	20	43
CNC(=O)[C@@H](C)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819142539	GF	On-Demand	Anodyne	CTSK	19	52
CNC(=O)[C@@H](C)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819142539	GF	On-Demand	Anodyne	ECE1	28	43
CNC(=O)[C@@H](C)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819142539	GF	On-Demand	Anodyne	REN	56	45
Cc1noc(C2CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC2)n1	ZINC000819142552	GF	On-Demand	Mild	ETHR	54	35
Cc1noc(C2CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC2)n1	ZINC000819142554	GF	On-Demand	Mild	ETHR	54	35
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819142557	GG	On-Demand	Anodyne	DRD4	22	41
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819142557	GG	On-Demand	Anodyne	HTR4	66	38
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819142557	GG	On-Demand	Anodyne	CACNA1I	51	48
COC(=O)c1ccc(CCNC(=O)C2CCN(S(=O)(=O)c3cccnc3Cl)CC2)cc1	ZINC000819142593	JE	On-Demand	Anodyne	EPHX2	37	49
COC(=O)c1ccc(CCNC(=O)C2CCN(S(=O)(=O)c3cccnc3Cl)CC2)cc1	ZINC000819142593	JE	On-Demand	Anodyne	GPBAR1	21	47
O=C1c2ccccc2C(=O)N1C[C@@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142598	GE	On-Demand	Anodyne	L3MBTL3	61	36
O=C1c2ccccc2C(=O)N1C[C@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142599	GE	On-Demand	Anodyne	L3MBTL3	61	36
O=C(CCNC1CCC(N2CCCCC2)CC1)Nc1ccccc1	ZINC000819142600	EG	On-Demand	Anodyne	L3MBTL3	91	40
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819142630	GI	On-Demand	Anodyne	CNR1	51	32
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819142630	GI	On-Demand	Anodyne	HTR1D	16	40
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819142630	GI	On-Demand	Anodyne	HTR1B	15	40
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819142630	GI	On-Demand	Anodyne	KCNQ2	48	46
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819142630	GI	On-Demand	Anodyne	NPY2R	60	53
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1C(F)(F)F	ZINC000819142653	FH	On-Demand	Anodyne	ADRB1	21	42
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1ccccc1C(F)(F)F	ZINC000819142653	FH	On-Demand	Anodyne	ADRB3	78	42
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1C(F)(F)F	ZINC000819142654	FH	On-Demand	Anodyne	ADRB1	21	42
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1ccccc1C(F)(F)F	ZINC000819142654	FH	On-Demand	Anodyne	ADRB3	78	42
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COCc1cccs1	ZINC000819142658	FG	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CNC1CCC(N2CCCCC2)CC1)COCc1cccs1	ZINC000819142659	FG	On-Demand	Anodyne	ADRB2	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(OC)cc1C(F)(F)F)C2	ZINC000819142671	GH	On-Demand	Anodyne	RBP4	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(OC)cc1C(F)(F)F)C2	ZINC000819142672	GH	On-Demand	Anodyne	RBP4	15	40
N#CCc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142673	FF	On-Demand	Mild	ADRB2	33	45
N#CCc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142673	FF	On-Demand	Mild	ADRB1	45	51
N#CCc1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142673	FF	On-Demand	Mild	ADRB3	30	43
N#CCc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142674	FF	On-Demand	Mild	ADRB2	33	45
N#CCc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142674	FF	On-Demand	Mild	ADRB1	45	51
N#CCc1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142674	FF	On-Demand	Mild	ADRB3	30	43
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1cccc(F)c1	ZINC000819142675	DG	On-Demand	Anodyne	L3MBTL3	51	35
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1cccc(F)c1	ZINC000819142676	DG	On-Demand	Anodyne	L3MBTL3	51	35
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)c1	ZINC000819142685	ED	On-Demand	Bother	ADRB2	19	46
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)c1	ZINC000819142685	ED	On-Demand	Bother	ADRB1	29	46
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)c1	ZINC000819142685	ED	On-Demand	Bother	ADRB3	20	46
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC[C@H]2CSCCS2)c1	ZINC000819142686	ED	On-Demand	Bother	ADRB2	19	46
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC[C@H]2CSCCS2)c1	ZINC000819142686	ED	On-Demand	Bother	ADRB1	29	46
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC[C@H]2CSCCS2)c1	ZINC000819142686	ED	On-Demand	Bother	ADRB3	20	46
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@H]2CSCCS2)c1	ZINC000819142687	ED	On-Demand	Bother	ADRB2	19	46
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@H]2CSCCS2)c1	ZINC000819142687	ED	On-Demand	Bother	ADRB1	29	46
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@H]2CSCCS2)c1	ZINC000819142687	ED	On-Demand	Bother	ADRB3	20	46
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@@H]2CSCCS2)c1	ZINC000819142688	ED	On-Demand	Bother	ADRB2	19	46
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@@H]2CSCCS2)c1	ZINC000819142688	ED	On-Demand	Bother	ADRB1	29	46
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@@H]2CSCCS2)c1	ZINC000819142688	ED	On-Demand	Bother	ADRB3	20	46
Cc1noc(C2CCN(C(=O)C(F)=C3CCC3)CC2)n1	ZINC000819142696	CE	On-Demand	Anodyne	ETHR	58	40
C=CCCn1cc(C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)nn1	ZINC000819142697	FH	On-Demand	Mild	CNR1	51	31
C=CCCn1cc(C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)nn1	ZINC000819142697	FH	On-Demand	Mild	NPY2R	48	40
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819142724	GF	On-Demand	Anodyne	CACNA1H	19	40
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819142724	GF	On-Demand	Anodyne	CACNA1I	79	57
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1ccc(F)c(F)c1	ZINC000819142725	EG	On-Demand	Anodyne	L3MBTL3	47	33
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1ccc(F)c(F)c1	ZINC000819142728	EG	On-Demand	Anodyne	L3MBTL3	47	33
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142731	FE	On-Demand	Anodyne	ADRB2	39	55
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142731	FE	On-Demand	Anodyne	ADRB1	73	55
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142731	FE	On-Demand	Anodyne	ADRB3	48	47
COCCc1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142733	FE	On-Demand	Anodyne	ADRB2	39	55
COCCc1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142733	FE	On-Demand	Anodyne	ADRB1	73	55
COCCc1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142733	FE	On-Demand	Anodyne	ADRB3	48	47
COCCc1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142735	FE	On-Demand	Anodyne	ADRB2	39	55
COCCc1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142735	FE	On-Demand	Anodyne	ADRB1	73	55
COCCc1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142735	FE	On-Demand	Anodyne	ADRB3	48	47
COCCc1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142737	FE	On-Demand	Anodyne	ADRB2	39	55
COCCc1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142737	FE	On-Demand	Anodyne	ADRB1	73	55
COCCc1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142737	FE	On-Demand	Anodyne	ADRB3	48	47
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819142738	GF	On-Demand	Anodyne	CACNA1H	17	40
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819142738	GF	On-Demand	Anodyne	ADRB1	48	46
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819142738	GF	On-Demand	Anodyne	ADRB3	70	46
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819142738	GF	On-Demand	Anodyne	IGF1R	28	40
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819142738	GF	On-Demand	Anodyne	CYP3A4	50	35
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819142738	GF	On-Demand	Anodyne	CACNA1I	84	56
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819142740	GF	On-Demand	Anodyne	CACNA1H	17	40
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819142740	GF	On-Demand	Anodyne	ADRB1	48	46
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819142740	GF	On-Demand	Anodyne	ADRB3	70	46
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819142740	GF	On-Demand	Anodyne	IGF1R	28	40
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819142740	GF	On-Demand	Anodyne	CYP3A4	50	35
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819142740	GF	On-Demand	Anodyne	CACNA1I	84	56
Cc1noc(C2CCN(C(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)CC2)n1	ZINC000819142767	FD	On-Demand	Anodyne	ETHR	55	36
CC[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1cccc(F)c1	ZINC000819142777	DG	On-Demand	Anodyne	ADRB1	21	44
CC[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1cccc(F)c1	ZINC000819142777	DG	On-Demand	Anodyne	ADRB3	29	44
CC[C@@H](CNC[C@@H](O)c1cccc(F)c1)Oc1cccc(F)c1	ZINC000819142777	DG	On-Demand	Anodyne	PDS	45	42
CC[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1cccc(F)c1	ZINC000819142781	DG	On-Demand	Anodyne	ADRB1	21	44
CC[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1cccc(F)c1	ZINC000819142781	DG	On-Demand	Anodyne	ADRB3	29	44
CC[C@@H](CNC[C@H](O)c1cccc(F)c1)Oc1cccc(F)c1	ZINC000819142781	DG	On-Demand	Anodyne	PDS	45	42
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142785	FG	On-Demand	Anodyne	ADRB2	37	43
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142785	FG	On-Demand	Anodyne	ADRB1	53	46
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142785	FG	On-Demand	Anodyne	ADRB3	40	46
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142785	FG	On-Demand	Anodyne	HRH3	28	42
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142785	FG	On-Demand	Anodyne	ABCB1	20	45
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142785	FG	On-Demand	Anodyne	L3MBTL3	80	38
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142787	FG	On-Demand	Anodyne	ADRB2	37	43
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142787	FG	On-Demand	Anodyne	ADRB1	53	46
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142787	FG	On-Demand	Anodyne	ADRB3	40	46
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142787	FG	On-Demand	Anodyne	HRH3	28	42
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142787	FG	On-Demand	Anodyne	ABCB1	20	45
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142787	FG	On-Demand	Anodyne	L3MBTL3	80	38
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc2ccccc2c1	ZINC000819142788	GH	On-Demand	Anodyne	ADRB2	37	53
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc2ccccc2c1	ZINC000819142788	GH	On-Demand	Anodyne	ADRB1	41	46
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc2ccccc2c1	ZINC000819142788	GH	On-Demand	Anodyne	ADRB3	30	43
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc2ccccc2c1	ZINC000819142788	GH	On-Demand	Anodyne	ABCB1	16	42
O[C@H](CNC[C@H]1CSCCS1)COc1cccc2ccccc12	ZINC000819142789	EG	On-Demand	Anodyne	ADRB2	30	56
O[C@H](CNC[C@H]1CSCCS1)COc1cccc2ccccc12	ZINC000819142789	EG	On-Demand	Anodyne	ADRB1	52	35
O[C@H](CNC[C@H]1CSCCS1)COc1cccc2ccccc12	ZINC000819142789	EG	On-Demand	Anodyne	ADRB3	19	51
O[C@@H](CNC[C@H]1CSCCS1)COc1cccc2ccccc12	ZINC000819142790	EG	On-Demand	Anodyne	ADRB2	30	56
O[C@@H](CNC[C@H]1CSCCS1)COc1cccc2ccccc12	ZINC000819142790	EG	On-Demand	Anodyne	ADRB1	52	35
O[C@@H](CNC[C@H]1CSCCS1)COc1cccc2ccccc12	ZINC000819142790	EG	On-Demand	Anodyne	ADRB3	19	51
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc2ccccc2c1	ZINC000819142791	GH	On-Demand	Anodyne	ADRB2	37	53
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc2ccccc2c1	ZINC000819142791	GH	On-Demand	Anodyne	ADRB1	41	46
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc2ccccc2c1	ZINC000819142791	GH	On-Demand	Anodyne	ADRB3	30	43
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc2ccccc2c1	ZINC000819142791	GH	On-Demand	Anodyne	ABCB1	16	42
O[C@H](CNC[C@@H]1CSCCS1)COc1cccc2ccccc12	ZINC000819142792	EG	On-Demand	Anodyne	ADRB2	30	56
O[C@H](CNC[C@@H]1CSCCS1)COc1cccc2ccccc12	ZINC000819142792	EG	On-Demand	Anodyne	ADRB1	52	35
O[C@H](CNC[C@@H]1CSCCS1)COc1cccc2ccccc12	ZINC000819142792	EG	On-Demand	Anodyne	ADRB3	19	51
COc1ccc(N2CCCN(C(=O)[C@@H]3C[C@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819142793	FH	On-Demand	Clean	MC4R	25	42
COc1ccc(N2CCCN(C(=O)[C@@H]3C[C@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819142793	FH	On-Demand	Clean	CCKAR	21	45
COc1ccc(N2CCCN(C(=O)[C@@H]3C[C@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819142793	FH	On-Demand	Clean	NPBWR1	95	42
O[C@@H](CNC[C@@H]1CSCCS1)COc1cccc2ccccc12	ZINC000819142794	EG	On-Demand	Anodyne	ADRB2	30	56
O[C@@H](CNC[C@@H]1CSCCS1)COc1cccc2ccccc12	ZINC000819142794	EG	On-Demand	Anodyne	ADRB1	52	35
O[C@@H](CNC[C@@H]1CSCCS1)COc1cccc2ccccc12	ZINC000819142794	EG	On-Demand	Anodyne	ADRB3	19	51
COc1ccc(N2CCCN(C(=O)[C@@H]3C[C@@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819142797	FH	On-Demand	Clean	MC4R	25	42
COc1ccc(N2CCCN(C(=O)[C@@H]3C[C@@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819142797	FH	On-Demand	Clean	CCKAR	21	45
COc1ccc(N2CCCN(C(=O)[C@@H]3C[C@@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819142797	FH	On-Demand	Clean	NPBWR1	95	42
COc1ccc(N2CCCN(C(=O)[C@H]3C[C@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819142799	FH	On-Demand	Clean	MC4R	25	42
COc1ccc(N2CCCN(C(=O)[C@H]3C[C@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819142799	FH	On-Demand	Clean	CCKAR	21	45
COc1ccc(N2CCCN(C(=O)[C@H]3C[C@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819142799	FH	On-Demand	Clean	NPBWR1	95	42
CSc1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142801	EF	On-Demand	Anodyne	ADRB1	52	39
COc1ccc(N2CCCN(C(=O)[C@H]3C[C@@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819142802	FH	On-Demand	Clean	MC4R	25	42
COc1ccc(N2CCCN(C(=O)[C@H]3C[C@@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819142802	FH	On-Demand	Clean	CCKAR	21	45
COc1ccc(N2CCCN(C(=O)[C@H]3C[C@@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819142802	FH	On-Demand	Clean	NPBWR1	95	42
CSc1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142804	EF	On-Demand	Anodyne	ADRB1	52	39
CSc1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142805	EF	On-Demand	Anodyne	ADRB1	52	39
CSc1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142806	EF	On-Demand	Anodyne	ADRB1	52	39
COc1cccc(OC)c1OC[C@@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142809	GF	On-Demand	Anodyne	ADRB2	40	51
COc1cccc(OC)c1OC[C@@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142809	GF	On-Demand	Anodyne	ADRB1	32	51
COc1cccc(OC)c1OC[C@@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142809	GF	On-Demand	Anodyne	ADRB3	25	44
COc1cccc(OC)c1OC[C@@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142809	GF	On-Demand	Anodyne	EBP	20	42
COc1cccc(OC)c1OC[C@@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142809	GF	On-Demand	Anodyne	ABCB1	19	45
CC[C@@H](CNC[C@@H](O)c1ccc(F)cc1)Oc1cccc(F)c1	ZINC000819142810	DG	On-Demand	Anodyne	PDS	39	42
COc1cccc(OC)c1OC[C@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142811	GF	On-Demand	Anodyne	ADRB2	40	51
COc1cccc(OC)c1OC[C@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142811	GF	On-Demand	Anodyne	ADRB1	32	51
COc1cccc(OC)c1OC[C@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142811	GF	On-Demand	Anodyne	ADRB3	25	44
COc1cccc(OC)c1OC[C@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142811	GF	On-Demand	Anodyne	EBP	20	42
COc1cccc(OC)c1OC[C@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819142811	GF	On-Demand	Anodyne	ABCB1	19	45
CC[C@@H](CNC[C@H](O)c1ccc(F)cc1)Oc1cccc(F)c1	ZINC000819142814	DG	On-Demand	Anodyne	PDS	39	42
O[C@H](CNC[C@H]1CCC[C@H](C(F)(F)F)C1)c1cccnc1	ZINC000819142823	DG	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNC[C@H]1CCC[C@H](C(F)(F)F)C1)c1cccnc1	ZINC000819142823	DG	On-Demand	Anodyne	ADRB1	21	40
O[C@H](CNC[C@H]1CCC[C@H](C(F)(F)F)C1)c1cccnc1	ZINC000819142823	DG	On-Demand	Anodyne	ADRB3	85	43
O[C@H](CNC[C@H]1CCC[C@@H](C(F)(F)F)C1)c1cccnc1	ZINC000819142825	DG	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNC[C@H]1CCC[C@@H](C(F)(F)F)C1)c1cccnc1	ZINC000819142825	DG	On-Demand	Anodyne	ADRB1	21	40
O[C@H](CNC[C@H]1CCC[C@@H](C(F)(F)F)C1)c1cccnc1	ZINC000819142825	DG	On-Demand	Anodyne	ADRB3	85	43
O[C@H](CNC[C@@H]1CCC[C@H](C(F)(F)F)C1)c1cccnc1	ZINC000819142827	DG	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNC[C@@H]1CCC[C@H](C(F)(F)F)C1)c1cccnc1	ZINC000819142827	DG	On-Demand	Anodyne	ADRB1	21	40
O[C@H](CNC[C@@H]1CCC[C@H](C(F)(F)F)C1)c1cccnc1	ZINC000819142827	DG	On-Demand	Anodyne	ADRB3	85	43
O[C@H](CNC[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1cccnc1	ZINC000819142831	DG	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNC[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1cccnc1	ZINC000819142831	DG	On-Demand	Anodyne	ADRB1	21	40
O[C@H](CNC[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1cccnc1	ZINC000819142831	DG	On-Demand	Anodyne	ADRB3	85	43
Cc1cc(F)ccc1[C@@H](O)CNCC1CCN(CCC(C)C)CC1	ZINC000819142850	EH	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CCCN(C(=O)Cc2nsc3ccccc23)CC1	ZINC000819142886	GG	On-Demand	Anodyne	GPR119	40	38
COc1ccc(OC)c([C@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819142892	FG	On-Demand	Anodyne	ADRA1D	21	42
COc1ccc(OC)c([C@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819142892	FG	On-Demand	Anodyne	ADRA1A	15	42
COc1ccc(OC)c([C@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819142892	FG	On-Demand	Anodyne	ADRA1B	17	42
COc1ccc(OC)c([C@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819142892	FG	On-Demand	Anodyne	CCR4	18	42
COc1ccc(OC)c([C@H](O)CNC2CCC(N3CCCCC3)CC2)c1	ZINC000819142892	FG	On-Demand	Anodyne	L3MBTL3	43	33
O[C@H](CNC[C@@H]1CSCCS1)c1cccc(Cl)c1	ZINC000819142914	DF	On-Demand	Anodyne	ADRB1	30	43
O[C@H](CNC[C@@H]1CSCCS1)c1cccc(Cl)c1	ZINC000819142914	DF	On-Demand	Anodyne	ADRB3	43	43
O[C@@H](CNC[C@@H]1CSCCS1)c1cccc(Cl)c1	ZINC000819142916	DF	On-Demand	Anodyne	ADRB1	30	43
O[C@@H](CNC[C@@H]1CSCCS1)c1cccc(Cl)c1	ZINC000819142916	DF	On-Demand	Anodyne	ADRB3	43	43
O=[N+]([O-])c1ccc([C@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142917	EG	On-Demand	Bother	L3MBTL3	57	35
O[C@H](CNC[C@H]1CSCCS1)c1cccc(Cl)c1	ZINC000819142918	DF	On-Demand	Anodyne	ADRB1	30	43
O[C@H](CNC[C@H]1CSCCS1)c1cccc(Cl)c1	ZINC000819142918	DF	On-Demand	Anodyne	ADRB3	43	43
O=[N+]([O-])c1ccc([C@@H](O)CNC2CCC(N3CCCCC3)CC2)cc1	ZINC000819142919	EG	On-Demand	Bother	L3MBTL3	57	35
O[C@@H](CNC[C@H]1CSCCS1)c1cccc(Cl)c1	ZINC000819142920	DF	On-Demand	Anodyne	ADRB1	30	43
O[C@@H](CNC[C@H]1CSCCS1)c1cccc(Cl)c1	ZINC000819142920	DF	On-Demand	Anodyne	ADRB3	43	43
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142922	EE	On-Demand	Anodyne	ADRB2	38	41
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142922	EE	On-Demand	Anodyne	ADRB1	69	41
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142922	EE	On-Demand	Anodyne	ADRB3	42	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142923	EE	On-Demand	Anodyne	ADRB2	38	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142923	EE	On-Demand	Anodyne	ADRB1	69	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819142923	EE	On-Demand	Anodyne	ADRB3	42	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142925	EE	On-Demand	Anodyne	ADRB2	38	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142925	EE	On-Demand	Anodyne	ADRB1	69	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142925	EE	On-Demand	Anodyne	ADRB3	42	41
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142927	EE	On-Demand	Anodyne	ADRB2	38	41
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142927	EE	On-Demand	Anodyne	ADRB1	69	41
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819142927	EE	On-Demand	Anodyne	ADRB3	42	41
O=C(CCNC1CCC(N2CCCCC2)CC1)Nc1ccccc1F	ZINC000819142928	EH	On-Demand	Anodyne	L3MBTL3	69	37
CC[C@@H](CNCCS(=O)(=O)CC)Oc1cccc(F)c1	ZINC000819142931	DE	On-Demand	Anodyne	PDS	48	42
CC[C@@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(F)c1	ZINC000819142970	DG	On-Demand	Anodyne	ADRB1	27	41
CC[C@@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(F)c1	ZINC000819142970	DG	On-Demand	Anodyne	ADRB3	39	41
CC[C@@H](CNC[C@@H](O)c1ccccc1)Oc1cccc(F)c1	ZINC000819142970	DG	On-Demand	Anodyne	PDS	72	47
CC[C@@H](CNC[C@H](O)c1ccccc1)Oc1cccc(F)c1	ZINC000819142974	DG	On-Demand	Anodyne	ADRB1	27	41
CC[C@@H](CNC[C@H](O)c1ccccc1)Oc1cccc(F)c1	ZINC000819142974	DG	On-Demand	Anodyne	ADRB3	39	41
CC[C@@H](CNC[C@H](O)c1ccccc1)Oc1cccc(F)c1	ZINC000819142974	DG	On-Demand	Anodyne	PDS	72	47
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc(F)cc1	ZINC000819143004	FF	On-Demand	Anodyne	ADRB2	36	51
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc(F)cc1	ZINC000819143004	FF	On-Demand	Anodyne	ADRB1	47	49
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc(F)cc1	ZINC000819143004	FF	On-Demand	Anodyne	ADRB3	33	47
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc(F)cc1	ZINC000819143005	FF	On-Demand	Anodyne	ADRB2	36	51
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc(F)cc1	ZINC000819143005	FF	On-Demand	Anodyne	ADRB1	47	49
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1ccc(F)cc1	ZINC000819143005	FF	On-Demand	Anodyne	ADRB3	33	47
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2ccccc12	ZINC000819143008	GH	On-Demand	Anodyne	ADRB2	45	56
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2ccccc12	ZINC000819143008	GH	On-Demand	Anodyne	ADRB1	34	56
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2ccccc12	ZINC000819143008	GH	On-Demand	Anodyne	ADRA1D	30	42
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2ccccc12	ZINC000819143008	GH	On-Demand	Anodyne	ADRA1A	21	42
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2ccccc12	ZINC000819143008	GH	On-Demand	Anodyne	ADRA1B	24	42
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2ccccc12	ZINC000819143008	GH	On-Demand	Anodyne	ADRB3	27	53
O[C@@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2ccccc12	ZINC000819143008	GH	On-Demand	Anodyne	ABCB1	36	49
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2ccccc12	ZINC000819143009	GH	On-Demand	Anodyne	ADRB2	45	56
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2ccccc12	ZINC000819143009	GH	On-Demand	Anodyne	ADRB1	34	56
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2ccccc12	ZINC000819143009	GH	On-Demand	Anodyne	ADRA1D	30	42
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2ccccc12	ZINC000819143009	GH	On-Demand	Anodyne	ADRA1A	21	42
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2ccccc12	ZINC000819143009	GH	On-Demand	Anodyne	ADRA1B	24	42
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2ccccc12	ZINC000819143009	GH	On-Demand	Anodyne	ADRB3	27	53
O[C@H](CNC1CCC(N2CCCCC2)CC1)COc1cccc2ccccc12	ZINC000819143009	GH	On-Demand	Anodyne	ABCB1	36	49
O[C@@H](CNCc1nccn1CCc1ccccc1)c1cccc(Cl)c1	ZINC000819143017	FH	On-Demand	Anodyne	ADRB1	55	48
O[C@@H](CNCc1nccn1CCc1ccccc1)c1cccc(Cl)c1	ZINC000819143017	FH	On-Demand	Anodyne	ADRB3	81	48
O[C@H](CNCc1nccn1CCc1ccccc1)c1cccc(Cl)c1	ZINC000819143019	FH	On-Demand	Anodyne	ADRB1	55	48
O[C@H](CNCc1nccn1CCc1ccccc1)c1cccc(Cl)c1	ZINC000819143019	FH	On-Demand	Anodyne	ADRB3	81	48
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1ccc(Cl)cc1	ZINC000819143032	EH	On-Demand	Anodyne	ADRB3	24	45
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1ccc(Cl)cc1	ZINC000819143032	EH	On-Demand	Anodyne	L3MBTL3	63	35
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819143050	EI	On-Demand	Anodyne	NPY2R	61	47
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819143052	EI	On-Demand	Anodyne	NPY2R	61	47
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819143054	EI	On-Demand	Anodyne	NPY2R	61	47
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819143056	EI	On-Demand	Anodyne	NPY2R	61	47
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC[C@H]1CSCCS1	ZINC000819143058	ED	On-Demand	Bother	ADRB1	44	35
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC[C@@H]1CSCCS1	ZINC000819143063	ED	On-Demand	Bother	ADRB1	44	35
CON(C)C(=O)CCNCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000819143065	EC	On-Demand	Anodyne	CACNA1I	39	47
COc1cccc(C[C@@H]2CCCN2C(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819143076	DF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C[C@@H]2CCCN2C(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819143076	DF	On-Demand	Anodyne	ACKR3	57	33
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC[C@H]1CSCCS1	ZINC000819143077	ED	On-Demand	Bother	ADRB1	44	35
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC[C@@H]1CSCCS1	ZINC000819143078	ED	On-Demand	Bother	ADRB1	44	35
CC[C@@H](CNC[C@@H](O)c1cc(OC)ccc1OC)Oc1cccc(F)c1	ZINC000819143089	FG	On-Demand	Anodyne	MTNR1A	18	40
CC[C@@H](CNC[C@H](O)c1cc(OC)ccc1OC)Oc1cccc(F)c1	ZINC000819143090	FG	On-Demand	Anodyne	MTNR1A	18	40
O[C@H](CNC[C@H]1CSCCS1)COc1ccccc1C(F)(F)F	ZINC000819143107	FF	On-Demand	Anodyne	ADRB1	48	33
O[C@@H](CNC[C@@H]1CSCCS1)COc1ccccc1C(F)(F)F	ZINC000819143108	FF	On-Demand	Anodyne	ADRB1	48	33
O[C@@H](CNC[C@H]1CSCCS1)COc1ccccc1C(F)(F)F	ZINC000819143109	FF	On-Demand	Anodyne	ADRB1	48	33
O[C@H](CNC[C@@H]1CSCCS1)COc1ccccc1C(F)(F)F	ZINC000819143110	FF	On-Demand	Anodyne	ADRB1	48	33
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819143115	DF	On-Demand	Anodyne	ADRB2	20	44
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819143115	DF	On-Demand	Anodyne	ADRB1	31	47
CC[C@@H](CNC[C@@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819143115	DF	On-Demand	Anodyne	ADRB3	94	47
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819143117	DF	On-Demand	Anodyne	ADRB2	20	44
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819143117	DF	On-Demand	Anodyne	ADRB1	31	47
CC[C@@H](CNC[C@H](O)c1cccnc1)Oc1cccc(F)c1	ZINC000819143117	DF	On-Demand	Anodyne	ADRB3	94	47
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819143119	FD	On-Demand	Anodyne	ADRB2	44	45
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819143119	FD	On-Demand	Anodyne	ADRB1	74	45
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819143119	FD	On-Demand	Anodyne	ADRB3	48	45
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819143120	FD	On-Demand	Anodyne	ADRB2	44	45
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819143120	FD	On-Demand	Anodyne	ADRB1	74	45
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819143120	FD	On-Demand	Anodyne	ADRB3	48	45
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819143121	FD	On-Demand	Anodyne	ADRB2	44	45
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819143121	FD	On-Demand	Anodyne	ADRB1	74	45
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CSCCS2)cc1	ZINC000819143121	FD	On-Demand	Anodyne	ADRB3	48	45
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819143122	FD	On-Demand	Anodyne	ADRB2	44	45
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819143122	FD	On-Demand	Anodyne	ADRB1	74	45
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CSCCS2)cc1	ZINC000819143122	FD	On-Demand	Anodyne	ADRB3	48	45
COc1cccc(C[C@@H]2CCCN2C(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819143135	DF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C[C@@H]2CCCN2C(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819143135	DF	On-Demand	Anodyne	ACKR3	57	33
COc1cccc(C[C@@H]2CCCN2C(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819143136	DF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C[C@@H]2CCCN2C(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819143136	DF	On-Demand	Anodyne	ACKR3	57	33
COc1cccc(C[C@@H]2CCCN2C(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819143137	DF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C[C@@H]2CCCN2C(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819143137	DF	On-Demand	Anodyne	ACKR3	57	33
O=C(Cc1ccc(-n2cnnc2)cc1)NCC1CCCCCCC1	ZINC000819143147	EG	On-Demand	Anodyne	CACNA1I	36	44
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)C2CC2)CC1	ZINC000819143157	DC	On-Demand	Anodyne	CACNA1I	51	51
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)C2CC2)CC1	ZINC000819143158	DC	On-Demand	Anodyne	CACNA1I	51	51
O[C@@H](CNCc1nccn1CCc1ccccc1)c1ccccc1	ZINC000819143161	DF	On-Demand	Anodyne	ADRB2	22	42
O[C@@H](CNCc1nccn1CCc1ccccc1)c1ccccc1	ZINC000819143161	DF	On-Demand	Anodyne	ADRB3	68	41
O[C@H](CNCc1nccn1CCc1ccccc1)c1ccccc1	ZINC000819143162	DF	On-Demand	Anodyne	ADRB2	22	42
O[C@H](CNCc1nccn1CCc1ccccc1)c1ccccc1	ZINC000819143162	DF	On-Demand	Anodyne	ADRB3	68	41
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2c(F)cccc2F)CC1	ZINC000819143163	GE	On-Demand	Anodyne	CACNA1I	57	48
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2c(F)cccc2F)CC1	ZINC000819143164	GE	On-Demand	Anodyne	CACNA1I	57	48
Cc1ccccc1[C@@H](O)CNC[C@@H](c1cccnc1)C(C)C	ZINC000819143165	CG	On-Demand	Anodyne	ADRB3	54	44
Cc1ccccc1[C@@H](O)CNC[C@H](c1cccnc1)C(C)C	ZINC000819143166	CG	On-Demand	Anodyne	ADRB3	54	44
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1ccccc1F	ZINC000819143171	DG	On-Demand	Anodyne	L3MBTL3	57	36
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1ccccc1F	ZINC000819143172	DG	On-Demand	Anodyne	L3MBTL3	57	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(-n2ccnc2)c(F)c1	ZINC000819143199	FF	On-Demand	Anodyne	NPY2R	43	33
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1ccc(F)cc1	ZINC000819143200	DG	On-Demand	Anodyne	SLC6A3	21	50
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1ccc(F)cc1	ZINC000819143200	DG	On-Demand	Anodyne	L3MBTL3	69	35
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1ccc(F)cc1	ZINC000819143201	DG	On-Demand	Anodyne	SLC6A3	21	50
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1ccc(F)cc1	ZINC000819143201	DG	On-Demand	Anodyne	L3MBTL3	69	35
O=S(=O)(CCNC1CCC(N2CCCCC2)CC1)c1ccccc1	ZINC000819143212	FF	On-Demand	Anodyne	L3MBTL3	70	36
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819143222	GF	On-Demand	Anodyne	CACNA1I	72	52
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819143223	GF	On-Demand	Anodyne	CACNA1I	72	52
O[C@H](CNC1CCC(N2CCCCC2)CC1)c1ccccc1C(F)(F)F	ZINC000819143224	FI	On-Demand	Anodyne	SFRP1	52	33
O[C@@H](CNC1CCC(N2CCCCC2)CC1)c1ccccc1C(F)(F)F	ZINC000819143225	FI	On-Demand	Anodyne	SFRP1	52	33
COc1ccc(N2CCCN(C(=O)c3cc4c(cn3)OCCO4)CC2)cc1	ZINC000819143229	FE	On-Demand	Clean	CCKAR	44	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(-c3nc(C)c(C)o3)c1)C2	ZINC000819143272	GH	On-Demand	Anodyne	PDE8B	52	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(-c3nc(C)c(C)o3)c1)C2	ZINC000819143273	GH	On-Demand	Anodyne	PDE8B	52	34
COc1ccccc1COC[C@@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819143282	GF	On-Demand	Anodyne	ADRB2	18	45
COc1ccccc1COC[C@H](O)CNC1CCC(N2CCCCC2)CC1	ZINC000819143283	GF	On-Demand	Anodyne	ADRB2	18	45
O[C@@H](CCc1ccccc1)CNC1CCC(N2CCCCC2)CC1	ZINC000819143292	EG	On-Demand	Anodyne	ABCB1	22	47
O[C@@H](CCc1ccccc1)CNC1CCC(N2CCCCC2)CC1	ZINC000819143292	EG	On-Demand	Anodyne	L3MBTL3	83	39
O[C@H](CCc1ccccc1)CNC1CCC(N2CCCCC2)CC1	ZINC000819143293	EG	On-Demand	Anodyne	ABCB1	22	47
O[C@H](CCc1ccccc1)CNC1CCC(N2CCCCC2)CC1	ZINC000819143293	EG	On-Demand	Anodyne	L3MBTL3	83	39
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2cc3ccccc3o2)CC1	ZINC000819143296	GF	On-Demand	Anodyne	ACHE	15	42
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2cc3ccccc3o2)CC1	ZINC000819143296	GF	On-Demand	Anodyne	CACNA1I	63	50
COc1ccc(N2CCCN(C(=O)c3cnc4cc(OC)ccn34)CC2)cc1	ZINC000819143297	GF	On-Demand	Clean	IGF1R	25	47
COc1ccc(N2CCCN(C(=O)c3cnc4cc(OC)ccn34)CC2)cc1	ZINC000819143297	GF	On-Demand	Clean	CCKAR	31	42
CC(C)(C)NC(=O)CN1CCC(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819143302	GD	On-Demand	Bother	CACNA1I	44	46
CC(C)(C)NC(=O)CN1CCC(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819143303	GD	On-Demand	Bother	CACNA1I	44	46
C=CCC1(C(=O)N2CCCN(c3ccc(OC)cc3)CC2)CCOCC1	ZINC000819143308	FG	On-Demand	Mild	MMP13	19	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819143322	FE	On-Demand	Anodyne	ADRB1	27	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819143322	FE	On-Demand	Anodyne	SLC6A3	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819143322	FE	On-Demand	Anodyne	ADRB3	43	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819143322	FE	On-Demand	Anodyne	CYP3A4	46	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819143323	FE	On-Demand	Anodyne	ADRB1	27	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819143323	FE	On-Demand	Anodyne	SLC6A3	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819143323	FE	On-Demand	Anodyne	ADRB3	43	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819143323	FE	On-Demand	Anodyne	CYP3A4	46	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819143324	FE	On-Demand	Anodyne	ADRB1	27	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819143324	FE	On-Demand	Anodyne	SLC6A3	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819143324	FE	On-Demand	Anodyne	ADRB3	43	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819143324	FE	On-Demand	Anodyne	CYP3A4	46	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819143325	FE	On-Demand	Anodyne	ADRB1	27	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819143325	FE	On-Demand	Anodyne	SLC6A3	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819143325	FE	On-Demand	Anodyne	ADRB3	43	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819143325	FE	On-Demand	Anodyne	CYP3A4	46	34
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819143332	FH	On-Demand	Anodyne	ADRB1	43	53
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819143332	FH	On-Demand	Anodyne	ADRB3	56	53
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819143333	FH	On-Demand	Anodyne	ADRB1	43	53
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819143333	FH	On-Demand	Anodyne	ADRB3	56	53
Cc1noc(C)c1CCCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819143395	GF	On-Demand	Anodyne	GPR119	32	40
Cc1noc(C)c1CCCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819143396	GF	On-Demand	Anodyne	GPR119	32	40
Cc1noc(C)c1CCCNCCC(=O)Nc1cccc(Br)c1	ZINC000819143399	GH	On-Demand	Anodyne	EGFR	24	40
Cc1noc(C)c1CCCNCCC(=O)Nc1cccc(Br)c1	ZINC000819143399	GH	On-Demand	Anodyne	HDAC10	27	42
O=C(NC[C@H]1CCN(CC(F)(F)F)C1)C(F)=C1CCC1	ZINC000819143400	CE	On-Demand	Anodyne	CACNA1I	45	33
O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)C(F)=C1CCC1	ZINC000819143401	CE	On-Demand	Anodyne	CACNA1I	45	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCN(CC(F)(F)F)C1)C2	ZINC000819143402	GD	On-Demand	Anodyne	CACNA1I	40	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCN(CC(F)(F)F)C1)C2	ZINC000819143403	GD	On-Demand	Anodyne	CACNA1I	40	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1)C2	ZINC000819143404	GD	On-Demand	Anodyne	CACNA1I	40	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1)C2	ZINC000819143405	GD	On-Demand	Anodyne	CACNA1I	40	33
COc1ccc(OC)c([C@H](O)CNCCCc2c(C)noc2C)c1	ZINC000819143422	EF	On-Demand	Anodyne	ADRB2	16	44
Cc1ccc(OC[C@@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819143425	DF	On-Demand	Anodyne	ADRB2	51	51
Cc1ccc(OC[C@@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819143425	DF	On-Demand	Anodyne	ADRB1	72	50
Cc1ccc(OC[C@@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819143425	DF	On-Demand	Anodyne	ADRB3	44	50
Cc1ccc(OC[C@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819143426	DF	On-Demand	Anodyne	ADRB2	51	51
Cc1ccc(OC[C@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819143426	DF	On-Demand	Anodyne	ADRB1	72	50
Cc1ccc(OC[C@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819143426	DF	On-Demand	Anodyne	ADRB3	44	50
O=C(NC[C@@H](O)c1cccc(Cl)c1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819143429	GI	On-Demand	Anodyne	ADRB1	32	43
O=C(NC[C@@H](O)c1cccc(Cl)c1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819143429	GI	On-Demand	Anodyne	ADRB3	47	43
O=C(NC[C@@H](O)c1cccc(Cl)c1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819143429	GI	On-Demand	Anodyne	CYP3A4	46	35
O=C(NC[C@H](O)c1cccc(Cl)c1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819143430	GI	On-Demand	Anodyne	ADRB1	32	43
O=C(NC[C@H](O)c1cccc(Cl)c1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819143430	GI	On-Demand	Anodyne	ADRB3	47	43
O=C(NC[C@H](O)c1cccc(Cl)c1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819143430	GI	On-Demand	Anodyne	CYP3A4	46	35
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819143431	GH	On-Demand	Anodyne	ADRB2	62	48
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819143431	GH	On-Demand	Anodyne	ADRB1	89	47
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819143431	GH	On-Demand	Anodyne	ADRB3	63	47
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819143432	GH	On-Demand	Anodyne	ADRB2	62	48
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819143432	GH	On-Demand	Anodyne	ADRB1	89	47
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819143432	GH	On-Demand	Anodyne	ADRB3	63	47
Cc1noc(C)c1CCCNC[C@H](O)COc1cccc(Br)c1	ZINC000819143437	GG	On-Demand	Anodyne	ADRB2	39	43
Cc1noc(C)c1CCCNC[C@H](O)COc1cccc(Br)c1	ZINC000819143437	GG	On-Demand	Anodyne	ADRB1	50	42
Cc1noc(C)c1CCCNC[C@H](O)COc1cccc(Br)c1	ZINC000819143437	GG	On-Demand	Anodyne	ADRB3	33	41
Cc1noc(C)c1CCCNC[C@@H](O)COc1cccc(Br)c1	ZINC000819143438	GG	On-Demand	Anodyne	ADRB2	39	43
Cc1noc(C)c1CCCNC[C@@H](O)COc1cccc(Br)c1	ZINC000819143438	GG	On-Demand	Anodyne	ADRB1	50	42
Cc1noc(C)c1CCCNC[C@@H](O)COc1cccc(Br)c1	ZINC000819143438	GG	On-Demand	Anodyne	ADRB3	33	41
Cc1noc(C)c1CCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819143468	FG	On-Demand	Anodyne	ADRB3	15	41
Cc1noc(C)c1CCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819143469	FG	On-Demand	Anodyne	ADRB3	15	41
O=C(NCCc1ccncc1)C(F)=C1CCC1	ZINC000819143479	BE	On-Demand	Anodyne	CA5B	17	45
O=C(NCCc1ccncc1)C(F)=C1CCC1	ZINC000819143479	BE	On-Demand	Anodyne	CA5A	15	45
Cc1noc(C)c1CCCNC[C@H](O)c1ccc(F)cc1Cl	ZINC000819143486	EG	On-Demand	Anodyne	P2RX7	18	50
Cc1noc(C)c1CCCNC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819143487	EG	On-Demand	Anodyne	P2RX7	18	50
Cc1noc(C)c1CCCNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819143488	GH	On-Demand	Anodyne	CYNT	35	43
Cc1noc(C)c1CCCNC[C@H](O)COc1ccccc1F	ZINC000819143496	DE	On-Demand	Anodyne	ADRB2	35	44
Cc1noc(C)c1CCCNC[C@H](O)COc1ccccc1F	ZINC000819143496	DE	On-Demand	Anodyne	ADRB1	59	39
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccccc1F	ZINC000819143497	DE	On-Demand	Anodyne	ADRB2	35	44
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccccc1F	ZINC000819143497	DE	On-Demand	Anodyne	ADRB1	59	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H]1C(=O)NCc1ccco1)C2	ZINC000819143503	GD	On-Demand	Anodyne	F2	42	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H]1C(=O)NCc1ccco1)C2	ZINC000819143503	GD	On-Demand	Anodyne	PREP	44	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H]1C(=O)NCc1ccco1)C2	ZINC000819143503	GD	On-Demand	Anodyne	LGMN	59	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1C(=O)NCc1ccco1)C2	ZINC000819143504	GD	On-Demand	Anodyne	F2	42	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1C(=O)NCc1ccco1)C2	ZINC000819143504	GD	On-Demand	Anodyne	PREP	44	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1C(=O)NCc1ccco1)C2	ZINC000819143504	GD	On-Demand	Anodyne	LGMN	59	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1)C2	ZINC000819143505	GD	On-Demand	Anodyne	F2	42	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1)C2	ZINC000819143505	GD	On-Demand	Anodyne	PREP	44	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1)C2	ZINC000819143505	GD	On-Demand	Anodyne	LGMN	59	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1)C2	ZINC000819143506	GD	On-Demand	Anodyne	F2	42	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1)C2	ZINC000819143506	GD	On-Demand	Anodyne	PREP	44	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1)C2	ZINC000819143506	GD	On-Demand	Anodyne	LGMN	59	32
CCN1CC[C@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819143507	FE	On-Demand	Mild	PAPA1_CARPA	40	54
CCN1CC[C@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819143509	FE	On-Demand	Mild	PAPA1_CARPA	40	54
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819143512	EE	On-Demand	Mild	ADRB2	42	47
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819143512	EE	On-Demand	Mild	ADRB1	69	47
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819143512	EE	On-Demand	Mild	ADRB3	38	47
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819143513	EE	On-Demand	Mild	ADRB2	42	47
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819143513	EE	On-Demand	Mild	ADRB1	69	47
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819143513	EE	On-Demand	Mild	ADRB3	38	47
Cc1noc(C)c1CCCNC[C@H](O)COCc1ccccc1	ZINC000819143527	DE	On-Demand	Anodyne	ADRB2	25	42
Cc1noc(C)c1CCCNC[C@@H](O)COCc1ccccc1	ZINC000819143528	DE	On-Demand	Anodyne	ADRB2	25	42
Cc1noc(C)c1CCCNC[C@H](O)COc1ccccc1	ZINC000819143532	DE	On-Demand	Anodyne	ADRB2	64	55
Cc1noc(C)c1CCCNC[C@H](O)COc1ccccc1	ZINC000819143532	DE	On-Demand	Anodyne	ADRB1	90	49
Cc1noc(C)c1CCCNC[C@H](O)COc1ccccc1	ZINC000819143532	DE	On-Demand	Anodyne	ADRB3	57	49
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccccc1	ZINC000819143533	DE	On-Demand	Anodyne	ADRB2	64	55
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccccc1	ZINC000819143533	DE	On-Demand	Anodyne	ADRB1	90	49
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccccc1	ZINC000819143533	DE	On-Demand	Anodyne	ADRB3	57	49
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(F)cc1	ZINC000819143545	DE	On-Demand	Anodyne	ADRB2	50	48
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(F)cc1	ZINC000819143545	DE	On-Demand	Anodyne	ADRB1	76	48
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(F)cc1	ZINC000819143545	DE	On-Demand	Anodyne	ADRB3	44	48
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819143546	DE	On-Demand	Anodyne	ADRB2	50	48
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819143546	DE	On-Demand	Anodyne	ADRB1	76	48
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819143546	DE	On-Demand	Anodyne	ADRB3	44	48
O=C(Nc1ccc(Cl)cn1)C(F)=C1CCC1	ZINC000819143555	BG	On-Demand	Anodyne	F10	38	40
Cc1noc(C)c1CCCNC[C@H](O)c1cccc(F)c1	ZINC000819143572	CF	On-Demand	Anodyne	ADRB1	23	41
Cc1noc(C)c1CCCNC[C@H](O)c1cccc(F)c1	ZINC000819143572	CF	On-Demand	Anodyne	ADRB3	38	41
Cc1noc(C)c1CCCNC[C@@H](O)c1cccc(F)c1	ZINC000819143573	CF	On-Demand	Anodyne	ADRB1	23	41
Cc1noc(C)c1CCCNC[C@@H](O)c1cccc(F)c1	ZINC000819143573	CF	On-Demand	Anodyne	ADRB3	38	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1c(C(C)C)cccc1C(C)C)C2	ZINC000819143576	FJ	On-Demand	Anodyne	SOAT1	42	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1c(C(C)C)cccc1C(C)C)C2	ZINC000819143577	FJ	On-Demand	Anodyne	SOAT1	42	39
Cc1noc(C)c1CCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819143586	EE	On-Demand	Bother	ADRB2	35	48
Cc1noc(C)c1CCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819143586	EE	On-Demand	Bother	ADRB1	45	48
Cc1noc(C)c1CCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819143586	EE	On-Demand	Bother	ADRB3	33	48
Cc1noc(C)c1CCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819143587	EE	On-Demand	Bother	ADRB2	35	48
Cc1noc(C)c1CCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819143587	EE	On-Demand	Bother	ADRB1	45	48
Cc1noc(C)c1CCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819143587	EE	On-Demand	Bother	ADRB3	33	48
Cc1noc(C)c1CCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819143595	FG	On-Demand	Anodyne	ADRB2	30	43
Cc1noc(C)c1CCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819143595	FG	On-Demand	Anodyne	ADRB1	56	34
Cc1noc(C)c1CCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819143595	FG	On-Demand	Anodyne	ADRB3	15	40
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819143596	FG	On-Demand	Anodyne	ADRB2	30	43
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819143596	FG	On-Demand	Anodyne	ADRB1	56	34
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819143596	FG	On-Demand	Anodyne	ADRB3	15	40
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819143631	CG	On-Demand	Anodyne	ADRB1	36	42
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819143631	CG	On-Demand	Anodyne	ADRB3	51	43
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819143631	CG	On-Demand	Anodyne	CYP3A4	47	35
C[C@@H]1CCCC[C@H]1C(=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000819143632	CG	On-Demand	Anodyne	ADRB1	36	42
C[C@@H]1CCCC[C@H]1C(=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000819143632	CG	On-Demand	Anodyne	ADRB3	51	43
C[C@@H]1CCCC[C@H]1C(=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000819143632	CG	On-Demand	Anodyne	CYP3A4	47	35
C[C@@H]1CCCC[C@H]1C(=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819143633	CG	On-Demand	Anodyne	ADRB1	36	42
C[C@@H]1CCCC[C@H]1C(=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819143633	CG	On-Demand	Anodyne	ADRB3	51	43
C[C@@H]1CCCC[C@H]1C(=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819143633	CG	On-Demand	Anodyne	CYP3A4	47	35
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000819143634	CG	On-Demand	Anodyne	ADRB1	36	42
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000819143634	CG	On-Demand	Anodyne	ADRB3	51	43
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000819143634	CG	On-Demand	Anodyne	CYP3A4	47	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccccc1COc1ccccc1)C2	ZINC000819143660	GI	On-Demand	Anodyne	ADAM17	43	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccccc1COc1ccccc1)C2	ZINC000819143661	GI	On-Demand	Anodyne	ADAM17	43	39
Cc1noc(C)c1CCCNC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819143670	FH	On-Demand	Anodyne	ADRB2	18	41
Cc1noc(C)c1CCCNC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819143671	FH	On-Demand	Anodyne	ADRB2	18	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1	ZINC000819143674	GD	On-Demand	Anodyne	F2	45	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1	ZINC000819143674	GD	On-Demand	Anodyne	PLG	20	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1	ZINC000819143674	GD	On-Demand	Anodyne	CELA1	35	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1	ZINC000819143674	GD	On-Demand	Anodyne	CMA1	30	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1	ZINC000819143674	GD	On-Demand	Anodyne	TRY1_BOVIN	42	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1	ZINC000819143674	GD	On-Demand	Anodyne	PREP	62	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1	ZINC000819143674	GD	On-Demand	Anodyne	XIAP	21	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1C(=O)NCc1ccco1	ZINC000819143674	GD	On-Demand	Anodyne	WNT3	41	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1C(=O)NCc1ccco1	ZINC000819143675	GD	On-Demand	Anodyne	F2	45	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1C(=O)NCc1ccco1	ZINC000819143675	GD	On-Demand	Anodyne	PLG	20	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1C(=O)NCc1ccco1	ZINC000819143675	GD	On-Demand	Anodyne	CELA1	35	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1C(=O)NCc1ccco1	ZINC000819143675	GD	On-Demand	Anodyne	CMA1	30	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1C(=O)NCc1ccco1	ZINC000819143675	GD	On-Demand	Anodyne	TRY1_BOVIN	42	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1C(=O)NCc1ccco1	ZINC000819143675	GD	On-Demand	Anodyne	PREP	62	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1C(=O)NCc1ccco1	ZINC000819143675	GD	On-Demand	Anodyne	XIAP	21	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1C(=O)NCc1ccco1	ZINC000819143675	GD	On-Demand	Anodyne	WNT3	41	33
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819143678	FG	On-Demand	Anodyne	ADRB2	55	55
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819143678	FG	On-Demand	Anodyne	ADRB1	68	47
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819143678	FG	On-Demand	Anodyne	ADRB3	45	47
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819143678	FG	On-Demand	Anodyne	ACOX1	49	34
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819143679	FG	On-Demand	Anodyne	ADRB2	55	55
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819143679	FG	On-Demand	Anodyne	ADRB1	68	47
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819143679	FG	On-Demand	Anodyne	ADRB3	45	47
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819143679	FG	On-Demand	Anodyne	ACOX1	49	34
Cc1noc(C)c1CCCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819143688	FD	On-Demand	Anodyne	ADRB2	17	43
Cc1noc(C)c1CCCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819143688	FD	On-Demand	Anodyne	ADRB3	51	35
Cc1noc(C)c1CCCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819143689	FD	On-Demand	Anodyne	ADRB2	17	43
Cc1noc(C)c1CCCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819143689	FD	On-Demand	Anodyne	ADRB3	51	35
C[C@H](CC(=O)NC[C@@H](O)c1cccc(Cl)c1)n1cccn1	ZINC000819143697	DE	On-Demand	Anodyne	ADRB1	28	43
C[C@H](CC(=O)NC[C@@H](O)c1cccc(Cl)c1)n1cccn1	ZINC000819143697	DE	On-Demand	Anodyne	ADRB3	43	43
C[C@@H](CC(=O)NC[C@H](O)c1cccc(Cl)c1)n1cccn1	ZINC000819143698	DE	On-Demand	Anodyne	ADRB1	28	43
C[C@@H](CC(=O)NC[C@H](O)c1cccc(Cl)c1)n1cccn1	ZINC000819143698	DE	On-Demand	Anodyne	ADRB3	43	43
C[C@H](CC(=O)NC[C@H](O)c1cccc(Cl)c1)n1cccn1	ZINC000819143699	DE	On-Demand	Anodyne	ADRB1	28	43
C[C@H](CC(=O)NC[C@H](O)c1cccc(Cl)c1)n1cccn1	ZINC000819143699	DE	On-Demand	Anodyne	ADRB3	43	43
C[C@@H](CC(=O)NC[C@@H](O)c1cccc(Cl)c1)n1cccn1	ZINC000819143700	DE	On-Demand	Anodyne	ADRB1	28	43
C[C@@H](CC(=O)NC[C@@H](O)c1cccc(Cl)c1)n1cccn1	ZINC000819143700	DE	On-Demand	Anodyne	ADRB3	43	43
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819143723	CG	On-Demand	Mild	ADRB1	34	47
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819143723	CG	On-Demand	Mild	ADRB3	48	47
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000819143724	CG	On-Demand	Mild	ADRB1	34	47
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000819143724	CG	On-Demand	Mild	ADRB3	48	47
Cc1noc(C)c1CCCNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819143734	FH	On-Demand	Anodyne	KIT	15	41
Cc1noc(C)c1CCCNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819143734	FH	On-Demand	Anodyne	LCK	25	40
Cc1noc(C)c1CCCNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819143734	FH	On-Demand	Anodyne	BTK	19	40
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(NC(=O)c2ccncc2)c1	ZINC000819143742	FF	On-Demand	Anodyne	KCNK3	61	43
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(NC(=O)c2ccncc2)c1	ZINC000819143743	FF	On-Demand	Anodyne	KCNK3	61	43
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(NC(=O)c2ccncc2)c1	ZINC000819143744	FF	On-Demand	Anodyne	KCNK3	61	43
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(NC(=O)c2ccncc2)c1	ZINC000819143745	FF	On-Demand	Anodyne	KCNK3	61	43
CC(=O)c1ccc(OC[C@@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819143764	EE	On-Demand	Anodyne	ADRB2	46	46
CC(=O)c1ccc(OC[C@@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819143764	EE	On-Demand	Anodyne	ADRB1	77	46
CC(=O)c1ccc(OC[C@@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819143764	EE	On-Demand	Anodyne	ADRB3	45	46
CC(=O)c1ccc(OC[C@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819143765	EE	On-Demand	Anodyne	ADRB2	46	46
CC(=O)c1ccc(OC[C@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819143765	EE	On-Demand	Anodyne	ADRB1	77	46
CC(=O)c1ccc(OC[C@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819143765	EE	On-Demand	Anodyne	ADRB3	45	46
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819143766	FH	On-Demand	Anodyne	ADRB2	43	45
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819143766	FH	On-Demand	Anodyne	ADRB1	58	45
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819143766	FH	On-Demand	Anodyne	GRIN1	30	50
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819143766	FH	On-Demand	Anodyne	ADRB3	37	45
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819143767	FH	On-Demand	Anodyne	ADRB2	43	45
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819143767	FH	On-Demand	Anodyne	ADRB1	58	45
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819143767	FH	On-Demand	Anodyne	GRIN1	30	50
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819143767	FH	On-Demand	Anodyne	ADRB3	37	45
Cc1noc(C)c1CCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819143778	FG	On-Demand	Anodyne	ADRB2	44	56
Cc1noc(C)c1CCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819143778	FG	On-Demand	Anodyne	ADRB1	60	38
Cc1noc(C)c1CCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819143778	FG	On-Demand	Anodyne	ADRB3	28	54
Cc1noc(C)c1CCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819143778	FG	On-Demand	Anodyne	CYP2D6	17	43
Cc1noc(C)c1CCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819143779	FG	On-Demand	Anodyne	ADRB2	44	56
Cc1noc(C)c1CCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819143779	FG	On-Demand	Anodyne	ADRB1	60	38
Cc1noc(C)c1CCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819143779	FG	On-Demand	Anodyne	ADRB3	28	54
Cc1noc(C)c1CCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819143779	FG	On-Demand	Anodyne	CYP2D6	17	43
CCC1CCC(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819143780	FH	On-Demand	Mild	PAPA1_CARPA	45	57
CCC1CCC(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819143780	FH	On-Demand	Mild	CTSK	18	51
CCC1CCC(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819143781	FH	On-Demand	Mild	PAPA1_CARPA	45	57
CCC1CCC(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819143781	FH	On-Demand	Mild	CTSK	18	51
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(Br)cc1	ZINC000819143786	GG	On-Demand	Anodyne	ADRB2	46	48
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(Br)cc1	ZINC000819143786	GG	On-Demand	Anodyne	ADRB1	67	48
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(Br)cc1	ZINC000819143786	GG	On-Demand	Anodyne	ADRB3	40	48
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000819143787	GG	On-Demand	Anodyne	ADRB2	46	48
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000819143787	GG	On-Demand	Anodyne	ADRB1	67	48
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000819143787	GG	On-Demand	Anodyne	ADRB3	40	48
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)Nc3ccccc3O)nn2)C1	ZINC000819143790	GF	On-Demand	Anodyne	PREP	19	40
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)Nc3ccccc3O)nn2)C1	ZINC000819143791	GF	On-Demand	Anodyne	PREP	19	40
CC(=O)c1cccc(OC[C@@H](O)CNCCCc2c(C)noc2C)c1	ZINC000819143793	EE	On-Demand	Anodyne	ADRB2	44	45
CC(=O)c1cccc(OC[C@@H](O)CNCCCc2c(C)noc2C)c1	ZINC000819143793	EE	On-Demand	Anodyne	ADRB1	66	43
CC(=O)c1cccc(OC[C@@H](O)CNCCCc2c(C)noc2C)c1	ZINC000819143793	EE	On-Demand	Anodyne	ADRB3	41	43
CC(=O)c1cccc(OC[C@@H](O)CNCCCc2c(C)noc2C)c1	ZINC000819143793	EE	On-Demand	Anodyne	NR1H4	42	36
CC(=O)c1cccc(OC[C@@H](O)CNCCCc2c(C)noc2C)c1	ZINC000819143793	EE	On-Demand	Anodyne	ABCB1	20	45
CC(=O)c1cccc(OC[C@H](O)CNCCCc2c(C)noc2C)c1	ZINC000819143794	EE	On-Demand	Anodyne	ADRB2	44	45
CC(=O)c1cccc(OC[C@H](O)CNCCCc2c(C)noc2C)c1	ZINC000819143794	EE	On-Demand	Anodyne	ADRB1	66	43
CC(=O)c1cccc(OC[C@H](O)CNCCCc2c(C)noc2C)c1	ZINC000819143794	EE	On-Demand	Anodyne	ADRB3	41	43
CC(=O)c1cccc(OC[C@H](O)CNCCCc2c(C)noc2C)c1	ZINC000819143794	EE	On-Demand	Anodyne	NR1H4	42	36
CC(=O)c1cccc(OC[C@H](O)CNCCCc2c(C)noc2C)c1	ZINC000819143794	EE	On-Demand	Anodyne	ABCB1	20	45
CN1CC[C@H](CNC(=O)c2cn([C@H]3CCCN(C(=O)OC(C)(C)C)C3)nn2)C1	ZINC000819143803	GD	On-Demand	Anodyne	CACNA1I	63	36
CN1CC[C@H](CNC(=O)c2cn([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)nn2)C1	ZINC000819143805	GD	On-Demand	Anodyne	CACNA1I	63	36
Cc1noc(C)c1CCCNC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819143831	FH	On-Demand	Anodyne	ADRB2	28	41
Cc1noc(C)c1CCCNC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819143832	FH	On-Demand	Anodyne	ADRB2	28	41
CCN1CC[C@H](CNC(=O)/C=C/[C@H]2CCCO2)C1	ZINC000819143833	CD	On-Demand	Anodyne	CACNA1I	40	31
CCN1CC[C@H](CNC(=O)/C=C\[C@H]2CCCO2)C1	ZINC000819143834	CD	On-Demand	Anodyne	CACNA1I	40	31
CCN1CC[C@H](CNC(=O)/C=C/[C@@H]2CCCO2)C1	ZINC000819143835	CD	On-Demand	Anodyne	CACNA1I	40	31
CCN1CC[C@H](CNC(=O)/C=C\[C@@H]2CCCO2)C1	ZINC000819143836	CD	On-Demand	Anodyne	CACNA1I	40	31
CC(=O)Nc1cccc(CC(=O)Nc2cccc(-c3cn4c(n3)CCCC4)c2)c1	ZINC000819143850	GI	On-Demand	Anodyne	P2RY14	44	35
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819143866	EE	On-Demand	Mild	ADRB2	45	49
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819143866	EE	On-Demand	Mild	ADRB1	70	49
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819143866	EE	On-Demand	Mild	ADRB3	44	49
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819143867	EE	On-Demand	Mild	ADRB2	45	49
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819143867	EE	On-Demand	Mild	ADRB1	70	49
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819143867	EE	On-Demand	Mild	ADRB3	44	49
Cc1ccc(OC[C@@H](O)CNCCCc2c(C)noc2C)c(C)c1	ZINC000819143892	EF	On-Demand	Anodyne	ADRB2	20	45
Cc1ccc(OC[C@H](O)CNCCCc2c(C)noc2C)c(C)c1	ZINC000819143893	EF	On-Demand	Anodyne	ADRB2	20	45
Cc1noc(C)c1CCCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819143904	EE	On-Demand	Bother	ADRB2	32	43
Cc1noc(C)c1CCCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819143904	EE	On-Demand	Bother	ADRB1	52	35
Cc1noc(C)c1CCCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819143904	EE	On-Demand	Bother	ADRB3	21	40
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819143905	EE	On-Demand	Bother	ADRB2	32	43
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819143905	EE	On-Demand	Bother	ADRB1	52	35
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819143905	EE	On-Demand	Bother	ADRB3	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1Cc1ccc(F)cc1)C2	ZINC000819143906	FG	On-Demand	Anodyne	CCR3	56	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1Cc1ccc(F)cc1)C2	ZINC000819143907	FG	On-Demand	Anodyne	CCR3	56	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H]1Cc1ccc(F)cc1)C2	ZINC000819143908	FG	On-Demand	Anodyne	CCR3	56	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H]1Cc1ccc(F)cc1)C2	ZINC000819143909	FG	On-Demand	Anodyne	CCR3	56	36
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819143918	EF	On-Demand	Anodyne	ADRB2	46	48
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819143918	EF	On-Demand	Anodyne	ADRB1	69	48
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819143918	EF	On-Demand	Anodyne	GRIN1	20	48
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819143918	EF	On-Demand	Anodyne	ADRB3	43	48
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819143919	EF	On-Demand	Anodyne	ADRB2	46	48
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819143919	EF	On-Demand	Anodyne	ADRB1	69	48
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819143919	EF	On-Demand	Anodyne	GRIN1	20	48
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819143919	EF	On-Demand	Anodyne	ADRB3	43	48
C=CCC1(C(=O)NC[C@H](O)c2cccc(Cl)c2)CCOCC1	ZINC000819143940	DF	On-Demand	Mild	ADRB1	26	42
C=CCC1(C(=O)NC[C@H](O)c2cccc(Cl)c2)CCOCC1	ZINC000819143940	DF	On-Demand	Mild	ADRB3	41	42
C=CCC1(C(=O)NC[C@@H](O)c2cccc(Cl)c2)CCOCC1	ZINC000819143941	DF	On-Demand	Mild	ADRB1	26	42
C=CCC1(C(=O)NC[C@@H](O)c2cccc(Cl)c2)CCOCC1	ZINC000819143941	DF	On-Demand	Mild	ADRB3	41	42
Cc1noc(C)c1CCCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819143956	GJ	On-Demand	Anodyne	LTA4H	50	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H]1CCN(CC(F)(F)F)C1	ZINC000819143967	FD	On-Demand	Anodyne	CACNA1I	47	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H]1CCN(CC(F)(F)F)C1	ZINC000819143968	FD	On-Demand	Anodyne	CACNA1I	47	33
O=C(/C=C/[C@@H]1CCCO1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819143978	CE	On-Demand	Anodyne	ADRB3	41	42
O=C(/C=C/[C@@H]1CCCO1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819143978	CE	On-Demand	Anodyne	CYP3A4	45	33
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819143979	CE	On-Demand	Anodyne	ADRB3	41	42
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819143979	CE	On-Demand	Anodyne	CYP3A4	45	33
O=C(/C=C\[C@@H]1CCCO1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819143980	CE	On-Demand	Anodyne	ADRB3	41	42
O=C(/C=C\[C@@H]1CCCO1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819143980	CE	On-Demand	Anodyne	CYP3A4	45	33
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819143981	CE	On-Demand	Anodyne	ADRB3	41	42
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819143981	CE	On-Demand	Anodyne	CYP3A4	45	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819143982	FE	On-Demand	Anodyne	ADRB1	29	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819143982	FE	On-Demand	Anodyne	ADRB3	47	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819143982	FE	On-Demand	Anodyne	CYP3A4	45	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000819143983	FE	On-Demand	Anodyne	ADRB1	29	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000819143983	FE	On-Demand	Anodyne	ADRB3	47	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000819143983	FE	On-Demand	Anodyne	CYP3A4	45	37
Cc1noc(C)c1CCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819143993	FG	On-Demand	Anodyne	ADRB2	33	41
Cc1noc(C)c1CCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819143993	FG	On-Demand	Anodyne	ADRB1	39	40
Cc1noc(C)c1CCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819143993	FG	On-Demand	Anodyne	PDS	45	42
Cc1noc(C)c1CCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819143994	FG	On-Demand	Anodyne	ADRB2	33	41
Cc1noc(C)c1CCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819143994	FG	On-Demand	Anodyne	ADRB1	39	40
Cc1noc(C)c1CCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819143994	FG	On-Demand	Anodyne	PDS	45	42
CSc1ccc(OC[C@@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819144005	FF	On-Demand	Anodyne	ADRB2	41	47
CSc1ccc(OC[C@@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819144005	FF	On-Demand	Anodyne	ADRB1	62	47
CSc1ccc(OC[C@@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819144005	FF	On-Demand	Anodyne	ADRB3	38	47
CSc1ccc(OC[C@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819144006	FF	On-Demand	Anodyne	ADRB2	41	47
CSc1ccc(OC[C@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819144006	FF	On-Demand	Anodyne	ADRB1	62	47
CSc1ccc(OC[C@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819144006	FF	On-Demand	Anodyne	ADRB3	38	47
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819144007	FH	On-Demand	Anodyne	ADRB2	45	47
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819144007	FH	On-Demand	Anodyne	ADRB1	63	47
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819144007	FH	On-Demand	Anodyne	ADRB3	38	47
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819144008	FH	On-Demand	Anodyne	ADRB2	45	47
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819144008	FH	On-Demand	Anodyne	ADRB1	63	47
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819144008	FH	On-Demand	Anodyne	ADRB3	38	47
Cc1noc(C)c1CCCNC[C@H](O)COc1ccccc1Cl	ZINC000819144017	EF	On-Demand	Anodyne	ADRB2	37	54
Cc1noc(C)c1CCCNC[C@H](O)COc1ccccc1Cl	ZINC000819144017	EF	On-Demand	Anodyne	ADRB1	53	34
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccccc1Cl	ZINC000819144018	EF	On-Demand	Anodyne	ADRB2	37	54
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccccc1Cl	ZINC000819144018	EF	On-Demand	Anodyne	ADRB1	53	34
CC(=O)Nc1ccc(OC[C@@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819144035	FE	On-Demand	Anodyne	ADRB2	49	58
CC(=O)Nc1ccc(OC[C@@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819144035	FE	On-Demand	Anodyne	ADRB1	87	58
CC(=O)Nc1ccc(OC[C@@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819144035	FE	On-Demand	Anodyne	GRIN1	23	45
CC(=O)Nc1ccc(OC[C@@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819144035	FE	On-Demand	Anodyne	ADRB3	55	58
CC(=O)Nc1ccc(OC[C@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819144036	FE	On-Demand	Anodyne	ADRB2	49	58
CC(=O)Nc1ccc(OC[C@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819144036	FE	On-Demand	Anodyne	ADRB1	87	58
CC(=O)Nc1ccc(OC[C@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819144036	FE	On-Demand	Anodyne	GRIN1	23	45
CC(=O)Nc1ccc(OC[C@H](O)CNCCCc2c(C)noc2C)cc1	ZINC000819144036	FE	On-Demand	Anodyne	ADRB3	55	58
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(-c3nc(C)c(C)o3)cc1)C2	ZINC000819144058	GH	On-Demand	Anodyne	PDE8B	49	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(-c3nc(C)c(C)o3)cc1)C2	ZINC000819144059	GH	On-Demand	Anodyne	PDE8B	49	35
O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cc2c(cn1)OCCO2	ZINC000819144071	ED	On-Demand	Anodyne	ADRB1	25	40
O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cc2c(cn1)OCCO2	ZINC000819144071	ED	On-Demand	Anodyne	ADRB3	39	43
O=C(NC[C@@H](O)c1cccc(Cl)c1)c1cc2c(cn1)OCCO2	ZINC000819144071	ED	On-Demand	Anodyne	CYP3A4	44	32
O=C(NC[C@H](O)c1cccc(Cl)c1)c1cc2c(cn1)OCCO2	ZINC000819144072	ED	On-Demand	Anodyne	ADRB1	25	40
O=C(NC[C@H](O)c1cccc(Cl)c1)c1cc2c(cn1)OCCO2	ZINC000819144072	ED	On-Demand	Anodyne	ADRB3	39	43
O=C(NC[C@H](O)c1cccc(Cl)c1)c1cc2c(cn1)OCCO2	ZINC000819144072	ED	On-Demand	Anodyne	CYP3A4	44	32
Cc1noc(C)c1CCCNCCC(=O)Nc1ccccc1	ZINC000819144075	DF	On-Demand	Anodyne	HDAC10	22	41
Cc1noc(C)c1CCCNCCC(=O)Nc1ccccc1	ZINC000819144075	DF	On-Demand	Anodyne	HDAC2	15	41
Cc1noc(C)c1CCCNCCC(=O)Nc1ccccc1	ZINC000819144075	DF	On-Demand	Anodyne	HDAC3	17	41
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(COc2ccccc2)c1	ZINC000819144076	EH	On-Demand	Anodyne	PDS	42	33
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(COc2ccccc2)c1	ZINC000819144077	EH	On-Demand	Anodyne	PDS	42	33
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(COc2ccccc2)c1	ZINC000819144078	EH	On-Demand	Anodyne	PDS	42	33
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(COc2ccccc2)c1	ZINC000819144079	EH	On-Demand	Anodyne	PDS	42	33
Cc1noc(C)c1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819144080	DG	On-Demand	Anodyne	ADRB2	47	39
Cc1noc(C)c1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819144080	DG	On-Demand	Anodyne	ADRB1	53	46
Cc1noc(C)c1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819144080	DG	On-Demand	Anodyne	ADRB3	66	46
Cc1noc(C)c1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819144081	DG	On-Demand	Anodyne	ADRB2	47	39
Cc1noc(C)c1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819144081	DG	On-Demand	Anodyne	ADRB1	53	46
Cc1noc(C)c1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819144081	DG	On-Demand	Anodyne	ADRB3	66	46
Cc1noc(C)c1CCCNC[C@H](O)COCc1ccc(Cl)cc1	ZINC000819144085	FG	On-Demand	Anodyne	ADRB1	15	40
Cc1noc(C)c1CCCNC[C@@H](O)COCc1ccc(Cl)cc1	ZINC000819144086	FG	On-Demand	Anodyne	ADRB1	15	40
CN1CC[C@H](CNC(=O)CC[C@@H](CC2CCCCC2)NC(=O)OC(C)(C)C)C1	ZINC000819144094	GH	On-Demand	Anodyne	REN	54	42
CN1CC[C@@H](CNC(=O)CC[C@@H](CC2CCCCC2)NC(=O)OC(C)(C)C)C1	ZINC000819144095	GH	On-Demand	Anodyne	REN	54	42
CN1CC[C@@H](CNC(=O)CC[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)C1	ZINC000819144096	GH	On-Demand	Anodyne	REN	54	42
CN1CC[C@H](CNC(=O)CC[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)C1	ZINC000819144097	GH	On-Demand	Anodyne	REN	54	42
O=C(NCc1ccco1)[C@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819144102	DE	On-Demand	Anodyne	F2	43	36
O=C(NCc1ccco1)[C@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819144102	DE	On-Demand	Anodyne	XIAP	30	55
O=C(NCc1ccco1)[C@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819144102	DE	On-Demand	Anodyne	TMPRSS11D	50	32
O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819144103	DE	On-Demand	Anodyne	F2	43	36
O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819144103	DE	On-Demand	Anodyne	XIAP	30	55
O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819144103	DE	On-Demand	Anodyne	TMPRSS11D	50	32
O=C(NC[C@@H](O)c1cccc(Cl)c1)C(F)=C1CCC1	ZINC000819144104	CF	On-Demand	Anodyne	ADRB1	29	43
O=C(NC[C@@H](O)c1cccc(Cl)c1)C(F)=C1CCC1	ZINC000819144104	CF	On-Demand	Anodyne	ADRB3	45	43
O=C(NC[C@H](O)c1cccc(Cl)c1)C(F)=C1CCC1	ZINC000819144105	CF	On-Demand	Anodyne	ADRB1	29	43
O=C(NC[C@H](O)c1cccc(Cl)c1)C(F)=C1CCC1	ZINC000819144105	CF	On-Demand	Anodyne	ADRB3	45	43
C[C@H]1C[C@H](NC[C@H](O)c2ccccc2Cl)CN1C1CC1	ZINC000819144112	CF	On-Demand	Anodyne	OPRL1	43	39
Cc1noc(C)c1CCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819144116	EF	On-Demand	Anodyne	ADRB2	22	58
Cc1noc(C)c1CCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819144116	EF	On-Demand	Anodyne	ADRB1	47	58
Cc1noc(C)c1CCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819144117	EF	On-Demand	Anodyne	ADRB2	22	58
Cc1noc(C)c1CCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819144117	EF	On-Demand	Anodyne	ADRB1	47	58
CC(CNC(=O)c1cc(Cl)c(Cl)[nH]1)CNC(=O)c1cc(Cl)c(Cl)[nH]1	ZINC000819144123	HH	On-Demand	Anodyne	ALPL	55	46
O=C(CC1CC1)NNC(=O)c1cn(CCOc2ccccc2Cl)c2ccccc12	ZINC000819144127	HH	On-Demand	Reactive	CNR1	18	42
O=C(CC1CC1)NNC(=O)c1cn(CCOc2ccccc2Cl)c2ccccc12	ZINC000819144127	HH	On-Demand	Reactive	HRH1	15	43
O=C(CC1CC1)NNC(=O)c1cn(CCOc2ccccc2Cl)c2ccccc12	ZINC000819144127	HH	On-Demand	Reactive	CNR2	26	42
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819144133	IE	On-Demand	Reactive	EPHX2	49	49
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819144133	IE	On-Demand	Reactive	TGM2	20	41
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819144133	IE	On-Demand	Reactive	RBP4	79	33
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819144133	IE	On-Demand	Reactive	SFRP1	123	41
O=C(CC1CC1)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819144133	IE	On-Demand	Reactive	WNT3	79	35
CCN1CCCC[C@@H]1C(=O)NNC(=O)CC1CC1	ZINC000819144136	CC	On-Demand	Reactive	HSD11B1	42	36
CCN1CCCC[C@H]1C(=O)NNC(=O)CC1CC1	ZINC000819144137	CC	On-Demand	Reactive	HSD11B1	42	36
CC(CNC(=O)CNc1ccccc1Cl)CNC(=O)CNc1ccccc1Cl	ZINC000819144138	HG	On-Demand	Anodyne	CXCL8	53	40
CC(C)(C)OC(=O)N1CCc2ccc(C(=O)NNC(=O)CC3CC3)cc2CC1	ZINC000819144142	GF	On-Demand	Reactive	GPR119	44	43
O=C(CSc1nnc(-c2ccc(F)cc2)n1-c1ccccc1)NNC(=O)CC1CC1	ZINC000819144143	IG	On-Demand	Reactive	TGM2	21	43
O=C(CC1CC1)NNC(=O)c1ccc(N2CCOCC2)nc1	ZINC000819144145	DC	On-Demand	Reactive	DGAT1	24	40
O=C(CC1CC1)NNC(=O)c1ccc(N2CCOCC2)nc1	ZINC000819144145	DC	On-Demand	Reactive	HPGDS	34	55
CC(CNC(=O)[C@@H]1CCCCN1C)CNC(=O)[C@@H]1CCCCN1C	ZINC000819144151	EC	On-Demand	Anodyne	TPP2	30	49
CC(CNC(=O)[C@H]1CCCCN1C)CNC(=O)[C@H]1CCCCN1C	ZINC000819144152	EC	On-Demand	Anodyne	TPP2	30	49
C[C@@H](CNC(=O)[C@@H]1CCCCN1C)CNC(=O)[C@H]1CCCCN1C	ZINC000819144153	EC	On-Demand	Anodyne	TPP2	30	49
O=C(CC1CC1)NNC(=O)c1ccc(N2CCCC2)nn1	ZINC000819144154	CC	On-Demand	Reactive	SCD1	61	48
O=C(CC1CC1)NNC(=O)c1ccc(N2CCCC2)nn1	ZINC000819144154	CC	On-Demand	Reactive	SCD	49	45
O=C(CSc1ccc2ccccc2c1)NNC(=O)CC1CC1	ZINC000819144156	DF	On-Demand	Reactive	FAS	44	37
N#Cc1ccc(N2CCC[C@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819144157	DD	On-Demand	Reactive	LGMN	50	32
N#Cc1ccc(N2CCC[C@@H]2C(=O)NNC(=O)CC2CC2)cc1	ZINC000819144158	DD	On-Demand	Reactive	LGMN	50	32
CC(CNC(=O)c1cc(F)ccc1[N+](=O)[O-])CNC(=O)c1cc(F)ccc1[N+](=O)[O-]	ZINC000819144159	HF	On-Demand	Bother	COLA	46	37
COc1cccc(C2(C(=O)NCC(C)CNC(=O)C3(c4cccc(OC)c4)CC3)CC2)c1	ZINC000819144170	IG	On-Demand	Anodyne	DRD4	42	32
COc1cccc(C2(C(=O)NCC(C)CNC(=O)C3(c4cccc(OC)c4)CC3)CC2)c1	ZINC000819144170	IG	On-Demand	Anodyne	MTNR1A	54	47
COc1cccc(C2(C(=O)NCC(C)CNC(=O)C3(c4cccc(OC)c4)CC3)CC2)c1	ZINC000819144170	IG	On-Demand	Anodyne	MTNR1B	48	47
COc1cccc(C2(C(=O)NCC(C)CNC(=O)C3(c4cccc(OC)c4)CC3)CC2)c1	ZINC000819144170	IG	On-Demand	Anodyne	SOAT1	18	43
CC(CNC(=O)c1cc2ccccc2oc1=O)CNC(=O)c1cc2ccccc2oc1=O	ZINC000819144178	IF	On-Demand	Anodyne	MAOB	23	66
CC(CNC(=O)c1cc2ccccc2oc1=O)CNC(=O)c1cc2ccccc2oc1=O	ZINC000819144178	IF	On-Demand	Anodyne	AKR1B10	41	33
CC[C@H](C)[C@H](NC(C)=O)C(=O)NNC(=O)CC1CC1	ZINC000819144179	CC	On-Demand	Reactive	GZMB	30	40
O=C(CC1CC1)NNC(=O)c1ccc(OCC(F)(F)F)nc1	ZINC000819144181	DD	On-Demand	Reactive	HPGDS	33	41
CC(CNC(=O)[C@@H]1C[C@H]1c1ccccc1)CNC(=O)[C@@H]1C[C@H]1c1ccccc1	ZINC000819144182	GG	On-Demand	Anodyne	PLD1	16	41
CCCc1c(C(=O)NNC(=O)CC2CC2)cnn1-c1ccccc1C	ZINC000819144187	EF	On-Demand	Reactive	GPR142	44	35
O=C(CC1CC1)NNC(=O)c1cc(-c2cccc(F)c2)no1	ZINC000819144189	DE	On-Demand	Reactive	VCP	20	42
O=C(CCCCc1ccc(I)cc1)NNC(=O)CC1CC1	ZINC000819144192	HF	On-Demand	Reactive	LUXR	16	42
O=C(CC1CC1)NNC(=O)c1cc(Cl)ccc1OC(F)F	ZINC000819144196	DF	On-Demand	Reactive	PDE4D	17	42
CC(CNC(=O)c1ccc2c(c1)CCN2C)CNC(=O)c1ccc2c(c1)CCN2C	ZINC000819144198	HE	On-Demand	Anodyne	SRD5A1	22	40
CC(CNC(=O)c1ccc2c(c1)CCN2C)CNC(=O)c1ccc2c(c1)CCN2C	ZINC000819144198	HE	On-Demand	Anodyne	DRD4	45	35
CC(CNC(=O)c1ccc2c(c1)CCN2C)CNC(=O)c1ccc2c(c1)CCN2C	ZINC000819144198	HE	On-Demand	Anodyne	F3	58	32
O=C(Cc1cccc(OCc2ccccc2Cl)c1)NNC(=O)CC1CC1	ZINC000819144202	FG	On-Demand	Reactive	FABP4	15	40
O=C(Cc1cccc(OCc2ccccc2Cl)c1)NNC(=O)CC1CC1	ZINC000819144202	FG	On-Demand	Reactive	ADAM17	16	42
O=C(Cc1cccc(OCc2ccccc2Cl)c1)NNC(=O)CC1CC1	ZINC000819144202	FG	On-Demand	Reactive	FABP5	27	40
O=C(CC1CC1)NNC(=O)c1cc(-c2ccco2)n(-c2cccc(Cl)c2)n1	ZINC000819144204	GG	On-Demand	Reactive	RPA1	64	34
CCN1CC[C@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819144227	BD	On-Demand	Anodyne	CACNA1I	49	32
CC(C)c1cccc(C(C)C)c1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819144230	DJ	On-Demand	Anodyne	SOAT1	50	42
CC(C)c1cccc(C(C)C)c1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819144231	DJ	On-Demand	Anodyne	SOAT1	50	42
CC(C)c1cccc(C(C)C)c1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819144232	DJ	On-Demand	Anodyne	SOAT1	50	42
CC(C)c1cccc(C(C)C)c1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819144233	DJ	On-Demand	Anodyne	SOAT1	50	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(C(N)=O)nc2)CC1	ZINC000819144234	GD	On-Demand	Anodyne	GPR119	53	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(C(N)=O)nc2)CC1	ZINC000819144235	GD	On-Demand	Anodyne	GPR119	53	47
Cc1noc(C)c1CCCNC[C@H](O)c1ccccc1	ZINC000819144236	CF	On-Demand	Anodyne	ADRB2	23	44
Cc1noc(C)c1CCCNC[C@H](O)c1ccccc1	ZINC000819144236	CF	On-Demand	Anodyne	ADRB1	33	40
Cc1noc(C)c1CCCNC[C@H](O)c1ccccc1	ZINC000819144236	CF	On-Demand	Anodyne	ADRB3	59	40
Cc1noc(C)c1CCCNC[C@@H](O)c1ccccc1	ZINC000819144237	CF	On-Demand	Anodyne	ADRB2	23	44
Cc1noc(C)c1CCCNC[C@@H](O)c1ccccc1	ZINC000819144237	CF	On-Demand	Anodyne	ADRB1	33	40
Cc1noc(C)c1CCCNC[C@@H](O)c1ccccc1	ZINC000819144237	CF	On-Demand	Anodyne	ADRB3	59	40
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000819144242	FH	On-Demand	Anodyne	ADRB2	18	41
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000819144243	FH	On-Demand	Anodyne	ADRB2	18	41
O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819144265	DD	On-Demand	Anodyne	F2	41	36
O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819144265	DD	On-Demand	Anodyne	PREP	36	40
O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819144265	DD	On-Demand	Anodyne	XIAP	16	53
O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819144265	DD	On-Demand	Anodyne	TMPRSS11D	56	33
O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819144266	DD	On-Demand	Anodyne	F2	41	36
O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819144266	DD	On-Demand	Anodyne	PREP	36	40
O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819144266	DD	On-Demand	Anodyne	XIAP	16	53
O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819144266	DD	On-Demand	Anodyne	TMPRSS11D	56	33
O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819144267	DD	On-Demand	Anodyne	F2	41	36
O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819144267	DD	On-Demand	Anodyne	PREP	36	40
O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819144267	DD	On-Demand	Anodyne	XIAP	16	53
O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819144267	DD	On-Demand	Anodyne	TMPRSS11D	56	33
O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819144268	DD	On-Demand	Anodyne	F2	41	36
O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819144268	DD	On-Demand	Anodyne	PREP	36	40
O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819144268	DD	On-Demand	Anodyne	XIAP	16	53
O=C(NCc1ccco1)[C@@H]1CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819144268	DD	On-Demand	Anodyne	TMPRSS11D	56	33
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819144296	FE	On-Demand	Anodyne	ADRB1	40	38
Cc1noc(C)c1CCCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819144296	FE	On-Demand	Anodyne	ADRB3	28	40
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819144297	FE	On-Demand	Anodyne	ADRB1	40	38
Cc1noc(C)c1CCCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819144297	FE	On-Demand	Anodyne	ADRB3	28	40
Cc1cc(F)ccc1[C@@H](O)CNCc1ccc(C(N)=O)nc1	ZINC000819144331	DD	On-Demand	Anodyne	LEF	63	33
COc1cccc([C@H](O)C(=O)NC[C@@H](C)CNC(=O)[C@H](O)c2cccc(OC)c2)c1	ZINC000819144353	HD	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](O)C(=O)NC[C@@H](C)CNC(=O)[C@H](O)c2cccc(OC)c2)c1	ZINC000819144353	HD	On-Demand	Anodyne	NQO2	21	43
COc1cccc([C@H](O)C(=O)NC[C@@H](C)CNC(=O)[C@H](O)c2cccc(OC)c2)c1	ZINC000819144353	HD	On-Demand	Anodyne	MTNR1A	59	50
COc1cccc([C@H](O)C(=O)NC[C@@H](C)CNC(=O)[C@H](O)c2cccc(OC)c2)c1	ZINC000819144353	HD	On-Demand	Anodyne	MTNR1B	57	50
COc1cccc([C@H](O)C(=O)NCC(C)CNC(=O)[C@@H](O)c2cccc(OC)c2)c1	ZINC000819144354	HD	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](O)C(=O)NCC(C)CNC(=O)[C@@H](O)c2cccc(OC)c2)c1	ZINC000819144354	HD	On-Demand	Anodyne	NQO2	21	43
COc1cccc([C@H](O)C(=O)NCC(C)CNC(=O)[C@@H](O)c2cccc(OC)c2)c1	ZINC000819144354	HD	On-Demand	Anodyne	MTNR1A	59	50
COc1cccc([C@H](O)C(=O)NCC(C)CNC(=O)[C@@H](O)c2cccc(OC)c2)c1	ZINC000819144354	HD	On-Demand	Anodyne	MTNR1B	57	50
O=C(CC1CC1)NNC(=O)c1ccc(Oc2ccc(Br)cc2)nc1	ZINC000819144363	GG	On-Demand	Reactive	LSS	15	40
CO/C(=C\c1ccccc1)C(=O)NCC(C)CNC(=O)/C(=C\c1ccccc1)OC	ZINC000819144371	HG	On-Demand	Anodyne	TLR4	27	47
CO/C(=C\c1ccccc1)C(=O)NCC(C)CNC(=O)/C(=C/c1ccccc1)OC	ZINC000819144372	HG	On-Demand	Anodyne	TLR4	27	47
CO/C(=C/c1ccccc1)C(=O)NCC(C)CNC(=O)/C(=C\c1ccccc1)OC	ZINC000819144373	HG	On-Demand	Anodyne	TLR4	27	47
CC(CNC(=O)c1ccc(-n2ccnc2)nc1)CNC(=O)c1ccc(-n2ccnc2)nc1	ZINC000819144382	ID	On-Demand	Anodyne	CYP27B1	40	39
CC(CNC(=O)[C@@H]1C[C@@H]1Cc1ccccc1)CNC(=O)[C@@H]1C[C@@H]1Cc1ccccc1	ZINC000819144397	HH	On-Demand	Anodyne	MME	42	35
CC(CNC(=O)[C@@H]1C[C@@H]1Cc1ccccc1)CNC(=O)[C@@H]1C[C@@H]1Cc1ccccc1	ZINC000819144397	HH	On-Demand	Anodyne	GALR1	44	31
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)NNC(=O)CC1CC1	ZINC000819144404	FC	On-Demand	Reactive	F2	20	43
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)NNC(=O)CC1CC1	ZINC000819144404	FC	On-Demand	Reactive	PREP	23	50
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)NNC(=O)CC1CC1	ZINC000819144404	FC	On-Demand	Reactive	LGMN	72	35
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)NNC(=O)CC1CC1	ZINC000819144405	FC	On-Demand	Reactive	F2	20	43
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)NNC(=O)CC1CC1	ZINC000819144405	FC	On-Demand	Reactive	PREP	23	50
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)NNC(=O)CC1CC1	ZINC000819144405	FC	On-Demand	Reactive	LGMN	72	35
CC(CNC(=O)c1cccc(CO)c1)CNC(=O)c1cccc(CO)c1	ZINC000819144407	FD	On-Demand	Anodyne	F3	58	34
CC(CNC(=O)c1cccc(CO)c1)CNC(=O)c1cccc(CO)c1	ZINC000819144407	FD	On-Demand	Anodyne	KCNK3	56	37
CC(CNC(=O)C[C@H]1CCc2ccccc21)CNC(=O)C[C@H]1CCc2ccccc21	ZINC000819144410	HI	On-Demand	Anodyne	MTNR1A	30	43
CC(CNC(=O)C[C@H]1CCc2ccccc21)CNC(=O)C[C@H]1CCc2ccccc21	ZINC000819144410	HI	On-Demand	Anodyne	MTNR1B	30	43
CC(CNC(=O)C[C@@H]1CCc2ccccc21)CNC(=O)C[C@@H]1CCc2ccccc21	ZINC000819144412	HI	On-Demand	Anodyne	MTNR1A	30	43
CC(CNC(=O)C[C@@H]1CCc2ccccc21)CNC(=O)C[C@@H]1CCc2ccccc21	ZINC000819144412	HI	On-Demand	Anodyne	MTNR1B	30	43
CC(CNC(=O)c1ccc(Cl)cc1Cl)CNC(=O)c1ccc(Cl)cc1Cl	ZINC000819144414	IK	On-Demand	Anodyne	CNR1	19	42
CC(CNC(=O)c1ccc(Cl)cc1Cl)CNC(=O)c1ccc(Cl)cc1Cl	ZINC000819144414	IK	On-Demand	Anodyne	P2RX7	28	40
CC(CNC(=O)c1ccc(Cl)cc1Cl)CNC(=O)c1ccc(Cl)cc1Cl	ZINC000819144414	IK	On-Demand	Anodyne	ECR	15	44
CC(CNC(=O)c1ccc(Cl)cc1Cl)CNC(=O)c1ccc(Cl)cc1Cl	ZINC000819144414	IK	On-Demand	Anodyne	PYGL	24	43
CC(CNC(=O)c1ccc(Cl)cc1Cl)CNC(=O)c1ccc(Cl)cc1Cl	ZINC000819144414	IK	On-Demand	Anodyne	SLC6A9	55	42
CC(CNC(=O)c1ccc(Cl)cc1Cl)CNC(=O)c1ccc(Cl)cc1Cl	ZINC000819144414	IK	On-Demand	Anodyne	ALPL	52	52
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	ZINC000819144418	FC	On-Demand	Reactive	F2	20	40
O=C(CC1CC1)NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	ZINC000819144418	FC	On-Demand	Reactive	LGMN	40	32
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	ZINC000819144419	FC	On-Demand	Reactive	F2	20	40
O=C(CC1CC1)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	ZINC000819144419	FC	On-Demand	Reactive	LGMN	40	32
O=C(CC1CC1)NNC(=O)c1nccs1	ZINC000819144427	BC	On-Demand	Reactive	MAP1	43	33
CC(CNC(=O)c1ccc(O)c(F)c1)CNC(=O)c1ccc(O)c(F)c1	ZINC000819144436	FE	On-Demand	Anodyne	F3	61	34
CC(CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000819144441	IG	On-Demand	Bother	CACNA1C	54	37
CC(CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000819144441	IG	On-Demand	Bother	CACNA1D	87	37
CC(CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000819144441	IG	On-Demand	Bother	COLA	95	41
CC(CNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)CNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000819144442	IG	On-Demand	Bother	CACNA1C	54	37
CC(CNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)CNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000819144442	IG	On-Demand	Bother	CACNA1D	87	37
CC(CNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)CNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000819144442	IG	On-Demand	Bother	COLA	95	41
CC(CNC(=O)CCn1ccccc1=O)CNC(=O)CCn1ccccc1=O	ZINC000819144444	GC	On-Demand	Anodyne	PSMB5	16	47
CC(CNC(=O)CCn1ccccc1=O)CNC(=O)CCn1ccccc1=O	ZINC000819144444	GC	On-Demand	Anodyne	PSMB1	15	41
O=C(CSc1nnc(-c2ccncc2)n1Cc1ccco1)NNC(=O)CC1CC1	ZINC000819144459	HE	On-Demand	Reactive	HCRTR2	18	52
N#Cc1ccc(OCc2cccc(C(=O)NNC(=O)CC3CC3)c2)cc1	ZINC000819144461	EF	On-Demand	Reactive	MAOB	28	44
N#Cc1ccc(OCc2cccc(C(=O)NNC(=O)CC3CC3)c2)cc1	ZINC000819144461	EF	On-Demand	Reactive	FFAR1	43	40
CC(C)(COc1cc(Cl)cc(Cl)c1)C(=O)NNC(=O)CC1CC1	ZINC000819144470	FG	On-Demand	Reactive	CACNA1I	65	38
O=C(CC1CC1)NNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000819144471	HG	On-Demand	Reactive	KCNMA1	31	43
O=C(CC1CC1)NNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000819144471	HG	On-Demand	Reactive	WDR5	28	42
C#Cc1ccc(C(=O)NCC(C)CNC(=O)c2ccc(C#C)cn2)nc1	ZINC000819144472	ED	On-Demand	Mild	GRM5	15	52
O=C(CCSc1ccccc1)NNC(=O)CC1CC1	ZINC000819144482	CE	On-Demand	Reactive	FAS	24	42
CC(C)(C)OC(=O)N1CCC[C@@H](CC(=O)NNC(=O)CC2CC2)CC1	ZINC000819144492	FE	On-Demand	Reactive	GPR119	45	41
CC(C)(C)OC(=O)N1CCC[C@H](CC(=O)NNC(=O)CC2CC2)CC1	ZINC000819144493	FE	On-Demand	Reactive	GPR119	45	41
O=C(Cc1cccc(OCc2cccc(Cl)c2)c1)NNC(=O)CC1CC1	ZINC000819144500	FG	On-Demand	Reactive	MAOB	53	47
O=C(Cc1cccc(OCc2cccc(Cl)c2)c1)NNC(=O)CC1CC1	ZINC000819144500	FG	On-Demand	Reactive	FFAR1	53	37
O=C(Cc1cccc(OCc2cccc(Cl)c2)c1)NNC(=O)CC1CC1	ZINC000819144500	FG	On-Demand	Reactive	PDS	46	37
CC(CNC(=O)c1cccc(Cl)c1Cl)CNC(=O)c1cccc(Cl)c1Cl	ZINC000819144501	IK	On-Demand	Anodyne	P2RX7	21	51
CC(CNC(=O)c1cccc(Cl)c1Cl)CNC(=O)c1cccc(Cl)c1Cl	ZINC000819144501	IK	On-Demand	Anodyne	ECR	51	51
CC(CNC(=O)c1cccc(Cl)c1Cl)CNC(=O)c1cccc(Cl)c1Cl	ZINC000819144501	IK	On-Demand	Anodyne	ITGAV	21	41
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000819144537	FF	On-Demand	Reactive	MAPK14	20	42
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000819144537	FF	On-Demand	Reactive	CCR3	42	43
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000819144537	FF	On-Demand	Reactive	PRNP	15	40
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000819144537	FF	On-Demand	Reactive	PLAU	15	40
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000819144537	FF	On-Demand	Reactive	BTK	24	41
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000819144537	FF	On-Demand	Reactive	TAAR1	51	40
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000819144537	FF	On-Demand	Reactive	KCNK3	122	57
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000819144537	FF	On-Demand	Reactive	KCNK9	74	43
CC(C)(C(=O)NNC(=O)CC1CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819144538	GG	On-Demand	Reactive	MAOB	15	40
CC(C)(C(=O)NNC(=O)CC1CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819144538	GG	On-Demand	Reactive	LTA4H	29	41
CC(C)(C(=O)NNC(=O)CC1CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819144538	GG	On-Demand	Reactive	ADAM17	17	40
CC(C)(C(=O)NNC(=O)CC1CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819144538	GG	On-Demand	Reactive	FFAR1	47	42
CC(C)(C(=O)NNC(=O)CC1CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819144539	GG	On-Demand	Reactive	MAOB	15	40
CC(C)(C(=O)NNC(=O)CC1CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819144539	GG	On-Demand	Reactive	LTA4H	29	41
CC(C)(C(=O)NNC(=O)CC1CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819144539	GG	On-Demand	Reactive	ADAM17	17	40
CC(C)(C(=O)NNC(=O)CC1CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819144539	GG	On-Demand	Reactive	FFAR1	47	42
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)CC2CC2)cc1	ZINC000819144566	DB	On-Demand	Reactive	CA2	157	50
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)CC2CC2)cc1	ZINC000819144566	DB	On-Demand	Reactive	CA6	29	40
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)CC2CC2)cc1	ZINC000819144566	DB	On-Demand	Reactive	CA1	135	50
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)CC2CC2)cc1	ZINC000819144566	DB	On-Demand	Reactive	CA7	93	50
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)CC2CC2)cc1	ZINC000819144566	DB	On-Demand	Reactive	CA13	30	42
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)CC2CC2)cc1	ZINC000819144566	DB	On-Demand	Reactive	CA5B	80	50
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)CC2CC2)cc1	ZINC000819144566	DB	On-Demand	Reactive	CA4	113	47
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)CC2CC2)cc1	ZINC000819144566	DB	On-Demand	Reactive	CA5A	86	50
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)CC2CC2)cc1	ZINC000819144566	DB	On-Demand	Reactive	CA14	70	48
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)CC2CC2)cc1	ZINC000819144566	DB	On-Demand	Reactive	CA12	99	49
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)CC2CC2)cc1	ZINC000819144566	DB	On-Demand	Reactive	CA9	106	50
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)CC2CC2)cc1	ZINC000819144566	DB	On-Demand	Reactive	CAH_METTE	26	42
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)CC2CC2)cc1	ZINC000819144566	DB	On-Demand	Reactive	CYNT	46	38
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)CC2CC2)cc1	ZINC000819144566	DB	On-Demand	Reactive	NCE103	25	45
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)CC2CC2)cc1	ZINC000819144566	DB	On-Demand	Reactive	CA15	19	42
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)CC2CC2)cc1	ZINC000819144566	DB	On-Demand	Reactive	MTCA1	51	40
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)CC2CC2)cc1	ZINC000819144566	DB	On-Demand	Reactive	P96878_MYCTU	61	40
NS(=O)(=O)c1ccc(CC(=O)NNC(=O)CC2CC2)cc1	ZINC000819144566	DB	On-Demand	Reactive	A6YCJ1_9METZ	31	41
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CC2CC2)(S(C)(=O)=O)CC1	ZINC000819144567	HC	On-Demand	Reactive	GPR119	42	40
CC(CNC(=O)c1cccnc1-n1cccn1)CNC(=O)c1cccnc1-n1cccn1	ZINC000819144572	ID	On-Demand	Anodyne	AMP1_PLAFQ	54	37
N#C[C@H](CCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819144574	CD	On-Demand	Reactive	CTSC	30	41
N#C[C@@H](CCc1ccccc1)C(=O)NNC(=O)CC1CC1	ZINC000819144575	CD	On-Demand	Reactive	CTSC	30	41
Cc1nc(C(=O)NNC(=O)CC2CC2)c(-c2ccccc2)s1	ZINC000819144576	DF	On-Demand	Reactive	HCRTR1	33	42
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NNC(=O)CC1CC1	ZINC000819144581	GC	On-Demand	Reactive	F2	16	41
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NNC(=O)CC1CC1	ZINC000819144582	GC	On-Demand	Reactive	F2	16	41
CC(CNC(=O)Cc1ccccc1CC#N)CNC(=O)Cc1ccccc1CC#N	ZINC000819144583	HE	On-Demand	Mild	CTSL	19	42
CC(CNC(=O)Cc1ccccc1CC#N)CNC(=O)Cc1ccccc1CC#N	ZINC000819144583	HE	On-Demand	Mild	CTSS	18	42
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000819144609	EG	On-Demand	Reactive	SLC6A4	17	42
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000819144609	EG	On-Demand	Reactive	SLC6A3	22	44
O=C(CC1CC1)NNC(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000819144610	EG	On-Demand	Reactive	SLC6A4	17	42
O=C(CC1CC1)NNC(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000819144610	EG	On-Demand	Reactive	SLC6A3	22	44
O=C(CC1CC1)NNC(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000819144611	EG	On-Demand	Reactive	SLC6A4	17	42
O=C(CC1CC1)NNC(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000819144611	EG	On-Demand	Reactive	SLC6A3	22	44
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000819144612	EG	On-Demand	Reactive	SLC6A4	17	42
O=C(CC1CC1)NNC(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000819144612	EG	On-Demand	Reactive	SLC6A3	22	44
CC(CNC(=O)c1c(Cl)cccc1Cl)CNC(=O)c1c(Cl)cccc1Cl	ZINC000819144619	IK	On-Demand	Anodyne	PPIA	25	41
CC(CNC(=O)c1c(Cl)cccc1Cl)CNC(=O)c1c(Cl)cccc1Cl	ZINC000819144619	IK	On-Demand	Anodyne	CXCL8	41	37
CC(CNC(=O)c1c(Cl)cccc1Cl)CNC(=O)c1c(Cl)cccc1Cl	ZINC000819144619	IK	On-Demand	Anodyne	P2RX7	15	48
CC(CNC(=O)c1c(Cl)cccc1Cl)CNC(=O)c1c(Cl)cccc1Cl	ZINC000819144619	IK	On-Demand	Anodyne	ECR	44	35
CC(CNC(=O)c1c(Cl)cccc1Cl)CNC(=O)c1c(Cl)cccc1Cl	ZINC000819144619	IK	On-Demand	Anodyne	ITGAV	23	43
CC(CNC(=O)c1c(Cl)cccc1Cl)CNC(=O)c1c(Cl)cccc1Cl	ZINC000819144619	IK	On-Demand	Anodyne	TYK2	30	40
CC(CNC(=O)c1c(Cl)cccc1Cl)CNC(=O)c1c(Cl)cccc1Cl	ZINC000819144619	IK	On-Demand	Anodyne	ALPL	16	40
CC(CNC(=O)Cc1ccccc1[N+](=O)[O-])CNC(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000819144648	HE	On-Demand	Bother	COLA	145	48
O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NNC(=O)CC1CC1	ZINC000819144649	EC	On-Demand	Reactive	SLC27A4	49	34
O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NNC(=O)CC1CC1	ZINC000819144649	EC	On-Demand	Reactive	LUXR	16	41
O=C(CC1CC1)NNC(=O)c1ccccc1-c1ccc(C(F)(F)F)cc1	ZINC000819144655	FH	On-Demand	Reactive	MTTP	135	50
O=C(CC1CC1)NNC(=O)c1sccc1NC(=O)c1ccc(Br)cc1	ZINC000819144661	HG	On-Demand	Reactive	FAS	30	40
CC(C)n1ncc2c(C(=O)NNC(=O)CC3CC3)cc(-c3ccc4c(c3)OCCO4)nc21	ZINC000819144663	IG	On-Demand	Reactive	EZH2	16	64
C[C@@H](Cc1ccc(F)cc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccc(F)cc1	ZINC000819144667	HH	On-Demand	Anodyne	ACE	32	46
C[C@@H](Cc1ccc(F)cc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccc(F)cc1	ZINC000819144667	HH	On-Demand	Anodyne	MME	91	46
C[C@@H](Cc1ccc(F)cc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccc(F)cc1	ZINC000819144667	HH	On-Demand	Anodyne	PAPA1_CARPA	26	42
C[C@@H](Cc1ccc(F)cc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccc(F)cc1	ZINC000819144667	HH	On-Demand	Anodyne	CTSL	15	42
C[C@@H](Cc1ccc(F)cc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccc(F)cc1	ZINC000819144667	HH	On-Demand	Anodyne	ACE2	69	43
C[C@@H](Cc1ccc(F)cc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccc(F)cc1	ZINC000819144667	HH	On-Demand	Anodyne	AMP1_PLAFQ	28	43
C[C@@H](Cc1ccc(F)cc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccc(F)cc1	ZINC000819144667	HH	On-Demand	Anodyne	LEF	61	34
CC(CNC(=O)[C@H](C)Cc1ccc(F)cc1)CNC(=O)[C@H](C)Cc1ccc(F)cc1	ZINC000819144668	HH	On-Demand	Anodyne	ACE	32	46
CC(CNC(=O)[C@H](C)Cc1ccc(F)cc1)CNC(=O)[C@H](C)Cc1ccc(F)cc1	ZINC000819144668	HH	On-Demand	Anodyne	MME	91	46
CC(CNC(=O)[C@H](C)Cc1ccc(F)cc1)CNC(=O)[C@H](C)Cc1ccc(F)cc1	ZINC000819144668	HH	On-Demand	Anodyne	PAPA1_CARPA	26	42
CC(CNC(=O)[C@H](C)Cc1ccc(F)cc1)CNC(=O)[C@H](C)Cc1ccc(F)cc1	ZINC000819144668	HH	On-Demand	Anodyne	CTSL	15	42
CC(CNC(=O)[C@H](C)Cc1ccc(F)cc1)CNC(=O)[C@H](C)Cc1ccc(F)cc1	ZINC000819144668	HH	On-Demand	Anodyne	ACE2	69	43
CC(CNC(=O)[C@H](C)Cc1ccc(F)cc1)CNC(=O)[C@H](C)Cc1ccc(F)cc1	ZINC000819144668	HH	On-Demand	Anodyne	AMP1_PLAFQ	28	43
CC(CNC(=O)[C@H](C)Cc1ccc(F)cc1)CNC(=O)[C@H](C)Cc1ccc(F)cc1	ZINC000819144668	HH	On-Demand	Anodyne	LEF	61	34
CC(CNC(=O)[C@@H](C)Cc1ccc(F)cc1)CNC(=O)[C@@H](C)Cc1ccc(F)cc1	ZINC000819144669	HH	On-Demand	Anodyne	ACE	32	46
CC(CNC(=O)[C@@H](C)Cc1ccc(F)cc1)CNC(=O)[C@@H](C)Cc1ccc(F)cc1	ZINC000819144669	HH	On-Demand	Anodyne	MME	91	46
CC(CNC(=O)[C@@H](C)Cc1ccc(F)cc1)CNC(=O)[C@@H](C)Cc1ccc(F)cc1	ZINC000819144669	HH	On-Demand	Anodyne	PAPA1_CARPA	26	42
CC(CNC(=O)[C@@H](C)Cc1ccc(F)cc1)CNC(=O)[C@@H](C)Cc1ccc(F)cc1	ZINC000819144669	HH	On-Demand	Anodyne	CTSL	15	42
CC(CNC(=O)[C@@H](C)Cc1ccc(F)cc1)CNC(=O)[C@@H](C)Cc1ccc(F)cc1	ZINC000819144669	HH	On-Demand	Anodyne	ACE2	69	43
CC(CNC(=O)[C@@H](C)Cc1ccc(F)cc1)CNC(=O)[C@@H](C)Cc1ccc(F)cc1	ZINC000819144669	HH	On-Demand	Anodyne	AMP1_PLAFQ	28	43
CC(CNC(=O)[C@@H](C)Cc1ccc(F)cc1)CNC(=O)[C@@H](C)Cc1ccc(F)cc1	ZINC000819144669	HH	On-Demand	Anodyne	LEF	61	34
O=C(CC1CC1)NNC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C(F)(F)F	ZINC000819144672	HG	On-Demand	Reactive	CCR2	74	37
COc1ccc(CC(=O)NNC(=O)CC2CC2)cc1S(=O)(=O)N1CCOCC1	ZINC000819144674	HC	On-Demand	Reactive	CPT1A	43	36
COc1ccc(CC(=O)NNC(=O)CC2CC2)cc1S(=O)(=O)N1CCOCC1	ZINC000819144674	HC	On-Demand	Reactive	NR1H4	15	40
COc1ccc(CC(=O)NNC(=O)CC2CC2)cc1S(=O)(=O)N1CCOCC1	ZINC000819144674	HC	On-Demand	Reactive	CPT1B	47	35
CC(CNC(=O)COc1cccc(C#N)c1)CNC(=O)COc1cccc(C#N)c1	ZINC000819144683	HD	On-Demand	Mild	PTGER3	19	42
CC(CNC(=O)COc1cccc(C#N)c1)CNC(=O)COc1cccc(C#N)c1	ZINC000819144683	HD	On-Demand	Mild	PDS	45	48
CN(C)CCS(=O)(=O)c1ccccc1C(=O)NNC(=O)CC1CC1	ZINC000819144687	FC	On-Demand	Reactive	CCR8	63	36
C[C@@H](Sc1nc2ccccc2s1)C(=O)NNC(=O)CC1CC1	ZINC000819144696	EF	On-Demand	Reactive	TMPRSS6	49	32
C[C@H](Sc1nc2ccccc2s1)C(=O)NNC(=O)CC1CC1	ZINC000819144697	EF	On-Demand	Reactive	TMPRSS6	49	32
CC(CNC(=O)C#Cc1ccccc1)CNC(=O)C#Cc1ccccc1	ZINC000819144701	ED	On-Demand	Mild	FFAR1	17	45
O=C(CSc1nnc(-c2cccc(Cl)c2)n1Cc1ccco1)NNC(=O)CC1CC1	ZINC000819144702	IG	On-Demand	Reactive	HCRTR2	17	58
N#Cc1ccccc1OCc1cccc(C(=O)NNC(=O)CC2CC2)c1	ZINC000819144705	EF	On-Demand	Reactive	ADRB1	42	33
O=C(CCc1nc(-c2ccccn2)no1)NNC(=O)CC1CC1	ZINC000819144708	DD	On-Demand	Reactive	FAAH	18	43
O=C(CCc1nc(-c2ccccn2)no1)NNC(=O)CC1CC1	ZINC000819144708	DD	On-Demand	Reactive	HCAR2	40	48
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccc(Br)cc2)c1	ZINC000819144719	HG	On-Demand	Reactive	MAPK14	16	44
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccc(Br)cc2)c1	ZINC000819144719	HG	On-Demand	Reactive	UL80	15	40
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccc(Br)cc2)c1	ZINC000819144719	HG	On-Demand	Reactive	TAAR1	47	40
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccc(Br)cc2)c1	ZINC000819144719	HG	On-Demand	Reactive	KCNK3	107	42
O=C(CC1CC1)NNC(=O)c1cccc(NC(=O)c2ccc(Br)cc2)c1	ZINC000819144719	HG	On-Demand	Reactive	KCNK9	55	40
O=C(CC1CC1)NNC(=O)c1cnccc1Oc1ccccc1	ZINC000819144723	DE	On-Demand	Reactive	GPBAR1	42	47
N#Cc1ccc(CCC(=O)NNC(=O)CC2CC2)cc1	ZINC000819144731	CD	On-Demand	Reactive	FFAR1	27	40
Cc1nc(C(=O)NCC(C)CNC(=O)c2nc(C)n3ccccc23)c2ccccn12	ZINC000819144734	HE	On-Demand	Anodyne	ITGAV	43	34
O=C(CC1CC1)NNC(=O)c1ccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)cc1	ZINC000819144735	HG	On-Demand	Reactive	EPHX2	15	47
CCCOc1cc(OC)ccc1C(=O)NNC(=O)CC1CC1	ZINC000819144743	DE	On-Demand	Reactive	MTNR1A	42	42
CCCOc1cc(OC)ccc1C(=O)NNC(=O)CC1CC1	ZINC000819144743	DE	On-Demand	Reactive	MTNR1B	37	42
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CC2CC2)(c2ccccc2)CC1	ZINC000819144747	HF	On-Demand	Reactive	GPR119	43	41
CC(C)(C)OC(=O)N1CCC(C(=O)NNC(=O)CC2CC2)(c2ccccc2)CC1	ZINC000819144747	HF	On-Demand	Reactive	SFRP1	15	42
CN1CCN(c2cccc(C(=O)NNC(=O)CC3CC3)n2)CC1	ZINC000819144753	DC	On-Demand	Reactive	HSD11B1	16	43
COc1cc(C(=O)NNC(=O)CC2CC2)cc(OC)c1OCc1ccccc1	ZINC000819144762	GF	On-Demand	Reactive	ACHE	20	42
COc1cc(C(=O)NNC(=O)CC2CC2)cc(OC)c1OCc1ccccc1	ZINC000819144762	GF	On-Demand	Reactive	BCHE	21	42
COc1cc(C(=O)NNC(=O)CC2CC2)cc(OC)c1OCc1ccccc1	ZINC000819144762	GF	On-Demand	Reactive	SLC6A5	28	54
COc1cc(C(=O)NNC(=O)CC2CC2)cc(OC)c1OCc1ccccc1	ZINC000819144762	GF	On-Demand	Reactive	ADCYAP1R1	39	45
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	ACE	67	49
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	OPRM1	57	40
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	OPRD1	51	40
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	MME	138	40
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	ANPEP	69	35
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	TACR1	17	55
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	CTRA_BOVIN	18	50
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	FCER2	76	41
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	CTSB	67	46
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	PAPA1_CARPA	56	54
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	CYSP_TRYCR	61	42
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	CTSK	22	48
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	CTSL	65	54
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	NPFFR2	52	43
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	TIMP3	83	38
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	CTRB1	51	46
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	CAPNS1	80	32
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	MMP2	18	47
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	GRIA1	49	47
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	HLA-DRB1	41	31
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	REN	42	38
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	CTSS	36	54
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	CAPN1	92	43
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	MMP9	21	44
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	CAPN2	56	34
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	ACE2	79	38
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	CTSV	36	45
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	PIN1	23	41
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	MMP1	27	44
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	FPR1	61	37
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	CTRB_BOVIN	46	33
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	BLA1_STEMA	74	40
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	KISS1R	41	33
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	BRCA1	44	33
O=C(CC1CC1)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144769	FD	On-Demand	Reactive	NPFFR1	65	43
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	ACE	67	49
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	OPRM1	57	40
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	OPRD1	51	40
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	MME	138	40
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	ANPEP	69	35
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	TACR1	17	55
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	CTRA_BOVIN	18	50
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	FCER2	76	41
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	CTSB	67	46
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	PAPA1_CARPA	56	54
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	CYSP_TRYCR	61	42
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	CTSK	22	48
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	CTSL	65	54
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	NPFFR2	52	43
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	TIMP3	83	38
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	CTRB1	51	46
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	CAPNS1	80	32
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	MMP2	18	47
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	GRIA1	49	47
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	HLA-DRB1	41	31
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	REN	42	38
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	CTSS	36	54
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	CAPN1	92	43
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	MMP9	21	44
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	CAPN2	56	34
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	ACE2	79	38
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	CTSV	36	45
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	PIN1	23	41
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	MMP1	27	44
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	FPR1	61	37
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	CTRB_BOVIN	46	33
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	BLA1_STEMA	74	40
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	KISS1R	41	33
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	BRCA1	44	33
O=C(CC1CC1)NNC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccccc1	ZINC000819144770	FD	On-Demand	Reactive	NPFFR1	65	43
CC(CNC(=O)c1ccnc(-n2ccnc2)c1)CNC(=O)c1ccnc(-n2ccnc2)c1	ZINC000819144779	ID	On-Demand	Anodyne	NOS2	60	33
CC(CNC(=O)c1ccc(F)cc1[N+](=O)[O-])CNC(=O)c1ccc(F)cc1[N+](=O)[O-]	ZINC000819144781	HF	On-Demand	Bother	COLA	54	38
O=C(CC1CC1)NNC(=O)C1CCN(C(=O)CCOc2ccccc2)CC1	ZINC000819144800	FD	On-Demand	Reactive	GRIN2B	33	40
O=C(CC1CC1)NNC(=O)C1CCN(C(=O)CCOc2ccccc2)CC1	ZINC000819144800	FD	On-Demand	Reactive	LTA4H	27	42
O=C(CC1CC1)NNC(=O)C1CCN(C(=O)CCOc2ccccc2)CC1	ZINC000819144800	FD	On-Demand	Reactive	CPT1A	67	36
O=C(CCc1nc(-c2ccsc2)no1)NNC(=O)CC1CC1	ZINC000819144805	DD	On-Demand	Reactive	HCAR2	23	42
CC(CNC(=O)c1ccc2c(c1)CCO2)CNC(=O)c1ccc2c(c1)CCO2	ZINC000819144810	GE	On-Demand	Anodyne	F3	79	34
O=C(CC1CC1)NNC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1	ZINC000819144821	CC	On-Demand	Reactive	INHA	23	50
O=C(CC1CC1)NNC(=O)[C@H]1CC(=O)N(C2CCCC2)C1	ZINC000819144822	CC	On-Demand	Reactive	INHA	23	50
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	ACE	22	45
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	TYR	15	40
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	SSTR2	81	47
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	OPRM1	17	44
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	GHRHR	27	40
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	MME	28	43
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	EDNRB	43	36
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	EDNRA	44	59
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	TACR1	42	63
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	CTSD	15	53
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	PGC	55	35
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	MC4R	47	39
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	CTSB	18	56
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	PAPA1_CARPA	51	41
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	CCKAR	161	62
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	CTSL	34	58
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	BCHE	15	55
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	PGA	31	54
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	BRS3	31	49
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	NMBR	53	50
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	MC3R	64	37
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	MC5R	69	35
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	MMP2	29	47
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	MMP8	41	47
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	MMP14	24	45
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	GRPR	77	36
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	ECE1	76	53
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	REN	83	54
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	REN1	34	54
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	SSTR3	25	52
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	MMP11	88	40
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	CCKBR	127	58
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	GHSR	66	50
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	CAPN1	18	47
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	MMP9	28	47
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	MC1R	98	39
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	MMP7	18	41
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	MMP1	24	44
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	FPR1	56	59
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	NPR	28	43
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	KISS1R	73	34
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)CC1CC1	ZINC000819144830	HF	On-Demand	Reactive	ERAP2	41	37
CC(CNC(=O)[C@@H](O)c1cccnc1)CNC(=O)[C@@H](O)c1cccnc1	ZINC000819144862	FC	On-Demand	Anodyne	ADRB1	15	44
CC(CNC(=O)[C@@H](O)c1cccnc1)CNC(=O)[C@@H](O)c1cccnc1	ZINC000819144862	FC	On-Demand	Anodyne	ADRB3	48	44
CC(CNC(=O)[C@@H](O)c1cccnc1)CNC(=O)[C@@H](O)c1cccnc1	ZINC000819144862	FC	On-Demand	Anodyne	KCNA5	26	43
CC(CNC(=O)[C@H](O)c1cccnc1)CNC(=O)[C@H](O)c1cccnc1	ZINC000819144863	FC	On-Demand	Anodyne	ADRB1	15	44
CC(CNC(=O)[C@H](O)c1cccnc1)CNC(=O)[C@H](O)c1cccnc1	ZINC000819144863	FC	On-Demand	Anodyne	ADRB3	48	44
CC(CNC(=O)[C@H](O)c1cccnc1)CNC(=O)[C@H](O)c1cccnc1	ZINC000819144863	FC	On-Demand	Anodyne	KCNA5	26	43
O=C(CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)CC1CC1	ZINC000819144866	HD	On-Demand	Reactive	CACNA1B	55	35
O=C(CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)CC1CC1	ZINC000819144866	HD	On-Demand	Reactive	BDKRB1	20	41
O=C(CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)CC1CC1	ZINC000819144866	HD	On-Demand	Reactive	CCR2	53	38
O=C(CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)CC1CC1	ZINC000819144866	HD	On-Demand	Reactive	SFRP1	92	35
O=C(CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)CC1CC1	ZINC000819144866	HD	On-Demand	Reactive	WNT3	52	32
CCOc1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819144877	FE	On-Demand	Anodyne	ADRB2	41	45
CCOc1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819144877	FE	On-Demand	Anodyne	ADRB1	62	41
CCOc1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819144877	FE	On-Demand	Anodyne	CACNA2D1	42	34
CCOc1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819144878	FE	On-Demand	Anodyne	ADRB2	41	45
CCOc1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819144878	FE	On-Demand	Anodyne	ADRB1	62	41
CCOc1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819144878	FE	On-Demand	Anodyne	CACNA2D1	42	34
O[C@@H](CNCc1ccnn1CCc1ccccc1)c1cccc(Cl)c1	ZINC000819144906	FH	On-Demand	Anodyne	ADRB1	43	46
O[C@@H](CNCc1ccnn1CCc1ccccc1)c1cccc(Cl)c1	ZINC000819144906	FH	On-Demand	Anodyne	ADRB3	61	46
O[C@H](CNCc1ccnn1CCc1ccccc1)c1cccc(Cl)c1	ZINC000819144907	FH	On-Demand	Anodyne	ADRB1	43	46
O[C@H](CNCc1ccnn1CCc1ccccc1)c1cccc(Cl)c1	ZINC000819144907	FH	On-Demand	Anodyne	ADRB3	61	46
O[C@@H](CNCc1ccnn1CCc1ccccc1)c1ccccc1	ZINC000819144930	DF	On-Demand	Anodyne	ADRB2	19	43
O[C@@H](CNCc1ccnn1CCc1ccccc1)c1ccccc1	ZINC000819144930	DF	On-Demand	Anodyne	ADRB3	47	42
O[C@H](CNCc1ccnn1CCc1ccccc1)c1ccccc1	ZINC000819144931	DF	On-Demand	Anodyne	ADRB2	19	43
O[C@H](CNCc1ccnn1CCc1ccccc1)c1ccccc1	ZINC000819144931	DF	On-Demand	Anodyne	ADRB3	47	42
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	ZINC000819144978	DH	On-Demand	Anodyne	SIGMAR1	22	44
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	ZINC000819144980	DH	On-Demand	Anodyne	SIGMAR1	22	44
CN(c1ccccc1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819144986	DF	On-Demand	Anodyne	ITGAL	55	35
CN(c1ccccc1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819144987	DF	On-Demand	Anodyne	ITGAL	55	35
CN(c1ccccc1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819144988	DF	On-Demand	Anodyne	ITGAL	55	35
CN(c1ccccc1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819144989	DF	On-Demand	Anodyne	ITGAL	55	35
COc1ccc(-n2cc(CNCCC(=O)N(C)OC)nn2)cc1	ZINC000819145011	DC	On-Demand	Anodyne	FIMH	17	42
CCc1noc(CC)c1CNC[C@H](O)c1cccnc1	ZINC000819145021	CE	On-Demand	Anodyne	ADRB2	18	42
CCc1noc(CC)c1CNC[C@H](O)c1cccnc1	ZINC000819145021	CE	On-Demand	Anodyne	ADRB1	21	42
CCc1noc(CC)c1CNC[C@H](O)c1cccnc1	ZINC000819145021	CE	On-Demand	Anodyne	ADRB3	81	42
CCc1noc(CC)c1CNC[C@@H](O)c1cccnc1	ZINC000819145022	CE	On-Demand	Anodyne	ADRB2	18	42
CCc1noc(CC)c1CNC[C@@H](O)c1cccnc1	ZINC000819145022	CE	On-Demand	Anodyne	ADRB1	21	42
CCc1noc(CC)c1CNC[C@@H](O)c1cccnc1	ZINC000819145022	CE	On-Demand	Anodyne	ADRB3	81	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145029	FD	On-Demand	Anodyne	ADRB2	40	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145029	FD	On-Demand	Anodyne	ADRB1	71	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145029	FD	On-Demand	Anodyne	ADRB3	43	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145029	FD	On-Demand	Anodyne	ABCB1	25	55
CC(=O)c1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145030	FD	On-Demand	Anodyne	ADRB2	40	42
CC(=O)c1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145030	FD	On-Demand	Anodyne	ADRB1	71	41
CC(=O)c1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145030	FD	On-Demand	Anodyne	ADRB3	43	41
CC(=O)c1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145030	FD	On-Demand	Anodyne	ABCB1	25	55
C[C@]1(CNC[C@@H](O)c2cccnc2)CCCO1	ZINC000819145033	BD	On-Demand	Anodyne	ADRB2	20	40
C[C@]1(CNC[C@@H](O)c2cccnc2)CCCO1	ZINC000819145033	BD	On-Demand	Anodyne	ADRB1	22	40
C[C@]1(CNC[C@@H](O)c2cccnc2)CCCO1	ZINC000819145033	BD	On-Demand	Anodyne	ADRB3	87	44
C[C@@]1(CNC[C@@H](O)c2cccnc2)CCCO1	ZINC000819145034	BD	On-Demand	Anodyne	ADRB2	20	40
C[C@@]1(CNC[C@@H](O)c2cccnc2)CCCO1	ZINC000819145034	BD	On-Demand	Anodyne	ADRB1	22	40
C[C@@]1(CNC[C@@H](O)c2cccnc2)CCCO1	ZINC000819145034	BD	On-Demand	Anodyne	ADRB3	87	44
C[C@]1(CNC[C@H](O)c2cccnc2)CCCO1	ZINC000819145035	BD	On-Demand	Anodyne	ADRB2	20	40
C[C@]1(CNC[C@H](O)c2cccnc2)CCCO1	ZINC000819145035	BD	On-Demand	Anodyne	ADRB1	22	40
C[C@]1(CNC[C@H](O)c2cccnc2)CCCO1	ZINC000819145035	BD	On-Demand	Anodyne	ADRB3	87	44
C[C@@]1(CNC[C@H](O)c2cccnc2)CCCO1	ZINC000819145036	BD	On-Demand	Anodyne	ADRB2	20	40
C[C@@]1(CNC[C@H](O)c2cccnc2)CCCO1	ZINC000819145036	BD	On-Demand	Anodyne	ADRB1	22	40
C[C@@]1(CNC[C@H](O)c2cccnc2)CCCO1	ZINC000819145036	BD	On-Demand	Anodyne	ADRB3	87	44
CSc1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145043	FF	On-Demand	Anodyne	ADRB2	33	43
CSc1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145043	FF	On-Demand	Anodyne	ADRB1	51	39
CSc1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145044	FF	On-Demand	Anodyne	ADRB2	33	43
CSc1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145044	FF	On-Demand	Anodyne	ADRB1	51	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1nnc(Cc2ccccc2)s1	ZINC000819145053	FF	On-Demand	Anodyne	FPR1	40	34
CCC(=O)c1cc(Cl)ccc1OCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819145068	IH	On-Demand	Bother	SLC6A9	20	40
CCC(=O)c1cc(Cl)ccc1OCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819145068	IH	On-Demand	Bother	SSTR1	51	43
N#CCc1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145075	FD	On-Demand	Mild	ADRB1	61	39
N#CCc1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145076	FD	On-Demand	Mild	ADRB1	61	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ccc(C#N)cn3)CC1)C2	ZINC000819145101	GD	On-Demand	Mild	SSTR1	32	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ccc(C#N)cn3)CC1)C2	ZINC000819145102	GD	On-Demand	Mild	SSTR1	32	49
O[C@@H](CNCc1cn(-c2ccccc2)nn1)COc1ccccc1C(F)(F)F	ZINC000819145104	GF	On-Demand	Anodyne	ADRB1	44	32
O[C@H](CNCc1cn(-c2ccccc2)nn1)COc1ccccc1C(F)(F)F	ZINC000819145105	GF	On-Demand	Anodyne	ADRB1	44	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCCO1	ZINC000819145120	GF	On-Demand	Anodyne	CTSD	114	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCCO1	ZINC000819145120	GF	On-Demand	Anodyne	PGC	65	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCCO1	ZINC000819145120	GF	On-Demand	Anodyne	PAPA1_CARPA	29	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCCO1	ZINC000819145120	GF	On-Demand	Anodyne	BACE2	47	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCCO1	ZINC000819145120	GF	On-Demand	Anodyne	REN	86	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCCO1	ZINC000819145120	GF	On-Demand	Anodyne	REN1	23	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCCO1	ZINC000819145120	GF	On-Demand	Anodyne	BACE1	92	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCCO1	ZINC000819145120	GF	On-Demand	Anodyne	FPR1	49	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCCO1	ZINC000819145121	GF	On-Demand	Anodyne	CTSD	114	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCCO1	ZINC000819145121	GF	On-Demand	Anodyne	PGC	65	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCCO1	ZINC000819145121	GF	On-Demand	Anodyne	PAPA1_CARPA	29	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCCO1	ZINC000819145121	GF	On-Demand	Anodyne	BACE2	47	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCCO1	ZINC000819145121	GF	On-Demand	Anodyne	REN	86	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCCO1	ZINC000819145121	GF	On-Demand	Anodyne	REN1	23	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCCO1	ZINC000819145121	GF	On-Demand	Anodyne	BACE1	92	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCCO1	ZINC000819145121	GF	On-Demand	Anodyne	FPR1	49	39
COc1ccnc(N2CCN(C(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)CC2)n1	ZINC000819145140	GD	On-Demand	Anodyne	NPBWR1	40	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	ZINC000819145176	GF	On-Demand	Anodyne	CCKAR	15	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	ZINC000819145176	GF	On-Demand	Anodyne	FPR1	42	35
Cc1cc(F)ccc1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819145177	DF	On-Demand	Bother	ADRB1	29	41
Cc1cc(F)ccc1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819145177	DF	On-Demand	Bother	ADRB3	55	41
Cc1cc(F)ccc1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819145177	DF	On-Demand	Bother	CACNA1D	57	35
Cc1cc(F)ccc1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819145178	DF	On-Demand	Bother	ADRB1	29	41
Cc1cc(F)ccc1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819145178	DF	On-Demand	Bother	ADRB3	55	41
Cc1cc(F)ccc1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819145178	DF	On-Demand	Bother	CACNA1D	57	35
CC(=O)Nc1cccc(CC(=O)Nc2nnc(C3CCCCC3)s2)c1	ZINC000819145180	FH	On-Demand	Anodyne	CDK5	51	47
CC(C)c1nnc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819145204	FG	On-Demand	Mild	PAPA1_CARPA	41	48
CC(C)c1nnc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819145205	FG	On-Demand	Mild	PAPA1_CARPA	41	48
O=C(Cc1nsc2ccccc12)Nc1nnc(C2CCCCC2)s1	ZINC000819145206	FI	On-Demand	Anodyne	CDK5	37	43
C[C@@]1(CNC[C@H](O)c2cccc(Cl)c2)CCCO1	ZINC000819145207	CF	On-Demand	Anodyne	ADRB1	27	40
C[C@@]1(CNC[C@H](O)c2cccc(Cl)c2)CCCO1	ZINC000819145207	CF	On-Demand	Anodyne	ADRB3	40	40
C[C@@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCCO1	ZINC000819145208	CF	On-Demand	Anodyne	ADRB1	27	40
C[C@@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCCO1	ZINC000819145208	CF	On-Demand	Anodyne	ADRB3	40	40
C[C@]1(CNC[C@H](O)c2cccc(Cl)c2)CCCO1	ZINC000819145209	CF	On-Demand	Anodyne	ADRB1	27	40
C[C@]1(CNC[C@H](O)c2cccc(Cl)c2)CCCO1	ZINC000819145209	CF	On-Demand	Anodyne	ADRB3	40	40
C[C@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCCO1	ZINC000819145210	CF	On-Demand	Anodyne	ADRB1	27	40
C[C@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCCO1	ZINC000819145210	CF	On-Demand	Anodyne	ADRB3	40	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCC2CCC2)c1	ZINC000819145284	CE	On-Demand	Bother	ADRB2	44	51
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCC2CCC2)c1	ZINC000819145284	CE	On-Demand	Bother	ADRB1	77	51
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCC2CCC2)c1	ZINC000819145284	CE	On-Demand	Bother	ADRB3	50	51
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCC2CCC2)c1	ZINC000819145285	CE	On-Demand	Bother	ADRB2	44	51
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCC2CCC2)c1	ZINC000819145285	CE	On-Demand	Bother	ADRB1	77	51
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCC2CCC2)c1	ZINC000819145285	CE	On-Demand	Bother	ADRB3	50	51
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819145313	DE	On-Demand	Anodyne	ADRB2	65	61
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819145313	DE	On-Demand	Anodyne	ADRB1	107	61
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819145313	DE	On-Demand	Anodyne	GRIN1	20	43
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819145313	DE	On-Demand	Anodyne	ADRB3	72	61
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819145313	DE	On-Demand	Anodyne	ABCB1	15	46
CC(=O)Nc1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819145314	DE	On-Demand	Anodyne	ADRB2	65	61
CC(=O)Nc1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819145314	DE	On-Demand	Anodyne	ADRB1	107	61
CC(=O)Nc1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819145314	DE	On-Demand	Anodyne	GRIN1	20	43
CC(=O)Nc1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819145314	DE	On-Demand	Anodyne	ADRB3	72	61
CC(=O)Nc1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819145314	DE	On-Demand	Anodyne	ABCB1	15	46
CC[C@@H](O)CNCCc1ccc(NC(=O)OC(C)(C)C)cc1	ZINC000819145325	DF	On-Demand	Anodyne	ADRB2	56	50
CC[C@@H](O)CNCCc1ccc(NC(=O)OC(C)(C)C)cc1	ZINC000819145325	DF	On-Demand	Anodyne	ADRB1	85	52
CC[C@@H](O)CNCCc1ccc(NC(=O)OC(C)(C)C)cc1	ZINC000819145325	DF	On-Demand	Anodyne	ADRB3	97	52
O=S(=O)(N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1)C(F)(F)F	ZINC000819145333	GE	On-Demand	Anodyne	ADRB1	43	49
O=S(=O)(N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1)C(F)(F)F	ZINC000819145333	GE	On-Demand	Anodyne	ADRB3	67	51
O=S(=O)(N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1)C(F)(F)F	ZINC000819145333	GE	On-Demand	Anodyne	IGF1R	28	40
O=S(=O)(N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1)C(F)(F)F	ZINC000819145333	GE	On-Demand	Anodyne	CYP3A4	49	40
O=S(=O)(N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1)C(F)(F)F	ZINC000819145333	GE	On-Demand	Anodyne	SFRP1	56	37
O=S(=O)(N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1)C(F)(F)F	ZINC000819145334	GE	On-Demand	Anodyne	ADRB1	43	49
O=S(=O)(N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1)C(F)(F)F	ZINC000819145334	GE	On-Demand	Anodyne	ADRB3	67	51
O=S(=O)(N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1)C(F)(F)F	ZINC000819145334	GE	On-Demand	Anodyne	IGF1R	28	40
O=S(=O)(N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1)C(F)(F)F	ZINC000819145334	GE	On-Demand	Anodyne	CYP3A4	49	40
O=S(=O)(N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1)C(F)(F)F	ZINC000819145334	GE	On-Demand	Anodyne	SFRP1	56	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000819145336	GG	On-Demand	Anodyne	CCR2	18	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCC2CCC2)CC1	ZINC000819145339	EF	On-Demand	Anodyne	GPR119	37	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCC2CCC2)CC1	ZINC000819145340	EF	On-Demand	Anodyne	GPR119	37	42
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCC1CCC1	ZINC000819145342	CE	On-Demand	Bother	ADRB2	42	42
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCC1CCC1	ZINC000819145342	CE	On-Demand	Bother	ADRB1	66	42
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCC1CCC1	ZINC000819145342	CE	On-Demand	Bother	ADRB3	35	42
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCC1CCC1	ZINC000819145343	CE	On-Demand	Bother	ADRB2	42	42
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCC1CCC1	ZINC000819145343	CE	On-Demand	Bother	ADRB1	66	42
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCC1CCC1	ZINC000819145343	CE	On-Demand	Bother	ADRB3	35	42
C[C@H](CNCCc1ccc(NC(=O)OC(C)(C)C)cc1)S(C)(=O)=O	ZINC000819145363	FF	On-Demand	Anodyne	ADRB2	44	47
C[C@H](CNCCc1ccc(NC(=O)OC(C)(C)C)cc1)S(C)(=O)=O	ZINC000819145363	FF	On-Demand	Anodyne	ADRB1	61	47
C[C@H](CNCCc1ccc(NC(=O)OC(C)(C)C)cc1)S(C)(=O)=O	ZINC000819145363	FF	On-Demand	Anodyne	ADRB3	105	47
C[C@@H](CNCCc1ccc(NC(=O)OC(C)(C)C)cc1)S(C)(=O)=O	ZINC000819145364	FF	On-Demand	Anodyne	ADRB2	44	47
C[C@@H](CNCCc1ccc(NC(=O)OC(C)(C)C)cc1)S(C)(=O)=O	ZINC000819145364	FF	On-Demand	Anodyne	ADRB1	61	47
C[C@@H](CNCCc1ccc(NC(=O)OC(C)(C)C)cc1)S(C)(=O)=O	ZINC000819145364	FF	On-Demand	Anodyne	ADRB3	105	47
CCN(C(=O)/C=C\[C@@H]1CCCO1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000819145367	EG	On-Demand	Anodyne	CCR5	33	41
CCN(C(=O)/C=C/[C@@H]1CCCO1)[C@@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000819145368	EG	On-Demand	Anodyne	CCR5	33	41
CCN(C(=O)/C=C\[C@@H]1CCCO1)[C@@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000819145369	EG	On-Demand	Anodyne	CCR5	33	41
CCN(C(=O)/C=C/[C@@H]1CCCO1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000819145370	EG	On-Demand	Anodyne	CCR5	33	41
Cc1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145373	EE	On-Demand	Anodyne	ADRB2	42	45
Cc1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145373	EE	On-Demand	Anodyne	ADRB1	61	43
Cc1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145373	EE	On-Demand	Anodyne	ADRB3	36	43
Cc1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145374	EE	On-Demand	Anodyne	ADRB2	42	45
Cc1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145374	EE	On-Demand	Anodyne	ADRB1	61	43
Cc1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145374	EE	On-Demand	Anodyne	ADRB3	36	43
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CCN(c2c(F)cccc2F)C1	ZINC000819145430	GE	On-Demand	Anodyne	GPR119	17	43
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H]1CCN(c2c(F)cccc2F)C1	ZINC000819145432	GE	On-Demand	Anodyne	GPR119	17	43
O=C(CCn1ccccc1=O)OCc1ccc(C(=O)O)cc1	ZINC000819145433	DD	On-Demand	Anodyne	SLC12A5	48	33
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CCN(c2c(F)cccc2F)C1	ZINC000819145435	GE	On-Demand	Anodyne	GPR119	17	43
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1CCN(c2c(F)cccc2F)C1	ZINC000819145438	GE	On-Demand	Anodyne	GPR119	17	43
O=C(CCc1nc(-c2ccccn2)no1)OCc1ccc(C(=O)O)cc1	ZINC000819145440	FF	On-Demand	Anodyne	FAAH	33	47
O=C(CCc1nc(-c2ccccn2)no1)OCc1ccc(C(=O)O)cc1	ZINC000819145440	FF	On-Demand	Anodyne	CES1	21	47
O=C(CCc1nc(-c2ccccn2)no1)OCc1ccc(C(=O)O)cc1	ZINC000819145440	FF	On-Demand	Anodyne	HCAR2	36	45
O=C(CCc1nc(-c2ccccn2)no1)OCc1ccc(C(=O)O)cc1	ZINC000819145440	FF	On-Demand	Anodyne	LUCI_PHOPE	26	45
O=C(CCOc1ccccc1)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819145452	FD	On-Demand	Reactive	GRIN2B	19	42
O=C(CCOc1ccccc1)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819145452	FD	On-Demand	Reactive	LTA4H	59	40
O=C(CCOc1ccccc1)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819145452	FD	On-Demand	Reactive	UL80	21	44
O=C(CCOc1ccccc1)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819145452	FD	On-Demand	Reactive	PLA2G4B	55	41
O=C(CCOc1ccccc1)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819145452	FD	On-Demand	Reactive	PDS	56	39
COC(=O)c1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145476	GD	On-Demand	Anodyne	ADRB2	45	47
COC(=O)c1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145476	GD	On-Demand	Anodyne	ADRB1	76	47
COC(=O)c1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145476	GD	On-Demand	Anodyne	ADRB3	49	47
COC(=O)c1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145476	GD	On-Demand	Anodyne	ABCB1	25	45
O=C(CCS(=O)(=O)Cc1ccc(C(=O)O)cc1)NC1CCCC1	ZINC000819145479	ED	On-Demand	Anodyne	EPHX2	22	47
COC(=O)c1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145480	GD	On-Demand	Anodyne	ADRB2	45	47
COC(=O)c1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145480	GD	On-Demand	Anodyne	ADRB1	76	47
COC(=O)c1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145480	GD	On-Demand	Anodyne	ADRB3	49	47
COC(=O)c1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819145480	GD	On-Demand	Anodyne	ABCB1	25	45
O=C(CCc1ccccn1)OCc1ccc(C(=O)O)cc1	ZINC000819145481	CE	On-Demand	Anodyne	PPIA	27	40
O=C(CCc1ccccn1)OCc1ccc(C(=O)O)cc1	ZINC000819145481	CE	On-Demand	Anodyne	PTGER1	15	42
O=C(CCc1nc2ccccc2oc1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145484	FD	On-Demand	Anodyne	ACE	38	51
O=C(CCc1nc2ccccc2oc1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145484	FD	On-Demand	Anodyne	MME	93	42
O=C(CCc1nc2ccccc2oc1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145484	FD	On-Demand	Anodyne	ANPEP	44	35
O=C(CCc1nc2ccccc2oc1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145484	FD	On-Demand	Anodyne	CMA1	33	45
O=C(CCc1nc2ccccc2oc1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145484	FD	On-Demand	Anodyne	CTRA_BOVIN	40	41
O=C(CCc1nc2ccccc2oc1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145484	FD	On-Demand	Anodyne	NAALAD2	25	42
O=C(CCc1nc2ccccc2oc1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145484	FD	On-Demand	Anodyne	ECE1	29	40
O=C(CCc1nc2ccccc2oc1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145484	FD	On-Demand	Anodyne	CES1	15	44
O=C(CCc1nc2ccccc2oc1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145484	FD	On-Demand	Anodyne	ACE2	63	42
O=C(CCc1nc2ccccc2oc1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145484	FD	On-Demand	Anodyne	PIN1	40	41
O=C(CCc1nc2ccccc2oc1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145484	FD	On-Demand	Anodyne	FPR1	56	36
O=C(CCc1nc2ccccc2oc1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145484	FD	On-Demand	Anodyne	BLA1_STEMA	74	45
O=C(CCc1nc2ccccc2oc1=O)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145484	FD	On-Demand	Anodyne	PARP3	22	42
O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819145504	ED	On-Demand	Anodyne	ADRB3	30	40
O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819145507	ED	On-Demand	Anodyne	ADRB3	30	40
O=C(CCSc1ccccn1)N[C@H](C(=O)O)c1ccccc1	ZINC000819145509	DF	On-Demand	Anodyne	NAALAD2	20	42
O=C(CCSc1ccccn1)N[C@H](C(=O)O)c1ccccc1	ZINC000819145509	DF	On-Demand	Anodyne	GSTP1	18	42
O=C(CCSc1ccccn1)N[C@H](C(=O)O)c1ccccc1	ZINC000819145509	DF	On-Demand	Anodyne	FAS	23	45
O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@H](O)c1cccc(F)c1	ZINC000819145512	ED	On-Demand	Anodyne	ADRB3	30	40
O=C(CCSc1ccccn1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145514	EE	On-Demand	Anodyne	ACE	59	57
O=C(CCSc1ccccn1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145514	EE	On-Demand	Anodyne	MME	130	46
O=C(CCSc1ccccn1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145514	EE	On-Demand	Anodyne	ANPEP	66	38
O=C(CCSc1ccccn1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145514	EE	On-Demand	Anodyne	CMA1	26	47
O=C(CCSc1ccccn1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145514	EE	On-Demand	Anodyne	FCER2	45	32
O=C(CCSc1ccccn1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145514	EE	On-Demand	Anodyne	CTSB	22	41
O=C(CCSc1ccccn1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145514	EE	On-Demand	Anodyne	CYSP_TRYCR	52	38
O=C(CCSc1ccccn1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145514	EE	On-Demand	Anodyne	CPA1	57	43
O=C(CCSc1ccccn1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145514	EE	On-Demand	Anodyne	NAALAD2	32	46
O=C(CCSc1ccccn1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145514	EE	On-Demand	Anodyne	ECE1	44	40
O=C(CCSc1ccccn1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145514	EE	On-Demand	Anodyne	CAPN1	46	42
O=C(CCSc1ccccn1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145514	EE	On-Demand	Anodyne	MMP9	15	45
O=C(CCSc1ccccn1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145514	EE	On-Demand	Anodyne	CAPN2	25	41
O=C(CCSc1ccccn1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145514	EE	On-Demand	Anodyne	ACE2	99	42
O=C(CCSc1ccccn1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145514	EE	On-Demand	Anodyne	FPR1	74	39
O=C(CCSc1ccccn1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145514	EE	On-Demand	Anodyne	BLA1_STEMA	82	47
O=C(CCSc1ccccn1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145514	EE	On-Demand	Anodyne	GPR142	63	34
O=C(CCSc1ccccn1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145514	EE	On-Demand	Anodyne	FAS	23	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(N(C)c3ccccc3)CC1)C2	ZINC000819145515	GF	On-Demand	Anodyne	SFRP1	59	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(N(C)c3ccccc3)CC1)C2	ZINC000819145515	GF	On-Demand	Anodyne	WNT3	60	33
O=C(CCSc1ccccn1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145516	EE	On-Demand	Anodyne	ACE	59	57
O=C(CCSc1ccccn1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145516	EE	On-Demand	Anodyne	MME	130	46
O=C(CCSc1ccccn1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145516	EE	On-Demand	Anodyne	ANPEP	66	38
O=C(CCSc1ccccn1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145516	EE	On-Demand	Anodyne	CMA1	26	47
O=C(CCSc1ccccn1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145516	EE	On-Demand	Anodyne	FCER2	45	32
O=C(CCSc1ccccn1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145516	EE	On-Demand	Anodyne	CTSB	22	41
O=C(CCSc1ccccn1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145516	EE	On-Demand	Anodyne	CYSP_TRYCR	52	38
O=C(CCSc1ccccn1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145516	EE	On-Demand	Anodyne	CPA1	57	43
O=C(CCSc1ccccn1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145516	EE	On-Demand	Anodyne	NAALAD2	32	46
O=C(CCSc1ccccn1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145516	EE	On-Demand	Anodyne	ECE1	44	40
O=C(CCSc1ccccn1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145516	EE	On-Demand	Anodyne	CAPN1	46	42
O=C(CCSc1ccccn1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145516	EE	On-Demand	Anodyne	MMP9	15	45
O=C(CCSc1ccccn1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145516	EE	On-Demand	Anodyne	CAPN2	25	41
O=C(CCSc1ccccn1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145516	EE	On-Demand	Anodyne	ACE2	99	42
O=C(CCSc1ccccn1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145516	EE	On-Demand	Anodyne	FPR1	74	39
O=C(CCSc1ccccn1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145516	EE	On-Demand	Anodyne	BLA1_STEMA	82	47
O=C(CCSc1ccccn1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145516	EE	On-Demand	Anodyne	GPR142	63	34
O=C(CCSc1ccccn1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145516	EE	On-Demand	Anodyne	FAS	23	45
O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@H](O)c1cccc(F)c1	ZINC000819145517	ED	On-Demand	Anodyne	ADRB3	30	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(N(C)c3ccccc3)CC1)C2	ZINC000819145519	GF	On-Demand	Anodyne	SFRP1	59	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(N(C)c3ccccc3)CC1)C2	ZINC000819145519	GF	On-Demand	Anodyne	WNT3	60	33
O[C@@H](CN[C@H]1CCN(c2c(F)cccc2F)C1)c1cccnc1	ZINC000819145520	DE	On-Demand	Anodyne	ADRB3	68	52
O=C(CCc1nc2ccccc2oc1=O)N[C@H](C(=O)O)c1ccccc1	ZINC000819145521	FE	On-Demand	Anodyne	PARP3	22	40
O[C@@H](CN[C@@H]1CCN(c2c(F)cccc2F)C1)c1cccnc1	ZINC000819145523	DE	On-Demand	Anodyne	ADRB3	68	52
O=C(CCSc1ccccn1)NC1(C(=O)O)CCCCC1	ZINC000819145524	DE	On-Demand	Anodyne	FAS	19	42
O[C@H](CN[C@@H]1CCN(c2c(F)cccc2F)C1)c1cccnc1	ZINC000819145526	DE	On-Demand	Anodyne	ADRB3	68	52
O=C(CC[S@](=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(Cl)c1	ZINC000819145527	FG	On-Demand	Anodyne	UL80	27	42
O=C(CC[S@](=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(Cl)c1	ZINC000819145527	FG	On-Demand	Anodyne	AKR1C3	15	45
O=C(CC[S@](=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(Cl)c1	ZINC000819145527	FG	On-Demand	Anodyne	KCNK3	31	40
O[C@H](CN[C@H]1CCN(c2c(F)cccc2F)C1)c1cccnc1	ZINC000819145529	DE	On-Demand	Anodyne	ADRB3	68	52
O=C(CC[S@@](=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(Cl)c1	ZINC000819145538	FG	On-Demand	Anodyne	UL80	27	42
O=C(CC[S@@](=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(Cl)c1	ZINC000819145538	FG	On-Demand	Anodyne	AKR1C3	15	45
O=C(CC[S@@](=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(Cl)c1	ZINC000819145538	FG	On-Demand	Anodyne	KCNK3	31	40
O=C(CCc1nc(-c2nc[nH]n2)no1)NCc1ccc(C(=O)O)cc1	ZINC000819145546	EC	On-Demand	Anodyne	HCAR2	36	41
Cc1ccc(-c2csc(NC(=O)/C=C/[C@@H]3CCCO3)n2)cc1C	ZINC000819145569	EI	On-Demand	Anodyne	MPL	15	46
Cc1ccc(-c2csc(NC(=O)/C=C\[C@@H]3CCCO3)n2)cc1C	ZINC000819145570	EI	On-Demand	Anodyne	MPL	15	46
Cc1ccc(-c2csc(NC(=O)/C=C/[C@H]3CCCO3)n2)cc1C	ZINC000819145573	EI	On-Demand	Anodyne	MPL	15	46
Cc1ccc(-c2csc(NC(=O)/C=C\[C@H]3CCCO3)n2)cc1C	ZINC000819145575	EI	On-Demand	Anodyne	MPL	15	46
O=C(CCn1c(S)nc2ccccc2c1=O)N[C@H](C(=O)O)c1ccccc1	ZINC000819145585	GE	On-Demand	Anodyne	PARP3	22	40
O=C(CN1C(=O)NC2(CCCC2)C1=O)OCc1ccc(C(=O)O)cc1	ZINC000819145588	ED	On-Demand	Anodyne	SLC12A5	62	34
O=C(CCn1cccc1)OCc1ccc(C(=O)O)cc1	ZINC000819145604	CE	On-Demand	Anodyne	SLC12A5	49	32
O=C(CC[S@@](=O)Cc1ccc(C(=O)O)cc1)NCc1ccc(F)cc1	ZINC000819145608	FE	On-Demand	Anodyne	TPSAB1	15	45
O=C(CC[S@](=O)Cc1ccc(C(=O)O)cc1)NCc1ccc(F)cc1	ZINC000819145610	FE	On-Demand	Anodyne	TPSAB1	15	45
CCOC(=O)Cn1cnc(NCc2ccc(N3CCOCC3)c(F)c2)n1	ZINC000819145612	FD	On-Demand	Clean	STAT6	51	36
O=C(CCS(=O)(=O)c1ccc(F)cc1)OCc1ccc(C(=O)O)cc1	ZINC000819145613	FE	On-Demand	Anodyne	CA2	16	42
O=C(CN1C(=O)NC2(CCCCC2)C1=O)OCc1ccc(C(=O)O)cc1	ZINC000819145617	FD	On-Demand	Anodyne	SLC12A5	59	34
O=C(CC[S@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccc(Cl)cc1	ZINC000819145619	FG	On-Demand	Anodyne	LTA4H	31	46
O=C(CC[S@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccc(Cl)cc1	ZINC000819145619	FG	On-Demand	Anodyne	ACR	33	40
O=C(CC[S@@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccc(Cl)cc1	ZINC000819145622	FG	On-Demand	Anodyne	LTA4H	31	46
O=C(CC[S@@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccc(Cl)cc1	ZINC000819145622	FG	On-Demand	Anodyne	ACR	33	40
O=C(CCc1nnc(-c2ccccc2)o1)OCc1ccc(C(=O)O)cc1	ZINC000819145627	FG	On-Demand	Anodyne	FAAH	35	41
O=C(CCc1nnc(-c2ccccc2)o1)OCc1ccc(C(=O)O)cc1	ZINC000819145627	FG	On-Demand	Anodyne	CES1	26	41
O=C(CCc1nnc(C2CCCC2)o1)NCc1ccc(C(=O)O)cc1	ZINC000819145630	EF	On-Demand	Anodyne	TMPRSS11D	42	32
O=C(CCS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(Cl)c1	ZINC000819145634	GF	On-Demand	Anodyne	CPT1A	45	39
O=C(CCS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(Cl)c1	ZINC000819145634	GF	On-Demand	Anodyne	AKR1C3	20	45
O=C(CCS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(Cl)c1	ZINC000819145634	GF	On-Demand	Anodyne	KCNK3	29	40
O=C(CCS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccc(Cl)cc1	ZINC000819145639	GF	On-Demand	Anodyne	LTA4H	29	46
O=C(CCS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccc(Cl)cc1	ZINC000819145639	GF	On-Demand	Anodyne	CPT1A	41	37
O=C(CCSc1ccccn1)NC1(C(=O)O)CCCC1	ZINC000819145641	CE	On-Demand	Anodyne	FAS	22	43
O=C(CN1C(=O)c2ccccc2C1=O)OCc1ccc(C(=O)O)cc1	ZINC000819145646	ED	On-Demand	Anodyne	PTGER1	18	43
O=C(CN1C(=O)c2ccccc2C1=O)OCc1ccc(C(=O)O)cc1	ZINC000819145646	ED	On-Demand	Anodyne	SLC12A5	45	33
O=C(CN1C(=O)CCC1=O)OCc1ccc(C(=O)O)cc1	ZINC000819145647	CC	On-Demand	Anodyne	PTGER4	42	34
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3c(F)cccc3F)C2)cc(OC)c1	ZINC000819145652	GF	On-Demand	Anodyne	DRD4	23	41
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3c(F)cccc3F)C2)cc(OC)c1	ZINC000819145652	GF	On-Demand	Anodyne	MCHR1	22	46
COc1cc(CN2CC[C@H](NC[C@@H](O)c3c(F)cccc3F)C2)cc(OC)c1	ZINC000819145653	GF	On-Demand	Anodyne	DRD4	23	41
COc1cc(CN2CC[C@H](NC[C@@H](O)c3c(F)cccc3F)C2)cc(OC)c1	ZINC000819145653	GF	On-Demand	Anodyne	MCHR1	22	46
COc1cc(CN2CC[C@@H](NC[C@H](O)c3c(F)cccc3F)C2)cc(OC)c1	ZINC000819145654	GF	On-Demand	Anodyne	DRD4	23	41
COc1cc(CN2CC[C@@H](NC[C@H](O)c3c(F)cccc3F)C2)cc(OC)c1	ZINC000819145654	GF	On-Demand	Anodyne	MCHR1	22	46
COc1cc(CN2CC[C@H](NC[C@H](O)c3c(F)cccc3F)C2)cc(OC)c1	ZINC000819145656	GF	On-Demand	Anodyne	DRD4	23	41
COc1cc(CN2CC[C@H](NC[C@H](O)c3c(F)cccc3F)C2)cc(OC)c1	ZINC000819145656	GF	On-Demand	Anodyne	MCHR1	22	46
O=C(CCc1nc(-c2ccncc2)no1)NC1(C(=O)O)CCCCC1	ZINC000819145670	ED	On-Demand	Anodyne	NPPA	20	40
O=C(CCc1nc(-c2ccncc2)no1)NC1(C(=O)O)CCCCC1	ZINC000819145670	ED	On-Demand	Anodyne	HCAR2	34	44
O=C(CCS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(F)c1	ZINC000819145673	FE	On-Demand	Anodyne	KCNK3	29	40
O=C(CCn1c(=O)nc(O)c2ccccc21)OCc1ccc(C(=O)O)cc1	ZINC000819145676	FD	On-Demand	Anodyne	FABI	52	35
O=C(CCc1ccoc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819145680	CE	On-Demand	Anodyne	NAALAD2	29	46
O=C(CCc1ccoc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819145680	CE	On-Demand	Anodyne	GSTP1	17	42
O=C(CC[S@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1Cl	ZINC000819145682	FG	On-Demand	Anodyne	HCAR2	33	46
O=C(CC[S@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1Cl	ZINC000819145682	FG	On-Demand	Anodyne	EPHB3	45	32
O=C(CC[S@@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1Cl	ZINC000819145685	FG	On-Demand	Anodyne	HCAR2	33	46
O=C(CC[S@@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1Cl	ZINC000819145685	FG	On-Demand	Anodyne	EPHB3	45	32
O[C@@H](CNCCC1CCC1)COc1cccc2[nH]ccc12	ZINC000819145689	CF	On-Demand	Anodyne	ADRB2	33	68
O[C@@H](CNCCC1CCC1)COc1cccc2[nH]ccc12	ZINC000819145689	CF	On-Demand	Anodyne	ADRB1	72	62
O[C@@H](CNCCC1CCC1)COc1cccc2[nH]ccc12	ZINC000819145689	CF	On-Demand	Anodyne	HTR1A	18	68
O[C@@H](CNCCC1CCC1)COc1cccc2[nH]ccc12	ZINC000819145689	CF	On-Demand	Anodyne	SLC6A4	20	45
O[C@@H](CNCCC1CCC1)COc1cccc2[nH]ccc12	ZINC000819145689	CF	On-Demand	Anodyne	ADRB3	25	62
O[C@@H](CNCCC1CCC1)COc1cccc2[nH]ccc12	ZINC000819145689	CF	On-Demand	Anodyne	CYP2D6	19	46
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccc(C)cc3)C2)cc(OC)c1	ZINC000819145690	FF	On-Demand	Anodyne	DRD4	19	41
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccc(C)cc3)C2)cc(OC)c1	ZINC000819145690	FF	On-Demand	Anodyne	ADRB3	18	41
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccc(C)cc3)C2)cc(OC)c1	ZINC000819145690	FF	On-Demand	Anodyne	SSTR5	44	37
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccc(C)cc3)C2)cc(OC)c1	ZINC000819145690	FF	On-Demand	Anodyne	MCHR1	17	45
O[C@H](CNCCC1CCC1)COc1cccc2[nH]ccc12	ZINC000819145692	CF	On-Demand	Anodyne	ADRB2	33	68
O[C@H](CNCCC1CCC1)COc1cccc2[nH]ccc12	ZINC000819145692	CF	On-Demand	Anodyne	ADRB1	72	62
O[C@H](CNCCC1CCC1)COc1cccc2[nH]ccc12	ZINC000819145692	CF	On-Demand	Anodyne	HTR1A	18	68
O[C@H](CNCCC1CCC1)COc1cccc2[nH]ccc12	ZINC000819145692	CF	On-Demand	Anodyne	SLC6A4	20	45
O[C@H](CNCCC1CCC1)COc1cccc2[nH]ccc12	ZINC000819145692	CF	On-Demand	Anodyne	ADRB3	25	62
O[C@H](CNCCC1CCC1)COc1cccc2[nH]ccc12	ZINC000819145692	CF	On-Demand	Anodyne	CYP2D6	19	46
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccc(C)cc3)C2)cc(OC)c1	ZINC000819145693	FF	On-Demand	Anodyne	DRD4	19	41
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccc(C)cc3)C2)cc(OC)c1	ZINC000819145693	FF	On-Demand	Anodyne	ADRB3	18	41
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccc(C)cc3)C2)cc(OC)c1	ZINC000819145693	FF	On-Demand	Anodyne	SSTR5	44	37
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccc(C)cc3)C2)cc(OC)c1	ZINC000819145693	FF	On-Demand	Anodyne	MCHR1	17	45
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccc(C)cc3)C2)cc(OC)c1	ZINC000819145696	FF	On-Demand	Anodyne	DRD4	19	41
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccc(C)cc3)C2)cc(OC)c1	ZINC000819145696	FF	On-Demand	Anodyne	ADRB3	18	41
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccc(C)cc3)C2)cc(OC)c1	ZINC000819145696	FF	On-Demand	Anodyne	SSTR5	44	37
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccc(C)cc3)C2)cc(OC)c1	ZINC000819145696	FF	On-Demand	Anodyne	MCHR1	17	45
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccc(C)cc3)C2)cc(OC)c1	ZINC000819145699	FF	On-Demand	Anodyne	DRD4	19	41
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccc(C)cc3)C2)cc(OC)c1	ZINC000819145699	FF	On-Demand	Anodyne	ADRB3	18	41
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccc(C)cc3)C2)cc(OC)c1	ZINC000819145699	FF	On-Demand	Anodyne	SSTR5	44	37
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccc(C)cc3)C2)cc(OC)c1	ZINC000819145699	FF	On-Demand	Anodyne	MCHR1	17	45
O=C(CC[S@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccc(F)cc1	ZINC000819145702	EF	On-Demand	Anodyne	LTA4H	31	47
O=C(CC[S@@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccc(F)cc1	ZINC000819145704	EF	On-Demand	Anodyne	LTA4H	31	47
O[C@H](CNCCC1CCC1)Cc1cccc(Cl)c1	ZINC000819145705	CG	On-Demand	Anodyne	PTGER4	15	42
O[C@@H](CNCCC1CCC1)Cc1cccc(Cl)c1	ZINC000819145707	CG	On-Demand	Anodyne	PTGER4	15	42
O=C(CCS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1Cl	ZINC000819145712	GF	On-Demand	Anodyne	HCAR2	25	44
O=C(CCS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccc(F)cc1	ZINC000819145713	FE	On-Demand	Anodyne	LTA4H	30	47
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1	ZINC000819145715	GD	On-Demand	Anodyne	DRD4	21	42
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1	ZINC000819145715	GD	On-Demand	Anodyne	SLC6A1	96	37
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1	ZINC000819145715	GD	On-Demand	Anodyne	GRIN2B	28	49
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1	ZINC000819145715	GD	On-Demand	Anodyne	SIGMAR1	30	53
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1	ZINC000819145715	GD	On-Demand	Anodyne	C3AR1	43	42
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1	ZINC000819145715	GD	On-Demand	Anodyne	MAPK1	21	41
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1	ZINC000819145715	GD	On-Demand	Anodyne	EPHX2	23	45
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1	ZINC000819145715	GD	On-Demand	Anodyne	MCHR1	16	41
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1	ZINC000819145715	GD	On-Demand	Anodyne	CACNA1G	19	40
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1	ZINC000819145715	GD	On-Demand	Anodyne	CCR8	46	37
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1	ZINC000819145716	GD	On-Demand	Anodyne	DRD4	21	42
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1	ZINC000819145716	GD	On-Demand	Anodyne	SLC6A1	96	37
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1	ZINC000819145716	GD	On-Demand	Anodyne	GRIN2B	28	49
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1	ZINC000819145716	GD	On-Demand	Anodyne	SIGMAR1	30	53
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1	ZINC000819145716	GD	On-Demand	Anodyne	C3AR1	43	42
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1	ZINC000819145716	GD	On-Demand	Anodyne	MAPK1	21	41
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1	ZINC000819145716	GD	On-Demand	Anodyne	EPHX2	23	45
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1	ZINC000819145716	GD	On-Demand	Anodyne	MCHR1	16	41
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1	ZINC000819145716	GD	On-Demand	Anodyne	CACNA1G	19	40
O=C(CCc1ccccc1)NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1	ZINC000819145716	GD	On-Demand	Anodyne	CCR8	46	37
O=C(CCn1cc(Br)cn1)N[C@H](C(=O)O)c1ccccc1	ZINC000819145718	FD	On-Demand	Anodyne	NAALAD2	20	42
O=C(CCS(=O)(=O)c1ccc(Cl)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819145719	GF	On-Demand	Anodyne	CA2	22	53
O=C(CCS(=O)(=O)c1ccc(Cl)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819145719	GF	On-Demand	Anodyne	TBXA2R	43	34
O=C(CCS(=O)(=O)c1ccc(Cl)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819145719	GF	On-Demand	Anodyne	CA1	17	53
O=C(CCS(=O)(=O)c1ccc(Cl)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819145719	GF	On-Demand	Anodyne	CA5B	21	42
O=C(CCS(=O)(=O)c1ccc(Cl)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819145719	GF	On-Demand	Anodyne	CA4	15	42
O=C(CCS(=O)(=O)c1ccc(Cl)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819145719	GF	On-Demand	Anodyne	CA5A	24	42
O=C(CC[S@](=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(F)c1	ZINC000819145720	EF	On-Demand	Anodyne	TAAR1	18	40
O=C(CC[S@](=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(F)c1	ZINC000819145720	EF	On-Demand	Anodyne	KCNK3	27	40
O=C(CC[S@@](=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(F)c1	ZINC000819145721	EF	On-Demand	Anodyne	TAAR1	18	40
O=C(CC[S@@](=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(F)c1	ZINC000819145721	EF	On-Demand	Anodyne	KCNK3	27	40
O=C(CCc1nc(-c2ccco2)no1)OCc1ccc(C(=O)O)cc1	ZINC000819145722	EF	On-Demand	Anodyne	ADORA2A	33	40
O=C(CCc1ccoc1)NCc1ccc(C(=O)O)cc1	ZINC000819145723	CE	On-Demand	Anodyne	TPSAB1	16	43
C/C=C\c1ccc(OC[C@@H](O)CNCCC2CCC2)c(OC)c1	ZINC000819145734	DG	On-Demand	Anodyne	ADRB2	25	65
C/C=C\c1ccc(OC[C@@H](O)CNCCC2CCC2)c(OC)c1	ZINC000819145734	DG	On-Demand	Anodyne	ADRB1	31	65
C/C=C\c1ccc(OC[C@H](O)CNCCC2CCC2)c(OC)c1	ZINC000819145735	DG	On-Demand	Anodyne	ADRB2	25	65
C/C=C\c1ccc(OC[C@H](O)CNCCC2CCC2)c(OC)c1	ZINC000819145735	DG	On-Demand	Anodyne	ADRB1	31	65
C/C=C/c1ccc(OC[C@H](O)CNCCC2CCC2)c(OC)c1	ZINC000819145736	DG	On-Demand	Anodyne	ADRB2	25	65
C/C=C/c1ccc(OC[C@H](O)CNCCC2CCC2)c(OC)c1	ZINC000819145736	DG	On-Demand	Anodyne	ADRB1	31	65
C/C=C/c1ccc(OC[C@@H](O)CNCCC2CCC2)c(OC)c1	ZINC000819145737	DG	On-Demand	Anodyne	ADRB2	25	65
C/C=C/c1ccc(OC[C@@H](O)CNCCC2CCC2)c(OC)c1	ZINC000819145737	DG	On-Demand	Anodyne	ADRB1	31	65
O=C(CCNCCC1CCC1)Nc1ccccc1	ZINC000819145739	BF	On-Demand	Anodyne	LTA4H	28	40
O=C(CCNCCC1CCC1)Nc1ccccc1	ZINC000819145739	BF	On-Demand	Anodyne	HDAC10	29	44
O=C(CCNCCC1CCC1)Nc1ccccc1	ZINC000819145739	BF	On-Demand	Anodyne	HDAC2	19	44
O=C(CCNCCC1CCC1)Nc1ccccc1	ZINC000819145739	BF	On-Demand	Anodyne	HDAC3	21	44
O=C(CCNCCC1CCC1)Nc1ccccc1	ZINC000819145739	BF	On-Demand	Anodyne	HDAC6	22	44
O=C(CCNCCC1CCC1)Nc1ccccc1	ZINC000819145739	BF	On-Demand	Anodyne	HDAC11	27	44
O=S(=O)(N1CCC(NC[C@@H](O)c2cc3ccccc3o2)CC1)C(F)(F)F	ZINC000819145754	GE	On-Demand	Anodyne	SFRP1	115	36
O=S(=O)(N1CCC(NC[C@@H](O)c2cc3ccccc3o2)CC1)C(F)(F)F	ZINC000819145754	GE	On-Demand	Anodyne	WNT3	73	35
CCOC(=O)Cn1cnc(NCc2cc3ccccc3nc2N2CCOCC2)n1	ZINC000819145759	GD	On-Demand	Anodyne	STAT6	54	36
O=C(CCc1nnc(C2CCCC2)o1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145764	FE	On-Demand	Anodyne	ACE	75	49
O=C(CCc1nnc(C2CCCC2)o1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145764	FE	On-Demand	Anodyne	MME	105	42
O=C(CCc1nnc(C2CCCC2)o1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145764	FE	On-Demand	Anodyne	ANPEP	41	34
O=C(CCc1nnc(C2CCCC2)o1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145764	FE	On-Demand	Anodyne	CPA1	35	40
O=C(CCc1nnc(C2CCCC2)o1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145764	FE	On-Demand	Anodyne	NPFFR2	53	32
O=C(CCc1nnc(C2CCCC2)o1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145764	FE	On-Demand	Anodyne	ITGA4	43	38
O=C(CCc1nnc(C2CCCC2)o1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145764	FE	On-Demand	Anodyne	NAALAD2	23	40
O=C(CCc1nnc(C2CCCC2)o1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145764	FE	On-Demand	Anodyne	ECE1	41	37
O=C(CCc1nnc(C2CCCC2)o1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145764	FE	On-Demand	Anodyne	REN	42	35
O=C(CCc1nnc(C2CCCC2)o1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145764	FE	On-Demand	Anodyne	CAPN1	33	41
O=C(CCc1nnc(C2CCCC2)o1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145764	FE	On-Demand	Anodyne	ACE2	82	42
O=C(CCc1nnc(C2CCCC2)o1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145764	FE	On-Demand	Anodyne	FPR1	59	37
O=C(CCc1nnc(C2CCCC2)o1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145764	FE	On-Demand	Anodyne	NPPA	42	36
O=C(CCc1nnc(C2CCCC2)o1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145764	FE	On-Demand	Anodyne	BLA1_STEMA	75	48
O=C(CCc1nnc(C2CCCC2)o1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145764	FE	On-Demand	Anodyne	BRCA1	54	38
O=C(CCc1nnc(C2CCCC2)o1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819145764	FE	On-Demand	Anodyne	NPFFR1	41	33
O=C(CCc1nnc(C2CCCC2)o1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145766	FE	On-Demand	Anodyne	ACE	75	49
O=C(CCc1nnc(C2CCCC2)o1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145766	FE	On-Demand	Anodyne	MME	105	42
O=C(CCc1nnc(C2CCCC2)o1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145766	FE	On-Demand	Anodyne	ANPEP	41	34
O=C(CCc1nnc(C2CCCC2)o1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145766	FE	On-Demand	Anodyne	CPA1	35	40
O=C(CCc1nnc(C2CCCC2)o1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145766	FE	On-Demand	Anodyne	NPFFR2	53	32
O=C(CCc1nnc(C2CCCC2)o1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145766	FE	On-Demand	Anodyne	ITGA4	43	38
O=C(CCc1nnc(C2CCCC2)o1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145766	FE	On-Demand	Anodyne	NAALAD2	23	40
O=C(CCc1nnc(C2CCCC2)o1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145766	FE	On-Demand	Anodyne	ECE1	41	37
O=C(CCc1nnc(C2CCCC2)o1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145766	FE	On-Demand	Anodyne	REN	42	35
O=C(CCc1nnc(C2CCCC2)o1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145766	FE	On-Demand	Anodyne	CAPN1	33	41
O=C(CCc1nnc(C2CCCC2)o1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145766	FE	On-Demand	Anodyne	ACE2	82	42
O=C(CCc1nnc(C2CCCC2)o1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145766	FE	On-Demand	Anodyne	FPR1	59	37
O=C(CCc1nnc(C2CCCC2)o1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145766	FE	On-Demand	Anodyne	NPPA	42	36
O=C(CCc1nnc(C2CCCC2)o1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145766	FE	On-Demand	Anodyne	BLA1_STEMA	75	48
O=C(CCc1nnc(C2CCCC2)o1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145766	FE	On-Demand	Anodyne	BRCA1	54	38
O=C(CCc1nnc(C2CCCC2)o1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819145766	FE	On-Demand	Anodyne	NPFFR1	41	33
Cc1ccccc1[C@@H](O)CNCCc1ccc(NC(=O)OC(C)(C)C)cc1	ZINC000819145768	FI	On-Demand	Anodyne	ADRB2	82	45
Cc1ccccc1[C@@H](O)CNCCc1ccc(NC(=O)OC(C)(C)C)cc1	ZINC000819145768	FI	On-Demand	Anodyne	ADRB1	98	49
Cc1ccccc1[C@@H](O)CNCCc1ccc(NC(=O)OC(C)(C)C)cc1	ZINC000819145768	FI	On-Demand	Anodyne	ADRB3	125	49
O=C(CC[S@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1F	ZINC000819145773	EF	On-Demand	Anodyne	HCAR2	29	42
O=C(CC[S@@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1F	ZINC000819145774	EF	On-Demand	Anodyne	HCAR2	29	42
O=C(CCOc1ccccc1)NNC(=O)N1CCO[C@@H](C(=O)O)C1	ZINC000819145775	EB	On-Demand	Reactive	CYSLTR2	51	36
O=C(CCOc1ccccc1)NNC(=O)N1CCO[C@H](C(=O)O)C1	ZINC000819145776	EB	On-Demand	Reactive	CYSLTR2	51	36
O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)N[C@H](C(=O)O)c1ccccc1	ZINC000819145780	FC	On-Demand	Anodyne	NAALAD2	19	40
O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)N[C@H](C(=O)O)c1ccccc1	ZINC000819145781	FC	On-Demand	Anodyne	NAALAD2	19	40
O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)N[C@H](C(=O)O)c1ccccc1	ZINC000819145782	FC	On-Demand	Anodyne	NAALAD2	19	40
O=C(CCS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145783	EE	On-Demand	Anodyne	CA2	17	41
O=C(CCS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145783	EE	On-Demand	Anodyne	LTA4H	39	42
O=C(CCS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145783	EE	On-Demand	Anodyne	CA1	15	41
O=C(CCS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145783	EE	On-Demand	Anodyne	HDAC8	15	43
O=C(CCS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145783	EE	On-Demand	Anodyne	HDAC10	15	43
O=C(CCS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145783	EE	On-Demand	Anodyne	CA5B	38	40
O=C(CCS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145783	EE	On-Demand	Anodyne	CA5A	43	40
O=C(CCS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145783	EE	On-Demand	Anodyne	HDAC6	15	43
O=C(CCc1nc2ccccc2oc1=O)NCc1ccc(C(=O)O)cc1	ZINC000819145785	FE	On-Demand	Anodyne	BCHE	40	34
O=C(CCSc1ccccn1)NCc1ccc(C(=O)O)cc1	ZINC000819145787	DF	On-Demand	Anodyne	TNKS	64	39
O=C(CCSc1ccccn1)NCc1ccc(C(=O)O)cc1	ZINC000819145787	DF	On-Demand	Anodyne	SUCNR1	35	43
O=C(CCSc1ccccn1)NCc1ccc(C(=O)O)cc1	ZINC000819145787	DF	On-Demand	Anodyne	FAS	23	47
O=C(CCS(=O)(=O)c1ccc(F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819145788	FE	On-Demand	Anodyne	CA2	22	53
O=C(CCS(=O)(=O)c1ccc(F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819145788	FE	On-Demand	Anodyne	CA1	17	53
O=C(CCS(=O)(=O)c1ccc(F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819145788	FE	On-Demand	Anodyne	CA5B	21	42
O=C(CCS(=O)(=O)c1ccc(F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819145788	FE	On-Demand	Anodyne	CA4	16	42
O=C(CCS(=O)(=O)c1ccc(F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819145788	FE	On-Demand	Anodyne	CA5A	24	42
O=C(CCS(=O)(=O)c1ccc(F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819145788	FE	On-Demand	Anodyne	CYNT	17	40
O=C(CCS(=O)(=O)c1ccc(F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819145788	FE	On-Demand	Anodyne	NAMPT	42	37
O=C(CCn1ccnc1)Nc1cccc(C(=O)NC2(C(=O)O)CCCCC2)c1	ZINC000819145800	GE	On-Demand	Anodyne	TBXAS1	48	47
O=C(CCn1ccnc1)Nc1cccc(C(=O)NC2(C(=O)O)CCCCC2)c1	ZINC000819145800	GE	On-Demand	Anodyne	KCNK3	63	38
O=C(CCc1ccccc1)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819145801	ED	On-Demand	Reactive	GRIN2B	15	41
O=C(CCc1ccccc1)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819145801	ED	On-Demand	Reactive	HCAR2	17	43
O=C(CCc1ccccc1)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819145801	ED	On-Demand	Reactive	FFAR1	35	44
O=C(CCc1ccccc1)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819145801	ED	On-Demand	Reactive	PSMB5	21	40
O=C(CC[S@@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145802	EF	On-Demand	Anodyne	LTA4H	38	42
O=C(CC[S@@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145802	EF	On-Demand	Anodyne	HDAC8	19	43
O=C(CC[S@@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145802	EF	On-Demand	Anodyne	HDAC10	19	43
O=C(CC[S@@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145802	EF	On-Demand	Anodyne	HDAC2	17	43
O=C(CC[S@@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145802	EF	On-Demand	Anodyne	HDAC3	15	43
O=C(CC[S@@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145802	EF	On-Demand	Anodyne	HDAC6	18	43
O=C(CC[S@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145803	EF	On-Demand	Anodyne	LTA4H	38	42
O=C(CC[S@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145803	EF	On-Demand	Anodyne	HDAC8	19	43
O=C(CC[S@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145803	EF	On-Demand	Anodyne	HDAC10	19	43
O=C(CC[S@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145803	EF	On-Demand	Anodyne	HDAC2	17	43
O=C(CC[S@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145803	EF	On-Demand	Anodyne	HDAC3	15	43
O=C(CC[S@](=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819145803	EF	On-Demand	Anodyne	HDAC6	18	43
O[C@@H](CN[C@@H]1CCN(c2c(F)cccc2F)C1)c1ccc(F)cc1	ZINC000819145822	EG	On-Demand	Anodyne	SLC6A3	17	47
O[C@H](CN[C@@H]1CCN(c2c(F)cccc2F)C1)c1ccc(F)cc1	ZINC000819145823	EG	On-Demand	Anodyne	SLC6A3	17	47
O[C@H](CN[C@H]1CCN(c2c(F)cccc2F)C1)c1ccc(F)cc1	ZINC000819145824	EG	On-Demand	Anodyne	SLC6A3	17	47
O[C@@H](CN[C@H]1CCN(c2c(F)cccc2F)C1)c1ccc(F)cc1	ZINC000819145825	EG	On-Demand	Anodyne	SLC6A3	17	47
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145831	FF	On-Demand	Anodyne	DRD4	22	40
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145831	FF	On-Demand	Anodyne	ADRB3	21	41
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145831	FF	On-Demand	Anodyne	SIGMAR1	15	46
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145831	FF	On-Demand	Anodyne	CCR3	37	42
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145831	FF	On-Demand	Anodyne	MCHR1	20	45
COc1cc(CN2CC[C@@H](NC[C@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145832	FF	On-Demand	Anodyne	DRD4	22	40
COc1cc(CN2CC[C@@H](NC[C@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145832	FF	On-Demand	Anodyne	ADRB3	21	41
COc1cc(CN2CC[C@@H](NC[C@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145832	FF	On-Demand	Anodyne	SIGMAR1	15	46
COc1cc(CN2CC[C@@H](NC[C@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145832	FF	On-Demand	Anodyne	CCR3	37	42
COc1cc(CN2CC[C@@H](NC[C@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145832	FF	On-Demand	Anodyne	MCHR1	20	45
COc1cc(CN2CC[C@H](NC[C@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145833	FF	On-Demand	Anodyne	DRD4	22	40
COc1cc(CN2CC[C@H](NC[C@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145833	FF	On-Demand	Anodyne	ADRB3	21	41
COc1cc(CN2CC[C@H](NC[C@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145833	FF	On-Demand	Anodyne	SIGMAR1	15	46
COc1cc(CN2CC[C@H](NC[C@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145833	FF	On-Demand	Anodyne	CCR3	37	42
COc1cc(CN2CC[C@H](NC[C@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145833	FF	On-Demand	Anodyne	MCHR1	20	45
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145834	FF	On-Demand	Anodyne	DRD4	22	40
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145834	FF	On-Demand	Anodyne	ADRB3	21	41
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145834	FF	On-Demand	Anodyne	SIGMAR1	15	46
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145834	FF	On-Demand	Anodyne	CCR3	37	42
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cccc(F)c3)C2)cc(OC)c1	ZINC000819145834	FF	On-Demand	Anodyne	MCHR1	20	45
COc1cc(CN2CC[C@H](NCC3(O)CCCCC3)C2)cc(OC)c1	ZINC000819145835	EF	On-Demand	Anodyne	MCHR1	17	47
COc1cc(CN2CC[C@@H](NCC3(O)CCCCC3)C2)cc(OC)c1	ZINC000819145836	EF	On-Demand	Anodyne	MCHR1	17	47
C[C@@H]1CCC[C@](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)(N(C)C)C1	ZINC000819145844	GG	On-Demand	Mild	PAPA1_CARPA	37	45
C[C@@H]1CCC[C@](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)(N(C)C)C1	ZINC000819145845	GG	On-Demand	Mild	PAPA1_CARPA	37	45
O[C@@H](CNCc1ccnn1CCc1ccccc1)c1cccc(F)c1	ZINC000819145880	EG	On-Demand	Anodyne	ADRB1	18	40
O[C@@H](CNCc1ccnn1CCc1ccccc1)c1cccc(F)c1	ZINC000819145880	EG	On-Demand	Anodyne	ADRB3	40	40
O[C@H](CNCc1ccnn1CCc1ccccc1)c1cccc(F)c1	ZINC000819145882	EG	On-Demand	Anodyne	ADRB1	18	40
O[C@H](CNCc1ccnn1CCc1ccccc1)c1cccc(F)c1	ZINC000819145882	EG	On-Demand	Anodyne	ADRB3	40	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(c2ccc(C#N)cn2)CC1	ZINC000819145883	FD	On-Demand	Mild	SSTR1	16	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(c2ccc(C#N)cn2)CC1	ZINC000819145883	FD	On-Demand	Mild	GPR119	20	40
O=C(c1ccc(Cl)cc1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819145888	EI	On-Demand	Anodyne	SLC18A3	43	38
O=C(c1ccc(Cl)cc1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819145888	EI	On-Demand	Anodyne	L3MBTL3	52	35
CC(=O)c1cccc(OC[C@@H](O)CNCCC2CCC2)c1	ZINC000819145907	CE	On-Demand	Anodyne	ADRB2	62	48
CC(=O)c1cccc(OC[C@@H](O)CNCCC2CCC2)c1	ZINC000819145907	CE	On-Demand	Anodyne	ADRB1	100	48
CC(=O)c1cccc(OC[C@@H](O)CNCCC2CCC2)c1	ZINC000819145907	CE	On-Demand	Anodyne	ADRB3	68	42
CC(=O)c1cccc(OC[C@@H](O)CNCCC2CCC2)c1	ZINC000819145907	CE	On-Demand	Anodyne	ABCB1	33	50
CC(=O)c1cccc(OC[C@H](O)CNCCC2CCC2)c1	ZINC000819145908	CE	On-Demand	Anodyne	ADRB2	62	48
CC(=O)c1cccc(OC[C@H](O)CNCCC2CCC2)c1	ZINC000819145908	CE	On-Demand	Anodyne	ADRB1	100	48
CC(=O)c1cccc(OC[C@H](O)CNCCC2CCC2)c1	ZINC000819145908	CE	On-Demand	Anodyne	ADRB3	68	42
CC(=O)c1cccc(OC[C@H](O)CNCCC2CCC2)c1	ZINC000819145908	CE	On-Demand	Anodyne	ABCB1	33	50
C[C@@H](OC[C@H](O)CNCCC1CCC1)c1ccc(Cl)cc1	ZINC000819145935	DH	On-Demand	Anodyne	CASR	24	40
C[C@@H](OC[C@@H](O)CNCCC1CCC1)c1ccc(Cl)cc1	ZINC000819145938	DH	On-Demand	Anodyne	CASR	24	40
Cc1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)c(C)c1	ZINC000819145949	FE	On-Demand	Anodyne	ADRB2	18	42
Cc1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)c(C)c1	ZINC000819145951	FE	On-Demand	Anodyne	ADRB2	18	42
N#Cc1ccc(N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)nc1	ZINC000819145952	DD	On-Demand	Mild	FASN	30	40
N#Cc1ccc(N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)nc1	ZINC000819145953	DD	On-Demand	Mild	FASN	30	40
N#Cc1ccc(N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)nc1	ZINC000819145954	DD	On-Demand	Mild	FASN	30	40
N#Cc1ccc(N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)nc1	ZINC000819145955	DD	On-Demand	Mild	FASN	30	40
O=C1CCc2cc(OC[C@@H](O)CNCCC3CCC3)ccc2N1	ZINC000819145967	DE	On-Demand	Anodyne	ADRB1	59	43
O=C1CCc2cc(OC[C@@H](O)CNCCC3CCC3)ccc2N1	ZINC000819145967	DE	On-Demand	Anodyne	ADRB3	39	42
O=C1CCc2cc(OC[C@H](O)CNCCC3CCC3)ccc2N1	ZINC000819145970	DE	On-Demand	Anodyne	ADRB1	59	43
O=C1CCc2cc(OC[C@H](O)CNCCC3CCC3)ccc2N1	ZINC000819145970	DE	On-Demand	Anodyne	ADRB3	39	42
CC(=O)c1cccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)c1	ZINC000819145984	FD	On-Demand	Anodyne	ADRB2	28	40
CC(=O)c1cccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)c1	ZINC000819145984	FD	On-Demand	Anodyne	ADRB1	46	38
CC(=O)c1cccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)c1	ZINC000819145984	FD	On-Demand	Anodyne	ABCB1	26	47
CC(=O)c1cccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)c1	ZINC000819145984	FD	On-Demand	Anodyne	PDS	48	36
CCOC(=O)Cn1cnc(NCc2ccc(Cl)c([N+](=O)[O-])c2)n1	ZINC000819145986	EE	On-Demand	Bother	DNAE	56	39
CC(=O)c1cccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)c1	ZINC000819145987	FD	On-Demand	Anodyne	ADRB2	28	40
CC(=O)c1cccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)c1	ZINC000819145987	FD	On-Demand	Anodyne	ADRB1	46	38
CC(=O)c1cccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)c1	ZINC000819145987	FD	On-Demand	Anodyne	ABCB1	26	47
CC(=O)c1cccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)c1	ZINC000819145987	FD	On-Demand	Anodyne	PDS	48	36
CC(=O)c1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819146011	CE	On-Demand	Anodyne	ADRB2	63	46
CC(=O)c1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819146011	CE	On-Demand	Anodyne	ADRB1	96	56
CC(=O)c1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819146011	CE	On-Demand	Anodyne	ADRB3	66	46
CC(=O)c1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819146011	CE	On-Demand	Anodyne	ABCB1	23	60
CC(=O)c1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819146013	CE	On-Demand	Anodyne	ADRB2	63	46
CC(=O)c1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819146013	CE	On-Demand	Anodyne	ADRB1	96	56
CC(=O)c1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819146013	CE	On-Demand	Anodyne	ADRB3	66	46
CC(=O)c1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819146013	CE	On-Demand	Anodyne	ABCB1	23	60
CCOC(=O)Cn1cnc(NCc2ccc(N3CCN(C)CC3)cc2)n1	ZINC000819146037	FD	On-Demand	Clean	STAT6	38	44
O[C@@H](CCc1ccccc1)CNCCC1CCC1	ZINC000819146039	BF	On-Demand	Anodyne	SLC18A2	64	42
O[C@H](CCc1ccccc1)CNCCC1CCC1	ZINC000819146040	BF	On-Demand	Anodyne	SLC18A2	64	42
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146049	FF	On-Demand	Anodyne	ADRB1	25	42
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146049	FF	On-Demand	Anodyne	DRD4	36	42
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146049	FF	On-Demand	Anodyne	SLC6A3	27	46
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146049	FF	On-Demand	Anodyne	ADRB3	40	42
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146049	FF	On-Demand	Anodyne	SIGMAR1	33	52
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146049	FF	On-Demand	Anodyne	SSTR5	47	41
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146049	FF	On-Demand	Anodyne	MCHR1	24	55
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146049	FF	On-Demand	Anodyne	CCR8	20	41
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146052	FF	On-Demand	Anodyne	ADRB1	25	42
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146052	FF	On-Demand	Anodyne	DRD4	36	42
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146052	FF	On-Demand	Anodyne	SLC6A3	27	46
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146052	FF	On-Demand	Anodyne	ADRB3	40	42
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146052	FF	On-Demand	Anodyne	SIGMAR1	33	52
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146052	FF	On-Demand	Anodyne	SSTR5	47	41
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146052	FF	On-Demand	Anodyne	MCHR1	24	55
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146052	FF	On-Demand	Anodyne	CCR8	20	41
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146055	FF	On-Demand	Anodyne	ADRB1	25	42
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146055	FF	On-Demand	Anodyne	DRD4	36	42
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146055	FF	On-Demand	Anodyne	SLC6A3	27	46
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146055	FF	On-Demand	Anodyne	ADRB3	40	42
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146055	FF	On-Demand	Anodyne	SIGMAR1	33	52
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146055	FF	On-Demand	Anodyne	SSTR5	47	41
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146055	FF	On-Demand	Anodyne	MCHR1	24	55
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146055	FF	On-Demand	Anodyne	CCR8	20	41
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146058	FF	On-Demand	Anodyne	ADRB1	25	42
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146058	FF	On-Demand	Anodyne	DRD4	36	42
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146058	FF	On-Demand	Anodyne	SLC6A3	27	46
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146058	FF	On-Demand	Anodyne	ADRB3	40	42
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146058	FF	On-Demand	Anodyne	SIGMAR1	33	52
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146058	FF	On-Demand	Anodyne	SSTR5	47	41
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146058	FF	On-Demand	Anodyne	MCHR1	24	55
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3)C2)cc(OC)c1	ZINC000819146058	FF	On-Demand	Anodyne	CCR8	20	41
CCOC(=O)Cn1cnc(NCc2ccc(N3CCOCC3)cc2)n1	ZINC000819146089	ED	On-Demand	Clean	EPHB4	57	34
CCOC(=O)Cn1cnc(NCc2ccc(N3CCOCC3)cc2)n1	ZINC000819146089	ED	On-Demand	Clean	STAT6	71	42
CCOC(=O)Cn1cnc(NCc2c(C)nn(-c3ccc(F)cc3)c2Cl)n1	ZINC000819146100	GF	On-Demand	Anodyne	P2RX7	23	43
O=C(C(F)=C1CCC1)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000819146137	DH	On-Demand	Anodyne	HTR1F	42	34
O=C(C(F)=C1CCC1)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000819146137	DH	On-Demand	Anodyne	CCR2	19	47
O[C@@H](CNCCC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819146139	DG	On-Demand	Anodyne	ADRB2	47	42
O[C@@H](CNCCC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819146139	DG	On-Demand	Anodyne	ADRB1	74	51
O[C@@H](CNCCC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819146139	DG	On-Demand	Anodyne	ADRB3	46	39
O[C@@H](CNCCC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819146139	DG	On-Demand	Anodyne	PDS	47	40
O[C@H](CNCCC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819146141	DG	On-Demand	Anodyne	ADRB2	47	42
O[C@H](CNCCC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819146141	DG	On-Demand	Anodyne	ADRB1	74	51
O[C@H](CNCCC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819146141	DG	On-Demand	Anodyne	ADRB3	46	39
O[C@H](CNCCC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819146141	DG	On-Demand	Anodyne	PDS	47	40
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(NC(=O)OC(C)(C)C)cc1	ZINC000819146215	GI	On-Demand	Anodyne	ADRB2	64	44
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(NC(=O)OC(C)(C)C)cc1	ZINC000819146215	GI	On-Demand	Anodyne	ADRB1	81	44
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(NC(=O)OC(C)(C)C)cc1	ZINC000819146215	GI	On-Demand	Anodyne	ADRB3	99	44
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(NC(=O)OC(C)(C)C)cc1	ZINC000819146215	GI	On-Demand	Anodyne	LEF	49	38
CCOC(=O)Cn1cnc(NCc2ccccc2N2CCCCC2)n1	ZINC000819146221	EE	On-Demand	Anodyne	KCNQ2	69	37
O=C(CCNCCC1CCC1)Nc1cccnc1	ZINC000819146225	BE	On-Demand	Anodyne	NAMPT	30	44
O[C@@H](CNCCC1CCC1)c1ccc(OC(F)(F)F)cc1	ZINC000819146267	DG	On-Demand	Anodyne	ADRB3	26	42
O[C@H](CNCCC1CCC1)c1ccc(OC(F)(F)F)cc1	ZINC000819146268	DG	On-Demand	Anodyne	ADRB3	26	42
CCOc1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819146270	CF	On-Demand	Anodyne	ADRB2	68	47
CCOc1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819146270	CF	On-Demand	Anodyne	ADRB1	90	52
CCOc1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819146270	CF	On-Demand	Anodyne	ADRB3	59	47
CCOc1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819146273	CF	On-Demand	Anodyne	ADRB2	68	47
CCOc1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819146273	CF	On-Demand	Anodyne	ADRB1	90	52
CCOc1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819146273	CF	On-Demand	Anodyne	ADRB3	59	47
CCC(=O)c1cc(Cl)ccc1OCc1cc(=O)oc2cc(C)ccc12	ZINC000819146274	FJ	On-Demand	Anodyne	MAOB	37	44
CCC(=O)c1cc(Cl)ccc1OCc1cc(=O)oc2cc(C)ccc12	ZINC000819146274	FJ	On-Demand	Anodyne	HSD17B3	22	42
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3C)C2)cc(OC)c1	ZINC000819146281	FF	On-Demand	Anodyne	DRD4	28	41
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3C)C2)cc(OC)c1	ZINC000819146281	FF	On-Demand	Anodyne	SIGMAR1	23	52
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3C)C2)cc(OC)c1	ZINC000819146281	FF	On-Demand	Anodyne	SSTR5	43	40
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3C)C2)cc(OC)c1	ZINC000819146281	FF	On-Demand	Anodyne	MCHR1	20	48
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3C)C2)cc(OC)c1	ZINC000819146283	FF	On-Demand	Anodyne	DRD4	28	41
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3C)C2)cc(OC)c1	ZINC000819146283	FF	On-Demand	Anodyne	SIGMAR1	23	52
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3C)C2)cc(OC)c1	ZINC000819146283	FF	On-Demand	Anodyne	SSTR5	43	40
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3C)C2)cc(OC)c1	ZINC000819146283	FF	On-Demand	Anodyne	MCHR1	20	48
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccccc3C)C2)cc(OC)c1	ZINC000819146286	FF	On-Demand	Anodyne	DRD4	28	41
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccccc3C)C2)cc(OC)c1	ZINC000819146286	FF	On-Demand	Anodyne	SIGMAR1	23	52
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccccc3C)C2)cc(OC)c1	ZINC000819146286	FF	On-Demand	Anodyne	SSTR5	43	40
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccccc3C)C2)cc(OC)c1	ZINC000819146286	FF	On-Demand	Anodyne	MCHR1	20	48
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3C)C2)cc(OC)c1	ZINC000819146289	FF	On-Demand	Anodyne	DRD4	28	41
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3C)C2)cc(OC)c1	ZINC000819146289	FF	On-Demand	Anodyne	SIGMAR1	23	52
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3C)C2)cc(OC)c1	ZINC000819146289	FF	On-Demand	Anodyne	SSTR5	43	40
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3C)C2)cc(OC)c1	ZINC000819146289	FF	On-Demand	Anodyne	MCHR1	20	48
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819146302	GD	On-Demand	Anodyne	ADRB2	49	50
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819146302	GD	On-Demand	Anodyne	ADRB1	86	50
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819146302	GD	On-Demand	Anodyne	TSHR	41	31
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819146302	GD	On-Demand	Anodyne	ADRB3	56	48
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819146302	GD	On-Demand	Anodyne	ABCB1	16	42
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819146306	GD	On-Demand	Anodyne	ADRB2	49	50
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819146306	GD	On-Demand	Anodyne	ADRB1	86	50
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819146306	GD	On-Demand	Anodyne	TSHR	41	31
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819146306	GD	On-Demand	Anodyne	ADRB3	56	48
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cn(-c3ccccc3)nn2)cc1	ZINC000819146306	GD	On-Demand	Anodyne	ABCB1	16	42
COc1cccc(OC)c1OC[C@@H](O)CNCc1cn(-c2ccccc2)nn1	ZINC000819146312	GD	On-Demand	Anodyne	ADRB2	22	40
COc1cccc(OC)c1OC[C@@H](O)CNCc1cn(-c2ccccc2)nn1	ZINC000819146312	GD	On-Demand	Anodyne	ADRB1	24	43
COc1cccc(OC)c1OC[C@H](O)CNCc1cn(-c2ccccc2)nn1	ZINC000819146314	GD	On-Demand	Anodyne	ADRB2	22	40
COc1cccc(OC)c1OC[C@H](O)CNCc1cn(-c2ccccc2)nn1	ZINC000819146314	GD	On-Demand	Anodyne	ADRB1	24	43
COCCOc1ccc(NC(=O)C(F)=C2CCC2)cc1Cl	ZINC000819146327	DH	On-Demand	Anodyne	DHODH	15	45
COCCOc1ccc(NC(=O)C(F)=C2CCC2)cc1Cl	ZINC000819146327	DH	On-Demand	Anodyne	GRM4	20	42
O[C@H](CNCCC1CCC1)COc1ccc2ccccc2c1	ZINC000819146328	CG	On-Demand	Anodyne	ADRB2	69	58
O[C@H](CNCCC1CCC1)COc1ccc2ccccc2c1	ZINC000819146328	CG	On-Demand	Anodyne	ADRB1	91	45
O[C@H](CNCCC1CCC1)COc1ccc2ccccc2c1	ZINC000819146328	CG	On-Demand	Anodyne	ADRB3	63	45
O[C@H](CNCCC1CCC1)COc1ccc2ccccc2c1	ZINC000819146328	CG	On-Demand	Anodyne	CASR	47	44
O[C@H](CNCCC1CCC1)COc1ccc2ccccc2c1	ZINC000819146328	CG	On-Demand	Anodyne	CYP2D6	19	44
O[C@H](CNCCC1CCC1)COc1ccc2ccccc2c1	ZINC000819146328	CG	On-Demand	Anodyne	ABCB1	18	40
O[C@@H](CNCCC1CCC1)COc1ccc2ccccc2c1	ZINC000819146329	CG	On-Demand	Anodyne	ADRB2	69	58
O[C@@H](CNCCC1CCC1)COc1ccc2ccccc2c1	ZINC000819146329	CG	On-Demand	Anodyne	ADRB1	91	45
O[C@@H](CNCCC1CCC1)COc1ccc2ccccc2c1	ZINC000819146329	CG	On-Demand	Anodyne	ADRB3	63	45
O[C@@H](CNCCC1CCC1)COc1ccc2ccccc2c1	ZINC000819146329	CG	On-Demand	Anodyne	CASR	47	44
O[C@@H](CNCCC1CCC1)COc1ccc2ccccc2c1	ZINC000819146329	CG	On-Demand	Anodyne	CYP2D6	19	44
O[C@@H](CNCCC1CCC1)COc1ccc2ccccc2c1	ZINC000819146329	CG	On-Demand	Anodyne	ABCB1	18	40
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146355	FF	On-Demand	Anodyne	DRD4	28	40
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146355	FF	On-Demand	Anodyne	SIGMAR1	25	52
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146355	FF	On-Demand	Anodyne	SSTR5	47	39
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146355	FF	On-Demand	Anodyne	CCR3	33	40
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146355	FF	On-Demand	Anodyne	MCHR1	22	48
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146356	FF	On-Demand	Anodyne	DRD4	28	40
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146356	FF	On-Demand	Anodyne	SIGMAR1	25	52
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146356	FF	On-Demand	Anodyne	SSTR5	47	39
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146356	FF	On-Demand	Anodyne	CCR3	33	40
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146356	FF	On-Demand	Anodyne	MCHR1	22	48
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146357	FF	On-Demand	Anodyne	DRD4	28	40
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146357	FF	On-Demand	Anodyne	SIGMAR1	25	52
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146357	FF	On-Demand	Anodyne	SSTR5	47	39
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146357	FF	On-Demand	Anodyne	CCR3	33	40
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146357	FF	On-Demand	Anodyne	MCHR1	22	48
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146358	FF	On-Demand	Anodyne	DRD4	28	40
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146358	FF	On-Demand	Anodyne	SIGMAR1	25	52
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146358	FF	On-Demand	Anodyne	SSTR5	47	39
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146358	FF	On-Demand	Anodyne	CCR3	33	40
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3F)C2)cc(OC)c1	ZINC000819146358	FF	On-Demand	Anodyne	MCHR1	22	48
CSc1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819146365	CF	On-Demand	Anodyne	ADRB2	61	45
CSc1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819146365	CF	On-Demand	Anodyne	ADRB1	84	50
CSc1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819146365	CF	On-Demand	Anodyne	ADRB3	57	45
CSc1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819146366	CF	On-Demand	Anodyne	ADRB2	61	45
CSc1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819146366	CF	On-Demand	Anodyne	ADRB1	84	50
CSc1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819146366	CF	On-Demand	Anodyne	ADRB3	57	45
COc1cc(CN2CC[C@H](NCCS(C)(=O)=O)C2)cc(OC)c1	ZINC000819146371	EC	On-Demand	Anodyne	DRD4	22	46
COc1cc(CN2CC[C@H](NCCS(C)(=O)=O)C2)cc(OC)c1	ZINC000819146371	EC	On-Demand	Anodyne	CCR3	20	41
COc1cc(CN2CC[C@H](NCCS(C)(=O)=O)C2)cc(OC)c1	ZINC000819146371	EC	On-Demand	Anodyne	MCHR1	17	51
COc1cc(CN2CC[C@@H](NCCS(C)(=O)=O)C2)cc(OC)c1	ZINC000819146372	EC	On-Demand	Anodyne	DRD4	22	46
COc1cc(CN2CC[C@@H](NCCS(C)(=O)=O)C2)cc(OC)c1	ZINC000819146372	EC	On-Demand	Anodyne	CCR3	20	41
COc1cc(CN2CC[C@@H](NCCS(C)(=O)=O)C2)cc(OC)c1	ZINC000819146372	EC	On-Demand	Anodyne	MCHR1	17	51
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cc4ccccc4o3)C2)cc(OC)c1	ZINC000819146383	GG	On-Demand	Anodyne	DRD4	29	44
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cc4ccccc4o3)C2)cc(OC)c1	ZINC000819146383	GG	On-Demand	Anodyne	SIGMAR1	28	49
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cc4ccccc4o3)C2)cc(OC)c1	ZINC000819146383	GG	On-Demand	Anodyne	SSTR5	61	47
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cc4ccccc4o3)C2)cc(OC)c1	ZINC000819146383	GG	On-Demand	Anodyne	MCHR1	26	49
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cc4ccccc4o3)C2)cc(OC)c1	ZINC000819146384	GG	On-Demand	Anodyne	DRD4	29	44
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cc4ccccc4o3)C2)cc(OC)c1	ZINC000819146384	GG	On-Demand	Anodyne	SIGMAR1	28	49
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cc4ccccc4o3)C2)cc(OC)c1	ZINC000819146384	GG	On-Demand	Anodyne	SSTR5	61	47
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cc4ccccc4o3)C2)cc(OC)c1	ZINC000819146384	GG	On-Demand	Anodyne	MCHR1	26	49
COC(=O)c1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819146427	DD	On-Demand	Anodyne	ADRB2	67	51
COC(=O)c1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819146427	DD	On-Demand	Anodyne	ADRB1	101	53
COC(=O)c1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819146427	DD	On-Demand	Anodyne	ADRB3	71	51
COC(=O)c1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819146427	DD	On-Demand	Anodyne	ABCB1	20	49
COC(=O)c1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819146428	DD	On-Demand	Anodyne	ADRB2	67	51
COC(=O)c1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819146428	DD	On-Demand	Anodyne	ADRB1	101	53
COC(=O)c1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819146428	DD	On-Demand	Anodyne	ADRB3	71	51
COC(=O)c1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819146428	DD	On-Demand	Anodyne	ABCB1	20	49
CCOC(=O)Cn1cnc(NCc2ccc(N3CCCCC3)cc2)n1	ZINC000819146444	EE	On-Demand	Clean	STAT6	35	41
O[C@@H](CNCCC1CCC1)c1cccc(Cl)c1	ZINC000819146452	CG	On-Demand	Anodyne	ADRB2	45	39
O[C@@H](CNCCC1CCC1)c1cccc(Cl)c1	ZINC000819146452	CG	On-Demand	Anodyne	ADRB1	63	52
O[C@@H](CNCCC1CCC1)c1cccc(Cl)c1	ZINC000819146452	CG	On-Demand	Anodyne	ADRB3	81	52
O[C@H](CNCCC1CCC1)c1cccc(Cl)c1	ZINC000819146453	CG	On-Demand	Anodyne	ADRB2	45	39
O[C@H](CNCCC1CCC1)c1cccc(Cl)c1	ZINC000819146453	CG	On-Demand	Anodyne	ADRB1	63	52
O[C@H](CNCCC1CCC1)c1cccc(Cl)c1	ZINC000819146453	CG	On-Demand	Anodyne	ADRB3	81	52
O[C@H](CNCCC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819146485	DG	On-Demand	Anodyne	ADRB2	42	44
O[C@H](CNCCC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819146485	DG	On-Demand	Anodyne	ADRB1	70	39
O[C@H](CNCCC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819146485	DG	On-Demand	Anodyne	ADRB3	29	41
O[C@H](CNCCC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819146485	DG	On-Demand	Anodyne	ABCB1	23	41
O[C@@H](CNCCC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819146488	DG	On-Demand	Anodyne	ADRB2	42	44
O[C@@H](CNCCC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819146488	DG	On-Demand	Anodyne	ADRB1	70	39
O[C@@H](CNCCC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819146488	DG	On-Demand	Anodyne	ADRB3	29	41
O[C@@H](CNCCC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819146488	DG	On-Demand	Anodyne	ABCB1	23	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccccc1N1CCCC1)C2	ZINC000819146489	FF	On-Demand	Anodyne	KCNQ2	70	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccccc1N1CCCC1)C2	ZINC000819146493	FF	On-Demand	Anodyne	KCNQ2	70	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCC2CCC2)c1	ZINC000819146499	CE	On-Demand	Bother	ADRB3	52	38
O=[N+]([O-])c1cccc([C@H](O)CNCCC2CCC2)c1	ZINC000819146502	CE	On-Demand	Bother	ADRB3	52	38
OCc1cccc(CNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819146528	DF	On-Demand	Anodyne	ADRB2	40	41
OCc1cccc(CNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819146530	DF	On-Demand	Anodyne	ADRB2	40	41
CCC(=O)c1cc(Cl)ccc1OCC(=O)Nc1ccc2nc(O)[nH]c2c1	ZINC000819146531	FH	On-Demand	Anodyne	HTR2A	15	43
CCC(=O)c1cc(Cl)ccc1OCC(=O)Nc1ccc2nc(O)[nH]c2c1	ZINC000819146531	FH	On-Demand	Anodyne	AGPAT2	77	39
CCC(=O)c1cc(Cl)ccc1OCC(=O)Nc1ccc2nc(O)[nH]c2c1	ZINC000819146531	FH	On-Demand	Anodyne	MCHR1	17	44
CCC(=O)c1cc(Cl)ccc1OCC(=O)Nc1ccc2nc(O)[nH]c2c1	ZINC000819146531	FH	On-Demand	Anodyne	MCHR2	40	44
CCC(=O)c1cc(Cl)ccc1OCC(=O)Nc1ccc2nc(O)[nH]c2c1	ZINC000819146531	FH	On-Demand	Anodyne	ENPP1	66	39
O=S(=O)(N1CCC(NC[C@@H](O)c2cccnc2)CC1)C(F)(F)F	ZINC000819146535	FD	On-Demand	Anodyne	ADRB1	31	40
O=S(=O)(N1CCC(NC[C@@H](O)c2cccnc2)CC1)C(F)(F)F	ZINC000819146535	FD	On-Demand	Anodyne	ADRB3	110	51
O=S(=O)(N1CCC(NC[C@H](O)c2cccnc2)CC1)C(F)(F)F	ZINC000819146537	FD	On-Demand	Anodyne	ADRB1	31	40
O=S(=O)(N1CCC(NC[C@H](O)c2cccnc2)CC1)C(F)(F)F	ZINC000819146537	FD	On-Demand	Anodyne	ADRB3	110	51
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819146569	GE	On-Demand	Anodyne	RBP4	41	35
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819146569	GE	On-Demand	Anodyne	SFRP1	125	38
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819146569	GE	On-Demand	Anodyne	WNT3	82	36
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819146572	GE	On-Demand	Anodyne	RBP4	41	35
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819146572	GE	On-Demand	Anodyne	SFRP1	125	38
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819146572	GE	On-Demand	Anodyne	WNT3	82	36
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819146584	ED	On-Demand	Anodyne	ADRB3	27	42
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819146587	ED	On-Demand	Anodyne	ADRB3	27	42
CCc1noc(CC)c1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819146629	GF	On-Demand	Anodyne	GPR119	34	42
CCc1noc(CC)c1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819146631	GF	On-Demand	Anodyne	GPR119	34	42
O[C@@H](CN[C@@H]1CCN(c2c(F)cccc2F)C1)c1ccc(Cl)cc1	ZINC000819146663	FH	On-Demand	Anodyne	ADRB3	25	46
O[C@@H](CN[C@H]1CCN(c2c(F)cccc2F)C1)c1ccc(Cl)cc1	ZINC000819146666	FH	On-Demand	Anodyne	ADRB3	25	46
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819146670	FD	On-Demand	Anodyne	ADRB3	23	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3nccc(OC)n3)CC1)C2	ZINC000819146685	GD	On-Demand	Anodyne	NPBWR1	53	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3nccc(OC)n3)CC1)C2	ZINC000819146687	GD	On-Demand	Anodyne	NPBWR1	53	33
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(CCN2CCCCC2)cc1	ZINC000819146737	EG	On-Demand	Anodyne	HRH3	17	40
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(CCN2CCCCC2)cc1	ZINC000819146739	EG	On-Demand	Anodyne	HRH3	17	40
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(CCN2CCCCC2)cc1	ZINC000819146741	EG	On-Demand	Anodyne	HRH3	17	40
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(CCN2CCCCC2)cc1	ZINC000819146743	EG	On-Demand	Anodyne	HRH3	17	40
COCCOc1cc(C)ccc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819146793	FF	On-Demand	Bother	CACNA1C	61	40
COCCOc1cc(C)ccc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819146793	FF	On-Demand	Bother	CACNA1D	95	40
COCCOc1cc(C)ccc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819146794	FF	On-Demand	Bother	CACNA1C	61	40
COCCOc1cc(C)ccc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819146794	FF	On-Demand	Bother	CACNA1D	95	40
COCCOc1cc(C)ccc1CNC[C@H](O)c1cccnc1	ZINC000819146802	DE	On-Demand	Anodyne	ADRB2	18	43
COCCOc1cc(C)ccc1CNC[C@H](O)c1cccnc1	ZINC000819146802	DE	On-Demand	Anodyne	ADRB1	25	43
COCCOc1cc(C)ccc1CNC[C@H](O)c1cccnc1	ZINC000819146802	DE	On-Demand	Anodyne	ADRB3	76	48
COCCOc1cc(C)ccc1CNC[C@@H](O)c1cccnc1	ZINC000819146803	DE	On-Demand	Anodyne	ADRB2	18	43
COCCOc1cc(C)ccc1CNC[C@@H](O)c1cccnc1	ZINC000819146803	DE	On-Demand	Anodyne	ADRB1	25	43
COCCOc1cc(C)ccc1CNC[C@@H](O)c1cccnc1	ZINC000819146803	DE	On-Demand	Anodyne	ADRB3	76	48
Cc1cc(F)ccc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819146808	DH	On-Demand	Anodyne	ADRB2	56	41
Cc1cc(F)ccc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819146808	DH	On-Demand	Anodyne	ADRB1	62	53
Cc1cc(F)ccc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819146808	DH	On-Demand	Anodyne	ADRB3	80	55
Cc1cc(F)ccc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819146809	DH	On-Demand	Anodyne	ADRB2	56	41
Cc1cc(F)ccc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819146809	DH	On-Demand	Anodyne	ADRB1	62	53
Cc1cc(F)ccc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819146809	DH	On-Demand	Anodyne	ADRB3	80	55
COc1cccc(OC)c1OC[C@@H](O)CNCCC1CCC1	ZINC000819146836	DE	On-Demand	Anodyne	ADRB2	49	46
COc1cccc(OC)c1OC[C@@H](O)CNCCC1CCC1	ZINC000819146836	DE	On-Demand	Anodyne	ADRB1	71	47
COc1cccc(OC)c1OC[C@@H](O)CNCCC1CCC1	ZINC000819146836	DE	On-Demand	Anodyne	ADRB3	31	41
COc1cccc(OC)c1OC[C@H](O)CNCCC1CCC1	ZINC000819146838	DE	On-Demand	Anodyne	ADRB2	49	46
COc1cccc(OC)c1OC[C@H](O)CNCCC1CCC1	ZINC000819146838	DE	On-Demand	Anodyne	ADRB1	71	47
COc1cccc(OC)c1OC[C@H](O)CNCCC1CCC1	ZINC000819146838	DE	On-Demand	Anodyne	ADRB3	31	41
O[C@H](CNCCC1CCC1)Cc1ccccc1	ZINC000819146865	BE	On-Demand	Anodyne	SLC18A2	53	39
O[C@@H](CNCCC1CCC1)Cc1ccccc1	ZINC000819146867	BE	On-Demand	Anodyne	SLC18A2	53	39
O=S(=O)(N1CCC(NC[C@H](O)COCc2ccccc2)CC1)C(F)(F)F	ZINC000819146870	GD	On-Demand	Anodyne	ADRB2	18	41
O=S(=O)(N1CCC(NC[C@H](O)COCc2ccccc2)CC1)C(F)(F)F	ZINC000819146870	GD	On-Demand	Anodyne	ADRB1	18	41
O=S(=O)(N1CCC(NC[C@H](O)COCc2ccccc2)CC1)C(F)(F)F	ZINC000819146870	GD	On-Demand	Anodyne	ADRB3	24	45
O=S(=O)(N1CCC(NC[C@H](O)COCc2ccccc2)CC1)C(F)(F)F	ZINC000819146870	GD	On-Demand	Anodyne	SFRP1	91	34
O=S(=O)(N1CCC(NC[C@H](O)COCc2ccccc2)CC1)C(F)(F)F	ZINC000819146870	GD	On-Demand	Anodyne	WNT3	53	33
O=C(c1ccc(Cl)cc1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819146902	EG	On-Demand	Anodyne	L3MBTL3	44	33
O=C(c1ccc(Cl)cc1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819146904	EG	On-Demand	Anodyne	L3MBTL3	44	33
O=C(c1ccc(Cl)cc1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819146906	EG	On-Demand	Anodyne	L3MBTL3	44	33
O=C(c1ccc(Cl)cc1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819146908	EG	On-Demand	Anodyne	L3MBTL3	44	33
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1nnc(C2CCCCC2)s1	ZINC000819146918	FG	On-Demand	Anodyne	CDK5	35	45
O=C(CCNC1CCN(S(=O)(=O)C(F)(F)F)CC1)Nc1cccnc1	ZINC000819146930	GD	On-Demand	Anodyne	NAMPT	46	39
O=C(CCNCCC1CCC1)Nc1cccc(F)c1	ZINC000819146945	CF	On-Demand	Anodyne	FUCA1	15	45
O=S(=O)(N1CCC(NC[C@@H](O)c2ccccc2)CC1)C(F)(F)F	ZINC000819146946	FD	On-Demand	Anodyne	ADRB1	21	40
O=S(=O)(N1CCC(NC[C@@H](O)c2ccccc2)CC1)C(F)(F)F	ZINC000819146946	FD	On-Demand	Anodyne	ADRB3	42	40
O=S(=O)(N1CCC(NC[C@@H](O)c2ccccc2)CC1)C(F)(F)F	ZINC000819146946	FD	On-Demand	Anodyne	SFRP1	122	38
O=S(=O)(N1CCC(NC[C@@H](O)c2ccccc2)CC1)C(F)(F)F	ZINC000819146946	FD	On-Demand	Anodyne	WNT3	80	36
O=S(=O)(N1CCC(NC[C@H](O)c2ccccc2)CC1)C(F)(F)F	ZINC000819146947	FD	On-Demand	Anodyne	ADRB1	21	40
O=S(=O)(N1CCC(NC[C@H](O)c2ccccc2)CC1)C(F)(F)F	ZINC000819146947	FD	On-Demand	Anodyne	ADRB3	42	40
O=S(=O)(N1CCC(NC[C@H](O)c2ccccc2)CC1)C(F)(F)F	ZINC000819146947	FD	On-Demand	Anodyne	SFRP1	122	38
O=S(=O)(N1CCC(NC[C@H](O)c2ccccc2)CC1)C(F)(F)F	ZINC000819146947	FD	On-Demand	Anodyne	WNT3	80	36
CCOC(=O)Cn1cnc(NCc2ccc([N+](=O)[O-])c(Cl)c2)n1	ZINC000819146949	EE	On-Demand	Bother	DNAE	56	39
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000819146966	EG	On-Demand	Anodyne	HTR1F	41	33
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000819146966	EG	On-Demand	Anodyne	CCR2	29	53
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000819146966	EG	On-Demand	Anodyne	CDC7	30	40
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000819146967	EG	On-Demand	Anodyne	HTR1F	41	33
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000819146967	EG	On-Demand	Anodyne	CCR2	29	53
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000819146967	EG	On-Demand	Anodyne	CDC7	30	40
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000819146968	EG	On-Demand	Anodyne	HTR1F	41	33
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000819146968	EG	On-Demand	Anodyne	CCR2	29	53
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000819146968	EG	On-Demand	Anodyne	CDC7	30	40
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000819146969	EG	On-Demand	Anodyne	HTR1F	41	33
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000819146969	EG	On-Demand	Anodyne	CCR2	29	53
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2c[nH]c3ncccc23)CC1	ZINC000819146969	EG	On-Demand	Anodyne	CDC7	30	40
COc1cc(CN2CC[C@H](NCCC(=O)N(C)OC)C2)cc(OC)c1	ZINC000819146983	FD	On-Demand	Anodyne	DRD4	23	42
COc1cc(CN2CC[C@H](NCCC(=O)N(C)OC)C2)cc(OC)c1	ZINC000819146983	FD	On-Demand	Anodyne	SSTR5	43	34
COc1cc(CN2CC[C@H](NCCC(=O)N(C)OC)C2)cc(OC)c1	ZINC000819146983	FD	On-Demand	Anodyne	UTS2R	17	41
COc1cc(CN2CC[C@H](NCCC(=O)N(C)OC)C2)cc(OC)c1	ZINC000819146983	FD	On-Demand	Anodyne	MCHR1	25	49
COc1cc(CN2CC[C@@H](NCCC(=O)N(C)OC)C2)cc(OC)c1	ZINC000819146984	FD	On-Demand	Anodyne	DRD4	23	42
COc1cc(CN2CC[C@@H](NCCC(=O)N(C)OC)C2)cc(OC)c1	ZINC000819146984	FD	On-Demand	Anodyne	SSTR5	43	34
COc1cc(CN2CC[C@@H](NCCC(=O)N(C)OC)C2)cc(OC)c1	ZINC000819146984	FD	On-Demand	Anodyne	UTS2R	17	41
COc1cc(CN2CC[C@@H](NCCC(=O)N(C)OC)C2)cc(OC)c1	ZINC000819146984	FD	On-Demand	Anodyne	MCHR1	25	49
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cc(F)ccc3F)C2)cc(OC)c1	ZINC000819146999	GF	On-Demand	Anodyne	CCR3	39	42
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cc(F)ccc3F)C2)cc(OC)c1	ZINC000819146999	GF	On-Demand	Anodyne	MCHR1	21	48
COc1cc(CN2CC[C@@H](NC[C@H](O)c3cc(F)ccc3F)C2)cc(OC)c1	ZINC000819147000	GF	On-Demand	Anodyne	CCR3	39	42
COc1cc(CN2CC[C@@H](NC[C@H](O)c3cc(F)ccc3F)C2)cc(OC)c1	ZINC000819147000	GF	On-Demand	Anodyne	MCHR1	21	48
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cc(F)ccc3F)C2)cc(OC)c1	ZINC000819147001	GF	On-Demand	Anodyne	CCR3	39	42
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cc(F)ccc3F)C2)cc(OC)c1	ZINC000819147001	GF	On-Demand	Anodyne	MCHR1	21	48
COc1cc(CN2CC[C@H](NC[C@H](O)c3cc(F)ccc3F)C2)cc(OC)c1	ZINC000819147002	GF	On-Demand	Anodyne	CCR3	39	42
COc1cc(CN2CC[C@H](NC[C@H](O)c3cc(F)ccc3F)C2)cc(OC)c1	ZINC000819147002	GF	On-Demand	Anodyne	MCHR1	21	48
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(c3c(F)cccc3F)C2)cc1	ZINC000819147003	EF	On-Demand	Mild	ADRB3	16	46
N#Cc1ccc([C@H](O)CN[C@H]2CCN(c3c(F)cccc3F)C2)cc1	ZINC000819147004	EF	On-Demand	Mild	ADRB3	16	46
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(c3c(F)cccc3F)C2)cc1	ZINC000819147005	EF	On-Demand	Mild	ADRB3	16	46
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(c3c(F)cccc3F)C2)cc1	ZINC000819147006	EF	On-Demand	Mild	ADRB3	16	46
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccc(C#N)cc3)C2)cc(OC)c1	ZINC000819147025	GE	On-Demand	Mild	CCR3	18	48
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccc(C#N)cc3)C2)cc(OC)c1	ZINC000819147026	GE	On-Demand	Mild	CCR3	18	48
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccc(C#N)cc3)C2)cc(OC)c1	ZINC000819147027	GE	On-Demand	Mild	CCR3	18	48
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccc(C#N)cc3)C2)cc(OC)c1	ZINC000819147028	GE	On-Demand	Mild	CCR3	18	48
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819147081	GE	On-Demand	Anodyne	ADRB3	29	42
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819147081	GE	On-Demand	Anodyne	CACNA1B	47	34
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819147081	GE	On-Demand	Anodyne	CCR2	40	34
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819147081	GE	On-Demand	Anodyne	SFRP1	48	33
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819147082	GE	On-Demand	Anodyne	ADRB3	29	42
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819147082	GE	On-Demand	Anodyne	CACNA1B	47	34
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819147082	GE	On-Demand	Anodyne	CCR2	40	34
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819147082	GE	On-Demand	Anodyne	SFRP1	48	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCNC(=O)c1cccc(C)c1)C2	ZINC000819147085	FD	On-Demand	Anodyne	DRD4	43	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCNC(=O)c1cccc(C)c1)C2	ZINC000819147085	FD	On-Demand	Anodyne	CCR2	53	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCNC(=O)c1cccc(C)c1)C2	ZINC000819147085	FD	On-Demand	Anodyne	KCNK3	50	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCNC(=O)c1cccc(C)c1)C2	ZINC000819147085	FD	On-Demand	Anodyne	KCNK9	40	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCNC(=O)c1cccc(C)c1)C2	ZINC000819147086	FD	On-Demand	Anodyne	DRD4	43	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCNC(=O)c1cccc(C)c1)C2	ZINC000819147086	FD	On-Demand	Anodyne	CCR2	53	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCNC(=O)c1cccc(C)c1)C2	ZINC000819147086	FD	On-Demand	Anodyne	KCNK3	50	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCNC(=O)c1cccc(C)c1)C2	ZINC000819147086	FD	On-Demand	Anodyne	KCNK9	40	34
COc1ccc(OC)c([C@H](O)CNCCc2csc(-c3ccccc3)n2)c1	ZINC000819147088	GH	On-Demand	Anodyne	ADRB2	43	46
COc1ccc(OC)c([C@H](O)CNCCc2csc(-c3ccccc3)n2)c1	ZINC000819147088	GH	On-Demand	Anodyne	ADRB1	53	41
COc1ccc(OC)c([C@H](O)CNCCc2csc(-c3ccccc3)n2)c1	ZINC000819147088	GH	On-Demand	Anodyne	ADRB3	65	43
O=[N+]([O-])c1cccc([C@@H](O)CNC2CCN(S(=O)(=O)C3CC3)CC2)c1	ZINC000819147114	FD	On-Demand	Bother	ADRB3	29	40
O=[N+]([O-])c1cccc([C@H](O)CNC2CCN(S(=O)(=O)C3CC3)CC2)c1	ZINC000819147115	FD	On-Demand	Bother	ADRB3	29	40
OCc1cccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819147175	EF	On-Demand	Anodyne	ADRB2	54	41
OCc1cccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819147175	EF	On-Demand	Anodyne	GRIN2B	18	46
OCc1cccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819147175	EF	On-Demand	Anodyne	ADRB3	31	41
OCc1cccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819147176	EF	On-Demand	Anodyne	ADRB2	54	41
OCc1cccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819147176	EF	On-Demand	Anodyne	GRIN2B	18	46
OCc1cccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819147176	EF	On-Demand	Anodyne	ADRB3	31	41
CCOC(=O)Cn1cnc(NCc2cc(Cl)ccc2OC)n1	ZINC000819147190	DE	On-Demand	Anodyne	CPT1A	62	35
CCOC(=O)Cn1cnc(NCc2cc(Cl)ccc2OC)n1	ZINC000819147190	DE	On-Demand	Anodyne	CPT1B	64	33
CCOC(=O)Cn1cnc(NCc2ccc(OCc3ccccc3F)cc2)n1	ZINC000819147201	GG	On-Demand	Anodyne	MT-CYB	45	30
O[C@@H](CNCCC1CCC1)COc1cccc2ccccc12	ZINC000819147211	CG	On-Demand	Anodyne	ADRB2	56	60
O[C@@H](CNCCC1CCC1)COc1cccc2ccccc12	ZINC000819147211	CG	On-Demand	Anodyne	ADRB1	85	58
O[C@@H](CNCCC1CCC1)COc1cccc2ccccc12	ZINC000819147211	CG	On-Demand	Anodyne	ADRB3	41	58
O[C@@H](CNCCC1CCC1)COc1cccc2ccccc12	ZINC000819147211	CG	On-Demand	Anodyne	CASR	40	38
O[C@@H](CNCCC1CCC1)COc1cccc2ccccc12	ZINC000819147211	CG	On-Demand	Anodyne	CYP2D6	23	50
O[C@@H](CNCCC1CCC1)COc1cccc2ccccc12	ZINC000819147211	CG	On-Demand	Anodyne	ABCB1	29	44
O[C@H](CNCCC1CCC1)COc1cccc2ccccc12	ZINC000819147212	CG	On-Demand	Anodyne	ADRB2	56	60
O[C@H](CNCCC1CCC1)COc1cccc2ccccc12	ZINC000819147212	CG	On-Demand	Anodyne	ADRB1	85	58
O[C@H](CNCCC1CCC1)COc1cccc2ccccc12	ZINC000819147212	CG	On-Demand	Anodyne	ADRB3	41	58
O[C@H](CNCCC1CCC1)COc1cccc2ccccc12	ZINC000819147212	CG	On-Demand	Anodyne	CASR	40	38
O[C@H](CNCCC1CCC1)COc1cccc2ccccc12	ZINC000819147212	CG	On-Demand	Anodyne	CYP2D6	23	50
O[C@H](CNCCC1CCC1)COc1cccc2ccccc12	ZINC000819147212	CG	On-Demand	Anodyne	ABCB1	29	44
N#Cc1ccc([C@@H](O)CNC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc1	ZINC000819147213	GD	On-Demand	Mild	ADRB3	20	49
N#Cc1ccc([C@H](O)CNC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc1	ZINC000819147214	GD	On-Demand	Mild	ADRB3	20	49
COc1ccccc1COC[C@@H](O)CNCCC1CCC1	ZINC000819147237	CE	On-Demand	Anodyne	ADRB1	30	43
COc1ccccc1COC[C@H](O)CNCCC1CCC1	ZINC000819147238	CE	On-Demand	Anodyne	ADRB1	30	43
COCCOc1cc(C)ccc1CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819147305	FF	On-Demand	Bother	CACNA1D	41	34
COCCOc1cc(C)ccc1CNC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819147306	FF	On-Demand	Bother	CACNA1D	41	34
O[C@@H](CNCCC1CCC1)c1ccc(Cl)c(F)c1	ZINC000819147319	CG	On-Demand	Anodyne	ADRB2	17	41
O[C@@H](CNCCC1CCC1)c1ccc(Cl)c(F)c1	ZINC000819147319	CG	On-Demand	Anodyne	ADRB1	19	41
O[C@H](CNCCC1CCC1)c1ccc(Cl)c(F)c1	ZINC000819147320	CG	On-Demand	Anodyne	ADRB2	17	41
O[C@H](CNCCC1CCC1)c1ccc(Cl)c(F)c1	ZINC000819147320	CG	On-Demand	Anodyne	ADRB1	19	41
O=C(CCNCCC1CCC1)Nc1cccc(Cl)c1	ZINC000819147327	CG	On-Demand	Anodyne	MCHR1	16	44
C[C@@H](Cc1ccsc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819147339	DF	On-Demand	Anodyne	PAPA1_CARPA	33	52
C[C@@H](Cc1ccsc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819147339	DF	On-Demand	Anodyne	FPR1	46	35
CCN(CC)Cc1csc(NC(=O)C[S@@](=O)c2cccc(OC)c2)n1	ZINC000819147356	GF	On-Demand	Anodyne	CSNK1D	19	40
CCN(CC)Cc1csc(NC(=O)C[S@](=O)c2cccc(OC)c2)n1	ZINC000819147357	GF	On-Demand	Anodyne	CSNK1D	19	40
O=S(=O)(N1CCC(NC[C@H](O)c2ccccc2Cl)CC1)C(F)(F)F	ZINC000819147363	GE	On-Demand	Anodyne	ADRB3	21	48
O=S(=O)(N1CCC(NC[C@H](O)c2ccccc2Cl)CC1)C(F)(F)F	ZINC000819147363	GE	On-Demand	Anodyne	SFRP1	108	38
O=S(=O)(N1CCC(NC[C@H](O)c2ccccc2Cl)CC1)C(F)(F)F	ZINC000819147363	GE	On-Demand	Anodyne	WNT3	66	34
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3Cl)C2)cc(OC)c1	ZINC000819147366	GG	On-Demand	Anodyne	DRD4	37	44
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3Cl)C2)cc(OC)c1	ZINC000819147366	GG	On-Demand	Anodyne	SIGMAR1	30	54
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3Cl)C2)cc(OC)c1	ZINC000819147366	GG	On-Demand	Anodyne	SSTR5	48	39
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3Cl)C2)cc(OC)c1	ZINC000819147366	GG	On-Demand	Anodyne	CCR3	41	39
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccccc3Cl)C2)cc(OC)c1	ZINC000819147366	GG	On-Demand	Anodyne	MCHR1	25	48
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3Cl)C2)cc(OC)c1	ZINC000819147367	GG	On-Demand	Anodyne	DRD4	37	44
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3Cl)C2)cc(OC)c1	ZINC000819147367	GG	On-Demand	Anodyne	SIGMAR1	30	54
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3Cl)C2)cc(OC)c1	ZINC000819147367	GG	On-Demand	Anodyne	SSTR5	48	39
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3Cl)C2)cc(OC)c1	ZINC000819147367	GG	On-Demand	Anodyne	CCR3	41	39
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccccc3Cl)C2)cc(OC)c1	ZINC000819147367	GG	On-Demand	Anodyne	MCHR1	25	48
N#CCc1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819147370	CE	On-Demand	Mild	ADRB2	53	48
N#CCc1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819147370	CE	On-Demand	Mild	ADRB1	88	51
N#CCc1ccc(OC[C@@H](O)CNCCC2CCC2)cc1	ZINC000819147370	CE	On-Demand	Mild	ADRB3	56	48
N#CCc1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819147375	CE	On-Demand	Mild	ADRB2	53	48
N#CCc1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819147375	CE	On-Demand	Mild	ADRB1	88	51
N#CCc1ccc(OC[C@H](O)CNCCC2CCC2)cc1	ZINC000819147375	CE	On-Demand	Mild	ADRB3	56	48
COCCc1nsc(NCc2ccc3c(c2)OC(F)(F)O3)n1	ZINC000819147386	EF	On-Demand	Anodyne	KIT	23	43
COCCc1nsc(NCc2ccc3c(c2)OC(F)(F)O3)n1	ZINC000819147386	EF	On-Demand	Anodyne	BRAF	19	43
COc1ccc(OC)c([C@H](O)CNCc2ccc(C)cc2OCC(F)(F)F)c1	ZINC000819147398	GH	On-Demand	Anodyne	CCR2	22	40
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccc(Cl)cc3)C2)cc(OC)c1	ZINC000819147413	GG	On-Demand	Anodyne	ADRB3	24	45
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccc(Cl)cc3)C2)cc(OC)c1	ZINC000819147413	GG	On-Demand	Anodyne	MCHR1	27	44
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccc(Cl)cc3)C2)cc(OC)c1	ZINC000819147414	GG	On-Demand	Anodyne	ADRB3	24	45
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccc(Cl)cc3)C2)cc(OC)c1	ZINC000819147414	GG	On-Demand	Anodyne	MCHR1	27	44
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2c(Cl)cccc2Cl)CC1	ZINC000819147439	GG	On-Demand	Anodyne	L3MBTL3	75	38
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2c(Cl)cccc2Cl)CC1	ZINC000819147440	GG	On-Demand	Anodyne	L3MBTL3	75	38
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2c(Cl)cccc2Cl)CC1	ZINC000819147441	GG	On-Demand	Anodyne	L3MBTL3	75	38
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2c(Cl)cccc2Cl)CC1	ZINC000819147442	GG	On-Demand	Anodyne	L3MBTL3	75	38
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819147449	FE	On-Demand	Anodyne	ADRB3	19	41
CN(C[C@@H](O)CNCCc1csc(-c2ccccc2)n1)C(=O)OC(C)(C)C	ZINC000819147462	GG	On-Demand	Anodyne	ADRB3	32	41
CN(C[C@H](O)CNCCc1csc(-c2ccccc2)n1)C(=O)OC(C)(C)C	ZINC000819147463	GG	On-Demand	Anodyne	ADRB3	32	41
O[C@@H](CNCCc1csc(-c2ccccc2)n1)C1CC1	ZINC000819147464	CF	On-Demand	Anodyne	ADRB3	29	44
O[C@H](CNCCc1csc(-c2ccccc2)n1)C1CC1	ZINC000819147465	CF	On-Demand	Anodyne	ADRB3	29	44
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819147474	DD	On-Demand	Anodyne	ADRB1	25	40
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819147474	DD	On-Demand	Anodyne	ADRB3	48	44
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819147475	DD	On-Demand	Anodyne	ADRB1	25	40
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819147475	DD	On-Demand	Anodyne	ADRB3	48	44
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819147476	FD	On-Demand	Anodyne	ADRB2	20	41
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819147476	FD	On-Demand	Anodyne	ADRB1	45	48
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819147476	FD	On-Demand	Anodyne	ADRB3	68	55
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819147476	FD	On-Demand	Anodyne	IGF1R	29	41
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819147476	FD	On-Demand	Anodyne	CYP3A4	50	41
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819147477	FD	On-Demand	Anodyne	ADRB2	20	41
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819147477	FD	On-Demand	Anodyne	ADRB1	45	48
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819147477	FD	On-Demand	Anodyne	ADRB3	68	55
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819147477	FD	On-Demand	Anodyne	IGF1R	29	41
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819147477	FD	On-Demand	Anodyne	CYP3A4	50	41
O[C@@H](CN[C@@H]1CCN(c2c(F)cccc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819147492	GH	On-Demand	Anodyne	LIPG	47	34
O[C@H](CN[C@@H]1CCN(c2c(F)cccc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819147493	GH	On-Demand	Anodyne	LIPG	47	34
O[C@H](CN[C@H]1CCN(c2c(F)cccc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819147495	GH	On-Demand	Anodyne	LIPG	47	34
O[C@@H](CN[C@H]1CCN(c2c(F)cccc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819147497	GH	On-Demand	Anodyne	LIPG	47	34
OCc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819147503	CD	On-Demand	Anodyne	ADRB2	36	47
OCc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819147503	CD	On-Demand	Anodyne	ADRB1	41	46
OCc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819147503	CD	On-Demand	Anodyne	ADRB3	107	47
OCc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819147503	CD	On-Demand	Anodyne	KCNA5	16	41
OCc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819147504	CD	On-Demand	Anodyne	ADRB2	36	47
OCc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819147504	CD	On-Demand	Anodyne	ADRB1	41	46
OCc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819147504	CD	On-Demand	Anodyne	ADRB3	107	47
OCc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819147504	CD	On-Demand	Anodyne	KCNA5	16	41
CCCC[C@@H](CCC)CNC[C@@H](O)c1cccnc1	ZINC000819147506	CG	On-Demand	Anodyne	ADRB2	22	43
CCCC[C@@H](CCC)CNC[C@@H](O)c1cccnc1	ZINC000819147506	CG	On-Demand	Anodyne	ADRB1	24	43
CCCC[C@@H](CCC)CNC[C@@H](O)c1cccnc1	ZINC000819147506	CG	On-Demand	Anodyne	ADRB3	89	43
CCCC[C@H](CCC)CNC[C@@H](O)c1cccnc1	ZINC000819147507	CG	On-Demand	Anodyne	ADRB2	22	43
CCCC[C@H](CCC)CNC[C@@H](O)c1cccnc1	ZINC000819147507	CG	On-Demand	Anodyne	ADRB1	24	43
CCCC[C@H](CCC)CNC[C@@H](O)c1cccnc1	ZINC000819147507	CG	On-Demand	Anodyne	ADRB3	89	43
CCCC[C@H](CCC)CNC[C@H](O)c1cccnc1	ZINC000819147509	CG	On-Demand	Anodyne	ADRB2	22	43
CCCC[C@H](CCC)CNC[C@H](O)c1cccnc1	ZINC000819147509	CG	On-Demand	Anodyne	ADRB1	24	43
CCCC[C@H](CCC)CNC[C@H](O)c1cccnc1	ZINC000819147509	CG	On-Demand	Anodyne	ADRB3	89	43
CCCC[C@@H](CCC)CNC[C@H](O)c1cccnc1	ZINC000819147510	CG	On-Demand	Anodyne	ADRB2	22	43
CCCC[C@@H](CCC)CNC[C@H](O)c1cccnc1	ZINC000819147510	CG	On-Demand	Anodyne	ADRB1	24	43
CCCC[C@@H](CCC)CNC[C@H](O)c1cccnc1	ZINC000819147510	CG	On-Demand	Anodyne	ADRB3	89	43
COc1ccc(C(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c(OC)c1	ZINC000819147512	FD	On-Demand	Anodyne	OXTR	23	46
COc1ccc(C(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c(OC)c1	ZINC000819147514	FD	On-Demand	Anodyne	OXTR	23	46
COc1ccc(C(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c(OC)c1	ZINC000819147516	FD	On-Demand	Anodyne	OXTR	23	46
COc1ccc(C(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c(OC)c1	ZINC000819147517	FD	On-Demand	Anodyne	OXTR	23	46
O[C@@H](CN[C@@H]1CCN(c2c(F)cccc2F)C1)c1cccc(Cl)c1	ZINC000819147536	FH	On-Demand	Anodyne	ADRB1	34	44
O[C@@H](CN[C@@H]1CCN(c2c(F)cccc2F)C1)c1cccc(Cl)c1	ZINC000819147536	FH	On-Demand	Anodyne	ADRB3	55	48
O[C@@H](CN[C@@H]1CCN(c2c(F)cccc2F)C1)c1cccc(Cl)c1	ZINC000819147536	FH	On-Demand	Anodyne	IGF1R	27	40
O[C@@H](CN[C@@H]1CCN(c2c(F)cccc2F)C1)c1cccc(Cl)c1	ZINC000819147536	FH	On-Demand	Anodyne	CYP3A4	49	40
O[C@H](CN[C@@H]1CCN(c2c(F)cccc2F)C1)c1cccc(Cl)c1	ZINC000819147537	FH	On-Demand	Anodyne	ADRB1	34	44
O[C@H](CN[C@@H]1CCN(c2c(F)cccc2F)C1)c1cccc(Cl)c1	ZINC000819147537	FH	On-Demand	Anodyne	ADRB3	55	48
O[C@H](CN[C@@H]1CCN(c2c(F)cccc2F)C1)c1cccc(Cl)c1	ZINC000819147537	FH	On-Demand	Anodyne	IGF1R	27	40
O[C@H](CN[C@@H]1CCN(c2c(F)cccc2F)C1)c1cccc(Cl)c1	ZINC000819147537	FH	On-Demand	Anodyne	CYP3A4	49	40
O[C@H](CN[C@H]1CCN(c2c(F)cccc2F)C1)c1cccc(Cl)c1	ZINC000819147538	FH	On-Demand	Anodyne	ADRB1	34	44
O[C@H](CN[C@H]1CCN(c2c(F)cccc2F)C1)c1cccc(Cl)c1	ZINC000819147538	FH	On-Demand	Anodyne	ADRB3	55	48
O[C@H](CN[C@H]1CCN(c2c(F)cccc2F)C1)c1cccc(Cl)c1	ZINC000819147538	FH	On-Demand	Anodyne	IGF1R	27	40
O[C@H](CN[C@H]1CCN(c2c(F)cccc2F)C1)c1cccc(Cl)c1	ZINC000819147538	FH	On-Demand	Anodyne	CYP3A4	49	40
O[C@@H](CN[C@H]1CCN(c2c(F)cccc2F)C1)c1cccc(Cl)c1	ZINC000819147539	FH	On-Demand	Anodyne	ADRB1	34	44
O[C@@H](CN[C@H]1CCN(c2c(F)cccc2F)C1)c1cccc(Cl)c1	ZINC000819147539	FH	On-Demand	Anodyne	ADRB3	55	48
O[C@@H](CN[C@H]1CCN(c2c(F)cccc2F)C1)c1cccc(Cl)c1	ZINC000819147539	FH	On-Demand	Anodyne	IGF1R	27	40
O[C@@H](CN[C@H]1CCN(c2c(F)cccc2F)C1)c1cccc(Cl)c1	ZINC000819147539	FH	On-Demand	Anodyne	CYP3A4	49	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccccc1OCC(C)C)C2	ZINC000819147542	FG	On-Demand	Anodyne	P2RX7	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccccc1OCC(C)C)C2	ZINC000819147543	FG	On-Demand	Anodyne	P2RX7	15	40
O[C@@H](CN[C@@H]1CCN(c2c(F)cccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819147552	GH	On-Demand	Anodyne	ADRB3	15	47
O[C@H](CN[C@@H]1CCN(c2c(F)cccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819147553	GH	On-Demand	Anodyne	ADRB3	15	47
O[C@H](CN[C@H]1CCN(c2c(F)cccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819147554	GH	On-Demand	Anodyne	ADRB3	15	47
O[C@@H](CN[C@H]1CCN(c2c(F)cccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819147555	GH	On-Demand	Anodyne	ADRB3	15	47
O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819147562	FD	On-Demand	Anodyne	ADRB1	45	48
O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819147562	FD	On-Demand	Anodyne	ADRB3	63	48
O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819147565	FD	On-Demand	Anodyne	ADRB1	45	48
O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819147565	FD	On-Demand	Anodyne	ADRB3	63	48
O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819147568	FD	On-Demand	Anodyne	ADRB1	45	48
O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819147568	FD	On-Demand	Anodyne	ADRB3	63	48
O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819147570	FD	On-Demand	Anodyne	ADRB1	45	48
O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819147570	FD	On-Demand	Anodyne	ADRB3	63	48
COCCCOc1cc(C)ccc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819147573	FH	On-Demand	Anodyne	ADRB1	36	43
COCCCOc1cc(C)ccc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819147573	FH	On-Demand	Anodyne	ADRB3	46	44
COCCCOc1cc(C)ccc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819147575	FH	On-Demand	Anodyne	ADRB1	36	43
COCCCOc1cc(C)ccc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819147575	FH	On-Demand	Anodyne	ADRB3	46	44
CC(=O)Nc1cccc(CC(=O)N(C)c2ccc(C(C)(C)C)cc2)c1	ZINC000819147595	EI	On-Demand	Anodyne	KCNK3	34	40
COCCOc1cc(C)ccc1CNC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819147668	GH	On-Demand	Anodyne	CCR2	30	41
COCCOc1cc(C)ccc1CNC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819147670	GH	On-Demand	Anodyne	CCR2	30	41
O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@@H](O)c1cccnc1	ZINC000819147687	EC	On-Demand	Anodyne	ADRB2	26	44
O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@@H](O)c1cccnc1	ZINC000819147687	EC	On-Demand	Anodyne	ADRB1	29	42
O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@@H](O)c1cccnc1	ZINC000819147687	EC	On-Demand	Anodyne	ADRB3	105	48
O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@@H](O)c1cccnc1	ZINC000819147690	EC	On-Demand	Anodyne	ADRB2	26	44
O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@@H](O)c1cccnc1	ZINC000819147690	EC	On-Demand	Anodyne	ADRB1	29	42
O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@@H](O)c1cccnc1	ZINC000819147690	EC	On-Demand	Anodyne	ADRB3	105	48
O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@H](O)c1cccnc1	ZINC000819147692	EC	On-Demand	Anodyne	ADRB2	26	44
O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@H](O)c1cccnc1	ZINC000819147692	EC	On-Demand	Anodyne	ADRB1	29	42
O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@H](O)c1cccnc1	ZINC000819147692	EC	On-Demand	Anodyne	ADRB3	105	48
O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@H](O)c1cccnc1	ZINC000819147694	EC	On-Demand	Anodyne	ADRB2	26	44
O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@H](O)c1cccnc1	ZINC000819147694	EC	On-Demand	Anodyne	ADRB1	29	42
O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@H](O)c1cccnc1	ZINC000819147694	EC	On-Demand	Anodyne	ADRB3	105	48
COCCOc1cc(C)ccc1CNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819147697	GH	On-Demand	Anodyne	CCR2	43	49
COCCOc1cc(C)ccc1CNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819147699	GH	On-Demand	Anodyne	CCR2	43	49
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(C(C)(C)C)cc1	ZINC000819147705	GJ	On-Demand	Mild	PAPA1_CARPA	53	43
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(C(C)(C)C)cc1	ZINC000819147705	GJ	On-Demand	Mild	CTSK	19	45
OCc1cccc(CNC[C@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819147711	FF	On-Demand	Anodyne	ADRB2	41	39
OCc1cccc(CNC[C@@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819147713	FF	On-Demand	Anodyne	ADRB2	41	39
OCc1cccc(CNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819147722	EG	On-Demand	Anodyne	ADRB2	27	40
OCc1cccc(CNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819147722	EG	On-Demand	Anodyne	ADRB1	32	40
OCc1cccc(CNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819147724	EG	On-Demand	Anodyne	ADRB2	27	40
OCc1cccc(CNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819147724	EG	On-Demand	Anodyne	ADRB1	32	40
COCCOc1cc(C)ccc1CNC[C@@H](O)c1ccccc1	ZINC000819147772	DF	On-Demand	Anodyne	ADRB1	22	41
COCCOc1cc(C)ccc1CNC[C@@H](O)c1ccccc1	ZINC000819147772	DF	On-Demand	Anodyne	ADRB3	44	38
COCCOc1cc(C)ccc1CNC[C@H](O)c1ccccc1	ZINC000819147773	DF	On-Demand	Anodyne	ADRB1	22	41
COCCOc1cc(C)ccc1CNC[C@H](O)c1ccccc1	ZINC000819147773	DF	On-Demand	Anodyne	ADRB3	44	38
O=C(Nc1ccc(CCN2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819147776	DF	On-Demand	Anodyne	EPHX2	27	44
O=C(Nc1ccc(CCN2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819147776	DF	On-Demand	Anodyne	L3MBTL3	19	40
O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@@H](O)c1ccccc1	ZINC000819147784	ED	On-Demand	Anodyne	ADRB2	17	43
O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@@H](O)c1ccccc1	ZINC000819147784	ED	On-Demand	Anodyne	ADRB3	49	40
O=C1[C@@H]2[C@@H](C(=O)N1CCNC[C@@H](O)c1ccccc1)[C@H]1C=C[C@H]2C1	ZINC000819147786	ED	On-Demand	Anodyne	ADRB2	17	43
O=C1[C@@H]2[C@@H](C(=O)N1CCNC[C@@H](O)c1ccccc1)[C@H]1C=C[C@H]2C1	ZINC000819147786	ED	On-Demand	Anodyne	ADRB3	49	40
O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@H](O)c1ccccc1	ZINC000819147788	ED	On-Demand	Anodyne	ADRB2	17	43
O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@H](O)c1ccccc1	ZINC000819147788	ED	On-Demand	Anodyne	ADRB3	49	40
O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@H](O)c1ccccc1	ZINC000819147791	ED	On-Demand	Anodyne	ADRB2	17	43
O=C1[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@H](O)c1ccccc1	ZINC000819147791	ED	On-Demand	Anodyne	ADRB3	49	40
O=C1[C@@H]2[C@@H](C(=O)N1CCNC[C@H](O)c1ccccc1)[C@H]1C=C[C@H]2C1	ZINC000819147793	ED	On-Demand	Anodyne	ADRB2	17	43
O=C1[C@@H]2[C@@H](C(=O)N1CCNC[C@H](O)c1ccccc1)[C@H]1C=C[C@H]2C1	ZINC000819147793	ED	On-Demand	Anodyne	ADRB3	49	40
O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@@H](O)c1ccccc1	ZINC000819147795	ED	On-Demand	Anodyne	ADRB2	17	43
O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1CCNC[C@@H](O)c1ccccc1	ZINC000819147795	ED	On-Demand	Anodyne	ADRB3	49	40
C[C@@H]1CCCC[C@@H]1C(=O)N(C)Cc1cccc(C(N)=O)c1	ZINC000819147809	CF	On-Demand	Anodyne	HSD17B2	19	40
C[C@@H]1CCCC[C@H]1C(=O)N(C)Cc1cccc(C(N)=O)c1	ZINC000819147810	CF	On-Demand	Anodyne	HSD17B2	19	40
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000819147817	GF	On-Demand	Anodyne	CMA1	27	42
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000819147817	GF	On-Demand	Anodyne	BIRC2	27	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000819147818	GF	On-Demand	Anodyne	CMA1	27	42
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000819147818	GF	On-Demand	Anodyne	BIRC2	27	43
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)c(F)c3)C2)cc(OC)c1	ZINC000819147833	GF	On-Demand	Anodyne	MCHR1	15	43
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)c(F)c3)C2)cc(OC)c1	ZINC000819147834	GF	On-Demand	Anodyne	MCHR1	15	43
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)c(F)c3)C2)cc(OC)c1	ZINC000819147835	GF	On-Demand	Anodyne	MCHR1	15	43
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccc(F)c(F)c3)C2)cc(OC)c1	ZINC000819147836	GF	On-Demand	Anodyne	MCHR1	15	43
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccc(F)cn3)C2)cc(OC)c1	ZINC000819147858	GE	On-Demand	Anodyne	SSTR5	61	37
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccc(F)cn3)C2)cc(OC)c1	ZINC000819147858	GE	On-Demand	Anodyne	MCHR1	16	44
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cn3)C2)cc(OC)c1	ZINC000819147859	GE	On-Demand	Anodyne	SSTR5	61	37
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cn3)C2)cc(OC)c1	ZINC000819147859	GE	On-Demand	Anodyne	MCHR1	16	44
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cn3)C2)cc(OC)c1	ZINC000819147860	GE	On-Demand	Anodyne	SSTR5	61	37
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cn3)C2)cc(OC)c1	ZINC000819147860	GE	On-Demand	Anodyne	MCHR1	16	44
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cn3)C2)cc(OC)c1	ZINC000819147861	GE	On-Demand	Anodyne	SSTR5	61	37
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cn3)C2)cc(OC)c1	ZINC000819147861	GE	On-Demand	Anodyne	MCHR1	16	44
C[C@@H](Cc1ccsc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819147866	FG	On-Demand	Mild	KLK3	57	32
C[C@@H](Cc1ccsc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819147866	FG	On-Demand	Mild	PAPA1_CARPA	68	65
C[C@@H](Cc1ccsc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819147866	FG	On-Demand	Mild	CTSK	21	44
C[C@@H](Cc1ccsc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819147866	FG	On-Demand	Mild	CTSL	22	48
C[C@@H](Cc1ccsc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819147866	FG	On-Demand	Mild	CAPNS1	46	30
C[C@@H](Cc1ccsc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819147866	FG	On-Demand	Mild	CAPN1	25	41
C[C@@H](Cc1ccsc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819147866	FG	On-Demand	Mild	FPR1	52	44
C[C@@H](Cc1ccsc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819147869	FG	On-Demand	Mild	KLK3	57	32
C[C@@H](Cc1ccsc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819147869	FG	On-Demand	Mild	PAPA1_CARPA	68	65
C[C@@H](Cc1ccsc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819147869	FG	On-Demand	Mild	CTSK	21	44
C[C@@H](Cc1ccsc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819147869	FG	On-Demand	Mild	CTSL	22	48
C[C@@H](Cc1ccsc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819147869	FG	On-Demand	Mild	CAPNS1	46	30
C[C@@H](Cc1ccsc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819147869	FG	On-Demand	Mild	CAPN1	25	41
C[C@@H](Cc1ccsc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819147869	FG	On-Demand	Mild	FPR1	52	44
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147889	FF	On-Demand	Anodyne	SLC6A3	33	44
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147889	FF	On-Demand	Anodyne	SIGMAR1	18	45
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147889	FF	On-Demand	Anodyne	SSTR5	41	36
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147889	FF	On-Demand	Anodyne	CCR3	43	43
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147889	FF	On-Demand	Anodyne	MCHR1	21	47
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147890	FF	On-Demand	Anodyne	SLC6A3	33	44
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147890	FF	On-Demand	Anodyne	SIGMAR1	18	45
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147890	FF	On-Demand	Anodyne	SSTR5	41	36
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147890	FF	On-Demand	Anodyne	CCR3	43	43
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147890	FF	On-Demand	Anodyne	MCHR1	21	47
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147891	FF	On-Demand	Anodyne	SLC6A3	33	44
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147891	FF	On-Demand	Anodyne	SIGMAR1	18	45
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147891	FF	On-Demand	Anodyne	SSTR5	41	36
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147891	FF	On-Demand	Anodyne	CCR3	43	43
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147891	FF	On-Demand	Anodyne	MCHR1	21	47
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147892	FF	On-Demand	Anodyne	SLC6A3	33	44
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147892	FF	On-Demand	Anodyne	SIGMAR1	18	45
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147892	FF	On-Demand	Anodyne	SSTR5	41	36
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147892	FF	On-Demand	Anodyne	CCR3	43	43
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cc3)C2)cc(OC)c1	ZINC000819147892	FF	On-Demand	Anodyne	MCHR1	21	47
COC(=O)C1(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCCC1	ZINC000819147894	FE	On-Demand	Mild	PAPA1_CARPA	40	50
COC(=O)C1(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCCC1	ZINC000819147895	FE	On-Demand	Mild	PAPA1_CARPA	40	50
COCCOc1cc(C)ccc1CNC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819147909	GH	On-Demand	Anodyne	CCR2	35	41
COCCOc1cc(C)ccc1CNC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819147910	GH	On-Demand	Anodyne	CCR2	35	41
O=[N+]([O-])c1ccc([C@@H](O)CNC2CCN(S(=O)(=O)C3CC3)CC2)cc1	ZINC000819147944	FD	On-Demand	Bother	ADRB3	18	40
O=[N+]([O-])c1ccc([C@H](O)CNC2CCN(S(=O)(=O)C3CC3)CC2)cc1	ZINC000819147945	FD	On-Demand	Bother	ADRB3	18	40
CN(C(=O)c1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1)C1CCCCC1	ZINC000819147954	FH	On-Demand	Anodyne	ITK	19	40
CN(C(=O)c1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1)C1CCCCC1	ZINC000819147955	FH	On-Demand	Anodyne	ITK	19	40
CN(C(=O)c1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1)C1CCCCC1	ZINC000819147956	FH	On-Demand	Anodyne	ITK	19	40
CN(C(=O)c1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1)C1CCCCC1	ZINC000819147957	FH	On-Demand	Anodyne	ITK	19	40
CC(C)(C)CCN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819147962	GG	On-Demand	Mild	PAPA1_CARPA	33	41
CC(C)(C)CCN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819147963	GG	On-Demand	Mild	PAPA1_CARPA	33	41
O=C(Nc1cc(N2CCCS2(=O)=O)ccc1F)C(F)=C1CCC1	ZINC000819147966	EF	On-Demand	Anodyne	CDK1	17	42
Cc1cc(F)ccc1CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819147967	GG	On-Demand	Anodyne	GPR119	45	54
Cc1cc(F)ccc1CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819147968	GG	On-Demand	Anodyne	GPR119	45	54
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819147975	FD	On-Demand	Anodyne	ADRB3	30	45
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819147976	FD	On-Demand	Anodyne	ADRB3	30	45
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819147977	GE	On-Demand	Anodyne	ADRB3	31	45
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819147978	GE	On-Demand	Anodyne	ADRB3	31	45
O=C(NCc1ccccc1N1CCCC1)C(F)=C1CCC1	ZINC000819147979	CG	On-Demand	Anodyne	KCNQ2	79	44
O=C(NCc1ccccc1N1CCCC1)C(F)=C1CCC1	ZINC000819147979	CG	On-Demand	Anodyne	SCN2A	18	44
O=C(NCc1ccccc1N1CCCC1)C(F)=C1CCC1	ZINC000819147979	CG	On-Demand	Anodyne	SCN10A	15	44
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(CCN2CCOCC2)cc1	ZINC000819147980	EE	On-Demand	Anodyne	EPHX2	23	41
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(CCN2CCOCC2)cc1	ZINC000819147980	EE	On-Demand	Anodyne	L3MBTL3	22	42
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(CCN2CCOCC2)cc1	ZINC000819147981	EE	On-Demand	Anodyne	EPHX2	23	41
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(CCN2CCOCC2)cc1	ZINC000819147981	EE	On-Demand	Anodyne	L3MBTL3	22	42
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(CCN2CCOCC2)cc1	ZINC000819147982	EE	On-Demand	Anodyne	EPHX2	23	41
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(CCN2CCOCC2)cc1	ZINC000819147982	EE	On-Demand	Anodyne	L3MBTL3	22	42
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(CCN2CCOCC2)cc1	ZINC000819147983	EE	On-Demand	Anodyne	EPHX2	23	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(CCN2CCOCC2)cc1	ZINC000819147983	EE	On-Demand	Anodyne	L3MBTL3	22	42
CCOC(=O)c1cc(NC(=O)/C=C\[C@@H]2CCCO2)ccc1Cl	ZINC000819147990	DG	On-Demand	Anodyne	Q9FYV8_MAIZE	28	41
CCOC(=O)c1cc(NC(=O)/C=C/[C@H]2CCCO2)ccc1Cl	ZINC000819147991	DG	On-Demand	Anodyne	Q9FYV8_MAIZE	28	41
CCOC(=O)c1cc(NC(=O)/C=C/[C@@H]2CCCO2)ccc1Cl	ZINC000819147992	DG	On-Demand	Anodyne	Q9FYV8_MAIZE	28	41
CCOC(=O)c1cc(NC(=O)/C=C\[C@H]2CCCO2)ccc1Cl	ZINC000819147993	DG	On-Demand	Anodyne	Q9FYV8_MAIZE	28	41
Cc1ccccc1[C@@H](O)CNC1CCN(S(=O)(=O)C2CC2)CC1	ZINC000819148003	ED	On-Demand	Anodyne	CCR8	55	33
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3c(F)cccc3F)C2)cc1	ZINC000819148072	GE	On-Demand	Anodyne	ADRB3	28	43
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3c(F)cccc3F)C2)cc1	ZINC000819148072	GE	On-Demand	Anodyne	CCR5	18	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3c(F)cccc3F)C2)cc1	ZINC000819148073	GE	On-Demand	Anodyne	ADRB3	28	43
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3c(F)cccc3F)C2)cc1	ZINC000819148073	GE	On-Demand	Anodyne	CCR5	18	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3c(F)cccc3F)C2)cc1	ZINC000819148074	GE	On-Demand	Anodyne	ADRB3	28	43
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3c(F)cccc3F)C2)cc1	ZINC000819148074	GE	On-Demand	Anodyne	CCR5	18	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3c(F)cccc3F)C2)cc1	ZINC000819148075	GE	On-Demand	Anodyne	ADRB3	28	43
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3c(F)cccc3F)C2)cc1	ZINC000819148075	GE	On-Demand	Anodyne	CCR5	18	40
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccc(F)cc3C)C2)cc(OC)c1	ZINC000819148084	GG	On-Demand	Anodyne	CCR3	39	42
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccc(F)cc3C)C2)cc(OC)c1	ZINC000819148084	GG	On-Demand	Anodyne	MCHR1	19	48
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cc3C)C2)cc(OC)c1	ZINC000819148085	GG	On-Demand	Anodyne	CCR3	39	42
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cc3C)C2)cc(OC)c1	ZINC000819148085	GG	On-Demand	Anodyne	MCHR1	19	48
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cc3C)C2)cc(OC)c1	ZINC000819148086	GG	On-Demand	Anodyne	CCR3	39	42
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cc3C)C2)cc(OC)c1	ZINC000819148086	GG	On-Demand	Anodyne	MCHR1	19	48
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cc3C)C2)cc(OC)c1	ZINC000819148087	GG	On-Demand	Anodyne	CCR3	39	42
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cc3C)C2)cc(OC)c1	ZINC000819148087	GG	On-Demand	Anodyne	MCHR1	19	48
COCCOc1cc(C)ccc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819148088	EG	On-Demand	Anodyne	ADRB2	26	41
COCCOc1cc(C)ccc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819148088	EG	On-Demand	Anodyne	ADRB1	39	45
COCCOc1cc(C)ccc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819148088	EG	On-Demand	Anodyne	ADRB3	51	45
COCCOc1cc(C)ccc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819148089	EG	On-Demand	Anodyne	ADRB2	26	41
COCCOc1cc(C)ccc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819148089	EG	On-Demand	Anodyne	ADRB1	39	45
COCCOc1cc(C)ccc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819148089	EG	On-Demand	Anodyne	ADRB3	51	45
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148113	GG	On-Demand	Anodyne	ADRB1	34	53
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148113	GG	On-Demand	Anodyne	DRD4	33	40
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148113	GG	On-Demand	Anodyne	ADRB3	54	53
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148113	GG	On-Demand	Anodyne	SIGMAR1	19	50
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148113	GG	On-Demand	Anodyne	CYP3A4	46	37
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148113	GG	On-Demand	Anodyne	MCHR1	30	44
COc1cc(CN2CC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148116	GG	On-Demand	Anodyne	ADRB1	34	53
COc1cc(CN2CC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148116	GG	On-Demand	Anodyne	DRD4	33	40
COc1cc(CN2CC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148116	GG	On-Demand	Anodyne	ADRB3	54	53
COc1cc(CN2CC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148116	GG	On-Demand	Anodyne	SIGMAR1	19	50
COc1cc(CN2CC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148116	GG	On-Demand	Anodyne	CYP3A4	46	37
COc1cc(CN2CC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148116	GG	On-Demand	Anodyne	MCHR1	30	44
COc1cc(CN2CC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148119	GG	On-Demand	Anodyne	ADRB1	34	53
COc1cc(CN2CC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148119	GG	On-Demand	Anodyne	DRD4	33	40
COc1cc(CN2CC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148119	GG	On-Demand	Anodyne	ADRB3	54	53
COc1cc(CN2CC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148119	GG	On-Demand	Anodyne	SIGMAR1	19	50
COc1cc(CN2CC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148119	GG	On-Demand	Anodyne	CYP3A4	46	37
COc1cc(CN2CC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148119	GG	On-Demand	Anodyne	MCHR1	30	44
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148121	GG	On-Demand	Anodyne	ADRB1	34	53
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148121	GG	On-Demand	Anodyne	DRD4	33	40
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148121	GG	On-Demand	Anodyne	ADRB3	54	53
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148121	GG	On-Demand	Anodyne	SIGMAR1	19	50
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148121	GG	On-Demand	Anodyne	CYP3A4	46	37
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2)cc(OC)c1	ZINC000819148121	GG	On-Demand	Anodyne	MCHR1	30	44
OCc1cccc(CNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819148129	EF	On-Demand	Anodyne	ADRB2	44	40
OCc1cccc(CNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819148130	EF	On-Demand	Anodyne	ADRB2	44	40
COc1ccc(OC)c([C@H](O)CNC2CCN(S(=O)(=O)C3CC3)CC2)c1	ZINC000819148132	GD	On-Demand	Anodyne	ADRB3	25	46
N#Cc1ccc([C@@H](O)CNC2CCN(S(=O)(=O)C3CC3)CC2)cc1	ZINC000819148139	ED	On-Demand	Mild	ADRB3	20	48
N#Cc1ccc([C@H](O)CNC2CCN(S(=O)(=O)C3CC3)CC2)cc1	ZINC000819148141	ED	On-Demand	Mild	ADRB3	20	48
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2cccc(F)c2)CC1	ZINC000819148178	ED	On-Demand	Anodyne	ADRB3	35	42
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819148180	ED	On-Demand	Anodyne	ADRB3	35	42
CN(C)c1ccc(NC(=O)CCNC2CCN(S(=O)(=O)C3CC3)CC2)cc1	ZINC000819148187	GD	On-Demand	Anodyne	EPHX2	16	46
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148198	FD	On-Demand	Anodyne	ADRB1	25	42
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148198	FD	On-Demand	Anodyne	DRD4	18	40
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148198	FD	On-Demand	Anodyne	ADRB3	69	45
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148198	FD	On-Demand	Anodyne	SSTR5	50	38
COc1cc(CN2CC[C@H](NC[C@@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148198	FD	On-Demand	Anodyne	MCHR1	17	44
COc1cc(CN2CC[C@H](NC[C@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148201	FD	On-Demand	Anodyne	ADRB1	25	42
COc1cc(CN2CC[C@H](NC[C@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148201	FD	On-Demand	Anodyne	DRD4	18	40
COc1cc(CN2CC[C@H](NC[C@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148201	FD	On-Demand	Anodyne	ADRB3	69	45
COc1cc(CN2CC[C@H](NC[C@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148201	FD	On-Demand	Anodyne	SSTR5	50	38
COc1cc(CN2CC[C@H](NC[C@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148201	FD	On-Demand	Anodyne	MCHR1	17	44
COc1cc(CN2CC[C@@H](NC[C@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148206	FD	On-Demand	Anodyne	ADRB1	25	42
COc1cc(CN2CC[C@@H](NC[C@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148206	FD	On-Demand	Anodyne	DRD4	18	40
COc1cc(CN2CC[C@@H](NC[C@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148206	FD	On-Demand	Anodyne	ADRB3	69	45
COc1cc(CN2CC[C@@H](NC[C@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148206	FD	On-Demand	Anodyne	SSTR5	50	38
COc1cc(CN2CC[C@@H](NC[C@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148206	FD	On-Demand	Anodyne	MCHR1	17	44
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148209	FD	On-Demand	Anodyne	ADRB1	25	42
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148209	FD	On-Demand	Anodyne	DRD4	18	40
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148209	FD	On-Demand	Anodyne	ADRB3	69	45
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148209	FD	On-Demand	Anodyne	SSTR5	50	38
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3cccnc3)C2)cc(OC)c1	ZINC000819148209	FD	On-Demand	Anodyne	MCHR1	17	44
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cc3F)C2)cc(OC)c1	ZINC000819148212	GF	On-Demand	Anodyne	CCR3	40	42
COc1cc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cc3F)C2)cc(OC)c1	ZINC000819148212	GF	On-Demand	Anodyne	MCHR1	19	48
Cc1cc(F)ccc1CCNC[C@H](O)c1cccnc1	ZINC000819148214	CE	On-Demand	Anodyne	ADRB2	41	49
Cc1cc(F)ccc1CCNC[C@H](O)c1cccnc1	ZINC000819148214	CE	On-Demand	Anodyne	ADRB1	47	49
Cc1cc(F)ccc1CCNC[C@H](O)c1cccnc1	ZINC000819148214	CE	On-Demand	Anodyne	ADRB3	135	52
Cc1cc(F)ccc1CCNC[C@@H](O)c1cccnc1	ZINC000819148215	CE	On-Demand	Anodyne	ADRB2	41	49
Cc1cc(F)ccc1CCNC[C@@H](O)c1cccnc1	ZINC000819148215	CE	On-Demand	Anodyne	ADRB1	47	49
Cc1cc(F)ccc1CCNC[C@@H](O)c1cccnc1	ZINC000819148215	CE	On-Demand	Anodyne	ADRB3	135	52
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cc3F)C2)cc(OC)c1	ZINC000819148218	GF	On-Demand	Anodyne	CCR3	40	42
COc1cc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cc3F)C2)cc(OC)c1	ZINC000819148218	GF	On-Demand	Anodyne	MCHR1	19	48
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cc3F)C2)cc(OC)c1	ZINC000819148223	GF	On-Demand	Anodyne	CCR3	40	42
COc1cc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cc3F)C2)cc(OC)c1	ZINC000819148223	GF	On-Demand	Anodyne	MCHR1	19	48
Cc1ccc(C(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)s1	ZINC000819148225	EE	On-Demand	Anodyne	L3MBTL3	33	41
Cc1ccc(C(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)s1	ZINC000819148226	EE	On-Demand	Anodyne	L3MBTL3	33	41
Cc1ccc(C(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)s1	ZINC000819148227	EE	On-Demand	Anodyne	L3MBTL3	33	41
Cc1ccc(C(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)s1	ZINC000819148228	EE	On-Demand	Anodyne	L3MBTL3	33	41
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccc(F)cc3F)C2)cc(OC)c1	ZINC000819148229	GF	On-Demand	Anodyne	CCR3	40	42
COc1cc(CN2CC[C@H](NC[C@H](O)c3ccc(F)cc3F)C2)cc(OC)c1	ZINC000819148229	GF	On-Demand	Anodyne	MCHR1	19	48
COCCCOc1cc(C)ccc1CNC[C@@H](O)c1cccnc1	ZINC000819148249	EF	On-Demand	Anodyne	ADRB2	18	44
COCCCOc1cc(C)ccc1CNC[C@@H](O)c1cccnc1	ZINC000819148249	EF	On-Demand	Anodyne	ADRB1	23	44
COCCCOc1cc(C)ccc1CNC[C@@H](O)c1cccnc1	ZINC000819148249	EF	On-Demand	Anodyne	ADRB3	71	45
COCCCOc1cc(C)ccc1CNC[C@H](O)c1cccnc1	ZINC000819148250	EF	On-Demand	Anodyne	ADRB2	18	44
COCCCOc1cc(C)ccc1CNC[C@H](O)c1cccnc1	ZINC000819148250	EF	On-Demand	Anodyne	ADRB1	23	44
COCCCOc1cc(C)ccc1CNC[C@H](O)c1cccnc1	ZINC000819148250	EF	On-Demand	Anodyne	ADRB3	71	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccccc1N1CCCC1	ZINC000819148269	FF	On-Demand	Anodyne	KCNQ2	71	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccccc1N1CCCC1	ZINC000819148269	FF	On-Demand	Anodyne	FPR1	40	35
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2ccc(Cl)cc2Cl)CC1	ZINC000819148274	GF	On-Demand	Anodyne	ADRB3	24	42
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2ccc(Cl)cc2Cl)CC1	ZINC000819148275	GF	On-Demand	Anodyne	ADRB3	24	42
O=[N+]([O-])c1cccc([C@@H](O)CNCc2cccc(CO)c2)c1	ZINC000819148280	DD	On-Demand	Bother	CACNA1D	44	32
O=[N+]([O-])c1cccc([C@H](O)CNCc2cccc(CO)c2)c1	ZINC000819148281	DD	On-Demand	Bother	CACNA1D	44	32
CCCCCC(C)(C)CNC[C@H](O)c1cccnc1	ZINC000819148283	CG	On-Demand	Anodyne	ADRB2	21	42
CCCCCC(C)(C)CNC[C@H](O)c1cccnc1	ZINC000819148283	CG	On-Demand	Anodyne	ADRB1	23	42
CCCCCC(C)(C)CNC[C@H](O)c1cccnc1	ZINC000819148283	CG	On-Demand	Anodyne	ADRB3	90	43
CCCCCC(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000819148284	CG	On-Demand	Anodyne	ADRB2	21	42
CCCCCC(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000819148284	CG	On-Demand	Anodyne	ADRB1	23	42
CCCCCC(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000819148284	CG	On-Demand	Anodyne	ADRB3	90	43
Cc1cc(F)ccc1[C@@H](O)CNCCc1csc(-c2ccccc2)n1	ZINC000819148313	FI	On-Demand	Anodyne	ADRB3	46	40
O=C(/C=C/[C@@H]1CCCO1)NCc1ccccc1N1CCCC1	ZINC000819148328	DF	On-Demand	Anodyne	KCNQ2	67	39
O=C(/C=C/[C@@H]1CCCO1)NCc1ccccc1N1CCCC1	ZINC000819148328	DF	On-Demand	Anodyne	SCN2A	17	42
O=C(/C=C/[C@@H]1CCCO1)NCc1ccccc1N1CCCC1	ZINC000819148328	DF	On-Demand	Anodyne	SCN10A	15	42
O=C(/C=C\[C@@H]1CCCO1)NCc1ccccc1N1CCCC1	ZINC000819148329	DF	On-Demand	Anodyne	KCNQ2	67	39
O=C(/C=C\[C@@H]1CCCO1)NCc1ccccc1N1CCCC1	ZINC000819148329	DF	On-Demand	Anodyne	SCN2A	17	42
O=C(/C=C\[C@@H]1CCCO1)NCc1ccccc1N1CCCC1	ZINC000819148329	DF	On-Demand	Anodyne	SCN10A	15	42
O=C(/C=C\[C@H]1CCCO1)NCc1ccccc1N1CCCC1	ZINC000819148330	DF	On-Demand	Anodyne	KCNQ2	67	39
O=C(/C=C\[C@H]1CCCO1)NCc1ccccc1N1CCCC1	ZINC000819148330	DF	On-Demand	Anodyne	SCN2A	17	42
O=C(/C=C\[C@H]1CCCO1)NCc1ccccc1N1CCCC1	ZINC000819148330	DF	On-Demand	Anodyne	SCN10A	15	42
O=C(/C=C/[C@H]1CCCO1)NCc1ccccc1N1CCCC1	ZINC000819148331	DF	On-Demand	Anodyne	KCNQ2	67	39
O=C(/C=C/[C@H]1CCCO1)NCc1ccccc1N1CCCC1	ZINC000819148331	DF	On-Demand	Anodyne	SCN2A	17	42
O=C(/C=C/[C@H]1CCCO1)NCc1ccccc1N1CCCC1	ZINC000819148331	DF	On-Demand	Anodyne	SCN10A	15	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(CCN3CCCCC3)cc1)C2	ZINC000819148334	GH	On-Demand	Anodyne	HRH3	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(CCN3CCCCC3)cc1)C2	ZINC000819148334	GH	On-Demand	Anodyne	BIRC2	40	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(CCN3CCCCC3)cc1)C2	ZINC000819148335	GH	On-Demand	Anodyne	HRH3	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(CCN3CCCCC3)cc1)C2	ZINC000819148335	GH	On-Demand	Anodyne	BIRC2	40	35
OCc1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819148349	CF	On-Demand	Anodyne	ADRB2	56	41
OCc1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819148349	CF	On-Demand	Anodyne	ADRB1	57	49
OCc1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819148349	CF	On-Demand	Anodyne	ADRB3	56	49
OCc1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819148350	CF	On-Demand	Anodyne	ADRB2	56	41
OCc1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819148350	CF	On-Demand	Anodyne	ADRB1	57	49
OCc1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819148350	CF	On-Demand	Anodyne	ADRB3	56	49
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819148383	FD	On-Demand	Anodyne	ADRB3	31	46
COc1ccc(C(=O)N2CCN(C(=O)C(F)=C3CCC3)CC2)c(OC)c1	ZINC000819148412	FE	On-Demand	Anodyne	OXTR	19	43
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819148419	GE	On-Demand	Anodyne	ADRB3	21	49
O=S(=O)(C1CC1)N1CCC(NC[C@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819148419	GE	On-Demand	Anodyne	EPHX2	16	40
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819148420	GE	On-Demand	Anodyne	ADRB3	21	49
O=S(=O)(C1CC1)N1CCC(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819148420	GE	On-Demand	Anodyne	EPHX2	16	40
Cc1ccccc1[C@@H](O)CNCCc1csc(-c2ccccc2)n1	ZINC000819148434	EH	On-Demand	Anodyne	ADRB2	26	43
Cc1ccccc1[C@@H](O)CNCCc1csc(-c2ccccc2)n1	ZINC000819148434	EH	On-Demand	Anodyne	ADRB1	29	40
Cc1ccccc1[C@@H](O)CNCCc1csc(-c2ccccc2)n1	ZINC000819148434	EH	On-Demand	Anodyne	ADRB3	50	39
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cccc(CO)c2)CC1	ZINC000819148437	FE	On-Demand	Anodyne	GPR119	50	55
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cccc(CO)c2)CC1	ZINC000819148438	FE	On-Demand	Anodyne	GPR119	50	55
C=C(C)C(C)(C)C(=O)N(C)Cc1cccc(C(N)=O)c1	ZINC000819148473	CE	On-Demand	Mild	HSD17B2	22	40
COc1ccc(OC)c([C@H](O)CNCCc2ccccc2OC(F)(F)F)c1	ZINC000819148548	GG	On-Demand	Anodyne	ADRB2	39	51
COc1ccc(OC)c([C@H](O)CNCCc2ccccc2OC(F)(F)F)c1	ZINC000819148548	GG	On-Demand	Anodyne	ADRB1	28	43
O[C@@H](CNCCc1ccccc1OC(F)(F)F)c1ccccc1F	ZINC000819148549	EH	On-Demand	Anodyne	ADRB2	23	41
O[C@@H](CNCCc1ccccc1OC(F)(F)F)c1ccccc1F	ZINC000819148549	EH	On-Demand	Anodyne	ADRB1	15	41
O[C@H](CNCCc1ccccc1OC(F)(F)F)c1ccccc1F	ZINC000819148550	EH	On-Demand	Anodyne	ADRB2	23	41
O[C@H](CNCCc1ccccc1OC(F)(F)F)c1ccccc1F	ZINC000819148550	EH	On-Demand	Anodyne	ADRB1	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCN(C)Cc1ccccc1)C2	ZINC000819148552	FE	On-Demand	Anodyne	GHSR	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCN(C)Cc1ccccc1)C2	ZINC000819148553	FE	On-Demand	Anodyne	GHSR	16	40
COc1cccc([S@@](=O)CC(=O)Nc2ccccc2C(=O)NC(C)(C)C)c1	ZINC000819148555	GF	On-Demand	Anodyne	MTNR1B	28	41
O=C(NCc1ccc(N2CCOCC2)cc1)c1cc2c(cn1)OCCO2	ZINC000819148575	FD	On-Demand	Clean	EPHB4	42	32
O=C(NCc1ccc(N2CCOCC2)cc1)c1cc2c(cn1)OCCO2	ZINC000819148575	FD	On-Demand	Clean	STAT6	67	39
O=C(NCc1ccc(N2CCOCC2)cc1)c1cc2c(cn1)OCCO2	ZINC000819148575	FD	On-Demand	Clean	NAMPT	44	42
Cc1ccccc1[C@@H](O)CNC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000819148581	FD	On-Demand	Anodyne	ADRB3	18	40
Cc1ccccc1[C@@H](O)CNC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000819148581	FD	On-Demand	Anodyne	CCR8	69	34
Cc1ccccc1[C@@H](O)CNC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000819148581	FD	On-Demand	Anodyne	SFRP1	90	35
Cc1ccccc1[C@@H](O)CNC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000819148581	FD	On-Demand	Anodyne	WNT3	53	34
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccccc2OC(F)(F)F)c1	ZINC000819148594	FG	On-Demand	Bother	ADRB1	41	38
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccccc2OC(F)(F)F)c1	ZINC000819148594	FG	On-Demand	Bother	ADRB3	54	39
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccccc2OC(F)(F)F)c1	ZINC000819148595	FG	On-Demand	Bother	ADRB1	41	38
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccccc2OC(F)(F)F)c1	ZINC000819148595	FG	On-Demand	Bother	ADRB3	54	39
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1CCN(c2ncccc2F)C1	ZINC000819148609	FD	On-Demand	Anodyne	PRKCQ	41	31
CSc1cc(C)ccc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819148613	EG	On-Demand	Bother	CACNA1C	46	39
CSc1cc(C)ccc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819148613	EG	On-Demand	Bother	CACNA1D	67	34
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CCN(c2ncccc2F)C1	ZINC000819148614	FD	On-Demand	Anodyne	PRKCQ	41	31
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CCN(c2ncccc2F)C1	ZINC000819148615	FD	On-Demand	Anodyne	PRKCQ	41	31
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H]1CCN(c2ncccc2F)C1	ZINC000819148616	FD	On-Demand	Anodyne	PRKCQ	41	31
CSc1cc(C)ccc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819148617	EG	On-Demand	Bother	CACNA1C	46	39
CSc1cc(C)ccc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819148617	EG	On-Demand	Bother	CACNA1D	67	34
CCOc1ccccc1CNC(=O)C(F)=C1CCC1	ZINC000819148635	CG	On-Demand	Anodyne	HCN1	51	34
CCOc1ccccc1CNC(=O)C(F)=C1CCC1	ZINC000819148635	CG	On-Demand	Anodyne	HCN4	43	33
CCOc1ccccc1CNC(=O)/C=C/[C@H]1CCCO1	ZINC000819148659	CE	On-Demand	Anodyne	HCN1	49	32
CCOc1ccccc1CNC(=O)/C=C/[C@H]1CCCO1	ZINC000819148659	CE	On-Demand	Anodyne	HCN4	42	32
CCOc1ccccc1CNC(=O)/C=C\[C@H]1CCCO1	ZINC000819148661	CE	On-Demand	Anodyne	HCN1	49	32
CCOc1ccccc1CNC(=O)/C=C\[C@H]1CCCO1	ZINC000819148661	CE	On-Demand	Anodyne	HCN4	42	32
CCOc1ccccc1CNC(=O)/C=C\[C@@H]1CCCO1	ZINC000819148663	CE	On-Demand	Anodyne	HCN1	49	32
CCOc1ccccc1CNC(=O)/C=C\[C@@H]1CCCO1	ZINC000819148663	CE	On-Demand	Anodyne	HCN4	42	32
CCOc1ccccc1CNC(=O)/C=C/[C@@H]1CCCO1	ZINC000819148665	CE	On-Demand	Anodyne	HCN1	49	32
CCOc1ccccc1CNC(=O)/C=C/[C@@H]1CCCO1	ZINC000819148665	CE	On-Demand	Anodyne	HCN4	42	32
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819148667	FF	On-Demand	Anodyne	GRIN2B	17	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819148667	FF	On-Demand	Anodyne	C3AR1	42	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819148667	FF	On-Demand	Anodyne	MLNR	20	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819148669	FF	On-Demand	Anodyne	GRIN2B	17	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819148669	FF	On-Demand	Anodyne	C3AR1	42	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819148669	FF	On-Demand	Anodyne	MLNR	20	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819148671	FF	On-Demand	Anodyne	GRIN2B	17	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819148671	FF	On-Demand	Anodyne	C3AR1	42	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819148671	FF	On-Demand	Anodyne	MLNR	20	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819148673	FF	On-Demand	Anodyne	GRIN2B	17	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819148673	FF	On-Demand	Anodyne	C3AR1	42	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819148673	FF	On-Demand	Anodyne	MLNR	20	42
CCCCCOc1cc(C)ccc1CNC[C@H](O)c1cccnc1	ZINC000819148736	EH	On-Demand	Anodyne	ADRB2	20	44
CCCCCOc1cc(C)ccc1CNC[C@H](O)c1cccnc1	ZINC000819148736	EH	On-Demand	Anodyne	ADRB1	25	44
CCCCCOc1cc(C)ccc1CNC[C@H](O)c1cccnc1	ZINC000819148736	EH	On-Demand	Anodyne	ADRB3	74	44
CCCCCOc1cc(C)ccc1CNC[C@@H](O)c1cccnc1	ZINC000819148737	EH	On-Demand	Anodyne	ADRB2	20	44
CCCCCOc1cc(C)ccc1CNC[C@@H](O)c1cccnc1	ZINC000819148737	EH	On-Demand	Anodyne	ADRB1	25	44
CCCCCOc1cc(C)ccc1CNC[C@@H](O)c1cccnc1	ZINC000819148737	EH	On-Demand	Anodyne	ADRB3	74	44
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819148762	FG	On-Demand	Anodyne	ADRB1	51	45
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819148762	FG	On-Demand	Anodyne	ADRB3	74	49
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819148762	FG	On-Demand	Anodyne	SIGMAR1	15	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819148762	FG	On-Demand	Anodyne	C3AR1	47	50
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819148762	FG	On-Demand	Anodyne	MLNR	18	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819148762	FG	On-Demand	Anodyne	CYP3A4	48	37
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819148763	FG	On-Demand	Anodyne	ADRB1	51	45
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819148763	FG	On-Demand	Anodyne	ADRB3	74	49
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819148763	FG	On-Demand	Anodyne	SIGMAR1	15	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819148763	FG	On-Demand	Anodyne	C3AR1	47	50
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819148763	FG	On-Demand	Anodyne	MLNR	18	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819148763	FG	On-Demand	Anodyne	CYP3A4	48	37
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819148764	FG	On-Demand	Anodyne	ADRB1	51	45
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819148764	FG	On-Demand	Anodyne	ADRB3	74	49
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819148764	FG	On-Demand	Anodyne	SIGMAR1	15	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819148764	FG	On-Demand	Anodyne	C3AR1	47	50
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819148764	FG	On-Demand	Anodyne	MLNR	18	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819148764	FG	On-Demand	Anodyne	CYP3A4	48	37
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819148765	FG	On-Demand	Anodyne	ADRB1	51	45
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819148765	FG	On-Demand	Anodyne	ADRB3	74	49
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819148765	FG	On-Demand	Anodyne	SIGMAR1	15	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819148765	FG	On-Demand	Anodyne	C3AR1	47	50
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819148765	FG	On-Demand	Anodyne	MLNR	18	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819148765	FG	On-Demand	Anodyne	CYP3A4	48	37
O[C@@H](CNCCc1ccccc1OC(F)(F)F)c1ccccc1	ZINC000819148776	EG	On-Demand	Anodyne	ADRB2	41	43
O[C@@H](CNCCc1ccccc1OC(F)(F)F)c1ccccc1	ZINC000819148776	EG	On-Demand	Anodyne	ADRB1	47	42
O[C@@H](CNCCc1ccccc1OC(F)(F)F)c1ccccc1	ZINC000819148776	EG	On-Demand	Anodyne	ADRB3	72	48
O[C@H](CNCCc1ccccc1OC(F)(F)F)c1ccccc1	ZINC000819148777	EG	On-Demand	Anodyne	ADRB2	41	43
O[C@H](CNCCc1ccccc1OC(F)(F)F)c1ccccc1	ZINC000819148777	EG	On-Demand	Anodyne	ADRB1	47	42
O[C@H](CNCCc1ccccc1OC(F)(F)F)c1ccccc1	ZINC000819148777	EG	On-Demand	Anodyne	ADRB3	72	48
O[C@@H](CNCCc1ccccc1OC(F)(F)F)c1cccc(F)c1	ZINC000819148793	EH	On-Demand	Anodyne	ADRB2	49	40
O[C@@H](CNCCc1ccccc1OC(F)(F)F)c1cccc(F)c1	ZINC000819148793	EH	On-Demand	Anodyne	ADRB1	45	46
O[C@@H](CNCCc1ccccc1OC(F)(F)F)c1cccc(F)c1	ZINC000819148793	EH	On-Demand	Anodyne	ADRB3	59	46
O[C@H](CNCCc1ccccc1OC(F)(F)F)c1cccc(F)c1	ZINC000819148794	EH	On-Demand	Anodyne	ADRB2	49	40
O[C@H](CNCCc1ccccc1OC(F)(F)F)c1cccc(F)c1	ZINC000819148794	EH	On-Demand	Anodyne	ADRB1	45	46
O[C@H](CNCCc1ccccc1OC(F)(F)F)c1cccc(F)c1	ZINC000819148794	EH	On-Demand	Anodyne	ADRB3	59	46
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)C2CC2)C1	ZINC000819148795	DD	On-Demand	Anodyne	GRIN2B	30	46
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)C2CC2)C1	ZINC000819148795	DD	On-Demand	Anodyne	C3AR1	47	46
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)C2CC2)C1	ZINC000819148795	DD	On-Demand	Anodyne	ABCB1	15	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)C2CC2)C1	ZINC000819148795	DD	On-Demand	Anodyne	BIRC2	19	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)C2CC2)C1	ZINC000819148796	DD	On-Demand	Anodyne	GRIN2B	30	46
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)C2CC2)C1	ZINC000819148796	DD	On-Demand	Anodyne	C3AR1	47	46
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)C2CC2)C1	ZINC000819148796	DD	On-Demand	Anodyne	ABCB1	15	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)C2CC2)C1	ZINC000819148796	DD	On-Demand	Anodyne	BIRC2	19	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)C2CC2)C1	ZINC000819148797	DD	On-Demand	Anodyne	GRIN2B	30	46
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)C2CC2)C1	ZINC000819148797	DD	On-Demand	Anodyne	C3AR1	47	46
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)C2CC2)C1	ZINC000819148797	DD	On-Demand	Anodyne	ABCB1	15	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)C2CC2)C1	ZINC000819148797	DD	On-Demand	Anodyne	BIRC2	19	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)C2CC2)C1	ZINC000819148798	DD	On-Demand	Anodyne	GRIN2B	30	46
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)C2CC2)C1	ZINC000819148798	DD	On-Demand	Anodyne	C3AR1	47	46
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)C2CC2)C1	ZINC000819148798	DD	On-Demand	Anodyne	ABCB1	15	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)C2CC2)C1	ZINC000819148798	DD	On-Demand	Anodyne	BIRC2	19	41
CCOC(=O)C1CCC(O)(CNCc2cc([N+](=O)[O-])ccc2Cl)CC1	ZINC000819148804	FF	On-Demand	Bother	CACNA1C	59	37
CCOC(=O)C1CCC(O)(CNCc2cc([N+](=O)[O-])ccc2Cl)CC1	ZINC000819148804	FF	On-Demand	Bother	CACNA1D	89	37
CCOC(=O)C1CCC(O)(CNCc2cc([N+](=O)[O-])ccc2Cl)CC1	ZINC000819148804	FF	On-Demand	Bother	SLC27A4	49	32
Cn1ccnc1[C@@](O)(CCNC(=O)c1coc(=O)c2ccccc12)C(F)(F)F	ZINC000819148808	GE	On-Demand	Anodyne	INHA	51	33
Cn1ccnc1[C@](O)(CCNC(=O)c1coc(=O)c2ccccc12)C(F)(F)F	ZINC000819148809	GE	On-Demand	Anodyne	INHA	51	33
O=[N+]([O-])c1ccc(Cl)c(CNC[C@@H](O)COc2ccccc2F)c1	ZINC000819148819	FF	On-Demand	Bother	ADRB1	48	40
O=[N+]([O-])c1ccc(Cl)c(CNC[C@H](O)COc2ccccc2F)c1	ZINC000819148820	FF	On-Demand	Bother	ADRB1	48	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819148835	FF	On-Demand	Anodyne	GRIN2B	17	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819148835	FF	On-Demand	Anodyne	ADRB3	48	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819148835	FF	On-Demand	Anodyne	C3AR1	47	43
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819148835	FF	On-Demand	Anodyne	MLNR	26	48
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819148836	FF	On-Demand	Anodyne	GRIN2B	17	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819148836	FF	On-Demand	Anodyne	ADRB3	48	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819148836	FF	On-Demand	Anodyne	C3AR1	47	43
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819148836	FF	On-Demand	Anodyne	MLNR	26	48
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819148837	FF	On-Demand	Anodyne	GRIN2B	17	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819148837	FF	On-Demand	Anodyne	ADRB3	48	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819148837	FF	On-Demand	Anodyne	C3AR1	47	43
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819148837	FF	On-Demand	Anodyne	MLNR	26	48
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819148838	FF	On-Demand	Anodyne	GRIN2B	17	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819148838	FF	On-Demand	Anodyne	ADRB3	48	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819148838	FF	On-Demand	Anodyne	C3AR1	47	43
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819148838	FF	On-Demand	Anodyne	MLNR	26	48
O=S(=O)(N1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1)C(F)(F)F	ZINC000819148865	FD	On-Demand	Anodyne	SLC6A3	27	45
O=S(=O)(N1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1)C(F)(F)F	ZINC000819148865	FD	On-Demand	Anodyne	ADRB3	27	42
O=S(=O)(N1CCC(NC[C@H](O)c2ccc(F)cc2)CC1)C(F)(F)F	ZINC000819148866	FD	On-Demand	Anodyne	SLC6A3	27	45
O=S(=O)(N1CCC(NC[C@H](O)c2ccc(F)cc2)CC1)C(F)(F)F	ZINC000819148866	FD	On-Demand	Anodyne	ADRB3	27	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCS1	ZINC000819148881	GF	On-Demand	Anodyne	CTSD	100	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCS1	ZINC000819148881	GF	On-Demand	Anodyne	PGC	62	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCS1	ZINC000819148881	GF	On-Demand	Anodyne	CMA1	29	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCS1	ZINC000819148881	GF	On-Demand	Anodyne	PAPA1_CARPA	31	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCS1	ZINC000819148881	GF	On-Demand	Anodyne	BACE2	52	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCS1	ZINC000819148881	GF	On-Demand	Anodyne	REN	98	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCS1	ZINC000819148881	GF	On-Demand	Anodyne	REN1	23	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCS1	ZINC000819148881	GF	On-Demand	Anodyne	BACE1	80	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCS1	ZINC000819148881	GF	On-Demand	Anodyne	FPR1	50	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCS1	ZINC000819148881	GF	On-Demand	Anodyne	PLM1_PLAFA	23	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCS1	ZINC000819148882	GF	On-Demand	Anodyne	CTSD	100	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCS1	ZINC000819148882	GF	On-Demand	Anodyne	PGC	62	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCS1	ZINC000819148882	GF	On-Demand	Anodyne	CMA1	29	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCS1	ZINC000819148882	GF	On-Demand	Anodyne	PAPA1_CARPA	31	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCS1	ZINC000819148882	GF	On-Demand	Anodyne	BACE2	52	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCS1	ZINC000819148882	GF	On-Demand	Anodyne	REN	98	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCS1	ZINC000819148882	GF	On-Demand	Anodyne	REN1	23	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCS1	ZINC000819148882	GF	On-Demand	Anodyne	BACE1	80	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCS1	ZINC000819148882	GF	On-Demand	Anodyne	FPR1	50	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCS1	ZINC000819148882	GF	On-Demand	Anodyne	PLM1_PLAFA	23	41
CCCNC(=O)c1ccc(NC(=O)C(F)=C2CCC2)cc1Cl	ZINC000819148883	DH	On-Demand	Anodyne	AVPR2	15	41
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1cccc2ccccc12	ZINC000819148896	FG	On-Demand	Anodyne	PRKCQ	41	31
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1cccc2ccccc12	ZINC000819148897	FG	On-Demand	Anodyne	PRKCQ	41	31
Cc1ccc(OC[C@@H](O)CNC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc1	ZINC000819148915	GD	On-Demand	Anodyne	ADRB2	43	51
Cc1ccc(OC[C@@H](O)CNC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc1	ZINC000819148915	GD	On-Demand	Anodyne	ADRB1	54	44
Cc1ccc(OC[C@@H](O)CNC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc1	ZINC000819148915	GD	On-Demand	Anodyne	ADRB3	43	59
Cc1ccc(OC[C@H](O)CNC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc1	ZINC000819148916	GD	On-Demand	Anodyne	ADRB2	43	51
Cc1ccc(OC[C@H](O)CNC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc1	ZINC000819148916	GD	On-Demand	Anodyne	ADRB1	54	44
Cc1ccc(OC[C@H](O)CNC2CCN(S(=O)(=O)C(F)(F)F)CC2)cc1	ZINC000819148916	GD	On-Demand	Anodyne	ADRB3	43	59
O=S(=O)(N1CCC(NC[C@@H](O)COc2ccccc2)CC1)C(F)(F)F	ZINC000819148922	GD	On-Demand	Anodyne	ADRB2	52	53
O=S(=O)(N1CCC(NC[C@@H](O)COc2ccccc2)CC1)C(F)(F)F	ZINC000819148922	GD	On-Demand	Anodyne	ADRB1	72	53
O=S(=O)(N1CCC(NC[C@@H](O)COc2ccccc2)CC1)C(F)(F)F	ZINC000819148922	GD	On-Demand	Anodyne	ADRB3	64	56
O=S(=O)(N1CCC(NC[C@@H](O)COc2ccccc2)CC1)C(F)(F)F	ZINC000819148922	GD	On-Demand	Anodyne	SFRP1	111	36
O=S(=O)(N1CCC(NC[C@@H](O)COc2ccccc2)CC1)C(F)(F)F	ZINC000819148922	GD	On-Demand	Anodyne	WNT3	67	36
O=S(=O)(N1CCC(NC[C@H](O)COc2ccccc2)CC1)C(F)(F)F	ZINC000819148923	GD	On-Demand	Anodyne	ADRB2	52	53
O=S(=O)(N1CCC(NC[C@H](O)COc2ccccc2)CC1)C(F)(F)F	ZINC000819148923	GD	On-Demand	Anodyne	ADRB1	72	53
O=S(=O)(N1CCC(NC[C@H](O)COc2ccccc2)CC1)C(F)(F)F	ZINC000819148923	GD	On-Demand	Anodyne	ADRB3	64	56
O=S(=O)(N1CCC(NC[C@H](O)COc2ccccc2)CC1)C(F)(F)F	ZINC000819148923	GD	On-Demand	Anodyne	SFRP1	111	36
O=S(=O)(N1CCC(NC[C@H](O)COc2ccccc2)CC1)C(F)(F)F	ZINC000819148923	GD	On-Demand	Anodyne	WNT3	67	36
CCOC(=O)[C@H](C)NC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819148927	GF	On-Demand	Anodyne	CNR1	52	33
CCOC(=O)[C@H](C)NC(=O)[C@@H](CC)Cc1ccccc1C	ZINC000819148929	CF	On-Demand	Anodyne	ACE	33	54
CCOC(=O)[C@H](C)NC(=O)[C@@H](CC)Cc1ccccc1C	ZINC000819148929	CF	On-Demand	Anodyne	MME	80	45
CCOC(=O)[C@H](C)NC(=O)[C@@H](CC)Cc1ccccc1C	ZINC000819148929	CF	On-Demand	Anodyne	ANPEP	59	38
CCOC(=O)[C@H](C)NC(=O)[C@@H](CC)Cc1ccccc1C	ZINC000819148929	CF	On-Demand	Anodyne	CPA1	16	47
CCOC(=O)[C@H](C)NC(=O)[C@@H](CC)Cc1ccccc1C	ZINC000819148929	CF	On-Demand	Anodyne	CAPNS1	52	34
CCOC(=O)[C@H](C)NC(=O)[C@@H](CC)Cc1ccccc1C	ZINC000819148929	CF	On-Demand	Anodyne	HLA-DRB1	82	39
CCOC(=O)[C@H](C)NC(=O)[C@@H](CC)Cc1ccccc1C	ZINC000819148929	CF	On-Demand	Anodyne	CAPN1	40	35
CCOC(=O)[C@H](C)NC(=O)[C@@H](CC)Cc1ccccc1C	ZINC000819148929	CF	On-Demand	Anodyne	CAPN2	72	39
CCOC(=O)[C@H](C)NC(=O)[C@@H](CC)Cc1ccccc1C	ZINC000819148929	CF	On-Demand	Anodyne	ACE2	60	38
CCOC(=O)[C@H](C)NC(=O)[C@@H](CC)Cc1ccccc1C	ZINC000819148929	CF	On-Demand	Anodyne	MMP1	17	44
CCOC(=O)[C@H](C)NC(=O)[C@@H](CC)Cc1ccccc1C	ZINC000819148929	CF	On-Demand	Anodyne	NPR	48	40
CCOC(=O)[C@H](C)NC(=O)[C@H](CC)Cc1ccccc1C	ZINC000819148931	CF	On-Demand	Anodyne	ACE	33	54
CCOC(=O)[C@H](C)NC(=O)[C@H](CC)Cc1ccccc1C	ZINC000819148931	CF	On-Demand	Anodyne	MME	80	45
CCOC(=O)[C@H](C)NC(=O)[C@H](CC)Cc1ccccc1C	ZINC000819148931	CF	On-Demand	Anodyne	ANPEP	59	38
CCOC(=O)[C@H](C)NC(=O)[C@H](CC)Cc1ccccc1C	ZINC000819148931	CF	On-Demand	Anodyne	CPA1	16	47
CCOC(=O)[C@H](C)NC(=O)[C@H](CC)Cc1ccccc1C	ZINC000819148931	CF	On-Demand	Anodyne	CAPNS1	52	34
CCOC(=O)[C@H](C)NC(=O)[C@H](CC)Cc1ccccc1C	ZINC000819148931	CF	On-Demand	Anodyne	HLA-DRB1	82	39
CCOC(=O)[C@H](C)NC(=O)[C@H](CC)Cc1ccccc1C	ZINC000819148931	CF	On-Demand	Anodyne	CAPN1	40	35
CCOC(=O)[C@H](C)NC(=O)[C@H](CC)Cc1ccccc1C	ZINC000819148931	CF	On-Demand	Anodyne	CAPN2	72	39
CCOC(=O)[C@H](C)NC(=O)[C@H](CC)Cc1ccccc1C	ZINC000819148931	CF	On-Demand	Anodyne	ACE2	60	38
CCOC(=O)[C@H](C)NC(=O)[C@H](CC)Cc1ccccc1C	ZINC000819148931	CF	On-Demand	Anodyne	MMP1	17	44
CCOC(=O)[C@H](C)NC(=O)[C@H](CC)Cc1ccccc1C	ZINC000819148931	CF	On-Demand	Anodyne	NPR	48	40
O=S(=O)(N1CCC(NC[C@@H](O)c2ccccc2F)CC1)C(F)(F)F	ZINC000819148937	FD	On-Demand	Anodyne	SFRP1	76	35
O=S(=O)(N1CCC(NC[C@@H](O)c2ccccc2F)CC1)C(F)(F)F	ZINC000819148937	FD	On-Demand	Anodyne	WNT3	40	33
O=S(=O)(N1CCC(NC[C@H](O)c2ccccc2F)CC1)C(F)(F)F	ZINC000819148938	FD	On-Demand	Anodyne	SFRP1	76	35
O=S(=O)(N1CCC(NC[C@H](O)c2ccccc2F)CC1)C(F)(F)F	ZINC000819148938	FD	On-Demand	Anodyne	WNT3	40	33
Cc1c(CC(=O)NCC(C)CNC(=O)Cc2cccc([N+](=O)[O-])c2C)cccc1[N+](=O)[O-]	ZINC000819148962	IF	On-Demand	Bother	COLA	126	39
CC(CNC(=O)[C@H](C)NC(=O)c1ccco1)CNC(=O)[C@H](C)NC(=O)c1ccco1	ZINC000819148974	HC	On-Demand	Anodyne	ADAM12	26	43
CC(CNC(=O)[C@@H](C)NC(=O)c1ccco1)CNC(=O)[C@@H](C)NC(=O)c1ccco1	ZINC000819148975	HC	On-Demand	Anodyne	ADAM12	26	43
C[C@@H](CNC(=O)[C@H](C)NC(=O)c1ccco1)CNC(=O)[C@@H](C)NC(=O)c1ccco1	ZINC000819148976	HC	On-Demand	Anodyne	ADAM12	26	43
CC(CNC(=O)c1ccnc(-c2ncc[nH]2)c1)CNC(=O)c1ccnc(-c2ncc[nH]2)c1	ZINC000819149004	IE	On-Demand	Anodyne	KDM4E	35	46
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000819149018	FF	On-Demand	Anodyne	GRIN2B	16	42
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000819149018	FF	On-Demand	Anodyne	SIGMAR1	16	43
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000819149018	FF	On-Demand	Anodyne	C3AR1	43	41
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000819149018	FF	On-Demand	Anodyne	CCR8	74	38
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000819149019	FF	On-Demand	Anodyne	GRIN2B	16	42
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000819149019	FF	On-Demand	Anodyne	SIGMAR1	16	43
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000819149019	FF	On-Demand	Anodyne	C3AR1	43	41
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000819149019	FF	On-Demand	Anodyne	CCR8	74	38
CC(CNC(=O)Cc1cccc([N+](=O)[O-])c1)CNC(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000819149034	HE	On-Demand	Bother	CACNA1C	63	40
CC(CNC(=O)Cc1cccc([N+](=O)[O-])c1)CNC(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000819149034	HE	On-Demand	Bother	CACNA1D	97	39
CC(CNC(=O)Cc1cccc([N+](=O)[O-])c1)CNC(=O)Cc1cccc([N+](=O)[O-])c1	ZINC000819149034	HE	On-Demand	Bother	COLA	60	39
COc1ccc2c(C)c(CCC(=O)NCCC(C)(C)C3CC3)c(=O)oc2c1	ZINC000819149042	FH	On-Demand	Anodyne	MAOB	34	45
COc1ccc2c(C)c(CCC(=O)NCCC(C)(C)C3CC3)c(=O)oc2c1	ZINC000819149042	FH	On-Demand	Anodyne	MTNR1A	63	41
COc1ccc2c(C)c(CCC(=O)NCCC(C)(C)C3CC3)c(=O)oc2c1	ZINC000819149042	FH	On-Demand	Anodyne	MTNR1B	56	41
COc1ccc2c(C)c(CCC(=O)NCCC(C)(C)C3CC3)c(=O)oc2c1	ZINC000819149042	FH	On-Demand	Anodyne	NQO1	24	44
CC(CNC(=O)c1ccc(-n2cccn2)nc1)CNC(=O)c1ccc(-n2cccn2)nc1	ZINC000819149045	ID	On-Demand	Anodyne	AMP1_PLAFQ	54	36
O=[N+]([O-])c1cccc([C@@H](O)CNCCCO[C@@H]2CCOC2)c1	ZINC000819149058	DD	On-Demand	Bother	ADRB3	32	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCCO[C@H]2CCOC2)c1	ZINC000819149059	DD	On-Demand	Bother	ADRB3	32	40
O=[N+]([O-])c1cccc([C@H](O)CNCCCO[C@@H]2CCOC2)c1	ZINC000819149061	DD	On-Demand	Bother	ADRB3	32	40
O=[N+]([O-])c1cccc([C@H](O)CNCCCO[C@H]2CCOC2)c1	ZINC000819149063	DD	On-Demand	Bother	ADRB3	32	40
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NCCC(C)(C)C3CC3)nn2)CC1	ZINC000819149066	HG	On-Demand	Anodyne	GPR119	41	38
CC(CNC(=O)[C@H]1CC(c2ccccc2)=NO1)CNC(=O)[C@H]1CC(c2ccccc2)=NO1	ZINC000819149073	IE	On-Demand	Anodyne	LUCI_PHOPY	71	42
C[C@@H](CNC(=O)[C@@H]1CC(c2ccccc2)=NO1)CNC(=O)[C@H]1CC(c2ccccc2)=NO1	ZINC000819149077	IE	On-Demand	Anodyne	LUCI_PHOPY	71	42
CC(CNC(=O)[C@@H]1CC(c2ccccc2)=NO1)CNC(=O)[C@@H]1CC(c2ccccc2)=NO1	ZINC000819149079	IE	On-Demand	Anodyne	LUCI_PHOPY	71	42
CC(CNC(=O)c1cc(C(C)(C)C)n[nH]1)CNC(=O)c1cc(C(C)(C)C)n[nH]1	ZINC000819149089	GF	On-Demand	Anodyne	ALPL	62	47
O[C@@H](CNCCCO[C@@H]1CCOC1)c1ccc(Cl)cc1	ZINC000819149098	CE	On-Demand	Anodyne	ADRB2	31	42
O[C@@H](CNCCCO[C@H]1CCOC1)c1ccc(Cl)cc1	ZINC000819149099	CE	On-Demand	Anodyne	ADRB2	31	42
CC(CNC(=O)/C=C/c1ccc(O)cc1)CNC(=O)/C=C/c1ccc(O)cc1	ZINC000819149107	GF	On-Demand	Anodyne	HDAC8	27	40
CC(CNC(=O)/C=C/c1ccc(O)cc1)CNC(=O)/C=C/c1ccc(O)cc1	ZINC000819149107	GF	On-Demand	Anodyne	F3	28	50
CC(CNC(=O)/C=C/c1ccc(O)cc1)CNC(=O)/C=C/c1ccc(O)cc1	ZINC000819149107	GF	On-Demand	Anodyne	MMP2	16	57
CC(CNC(=O)/C=C/c1ccc(O)cc1)CNC(=O)/C=C/c1ccc(O)cc1	ZINC000819149107	GF	On-Demand	Anodyne	MMP9	16	57
CC(CNC(=O)/C=C/c1ccc(O)cc1)CNC(=O)/C=C/c1ccc(O)cc1	ZINC000819149107	GF	On-Demand	Anodyne	SSSIM	18	56
O=C(NCc1ccc(F)cc1Br)C(F)=C1CCC1	ZINC000819149126	DH	On-Demand	Anodyne	P2RX7	22	49
O[C@@H](CNCCCO[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819149137	CE	On-Demand	Anodyne	ADRB2	47	43
O[C@@H](CNCCCO[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819149137	CE	On-Demand	Anodyne	ADRB1	57	45
O[C@@H](CNCCCO[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819149137	CE	On-Demand	Anodyne	ADRB3	60	46
O[C@@H](CNCCCO[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819149137	CE	On-Demand	Anodyne	CYP3A4	46	37
O[C@@H](CNCCCO[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819149139	CE	On-Demand	Anodyne	ADRB2	47	43
O[C@@H](CNCCCO[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819149139	CE	On-Demand	Anodyne	ADRB1	57	45
O[C@@H](CNCCCO[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819149139	CE	On-Demand	Anodyne	ADRB3	60	46
O[C@@H](CNCCCO[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819149139	CE	On-Demand	Anodyne	CYP3A4	46	37
O[C@H](CNCCCO[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819149141	CE	On-Demand	Anodyne	ADRB2	47	43
O[C@H](CNCCCO[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819149141	CE	On-Demand	Anodyne	ADRB1	57	45
O[C@H](CNCCCO[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819149141	CE	On-Demand	Anodyne	ADRB3	60	46
O[C@H](CNCCCO[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819149141	CE	On-Demand	Anodyne	CYP3A4	46	37
O[C@H](CNCCCO[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819149143	CE	On-Demand	Anodyne	ADRB2	47	43
O[C@H](CNCCCO[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819149143	CE	On-Demand	Anodyne	ADRB1	57	45
O[C@H](CNCCCO[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819149143	CE	On-Demand	Anodyne	ADRB3	60	46
O[C@H](CNCCCO[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819149143	CE	On-Demand	Anodyne	CYP3A4	46	37
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1c(F)cccc1F	ZINC000819149157	ED	On-Demand	Anodyne	ADRB3	65	45
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1c(F)cccc1F	ZINC000819149158	ED	On-Demand	Anodyne	ADRB3	65	45
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1c(F)cccc1F	ZINC000819149159	ED	On-Demand	Anodyne	ADRB3	65	45
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1c(F)cccc1F	ZINC000819149160	ED	On-Demand	Anodyne	ADRB3	65	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccnc1N1CCOCC1)C2	ZINC000819149183	FD	On-Demand	Anodyne	MTOR	40	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccnc1N1CCOCC1)C2	ZINC000819149184	FD	On-Demand	Anodyne	MTOR	40	38
O[C@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819149186	FG	On-Demand	Anodyne	ADRB3	16	42
O[C@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819149186	FG	On-Demand	Anodyne	TRPV1	26	43
O[C@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819149186	FG	On-Demand	Anodyne	LIPG	17	40
O[C@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819149187	FG	On-Demand	Anodyne	ADRB3	16	42
O[C@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819149187	FG	On-Demand	Anodyne	TRPV1	26	43
O[C@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819149187	FG	On-Demand	Anodyne	LIPG	17	40
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819149188	FG	On-Demand	Anodyne	ADRB3	16	42
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819149188	FG	On-Demand	Anodyne	TRPV1	26	43
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819149188	FG	On-Demand	Anodyne	LIPG	17	40
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819149189	FG	On-Demand	Anodyne	ADRB3	16	42
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819149189	FG	On-Demand	Anodyne	TRPV1	26	43
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819149189	FG	On-Demand	Anodyne	LIPG	17	40
O=C1[C@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1c1c(F)cccc1F	ZINC000819149196	FG	On-Demand	Anodyne	ADRB3	19	43
O=C1[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1c1c(F)cccc1F	ZINC000819149197	FG	On-Demand	Anodyne	ADRB3	19	43
O=S(=O)(N1CCC(NC[C@@H](O)c2c(F)cccc2F)CC1)C(F)(F)F	ZINC000819149205	GD	On-Demand	Anodyne	SFRP1	46	34
O=S(=O)(N1CCC(NC[C@H](O)c2c(F)cccc2F)CC1)C(F)(F)F	ZINC000819149206	GD	On-Demand	Anodyne	SFRP1	46	34
O=S(=O)(N1CCC(NC[C@@H](O)c2cccc(F)c2)CC1)C(F)(F)F	ZINC000819149207	FD	On-Demand	Anodyne	ADRB3	38	42
O=S(=O)(N1CCC(NC[C@@H](O)c2cccc(F)c2)CC1)C(F)(F)F	ZINC000819149207	FD	On-Demand	Anodyne	SFRP1	57	34
O=S(=O)(N1CCC(NC[C@H](O)c2cccc(F)c2)CC1)C(F)(F)F	ZINC000819149208	FD	On-Demand	Anodyne	ADRB3	38	42
O=S(=O)(N1CCC(NC[C@H](O)c2cccc(F)c2)CC1)C(F)(F)F	ZINC000819149208	FD	On-Demand	Anodyne	SFRP1	57	34
O=C(Nc1cc(N2CCCC2=O)ccc1Cl)C(F)=C1CCC1	ZINC000819149223	DH	On-Demand	Anodyne	HEMY	47	36
CCOC(=O)Nc1ccc2c(COc3ccc(Cl)cc3C(=O)CC)cc(=O)oc2c1	ZINC000819149241	IK	On-Demand	Anodyne	MAOB	28	47
CCOC(=O)Nc1ccc2c(COc3ccc(Cl)cc3C(=O)CC)cc(=O)oc2c1	ZINC000819149241	IK	On-Demand	Anodyne	AGPAT2	62	38
CC(CNC(=O)/C=C\c1ccc(O)cc1)CNC(=O)/C=C\c1ccc(O)cc1	ZINC000819149247	GF	On-Demand	Anodyne	HDAC8	27	40
CC(CNC(=O)/C=C\c1ccc(O)cc1)CNC(=O)/C=C\c1ccc(O)cc1	ZINC000819149247	GF	On-Demand	Anodyne	F3	28	50
CC(CNC(=O)/C=C\c1ccc(O)cc1)CNC(=O)/C=C\c1ccc(O)cc1	ZINC000819149247	GF	On-Demand	Anodyne	MMP2	16	57
CC(CNC(=O)/C=C\c1ccc(O)cc1)CNC(=O)/C=C\c1ccc(O)cc1	ZINC000819149247	GF	On-Demand	Anodyne	MMP9	16	57
CC(CNC(=O)/C=C\c1ccc(O)cc1)CNC(=O)/C=C\c1ccc(O)cc1	ZINC000819149247	GF	On-Demand	Anodyne	SSSIM	18	56
CC(CNC(=O)/C=C\c1ccc(O)cc1)CNC(=O)/C=C/c1ccc(O)cc1	ZINC000819149248	GF	On-Demand	Anodyne	HDAC8	27	40
CC(CNC(=O)/C=C\c1ccc(O)cc1)CNC(=O)/C=C/c1ccc(O)cc1	ZINC000819149248	GF	On-Demand	Anodyne	F3	28	50
CC(CNC(=O)/C=C\c1ccc(O)cc1)CNC(=O)/C=C/c1ccc(O)cc1	ZINC000819149248	GF	On-Demand	Anodyne	MMP2	16	57
CC(CNC(=O)/C=C\c1ccc(O)cc1)CNC(=O)/C=C/c1ccc(O)cc1	ZINC000819149248	GF	On-Demand	Anodyne	MMP9	16	57
CC(CNC(=O)/C=C\c1ccc(O)cc1)CNC(=O)/C=C/c1ccc(O)cc1	ZINC000819149248	GF	On-Demand	Anodyne	SSSIM	18	56
O=C(NOCCCO)c1cc(Cl)cc(Cl)c1	ZINC000819149284	CE	On-Demand	Anodyne	CACNA1I	45	35
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	ACE	64	47
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	MME	160	51
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	ANPEP	90	41
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	FCER2	85	37
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	CTSB	50	39
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	PAPA1_CARPA	53	41
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	CTSL	35	40
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	CPA1	70	40
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	CTRB1	29	44
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	CAPNS1	60	34
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	MMP8	25	41
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	ECE1	15	41
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	HLA-DRB1	46	34
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	CTSS	15	40
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	CAPN1	77	42
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	CAPN2	76	38
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	ACE2	72	40
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	LAP3	49	43
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	FPR1	66	39
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	NPR	70	40
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	AMP1_PLAFQ	67	43
CC(CNC(=O)[C@@H](F)Cc1ccccc1)CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819149293	GG	On-Demand	Anodyne	NPFFR1	55	32
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	ACE	64	47
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	MME	160	51
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	ANPEP	90	41
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	FCER2	85	37
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	CTSB	50	39
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	PAPA1_CARPA	53	41
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	CTSL	35	40
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	CPA1	70	40
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	CTRB1	29	44
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	CAPNS1	60	34
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	MMP8	25	41
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	ECE1	15	41
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	HLA-DRB1	46	34
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	CTSS	15	40
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	CAPN1	77	42
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	CAPN2	76	38
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	ACE2	72	40
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	LAP3	49	43
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	FPR1	66	39
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	NPR	70	40
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	AMP1_PLAFQ	67	43
CC(CNC(=O)[C@H](F)Cc1ccccc1)CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819149294	GG	On-Demand	Anodyne	NPFFR1	55	32
CC(CNC(=O)c1ccc2c(c1)N(C)CCO2)CNC(=O)c1ccc2c(c1)N(C)CCO2	ZINC000819149323	IE	On-Demand	Anodyne	F3	75	33
CC(CNC(=O)[C@H](O)c1ccc(Cl)cc1)CNC(=O)[C@H](O)c1ccc(Cl)cc1	ZINC000819149338	IF	On-Demand	Anodyne	UTS2	44	36
CC(CNC(=O)[C@@H](O)c1ccc(Cl)cc1)CNC(=O)[C@@H](O)c1ccc(Cl)cc1	ZINC000819149339	IF	On-Demand	Anodyne	UTS2	44	36
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819149351	FF	On-Demand	Anodyne	SLC6A3	29	46
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819149351	FF	On-Demand	Anodyne	GRIN2B	29	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819149351	FF	On-Demand	Anodyne	SIGMAR1	19	46
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819149351	FF	On-Demand	Anodyne	C3AR1	46	49
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819149351	FF	On-Demand	Anodyne	MLNR	35	47
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819149352	FF	On-Demand	Anodyne	SLC6A3	29	46
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819149352	FF	On-Demand	Anodyne	GRIN2B	29	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819149352	FF	On-Demand	Anodyne	SIGMAR1	19	46
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819149352	FF	On-Demand	Anodyne	C3AR1	46	49
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819149352	FF	On-Demand	Anodyne	MLNR	35	47
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819149353	FF	On-Demand	Anodyne	SLC6A3	29	46
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819149353	FF	On-Demand	Anodyne	GRIN2B	29	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819149353	FF	On-Demand	Anodyne	SIGMAR1	19	46
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819149353	FF	On-Demand	Anodyne	C3AR1	46	49
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819149353	FF	On-Demand	Anodyne	MLNR	35	47
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819149354	FF	On-Demand	Anodyne	SLC6A3	29	46
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819149354	FF	On-Demand	Anodyne	GRIN2B	29	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819149354	FF	On-Demand	Anodyne	SIGMAR1	19	46
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819149354	FF	On-Demand	Anodyne	C3AR1	46	49
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819149354	FF	On-Demand	Anodyne	MLNR	35	47
O=C(/C=C/[C@@H]1CCCO1)Nc1ccccc1OCCn1ccnc1	ZINC000819149363	EF	On-Demand	Anodyne	TBXAS1	26	43
O=C(/C=C\[C@@H]1CCCO1)Nc1ccccc1OCCn1ccnc1	ZINC000819149364	EF	On-Demand	Anodyne	TBXAS1	26	43
O=C(/C=C/[C@H]1CCCO1)Nc1ccccc1OCCn1ccnc1	ZINC000819149365	EF	On-Demand	Anodyne	TBXAS1	26	43
O=C(/C=C\[C@H]1CCCO1)Nc1ccccc1OCCn1ccnc1	ZINC000819149366	EF	On-Demand	Anodyne	TBXAS1	26	43
O=C(CCc1cccc(OC(F)F)c1)NCc1ccc(N2CCOCC2)cc1	ZINC000819149372	GG	On-Demand	Clean	PLA2G4A	28	43
O=C(CCc1cccc(OC(F)F)c1)NCc1ccc(N2CCOCC2)cc1	ZINC000819149372	GG	On-Demand	Clean	STAT6	54	36
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819149373	GE	On-Demand	Bother	ADRB3	41	37
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819149373	GE	On-Demand	Bother	C3AR1	41	44
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819149374	GE	On-Demand	Bother	ADRB3	41	37
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819149374	GE	On-Demand	Bother	C3AR1	41	44
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819149375	GE	On-Demand	Bother	ADRB3	41	37
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819149375	GE	On-Demand	Bother	C3AR1	41	44
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819149376	GE	On-Demand	Bother	ADRB3	41	37
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819149376	GE	On-Demand	Bother	C3AR1	41	44
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819149377	GG	On-Demand	Anodyne	SIGMAR1	18	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819149377	GG	On-Demand	Anodyne	C3AR1	40	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819149377	GG	On-Demand	Anodyne	MLNR	27	44
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819149378	GG	On-Demand	Anodyne	SIGMAR1	18	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819149378	GG	On-Demand	Anodyne	C3AR1	40	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819149378	GG	On-Demand	Anodyne	MLNR	27	44
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819149379	GG	On-Demand	Anodyne	SIGMAR1	18	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819149379	GG	On-Demand	Anodyne	C3AR1	40	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819149379	GG	On-Demand	Anodyne	MLNR	27	44
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819149380	GG	On-Demand	Anodyne	SIGMAR1	18	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819149380	GG	On-Demand	Anodyne	C3AR1	40	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819149380	GG	On-Demand	Anodyne	MLNR	27	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccccc1OCCn1ccnc1	ZINC000819149383	GF	On-Demand	Anodyne	TNF	20	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccccc1OCCn1ccnc1	ZINC000819149383	GF	On-Demand	Anodyne	TBXAS1	20	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccccc1OCCn1ccnc1	ZINC000819149383	GF	On-Demand	Anodyne	MAPK14	20	40
O=[N+]([O-])c1ccc(Cl)c(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819149384	FG	On-Demand	Bother	ADRB2	22	48
O=[N+]([O-])c1ccc(Cl)c(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819149384	FG	On-Demand	Bother	ADRB1	55	37
O=[N+]([O-])c1ccc(Cl)c(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819149385	FG	On-Demand	Bother	ADRB2	22	48
O=[N+]([O-])c1ccc(Cl)c(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819149385	FG	On-Demand	Bother	ADRB1	55	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(F)cc1Br)C2	ZINC000819149386	GG	On-Demand	Anodyne	P2RX7	56	52
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(F)cc1Br)C2	ZINC000819149387	GG	On-Demand	Anodyne	P2RX7	56	52
O[C@@H](CNCCc1ccccc1OC(F)(F)F)c1ccc(F)cc1	ZINC000819149388	EH	On-Demand	Anodyne	ADRB2	48	45
O[C@@H](CNCCc1ccccc1OC(F)(F)F)c1ccc(F)cc1	ZINC000819149388	EH	On-Demand	Anodyne	ADRB3	43	41
O[C@H](CNCCc1ccccc1OC(F)(F)F)c1ccc(F)cc1	ZINC000819149389	EH	On-Demand	Anodyne	ADRB2	48	45
O[C@H](CNCCc1ccccc1OC(F)(F)F)c1ccc(F)cc1	ZINC000819149389	EH	On-Demand	Anodyne	ADRB3	43	41
COC(=O)c1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819149390	GF	On-Demand	Bother	ADRB2	35	42
COC(=O)c1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819149390	GF	On-Demand	Bother	ADRB1	60	42
COC(=O)c1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819149390	GF	On-Demand	Bother	GRIN1	30	43
COC(=O)c1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819149390	GF	On-Demand	Bother	ADRB3	39	42
COC(=O)c1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819149390	GF	On-Demand	Bother	CACNA1D	59	34
COC(=O)c1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819149391	GF	On-Demand	Bother	ADRB2	35	42
COC(=O)c1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819149391	GF	On-Demand	Bother	ADRB1	60	42
COC(=O)c1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819149391	GF	On-Demand	Bother	GRIN1	30	43
COC(=O)c1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819149391	GF	On-Demand	Bother	ADRB3	39	42
COC(=O)c1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819149391	GF	On-Demand	Bother	CACNA1D	59	34
CSc1cc(C)ccc1CNC[C@H](O)c1cccnc1	ZINC000819149392	CF	On-Demand	Anodyne	ADRB2	20	41
CSc1cc(C)ccc1CNC[C@H](O)c1cccnc1	ZINC000819149392	CF	On-Demand	Anodyne	ADRB1	21	41
CSc1cc(C)ccc1CNC[C@H](O)c1cccnc1	ZINC000819149392	CF	On-Demand	Anodyne	ADRB3	85	48
CSc1cc(C)ccc1CNC[C@@H](O)c1cccnc1	ZINC000819149393	CF	On-Demand	Anodyne	ADRB2	20	41
CSc1cc(C)ccc1CNC[C@@H](O)c1cccnc1	ZINC000819149393	CF	On-Demand	Anodyne	ADRB1	21	41
CSc1cc(C)ccc1CNC[C@@H](O)c1cccnc1	ZINC000819149393	CF	On-Demand	Anodyne	ADRB3	85	48
CC(=O)c1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819149426	GF	On-Demand	Bother	ADRB2	28	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819149426	GF	On-Demand	Bother	ADRB1	54	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819149426	GF	On-Demand	Bother	GRIN1	29	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819149426	GF	On-Demand	Bother	ADRB3	32	40
CC(=O)c1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819149427	GF	On-Demand	Bother	ADRB2	28	40
CC(=O)c1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819149427	GF	On-Demand	Bother	ADRB1	54	40
CC(=O)c1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819149427	GF	On-Demand	Bother	GRIN1	29	41
CC(=O)c1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819149427	GF	On-Demand	Bother	ADRB3	32	40
C[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)c1cccc(N2CCCC2)c1	ZINC000819149442	GG	On-Demand	Anodyne	KCNQ2	41	39
C[C@@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)c1cccc(N2CCCC2)c1	ZINC000819149446	GG	On-Demand	Anodyne	KCNQ2	41	39
CCOC(=O)[C@H](C)NC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819149455	DC	On-Demand	Anodyne	MTNR1A	39	45
CCOC(=O)[C@H](C)NC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819149455	DC	On-Demand	Anodyne	MTNR1B	39	45
CCOC(=O)[C@H](C)NC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819149456	DC	On-Demand	Anodyne	MTNR1A	39	45
CCOC(=O)[C@H](C)NC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819149456	DC	On-Demand	Anodyne	MTNR1B	39	45
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CCN(c2ncccc2F)C1	ZINC000819149475	FD	On-Demand	Anodyne	PRKCQ	40	30
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CCN(c2ncccc2F)C1	ZINC000819149476	FD	On-Demand	Anodyne	PRKCQ	40	30
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@H]1CCN(c2ncccc2F)C1	ZINC000819149477	FD	On-Demand	Anodyne	PRKCQ	40	30
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1CCN(c2ncccc2F)C1	ZINC000819149478	FD	On-Demand	Anodyne	PRKCQ	40	30
O=S(=O)(N1CCC(NC[C@@H](O)COCc2ccco2)CC1)C(F)(F)F	ZINC000819149515	GD	On-Demand	Anodyne	ADRB3	16	42
O=S(=O)(N1CCC(NC[C@H](O)COCc2ccco2)CC1)C(F)(F)F	ZINC000819149516	GD	On-Demand	Anodyne	ADRB3	16	42
O[C@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1cccc(Cl)c1	ZINC000819149522	EF	On-Demand	Anodyne	ADRB1	36	43
O[C@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1cccc(Cl)c1	ZINC000819149522	EF	On-Demand	Anodyne	ADRB3	57	46
O[C@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1cccc(Cl)c1	ZINC000819149522	EF	On-Demand	Anodyne	CYP3A4	48	39
O[C@H](CN[C@H]1CCN(c2ncccc2F)C1)c1cccc(Cl)c1	ZINC000819149523	EF	On-Demand	Anodyne	ADRB1	36	43
O[C@H](CN[C@H]1CCN(c2ncccc2F)C1)c1cccc(Cl)c1	ZINC000819149523	EF	On-Demand	Anodyne	ADRB3	57	46
O[C@H](CN[C@H]1CCN(c2ncccc2F)C1)c1cccc(Cl)c1	ZINC000819149523	EF	On-Demand	Anodyne	CYP3A4	48	39
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1cccc(Cl)c1	ZINC000819149524	EF	On-Demand	Anodyne	ADRB1	36	43
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1cccc(Cl)c1	ZINC000819149524	EF	On-Demand	Anodyne	ADRB3	57	46
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1cccc(Cl)c1	ZINC000819149524	EF	On-Demand	Anodyne	CYP3A4	48	39
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1cccc(Cl)c1	ZINC000819149525	EF	On-Demand	Anodyne	ADRB1	36	43
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1cccc(Cl)c1	ZINC000819149525	EF	On-Demand	Anodyne	ADRB3	57	46
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1cccc(Cl)c1	ZINC000819149525	EF	On-Demand	Anodyne	CYP3A4	48	39
C[C@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149539	GG	On-Demand	Mild	KLK3	60	34
C[C@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149539	GG	On-Demand	Mild	PAPA1_CARPA	73	65
C[C@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149539	GG	On-Demand	Mild	CCKAR	54	39
C[C@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149539	GG	On-Demand	Mild	CTSK	32	44
C[C@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149539	GG	On-Demand	Mild	CTSL	30	65
C[C@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149539	GG	On-Demand	Mild	CAPNS1	46	30
C[C@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149539	GG	On-Demand	Mild	REN	45	40
C[C@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149539	GG	On-Demand	Mild	CTSS	19	65
C[C@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149539	GG	On-Demand	Mild	CAPN1	26	43
C[C@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149539	GG	On-Demand	Mild	SCN10A	15	40
C[C@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149539	GG	On-Demand	Mild	FPR1	55	48
C[C@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149540	GG	On-Demand	Mild	KLK3	60	34
C[C@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149540	GG	On-Demand	Mild	PAPA1_CARPA	73	65
C[C@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149540	GG	On-Demand	Mild	CCKAR	54	39
C[C@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149540	GG	On-Demand	Mild	CTSK	32	44
C[C@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149540	GG	On-Demand	Mild	CTSL	30	65
C[C@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149540	GG	On-Demand	Mild	CAPNS1	46	30
C[C@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149540	GG	On-Demand	Mild	REN	45	40
C[C@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149540	GG	On-Demand	Mild	CTSS	19	65
C[C@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149540	GG	On-Demand	Mild	CAPN1	26	43
C[C@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149540	GG	On-Demand	Mild	SCN10A	15	40
C[C@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149540	GG	On-Demand	Mild	FPR1	55	48
C[C@@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149541	GG	On-Demand	Mild	KLK3	60	34
C[C@@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149541	GG	On-Demand	Mild	PAPA1_CARPA	73	65
C[C@@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149541	GG	On-Demand	Mild	CCKAR	54	39
C[C@@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149541	GG	On-Demand	Mild	CTSK	32	44
C[C@@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149541	GG	On-Demand	Mild	CTSL	30	65
C[C@@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149541	GG	On-Demand	Mild	CAPNS1	46	30
C[C@@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149541	GG	On-Demand	Mild	REN	45	40
C[C@@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149541	GG	On-Demand	Mild	CTSS	19	65
C[C@@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149541	GG	On-Demand	Mild	CAPN1	26	43
C[C@@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149541	GG	On-Demand	Mild	SCN10A	15	40
C[C@@H](Cc1ccccc1F)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149541	GG	On-Demand	Mild	FPR1	55	48
C[C@@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149542	GG	On-Demand	Mild	KLK3	60	34
C[C@@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149542	GG	On-Demand	Mild	PAPA1_CARPA	73	65
C[C@@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149542	GG	On-Demand	Mild	CCKAR	54	39
C[C@@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149542	GG	On-Demand	Mild	CTSK	32	44
C[C@@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149542	GG	On-Demand	Mild	CTSL	30	65
C[C@@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149542	GG	On-Demand	Mild	CAPNS1	46	30
C[C@@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149542	GG	On-Demand	Mild	REN	45	40
C[C@@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149542	GG	On-Demand	Mild	CTSS	19	65
C[C@@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149542	GG	On-Demand	Mild	CAPN1	26	43
C[C@@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149542	GG	On-Demand	Mild	SCN10A	15	40
C[C@@H](Cc1ccccc1F)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819149542	GG	On-Demand	Mild	FPR1	55	48
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)NCCc2ccccc2)cc1	ZINC000819149543	FG	On-Demand	Anodyne	TGM2	29	42
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)NCCc2ccccc2)cc1	ZINC000819149544	FG	On-Demand	Anodyne	TGM2	29	42
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)NCCc2ccccc2)cc1	ZINC000819149546	FG	On-Demand	Anodyne	TGM2	29	42
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)NCCc2ccccc2)cc1	ZINC000819149548	FG	On-Demand	Anodyne	TGM2	29	42
CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)NCCC(C)(C)C3CC3)ccc2F)CC1	ZINC000819149549	IE	On-Demand	Anodyne	CNR2	16	42
CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)NCCC(C)(C)C3CC3)ccc2F)CC1	ZINC000819149549	IE	On-Demand	Anodyne	CACNA1I	53	37
Cc1cc(C(=O)NCC(C)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)ccc1[N+](=O)[O-]	ZINC000819149560	HF	On-Demand	Bother	GSTM2	46	36
Cc1cc(C(=O)NCC(C)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)ccc1[N+](=O)[O-]	ZINC000819149560	HF	On-Demand	Bother	COLA	53	35
Cc1cc(C(=O)NCC(C)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)ccc1[N+](=O)[O-]	ZINC000819149560	HF	On-Demand	Bother	ITGAV	41	40
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	ACE	105	52
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	OPRM1	35	41
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	OPRD1	33	41
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	MME	213	57
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	LTA4H	16	45
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	ANPEP	113	52
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	TACR1	17	45
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	FCER2	102	41
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	RNPEP	36	43
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	CTSB	90	47
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	PAPA1_CARPA	82	47
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	CYSP_TRYCR	67	38
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	CTSF	46	34
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	CTSK	43	42
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	CTSL	71	47
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	CPA1	83	48
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	NPFFR2	47	37
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	TIMP3	52	37
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	CTRB1	34	45
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	NAALAD2	30	42
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	CAPNS1	71	39
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	MMP2	34	40
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	MMP3	52	42
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	MMP8	34	47
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	ECE1	53	43
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	HLA-DRB1	66	38
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	SOAT1	25	45
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	CTSS	35	47
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	CAPN1	117	51
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	MMP9	37	47
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	CTRC	18	40
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	CAPN2	125	44
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	ACE2	110	48
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	BACE1	24	40
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	LAP3	59	45
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	MMP1	48	43
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	FPR1	84	47
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	NPPA	21	44
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	NPR	96	41
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	AMP1_PLAFQ	71	45
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	PSMB5	27	41
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	BLA1_STEMA	75	40
C[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)CNC(=O)[C@H](C)Cc1ccccc1	ZINC000819149584	GH	On-Demand	Anodyne	NPFFR1	67	37
CCCCSCC(=O)NCCC(C)(C)C1CC1	ZINC000819149601	CG	On-Demand	Anodyne	CES1	17	40
CCCCSCC(=O)NCCC(C)(C)C1CC1	ZINC000819149601	CG	On-Demand	Anodyne	EST1_PIG	47	40
CCn1c(S)nc2cc(C(=O)NCCC(C)(C)C3CC3)ccc2c1=O	ZINC000819149605	FG	On-Demand	Anodyne	POLR1A	43	30
CC(CNC(=O)Cc1ccccc1CO)CNC(=O)Cc1ccccc1CO	ZINC000819149613	GD	On-Demand	Anodyne	ADRB2	35	40
CC(CNC(=O)c1cccc([N+](=O)[O-])c1)CNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000819149614	GE	On-Demand	Bother	DRD4	40	30
CC(CNC(=O)c1cccc([N+](=O)[O-])c1)CNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000819149614	GE	On-Demand	Bother	CACNA1C	58	39
CC(CNC(=O)c1cccc([N+](=O)[O-])c1)CNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000819149614	GE	On-Demand	Bother	CACNA1D	89	38
CC(CNC(=O)c1cccc([N+](=O)[O-])c1)CNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000819149614	GE	On-Demand	Bother	COLA	33	40
CC(CNC(=O)c1cccc([N+](=O)[O-])c1)CNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000819149614	GE	On-Demand	Bother	IRAK4	15	41
CCC(=O)N[C@@H](C)C(=O)NC[C@H](C)CNC(=O)[C@@H](C)NC(=O)CC	ZINC000819149622	EB	On-Demand	Anodyne	PGA	49	40
CCC(=O)N[C@@H](C)C(=O)NCC(C)CNC(=O)[C@H](C)NC(=O)CC	ZINC000819149623	EB	On-Demand	Anodyne	PGA	49	40
CCC(=O)N[C@H](C)C(=O)NCC(C)CNC(=O)[C@@H](C)NC(=O)CC	ZINC000819149624	EB	On-Demand	Anodyne	PGA	49	40
O=C(NOCCCO)c1ccc2ccccc2n1	ZINC000819149628	BD	On-Demand	Anodyne	CYSLTR1	18	41
CC(CNC(=O)C[C@H](O)C(C)C)CNC(=O)C[C@H](O)C(C)C	ZINC000819149638	DC	On-Demand	Anodyne	PGA	44	35
CC(CNC(=O)C[C@@H](O)C(C)C)CNC(=O)C[C@@H](O)C(C)C	ZINC000819149639	DC	On-Demand	Anodyne	PGA	44	35
O[C@@H](CNCCCO[C@@H]1CCOC1)c1cccc2ccccc12	ZINC000819149649	DF	On-Demand	Anodyne	ADRB2	36	40
O[C@@H](CNCCCO[C@@H]1CCOC1)c1cccc2ccccc12	ZINC000819149649	DF	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CNCCCO[C@H]1CCOC1)c1cccc2ccccc12	ZINC000819149650	DF	On-Demand	Anodyne	ADRB2	36	40
O[C@@H](CNCCCO[C@H]1CCOC1)c1cccc2ccccc12	ZINC000819149650	DF	On-Demand	Anodyne	ADRB1	20	40
N#Cc1ccc([C@H](O)CN[C@H]2CCN(C(=O)CCc3ccccc3)C2)cc1	ZINC000819149683	FE	On-Demand	Mild	ADRB3	22	46
N#Cc1ccc([C@H](O)CN[C@H]2CCN(C(=O)CCc3ccccc3)C2)cc1	ZINC000819149683	FE	On-Demand	Mild	C3AR1	41	41
N#Cc1ccc([C@H](O)CN[C@H]2CCN(C(=O)CCc3ccccc3)C2)cc1	ZINC000819149683	FE	On-Demand	Mild	CTRB_BOVIN	46	34
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(C(=O)CCc3ccccc3)C2)cc1	ZINC000819149684	FE	On-Demand	Mild	ADRB3	22	46
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(C(=O)CCc3ccccc3)C2)cc1	ZINC000819149684	FE	On-Demand	Mild	C3AR1	41	41
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(C(=O)CCc3ccccc3)C2)cc1	ZINC000819149684	FE	On-Demand	Mild	CTRB_BOVIN	46	34
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(C(=O)CCc3ccccc3)C2)cc1	ZINC000819149685	FE	On-Demand	Mild	ADRB3	22	46
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(C(=O)CCc3ccccc3)C2)cc1	ZINC000819149685	FE	On-Demand	Mild	C3AR1	41	41
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(C(=O)CCc3ccccc3)C2)cc1	ZINC000819149685	FE	On-Demand	Mild	CTRB_BOVIN	46	34
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(C(=O)CCc3ccccc3)C2)cc1	ZINC000819149686	FE	On-Demand	Mild	ADRB3	22	46
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(C(=O)CCc3ccccc3)C2)cc1	ZINC000819149686	FE	On-Demand	Mild	C3AR1	41	41
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(C(=O)CCc3ccccc3)C2)cc1	ZINC000819149686	FE	On-Demand	Mild	CTRB_BOVIN	46	34
CSc1cc(C)ccc1CNC[C@H](O)c1ccccc1	ZINC000819149693	CH	On-Demand	Anodyne	CCR2	18	40
CSc1cc(C)ccc1CNC[C@H](O)c1ccccc1	ZINC000819149693	CH	On-Demand	Anodyne	AOC3	15	45
CSc1cc(C)ccc1CNC[C@@H](O)c1ccccc1	ZINC000819149694	CH	On-Demand	Anodyne	CCR2	18	40
CSc1cc(C)ccc1CNC[C@@H](O)c1ccccc1	ZINC000819149694	CH	On-Demand	Anodyne	AOC3	15	45
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819149720	FG	On-Demand	Anodyne	OPRL1	26	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819149720	FG	On-Demand	Anodyne	SIGMAR1	22	43
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819149720	FG	On-Demand	Anodyne	C3AR1	41	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819149721	FG	On-Demand	Anodyne	OPRL1	26	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819149721	FG	On-Demand	Anodyne	SIGMAR1	22	43
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819149721	FG	On-Demand	Anodyne	C3AR1	41	41
CCOC(=O)CC[C@@H](O)CNCc1cc([N+](=O)[O-])ccc1Cl	ZINC000819149726	EE	On-Demand	Bother	CACNA1D	60	34
CCOC(=O)CC[C@H](O)CNCc1cc([N+](=O)[O-])ccc1Cl	ZINC000819149727	EE	On-Demand	Bother	CACNA1D	60	34
O=C(CCc1ccccc1)N1CC[C@@H](NCC2(O)CCCCC2)C1	ZINC000819149743	EF	On-Demand	Anodyne	GRIN2B	19	44
O=C(CCc1ccccc1)N1CC[C@@H](NCC2(O)CCCCC2)C1	ZINC000819149743	EF	On-Demand	Anodyne	C3AR1	46	45
O=C(CCc1ccccc1)N1CC[C@@H](NCC2(O)CCCCC2)C1	ZINC000819149743	EF	On-Demand	Anodyne	PREP	44	37
O=C(CCc1ccccc1)N1CC[C@@H](NCC2(O)CCCCC2)C1	ZINC000819149743	EF	On-Demand	Anodyne	BIRC2	19	40
O=C(CCc1ccccc1)N1CC[C@H](NCC2(O)CCCCC2)C1	ZINC000819149744	EF	On-Demand	Anodyne	GRIN2B	19	44
O=C(CCc1ccccc1)N1CC[C@H](NCC2(O)CCCCC2)C1	ZINC000819149744	EF	On-Demand	Anodyne	C3AR1	46	45
O=C(CCc1ccccc1)N1CC[C@H](NCC2(O)CCCCC2)C1	ZINC000819149744	EF	On-Demand	Anodyne	PREP	44	37
O=C(CCc1ccccc1)N1CC[C@H](NCC2(O)CCCCC2)C1	ZINC000819149744	EF	On-Demand	Anodyne	BIRC2	19	40
COc1ccc(OC(F)F)c(CNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819149756	GG	On-Demand	Anodyne	MTNR1A	21	44
COc1ccc(OC(F)F)c(CNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819149756	GG	On-Demand	Anodyne	MTNR1B	27	44
CC(CNC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1)CNC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1	ZINC000819149787	ID	On-Demand	Anodyne	INHA	23	51
CC(CNC(=O)[C@H]1CC(=O)N(C2CCCC2)C1)CNC(=O)[C@H]1CC(=O)N(C2CCCC2)C1	ZINC000819149789	ID	On-Demand	Anodyne	INHA	23	51
CC(C)(C)OC(=O)NCc1cccc(C(=O)NCCC(C)(C)C2CC2)c1	ZINC000819149795	FI	On-Demand	Anodyne	DRD4	44	34
O[C@@H](CNC[C@H]1CCCS1)c1cccnc1	ZINC000819149812	BD	On-Demand	Anodyne	ADRB2	25	42
O[C@@H](CNC[C@H]1CCCS1)c1cccnc1	ZINC000819149812	BD	On-Demand	Anodyne	ADRB1	26	45
O[C@@H](CNC[C@H]1CCCS1)c1cccnc1	ZINC000819149812	BD	On-Demand	Anodyne	ADRB3	101	47
O[C@H](CNC[C@@H]1CCCS1)c1cccnc1	ZINC000819149814	BD	On-Demand	Anodyne	ADRB2	25	42
O[C@H](CNC[C@@H]1CCCS1)c1cccnc1	ZINC000819149814	BD	On-Demand	Anodyne	ADRB1	26	45
O[C@H](CNC[C@@H]1CCCS1)c1cccnc1	ZINC000819149814	BD	On-Demand	Anodyne	ADRB3	101	47
O[C@@H](CNC[C@@H]1CCCS1)c1cccnc1	ZINC000819149815	BD	On-Demand	Anodyne	ADRB2	25	42
O[C@@H](CNC[C@@H]1CCCS1)c1cccnc1	ZINC000819149815	BD	On-Demand	Anodyne	ADRB1	26	45
O[C@@H](CNC[C@@H]1CCCS1)c1cccnc1	ZINC000819149815	BD	On-Demand	Anodyne	ADRB3	101	47
CC(CNC(=O)c1nc(Cl)ccc1F)CNC(=O)c1nc(Cl)ccc1F	ZINC000819149816	HF	On-Demand	Anodyne	ALPL	40	41
O[C@H](CNC[C@H]1CCCS1)c1cccnc1	ZINC000819149817	BD	On-Demand	Anodyne	ADRB2	25	42
O[C@H](CNC[C@H]1CCCS1)c1cccnc1	ZINC000819149817	BD	On-Demand	Anodyne	ADRB1	26	45
O[C@H](CNC[C@H]1CCCS1)c1cccnc1	ZINC000819149817	BD	On-Demand	Anodyne	ADRB3	101	47
O[C@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819149825	FG	On-Demand	Anodyne	LIPG	34	40
O[C@H](CN[C@H]1CCN(c2ncccc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819149830	FG	On-Demand	Anodyne	LIPG	34	40
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819149832	FG	On-Demand	Anodyne	LIPG	34	40
CC(CNC(=O)/C=C/c1cccnc1)CNC(=O)/C=C/c1cccnc1	ZINC000819149833	FE	On-Demand	Anodyne	TBXAS1	21	43
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819149834	FG	On-Demand	Anodyne	LIPG	34	40
CC(CNC(=O)/C=C\c1cccnc1)CNC(=O)/C=C/c1cccnc1	ZINC000819149835	FE	On-Demand	Anodyne	TBXAS1	21	43
CC(CNC(=O)/C=C\c1cccnc1)CNC(=O)/C=C\c1cccnc1	ZINC000819149837	FE	On-Demand	Anodyne	TBXAS1	21	43
CCCCCOc1cc(C)ccc1CNCCS(C)(=O)=O	ZINC000819149858	DF	On-Demand	Anodyne	LPAR2	49	39
CCCCCOc1cc(C)ccc1CNCCS(C)(=O)=O	ZINC000819149858	DF	On-Demand	Anodyne	S1PR2	48	39
O[C@H](CNC[C@H]1CCCS1)c1cccc(Cl)c1	ZINC000819149863	CF	On-Demand	Anodyne	ADRB1	39	44
O[C@H](CNC[C@H]1CCCS1)c1cccc(Cl)c1	ZINC000819149863	CF	On-Demand	Anodyne	ADRB3	51	44
O[C@@H](CNC[C@H]1CCCS1)c1cccc(Cl)c1	ZINC000819149865	CF	On-Demand	Anodyne	ADRB1	39	44
O[C@@H](CNC[C@H]1CCCS1)c1cccc(Cl)c1	ZINC000819149865	CF	On-Demand	Anodyne	ADRB3	51	44
O[C@H](CNC[C@@H]1CCCS1)c1cccc(Cl)c1	ZINC000819149867	CF	On-Demand	Anodyne	ADRB1	39	44
O[C@H](CNC[C@@H]1CCCS1)c1cccc(Cl)c1	ZINC000819149867	CF	On-Demand	Anodyne	ADRB3	51	44
O[C@@H](CNC[C@@H]1CCCS1)c1cccc(Cl)c1	ZINC000819149868	CF	On-Demand	Anodyne	ADRB1	39	44
O[C@@H](CNC[C@@H]1CCCS1)c1cccc(Cl)c1	ZINC000819149868	CF	On-Demand	Anodyne	ADRB3	51	44
COc1cccc(C(=O)NCC(C)CNC(=O)c2cccc(OC)c2[N+](=O)[O-])c1[N+](=O)[O-]	ZINC000819149875	IE	On-Demand	Bother	KCNA3	39	50
COc1cccc(C(=O)NCC(C)CNC(=O)c2cccc(OC)c2[N+](=O)[O-])c1[N+](=O)[O-]	ZINC000819149875	IE	On-Demand	Bother	HCN1	40	37
COc1cccc(C(=O)NCC(C)CNC(=O)c2cccc(OC)c2[N+](=O)[O-])c1[N+](=O)[O-]	ZINC000819149875	IE	On-Demand	Bother	KCNK3	45	40
COc1cccc(C(=O)NCC(C)CNC(=O)c2cccc(OC)c2[N+](=O)[O-])c1[N+](=O)[O-]	ZINC000819149875	IE	On-Demand	Bother	KCNK9	39	40
O[C@@H](CNCCCO[C@H]1CCOC1)c1cccnc1	ZINC000819149881	CC	On-Demand	Anodyne	ADRB2	36	47
O[C@@H](CNCCCO[C@H]1CCOC1)c1cccnc1	ZINC000819149881	CC	On-Demand	Anodyne	ADRB1	39	47
O[C@@H](CNCCCO[C@H]1CCOC1)c1cccnc1	ZINC000819149881	CC	On-Demand	Anodyne	ADRB3	102	49
O[C@@H](CNCCCO[C@@H]1CCOC1)c1cccnc1	ZINC000819149882	CC	On-Demand	Anodyne	ADRB2	36	47
O[C@@H](CNCCCO[C@@H]1CCOC1)c1cccnc1	ZINC000819149882	CC	On-Demand	Anodyne	ADRB1	39	47
O[C@@H](CNCCCO[C@@H]1CCOC1)c1cccnc1	ZINC000819149882	CC	On-Demand	Anodyne	ADRB3	102	49
O[C@H](CNCCCO[C@H]1CCOC1)c1cccnc1	ZINC000819149884	CC	On-Demand	Anodyne	ADRB2	36	47
O[C@H](CNCCCO[C@H]1CCOC1)c1cccnc1	ZINC000819149884	CC	On-Demand	Anodyne	ADRB1	39	47
O[C@H](CNCCCO[C@H]1CCOC1)c1cccnc1	ZINC000819149884	CC	On-Demand	Anodyne	ADRB3	102	49
O[C@H](CNCCCO[C@@H]1CCOC1)c1cccnc1	ZINC000819149885	CC	On-Demand	Anodyne	ADRB2	36	47
O[C@H](CNCCCO[C@@H]1CCOC1)c1cccnc1	ZINC000819149885	CC	On-Demand	Anodyne	ADRB1	39	47
O[C@H](CNCCCO[C@@H]1CCOC1)c1cccnc1	ZINC000819149885	CC	On-Demand	Anodyne	ADRB3	102	49
O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)C(F)=C1CCC1	ZINC000819149886	GF	On-Demand	Clean	NPY2R	56	35
COc1cccc(C(=O)NCC(C)CNC(=O)c2cccc(OC)n2)n1	ZINC000819149896	FD	On-Demand	Anodyne	ALS	81	35
CC(CNC(=O)c1cc(Cl)ccc1Cl)CNC(=O)c1cc(Cl)ccc1Cl	ZINC000819149900	IK	On-Demand	Anodyne	CNR1	17	40
CC(CNC(=O)c1cc(Cl)ccc1Cl)CNC(=O)c1cc(Cl)ccc1Cl	ZINC000819149900	IK	On-Demand	Anodyne	P2RX7	35	50
CC(CNC(=O)c1cc(Cl)ccc1Cl)CNC(=O)c1cc(Cl)ccc1Cl	ZINC000819149900	IK	On-Demand	Anodyne	ALPL	68	53
O[C@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccc(F)c(F)c1	ZINC000819149909	EE	On-Demand	Anodyne	PRKCQ	40	30
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccc(F)c(F)c1	ZINC000819149912	EE	On-Demand	Anodyne	PRKCQ	40	30
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819149913	EH	On-Demand	Anodyne	PAPA1_CARPA	39	60
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819149913	EH	On-Demand	Anodyne	CTSK	22	44
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819149913	EH	On-Demand	Anodyne	PGA5	23	42
O[C@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccc(F)c(F)c1	ZINC000819149914	EE	On-Demand	Anodyne	PRKCQ	40	30
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccc(F)c(F)c1	ZINC000819149916	EE	On-Demand	Anodyne	PRKCQ	40	30
O=S(=O)(N1CCC(NC[C@@H](O)Cc2ccccc2)CC1)C(F)(F)F	ZINC000819149918	FD	On-Demand	Anodyne	SFRP1	121	37
O=S(=O)(N1CCC(NC[C@@H](O)Cc2ccccc2)CC1)C(F)(F)F	ZINC000819149918	FD	On-Demand	Anodyne	WNT3	79	35
O=S(=O)(N1CCC(NC[C@H](O)Cc2ccccc2)CC1)C(F)(F)F	ZINC000819149919	FD	On-Demand	Anodyne	SFRP1	121	37
O=S(=O)(N1CCC(NC[C@H](O)Cc2ccccc2)CC1)C(F)(F)F	ZINC000819149919	FD	On-Demand	Anodyne	WNT3	79	35
O=[N+]([O-])c1cccc([C@H](O)CNC2CCN(S(=O)(=O)C(F)(F)F)CC2)c1	ZINC000819149920	GD	On-Demand	Bother	ADRB3	27	41
O=[N+]([O-])c1cccc([C@H](O)CNC2CCN(S(=O)(=O)C(F)(F)F)CC2)c1	ZINC000819149920	GD	On-Demand	Bother	SFRP1	57	34
O=[N+]([O-])c1cccc([C@@H](O)CNC2CCN(S(=O)(=O)C(F)(F)F)CC2)c1	ZINC000819149921	GD	On-Demand	Bother	ADRB3	27	41
O=[N+]([O-])c1cccc([C@@H](O)CNC2CCN(S(=O)(=O)C(F)(F)F)CC2)c1	ZINC000819149921	GD	On-Demand	Bother	SFRP1	57	34
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C\c1ccccc1	ZINC000819149935	EG	On-Demand	Anodyne	HDAC8	68	42
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C\c1ccccc1	ZINC000819149935	EG	On-Demand	Anodyne	HDAC10	16	40
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C\c1ccccc1	ZINC000819149935	EG	On-Demand	Anodyne	F3	25	48
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C\c1ccccc1	ZINC000819149935	EG	On-Demand	Anodyne	MMP2	19	61
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C\c1ccccc1	ZINC000819149935	EG	On-Demand	Anodyne	HDAC1	44	43
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C\c1ccccc1	ZINC000819149935	EG	On-Demand	Anodyne	HDAC2	25	58
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C\c1ccccc1	ZINC000819149935	EG	On-Demand	Anodyne	HDAC3	21	43
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C\c1ccccc1	ZINC000819149935	EG	On-Demand	Anodyne	HDAC4	25	43
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C\c1ccccc1	ZINC000819149935	EG	On-Demand	Anodyne	HDAC6	42	58
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C\c1ccccc1	ZINC000819149935	EG	On-Demand	Anodyne	MMP9	17	61
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C\c1ccccc1	ZINC000819149935	EG	On-Demand	Anodyne	HDAC9	38	43
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C\c1ccccc1	ZINC000819149935	EG	On-Demand	Anodyne	HDAC7	49	43
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149936	EG	On-Demand	Anodyne	HDAC8	68	42
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149936	EG	On-Demand	Anodyne	HDAC10	16	40
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149936	EG	On-Demand	Anodyne	F3	25	48
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149936	EG	On-Demand	Anodyne	MMP2	19	61
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149936	EG	On-Demand	Anodyne	HDAC1	44	43
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149936	EG	On-Demand	Anodyne	HDAC2	25	58
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149936	EG	On-Demand	Anodyne	HDAC3	21	43
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149936	EG	On-Demand	Anodyne	HDAC4	25	43
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149936	EG	On-Demand	Anodyne	HDAC6	42	58
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149936	EG	On-Demand	Anodyne	MMP9	17	61
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149936	EG	On-Demand	Anodyne	HDAC9	38	43
CC(CNC(=O)/C=C\c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149936	EG	On-Demand	Anodyne	HDAC7	49	43
CC(CNC(=O)/C=C/c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149937	EG	On-Demand	Anodyne	HDAC8	68	42
CC(CNC(=O)/C=C/c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149937	EG	On-Demand	Anodyne	HDAC10	16	40
CC(CNC(=O)/C=C/c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149937	EG	On-Demand	Anodyne	F3	25	48
CC(CNC(=O)/C=C/c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149937	EG	On-Demand	Anodyne	MMP2	19	61
CC(CNC(=O)/C=C/c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149937	EG	On-Demand	Anodyne	HDAC1	44	43
CC(CNC(=O)/C=C/c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149937	EG	On-Demand	Anodyne	HDAC2	25	58
CC(CNC(=O)/C=C/c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149937	EG	On-Demand	Anodyne	HDAC3	21	43
CC(CNC(=O)/C=C/c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149937	EG	On-Demand	Anodyne	HDAC4	25	43
CC(CNC(=O)/C=C/c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149937	EG	On-Demand	Anodyne	HDAC6	42	58
CC(CNC(=O)/C=C/c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149937	EG	On-Demand	Anodyne	MMP9	17	61
CC(CNC(=O)/C=C/c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149937	EG	On-Demand	Anodyne	HDAC9	38	43
CC(CNC(=O)/C=C/c1ccccc1)CNC(=O)/C=C/c1ccccc1	ZINC000819149937	EG	On-Demand	Anodyne	HDAC7	49	43
CC(CNC(=O)Cc1c[nH]c2ccc(F)cc12)CNC(=O)Cc1c[nH]c2ccc(F)cc12	ZINC000819149941	IH	On-Demand	Anodyne	HTR1A	19	40
CC(CNC(=O)Cc1c[nH]c2ccc(F)cc12)CNC(=O)Cc1c[nH]c2ccc(F)cc12	ZINC000819149941	IH	On-Demand	Anodyne	HTR1D	43	39
CC(CNC(=O)Cc1c[nH]c2ccc(F)cc12)CNC(=O)Cc1c[nH]c2ccc(F)cc12	ZINC000819149941	IH	On-Demand	Anodyne	SLC6A4	26	54
CC(CNC(=O)Cc1c[nH]c2ccc(F)cc12)CNC(=O)Cc1c[nH]c2ccc(F)cc12	ZINC000819149941	IH	On-Demand	Anodyne	MPO	115	57
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819149959	GE	On-Demand	Bother	C3AR1	42	51
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819149959	GE	On-Demand	Bother	SSTR1	17	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819149960	GE	On-Demand	Bother	C3AR1	42	51
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819149960	GE	On-Demand	Bother	SSTR1	17	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819149961	GE	On-Demand	Bother	C3AR1	42	51
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819149961	GE	On-Demand	Bother	SSTR1	17	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819149962	GE	On-Demand	Bother	C3AR1	42	51
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819149962	GE	On-Demand	Bother	SSTR1	17	40
CS(=O)(=O)c1ccc([C@H](O)CNCCCO[C@@H]2CCOC2)cc1	ZINC000819149973	EC	On-Demand	Anodyne	ADRB2	32	49
CS(=O)(=O)c1ccc([C@H](O)CNCCCO[C@@H]2CCOC2)cc1	ZINC000819149973	EC	On-Demand	Anodyne	ADRB1	24	40
CS(=O)(=O)c1ccc([C@H](O)CNCCCO[C@@H]2CCOC2)cc1	ZINC000819149973	EC	On-Demand	Anodyne	ADRB3	32	40
CS(=O)(=O)c1ccc([C@H](O)CNCCCO[C@H]2CCOC2)cc1	ZINC000819149974	EC	On-Demand	Anodyne	ADRB2	32	49
CS(=O)(=O)c1ccc([C@H](O)CNCCCO[C@H]2CCOC2)cc1	ZINC000819149974	EC	On-Demand	Anodyne	ADRB1	24	40
CS(=O)(=O)c1ccc([C@H](O)CNCCCO[C@H]2CCOC2)cc1	ZINC000819149974	EC	On-Demand	Anodyne	ADRB3	32	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCCO[C@H]2CCOC2)cc1	ZINC000819149975	EC	On-Demand	Anodyne	ADRB2	32	49
CS(=O)(=O)c1ccc([C@@H](O)CNCCCO[C@H]2CCOC2)cc1	ZINC000819149975	EC	On-Demand	Anodyne	ADRB1	24	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCCO[C@H]2CCOC2)cc1	ZINC000819149975	EC	On-Demand	Anodyne	ADRB3	32	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCCO[C@@H]2CCOC2)cc1	ZINC000819149976	EC	On-Demand	Anodyne	ADRB2	32	49
CS(=O)(=O)c1ccc([C@@H](O)CNCCCO[C@@H]2CCOC2)cc1	ZINC000819149976	EC	On-Demand	Anodyne	ADRB1	24	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCCO[C@@H]2CCOC2)cc1	ZINC000819149976	EC	On-Demand	Anodyne	ADRB3	32	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819150005	FF	On-Demand	Anodyne	ADRB1	25	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819150005	FF	On-Demand	Anodyne	ADRB3	38	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819150005	FF	On-Demand	Anodyne	C3AR1	43	44
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819150005	FF	On-Demand	Anodyne	MLNR	23	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819150006	FF	On-Demand	Anodyne	ADRB1	25	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819150006	FF	On-Demand	Anodyne	ADRB3	38	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819150006	FF	On-Demand	Anodyne	C3AR1	43	44
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819150006	FF	On-Demand	Anodyne	MLNR	23	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819150007	FF	On-Demand	Anodyne	ADRB1	25	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819150007	FF	On-Demand	Anodyne	ADRB3	38	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819150007	FF	On-Demand	Anodyne	C3AR1	43	44
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819150007	FF	On-Demand	Anodyne	MLNR	23	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819150008	FF	On-Demand	Anodyne	ADRB1	25	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819150008	FF	On-Demand	Anodyne	ADRB3	38	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819150008	FF	On-Demand	Anodyne	C3AR1	43	44
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819150008	FF	On-Demand	Anodyne	MLNR	23	42
CCC(=O)c1cc(Cl)ccc1OCc1cc(=O)oc2cc(NC(C)=O)ccc12	ZINC000819150010	GJ	On-Demand	Anodyne	MAOB	30	42
Cc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150029	FG	On-Demand	Bother	ADRB2	34	44
Cc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150029	FG	On-Demand	Bother	ADRB1	50	41
Cc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150029	FG	On-Demand	Bother	GRIN1	29	43
Cc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150029	FG	On-Demand	Bother	ADRB3	32	41
Cc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150030	FG	On-Demand	Bother	ADRB2	34	44
Cc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150030	FG	On-Demand	Bother	ADRB1	50	41
Cc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150030	FG	On-Demand	Bother	GRIN1	29	43
Cc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150030	FG	On-Demand	Bother	ADRB3	32	41
C=CCCn1cc(C(=O)NCc2ccc(N3CCOCC3)cc2)nn1	ZINC000819150041	ED	On-Demand	Mild	STAT6	57	36
CON(C)C(=O)CCN[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000819150044	ED	On-Demand	Anodyne	GRIN2B	22	44
CON(C)C(=O)CCN[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000819150045	ED	On-Demand	Anodyne	GRIN2B	22	44
O[C@@H](CNCCc1ccccc1OC(F)(F)F)c1cccnc1	ZINC000819150046	EF	On-Demand	Anodyne	ADRB2	47	47
O[C@@H](CNCCc1ccccc1OC(F)(F)F)c1cccnc1	ZINC000819150046	EF	On-Demand	Anodyne	ADRB1	48	46
O[C@@H](CNCCc1ccccc1OC(F)(F)F)c1cccnc1	ZINC000819150046	EF	On-Demand	Anodyne	ADRB3	127	48
O[C@H](CN[C@H]1CCN(c2ncccc2F)C1)c1cccnc1	ZINC000819150069	DD	On-Demand	Anodyne	ADRB3	59	51
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1cccnc1	ZINC000819150070	DD	On-Demand	Anodyne	ADRB3	59	51
O[C@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1cccnc1	ZINC000819150071	DD	On-Demand	Anodyne	ADRB3	59	51
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1cccnc1	ZINC000819150072	DD	On-Demand	Anodyne	ADRB3	59	51
CCOC(=O)[C@H](C)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819150078	DC	On-Demand	Anodyne	PAPA1_CARPA	17	40
CCOC(=O)[C@H](C)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819150078	DC	On-Demand	Anodyne	CTSK	17	40
CCOC(=O)[C@H](C)NC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819150082	GD	On-Demand	Anodyne	SSTR2	53	34
CCOC(=O)[C@H](C)NC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819150083	GD	On-Demand	Anodyne	SSTR2	53	34
CCOC(=O)[C@H](C)NC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819150110	CD	On-Demand	Anodyne	INHA	18	40
CCOC(=O)[C@H](C)NC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819150110	CD	On-Demand	Anodyne	LTA4H	17	40
CCOC(=O)[C@H](C)NC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819150110	CD	On-Demand	Anodyne	NPR1	49	32
CCOC(=O)[C@H](C)NC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819150110	CD	On-Demand	Anodyne	PAPA1_CARPA	17	40
CCOC(=O)[C@H](C)NC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819150110	CD	On-Demand	Anodyne	MMP3	18	41
CCOC(=O)[C@H](C)NC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819150110	CD	On-Demand	Anodyne	HLA-DRB1	55	34
CCOC(=O)[C@H](C)NC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819150110	CD	On-Demand	Anodyne	CAPN2	41	33
CCOC(=O)[C@H](C)NC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819150110	CD	On-Demand	Anodyne	KCNK3	51	33
CCOC(=O)[C@H](C)NC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819150110	CD	On-Demand	Anodyne	KCNK9	48	33
O[C@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccc(F)cc1Cl	ZINC000819150120	FF	On-Demand	Anodyne	PRKCQ	40	33
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccc(F)cc1Cl	ZINC000819150121	FF	On-Demand	Anodyne	PRKCQ	40	33
O[C@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccc(F)cc1Cl	ZINC000819150122	FF	On-Demand	Anodyne	PRKCQ	40	33
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccc(F)cc1Cl	ZINC000819150123	FF	On-Demand	Anodyne	PRKCQ	40	33
COc1cccc([C@H](O)C(=O)NCCC(C)(C)C2CC2)c1	ZINC000819150159	CF	On-Demand	Anodyne	DRD4	44	34
COc1cccc([C@H](O)C(=O)NCCC(C)(C)C2CC2)c1	ZINC000819150159	CF	On-Demand	Anodyne	MTNR1A	57	41
COc1cccc([C@H](O)C(=O)NCCC(C)(C)C2CC2)c1	ZINC000819150159	CF	On-Demand	Anodyne	MTNR1B	51	41
CCC(=O)c1cc(C(=O)NCC(C)CNC(=O)c2ccc(F)c(C(=O)CC)c2)ccc1F	ZINC000819150161	IH	On-Demand	Anodyne	F3	79	35
COC(=O)N[C@H](CC(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819150163	CF	On-Demand	Anodyne	PAPA1_CARPA	42	40
COC(=O)N[C@H](CC(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819150163	CF	On-Demand	Anodyne	CTSK	37	52
COC(=O)N[C@H](CC(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819150163	CF	On-Demand	Anodyne	CTSL	31	42
COC(=O)N[C@H](CC(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819150163	CF	On-Demand	Anodyne	CAPNS1	44	33
COC(=O)N[C@H](CC(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819150163	CF	On-Demand	Anodyne	REN	22	43
COC(=O)N[C@H](CC(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819150163	CF	On-Demand	Anodyne	CTSS	25	52
COC(=O)N[C@H](CC(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819150163	CF	On-Demand	Anodyne	CAPN1	60	47
COC(=O)N[C@H](CC(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819150163	CF	On-Demand	Anodyne	CAPN2	75	36
COC(=O)N[C@H](CC(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819150163	CF	On-Demand	Anodyne	FPR1	48	40
COC(=O)N[C@@H](CC(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819150164	CF	On-Demand	Anodyne	PAPA1_CARPA	42	40
COC(=O)N[C@@H](CC(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819150164	CF	On-Demand	Anodyne	CTSK	37	52
COC(=O)N[C@@H](CC(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819150164	CF	On-Demand	Anodyne	CTSL	31	42
COC(=O)N[C@@H](CC(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819150164	CF	On-Demand	Anodyne	CAPNS1	44	33
COC(=O)N[C@@H](CC(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819150164	CF	On-Demand	Anodyne	REN	22	43
COC(=O)N[C@@H](CC(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819150164	CF	On-Demand	Anodyne	CTSS	25	52
COC(=O)N[C@@H](CC(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819150164	CF	On-Demand	Anodyne	CAPN1	60	47
COC(=O)N[C@@H](CC(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819150164	CF	On-Demand	Anodyne	CAPN2	75	36
COC(=O)N[C@@H](CC(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819150164	CF	On-Demand	Anodyne	FPR1	48	40
CC(CNC(=O)c1ccccc1SCC#N)CNC(=O)c1ccccc1SCC#N	ZINC000819150190	IH	On-Demand	Mild	CTSK	16	41
CC(CNC(=O)c1ccc([N+](=O)[O-])cc1)CNC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819150209	GE	On-Demand	Bother	COLA	26	45
CC(CNC(=O)Cc1ccc([N+](=O)[O-])cc1)CNC(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000819150214	HE	On-Demand	Bother	COLA	38	42
CC(CNC(=O)Cc1ccc([N+](=O)[O-])cc1)CNC(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000819150214	HE	On-Demand	Bother	MMP2	18	43
CC(CNC(=O)Cc1ccc([N+](=O)[O-])cc1)CNC(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000819150214	HE	On-Demand	Bother	MMP8	34	43
CC(CNC(=O)Cc1ccc([N+](=O)[O-])cc1)CNC(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000819150214	HE	On-Demand	Bother	MMP9	19	43
CC(CNC(=O)Cc1ccc([N+](=O)[O-])cc1)CNC(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000819150214	HE	On-Demand	Bother	MMP1	30	43
Cn1cc(-c2cccc(C(=O)NCCC(C)(C)C3CC3)c2)cn1	ZINC000819150224	DH	On-Demand	Anodyne	DRD4	45	35
Cn1cc(-c2cccc(C(=O)NCCC(C)(C)C3CC3)c2)cn1	ZINC000819150224	DH	On-Demand	Anodyne	TYRO3	28	47
C#CCN1CCC[C@H]1C(=O)NCC(C)CNC(=O)[C@@H]1CCCN1CC#C	ZINC000819150225	FC	On-Demand	Mild	HSD11B1	45	42
C#CCN1CCC[C@H]1C(=O)NCC(C)CNC(=O)[C@@H]1CCCN1CC#C	ZINC000819150225	FC	On-Demand	Mild	TPP2	29	47
COC(=O)c1ccc(C(=O)NCC(C)CNC(=O)c2ccc(C(=O)OC)c(F)c2)cc1F	ZINC000819150230	IE	On-Demand	Anodyne	F3	62	35
CC(CNC(=O)c1ccccc1[N+](=O)[O-])CNC(=O)c1ccccc1[N+](=O)[O-]	ZINC000819150231	GE	On-Demand	Bother	COLA	124	40
CC(CNC(=O)c1ccccc1[N+](=O)[O-])CNC(=O)c1ccccc1[N+](=O)[O-]	ZINC000819150231	GE	On-Demand	Bother	KCNMA1	19	45
CC(CNC(=O)c1ccccc1[N+](=O)[O-])CNC(=O)c1ccccc1[N+](=O)[O-]	ZINC000819150231	GE	On-Demand	Bother	DAC	28	64
CC(CNC(=O)c1ccnc(C(F)(F)F)c1)CNC(=O)c1ccnc(C(F)(F)F)c1	ZINC000819150235	IG	On-Demand	Anodyne	KDM4E	32	41
CN(CCCC(=O)NCCC(C)(C)C1CC1)C1=NS(=O)(=O)c2ccccc21	ZINC000819150243	GF	On-Demand	Anodyne	KCNA3	45	47
CC(CNC(=O)[C@@]1(O)CCc2ccccc2C1)CNC(=O)[C@@]1(O)CCc2ccccc2C1	ZINC000819150244	ID	On-Demand	Anodyne	MME	21	41
CC(CNC(=O)[C@]1(O)CCc2ccccc2C1)CNC(=O)[C@]1(O)CCc2ccccc2C1	ZINC000819150245	ID	On-Demand	Anodyne	MME	21	41
C[C@@H](CNC(=O)[C@]1(O)CCc2ccccc2C1)CNC(=O)[C@@]1(O)CCc2ccccc2C1	ZINC000819150246	ID	On-Demand	Anodyne	MME	21	41
O[C@H](CNCCc1ccccc1OC(F)(F)F)c1cccnc1	ZINC000819150247	EF	On-Demand	Anodyne	ADRB2	47	47
O[C@H](CNCCc1ccccc1OC(F)(F)F)c1cccnc1	ZINC000819150247	EF	On-Demand	Anodyne	ADRB1	48	46
O[C@H](CNCCc1ccccc1OC(F)(F)F)c1cccnc1	ZINC000819150247	EF	On-Demand	Anodyne	ADRB3	127	48
C[C@@H](CC(=O)NCc1ccc(N2CCOCC2)cc1)n1cccn1	ZINC000819150251	ED	On-Demand	Clean	STAT6	54	35
C[C@H](CC(=O)NCc1ccc(N2CCOCC2)cc1)n1cccn1	ZINC000819150252	ED	On-Demand	Clean	STAT6	54	35
O=C(NCc1ccccc1N1CCOCC1)C(F)=C1CCC1	ZINC000819150265	DF	On-Demand	Anodyne	KCNQ2	45	36
O=C(NCc1ccccc1N1CCOCC1)C(F)=C1CCC1	ZINC000819150265	DF	On-Demand	Anodyne	SCN10A	15	47
O=C(Cc1ccc(-n2cnnc2)cc1)NCc1ccc(N2CCOCC2)cc1	ZINC000819150275	GD	On-Demand	Clean	HTR1D	27	40
O=C(Cc1ccc(-n2cnnc2)cc1)NCc1ccc(N2CCOCC2)cc1	ZINC000819150275	GD	On-Demand	Clean	HTR1B	26	40
O=C(Cc1ccc(-n2cnnc2)cc1)NCc1ccc(N2CCOCC2)cc1	ZINC000819150275	GD	On-Demand	Clean	STAT6	56	37
CCOc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150284	GG	On-Demand	Bother	ADRB2	33	41
CCOc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150284	GG	On-Demand	Bother	ADRB1	50	41
CCOc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150284	GG	On-Demand	Bother	GRIN1	29	44
CCOc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150284	GG	On-Demand	Bother	ADRB3	33	41
CCOc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150285	GG	On-Demand	Bother	ADRB2	33	41
CCOc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150285	GG	On-Demand	Bother	ADRB1	50	41
CCOc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150285	GG	On-Demand	Bother	GRIN1	29	44
CCOc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150285	GG	On-Demand	Bother	ADRB3	33	41
CC(CNC(=O)C(F)(F)c1ccccc1)CNC(=O)C(F)(F)c1ccccc1	ZINC000819150322	GG	On-Demand	Anodyne	PDS	40	38
CC(CNC(=O)c1ccccc1OCC#N)CNC(=O)c1ccccc1OCC#N	ZINC000819150326	HE	On-Demand	Mild	KCNA3	40	49
CC(CNC(=O)c1ccccc1OCC#N)CNC(=O)c1ccccc1OCC#N	ZINC000819150326	HE	On-Demand	Mild	HCN1	81	39
CC(CNC(=O)c1ccccc1OCC#N)CNC(=O)c1ccccc1OCC#N	ZINC000819150326	HE	On-Demand	Mild	HCN4	56	39
CC(CNC(=O)c1ccccc1OCC#N)CNC(=O)c1ccccc1OCC#N	ZINC000819150326	HE	On-Demand	Mild	KCNK3	51	38
CC(CNC(=O)c1ccccc1OCC#N)CNC(=O)c1ccccc1OCC#N	ZINC000819150326	HE	On-Demand	Mild	KCNK9	49	38
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819150341	FE	On-Demand	Anodyne	C3AR1	44	44
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819150341	FE	On-Demand	Anodyne	MLNR	16	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819150343	FE	On-Demand	Anodyne	C3AR1	44	44
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819150343	FE	On-Demand	Anodyne	MLNR	16	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819150344	FE	On-Demand	Anodyne	C3AR1	44	44
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819150344	FE	On-Demand	Anodyne	MLNR	16	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819150346	FE	On-Demand	Anodyne	C3AR1	44	44
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819150346	FE	On-Demand	Anodyne	MLNR	16	42
O=C(NCc1ccc(N2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819150348	DF	On-Demand	Clean	STAT6	53	35
COc1cccc([S@@](=O)CC(=O)NCc2ccc(N3CCOCC3)cc2)c1	ZINC000819150394	GD	On-Demand	Clean	DRD4	48	40
CSc1cc(C)ccc1CNC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819150397	FG	On-Demand	Anodyne	CCR2	28	41
CSc1cc(C)ccc1CNC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819150398	FG	On-Demand	Anodyne	CCR2	28	41
CC(CNC(=O)[C@H]1Cc2ccccc21)CNC(=O)[C@H]1Cc2ccccc21	ZINC000819150408	EF	On-Demand	Anodyne	MTNR1A	17	40
CC(CNC(=O)[C@H]1Cc2ccccc21)CNC(=O)[C@H]1Cc2ccccc21	ZINC000819150408	EF	On-Demand	Anodyne	MTNR1B	16	40
CC(CNC(=O)[C@@H]1Cc2ccccc21)CNC(=O)[C@@H]1Cc2ccccc21	ZINC000819150412	EF	On-Demand	Anodyne	MTNR1A	17	40
CC(CNC(=O)[C@@H]1Cc2ccccc21)CNC(=O)[C@@H]1Cc2ccccc21	ZINC000819150412	EF	On-Demand	Anodyne	MTNR1B	16	40
O=S(=O)(N1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1)C(F)(F)F	ZINC000819150416	GE	On-Demand	Anodyne	ADRB3	29	47
O=S(=O)(N1CCC(NC[C@@H](O)COCc2ccccc2)CC1)C(F)(F)F	ZINC000819150417	GD	On-Demand	Anodyne	ADRB2	18	41
O=S(=O)(N1CCC(NC[C@@H](O)COCc2ccccc2)CC1)C(F)(F)F	ZINC000819150417	GD	On-Demand	Anodyne	ADRB1	18	41
O=S(=O)(N1CCC(NC[C@@H](O)COCc2ccccc2)CC1)C(F)(F)F	ZINC000819150417	GD	On-Demand	Anodyne	ADRB3	24	45
O=S(=O)(N1CCC(NC[C@@H](O)COCc2ccccc2)CC1)C(F)(F)F	ZINC000819150417	GD	On-Demand	Anodyne	SFRP1	91	34
O=S(=O)(N1CCC(NC[C@@H](O)COCc2ccccc2)CC1)C(F)(F)F	ZINC000819150417	GD	On-Demand	Anodyne	WNT3	53	33
CCOC(=O)[C@H](C)NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819150421	DE	On-Demand	Anodyne	MTNR1A	15	41
CCOC(=O)[C@H](C)NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819150421	DE	On-Demand	Anodyne	MTNR1B	16	41
CCOC(=O)[C@H](C)NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819150421	DE	On-Demand	Anodyne	CRTM	43	33
CC(CNC(=O)c1ncoc1-c1ccccc1)CNC(=O)c1ncoc1-c1ccccc1	ZINC000819150432	IH	On-Demand	Anodyne	PTGIR	17	44
CC(CNC(=O)c1ncoc1-c1ccccc1)CNC(=O)c1ncoc1-c1ccccc1	ZINC000819150432	IH	On-Demand	Anodyne	ITGAV	40	35
CN(CC(=O)NCCC(C)(C)C1CC1)C1=NS(=O)(=O)c2ccccc21	ZINC000819150440	FE	On-Demand	Anodyne	KCNA3	46	45
CC(CNC(=O)[C@H](O)c1ccccc1Cl)CNC(=O)[C@H](O)c1ccccc1Cl	ZINC000819150453	IF	On-Demand	Anodyne	OPRL1	15	40
CC(CNC(=O)[C@H](O)c1ccccc1Cl)CNC(=O)[C@H](O)c1ccccc1Cl	ZINC000819150453	IF	On-Demand	Anodyne	CXCL8	54	42
CC(CNC(=O)/C=C/c1ccc2c(c1)OCO2)CNC(=O)/C=C/c1ccc2c(c1)OCO2	ZINC000819150459	IF	On-Demand	Anodyne	KCNQ2	22	46
CC(CNC(=O)/C=C/c1ccc2c(c1)OCO2)CNC(=O)/C=C/c1ccc2c(c1)OCO2	ZINC000819150459	IF	On-Demand	Anodyne	DYRK1A	21	41
CC(CNC(=O)/C=C/c1ccc2c(c1)OCO2)CNC(=O)/C=C/c1ccc2c(c1)OCO2	ZINC000819150459	IF	On-Demand	Anodyne	CLK1	36	41
CC(CNC(=O)/C=C/c1ccc2c(c1)OCO2)CNC(=O)/C=C/c1ccc2c(c1)OCO2	ZINC000819150459	IF	On-Demand	Anodyne	CLK3	36	41
CC(CNC(=O)/C=C/c1ccc2c(c1)OCO2)CNC(=O)/C=C/c1ccc2c(c1)OCO2	ZINC000819150459	IF	On-Demand	Anodyne	DYRK2	72	41
CC(CNC(=O)/C=C\c1ccc2c(c1)OCO2)CNC(=O)/C=C/c1ccc2c(c1)OCO2	ZINC000819150461	IF	On-Demand	Anodyne	KCNQ2	22	46
CC(CNC(=O)/C=C\c1ccc2c(c1)OCO2)CNC(=O)/C=C/c1ccc2c(c1)OCO2	ZINC000819150461	IF	On-Demand	Anodyne	DYRK1A	21	41
CC(CNC(=O)/C=C\c1ccc2c(c1)OCO2)CNC(=O)/C=C/c1ccc2c(c1)OCO2	ZINC000819150461	IF	On-Demand	Anodyne	CLK1	36	41
CC(CNC(=O)/C=C\c1ccc2c(c1)OCO2)CNC(=O)/C=C/c1ccc2c(c1)OCO2	ZINC000819150461	IF	On-Demand	Anodyne	CLK3	36	41
CC(CNC(=O)/C=C\c1ccc2c(c1)OCO2)CNC(=O)/C=C/c1ccc2c(c1)OCO2	ZINC000819150461	IF	On-Demand	Anodyne	DYRK2	72	41
CC(CNC(=O)/C=C\c1ccc2c(c1)OCO2)CNC(=O)/C=C\c1ccc2c(c1)OCO2	ZINC000819150464	IF	On-Demand	Anodyne	KCNQ2	22	46
CC(CNC(=O)/C=C\c1ccc2c(c1)OCO2)CNC(=O)/C=C\c1ccc2c(c1)OCO2	ZINC000819150464	IF	On-Demand	Anodyne	DYRK1A	21	41
CC(CNC(=O)/C=C\c1ccc2c(c1)OCO2)CNC(=O)/C=C\c1ccc2c(c1)OCO2	ZINC000819150464	IF	On-Demand	Anodyne	CLK1	36	41
CC(CNC(=O)/C=C\c1ccc2c(c1)OCO2)CNC(=O)/C=C\c1ccc2c(c1)OCO2	ZINC000819150464	IF	On-Demand	Anodyne	CLK3	36	41
CC(CNC(=O)/C=C\c1ccc2c(c1)OCO2)CNC(=O)/C=C\c1ccc2c(c1)OCO2	ZINC000819150464	IF	On-Demand	Anodyne	DYRK2	72	41
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(N2CCCC2=O)ccc1Cl	ZINC000819150468	EG	On-Demand	Anodyne	HEMY	46	34
Cc1ccc([N+](=O)[O-])c(C(=O)NCC(C)CNC(=O)c2cc(C)ccc2[N+](=O)[O-])c1	ZINC000819150469	HF	On-Demand	Bother	COLA	94	37
O=C(/C=C\[C@H]1CCCO1)Nc1cc(N2CCCC2=O)ccc1Cl	ZINC000819150470	EG	On-Demand	Anodyne	HEMY	46	34
O=C(/C=C/[C@H]1CCCO1)Nc1cc(N2CCCC2=O)ccc1Cl	ZINC000819150472	EG	On-Demand	Anodyne	HEMY	46	34
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(N2CCCC2=O)ccc1Cl	ZINC000819150474	EG	On-Demand	Anodyne	HEMY	46	34
O=C(/C=C\[C@@H]1CCCO1)NCCc1ccc([N+](=O)[O-])cc1	ZINC000819150478	CD	On-Demand	Bother	LUXR	17	42
CC(CNC(=O)c1nc(Cl)ccc1Cl)CNC(=O)c1nc(Cl)ccc1Cl	ZINC000819150479	IH	On-Demand	Anodyne	ALPL	26	40
O=C(/C=C/[C@H]1CCCO1)NCCc1ccc([N+](=O)[O-])cc1	ZINC000819150480	CD	On-Demand	Bother	LUXR	17	42
O=C(/C=C/[C@@H]1CCCO1)NCCc1ccc([N+](=O)[O-])cc1	ZINC000819150482	CD	On-Demand	Bother	LUXR	17	42
O=C(/C=C\[C@H]1CCCO1)NCCc1ccc([N+](=O)[O-])cc1	ZINC000819150483	CD	On-Demand	Bother	LUXR	17	42
O=S(=O)(N1CCC(NC[C@@H](O)CCc2ccccc2)CC1)C(F)(F)F	ZINC000819150484	GD	On-Demand	Anodyne	SIGMAR1	15	40
O=S(=O)(N1CCC(NC[C@@H](O)CCc2ccccc2)CC1)C(F)(F)F	ZINC000819150484	GD	On-Demand	Anodyne	SFRP1	108	36
O=S(=O)(N1CCC(NC[C@@H](O)CCc2ccccc2)CC1)C(F)(F)F	ZINC000819150484	GD	On-Demand	Anodyne	WNT3	69	34
O=S(=O)(N1CCC(NC[C@H](O)CCc2ccccc2)CC1)C(F)(F)F	ZINC000819150485	GD	On-Demand	Anodyne	SIGMAR1	15	40
O=S(=O)(N1CCC(NC[C@H](O)CCc2ccccc2)CC1)C(F)(F)F	ZINC000819150485	GD	On-Demand	Anodyne	SFRP1	108	36
O=S(=O)(N1CCC(NC[C@H](O)CCc2ccccc2)CC1)C(F)(F)F	ZINC000819150485	GD	On-Demand	Anodyne	WNT3	69	34
CC(CNC(=O)c1cc(=O)c2ccccc2o1)CNC(=O)c1cc(=O)c2ccccc2o1	ZINC000819150493	IF	On-Demand	Anodyne	BCHE	34	45
CC(CNC(=O)c1cc(=O)c2ccccc2o1)CNC(=O)c1cc(=O)c2ccccc2o1	ZINC000819150493	IF	On-Demand	Anodyne	ECE1	18	40
CC(CNC(=O)c1cc(=O)c2ccccc2o1)CNC(=O)c1cc(=O)c2ccccc2o1	ZINC000819150493	IF	On-Demand	Anodyne	TNKS	33	46
CC(CNC(=O)c1cc(=O)c2ccccc2o1)CNC(=O)c1cc(=O)c2ccccc2o1	ZINC000819150493	IF	On-Demand	Anodyne	GPR35	52	35
CC(CNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)CNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1	ZINC000819150498	IG	On-Demand	Bother	HDAC8	15	50
CC(CNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)CNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1	ZINC000819150499	IG	On-Demand	Bother	HDAC8	15	50
CC(CNC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)CNC(=O)/C=C/c1ccc([N+](=O)[O-])cc1	ZINC000819150500	IG	On-Demand	Bother	HDAC8	15	50
CC(CNC(=O)/C=C/c1cccc(O)c1)CNC(=O)/C=C/c1cccc(O)c1	ZINC000819150509	GF	On-Demand	Anodyne	HDAC8	53	40
CC(CNC(=O)/C=C/c1cccc(O)c1)CNC(=O)/C=C/c1cccc(O)c1	ZINC000819150509	GF	On-Demand	Anodyne	MMP2	18	63
CC(CNC(=O)/C=C/c1cccc(O)c1)CNC(=O)/C=C/c1cccc(O)c1	ZINC000819150509	GF	On-Demand	Anodyne	HDAC1	24	40
CC(CNC(=O)/C=C/c1cccc(O)c1)CNC(=O)/C=C/c1cccc(O)c1	ZINC000819150509	GF	On-Demand	Anodyne	HDAC6	28	40
CC(CNC(=O)/C=C/c1cccc(O)c1)CNC(=O)/C=C/c1cccc(O)c1	ZINC000819150509	GF	On-Demand	Anodyne	MMP9	17	63
CC(CNC(=O)/C=C\c1cccc(O)c1)CNC(=O)/C=C/c1cccc(O)c1	ZINC000819150510	GF	On-Demand	Anodyne	HDAC8	53	40
CC(CNC(=O)/C=C\c1cccc(O)c1)CNC(=O)/C=C/c1cccc(O)c1	ZINC000819150510	GF	On-Demand	Anodyne	MMP2	18	63
CC(CNC(=O)/C=C\c1cccc(O)c1)CNC(=O)/C=C/c1cccc(O)c1	ZINC000819150510	GF	On-Demand	Anodyne	HDAC1	24	40
CC(CNC(=O)/C=C\c1cccc(O)c1)CNC(=O)/C=C/c1cccc(O)c1	ZINC000819150510	GF	On-Demand	Anodyne	HDAC6	28	40
CC(CNC(=O)/C=C\c1cccc(O)c1)CNC(=O)/C=C/c1cccc(O)c1	ZINC000819150510	GF	On-Demand	Anodyne	MMP9	17	63
CC(CNC(=O)/C=C\c1cccc(O)c1)CNC(=O)/C=C\c1cccc(O)c1	ZINC000819150511	GF	On-Demand	Anodyne	HDAC8	53	40
CC(CNC(=O)/C=C\c1cccc(O)c1)CNC(=O)/C=C\c1cccc(O)c1	ZINC000819150511	GF	On-Demand	Anodyne	MMP2	18	63
CC(CNC(=O)/C=C\c1cccc(O)c1)CNC(=O)/C=C\c1cccc(O)c1	ZINC000819150511	GF	On-Demand	Anodyne	HDAC1	24	40
CC(CNC(=O)/C=C\c1cccc(O)c1)CNC(=O)/C=C\c1cccc(O)c1	ZINC000819150511	GF	On-Demand	Anodyne	HDAC6	28	40
CC(CNC(=O)/C=C\c1cccc(O)c1)CNC(=O)/C=C\c1cccc(O)c1	ZINC000819150511	GF	On-Demand	Anodyne	MMP9	17	63
C[C@@H](CNC(=O)[C@@H]1CCCN1c1ncccn1)CNC(=O)[C@H]1CCCN1c1ncccn1	ZINC000819150541	IC	On-Demand	Anodyne	TPP2	28	44
C[C@@H](CNC(=O)[C@@H]1CCCN1c1ncccn1)CNC(=O)[C@H]1CCCN1c1ncccn1	ZINC000819150541	IC	On-Demand	Anodyne	XIAP	31	40
CC(CNC(=O)[C@H]1CCCN1c1ncccn1)CNC(=O)[C@H]1CCCN1c1ncccn1	ZINC000819150542	IC	On-Demand	Anodyne	TPP2	28	44
CC(CNC(=O)[C@H]1CCCN1c1ncccn1)CNC(=O)[C@H]1CCCN1c1ncccn1	ZINC000819150542	IC	On-Demand	Anodyne	XIAP	31	40
CC(CNC(=O)[C@@H]1CCCN1c1ncccn1)CNC(=O)[C@@H]1CCCN1c1ncccn1	ZINC000819150543	IC	On-Demand	Anodyne	TPP2	28	44
CC(CNC(=O)[C@@H]1CCCN1c1ncccn1)CNC(=O)[C@@H]1CCCN1c1ncccn1	ZINC000819150543	IC	On-Demand	Anodyne	XIAP	31	40
CC(CNC(=O)[C@@H]1CCCN1S(C)(=O)=O)CNC(=O)[C@@H]1CCCN1S(C)(=O)=O	ZINC000819150546	IA	On-Demand	Anodyne	TPP2	31	50
CC(CNC(=O)[C@H]1CCCN1S(C)(=O)=O)CNC(=O)[C@H]1CCCN1S(C)(=O)=O	ZINC000819150547	IA	On-Demand	Anodyne	TPP2	31	50
C[C@@H](CNC(=O)[C@@H]1CCCN1S(C)(=O)=O)CNC(=O)[C@H]1CCCN1S(C)(=O)=O	ZINC000819150548	IA	On-Demand	Anodyne	TPP2	31	50
CC(CNC(=O)[C@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150563	IG	On-Demand	Anodyne	F2	48	40
CC(CNC(=O)[C@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150563	IG	On-Demand	Anodyne	ACE	62	41
CC(CNC(=O)[C@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150563	IG	On-Demand	Anodyne	TRY1_BOVIN	44	38
CC(CNC(=O)[C@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150563	IG	On-Demand	Anodyne	PREP	65	39
CC(CNC(=O)[C@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150563	IG	On-Demand	Anodyne	TPP2	39	45
CC(CNC(=O)[C@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150563	IG	On-Demand	Anodyne	XIAP	77	48
CC(CNC(=O)[C@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150563	IG	On-Demand	Anodyne	BIRC3	56	30
CC(CNC(=O)[C@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150563	IG	On-Demand	Anodyne	BIRC2	52	33
CC(CNC(=O)[C@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150563	IG	On-Demand	Anodyne	WNT3	41	34
CC(CNC(=O)[C@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150563	IG	On-Demand	Anodyne	TMPRSS11D	54	36
C[C@@H](CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150564	IG	On-Demand	Anodyne	F2	48	40
C[C@@H](CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150564	IG	On-Demand	Anodyne	ACE	62	41
C[C@@H](CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150564	IG	On-Demand	Anodyne	TRY1_BOVIN	44	38
C[C@@H](CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150564	IG	On-Demand	Anodyne	PREP	65	39
C[C@@H](CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150564	IG	On-Demand	Anodyne	TPP2	39	45
C[C@@H](CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150564	IG	On-Demand	Anodyne	XIAP	77	48
C[C@@H](CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150564	IG	On-Demand	Anodyne	BIRC3	56	30
C[C@@H](CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150564	IG	On-Demand	Anodyne	BIRC2	52	33
C[C@@H](CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150564	IG	On-Demand	Anodyne	WNT3	41	34
C[C@@H](CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000819150564	IG	On-Demand	Anodyne	TMPRSS11D	54	36
CC(CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@@H]1CCCN1c1ccccc1	ZINC000819150565	IG	On-Demand	Anodyne	F2	48	40
CC(CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@@H]1CCCN1c1ccccc1	ZINC000819150565	IG	On-Demand	Anodyne	ACE	62	41
CC(CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@@H]1CCCN1c1ccccc1	ZINC000819150565	IG	On-Demand	Anodyne	TRY1_BOVIN	44	38
CC(CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@@H]1CCCN1c1ccccc1	ZINC000819150565	IG	On-Demand	Anodyne	PREP	65	39
CC(CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@@H]1CCCN1c1ccccc1	ZINC000819150565	IG	On-Demand	Anodyne	TPP2	39	45
CC(CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@@H]1CCCN1c1ccccc1	ZINC000819150565	IG	On-Demand	Anodyne	XIAP	77	48
CC(CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@@H]1CCCN1c1ccccc1	ZINC000819150565	IG	On-Demand	Anodyne	BIRC3	56	30
CC(CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@@H]1CCCN1c1ccccc1	ZINC000819150565	IG	On-Demand	Anodyne	BIRC2	52	33
CC(CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@@H]1CCCN1c1ccccc1	ZINC000819150565	IG	On-Demand	Anodyne	WNT3	41	34
CC(CNC(=O)[C@@H]1CCCN1c1ccccc1)CNC(=O)[C@@H]1CCCN1c1ccccc1	ZINC000819150565	IG	On-Demand	Anodyne	TMPRSS11D	54	36
CC(CNC(=O)[C@H](F)c1ccccc1)CNC(=O)[C@H](F)c1ccccc1	ZINC000819150579	FG	On-Demand	Anodyne	MME	47	41
CC(CNC(=O)[C@H](F)c1ccccc1)CNC(=O)[C@H](F)c1ccccc1	ZINC000819150579	FG	On-Demand	Anodyne	KCNQ2	17	41
CC(CNC(=O)[C@@H](F)c1ccccc1)CNC(=O)[C@@H](F)c1ccccc1	ZINC000819150580	FG	On-Demand	Anodyne	MME	47	41
CC(CNC(=O)[C@@H](F)c1ccccc1)CNC(=O)[C@@H](F)c1ccccc1	ZINC000819150580	FG	On-Demand	Anodyne	KCNQ2	17	41
CC(CNC(=O)c1nccs1)CNC(=O)c1nccs1	ZINC000819150581	DD	On-Demand	Anodyne	MAP1	85	40
CC(CNC(=O)c1nccs1)CNC(=O)c1nccs1	ZINC000819150581	DD	On-Demand	Anodyne	HPN	59	34
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819150603	ED	On-Demand	Anodyne	ADRB2	26	44
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819150603	ED	On-Demand	Anodyne	ADRB1	33	43
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819150603	ED	On-Demand	Anodyne	ADRB3	106	48
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819150603	ED	On-Demand	Anodyne	PTAFR	20	52
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819150603	ED	On-Demand	Anodyne	KCNA5	18	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819150603	ED	On-Demand	Anodyne	C3AR1	59	58
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819150603	ED	On-Demand	Anodyne	SCD	24	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819150604	ED	On-Demand	Anodyne	ADRB2	26	44
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819150604	ED	On-Demand	Anodyne	ADRB1	33	43
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819150604	ED	On-Demand	Anodyne	ADRB3	106	48
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819150604	ED	On-Demand	Anodyne	PTAFR	20	52
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819150604	ED	On-Demand	Anodyne	KCNA5	18	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819150604	ED	On-Demand	Anodyne	C3AR1	59	58
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819150604	ED	On-Demand	Anodyne	SCD	24	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819150605	ED	On-Demand	Anodyne	ADRB2	26	44
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819150605	ED	On-Demand	Anodyne	ADRB1	33	43
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819150605	ED	On-Demand	Anodyne	ADRB3	106	48
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819150605	ED	On-Demand	Anodyne	PTAFR	20	52
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819150605	ED	On-Demand	Anodyne	KCNA5	18	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819150605	ED	On-Demand	Anodyne	C3AR1	59	58
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819150605	ED	On-Demand	Anodyne	SCD	24	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819150606	ED	On-Demand	Anodyne	ADRB2	26	44
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819150606	ED	On-Demand	Anodyne	ADRB1	33	43
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819150606	ED	On-Demand	Anodyne	ADRB3	106	48
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819150606	ED	On-Demand	Anodyne	PTAFR	20	52
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819150606	ED	On-Demand	Anodyne	KCNA5	18	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819150606	ED	On-Demand	Anodyne	C3AR1	59	58
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819150606	ED	On-Demand	Anodyne	SCD	24	40
O[C@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccccc1	ZINC000819150624	DE	On-Demand	Anodyne	ADRB2	16	40
O[C@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccccc1	ZINC000819150624	DE	On-Demand	Anodyne	ADRB1	19	40
O[C@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccccc1	ZINC000819150624	DE	On-Demand	Anodyne	ADRB3	30	40
O[C@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccccc1	ZINC000819150626	DE	On-Demand	Anodyne	ADRB2	16	40
O[C@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccccc1	ZINC000819150626	DE	On-Demand	Anodyne	ADRB1	19	40
O[C@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccccc1	ZINC000819150626	DE	On-Demand	Anodyne	ADRB3	30	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(c3ccccc3)CC1)C2	ZINC000819150627	FF	On-Demand	Anodyne	ADAM10	40	41
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccccc1	ZINC000819150628	DE	On-Demand	Anodyne	ADRB2	16	40
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccccc1	ZINC000819150628	DE	On-Demand	Anodyne	ADRB1	19	40
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccccc1	ZINC000819150628	DE	On-Demand	Anodyne	ADRB3	30	40
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccccc1	ZINC000819150629	DE	On-Demand	Anodyne	ADRB2	16	40
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccccc1	ZINC000819150629	DE	On-Demand	Anodyne	ADRB1	19	40
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccccc1	ZINC000819150629	DE	On-Demand	Anodyne	ADRB3	30	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(c3ccccc3)CC1)C2	ZINC000819150630	FF	On-Demand	Anodyne	ADAM10	40	41
O=C(CCNC1CCN(S(=O)(=O)C(F)(F)F)CC1)Nc1ccccc1F	ZINC000819150634	GE	On-Demand	Anodyne	CCR8	47	36
O=C(CCNC1CCN(S(=O)(=O)C(F)(F)F)CC1)Nc1ccccc1F	ZINC000819150634	GE	On-Demand	Anodyne	SFRP1	53	33
O=C(CCNC1CCN(S(=O)(=O)C(F)(F)F)CC1)Nc1ccccc1	ZINC000819150635	GD	On-Demand	Anodyne	EPHX2	28	42
O=C(CCNC1CCN(S(=O)(=O)C(F)(F)F)CC1)Nc1ccccc1	ZINC000819150635	GD	On-Demand	Anodyne	SFRP1	114	36
O=C(CCNC1CCN(S(=O)(=O)C(F)(F)F)CC1)Nc1ccccc1	ZINC000819150635	GD	On-Demand	Anodyne	WNT3	73	35
O[C@@H](CNCCCO[C@@H]1CCOC1)c1ccc(Cl)c(F)c1	ZINC000819150647	DE	On-Demand	Anodyne	ADRB2	33	42
O[C@@H](CNCCCO[C@@H]1CCOC1)c1ccc(Cl)c(F)c1	ZINC000819150647	DE	On-Demand	Anodyne	ADRB1	23	42
O[C@@H](CNCCCO[C@@H]1CCOC1)c1ccc(Cl)c(F)c1	ZINC000819150647	DE	On-Demand	Anodyne	ADRB3	19	42
O[C@H](CNCCCO[C@@H]1CCOC1)c1ccc(Cl)c(F)c1	ZINC000819150649	DE	On-Demand	Anodyne	ADRB2	33	42
O[C@H](CNCCCO[C@@H]1CCOC1)c1ccc(Cl)c(F)c1	ZINC000819150649	DE	On-Demand	Anodyne	ADRB1	23	42
O[C@H](CNCCCO[C@@H]1CCOC1)c1ccc(Cl)c(F)c1	ZINC000819150649	DE	On-Demand	Anodyne	ADRB3	19	42
O[C@H](CNCCCO[C@H]1CCOC1)c1ccc(Cl)c(F)c1	ZINC000819150651	DE	On-Demand	Anodyne	ADRB2	33	42
O[C@H](CNCCCO[C@H]1CCOC1)c1ccc(Cl)c(F)c1	ZINC000819150651	DE	On-Demand	Anodyne	ADRB1	23	42
O[C@H](CNCCCO[C@H]1CCOC1)c1ccc(Cl)c(F)c1	ZINC000819150651	DE	On-Demand	Anodyne	ADRB3	19	42
O[C@@H](CNCCCO[C@H]1CCOC1)c1ccc(Cl)c(F)c1	ZINC000819150653	DE	On-Demand	Anodyne	ADRB2	33	42
O[C@@H](CNCCCO[C@H]1CCOC1)c1ccc(Cl)c(F)c1	ZINC000819150653	DE	On-Demand	Anodyne	ADRB1	23	42
O[C@@H](CNCCCO[C@H]1CCOC1)c1ccc(Cl)c(F)c1	ZINC000819150653	DE	On-Demand	Anodyne	ADRB3	19	42
O=[N+]([O-])c1ccc(Cl)c(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819150662	FG	On-Demand	Bother	ADRB2	28	43
O=[N+]([O-])c1ccc(Cl)c(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819150662	FG	On-Demand	Bother	ADRB1	51	43
O=[N+]([O-])c1ccc(Cl)c(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819150662	FG	On-Demand	Bother	GRIN1	28	44
O=[N+]([O-])c1ccc(Cl)c(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819150662	FG	On-Demand	Bother	ADRB3	34	43
O=[N+]([O-])c1ccc(Cl)c(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819150664	FG	On-Demand	Bother	ADRB2	28	43
O=[N+]([O-])c1ccc(Cl)c(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819150664	FG	On-Demand	Bother	ADRB1	51	43
O=[N+]([O-])c1ccc(Cl)c(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819150664	FG	On-Demand	Bother	GRIN1	28	44
O=[N+]([O-])c1ccc(Cl)c(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819150664	FG	On-Demand	Bother	ADRB3	34	43
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819150669	GH	On-Demand	Anodyne	DRD4	15	44
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819150669	GH	On-Demand	Anodyne	GRIN2B	19	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819150669	GH	On-Demand	Anodyne	SIGMAR1	16	47
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819150669	GH	On-Demand	Anodyne	C3AR1	40	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819150669	GH	On-Demand	Anodyne	CCR8	55	36
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819150671	GH	On-Demand	Anodyne	DRD4	15	44
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819150671	GH	On-Demand	Anodyne	GRIN2B	19	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819150671	GH	On-Demand	Anodyne	SIGMAR1	16	47
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819150671	GH	On-Demand	Anodyne	C3AR1	40	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819150671	GH	On-Demand	Anodyne	CCR8	55	36
O=C(NCc1ccc(N2CCOCC2)cc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819150693	GH	On-Demand	Clean	STAT6	55	38
O[C@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccc(F)cc1	ZINC000819150699	DE	On-Demand	Anodyne	ADRB3	22	40
O[C@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccc(F)cc1	ZINC000819150700	DE	On-Demand	Anodyne	ADRB3	22	40
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccc(F)cc1	ZINC000819150701	DE	On-Demand	Anodyne	ADRB3	22	40
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccc(F)cc1	ZINC000819150702	DE	On-Demand	Anodyne	ADRB3	22	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819150707	FG	On-Demand	Anodyne	ADRB1	29	44
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819150707	FG	On-Demand	Anodyne	GRIN2B	16	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819150707	FG	On-Demand	Anodyne	ADRB3	45	44
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819150707	FG	On-Demand	Anodyne	SIGMAR1	18	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819150707	FG	On-Demand	Anodyne	CCR1	27	43
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819150707	FG	On-Demand	Anodyne	C3AR1	46	49
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819150709	FG	On-Demand	Anodyne	ADRB1	29	44
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819150709	FG	On-Demand	Anodyne	GRIN2B	16	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819150709	FG	On-Demand	Anodyne	ADRB3	45	44
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819150709	FG	On-Demand	Anodyne	SIGMAR1	18	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819150709	FG	On-Demand	Anodyne	CCR1	27	43
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819150709	FG	On-Demand	Anodyne	C3AR1	46	49
C=C(C)C(C)(C)C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1	ZINC000819150716	GG	On-Demand	Mild	NPY2R	75	36
C[C@@H]1CCCC[C@H]1C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000819150743	DF	On-Demand	Clean	STAT6	42	34
C[C@@H]1CCCC[C@@H]1C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000819150747	DF	On-Demand	Clean	STAT6	42	34
O=C(/C=C/[C@H]1CCCO1)NCc1ccccc1N1CCOCC1	ZINC000819150766	DD	On-Demand	Anodyne	SCN10A	15	46
O=C(/C=C\[C@@H]1CCCO1)NCc1ccccc1N1CCOCC1	ZINC000819150768	DD	On-Demand	Anodyne	SCN10A	15	46
O=C(/C=C/[C@@H]1CCCO1)NCc1ccccc1N1CCOCC1	ZINC000819150770	DD	On-Demand	Anodyne	SCN10A	15	46
O=C(/C=C\[C@H]1CCCO1)NCc1ccccc1N1CCOCC1	ZINC000819150772	DD	On-Demand	Anodyne	SCN10A	15	46
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccc(Cl)cc1	ZINC000819150782	EF	On-Demand	Anodyne	ADRB1	15	41
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccc(Cl)cc1	ZINC000819150782	EF	On-Demand	Anodyne	ADRB3	26	41
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccc(Cl)cc1	ZINC000819150782	EF	On-Demand	Anodyne	AKT3	46	37
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccc(Cl)cc1	ZINC000819150784	EF	On-Demand	Anodyne	ADRB1	15	41
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccc(Cl)cc1	ZINC000819150784	EF	On-Demand	Anodyne	ADRB3	26	41
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccc(Cl)cc1	ZINC000819150784	EF	On-Demand	Anodyne	AKT3	46	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1cc(OC)ccc1OC)C2	ZINC000819150837	GE	On-Demand	Anodyne	NQO2	37	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1cc(OC)ccc1OC)C2	ZINC000819150837	GE	On-Demand	Anodyne	MTNR1A	83	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1cc(OC)ccc1OC)C2	ZINC000819150837	GE	On-Demand	Anodyne	MTNR1B	71	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1cc(OC)ccc1OC)C2	ZINC000819150839	GE	On-Demand	Anodyne	NQO2	37	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1cc(OC)ccc1OC)C2	ZINC000819150839	GE	On-Demand	Anodyne	MTNR1A	83	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1cc(OC)ccc1OC)C2	ZINC000819150839	GE	On-Demand	Anodyne	MTNR1B	71	44
O[C@@H](CNCCc1ccccc1OC(F)(F)F)c1ccc(F)c(F)c1	ZINC000819150880	FH	On-Demand	Anodyne	ADRB2	51	40
O[C@@H](CNCCc1ccccc1OC(F)(F)F)c1ccc(F)c(F)c1	ZINC000819150880	FH	On-Demand	Anodyne	ADRB1	40	38
O[C@@H](CNCCc1ccccc1OC(F)(F)F)c1ccc(F)c(F)c1	ZINC000819150880	FH	On-Demand	Anodyne	ADRB3	50	40
O[C@H](CNCCc1ccccc1OC(F)(F)F)c1ccc(F)c(F)c1	ZINC000819150882	FH	On-Demand	Anodyne	ADRB2	51	40
O[C@H](CNCCc1ccccc1OC(F)(F)F)c1ccc(F)c(F)c1	ZINC000819150882	FH	On-Demand	Anodyne	ADRB1	40	38
O[C@H](CNCCc1ccccc1OC(F)(F)F)c1ccc(F)c(F)c1	ZINC000819150882	FH	On-Demand	Anodyne	ADRB3	50	40
CSc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150886	GG	On-Demand	Bother	ADRB2	25	40
CSc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150886	GG	On-Demand	Bother	ADRB1	39	40
CSc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150886	GG	On-Demand	Bother	GRIN1	28	41
CSc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150886	GG	On-Demand	Bother	ADRB3	27	40
CSc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150888	GG	On-Demand	Bother	ADRB2	25	40
CSc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150888	GG	On-Demand	Bother	ADRB1	39	40
CSc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150888	GG	On-Demand	Bother	GRIN1	28	41
CSc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150888	GG	On-Demand	Bother	ADRB3	27	40
CSc1cc(C)ccc1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819150889	GH	On-Demand	Anodyne	GPR119	49	52
CSc1cc(C)ccc1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819150892	GH	On-Demand	Anodyne	GPR119	49	52
O=C(Cc1nsc2ccccc12)NCc1ccc(N2CCOCC2)cc1	ZINC000819150902	FF	On-Demand	Clean	HTR1A	20	41
O=C(Cc1nsc2ccccc12)NCc1ccc(N2CCOCC2)cc1	ZINC000819150902	FF	On-Demand	Clean	PRKDC	69	36
O=C(Cc1nsc2ccccc12)NCc1ccc(N2CCOCC2)cc1	ZINC000819150902	FF	On-Demand	Clean	STAT6	62	38
O=C(CCNC1CCN(S(=O)(=O)C(F)(F)F)CC1)Nc1cccc(F)c1	ZINC000819150906	GE	On-Demand	Anodyne	EPHX2	17	44
O=C(CCNC1CCN(S(=O)(=O)C(F)(F)F)CC1)Nc1cccc(F)c1	ZINC000819150906	GE	On-Demand	Anodyne	SFRP1	40	33
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150918	GF	On-Demand	Bother	ADRB2	37	50
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150918	GF	On-Demand	Bother	ADRB1	73	50
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150918	GF	On-Demand	Bother	GRIN1	33	46
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150918	GF	On-Demand	Bother	ADRB3	48	48
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150921	GF	On-Demand	Bother	ADRB2	37	50
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150921	GF	On-Demand	Bother	ADRB1	73	50
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150921	GF	On-Demand	Bother	GRIN1	33	46
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819150921	GF	On-Demand	Bother	ADRB3	48	48
COc1cc(CNC(=O)C(F)=C2CCC2)ccc1C	ZINC000819150929	CG	On-Demand	Anodyne	TRPV1	19	40
O=[N+]([O-])c1ccc(Cl)c(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819150931	GF	On-Demand	Bother	ADRB1	49	36
O=[N+]([O-])c1ccc(Cl)c(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819150934	GF	On-Demand	Bother	ADRB1	49	36
O[C@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccc(Cl)cc1Cl	ZINC000819150940	FG	On-Demand	Anodyne	PRKCQ	40	33
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccc(Cl)cc1Cl	ZINC000819150942	FG	On-Demand	Anodyne	PRKCQ	40	33
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819150943	FF	On-Demand	Anodyne	SIGMAR1	17	43
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819150943	FF	On-Demand	Anodyne	CCR3	30	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819150943	FF	On-Demand	Anodyne	C3AR1	40	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819150943	FF	On-Demand	Anodyne	MLNR	27	43
O[C@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccc(Cl)cc1Cl	ZINC000819150944	FG	On-Demand	Anodyne	PRKCQ	40	33
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819150945	FF	On-Demand	Anodyne	SIGMAR1	17	43
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819150945	FF	On-Demand	Anodyne	CCR3	30	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819150945	FF	On-Demand	Anodyne	C3AR1	40	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819150945	FF	On-Demand	Anodyne	MLNR	27	43
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccc(Cl)cc1Cl	ZINC000819150946	FG	On-Demand	Anodyne	PRKCQ	40	33
O[C@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccc(Cl)c(F)c1	ZINC000819150948	FF	On-Demand	Anodyne	PRKCQ	40	33
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819150949	FF	On-Demand	Anodyne	SIGMAR1	17	43
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819150949	FF	On-Demand	Anodyne	CCR3	30	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819150949	FF	On-Demand	Anodyne	C3AR1	40	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819150949	FF	On-Demand	Anodyne	MLNR	27	43
O[C@@H](CN[C@H]1CCN(c2ncccc2F)C1)c1ccc(Cl)c(F)c1	ZINC000819150950	FF	On-Demand	Anodyne	PRKCQ	40	33
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819150951	FF	On-Demand	Anodyne	SIGMAR1	17	43
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819150951	FF	On-Demand	Anodyne	CCR3	30	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819150951	FF	On-Demand	Anodyne	C3AR1	40	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819150951	FF	On-Demand	Anodyne	MLNR	27	43
O[C@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccc(Cl)c(F)c1	ZINC000819150952	FF	On-Demand	Anodyne	PRKCQ	40	33
O[C@@H](CN[C@@H]1CCN(c2ncccc2F)C1)c1ccc(Cl)c(F)c1	ZINC000819150954	FF	On-Demand	Anodyne	PRKCQ	40	33
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2C(=O)NC(C)(C)C)c1	ZINC000819150962	FG	On-Demand	Anodyne	NR1H4	16	55
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2C(=O)NC(C)(C)C)c1	ZINC000819150962	FG	On-Demand	Anodyne	KCNK3	77	36
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2C(=O)NC(C)(C)C)c1	ZINC000819150962	FG	On-Demand	Anodyne	KCNK9	60	36
COc1ccc(OC(F)F)c(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819150963	FG	On-Demand	Bother	CACNA1D	43	35
COc1ccc(OC(F)F)c(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819150965	FG	On-Demand	Bother	CACNA1D	43	35
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819150974	FF	On-Demand	Anodyne	GRIN2B	21	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819150974	FF	On-Demand	Anodyne	SIGMAR1	18	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819150974	FF	On-Demand	Anodyne	C3AR1	41	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819150974	FF	On-Demand	Anodyne	MLNR	15	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819150976	FF	On-Demand	Anodyne	GRIN2B	21	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819150976	FF	On-Demand	Anodyne	SIGMAR1	18	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819150976	FF	On-Demand	Anodyne	C3AR1	41	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819150976	FF	On-Demand	Anodyne	MLNR	15	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819150978	FF	On-Demand	Anodyne	GRIN2B	21	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819150978	FF	On-Demand	Anodyne	SIGMAR1	18	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819150978	FF	On-Demand	Anodyne	C3AR1	41	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819150978	FF	On-Demand	Anodyne	MLNR	15	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819150981	FF	On-Demand	Anodyne	GRIN2B	21	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819150981	FF	On-Demand	Anodyne	SIGMAR1	18	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819150981	FF	On-Demand	Anodyne	C3AR1	41	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819150981	FF	On-Demand	Anodyne	MLNR	15	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819150997	GG	On-Demand	Anodyne	ADRB1	23	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819150997	GG	On-Demand	Anodyne	ADRB3	36	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819150997	GG	On-Demand	Anodyne	C3AR1	42	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819150997	GG	On-Demand	Anodyne	MLNR	20	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819150998	GG	On-Demand	Anodyne	ADRB1	23	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819150998	GG	On-Demand	Anodyne	ADRB3	36	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819150998	GG	On-Demand	Anodyne	C3AR1	42	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819150998	GG	On-Demand	Anodyne	MLNR	20	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819150999	GG	On-Demand	Anodyne	ADRB1	23	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819150999	GG	On-Demand	Anodyne	ADRB3	36	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819150999	GG	On-Demand	Anodyne	C3AR1	42	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819150999	GG	On-Demand	Anodyne	MLNR	20	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819151000	GG	On-Demand	Anodyne	ADRB1	23	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819151000	GG	On-Demand	Anodyne	ADRB3	36	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819151000	GG	On-Demand	Anodyne	C3AR1	42	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819151000	GG	On-Demand	Anodyne	MLNR	20	41
N#CCc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819151017	GF	On-Demand	Mild	ADRB2	29	43
N#CCc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819151017	GF	On-Demand	Mild	ADRB1	52	43
N#CCc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819151017	GF	On-Demand	Mild	GRIN1	28	42
N#CCc1ccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819151017	GF	On-Demand	Mild	ADRB3	37	43
N#CCc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819151019	GF	On-Demand	Mild	ADRB2	29	43
N#CCc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819151019	GF	On-Demand	Mild	ADRB1	52	43
N#CCc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819151019	GF	On-Demand	Mild	GRIN1	28	42
N#CCc1ccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000819151019	GF	On-Demand	Mild	ADRB3	37	43
O=C(NCCc1ccc([N+](=O)[O-])cc1)C(F)=C1CCC1	ZINC000819151034	CF	On-Demand	Bother	KCNJ1	27	40
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1c(F)cccc1F	ZINC000819151036	FG	On-Demand	Anodyne	ADRB1	30	41
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1c(F)cccc1F	ZINC000819151036	FG	On-Demand	Anodyne	ADRB3	49	45
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1c(F)cccc1F	ZINC000819151036	FG	On-Demand	Anodyne	CYP3A4	49	36
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1c(F)cccc1F	ZINC000819151038	FG	On-Demand	Anodyne	ADRB1	30	41
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1c(F)cccc1F	ZINC000819151038	FG	On-Demand	Anodyne	ADRB3	49	45
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1c(F)cccc1F	ZINC000819151038	FG	On-Demand	Anodyne	CYP3A4	49	36
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1c(F)cccc1F	ZINC000819151040	FG	On-Demand	Anodyne	ADRB1	30	41
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1c(F)cccc1F	ZINC000819151040	FG	On-Demand	Anodyne	ADRB3	49	45
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1c(F)cccc1F	ZINC000819151040	FG	On-Demand	Anodyne	CYP3A4	49	36
CON(C)C(=O)CCNCc1cc([N+](=O)[O-])ccc1Cl	ZINC000819151042	DD	On-Demand	Bother	CACNA1C	40	35
CON(C)C(=O)CCNCc1cc([N+](=O)[O-])ccc1Cl	ZINC000819151042	DD	On-Demand	Bother	CACNA1D	64	34
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1c(F)cccc1F	ZINC000819151043	FG	On-Demand	Anodyne	ADRB1	30	41
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1c(F)cccc1F	ZINC000819151043	FG	On-Demand	Anodyne	ADRB3	49	45
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1c(F)cccc1F	ZINC000819151043	FG	On-Demand	Anodyne	CYP3A4	49	36
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151055	GF	On-Demand	Bother	ADRB2	27	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151055	GF	On-Demand	Bother	ADRB1	39	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151055	GF	On-Demand	Bother	GRIN1	22	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151055	GF	On-Demand	Bother	ADRB3	26	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151055	GF	On-Demand	Bother	PDS	18	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151056	GF	On-Demand	Bother	ADRB2	27	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151056	GF	On-Demand	Bother	ADRB1	39	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151056	GF	On-Demand	Bother	GRIN1	22	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151056	GF	On-Demand	Bother	ADRB3	26	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151056	GF	On-Demand	Bother	PDS	18	44
CC(=O)c1cccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151072	GF	On-Demand	Bother	ADRB2	20	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151072	GF	On-Demand	Bother	ADRB1	44	41
CC(=O)c1cccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151072	GF	On-Demand	Bother	GRIN1	16	41
CC(=O)c1cccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151072	GF	On-Demand	Bother	ADRB3	21	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151072	GF	On-Demand	Bother	ABCB1	15	41
CC(=O)c1cccc(OC[C@@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151072	GF	On-Demand	Bother	PDS	34	40
CC(=O)c1cccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151074	GF	On-Demand	Bother	ADRB2	20	43
CC(=O)c1cccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151074	GF	On-Demand	Bother	ADRB1	44	41
CC(=O)c1cccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151074	GF	On-Demand	Bother	GRIN1	16	41
CC(=O)c1cccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151074	GF	On-Demand	Bother	ADRB3	21	43
CC(=O)c1cccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151074	GF	On-Demand	Bother	ABCB1	15	41
CC(=O)c1cccc(OC[C@H](O)CNCc2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000819151074	GF	On-Demand	Bother	PDS	34	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccccc1OCCn1ccnc1)C2	ZINC000819151076	GF	On-Demand	Anodyne	TBXAS1	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccccc1OCCn1ccnc1)C2	ZINC000819151079	GF	On-Demand	Anodyne	TBXAS1	15	40
C=C(C)C(C)(C)C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000819151120	DF	On-Demand	Mild	STAT6	66	39
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(c2ncccc2F)C1	ZINC000819151164	DE	On-Demand	Anodyne	PRKCQ	40	30
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(c2ncccc2F)C1	ZINC000819151170	DE	On-Demand	Anodyne	PRKCQ	40	30
O=S(=O)(N1CCC(NC[C@@H](O)c2ccc(F)c(F)c2)CC1)C(F)(F)F	ZINC000819151186	GD	On-Demand	Anodyne	ADRB3	30	44
O=S(=O)(N1CCC(NC[C@@H](O)c2ccc(F)c(F)c2)CC1)C(F)(F)F	ZINC000819151186	GD	On-Demand	Anodyne	SFRP1	57	32
O=S(=O)(N1CCC(NC[C@@H](O)c2ccc(F)c(F)c2)CC1)C(F)(F)F	ZINC000819151186	GD	On-Demand	Anodyne	WNT3	50	31
O=S(=O)(N1CCC(NC[C@H](O)c2ccc(F)c(F)c2)CC1)C(F)(F)F	ZINC000819151187	GD	On-Demand	Anodyne	ADRB3	30	44
O=S(=O)(N1CCC(NC[C@H](O)c2ccc(F)c(F)c2)CC1)C(F)(F)F	ZINC000819151187	GD	On-Demand	Anodyne	SFRP1	57	32
O=S(=O)(N1CCC(NC[C@H](O)c2ccc(F)c(F)c2)CC1)C(F)(F)F	ZINC000819151187	GD	On-Demand	Anodyne	WNT3	50	31
Cc1ccc([C@@H](C)NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1F	ZINC000819151188	GH	On-Demand	Anodyne	GPR119	53	51
Cc1ccc([C@@H](C)NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1F	ZINC000819151189	GH	On-Demand	Anodyne	GPR119	53	51
Cc1ccc([C@H](C)NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1F	ZINC000819151190	GH	On-Demand	Anodyne	GPR119	53	51
Cc1ccc([C@H](C)NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1F	ZINC000819151191	GH	On-Demand	Anodyne	GPR119	53	51
O=C(/C=C\[C@H]1CCCO1)Nc1cccnc1N1CCOCC1	ZINC000819151207	DD	On-Demand	Anodyne	MTOR	47	35
O=C(/C=C/[C@@H]1CCCO1)Nc1cccnc1N1CCOCC1	ZINC000819151208	DD	On-Demand	Anodyne	MTOR	47	35
O=C(/C=C\[C@@H]1CCCO1)Nc1cccnc1N1CCOCC1	ZINC000819151209	DD	On-Demand	Anodyne	MTOR	47	35
O=C(/C=C/[C@H]1CCCO1)Nc1cccnc1N1CCOCC1	ZINC000819151210	DD	On-Demand	Anodyne	MTOR	47	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccccc1N1CCOCC1	ZINC000819151237	GE	On-Demand	Anodyne	SCN10A	17	43
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819151242	FF	On-Demand	Anodyne	GRIN2B	20	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819151242	FF	On-Demand	Anodyne	SIGMAR1	17	43
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819151242	FF	On-Demand	Anodyne	CCR3	32	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819151242	FF	On-Demand	Anodyne	C3AR1	41	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819151242	FF	On-Demand	Anodyne	MLNR	24	43
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819151243	FF	On-Demand	Anodyne	GRIN2B	20	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819151243	FF	On-Demand	Anodyne	SIGMAR1	17	43
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819151243	FF	On-Demand	Anodyne	CCR3	32	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819151243	FF	On-Demand	Anodyne	C3AR1	41	41
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819151243	FF	On-Demand	Anodyne	MLNR	24	43
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819151244	FF	On-Demand	Anodyne	GRIN2B	20	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819151244	FF	On-Demand	Anodyne	SIGMAR1	17	43
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819151244	FF	On-Demand	Anodyne	CCR3	32	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819151244	FF	On-Demand	Anodyne	C3AR1	41	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819151244	FF	On-Demand	Anodyne	MLNR	24	43
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819151245	FF	On-Demand	Anodyne	GRIN2B	20	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819151245	FF	On-Demand	Anodyne	SIGMAR1	17	43
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819151245	FF	On-Demand	Anodyne	CCR3	32	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819151245	FF	On-Demand	Anodyne	C3AR1	41	41
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819151245	FF	On-Demand	Anodyne	MLNR	24	43
C=CCC1(C(=O)NCc2ccc(N3CCOCC3)cc2)CCOCC1	ZINC000819151253	EF	On-Demand	Mild	STAT6	56	38
COc1ccc(OC)c([C@H](O)CNCCc2nnc(-c3ccccc3)o2)c1	ZINC000819151274	FF	On-Demand	Anodyne	ADRB2	24	44
COc1ccccc1N1CC[C@@H](NCCS(C)(=O)=O)C1	ZINC000819151278	CC	On-Demand	Anodyne	HTR1A	78	42
COc1ccccc1N1CC[C@@H](NCCS(C)(=O)=O)C1	ZINC000819151278	CC	On-Demand	Anodyne	DRD2	66	44
COc1ccccc1N1CC[C@@H](NCCS(C)(=O)=O)C1	ZINC000819151278	CC	On-Demand	Anodyne	DRD4	35	40
COc1ccccc1N1CC[C@@H](NCCS(C)(=O)=O)C1	ZINC000819151278	CC	On-Demand	Anodyne	ADRA1D	83	39
COc1ccccc1N1CC[C@@H](NCCS(C)(=O)=O)C1	ZINC000819151278	CC	On-Demand	Anodyne	HTR2A	19	40
COc1ccccc1N1CC[C@@H](NCCS(C)(=O)=O)C1	ZINC000819151278	CC	On-Demand	Anodyne	ADRA1A	70	38
COc1ccccc1N1CC[C@@H](NCCS(C)(=O)=O)C1	ZINC000819151278	CC	On-Demand	Anodyne	ADRA1B	65	39
COc1ccccc1N1CC[C@@H](NCCS(C)(=O)=O)C1	ZINC000819151278	CC	On-Demand	Anodyne	DRD3	62	41
COc1ccccc1N1CC[C@@H](NCCS(C)(=O)=O)C1	ZINC000819151278	CC	On-Demand	Anodyne	HTR7	53	42
COc1ccccc1N1CC[C@H](NCCS(C)(=O)=O)C1	ZINC000819151279	CC	On-Demand	Anodyne	HTR1A	78	42
COc1ccccc1N1CC[C@H](NCCS(C)(=O)=O)C1	ZINC000819151279	CC	On-Demand	Anodyne	DRD2	66	44
COc1ccccc1N1CC[C@H](NCCS(C)(=O)=O)C1	ZINC000819151279	CC	On-Demand	Anodyne	DRD4	35	40
COc1ccccc1N1CC[C@H](NCCS(C)(=O)=O)C1	ZINC000819151279	CC	On-Demand	Anodyne	ADRA1D	83	39
COc1ccccc1N1CC[C@H](NCCS(C)(=O)=O)C1	ZINC000819151279	CC	On-Demand	Anodyne	HTR2A	19	40
COc1ccccc1N1CC[C@H](NCCS(C)(=O)=O)C1	ZINC000819151279	CC	On-Demand	Anodyne	ADRA1A	70	38
COc1ccccc1N1CC[C@H](NCCS(C)(=O)=O)C1	ZINC000819151279	CC	On-Demand	Anodyne	ADRA1B	65	39
COc1ccccc1N1CC[C@H](NCCS(C)(=O)=O)C1	ZINC000819151279	CC	On-Demand	Anodyne	DRD3	62	41
COc1ccccc1N1CC[C@H](NCCS(C)(=O)=O)C1	ZINC000819151279	CC	On-Demand	Anodyne	HTR7	53	42
COc1ccccc1N1CC[C@@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151284	GE	On-Demand	Anodyne	HTR1A	77	45
COc1ccccc1N1CC[C@@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151284	GE	On-Demand	Anodyne	DRD2	67	57
COc1ccccc1N1CC[C@@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151284	GE	On-Demand	Anodyne	DRD4	38	42
COc1ccccc1N1CC[C@@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151284	GE	On-Demand	Anodyne	ADRA1D	74	40
COc1ccccc1N1CC[C@@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151284	GE	On-Demand	Anodyne	HTR2A	18	41
COc1ccccc1N1CC[C@@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151284	GE	On-Demand	Anodyne	ADRA1A	66	40
COc1ccccc1N1CC[C@@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151284	GE	On-Demand	Anodyne	ADRA1B	55	37
COc1ccccc1N1CC[C@@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151284	GE	On-Demand	Anodyne	DRD3	72	44
COc1ccccc1N1CC[C@@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151284	GE	On-Demand	Anodyne	HTR7	51	38
COc1ccccc1N1CC[C@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151285	GE	On-Demand	Anodyne	HTR1A	77	45
COc1ccccc1N1CC[C@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151285	GE	On-Demand	Anodyne	DRD2	67	57
COc1ccccc1N1CC[C@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151285	GE	On-Demand	Anodyne	DRD4	38	42
COc1ccccc1N1CC[C@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151285	GE	On-Demand	Anodyne	ADRA1D	74	40
COc1ccccc1N1CC[C@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151285	GE	On-Demand	Anodyne	HTR2A	18	41
COc1ccccc1N1CC[C@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151285	GE	On-Demand	Anodyne	ADRA1A	66	40
COc1ccccc1N1CC[C@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151285	GE	On-Demand	Anodyne	ADRA1B	55	37
COc1ccccc1N1CC[C@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151285	GE	On-Demand	Anodyne	DRD3	72	44
COc1ccccc1N1CC[C@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151285	GE	On-Demand	Anodyne	HTR7	51	38
COc1ccccc1N1CC[C@@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151287	GE	On-Demand	Anodyne	HTR1A	77	45
COc1ccccc1N1CC[C@@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151287	GE	On-Demand	Anodyne	DRD2	67	57
COc1ccccc1N1CC[C@@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151287	GE	On-Demand	Anodyne	DRD4	38	42
COc1ccccc1N1CC[C@@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151287	GE	On-Demand	Anodyne	ADRA1D	74	40
COc1ccccc1N1CC[C@@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151287	GE	On-Demand	Anodyne	HTR2A	18	41
COc1ccccc1N1CC[C@@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151287	GE	On-Demand	Anodyne	ADRA1A	66	40
COc1ccccc1N1CC[C@@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151287	GE	On-Demand	Anodyne	ADRA1B	55	37
COc1ccccc1N1CC[C@@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151287	GE	On-Demand	Anodyne	DRD3	72	44
COc1ccccc1N1CC[C@@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151287	GE	On-Demand	Anodyne	HTR7	51	38
COc1ccccc1N1CC[C@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151288	GE	On-Demand	Anodyne	HTR1A	77	45
COc1ccccc1N1CC[C@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151288	GE	On-Demand	Anodyne	DRD2	67	57
COc1ccccc1N1CC[C@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151288	GE	On-Demand	Anodyne	DRD4	38	42
COc1ccccc1N1CC[C@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151288	GE	On-Demand	Anodyne	ADRA1D	74	40
COc1ccccc1N1CC[C@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151288	GE	On-Demand	Anodyne	HTR2A	18	41
COc1ccccc1N1CC[C@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151288	GE	On-Demand	Anodyne	ADRA1A	66	40
COc1ccccc1N1CC[C@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151288	GE	On-Demand	Anodyne	ADRA1B	55	37
COc1ccccc1N1CC[C@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151288	GE	On-Demand	Anodyne	DRD3	72	44
COc1ccccc1N1CC[C@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1	ZINC000819151288	GE	On-Demand	Anodyne	HTR7	51	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151289	DF	On-Demand	Anodyne	HTR1A	74	57
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151289	DF	On-Demand	Anodyne	DRD2	59	47
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151289	DF	On-Demand	Anodyne	DRD4	34	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151289	DF	On-Demand	Anodyne	ADRA1D	78	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151289	DF	On-Demand	Anodyne	ADRA1A	66	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151289	DF	On-Demand	Anodyne	ADRA1B	62	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151289	DF	On-Demand	Anodyne	DRD3	55	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151289	DF	On-Demand	Anodyne	SLC6A3	15	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151289	DF	On-Demand	Anodyne	ADRB3	41	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151289	DF	On-Demand	Anodyne	HTR7	47	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151291	DF	On-Demand	Anodyne	HTR1A	74	57
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151291	DF	On-Demand	Anodyne	DRD2	59	47
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151291	DF	On-Demand	Anodyne	DRD4	34	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151291	DF	On-Demand	Anodyne	ADRA1D	78	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151291	DF	On-Demand	Anodyne	ADRA1A	66	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151291	DF	On-Demand	Anodyne	ADRA1B	62	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151291	DF	On-Demand	Anodyne	DRD3	55	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151291	DF	On-Demand	Anodyne	SLC6A3	15	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151291	DF	On-Demand	Anodyne	ADRB3	41	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151291	DF	On-Demand	Anodyne	HTR7	47	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151292	DF	On-Demand	Anodyne	HTR1A	74	57
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151292	DF	On-Demand	Anodyne	DRD2	59	47
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151292	DF	On-Demand	Anodyne	DRD4	34	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151292	DF	On-Demand	Anodyne	ADRA1D	78	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151292	DF	On-Demand	Anodyne	ADRA1A	66	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151292	DF	On-Demand	Anodyne	ADRA1B	62	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151292	DF	On-Demand	Anodyne	DRD3	55	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151292	DF	On-Demand	Anodyne	SLC6A3	15	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151292	DF	On-Demand	Anodyne	ADRB3	41	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151292	DF	On-Demand	Anodyne	HTR7	47	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151293	DF	On-Demand	Anodyne	HTR1A	74	57
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151293	DF	On-Demand	Anodyne	DRD2	59	47
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151293	DF	On-Demand	Anodyne	DRD4	34	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151293	DF	On-Demand	Anodyne	ADRA1D	78	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151293	DF	On-Demand	Anodyne	ADRA1A	66	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151293	DF	On-Demand	Anodyne	ADRA1B	62	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151293	DF	On-Demand	Anodyne	DRD3	55	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151293	DF	On-Demand	Anodyne	SLC6A3	15	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151293	DF	On-Demand	Anodyne	ADRB3	41	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151293	DF	On-Demand	Anodyne	HTR7	47	39
COc1ccccc1N1CC[C@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C1	ZINC000819151316	GD	On-Demand	Anodyne	HTR1A	76	43
COc1ccccc1N1CC[C@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C1	ZINC000819151316	GD	On-Demand	Anodyne	DRD2	60	50
COc1ccccc1N1CC[C@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C1	ZINC000819151316	GD	On-Demand	Anodyne	DRD4	33	42
COc1ccccc1N1CC[C@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C1	ZINC000819151316	GD	On-Demand	Anodyne	ADRA1D	83	41
COc1ccccc1N1CC[C@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C1	ZINC000819151316	GD	On-Demand	Anodyne	ADRA1A	70	41
COc1ccccc1N1CC[C@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C1	ZINC000819151316	GD	On-Demand	Anodyne	ADRA1B	61	40
COc1ccccc1N1CC[C@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C1	ZINC000819151316	GD	On-Demand	Anodyne	DRD3	62	40
COc1ccccc1N1CC[C@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C1	ZINC000819151316	GD	On-Demand	Anodyne	HTR7	49	40
COc1ccccc1N1CC[C@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C1	ZINC000819151316	GD	On-Demand	Anodyne	SFRP1	43	33
COc1ccccc1N1CC[C@@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C1	ZINC000819151317	GD	On-Demand	Anodyne	HTR1A	76	43
COc1ccccc1N1CC[C@@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C1	ZINC000819151317	GD	On-Demand	Anodyne	DRD2	60	50
COc1ccccc1N1CC[C@@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C1	ZINC000819151317	GD	On-Demand	Anodyne	DRD4	33	42
COc1ccccc1N1CC[C@@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C1	ZINC000819151317	GD	On-Demand	Anodyne	ADRA1D	83	41
COc1ccccc1N1CC[C@@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C1	ZINC000819151317	GD	On-Demand	Anodyne	ADRA1A	70	41
COc1ccccc1N1CC[C@@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C1	ZINC000819151317	GD	On-Demand	Anodyne	ADRA1B	61	40
COc1ccccc1N1CC[C@@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C1	ZINC000819151317	GD	On-Demand	Anodyne	DRD3	62	40
COc1ccccc1N1CC[C@@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C1	ZINC000819151317	GD	On-Demand	Anodyne	HTR7	49	40
COc1ccccc1N1CC[C@@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C1	ZINC000819151317	GD	On-Demand	Anodyne	SFRP1	43	33
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819151324	FH	On-Demand	Mild	PAPA1_CARPA	44	45
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819151324	FH	On-Demand	Mild	CTSK	15	45
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819151324	FH	On-Demand	Mild	FPR1	45	40
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819151328	FH	On-Demand	Mild	PAPA1_CARPA	44	45
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819151328	FH	On-Demand	Mild	CTSK	15	45
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819151328	FH	On-Demand	Mild	FPR1	45	40
O=C(CN1CC[C@H](C(=O)O)C1)NCCc1cccc2cccnc12	ZINC000819151330	ED	On-Demand	Anodyne	SLC6A1	61	39
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819151333	FH	On-Demand	Mild	PAPA1_CARPA	44	45
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819151333	FH	On-Demand	Mild	CTSK	15	45
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819151333	FH	On-Demand	Mild	FPR1	45	40
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819151334	FH	On-Demand	Mild	PAPA1_CARPA	44	45
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819151334	FH	On-Demand	Mild	CTSK	15	45
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819151334	FH	On-Demand	Mild	FPR1	45	40
O=C(CN1CC[C@@H](C(=O)O)C1)NCCc1cccc2cccnc12	ZINC000819151336	ED	On-Demand	Anodyne	SLC6A1	61	39
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(NC(=O)c2cccs2)cc1	ZINC000819151338	FE	On-Demand	Anodyne	SLC6A1	93	40
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(NC(=O)c2cccs2)cc1	ZINC000819151338	FE	On-Demand	Anodyne	NOS1	42	41
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(NC(=O)c2cccs2)cc1	ZINC000819151341	FE	On-Demand	Anodyne	SLC6A1	93	40
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(NC(=O)c2cccs2)cc1	ZINC000819151341	FE	On-Demand	Anodyne	NOS1	42	41
O=C(CN1CC[C@H](C(=O)O)C1)NCC1(c2ccccc2)CCOCC1	ZINC000819151344	ED	On-Demand	Anodyne	SLC6A1	95	36
O=C(CN1CC[C@H](C(=O)O)C1)NCC1(c2ccccc2)CCOCC1	ZINC000819151344	ED	On-Demand	Anodyne	KCNA3	45	36
O=C(CN1CC[C@H](C(=O)O)C1)NCC1(c2ccccc2)CCOCC1	ZINC000819151344	ED	On-Demand	Anodyne	NPFFR1	17	42
O=C(CN1CC[C@@H](C(=O)O)C1)NCC1(c2ccccc2)CCOCC1	ZINC000819151347	ED	On-Demand	Anodyne	SLC6A1	95	36
O=C(CN1CC[C@@H](C(=O)O)C1)NCC1(c2ccccc2)CCOCC1	ZINC000819151347	ED	On-Demand	Anodyne	KCNA3	45	36
O=C(CN1CC[C@@H](C(=O)O)C1)NCC1(c2ccccc2)CCOCC1	ZINC000819151347	ED	On-Demand	Anodyne	NPFFR1	17	42
COC(=O)[C@@H]1CCCCN1C(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819151348	ED	On-Demand	Anodyne	PREP	17	44
COC(=O)[C@@H]1CCCCN1C(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819151350	ED	On-Demand	Anodyne	PREP	17	44
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000819151351	EB	On-Demand	Reactive	SLC6A1	89	37
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000819151355	EB	On-Demand	Reactive	SLC6A1	89	37
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1cccc(Cl)c1	ZINC000819151357	EC	On-Demand	Reactive	DRD4	43	33
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1cccc(Cl)c1	ZINC000819151357	EC	On-Demand	Reactive	SLC6A1	130	49
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1cccc(Cl)c1	ZINC000819151357	EC	On-Demand	Reactive	DRD3	19	40
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1cccc(Cl)c1	ZINC000819151357	EC	On-Demand	Reactive	SIGMAR1	15	42
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1cccc(Cl)c1	ZINC000819151357	EC	On-Demand	Reactive	MAPK1	20	47
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1cccc(Cl)c1	ZINC000819151357	EC	On-Demand	Reactive	MCHR1	21	46
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1cccc(Cl)c1	ZINC000819151357	EC	On-Demand	Reactive	CACNA1I	62	47
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1cccc(Cl)c1	ZINC000819151360	EC	On-Demand	Reactive	DRD4	43	33
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1cccc(Cl)c1	ZINC000819151360	EC	On-Demand	Reactive	SLC6A1	130	49
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1cccc(Cl)c1	ZINC000819151360	EC	On-Demand	Reactive	DRD3	19	40
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1cccc(Cl)c1	ZINC000819151360	EC	On-Demand	Reactive	SIGMAR1	15	42
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1cccc(Cl)c1	ZINC000819151360	EC	On-Demand	Reactive	MAPK1	20	47
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1cccc(Cl)c1	ZINC000819151360	EC	On-Demand	Reactive	MCHR1	21	46
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1cccc(Cl)c1	ZINC000819151360	EC	On-Demand	Reactive	CACNA1I	62	47
O=C(CN1CC[C@H](C(=O)O)C1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819151362	EC	On-Demand	Anodyne	DRD2	18	49
O=C(CN1CC[C@H](C(=O)O)C1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819151362	EC	On-Demand	Anodyne	DRD4	43	48
O=C(CN1CC[C@H](C(=O)O)C1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819151362	EC	On-Demand	Anodyne	SLC6A1	96	36
O=C(CN1CC[C@H](C(=O)O)C1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819151362	EC	On-Demand	Anodyne	MAPK14	24	45
O=C(CN1CC[C@H](C(=O)O)C1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819151362	EC	On-Demand	Anodyne	SIGMAR1	19	49
O=C(CN1CC[C@H](C(=O)O)C1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819151362	EC	On-Demand	Anodyne	SSTR5	42	36
O=C(CN1CC[C@H](C(=O)O)C1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819151362	EC	On-Demand	Anodyne	CCR3	22	42
O=C(CN1CC[C@H](C(=O)O)C1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819151362	EC	On-Demand	Anodyne	CCR2	39	42
O=C(CN1CC[C@H](C(=O)O)C1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819151362	EC	On-Demand	Anodyne	MCHR1	28	43
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819151364	EC	On-Demand	Anodyne	DRD2	18	49
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819151364	EC	On-Demand	Anodyne	DRD4	43	48
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819151364	EC	On-Demand	Anodyne	SLC6A1	96	36
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819151364	EC	On-Demand	Anodyne	MAPK14	24	45
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819151364	EC	On-Demand	Anodyne	SIGMAR1	19	49
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819151364	EC	On-Demand	Anodyne	SSTR5	42	36
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819151364	EC	On-Demand	Anodyne	CCR3	22	42
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819151364	EC	On-Demand	Anodyne	CCR2	39	42
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819151364	EC	On-Demand	Anodyne	MCHR1	28	43
O=C(CN1CC[C@@H](C(=O)O)C1)NCC(=O)Nc1ccc(F)c(F)c1	ZINC000819151365	EC	On-Demand	Anodyne	SLC6A1	129	42
O=C(CN1CC[C@@H](C(=O)O)C1)NCC(=O)Nc1ccc(F)c(F)c1	ZINC000819151365	EC	On-Demand	Anodyne	MAPK1	21	42
O=C(CN1CC[C@@H](C(=O)O)C1)NCC(=O)Nc1ccc(F)c(F)c1	ZINC000819151365	EC	On-Demand	Anodyne	MCHR1	29	40
O=C(CN1CC[C@H](C(=O)O)C1)NCC(=O)Nc1ccc(F)c(F)c1	ZINC000819151368	EC	On-Demand	Anodyne	SLC6A1	129	42
O=C(CN1CC[C@H](C(=O)O)C1)NCC(=O)Nc1ccc(F)c(F)c1	ZINC000819151368	EC	On-Demand	Anodyne	MAPK1	21	42
O=C(CN1CC[C@H](C(=O)O)C1)NCC(=O)Nc1ccc(F)c(F)c1	ZINC000819151368	EC	On-Demand	Anodyne	MCHR1	29	40
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccccc1CN1CCOCC1	ZINC000819151371	FC	On-Demand	Anodyne	SLC6A1	106	37
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccccc1CN1CCOCC1	ZINC000819151371	FC	On-Demand	Anodyne	AVPR1B	15	40
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccccc1CN1CCOCC1	ZINC000819151371	FC	On-Demand	Anodyne	SIGMAR1	22	43
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccccc1CN1CCOCC1	ZINC000819151373	FC	On-Demand	Anodyne	SLC6A1	106	37
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccccc1CN1CCOCC1	ZINC000819151373	FC	On-Demand	Anodyne	AVPR1B	15	40
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccccc1CN1CCOCC1	ZINC000819151373	FC	On-Demand	Anodyne	SIGMAR1	22	43
COC(=O)[C@@H]1CCCCN1C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819151374	ED	On-Demand	Anodyne	FKBP1A	40	38
COC(=O)[C@@H]1CCCCN1C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819151374	ED	On-Demand	Anodyne	PREP	26	42
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCOCC3)cc2)c1	ZINC000819151386	FE	On-Demand	Clean	PTGIR	15	43
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCOCC3)cc2)c1	ZINC000819151386	FE	On-Demand	Clean	PRKDC	55	33
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCOCC3)cc2)c1	ZINC000819151386	FE	On-Demand	Clean	PIK3CA	31	41
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCOCC3)cc2)c1	ZINC000819151386	FE	On-Demand	Clean	PIK3CD	17	41
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCOCC3)cc2)c1	ZINC000819151386	FE	On-Demand	Clean	EPHX2	19	41
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCOCC3)cc2)c1	ZINC000819151386	FE	On-Demand	Clean	PIK3CB	30	41
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCOCC3)cc2)c1	ZINC000819151386	FE	On-Demand	Clean	STAT6	65	38
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NCc1ccccc1	ZINC000819151392	GD	On-Demand	Anodyne	DRD4	33	40
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NCc1ccccc1	ZINC000819151392	GD	On-Demand	Anodyne	SLC6A1	128	37
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NCc1ccccc1	ZINC000819151392	GD	On-Demand	Anodyne	KCNQ2	36	41
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NCc1ccccc1	ZINC000819151392	GD	On-Demand	Anodyne	SIGMAR1	21	48
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NCc1ccccc1	ZINC000819151392	GD	On-Demand	Anodyne	SCD	17	45
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NCc1ccccc1	ZINC000819151397	GD	On-Demand	Anodyne	DRD4	33	40
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NCc1ccccc1	ZINC000819151397	GD	On-Demand	Anodyne	SLC6A1	128	37
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NCc1ccccc1	ZINC000819151397	GD	On-Demand	Anodyne	KCNQ2	36	41
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NCc1ccccc1	ZINC000819151397	GD	On-Demand	Anodyne	SIGMAR1	21	48
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NCc1ccccc1	ZINC000819151397	GD	On-Demand	Anodyne	SCD	17	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151414	GE	On-Demand	Anodyne	ADRB2	15	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151414	GE	On-Demand	Anodyne	HTR1A	57	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151414	GE	On-Demand	Anodyne	DRD2	45	47
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151414	GE	On-Demand	Anodyne	ADRA1D	74	47
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151414	GE	On-Demand	Anodyne	ADRA1A	58	47
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151414	GE	On-Demand	Anodyne	ADRA1B	56	47
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151414	GE	On-Demand	Anodyne	ADRB3	29	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151414	GE	On-Demand	Anodyne	HTR7	39	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151415	GE	On-Demand	Anodyne	ADRB2	15	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151415	GE	On-Demand	Anodyne	HTR1A	57	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151415	GE	On-Demand	Anodyne	DRD2	45	47
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151415	GE	On-Demand	Anodyne	ADRA1D	74	47
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151415	GE	On-Demand	Anodyne	ADRA1A	58	47
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151415	GE	On-Demand	Anodyne	ADRA1B	56	47
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151415	GE	On-Demand	Anodyne	ADRB3	29	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151415	GE	On-Demand	Anodyne	HTR7	39	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151417	GE	On-Demand	Anodyne	ADRB2	15	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151417	GE	On-Demand	Anodyne	HTR1A	57	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151417	GE	On-Demand	Anodyne	DRD2	45	47
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151417	GE	On-Demand	Anodyne	ADRA1D	74	47
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151417	GE	On-Demand	Anodyne	ADRA1A	58	47
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151417	GE	On-Demand	Anodyne	ADRA1B	56	47
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151417	GE	On-Demand	Anodyne	ADRB3	29	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151417	GE	On-Demand	Anodyne	HTR7	39	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151419	GE	On-Demand	Anodyne	ADRB2	15	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151419	GE	On-Demand	Anodyne	HTR1A	57	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151419	GE	On-Demand	Anodyne	DRD2	45	47
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151419	GE	On-Demand	Anodyne	ADRA1D	74	47
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151419	GE	On-Demand	Anodyne	ADRA1A	58	47
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151419	GE	On-Demand	Anodyne	ADRA1B	56	47
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151419	GE	On-Demand	Anodyne	ADRB3	29	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819151419	GE	On-Demand	Anodyne	HTR7	39	40
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccnn1C1CCCC1	ZINC000819151423	DD	On-Demand	Anodyne	SLC6A1	89	35
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccnn1C1CCCC1	ZINC000819151428	DD	On-Demand	Anodyne	SLC6A1	89	35
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819151432	EC	On-Demand	Anodyne	SLC6A1	76	34
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819151432	EC	On-Demand	Anodyne	PIK3CA	47	40
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819151432	EC	On-Demand	Anodyne	MAPK1	24	46
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819151432	EC	On-Demand	Anodyne	MTOR	93	40
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819151432	EC	On-Demand	Anodyne	EPHX2	28	48
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819151432	EC	On-Demand	Anodyne	PIK3CG	37	40
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819151432	EC	On-Demand	Anodyne	STAT6	53	34
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819151438	EC	On-Demand	Anodyne	SLC6A1	76	34
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819151438	EC	On-Demand	Anodyne	PIK3CA	47	40
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819151438	EC	On-Demand	Anodyne	MAPK1	24	46
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819151438	EC	On-Demand	Anodyne	MTOR	93	40
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819151438	EC	On-Demand	Anodyne	EPHX2	28	48
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819151438	EC	On-Demand	Anodyne	PIK3CG	37	40
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(N2CCOCC2)cc1	ZINC000819151438	EC	On-Demand	Anodyne	STAT6	53	34
O=C(CN1CC[C@H](C(=O)O)C1)NCc1cnn(-c2ccccc2)c1	ZINC000819151442	EC	On-Demand	Anodyne	DRD4	15	45
O=C(CN1CC[C@H](C(=O)O)C1)NCc1cnn(-c2ccccc2)c1	ZINC000819151442	EC	On-Demand	Anodyne	SLC6A1	96	35
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1cnn(-c2ccccc2)c1	ZINC000819151447	EC	On-Demand	Anodyne	DRD4	15	45
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1cnn(-c2ccccc2)c1	ZINC000819151447	EC	On-Demand	Anodyne	SLC6A1	96	35
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1ccccc1Cl	ZINC000819151451	EC	On-Demand	Reactive	DRD4	40	40
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1ccccc1Cl	ZINC000819151451	EC	On-Demand	Reactive	SLC6A1	161	46
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1ccccc1Cl	ZINC000819151451	EC	On-Demand	Reactive	DRD3	20	40
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1ccccc1Cl	ZINC000819151451	EC	On-Demand	Reactive	SIGMAR1	22	41
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1ccccc1Cl	ZINC000819151451	EC	On-Demand	Reactive	MAPK1	20	42
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1ccccc1Cl	ZINC000819151455	EC	On-Demand	Reactive	DRD4	40	40
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1ccccc1Cl	ZINC000819151455	EC	On-Demand	Reactive	SLC6A1	161	46
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1ccccc1Cl	ZINC000819151455	EC	On-Demand	Reactive	DRD3	20	40
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1ccccc1Cl	ZINC000819151455	EC	On-Demand	Reactive	SIGMAR1	22	41
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1ccccc1Cl	ZINC000819151455	EC	On-Demand	Reactive	MAPK1	20	42
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151457	EC	On-Demand	Anodyne	DRD4	26	42
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151457	EC	On-Demand	Anodyne	ACHE	19	48
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151457	EC	On-Demand	Anodyne	SLC6A1	50	33
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151457	EC	On-Demand	Anodyne	LTA4H	29	44
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151457	EC	On-Demand	Anodyne	HRH3	15	45
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151457	EC	On-Demand	Anodyne	SIGMAR1	28	49
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151457	EC	On-Demand	Anodyne	PIK3CA	37	42
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151457	EC	On-Demand	Anodyne	S1PR4	21	40
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151457	EC	On-Demand	Anodyne	MAPK1	21	40
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151457	EC	On-Demand	Anodyne	MTOR	60	42
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151457	EC	On-Demand	Anodyne	S1PR1	26	47
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151457	EC	On-Demand	Anodyne	EPHX2	27	42
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151457	EC	On-Demand	Anodyne	PIK3CG	25	41
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151457	EC	On-Demand	Anodyne	S1PR5	44	47
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151457	EC	On-Demand	Anodyne	MCHR1	28	43
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151457	EC	On-Demand	Anodyne	CACNA1G	21	44
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151459	EC	On-Demand	Anodyne	DRD4	26	42
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151459	EC	On-Demand	Anodyne	ACHE	19	48
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151459	EC	On-Demand	Anodyne	SLC6A1	50	33
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151459	EC	On-Demand	Anodyne	LTA4H	29	44
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151459	EC	On-Demand	Anodyne	HRH3	15	45
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151459	EC	On-Demand	Anodyne	SIGMAR1	28	49
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151459	EC	On-Demand	Anodyne	PIK3CA	37	42
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151459	EC	On-Demand	Anodyne	S1PR4	21	40
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151459	EC	On-Demand	Anodyne	MAPK1	21	40
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151459	EC	On-Demand	Anodyne	MTOR	60	42
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151459	EC	On-Demand	Anodyne	S1PR1	26	47
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151459	EC	On-Demand	Anodyne	EPHX2	27	42
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151459	EC	On-Demand	Anodyne	PIK3CG	25	41
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151459	EC	On-Demand	Anodyne	S1PR5	44	47
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151459	EC	On-Demand	Anodyne	MCHR1	28	43
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(CN2CCOCC2)cc1	ZINC000819151459	EC	On-Demand	Anodyne	CACNA1G	21	44
O=C(CN1CCC(C(=O)O)CC1)NCC(=O)c1ccccc1	ZINC000819151461	DC	On-Demand	Anodyne	DRD4	27	40
O=C(CN1CCC(C(=O)O)CC1)NCC(=O)c1ccccc1	ZINC000819151461	DC	On-Demand	Anodyne	SLC6A1	93	38
O=C(CN1CCC(C(=O)O)CC1)NCC(=O)c1ccccc1	ZINC000819151461	DC	On-Demand	Anodyne	SIGMAR1	25	43
O=C(CN1CCC(C(=O)O)CC1)NCC(=O)c1ccccc1	ZINC000819151461	DC	On-Demand	Anodyne	CYP2J2	47	35
O=C(CN1CCC[C@@H]1C(=O)O)NNC(=O)c1ccccc1Cl	ZINC000819151464	EC	On-Demand	Reactive	ACE	45	38
O=C(CN1CCC[C@@H]1C(=O)O)NNC(=O)c1ccccc1Cl	ZINC000819151464	EC	On-Demand	Reactive	SLC6A1	115	40
O=C(CN1CCC[C@@H]1C(=O)O)NNC(=O)c1ccccc1Cl	ZINC000819151464	EC	On-Demand	Reactive	PREP	49	37
O=C(CN1CCC[C@H]1C(=O)O)NNC(=O)c1ccccc1Cl	ZINC000819151466	EC	On-Demand	Reactive	ACE	45	38
O=C(CN1CCC[C@H]1C(=O)O)NNC(=O)c1ccccc1Cl	ZINC000819151466	EC	On-Demand	Reactive	SLC6A1	115	40
O=C(CN1CCC[C@H]1C(=O)O)NNC(=O)c1ccccc1Cl	ZINC000819151466	EC	On-Demand	Reactive	PREP	49	37
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccccc1Cn1cccn1	ZINC000819151470	EC	On-Demand	Anodyne	SLC6A1	95	36
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccccc1Cn1cccn1	ZINC000819151470	EC	On-Demand	Anodyne	SIGMAR1	18	41
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccccc1Cn1cccn1	ZINC000819151470	EC	On-Demand	Anodyne	S1PR1	18	40
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccccc1Cn1cccn1	ZINC000819151470	EC	On-Demand	Anodyne	S1PR5	27	40
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccccc1Cn1cccn1	ZINC000819151472	EC	On-Demand	Anodyne	SLC6A1	95	36
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccccc1Cn1cccn1	ZINC000819151472	EC	On-Demand	Anodyne	SIGMAR1	18	41
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccccc1Cn1cccn1	ZINC000819151472	EC	On-Demand	Anodyne	S1PR1	18	40
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccccc1Cn1cccn1	ZINC000819151472	EC	On-Demand	Anodyne	S1PR5	27	40
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc2c(c1)OCCO2	ZINC000819151474	DC	On-Demand	Anodyne	SLC6A1	109	36
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc2c(c1)OCCO2	ZINC000819151476	DC	On-Demand	Anodyne	SLC6A1	109	36
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cccc(CSc2ccccn2)c1	ZINC000819151479	FF	On-Demand	Anodyne	DRD4	21	49
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cccc(CSc2ccccn2)c1	ZINC000819151479	FF	On-Demand	Anodyne	SLC6A1	77	35
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cccc(CSc2ccccn2)c1	ZINC000819151481	FF	On-Demand	Anodyne	DRD4	21	49
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cccc(CSc2ccccn2)c1	ZINC000819151481	FF	On-Demand	Anodyne	SLC6A1	77	35
O=C(CN1CCC(NC(=O)N2CC[C@H](C(=O)O)C2)CC1)Nc1ccccc1	ZINC000819151483	FD	On-Demand	Anodyne	DRD4	33	48
O=C(CN1CCC(NC(=O)N2CC[C@H](C(=O)O)C2)CC1)Nc1ccccc1	ZINC000819151483	FD	On-Demand	Anodyne	SLC6A1	74	35
O=C(CN1CCC(NC(=O)N2CC[C@H](C(=O)O)C2)CC1)Nc1ccccc1	ZINC000819151483	FD	On-Demand	Anodyne	LTA4H	18	40
O=C(CN1CCC(NC(=O)N2CC[C@H](C(=O)O)C2)CC1)Nc1ccccc1	ZINC000819151483	FD	On-Demand	Anodyne	SIGMAR1	19	44
O=C(CN1CCC(NC(=O)N2CC[C@H](C(=O)O)C2)CC1)Nc1ccccc1	ZINC000819151483	FD	On-Demand	Anodyne	CCR3	23	42
O=C(CN1CCC(NC(=O)N2CC[C@H](C(=O)O)C2)CC1)Nc1ccccc1	ZINC000819151483	FD	On-Demand	Anodyne	EPHX2	44	47
O=C(CN1CCC(NC(=O)N2CC[C@@H](C(=O)O)C2)CC1)Nc1ccccc1	ZINC000819151484	FD	On-Demand	Anodyne	DRD4	33	48
O=C(CN1CCC(NC(=O)N2CC[C@@H](C(=O)O)C2)CC1)Nc1ccccc1	ZINC000819151484	FD	On-Demand	Anodyne	SLC6A1	74	35
O=C(CN1CCC(NC(=O)N2CC[C@@H](C(=O)O)C2)CC1)Nc1ccccc1	ZINC000819151484	FD	On-Demand	Anodyne	LTA4H	18	40
O=C(CN1CCC(NC(=O)N2CC[C@@H](C(=O)O)C2)CC1)Nc1ccccc1	ZINC000819151484	FD	On-Demand	Anodyne	SIGMAR1	19	44
O=C(CN1CCC(NC(=O)N2CC[C@@H](C(=O)O)C2)CC1)Nc1ccccc1	ZINC000819151484	FD	On-Demand	Anodyne	CCR3	23	42
O=C(CN1CCC(NC(=O)N2CC[C@@H](C(=O)O)C2)CC1)Nc1ccccc1	ZINC000819151484	FD	On-Demand	Anodyne	EPHX2	44	47
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccco2)cs1	ZINC000819151485	DD	On-Demand	Anodyne	SLC6A1	81	35
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccco2)cs1	ZINC000819151486	DD	On-Demand	Anodyne	SLC6A1	81	35
O=C(CN1CC[C@@H](C(=O)O)C1)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000819151487	FD	On-Demand	Mild	SLC6A1	125	38
O=C(CN1CC[C@@H](C(=O)O)C1)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000819151487	FD	On-Demand	Mild	CCR2	89	40
O=C(CN1CC[C@@H](C(=O)O)C1)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000819151487	FD	On-Demand	Mild	LIPG	47	32
O=C(CN1CC[C@H](C(=O)O)C1)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000819151488	FD	On-Demand	Mild	SLC6A1	125	38
O=C(CN1CC[C@H](C(=O)O)C1)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000819151488	FD	On-Demand	Mild	CCR2	89	40
O=C(CN1CC[C@H](C(=O)O)C1)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000819151488	FD	On-Demand	Mild	LIPG	47	32
O=C(CN1CC[C@@H](C(=O)O)C1)NC[C@@H](c1ccccc1Cl)N1CCCC1	ZINC000819151489	GD	On-Demand	Anodyne	SLC6A1	145	40
O=C(CN1CC[C@@H](C(=O)O)C1)NC[C@H](c1ccccc1Cl)N1CCCC1	ZINC000819151490	GD	On-Demand	Anodyne	SLC6A1	145	40
O=C(CN1CC[C@H](C(=O)O)C1)NC[C@H](c1ccccc1Cl)N1CCCC1	ZINC000819151491	GD	On-Demand	Anodyne	SLC6A1	145	40
O=C(CN1CC[C@H](C(=O)O)C1)NC[C@@H](c1ccccc1Cl)N1CCCC1	ZINC000819151492	GD	On-Demand	Anodyne	SLC6A1	145	40
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccccc1CN1CCCC1=O	ZINC000819151493	FC	On-Demand	Anodyne	SLC6A1	134	40
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccccc1CN1CCCC1=O	ZINC000819151494	FC	On-Demand	Anodyne	SLC6A1	134	40
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1c(F)cc(F)cc1Br	ZINC000819151495	FE	On-Demand	Anodyne	SLC6A1	79	38
O=C(CN1CC[C@H](C(=O)O)C1)Nc1c(F)cc(F)cc1Br	ZINC000819151496	FE	On-Demand	Anodyne	SLC6A1	79	38
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000819151497	ED	On-Demand	Bother	DRD4	17	45
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000819151497	ED	On-Demand	Bother	SLC6A1	45	35
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000819151497	ED	On-Demand	Bother	MAPK1	21	40
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000819151498	ED	On-Demand	Bother	DRD4	17	45
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000819151498	ED	On-Demand	Bother	SLC6A1	45	35
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000819151498	ED	On-Demand	Bother	MAPK1	21	40
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cc(-n2cnnn2)ccc1F	ZINC000819151499	EC	On-Demand	Anodyne	SLC6A1	57	33
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cc(-n2cnnn2)ccc1F	ZINC000819151500	EC	On-Demand	Anodyne	SLC6A1	57	33
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819151501	DE	On-Demand	Anodyne	DRD4	19	48
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819151501	DE	On-Demand	Anodyne	SLC6A1	140	45
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819151501	DE	On-Demand	Anodyne	KCNQ2	57	39
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819151501	DE	On-Demand	Anodyne	CCR3	24	46
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819151501	DE	On-Demand	Anodyne	MAPK1	19	41
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819151501	DE	On-Demand	Anodyne	EPHX2	17	42
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819151501	DE	On-Demand	Anodyne	RBP4	91	42
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819151501	DE	On-Demand	Anodyne	SFRP1	86	39
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819151501	DE	On-Demand	Anodyne	WNT3	48	35
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819151502	DE	On-Demand	Anodyne	DRD4	19	48
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819151502	DE	On-Demand	Anodyne	SLC6A1	140	45
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819151502	DE	On-Demand	Anodyne	KCNQ2	57	39
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819151502	DE	On-Demand	Anodyne	CCR3	24	46
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819151502	DE	On-Demand	Anodyne	MAPK1	19	41
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819151502	DE	On-Demand	Anodyne	EPHX2	17	42
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819151502	DE	On-Demand	Anodyne	RBP4	91	42
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819151502	DE	On-Demand	Anodyne	SFRP1	86	39
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(F)(F)F	ZINC000819151502	DE	On-Demand	Anodyne	WNT3	48	35
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NCc1ccco1	ZINC000819151503	FD	On-Demand	Anodyne	SLC6A1	95	33
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NCc1ccco1	ZINC000819151504	FD	On-Demand	Anodyne	SLC6A1	95	33
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000819151506	FD	On-Demand	Anodyne	CNR1	15	44
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000819151506	FD	On-Demand	Anodyne	DRD4	32	43
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000819151506	FD	On-Demand	Anodyne	SLC6A1	147	38
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000819151506	FD	On-Demand	Anodyne	CNR2	23	44
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000819151506	FD	On-Demand	Anodyne	KCNQ2	41	38
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000819151506	FD	On-Demand	Anodyne	SIGMAR1	19	45
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000819151506	FD	On-Demand	Anodyne	CCR8	42	36
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000819151507	FD	On-Demand	Anodyne	CNR1	15	44
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000819151507	FD	On-Demand	Anodyne	DRD4	32	43
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000819151507	FD	On-Demand	Anodyne	SLC6A1	147	38
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000819151507	FD	On-Demand	Anodyne	CNR2	23	44
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000819151507	FD	On-Demand	Anodyne	KCNQ2	41	38
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000819151507	FD	On-Demand	Anodyne	SIGMAR1	19	45
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CCCC1	ZINC000819151507	FD	On-Demand	Anodyne	CCR8	42	36
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151509	EE	On-Demand	Anodyne	SLC6A1	113	36
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151509	EE	On-Demand	Anodyne	P2RY12	45	33
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151509	EE	On-Demand	Anodyne	MPL	36	40
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151509	EE	On-Demand	Anodyne	CPT1A	46	45
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151509	EE	On-Demand	Anodyne	ROCK1	23	45
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151509	EE	On-Demand	Anodyne	SPHK2	55	34
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151509	EE	On-Demand	Anodyne	ROCK2	16	45
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151509	EE	On-Demand	Anodyne	S1PR1	22	40
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151509	EE	On-Demand	Anodyne	SPHK1	52	38
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151509	EE	On-Demand	Anodyne	TRPA1	15	51
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151509	EE	On-Demand	Anodyne	SLC12A5	19	42
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151510	EE	On-Demand	Anodyne	SLC6A1	113	36
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151510	EE	On-Demand	Anodyne	P2RY12	45	33
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151510	EE	On-Demand	Anodyne	MPL	36	40
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151510	EE	On-Demand	Anodyne	CPT1A	46	45
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151510	EE	On-Demand	Anodyne	ROCK1	23	45
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151510	EE	On-Demand	Anodyne	SPHK2	55	34
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151510	EE	On-Demand	Anodyne	ROCK2	16	45
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151510	EE	On-Demand	Anodyne	S1PR1	22	40
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151510	EE	On-Demand	Anodyne	SPHK1	52	38
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151510	EE	On-Demand	Anodyne	TRPA1	15	51
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccccc2)cs1	ZINC000819151510	EE	On-Demand	Anodyne	SLC12A5	19	42
O=C(CN1CC[C@H](C(=O)O)C1)NCCc1cnn(-c2ccccc2)c1	ZINC000819151511	EC	On-Demand	Anodyne	SLC6A1	83	35
O=C(CN1CC[C@@H](C(=O)O)C1)NCCc1cnn(-c2ccccc2)c1	ZINC000819151512	EC	On-Demand	Anodyne	SLC6A1	83	35
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccc(F)c(F)c2)cs1	ZINC000819151515	FE	On-Demand	Anodyne	SLC6A1	61	40
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccc(F)c(F)c2)cs1	ZINC000819151515	FE	On-Demand	Anodyne	MPL	59	48
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccc(F)c(F)c2)cs1	ZINC000819151515	FE	On-Demand	Anodyne	SPHK2	47	34
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccc(F)c(F)c2)cs1	ZINC000819151515	FE	On-Demand	Anodyne	SPHK1	42	34
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccc(F)c(F)c2)cs1	ZINC000819151516	FE	On-Demand	Anodyne	SLC6A1	61	40
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccc(F)c(F)c2)cs1	ZINC000819151516	FE	On-Demand	Anodyne	MPL	59	48
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccc(F)c(F)c2)cs1	ZINC000819151516	FE	On-Demand	Anodyne	SPHK2	47	34
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccc(F)c(F)c2)cs1	ZINC000819151516	FE	On-Demand	Anodyne	SPHK1	42	34
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccc(N2CCCC2=O)cc1	ZINC000819151517	EC	On-Demand	Anodyne	SLC6A1	71	33
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccc(N2CCCC2=O)cc1	ZINC000819151518	EC	On-Demand	Anodyne	SLC6A1	71	33
O=C(CN1CCC(C(=O)O)CC1)Nc1cc(-n2cnnn2)ccc1F	ZINC000819151523	EC	On-Demand	Anodyne	KCNJ1	40	34
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc2nc(O)[nH]c2c1	ZINC000819151526	DC	On-Demand	Anodyne	SLC6A1	53	33
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc2nc(O)[nH]c2c1	ZINC000819151526	DC	On-Demand	Anodyne	MCHR1	27	44
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc2nc(O)[nH]c2c1	ZINC000819151527	DC	On-Demand	Anodyne	SLC6A1	53	33
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc2nc(O)[nH]c2c1	ZINC000819151527	DC	On-Demand	Anodyne	MCHR1	27	44
O=C(CN1CCC[C@@H]1C(=O)O)NCC(=O)c1ccccc1	ZINC000819151532	CC	On-Demand	Anodyne	ACE	60	44
O=C(CN1CCC[C@@H]1C(=O)O)NCC(=O)c1ccccc1	ZINC000819151532	CC	On-Demand	Anodyne	SLC6A1	82	37
O=C(CN1CCC[C@@H]1C(=O)O)NCC(=O)c1ccccc1	ZINC000819151532	CC	On-Demand	Anodyne	PREP	78	38
O=C(CN1CCC[C@H]1C(=O)O)NCC(=O)c1ccccc1	ZINC000819151533	CC	On-Demand	Anodyne	ACE	60	44
O=C(CN1CCC[C@H]1C(=O)O)NCC(=O)c1ccccc1	ZINC000819151533	CC	On-Demand	Anodyne	SLC6A1	82	37
O=C(CN1CCC[C@H]1C(=O)O)NCC(=O)c1ccccc1	ZINC000819151533	CC	On-Demand	Anodyne	PREP	78	38
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819151564	GG	On-Demand	Anodyne	GRIN2B	22	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819151564	GG	On-Demand	Anodyne	C3AR1	40	39
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819151565	GG	On-Demand	Anodyne	GRIN2B	22	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819151565	GG	On-Demand	Anodyne	C3AR1	40	39
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151566	EF	On-Demand	Anodyne	SLC6A3	15	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151566	EF	On-Demand	Anodyne	GRIN2B	35	46
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151566	EF	On-Demand	Anodyne	ADRB3	44	43
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151566	EF	On-Demand	Anodyne	C3AR1	48	48
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151566	EF	On-Demand	Anodyne	ABCB1	18	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151566	EF	On-Demand	Anodyne	CCR8	40	36
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151567	EF	On-Demand	Anodyne	SLC6A3	15	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151567	EF	On-Demand	Anodyne	GRIN2B	35	46
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151567	EF	On-Demand	Anodyne	ADRB3	44	43
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151567	EF	On-Demand	Anodyne	C3AR1	48	48
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151567	EF	On-Demand	Anodyne	ABCB1	18	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819151567	EF	On-Demand	Anodyne	CCR8	40	36
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151568	EF	On-Demand	Anodyne	SLC6A3	15	42
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151568	EF	On-Demand	Anodyne	GRIN2B	35	46
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151568	EF	On-Demand	Anodyne	ADRB3	44	43
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151568	EF	On-Demand	Anodyne	C3AR1	48	48
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151568	EF	On-Demand	Anodyne	ABCB1	18	40
O=C(CCc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151568	EF	On-Demand	Anodyne	CCR8	40	36
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151569	EF	On-Demand	Anodyne	SLC6A3	15	42
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151569	EF	On-Demand	Anodyne	GRIN2B	35	46
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151569	EF	On-Demand	Anodyne	ADRB3	44	43
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151569	EF	On-Demand	Anodyne	C3AR1	48	48
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151569	EF	On-Demand	Anodyne	ABCB1	18	40
O=C(CCc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819151569	EF	On-Demand	Anodyne	CCR8	40	36
CC(C)(C)NC(=O)c1ccccc1NC(=O)c1cc2c(cn1)OCCO2	ZINC000819151584	FF	On-Demand	Anodyne	G2YM83_BOTF4	43	30
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cc(C)cc(C)c2)C1=O	ZINC000819151588	FF	On-Demand	Anodyne	HTR1A	42	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc(C)cc(C)c2)C1=O	ZINC000819151589	FF	On-Demand	Anodyne	HTR1A	42	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cc(C)cc(C)c2)C1=O	ZINC000819151590	FF	On-Demand	Anodyne	HTR1A	42	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc(C)cc(C)c2)C1=O	ZINC000819151591	FF	On-Demand	Anodyne	HTR1A	42	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C)C1=O	ZINC000819151614	EE	On-Demand	Anodyne	HTR1A	45	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C)C1=O	ZINC000819151615	EE	On-Demand	Anodyne	HTR1A	45	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C)C1=O	ZINC000819151616	EE	On-Demand	Anodyne	HTR1A	45	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C)C1=O	ZINC000819151617	EE	On-Demand	Anodyne	HTR1A	45	38
Cn1cc(CNC(=O)c2cn([C@H]3CCCN(C(=O)OC(C)(C)C)C3)nn2)cn1	ZINC000819151623	GD	On-Demand	Anodyne	PREP	15	41
Cn1cc(CNC(=O)c2cn([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)nn2)cn1	ZINC000819151624	GD	On-Demand	Anodyne	PREP	15	41
NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)C(F)=C1CCC1	ZINC000819151632	GG	On-Demand	Anodyne	MAOB	19	40
NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)C(F)=C1CCC1	ZINC000819151632	GG	On-Demand	Anodyne	HRAS	41	38
NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)C(F)=C1CCC1	ZINC000819151632	GG	On-Demand	Anodyne	FFAR1	28	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C)cc2)C1=O	ZINC000819151643	EE	On-Demand	Anodyne	HTR1A	42	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C)cc2)C1=O	ZINC000819151643	EE	On-Demand	Anodyne	DRD2	25	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C)cc2)C1=O	ZINC000819151643	EE	On-Demand	Anodyne	DRD3	22	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C)cc2)C1=O	ZINC000819151644	EE	On-Demand	Anodyne	HTR1A	42	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C)cc2)C1=O	ZINC000819151644	EE	On-Demand	Anodyne	DRD2	25	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C)cc2)C1=O	ZINC000819151644	EE	On-Demand	Anodyne	DRD3	22	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C)cc2)C1=O	ZINC000819151645	EE	On-Demand	Anodyne	HTR1A	42	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C)cc2)C1=O	ZINC000819151645	EE	On-Demand	Anodyne	DRD2	25	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C)cc2)C1=O	ZINC000819151645	EE	On-Demand	Anodyne	DRD3	22	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C)cc2)C1=O	ZINC000819151646	EE	On-Demand	Anodyne	HTR1A	42	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C)cc2)C1=O	ZINC000819151646	EE	On-Demand	Anodyne	DRD2	25	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C)cc2)C1=O	ZINC000819151646	EE	On-Demand	Anodyne	DRD3	22	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1=O	ZINC000819151652	FE	On-Demand	Anodyne	HTR1A	45	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1=O	ZINC000819151652	FE	On-Demand	Anodyne	ADRA1D	42	34
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1=O	ZINC000819151653	FE	On-Demand	Anodyne	HTR1A	45	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1=O	ZINC000819151653	FE	On-Demand	Anodyne	ADRA1D	42	34
COc1ccccc1N1CC[C@H](NC[C@H](O)c2c(F)cccc2F)C1=O	ZINC000819151654	FE	On-Demand	Anodyne	HTR1A	45	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2c(F)cccc2F)C1=O	ZINC000819151654	FE	On-Demand	Anodyne	ADRA1D	42	34
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2c(F)cccc2F)C1=O	ZINC000819151655	FE	On-Demand	Anodyne	HTR1A	45	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2c(F)cccc2F)C1=O	ZINC000819151655	FE	On-Demand	Anodyne	ADRA1D	42	34
COc1cc(C)ccc1CNC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819151656	EE	On-Demand	Anodyne	CCR2	25	40
COc1cc(C)ccc1CNC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819151657	EE	On-Demand	Anodyne	CCR2	25	40
COc1ccccc1N1CC[C@@H](NCCC(=O)N(C)OC)C1=O	ZINC000819151659	DC	On-Demand	Anodyne	HTR1A	56	41
COc1ccccc1N1CC[C@@H](NCCC(=O)N(C)OC)C1=O	ZINC000819151659	DC	On-Demand	Anodyne	DRD2	39	41
COc1ccccc1N1CC[C@@H](NCCC(=O)N(C)OC)C1=O	ZINC000819151659	DC	On-Demand	Anodyne	DRD3	48	37
COc1ccccc1N1CC[C@H](NCCC(=O)N(C)OC)C1=O	ZINC000819151660	DC	On-Demand	Anodyne	HTR1A	56	41
COc1ccccc1N1CC[C@H](NCCC(=O)N(C)OC)C1=O	ZINC000819151660	DC	On-Demand	Anodyne	DRD2	39	41
COc1ccccc1N1CC[C@H](NCCC(=O)N(C)OC)C1=O	ZINC000819151660	DC	On-Demand	Anodyne	DRD3	48	37
O=C(CN1C(=O)c2ccccc2S1(=O)=O)OCc1ccc(C(=O)O)cc1	ZINC000819151674	GD	On-Demand	Anodyne	ELANE	18	54
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1S(=O)(=O)C(F)F	ZINC000819151682	FD	On-Demand	Anodyne	SLC6A1	115	37
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1S(=O)(=O)C(F)F	ZINC000819151684	FD	On-Demand	Anodyne	SLC6A1	115	37
O=C(CN1CC[C@H](C(=O)O)C1)NC[C@H]1CCN(c2ccccc2)C1	ZINC000819151686	ED	On-Demand	Anodyne	SLC6A1	123	38
O=C(CN1CC[C@H](C(=O)O)C1)NC[C@H]1CCN(c2ccccc2)C1	ZINC000819151686	ED	On-Demand	Anodyne	SIGMAR1	15	40
O=C(CN1CC[C@H](C(=O)O)C1)NC[C@H]1CCN(c2ccccc2)C1	ZINC000819151686	ED	On-Demand	Anodyne	MAPK1	20	41
O=C(CN1CC[C@H](C(=O)O)C1)NC[C@H]1CCN(c2ccccc2)C1	ZINC000819151686	ED	On-Demand	Anodyne	CACNA1I	52	35
O=C(CN1CC[C@H](C(=O)O)C1)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000819151689	ED	On-Demand	Anodyne	SLC6A1	123	38
O=C(CN1CC[C@H](C(=O)O)C1)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000819151689	ED	On-Demand	Anodyne	SIGMAR1	15	40
O=C(CN1CC[C@H](C(=O)O)C1)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000819151689	ED	On-Demand	Anodyne	MAPK1	20	41
O=C(CN1CC[C@H](C(=O)O)C1)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000819151689	ED	On-Demand	Anodyne	CACNA1I	52	35
O=C(CN1CC[C@@H](C(=O)O)C1)NC[C@H]1CCN(c2ccccc2)C1	ZINC000819151691	ED	On-Demand	Anodyne	SLC6A1	123	38
O=C(CN1CC[C@@H](C(=O)O)C1)NC[C@H]1CCN(c2ccccc2)C1	ZINC000819151691	ED	On-Demand	Anodyne	SIGMAR1	15	40
O=C(CN1CC[C@@H](C(=O)O)C1)NC[C@H]1CCN(c2ccccc2)C1	ZINC000819151691	ED	On-Demand	Anodyne	MAPK1	20	41
O=C(CN1CC[C@@H](C(=O)O)C1)NC[C@H]1CCN(c2ccccc2)C1	ZINC000819151691	ED	On-Demand	Anodyne	CACNA1I	52	35
O=C(CN1CC[C@@H](C(=O)O)C1)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000819151693	ED	On-Demand	Anodyne	SLC6A1	123	38
O=C(CN1CC[C@@H](C(=O)O)C1)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000819151693	ED	On-Demand	Anodyne	SIGMAR1	15	40
O=C(CN1CC[C@@H](C(=O)O)C1)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000819151693	ED	On-Demand	Anodyne	MAPK1	20	41
O=C(CN1CC[C@@H](C(=O)O)C1)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000819151693	ED	On-Demand	Anodyne	CACNA1I	52	35
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1N1CCCC1=O	ZINC000819151698	ED	On-Demand	Anodyne	SLC6A1	137	39
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1N1CCCC1=O	ZINC000819151698	ED	On-Demand	Anodyne	KCNQ2	75	45
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1N1CCCC1=O	ZINC000819151699	ED	On-Demand	Anodyne	SLC6A1	137	39
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1N1CCCC1=O	ZINC000819151699	ED	On-Demand	Anodyne	KCNQ2	75	45
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccon1	ZINC000819151700	BC	On-Demand	Anodyne	SLC6A1	106	39
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccon1	ZINC000819151701	BC	On-Demand	Anodyne	SLC6A1	106	39
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819151702	FC	On-Demand	Anodyne	SLC6A1	105	36
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819151702	FC	On-Demand	Anodyne	L3MBTL3	87	45
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819151703	FC	On-Demand	Anodyne	SLC6A1	105	36
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819151703	FC	On-Demand	Anodyne	L3MBTL3	87	45
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc2c(c1)OC1(CCCCC1)O2	ZINC000819151704	FE	On-Demand	Anodyne	SLC6A1	60	35
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc2c(c1)OC1(CCCCC1)O2	ZINC000819151705	FE	On-Demand	Anodyne	SLC6A1	60	35
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000819151708	FE	On-Demand	Anodyne	DRD4	25	43
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000819151708	FE	On-Demand	Anodyne	SLC6A1	138	38
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000819151708	FE	On-Demand	Anodyne	CCR3	23	41
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000819151708	FE	On-Demand	Anodyne	NR1H4	15	43
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000819151708	FE	On-Demand	Anodyne	NR2E3	65	36
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000819151708	FE	On-Demand	Anodyne	KCNK3	48	36
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000819151708	FE	On-Demand	Anodyne	KCNK9	40	33
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000819151709	FE	On-Demand	Anodyne	DRD4	25	43
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000819151709	FE	On-Demand	Anodyne	SLC6A1	138	38
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000819151709	FE	On-Demand	Anodyne	CCR3	23	41
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000819151709	FE	On-Demand	Anodyne	NR1H4	15	43
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000819151709	FE	On-Demand	Anodyne	NR2E3	65	36
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000819151709	FE	On-Demand	Anodyne	KCNK3	48	36
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccccc1	ZINC000819151709	FE	On-Demand	Anodyne	KCNK9	40	33
O=C(CN1CC[C@@H](C(=O)O)C1)NCC(=O)c1ccccc1	ZINC000819151710	CC	On-Demand	Anodyne	SLC6A1	157	44
O=C(CN1CC[C@@H](C(=O)O)C1)NCC(=O)c1ccccc1	ZINC000819151710	CC	On-Demand	Anodyne	SIGMAR1	21	41
O=C(CN1CC[C@@H](C(=O)O)C1)NCC(=O)c1ccccc1	ZINC000819151710	CC	On-Demand	Anodyne	CYP2J2	49	36
O=C(CN1CC[C@H](C(=O)O)C1)NCC(=O)c1ccccc1	ZINC000819151711	CC	On-Demand	Anodyne	SLC6A1	157	44
O=C(CN1CC[C@H](C(=O)O)C1)NCC(=O)c1ccccc1	ZINC000819151711	CC	On-Demand	Anodyne	SIGMAR1	21	41
O=C(CN1CC[C@H](C(=O)O)C1)NCC(=O)c1ccccc1	ZINC000819151711	CC	On-Demand	Anodyne	CYP2J2	49	36
O=C(CN1CC[C@H](C(=O)O)C1)NCC(=O)N1CCCC1	ZINC000819151712	CB	On-Demand	Anodyne	SLC6A1	44	36
O=C(CN1CC[C@@H](C(=O)O)C1)NCC(=O)N1CCCC1	ZINC000819151713	CB	On-Demand	Anodyne	SLC6A1	44	36
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000819151714	FD	On-Demand	Anodyne	SLC6A1	57	33
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000819151714	FD	On-Demand	Anodyne	F13A1	40	32
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000819151715	FD	On-Demand	Anodyne	SLC6A1	57	33
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000819151715	FD	On-Demand	Anodyne	F13A1	40	32
O=C(CN1CC[C@H](C(=O)O)C1)c1c[nH]c2ccccc12	ZINC000819151716	CD	On-Demand	Anodyne	SLC6A1	148	41
O=C(CN1CC[C@H](C(=O)O)C1)c1c[nH]c2ccccc12	ZINC000819151716	CD	On-Demand	Anodyne	SSTR2	47	36
O=C(CN1CC[C@H](C(=O)O)C1)c1c[nH]c2ccccc12	ZINC000819151716	CD	On-Demand	Anodyne	GRIN2B	17	67
O=C(CN1CC[C@@H](C(=O)O)C1)c1c[nH]c2ccccc12	ZINC000819151717	CD	On-Demand	Anodyne	SLC6A1	148	41
O=C(CN1CC[C@@H](C(=O)O)C1)c1c[nH]c2ccccc12	ZINC000819151717	CD	On-Demand	Anodyne	SSTR2	47	36
O=C(CN1CC[C@@H](C(=O)O)C1)c1c[nH]c2ccccc12	ZINC000819151717	CD	On-Demand	Anodyne	GRIN2B	17	67
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccc2c(c1)OCO2	ZINC000819151718	DC	On-Demand	Anodyne	PDE5A	23	50
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccc2c(c1)OCO2	ZINC000819151718	DC	On-Demand	Anodyne	SLC6A1	79	34
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccc2c(c1)OCO2	ZINC000819151718	DC	On-Demand	Anodyne	EDNRB	55	44
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccc2c(c1)OCO2	ZINC000819151718	DC	On-Demand	Anodyne	EDNRA	60	44
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccc2c(c1)OCO2	ZINC000819151718	DC	On-Demand	Anodyne	SIGMAR1	16	51
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccc2c(c1)OCO2	ZINC000819151718	DC	On-Demand	Anodyne	NOS2	116	45
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccc2c(c1)OCO2	ZINC000819151718	DC	On-Demand	Anodyne	PDE11A	45	35
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccc2c(c1)OCO2	ZINC000819151718	DC	On-Demand	Anodyne	MCHR1	28	51
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccc2c(c1)OCO2	ZINC000819151719	DC	On-Demand	Anodyne	PDE5A	23	50
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccc2c(c1)OCO2	ZINC000819151719	DC	On-Demand	Anodyne	SLC6A1	79	34
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccc2c(c1)OCO2	ZINC000819151719	DC	On-Demand	Anodyne	EDNRB	55	44
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccc2c(c1)OCO2	ZINC000819151719	DC	On-Demand	Anodyne	EDNRA	60	44
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccc2c(c1)OCO2	ZINC000819151719	DC	On-Demand	Anodyne	SIGMAR1	16	51
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccc2c(c1)OCO2	ZINC000819151719	DC	On-Demand	Anodyne	NOS2	116	45
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccc2c(c1)OCO2	ZINC000819151719	DC	On-Demand	Anodyne	PDE11A	45	35
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccc2c(c1)OCO2	ZINC000819151719	DC	On-Demand	Anodyne	MCHR1	28	51
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819151720	EB	On-Demand	Reactive	SLC6A1	51	33
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819151721	EB	On-Demand	Reactive	SLC6A1	51	33
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151722	EE	On-Demand	Anodyne	MAOB	16	41
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151722	EE	On-Demand	Anodyne	SLC6A1	77	38
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151722	EE	On-Demand	Anodyne	MPL	48	43
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151722	EE	On-Demand	Anodyne	CPT1A	25	42
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151722	EE	On-Demand	Anodyne	ROCK1	21	47
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151722	EE	On-Demand	Anodyne	HDAC9	15	52
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151722	EE	On-Demand	Anodyne	SPHK1	34	40
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151722	EE	On-Demand	Anodyne	TRPA1	15	43
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151722	EE	On-Demand	Anodyne	WNT3A	46	36
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151722	EE	On-Demand	Anodyne	SLC27A1	45	43
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151723	EE	On-Demand	Anodyne	MAOB	16	41
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151723	EE	On-Demand	Anodyne	SLC6A1	77	38
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151723	EE	On-Demand	Anodyne	MPL	48	43
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151723	EE	On-Demand	Anodyne	CPT1A	25	42
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151723	EE	On-Demand	Anodyne	ROCK1	21	47
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151723	EE	On-Demand	Anodyne	HDAC9	15	52
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151723	EE	On-Demand	Anodyne	SPHK1	34	40
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151723	EE	On-Demand	Anodyne	TRPA1	15	43
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151723	EE	On-Demand	Anodyne	WNT3A	46	36
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819151723	EE	On-Demand	Anodyne	SLC27A1	45	43
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1OC(F)F	ZINC000819151725	DD	On-Demand	Anodyne	SLC6A1	143	38
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1OC(F)F	ZINC000819151725	DD	On-Demand	Anodyne	KCNQ2	44	36
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1OC(F)F	ZINC000819151726	DD	On-Demand	Anodyne	SLC6A1	143	38
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1OC(F)F	ZINC000819151726	DD	On-Demand	Anodyne	KCNQ2	44	36
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccc(N2CCOCC2)c(F)c1	ZINC000819151727	FC	On-Demand	Clean	SLC6A1	56	32
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccc(N2CCOCC2)c(F)c1	ZINC000819151728	FC	On-Demand	Clean	SLC6A1	56	32
O=C(CN1CC[C@H](C(=O)O)C1)N[C@H]1CCOc2ccccc21	ZINC000819151729	DD	On-Demand	Anodyne	SLC6A1	121	39
O=C(CN1CC[C@H](C(=O)O)C1)N[C@H]1CCOc2ccccc21	ZINC000819151729	DD	On-Demand	Anodyne	BDKRB1	30	45
O=C(CN1CC[C@H](C(=O)O)C1)N[C@H]1CCOc2ccccc21	ZINC000819151729	DD	On-Demand	Anodyne	LUXR	67	37
O=C(CN1CC[C@H](C(=O)O)C1)N[C@H]1CCOc2ccccc21	ZINC000819151729	DD	On-Demand	Anodyne	TRAR	75	39
O=C(CN1CC[C@H](C(=O)O)C1)N[C@H]1CCOc2ccccc21	ZINC000819151729	DD	On-Demand	Anodyne	LASR	47	39
O=C(CN1CC[C@@H](C(=O)O)C1)N[C@@H]1CCOc2ccccc21	ZINC000819151730	DD	On-Demand	Anodyne	SLC6A1	121	39
O=C(CN1CC[C@@H](C(=O)O)C1)N[C@@H]1CCOc2ccccc21	ZINC000819151730	DD	On-Demand	Anodyne	BDKRB1	30	45
O=C(CN1CC[C@@H](C(=O)O)C1)N[C@@H]1CCOc2ccccc21	ZINC000819151730	DD	On-Demand	Anodyne	LUXR	67	37
O=C(CN1CC[C@@H](C(=O)O)C1)N[C@@H]1CCOc2ccccc21	ZINC000819151730	DD	On-Demand	Anodyne	TRAR	75	39
O=C(CN1CC[C@@H](C(=O)O)C1)N[C@@H]1CCOc2ccccc21	ZINC000819151730	DD	On-Demand	Anodyne	LASR	47	39
O=C(CN1CC[C@H](C(=O)O)C1)N[C@@H]1CCOc2ccccc21	ZINC000819151731	DD	On-Demand	Anodyne	SLC6A1	121	39
O=C(CN1CC[C@H](C(=O)O)C1)N[C@@H]1CCOc2ccccc21	ZINC000819151731	DD	On-Demand	Anodyne	BDKRB1	30	45
O=C(CN1CC[C@H](C(=O)O)C1)N[C@@H]1CCOc2ccccc21	ZINC000819151731	DD	On-Demand	Anodyne	LUXR	67	37
O=C(CN1CC[C@H](C(=O)O)C1)N[C@@H]1CCOc2ccccc21	ZINC000819151731	DD	On-Demand	Anodyne	TRAR	75	39
O=C(CN1CC[C@H](C(=O)O)C1)N[C@@H]1CCOc2ccccc21	ZINC000819151731	DD	On-Demand	Anodyne	LASR	47	39
O=C(CN1CC[C@@H](C(=O)O)C1)N[C@H]1CCOc2ccccc21	ZINC000819151732	DD	On-Demand	Anodyne	SLC6A1	121	39
O=C(CN1CC[C@@H](C(=O)O)C1)N[C@H]1CCOc2ccccc21	ZINC000819151732	DD	On-Demand	Anodyne	BDKRB1	30	45
O=C(CN1CC[C@@H](C(=O)O)C1)N[C@H]1CCOc2ccccc21	ZINC000819151732	DD	On-Demand	Anodyne	LUXR	67	37
O=C(CN1CC[C@@H](C(=O)O)C1)N[C@H]1CCOc2ccccc21	ZINC000819151732	DD	On-Demand	Anodyne	TRAR	75	39
O=C(CN1CC[C@@H](C(=O)O)C1)N[C@H]1CCOc2ccccc21	ZINC000819151732	DD	On-Demand	Anodyne	LASR	47	39
O=C(CN1CC[C@@H](C(=O)O)C1)NCCCN1CCCCCC1=O	ZINC000819151733	EC	On-Demand	Anodyne	SLC6A1	56	35
O=C(CN1CC[C@H](C(=O)O)C1)NCCCN1CCCCCC1=O	ZINC000819151734	EC	On-Demand	Anodyne	SLC6A1	56	35
O=C(CN1CCCC1=O)OCc1ccc(C(=O)O)cc1	ZINC000819151735	CD	On-Demand	Anodyne	SLC12A5	48	36
O=C(CN1CCCCC1=O)OCc1ccc(C(=O)O)cc1	ZINC000819151736	CD	On-Demand	Anodyne	SLC12A5	48	35
O=C(CN1CCC[C@@H]1C(=O)O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1	ZINC000819151737	GE	On-Demand	Bother	CPT1A	22	40
O=C(CN1CCC[C@H]1C(=O)O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1	ZINC000819151738	GE	On-Demand	Bother	CPT1A	22	40
O=C(CN1CC[C@H](C(=O)O)C1)NCC(=O)Nc1ccccc1Br	ZINC000819151739	GC	On-Demand	Anodyne	DRD4	15	40
O=C(CN1CC[C@H](C(=O)O)C1)NCC(=O)Nc1ccccc1Br	ZINC000819151739	GC	On-Demand	Anodyne	SLC6A1	126	39
O=C(CN1CC[C@@H](C(=O)O)C1)NCC(=O)Nc1ccccc1Br	ZINC000819151740	GC	On-Demand	Anodyne	DRD4	15	40
O=C(CN1CC[C@@H](C(=O)O)C1)NCC(=O)Nc1ccccc1Br	ZINC000819151740	GC	On-Demand	Anodyne	SLC6A1	126	39
O=C(CN1CCCC1=O)Nc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819151741	FF	On-Demand	Anodyne	CYSLTR1	16	43
O=C(CN1CCCC1=O)Nc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819151741	FF	On-Demand	Anodyne	LTA4H	31	45
O=C(CN1CCCC1=O)Nc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819151741	FF	On-Demand	Anodyne	EPHX2	22	42
O=C(CN1CCCC1=O)Nc1cccc(OCc2ccc(C(=O)O)cc2)c1	ZINC000819151741	FF	On-Demand	Anodyne	TAAR1	41	39
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc2c(c1)OC1(CCCC1)O2	ZINC000819151742	EE	On-Demand	Anodyne	SLC6A1	75	35
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc2c(c1)OC1(CCCC1)O2	ZINC000819151743	EE	On-Demand	Anodyne	SLC6A1	75	35
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151744	EC	On-Demand	Anodyne	DRD2	15	47
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151744	EC	On-Demand	Anodyne	DRD4	43	47
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151744	EC	On-Demand	Anodyne	SLC6A1	114	37
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151744	EC	On-Demand	Anodyne	DRD3	22	43
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151744	EC	On-Demand	Anodyne	MAPK14	28	40
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151744	EC	On-Demand	Anodyne	SIGMAR1	16	47
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151744	EC	On-Demand	Anodyne	CCR3	42	42
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151744	EC	On-Demand	Anodyne	CCKBR	23	40
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151744	EC	On-Demand	Anodyne	EPHX2	25	42
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151744	EC	On-Demand	Anodyne	MCHR1	32	43
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151744	EC	On-Demand	Anodyne	KCNK3	70	37
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151745	EC	On-Demand	Anodyne	DRD2	15	47
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151745	EC	On-Demand	Anodyne	DRD4	43	47
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151745	EC	On-Demand	Anodyne	SLC6A1	114	37
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151745	EC	On-Demand	Anodyne	DRD3	22	43
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151745	EC	On-Demand	Anodyne	MAPK14	28	40
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151745	EC	On-Demand	Anodyne	SIGMAR1	16	47
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151745	EC	On-Demand	Anodyne	CCR3	42	42
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151745	EC	On-Demand	Anodyne	CCKBR	23	40
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151745	EC	On-Demand	Anodyne	EPHX2	25	42
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151745	EC	On-Demand	Anodyne	MCHR1	32	43
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819151745	EC	On-Demand	Anodyne	KCNK3	70	37
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1	ZINC000819151746	GE	On-Demand	Bother	CPT1A	24	40
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1	ZINC000819151746	GE	On-Demand	Bother	VCP	30	49
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1	ZINC000819151747	GE	On-Demand	Bother	CPT1A	24	40
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1	ZINC000819151747	GE	On-Demand	Bother	VCP	30	49
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cccc(N2CCCC2=O)c1	ZINC000819151748	ED	On-Demand	Anodyne	SLC6A1	129	35
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cccc(N2CCCC2=O)c1	ZINC000819151748	ED	On-Demand	Anodyne	MAPK1	20	40
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cccc(N2CCCC2=O)c1	ZINC000819151749	ED	On-Demand	Anodyne	SLC6A1	129	35
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cccc(N2CCCC2=O)c1	ZINC000819151749	ED	On-Demand	Anodyne	MAPK1	20	40
O=C(CN1CC[C@H](C(=O)O)C1)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819151750	GC	On-Demand	Anodyne	L3MBTL3	56	40
O=C(CN1CC[C@@H](C(=O)O)C1)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819151751	GC	On-Demand	Anodyne	L3MBTL3	56	40
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1ccc(F)cc1	ZINC000819151752	DB	On-Demand	Reactive	DRD4	19	47
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1ccc(F)cc1	ZINC000819151752	DB	On-Demand	Reactive	HTR2A	25	44
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1ccc(F)cc1	ZINC000819151752	DB	On-Demand	Reactive	SLC6A1	134	40
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1ccc(F)cc1	ZINC000819151752	DB	On-Demand	Reactive	SIGMAR1	18	41
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1ccc(F)cc1	ZINC000819151752	DB	On-Demand	Reactive	CCR3	30	42
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1ccc(F)cc1	ZINC000819151752	DB	On-Demand	Reactive	SLC18A3	21	40
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1ccc(F)cc1	ZINC000819151752	DB	On-Demand	Reactive	CACNA1G	40	39
O=C(CN1CC[C@H](C(=O)O)C1)NNC(=O)c1ccc(F)cc1	ZINC000819151752	DB	On-Demand	Reactive	WNT3A	50	38
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1ccc(F)cc1	ZINC000819151753	DB	On-Demand	Reactive	DRD4	19	47
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1ccc(F)cc1	ZINC000819151753	DB	On-Demand	Reactive	HTR2A	25	44
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1ccc(F)cc1	ZINC000819151753	DB	On-Demand	Reactive	SLC6A1	134	40
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1ccc(F)cc1	ZINC000819151753	DB	On-Demand	Reactive	SIGMAR1	18	41
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1ccc(F)cc1	ZINC000819151753	DB	On-Demand	Reactive	CCR3	30	42
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1ccc(F)cc1	ZINC000819151753	DB	On-Demand	Reactive	SLC18A3	21	40
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1ccc(F)cc1	ZINC000819151753	DB	On-Demand	Reactive	CACNA1G	40	39
O=C(CN1CC[C@@H](C(=O)O)C1)NNC(=O)c1ccc(F)cc1	ZINC000819151753	DB	On-Demand	Reactive	WNT3A	50	38
O=C(CN1CC[C@@H](C(=O)O)C1)NCCCN1CCCC1=O	ZINC000819151754	CB	On-Demand	Anodyne	SLC6A1	71	35
O=C(CN1CC[C@H](C(=O)O)C1)NCCCN1CCCC1=O	ZINC000819151755	CB	On-Demand	Anodyne	SLC6A1	71	35
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nc(-c2cccs2)cs1	ZINC000819151756	EE	On-Demand	Anodyne	SLC6A1	49	40
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nc(-c2cccs2)cs1	ZINC000819151757	EE	On-Demand	Anodyne	SLC6A1	49	40
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CC1	ZINC000819151758	EC	On-Demand	Anodyne	DRD4	34	44
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CC1	ZINC000819151758	EC	On-Demand	Anodyne	SLC6A1	136	37
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CC1	ZINC000819151758	EC	On-Demand	Anodyne	SIGMAR1	19	45
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CC1	ZINC000819151758	EC	On-Demand	Anodyne	CCR8	43	32
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CC1	ZINC000819151759	EC	On-Demand	Anodyne	DRD4	34	44
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CC1	ZINC000819151759	EC	On-Demand	Anodyne	SLC6A1	136	37
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CC1	ZINC000819151759	EC	On-Demand	Anodyne	SIGMAR1	19	45
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)NC1CC1	ZINC000819151759	EC	On-Demand	Anodyne	CCR8	43	32
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(O)cc1	ZINC000819151760	CC	On-Demand	Anodyne	SLC6A1	124	38
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccc(O)cc1	ZINC000819151760	CC	On-Demand	Anodyne	MAPK1	24	51
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(O)cc1	ZINC000819151761	CC	On-Demand	Anodyne	SLC6A1	124	38
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccc(O)cc1	ZINC000819151761	CC	On-Demand	Anodyne	MAPK1	24	51
O=C(CN1CC[C@@H](C(=O)O)C1)NC(=O)NCc1cccs1	ZINC000819151764	DC	On-Demand	Anodyne	SLC6A1	78	36
O=C(CN1CC[C@H](C(=O)O)C1)NC(=O)NCc1cccs1	ZINC000819151765	DC	On-Demand	Anodyne	SLC6A1	78	36
O=C(CN1CC[C@H](C(=O)O)C1)Nc1nncs1	ZINC000819151766	CB	On-Demand	Anodyne	SLC6A1	41	33
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1nncs1	ZINC000819151767	CB	On-Demand	Anodyne	SLC6A1	41	33
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cccnc1Cl	ZINC000819151768	CD	On-Demand	Anodyne	DRD4	17	44
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cccnc1Cl	ZINC000819151768	CD	On-Demand	Anodyne	SLC6A1	93	35
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cccnc1Cl	ZINC000819151768	CD	On-Demand	Anodyne	MAPK1	21	42
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1cccnc1Cl	ZINC000819151768	CD	On-Demand	Anodyne	G2YM83_BOTF4	67	35
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cccnc1Cl	ZINC000819151769	CD	On-Demand	Anodyne	DRD4	17	44
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cccnc1Cl	ZINC000819151769	CD	On-Demand	Anodyne	SLC6A1	93	35
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cccnc1Cl	ZINC000819151769	CD	On-Demand	Anodyne	MAPK1	21	42
O=C(CN1CC[C@H](C(=O)O)C1)Nc1cccnc1Cl	ZINC000819151769	CD	On-Demand	Anodyne	G2YM83_BOTF4	67	35
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819151770	FE	On-Demand	Anodyne	SLC6A1	47	35
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819151770	FE	On-Demand	Anodyne	CCR3	58	34
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819151770	FE	On-Demand	Anodyne	CDK5	49	41
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819151770	FE	On-Demand	Anodyne	WNT3A	45	33
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819151770	FE	On-Demand	Anodyne	MGEA5	35	41
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819151770	FE	On-Demand	Anodyne	SLC27A1	58	41
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819151771	FE	On-Demand	Anodyne	SLC6A1	47	35
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819151771	FE	On-Demand	Anodyne	CCR3	58	34
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819151771	FE	On-Demand	Anodyne	CDK5	49	41
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819151771	FE	On-Demand	Anodyne	WNT3A	45	33
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819151771	FE	On-Demand	Anodyne	MGEA5	35	41
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819151771	FE	On-Demand	Anodyne	SLC27A1	58	41
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccc(F)cc1	ZINC000819151772	GE	On-Demand	Anodyne	DRD4	21	47
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccc(F)cc1	ZINC000819151772	GE	On-Demand	Anodyne	AVPR2	53	34
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccc(F)cc1	ZINC000819151772	GE	On-Demand	Anodyne	SLC6A1	142	42
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccc(F)cc1	ZINC000819151772	GE	On-Demand	Anodyne	AVPR1A	25	40
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccc(F)cc1	ZINC000819151772	GE	On-Demand	Anodyne	KCNQ2	36	42
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccc(F)cc1	ZINC000819151772	GE	On-Demand	Anodyne	CCR3	59	44
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccc(F)cc1	ZINC000819151772	GE	On-Demand	Anodyne	NR2E3	66	36
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccc(F)cc1	ZINC000819151772	GE	On-Demand	Anodyne	WNT3A	45	33
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccc(F)cc1	ZINC000819151773	GE	On-Demand	Anodyne	DRD4	21	47
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccc(F)cc1	ZINC000819151773	GE	On-Demand	Anodyne	AVPR2	53	34
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccc(F)cc1	ZINC000819151773	GE	On-Demand	Anodyne	SLC6A1	142	42
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccc(F)cc1	ZINC000819151773	GE	On-Demand	Anodyne	AVPR1A	25	40
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccc(F)cc1	ZINC000819151773	GE	On-Demand	Anodyne	KCNQ2	36	42
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccc(F)cc1	ZINC000819151773	GE	On-Demand	Anodyne	CCR3	59	44
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccc(F)cc1	ZINC000819151773	GE	On-Demand	Anodyne	NR2E3	66	36
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccccc1C(=O)Nc1ccc(F)cc1	ZINC000819151773	GE	On-Demand	Anodyne	WNT3A	45	33
O=C(CN1CC[C@@H](C(=O)O)C1)Nc1ccnn1Cc1cccs1	ZINC000819151775	ED	On-Demand	Anodyne	SLC6A1	58	34
O=C(CN1CC[C@H](C(=O)O)C1)Nc1ccnn1Cc1cccs1	ZINC000819151776	ED	On-Demand	Anodyne	SLC6A1	58	34
COc1cc(C)ccc1CNC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819151786	EH	On-Demand	Anodyne	CCR2	33	45
COc1cc(C)ccc1CNC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819151787	EH	On-Demand	Anodyne	CCR2	33	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151807	GE	On-Demand	Anodyne	HTR1A	75	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151807	GE	On-Demand	Anodyne	DRD2	64	57
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151807	GE	On-Demand	Anodyne	DRD4	34	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151807	GE	On-Demand	Anodyne	ADRA1D	81	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151807	GE	On-Demand	Anodyne	HTR2A	18	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151807	GE	On-Demand	Anodyne	ADRA1A	71	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151807	GE	On-Demand	Anodyne	ADRA1B	56	37
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151807	GE	On-Demand	Anodyne	DRD3	68	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151807	GE	On-Demand	Anodyne	HTR7	48	36
COc1ccccc1N1CC[C@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151808	GE	On-Demand	Anodyne	HTR1A	75	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151808	GE	On-Demand	Anodyne	DRD2	64	57
COc1ccccc1N1CC[C@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151808	GE	On-Demand	Anodyne	DRD4	34	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151808	GE	On-Demand	Anodyne	ADRA1D	81	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151808	GE	On-Demand	Anodyne	HTR2A	18	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151808	GE	On-Demand	Anodyne	ADRA1A	71	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151808	GE	On-Demand	Anodyne	ADRA1B	56	37
COc1ccccc1N1CC[C@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151808	GE	On-Demand	Anodyne	DRD3	68	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151808	GE	On-Demand	Anodyne	HTR7	48	36
COc1ccccc1N1CC[C@@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151809	GE	On-Demand	Anodyne	HTR1A	75	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151809	GE	On-Demand	Anodyne	DRD2	64	57
COc1ccccc1N1CC[C@@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151809	GE	On-Demand	Anodyne	DRD4	34	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151809	GE	On-Demand	Anodyne	ADRA1D	81	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151809	GE	On-Demand	Anodyne	HTR2A	18	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151809	GE	On-Demand	Anodyne	ADRA1A	71	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151809	GE	On-Demand	Anodyne	ADRA1B	56	37
COc1ccccc1N1CC[C@@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151809	GE	On-Demand	Anodyne	DRD3	68	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151809	GE	On-Demand	Anodyne	HTR7	48	36
COc1ccccc1N1CC[C@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151810	GE	On-Demand	Anodyne	HTR1A	75	44
COc1ccccc1N1CC[C@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151810	GE	On-Demand	Anodyne	DRD2	64	57
COc1ccccc1N1CC[C@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151810	GE	On-Demand	Anodyne	DRD4	34	43
COc1ccccc1N1CC[C@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151810	GE	On-Demand	Anodyne	ADRA1D	81	39
COc1ccccc1N1CC[C@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151810	GE	On-Demand	Anodyne	HTR2A	18	43
COc1ccccc1N1CC[C@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151810	GE	On-Demand	Anodyne	ADRA1A	71	39
COc1ccccc1N1CC[C@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151810	GE	On-Demand	Anodyne	ADRA1B	56	37
COc1ccccc1N1CC[C@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151810	GE	On-Demand	Anodyne	DRD3	68	44
COc1ccccc1N1CC[C@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1	ZINC000819151810	GE	On-Demand	Anodyne	HTR7	48	36
COc1ccccc1N1CC[C@@H](NCCC(=O)N(C)OC)C1	ZINC000819151828	DD	On-Demand	Anodyne	HTR1A	78	45
COc1ccccc1N1CC[C@@H](NCCC(=O)N(C)OC)C1	ZINC000819151828	DD	On-Demand	Anodyne	DRD2	65	45
COc1ccccc1N1CC[C@@H](NCCC(=O)N(C)OC)C1	ZINC000819151828	DD	On-Demand	Anodyne	DRD4	38	43
COc1ccccc1N1CC[C@@H](NCCC(=O)N(C)OC)C1	ZINC000819151828	DD	On-Demand	Anodyne	ADRA1D	71	40
COc1ccccc1N1CC[C@@H](NCCC(=O)N(C)OC)C1	ZINC000819151828	DD	On-Demand	Anodyne	ADRA1A	63	40
COc1ccccc1N1CC[C@@H](NCCC(=O)N(C)OC)C1	ZINC000819151828	DD	On-Demand	Anodyne	ADRA1B	54	37
COc1ccccc1N1CC[C@@H](NCCC(=O)N(C)OC)C1	ZINC000819151828	DD	On-Demand	Anodyne	DRD3	70	40
COc1ccccc1N1CC[C@@H](NCCC(=O)N(C)OC)C1	ZINC000819151828	DD	On-Demand	Anodyne	HTR7	51	40
COc1ccccc1N1CC[C@@H](NCCC(=O)N(C)OC)C1	ZINC000819151828	DD	On-Demand	Anodyne	NPY1R	22	44
COc1ccccc1N1CC[C@H](NCCC(=O)N(C)OC)C1	ZINC000819151829	DD	On-Demand	Anodyne	HTR1A	78	45
COc1ccccc1N1CC[C@H](NCCC(=O)N(C)OC)C1	ZINC000819151829	DD	On-Demand	Anodyne	DRD2	65	45
COc1ccccc1N1CC[C@H](NCCC(=O)N(C)OC)C1	ZINC000819151829	DD	On-Demand	Anodyne	DRD4	38	43
COc1ccccc1N1CC[C@H](NCCC(=O)N(C)OC)C1	ZINC000819151829	DD	On-Demand	Anodyne	ADRA1D	71	40
COc1ccccc1N1CC[C@H](NCCC(=O)N(C)OC)C1	ZINC000819151829	DD	On-Demand	Anodyne	ADRA1A	63	40
COc1ccccc1N1CC[C@H](NCCC(=O)N(C)OC)C1	ZINC000819151829	DD	On-Demand	Anodyne	ADRA1B	54	37
COc1ccccc1N1CC[C@H](NCCC(=O)N(C)OC)C1	ZINC000819151829	DD	On-Demand	Anodyne	DRD3	70	40
COc1ccccc1N1CC[C@H](NCCC(=O)N(C)OC)C1	ZINC000819151829	DD	On-Demand	Anodyne	HTR7	51	40
COc1ccccc1N1CC[C@H](NCCC(=O)N(C)OC)C1	ZINC000819151829	DD	On-Demand	Anodyne	NPY1R	22	44
O[C@H](CNCC1(Cc2ccccc2)CCC1)c1cccnc1	ZINC000819151842	CG	On-Demand	Anodyne	ADRB2	24	47
O[C@H](CNCC1(Cc2ccccc2)CCC1)c1cccnc1	ZINC000819151842	CG	On-Demand	Anodyne	ADRB1	24	43
O[C@H](CNCC1(Cc2ccccc2)CCC1)c1cccnc1	ZINC000819151842	CG	On-Demand	Anodyne	ADRB3	95	48
O[C@@H](CNCC1(Cc2ccccc2)CCC1)c1cccnc1	ZINC000819151843	CG	On-Demand	Anodyne	ADRB2	24	47
O[C@@H](CNCC1(Cc2ccccc2)CCC1)c1cccnc1	ZINC000819151843	CG	On-Demand	Anodyne	ADRB1	24	43
O[C@@H](CNCC1(Cc2ccccc2)CCC1)c1cccnc1	ZINC000819151843	CG	On-Demand	Anodyne	ADRB3	95	48
COc1cc(C)ccc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819151858	DF	On-Demand	Bother	CACNA1C	55	36
COc1cc(C)ccc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819151858	DF	On-Demand	Bother	CACNA1D	87	36
COc1cc(C)ccc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819151859	DF	On-Demand	Bother	CACNA1C	55	36
COc1cc(C)ccc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819151859	DF	On-Demand	Bother	CACNA1D	87	36
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1=O	ZINC000819151870	EE	On-Demand	Anodyne	HTR1A	38	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1=O	ZINC000819151870	EE	On-Demand	Anodyne	DRD2	29	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1=O	ZINC000819151871	EE	On-Demand	Anodyne	HTR1A	38	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1=O	ZINC000819151871	EE	On-Demand	Anodyne	DRD2	29	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1=O	ZINC000819151872	EE	On-Demand	Anodyne	HTR1A	38	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1=O	ZINC000819151872	EE	On-Demand	Anodyne	DRD2	29	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1=O	ZINC000819151873	EE	On-Demand	Anodyne	HTR1A	38	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1=O	ZINC000819151873	EE	On-Demand	Anodyne	DRD2	29	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151874	FH	On-Demand	Anodyne	ADRB2	15	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151874	FH	On-Demand	Anodyne	HTR1A	72	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151874	FH	On-Demand	Anodyne	DRD2	55	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151874	FH	On-Demand	Anodyne	ADRA1D	57	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151874	FH	On-Demand	Anodyne	HTR2A	16	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151874	FH	On-Demand	Anodyne	ADRA1A	51	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151874	FH	On-Demand	Anodyne	ADRA1B	48	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151874	FH	On-Demand	Anodyne	DRD3	54	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151874	FH	On-Demand	Anodyne	PDE3A	30	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151874	FH	On-Demand	Anodyne	HTR7	50	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151874	FH	On-Demand	Anodyne	PDE3B	34	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151875	FH	On-Demand	Anodyne	ADRB2	15	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151875	FH	On-Demand	Anodyne	HTR1A	72	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151875	FH	On-Demand	Anodyne	DRD2	55	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151875	FH	On-Demand	Anodyne	ADRA1D	57	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151875	FH	On-Demand	Anodyne	HTR2A	16	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151875	FH	On-Demand	Anodyne	ADRA1A	51	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151875	FH	On-Demand	Anodyne	ADRA1B	48	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151875	FH	On-Demand	Anodyne	DRD3	54	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151875	FH	On-Demand	Anodyne	PDE3A	30	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151875	FH	On-Demand	Anodyne	HTR7	50	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819151875	FH	On-Demand	Anodyne	PDE3B	34	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)C2CC2)C1	ZINC000819151885	CD	On-Demand	Anodyne	HTR1A	79	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)C2CC2)C1	ZINC000819151885	CD	On-Demand	Anodyne	DRD2	62	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)C2CC2)C1	ZINC000819151885	CD	On-Demand	Anodyne	DRD4	31	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)C2CC2)C1	ZINC000819151885	CD	On-Demand	Anodyne	ADRA1D	79	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)C2CC2)C1	ZINC000819151885	CD	On-Demand	Anodyne	ADRA1A	69	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)C2CC2)C1	ZINC000819151885	CD	On-Demand	Anodyne	ADRA1B	60	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)C2CC2)C1	ZINC000819151885	CD	On-Demand	Anodyne	DRD3	55	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)C2CC2)C1	ZINC000819151885	CD	On-Demand	Anodyne	HTR7	45	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)C2CC2)C1	ZINC000819151886	CD	On-Demand	Anodyne	HTR1A	79	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)C2CC2)C1	ZINC000819151886	CD	On-Demand	Anodyne	DRD2	62	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)C2CC2)C1	ZINC000819151886	CD	On-Demand	Anodyne	DRD4	31	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)C2CC2)C1	ZINC000819151886	CD	On-Demand	Anodyne	ADRA1D	79	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)C2CC2)C1	ZINC000819151886	CD	On-Demand	Anodyne	ADRA1A	69	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)C2CC2)C1	ZINC000819151886	CD	On-Demand	Anodyne	ADRA1B	60	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)C2CC2)C1	ZINC000819151886	CD	On-Demand	Anodyne	DRD3	55	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)C2CC2)C1	ZINC000819151886	CD	On-Demand	Anodyne	HTR7	45	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)C2CC2)C1	ZINC000819151887	CD	On-Demand	Anodyne	HTR1A	79	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)C2CC2)C1	ZINC000819151887	CD	On-Demand	Anodyne	DRD2	62	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)C2CC2)C1	ZINC000819151887	CD	On-Demand	Anodyne	DRD4	31	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)C2CC2)C1	ZINC000819151887	CD	On-Demand	Anodyne	ADRA1D	79	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)C2CC2)C1	ZINC000819151887	CD	On-Demand	Anodyne	ADRA1A	69	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)C2CC2)C1	ZINC000819151887	CD	On-Demand	Anodyne	ADRA1B	60	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)C2CC2)C1	ZINC000819151887	CD	On-Demand	Anodyne	DRD3	55	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)C2CC2)C1	ZINC000819151887	CD	On-Demand	Anodyne	HTR7	45	41
COc1ccccc1N1CC[C@H](NC[C@H](O)C2CC2)C1	ZINC000819151888	CD	On-Demand	Anodyne	HTR1A	79	45
COc1ccccc1N1CC[C@H](NC[C@H](O)C2CC2)C1	ZINC000819151888	CD	On-Demand	Anodyne	DRD2	62	43
COc1ccccc1N1CC[C@H](NC[C@H](O)C2CC2)C1	ZINC000819151888	CD	On-Demand	Anodyne	DRD4	31	41
COc1ccccc1N1CC[C@H](NC[C@H](O)C2CC2)C1	ZINC000819151888	CD	On-Demand	Anodyne	ADRA1D	79	40
COc1ccccc1N1CC[C@H](NC[C@H](O)C2CC2)C1	ZINC000819151888	CD	On-Demand	Anodyne	ADRA1A	69	40
COc1ccccc1N1CC[C@H](NC[C@H](O)C2CC2)C1	ZINC000819151888	CD	On-Demand	Anodyne	ADRA1B	60	40
COc1ccccc1N1CC[C@H](NC[C@H](O)C2CC2)C1	ZINC000819151888	CD	On-Demand	Anodyne	DRD3	55	39
COc1ccccc1N1CC[C@H](NC[C@H](O)C2CC2)C1	ZINC000819151888	CD	On-Demand	Anodyne	HTR7	45	41
COc1cc(C)ccc1CNC[C@H](O)c1ccccc1	ZINC000819151889	CF	On-Demand	Anodyne	ADRB1	22	40
COc1cc(C)ccc1CNC[C@H](O)c1ccccc1	ZINC000819151889	CF	On-Demand	Anodyne	ADRB3	43	39
COc1cc(C)ccc1CNC[C@@H](O)c1ccccc1	ZINC000819151890	CF	On-Demand	Anodyne	ADRB1	22	40
COc1cc(C)ccc1CNC[C@@H](O)c1ccccc1	ZINC000819151890	CF	On-Demand	Anodyne	ADRB3	43	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151901	FF	On-Demand	Bother	HTR1A	49	51
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151901	FF	On-Demand	Bother	DRD2	40	46
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151901	FF	On-Demand	Bother	DRD4	19	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151901	FF	On-Demand	Bother	ADRA1D	55	46
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151901	FF	On-Demand	Bother	ADRA1A	47	46
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151901	FF	On-Demand	Bother	ADRA1B	44	46
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151901	FF	On-Demand	Bother	DRD3	34	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151902	FF	On-Demand	Bother	HTR1A	49	51
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151902	FF	On-Demand	Bother	DRD2	40	46
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151902	FF	On-Demand	Bother	DRD4	19	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151902	FF	On-Demand	Bother	ADRA1D	55	46
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151902	FF	On-Demand	Bother	ADRA1A	47	46
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151902	FF	On-Demand	Bother	ADRA1B	44	46
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151902	FF	On-Demand	Bother	DRD3	34	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151903	FF	On-Demand	Bother	HTR1A	49	51
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151903	FF	On-Demand	Bother	DRD2	40	46
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151903	FF	On-Demand	Bother	DRD4	19	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151903	FF	On-Demand	Bother	ADRA1D	55	46
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151903	FF	On-Demand	Bother	ADRA1A	47	46
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151903	FF	On-Demand	Bother	ADRA1B	44	46
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151903	FF	On-Demand	Bother	DRD3	34	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151904	FF	On-Demand	Bother	HTR1A	49	51
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151904	FF	On-Demand	Bother	DRD2	40	46
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151904	FF	On-Demand	Bother	DRD4	19	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151904	FF	On-Demand	Bother	ADRA1D	55	46
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151904	FF	On-Demand	Bother	ADRA1A	47	46
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151904	FF	On-Demand	Bother	ADRA1B	44	46
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819151904	FF	On-Demand	Bother	DRD3	34	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151906	EG	On-Demand	Anodyne	ADRB2	22	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151906	EG	On-Demand	Anodyne	ADRB1	42	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151906	EG	On-Demand	Anodyne	HTR1A	58	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151906	EG	On-Demand	Anodyne	DRD2	52	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151906	EG	On-Demand	Anodyne	DRD4	32	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151906	EG	On-Demand	Anodyne	ADRA1D	59	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151906	EG	On-Demand	Anodyne	ADRA1A	50	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151906	EG	On-Demand	Anodyne	ADRA1B	47	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151906	EG	On-Demand	Anodyne	DRD3	48	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151906	EG	On-Demand	Anodyne	ADRB3	62	49
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151906	EG	On-Demand	Anodyne	HTR7	37	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151906	EG	On-Demand	Anodyne	CYP3A4	50	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151907	EG	On-Demand	Anodyne	ADRB2	22	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151907	EG	On-Demand	Anodyne	ADRB1	42	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151907	EG	On-Demand	Anodyne	HTR1A	58	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151907	EG	On-Demand	Anodyne	DRD2	52	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151907	EG	On-Demand	Anodyne	DRD4	32	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151907	EG	On-Demand	Anodyne	ADRA1D	59	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151907	EG	On-Demand	Anodyne	ADRA1A	50	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151907	EG	On-Demand	Anodyne	ADRA1B	47	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151907	EG	On-Demand	Anodyne	DRD3	48	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151907	EG	On-Demand	Anodyne	ADRB3	62	49
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151907	EG	On-Demand	Anodyne	HTR7	37	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151907	EG	On-Demand	Anodyne	CYP3A4	50	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151908	EG	On-Demand	Anodyne	ADRB2	22	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151908	EG	On-Demand	Anodyne	ADRB1	42	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151908	EG	On-Demand	Anodyne	HTR1A	58	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151908	EG	On-Demand	Anodyne	DRD2	52	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151908	EG	On-Demand	Anodyne	DRD4	32	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151908	EG	On-Demand	Anodyne	ADRA1D	59	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151908	EG	On-Demand	Anodyne	ADRA1A	50	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151908	EG	On-Demand	Anodyne	ADRA1B	47	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151908	EG	On-Demand	Anodyne	DRD3	48	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151908	EG	On-Demand	Anodyne	ADRB3	62	49
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151908	EG	On-Demand	Anodyne	HTR7	37	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819151908	EG	On-Demand	Anodyne	CYP3A4	50	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151909	EG	On-Demand	Anodyne	ADRB2	22	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151909	EG	On-Demand	Anodyne	ADRB1	42	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151909	EG	On-Demand	Anodyne	HTR1A	58	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151909	EG	On-Demand	Anodyne	DRD2	52	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151909	EG	On-Demand	Anodyne	DRD4	32	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151909	EG	On-Demand	Anodyne	ADRA1D	59	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151909	EG	On-Demand	Anodyne	ADRA1A	50	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151909	EG	On-Demand	Anodyne	ADRA1B	47	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151909	EG	On-Demand	Anodyne	DRD3	48	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151909	EG	On-Demand	Anodyne	ADRB3	62	49
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151909	EG	On-Demand	Anodyne	HTR7	37	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819151909	EG	On-Demand	Anodyne	CYP3A4	50	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1=O	ZINC000819151922	FF	On-Demand	Anodyne	HTR1A	41	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1=O	ZINC000819151923	FF	On-Demand	Anodyne	HTR1A	41	39
Cn1cc(CNC(=O)CC[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)cn1	ZINC000819151933	GH	On-Demand	Anodyne	CACNA1B	17	42
Cn1cc(CNC(=O)CC[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)cn1	ZINC000819151933	GH	On-Demand	Anodyne	REN	65	45
Cn1cc(CNC(=O)CC[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)cn1	ZINC000819151933	GH	On-Demand	Anodyne	FPR1	19	40
Cn1cc(CNC(=O)CC[C@@H](CC2CCCCC2)NC(=O)OC(C)(C)C)cn1	ZINC000819151934	GH	On-Demand	Anodyne	CACNA1B	17	42
Cn1cc(CNC(=O)CC[C@@H](CC2CCCCC2)NC(=O)OC(C)(C)C)cn1	ZINC000819151934	GH	On-Demand	Anodyne	REN	65	45
Cn1cc(CNC(=O)CC[C@@H](CC2CCCCC2)NC(=O)OC(C)(C)C)cn1	ZINC000819151934	GH	On-Demand	Anodyne	FPR1	19	40
O=C(Nc1cccc(N2CCCCC2)c1)c1cc2c(cn1)OCCO2	ZINC000819151935	EG	On-Demand	Anodyne	GRM4	35	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1=O	ZINC000819151940	GF	On-Demand	Anodyne	P2RX7	40	52
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1=O	ZINC000819151941	GF	On-Demand	Anodyne	P2RX7	40	52
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1=O	ZINC000819151942	GF	On-Demand	Anodyne	P2RX7	40	52
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1=O	ZINC000819151943	GF	On-Demand	Anodyne	P2RX7	40	52
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819151984	GG	On-Demand	Anodyne	HTR1A	57	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819151984	GG	On-Demand	Anodyne	DRD2	48	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819151984	GG	On-Demand	Anodyne	ADRA1D	52	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819151984	GG	On-Demand	Anodyne	ADRA1A	45	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819151984	GG	On-Demand	Anodyne	ADRA1B	41	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819151984	GG	On-Demand	Anodyne	DRD3	44	37
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819151984	GG	On-Demand	Anodyne	ADRB3	28	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819151985	GG	On-Demand	Anodyne	HTR1A	57	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819151985	GG	On-Demand	Anodyne	DRD2	48	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819151985	GG	On-Demand	Anodyne	ADRA1D	52	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819151985	GG	On-Demand	Anodyne	ADRA1A	45	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819151985	GG	On-Demand	Anodyne	ADRA1B	41	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819151985	GG	On-Demand	Anodyne	DRD3	44	37
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819151985	GG	On-Demand	Anodyne	ADRB3	28	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819151986	GG	On-Demand	Anodyne	HTR1A	57	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819151986	GG	On-Demand	Anodyne	DRD2	48	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819151986	GG	On-Demand	Anodyne	ADRA1D	52	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819151986	GG	On-Demand	Anodyne	ADRA1A	45	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819151986	GG	On-Demand	Anodyne	ADRA1B	41	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819151986	GG	On-Demand	Anodyne	DRD3	44	37
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819151986	GG	On-Demand	Anodyne	ADRB3	28	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819151987	GG	On-Demand	Anodyne	HTR1A	57	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819151987	GG	On-Demand	Anodyne	DRD2	48	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819151987	GG	On-Demand	Anodyne	ADRA1D	52	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819151987	GG	On-Demand	Anodyne	ADRA1A	45	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819151987	GG	On-Demand	Anodyne	ADRA1B	41	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819151987	GG	On-Demand	Anodyne	DRD3	44	37
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819151987	GG	On-Demand	Anodyne	ADRB3	28	42
O=S1(=O)CCc2cc(CNC[C@H](O)c3cccc(Cl)c3)ccc21	ZINC000819151988	FE	On-Demand	Anodyne	ADRB1	29	44
O=S1(=O)CCc2cc(CNC[C@H](O)c3cccc(Cl)c3)ccc21	ZINC000819151988	FE	On-Demand	Anodyne	ADRB3	43	44
O=S1(=O)CCc2cc(CNC[C@@H](O)c3cccc(Cl)c3)ccc21	ZINC000819151989	FE	On-Demand	Anodyne	ADRB1	29	44
O=S1(=O)CCc2cc(CNC[C@@H](O)c3cccc(Cl)c3)ccc21	ZINC000819151989	FE	On-Demand	Anodyne	ADRB3	43	44
COc1ccccc1N1CC[C@@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1=O	ZINC000819151992	GD	On-Demand	Anodyne	HTR1A	56	41
COc1ccccc1N1CC[C@@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1=O	ZINC000819151992	GD	On-Demand	Anodyne	DRD2	40	52
COc1ccccc1N1CC[C@@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1=O	ZINC000819151992	GD	On-Demand	Anodyne	DRD4	23	41
COc1ccccc1N1CC[C@@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1=O	ZINC000819151992	GD	On-Demand	Anodyne	DRD3	49	40
COc1ccccc1N1CC[C@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1=O	ZINC000819151993	GD	On-Demand	Anodyne	HTR1A	56	41
COc1ccccc1N1CC[C@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1=O	ZINC000819151993	GD	On-Demand	Anodyne	DRD2	40	52
COc1ccccc1N1CC[C@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1=O	ZINC000819151993	GD	On-Demand	Anodyne	DRD4	23	41
COc1ccccc1N1CC[C@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C1=O	ZINC000819151993	GD	On-Demand	Anodyne	DRD3	49	40
COc1ccccc1N1CC[C@@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1=O	ZINC000819151994	GD	On-Demand	Anodyne	HTR1A	56	41
COc1ccccc1N1CC[C@@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1=O	ZINC000819151994	GD	On-Demand	Anodyne	DRD2	40	52
COc1ccccc1N1CC[C@@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1=O	ZINC000819151994	GD	On-Demand	Anodyne	DRD4	23	41
COc1ccccc1N1CC[C@@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1=O	ZINC000819151994	GD	On-Demand	Anodyne	DRD3	49	40
COc1ccccc1N1CC[C@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1=O	ZINC000819151995	GD	On-Demand	Anodyne	HTR1A	56	41
COc1ccccc1N1CC[C@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1=O	ZINC000819151995	GD	On-Demand	Anodyne	DRD2	40	52
COc1ccccc1N1CC[C@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1=O	ZINC000819151995	GD	On-Demand	Anodyne	DRD4	23	41
COc1ccccc1N1CC[C@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C1=O	ZINC000819151995	GD	On-Demand	Anodyne	DRD3	49	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)C(=O)NCc1ccccc1)C2	ZINC000819152002	FD	On-Demand	Anodyne	XIAP	40	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)C(=O)NCc1ccccc1)C2	ZINC000819152002	FD	On-Demand	Anodyne	BIRC2	39	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)C(=O)NCc1ccccc1)C2	ZINC000819152002	FD	On-Demand	Anodyne	VHL	42	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)C(=O)NCc1ccccc1)C2	ZINC000819152003	FD	On-Demand	Anodyne	XIAP	40	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)C(=O)NCc1ccccc1)C2	ZINC000819152003	FD	On-Demand	Anodyne	BIRC2	39	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)C(=O)NCc1ccccc1)C2	ZINC000819152003	FD	On-Demand	Anodyne	VHL	42	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)C(=O)NCc1ccccc1)C2	ZINC000819152004	FD	On-Demand	Anodyne	XIAP	40	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)C(=O)NCc1ccccc1)C2	ZINC000819152004	FD	On-Demand	Anodyne	BIRC2	39	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)C(=O)NCc1ccccc1)C2	ZINC000819152004	FD	On-Demand	Anodyne	VHL	42	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)C(=O)NCc1ccccc1)C2	ZINC000819152005	FD	On-Demand	Anodyne	XIAP	40	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)C(=O)NCc1ccccc1)C2	ZINC000819152005	FD	On-Demand	Anodyne	BIRC2	39	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)C(=O)NCc1ccccc1)C2	ZINC000819152005	FD	On-Demand	Anodyne	VHL	42	34
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152020	FF	On-Demand	Bother	HTR1A	51	63
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152020	FF	On-Demand	Bother	DRD2	39	46
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152020	FF	On-Demand	Bother	ADRA1D	59	46
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152020	FF	On-Demand	Bother	ADRA1A	51	46
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152020	FF	On-Demand	Bother	ADRA1B	47	46
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152020	FF	On-Demand	Bother	DRD3	36	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152021	FF	On-Demand	Bother	HTR1A	51	63
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152021	FF	On-Demand	Bother	DRD2	39	46
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152021	FF	On-Demand	Bother	ADRA1D	59	46
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152021	FF	On-Demand	Bother	ADRA1A	51	46
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152021	FF	On-Demand	Bother	ADRA1B	47	46
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152021	FF	On-Demand	Bother	DRD3	36	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152022	FF	On-Demand	Bother	HTR1A	51	63
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152022	FF	On-Demand	Bother	DRD2	39	46
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152022	FF	On-Demand	Bother	ADRA1D	59	46
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152022	FF	On-Demand	Bother	ADRA1A	51	46
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152022	FF	On-Demand	Bother	ADRA1B	47	46
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152022	FF	On-Demand	Bother	DRD3	36	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152023	FF	On-Demand	Bother	HTR1A	51	63
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152023	FF	On-Demand	Bother	DRD2	39	46
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152023	FF	On-Demand	Bother	ADRA1D	59	46
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152023	FF	On-Demand	Bother	ADRA1A	51	46
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152023	FF	On-Demand	Bother	ADRA1B	47	46
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819152023	FF	On-Demand	Bother	DRD3	36	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152063	GH	On-Demand	Anodyne	HTR1A	47	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152063	GH	On-Demand	Anodyne	DRD2	48	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152063	GH	On-Demand	Anodyne	DRD4	36	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152063	GH	On-Demand	Anodyne	ADRA1D	55	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152063	GH	On-Demand	Anodyne	ADRA1A	47	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152063	GH	On-Demand	Anodyne	ADRA1B	45	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152063	GH	On-Demand	Anodyne	DRD3	47	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152063	GH	On-Demand	Anodyne	HTR7	31	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152064	GH	On-Demand	Anodyne	HTR1A	47	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152064	GH	On-Demand	Anodyne	DRD2	48	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152064	GH	On-Demand	Anodyne	DRD4	36	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152064	GH	On-Demand	Anodyne	ADRA1D	55	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152064	GH	On-Demand	Anodyne	ADRA1A	47	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152064	GH	On-Demand	Anodyne	ADRA1B	45	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152064	GH	On-Demand	Anodyne	DRD3	47	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152064	GH	On-Demand	Anodyne	HTR7	31	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152065	GH	On-Demand	Anodyne	HTR1A	47	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152065	GH	On-Demand	Anodyne	DRD2	48	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152065	GH	On-Demand	Anodyne	DRD4	36	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152065	GH	On-Demand	Anodyne	ADRA1D	55	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152065	GH	On-Demand	Anodyne	ADRA1A	47	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152065	GH	On-Demand	Anodyne	ADRA1B	45	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152065	GH	On-Demand	Anodyne	DRD3	47	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152065	GH	On-Demand	Anodyne	HTR7	31	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152066	GH	On-Demand	Anodyne	HTR1A	47	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152066	GH	On-Demand	Anodyne	DRD2	48	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152066	GH	On-Demand	Anodyne	DRD4	36	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152066	GH	On-Demand	Anodyne	ADRA1D	55	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152066	GH	On-Demand	Anodyne	ADRA1A	47	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152066	GH	On-Demand	Anodyne	ADRA1B	45	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152066	GH	On-Demand	Anodyne	DRD3	47	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819152066	GH	On-Demand	Anodyne	HTR7	31	44
CCOC(=O)N(C)c1ccc(NC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819152073	GI	On-Demand	Anodyne	MTNR1B	19	44
COC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152074	FE	On-Demand	Mild	F2	20	43
COC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152074	FE	On-Demand	Mild	PLG	21	43
COC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152074	FE	On-Demand	Mild	PRSS1	15	43
COC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152074	FE	On-Demand	Mild	CELA1	53	43
COC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152074	FE	On-Demand	Mild	CMA1	32	40
COC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152074	FE	On-Demand	Mild	PAPA1_CARPA	35	43
COC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152074	FE	On-Demand	Mild	TRY1_BOVIN	31	43
COC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152074	FE	On-Demand	Mild	CTSK	16	43
COC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152075	FE	On-Demand	Mild	F2	20	43
COC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152075	FE	On-Demand	Mild	PLG	21	43
COC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152075	FE	On-Demand	Mild	PRSS1	15	43
COC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152075	FE	On-Demand	Mild	CELA1	53	43
COC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152075	FE	On-Demand	Mild	CMA1	32	40
COC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152075	FE	On-Demand	Mild	PAPA1_CARPA	35	43
COC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152075	FE	On-Demand	Mild	TRY1_BOVIN	31	43
COC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152075	FE	On-Demand	Mild	CTSK	16	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819152104	EF	On-Demand	Anodyne	HTR1A	60	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819152104	EF	On-Demand	Anodyne	DRD2	53	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819152104	EF	On-Demand	Anodyne	DRD4	29	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819152104	EF	On-Demand	Anodyne	ADRA1D	61	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819152104	EF	On-Demand	Anodyne	ADRA1A	52	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819152104	EF	On-Demand	Anodyne	ADRA1B	48	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819152104	EF	On-Demand	Anodyne	DRD3	54	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819152104	EF	On-Demand	Anodyne	HTR7	43	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819152105	EF	On-Demand	Anodyne	HTR1A	60	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819152105	EF	On-Demand	Anodyne	DRD2	53	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819152105	EF	On-Demand	Anodyne	DRD4	29	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819152105	EF	On-Demand	Anodyne	ADRA1D	61	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819152105	EF	On-Demand	Anodyne	ADRA1A	52	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819152105	EF	On-Demand	Anodyne	ADRA1B	48	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819152105	EF	On-Demand	Anodyne	DRD3	54	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819152105	EF	On-Demand	Anodyne	HTR7	43	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819152106	EF	On-Demand	Anodyne	HTR1A	60	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819152106	EF	On-Demand	Anodyne	DRD2	53	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819152106	EF	On-Demand	Anodyne	DRD4	29	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819152106	EF	On-Demand	Anodyne	ADRA1D	61	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819152106	EF	On-Demand	Anodyne	ADRA1A	52	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819152106	EF	On-Demand	Anodyne	ADRA1B	48	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819152106	EF	On-Demand	Anodyne	DRD3	54	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819152106	EF	On-Demand	Anodyne	HTR7	43	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819152107	EF	On-Demand	Anodyne	HTR1A	60	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819152107	EF	On-Demand	Anodyne	DRD2	53	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819152107	EF	On-Demand	Anodyne	DRD4	29	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819152107	EF	On-Demand	Anodyne	ADRA1D	61	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819152107	EF	On-Demand	Anodyne	ADRA1A	52	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819152107	EF	On-Demand	Anodyne	ADRA1B	48	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819152107	EF	On-Demand	Anodyne	DRD3	54	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819152107	EF	On-Demand	Anodyne	HTR7	43	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819152119	EF	On-Demand	Anodyne	HTR1A	59	47
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819152119	EF	On-Demand	Anodyne	DRD2	49	47
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819152119	EF	On-Demand	Anodyne	DRD4	25	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819152119	EF	On-Demand	Anodyne	SLC6A2	19	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819152119	EF	On-Demand	Anodyne	ADRA1D	58	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819152119	EF	On-Demand	Anodyne	ADRA1A	51	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819152119	EF	On-Demand	Anodyne	ADRA1B	46	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819152119	EF	On-Demand	Anodyne	DRD3	43	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819152119	EF	On-Demand	Anodyne	HTR7	40	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819152120	EF	On-Demand	Anodyne	HTR1A	59	47
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819152120	EF	On-Demand	Anodyne	DRD2	49	47
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819152120	EF	On-Demand	Anodyne	DRD4	25	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819152120	EF	On-Demand	Anodyne	SLC6A2	19	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819152120	EF	On-Demand	Anodyne	ADRA1D	58	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819152120	EF	On-Demand	Anodyne	ADRA1A	51	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819152120	EF	On-Demand	Anodyne	ADRA1B	46	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819152120	EF	On-Demand	Anodyne	DRD3	43	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819152120	EF	On-Demand	Anodyne	HTR7	40	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819152121	EF	On-Demand	Anodyne	HTR1A	59	47
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819152121	EF	On-Demand	Anodyne	DRD2	49	47
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819152121	EF	On-Demand	Anodyne	DRD4	25	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819152121	EF	On-Demand	Anodyne	SLC6A2	19	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819152121	EF	On-Demand	Anodyne	ADRA1D	58	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819152121	EF	On-Demand	Anodyne	ADRA1A	51	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819152121	EF	On-Demand	Anodyne	ADRA1B	46	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819152121	EF	On-Demand	Anodyne	DRD3	43	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819152121	EF	On-Demand	Anodyne	HTR7	40	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819152122	EF	On-Demand	Anodyne	HTR1A	59	47
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819152122	EF	On-Demand	Anodyne	DRD2	49	47
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819152122	EF	On-Demand	Anodyne	DRD4	25	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819152122	EF	On-Demand	Anodyne	SLC6A2	19	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819152122	EF	On-Demand	Anodyne	ADRA1D	58	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819152122	EF	On-Demand	Anodyne	ADRA1A	51	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819152122	EF	On-Demand	Anodyne	ADRA1B	46	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819152122	EF	On-Demand	Anodyne	DRD3	43	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819152122	EF	On-Demand	Anodyne	HTR7	40	38
O[C@@H](CNCCc1nnc(-c2ccccc2)o1)c1ccc(OC(F)(F)F)cc1	ZINC000819152125	GH	On-Demand	Anodyne	ADRB3	50	45
O[C@H](CNCCc1nnc(-c2ccccc2)o1)c1ccc(OC(F)(F)F)cc1	ZINC000819152126	GH	On-Demand	Anodyne	ADRB3	50	45
COC(=O)C[C@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152127	GF	On-Demand	Mild	PAPA1_CARPA	31	40
COC(=O)C[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152128	GF	On-Demand	Mild	PAPA1_CARPA	31	40
COC(=O)C[C@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152129	GF	On-Demand	Mild	PAPA1_CARPA	31	40
COC(=O)C[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819152130	GF	On-Demand	Mild	PAPA1_CARPA	31	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819152132	GG	On-Demand	Anodyne	HTR1A	56	47
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819152132	GG	On-Demand	Anodyne	DRD2	46	47
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819152132	GG	On-Demand	Anodyne	ADRA1D	55	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819152132	GG	On-Demand	Anodyne	ADRA1A	46	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819152132	GG	On-Demand	Anodyne	ADRA1B	43	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819152132	GG	On-Demand	Anodyne	DRD3	44	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819152133	GG	On-Demand	Anodyne	HTR1A	56	47
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819152133	GG	On-Demand	Anodyne	DRD2	46	47
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819152133	GG	On-Demand	Anodyne	ADRA1D	55	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819152133	GG	On-Demand	Anodyne	ADRA1A	46	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819152133	GG	On-Demand	Anodyne	ADRA1B	43	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819152133	GG	On-Demand	Anodyne	DRD3	44	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819152134	GG	On-Demand	Anodyne	HTR1A	56	47
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819152134	GG	On-Demand	Anodyne	DRD2	46	47
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819152134	GG	On-Demand	Anodyne	ADRA1D	55	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819152134	GG	On-Demand	Anodyne	ADRA1A	46	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819152134	GG	On-Demand	Anodyne	ADRA1B	43	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819152134	GG	On-Demand	Anodyne	DRD3	44	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819152135	GG	On-Demand	Anodyne	HTR1A	56	47
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819152135	GG	On-Demand	Anodyne	DRD2	46	47
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819152135	GG	On-Demand	Anodyne	ADRA1D	55	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819152135	GG	On-Demand	Anodyne	ADRA1A	46	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819152135	GG	On-Demand	Anodyne	ADRA1B	43	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819152135	GG	On-Demand	Anodyne	DRD3	44	38
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2nnc(-c3ccccc3)o2)cc1	ZINC000819152140	GE	On-Demand	Anodyne	ADRB3	100	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2nnc(-c3ccccc3)o2)cc1	ZINC000819152140	GE	On-Demand	Anodyne	CTSF	40	33
CS(=O)(=O)c1ccc([C@H](O)CNCCc2nnc(-c3ccccc3)o2)cc1	ZINC000819152141	GE	On-Demand	Anodyne	ADRB3	100	43
CS(=O)(=O)c1ccc([C@H](O)CNCCc2nnc(-c3ccccc3)o2)cc1	ZINC000819152141	GE	On-Demand	Anodyne	CTSF	40	33
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152157	EF	On-Demand	Anodyne	HTR1A	67	58
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152157	EF	On-Demand	Anodyne	DRD2	55	58
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152157	EF	On-Demand	Anodyne	DRD4	28	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152157	EF	On-Demand	Anodyne	ADRA1D	68	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152157	EF	On-Demand	Anodyne	SLC6A4	15	48
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152157	EF	On-Demand	Anodyne	ADRA1A	57	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152157	EF	On-Demand	Anodyne	ADRA1B	51	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152157	EF	On-Demand	Anodyne	DRD3	51	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152157	EF	On-Demand	Anodyne	SLC6A3	28	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152157	EF	On-Demand	Anodyne	HTR7	43	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152158	EF	On-Demand	Anodyne	HTR1A	67	58
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152158	EF	On-Demand	Anodyne	DRD2	55	58
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152158	EF	On-Demand	Anodyne	DRD4	28	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152158	EF	On-Demand	Anodyne	ADRA1D	68	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152158	EF	On-Demand	Anodyne	SLC6A4	15	48
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152158	EF	On-Demand	Anodyne	ADRA1A	57	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152158	EF	On-Demand	Anodyne	ADRA1B	51	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152158	EF	On-Demand	Anodyne	DRD3	51	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152158	EF	On-Demand	Anodyne	SLC6A3	28	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152158	EF	On-Demand	Anodyne	HTR7	43	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152159	EF	On-Demand	Anodyne	HTR1A	67	58
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152159	EF	On-Demand	Anodyne	DRD2	55	58
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152159	EF	On-Demand	Anodyne	DRD4	28	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152159	EF	On-Demand	Anodyne	ADRA1D	68	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152159	EF	On-Demand	Anodyne	SLC6A4	15	48
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152159	EF	On-Demand	Anodyne	ADRA1A	57	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152159	EF	On-Demand	Anodyne	ADRA1B	51	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152159	EF	On-Demand	Anodyne	DRD3	51	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152159	EF	On-Demand	Anodyne	SLC6A3	28	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819152159	EF	On-Demand	Anodyne	HTR7	43	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152160	EF	On-Demand	Anodyne	HTR1A	67	58
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152160	EF	On-Demand	Anodyne	DRD2	55	58
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152160	EF	On-Demand	Anodyne	DRD4	28	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152160	EF	On-Demand	Anodyne	ADRA1D	68	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152160	EF	On-Demand	Anodyne	SLC6A4	15	48
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152160	EF	On-Demand	Anodyne	ADRA1A	57	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152160	EF	On-Demand	Anodyne	ADRA1B	51	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152160	EF	On-Demand	Anodyne	DRD3	51	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152160	EF	On-Demand	Anodyne	SLC6A3	28	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819152160	EF	On-Demand	Anodyne	HTR7	43	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152161	EF	On-Demand	Anodyne	HTR1A	51	47
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152161	EF	On-Demand	Anodyne	DRD2	46	47
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152161	EF	On-Demand	Anodyne	ADRA1D	61	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152161	EF	On-Demand	Anodyne	ADRA1A	53	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152161	EF	On-Demand	Anodyne	ADRA1B	50	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152161	EF	On-Demand	Anodyne	DRD3	41	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152162	EF	On-Demand	Anodyne	HTR1A	51	47
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152162	EF	On-Demand	Anodyne	DRD2	46	47
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152162	EF	On-Demand	Anodyne	ADRA1D	61	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152162	EF	On-Demand	Anodyne	ADRA1A	53	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152162	EF	On-Demand	Anodyne	ADRA1B	50	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152162	EF	On-Demand	Anodyne	DRD3	41	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152163	EF	On-Demand	Anodyne	HTR1A	51	47
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152163	EF	On-Demand	Anodyne	DRD2	46	47
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152163	EF	On-Demand	Anodyne	ADRA1D	61	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152163	EF	On-Demand	Anodyne	ADRA1A	53	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152163	EF	On-Demand	Anodyne	ADRA1B	50	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152163	EF	On-Demand	Anodyne	DRD3	41	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152164	EF	On-Demand	Anodyne	HTR1A	51	47
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152164	EF	On-Demand	Anodyne	DRD2	46	47
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152164	EF	On-Demand	Anodyne	ADRA1D	61	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152164	EF	On-Demand	Anodyne	ADRA1A	53	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152164	EF	On-Demand	Anodyne	ADRA1B	50	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819152164	EF	On-Demand	Anodyne	DRD3	41	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819152169	EF	On-Demand	Anodyne	HTR1A	54	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819152169	EF	On-Demand	Anodyne	DRD2	50	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819152169	EF	On-Demand	Anodyne	DRD4	26	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819152169	EF	On-Demand	Anodyne	ADRA1D	60	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819152169	EF	On-Demand	Anodyne	ADRA1A	52	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819152169	EF	On-Demand	Anodyne	ADRA1B	47	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819152169	EF	On-Demand	Anodyne	DRD3	47	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819152169	EF	On-Demand	Anodyne	HTR7	41	37
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819152170	EF	On-Demand	Anodyne	HTR1A	54	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819152170	EF	On-Demand	Anodyne	DRD2	50	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819152170	EF	On-Demand	Anodyne	DRD4	26	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819152170	EF	On-Demand	Anodyne	ADRA1D	60	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819152170	EF	On-Demand	Anodyne	ADRA1A	52	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819152170	EF	On-Demand	Anodyne	ADRA1B	47	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819152170	EF	On-Demand	Anodyne	DRD3	47	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819152170	EF	On-Demand	Anodyne	HTR7	41	37
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819152171	EF	On-Demand	Anodyne	HTR1A	54	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819152171	EF	On-Demand	Anodyne	DRD2	50	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819152171	EF	On-Demand	Anodyne	DRD4	26	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819152171	EF	On-Demand	Anodyne	ADRA1D	60	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819152171	EF	On-Demand	Anodyne	ADRA1A	52	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819152171	EF	On-Demand	Anodyne	ADRA1B	47	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819152171	EF	On-Demand	Anodyne	DRD3	47	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819152171	EF	On-Demand	Anodyne	HTR7	41	37
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819152172	EF	On-Demand	Anodyne	HTR1A	54	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819152172	EF	On-Demand	Anodyne	DRD2	50	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819152172	EF	On-Demand	Anodyne	DRD4	26	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819152172	EF	On-Demand	Anodyne	ADRA1D	60	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819152172	EF	On-Demand	Anodyne	ADRA1A	52	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819152172	EF	On-Demand	Anodyne	ADRA1B	47	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819152172	EF	On-Demand	Anodyne	DRD3	47	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819152172	EF	On-Demand	Anodyne	HTR7	41	37
C[C@H](CNC(=O)C(F)=C1CCC1)COCc1ccccc1	ZINC000819152173	CG	On-Demand	Anodyne	CAPNS1	46	31
C[C@H](CNC(=O)C(F)=C1CCC1)COCc1ccccc1	ZINC000819152173	CG	On-Demand	Anodyne	CAPN1	51	38
C[C@H](CNC(=O)C(F)=C1CCC1)COCc1ccccc1	ZINC000819152173	CG	On-Demand	Anodyne	CAPN2	75	35
C[C@H](CNC(=O)C(F)=C1CCC1)COCc1ccccc1	ZINC000819152173	CG	On-Demand	Anodyne	NPR	43	35
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152179	EG	On-Demand	Anodyne	HTR1A	63	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152179	EG	On-Demand	Anodyne	DRD2	54	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152179	EG	On-Demand	Anodyne	ADRA1D	69	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152179	EG	On-Demand	Anodyne	ADRA1A	60	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152179	EG	On-Demand	Anodyne	ADRA1B	53	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152179	EG	On-Demand	Anodyne	DRD3	49	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152180	EG	On-Demand	Anodyne	HTR1A	63	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152180	EG	On-Demand	Anodyne	DRD2	54	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152180	EG	On-Demand	Anodyne	ADRA1D	69	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152180	EG	On-Demand	Anodyne	ADRA1A	60	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152180	EG	On-Demand	Anodyne	ADRA1B	53	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152180	EG	On-Demand	Anodyne	DRD3	49	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152181	EG	On-Demand	Anodyne	HTR1A	63	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152181	EG	On-Demand	Anodyne	DRD2	54	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152181	EG	On-Demand	Anodyne	ADRA1D	69	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152181	EG	On-Demand	Anodyne	ADRA1A	60	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152181	EG	On-Demand	Anodyne	ADRA1B	53	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152181	EG	On-Demand	Anodyne	DRD3	49	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152182	EG	On-Demand	Anodyne	HTR1A	63	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152182	EG	On-Demand	Anodyne	DRD2	54	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152182	EG	On-Demand	Anodyne	ADRA1D	69	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152182	EG	On-Demand	Anodyne	ADRA1A	60	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152182	EG	On-Demand	Anodyne	ADRA1B	53	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc(C)cc(C)c2)C1	ZINC000819152182	EG	On-Demand	Anodyne	DRD3	49	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819152196	EE	On-Demand	Anodyne	HTR1A	53	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819152196	EE	On-Demand	Anodyne	DRD2	43	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819152196	EE	On-Demand	Anodyne	ADRA1D	52	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819152196	EE	On-Demand	Anodyne	ADRA1A	45	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819152196	EE	On-Demand	Anodyne	ADRA1B	41	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819152197	EE	On-Demand	Anodyne	HTR1A	53	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819152197	EE	On-Demand	Anodyne	DRD2	43	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819152197	EE	On-Demand	Anodyne	ADRA1D	52	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819152197	EE	On-Demand	Anodyne	ADRA1A	45	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819152197	EE	On-Demand	Anodyne	ADRA1B	41	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819152198	EE	On-Demand	Anodyne	HTR1A	53	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819152198	EE	On-Demand	Anodyne	DRD2	43	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819152198	EE	On-Demand	Anodyne	ADRA1D	52	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819152198	EE	On-Demand	Anodyne	ADRA1A	45	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819152198	EE	On-Demand	Anodyne	ADRA1B	41	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819152199	EE	On-Demand	Anodyne	HTR1A	53	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819152199	EE	On-Demand	Anodyne	DRD2	43	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819152199	EE	On-Demand	Anodyne	ADRA1D	52	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819152199	EE	On-Demand	Anodyne	ADRA1A	45	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819152199	EE	On-Demand	Anodyne	ADRA1B	41	38
COc1ccccc1N1CC[C@@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819152200	GF	On-Demand	Anodyne	HTR1A	60	46
COc1ccccc1N1CC[C@@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819152200	GF	On-Demand	Anodyne	DRD2	46	46
COc1ccccc1N1CC[C@@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819152200	GF	On-Demand	Anodyne	DRD4	27	46
COc1ccccc1N1CC[C@@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819152200	GF	On-Demand	Anodyne	ADRA1D	61	42
COc1ccccc1N1CC[C@@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819152200	GF	On-Demand	Anodyne	ADRA1A	52	39
COc1ccccc1N1CC[C@@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819152200	GF	On-Demand	Anodyne	ADRA1B	46	39
COc1ccccc1N1CC[C@@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819152200	GF	On-Demand	Anodyne	DRD3	55	46
COc1ccccc1N1CC[C@@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819152200	GF	On-Demand	Anodyne	HTR7	40	37
COc1ccccc1N1CC[C@@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819152200	GF	On-Demand	Anodyne	NPY1R	17	41
COc1ccccc1N1CC[C@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819152201	GF	On-Demand	Anodyne	HTR1A	60	46
COc1ccccc1N1CC[C@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819152201	GF	On-Demand	Anodyne	DRD2	46	46
COc1ccccc1N1CC[C@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819152201	GF	On-Demand	Anodyne	DRD4	27	46
COc1ccccc1N1CC[C@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819152201	GF	On-Demand	Anodyne	ADRA1D	61	42
COc1ccccc1N1CC[C@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819152201	GF	On-Demand	Anodyne	ADRA1A	52	39
COc1ccccc1N1CC[C@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819152201	GF	On-Demand	Anodyne	ADRA1B	46	39
COc1ccccc1N1CC[C@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819152201	GF	On-Demand	Anodyne	DRD3	55	46
COc1ccccc1N1CC[C@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819152201	GF	On-Demand	Anodyne	HTR7	40	37
COc1ccccc1N1CC[C@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819152201	GF	On-Demand	Anodyne	NPY1R	17	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819152214	EF	On-Demand	Anodyne	HTR1A	62	48
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819152214	EF	On-Demand	Anodyne	DRD2	49	48
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819152214	EF	On-Demand	Anodyne	DRD4	25	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819152214	EF	On-Demand	Anodyne	ADRA1D	64	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819152214	EF	On-Demand	Anodyne	ADRA1A	55	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819152214	EF	On-Demand	Anodyne	ADRA1B	49	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819152214	EF	On-Demand	Anodyne	DRD3	46	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819152214	EF	On-Demand	Anodyne	ADRB3	21	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819152215	EF	On-Demand	Anodyne	HTR1A	62	48
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819152215	EF	On-Demand	Anodyne	DRD2	49	48
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819152215	EF	On-Demand	Anodyne	DRD4	25	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819152215	EF	On-Demand	Anodyne	ADRA1D	64	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819152215	EF	On-Demand	Anodyne	ADRA1A	55	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819152215	EF	On-Demand	Anodyne	ADRA1B	49	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819152215	EF	On-Demand	Anodyne	DRD3	46	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819152215	EF	On-Demand	Anodyne	ADRB3	21	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819152216	EF	On-Demand	Anodyne	HTR1A	62	48
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819152216	EF	On-Demand	Anodyne	DRD2	49	48
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819152216	EF	On-Demand	Anodyne	DRD4	25	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819152216	EF	On-Demand	Anodyne	ADRA1D	64	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819152216	EF	On-Demand	Anodyne	ADRA1A	55	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819152216	EF	On-Demand	Anodyne	ADRA1B	49	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819152216	EF	On-Demand	Anodyne	DRD3	46	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819152216	EF	On-Demand	Anodyne	ADRB3	21	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819152217	EF	On-Demand	Anodyne	HTR1A	62	48
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819152217	EF	On-Demand	Anodyne	DRD2	49	48
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819152217	EF	On-Demand	Anodyne	DRD4	25	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819152217	EF	On-Demand	Anodyne	ADRA1D	64	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819152217	EF	On-Demand	Anodyne	ADRA1A	55	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819152217	EF	On-Demand	Anodyne	ADRA1B	49	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819152217	EF	On-Demand	Anodyne	DRD3	46	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819152217	EF	On-Demand	Anodyne	ADRB3	21	40
CC(=O)Nc1cccc(CC(=O)Nc2cccc(N3CCCCC3)c2)c1	ZINC000819152218	FH	On-Demand	Anodyne	HTR1A	15	55
CC(=O)Nc1cccc(CC(=O)Nc2cccc(N3CCCCC3)c2)c1	ZINC000819152218	FH	On-Demand	Anodyne	KCNQ2	57	45
CC(=O)Nc1cccc(CC(=O)Nc2cccc(N3CCCCC3)c2)c1	ZINC000819152218	FH	On-Demand	Anodyne	TAAR1	25	42
COc1ccccc1N1CC[C@@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1=O	ZINC000819152229	GE	On-Demand	Anodyne	HTR1A	38	42
COc1ccccc1N1CC[C@@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1=O	ZINC000819152229	GE	On-Demand	Anodyne	DRD2	25	42
COc1ccccc1N1CC[C@@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1=O	ZINC000819152229	GE	On-Demand	Anodyne	DRD3	30	42
COc1ccccc1N1CC[C@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1=O	ZINC000819152230	GE	On-Demand	Anodyne	HTR1A	38	42
COc1ccccc1N1CC[C@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1=O	ZINC000819152230	GE	On-Demand	Anodyne	DRD2	25	42
COc1ccccc1N1CC[C@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1=O	ZINC000819152230	GE	On-Demand	Anodyne	DRD3	30	42
CCOC(=O)N(C)c1ccc(NC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819152233	FG	On-Demand	Anodyne	MTNR1B	17	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152234	GH	On-Demand	Anodyne	HTR1A	52	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152234	GH	On-Demand	Anodyne	DRD2	45	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152234	GH	On-Demand	Anodyne	ADRA1D	57	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152234	GH	On-Demand	Anodyne	ADRA1A	47	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152234	GH	On-Demand	Anodyne	ADRA1B	45	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152234	GH	On-Demand	Anodyne	DRD3	46	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152234	GH	On-Demand	Anodyne	HTR7	36	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152235	GH	On-Demand	Anodyne	HTR1A	52	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152235	GH	On-Demand	Anodyne	DRD2	45	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152235	GH	On-Demand	Anodyne	ADRA1D	57	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152235	GH	On-Demand	Anodyne	ADRA1A	47	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152235	GH	On-Demand	Anodyne	ADRA1B	45	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152235	GH	On-Demand	Anodyne	DRD3	46	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152235	GH	On-Demand	Anodyne	HTR7	36	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152236	GH	On-Demand	Anodyne	HTR1A	52	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152236	GH	On-Demand	Anodyne	DRD2	45	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152236	GH	On-Demand	Anodyne	ADRA1D	57	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152236	GH	On-Demand	Anodyne	ADRA1A	47	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152236	GH	On-Demand	Anodyne	ADRA1B	45	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152236	GH	On-Demand	Anodyne	DRD3	46	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152236	GH	On-Demand	Anodyne	HTR7	36	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152237	GH	On-Demand	Anodyne	HTR1A	52	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152237	GH	On-Demand	Anodyne	DRD2	45	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152237	GH	On-Demand	Anodyne	ADRA1D	57	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152237	GH	On-Demand	Anodyne	ADRA1A	47	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152237	GH	On-Demand	Anodyne	ADRA1B	45	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152237	GH	On-Demand	Anodyne	DRD3	46	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819152237	GH	On-Demand	Anodyne	HTR7	36	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152238	GE	On-Demand	Anodyne	HTR1A	66	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152238	GE	On-Demand	Anodyne	DRD2	51	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152238	GE	On-Demand	Anodyne	ADRA1D	72	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152238	GE	On-Demand	Anodyne	ADRA1A	62	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152238	GE	On-Demand	Anodyne	ADRA1B	51	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152238	GE	On-Demand	Anodyne	DRD3	52	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152238	GE	On-Demand	Anodyne	HTR7	42	36
COc1ccccc1N1CC[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152239	GE	On-Demand	Anodyne	HTR1A	66	44
COc1ccccc1N1CC[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152239	GE	On-Demand	Anodyne	DRD2	51	44
COc1ccccc1N1CC[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152239	GE	On-Demand	Anodyne	ADRA1D	72	38
COc1ccccc1N1CC[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152239	GE	On-Demand	Anodyne	ADRA1A	62	38
COc1ccccc1N1CC[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152239	GE	On-Demand	Anodyne	ADRA1B	51	38
COc1ccccc1N1CC[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152239	GE	On-Demand	Anodyne	DRD3	52	39
COc1ccccc1N1CC[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152239	GE	On-Demand	Anodyne	HTR7	42	36
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152240	GE	On-Demand	Anodyne	HTR1A	66	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152240	GE	On-Demand	Anodyne	DRD2	51	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152240	GE	On-Demand	Anodyne	ADRA1D	72	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152240	GE	On-Demand	Anodyne	ADRA1A	62	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152240	GE	On-Demand	Anodyne	ADRA1B	51	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152240	GE	On-Demand	Anodyne	DRD3	52	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152240	GE	On-Demand	Anodyne	HTR7	42	36
COc1ccccc1N1CC[C@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152241	GE	On-Demand	Anodyne	HTR1A	66	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152241	GE	On-Demand	Anodyne	DRD2	51	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152241	GE	On-Demand	Anodyne	ADRA1D	72	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152241	GE	On-Demand	Anodyne	ADRA1A	62	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152241	GE	On-Demand	Anodyne	ADRA1B	51	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152241	GE	On-Demand	Anodyne	DRD3	52	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)C1	ZINC000819152241	GE	On-Demand	Anodyne	HTR7	42	36
CC(=O)Nc1cccc(CC(=O)N[C@@H](Cn2ccnc2)C(C)(C)C)c1	ZINC000819152261	EF	On-Demand	Anodyne	TBXAS1	42	38
CC(=O)Nc1cccc(CC(=O)N[C@@H](Cn2ccnc2)C(C)(C)C)c1	ZINC000819152261	EF	On-Demand	Anodyne	CYP26A1	42	33
CC(=O)Nc1cccc(CC(=O)N[C@H](Cn2ccnc2)C(C)(C)C)c1	ZINC000819152262	EF	On-Demand	Anodyne	TBXAS1	42	38
CC(=O)Nc1cccc(CC(=O)N[C@H](Cn2ccnc2)C(C)(C)C)c1	ZINC000819152262	EF	On-Demand	Anodyne	CYP26A1	42	33
CON(C)C(=O)CCNCC1(Cc2ccccc2)CCC1	ZINC000819152263	CE	On-Demand	Anodyne	SLC12A5	42	36
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1cccc(N2CCCCC2)c1	ZINC000819152270	FG	On-Demand	Anodyne	HTR1D	30	43
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1cccc(N2CCCCC2)c1	ZINC000819152270	FG	On-Demand	Anodyne	HTR1B	25	43
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1cccc(N2CCCCC2)c1	ZINC000819152270	FG	On-Demand	Anodyne	KCNQ2	26	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000819152285	ED	On-Demand	Anodyne	ADRB1	19	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000819152285	ED	On-Demand	Anodyne	DRD2	17	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000819152285	ED	On-Demand	Anodyne	ADRB3	58	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000819152286	ED	On-Demand	Anodyne	ADRB1	19	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000819152286	ED	On-Demand	Anodyne	DRD2	17	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000819152286	ED	On-Demand	Anodyne	ADRB3	58	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000819152287	ED	On-Demand	Anodyne	ADRB1	19	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000819152287	ED	On-Demand	Anodyne	DRD2	17	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000819152287	ED	On-Demand	Anodyne	ADRB3	58	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000819152288	ED	On-Demand	Anodyne	ADRB1	19	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000819152288	ED	On-Demand	Anodyne	DRD2	17	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000819152288	ED	On-Demand	Anodyne	ADRB3	58	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)C2CC2)C1=O	ZINC000819152293	CD	On-Demand	Anodyne	HTR1A	51	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)C2CC2)C1=O	ZINC000819152293	CD	On-Demand	Anodyne	ADRA1D	47	35
COc1ccccc1N1CC[C@H](NC[C@@H](O)C2CC2)C1=O	ZINC000819152293	CD	On-Demand	Anodyne	ADRA1A	42	36
COc1ccccc1N1CC[C@H](NC[C@H](O)C2CC2)C1=O	ZINC000819152294	CD	On-Demand	Anodyne	HTR1A	51	40
COc1ccccc1N1CC[C@H](NC[C@H](O)C2CC2)C1=O	ZINC000819152294	CD	On-Demand	Anodyne	ADRA1D	47	35
COc1ccccc1N1CC[C@H](NC[C@H](O)C2CC2)C1=O	ZINC000819152294	CD	On-Demand	Anodyne	ADRA1A	42	36
COc1ccccc1N1CC[C@@H](NC[C@H](O)C2CC2)C1=O	ZINC000819152295	CD	On-Demand	Anodyne	HTR1A	51	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)C2CC2)C1=O	ZINC000819152295	CD	On-Demand	Anodyne	ADRA1D	47	35
COc1ccccc1N1CC[C@@H](NC[C@H](O)C2CC2)C1=O	ZINC000819152295	CD	On-Demand	Anodyne	ADRA1A	42	36
COc1ccccc1N1CC[C@@H](NC[C@@H](O)C2CC2)C1=O	ZINC000819152296	CD	On-Demand	Anodyne	HTR1A	51	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)C2CC2)C1=O	ZINC000819152296	CD	On-Demand	Anodyne	ADRA1D	47	35
COc1ccccc1N1CC[C@@H](NC[C@@H](O)C2CC2)C1=O	ZINC000819152296	CD	On-Demand	Anodyne	ADRA1A	42	36
COc1cc(C)ccc1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819152297	GG	On-Demand	Anodyne	GPR119	45	51
COc1cc(C)ccc1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819152298	GG	On-Demand	Anodyne	GPR119	45	51
COc1ccccc1N1CC[C@@H](NCCS(C)(=O)=O)C1=O	ZINC000819152303	DC	On-Demand	Anodyne	HTR1A	58	41
COc1ccccc1N1CC[C@@H](NCCS(C)(=O)=O)C1=O	ZINC000819152303	DC	On-Demand	Anodyne	DRD2	40	41
COc1ccccc1N1CC[C@@H](NCCS(C)(=O)=O)C1=O	ZINC000819152303	DC	On-Demand	Anodyne	ADRA1D	53	36
COc1ccccc1N1CC[C@@H](NCCS(C)(=O)=O)C1=O	ZINC000819152303	DC	On-Demand	Anodyne	ADRA1A	46	37
COc1ccccc1N1CC[C@@H](NCCS(C)(=O)=O)C1=O	ZINC000819152303	DC	On-Demand	Anodyne	ADRA1B	42	36
COc1ccccc1N1CC[C@H](NCCS(C)(=O)=O)C1=O	ZINC000819152304	DC	On-Demand	Anodyne	HTR1A	58	41
COc1ccccc1N1CC[C@H](NCCS(C)(=O)=O)C1=O	ZINC000819152304	DC	On-Demand	Anodyne	DRD2	40	41
COc1ccccc1N1CC[C@H](NCCS(C)(=O)=O)C1=O	ZINC000819152304	DC	On-Demand	Anodyne	ADRA1D	53	36
COc1ccccc1N1CC[C@H](NCCS(C)(=O)=O)C1=O	ZINC000819152304	DC	On-Demand	Anodyne	ADRA1A	46	37
COc1ccccc1N1CC[C@H](NCCS(C)(=O)=O)C1=O	ZINC000819152304	DC	On-Demand	Anodyne	ADRA1B	42	36
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819152314	FG	On-Demand	Anodyne	HTR1A	58	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819152314	FG	On-Demand	Anodyne	DRD2	51	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819152314	FG	On-Demand	Anodyne	DRD4	31	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819152314	FG	On-Demand	Anodyne	ADRA1D	58	37
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819152314	FG	On-Demand	Anodyne	ADRA1A	50	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819152314	FG	On-Demand	Anodyne	ADRA1B	45	37
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819152314	FG	On-Demand	Anodyne	DRD3	47	47
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819152315	FG	On-Demand	Anodyne	HTR1A	58	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819152315	FG	On-Demand	Anodyne	DRD2	51	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819152315	FG	On-Demand	Anodyne	DRD4	31	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819152315	FG	On-Demand	Anodyne	ADRA1D	58	37
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819152315	FG	On-Demand	Anodyne	ADRA1A	50	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819152315	FG	On-Demand	Anodyne	ADRA1B	45	37
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819152315	FG	On-Demand	Anodyne	DRD3	47	47
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2)C1=O	ZINC000819152328	EE	On-Demand	Anodyne	HTR1A	55	47
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2)C1=O	ZINC000819152328	EE	On-Demand	Anodyne	DRD2	37	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2)C1=O	ZINC000819152328	EE	On-Demand	Anodyne	ADRA1D	50	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2)C1=O	ZINC000819152328	EE	On-Demand	Anodyne	ADRA1A	44	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2)C1=O	ZINC000819152328	EE	On-Demand	Anodyne	ADRA1B	42	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1=O	ZINC000819152329	EE	On-Demand	Anodyne	HTR1A	55	47
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1=O	ZINC000819152329	EE	On-Demand	Anodyne	DRD2	37	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1=O	ZINC000819152329	EE	On-Demand	Anodyne	ADRA1D	50	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1=O	ZINC000819152329	EE	On-Demand	Anodyne	ADRA1A	44	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1=O	ZINC000819152329	EE	On-Demand	Anodyne	ADRA1B	42	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2)C1=O	ZINC000819152330	EE	On-Demand	Anodyne	HTR1A	55	47
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2)C1=O	ZINC000819152330	EE	On-Demand	Anodyne	DRD2	37	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2)C1=O	ZINC000819152330	EE	On-Demand	Anodyne	ADRA1D	50	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2)C1=O	ZINC000819152330	EE	On-Demand	Anodyne	ADRA1A	44	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2)C1=O	ZINC000819152330	EE	On-Demand	Anodyne	ADRA1B	42	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2)C1=O	ZINC000819152331	EE	On-Demand	Anodyne	HTR1A	55	47
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2)C1=O	ZINC000819152331	EE	On-Demand	Anodyne	DRD2	37	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2)C1=O	ZINC000819152331	EE	On-Demand	Anodyne	ADRA1D	50	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2)C1=O	ZINC000819152331	EE	On-Demand	Anodyne	ADRA1A	44	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2)C1=O	ZINC000819152331	EE	On-Demand	Anodyne	ADRA1B	42	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152332	FG	On-Demand	Anodyne	HTR1A	47	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152332	FG	On-Demand	Anodyne	DRD2	48	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152332	FG	On-Demand	Anodyne	DRD4	31	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152332	FG	On-Demand	Anodyne	ADRA1D	50	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152332	FG	On-Demand	Anodyne	ADRA1A	45	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152332	FG	On-Demand	Anodyne	ADRA1B	41	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152332	FG	On-Demand	Anodyne	DRD3	47	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152333	FG	On-Demand	Anodyne	HTR1A	47	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152333	FG	On-Demand	Anodyne	DRD2	48	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152333	FG	On-Demand	Anodyne	DRD4	31	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152333	FG	On-Demand	Anodyne	ADRA1D	50	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152333	FG	On-Demand	Anodyne	ADRA1A	45	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152333	FG	On-Demand	Anodyne	ADRA1B	41	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152333	FG	On-Demand	Anodyne	DRD3	47	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152334	FG	On-Demand	Anodyne	HTR1A	47	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152334	FG	On-Demand	Anodyne	DRD2	48	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152334	FG	On-Demand	Anodyne	DRD4	31	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152334	FG	On-Demand	Anodyne	ADRA1D	50	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152334	FG	On-Demand	Anodyne	ADRA1A	45	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152334	FG	On-Demand	Anodyne	ADRA1B	41	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152334	FG	On-Demand	Anodyne	DRD3	47	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152335	FG	On-Demand	Anodyne	HTR1A	47	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152335	FG	On-Demand	Anodyne	DRD2	48	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152335	FG	On-Demand	Anodyne	DRD4	31	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152335	FG	On-Demand	Anodyne	ADRA1D	50	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152335	FG	On-Demand	Anodyne	ADRA1A	45	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152335	FG	On-Demand	Anodyne	ADRA1B	41	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819152335	FG	On-Demand	Anodyne	DRD3	47	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819152336	EF	On-Demand	Anodyne	HTR1A	64	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819152336	EF	On-Demand	Anodyne	DRD2	51	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819152336	EF	On-Demand	Anodyne	ADRA1D	63	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819152336	EF	On-Demand	Anodyne	ADRA1A	54	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819152336	EF	On-Demand	Anodyne	ADRA1B	49	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819152336	EF	On-Demand	Anodyne	DRD3	50	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819152336	EF	On-Demand	Anodyne	HTR7	43	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819152337	EF	On-Demand	Anodyne	HTR1A	64	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819152337	EF	On-Demand	Anodyne	DRD2	51	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819152337	EF	On-Demand	Anodyne	ADRA1D	63	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819152337	EF	On-Demand	Anodyne	ADRA1A	54	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819152337	EF	On-Demand	Anodyne	ADRA1B	49	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819152337	EF	On-Demand	Anodyne	DRD3	50	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819152337	EF	On-Demand	Anodyne	HTR7	43	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819152338	EF	On-Demand	Anodyne	HTR1A	64	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819152338	EF	On-Demand	Anodyne	DRD2	51	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819152338	EF	On-Demand	Anodyne	ADRA1D	63	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819152338	EF	On-Demand	Anodyne	ADRA1A	54	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819152338	EF	On-Demand	Anodyne	ADRA1B	49	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819152338	EF	On-Demand	Anodyne	DRD3	50	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819152338	EF	On-Demand	Anodyne	HTR7	43	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819152339	EF	On-Demand	Anodyne	HTR1A	64	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819152339	EF	On-Demand	Anodyne	DRD2	51	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819152339	EF	On-Demand	Anodyne	ADRA1D	63	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819152339	EF	On-Demand	Anodyne	ADRA1A	54	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819152339	EF	On-Demand	Anodyne	ADRA1B	49	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819152339	EF	On-Demand	Anodyne	DRD3	50	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819152339	EF	On-Demand	Anodyne	HTR7	43	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cc(C(N)=O)no2)CC1	ZINC000819152345	FC	On-Demand	Anodyne	GPR119	39	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cc(C(N)=O)no2)CC1	ZINC000819152346	FC	On-Demand	Anodyne	GPR119	39	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C)C1	ZINC000819152347	EF	On-Demand	Anodyne	HTR1A	64	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C)C1	ZINC000819152347	EF	On-Demand	Anodyne	DRD2	52	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C)C1	ZINC000819152347	EF	On-Demand	Anodyne	ADRA1D	66	37
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C)C1	ZINC000819152347	EF	On-Demand	Anodyne	ADRA1A	55	37
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C)C1	ZINC000819152347	EF	On-Demand	Anodyne	ADRA1B	51	37
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C)C1	ZINC000819152347	EF	On-Demand	Anodyne	DRD3	50	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2C)C1	ZINC000819152347	EF	On-Demand	Anodyne	HTR7	42	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C)C1	ZINC000819152348	EF	On-Demand	Anodyne	HTR1A	64	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C)C1	ZINC000819152348	EF	On-Demand	Anodyne	DRD2	52	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C)C1	ZINC000819152348	EF	On-Demand	Anodyne	ADRA1D	66	37
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C)C1	ZINC000819152348	EF	On-Demand	Anodyne	ADRA1A	55	37
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C)C1	ZINC000819152348	EF	On-Demand	Anodyne	ADRA1B	51	37
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C)C1	ZINC000819152348	EF	On-Demand	Anodyne	DRD3	50	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2C)C1	ZINC000819152348	EF	On-Demand	Anodyne	HTR7	42	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C)C1	ZINC000819152349	EF	On-Demand	Anodyne	HTR1A	64	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C)C1	ZINC000819152349	EF	On-Demand	Anodyne	DRD2	52	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C)C1	ZINC000819152349	EF	On-Demand	Anodyne	ADRA1D	66	37
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C)C1	ZINC000819152349	EF	On-Demand	Anodyne	ADRA1A	55	37
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C)C1	ZINC000819152349	EF	On-Demand	Anodyne	ADRA1B	51	37
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C)C1	ZINC000819152349	EF	On-Demand	Anodyne	DRD3	50	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2C)C1	ZINC000819152349	EF	On-Demand	Anodyne	HTR7	42	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C)C1	ZINC000819152350	EF	On-Demand	Anodyne	HTR1A	64	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C)C1	ZINC000819152350	EF	On-Demand	Anodyne	DRD2	52	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C)C1	ZINC000819152350	EF	On-Demand	Anodyne	ADRA1D	66	37
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C)C1	ZINC000819152350	EF	On-Demand	Anodyne	ADRA1A	55	37
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C)C1	ZINC000819152350	EF	On-Demand	Anodyne	ADRA1B	51	37
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C)C1	ZINC000819152350	EF	On-Demand	Anodyne	DRD3	50	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2C)C1	ZINC000819152350	EF	On-Demand	Anodyne	HTR7	42	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2C)C1	ZINC000819152351	EG	On-Demand	Anodyne	HTR1A	52	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2C)C1	ZINC000819152351	EG	On-Demand	Anodyne	DRD2	48	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2C)C1	ZINC000819152351	EG	On-Demand	Anodyne	DRD4	26	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2C)C1	ZINC000819152351	EG	On-Demand	Anodyne	ADRA1D	56	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2C)C1	ZINC000819152351	EG	On-Demand	Anodyne	ADRA1A	49	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2C)C1	ZINC000819152351	EG	On-Demand	Anodyne	ADRA1B	45	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2C)C1	ZINC000819152351	EG	On-Demand	Anodyne	DRD3	46	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2C)C1	ZINC000819152352	EG	On-Demand	Anodyne	HTR1A	52	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2C)C1	ZINC000819152352	EG	On-Demand	Anodyne	DRD2	48	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2C)C1	ZINC000819152352	EG	On-Demand	Anodyne	DRD4	26	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2C)C1	ZINC000819152352	EG	On-Demand	Anodyne	ADRA1D	56	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2C)C1	ZINC000819152352	EG	On-Demand	Anodyne	ADRA1A	49	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2C)C1	ZINC000819152352	EG	On-Demand	Anodyne	ADRA1B	45	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2C)C1	ZINC000819152352	EG	On-Demand	Anodyne	DRD3	46	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2C)C1	ZINC000819152353	EG	On-Demand	Anodyne	HTR1A	52	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2C)C1	ZINC000819152353	EG	On-Demand	Anodyne	DRD2	48	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2C)C1	ZINC000819152353	EG	On-Demand	Anodyne	DRD4	26	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2C)C1	ZINC000819152353	EG	On-Demand	Anodyne	ADRA1D	56	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2C)C1	ZINC000819152353	EG	On-Demand	Anodyne	ADRA1A	49	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2C)C1	ZINC000819152353	EG	On-Demand	Anodyne	ADRA1B	45	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2C)C1	ZINC000819152353	EG	On-Demand	Anodyne	DRD3	46	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2C)C1	ZINC000819152354	EG	On-Demand	Anodyne	HTR1A	52	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2C)C1	ZINC000819152354	EG	On-Demand	Anodyne	DRD2	48	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2C)C1	ZINC000819152354	EG	On-Demand	Anodyne	DRD4	26	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2C)C1	ZINC000819152354	EG	On-Demand	Anodyne	ADRA1D	56	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2C)C1	ZINC000819152354	EG	On-Demand	Anodyne	ADRA1A	49	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2C)C1	ZINC000819152354	EG	On-Demand	Anodyne	ADRA1B	45	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2C)C1	ZINC000819152354	EG	On-Demand	Anodyne	DRD3	46	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1=O	ZINC000819152355	FD	On-Demand	Mild	HTR1A	27	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1=O	ZINC000819152355	FD	On-Demand	Mild	DRD2	15	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1=O	ZINC000819152355	FD	On-Demand	Mild	HTR7	17	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1=O	ZINC000819152356	FD	On-Demand	Mild	HTR1A	27	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1=O	ZINC000819152356	FD	On-Demand	Mild	DRD2	15	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1=O	ZINC000819152356	FD	On-Demand	Mild	HTR7	17	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1=O	ZINC000819152357	FD	On-Demand	Mild	HTR1A	27	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1=O	ZINC000819152357	FD	On-Demand	Mild	DRD2	15	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1=O	ZINC000819152357	FD	On-Demand	Mild	HTR7	17	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1=O	ZINC000819152358	FD	On-Demand	Mild	HTR1A	27	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1=O	ZINC000819152358	FD	On-Demand	Mild	DRD2	15	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1=O	ZINC000819152358	FD	On-Demand	Mild	HTR7	17	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819152378	EE	On-Demand	Mild	HTR1A	44	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819152378	EE	On-Demand	Mild	DRD2	35	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819152378	EE	On-Demand	Mild	ADRA1D	44	36
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819152378	EE	On-Demand	Mild	DRD3	32	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819152378	EE	On-Demand	Mild	ADRB3	16	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819152378	EE	On-Demand	Mild	HTR7	29	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819152379	EE	On-Demand	Mild	HTR1A	44	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819152379	EE	On-Demand	Mild	DRD2	35	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819152379	EE	On-Demand	Mild	ADRA1D	44	36
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819152379	EE	On-Demand	Mild	DRD3	32	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819152379	EE	On-Demand	Mild	ADRB3	16	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819152379	EE	On-Demand	Mild	HTR7	29	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819152380	EE	On-Demand	Mild	HTR1A	44	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819152380	EE	On-Demand	Mild	DRD2	35	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819152380	EE	On-Demand	Mild	ADRA1D	44	36
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819152380	EE	On-Demand	Mild	DRD3	32	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819152380	EE	On-Demand	Mild	ADRB3	16	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819152380	EE	On-Demand	Mild	HTR7	29	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819152381	EE	On-Demand	Mild	HTR1A	44	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819152381	EE	On-Demand	Mild	DRD2	35	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819152381	EE	On-Demand	Mild	ADRA1D	44	36
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819152381	EE	On-Demand	Mild	DRD3	32	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819152381	EE	On-Demand	Mild	ADRB3	16	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819152381	EE	On-Demand	Mild	HTR7	29	44
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H](C)c1ccc(C#N)cc1	ZINC000819152394	GI	On-Demand	Mild	PAPA1_CARPA	40	41
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H](C)c1ccc(C#N)cc1	ZINC000819152394	GI	On-Demand	Mild	CTSK	19	41
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H](C)c1ccc(C#N)cc1	ZINC000819152394	GI	On-Demand	Mild	CTRB_BOVIN	56	32
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H](C)c1ccc(C#N)cc1	ZINC000819152395	GI	On-Demand	Mild	PAPA1_CARPA	40	41
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H](C)c1ccc(C#N)cc1	ZINC000819152395	GI	On-Demand	Mild	CTSK	19	41
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H](C)c1ccc(C#N)cc1	ZINC000819152395	GI	On-Demand	Mild	CTRB_BOVIN	56	32
CN1CCN(c2ccncc2NC(=O)C(F)=C2CCC2)CC1	ZINC000819152412	DE	On-Demand	Anodyne	PIM3	15	43
CCOC(=O)N(C)c1ccc(NC(=O)c2cc(C)ccc2C2CC2)cc1	ZINC000819152430	FJ	On-Demand	Anodyne	KCNK3	47	35
CCOC(=O)N(C)c1ccc(NC(=O)c2cc(C)ccc2C2CC2)cc1	ZINC000819152430	FJ	On-Demand	Anodyne	KCNK9	44	35
C=CCC1(C(=O)Nc2cccc(N3CCCCC3)c2)CCOCC1	ZINC000819152431	EH	On-Demand	Mild	LIMK2	17	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1=O	ZINC000819152432	FF	On-Demand	Anodyne	HTR1A	39	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1=O	ZINC000819152432	FF	On-Demand	Anodyne	DRD2	27	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1=O	ZINC000819152432	FF	On-Demand	Anodyne	DRD4	16	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1=O	ZINC000819152432	FF	On-Demand	Anodyne	ADRA1A	31	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1=O	ZINC000819152432	FF	On-Demand	Anodyne	DRD3	25	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1=O	ZINC000819152433	FF	On-Demand	Anodyne	HTR1A	39	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1=O	ZINC000819152433	FF	On-Demand	Anodyne	DRD2	27	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1=O	ZINC000819152433	FF	On-Demand	Anodyne	DRD4	16	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1=O	ZINC000819152433	FF	On-Demand	Anodyne	ADRA1A	31	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1=O	ZINC000819152433	FF	On-Demand	Anodyne	DRD3	25	43
COc1ccccc1N1CC[C@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1=O	ZINC000819152440	GD	On-Demand	Anodyne	HTR1A	46	39
COc1ccccc1N1CC[C@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1=O	ZINC000819152440	GD	On-Demand	Anodyne	DRD2	35	52
COc1ccccc1N1CC[C@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1=O	ZINC000819152440	GD	On-Demand	Anodyne	DRD3	45	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1=O	ZINC000819152441	GD	On-Demand	Anodyne	HTR1A	46	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1=O	ZINC000819152441	GD	On-Demand	Anodyne	DRD2	35	52
COc1ccccc1N1CC[C@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1=O	ZINC000819152441	GD	On-Demand	Anodyne	DRD3	45	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1=O	ZINC000819152442	GD	On-Demand	Anodyne	HTR1A	46	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1=O	ZINC000819152442	GD	On-Demand	Anodyne	DRD2	35	52
COc1ccccc1N1CC[C@@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C1=O	ZINC000819152442	GD	On-Demand	Anodyne	DRD3	45	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1=O	ZINC000819152443	GD	On-Demand	Anodyne	HTR1A	46	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1=O	ZINC000819152443	GD	On-Demand	Anodyne	DRD2	35	52
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C1=O	ZINC000819152443	GD	On-Demand	Anodyne	DRD3	45	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819152444	FG	On-Demand	Anodyne	HTR1A	39	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819152444	FG	On-Demand	Anodyne	DRD2	37	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819152444	FG	On-Demand	Anodyne	ADRA1D	47	39
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819152444	FG	On-Demand	Anodyne	ADRA1A	40	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819152445	FG	On-Demand	Anodyne	HTR1A	39	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819152445	FG	On-Demand	Anodyne	DRD2	37	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819152445	FG	On-Demand	Anodyne	ADRA1D	47	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819152445	FG	On-Demand	Anodyne	ADRA1A	40	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819152446	FG	On-Demand	Anodyne	HTR1A	39	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819152446	FG	On-Demand	Anodyne	DRD2	37	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819152446	FG	On-Demand	Anodyne	ADRA1D	47	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819152446	FG	On-Demand	Anodyne	ADRA1A	40	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819152447	FG	On-Demand	Anodyne	HTR1A	39	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819152447	FG	On-Demand	Anodyne	DRD2	37	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819152447	FG	On-Demand	Anodyne	ADRA1D	47	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819152447	FG	On-Demand	Anodyne	ADRA1A	40	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1=O	ZINC000819152448	GG	On-Demand	Anodyne	HTR1A	53	37
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1=O	ZINC000819152448	GG	On-Demand	Anodyne	ADRA1D	29	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1=O	ZINC000819152448	GG	On-Demand	Anodyne	ADRA1A	30	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1=O	ZINC000819152448	GG	On-Demand	Anodyne	ADRA1B	26	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1=O	ZINC000819152448	GG	On-Demand	Anodyne	DRD3	40	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1=O	ZINC000819152448	GG	On-Demand	Anodyne	HTR7	40	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1=O	ZINC000819152449	GG	On-Demand	Anodyne	HTR1A	53	37
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1=O	ZINC000819152449	GG	On-Demand	Anodyne	ADRA1D	29	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1=O	ZINC000819152449	GG	On-Demand	Anodyne	ADRA1A	30	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1=O	ZINC000819152449	GG	On-Demand	Anodyne	ADRA1B	26	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1=O	ZINC000819152449	GG	On-Demand	Anodyne	DRD3	40	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1=O	ZINC000819152449	GG	On-Demand	Anodyne	HTR7	40	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152450	FF	On-Demand	Anodyne	ADRB1	34	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152450	FF	On-Demand	Anodyne	DRD2	35	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152450	FF	On-Demand	Anodyne	DRD4	21	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152450	FF	On-Demand	Anodyne	ADRB3	55	47
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152450	FF	On-Demand	Anodyne	CYP3A4	49	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152451	FF	On-Demand	Anodyne	ADRB1	34	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152451	FF	On-Demand	Anodyne	DRD2	35	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152451	FF	On-Demand	Anodyne	DRD4	21	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152451	FF	On-Demand	Anodyne	ADRB3	55	47
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152451	FF	On-Demand	Anodyne	CYP3A4	49	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152452	FF	On-Demand	Anodyne	ADRB1	34	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152452	FF	On-Demand	Anodyne	DRD2	35	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152452	FF	On-Demand	Anodyne	DRD4	21	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152452	FF	On-Demand	Anodyne	ADRB3	55	47
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152452	FF	On-Demand	Anodyne	CYP3A4	49	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152453	FF	On-Demand	Anodyne	ADRB1	34	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152453	FF	On-Demand	Anodyne	DRD2	35	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152453	FF	On-Demand	Anodyne	DRD4	21	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152453	FF	On-Demand	Anodyne	ADRB3	55	47
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819152453	FF	On-Demand	Anodyne	CYP3A4	49	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1=O	ZINC000819152476	EE	On-Demand	Anodyne	HTR1A	42	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1=O	ZINC000819152476	EE	On-Demand	Anodyne	ADRA1D	40	34
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1=O	ZINC000819152476	EE	On-Demand	Anodyne	DRD3	40	37
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1=O	ZINC000819152477	EE	On-Demand	Anodyne	HTR1A	42	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1=O	ZINC000819152477	EE	On-Demand	Anodyne	ADRA1D	40	34
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1=O	ZINC000819152477	EE	On-Demand	Anodyne	DRD3	40	37
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2F)C1=O	ZINC000819152478	EE	On-Demand	Anodyne	HTR1A	42	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2F)C1=O	ZINC000819152478	EE	On-Demand	Anodyne	ADRA1D	40	34
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2F)C1=O	ZINC000819152478	EE	On-Demand	Anodyne	DRD3	40	37
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1=O	ZINC000819152479	EE	On-Demand	Anodyne	HTR1A	42	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1=O	ZINC000819152479	EE	On-Demand	Anodyne	ADRA1D	40	34
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1=O	ZINC000819152479	EE	On-Demand	Anodyne	DRD3	40	37
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819152508	FE	On-Demand	Bother	HTR1A	20	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819152508	FE	On-Demand	Bother	ADRA1D	19	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819152508	FE	On-Demand	Bother	ADRA1A	17	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819152508	FE	On-Demand	Bother	ADRA1B	17	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819152509	FE	On-Demand	Bother	HTR1A	20	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819152509	FE	On-Demand	Bother	ADRA1D	19	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819152509	FE	On-Demand	Bother	ADRA1A	17	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819152509	FE	On-Demand	Bother	ADRA1B	17	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819152510	FE	On-Demand	Bother	HTR1A	20	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819152510	FE	On-Demand	Bother	ADRA1D	19	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819152510	FE	On-Demand	Bother	ADRA1A	17	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819152510	FE	On-Demand	Bother	ADRA1B	17	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819152511	FE	On-Demand	Bother	HTR1A	20	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819152511	FE	On-Demand	Bother	ADRA1D	19	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819152511	FE	On-Demand	Bother	ADRA1A	17	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819152511	FE	On-Demand	Bother	ADRA1B	17	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)C1=O	ZINC000819152512	GD	On-Demand	Anodyne	HTR1A	41	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)C1=O	ZINC000819152512	GD	On-Demand	Anodyne	DRD2	25	40
COc1ccccc1N1CC[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C1=O	ZINC000819152513	GD	On-Demand	Anodyne	HTR1A	41	40
COc1ccccc1N1CC[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C1=O	ZINC000819152513	GD	On-Demand	Anodyne	DRD2	25	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)C1=O	ZINC000819152514	GD	On-Demand	Anodyne	HTR1A	41	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)C1=O	ZINC000819152514	GD	On-Demand	Anodyne	DRD2	25	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C1=O	ZINC000819152515	GD	On-Demand	Anodyne	HTR1A	41	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C1=O	ZINC000819152515	GD	On-Demand	Anodyne	DRD2	25	40
O[C@@H](CNCCc1nnc(-c2ccccc2)o1)c1ccc(C(F)(F)F)cc1	ZINC000819152516	GH	On-Demand	Anodyne	ADRB2	15	45
O[C@@H](CNCCc1nnc(-c2ccccc2)o1)c1ccc(C(F)(F)F)cc1	ZINC000819152516	GH	On-Demand	Anodyne	ADRB3	39	45
O[C@H](CNCCc1nnc(-c2ccccc2)o1)c1ccc(C(F)(F)F)cc1	ZINC000819152517	GH	On-Demand	Anodyne	ADRB2	15	45
O[C@H](CNCCc1nnc(-c2ccccc2)o1)c1ccc(C(F)(F)F)cc1	ZINC000819152517	GH	On-Demand	Anodyne	ADRB3	39	45
CS(=O)(=O)c1ccc([C@@H](O)CNCC2(Cc3ccccc3)CCC2)cc1	ZINC000819152522	FG	On-Demand	Anodyne	ADRB3	46	42
CS(=O)(=O)c1ccc([C@@H](O)CNCC2(Cc3ccccc3)CCC2)cc1	ZINC000819152522	FG	On-Demand	Anodyne	SLC12A5	19	41
CS(=O)(=O)c1ccc([C@H](O)CNCC2(Cc3ccccc3)CCC2)cc1	ZINC000819152523	FG	On-Demand	Anodyne	ADRB3	46	42
CS(=O)(=O)c1ccc([C@H](O)CNCC2(Cc3ccccc3)CCC2)cc1	ZINC000819152523	FG	On-Demand	Anodyne	SLC12A5	19	41
O[C@@H](CNCCc1nnc(-c2ccccc2)o1)c1cccc(C(F)(F)F)c1	ZINC000819152534	GH	On-Demand	Anodyne	ADRB2	20	41
O[C@@H](CNCCc1nnc(-c2ccccc2)o1)c1cccc(C(F)(F)F)c1	ZINC000819152534	GH	On-Demand	Anodyne	ADRB3	58	41
O[C@H](CNCCc1nnc(-c2ccccc2)o1)c1cccc(C(F)(F)F)c1	ZINC000819152535	GH	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNCCc1nnc(-c2ccccc2)o1)c1cccc(C(F)(F)F)c1	ZINC000819152535	GH	On-Demand	Anodyne	ADRB3	58	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152552	GH	On-Demand	Anodyne	HTR1A	42	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152552	GH	On-Demand	Anodyne	DRD2	35	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152552	GH	On-Demand	Anodyne	ADRA1D	43	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152552	GH	On-Demand	Anodyne	ADRA1A	37	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152552	GH	On-Demand	Anodyne	ADRA1B	35	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152552	GH	On-Demand	Anodyne	DRD3	30	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152552	GH	On-Demand	Anodyne	LIPG	52	36
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152553	GH	On-Demand	Anodyne	HTR1A	42	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152553	GH	On-Demand	Anodyne	DRD2	35	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152553	GH	On-Demand	Anodyne	ADRA1D	43	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152553	GH	On-Demand	Anodyne	ADRA1A	37	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152553	GH	On-Demand	Anodyne	ADRA1B	35	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152553	GH	On-Demand	Anodyne	DRD3	30	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152553	GH	On-Demand	Anodyne	LIPG	52	36
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152554	GH	On-Demand	Anodyne	HTR1A	42	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152554	GH	On-Demand	Anodyne	DRD2	35	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152554	GH	On-Demand	Anodyne	ADRA1D	43	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152554	GH	On-Demand	Anodyne	ADRA1A	37	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152554	GH	On-Demand	Anodyne	ADRA1B	35	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152554	GH	On-Demand	Anodyne	DRD3	30	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152554	GH	On-Demand	Anodyne	LIPG	52	36
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152555	GH	On-Demand	Anodyne	HTR1A	42	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152555	GH	On-Demand	Anodyne	DRD2	35	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152555	GH	On-Demand	Anodyne	ADRA1D	43	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152555	GH	On-Demand	Anodyne	ADRA1A	37	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152555	GH	On-Demand	Anodyne	ADRA1B	35	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152555	GH	On-Demand	Anodyne	DRD3	30	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819152555	GH	On-Demand	Anodyne	LIPG	52	36
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1=O	ZINC000819152561	FE	On-Demand	Anodyne	HTR1A	32	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1=O	ZINC000819152561	FE	On-Demand	Anodyne	DRD2	25	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1=O	ZINC000819152561	FE	On-Demand	Anodyne	ADRA1D	40	37
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1=O	ZINC000819152562	FE	On-Demand	Anodyne	HTR1A	32	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1=O	ZINC000819152562	FE	On-Demand	Anodyne	DRD2	25	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1=O	ZINC000819152562	FE	On-Demand	Anodyne	ADRA1D	40	37
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1=O	ZINC000819152563	FE	On-Demand	Anodyne	HTR1A	32	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1=O	ZINC000819152563	FE	On-Demand	Anodyne	DRD2	25	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1=O	ZINC000819152563	FE	On-Demand	Anodyne	ADRA1D	40	37
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1=O	ZINC000819152564	FE	On-Demand	Anodyne	HTR1A	32	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1=O	ZINC000819152564	FE	On-Demand	Anodyne	DRD2	25	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1=O	ZINC000819152564	FE	On-Demand	Anodyne	ADRA1D	40	37
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1=O	ZINC000819152565	GG	On-Demand	Anodyne	HTR1A	28	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1=O	ZINC000819152565	GG	On-Demand	Anodyne	DRD2	17	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1=O	ZINC000819152566	GG	On-Demand	Anodyne	HTR1A	28	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1=O	ZINC000819152566	GG	On-Demand	Anodyne	DRD2	17	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1=O	ZINC000819152567	GG	On-Demand	Anodyne	HTR1A	28	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1=O	ZINC000819152567	GG	On-Demand	Anodyne	DRD2	17	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1=O	ZINC000819152568	GG	On-Demand	Anodyne	HTR1A	28	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1=O	ZINC000819152568	GG	On-Demand	Anodyne	DRD2	17	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152569	GH	On-Demand	Anodyne	HTR1A	45	47
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152569	GH	On-Demand	Anodyne	DRD2	36	47
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152569	GH	On-Demand	Anodyne	ADRA1D	47	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152569	GH	On-Demand	Anodyne	ADRA1A	39	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152569	GH	On-Demand	Anodyne	ADRA1B	37	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152569	GH	On-Demand	Anodyne	DRD3	34	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152569	GH	On-Demand	Anodyne	ADRB3	15	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152569	GH	On-Demand	Anodyne	LIPG	50	36
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152570	GH	On-Demand	Anodyne	HTR1A	45	47
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152570	GH	On-Demand	Anodyne	DRD2	36	47
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152570	GH	On-Demand	Anodyne	ADRA1D	47	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152570	GH	On-Demand	Anodyne	ADRA1A	39	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152570	GH	On-Demand	Anodyne	ADRA1B	37	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152570	GH	On-Demand	Anodyne	DRD3	34	41
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152570	GH	On-Demand	Anodyne	ADRB3	15	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152570	GH	On-Demand	Anodyne	LIPG	50	36
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152571	GH	On-Demand	Anodyne	HTR1A	45	47
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152571	GH	On-Demand	Anodyne	DRD2	36	47
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152571	GH	On-Demand	Anodyne	ADRA1D	47	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152571	GH	On-Demand	Anodyne	ADRA1A	39	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152571	GH	On-Demand	Anodyne	ADRA1B	37	44
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152571	GH	On-Demand	Anodyne	DRD3	34	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152571	GH	On-Demand	Anodyne	ADRB3	15	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152571	GH	On-Demand	Anodyne	LIPG	50	36
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152572	GH	On-Demand	Anodyne	HTR1A	45	47
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152572	GH	On-Demand	Anodyne	DRD2	36	47
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152572	GH	On-Demand	Anodyne	ADRA1D	47	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152572	GH	On-Demand	Anodyne	ADRA1A	39	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152572	GH	On-Demand	Anodyne	ADRA1B	37	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152572	GH	On-Demand	Anodyne	DRD3	34	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152572	GH	On-Demand	Anodyne	ADRB3	15	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819152572	GH	On-Demand	Anodyne	LIPG	50	36
NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)/C=C\[C@@H]1CCCO1	ZINC000819152576	GF	On-Demand	Anodyne	Q6PRC7_IXORI	56	38
NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)/C=C/[C@H]1CCCO1	ZINC000819152577	GF	On-Demand	Anodyne	Q6PRC7_IXORI	56	38
NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)/C=C\[C@H]1CCCO1	ZINC000819152578	GF	On-Demand	Anodyne	Q6PRC7_IXORI	56	38
NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)/C=C/[C@@H]1CCCO1	ZINC000819152579	GF	On-Demand	Anodyne	Q6PRC7_IXORI	56	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819152580	EG	On-Demand	Anodyne	HTR1A	59	47
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819152580	EG	On-Demand	Anodyne	DRD2	49	47
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819152580	EG	On-Demand	Anodyne	DRD4	34	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819152580	EG	On-Demand	Anodyne	ADRA1D	66	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819152580	EG	On-Demand	Anodyne	ADRA1A	54	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819152580	EG	On-Demand	Anodyne	ADRA1B	52	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819152580	EG	On-Demand	Anodyne	DRD3	45	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819152580	EG	On-Demand	Anodyne	ADRB3	29	46
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819152580	EG	On-Demand	Anodyne	HTR7	37	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819152581	EG	On-Demand	Anodyne	HTR1A	59	47
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819152581	EG	On-Demand	Anodyne	DRD2	49	47
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819152581	EG	On-Demand	Anodyne	DRD4	34	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819152581	EG	On-Demand	Anodyne	ADRA1D	66	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819152581	EG	On-Demand	Anodyne	ADRA1A	54	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819152581	EG	On-Demand	Anodyne	ADRA1B	52	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819152581	EG	On-Demand	Anodyne	DRD3	45	44
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819152581	EG	On-Demand	Anodyne	ADRB3	29	46
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819152581	EG	On-Demand	Anodyne	HTR7	37	43
O=S1(=O)CCc2cc(CNC[C@H](O)c3cccnc3)ccc21	ZINC000819152586	DD	On-Demand	Anodyne	ADRB2	23	41
O=S1(=O)CCc2cc(CNC[C@H](O)c3cccnc3)ccc21	ZINC000819152586	DD	On-Demand	Anodyne	ADRB3	91	42
O=S1(=O)CCc2cc(CNC[C@@H](O)c3cccnc3)ccc21	ZINC000819152587	DD	On-Demand	Anodyne	ADRB2	23	41
O=S1(=O)CCc2cc(CNC[C@@H](O)c3cccnc3)ccc21	ZINC000819152587	DD	On-Demand	Anodyne	ADRB3	91	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152590	GG	On-Demand	Anodyne	HTR1A	39	48
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152590	GG	On-Demand	Anodyne	DRD2	33	48
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152590	GG	On-Demand	Anodyne	ADRA1D	40	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152590	GG	On-Demand	Anodyne	ADRA1A	33	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152590	GG	On-Demand	Anodyne	ADRA1B	32	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152591	GG	On-Demand	Anodyne	HTR1A	39	48
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152591	GG	On-Demand	Anodyne	DRD2	33	48
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152591	GG	On-Demand	Anodyne	ADRA1D	40	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152591	GG	On-Demand	Anodyne	ADRA1A	33	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152591	GG	On-Demand	Anodyne	ADRA1B	32	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152592	GG	On-Demand	Anodyne	HTR1A	39	48
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152592	GG	On-Demand	Anodyne	DRD2	33	48
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152592	GG	On-Demand	Anodyne	ADRA1D	40	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152592	GG	On-Demand	Anodyne	ADRA1A	33	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152592	GG	On-Demand	Anodyne	ADRA1B	32	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152593	GG	On-Demand	Anodyne	HTR1A	39	48
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152593	GG	On-Demand	Anodyne	DRD2	33	48
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152593	GG	On-Demand	Anodyne	ADRA1D	40	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152593	GG	On-Demand	Anodyne	ADRA1A	33	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819152593	GG	On-Demand	Anodyne	ADRA1B	32	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819152598	EG	On-Demand	Anodyne	HTR1A	60	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819152598	EG	On-Demand	Anodyne	DRD2	56	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819152598	EG	On-Demand	Anodyne	ADRA1D	62	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819152598	EG	On-Demand	Anodyne	ADRA1A	51	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819152598	EG	On-Demand	Anodyne	ADRA1B	48	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819152598	EG	On-Demand	Anodyne	DRD3	54	39
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819152598	EG	On-Demand	Anodyne	HTR7	43	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819152599	EG	On-Demand	Anodyne	HTR1A	60	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819152599	EG	On-Demand	Anodyne	DRD2	56	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819152599	EG	On-Demand	Anodyne	ADRA1D	62	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819152599	EG	On-Demand	Anodyne	ADRA1A	51	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819152599	EG	On-Demand	Anodyne	ADRA1B	48	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819152599	EG	On-Demand	Anodyne	DRD3	54	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819152599	EG	On-Demand	Anodyne	HTR7	43	40
CCOC(=O)N(C)c1ccc(NC(=O)C[S@@](=O)c2cccc(OC)c2)cc1	ZINC000819152604	GG	On-Demand	Anodyne	MTNR1A	24	53
CCOC(=O)N(C)c1ccc(NC(=O)C[S@@](=O)c2cccc(OC)c2)cc1	ZINC000819152604	GG	On-Demand	Anodyne	MTNR1B	29	53
CCOC(=O)N(C)c1ccc(NC(=O)C[S@@](=O)c2cccc(OC)c2)cc1	ZINC000819152604	GG	On-Demand	Anodyne	ACR	27	40
CCOC(=O)N(C)c1ccc(NC(=O)C[S@](=O)c2cccc(OC)c2)cc1	ZINC000819152605	GG	On-Demand	Anodyne	MTNR1A	24	53
CCOC(=O)N(C)c1ccc(NC(=O)C[S@](=O)c2cccc(OC)c2)cc1	ZINC000819152605	GG	On-Demand	Anodyne	MTNR1B	29	53
CCOC(=O)N(C)c1ccc(NC(=O)C[S@](=O)c2cccc(OC)c2)cc1	ZINC000819152605	GG	On-Demand	Anodyne	ACR	27	40
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)C(=O)NCc1ccccc1	ZINC000819152620	DD	On-Demand	Anodyne	REN	23	40
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)C(=O)NCc1ccccc1	ZINC000819152620	DD	On-Demand	Anodyne	PROC	58	37
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)C(=O)NCc1ccccc1	ZINC000819152620	DD	On-Demand	Anodyne	Q6PRC7_IXORI	61	34
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)C(=O)NCc1ccccc1	ZINC000819152621	DD	On-Demand	Anodyne	REN	23	40
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)C(=O)NCc1ccccc1	ZINC000819152621	DD	On-Demand	Anodyne	PROC	58	37
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)C(=O)NCc1ccccc1	ZINC000819152621	DD	On-Demand	Anodyne	Q6PRC7_IXORI	61	34
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)C(=O)NCc1ccccc1	ZINC000819152622	DD	On-Demand	Anodyne	REN	23	40
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)C(=O)NCc1ccccc1	ZINC000819152622	DD	On-Demand	Anodyne	PROC	58	37
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)C(=O)NCc1ccccc1	ZINC000819152622	DD	On-Demand	Anodyne	Q6PRC7_IXORI	61	34
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)C(=O)NCc1ccccc1	ZINC000819152623	DD	On-Demand	Anodyne	REN	23	40
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)C(=O)NCc1ccccc1	ZINC000819152623	DD	On-Demand	Anodyne	PROC	58	37
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)C(=O)NCc1ccccc1	ZINC000819152623	DD	On-Demand	Anodyne	Q6PRC7_IXORI	61	34
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819152624	GG	On-Demand	Anodyne	HTR1A	56	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819152624	GG	On-Demand	Anodyne	DRD2	50	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819152624	GG	On-Demand	Anodyne	ADRA1D	56	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819152624	GG	On-Demand	Anodyne	ADRA1A	46	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819152624	GG	On-Demand	Anodyne	ADRA1B	43	38
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819152624	GG	On-Demand	Anodyne	DRD3	50	37
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819152625	GG	On-Demand	Anodyne	HTR1A	56	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819152625	GG	On-Demand	Anodyne	DRD2	50	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819152625	GG	On-Demand	Anodyne	ADRA1D	56	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819152625	GG	On-Demand	Anodyne	ADRA1A	46	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819152625	GG	On-Demand	Anodyne	ADRA1B	43	38
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819152625	GG	On-Demand	Anodyne	DRD3	50	37
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819152626	GG	On-Demand	Anodyne	HTR1A	56	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819152626	GG	On-Demand	Anodyne	DRD2	50	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819152626	GG	On-Demand	Anodyne	ADRA1D	56	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819152626	GG	On-Demand	Anodyne	ADRA1A	46	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819152626	GG	On-Demand	Anodyne	ADRA1B	43	38
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819152626	GG	On-Demand	Anodyne	DRD3	50	37
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819152627	GG	On-Demand	Anodyne	HTR1A	56	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819152627	GG	On-Demand	Anodyne	DRD2	50	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819152627	GG	On-Demand	Anodyne	ADRA1D	56	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819152627	GG	On-Demand	Anodyne	ADRA1A	46	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819152627	GG	On-Demand	Anodyne	ADRA1B	43	38
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819152627	GG	On-Demand	Anodyne	DRD3	50	37
COC(=O)[C@@H]1CCCCN1C(=O)C(F)=C1CCC1	ZINC000819152640	CD	On-Demand	Anodyne	FKBP1A	61	39
COC(=O)[C@@H]1CCCCN1C(=O)C(F)=C1CCC1	ZINC000819152640	CD	On-Demand	Anodyne	PREP	16	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819152647	DD	On-Demand	Anodyne	HTR1A	55	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819152647	DD	On-Demand	Anodyne	DRD2	41	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819152647	DD	On-Demand	Anodyne	ADRA1D	56	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819152647	DD	On-Demand	Anodyne	ADRA1A	47	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819152647	DD	On-Demand	Anodyne	ADRA1B	44	42
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819152647	DD	On-Demand	Anodyne	ADRB3	58	47
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819152647	DD	On-Demand	Anodyne	SCD	16	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819152648	DD	On-Demand	Anodyne	HTR1A	55	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819152648	DD	On-Demand	Anodyne	DRD2	41	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819152648	DD	On-Demand	Anodyne	ADRA1D	56	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819152648	DD	On-Demand	Anodyne	ADRA1A	47	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819152648	DD	On-Demand	Anodyne	ADRA1B	44	42
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819152648	DD	On-Demand	Anodyne	ADRB3	58	47
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819152648	DD	On-Demand	Anodyne	SCD	16	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819152649	DD	On-Demand	Anodyne	HTR1A	55	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819152649	DD	On-Demand	Anodyne	DRD2	41	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819152649	DD	On-Demand	Anodyne	ADRA1D	56	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819152649	DD	On-Demand	Anodyne	ADRA1A	47	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819152649	DD	On-Demand	Anodyne	ADRA1B	44	42
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819152649	DD	On-Demand	Anodyne	ADRB3	58	47
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819152649	DD	On-Demand	Anodyne	SCD	16	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819152650	DD	On-Demand	Anodyne	HTR1A	55	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819152650	DD	On-Demand	Anodyne	DRD2	41	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819152650	DD	On-Demand	Anodyne	ADRA1D	56	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819152650	DD	On-Demand	Anodyne	ADRA1A	47	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819152650	DD	On-Demand	Anodyne	ADRA1B	44	42
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819152650	DD	On-Demand	Anodyne	ADRB3	58	47
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819152650	DD	On-Demand	Anodyne	SCD	16	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1=O	ZINC000819152651	GG	On-Demand	Anodyne	P2RX7	19	41
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1=O	ZINC000819152652	GG	On-Demand	Anodyne	P2RX7	19	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1=O	ZINC000819152653	GG	On-Demand	Anodyne	P2RX7	19	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1=O	ZINC000819152654	GG	On-Demand	Anodyne	P2RX7	19	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1=O	ZINC000819152670	FF	On-Demand	Anodyne	HTR1A	39	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1=O	ZINC000819152670	FF	On-Demand	Anodyne	DRD2	26	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1=O	ZINC000819152670	FF	On-Demand	Anodyne	DRD4	17	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1=O	ZINC000819152670	FF	On-Demand	Anodyne	ADRA1D	43	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1=O	ZINC000819152670	FF	On-Demand	Anodyne	ADRA1A	36	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1=O	ZINC000819152670	FF	On-Demand	Anodyne	ADRA1B	38	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1=O	ZINC000819152670	FF	On-Demand	Anodyne	DRD3	21	41
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1=O	ZINC000819152670	FF	On-Demand	Anodyne	ADRB3	21	44
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1=O	ZINC000819152671	FF	On-Demand	Anodyne	HTR1A	39	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1=O	ZINC000819152671	FF	On-Demand	Anodyne	DRD2	26	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1=O	ZINC000819152671	FF	On-Demand	Anodyne	DRD4	17	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1=O	ZINC000819152671	FF	On-Demand	Anodyne	ADRA1D	43	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1=O	ZINC000819152671	FF	On-Demand	Anodyne	ADRA1A	36	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1=O	ZINC000819152671	FF	On-Demand	Anodyne	ADRA1B	38	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1=O	ZINC000819152671	FF	On-Demand	Anodyne	DRD3	21	41
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1=O	ZINC000819152671	FF	On-Demand	Anodyne	ADRB3	21	44
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819152678	EF	On-Demand	Anodyne	HTR1A	55	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819152678	EF	On-Demand	Anodyne	DRD2	52	45
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819152678	EF	On-Demand	Anodyne	DRD4	28	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819152678	EF	On-Demand	Anodyne	ADRA1D	63	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819152678	EF	On-Demand	Anodyne	ADRA1A	55	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819152678	EF	On-Demand	Anodyne	ADRA1B	50	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819152678	EF	On-Demand	Anodyne	DRD3	48	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819152678	EF	On-Demand	Anodyne	HTR7	42	39
O=C(NC1CCCCC1)NC1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819152679	EE	On-Demand	Anodyne	EPHX2	24	54
O=C(NC1CCCCC1)NC1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819152680	EE	On-Demand	Anodyne	EPHX2	24	54
O=C(NC1CCCCC1)NC1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819152681	EE	On-Demand	Anodyne	EPHX2	24	54
O=C(NC1CCCCC1)NC1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819152682	EE	On-Demand	Anodyne	EPHX2	24	54
CN(C[C@@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819152709	GG	On-Demand	Anodyne	CTSD	37	42
CN(C[C@@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819152709	GG	On-Demand	Anodyne	BACE1	34	49
CN(C[C@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819152710	GG	On-Demand	Anodyne	CTSD	37	42
CN(C[C@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819152710	GG	On-Demand	Anodyne	BACE1	34	49
CN(C[C@@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819152711	GG	On-Demand	Anodyne	CTSD	37	42
CN(C[C@@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819152711	GG	On-Demand	Anodyne	BACE1	34	49
CN(C[C@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819152712	GG	On-Demand	Anodyne	CTSD	37	42
CN(C[C@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819152712	GG	On-Demand	Anodyne	BACE1	34	49
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819152722	EF	On-Demand	Anodyne	HTR1A	55	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819152722	EF	On-Demand	Anodyne	DRD2	52	45
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819152722	EF	On-Demand	Anodyne	DRD4	28	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819152722	EF	On-Demand	Anodyne	ADRA1D	63	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819152722	EF	On-Demand	Anodyne	ADRA1A	55	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819152722	EF	On-Demand	Anodyne	ADRA1B	50	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819152722	EF	On-Demand	Anodyne	DRD3	48	43
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819152722	EF	On-Demand	Anodyne	HTR7	42	39
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819152724	EF	On-Demand	Anodyne	HTR1A	55	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819152724	EF	On-Demand	Anodyne	DRD2	52	45
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819152724	EF	On-Demand	Anodyne	DRD4	28	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819152724	EF	On-Demand	Anodyne	ADRA1D	63	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819152724	EF	On-Demand	Anodyne	ADRA1A	55	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819152724	EF	On-Demand	Anodyne	ADRA1B	50	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819152724	EF	On-Demand	Anodyne	DRD3	48	43
COc1ccccc1N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819152724	EF	On-Demand	Anodyne	HTR7	42	39
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819152727	EF	On-Demand	Anodyne	HTR1A	55	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819152727	EF	On-Demand	Anodyne	DRD2	52	45
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819152727	EF	On-Demand	Anodyne	DRD4	28	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819152727	EF	On-Demand	Anodyne	ADRA1D	63	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819152727	EF	On-Demand	Anodyne	ADRA1A	55	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819152727	EF	On-Demand	Anodyne	ADRA1B	50	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819152727	EF	On-Demand	Anodyne	DRD3	48	43
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819152727	EF	On-Demand	Anodyne	HTR7	42	39
C[C@@]1(CNC[C@H](O)c2cccc(Cl)c2)CCCS1	ZINC000819152742	CG	On-Demand	Anodyne	ADRB1	32	43
C[C@@]1(CNC[C@H](O)c2cccc(Cl)c2)CCCS1	ZINC000819152742	CG	On-Demand	Anodyne	ADRB3	49	43
C[C@@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCCS1	ZINC000819152743	CG	On-Demand	Anodyne	ADRB1	32	43
C[C@@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCCS1	ZINC000819152743	CG	On-Demand	Anodyne	ADRB3	49	43
C[C@]1(CNC[C@H](O)c2cccc(Cl)c2)CCCS1	ZINC000819152745	CG	On-Demand	Anodyne	ADRB1	32	43
C[C@]1(CNC[C@H](O)c2cccc(Cl)c2)CCCS1	ZINC000819152745	CG	On-Demand	Anodyne	ADRB3	49	43
C[C@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCCS1	ZINC000819152746	CG	On-Demand	Anodyne	ADRB1	32	43
C[C@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCCS1	ZINC000819152746	CG	On-Demand	Anodyne	ADRB3	49	43
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1=O	ZINC000819152776	EE	On-Demand	Anodyne	HTR1A	47	49
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1=O	ZINC000819152776	EE	On-Demand	Anodyne	DRD2	33	49
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1=O	ZINC000819152776	EE	On-Demand	Anodyne	ADRA1D	43	35
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1=O	ZINC000819152776	EE	On-Demand	Anodyne	SLC6A3	24	40
COc1ccccc1N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1=O	ZINC000819152776	EE	On-Demand	Anodyne	HTR7	31	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1=O	ZINC000819152778	EE	On-Demand	Anodyne	HTR1A	47	49
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1=O	ZINC000819152778	EE	On-Demand	Anodyne	DRD2	33	49
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1=O	ZINC000819152778	EE	On-Demand	Anodyne	ADRA1D	43	35
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1=O	ZINC000819152778	EE	On-Demand	Anodyne	SLC6A3	24	40
COc1ccccc1N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1=O	ZINC000819152778	EE	On-Demand	Anodyne	HTR7	31	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1=O	ZINC000819152781	EE	On-Demand	Anodyne	HTR1A	47	49
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1=O	ZINC000819152781	EE	On-Demand	Anodyne	DRD2	33	49
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1=O	ZINC000819152781	EE	On-Demand	Anodyne	ADRA1D	43	35
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1=O	ZINC000819152781	EE	On-Demand	Anodyne	SLC6A3	24	40
COc1ccccc1N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1=O	ZINC000819152781	EE	On-Demand	Anodyne	HTR7	31	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1=O	ZINC000819152783	EE	On-Demand	Anodyne	HTR1A	47	49
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1=O	ZINC000819152783	EE	On-Demand	Anodyne	DRD2	33	49
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1=O	ZINC000819152783	EE	On-Demand	Anodyne	ADRA1D	43	35
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1=O	ZINC000819152783	EE	On-Demand	Anodyne	SLC6A3	24	40
COc1ccccc1N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1=O	ZINC000819152783	EE	On-Demand	Anodyne	HTR7	31	40
O[C@H](CN[C@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1)c1cccnc1	ZINC000819152808	GG	On-Demand	Anodyne	ADRB3	38	44
O[C@@H](CN[C@@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1)c1cccnc1	ZINC000819152809	GG	On-Demand	Anodyne	ADRB3	38	44
O[C@H](CN[C@@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1)c1cccnc1	ZINC000819152810	GG	On-Demand	Anodyne	ADRB3	38	44
O[C@@H](CN[C@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1)c1cccnc1	ZINC000819152811	GG	On-Demand	Anodyne	ADRB3	38	44
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152816	GG	On-Demand	Anodyne	BACE1	24	44
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152816	GG	On-Demand	Anodyne	SCD	15	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152817	GG	On-Demand	Anodyne	BACE1	24	44
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152817	GG	On-Demand	Anodyne	SCD	15	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152818	GG	On-Demand	Anodyne	BACE1	24	44
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152818	GG	On-Demand	Anodyne	SCD	15	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152819	GG	On-Demand	Anodyne	BACE1	24	44
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152819	GG	On-Demand	Anodyne	SCD	15	40
N#CCc1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152820	GH	On-Demand	Mild	ADRB1	57	38
N#CCc1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152820	GH	On-Demand	Mild	BACE1	24	41
N#CCc1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152821	GH	On-Demand	Mild	ADRB1	57	38
N#CCc1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152821	GH	On-Demand	Mild	BACE1	24	41
N#CCc1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152822	GH	On-Demand	Mild	ADRB1	57	38
N#CCc1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152822	GH	On-Demand	Mild	BACE1	24	41
N#CCc1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152823	GH	On-Demand	Mild	ADRB1	57	38
N#CCc1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152823	GH	On-Demand	Mild	BACE1	24	41
O[C@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)Cc1ccc(F)cc1	ZINC000819152865	EH	On-Demand	Anodyne	CTSD	42	47
O[C@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)Cc1ccc(F)cc1	ZINC000819152865	EH	On-Demand	Anodyne	BACE1	35	50
O[C@@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)Cc1ccc(F)cc1	ZINC000819152866	EH	On-Demand	Anodyne	CTSD	42	47
O[C@@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)Cc1ccc(F)cc1	ZINC000819152866	EH	On-Demand	Anodyne	BACE1	35	50
O[C@@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)Cc1ccc(F)cc1	ZINC000819152867	EH	On-Demand	Anodyne	CTSD	42	47
O[C@@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)Cc1ccc(F)cc1	ZINC000819152867	EH	On-Demand	Anodyne	BACE1	35	50
O[C@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)Cc1ccc(F)cc1	ZINC000819152868	EH	On-Demand	Anodyne	CTSD	42	47
O[C@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)Cc1ccc(F)cc1	ZINC000819152868	EH	On-Demand	Anodyne	BACE1	35	50
O=C1c2ccccc2C(=O)N1C[C@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819152877	GF	On-Demand	Anodyne	BACE1	26	43
O=C1c2ccccc2C(=O)N1C[C@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819152878	GF	On-Demand	Anodyne	BACE1	26	43
O=C1c2ccccc2C(=O)N1C[C@@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819152879	GF	On-Demand	Anodyne	BACE1	26	43
O=C1c2ccccc2C(=O)N1C[C@@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819152880	GF	On-Demand	Anodyne	BACE1	26	43
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152891	GG	On-Demand	Anodyne	ADRB2	49	50
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152891	GG	On-Demand	Anodyne	ADRB1	81	50
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152891	GG	On-Demand	Anodyne	ADRB3	52	46
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152891	GG	On-Demand	Anodyne	CTSD	35	41
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152891	GG	On-Demand	Anodyne	BACE1	32	46
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152892	GG	On-Demand	Anodyne	ADRB2	49	50
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152892	GG	On-Demand	Anodyne	ADRB1	81	50
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152892	GG	On-Demand	Anodyne	ADRB3	52	46
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152892	GG	On-Demand	Anodyne	CTSD	35	41
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152892	GG	On-Demand	Anodyne	BACE1	32	46
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152893	GG	On-Demand	Anodyne	ADRB2	49	50
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152893	GG	On-Demand	Anodyne	ADRB1	81	50
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152893	GG	On-Demand	Anodyne	ADRB3	52	46
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152893	GG	On-Demand	Anodyne	CTSD	35	41
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152893	GG	On-Demand	Anodyne	BACE1	32	46
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152894	GG	On-Demand	Anodyne	ADRB2	49	50
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152894	GG	On-Demand	Anodyne	ADRB1	81	50
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152894	GG	On-Demand	Anodyne	ADRB3	52	46
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152894	GG	On-Demand	Anodyne	CTSD	35	41
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819152894	GG	On-Demand	Anodyne	BACE1	32	46
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)c(F)c1	ZINC000819152895	FH	On-Demand	Mild	PAPA1_CARPA	51	46
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)c(F)c1	ZINC000819152895	FH	On-Demand	Mild	CTSK	19	43
C[C@@H]1CN(C2CC2)C[C@H]1NC[C@H](O)c1ccccc1Cl	ZINC000819152903	CE	On-Demand	Anodyne	OPRL1	47	45
C[C@@H]1CN(C2CC2)C[C@@H]1NC[C@H](O)c1ccccc1Cl	ZINC000819152904	CE	On-Demand	Anodyne	OPRL1	47	45
O[C@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)COC1CCOCC1	ZINC000819152913	EF	On-Demand	Anodyne	BACE1	18	40
O[C@@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)COC1CCOCC1	ZINC000819152914	EF	On-Demand	Anodyne	BACE1	18	40
O[C@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)COC1CCOCC1	ZINC000819152915	EF	On-Demand	Anodyne	BACE1	18	40
O[C@@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)COC1CCOCC1	ZINC000819152916	EF	On-Demand	Anodyne	BACE1	18	40
O[C@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccc(F)c(F)c1	ZINC000819152917	FF	On-Demand	Anodyne	PRKCQ	40	33
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccc(F)c(F)c1	ZINC000819152918	FF	On-Demand	Anodyne	PRKCQ	40	33
O[C@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccc(F)c(F)c1	ZINC000819152919	FF	On-Demand	Anodyne	PRKCQ	40	33
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccc(F)c(F)c1	ZINC000819152920	FF	On-Demand	Anodyne	PRKCQ	40	33
COc1ccccc1COC[C@@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819152921	GH	On-Demand	Anodyne	BACE1	22	40
COc1ccccc1COC[C@@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819152922	GH	On-Demand	Anodyne	BACE1	22	40
COc1ccccc1COC[C@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819152923	GH	On-Demand	Anodyne	BACE1	22	40
COc1ccccc1COC[C@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819152924	GH	On-Demand	Anodyne	BACE1	22	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819152932	GG	On-Demand	Anodyne	BACE1	26	45
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819152933	GG	On-Demand	Anodyne	BACE1	26	45
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819152934	GG	On-Demand	Anodyne	BACE1	26	45
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819152935	GG	On-Demand	Anodyne	BACE1	26	45
O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819152948	GG	On-Demand	Bother	BACE1	21	41
O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819152949	GG	On-Demand	Bother	BACE1	21	41
O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819152950	GG	On-Demand	Bother	BACE1	21	41
O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819152951	GG	On-Demand	Bother	BACE1	21	41
C[C@@H]1CN(C2CC2)C[C@@H]1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819152988	FE	On-Demand	Anodyne	GPR119	26	40
C[C@@H]1CN(C2CC2)C[C@@H]1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819152989	FE	On-Demand	Anodyne	GPR119	26	40
C[C@@H]1CN(C2CC2)C[C@H]1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819152990	FE	On-Demand	Anodyne	GPR119	26	40
C[C@@H]1CN(C2CC2)C[C@H]1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819152991	FE	On-Demand	Anodyne	GPR119	26	40
O=C(Cc1nsc2ccccc12)Nc1cccc(N2CCCCC2)c1	ZINC000819153012	FI	On-Demand	Anodyne	HTR1A	23	43
O=C(Cc1nsc2ccccc12)Nc1cccc(N2CCCCC2)c1	ZINC000819153012	FI	On-Demand	Anodyne	DRD2	23	43
O[C@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccccc1	ZINC000819153016	DF	On-Demand	Anodyne	ADRB2	18	40
O[C@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccccc1	ZINC000819153016	DF	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccccc1	ZINC000819153016	DF	On-Demand	Anodyne	ADRB3	37	40
O[C@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccccc1	ZINC000819153017	DF	On-Demand	Anodyne	ADRB2	18	40
O[C@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccccc1	ZINC000819153017	DF	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccccc1	ZINC000819153017	DF	On-Demand	Anodyne	ADRB3	37	40
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccccc1	ZINC000819153018	DF	On-Demand	Anodyne	ADRB2	18	40
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccccc1	ZINC000819153018	DF	On-Demand	Anodyne	ADRB1	22	40
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccccc1	ZINC000819153018	DF	On-Demand	Anodyne	ADRB3	37	40
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccccc1	ZINC000819153019	DF	On-Demand	Anodyne	ADRB2	18	40
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccccc1	ZINC000819153019	DF	On-Demand	Anodyne	ADRB1	22	40
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccccc1	ZINC000819153019	DF	On-Demand	Anodyne	ADRB3	37	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153020	GH	On-Demand	Anodyne	ADRB2	42	38
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153020	GH	On-Demand	Anodyne	ADRB1	63	37
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153020	GH	On-Demand	Anodyne	ADRB3	39	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153020	GH	On-Demand	Anodyne	CTSD	30	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153020	GH	On-Demand	Anodyne	BACE1	31	45
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153021	GH	On-Demand	Anodyne	ADRB2	42	38
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153021	GH	On-Demand	Anodyne	ADRB1	63	37
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153021	GH	On-Demand	Anodyne	ADRB3	39	40
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153021	GH	On-Demand	Anodyne	CTSD	30	40
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153021	GH	On-Demand	Anodyne	BACE1	31	45
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153022	GH	On-Demand	Anodyne	ADRB2	42	38
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153022	GH	On-Demand	Anodyne	ADRB1	63	37
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153022	GH	On-Demand	Anodyne	ADRB3	39	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153022	GH	On-Demand	Anodyne	CTSD	30	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153022	GH	On-Demand	Anodyne	BACE1	31	45
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153023	GH	On-Demand	Anodyne	ADRB2	42	38
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153023	GH	On-Demand	Anodyne	ADRB1	63	37
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153023	GH	On-Demand	Anodyne	ADRB3	39	40
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153023	GH	On-Demand	Anodyne	CTSD	30	40
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153023	GH	On-Demand	Anodyne	BACE1	31	45
O[C@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)c1cc2ccccc2o1	ZINC000819153032	EJ	On-Demand	Anodyne	BACE1	25	45
O[C@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)c1cc2ccccc2o1	ZINC000819153033	EJ	On-Demand	Anodyne	BACE1	25	45
O[C@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)Cn1cccn1	ZINC000819153052	DE	On-Demand	Anodyne	BACE1	24	42
O[C@@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)Cn1cccn1	ZINC000819153053	DE	On-Demand	Anodyne	BACE1	24	42
O[C@@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)Cn1cccn1	ZINC000819153054	DE	On-Demand	Anodyne	BACE1	24	42
O[C@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)Cn1cccn1	ZINC000819153055	DE	On-Demand	Anodyne	BACE1	24	42
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccc(Cl)cc1	ZINC000819153070	FG	On-Demand	Anodyne	ADRB1	18	40
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccc(Cl)cc1	ZINC000819153070	FG	On-Demand	Anodyne	ADRB3	29	40
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccc(Cl)cc1	ZINC000819153070	FG	On-Demand	Anodyne	AKT3	53	38
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccc(Cl)cc1	ZINC000819153071	FG	On-Demand	Anodyne	ADRB1	18	40
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccc(Cl)cc1	ZINC000819153071	FG	On-Demand	Anodyne	ADRB3	29	40
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccc(Cl)cc1	ZINC000819153071	FG	On-Demand	Anodyne	AKT3	53	38
O[C@@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)C1CC1	ZINC000819153110	CF	On-Demand	Anodyne	BACE1	26	45
O[C@@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)C1CC1	ZINC000819153111	CF	On-Demand	Anodyne	BACE1	26	45
O[C@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)C1CC1	ZINC000819153112	CF	On-Demand	Anodyne	BACE1	26	45
O[C@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)C1CC1	ZINC000819153113	CF	On-Demand	Anodyne	BACE1	26	45
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153116	GG	On-Demand	Anodyne	ADRB2	49	43
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153116	GG	On-Demand	Anodyne	ADRB1	71	43
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153116	GG	On-Demand	Anodyne	ADRB3	49	43
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153116	GG	On-Demand	Anodyne	CTSD	30	40
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153116	GG	On-Demand	Anodyne	BACE1	32	43
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153117	GG	On-Demand	Anodyne	ADRB2	49	43
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153117	GG	On-Demand	Anodyne	ADRB1	71	43
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153117	GG	On-Demand	Anodyne	ADRB3	49	43
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153117	GG	On-Demand	Anodyne	CTSD	30	40
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153117	GG	On-Demand	Anodyne	BACE1	32	43
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153118	GG	On-Demand	Anodyne	ADRB2	49	43
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153118	GG	On-Demand	Anodyne	ADRB1	71	43
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153118	GG	On-Demand	Anodyne	ADRB3	49	43
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153118	GG	On-Demand	Anodyne	CTSD	30	40
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153118	GG	On-Demand	Anodyne	BACE1	32	43
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153119	GG	On-Demand	Anodyne	ADRB2	49	43
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153119	GG	On-Demand	Anodyne	ADRB1	71	43
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153119	GG	On-Demand	Anodyne	ADRB3	49	43
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153119	GG	On-Demand	Anodyne	CTSD	30	40
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153119	GG	On-Demand	Anodyne	BACE1	32	43
O=C(C(F)=C1CCC1)N1CCCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000819153126	FG	On-Demand	Anodyne	HPGD	20	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCNC(=O)c1ccc(F)cc1	ZINC000819153147	FD	On-Demand	Anodyne	SSTR3	15	42
C#CCCCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819153148	DG	On-Demand	Mild	ADRB3	18	41
C#CCCCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819153149	DG	On-Demand	Mild	ADRB3	18	41
O[C@@H](CNCCCc1ccc2c(c1)OCCO2)c1ccc(Cl)cc1	ZINC000819153152	EG	On-Demand	Anodyne	ADRB2	43	43
O[C@@H](CNCCCc1ccc2c(c1)OCCO2)c1ccc(Cl)cc1	ZINC000819153152	EG	On-Demand	Anodyne	ADRB1	35	40
O[C@@H](CNCCCc1ccc2c(c1)OCCO2)c1ccc(Cl)cc1	ZINC000819153152	EG	On-Demand	Anodyne	ADRB3	34	40
C#CCCCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819153161	CE	On-Demand	Mild	ADRB2	26	62
C#CCCCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819153161	CE	On-Demand	Mild	ADRB1	63	62
C#CCCCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819153162	CE	On-Demand	Mild	ADRB2	26	62
C#CCCCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819153162	CE	On-Demand	Mild	ADRB1	63	62
CN1CCN(C(=O)c2ccc(NC(=O)C(F)=C3CCC3)cc2)CC1	ZINC000819153173	EE	On-Demand	Anodyne	L3MBTL3	54	42
O[C@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1cccc(F)c1	ZINC000819153243	EF	On-Demand	Anodyne	ADRB3	29	40
O[C@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1cccc(F)c1	ZINC000819153245	EF	On-Demand	Anodyne	ADRB3	29	40
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1cccc(F)c1	ZINC000819153247	EF	On-Demand	Anodyne	ADRB3	29	40
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1cccc(F)c1	ZINC000819153248	EF	On-Demand	Anodyne	ADRB3	29	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2COc3c(Cl)cccc32)CC1	ZINC000819153249	GG	On-Demand	Anodyne	GPR119	29	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2COc3c(Cl)cccc32)CC1	ZINC000819153253	GG	On-Demand	Anodyne	GPR119	29	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2COc3c(Cl)cccc32)CC1	ZINC000819153256	GG	On-Demand	Anodyne	GPR119	29	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2COc3c(Cl)cccc32)CC1	ZINC000819153258	GG	On-Demand	Anodyne	GPR119	29	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(Cc2cscn2)CC1	ZINC000819153265	FD	On-Demand	Anodyne	SCN5A	41	34
CC[C@@H](NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2)c1ncc(-c2ccccc2)[nH]1	ZINC000819153291	GH	On-Demand	Anodyne	HDAC1	16	50
CC[C@H](NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2)c1ncc(-c2ccccc2)[nH]1	ZINC000819153296	GH	On-Demand	Anodyne	HDAC1	16	50
CC[C@H](NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2)c1ncc(-c2ccccc2)[nH]1	ZINC000819153298	GH	On-Demand	Anodyne	HDAC1	16	50
O=C(Cc1nsc2ccccc12)NCCCCCCCN1CCCC1	ZINC000819153317	FI	On-Demand	Anodyne	HTR1A	48	57
O=C(Cc1nsc2ccccc12)NCCCCCCCN1CCCC1	ZINC000819153317	FI	On-Demand	Anodyne	DRD2	63	57
O=C(Cc1nsc2ccccc12)NCCCCCCCN1CCCC1	ZINC000819153317	FI	On-Demand	Anodyne	HTR2A	44	57
O=C(Cc1nsc2ccccc12)NCCCCCCCN1CCCC1	ZINC000819153317	FI	On-Demand	Anodyne	HTR2C	21	40
O=C(Cc1nsc2ccccc12)NCCCCCCCN1CCCC1	ZINC000819153317	FI	On-Demand	Anodyne	DRD3	73	42
O=C(Cc1nsc2ccccc12)NCCCCCCCN1CCCC1	ZINC000819153317	FI	On-Demand	Anodyne	HTR7	41	43
O=C(Cc1nsc2ccccc12)NCCCCCCCN1CCCC1	ZINC000819153317	FI	On-Demand	Anodyne	CHRNA7	20	46
O=C(Cc1nsc2ccccc12)NCCCCCCCN1CCCC1	ZINC000819153317	FI	On-Demand	Anodyne	HNMT	88	42
O[C@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)CC(F)(F)F	ZINC000819153321	DG	On-Demand	Anodyne	CTSD	39	42
O[C@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)CC(F)(F)F	ZINC000819153321	DG	On-Demand	Anodyne	BACE1	34	47
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819153323	FH	On-Demand	Mild	ADRB1	19	41
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819153323	FH	On-Demand	Mild	ADRB3	29	41
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819153324	FH	On-Demand	Mild	ADRB1	19	41
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819153324	FH	On-Demand	Mild	ADRB3	29	41
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819153325	FH	On-Demand	Mild	ADRB1	19	41
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819153325	FH	On-Demand	Mild	ADRB3	29	41
O[C@@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)CC(F)(F)F	ZINC000819153326	DG	On-Demand	Anodyne	CTSD	39	42
O[C@@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)CC(F)(F)F	ZINC000819153326	DG	On-Demand	Anodyne	BACE1	34	47
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819153327	FH	On-Demand	Mild	ADRB1	19	41
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819153327	FH	On-Demand	Mild	ADRB3	29	41
O[C@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)CC(F)(F)F	ZINC000819153328	DG	On-Demand	Anodyne	CTSD	39	42
O[C@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)CC(F)(F)F	ZINC000819153328	DG	On-Demand	Anodyne	BACE1	34	47
O[C@@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)CC(F)(F)F	ZINC000819153330	DG	On-Demand	Anodyne	CTSD	39	42
O[C@@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)CC(F)(F)F	ZINC000819153330	DG	On-Demand	Anodyne	BACE1	34	47
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819153354	GG	On-Demand	Bother	ADRB1	18	43
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819153354	GG	On-Demand	Bother	BACE1	24	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819153356	GG	On-Demand	Bother	ADRB1	18	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819153356	GG	On-Demand	Bother	BACE1	24	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819153358	GG	On-Demand	Bother	ADRB1	18	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819153358	GG	On-Demand	Bother	BACE1	24	40
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819153361	GG	On-Demand	Bother	ADRB1	18	43
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819153361	GG	On-Demand	Bother	BACE1	24	40
O[C@@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)COCc1ccccc1F	ZINC000819153403	FH	On-Demand	Anodyne	BACE1	20	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819153404	GE	On-Demand	Anodyne	CTSD	96	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819153404	GE	On-Demand	Anodyne	PGC	57	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819153404	GE	On-Demand	Anodyne	PAPA1_CARPA	28	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819153404	GE	On-Demand	Anodyne	BACE2	48	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819153404	GE	On-Demand	Anodyne	REN	72	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819153404	GE	On-Demand	Anodyne	BACE1	90	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819153404	GE	On-Demand	Anodyne	FPR1	48	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819153404	GE	On-Demand	Anodyne	PLM2_PLAFA	43	32
O[C@@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)COCc1ccccc1F	ZINC000819153405	FH	On-Demand	Anodyne	BACE1	20	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819153406	GE	On-Demand	Anodyne	CTSD	96	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819153406	GE	On-Demand	Anodyne	PGC	57	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819153406	GE	On-Demand	Anodyne	PAPA1_CARPA	28	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819153406	GE	On-Demand	Anodyne	BACE2	48	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819153406	GE	On-Demand	Anodyne	REN	72	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819153406	GE	On-Demand	Anodyne	BACE1	90	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819153406	GE	On-Demand	Anodyne	FPR1	48	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819153406	GE	On-Demand	Anodyne	PLM2_PLAFA	43	32
O[C@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)COCc1ccccc1F	ZINC000819153408	FH	On-Demand	Anodyne	BACE1	20	42
O[C@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)COCc1ccccc1F	ZINC000819153410	FH	On-Demand	Anodyne	BACE1	20	42
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153421	GD	On-Demand	Anodyne	ACE	48	39
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153421	GD	On-Demand	Anodyne	OPRM1	33	44
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153421	GD	On-Demand	Anodyne	OPRD1	29	44
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153421	GD	On-Demand	Anodyne	MME	44	39
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153421	GD	On-Demand	Anodyne	CTRA_BOVIN	47	41
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153421	GD	On-Demand	Anodyne	TRY1_BOVIN	45	35
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153421	GD	On-Demand	Anodyne	CYSP_TRYCR	45	36
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153421	GD	On-Demand	Anodyne	NPFFR2	42	30
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153421	GD	On-Demand	Anodyne	TIMP3	79	35
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153421	GD	On-Demand	Anodyne	CAPNS1	60	32
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153421	GD	On-Demand	Anodyne	CELA2A	51	36
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153421	GD	On-Demand	Anodyne	CAPN1	54	35
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153421	GD	On-Demand	Anodyne	ACE2	40	33
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153421	GD	On-Demand	Anodyne	CTRB_BOVIN	52	40
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153423	GD	On-Demand	Anodyne	ACE	48	39
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153423	GD	On-Demand	Anodyne	OPRM1	33	44
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153423	GD	On-Demand	Anodyne	OPRD1	29	44
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153423	GD	On-Demand	Anodyne	MME	44	39
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153423	GD	On-Demand	Anodyne	CTRA_BOVIN	47	41
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153423	GD	On-Demand	Anodyne	TRY1_BOVIN	45	35
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153423	GD	On-Demand	Anodyne	CYSP_TRYCR	45	36
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153423	GD	On-Demand	Anodyne	NPFFR2	42	30
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153423	GD	On-Demand	Anodyne	TIMP3	79	35
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153423	GD	On-Demand	Anodyne	CAPNS1	60	32
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153423	GD	On-Demand	Anodyne	CELA2A	51	36
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153423	GD	On-Demand	Anodyne	CAPN1	54	35
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153423	GD	On-Demand	Anodyne	ACE2	40	33
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819153423	GD	On-Demand	Anodyne	CTRB_BOVIN	52	40
O[C@@H](CNCCCc1ccc2c(c1)OCCO2)c1cccc(Cl)c1	ZINC000819153429	EG	On-Demand	Anodyne	ADRB2	58	39
O[C@@H](CNCCCc1ccc2c(c1)OCCO2)c1cccc(Cl)c1	ZINC000819153429	EG	On-Demand	Anodyne	ADRB1	60	51
O[C@@H](CNCCCc1ccc2c(c1)OCCO2)c1cccc(Cl)c1	ZINC000819153429	EG	On-Demand	Anodyne	ADRB3	73	51
O[C@H](CNCCCc1ccc2c(c1)OCCO2)c1cccc(Cl)c1	ZINC000819153430	EG	On-Demand	Anodyne	ADRB2	58	39
O[C@H](CNCCCc1ccc2c(c1)OCCO2)c1cccc(Cl)c1	ZINC000819153430	EG	On-Demand	Anodyne	ADRB1	60	51
O[C@H](CNCCCc1ccc2c(c1)OCCO2)c1cccc(Cl)c1	ZINC000819153430	EG	On-Demand	Anodyne	ADRB3	73	51
C#CCCCCNC[C@H](O)COc1ccc(SC)cc1	ZINC000819153459	CF	On-Demand	Mild	ADRB2	48	46
C#CCCCCNC[C@H](O)COc1ccc(SC)cc1	ZINC000819153459	CF	On-Demand	Mild	ADRB1	68	46
C#CCCCCNC[C@H](O)COc1ccc(SC)cc1	ZINC000819153459	CF	On-Demand	Mild	ADRB3	40	46
C#CCCCCNC[C@@H](O)COc1ccc(SC)cc1	ZINC000819153460	CF	On-Demand	Mild	ADRB2	48	46
C#CCCCCNC[C@@H](O)COc1ccc(SC)cc1	ZINC000819153460	CF	On-Demand	Mild	ADRB1	68	46
C#CCCCCNC[C@@H](O)COc1ccc(SC)cc1	ZINC000819153460	CF	On-Demand	Mild	ADRB3	40	46
C#CCCCCNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819153507	DG	On-Demand	Mild	CYNT	43	49
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2ccc3c(c2)OCCO3)c1	ZINC000819153529	FF	On-Demand	Bother	ADRB3	48	38
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2ccc3c(c2)OCCO3)c1	ZINC000819153531	FF	On-Demand	Bother	ADRB3	48	38
O[C@@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccc(Cl)cc1	ZINC000819153598	CE	On-Demand	Anodyne	ADRB3	23	52
O[C@@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccc(Cl)cc1	ZINC000819153599	CE	On-Demand	Anodyne	ADRB3	23	52
COCCc1ccc(OC[C@H](O)CN[C@H]2CCC[C@H]2OC)cc1	ZINC000819153600	DD	On-Demand	Anodyne	ADRB2	45	61
COCCc1ccc(OC[C@H](O)CN[C@H]2CCC[C@H]2OC)cc1	ZINC000819153600	DD	On-Demand	Anodyne	ADRB1	68	61
COCCc1ccc(OC[C@H](O)CN[C@H]2CCC[C@H]2OC)cc1	ZINC000819153600	DD	On-Demand	Anodyne	ADRB3	44	42
COCCc1ccc(OC[C@H](O)CN[C@H]2CCC[C@@H]2OC)cc1	ZINC000819153601	DD	On-Demand	Anodyne	ADRB2	45	61
COCCc1ccc(OC[C@H](O)CN[C@H]2CCC[C@@H]2OC)cc1	ZINC000819153601	DD	On-Demand	Anodyne	ADRB1	68	61
COCCc1ccc(OC[C@H](O)CN[C@H]2CCC[C@@H]2OC)cc1	ZINC000819153601	DD	On-Demand	Anodyne	ADRB3	44	42
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCC[C@@H]2OC)cc1	ZINC000819153602	DD	On-Demand	Anodyne	ADRB2	45	61
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCC[C@@H]2OC)cc1	ZINC000819153602	DD	On-Demand	Anodyne	ADRB1	68	61
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCC[C@@H]2OC)cc1	ZINC000819153602	DD	On-Demand	Anodyne	ADRB3	44	42
CSc1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153647	GI	On-Demand	Anodyne	ADRB1	44	35
CSc1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153647	GI	On-Demand	Anodyne	BACE1	26	42
CSc1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153649	GI	On-Demand	Anodyne	ADRB1	44	35
CSc1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153649	GI	On-Demand	Anodyne	BACE1	26	42
CSc1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153652	GI	On-Demand	Anodyne	ADRB1	44	35
CSc1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153652	GI	On-Demand	Anodyne	BACE1	26	42
CSc1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153654	GI	On-Demand	Anodyne	ADRB1	44	35
CSc1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819153654	GI	On-Demand	Anodyne	BACE1	26	42
CC(=O)NCC1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819153663	CD	On-Demand	Anodyne	CACNA1I	47	31
O=C(CN1CCO[C@@H](C(=O)O)C1)Nc1cc(-n2cnnn2)ccc1Cl	ZINC000819153698	FC	On-Demand	Anodyne	KCNJ1	44	35
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc2ccccc12	ZINC000819153701	GI	On-Demand	Mild	CTSB	40	35
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc2ccccc12	ZINC000819153701	GI	On-Demand	Mild	PAPA1_CARPA	52	45
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc2ccccc12	ZINC000819153701	GI	On-Demand	Mild	CCKAR	40	39
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc2ccccc12	ZINC000819153701	GI	On-Demand	Mild	CTSL	16	45
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc2ccccc12	ZINC000819153701	GI	On-Demand	Mild	FPR1	41	36
O=C(CN1CCO[C@H](C(=O)O)C1)Nc1cc(-n2cnnn2)ccc1Cl	ZINC000819153709	FC	On-Demand	Anodyne	KCNJ1	44	35
O=C(CN1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1)Nc1ccc(F)cc1	ZINC000819153712	GC	On-Demand	Anodyne	SLC6A1	84	39
O=C(CN1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1)Nc1ccc(F)cc1	ZINC000819153712	GC	On-Demand	Anodyne	AURKB	22	40
O=C(CN1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1)Nc1ccc(F)cc1	ZINC000819153712	GC	On-Demand	Anodyne	MLNR	32	42
O=C(CN1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1)Nc1ccc(F)cc1	ZINC000819153712	GC	On-Demand	Anodyne	MAPK1	26	48
O=C(CN1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1)Nc1ccc(F)cc1	ZINC000819153724	GC	On-Demand	Anodyne	SLC6A1	84	39
O=C(CN1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1)Nc1ccc(F)cc1	ZINC000819153724	GC	On-Demand	Anodyne	AURKB	22	40
O=C(CN1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1)Nc1ccc(F)cc1	ZINC000819153724	GC	On-Demand	Anodyne	MLNR	32	42
O=C(CN1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1)Nc1ccc(F)cc1	ZINC000819153724	GC	On-Demand	Anodyne	MAPK1	26	48
O=C(CN1CCN(C(=O)NCc2ccc(C(=O)O)cc2)CC1)NC1CC1	ZINC000819153731	FC	On-Demand	Anodyne	SIGMAR1	16	41
O[C@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccccc1C(F)(F)F	ZINC000819153746	GH	On-Demand	Anodyne	TRPV1	30	41
O[C@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccccc1C(F)(F)F	ZINC000819153746	GH	On-Demand	Anodyne	SFRP1	42	32
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccccc1C(F)(F)F	ZINC000819153748	GH	On-Demand	Anodyne	TRPV1	30	41
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccccc1C(F)(F)F	ZINC000819153748	GH	On-Demand	Anodyne	SFRP1	42	32
O[C@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccccc1C(F)(F)F	ZINC000819153750	GH	On-Demand	Anodyne	TRPV1	30	41
O[C@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccccc1C(F)(F)F	ZINC000819153750	GH	On-Demand	Anodyne	SFRP1	42	32
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccccc1C(F)(F)F	ZINC000819153752	GH	On-Demand	Anodyne	TRPV1	30	41
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccccc1C(F)(F)F	ZINC000819153752	GH	On-Demand	Anodyne	SFRP1	42	32
O[C@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1cccc(C(F)(F)F)c1	ZINC000819153802	GH	On-Demand	Anodyne	TRPV1	23	42
O[C@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1cccc(C(F)(F)F)c1	ZINC000819153804	GH	On-Demand	Anodyne	TRPV1	23	42
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1cccc(C(F)(F)F)c1	ZINC000819153807	GH	On-Demand	Anodyne	TRPV1	23	42
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1cccc(C(F)(F)F)c1	ZINC000819153809	GH	On-Demand	Anodyne	TRPV1	23	42
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819153820	GH	On-Demand	Bother	ADRB2	41	39
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819153820	GH	On-Demand	Bother	ADRB1	33	44
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819153820	GH	On-Demand	Bother	ADRB3	58	44
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819153820	GH	On-Demand	Bother	COLA	50	38
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819153821	GH	On-Demand	Bother	ADRB2	41	39
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819153821	GH	On-Demand	Bother	ADRB1	33	44
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819153821	GH	On-Demand	Bother	ADRB3	58	44
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819153821	GH	On-Demand	Bother	COLA	50	38
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819153822	GH	On-Demand	Bother	ADRB2	41	39
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819153822	GH	On-Demand	Bother	ADRB1	33	44
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819153822	GH	On-Demand	Bother	ADRB3	58	44
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819153822	GH	On-Demand	Bother	COLA	50	38
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819153823	GH	On-Demand	Bother	ADRB2	41	39
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819153823	GH	On-Demand	Bother	ADRB1	33	44
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819153823	GH	On-Demand	Bother	ADRB3	58	44
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819153823	GH	On-Demand	Bother	COLA	50	38
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819153864	ED	On-Demand	Anodyne	ADRB2	36	54
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819153864	ED	On-Demand	Anodyne	ADRB1	69	54
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819153864	ED	On-Demand	Anodyne	ADRB3	45	44
COCCc1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819153867	ED	On-Demand	Anodyne	ADRB2	36	54
COCCc1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819153867	ED	On-Demand	Anodyne	ADRB1	69	54
COCCc1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819153867	ED	On-Demand	Anodyne	ADRB3	45	44
COCCc1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819153869	ED	On-Demand	Anodyne	ADRB2	36	54
COCCc1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819153869	ED	On-Demand	Anodyne	ADRB1	69	54
COCCc1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819153869	ED	On-Demand	Anodyne	ADRB3	45	44
COCCc1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819153871	ED	On-Demand	Anodyne	ADRB2	36	54
COCCc1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819153871	ED	On-Demand	Anodyne	ADRB1	69	54
COCCc1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819153871	ED	On-Demand	Anodyne	ADRB3	45	44
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(F)c(Cl)c1	ZINC000819153928	CG	On-Demand	Anodyne	KCNQ2	53	42
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(F)c(Cl)c1	ZINC000819153930	CG	On-Demand	Anodyne	KCNQ2	53	42
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(F)c(Cl)c1	ZINC000819153932	CG	On-Demand	Anodyne	KCNQ2	53	42
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(F)c(Cl)c1	ZINC000819153934	CG	On-Demand	Anodyne	KCNQ2	53	42
O[C@H](CN[C@H]1CCc2c[nH]nc2C1)c1cccc(Cl)c1	ZINC000819153958	CE	On-Demand	Anodyne	ADRB1	32	57
O[C@H](CN[C@H]1CCc2c[nH]nc2C1)c1cccc(Cl)c1	ZINC000819153958	CE	On-Demand	Anodyne	ADRB3	53	58
O[C@H](CN[C@H]1CCc2c[nH]nc2C1)c1cccc(Cl)c1	ZINC000819153958	CE	On-Demand	Anodyne	CYP3A4	45	35
O[C@@H](CN[C@@H]1CCc2c[nH]nc2C1)c1cccc(Cl)c1	ZINC000819153959	CE	On-Demand	Anodyne	ADRB1	32	57
O[C@@H](CN[C@@H]1CCc2c[nH]nc2C1)c1cccc(Cl)c1	ZINC000819153959	CE	On-Demand	Anodyne	ADRB3	53	58
O[C@@H](CN[C@@H]1CCc2c[nH]nc2C1)c1cccc(Cl)c1	ZINC000819153959	CE	On-Demand	Anodyne	CYP3A4	45	35
O[C@H](CN[C@@H]1CCc2c[nH]nc2C1)c1cccc(Cl)c1	ZINC000819153960	CE	On-Demand	Anodyne	ADRB1	32	57
O[C@H](CN[C@@H]1CCc2c[nH]nc2C1)c1cccc(Cl)c1	ZINC000819153960	CE	On-Demand	Anodyne	ADRB3	53	58
O[C@H](CN[C@@H]1CCc2c[nH]nc2C1)c1cccc(Cl)c1	ZINC000819153960	CE	On-Demand	Anodyne	CYP3A4	45	35
O[C@@H](CN[C@H]1CCc2c[nH]nc2C1)c1cccc(Cl)c1	ZINC000819153961	CE	On-Demand	Anodyne	ADRB1	32	57
O[C@@H](CN[C@H]1CCc2c[nH]nc2C1)c1cccc(Cl)c1	ZINC000819153961	CE	On-Demand	Anodyne	ADRB3	53	58
O[C@@H](CN[C@H]1CCc2c[nH]nc2C1)c1cccc(Cl)c1	ZINC000819153961	CE	On-Demand	Anodyne	CYP3A4	45	35
O[C@@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccc(F)c(Br)c1	ZINC000819153973	FE	On-Demand	Anodyne	ADRB3	20	44
O[C@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccc(F)c(Br)c1	ZINC000819153974	FE	On-Demand	Anodyne	ADRB3	20	44
O[C@@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccc(F)c(Br)c1	ZINC000819153975	FE	On-Demand	Anodyne	ADRB3	20	44
O[C@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccc(F)c(Br)c1	ZINC000819153976	FE	On-Demand	Anodyne	ADRB3	20	44
CNC(=O)NNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819153977	FF	On-Demand	Reactive	CTSK	18	52
CNC(=O)NNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819153977	FF	On-Demand	Reactive	ECE1	22	41
CNC(=O)NNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819153977	FF	On-Demand	Reactive	REN	48	43
CNC(=O)NNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819153978	FF	On-Demand	Reactive	CTSK	18	52
CNC(=O)NNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819153978	FF	On-Demand	Reactive	ECE1	22	41
CNC(=O)NNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819153978	FF	On-Demand	Reactive	REN	48	43
COc1ccc(OC)c([C@H](O)CNC[C@H](C[C@@H](C)O)c2ccccc2)c1	ZINC000819153979	FF	On-Demand	Anodyne	ADRB2	17	43
COc1ccc(OC)c([C@H](O)CNC[C@H](C[C@H](C)O)c2ccccc2)c1	ZINC000819153980	FF	On-Demand	Anodyne	ADRB2	17	43
COc1ccc(OC)c([C@H](O)CNC[C@@H](C[C@@H](C)O)c2ccccc2)c1	ZINC000819153981	FF	On-Demand	Anodyne	ADRB2	17	43
COc1ccc(OC)c([C@H](O)CNC[C@@H](C[C@H](C)O)c2ccccc2)c1	ZINC000819153982	FF	On-Demand	Anodyne	ADRB2	17	43
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1cccc(F)c1	ZINC000819154069	FH	On-Demand	Anodyne	ADRB2	44	39
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1cccc(F)c1	ZINC000819154069	FH	On-Demand	Anodyne	ADRB1	32	47
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1cccc(F)c1	ZINC000819154069	FH	On-Demand	Anodyne	ADRB3	52	47
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1cccc(F)c1	ZINC000819154070	FH	On-Demand	Anodyne	ADRB2	44	39
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1cccc(F)c1	ZINC000819154070	FH	On-Demand	Anodyne	ADRB1	32	47
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1cccc(F)c1	ZINC000819154070	FH	On-Demand	Anodyne	ADRB3	52	47
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1cccc(F)c1	ZINC000819154072	FH	On-Demand	Anodyne	ADRB2	44	39
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1cccc(F)c1	ZINC000819154072	FH	On-Demand	Anodyne	ADRB1	32	47
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1cccc(F)c1	ZINC000819154072	FH	On-Demand	Anodyne	ADRB3	52	47
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1cccc(F)c1	ZINC000819154074	FH	On-Demand	Anodyne	ADRB2	44	39
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1cccc(F)c1	ZINC000819154074	FH	On-Demand	Anodyne	ADRB1	32	47
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1cccc(F)c1	ZINC000819154074	FH	On-Demand	Anodyne	ADRB3	52	47
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819154076	FD	On-Demand	Anodyne	ADRB2	41	45
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819154076	FD	On-Demand	Anodyne	ADRB1	74	45
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819154076	FD	On-Demand	Anodyne	ADRB3	50	45
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819154076	FD	On-Demand	Anodyne	ABCB1	23	40
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819154078	FD	On-Demand	Anodyne	ADRB2	41	45
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819154078	FD	On-Demand	Anodyne	ADRB1	74	45
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819154078	FD	On-Demand	Anodyne	ADRB3	50	45
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819154078	FD	On-Demand	Anodyne	ABCB1	23	40
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819154080	FD	On-Demand	Anodyne	ADRB2	41	45
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819154080	FD	On-Demand	Anodyne	ADRB1	74	45
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819154080	FD	On-Demand	Anodyne	ADRB3	50	45
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819154080	FD	On-Demand	Anodyne	ABCB1	23	40
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819154081	FD	On-Demand	Anodyne	ADRB2	41	45
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819154081	FD	On-Demand	Anodyne	ADRB1	74	45
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819154081	FD	On-Demand	Anodyne	ADRB3	50	45
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819154081	FD	On-Demand	Anodyne	ABCB1	23	40
C=C(Cl)CSc1nc(C)c(CC(=O)NCC2CCN(CC)CC2)s1	ZINC000819154090	GH	On-Demand	Mild	CACNA1I	51	35
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@]2(C)CCCS2)CC1	ZINC000819154105	FF	On-Demand	Anodyne	GPR119	19	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@]2(C)CCCS2)CC1	ZINC000819154107	FF	On-Demand	Anodyne	GPR119	19	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@]2(C)CCCS2)CC1	ZINC000819154109	FF	On-Demand	Anodyne	GPR119	19	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@]2(C)CCCS2)CC1	ZINC000819154111	FF	On-Demand	Anodyne	GPR119	19	40
O[C@@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)COc1cccc2[nH]ccc12	ZINC000819154115	GH	On-Demand	Anodyne	ADRB2	15	62
O[C@@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)COc1cccc2[nH]ccc12	ZINC000819154115	GH	On-Demand	Anodyne	ADRB1	18	62
O[C@@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)COc1cccc2[nH]ccc12	ZINC000819154118	GH	On-Demand	Anodyne	ADRB2	15	62
O[C@@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)COc1cccc2[nH]ccc12	ZINC000819154118	GH	On-Demand	Anodyne	ADRB1	18	62
O[C@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)COc1cccc2[nH]ccc12	ZINC000819154120	GH	On-Demand	Anodyne	ADRB2	15	62
O[C@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)COc1cccc2[nH]ccc12	ZINC000819154120	GH	On-Demand	Anodyne	ADRB1	18	62
O[C@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)COc1cccc2[nH]ccc12	ZINC000819154122	GH	On-Demand	Anodyne	ADRB2	15	62
O[C@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)COc1cccc2[nH]ccc12	ZINC000819154122	GH	On-Demand	Anodyne	ADRB1	18	62
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(c2ncccc2Cl)C1	ZINC000819154128	EF	On-Demand	Anodyne	OPRL1	27	41
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(c2ncccc2Cl)C1	ZINC000819154128	EF	On-Demand	Anodyne	ADRB3	17	40
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(c2ncccc2Cl)C1	ZINC000819154137	EF	On-Demand	Anodyne	OPRL1	27	41
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(c2ncccc2Cl)C1	ZINC000819154137	EF	On-Demand	Anodyne	ADRB3	17	40
C[C@@H]1CN(C2CC2)C[C@H]1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819154174	DD	On-Demand	Bother	CACNA1C	43	35
C[C@@H]1CN(C2CC2)C[C@H]1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819154174	DD	On-Demand	Bother	CACNA1D	65	35
C[C@@H]1CN(C2CC2)C[C@H]1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819154175	DD	On-Demand	Bother	CACNA1C	43	35
C[C@@H]1CN(C2CC2)C[C@H]1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819154175	DD	On-Demand	Bother	CACNA1D	65	35
C[C@@H]1CN(C2CC2)C[C@@H]1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819154176	DD	On-Demand	Bother	CACNA1C	43	35
C[C@@H]1CN(C2CC2)C[C@@H]1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819154176	DD	On-Demand	Bother	CACNA1D	65	35
C[C@@H]1CN(C2CC2)C[C@@H]1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819154177	DD	On-Demand	Bother	CACNA1C	43	35
C[C@@H]1CN(C2CC2)C[C@@H]1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819154177	DD	On-Demand	Bother	CACNA1D	65	35
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819154198	GH	On-Demand	Anodyne	ADRB2	26	40
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819154198	GH	On-Demand	Anodyne	CTSD	35	40
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819154198	GH	On-Demand	Anodyne	ABCB1	15	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819154198	GH	On-Demand	Anodyne	BACE1	32	45
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819154199	GH	On-Demand	Anodyne	ADRB2	26	40
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819154199	GH	On-Demand	Anodyne	CTSD	35	40
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819154199	GH	On-Demand	Anodyne	ABCB1	15	43
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819154199	GH	On-Demand	Anodyne	BACE1	32	45
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819154200	GH	On-Demand	Anodyne	ADRB2	26	40
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819154200	GH	On-Demand	Anodyne	CTSD	35	40
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819154200	GH	On-Demand	Anodyne	ABCB1	15	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819154200	GH	On-Demand	Anodyne	BACE1	32	45
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819154201	GH	On-Demand	Anodyne	ADRB2	26	40
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819154201	GH	On-Demand	Anodyne	CTSD	35	40
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819154201	GH	On-Demand	Anodyne	ABCB1	15	43
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819154201	GH	On-Demand	Anodyne	BACE1	32	45
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](C)O	ZINC000819154204	CE	On-Demand	Anodyne	CTSK	24	46
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](C)O	ZINC000819154204	CE	On-Demand	Anodyne	PGA5	23	43
CCCC[C@H](CNC(=O)OC(C)(C)C)NC[C@@H](C)O	ZINC000819154205	CE	On-Demand	Anodyne	CTSK	24	46
CCCC[C@H](CNC(=O)OC(C)(C)C)NC[C@@H](C)O	ZINC000819154205	CE	On-Demand	Anodyne	PGA5	23	43
Cc1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154214	FH	On-Demand	Anodyne	ADRB2	46	45
Cc1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154214	FH	On-Demand	Anodyne	ADRB1	53	39
Cc1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154214	FH	On-Demand	Anodyne	ADRB3	32	41
Cc1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154214	FH	On-Demand	Anodyne	BACE1	25	42
Cc1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154215	FH	On-Demand	Anodyne	ADRB2	46	45
Cc1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154215	FH	On-Demand	Anodyne	ADRB1	53	39
Cc1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154215	FH	On-Demand	Anodyne	ADRB3	32	41
Cc1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154215	FH	On-Demand	Anodyne	BACE1	25	42
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCc3c[nH]nc3C2)cc1	ZINC000819154239	DD	On-Demand	Bother	ADRB3	19	43
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCc3c[nH]nc3C2)cc1	ZINC000819154240	DD	On-Demand	Bother	ADRB3	19	43
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCc3c[nH]nc3C2)cc1	ZINC000819154241	DD	On-Demand	Bother	ADRB3	19	43
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCc3c[nH]nc3C2)cc1	ZINC000819154242	DD	On-Demand	Bother	ADRB3	19	43
O[C@H](CN[C@@H]1C[C@H]2CC[C@H]1O2)c1cccnc1	ZINC000819154274	BD	On-Demand	Anodyne	ADRB3	56	42
O[C@@H](CN[C@@H]1C[C@H]2CC[C@H]1O2)c1cccnc1	ZINC000819154275	BD	On-Demand	Anodyne	ADRB3	56	42
O[C@@H](CN[C@H]1C[C@H]2CC[C@H]1O2)c1cccnc1	ZINC000819154276	BD	On-Demand	Anodyne	ADRB3	56	42
O[C@H](CN[C@H]1C[C@H]2CC[C@H]1O2)c1cccnc1	ZINC000819154277	BD	On-Demand	Anodyne	ADRB3	56	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000819154299	ED	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000819154300	ED	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000819154301	ED	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2C[C@H]3CC[C@H]2O3)CC1	ZINC000819154302	ED	On-Demand	Anodyne	GPR119	23	41
CSc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819154307	GH	On-Demand	Mild	PAPA1_CARPA	58	54
CSc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819154307	GH	On-Demand	Mild	CTSK	22	54
CSc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819154307	GH	On-Demand	Mild	CTSL	17	54
CSc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819154307	GH	On-Demand	Mild	REN	17	40
CSc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819154307	GH	On-Demand	Mild	FURIN	51	35
CSc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819154307	GH	On-Demand	Mild	FPR1	50	41
CSc1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819154308	GH	On-Demand	Mild	PAPA1_CARPA	58	54
CSc1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819154308	GH	On-Demand	Mild	CTSK	22	54
CSc1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819154308	GH	On-Demand	Mild	CTSL	17	54
CSc1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819154308	GH	On-Demand	Mild	REN	17	40
CSc1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819154308	GH	On-Demand	Mild	FURIN	51	35
CSc1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819154308	GH	On-Demand	Mild	FPR1	50	41
NC(=O)[C@@H]1CC[C@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)O1	ZINC000819154319	DC	On-Demand	Bother	CACNA1C	42	34
NC(=O)[C@@H]1CC[C@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)O1	ZINC000819154319	DC	On-Demand	Bother	CACNA1D	68	34
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)O1	ZINC000819154320	DC	On-Demand	Bother	CACNA1C	42	34
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)O1	ZINC000819154320	DC	On-Demand	Bother	CACNA1D	68	34
NC(=O)[C@@H]1CC[C@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)O1	ZINC000819154321	DC	On-Demand	Bother	CACNA1C	42	34
NC(=O)[C@@H]1CC[C@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)O1	ZINC000819154321	DC	On-Demand	Bother	CACNA1D	68	34
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)O1	ZINC000819154322	DC	On-Demand	Bother	CACNA1C	42	34
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)O1	ZINC000819154322	DC	On-Demand	Bother	CACNA1D	68	34
Cc1ncc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819154360	FF	On-Demand	Mild	PAPA1_CARPA	45	48
Cc1ncc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819154361	FF	On-Demand	Mild	PAPA1_CARPA	45	48
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1ccccc1F	ZINC000819154378	FH	On-Demand	Anodyne	ADRB2	17	43
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1ccccc1F	ZINC000819154379	FH	On-Demand	Anodyne	ADRB2	17	43
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1ccccc1F	ZINC000819154380	FH	On-Demand	Anodyne	ADRB2	17	43
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1ccccc1F	ZINC000819154381	FH	On-Demand	Anodyne	ADRB2	17	43
Cc1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154411	FH	On-Demand	Anodyne	ADRB2	46	45
Cc1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154411	FH	On-Demand	Anodyne	ADRB1	53	39
Cc1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154411	FH	On-Demand	Anodyne	ADRB3	32	41
Cc1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154411	FH	On-Demand	Anodyne	BACE1	25	42
Cc1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154412	FH	On-Demand	Anodyne	ADRB2	46	45
Cc1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154412	FH	On-Demand	Anodyne	ADRB1	53	39
Cc1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154412	FH	On-Demand	Anodyne	ADRB3	32	41
Cc1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154412	FH	On-Demand	Anodyne	BACE1	25	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819154424	EC	On-Demand	Anodyne	ADRB2	36	45
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819154424	EC	On-Demand	Anodyne	ADRB1	66	45
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819154424	EC	On-Demand	Anodyne	ADRB3	41	45
CN(CCC#N)C[C@@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819154436	EE	On-Demand	Mild	BACE1	16	41
CN(CCC#N)C[C@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819154437	EE	On-Demand	Mild	BACE1	16	41
CN(CCC#N)C[C@@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819154438	EE	On-Demand	Mild	BACE1	16	41
CN(CCC#N)C[C@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819154439	EE	On-Demand	Mild	BACE1	16	41
O=C(Nc1ccccc1)NC1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819154444	EF	On-Demand	Anodyne	EPHX2	60	46
O=C(Nc1ccccc1)NC1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819154445	EF	On-Demand	Anodyne	EPHX2	60	46
O=C(Nc1ccccc1)NC1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819154446	EF	On-Demand	Anodyne	EPHX2	60	46
O=C(Nc1ccccc1)NC1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819154447	EF	On-Demand	Anodyne	EPHX2	60	46
COc1cccc([S@@](=O)CC(=O)Nc2cccc(N3CCCCC3)c2)c1	ZINC000819154457	FG	On-Demand	Anodyne	DRD4	46	36
COc1cccc([S@@](=O)CC(=O)Nc2cccc(N3CCCCC3)c2)c1	ZINC000819154457	FG	On-Demand	Anodyne	HRH2	15	41
COc1cccc([S@@](=O)CC(=O)Nc2cccc(N3CCCCC3)c2)c1	ZINC000819154457	FG	On-Demand	Anodyne	MTNR1A	22	42
COc1cccc([S@@](=O)CC(=O)Nc2cccc(N3CCCCC3)c2)c1	ZINC000819154457	FG	On-Demand	Anodyne	MTNR1B	27	42
COc1cccc([S@@](=O)CC(=O)Nc2cccc(N3CCCCC3)c2)c1	ZINC000819154457	FG	On-Demand	Anodyne	GALR2	26	40
COc1cccc([S@@](=O)CC(=O)Nc2cccc(N3CCCCC3)c2)c1	ZINC000819154457	FG	On-Demand	Anodyne	TAAR1	48	46
CN(C[C@@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21)C1CC1	ZINC000819154458	DE	On-Demand	Anodyne	BACE1	26	44
CN(C[C@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21)C1CC1	ZINC000819154459	DE	On-Demand	Anodyne	BACE1	26	44
CN(C[C@@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21)C1CC1	ZINC000819154460	DE	On-Demand	Anodyne	BACE1	26	44
CN(C[C@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21)C1CC1	ZINC000819154461	DE	On-Demand	Anodyne	BACE1	26	44
O[C@@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccc(F)c(F)c1	ZINC000819154484	CD	On-Demand	Anodyne	ADRB3	21	46
O[C@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccc(F)c(F)c1	ZINC000819154485	CD	On-Demand	Anodyne	ADRB3	21	46
O[C@@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccc(F)c(F)c1	ZINC000819154486	CD	On-Demand	Anodyne	ADRB3	21	46
O[C@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccc(F)c(F)c1	ZINC000819154487	CD	On-Demand	Anodyne	ADRB3	21	46
O[C@H](CN[C@@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819154519	CE	On-Demand	Anodyne	ADRB1	27	40
O[C@H](CN[C@@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819154519	CE	On-Demand	Anodyne	ADRB3	42	44
O[C@H](CN[C@@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819154519	CE	On-Demand	Anodyne	CYP3A4	41	34
O[C@H](CN[C@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819154522	CE	On-Demand	Anodyne	ADRB1	27	40
O[C@H](CN[C@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819154522	CE	On-Demand	Anodyne	ADRB3	42	44
O[C@H](CN[C@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819154522	CE	On-Demand	Anodyne	CYP3A4	41	34
O[C@@H](CN[C@@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819154524	CE	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CN[C@@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819154524	CE	On-Demand	Anodyne	ADRB3	42	44
O[C@@H](CN[C@@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819154524	CE	On-Demand	Anodyne	CYP3A4	41	34
O[C@@H](CN[C@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819154525	CE	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CN[C@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819154525	CE	On-Demand	Anodyne	ADRB3	42	44
O[C@@H](CN[C@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819154525	CE	On-Demand	Anodyne	CYP3A4	41	34
CON(C)C(=O)CCN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819154526	DE	On-Demand	Anodyne	BACE1	18	40
CON(C)C(=O)CCN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819154528	DE	On-Demand	Anodyne	BACE1	18	40
CNC(=O)NNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819154544	CB	On-Demand	Reactive	MTNR1A	42	39
CNC(=O)NNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819154545	CB	On-Demand	Reactive	MTNR1A	42	39
O[C@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccccc1	ZINC000819154546	CD	On-Demand	Anodyne	ADRB3	24	44
O[C@@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccccc1	ZINC000819154548	CD	On-Demand	Anodyne	ADRB3	24	44
O[C@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccccc1	ZINC000819154550	CD	On-Demand	Anodyne	ADRB3	24	44
O[C@@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccccc1	ZINC000819154552	CD	On-Demand	Anodyne	ADRB3	24	44
N#Cc1ccc([C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154562	EH	On-Demand	Mild	BACE1	16	41
N#Cc1ccc([C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154565	EH	On-Demand	Mild	BACE1	16	41
N#Cc1ccc([C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154567	EH	On-Demand	Mild	BACE1	16	41
N#Cc1ccc([C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819154570	EH	On-Demand	Mild	BACE1	16	41
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccccc1Cl	ZINC000819154572	FG	On-Demand	Anodyne	OPRL1	43	38
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccccc1Cl	ZINC000819154572	FG	On-Demand	Anodyne	ADRB3	18	43
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccccc1Cl	ZINC000819154574	FG	On-Demand	Anodyne	OPRL1	43	38
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccccc1Cl	ZINC000819154574	FG	On-Demand	Anodyne	ADRB3	18	43
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(C)c1C	ZINC000819154586	FI	On-Demand	Mild	PAPA1_CARPA	45	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2nnc(C(C)(C)C)s2)CC1	ZINC000819154596	GF	On-Demand	Anodyne	GPR119	34	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2nnc(C(C)(C)C)s2)CC1	ZINC000819154599	GF	On-Demand	Anodyne	GPR119	34	43
O=C(NCCCCCCCN1CCCC1)c1cc2c(cn1)OCCO2	ZINC000819154604	EF	On-Demand	Anodyne	HTR1A	27	51
O=C(NCCCCCCCN1CCCC1)c1cc2c(cn1)OCCO2	ZINC000819154604	EF	On-Demand	Anodyne	DRD2	34	46
O=C(NCCCCCCCN1CCCC1)c1cc2c(cn1)OCCO2	ZINC000819154604	EF	On-Demand	Anodyne	HTR2A	25	51
O=C(NCCCCCCCN1CCCC1)c1cc2c(cn1)OCCO2	ZINC000819154604	EF	On-Demand	Anodyne	HTR2C	23	48
O=C(NCCCCCCCN1CCCC1)c1cc2c(cn1)OCCO2	ZINC000819154604	EF	On-Demand	Anodyne	DRD3	65	51
O=C(NCCCCCCCN1CCCC1)c1cc2c(cn1)OCCO2	ZINC000819154604	EF	On-Demand	Anodyne	CHRNA7	21	43
O=C(NCCCCCCCN1CCCC1)c1cc2c(cn1)OCCO2	ZINC000819154604	EF	On-Demand	Anodyne	HNMT	47	34
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819154616	EC	On-Demand	Anodyne	ADRB2	36	45
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819154616	EC	On-Demand	Anodyne	ADRB1	66	45
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819154616	EC	On-Demand	Anodyne	ADRB3	41	45
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819154617	EC	On-Demand	Anodyne	ADRB2	36	45
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819154617	EC	On-Demand	Anodyne	ADRB1	66	45
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819154617	EC	On-Demand	Anodyne	ADRB3	41	45
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819154618	EC	On-Demand	Anodyne	ADRB2	36	45
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819154618	EC	On-Demand	Anodyne	ADRB1	66	45
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819154618	EC	On-Demand	Anodyne	ADRB3	41	45
CC[C@@H](NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2)c1ncc(-c2ccccc2)[nH]1	ZINC000819154631	GG	On-Demand	Anodyne	HDAC1	15	45
CC[C@H](NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2)c1ncc(-c2ccccc2)[nH]1	ZINC000819154633	GG	On-Demand	Anodyne	HDAC1	15	45
CC[C@H](NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2)c1ncc(-c2ccccc2)[nH]1	ZINC000819154634	GG	On-Demand	Anodyne	HDAC1	15	45
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1ccc(F)cc1	ZINC000819154639	FH	On-Demand	Anodyne	ADRB2	43	37
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1ccc(F)cc1	ZINC000819154639	FH	On-Demand	Anodyne	ADRB1	30	43
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1ccc(F)cc1	ZINC000819154639	FH	On-Demand	Anodyne	ADRB3	44	43
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1ccc(F)cc1	ZINC000819154640	FH	On-Demand	Anodyne	ADRB2	43	37
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1ccc(F)cc1	ZINC000819154640	FH	On-Demand	Anodyne	ADRB1	30	43
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1ccc(F)cc1	ZINC000819154640	FH	On-Demand	Anodyne	ADRB3	44	43
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1ccc(F)cc1	ZINC000819154641	FH	On-Demand	Anodyne	ADRB2	43	37
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1ccc(F)cc1	ZINC000819154641	FH	On-Demand	Anodyne	ADRB1	30	43
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1ccc(F)cc1	ZINC000819154641	FH	On-Demand	Anodyne	ADRB3	44	43
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1ccc(F)cc1	ZINC000819154642	FH	On-Demand	Anodyne	ADRB2	43	37
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1ccc(F)cc1	ZINC000819154642	FH	On-Demand	Anodyne	ADRB1	30	43
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1ccc(F)cc1	ZINC000819154642	FH	On-Demand	Anodyne	ADRB3	44	43
CC[C@@H](NC(=O)C(F)=C1CCC1)c1ncc(-c2ccccc2)[nH]1	ZINC000819154660	DI	On-Demand	Anodyne	HDAC1	15	46
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819154666	GH	On-Demand	Bother	ADRB1	22	42
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819154666	GH	On-Demand	Bother	ADRB3	42	42
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819154666	GH	On-Demand	Bother	COLA	60	39
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819154667	GH	On-Demand	Bother	ADRB1	22	42
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819154667	GH	On-Demand	Bother	ADRB3	42	42
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819154667	GH	On-Demand	Bother	COLA	60	39
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819154668	GH	On-Demand	Bother	ADRB1	22	42
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819154668	GH	On-Demand	Bother	ADRB3	42	42
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819154668	GH	On-Demand	Bother	COLA	60	39
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819154669	GH	On-Demand	Bother	ADRB1	22	42
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819154669	GH	On-Demand	Bother	ADRB3	42	42
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819154669	GH	On-Demand	Bother	COLA	60	39
COc1ccccc1COC[C@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819154685	ED	On-Demand	Anodyne	ADRA1D	23	47
COc1ccccc1COC[C@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819154685	ED	On-Demand	Anodyne	ADRA1A	16	47
COc1ccccc1COC[C@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819154685	ED	On-Demand	Anodyne	ADRA1B	24	47
COc1ccccc1COC[C@@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819154686	ED	On-Demand	Anodyne	ADRA1D	23	47
COc1ccccc1COC[C@@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819154686	ED	On-Demand	Anodyne	ADRA1A	16	47
COc1ccccc1COC[C@@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819154686	ED	On-Demand	Anodyne	ADRA1B	24	47
COc1ccccc1COC[C@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819154687	ED	On-Demand	Anodyne	ADRA1D	23	47
COc1ccccc1COC[C@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819154687	ED	On-Demand	Anodyne	ADRA1A	16	47
COc1ccccc1COC[C@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819154687	ED	On-Demand	Anodyne	ADRA1B	24	47
COc1ccccc1COC[C@@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819154688	ED	On-Demand	Anodyne	ADRA1D	23	47
COc1ccccc1COC[C@@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819154688	ED	On-Demand	Anodyne	ADRA1A	16	47
COc1ccccc1COC[C@@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819154688	ED	On-Demand	Anodyne	ADRA1B	24	47
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(CCC(=O)N2CCCC2)cc1	ZINC000819154707	EF	On-Demand	Anodyne	F13A1	18	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(CCC(=O)N2CCCC2)cc1	ZINC000819154708	EF	On-Demand	Anodyne	F13A1	18	41
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(CCC(=O)N2CCCC2)cc1	ZINC000819154709	EF	On-Demand	Anodyne	F13A1	18	41
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(CCC(=O)N2CCCC2)cc1	ZINC000819154710	EF	On-Demand	Anodyne	F13A1	18	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCc3c[nH]nc3C2)CC1	ZINC000819154741	FD	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCc3c[nH]nc3C2)CC1	ZINC000819154742	FD	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCc3c[nH]nc3C2)CC1	ZINC000819154743	FD	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCc3c[nH]nc3C2)CC1	ZINC000819154744	FD	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N(CCNC[C@H](O)c1cccnc1)C1CCCCCC1	ZINC000819154766	GH	On-Demand	Anodyne	ADRB2	24	40
CC(C)(C)OC(=O)N(CCNC[C@H](O)c1cccnc1)C1CCCCCC1	ZINC000819154766	GH	On-Demand	Anodyne	ADRB1	33	48
CC(C)(C)OC(=O)N(CCNC[C@H](O)c1cccnc1)C1CCCCCC1	ZINC000819154766	GH	On-Demand	Anodyne	ADRB3	107	54
CC(C)(C)OC(=O)N(CCNC[C@H](O)c1cccnc1)C1CCCCCC1	ZINC000819154766	GH	On-Demand	Anodyne	AMY2	43	29
CC(C)(C)OC(=O)N(CCNC[C@@H](O)c1cccnc1)C1CCCCCC1	ZINC000819154767	GH	On-Demand	Anodyne	ADRB2	24	40
CC(C)(C)OC(=O)N(CCNC[C@@H](O)c1cccnc1)C1CCCCCC1	ZINC000819154767	GH	On-Demand	Anodyne	ADRB1	33	48
CC(C)(C)OC(=O)N(CCNC[C@@H](O)c1cccnc1)C1CCCCCC1	ZINC000819154767	GH	On-Demand	Anodyne	ADRB3	107	54
CC(C)(C)OC(=O)N(CCNC[C@@H](O)c1cccnc1)C1CCCCCC1	ZINC000819154767	GH	On-Demand	Anodyne	AMY2	43	29
O[C@H](CN[C@H]1CCc2c[nH]nc2C1)c1cccnc1	ZINC000819154772	CC	On-Demand	Anodyne	ADRB1	20	41
O[C@H](CN[C@H]1CCc2c[nH]nc2C1)c1cccnc1	ZINC000819154772	CC	On-Demand	Anodyne	ADRB3	52	56
O[C@@H](CN[C@H]1CCc2c[nH]nc2C1)c1cccnc1	ZINC000819154773	CC	On-Demand	Anodyne	ADRB1	20	41
O[C@@H](CN[C@H]1CCc2c[nH]nc2C1)c1cccnc1	ZINC000819154773	CC	On-Demand	Anodyne	ADRB3	52	56
O[C@@H](CN[C@@H]1CCc2c[nH]nc2C1)c1cccnc1	ZINC000819154774	CC	On-Demand	Anodyne	ADRB1	20	41
O[C@@H](CN[C@@H]1CCc2c[nH]nc2C1)c1cccnc1	ZINC000819154774	CC	On-Demand	Anodyne	ADRB3	52	56
O[C@H](CN[C@@H]1CCc2c[nH]nc2C1)c1cccnc1	ZINC000819154775	CC	On-Demand	Anodyne	ADRB1	20	41
O[C@H](CN[C@@H]1CCc2c[nH]nc2C1)c1cccnc1	ZINC000819154775	CC	On-Demand	Anodyne	ADRB3	52	56
CNC(=O)NNC(=O)C1(c2ccc(Cl)cc2Cl)CCCCC1	ZINC000819154776	EG	On-Demand	Reactive	UGCG	36	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@H]2CC[C@H]1O2	ZINC000819154781	GE	On-Demand	Anodyne	CTSD	102	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@H]2CC[C@H]1O2	ZINC000819154781	GE	On-Demand	Anodyne	PGC	67	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@H]2CC[C@H]1O2	ZINC000819154781	GE	On-Demand	Anodyne	PAPA1_CARPA	29	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@H]2CC[C@H]1O2	ZINC000819154781	GE	On-Demand	Anodyne	BACE2	45	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@H]2CC[C@H]1O2	ZINC000819154781	GE	On-Demand	Anodyne	REN	92	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@H]2CC[C@H]1O2	ZINC000819154781	GE	On-Demand	Anodyne	REN1	27	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@H]2CC[C@H]1O2	ZINC000819154781	GE	On-Demand	Anodyne	BACE1	73	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@H]2CC[C@H]1O2	ZINC000819154781	GE	On-Demand	Anodyne	FPR1	53	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@H]2CC[C@H]1O2	ZINC000819154781	GE	On-Demand	Anodyne	PLM1_PLAFA	20	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000819154782	GE	On-Demand	Anodyne	CTSD	102	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000819154782	GE	On-Demand	Anodyne	PGC	67	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000819154782	GE	On-Demand	Anodyne	PAPA1_CARPA	29	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000819154782	GE	On-Demand	Anodyne	BACE2	45	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000819154782	GE	On-Demand	Anodyne	REN	92	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000819154782	GE	On-Demand	Anodyne	REN1	27	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000819154782	GE	On-Demand	Anodyne	BACE1	73	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000819154782	GE	On-Demand	Anodyne	FPR1	53	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]2CC[C@H]1O2	ZINC000819154782	GE	On-Demand	Anodyne	PLM1_PLAFA	20	41
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819154829	DD	On-Demand	Anodyne	ADRB2	32	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819154829	DD	On-Demand	Anodyne	ADRB1	61	39
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819154832	DD	On-Demand	Anodyne	ADRB2	32	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819154832	DD	On-Demand	Anodyne	ADRB1	61	39
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819154834	DD	On-Demand	Anodyne	ADRB2	32	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819154834	DD	On-Demand	Anodyne	ADRB1	61	39
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819154837	DD	On-Demand	Anodyne	ADRB2	32	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819154837	DD	On-Demand	Anodyne	ADRB1	61	39
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819154838	GG	On-Demand	Anodyne	CTSD	38	42
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819154838	GG	On-Demand	Anodyne	BACE1	34	49
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819154842	GG	On-Demand	Anodyne	CTSD	38	42
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819154842	GG	On-Demand	Anodyne	BACE1	34	49
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819154846	GG	On-Demand	Anodyne	CTSD	38	42
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819154846	GG	On-Demand	Anodyne	BACE1	34	49
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819154849	GG	On-Demand	Anodyne	CTSD	38	42
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819154849	GG	On-Demand	Anodyne	BACE1	34	49
O=C(Nc1ccccc1)NC1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819154858	EG	On-Demand	Anodyne	EPHX2	58	51
O[C@@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccc(Cl)cc1Cl	ZINC000819154876	EF	On-Demand	Anodyne	ADRB3	21	42
O[C@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccc(Cl)cc1Cl	ZINC000819154878	EF	On-Demand	Anodyne	ADRB3	21	42
O[C@@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccc(Cl)cc1Cl	ZINC000819154882	EF	On-Demand	Anodyne	ADRB3	21	42
O[C@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccc(Cl)cc1Cl	ZINC000819154883	EF	On-Demand	Anodyne	ADRB3	21	42
O[C@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccc(Cl)c(F)c1	ZINC000819154894	FG	On-Demand	Anodyne	PRKCQ	40	33
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccc(Cl)c(F)c1	ZINC000819154896	FG	On-Demand	Anodyne	PRKCQ	40	33
O[C@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccc(Cl)c(F)c1	ZINC000819154898	FG	On-Demand	Anodyne	PRKCQ	40	33
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccc(Cl)c(F)c1	ZINC000819154900	FG	On-Demand	Anodyne	PRKCQ	40	33
COc1ccc(OCCCNC(=O)C(F)=C2CCC2)cc1	ZINC000819154918	CF	On-Demand	Anodyne	HRH2	21	40
COc1ccc(OCCCNC(=O)C(F)=C2CCC2)cc1	ZINC000819154918	CF	On-Demand	Anodyne	SCNN1A	24	41
COc1ccc(OCCCNC(=O)C(F)=C2CCC2)cc1	ZINC000819154918	CF	On-Demand	Anodyne	MTNR1A	44	39
CCC(=O)c1cc(Cl)ccc1OCC(=O)Nc1ccc(N2CCCCC2)cc1	ZINC000819154960	HJ	On-Demand	Anodyne	F10	16	43
CCC(=O)c1cc(Cl)ccc1OCC(=O)Nc1ccc(N2CCCCC2)cc1	ZINC000819154960	HJ	On-Demand	Anodyne	PTGER1	29	40
CCC(=O)c1cc(Cl)ccc1OCC(=O)Nc1ccc(N2CCCCC2)cc1	ZINC000819154960	HJ	On-Demand	Anodyne	CPT1A	44	35
CCC(=O)c1cc(Cl)ccc1OCC(=O)Nc1ccc(N2CCCCC2)cc1	ZINC000819154960	HJ	On-Demand	Anodyne	CPT2	48	33
CCC(=O)c1cc(Cl)ccc1OCC(=O)Nc1ccc(N2CCCCC2)cc1	ZINC000819154960	HJ	On-Demand	Anodyne	MCHR2	24	42
O[C@H](CN[C@H]1CCc2c[nH]nc2C1)c1cccc(Br)c1	ZINC000819154986	EE	On-Demand	Anodyne	ADRB3	21	45
O[C@@H](CN[C@@H]1CCc2c[nH]nc2C1)c1cccc(Br)c1	ZINC000819154990	EE	On-Demand	Anodyne	ADRB3	21	45
O[C@H](CN[C@@H]1CCc2c[nH]nc2C1)c1cccc(Br)c1	ZINC000819154993	EE	On-Demand	Anodyne	ADRB3	21	45
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3ncccc3Cl)C2)cc1	ZINC000819154997	GE	On-Demand	Anodyne	ADRB3	34	41
O[C@@H](CN[C@H]1CCc2c[nH]nc2C1)c1cccc(Br)c1	ZINC000819154998	EE	On-Demand	Anodyne	ADRB3	21	45
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3ncccc3Cl)C2)cc1	ZINC000819155000	GE	On-Demand	Anodyne	ADRB3	34	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3ncccc3Cl)C2)cc1	ZINC000819155001	GE	On-Demand	Anodyne	ADRB3	34	41
COCCOc1ccc(NC(=O)C(F)=C2CCC2)cc1F	ZINC000819155002	CG	On-Demand	Anodyne	KDR	17	41
COCCOc1ccc(NC(=O)C(F)=C2CCC2)cc1F	ZINC000819155002	CG	On-Demand	Anodyne	MET	89	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3ncccc3Cl)C2)cc1	ZINC000819155004	GE	On-Demand	Anodyne	ADRB3	34	41
CNC(=O)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819155006	CD	On-Demand	Reactive	CRTM	49	34
O=C(Nc1ccc(CCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819155014	DH	On-Demand	Anodyne	HRH3	17	44
O[C@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)COc1ccccc1F	ZINC000819155028	FH	On-Demand	Anodyne	ADRB2	18	43
O[C@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)COc1ccccc1F	ZINC000819155028	FH	On-Demand	Anodyne	BACE1	26	40
O[C@@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)COc1ccccc1F	ZINC000819155030	FH	On-Demand	Anodyne	ADRB2	18	43
O[C@@H](CN[C@@H]1CC2(CCC2)Oc2ccccc21)COc1ccccc1F	ZINC000819155030	FH	On-Demand	Anodyne	BACE1	26	40
O[C@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)COc1ccccc1F	ZINC000819155031	FH	On-Demand	Anodyne	ADRB2	18	43
O[C@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)COc1ccccc1F	ZINC000819155031	FH	On-Demand	Anodyne	BACE1	26	40
O[C@@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)COc1ccccc1F	ZINC000819155033	FH	On-Demand	Anodyne	ADRB2	18	43
O[C@@H](CN[C@H]1CC2(CCC2)Oc2ccccc21)COc1ccccc1F	ZINC000819155033	FH	On-Demand	Anodyne	BACE1	26	40
CCC(CC)(CC)CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819155046	CG	On-Demand	Bother	CACNA1D	50	33
CCC(CC)(CC)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819155048	CG	On-Demand	Bother	CACNA1D	50	33
CSc1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819155060	ED	On-Demand	Anodyne	ADRB2	23	40
CSc1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819155062	ED	On-Demand	Anodyne	ADRB2	23	40
CSc1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819155064	ED	On-Demand	Anodyne	ADRB2	23	40
CSc1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819155066	ED	On-Demand	Anodyne	ADRB2	23	40
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCc3c[nH]nc3C2)c1	ZINC000819155068	DD	On-Demand	Bother	ADRB3	21	47
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCc3c[nH]nc3C2)c1	ZINC000819155068	DD	On-Demand	Bother	CACNA1D	44	33
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCc3c[nH]nc3C2)c1	ZINC000819155070	DD	On-Demand	Bother	ADRB3	21	47
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCc3c[nH]nc3C2)c1	ZINC000819155070	DD	On-Demand	Bother	CACNA1D	44	33
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCc3c[nH]nc3C2)c1	ZINC000819155072	DD	On-Demand	Bother	ADRB3	21	47
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCc3c[nH]nc3C2)c1	ZINC000819155072	DD	On-Demand	Bother	CACNA1D	44	33
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCc3c[nH]nc3C2)c1	ZINC000819155074	DD	On-Demand	Bother	ADRB3	21	47
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCc3c[nH]nc3C2)c1	ZINC000819155074	DD	On-Demand	Bother	CACNA1D	44	33
O[C@H](CN[C@H]1CCc2c[nH]nc2C1)c1cccc(F)c1	ZINC000819155080	CD	On-Demand	Anodyne	ADRB3	21	44
O[C@@H](CN[C@@H]1CCc2c[nH]nc2C1)c1cccc(F)c1	ZINC000819155081	CD	On-Demand	Anodyne	ADRB3	21	44
O[C@H](CN[C@@H]1CCc2c[nH]nc2C1)c1cccc(F)c1	ZINC000819155084	CD	On-Demand	Anodyne	ADRB3	21	44
O[C@@H](CN[C@H]1CCc2c[nH]nc2C1)c1cccc(F)c1	ZINC000819155086	CD	On-Demand	Anodyne	ADRB3	21	44
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1ccccc1	ZINC000819155096	EH	On-Demand	Anodyne	ADRB2	40	39
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1ccccc1	ZINC000819155096	EH	On-Demand	Anodyne	ADRB1	32	53
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1ccccc1	ZINC000819155096	EH	On-Demand	Anodyne	ADRB3	66	53
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1ccccc1	ZINC000819155096	EH	On-Demand	Anodyne	AOC3	15	44
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1ccccc1	ZINC000819155098	EH	On-Demand	Anodyne	ADRB2	40	39
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1ccccc1	ZINC000819155098	EH	On-Demand	Anodyne	ADRB1	32	53
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1ccccc1	ZINC000819155098	EH	On-Demand	Anodyne	ADRB3	66	53
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1ccccc1	ZINC000819155098	EH	On-Demand	Anodyne	AOC3	15	44
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1ccccc1	ZINC000819155100	EH	On-Demand	Anodyne	ADRB2	40	39
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1ccccc1	ZINC000819155100	EH	On-Demand	Anodyne	ADRB1	32	53
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1ccccc1	ZINC000819155100	EH	On-Demand	Anodyne	ADRB3	66	53
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1ccccc1	ZINC000819155100	EH	On-Demand	Anodyne	AOC3	15	44
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1ccccc1	ZINC000819155103	EH	On-Demand	Anodyne	ADRB2	40	39
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1ccccc1	ZINC000819155103	EH	On-Demand	Anodyne	ADRB1	32	53
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1ccccc1	ZINC000819155103	EH	On-Demand	Anodyne	ADRB3	66	53
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1ccccc1	ZINC000819155103	EH	On-Demand	Anodyne	AOC3	15	44
COc1ccc(-c2nnc(S)n2CC(=O)NCCC(C)(C)C2CC2)cc1	ZINC000819155117	FG	On-Demand	Anodyne	AVPR1B	43	37
C#CCOc1ccc(C(=O)NCCC(C)(C)C2CC2)cc1	ZINC000819155119	CG	On-Demand	Mild	GCGR	31	41
CCOC(=O)Nc1ccc(C(=O)NCCC(C)(C)C2CC2)cc1	ZINC000819155135	DH	On-Demand	Anodyne	GCGR	27	41
CCOC(=O)Nc1ccc(C(=O)NCCC(C)(C)C2CC2)cc1	ZINC000819155135	DH	On-Demand	Anodyne	GIPR	40	39
CN(C)S(=O)(=O)c1cc(C(=O)NCCC(C)(C)C2CC2)ccc1Cl	ZINC000819155168	FG	On-Demand	Anodyne	CACNA1I	39	40
CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)NCCC(C)(C)C1CC1	ZINC000819155172	EG	On-Demand	Anodyne	CACNA1B	19	44
CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)NCCC(C)(C)C1CC1	ZINC000819155173	EG	On-Demand	Anodyne	CACNA1B	19	44
CCOC(=O)N[C@@H](C(=O)NCCC(C)(C)C1CC1)C(C)C	ZINC000819155193	CF	On-Demand	Anodyne	HLA-DRB1	44	43
CCOC(=O)N[C@H](C(=O)NCCC(C)(C)C1CC1)C(C)C	ZINC000819155194	CF	On-Demand	Anodyne	HLA-DRB1	44	43
CN(CCC(=O)NCCC(C)(C)C1CC1)C(=O)OCc1ccccc1	ZINC000819155197	EH	On-Demand	Anodyne	AMY2	49	34
COc1cccc(/C=C(\C(=O)NCCC(C)(C)C2CC2)n2nnnc2C)c1	ZINC000819155201	FF	On-Demand	Anodyne	DRD4	40	31
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)NCCC(C)(C)C1CC1	ZINC000819155206	EE	On-Demand	Anodyne	VHL	48	32
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2CC[C@@H](C(N)=O)O2)CC1	ZINC000819155216	FC	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2CC[C@H](C(N)=O)O2)CC1	ZINC000819155217	FC	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2CC[C@H](C(N)=O)O2)CC1	ZINC000819155218	FC	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2CC[C@@H](C(N)=O)O2)CC1	ZINC000819155219	FC	On-Demand	Anodyne	GPR119	29	40
O[C@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1cccnc1	ZINC000819155265	DE	On-Demand	Anodyne	ADRB3	62	49
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1cccnc1	ZINC000819155267	DE	On-Demand	Anodyne	ADRB3	62	49
O[C@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1cccnc1	ZINC000819155268	DE	On-Demand	Anodyne	ADRB3	62	49
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1cccnc1	ZINC000819155270	DE	On-Demand	Anodyne	ADRB3	62	49
O=[N+]([O-])c1cnn(C[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819155277	FE	On-Demand	Bother	BACE1	23	40
O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819155279	FE	On-Demand	Bother	BACE1	23	40
O=[N+]([O-])c1cnn(C[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819155282	FE	On-Demand	Bother	BACE1	23	40
O=[N+]([O-])c1cnn(C[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819155286	FE	On-Demand	Bother	BACE1	23	40
CC(=O)NCC1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819155302	GD	On-Demand	Mild	PAPA1_CARPA	34	45
CC(=O)NCC1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819155312	GD	On-Demand	Mild	PAPA1_CARPA	34	45
O[C@@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccc(Cl)c(F)c1	ZINC000819155319	DE	On-Demand	Anodyne	ADRB3	22	46
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819155324	FH	On-Demand	Bother	BACE1	24	42
O[C@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccc(Cl)c(F)c1	ZINC000819155332	DE	On-Demand	Anodyne	ADRB3	22	46
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819155334	FH	On-Demand	Bother	BACE1	24	42
O[C@@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccc(Cl)c(F)c1	ZINC000819155335	DE	On-Demand	Anodyne	ADRB3	22	46
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819155338	FH	On-Demand	Bother	BACE1	24	42
O[C@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccc(Cl)c(F)c1	ZINC000819155339	DE	On-Demand	Anodyne	ADRB3	22	46
CCC(=O)c1cc(Cl)ccc1OCC(=O)Nc1c(Cl)cc(Cl)cc1Cl	ZINC000819155342	HK	On-Demand	Anodyne	ALPL	40	36
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819155343	FH	On-Demand	Bother	BACE1	24	42
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)NCCC(C)(C)C1CC1	ZINC000819155349	EI	On-Demand	Anodyne	FPR1	27	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3cscn3)CC1)C2	ZINC000819155365	GD	On-Demand	Anodyne	SCN5A	41	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3cscn3)CC1)C2	ZINC000819155369	GD	On-Demand	Anodyne	SCN5A	41	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCCS1	ZINC000819155446	GG	On-Demand	Anodyne	CTSD	94	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCCS1	ZINC000819155446	GG	On-Demand	Anodyne	PGC	58	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCCS1	ZINC000819155446	GG	On-Demand	Anodyne	PAPA1_CARPA	29	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCCS1	ZINC000819155446	GG	On-Demand	Anodyne	BACE2	42	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCCS1	ZINC000819155446	GG	On-Demand	Anodyne	TIMP3	40	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCCS1	ZINC000819155446	GG	On-Demand	Anodyne	REN	73	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCCS1	ZINC000819155446	GG	On-Demand	Anodyne	REN1	15	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCCS1	ZINC000819155446	GG	On-Demand	Anodyne	BACE1	81	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCCS1	ZINC000819155446	GG	On-Demand	Anodyne	FPR1	48	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCCS1	ZINC000819155446	GG	On-Demand	Anodyne	PLM2_PLAFA	47	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCCS1	ZINC000819155446	GG	On-Demand	Anodyne	Q82323_9DELA	72	31
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCCS1	ZINC000819155450	GG	On-Demand	Anodyne	CTSD	94	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCCS1	ZINC000819155450	GG	On-Demand	Anodyne	PGC	58	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCCS1	ZINC000819155450	GG	On-Demand	Anodyne	PAPA1_CARPA	29	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCCS1	ZINC000819155450	GG	On-Demand	Anodyne	BACE2	42	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCCS1	ZINC000819155450	GG	On-Demand	Anodyne	TIMP3	40	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCCS1	ZINC000819155450	GG	On-Demand	Anodyne	REN	73	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCCS1	ZINC000819155450	GG	On-Demand	Anodyne	REN1	15	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCCS1	ZINC000819155450	GG	On-Demand	Anodyne	BACE1	81	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCCS1	ZINC000819155450	GG	On-Demand	Anodyne	FPR1	48	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCCS1	ZINC000819155450	GG	On-Demand	Anodyne	PLM2_PLAFA	47	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCCS1	ZINC000819155450	GG	On-Demand	Anodyne	Q82323_9DELA	72	31
CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)NCCC(C)(C)C1CC1	ZINC000819155451	ED	On-Demand	Anodyne	PAPA1_CARPA	38	42
CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)NCCC(C)(C)C1CC1	ZINC000819155451	ED	On-Demand	Anodyne	ECE1	32	40
NC(=O)[C@@H]1CC[C@H](CNC[C@H](O)c2cccc(Cl)c2)O1	ZINC000819155556	CC	On-Demand	Anodyne	ADRB1	38	44
NC(=O)[C@@H]1CC[C@H](CNC[C@H](O)c2cccc(Cl)c2)O1	ZINC000819155556	CC	On-Demand	Anodyne	ADRB3	53	44
NC(=O)[C@@H]1CC[C@H](CNC[C@H](O)c2cccc(Cl)c2)O1	ZINC000819155556	CC	On-Demand	Anodyne	CYP3A4	44	33
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)O1	ZINC000819155616	CC	On-Demand	Anodyne	ADRB1	38	44
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)O1	ZINC000819155616	CC	On-Demand	Anodyne	ADRB3	53	44
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)O1	ZINC000819155616	CC	On-Demand	Anodyne	CYP3A4	44	33
NC(=O)[C@@H]1CC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)O1	ZINC000819155617	CC	On-Demand	Anodyne	ADRB1	38	44
NC(=O)[C@@H]1CC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)O1	ZINC000819155617	CC	On-Demand	Anodyne	ADRB3	53	44
NC(=O)[C@@H]1CC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)O1	ZINC000819155617	CC	On-Demand	Anodyne	CYP3A4	44	33
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)O1	ZINC000819155618	CC	On-Demand	Anodyne	ADRB1	38	44
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)O1	ZINC000819155618	CC	On-Demand	Anodyne	ADRB3	53	44
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)O1	ZINC000819155618	CC	On-Demand	Anodyne	CYP3A4	44	33
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819155718	FG	On-Demand	Mild	ADRB1	46	37
N#Cc1ccc(OC[C@@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819155724	FG	On-Demand	Mild	ADRB1	46	37
N#Cc1ccc(OC[C@H](O)CN[C@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819155726	FG	On-Demand	Mild	ADRB1	46	37
N#Cc1ccc(OC[C@H](O)CN[C@@H]2CC3(CCC3)Oc3ccccc32)cc1	ZINC000819155727	FG	On-Demand	Mild	ADRB1	46	37
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819155733	GF	On-Demand	Anodyne	BACE1	20	42
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819155735	GF	On-Demand	Anodyne	BACE1	20	42
CCOC(=O)CC[C@@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819155742	EF	On-Demand	Anodyne	CTSD	34	42
CCOC(=O)CC[C@@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819155742	EF	On-Demand	Anodyne	BACE1	30	46
CCOC(=O)CC[C@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819155743	EF	On-Demand	Anodyne	CTSD	34	42
CCOC(=O)CC[C@H](O)CN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819155743	EF	On-Demand	Anodyne	BACE1	30	46
CCOC(=O)CC[C@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819155744	EF	On-Demand	Anodyne	CTSD	34	42
CCOC(=O)CC[C@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819155744	EF	On-Demand	Anodyne	BACE1	30	46
CCOC(=O)CC[C@@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819155745	EF	On-Demand	Anodyne	CTSD	34	42
CCOC(=O)CC[C@@H](O)CN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819155745	EF	On-Demand	Anodyne	BACE1	30	46
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819155778	ED	On-Demand	Anodyne	ADRB2	41	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819155778	ED	On-Demand	Anodyne	ADRB1	77	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819155778	ED	On-Demand	Anodyne	ADRB3	52	52
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819155781	ED	On-Demand	Anodyne	ADRB2	41	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819155781	ED	On-Demand	Anodyne	ADRB1	77	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819155781	ED	On-Demand	Anodyne	ADRB3	52	52
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819155782	ED	On-Demand	Anodyne	ADRB2	41	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819155782	ED	On-Demand	Anodyne	ADRB1	77	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819155782	ED	On-Demand	Anodyne	ADRB3	52	52
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819155784	ED	On-Demand	Anodyne	ADRB2	41	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819155784	ED	On-Demand	Anodyne	ADRB1	77	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819155784	ED	On-Demand	Anodyne	ADRB3	52	52
OC1(CN[C@@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)CCCCC1	ZINC000819155800	GH	On-Demand	Anodyne	CXCR3	21	41
O[C@@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccccc1Cl	ZINC000819155802	CE	On-Demand	Anodyne	ADRB3	19	40
OC1(CN[C@H]2CCN(c3ncc(C(F)(F)F)cc3Cl)C2)CCCCC1	ZINC000819155803	GH	On-Demand	Anodyne	CXCR3	21	41
O[C@@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccccc1Cl	ZINC000819155804	CE	On-Demand	Anodyne	ADRB3	19	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCc3c[nH]nc3C2)cc1	ZINC000819155847	EC	On-Demand	Anodyne	ADRB3	25	43
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCc3c[nH]nc3C2)cc1	ZINC000819155850	EC	On-Demand	Anodyne	ADRB3	25	43
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCc3c[nH]nc3C2)cc1	ZINC000819155853	EC	On-Demand	Anodyne	ADRB3	25	43
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCc3c[nH]nc3C2)cc1	ZINC000819155856	EC	On-Demand	Anodyne	ADRB3	25	43
N#Cc1ccc([C@H](O)CN[C@H]2CCN(c3ncccc3Cl)C2)cc1	ZINC000819155912	EF	On-Demand	Mild	ADRB3	21	42
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(c3ncccc3Cl)C2)cc1	ZINC000819155917	EF	On-Demand	Mild	ADRB3	21	42
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(c3ncccc3Cl)C2)cc1	ZINC000819155919	EF	On-Demand	Mild	ADRB3	21	42
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(c3ncccc3Cl)C2)cc1	ZINC000819155922	EF	On-Demand	Mild	ADRB3	21	42
C[C@H]1C[C@@H](C)CN(C[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819155982	GG	On-Demand	Mild	PAPA1_CARPA	37	45
C[C@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819155983	GG	On-Demand	Mild	PAPA1_CARPA	37	45
C[C@H]1C[C@@H](C)CN(C[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819155984	GG	On-Demand	Mild	PAPA1_CARPA	37	45
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(C)(C)C1CC1	ZINC000819156000	DG	On-Demand	Anodyne	F2	18	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(C)(C)C1CC1	ZINC000819156000	DG	On-Demand	Anodyne	CELA1	52	39
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(C)(C)C1CC1	ZINC000819156000	DG	On-Demand	Anodyne	ELANE	35	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(C)(C)C1CC1	ZINC000819156000	DG	On-Demand	Anodyne	PREP	17	52
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(C)(C)C1CC1	ZINC000819156000	DG	On-Demand	Anodyne	TPP2	31	42
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(C)(C)C1CC1	ZINC000819156001	DG	On-Demand	Anodyne	F2	18	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(C)(C)C1CC1	ZINC000819156001	DG	On-Demand	Anodyne	CELA1	52	39
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(C)(C)C1CC1	ZINC000819156001	DG	On-Demand	Anodyne	ELANE	35	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(C)(C)C1CC1	ZINC000819156001	DG	On-Demand	Anodyne	PREP	17	52
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(C)(C)C1CC1	ZINC000819156001	DG	On-Demand	Anodyne	TPP2	31	42
C[C@H]1C[C@@H](C)CN(C[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819156028	GG	On-Demand	Mild	PAPA1_CARPA	37	45
O=C(Nc1cccc(CN2CCOCC2)c1)C(F)=C1CCC1	ZINC000819156068	DF	On-Demand	Anodyne	CASR	34	43
O=C(Nc1cccc(CN2CCOCC2)c1)C(F)=C1CCC1	ZINC000819156068	DF	On-Demand	Anodyne	FAAH	17	40
O=C(Nc1cccc(CN2CCOCC2)c1)C(F)=C1CCC1	ZINC000819156068	DF	On-Demand	Anodyne	EPHX2	23	40
CN(CC(=O)NCCC(C)(C)C1CC1)C(=O)OCc1ccccc1	ZINC000819156082	EG	On-Demand	Anodyne	ELANE	15	40
CN(CC(=O)NCCC(C)(C)C1CC1)C(=O)OCc1ccccc1	ZINC000819156082	EG	On-Demand	Anodyne	AMY2	47	33
CN(CC(=O)NCCC(C)(C)C1CC1)C(=O)OCc1ccccc1	ZINC000819156082	EG	On-Demand	Anodyne	NPR	46	37
CCCC[C@@H](CNC(=O)OC(C)(C)C)NCC1(O)CCCC1	ZINC000819156095	DF	On-Demand	Anodyne	CTSK	18	40
CCCC[C@H](CNC(=O)OC(C)(C)C)NCC1(O)CCCC1	ZINC000819156096	DF	On-Demand	Anodyne	CTSK	18	40
O[C@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1cccc(Cl)c1	ZINC000819156144	FG	On-Demand	Anodyne	ADRB1	42	45
O[C@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1cccc(Cl)c1	ZINC000819156144	FG	On-Demand	Anodyne	ADRB3	64	48
O[C@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1cccc(Cl)c1	ZINC000819156144	FG	On-Demand	Anodyne	IGF1R	28	40
O[C@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1cccc(Cl)c1	ZINC000819156144	FG	On-Demand	Anodyne	CYP3A4	50	40
O[C@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1cccc(Cl)c1	ZINC000819156146	FG	On-Demand	Anodyne	ADRB1	42	45
O[C@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1cccc(Cl)c1	ZINC000819156146	FG	On-Demand	Anodyne	ADRB3	64	48
O[C@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1cccc(Cl)c1	ZINC000819156146	FG	On-Demand	Anodyne	IGF1R	28	40
O[C@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1cccc(Cl)c1	ZINC000819156146	FG	On-Demand	Anodyne	CYP3A4	50	40
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1cccc(Cl)c1	ZINC000819156149	FG	On-Demand	Anodyne	ADRB1	42	45
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1cccc(Cl)c1	ZINC000819156149	FG	On-Demand	Anodyne	ADRB3	64	48
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1cccc(Cl)c1	ZINC000819156149	FG	On-Demand	Anodyne	IGF1R	28	40
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1cccc(Cl)c1	ZINC000819156149	FG	On-Demand	Anodyne	CYP3A4	50	40
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1cccc(Cl)c1	ZINC000819156151	FG	On-Demand	Anodyne	ADRB1	42	45
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1cccc(Cl)c1	ZINC000819156151	FG	On-Demand	Anodyne	ADRB3	64	48
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1cccc(Cl)c1	ZINC000819156151	FG	On-Demand	Anodyne	IGF1R	28	40
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1cccc(Cl)c1	ZINC000819156151	FG	On-Demand	Anodyne	CYP3A4	50	40
N#Cc1ccc([C@H](O)CN[C@@H]2CCc3c[nH]nc3C2)cc1	ZINC000819156203	CD	On-Demand	Mild	ADRB3	19	40
N#Cc1ccc([C@H](O)CN[C@H]2CCc3c[nH]nc3C2)cc1	ZINC000819156205	CD	On-Demand	Mild	ADRB3	19	40
N#Cc1ccc([C@@H](O)CN[C@H]2CCc3c[nH]nc3C2)cc1	ZINC000819156208	CD	On-Demand	Mild	ADRB3	19	40
N#Cc1ccc([C@@H](O)CN[C@@H]2CCc3c[nH]nc3C2)cc1	ZINC000819156211	CD	On-Demand	Mild	ADRB3	19	40
CO[C@H]1CCC[C@@H]1NCCC(=O)Nc1ccccc1	ZINC000819156223	CE	On-Demand	Anodyne	HDAC10	20	40
CO[C@H]1CCC[C@@H]1NCCC(=O)Nc1ccccc1	ZINC000819156223	CE	On-Demand	Anodyne	HDAC11	23	40
C[C@@H](Cc1ccc(F)cc1)C(=O)NCCC(C)(C)C1CC1	ZINC000819156241	CH	On-Demand	Anodyne	ACE	18	40
C[C@@H](Cc1ccc(F)cc1)C(=O)NCCC(C)(C)C1CC1	ZINC000819156241	CH	On-Demand	Anodyne	MME	39	40
C[C@@H](Cc1ccc(F)cc1)C(=O)NCCC(C)(C)C1CC1	ZINC000819156241	CH	On-Demand	Anodyne	ACE2	48	37
C[C@@H](Cc1ccc(F)cc1)C(=O)NCCC(C)(C)C1CC1	ZINC000819156241	CH	On-Demand	Anodyne	LEF	46	33
CCOc1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819156250	ED	On-Demand	Anodyne	ADRB2	33	42
CCOc1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819156250	ED	On-Demand	Anodyne	ADRB1	50	38
CCOc1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819156251	ED	On-Demand	Anodyne	ADRB2	33	42
CCOc1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819156251	ED	On-Demand	Anodyne	ADRB1	50	38
CCOc1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819156252	ED	On-Demand	Anodyne	ADRB2	33	42
CCOc1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819156252	ED	On-Demand	Anodyne	ADRB1	50	38
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819156253	ED	On-Demand	Anodyne	ADRB2	33	42
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819156253	ED	On-Demand	Anodyne	ADRB1	50	38
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819156254	ED	On-Demand	Anodyne	ADRA1D	26	45
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819156254	ED	On-Demand	Anodyne	ADRA1A	21	50
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819156254	ED	On-Demand	Anodyne	ADRA1B	26	50
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819156255	ED	On-Demand	Anodyne	ADRA1D	26	45
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819156255	ED	On-Demand	Anodyne	ADRA1A	21	50
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819156255	ED	On-Demand	Anodyne	ADRA1B	26	50
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819156256	ED	On-Demand	Anodyne	ADRA1D	26	45
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819156256	ED	On-Demand	Anodyne	ADRA1A	21	50
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1COC(C)(C)O1	ZINC000819156256	ED	On-Demand	Anodyne	ADRA1B	26	50
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819156257	ED	On-Demand	Anodyne	ADRA1D	26	45
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819156257	ED	On-Demand	Anodyne	ADRA1A	21	50
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1COC(C)(C)O1	ZINC000819156257	ED	On-Demand	Anodyne	ADRA1B	26	50
O[C@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccc(C(F)(F)F)cc1	ZINC000819156276	GH	On-Demand	Anodyne	ADRB3	20	42
O[C@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccc(C(F)(F)F)cc1	ZINC000819156276	GH	On-Demand	Anodyne	TRPV1	34	47
O[C@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccc(C(F)(F)F)cc1	ZINC000819156277	GH	On-Demand	Anodyne	ADRB3	20	42
O[C@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccc(C(F)(F)F)cc1	ZINC000819156277	GH	On-Demand	Anodyne	TRPV1	34	47
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccc(C(F)(F)F)cc1	ZINC000819156278	GH	On-Demand	Anodyne	ADRB3	20	42
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1ccc(C(F)(F)F)cc1	ZINC000819156278	GH	On-Demand	Anodyne	TRPV1	34	47
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccc(C(F)(F)F)cc1	ZINC000819156279	GH	On-Demand	Anodyne	ADRB3	20	42
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1ccc(C(F)(F)F)cc1	ZINC000819156279	GH	On-Demand	Anodyne	TRPV1	34	47
C[C@]1(CNC[C@@H](O)c2cccnc2)CCCS1	ZINC000819156302	CD	On-Demand	Anodyne	ADRB2	23	41
C[C@]1(CNC[C@@H](O)c2cccnc2)CCCS1	ZINC000819156302	CD	On-Demand	Anodyne	ADRB1	24	40
C[C@]1(CNC[C@@H](O)c2cccnc2)CCCS1	ZINC000819156302	CD	On-Demand	Anodyne	ADRB3	94	44
C[C@@]1(CNC[C@@H](O)c2cccnc2)CCCS1	ZINC000819156303	CD	On-Demand	Anodyne	ADRB2	23	41
C[C@@]1(CNC[C@@H](O)c2cccnc2)CCCS1	ZINC000819156303	CD	On-Demand	Anodyne	ADRB1	24	40
C[C@@]1(CNC[C@@H](O)c2cccnc2)CCCS1	ZINC000819156303	CD	On-Demand	Anodyne	ADRB3	94	44
C[C@]1(CNC[C@H](O)c2cccnc2)CCCS1	ZINC000819156304	CD	On-Demand	Anodyne	ADRB2	23	41
C[C@]1(CNC[C@H](O)c2cccnc2)CCCS1	ZINC000819156304	CD	On-Demand	Anodyne	ADRB1	24	40
C[C@]1(CNC[C@H](O)c2cccnc2)CCCS1	ZINC000819156304	CD	On-Demand	Anodyne	ADRB3	94	44
C[C@@]1(CNC[C@H](O)c2cccnc2)CCCS1	ZINC000819156306	CD	On-Demand	Anodyne	ADRB2	23	41
C[C@@]1(CNC[C@H](O)c2cccnc2)CCCS1	ZINC000819156306	CD	On-Demand	Anodyne	ADRB1	24	40
C[C@@]1(CNC[C@H](O)c2cccnc2)CCCS1	ZINC000819156306	CD	On-Demand	Anodyne	ADRB3	94	44
O[C@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1cccc(Br)c1	ZINC000819156320	GG	On-Demand	Anodyne	ADRB3	30	41
O[C@@H](CN[C@H]1CCN(c2ncccc2Cl)C1)c1cccc(Br)c1	ZINC000819156322	GG	On-Demand	Anodyne	ADRB3	30	41
O[C@@H](CN[C@@H]1CCN(c2ncccc2Cl)C1)c1cccc(Br)c1	ZINC000819156323	GG	On-Demand	Anodyne	ADRB3	30	41
O=C(NC1CCCCC1)NC1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819156325	EG	On-Demand	Anodyne	EPHX2	45	56
C[C@@H]1CN(C2CC2)C[C@H]1NC[C@@H](O)c1ccccc1	ZINC000819156331	CD	On-Demand	Anodyne	SLC6A3	18	42
C[C@@H]1CN(C2CC2)C[C@@H]1NC[C@H](O)c1ccccc1	ZINC000819156332	CD	On-Demand	Anodyne	SLC6A3	18	42
C[C@@H]1CN(C2CC2)C[C@@H]1NC[C@@H](O)c1ccccc1	ZINC000819156335	CD	On-Demand	Anodyne	SLC6A3	18	42
C[C@@H]1CN(C2CC2)C[C@H]1NC[C@H](O)c1ccccc1	ZINC000819156339	CD	On-Demand	Anodyne	SLC6A3	18	42
C#CCCCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819156351	CF	On-Demand	Mild	ADRB2	54	58
C#CCCCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819156351	CF	On-Demand	Mild	ADRB1	71	45
C#CCCCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819156351	CF	On-Demand	Mild	ADRB3	42	45
C#CCCCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819156351	CF	On-Demand	Mild	CASR	42	38
C#CCCCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819156355	CF	On-Demand	Mild	ADRB2	54	58
C#CCCCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819156355	CF	On-Demand	Mild	ADRB1	71	45
C#CCCCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819156355	CF	On-Demand	Mild	ADRB3	42	45
C#CCCCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819156355	CF	On-Demand	Mild	CASR	42	38
O[C@H](CN[C@H]1CCc2c[nH]nc2C1)c1cccc(C(F)(F)F)c1	ZINC000819156370	EF	On-Demand	Anodyne	ADRB3	21	46
CN1CCN(C(=O)c2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cc2)CC1	ZINC000819156387	ED	On-Demand	Anodyne	MTOR	21	45
CN1CCN(C(=O)c2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cc2)CC1	ZINC000819156387	ED	On-Demand	Anodyne	L3MBTL3	64	43
CN1CCN(C(=O)c2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cc2)CC1	ZINC000819156390	ED	On-Demand	Anodyne	MTOR	21	45
CN1CCN(C(=O)c2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cc2)CC1	ZINC000819156390	ED	On-Demand	Anodyne	L3MBTL3	64	43
CN1CCN(C(=O)c2ccc(NC(=O)/C=C/[C@H]3CCCO3)cc2)CC1	ZINC000819156391	ED	On-Demand	Anodyne	MTOR	21	45
CN1CCN(C(=O)c2ccc(NC(=O)/C=C/[C@H]3CCCO3)cc2)CC1	ZINC000819156391	ED	On-Demand	Anodyne	L3MBTL3	64	43
CN1CCN(C(=O)c2ccc(NC(=O)/C=C\[C@H]3CCCO3)cc2)CC1	ZINC000819156394	ED	On-Demand	Anodyne	MTOR	21	45
CN1CCN(C(=O)c2ccc(NC(=O)/C=C\[C@H]3CCCO3)cc2)CC1	ZINC000819156394	ED	On-Demand	Anodyne	L3MBTL3	64	43
CC(C)(C)OC(=O)NCc1ccc(C(=O)NCCC(C)(C)C2CC2)cc1	ZINC000819156397	FI	On-Demand	Anodyne	GCGR	40	39
CC(C)(C)OC(=O)NCc1ccc(C(=O)NCCC(C)(C)C2CC2)cc1	ZINC000819156397	FI	On-Demand	Anodyne	GIPR	46	38
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)NCCCN3CCCCC3)ccc2Cl)cc1	ZINC000819156403	JI	On-Demand	Anodyne	HTR1A	15	43
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)NCCCN3CCCCC3)ccc2Cl)cc1	ZINC000819156403	JI	On-Demand	Anodyne	DRD2	24	41
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)NCCCN3CCCCC3)ccc2Cl)cc1	ZINC000819156403	JI	On-Demand	Anodyne	DRD4	47	38
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)NCCCN3CCCCC3)ccc2Cl)cc1	ZINC000819156403	JI	On-Demand	Anodyne	HRH2	38	43
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)NCCCN3CCCCC3)ccc2Cl)cc1	ZINC000819156403	JI	On-Demand	Anodyne	DRD3	50	43
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)NCCCN3CCCCC3)ccc2Cl)cc1	ZINC000819156403	JI	On-Demand	Anodyne	HRP1_PLAFA	36	43
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)NCCCN3CCCCC3)ccc2Cl)cc1	ZINC000819156403	JI	On-Demand	Anodyne	HRH3	51	45
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)NCCCN3CCCCC3)ccc2Cl)cc1	ZINC000819156403	JI	On-Demand	Anodyne	CHRNA7	20	42
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)NCCCN3CCCCC3)ccc2Cl)cc1	ZINC000819156403	JI	On-Demand	Anodyne	HNMT	64	36
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)NCCCN3CCCCC3)ccc2Cl)cc1	ZINC000819156403	JI	On-Demand	Anodyne	PTGDR	23	40
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)NCCCN3CCCCC3)ccc2Cl)cc1	ZINC000819156403	JI	On-Demand	Anodyne	PTGDR2	17	40
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)NCCCN3CCCCC3)ccc2Cl)cc1	ZINC000819156403	JI	On-Demand	Anodyne	CACNA1I	29	40
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)NCCCN3CCCCC3)ccc2Cl)cc1	ZINC000819156403	JI	On-Demand	Anodyne	BCL2	16	43
CCOc1ccc(NS(=O)(=O)c2cc(C(=O)NCCCN3CCCCC3)ccc2Cl)cc1	ZINC000819156403	JI	On-Demand	Anodyne	NOD2	24	40
O[C@@H](CN[C@@H]1CCc2c[nH]nc2C1)c1cccc(C(F)(F)F)c1	ZINC000819156460	EF	On-Demand	Anodyne	ADRB3	21	46
O[C@H](CN[C@@H]1CCc2c[nH]nc2C1)c1cccc(C(F)(F)F)c1	ZINC000819156462	EF	On-Demand	Anodyne	ADRB3	21	46
O[C@@H](CN[C@H]1CCc2c[nH]nc2C1)c1cccc(C(F)(F)F)c1	ZINC000819156464	EF	On-Demand	Anodyne	ADRB3	21	46
O[C@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccc(F)cc1	ZINC000819156473	CD	On-Demand	Anodyne	ADRB3	20	44
O[C@@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccc(F)cc1	ZINC000819156475	CD	On-Demand	Anodyne	ADRB3	20	44
O[C@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccc(F)cc1	ZINC000819156476	CD	On-Demand	Anodyne	ADRB3	20	44
O[C@@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccc(F)cc1	ZINC000819156478	CD	On-Demand	Anodyne	ADRB3	20	44
O[C@@H](CNCCCc1ccc2c(c1)OCCO2)c1cccc(Br)c1	ZINC000819156561	GG	On-Demand	Anodyne	ADRB2	40	36
O[C@@H](CNCCCc1ccc2c(c1)OCCO2)c1cccc(Br)c1	ZINC000819156561	GG	On-Demand	Anodyne	ADRB3	43	38
O[C@H](CNCCCc1ccc2c(c1)OCCO2)c1cccc(Br)c1	ZINC000819156569	GG	On-Demand	Anodyne	ADRB2	40	36
O[C@H](CNCCCc1ccc2c(c1)OCCO2)c1cccc(Br)c1	ZINC000819156569	GG	On-Demand	Anodyne	ADRB3	43	38
O=C(NCCNC(=O)c1ccc(F)cc1)C(F)=C1CCC1	ZINC000819156666	CE	On-Demand	Anodyne	BCHE	22	44
O=C(NCCNC(=O)c1ccc(F)cc1)C(F)=C1CCC1	ZINC000819156666	CE	On-Demand	Anodyne	PLD2	37	40
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)NCCC(C)(C)C1CC1)=NO2	ZINC000819156676	GG	On-Demand	Anodyne	GPR119	24	54
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819156681	DG	On-Demand	Anodyne	PAPA1_CARPA	39	46
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCC(C)(C)C1CC1	ZINC000819156681	DG	On-Demand	Anodyne	CTSK	17	43
Cc1ccccc1[C@@H](O)CNCCCc1ccc2c(c1)OCCO2	ZINC000819156694	EG	On-Demand	Anodyne	ADRB2	45	36
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2C(=O)NCCC(C)(C)C2CC2)CC1	ZINC000819156706	GI	On-Demand	Anodyne	GPR119	26	41
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156722	GE	On-Demand	Anodyne	ACE	51	41
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156722	GE	On-Demand	Anodyne	OPRM1	44	45
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156722	GE	On-Demand	Anodyne	OPRD1	38	45
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156722	GE	On-Demand	Anodyne	MME	45	37
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156722	GE	On-Demand	Anodyne	CMA1	53	38
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156722	GE	On-Demand	Anodyne	CTRA_BOVIN	47	40
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156722	GE	On-Demand	Anodyne	TRY1_BOVIN	50	36
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156722	GE	On-Demand	Anodyne	CYSP_TRYCR	48	37
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156722	GE	On-Demand	Anodyne	NPFFR2	47	32
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156722	GE	On-Demand	Anodyne	TIMP3	78	34
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156722	GE	On-Demand	Anodyne	CAPNS1	52	32
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156722	GE	On-Demand	Anodyne	CELA2A	52	38
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156722	GE	On-Demand	Anodyne	CAPN1	47	37
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156722	GE	On-Demand	Anodyne	ACE2	48	33
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156722	GE	On-Demand	Anodyne	CTRB_BOVIN	54	42
CCCCCCC(=O)NCCC(C)(C)C1CC1	ZINC000819156730	BH	On-Demand	Anodyne	CNR1	15	54
CCCCCCC(=O)NCCC(C)(C)C1CC1	ZINC000819156730	BH	On-Demand	Anodyne	LUXR	31	40
CCCCCCC(=O)NCCC(C)(C)C1CC1	ZINC000819156730	BH	On-Demand	Anodyne	LASR	59	40
CCCCCCC(=O)NCCC(C)(C)C1CC1	ZINC000819156730	BH	On-Demand	Anodyne	CQSS	52	32
Cn1nc(C(=O)NCCC(C)(C)C2CC2)c2ccccc2c1=O	ZINC000819156731	DE	On-Demand	Anodyne	HTR3A	24	43
C#CCNS(=O)(=O)c1cccc(C(=O)NCCC(C)(C)C2CC2)c1	ZINC000819156749	EE	On-Demand	Mild	DRD4	40	31
CNC(=O)NNC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819156808	FD	On-Demand	Reactive	CNR1	57	34
O[C@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccc(Br)cc1	ZINC000819156820	EE	On-Demand	Anodyne	ADRB3	19	42
O[C@@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccc(Br)cc1	ZINC000819156821	EE	On-Demand	Anodyne	ADRB3	19	42
O[C@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccc(Br)cc1	ZINC000819156822	EE	On-Demand	Anodyne	ADRB3	19	42
O[C@@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccc(Br)cc1	ZINC000819156823	EE	On-Demand	Anodyne	ADRB3	19	42
O[C@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccc(C(F)(F)F)cc1	ZINC000819156855	EF	On-Demand	Anodyne	ADRB3	19	56
O[C@@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccc(C(F)(F)F)cc1	ZINC000819156856	EF	On-Demand	Anodyne	ADRB3	19	56
O[C@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccc(C(F)(F)F)cc1	ZINC000819156858	EF	On-Demand	Anodyne	ADRB3	19	56
O[C@@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccc(C(F)(F)F)cc1	ZINC000819156861	EF	On-Demand	Anodyne	ADRB3	19	56
O[C@@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccc(OC(F)(F)F)cc1	ZINC000819156878	EE	On-Demand	Anodyne	ADRB3	21	43
O[C@H](CN[C@@H]1CCc2c[nH]nc2C1)c1ccc(OC(F)(F)F)cc1	ZINC000819156882	EE	On-Demand	Anodyne	ADRB3	21	43
CC(C)(C)OC(=O)N1CCC(CC(=O)NCCC(C)(C)C2CC2)CC1	ZINC000819156883	FH	On-Demand	Anodyne	GPR119	35	40
O[C@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccc(OC(F)(F)F)cc1	ZINC000819156884	EE	On-Demand	Anodyne	ADRB3	21	43
O[C@@H](CN[C@H]1CCc2c[nH]nc2C1)c1ccc(OC(F)(F)F)cc1	ZINC000819156891	EE	On-Demand	Anodyne	ADRB3	21	43
CC(C)(C)OC(=O)N1CCC(CCC(=O)NCCC(C)(C)C2CC2)CC1	ZINC000819156917	FI	On-Demand	Anodyne	GPR119	35	42
COc1cc(NC(=O)c2ccccc2)c(C(=O)NCCC(C)(C)C2CC2)cc1OC	ZINC000819156938	HJ	On-Demand	Anodyne	HTR1A	15	41
COc1cc(NC(=O)c2ccccc2)c(C(=O)NCCC(C)(C)C2CC2)cc1OC	ZINC000819156938	HJ	On-Demand	Anodyne	DRD2	31	44
COc1cc(NC(=O)c2ccccc2)c(C(=O)NCCC(C)(C)C2CC2)cc1OC	ZINC000819156938	HJ	On-Demand	Anodyne	DRD4	40	31
COc1cc(NC(=O)c2ccccc2)c(C(=O)NCCC(C)(C)C2CC2)cc1OC	ZINC000819156938	HJ	On-Demand	Anodyne	DRD3	50	44
COc1cc(NC(=O)c2ccccc2)c(C(=O)NCCC(C)(C)C2CC2)cc1OC	ZINC000819156938	HJ	On-Demand	Anodyne	KCNA3	41	41
COc1cc(NC(=O)c2ccccc2)c(C(=O)NCCC(C)(C)C2CC2)cc1OC	ZINC000819156938	HJ	On-Demand	Anodyne	NR1H4	15	42
COc1cc(NC(=O)c2ccccc2)c(C(=O)NCCC(C)(C)C2CC2)cc1OC	ZINC000819156938	HJ	On-Demand	Anodyne	HDAC1	16	40
COc1cc(NC(=O)c2ccccc2)c(C(=O)NCCC(C)(C)C2CC2)cc1OC	ZINC000819156938	HJ	On-Demand	Anodyne	HDAC2	21	40
COc1cc(NC(=O)c2ccccc2)c(C(=O)NCCC(C)(C)C2CC2)cc1OC	ZINC000819156938	HJ	On-Demand	Anodyne	KCNK3	45	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(CN3CCOCC3)c1)C2	ZINC000819156965	GE	On-Demand	Anodyne	CASR	22	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(CN3CCOCC3)c1)C2	ZINC000819156965	GE	On-Demand	Anodyne	EPHX2	23	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(CN3CCOCC3)c1)C2	ZINC000819156966	GE	On-Demand	Anodyne	CASR	22	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(CN3CCOCC3)c1)C2	ZINC000819156966	GE	On-Demand	Anodyne	EPHX2	23	41
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156971	GE	On-Demand	Anodyne	ACE	51	41
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156971	GE	On-Demand	Anodyne	OPRM1	44	45
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156971	GE	On-Demand	Anodyne	OPRD1	38	45
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156971	GE	On-Demand	Anodyne	MME	45	37
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156971	GE	On-Demand	Anodyne	CMA1	53	38
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156971	GE	On-Demand	Anodyne	CTRA_BOVIN	47	40
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156971	GE	On-Demand	Anodyne	TRY1_BOVIN	50	36
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156971	GE	On-Demand	Anodyne	CYSP_TRYCR	48	37
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156971	GE	On-Demand	Anodyne	NPFFR2	47	32
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156971	GE	On-Demand	Anodyne	TIMP3	78	34
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156971	GE	On-Demand	Anodyne	CAPNS1	52	32
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156971	GE	On-Demand	Anodyne	CELA2A	52	38
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156971	GE	On-Demand	Anodyne	CAPN1	47	37
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156971	GE	On-Demand	Anodyne	ACE2	48	33
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819156971	GE	On-Demand	Anodyne	CTRB_BOVIN	54	42
O[C@@H](CNCCCc1ccc2c(c1)OCCO2)c1cccc(F)c1	ZINC000819156977	EF	On-Demand	Anodyne	ADRB2	40	35
O[C@@H](CNCCCc1ccc2c(c1)OCCO2)c1cccc(F)c1	ZINC000819156977	EF	On-Demand	Anodyne	ADRB1	35	42
O[C@@H](CNCCCc1ccc2c(c1)OCCO2)c1cccc(F)c1	ZINC000819156977	EF	On-Demand	Anodyne	ADRB3	47	42
O[C@H](CNCCCc1ccc2c(c1)OCCO2)c1cccc(F)c1	ZINC000819156978	EF	On-Demand	Anodyne	ADRB2	40	35
O[C@H](CNCCCc1ccc2c(c1)OCCO2)c1cccc(F)c1	ZINC000819156978	EF	On-Demand	Anodyne	ADRB1	35	42
O[C@H](CNCCCc1ccc2c(c1)OCCO2)c1cccc(F)c1	ZINC000819156978	EF	On-Demand	Anodyne	ADRB3	47	42
C#CCCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819156980	CF	On-Demand	Mild	ADRB2	49	44
C#CCCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819156980	CF	On-Demand	Mild	ADRB1	56	50
C#CCCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819156980	CF	On-Demand	Mild	ADRB3	62	50
C#CCCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819156981	CF	On-Demand	Mild	ADRB2	49	44
C#CCCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819156981	CF	On-Demand	Mild	ADRB1	56	50
C#CCCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819156981	CF	On-Demand	Mild	ADRB3	62	50
C#CCCCCNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819156982	CE	On-Demand	Mild	ADRB2	51	47
C#CCCCCNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819156982	CE	On-Demand	Mild	ADRB1	82	46
C#CCCCCNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819156982	CE	On-Demand	Mild	ADRB3	48	46
C#CCCCCNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819156982	CE	On-Demand	Mild	ABCB1	15	60
C#CCCCCNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819156983	CE	On-Demand	Mild	ADRB2	51	47
C#CCCCCNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819156983	CE	On-Demand	Mild	ADRB1	82	46
C#CCCCCNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819156983	CE	On-Demand	Mild	ADRB3	48	46
C#CCCCCNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819156983	CE	On-Demand	Mild	ABCB1	15	60
C#CCCCCNC[C@@H](O)COc1ccc(Cl)cc1Br	ZINC000819156985	FG	On-Demand	Mild	ADRB2	16	40
C#CCCCCNC[C@H](O)COc1ccc(Cl)cc1Br	ZINC000819156987	FG	On-Demand	Mild	ADRB2	16	40
C=C(Cl)CSc1nc(C)c(CC(=O)N2CCC[C@H]2c2ccccn2)s1	ZINC000819156988	GJ	On-Demand	Mild	CPT1A	81	39
C=C(Cl)CSc1nc(C)c(CC(=O)N2CCC[C@@H]2c2ccccn2)s1	ZINC000819156989	GJ	On-Demand	Mild	CPT1A	81	39
C#CCCCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819156991	DG	On-Demand	Mild	ADRB2	63	49
C#CCCCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819156991	DG	On-Demand	Mild	ADRB1	96	49
C#CCCCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819156991	DG	On-Demand	Mild	ADRB3	63	49
C#CCCCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819156992	DG	On-Demand	Mild	ADRB2	63	49
C#CCCCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819156992	DG	On-Demand	Mild	ADRB1	96	49
C#CCCCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819156992	DG	On-Demand	Mild	ADRB3	63	49
O[C@@H](CNCCCc1ccc2c(c1)OCCO2)c1ccccc1	ZINC000819156993	DF	On-Demand	Anodyne	ADRB2	55	42
O[C@@H](CNCCCc1ccc2c(c1)OCCO2)c1ccccc1	ZINC000819156993	DF	On-Demand	Anodyne	ADRB1	54	40
O[C@@H](CNCCCc1ccc2c(c1)OCCO2)c1ccccc1	ZINC000819156993	DF	On-Demand	Anodyne	ADRB3	76	41
O[C@H](CNCCCc1ccc2c(c1)OCCO2)c1ccccc1	ZINC000819156994	DF	On-Demand	Anodyne	ADRB2	55	42
O[C@H](CNCCCc1ccc2c(c1)OCCO2)c1ccccc1	ZINC000819156994	DF	On-Demand	Anodyne	ADRB1	54	40
O[C@H](CNCCCc1ccc2c(c1)OCCO2)c1ccccc1	ZINC000819156994	DF	On-Demand	Anodyne	ADRB3	76	41
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1Cc2ccccc2C1	ZINC000819157011	FG	On-Demand	Mild	PAPA1_CARPA	54	46
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1Cc2ccccc2C1	ZINC000819157011	FG	On-Demand	Mild	CTSK	24	40
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1Cc2ccccc2C1	ZINC000819157011	FG	On-Demand	Mild	CTSL	15	46
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1Cc2ccccc2C1	ZINC000819157011	FG	On-Demand	Mild	FPR1	45	37
C#CCCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819157073	CF	On-Demand	Mild	ADRB2	20	42
C#CCCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819157073	CF	On-Demand	Mild	ADRB1	20	42
C#CCCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819157073	CF	On-Demand	Mild	ADRB3	18	42
C#CCCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819157074	CF	On-Demand	Mild	ADRB2	20	42
C#CCCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819157074	CF	On-Demand	Mild	ADRB1	20	42
C#CCCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819157074	CF	On-Demand	Mild	ADRB3	18	42
C#CCCCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819157081	DF	On-Demand	Mild	ADRB2	33	42
C#CCCCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819157081	DF	On-Demand	Mild	ADRB1	44	43
C#CCCCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819157081	DF	On-Demand	Mild	PDS	47	40
C#CCCCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819157082	DF	On-Demand	Mild	ADRB2	33	42
C#CCCCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819157082	DF	On-Demand	Mild	ADRB1	44	43
C#CCCCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819157082	DF	On-Demand	Mild	PDS	47	40
C#CCCCCNCCC(=O)Nc1ccc(Cl)cc1	ZINC000819157092	CG	On-Demand	Mild	AGPAT2	18	43
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(CN2CCOCC2)c1	ZINC000819157121	DE	On-Demand	Anodyne	MCHR1	20	40
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(CN2CCOCC2)c1	ZINC000819157122	DE	On-Demand	Anodyne	MCHR1	20	40
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(CN2CCOCC2)c1	ZINC000819157123	DE	On-Demand	Anodyne	MCHR1	20	40
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(CN2CCOCC2)c1	ZINC000819157124	DE	On-Demand	Anodyne	MCHR1	20	40
Cn1nc2c(c1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCC2	ZINC000819157129	FE	On-Demand	Mild	PAPA1_CARPA	34	42
Cn1nc2c(c1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCC2	ZINC000819157130	FE	On-Demand	Mild	PAPA1_CARPA	34	42
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2ccc3c(c2)OCCO3)cc1	ZINC000819157194	GE	On-Demand	Anodyne	ADRB2	40	49
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2ccc3c(c2)OCCO3)cc1	ZINC000819157194	GE	On-Demand	Anodyne	ADRB1	34	40
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2ccc3c(c2)OCCO3)cc1	ZINC000819157194	GE	On-Demand	Anodyne	ADRB3	75	39
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2ccc3c(c2)OCCO3)cc1	ZINC000819157195	GE	On-Demand	Anodyne	ADRB2	40	49
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2ccc3c(c2)OCCO3)cc1	ZINC000819157195	GE	On-Demand	Anodyne	ADRB1	34	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2ccc3c(c2)OCCO3)cc1	ZINC000819157195	GE	On-Demand	Anodyne	ADRB3	75	39
C#CCCCCNC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819157200	CF	On-Demand	Mild	ADRB2	24	47
C#CCCCCNC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819157200	CF	On-Demand	Mild	ADRB1	42	36
C#CCCCCNC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819157201	CF	On-Demand	Mild	ADRB2	24	47
C#CCCCCNC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819157201	CF	On-Demand	Mild	ADRB1	42	36
C#CCCCCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819157206	CD	On-Demand	Mild	ADRB2	35	46
C#CCCCCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819157206	CD	On-Demand	Mild	ADRB1	64	42
C#CCCCCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819157206	CD	On-Demand	Mild	ADRB3	23	43
C#CCCCCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819157207	CD	On-Demand	Mild	ADRB2	35	46
C#CCCCCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819157207	CD	On-Demand	Mild	ADRB1	64	42
C#CCCCCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819157207	CD	On-Demand	Mild	ADRB3	23	43
C#CCCCCNC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819157208	CD	On-Demand	Mild	ADRB1	46	39
C#CCCCCNC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819157209	CD	On-Demand	Mild	ADRB1	46	39
C#CCCCCNCCC(=O)Nc1ccccc1	ZINC000819157215	BE	On-Demand	Mild	LTA4H	23	40
C#CCCCCNCCC(=O)Nc1ccccc1	ZINC000819157215	BE	On-Demand	Mild	HDAC10	21	48
C#CCCCCNCCC(=O)Nc1ccccc1	ZINC000819157215	BE	On-Demand	Mild	HDAC2	17	48
C#CCCCCNCCC(=O)Nc1ccccc1	ZINC000819157215	BE	On-Demand	Mild	HDAC3	17	48
C#CCCCCNCCC(=O)Nc1ccccc1	ZINC000819157215	BE	On-Demand	Mild	HDAC6	16	48
C#CCCCCNCCC(=O)Nc1cccc(Cl)c1	ZINC000819157220	CG	On-Demand	Mild	AGPAT2	23	43
C#CCCCCNCCC(=O)Nc1cccc(Cl)c1	ZINC000819157220	CG	On-Demand	Mild	KCNK3	21	40
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H]1c1ccccn1	ZINC000819157221	CE	On-Demand	Anodyne	CPT1A	54	36
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H]1c1ccccn1	ZINC000819157222	CE	On-Demand	Anodyne	CPT1A	54	36
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H]1c1ccccn1	ZINC000819157223	CE	On-Demand	Anodyne	CPT1A	54	36
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H]1c1ccccn1	ZINC000819157224	CE	On-Demand	Anodyne	CPT1A	54	36
O=C(/C=C/[C@H]1CCCO1)N1CCCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000819157227	FF	On-Demand	Anodyne	HRH3	24	41
O=C(/C=C/[C@H]1CCCO1)N1CCCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000819157227	FF	On-Demand	Anodyne	L3MBTL3	43	41
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000819157228	FF	On-Demand	Anodyne	HRH3	24	41
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000819157228	FF	On-Demand	Anodyne	L3MBTL3	43	41
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000819157229	FF	On-Demand	Anodyne	HRH3	24	41
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000819157229	FF	On-Demand	Anodyne	L3MBTL3	43	41
O=C(/C=C\[C@H]1CCCO1)N1CCCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000819157230	FF	On-Demand	Anodyne	HRH3	24	41
O=C(/C=C\[C@H]1CCCO1)N1CCCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000819157230	FF	On-Demand	Anodyne	L3MBTL3	43	41
O[C@@H](CNCCCc1ccc2c(c1)OCCO2)c1cccnc1	ZINC000819157231	DE	On-Demand	Anodyne	ADRB2	47	49
O[C@@H](CNCCCc1ccc2c(c1)OCCO2)c1cccnc1	ZINC000819157231	DE	On-Demand	Anodyne	ADRB1	54	45
O[C@@H](CNCCCc1ccc2c(c1)OCCO2)c1cccnc1	ZINC000819157231	DE	On-Demand	Anodyne	ADRB3	132	49
O[C@@H](CNCCCc1ccc2c(c1)OCCO2)c1cccnc1	ZINC000819157231	DE	On-Demand	Anodyne	CYP51A1	18	44
O[C@H](CNCCCc1ccc2c(c1)OCCO2)c1cccnc1	ZINC000819157232	DE	On-Demand	Anodyne	ADRB2	47	49
O[C@H](CNCCCc1ccc2c(c1)OCCO2)c1cccnc1	ZINC000819157232	DE	On-Demand	Anodyne	ADRB1	54	45
O[C@H](CNCCCc1ccc2c(c1)OCCO2)c1cccnc1	ZINC000819157232	DE	On-Demand	Anodyne	ADRB3	132	49
O[C@H](CNCCCc1ccc2c(c1)OCCO2)c1cccnc1	ZINC000819157232	DE	On-Demand	Anodyne	CYP51A1	18	44
C#CCCCCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819157239	DG	On-Demand	Mild	ADRB2	51	47
C#CCCCCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819157239	DG	On-Demand	Mild	ADRB1	68	47
C#CCCCCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819157239	DG	On-Demand	Mild	ADRB3	39	47
C#CCCCCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819157240	DG	On-Demand	Mild	ADRB2	51	47
C#CCCCCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819157240	DG	On-Demand	Mild	ADRB1	68	47
C#CCCCCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819157240	DG	On-Demand	Mild	ADRB3	39	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(C)(C)[C@@H]2CCCCO2)CC1	ZINC000819157241	GG	On-Demand	Anodyne	GPR119	19	40
C[C@H](C[C@@H]1CCOC1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819157248	FE	On-Demand	Anodyne	GPR119	23	40
C[C@H](C[C@@H]1CCOC1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819157250	FE	On-Demand	Anodyne	GPR119	23	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccc(OCC(C)C)c1)C2	ZINC000819157269	FG	On-Demand	Anodyne	PDS	63	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccc(OCC(C)C)c1)C2	ZINC000819157270	FG	On-Demand	Anodyne	PDS	63	36
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)c1	ZINC000819157304	DD	On-Demand	Anodyne	ADRB2	24	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)c1	ZINC000819157304	DD	On-Demand	Anodyne	ADRB1	43	38
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)c1	ZINC000819157304	DD	On-Demand	Anodyne	ABCB1	21	48
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)c1	ZINC000819157305	DD	On-Demand	Anodyne	ADRB2	24	45
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)c1	ZINC000819157305	DD	On-Demand	Anodyne	ADRB1	43	38
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)c1	ZINC000819157305	DD	On-Demand	Anodyne	ABCB1	21	48
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)c1	ZINC000819157306	DD	On-Demand	Anodyne	ADRB2	24	45
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)c1	ZINC000819157306	DD	On-Demand	Anodyne	ADRB1	43	38
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)c1	ZINC000819157306	DD	On-Demand	Anodyne	ABCB1	21	48
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)c1	ZINC000819157307	DD	On-Demand	Anodyne	ADRB2	24	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)c1	ZINC000819157307	DD	On-Demand	Anodyne	ADRB1	43	38
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)c1	ZINC000819157307	DD	On-Demand	Anodyne	ABCB1	21	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H](Cc1ccc(F)cc1)C(N)=O	ZINC000819157338	GD	On-Demand	Anodyne	PAPA1_CARPA	28	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H](Cc1ccc(F)cc1)C(N)=O	ZINC000819157339	GD	On-Demand	Anodyne	PAPA1_CARPA	28	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(C)(C)[C@H]2CCCCO2)CC1	ZINC000819157342	GG	On-Demand	Anodyne	GPR119	19	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(C)(C)[C@@H]2CCCCO2)CC1	ZINC000819157343	GG	On-Demand	Anodyne	GPR119	19	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(C)(C)[C@H]2CCCCO2)CC1	ZINC000819157344	GG	On-Demand	Anodyne	GPR119	19	40
C#CCCCCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819157347	CD	On-Demand	Mild	ADRB2	46	49
C#CCCCCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819157347	CD	On-Demand	Mild	ADRB1	77	49
C#CCCCCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819157347	CD	On-Demand	Mild	ADRB3	46	49
C#CCCCCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819157348	CD	On-Demand	Mild	ADRB2	46	49
C#CCCCCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819157348	CD	On-Demand	Mild	ADRB1	77	49
C#CCCCCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819157348	CD	On-Demand	Mild	ADRB3	46	49
C#CCCCCNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819157367	DG	On-Demand	Mild	KCNK3	15	43
CN(C)c1ccc(NC(=O)CCNCCCc2ccc3c(c2)OCCO3)cc1	ZINC000819157378	GG	On-Demand	Anodyne	NOS2	49	32
C#CCCCCNCCC(=O)Nc1cccnc1	ZINC000819157380	BD	On-Demand	Mild	NAMPT	18	41
C#CCCCCNCCC(=O)Nc1cccc(Br)c1	ZINC000819157381	DG	On-Demand	Mild	EGFR	22	40
C#CCCCCNCCC(=O)Nc1cccc(Br)c1	ZINC000819157381	DG	On-Demand	Mild	HDAC2	17	42
C#CCCCCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819157388	DD	On-Demand	Mild	ADRB1	42	38
C#CCCCCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819157388	DD	On-Demand	Mild	ADRB3	24	40
C#CCCCCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819157389	DD	On-Demand	Mild	ADRB1	42	38
C#CCCCCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819157389	DD	On-Demand	Mild	ADRB3	24	40
O=C(C(F)=C1CCC1)N1CCCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000819157406	FG	On-Demand	Anodyne	MLYCD	19	43
O=C(C(F)=C1CCC1)N1CCCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000819157406	FG	On-Demand	Anodyne	L3MBTL3	47	39
C#CCCCCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819157423	DD	On-Demand	Mild	ADRB2	56	61
C#CCCCCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819157423	DD	On-Demand	Mild	ADRB1	97	61
C#CCCCCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819157423	DD	On-Demand	Mild	GRIN1	21	44
C#CCCCCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819157423	DD	On-Demand	Mild	ADRB3	59	61
C#CCCCCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819157424	DD	On-Demand	Mild	ADRB2	56	61
C#CCCCCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819157424	DD	On-Demand	Mild	ADRB1	97	61
C#CCCCCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819157424	DD	On-Demand	Mild	GRIN1	21	44
C#CCCCCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819157424	DD	On-Demand	Mild	ADRB3	59	61
C#CCCCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819157426	CF	On-Demand	Mild	ADRB2	42	60
C#CCCCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819157426	CF	On-Demand	Mild	ADRB1	63	40
C#CCCCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819157426	CF	On-Demand	Mild	ADRB3	26	58
C#CCCCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819157426	CF	On-Demand	Mild	CASR	40	37
C#CCCCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819157426	CF	On-Demand	Mild	CYP2D6	20	45
C#CCCCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819157426	CF	On-Demand	Mild	ABCB1	16	44
C#CCCCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819157427	CF	On-Demand	Mild	ADRB2	42	60
C#CCCCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819157427	CF	On-Demand	Mild	ADRB1	63	40
C#CCCCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819157427	CF	On-Demand	Mild	ADRB3	26	58
C#CCCCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819157427	CF	On-Demand	Mild	CASR	40	37
C#CCCCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819157427	CF	On-Demand	Mild	CYP2D6	20	45
C#CCCCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819157427	CF	On-Demand	Mild	ABCB1	16	44
C#CCCCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819157430	DF	On-Demand	Mild	ADRB2	36	46
C#CCCCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819157430	DF	On-Demand	Mild	ADRB1	66	40
C#CCCCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819157430	DF	On-Demand	Mild	ADRB3	19	40
C#CCCCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819157431	DF	On-Demand	Mild	ADRB2	36	46
C#CCCCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819157431	DF	On-Demand	Mild	ADRB1	66	40
C#CCCCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819157431	DF	On-Demand	Mild	ADRB3	19	40
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1cccnc1	ZINC000819157457	EG	On-Demand	Anodyne	ADRB2	38	45
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1cccnc1	ZINC000819157457	EG	On-Demand	Anodyne	ADRB1	36	56
C[C@@H](Cc1ccccc1Br)NC[C@@H](O)c1cccnc1	ZINC000819157457	EG	On-Demand	Anodyne	ADRB3	75	56
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1cccnc1	ZINC000819157458	EG	On-Demand	Anodyne	ADRB2	38	45
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1cccnc1	ZINC000819157458	EG	On-Demand	Anodyne	ADRB1	36	56
C[C@@H](Cc1ccccc1Br)NC[C@H](O)c1cccnc1	ZINC000819157458	EG	On-Demand	Anodyne	ADRB3	75	56
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1cccnc1	ZINC000819157459	EG	On-Demand	Anodyne	ADRB2	38	45
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1cccnc1	ZINC000819157459	EG	On-Demand	Anodyne	ADRB1	36	56
C[C@H](Cc1ccccc1Br)NC[C@@H](O)c1cccnc1	ZINC000819157459	EG	On-Demand	Anodyne	ADRB3	75	56
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1cccnc1	ZINC000819157460	EG	On-Demand	Anodyne	ADRB2	38	45
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1cccnc1	ZINC000819157460	EG	On-Demand	Anodyne	ADRB1	36	56
C[C@H](Cc1ccccc1Br)NC[C@H](O)c1cccnc1	ZINC000819157460	EG	On-Demand	Anodyne	ADRB3	75	56
COC(=O)N(C)c1ccc(NC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819157596	GI	On-Demand	Anodyne	LTA4H	31	41
COC(=O)N(C)c1ccc(NC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819157596	GI	On-Demand	Anodyne	MTNR1A	17	47
COC(=O)N(C)c1ccc(NC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819157596	GI	On-Demand	Anodyne	MTNR1B	23	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(CN2CCOCC2)c1	ZINC000819157599	GE	On-Demand	Anodyne	HRH2	30	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(CN2CCOCC2)c1	ZINC000819157599	GE	On-Demand	Anodyne	CASR	21	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(CN2CCOCC2)c1	ZINC000819157599	GE	On-Demand	Anodyne	EPHX2	26	40
Cc1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819157616	CD	On-Demand	Anodyne	ADRB2	33	48
Cc1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819157616	CD	On-Demand	Anodyne	ADRB1	49	41
Cc1ccc(OC[C@@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819157616	CD	On-Demand	Anodyne	ADRB3	26	41
Cc1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819157617	CD	On-Demand	Anodyne	ADRB2	33	48
Cc1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819157617	CD	On-Demand	Anodyne	ADRB1	49	41
Cc1ccc(OC[C@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819157617	CD	On-Demand	Anodyne	ADRB3	26	41
Cc1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819157618	CD	On-Demand	Anodyne	ADRB2	33	48
Cc1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819157618	CD	On-Demand	Anodyne	ADRB1	49	41
Cc1ccc(OC[C@H](O)CNC[C@@H]2COC(C)(C)O2)cc1	ZINC000819157618	CD	On-Demand	Anodyne	ADRB3	26	41
Cc1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819157619	CD	On-Demand	Anodyne	ADRB2	33	48
Cc1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819157619	CD	On-Demand	Anodyne	ADRB1	49	41
Cc1ccc(OC[C@@H](O)CNC[C@H]2COC(C)(C)O2)cc1	ZINC000819157619	CD	On-Demand	Anodyne	ADRB3	26	41
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000819157637	FF	On-Demand	Anodyne	L3MBTL3	70	42
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000819157638	FF	On-Demand	Anodyne	L3MBTL3	70	42
O=C(/C=C/[C@H]1CCCO1)N1CCCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000819157639	FF	On-Demand	Anodyne	L3MBTL3	70	42
O=C(/C=C\[C@H]1CCCO1)N1CCCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000819157640	FF	On-Demand	Anodyne	L3MBTL3	70	42
COc1c(Cl)cccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819157641	GH	On-Demand	Mild	PAPA1_CARPA	47	46
COc1c(Cl)cccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819157641	GH	On-Demand	Mild	CTSL	16	46
COc1c(Cl)cccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819157641	GH	On-Demand	Mild	FPR1	40	37
COc1c(Cl)cccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819157642	GH	On-Demand	Mild	PAPA1_CARPA	47	46
COc1c(Cl)cccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819157642	GH	On-Demand	Mild	CTSL	16	46
COc1c(Cl)cccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819157642	GH	On-Demand	Mild	FPR1	40	37
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819157693	FD	On-Demand	Anodyne	TGM2	66	41
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819157693	FD	On-Demand	Anodyne	F13A1	72	41
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819157693	FD	On-Demand	Anodyne	AKR1C3	23	40
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819157694	FD	On-Demand	Anodyne	TGM2	66	41
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819157694	FD	On-Demand	Anodyne	F13A1	72	41
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819157694	FD	On-Demand	Anodyne	AKR1C3	23	40
O=C(/C=C\[C@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819157695	FD	On-Demand	Anodyne	TGM2	66	41
O=C(/C=C\[C@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819157695	FD	On-Demand	Anodyne	F13A1	72	41
O=C(/C=C\[C@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819157695	FD	On-Demand	Anodyne	AKR1C3	23	40
O=C(/C=C/[C@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819157696	FD	On-Demand	Anodyne	TGM2	66	41
O=C(/C=C/[C@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819157696	FD	On-Demand	Anodyne	F13A1	72	41
O=C(/C=C/[C@H]1CCCO1)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819157696	FD	On-Demand	Anodyne	AKR1C3	23	40
COc1ccc2[nH]cc(C3CCN(C(=O)/C=C/[C@H]4CCCO4)CC3)c2c1	ZINC000819157705	FH	On-Demand	Anodyne	HTR1D	33	43
COc1ccc2[nH]cc(C3CCN(C(=O)/C=C/[C@H]4CCCO4)CC3)c2c1	ZINC000819157705	FH	On-Demand	Anodyne	HTR1B	30	43
COc1ccc2[nH]cc(C3CCN(C(=O)/C=C/[C@H]4CCCO4)CC3)c2c1	ZINC000819157705	FH	On-Demand	Anodyne	HTR1F	77	42
COc1ccc2[nH]cc(C3CCN(C(=O)/C=C/[C@H]4CCCO4)CC3)c2c1	ZINC000819157705	FH	On-Demand	Anodyne	CCR2	31	56
COc1ccc2[nH]cc(C3CCN(C(=O)/C=C\[C@H]4CCCO4)CC3)c2c1	ZINC000819157706	FH	On-Demand	Anodyne	HTR1D	33	43
COc1ccc2[nH]cc(C3CCN(C(=O)/C=C\[C@H]4CCCO4)CC3)c2c1	ZINC000819157706	FH	On-Demand	Anodyne	HTR1B	30	43
COc1ccc2[nH]cc(C3CCN(C(=O)/C=C\[C@H]4CCCO4)CC3)c2c1	ZINC000819157706	FH	On-Demand	Anodyne	HTR1F	77	42
COc1ccc2[nH]cc(C3CCN(C(=O)/C=C\[C@H]4CCCO4)CC3)c2c1	ZINC000819157706	FH	On-Demand	Anodyne	CCR2	31	56
COc1ccc2[nH]cc(C3CCN(C(=O)/C=C\[C@@H]4CCCO4)CC3)c2c1	ZINC000819157707	FH	On-Demand	Anodyne	HTR1D	33	43
COc1ccc2[nH]cc(C3CCN(C(=O)/C=C\[C@@H]4CCCO4)CC3)c2c1	ZINC000819157707	FH	On-Demand	Anodyne	HTR1B	30	43
COc1ccc2[nH]cc(C3CCN(C(=O)/C=C\[C@@H]4CCCO4)CC3)c2c1	ZINC000819157707	FH	On-Demand	Anodyne	HTR1F	77	42
COc1ccc2[nH]cc(C3CCN(C(=O)/C=C\[C@@H]4CCCO4)CC3)c2c1	ZINC000819157707	FH	On-Demand	Anodyne	CCR2	31	56
COc1ccc2[nH]cc(C3CCN(C(=O)/C=C/[C@@H]4CCCO4)CC3)c2c1	ZINC000819157708	FH	On-Demand	Anodyne	HTR1D	33	43
COc1ccc2[nH]cc(C3CCN(C(=O)/C=C/[C@@H]4CCCO4)CC3)c2c1	ZINC000819157708	FH	On-Demand	Anodyne	HTR1B	30	43
COc1ccc2[nH]cc(C3CCN(C(=O)/C=C/[C@@H]4CCCO4)CC3)c2c1	ZINC000819157708	FH	On-Demand	Anodyne	HTR1F	77	42
COc1ccc2[nH]cc(C3CCN(C(=O)/C=C/[C@@H]4CCCO4)CC3)c2c1	ZINC000819157708	FH	On-Demand	Anodyne	CCR2	31	56
O=C(C(F)=C1CCC1)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819157718	FE	On-Demand	Anodyne	TGM2	54	38
O=C(C(F)=C1CCC1)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819157718	FE	On-Demand	Anodyne	F13A1	65	42
O=C(C(F)=C1CCC1)N1CCCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819157718	FE	On-Demand	Anodyne	AKR1C3	52	37
O=C(C(F)=C1CCC1)N1CCC[C@@H]1c1ccccn1	ZINC000819157723	CG	On-Demand	Anodyne	CPT1A	51	39
O=C(C(F)=C1CCC1)N1CCC[C@H]1c1ccccn1	ZINC000819157724	CG	On-Demand	Anodyne	CPT1A	51	39
COc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2cccnc12	ZINC000819157727	GH	On-Demand	Mild	PAPA1_CARPA	42	42
COc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2cccnc12	ZINC000819157727	GH	On-Demand	Mild	CCKAR	42	38
C#CCCCCNC[C@H](O)COc1ccccc1C(C)C	ZINC000819157753	CF	On-Demand	Mild	ADRB2	46	49
C#CCCCCNC[C@H](O)COc1ccccc1C(C)C	ZINC000819157753	CF	On-Demand	Mild	ADRB1	62	38
C#CCCCCNC[C@H](O)COc1ccccc1C(C)C	ZINC000819157753	CF	On-Demand	Mild	ADRB3	21	43
C#CCCCCNC[C@H](O)COc1ccccc1C(C)C	ZINC000819157753	CF	On-Demand	Mild	ABCB1	20	48
C#CCCCCNC[C@@H](O)COc1ccccc1C(C)C	ZINC000819157754	CF	On-Demand	Mild	ADRB2	46	49
C#CCCCCNC[C@@H](O)COc1ccccc1C(C)C	ZINC000819157754	CF	On-Demand	Mild	ADRB1	62	38
C#CCCCCNC[C@@H](O)COc1ccccc1C(C)C	ZINC000819157754	CF	On-Demand	Mild	ADRB3	21	43
C#CCCCCNC[C@@H](O)COc1ccccc1C(C)C	ZINC000819157754	CF	On-Demand	Mild	ABCB1	20	48
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	ACE	63	39
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	OPRM1	29	42
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	OPRD1	24	42
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	CELA1	23	40
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	MME	112	41
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	ANPEP	57	35
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	TACR1	20	45
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	CTRA_BOVIN	25	45
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	FCER2	48	33
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	CTSB	63	40
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	PAPA1_CARPA	69	43
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	CYSP_TRYCR	54	40
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	CTSK	34	40
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	CTSL	52	40
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	TIMP3	82	37
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	CAPNS1	79	40
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	GRIA1	41	33
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	HLA-DRB1	83	41
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	CTSS	29	40
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	CAPN1	89	40
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	CAPN2	94	40
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	ACE2	83	39
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	MMP1	20	40
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	FPR1	62	36
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	CTRB_BOVIN	57	44
CCOC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819157769	DF	On-Demand	Anodyne	NPR	38	41
C#CCCCCNC[C@@H](O)c1cccnc1	ZINC000819157776	BD	On-Demand	Mild	ADRB2	27	47
C#CCCCCNC[C@@H](O)c1cccnc1	ZINC000819157776	BD	On-Demand	Mild	ADRB1	32	46
C#CCCCCNC[C@@H](O)c1cccnc1	ZINC000819157776	BD	On-Demand	Mild	ADRB3	106	47
C#CCCCCNC[C@H](O)c1cccnc1	ZINC000819157777	BD	On-Demand	Mild	ADRB2	27	47
C#CCCCCNC[C@H](O)c1cccnc1	ZINC000819157777	BD	On-Demand	Mild	ADRB1	32	46
C#CCCCCNC[C@H](O)c1cccnc1	ZINC000819157777	BD	On-Demand	Mild	ADRB3	106	47
C#CCCCCNC[C@H](O)c1ccc(C)cc1	ZINC000819157786	BE	On-Demand	Mild	ADRB2	21	42
C#CCCCCNC[C@@H](O)c1ccc(C)cc1	ZINC000819157787	BE	On-Demand	Mild	ADRB2	21	42
O[C@H](CN[C@H](c1cccc(F)c1)c1cccc(Cl)c1)C1CC1	ZINC000819157807	DH	On-Demand	Anodyne	SLC6A2	15	41
O[C@H](CN[C@@H](c1cccc(F)c1)c1cccc(Cl)c1)C1CC1	ZINC000819157808	DH	On-Demand	Anodyne	SLC6A2	15	41
O[C@@H](CN[C@H](c1cccc(F)c1)c1cccc(Cl)c1)C1CC1	ZINC000819157809	DH	On-Demand	Anodyne	SLC6A2	15	41
O[C@@H](CN[C@@H](c1cccc(F)c1)c1cccc(Cl)c1)C1CC1	ZINC000819157810	DH	On-Demand	Anodyne	SLC6A2	15	41
C#CCCCCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819157839	CE	On-Demand	Mild	ADRB2	50	48
C#CCCCCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819157839	CE	On-Demand	Mild	ADRB1	77	44
C#CCCCCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819157839	CE	On-Demand	Mild	ADRB3	45	44
C#CCCCCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819157839	CE	On-Demand	Mild	ABCB1	20	48
C#CCCCCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819157840	CE	On-Demand	Mild	ADRB2	50	48
C#CCCCCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819157840	CE	On-Demand	Mild	ADRB1	77	44
C#CCCCCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819157840	CE	On-Demand	Mild	ADRB3	45	44
C#CCCCCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819157840	CE	On-Demand	Mild	ABCB1	20	48
C#CCCCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819157845	CD	On-Demand	Mild	ADRB2	36	51
C#CCCCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819157845	CD	On-Demand	Mild	ADRB1	57	51
C#CCCCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819157845	CD	On-Demand	Mild	ADRB3	33	51
C#CCCCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819157846	CD	On-Demand	Mild	ADRB2	36	51
C#CCCCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819157846	CD	On-Demand	Mild	ADRB1	57	51
C#CCCCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819157846	CD	On-Demand	Mild	ADRB3	33	51
O[C@@H](CNCCCc1ccc2c(c1)OCCO2)c1ccc(Br)cc1	ZINC000819157866	GG	On-Demand	Anodyne	ADRB2	40	35
O[C@H](CNCCCc1ccc2c(c1)OCCO2)c1ccc(Br)cc1	ZINC000819157867	GG	On-Demand	Anodyne	ADRB2	40	35
C#CCCCCNC[C@H](O)COc1c(C)ccc(C)c1C	ZINC000819157880	CF	On-Demand	Mild	ADRB2	25	42
C#CCCCCNC[C@@H](O)COc1c(C)ccc(C)c1C	ZINC000819157881	CF	On-Demand	Mild	ADRB2	25	42
CCOc1ccc(C#N)cc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819157944	GG	On-Demand	Mild	PAPA1_CARPA	39	44
CCOc1ccc(C#N)cc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819157944	GG	On-Demand	Mild	CTRB_BOVIN	58	35
CCOc1ccc(C#N)cc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819157945	GG	On-Demand	Mild	PAPA1_CARPA	39	44
CCOc1ccc(C#N)cc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819157945	GG	On-Demand	Mild	CTRB_BOVIN	58	35
O=C(CCNCCc1ccc(Cl)nc1)Nc1ccc(Cl)cc1	ZINC000819157952	EH	On-Demand	Anodyne	ADRB1	19	44
O=C(CCNCCc1ccc(Cl)nc1)Nc1ccc(Cl)cc1	ZINC000819157952	EH	On-Demand	Anodyne	NACHRBETA2	40	33
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccccc1	ZINC000819157962	CF	On-Demand	Anodyne	ADRB2	77	59
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccccc1	ZINC000819157962	CF	On-Demand	Anodyne	ADRB1	99	49
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccccc1	ZINC000819157962	CF	On-Demand	Anodyne	ADRB3	165	53
O[C@H](CNCCc1ccc(Cl)nc1)c1ccccc1	ZINC000819157963	CF	On-Demand	Anodyne	ADRB2	77	59
O[C@H](CNCCc1ccc(Cl)nc1)c1ccccc1	ZINC000819157963	CF	On-Demand	Anodyne	ADRB1	99	49
O[C@H](CNCCc1ccc(Cl)nc1)c1ccccc1	ZINC000819157963	CF	On-Demand	Anodyne	ADRB3	165	53
CCC(=O)c1cc(Cl)ccc1OCC(=O)NC1CCCCCCC1	ZINC000819157972	FJ	On-Demand	Anodyne	CNR1	29	46
CCC(=O)c1cc(Cl)ccc1OCC(=O)NC1CCCCCCC1	ZINC000819157972	FJ	On-Demand	Anodyne	PTGDR2	35	46
O=C1CCc2cc(OC[C@@H](O)CNCCc3ccc(Cl)nc3)ccc2N1	ZINC000819157981	GE	On-Demand	Anodyne	ADRB2	38	44
O=C1CCc2cc(OC[C@@H](O)CNCCc3ccc(Cl)nc3)ccc2N1	ZINC000819157981	GE	On-Demand	Anodyne	ADRB1	69	44
O=C1CCc2cc(OC[C@@H](O)CNCCc3ccc(Cl)nc3)ccc2N1	ZINC000819157981	GE	On-Demand	Anodyne	GRIN1	24	47
O=C1CCc2cc(OC[C@@H](O)CNCCc3ccc(Cl)nc3)ccc2N1	ZINC000819157981	GE	On-Demand	Anodyne	ADRB3	53	46
O=C1CCc2cc(OC[C@H](O)CNCCc3ccc(Cl)nc3)ccc2N1	ZINC000819157982	GE	On-Demand	Anodyne	ADRB2	38	44
O=C1CCc2cc(OC[C@H](O)CNCCc3ccc(Cl)nc3)ccc2N1	ZINC000819157982	GE	On-Demand	Anodyne	ADRB1	69	44
O=C1CCc2cc(OC[C@H](O)CNCCc3ccc(Cl)nc3)ccc2N1	ZINC000819157982	GE	On-Demand	Anodyne	GRIN1	24	47
O=C1CCc2cc(OC[C@H](O)CNCCc3ccc(Cl)nc3)ccc2N1	ZINC000819157982	GE	On-Demand	Anodyne	ADRB3	53	46
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819157984	EE	On-Demand	Anodyne	ADRB1	51	38
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819157984	EE	On-Demand	Anodyne	ADRB3	51	38
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819157985	EE	On-Demand	Anodyne	ADRB1	51	38
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819157985	EE	On-Demand	Anodyne	ADRB3	51	38
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2ccc(Cl)nc2)CC1	ZINC000819158019	GF	On-Demand	Anodyne	GPR119	55	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2ccc(Cl)nc2)CC1	ZINC000819158020	GF	On-Demand	Anodyne	GPR119	55	44
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccccc1Cl	ZINC000819158041	DG	On-Demand	Anodyne	ADRB2	54	45
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccccc1Cl	ZINC000819158041	DG	On-Demand	Anodyne	ADRB1	69	41
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccccc1Cl	ZINC000819158041	DG	On-Demand	Anodyne	ADRB3	80	41
CON(C)C(=O)CCNCCc1ccc(Cl)nc1	ZINC000819158044	CD	On-Demand	Anodyne	NACHRBETA2	45	36
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158046	DG	On-Demand	Anodyne	ADRB1	40	39
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158046	DG	On-Demand	Anodyne	ADRB3	46	38
O=C(CCNCCc1ccc(Cl)nc1)Nc1cccc(Cl)c1	ZINC000819158048	EH	On-Demand	Anodyne	ADRB1	26	41
O=C(CCNCCc1ccc(Cl)nc1)Nc1cccc(Cl)c1	ZINC000819158048	EH	On-Demand	Anodyne	ADRB3	29	41
O[C@H](CNCCc1ccc(Cl)nc1)CC1CCCC1	ZINC000819158073	CF	On-Demand	Anodyne	ADRB2	25	40
O[C@H](CNCCc1ccc(Cl)nc1)CC1CCCC1	ZINC000819158073	CF	On-Demand	Anodyne	ADRB1	55	40
O[C@H](CNCCc1ccc(Cl)nc1)CC1CCCC1	ZINC000819158073	CF	On-Demand	Anodyne	ADRB3	50	40
O[C@@H](CNCCc1ccc(Cl)nc1)CC1CCCC1	ZINC000819158074	CF	On-Demand	Anodyne	ADRB2	25	40
O[C@@H](CNCCc1ccc(Cl)nc1)CC1CCCC1	ZINC000819158074	CF	On-Demand	Anodyne	ADRB1	55	40
O[C@@H](CNCCc1ccc(Cl)nc1)CC1CCCC1	ZINC000819158074	CF	On-Demand	Anodyne	ADRB3	50	40
CCOC(=O)CC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158079	DD	On-Demand	Anodyne	ADRB2	33	49
CCOC(=O)CC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158079	DD	On-Demand	Anodyne	ADRB1	55	39
CCOC(=O)CC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158079	DD	On-Demand	Anodyne	ADRB3	59	39
CCOC(=O)CC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158080	DD	On-Demand	Anodyne	ADRB2	33	49
CCOC(=O)CC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158080	DD	On-Demand	Anodyne	ADRB1	55	39
CCOC(=O)CC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158080	DD	On-Demand	Anodyne	ADRB3	59	39
O=C(CCNCCc1ccc(Cl)nc1)Nc1cccnc1	ZINC000819158120	DE	On-Demand	Anodyne	ADRB1	20	41
O=C(CCNCCc1ccc(Cl)nc1)Nc1cccnc1	ZINC000819158120	DE	On-Demand	Anodyne	ADRB3	43	43
O=C(CCNCCc1ccc(Cl)nc1)Nc1cccnc1	ZINC000819158120	DE	On-Demand	Anodyne	NAMPT	18	42
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3csc(C(=O)O)c3)C2)cc1	ZINC000819158164	GE	On-Demand	Clean	MMP13	54	37
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3csc(C(=O)O)c3)C2)cc1	ZINC000819158164	GE	On-Demand	Clean	MMP3	47	37
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3csc(C(=O)O)c3)C2)cc1	ZINC000819158164	GE	On-Demand	Clean	MMP9	40	37
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3csc(C(=O)O)c3)C2)cc1	ZINC000819158164	GE	On-Demand	Clean	MMP7	42	37
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3csc(C(=O)O)c3)C2)cc1	ZINC000819158164	GE	On-Demand	Clean	MMP1	48	38
O[C@@H](CNCCc1ccc(Cl)nc1)CC(F)(F)F	ZINC000819158192	CE	On-Demand	Anodyne	NACHRBETA2	40	36
O[C@H](CNCCc1ccc(Cl)nc1)CC(F)(F)F	ZINC000819158193	CE	On-Demand	Anodyne	NACHRBETA2	40	36
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(F)cc1Cl	ZINC000819158194	EG	On-Demand	Anodyne	ADRB1	41	38
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(F)cc1Cl	ZINC000819158194	EG	On-Demand	Anodyne	ADRB3	44	38
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(F)cc1Cl	ZINC000819158195	EG	On-Demand	Anodyne	ADRB1	41	38
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(F)cc1Cl	ZINC000819158195	EG	On-Demand	Anodyne	ADRB3	44	38
N#Cc1ccc(S(=O)(=O)CCNCCc2ccc(Cl)nc2)cc1	ZINC000819158231	EE	On-Demand	Mild	NACHRBETA2	46	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(NC(=O)c2ccsc2)CC1	ZINC000819158237	GE	On-Demand	Anodyne	NPBWR1	90	34
CCOC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158271	CD	On-Demand	Anodyne	ADRB2	41	46
CCOC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158271	CD	On-Demand	Anodyne	ADRB1	62	46
CCOC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158271	CD	On-Demand	Anodyne	ADRB3	52	46
CSc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158284	FG	On-Demand	Anodyne	ADRB2	55	55
CSc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158284	FG	On-Demand	Anodyne	ADRB1	87	55
CSc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158284	FG	On-Demand	Anodyne	GRIN1	30	51
CSc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158284	FG	On-Demand	Anodyne	ADRB3	63	55
CSc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158285	FG	On-Demand	Anodyne	ADRB2	55	55
CSc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158285	FG	On-Demand	Anodyne	ADRB1	87	55
CSc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158285	FG	On-Demand	Anodyne	GRIN1	30	51
CSc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158285	FG	On-Demand	Anodyne	ADRB3	63	55
O[C@H](CNCCc1ccc(Cl)nc1)c1cccnc1	ZINC000819158322	CD	On-Demand	Anodyne	ADRB2	59	56
O[C@H](CNCCc1ccc(Cl)nc1)c1cccnc1	ZINC000819158322	CD	On-Demand	Anodyne	ADRB1	74	56
O[C@H](CNCCc1ccc(Cl)nc1)c1cccnc1	ZINC000819158322	CD	On-Demand	Anodyne	ADRB3	171	59
O[C@H](CNCCc1ccc(Cl)nc1)c1cccnc1	ZINC000819158322	CD	On-Demand	Anodyne	CYP51A1	16	41
O[C@@H](CNCCc1ccc(Cl)nc1)c1cccnc1	ZINC000819158323	CD	On-Demand	Anodyne	ADRB2	59	56
O[C@@H](CNCCc1ccc(Cl)nc1)c1cccnc1	ZINC000819158323	CD	On-Demand	Anodyne	ADRB1	74	56
O[C@@H](CNCCc1ccc(Cl)nc1)c1cccnc1	ZINC000819158323	CD	On-Demand	Anodyne	ADRB3	171	59
O[C@@H](CNCCc1ccc(Cl)nc1)c1cccnc1	ZINC000819158323	CD	On-Demand	Anodyne	CYP51A1	16	41
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cc(C(=O)O)n(C)c3)C2)cc1	ZINC000819158324	GD	On-Demand	Clean	MMP13	50	39
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cc(C(=O)O)n(C)c3)C2)cc1	ZINC000819158324	GD	On-Demand	Clean	MMP3	44	38
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cc(C(=O)O)n(C)c3)C2)cc1	ZINC000819158324	GD	On-Demand	Clean	NPY5R	18	41
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cc(C(=O)O)n(C)c3)C2)cc1	ZINC000819158324	GD	On-Demand	Clean	MMP7	40	38
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cc(C(=O)O)n(C)c3)C2)cc1	ZINC000819158324	GD	On-Demand	Clean	MMP1	43	38
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cc(C(=O)O)oc3C)C2)cc1	ZINC000819158327	GE	On-Demand	Clean	MMP13	42	37
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cc(C(=O)O)oc3C)C2)cc1	ZINC000819158327	GE	On-Demand	Clean	MMP3	41	37
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cc(C(=O)O)oc3C)C2)cc1	ZINC000819158327	GE	On-Demand	Clean	NPY5R	24	40
O[C@H](CNCCc1ccc(Cl)nc1)Cc1ccc(F)cc1	ZINC000819158343	DF	On-Demand	Anodyne	ADRB2	22	42
O[C@H](CNCCc1ccc(Cl)nc1)Cc1ccc(F)cc1	ZINC000819158343	DF	On-Demand	Anodyne	ADRB1	39	42
O[C@H](CNCCc1ccc(Cl)nc1)Cc1ccc(F)cc1	ZINC000819158343	DF	On-Demand	Anodyne	ADRB3	41	42
O[C@@H](CNCCc1ccc(Cl)nc1)Cc1ccc(F)cc1	ZINC000819158344	DF	On-Demand	Anodyne	ADRB2	22	42
O[C@@H](CNCCc1ccc(Cl)nc1)Cc1ccc(F)cc1	ZINC000819158344	DF	On-Demand	Anodyne	ADRB1	39	42
O[C@@H](CNCCc1ccc(Cl)nc1)Cc1ccc(F)cc1	ZINC000819158344	DF	On-Demand	Anodyne	ADRB3	41	42
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3c[nH]c(C(=O)O)c3)C2)cc1	ZINC000819158359	GD	On-Demand	Clean	MMP13	61	39
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3c[nH]c(C(=O)O)c3)C2)cc1	ZINC000819158359	GD	On-Demand	Clean	MMP3	54	40
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3c[nH]c(C(=O)O)c3)C2)cc1	ZINC000819158359	GD	On-Demand	Clean	MMP9	46	40
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3c[nH]c(C(=O)O)c3)C2)cc1	ZINC000819158359	GD	On-Demand	Clean	MMP7	46	40
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3c[nH]c(C(=O)O)c3)C2)cc1	ZINC000819158359	GD	On-Demand	Clean	MMP1	56	40
O=C1CCCN1C[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158367	CC	On-Demand	Anodyne	ADRB1	42	36
O=C1CCCN1C[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158367	CC	On-Demand	Anodyne	ADRB3	54	36
O=C1CCCN1C[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158367	CC	On-Demand	Anodyne	NACHRBETA2	46	37
O=C1CCCN1C[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158368	CC	On-Demand	Anodyne	ADRB1	42	36
O=C1CCCN1C[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158368	CC	On-Demand	Anodyne	ADRB3	54	36
O=C1CCCN1C[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158368	CC	On-Demand	Anodyne	NACHRBETA2	46	37
Cn1cnnc1[C@H]1CN(S(=O)(=O)c2cccc(C(=O)O)c2)CCO1	ZINC000819158374	FC	On-Demand	Anodyne	AKR1C3	68	45
Cn1cnnc1[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)O)c2)CCO1	ZINC000819158375	FC	On-Demand	Anodyne	AKR1C3	68	45
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(C(F)(F)F)cc1	ZINC000819158387	EH	On-Demand	Anodyne	ADRB2	33	43
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(C(F)(F)F)cc1	ZINC000819158387	EH	On-Demand	Anodyne	ADRB1	37	41
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(C(F)(F)F)cc1	ZINC000819158387	EH	On-Demand	Anodyne	ADRB3	78	43
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(C(F)(F)F)cc1	ZINC000819158388	EH	On-Demand	Anodyne	ADRB2	33	43
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(C(F)(F)F)cc1	ZINC000819158388	EH	On-Demand	Anodyne	ADRB1	37	41
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(C(F)(F)F)cc1	ZINC000819158388	EH	On-Demand	Anodyne	ADRB3	78	43
Cn1cnnc1[C@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CCO1	ZINC000819158400	GC	On-Demand	Anodyne	ADAM17	40	38
Cn1cnnc1[C@@H]1CN(S(=O)(=O)c2ccc(OCC(=O)O)cc2)CCO1	ZINC000819158401	GC	On-Demand	Anodyne	ADAM17	40	38
O[C@H](CNCCc1ccc(Cl)nc1)Cc1cccc(Cl)c1	ZINC000819158402	EG	On-Demand	Anodyne	ADRB2	40	44
O[C@H](CNCCc1ccc(Cl)nc1)Cc1cccc(Cl)c1	ZINC000819158402	EG	On-Demand	Anodyne	ADRB1	65	46
O[C@H](CNCCc1ccc(Cl)nc1)Cc1cccc(Cl)c1	ZINC000819158402	EG	On-Demand	Anodyne	ADRB3	62	46
O[C@@H](CNCCc1ccc(Cl)nc1)Cc1cccc(Cl)c1	ZINC000819158403	EG	On-Demand	Anodyne	ADRB2	40	44
O[C@@H](CNCCc1ccc(Cl)nc1)Cc1cccc(Cl)c1	ZINC000819158403	EG	On-Demand	Anodyne	ADRB1	65	46
O[C@@H](CNCCc1ccc(Cl)nc1)Cc1cccc(Cl)c1	ZINC000819158403	EG	On-Demand	Anodyne	ADRB3	62	46
CC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158429	BD	On-Demand	Anodyne	ADRB2	30	42
CC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158429	BD	On-Demand	Anodyne	ADRB1	49	42
CC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158429	BD	On-Demand	Anodyne	ADRB3	56	42
CC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158430	BD	On-Demand	Anodyne	ADRB2	30	42
CC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158430	BD	On-Demand	Anodyne	ADRB1	49	42
CC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158430	BD	On-Demand	Anodyne	ADRB3	56	42
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CCO[C@@H](c2nncn2C)C1	ZINC000819158432	GC	On-Demand	Anodyne	CPT1A	52	35
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CCO[C@H](c2nncn2C)C1	ZINC000819158433	GC	On-Demand	Anodyne	CPT1A	52	35
O=C(Nc1cccc(N2CCN(CC3CC3)CC2)c1)C(F)=C1CCC1	ZINC000819158469	EH	On-Demand	Anodyne	HTR1A	22	54
O=C(Nc1cccc(N2CCN(CC3CC3)CC2)c1)C(F)=C1CCC1	ZINC000819158469	EH	On-Demand	Anodyne	DRD3	17	41
O[C@H](CNCCc1ccc(Cl)nc1)Cn1cccn1	ZINC000819158521	CD	On-Demand	Anodyne	ADRB3	37	42
O[C@@H](CNCCc1ccc(Cl)nc1)Cn1cccn1	ZINC000819158522	CD	On-Demand	Anodyne	ADRB3	37	42
O[C@H](CNCCc1ccc(Cl)nc1)C(F)(F)F	ZINC000819158530	CD	On-Demand	Anodyne	ADRB3	43	38
O[C@H](CNCCc1ccc(Cl)nc1)C(F)(F)F	ZINC000819158530	CD	On-Demand	Anodyne	NACHRBETA2	40	35
O[C@@H](CNCCc1ccc(Cl)nc1)C(F)(F)F	ZINC000819158531	CD	On-Demand	Anodyne	ADRB3	43	38
O[C@@H](CNCCc1ccc(Cl)nc1)C(F)(F)F	ZINC000819158531	CD	On-Demand	Anodyne	NACHRBETA2	40	35
O[C@H](CNCCc1ccc(Cl)nc1)C1CC1	ZINC000819158535	BD	On-Demand	Anodyne	Q8WSF8_APLCA	42	37
O[C@H](CNCCc1ccc(Cl)nc1)C1CC1	ZINC000819158535	BD	On-Demand	Anodyne	NACHRBETA2	48	37
O[C@@H](CNCCc1ccc(Cl)nc1)C1CC1	ZINC000819158536	BD	On-Demand	Anodyne	Q8WSF8_APLCA	42	37
O[C@@H](CNCCc1ccc(Cl)nc1)C1CC1	ZINC000819158536	BD	On-Demand	Anodyne	NACHRBETA2	48	37
O[C@@H](CNCCc1ccc(Cl)nc1)c1cccc(Cl)c1	ZINC000819158542	DG	On-Demand	Anodyne	ADRB2	84	45
O[C@@H](CNCCc1ccc(Cl)nc1)c1cccc(Cl)c1	ZINC000819158542	DG	On-Demand	Anodyne	ADRB1	103	61
O[C@@H](CNCCc1ccc(Cl)nc1)c1cccc(Cl)c1	ZINC000819158542	DG	On-Demand	Anodyne	ADRB3	174	61
O[C@H](CNCCc1ccc(Cl)nc1)c1cccc(Cl)c1	ZINC000819158543	DG	On-Demand	Anodyne	ADRB2	84	45
O[C@H](CNCCc1ccc(Cl)nc1)c1cccc(Cl)c1	ZINC000819158543	DG	On-Demand	Anodyne	ADRB1	103	61
O[C@H](CNCCc1ccc(Cl)nc1)c1cccc(Cl)c1	ZINC000819158543	DG	On-Demand	Anodyne	ADRB3	174	61
O=S(=O)(CCNCCc1ccc(Cl)nc1)c1ccc(F)cc1	ZINC000819158545	EE	On-Demand	Anodyne	NACHRBETA2	40	33
O[C@@H](CNCCc1ccc(Cl)nc1)C1CCCCC1	ZINC000819158603	CF	On-Demand	Anodyne	ADRB3	29	41
O[C@H](CNCCc1ccc(Cl)nc1)C1CCCCC1	ZINC000819158604	CF	On-Demand	Anodyne	ADRB3	29	41
C[C@H](CNCCc1ccc(Cl)nc1)S(C)(=O)=O	ZINC000819158621	CD	On-Demand	Anodyne	NACHRBETA2	44	35
C[C@@H](CNCCc1ccc(Cl)nc1)S(C)(=O)=O	ZINC000819158622	CD	On-Demand	Anodyne	NACHRBETA2	44	35
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cccc(C(=O)O)c3)C2)cc1	ZINC000819158644	GE	On-Demand	Clean	F2	27	42
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cccc(C(=O)O)c3)C2)cc1	ZINC000819158644	GE	On-Demand	Clean	PLG	16	42
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cccc(C(=O)O)c3)C2)cc1	ZINC000819158644	GE	On-Demand	Clean	DRD4	43	36
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cccc(C(=O)O)c3)C2)cc1	ZINC000819158644	GE	On-Demand	Clean	F10	24	44
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cccc(C(=O)O)c3)C2)cc1	ZINC000819158644	GE	On-Demand	Clean	HTR7	22	41
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cccc(C(=O)O)c3)C2)cc1	ZINC000819158644	GE	On-Demand	Clean	MMP13	63	39
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cccc(C(=O)O)c3)C2)cc1	ZINC000819158644	GE	On-Demand	Clean	TRY2_BOVIN	44	38
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cccc(C(=O)O)c3)C2)cc1	ZINC000819158644	GE	On-Demand	Clean	MMP3	51	39
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cccc(C(=O)O)c3)C2)cc1	ZINC000819158644	GE	On-Demand	Clean	NPY5R	24	44
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cccc(C(=O)O)c3)C2)cc1	ZINC000819158644	GE	On-Demand	Clean	MMP9	47	39
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cccc(C(=O)O)c3)C2)cc1	ZINC000819158644	GE	On-Demand	Clean	ST14	63	42
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cccc(C(=O)O)c3)C2)cc1	ZINC000819158644	GE	On-Demand	Clean	MMP7	41	37
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cccc(C(=O)O)c3)C2)cc1	ZINC000819158644	GE	On-Demand	Clean	MMP1	54	39
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3cccc(C(=O)O)c3)C2)cc1	ZINC000819158644	GE	On-Demand	Clean	AKR1C3	55	45
CCC(=O)c1cc(Cl)ccc1OCC(=O)Nc1ccc2ccccc2c1	ZINC000819158658	FK	On-Demand	Anodyne	HTR2A	18	42
CCC(=O)c1cc(Cl)ccc1OCC(=O)Nc1ccc2ccccc2c1	ZINC000819158658	FK	On-Demand	Anodyne	PTGER1	39	45
CCC(=O)c1cc(Cl)ccc1OCC(=O)Nc1ccc2ccccc2c1	ZINC000819158658	FK	On-Demand	Anodyne	AGPAT2	81	40
CCC(=O)c1cc(Cl)ccc1OCC(=O)Nc1ccc2ccccc2c1	ZINC000819158658	FK	On-Demand	Anodyne	MCHR2	30	42
CCC(=O)c1cc(Cl)ccc1OCC(=O)Nc1ccc2ccccc2c1	ZINC000819158658	FK	On-Demand	Anodyne	ENPP1	40	34
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3ccc(C(=O)O)cc3)C2)cc1	ZINC000819158672	GE	On-Demand	Clean	F10	20	45
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3ccc(C(=O)O)cc3)C2)cc1	ZINC000819158672	GE	On-Demand	Clean	MMP13	92	43
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3ccc(C(=O)O)cc3)C2)cc1	ZINC000819158672	GE	On-Demand	Clean	MMP2	50	44
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3ccc(C(=O)O)cc3)C2)cc1	ZINC000819158672	GE	On-Demand	Clean	MMP3	72	41
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3ccc(C(=O)O)cc3)C2)cc1	ZINC000819158672	GE	On-Demand	Clean	MMP8	37	43
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3ccc(C(=O)O)cc3)C2)cc1	ZINC000819158672	GE	On-Demand	Clean	MMP14	15	43
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3ccc(C(=O)O)cc3)C2)cc1	ZINC000819158672	GE	On-Demand	Clean	NPY5R	20	42
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3ccc(C(=O)O)cc3)C2)cc1	ZINC000819158672	GE	On-Demand	Clean	MMP9	62	43
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3ccc(C(=O)O)cc3)C2)cc1	ZINC000819158672	GE	On-Demand	Clean	MMP12	23	43
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3ccc(C(=O)O)cc3)C2)cc1	ZINC000819158672	GE	On-Demand	Clean	MMP7	53	40
COc1ccc(N2CC[C@H](CNS(=O)(=O)c3ccc(C(=O)O)cc3)C2)cc1	ZINC000819158672	GE	On-Demand	Clean	MMP1	74	43
O=C(CCNCCc1ccc(Cl)nc1)Nc1cccc(C(F)(F)F)c1	ZINC000819158675	FH	On-Demand	Anodyne	LCK	25	40
O=C(CCNCCc1ccc(Cl)nc1)Nc1cccc(C(F)(F)F)c1	ZINC000819158675	FH	On-Demand	Anodyne	RAF1	22	47
O=C(CCNCCc1ccc(Cl)nc1)Nc1cccc(C(F)(F)F)c1	ZINC000819158675	FH	On-Demand	Anodyne	BTK	20	40
O=C(CCNCCc1ccc(Cl)nc1)Nc1cccc(C(F)(F)F)c1	ZINC000819158675	FH	On-Demand	Anodyne	PDS	43	35
COC[C@@H](C)OC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158699	DD	On-Demand	Anodyne	ADRB2	35	43
COC[C@@H](C)OC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158699	DD	On-Demand	Anodyne	ADRB1	56	43
COC[C@@H](C)OC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158699	DD	On-Demand	Anodyne	ADRB3	46	44
COC[C@@H](C)OC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158701	DD	On-Demand	Anodyne	ADRB2	35	43
COC[C@@H](C)OC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158701	DD	On-Demand	Anodyne	ADRB1	56	43
COC[C@@H](C)OC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158701	DD	On-Demand	Anodyne	ADRB3	46	44
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(F)c(Br)c1	ZINC000819158731	FH	On-Demand	Anodyne	ADRB2	39	44
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(F)c(Br)c1	ZINC000819158731	FH	On-Demand	Anodyne	ADRB1	43	45
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(F)c(Br)c1	ZINC000819158731	FH	On-Demand	Anodyne	ADRB3	78	45
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(F)c(Br)c1	ZINC000819158732	FH	On-Demand	Anodyne	ADRB2	39	44
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(F)c(Br)c1	ZINC000819158732	FH	On-Demand	Anodyne	ADRB1	43	45
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(F)c(Br)c1	ZINC000819158732	FH	On-Demand	Anodyne	ADRB3	78	45
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(F)cn1	ZINC000819158756	CE	On-Demand	Anodyne	ADRB3	40	35
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(F)cn1	ZINC000819158757	CE	On-Demand	Anodyne	ADRB3	40	35
O[C@H](CNCCc1ccc(Cl)nc1)Cc1ccc2ccccc2c1	ZINC000819158797	EH	On-Demand	Anodyne	ADRB2	41	41
O[C@H](CNCCc1ccc(Cl)nc1)Cc1ccc2ccccc2c1	ZINC000819158797	EH	On-Demand	Anodyne	ADRB1	54	45
O[C@H](CNCCc1ccc(Cl)nc1)Cc1ccc2ccccc2c1	ZINC000819158797	EH	On-Demand	Anodyne	ADRB3	64	45
O[C@@H](CNCCc1ccc(Cl)nc1)Cc1ccc2ccccc2c1	ZINC000819158798	EH	On-Demand	Anodyne	ADRB2	41	41
O[C@@H](CNCCc1ccc(Cl)nc1)Cc1ccc2ccccc2c1	ZINC000819158798	EH	On-Demand	Anodyne	ADRB1	54	45
O[C@@H](CNCCc1ccc(Cl)nc1)Cc1ccc2ccccc2c1	ZINC000819158798	EH	On-Demand	Anodyne	ADRB3	64	45
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(Cl)c(F)c1	ZINC000819158803	EG	On-Demand	Anodyne	ADRB2	40	43
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(Cl)c(F)c1	ZINC000819158803	EG	On-Demand	Anodyne	ADRB1	41	44
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(Cl)c(F)c1	ZINC000819158803	EG	On-Demand	Anodyne	ADRB3	85	44
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(Cl)c(F)c1	ZINC000819158804	EG	On-Demand	Anodyne	ADRB2	40	43
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(Cl)c(F)c1	ZINC000819158804	EG	On-Demand	Anodyne	ADRB1	41	44
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(Cl)c(F)c1	ZINC000819158804	EG	On-Demand	Anodyne	ADRB3	85	44
O[C@@H](CNCCc1ccc(Cl)nc1)COCc1ccccc1Cl	ZINC000819158806	FG	On-Demand	Anodyne	ADRB2	37	44
O[C@@H](CNCCc1ccc(Cl)nc1)COCc1ccccc1Cl	ZINC000819158806	FG	On-Demand	Anodyne	ADRB1	59	50
O[C@@H](CNCCc1ccc(Cl)nc1)COCc1ccccc1Cl	ZINC000819158806	FG	On-Demand	Anodyne	ADRB3	50	50
O[C@H](CNCCc1ccc(Cl)nc1)COCc1ccccc1Cl	ZINC000819158807	FG	On-Demand	Anodyne	ADRB2	37	44
O[C@H](CNCCc1ccc(Cl)nc1)COCc1ccccc1Cl	ZINC000819158807	FG	On-Demand	Anodyne	ADRB1	59	50
O[C@H](CNCCc1ccc(Cl)nc1)COCc1ccccc1Cl	ZINC000819158807	FG	On-Demand	Anodyne	ADRB3	50	50
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(F)c(F)c1	ZINC000819158820	DF	On-Demand	Anodyne	ADRB2	43	46
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(F)c(F)c1	ZINC000819158820	DF	On-Demand	Anodyne	ADRB1	48	47
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(F)c(F)c1	ZINC000819158820	DF	On-Demand	Anodyne	ADRB3	93	47
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(F)c(F)c1	ZINC000819158821	DF	On-Demand	Anodyne	ADRB2	43	46
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(F)c(F)c1	ZINC000819158821	DF	On-Demand	Anodyne	ADRB1	48	47
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(F)c(F)c1	ZINC000819158821	DF	On-Demand	Anodyne	ADRB3	93	47
O[C@@H](CNCCc1ccc(Cl)nc1)c1cccc(C(F)(F)F)c1	ZINC000819158824	EH	On-Demand	Anodyne	ADRB2	46	43
O[C@@H](CNCCc1ccc(Cl)nc1)c1cccc(C(F)(F)F)c1	ZINC000819158824	EH	On-Demand	Anodyne	ADRB1	55	49
O[C@@H](CNCCc1ccc(Cl)nc1)c1cccc(C(F)(F)F)c1	ZINC000819158824	EH	On-Demand	Anodyne	ADRB3	119	49
O[C@H](CNCCc1ccc(Cl)nc1)c1cccc(C(F)(F)F)c1	ZINC000819158825	EH	On-Demand	Anodyne	ADRB2	46	43
O[C@H](CNCCc1ccc(Cl)nc1)c1cccc(C(F)(F)F)c1	ZINC000819158825	EH	On-Demand	Anodyne	ADRB1	55	49
O[C@H](CNCCc1ccc(Cl)nc1)c1cccc(C(F)(F)F)c1	ZINC000819158825	EH	On-Demand	Anodyne	ADRB3	119	49
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819158826	DF	On-Demand	Bother	ADRB2	54	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819158826	DF	On-Demand	Bother	ADRB1	63	48
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819158826	DF	On-Demand	Bother	ADRB3	139	48
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819158827	DF	On-Demand	Bother	ADRB2	54	42
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819158827	DF	On-Demand	Bother	ADRB1	63	48
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819158827	DF	On-Demand	Bother	ADRB3	139	48
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(OC(F)(F)F)cc1	ZINC000819158832	FG	On-Demand	Anodyne	ADRB2	55	45
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(OC(F)(F)F)cc1	ZINC000819158832	FG	On-Demand	Anodyne	ADRB1	68	43
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(OC(F)(F)F)cc1	ZINC000819158832	FG	On-Demand	Anodyne	ADRB3	104	48
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(OC(F)(F)F)cc1	ZINC000819158833	FG	On-Demand	Anodyne	ADRB2	55	45
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(OC(F)(F)F)cc1	ZINC000819158833	FG	On-Demand	Anodyne	ADRB1	68	43
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(OC(F)(F)F)cc1	ZINC000819158833	FG	On-Demand	Anodyne	ADRB3	104	48
N#Cc1cccc(S(=O)(=O)CCNCCc2ccc(Cl)nc2)c1	ZINC000819158840	EE	On-Demand	Mild	ITGA4	49	31
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc2ccccc2c1	ZINC000819158841	FG	On-Demand	Anodyne	ADRB2	67	52
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc2ccccc2c1	ZINC000819158841	FG	On-Demand	Anodyne	ADRB1	102	53
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc2ccccc2c1	ZINC000819158841	FG	On-Demand	Anodyne	GRIN1	30	48
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc2ccccc2c1	ZINC000819158841	FG	On-Demand	Anodyne	ADRB3	83	53
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc2ccccc2c1	ZINC000819158841	FG	On-Demand	Anodyne	CASR	43	39
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc2ccccc2c1	ZINC000819158842	FG	On-Demand	Anodyne	ADRB2	67	52
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc2ccccc2c1	ZINC000819158842	FG	On-Demand	Anodyne	ADRB1	102	53
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc2ccccc2c1	ZINC000819158842	FG	On-Demand	Anodyne	GRIN1	30	48
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc2ccccc2c1	ZINC000819158842	FG	On-Demand	Anodyne	ADRB3	83	53
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc2ccccc2c1	ZINC000819158842	FG	On-Demand	Anodyne	CASR	43	39
COc1ccc(OC)c([C@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819158845	EF	On-Demand	Anodyne	ADRB2	54	53
COc1ccc(OC)c([C@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819158845	EF	On-Demand	Anodyne	ADRB1	66	43
COc1ccc(OC)c([C@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819158845	EF	On-Demand	Anodyne	ADRB3	64	43
CCOc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158855	FF	On-Demand	Anodyne	ADRB2	65	58
CCOc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158855	FF	On-Demand	Anodyne	ADRB1	98	58
CCOc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158855	FF	On-Demand	Anodyne	GRIN1	32	55
CCOc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158855	FF	On-Demand	Anodyne	ADRB3	72	58
CCOc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158856	FF	On-Demand	Anodyne	ADRB2	65	58
CCOc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158856	FF	On-Demand	Anodyne	ADRB1	98	58
CCOc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158856	FF	On-Demand	Anodyne	GRIN1	32	55
CCOc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158856	FF	On-Demand	Anodyne	ADRB3	72	58
O[C@H](CNCCc1ccc(Cl)nc1)COc1cc(Cl)ccc1Cl	ZINC000819158867	GH	On-Demand	Anodyne	ADRB2	40	44
O[C@H](CNCCc1ccc(Cl)nc1)COc1cc(Cl)ccc1Cl	ZINC000819158867	GH	On-Demand	Anodyne	ADRB1	74	44
O[C@H](CNCCc1ccc(Cl)nc1)COc1cc(Cl)ccc1Cl	ZINC000819158867	GH	On-Demand	Anodyne	GRIN1	21	50
O[C@H](CNCCc1ccc(Cl)nc1)COc1cc(Cl)ccc1Cl	ZINC000819158867	GH	On-Demand	Anodyne	ADRB3	57	44
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cc(Cl)ccc1Cl	ZINC000819158868	GH	On-Demand	Anodyne	ADRB2	40	44
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cc(Cl)ccc1Cl	ZINC000819158868	GH	On-Demand	Anodyne	ADRB1	74	44
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cc(Cl)ccc1Cl	ZINC000819158868	GH	On-Demand	Anodyne	GRIN1	21	50
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cc(Cl)ccc1Cl	ZINC000819158868	GH	On-Demand	Anodyne	ADRB3	57	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819158878	FE	On-Demand	Bother	ADRB2	48	59
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819158878	FE	On-Demand	Bother	ADRB1	87	59
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819158878	FE	On-Demand	Bother	GRIN1	22	51
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819158878	FE	On-Demand	Bother	ADRB3	75	59
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819158878	FE	On-Demand	Bother	PDS	17	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819158879	FE	On-Demand	Bother	ADRB2	48	59
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819158879	FE	On-Demand	Bother	ADRB1	87	59
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819158879	FE	On-Demand	Bother	GRIN1	22	51
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819158879	FE	On-Demand	Bother	ADRB3	75	59
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819158879	FE	On-Demand	Bother	PDS	17	43
C[C@@H](OC[C@H](O)CNCCc1ccc(Cl)nc1)c1ccc(Cl)cc1	ZINC000819158898	FH	On-Demand	Anodyne	ADRB2	35	44
C[C@@H](OC[C@H](O)CNCCc1ccc(Cl)nc1)c1ccc(Cl)cc1	ZINC000819158898	FH	On-Demand	Anodyne	ADRB1	56	44
C[C@@H](OC[C@H](O)CNCCc1ccc(Cl)nc1)c1ccc(Cl)cc1	ZINC000819158898	FH	On-Demand	Anodyne	ADRB3	55	44
C[C@@H](OC[C@@H](O)CNCCc1ccc(Cl)nc1)c1ccc(Cl)cc1	ZINC000819158899	FH	On-Demand	Anodyne	ADRB2	35	44
C[C@@H](OC[C@@H](O)CNCCc1ccc(Cl)nc1)c1ccc(Cl)cc1	ZINC000819158899	FH	On-Demand	Anodyne	ADRB1	56	44
C[C@@H](OC[C@@H](O)CNCCc1ccc(Cl)nc1)c1ccc(Cl)cc1	ZINC000819158899	FH	On-Demand	Anodyne	ADRB3	55	44
CCN(Cc1ccccc1)C(=O)CNC(=O)C(F)=C1CCC1	ZINC000819158905	DF	On-Demand	Anodyne	LIMK2	21	42
O[C@@H](CNCCc1ccc(Cl)nc1)CO[C@H]1CCCc2ccccc21	ZINC000819158907	FG	On-Demand	Anodyne	ADRB2	28	42
O[C@@H](CNCCc1ccc(Cl)nc1)CO[C@H]1CCCc2ccccc21	ZINC000819158907	FG	On-Demand	Anodyne	ADRB1	60	42
O[C@@H](CNCCc1ccc(Cl)nc1)CO[C@H]1CCCc2ccccc21	ZINC000819158907	FG	On-Demand	Anodyne	ADRB3	46	42
O[C@H](CNCCc1ccc(Cl)nc1)CO[C@@H]1CCCc2ccccc21	ZINC000819158908	FG	On-Demand	Anodyne	ADRB2	28	42
O[C@H](CNCCc1ccc(Cl)nc1)CO[C@@H]1CCCc2ccccc21	ZINC000819158908	FG	On-Demand	Anodyne	ADRB1	60	42
O[C@H](CNCCc1ccc(Cl)nc1)CO[C@@H]1CCCc2ccccc21	ZINC000819158908	FG	On-Demand	Anodyne	ADRB3	46	42
O[C@H](CNCCc1ccc(Cl)nc1)CO[C@H]1CCCc2ccccc21	ZINC000819158909	FG	On-Demand	Anodyne	ADRB2	28	42
O[C@H](CNCCc1ccc(Cl)nc1)CO[C@H]1CCCc2ccccc21	ZINC000819158909	FG	On-Demand	Anodyne	ADRB1	60	42
O[C@H](CNCCc1ccc(Cl)nc1)CO[C@H]1CCCc2ccccc21	ZINC000819158909	FG	On-Demand	Anodyne	ADRB3	46	42
O[C@@H](CNCCc1ccc(Cl)nc1)CO[C@@H]1CCCc2ccccc21	ZINC000819158910	FG	On-Demand	Anodyne	ADRB2	28	42
O[C@@H](CNCCc1ccc(Cl)nc1)CO[C@@H]1CCCc2ccccc21	ZINC000819158910	FG	On-Demand	Anodyne	ADRB1	60	42
O[C@@H](CNCCc1ccc(Cl)nc1)CO[C@@H]1CCCc2ccccc21	ZINC000819158910	FG	On-Demand	Anodyne	ADRB3	46	42
N#C[C@H]1CC[C@@H](NS(=O)(=O)c2ccc(F)c(C(=O)O)c2)C1	ZINC000819158925	DD	On-Demand	Mild	SFRP1	65	32
OC1(CNCCc2ccc(Cl)nc2)CCCC1	ZINC000819158932	CE	On-Demand	Anodyne	NACHRBETA2	46	33
COc1ccccc1COC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158934	FE	On-Demand	Anodyne	ADRB2	47	47
COc1ccccc1COC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158934	FE	On-Demand	Anodyne	ADRB1	66	50
COc1ccccc1COC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158934	FE	On-Demand	Anodyne	ADRB3	50	50
COc1ccccc1COC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158935	FE	On-Demand	Anodyne	ADRB2	47	47
COc1ccccc1COC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158935	FE	On-Demand	Anodyne	ADRB1	66	50
COc1ccccc1COC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158935	FE	On-Demand	Anodyne	ADRB3	50	50
O[C@H](CNCCc1ccc(Cl)nc1)Cc1ccccc1	ZINC000819158936	CE	On-Demand	Anodyne	ADRB2	42	43
O[C@H](CNCCc1ccc(Cl)nc1)Cc1ccccc1	ZINC000819158936	CE	On-Demand	Anodyne	ADRB1	62	44
O[C@H](CNCCc1ccc(Cl)nc1)Cc1ccccc1	ZINC000819158936	CE	On-Demand	Anodyne	ADRB3	76	44
O[C@@H](CNCCc1ccc(Cl)nc1)Cc1ccccc1	ZINC000819158937	CE	On-Demand	Anodyne	ADRB2	42	43
O[C@@H](CNCCc1ccc(Cl)nc1)Cc1ccccc1	ZINC000819158937	CE	On-Demand	Anodyne	ADRB1	62	44
O[C@@H](CNCCc1ccc(Cl)nc1)Cc1ccccc1	ZINC000819158937	CE	On-Demand	Anodyne	ADRB3	76	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCOc2ncccc2Cl)CC1	ZINC000819158938	GF	On-Demand	Anodyne	GPR119	58	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCOc2ncccc2Cl)CC1	ZINC000819158939	GF	On-Demand	Anodyne	GPR119	58	44
Cc1ccccc1[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158940	CF	On-Demand	Anodyne	ADRB2	57	40
Cc1ccccc1[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158940	CF	On-Demand	Anodyne	ADRB1	67	40
Cc1ccccc1[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819158940	CF	On-Demand	Anodyne	ADRB3	80	42
O[C@H](CNCCc1ccc(Cl)nc1)CN1CCc2ccccc2C1	ZINC000819158942	EE	On-Demand	Anodyne	NOD2	41	35
O[C@@H](CNCCc1ccc(Cl)nc1)CN1CCc2ccccc2C1	ZINC000819158943	EE	On-Demand	Anodyne	NOD2	41	35
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccccc1Br	ZINC000819158944	FG	On-Demand	Anodyne	ADRB2	45	40
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccccc1Br	ZINC000819158944	FG	On-Demand	Anodyne	ADRB1	58	39
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccccc1Br	ZINC000819158944	FG	On-Demand	Anodyne	ADRB3	79	39
O[C@H](CNCCc1ccc(Cl)nc1)c1ccccc1Br	ZINC000819158945	FG	On-Demand	Anodyne	ADRB2	45	40
O[C@H](CNCCc1ccc(Cl)nc1)c1ccccc1Br	ZINC000819158945	FG	On-Demand	Anodyne	ADRB1	58	39
O[C@H](CNCCc1ccc(Cl)nc1)c1ccccc1Br	ZINC000819158945	FG	On-Demand	Anodyne	ADRB3	79	39
O[C@@H](CNCCOc1ncccc1Cl)c1ccc(F)cc1	ZINC000819158952	DF	On-Demand	Anodyne	ADRB3	31	40
O[C@H](CNCCOc1ncccc1Cl)c1ccc(F)cc1	ZINC000819158953	DF	On-Demand	Anodyne	ADRB3	31	40
N#C[C@H]1CC[C@@H](NS(=O)(=O)c2cc(C(=O)O)cc(F)c2F)C1	ZINC000819158954	ED	On-Demand	Mild	SFRP1	73	32
O[C@@H](CNCCOc1ncccc1Cl)c1ccc(C(F)(F)F)cc1	ZINC000819158956	FG	On-Demand	Anodyne	ADRB1	19	42
O[C@@H](CNCCOc1ncccc1Cl)c1ccc(C(F)(F)F)cc1	ZINC000819158956	FG	On-Demand	Anodyne	ADRB3	24	42
O[C@H](CNCCOc1ncccc1Cl)c1ccc(C(F)(F)F)cc1	ZINC000819158957	FG	On-Demand	Anodyne	ADRB1	19	42
O[C@H](CNCCOc1ncccc1Cl)c1ccc(C(F)(F)F)cc1	ZINC000819158957	FG	On-Demand	Anodyne	ADRB3	24	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(N3CCCCC3)CC1)C2	ZINC000819158958	FE	On-Demand	Anodyne	L3MBTL3	66	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(N3CCCCC3)CC1)C2	ZINC000819158959	FE	On-Demand	Anodyne	L3MBTL3	66	37
N#C[C@H]1CC[C@@H](NS(=O)(=O)c2cc(C(=O)O)ccc2Br)C1	ZINC000819158962	FE	On-Demand	Mild	CTSC	18	47
N#C[C@H]1CC[C@@H](NS(=O)(=O)c2cc(C(=O)O)ccc2Br)C1	ZINC000819158962	FE	On-Demand	Mild	SFRP1	77	36
N#C[C@H]1CC[C@@H](NS(=O)(=O)c2cc(C(=O)O)c(F)cc2F)C1	ZINC000819158967	ED	On-Demand	Mild	SFRP1	41	31
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)c(Cl)c1	ZINC000819158970	GH	On-Demand	Anodyne	ADRB2	56	56
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)c(Cl)c1	ZINC000819158970	GH	On-Demand	Anodyne	ADRB1	94	56
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)c(Cl)c1	ZINC000819158970	GH	On-Demand	Anodyne	GRIN1	35	60
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)c(Cl)c1	ZINC000819158970	GH	On-Demand	Anodyne	ADRB3	69	56
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)c(Cl)c1	ZINC000819158971	GH	On-Demand	Anodyne	ADRB2	56	56
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)c(Cl)c1	ZINC000819158971	GH	On-Demand	Anodyne	ADRB1	94	56
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)c(Cl)c1	ZINC000819158971	GH	On-Demand	Anodyne	GRIN1	35	60
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)c(Cl)c1	ZINC000819158971	GH	On-Demand	Anodyne	ADRB3	69	56
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(Cl)cc1	ZINC000819158972	DG	On-Demand	Anodyne	ADRB2	49	50
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(Cl)cc1	ZINC000819158972	DG	On-Demand	Anodyne	ADRB1	57	46
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(Cl)cc1	ZINC000819158972	DG	On-Demand	Anodyne	ADRB3	104	47
O[C@H](CNCCc1ccc(Cl)nc1)COC1CCOCC1	ZINC000819158974	DD	On-Demand	Anodyne	ADRB2	27	41
O[C@H](CNCCc1ccc(Cl)nc1)COC1CCOCC1	ZINC000819158974	DD	On-Demand	Anodyne	ADRB1	62	41
O[C@H](CNCCc1ccc(Cl)nc1)COC1CCOCC1	ZINC000819158974	DD	On-Demand	Anodyne	ADRB3	43	41
O[C@@H](CNCCc1ccc(Cl)nc1)COC1CCOCC1	ZINC000819158975	DD	On-Demand	Anodyne	ADRB2	27	41
O[C@@H](CNCCc1ccc(Cl)nc1)COC1CCOCC1	ZINC000819158975	DD	On-Demand	Anodyne	ADRB1	62	41
O[C@@H](CNCCc1ccc(Cl)nc1)COC1CCOCC1	ZINC000819158975	DD	On-Demand	Anodyne	ADRB3	43	41
COC(=O)c1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158976	FE	On-Demand	Anodyne	ADRB2	67	58
COC(=O)c1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158976	FE	On-Demand	Anodyne	ADRB1	119	58
COC(=O)c1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158976	FE	On-Demand	Anodyne	GRIN1	32	53
COC(=O)c1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158976	FE	On-Demand	Anodyne	ADRB3	94	58
COC(=O)c1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158977	FE	On-Demand	Anodyne	ADRB2	67	58
COC(=O)c1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158977	FE	On-Demand	Anodyne	ADRB1	119	58
COC(=O)c1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158977	FE	On-Demand	Anodyne	GRIN1	32	53
COC(=O)c1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158977	FE	On-Demand	Anodyne	ADRB3	94	58
C/C=C\c1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c(OC)c1	ZINC000819158978	GG	On-Demand	Anodyne	ADRB2	40	58
C/C=C\c1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c(OC)c1	ZINC000819158978	GG	On-Demand	Anodyne	ADRB1	57	58
C/C=C\c1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c(OC)c1	ZINC000819158978	GG	On-Demand	Anodyne	ADRB3	48	44
C/C=C/c1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c(OC)c1	ZINC000819158979	GG	On-Demand	Anodyne	ADRB2	40	58
C/C=C/c1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c(OC)c1	ZINC000819158979	GG	On-Demand	Anodyne	ADRB1	57	58
C/C=C/c1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c(OC)c1	ZINC000819158979	GG	On-Demand	Anodyne	ADRB3	48	44
C/C=C\c1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c(OC)c1	ZINC000819158980	GG	On-Demand	Anodyne	ADRB2	40	58
C/C=C\c1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c(OC)c1	ZINC000819158980	GG	On-Demand	Anodyne	ADRB1	57	58
C/C=C\c1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c(OC)c1	ZINC000819158980	GG	On-Demand	Anodyne	ADRB3	48	44
C/C=C/c1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c(OC)c1	ZINC000819158981	GG	On-Demand	Anodyne	ADRB2	40	58
C/C=C/c1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c(OC)c1	ZINC000819158981	GG	On-Demand	Anodyne	ADRB1	57	58
C/C=C/c1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c(OC)c1	ZINC000819158981	GG	On-Demand	Anodyne	ADRB3	48	44
OC1(CNCCc2ccc(Cl)nc2)CCC1	ZINC000819158983	BD	On-Demand	Anodyne	NACHRBETA2	46	34
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cccc2[nH]ccc12	ZINC000819158995	EF	On-Demand	Anodyne	ADRB2	42	55
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cccc2[nH]ccc12	ZINC000819158995	EF	On-Demand	Anodyne	ADRB1	70	58
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cccc2[nH]ccc12	ZINC000819158995	EF	On-Demand	Anodyne	SLC6A4	15	43
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cccc2[nH]ccc12	ZINC000819158995	EF	On-Demand	Anodyne	ADRB3	55	55
O[C@H](CNCCc1ccc(Cl)nc1)COc1cccc2[nH]ccc12	ZINC000819158996	EF	On-Demand	Anodyne	ADRB2	42	55
O[C@H](CNCCc1ccc(Cl)nc1)COc1cccc2[nH]ccc12	ZINC000819158996	EF	On-Demand	Anodyne	ADRB1	70	58
O[C@H](CNCCc1ccc(Cl)nc1)COc1cccc2[nH]ccc12	ZINC000819158996	EF	On-Demand	Anodyne	SLC6A4	15	43
O[C@H](CNCCc1ccc(Cl)nc1)COc1cccc2[nH]ccc12	ZINC000819158996	EF	On-Demand	Anodyne	ADRB3	55	55
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158998	FE	On-Demand	Anodyne	ADRB2	69	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158998	FE	On-Demand	Anodyne	ADRB1	69	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158998	FE	On-Demand	Anodyne	ADRB3	152	48
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158999	FE	On-Demand	Anodyne	ADRB2	69	43
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158999	FE	On-Demand	Anodyne	ADRB1	69	40
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819158999	FE	On-Demand	Anodyne	ADRB3	152	48
N#Cc1ccc([C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159009	DE	On-Demand	Mild	ADRB2	34	42
N#Cc1ccc([C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159009	DE	On-Demand	Mild	ADRB1	40	41
N#Cc1ccc([C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159009	DE	On-Demand	Mild	ADRB3	71	41
N#Cc1ccc([C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159010	DE	On-Demand	Mild	ADRB2	34	42
N#Cc1ccc([C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159010	DE	On-Demand	Mild	ADRB1	40	41
N#Cc1ccc([C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159010	DE	On-Demand	Mild	ADRB3	71	41
CC[C@@H](C)[C@H](C)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819159014	CE	On-Demand	Anodyne	CTSK	17	47
CC[C@H](C)[C@H](C)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819159016	CE	On-Demand	Anodyne	CTSK	17	47
CCCOc1ccc(CNC[C@H](O)c2cccnc2)c(OC(F)F)c1	ZINC000819159020	FG	On-Demand	Anodyne	ADRB2	17	46
CCCOc1ccc(CNC[C@H](O)c2cccnc2)c(OC(F)F)c1	ZINC000819159020	FG	On-Demand	Anodyne	ADRB1	27	46
CCCOc1ccc(CNC[C@H](O)c2cccnc2)c(OC(F)F)c1	ZINC000819159020	FG	On-Demand	Anodyne	ADRB3	72	46
CCCOc1ccc(CNC[C@@H](O)c2cccnc2)c(OC(F)F)c1	ZINC000819159021	FG	On-Demand	Anodyne	ADRB2	17	46
CCCOc1ccc(CNC[C@@H](O)c2cccnc2)c(OC(F)F)c1	ZINC000819159021	FG	On-Demand	Anodyne	ADRB1	27	46
CCCOc1ccc(CNC[C@@H](O)c2cccnc2)c(OC(F)F)c1	ZINC000819159021	FG	On-Demand	Anodyne	ADRB3	72	46
COC(=O)N1CCC(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819159022	GD	On-Demand	Mild	PAPA1_CARPA	39	48
COC(=O)N1CCC(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819159023	GD	On-Demand	Mild	PAPA1_CARPA	39	48
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cccc(Br)c1	ZINC000819159033	GG	On-Demand	Anodyne	ADRB2	54	50
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cccc(Br)c1	ZINC000819159033	GG	On-Demand	Anodyne	ADRB1	89	50
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cccc(Br)c1	ZINC000819159033	GG	On-Demand	Anodyne	GRIN1	23	52
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cccc(Br)c1	ZINC000819159033	GG	On-Demand	Anodyne	ADRB3	72	50
O[C@H](CNCCc1ccc(Cl)nc1)COc1cccc(Br)c1	ZINC000819159034	GG	On-Demand	Anodyne	ADRB2	54	50
O[C@H](CNCCc1ccc(Cl)nc1)COc1cccc(Br)c1	ZINC000819159034	GG	On-Demand	Anodyne	ADRB1	89	50
O[C@H](CNCCc1ccc(Cl)nc1)COc1cccc(Br)c1	ZINC000819159034	GG	On-Demand	Anodyne	GRIN1	23	52
O[C@H](CNCCc1ccc(Cl)nc1)COc1cccc(Br)c1	ZINC000819159034	GG	On-Demand	Anodyne	ADRB3	72	50
CC(=O)c1cccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819159035	EF	On-Demand	Anodyne	ADRB2	64	48
CC(=O)c1cccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819159035	EF	On-Demand	Anodyne	ADRB1	118	51
CC(=O)c1cccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819159035	EF	On-Demand	Anodyne	GRIN1	29	54
CC(=O)c1cccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819159035	EF	On-Demand	Anodyne	ADRB3	102	51
CC(=O)c1cccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819159035	EF	On-Demand	Anodyne	ABCB1	22	49
CC(=O)c1cccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819159035	EF	On-Demand	Anodyne	PDS	69	38
CC(=O)c1cccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819159036	EF	On-Demand	Anodyne	ADRB2	64	48
CC(=O)c1cccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819159036	EF	On-Demand	Anodyne	ADRB1	118	51
CC(=O)c1cccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819159036	EF	On-Demand	Anodyne	GRIN1	29	54
CC(=O)c1cccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819159036	EF	On-Demand	Anodyne	ADRB3	102	51
CC(=O)c1cccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819159036	EF	On-Demand	Anodyne	ABCB1	22	49
CC(=O)c1cccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c1	ZINC000819159036	EF	On-Demand	Anodyne	PDS	69	38
COCC(C)(C)N1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)O)c2)CC1	ZINC000819159053	GD	On-Demand	Anodyne	TGM2	50	35
COCC(C)(C)N1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)O)c2)CC1	ZINC000819159053	GD	On-Demand	Anodyne	F13A1	62	35
COCC(C)(C)N1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)O)c2)CC1	ZINC000819159053	GD	On-Demand	Anodyne	AKR1C3	40	40
O[C@H](CNCCc1ccc(Cl)nc1)COCc1cccs1	ZINC000819159054	EF	On-Demand	Anodyne	ADRB2	28	43
O[C@H](CNCCc1ccc(Cl)nc1)COCc1cccs1	ZINC000819159054	EF	On-Demand	Anodyne	ADRB1	48	47
O[C@H](CNCCc1ccc(Cl)nc1)COCc1cccs1	ZINC000819159054	EF	On-Demand	Anodyne	ADRB3	41	47
O[C@@H](CNCCc1ccc(Cl)nc1)COCc1cccs1	ZINC000819159055	EF	On-Demand	Anodyne	ADRB2	28	43
O[C@@H](CNCCc1ccc(Cl)nc1)COCc1cccs1	ZINC000819159055	EF	On-Demand	Anodyne	ADRB1	48	47
O[C@@H](CNCCc1ccc(Cl)nc1)COCc1cccs1	ZINC000819159055	EF	On-Demand	Anodyne	ADRB3	41	47
O=C1c2ccccc2C(=O)N1C[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819159056	FD	On-Demand	Anodyne	ADRB1	48	38
O=C1c2ccccc2C(=O)N1C[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819159056	FD	On-Demand	Anodyne	ADRB3	59	38
O=C1c2ccccc2C(=O)N1C[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819159057	FD	On-Demand	Anodyne	ADRB1	48	38
O=C1c2ccccc2C(=O)N1C[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819159057	FD	On-Demand	Anodyne	ADRB3	59	38
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ncccc2Cl)c1	ZINC000819159065	EE	On-Demand	Bother	ADRB1	35	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ncccc2Cl)c1	ZINC000819159065	EE	On-Demand	Bother	ADRB3	48	41
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ncccc2Cl)c1	ZINC000819159066	EE	On-Demand	Bother	ADRB1	35	41
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ncccc2Cl)c1	ZINC000819159066	EE	On-Demand	Bother	ADRB3	48	41
O[C@@H](CNCCOc1ccc(Cl)cn1)c1ccc(Cl)c(F)c1	ZINC000819159101	EG	On-Demand	Anodyne	ADRB2	21	41
O[C@@H](CNCCOc1ccc(Cl)cn1)c1ccc(Cl)c(F)c1	ZINC000819159101	EG	On-Demand	Anodyne	ADRB1	26	41
O[C@@H](CNCCOc1ccc(Cl)cn1)c1ccc(Cl)c(F)c1	ZINC000819159101	EG	On-Demand	Anodyne	ADRB3	26	41
O[C@H](CNCCOc1ccc(Cl)cn1)c1ccc(Cl)c(F)c1	ZINC000819159102	EG	On-Demand	Anodyne	ADRB2	21	41
O[C@H](CNCCOc1ccc(Cl)cn1)c1ccc(Cl)c(F)c1	ZINC000819159102	EG	On-Demand	Anodyne	ADRB1	26	41
O[C@H](CNCCOc1ccc(Cl)cn1)c1ccc(Cl)c(F)c1	ZINC000819159102	EG	On-Demand	Anodyne	ADRB3	26	41
COC(=O)N1CCC(NC(=O)c2cn(-c3ccccc3)nc2C(C)C)CC1	ZINC000819159123	FF	On-Demand	Anodyne	DRD4	15	40
C#CCNC(=O)CCNCCc1cccc(-c2ccccc2)c1	ZINC000819159126	DF	On-Demand	Mild	CTSL	19	40
C#CCNC(=O)CCNCCc1cccc(-c2ccccc2)c1	ZINC000819159126	DF	On-Demand	Mild	FFAR1	17	40
C#CCNC(=O)CCNCCc1cccc(-c2ccccc2)c1	ZINC000819159126	DF	On-Demand	Mild	HAO2	47	33
O=C(C1CCCCC1)N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819159144	GH	On-Demand	Anodyne	CNR1	20	51
O=C(C1CCCCC1)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819159145	GH	On-Demand	Anodyne	CNR1	20	51
O=C(C1CCCCC1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819159146	GH	On-Demand	Anodyne	CNR1	20	51
O=C(C1CCCCC1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819159147	GH	On-Demand	Anodyne	CNR1	20	51
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCOc2ccc(Cl)cn2)CC1	ZINC000819159151	GF	On-Demand	Anodyne	GPR119	53	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCOc2ccc(Cl)cn2)CC1	ZINC000819159152	GF	On-Demand	Anodyne	GPR119	53	44
O[C@@H](CNCCOc1ncccc1Cl)c1ccc(OC(F)(F)F)cc1	ZINC000819159153	GG	On-Demand	Anodyne	ADRB2	17	41
O[C@@H](CNCCOc1ncccc1Cl)c1ccc(OC(F)(F)F)cc1	ZINC000819159153	GG	On-Demand	Anodyne	ADRB1	27	42
O[C@@H](CNCCOc1ncccc1Cl)c1ccc(OC(F)(F)F)cc1	ZINC000819159153	GG	On-Demand	Anodyne	ADRB3	34	42
O[C@H](CNCCOc1ncccc1Cl)c1ccc(OC(F)(F)F)cc1	ZINC000819159154	GG	On-Demand	Anodyne	ADRB2	17	41
O[C@H](CNCCOc1ncccc1Cl)c1ccc(OC(F)(F)F)cc1	ZINC000819159154	GG	On-Demand	Anodyne	ADRB1	27	42
O[C@H](CNCCOc1ncccc1Cl)c1ccc(OC(F)(F)F)cc1	ZINC000819159154	GG	On-Demand	Anodyne	ADRB3	34	42
O[C@@H](CNCCOc1ccc(C(F)(F)F)cn1)c1ccccc1	ZINC000819159173	EF	On-Demand	Anodyne	ADRB1	26	45
O[C@@H](CNCCOc1ccc(C(F)(F)F)cn1)c1ccccc1	ZINC000819159173	EF	On-Demand	Anodyne	ADRB3	37	45
O[C@H](CNCCOc1ccc(C(F)(F)F)cn1)c1ccccc1	ZINC000819159174	EF	On-Demand	Anodyne	ADRB1	26	45
O[C@H](CNCCOc1ccc(C(F)(F)F)cn1)c1ccccc1	ZINC000819159174	EF	On-Demand	Anodyne	ADRB3	37	45
COc1ccc(OC)c([C@H](O)CNCCOc2ccc(Cl)cn2)c1	ZINC000819159188	FE	On-Demand	Anodyne	ADRB2	16	44
Cc1ccccc1[C@@H](O)CNCCOc1ccc(C(F)(F)F)cn1	ZINC000819159197	EG	On-Demand	Anodyne	LIPE	17	43
CCC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(=O)O)c2)C1	ZINC000819159210	EC	On-Demand	Anodyne	PKM	43	40
CCC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(=O)O)c2)C1	ZINC000819159210	EC	On-Demand	Anodyne	TGM2	41	35
CCC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(=O)O)c2)C1	ZINC000819159210	EC	On-Demand	Anodyne	F13A1	42	35
CCC(=O)N1CCN(S(=O)(=O)c2ccc(F)c(C(=O)O)c2)C1	ZINC000819159210	EC	On-Demand	Anodyne	NOD2	17	42
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159213	FE	On-Demand	Anodyne	ADRB2	73	72
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159213	FE	On-Demand	Anodyne	ADRB1	126	72
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159213	FE	On-Demand	Anodyne	GRIN1	35	59
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159213	FE	On-Demand	Anodyne	ADRB3	116	72
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159214	FE	On-Demand	Anodyne	ADRB2	73	72
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159214	FE	On-Demand	Anodyne	ADRB1	126	72
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159214	FE	On-Demand	Anodyne	GRIN1	35	59
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159214	FE	On-Demand	Anodyne	ADRB3	116	72
COC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819159218	BC	On-Demand	Anodyne	ADRB2	47	48
COC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819159218	BC	On-Demand	Anodyne	ADRB1	72	48
COC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819159218	BC	On-Demand	Anodyne	ADRB3	61	49
O[C@@H](CNCCc1ccc(Cl)nc1)COCc1ccccc1F	ZINC000819159231	EF	On-Demand	Anodyne	ADRB2	33	42
O[C@@H](CNCCc1ccc(Cl)nc1)COCc1ccccc1F	ZINC000819159231	EF	On-Demand	Anodyne	ADRB1	58	42
O[C@@H](CNCCc1ccc(Cl)nc1)COCc1ccccc1F	ZINC000819159231	EF	On-Demand	Anodyne	ADRB3	46	42
O[C@H](CNCCc1ccc(Cl)nc1)COCc1ccccc1F	ZINC000819159232	EF	On-Demand	Anodyne	ADRB2	33	42
O[C@H](CNCCc1ccc(Cl)nc1)COCc1ccccc1F	ZINC000819159232	EF	On-Demand	Anodyne	ADRB1	58	42
O[C@H](CNCCc1ccc(Cl)nc1)COCc1ccccc1F	ZINC000819159232	EF	On-Demand	Anodyne	ADRB3	46	42
CCC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)O)c(OC)cc2Cl)C1	ZINC000819159238	GD	On-Demand	Anodyne	HTR4	61	37
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccccc1F	ZINC000819159244	DE	On-Demand	Anodyne	ADRB2	51	47
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccccc1F	ZINC000819159244	DE	On-Demand	Anodyne	ADRB1	81	47
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccccc1F	ZINC000819159244	DE	On-Demand	Anodyne	GRIN1	15	50
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccccc1F	ZINC000819159244	DE	On-Demand	Anodyne	ADRB3	60	47
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccccc1F	ZINC000819159244	DE	On-Demand	Anodyne	ABCB1	17	41
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccccc1F	ZINC000819159246	DE	On-Demand	Anodyne	ADRB2	51	47
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccccc1F	ZINC000819159246	DE	On-Demand	Anodyne	ADRB1	81	47
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccccc1F	ZINC000819159246	DE	On-Demand	Anodyne	GRIN1	15	50
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccccc1F	ZINC000819159246	DE	On-Demand	Anodyne	ADRB3	60	47
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccccc1F	ZINC000819159246	DE	On-Demand	Anodyne	ABCB1	17	41
O[C@H](CNCCc1ccc(Cl)nc1)c1c(F)cccc1F	ZINC000819159260	DF	On-Demand	Anodyne	ADRB1	42	41
O[C@H](CNCCc1ccc(Cl)nc1)c1c(F)cccc1F	ZINC000819159260	DF	On-Demand	Anodyne	ADRB3	69	41
O[C@@H](CNCCc1ccc(Cl)nc1)c1c(F)cccc1F	ZINC000819159261	DF	On-Demand	Anodyne	ADRB1	42	41
O[C@@H](CNCCc1ccc(Cl)nc1)c1c(F)cccc1F	ZINC000819159261	DF	On-Demand	Anodyne	ADRB3	69	41
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(Br)cc1	ZINC000819159262	FG	On-Demand	Anodyne	ADRB2	41	52
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(Br)cc1	ZINC000819159262	FG	On-Demand	Anodyne	ADRB1	45	41
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(Br)cc1	ZINC000819159262	FG	On-Demand	Anodyne	ADRB3	84	45
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(Br)cc1	ZINC000819159263	FG	On-Demand	Anodyne	ADRB2	41	52
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(Br)cc1	ZINC000819159263	FG	On-Demand	Anodyne	ADRB1	45	41
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(Br)cc1	ZINC000819159263	FG	On-Demand	Anodyne	ADRB3	84	45
O=C(Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1)C(F)=C1CCC1	ZINC000819159265	GH	On-Demand	Anodyne	HTR1A	15	44
O=C(Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1)C(F)=C1CCC1	ZINC000819159265	GH	On-Demand	Anodyne	DRD2	16	44
O=C(Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1)C(F)=C1CCC1	ZINC000819159265	GH	On-Demand	Anodyne	DRD4	38	44
O=C(Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1)C(F)=C1CCC1	ZINC000819159265	GH	On-Demand	Anodyne	NOD2	41	34
O=C(Nc1ccc(CN2CCN(c3ccccn3)CC2)cc1)C(F)=C1CCC1	ZINC000819159265	GH	On-Demand	Anodyne	SLC27A1	50	46
O[C@H](CNCCc1ccc(Cl)nc1)COc1c(Cl)cccc1Cl	ZINC000819159288	GH	On-Demand	Anodyne	ADRB2	45	47
O[C@H](CNCCc1ccc(Cl)nc1)COc1c(Cl)cccc1Cl	ZINC000819159288	GH	On-Demand	Anodyne	ADRB1	74	47
O[C@H](CNCCc1ccc(Cl)nc1)COc1c(Cl)cccc1Cl	ZINC000819159288	GH	On-Demand	Anodyne	GRIN1	15	47
O[C@H](CNCCc1ccc(Cl)nc1)COc1c(Cl)cccc1Cl	ZINC000819159288	GH	On-Demand	Anodyne	ADRB3	59	47
O[C@@H](CNCCc1ccc(Cl)nc1)COc1c(Cl)cccc1Cl	ZINC000819159289	GH	On-Demand	Anodyne	ADRB2	45	47
O[C@@H](CNCCc1ccc(Cl)nc1)COc1c(Cl)cccc1Cl	ZINC000819159289	GH	On-Demand	Anodyne	ADRB1	74	47
O[C@@H](CNCCc1ccc(Cl)nc1)COc1c(Cl)cccc1Cl	ZINC000819159289	GH	On-Demand	Anodyne	GRIN1	15	47
O[C@@H](CNCCc1ccc(Cl)nc1)COc1c(Cl)cccc1Cl	ZINC000819159289	GH	On-Demand	Anodyne	ADRB3	59	47
COC(=O)N1CCC(NC(=O)c2c(C)ccc(Br)c2OC)CC1	ZINC000819159291	GF	On-Demand	Anodyne	DRD2	22	41
COC(=O)N1CCC(NC(=O)c2c(C)ccc(Br)c2OC)CC1	ZINC000819159291	GF	On-Demand	Anodyne	CCR8	59	37
N#CCc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159294	EE	On-Demand	Mild	ADRB2	51	55
N#CCc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159294	EE	On-Demand	Mild	ADRB1	87	55
N#CCc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159294	EE	On-Demand	Mild	GRIN1	26	48
N#CCc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159294	EE	On-Demand	Mild	ADRB3	58	55
N#CCc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159298	EE	On-Demand	Mild	ADRB2	51	55
N#CCc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159298	EE	On-Demand	Mild	ADRB1	87	55
N#CCc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159298	EE	On-Demand	Mild	GRIN1	26	48
N#CCc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159298	EE	On-Demand	Mild	ADRB3	58	55
CCCOc1ccc(CNC[C@H](O)c2ccccc2)c(OC(F)F)c1	ZINC000819159313	FH	On-Demand	Anodyne	ADRB1	21	49
CCCOc1ccc(CNC[C@H](O)c2ccccc2)c(OC(F)F)c1	ZINC000819159313	FH	On-Demand	Anodyne	ADRB3	35	42
CCCOc1ccc(CNC[C@@H](O)c2ccccc2)c(OC(F)F)c1	ZINC000819159315	FH	On-Demand	Anodyne	ADRB1	21	49
CCCOc1ccc(CNC[C@@H](O)c2ccccc2)c(OC(F)F)c1	ZINC000819159315	FH	On-Demand	Anodyne	ADRB3	35	42
O=C(C(F)=C1CCC1)N1CCC(N2CCCCC2)CC1	ZINC000819159322	CF	On-Demand	Anodyne	L3MBTL3	113	51
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159323	DF	On-Demand	Bother	ADRB2	42	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159323	DF	On-Demand	Bother	ADRB1	48	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159323	DF	On-Demand	Bother	ADRB3	105	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159323	DF	On-Demand	Bother	NACHRBETA2	43	38
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159324	DF	On-Demand	Bother	ADRB2	42	42
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159324	DF	On-Demand	Bother	ADRB1	48	42
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159324	DF	On-Demand	Bother	ADRB3	105	42
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159324	DF	On-Demand	Bother	NACHRBETA2	43	38
O[C@@H](CNCCc1ccc(Cl)nc1)COC(c1ccccc1)c1ccccc1	ZINC000819159327	GI	On-Demand	Anodyne	ADRB2	46	45
O[C@@H](CNCCc1ccc(Cl)nc1)COC(c1ccccc1)c1ccccc1	ZINC000819159327	GI	On-Demand	Anodyne	ADRB1	78	46
O[C@@H](CNCCc1ccc(Cl)nc1)COC(c1ccccc1)c1ccccc1	ZINC000819159327	GI	On-Demand	Anodyne	ADRB3	91	46
O[C@@H](CNCCc1ccc(Cl)nc1)COC(c1ccccc1)c1ccccc1	ZINC000819159327	GI	On-Demand	Anodyne	CASR	18	44
O[C@H](CNCCc1ccc(Cl)nc1)COC(c1ccccc1)c1ccccc1	ZINC000819159328	GI	On-Demand	Anodyne	ADRB2	46	45
O[C@H](CNCCc1ccc(Cl)nc1)COC(c1ccccc1)c1ccccc1	ZINC000819159328	GI	On-Demand	Anodyne	ADRB1	78	46
O[C@H](CNCCc1ccc(Cl)nc1)COC(c1ccccc1)c1ccccc1	ZINC000819159328	GI	On-Demand	Anodyne	ADRB3	91	46
O[C@H](CNCCc1ccc(Cl)nc1)COC(c1ccccc1)c1ccccc1	ZINC000819159328	GI	On-Demand	Anodyne	CASR	18	44
O=C(/C=C/[C@H]1CCCO1)NCC(=O)N1CCCc2ccccc21	ZINC000819159329	DD	On-Demand	Anodyne	AVPR2	36	40
O=C(/C=C/[C@@H]1CCCO1)NCC(=O)N1CCCc2ccccc21	ZINC000819159330	DD	On-Demand	Anodyne	AVPR2	36	40
O=C(/C=C\[C@H]1CCCO1)NCC(=O)N1CCCc2ccccc21	ZINC000819159331	DD	On-Demand	Anodyne	AVPR2	36	40
O=C(/C=C\[C@@H]1CCCO1)NCC(=O)N1CCCc2ccccc21	ZINC000819159332	DD	On-Demand	Anodyne	AVPR2	36	40
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)cc1	ZINC000819159336	EF	On-Demand	Anodyne	ADRB2	60	61
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)cc1	ZINC000819159336	EF	On-Demand	Anodyne	ADRB1	100	61
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)cc1	ZINC000819159336	EF	On-Demand	Anodyne	GRIN1	31	61
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)cc1	ZINC000819159336	EF	On-Demand	Anodyne	ADRB3	73	61
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)cc1	ZINC000819159337	EF	On-Demand	Anodyne	ADRB2	60	61
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)cc1	ZINC000819159337	EF	On-Demand	Anodyne	ADRB1	100	61
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)cc1	ZINC000819159337	EF	On-Demand	Anodyne	GRIN1	31	61
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)cc1	ZINC000819159337	EF	On-Demand	Anodyne	ADRB3	73	61
C#Cc1ccc(C(=O)NCCc2ccc(Cl)c(OC)c2)nc1	ZINC000819159406	DF	On-Demand	Mild	RAF1	20	45
C#Cc1ccc(C(=O)NCCc2ccc(Cl)c(OC)c2)nc1	ZINC000819159406	DF	On-Demand	Mild	PDE6A	42	31
O[C@@H](CNCCc1ccc(Cl)nc1)c1cccc(F)c1	ZINC000819159449	CF	On-Demand	Anodyne	ADRB2	56	46
O[C@@H](CNCCc1ccc(Cl)nc1)c1cccc(F)c1	ZINC000819159449	CF	On-Demand	Anodyne	ADRB1	66	49
O[C@@H](CNCCc1ccc(Cl)nc1)c1cccc(F)c1	ZINC000819159449	CF	On-Demand	Anodyne	ADRB3	134	49
O[C@H](CNCCc1ccc(Cl)nc1)c1cccc(F)c1	ZINC000819159451	CF	On-Demand	Anodyne	ADRB2	56	46
O[C@H](CNCCc1ccc(Cl)nc1)c1cccc(F)c1	ZINC000819159451	CF	On-Demand	Anodyne	ADRB1	66	49
O[C@H](CNCCc1ccc(Cl)nc1)c1cccc(F)c1	ZINC000819159451	CF	On-Demand	Anodyne	ADRB3	134	49
COc1cccc(C2=NO[C@H](C(=O)NCCc3ccc(Cl)c(OC)c3)C2)c1	ZINC000819159461	GG	On-Demand	Anodyne	MTNR1A	50	38
COc1cccc(C2=NO[C@H](C(=O)NCCc3ccc(Cl)c(OC)c3)C2)c1	ZINC000819159461	GG	On-Demand	Anodyne	MTNR1B	48	38
COc1cccc(C2=NO[C@H](C(=O)NCCc3ccc(Cl)c(OC)c3)C2)c1	ZINC000819159461	GG	On-Demand	Anodyne	LUCI_PHOPY	41	45
COc1cccc(C2=NO[C@@H](C(=O)NCCc3ccc(Cl)c(OC)c3)C2)c1	ZINC000819159462	GG	On-Demand	Anodyne	MTNR1A	50	38
COc1cccc(C2=NO[C@@H](C(=O)NCCc3ccc(Cl)c(OC)c3)C2)c1	ZINC000819159462	GG	On-Demand	Anodyne	MTNR1B	48	38
COc1cccc(C2=NO[C@@H](C(=O)NCCc3ccc(Cl)c(OC)c3)C2)c1	ZINC000819159462	GG	On-Demand	Anodyne	LUCI_PHOPY	41	45
COc1ccc(-c2nnc(S)n2CCC(=O)NCCc2ccc(Cl)c(OC)c2)cc1	ZINC000819159469	IH	On-Demand	Anodyne	PROKR1	54	35
COC(=O)N[C@@H](C(=O)NCCc1ccc(Cl)c(OC)c1)C(C)C	ZINC000819159479	EE	On-Demand	Anodyne	CASP3	17	41
CN1C[C@@H]2CCCN(S(=O)(=O)c3ccc(Cl)c(C(=O)O)c3)[C@@H]2C1	ZINC000819159492	FD	On-Demand	Anodyne	CASP3	71	37
CN1C[C@@H]2CCCN(S(=O)(=O)c3ccc(Cl)c(C(=O)O)c3)[C@@H]2C1	ZINC000819159492	FD	On-Demand	Anodyne	CCR4	15	41
CN1C[C@@H]2CCCN(S(=O)(=O)c3ccc(Cl)c(C(=O)O)c3)[C@@H]2C1	ZINC000819159492	FD	On-Demand	Anodyne	CASP7	92	37
Cc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c(C)c1	ZINC000819159493	EF	On-Demand	Anodyne	ADRB2	46	46
Cc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c(C)c1	ZINC000819159493	EF	On-Demand	Anodyne	ADRB1	67	43
Cc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)c(C)c1	ZINC000819159493	EF	On-Demand	Anodyne	ADRB3	51	43
Cc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c(C)c1	ZINC000819159496	EF	On-Demand	Anodyne	ADRB2	46	46
Cc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c(C)c1	ZINC000819159496	EF	On-Demand	Anodyne	ADRB1	67	43
Cc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)c(C)c1	ZINC000819159496	EF	On-Demand	Anodyne	ADRB3	51	43
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(Cl)cc1Cl	ZINC000819159516	EH	On-Demand	Anodyne	ADRB2	40	38
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(Cl)cc1Cl	ZINC000819159516	EH	On-Demand	Anodyne	ADRB1	47	44
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(Cl)cc1Cl	ZINC000819159516	EH	On-Demand	Anodyne	ADRB3	46	44
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(Cl)cc1Cl	ZINC000819159517	EH	On-Demand	Anodyne	ADRB2	40	38
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(Cl)cc1Cl	ZINC000819159517	EH	On-Demand	Anodyne	ADRB1	47	44
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(Cl)cc1Cl	ZINC000819159517	EH	On-Demand	Anodyne	ADRB3	46	44
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccccc1C(F)(F)F	ZINC000819159518	EH	On-Demand	Anodyne	ADRB2	39	40
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccccc1C(F)(F)F	ZINC000819159518	EH	On-Demand	Anodyne	ADRB1	51	42
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccccc1C(F)(F)F	ZINC000819159518	EH	On-Demand	Anodyne	ADRB3	83	42
O[C@H](CNCCc1ccc(Cl)nc1)c1ccccc1C(F)(F)F	ZINC000819159519	EH	On-Demand	Anodyne	ADRB2	39	40
O[C@H](CNCCc1ccc(Cl)nc1)c1ccccc1C(F)(F)F	ZINC000819159519	EH	On-Demand	Anodyne	ADRB1	51	42
O[C@H](CNCCc1ccc(Cl)nc1)c1ccccc1C(F)(F)F	ZINC000819159519	EH	On-Demand	Anodyne	ADRB3	83	42
O=C(COc1ccccc1F)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819159524	FD	On-Demand	Reactive	PTGER1	16	41
O=C(COc1ccccc1F)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819159524	FD	On-Demand	Reactive	UL80	28	41
O=C(CNC(=O)N1CC[C@@H](C(=O)O)C1)Nc1ccc(F)c(F)c1	ZINC000819159525	ED	On-Demand	Anodyne	SLC6A1	51	37
O=C(CNC(=O)N1CC[C@@H](C(=O)O)C1)Nc1ccc(F)c(F)c1	ZINC000819159525	ED	On-Demand	Anodyne	EPHX2	30	45
O=C(CNC(=O)N1CC[C@H](C(=O)O)C1)Nc1ccc(F)c(F)c1	ZINC000819159527	ED	On-Demand	Anodyne	SLC6A1	51	37
O=C(CNC(=O)N1CC[C@H](C(=O)O)C1)Nc1ccc(F)c(F)c1	ZINC000819159527	ED	On-Demand	Anodyne	EPHX2	30	45
O=C(COCc1ccccc1)NNC(=O)N1CCO[C@@H](C(=O)O)C1	ZINC000819159528	EB	On-Demand	Reactive	SLC12A5	46	34
O[C@@H](CNCCc1ccc(Cl)nc1)COCc1ccc(Cl)cc1	ZINC000819159529	FG	On-Demand	Anodyne	ADRB2	31	47
O[C@@H](CNCCc1ccc(Cl)nc1)COCc1ccc(Cl)cc1	ZINC000819159529	FG	On-Demand	Anodyne	ADRB1	58	47
O[C@@H](CNCCc1ccc(Cl)nc1)COCc1ccc(Cl)cc1	ZINC000819159529	FG	On-Demand	Anodyne	ADRB3	51	47
O[C@H](CNCCc1ccc(Cl)nc1)COCc1ccc(Cl)cc1	ZINC000819159530	FG	On-Demand	Anodyne	ADRB2	31	47
O[C@H](CNCCc1ccc(Cl)nc1)COCc1ccc(Cl)cc1	ZINC000819159530	FG	On-Demand	Anodyne	ADRB1	58	47
O[C@H](CNCCc1ccc(Cl)nc1)COCc1ccc(Cl)cc1	ZINC000819159530	FG	On-Demand	Anodyne	ADRB3	51	47
O=C(COCc1ccccc1)NNC(=O)N1CCO[C@H](C(=O)O)C1	ZINC000819159531	EB	On-Demand	Reactive	SLC12A5	46	34
O=C(CNC(=O)c1ccsc1)NCc1ccc(C(=O)O)cc1	ZINC000819159532	DD	On-Demand	Anodyne	TPSAB1	15	41
O=C(CN1CCS(=O)(=O)CC1)NCc1ccc(C(=O)O)cc1	ZINC000819159537	EB	On-Demand	Anodyne	RPA1	42	32
O=C(CNC(=O)C1CCCCC1)OCc1ccc(C(=O)O)cc1	ZINC000819159540	DE	On-Demand	Anodyne	FKBP1A	31	41
O=C(CNC(=O)C1CCCCC1)OCc1ccc(C(=O)O)cc1	ZINC000819159540	DE	On-Demand	Anodyne	PROC	40	32
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)OCc1ccc(C(=O)O)cc1	ZINC000819159544	FD	On-Demand	Bother	CACNA1C	50	41
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)OCc1ccc(C(=O)O)cc1	ZINC000819159544	FD	On-Demand	Bother	CACNA1D	80	41
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)OCc1ccc(C(=O)O)cc1	ZINC000819159544	FD	On-Demand	Bother	ACR	22	46
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)OCc1ccc(C(=O)O)cc1	ZINC000819159544	FD	On-Demand	Bother	AKR1C3	15	40
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819159545	GG	On-Demand	Anodyne	CA2	23	46
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819159545	GG	On-Demand	Anodyne	MME	43	43
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819159545	GG	On-Demand	Anodyne	CA5A	15	43
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819159545	GG	On-Demand	Anodyne	HDAC1	35	51
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819159545	GG	On-Demand	Anodyne	HDAC2	34	51
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819159545	GG	On-Demand	Anodyne	HDAC6	23	51
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819159545	GG	On-Demand	Anodyne	FURIN	42	37
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819159545	GG	On-Demand	Anodyne	TPSAB1	17	42
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819159545	GG	On-Demand	Anodyne	RPA1	32	40
O=C(CNC(=O)c1ccc(-c2ccccc2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819159545	GG	On-Demand	Anodyne	SUCNR1	28	40
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)NC1CCCC1	ZINC000819159546	DD	On-Demand	Anodyne	CCR2	42	39
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)NC1CCCC1	ZINC000819159546	DD	On-Demand	Anodyne	EPHX2	30	52
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)NC1CCCC1	ZINC000819159546	DD	On-Demand	Anodyne	TPSAB1	15	42
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)NC1CCCC1	ZINC000819159546	DD	On-Demand	Anodyne	PROC	50	36
O=C(CNC(=O)c1ccc2c(c1)OCO2)OCc1ccc(C(=O)O)cc1	ZINC000819159556	FD	On-Demand	Anodyne	EDNRA	27	41
O=C(CNC(=O)c1ccc2c(c1)OCO2)OCc1ccc(C(=O)O)cc1	ZINC000819159556	FD	On-Demand	Anodyne	BMP1	51	37
O=C(CNC(=O)c1ccc2c(c1)OCO2)OCc1ccc(C(=O)O)cc1	ZINC000819159556	FD	On-Demand	Anodyne	MCHR1	15	42
O=C(COc1ccc2ccc(=O)oc2c1)NC1(C(=O)O)CCCCC1	ZINC000819159558	EE	On-Demand	Anodyne	MAOA	43	43
O=C(COc1ccc2ccc(=O)oc2c1)NC1(C(=O)O)CCCCC1	ZINC000819159558	EE	On-Demand	Anodyne	MAOB	24	47
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	CA2	18	49
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	GRIN2B	17	40
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	LTA4H	23	40
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	KLK3	43	34
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	CTSB	42	47
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	CTSK	28	47
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	PREP	24	44
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	CA5B	20	44
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	CA5A	23	44
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	CAPNS1	59	35
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	HDAC1	15	50
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	HDAC2	16	50
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	FURIN	47	39
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	CAPN1	61	40
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	CAPN2	95	40
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	TGM2	31	42
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	TPSAB1	44	68
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	PROC	43	34
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	NPR	68	38
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	SLC12A5	41	34
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	TMPRSS11D	58	39
O=C(CNC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819159561	ED	On-Demand	Anodyne	PDS	52	39
O=C(CNC(=O)c1ccccc1C(F)(F)F)OCc1ccc(C(=O)O)cc1	ZINC000819159564	GF	On-Demand	Anodyne	RBP4	47	37
O=C(CNC(=O)c1ccccc1C(F)(F)F)OCc1ccc(C(=O)O)cc1	ZINC000819159564	GF	On-Demand	Anodyne	SCD1	24	44
O=C(CNC(=O)c1ccccc1C(F)(F)F)OCc1ccc(C(=O)O)cc1	ZINC000819159564	GF	On-Demand	Anodyne	SCD	27	44
O=C(CNC(=O)c1ccccc1C(F)(F)F)OCc1ccc(C(=O)O)cc1	ZINC000819159564	GF	On-Demand	Anodyne	E3UJZ5_SPOLI	15	43
O=C(COC/C=C/c1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159566	EF	On-Demand	Anodyne	GRIK1	20	40
O=C(COC/C=C\c1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159567	EF	On-Demand	Anodyne	GRIK1	20	40
O=C(CNC(=O)c1cccc(F)c1)OCc1ccc(C(=O)O)cc1	ZINC000819159568	ED	On-Demand	Anodyne	CCR2	40	38
O=C(CNC(=O)c1cccc(F)c1)OCc1ccc(C(=O)O)cc1	ZINC000819159568	ED	On-Demand	Anodyne	KCNK3	17	43
O=C(CNC(=O)c1cc2ccccc2[nH]1)OCc1ccc(C(=O)O)cc1	ZINC000819159569	FE	On-Demand	Anodyne	CCKAR	19	53
O=C(CNC(=O)c1cc2ccccc2[nH]1)OCc1ccc(C(=O)O)cc1	ZINC000819159569	FE	On-Demand	Anodyne	PYGL	62	43
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NC1CCCCCCC1	ZINC000819159573	FF	On-Demand	Anodyne	EPHX2	29	47
O=C(COc1ccc2ccc(=O)oc2c1)OCc1ccc(C(=O)O)cc1	ZINC000819159577	FF	On-Demand	Anodyne	MAOA	40	41
O=C(COc1ccc2ccc(=O)oc2c1)OCc1ccc(C(=O)O)cc1	ZINC000819159577	FF	On-Demand	Anodyne	MAOB	47	57
O=C(COc1ccc2ccc(=O)oc2c1)OCc1ccc(C(=O)O)cc1	ZINC000819159577	FF	On-Demand	Anodyne	PLA2G4B	47	37
O=C(CNC(=O)c1cccnc1)OCc1ccc(C(=O)O)cc1	ZINC000819159579	DD	On-Demand	Anodyne	TBXAS1	66	42
O=C(CNC(=O)c1cccnc1)OCc1ccc(C(=O)O)cc1	ZINC000819159579	DD	On-Demand	Anodyne	PTAFR	18	40
O=C(CCNCCc1ccc(Cl)nc1)Nc1cccc(Br)c1	ZINC000819159581	GH	On-Demand	Anodyne	EGFR	42	44
O=C(COc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)Nc1ccccc1	ZINC000819159582	GF	On-Demand	Anodyne	ACE	53	48
O=C(COc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)Nc1ccccc1	ZINC000819159582	GF	On-Demand	Anodyne	FKBP1A	42	50
O=C(COc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)Nc1ccccc1	ZINC000819159582	GF	On-Demand	Anodyne	LTA4H	30	41
O=C(COc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)Nc1ccccc1	ZINC000819159582	GF	On-Demand	Anodyne	ADORA2B	18	41
O=C(COc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)Nc1ccccc1	ZINC000819159582	GF	On-Demand	Anodyne	CCR3	26	42
O=C(COc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)Nc1ccccc1	ZINC000819159582	GF	On-Demand	Anodyne	CPT1A	117	44
O=C(COc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)Nc1ccccc1	ZINC000819159582	GF	On-Demand	Anodyne	CPT2	50	41
O=C(COc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)Nc1ccccc1	ZINC000819159582	GF	On-Demand	Anodyne	PREP	69	37
O=C(COc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)Nc1ccccc1	ZINC000819159582	GF	On-Demand	Anodyne	EPHX2	27	42
O=C(CNC(=O)c1cccnc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159583	DC	On-Demand	Anodyne	TBXAS1	48	39
O=C(CNC(=O)c1cccnc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159583	DC	On-Demand	Anodyne	ITGAV	27	43
O=C(CNC(=O)c1cccnc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159583	DC	On-Demand	Anodyne	NAMPT	21	40
O=C(CNC(=O)c1ccc(F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819159584	ED	On-Demand	Anodyne	CA2	21	55
O=C(CNC(=O)c1ccc(F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819159584	ED	On-Demand	Anodyne	BCHE	20	40
O=C(CNC(=O)c1ccc(F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819159584	ED	On-Demand	Anodyne	SSTR3	16	43
O=C(CNC(=O)c1ccc(F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819159584	ED	On-Demand	Anodyne	TPSAB1	17	40
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)Nc1cccc2cccnc12	ZINC000819159585	GE	On-Demand	Anodyne	TNKS	15	40
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819159591	ED	On-Demand	Anodyne	CA2	17	53
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819159591	ED	On-Demand	Anodyne	ANPEP	17	41
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819159591	ED	On-Demand	Anodyne	FABP4	41	40
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819159591	ED	On-Demand	Anodyne	CA5B	17	45
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819159591	ED	On-Demand	Anodyne	CA5A	19	45
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819159591	ED	On-Demand	Anodyne	FURIN	47	39
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819159591	ED	On-Demand	Anodyne	F7	19	42
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819159591	ED	On-Demand	Anodyne	TPSAB1	18	42
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819159591	ED	On-Demand	Anodyne	NPFFR1	42	38
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819159591	ED	On-Demand	Anodyne	NAMPT	20	43
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819159591	ED	On-Demand	Anodyne	TMPRSS11D	31	40
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819159591	ED	On-Demand	Anodyne	PDS	44	33
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NC12CC3CC(CC(C3)C1)C2	ZINC000819159592	GE	On-Demand	Anodyne	EPHX2	84	45
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819159594	ED	On-Demand	Anodyne	LTA4H	32	43
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819159594	ED	On-Demand	Anodyne	HDAC2	15	41
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819159594	ED	On-Demand	Anodyne	F7	22	42
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819159594	ED	On-Demand	Anodyne	TPSAB1	18	42
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819159594	ED	On-Demand	Anodyne	NPFFR1	40	38
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)Nc1ccccc1	ZINC000819159594	ED	On-Demand	Anodyne	NAMPT	37	42
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NC1CCCCCC1	ZINC000819159596	FE	On-Demand	Anodyne	EPHX2	29	47
O=C(CNC1(C(=O)O)CCCC1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1	ZINC000819159597	GF	On-Demand	Bother	HDAC9	15	40
O=C(CN1CCS(=O)(=O)CC1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159598	EB	On-Demand	Anodyne	NAALAD2	21	44
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NC1CCCCC1	ZINC000819159599	ED	On-Demand	Anodyne	EPHX2	29	47
O=C(CN1CCO[C@@H](C(=O)O)C1)Nc1cc(-n2cnnn2)ccc1F	ZINC000819159601	FB	On-Demand	Anodyne	KCNJ1	46	34
O=C(CN1CCO[C@H](C(=O)O)C1)Nc1cc(-n2cnnn2)ccc1F	ZINC000819159602	FB	On-Demand	Anodyne	KCNJ1	46	34
O=C(COc1ccc2ccc(=O)oc2c1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159612	FE	On-Demand	Anodyne	MAOA	34	42
O=C(COc1ccc2ccc(=O)oc2c1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159612	FE	On-Demand	Anodyne	MAOB	35	53
O=C(CNC(=O)c1ccccc1)OCc1ccc(C(=O)O)cc1	ZINC000819159616	DD	On-Demand	Anodyne	CA2	24	63
O=C(CNC(=O)c1ccccc1)OCc1ccc(C(=O)O)cc1	ZINC000819159616	DD	On-Demand	Anodyne	GRIN2B	15	43
O=C(CNC(=O)c1ccccc1)OCc1ccc(C(=O)O)cc1	ZINC000819159616	DD	On-Demand	Anodyne	PTGER1	17	44
O=C(CNC(=O)c1ccccc1)OCc1ccc(C(=O)O)cc1	ZINC000819159616	DD	On-Demand	Anodyne	ECR	35	42
O=C(CNC(=O)c1ccccc1)OCc1ccc(C(=O)O)cc1	ZINC000819159616	DD	On-Demand	Anodyne	CTRB1	33	43
O=C(CNC(=O)c1ccccc1)OCc1ccc(C(=O)O)cc1	ZINC000819159616	DD	On-Demand	Anodyne	HDAC1	25	40
O=C(CNC(=O)c1ccccc1)OCc1ccc(C(=O)O)cc1	ZINC000819159616	DD	On-Demand	Anodyne	HDAC2	24	43
O=C(CNC(=O)c1ccccc1)OCc1ccc(C(=O)O)cc1	ZINC000819159616	DD	On-Demand	Anodyne	TPSAB1	30	42
O=C(CNC(=O)c1ccccc1)OCc1ccc(C(=O)O)cc1	ZINC000819159616	DD	On-Demand	Anodyne	NPR	58	33
O=C(CNC(=O)c1ccccc1)OCc1ccc(C(=O)O)cc1	ZINC000819159616	DD	On-Demand	Anodyne	TMPRSS11D	41	34
O=C(CNC(=O)c1ccccc1)OCc1ccc(C(=O)O)cc1	ZINC000819159616	DD	On-Demand	Anodyne	E3UJZ5_SPOLI	31	42
O=C(CN1CCOCC1)Nc1ccc(NC(=O)NC2(C(=O)O)CCCC2)cc1	ZINC000819159617	GD	On-Demand	Anodyne	MTOR	73	39
O=C(CN1CCOCC1)Nc1ccc(NC(=O)NC2(C(=O)O)CCCC2)cc1	ZINC000819159617	GD	On-Demand	Anodyne	EPHX2	43	45
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)Nc1ccc(F)c(F)c1	ZINC000819159618	FE	On-Demand	Anodyne	LTA4H	18	42
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)Nc1ccc(F)c(F)c1	ZINC000819159618	FE	On-Demand	Anodyne	F7	17	40
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	CA2	15	60
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	ACE	51	50
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	OPRM1	19	41
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	FOLH1	23	50
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	MME	140	46
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	ANPEP	94	42
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	TBXAS1	70	47
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	PTAFR	28	45
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	CMA1	46	40
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	CTRA_BOVIN	35	42
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	FCER2	65	33
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	CTSB	27	42
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	PAPA1_CARPA	31	43
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	CTSL	31	43
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	CPA1	61	42
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	ITGA4	24	41
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	CTRB1	25	40
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	NAALAD2	25	43
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	MMP3	15	45
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	ECE1	42	40
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	CAPN1	43	45
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	CTRC	40	40
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	CAPN2	26	42
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	ACE2	98	46
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	LAP3	51	42
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	ITGAV	33	48
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	MMP7	15	45
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	PIN1	42	36
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	MMP1	19	45
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	FPR1	73	39
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	BLA1_STEMA	84	44
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	KISS1R	41	43
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	QRFPR	40	43
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	NPFFR1	49	35
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	NAMPT	37	40
O=C(CNC(=O)c1cccnc1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159620	EC	On-Demand	Anodyne	GPR142	67	36
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	CA2	15	60
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	ACE	51	50
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	OPRM1	19	41
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	FOLH1	23	50
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	MME	140	46
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	ANPEP	94	42
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	TBXAS1	70	47
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	PTAFR	28	45
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	CMA1	46	40
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	CTRA_BOVIN	35	42
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	FCER2	65	33
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	CTSB	27	42
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	PAPA1_CARPA	31	43
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	CTSL	31	43
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	CPA1	61	42
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	ITGA4	24	41
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	CTRB1	25	40
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	NAALAD2	25	43
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	MMP3	15	45
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	ECE1	42	40
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	CAPN1	43	45
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	CTRC	40	40
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	CAPN2	26	42
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	ACE2	98	46
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	LAP3	51	42
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	ITGAV	33	48
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	MMP7	15	45
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	PIN1	42	36
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	MMP1	19	45
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	FPR1	73	39
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	BLA1_STEMA	84	44
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	KISS1R	41	43
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	QRFPR	40	43
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	NPFFR1	49	35
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	NAMPT	37	40
O=C(CNC(=O)c1cccnc1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819159621	EC	On-Demand	Anodyne	GPR142	67	36
O=C(CNC(=O)N1CC[C@@H](C(=O)O)C1)Nc1ccc(Cl)cc1	ZINC000819159622	ED	On-Demand	Anodyne	SLC6A1	48	36
O=C(CNC(=O)N1CC[C@@H](C(=O)O)C1)Nc1ccc(Cl)cc1	ZINC000819159622	ED	On-Demand	Anodyne	EPHX2	45	50
O=C(CNC(=O)N1CC[C@@H](C(=O)O)C1)Nc1ccc(Cl)cc1	ZINC000819159622	ED	On-Demand	Anodyne	MCHR1	17	40
O=C(CNC(=O)N1CC[C@H](C(=O)O)C1)Nc1ccc(Cl)cc1	ZINC000819159623	ED	On-Demand	Anodyne	SLC6A1	48	36
O=C(CNC(=O)N1CC[C@H](C(=O)O)C1)Nc1ccc(Cl)cc1	ZINC000819159623	ED	On-Demand	Anodyne	EPHX2	45	50
O=C(CNC(=O)N1CC[C@H](C(=O)O)C1)Nc1ccc(Cl)cc1	ZINC000819159623	ED	On-Demand	Anodyne	MCHR1	17	40
O=C(CNC(=O)c1cccnc1)NCc1ccc(C(=O)O)cc1	ZINC000819159625	DC	On-Demand	Anodyne	TBXAS1	65	41
O=C(CNC(=O)c1cccnc1)NCc1ccc(C(=O)O)cc1	ZINC000819159625	DC	On-Demand	Anodyne	PTAFR	18	41
O=C(CNC(=O)c1cccnc1)NCc1ccc(C(=O)O)cc1	ZINC000819159625	DC	On-Demand	Anodyne	NAMPT	117	44
O=C(CNS(=O)(=O)c1cccc(F)c1)OCc1ccc(C(=O)O)cc1	ZINC000819159626	FD	On-Demand	Anodyne	AKR1C3	18	44
O=C(CNC(=O)c1cc(F)cc(F)c1)NCc1ccc(C(=O)O)cc1	ZINC000819159627	ED	On-Demand	Anodyne	CA2	17	43
O=C(CNC(=O)c1cc(F)cc(F)c1)NCc1ccc(C(=O)O)cc1	ZINC000819159627	ED	On-Demand	Anodyne	NAMPT	16	40
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NC1CCCC1	ZINC000819159629	ED	On-Demand	Anodyne	SIGMAR1	15	41
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NC1CCCC1	ZINC000819159629	ED	On-Demand	Anodyne	EPHX2	26	45
O=C(CS(=O)(=O)C1CCCC1)OCc1ccc(C(=O)O)cc1	ZINC000819159630	ED	On-Demand	Anodyne	SLC12A5	41	32
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)Nc1cccc2ccccc12	ZINC000819159632	GF	On-Demand	Anodyne	TRPV1	27	51
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)Nc1cccc2ccccc12	ZINC000819159632	GF	On-Demand	Anodyne	NPFFR2	15	40
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)Nc1cccc2ccccc12	ZINC000819159632	GF	On-Demand	Anodyne	HDAC1	22	40
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)Nc1cccc2ccccc12	ZINC000819159632	GF	On-Demand	Anodyne	NPFFR1	20	40
O=C(COc1ccccc1[N+](=O)[O-])OCc1ccc(C(=O)O)cc1	ZINC000819159633	EE	On-Demand	Bother	PTGER1	15	43
O=C(COc1ccccc1[N+](=O)[O-])OCc1ccc(C(=O)O)cc1	ZINC000819159633	EE	On-Demand	Bother	PLA2G4B	22	40
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cccc2ccccc12	ZINC000819159641	FG	On-Demand	Anodyne	ADRB2	62	56
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cccc2ccccc12	ZINC000819159641	FG	On-Demand	Anodyne	ADRB1	90	51
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cccc2ccccc12	ZINC000819159641	FG	On-Demand	Anodyne	ADRB3	71	51
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cccc2ccccc12	ZINC000819159641	FG	On-Demand	Anodyne	CASR	40	39
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cccc2ccccc12	ZINC000819159641	FG	On-Demand	Anodyne	CYP2D6	18	42
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cccc2ccccc12	ZINC000819159641	FG	On-Demand	Anodyne	ABCB1	21	43
O[C@H](CNCCc1ccc(Cl)nc1)COc1cccc2ccccc12	ZINC000819159642	FG	On-Demand	Anodyne	ADRB2	62	56
O[C@H](CNCCc1ccc(Cl)nc1)COc1cccc2ccccc12	ZINC000819159642	FG	On-Demand	Anodyne	ADRB1	90	51
O[C@H](CNCCc1ccc(Cl)nc1)COc1cccc2ccccc12	ZINC000819159642	FG	On-Demand	Anodyne	ADRB3	71	51
O[C@H](CNCCc1ccc(Cl)nc1)COc1cccc2ccccc12	ZINC000819159642	FG	On-Demand	Anodyne	CASR	40	39
O[C@H](CNCCc1ccc(Cl)nc1)COc1cccc2ccccc12	ZINC000819159642	FG	On-Demand	Anodyne	CYP2D6	18	42
O[C@H](CNCCc1ccc(Cl)nc1)COc1cccc2ccccc12	ZINC000819159642	FG	On-Demand	Anodyne	ABCB1	21	43
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc(F)cc1	ZINC000819159646	DE	On-Demand	Anodyne	ADRB2	60	58
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc(F)cc1	ZINC000819159646	DE	On-Demand	Anodyne	ADRB1	99	58
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc(F)cc1	ZINC000819159646	DE	On-Demand	Anodyne	GRIN1	32	59
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc(F)cc1	ZINC000819159646	DE	On-Demand	Anodyne	ADRB3	71	58
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc(F)cc1	ZINC000819159647	DE	On-Demand	Anodyne	ADRB2	60	58
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc(F)cc1	ZINC000819159647	DE	On-Demand	Anodyne	ADRB1	99	58
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc(F)cc1	ZINC000819159647	DE	On-Demand	Anodyne	GRIN1	32	59
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc(F)cc1	ZINC000819159647	DE	On-Demand	Anodyne	ADRB3	71	58
N#Cc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159648	EE	On-Demand	Mild	ADRB2	52	56
N#Cc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159648	EE	On-Demand	Mild	ADRB1	89	56
N#Cc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159648	EE	On-Demand	Mild	GRIN1	27	49
N#Cc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159648	EE	On-Demand	Mild	ADRB3	58	56
N#Cc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159649	EE	On-Demand	Mild	ADRB2	52	56
N#Cc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159649	EE	On-Demand	Mild	ADRB1	89	56
N#Cc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159649	EE	On-Demand	Mild	GRIN1	27	49
N#Cc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159649	EE	On-Demand	Mild	ADRB3	58	56
O=C(CNC(=O)C1CC1)OCc1ccc(C(=O)O)cc1	ZINC000819159659	CC	On-Demand	Anodyne	FKBP1A	17	40
O=C(CNC(=O)C1CC1)OCc1ccc(C(=O)O)cc1	ZINC000819159659	CC	On-Demand	Anodyne	LTA4H	20	45
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159661	EE	On-Demand	Bother	COLA	44	32
COC(=O)NC(C)(C)C(=O)NCC1(c2ccc(C)cc2C)CCCC1	ZINC000819159668	EG	On-Demand	Anodyne	NMBR	59	33
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	ACE	25	51
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	OPRM1	20	40
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	OPRD1	21	40
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	CELA1	18	42
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	MME	59	41
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	ANPEP	57	42
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	CASP3	20	52
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	BMP1	16	40
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	KLK3	72	37
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	CTSB	70	48
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	PAPA1_CARPA	54	39
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	CYSP_TRYCR	51	39
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	CTSK	39	48
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	CTSL	46	42
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	PGA	27	42
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	NAALAD2	28	41
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	CAPNS1	67	39
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	GSTP1	20	43
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	CTSS	21	48
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	CAPN1	92	46
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	CASP1	25	49
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	CAPN2	139	48
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	CASP9	25	41
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	TGM2	24	47
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	TPSAB1	29	48
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	NPR	92	46
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	CASP10	23	41
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	NAAA	26	42
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	PSMB5	25	40
O=C(CNC(=O)OCc1ccccc1)N[C@H](C(=O)O)c1ccccc1	ZINC000819159669	ED	On-Demand	Anodyne	QRFPR	17	42
O=C(COc1ccc(F)cc1)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819159671	FD	On-Demand	Reactive	LTA4H	22	41
O=C(COc1ccc(F)cc1)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819159671	FD	On-Demand	Reactive	UL80	25	44
O=C(COc1ccc(F)cc1)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819159671	FD	On-Demand	Reactive	PLA2G4B	61	40
O=C(CNC(=O)c1ccncc1)NCc1ccc(C(=O)O)cc1	ZINC000819159673	DC	On-Demand	Anodyne	CA2	18	50
O=C(CNC(=O)c1ccncc1)NCc1ccc(C(=O)O)cc1	ZINC000819159673	DC	On-Demand	Anodyne	TPSAB1	15	40
O=C(CNC(=O)c1ccncc1)NCc1ccc(C(=O)O)cc1	ZINC000819159673	DC	On-Demand	Anodyne	NAMPT	59	40
O=C(CNC(=O)c1ccc(F)cc1)OCc1ccc(C(=O)O)cc1	ZINC000819159674	ED	On-Demand	Anodyne	CA2	18	54
O=C(CNC(=O)c1ccc(F)cc1)OCc1ccc(C(=O)O)cc1	ZINC000819159674	ED	On-Demand	Anodyne	TPSAB1	24	40
O=C(CN1CCOCC1)Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819159676	GC	On-Demand	Anodyne	MTOR	77	39
O=C(CN1CCOCC1)Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819159676	GC	On-Demand	Anodyne	EPHX2	39	40
O=C(CN1CCOCC1)Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819159678	GC	On-Demand	Anodyne	MTOR	77	39
O=C(CN1CCOCC1)Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819159678	GC	On-Demand	Anodyne	EPHX2	39	40
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)Nc1cccnc1	ZINC000819159680	ED	On-Demand	Anodyne	LTA4H	15	43
O=C(CNC(=O)NCc1ccc(C(=O)O)cc1)Nc1cccnc1	ZINC000819159680	ED	On-Demand	Anodyne	NAMPT	92	51
O=C(CNC(=O)c1ccc(F)c(F)c1)NCc1ccc(C(=O)O)cc1	ZINC000819159686	ED	On-Demand	Anodyne	CA2	16	40
O=C(CNC(=O)c1ccc(F)c(F)c1)NCc1ccc(C(=O)O)cc1	ZINC000819159686	ED	On-Demand	Anodyne	CCR2	35	40
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159691	FD	On-Demand	Bother	ACE	37	44
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159691	FD	On-Demand	Bother	MME	97	43
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159691	FD	On-Demand	Bother	ANPEP	48	36
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159691	FD	On-Demand	Bother	CMA1	15	40
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159691	FD	On-Demand	Bother	CPA1	42	41
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159691	FD	On-Demand	Bother	ECE1	32	41
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159691	FD	On-Demand	Bother	ACE2	87	41
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159691	FD	On-Demand	Bother	FPR1	65	37
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159691	FD	On-Demand	Bother	BLA1_STEMA	74	46
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819159691	FD	On-Demand	Bother	BRCA1	50	31
C#Cc1cncc(C(=O)NCCc2ccc(Cl)c(OC)c2)c1	ZINC000819159703	DF	On-Demand	Mild	DRD3	18	40
C#CCN1CCC(C(=O)NCC2(c3ccc(C)cc3C)CCCC2)CC1	ZINC000819159743	FH	On-Demand	Mild	EPHX2	27	41
C#CCN1CCC(C(=O)NCC2(c3ccc(C)cc3C)CCCC2)CC1	ZINC000819159743	FH	On-Demand	Mild	CACNA1G	22	44
NC(=O)NC(=O)CCNCCc1ccc(Cl)nc1	ZINC000819159813	CC	On-Demand	Anodyne	NACHRBETA2	50	37
O[C@@H](CNCCOc1ncccc1Cl)c1ccc(Cl)c(F)c1	ZINC000819159841	EG	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CNCCOc1ncccc1Cl)c1ccc(Cl)c(F)c1	ZINC000819159841	EG	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CNCCOc1ncccc1Cl)c1ccc(Cl)c(F)c1	ZINC000819159842	EG	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CNCCOc1ncccc1Cl)c1ccc(Cl)c(F)c1	ZINC000819159842	EG	On-Demand	Anodyne	ADRB1	26	40
COC(=O)N1CCC(NC(=O)C2(c3ccc(C)cc3)CCC2)CC1	ZINC000819159845	EF	On-Demand	Anodyne	EPHX2	24	40
Cc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159856	DF	On-Demand	Anodyne	ADRB2	65	58
Cc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159856	DF	On-Demand	Anodyne	ADRB1	101	58
Cc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159856	DF	On-Demand	Anodyne	GRIN1	32	53
Cc1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159856	DF	On-Demand	Anodyne	ADRB3	78	58
Cc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159857	DF	On-Demand	Anodyne	ADRB2	65	58
Cc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159857	DF	On-Demand	Anodyne	ADRB1	101	58
Cc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159857	DF	On-Demand	Anodyne	GRIN1	32	53
Cc1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819159857	DF	On-Demand	Anodyne	ADRB3	78	58
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(F)cc1F	ZINC000819159858	DF	On-Demand	Anodyne	ADRB2	42	38
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(F)cc1F	ZINC000819159858	DF	On-Demand	Anodyne	ADRB1	46	42
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(F)cc1F	ZINC000819159858	DF	On-Demand	Anodyne	ADRB3	53	42
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(F)cc1F	ZINC000819159859	DF	On-Demand	Anodyne	ADRB2	42	38
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(F)cc1F	ZINC000819159859	DF	On-Demand	Anodyne	ADRB1	46	42
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(F)cc1F	ZINC000819159859	DF	On-Demand	Anodyne	ADRB3	53	42
O[C@@H](CNCCOc1ncccc1Cl)c1ccc(Cl)cc1	ZINC000819159873	EG	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNCCOc1ncccc1Cl)c1ccc(Cl)cc1	ZINC000819159873	EG	On-Demand	Anodyne	ADRB3	34	41
O[C@@H](CNCCOc1ncccc1Cl)c1ccccc1	ZINC000819159874	CE	On-Demand	Anodyne	ADRB2	24	44
O[C@@H](CNCCOc1ncccc1Cl)c1ccccc1	ZINC000819159874	CE	On-Demand	Anodyne	ADRB1	44	44
O[C@@H](CNCCOc1ncccc1Cl)c1ccccc1	ZINC000819159874	CE	On-Demand	Anodyne	ADRB3	67	44
O[C@H](CNCCOc1ncccc1Cl)c1ccccc1	ZINC000819159875	CE	On-Demand	Anodyne	ADRB2	24	44
O[C@H](CNCCOc1ncccc1Cl)c1ccccc1	ZINC000819159875	CE	On-Demand	Anodyne	ADRB1	44	44
O[C@H](CNCCOc1ncccc1Cl)c1ccccc1	ZINC000819159875	CE	On-Demand	Anodyne	ADRB3	67	44
CCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)O)c2)C1	ZINC000819159885	ED	On-Demand	Anodyne	TGM2	54	38
CCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)O)c2)C1	ZINC000819159885	ED	On-Demand	Anodyne	F13A1	58	38
CCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)O)c2)C1	ZINC000819159885	ED	On-Demand	Anodyne	NOD2	20	48
CCOC(Cn1ncc(C(=O)NCC2(c3ccc(C)cc3C)CCCC2)c1N)OCC	ZINC000819159924	IH	On-Demand	Anodyne	HCN1	62	33
CCOC(Cn1ncc(C(=O)NCC2(c3ccc(C)cc3C)CCCC2)c1N)OCC	ZINC000819159924	IH	On-Demand	Anodyne	HCN4	49	32
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccc(N3CCOCC3)c3ccncc23)ccc1Cl	ZINC000819159930	IG	On-Demand	Bother	PIK3C3	23	43
CC(C)(C)OC(=O)NC[C@H]1CC(C(=O)NCCC(C)(C)C2CC2)=NO1	ZINC000819159935	FF	On-Demand	Anodyne	MLYCD	19	44
CC(C)(C)OC(=O)NC[C@@H]1CC(C(=O)NCCC(C)(C)C2CC2)=NO1	ZINC000819159936	FF	On-Demand	Anodyne	MLYCD	19	44
CCOC(=O)N1CCC(C(=O)NCC2(c3ccc(C)cc3C)CCCC2)CC1	ZINC000819159939	GI	On-Demand	Anodyne	EPHX2	29	43
CCN(CC)S(=O)(=O)c1cc(C(=O)NCCc2ccc(Cl)c(OC)c2)ccc1F	ZINC000819159960	IG	On-Demand	Anodyne	CPT1A	59	36
CCN(CC)S(=O)(=O)c1cc(C(=O)NCCc2ccc(Cl)c(OC)c2)ccc1F	ZINC000819159960	IG	On-Demand	Anodyne	CPT1B	62	35
CCN(CC)S(=O)(=O)c1cc(C(=O)NCCc2ccc(Cl)c(OC)c2)ccc1F	ZINC000819159960	IG	On-Demand	Anodyne	PTGDR	35	45
CCN(CC)S(=O)(=O)c1cc(C(=O)NCCc2ccc(Cl)c(OC)c2)ccc1F	ZINC000819159960	IG	On-Demand	Anodyne	PTGDR2	30	45
O[C@@H](CCc1ccccc1)CNCCc1ccc(Cl)nc1	ZINC000819159987	DF	On-Demand	Anodyne	ADRB2	49	44
O[C@@H](CCc1ccccc1)CNCCc1ccc(Cl)nc1	ZINC000819159987	DF	On-Demand	Anodyne	ADRB1	69	45
O[C@@H](CCc1ccccc1)CNCCc1ccc(Cl)nc1	ZINC000819159987	DF	On-Demand	Anodyne	ADRB3	85	45
O[C@H](CCc1ccccc1)CNCCc1ccc(Cl)nc1	ZINC000819159988	DF	On-Demand	Anodyne	ADRB2	49	44
O[C@H](CCc1ccccc1)CNCCc1ccc(Cl)nc1	ZINC000819159988	DF	On-Demand	Anodyne	ADRB1	69	45
O[C@H](CCc1ccccc1)CNCCc1ccc(Cl)nc1	ZINC000819159988	DF	On-Demand	Anodyne	ADRB3	85	45
CCN(Cc1ccccc1)C(=O)CNC(=O)/C=C\[C@H]1CCCO1	ZINC000819159989	DD	On-Demand	Anodyne	LIMK2	19	40
CCN(Cc1ccccc1)C(=O)CNC(=O)/C=C/[C@@H]1CCCO1	ZINC000819159990	DD	On-Demand	Anodyne	LIMK2	19	40
CCN(Cc1ccccc1)C(=O)CNC(=O)/C=C/[C@H]1CCCO1	ZINC000819159991	DD	On-Demand	Anodyne	LIMK2	19	40
CCN(Cc1ccccc1)C(=O)CNC(=O)/C=C\[C@@H]1CCCO1	ZINC000819159992	DD	On-Demand	Anodyne	LIMK2	19	40
O[C@H](CNCCc1ccc(Cl)nc1)COCc1ccco1	ZINC000819160003	DE	On-Demand	Anodyne	ADRB2	25	42
O[C@H](CNCCc1ccc(Cl)nc1)COCc1ccco1	ZINC000819160003	DE	On-Demand	Anodyne	ADRB1	44	42
O[C@H](CNCCc1ccc(Cl)nc1)COCc1ccco1	ZINC000819160003	DE	On-Demand	Anodyne	ADRB3	39	42
O[C@@H](CNCCc1ccc(Cl)nc1)COCc1ccco1	ZINC000819160004	DE	On-Demand	Anodyne	ADRB2	25	42
O[C@@H](CNCCc1ccc(Cl)nc1)COCc1ccco1	ZINC000819160004	DE	On-Demand	Anodyne	ADRB1	44	42
O[C@@H](CNCCc1ccc(Cl)nc1)COCc1ccco1	ZINC000819160004	DE	On-Demand	Anodyne	ADRB3	39	42
CC(=O)c1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819160011	EF	On-Demand	Anodyne	ADRB2	61	55
CC(=O)c1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819160011	EF	On-Demand	Anodyne	ADRB1	115	55
CC(=O)c1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819160011	EF	On-Demand	Anodyne	GRIN1	32	52
CC(=O)c1ccc(OC[C@@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819160011	EF	On-Demand	Anodyne	ADRB3	88	55
CC(=O)c1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819160012	EF	On-Demand	Anodyne	ADRB2	61	55
CC(=O)c1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819160012	EF	On-Demand	Anodyne	ADRB1	115	55
CC(=O)c1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819160012	EF	On-Demand	Anodyne	GRIN1	32	52
CC(=O)c1ccc(OC[C@H](O)CNCCc2ccc(Cl)nc2)cc1	ZINC000819160012	EF	On-Demand	Anodyne	ADRB3	88	55
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(N2CCCCC2)CC1	ZINC000819160013	FE	On-Demand	Anodyne	L3MBTL3	86	41
O=C(CCNCCc1ccc(Cl)nc1)Nc1ccccc1	ZINC000819160014	DF	On-Demand	Anodyne	ADRB1	28	42
O=C(CCNCCc1ccc(Cl)nc1)Nc1ccccc1	ZINC000819160014	DF	On-Demand	Anodyne	ADRB3	40	42
O=C(CCNCCc1ccc(Cl)nc1)Nc1ccccc1	ZINC000819160014	DF	On-Demand	Anodyne	HDAC10	19	40
O=C(CCNCCc1ccc(Cl)nc1)Nc1ccccc1	ZINC000819160014	DF	On-Demand	Anodyne	HDAC1	15	42
O=C(CCNCCc1ccc(Cl)nc1)Nc1ccccc1	ZINC000819160014	DF	On-Demand	Anodyne	HDAC2	15	40
O=C(CCNCCc1ccc(Cl)nc1)Nc1ccccc1	ZINC000819160014	DF	On-Demand	Anodyne	HDAC3	18	40
O=C(CCNCCc1ccc(Cl)nc1)Nc1ccccc1	ZINC000819160014	DF	On-Demand	Anodyne	HDAC6	15	40
O=C(CCNCCc1ccc(Cl)nc1)Nc1ccccc1	ZINC000819160014	DF	On-Demand	Anodyne	NACHRBETA2	40	33
O[C@@H](CNCCc1ccc(Cl)nc1)COCc1ccccc1	ZINC000819160039	DE	On-Demand	Anodyne	ADRB2	47	46
O[C@@H](CNCCc1ccc(Cl)nc1)COCc1ccccc1	ZINC000819160039	DE	On-Demand	Anodyne	ADRB1	75	47
O[C@@H](CNCCc1ccc(Cl)nc1)COCc1ccccc1	ZINC000819160039	DE	On-Demand	Anodyne	ADRB3	67	47
O[C@H](CNCCc1ccc(Cl)nc1)COCc1ccccc1	ZINC000819160040	DE	On-Demand	Anodyne	ADRB2	47	46
O[C@H](CNCCc1ccc(Cl)nc1)COCc1ccccc1	ZINC000819160040	DE	On-Demand	Anodyne	ADRB1	75	47
O[C@H](CNCCc1ccc(Cl)nc1)COCc1ccccc1	ZINC000819160040	DE	On-Demand	Anodyne	ADRB3	67	47
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cccc(C(F)(F)F)c1	ZINC000819160051	FG	On-Demand	Anodyne	ADRB2	49	46
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cccc(C(F)(F)F)c1	ZINC000819160051	FG	On-Demand	Anodyne	ADRB1	81	47
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cccc(C(F)(F)F)c1	ZINC000819160051	FG	On-Demand	Anodyne	GRIN1	15	50
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cccc(C(F)(F)F)c1	ZINC000819160051	FG	On-Demand	Anodyne	ADRB3	68	47
O[C@@H](CNCCc1ccc(Cl)nc1)COc1cccc(C(F)(F)F)c1	ZINC000819160051	FG	On-Demand	Anodyne	PDS	54	46
O[C@H](CNCCc1ccc(Cl)nc1)COc1cccc(C(F)(F)F)c1	ZINC000819160052	FG	On-Demand	Anodyne	ADRB2	49	46
O[C@H](CNCCc1ccc(Cl)nc1)COc1cccc(C(F)(F)F)c1	ZINC000819160052	FG	On-Demand	Anodyne	ADRB1	81	47
O[C@H](CNCCc1ccc(Cl)nc1)COc1cccc(C(F)(F)F)c1	ZINC000819160052	FG	On-Demand	Anodyne	GRIN1	15	50
O[C@H](CNCCc1ccc(Cl)nc1)COc1cccc(C(F)(F)F)c1	ZINC000819160052	FG	On-Demand	Anodyne	ADRB3	68	47
O[C@H](CNCCc1ccc(Cl)nc1)COc1cccc(C(F)(F)F)c1	ZINC000819160052	FG	On-Demand	Anodyne	PDS	54	46
N#CCCNCCc1ccc(Cl)nc1	ZINC000819160057	BD	On-Demand	Mild	Q8WSF8_APLCA	43	40
N#CCCNCCc1ccc(Cl)nc1	ZINC000819160057	BD	On-Demand	Mild	NACHRBETA2	54	40
N#C[C@H]1CC[C@@H](NS(=O)(=O)c2cc(C(=O)O)ccc2F)C1	ZINC000819160068	DD	On-Demand	Mild	SFRP1	117	38
N#C[C@H]1CC[C@@H](NS(=O)(=O)c2cc(C(=O)O)ccc2F)C1	ZINC000819160068	DD	On-Demand	Mild	WNT3	74	32
O=C(/C=C/[C@H]1CCCO1)N1CCC(N2CCCCC2)CC1	ZINC000819160069	CE	On-Demand	Anodyne	L3MBTL3	96	48
O=C(/C=C/[C@@H]1CCCO1)N1CCC(N2CCCCC2)CC1	ZINC000819160070	CE	On-Demand	Anodyne	L3MBTL3	96	48
O=C(/C=C\[C@H]1CCCO1)N1CCC(N2CCCCC2)CC1	ZINC000819160071	CE	On-Demand	Anodyne	L3MBTL3	96	48
O=C(/C=C\[C@@H]1CCCO1)N1CCC(N2CCCCC2)CC1	ZINC000819160072	CE	On-Demand	Anodyne	L3MBTL3	96	48
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)cc1Cl	ZINC000819160073	GH	On-Demand	Anodyne	ADRB2	41	45
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)cc1Cl	ZINC000819160073	GH	On-Demand	Anodyne	ADRB1	74	44
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)cc1Cl	ZINC000819160073	GH	On-Demand	Anodyne	ADRB3	58	44
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)cc1Cl	ZINC000819160074	GH	On-Demand	Anodyne	ADRB2	41	45
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)cc1Cl	ZINC000819160074	GH	On-Demand	Anodyne	ADRB1	74	44
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc(Cl)cc1Cl	ZINC000819160074	GH	On-Demand	Anodyne	ADRB3	58	44
O[C@@H](CNCCOc1ncccc1Cl)c1cccc(Cl)c1	ZINC000819160075	EG	On-Demand	Anodyne	ADRB2	41	42
O[C@@H](CNCCOc1ncccc1Cl)c1cccc(Cl)c1	ZINC000819160075	EG	On-Demand	Anodyne	ADRB1	64	50
O[C@@H](CNCCOc1ncccc1Cl)c1cccc(Cl)c1	ZINC000819160075	EG	On-Demand	Anodyne	ADRB3	81	50
O[C@H](CNCCOc1ncccc1Cl)c1cccc(Cl)c1	ZINC000819160076	EG	On-Demand	Anodyne	ADRB2	41	42
O[C@H](CNCCOc1ncccc1Cl)c1cccc(Cl)c1	ZINC000819160076	EG	On-Demand	Anodyne	ADRB1	64	50
O[C@H](CNCCOc1ncccc1Cl)c1cccc(Cl)c1	ZINC000819160076	EG	On-Demand	Anodyne	ADRB3	81	50
O[C@@H](CNCCc1ccc(Cl)nc1)c1cc(F)ccc1F	ZINC000819160077	DF	On-Demand	Anodyne	ADRB1	37	42
O[C@@H](CNCCc1ccc(Cl)nc1)c1cc(F)ccc1F	ZINC000819160077	DF	On-Demand	Anodyne	ADRB3	53	42
O[C@H](CNCCc1ccc(Cl)nc1)c1cc(F)ccc1F	ZINC000819160078	DF	On-Demand	Anodyne	ADRB1	37	42
O[C@H](CNCCc1ccc(Cl)nc1)c1cc(F)ccc1F	ZINC000819160078	DF	On-Demand	Anodyne	ADRB3	53	42
C#CCNS(=O)(=O)c1ccc(C(=O)NCCc2ccc(Cl)c(OC)c2)cc1	ZINC000819160091	HE	On-Demand	Mild	TBXA2R	47	40
C#CCNS(=O)(=O)c1ccc(C(=O)NCCc2ccc(Cl)c(OC)c2)cc1	ZINC000819160091	HE	On-Demand	Mild	PTGDR	21	43
C#CCNS(=O)(=O)c1ccc(C(=O)NCCc2ccc(Cl)c(OC)c2)cc1	ZINC000819160091	HE	On-Demand	Mild	CA9	15	41
C#CCNS(=O)(=O)c1ccc(C(=O)NCCc2ccc(Cl)c(OC)c2)cc1	ZINC000819160091	HE	On-Demand	Mild	PTGDR2	19	43
C#CCNS(=O)(=O)c1ccc(C(=O)NCCc2ccc(Cl)c(OC)c2)cc1	ZINC000819160091	HE	On-Demand	Mild	CYNT	18	42
C#CCNS(=O)(=O)c1ccc(C(=O)NCCc2ccc(Cl)c(OC)c2)cc1	ZINC000819160091	HE	On-Demand	Mild	A6YCJ1_9METZ	15	44
C#CCCCCCC(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160105	DH	On-Demand	Mild	MTNR1A	15	42
C#CCCCCCC(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160105	DH	On-Demand	Mild	MTNR1B	15	42
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160130	GH	On-Demand	Anodyne	PAPA1_CARPA	44	52
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160130	GH	On-Demand	Anodyne	CTSK	19	40
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160130	GH	On-Demand	Anodyne	CTSL	20	44
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160130	GH	On-Demand	Anodyne	FPR1	42	38
CO/C(=C\c1ccccc1)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160140	EH	On-Demand	Anodyne	MTNR1B	18	40
CO/C(=C/c1ccccc1)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160141	EH	On-Demand	Anodyne	MTNR1B	18	40
COC(=O)Nc1cc(C(=O)NCCc2ccc(Cl)c(OC)c2)cc(C(F)(F)F)c1	ZINC000819160149	IJ	On-Demand	Anodyne	RAF1	35	42
CCOC(=O)N[C@H](C(=O)NCCc1ccc(Cl)c(OC)c1)C(C)C	ZINC000819160155	FF	On-Demand	Anodyne	CASP3	16	43
CCOC(=O)N[C@H](C(=O)NCCc1ccc(Cl)c(OC)c1)C(C)C	ZINC000819160155	FF	On-Demand	Anodyne	TRPV1	15	41
CCOC(=O)N[C@H](C(=O)NCCc1ccc(Cl)c(OC)c1)C(C)C	ZINC000819160155	FF	On-Demand	Anodyne	HLA-DRB1	74	42
CCOC(=O)N[C@@H](C(=O)NCCc1ccc(Cl)c(OC)c1)C(C)C	ZINC000819160156	FF	On-Demand	Anodyne	CASP3	16	43
CCOC(=O)N[C@@H](C(=O)NCCc1ccc(Cl)c(OC)c1)C(C)C	ZINC000819160156	FF	On-Demand	Anodyne	TRPV1	15	41
CCOC(=O)N[C@@H](C(=O)NCCc1ccc(Cl)c(OC)c1)C(C)C	ZINC000819160156	FF	On-Demand	Anodyne	HLA-DRB1	74	42
C=CCNS(=O)(=O)c1cc(C(=O)NCCc2ccc(Cl)c(OC)c2)ccc1F	ZINC000819160160	IF	On-Demand	Mild	CPT1A	48	35
C=CCNS(=O)(=O)c1cc(C(=O)NCCc2ccc(Cl)c(OC)c2)ccc1F	ZINC000819160160	IF	On-Demand	Mild	CPT1B	45	34
C=CCNS(=O)(=O)c1cc(C(=O)NCCc2ccc(Cl)c(OC)c2)ccc1F	ZINC000819160160	IF	On-Demand	Mild	PTGDR	33	43
C=CCNS(=O)(=O)c1cc(C(=O)NCCc2ccc(Cl)c(OC)c2)ccc1F	ZINC000819160160	IF	On-Demand	Mild	PTGDR2	24	43
CCCCSCC(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160161	DH	On-Demand	Anodyne	MTNR1A	25	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNS(=O)(=O)c1cccc(C(=O)O)c1)C2	ZINC000819160191	GD	On-Demand	Anodyne	AKR1C3	49	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNS(=O)(=O)c1cccc(C(=O)O)c1)C2	ZINC000819160191	GD	On-Demand	Anodyne	SFRP1	73	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNS(=O)(=O)c1cccc(C(=O)O)c1)C2	ZINC000819160191	GD	On-Demand	Anodyne	WNT3	49	31
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC(=O)N1CCCc2ccccc21	ZINC000819160193	FD	On-Demand	Anodyne	AVPR2	36	43
NC(=O)CCNCCc1ccc(Cl)nc1	ZINC000819160202	BC	On-Demand	Anodyne	Q8WSF8_APLCA	41	38
NC(=O)CCNCCc1ccc(Cl)nc1	ZINC000819160202	BC	On-Demand	Anodyne	NACHRBETA2	54	38
COCC(C)(C)N1CCN(S(=O)(=O)c2ccc(F)c(C(=O)O)c2)CC1	ZINC000819160210	FD	On-Demand	Anodyne	PKM	44	42
COCC(C)(C)N1CCN(S(=O)(=O)c2ccc(F)c(C(=O)O)c2)CC1	ZINC000819160210	FD	On-Demand	Anodyne	TGM2	44	34
COCC(C)(C)N1CCN(S(=O)(=O)c2ccc(F)c(C(=O)O)c2)CC1	ZINC000819160210	FD	On-Demand	Anodyne	F13A1	55	34
O=C(NCC(=O)N1CCCc2ccccc21)C(F)=C1CCC1	ZINC000819160212	DE	On-Demand	Anodyne	AVPR2	39	42
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccccc1F	ZINC000819160213	CF	On-Demand	Anodyne	ADRB2	49	40
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccccc1F	ZINC000819160213	CF	On-Demand	Anodyne	ADRB1	58	41
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccccc1F	ZINC000819160213	CF	On-Demand	Anodyne	ADRB3	78	41
O[C@H](CNCCc1ccc(Cl)nc1)c1ccccc1F	ZINC000819160214	CF	On-Demand	Anodyne	ADRB2	49	40
O[C@H](CNCCc1ccc(Cl)nc1)c1ccccc1F	ZINC000819160214	CF	On-Demand	Anodyne	ADRB1	58	41
O[C@H](CNCCc1ccc(Cl)nc1)c1ccccc1F	ZINC000819160214	CF	On-Demand	Anodyne	ADRB3	78	41
COC(=O)N1CCC(NC(=O)c2cnc(OC)c(Br)c2)CC1	ZINC000819160215	FD	On-Demand	Anodyne	SSTR5	44	39
COC(=O)N1CCC(NC(=O)c2cnc(OC)c(Br)c2)CC1	ZINC000819160215	FD	On-Demand	Anodyne	HPGDS	34	41
CCN(Cc1ccccc1)C(=O)CNC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819160216	GE	On-Demand	Anodyne	CTSB	15	45
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccccc1	ZINC000819160223	DE	On-Demand	Anodyne	ADRB2	83	61
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccccc1	ZINC000819160223	DE	On-Demand	Anodyne	ADRB1	131	65
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccccc1	ZINC000819160223	DE	On-Demand	Anodyne	GRIN1	30	50
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccccc1	ZINC000819160223	DE	On-Demand	Anodyne	ADRB3	115	65
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccccc1	ZINC000819160224	DE	On-Demand	Anodyne	ADRB2	83	61
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccccc1	ZINC000819160224	DE	On-Demand	Anodyne	ADRB1	131	65
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccccc1	ZINC000819160224	DE	On-Demand	Anodyne	GRIN1	30	50
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccccc1	ZINC000819160224	DE	On-Demand	Anodyne	ADRB3	115	65
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(F)cc1	ZINC000819160230	CF	On-Demand	Anodyne	ADRB2	48	48
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(F)cc1	ZINC000819160230	CF	On-Demand	Anodyne	ADRB1	52	41
O[C@@H](CNCCc1ccc(Cl)nc1)c1ccc(F)cc1	ZINC000819160230	CF	On-Demand	Anodyne	ADRB3	96	41
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(F)cc1	ZINC000819160231	CF	On-Demand	Anodyne	ADRB2	48	48
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(F)cc1	ZINC000819160231	CF	On-Demand	Anodyne	ADRB1	52	41
O[C@H](CNCCc1ccc(Cl)nc1)c1ccc(F)cc1	ZINC000819160231	CF	On-Demand	Anodyne	ADRB3	96	41
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819160236	FE	On-Demand	Bother	ADRB2	53	51
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819160236	FE	On-Demand	Bother	ADRB1	88	51
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819160236	FE	On-Demand	Bother	ADRB3	78	51
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819160236	FE	On-Demand	Bother	ABCB1	15	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819160237	FE	On-Demand	Bother	ADRB2	53	51
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819160237	FE	On-Demand	Bother	ADRB1	88	51
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819160237	FE	On-Demand	Bother	ADRB3	78	51
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819160237	FE	On-Demand	Bother	ABCB1	15	40
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc2c(c1)OCO2	ZINC000819160243	FE	On-Demand	Anodyne	ADRB2	40	48
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc2c(c1)OCO2	ZINC000819160243	FE	On-Demand	Anodyne	ADRB1	70	48
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc2c(c1)OCO2	ZINC000819160243	FE	On-Demand	Anodyne	GRIN1	27	58
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc2c(c1)OCO2	ZINC000819160243	FE	On-Demand	Anodyne	ADRB3	51	48
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc2c(c1)OCO2	ZINC000819160244	FE	On-Demand	Anodyne	ADRB2	40	48
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc2c(c1)OCO2	ZINC000819160244	FE	On-Demand	Anodyne	ADRB1	70	48
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc2c(c1)OCO2	ZINC000819160244	FE	On-Demand	Anodyne	GRIN1	27	58
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc2c(c1)OCO2	ZINC000819160244	FE	On-Demand	Anodyne	ADRB3	51	48
N#Cc1ccc([C@@H](O)CNCCOc2ncccc2Cl)cc1	ZINC000819160249	DE	On-Demand	Mild	ADRB3	18	40
N#Cc1ccc([C@H](O)CNCCOc2ncccc2Cl)cc1	ZINC000819160250	DE	On-Demand	Mild	ADRB3	18	40
CN1C[C@@H]2CCCN(S(=O)(=O)c3ccc(F)c(C(=O)O)c3)[C@@H]2C1	ZINC000819160251	ED	On-Demand	Anodyne	CASP3	79	37
CN1C[C@@H]2CCCN(S(=O)(=O)c3ccc(F)c(C(=O)O)c3)[C@@H]2C1	ZINC000819160251	ED	On-Demand	Anodyne	CASP7	101	37
O[C@H](CNCCOc1ncccc1Cl)c1cccnc1	ZINC000819160252	CD	On-Demand	Anodyne	ADRB2	31	55
O[C@H](CNCCOc1ncccc1Cl)c1cccnc1	ZINC000819160252	CD	On-Demand	Anodyne	ADRB1	46	55
O[C@H](CNCCOc1ncccc1Cl)c1cccnc1	ZINC000819160252	CD	On-Demand	Anodyne	ADRB3	116	57
O[C@@H](CNCCOc1ncccc1Cl)c1cccnc1	ZINC000819160253	CD	On-Demand	Anodyne	ADRB2	31	55
O[C@@H](CNCCOc1ncccc1Cl)c1cccnc1	ZINC000819160253	CD	On-Demand	Anodyne	ADRB1	46	55
O[C@@H](CNCCOc1ncccc1Cl)c1cccnc1	ZINC000819160253	CD	On-Demand	Anodyne	ADRB3	116	57
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccccc1Cl	ZINC000819160258	EF	On-Demand	Anodyne	ADRB2	59	54
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccccc1Cl	ZINC000819160258	EF	On-Demand	Anodyne	ADRB1	89	48
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccccc1Cl	ZINC000819160258	EF	On-Demand	Anodyne	GRIN1	15	46
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccccc1Cl	ZINC000819160258	EF	On-Demand	Anodyne	ADRB3	66	48
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccccc1Cl	ZINC000819160258	EF	On-Demand	Anodyne	ABCB1	22	42
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccccc1Cl	ZINC000819160259	EF	On-Demand	Anodyne	ADRB2	59	54
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccccc1Cl	ZINC000819160259	EF	On-Demand	Anodyne	ADRB1	89	48
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccccc1Cl	ZINC000819160259	EF	On-Demand	Anodyne	GRIN1	15	46
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccccc1Cl	ZINC000819160259	EF	On-Demand	Anodyne	ADRB3	66	48
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccccc1Cl	ZINC000819160259	EF	On-Demand	Anodyne	ABCB1	22	42
COc1cccc([C@H](O)C(=O)NCCc2ccc(Cl)c(OC)c2)c1	ZINC000819160264	EF	On-Demand	Anodyne	ADRB1	32	43
COc1cccc([C@H](O)C(=O)NCCc2ccc(Cl)c(OC)c2)c1	ZINC000819160264	EF	On-Demand	Anodyne	DRD4	43	34
COc1cccc([C@H](O)C(=O)NCCc2ccc(Cl)c(OC)c2)c1	ZINC000819160264	EF	On-Demand	Anodyne	ADRB3	38	42
COc1cccc([C@H](O)C(=O)NCCc2ccc(Cl)c(OC)c2)c1	ZINC000819160264	EF	On-Demand	Anodyne	NQO2	25	41
COc1cccc([C@H](O)C(=O)NCCc2ccc(Cl)c(OC)c2)c1	ZINC000819160264	EF	On-Demand	Anodyne	MTNR1A	79	43
COc1cccc([C@H](O)C(=O)NCCc2ccc(Cl)c(OC)c2)c1	ZINC000819160264	EF	On-Demand	Anodyne	MTNR1B	72	44
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NCCC(C)(C)C1CC1	ZINC000819160269	GF	On-Demand	Anodyne	CELA1	45	37
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NCCC(C)(C)C1CC1	ZINC000819160271	GF	On-Demand	Anodyne	CELA1	45	37
O[C@@H](CNCCc1ccc(Cl)nc1)c1cccc(Br)c1	ZINC000819160292	FG	On-Demand	Anodyne	ADRB2	55	46
O[C@@H](CNCCc1ccc(Cl)nc1)c1cccc(Br)c1	ZINC000819160292	FG	On-Demand	Anodyne	ADRB1	65	49
O[C@@H](CNCCc1ccc(Cl)nc1)c1cccc(Br)c1	ZINC000819160292	FG	On-Demand	Anodyne	ADRB3	132	49
O[C@H](CNCCc1ccc(Cl)nc1)c1cccc(Br)c1	ZINC000819160293	FG	On-Demand	Anodyne	ADRB2	55	46
O[C@H](CNCCc1ccc(Cl)nc1)c1cccc(Br)c1	ZINC000819160293	FG	On-Demand	Anodyne	ADRB1	65	49
O[C@H](CNCCc1ccc(Cl)nc1)c1cccc(Br)c1	ZINC000819160293	FG	On-Demand	Anodyne	ADRB3	132	49
CN1C[C@@H]2CCCN(S(=O)(=O)c3cc(Cl)c(F)c(C(=O)O)c3)[C@@H]2C1	ZINC000819160295	GD	On-Demand	Anodyne	CASP7	40	36
C=C(CO)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160353	CD	On-Demand	Mild	PDE6A	40	31
COC(=O)N1CCC(NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819160361	FF	On-Demand	Anodyne	GRIN2B	27	42
COC(=O)N1CCC(NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819160361	FF	On-Demand	Anodyne	SIGMAR1	18	40
COC(=O)N1CCC(NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819160361	FF	On-Demand	Anodyne	C3AR1	42	42
COC(=O)N1CCC(NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819160361	FF	On-Demand	Anodyne	FAAH	15	41
COC(=O)N1CCC(NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819160361	FF	On-Demand	Anodyne	CCR8	28	45
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc(Br)cc1	ZINC000819160363	GG	On-Demand	Anodyne	ADRB2	54	58
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc(Br)cc1	ZINC000819160363	GG	On-Demand	Anodyne	ADRB1	88	58
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc(Br)cc1	ZINC000819160363	GG	On-Demand	Anodyne	GRIN1	30	51
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccc(Br)cc1	ZINC000819160363	GG	On-Demand	Anodyne	ADRB3	63	58
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc(Br)cc1	ZINC000819160364	GG	On-Demand	Anodyne	ADRB2	54	58
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc(Br)cc1	ZINC000819160364	GG	On-Demand	Anodyne	ADRB1	88	58
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc(Br)cc1	ZINC000819160364	GG	On-Demand	Anodyne	GRIN1	30	51
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccc(Br)cc1	ZINC000819160364	GG	On-Demand	Anodyne	ADRB3	63	58
COc1cccc(OC)c1OC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819160365	FE	On-Demand	Anodyne	ADRB2	59	50
COc1cccc(OC)c1OC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819160365	FE	On-Demand	Anodyne	ADRB1	89	46
COc1cccc(OC)c1OC[C@@H](O)CNCCc1ccc(Cl)nc1	ZINC000819160365	FE	On-Demand	Anodyne	ADRB3	69	47
COc1cccc(OC)c1OC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819160366	FE	On-Demand	Anodyne	ADRB2	59	50
COc1cccc(OC)c1OC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819160366	FE	On-Demand	Anodyne	ADRB1	89	46
COc1cccc(OC)c1OC[C@H](O)CNCCc1ccc(Cl)nc1	ZINC000819160366	FE	On-Demand	Anodyne	ADRB3	69	47
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccccc1C(F)(F)F	ZINC000819160367	FG	On-Demand	Anodyne	ADRB2	46	45
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccccc1C(F)(F)F	ZINC000819160367	FG	On-Demand	Anodyne	ADRB1	76	44
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccccc1C(F)(F)F	ZINC000819160367	FG	On-Demand	Anodyne	ADRB3	56	44
O[C@H](CNCCc1ccc(Cl)nc1)COc1ccccc1C(F)(F)F	ZINC000819160367	FG	On-Demand	Anodyne	ABCB1	17	42
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccccc1C(F)(F)F	ZINC000819160368	FG	On-Demand	Anodyne	ADRB2	46	45
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccccc1C(F)(F)F	ZINC000819160368	FG	On-Demand	Anodyne	ADRB1	76	44
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccccc1C(F)(F)F	ZINC000819160368	FG	On-Demand	Anodyne	ADRB3	56	44
O[C@@H](CNCCc1ccc(Cl)nc1)COc1ccccc1C(F)(F)F	ZINC000819160368	FG	On-Demand	Anodyne	ABCB1	17	42
N#C[C@H]1CC[C@@H](NS(=O)(=O)c2cc(C(=O)O)ccc2Cl)C1	ZINC000819160372	EE	On-Demand	Mild	SFRP1	80	36
COc1ccc2c(c1)CN(C(=O)C(F)=C1CCC1)CC2	ZINC000819160410	CF	On-Demand	Anodyne	DRD5	18	42
COc1ccc2c(c1)CN(C(=O)C(F)=C1CCC1)CC2	ZINC000819160410	CF	On-Demand	Anodyne	HDAC6	37	46
O[C@H](CNCCOc1ccc(C(F)(F)F)cn1)c1cccnc1	ZINC000819160434	EE	On-Demand	Anodyne	ADRB2	25	53
O[C@H](CNCCOc1ccc(C(F)(F)F)cn1)c1cccnc1	ZINC000819160434	EE	On-Demand	Anodyne	ADRB1	32	56
O[C@H](CNCCOc1ccc(C(F)(F)F)cn1)c1cccnc1	ZINC000819160434	EE	On-Demand	Anodyne	ADRB3	99	56
O[C@@H](CNCCOc1ccc(C(F)(F)F)cn1)c1cccnc1	ZINC000819160435	EE	On-Demand	Anodyne	ADRB2	25	53
O[C@@H](CNCCOc1ccc(C(F)(F)F)cn1)c1cccnc1	ZINC000819160435	EE	On-Demand	Anodyne	ADRB1	32	56
O[C@@H](CNCCOc1ccc(C(F)(F)F)cn1)c1cccnc1	ZINC000819160435	EE	On-Demand	Anodyne	ADRB3	99	56
CC(=O)Nc1cccc(CC(=O)Nc2cccc(NC(=O)OCC(C)C)c2)c1	ZINC000819160444	GI	On-Demand	Anodyne	KCNK3	53	33
CC(=O)Nc1cccc(CC(=O)Nc2cccc(NC(=O)OCC(C)C)c2)c1	ZINC000819160444	GI	On-Demand	Anodyne	KCNK9	47	33
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ncccc2Cl)cc1	ZINC000819160455	FD	On-Demand	Anodyne	ADRB2	30	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ncccc2Cl)cc1	ZINC000819160455	FD	On-Demand	Anodyne	ADRB3	87	43
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ncccc2Cl)cc1	ZINC000819160456	FD	On-Demand	Anodyne	ADRB2	30	40
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ncccc2Cl)cc1	ZINC000819160456	FD	On-Demand	Anodyne	ADRB3	87	43
O=C(C1CCCCC1)N1CC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819160458	FE	On-Demand	Bother	C3AR1	31	45
O=C(C1CCCCC1)N1CC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819160459	FE	On-Demand	Bother	C3AR1	31	45
O=C(C1CCCCC1)N1CC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819160460	FE	On-Demand	Bother	C3AR1	31	45
O=C(C1CCCCC1)N1CC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819160461	FE	On-Demand	Bother	C3AR1	31	45
O[C@H](CNCCOc1ccc(Cl)cn1)c1cccnc1	ZINC000819160471	CD	On-Demand	Anodyne	ADRB2	30	54
O[C@H](CNCCOc1ccc(Cl)cn1)c1cccnc1	ZINC000819160471	CD	On-Demand	Anodyne	ADRB1	48	54
O[C@H](CNCCOc1ccc(Cl)cn1)c1cccnc1	ZINC000819160471	CD	On-Demand	Anodyne	ADRB3	116	56
O[C@@H](CNCCOc1ccc(Cl)cn1)c1cccnc1	ZINC000819160472	CD	On-Demand	Anodyne	ADRB2	30	54
O[C@@H](CNCCOc1ccc(Cl)cn1)c1cccnc1	ZINC000819160472	CD	On-Demand	Anodyne	ADRB1	48	54
O[C@@H](CNCCOc1ccc(Cl)cn1)c1cccnc1	ZINC000819160472	CD	On-Demand	Anodyne	ADRB3	116	56
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819160491	DF	On-Demand	Mild	PAPA1_CARPA	45	54
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819160491	DF	On-Demand	Mild	CTSK	15	51
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819160496	DF	On-Demand	Mild	PAPA1_CARPA	45	54
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819160496	DF	On-Demand	Mild	CTSK	15	51
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160616	FF	On-Demand	Anodyne	ANPEP	30	41
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160616	FF	On-Demand	Anodyne	CTSB	40	46
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160616	FF	On-Demand	Anodyne	CTSK	40	42
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160616	FF	On-Demand	Anodyne	CTSL	42	42
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160616	FF	On-Demand	Anodyne	CAPNS1	57	41
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160616	FF	On-Demand	Anodyne	HLA-DRB1	44	36
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160616	FF	On-Demand	Anodyne	CTSS	27	42
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160616	FF	On-Demand	Anodyne	CAPN1	88	46
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160616	FF	On-Demand	Anodyne	CAPN2	132	46
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160616	FF	On-Demand	Anodyne	FPR1	54	39
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160616	FF	On-Demand	Anodyne	NPR	73	40
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160617	FF	On-Demand	Anodyne	ANPEP	30	41
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160617	FF	On-Demand	Anodyne	CTSB	40	46
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160617	FF	On-Demand	Anodyne	CTSK	40	42
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160617	FF	On-Demand	Anodyne	CTSL	42	42
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160617	FF	On-Demand	Anodyne	CAPNS1	57	41
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160617	FF	On-Demand	Anodyne	HLA-DRB1	44	36
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160617	FF	On-Demand	Anodyne	CTSS	27	42
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160617	FF	On-Demand	Anodyne	CAPN1	88	46
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160617	FF	On-Demand	Anodyne	CAPN2	132	46
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160617	FF	On-Demand	Anodyne	FPR1	54	39
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160617	FF	On-Demand	Anodyne	NPR	73	40
COC[C@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160680	GF	On-Demand	Anodyne	TRPV1	18	40
COC[C@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160680	GF	On-Demand	Anodyne	PAPA1_CARPA	44	45
COC[C@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160680	GF	On-Demand	Anodyne	CTSL	18	45
COC[C@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160680	GF	On-Demand	Anodyne	FPR1	44	39
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160681	GF	On-Demand	Anodyne	TRPV1	18	40
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160681	GF	On-Demand	Anodyne	PAPA1_CARPA	44	45
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160681	GF	On-Demand	Anodyne	CTSL	18	45
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160681	GF	On-Demand	Anodyne	FPR1	44	39
CCOC(=O)N1CCC(C(=O)NCCc2ccc(Cl)c(OC)c2)CC1	ZINC000819160685	FF	On-Demand	Anodyne	HTR4	64	44
CCOC(=O)N1CCC(C(=O)NCCc2ccc(Cl)c(OC)c2)CC1	ZINC000819160685	FF	On-Demand	Anodyne	EPHX2	21	46
CCOC(=O)N1CCC(C(=O)NCCc2ccc(Cl)c(OC)c2)CC1	ZINC000819160685	FF	On-Demand	Anodyne	MBTPS1	43	32
O[C@@H](CNCCOc1ncccc1Cl)c1cccc(C(F)(F)F)c1	ZINC000819160686	FG	On-Demand	Anodyne	ADRB1	31	42
O[C@@H](CNCCOc1ncccc1Cl)c1cccc(C(F)(F)F)c1	ZINC000819160686	FG	On-Demand	Anodyne	ADRB3	39	42
O[C@H](CNCCOc1ncccc1Cl)c1cccc(C(F)(F)F)c1	ZINC000819160687	FG	On-Demand	Anodyne	ADRB1	31	42
O[C@H](CNCCOc1ncccc1Cl)c1cccc(C(F)(F)F)c1	ZINC000819160687	FG	On-Demand	Anodyne	ADRB3	39	42
CON(C)C(=O)CCNCCc1cccc(-c2ccccc2)c1	ZINC000819160709	DF	On-Demand	Anodyne	FAAH	19	43
CON(C)C(=O)CCNCCc1cccc(-c2ccccc2)c1	ZINC000819160709	DF	On-Demand	Anodyne	FFAR1	27	40
CON(C)C(=O)CCNCCc1cccc(-c2ccccc2)c1	ZINC000819160709	DF	On-Demand	Anodyne	HAO2	47	33
Cc1cc(CNC(=O)c2cn([C@H]3CCCN(C(=O)OC(C)(C)C)C3)nn2)no1	ZINC000819160714	GE	On-Demand	Anodyne	PANC	45	33
Cc1cc(CNC(=O)c2cn([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)nn2)no1	ZINC000819160715	GE	On-Demand	Anodyne	PANC	45	33
O=C(N[C@H]1C[C@@H]1c1ccccc1)C(F)=C1CCC1	ZINC000819160724	BG	On-Demand	Anodyne	EPHX2	22	43
O=C(N[C@@H]1C[C@H]1c1ccccc1)C(F)=C1CCC1	ZINC000819160725	BG	On-Demand	Anodyne	EPHX2	22	43
O=C(N[C@H]1C[C@H]1c1ccccc1)C(F)=C1CCC1	ZINC000819160726	BG	On-Demand	Anodyne	EPHX2	22	43
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ccc(Cl)cn2)c1	ZINC000819160733	EE	On-Demand	Bother	ADRB1	39	44
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ccc(Cl)cn2)c1	ZINC000819160733	EE	On-Demand	Bother	ADRB3	44	44
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ccc(Cl)cn2)c1	ZINC000819160734	EE	On-Demand	Bother	ADRB1	39	44
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ccc(Cl)cn2)c1	ZINC000819160734	EE	On-Demand	Bother	ADRB3	44	44
O[C@@H](CNCCOc1ccc(Cl)cn1)c1ccc(F)c(F)c1	ZINC000819160749	EF	On-Demand	Anodyne	ADRB1	29	41
O[C@@H](CNCCOc1ccc(Cl)cn1)c1ccc(F)c(F)c1	ZINC000819160749	EF	On-Demand	Anodyne	ADRB3	33	41
O[C@H](CNCCOc1ccc(Cl)cn1)c1ccc(F)c(F)c1	ZINC000819160750	EF	On-Demand	Anodyne	ADRB1	29	41
O[C@H](CNCCOc1ccc(Cl)cn1)c1ccc(F)c(F)c1	ZINC000819160750	EF	On-Demand	Anodyne	ADRB3	33	41
C#CC(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160787	BD	On-Demand	Mild	MTNR1A	23	46
C#CC(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819160787	BD	On-Demand	Mild	MTNR1B	20	46
O[C@@H](CNCCOc1ccc(Cl)cn1)c1cccc(C(F)(F)F)c1	ZINC000819160788	FG	On-Demand	Anodyne	ADRB1	34	45
O[C@@H](CNCCOc1ccc(Cl)cn1)c1cccc(C(F)(F)F)c1	ZINC000819160788	FG	On-Demand	Anodyne	ADRB3	37	45
O[C@H](CNCCOc1ccc(Cl)cn1)c1cccc(C(F)(F)F)c1	ZINC000819160790	FG	On-Demand	Anodyne	ADRB1	34	45
O[C@H](CNCCOc1ccc(Cl)cn1)c1cccc(C(F)(F)F)c1	ZINC000819160790	FG	On-Demand	Anodyne	ADRB3	37	45
COc1ccc2c(C)c(CCC(=O)NCCc3ccc(Cl)c(OC)c3)c(=O)oc2c1	ZINC000819160796	II	On-Demand	Anodyne	MAOB	45	44
COc1ccc2c(C)c(CCC(=O)NCCc3ccc(Cl)c(OC)c3)c(=O)oc2c1	ZINC000819160796	II	On-Demand	Anodyne	MTNR1A	64	43
COc1ccc2c(C)c(CCC(=O)NCCc3ccc(Cl)c(OC)c3)c(=O)oc2c1	ZINC000819160796	II	On-Demand	Anodyne	MTNR1B	61	43
COc1ccc2c(C)c(CCC(=O)NCCc3ccc(Cl)c(OC)c3)c(=O)oc2c1	ZINC000819160796	II	On-Demand	Anodyne	NQO1	41	43
C[C@@H]1CN(Cc2cccc(CNC(=O)/C=C\[C@@H]3CCCO3)c2)CCO1	ZINC000819160822	EE	On-Demand	Anodyne	CHRM3	15	40
C[C@@H]1CN(Cc2cccc(CNC(=O)/C=C/[C@@H]3CCCO3)c2)CCO1	ZINC000819160823	EE	On-Demand	Anodyne	CHRM3	15	40
C[C@@H]1CN(Cc2cccc(CNC(=O)/C=C/[C@H]3CCCO3)c2)CCO1	ZINC000819160824	EE	On-Demand	Anodyne	CHRM3	15	40
C[C@@H]1CN(Cc2cccc(CNC(=O)/C=C\[C@H]3CCCO3)c2)CCO1	ZINC000819160825	EE	On-Demand	Anodyne	CHRM3	15	40
NC(=O)c1cn([C@H]2CCN(S(=O)(=O)c3cccc(C(=O)O)c3)C2)nn1	ZINC000819160851	FB	On-Demand	Anodyne	AKR1C3	70	46
NC(=O)c1cn([C@H]2CCN(S(=O)(=O)c3cccc(C(=O)O)c3)C2)nn1	ZINC000819160851	FB	On-Demand	Anodyne	SFRP1	15	40
NC(=O)c1cn([C@@H]2CCN(S(=O)(=O)c3cccc(C(=O)O)c3)C2)nn1	ZINC000819160852	FB	On-Demand	Anodyne	AKR1C3	70	46
NC(=O)c1cn([C@@H]2CCN(S(=O)(=O)c3cccc(C(=O)O)c3)C2)nn1	ZINC000819160852	FB	On-Demand	Anodyne	SFRP1	15	40
O=C(Nc1ccc(F)cc1)c1ccc(CNC[C@@H](O)C2CC2)cc1	ZINC000819160854	EF	On-Demand	Anodyne	HTR1F	35	40
O=C(Nc1ccc(F)cc1)c1ccc(CNC[C@@H](O)C2CC2)cc1	ZINC000819160854	EF	On-Demand	Anodyne	SSTR3	21	45
O=C(Nc1ccc(F)cc1)c1ccc(CNC[C@@H](O)C2CC2)cc1	ZINC000819160854	EF	On-Demand	Anodyne	GIPR	42	33
O=C(Nc1ccc(F)cc1)c1ccc(CNC[C@@H](O)C2CC2)cc1	ZINC000819160854	EF	On-Demand	Anodyne	NOD2	40	34
O=C(Nc1ccc(F)cc1)c1ccc(CNC[C@H](O)C2CC2)cc1	ZINC000819160855	EF	On-Demand	Anodyne	HTR1F	35	40
O=C(Nc1ccc(F)cc1)c1ccc(CNC[C@H](O)C2CC2)cc1	ZINC000819160855	EF	On-Demand	Anodyne	SSTR3	21	45
O=C(Nc1ccc(F)cc1)c1ccc(CNC[C@H](O)C2CC2)cc1	ZINC000819160855	EF	On-Demand	Anodyne	GIPR	42	33
O=C(Nc1ccc(F)cc1)c1ccc(CNC[C@H](O)C2CC2)cc1	ZINC000819160855	EF	On-Demand	Anodyne	NOD2	40	34
CON(C)C(=O)CCNCc1ccc(C(=O)Nc2ccc(F)cc2)cc1	ZINC000819160856	FF	On-Demand	Anodyne	ENPP2	22	41
CON(C)C(=O)CCNCc1ccc(C(=O)Nc2ccc(F)cc2)cc1	ZINC000819160856	FF	On-Demand	Anodyne	LEF	58	38
CON(C)C(=O)CCNCc1ccc(C(=O)Nc2ccc(F)cc2)cc1	ZINC000819160856	FF	On-Demand	Anodyne	NOD2	42	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1C[C@H]1c1ccccc1	ZINC000819160863	DF	On-Demand	Anodyne	EPHX2	21	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1C[C@@H]1c1ccccc1	ZINC000819160864	DF	On-Demand	Anodyne	EPHX2	21	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1C[C@@H]1c1ccccc1	ZINC000819160865	DF	On-Demand	Anodyne	EPHX2	21	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1C[C@H]1c1ccccc1	ZINC000819160866	DF	On-Demand	Anodyne	EPHX2	21	47
C[C@H]1CN(Cc2cccc(CNC(=O)C(F)=C3CCC3)c2)CCO1	ZINC000819160870	EF	On-Demand	Anodyne	CHRM3	15	40
C[C@@H]1CN(Cc2cccc(CNC(=O)C(F)=C3CCC3)c2)CCO1	ZINC000819160871	EF	On-Demand	Anodyne	CHRM3	15	40
O[C@@H](CNCCOc1ccc(Cl)cn1)c1cccc(Cl)c1	ZINC000819160872	EG	On-Demand	Anodyne	ADRB2	49	42
O[C@@H](CNCCOc1ccc(Cl)cn1)c1cccc(Cl)c1	ZINC000819160872	EG	On-Demand	Anodyne	ADRB1	66	54
O[C@@H](CNCCOc1ccc(Cl)cn1)c1cccc(Cl)c1	ZINC000819160872	EG	On-Demand	Anodyne	ADRB3	74	54
O[C@H](CNCCOc1ccc(Cl)cn1)c1cccc(Cl)c1	ZINC000819160873	EG	On-Demand	Anodyne	ADRB2	49	42
O[C@H](CNCCOc1ccc(Cl)cn1)c1cccc(Cl)c1	ZINC000819160873	EG	On-Demand	Anodyne	ADRB1	66	54
O[C@H](CNCCOc1ccc(Cl)cn1)c1cccc(Cl)c1	ZINC000819160873	EG	On-Demand	Anodyne	ADRB3	74	54
O[C@@H](CNCCOc1ccc(Cl)cn1)c1ccccc1	ZINC000819160877	CE	On-Demand	Anodyne	ADRB2	23	42
O[C@@H](CNCCOc1ccc(Cl)cn1)c1ccccc1	ZINC000819160877	CE	On-Demand	Anodyne	ADRB1	42	45
O[C@@H](CNCCOc1ccc(Cl)cn1)c1ccccc1	ZINC000819160877	CE	On-Demand	Anodyne	ADRB3	56	45
O[C@H](CNCCOc1ccc(Cl)cn1)c1ccccc1	ZINC000819160878	CE	On-Demand	Anodyne	ADRB2	23	42
O[C@H](CNCCOc1ccc(Cl)cn1)c1ccccc1	ZINC000819160878	CE	On-Demand	Anodyne	ADRB1	42	45
O[C@H](CNCCOc1ccc(Cl)cn1)c1ccccc1	ZINC000819160878	CE	On-Demand	Anodyne	ADRB3	56	45
COc1ccc2c(c1)CN(C(=O)/C=C\[C@H]1CCCO1)CC2	ZINC000819160886	CE	On-Demand	Anodyne	HDAC6	33	42
COc1ccc2c(c1)CN(C(=O)/C=C/[C@@H]1CCCO1)CC2	ZINC000819160887	CE	On-Demand	Anodyne	HDAC6	33	42
COc1ccc2c(c1)CN(C(=O)/C=C/[C@H]1CCCO1)CC2	ZINC000819160888	CE	On-Demand	Anodyne	HDAC6	33	42
COc1ccc2c(c1)CN(C(=O)/C=C\[C@@H]1CCCO1)CC2	ZINC000819160889	CE	On-Demand	Anodyne	HDAC6	33	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000819160890	FF	On-Demand	Anodyne	NOS2	89	33
O[C@@H](CNCCOc1ccc(C(F)(F)F)cn1)c1cccc(Cl)c1	ZINC000819160894	FG	On-Demand	Anodyne	ADRB1	48	51
O[C@@H](CNCCOc1ccc(C(F)(F)F)cn1)c1cccc(Cl)c1	ZINC000819160894	FG	On-Demand	Anodyne	ADRB3	59	51
O[C@H](CNCCOc1ccc(C(F)(F)F)cn1)c1cccc(Cl)c1	ZINC000819160895	FG	On-Demand	Anodyne	ADRB1	48	51
O[C@H](CNCCOc1ccc(C(F)(F)F)cn1)c1cccc(Cl)c1	ZINC000819160895	FG	On-Demand	Anodyne	ADRB3	59	51
COC(=O)N1CCC(NC(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819160961	FD	On-Demand	Anodyne	DRD4	41	31
COC(=O)N1CCC(NC(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819160961	FD	On-Demand	Anodyne	MTNR1A	34	48
COC(=O)N1CCC(NC(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819160961	FD	On-Demand	Anodyne	MTNR1B	39	48
COC(=O)N1CCC(NC(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819160961	FD	On-Demand	Anodyne	EPHX2	21	40
COC(=O)N1CCC(NC(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819160961	FD	On-Demand	Anodyne	MCHR1	16	42
COC(=O)N1CCC(NC(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819160961	FD	On-Demand	Anodyne	CCR8	21	42
COC(=O)N1CCC(NC(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819160962	FD	On-Demand	Anodyne	DRD4	41	31
COC(=O)N1CCC(NC(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819160962	FD	On-Demand	Anodyne	MTNR1A	34	48
COC(=O)N1CCC(NC(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819160962	FD	On-Demand	Anodyne	MTNR1B	39	48
COC(=O)N1CCC(NC(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819160962	FD	On-Demand	Anodyne	EPHX2	21	40
COC(=O)N1CCC(NC(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819160962	FD	On-Demand	Anodyne	MCHR1	16	42
COC(=O)N1CCC(NC(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819160962	FD	On-Demand	Anodyne	CCR8	21	42
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1C[C@@H]1c1ccccc1	ZINC000819160964	CE	On-Demand	Anodyne	EPHX2	22	45
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1C[C@@H]1c1ccccc1	ZINC000819160965	CE	On-Demand	Anodyne	EPHX2	22	45
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1C[C@H]1c1ccccc1	ZINC000819160966	CE	On-Demand	Anodyne	EPHX2	22	45
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1C[C@H]1c1ccccc1	ZINC000819160967	CE	On-Demand	Anodyne	EPHX2	22	45
CN(C)c1ccc(NC(=O)CCNCCOc2ccc(C(F)(F)F)cn2)cc1	ZINC000819160985	GG	On-Demand	Anodyne	LIPE	19	40
O=C(NCc1ccc(-n2ccnc2)c(F)c1)C(F)=C1CCC1	ZINC000819161012	DG	On-Demand	Anodyne	NOS2	97	35
C=CCCn1cc(C(=O)Nc2cccc(NC(=O)OCC(C)C)c2)nn1	ZINC000819161013	FG	On-Demand	Mild	KCNK3	44	33
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161014	EG	On-Demand	Mild	PAPA1_CARPA	42	55
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161014	EG	On-Demand	Mild	CTSK	22	49
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161014	EG	On-Demand	Mild	PGA	15	41
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161014	EG	On-Demand	Mild	ECE1	37	41
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161014	EG	On-Demand	Mild	REN	23	41
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161014	EG	On-Demand	Mild	PGA5	25	44
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161014	EG	On-Demand	Mild	FPR1	40	39
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161015	EG	On-Demand	Mild	PAPA1_CARPA	42	55
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161015	EG	On-Demand	Mild	CTSK	22	49
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161015	EG	On-Demand	Mild	PGA	15	41
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161015	EG	On-Demand	Mild	ECE1	37	41
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161015	EG	On-Demand	Mild	REN	23	41
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161015	EG	On-Demand	Mild	PGA5	25	44
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161015	EG	On-Demand	Mild	FPR1	40	39
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161016	EG	On-Demand	Mild	PAPA1_CARPA	42	55
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161016	EG	On-Demand	Mild	CTSK	22	49
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161016	EG	On-Demand	Mild	PGA	15	41
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161016	EG	On-Demand	Mild	ECE1	37	41
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161016	EG	On-Demand	Mild	REN	23	41
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161016	EG	On-Demand	Mild	PGA5	25	44
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161016	EG	On-Demand	Mild	FPR1	40	39
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161017	EG	On-Demand	Mild	PAPA1_CARPA	42	55
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161017	EG	On-Demand	Mild	CTSK	22	49
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161017	EG	On-Demand	Mild	PGA	15	41
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161017	EG	On-Demand	Mild	ECE1	37	41
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161017	EG	On-Demand	Mild	REN	23	41
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161017	EG	On-Demand	Mild	PGA5	25	44
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819161017	EG	On-Demand	Mild	FPR1	40	39
C=CCCn1cc(C(=O)Oc2ccc(NC(=O)CSC)cc2)nn1	ZINC000819161027	EE	On-Demand	Mild	ACR	43	36
COC(=O)N1CCC(NC(=O)Cc2noc3ccc(Br)cc23)CC1	ZINC000819161040	GE	On-Demand	Anodyne	SIGMAR1	15	41
O[C@@H](CNCCOc1ncccc1Cl)c1cccc(Br)c1	ZINC000819161041	FG	On-Demand	Anodyne	ADRB2	17	41
O[C@@H](CNCCOc1ncccc1Cl)c1cccc(Br)c1	ZINC000819161041	FG	On-Demand	Anodyne	ADRB1	37	41
O[C@@H](CNCCOc1ncccc1Cl)c1cccc(Br)c1	ZINC000819161041	FG	On-Demand	Anodyne	ADRB3	46	41
O[C@H](CNCCOc1ncccc1Cl)c1cccc(Br)c1	ZINC000819161042	FG	On-Demand	Anodyne	ADRB2	17	41
O[C@H](CNCCOc1ncccc1Cl)c1cccc(Br)c1	ZINC000819161042	FG	On-Demand	Anodyne	ADRB1	37	41
O[C@H](CNCCOc1ncccc1Cl)c1cccc(Br)c1	ZINC000819161042	FG	On-Demand	Anodyne	ADRB3	46	41
CON(C)C(=O)CCNCCOc1ccc(C(F)(F)F)cn1	ZINC000819161051	DD	On-Demand	Anodyne	LIPE	19	41
O[C@@H](CNCCOc1ccc(C(F)(F)F)cn1)c1cccc(F)c1	ZINC000819161057	EF	On-Demand	Anodyne	ADRB1	24	40
O[C@@H](CNCCOc1ccc(C(F)(F)F)cn1)c1cccc(F)c1	ZINC000819161057	EF	On-Demand	Anodyne	ADRB3	28	40
O[C@H](CNCCOc1ccc(C(F)(F)F)cn1)c1cccc(F)c1	ZINC000819161058	EF	On-Demand	Anodyne	ADRB1	24	40
O[C@H](CNCCOc1ccc(C(F)(F)F)cn1)c1cccc(F)c1	ZINC000819161058	EF	On-Demand	Anodyne	ADRB3	28	40
CCC1(CNC[C@H](O)c2cccnc2)CCCC1	ZINC000819161059	BF	On-Demand	Anodyne	ADRB2	22	42
CCC1(CNC[C@H](O)c2cccnc2)CCCC1	ZINC000819161059	BF	On-Demand	Anodyne	ADRB1	23	42
CCC1(CNC[C@H](O)c2cccnc2)CCCC1	ZINC000819161059	BF	On-Demand	Anodyne	ADRB3	91	42
CCC1(CNC[C@@H](O)c2cccnc2)CCCC1	ZINC000819161060	BF	On-Demand	Anodyne	ADRB2	22	42
CCC1(CNC[C@@H](O)c2cccnc2)CCCC1	ZINC000819161060	BF	On-Demand	Anodyne	ADRB1	23	42
CCC1(CNC[C@@H](O)c2cccnc2)CCCC1	ZINC000819161060	BF	On-Demand	Anodyne	ADRB3	91	42
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1	ZINC000819161063	GH	On-Demand	Mild	PAPA1_CARPA	53	58
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1	ZINC000819161063	GH	On-Demand	Mild	CTSK	31	49
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1	ZINC000819161063	GH	On-Demand	Mild	CTSL	22	58
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1	ZINC000819161063	GH	On-Demand	Mild	CTSS	22	58
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1	ZINC000819161063	GH	On-Demand	Mild	FPR1	41	38
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1	ZINC000819161064	GH	On-Demand	Mild	PAPA1_CARPA	53	58
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1	ZINC000819161064	GH	On-Demand	Mild	CTSK	31	49
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1	ZINC000819161064	GH	On-Demand	Mild	CTSL	22	58
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1	ZINC000819161064	GH	On-Demand	Mild	CTSS	22	58
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1	ZINC000819161064	GH	On-Demand	Mild	FPR1	41	38
O[C@@H](CNCCc1cccc(-c2ccccc2)c1)C1CC1	ZINC000819161094	CG	On-Demand	Anodyne	ADRB2	35	42
O[C@@H](CNCCc1cccc(-c2ccccc2)c1)C1CC1	ZINC000819161094	CG	On-Demand	Anodyne	ADRB1	49	40
O[C@@H](CNCCc1cccc(-c2ccccc2)c1)C1CC1	ZINC000819161094	CG	On-Demand	Anodyne	ADRB3	58	40
O[C@H](CNCCc1cccc(-c2ccccc2)c1)C1CC1	ZINC000819161095	CG	On-Demand	Anodyne	ADRB2	35	42
O[C@H](CNCCc1cccc(-c2ccccc2)c1)C1CC1	ZINC000819161095	CG	On-Demand	Anodyne	ADRB1	49	40
O[C@H](CNCCc1cccc(-c2ccccc2)c1)C1CC1	ZINC000819161095	CG	On-Demand	Anodyne	ADRB3	58	40
O[C@@H](CNCCOc1ccc(Cl)cn1)c1ccc(OC(F)(F)F)cc1	ZINC000819161106	GG	On-Demand	Anodyne	ADRB1	25	42
O[C@@H](CNCCOc1ccc(Cl)cn1)c1ccc(OC(F)(F)F)cc1	ZINC000819161106	GG	On-Demand	Anodyne	ADRB3	28	42
O[C@H](CNCCOc1ccc(Cl)cn1)c1ccc(OC(F)(F)F)cc1	ZINC000819161107	GG	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CNCCOc1ccc(Cl)cn1)c1ccc(OC(F)(F)F)cc1	ZINC000819161107	GG	On-Demand	Anodyne	ADRB3	28	42
O[C@@H](CNCCOc1ccc(Cl)cn1)c1ccc(Cl)cc1	ZINC000819161110	EG	On-Demand	Anodyne	ADRB2	18	40
CC[C@@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)C(C)C	ZINC000819161116	CE	On-Demand	Anodyne	CTSK	16	43
CC[C@@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)C(C)C	ZINC000819161116	CE	On-Demand	Anodyne	PGA5	22	41
CC[C@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)C(C)C	ZINC000819161117	CE	On-Demand	Anodyne	CTSK	16	43
CC[C@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)C(C)C	ZINC000819161117	CE	On-Demand	Anodyne	PGA5	22	41
CCCCNC(=O)NNC(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819161164	DC	On-Demand	Reactive	ASAH1	43	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(-n3ccnc3)c(F)c1)C2	ZINC000819161167	GE	On-Demand	Anodyne	NOS2	96	37
CCCCNC(=O)NNC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819161170	GF	On-Demand	Reactive	CNR1	52	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(-n3ccnc3)c(F)c1)C2	ZINC000819161171	GE	On-Demand	Anodyne	NOS2	96	37
O=C(O)[C@@H]1CC[C@H](NCc2cnn(Cc3ccccc3)c2Cl)C1	ZINC000819161180	EF	On-Demand	Anodyne	SIGMAR1	17	41
O=C(NNC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2)NC1CC1	ZINC000819161184	GE	On-Demand	Reactive	CNR1	54	33
O=C(Cc1ccc(-n2cnnc2)cc1)NNC(=O)NC1CC1	ZINC000819161214	DC	On-Demand	Reactive	HTR1D	44	37
COc1ccc2c(c1)CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819161224	GG	On-Demand	Mild	HDAC8	17	44
COc1ccc2c(c1)CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819161225	GG	On-Demand	Mild	HDAC8	17	44
C=C(C)COCCNC[C@H](O)c1ccc(C)cc1	ZINC000819161246	BE	On-Demand	Mild	ADRB2	29	42
C=C(C)COCCNC[C@@H](O)c1ccc(C)cc1	ZINC000819161247	BE	On-Demand	Mild	ADRB2	29	42
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccc3nc[nH]c3c2)CC1	ZINC000819161274	FD	On-Demand	Anodyne	L3MBTL3	48	36
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccc3nc[nH]c3c2)CC1	ZINC000819161274	FD	On-Demand	Anodyne	HPGD	42	33
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccc3nc[nH]c3c2)CC1	ZINC000819161276	FD	On-Demand	Anodyne	L3MBTL3	48	36
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccc3nc[nH]c3c2)CC1	ZINC000819161276	FD	On-Demand	Anodyne	HPGD	42	33
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccc3nc[nH]c3c2)CC1	ZINC000819161277	FD	On-Demand	Anodyne	L3MBTL3	48	36
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccc3nc[nH]c3c2)CC1	ZINC000819161277	FD	On-Demand	Anodyne	HPGD	42	33
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccc3nc[nH]c3c2)CC1	ZINC000819161278	FD	On-Demand	Anodyne	L3MBTL3	48	36
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccc3nc[nH]c3c2)CC1	ZINC000819161278	FD	On-Demand	Anodyne	HPGD	42	33
CCC1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CCCC1	ZINC000819161318	CG	On-Demand	Bother	CACNA1D	45	32
CCC1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCCC1	ZINC000819161319	CG	On-Demand	Bother	CACNA1D	45	32
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(Br)c2)C1	ZINC000819161356	FE	On-Demand	Anodyne	EPHX2	16	43
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)c(Br)c2)C1	ZINC000819161357	FE	On-Demand	Anodyne	EPHX2	16	43
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(Br)c2)C1	ZINC000819161358	FE	On-Demand	Anodyne	EPHX2	16	43
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(Br)c2)C1	ZINC000819161359	FE	On-Demand	Anodyne	EPHX2	16	43
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161366	GF	On-Demand	Anodyne	HTR1A	96	46
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161366	GF	On-Demand	Anodyne	DRD2	85	51
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161366	GF	On-Demand	Anodyne	DRD1	24	45
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161366	GF	On-Demand	Anodyne	DRD4	41	46
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161366	GF	On-Demand	Anodyne	ADRA1D	47	42
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161366	GF	On-Demand	Anodyne	HTR2A	64	46
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161366	GF	On-Demand	Anodyne	HTR2C	46	46
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161366	GF	On-Demand	Anodyne	SLC6A4	20	46
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161366	GF	On-Demand	Anodyne	ADRA1A	55	42
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161366	GF	On-Demand	Anodyne	ADRA1B	35	44
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161366	GF	On-Demand	Anodyne	DRD3	117	52
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161366	GF	On-Demand	Anodyne	HTR7	80	46
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161367	GF	On-Demand	Anodyne	HTR1A	96	46
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161367	GF	On-Demand	Anodyne	DRD2	85	51
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161367	GF	On-Demand	Anodyne	DRD1	24	45
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161367	GF	On-Demand	Anodyne	DRD4	41	46
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161367	GF	On-Demand	Anodyne	ADRA1D	47	42
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161367	GF	On-Demand	Anodyne	HTR2A	64	46
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161367	GF	On-Demand	Anodyne	HTR2C	46	46
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161367	GF	On-Demand	Anodyne	SLC6A4	20	46
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161367	GF	On-Demand	Anodyne	ADRA1A	55	42
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161367	GF	On-Demand	Anodyne	ADRA1B	35	44
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161367	GF	On-Demand	Anodyne	DRD3	117	52
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161367	GF	On-Demand	Anodyne	HTR7	80	46
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161368	GF	On-Demand	Anodyne	HTR1A	96	46
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161368	GF	On-Demand	Anodyne	DRD2	85	51
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161368	GF	On-Demand	Anodyne	DRD1	24	45
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161368	GF	On-Demand	Anodyne	DRD4	41	46
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161368	GF	On-Demand	Anodyne	ADRA1D	47	42
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161368	GF	On-Demand	Anodyne	HTR2A	64	46
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161368	GF	On-Demand	Anodyne	HTR2C	46	46
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161368	GF	On-Demand	Anodyne	SLC6A4	20	46
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161368	GF	On-Demand	Anodyne	ADRA1A	55	42
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161368	GF	On-Demand	Anodyne	ADRA1B	35	44
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161368	GF	On-Demand	Anodyne	DRD3	117	52
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161368	GF	On-Demand	Anodyne	HTR7	80	46
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161369	GF	On-Demand	Anodyne	HTR1A	96	46
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161369	GF	On-Demand	Anodyne	DRD2	85	51
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161369	GF	On-Demand	Anodyne	DRD1	24	45
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161369	GF	On-Demand	Anodyne	DRD4	41	46
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161369	GF	On-Demand	Anodyne	ADRA1D	47	42
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161369	GF	On-Demand	Anodyne	HTR2A	64	46
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161369	GF	On-Demand	Anodyne	HTR2C	46	46
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161369	GF	On-Demand	Anodyne	SLC6A4	20	46
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161369	GF	On-Demand	Anodyne	ADRA1A	55	42
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161369	GF	On-Demand	Anodyne	ADRA1B	35	44
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161369	GF	On-Demand	Anodyne	DRD3	117	52
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccccc2Cl)CC1	ZINC000819161369	GF	On-Demand	Anodyne	HTR7	80	46
CCN(CC)C(=O)CNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819161370	EC	On-Demand	Anodyne	MTNR1A	42	42
CCN(CC)C(=O)CNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819161370	EC	On-Demand	Anodyne	MTNR1B	41	42
CCN(CC)C(=O)CNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819161371	EC	On-Demand	Anodyne	MTNR1A	42	42
CCN(CC)C(=O)CNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819161371	EC	On-Demand	Anodyne	MTNR1B	41	42
CCN(CC)C(=O)CNC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819161395	GF	On-Demand	Anodyne	CNR1	54	33
C=C(C)COCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819161408	CD	On-Demand	Mild	ADRB1	44	37
C=C(C)COCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819161408	CD	On-Demand	Mild	ADRB3	49	37
C=C(C)COCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819161408	CD	On-Demand	Mild	CACNA1D	52	37
C=C(C)COCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819161409	CD	On-Demand	Mild	ADRB1	44	37
C=C(C)COCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819161409	CD	On-Demand	Mild	ADRB3	49	37
C=C(C)COCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819161409	CD	On-Demand	Mild	CACNA1D	52	37
Cc1nn(-c2cccc(Cl)c2)c(Cl)c1CN[C@@H]1CC[C@H](C(=O)O)C1	ZINC000819161425	FH	On-Demand	Anodyne	P2RX7	19	43
O[C@@H](CNCCOc1ncccc1Cl)c1ccc(Br)cc1	ZINC000819161442	FG	On-Demand	Anodyne	ADRB1	21	41
O[C@@H](CNCCOc1ncccc1Cl)c1ccc(Br)cc1	ZINC000819161442	FG	On-Demand	Anodyne	ADRB3	25	41
O[C@H](CNCCOc1ncccc1Cl)c1ccc(Br)cc1	ZINC000819161443	FG	On-Demand	Anodyne	ADRB1	21	41
O[C@H](CNCCOc1ncccc1Cl)c1ccc(Br)cc1	ZINC000819161443	FG	On-Demand	Anodyne	ADRB3	25	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCN1Cc2ccccc2C1	ZINC000819161446	EE	On-Demand	Anodyne	ADAM9	54	33
O[C@@H](CNCCOc1ccc(C(F)(F)F)cn1)c1cccc(C(F)(F)F)c1	ZINC000819161458	GH	On-Demand	Anodyne	ADRB1	26	41
O[C@@H](CNCCOc1ccc(C(F)(F)F)cn1)c1cccc(C(F)(F)F)c1	ZINC000819161458	GH	On-Demand	Anodyne	ADRB3	31	41
O[C@H](CNCCOc1ccc(C(F)(F)F)cn1)c1cccc(C(F)(F)F)c1	ZINC000819161459	GH	On-Demand	Anodyne	ADRB1	26	41
O[C@H](CNCCOc1ccc(C(F)(F)F)cn1)c1cccc(C(F)(F)F)c1	ZINC000819161459	GH	On-Demand	Anodyne	ADRB3	31	41
CCO[C@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819161461	FF	On-Demand	Mild	PAPA1_CARPA	32	42
CCO[C@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819161463	FF	On-Demand	Mild	PAPA1_CARPA	32	42
Cc1ccc(S(=O)(=O)N2CC[C@H](n3cc(C(N)=O)nn3)C2)cc1C(=O)O	ZINC000819161482	GC	On-Demand	Anodyne	GCKR	43	30
Cc1ccc(S(=O)(=O)N2CC[C@@H](n3cc(C(N)=O)nn3)C2)cc1C(=O)O	ZINC000819161483	GC	On-Demand	Anodyne	GCKR	43	30
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000819161492	DE	On-Demand	Anodyne	NOS2	96	36
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000819161493	DE	On-Demand	Anodyne	NOS2	96	36
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000819161494	DE	On-Demand	Anodyne	NOS2	96	36
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000819161495	DE	On-Demand	Anodyne	NOS2	96	36
O[C@@H](CNCCOc1ncccc1Cl)c1cccc(F)c1	ZINC000819161500	DF	On-Demand	Anodyne	ADRB1	37	41
O[C@@H](CNCCOc1ncccc1Cl)c1cccc(F)c1	ZINC000819161500	DF	On-Demand	Anodyne	ADRB3	49	41
O[C@H](CNCCOc1ncccc1Cl)c1cccc(F)c1	ZINC000819161501	DF	On-Demand	Anodyne	ADRB1	37	41
O[C@H](CNCCOc1ncccc1Cl)c1cccc(F)c1	ZINC000819161501	DF	On-Demand	Anodyne	ADRB3	49	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(Cl)cn2)cc1	ZINC000819161527	FD	On-Demand	Anodyne	ADRB2	18	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(Cl)cn2)cc1	ZINC000819161527	FD	On-Demand	Anodyne	ADRB3	48	39
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(Cl)cn2)cc1	ZINC000819161528	FD	On-Demand	Anodyne	ADRB2	18	42
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(Cl)cn2)cc1	ZINC000819161528	FD	On-Demand	Anodyne	ADRB3	48	39
CCCCNC(=O)NNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819161532	EC	On-Demand	Reactive	MTNR1A	55	45
CCCCNC(=O)NNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819161532	EC	On-Demand	Reactive	MTNR1B	51	45
CCCCNC(=O)NNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819161534	EC	On-Demand	Reactive	MTNR1A	55	45
CCCCNC(=O)NNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819161534	EC	On-Demand	Reactive	MTNR1B	51	45
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161551	EE	On-Demand	Anodyne	ADRB3	16	49
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161551	EE	On-Demand	Anodyne	MLNR	18	42
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161551	EE	On-Demand	Anodyne	EPHX2	29	54
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161551	EE	On-Demand	Anodyne	MCHR1	23	42
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161551	EE	On-Demand	Anodyne	LIPG	44	34
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161552	EE	On-Demand	Anodyne	ADRB3	16	49
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161552	EE	On-Demand	Anodyne	MLNR	18	42
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161552	EE	On-Demand	Anodyne	EPHX2	29	54
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161552	EE	On-Demand	Anodyne	MCHR1	23	42
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161552	EE	On-Demand	Anodyne	LIPG	44	34
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161553	EE	On-Demand	Anodyne	ADRB3	16	49
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161553	EE	On-Demand	Anodyne	MLNR	18	42
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161553	EE	On-Demand	Anodyne	EPHX2	29	54
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161553	EE	On-Demand	Anodyne	MCHR1	23	42
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161553	EE	On-Demand	Anodyne	LIPG	44	34
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161554	EE	On-Demand	Anodyne	ADRB3	16	49
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161554	EE	On-Demand	Anodyne	MLNR	18	42
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161554	EE	On-Demand	Anodyne	EPHX2	29	54
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161554	EE	On-Demand	Anodyne	MCHR1	23	42
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819161554	EE	On-Demand	Anodyne	LIPG	44	34
CCCCNC(=O)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819161564	EE	On-Demand	Reactive	HRH2	26	44
CCCCNC(=O)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819161564	EE	On-Demand	Reactive	MTNR1A	30	46
CCCCNC(=O)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819161564	EE	On-Demand	Reactive	MTNR1B	28	46
CCCCNC(=O)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819161564	EE	On-Demand	Reactive	CRTM	53	38
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819161589	GF	On-Demand	Anodyne	CMA1	26	40
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819161589	GF	On-Demand	Anodyne	CCR3	51	42
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819161589	GF	On-Demand	Anodyne	CACNA1I	52	33
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819161590	GF	On-Demand	Anodyne	CMA1	26	40
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819161590	GF	On-Demand	Anodyne	CCR3	51	42
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819161590	GF	On-Demand	Anodyne	CACNA1I	52	33
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2COc3ccc(Cl)cc32)CC1	ZINC000819161608	GG	On-Demand	Anodyne	GPR119	33	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2COc3ccc(Cl)cc32)CC1	ZINC000819161609	GG	On-Demand	Anodyne	GPR119	33	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2COc3ccc(Cl)cc32)CC1	ZINC000819161610	GG	On-Demand	Anodyne	GPR119	33	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2COc3ccc(Cl)cc32)CC1	ZINC000819161611	GG	On-Demand	Anodyne	GPR119	33	45
CCN(CC)C(=O)CNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819161617	DD	On-Demand	Anodyne	KCNK3	55	34
CCN(CC)C(=O)CNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819161619	EE	On-Demand	Anodyne	MTNR1A	16	44
CCN(CC)C(=O)CNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819161619	EE	On-Demand	Anodyne	MTNR1B	17	44
CCN(CC)C(=O)CNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819161619	EE	On-Demand	Anodyne	CRTM	61	38
CCN(CC)C(=O)CNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819161619	EE	On-Demand	Anodyne	PDS	50	33
C=C(C)COCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819161621	CF	On-Demand	Mild	ADRB2	30	40
C=C(C)COCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819161621	CF	On-Demand	Mild	ADRB1	30	40
C=C(C)COCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819161621	CF	On-Demand	Mild	ADRB3	27	40
C=C(C)COCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819161622	CF	On-Demand	Mild	ADRB2	30	40
C=C(C)COCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819161622	CF	On-Demand	Mild	ADRB1	30	40
C=C(C)COCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819161622	CF	On-Demand	Mild	ADRB3	27	40
C=C(C)C(C)(C)C(=O)Nc1cccc(NC(=O)OCC(C)C)c1	ZINC000819161636	DI	On-Demand	Mild	KCNK3	47	36
C=C(C)C(C)(C)C(=O)Nc1cccc(NC(=O)OCC(C)C)c1	ZINC000819161636	DI	On-Demand	Mild	KCNK9	45	36
NC(=O)c1cn([C@@H]2CCN(S(=O)(=O)c3ccc(Cl)c(C(=O)O)c3)C2)nn1	ZINC000819161637	GC	On-Demand	Anodyne	GCK	54	31
NC(=O)c1cn([C@H]2CCN(S(=O)(=O)c3ccc(Cl)c(C(=O)O)c3)C2)nn1	ZINC000819161638	GC	On-Demand	Anodyne	GCK	54	31
NC(=O)c1cn([C@@H]2CCN(S(=O)(=O)c3ccc(F)c(C(=O)O)c3)C2)nn1	ZINC000819161655	GB	On-Demand	Anodyne	GCKR	71	32
NC(=O)c1cn([C@H]2CCN(S(=O)(=O)c3ccc(F)c(C(=O)O)c3)C2)nn1	ZINC000819161656	GB	On-Demand	Anodyne	GCKR	71	32
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@H](n2cc(C(N)=O)nn2)C1	ZINC000819161661	GB	On-Demand	Anodyne	CPT1A	57	38
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@H](n2cc(C(N)=O)nn2)C1	ZINC000819161661	GB	On-Demand	Anodyne	CPT2	47	38
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@H](n2cc(C(N)=O)nn2)C1	ZINC000819161661	GB	On-Demand	Anodyne	CPT1B	42	35
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@@H](n2cc(C(N)=O)nn2)C1	ZINC000819161662	GB	On-Demand	Anodyne	CPT1A	57	38
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@@H](n2cc(C(N)=O)nn2)C1	ZINC000819161662	GB	On-Demand	Anodyne	CPT2	47	38
COc1ccc(C(=O)O)cc1S(=O)(=O)N1CC[C@@H](n2cc(C(N)=O)nn2)C1	ZINC000819161662	GB	On-Demand	Anodyne	CPT1B	42	35
COC(=O)N1CCC(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819161666	GG	On-Demand	Anodyne	DRD4	20	45
COC(=O)N1CCC(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819161666	GG	On-Demand	Anodyne	P2RY12	111	36
O[C@@H](CNCCOc1ccc(Cl)cn1)c1cccc(Br)c1	ZINC000819161671	FG	On-Demand	Anodyne	ADRB1	39	45
O[C@@H](CNCCOc1ccc(Cl)cn1)c1cccc(Br)c1	ZINC000819161671	FG	On-Demand	Anodyne	ADRB3	44	45
O[C@H](CNCCOc1ccc(Cl)cn1)c1cccc(Br)c1	ZINC000819161672	FG	On-Demand	Anodyne	ADRB1	39	45
O[C@H](CNCCOc1ccc(Cl)cn1)c1cccc(Br)c1	ZINC000819161672	FG	On-Demand	Anodyne	ADRB3	44	45
COc1ccc(OC)c([C@H](O)CNCCOc2ncccc2Cl)c1	ZINC000819161677	FE	On-Demand	Anodyne	ADRB2	19	41
O[C@@H](CNCCOc1ccc(C(F)(F)F)cn1)c1ccccc1Cl	ZINC000819161678	FG	On-Demand	Anodyne	LIPE	16	41
O[C@@H](CNCCOc1ccc(Cl)cn1)c1cccc(F)c1	ZINC000819161704	DF	On-Demand	Anodyne	ADRB1	39	45
O[C@@H](CNCCOc1ccc(Cl)cn1)c1cccc(F)c1	ZINC000819161704	DF	On-Demand	Anodyne	ADRB3	46	45
O[C@H](CNCCOc1ccc(Cl)cn1)c1cccc(F)c1	ZINC000819161705	DF	On-Demand	Anodyne	ADRB1	39	45
O[C@H](CNCCOc1ccc(Cl)cn1)c1cccc(F)c1	ZINC000819161705	DF	On-Demand	Anodyne	ADRB3	46	45
O[C@@H](CN[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21)c1cccnc1	ZINC000819161714	BD	On-Demand	Anodyne	ADRB3	64	44
O[C@H](CNC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12)c1cccnc1	ZINC000819161715	BD	On-Demand	Anodyne	ADRB3	64	44
O[C@H](CN[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21)c1cccnc1	ZINC000819161716	BD	On-Demand	Anodyne	ADRB3	64	44
O[C@H](CNC1[C@H]2[C@H]3CC[C@@H](C3)[C@H]12)c1cccnc1	ZINC000819161717	BD	On-Demand	Anodyne	ADRB3	64	44
O=C(NCC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819161718	DG	On-Demand	Anodyne	CHRM2	20	41
O=C(NCC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819161718	DG	On-Demand	Anodyne	DRD2	27	53
O=C(NCC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819161718	DG	On-Demand	Anodyne	DRD4	53	53
O=C(NCC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819161718	DG	On-Demand	Anodyne	ACHE	63	50
O=C(NCC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819161718	DG	On-Demand	Anodyne	HRH1	15	42
O=C(NCC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819161718	DG	On-Demand	Anodyne	DRD3	16	44
O=C(NCC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819161718	DG	On-Demand	Anodyne	SLC6A3	22	46
O=C(NCC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819161718	DG	On-Demand	Anodyne	HTR4	54	48
O=C(NCC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819161718	DG	On-Demand	Anodyne	CHRM3	24	41
O=C(NCC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819161718	DG	On-Demand	Anodyne	LTA4H	31	41
O=C(NCC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819161718	DG	On-Demand	Anodyne	HRH3	15	41
O=C(NCC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819161718	DG	On-Demand	Anodyne	SIGMAR1	81	48
O=C(NCC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819161718	DG	On-Demand	Anodyne	BCHE	20	43
O=C(NCC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819161718	DG	On-Demand	Anodyne	CCR3	46	40
O=C(NCC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819161718	DG	On-Demand	Anodyne	MCHR1	25	41
O=C(NCC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819161718	DG	On-Demand	Anodyne	CACNA1G	35	42
O=C(NCC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819161718	DG	On-Demand	Anodyne	CACNA1I	64	45
O=C(NCC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819161718	DG	On-Demand	Anodyne	NPFFR1	40	36
CCC(=O)N1CC[C@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819161762	ED	On-Demand	Anodyne	EPHX2	23	44
CCC(=O)N1CC[C@@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819161763	ED	On-Demand	Anodyne	EPHX2	23	44
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819161798	CD	On-Demand	Anodyne	ADRB3	43	39
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819161798	CD	On-Demand	Anodyne	EPHX2	22	46
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819161798	CD	On-Demand	Anodyne	CCR8	62	38
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819161798	CD	On-Demand	Anodyne	Q8WSF8_APLCA	33	40
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819161802	CD	On-Demand	Anodyne	ADRB3	43	39
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819161802	CD	On-Demand	Anodyne	EPHX2	22	46
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819161802	CD	On-Demand	Anodyne	CCR8	62	38
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819161802	CD	On-Demand	Anodyne	Q8WSF8_APLCA	33	40
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819161803	CD	On-Demand	Anodyne	ADRB3	43	39
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819161803	CD	On-Demand	Anodyne	EPHX2	22	46
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819161803	CD	On-Demand	Anodyne	CCR8	62	38
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819161803	CD	On-Demand	Anodyne	Q8WSF8_APLCA	33	40
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819161804	CD	On-Demand	Anodyne	ADRB3	43	39
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819161804	CD	On-Demand	Anodyne	EPHX2	22	46
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819161804	CD	On-Demand	Anodyne	CCR8	62	38
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819161804	CD	On-Demand	Anodyne	Q8WSF8_APLCA	33	40
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819161807	CC	On-Demand	Anodyne	ADRB1	26	42
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819161807	CC	On-Demand	Anodyne	ADRB3	82	49
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819161807	CC	On-Demand	Anodyne	PTAFR	16	49
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819161807	CC	On-Demand	Anodyne	C3AR1	45	42
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819161807	CC	On-Demand	Anodyne	EPHX2	15	40
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819161807	CC	On-Demand	Anodyne	SCD	21	40
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819161809	CC	On-Demand	Anodyne	ADRB1	26	42
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819161809	CC	On-Demand	Anodyne	ADRB3	82	49
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819161809	CC	On-Demand	Anodyne	PTAFR	16	49
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819161809	CC	On-Demand	Anodyne	C3AR1	45	42
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819161809	CC	On-Demand	Anodyne	EPHX2	15	40
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819161809	CC	On-Demand	Anodyne	SCD	21	40
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819161810	CC	On-Demand	Anodyne	ADRB1	26	42
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819161810	CC	On-Demand	Anodyne	ADRB3	82	49
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819161810	CC	On-Demand	Anodyne	PTAFR	16	49
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819161810	CC	On-Demand	Anodyne	C3AR1	45	42
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819161810	CC	On-Demand	Anodyne	EPHX2	15	40
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819161810	CC	On-Demand	Anodyne	SCD	21	40
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819161811	CC	On-Demand	Anodyne	ADRB1	26	42
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819161811	CC	On-Demand	Anodyne	ADRB3	82	49
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819161811	CC	On-Demand	Anodyne	PTAFR	16	49
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819161811	CC	On-Demand	Anodyne	C3AR1	45	42
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819161811	CC	On-Demand	Anodyne	EPHX2	15	40
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819161811	CC	On-Demand	Anodyne	SCD	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCN(c3nccs3)CC1)C2	ZINC000819161815	GE	On-Demand	Anodyne	NPBWR1	41	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCN(c3nccs3)CC1)C2	ZINC000819161817	GE	On-Demand	Anodyne	NPBWR1	41	43
CCc1nnc(O)c(CNC[C@H](O)c2cccc(Cl)c2)c1CC	ZINC000819161841	EF	On-Demand	Anodyne	ADRB1	27	41
CCc1nnc(O)c(CNC[C@H](O)c2cccc(Cl)c2)c1CC	ZINC000819161841	EF	On-Demand	Anodyne	ADRB3	39	41
CCc1nnc(O)c(CNC[C@@H](O)c2cccc(Cl)c2)c1CC	ZINC000819161844	EF	On-Demand	Anodyne	ADRB1	27	41
CCc1nnc(O)c(CNC[C@@H](O)c2cccc(Cl)c2)c1CC	ZINC000819161844	EF	On-Demand	Anodyne	ADRB3	39	41
CC[C@@H](NCCS(=O)(=O)CC)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819161867	FD	On-Demand	Anodyne	DRD4	19	43
CC[C@@H](NCCS(=O)(=O)CC)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819161868	FD	On-Demand	Anodyne	DRD4	19	43
O=C(C[C@H](NCc1ccc2c(c1)OC(F)(F)O2)C(=O)O)OCc1ccccc1	ZINC000819161871	GF	On-Demand	Anodyne	CPA1	26	40
O=C(C[C@H](NCc1ccc2c(c1)OC(F)(F)O2)C(=O)O)OCc1ccccc1	ZINC000819161871	GF	On-Demand	Anodyne	NPR	52	37
CS(=O)(=O)c1ccc([C@H](O)CNCCCOc2ccc3ccccc3c2)cc1	ZINC000819161873	GG	On-Demand	Anodyne	ADRB2	59	46
CS(=O)(=O)c1ccc([C@H](O)CNCCCOc2ccc3ccccc3c2)cc1	ZINC000819161873	GG	On-Demand	Anodyne	ADRB1	57	43
CS(=O)(=O)c1ccc([C@H](O)CNCCCOc2ccc3ccccc3c2)cc1	ZINC000819161873	GG	On-Demand	Anodyne	ADRB3	105	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCCOc2ccc3ccccc3c2)cc1	ZINC000819161874	GG	On-Demand	Anodyne	ADRB2	59	46
CS(=O)(=O)c1ccc([C@@H](O)CNCCCOc2ccc3ccccc3c2)cc1	ZINC000819161874	GG	On-Demand	Anodyne	ADRB1	57	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCCOc2ccc3ccccc3c2)cc1	ZINC000819161874	GG	On-Demand	Anodyne	ADRB3	105	43
CCCCNC(=O)NNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819161875	DD	On-Demand	Reactive	INHA	19	42
CCCCNC(=O)NNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819161875	DD	On-Demand	Reactive	MTNR1A	41	37
COCCOC(=O)Nc1cccc(NC(=O)C2(c3ccc(C)cc3)CCC2)c1	ZINC000819161945	GI	On-Demand	Anodyne	KCNK3	72	36
COCCOC(=O)Nc1cccc(NC(=O)C2(c3ccc(C)cc3)CCC2)c1	ZINC000819161945	GI	On-Demand	Anodyne	KCNK9	60	36
CC(C)(C)OC(=O)N[C@@H](CNCc1ccc2c(c1)OC(F)(F)O2)C(=O)O	ZINC000819161947	FE	On-Demand	Anodyne	FPR1	49	39
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ncc(Cl)cc2Cl)c1	ZINC000819161981	FF	On-Demand	Bother	ADRB1	43	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ncc(Cl)cc2Cl)c1	ZINC000819161981	FF	On-Demand	Bother	ADRB3	56	42
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ncc(Cl)cc2Cl)c1	ZINC000819161983	FF	On-Demand	Bother	ADRB1	43	42
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ncc(Cl)cc2Cl)c1	ZINC000819161983	FF	On-Demand	Bother	ADRB3	56	42
CC(C)c1cccc(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819161987	FI	On-Demand	Mild	PAPA1_CARPA	52	42
CC(C)c1cccc(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819161987	FI	On-Demand	Mild	CTSK	28	43
CC(C)c1cccc(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819161987	FI	On-Demand	Mild	CTSL	17	43
CC(C)c1cccc(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819161987	FI	On-Demand	Mild	CTSS	16	43
CC(C)c1cccc(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819161987	FI	On-Demand	Mild	FPR1	44	37
CC(C)c1cccc(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819161991	FI	On-Demand	Mild	PAPA1_CARPA	52	42
CC(C)c1cccc(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819161991	FI	On-Demand	Mild	CTSK	28	43
CC(C)c1cccc(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819161991	FI	On-Demand	Mild	CTSL	17	43
CC(C)c1cccc(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819161991	FI	On-Demand	Mild	CTSS	16	43
CC(C)c1cccc(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819161991	FI	On-Demand	Mild	FPR1	44	37
O[C@H](CNCCOc1ncc(Cl)cc1Cl)c1cccnc1	ZINC000819162033	EE	On-Demand	Anodyne	ADRB2	36	57
O[C@H](CNCCOc1ncc(Cl)cc1Cl)c1cccnc1	ZINC000819162033	EE	On-Demand	Anodyne	ADRB1	54	57
O[C@H](CNCCOc1ncc(Cl)cc1Cl)c1cccnc1	ZINC000819162033	EE	On-Demand	Anodyne	ADRB3	124	57
O[C@@H](CNCCOc1ncc(Cl)cc1Cl)c1cccnc1	ZINC000819162035	EE	On-Demand	Anodyne	ADRB2	36	57
O[C@@H](CNCCOc1ncc(Cl)cc1Cl)c1cccnc1	ZINC000819162035	EE	On-Demand	Anodyne	ADRB1	54	57
O[C@@H](CNCCOc1ncc(Cl)cc1Cl)c1cccnc1	ZINC000819162035	EE	On-Demand	Anodyne	ADRB3	124	57
CC(C)(C)OC(=O)NC[C@@H]1CCCN(C(=O)c2coc(=O)c3ccccc23)C1	ZINC000819162045	GG	On-Demand	Anodyne	INHA	44	34
CC(C)(C)OC(=O)NC[C@@H]1CCCN(C(=O)c2coc(=O)c3ccccc23)C1	ZINC000819162045	GG	On-Demand	Anodyne	ACACB	17	43
CC(C)(C)OC(=O)NC[C@H]1CCCN(C(=O)c2coc(=O)c3ccccc23)C1	ZINC000819162047	GG	On-Demand	Anodyne	INHA	44	34
CC(C)(C)OC(=O)NC[C@H]1CCCN(C(=O)c2coc(=O)c3ccccc23)C1	ZINC000819162047	GG	On-Demand	Anodyne	ACACB	17	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCCN(c2nccs2)CC1	ZINC000819162060	FE	On-Demand	Anodyne	NPBWR1	54	43
CCCCNC(=O)NNC(=O)c1cc(OC)ccc1OCC(F)(F)C(F)F	ZINC000819162115	GF	On-Demand	Reactive	MTNR1A	29	41
CCCCNC(=O)NNC(=O)c1cc(OC)ccc1OCC(F)(F)C(F)F	ZINC000819162115	GF	On-Demand	Reactive	MTNR1B	24	41
CC(C)(C)OC(=O)NC[C@@H]1CCCN(C(=O)Cc2nsc3ccccc23)C1	ZINC000819162134	GH	On-Demand	Anodyne	HTR1A	15	43
CC(C)(C)OC(=O)NC[C@@H]1CCCN(C(=O)Cc2nsc3ccccc23)C1	ZINC000819162134	GH	On-Demand	Anodyne	DRD2	19	43
CC(C)(C)OC(=O)NC[C@@H]1CCCN(C(=O)Cc2nsc3ccccc23)C1	ZINC000819162134	GH	On-Demand	Anodyne	ACACB	16	43
CC(C)(C)OC(=O)NC[C@H]1CCCN(C(=O)Cc2nsc3ccccc23)C1	ZINC000819162135	GH	On-Demand	Anodyne	HTR1A	15	43
CC(C)(C)OC(=O)NC[C@H]1CCCN(C(=O)Cc2nsc3ccccc23)C1	ZINC000819162135	GH	On-Demand	Anodyne	DRD2	19	43
CC(C)(C)OC(=O)NC[C@H]1CCCN(C(=O)Cc2nsc3ccccc23)C1	ZINC000819162135	GH	On-Demand	Anodyne	ACACB	16	43
COc1ccc(OC)c([C@H](O)CNCCOc2ncc(Cl)cc2Cl)c1	ZINC000819162137	GG	On-Demand	Anodyne	ADRB2	17	42
CS[C@@H]1CC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819162163	CF	On-Demand	Anodyne	ADRB1	33	43
CS[C@@H]1CC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819162163	CF	On-Demand	Anodyne	ADRB3	50	46
CS[C@@H]1CC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819162163	CF	On-Demand	Anodyne	CYP3A4	48	37
CS[C@@H]1CC[C@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819162164	CF	On-Demand	Anodyne	ADRB1	33	43
CS[C@@H]1CC[C@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819162164	CF	On-Demand	Anodyne	ADRB3	50	46
CS[C@@H]1CC[C@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819162164	CF	On-Demand	Anodyne	CYP3A4	48	37
COc1cccc([S@@](=O)CC(=O)NNC(=O)NC2CC2)c1	ZINC000819162167	DC	On-Demand	Reactive	MTNR1A	31	40
COc1cccc([S@@](=O)CC(=O)NNC(=O)NC2CC2)c1	ZINC000819162167	DC	On-Demand	Reactive	MTNR1B	31	40
O=C(O)C[C@H](Cc1ccccc1)NCc1ccc2c(c1)OC(F)(F)O2	ZINC000819162235	EG	On-Demand	Anodyne	MME	65	44
O=C(O)C[C@H](Cc1ccccc1)NCc1ccc2c(c1)OC(F)(F)O2	ZINC000819162235	EG	On-Demand	Anodyne	CPA1	42	40
O=C(O)C[C@@H](Cc1ccccc1)NCc1ccc2c(c1)OC(F)(F)O2	ZINC000819162236	EG	On-Demand	Anodyne	MME	65	44
O=C(O)C[C@@H](Cc1ccccc1)NCc1ccc2c(c1)OC(F)(F)O2	ZINC000819162236	EG	On-Demand	Anodyne	CPA1	42	40
O[C@H](CN[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21)c1cccc(Cl)c1	ZINC000819162255	CG	On-Demand	Anodyne	ADRB1	32	41
O[C@H](CN[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21)c1cccc(Cl)c1	ZINC000819162255	CG	On-Demand	Anodyne	ADRB3	46	45
O[C@H](CN[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21)c1cccc(Cl)c1	ZINC000819162255	CG	On-Demand	Anodyne	CYP3A4	47	37
O[C@H](CNC1[C@H]2[C@H]3CC[C@@H](C3)[C@H]12)c1cccc(Cl)c1	ZINC000819162256	CG	On-Demand	Anodyne	ADRB1	32	41
O[C@H](CNC1[C@H]2[C@H]3CC[C@@H](C3)[C@H]12)c1cccc(Cl)c1	ZINC000819162256	CG	On-Demand	Anodyne	ADRB3	46	45
O[C@H](CNC1[C@H]2[C@H]3CC[C@@H](C3)[C@H]12)c1cccc(Cl)c1	ZINC000819162256	CG	On-Demand	Anodyne	CYP3A4	47	37
O[C@H](CNC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12)c1cccc(Cl)c1	ZINC000819162257	CG	On-Demand	Anodyne	ADRB1	32	41
O[C@H](CNC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12)c1cccc(Cl)c1	ZINC000819162257	CG	On-Demand	Anodyne	ADRB3	46	45
O[C@H](CNC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12)c1cccc(Cl)c1	ZINC000819162257	CG	On-Demand	Anodyne	CYP3A4	47	37
O[C@@H](CN[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21)c1cccc(Cl)c1	ZINC000819162258	CG	On-Demand	Anodyne	ADRB1	32	41
O[C@@H](CN[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21)c1cccc(Cl)c1	ZINC000819162258	CG	On-Demand	Anodyne	ADRB3	46	45
O[C@@H](CN[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21)c1cccc(Cl)c1	ZINC000819162258	CG	On-Demand	Anodyne	CYP3A4	47	37
O[C@@H](CNCCOc1ncc(Cl)cc1Cl)c1ccc(F)c(F)c1	ZINC000819162312	FG	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNCCOc1ncc(Cl)cc1Cl)c1ccc(F)c(F)c1	ZINC000819162312	FG	On-Demand	Anodyne	ADRB1	30	40
O[C@@H](CNCCOc1ncc(Cl)cc1Cl)c1ccc(F)c(F)c1	ZINC000819162312	FG	On-Demand	Anodyne	ADRB3	34	40
O[C@H](CNCCOc1ncc(Cl)cc1Cl)c1ccc(F)c(F)c1	ZINC000819162313	FG	On-Demand	Anodyne	ADRB2	19	40
O[C@H](CNCCOc1ncc(Cl)cc1Cl)c1ccc(F)c(F)c1	ZINC000819162313	FG	On-Demand	Anodyne	ADRB1	30	40
O[C@H](CNCCOc1ncc(Cl)cc1Cl)c1ccc(F)c(F)c1	ZINC000819162313	FG	On-Demand	Anodyne	ADRB3	34	40
CC(=O)Nc1cccc(CC(=O)NNC(=O)NC2CC2)c1	ZINC000819162362	CC	On-Demand	Reactive	SIGMAR1	18	41
CC(=O)Nc1cccc(CC(=O)NNC(=O)NC2CC2)c1	ZINC000819162362	CC	On-Demand	Reactive	NPY1R	25	42
CC(=O)Nc1cccc(CC(=O)NNC(=O)NC2CC2)c1	ZINC000819162362	CC	On-Demand	Reactive	EPHX2	40	45
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819162419	CD	On-Demand	Anodyne	CCR5	33	43
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819162419	CD	On-Demand	Anodyne	MLNR	36	41
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819162419	CD	On-Demand	Anodyne	EPHX2	18	44
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819162421	CD	On-Demand	Anodyne	CCR5	33	43
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819162421	CD	On-Demand	Anodyne	MLNR	36	41
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819162421	CD	On-Demand	Anodyne	EPHX2	18	44
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819162423	CD	On-Demand	Anodyne	CCR5	33	43
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819162423	CD	On-Demand	Anodyne	MLNR	36	41
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819162423	CD	On-Demand	Anodyne	EPHX2	18	44
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819162425	CD	On-Demand	Anodyne	CCR5	33	43
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819162425	CD	On-Demand	Anodyne	MLNR	36	41
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819162425	CD	On-Demand	Anodyne	EPHX2	18	44
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819162439	DE	On-Demand	Anodyne	CCR8	77	39
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819162443	DE	On-Demand	Anodyne	CCR8	77	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCc1cccc(C(F)(F)F)c1)C2	ZINC000819162446	GH	On-Demand	Anodyne	CCR2	74	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCc1cccc(C(F)(F)F)c1)C2	ZINC000819162446	GH	On-Demand	Anodyne	PDS	35	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCc1cccc(C(F)(F)F)c1)C2	ZINC000819162447	GH	On-Demand	Anodyne	CCR2	74	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCc1cccc(C(F)(F)F)c1)C2	ZINC000819162447	GH	On-Demand	Anodyne	PDS	35	40
Cc1nn(-c2ccccc2)c(Cl)c1CN[C@@H](C)[C@@H](C(=O)O)C(C)C	ZINC000819162469	EH	On-Demand	Anodyne	P2RX7	17	47
Cc1nn(-c2ccccc2)c(Cl)c1CN[C@H](C)[C@@H](C(=O)O)C(C)C	ZINC000819162471	EH	On-Demand	Anodyne	P2RX7	17	47
Cc1nn(-c2ccccc2)c(Cl)c1CN[C@H](C)[C@H](C(=O)O)C(C)C	ZINC000819162473	EH	On-Demand	Anodyne	P2RX7	17	47
Cc1nn(-c2ccccc2)c(Cl)c1CN[C@@H](C)[C@H](C(=O)O)C(C)C	ZINC000819162476	EH	On-Demand	Anodyne	P2RX7	17	47
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@H]2COc3ccc(Cl)cc32)CC1	ZINC000819162492	GH	On-Demand	Anodyne	GPR119	18	40
O[C@H](CN[C@@H]1CCC[C@H]2OCC[C@@H]12)c1cccnc1	ZINC000819162527	CD	On-Demand	Anodyne	ADRB3	59	40
COc1cccc([S@@](=O)CC(=O)NNC(=O)NCCc2cccs2)c1	ZINC000819162528	GD	On-Demand	Reactive	BMP1	16	42
COc1cccc([S@@](=O)CC(=O)NNC(=O)NCCc2cccs2)c1	ZINC000819162528	GD	On-Demand	Reactive	MTNR1A	62	38
COc1cccc([S@@](=O)CC(=O)NNC(=O)NCCc2cccs2)c1	ZINC000819162528	GD	On-Demand	Reactive	MTNR1B	59	37
O[C@H](CN[C@@H]1CCC[C@H]2OCC[C@H]12)c1cccnc1	ZINC000819162529	CD	On-Demand	Anodyne	ADRB3	59	40
O[C@H](CN[C@@H]1CCC[C@@H]2OCC[C@@H]21)c1cccnc1	ZINC000819162531	CD	On-Demand	Anodyne	ADRB3	59	40
O[C@H](CN[C@@H]1CCC[C@@H]2OCC[C@H]21)c1cccnc1	ZINC000819162533	CD	On-Demand	Anodyne	ADRB3	59	40
Cc1noc(C)c1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819162535	FE	On-Demand	Mild	PAPA1_CARPA	44	50
Cc1noc(C)c1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819162538	FE	On-Demand	Mild	PAPA1_CARPA	44	50
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCc1ccc(OC)c(OC)c1)C2	ZINC000819162540	GF	On-Demand	Anodyne	FKBP1A	36	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCc1ccc(OC)c(OC)c1)C2	ZINC000819162540	GF	On-Demand	Anodyne	MTNR1A	16	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCc1ccc(OC)c(OC)c1)C2	ZINC000819162540	GF	On-Demand	Anodyne	MTNR1B	25	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCc1ccc(OC)c(OC)c1)C2	ZINC000819162543	GF	On-Demand	Anodyne	FKBP1A	36	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCc1ccc(OC)c(OC)c1)C2	ZINC000819162543	GF	On-Demand	Anodyne	MTNR1A	16	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCc1ccc(OC)c(OC)c1)C2	ZINC000819162543	GF	On-Demand	Anodyne	MTNR1B	25	45
O[C@H](CNCCc1cscn1)c1ccc(OC(F)(F)F)cc1	ZINC000819162549	EF	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNCCc1cscn1)c1ccc(OC(F)(F)F)cc1	ZINC000819162549	EF	On-Demand	Anodyne	ADRB1	17	41
O[C@H](CNCCc1cscn1)c1ccc(OC(F)(F)F)cc1	ZINC000819162549	EF	On-Demand	Anodyne	ADRB3	24	42
O[C@@H](CNCCc1cscn1)c1ccc(OC(F)(F)F)cc1	ZINC000819162551	EF	On-Demand	Anodyne	ADRB2	20	41
O[C@@H](CNCCc1cscn1)c1ccc(OC(F)(F)F)cc1	ZINC000819162551	EF	On-Demand	Anodyne	ADRB1	17	41
O[C@@H](CNCCc1cscn1)c1ccc(OC(F)(F)F)cc1	ZINC000819162551	EF	On-Demand	Anodyne	ADRB3	24	42
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819162562	CD	On-Demand	Anodyne	ADRB3	20	48
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819162562	CD	On-Demand	Anodyne	EPHX2	17	46
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819162564	CD	On-Demand	Anodyne	ADRB3	20	48
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819162564	CD	On-Demand	Anodyne	EPHX2	17	46
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819162566	CD	On-Demand	Anodyne	ADRB3	20	48
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819162566	CD	On-Demand	Anodyne	EPHX2	17	46
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819162567	CD	On-Demand	Anodyne	ADRB3	20	48
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819162567	CD	On-Demand	Anodyne	EPHX2	17	46
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819162569	EE	On-Demand	Anodyne	CCR8	44	36
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@H]2COc3ccc(Cl)cc32)CC1	ZINC000819162603	GH	On-Demand	Anodyne	GPR119	18	40
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@@H]2COc3ccc(Cl)cc32)CC1	ZINC000819162604	GH	On-Demand	Anodyne	GPR119	18	40
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@@H]2COc3ccc(Cl)cc32)CC1	ZINC000819162605	GH	On-Demand	Anodyne	GPR119	18	40
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819162644	EE	On-Demand	Anodyne	CCR8	44	36
C=C(C)COCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819162645	DF	On-Demand	Mild	ADRB3	25	43
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819162646	EE	On-Demand	Anodyne	CCR8	44	36
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819162647	EE	On-Demand	Anodyne	CCR8	44	36
C=C(C)COCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819162648	DF	On-Demand	Mild	ADRB3	25	43
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819162651	DE	On-Demand	Anodyne	C3AR1	27	40
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819162651	DE	On-Demand	Anodyne	MLNR	24	41
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819162653	DE	On-Demand	Anodyne	C3AR1	27	40
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819162653	DE	On-Demand	Anodyne	MLNR	24	41
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819162655	DE	On-Demand	Anodyne	C3AR1	27	40
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819162655	DE	On-Demand	Anodyne	MLNR	24	41
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819162656	DE	On-Demand	Anodyne	C3AR1	27	40
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819162656	DE	On-Demand	Anodyne	MLNR	24	41
O[C@H](CNCCc1cscn1)c1cccnc1	ZINC000819162671	BD	On-Demand	Anodyne	ADRB2	36	60
O[C@H](CNCCc1cscn1)c1cccnc1	ZINC000819162671	BD	On-Demand	Anodyne	ADRB1	43	60
O[C@H](CNCCc1cscn1)c1cccnc1	ZINC000819162671	BD	On-Demand	Anodyne	ADRB3	127	60
O[C@@H](CNCCc1cscn1)c1cccnc1	ZINC000819162672	BD	On-Demand	Anodyne	ADRB2	36	60
O[C@@H](CNCCc1cscn1)c1cccnc1	ZINC000819162672	BD	On-Demand	Anodyne	ADRB1	43	60
O[C@@H](CNCCc1cscn1)c1cccnc1	ZINC000819162672	BD	On-Demand	Anodyne	ADRB3	127	60
O[C@H](CNCCc1cscn1)c1cccc(C(F)(F)F)c1	ZINC000819162673	DG	On-Demand	Anodyne	ADRB3	43	39
O[C@@H](CNCCc1cscn1)c1cccc(C(F)(F)F)c1	ZINC000819162674	DG	On-Demand	Anodyne	ADRB3	43	39
Cc1nn(-c2ccccc2)c(Cl)c1CN[C@@H]1CC[C@H](C(=O)O)C1	ZINC000819162676	EG	On-Demand	Anodyne	P2RX7	19	47
CCC(=O)N1CC[C@@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819162710	FD	On-Demand	Anodyne	GPR119	26	41
CCC(=O)N1CC[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819162711	FD	On-Demand	Anodyne	GPR119	26	41
CCC(=O)N1CC[C@@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819162713	FD	On-Demand	Anodyne	GPR119	26	41
CCC(=O)N1CC[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819162715	FD	On-Demand	Anodyne	GPR119	26	41
O[C@@H](CNCCOc1ncc(Cl)cc1Cl)c1cccc(F)c1	ZINC000819162719	EG	On-Demand	Anodyne	ADRB2	26	41
O[C@@H](CNCCOc1ncc(Cl)cc1Cl)c1cccc(F)c1	ZINC000819162719	EG	On-Demand	Anodyne	ADRB1	45	41
O[C@@H](CNCCOc1ncc(Cl)cc1Cl)c1cccc(F)c1	ZINC000819162719	EG	On-Demand	Anodyne	ADRB3	59	41
O[C@H](CNCCOc1ncc(Cl)cc1Cl)c1cccc(F)c1	ZINC000819162720	EG	On-Demand	Anodyne	ADRB2	26	41
O[C@H](CNCCOc1ncc(Cl)cc1Cl)c1cccc(F)c1	ZINC000819162720	EG	On-Demand	Anodyne	ADRB1	45	41
O[C@H](CNCCOc1ncc(Cl)cc1Cl)c1cccc(F)c1	ZINC000819162720	EG	On-Demand	Anodyne	ADRB3	59	41
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819162741	DE	On-Demand	Anodyne	SLC6A1	15	41
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819162744	DE	On-Demand	Anodyne	SLC6A1	15	41
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819162748	DE	On-Demand	Anodyne	SLC6A1	15	41
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819162751	DE	On-Demand	Anodyne	SLC6A1	15	41
CN(CCC#N)c1ccc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)cc1	ZINC000819162761	GH	On-Demand	Mild	MME	30	44
CN(CCC#N)c1ccc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)cc1	ZINC000819162761	GH	On-Demand	Mild	PAPA1_CARPA	27	45
CN(CCC#N)c1ccc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)cc1	ZINC000819162761	GH	On-Demand	Mild	CTSL	17	45
CN(CCC#N)c1ccc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)cc1	ZINC000819162761	GH	On-Demand	Mild	CPA1	21	40
CN(CCC#N)c1ccc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)cc1	ZINC000819162761	GH	On-Demand	Mild	ACE2	47	44
COCCOC(=O)Nc1cccc(NC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819162769	GG	On-Demand	Anodyne	NQO2	21	41
COCCOC(=O)Nc1cccc(NC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819162769	GG	On-Demand	Anodyne	MTNR1A	23	41
COCCOC(=O)Nc1cccc(NC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819162769	GG	On-Demand	Anodyne	MTNR1B	28	41
COCCOC(=O)Nc1cccc(NC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819162769	GG	On-Demand	Anodyne	KCNK3	102	38
COCCOC(=O)Nc1cccc(NC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819162769	GG	On-Demand	Anodyne	KCNK9	77	38
COCCCNC(=O)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819162793	ED	On-Demand	Reactive	HRH2	29	40
COCCCNC(=O)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819162793	ED	On-Demand	Reactive	MTNR1A	21	45
COCCCNC(=O)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819162793	ED	On-Demand	Reactive	MTNR1B	21	45
COCCCNC(=O)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819162793	ED	On-Demand	Reactive	CRTM	58	39
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(N2CCOCC2)cc1	ZINC000819162813	GG	On-Demand	Clean	ACE	18	45
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(N2CCOCC2)cc1	ZINC000819162813	GG	On-Demand	Clean	MME	42	47
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(N2CCOCC2)cc1	ZINC000819162813	GG	On-Demand	Clean	FCER2	21	40
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(N2CCOCC2)cc1	ZINC000819162813	GG	On-Demand	Clean	TRY2_BOVIN	66	42
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(N2CCOCC2)cc1	ZINC000819162813	GG	On-Demand	Clean	CPA1	30	45
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(N2CCOCC2)cc1	ZINC000819162813	GG	On-Demand	Clean	ITGA4	33	44
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(N2CCOCC2)cc1	ZINC000819162813	GG	On-Demand	Clean	ECE1	22	43
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(N2CCOCC2)cc1	ZINC000819162813	GG	On-Demand	Clean	ACE2	59	45
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(N2CCOCC2)cc1	ZINC000819162813	GG	On-Demand	Clean	STAT6	63	39
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(N2CCOCC2)cc1	ZINC000819162813	GG	On-Demand	Clean	PSMB8	22	40
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(C#N)c1	ZINC000819162866	FG	On-Demand	Mild	PAPA1_CARPA	53	43
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(C#N)c1	ZINC000819162866	FG	On-Demand	Mild	CTSK	16	42
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc(C#N)c1	ZINC000819162866	FG	On-Demand	Mild	CTRB_BOVIN	45	32
C=CCCn1cc(C(=O)Nc2cccc(NC(=O)OCCOC)c2)nn1	ZINC000819162884	FE	On-Demand	Mild	KCNK3	49	33
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1CC(C)(C)Oc2ccccc21	ZINC000819162885	FG	On-Demand	Anodyne	CTSD	22	41
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CC(C)(C)Oc2ccccc21	ZINC000819162886	FG	On-Demand	Anodyne	CTSD	22	41
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CC(C)(C)Oc2ccccc21	ZINC000819162887	FG	On-Demand	Anodyne	CTSD	22	41
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@H]1CC(C)(C)Oc2ccccc21	ZINC000819162888	FG	On-Demand	Anodyne	CTSD	22	41
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819162906	CD	On-Demand	Anodyne	OPRL1	40	41
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819162906	CD	On-Demand	Anodyne	ADRB3	16	48
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819162906	CD	On-Demand	Anodyne	EPHX2	15	44
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819162906	CD	On-Demand	Anodyne	CCR8	48	36
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819162907	CD	On-Demand	Anodyne	OPRL1	40	41
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819162907	CD	On-Demand	Anodyne	ADRB3	16	48
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819162907	CD	On-Demand	Anodyne	EPHX2	15	44
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819162907	CD	On-Demand	Anodyne	CCR8	48	36
O=C(O)[C@@H]1CC[C@H](NCc2ccc(Cl)nc2)C1	ZINC000819162911	CE	On-Demand	Anodyne	Q8WSF8_APLCA	42	32
O=C(O)[C@@H]1CC[C@H](NCc2ccc(Cl)nc2)C1	ZINC000819162911	CE	On-Demand	Anodyne	NACHRBETA2	53	38
O=C(Cn1cc(C(=O)O)c2ccccc21)Nc1ccc(OCC(F)(F)F)cc1	ZINC000819162912	GH	On-Demand	Anodyne	IMDH_CRYPV	34	40
CSc1ccc(Cl)cc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819162913	GJ	On-Demand	Mild	PAPA1_CARPA	43	45
CSc1ccc(Cl)cc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819162914	GJ	On-Demand	Mild	PAPA1_CARPA	43	45
O[C@@H](CNCCOc1ncc(Cl)cc1Cl)c1ccccc1	ZINC000819162917	EG	On-Demand	Anodyne	ADRB2	29	44
O[C@@H](CNCCOc1ncc(Cl)cc1Cl)c1ccccc1	ZINC000819162917	EG	On-Demand	Anodyne	ADRB1	56	44
O[C@@H](CNCCOc1ncc(Cl)cc1Cl)c1ccccc1	ZINC000819162917	EG	On-Demand	Anodyne	ADRB3	85	44
O[C@H](CNCCOc1ncc(Cl)cc1Cl)c1ccccc1	ZINC000819162918	EG	On-Demand	Anodyne	ADRB2	29	44
O[C@H](CNCCOc1ncc(Cl)cc1Cl)c1ccccc1	ZINC000819162918	EG	On-Demand	Anodyne	ADRB1	56	44
O[C@H](CNCCOc1ncc(Cl)cc1Cl)c1ccccc1	ZINC000819162918	EG	On-Demand	Anodyne	ADRB3	85	44
C[C@@H](CC(=O)N1CCC[C@@H]1Cc1ccc(Br)cc1)n1cccn1	ZINC000819162925	GH	On-Demand	Anodyne	DPP4	26	40
C[C@@H](CC(=O)N1CCC[C@@H]1Cc1ccc(Br)cc1)n1cccn1	ZINC000819162925	GH	On-Demand	Anodyne	DPP8	18	40
C[C@@H](CC(=O)N1CCC[C@H]1Cc1ccc(Br)cc1)n1cccn1	ZINC000819162926	GH	On-Demand	Anodyne	DPP4	26	40
C[C@@H](CC(=O)N1CCC[C@H]1Cc1ccc(Br)cc1)n1cccn1	ZINC000819162926	GH	On-Demand	Anodyne	DPP8	18	40
Cc1cc(CN[C@@H]2CC[C@H](C(=O)O)C2)cc(C)c1OCc1ccccc1Cl	ZINC000819162928	GJ	On-Demand	Anodyne	FABP4	15	41
Cc1cc(CN[C@@H]2CC[C@H](C(=O)O)C2)cc(C)c1OCc1ccccc1Cl	ZINC000819162928	GJ	On-Demand	Anodyne	FABP5	29	41
C=C(C)COCCNC[C@@H](O)c1cccnc1	ZINC000819162938	BD	On-Demand	Mild	ADRB2	32	54
C=C(C)COCCNC[C@@H](O)c1cccnc1	ZINC000819162938	BD	On-Demand	Mild	ADRB1	40	54
C=C(C)COCCNC[C@@H](O)c1cccnc1	ZINC000819162938	BD	On-Demand	Mild	ADRB3	113	54
C=C(C)COCCNC[C@H](O)c1cccnc1	ZINC000819162939	BD	On-Demand	Mild	ADRB2	32	54
C=C(C)COCCNC[C@H](O)c1cccnc1	ZINC000819162939	BD	On-Demand	Mild	ADRB1	40	54
C=C(C)COCCNC[C@H](O)c1cccnc1	ZINC000819162939	BD	On-Demand	Mild	ADRB3	113	54
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C1CCOCC1	ZINC000819162951	FE	On-Demand	Anodyne	GPR119	34	45
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C1CCOCC1	ZINC000819162953	FE	On-Demand	Anodyne	GPR119	34	45
C=C(C)COCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819162962	CF	On-Demand	Mild	ADRB2	54	42
C=C(C)COCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819162962	CF	On-Demand	Mild	ADRB1	66	48
C=C(C)COCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819162962	CF	On-Demand	Mild	ADRB3	76	48
C=C(C)COCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819162963	CF	On-Demand	Mild	ADRB2	54	42
C=C(C)COCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819162963	CF	On-Demand	Mild	ADRB1	66	48
C=C(C)COCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819162963	CF	On-Demand	Mild	ADRB3	76	48
O=C(Cc1ccccc1Cl)N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819163053	FF	On-Demand	Anodyne	KCNQ2	18	42
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819163064	EF	On-Demand	Anodyne	SFRP1	51	33
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819163064	EF	On-Demand	Anodyne	WNT3	53	33
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819163065	EF	On-Demand	Anodyne	SFRP1	51	33
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819163065	EF	On-Demand	Anodyne	WNT3	53	33
Cn1nccc1[C@H](NCc1ccc(N2CCOCC2)cc1)C(=O)O	ZINC000819163066	ED	On-Demand	Clean	STAT6	61	37
Cn1nccc1[C@@H](NCc1ccc(N2CCOCC2)cc1)C(=O)O	ZINC000819163067	ED	On-Demand	Clean	STAT6	61	37
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819163072	CD	On-Demand	Anodyne	ADRB1	39	46
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819163072	CD	On-Demand	Anodyne	ADRB3	61	50
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819163072	CD	On-Demand	Anodyne	IGF1R	29	40
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819163072	CD	On-Demand	Anodyne	EPHX2	21	55
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819163072	CD	On-Demand	Anodyne	CYP3A4	51	40
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819163073	CD	On-Demand	Anodyne	ADRB1	39	46
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819163073	CD	On-Demand	Anodyne	ADRB3	61	50
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819163073	CD	On-Demand	Anodyne	IGF1R	29	40
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819163073	CD	On-Demand	Anodyne	EPHX2	21	55
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819163073	CD	On-Demand	Anodyne	CYP3A4	51	40
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819163074	CD	On-Demand	Anodyne	ADRB1	39	46
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819163074	CD	On-Demand	Anodyne	ADRB3	61	50
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819163074	CD	On-Demand	Anodyne	IGF1R	29	40
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819163074	CD	On-Demand	Anodyne	EPHX2	21	55
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819163074	CD	On-Demand	Anodyne	CYP3A4	51	40
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819163075	CD	On-Demand	Anodyne	ADRB1	39	46
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819163075	CD	On-Demand	Anodyne	ADRB3	61	50
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819163075	CD	On-Demand	Anodyne	IGF1R	29	40
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819163075	CD	On-Demand	Anodyne	EPHX2	21	55
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819163075	CD	On-Demand	Anodyne	CYP3A4	51	40
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(N2CCCCC2)cc1	ZINC000819163100	GJ	On-Demand	Clean	ACE	32	46
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(N2CCCCC2)cc1	ZINC000819163100	GJ	On-Demand	Clean	MME	55	46
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(N2CCCCC2)cc1	ZINC000819163100	GJ	On-Demand	Clean	FCER2	22	41
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(N2CCCCC2)cc1	ZINC000819163100	GJ	On-Demand	Clean	TRY2_BOVIN	75	41
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(N2CCCCC2)cc1	ZINC000819163100	GJ	On-Demand	Clean	CPA1	30	43
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(N2CCCCC2)cc1	ZINC000819163100	GJ	On-Demand	Clean	ITGA4	57	44
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(N2CCCCC2)cc1	ZINC000819163100	GJ	On-Demand	Clean	ECE1	32	45
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(N2CCCCC2)cc1	ZINC000819163100	GJ	On-Demand	Clean	ACE2	67	46
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(N2CCCCC2)cc1	ZINC000819163100	GJ	On-Demand	Clean	DPP7	45	46
O=C(O)[C@@H]1CC[C@H](NCc2ccc(N3CCOCC3)cc2)C1	ZINC000819163104	DD	On-Demand	Clean	STAT6	55	37
C#CCNC(=O)CCNC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819163135	GE	On-Demand	Mild	DRD4	22	48
C#CCNC(=O)CCNC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819163135	GE	On-Demand	Mild	SIGMAR1	25	53
C#CCNC(=O)CCNC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819163135	GE	On-Demand	Mild	SSTR5	55	35
CCOCc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)ccc1OC	ZINC000819163138	GI	On-Demand	Clean	ACE	21	48
CCOCc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)ccc1OC	ZINC000819163138	GI	On-Demand	Clean	TSHR	41	31
CCOCc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)ccc1OC	ZINC000819163138	GI	On-Demand	Clean	PPARG	18	45
CCOCc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)ccc1OC	ZINC000819163138	GI	On-Demand	Clean	PPARA	23	45
CCOCc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)ccc1OC	ZINC000819163138	GI	On-Demand	Clean	MME	48	48
CCOCc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)ccc1OC	ZINC000819163138	GI	On-Demand	Clean	CPA1	24	42
CCOCc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)ccc1OC	ZINC000819163138	GI	On-Demand	Clean	PPARD	15	45
CCOCc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)ccc1OC	ZINC000819163138	GI	On-Demand	Clean	ACE2	69	48
CCOCc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)ccc1OC	ZINC000819163138	GI	On-Demand	Clean	PIN1	25	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163143	GF	On-Demand	Anodyne	CHRM2	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163143	GF	On-Demand	Anodyne	DRD2	20	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163143	GF	On-Demand	Anodyne	DRD4	43	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163143	GF	On-Demand	Anodyne	ACHE	57	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163143	GF	On-Demand	Anodyne	DRD3	16	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163143	GF	On-Demand	Anodyne	SLC6A3	23	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163143	GF	On-Demand	Anodyne	HTR4	44	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163143	GF	On-Demand	Anodyne	SIGMAR1	54	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163143	GF	On-Demand	Anodyne	BCHE	15	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163143	GF	On-Demand	Anodyne	MCHR1	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163143	GF	On-Demand	Anodyne	CACNA1G	36	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163143	GF	On-Demand	Anodyne	CACNA1I	66	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163145	GF	On-Demand	Anodyne	CHRM2	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163145	GF	On-Demand	Anodyne	DRD2	20	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163145	GF	On-Demand	Anodyne	DRD4	43	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163145	GF	On-Demand	Anodyne	ACHE	57	49
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163145	GF	On-Demand	Anodyne	DRD3	16	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163145	GF	On-Demand	Anodyne	SLC6A3	23	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163145	GF	On-Demand	Anodyne	HTR4	44	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163145	GF	On-Demand	Anodyne	SIGMAR1	54	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163145	GF	On-Demand	Anodyne	BCHE	15	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163145	GF	On-Demand	Anodyne	MCHR1	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163145	GF	On-Demand	Anodyne	CACNA1G	36	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1CCN(Cc3ccccc3)CC1)C2	ZINC000819163145	GF	On-Demand	Anodyne	CACNA1I	66	40
COCCCNC(=O)NNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819163157	EC	On-Demand	Reactive	DRD4	41	31
COCCCNC(=O)NNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819163157	EC	On-Demand	Reactive	MTNR1A	45	42
COCCCNC(=O)NNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819163157	EC	On-Demand	Reactive	MTNR1B	43	42
COCCCNC(=O)NNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819163161	EC	On-Demand	Reactive	DRD4	41	31
COCCCNC(=O)NNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819163161	EC	On-Demand	Reactive	MTNR1A	45	42
COCCCNC(=O)NNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819163161	EC	On-Demand	Reactive	MTNR1B	43	42
CC[C@@H](NCCS(C)(=O)=O)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819163162	ED	On-Demand	Anodyne	DRD4	21	42
CC[C@@H](NCCS(C)(=O)=O)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819163165	ED	On-Demand	Anodyne	DRD4	21	42
O=C(/C=C/[C@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163166	EF	On-Demand	Anodyne	DRD2	19	46
O=C(/C=C/[C@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163166	EF	On-Demand	Anodyne	DRD4	46	46
O=C(/C=C/[C@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163166	EF	On-Demand	Anodyne	ACHE	54	48
O=C(/C=C/[C@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163166	EF	On-Demand	Anodyne	DRD3	15	41
O=C(/C=C/[C@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163166	EF	On-Demand	Anodyne	HTR4	51	48
O=C(/C=C/[C@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163166	EF	On-Demand	Anodyne	SIGMAR1	63	45
O=C(/C=C/[C@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163166	EF	On-Demand	Anodyne	BCHE	17	46
O=C(/C=C/[C@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163166	EF	On-Demand	Anodyne	MCHR1	18	40
O=C(/C=C/[C@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163166	EF	On-Demand	Anodyne	CACNA1I	64	42
O=C(/C=C\[C@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163167	EF	On-Demand	Anodyne	DRD2	19	46
O=C(/C=C\[C@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163167	EF	On-Demand	Anodyne	DRD4	46	46
O=C(/C=C\[C@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163167	EF	On-Demand	Anodyne	ACHE	54	48
O=C(/C=C\[C@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163167	EF	On-Demand	Anodyne	DRD3	15	41
O=C(/C=C\[C@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163167	EF	On-Demand	Anodyne	HTR4	51	48
O=C(/C=C\[C@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163167	EF	On-Demand	Anodyne	SIGMAR1	63	45
O=C(/C=C\[C@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163167	EF	On-Demand	Anodyne	BCHE	17	46
O=C(/C=C\[C@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163167	EF	On-Demand	Anodyne	MCHR1	18	40
O=C(/C=C\[C@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163167	EF	On-Demand	Anodyne	CACNA1I	64	42
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163169	EF	On-Demand	Anodyne	DRD2	19	46
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163169	EF	On-Demand	Anodyne	DRD4	46	46
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163169	EF	On-Demand	Anodyne	ACHE	54	48
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163169	EF	On-Demand	Anodyne	DRD3	15	41
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163169	EF	On-Demand	Anodyne	HTR4	51	48
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163169	EF	On-Demand	Anodyne	SIGMAR1	63	45
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163169	EF	On-Demand	Anodyne	BCHE	17	46
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163169	EF	On-Demand	Anodyne	MCHR1	18	40
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163169	EF	On-Demand	Anodyne	CACNA1I	64	42
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163170	EF	On-Demand	Anodyne	DRD2	19	46
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163170	EF	On-Demand	Anodyne	DRD4	46	46
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163170	EF	On-Demand	Anodyne	ACHE	54	48
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163170	EF	On-Demand	Anodyne	DRD3	15	41
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163170	EF	On-Demand	Anodyne	HTR4	51	48
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163170	EF	On-Demand	Anodyne	SIGMAR1	63	45
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163170	EF	On-Demand	Anodyne	BCHE	17	46
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163170	EF	On-Demand	Anodyne	MCHR1	18	40
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2)CC1	ZINC000819163170	EF	On-Demand	Anodyne	CACNA1I	64	42
CON(C)C(=O)CCNC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819163175	GE	On-Demand	Anodyne	DRD4	28	48
CON(C)C(=O)CCNC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819163175	GE	On-Demand	Anodyne	SIGMAR1	29	50
CON(C)C(=O)CCNC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819163175	GE	On-Demand	Anodyne	SSTR5	66	36
CON(C)C(=O)CCNC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819163175	GE	On-Demand	Anodyne	UTS2R	17	47
CON(C)C(=O)CCNC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819163175	GE	On-Demand	Anodyne	MCHR1	40	42
COc1cccc([S@@](=O)CC(=O)NCCS(=O)(=O)Cc2ccccc2)c1	ZINC000819163195	GD	On-Demand	Anodyne	MTNR1A	52	43
COc1cccc([S@@](=O)CC(=O)NCCS(=O)(=O)Cc2ccccc2)c1	ZINC000819163195	GD	On-Demand	Anodyne	MTNR1B	52	43
O[C@@H](CNCCCOc1ccc2ccccc2c1)c1cccnc1	ZINC000819163213	DG	On-Demand	Anodyne	ADRB2	48	63
O[C@@H](CNCCCOc1ccc2ccccc2c1)c1cccnc1	ZINC000819163213	DG	On-Demand	Anodyne	ADRB1	53	63
O[C@@H](CNCCCOc1ccc2ccccc2c1)c1cccnc1	ZINC000819163213	DG	On-Demand	Anodyne	ADRB3	126	63
O[C@@H](CNCCCOc1ccc2ccccc2c1)c1cccnc1	ZINC000819163213	DG	On-Demand	Anodyne	CYP51A1	15	43
O[C@H](CNCCCOc1ccc2ccccc2c1)c1cccnc1	ZINC000819163215	DG	On-Demand	Anodyne	ADRB2	48	63
O[C@H](CNCCCOc1ccc2ccccc2c1)c1cccnc1	ZINC000819163215	DG	On-Demand	Anodyne	ADRB1	53	63
O[C@H](CNCCCOc1ccc2ccccc2c1)c1cccnc1	ZINC000819163215	DG	On-Demand	Anodyne	ADRB3	126	63
O[C@H](CNCCCOc1ccc2ccccc2c1)c1cccnc1	ZINC000819163215	DG	On-Demand	Anodyne	CYP51A1	15	43
COCCOC(=O)Nc1cccc(NC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819163216	FI	On-Demand	Anodyne	KCNK3	119	45
COCCOC(=O)Nc1cccc(NC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819163216	FI	On-Demand	Anodyne	KCNK9	89	45
O[C@H](CNCCCOc1ccc2ccccc2c1)C1CC1	ZINC000819163226	CF	On-Demand	Anodyne	ADRB2	15	44
O[C@H](CNCCCOc1ccc2ccccc2c1)C1CC1	ZINC000819163226	CF	On-Demand	Anodyne	DRD4	18	40
O[C@@H](CNCCCOc1ccc2ccccc2c1)C1CC1	ZINC000819163227	CF	On-Demand	Anodyne	ADRB2	15	44
O[C@@H](CNCCCOc1ccc2ccccc2c1)C1CC1	ZINC000819163227	CF	On-Demand	Anodyne	DRD4	18	40
O[C@@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1	ZINC000819163234	GH	On-Demand	Anodyne	DRD4	38	49
O[C@@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1	ZINC000819163234	GH	On-Demand	Anodyne	ACHE	30	42
O[C@@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1	ZINC000819163234	GH	On-Demand	Anodyne	SLC6A3	29	52
O[C@@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1	ZINC000819163234	GH	On-Demand	Anodyne	LTA4H	18	42
O[C@@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1	ZINC000819163234	GH	On-Demand	Anodyne	SIGMAR1	49	58
O[C@@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1	ZINC000819163234	GH	On-Demand	Anodyne	SLC18A3	18	48
O[C@@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1	ZINC000819163234	GH	On-Demand	Anodyne	CXCR3	18	40
O[C@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1	ZINC000819163235	GH	On-Demand	Anodyne	DRD4	38	49
O[C@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1	ZINC000819163235	GH	On-Demand	Anodyne	ACHE	30	42
O[C@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1	ZINC000819163235	GH	On-Demand	Anodyne	SLC6A3	29	52
O[C@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1	ZINC000819163235	GH	On-Demand	Anodyne	LTA4H	18	42
O[C@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1	ZINC000819163235	GH	On-Demand	Anodyne	SIGMAR1	49	58
O[C@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1	ZINC000819163235	GH	On-Demand	Anodyne	SLC18A3	18	48
O[C@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1ccccc1	ZINC000819163235	GH	On-Demand	Anodyne	CXCR3	18	40
COCCCNC(=O)NNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819163237	DC	On-Demand	Reactive	HRH2	34	42
COCCCNC(=O)NNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819163237	DC	On-Demand	Reactive	MTNR1A	40	40
COCCCNC(=O)NNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819163237	DC	On-Demand	Reactive	MTNR1B	41	40
COCCCNC(=O)NNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819163237	DC	On-Demand	Reactive	KCNK3	42	36
COCCCNC(=O)NNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819163237	DC	On-Demand	Reactive	KCNK9	44	36
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccn3ccnc3c2)CC1	ZINC000819163239	FE	On-Demand	Anodyne	GPR119	48	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccn3ccnc3c2)CC1	ZINC000819163240	FE	On-Demand	Anodyne	GPR119	48	45
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC000819163263	DE	On-Demand	Anodyne	CCR8	69	42
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC000819163266	DE	On-Demand	Anodyne	CCR8	69	42
O[C@H](CN[C@@H]1CCC[C@@H]2OCC[C@@H]21)c1cccc(Cl)c1	ZINC000819163285	CF	On-Demand	Anodyne	ADRB3	39	44
O[C@@H](CNCCc1cscn1)c1ccc(Cl)cc1	ZINC000819163286	CF	On-Demand	Anodyne	ADRB2	15	42
O[C@H](CN[C@@H]1CCC[C@@H]2OCC[C@H]21)c1cccc(Cl)c1	ZINC000819163287	CF	On-Demand	Anodyne	ADRB3	39	44
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819163288	DE	On-Demand	Anodyne	ADRB3	41	37
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819163288	DE	On-Demand	Anodyne	SFRP1	75	35
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819163288	DE	On-Demand	Anodyne	WNT3	70	35
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819163288	DE	On-Demand	Anodyne	Q8WSF8_APLCA	24	40
O[C@H](CN[C@@H]1CCC[C@H]2OCC[C@H]12)c1cccc(Cl)c1	ZINC000819163289	CF	On-Demand	Anodyne	ADRB3	39	44
O[C@H](CN[C@@H]1CCC[C@H]2OCC[C@@H]12)c1cccc(Cl)c1	ZINC000819163290	CF	On-Demand	Anodyne	ADRB3	39	44
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819163291	DE	On-Demand	Anodyne	ADRB3	41	37
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819163291	DE	On-Demand	Anodyne	SFRP1	75	35
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819163291	DE	On-Demand	Anodyne	WNT3	70	35
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819163291	DE	On-Demand	Anodyne	Q8WSF8_APLCA	24	40
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819163292	DE	On-Demand	Anodyne	ADRB3	41	37
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819163292	DE	On-Demand	Anodyne	SFRP1	75	35
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819163292	DE	On-Demand	Anodyne	WNT3	70	35
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819163292	DE	On-Demand	Anodyne	Q8WSF8_APLCA	24	40
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819163294	DE	On-Demand	Anodyne	ADRB3	41	37
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819163294	DE	On-Demand	Anodyne	SFRP1	75	35
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819163294	DE	On-Demand	Anodyne	WNT3	70	35
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819163294	DE	On-Demand	Anodyne	Q8WSF8_APLCA	24	40
O=C(O)CCCCCCNCc1ccc2c(c1)OC(F)(F)O2	ZINC000819163303	DG	On-Demand	Anodyne	S1PR2	27	45
O=C(O)CCCCCCNCc1ccc2c(c1)OC(F)(F)O2	ZINC000819163303	DG	On-Demand	Anodyne	LEF	59	36
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819163316	FF	On-Demand	Anodyne	ADRB3	24	40
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819163318	FF	On-Demand	Anodyne	ADRB3	24	40
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819163320	FF	On-Demand	Anodyne	ADRB3	24	40
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819163322	FF	On-Demand	Anodyne	ADRB3	24	40
O=C(CCc1cccc(OC(F)F)c1)NCCS(=O)(=O)Cc1ccccc1	ZINC000819163338	GF	On-Demand	Anodyne	PLA2G4A	25	40
O=C(CCc1cccc(OC(F)F)c1)NCCS(=O)(=O)Cc1ccccc1	ZINC000819163338	GF	On-Demand	Anodyne	MTNR1A	15	41
O=C(CCc1cccc(OC(F)F)c1)NCCS(=O)(=O)Cc1ccccc1	ZINC000819163338	GF	On-Demand	Anodyne	CRTM	53	45
Cc1nn(-c2ccc(F)cc2)c(Cl)c1CN[C@@H](C)[C@H](C(=O)O)C(C)C	ZINC000819163385	FH	On-Demand	Anodyne	P2RX7	29	45
Cc1nn(-c2ccc(F)cc2)c(Cl)c1CN[C@@H](C)[C@@H](C(=O)O)C(C)C	ZINC000819163388	FH	On-Demand	Anodyne	P2RX7	29	45
Cc1nn(-c2ccc(F)cc2)c(Cl)c1CN[C@H](C)[C@H](C(=O)O)C(C)C	ZINC000819163391	FH	On-Demand	Anodyne	P2RX7	29	45
Cc1nn(-c2ccc(F)cc2)c(Cl)c1CN[C@H](C)[C@@H](C(=O)O)C(C)C	ZINC000819163393	FH	On-Demand	Anodyne	P2RX7	29	45
COCCOC(=O)Nc1cccc(NC(=O)c2cc(Br)oc2C)c1	ZINC000819163445	GH	On-Demand	Anodyne	KCNK3	118	43
COCCOC(=O)Nc1cccc(NC(=O)c2cc(Br)oc2C)c1	ZINC000819163445	GH	On-Demand	Anodyne	KCNK9	88	43
CCOCc1cc(CN[C@H](C)[C@H](C(=O)O)C(C)C)ccc1OC	ZINC000819163508	DG	On-Demand	Clean	PPARA	15	40
COCCOC(=O)Nc1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819163510	EF	On-Demand	Anodyne	KCNK3	71	33
COCCOC(=O)Nc1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819163510	EF	On-Demand	Anodyne	KCNK9	48	33
CCOCc1cc(CN[C@H](C)[C@@H](C(=O)O)C(C)C)ccc1OC	ZINC000819163511	DG	On-Demand	Clean	PPARA	15	40
CCOCc1cc(CN[C@@H](C)[C@@H](C(=O)O)C(C)C)ccc1OC	ZINC000819163512	DG	On-Demand	Clean	PPARA	15	40
CCOCc1cc(CN[C@@H](C)[C@H](C(=O)O)C(C)C)ccc1OC	ZINC000819163513	DG	On-Demand	Clean	PPARA	15	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2cscn2)CC1	ZINC000819163519	FE	On-Demand	Anodyne	GPR119	45	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2cscn2)CC1	ZINC000819163520	FE	On-Demand	Anodyne	GPR119	45	41
O[C@H](CNCCc1cscn1)c1cccc(Br)c1	ZINC000819163521	EF	On-Demand	Anodyne	ADRB2	23	41
O[C@H](CNCCc1cscn1)c1cccc(Br)c1	ZINC000819163521	EF	On-Demand	Anodyne	ADRB1	29	41
O[C@H](CNCCc1cscn1)c1cccc(Br)c1	ZINC000819163521	EF	On-Demand	Anodyne	ADRB3	52	41
O[C@@H](CNCCc1cscn1)c1cccc(Br)c1	ZINC000819163522	EF	On-Demand	Anodyne	ADRB2	23	41
O[C@@H](CNCCc1cscn1)c1cccc(Br)c1	ZINC000819163522	EF	On-Demand	Anodyne	ADRB1	29	41
O[C@@H](CNCCc1cscn1)c1cccc(Br)c1	ZINC000819163522	EF	On-Demand	Anodyne	ADRB3	52	41
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819163527	EF	On-Demand	Anodyne	ADRB1	15	45
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819163527	EF	On-Demand	Anodyne	ADRB3	26	45
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819163527	EF	On-Demand	Anodyne	C3AR1	26	40
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819163528	EF	On-Demand	Anodyne	ADRB1	15	45
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819163528	EF	On-Demand	Anodyne	ADRB3	26	45
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819163528	EF	On-Demand	Anodyne	C3AR1	26	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cscn2)cc1	ZINC000819163531	ED	On-Demand	Anodyne	ADRB2	30	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cscn2)cc1	ZINC000819163531	ED	On-Demand	Anodyne	ADRB3	82	38
COCCOC(=O)Nc1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819163532	EF	On-Demand	Anodyne	KCNK3	71	33
COCCOC(=O)Nc1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819163532	EF	On-Demand	Anodyne	KCNK9	48	33
COCCOC(=O)Nc1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819163533	EF	On-Demand	Anodyne	KCNK3	71	33
COCCOC(=O)Nc1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819163533	EF	On-Demand	Anodyne	KCNK9	48	33
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cscn2)cc1	ZINC000819163534	ED	On-Demand	Anodyne	ADRB2	30	41
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cscn2)cc1	ZINC000819163534	ED	On-Demand	Anodyne	ADRB3	82	38
COCCOC(=O)Nc1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819163535	EF	On-Demand	Anodyne	KCNK3	71	33
COCCOC(=O)Nc1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819163535	EF	On-Demand	Anodyne	KCNK9	48	33
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819163544	GF	On-Demand	Anodyne	EPHX2	57	51
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819163544	GF	On-Demand	Anodyne	SFRP1	53	33
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819163544	GF	On-Demand	Anodyne	WNT3	53	33
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819163548	GF	On-Demand	Anodyne	EPHX2	57	51
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819163548	GF	On-Demand	Anodyne	SFRP1	53	33
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819163548	GF	On-Demand	Anodyne	WNT3	53	33
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819163552	GF	On-Demand	Anodyne	EPHX2	57	51
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819163552	GF	On-Demand	Anodyne	SFRP1	53	33
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819163552	GF	On-Demand	Anodyne	WNT3	53	33
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819163556	GF	On-Demand	Anodyne	EPHX2	57	51
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819163556	GF	On-Demand	Anodyne	SFRP1	53	33
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819163556	GF	On-Demand	Anodyne	WNT3	53	33
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819163559	FG	On-Demand	Anodyne	CNR1	16	50
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819163563	FG	On-Demand	Anodyne	CNR1	16	50
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819163567	FG	On-Demand	Anodyne	CNR1	16	50
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819163571	FG	On-Demand	Anodyne	CNR1	16	50
CON(C)C(=O)CCNCCCOc1ccc2ccccc2c1	ZINC000819163575	DF	On-Demand	Anodyne	DRD4	19	44
CON(C)C(=O)CCNCCCOc1ccc2ccccc2c1	ZINC000819163575	DF	On-Demand	Anodyne	LTA4H	19	46
CON(C)C(=O)CCNCCCOc1ccc2ccccc2c1	ZINC000819163575	DF	On-Demand	Anodyne	MTNR1A	42	40
CON(C)C(=O)CCNCCCOc1ccc2ccccc2c1	ZINC000819163575	DF	On-Demand	Anodyne	MTNR1B	27	40
O[C@H](CNCCc1cscn1)c1cccc(F)c1	ZINC000819163587	CE	On-Demand	Anodyne	ADRB1	29	43
O[C@H](CNCCc1cscn1)c1cccc(F)c1	ZINC000819163587	CE	On-Demand	Anodyne	ADRB3	61	43
O[C@@H](CNCCc1cscn1)c1cccc(F)c1	ZINC000819163591	CE	On-Demand	Anodyne	ADRB1	29	43
O[C@@H](CNCCc1cscn1)c1cccc(F)c1	ZINC000819163591	CE	On-Demand	Anodyne	ADRB3	61	43
CCC(=O)c1cc(Cl)ccc1OCC(=O)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000819163600	GJ	On-Demand	Bother	KCNMA1	31	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2[C@@H]3[C@H]4CC[C@@H](C4)[C@@H]23)CC1	ZINC000819163612	FF	On-Demand	Anodyne	GPR119	27	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2[C@H]3[C@H]4CC[C@@H](C4)[C@H]32)CC1	ZINC000819163613	FF	On-Demand	Anodyne	GPR119	27	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2[C@H]3[C@H]4CC[C@@H](C4)[C@H]23)CC1	ZINC000819163614	FF	On-Demand	Anodyne	GPR119	27	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2[C@H]3[C@H]4CC[C@@H](C4)[C@H]32)CC1	ZINC000819163615	FF	On-Demand	Anodyne	GPR119	27	42
O=C(O)CCCCCCCNCc1ccc2c(c1)OC(F)(F)O2	ZINC000819163627	EH	On-Demand	Anodyne	S1PR2	27	45
O=C(O)CCCCCCCNCc1ccc2c(c1)OC(F)(F)O2	ZINC000819163627	EH	On-Demand	Anodyne	LEF	59	36
COCCOC(=O)Nc1cccc(NC(=O)c2cc3c(cn2)OCCO3)c1	ZINC000819163640	FE	On-Demand	Anodyne	KCNK3	82	36
COCCOC(=O)Nc1cccc(NC(=O)c2cc3c(cn2)OCCO3)c1	ZINC000819163640	FE	On-Demand	Anodyne	KCNK9	58	35
O[C@H](CNCCc1cscn1)c1ccccc1	ZINC000819163665	BE	On-Demand	Anodyne	ADRB2	35	51
O[C@H](CNCCc1cscn1)c1ccccc1	ZINC000819163665	BE	On-Demand	Anodyne	ADRB1	50	43
O[C@H](CNCCc1cscn1)c1ccccc1	ZINC000819163665	BE	On-Demand	Anodyne	ADRB3	88	46
O[C@@H](CNCCc1cscn1)c1ccccc1	ZINC000819163666	BE	On-Demand	Anodyne	ADRB2	35	51
O[C@@H](CNCCc1cscn1)c1ccccc1	ZINC000819163666	BE	On-Demand	Anodyne	ADRB1	50	43
O[C@@H](CNCCc1cscn1)c1ccccc1	ZINC000819163666	BE	On-Demand	Anodyne	ADRB3	88	46
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2C)C1	ZINC000819163669	CD	On-Demand	Anodyne	CCR8	84	42
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2C)C1	ZINC000819163670	CD	On-Demand	Anodyne	CCR8	84	42
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2C)C1	ZINC000819163671	CD	On-Demand	Anodyne	CCR8	84	42
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2C)C1	ZINC000819163672	CD	On-Demand	Anodyne	CCR8	84	42
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819163673	CD	On-Demand	Anodyne	EPHX2	15	40
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819163673	CD	On-Demand	Anodyne	CCR8	48	36
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819163674	CD	On-Demand	Anodyne	EPHX2	15	40
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819163674	CD	On-Demand	Anodyne	CCR8	48	36
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819163675	CD	On-Demand	Anodyne	EPHX2	15	40
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819163675	CD	On-Demand	Anodyne	CCR8	48	36
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819163676	CD	On-Demand	Anodyne	EPHX2	15	40
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819163676	CD	On-Demand	Anodyne	CCR8	48	36
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC[C@H](O)c1cc(F)ccc1F	ZINC000819163682	FH	On-Demand	Anodyne	SIGMAR1	25	43
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC[C@@H](O)c1cc(F)ccc1F	ZINC000819163683	FH	On-Demand	Anodyne	SIGMAR1	25	43
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC[C@H](O)c1cc(F)ccc1F	ZINC000819163684	FH	On-Demand	Anodyne	SIGMAR1	25	43
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC[C@@H](O)c1cc(F)ccc1F	ZINC000819163685	FH	On-Demand	Anodyne	SIGMAR1	25	43
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819163698	EE	On-Demand	Anodyne	EPHX2	56	57
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819163700	EE	On-Demand	Anodyne	EPHX2	56	57
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819163701	EE	On-Demand	Anodyne	EPHX2	56	57
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819163702	EE	On-Demand	Anodyne	EPHX2	56	57
C[C@@H]1CCCC[C@@H]1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819163747	FH	On-Demand	Mild	PAPA1_CARPA	44	52
C[C@@H]1CCCC[C@@H]1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819163749	FH	On-Demand	Mild	PAPA1_CARPA	44	52
C[C@@H]1CCCC[C@H]1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819163751	FH	On-Demand	Mild	PAPA1_CARPA	44	52
C[C@@H]1CCCC[C@H]1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819163752	FH	On-Demand	Mild	PAPA1_CARPA	44	52
CCc1nnc(O)c(CNC[C@H](O)c2cccnc2)c1CC	ZINC000819163754	DD	On-Demand	Anodyne	ADRB2	16	40
CCc1nnc(O)c(CNC[C@H](O)c2cccnc2)c1CC	ZINC000819163754	DD	On-Demand	Anodyne	ADRB1	20	41
CCc1nnc(O)c(CNC[C@H](O)c2cccnc2)c1CC	ZINC000819163754	DD	On-Demand	Anodyne	ADRB3	73	41
CCc1nnc(O)c(CNC[C@@H](O)c2cccnc2)c1CC	ZINC000819163757	DD	On-Demand	Anodyne	ADRB2	16	40
CCc1nnc(O)c(CNC[C@@H](O)c2cccnc2)c1CC	ZINC000819163757	DD	On-Demand	Anodyne	ADRB1	20	41
CCc1nnc(O)c(CNC[C@@H](O)c2cccnc2)c1CC	ZINC000819163757	DD	On-Demand	Anodyne	ADRB3	73	41
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819163765	CD	On-Demand	Mild	ADRB3	16	48
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819163765	CD	On-Demand	Mild	MLNR	21	43
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819163765	CD	On-Demand	Mild	EPHX2	15	43
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819163769	CD	On-Demand	Mild	ADRB3	16	48
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819163769	CD	On-Demand	Mild	MLNR	21	43
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819163769	CD	On-Demand	Mild	EPHX2	15	43
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819163771	CD	On-Demand	Mild	ADRB3	16	48
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819163771	CD	On-Demand	Mild	MLNR	21	43
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819163771	CD	On-Demand	Mild	EPHX2	15	43
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819163772	CD	On-Demand	Mild	ADRB3	16	48
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819163772	CD	On-Demand	Mild	MLNR	21	43
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819163772	CD	On-Demand	Mild	EPHX2	15	43
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819163803	EE	On-Demand	Anodyne	EPHX2	15	46
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819163805	EE	On-Demand	Anodyne	EPHX2	15	46
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819163808	EE	On-Demand	Anodyne	EPHX2	15	46
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819163811	EE	On-Demand	Anodyne	EPHX2	15	46
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819163814	EE	On-Demand	Anodyne	EPHX2	15	52
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819163817	EE	On-Demand	Anodyne	EPHX2	15	52
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819163820	EE	On-Demand	Anodyne	EPHX2	15	52
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819163823	EE	On-Demand	Anodyne	EPHX2	15	52
O[C@H](CNCCc1cscn1)c1cccc(Cl)c1	ZINC000819163853	CF	On-Demand	Anodyne	ADRB2	46	39
O[C@H](CNCCc1cscn1)c1cccc(Cl)c1	ZINC000819163853	CF	On-Demand	Anodyne	ADRB1	60	52
O[C@H](CNCCc1cscn1)c1cccc(Cl)c1	ZINC000819163853	CF	On-Demand	Anodyne	ADRB3	87	52
O[C@@H](CNCCc1cscn1)c1cccc(Cl)c1	ZINC000819163856	CF	On-Demand	Anodyne	ADRB2	46	39
O[C@@H](CNCCc1cscn1)c1cccc(Cl)c1	ZINC000819163856	CF	On-Demand	Anodyne	ADRB1	60	52
O[C@@H](CNCCc1cscn1)c1cccc(Cl)c1	ZINC000819163856	CF	On-Demand	Anodyne	ADRB3	87	52
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819163882	EF	On-Demand	Anodyne	EPHX2	24	48
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819163885	EF	On-Demand	Anodyne	EPHX2	24	48
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819163888	EF	On-Demand	Anodyne	EPHX2	24	48
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819163890	EF	On-Demand	Anodyne	EPHX2	24	48
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819163920	DD	On-Demand	Bother	CACNA1D	46	33
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819163921	DD	On-Demand	Bother	CACNA1D	46	33
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819163923	DD	On-Demand	Bother	CACNA1D	46	33
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819163925	DD	On-Demand	Bother	CACNA1D	46	33
O=C(/C=C/[C@@H]1CCCO1)N[C@H](c1ccccc1)c1ccc(Br)cc1	ZINC000819163943	GI	On-Demand	Anodyne	PRCP	15	40
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](c1ccccc1)c1ccc(Br)cc1	ZINC000819163945	GI	On-Demand	Anodyne	PRCP	15	40
O=C(/C=C\[C@@H]1CCCO1)N[C@H](c1ccccc1)c1ccc(Br)cc1	ZINC000819163947	GI	On-Demand	Anodyne	PRCP	15	40
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](c1ccccc1)c1ccc(Br)cc1	ZINC000819163949	GI	On-Demand	Anodyne	PRCP	15	40
Cc1ccc2c(c1)[C@H](NC[C@H](O)c1cccnc1)CO2	ZINC000819164029	CE	On-Demand	Anodyne	ADRB3	46	41
Cc1ccc2c(c1)[C@@H](NC[C@H](O)c1cccnc1)CO2	ZINC000819164030	CE	On-Demand	Anodyne	ADRB3	46	41
Cc1ccc2c(c1)[C@H](NC[C@@H](O)c1cccnc1)CO2	ZINC000819164031	CE	On-Demand	Anodyne	ADRB3	46	41
Cc1ccc2c(c1)[C@@H](NC[C@@H](O)c1cccnc1)CO2	ZINC000819164032	CE	On-Demand	Anodyne	ADRB3	46	41
C[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC(C)(C)O1	ZINC000819164075	FF	On-Demand	Mild	PAPA1_CARPA	31	40
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164077	FG	On-Demand	Anodyne	ADRB3	22	40
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164077	FG	On-Demand	Anodyne	CACNA1B	41	38
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164077	FG	On-Demand	Anodyne	CCR2	65	41
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164077	FG	On-Demand	Anodyne	EPHX2	19	43
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164077	FG	On-Demand	Anodyne	LIPG	40	30
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164077	FG	On-Demand	Anodyne	SFRP1	108	36
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164077	FG	On-Demand	Anodyne	WNT3	80	36
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164078	FG	On-Demand	Anodyne	ADRB3	22	40
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164078	FG	On-Demand	Anodyne	CACNA1B	41	38
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164078	FG	On-Demand	Anodyne	CCR2	65	41
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164078	FG	On-Demand	Anodyne	EPHX2	19	43
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164078	FG	On-Demand	Anodyne	LIPG	40	30
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164078	FG	On-Demand	Anodyne	SFRP1	108	36
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164078	FG	On-Demand	Anodyne	WNT3	80	36
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164079	FG	On-Demand	Anodyne	ADRB3	22	40
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164079	FG	On-Demand	Anodyne	CACNA1B	41	38
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164079	FG	On-Demand	Anodyne	CCR2	65	41
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164079	FG	On-Demand	Anodyne	EPHX2	19	43
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164079	FG	On-Demand	Anodyne	LIPG	40	30
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164079	FG	On-Demand	Anodyne	SFRP1	108	36
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164079	FG	On-Demand	Anodyne	WNT3	80	36
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164081	FG	On-Demand	Anodyne	ADRB3	22	40
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164081	FG	On-Demand	Anodyne	CACNA1B	41	38
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164081	FG	On-Demand	Anodyne	CCR2	65	41
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164081	FG	On-Demand	Anodyne	EPHX2	19	43
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164081	FG	On-Demand	Anodyne	LIPG	40	30
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164081	FG	On-Demand	Anodyne	SFRP1	108	36
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164081	FG	On-Demand	Anodyne	WNT3	80	36
COc1ccc(OC)c([C@H](O)CNCCc2cscn2)c1	ZINC000819164101	DE	On-Demand	Anodyne	ADRB2	23	48
Cc1nc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)sc1C	ZINC000819164103	FH	On-Demand	Anodyne	ADRB2	18	40
Cc1nc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)sc1C	ZINC000819164103	FH	On-Demand	Anodyne	ADRB3	20	43
Cc1nc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)sc1C	ZINC000819164105	FH	On-Demand	Anodyne	ADRB2	18	40
Cc1nc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)sc1C	ZINC000819164105	FH	On-Demand	Anodyne	ADRB3	20	43
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819164116	DE	On-Demand	Anodyne	ADRB3	24	40
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819164116	DE	On-Demand	Anodyne	EPHX2	17	47
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819164117	DE	On-Demand	Anodyne	ADRB3	24	40
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819164117	DE	On-Demand	Anodyne	EPHX2	17	47
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819164118	DE	On-Demand	Anodyne	ADRB3	24	40
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819164118	DE	On-Demand	Anodyne	EPHX2	17	47
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819164119	DE	On-Demand	Anodyne	ADRB3	24	40
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819164119	DE	On-Demand	Anodyne	EPHX2	17	47
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cc(OC)ccc2OC)C1	ZINC000819164159	DD	On-Demand	Anodyne	MTNR1B	29	41
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cc(OC)ccc2OC)C1	ZINC000819164161	DD	On-Demand	Anodyne	MTNR1B	29	41
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cc(OC)ccc2OC)C1	ZINC000819164163	DD	On-Demand	Anodyne	MTNR1B	29	41
CCC(=O)N1CC[C@H](NC[C@H](O)c2cc(OC)ccc2OC)C1	ZINC000819164165	DD	On-Demand	Anodyne	MTNR1B	29	41
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819164189	FG	On-Demand	Anodyne	CCR8	43	38
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819164191	FG	On-Demand	Anodyne	CCR8	43	38
Cc1nn(-c2cccc(Cl)c2)c(Cl)c1CN[C@@H](C)[C@H](C(=O)O)C(C)C	ZINC000819164192	GI	On-Demand	Anodyne	P2RX7	18	45
Cc1nn(-c2cccc(Cl)c2)c(Cl)c1CN[C@@H](C)[C@@H](C(=O)O)C(C)C	ZINC000819164201	GI	On-Demand	Anodyne	P2RX7	18	45
Cc1nn(-c2cccc(Cl)c2)c(Cl)c1CN[C@H](C)[C@H](C(=O)O)C(C)C	ZINC000819164203	GI	On-Demand	Anodyne	P2RX7	18	45
Cc1nn(-c2cccc(Cl)c2)c(Cl)c1CN[C@H](C)[C@@H](C(=O)O)C(C)C	ZINC000819164206	GI	On-Demand	Anodyne	P2RX7	18	45
O[C@@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)C1CC1	ZINC000819164208	FF	On-Demand	Anodyne	SIGMAR1	26	52
O[C@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)C1CC1	ZINC000819164211	FF	On-Demand	Anodyne	SIGMAR1	26	52
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(CSC(F)F)o1	ZINC000819164213	GJ	On-Demand	Anodyne	MME	31	44
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(CSC(F)F)o1	ZINC000819164213	GJ	On-Demand	Anodyne	CPA1	26	42
O=C(O)[C@H](Cc1ccc2ccccc2c1)NCc1ccc(CSC(F)F)o1	ZINC000819164213	GJ	On-Demand	Anodyne	ACE2	46	44
Cc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)cc(C)c1OC(F)F	ZINC000819164228	GJ	On-Demand	Anodyne	ACE	21	48
Cc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)cc(C)c1OC(F)F	ZINC000819164228	GJ	On-Demand	Anodyne	MME	54	48
Cc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)cc(C)c1OC(F)F	ZINC000819164228	GJ	On-Demand	Anodyne	CPA1	34	42
Cc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)cc(C)c1OC(F)F	ZINC000819164228	GJ	On-Demand	Anodyne	ACE2	65	48
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819164231	DG	On-Demand	Anodyne	KCNK3	77	36
CO[C@@H](C)C(=O)Nc1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819164231	DG	On-Demand	Anodyne	KCNK9	67	36
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819164237	DE	On-Demand	Anodyne	SFRP1	45	33
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819164237	DE	On-Demand	Anodyne	WNT3	50	33
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819164238	DE	On-Demand	Anodyne	SFRP1	45	33
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819164238	DE	On-Demand	Anodyne	WNT3	50	33
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819164239	DE	On-Demand	Anodyne	SFRP1	45	33
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819164239	DE	On-Demand	Anodyne	WNT3	50	33
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819164241	DE	On-Demand	Anodyne	SFRP1	45	33
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819164241	DE	On-Demand	Anodyne	WNT3	50	33
CC[C@@H](NC[C@H](O)c1ccccc1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819164260	FF	On-Demand	Anodyne	DRD4	16	43
CC[C@@H](NC[C@H](O)c1ccccc1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819164263	FF	On-Demand	Anodyne	DRD4	16	43
CC[C@@H](NC[C@@H](O)c1ccccc1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819164264	FF	On-Demand	Anodyne	DRD4	16	43
CC[C@@H](NC[C@@H](O)c1ccccc1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819164265	FF	On-Demand	Anodyne	DRD4	16	43
COCCOC(=O)Nc1cccc(NC(=O)[C@H]2C[C@@H]2c2ccc(C)cc2)c1	ZINC000819164270	FH	On-Demand	Anodyne	KDM1A	21	41
COCCOC(=O)Nc1cccc(NC(=O)[C@H]2C[C@@H]2c2ccc(C)cc2)c1	ZINC000819164270	FH	On-Demand	Anodyne	KCNK3	73	36
COCCOC(=O)Nc1cccc(NC(=O)[C@H]2C[C@@H]2c2ccc(C)cc2)c1	ZINC000819164270	FH	On-Demand	Anodyne	KCNK9	60	36
COCCOC(=O)Nc1cccc(NC(=O)[C@H]2C[C@H]2c2ccc(C)cc2)c1	ZINC000819164271	FH	On-Demand	Anodyne	KDM1A	21	41
COCCOC(=O)Nc1cccc(NC(=O)[C@H]2C[C@H]2c2ccc(C)cc2)c1	ZINC000819164271	FH	On-Demand	Anodyne	KCNK3	73	36
COCCOC(=O)Nc1cccc(NC(=O)[C@H]2C[C@H]2c2ccc(C)cc2)c1	ZINC000819164271	FH	On-Demand	Anodyne	KCNK9	60	36
COCCOC(=O)Nc1cccc(NC(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)c1	ZINC000819164272	FH	On-Demand	Anodyne	KDM1A	21	41
COCCOC(=O)Nc1cccc(NC(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)c1	ZINC000819164272	FH	On-Demand	Anodyne	KCNK3	73	36
COCCOC(=O)Nc1cccc(NC(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)c1	ZINC000819164272	FH	On-Demand	Anodyne	KCNK9	60	36
COCCOC(=O)Nc1cccc(NC(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)c1	ZINC000819164273	FH	On-Demand	Anodyne	KDM1A	21	41
COCCOC(=O)Nc1cccc(NC(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)c1	ZINC000819164273	FH	On-Demand	Anodyne	KCNK3	73	36
COCCOC(=O)Nc1cccc(NC(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)c1	ZINC000819164273	FH	On-Demand	Anodyne	KCNK9	60	36
CN(C[C@H](O)CN[C@@H]1CC(C)(C)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819164276	FG	On-Demand	Anodyne	CTSD	21	41
CN(C[C@@H](O)CN[C@@H]1CC(C)(C)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819164277	FG	On-Demand	Anodyne	CTSD	21	41
CN(C[C@@H](O)CN[C@H]1CC(C)(C)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819164278	FG	On-Demand	Anodyne	CTSD	21	41
CN(C[C@H](O)CN[C@H]1CC(C)(C)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819164279	FG	On-Demand	Anodyne	CTSD	21	41
CC(C)(C)OC(=O)N1CCC[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819164318	GF	On-Demand	Clean	GPR119	23	40
CC(C)(C)OC(=O)N1CCC[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819164319	GF	On-Demand	Clean	GPR119	23	40
Cc1nc(CCNC[C@H](O)c2cccc(F)c2)sc1C	ZINC000819164393	CF	On-Demand	Anodyne	ADRB1	28	44
Cc1nc(CCNC[C@H](O)c2cccc(F)c2)sc1C	ZINC000819164393	CF	On-Demand	Anodyne	ADRB3	61	44
Cc1nc(CCNC[C@@H](O)c2cccc(F)c2)sc1C	ZINC000819164394	CF	On-Demand	Anodyne	ADRB1	28	44
Cc1nc(CCNC[C@@H](O)c2cccc(F)c2)sc1C	ZINC000819164394	CF	On-Demand	Anodyne	ADRB3	61	44
CC(C)(C)OC(=O)N1CC[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819164397	GE	On-Demand	Clean	GPR119	36	43
CC(C)(C)OC(=O)N1CC[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819164398	GE	On-Demand	Clean	GPR119	36	43
CN(C)CCOc1cccc(CN2C(=O)CN(Cc3ccccc3O)C2=O)c1	ZINC000819164402	GE	On-Demand	Clean	UPP1	48	32
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819164445	CD	On-Demand	Anodyne	SLC6A3	20	43
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819164445	CD	On-Demand	Anodyne	MLNR	38	41
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819164445	CD	On-Demand	Anodyne	EPHX2	21	45
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819164446	CD	On-Demand	Anodyne	SLC6A3	20	43
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819164446	CD	On-Demand	Anodyne	MLNR	38	41
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819164446	CD	On-Demand	Anodyne	EPHX2	21	45
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819164447	CD	On-Demand	Anodyne	SLC6A3	20	43
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819164447	CD	On-Demand	Anodyne	MLNR	38	41
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819164447	CD	On-Demand	Anodyne	EPHX2	21	45
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819164448	CD	On-Demand	Anodyne	SLC6A3	20	43
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819164448	CD	On-Demand	Anodyne	MLNR	38	41
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819164448	CD	On-Demand	Anodyne	EPHX2	21	45
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(C(=O)C3CCCC3)C2)cc1	ZINC000819164452	GD	On-Demand	Anodyne	ADRB3	25	41
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(C(=O)C3CCCC3)C2)cc1	ZINC000819164452	GD	On-Demand	Anodyne	SFRP1	65	34
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(C(=O)C3CCCC3)C2)cc1	ZINC000819164452	GD	On-Demand	Anodyne	WNT3	63	34
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(C(=O)C3CCCC3)C2)cc1	ZINC000819164453	GD	On-Demand	Anodyne	ADRB3	25	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(C(=O)C3CCCC3)C2)cc1	ZINC000819164453	GD	On-Demand	Anodyne	SFRP1	65	34
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(C(=O)C3CCCC3)C2)cc1	ZINC000819164453	GD	On-Demand	Anodyne	WNT3	63	34
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(C(=O)C3CCCC3)C2)cc1	ZINC000819164454	GD	On-Demand	Anodyne	ADRB3	25	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(C(=O)C3CCCC3)C2)cc1	ZINC000819164454	GD	On-Demand	Anodyne	SFRP1	65	34
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(C(=O)C3CCCC3)C2)cc1	ZINC000819164454	GD	On-Demand	Anodyne	WNT3	63	34
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(C(=O)C3CCCC3)C2)cc1	ZINC000819164455	GD	On-Demand	Anodyne	ADRB3	25	41
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(C(=O)C3CCCC3)C2)cc1	ZINC000819164455	GD	On-Demand	Anodyne	SFRP1	65	34
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(C(=O)C3CCCC3)C2)cc1	ZINC000819164455	GD	On-Demand	Anodyne	WNT3	63	34
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819164460	EF	On-Demand	Anodyne	ADRB1	39	47
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819164460	EF	On-Demand	Anodyne	ADRB3	59	49
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819164460	EF	On-Demand	Anodyne	CYP3A4	48	39
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819164461	EF	On-Demand	Anodyne	ADRB1	39	47
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819164461	EF	On-Demand	Anodyne	ADRB3	59	49
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819164461	EF	On-Demand	Anodyne	CYP3A4	48	39
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819164462	EF	On-Demand	Anodyne	ADRB1	39	47
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819164462	EF	On-Demand	Anodyne	ADRB3	59	49
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819164462	EF	On-Demand	Anodyne	CYP3A4	48	39
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819164463	EF	On-Demand	Anodyne	ADRB1	39	47
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819164463	EF	On-Demand	Anodyne	ADRB3	59	49
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819164463	EF	On-Demand	Anodyne	CYP3A4	48	39
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164474	EE	On-Demand	Anodyne	SFRP1	45	34
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164474	EE	On-Demand	Anodyne	WNT3	46	34
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164475	EE	On-Demand	Anodyne	SFRP1	45	34
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164475	EE	On-Demand	Anodyne	WNT3	46	34
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164476	EE	On-Demand	Anodyne	SFRP1	45	34
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164476	EE	On-Demand	Anodyne	WNT3	46	34
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164477	EE	On-Demand	Anodyne	SFRP1	45	34
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164477	EE	On-Demand	Anodyne	WNT3	46	34
O=S(=O)(Nc1ccc(F)cc1)c1ccc(CNC[C@@H](O)C2CC2)cc1	ZINC000819164488	FE	On-Demand	Anodyne	ADRB2	26	47
O=S(=O)(Nc1ccc(F)cc1)c1ccc(CNC[C@@H](O)C2CC2)cc1	ZINC000819164488	FE	On-Demand	Anodyne	ADRB1	21	47
O=S(=O)(Nc1ccc(F)cc1)c1ccc(CNC[C@@H](O)C2CC2)cc1	ZINC000819164488	FE	On-Demand	Anodyne	ADRB3	83	47
O=S(=O)(Nc1ccc(F)cc1)c1ccc(CNC[C@@H](O)C2CC2)cc1	ZINC000819164488	FE	On-Demand	Anodyne	LIMK2	17	41
O=S(=O)(Nc1ccc(F)cc1)c1ccc(CNC[C@H](O)C2CC2)cc1	ZINC000819164489	FE	On-Demand	Anodyne	ADRB2	26	47
O=S(=O)(Nc1ccc(F)cc1)c1ccc(CNC[C@H](O)C2CC2)cc1	ZINC000819164489	FE	On-Demand	Anodyne	ADRB1	21	47
O=S(=O)(Nc1ccc(F)cc1)c1ccc(CNC[C@H](O)C2CC2)cc1	ZINC000819164489	FE	On-Demand	Anodyne	ADRB3	83	47
O=S(=O)(Nc1ccc(F)cc1)c1ccc(CNC[C@H](O)C2CC2)cc1	ZINC000819164489	FE	On-Demand	Anodyne	LIMK2	17	41
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cscn2)c1	ZINC000819164512	CD	On-Demand	Bother	ADRB3	62	38
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cscn2)c1	ZINC000819164513	CD	On-Demand	Bother	ADRB3	62	38
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164519	FG	On-Demand	Anodyne	RBP4	73	36
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164519	FG	On-Demand	Anodyne	SFRP1	130	40
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164519	FG	On-Demand	Anodyne	WNT3	91	40
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164520	FG	On-Demand	Anodyne	RBP4	73	36
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164520	FG	On-Demand	Anodyne	SFRP1	130	40
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164520	FG	On-Demand	Anodyne	WNT3	91	40
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164521	FG	On-Demand	Anodyne	RBP4	73	36
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164521	FG	On-Demand	Anodyne	SFRP1	130	40
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164521	FG	On-Demand	Anodyne	WNT3	91	40
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164522	FG	On-Demand	Anodyne	RBP4	73	36
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164522	FG	On-Demand	Anodyne	SFRP1	130	40
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164522	FG	On-Demand	Anodyne	WNT3	91	40
CN(C)CCOc1ccc(CN2C(=O)CN(Cc3ccccc3O)C2=O)cc1	ZINC000819164543	GE	On-Demand	Clean	ESRRG	50	37
COCCOC(=O)Nc1cccc(NC(=O)[C@@H]2CCCO[C@@H]2C(C)C)c1	ZINC000819164621	FG	On-Demand	Anodyne	KCNK3	60	38
COCCOC(=O)Nc1cccc(NC(=O)[C@@H]2CCCO[C@@H]2C(C)C)c1	ZINC000819164621	FG	On-Demand	Anodyne	KCNK9	47	33
Cc1nc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)sc1C	ZINC000819164627	FE	On-Demand	Anodyne	ADRB2	22	40
Cc1nc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)sc1C	ZINC000819164627	FE	On-Demand	Anodyne	ADRB3	73	38
Cc1nc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)sc1C	ZINC000819164628	FE	On-Demand	Anodyne	ADRB2	22	40
Cc1nc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)sc1C	ZINC000819164628	FE	On-Demand	Anodyne	ADRB3	73	38
C=CCC1(C(=O)Nc2cccc(NC(=O)OCCOC)c2)CCOCC1	ZINC000819164705	FG	On-Demand	Mild	LIMK2	19	42
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164730	CD	On-Demand	Anodyne	ADRB3	27	40
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164730	CD	On-Demand	Anodyne	MLNR	29	41
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164730	CD	On-Demand	Anodyne	EPHX2	19	42
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164732	CD	On-Demand	Anodyne	ADRB3	27	40
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164732	CD	On-Demand	Anodyne	MLNR	29	41
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164732	CD	On-Demand	Anodyne	EPHX2	19	42
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164734	CD	On-Demand	Anodyne	ADRB3	27	40
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164734	CD	On-Demand	Anodyne	MLNR	29	41
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164734	CD	On-Demand	Anodyne	EPHX2	19	42
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164735	CD	On-Demand	Anodyne	ADRB3	27	40
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164735	CD	On-Demand	Anodyne	MLNR	29	41
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819164735	CD	On-Demand	Anodyne	EPHX2	19	42
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164739	EE	On-Demand	Anodyne	ADRB3	25	40
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164739	EE	On-Demand	Anodyne	CACNA1B	48	35
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164739	EE	On-Demand	Anodyne	MLNR	20	43
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164739	EE	On-Demand	Anodyne	CCR2	104	45
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164739	EE	On-Demand	Anodyne	EPHX2	26	57
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164739	EE	On-Demand	Anodyne	LIPG	48	34
CCC(=O)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164739	EE	On-Demand	Anodyne	SFRP1	62	35
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164741	EE	On-Demand	Anodyne	ADRB3	25	40
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164741	EE	On-Demand	Anodyne	CACNA1B	48	35
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164741	EE	On-Demand	Anodyne	MLNR	20	43
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164741	EE	On-Demand	Anodyne	CCR2	104	45
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164741	EE	On-Demand	Anodyne	EPHX2	26	57
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164741	EE	On-Demand	Anodyne	LIPG	48	34
CCC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164741	EE	On-Demand	Anodyne	SFRP1	62	35
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164743	EE	On-Demand	Anodyne	ADRB3	25	40
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164743	EE	On-Demand	Anodyne	CACNA1B	48	35
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164743	EE	On-Demand	Anodyne	MLNR	20	43
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164743	EE	On-Demand	Anodyne	CCR2	104	45
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164743	EE	On-Demand	Anodyne	EPHX2	26	57
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164743	EE	On-Demand	Anodyne	LIPG	48	34
CCC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164743	EE	On-Demand	Anodyne	SFRP1	62	35
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164744	EE	On-Demand	Anodyne	ADRB3	25	40
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164744	EE	On-Demand	Anodyne	CACNA1B	48	35
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164744	EE	On-Demand	Anodyne	MLNR	20	43
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164744	EE	On-Demand	Anodyne	CCR2	104	45
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164744	EE	On-Demand	Anodyne	EPHX2	26	57
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164744	EE	On-Demand	Anodyne	LIPG	48	34
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819164744	EE	On-Demand	Anodyne	SFRP1	62	35
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819164745	DD	On-Demand	Anodyne	ADRB1	28	42
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819164745	DD	On-Demand	Anodyne	ADRB3	91	49
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819164745	DD	On-Demand	Anodyne	C3AR1	46	44
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819164746	DD	On-Demand	Anodyne	ADRB1	28	42
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819164746	DD	On-Demand	Anodyne	ADRB3	91	49
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819164746	DD	On-Demand	Anodyne	C3AR1	46	44
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819164747	DD	On-Demand	Anodyne	ADRB1	28	42
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819164747	DD	On-Demand	Anodyne	ADRB3	91	49
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819164747	DD	On-Demand	Anodyne	C3AR1	46	44
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819164748	DD	On-Demand	Anodyne	ADRB1	28	42
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819164748	DD	On-Demand	Anodyne	ADRB3	91	49
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819164748	DD	On-Demand	Anodyne	C3AR1	46	44
O=C(NCC1CC1)NNC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819164774	GF	On-Demand	Reactive	CNR1	53	32
Cc1nn(-c2ccc(F)cc2)c(Cl)c1CN[C@@H]1CC[C@H](C(=O)O)C1	ZINC000819164775	FG	On-Demand	Anodyne	P2RX7	27	40
CON(C)C(=O)CCNCc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000819164788	GE	On-Demand	Anodyne	ADRB3	36	42
CON(C)C(=O)CCNCc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000819164788	GE	On-Demand	Anodyne	ALPI	16	48
CON(C)C(=O)CCNCc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1	ZINC000819164788	GE	On-Demand	Anodyne	LIMK2	30	48
O=C(Cc1ccc(-n2cnnc2)cc1)NNC(=O)NCC1CC1	ZINC000819164814	DC	On-Demand	Reactive	CACNA1I	25	40
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819164815	CD	On-Demand	Anodyne	ADRB3	24	46
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819164815	CD	On-Demand	Anodyne	EPHX2	19	52
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819164816	CD	On-Demand	Anodyne	ADRB3	24	46
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819164816	CD	On-Demand	Anodyne	EPHX2	19	52
COc1cccc([S@@](=O)CC(=O)NNC(=O)NCC2CC2)c1	ZINC000819164819	EC	On-Demand	Reactive	MTNR1A	45	38
COc1cccc([S@@](=O)CC(=O)NNC(=O)NCC2CC2)c1	ZINC000819164819	EC	On-Demand	Reactive	MTNR1B	40	38
O[C@@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1cccnc1	ZINC000819164839	GG	On-Demand	Anodyne	ADRB1	24	40
O[C@@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1cccnc1	ZINC000819164839	GG	On-Demand	Anodyne	ADRB3	82	52
O[C@@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1cccnc1	ZINC000819164839	GG	On-Demand	Anodyne	SIGMAR1	21	47
O[C@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1cccnc1	ZINC000819164841	GG	On-Demand	Anodyne	ADRB1	24	40
O[C@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1cccnc1	ZINC000819164841	GG	On-Demand	Anodyne	ADRB3	82	52
O[C@H](CNC1CCN(Cc2ccc(Br)cc2)CC1)c1cccnc1	ZINC000819164841	GG	On-Demand	Anodyne	SIGMAR1	21	47
CCC(=O)N1CC[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819164869	CD	On-Demand	Anodyne	EPHX2	17	41
CCC(=O)N1CC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819164871	CD	On-Demand	Anodyne	EPHX2	17	41
CCC(=O)N1CC[C@@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819164873	CD	On-Demand	Anodyne	EPHX2	17	41
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819164874	CD	On-Demand	Anodyne	EPHX2	17	41
CC(=O)Nc1cccc(CC(=O)NCCS(=O)(=O)Cc2ccccc2)c1	ZINC000819164958	FD	On-Demand	Anodyne	KCNK3	70	35
CC(=O)Nc1cccc(CC(=O)NCCS(=O)(=O)Cc2ccccc2)c1	ZINC000819164958	FD	On-Demand	Anodyne	KCNK9	44	34
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164961	EE	On-Demand	Anodyne	EPHX2	27	44
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164961	EE	On-Demand	Anodyne	RBP4	78	37
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164961	EE	On-Demand	Anodyne	SFRP1	122	40
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164961	EE	On-Demand	Anodyne	SCD	20	42
CCC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164961	EE	On-Demand	Anodyne	WNT3	84	40
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164962	EE	On-Demand	Anodyne	EPHX2	27	44
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164962	EE	On-Demand	Anodyne	RBP4	78	37
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164962	EE	On-Demand	Anodyne	SFRP1	122	40
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164962	EE	On-Demand	Anodyne	SCD	20	42
CCC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164962	EE	On-Demand	Anodyne	WNT3	84	40
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164963	EE	On-Demand	Anodyne	EPHX2	27	44
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164963	EE	On-Demand	Anodyne	RBP4	78	37
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164963	EE	On-Demand	Anodyne	SFRP1	122	40
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164963	EE	On-Demand	Anodyne	SCD	20	42
CCC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164963	EE	On-Demand	Anodyne	WNT3	84	40
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164969	EE	On-Demand	Anodyne	EPHX2	27	44
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164969	EE	On-Demand	Anodyne	RBP4	78	37
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164969	EE	On-Demand	Anodyne	SFRP1	122	40
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164969	EE	On-Demand	Anodyne	SCD	20	42
CCC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819164969	EE	On-Demand	Anodyne	WNT3	84	40
O=C(NC1CC1)c1cccc(CN2C(=O)CN(Cc3ccccc3O)C2=O)c1	ZINC000819164970	GE	On-Demand	Clean	DRD4	17	42
O=C(NC1CC1)c1cccc(CN2C(=O)CN(Cc3ccccc3O)C2=O)c1	ZINC000819164970	GE	On-Demand	Clean	MCHR1	15	47
CN1C(=O)CCc2cc(CN[C@@H](Cc3ccc4ccccc4c3)C(=O)O)ccc21	ZINC000819165006	GH	On-Demand	Anodyne	ACE	17	44
CN1C(=O)CCc2cc(CN[C@@H](Cc3ccc4ccccc4c3)C(=O)O)ccc21	ZINC000819165006	GH	On-Demand	Anodyne	MME	28	44
CN1C(=O)CCc2cc(CN[C@@H](Cc3ccc4ccccc4c3)C(=O)O)ccc21	ZINC000819165006	GH	On-Demand	Anodyne	TRY2_BOVIN	61	35
CN1C(=O)CCc2cc(CN[C@@H](Cc3ccc4ccccc4c3)C(=O)O)ccc21	ZINC000819165006	GH	On-Demand	Anodyne	ACE2	52	44
Cc1nc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)sc1C	ZINC000819165027	EH	On-Demand	Anodyne	ADRB3	44	38
Cc1nc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)sc1C	ZINC000819165031	EH	On-Demand	Anodyne	ADRB3	44	38
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819165048	EE	On-Demand	Bother	C3AR1	27	44
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819165050	EE	On-Demand	Bother	C3AR1	27	44
CCN(Cc1ccccc1)C(=O)CN1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819165068	GE	On-Demand	Clean	TSPO	17	41
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819165154	EE	On-Demand	Bother	C3AR1	27	44
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819165155	EE	On-Demand	Bother	C3AR1	27	44
Cc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)c(C)o1	ZINC000819165156	DH	On-Demand	Anodyne	ACE	29	49
Cc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)c(C)o1	ZINC000819165156	DH	On-Demand	Anodyne	PPARG	31	43
Cc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)c(C)o1	ZINC000819165156	DH	On-Demand	Anodyne	PPARA	33	43
Cc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)c(C)o1	ZINC000819165156	DH	On-Demand	Anodyne	MME	76	49
Cc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)c(C)o1	ZINC000819165156	DH	On-Demand	Anodyne	FCER2	25	41
Cc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)c(C)o1	ZINC000819165156	DH	On-Demand	Anodyne	TRY2_BOVIN	53	31
Cc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)c(C)o1	ZINC000819165156	DH	On-Demand	Anodyne	CPA1	42	45
Cc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)c(C)o1	ZINC000819165156	DH	On-Demand	Anodyne	ECE1	28	42
Cc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)c(C)o1	ZINC000819165156	DH	On-Demand	Anodyne	ACE2	77	49
Cc1cc(CN[C@@H](Cc2ccc3ccccc3c2)C(=O)O)c(C)o1	ZINC000819165156	DH	On-Demand	Anodyne	PIN1	36	41
CC(=O)Nc1cccc(CC(=O)NNC(=O)NCC2CC2)c1	ZINC000819165160	DC	On-Demand	Reactive	TSHR	42	32
CC(=O)Nc1cccc(CC(=O)NNC(=O)NCC2CC2)c1	ZINC000819165160	DC	On-Demand	Reactive	CCR3	46	37
O[C@H](CNCCc1cscn1)c1ccc(F)cc1	ZINC000819165170	CE	On-Demand	Anodyne	ADRB2	15	42
O[C@@H](CNCCc1cscn1)c1ccc(F)cc1	ZINC000819165171	CE	On-Demand	Anodyne	ADRB2	15	42
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819165172	FG	On-Demand	Anodyne	EPHX2	24	48
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819165172	FG	On-Demand	Anodyne	MCHR1	19	43
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819165172	FG	On-Demand	Anodyne	SFRP1	80	35
O=C(C1CCCC1)N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819165172	FG	On-Demand	Anodyne	WNT3	72	34
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819165173	FG	On-Demand	Anodyne	EPHX2	24	48
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819165173	FG	On-Demand	Anodyne	MCHR1	19	43
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819165173	FG	On-Demand	Anodyne	SFRP1	80	35
O=C(C1CCCC1)N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819165173	FG	On-Demand	Anodyne	WNT3	72	34
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819165174	FG	On-Demand	Anodyne	EPHX2	24	48
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819165174	FG	On-Demand	Anodyne	MCHR1	19	43
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819165174	FG	On-Demand	Anodyne	SFRP1	80	35
O=C(C1CCCC1)N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819165174	FG	On-Demand	Anodyne	WNT3	72	34
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819165175	FG	On-Demand	Anodyne	EPHX2	24	48
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819165175	FG	On-Demand	Anodyne	MCHR1	19	43
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819165175	FG	On-Demand	Anodyne	SFRP1	80	35
O=C(C1CCCC1)N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819165175	FG	On-Demand	Anodyne	WNT3	72	34
COc1ccc(OCCCN2C(=O)CN(Cc3ccccc3O)C2=O)cc1	ZINC000819165214	FF	On-Demand	Clean	HRH3	47	38
COc1ccc(OCCCN2C(=O)CN(Cc3ccccc3O)C2=O)cc1	ZINC000819165214	FF	On-Demand	Clean	HTR5A	23	44
COc1ccc(OC)c([C@H](O)CNCCc2nc(C)c(C)s2)c1	ZINC000819165262	EF	On-Demand	Anodyne	ADRB2	18	47
CCOC(=O)N[C@@H](CC(C)C)CN1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819165337	GE	On-Demand	Clean	CAPNS1	52	32
CCOC(=O)N[C@@H](CC(C)C)CN1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819165337	GE	On-Demand	Clean	HLA-DRB1	66	36
CCOC(=O)N[C@@H](CC(C)C)CN1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819165337	GE	On-Demand	Clean	CAPN1	44	33
CCOC(=O)N[C@@H](CC(C)C)CN1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819165337	GE	On-Demand	Clean	CAPN2	72	35
CCOC(=O)N[C@H](CC(C)C)CN1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819165338	GE	On-Demand	Clean	CAPNS1	52	32
CCOC(=O)N[C@H](CC(C)C)CN1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819165338	GE	On-Demand	Clean	HLA-DRB1	66	36
CCOC(=O)N[C@H](CC(C)C)CN1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819165338	GE	On-Demand	Clean	CAPN1	44	33
CCOC(=O)N[C@H](CC(C)C)CN1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819165338	GE	On-Demand	Clean	CAPN2	72	35
C[C@H]1CCCCN1CCCCN1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819165341	FF	On-Demand	Clean	HRH3	55	40
C[C@@H]1CCCCN1CCCCN1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819165342	FF	On-Demand	Clean	HRH3	55	40
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccc2ccccc2c1	ZINC000819165347	GG	On-Demand	Anodyne	CYSLTR1	26	48
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccc2ccccc2c1	ZINC000819165347	GG	On-Demand	Anodyne	LTA4H	32	42
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccc2ccccc2c1	ZINC000819165347	GG	On-Demand	Anodyne	TRY2_BOVIN	49	34
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccc2ccccc2c1	ZINC000819165347	GG	On-Demand	Anodyne	UL80	36	41
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccc2ccccc2c1	ZINC000819165347	GG	On-Demand	Anodyne	PLAU	15	42
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1F	ZINC000819165349	FE	On-Demand	Anodyne	CA5B	27	41
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1F	ZINC000819165349	FE	On-Demand	Anodyne	CA5A	31	41
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1Cl	ZINC000819165350	FF	On-Demand	Anodyne	CA5B	27	41
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1Cl	ZINC000819165350	FF	On-Demand	Anodyne	CA5A	31	41
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccccc1Cl	ZINC000819165350	FF	On-Demand	Anodyne	EPHB3	45	32
Cc1nc(CCNC[C@H](O)c2cccc(Br)c2)sc1C	ZINC000819165352	FG	On-Demand	Anodyne	ADRB3	54	37
Cc1nc(CCNC[C@@H](O)c2cccc(Br)c2)sc1C	ZINC000819165353	FG	On-Demand	Anodyne	ADRB3	54	37
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCC1(c2ccccc2)CC1	ZINC000819165367	GE	On-Demand	Anodyne	KCNA3	43	39
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCC1(c2ccccc2)CC1	ZINC000819165367	GE	On-Demand	Anodyne	NPFFR1	26	43
O=C(Cc1cccc2ccccc12)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819165370	GF	On-Demand	Reactive	UL80	32	51
O=C(Cc1cccc2ccccc12)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819165370	GF	On-Demand	Reactive	FURIN	48	34
O=C(Cc1cccc2ccccc12)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819165370	GF	On-Demand	Reactive	AMP1_PLAFQ	29	42
O=C(Cc1cccc2ccccc12)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819165370	GF	On-Demand	Reactive	NCEH1	17	40
O=C(CSCC(=O)Nc1ccc(F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819165371	GF	On-Demand	Anodyne	LTA4H	24	47
O=C(CSCC(=O)Nc1ccc(F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819165371	GF	On-Demand	Anodyne	TPSAB1	16	43
O=C(CSc1nccc2ccccc12)NC1(C(=O)O)CCCC1	ZINC000819165373	EF	On-Demand	Anodyne	NTSR2	20	41
O=C(CSc1nnc(-c2ccc(F)cc2)o1)NCc1ccc(C(=O)O)cc1	ZINC000819165390	GF	On-Demand	Anodyne	ALOX15	53	51
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1cc(F)cc(F)c1	ZINC000819165398	FE	On-Demand	Anodyne	LTA4H	17	40
O=C(CSc1cccc[n+]1[O-])N[C@H](C(=O)O)c1ccccc1	ZINC000819165399	DD	On-Demand	Anodyne	NAALAD2	20	42
Cc1ccc2c(c1)[C@H](NC[C@H](O)c1cccc(Cl)c1)CO2	ZINC000819165403	DG	On-Demand	Anodyne	ADRB3	37	43
Cc1ccc2c(c1)[C@@H](NC[C@H](O)c1cccc(Cl)c1)CO2	ZINC000819165404	DG	On-Demand	Anodyne	ADRB3	37	43
Cc1ccc2c(c1)[C@H](NC[C@@H](O)c1cccc(Cl)c1)CO2	ZINC000819165407	DG	On-Demand	Anodyne	ADRB3	37	43
Cc1ccc2c(c1)[C@@H](NC[C@@H](O)c1cccc(Cl)c1)CO2	ZINC000819165408	DG	On-Demand	Anodyne	ADRB3	37	43
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCC1CCCCC1	ZINC000819165409	FD	On-Demand	Anodyne	CACNA1I	56	40
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCC1CCCCC1	ZINC000819165409	FD	On-Demand	Anodyne	TMPRSS11D	51	37
O=C(Cc1cc2ccccc2nc1O)OCc1ccc(C(=O)O)cc1	ZINC000819165419	EF	On-Demand	Anodyne	CYSLTR1	28	49
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCCC1CCCCC1	ZINC000819165422	FE	On-Demand	Anodyne	ACHE	17	46
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCCC1CCCCC1	ZINC000819165422	FE	On-Demand	Anodyne	MMP2	60	30
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCCC1CCCCC1	ZINC000819165422	FE	On-Demand	Anodyne	PROC	41	36
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCCC1CCCCC1	ZINC000819165422	FE	On-Demand	Anodyne	TMPRSS11D	46	37
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(Cl)c1	ZINC000819165427	FF	On-Demand	Anodyne	UL80	24	41
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(Cl)c1	ZINC000819165427	FF	On-Demand	Anodyne	CPT1A	43	41
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(Cl)c1	ZINC000819165427	FF	On-Demand	Anodyne	AKR1C3	29	47
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(Cl)c1	ZINC000819165427	FF	On-Demand	Anodyne	RORC	35	40
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(Cl)c1	ZINC000819165427	FF	On-Demand	Anodyne	KCNK3	43	42
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NC[C@@H]1Cc2ccccc2O1	ZINC000819165435	GD	On-Demand	Anodyne	TMPRSS11D	42	31
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NC[C@H]1Cc2ccccc2O1	ZINC000819165436	GD	On-Demand	Anodyne	TMPRSS11D	42	31
O=C(Cc1cccc(O)c1)OCc1ccc(C(=O)O)cc1	ZINC000819165439	CE	On-Demand	Anodyne	SRD5A2	16	45
O=C(Cc1cccc(O)c1)OCc1ccc(C(=O)O)cc1	ZINC000819165439	CE	On-Demand	Anodyne	FOLH1	20	41
O=C(Cc1cccc(O)c1)OCc1ccc(C(=O)O)cc1	ZINC000819165439	CE	On-Demand	Anodyne	PTGER1	30	43
O=C(Cc1cccc(O)c1)OCc1ccc(C(=O)O)cc1	ZINC000819165439	CE	On-Demand	Anodyne	SLC12A5	65	33
O=C(CSCc1ccc(C(=O)O)cc1)NCc1cccs1	ZINC000819165445	DF	On-Demand	Anodyne	CA5B	31	42
O=C(CSCc1ccc(C(=O)O)cc1)NCc1cccs1	ZINC000819165445	DF	On-Demand	Anodyne	CA5A	31	42
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1ccc2c(c1)OCO2	ZINC000819165447	GD	On-Demand	Anodyne	PDE5A	16	42
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1ccc2c(c1)OCO2	ZINC000819165447	GD	On-Demand	Anodyne	EDNRB	29	40
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1ccc2c(c1)OCO2	ZINC000819165447	GD	On-Demand	Anodyne	EDNRA	33	40
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1ccc2c(c1)OCO2	ZINC000819165447	GD	On-Demand	Anodyne	BMP1	52	38
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1ccc2c(c1)OCO2	ZINC000819165447	GD	On-Demand	Anodyne	NOS2	100	39
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1ccc2c(c1)OCO2	ZINC000819165447	GD	On-Demand	Anodyne	MCHR1	19	43
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1ccc(Cl)cc1	ZINC000819165452	GE	On-Demand	Anodyne	TMPRSS11D	75	35
O=C(Cc1cc2ccccc2o1)NCc1ccc(C(=O)O)cc1	ZINC000819165454	DF	On-Demand	Anodyne	KCNJ11	55	33
O=C(Cc1cc2ccccc2o1)NCc1ccc(C(=O)O)cc1	ZINC000819165454	DF	On-Demand	Anodyne	UL80	29	44
O=C(Cc1cc2ccccc2o1)NCc1ccc(C(=O)O)cc1	ZINC000819165454	DF	On-Demand	Anodyne	CA5A	15	41
O=C(Cc1cc2ccccc2o1)NCc1ccc(C(=O)O)cc1	ZINC000819165454	DF	On-Demand	Anodyne	HDAC2	16	40
O=C(Cc1cc2ccccc2o1)NCc1ccc(C(=O)O)cc1	ZINC000819165454	DF	On-Demand	Anodyne	FURIN	49	35
O=C(CSc1nncs1)N[C@H](C(=O)O)c1ccccc1	ZINC000819165455	DD	On-Demand	Anodyne	NAALAD2	19	41
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCCc1ccc(F)cc1	ZINC000819165459	GD	On-Demand	Anodyne	CA2	17	51
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCCc1ccc(F)cc1	ZINC000819165459	GD	On-Demand	Anodyne	CA1	19	51
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCCc1ccc(F)cc1	ZINC000819165459	GD	On-Demand	Anodyne	CA12	15	51
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCCc1ccc(F)cc1	ZINC000819165459	GD	On-Demand	Anodyne	CA9	17	51
O=C(CSCC(=O)N1CC[C@H](C(=O)O)C1)Nc1ccc(F)cc1	ZINC000819165460	ED	On-Demand	Anodyne	SLC6A1	50	35
O=C(CSCC(=O)N1CC[C@@H](C(=O)O)C1)Nc1ccc(F)cc1	ZINC000819165461	ED	On-Demand	Anodyne	SLC6A1	50	35
O=C(Cc1ccccc1)NCC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819165462	ED	On-Demand	Anodyne	CA2	21	62
O=C(Cc1ccccc1)NCC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819165462	ED	On-Demand	Anodyne	SRD5A2	15	47
O=C(Cc1ccccc1)NCC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819165462	ED	On-Demand	Anodyne	MME	17	51
O=C(Cc1ccccc1)NCC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819165462	ED	On-Demand	Anodyne	PTGER1	22	46
O=C(Cc1ccccc1)NCC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819165462	ED	On-Demand	Anodyne	CA5B	42	43
O=C(Cc1ccccc1)NCC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819165462	ED	On-Demand	Anodyne	CA5A	44	43
O=C(Cc1ccccc1)NCC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819165462	ED	On-Demand	Anodyne	CAPNS1	42	31
O=C(Cc1ccccc1)NCC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819165462	ED	On-Demand	Anodyne	HDAC1	15	40
O=C(Cc1ccccc1)NCC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819165462	ED	On-Demand	Anodyne	FURIN	46	35
O=C(Cc1ccccc1)NCC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819165462	ED	On-Demand	Anodyne	CAPN2	57	32
O=C(Cc1ccccc1)NCC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819165462	ED	On-Demand	Anodyne	NPR	65	35
O=C(Cc1ccccc1)NCC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819165462	ED	On-Demand	Anodyne	SLC12A5	55	36
O=C(Cc1ccccc1)NCC(=O)OCc1ccc(C(=O)O)cc1	ZINC000819165462	ED	On-Demand	Anodyne	H9B8T9_CAPHI	21	49
O=C(CSc1nnc(S)s1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165466	FD	On-Demand	Anodyne	ACE	60	52
O=C(CSc1nnc(S)s1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165466	FD	On-Demand	Anodyne	MME	130	48
O=C(CSc1nnc(S)s1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165466	FD	On-Demand	Anodyne	ANPEP	63	38
O=C(CSc1nnc(S)s1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165466	FD	On-Demand	Anodyne	FCER2	69	34
O=C(CSc1nnc(S)s1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165466	FD	On-Demand	Anodyne	CTSB	15	40
O=C(CSc1nnc(S)s1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165466	FD	On-Demand	Anodyne	CYSP_TRYCR	40	35
O=C(CSc1nnc(S)s1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165466	FD	On-Demand	Anodyne	CPA1	59	43
O=C(CSc1nnc(S)s1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165466	FD	On-Demand	Anodyne	NAALAD2	31	45
O=C(CSc1nnc(S)s1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165466	FD	On-Demand	Anodyne	ECE1	43	42
O=C(CSc1nnc(S)s1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165466	FD	On-Demand	Anodyne	CAPN1	26	42
O=C(CSc1nnc(S)s1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165466	FD	On-Demand	Anodyne	MMP9	15	41
O=C(CSc1nnc(S)s1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165466	FD	On-Demand	Anodyne	ACE2	95	48
O=C(CSc1nnc(S)s1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165466	FD	On-Demand	Anodyne	FPR1	71	41
O=C(CSc1nnc(S)s1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165466	FD	On-Demand	Anodyne	BLA1_STEMA	83	43
O=C(CSc1nnc(S)s1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165467	FD	On-Demand	Anodyne	ACE	60	52
O=C(CSc1nnc(S)s1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165467	FD	On-Demand	Anodyne	MME	130	48
O=C(CSc1nnc(S)s1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165467	FD	On-Demand	Anodyne	ANPEP	63	38
O=C(CSc1nnc(S)s1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165467	FD	On-Demand	Anodyne	FCER2	69	34
O=C(CSc1nnc(S)s1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165467	FD	On-Demand	Anodyne	CTSB	15	40
O=C(CSc1nnc(S)s1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165467	FD	On-Demand	Anodyne	CYSP_TRYCR	40	35
O=C(CSc1nnc(S)s1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165467	FD	On-Demand	Anodyne	CPA1	59	43
O=C(CSc1nnc(S)s1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165467	FD	On-Demand	Anodyne	NAALAD2	31	45
O=C(CSc1nnc(S)s1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165467	FD	On-Demand	Anodyne	ECE1	43	42
O=C(CSc1nnc(S)s1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165467	FD	On-Demand	Anodyne	CAPN1	26	42
O=C(CSc1nnc(S)s1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165467	FD	On-Demand	Anodyne	MMP9	15	41
O=C(CSc1nnc(S)s1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165467	FD	On-Demand	Anodyne	ACE2	95	48
O=C(CSc1nnc(S)s1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165467	FD	On-Demand	Anodyne	FPR1	71	41
O=C(CSc1nnc(S)s1)N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165467	FD	On-Demand	Anodyne	BLA1_STEMA	83	43
O=C(Cc1ccccc1[N+](=O)[O-])OCc1ccc(C(=O)O)cc1	ZINC000819165470	DF	On-Demand	Bother	GSTM2	37	40
O=C(Cc1ccccc1[N+](=O)[O-])OCc1ccc(C(=O)O)cc1	ZINC000819165470	DF	On-Demand	Bother	COLA	107	43
O=C(Cc1ccccc1[N+](=O)[O-])OCc1ccc(C(=O)O)cc1	ZINC000819165470	DF	On-Demand	Bother	SLC12A5	53	34
O=C(CSc1nnc(S)s1)N[C@H](C(=O)O)c1ccccc1	ZINC000819165472	ED	On-Demand	Anodyne	NAALAD2	19	41
O=C(CSCc1ccc(C(=O)O)cc1)Nc1cc(-n2cnnn2)ccc1F	ZINC000819165476	GE	On-Demand	Anodyne	KCNJ1	45	35
O=C(Cc1ccc(NC(=O)C2CC2)cc1)OCc1ccc(C(=O)O)cc1	ZINC000819165478	FG	On-Demand	Anodyne	EPHX2	23	42
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1ccc(F)cc1	ZINC000819165481	FD	On-Demand	Anodyne	TMPRSS11D	72	35
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)N[C@H]1CCOc2ccccc21	ZINC000819165482	GD	On-Demand	Anodyne	BDKRB1	45	42
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)N[C@H]1CCOc2ccccc21	ZINC000819165482	GD	On-Demand	Anodyne	LUXR	76	40
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)N[C@H]1CCOc2ccccc21	ZINC000819165482	GD	On-Demand	Anodyne	TRAR	77	40
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)N[C@H]1CCOc2ccccc21	ZINC000819165482	GD	On-Demand	Anodyne	LASR	25	40
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)N[C@@H]1CCOc2ccccc21	ZINC000819165483	GD	On-Demand	Anodyne	BDKRB1	45	42
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)N[C@@H]1CCOc2ccccc21	ZINC000819165483	GD	On-Demand	Anodyne	LUXR	76	40
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)N[C@@H]1CCOc2ccccc21	ZINC000819165483	GD	On-Demand	Anodyne	TRAR	77	40
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)N[C@@H]1CCOc2ccccc21	ZINC000819165483	GD	On-Demand	Anodyne	LASR	25	40
OCc1ccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1F	ZINC000819165490	FG	On-Demand	Anodyne	ADRB2	39	43
OCc1ccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1F	ZINC000819165490	FG	On-Demand	Anodyne	GRIN2B	15	47
OCc1ccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1F	ZINC000819165491	FG	On-Demand	Anodyne	ADRB2	39	43
OCc1ccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1F	ZINC000819165491	FG	On-Demand	Anodyne	GRIN2B	15	47
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](C)S(C)(=O)=O)cc1	ZINC000819165498	FF	On-Demand	Anodyne	CTSK	15	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](C)S(C)(=O)=O)cc1	ZINC000819165499	FF	On-Demand	Anodyne	CTSK	15	41
C[C@@H](CNCc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1)S(C)(=O)=O	ZINC000819165500	FF	On-Demand	Anodyne	CTSK	15	41
OCc1ccc(CNC[C@H](O)c2ccccc2)cc1F	ZINC000819165515	CE	On-Demand	Anodyne	ADRB2	42	46
OCc1ccc(CNC[C@H](O)c2ccccc2)cc1F	ZINC000819165515	CE	On-Demand	Anodyne	ADRB1	30	46
OCc1ccc(CNC[C@H](O)c2ccccc2)cc1F	ZINC000819165515	CE	On-Demand	Anodyne	ADRB3	49	39
OCc1ccc(CNC[C@@H](O)c2ccccc2)cc1F	ZINC000819165517	CE	On-Demand	Anodyne	ADRB2	42	46
OCc1ccc(CNC[C@@H](O)c2ccccc2)cc1F	ZINC000819165517	CE	On-Demand	Anodyne	ADRB1	30	46
OCc1ccc(CNC[C@@H](O)c2ccccc2)cc1F	ZINC000819165517	CE	On-Demand	Anodyne	ADRB3	49	39
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2ccccc2F)cc1	ZINC000819165521	GI	On-Demand	Anodyne	PAPA1_CARPA	29	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2ccccc2F)cc1	ZINC000819165521	GI	On-Demand	Anodyne	REN	29	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2ccccc2F)cc1	ZINC000819165521	GI	On-Demand	Anodyne	FPR1	47	39
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2ccccc2F)cc1	ZINC000819165524	GI	On-Demand	Anodyne	PAPA1_CARPA	29	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2ccccc2F)cc1	ZINC000819165524	GI	On-Demand	Anodyne	REN	29	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2ccccc2F)cc1	ZINC000819165524	GI	On-Demand	Anodyne	FPR1	47	39
C[C@@H](CCc1ccc2c(c1)OCO2)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819165527	GF	On-Demand	Clean	BMP1	47	33
C[C@H](CCc1ccc2c(c1)OCO2)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819165529	GF	On-Demand	Clean	BMP1	47	33
Cc1ccc2c(c1)[C@H](NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)CO2	ZINC000819165544	GG	On-Demand	Anodyne	GPR119	19	40
Cc1ccc2c(c1)[C@@H](NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)CO2	ZINC000819165546	GG	On-Demand	Anodyne	GPR119	19	40
Cc1nc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)sc1C	ZINC000819165547	EG	On-Demand	Anodyne	ADRB2	15	40
Cc1nc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)sc1C	ZINC000819165547	EG	On-Demand	Anodyne	ADRB1	15	40
Cc1nc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)sc1C	ZINC000819165547	EG	On-Demand	Anodyne	ADRB3	21	42
Cc1nc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)sc1C	ZINC000819165548	EG	On-Demand	Anodyne	ADRB2	15	40
Cc1nc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)sc1C	ZINC000819165548	EG	On-Demand	Anodyne	ADRB1	15	40
Cc1nc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)sc1C	ZINC000819165548	EG	On-Demand	Anodyne	ADRB3	21	42
Cc1ccc2c(c1)[C@H](NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)CO2	ZINC000819165549	GG	On-Demand	Anodyne	GPR119	19	40
Cc1ccc2c(c1)[C@@H](NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1)CO2	ZINC000819165551	GG	On-Demand	Anodyne	GPR119	19	40
C[C@@H](NC(=O)Cc1nsc2ccccc12)c1ccc(N2CCOCC2)cc1	ZINC000819165563	GH	On-Demand	Clean	PRKDC	48	33
CNC(=O)COc1cccc(CN2C(=O)CN(Cc3ccccc3O)C2=O)c1	ZINC000819165581	GD	On-Demand	Clean	UPP1	58	34
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)C(F)=C1CCC1	ZINC000819165582	EI	On-Demand	Anodyne	MAPK14	49	39
Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)C(F)=C1CCC1	ZINC000819165582	EI	On-Demand	Anodyne	MAPK13	59	34
Cc1ccc2c(c1)[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CO2	ZINC000819165599	GG	On-Demand	Anodyne	GPR119	35	43
Cc1ccc2c(c1)[C@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CO2	ZINC000819165601	GG	On-Demand	Anodyne	GPR119	35	43
Cc1ccc2c(c1)[C@@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CO2	ZINC000819165604	GG	On-Demand	Anodyne	GPR119	35	43
Cc1ccc2c(c1)[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CO2	ZINC000819165605	GG	On-Demand	Anodyne	GPR119	35	43
O=C(Cc1ccc(NCc2ccc(C(=O)O)cc2)cc1)NCCO	ZINC000819165615	ED	On-Demand	Anodyne	UL80	20	43
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819165617	ED	On-Demand	Anodyne	F2	25	45
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819165617	ED	On-Demand	Anodyne	PLG	55	35
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819165617	ED	On-Demand	Anodyne	CA2	20	49
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819165617	ED	On-Demand	Anodyne	CA1	15	49
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819165617	ED	On-Demand	Anodyne	TRYP_PIG	47	33
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819165617	ED	On-Demand	Anodyne	CA5B	33	49
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819165617	ED	On-Demand	Anodyne	CA4	15	42
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819165617	ED	On-Demand	Anodyne	CA5A	38	49
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819165617	ED	On-Demand	Anodyne	FURIN	50	35
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1ccccc1	ZINC000819165617	ED	On-Demand	Anodyne	TMPRSS11D	114	43
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	ACE	55	50
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	MME	120	46
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	ANPEP	61	38
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	FCER2	72	36
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	GSTM2	41	35
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	CTSB	17	41
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	CYSP_TRYCR	44	34
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	CPA1	59	42
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	COLA	41	38
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	ITGA4	27	41
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	NAALAD2	32	46
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	ECE1	34	40
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	CAPN1	29	42
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	MMP9	15	40
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	ACE2	87	46
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	MMP1	17	40
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	FPR1	71	39
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	NPR	18	40
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	BLA1_STEMA	81	48
O=C(CSc1ccccc1[N+](=O)[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165619	FE	On-Demand	Bother	BRCA1	44	31
Cc1nc(CCNC[C@H](O)c2ccc(F)cc2)sc1C	ZINC000819165623	CF	On-Demand	Anodyne	ADRB2	15	41
Cc1nc(CCNC[C@@H](O)c2ccc(F)cc2)sc1C	ZINC000819165624	CF	On-Demand	Anodyne	ADRB2	15	41
O=C(Cc1ccc2ccccc2c1)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819165658	GF	On-Demand	Reactive	CYSLTR1	21	42
O=C(Cc1ccc2ccccc2c1)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819165658	GF	On-Demand	Reactive	UL80	29	45
O=C(Cc1ccc2ccccc2c1)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819165658	GF	On-Demand	Reactive	FURIN	51	35
O=C(Cc1ccc2ccccc2c1)NNC(=O)NCc1ccc(C(=O)O)cc1	ZINC000819165658	GF	On-Demand	Reactive	NCEH1	16	40
O=C(CSCc1ccc(C(=O)O)cc1)NCC1CC1	ZINC000819165682	CE	On-Demand	Anodyne	CACNA1I	66	43
Cc1nc(CCNC[C@H](O)c2ccccc2)sc1C	ZINC000819165687	CF	On-Demand	Anodyne	ADRB2	33	49
Cc1nc(CCNC[C@H](O)c2ccccc2)sc1C	ZINC000819165687	CF	On-Demand	Anodyne	ADRB1	42	39
Cc1nc(CCNC[C@H](O)c2ccccc2)sc1C	ZINC000819165687	CF	On-Demand	Anodyne	ADRB3	82	44
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1cccc(Cl)c1	ZINC000819165691	GE	On-Demand	Anodyne	F2	19	48
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1cccc(Cl)c1	ZINC000819165691	GE	On-Demand	Anodyne	PTGER4	16	49
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1cccc(Cl)c1	ZINC000819165691	GE	On-Demand	Anodyne	UL80	24	42
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1cccc(Cl)c1	ZINC000819165691	GE	On-Demand	Anodyne	FBP1	24	44
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1cccc(Cl)c1	ZINC000819165691	GE	On-Demand	Anodyne	TMPRSS11D	82	35
O=C(Cc1ccc(O)cc1)OCc1ccc(C(=O)O)cc1	ZINC000819165693	CE	On-Demand	Anodyne	SRD5A2	18	50
OCc1ccc(CNC[C@H](O)c2ccc(Cl)c(F)c2)cc1F	ZINC000819165698	EF	On-Demand	Anodyne	ADRB2	34	42
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccc(F)cc1F	ZINC000819165699	FE	On-Demand	Anodyne	CA5B	17	42
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccc(F)cc1F	ZINC000819165699	FE	On-Demand	Anodyne	CA5A	19	42
OCc1ccc(CNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1F	ZINC000819165700	EF	On-Demand	Anodyne	ADRB2	34	42
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1cccs1	ZINC000819165701	FD	On-Demand	Anodyne	CA5B	35	46
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1cccs1	ZINC000819165701	FD	On-Demand	Anodyne	CA5A	35	46
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccc2c(c1)OCO2	ZINC000819165709	GD	On-Demand	Anodyne	NOS2	50	31
O=C(CSc1nnc(-c2ccco2)o1)OCc1ccc(C(=O)O)cc1	ZINC000819165711	FF	On-Demand	Anodyne	ALOX15	60	35
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)N[C@@H]1CCCc2ccccc21	ZINC000819165715	GE	On-Demand	Anodyne	BDKRB1	79	43
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)N[C@H]1CCCc2ccccc21	ZINC000819165717	GE	On-Demand	Anodyne	BDKRB1	79	43
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccc(F)cc1Cl	ZINC000819165719	GF	On-Demand	Anodyne	CA1	17	49
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccc(F)cc1Cl	ZINC000819165719	GF	On-Demand	Anodyne	CA5B	17	40
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccc(F)cc1Cl	ZINC000819165719	GF	On-Demand	Anodyne	CA4	20	40
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccc(F)cc1Cl	ZINC000819165719	GF	On-Demand	Anodyne	CA5A	19	40
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1cccc(F)c1	ZINC000819165725	FE	On-Demand	Anodyne	KCNK3	41	42
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCC1CCC1	ZINC000819165734	ED	On-Demand	Anodyne	CACNA1I	59	40
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCC1CCC1	ZINC000819165734	ED	On-Demand	Anodyne	TMPRSS11D	56	34
O=C(Cc1cccnc1)NNC(=O)N1CCO[C@H](C(=O)O)C1	ZINC000819165735	DB	On-Demand	Reactive	CHRNA7	49	36
O=C(Cc1cccnc1)NNC(=O)N1CCO[C@H](C(=O)O)C1	ZINC000819165735	DB	On-Demand	Reactive	C3AR1	40	37
O=C(Cc1cccnc1)NNC(=O)N1CCO[C@@H](C(=O)O)C1	ZINC000819165736	DB	On-Demand	Reactive	CHRNA7	49	36
O=C(Cc1cccnc1)NNC(=O)N1CCO[C@@H](C(=O)O)C1	ZINC000819165736	DB	On-Demand	Reactive	C3AR1	40	37
O=C(CSc1cccc[n+]1[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165752	ED	On-Demand	Anodyne	ACE	51	50
O=C(CSc1cccc[n+]1[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165752	ED	On-Demand	Anodyne	MME	118	46
O=C(CSc1cccc[n+]1[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165752	ED	On-Demand	Anodyne	ANPEP	59	38
O=C(CSc1cccc[n+]1[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165752	ED	On-Demand	Anodyne	FCER2	62	32
O=C(CSc1cccc[n+]1[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165752	ED	On-Demand	Anodyne	CTSB	15	41
O=C(CSc1cccc[n+]1[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165752	ED	On-Demand	Anodyne	CPA1	58	42
O=C(CSc1cccc[n+]1[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165752	ED	On-Demand	Anodyne	NAALAD2	32	46
O=C(CSc1cccc[n+]1[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165752	ED	On-Demand	Anodyne	ECE1	32	40
O=C(CSc1cccc[n+]1[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165752	ED	On-Demand	Anodyne	CAPN1	27	42
O=C(CSc1cccc[n+]1[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165752	ED	On-Demand	Anodyne	ACE2	85	46
O=C(CSc1cccc[n+]1[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165752	ED	On-Demand	Anodyne	FPR1	72	39
O=C(CSc1cccc[n+]1[O-])N[C@H](Cc1ccccc1)C(=O)O	ZINC000819165752	ED	On-Demand	Anodyne	BLA1_STEMA	76	40
O=C(CSc1cccc[n+]1[O-])N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165753	ED	On-Demand	Anodyne	ACE	51	50
O=C(CSc1cccc[n+]1[O-])N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165753	ED	On-Demand	Anodyne	MME	118	46
O=C(CSc1cccc[n+]1[O-])N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165753	ED	On-Demand	Anodyne	ANPEP	59	38
O=C(CSc1cccc[n+]1[O-])N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165753	ED	On-Demand	Anodyne	FCER2	62	32
O=C(CSc1cccc[n+]1[O-])N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165753	ED	On-Demand	Anodyne	CTSB	15	41
O=C(CSc1cccc[n+]1[O-])N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165753	ED	On-Demand	Anodyne	CPA1	58	42
O=C(CSc1cccc[n+]1[O-])N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165753	ED	On-Demand	Anodyne	NAALAD2	32	46
O=C(CSc1cccc[n+]1[O-])N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165753	ED	On-Demand	Anodyne	ECE1	32	40
O=C(CSc1cccc[n+]1[O-])N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165753	ED	On-Demand	Anodyne	CAPN1	27	42
O=C(CSc1cccc[n+]1[O-])N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165753	ED	On-Demand	Anodyne	ACE2	85	46
O=C(CSc1cccc[n+]1[O-])N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165753	ED	On-Demand	Anodyne	FPR1	72	39
O=C(CSc1cccc[n+]1[O-])N[C@@H](Cc1ccccc1)C(=O)O	ZINC000819165753	ED	On-Demand	Anodyne	BLA1_STEMA	76	40
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccc(F)c(Cl)c1	ZINC000819165754	GF	On-Demand	Anodyne	CPT1A	53	38
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)Nc1ccc(F)c(Cl)c1	ZINC000819165754	GF	On-Demand	Anodyne	CPT2	43	33
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCC(=O)N1CCCC1	ZINC000819165759	FC	On-Demand	Anodyne	TMPRSS11D	82	34
O=C(CS(=O)(=O)Cc1ccc(C(=O)O)cc1)NCc1ccccc1F	ZINC000819165762	FD	On-Demand	Anodyne	TMPRSS11D	53	35
Cc1nc(CCNC[C@@H](O)c2ccccc2)sc1C	ZINC000819165765	CF	On-Demand	Anodyne	ADRB2	33	49
Cc1nc(CCNC[C@@H](O)c2ccccc2)sc1C	ZINC000819165765	CF	On-Demand	Anodyne	ADRB1	42	39
Cc1nc(CCNC[C@@H](O)c2ccccc2)sc1C	ZINC000819165765	CF	On-Demand	Anodyne	ADRB3	82	44
CC(C)(C)OC(=O)N1CCC(N2C(=O)CN(Cc3ccccc3O)C2=O)CC1	ZINC000819165769	GF	On-Demand	Clean	GPR119	43	45
OCc1ccc(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1F	ZINC000819165807	EG	On-Demand	Anodyne	ADRB2	22	40
OCc1ccc(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1F	ZINC000819165808	EG	On-Demand	Anodyne	ADRB2	22	40
COC(=O)c1ccc(CCN2C(=O)CN(Cc3ccccc3O)C2=O)cc1	ZINC000819165814	FE	On-Demand	Clean	FABI	45	32
OCc1ccc(CNC[C@H](O)c2cccc(F)c2)cc1F	ZINC000819165819	CE	On-Demand	Anodyne	ADRB2	45	41
OCc1ccc(CNC[C@H](O)c2cccc(F)c2)cc1F	ZINC000819165819	CE	On-Demand	Anodyne	ADRB1	32	40
OCc1ccc(CNC[C@H](O)c2cccc(F)c2)cc1F	ZINC000819165819	CE	On-Demand	Anodyne	ADRB3	38	40
OCc1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1F	ZINC000819165820	CE	On-Demand	Anodyne	ADRB2	45	41
OCc1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1F	ZINC000819165820	CE	On-Demand	Anodyne	ADRB1	32	40
OCc1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1F	ZINC000819165820	CE	On-Demand	Anodyne	ADRB3	38	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNCCC(=O)Nc2cccnc2)cc1	ZINC000819165827	GH	On-Demand	Anodyne	NAMPT	15	45
OCc1ccc(CNC[C@H](O)c2ccc(F)c(Br)c2)cc1F	ZINC000819165833	FG	On-Demand	Anodyne	ADRB2	31	40
OCc1ccc(CNC[C@@H](O)c2ccc(F)c(Br)c2)cc1F	ZINC000819165834	FG	On-Demand	Anodyne	ADRB2	31	40
CC(=O)N(C)C1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819165868	GE	On-Demand	Mild	PAPA1_CARPA	32	40
CC(=O)N(C)C1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819165869	GE	On-Demand	Mild	PAPA1_CARPA	32	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)C(C)(C)C)cc1	ZINC000819165872	FH	On-Demand	Anodyne	CTSK	18	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)C(C)(C)C)cc1	ZINC000819165872	FH	On-Demand	Anodyne	REN	20	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)C(C)(C)C)cc1	ZINC000819165872	FH	On-Demand	Anodyne	FPR1	42	35
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)C(C)(C)C)cc1	ZINC000819165873	FH	On-Demand	Anodyne	CTSK	18	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)C(C)(C)C)cc1	ZINC000819165873	FH	On-Demand	Anodyne	REN	20	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)C(C)(C)C)cc1	ZINC000819165873	FH	On-Demand	Anodyne	FPR1	42	35
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(OCCN2CCOCC2)c1	ZINC000819165874	FD	On-Demand	Anodyne	LTA4H	25	40
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(OCCN2CCOCC2)c1	ZINC000819165874	FD	On-Demand	Anodyne	EPHX2	23	45
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(OCCN2CCOCC2)c1	ZINC000819165875	FD	On-Demand	Anodyne	LTA4H	25	40
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(OCCN2CCOCC2)c1	ZINC000819165875	FD	On-Demand	Anodyne	EPHX2	23	45
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(OCCN2CCOCC2)c1	ZINC000819165876	FD	On-Demand	Anodyne	LTA4H	25	40
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(OCCN2CCOCC2)c1	ZINC000819165876	FD	On-Demand	Anodyne	EPHX2	23	45
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(OCCN2CCOCC2)c1	ZINC000819165877	FD	On-Demand	Anodyne	LTA4H	25	40
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(OCCN2CCOCC2)c1	ZINC000819165877	FD	On-Demand	Anodyne	EPHX2	23	45
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819165883	GI	On-Demand	Anodyne	PAPA1_CARPA	28	44
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819165883	GI	On-Demand	Anodyne	LEF	39	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819165885	GI	On-Demand	Anodyne	PAPA1_CARPA	28	44
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819165885	GI	On-Demand	Anodyne	LEF	39	40
OCc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1F	ZINC000819165900	DF	On-Demand	Anodyne	ADRB2	51	42
OCc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1F	ZINC000819165900	DF	On-Demand	Anodyne	ADRB1	49	50
OCc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1F	ZINC000819165900	DF	On-Demand	Anodyne	ADRB3	61	50
OCc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1F	ZINC000819165901	DF	On-Demand	Anodyne	ADRB2	51	42
OCc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1F	ZINC000819165901	DF	On-Demand	Anodyne	ADRB1	49	50
OCc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1F	ZINC000819165901	DF	On-Demand	Anodyne	ADRB3	61	50
Cn1nccc1[C@H](NCc1ccc(N2CCOCC2)c(F)c1)C(=O)O	ZINC000819165909	ED	On-Demand	Clean	NPY2R	55	33
Cn1nccc1[C@@H](NCc1ccc(N2CCOCC2)c(F)c1)C(=O)O	ZINC000819165910	ED	On-Demand	Clean	NPY2R	55	33
Cc1nc(CCNC[C@H](O)c2cccc(Cl)c2)sc1C	ZINC000819165922	DG	On-Demand	Anodyne	ADRB2	43	38
Cc1nc(CCNC[C@H](O)c2cccc(Cl)c2)sc1C	ZINC000819165922	DG	On-Demand	Anodyne	ADRB1	59	50
Cc1nc(CCNC[C@H](O)c2cccc(Cl)c2)sc1C	ZINC000819165922	DG	On-Demand	Anodyne	ADRB3	87	50
Cc1nc(CCNC[C@@H](O)c2cccc(Cl)c2)sc1C	ZINC000819165923	DG	On-Demand	Anodyne	ADRB2	43	38
Cc1nc(CCNC[C@@H](O)c2cccc(Cl)c2)sc1C	ZINC000819165923	DG	On-Demand	Anodyne	ADRB1	59	50
Cc1nc(CCNC[C@@H](O)c2cccc(Cl)c2)sc1C	ZINC000819165923	DG	On-Demand	Anodyne	ADRB3	87	50
Cc1nc(CCNC[C@H](O)c2ccc(Cl)cc2)sc1C	ZINC000819165957	DG	On-Demand	Anodyne	ADRB1	15	40
Cc1nc(CCNC[C@H](O)c2ccc(Cl)cc2)sc1C	ZINC000819165957	DG	On-Demand	Anodyne	ADRB3	27	40
OCc1ccc(CNC[C@H](O)c2cccnc2)cc1F	ZINC000819165959	CD	On-Demand	Anodyne	ADRB2	40	44
OCc1ccc(CNC[C@H](O)c2cccnc2)cc1F	ZINC000819165959	CD	On-Demand	Anodyne	ADRB1	33	45
OCc1ccc(CNC[C@H](O)c2cccnc2)cc1F	ZINC000819165959	CD	On-Demand	Anodyne	ADRB3	105	45
OCc1ccc(CNC[C@@H](O)c2cccnc2)cc1F	ZINC000819165960	CD	On-Demand	Anodyne	ADRB2	40	44
OCc1ccc(CNC[C@@H](O)c2cccnc2)cc1F	ZINC000819165960	CD	On-Demand	Anodyne	ADRB1	33	45
OCc1ccc(CNC[C@@H](O)c2cccnc2)cc1F	ZINC000819165960	CD	On-Demand	Anodyne	ADRB3	105	45
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1	ZINC000819165963	GF	On-Demand	Clean	CASR	33	41
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1	ZINC000819165963	GF	On-Demand	Clean	KCNQ2	22	44
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1	ZINC000819165963	GF	On-Demand	Clean	PIK3CA	19	41
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1	ZINC000819165963	GF	On-Demand	Clean	PIK3CD	17	42
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1	ZINC000819165963	GF	On-Demand	Clean	PIK3CB	31	42
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)c1	ZINC000819165963	GF	On-Demand	Clean	STAT6	48	36
CC(=O)Nc1cccc(CC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1	ZINC000819165964	GF	On-Demand	Clean	CASR	33	41
CC(=O)Nc1cccc(CC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1	ZINC000819165964	GF	On-Demand	Clean	KCNQ2	22	44
CC(=O)Nc1cccc(CC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1	ZINC000819165964	GF	On-Demand	Clean	PIK3CA	19	41
CC(=O)Nc1cccc(CC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1	ZINC000819165964	GF	On-Demand	Clean	PIK3CD	17	42
CC(=O)Nc1cccc(CC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1	ZINC000819165964	GF	On-Demand	Clean	PIK3CB	31	42
CC(=O)Nc1cccc(CC(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)c1	ZINC000819165964	GF	On-Demand	Clean	STAT6	48	36
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819165994	CC	On-Demand	Anodyne	OPRM1	41	44
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819165994	CC	On-Demand	Anodyne	OPRD1	27	41
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819165994	CC	On-Demand	Anodyne	MME	42	37
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819165994	CC	On-Demand	Anodyne	TACR1	15	48
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819165994	CC	On-Demand	Anodyne	FCER2	60	38
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819165994	CC	On-Demand	Anodyne	CTSB	25	40
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819165994	CC	On-Demand	Anodyne	NPFFR2	76	38
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819165994	CC	On-Demand	Anodyne	HLA-DRB1	55	35
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819165994	CC	On-Demand	Anodyne	CAPN1	49	40
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819165994	CC	On-Demand	Anodyne	QRFPR	47	33
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819165994	CC	On-Demand	Anodyne	NPFFR1	76	44
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819165995	CC	On-Demand	Anodyne	OPRM1	41	44
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819165995	CC	On-Demand	Anodyne	OPRD1	27	41
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819165995	CC	On-Demand	Anodyne	MME	42	37
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819165995	CC	On-Demand	Anodyne	TACR1	15	48
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819165995	CC	On-Demand	Anodyne	FCER2	60	38
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819165995	CC	On-Demand	Anodyne	CTSB	25	40
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819165995	CC	On-Demand	Anodyne	NPFFR2	76	38
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819165995	CC	On-Demand	Anodyne	HLA-DRB1	55	35
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819165995	CC	On-Demand	Anodyne	CAPN1	49	40
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819165995	CC	On-Demand	Anodyne	QRFPR	47	33
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819165995	CC	On-Demand	Anodyne	NPFFR1	76	44
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819165996	CC	On-Demand	Anodyne	OPRM1	41	44
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819165996	CC	On-Demand	Anodyne	OPRD1	27	41
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819165996	CC	On-Demand	Anodyne	MME	42	37
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819165996	CC	On-Demand	Anodyne	TACR1	15	48
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819165996	CC	On-Demand	Anodyne	FCER2	60	38
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819165996	CC	On-Demand	Anodyne	CTSB	25	40
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819165996	CC	On-Demand	Anodyne	NPFFR2	76	38
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819165996	CC	On-Demand	Anodyne	HLA-DRB1	55	35
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819165996	CC	On-Demand	Anodyne	CAPN1	49	40
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819165996	CC	On-Demand	Anodyne	QRFPR	47	33
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819165996	CC	On-Demand	Anodyne	NPFFR1	76	44
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819165997	CC	On-Demand	Anodyne	OPRM1	41	44
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819165997	CC	On-Demand	Anodyne	OPRD1	27	41
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819165997	CC	On-Demand	Anodyne	MME	42	37
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819165997	CC	On-Demand	Anodyne	TACR1	15	48
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819165997	CC	On-Demand	Anodyne	FCER2	60	38
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819165997	CC	On-Demand	Anodyne	CTSB	25	40
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819165997	CC	On-Demand	Anodyne	NPFFR2	76	38
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819165997	CC	On-Demand	Anodyne	HLA-DRB1	55	35
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819165997	CC	On-Demand	Anodyne	CAPN1	49	40
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819165997	CC	On-Demand	Anodyne	QRFPR	47	33
NC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819165997	CC	On-Demand	Anodyne	NPFFR1	76	44
OCc1ccc(CNC[C@H](O)c2ccc(Br)cc2)cc1F	ZINC000819166015	FF	On-Demand	Anodyne	ADRB2	29	41
OCc1ccc(CNC[C@@H](O)c2ccc(Br)cc2)cc1F	ZINC000819166016	FF	On-Demand	Anodyne	ADRB2	29	41
Cc1nc(CCNC[C@@H](O)c2cccnc2)sc1C	ZINC000819166030	CE	On-Demand	Anodyne	ADRB2	33	48
Cc1nc(CCNC[C@@H](O)c2cccnc2)sc1C	ZINC000819166030	CE	On-Demand	Anodyne	ADRB1	41	48
Cc1nc(CCNC[C@@H](O)c2cccnc2)sc1C	ZINC000819166030	CE	On-Demand	Anodyne	ADRB3	128	53
Cc1nc(CCNC[C@H](O)c2cccnc2)sc1C	ZINC000819166031	CE	On-Demand	Anodyne	ADRB2	33	48
Cc1nc(CCNC[C@H](O)c2cccnc2)sc1C	ZINC000819166031	CE	On-Demand	Anodyne	ADRB1	41	48
Cc1nc(CCNC[C@H](O)c2cccnc2)sc1C	ZINC000819166031	CE	On-Demand	Anodyne	ADRB3	128	53
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819166053	FI	On-Demand	Anodyne	ADRB1	29	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819166053	FI	On-Demand	Anodyne	ADRB3	51	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819166053	FI	On-Demand	Anodyne	CTSB	22	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819166053	FI	On-Demand	Anodyne	PAPA1_CARPA	36	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819166053	FI	On-Demand	Anodyne	CTSK	33	49
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819166053	FI	On-Demand	Anodyne	TACR3	15	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819166053	FI	On-Demand	Anodyne	REN	41	44
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819166053	FI	On-Demand	Anodyne	CAPN2	44	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819166053	FI	On-Demand	Anodyne	FPR1	50	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819166054	FI	On-Demand	Anodyne	ADRB1	29	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819166054	FI	On-Demand	Anodyne	ADRB3	51	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819166054	FI	On-Demand	Anodyne	CTSB	22	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819166054	FI	On-Demand	Anodyne	PAPA1_CARPA	36	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819166054	FI	On-Demand	Anodyne	CTSK	33	49
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819166054	FI	On-Demand	Anodyne	TACR3	15	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819166054	FI	On-Demand	Anodyne	REN	41	44
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819166054	FI	On-Demand	Anodyne	CAPN2	44	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819166054	FI	On-Demand	Anodyne	FPR1	50	40
COc1ccc(OCCN2C(=O)CN(Cc3ccccc3O)C2=O)cc1	ZINC000819166057	FE	On-Demand	Clean	HTR5A	15	40
Cc1nc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)sc1C	ZINC000819166059	DF	On-Demand	Bother	CACNA1C	43	34
Cc1nc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)sc1C	ZINC000819166059	DF	On-Demand	Bother	ADRB3	67	39
Cc1nc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)sc1C	ZINC000819166059	DF	On-Demand	Bother	CACNA1D	69	33
Cc1nc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)sc1C	ZINC000819166060	DF	On-Demand	Bother	CACNA1C	43	34
Cc1nc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)sc1C	ZINC000819166060	DF	On-Demand	Bother	ADRB3	67	39
Cc1nc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)sc1C	ZINC000819166060	DF	On-Demand	Bother	CACNA1D	69	33
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819166071	FG	On-Demand	Anodyne	ADRB2	23	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819166071	FG	On-Demand	Anodyne	ADRB1	31	46
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819166071	FG	On-Demand	Anodyne	ADRB3	101	46
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819166072	FG	On-Demand	Anodyne	ADRB2	23	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819166072	FG	On-Demand	Anodyne	ADRB1	31	46
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819166072	FG	On-Demand	Anodyne	ADRB3	101	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(CO)c(F)c2)CC1	ZINC000819166099	GE	On-Demand	Anodyne	GPR119	52	54
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(CO)c(F)c2)CC1	ZINC000819166100	GE	On-Demand	Anodyne	GPR119	52	54
C=CCC1(C(=O)N[C@@H](C)c2ccc(N3CCOCC3)cc2)CCOCC1	ZINC000819166102	FG	On-Demand	Mild	STAT6	45	30
C=CCC1(C(=O)N[C@H](C)c2ccc(N3CCOCC3)cc2)CCOCC1	ZINC000819166103	FG	On-Demand	Mild	STAT6	45	30
Cc1ccccc1[C@@H](O)CNCc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819166158	GI	On-Demand	Anodyne	REN	31	42
Cc1ccccc1[C@@H](O)CNCc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819166158	GI	On-Demand	Anodyne	FPR1	47	39
Cc1ccccc1[C@@H](O)CNCc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819166159	GI	On-Demand	Anodyne	REN	31	42
Cc1ccccc1[C@@H](O)CNCc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819166159	GI	On-Demand	Anodyne	FPR1	47	39
CC(C)(C)OC(=O)CS(=O)(=O)CCNCc1ccc(CO)c(F)c1	ZINC000819166181	FD	On-Demand	Anodyne	TRPV1	30	42
OCc1ccc(CNC[C@H](O)c2ccc(F)cc2)cc1F	ZINC000819166183	CE	On-Demand	Anodyne	ADRB2	36	50
OCc1ccc(CNC[C@@H](O)c2ccc(F)cc2)cc1F	ZINC000819166184	CE	On-Demand	Anodyne	ADRB2	36	50
CC[C@@H](O)CNCc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819166195	DG	On-Demand	Anodyne	CTSK	21	44
CC[C@@H](O)CNCc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819166195	DG	On-Demand	Anodyne	REN	21	40
CC[C@@H](O)CNCc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819166196	DG	On-Demand	Anodyne	CTSK	21	44
CC[C@@H](O)CNCc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819166196	DG	On-Demand	Anodyne	REN	21	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	MME	57	35
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	CTSD	36	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	PGC	54	39
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	CTSB	43	36
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	PAPA1_CARPA	63	48
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	CYSP_TRYCR	41	34
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	CTSK	37	54
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	CTSL	30	48
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	PGA	38	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	TACR3	17	45
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	CAPNS1	54	35
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	REN	73	50
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	REN1	20	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	CTSS	15	48
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	CAPN1	69	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	CAPN2	78	37
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	ACE2	45	35
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	BACE1	35	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	FPR1	65	45
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1	ZINC000819166215	GH	On-Demand	Anodyne	CTRB_BOVIN	21	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	MME	57	35
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	CTSD	36	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	PGC	54	39
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	CTSB	43	36
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	PAPA1_CARPA	63	48
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	CYSP_TRYCR	41	34
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	CTSK	37	54
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	CTSL	30	48
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	PGA	38	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	TACR3	17	45
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	CAPNS1	54	35
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	REN	73	50
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	REN1	20	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	CTSS	15	48
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	CAPN1	69	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	CAPN2	78	37
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	ACE2	45	35
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	BACE1	35	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	FPR1	65	45
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cc2ccccc2)cc1	ZINC000819166217	GH	On-Demand	Anodyne	CTRB_BOVIN	21	42
CON(C)C(=O)CCNCc1ccc(CO)c(F)c1	ZINC000819166218	CC	On-Demand	Anodyne	LEF	50	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	ACE	45	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	OPRM1	62	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	OPRD1	51	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	MME	46	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	TACR1	30	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	MC4R	28	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	CMA1	43	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	CTRA_BOVIN	42	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	FCER2	77	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	TRY1_BOVIN	56	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	CYSP_TRYCR	46	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	NPFFR2	81	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	TIMP3	57	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	TACR3	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	MC3R	46	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	CAPNS1	62	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	HLA-DRB1	60	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	CELA2A	49	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	CAPN1	52	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	ACE2	51	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	MC1R	52	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	MARS	47	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	MMP1	20	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	GAG-PRO	60	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	XIAP	28	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	BLA1_STEMA	49	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	QRFPR	51	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	BRCA1	52	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166249	FD	On-Demand	Anodyne	NPFFR1	77	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	ACE	45	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	OPRM1	62	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	OPRD1	51	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	MME	46	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	TACR1	30	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	MC4R	28	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	CMA1	43	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	CTRA_BOVIN	42	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	FCER2	77	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	TRY1_BOVIN	56	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	CYSP_TRYCR	46	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	NPFFR2	81	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	TIMP3	57	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	TACR3	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	MC3R	46	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	CAPNS1	62	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	HLA-DRB1	60	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	CELA2A	49	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	CAPN1	52	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	ACE2	51	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	MC1R	52	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	MARS	47	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	MMP1	20	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	GAG-PRO	60	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	XIAP	28	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	BLA1_STEMA	49	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	QRFPR	51	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	BRCA1	52	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166250	FD	On-Demand	Anodyne	NPFFR1	77	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	ACE	45	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	OPRM1	62	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	OPRD1	51	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	MME	46	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	TACR1	30	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	MC4R	28	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	CMA1	43	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	CTRA_BOVIN	42	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	FCER2	77	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	TRY1_BOVIN	56	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	CYSP_TRYCR	46	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	NPFFR2	81	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	TIMP3	57	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	TACR3	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	MC3R	46	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	CAPNS1	62	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	HLA-DRB1	60	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	CELA2A	49	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	CAPN1	52	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	ACE2	51	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	MC1R	52	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	MARS	47	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	MMP1	20	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	GAG-PRO	60	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	XIAP	28	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	BLA1_STEMA	49	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	QRFPR	51	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	BRCA1	52	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166251	FD	On-Demand	Anodyne	NPFFR1	77	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	ACE	45	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	OPRM1	62	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	OPRD1	51	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	MME	46	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	TACR1	30	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	MC4R	28	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	CMA1	43	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	CTRA_BOVIN	42	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	FCER2	77	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	TRY1_BOVIN	56	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	CYSP_TRYCR	46	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	NPFFR2	81	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	TIMP3	57	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	TACR3	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	MC3R	46	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	CAPNS1	62	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	HLA-DRB1	60	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	CELA2A	49	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	CAPN1	52	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	ACE2	51	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	MC1R	52	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	MARS	47	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	MMP1	20	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	GAG-PRO	60	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	XIAP	28	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	BLA1_STEMA	49	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	QRFPR	51	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	BRCA1	52	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(N)=O)C2	ZINC000819166252	FD	On-Demand	Anodyne	NPFFR1	77	39
O=C(NCCN1C(=O)CN(Cc2ccccc2O)C1=O)C1CC1	ZINC000819166261	DC	On-Demand	Clean	MTNR1A	16	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)C(F)(F)F)cc1	ZINC000819166280	FG	On-Demand	Anodyne	CTSK	17	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)C(F)(F)F)cc1	ZINC000819166280	FG	On-Demand	Anodyne	REN	15	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)C(F)(F)F)cc1	ZINC000819166282	FG	On-Demand	Anodyne	CTSK	17	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)C(F)(F)F)cc1	ZINC000819166282	FG	On-Demand	Anodyne	REN	15	40
O=C(c1ccc(CN2C(=O)CN(Cc3ccccc3O)C2=O)cc1)N1CCCC1	ZINC000819166292	GF	On-Demand	Clean	FABI	57	42
O=C(c1ccc(CN2C(=O)CN(Cc3ccccc3O)C2=O)cc1)N1CCCC1	ZINC000819166292	GF	On-Demand	Clean	L3MBTL3	51	40
C#CCNC(=O)CCNCc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819166297	FF	On-Demand	Mild	PAPA1_CARPA	37	40
C#CCNC(=O)CCNCc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819166298	FF	On-Demand	Mild	PAPA1_CARPA	37	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819166326	GH	On-Demand	Mild	CTRB_BOVIN	56	32
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819166329	GH	On-Demand	Mild	CTRB_BOVIN	56	32
O=C(c1ccoc1)N1CCC(N2C(=O)CN(Cc3ccccc3O)C2=O)CC1	ZINC000819166336	GE	On-Demand	Clean	L3MBTL3	62	33
C[C@@H](CCc1ccccc1)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819166348	EG	On-Demand	Clean	ACE	38	40
C[C@H](CCc1ccccc1)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819166349	EG	On-Demand	Clean	ACE	38	40
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(CO)c(F)c2)cc1	ZINC000819166380	FD	On-Demand	Anodyne	ADRB2	41	38
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(CO)c(F)c2)cc1	ZINC000819166380	FD	On-Demand	Anodyne	ADRB3	48	38
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(CO)c(F)c2)cc1	ZINC000819166380	FD	On-Demand	Anodyne	TRPV1	83	35
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(CO)c(F)c2)cc1	ZINC000819166381	FD	On-Demand	Anodyne	ADRB2	41	38
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(CO)c(F)c2)cc1	ZINC000819166381	FD	On-Demand	Anodyne	ADRB3	48	38
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(CO)c(F)c2)cc1	ZINC000819166381	FD	On-Demand	Anodyne	TRPV1	83	35
C=C(C)C(C)(C)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1	ZINC000819166387	DG	On-Demand	Mild	STAT6	46	31
C=C(C)C(C)(C)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1	ZINC000819166388	DG	On-Demand	Mild	STAT6	46	31
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](C)O)cc1	ZINC000819166393	DF	On-Demand	Anodyne	CTSK	19	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](C)O)cc1	ZINC000819166393	DF	On-Demand	Anodyne	REN	21	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](C)O)cc1	ZINC000819166393	DF	On-Demand	Anodyne	FPR1	42	36
O=C(c1ccccc1)N1CCC(N2C(=O)CN(Cc3ccccc3O)C2=O)CC1	ZINC000819166511	GE	On-Demand	Clean	AVPR1A	15	43
O=C(c1ccccc1)N1CCC(N2C(=O)CN(Cc3ccccc3O)C2=O)CC1	ZINC000819166511	GE	On-Demand	Clean	L3MBTL3	82	39
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819166542	GI	On-Demand	Anodyne	ADRB1	25	44
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819166542	GI	On-Demand	Anodyne	ADRB3	35	44
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819166542	GI	On-Demand	Anodyne	PAPA1_CARPA	28	43
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819166544	GI	On-Demand	Anodyne	ADRB1	25	44
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819166544	GI	On-Demand	Anodyne	ADRB3	35	44
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819166544	GI	On-Demand	Anodyne	PAPA1_CARPA	28	43
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	ACE	44	39
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	OPRM1	51	45
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	OPRD1	38	45
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	MME	103	40
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	ANPEP	62	34
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	TACR1	19	53
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	FCER2	82	42
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	CTSB	37	42
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	PAPA1_CARPA	48	38
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	CYSP_TRYCR	40	35
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	CTSL	40	43
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	CPA1	42	40
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	NPFFR2	76	41
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	CAPNS1	60	35
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	HLA-DRB1	69	41
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	CAPN1	62	42
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	MMP9	16	44
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	CAPN2	44	38
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	ACE2	58	36
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	MC1R	49	34
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	MMP1	21	47
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	FPR1	45	39
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	BLA1_STEMA	58	40
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	KISS1R	42	31
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	QRFPR	51	36
NC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166545	CD	On-Demand	Anodyne	NPFFR1	79	41
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	ACE	44	39
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	OPRM1	51	45
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	OPRD1	38	45
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	MME	103	40
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	ANPEP	62	34
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	TACR1	19	53
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	FCER2	82	42
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	CTSB	37	42
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	PAPA1_CARPA	48	38
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	CYSP_TRYCR	40	35
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	CTSL	40	43
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	CPA1	42	40
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	NPFFR2	76	41
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	CAPNS1	60	35
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	HLA-DRB1	69	41
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	CAPN1	62	42
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	MMP9	16	44
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	CAPN2	44	38
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	ACE2	58	36
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	MC1R	49	34
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	MMP1	21	47
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	FPR1	45	39
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	BLA1_STEMA	58	40
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	KISS1R	42	31
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	QRFPR	51	36
NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819166546	CD	On-Demand	Anodyne	NPFFR1	79	41
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1ccc(CO)c(F)c1	ZINC000819166550	ED	On-Demand	Anodyne	LEF	44	34
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1ccc(CO)c(F)c1	ZINC000819166552	ED	On-Demand	Anodyne	LEF	44	34
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cn2cccn2)cc1	ZINC000819166562	FF	On-Demand	Anodyne	REN	17	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@@H](O)Cn2cccn2)cc1	ZINC000819166562	FF	On-Demand	Anodyne	AMP1_PLAFQ	21	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cn2cccn2)cc1	ZINC000819166564	FF	On-Demand	Anodyne	REN	17	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC[C@H](O)Cn2cccn2)cc1	ZINC000819166564	FF	On-Demand	Anodyne	AMP1_PLAFQ	21	41
O=C(NCc1cccc(OCCN2CCOCC2)c1)C(F)=C1CCC1	ZINC000819166567	EE	On-Demand	Anodyne	ESR1	53	36
O=C(NCc1cccc(OCCN2CCOCC2)c1)C(F)=C1CCC1	ZINC000819166567	EE	On-Demand	Anodyne	HRH2	31	41
O=C(NCc1cccc(OCCN2CCOCC2)c1)C(F)=C1CCC1	ZINC000819166567	EE	On-Demand	Anodyne	LTA4H	37	43
O=C(NCc1cccc(OCCN2CCOCC2)c1)C(F)=C1CCC1	ZINC000819166567	EE	On-Demand	Anodyne	HRH3	21	40
O=C(NCc1cccc(OCCN2CCOCC2)c1)C(F)=C1CCC1	ZINC000819166567	EE	On-Demand	Anodyne	EPHX2	27	46
O=C(NCc1cccc(OCCN2CCOCC2)c1)C(F)=C1CCC1	ZINC000819166567	EE	On-Demand	Anodyne	FLT3	15	40
OCc1ccc(CNC[C@H](O)c2ccc(Cl)cc2)cc1F	ZINC000819166568	DF	On-Demand	Anodyne	ADRB2	31	49
Cn1nccc1[C@H](NCc1cccnc1Cl)C(=O)O	ZINC000819166595	CD	On-Demand	Anodyne	G2YM83_BOTF4	44	30
Cn1nccc1[C@@H](NCc1cccnc1Cl)C(=O)O	ZINC000819166597	CD	On-Demand	Anodyne	G2YM83_BOTF4	44	30
Cn1nccc1[C@@H](NCc1ccc(Cl)nc1)C(=O)O	ZINC000819166612	CD	On-Demand	Anodyne	NACHRBETA2	43	37
Cn1nccc1[C@H](NCc1ccc(Cl)nc1)C(=O)O	ZINC000819166615	CD	On-Demand	Anodyne	NACHRBETA2	43	37
O=S(=O)(Nc1ccc(N2CCOCC2)c2ccncc12)c1ccc(Cl)nc1	ZINC000819166643	HF	On-Demand	Anodyne	PIK3C3	33	45
COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@H]3CCCC3(C)C)CC2)cc1	ZINC000819166655	GF	On-Demand	Clean	NPBWR1	43	30
COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@@H]3CCCC3(C)C)CC2)cc1	ZINC000819166656	GF	On-Demand	Clean	NPBWR1	43	30
COc1ccc(N2CCN(C(=O)/C=C\C(=O)NC[C@H]3CCCC3(C)C)CC2)cc1	ZINC000819166658	GF	On-Demand	Clean	NPBWR1	43	30
COc1ccc(N2CCN(C(=O)/C=C/C(=O)NC[C@@H]3CCCC3(C)C)CC2)cc1	ZINC000819166660	GF	On-Demand	Clean	NPBWR1	43	30
C[C@H](NC(=O)c1cc2c(cn1)OCCO2)c1ccc(N2CCOCC2)cc1	ZINC000819166664	FE	On-Demand	Clean	EPHB4	46	33
C[C@H](NC(=O)c1cc2c(cn1)OCCO2)c1ccc(N2CCOCC2)cc1	ZINC000819166664	FE	On-Demand	Clean	STAT6	51	32
C[C@@H](NC(=O)c1cc2c(cn1)OCCO2)c1ccc(N2CCOCC2)cc1	ZINC000819166666	FE	On-Demand	Clean	EPHB4	46	33
C[C@@H](NC(=O)c1cc2c(cn1)OCCO2)c1ccc(N2CCOCC2)cc1	ZINC000819166666	FE	On-Demand	Clean	STAT6	51	32
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNCCC(=O)Nc2ccccc2)cc1	ZINC000819166668	GI	On-Demand	Anodyne	LTA4H	23	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNCCC(=O)Nc2ccccc2)cc1	ZINC000819166668	GI	On-Demand	Anodyne	PAPA1_CARPA	31	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNCCC(=O)Nc2ccccc2)cc1	ZINC000819166668	GI	On-Demand	Anodyne	CTSK	23	43
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNCCC(=O)Nc2ccccc2)cc1	ZINC000819166668	GI	On-Demand	Anodyne	REN	26	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNCCC(=O)Nc2ccccc2)cc1	ZINC000819166668	GI	On-Demand	Anodyne	FPR1	49	37
COc1cccc([C@H](O)C(=O)NC[C@H]2CCCC2(C)C)c1	ZINC000819166677	CF	On-Demand	Anodyne	MTNR1A	46	39
COc1cccc([C@H](O)C(=O)NC[C@H]2CCCC2(C)C)c1	ZINC000819166677	CF	On-Demand	Anodyne	MTNR1B	43	40
COc1cccc([C@H](O)C(=O)NC[C@@H]2CCCC2(C)C)c1	ZINC000819166679	CF	On-Demand	Anodyne	MTNR1A	46	39
COc1cccc([C@H](O)C(=O)NC[C@@H]2CCCC2(C)C)c1	ZINC000819166679	CF	On-Demand	Anodyne	MTNR1B	43	40
C#CCN1CCC[C@H]1C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819166717	DE	On-Demand	Mild	DRD2	46	37
C#CCN1CCC[C@H]1C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819166717	DE	On-Demand	Mild	FKBP1A	47	38
CC1(C)CCC[C@H]1CNC(=O)C[C@@](C)(O)c1ccccc1	ZINC000819166754	CG	On-Demand	Anodyne	AMY2	48	34
CC1(C)CCC[C@H]1CNC(=O)C[C@](C)(O)c1ccccc1	ZINC000819166756	CG	On-Demand	Anodyne	AMY2	48	34
CC1(C)CCC[C@H]1CNC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	ZINC000819166779	FF	On-Demand	Anodyne	SFRP1	76	34
CC1(C)CCC[C@H]1CNC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	ZINC000819166779	FF	On-Demand	Anodyne	WNT3	46	32
C/C=C(/C=C/C(=O)NCCc1ccc(Cl)c(OC)c1)CC	ZINC000819166797	DH	On-Demand	Anodyne	MTNR1A	17	41
C/C=C(/C=C\C(=O)NCCc1ccc(Cl)c(OC)c1)CC	ZINC000819166798	DH	On-Demand	Anodyne	MTNR1A	17	41
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819166853	FH	On-Demand	Anodyne	PAPA1_CARPA	35	56
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819166854	FH	On-Demand	Anodyne	PAPA1_CARPA	35	56
C=CC(=O)NCc1ccc(C(=O)NCCc2ccc(Cl)c(OC)c2)cc1	ZINC000819166862	FG	On-Demand	Anodyne	TRPV1	15	44
C=CC(=O)NCc1ccc(C(=O)NCCc2ccc(Cl)c(OC)c2)cc1	ZINC000819166862	FG	On-Demand	Anodyne	TGM2	24	53
C=CC(=O)NCc1ccc(C(=O)NCCc2ccc(Cl)c(OC)c2)cc1	ZINC000819166862	FG	On-Demand	Anodyne	MT-ND1	23	42
C=CC(=O)NCc1ccc(C(=O)NCCc2ccc(Cl)c(OC)c2)cc1	ZINC000819166862	FG	On-Demand	Anodyne	RPA1	35	40
CN(CCCC(=O)NC[C@@H]1CCCC1(C)C)C1=NS(=O)(=O)c2ccccc21	ZINC000819166885	GF	On-Demand	Anodyne	KCNA3	37	44
CN(CCCC(=O)NC[C@H]1CCCC1(C)C)C1=NS(=O)(=O)c2ccccc21	ZINC000819166886	GF	On-Demand	Anodyne	KCNA3	37	44
CCn1c(=O)c2ccccc2n(CC(=O)NCCc2ccc(Cl)c(OC)c2)c1=O	ZINC000819166887	HE	On-Demand	Anodyne	MTNR1B	15	40
CCC(=O)Nc1ccccc1C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819166895	FH	On-Demand	Anodyne	DRD4	15	44
CCC(=O)Nc1ccccc1C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819166895	FH	On-Demand	Anodyne	DRD3	18	44
CCC(=O)Nc1ccccc1C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819166895	FH	On-Demand	Anodyne	CNR2	29	40
CCC(=O)Nc1ccccc1C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819166895	FH	On-Demand	Anodyne	RAF1	15	41
CCC(=O)Nc1ccccc1C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819166895	FH	On-Demand	Anodyne	SLC6A5	27	41
CCC(=O)Nc1ccccc1C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819166895	FH	On-Demand	Anodyne	HCAR2	16	42
CCC(=O)Nc1ccccc1C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819166895	FH	On-Demand	Anodyne	ABCG2	23	48
CCC(=O)c1cc(C(=O)NCCc2ccc(Cl)c(OC)c2)ccc1F	ZINC000819166896	FI	On-Demand	Anodyne	PTGDR	26	42
CCC(=O)c1cc(C(=O)NCCc2ccc(Cl)c(OC)c2)ccc1F	ZINC000819166896	FI	On-Demand	Anodyne	PTGDR2	21	42
CC1(C)CCC[C@H]1CNC(=O)c1ccc(Cl)c(S(C)(=O)=O)c1	ZINC000819166904	EG	On-Demand	Anodyne	CACNA1I	50	40
C#CCOc1ccc(C(=O)NCCc2ccc(Cl)c(OC)c2)cc1	ZINC000819166942	EG	On-Demand	Mild	MTNR1A	22	40
C#CCOc1ccc(C(=O)NCCc2ccc(Cl)c(OC)c2)cc1	ZINC000819166942	EG	On-Demand	Mild	MT-ND1	20	41
CCOC(=O)N1CCC[C@H](C(=O)NCCc2ccc(Cl)c(OC)c2)C1	ZINC000819166962	FF	On-Demand	Anodyne	HTR4	60	39
CCOC(=O)N1CCC[C@H](C(=O)NCCc2ccc(Cl)c(OC)c2)C1	ZINC000819166962	FF	On-Demand	Anodyne	GPBAR1	26	47
CCOC(=O)N1CCC[C@@H](C(=O)NCCc2ccc(Cl)c(OC)c2)C1	ZINC000819166963	FF	On-Demand	Anodyne	HTR4	60	39
CCOC(=O)N1CCC[C@@H](C(=O)NCCc2ccc(Cl)c(OC)c2)C1	ZINC000819166963	FF	On-Demand	Anodyne	GPBAR1	26	47
C#Cc1ccccc1CC(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819166966	EG	On-Demand	Mild	TRPV1	15	43
C#Cc1ccccc1CC(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819166966	EG	On-Demand	Mild	MTNR1A	32	40
C#Cc1ccccc1CC(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819166966	EG	On-Demand	Mild	MTNR1B	23	40
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NCCc2ccc(Cl)c(OC)c2)c1	ZINC000819166975	HF	On-Demand	Anodyne	CA2	18	52
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NCCc2ccc(Cl)c(OC)c2)c1	ZINC000819166975	HF	On-Demand	Anodyne	ABCC8	15	47
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NCCc2ccc(Cl)c(OC)c2)c1	ZINC000819166975	HF	On-Demand	Anodyne	CA1	17	52
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NCCc2ccc(Cl)c(OC)c2)c1	ZINC000819166975	HF	On-Demand	Anodyne	PTGDR	25	42
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NCCc2ccc(Cl)c(OC)c2)c1	ZINC000819166975	HF	On-Demand	Anodyne	CA9	23	40
CNS(=O)(=O)c1ccc(Cl)c(C(=O)NCCc2ccc(Cl)c(OC)c2)c1	ZINC000819166975	HF	On-Demand	Anodyne	PTGDR2	20	42
CCCCCCC(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819166993	CH	On-Demand	Anodyne	CNR1	19	60
CCCCCCC(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819166993	CH	On-Demand	Anodyne	INHA	88	39
CCCCCCC(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819166993	CH	On-Demand	Anodyne	TRPV1	18	60
CCCCCCC(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819166993	CH	On-Demand	Anodyne	LPAR2	53	38
CCCCCCC(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819166993	CH	On-Demand	Anodyne	MTNR1A	49	45
CCCCCCC(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819166993	CH	On-Demand	Anodyne	MTNR1B	44	41
CCCCCCC(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819166993	CH	On-Demand	Anodyne	S1PR2	57	38
C#CCNS(=O)(=O)c1cccc(C(=O)NCCc2ccc(Cl)c(OC)c2)c1	ZINC000819167003	HE	On-Demand	Mild	DRD4	44	36
C#CCNS(=O)(=O)c1cccc(C(=O)NCCc2ccc(Cl)c(OC)c2)c1	ZINC000819167003	HE	On-Demand	Mild	PTGDR	18	43
C#CCNS(=O)(=O)c1cccc(C(=O)NCCc2ccc(Cl)c(OC)c2)c1	ZINC000819167003	HE	On-Demand	Mild	PTGDR2	15	41
CC1(C)CCC[C@H]1CNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000819167029	GE	On-Demand	Anodyne	SLC6A9	49	37
CC1(C)CCC[C@H]1CNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000819167029	GE	On-Demand	Anodyne	NAMPT	20	40
CC1(C)CCC[C@H]1CNC(=O)CCCCNC(=O)OCc1ccccc1	ZINC000819167065	FI	On-Demand	Anodyne	PREP	18	45
CC1(C)CCC[C@H]1CNC(=O)CCCCNC(=O)OCc1ccccc1	ZINC000819167065	FI	On-Demand	Anodyne	CAPN1	45	43
CC1(C)CCC[C@H]1CNC(=O)CCCCNC(=O)OCc1ccccc1	ZINC000819167065	FI	On-Demand	Anodyne	CAPN2	73	43
CC1(C)CCC[C@H]1CNC(=O)CCCCNC(=O)OCc1ccccc1	ZINC000819167065	FI	On-Demand	Anodyne	NPR	63	39
CC1(C)CCC[C@H]1CNC(=O)CCCCNC(=O)OCc1ccccc1	ZINC000819167065	FI	On-Demand	Anodyne	SLC12A5	52	36
CCC(=CC(=O)NCCc1ccc(Cl)c(OC)c1)CC	ZINC000819167072	CH	On-Demand	Anodyne	MTNR1A	22	41
CCC(=CC(=O)NCCc1ccc(Cl)c(OC)c1)CC	ZINC000819167072	CH	On-Demand	Anodyne	MTNR1B	19	41
CC1(C)CCC[C@H]1CNC(=O)COc1cccc(C#N)c1	ZINC000819167168	CF	On-Demand	Mild	CHRNA10	20	44
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819167178	FG	On-Demand	Anodyne	PAPA1_CARPA	45	45
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819167178	FG	On-Demand	Anodyne	CTSK	15	41
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819167178	FG	On-Demand	Anodyne	CTSL	18	45
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819167178	FG	On-Demand	Anodyne	CAPN1	16	40
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819167178	FG	On-Demand	Anodyne	CAPN2	44	39
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819167178	FG	On-Demand	Anodyne	FPR1	44	39
COc1ccc(-c2nnc(S)n2CC(=O)NCCc2ccc(Cl)c(OC)c2)cc1	ZINC000819167183	IG	On-Demand	Anodyne	PTGDR	15	40
COc1ccc(-c2nnc(S)n2CC(=O)NCCc2ccc(Cl)c(OC)c2)cc1	ZINC000819167183	IG	On-Demand	Anodyne	PROKR1	60	35
COc1cccc(C(=O)NCCc2ccc(Cl)c(OC)c2)n1	ZINC000819167271	DF	On-Demand	Anodyne	DRD3	17	41
COc1cccc(C(=O)NCCc2ccc(Cl)c(OC)c2)n1	ZINC000819167271	DF	On-Demand	Anodyne	RAF1	19	42
COc1cccc(C(=O)NCCc2ccc(Cl)c(OC)c2)n1	ZINC000819167271	DF	On-Demand	Anodyne	PDE6A	41	31
COc1cccc(C(=O)NCCc2ccc(Cl)c(OC)c2)n1	ZINC000819167271	DF	On-Demand	Anodyne	ALS	51	36
COc1cccc(C(=O)NCCc2ccc(Cl)c(OC)c2)n1	ZINC000819167271	DF	On-Demand	Anodyne	ABCG2	17	42
C/C=C\C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819167277	CF	On-Demand	Anodyne	MTNR1A	21	45
C/C=C\C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819167277	CF	On-Demand	Anodyne	MTNR1B	17	45
C/C=C/C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819167279	CF	On-Demand	Anodyne	MTNR1A	21	45
C/C=C/C(=O)NCCc1ccc(Cl)c(OC)c1	ZINC000819167279	CF	On-Demand	Anodyne	MTNR1B	17	45
C[C@@H](Cn1cncn1)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819167461	DC	On-Demand	Clean	HIS3	57	37
CCOc1cc(CCCN2C(=O)CN(Cc3ccccc3O)C2=O)ccc1OC	ZINC000819167508	GG	On-Demand	Clean	INHA	43	36
O=C1[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)CCN1c1ccccc1Cl	ZINC000819167530	GF	On-Demand	Clean	P2RX7	15	41
O=C1[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)CCN1c1ccccc1Cl	ZINC000819167531	GF	On-Demand	Clean	P2RX7	15	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCC(F)(F)C2)CC1	ZINC000819167627	EF	On-Demand	Anodyne	GPR119	28	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCC(F)(F)C2)CC1	ZINC000819167628	EF	On-Demand	Anodyne	GPR119	28	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCC(F)(F)C2)CC1	ZINC000819167629	EF	On-Demand	Anodyne	GPR119	28	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCC(F)(F)C2)CC1	ZINC000819167630	EF	On-Demand	Anodyne	GPR119	28	45
CC(C)(C)OC(=O)N1CC[C@H](CN2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819167650	GE	On-Demand	Clean	GPR119	31	42
CC(C)(C)OC(=O)N1CC[C@@H](CN2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819167651	GE	On-Demand	Clean	GPR119	31	42
CCNS(=O)(=O)c1ccc(CNCCS(C)(=O)=O)cc1	ZINC000819167662	DC	On-Demand	Anodyne	A6YCJ1_9METZ	17	44
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819167688	FD	On-Demand	Anodyne	ADRB3	53	40
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819167689	FD	On-Demand	Anodyne	ADRB3	53	40
CN(C)CCOc1ccc(CCN2C(=O)CN(Cc3ccccc3O)C2=O)cc1	ZINC000819167700	GE	On-Demand	Clean	LTA4H	19	42
CN(C)CCOc1ccc(CCN2C(=O)CN(Cc3ccccc3O)C2=O)cc1	ZINC000819167700	GE	On-Demand	Clean	ESRRG	47	35
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(F)cn2)CC1	ZINC000819167753	FE	On-Demand	Anodyne	GPR119	67	54
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(F)cn2)CC1	ZINC000819167754	FE	On-Demand	Anodyne	GPR119	67	54
COc1ccccc1N1CC[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819167801	GE	On-Demand	Clean	HTR1A	61	44
COc1ccccc1N1CC[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819167801	GE	On-Demand	Clean	ADRA1D	45	37
COc1ccccc1N1CC[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819167801	GE	On-Demand	Clean	ADRA1A	41	39
COc1ccccc1N1CC[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819167801	GE	On-Demand	Clean	HTR7	42	43
COc1ccccc1N1CC[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819167802	GE	On-Demand	Clean	HTR1A	61	44
COc1ccccc1N1CC[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819167802	GE	On-Demand	Clean	ADRA1D	45	37
COc1ccccc1N1CC[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819167802	GE	On-Demand	Clean	ADRA1A	41	39
COc1ccccc1N1CC[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819167802	GE	On-Demand	Clean	HTR7	42	43
O=C(NCCCN1C(=O)CN(Cc2ccccc2O)C1=O)c1ccc(F)cc1	ZINC000819167856	GE	On-Demand	Clean	DRD3	22	42
O=C(NCCCN1C(=O)CN(Cc2ccccc2O)C1=O)c1ccc(F)cc1	ZINC000819167856	GE	On-Demand	Clean	PLD1	61	41
O=C(NCCCN1C(=O)CN(Cc2ccccc2O)C1=O)c1ccc(F)cc1	ZINC000819167856	GE	On-Demand	Clean	PLD2	77	41
CC(C)[C@H](CN1C(=O)CN(Cc2ccccc2O)C1=O)NC(=O)OC(C)(C)C	ZINC000819167861	GF	On-Demand	Clean	FPR1	43	35
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819167863	FD	On-Demand	Anodyne	ADRB2	27	40
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819167863	FD	On-Demand	Anodyne	ADRB1	30	41
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819167863	FD	On-Demand	Anodyne	ADRB3	97	41
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819167864	FD	On-Demand	Anodyne	ADRB2	27	40
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819167864	FD	On-Demand	Anodyne	ADRB1	30	41
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819167864	FD	On-Demand	Anodyne	ADRB3	97	41
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819167865	GD	On-Demand	Anodyne	ADRB2	15	42
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819167866	GD	On-Demand	Anodyne	ADRB2	15	42
CN(C)CCCOc1ccc(CN2C(=O)CN(Cc3ccccc3O)C2=O)cc1	ZINC000819167889	GF	On-Demand	Clean	HRH3	15	49
CN(C)CCCOc1ccc(CN2C(=O)CN(Cc3ccccc3O)C2=O)cc1	ZINC000819167889	GF	On-Demand	Clean	ESRRG	45	34
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2ccc(F)cc2C)cc1	ZINC000819167895	FE	On-Demand	Anodyne	LEF	56	36
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2ccc(F)cc2C)cc1	ZINC000819167896	FE	On-Demand	Anodyne	LEF	56	36
C[C@H]1CN(Cc2ccccc2)CC[C@H]1N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819167931	GG	On-Demand	Clean	ACHE	25	40
C[C@H]1CN(Cc2ccccc2)CC[C@H]1N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819167931	GG	On-Demand	Clean	SIGMAR1	40	44
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819167933	GG	On-Demand	Clean	ACHE	25	40
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819167933	GG	On-Demand	Clean	SIGMAR1	40	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819167934	GG	On-Demand	Clean	ACHE	25	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819167934	GG	On-Demand	Clean	SIGMAR1	40	44
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819167935	GG	On-Demand	Clean	ACHE	25	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819167935	GG	On-Demand	Clean	SIGMAR1	40	44
CC(=O)Nc1cccc(OCCN2C(=O)CN(Cc3ccccc3O)C2=O)c1	ZINC000819168047	GE	On-Demand	Clean	EPHX2	18	41
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2ccc(C)cc2)cc1	ZINC000819168058	EE	On-Demand	Anodyne	ADRB2	17	41
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2ccc(C)cc2)cc1	ZINC000819168058	EE	On-Demand	Anodyne	ADRB3	61	37
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2ccc(C)cc2)cc1	ZINC000819168059	EE	On-Demand	Anodyne	ADRB2	17	41
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2ccc(C)cc2)cc1	ZINC000819168059	EE	On-Demand	Anodyne	ADRB3	61	37
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819168077	FE	On-Demand	Anodyne	ADRB2	38	42
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819168077	FE	On-Demand	Anodyne	ADRB1	54	46
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819168077	FE	On-Demand	Anodyne	ADRB3	119	46
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819168078	FE	On-Demand	Anodyne	ADRB2	38	42
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819168078	FE	On-Demand	Anodyne	ADRB1	54	46
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819168078	FE	On-Demand	Anodyne	ADRB3	119	46
COc1ccccc1N1CC[C@H](CN2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819168108	GF	On-Demand	Clean	HTR1A	57	41
COc1ccccc1N1CC[C@H](CN2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819168108	GF	On-Demand	Clean	DRD2	32	41
COc1ccccc1N1CC[C@H](CN2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819168108	GF	On-Demand	Clean	ADRA1D	43	37
COc1ccccc1N1CC[C@H](CN2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819168108	GF	On-Demand	Clean	HTR7	37	44
COc1ccccc1N1CC[C@@H](CN2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819168109	GF	On-Demand	Clean	HTR1A	57	41
COc1ccccc1N1CC[C@@H](CN2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819168109	GF	On-Demand	Clean	DRD2	32	41
COc1ccccc1N1CC[C@@H](CN2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819168109	GF	On-Demand	Clean	ADRA1D	43	37
COc1ccccc1N1CC[C@@H](CN2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819168109	GF	On-Demand	Clean	HTR7	37	44
C[C@@H](Cc1ccc(Cl)cc1Cl)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819168116	GI	On-Demand	Clean	P2RX7	28	40
COc1cccc(OCCCN2C(=O)CN(Cc3ccccc3O)C2=O)c1	ZINC000819168156	FF	On-Demand	Clean	HRH3	16	45
NC(=O)[C@H]1CCCN(CCCN2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819168233	FC	On-Demand	Clean	SLC6A1	150	44
NC(=O)[C@@H]1CCCN(CCCN2C(=O)CN(Cc3ccccc3O)C2=O)C1	ZINC000819168234	FC	On-Demand	Clean	SLC6A1	150	44
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819168247	ED	On-Demand	Anodyne	ADRB2	33	50
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819168247	ED	On-Demand	Anodyne	ADRB1	34	50
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819168247	ED	On-Demand	Anodyne	ADRB3	132	56
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819168247	ED	On-Demand	Anodyne	TBXA2R	17	42
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819168247	ED	On-Demand	Anodyne	TBXAS1	46	41
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819168247	ED	On-Demand	Anodyne	NAMPT	45	44
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819168248	ED	On-Demand	Anodyne	ADRB2	33	50
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819168248	ED	On-Demand	Anodyne	ADRB1	34	50
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819168248	ED	On-Demand	Anodyne	ADRB3	132	56
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819168248	ED	On-Demand	Anodyne	TBXA2R	17	42
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819168248	ED	On-Demand	Anodyne	TBXAS1	46	41
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819168248	ED	On-Demand	Anodyne	NAMPT	45	44
O=C(Cc1cccc(F)c1)NCCN1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819168290	GD	On-Demand	Clean	PLD2	40	36
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819168291	FF	On-Demand	Anodyne	ADRB3	22	40
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819168291	FF	On-Demand	Anodyne	ALOX15	29	43
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819168315	FE	On-Demand	Anodyne	ADRB3	46	38
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819168316	FE	On-Demand	Anodyne	ADRB3	46	38
CCCOc1cccc(CCN2C(=O)CN(Cc3ccccc3O)C2=O)c1	ZINC000819168371	FG	On-Demand	Clean	UPP1	53	40
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819168440	GD	On-Demand	Bother	ADRB3	68	35
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819168441	GD	On-Demand	Bother	ADRB3	68	35
COCCCOc1cccc(CN2C(=O)CN(Cc3ccccc3O)C2=O)c1	ZINC000819168516	GF	On-Demand	Clean	UPP1	49	32
O[C@H](CN[C@@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819168532	BD	On-Demand	Anodyne	ADRB1	19	40
O[C@H](CN[C@@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819168532	BD	On-Demand	Anodyne	ADRB3	64	47
O[C@H](CN[C@@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819168532	BD	On-Demand	Anodyne	C3AR1	20	40
O[C@@H](CN[C@@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819168534	BD	On-Demand	Anodyne	ADRB1	19	40
O[C@@H](CN[C@@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819168534	BD	On-Demand	Anodyne	ADRB3	64	47
O[C@@H](CN[C@@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819168534	BD	On-Demand	Anodyne	C3AR1	20	40
CCNS(=O)(=O)c1ccc(CNCCS(=O)(=O)CC)cc1	ZINC000819168535	EC	On-Demand	Anodyne	A6YCJ1_9METZ	16	42
O[C@@H](CN[C@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819168536	BD	On-Demand	Anodyne	ADRB1	19	40
O[C@@H](CN[C@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819168536	BD	On-Demand	Anodyne	ADRB3	64	47
O[C@@H](CN[C@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819168536	BD	On-Demand	Anodyne	C3AR1	20	40
O[C@H](CN[C@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819168538	BD	On-Demand	Anodyne	ADRB1	19	40
O[C@H](CN[C@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819168538	BD	On-Demand	Anodyne	ADRB3	64	47
O[C@H](CN[C@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819168538	BD	On-Demand	Anodyne	C3AR1	20	40
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(F)cn2)cc1	ZINC000819168566	DD	On-Demand	Anodyne	PTGS2	34	41
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(F)cn2)cc1	ZINC000819168567	DD	On-Demand	Anodyne	PTGS2	34	41
COc1cccc(O[C@@H](C)CN2C(=O)CN(Cc3ccccc3O)C2=O)c1	ZINC000819168616	FF	On-Demand	Clean	MTNR1A	23	44
COc1cccc(O[C@@H](C)CN2C(=O)CN(Cc3ccccc3O)C2=O)c1	ZINC000819168616	FF	On-Demand	Clean	MTNR1B	24	44
COc1cccc(O[C@H](C)CN2C(=O)CN(Cc3ccccc3O)C2=O)c1	ZINC000819168617	FF	On-Demand	Clean	MTNR1A	23	44
COc1cccc(O[C@H](C)CN2C(=O)CN(Cc3ccccc3O)C2=O)c1	ZINC000819168617	FF	On-Demand	Clean	MTNR1B	24	44
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819168668	FE	On-Demand	Anodyne	LEF	52	36
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819168669	FE	On-Demand	Anodyne	LEF	52	36
CN1[C@H]2CC[C@H]1CC(N1C(=O)CN(Cc3ccccc3O)C1=O)C2	ZINC000819168732	ED	On-Demand	Clean	GLRA1	43	33
O=C1[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)CCN1Cc1ccccc1	ZINC000819168733	GD	On-Demand	Clean	SIGMAR1	17	40
O=C1[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)CCN1Cc1ccccc1	ZINC000819168735	GD	On-Demand	Clean	SIGMAR1	17	40
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819168749	FE	On-Demand	Anodyne	ADRB3	53	44
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819168749	FE	On-Demand	Anodyne	TBXA2R	46	38
COc1ccccc1N1CCC(N2C(=O)CN(Cc3ccccc3O)C2=O)CC1	ZINC000819168751	GF	On-Demand	Clean	HTR1A	85	50
COc1ccccc1N1CCC(N2C(=O)CN(Cc3ccccc3O)C2=O)CC1	ZINC000819168751	GF	On-Demand	Clean	DRD2	58	41
COc1ccccc1N1CCC(N2C(=O)CN(Cc3ccccc3O)C2=O)CC1	ZINC000819168751	GF	On-Demand	Clean	DRD1	15	41
COc1ccccc1N1CCC(N2C(=O)CN(Cc3ccccc3O)C2=O)CC1	ZINC000819168751	GF	On-Demand	Clean	ADRA1D	71	40
COc1ccccc1N1CCC(N2C(=O)CN(Cc3ccccc3O)C2=O)CC1	ZINC000819168751	GF	On-Demand	Clean	HTR2A	19	41
COc1ccccc1N1CCC(N2C(=O)CN(Cc3ccccc3O)C2=O)CC1	ZINC000819168751	GF	On-Demand	Clean	ADRA1A	65	42
COc1ccccc1N1CCC(N2C(=O)CN(Cc3ccccc3O)C2=O)CC1	ZINC000819168751	GF	On-Demand	Clean	ADRA1B	57	42
COc1ccccc1N1CCC(N2C(=O)CN(Cc3ccccc3O)C2=O)CC1	ZINC000819168751	GF	On-Demand	Clean	DRD3	55	41
COc1ccccc1N1CCC(N2C(=O)CN(Cc3ccccc3O)C2=O)CC1	ZINC000819168751	GF	On-Demand	Clean	HTR7	52	47
O[C@@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccc(Cl)c(F)c1	ZINC000819168758	DE	On-Demand	Anodyne	ADRB3	22	46
O[C@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccc(Cl)c(F)c1	ZINC000819168760	DE	On-Demand	Anodyne	ADRB3	22	46
O[C@@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccc(Cl)c(F)c1	ZINC000819168762	DE	On-Demand	Anodyne	ADRB3	22	46
O[C@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccc(Cl)c(F)c1	ZINC000819168764	DE	On-Demand	Anodyne	ADRB3	22	46
CCCCN1CCCC[C@H]1CN1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819168765	FF	On-Demand	Clean	HRH1	17	41
CCCCN1CCCC[C@@H]1CN1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819168767	FF	On-Demand	Clean	HRH1	17	41
O[C@H](CN[C@H]1CCc2n[nH]cc2C1)c1cccc(Cl)c1	ZINC000819168814	CE	On-Demand	Anodyne	ADRB1	32	57
O[C@H](CN[C@H]1CCc2n[nH]cc2C1)c1cccc(Cl)c1	ZINC000819168814	CE	On-Demand	Anodyne	ADRB3	53	58
O[C@H](CN[C@H]1CCc2n[nH]cc2C1)c1cccc(Cl)c1	ZINC000819168814	CE	On-Demand	Anodyne	CYP3A4	45	35
O[C@@H](CN[C@@H]1CCc2n[nH]cc2C1)c1cccc(Cl)c1	ZINC000819168817	CE	On-Demand	Anodyne	ADRB1	32	57
O[C@@H](CN[C@@H]1CCc2n[nH]cc2C1)c1cccc(Cl)c1	ZINC000819168817	CE	On-Demand	Anodyne	ADRB3	53	58
O[C@@H](CN[C@@H]1CCc2n[nH]cc2C1)c1cccc(Cl)c1	ZINC000819168817	CE	On-Demand	Anodyne	CYP3A4	45	35
O[C@H](CN[C@@H]1CCc2n[nH]cc2C1)c1cccc(Cl)c1	ZINC000819168820	CE	On-Demand	Anodyne	ADRB1	32	57
O[C@H](CN[C@@H]1CCc2n[nH]cc2C1)c1cccc(Cl)c1	ZINC000819168820	CE	On-Demand	Anodyne	ADRB3	53	58
O[C@H](CN[C@@H]1CCc2n[nH]cc2C1)c1cccc(Cl)c1	ZINC000819168820	CE	On-Demand	Anodyne	CYP3A4	45	35
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819168861	ED	On-Demand	Anodyne	ADRB2	33	41
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819168861	ED	On-Demand	Anodyne	ADRB1	35	40
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819168861	ED	On-Demand	Anodyne	ADRB3	106	42
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819168863	ED	On-Demand	Anodyne	ADRB2	33	41
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819168863	ED	On-Demand	Anodyne	ADRB1	35	40
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819168863	ED	On-Demand	Anodyne	ADRB3	106	42
C[C@H](CCNC(=O)OC(C)(C)C)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819168908	GE	On-Demand	Clean	FPR1	42	33
C[C@@H](CCNC(=O)OC(C)(C)C)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819168909	GE	On-Demand	Clean	FPR1	42	33
O[C@@H](CN[C@H]1CCc2n[nH]cc2C1)c1cccc(Cl)c1	ZINC000819168932	CE	On-Demand	Anodyne	ADRB1	32	57
O[C@@H](CN[C@H]1CCc2n[nH]cc2C1)c1cccc(Cl)c1	ZINC000819168932	CE	On-Demand	Anodyne	ADRB3	53	58
O[C@@H](CN[C@H]1CCc2n[nH]cc2C1)c1cccc(Cl)c1	ZINC000819168932	CE	On-Demand	Anodyne	CYP3A4	45	35
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCc3n[nH]cc3C2)CC1	ZINC000819168933	FD	On-Demand	Anodyne	GPR119	35	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCc3n[nH]cc3C2)CC1	ZINC000819168934	FD	On-Demand	Anodyne	GPR119	35	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCc3n[nH]cc3C2)CC1	ZINC000819168935	FD	On-Demand	Anodyne	GPR119	35	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCc3n[nH]cc3C2)CC1	ZINC000819168936	FD	On-Demand	Anodyne	GPR119	35	40
O[C@H](CN[C@H]1CCc2n[nH]cc2C1)c1cccc(F)c1	ZINC000819168947	CD	On-Demand	Anodyne	ADRB3	22	44
O[C@@H](CN[C@@H]1CCc2n[nH]cc2C1)c1cccc(F)c1	ZINC000819168948	CD	On-Demand	Anodyne	ADRB3	22	44
O[C@H](CN[C@@H]1CCc2n[nH]cc2C1)c1cccc(F)c1	ZINC000819168949	CD	On-Demand	Anodyne	ADRB3	22	44
O[C@@H](CN[C@H]1CCc2n[nH]cc2C1)c1cccc(F)c1	ZINC000819168950	CD	On-Demand	Anodyne	ADRB3	22	44
O[C@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccc(Br)cc1	ZINC000819168955	EE	On-Demand	Anodyne	ADRB3	19	42
O[C@@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccc(Br)cc1	ZINC000819168956	EE	On-Demand	Anodyne	ADRB3	19	42
O[C@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccc(Br)cc1	ZINC000819168957	EE	On-Demand	Anodyne	ADRB3	19	42
O[C@@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccc(Br)cc1	ZINC000819168958	EE	On-Demand	Anodyne	ADRB3	19	42
O[C@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccccc1	ZINC000819168990	CD	On-Demand	Anodyne	ADRB3	24	44
O[C@@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccccc1	ZINC000819168992	CD	On-Demand	Anodyne	ADRB3	24	44
O[C@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccccc1	ZINC000819168994	CD	On-Demand	Anodyne	ADRB3	24	44
O[C@@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccccc1	ZINC000819168995	CD	On-Demand	Anodyne	ADRB3	24	44
CCNS(=O)(=O)c1ccc(CNC[C@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819169009	FE	On-Demand	Anodyne	ADRB3	40	35
CCNS(=O)(=O)c1ccc(CNC[C@@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819169012	FE	On-Demand	Anodyne	ADRB3	40	35
CCOc1cc(CN2C(=O)CN(Cc3ccccc3O)C2=O)ccc1OC	ZINC000819169013	FF	On-Demand	Clean	SSTR5	44	39
O=C(NCCCN1C(=O)CN(Cc2ccccc2O)C1=O)c1cccc(F)c1	ZINC000819169024	GE	On-Demand	Clean	DRD4	41	32
O=C(NCCCN1C(=O)CN(Cc2ccccc2O)C1=O)c1cccc(F)c1	ZINC000819169024	GE	On-Demand	Clean	PLD2	58	40
CN1CCC(N2CCC(N3C(=O)CN(Cc4ccccc4O)C3=O)CC2)CC1	ZINC000819169175	GD	On-Demand	Clean	OPRL1	23	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(F)cn1	ZINC000819169329	GF	On-Demand	Anodyne	CTSD	97	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(F)cn1	ZINC000819169329	GF	On-Demand	Anodyne	PGC	56	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(F)cn1	ZINC000819169329	GF	On-Demand	Anodyne	PAPA1_CARPA	30	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(F)cn1	ZINC000819169329	GF	On-Demand	Anodyne	REN	79	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(F)cn1	ZINC000819169329	GF	On-Demand	Anodyne	REN1	23	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(F)cn1	ZINC000819169329	GF	On-Demand	Anodyne	BACE1	98	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(F)cn1	ZINC000819169329	GF	On-Demand	Anodyne	FPR1	47	38
CC[C@@H]1CN(S(C)(=O)=O)CC[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819169367	EC	On-Demand	Anodyne	ADRB3	72	47
CC[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1NC[C@H](O)c1cccnc1	ZINC000819169368	EC	On-Demand	Anodyne	ADRB3	72	47
CC[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1NC[C@@H](O)c1cccnc1	ZINC000819169369	EC	On-Demand	Anodyne	ADRB3	72	47
CC[C@@H]1CN(S(C)(=O)=O)CC[C@H]1NC[C@H](O)c1cccnc1	ZINC000819169370	EC	On-Demand	Anodyne	ADRB3	72	47
O[C@H](CN[C@H]1CCc2n[nH]cc2C1)c1cccnc1	ZINC000819169422	CC	On-Demand	Anodyne	ADRB1	20	41
O[C@H](CN[C@H]1CCc2n[nH]cc2C1)c1cccnc1	ZINC000819169422	CC	On-Demand	Anodyne	ADRB3	52	56
O[C@@H](CN[C@H]1CCc2n[nH]cc2C1)c1cccnc1	ZINC000819169423	CC	On-Demand	Anodyne	ADRB1	20	41
O[C@@H](CN[C@H]1CCc2n[nH]cc2C1)c1cccnc1	ZINC000819169423	CC	On-Demand	Anodyne	ADRB3	52	56
O[C@@H](CN[C@@H]1CCc2n[nH]cc2C1)c1cccnc1	ZINC000819169424	CC	On-Demand	Anodyne	ADRB1	20	41
O[C@@H](CN[C@@H]1CCc2n[nH]cc2C1)c1cccnc1	ZINC000819169424	CC	On-Demand	Anodyne	ADRB3	52	56
O[C@H](CN[C@@H]1CCc2n[nH]cc2C1)c1cccnc1	ZINC000819169425	CC	On-Demand	Anodyne	ADRB1	20	41
O[C@H](CN[C@@H]1CCc2n[nH]cc2C1)c1cccnc1	ZINC000819169425	CC	On-Demand	Anodyne	ADRB3	52	56
O[C@@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccccc1Cl	ZINC000819169426	CE	On-Demand	Anodyne	ADRB3	19	40
O[C@@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccccc1Cl	ZINC000819169427	CE	On-Demand	Anodyne	ADRB3	19	40
O[C@@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccc(F)c(Br)c1	ZINC000819169431	FE	On-Demand	Anodyne	ADRB3	20	44
O[C@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccc(F)c(Br)c1	ZINC000819169432	FE	On-Demand	Anodyne	ADRB3	20	44
O[C@@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccc(F)c(Br)c1	ZINC000819169433	FE	On-Demand	Anodyne	ADRB3	20	44
O[C@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccc(F)c(Br)c1	ZINC000819169434	FE	On-Demand	Anodyne	ADRB3	20	44
O[C@H](CN[C@H]1CCc2n[nH]cc2C1)c1cccc(Br)c1	ZINC000819169436	EE	On-Demand	Anodyne	ADRB3	21	45
O[C@@H](CN[C@@H]1CCc2n[nH]cc2C1)c1cccc(Br)c1	ZINC000819169437	EE	On-Demand	Anodyne	ADRB3	21	45
O[C@H](CN[C@@H]1CCc2n[nH]cc2C1)c1cccc(Br)c1	ZINC000819169438	EE	On-Demand	Anodyne	ADRB3	21	45
O[C@@H](CN[C@H]1CCc2n[nH]cc2C1)c1cccc(Br)c1	ZINC000819169439	EE	On-Demand	Anodyne	ADRB3	21	45
C[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819169461	GE	On-Demand	Clean	FPR1	44	36
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819169463	GE	On-Demand	Clean	FPR1	44	36
O[C@@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccc(Cl)cc1	ZINC000819169494	CE	On-Demand	Anodyne	ADRB3	23	52
O[C@@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccc(Cl)cc1	ZINC000819169495	CE	On-Demand	Anodyne	ADRB3	23	52
O[C@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccc(C(F)(F)F)cc1	ZINC000819169510	EF	On-Demand	Anodyne	ADRB3	20	56
O[C@@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccc(C(F)(F)F)cc1	ZINC000819169511	EF	On-Demand	Anodyne	ADRB3	20	56
O[C@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccc(C(F)(F)F)cc1	ZINC000819169512	EF	On-Demand	Anodyne	ADRB3	20	56
O[C@@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccc(C(F)(F)F)cc1	ZINC000819169513	EF	On-Demand	Anodyne	ADRB3	20	56
N#Cc1ccc([C@H](O)CN[C@@H]2CCc3n[nH]cc3C2)cc1	ZINC000819169540	CD	On-Demand	Mild	ADRB3	19	40
N#Cc1ccc([C@H](O)CN[C@H]2CCc3n[nH]cc3C2)cc1	ZINC000819169541	CD	On-Demand	Mild	ADRB3	19	40
N#Cc1ccc([C@@H](O)CN[C@H]2CCc3n[nH]cc3C2)cc1	ZINC000819169542	CD	On-Demand	Mild	ADRB3	19	40
N#Cc1ccc([C@@H](O)CN[C@@H]2CCc3n[nH]cc3C2)cc1	ZINC000819169543	CD	On-Demand	Mild	ADRB3	19	40
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCc3n[nH]cc3C2)cc1	ZINC000819169583	DD	On-Demand	Bother	ADRB3	19	43
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCc3n[nH]cc3C2)cc1	ZINC000819169584	DD	On-Demand	Bother	ADRB3	19	43
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCc3n[nH]cc3C2)cc1	ZINC000819169585	DD	On-Demand	Bother	ADRB3	19	43
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCc3n[nH]cc3C2)cc1	ZINC000819169586	DD	On-Demand	Bother	ADRB3	19	43
O[C@H](CN[C@H]1CCc2n[nH]cc2C1)c1cccc(C(F)(F)F)c1	ZINC000819169587	EF	On-Demand	Anodyne	ADRB3	21	46
O[C@@H](CN[C@@H]1CCc2n[nH]cc2C1)c1cccc(C(F)(F)F)c1	ZINC000819169588	EF	On-Demand	Anodyne	ADRB3	21	46
O[C@H](CN[C@@H]1CCc2n[nH]cc2C1)c1cccc(C(F)(F)F)c1	ZINC000819169589	EF	On-Demand	Anodyne	ADRB3	21	46
O[C@@H](CN[C@H]1CCc2n[nH]cc2C1)c1cccc(C(F)(F)F)c1	ZINC000819169590	EF	On-Demand	Anodyne	ADRB3	21	46
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCc3n[nH]cc3C2)c1	ZINC000819169607	DD	On-Demand	Bother	ADRB3	21	47
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCc3n[nH]cc3C2)c1	ZINC000819169608	DD	On-Demand	Bother	ADRB3	21	47
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCc3n[nH]cc3C2)c1	ZINC000819169609	DD	On-Demand	Bother	ADRB3	21	47
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCc3n[nH]cc3C2)c1	ZINC000819169611	DD	On-Demand	Bother	ADRB3	21	47
C[C@H](Cc1ccccc1C(F)(F)F)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819169643	GH	On-Demand	Clean	SLC16A1	49	30
C[C@@H](Cc1ccccc1C(F)(F)F)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819169645	GH	On-Demand	Clean	SLC16A1	49	30
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCc3n[nH]cc3C2)cc1	ZINC000819169737	EC	On-Demand	Anodyne	ADRB3	24	43
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCc3n[nH]cc3C2)cc1	ZINC000819169738	EC	On-Demand	Anodyne	ADRB3	24	43
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCc3n[nH]cc3C2)cc1	ZINC000819169739	EC	On-Demand	Anodyne	ADRB3	24	43
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCc3n[nH]cc3C2)cc1	ZINC000819169740	EC	On-Demand	Anodyne	ADRB3	24	43
O[C@@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccc(Cl)cc1Cl	ZINC000819169764	EF	On-Demand	Anodyne	ADRB3	21	42
O[C@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccc(Cl)cc1Cl	ZINC000819169765	EF	On-Demand	Anodyne	ADRB3	21	42
O[C@@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccc(Cl)cc1Cl	ZINC000819169766	EF	On-Demand	Anodyne	ADRB3	21	42
O[C@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccc(Cl)cc1Cl	ZINC000819169767	EF	On-Demand	Anodyne	ADRB3	21	42
CC[C@@H]1CN(S(=O)(=O)C(C)C)CC[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819169776	FD	On-Demand	Anodyne	ADRB3	68	45
CC[C@@H]1CN(S(=O)(=O)C(C)C)CC[C@@H]1NC[C@@H](O)c1cccnc1	ZINC000819169777	FD	On-Demand	Anodyne	ADRB3	68	45
CC[C@@H]1CN(S(=O)(=O)C(C)C)CC[C@H]1NC[C@H](O)c1cccnc1	ZINC000819169778	FD	On-Demand	Anodyne	ADRB3	68	45
CC[C@@H]1CN(S(=O)(=O)C(C)C)CC[C@@H]1NC[C@H](O)c1cccnc1	ZINC000819169779	FD	On-Demand	Anodyne	ADRB3	68	45
O[C@@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccc(OC(F)(F)F)cc1	ZINC000819169790	EE	On-Demand	Anodyne	ADRB3	21	43
O[C@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccc(OC(F)(F)F)cc1	ZINC000819169791	EE	On-Demand	Anodyne	ADRB3	21	43
O[C@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccc(OC(F)(F)F)cc1	ZINC000819169792	EE	On-Demand	Anodyne	ADRB3	21	43
O[C@@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccc(OC(F)(F)F)cc1	ZINC000819169793	EE	On-Demand	Anodyne	ADRB3	21	43
O[C@@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccc(F)c(F)c1	ZINC000819169807	CD	On-Demand	Anodyne	ADRB3	21	46
O[C@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccc(F)c(F)c1	ZINC000819169808	CD	On-Demand	Anodyne	ADRB3	21	46
O[C@@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccc(F)c(F)c1	ZINC000819169809	CD	On-Demand	Anodyne	ADRB3	21	46
O[C@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccc(F)c(F)c1	ZINC000819169810	CD	On-Demand	Anodyne	ADRB3	21	46
C[C@H]1CCCCN1C(=O)[C@H](C)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819169884	FD	On-Demand	Clean	ACE	38	40
C[C@H]1CCCCN1C(=O)[C@H](C)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819169884	FD	On-Demand	Clean	MME	17	40
C[C@@H](C(=O)N1CCCC[C@H]1C)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819169885	FD	On-Demand	Clean	ACE	38	40
C[C@@H](C(=O)N1CCCC[C@H]1C)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819169885	FD	On-Demand	Clean	MME	17	40
C[C@H]1CCCCN1C(=O)[C@@H](C)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819169886	FD	On-Demand	Clean	ACE	38	40
C[C@H]1CCCCN1C(=O)[C@@H](C)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819169886	FD	On-Demand	Clean	MME	17	40
C[C@@H]1CCCCN1C(=O)[C@@H](C)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819169887	FD	On-Demand	Clean	ACE	38	40
C[C@@H]1CCCCN1C(=O)[C@@H](C)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819169887	FD	On-Demand	Clean	MME	17	40
OCCC[C@H](NC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819169938	CE	On-Demand	Anodyne	ADRB2	15	40
OCCC[C@H](NC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819169938	CE	On-Demand	Anodyne	ADRB1	20	48
OCCC[C@H](NC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819169938	CE	On-Demand	Anodyne	ADRB3	67	48
OCCC[C@H](NC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819169940	CE	On-Demand	Anodyne	ADRB2	15	40
OCCC[C@H](NC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819169940	CE	On-Demand	Anodyne	ADRB1	20	48
OCCC[C@H](NC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819169940	CE	On-Demand	Anodyne	ADRB3	67	48
C[C@@H](CCCNC(=O)OC(C)(C)C)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819170016	GF	On-Demand	Clean	FPR1	40	35
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H](CCCO)c2ccccc2)CC1	ZINC000819170087	GG	On-Demand	Anodyne	GPR119	36	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H](CCCO)c2ccccc2)CC1	ZINC000819170088	GG	On-Demand	Anodyne	GPR119	36	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H](CCCO)c2ccccc2)CC1	ZINC000819170089	GG	On-Demand	Anodyne	GPR119	36	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H](CCCO)c2ccccc2)CC1	ZINC000819170090	GG	On-Demand	Anodyne	GPR119	36	46
O[C@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccc(F)cc1	ZINC000819170128	CD	On-Demand	Anodyne	ADRB3	20	44
O[C@@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccc(F)cc1	ZINC000819170129	CD	On-Demand	Anodyne	ADRB3	20	44
O[C@H](CN[C@@H]1CCc2n[nH]cc2C1)c1ccc(F)cc1	ZINC000819170130	CD	On-Demand	Anodyne	ADRB3	20	44
O[C@@H](CN[C@H]1CCc2n[nH]cc2C1)c1ccc(F)cc1	ZINC000819170131	CD	On-Demand	Anodyne	ADRB3	20	44
O=C(Cn1cc(C(=O)N2CCC(C(=O)O)CC2)cn1)NC1CCCC1	ZINC000819170357	EC	On-Demand	Anodyne	EPHX2	18	48
O=C(Cn1cc(C(=O)N2CCC(C(=O)O)CC2)cn1)NC1CCCC1	ZINC000819170357	EC	On-Demand	Anodyne	L3MBTL3	66	36
O=C(Cc1csc(NC(=O)c2ccccc2)n1)NC1(C(=O)O)CCCCC1	ZINC000819170362	GF	On-Demand	Anodyne	CPT1A	28	40
O=C(Cn1ccc(=O)c2ccccc21)OCc1ccc(C(=O)O)cc1	ZINC000819170380	EE	On-Demand	Anodyne	FABI	51	34
O=C(Cn1ccc(=O)c2ccccc21)OCc1ccc(C(=O)O)cc1	ZINC000819170380	EE	On-Demand	Anodyne	SLC12A5	49	33
O=C(Cn1c(=O)nc(O)c2ccccc21)NCc1ccc(C(=O)O)cc1	ZINC000819170385	FD	On-Demand	Anodyne	F2	22	42
O=C(Cn1c(=O)nc(O)c2ccccc21)NCc1ccc(C(=O)O)cc1	ZINC000819170385	FD	On-Demand	Anodyne	FABI	48	34
O=C(Cn1c(=O)cnc2ccccc21)N[C@H](C(=O)O)c1ccccc1	ZINC000819170386	ED	On-Demand	Anodyne	NAALAD2	19	40
O=C(NC1(C(=O)O)CCCC1)c1ccc(F)cc1C(F)(F)F	ZINC000819170399	DF	On-Demand	Anodyne	NTSR2	15	40
O=C(Cc1nnc(O)c2ccccc12)OCc1ccc(C(=O)O)cc1	ZINC000819170408	EE	On-Demand	Anodyne	SLC12A5	54	32
O=C(Cn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170411	GD	On-Demand	Anodyne	ACE	74	45
O=C(Cn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170411	GD	On-Demand	Anodyne	MME	113	45
O=C(Cn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170411	GD	On-Demand	Anodyne	ANPEP	50	34
O=C(Cn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170411	GD	On-Demand	Anodyne	CTSD	34	41
O=C(Cn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170411	GD	On-Demand	Anodyne	CTSB	25	46
O=C(Cn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170411	GD	On-Demand	Anodyne	CYSP_TRYCR	45	37
O=C(Cn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170411	GD	On-Demand	Anodyne	BACE2	35	42
O=C(Cn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170411	GD	On-Demand	Anodyne	NPFFR2	51	36
O=C(Cn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170411	GD	On-Demand	Anodyne	ITGA4	41	40
O=C(Cn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170411	GD	On-Demand	Anodyne	ECE1	42	37
O=C(Cn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170411	GD	On-Demand	Anodyne	REN	68	34
O=C(Cn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170411	GD	On-Demand	Anodyne	CAPN1	38	41
O=C(Cn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170411	GD	On-Demand	Anodyne	ACE2	90	45
O=C(Cn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170411	GD	On-Demand	Anodyne	BACE1	31	41
O=C(Cn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170411	GD	On-Demand	Anodyne	FPR1	74	38
O=C(Cn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170411	GD	On-Demand	Anodyne	BLA1_STEMA	81	42
O=C(Cn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170411	GD	On-Demand	Anodyne	BRCA1	55	34
O=C(Cn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170411	GD	On-Demand	Anodyne	NPFFR1	53	36
O=C(Cn1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170412	GD	On-Demand	Anodyne	ACE	74	45
O=C(Cn1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170412	GD	On-Demand	Anodyne	MME	113	45
O=C(Cn1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170412	GD	On-Demand	Anodyne	ANPEP	50	34
O=C(Cn1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170412	GD	On-Demand	Anodyne	CTSD	34	41
O=C(Cn1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170412	GD	On-Demand	Anodyne	CTSB	25	46
O=C(Cn1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170412	GD	On-Demand	Anodyne	CYSP_TRYCR	45	37
O=C(Cn1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170412	GD	On-Demand	Anodyne	BACE2	35	42
O=C(Cn1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170412	GD	On-Demand	Anodyne	NPFFR2	51	36
O=C(Cn1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170412	GD	On-Demand	Anodyne	ITGA4	41	40
O=C(Cn1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170412	GD	On-Demand	Anodyne	ECE1	42	37
O=C(Cn1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170412	GD	On-Demand	Anodyne	REN	68	34
O=C(Cn1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170412	GD	On-Demand	Anodyne	CAPN1	38	41
O=C(Cn1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170412	GD	On-Demand	Anodyne	ACE2	90	45
O=C(Cn1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170412	GD	On-Demand	Anodyne	BACE1	31	41
O=C(Cn1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170412	GD	On-Demand	Anodyne	FPR1	74	38
O=C(Cn1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170412	GD	On-Demand	Anodyne	BLA1_STEMA	81	42
O=C(Cn1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170412	GD	On-Demand	Anodyne	BRCA1	55	34
O=C(Cn1cc(C(=O)N[C@H](Cc2ccccc2)C(=O)O)cn1)NC1CCCC1	ZINC000819170412	GD	On-Demand	Anodyne	NPFFR1	53	36
O=C(Cn1nc(-c2ccccc2)oc1=O)N[C@H](C(=O)O)c1ccccc1	ZINC000819170416	FD	On-Demand	Anodyne	NAALAD2	20	42
O=C(NC1(C(=O)O)CCCC1)C1(Cc2ccccc2)CC1	ZINC000819170420	CF	On-Demand	Anodyne	SLC12A5	44	35
O=C(Cc1nnc(O)c2ccccc12)NCc1ccc(C(=O)O)cc1	ZINC000819170425	ED	On-Demand	Anodyne	CA5B	17	44
O=C(Cc1nnc(O)c2ccccc12)NCc1ccc(C(=O)O)cc1	ZINC000819170425	ED	On-Demand	Anodyne	CA5A	19	44
O=C(Cc1nnc(O)c2ccccc12)NCc1ccc(C(=O)O)cc1	ZINC000819170425	ED	On-Demand	Anodyne	HDAC6	15	42
O=C(Cc1nnc(O)c2ccccc12)NCc1ccc(C(=O)O)cc1	ZINC000819170425	ED	On-Demand	Anodyne	FURIN	49	34
O=C(Cc1cccs1)OCc1ccc(C(=O)O)cc1	ZINC000819170431	CF	On-Demand	Anodyne	CA5B	31	40
O=C(Cc1cccs1)OCc1ccc(C(=O)O)cc1	ZINC000819170431	CF	On-Demand	Anodyne	CA5A	30	40
O=C(Cn1cc(C(=O)NCc2ccc(C(=O)O)cc2)cn1)NC1CCCC1	ZINC000819170434	FD	On-Demand	Anodyne	NAMPT	36	43
O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170436	GD	On-Demand	Bother	ACE	28	41
O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170436	GD	On-Demand	Bother	MME	60	40
O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170436	GD	On-Demand	Bother	CMA1	47	42
O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170436	GD	On-Demand	Bother	ACE2	53	38
O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170436	GD	On-Demand	Bother	FPR1	51	33
O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170436	GD	On-Demand	Bother	F2RL3	47	34
O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170436	GD	On-Demand	Bother	BLA1_STEMA	62	46
O=C(Cn1cc(C(=O)N2CC[C@@H](C(=O)O)C2)cn1)NC1CCCC1	ZINC000819170438	EC	On-Demand	Anodyne	EPHX2	17	46
O=C(Cn1cc(C(=O)N2CC[C@H](C(=O)O)C2)cn1)NC1CCCC1	ZINC000819170439	EC	On-Demand	Anodyne	EPHX2	17	46
O=C(Cn1c(=O)cnc2ccccc21)NCc1ccc(C(=O)O)cc1	ZINC000819170440	ED	On-Demand	Anodyne	F2	34	44
O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)N[C@H](C(=O)O)c1ccccc1	ZINC000819170441	FD	On-Demand	Bother	F2RL3	45	33
O=C(Cn1c(S)nc2ccccc2c1=O)NCc1ccc(C(=O)O)cc1	ZINC000819170443	FD	On-Demand	Anodyne	F2	29	45
O=C(Cc1nc(CN2CC[C@@H](C(=O)O)C2)cs1)Nc1ccccc1	ZINC000819170444	EE	On-Demand	Anodyne	SLC6A1	109	38
O=C(Cc1nc(CN2CC[C@H](C(=O)O)C2)cs1)Nc1ccccc1	ZINC000819170445	EE	On-Demand	Anodyne	SLC6A1	109	38
O=C(Cc1nc(CN2CCC(C(=O)O)CC2)cs1)Nc1ccccc1	ZINC000819170448	FF	On-Demand	Anodyne	LTA4H	15	44
O=C(Cc1nc(CN2CCC(C(=O)O)CC2)cs1)Nc1ccccc1	ZINC000819170448	FF	On-Demand	Anodyne	SIGMAR1	18	47
O=C(Cn1c(=O)nc(O)c2ccccc21)OCc1ccc(C(=O)O)cc1	ZINC000819170452	FD	On-Demand	Anodyne	FABI	53	35
O=C(Cc1nn(CCO)c(=O)c2ccccc12)OCc1ccc(C(=O)O)cc1	ZINC000819170456	GD	On-Demand	Anodyne	HRH1	28	40
O=C(Cc1nn(CCO)c(=O)c2ccccc12)OCc1ccc(C(=O)O)cc1	ZINC000819170456	GD	On-Demand	Anodyne	AKR1B1	50	40
O=C(Cn1cc(C(=O)N2CCC[C@@H]2C(=O)O)cn1)NC1CCCC1	ZINC000819170461	EC	On-Demand	Anodyne	ACE	41	37
O=C(Cn1cc(C(=O)N2CCC[C@@H]2C(=O)O)cn1)NC1CCCC1	ZINC000819170461	EC	On-Demand	Anodyne	PREP	53	39
O=C(Cn1cc(C(=O)N2CCC[C@H]2C(=O)O)cn1)NC1CCCC1	ZINC000819170462	EC	On-Demand	Anodyne	ACE	41	37
O=C(Cn1cc(C(=O)N2CCC[C@H]2C(=O)O)cn1)NC1CCCC1	ZINC000819170462	EC	On-Demand	Anodyne	PREP	53	39
O=C(Cn1c(=O)cnc2ccccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170465	FD	On-Demand	Anodyne	ACE	55	48
O=C(Cn1c(=O)cnc2ccccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170465	FD	On-Demand	Anodyne	MME	116	46
O=C(Cn1c(=O)cnc2ccccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170465	FD	On-Demand	Anodyne	ANPEP	50	36
O=C(Cn1c(=O)cnc2ccccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170465	FD	On-Demand	Anodyne	CMA1	57	44
O=C(Cn1c(=O)cnc2ccccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170465	FD	On-Demand	Anodyne	CTRA_BOVIN	47	43
O=C(Cn1c(=O)cnc2ccccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170465	FD	On-Demand	Anodyne	CPA1	51	43
O=C(Cn1c(=O)cnc2ccccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170465	FD	On-Demand	Anodyne	ITGA4	60	38
O=C(Cn1c(=O)cnc2ccccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170465	FD	On-Demand	Anodyne	NAALAD2	31	44
O=C(Cn1c(=O)cnc2ccccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170465	FD	On-Demand	Anodyne	CAPN1	22	43
O=C(Cn1c(=O)cnc2ccccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170465	FD	On-Demand	Anodyne	CTRC	48	44
O=C(Cn1c(=O)cnc2ccccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170465	FD	On-Demand	Anodyne	ACE2	93	44
O=C(Cn1c(=O)cnc2ccccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170465	FD	On-Demand	Anodyne	FPR1	68	38
O=C(Cn1c(=O)cnc2ccccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170465	FD	On-Demand	Anodyne	BLA1_STEMA	81	41
O=C(Cn1c(=O)cnc2ccccc21)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819170465	FD	On-Demand	Anodyne	GPR142	50	33
O=C(Cn1nc(-c2ccccc2)ccc1=O)OCc1ccc(C(=O)O)cc1	ZINC000819170466	FE	On-Demand	Anodyne	CYSP_TRYCR	41	35
O=C(Cn1cccc(C(F)(F)F)c1=O)OCc1ccc(C(=O)O)cc1	ZINC000819170469	FE	On-Demand	Anodyne	SLC12A5	47	37
O=C(Cn1cc(NC(=O)NCc2ccc(C(=O)O)cc2)cn1)NC1CCCC1	ZINC000819170471	GD	On-Demand	Anodyne	EPHX2	30	43
O=C(Cn1cc(NC(=O)NCc2ccc(C(=O)O)cc2)cn1)NC1CCCC1	ZINC000819170471	GD	On-Demand	Anodyne	PANC	56	42
O=C(Cn1cc(NC(=O)NCc2ccc(C(=O)O)cc2)cn1)NC1CCCC1	ZINC000819170471	GD	On-Demand	Anodyne	NAMPT	46	38
O=C(Cc1csc(-c2ccccn2)n1)OCc1ccc(C(=O)O)cc1	ZINC000819170475	FG	On-Demand	Anodyne	PTGER1	15	42
O=C(Cc1csc(-c2ccccn2)n1)OCc1ccc(C(=O)O)cc1	ZINC000819170475	FG	On-Demand	Anodyne	CPT1A	15	44
O=C(Cn1c(O)nc2ccccc21)OCc1ccc(C(=O)O)cc1	ZINC000819170477	EE	On-Demand	Anodyne	FABI	46	34
O=C(Cn1c(O)nc2ccccc21)OCc1ccc(C(=O)O)cc1	ZINC000819170477	EE	On-Demand	Anodyne	PDE6D	62	36
O=C(Cn1cc(NC(=O)C(=O)NCc2ccc(C(=O)O)cc2)cn1)NC1CC1	ZINC000819170478	GC	On-Demand	Anodyne	PANC	60	45
O=C(Cn1ccccc1=O)OCc1ccc(C(=O)O)cc1	ZINC000819170482	CD	On-Demand	Anodyne	SLC12A5	56	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC(F)(F)C1	ZINC000819170726	GG	On-Demand	Anodyne	CELA1	17	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC(F)(F)C1	ZINC000819170726	GG	On-Demand	Anodyne	CTSD	125	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC(F)(F)C1	ZINC000819170726	GG	On-Demand	Anodyne	PGC	63	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC(F)(F)C1	ZINC000819170726	GG	On-Demand	Anodyne	CMA1	30	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC(F)(F)C1	ZINC000819170726	GG	On-Demand	Anodyne	CTRA_BOVIN	17	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC(F)(F)C1	ZINC000819170726	GG	On-Demand	Anodyne	PAPA1_CARPA	31	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC(F)(F)C1	ZINC000819170726	GG	On-Demand	Anodyne	PGA	45	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC(F)(F)C1	ZINC000819170726	GG	On-Demand	Anodyne	BACE2	56	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC(F)(F)C1	ZINC000819170726	GG	On-Demand	Anodyne	TIMP3	54	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC(F)(F)C1	ZINC000819170726	GG	On-Demand	Anodyne	REN	97	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC(F)(F)C1	ZINC000819170726	GG	On-Demand	Anodyne	REN1	34	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC(F)(F)C1	ZINC000819170726	GG	On-Demand	Anodyne	BACE1	101	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC(F)(F)C1	ZINC000819170726	GG	On-Demand	Anodyne	FPR1	57	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC(F)(F)C1	ZINC000819170726	GG	On-Demand	Anodyne	PLM1_PLAFA	34	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC(F)(F)C1	ZINC000819170726	GG	On-Demand	Anodyne	PLM2_PLAFA	51	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC(F)(F)C1	ZINC000819170726	GG	On-Demand	Anodyne	Q82323_9DELA	63	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC(F)(F)C1	ZINC000819170727	GG	On-Demand	Anodyne	CELA1	17	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC(F)(F)C1	ZINC000819170727	GG	On-Demand	Anodyne	CTSD	125	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC(F)(F)C1	ZINC000819170727	GG	On-Demand	Anodyne	PGC	63	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC(F)(F)C1	ZINC000819170727	GG	On-Demand	Anodyne	CMA1	30	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC(F)(F)C1	ZINC000819170727	GG	On-Demand	Anodyne	CTRA_BOVIN	17	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC(F)(F)C1	ZINC000819170727	GG	On-Demand	Anodyne	PAPA1_CARPA	31	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC(F)(F)C1	ZINC000819170727	GG	On-Demand	Anodyne	PGA	45	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC(F)(F)C1	ZINC000819170727	GG	On-Demand	Anodyne	BACE2	56	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC(F)(F)C1	ZINC000819170727	GG	On-Demand	Anodyne	TIMP3	54	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC(F)(F)C1	ZINC000819170727	GG	On-Demand	Anodyne	REN	97	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC(F)(F)C1	ZINC000819170727	GG	On-Demand	Anodyne	REN1	34	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC(F)(F)C1	ZINC000819170727	GG	On-Demand	Anodyne	BACE1	101	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC(F)(F)C1	ZINC000819170727	GG	On-Demand	Anodyne	FPR1	57	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC(F)(F)C1	ZINC000819170727	GG	On-Demand	Anodyne	PLM1_PLAFA	34	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC(F)(F)C1	ZINC000819170727	GG	On-Demand	Anodyne	PLM2_PLAFA	51	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC(F)(F)C1	ZINC000819170727	GG	On-Demand	Anodyne	Q82323_9DELA	63	32
CON(C)C(=O)CCNCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819170789	FD	On-Demand	Anodyne	HTR1A	84	56
CON(C)C(=O)CCNCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819170789	FD	On-Demand	Anodyne	DRD2	68	55
CON(C)C(=O)CCNCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819170789	FD	On-Demand	Anodyne	DRD1	17	40
CON(C)C(=O)CCNCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819170789	FD	On-Demand	Anodyne	DRD4	55	46
CON(C)C(=O)CCNCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819170789	FD	On-Demand	Anodyne	ADRA1D	27	43
CON(C)C(=O)CCNCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819170789	FD	On-Demand	Anodyne	HTR2A	60	55
CON(C)C(=O)CCNCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819170789	FD	On-Demand	Anodyne	HTR2C	33	48
CON(C)C(=O)CCNCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819170789	FD	On-Demand	Anodyne	SLC6A4	16	50
CON(C)C(=O)CCNCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819170789	FD	On-Demand	Anodyne	ADRA1A	29	43
CON(C)C(=O)CCNCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819170789	FD	On-Demand	Anodyne	ADRA1B	20	43
CON(C)C(=O)CCNCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819170789	FD	On-Demand	Anodyne	DRD3	90	56
CON(C)C(=O)CCNCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819170789	FD	On-Demand	Anodyne	HTR7	76	46
CON(C)C(=O)CCNCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819170789	FD	On-Demand	Anodyne	CACNA1G	15	48
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819170831	GE	On-Demand	Anodyne	HTR1A	56	51
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819170831	GE	On-Demand	Anodyne	DRD2	36	51
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819170831	GE	On-Demand	Anodyne	DRD4	42	35
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819170831	GE	On-Demand	Anodyne	HTR2A	46	46
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819170831	GE	On-Demand	Anodyne	HTR2C	20	42
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819170831	GE	On-Demand	Anodyne	DRD3	42	46
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819170831	GE	On-Demand	Anodyne	HTR7	50	44
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819170831	GE	On-Demand	Anodyne	SLC27A1	48	32
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819170832	GE	On-Demand	Anodyne	HTR1A	56	51
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819170832	GE	On-Demand	Anodyne	DRD2	36	51
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819170832	GE	On-Demand	Anodyne	DRD4	42	35
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819170832	GE	On-Demand	Anodyne	HTR2A	46	46
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819170832	GE	On-Demand	Anodyne	HTR2C	20	42
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819170832	GE	On-Demand	Anodyne	DRD3	42	46
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819170832	GE	On-Demand	Anodyne	HTR7	50	44
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819170832	GE	On-Demand	Anodyne	SLC27A1	48	32
CN(C[C@H](O)CN[C@H]1CC2(CCCC2)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819170874	GH	On-Demand	Anodyne	CTSD	36	40
CN(C[C@H](O)CN[C@H]1CC2(CCCC2)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819170874	GH	On-Demand	Anodyne	BACE1	33	47
CN(C[C@@H](O)CN[C@@H]1CC2(CCCC2)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819170875	GH	On-Demand	Anodyne	CTSD	36	40
CN(C[C@@H](O)CN[C@@H]1CC2(CCCC2)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819170875	GH	On-Demand	Anodyne	BACE1	33	47
CN(C[C@H](O)CN[C@@H]1CC2(CCCC2)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819170876	GH	On-Demand	Anodyne	CTSD	36	40
CN(C[C@H](O)CN[C@@H]1CC2(CCCC2)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819170876	GH	On-Demand	Anodyne	BACE1	33	47
CN(C[C@@H](O)CN[C@H]1CC2(CCCC2)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819170877	GH	On-Demand	Anodyne	CTSD	36	40
CN(C[C@@H](O)CN[C@H]1CC2(CCCC2)Oc2ccccc21)C(=O)OC(C)(C)C	ZINC000819170877	GH	On-Demand	Anodyne	BACE1	33	47
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1nnc2n1CCCC2	ZINC000819170890	GE	On-Demand	Anodyne	GPR119	31	43
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1nnc2n1CCCC2	ZINC000819170893	GE	On-Demand	Anodyne	GPR119	31	43
C[C@@H]([C@H]1CCN(Cc2ccccc2)C1)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819170920	GG	On-Demand	Clean	SIGMAR1	34	43
C[C@H]([C@@H]1CCN(Cc2ccccc2)C1)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819170921	GG	On-Demand	Clean	SIGMAR1	34	43
C[C@H]([C@H]1CCN(Cc2ccccc2)C1)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819170922	GG	On-Demand	Clean	SIGMAR1	34	43
C[C@@H]([C@@H]1CCN(Cc2ccccc2)C1)N1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819170923	GG	On-Demand	Clean	SIGMAR1	34	43
O=C1C[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)CN1C1CCCCC1	ZINC000819170933	FE	On-Demand	Clean	INHA	18	41
O=C1C[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)CN1C1CCCCC1	ZINC000819170934	FE	On-Demand	Clean	INHA	18	41
CC(=O)c1ccc(OC[C@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819171007	EG	On-Demand	Anodyne	ADRB2	52	48
CC(=O)c1ccc(OC[C@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819171007	EG	On-Demand	Anodyne	ADRB1	80	44
CC(=O)c1ccc(OC[C@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819171007	EG	On-Demand	Anodyne	ADRB3	46	44
CC(=O)c1ccc(OC[C@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819171007	EG	On-Demand	Anodyne	ABCB1	34	60
CC(=O)c1ccc(OC[C@@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819171015	EG	On-Demand	Anodyne	ADRB2	52	48
CC(=O)c1ccc(OC[C@@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819171015	EG	On-Demand	Anodyne	ADRB1	80	44
CC(=O)c1ccc(OC[C@@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819171015	EG	On-Demand	Anodyne	ADRB3	46	44
CC(=O)c1ccc(OC[C@@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819171015	EG	On-Demand	Anodyne	ABCB1	34	60
O[C@@H](CNCC[C@@H]1COc2ccccc2O1)c1cccnc1	ZINC000819171040	DD	On-Demand	Anodyne	ADRB2	24	44
O[C@@H](CNCC[C@@H]1COc2ccccc2O1)c1cccnc1	ZINC000819171040	DD	On-Demand	Anodyne	ADRB1	26	42
O[C@@H](CNCC[C@@H]1COc2ccccc2O1)c1cccnc1	ZINC000819171040	DD	On-Demand	Anodyne	ADRA2B	17	43
O[C@@H](CNCC[C@@H]1COc2ccccc2O1)c1cccnc1	ZINC000819171040	DD	On-Demand	Anodyne	ADRB3	98	45
O[C@@H](CNCC[C@H]1COc2ccccc2O1)c1cccnc1	ZINC000819171042	DD	On-Demand	Anodyne	ADRB2	24	44
O[C@@H](CNCC[C@H]1COc2ccccc2O1)c1cccnc1	ZINC000819171042	DD	On-Demand	Anodyne	ADRB1	26	42
O[C@@H](CNCC[C@H]1COc2ccccc2O1)c1cccnc1	ZINC000819171042	DD	On-Demand	Anodyne	ADRA2B	17	43
O[C@@H](CNCC[C@H]1COc2ccccc2O1)c1cccnc1	ZINC000819171042	DD	On-Demand	Anodyne	ADRB3	98	45
O[C@H](CNCC[C@@H]1COc2ccccc2O1)c1cccnc1	ZINC000819171043	DD	On-Demand	Anodyne	ADRB2	24	44
O[C@H](CNCC[C@@H]1COc2ccccc2O1)c1cccnc1	ZINC000819171043	DD	On-Demand	Anodyne	ADRB1	26	42
O[C@H](CNCC[C@@H]1COc2ccccc2O1)c1cccnc1	ZINC000819171043	DD	On-Demand	Anodyne	ADRA2B	17	43
O[C@H](CNCC[C@@H]1COc2ccccc2O1)c1cccnc1	ZINC000819171043	DD	On-Demand	Anodyne	ADRB3	98	45
O[C@H](CNCC[C@H]1COc2ccccc2O1)c1cccnc1	ZINC000819171045	DD	On-Demand	Anodyne	ADRB2	24	44
O[C@H](CNCC[C@H]1COc2ccccc2O1)c1cccnc1	ZINC000819171045	DD	On-Demand	Anodyne	ADRB1	26	42
O[C@H](CNCC[C@H]1COc2ccccc2O1)c1cccnc1	ZINC000819171045	DD	On-Demand	Anodyne	ADRA2B	17	43
O[C@H](CNCC[C@H]1COc2ccccc2O1)c1cccnc1	ZINC000819171045	DD	On-Demand	Anodyne	ADRB3	98	45
CON(C)C(=O)[C@H](CCSC)NC[C@H](O)c1cccc(Cl)c1	ZINC000819171106	EE	On-Demand	Anodyne	ADRB1	27	44
CON(C)C(=O)[C@H](CCSC)NC[C@H](O)c1cccc(Cl)c1	ZINC000819171106	EE	On-Demand	Anodyne	ADRB3	43	43
CON(C)C(=O)[C@H](CCSC)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819171108	EE	On-Demand	Anodyne	ADRB1	27	44
CON(C)C(=O)[C@H](CCSC)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819171108	EE	On-Demand	Anodyne	ADRB3	43	43
Cc1cc(F)ccc1CCN1C(=O)CN(Cc2ccccc2O)C1=O	ZINC000819171224	EF	On-Demand	Clean	P2RX7	24	43
CC(C)(C)C1CCC(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819171260	FH	On-Demand	Anodyne	ADRB2	18	41
CC(C)(C)C1CCC(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819171260	FH	On-Demand	Anodyne	ADRB3	29	40
CC(C)(C)C1CCC(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819171261	FH	On-Demand	Anodyne	ADRB2	18	41
CC(C)(C)C1CCC(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819171261	FH	On-Demand	Anodyne	ADRB3	29	40
CON(C)C(=O)[C@H](CCSC)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819171266	FD	On-Demand	Bother	CACNA1C	47	39
CON(C)C(=O)[C@H](CCSC)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819171266	FD	On-Demand	Bother	CACNA1D	71	36
CON(C)C(=O)[C@H](CCSC)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819171267	FD	On-Demand	Bother	CACNA1C	47	39
CON(C)C(=O)[C@H](CCSC)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819171267	FD	On-Demand	Bother	CACNA1D	71	36
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CC2(CCCC2)Oc2ccccc21	ZINC000819171285	GH	On-Demand	Anodyne	BACE1	22	44
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CC2(CCCC2)Oc2ccccc21	ZINC000819171286	GH	On-Demand	Anodyne	BACE1	22	44
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1CC2(CCCC2)Oc2ccccc21	ZINC000819171287	GH	On-Demand	Anodyne	BACE1	22	44
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H]1CC2(CCCC2)Oc2ccccc21	ZINC000819171288	GH	On-Demand	Anodyne	BACE1	22	44
COc1ccccc1N1CC[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1=O	ZINC000819171326	GD	On-Demand	Clean	HTR1A	34	43
COc1ccccc1N1CC[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1=O	ZINC000819171328	GD	On-Demand	Clean	HTR1A	34	43
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCN1C1CCCCC1	ZINC000819171372	DE	On-Demand	Anodyne	ADRB1	17	40
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCN1C1CCCCC1	ZINC000819171372	DE	On-Demand	Anodyne	ADRB3	43	40
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCN1C1CCCCC1	ZINC000819171372	DE	On-Demand	Anodyne	XIAP	46	39
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCN1C1CCCCC1	ZINC000819171372	DE	On-Demand	Anodyne	BIRC8	48	37
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCN1C1CCCCC1	ZINC000819171375	DE	On-Demand	Anodyne	ADRB1	17	40
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCN1C1CCCCC1	ZINC000819171375	DE	On-Demand	Anodyne	ADRB3	43	40
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCN1C1CCCCC1	ZINC000819171375	DE	On-Demand	Anodyne	XIAP	46	39
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCN1C1CCCCC1	ZINC000819171375	DE	On-Demand	Anodyne	BIRC8	48	37
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCN1C1CCCCC1	ZINC000819171377	DE	On-Demand	Anodyne	ADRB1	17	40
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCN1C1CCCCC1	ZINC000819171377	DE	On-Demand	Anodyne	ADRB3	43	40
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCN1C1CCCCC1	ZINC000819171377	DE	On-Demand	Anodyne	XIAP	46	39
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCN1C1CCCCC1	ZINC000819171377	DE	On-Demand	Anodyne	BIRC8	48	37
O=C1[C@H](NC[C@H](O)c2ccccc2)CCN1C1CCCCC1	ZINC000819171380	DE	On-Demand	Anodyne	ADRB1	17	40
O=C1[C@H](NC[C@H](O)c2ccccc2)CCN1C1CCCCC1	ZINC000819171380	DE	On-Demand	Anodyne	ADRB3	43	40
O=C1[C@H](NC[C@H](O)c2ccccc2)CCN1C1CCCCC1	ZINC000819171380	DE	On-Demand	Anodyne	XIAP	46	39
O=C1[C@H](NC[C@H](O)c2ccccc2)CCN1C1CCCCC1	ZINC000819171380	DE	On-Demand	Anodyne	BIRC8	48	37
C#CCNC(=O)CCNCCc1ccc(-c2ccccc2)cc1	ZINC000819171382	DF	On-Demand	Mild	MME	37	43
C#CCNC(=O)CCNCCc1ccc(-c2ccccc2)cc1	ZINC000819171382	DF	On-Demand	Mild	GRIA1	45	40
C#CCNC(=O)CCNCCc1ccc(-c2ccccc2)cc1	ZINC000819171382	DF	On-Demand	Mild	FFAR1	20	40
C#CCNC(=O)CCNCCc1ccc(-c2ccccc2)cc1	ZINC000819171382	DF	On-Demand	Mild	CRTM	15	46
O[C@@H](CN[C@@H]1CCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819171535	CG	On-Demand	Anodyne	ADRB1	33	43
O[C@@H](CN[C@@H]1CCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819171535	CG	On-Demand	Anodyne	ADRB3	49	49
O[C@H](CN[C@H]1CCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819171536	CG	On-Demand	Anodyne	ADRB1	33	43
O[C@H](CN[C@H]1CCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819171536	CG	On-Demand	Anodyne	ADRB3	49	49
O[C@@H](CN[C@H]1CCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819171537	CG	On-Demand	Anodyne	ADRB1	33	43
O[C@@H](CN[C@H]1CCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819171537	CG	On-Demand	Anodyne	ADRB3	49	49
O[C@H](CN[C@@H]1CCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819171538	CG	On-Demand	Anodyne	ADRB1	33	43
O[C@H](CN[C@@H]1CCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819171538	CG	On-Demand	Anodyne	ADRB3	49	49
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171579	FF	On-Demand	Anodyne	ADRB2	36	46
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171579	FF	On-Demand	Anodyne	ADRB1	55	49
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171579	FF	On-Demand	Anodyne	HTR1A	83	56
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171579	FF	On-Demand	Anodyne	DRD2	65	59
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171579	FF	On-Demand	Anodyne	DRD1	15	43
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171579	FF	On-Demand	Anodyne	DRD4	51	48
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171579	FF	On-Demand	Anodyne	HTR2A	67	59
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171579	FF	On-Demand	Anodyne	HTR2C	32	49
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171579	FF	On-Demand	Anodyne	SLC6A4	23	59
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171579	FF	On-Demand	Anodyne	ADRA1A	18	42
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171579	FF	On-Demand	Anodyne	DRD3	81	48
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171579	FF	On-Demand	Anodyne	SLC6A3	15	59
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171579	FF	On-Demand	Anodyne	ADRB3	83	49
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171579	FF	On-Demand	Anodyne	IGF1R	25	40
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171579	FF	On-Demand	Anodyne	HTR7	72	47
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171579	FF	On-Demand	Anodyne	SIGMAR1	17	59
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171580	FF	On-Demand	Anodyne	ADRB2	36	46
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171580	FF	On-Demand	Anodyne	ADRB1	55	49
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171580	FF	On-Demand	Anodyne	HTR1A	83	56
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171580	FF	On-Demand	Anodyne	DRD2	65	59
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171580	FF	On-Demand	Anodyne	DRD1	15	43
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171580	FF	On-Demand	Anodyne	DRD4	51	48
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171580	FF	On-Demand	Anodyne	HTR2A	67	59
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171580	FF	On-Demand	Anodyne	HTR2C	32	49
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171580	FF	On-Demand	Anodyne	SLC6A4	23	59
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171580	FF	On-Demand	Anodyne	ADRA1A	18	42
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171580	FF	On-Demand	Anodyne	DRD3	81	48
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171580	FF	On-Demand	Anodyne	SLC6A3	15	59
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171580	FF	On-Demand	Anodyne	ADRB3	83	49
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171580	FF	On-Demand	Anodyne	IGF1R	25	40
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171580	FF	On-Demand	Anodyne	HTR7	72	47
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1ccccc1	ZINC000819171580	FF	On-Demand	Anodyne	SIGMAR1	17	59
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1C1CCCCC1	ZINC000819171606	DD	On-Demand	Anodyne	ADRB2	18	40
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1C1CCCCC1	ZINC000819171606	DD	On-Demand	Anodyne	ADRB1	23	44
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1C1CCCCC1	ZINC000819171606	DD	On-Demand	Anodyne	ADRB3	87	45
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1C1CCCCC1	ZINC000819171608	DD	On-Demand	Anodyne	ADRB2	18	40
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1C1CCCCC1	ZINC000819171608	DD	On-Demand	Anodyne	ADRB1	23	44
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1C1CCCCC1	ZINC000819171608	DD	On-Demand	Anodyne	ADRB3	87	45
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1C1CCCCC1	ZINC000819171609	DD	On-Demand	Anodyne	ADRB2	18	40
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1C1CCCCC1	ZINC000819171609	DD	On-Demand	Anodyne	ADRB1	23	44
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1C1CCCCC1	ZINC000819171609	DD	On-Demand	Anodyne	ADRB3	87	45
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1C1CCCCC1	ZINC000819171610	DD	On-Demand	Anodyne	ADRB2	18	40
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1C1CCCCC1	ZINC000819171610	DD	On-Demand	Anodyne	ADRB1	23	44
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1C1CCCCC1	ZINC000819171610	DD	On-Demand	Anodyne	ADRB3	87	45
O[C@@H](CNCc1nc(C2CC2)cs1)c1cccc(Cl)c1	ZINC000819171627	DG	On-Demand	Anodyne	ADRB1	37	45
O[C@@H](CNCc1nc(C2CC2)cs1)c1cccc(Cl)c1	ZINC000819171627	DG	On-Demand	Anodyne	ADRB3	56	45
O[C@@H](CNCc1nc(C2CC2)cs1)c1cccc(Cl)c1	ZINC000819171627	DG	On-Demand	Anodyne	CYP3A4	42	32
O[C@H](CNCc1nc(C2CC2)cs1)c1cccc(Cl)c1	ZINC000819171628	DG	On-Demand	Anodyne	ADRB1	37	45
O[C@H](CNCc1nc(C2CC2)cs1)c1cccc(Cl)c1	ZINC000819171628	DG	On-Demand	Anodyne	ADRB3	56	45
O[C@H](CNCc1nc(C2CC2)cs1)c1cccc(Cl)c1	ZINC000819171628	DG	On-Demand	Anodyne	CYP3A4	42	32
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819171641	GH	On-Demand	Bother	ADRB2	45	36
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819171641	GH	On-Demand	Bother	ADRB1	17	42
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819171641	GH	On-Demand	Bother	ADRB3	39	40
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819171643	GH	On-Demand	Bother	ADRB2	45	36
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819171643	GH	On-Demand	Bother	ADRB1	17	42
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819171643	GH	On-Demand	Bother	ADRB3	39	40
COc1cccc(OC)c1OC[C@@H](O)CNCc1c(C)cccc1C	ZINC000819171650	EF	On-Demand	Anodyne	ADRB2	34	54
COc1cccc(OC)c1OC[C@@H](O)CNCc1c(C)cccc1C	ZINC000819171650	EF	On-Demand	Anodyne	ADRB1	34	44
COc1cccc(OC)c1OC[C@H](O)CNCc1c(C)cccc1C	ZINC000819171651	EF	On-Demand	Anodyne	ADRB2	34	54
COc1cccc(OC)c1OC[C@H](O)CNCc1c(C)cccc1C	ZINC000819171651	EF	On-Demand	Anodyne	ADRB1	34	44
O[C@@H](CNCCc1ccc(-c2ccccc2)cc1)C1CC1	ZINC000819171683	CG	On-Demand	Anodyne	ADRB2	43	46
O[C@@H](CNCCc1ccc(-c2ccccc2)cc1)C1CC1	ZINC000819171683	CG	On-Demand	Anodyne	ADRB1	62	44
O[C@@H](CNCCc1ccc(-c2ccccc2)cc1)C1CC1	ZINC000819171683	CG	On-Demand	Anodyne	SLC18A2	27	43
O[C@@H](CNCCc1ccc(-c2ccccc2)cc1)C1CC1	ZINC000819171683	CG	On-Demand	Anodyne	ADRB3	85	44
O[C@H](CNCCc1ccc(-c2ccccc2)cc1)C1CC1	ZINC000819171684	CG	On-Demand	Anodyne	ADRB2	43	46
O[C@H](CNCCc1ccc(-c2ccccc2)cc1)C1CC1	ZINC000819171684	CG	On-Demand	Anodyne	ADRB1	62	44
O[C@H](CNCCc1ccc(-c2ccccc2)cc1)C1CC1	ZINC000819171684	CG	On-Demand	Anodyne	SLC18A2	27	43
O[C@H](CNCCc1ccc(-c2ccccc2)cc1)C1CC1	ZINC000819171684	CG	On-Demand	Anodyne	ADRB3	85	44
O[C@H](CNCc1nc(C2CC2)cs1)c1cccnc1	ZINC000819171691	CE	On-Demand	Anodyne	ADRB2	22	48
O[C@H](CNCc1nc(C2CC2)cs1)c1cccnc1	ZINC000819171691	CE	On-Demand	Anodyne	ADRB1	25	52
O[C@H](CNCc1nc(C2CC2)cs1)c1cccnc1	ZINC000819171691	CE	On-Demand	Anodyne	ADRB3	100	52
O[C@@H](CNCc1nc(C2CC2)cs1)c1cccnc1	ZINC000819171692	CE	On-Demand	Anodyne	ADRB2	22	48
O[C@@H](CNCc1nc(C2CC2)cs1)c1cccnc1	ZINC000819171692	CE	On-Demand	Anodyne	ADRB1	25	52
O[C@@H](CNCc1nc(C2CC2)cs1)c1cccnc1	ZINC000819171692	CE	On-Demand	Anodyne	ADRB3	100	52
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2nc(C3CC3)cs2)CC1	ZINC000819171693	GG	On-Demand	Anodyne	GPR119	42	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2nc(C3CC3)cs2)CC1	ZINC000819171694	GG	On-Demand	Anodyne	GPR119	42	43
O=S1(=O)CCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819171762	DD	On-Demand	Anodyne	ADRB1	35	43
O=S1(=O)CCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819171762	DD	On-Demand	Anodyne	ADRB3	47	43
O=S1(=O)CCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819171763	DD	On-Demand	Anodyne	ADRB1	35	43
O=S1(=O)CCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819171763	DD	On-Demand	Anodyne	ADRB3	47	43
O=S1(=O)CCC[C@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819171764	DD	On-Demand	Anodyne	ADRB1	35	43
O=S1(=O)CCC[C@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819171764	DD	On-Demand	Anodyne	ADRB3	47	43
O=S1(=O)CCC[C@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819171765	DD	On-Demand	Anodyne	ADRB1	35	43
O=S1(=O)CCC[C@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819171765	DD	On-Demand	Anodyne	ADRB3	47	43
O=C1[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1C1CCCCC1	ZINC000819171768	EF	On-Demand	Anodyne	ADRB3	20	42
O=C1[C@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1C1CCCCC1	ZINC000819171769	EF	On-Demand	Anodyne	ADRB3	20	42
O[C@@H](CNCc1nc(C2CC2)cs1)c1ccccc1	ZINC000819171819	CF	On-Demand	Anodyne	ADRB3	38	40
O[C@H](CNCc1nc(C2CC2)cs1)c1ccccc1	ZINC000819171820	CF	On-Demand	Anodyne	ADRB3	38	40
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@H](O)c1ccccc1	ZINC000819171866	FH	On-Demand	Anodyne	ADRB2	54	42
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@H](O)c1ccccc1	ZINC000819171866	FH	On-Demand	Anodyne	ADRB1	35	56
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@H](O)c1ccccc1	ZINC000819171866	FH	On-Demand	Anodyne	ADRB3	70	56
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@@H](O)c1ccccc1	ZINC000819171868	FH	On-Demand	Anodyne	ADRB2	54	42
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@@H](O)c1ccccc1	ZINC000819171868	FH	On-Demand	Anodyne	ADRB1	35	56
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@@H](O)c1ccccc1	ZINC000819171868	FH	On-Demand	Anodyne	ADRB3	70	56
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171873	FE	On-Demand	Anodyne	ADRB2	32	43
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171873	FE	On-Demand	Anodyne	ADRB1	54	44
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171873	FE	On-Demand	Anodyne	HTR1A	50	50
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171873	FE	On-Demand	Anodyne	DRD2	31	50
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171873	FE	On-Demand	Anodyne	DRD4	45	38
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171873	FE	On-Demand	Anodyne	HTR2A	41	48
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171873	FE	On-Demand	Anodyne	HTR2C	18	42
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171873	FE	On-Demand	Anodyne	DRD3	44	46
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171873	FE	On-Demand	Anodyne	ADRB3	137	46
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171873	FE	On-Demand	Anodyne	HTR7	40	44
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171874	FE	On-Demand	Anodyne	ADRB2	32	43
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171874	FE	On-Demand	Anodyne	ADRB1	54	44
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171874	FE	On-Demand	Anodyne	HTR1A	50	50
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171874	FE	On-Demand	Anodyne	DRD2	31	50
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171874	FE	On-Demand	Anodyne	DRD4	45	38
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171874	FE	On-Demand	Anodyne	HTR2A	41	48
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171874	FE	On-Demand	Anodyne	HTR2C	18	42
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171874	FE	On-Demand	Anodyne	DRD3	44	46
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171874	FE	On-Demand	Anodyne	ADRB3	137	46
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819171874	FE	On-Demand	Anodyne	HTR7	40	44
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CC3(CCCC3)Oc3ccccc32)c1	ZINC000819171877	FI	On-Demand	Bother	BACE1	22	40
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CC3(CCCC3)Oc3ccccc32)c1	ZINC000819171878	FI	On-Demand	Bother	BACE1	22	40
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CC3(CCCC3)Oc3ccccc32)c1	ZINC000819171879	FI	On-Demand	Bother	BACE1	22	40
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CC3(CCCC3)Oc3ccccc32)c1	ZINC000819171880	FI	On-Demand	Bother	BACE1	22	40
O=C1[C@@H](NC[C@H](O)c2ccccc2Cl)CCN1C1CCCCC1	ZINC000819171891	EF	On-Demand	Anodyne	OPRL1	48	38
O=C1[C@H](NC[C@H](O)c2ccccc2Cl)CCN1C1CCCCC1	ZINC000819171892	EF	On-Demand	Anodyne	OPRL1	48	38
COC[C@@H](C)OC[C@@H](O)CNCc1c(C)cccc1C	ZINC000819171897	CD	On-Demand	Anodyne	ADRB2	15	46
COC[C@@H](C)OC[C@H](O)CNCc1c(C)cccc1C	ZINC000819171899	CD	On-Demand	Anodyne	ADRB2	15	46
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@H]1CC2(CCCC2)Oc2ccccc21	ZINC000819171903	GH	On-Demand	Anodyne	CTSD	37	40
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@H]1CC2(CCCC2)Oc2ccccc21	ZINC000819171903	GH	On-Demand	Anodyne	BACE1	33	47
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CC2(CCCC2)Oc2ccccc21	ZINC000819171904	GH	On-Demand	Anodyne	CTSD	37	40
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CC2(CCCC2)Oc2ccccc21	ZINC000819171904	GH	On-Demand	Anodyne	BACE1	33	47
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1CC2(CCCC2)Oc2ccccc21	ZINC000819171905	GH	On-Demand	Anodyne	CTSD	37	40
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1CC2(CCCC2)Oc2ccccc21	ZINC000819171905	GH	On-Demand	Anodyne	BACE1	33	47
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CC2(CCCC2)Oc2ccccc21	ZINC000819171906	GH	On-Demand	Anodyne	CTSD	37	40
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CC2(CCCC2)Oc2ccccc21	ZINC000819171906	GH	On-Demand	Anodyne	BACE1	33	47
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1C1CCCCC1	ZINC000819171907	EF	On-Demand	Anodyne	ADRB1	37	45
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1C1CCCCC1	ZINC000819171907	EF	On-Demand	Anodyne	ADRB3	57	46
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1C1CCCCC1	ZINC000819171907	EF	On-Demand	Anodyne	CYP3A4	51	39
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1C1CCCCC1	ZINC000819171908	EF	On-Demand	Anodyne	ADRB1	37	45
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1C1CCCCC1	ZINC000819171908	EF	On-Demand	Anodyne	ADRB3	57	46
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1C1CCCCC1	ZINC000819171908	EF	On-Demand	Anodyne	CYP3A4	51	39
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1C1CCCCC1	ZINC000819171909	EF	On-Demand	Anodyne	ADRB1	37	45
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1C1CCCCC1	ZINC000819171909	EF	On-Demand	Anodyne	ADRB3	57	46
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1C1CCCCC1	ZINC000819171909	EF	On-Demand	Anodyne	CYP3A4	51	39
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1C1CCCCC1	ZINC000819171910	EF	On-Demand	Anodyne	ADRB1	37	45
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1C1CCCCC1	ZINC000819171910	EF	On-Demand	Anodyne	ADRB3	57	46
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1C1CCCCC1	ZINC000819171910	EF	On-Demand	Anodyne	CYP3A4	51	39
COc1ccc(OC)c([C@H](O)CNCC[C@H]2COc3ccccc3O2)c1	ZINC000819171957	FF	On-Demand	Anodyne	ADRA1D	15	45
COc1ccc(OC)c([C@H](O)CNCC[C@H]2COc3ccccc3O2)c1	ZINC000819171957	FF	On-Demand	Anodyne	ADRA1B	16	45
COc1ccc(OC)c([C@H](O)CNCC[C@@H]2COc3ccccc3O2)c1	ZINC000819171958	FF	On-Demand	Anodyne	ADRA1D	15	45
COc1ccc(OC)c([C@H](O)CNCC[C@@H]2COc3ccccc3O2)c1	ZINC000819171958	FF	On-Demand	Anodyne	ADRA1B	16	45
CON(C)C(=O)[C@H](CCSC)NC[C@@H](O)c1cccnc1	ZINC000819171970	DC	On-Demand	Anodyne	ADRB1	15	42
CON(C)C(=O)[C@H](CCSC)NC[C@@H](O)c1cccnc1	ZINC000819171970	DC	On-Demand	Anodyne	ADRB3	45	42
CON(C)C(=O)[C@H](CCSC)NC[C@H](O)c1cccnc1	ZINC000819171971	DC	On-Demand	Anodyne	ADRB1	15	42
CON(C)C(=O)[C@H](CCSC)NC[C@H](O)c1cccnc1	ZINC000819171971	DC	On-Demand	Anodyne	ADRB3	45	42
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@@H](O)c1cccnc1	ZINC000819171979	FG	On-Demand	Anodyne	ADRB2	44	36
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@@H](O)c1cccnc1	ZINC000819171979	FG	On-Demand	Anodyne	ADRB1	34	60
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@@H](O)c1cccnc1	ZINC000819171979	FG	On-Demand	Anodyne	ADRB3	93	60
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@H](O)c1cccnc1	ZINC000819171980	FG	On-Demand	Anodyne	ADRB2	44	36
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@H](O)c1cccnc1	ZINC000819171980	FG	On-Demand	Anodyne	ADRB1	34	60
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@H](O)c1cccnc1	ZINC000819171980	FG	On-Demand	Anodyne	ADRB3	93	60
N#Cc1ccc([C@@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171986	GF	On-Demand	Mild	ADRB2	16	40
N#Cc1ccc([C@@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171986	GF	On-Demand	Mild	ADRB1	28	40
N#Cc1ccc([C@@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171986	GF	On-Demand	Mild	HTR1A	43	50
N#Cc1ccc([C@@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171986	GF	On-Demand	Mild	DRD2	27	50
N#Cc1ccc([C@@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171986	GF	On-Demand	Mild	DRD4	45	38
N#Cc1ccc([C@@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171986	GF	On-Demand	Mild	HTR2A	31	48
N#Cc1ccc([C@@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171986	GF	On-Demand	Mild	DRD3	40	46
N#Cc1ccc([C@@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171986	GF	On-Demand	Mild	ADRB3	39	40
N#Cc1ccc([C@@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171986	GF	On-Demand	Mild	IGF1R	19	40
N#Cc1ccc([C@@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171986	GF	On-Demand	Mild	HTR7	30	41
N#Cc1ccc([C@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171987	GF	On-Demand	Mild	ADRB2	16	40
N#Cc1ccc([C@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171987	GF	On-Demand	Mild	ADRB1	28	40
N#Cc1ccc([C@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171987	GF	On-Demand	Mild	HTR1A	43	50
N#Cc1ccc([C@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171987	GF	On-Demand	Mild	DRD2	27	50
N#Cc1ccc([C@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171987	GF	On-Demand	Mild	DRD4	45	38
N#Cc1ccc([C@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171987	GF	On-Demand	Mild	HTR2A	31	48
N#Cc1ccc([C@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171987	GF	On-Demand	Mild	DRD3	40	46
N#Cc1ccc([C@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171987	GF	On-Demand	Mild	ADRB3	39	40
N#Cc1ccc([C@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171987	GF	On-Demand	Mild	IGF1R	19	40
N#Cc1ccc([C@H](O)CNCCN2CCN(c3cccc(Cl)c3)CC2)cc1	ZINC000819171987	GF	On-Demand	Mild	HTR7	30	41
COC(=O)c1ccc(OC[C@@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819171988	EF	On-Demand	Anodyne	ADRB2	59	50
COC(=O)c1ccc(OC[C@@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819171988	EF	On-Demand	Anodyne	ADRB1	88	50
COC(=O)c1ccc(OC[C@@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819171988	EF	On-Demand	Anodyne	ADRB3	55	50
COC(=O)c1ccc(OC[C@@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819171988	EF	On-Demand	Anodyne	ABCB1	33	48
COC(=O)c1ccc(OC[C@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819171989	EF	On-Demand	Anodyne	ADRB2	59	50
COC(=O)c1ccc(OC[C@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819171989	EF	On-Demand	Anodyne	ADRB1	88	50
COC(=O)c1ccc(OC[C@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819171989	EF	On-Demand	Anodyne	ADRB3	55	50
COC(=O)c1ccc(OC[C@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819171989	EF	On-Demand	Anodyne	ABCB1	33	48
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819172009	GH	On-Demand	Bother	ADRB2	47	38
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819172009	GH	On-Demand	Bother	ADRB1	28	46
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819172009	GH	On-Demand	Bother	ADRB3	53	46
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819172011	GH	On-Demand	Bother	ADRB2	47	38
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819172011	GH	On-Demand	Bother	ADRB1	28	46
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819172011	GH	On-Demand	Bother	ADRB3	53	46
O[C@@H](CNCC[C@@H]1COc2ccccc2O1)c1cccc(Cl)c1	ZINC000819172028	EG	On-Demand	Anodyne	ADRB1	35	45
O[C@@H](CNCC[C@@H]1COc2ccccc2O1)c1cccc(Cl)c1	ZINC000819172028	EG	On-Demand	Anodyne	ADRB3	52	45
O[C@@H](CNCC[C@H]1COc2ccccc2O1)c1cccc(Cl)c1	ZINC000819172029	EG	On-Demand	Anodyne	ADRB1	35	45
O[C@@H](CNCC[C@H]1COc2ccccc2O1)c1cccc(Cl)c1	ZINC000819172029	EG	On-Demand	Anodyne	ADRB3	52	45
O[C@H](CNCC[C@@H]1COc2ccccc2O1)c1cccc(Cl)c1	ZINC000819172030	EG	On-Demand	Anodyne	ADRB1	35	45
O[C@H](CNCC[C@@H]1COc2ccccc2O1)c1cccc(Cl)c1	ZINC000819172030	EG	On-Demand	Anodyne	ADRB3	52	45
O[C@H](CNCC[C@H]1COc2ccccc2O1)c1cccc(Cl)c1	ZINC000819172031	EG	On-Demand	Anodyne	ADRB1	35	45
O[C@H](CNCC[C@H]1COc2ccccc2O1)c1cccc(Cl)c1	ZINC000819172031	EG	On-Demand	Anodyne	ADRB3	52	45
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819172052	GH	On-Demand	Mild	ADRB2	44	35
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819172052	GH	On-Demand	Mild	ADRB1	15	41
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819172054	GH	On-Demand	Mild	ADRB2	44	35
C[C@@H](Cc1ccc(F)c(Br)c1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819172054	GH	On-Demand	Mild	ADRB1	15	41
CC(C)(C)OC(=O)N1CCCC[C@H]1CNC(=O)c1coc(=O)c2ccccc12	ZINC000819172083	GG	On-Demand	Anodyne	INHA	44	33
CC(C)(C)OC(=O)N1CCCC[C@H]1CNC(=O)c1coc(=O)c2ccccc12	ZINC000819172083	GG	On-Demand	Anodyne	HCRTR1	34	43
CC(C)(C)OC(=O)N1CCCC[C@H]1CNC(=O)c1coc(=O)c2ccccc12	ZINC000819172083	GG	On-Demand	Anodyne	HCRTR2	16	43
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)c1coc(=O)c2ccccc12	ZINC000819172084	GG	On-Demand	Anodyne	INHA	44	33
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)c1coc(=O)c2ccccc12	ZINC000819172084	GG	On-Demand	Anodyne	HCRTR1	34	43
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)c1coc(=O)c2ccccc12	ZINC000819172084	GG	On-Demand	Anodyne	HCRTR2	16	43
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819172100	GF	On-Demand	Anodyne	CACNA1I	17	42
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819172100	GF	On-Demand	Anodyne	GPR119	20	45
CC(C)(C)OC(=O)N1CCCC[C@H]1CNC(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819172101	GF	On-Demand	Anodyne	CACNA1I	17	42
CC(C)(C)OC(=O)N1CCCC[C@H]1CNC(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819172101	GF	On-Demand	Anodyne	GPR119	20	45
O[C@H](CNC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172114	EE	On-Demand	Anodyne	ADRB1	38	48
O[C@H](CNC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172114	EE	On-Demand	Anodyne	ADRB3	59	48
O[C@H](CNC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172114	EE	On-Demand	Anodyne	SLC18A3	32	40
O[C@H](CNC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172114	EE	On-Demand	Anodyne	CYP3A4	47	37
O[C@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172115	EE	On-Demand	Anodyne	ADRB1	38	48
O[C@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172115	EE	On-Demand	Anodyne	ADRB3	59	48
O[C@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172115	EE	On-Demand	Anodyne	SLC18A3	32	40
O[C@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172115	EE	On-Demand	Anodyne	CYP3A4	47	37
O[C@H](CNC1CCN([C@H]2CCC[C@@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172116	EE	On-Demand	Anodyne	ADRB1	38	48
O[C@H](CNC1CCN([C@H]2CCC[C@@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172116	EE	On-Demand	Anodyne	ADRB3	59	48
O[C@H](CNC1CCN([C@H]2CCC[C@@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172116	EE	On-Demand	Anodyne	SLC18A3	32	40
O[C@H](CNC1CCN([C@H]2CCC[C@@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172116	EE	On-Demand	Anodyne	CYP3A4	47	37
O[C@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172117	EE	On-Demand	Anodyne	ADRB1	38	48
O[C@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172117	EE	On-Demand	Anodyne	ADRB3	59	48
O[C@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172117	EE	On-Demand	Anodyne	SLC18A3	32	40
O[C@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172117	EE	On-Demand	Anodyne	CYP3A4	47	37
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172127	FF	On-Demand	Anodyne	ADRB1	39	48
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172127	FF	On-Demand	Anodyne	ADRB3	60	48
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172127	FF	On-Demand	Anodyne	SLC18A3	36	42
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172127	FF	On-Demand	Anodyne	CYP3A4	47	37
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172128	FF	On-Demand	Anodyne	ADRB1	39	48
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172128	FF	On-Demand	Anodyne	ADRB3	60	48
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172128	FF	On-Demand	Anodyne	SLC18A3	36	42
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172128	FF	On-Demand	Anodyne	CYP3A4	47	37
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172129	FF	On-Demand	Anodyne	ADRB1	39	48
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172129	FF	On-Demand	Anodyne	ADRB3	60	48
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172129	FF	On-Demand	Anodyne	SLC18A3	36	42
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172129	FF	On-Demand	Anodyne	CYP3A4	47	37
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172130	FF	On-Demand	Anodyne	ADRB1	39	48
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172130	FF	On-Demand	Anodyne	ADRB3	60	48
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172130	FF	On-Demand	Anodyne	SLC18A3	36	42
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1cccc(Cl)c1	ZINC000819172130	FF	On-Demand	Anodyne	CYP3A4	47	37
O[C@H](CNC1CCN([C@@H]2CCC[C@@H]2O)CC1)C1CC1	ZINC000819172138	CC	On-Demand	Anodyne	SLC18A3	33	45
O[C@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)C1CC1	ZINC000819172139	CC	On-Demand	Anodyne	SLC18A3	33	45
O[C@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)C1CC1	ZINC000819172140	CC	On-Demand	Anodyne	SLC18A3	33	45
O[C@H](CNC1CCN([C@H]2CCC[C@@H]2O)CC1)C1CC1	ZINC000819172141	CC	On-Demand	Anodyne	SLC18A3	33	45
CON(C)C(=O)[C@H](CCSC)NC[C@H](O)Cc1ccccc1	ZINC000819172173	ED	On-Demand	Anodyne	MME	30	44
CON(C)C(=O)[C@H](CCSC)NC[C@H](O)Cc1ccccc1	ZINC000819172173	ED	On-Demand	Anodyne	FPR1	41	40
CON(C)C(=O)[C@H](CCSC)NC[C@@H](O)Cc1ccccc1	ZINC000819172174	ED	On-Demand	Anodyne	MME	30	44
CON(C)C(=O)[C@H](CCSC)NC[C@@H](O)Cc1ccccc1	ZINC000819172174	ED	On-Demand	Anodyne	FPR1	41	40
CC(=O)Nc1ccc(OC[C@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819172233	EF	On-Demand	Anodyne	ADRB2	59	60
CC(=O)Nc1ccc(OC[C@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819172233	EF	On-Demand	Anodyne	ADRB1	94	60
CC(=O)Nc1ccc(OC[C@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819172233	EF	On-Demand	Anodyne	GRIN1	26	44
CC(=O)Nc1ccc(OC[C@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819172233	EF	On-Demand	Anodyne	ADRB3	57	57
CC(=O)Nc1ccc(OC[C@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819172233	EF	On-Demand	Anodyne	ABCB1	28	45
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819172234	EF	On-Demand	Anodyne	ADRB2	59	60
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819172234	EF	On-Demand	Anodyne	ADRB1	94	60
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819172234	EF	On-Demand	Anodyne	GRIN1	26	44
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819172234	EF	On-Demand	Anodyne	ADRB3	57	57
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819172234	EF	On-Demand	Anodyne	ABCB1	28	45
O[C@H](CNC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1cccc(Br)c1	ZINC000819172273	GE	On-Demand	Anodyne	SLC18A3	39	40
O[C@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1cccc(Br)c1	ZINC000819172274	GE	On-Demand	Anodyne	SLC18A3	39	40
O[C@H](CNC1CCN([C@H]2CCC[C@@H]2O)CC1)c1cccc(Br)c1	ZINC000819172275	GE	On-Demand	Anodyne	SLC18A3	39	40
O[C@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1cccc(Br)c1	ZINC000819172276	GE	On-Demand	Anodyne	SLC18A3	39	40
O[C@H]1CCC[C@@H]1N1CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819172277	EE	On-Demand	Anodyne	SLC18A3	60	43
O[C@@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1ccccc1Cl	ZINC000819172278	EE	On-Demand	Anodyne	SLC18A3	60	43
O[C@@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1ccccc1Cl	ZINC000819172279	EE	On-Demand	Anodyne	SLC18A3	60	43
O[C@H]1CCC[C@H]1N1CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819172280	EE	On-Demand	Anodyne	SLC18A3	60	43
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1ccccc1F	ZINC000819172297	EE	On-Demand	Anodyne	SLC18A3	68	44
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1ccccc1F	ZINC000819172298	EE	On-Demand	Anodyne	SLC18A3	68	44
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccccc1F	ZINC000819172299	EE	On-Demand	Anodyne	SLC18A3	68	44
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccccc1F	ZINC000819172300	EE	On-Demand	Anodyne	SLC18A3	68	44
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1cccc(C(F)(F)F)c1	ZINC000819172337	GG	On-Demand	Anodyne	CCR2	41	38
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1cccc(C(F)(F)F)c1	ZINC000819172338	GG	On-Demand	Anodyne	CCR2	41	38
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1cccc(C(F)(F)F)c1	ZINC000819172339	GG	On-Demand	Anodyne	CCR2	41	38
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1cccc(C(F)(F)F)c1	ZINC000819172340	GG	On-Demand	Anodyne	CCR2	41	38
O=[N+]([O-])c1cccc([C@H](O)CNC2CCN([C@@H]3CCC[C@@H]3O)CC2)c1	ZINC000819172358	ED	On-Demand	Bother	SLC18A3	23	48
O=[N+]([O-])c1cccc([C@H](O)CNC2CCN([C@@H]3CCC[C@H]3O)CC2)c1	ZINC000819172359	ED	On-Demand	Bother	SLC18A3	23	48
O=[N+]([O-])c1cccc([C@H](O)CNC2CCN([C@H]3CCC[C@@H]3O)CC2)c1	ZINC000819172360	ED	On-Demand	Bother	SLC18A3	23	48
O=[N+]([O-])c1cccc([C@H](O)CNC2CCN([C@H]3CCC[C@H]3O)CC2)c1	ZINC000819172361	ED	On-Demand	Bother	SLC18A3	23	48
O=S(=O)(CCNC[C@@H](O)CCc1ccccc1)CC1CC1	ZINC000819172365	DD	On-Demand	Anodyne	ADRB2	28	40
O=S(=O)(CCNC[C@@H](O)CCc1ccccc1)CC1CC1	ZINC000819172365	DD	On-Demand	Anodyne	ADRB1	45	43
O=S(=O)(CCNC[C@@H](O)CCc1ccccc1)CC1CC1	ZINC000819172365	DD	On-Demand	Anodyne	ADRB3	40	40
O=S(=O)(CCNC[C@H](O)CCc1ccccc1)CC1CC1	ZINC000819172366	DD	On-Demand	Anodyne	ADRB2	28	40
O=S(=O)(CCNC[C@H](O)CCc1ccccc1)CC1CC1	ZINC000819172366	DD	On-Demand	Anodyne	ADRB1	45	43
O=S(=O)(CCNC[C@H](O)CCc1ccccc1)CC1CC1	ZINC000819172366	DD	On-Demand	Anodyne	ADRB3	40	40
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)cc1Cl)CC1CC1	ZINC000819172375	GE	On-Demand	Anodyne	ADRB2	24	41
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)cc1Cl)CC1CC1	ZINC000819172375	GE	On-Demand	Anodyne	ADRB1	43	41
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)cc1Cl)CC1CC1	ZINC000819172376	GE	On-Demand	Anodyne	ADRB2	24	41
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)cc1Cl)CC1CC1	ZINC000819172376	GE	On-Demand	Anodyne	ADRB1	43	41
C[C@@H]1CCCC[C@H]1C(=O)NCc1cccnc1N1CCCCC1	ZINC000819172379	DH	On-Demand	Anodyne	TRPV1	21	42
C[C@@H]1CCCC[C@H]1C(=O)NCc1cccnc1N1CCCCC1	ZINC000819172379	DH	On-Demand	Anodyne	SCN2A	19	48
C[C@@H]1CCCC[C@H]1C(=O)NCc1cccnc1N1CCCCC1	ZINC000819172379	DH	On-Demand	Anodyne	EPHX2	22	40
C[C@@H]1CCCC[C@H]1C(=O)NCc1cccnc1N1CCCCC1	ZINC000819172379	DH	On-Demand	Anodyne	SCN10A	20	48
C[C@@H]1CCCC[C@@H]1C(=O)NCc1cccnc1N1CCCCC1	ZINC000819172381	DH	On-Demand	Anodyne	TRPV1	21	42
C[C@@H]1CCCC[C@@H]1C(=O)NCc1cccnc1N1CCCCC1	ZINC000819172381	DH	On-Demand	Anodyne	SCN2A	19	48
C[C@@H]1CCCC[C@@H]1C(=O)NCc1cccnc1N1CCCCC1	ZINC000819172381	DH	On-Demand	Anodyne	EPHX2	22	40
C[C@@H]1CCCC[C@@H]1C(=O)NCc1cccnc1N1CCCCC1	ZINC000819172381	DH	On-Demand	Anodyne	SCN10A	20	48
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(N2CCCC2=O)c1	ZINC000819172423	EF	On-Demand	Anodyne	KCNQ2	46	34
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(N2CCCC2=O)c1	ZINC000819172424	EF	On-Demand	Anodyne	KCNQ2	46	34
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(N2CCCC2=O)c1	ZINC000819172425	EF	On-Demand	Anodyne	KCNQ2	46	34
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(N2CCCC2=O)c1	ZINC000819172426	EF	On-Demand	Anodyne	KCNQ2	46	34
O=C1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CN1C1CCCCC1	ZINC000819172442	EF	On-Demand	Anodyne	ADRB1	36	45
O=C1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CN1C1CCCCC1	ZINC000819172442	EF	On-Demand	Anodyne	INHA	19	42
O=C1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CN1C1CCCCC1	ZINC000819172442	EF	On-Demand	Anodyne	ADRB3	52	49
O=C1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CN1C1CCCCC1	ZINC000819172442	EF	On-Demand	Anodyne	CYP3A4	49	37
O=C1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CN1C1CCCCC1	ZINC000819172443	EF	On-Demand	Anodyne	ADRB1	36	45
O=C1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CN1C1CCCCC1	ZINC000819172443	EF	On-Demand	Anodyne	INHA	19	42
O=C1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CN1C1CCCCC1	ZINC000819172443	EF	On-Demand	Anodyne	ADRB3	52	49
O=C1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CN1C1CCCCC1	ZINC000819172443	EF	On-Demand	Anodyne	CYP3A4	49	37
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1C1CCCCC1	ZINC000819172444	EF	On-Demand	Anodyne	ADRB1	36	45
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1C1CCCCC1	ZINC000819172444	EF	On-Demand	Anodyne	INHA	19	42
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1C1CCCCC1	ZINC000819172444	EF	On-Demand	Anodyne	ADRB3	52	49
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1C1CCCCC1	ZINC000819172444	EF	On-Demand	Anodyne	CYP3A4	49	37
O=C1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CN1C1CCCCC1	ZINC000819172445	EF	On-Demand	Anodyne	ADRB1	36	45
O=C1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CN1C1CCCCC1	ZINC000819172445	EF	On-Demand	Anodyne	INHA	19	42
O=C1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CN1C1CCCCC1	ZINC000819172445	EF	On-Demand	Anodyne	ADRB3	52	49
O=C1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CN1C1CCCCC1	ZINC000819172445	EF	On-Demand	Anodyne	CYP3A4	49	37
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819172490	DD	On-Demand	Anodyne	HTR1A	62	58
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819172490	DD	On-Demand	Anodyne	DRD2	47	58
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819172490	DD	On-Demand	Anodyne	DRD4	46	39
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819172490	DD	On-Demand	Anodyne	HTR2A	49	54
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819172490	DD	On-Demand	Anodyne	HTR2C	20	44
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819172490	DD	On-Demand	Anodyne	ADRA1A	15	47
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819172490	DD	On-Demand	Anodyne	DRD3	61	49
O[C@@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819172490	DD	On-Demand	Anodyne	HTR7	58	45
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819172491	DD	On-Demand	Anodyne	HTR1A	62	58
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819172491	DD	On-Demand	Anodyne	DRD2	47	58
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819172491	DD	On-Demand	Anodyne	DRD4	46	39
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819172491	DD	On-Demand	Anodyne	HTR2A	49	54
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819172491	DD	On-Demand	Anodyne	HTR2C	20	44
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819172491	DD	On-Demand	Anodyne	ADRA1A	15	47
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819172491	DD	On-Demand	Anodyne	DRD3	61	49
O[C@H](CNCCN1CCN(c2cccc(Cl)c2)CC1)C1CC1	ZINC000819172491	DD	On-Demand	Anodyne	HTR7	58	45
O[C@@H](CN[C@@H]1CC2(CCCC2)Oc2ccccc21)C1CC1	ZINC000819172553	CG	On-Demand	Anodyne	BACE1	23	43
O[C@@H](CN[C@H]1CC2(CCCC2)Oc2ccccc21)C1CC1	ZINC000819172554	CG	On-Demand	Anodyne	BACE1	23	43
O[C@H](CN[C@@H]1CC2(CCCC2)Oc2ccccc21)C1CC1	ZINC000819172555	CG	On-Demand	Anodyne	BACE1	23	43
O[C@H](CN[C@H]1CC2(CCCC2)Oc2ccccc21)C1CC1	ZINC000819172556	CG	On-Demand	Anodyne	BACE1	23	43
CON(C)C(=O)CCNCCc1ccc(-c2ccccc2)cc1	ZINC000819172557	DF	On-Demand	Anodyne	ADRB3	44	38
CON(C)C(=O)CCNCCc1ccc(-c2ccccc2)cc1	ZINC000819172557	DF	On-Demand	Anodyne	MME	36	40
CON(C)C(=O)CCNCCc1ccc(-c2ccccc2)cc1	ZINC000819172557	DF	On-Demand	Anodyne	FAAH	30	44
CON(C)C(=O)CCNCCc1ccc(-c2ccccc2)cc1	ZINC000819172557	DF	On-Demand	Anodyne	FFAR1	27	40
O[C@H](CN[C@@H]1CCCc2c[nH]nc21)c1cccnc1	ZINC000819172567	CD	On-Demand	Anodyne	ADRB1	21	41
O[C@H](CN[C@@H]1CCCc2c[nH]nc21)c1cccnc1	ZINC000819172567	CD	On-Demand	Anodyne	ADRB3	75	43
O[C@@H](CN[C@@H]1CCCc2c[nH]nc21)c1cccnc1	ZINC000819172568	CD	On-Demand	Anodyne	ADRB1	21	41
O[C@@H](CN[C@@H]1CCCc2c[nH]nc21)c1cccnc1	ZINC000819172568	CD	On-Demand	Anodyne	ADRB3	75	43
O[C@H](CN[C@H]1CCCc2c[nH]nc21)c1cccnc1	ZINC000819172569	CD	On-Demand	Anodyne	ADRB1	21	41
O[C@H](CN[C@H]1CCCc2c[nH]nc21)c1cccnc1	ZINC000819172569	CD	On-Demand	Anodyne	ADRB3	75	43
O[C@@H](CN[C@H]1CCCc2c[nH]nc21)c1cccnc1	ZINC000819172570	CD	On-Demand	Anodyne	ADRB1	21	41
O[C@@H](CN[C@H]1CCCc2c[nH]nc21)c1cccnc1	ZINC000819172570	CD	On-Demand	Anodyne	ADRB3	75	43
O=S(=O)(CCNC[C@H](O)c1cccc(F)c1)CC1CC1	ZINC000819172575	DD	On-Demand	Anodyne	ADRB1	31	40
O=S(=O)(CCNC[C@H](O)c1cccc(F)c1)CC1CC1	ZINC000819172575	DD	On-Demand	Anodyne	ADRB3	51	40
O=S(=O)(CCNC[C@@H](O)c1cccc(F)c1)CC1CC1	ZINC000819172577	DD	On-Demand	Anodyne	ADRB1	31	40
O=S(=O)(CCNC[C@@H](O)c1cccc(F)c1)CC1CC1	ZINC000819172577	DD	On-Demand	Anodyne	ADRB3	51	40
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1cccc(Br)c1	ZINC000819172579	GF	On-Demand	Anodyne	SLC18A3	44	40
O=C(CCNCCS(=O)(=O)CC1CC1)Nc1cccc(C(F)(F)F)c1	ZINC000819172581	GE	On-Demand	Anodyne	CCR2	23	40
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1cccc(Br)c1	ZINC000819172583	GF	On-Demand	Anodyne	SLC18A3	44	40
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1cccc(Br)c1	ZINC000819172585	GF	On-Demand	Anodyne	SLC18A3	44	40
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1cccc(Br)c1	ZINC000819172587	GF	On-Demand	Anodyne	SLC18A3	44	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H]1CCN(c2ccc(F)c(F)c2)C1	ZINC000819172604	GF	On-Demand	Anodyne	CACNA1I	53	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1	ZINC000819172605	GF	On-Demand	Anodyne	CACNA1I	53	33
O=C1CCc2cc(OC[C@@H](O)CNCCS(=O)(=O)CC3CC3)ccc2N1	ZINC000819172607	GC	On-Demand	Anodyne	ADRB1	49	43
O=C1CCc2cc(OC[C@@H](O)CNCCS(=O)(=O)CC3CC3)ccc2N1	ZINC000819172607	GC	On-Demand	Anodyne	ADRB3	34	41
O=C1CCc2cc(OC[C@H](O)CNCCS(=O)(=O)CC3CC3)ccc2N1	ZINC000819172608	GC	On-Demand	Anodyne	ADRB1	49	43
O=C1CCc2cc(OC[C@H](O)CNCCS(=O)(=O)CC3CC3)ccc2N1	ZINC000819172608	GC	On-Demand	Anodyne	ADRB3	34	41
CC(=O)c1cccc(OC[C@H](O)CNCc2c(C)cccc2C)c1	ZINC000819172617	EG	On-Demand	Anodyne	ADRB2	43	50
CC(=O)c1cccc(OC[C@H](O)CNCc2c(C)cccc2C)c1	ZINC000819172617	EG	On-Demand	Anodyne	ADRB1	63	45
CC(=O)c1cccc(OC[C@H](O)CNCc2c(C)cccc2C)c1	ZINC000819172617	EG	On-Demand	Anodyne	ADRB3	36	40
CC(=O)c1cccc(OC[C@H](O)CNCc2c(C)cccc2C)c1	ZINC000819172617	EG	On-Demand	Anodyne	ABCB1	32	56
CC(=O)c1cccc(OC[C@H](O)CNCc2c(C)cccc2C)c1	ZINC000819172617	EG	On-Demand	Anodyne	PDS	63	38
CC(=O)c1cccc(OC[C@@H](O)CNCc2c(C)cccc2C)c1	ZINC000819172618	EG	On-Demand	Anodyne	ADRB2	43	50
CC(=O)c1cccc(OC[C@@H](O)CNCc2c(C)cccc2C)c1	ZINC000819172618	EG	On-Demand	Anodyne	ADRB1	63	45
CC(=O)c1cccc(OC[C@@H](O)CNCc2c(C)cccc2C)c1	ZINC000819172618	EG	On-Demand	Anodyne	ADRB3	36	40
CC(=O)c1cccc(OC[C@@H](O)CNCc2c(C)cccc2C)c1	ZINC000819172618	EG	On-Demand	Anodyne	ABCB1	32	56
CC(=O)c1cccc(OC[C@@H](O)CNCc2c(C)cccc2C)c1	ZINC000819172618	EG	On-Demand	Anodyne	PDS	63	38
O=C1C[C@@H](NC[C@@H](O)c2ccccc2Br)CN1C1CCCCC1	ZINC000819172632	GG	On-Demand	Anodyne	INHA	18	41
O=C1C[C@@H](NC[C@H](O)c2ccccc2Br)CN1C1CCCCC1	ZINC000819172633	GG	On-Demand	Anodyne	INHA	18	41
O=C1C[C@H](NC[C@H](O)c2ccccc2Br)CN1C1CCCCC1	ZINC000819172635	GG	On-Demand	Anodyne	INHA	18	41
O=C1C[C@H](NC[C@@H](O)c2ccccc2Br)CN1C1CCCCC1	ZINC000819172636	GG	On-Demand	Anodyne	INHA	18	41
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1ccccc1C(F)(F)F	ZINC000819172638	GG	On-Demand	Anodyne	SLC18A3	49	42
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1ccccc1C(F)(F)F	ZINC000819172643	GG	On-Demand	Anodyne	SLC18A3	49	42
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccccc1C(F)(F)F	ZINC000819172647	GG	On-Demand	Anodyne	SLC18A3	49	42
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccccc1C(F)(F)F	ZINC000819172651	GG	On-Demand	Anodyne	SLC18A3	49	42
O=C(NCc1cccnc1N1CCCCC1)C(F)=C1CCC1	ZINC000819172656	DG	On-Demand	Anodyne	SCN2A	20	48
O=C(NCc1cccnc1N1CCCCC1)C(F)=C1CCC1	ZINC000819172656	DG	On-Demand	Anodyne	SCN10A	21	48
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)CC2CC2)c(C)c1	ZINC000819172666	ED	On-Demand	Anodyne	ADRB2	33	43
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)CC2CC2)c(C)c1	ZINC000819172666	ED	On-Demand	Anodyne	ADRB1	48	43
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)CC2CC2)c(C)c1	ZINC000819172667	ED	On-Demand	Anodyne	ADRB2	33	43
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)CC2CC2)c(C)c1	ZINC000819172667	ED	On-Demand	Anodyne	ADRB1	48	43
O=S(=O)(CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)CC1CC1	ZINC000819172672	FE	On-Demand	Anodyne	ADRB3	25	40
O=S(=O)(CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)CC1CC1	ZINC000819172673	FE	On-Demand	Anodyne	ADRB3	25	40
O=S(=O)(CCNC[C@@H](O)Cc1ccc2ccccc2c1)CC1CC1	ZINC000819172675	EE	On-Demand	Anodyne	ADRB2	27	40
O=S(=O)(CCNC[C@@H](O)Cc1ccc2ccccc2c1)CC1CC1	ZINC000819172675	EE	On-Demand	Anodyne	ADRB1	37	41
O=S(=O)(CCNC[C@@H](O)Cc1ccc2ccccc2c1)CC1CC1	ZINC000819172675	EE	On-Demand	Anodyne	ADRB3	34	40
O=S(=O)(CCNC[C@H](O)Cc1ccc2ccccc2c1)CC1CC1	ZINC000819172676	EE	On-Demand	Anodyne	ADRB2	27	40
O=S(=O)(CCNC[C@H](O)Cc1ccc2ccccc2c1)CC1CC1	ZINC000819172676	EE	On-Demand	Anodyne	ADRB1	37	41
O=S(=O)(CCNC[C@H](O)Cc1ccc2ccccc2c1)CC1CC1	ZINC000819172676	EE	On-Demand	Anodyne	ADRB3	34	40
O=S(=O)(CCNC[C@@H](O)COc1c(Cl)cccc1Cl)CC1CC1	ZINC000819172697	GE	On-Demand	Anodyne	ADRB2	32	40
O=S(=O)(CCNC[C@@H](O)COc1c(Cl)cccc1Cl)CC1CC1	ZINC000819172697	GE	On-Demand	Anodyne	ADRB1	52	43
O=S(=O)(CCNC[C@H](O)COc1c(Cl)cccc1Cl)CC1CC1	ZINC000819172698	GE	On-Demand	Anodyne	ADRB2	32	40
O=S(=O)(CCNC[C@H](O)COc1c(Cl)cccc1Cl)CC1CC1	ZINC000819172698	GE	On-Demand	Anodyne	ADRB1	52	43
O[C@H]1CCC[C@@H]1N1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819172699	EE	On-Demand	Anodyne	ADRB3	25	44
O[C@H]1CCC[C@@H]1N1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819172699	EE	On-Demand	Anodyne	SLC18A3	33	49
O[C@@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1ccc(Cl)cc1	ZINC000819172703	EE	On-Demand	Anodyne	ADRB3	25	44
O[C@@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1ccc(Cl)cc1	ZINC000819172703	EE	On-Demand	Anodyne	SLC18A3	33	49
O[C@@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1ccc(Cl)cc1	ZINC000819172707	EE	On-Demand	Anodyne	ADRB3	25	44
O[C@@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1ccc(Cl)cc1	ZINC000819172707	EE	On-Demand	Anodyne	SLC18A3	33	49
O[C@H]1CCC[C@H]1N1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819172711	EE	On-Demand	Anodyne	ADRB3	25	44
O[C@H]1CCC[C@H]1N1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819172711	EE	On-Demand	Anodyne	SLC18A3	33	49
O[C@H]1CCCC[C@@H]1N1CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819172762	FF	On-Demand	Anodyne	OPRL1	34	40
O[C@H]1CCCC[C@@H]1N1CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819172762	FF	On-Demand	Anodyne	SLC18A3	64	44
O[C@@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccccc1Cl	ZINC000819172763	FF	On-Demand	Anodyne	OPRL1	34	40
O[C@@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccccc1Cl	ZINC000819172763	FF	On-Demand	Anodyne	SLC18A3	64	44
O[C@@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccccc1Cl	ZINC000819172764	FF	On-Demand	Anodyne	OPRL1	34	40
O[C@@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccccc1Cl	ZINC000819172764	FF	On-Demand	Anodyne	SLC18A3	64	44
O[C@H]1CCCC[C@H]1N1CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819172765	FF	On-Demand	Anodyne	OPRL1	34	40
O[C@H]1CCCC[C@H]1N1CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819172765	FF	On-Demand	Anodyne	SLC18A3	64	44
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)cc1)CC1CC1	ZINC000819172782	ED	On-Demand	Anodyne	ADRB2	46	49
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)cc1)CC1CC1	ZINC000819172782	ED	On-Demand	Anodyne	ADRB1	83	53
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)cc1)CC1CC1	ZINC000819172782	ED	On-Demand	Anodyne	GRIN1	24	53
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)cc1)CC1CC1	ZINC000819172782	ED	On-Demand	Anodyne	ADRB3	57	49
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)cc1)CC1CC1	ZINC000819172783	ED	On-Demand	Anodyne	ADRB2	46	49
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)cc1)CC1CC1	ZINC000819172783	ED	On-Demand	Anodyne	ADRB1	83	53
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)cc1)CC1CC1	ZINC000819172783	ED	On-Demand	Anodyne	GRIN1	24	53
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)cc1)CC1CC1	ZINC000819172783	ED	On-Demand	Anodyne	ADRB3	57	49
COc1ccc(OC)c([C@H](O)CNCCS(=O)(=O)CC2CC2)c1	ZINC000819172805	ED	On-Demand	Anodyne	ADRB2	20	43
O=S(=O)(CCNC[C@H](O)COc1cccc2[nH]ccc12)CC1CC1	ZINC000819172806	FD	On-Demand	Anodyne	ADRB2	33	60
O=S(=O)(CCNC[C@H](O)COc1cccc2[nH]ccc12)CC1CC1	ZINC000819172806	FD	On-Demand	Anodyne	ADRB1	65	55
O=S(=O)(CCNC[C@H](O)COc1cccc2[nH]ccc12)CC1CC1	ZINC000819172806	FD	On-Demand	Anodyne	HTR1A	16	60
O=S(=O)(CCNC[C@H](O)COc1cccc2[nH]ccc12)CC1CC1	ZINC000819172806	FD	On-Demand	Anodyne	SLC6A4	19	43
O=S(=O)(CCNC[C@H](O)COc1cccc2[nH]ccc12)CC1CC1	ZINC000819172806	FD	On-Demand	Anodyne	ADRB3	30	55
O=S(=O)(CCNC[C@@H](O)COc1cccc2[nH]ccc12)CC1CC1	ZINC000819172807	FD	On-Demand	Anodyne	ADRB2	33	60
O=S(=O)(CCNC[C@@H](O)COc1cccc2[nH]ccc12)CC1CC1	ZINC000819172807	FD	On-Demand	Anodyne	ADRB1	65	55
O=S(=O)(CCNC[C@@H](O)COc1cccc2[nH]ccc12)CC1CC1	ZINC000819172807	FD	On-Demand	Anodyne	HTR1A	16	60
O=S(=O)(CCNC[C@@H](O)COc1cccc2[nH]ccc12)CC1CC1	ZINC000819172807	FD	On-Demand	Anodyne	SLC6A4	19	43
O=S(=O)(CCNC[C@@H](O)COc1cccc2[nH]ccc12)CC1CC1	ZINC000819172807	FD	On-Demand	Anodyne	ADRB3	30	55
CS(=O)(=O)c1ccc([C@@H](O)CNCCS(=O)(=O)CC2CC2)cc1	ZINC000819172826	FC	On-Demand	Anodyne	ADRB2	17	41
CS(=O)(=O)c1ccc([C@H](O)CNCCS(=O)(=O)CC2CC2)cc1	ZINC000819172827	FC	On-Demand	Anodyne	ADRB2	17	41
C=CCC1(C(=O)N[C@@H](C)c2cccc(N3CCOC3=O)c2)CCOCC1	ZINC000819172847	FG	On-Demand	Mild	KCNQ2	17	41
C=CCC1(C(=O)N[C@H](C)c2cccc(N3CCOC3=O)c2)CCOCC1	ZINC000819172849	FG	On-Demand	Mild	KCNQ2	17	41
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)CC2CC2)cc1	ZINC000819172854	ED	On-Demand	Anodyne	ADRB2	57	49
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)CC2CC2)cc1	ZINC000819172854	ED	On-Demand	Anodyne	ADRB1	84	56
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)CC2CC2)cc1	ZINC000819172854	ED	On-Demand	Anodyne	GRIN1	16	45
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)CC2CC2)cc1	ZINC000819172854	ED	On-Demand	Anodyne	ADRB3	59	49
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)CC2CC2)cc1	ZINC000819172859	ED	On-Demand	Anodyne	ADRB2	57	49
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)CC2CC2)cc1	ZINC000819172859	ED	On-Demand	Anodyne	ADRB1	84	56
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)CC2CC2)cc1	ZINC000819172859	ED	On-Demand	Anodyne	GRIN1	16	45
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)CC2CC2)cc1	ZINC000819172859	ED	On-Demand	Anodyne	ADRB3	59	49
O=C1C[C@H](NC[C@@H](O)c2ccc(Br)cc2)CN1C1CCCCC1	ZINC000819172872	GG	On-Demand	Anodyne	INHA	18	44
O=C1C[C@@H](NC[C@@H](O)c2ccc(Br)cc2)CN1C1CCCCC1	ZINC000819172874	GG	On-Demand	Anodyne	INHA	18	44
O=C1C[C@H](NC[C@H](O)c2ccc(Br)cc2)CN1C1CCCCC1	ZINC000819172876	GG	On-Demand	Anodyne	INHA	18	44
O=C1C[C@@H](NC[C@H](O)c2ccc(Br)cc2)CN1C1CCCCC1	ZINC000819172877	GG	On-Demand	Anodyne	INHA	18	44
O=C1C[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)CN1C1CCCCC1	ZINC000819172879	FG	On-Demand	Anodyne	INHA	18	41
O=C1C[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)CN1C1CCCCC1	ZINC000819172884	FG	On-Demand	Anodyne	INHA	18	41
O=C1C[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)CN1C1CCCCC1	ZINC000819172886	FG	On-Demand	Anodyne	INHA	18	41
O=C1C[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)CN1C1CCCCC1	ZINC000819172889	FG	On-Demand	Anodyne	INHA	18	41
O=S(=O)(CCNC[C@H](O)c1cccc(F)c1)c1ccc(F)cc1	ZINC000819172901	EE	On-Demand	Anodyne	ADRB1	40	42
O=S(=O)(CCNC[C@H](O)c1cccc(F)c1)c1ccc(F)cc1	ZINC000819172901	EE	On-Demand	Anodyne	ADRB3	100	43
O=S(=O)(CCNC[C@@H](O)c1cccc(F)c1)c1ccc(F)cc1	ZINC000819172903	EE	On-Demand	Anodyne	ADRB1	40	42
O=S(=O)(CCNC[C@@H](O)c1cccc(F)c1)c1ccc(F)cc1	ZINC000819172903	EE	On-Demand	Anodyne	ADRB3	100	43
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN([C@@H]3CCCC[C@@H]3O)CC2)cc1	ZINC000819172920	GD	On-Demand	Anodyne	ADRB3	29	43
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN([C@H]3CCCC[C@@H]3O)CC2)cc1	ZINC000819172921	GD	On-Demand	Anodyne	ADRB3	29	43
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN([C@@H]3CCCC[C@H]3O)CC2)cc1	ZINC000819172922	GD	On-Demand	Anodyne	ADRB3	29	43
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN([C@H]3CCCC[C@H]3O)CC2)cc1	ZINC000819172923	GD	On-Demand	Anodyne	ADRB3	29	43
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1ccc(F)c(F)c1	ZINC000819172924	FE	On-Demand	Anodyne	SLC18A3	32	40
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1ccc(F)c(F)c1	ZINC000819172925	FE	On-Demand	Anodyne	SLC18A3	32	40
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccc(F)c(F)c1	ZINC000819172926	FE	On-Demand	Anodyne	SLC18A3	32	40
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccc(F)c(F)c1	ZINC000819172927	FE	On-Demand	Anodyne	SLC18A3	32	40
O=[N+]([O-])c1ccc([C@H](O)CNC2CCN([C@@H]3CCCC[C@@H]3O)CC2)cc1	ZINC000819172928	FD	On-Demand	Bother	SLC18A3	32	57
O=[N+]([O-])c1ccc([C@H](O)CNC2CCN([C@H]3CCCC[C@@H]3O)CC2)cc1	ZINC000819172929	FD	On-Demand	Bother	SLC18A3	32	57
O=[N+]([O-])c1ccc([C@H](O)CNC2CCN([C@@H]3CCCC[C@H]3O)CC2)cc1	ZINC000819172930	FD	On-Demand	Bother	SLC18A3	32	57
O=[N+]([O-])c1ccc([C@H](O)CNC2CCN([C@H]3CCCC[C@H]3O)CC2)cc1	ZINC000819172931	FD	On-Demand	Bother	SLC18A3	32	57
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1ccc(Br)cc1	ZINC000819172938	GF	On-Demand	Anodyne	SLC18A3	40	43
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1ccc(Br)cc1	ZINC000819172939	GF	On-Demand	Anodyne	SLC18A3	40	43
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccc(Br)cc1	ZINC000819172940	GF	On-Demand	Anodyne	SLC18A3	40	43
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccc(Br)cc1	ZINC000819172941	GF	On-Demand	Anodyne	SLC18A3	40	43
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1cccnc1	ZINC000819172962	DD	On-Demand	Anodyne	ADRB1	28	44
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1cccnc1	ZINC000819172962	DD	On-Demand	Anodyne	ADRB3	80	52
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1cccnc1	ZINC000819172962	DD	On-Demand	Anodyne	SLC18A3	42	39
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1cccnc1	ZINC000819172963	DD	On-Demand	Anodyne	ADRB1	28	44
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1cccnc1	ZINC000819172963	DD	On-Demand	Anodyne	ADRB3	80	52
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1cccnc1	ZINC000819172963	DD	On-Demand	Anodyne	SLC18A3	42	39
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1cccnc1	ZINC000819172964	DD	On-Demand	Anodyne	ADRB1	28	44
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1cccnc1	ZINC000819172964	DD	On-Demand	Anodyne	ADRB3	80	52
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1cccnc1	ZINC000819172964	DD	On-Demand	Anodyne	SLC18A3	42	39
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1cccnc1	ZINC000819172965	DD	On-Demand	Anodyne	ADRB1	28	44
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1cccnc1	ZINC000819172965	DD	On-Demand	Anodyne	ADRB3	80	52
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1cccnc1	ZINC000819172965	DD	On-Demand	Anodyne	SLC18A3	42	39
N#Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)CC2CC2)cc1	ZINC000819172967	EC	On-Demand	Mild	ADRB2	42	42
N#Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)CC2CC2)cc1	ZINC000819172967	EC	On-Demand	Mild	ADRB1	79	52
N#Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)CC2CC2)cc1	ZINC000819172967	EC	On-Demand	Mild	ADRB3	48	42
N#Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)CC2CC2)cc1	ZINC000819172968	EC	On-Demand	Mild	ADRB2	42	42
N#Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)CC2CC2)cc1	ZINC000819172968	EC	On-Demand	Mild	ADRB1	79	52
N#Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)CC2CC2)cc1	ZINC000819172968	EC	On-Demand	Mild	ADRB3	48	42
O=C(Cc1nsc2ccccc12)NCc1cccnc1N1CCCCC1	ZINC000819172969	FH	On-Demand	Anodyne	HTR1A	21	47
O=C(Cc1nsc2ccccc12)NCc1cccnc1N1CCCCC1	ZINC000819172969	FH	On-Demand	Anodyne	DRD2	26	47
O=C(Cc1nsc2ccccc12)NCc1cccnc1N1CCCCC1	ZINC000819172969	FH	On-Demand	Anodyne	SCN2A	20	47
O=C(Cc1nsc2ccccc12)NCc1cccnc1N1CCCCC1	ZINC000819172969	FH	On-Demand	Anodyne	LIPA	54	33
O=C(Cc1nsc2ccccc12)NCc1cccnc1N1CCCCC1	ZINC000819172969	FH	On-Demand	Anodyne	SCN10A	21	47
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1CC(C)(C)Oc2cc(F)ccc21	ZINC000819172970	GG	On-Demand	Anodyne	CTSD	29	42
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1CC(C)(C)Oc2cc(F)ccc21	ZINC000819172970	GG	On-Demand	Anodyne	BACE1	17	44
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CC(C)(C)Oc2cc(F)ccc21	ZINC000819172971	GG	On-Demand	Anodyne	CTSD	29	42
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CC(C)(C)Oc2cc(F)ccc21	ZINC000819172971	GG	On-Demand	Anodyne	BACE1	17	44
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CC(C)(C)Oc2cc(F)ccc21	ZINC000819172972	GG	On-Demand	Anodyne	CTSD	29	42
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CC(C)(C)Oc2cc(F)ccc21	ZINC000819172972	GG	On-Demand	Anodyne	BACE1	17	44
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@H]1CC(C)(C)Oc2cc(F)ccc21	ZINC000819172973	GG	On-Demand	Anodyne	CTSD	29	42
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@H]1CC(C)(C)Oc2cc(F)ccc21	ZINC000819172973	GG	On-Demand	Anodyne	BACE1	17	44
O=S(=O)(CCNC[C@H](O)COc1cccc(Br)c1)CC1CC1	ZINC000819172982	GD	On-Demand	Anodyne	ADRB2	43	44
O=S(=O)(CCNC[C@H](O)COc1cccc(Br)c1)CC1CC1	ZINC000819172982	GD	On-Demand	Anodyne	ADRB1	74	46
O=S(=O)(CCNC[C@H](O)COc1cccc(Br)c1)CC1CC1	ZINC000819172982	GD	On-Demand	Anodyne	ADRB3	52	41
O=S(=O)(CCNC[C@@H](O)COc1cccc(Br)c1)CC1CC1	ZINC000819172983	GD	On-Demand	Anodyne	ADRB2	43	44
O=S(=O)(CCNC[C@@H](O)COc1cccc(Br)c1)CC1CC1	ZINC000819172983	GD	On-Demand	Anodyne	ADRB1	74	46
O=S(=O)(CCNC[C@@H](O)COc1cccc(Br)c1)CC1CC1	ZINC000819172983	GD	On-Demand	Anodyne	ADRB3	52	41
C=CCC1(C(=O)NCc2cccnc2N2CCCCC2)CCOCC1	ZINC000819172984	EG	On-Demand	Mild	SCN2A	19	45
C=CCC1(C(=O)NCc2cccnc2N2CCCCC2)CCOCC1	ZINC000819172984	EG	On-Demand	Mild	SCN10A	24	45
C=CCCn1cc(C(=O)NCc2cccnc2N2CCCCC2)nn1	ZINC000819172986	EE	On-Demand	Mild	SCN2A	20	48
C=CCCn1cc(C(=O)NCc2cccnc2N2CCCCC2)nn1	ZINC000819172986	EE	On-Demand	Mild	SCN10A	24	48
O=S(=O)(CCNC[C@@H](O)Cc1ccc(F)cc1)CC1CC1	ZINC000819173015	DD	On-Demand	Anodyne	ADRB1	16	41
O=S(=O)(CCNC[C@H](O)Cc1ccc(F)cc1)CC1CC1	ZINC000819173016	DD	On-Demand	Anodyne	ADRB1	16	41
CN(C)c1ccc(NC(=O)CCNC2CCN([C@H]3CCCC[C@H]3O)CC2)cc1	ZINC000819173022	GE	On-Demand	Anodyne	SLC18A3	35	51
CN(C)c1ccc(NC(=O)CCNC2CCN([C@@H]3CCCC[C@H]3O)CC2)cc1	ZINC000819173024	GE	On-Demand	Anodyne	SLC18A3	35	51
COc1ccc(OC)c([C@H](O)CNCCc2c(C)cccc2C)c1	ZINC000819173025	EG	On-Demand	Anodyne	ADRB2	35	50
COc1ccc(OC)c([C@H](O)CNCCc2c(C)cccc2C)c1	ZINC000819173025	EG	On-Demand	Anodyne	ADRB1	37	42
COc1ccc(OC)c([C@H](O)CNCCc2c(C)cccc2C)c1	ZINC000819173025	EG	On-Demand	Anodyne	ADRB3	29	42
COc1ccc(OC)c([C@H](O)CNCCc2c(C)cccc2C)c1	ZINC000819173025	EG	On-Demand	Anodyne	MTNR1A	38	42
CN(C)c1ccc(NC(=O)CCNC2CCN([C@@H]3CCCC[C@@H]3O)CC2)cc1	ZINC000819173026	GE	On-Demand	Anodyne	SLC18A3	35	51
CN(C)c1ccc(NC(=O)CCNC2CCN([C@H]3CCCC[C@@H]3O)CC2)cc1	ZINC000819173028	GE	On-Demand	Anodyne	SLC18A3	35	51
COc1ccc(OC)c([C@H](O)CNC2CCN([C@@H]3CCCC[C@@H]3O)CC2)c1	ZINC000819173042	GE	On-Demand	Anodyne	SLC18A3	44	36
COc1ccc(OC)c([C@H](O)CNC2CCN([C@H]3CCCC[C@@H]3O)CC2)c1	ZINC000819173044	GE	On-Demand	Anodyne	SLC18A3	44	36
COc1ccc(OC)c([C@H](O)CNC2CCN([C@@H]3CCCC[C@H]3O)CC2)c1	ZINC000819173046	GE	On-Demand	Anodyne	SLC18A3	44	36
COc1ccc(OC)c([C@H](O)CNC2CCN([C@H]3CCCC[C@H]3O)CC2)c1	ZINC000819173048	GE	On-Demand	Anodyne	SLC18A3	44	36
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCS(=O)(=O)CC2CC2)CC1	ZINC000819173065	GD	On-Demand	Anodyne	GPR119	36	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCS(=O)(=O)CC2CC2)CC1	ZINC000819173067	GD	On-Demand	Anodyne	GPR119	36	45
O[C@H](CNC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1ccc(Br)cc1	ZINC000819173069	GE	On-Demand	Anodyne	SLC18A3	35	40
O[C@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1ccc(Br)cc1	ZINC000819173071	GE	On-Demand	Anodyne	SLC18A3	35	40
O[C@H](CNC1CCN([C@H]2CCC[C@@H]2O)CC1)c1ccc(Br)cc1	ZINC000819173073	GE	On-Demand	Anodyne	SLC18A3	35	40
O[C@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1ccc(Br)cc1	ZINC000819173075	GE	On-Demand	Anodyne	SLC18A3	35	40
O=C(NCc1cccnc1N1CCCCC1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819173088	GI	On-Demand	Anodyne	TRPV1	33	42
O=C(NCc1cccnc1N1CCCCC1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819173088	GI	On-Demand	Anodyne	P2RX7	46	39
O=C(NCc1cccnc1N1CCCCC1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819173088	GI	On-Demand	Anodyne	SCN2A	20	48
O=C(NCc1cccnc1N1CCCCC1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819173088	GI	On-Demand	Anodyne	EPHX2	17	43
O=C(NCc1cccnc1N1CCCCC1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819173088	GI	On-Demand	Anodyne	SCN10A	26	48
O[C@H]1CCC[C@@H]1N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819173090	DD	On-Demand	Anodyne	SLC18A3	83	47
O[C@H](CNC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1ccccc1	ZINC000819173091	DD	On-Demand	Anodyne	SLC18A3	83	47
O[C@@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1ccccc1	ZINC000819173092	DD	On-Demand	Anodyne	SLC18A3	83	47
O[C@@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1ccccc1	ZINC000819173094	DD	On-Demand	Anodyne	SLC18A3	83	47
O[C@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1ccccc1	ZINC000819173096	DD	On-Demand	Anodyne	SLC18A3	83	47
O[C@H](CNC1CCN([C@H]2CCC[C@@H]2O)CC1)c1ccccc1	ZINC000819173098	DD	On-Demand	Anodyne	SLC18A3	83	47
O[C@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1ccccc1	ZINC000819173100	DD	On-Demand	Anodyne	SLC18A3	83	47
O[C@H]1CCC[C@H]1N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819173101	DD	On-Demand	Anodyne	SLC18A3	83	47
O[C@H](CN[C@H]1CCOC2(CCCCC2)C1)c1cccc(Cl)c1	ZINC000819173150	DH	On-Demand	Anodyne	ADRB1	27	42
O[C@H](CN[C@H]1CCOC2(CCCCC2)C1)c1cccc(Cl)c1	ZINC000819173150	DH	On-Demand	Anodyne	ADRB3	43	49
O[C@H](CN[C@H]1CCOC2(CCCCC2)C1)c1cccc(Cl)c1	ZINC000819173150	DH	On-Demand	Anodyne	CYP3A4	43	36
O[C@H](CN[C@@H]1CCOC2(CCCCC2)C1)c1cccc(Cl)c1	ZINC000819173151	DH	On-Demand	Anodyne	ADRB1	27	42
O[C@H](CN[C@@H]1CCOC2(CCCCC2)C1)c1cccc(Cl)c1	ZINC000819173151	DH	On-Demand	Anodyne	ADRB3	43	49
O[C@H](CN[C@@H]1CCOC2(CCCCC2)C1)c1cccc(Cl)c1	ZINC000819173151	DH	On-Demand	Anodyne	CYP3A4	43	36
O[C@@H](CN[C@H]1CCOC2(CCCCC2)C1)c1cccc(Cl)c1	ZINC000819173152	DH	On-Demand	Anodyne	ADRB1	27	42
O[C@@H](CN[C@H]1CCOC2(CCCCC2)C1)c1cccc(Cl)c1	ZINC000819173152	DH	On-Demand	Anodyne	ADRB3	43	49
O[C@@H](CN[C@H]1CCOC2(CCCCC2)C1)c1cccc(Cl)c1	ZINC000819173152	DH	On-Demand	Anodyne	CYP3A4	43	36
O[C@@H](CN[C@@H]1CCOC2(CCCCC2)C1)c1cccc(Cl)c1	ZINC000819173153	DH	On-Demand	Anodyne	ADRB1	27	42
O[C@@H](CN[C@@H]1CCOC2(CCCCC2)C1)c1cccc(Cl)c1	ZINC000819173153	DH	On-Demand	Anodyne	ADRB3	43	49
O[C@@H](CN[C@@H]1CCOC2(CCCCC2)C1)c1cccc(Cl)c1	ZINC000819173153	DH	On-Demand	Anodyne	CYP3A4	43	36
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819173161	GG	On-Demand	Anodyne	SLC18A3	31	41
O[C@H]1CCCC[C@@H]1N1CCC(NC[C@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819173162	GG	On-Demand	Anodyne	SLC18A3	31	41
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819173163	GG	On-Demand	Anodyne	SLC18A3	31	41
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819173164	GG	On-Demand	Anodyne	SLC18A3	31	41
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819173165	GG	On-Demand	Anodyne	SLC18A3	31	41
O=S(=O)(CCNC[C@H](O)c1cccc(Br)c1)CC1CC1	ZINC000819173191	FD	On-Demand	Anodyne	ADRB3	51	39
O=S(=O)(CCNC[C@@H](O)c1cccc(Br)c1)CC1CC1	ZINC000819173192	FD	On-Demand	Anodyne	ADRB3	51	39
CCC(=O)Nc1ccccc1C(=O)NC[C@H]1CCCC1(C)C	ZINC000819173195	DH	On-Demand	Anodyne	KCNA3	39	41
CCC(=O)Nc1ccccc1C(=O)NC[C@H]1CCCC1(C)C	ZINC000819173195	DH	On-Demand	Anodyne	HCN1	41	33
CCC(=O)Nc1ccccc1C(=O)NC[C@H]1CCCC1(C)C	ZINC000819173195	DH	On-Demand	Anodyne	HCN4	41	33
CCC(=O)Nc1ccccc1C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819173197	DH	On-Demand	Anodyne	KCNA3	39	41
CCC(=O)Nc1ccccc1C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819173197	DH	On-Demand	Anodyne	HCN1	41	33
CCC(=O)Nc1ccccc1C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819173197	DH	On-Demand	Anodyne	HCN4	41	33
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCCc3c[nH]nc32)CC1	ZINC000819173230	FE	On-Demand	Anodyne	GPR119	33	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCCc3c[nH]nc32)CC1	ZINC000819173232	FE	On-Demand	Anodyne	GPR119	33	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCCc3c[nH]nc32)CC1	ZINC000819173234	FE	On-Demand	Anodyne	GPR119	33	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCCc3c[nH]nc32)CC1	ZINC000819173236	FE	On-Demand	Anodyne	GPR119	33	41
O=C(Cc1ccc(-n2cnnc2)cc1)NCc1cccnc1N1CCCCC1	ZINC000819173238	GF	On-Demand	Anodyne	SCN2A	20	49
O=C(Cc1ccc(-n2cnnc2)cc1)NCc1cccnc1N1CCCCC1	ZINC000819173238	GF	On-Demand	Anodyne	SCN10A	21	49
O=S(=O)(CCNC[C@@H](O)COc1ccccc1Cl)CC1CC1	ZINC000819173240	ED	On-Demand	Anodyne	ADRB2	46	54
O=S(=O)(CCNC[C@@H](O)COc1ccccc1Cl)CC1CC1	ZINC000819173240	ED	On-Demand	Anodyne	ADRB1	74	44
O=S(=O)(CCNC[C@@H](O)COc1ccccc1Cl)CC1CC1	ZINC000819173240	ED	On-Demand	Anodyne	ADRB3	45	42
O=S(=O)(CCNC[C@@H](O)COc1ccccc1Cl)CC1CC1	ZINC000819173240	ED	On-Demand	Anodyne	ABCB1	22	41
O=S(=O)(CCNC[C@H](O)COc1ccccc1Cl)CC1CC1	ZINC000819173242	ED	On-Demand	Anodyne	ADRB2	46	54
O=S(=O)(CCNC[C@H](O)COc1ccccc1Cl)CC1CC1	ZINC000819173242	ED	On-Demand	Anodyne	ADRB1	74	44
O=S(=O)(CCNC[C@H](O)COc1ccccc1Cl)CC1CC1	ZINC000819173242	ED	On-Demand	Anodyne	ADRB3	45	42
O=S(=O)(CCNC[C@H](O)COc1ccccc1Cl)CC1CC1	ZINC000819173242	ED	On-Demand	Anodyne	ABCB1	22	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCS(=O)(=O)CC2CC2)c1	ZINC000819173244	ED	On-Demand	Bother	ADRB3	41	34
O=[N+]([O-])c1cccc([C@H](O)CNCCS(=O)(=O)CC2CC2)c1	ZINC000819173245	ED	On-Demand	Bother	ADRB3	41	34
O=C(CCc1cccc(OC(F)F)c1)NCc1nc(Cc2ccccc2)no1	ZINC000819173275	GH	On-Demand	Anodyne	PLA2G4A	26	40
CC1(C)CCC[C@H]1CNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1	ZINC000819173359	FF	On-Demand	Anodyne	LPL	45	36
CC1(C)CCC[C@H]1CNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1	ZINC000819173359	FF	On-Demand	Anodyne	CACNA1I	44	34
O[C@@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819173366	GG	On-Demand	Anodyne	SLC18A3	31	41
O[C@@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819173367	GG	On-Demand	Anodyne	SLC18A3	31	41
O[C@H]1CCCC[C@H]1N1CCC(NC[C@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819173368	GG	On-Demand	Anodyne	SLC18A3	31	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ccc(Cl)cc3)CC1)C2	ZINC000819173373	GF	On-Demand	Anodyne	SSTR1	50	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ccc(Cl)cc3)CC1)C2	ZINC000819173373	GF	On-Demand	Anodyne	ADAM10	38	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ccc(Cl)cc3)CC1)C2	ZINC000819173374	GF	On-Demand	Anodyne	SSTR1	50	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ccc(Cl)cc3)CC1)C2	ZINC000819173374	GF	On-Demand	Anodyne	ADAM10	38	41
O[C@H](CNC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1cccc(F)c1	ZINC000819173401	DD	On-Demand	Anodyne	SLC18A3	40	38
O[C@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1cccc(F)c1	ZINC000819173402	DD	On-Demand	Anodyne	SLC18A3	40	38
O[C@H](CNC1CCN([C@H]2CCC[C@@H]2O)CC1)c1cccc(F)c1	ZINC000819173403	DD	On-Demand	Anodyne	SLC18A3	40	38
O[C@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1cccc(F)c1	ZINC000819173404	DD	On-Demand	Anodyne	SLC18A3	40	38
C=C(Br)CNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819173460	ED	On-Demand	Mild	DRD4	40	31
C=C(Br)CNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819173461	ED	On-Demand	Mild	DRD4	40	31
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173467	HF	On-Demand	Anodyne	ACE	22	45
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173467	HF	On-Demand	Anodyne	CTRA_BOVIN	61	33
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173467	HF	On-Demand	Anodyne	KLK3	86	37
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173467	HF	On-Demand	Anodyne	CTSB	72	44
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173467	HF	On-Demand	Anodyne	PAPA1_CARPA	69	46
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173467	HF	On-Demand	Anodyne	CYSP_TRYCR	55	41
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173467	HF	On-Demand	Anodyne	CTSG	42	33
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173467	HF	On-Demand	Anodyne	CTSK	67	50
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173467	HF	On-Demand	Anodyne	CTSL	54	46
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173467	HF	On-Demand	Anodyne	CAPNS1	72	39
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173467	HF	On-Demand	Anodyne	CELA2A	50	33
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173467	HF	On-Demand	Anodyne	CTSS	40	50
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173467	HF	On-Demand	Anodyne	CAPN1	98	46
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173467	HF	On-Demand	Anodyne	CASP1	24	40
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173467	HF	On-Demand	Anodyne	CAPN2	142	46
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173467	HF	On-Demand	Anodyne	NPR	77	39
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173467	HF	On-Demand	Anodyne	PSMB5	50	41
CC1(C)CCC[C@H]1CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173469	HF	On-Demand	Anodyne	ACE	22	45
CC1(C)CCC[C@H]1CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173469	HF	On-Demand	Anodyne	CTRA_BOVIN	61	33
CC1(C)CCC[C@H]1CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173469	HF	On-Demand	Anodyne	KLK3	86	37
CC1(C)CCC[C@H]1CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173469	HF	On-Demand	Anodyne	CTSB	72	44
CC1(C)CCC[C@H]1CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173469	HF	On-Demand	Anodyne	PAPA1_CARPA	69	46
CC1(C)CCC[C@H]1CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173469	HF	On-Demand	Anodyne	CYSP_TRYCR	55	41
CC1(C)CCC[C@H]1CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173469	HF	On-Demand	Anodyne	CTSG	42	33
CC1(C)CCC[C@H]1CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173469	HF	On-Demand	Anodyne	CTSK	67	50
CC1(C)CCC[C@H]1CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173469	HF	On-Demand	Anodyne	CTSL	54	46
CC1(C)CCC[C@H]1CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173469	HF	On-Demand	Anodyne	CAPNS1	72	39
CC1(C)CCC[C@H]1CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173469	HF	On-Demand	Anodyne	CELA2A	50	33
CC1(C)CCC[C@H]1CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173469	HF	On-Demand	Anodyne	CTSS	40	50
CC1(C)CCC[C@H]1CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173469	HF	On-Demand	Anodyne	CAPN1	98	46
CC1(C)CCC[C@H]1CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173469	HF	On-Demand	Anodyne	CASP1	24	40
CC1(C)CCC[C@H]1CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173469	HF	On-Demand	Anodyne	CAPN2	142	46
CC1(C)CCC[C@H]1CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173469	HF	On-Demand	Anodyne	NPR	77	39
CC1(C)CCC[C@H]1CNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819173469	HF	On-Demand	Anodyne	PSMB5	50	41
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819173495	DG	On-Demand	Anodyne	PAPA1_CARPA	36	42
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819173499	DG	On-Demand	Anodyne	PAPA1_CARPA	36	42
CN(C[C@H](O)CN[C@@H]1CC(C)(C)Oc2cc(F)ccc21)C(=O)OC(C)(C)C	ZINC000819173502	GG	On-Demand	Anodyne	CTSD	29	42
CN(C[C@H](O)CN[C@@H]1CC(C)(C)Oc2cc(F)ccc21)C(=O)OC(C)(C)C	ZINC000819173502	GG	On-Demand	Anodyne	BACE1	19	44
CN(C[C@@H](O)CN[C@@H]1CC(C)(C)Oc2cc(F)ccc21)C(=O)OC(C)(C)C	ZINC000819173505	GG	On-Demand	Anodyne	CTSD	29	42
CN(C[C@@H](O)CN[C@@H]1CC(C)(C)Oc2cc(F)ccc21)C(=O)OC(C)(C)C	ZINC000819173505	GG	On-Demand	Anodyne	BACE1	19	44
CN(C[C@@H](O)CN[C@H]1CC(C)(C)Oc2cc(F)ccc21)C(=O)OC(C)(C)C	ZINC000819173507	GG	On-Demand	Anodyne	CTSD	29	42
CN(C[C@@H](O)CN[C@H]1CC(C)(C)Oc2cc(F)ccc21)C(=O)OC(C)(C)C	ZINC000819173507	GG	On-Demand	Anodyne	BACE1	19	44
CN(C[C@H](O)CN[C@H]1CC(C)(C)Oc2cc(F)ccc21)C(=O)OC(C)(C)C	ZINC000819173510	GG	On-Demand	Anodyne	CTSD	29	42
CN(C[C@H](O)CN[C@H]1CC(C)(C)Oc2cc(F)ccc21)C(=O)OC(C)(C)C	ZINC000819173510	GG	On-Demand	Anodyne	BACE1	19	44
C=C(C)C(C)(C)C(=O)NCc1cccnc1N1CCCCC1	ZINC000819173512	DG	On-Demand	Mild	SCN2A	19	48
C=C(C)C(C)(C)C(=O)NCc1cccnc1N1CCCCC1	ZINC000819173512	DG	On-Demand	Mild	SCN10A	20	48
O=C1C[C@@H](NC[C@H](O)c2ccccc2Cl)CN1C1CCCCC1	ZINC000819173553	EF	On-Demand	Anodyne	INHA	19	41
O=C1C[C@H](NC[C@H](O)c2ccccc2Cl)CN1C1CCCCC1	ZINC000819173555	EF	On-Demand	Anodyne	INHA	19	41
O=S(=O)(CCNC[C@@H](O)COc1cc(Cl)ccc1Cl)CC1CC1	ZINC000819173587	GE	On-Demand	Anodyne	ADRB2	24	41
O=S(=O)(CCNC[C@@H](O)COc1cc(Cl)ccc1Cl)CC1CC1	ZINC000819173587	GE	On-Demand	Anodyne	ADRB1	44	43
O=S(=O)(CCNC[C@H](O)COc1cc(Cl)ccc1Cl)CC1CC1	ZINC000819173588	GE	On-Demand	Anodyne	ADRB2	24	41
O=S(=O)(CCNC[C@H](O)COc1cc(Cl)ccc1Cl)CC1CC1	ZINC000819173588	GE	On-Demand	Anodyne	ADRB1	44	43
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819173599	FG	On-Demand	Anodyne	ADRB2	59	49
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819173599	FG	On-Demand	Anodyne	ADRB1	88	50
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819173599	FG	On-Demand	Anodyne	GRIN1	23	44
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819173599	FG	On-Demand	Anodyne	ADRB3	61	49
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819173599	FG	On-Demand	Anodyne	ABCB1	50	46
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819173599	FG	On-Demand	Anodyne	FFAR1	46	40
CC(=O)CCc1ccc(OC[C@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819173612	FG	On-Demand	Anodyne	ADRB2	59	49
CC(=O)CCc1ccc(OC[C@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819173612	FG	On-Demand	Anodyne	ADRB1	88	50
CC(=O)CCc1ccc(OC[C@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819173612	FG	On-Demand	Anodyne	GRIN1	23	44
CC(=O)CCc1ccc(OC[C@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819173612	FG	On-Demand	Anodyne	ADRB3	61	49
CC(=O)CCc1ccc(OC[C@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819173612	FG	On-Demand	Anodyne	ABCB1	50	46
CC(=O)CCc1ccc(OC[C@H](O)CNCc2c(C)cccc2C)cc1	ZINC000819173612	FG	On-Demand	Anodyne	FFAR1	46	40
CC(=O)Nc1cccc(CC(=O)NCc2cccnc2N2CCCCC2)c1	ZINC000819173614	FF	On-Demand	Anodyne	KCNQ2	42	38
CC(=O)Nc1cccc(CC(=O)NCc2cccnc2N2CCCCC2)c1	ZINC000819173614	FF	On-Demand	Anodyne	TRPV1	21	42
CC(=O)Nc1cccc(CC(=O)NCc2cccnc2N2CCCCC2)c1	ZINC000819173614	FF	On-Demand	Anodyne	P2RX7	24	43
CC(=O)Nc1cccc(CC(=O)NCc2cccnc2N2CCCCC2)c1	ZINC000819173614	FF	On-Demand	Anodyne	SCN2A	21	50
CC(=O)Nc1cccc(CC(=O)NCc2cccnc2N2CCCCC2)c1	ZINC000819173614	FF	On-Demand	Anodyne	SCN10A	23	50
CC(=O)Nc1cccc(CC(=O)NCc2cccnc2N2CCCCC2)c1	ZINC000819173614	FF	On-Demand	Anodyne	TAAR1	24	40
CC1(C)CCC[C@H]1CNC(=O)c1ccccc1OCC#N	ZINC000819173634	CG	On-Demand	Mild	KCNA3	45	38
CC1(C)CCC[C@H]1CNC(=O)c1ccccc1OCC#N	ZINC000819173634	CG	On-Demand	Mild	HCN1	83	41
CC1(C)CCC[C@H]1CNC(=O)c1ccccc1OCC#N	ZINC000819173634	CG	On-Demand	Mild	HCN4	61	41
O=S(=O)(CCNC[C@H](O)COc1ccc(F)cc1)CC1CC1	ZINC000819173641	EC	On-Demand	Anodyne	ADRB2	53	49
O=S(=O)(CCNC[C@H](O)COc1ccc(F)cc1)CC1CC1	ZINC000819173641	EC	On-Demand	Anodyne	ADRB1	88	53
O=S(=O)(CCNC[C@H](O)COc1ccc(F)cc1)CC1CC1	ZINC000819173641	EC	On-Demand	Anodyne	GRIN1	15	53
O=S(=O)(CCNC[C@H](O)COc1ccc(F)cc1)CC1CC1	ZINC000819173641	EC	On-Demand	Anodyne	ADRB3	60	49
O=S(=O)(CCNC[C@@H](O)COc1ccc(F)cc1)CC1CC1	ZINC000819173643	EC	On-Demand	Anodyne	ADRB2	53	49
O=S(=O)(CCNC[C@@H](O)COc1ccc(F)cc1)CC1CC1	ZINC000819173643	EC	On-Demand	Anodyne	ADRB1	88	53
O=S(=O)(CCNC[C@@H](O)COc1ccc(F)cc1)CC1CC1	ZINC000819173643	EC	On-Demand	Anodyne	GRIN1	15	53
O=S(=O)(CCNC[C@@H](O)COc1ccc(F)cc1)CC1CC1	ZINC000819173643	EC	On-Demand	Anodyne	ADRB3	60	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccnc1N1CCCCC1	ZINC000819173649	FF	On-Demand	Anodyne	SCN2A	18	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccnc1N1CCCCC1	ZINC000819173649	FF	On-Demand	Anodyne	SCN10A	28	44
COc1ccc(-c2nnc(S)n2CC(=O)NC[C@@H]2CCCC2(C)C)cc1	ZINC000819173659	FG	On-Demand	Anodyne	AVPR1B	54	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccnc1N1CCCCC1)C2	ZINC000819173660	GF	On-Demand	Anodyne	SCN2A	18	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccnc1N1CCCCC1)C2	ZINC000819173660	GF	On-Demand	Anodyne	SCN10A	18	43
COc1ccc(-c2nnc(S)n2CC(=O)NC[C@H]2CCCC2(C)C)cc1	ZINC000819173661	FG	On-Demand	Anodyne	AVPR1B	54	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccnc1N1CCCCC1)C2	ZINC000819173662	GF	On-Demand	Anodyne	SCN2A	18	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccnc1N1CCCCC1)C2	ZINC000819173662	GF	On-Demand	Anodyne	SCN10A	18	43
O=C(NCc1cccnc1N1CCCCC1)c1coc(=O)c2ccccc12	ZINC000819173663	FG	On-Demand	Anodyne	SCN2A	20	49
O=C(NCc1cccnc1N1CCCCC1)c1coc(=O)c2ccccc12	ZINC000819173663	FG	On-Demand	Anodyne	SCN10A	24	49
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)CC1CC1	ZINC000819173665	DD	On-Demand	Anodyne	ADRB2	40	39
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)CC1CC1	ZINC000819173665	DD	On-Demand	Anodyne	ADRB1	59	47
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)CC1CC1	ZINC000819173665	DD	On-Demand	Anodyne	ADRB3	80	52
O[C@H](CNC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1ccccc1F	ZINC000819173666	DD	On-Demand	Anodyne	SLC18A3	64	41
O[C@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1ccccc1F	ZINC000819173667	DD	On-Demand	Anodyne	SLC18A3	64	41
O[C@H](CNC1CCN([C@H]2CCC[C@@H]2O)CC1)c1ccccc1F	ZINC000819173668	DD	On-Demand	Anodyne	SLC18A3	64	41
O[C@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1ccccc1F	ZINC000819173669	DD	On-Demand	Anodyne	SLC18A3	64	41
O[C@H](CNC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1ccc(F)cc1	ZINC000819173676	DD	On-Demand	Anodyne	SLC18A3	54	39
O[C@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1ccc(F)cc1	ZINC000819173677	DD	On-Demand	Anodyne	SLC18A3	54	39
O[C@H](CNC1CCN([C@H]2CCC[C@@H]2O)CC1)c1ccc(F)cc1	ZINC000819173678	DD	On-Demand	Anodyne	SLC18A3	54	39
O[C@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1ccc(F)cc1	ZINC000819173679	DD	On-Demand	Anodyne	SLC18A3	54	39
O[C@H](CNC[C@H]1[C@H]2c3ccccc3C[C@H]21)c1cccc(Cl)c1	ZINC000819173680	DH	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CNC[C@H]1[C@H]2c3ccccc3C[C@H]21)c1cccc(Cl)c1	ZINC000819173680	DH	On-Demand	Anodyne	ADRB3	41	40
O[C@H](CNC[C@@H]1[C@H]2Cc3ccccc3[C@@H]21)c1cccc(Cl)c1	ZINC000819173681	DH	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CNC[C@@H]1[C@H]2Cc3ccccc3[C@@H]21)c1cccc(Cl)c1	ZINC000819173681	DH	On-Demand	Anodyne	ADRB3	41	40
O[C@H](CNC[C@@H]1[C@H]2Cc3ccccc3[C@H]21)c1cccc(Cl)c1	ZINC000819173682	DH	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CNC[C@@H]1[C@H]2Cc3ccccc3[C@H]21)c1cccc(Cl)c1	ZINC000819173682	DH	On-Demand	Anodyne	ADRB3	41	40
O[C@H](CNC[C@@H]1[C@@H]2Cc3ccccc3[C@@H]12)c1cccc(Cl)c1	ZINC000819173683	DH	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CNC[C@@H]1[C@@H]2Cc3ccccc3[C@@H]12)c1cccc(Cl)c1	ZINC000819173683	DH	On-Demand	Anodyne	ADRB3	41	40
O[C@@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1cccc2ccccc12	ZINC000819173699	FF	On-Demand	Anodyne	SLC18A3	49	40
O[C@H]1CCC[C@@H]1N1CCC(NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819173700	FF	On-Demand	Anodyne	SLC18A3	49	40
O[C@H]1CCC[C@H]1N1CCC(NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819173701	FF	On-Demand	Anodyne	SLC18A3	49	40
O[C@@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1cccc2ccccc12	ZINC000819173702	FF	On-Demand	Anodyne	SLC18A3	49	40
O=[N+]([O-])c1cccc([C@H](O)CNC2CCN([C@@H]3CCCC[C@@H]3O)CC2)c1	ZINC000819173703	FD	On-Demand	Bother	SLC18A3	32	51
O=[N+]([O-])c1cccc([C@H](O)CNC2CCN([C@H]3CCCC[C@@H]3O)CC2)c1	ZINC000819173704	FD	On-Demand	Bother	SLC18A3	32	51
O=[N+]([O-])c1cccc([C@H](O)CNC2CCN([C@@H]3CCCC[C@H]3O)CC2)c1	ZINC000819173705	FD	On-Demand	Bother	SLC18A3	32	51
O=[N+]([O-])c1cccc([C@H](O)CNC2CCN([C@H]3CCCC[C@H]3O)CC2)c1	ZINC000819173706	FD	On-Demand	Bother	SLC18A3	32	51
O[C@H]1CCC[C@H]1N1CCC(NCC2(O)CCCCC2)CC1	ZINC000819173721	CD	On-Demand	Anodyne	SLC18A3	34	45
O[C@H]1CCC[C@@H]1N1CCC(NCC2(O)CCCCC2)CC1	ZINC000819173722	CD	On-Demand	Anodyne	SLC18A3	34	45
O[C@@H]1CCC[C@H]1N1CCC(NCC2(O)CCCCC2)CC1	ZINC000819173723	CD	On-Demand	Anodyne	SLC18A3	34	45
O[C@@H]1CCC[C@@H]1N1CCC(NCC2(O)CCCCC2)CC1	ZINC000819173724	CD	On-Demand	Anodyne	SLC18A3	34	45
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1ccccc1	ZINC000819173729	DE	On-Demand	Anodyne	SLC18A3	87	50
O[C@H]1CCCC[C@@H]1N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819173730	DE	On-Demand	Anodyne	SLC18A3	87	50
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1ccccc1	ZINC000819173731	DE	On-Demand	Anodyne	SLC18A3	87	50
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccccc1	ZINC000819173732	DE	On-Demand	Anodyne	SLC18A3	87	50
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccccc1	ZINC000819173733	DE	On-Demand	Anodyne	SLC18A3	87	50
O[C@@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccccc1	ZINC000819173734	DE	On-Demand	Anodyne	SLC18A3	87	50
O[C@@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccccc1	ZINC000819173735	DE	On-Demand	Anodyne	SLC18A3	87	50
O[C@H]1CCCC[C@H]1N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819173736	DE	On-Demand	Anodyne	SLC18A3	87	50
O[C@@H](CN[C@@H]1CCOC2(CCCCC2)C1)c1cccnc1	ZINC000819173741	CF	On-Demand	Anodyne	ADRB3	49	43
O[C@@H](CN[C@H]1CCOC2(CCCCC2)C1)c1cccnc1	ZINC000819173742	CF	On-Demand	Anodyne	ADRB3	49	43
O[C@H](CN[C@@H]1CCOC2(CCCCC2)C1)c1cccnc1	ZINC000819173743	CF	On-Demand	Anodyne	ADRB3	49	43
O[C@H](CN[C@H]1CCOC2(CCCCC2)C1)c1cccnc1	ZINC000819173744	CF	On-Demand	Anodyne	ADRB3	49	43
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1ccc(Cl)cc1Cl	ZINC000819173747	GG	On-Demand	Anodyne	SLC18A3	32	45
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1ccc(Cl)cc1Cl	ZINC000819173748	GG	On-Demand	Anodyne	SLC18A3	32	45
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccc(Cl)cc1Cl	ZINC000819173749	GG	On-Demand	Anodyne	SLC18A3	32	45
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccc(Cl)cc1Cl	ZINC000819173750	GG	On-Demand	Anodyne	SLC18A3	32	45
O[C@H]1CCCC[C@@H]1N1CCC(NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819173751	FG	On-Demand	Anodyne	SLC18A3	56	43
O[C@H]1CCCC[C@H]1N1CCC(NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819173752	FG	On-Demand	Anodyne	SLC18A3	56	43
O[C@@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1cccc2ccccc12	ZINC000819173753	FG	On-Demand	Anodyne	SLC18A3	56	43
O[C@@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1cccc2ccccc12	ZINC000819173754	FG	On-Demand	Anodyne	SLC18A3	56	43
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)CC1CC1	ZINC000819173796	DD	On-Demand	Anodyne	ADRB2	40	39
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)CC1CC1	ZINC000819173796	DD	On-Demand	Anodyne	ADRB1	59	47
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)CC1CC1	ZINC000819173796	DD	On-Demand	Anodyne	ADRB3	80	52
C[C@H](CC(=O)NC[C@H]1CCCC1(C)C)NC(=O)OC(C)(C)C	ZINC000819173797	DG	On-Demand	Anodyne	ECE1	19	41
C[C@H](CC(=O)NC[C@@H]1CCCC1(C)C)NC(=O)OC(C)(C)C	ZINC000819173799	DG	On-Demand	Anodyne	ECE1	19	41
C[C@@H](CC(=O)NC[C@H]1CCCC1(C)C)NC(=O)OC(C)(C)C	ZINC000819173801	DG	On-Demand	Anodyne	ECE1	19	41
C[C@@H](CC(=O)NC[C@@H]1CCCC1(C)C)NC(=O)OC(C)(C)C	ZINC000819173803	DG	On-Demand	Anodyne	ECE1	19	41
COc1ccc2c(C)c(CCC(=O)NC[C@@H]3CCCC3(C)C)c(=O)oc2c1	ZINC000819173805	FH	On-Demand	Anodyne	MAOB	31	44
COc1ccc2c(C)c(CCC(=O)NC[C@@H]3CCCC3(C)C)c(=O)oc2c1	ZINC000819173805	FH	On-Demand	Anodyne	MTNR1A	46	37
COc1ccc2c(C)c(CCC(=O)NC[C@@H]3CCCC3(C)C)c(=O)oc2c1	ZINC000819173805	FH	On-Demand	Anodyne	MTNR1B	40	37
COc1ccc2c(C)c(CCC(=O)NC[C@@H]3CCCC3(C)C)c(=O)oc2c1	ZINC000819173805	FH	On-Demand	Anodyne	NQO1	20	43
COc1ccc2c(C)c(CCC(=O)NC[C@H]3CCCC3(C)C)c(=O)oc2c1	ZINC000819173807	FH	On-Demand	Anodyne	MAOB	31	44
COc1ccc2c(C)c(CCC(=O)NC[C@H]3CCCC3(C)C)c(=O)oc2c1	ZINC000819173807	FH	On-Demand	Anodyne	MTNR1A	46	37
COc1ccc2c(C)c(CCC(=O)NC[C@H]3CCCC3(C)C)c(=O)oc2c1	ZINC000819173807	FH	On-Demand	Anodyne	MTNR1B	40	37
COc1ccc2c(C)c(CCC(=O)NC[C@H]3CCCC3(C)C)c(=O)oc2c1	ZINC000819173807	FH	On-Demand	Anodyne	NQO1	20	43
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)NC[C@@H]1CCCC1(C)C)=NO2	ZINC000819173831	GG	On-Demand	Anodyne	GPR119	18	52
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)NC[C@H]1CCCC1(C)C)=NO2	ZINC000819173833	GG	On-Demand	Anodyne	GPR119	18	52
CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)NC[C@@H]3CCCC3(C)C)ccc2F)CC1	ZINC000819173839	IE	On-Demand	Anodyne	CACNA1I	63	35
CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)NC[C@H]3CCCC3(C)C)ccc2F)CC1	ZINC000819173841	IE	On-Demand	Anodyne	CACNA1I	63	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Oc1ccc(C(=O)Nc2cccnc2)cc1	ZINC000819173850	GG	On-Demand	Anodyne	RPS6KA3	19	40
CC1(C)CCC[C@H]1CNC(=O)CNC(=O)OCc1ccccc1	ZINC000819173859	DF	On-Demand	Anodyne	CTSB	31	46
CC1(C)CCC[C@H]1CNC(=O)CNC(=O)OCc1ccccc1	ZINC000819173859	DF	On-Demand	Anodyne	CTSK	30	46
CC1(C)CCC[C@H]1CNC(=O)CNC(=O)OCc1ccccc1	ZINC000819173859	DF	On-Demand	Anodyne	PREP	22	45
CC1(C)CCC[C@H]1CNC(=O)CNC(=O)OCc1ccccc1	ZINC000819173859	DF	On-Demand	Anodyne	CAPNS1	58	33
CC1(C)CCC[C@H]1CNC(=O)CNC(=O)OCc1ccccc1	ZINC000819173859	DF	On-Demand	Anodyne	CTSS	19	46
CC1(C)CCC[C@H]1CNC(=O)CNC(=O)OCc1ccccc1	ZINC000819173859	DF	On-Demand	Anodyne	CAPN1	49	38
CC1(C)CCC[C@H]1CNC(=O)CNC(=O)OCc1ccccc1	ZINC000819173859	DF	On-Demand	Anodyne	CAPN2	82	38
CC1(C)CCC[C@H]1CNC(=O)CNC(=O)OCc1ccccc1	ZINC000819173859	DF	On-Demand	Anodyne	NPR	67	37
CC1(C)CCC[C@H]1CNC(=O)CNC(=O)OCc1ccccc1	ZINC000819173859	DF	On-Demand	Anodyne	SLC12A5	68	39
O=C1C[C@@H](NC[C@@H](O)c2cccnc2)CN1C1CCCCC1	ZINC000819173860	DD	On-Demand	Anodyne	ADRB1	18	40
O=C1C[C@@H](NC[C@@H](O)c2cccnc2)CN1C1CCCCC1	ZINC000819173860	DD	On-Demand	Anodyne	ADRB3	72	46
O=C1C[C@H](NC[C@@H](O)c2cccnc2)CN1C1CCCCC1	ZINC000819173862	DD	On-Demand	Anodyne	ADRB1	18	40
O=C1C[C@H](NC[C@@H](O)c2cccnc2)CN1C1CCCCC1	ZINC000819173862	DD	On-Demand	Anodyne	ADRB3	72	46
CC1(C)CCC[C@H]1CNC(=O)c1ccc(-n2ccnc2)nc1	ZINC000819173863	CF	On-Demand	Anodyne	NOS2	57	34
O=C1C[C@H](NC[C@H](O)c2cccnc2)CN1C1CCCCC1	ZINC000819173864	DD	On-Demand	Anodyne	ADRB1	18	40
O=C1C[C@H](NC[C@H](O)c2cccnc2)CN1C1CCCCC1	ZINC000819173864	DD	On-Demand	Anodyne	ADRB3	72	46
O=C1C[C@@H](NC[C@H](O)c2cccnc2)CN1C1CCCCC1	ZINC000819173866	DD	On-Demand	Anodyne	ADRB1	18	40
O=C1C[C@@H](NC[C@H](O)c2cccnc2)CN1C1CCCCC1	ZINC000819173866	DD	On-Demand	Anodyne	ADRB3	72	46
O=C(CCc1cccc(OC(F)F)c1)NCc1cccnc1N1CCCCC1	ZINC000819173888	GH	On-Demand	Anodyne	SCN2A	18	44
O=C(CCc1cccc(OC(F)F)c1)NCc1cccnc1N1CCCCC1	ZINC000819173888	GH	On-Demand	Anodyne	PLA2G4A	26	40
O=C(CCc1cccc(OC(F)F)c1)NCc1cccnc1N1CCCCC1	ZINC000819173888	GH	On-Demand	Anodyne	SCN10A	19	44
CC1(C)CCC[C@H]1CNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819173890	GE	On-Demand	Anodyne	CNR2	23	50
CC1(C)CCC[C@H]1CNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819173890	GE	On-Demand	Anodyne	CACNA1I	63	35
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819173930	CF	On-Demand	Anodyne	CTSK	18	43
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819173930	CF	On-Demand	Anodyne	CAPN1	39	44
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819173930	CF	On-Demand	Anodyne	CAPN2	47	36
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819173930	CF	On-Demand	Anodyne	NPR	44	32
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819173932	CF	On-Demand	Anodyne	CTSK	18	43
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819173932	CF	On-Demand	Anodyne	CAPN1	39	44
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819173932	CF	On-Demand	Anodyne	CAPN2	47	36
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819173932	CF	On-Demand	Anodyne	NPR	44	32
O=C(NCc1cccc(NC(=O)C2CCCCC2)c1)C(F)=C1CCC1	ZINC000819173951	EI	On-Demand	Anodyne	NMT1	29	40
O=S(=O)(CCNC[C@@H](O)Cc1ccccc1)CC1CC1	ZINC000819173952	CD	On-Demand	Anodyne	ADRB1	27	40
O=S(=O)(CCNC[C@H](O)Cc1ccccc1)CC1CC1	ZINC000819173953	CD	On-Demand	Anodyne	ADRB1	27	40
O=S(=O)(CCNC[C@@H](O)COc1ccc2ccccc2c1)CC1CC1	ZINC000819173960	FD	On-Demand	Anodyne	ADRB2	59	51
O=S(=O)(CCNC[C@@H](O)COc1ccc2ccccc2c1)CC1CC1	ZINC000819173960	FD	On-Demand	Anodyne	ADRB1	91	48
O=S(=O)(CCNC[C@@H](O)COc1ccc2ccccc2c1)CC1CC1	ZINC000819173960	FD	On-Demand	Anodyne	ADRB3	64	47
O=S(=O)(CCNC[C@@H](O)COc1ccc2ccccc2c1)CC1CC1	ZINC000819173960	FD	On-Demand	Anodyne	ABCB1	18	40
O=S(=O)(CCNC[C@H](O)COc1ccc2ccccc2c1)CC1CC1	ZINC000819173961	FD	On-Demand	Anodyne	ADRB2	59	51
O=S(=O)(CCNC[C@H](O)COc1ccc2ccccc2c1)CC1CC1	ZINC000819173961	FD	On-Demand	Anodyne	ADRB1	91	48
O=S(=O)(CCNC[C@H](O)COc1ccc2ccccc2c1)CC1CC1	ZINC000819173961	FD	On-Demand	Anodyne	ADRB3	64	47
O=S(=O)(CCNC[C@H](O)COc1ccc2ccccc2c1)CC1CC1	ZINC000819173961	FD	On-Demand	Anodyne	ABCB1	18	40
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000819173972	EG	On-Demand	Anodyne	CACNA1I	48	33
O=C(/C=C\[C@@H]1CCCO1)NC[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000819173973	EG	On-Demand	Anodyne	CACNA1I	48	33
O=C(/C=C/[C@@H]1CCCO1)NC[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000819173974	EG	On-Demand	Anodyne	CACNA1I	48	33
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000819173975	EG	On-Demand	Anodyne	CACNA1I	48	33
O[C@H]1CCCC[C@@H]1N1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819173992	FF	On-Demand	Anodyne	ADRB3	25	44
O[C@H]1CCCC[C@@H]1N1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819173992	FF	On-Demand	Anodyne	SLC18A3	37	52
O[C@@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccc(Cl)cc1	ZINC000819173993	FF	On-Demand	Anodyne	ADRB3	25	44
O[C@@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccc(Cl)cc1	ZINC000819173993	FF	On-Demand	Anodyne	SLC18A3	37	52
O[C@@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccc(Cl)cc1	ZINC000819173994	FF	On-Demand	Anodyne	ADRB3	25	44
O[C@@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccc(Cl)cc1	ZINC000819173994	FF	On-Demand	Anodyne	SLC18A3	37	52
O[C@H]1CCCC[C@H]1N1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819173995	FF	On-Demand	Anodyne	ADRB3	25	44
O[C@H]1CCCC[C@H]1N1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819173995	FF	On-Demand	Anodyne	SLC18A3	37	52
O[C@@H](CN[C@@H]1CCOC2(CCCC2)C1)c1cccc(Cl)c1	ZINC000819173997	DG	On-Demand	Anodyne	ADRB1	26	42
O[C@@H](CN[C@@H]1CCOC2(CCCC2)C1)c1cccc(Cl)c1	ZINC000819173997	DG	On-Demand	Anodyne	ADRB3	43	50
O[C@@H](CN[C@H]1CCOC2(CCCC2)C1)c1cccc(Cl)c1	ZINC000819173998	DG	On-Demand	Anodyne	ADRB1	26	42
O[C@@H](CN[C@H]1CCOC2(CCCC2)C1)c1cccc(Cl)c1	ZINC000819173998	DG	On-Demand	Anodyne	ADRB3	43	50
O[C@H](CN[C@@H]1CCOC2(CCCC2)C1)c1cccc(Cl)c1	ZINC000819173999	DG	On-Demand	Anodyne	ADRB1	26	42
O[C@H](CN[C@@H]1CCOC2(CCCC2)C1)c1cccc(Cl)c1	ZINC000819173999	DG	On-Demand	Anodyne	ADRB3	43	50
O[C@H](CN[C@H]1CCOC2(CCCC2)C1)c1cccc(Cl)c1	ZINC000819174000	DG	On-Demand	Anodyne	ADRB1	26	42
O[C@H](CN[C@H]1CCOC2(CCCC2)C1)c1cccc(Cl)c1	ZINC000819174000	DG	On-Demand	Anodyne	ADRB3	43	50
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174006	CF	On-Demand	Anodyne	CTSK	18	43
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174006	CF	On-Demand	Anodyne	CAPN1	39	44
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174006	CF	On-Demand	Anodyne	CAPN2	47	36
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174006	CF	On-Demand	Anodyne	NPR	44	32
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174008	CF	On-Demand	Anodyne	CTSK	18	43
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174008	CF	On-Demand	Anodyne	CAPN1	39	44
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174008	CF	On-Demand	Anodyne	CAPN2	47	36
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174008	CF	On-Demand	Anodyne	NPR	44	32
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	ACE	47	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	OPRM1	23	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	OPRD1	22	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	CELA1	22	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	ELANE	30	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	MME	40	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	CTRA_BOVIN	60	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	CASP3	19	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	BMP1	17	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	KLK3	83	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	CTSB	75	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	PAPA1_CARPA	80	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	CYSP_TRYCR	55	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	CTSG	42	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	CTSK	58	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	CTSL	52	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	PGA	24	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	TIMP3	48	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	PREP	15	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	CAPNS1	81	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	HLA-DRB1	48	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	CELA2A	50	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	LGMN	19	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	CTSS	33	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	CAPN1	97	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	CASP1	30	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	CAPN2	150	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	PLAU	20	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	NPR	91	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	PSMB5	54	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	BIRC2	23	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	Q6PRC7_IXORI	50	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174021	EG	On-Demand	Anodyne	SLC12A5	65	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	ACE	47	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	OPRM1	23	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	OPRD1	22	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	CELA1	22	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	ELANE	30	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	MME	40	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	CTRA_BOVIN	60	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	CASP3	19	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	BMP1	17	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	KLK3	83	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	CTSB	75	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	PAPA1_CARPA	80	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	CYSP_TRYCR	55	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	CTSG	42	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	CTSK	58	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	CTSL	52	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	PGA	24	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	TIMP3	48	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	PREP	15	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	CAPNS1	81	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	HLA-DRB1	48	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	CELA2A	50	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	LGMN	19	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	CTSS	33	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	CAPN1	97	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	CASP1	30	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	CAPN2	150	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	PLAU	20	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	NPR	91	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	PSMB5	54	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	BIRC2	23	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	Q6PRC7_IXORI	50	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174023	EG	On-Demand	Anodyne	SLC12A5	65	35
COc1ccc2c(C)c(CCC(=O)NCCCN3CCN(C)CC3)c(=O)oc2c1	ZINC000819174028	HD	On-Demand	Anodyne	HTR1A	28	46
COc1ccc2c(C)c(CCC(=O)NCCCN3CCN(C)CC3)c(=O)oc2c1	ZINC000819174028	HD	On-Demand	Anodyne	DRD2	27	46
COc1ccc2c(C)c(CCC(=O)NCCCN3CCN(C)CC3)c(=O)oc2c1	ZINC000819174028	HD	On-Demand	Anodyne	DRD4	42	33
COc1ccc2c(C)c(CCC(=O)NCCCN3CCN(C)CC3)c(=O)oc2c1	ZINC000819174028	HD	On-Demand	Anodyne	ACHE	28	41
COc1ccc2c(C)c(CCC(=O)NCCCN3CCN(C)CC3)c(=O)oc2c1	ZINC000819174028	HD	On-Demand	Anodyne	MAOB	35	44
COc1ccc2c(C)c(CCC(=O)NCCCN3CCN(C)CC3)c(=O)oc2c1	ZINC000819174028	HD	On-Demand	Anodyne	HTR2A	20	46
COc1ccc2c(C)c(CCC(=O)NCCCN3CCN(C)CC3)c(=O)oc2c1	ZINC000819174028	HD	On-Demand	Anodyne	ADRA1A	31	41
COc1ccc2c(C)c(CCC(=O)NCCCN3CCN(C)CC3)c(=O)oc2c1	ZINC000819174028	HD	On-Demand	Anodyne	DRD3	41	44
COc1ccc2c(C)c(CCC(=O)NCCCN3CCN(C)CC3)c(=O)oc2c1	ZINC000819174028	HD	On-Demand	Anodyne	AVPR1B	25	42
COc1ccc2c(C)c(CCC(=O)NCCCN3CCN(C)CC3)c(=O)oc2c1	ZINC000819174028	HD	On-Demand	Anodyne	SIGMAR1	15	47
COc1ccc2c(C)c(CCC(=O)NCCCN3CCN(C)CC3)c(=O)oc2c1	ZINC000819174028	HD	On-Demand	Anodyne	BCHE	28	41
COc1ccc2c(C)c(CCC(=O)NCCCN3CCN(C)CC3)c(=O)oc2c1	ZINC000819174028	HD	On-Demand	Anodyne	MTNR1A	71	42
COc1ccc2c(C)c(CCC(=O)NCCCN3CCN(C)CC3)c(=O)oc2c1	ZINC000819174028	HD	On-Demand	Anodyne	MTNR1B	62	39
COc1ccc2c(C)c(CCC(=O)NCCCN3CCN(C)CC3)c(=O)oc2c1	ZINC000819174028	HD	On-Demand	Anodyne	NQO1	20	43
CC1(C)CCC[C@H]1CNC(=O)c1ccnc(Cl)c1I	ZINC000819174069	GH	On-Demand	Anodyne	G2YM83_BOTF4	60	33
O=S(=O)(c1ccc(Cl)nc1)N1CCCc2ncccc21	ZINC000819174075	DE	On-Demand	Anodyne	CYP11B2	26	44
CC1(C)CCC[C@H]1CNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	ZINC000819174101	HF	On-Demand	Anodyne	CNR2	15	42
CC1(C)CCC[C@H]1CNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	ZINC000819174101	HF	On-Demand	Anodyne	SLC6A9	49	38
CC1(C)CCC[C@H]1CNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	ZINC000819174101	HF	On-Demand	Anodyne	NAMPT	31	41
CC1(C)CCC[C@H]1CNC(=O)c1cc2ccccc2oc1=O	ZINC000819174111	CG	On-Demand	Anodyne	MAOB	15	56
CC1(C)CCC[C@H]1CNC(=O)c1cc(C(F)(F)F)cnc1Cl	ZINC000819174133	EI	On-Demand	Anodyne	ATF1	51	32
CC1(C)CCC[C@H]1CNC(=O)c1cc(C(F)(F)F)cnc1Cl	ZINC000819174133	EI	On-Demand	Anodyne	NFKB1	47	32
CC1(C)CCC[C@H]1CNC(=O)c1ccnc(Cl)c1F	ZINC000819174156	CG	On-Demand	Anodyne	G2YM83_BOTF4	57	31
CC1(C)CCC[C@H]1CNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	ZINC000819174167	GF	On-Demand	Anodyne	CCR8	47	31
O=C1C[C@H](NC[C@@H](O)c2ccccc2)CN1C1CCCCC1	ZINC000819174172	DE	On-Demand	Anodyne	INHA	22	46
O=C1C[C@@H](NC[C@@H](O)c2ccccc2)CN1C1CCCCC1	ZINC000819174173	DE	On-Demand	Anodyne	INHA	22	46
O=C1C[C@H](NC[C@H](O)c2ccccc2)CN1C1CCCCC1	ZINC000819174175	DE	On-Demand	Anodyne	INHA	22	46
O=C1C[C@@H](NC[C@H](O)c2ccccc2)CN1C1CCCCC1	ZINC000819174176	DE	On-Demand	Anodyne	INHA	22	46
O=S(=O)(CCNC[C@@H](O)COc1ccccc1F)CC1CC1	ZINC000819174192	EC	On-Demand	Anodyne	ADRB2	46	42
O=S(=O)(CCNC[C@@H](O)COc1ccccc1F)CC1CC1	ZINC000819174192	EC	On-Demand	Anodyne	ADRB1	74	48
O=S(=O)(CCNC[C@@H](O)COc1ccccc1F)CC1CC1	ZINC000819174192	EC	On-Demand	Anodyne	ADRB3	43	41
O=S(=O)(CCNC[C@@H](O)COc1ccccc1F)CC1CC1	ZINC000819174192	EC	On-Demand	Anodyne	ABCB1	20	41
O=S(=O)(CCNC[C@H](O)COc1ccccc1F)CC1CC1	ZINC000819174193	EC	On-Demand	Anodyne	ADRB2	46	42
O=S(=O)(CCNC[C@H](O)COc1ccccc1F)CC1CC1	ZINC000819174193	EC	On-Demand	Anodyne	ADRB1	74	48
O=S(=O)(CCNC[C@H](O)COc1ccccc1F)CC1CC1	ZINC000819174193	EC	On-Demand	Anodyne	ADRB3	43	41
O=S(=O)(CCNC[C@H](O)COc1ccccc1F)CC1CC1	ZINC000819174193	EC	On-Demand	Anodyne	ABCB1	20	41
C=CCC1(C(=O)Oc2ccc(C(=O)Nc3cccnc3)cc2)CCOCC1	ZINC000819174194	FH	On-Demand	Mild	NAMPT	17	47
O=C(/C=C/[C@@H]1CCCO1)NCc1cccnc1N1CCCCC1	ZINC000819174199	DE	On-Demand	Anodyne	SCN2A	19	46
O=C(/C=C/[C@@H]1CCCO1)NCc1cccnc1N1CCCCC1	ZINC000819174199	DE	On-Demand	Anodyne	SCN10A	20	46
O=C(/C=C\[C@H]1CCCO1)NCc1cccnc1N1CCCCC1	ZINC000819174200	DE	On-Demand	Anodyne	SCN2A	19	46
O=C(/C=C\[C@H]1CCCO1)NCc1cccnc1N1CCCCC1	ZINC000819174200	DE	On-Demand	Anodyne	SCN10A	20	46
O=C(/C=C\[C@@H]1CCCO1)NCc1cccnc1N1CCCCC1	ZINC000819174201	DE	On-Demand	Anodyne	SCN2A	19	46
O=C(/C=C\[C@@H]1CCCO1)NCc1cccnc1N1CCCCC1	ZINC000819174201	DE	On-Demand	Anodyne	SCN10A	20	46
O=C(/C=C/[C@H]1CCCO1)NCc1cccnc1N1CCCCC1	ZINC000819174202	DE	On-Demand	Anodyne	SCN2A	19	46
O=C(/C=C/[C@H]1CCCO1)NCc1cccnc1N1CCCCC1	ZINC000819174202	DE	On-Demand	Anodyne	SCN10A	20	46
O=S(=O)(CCNC[C@H](O)c1ccccc1)CC1CC1	ZINC000819174212	CD	On-Demand	Anodyne	ADRB2	26	43
O=S(=O)(CCNC[C@H](O)c1ccccc1)CC1CC1	ZINC000819174212	CD	On-Demand	Anodyne	ADRB1	34	41
O=S(=O)(CCNC[C@H](O)c1ccccc1)CC1CC1	ZINC000819174212	CD	On-Demand	Anodyne	ADRB3	63	41
O=S(=O)(CCNC[C@@H](O)c1ccccc1)CC1CC1	ZINC000819174213	CD	On-Demand	Anodyne	ADRB2	26	43
O=S(=O)(CCNC[C@@H](O)c1ccccc1)CC1CC1	ZINC000819174213	CD	On-Demand	Anodyne	ADRB1	34	41
O=S(=O)(CCNC[C@@H](O)c1ccccc1)CC1CC1	ZINC000819174213	CD	On-Demand	Anodyne	ADRB3	63	41
O=S(=O)(CCNC[C@@H](O)COc1ccc2c(c1)OCO2)CC1CC1	ZINC000819174248	FC	On-Demand	Anodyne	ADRB1	60	46
O=S(=O)(CCNC[C@@H](O)COc1ccc2c(c1)OCO2)CC1CC1	ZINC000819174248	FC	On-Demand	Anodyne	ADRB3	42	42
O=S(=O)(CCNC[C@H](O)COc1ccc2c(c1)OCO2)CC1CC1	ZINC000819174249	FC	On-Demand	Anodyne	ADRB1	60	46
O=S(=O)(CCNC[C@H](O)COc1ccc2c(c1)OCO2)CC1CC1	ZINC000819174249	FC	On-Demand	Anodyne	ADRB3	42	42
COc1ccccc1COC[C@H](O)CNCc1c(C)cccc1C	ZINC000819174262	EF	On-Demand	Anodyne	ADRB2	20	47
COc1ccccc1COC[C@@H](O)CNCc1c(C)cccc1C	ZINC000819174263	EF	On-Demand	Anodyne	ADRB2	20	47
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174286	FH	On-Demand	Anodyne	PAPA1_CARPA	35	56
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174287	FH	On-Demand	Anodyne	PAPA1_CARPA	35	56
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1cc(F)ccc1F	ZINC000819174333	FE	On-Demand	Anodyne	SLC18A3	42	40
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1cc(F)ccc1F	ZINC000819174335	FE	On-Demand	Anodyne	SLC18A3	42	40
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1cc(F)ccc1F	ZINC000819174337	FE	On-Demand	Anodyne	SLC18A3	42	40
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1cc(F)ccc1F	ZINC000819174339	FE	On-Demand	Anodyne	SLC18A3	42	40
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1c(F)cccc1F	ZINC000819174341	FE	On-Demand	Anodyne	SLC18A3	46	41
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1c(F)cccc1F	ZINC000819174343	FE	On-Demand	Anodyne	SLC18A3	46	41
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1c(F)cccc1F	ZINC000819174346	FE	On-Demand	Anodyne	SLC18A3	46	41
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1c(F)cccc1F	ZINC000819174348	FE	On-Demand	Anodyne	SLC18A3	46	41
CC1(C)CCC[C@H]1CNC(=O)[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819174414	EH	On-Demand	Anodyne	CCR2	71	38
CC1(C)CCC[C@H]1CNC(=O)[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819174416	EH	On-Demand	Anodyne	CCR2	71	38
O=C1C[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)CN1C1CCCCC1	ZINC000819174421	FG	On-Demand	Anodyne	INHA	17	44
O=C1C[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)CN1C1CCCCC1	ZINC000819174423	FG	On-Demand	Anodyne	INHA	17	44
CC1(C)CCC[C@H]1CNC(=O)c1cccnc1S	ZINC000819174424	CF	On-Demand	Anodyne	G2YM83_BOTF4	63	37
O=C1C[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)CN1C1CCCCC1	ZINC000819174426	FG	On-Demand	Anodyne	INHA	17	44
O=C1C[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)CN1C1CCCCC1	ZINC000819174428	FG	On-Demand	Anodyne	INHA	17	44
O[C@@H](CN[C@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1	ZINC000819174456	CF	On-Demand	Anodyne	ADRB1	32	47
O[C@@H](CN[C@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1	ZINC000819174456	CF	On-Demand	Anodyne	ADRB3	49	49
O[C@@H](CN[C@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1	ZINC000819174456	CF	On-Demand	Anodyne	CYP3A4	45	34
CC1(C)CCC[C@H]1CNC(=O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1	ZINC000819174457	HG	On-Demand	Anodyne	EPHX2	39	44
O[C@@H](CN[C@@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1	ZINC000819174458	CF	On-Demand	Anodyne	ADRB1	32	47
O[C@@H](CN[C@@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1	ZINC000819174458	CF	On-Demand	Anodyne	ADRB3	49	49
O[C@@H](CN[C@@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1	ZINC000819174458	CF	On-Demand	Anodyne	CYP3A4	45	34
O[C@H](CN[C@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1	ZINC000819174461	CF	On-Demand	Anodyne	ADRB1	32	47
O[C@H](CN[C@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1	ZINC000819174461	CF	On-Demand	Anodyne	ADRB3	49	49
O[C@H](CN[C@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1	ZINC000819174461	CF	On-Demand	Anodyne	CYP3A4	45	34
O[C@H](CN[C@@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1	ZINC000819174464	CF	On-Demand	Anodyne	ADRB1	32	47
O[C@H](CN[C@@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1	ZINC000819174464	CF	On-Demand	Anodyne	ADRB3	49	49
O[C@H](CN[C@@H]1CCCc2c[nH]nc21)c1cccc(Cl)c1	ZINC000819174464	CF	On-Demand	Anodyne	CYP3A4	45	34
O=S(=O)(CCNC[C@H](O)COc1ccc(Br)cc1)CC1CC1	ZINC000819174466	GD	On-Demand	Anodyne	ADRB2	46	49
O=S(=O)(CCNC[C@H](O)COc1ccc(Br)cc1)CC1CC1	ZINC000819174466	GD	On-Demand	Anodyne	ADRB1	77	53
O=S(=O)(CCNC[C@H](O)COc1ccc(Br)cc1)CC1CC1	ZINC000819174466	GD	On-Demand	Anodyne	ADRB3	52	49
CC1(C)CCC[C@H]1CNC(=O)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl	ZINC000819174467	IH	On-Demand	Anodyne	CNR2	17	44
CC1(C)CCC[C@H]1CNC(=O)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl	ZINC000819174467	IH	On-Demand	Anodyne	SLC6A9	51	41
O=S(=O)(CCNC[C@@H](O)COc1ccc(Br)cc1)CC1CC1	ZINC000819174469	GD	On-Demand	Anodyne	ADRB2	46	49
O=S(=O)(CCNC[C@@H](O)COc1ccc(Br)cc1)CC1CC1	ZINC000819174469	GD	On-Demand	Anodyne	ADRB1	77	53
O=S(=O)(CCNC[C@@H](O)COc1ccc(Br)cc1)CC1CC1	ZINC000819174469	GD	On-Demand	Anodyne	ADRB3	52	49
COc1cccc([S@@](=O)CC(=O)NCc2cccnc2N2CCCCC2)c1	ZINC000819174475	GF	On-Demand	Anodyne	DRD4	42	32
COc1cccc([S@@](=O)CC(=O)NCc2cccnc2N2CCCCC2)c1	ZINC000819174475	GF	On-Demand	Anodyne	SCN2A	18	43
COc1cccc([S@@](=O)CC(=O)NCc2cccnc2N2CCCCC2)c1	ZINC000819174475	GF	On-Demand	Anodyne	SCN10A	18	43
O[C@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1c(F)cccc1F	ZINC000819174490	ED	On-Demand	Anodyne	SLC18A3	41	38
O=C(CCNCCS(=O)(=O)CC1CC1)Nc1cccnc1	ZINC000819174491	DC	On-Demand	Anodyne	NAMPT	44	39
O[C@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1c(F)cccc1F	ZINC000819174493	ED	On-Demand	Anodyne	SLC18A3	41	38
CC1(C)CCC[C@H]1CNC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819174495	EH	On-Demand	Anodyne	F2	55	42
CC1(C)CCC[C@H]1CNC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819174495	EH	On-Demand	Anodyne	FKBP1A	37	42
CC1(C)CCC[C@H]1CNC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819174495	EH	On-Demand	Anodyne	ELANE	43	37
CC1(C)CCC[C@H]1CNC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819174495	EH	On-Demand	Anodyne	PREP	67	48
CC1(C)CCC[C@H]1CNC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819174495	EH	On-Demand	Anodyne	XIAP	41	39
CC1(C)CCC[C@H]1CNC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819174495	EH	On-Demand	Anodyne	TMPRSS11D	64	36
O[C@H](CNC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1c(F)cccc1F	ZINC000819174496	ED	On-Demand	Anodyne	SLC18A3	41	38
CC1(C)CCC[C@H]1CNC(=O)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819174498	EH	On-Demand	Anodyne	F2	55	42
CC1(C)CCC[C@H]1CNC(=O)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819174498	EH	On-Demand	Anodyne	FKBP1A	37	42
CC1(C)CCC[C@H]1CNC(=O)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819174498	EH	On-Demand	Anodyne	ELANE	43	37
CC1(C)CCC[C@H]1CNC(=O)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819174498	EH	On-Demand	Anodyne	PREP	67	48
CC1(C)CCC[C@H]1CNC(=O)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819174498	EH	On-Demand	Anodyne	XIAP	41	39
CC1(C)CCC[C@H]1CNC(=O)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819174498	EH	On-Demand	Anodyne	TMPRSS11D	64	36
O[C@H](CNC1CCN([C@H]2CCC[C@@H]2O)CC1)c1c(F)cccc1F	ZINC000819174499	ED	On-Demand	Anodyne	SLC18A3	41	38
O=C(NCc1cccnc1N1CCCCC1)c1cc2c(cn1)OCCO2	ZINC000819174514	FE	On-Demand	Anodyne	SCN2A	23	54
O=C(NCc1cccnc1N1CCCCC1)c1cc2c(cn1)OCCO2	ZINC000819174514	FE	On-Demand	Anodyne	SCN10A	39	54
O=S(=O)(CCNC[C@H](O)c1cccc(C(F)(F)F)c1)c1ccc(F)cc1	ZINC000819174516	GF	On-Demand	Anodyne	ADRB2	21	41
O=S(=O)(CCNC[C@H](O)c1cccc(C(F)(F)F)c1)c1ccc(F)cc1	ZINC000819174516	GF	On-Demand	Anodyne	ADRB3	69	41
O=S(=O)(CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)c1ccc(F)cc1	ZINC000819174517	GF	On-Demand	Anodyne	ADRB2	21	41
O=S(=O)(CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)c1ccc(F)cc1	ZINC000819174517	GF	On-Demand	Anodyne	ADRB3	69	41
O=C1C[C@H](NC[C@@H](O)c2cc3ccccc3o2)CN1C1CCCCC1	ZINC000819174530	EF	On-Demand	Anodyne	INHA	19	40
O=C1C[C@@H](NC[C@@H](O)c2cc3ccccc3o2)CN1C1CCCCC1	ZINC000819174531	EF	On-Demand	Anodyne	INHA	19	40
O=S(=O)(CCNC[C@H](O)c1ccc(Cl)c(F)c1)c1ccc(F)cc1	ZINC000819174533	GF	On-Demand	Anodyne	ADRB3	40	37
O=S(=O)(CCNC[C@@H](O)c1ccc(Cl)c(F)c1)c1ccc(F)cc1	ZINC000819174534	GF	On-Demand	Anodyne	ADRB3	40	37
O=S(=O)(CCNC[C@H](O)COc1ccccc1)CC1CC1	ZINC000819174626	DC	On-Demand	Anodyne	ADRB2	66	51
O=S(=O)(CCNC[C@H](O)COc1ccccc1)CC1CC1	ZINC000819174626	DC	On-Demand	Anodyne	ADRB1	106	53
O=S(=O)(CCNC[C@H](O)COc1ccccc1)CC1CC1	ZINC000819174626	DC	On-Demand	Anodyne	ADRB3	74	52
O=S(=O)(CCNC[C@H](O)COc1ccccc1)CC1CC1	ZINC000819174626	DC	On-Demand	Anodyne	ABCB1	23	46
O=S(=O)(CCNC[C@@H](O)COc1ccccc1)CC1CC1	ZINC000819174628	DC	On-Demand	Anodyne	ADRB2	66	51
O=S(=O)(CCNC[C@@H](O)COc1ccccc1)CC1CC1	ZINC000819174628	DC	On-Demand	Anodyne	ADRB1	106	53
O=S(=O)(CCNC[C@@H](O)COc1ccccc1)CC1CC1	ZINC000819174628	DC	On-Demand	Anodyne	ADRB3	74	52
O=S(=O)(CCNC[C@@H](O)COc1ccccc1)CC1CC1	ZINC000819174628	DC	On-Demand	Anodyne	ABCB1	23	46
CC(C)(C)OC(=O)NCc1cc(C(=O)NC[C@@H]2CCCC2(C)C)co1	ZINC000819174629	FH	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)NCc1cc(C(=O)NC[C@H]2CCCC2(C)C)co1	ZINC000819174631	FH	On-Demand	Anodyne	CACNA1I	41	32
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(N2CCOC2=O)c1	ZINC000819174636	EF	On-Demand	Anodyne	KCNQ2	48	37
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(N2CCOC2=O)c1	ZINC000819174638	EF	On-Demand	Anodyne	KCNQ2	48	37
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(N2CCOC2=O)c1	ZINC000819174640	EF	On-Demand	Anodyne	KCNQ2	48	37
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(N2CCOC2=O)c1	ZINC000819174642	EF	On-Demand	Anodyne	KCNQ2	48	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	ACE	26	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	CTRA_BOVIN	63	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	KLK3	87	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	CTSB	70	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	PAPA1_CARPA	74	48
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	CYSP_TRYCR	55	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	CTSG	42	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	CTSK	64	49
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	CTSL	59	48
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	CAPNS1	70	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	MMP3	15	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	CELA2A	52	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	MMP11	53	33
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	CTSS	43	49
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	CAPN1	92	46
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	CAPN2	141	46
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	TGM2	25	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	TPSAB1	42	33
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	NPR	84	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174666	GG	On-Demand	Anodyne	PSMB5	47	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	ACE	26	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	CTRA_BOVIN	63	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	KLK3	87	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	CTSB	70	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	PAPA1_CARPA	74	48
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	CYSP_TRYCR	55	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	CTSG	42	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	CTSK	64	49
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	CTSL	59	48
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	CAPNS1	70	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	MMP3	15	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	CELA2A	52	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	MMP11	53	33
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	CTSS	43	49
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	CAPN1	92	46
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	CAPN2	141	46
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	TGM2	25	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	TPSAB1	42	33
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	NPR	84	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@H]1CCCC1(C)C	ZINC000819174668	GG	On-Demand	Anodyne	PSMB5	47	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	ACE	26	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	CTRA_BOVIN	63	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	KLK3	87	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	CTSB	70	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	PAPA1_CARPA	74	48
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	CYSP_TRYCR	55	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	CTSG	42	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	CTSK	64	49
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	CTSL	59	48
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	CAPNS1	70	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	MMP3	15	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	CELA2A	52	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	MMP11	53	33
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	CTSS	43	49
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	CAPN1	92	46
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	CAPN2	141	46
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	TGM2	25	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	TPSAB1	42	33
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	NPR	84	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174670	GG	On-Demand	Anodyne	PSMB5	47	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	ACE	26	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	CTRA_BOVIN	63	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	KLK3	87	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	CTSB	70	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	PAPA1_CARPA	74	48
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	CYSP_TRYCR	55	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	CTSG	42	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	CTSK	64	49
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	CTSL	59	48
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	CAPNS1	70	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	MMP3	15	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	CELA2A	52	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	MMP11	53	33
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	CTSS	43	49
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	CAPN1	92	46
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	CAPN2	141	46
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	TGM2	25	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	TPSAB1	42	33
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	NPR	84	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174672	GG	On-Demand	Anodyne	PSMB5	47	40
CC1(C)CCC[C@H]1CNC(=O)c1cc(=O)c2ccccc2o1	ZINC000819174675	CG	On-Demand	Anodyne	BCHE	33	43
CC1(C)CCC[C@H]1CNC(=O)CCCNC(=O)OCc1ccccc1	ZINC000819174691	EH	On-Demand	Anodyne	PREP	18	42
CC1(C)CCC[C@H]1CNC(=O)CCCNC(=O)OCc1ccccc1	ZINC000819174691	EH	On-Demand	Anodyne	CAPNS1	47	33
CC1(C)CCC[C@H]1CNC(=O)CCCNC(=O)OCc1ccccc1	ZINC000819174691	EH	On-Demand	Anodyne	CAPN1	49	46
CC1(C)CCC[C@H]1CNC(=O)CCCNC(=O)OCc1ccccc1	ZINC000819174691	EH	On-Demand	Anodyne	CAPN2	79	46
CC1(C)CCC[C@H]1CNC(=O)CCCNC(=O)OCc1ccccc1	ZINC000819174691	EH	On-Demand	Anodyne	NPR	63	38
CC1(C)CCC[C@H]1CNC(=O)CCCNC(=O)OCc1ccccc1	ZINC000819174691	EH	On-Demand	Anodyne	SLC12A5	64	36
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1ccc(Cl)c(F)c1	ZINC000819174695	FF	On-Demand	Anodyne	SLC18A3	29	41
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1ccc(Cl)c(F)c1	ZINC000819174698	FF	On-Demand	Anodyne	SLC18A3	29	41
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccc(Cl)c(F)c1	ZINC000819174701	FF	On-Demand	Anodyne	SLC18A3	29	41
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccc(Cl)c(F)c1	ZINC000819174703	FF	On-Demand	Anodyne	SLC18A3	29	41
O=S(=O)(CCNC[C@H](O)c1cccc(C(F)(F)F)c1)CC1CC1	ZINC000819174726	FE	On-Demand	Anodyne	ADRB3	42	38
O=S(=O)(CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)CC1CC1	ZINC000819174728	FE	On-Demand	Anodyne	ADRB3	42	38
O=C1C[C@H](NC[C@H](O)c2ccc(Cl)cc2)CN1C1CCCCC1	ZINC000819174731	EF	On-Demand	Anodyne	INHA	18	45
O=C1C[C@H](NC[C@H](O)c2ccc(Cl)cc2)CN1C1CCCCC1	ZINC000819174731	EF	On-Demand	Anodyne	ADRB3	20	43
O=C1C[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CN1C1CCCCC1	ZINC000819174733	EF	On-Demand	Anodyne	INHA	18	45
O=C1C[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CN1C1CCCCC1	ZINC000819174733	EF	On-Demand	Anodyne	ADRB3	20	43
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)CC1CC1	ZINC000819174739	GE	On-Demand	Anodyne	ADRB2	45	45
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)CC1CC1	ZINC000819174739	GE	On-Demand	Anodyne	ADRB1	74	49
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)CC1CC1	ZINC000819174739	GE	On-Demand	Anodyne	GRIN1	32	52
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)CC1CC1	ZINC000819174739	GE	On-Demand	Anodyne	ADRB3	52	48
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)CC1CC1	ZINC000819174739	GE	On-Demand	Anodyne	CCR3	23	42
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)c(Cl)c1)CC1CC1	ZINC000819174741	GE	On-Demand	Anodyne	ADRB2	45	45
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)c(Cl)c1)CC1CC1	ZINC000819174741	GE	On-Demand	Anodyne	ADRB1	74	49
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)c(Cl)c1)CC1CC1	ZINC000819174741	GE	On-Demand	Anodyne	GRIN1	32	52
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)c(Cl)c1)CC1CC1	ZINC000819174741	GE	On-Demand	Anodyne	ADRB3	52	48
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)c(Cl)c1)CC1CC1	ZINC000819174741	GE	On-Demand	Anodyne	CCR3	23	42
CC(=O)Nc1cccc(CC(=O)NC[C@H]2CCCCN2C(=O)OC(C)(C)C)c1	ZINC000819174754	GG	On-Demand	Anodyne	CCR3	24	41
CC(=O)Nc1cccc(CC(=O)NC[C@H]2CCCCN2C(=O)OC(C)(C)C)c1	ZINC000819174754	GG	On-Demand	Anodyne	CPT1A	15	42
CC(=O)Nc1cccc(CC(=O)NC[C@H]2CCCCN2C(=O)OC(C)(C)C)c1	ZINC000819174754	GG	On-Demand	Anodyne	GPR119	15	43
CC(=O)Nc1cccc(CC(=O)NC[C@@H]2CCCCN2C(=O)OC(C)(C)C)c1	ZINC000819174756	GG	On-Demand	Anodyne	CCR3	24	41
CC(=O)Nc1cccc(CC(=O)NC[C@@H]2CCCCN2C(=O)OC(C)(C)C)c1	ZINC000819174756	GG	On-Demand	Anodyne	CPT1A	15	42
CC(=O)Nc1cccc(CC(=O)NC[C@@H]2CCCCN2C(=O)OC(C)(C)C)c1	ZINC000819174756	GG	On-Demand	Anodyne	GPR119	15	43
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN([C@@H]3CCC[C@@H]3O)CC2)cc1	ZINC000819174764	GD	On-Demand	Anodyne	ADRB3	26	43
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN([C@H]3CCC[C@@H]3O)CC2)cc1	ZINC000819174766	GD	On-Demand	Anodyne	ADRB3	26	43
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN([C@@H]3CCC[C@H]3O)CC2)cc1	ZINC000819174768	GD	On-Demand	Anodyne	ADRB3	26	43
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN([C@H]3CCC[C@H]3O)CC2)cc1	ZINC000819174770	GD	On-Demand	Anodyne	ADRB3	26	43
CON(C)C(=O)CCNC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000819174787	DC	On-Demand	Anodyne	SLC18A3	34	40
CON(C)C(=O)CCNC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000819174789	DC	On-Demand	Anodyne	SLC18A3	34	40
CON(C)C(=O)CCNC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000819174791	DC	On-Demand	Anodyne	SLC18A3	34	40
CON(C)C(=O)CCNC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000819174792	DC	On-Demand	Anodyne	SLC18A3	34	40
CN(C)c1ccc(NC(=O)CCNC2CCN([C@H]3CCC[C@@H]3O)CC2)cc1	ZINC000819174809	FE	On-Demand	Anodyne	SLC18A3	28	48
CN(C)c1ccc(NC(=O)CCNC2CCN([C@@H]3CCC[C@@H]3O)CC2)cc1	ZINC000819174811	FE	On-Demand	Anodyne	SLC18A3	28	48
CN(C)c1ccc(NC(=O)CCNC2CCN([C@H]3CCC[C@H]3O)CC2)cc1	ZINC000819174813	FE	On-Demand	Anodyne	SLC18A3	28	48
O=S(=O)(CCNC[C@@H](O)Cc1cccc(Cl)c1)CC1CC1	ZINC000819174814	ED	On-Demand	Anodyne	ADRB1	32	42
CN(C)c1ccc(NC(=O)CCNC2CCN([C@@H]3CCC[C@H]3O)CC2)cc1	ZINC000819174815	FE	On-Demand	Anodyne	SLC18A3	28	48
O=S(=O)(CCNC[C@H](O)Cc1cccc(Cl)c1)CC1CC1	ZINC000819174816	ED	On-Demand	Anodyne	ADRB1	32	42
O=C1C[C@H](NC[C@@H](O)c2cccc(Br)c2)CN1C1CCCCC1	ZINC000819174832	GG	On-Demand	Anodyne	INHA	19	51
O=C1C[C@@H](NC[C@@H](O)c2cccc(Br)c2)CN1C1CCCCC1	ZINC000819174833	GG	On-Demand	Anodyne	INHA	19	51
O=C1C[C@H](NC[C@H](O)c2cccc(Br)c2)CN1C1CCCCC1	ZINC000819174834	GG	On-Demand	Anodyne	INHA	19	51
O=C1C[C@@H](NC[C@H](O)c2cccc(Br)c2)CN1C1CCCCC1	ZINC000819174835	GG	On-Demand	Anodyne	INHA	19	51
O=S(=O)(CCNC[C@@H](O)c1cccnc1)CC1CC1	ZINC000819174837	CC	On-Demand	Anodyne	ADRB2	28	45
O=S(=O)(CCNC[C@@H](O)c1cccnc1)CC1CC1	ZINC000819174837	CC	On-Demand	Anodyne	ADRB1	34	44
O=S(=O)(CCNC[C@@H](O)c1cccnc1)CC1CC1	ZINC000819174837	CC	On-Demand	Anodyne	ADRB3	116	51
O[C@H](CNC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1ccccc1Br	ZINC000819174841	GE	On-Demand	Anodyne	SLC18A3	57	41
O[C@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1ccccc1Br	ZINC000819174842	GE	On-Demand	Anodyne	SLC18A3	57	41
O[C@H](CNC1CCN([C@H]2CCC[C@@H]2O)CC1)c1ccccc1Br	ZINC000819174843	GE	On-Demand	Anodyne	SLC18A3	57	41
O[C@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1ccccc1Br	ZINC000819174844	GE	On-Demand	Anodyne	SLC18A3	57	41
C=C(Br)CNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819174859	EG	On-Demand	Mild	PLA2G4A	25	41
O=S(=O)(CCNC[C@H](O)c1cccnc1)CC1CC1	ZINC000819174866	CC	On-Demand	Anodyne	ADRB2	28	45
O=S(=O)(CCNC[C@H](O)c1cccnc1)CC1CC1	ZINC000819174866	CC	On-Demand	Anodyne	ADRB1	34	44
O=S(=O)(CCNC[C@H](O)c1cccnc1)CC1CC1	ZINC000819174866	CC	On-Demand	Anodyne	ADRB3	116	51
C[C@@H](CC(=O)NCc1cccnc1N1CCCCC1)n1cccn1	ZINC000819174867	EF	On-Demand	Anodyne	SCN2A	18	45
C[C@@H](CC(=O)NCc1cccnc1N1CCCCC1)n1cccn1	ZINC000819174867	EF	On-Demand	Anodyne	SCN10A	19	45
C[C@H](CC(=O)NCc1cccnc1N1CCCCC1)n1cccn1	ZINC000819174868	EF	On-Demand	Anodyne	SCN2A	18	45
C[C@H](CC(=O)NCc1cccnc1N1CCCCC1)n1cccn1	ZINC000819174868	EF	On-Demand	Anodyne	SCN10A	19	45
O=S(=O)(CCNC[C@H](O)COc1cccc2ccccc12)CC1CC1	ZINC000819174921	FD	On-Demand	Anodyne	ADRB2	54	58
O=S(=O)(CCNC[C@H](O)COc1cccc2ccccc12)CC1CC1	ZINC000819174921	FD	On-Demand	Anodyne	ADRB1	78	52
O=S(=O)(CCNC[C@H](O)COc1cccc2ccccc12)CC1CC1	ZINC000819174921	FD	On-Demand	Anodyne	ADRB3	48	51
O=S(=O)(CCNC[C@H](O)COc1cccc2ccccc12)CC1CC1	ZINC000819174921	FD	On-Demand	Anodyne	CYP2D6	15	42
O=S(=O)(CCNC[C@H](O)COc1cccc2ccccc12)CC1CC1	ZINC000819174921	FD	On-Demand	Anodyne	ABCB1	26	46
O=S(=O)(CCNC[C@@H](O)COc1cccc2ccccc12)CC1CC1	ZINC000819174922	FD	On-Demand	Anodyne	ADRB2	54	58
O=S(=O)(CCNC[C@@H](O)COc1cccc2ccccc12)CC1CC1	ZINC000819174922	FD	On-Demand	Anodyne	ADRB1	78	52
O=S(=O)(CCNC[C@@H](O)COc1cccc2ccccc12)CC1CC1	ZINC000819174922	FD	On-Demand	Anodyne	ADRB3	48	51
O=S(=O)(CCNC[C@@H](O)COc1cccc2ccccc12)CC1CC1	ZINC000819174922	FD	On-Demand	Anodyne	CYP2D6	15	42
O=S(=O)(CCNC[C@@H](O)COc1cccc2ccccc12)CC1CC1	ZINC000819174922	FD	On-Demand	Anodyne	ABCB1	26	46
CCCCSCC(=O)NC[C@H]1CCCC1(C)C	ZINC000819174927	CG	On-Demand	Anodyne	EST1_PIG	41	36
CCOc1ccc(CCC2CCN(C(=O)[C@@H](CC(N)=O)NC(=O)c3ccccc3Cl)CC2)cc1	ZINC000819174929	JH	On-Demand	Anodyne	F2	23	43
CCOc1ccc(CCC2CCN(C(=O)[C@@H](CC(N)=O)NC(=O)c3ccccc3Cl)CC2)cc1	ZINC000819174929	JH	On-Demand	Anodyne	PLG	20	42
CCOc1ccc(CCC2CCN(C(=O)[C@@H](CC(N)=O)NC(=O)c3ccccc3Cl)CC2)cc1	ZINC000819174929	JH	On-Demand	Anodyne	GHRHR	52	32
CCOc1ccc(CCC2CCN(C(=O)[C@@H](CC(N)=O)NC(=O)c3ccccc3Cl)CC2)cc1	ZINC000819174929	JH	On-Demand	Anodyne	P2RY12	127	36
CCOc1ccc(CCC2CCN(C(=O)[C@@H](CC(N)=O)NC(=O)c3ccccc3Cl)CC2)cc1	ZINC000819174929	JH	On-Demand	Anodyne	UGCG	43	36
CCOc1ccc(CCC2CCN(C(=O)[C@@H](CC(N)=O)NC(=O)c3ccccc3Cl)CC2)cc1	ZINC000819174929	JH	On-Demand	Anodyne	MC4R	71	36
CCOc1ccc(CCC2CCN(C(=O)[C@@H](CC(N)=O)NC(=O)c3ccccc3Cl)CC2)cc1	ZINC000819174929	JH	On-Demand	Anodyne	CCR1	29	43
CCOc1ccc(CCC2CCN(C(=O)[C@@H](CC(N)=O)NC(=O)c3ccccc3Cl)CC2)cc1	ZINC000819174929	JH	On-Demand	Anodyne	ST14	63	43
CCOc1ccc(CCC2CCN(C(=O)[C@@H](CC(N)=O)NC(=O)c3ccccc3Cl)CC2)cc1	ZINC000819174929	JH	On-Demand	Anodyne	TMPRSS6	36	43
CCCCSCC(=O)NC[C@@H]1CCCC1(C)C	ZINC000819174930	CG	On-Demand	Anodyne	EST1_PIG	41	36
CCOc1ccc(CCC2CCN(C(=O)[C@H](CC(N)=O)NC(=O)c3ccccc3Cl)CC2)cc1	ZINC000819174939	JH	On-Demand	Anodyne	F2	23	43
CCOc1ccc(CCC2CCN(C(=O)[C@H](CC(N)=O)NC(=O)c3ccccc3Cl)CC2)cc1	ZINC000819174939	JH	On-Demand	Anodyne	PLG	20	42
CCOc1ccc(CCC2CCN(C(=O)[C@H](CC(N)=O)NC(=O)c3ccccc3Cl)CC2)cc1	ZINC000819174939	JH	On-Demand	Anodyne	GHRHR	52	32
CCOc1ccc(CCC2CCN(C(=O)[C@H](CC(N)=O)NC(=O)c3ccccc3Cl)CC2)cc1	ZINC000819174939	JH	On-Demand	Anodyne	P2RY12	127	36
CCOc1ccc(CCC2CCN(C(=O)[C@H](CC(N)=O)NC(=O)c3ccccc3Cl)CC2)cc1	ZINC000819174939	JH	On-Demand	Anodyne	UGCG	43	36
CCOc1ccc(CCC2CCN(C(=O)[C@H](CC(N)=O)NC(=O)c3ccccc3Cl)CC2)cc1	ZINC000819174939	JH	On-Demand	Anodyne	MC4R	71	36
CCOc1ccc(CCC2CCN(C(=O)[C@H](CC(N)=O)NC(=O)c3ccccc3Cl)CC2)cc1	ZINC000819174939	JH	On-Demand	Anodyne	CCR1	29	43
CCOc1ccc(CCC2CCN(C(=O)[C@H](CC(N)=O)NC(=O)c3ccccc3Cl)CC2)cc1	ZINC000819174939	JH	On-Demand	Anodyne	ST14	63	43
CCOc1ccc(CCC2CCN(C(=O)[C@H](CC(N)=O)NC(=O)c3ccccc3Cl)CC2)cc1	ZINC000819174939	JH	On-Demand	Anodyne	TMPRSS6	36	43
Cn1cc(-c2cccc(C(=O)NC[C@@H]3CCCC3(C)C)c2)cn1	ZINC000819174990	DH	On-Demand	Anodyne	TYRO3	21	40
Cn1cc(-c2cccc(C(=O)NC[C@H]3CCCC3(C)C)c2)cn1	ZINC000819174991	DH	On-Demand	Anodyne	TYRO3	21	40
O[C@H](CNC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1ccc(Cl)cc1Cl	ZINC000819175064	FF	On-Demand	Anodyne	SLC18A3	26	42
O[C@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1ccc(Cl)cc1Cl	ZINC000819175065	FF	On-Demand	Anodyne	SLC18A3	26	42
O[C@H](CNC1CCN([C@H]2CCC[C@@H]2O)CC1)c1ccc(Cl)cc1Cl	ZINC000819175066	FF	On-Demand	Anodyne	SLC18A3	26	42
O[C@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1ccc(Cl)cc1Cl	ZINC000819175067	FF	On-Demand	Anodyne	SLC18A3	26	42
O=C(NC[C@H]1CCN(c2ccc(Cl)cc2)C1)C(F)=C1CCC1	ZINC000819175072	DH	On-Demand	Anodyne	CACNA1I	48	33
O=C(NC[C@@H]1CCN(c2ccc(Cl)cc2)C1)C(F)=C1CCC1	ZINC000819175073	DH	On-Demand	Anodyne	CACNA1I	48	33
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1ccc(F)cc1F	ZINC000819175086	FE	On-Demand	Anodyne	SLC18A3	42	38
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1ccc(F)cc1F	ZINC000819175087	FE	On-Demand	Anodyne	SLC18A3	42	38
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccc(F)cc1F	ZINC000819175088	FE	On-Demand	Anodyne	SLC18A3	42	38
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccc(F)cc1F	ZINC000819175089	FE	On-Demand	Anodyne	SLC18A3	42	38
CC1(C)CCC[C@H]1CNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819175147	GG	On-Demand	Anodyne	SLC6A9	58	37
CC1(C)CCC[C@H]1CNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819175147	GG	On-Demand	Anodyne	CACNA1I	61	34
CC1(C)CCC[C@H]1CNC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F	ZINC000819175237	FG	On-Demand	Anodyne	LGMN	68	35
CC1(C)CCC[C@H]1CNC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F	ZINC000819175238	FG	On-Demand	Anodyne	LGMN	68	35
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2[C@H]3c4ccccc4C[C@H]32)CC1	ZINC000819175246	GG	On-Demand	Anodyne	GPR119	40	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2[C@@H]3Cc4ccccc4[C@@H]23)CC1	ZINC000819175247	GG	On-Demand	Anodyne	GPR119	40	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2[C@H]3Cc4ccccc4[C@@H]32)CC1	ZINC000819175248	GG	On-Demand	Anodyne	GPR119	40	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2[C@H]3Cc4ccccc4[C@H]32)CC1	ZINC000819175249	GG	On-Demand	Anodyne	GPR119	40	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ccc(Cl)cn3)CC1)C2	ZINC000819175275	GE	On-Demand	Anodyne	NPBWR1	55	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ccc(Cl)cn3)CC1)C2	ZINC000819175276	GE	On-Demand	Anodyne	NPBWR1	55	47
O[C@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1cccnc1	ZINC000819175281	DD	On-Demand	Anodyne	ADRB1	27	44
O[C@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1cccnc1	ZINC000819175281	DD	On-Demand	Anodyne	ADRB3	81	52
O[C@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1cccnc1	ZINC000819175282	DD	On-Demand	Anodyne	ADRB1	27	44
O[C@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1cccnc1	ZINC000819175282	DD	On-Demand	Anodyne	ADRB3	81	52
O[C@H](CNC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1cccnc1	ZINC000819175283	DD	On-Demand	Anodyne	ADRB1	27	44
O[C@H](CNC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1cccnc1	ZINC000819175283	DD	On-Demand	Anodyne	ADRB3	81	52
O[C@H](CNC1CCN([C@H]2CCC[C@@H]2O)CC1)c1cccnc1	ZINC000819175284	DD	On-Demand	Anodyne	ADRB1	27	44
O[C@H](CNC1CCN([C@H]2CCC[C@@H]2O)CC1)c1cccnc1	ZINC000819175284	DD	On-Demand	Anodyne	ADRB3	81	52
O[C@H](CNC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1ccccc1C(F)(F)F	ZINC000819175289	FF	On-Demand	Anodyne	SLC18A3	42	39
O[C@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1ccccc1C(F)(F)F	ZINC000819175290	FF	On-Demand	Anodyne	SLC18A3	42	39
O[C@H](CNC1CCN([C@H]2CCC[C@@H]2O)CC1)c1ccccc1C(F)(F)F	ZINC000819175291	FF	On-Demand	Anodyne	SLC18A3	42	39
O[C@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1ccccc1C(F)(F)F	ZINC000819175292	FF	On-Demand	Anodyne	SLC18A3	42	39
O=[N+]([O-])c1ccc([C@H](O)CNC2CCN([C@@H]3CCC[C@@H]3O)CC2)cc1	ZINC000819175293	ED	On-Demand	Bother	SLC18A3	24	54
O=[N+]([O-])c1ccc([C@H](O)CNC2CCN([C@@H]3CCC[C@H]3O)CC2)cc1	ZINC000819175294	ED	On-Demand	Bother	SLC18A3	24	54
O=[N+]([O-])c1ccc([C@H](O)CNC2CCN([C@H]3CCC[C@@H]3O)CC2)cc1	ZINC000819175295	ED	On-Demand	Bother	SLC18A3	24	54
O=[N+]([O-])c1ccc([C@H](O)CNC2CCN([C@H]3CCC[C@H]3O)CC2)cc1	ZINC000819175296	ED	On-Demand	Bother	SLC18A3	24	54
O[C@H]1CCCC[C@H]1N1CCC(NC[C@@H](O)c2cc3ccccc3o2)CC1	ZINC000819175308	FF	On-Demand	Anodyne	SLC18A3	40	40
O[C@H]1CCCC[C@@H]1N1CCC(NC[C@@H](O)c2cc3ccccc3o2)CC1	ZINC000819175309	FF	On-Demand	Anodyne	SLC18A3	40	40
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1cc2ccccc2o1	ZINC000819175310	FF	On-Demand	Anodyne	SLC18A3	40	40
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1cc2ccccc2o1	ZINC000819175311	FF	On-Demand	Anodyne	SLC18A3	40	40
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1cccc(F)c1	ZINC000819175318	EE	On-Demand	Anodyne	SLC18A3	45	39
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1cccc(F)c1	ZINC000819175319	EE	On-Demand	Anodyne	SLC18A3	45	39
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1cccc(F)c1	ZINC000819175320	EE	On-Demand	Anodyne	SLC18A3	45	39
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1cccc(F)c1	ZINC000819175321	EE	On-Demand	Anodyne	SLC18A3	45	39
O[C@@H](CN[C@@H]1CCOC2(CCCC2)C1)c1cccnc1	ZINC000819175326	CE	On-Demand	Anodyne	ADRB3	54	43
O[C@@H](CN[C@H]1CCOC2(CCCC2)C1)c1cccnc1	ZINC000819175327	CE	On-Demand	Anodyne	ADRB3	54	43
O[C@H](CN[C@@H]1CCOC2(CCCC2)C1)c1cccnc1	ZINC000819175328	CE	On-Demand	Anodyne	ADRB3	54	43
O[C@H](CN[C@H]1CCOC2(CCCC2)C1)c1cccnc1	ZINC000819175329	CE	On-Demand	Anodyne	ADRB3	54	43
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	ACE	40	49
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	ELANE	23	41
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	TACR1	15	47
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	CTRA_BOVIN	67	37
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	CASP3	18	42
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	KLK3	103	49
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	CTSB	70	44
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	PAPA1_CARPA	73	39
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	TRY1_BOVIN	50	37
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	CYSP_TRYCR	58	44
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	CTSG	46	37
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	CTSK	67	47
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	CTSL	56	45
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	NPFFR2	58	36
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	PREP	17	40
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	CAPNS1	70	40
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	CELA2A	55	37
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	LGMN	44	36
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	MMP11	63	33
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	TGM1	25	44
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	CTSS	37	47
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	CAPN1	93	52
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	CASP1	26	41
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	CAPN2	144	46
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	PLAU	17	41
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	CASP9	30	40
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	TGM2	27	44
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	NPR	78	38
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	CASP10	36	40
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	PSMB5	48	40
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	NPFFR1	42	33
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	Q6PRC7_IXORI	41	33
CC1(C)CCC[C@H]1CNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1	ZINC000819175358	GE	On-Demand	Anodyne	SLC12A5	58	34
CC1(C)CCC[C@H]1CNC(=O)c1ccc(F)c(S(C)(=O)=O)c1	ZINC000819175361	EF	On-Demand	Anodyne	CACNA1I	44	32
CC1(C)CCC[C@H]1CNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000819175398	GH	On-Demand	Anodyne	HTR4	16	42
CC1(C)CCC[C@H]1CNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000819175398	GH	On-Demand	Anodyne	SLC6A9	56	37
CC1(C)CCC[C@H]1CNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000819175398	GH	On-Demand	Anodyne	CACNA1I	61	34
CC1(C)CCC[C@H]1CNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819175432	FF	On-Demand	Anodyne	ACE	21	40
CC1(C)CCC[C@H]1CNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819175432	FF	On-Demand	Anodyne	FKBP1A	20	42
CC1(C)CCC[C@H]1CNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819175432	FF	On-Demand	Anodyne	CELA1	19	41
CC1(C)CCC[C@H]1CNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819175432	FF	On-Demand	Anodyne	CTRA_BOVIN	53	31
CC1(C)CCC[C@H]1CNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819175432	FF	On-Demand	Anodyne	TRY1_BOVIN	43	31
CC1(C)CCC[C@H]1CNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819175432	FF	On-Demand	Anodyne	CTSG	40	31
CC1(C)CCC[C@H]1CNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819175432	FF	On-Demand	Anodyne	PREP	29	41
CC1(C)CCC[C@H]1CNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819175432	FF	On-Demand	Anodyne	CELA2A	40	31
CC1(C)CCC[C@H]1CNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819175432	FF	On-Demand	Anodyne	LGMN	65	39
CC1(C)CCC[C@H]1CNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819175432	FF	On-Demand	Anodyne	SLC12A5	64	38
CC1(C)CCC[C@H]1CNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819175432	FF	On-Demand	Anodyne	Q9NAW4_PLAFA	44	53
CC1(C)CCC[C@H]1CNC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819175432	FF	On-Demand	Anodyne	VHL	61	35
CC(C)(C)OC(=O)N1CCCC[C@H]1CNC(=O)Cc1nsc2ccccc12	ZINC000819175451	GH	On-Demand	Anodyne	HTR1A	16	40
CC(C)(C)OC(=O)N1CCCC[C@H]1CNC(=O)Cc1nsc2ccccc12	ZINC000819175451	GH	On-Demand	Anodyne	DRD2	23	40
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)Cc1nsc2ccccc12	ZINC000819175452	GH	On-Demand	Anodyne	HTR1A	16	40
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)Cc1nsc2ccccc12	ZINC000819175452	GH	On-Demand	Anodyne	DRD2	23	40
O[C@@H]1CCCC[C@@H]1N1CCC(NCC2(O)CCCCC2)CC1	ZINC000819175463	DE	On-Demand	Anodyne	SLC18A3	39	49
O[C@@H]1CCCC[C@H]1N1CCC(NCC2(O)CCCCC2)CC1	ZINC000819175464	DE	On-Demand	Anodyne	SLC18A3	39	49
O[C@H]1CCCC[C@@H]1N1CCC(NCC2(O)CCCCC2)CC1	ZINC000819175465	DE	On-Demand	Anodyne	SLC18A3	39	49
O[C@H]1CCCC[C@H]1N1CCC(NCC2(O)CCCCC2)CC1	ZINC000819175466	DE	On-Demand	Anodyne	SLC18A3	39	49
O=C(Cn1cc(C(=O)O)c2ccccc21)N[C@@H](c1ccccc1)C1CC1	ZINC000819175471	EH	On-Demand	Anodyne	CNR1	20	41
O=C(Cn1cc(C(=O)O)c2ccccc21)N[C@@H](c1ccccc1)C1CC1	ZINC000819175471	EH	On-Demand	Anodyne	CNR2	27	42
O=C(Cn1cc(C(=O)O)c2ccccc21)N[C@H](c1ccccc1)C1CC1	ZINC000819175472	EH	On-Demand	Anodyne	CNR1	20	41
O=C(Cn1cc(C(=O)O)c2ccccc21)N[C@H](c1ccccc1)C1CC1	ZINC000819175472	EH	On-Demand	Anodyne	CNR2	27	42
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1ccccc1Br	ZINC000819175487	GF	On-Demand	Anodyne	SLC18A3	61	44
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1ccccc1Br	ZINC000819175488	GF	On-Demand	Anodyne	SLC18A3	61	44
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccccc1Br	ZINC000819175489	GF	On-Demand	Anodyne	SLC18A3	61	44
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccccc1Br	ZINC000819175490	GF	On-Demand	Anodyne	SLC18A3	61	44
CN1CCN(c2ncccc2CNC(=O)C(F)=C2CCC2)CC1	ZINC000819175493	DD	On-Demand	Anodyne	SCN10A	16	40
C=C(Br)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819175513	FF	On-Demand	Mild	PAPA1_CARPA	48	57
C=C(Br)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819175513	FF	On-Demand	Mild	CTSK	16	54
C=C(Br)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819175514	FF	On-Demand	Mild	PAPA1_CARPA	48	57
C=C(Br)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819175514	FF	On-Demand	Mild	CTSK	16	54
O[C@H](CNC[C@@H]1[C@H]2Cc3ccccc3[C@H]21)c1cccnc1	ZINC000819175524	CE	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNC[C@@H]1[C@H]2Cc3ccccc3[C@H]21)c1cccnc1	ZINC000819175524	CE	On-Demand	Anodyne	ADRB1	22	41
O[C@H](CNC[C@@H]1[C@H]2Cc3ccccc3[C@H]21)c1cccnc1	ZINC000819175524	CE	On-Demand	Anodyne	ADRB3	82	41
O[C@H](CNC[C@@H]1[C@@H]2Cc3ccccc3[C@@H]12)c1cccnc1	ZINC000819175525	CE	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNC[C@@H]1[C@@H]2Cc3ccccc3[C@@H]12)c1cccnc1	ZINC000819175525	CE	On-Demand	Anodyne	ADRB1	22	41
O[C@H](CNC[C@@H]1[C@@H]2Cc3ccccc3[C@@H]12)c1cccnc1	ZINC000819175525	CE	On-Demand	Anodyne	ADRB3	82	41
O[C@H](CNC[C@H]1[C@H]2c3ccccc3C[C@H]21)c1cccnc1	ZINC000819175526	CE	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNC[C@H]1[C@H]2c3ccccc3C[C@H]21)c1cccnc1	ZINC000819175526	CE	On-Demand	Anodyne	ADRB1	22	41
O[C@H](CNC[C@H]1[C@H]2c3ccccc3C[C@H]21)c1cccnc1	ZINC000819175526	CE	On-Demand	Anodyne	ADRB3	82	41
O[C@H](CNC[C@@H]1[C@H]2Cc3ccccc3[C@@H]21)c1cccnc1	ZINC000819175527	CE	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNC[C@@H]1[C@H]2Cc3ccccc3[C@@H]21)c1cccnc1	ZINC000819175527	CE	On-Demand	Anodyne	ADRB1	22	41
O[C@H](CNC[C@@H]1[C@H]2Cc3ccccc3[C@@H]21)c1cccnc1	ZINC000819175527	CE	On-Demand	Anodyne	ADRB3	82	41
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)C1CC1	ZINC000819175532	CD	On-Demand	Anodyne	SLC18A3	37	49
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)C1CC1	ZINC000819175533	CD	On-Demand	Anodyne	SLC18A3	37	49
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)C1CC1	ZINC000819175534	CD	On-Demand	Anodyne	SLC18A3	37	49
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)C1CC1	ZINC000819175535	CD	On-Demand	Anodyne	SLC18A3	37	49
O=C(/C=C/[C@H]1CCCO1)N1CCN(c2ccc(Cl)cc2)CC1	ZINC000819175537	DF	On-Demand	Anodyne	AKR1C3	15	52
O=C(/C=C\[C@@H]1CCCO1)N1CCN(c2ccc(Cl)cc2)CC1	ZINC000819175538	DF	On-Demand	Anodyne	AKR1C3	15	52
Cn1nc(C(=O)NC[C@H]2CCCC2(C)C)c2ccccc2c1=O	ZINC000819175548	DE	On-Demand	Anodyne	HTR3A	15	41
Cn1nc(C(=O)NC[C@@H]2CCCC2(C)C)c2ccccc2c1=O	ZINC000819175549	DE	On-Demand	Anodyne	HTR3A	15	41
CC1(C)CCC[C@H]1CNC(=O)[C@@]1(NC(=O)OCc2ccccc2)CCOC1	ZINC000819175627	FG	On-Demand	Anodyne	CTSK	15	49
CC1(C)CCC[C@H]1CNC(=O)[C@@]1(NC(=O)OCc2ccccc2)CCOC1	ZINC000819175627	FG	On-Demand	Anodyne	CAPN2	55	36
CC1(C)CCC[C@H]1CNC(=O)[C@@]1(NC(=O)OCc2ccccc2)CCOC1	ZINC000819175627	FG	On-Demand	Anodyne	NPR	58	33
CC1(C)CCC[C@H]1CNC(=O)[C@@]1(NC(=O)OCc2ccccc2)CCOC1	ZINC000819175627	FG	On-Demand	Anodyne	SLC12A5	48	34
CC1(C)CCC[C@H]1CNC(=O)[C@]1(NC(=O)OCc2ccccc2)CCOC1	ZINC000819175629	FG	On-Demand	Anodyne	CTSK	15	49
CC1(C)CCC[C@H]1CNC(=O)[C@]1(NC(=O)OCc2ccccc2)CCOC1	ZINC000819175629	FG	On-Demand	Anodyne	CAPN2	55	36
CC1(C)CCC[C@H]1CNC(=O)[C@]1(NC(=O)OCc2ccccc2)CCOC1	ZINC000819175629	FG	On-Demand	Anodyne	NPR	58	33
CC1(C)CCC[C@H]1CNC(=O)[C@]1(NC(=O)OCc2ccccc2)CCOC1	ZINC000819175629	FG	On-Demand	Anodyne	SLC12A5	48	34
O=C(/C=C/[C@@H]1CCCO1)N1CCN(c2ccc(Cl)cc2)CC1	ZINC000819175639	DF	On-Demand	Anodyne	AKR1C3	15	52
O=C(/C=C\[C@H]1CCCO1)N1CCN(c2ccc(Cl)cc2)CC1	ZINC000819175640	DF	On-Demand	Anodyne	AKR1C3	15	52
O[C@H](CNC1CCN([C@@H]2CCCC[C@@H]2O)CC1)c1ccc(F)cc1	ZINC000819175641	EE	On-Demand	Anodyne	SLC18A3	58	42
O[C@H](CNC1CCN([C@H]2CCCC[C@@H]2O)CC1)c1ccc(F)cc1	ZINC000819175642	EE	On-Demand	Anodyne	SLC18A3	58	42
O[C@H](CNC1CCN([C@@H]2CCCC[C@H]2O)CC1)c1ccc(F)cc1	ZINC000819175643	EE	On-Demand	Anodyne	SLC18A3	58	42
O[C@H](CNC1CCN([C@H]2CCCC[C@H]2O)CC1)c1ccc(F)cc1	ZINC000819175644	EE	On-Demand	Anodyne	SLC18A3	58	42
O[C@H](CNC1CCN([C@@H]2CCC[C@@H]2O)CC1)c1cccc(C(F)(F)F)c1	ZINC000819175649	FF	On-Demand	Anodyne	CCR2	40	38
O[C@H](CNC1CCN([C@@H]2CCC[C@H]2O)CC1)c1cccc(C(F)(F)F)c1	ZINC000819175650	FF	On-Demand	Anodyne	CCR2	40	38
O[C@H](CNC1CCN([C@H]2CCC[C@@H]2O)CC1)c1cccc(C(F)(F)F)c1	ZINC000819175651	FF	On-Demand	Anodyne	CCR2	40	38
O[C@H](CNC1CCN([C@H]2CCC[C@H]2O)CC1)c1cccc(C(F)(F)F)c1	ZINC000819175652	FF	On-Demand	Anodyne	CCR2	40	38
CC1(C)CCC[C@H]1CNC(=O)c1cccnc1SC(F)F	ZINC000819175732	DH	On-Demand	Anodyne	G2YM83_BOTF4	50	31
CC1(C)CCC[C@H]1CNC(=O)c1cccnc1-n1cccn1	ZINC000819175737	CF	On-Demand	Anodyne	HCN1	41	33
CC1(C)CCC[C@H]1CNC(=O)c1cccnc1-n1cccn1	ZINC000819175737	CF	On-Demand	Anodyne	HCN4	41	33
CC1(C)CCC[C@H]1CNC(=O)c1cccnc1-n1cccn1	ZINC000819175737	CF	On-Demand	Anodyne	G2YM83_BOTF4	51	32
O=[N+]([O-])c1cnn(CCNC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819175782	FC	On-Demand	Bother	ADRB2	29	42
O=[N+]([O-])c1cnn(CCNC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819175782	FC	On-Demand	Bother	ADRB1	53	38
O=[N+]([O-])c1cnn(CCNC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819175782	FC	On-Demand	Bother	ADRB3	27	42
O=[N+]([O-])c1cnn(CCNC[C@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819175783	FC	On-Demand	Bother	ADRB2	29	42
O=[N+]([O-])c1cnn(CCNC[C@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819175783	FC	On-Demand	Bother	ADRB1	53	38
O=[N+]([O-])c1cnn(CCNC[C@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819175783	FC	On-Demand	Bother	ADRB3	27	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCn2cc([N+](=O)[O-])cn2)CC1	ZINC000819175872	GD	On-Demand	Bother	GPR119	38	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCn2cc([N+](=O)[O-])cn2)CC1	ZINC000819175873	GD	On-Demand	Bother	GPR119	38	41
O=[N+]([O-])c1cccc([C@H](O)CNCCn2cc([N+](=O)[O-])cn2)c1	ZINC000819175906	DD	On-Demand	Bother	ADRB3	47	36
O=[N+]([O-])c1cccc([C@@H](O)CNCCn2cc([N+](=O)[O-])cn2)c1	ZINC000819175907	DD	On-Demand	Bother	ADRB3	47	36
O[C@@H](CN[C@@H]1CCOC2(CCOCC2)C1)c1cccc(Cl)c1	ZINC000819175935	EF	On-Demand	Anodyne	ADRB1	26	44
O[C@@H](CN[C@@H]1CCOC2(CCOCC2)C1)c1cccc(Cl)c1	ZINC000819175935	EF	On-Demand	Anodyne	ADRB3	42	47
O[C@@H](CN[C@@H]1CCOC2(CCOCC2)C1)c1cccc(Cl)c1	ZINC000819175935	EF	On-Demand	Anodyne	CYP3A4	43	36
O[C@@H](CN[C@H]1CCOC2(CCOCC2)C1)c1cccc(Cl)c1	ZINC000819175936	EF	On-Demand	Anodyne	ADRB1	26	44
O[C@@H](CN[C@H]1CCOC2(CCOCC2)C1)c1cccc(Cl)c1	ZINC000819175936	EF	On-Demand	Anodyne	ADRB3	42	47
O[C@@H](CN[C@H]1CCOC2(CCOCC2)C1)c1cccc(Cl)c1	ZINC000819175936	EF	On-Demand	Anodyne	CYP3A4	43	36
O[C@H](CN[C@@H]1CCOC2(CCOCC2)C1)c1cccc(Cl)c1	ZINC000819175937	EF	On-Demand	Anodyne	ADRB1	26	44
O[C@H](CN[C@@H]1CCOC2(CCOCC2)C1)c1cccc(Cl)c1	ZINC000819175937	EF	On-Demand	Anodyne	ADRB3	42	47
O[C@H](CN[C@@H]1CCOC2(CCOCC2)C1)c1cccc(Cl)c1	ZINC000819175937	EF	On-Demand	Anodyne	CYP3A4	43	36
O[C@H](CN[C@H]1CCOC2(CCOCC2)C1)c1cccc(Cl)c1	ZINC000819175938	EF	On-Demand	Anodyne	ADRB1	26	44
O[C@H](CN[C@H]1CCOC2(CCOCC2)C1)c1cccc(Cl)c1	ZINC000819175938	EF	On-Demand	Anodyne	ADRB3	42	47
O[C@H](CN[C@H]1CCOC2(CCOCC2)C1)c1cccc(Cl)c1	ZINC000819175938	EF	On-Demand	Anodyne	CYP3A4	43	36
Cc1ccccc1[C@@H](O)CNCc1ccc(O)c(Br)c1	ZINC000819175977	EG	On-Demand	Anodyne	ADRB2	50	36
O[C@H](CN[C@H]1CCO[C@]2(CCSC2)C1)c1cccc(Cl)c1	ZINC000819175997	EG	On-Demand	Anodyne	ADRB1	28	41
O[C@H](CN[C@H]1CCO[C@]2(CCSC2)C1)c1cccc(Cl)c1	ZINC000819175997	EG	On-Demand	Anodyne	ADRB3	45	47
O[C@H](CN[C@@H]1CCO[C@]2(CCSC2)C1)c1cccc(Cl)c1	ZINC000819175998	EG	On-Demand	Anodyne	ADRB1	28	41
O[C@H](CN[C@@H]1CCO[C@]2(CCSC2)C1)c1cccc(Cl)c1	ZINC000819175998	EG	On-Demand	Anodyne	ADRB3	45	47
O[C@H](CN[C@@H]1CCO[C@@]2(CCSC2)C1)c1cccc(Cl)c1	ZINC000819175999	EG	On-Demand	Anodyne	ADRB1	28	41
O[C@H](CN[C@@H]1CCO[C@@]2(CCSC2)C1)c1cccc(Cl)c1	ZINC000819175999	EG	On-Demand	Anodyne	ADRB3	45	47
O[C@H](CN[C@H]1CCO[C@@]2(CCSC2)C1)c1cccc(Cl)c1	ZINC000819176000	EG	On-Demand	Anodyne	ADRB1	28	41
O[C@H](CN[C@H]1CCO[C@@]2(CCSC2)C1)c1cccc(Cl)c1	ZINC000819176000	EG	On-Demand	Anodyne	ADRB3	45	47
Oc1ccc(CCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819176070	CF	On-Demand	Anodyne	ADRB2	86	58
Oc1ccc(CCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819176070	CF	On-Demand	Anodyne	ADRB1	89	49
Oc1ccc(CCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819176070	CF	On-Demand	Anodyne	ADRB3	133	49
Oc1ccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819176071	CF	On-Demand	Anodyne	ADRB2	86	58
Oc1ccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819176071	CF	On-Demand	Anodyne	ADRB1	89	49
Oc1ccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819176071	CF	On-Demand	Anodyne	ADRB3	133	49
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cc2ccccc2o1	ZINC000819176075	DG	On-Demand	Anodyne	ADRB2	45	40
Oc1cccc(CCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819176085	CF	On-Demand	Anodyne	ADRB2	85	47
Oc1cccc(CCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819176085	CF	On-Demand	Anodyne	ADRB1	73	49
Oc1cccc(CCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819176085	CF	On-Demand	Anodyne	ADRB3	91	49
Oc1cccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819176086	CF	On-Demand	Anodyne	ADRB2	85	47
Oc1cccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819176086	CF	On-Demand	Anodyne	ADRB1	73	49
Oc1cccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819176086	CF	On-Demand	Anodyne	ADRB3	91	49
O[C@@H](CN[C@H]1CCOC2(CCC2)C1)c1cccnc1	ZINC000819176091	CD	On-Demand	Anodyne	ADRB3	75	43
O[C@@H](CN[C@@H]1CCOC2(CCC2)C1)c1cccnc1	ZINC000819176092	CD	On-Demand	Anodyne	ADRB3	75	43
O[C@H](CN[C@H]1CCOC2(CCC2)C1)c1cccnc1	ZINC000819176093	CD	On-Demand	Anodyne	ADRB3	75	43
O[C@H](CN[C@@H]1CCOC2(CCC2)C1)c1cccnc1	ZINC000819176094	CD	On-Demand	Anodyne	ADRB3	75	43
Oc1ccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819176100	DG	On-Demand	Anodyne	ADRB2	78	55
Oc1ccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819176100	DG	On-Demand	Anodyne	ADRB1	81	49
Oc1ccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819176100	DG	On-Demand	Anodyne	ADRB3	117	49
Oc1ccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819176101	DG	On-Demand	Anodyne	ADRB2	78	55
Oc1ccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819176101	DG	On-Demand	Anodyne	ADRB1	81	49
Oc1ccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819176101	DG	On-Demand	Anodyne	ADRB3	117	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	OPRM1	32	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	MME	44	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	CTSD	91	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	PGC	59	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	CTSB	36	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	PAPA1_CARPA	55	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	CTSK	22	53
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	CTSL	22	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	PGA	51	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	BACE2	47	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	TACR3	18	56
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	CAPNS1	46	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	ECE1	16	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	REN	79	51
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	REN1	23	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	YARS	46	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	CAPN1	41	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	CAPN2	53	31
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	BACE1	88	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	FPR1	54	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)cc1	ZINC000819176102	GF	On-Demand	Anodyne	PLM1_PLAFA	32	40
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccccc1Cl	ZINC000819176110	DG	On-Demand	Anodyne	ADRB2	48	43
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccccc1Cl	ZINC000819176110	DG	On-Demand	Anodyne	ADRB1	26	46
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccccc1Cl	ZINC000819176110	DG	On-Demand	Anodyne	ADRB3	42	42
Oc1cccc(CCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819176111	CD	On-Demand	Anodyne	ADRB2	46	38
Oc1cccc(CCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819176111	CD	On-Demand	Anodyne	ADRB1	42	39
Oc1cccc(CCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819176111	CD	On-Demand	Anodyne	ADRB3	54	39
Oc1cccc(CCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819176112	CD	On-Demand	Anodyne	ADRB2	46	38
Oc1cccc(CCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819176112	CD	On-Demand	Anodyne	ADRB1	42	39
Oc1cccc(CCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819176112	CD	On-Demand	Anodyne	ADRB3	54	39
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176114	DF	On-Demand	Bother	ADRB2	56	45
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176114	DF	On-Demand	Bother	ADRB1	33	45
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176114	DF	On-Demand	Bother	ADRB3	58	45
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176116	DF	On-Demand	Bother	ADRB2	56	45
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176116	DF	On-Demand	Bother	ADRB1	33	45
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176116	DF	On-Demand	Bother	ADRB3	58	45
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819176117	FH	On-Demand	Anodyne	ADRB2	57	46
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819176117	FH	On-Demand	Anodyne	ADRB1	25	44
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819176117	FH	On-Demand	Anodyne	ADRB3	41	42
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819176119	FH	On-Demand	Anodyne	ADRB2	57	46
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819176119	FH	On-Demand	Anodyne	ADRB1	25	44
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819176119	FH	On-Demand	Anodyne	ADRB3	41	42
C#CCNC(=O)CCNCCc1ccc(O)c(OC)c1	ZINC000819176121	CC	On-Demand	Mild	TRPV1	15	51
C#CCNC(=O)CCNCCc1ccc(O)c(OC)c1	ZINC000819176121	CC	On-Demand	Mild	NCE103	15	47
Oc1ccc(CCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819176126	CE	On-Demand	Anodyne	ADRB2	107	54
Oc1ccc(CCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819176126	CE	On-Demand	Anodyne	ADRB1	112	56
Oc1ccc(CCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819176126	CE	On-Demand	Anodyne	ADRB3	172	56
Oc1ccc(CCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819176127	CE	On-Demand	Anodyne	ADRB2	107	54
Oc1ccc(CCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819176127	CE	On-Demand	Anodyne	ADRB1	112	56
Oc1ccc(CCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819176127	CE	On-Demand	Anodyne	ADRB3	172	56
Oc1ccc(CCNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819176128	CF	On-Demand	Anodyne	ADRB2	70	46
Oc1ccc(CCNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819176128	CF	On-Demand	Anodyne	ADRB1	81	46
Oc1ccc(CCNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819176128	CF	On-Demand	Anodyne	ADRB3	86	46
Oc1ccc(CCNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819176129	CF	On-Demand	Anodyne	ADRB2	70	46
Oc1ccc(CCNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819176129	CF	On-Demand	Anodyne	ADRB1	81	46
Oc1ccc(CCNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819176129	CF	On-Demand	Anodyne	ADRB3	86	46
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819176133	EE	On-Demand	Anodyne	ADRB2	47	38
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819176133	EE	On-Demand	Anodyne	PAPA1_CARPA	33	40
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819176136	EE	On-Demand	Anodyne	ADRB2	47	38
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819176136	EE	On-Demand	Anodyne	PAPA1_CARPA	33	40
O[C@@H](CN[C@@H]1CCCC(F)(F)C1)c1cccnc1	ZINC000819176137	CE	On-Demand	Anodyne	ADRB1	21	43
O[C@@H](CN[C@@H]1CCCC(F)(F)C1)c1cccnc1	ZINC000819176137	CE	On-Demand	Anodyne	ADRB3	78	45
O[C@H](CN[C@H]1CCCC(F)(F)C1)c1cccnc1	ZINC000819176138	CE	On-Demand	Anodyne	ADRB1	21	43
O[C@H](CN[C@H]1CCCC(F)(F)C1)c1cccnc1	ZINC000819176138	CE	On-Demand	Anodyne	ADRB3	78	45
O[C@@H](CN[C@H]1CCCC(F)(F)C1)c1cccnc1	ZINC000819176139	CE	On-Demand	Anodyne	ADRB1	21	43
O[C@@H](CN[C@H]1CCCC(F)(F)C1)c1cccnc1	ZINC000819176139	CE	On-Demand	Anodyne	ADRB3	78	45
O[C@H](CN[C@@H]1CCCC(F)(F)C1)c1cccnc1	ZINC000819176140	CE	On-Demand	Anodyne	ADRB1	21	43
O[C@H](CN[C@@H]1CCCC(F)(F)C1)c1cccnc1	ZINC000819176140	CE	On-Demand	Anodyne	ADRB3	78	45
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819176141	GH	On-Demand	Anodyne	ADRB2	46	70
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819176141	GH	On-Demand	Anodyne	ADRB1	23	49
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819176141	GH	On-Demand	Anodyne	ADRB3	28	48
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819176142	GH	On-Demand	Anodyne	ADRB2	46	70
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819176142	GH	On-Demand	Anodyne	ADRB1	23	49
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819176142	GH	On-Demand	Anodyne	ADRB3	28	48
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819176143	GH	On-Demand	Anodyne	ADRB2	46	70
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819176143	GH	On-Demand	Anodyne	ADRB1	23	49
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819176143	GH	On-Demand	Anodyne	ADRB3	28	48
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819176144	GH	On-Demand	Anodyne	ADRB2	46	70
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819176144	GH	On-Demand	Anodyne	ADRB1	23	49
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819176144	GH	On-Demand	Anodyne	ADRB3	28	48
C[C@H](CCc1ccc(O)cc1)NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819176145	FF	On-Demand	Anodyne	PAPA1_CARPA	34	44
C[C@H](CCc1ccc(O)cc1)NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819176145	FF	On-Demand	Anodyne	GRIA1	47	34
C[C@@H](CCc1ccc(O)cc1)NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819176146	FF	On-Demand	Anodyne	PAPA1_CARPA	34	44
C[C@@H](CCc1ccc(O)cc1)NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819176146	FF	On-Demand	Anodyne	GRIA1	47	34
C[C@H](CCc1ccc(O)cc1)NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819176147	FF	On-Demand	Anodyne	PAPA1_CARPA	34	44
C[C@H](CCc1ccc(O)cc1)NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819176147	FF	On-Demand	Anodyne	GRIA1	47	34
C[C@@H](CCc1ccc(O)cc1)NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819176148	FF	On-Demand	Anodyne	PAPA1_CARPA	34	44
C[C@@H](CCc1ccc(O)cc1)NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819176148	FF	On-Demand	Anodyne	GRIA1	47	34
COc1ccc(OC)c([C@H](O)CNCCc2ccc(O)c(OC)c2)c1	ZINC000819176150	EE	On-Demand	Anodyne	ADRB2	104	64
COc1ccc(OC)c([C@H](O)CNCCc2ccc(O)c(OC)c2)c1	ZINC000819176150	EE	On-Demand	Anodyne	ADRB1	86	50
COc1ccc(OC)c([C@H](O)CNCCc2ccc(O)c(OC)c2)c1	ZINC000819176150	EE	On-Demand	Anodyne	ADRB3	72	53
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176151	EF	On-Demand	Bother	ADRB2	49	63
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176151	EF	On-Demand	Bother	ADRB1	44	49
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176151	EF	On-Demand	Bother	ADRB3	70	40
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176152	EF	On-Demand	Bother	ADRB2	49	63
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176152	EF	On-Demand	Bother	ADRB1	44	49
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176152	EF	On-Demand	Bother	ADRB3	70	40
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176153	EF	On-Demand	Bother	ADRB2	49	63
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176153	EF	On-Demand	Bother	ADRB1	44	49
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176153	EF	On-Demand	Bother	ADRB3	70	40
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176154	EF	On-Demand	Bother	ADRB2	49	63
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176154	EF	On-Demand	Bother	ADRB1	44	49
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176154	EF	On-Demand	Bother	ADRB3	70	40
O=[N+]([O-])c1cnn(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819176202	CD	On-Demand	Bother	ADRB2	17	41
O=[N+]([O-])c1cnn(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819176202	CD	On-Demand	Bother	ADRB3	71	38
O=[N+]([O-])c1cnn(CCNC[C@H](O)c2ccccc2)c1	ZINC000819176203	CD	On-Demand	Bother	ADRB2	17	41
O=[N+]([O-])c1cnn(CCNC[C@H](O)c2ccccc2)c1	ZINC000819176203	CD	On-Demand	Bother	ADRB3	71	38
O=[N+]([O-])c1cnn(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819176204	CC	On-Demand	Bother	ADRB2	27	44
O=[N+]([O-])c1cnn(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819176204	CC	On-Demand	Bother	ADRB1	31	45
O=[N+]([O-])c1cnn(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819176204	CC	On-Demand	Bother	ADRB3	106	48
O=[N+]([O-])c1cnn(CCNC[C@H](O)c2cccnc2)c1	ZINC000819176205	CC	On-Demand	Bother	ADRB2	27	44
O=[N+]([O-])c1cnn(CCNC[C@H](O)c2cccnc2)c1	ZINC000819176205	CC	On-Demand	Bother	ADRB1	31	45
O=[N+]([O-])c1cnn(CCNC[C@H](O)c2cccnc2)c1	ZINC000819176205	CC	On-Demand	Bother	ADRB3	106	48
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176207	FE	On-Demand	Anodyne	F2	39	46
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176207	FE	On-Demand	Anodyne	PRSS1	15	40
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176207	FE	On-Demand	Anodyne	ACE	90	56
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176207	FE	On-Demand	Anodyne	DRD3	22	42
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176207	FE	On-Demand	Anodyne	MME	28	48
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176207	FE	On-Demand	Anodyne	HCRTR1	27	43
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176207	FE	On-Demand	Anodyne	PRCP	15	41
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176207	FE	On-Demand	Anodyne	CPT1A	44	35
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176207	FE	On-Demand	Anodyne	CPT2	40	34
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176207	FE	On-Demand	Anodyne	DPP4	34	65
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176207	FE	On-Demand	Anodyne	PREP	119	60
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176207	FE	On-Demand	Anodyne	LGMN	55	38
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176207	FE	On-Demand	Anodyne	ACE2	25	43
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176207	FE	On-Demand	Anodyne	HCRTR2	20	42
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176207	FE	On-Demand	Anodyne	TMPRSS11D	65	35
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176209	FE	On-Demand	Anodyne	F2	39	46
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176209	FE	On-Demand	Anodyne	PRSS1	15	40
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176209	FE	On-Demand	Anodyne	ACE	90	56
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176209	FE	On-Demand	Anodyne	DRD3	22	42
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176209	FE	On-Demand	Anodyne	MME	28	48
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176209	FE	On-Demand	Anodyne	HCRTR1	27	43
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176209	FE	On-Demand	Anodyne	PRCP	15	41
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176209	FE	On-Demand	Anodyne	CPT1A	44	35
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176209	FE	On-Demand	Anodyne	CPT2	40	34
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176209	FE	On-Demand	Anodyne	DPP4	34	65
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176209	FE	On-Demand	Anodyne	PREP	119	60
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176209	FE	On-Demand	Anodyne	LGMN	55	38
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176209	FE	On-Demand	Anodyne	ACE2	25	43
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176209	FE	On-Demand	Anodyne	HCRTR2	20	42
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccc(-c2ccccc2)cc1	ZINC000819176209	FE	On-Demand	Anodyne	TMPRSS11D	65	35
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819176212	CC	On-Demand	Anodyne	SLC6A1	72	36
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819176212	CC	On-Demand	Anodyne	PLD1	42	37
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819176212	CC	On-Demand	Anodyne	SLC18A3	16	42
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819176212	CC	On-Demand	Anodyne	PREP	16	45
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819176212	CC	On-Demand	Anodyne	CCR2	18	41
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819176212	CC	On-Demand	Anodyne	EPHX2	16	40
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819176212	CC	On-Demand	Anodyne	DPP7	23	40
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819176212	CC	On-Demand	Anodyne	SCD	21	40
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819176214	CC	On-Demand	Anodyne	SLC6A1	72	36
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819176214	CC	On-Demand	Anodyne	PLD1	42	37
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819176214	CC	On-Demand	Anodyne	SLC18A3	16	42
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819176214	CC	On-Demand	Anodyne	PREP	16	45
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819176214	CC	On-Demand	Anodyne	CCR2	18	41
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819176214	CC	On-Demand	Anodyne	EPHX2	16	40
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819176214	CC	On-Demand	Anodyne	DPP7	23	40
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(F)cc1	ZINC000819176214	CC	On-Demand	Anodyne	SCD	21	40
O=C(NCC#Cc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819176217	DE	On-Demand	Mild	RARG	33	40
O=C(NCC#Cc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819176217	DE	On-Demand	Mild	RARB	34	40
O=C(NCC#Cc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819176217	DE	On-Demand	Mild	FFAR1	22	40
O=C(NCC#Cc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819176217	DE	On-Demand	Mild	PDS	42	36
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1cccc([N+](=O)[O-])c1	ZINC000819176239	DC	On-Demand	Bother	DRD4	41	32
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1cccc([N+](=O)[O-])c1	ZINC000819176239	DC	On-Demand	Bother	CCR2	36	51
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1cccc([N+](=O)[O-])c1	ZINC000819176241	DC	On-Demand	Bother	DRD4	41	32
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1cccc([N+](=O)[O-])c1	ZINC000819176241	DC	On-Demand	Bother	CCR2	36	51
O=C(NC1CC1)c1cccc(S(=O)(=O)NC2(C(=O)O)CCCCC2)c1	ZINC000819176243	FD	On-Demand	Anodyne	MAPK14	16	40
O=C(NC1CC1)c1cccc(S(=O)(=O)NC2(C(=O)O)CCCCC2)c1	ZINC000819176243	FD	On-Demand	Anodyne	PLAU	19	42
O=C(NC1(C(=O)O)CCCCC1)c1ccc2nc(O)oc2c1	ZINC000819176245	DE	On-Demand	Anodyne	NTSR2	16	40
O=C(NC1(C(=O)O)CCCCC1)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	ZINC000819176258	GD	On-Demand	Anodyne	SFRP1	98	36
O=C(NC1(C(=O)O)CCCCC1)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	ZINC000819176258	GD	On-Demand	Anodyne	WNT3	58	32
O=C(NC1(C(=O)O)CCCCC1)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819176260	ED	On-Demand	Anodyne	NTSR2	18	41
O=C(NC1CC1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819176264	DD	On-Demand	Anodyne	EPHX2	62	44
O=C(NC1CC1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819176264	DD	On-Demand	Anodyne	L3MBTL3	42	34
O=C(NC1CC1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819176266	DD	On-Demand	Anodyne	EPHX2	62	44
O=C(NC1CC1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819176266	DD	On-Demand	Anodyne	L3MBTL3	42	34
O=C(NC1CC1)c1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819176269	DD	On-Demand	Anodyne	DRD4	19	43
O=C(NC1CC1)c1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819176269	DD	On-Demand	Anodyne	EPHX2	45	44
O=C(NC1CC1)c1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819176269	DD	On-Demand	Anodyne	KCNK3	82	42
O=C(NC1CC1)c1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819176269	DD	On-Demand	Anodyne	KCNK9	40	35
O=C(NC1CC1)c1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819176271	DD	On-Demand	Anodyne	DRD4	19	43
O=C(NC1CC1)c1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819176271	DD	On-Demand	Anodyne	EPHX2	45	44
O=C(NC1CC1)c1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819176271	DD	On-Demand	Anodyne	KCNK3	82	42
O=C(NC1CC1)c1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819176271	DD	On-Demand	Anodyne	KCNK9	40	35
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1cccc([N+](=O)[O-])c1	ZINC000819176282	DC	On-Demand	Bother	ACE	53	44
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1cccc([N+](=O)[O-])c1	ZINC000819176282	DC	On-Demand	Bother	DRD4	40	30
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1cccc([N+](=O)[O-])c1	ZINC000819176282	DC	On-Demand	Bother	PREP	89	50
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1cccc([N+](=O)[O-])c1	ZINC000819176282	DC	On-Demand	Bother	CCR2	21	49
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1cccc([N+](=O)[O-])c1	ZINC000819176284	DC	On-Demand	Bother	ACE	53	44
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1cccc([N+](=O)[O-])c1	ZINC000819176284	DC	On-Demand	Bother	DRD4	40	30
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1cccc([N+](=O)[O-])c1	ZINC000819176284	DC	On-Demand	Bother	PREP	89	50
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1cccc([N+](=O)[O-])c1	ZINC000819176284	DC	On-Demand	Bother	CCR2	21	49
O=C(NC1(C(=O)O)CCCC1)c1cccc(OCC(F)(F)F)c1	ZINC000819176297	EF	On-Demand	Anodyne	NTSR2	16	40
O=C(NC1CC1)c1cc(NC(=O)N2CC[C@@H](C(=O)O)C2)ccc1Cl	ZINC000819176306	FE	On-Demand	Anodyne	EPHX2	48	43
O=C(NC1CC1)c1cc(NC(=O)N2CC[C@H](C(=O)O)C2)ccc1Cl	ZINC000819176309	FE	On-Demand	Anodyne	EPHX2	48	43
O=C(NC1(C(=O)O)CCCCC1)c1cccc(Cn2ccnc2)c1	ZINC000819176311	EE	On-Demand	Anodyne	CYP19A1	20	60
O=C(NC1(C(=O)O)CCCCC1)c1cccc(Cn2ccnc2)c1	ZINC000819176311	EE	On-Demand	Anodyne	CYP11B1	51	48
O=C(NC1(C(=O)O)CCCCC1)c1cccc(Cn2ccnc2)c1	ZINC000819176311	EE	On-Demand	Anodyne	TBXAS1	64	49
O=C(NC1(C(=O)O)CCCCC1)c1cccc(Cn2ccnc2)c1	ZINC000819176311	EE	On-Demand	Anodyne	CYP11B2	26	47
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccncc1	ZINC000819176315	CB	On-Demand	Anodyne	PREP	23	53
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccncc1	ZINC000819176315	CB	On-Demand	Anodyne	DPP7	18	40
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccncc1	ZINC000819176318	CB	On-Demand	Anodyne	PREP	23	53
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccncc1	ZINC000819176318	CB	On-Demand	Anodyne	DPP7	18	40
O=C(NC1CC1)c1cc(NC(=O)N2CCC[C@H]2C(=O)O)ccc1Cl	ZINC000819176319	FE	On-Demand	Anodyne	ACE	44	37
O=C(NC1CC1)c1cc(NC(=O)N2CCC[C@H]2C(=O)O)ccc1Cl	ZINC000819176319	FE	On-Demand	Anodyne	UL80	39	42
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176329	FE	On-Demand	Anodyne	DRD4	15	45
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176329	FE	On-Demand	Anodyne	SLC6A1	76	36
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176329	FE	On-Demand	Anodyne	DRD3	28	44
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176329	FE	On-Demand	Anodyne	P2RY12	54	38
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176329	FE	On-Demand	Anodyne	PRNP	53	39
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176329	FE	On-Demand	Anodyne	PREP	27	47
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176329	FE	On-Demand	Anodyne	CCR2	17	43
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176329	FE	On-Demand	Anodyne	DPP7	29	44
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176329	FE	On-Demand	Anodyne	MCHR1	18	44
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176329	FE	On-Demand	Anodyne	UTS2	44	43
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176329	FE	On-Demand	Anodyne	L3MBTL3	46	35
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176331	FE	On-Demand	Anodyne	DRD4	15	45
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176331	FE	On-Demand	Anodyne	SLC6A1	76	36
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176331	FE	On-Demand	Anodyne	DRD3	28	44
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176331	FE	On-Demand	Anodyne	P2RY12	54	38
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176331	FE	On-Demand	Anodyne	PRNP	53	39
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176331	FE	On-Demand	Anodyne	PREP	27	47
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176331	FE	On-Demand	Anodyne	CCR2	17	43
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176331	FE	On-Demand	Anodyne	DPP7	29	44
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176331	FE	On-Demand	Anodyne	MCHR1	18	44
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176331	FE	On-Demand	Anodyne	UTS2	44	43
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1ccc(-c2ccccc2)cc1	ZINC000819176331	FE	On-Demand	Anodyne	L3MBTL3	46	35
O=C(NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176333	FC	On-Demand	Anodyne	CHRM1	15	43
O=C(NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176333	FC	On-Demand	Anodyne	DRD4	31	50
O=C(NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176333	FC	On-Demand	Anodyne	SLC6A1	138	41
O=C(NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176333	FC	On-Demand	Anodyne	SIGMAR1	20	49
O=C(NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176333	FC	On-Demand	Anodyne	MAPK1	24	43
O=C(NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176333	FC	On-Demand	Anodyne	SLC6A5	33	40
O=C(NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176333	FC	On-Demand	Anodyne	EPHX2	30	45
O=C(NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176333	FC	On-Demand	Anodyne	MCHR1	21	50
O=C(NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176333	FC	On-Demand	Anodyne	CCR8	59	40
O=C(NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176333	FC	On-Demand	Anodyne	SHH	23	41
O=C(NC1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176333	FC	On-Demand	Anodyne	HPGDS	34	41
O=C(NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176335	FC	On-Demand	Anodyne	CHRM1	15	43
O=C(NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176335	FC	On-Demand	Anodyne	DRD4	31	50
O=C(NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176335	FC	On-Demand	Anodyne	SLC6A1	138	41
O=C(NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176335	FC	On-Demand	Anodyne	SIGMAR1	20	49
O=C(NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176335	FC	On-Demand	Anodyne	MAPK1	24	43
O=C(NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176335	FC	On-Demand	Anodyne	SLC6A5	33	40
O=C(NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176335	FC	On-Demand	Anodyne	EPHX2	30	45
O=C(NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176335	FC	On-Demand	Anodyne	MCHR1	21	50
O=C(NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176335	FC	On-Demand	Anodyne	CCR8	59	40
O=C(NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176335	FC	On-Demand	Anodyne	SHH	23	41
O=C(NC1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1)c1ccccc1	ZINC000819176335	FC	On-Demand	Anodyne	HPGDS	34	41
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccsc1	ZINC000819176336	CC	On-Demand	Anodyne	F2	15	40
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccsc1	ZINC000819176336	CC	On-Demand	Anodyne	ACE	62	47
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccsc1	ZINC000819176336	CC	On-Demand	Anodyne	DPP4	25	46
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccsc1	ZINC000819176336	CC	On-Demand	Anodyne	PREP	91	51
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccsc1	ZINC000819176337	CC	On-Demand	Anodyne	F2	15	40
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccsc1	ZINC000819176337	CC	On-Demand	Anodyne	ACE	62	47
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccsc1	ZINC000819176337	CC	On-Demand	Anodyne	DPP4	25	46
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccsc1	ZINC000819176337	CC	On-Demand	Anodyne	PREP	91	51
O=C(NC1CCCC1)c1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819176340	EE	On-Demand	Anodyne	ACE	51	41
O=C(NC1CCCC1)c1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819176340	EE	On-Demand	Anodyne	EPHX2	33	42
O=C(NC1(C(=O)O)CCCCC1)c1ccc(CS(=O)(=O)C(F)F)cc1	ZINC000819176342	GE	On-Demand	Anodyne	CTSK	21	40
O=C(NC1(C(=O)O)CCCCC1)c1ccc2nc(O)[nH]c2c1	ZINC000819176396	DD	On-Demand	Anodyne	NTSR2	17	42
O=C(NC1CC1)c1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819176398	DD	On-Demand	Anodyne	ACE	50	42
O=C(NC1CC1)c1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819176398	DD	On-Demand	Anodyne	UL80	29	40
O=C(NC1CC1)c1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819176398	DD	On-Demand	Anodyne	PREP	49	39
O=C(NC1CC1)c1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819176398	DD	On-Demand	Anodyne	EPHX2	18	43
O=C(NC1CC1)c1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819176398	DD	On-Demand	Anodyne	KCNK3	74	39
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	ACE	53	48
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	FKBP1A	32	43
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	SLC6A1	84	38
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	GRIN2B	37	42
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	KLK3	49	32
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	CTSB	50	46
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	CYSP_TRYCR	46	41
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	CTSK	38	46
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	CTSL	45	46
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	PREP	55	58
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	CAPNS1	62	33
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	CTSS	31	41
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	CAPN1	64	39
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	CASP1	23	40
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	CAPN2	100	38
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	TGM2	41	45
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	DPP7	53	40
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	NPR	71	39
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	F13A1	26	40
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	BIRC2	18	41
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176416	DC	On-Demand	Anodyne	SLC12A5	60	38
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	ACE	53	48
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	FKBP1A	32	43
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	SLC6A1	84	38
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	GRIN2B	37	42
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	KLK3	49	32
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	CTSB	50	46
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	CYSP_TRYCR	46	41
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	CTSK	38	46
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	CTSL	45	46
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	PREP	55	58
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	CAPNS1	62	33
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	CTSS	31	41
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	CAPN1	64	39
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	CASP1	23	40
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	CAPN2	100	38
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	TGM2	41	45
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	DPP7	53	40
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	NPR	71	39
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	F13A1	26	40
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	BIRC2	18	41
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819176417	DC	On-Demand	Anodyne	SLC12A5	60	38
O=C(NC1CCOCC1)c1ccc(NC(=O)N2CCC(C(=O)O)CC2)cc1	ZINC000819176421	GD	On-Demand	Anodyne	PRNP	40	35
O=C(NC1CCOCC1)c1ccc(NC(=O)N2CCC(C(=O)O)CC2)cc1	ZINC000819176421	GD	On-Demand	Anodyne	MTOR	44	37
O=C(NC1CCOCC1)c1ccc(NC(=O)N2CCC(C(=O)O)CC2)cc1	ZINC000819176421	GD	On-Demand	Anodyne	EPHX2	50	43
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccc(Br)s1	ZINC000819176422	FD	On-Demand	Anodyne	ACE	58	46
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccc(Br)s1	ZINC000819176422	FD	On-Demand	Anodyne	DPP4	15	40
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1ccc(Br)s1	ZINC000819176422	FD	On-Demand	Anodyne	PREP	70	44
Cc1ccccc1[C@@H](O)CNCCc1cccc(O)c1	ZINC000819176425	CF	On-Demand	Anodyne	ADRB2	99	45
Cc1ccccc1[C@@H](O)CNCCc1cccc(O)c1	ZINC000819176425	CF	On-Demand	Anodyne	ADRB1	78	45
Cc1ccccc1[C@@H](O)CNCCc1cccc(O)c1	ZINC000819176425	CF	On-Demand	Anodyne	ADRB3	63	42
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccc(Br)s1	ZINC000819176426	FD	On-Demand	Anodyne	ACE	58	46
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccc(Br)s1	ZINC000819176426	FD	On-Demand	Anodyne	DPP4	15	40
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1ccc(Br)s1	ZINC000819176426	FD	On-Demand	Anodyne	PREP	70	44
Oc1ccc(CCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819176437	CF	On-Demand	Anodyne	ADRB2	81	50
Oc1ccc(CCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819176437	CF	On-Demand	Anodyne	ADRB1	89	47
Oc1ccc(CCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819176437	CF	On-Demand	Anodyne	ADRB3	90	47
Oc1ccc(CCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819176438	CF	On-Demand	Anodyne	ADRB2	81	50
Oc1ccc(CCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819176438	CF	On-Demand	Anodyne	ADRB1	89	47
Oc1ccc(CCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819176438	CF	On-Demand	Anodyne	ADRB3	90	47
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819176451	EE	On-Demand	Anodyne	ADRB2	52	41
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819176451	EE	On-Demand	Anodyne	ADRB1	30	51
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819176451	EE	On-Demand	Anodyne	ADRB3	61	51
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819176451	EE	On-Demand	Anodyne	CTSF	40	34
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819176452	EE	On-Demand	Anodyne	ADRB2	52	41
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819176452	EE	On-Demand	Anodyne	ADRB1	30	51
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819176452	EE	On-Demand	Anodyne	ADRB3	61	51
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819176452	EE	On-Demand	Anodyne	CTSF	40	34
Oc1cccc(CCNC[C@H](O)c2ccccc2Br)c1	ZINC000819176453	EG	On-Demand	Anodyne	ADRB2	84	42
Oc1cccc(CCNC[C@H](O)c2ccccc2Br)c1	ZINC000819176453	EG	On-Demand	Anodyne	ADRB1	67	42
Oc1cccc(CCNC[C@H](O)c2ccccc2Br)c1	ZINC000819176453	EG	On-Demand	Anodyne	ADRB3	54	40
Oc1cccc(CCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819176454	EG	On-Demand	Anodyne	ADRB2	84	42
Oc1cccc(CCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819176454	EG	On-Demand	Anodyne	ADRB1	67	42
Oc1cccc(CCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819176454	EG	On-Demand	Anodyne	ADRB3	54	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CC3CCC2CC3)CC1	ZINC000819176459	FG	On-Demand	Anodyne	GPR119	27	42
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1cccnc1	ZINC000819176460	CB	On-Demand	Anodyne	F2	23	46
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1cccnc1	ZINC000819176460	CB	On-Demand	Anodyne	ACE	60	47
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1cccnc1	ZINC000819176460	CB	On-Demand	Anodyne	FKBP1A	29	41
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1cccnc1	ZINC000819176460	CB	On-Demand	Anodyne	CPT2	41	36
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1cccnc1	ZINC000819176460	CB	On-Demand	Anodyne	DPP4	25	49
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1cccnc1	ZINC000819176460	CB	On-Demand	Anodyne	PREP	120	71
O=C(NCC(=O)N1CCC[C@H]1C(=O)O)c1cccnc1	ZINC000819176460	CB	On-Demand	Anodyne	TMPRSS11D	40	31
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CC3CCC2CC3)CC1	ZINC000819176461	FG	On-Demand	Anodyne	GPR119	27	42
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1cccnc1	ZINC000819176462	CB	On-Demand	Anodyne	F2	23	46
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1cccnc1	ZINC000819176462	CB	On-Demand	Anodyne	ACE	60	47
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1cccnc1	ZINC000819176462	CB	On-Demand	Anodyne	FKBP1A	29	41
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1cccnc1	ZINC000819176462	CB	On-Demand	Anodyne	CPT2	41	36
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1cccnc1	ZINC000819176462	CB	On-Demand	Anodyne	DPP4	25	49
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1cccnc1	ZINC000819176462	CB	On-Demand	Anodyne	PREP	120	71
O=C(NCC(=O)N1CCC[C@@H]1C(=O)O)c1cccnc1	ZINC000819176462	CB	On-Demand	Anodyne	TMPRSS11D	40	31
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CC3CCC2CC3)CC1	ZINC000819176465	FG	On-Demand	Anodyne	GPR119	27	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CC3CCC2CC3)CC1	ZINC000819176469	FG	On-Demand	Anodyne	GPR119	27	42
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1cc(F)cc(F)c1	ZINC000819176470	DC	On-Demand	Anodyne	SLC6A1	69	35
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1cc(F)cc(F)c1	ZINC000819176470	DC	On-Demand	Anodyne	CCR2	20	41
O=C(NCC(=O)N1CC[C@@H](C(=O)O)C1)c1cc(F)cc(F)c1	ZINC000819176470	DC	On-Demand	Anodyne	CACNA1I	50	33
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1cc(F)cc(F)c1	ZINC000819176471	DC	On-Demand	Anodyne	SLC6A1	69	35
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1cc(F)cc(F)c1	ZINC000819176471	DC	On-Demand	Anodyne	CCR2	20	41
O=C(NCC(=O)N1CC[C@H](C(=O)O)C1)c1cc(F)cc(F)c1	ZINC000819176471	DC	On-Demand	Anodyne	CACNA1I	50	33
O=C(NC1(C(=O)O)CCCCC1)c1ccc(=O)n(-c2cccc(F)c2)c1	ZINC000819176472	FE	On-Demand	Anodyne	NTSR2	23	46
O=C(NC1CCOCC1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819176474	FD	On-Demand	Anodyne	MTOR	45	38
O=C(NC1CCOCC1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819176474	FD	On-Demand	Anodyne	EPHX2	45	42
O=C(NC1CCOCC1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819176475	FD	On-Demand	Anodyne	MTOR	45	38
O=C(NC1CCOCC1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819176475	FD	On-Demand	Anodyne	EPHX2	45	42
O=C(NC1(C(=O)O)CCCCC1)c1ccc(CN2CCCC2)cc1	ZINC000819176479	EF	On-Demand	Anodyne	ACHE	19	48
O=C(NC1(C(=O)O)CCCCC1)c1ccc(CN2CCCC2)cc1	ZINC000819176479	EF	On-Demand	Anodyne	TACR2	46	37
O=C(NC1(C(=O)O)CCCCC1)c1ccc(CN2CCCC2)cc1	ZINC000819176479	EF	On-Demand	Anodyne	HRH3	28	48
O=C(NC1(C(=O)O)CCCCC1)c1ccc(CN2CCCC2)cc1	ZINC000819176479	EF	On-Demand	Anodyne	SIGMAR1	35	41
O=C(NC1(C(=O)O)CCCCC1)c1ccc(CN2CCCC2)cc1	ZINC000819176479	EF	On-Demand	Anodyne	CTSB	15	43
O=C(NC1(C(=O)O)CCCCC1)c1ccc(CN2CCCC2)cc1	ZINC000819176479	EF	On-Demand	Anodyne	CTSK	26	43
O=C(NC1(C(=O)O)CCCCC1)c1ccc(CN2CCCC2)cc1	ZINC000819176479	EF	On-Demand	Anodyne	BDKRB1	21	41
O=C(NC1(C(=O)O)CCCCC1)c1ccc(CN2CCCC2)cc1	ZINC000819176479	EF	On-Demand	Anodyne	HDAC6	23	40
O=C(NC1(C(=O)O)CCCCC1)c1ccc(CN2CCCC2)cc1	ZINC000819176479	EF	On-Demand	Anodyne	MCHR1	20	44
O=C(NC1(C(=O)O)CCCCC1)c1ccc(CN2CCCC2)cc1	ZINC000819176479	EF	On-Demand	Anodyne	NPFFR1	41	37
O=C(NC1(C(=O)O)CCCCC1)c1ccc(CN2CCCC2)cc1	ZINC000819176479	EF	On-Demand	Anodyne	NOD2	41	34
C[C@@H](CCc1ccc(O)cc1)NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819176483	FG	On-Demand	Anodyne	ADRB1	19	41
C[C@@H](CCc1ccc(O)cc1)NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819176483	FG	On-Demand	Anodyne	ADRB3	21	40
C[C@H](CCc1ccc(O)cc1)NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819176484	FG	On-Demand	Anodyne	ADRB1	19	41
C[C@H](CCc1ccc(O)cc1)NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819176484	FG	On-Demand	Anodyne	ADRB3	21	40
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819176489	GF	On-Demand	Anodyne	GPR119	49	50
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819176490	GF	On-Demand	Anodyne	GPR119	49	50
Oc1ccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819176491	EG	On-Demand	Anodyne	ADRB2	93	56
Oc1ccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819176491	EG	On-Demand	Anodyne	ADRB1	102	54
Oc1ccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819176491	EG	On-Demand	Anodyne	ADRB3	137	57
Oc1ccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819176491	EG	On-Demand	Anodyne	SLC6A5	15	49
Oc1ccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819176492	EG	On-Demand	Anodyne	ADRB2	93	56
Oc1ccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819176492	EG	On-Demand	Anodyne	ADRB1	102	54
Oc1ccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819176492	EG	On-Demand	Anodyne	ADRB3	137	57
Oc1ccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819176492	EG	On-Demand	Anodyne	SLC6A5	15	49
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cc(F)ccc1F	ZINC000819176509	DF	On-Demand	Anodyne	ADRB2	44	39
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cc(F)ccc1F	ZINC000819176509	DF	On-Demand	Anodyne	ADRB1	17	41
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cc(F)ccc1F	ZINC000819176511	DF	On-Demand	Anodyne	ADRB2	44	39
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cc(F)ccc1F	ZINC000819176511	DF	On-Demand	Anodyne	ADRB1	17	41
Oc1ccc(CCNC[C@H](O)c2ccc(Br)cc2)cc1	ZINC000819176519	EG	On-Demand	Anodyne	ADRB2	78	66
Oc1ccc(CCNC[C@H](O)c2ccc(Br)cc2)cc1	ZINC000819176519	EG	On-Demand	Anodyne	ADRB1	83	50
Oc1ccc(CCNC[C@H](O)c2ccc(Br)cc2)cc1	ZINC000819176519	EG	On-Demand	Anodyne	ADRB3	119	50
Oc1ccc(CCNC[C@@H](O)c2ccc(Br)cc2)cc1	ZINC000819176520	EG	On-Demand	Anodyne	ADRB2	78	66
Oc1ccc(CCNC[C@@H](O)c2ccc(Br)cc2)cc1	ZINC000819176520	EG	On-Demand	Anodyne	ADRB1	83	50
Oc1ccc(CCNC[C@@H](O)c2ccc(Br)cc2)cc1	ZINC000819176520	EG	On-Demand	Anodyne	ADRB3	119	50
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819176526	DG	On-Demand	Anodyne	ADRB2	68	49
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819176526	DG	On-Demand	Anodyne	ADRB1	56	63
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819176526	DG	On-Demand	Anodyne	ADRB3	79	63
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819176528	DG	On-Demand	Anodyne	ADRB2	68	49
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819176528	DG	On-Demand	Anodyne	ADRB1	56	63
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819176528	DG	On-Demand	Anodyne	ADRB3	79	63
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(F)cn1	ZINC000819176650	DF	On-Demand	Anodyne	ADRB2	18	61
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(F)cn1	ZINC000819176652	DF	On-Demand	Anodyne	ADRB2	18	61
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)cn1	ZINC000819176654	DF	On-Demand	Anodyne	ADRB2	18	61
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)cn1	ZINC000819176656	DF	On-Demand	Anodyne	ADRB2	18	61
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)cn1	ZINC000819176675	CE	On-Demand	Anodyne	ADRB2	19	55
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1ccc(F)cn1	ZINC000819176677	CE	On-Demand	Anodyne	ADRB2	19	55
O=[N+]([O-])c1cnn(CCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819176686	DD	On-Demand	Bother	ADRB1	37	45
O=[N+]([O-])c1cnn(CCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819176686	DD	On-Demand	Bother	ADRB3	64	45
O=[N+]([O-])c1cnn(CCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819176688	DD	On-Demand	Bother	ADRB1	37	45
O=[N+]([O-])c1cnn(CCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819176688	DD	On-Demand	Bother	ADRB3	64	45
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1ccc(O)cc1	ZINC000819176689	DD	On-Demand	Anodyne	ADRB2	50	51
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1ccc(O)cc1	ZINC000819176689	DD	On-Demand	Anodyne	ADRB1	71	51
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1ccc(O)cc1	ZINC000819176689	DD	On-Demand	Anodyne	ADRB3	70	51
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1ccc(O)cc1	ZINC000819176689	DD	On-Demand	Anodyne	PAPA1_CARPA	29	43
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1ccc(O)cc1	ZINC000819176691	DD	On-Demand	Anodyne	ADRB2	50	51
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1ccc(O)cc1	ZINC000819176691	DD	On-Demand	Anodyne	ADRB1	71	51
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1ccc(O)cc1	ZINC000819176691	DD	On-Demand	Anodyne	ADRB3	70	51
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1ccc(O)cc1	ZINC000819176691	DD	On-Demand	Anodyne	PAPA1_CARPA	29	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc(O)c2)cc1	ZINC000819176692	ED	On-Demand	Anodyne	ADRB2	118	47
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc(O)c2)cc1	ZINC000819176692	ED	On-Demand	Anodyne	ADRB1	101	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc(O)c2)cc1	ZINC000819176692	ED	On-Demand	Anodyne	ADRB3	182	47
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc(O)c2)cc1	ZINC000819176694	ED	On-Demand	Anodyne	ADRB2	118	47
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc(O)c2)cc1	ZINC000819176694	ED	On-Demand	Anodyne	ADRB1	101	43
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc(O)c2)cc1	ZINC000819176694	ED	On-Demand	Anodyne	ADRB3	182	47
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819176696	DG	On-Demand	Anodyne	ADRB2	63	51
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819176696	DG	On-Demand	Anodyne	ADRB1	25	46
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819176696	DG	On-Demand	Anodyne	ADRB3	42	44
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819176699	DG	On-Demand	Anodyne	ADRB2	63	51
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819176699	DG	On-Demand	Anodyne	ADRB1	25	46
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819176699	DG	On-Demand	Anodyne	ADRB3	42	44
O[C@H](CN[C@@H]1CCO[C@@]2(CCSC2)C1)c1cccnc1	ZINC000819176706	CD	On-Demand	Anodyne	ADRB3	67	44
O[C@H](CN[C@@H]1CCO[C@]2(CCSC2)C1)c1cccnc1	ZINC000819176709	CD	On-Demand	Anodyne	ADRB3	67	44
Oc1cccc(CCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819176710	CF	On-Demand	Anodyne	ADRB2	90	47
Oc1cccc(CCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819176710	CF	On-Demand	Anodyne	ADRB1	73	47
Oc1cccc(CCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819176710	CF	On-Demand	Anodyne	ADRB3	57	44
O[C@H](CN[C@H]1CCO[C@]2(CCSC2)C1)c1cccnc1	ZINC000819176711	CD	On-Demand	Anodyne	ADRB3	67	44
O[C@H](CN[C@H]1CCO[C@@]2(CCSC2)C1)c1cccnc1	ZINC000819176713	CD	On-Demand	Anodyne	ADRB3	67	44
CC(C)(C)OC(=O)CS(=O)(=O)CCNCc1ccc(O)c(F)c1	ZINC000819176714	ED	On-Demand	Anodyne	TRPV1	16	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC(F)(F)C1	ZINC000819176730	GH	On-Demand	Anodyne	CELA1	17	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC(F)(F)C1	ZINC000819176730	GH	On-Demand	Anodyne	CTSD	127	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC(F)(F)C1	ZINC000819176730	GH	On-Demand	Anodyne	PGC	65	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC(F)(F)C1	ZINC000819176730	GH	On-Demand	Anodyne	CMA1	31	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC(F)(F)C1	ZINC000819176730	GH	On-Demand	Anodyne	PAPA1_CARPA	28	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC(F)(F)C1	ZINC000819176730	GH	On-Demand	Anodyne	PGA	42	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC(F)(F)C1	ZINC000819176730	GH	On-Demand	Anodyne	BACE2	57	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC(F)(F)C1	ZINC000819176730	GH	On-Demand	Anodyne	TIMP3	41	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC(F)(F)C1	ZINC000819176730	GH	On-Demand	Anodyne	REN	118	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC(F)(F)C1	ZINC000819176730	GH	On-Demand	Anodyne	REN1	45	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC(F)(F)C1	ZINC000819176730	GH	On-Demand	Anodyne	BACE1	98	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC(F)(F)C1	ZINC000819176730	GH	On-Demand	Anodyne	FPR1	54	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC(F)(F)C1	ZINC000819176730	GH	On-Demand	Anodyne	PLM1_PLAFA	34	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC(F)(F)C1	ZINC000819176730	GH	On-Demand	Anodyne	PLM2_PLAFA	63	35
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC(F)(F)C1	ZINC000819176733	GH	On-Demand	Anodyne	CELA1	17	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC(F)(F)C1	ZINC000819176733	GH	On-Demand	Anodyne	CTSD	127	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC(F)(F)C1	ZINC000819176733	GH	On-Demand	Anodyne	PGC	65	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC(F)(F)C1	ZINC000819176733	GH	On-Demand	Anodyne	CMA1	31	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC(F)(F)C1	ZINC000819176733	GH	On-Demand	Anodyne	PAPA1_CARPA	28	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC(F)(F)C1	ZINC000819176733	GH	On-Demand	Anodyne	PGA	42	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC(F)(F)C1	ZINC000819176733	GH	On-Demand	Anodyne	BACE2	57	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC(F)(F)C1	ZINC000819176733	GH	On-Demand	Anodyne	TIMP3	41	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC(F)(F)C1	ZINC000819176733	GH	On-Demand	Anodyne	REN	118	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC(F)(F)C1	ZINC000819176733	GH	On-Demand	Anodyne	REN1	45	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC(F)(F)C1	ZINC000819176733	GH	On-Demand	Anodyne	BACE1	98	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC(F)(F)C1	ZINC000819176733	GH	On-Demand	Anodyne	FPR1	54	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC(F)(F)C1	ZINC000819176733	GH	On-Demand	Anodyne	PLM1_PLAFA	34	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC(F)(F)C1	ZINC000819176733	GH	On-Demand	Anodyne	PLM2_PLAFA	63	35
Oc1ccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819176739	EG	On-Demand	Anodyne	ADRB2	68	53
Oc1ccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819176739	EG	On-Demand	Anodyne	ADRB1	73	47
Oc1ccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819176739	EG	On-Demand	Anodyne	ADRB3	114	47
Oc1ccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819176739	EG	On-Demand	Anodyne	SLC6A5	20	47
Oc1ccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819176742	EG	On-Demand	Anodyne	ADRB2	68	53
Oc1ccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819176742	EG	On-Demand	Anodyne	ADRB1	73	47
Oc1ccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819176742	EG	On-Demand	Anodyne	ADRB3	114	47
Oc1ccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819176742	EG	On-Demand	Anodyne	SLC6A5	20	47
Oc1cccc(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819176748	CE	On-Demand	Anodyne	ADRB2	98	53
Oc1cccc(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819176748	CE	On-Demand	Anodyne	ADRB1	81	45
Oc1cccc(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819176748	CE	On-Demand	Anodyne	ADRB3	102	45
Oc1cccc(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819176750	CE	On-Demand	Anodyne	ADRB2	98	53
Oc1cccc(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819176750	CE	On-Demand	Anodyne	ADRB1	81	45
Oc1cccc(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819176750	CE	On-Demand	Anodyne	ADRB3	102	45
Oc1ccc(CCNC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819176751	CD	On-Demand	Anodyne	ADRB2	61	48
Oc1ccc(CCNC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819176751	CD	On-Demand	Anodyne	ADRB1	65	48
Oc1ccc(CCNC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819176751	CD	On-Demand	Anodyne	ADRB3	109	48
O=[N+]([O-])c1cnn(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819176752	CD	On-Demand	Bother	ADRB1	17	41
O=[N+]([O-])c1cnn(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819176752	CD	On-Demand	Bother	ADRB3	42	41
Oc1ccc(CCNC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819176753	CD	On-Demand	Anodyne	ADRB2	61	48
Oc1ccc(CCNC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819176753	CD	On-Demand	Anodyne	ADRB1	65	48
Oc1ccc(CCNC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819176753	CD	On-Demand	Anodyne	ADRB3	109	48
O=[N+]([O-])c1cnn(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819176754	CD	On-Demand	Bother	ADRB1	17	41
O=[N+]([O-])c1cnn(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819176754	CD	On-Demand	Bother	ADRB3	42	41
COc1cccc(OC)c1C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819176777	FI	On-Demand	Anodyne	CHRM2	28	45
COc1cccc(OC)c1C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819176777	FI	On-Demand	Anodyne	HTR1A	32	40
COc1cccc(OC)c1C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819176777	FI	On-Demand	Anodyne	DRD2	34	42
COc1cccc(OC)c1C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819176777	FI	On-Demand	Anodyne	FKBP1A	46	35
COc1cccc(OC)c1C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819176777	FI	On-Demand	Anodyne	DRD4	32	40
COc1cccc(OC)c1C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819176777	FI	On-Demand	Anodyne	ACHE	50	46
COc1cccc(OC)c1C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819176777	FI	On-Demand	Anodyne	HTR2A	19	43
COc1cccc(OC)c1C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819176777	FI	On-Demand	Anodyne	DRD3	22	42
COc1cccc(OC)c1C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819176777	FI	On-Demand	Anodyne	SLC18A2	67	45
COc1cccc(OC)c1C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819176777	FI	On-Demand	Anodyne	HTR4	19	42
COc1cccc(OC)c1C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819176777	FI	On-Demand	Anodyne	GRIN2B	74	50
COc1cccc(OC)c1C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819176777	FI	On-Demand	Anodyne	SIGMAR1	43	44
COc1cccc(OC)c1C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819176777	FI	On-Demand	Anodyne	CCR3	33	41
COc1cccc(OC)c1C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819176777	FI	On-Demand	Anodyne	CCR5	29	48
COc1cccc(OC)c1C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819176777	FI	On-Demand	Anodyne	MTNR1B	15	45
COc1cccc(OC)c1C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819176777	FI	On-Demand	Anodyne	HCRTR2	32	40
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819176783	EH	On-Demand	Anodyne	ADRB2	39	41
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819176783	EH	On-Demand	Anodyne	ADRB1	24	48
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819176783	EH	On-Demand	Anodyne	ADRB3	41	45
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819176788	EH	On-Demand	Anodyne	ADRB2	39	41
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819176788	EH	On-Demand	Anodyne	ADRB1	24	48
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819176788	EH	On-Demand	Anodyne	ADRB3	41	45
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(O)cc1	ZINC000819176795	CF	On-Demand	Anodyne	ADRB2	76	46
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(O)cc1	ZINC000819176795	CF	On-Demand	Anodyne	ADRB1	82	45
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(O)cc1	ZINC000819176795	CF	On-Demand	Anodyne	ADRB3	80	44
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cccc(F)c1	ZINC000819176802	CF	On-Demand	Anodyne	ADRB2	58	47
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cccc(F)c1	ZINC000819176802	CF	On-Demand	Anodyne	ADRB1	32	47
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cccc(F)c1	ZINC000819176802	CF	On-Demand	Anodyne	ADRB3	51	47
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cccc(F)c1	ZINC000819176805	CF	On-Demand	Anodyne	ADRB2	58	47
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cccc(F)c1	ZINC000819176805	CF	On-Demand	Anodyne	ADRB1	32	47
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cccc(F)c1	ZINC000819176805	CF	On-Demand	Anodyne	ADRB3	51	47
Oc1cccc(CCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819176849	EG	On-Demand	Anodyne	ADRB2	82	45
Oc1cccc(CCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819176849	EG	On-Demand	Anodyne	ADRB1	72	46
Oc1cccc(CCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819176849	EG	On-Demand	Anodyne	ADRB3	95	46
Oc1cccc(CCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819176850	EG	On-Demand	Anodyne	ADRB2	82	45
Oc1cccc(CCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819176850	EG	On-Demand	Anodyne	ADRB1	72	46
Oc1cccc(CCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819176850	EG	On-Demand	Anodyne	ADRB3	95	46
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819176856	EH	On-Demand	Anodyne	ADRB2	58	45
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819176856	EH	On-Demand	Anodyne	ADRB1	25	45
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819176856	EH	On-Demand	Anodyne	ADRB3	42	38
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819176859	EH	On-Demand	Anodyne	ADRB2	58	45
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819176859	EH	On-Demand	Anodyne	ADRB1	25	45
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819176859	EH	On-Demand	Anodyne	ADRB3	42	38
Cc1ccccc1[C@@H](O)CNCc1ccc(O)c(F)c1	ZINC000819176868	CF	On-Demand	Anodyne	ADRB2	48	38
Cc1ccccc1[C@@H](O)CNCc1ccc(O)c(F)c1	ZINC000819176868	CF	On-Demand	Anodyne	LEF	49	34
Oc1ccc(CCNC[C@H](O)c2ccccc2F)cc1	ZINC000819176869	CE	On-Demand	Anodyne	ADRB2	87	48
Oc1ccc(CCNC[C@H](O)c2ccccc2F)cc1	ZINC000819176869	CE	On-Demand	Anodyne	ADRB1	95	48
Oc1ccc(CCNC[C@H](O)c2ccccc2F)cc1	ZINC000819176869	CE	On-Demand	Anodyne	ADRB3	113	48
Oc1ccc(CCNC[C@H](O)c2ccccc2F)cc1	ZINC000819176869	CE	On-Demand	Anodyne	SLC6A5	26	43
Oc1ccc(CCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819176871	CE	On-Demand	Anodyne	ADRB2	87	48
Oc1ccc(CCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819176871	CE	On-Demand	Anodyne	ADRB1	95	48
Oc1ccc(CCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819176871	CE	On-Demand	Anodyne	ADRB3	113	48
Oc1ccc(CCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819176871	CE	On-Demand	Anodyne	SLC6A5	26	43
COc1ccc(OC)c([C@H](O)CNCCc2cccc(O)c2)c1	ZINC000819176884	DE	On-Demand	Anodyne	ADRB2	98	55
COc1ccc(OC)c([C@H](O)CNCCc2cccc(O)c2)c1	ZINC000819176884	DE	On-Demand	Anodyne	ADRB1	89	49
COc1ccc(OC)c([C@H](O)CNCCc2cccc(O)c2)c1	ZINC000819176884	DE	On-Demand	Anodyne	ADRB3	71	49
COc1ccc(OC)c([C@H](O)CNCCc2cccc(O)c2)c1	ZINC000819176884	DE	On-Demand	Anodyne	MTNR1A	25	43
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819176885	EH	On-Demand	Anodyne	ADRB2	24	60
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819176885	EH	On-Demand	Anodyne	ADRB1	18	48
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819176885	EH	On-Demand	Anodyne	ADRB3	16	48
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819176888	EH	On-Demand	Anodyne	ADRB2	24	60
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819176888	EH	On-Demand	Anodyne	ADRB1	18	48
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819176888	EH	On-Demand	Anodyne	ADRB3	16	48
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(F)cc1Cl	ZINC000819176889	EH	On-Demand	Anodyne	ADRB2	24	60
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(F)cc1Cl	ZINC000819176889	EH	On-Demand	Anodyne	ADRB1	18	48
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(F)cc1Cl	ZINC000819176889	EH	On-Demand	Anodyne	ADRB3	16	48
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(F)cc1Cl	ZINC000819176891	EH	On-Demand	Anodyne	ADRB2	24	60
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(F)cc1Cl	ZINC000819176891	EH	On-Demand	Anodyne	ADRB1	18	48
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(F)cc1Cl	ZINC000819176891	EH	On-Demand	Anodyne	ADRB3	16	48
Oc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819176895	CF	On-Demand	Anodyne	ADRB2	85	60
Oc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819176895	CF	On-Demand	Anodyne	ADRB1	95	52
Oc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819176895	CF	On-Demand	Anodyne	ADRB3	131	52
Oc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819176895	CF	On-Demand	Anodyne	SLC6A5	21	44
Oc1cccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819176899	EG	On-Demand	Anodyne	ADRB2	95	47
Oc1cccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819176899	EG	On-Demand	Anodyne	ADRB1	93	46
Oc1cccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819176899	EG	On-Demand	Anodyne	ADRB3	100	50
Oc1cccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819176901	EG	On-Demand	Anodyne	ADRB2	95	47
Oc1cccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819176901	EG	On-Demand	Anodyne	ADRB1	93	46
Oc1cccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819176901	EG	On-Demand	Anodyne	ADRB3	100	50
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819176907	GF	On-Demand	Anodyne	GPR119	45	53
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819176909	GF	On-Demand	Anodyne	GPR119	45	53
CS(=O)(=O)c1ccc([C@@H](O)CNCCn2cc([N+](=O)[O-])cn2)cc1	ZINC000819176914	FC	On-Demand	Bother	ADRB3	40	35
CS(=O)(=O)c1ccc([C@H](O)CNCCn2cc([N+](=O)[O-])cn2)cc1	ZINC000819176915	FC	On-Demand	Bother	ADRB3	40	35
Oc1cccc(CCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819176921	EG	On-Demand	Anodyne	ADRB2	88	47
Oc1cccc(CCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819176921	EG	On-Demand	Anodyne	ADRB1	73	47
Oc1cccc(CCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819176921	EG	On-Demand	Anodyne	ADRB3	85	47
Oc1cccc(CCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819176922	EG	On-Demand	Anodyne	ADRB2	88	47
Oc1cccc(CCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819176922	EG	On-Demand	Anodyne	ADRB1	73	47
Oc1cccc(CCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819176922	EG	On-Demand	Anodyne	ADRB3	85	47
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819176930	DF	On-Demand	Bother	ADRB2	57	46
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819176930	DF	On-Demand	Bother	ADRB1	25	44
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819176930	DF	On-Demand	Bother	ADRB3	48	42
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819176933	DF	On-Demand	Bother	ADRB2	57	46
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819176933	DF	On-Demand	Bother	ADRB1	25	44
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819176933	DF	On-Demand	Bother	ADRB3	48	42
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176945	DF	On-Demand	Bother	ADRB2	50	42
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176945	DF	On-Demand	Bother	ADRB1	38	51
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176945	DF	On-Demand	Bother	ADRB3	76	51
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176948	DF	On-Demand	Bother	ADRB2	50	42
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176948	DF	On-Demand	Bother	ADRB1	38	51
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819176948	DF	On-Demand	Bother	ADRB3	76	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2ccc(O)cc2)CC1	ZINC000819176949	FF	On-Demand	Anodyne	ADRB2	20	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2ccc(O)cc2)CC1	ZINC000819176949	FF	On-Demand	Anodyne	ADRB1	45	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2ccc(O)cc2)CC1	ZINC000819176949	FF	On-Demand	Anodyne	ADRB3	51	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2ccc(O)cc2)CC1	ZINC000819176949	FF	On-Demand	Anodyne	GPR119	50	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2ccc(O)cc2)CC1	ZINC000819176951	FF	On-Demand	Anodyne	ADRB2	20	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2ccc(O)cc2)CC1	ZINC000819176951	FF	On-Demand	Anodyne	ADRB1	45	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2ccc(O)cc2)CC1	ZINC000819176951	FF	On-Demand	Anodyne	ADRB3	51	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2ccc(O)cc2)CC1	ZINC000819176951	FF	On-Demand	Anodyne	GPR119	50	48
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1ccc(O)c(F)c1	ZINC000819176953	ED	On-Demand	Anodyne	LEF	53	35
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1ccc(O)c(F)c1	ZINC000819176954	ED	On-Demand	Anodyne	LEF	53	35
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819176966	EE	On-Demand	Anodyne	ADRB2	72	49
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819176966	EE	On-Demand	Anodyne	ADRB1	36	45
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819176966	EE	On-Demand	Anodyne	ADRB3	62	45
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819176968	EE	On-Demand	Anodyne	ADRB2	72	49
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819176968	EE	On-Demand	Anodyne	ADRB1	36	45
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819176968	EE	On-Demand	Anodyne	ADRB3	62	45
CON(C)C(=O)CCN[C@H](C)Cc1ccc(O)cc1	ZINC000819176975	CD	On-Demand	Anodyne	GRIA1	46	33
CON(C)C(=O)CCN[C@@H](C)Cc1ccc(O)cc1	ZINC000819176976	CD	On-Demand	Anodyne	GRIA1	46	33
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819176978	EE	On-Demand	Anodyne	ADRB2	26	53
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819176978	EE	On-Demand	Anodyne	ADRB1	20	53
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819176978	EE	On-Demand	Anodyne	PAPA1_CARPA	29	47
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819176978	EE	On-Demand	Anodyne	GRIA1	42	34
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819176983	EE	On-Demand	Anodyne	ADRB2	26	53
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819176983	EE	On-Demand	Anodyne	ADRB1	20	53
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819176983	EE	On-Demand	Anodyne	PAPA1_CARPA	29	47
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819176983	EE	On-Demand	Anodyne	GRIA1	42	34
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819176985	FH	On-Demand	Anodyne	ADRB2	43	86
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819176985	FH	On-Demand	Anodyne	ADRB1	21	54
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819176987	FH	On-Demand	Anodyne	ADRB2	43	86
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819176987	FH	On-Demand	Anodyne	ADRB1	21	54
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819176988	FH	On-Demand	Anodyne	ADRB2	43	86
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819176988	FH	On-Demand	Anodyne	ADRB1	21	54
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819176990	FH	On-Demand	Anodyne	ADRB2	43	86
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819176990	FH	On-Demand	Anodyne	ADRB1	21	54
Oc1ccc(CCNC[C@@H](O)C2CC2)cc1	ZINC000819176992	BD	On-Demand	Anodyne	ADRB2	41	52
Oc1ccc(CCNC[C@@H](O)C2CC2)cc1	ZINC000819176992	BD	On-Demand	Anodyne	ADRB1	53	52
Oc1ccc(CCNC[C@@H](O)C2CC2)cc1	ZINC000819176992	BD	On-Demand	Anodyne	ADRB3	59	52
Oc1ccc(CCNC[C@H](O)C2CC2)cc1	ZINC000819176993	BD	On-Demand	Anodyne	ADRB2	41	52
Oc1ccc(CCNC[C@H](O)C2CC2)cc1	ZINC000819176993	BD	On-Demand	Anodyne	ADRB1	53	52
Oc1ccc(CCNC[C@H](O)C2CC2)cc1	ZINC000819176993	BD	On-Demand	Anodyne	ADRB3	59	52
Oc1cccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819176995	DG	On-Demand	Anodyne	ADRB2	82	44
Oc1cccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819176995	DG	On-Demand	Anodyne	ADRB1	63	49
Oc1cccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819176995	DG	On-Demand	Anodyne	ADRB3	77	49
Oc1cccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819176996	DG	On-Demand	Anodyne	ADRB2	82	44
Oc1cccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819176996	DG	On-Demand	Anodyne	ADRB1	63	49
Oc1cccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819176996	DG	On-Demand	Anodyne	ADRB3	77	49
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1cccc(O)c1	ZINC000819177020	FG	On-Demand	Anodyne	GPR119	48	50
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1cccc(O)c1	ZINC000819177022	FG	On-Demand	Anodyne	GPR119	48	50
Oc1cccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819177024	EG	On-Demand	Anodyne	ADRB2	74	40
Oc1cccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819177024	EG	On-Demand	Anodyne	ADRB1	61	40
Oc1cccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819177024	EG	On-Demand	Anodyne	ADRB3	50	41
Oc1cccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819177051	EG	On-Demand	Anodyne	ADRB2	74	40
Oc1cccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819177051	EG	On-Demand	Anodyne	ADRB1	61	40
Oc1cccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819177051	EG	On-Demand	Anodyne	ADRB3	50	41
COc1ccc(OC)c([C@H](O)CNCCc2ccc(O)cc2)c1	ZINC000819177058	DE	On-Demand	Anodyne	ADRB2	95	66
COc1ccc(OC)c([C@H](O)CNCCc2ccc(O)cc2)c1	ZINC000819177058	DE	On-Demand	Anodyne	ADRB1	103	51
COc1ccc(OC)c([C@H](O)CNCCc2ccc(O)cc2)c1	ZINC000819177058	DE	On-Demand	Anodyne	ADRB3	94	58
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819177061	FG	On-Demand	Anodyne	ADRB2	60	48
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819177061	FG	On-Demand	Anodyne	ADRB1	28	45
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819177061	FG	On-Demand	Anodyne	ADRB3	43	40
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819177065	FG	On-Demand	Anodyne	ADRB2	60	48
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819177065	FG	On-Demand	Anodyne	ADRB1	28	45
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819177065	FG	On-Demand	Anodyne	ADRB3	43	40
Oc1ccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819177106	EG	On-Demand	Anodyne	ADRB2	82	48
Oc1ccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819177106	EG	On-Demand	Anodyne	ADRB1	92	45
Oc1ccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819177106	EG	On-Demand	Anodyne	ADRB3	116	45
Oc1ccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819177106	EG	On-Demand	Anodyne	SLC6A5	24	43
Oc1ccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819177108	EG	On-Demand	Anodyne	ADRB2	82	48
Oc1ccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819177108	EG	On-Demand	Anodyne	ADRB1	92	45
Oc1ccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819177108	EG	On-Demand	Anodyne	ADRB3	116	45
Oc1ccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819177108	EG	On-Demand	Anodyne	SLC6A5	24	43
O[C@H](CN[C@@H]1CCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819177124	CH	On-Demand	Anodyne	ADRB1	33	46
O[C@H](CN[C@@H]1CCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819177124	CH	On-Demand	Anodyne	ADRB3	50	52
O[C@@H](CN[C@@H]1CCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819177125	CH	On-Demand	Anodyne	ADRB1	33	46
O[C@@H](CN[C@@H]1CCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819177125	CH	On-Demand	Anodyne	ADRB3	50	52
O[C@H](CN[C@H]1CCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819177128	CH	On-Demand	Anodyne	ADRB1	33	46
O[C@H](CN[C@H]1CCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819177128	CH	On-Demand	Anodyne	ADRB3	50	52
O[C@@H](CN[C@H]1CCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819177131	CH	On-Demand	Anodyne	ADRB1	33	46
O[C@@H](CN[C@H]1CCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819177131	CH	On-Demand	Anodyne	ADRB3	50	52
Oc1ccc(CCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819177133	CF	On-Demand	Anodyne	ADRB2	73	49
Oc1ccc(CCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819177133	CF	On-Demand	Anodyne	ADRB1	81	49
Oc1ccc(CCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819177133	CF	On-Demand	Anodyne	ADRB3	104	49
Oc1ccc(CCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819177136	CF	On-Demand	Anodyne	ADRB2	73	49
Oc1ccc(CCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819177136	CF	On-Demand	Anodyne	ADRB1	81	49
Oc1ccc(CCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819177136	CF	On-Demand	Anodyne	ADRB3	104	49
C[C@@H](Cc1ccc(O)cc1)NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819177205	EG	On-Demand	Anodyne	MME	15	42
C[C@@H](Cc1ccc(O)cc1)NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819177205	EG	On-Demand	Anodyne	GRIA1	42	33
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccc(O)cc2)cc1	ZINC000819177210	DE	On-Demand	Bother	ADRB2	75	51
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccc(O)cc2)cc1	ZINC000819177210	DE	On-Demand	Bother	ADRB1	82	46
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccc(O)cc2)cc1	ZINC000819177210	DE	On-Demand	Bother	ADRB3	140	46
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccc(O)cc2)cc1	ZINC000819177212	DE	On-Demand	Bother	ADRB2	75	51
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccc(O)cc2)cc1	ZINC000819177212	DE	On-Demand	Bother	ADRB1	82	46
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccc(O)cc2)cc1	ZINC000819177212	DE	On-Demand	Bother	ADRB3	140	46
Oc1cccc(CCNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819177214	EH	On-Demand	Anodyne	ADRB2	84	46
Oc1cccc(CCNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819177214	EH	On-Demand	Anodyne	ADRB1	67	47
Oc1cccc(CCNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819177214	EH	On-Demand	Anodyne	ADRB3	48	47
Oc1cccc(CCNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819177217	EH	On-Demand	Anodyne	ADRB2	84	46
Oc1cccc(CCNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819177217	EH	On-Demand	Anodyne	ADRB1	67	47
Oc1cccc(CCNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819177217	EH	On-Demand	Anodyne	ADRB3	48	47
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cccc(O)c2)c1	ZINC000819177224	DE	On-Demand	Bother	ADRB2	75	44
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cccc(O)c2)c1	ZINC000819177224	DE	On-Demand	Bother	ADRB1	74	47
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cccc(O)c2)c1	ZINC000819177224	DE	On-Demand	Bother	ADRB3	109	47
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cccc(O)c2)c1	ZINC000819177224	DE	On-Demand	Bother	CACNA1D	41	35
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cccc(O)c2)c1	ZINC000819177226	DE	On-Demand	Bother	ADRB2	75	44
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cccc(O)c2)c1	ZINC000819177226	DE	On-Demand	Bother	ADRB1	74	47
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cccc(O)c2)c1	ZINC000819177226	DE	On-Demand	Bother	ADRB3	109	47
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cccc(O)c2)c1	ZINC000819177226	DE	On-Demand	Bother	CACNA1D	41	35
Oc1cccc(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819177273	CE	On-Demand	Anodyne	ADRB2	88	47
Oc1cccc(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819177273	CE	On-Demand	Anodyne	ADRB1	70	47
Oc1cccc(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819177273	CE	On-Demand	Anodyne	ADRB3	57	43
Oc1cccc(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819177273	CE	On-Demand	Anodyne	SLC6A5	20	46
O[C@@H](CNCc1ccn(C2CCCC2)n1)c1ccc(F)cc1Cl	ZINC000819177274	EH	On-Demand	Anodyne	P2RX7	15	40
Oc1cccc(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819177276	CE	On-Demand	Anodyne	ADRB2	88	47
Oc1cccc(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819177276	CE	On-Demand	Anodyne	ADRB1	70	47
Oc1cccc(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819177276	CE	On-Demand	Anodyne	ADRB3	57	43
Oc1cccc(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819177276	CE	On-Demand	Anodyne	SLC6A5	20	46
O[C@H](CNCc1ccn(C2CCCC2)n1)c1ccc(F)cc1Cl	ZINC000819177277	EH	On-Demand	Anodyne	P2RX7	15	40
C[C@@H](Cc1cccc(O)c1)NCCS(C)(=O)=O	ZINC000819177278	CC	On-Demand	Anodyne	HSD17B2	19	40
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819177295	EH	On-Demand	Anodyne	ADRB2	45	40
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819177295	EH	On-Demand	Anodyne	ADRB1	22	42
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819177295	EH	On-Demand	Anodyne	ADRB3	41	38
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819177299	EH	On-Demand	Anodyne	ADRB2	45	40
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819177299	EH	On-Demand	Anodyne	ADRB1	22	42
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819177299	EH	On-Demand	Anodyne	ADRB3	41	38
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCn2cc([N+](=O)[O-])cn2)c1	ZINC000819177413	FC	On-Demand	Bother	ADRB2	36	51
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCn2cc([N+](=O)[O-])cn2)c1	ZINC000819177413	FC	On-Demand	Bother	ADRB1	62	51
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCn2cc([N+](=O)[O-])cn2)c1	ZINC000819177413	FC	On-Demand	Bother	ADRB3	38	51
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCn2cc([N+](=O)[O-])cn2)c1	ZINC000819177414	FC	On-Demand	Bother	ADRB2	36	51
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCn2cc([N+](=O)[O-])cn2)c1	ZINC000819177414	FC	On-Demand	Bother	ADRB1	62	51
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCn2cc([N+](=O)[O-])cn2)c1	ZINC000819177414	FC	On-Demand	Bother	ADRB3	38	51
O[C@@H](CNCc1ccn(C2CCCC2)n1)c1cccnc1	ZINC000819177427	CE	On-Demand	Anodyne	ADRB1	22	44
O[C@@H](CNCc1ccn(C2CCCC2)n1)c1cccnc1	ZINC000819177427	CE	On-Demand	Anodyne	ADRB3	92	45
O[C@H](CNCc1ccn(C2CCCC2)n1)c1cccnc1	ZINC000819177428	CE	On-Demand	Anodyne	ADRB1	22	44
O[C@H](CNCc1ccn(C2CCCC2)n1)c1cccnc1	ZINC000819177428	CE	On-Demand	Anodyne	ADRB3	92	45
O[C@@H](CNCc1ccn(C2CCCC2)n1)c1ccccc1Cl	ZINC000819177437	DG	On-Demand	Anodyne	OPRL1	44	39
C[C@H](NC[C@H](O)c1cccnc1)[C@H]1CN(C)CCO1	ZINC000819177447	CC	On-Demand	Anodyne	ADRB1	18	44
C[C@H](NC[C@H](O)c1cccnc1)[C@H]1CN(C)CCO1	ZINC000819177447	CC	On-Demand	Anodyne	ADRB3	63	44
C[C@H](NC[C@H](O)c1cccnc1)[C@@H]1CN(C)CCO1	ZINC000819177456	CC	On-Demand	Anodyne	ADRB1	18	44
C[C@H](NC[C@H](O)c1cccnc1)[C@@H]1CN(C)CCO1	ZINC000819177456	CC	On-Demand	Anodyne	ADRB3	63	44
CON(C)C(=O)CCNCc1ccc(O)c(F)c1	ZINC000819177466	CD	On-Demand	Anodyne	LEF	54	34
Oc1ccc(CCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819177475	CF	On-Demand	Anodyne	ADRB2	88	49
Oc1ccc(CCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819177475	CF	On-Demand	Anodyne	ADRB1	101	48
Oc1ccc(CCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819177475	CF	On-Demand	Anodyne	ADRB3	109	48
Oc1ccc(CCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819177475	CF	On-Demand	Anodyne	SLC6A5	25	43
Oc1cccc(CCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819177502	CF	On-Demand	Anodyne	ADRB2	61	42
Oc1cccc(CCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819177502	CF	On-Demand	Anodyne	ADRB1	51	42
Oc1cccc(CCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819177502	CF	On-Demand	Anodyne	ADRB3	45	42
Oc1cccc(CCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819177503	CF	On-Demand	Anodyne	ADRB2	61	42
Oc1cccc(CCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819177503	CF	On-Demand	Anodyne	ADRB1	51	42
Oc1cccc(CCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819177503	CF	On-Demand	Anodyne	ADRB3	45	42
Oc1cccc(CCNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819177513	DG	On-Demand	Anodyne	ADRB2	75	43
Oc1cccc(CCNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819177513	DG	On-Demand	Anodyne	ADRB1	55	43
Oc1cccc(CCNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819177513	DG	On-Demand	Anodyne	ADRB3	35	42
Oc1cccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819177515	DG	On-Demand	Anodyne	ADRB2	75	43
Oc1cccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819177515	DG	On-Demand	Anodyne	ADRB1	55	43
Oc1cccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819177515	DG	On-Demand	Anodyne	ADRB3	35	42
Oc1ccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819177518	EG	On-Demand	Anodyne	ADRB2	93	51
Oc1ccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819177518	EG	On-Demand	Anodyne	ADRB1	97	50
Oc1ccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819177518	EG	On-Demand	Anodyne	ADRB3	153	50
Oc1ccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819177518	EG	On-Demand	Anodyne	SLC6A5	21	42
Oc1ccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819177520	EG	On-Demand	Anodyne	ADRB2	93	51
Oc1ccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819177520	EG	On-Demand	Anodyne	ADRB1	97	50
Oc1ccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819177520	EG	On-Demand	Anodyne	ADRB3	153	50
Oc1ccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819177520	EG	On-Demand	Anodyne	SLC6A5	21	42
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819177522	DG	On-Demand	Anodyne	ADRB2	61	48
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819177522	DG	On-Demand	Anodyne	ADRB1	34	50
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819177522	DG	On-Demand	Anodyne	ADRB3	55	50
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1ccc(O)cc1	ZINC000819177524	DD	On-Demand	Anodyne	PAPA1_CARPA	29	44
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1ccc(O)cc1	ZINC000819177524	DD	On-Demand	Anodyne	GRIA1	40	33
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1ccc(O)cc1	ZINC000819177526	DD	On-Demand	Anodyne	PAPA1_CARPA	29	44
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1ccc(O)cc1	ZINC000819177526	DD	On-Demand	Anodyne	GRIA1	40	33
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccccc1F	ZINC000819177541	CF	On-Demand	Anodyne	ADRB2	49	42
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccccc1F	ZINC000819177541	CF	On-Demand	Anodyne	ADRB1	20	40
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccccc1F	ZINC000819177541	CF	On-Demand	Anodyne	ADRB3	40	38
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccccc1F	ZINC000819177544	CF	On-Demand	Anodyne	ADRB2	49	42
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccccc1F	ZINC000819177544	CF	On-Demand	Anodyne	ADRB1	20	40
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccccc1F	ZINC000819177544	CF	On-Demand	Anodyne	ADRB3	40	38
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(O)c(F)c2)CC1	ZINC000819177553	FF	On-Demand	Anodyne	GPR119	55	54
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(O)c(F)c2)CC1	ZINC000819177554	FF	On-Demand	Anodyne	GPR119	55	54
Oc1cccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819177555	EG	On-Demand	Anodyne	ADRB2	73	44
Oc1cccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819177555	EG	On-Demand	Anodyne	ADRB1	64	44
Oc1cccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819177555	EG	On-Demand	Anodyne	ADRB3	89	45
CCn1nc(C)c(CN2C(=O)NC3(CCN(Cc4ccccc4)CC3)C2=O)n1	ZINC000819177556	GD	On-Demand	Anodyne	SIGMAR1	40	41
Oc1cccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819177557	EG	On-Demand	Anodyne	ADRB2	73	44
Oc1cccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819177557	EG	On-Demand	Anodyne	ADRB1	64	44
Oc1cccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819177557	EG	On-Demand	Anodyne	ADRB3	89	45
Oc1ccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1F	ZINC000819177560	EG	On-Demand	Anodyne	ADRB2	46	42
Oc1ccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1F	ZINC000819177560	EG	On-Demand	Anodyne	GRIN2B	15	46
Oc1ccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1F	ZINC000819177560	EG	On-Demand	Anodyne	ADRB3	21	42
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819177563	FH	On-Demand	Anodyne	ADRB2	49	39
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819177563	FH	On-Demand	Anodyne	ADRB1	20	46
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819177563	FH	On-Demand	Anodyne	ADRB3	43	44
Oc1ccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1F	ZINC000819177565	EG	On-Demand	Anodyne	ADRB2	46	42
Oc1ccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1F	ZINC000819177565	EG	On-Demand	Anodyne	GRIN2B	15	46
Oc1ccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1F	ZINC000819177565	EG	On-Demand	Anodyne	ADRB3	21	42
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819177567	FH	On-Demand	Anodyne	ADRB2	49	39
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819177567	FH	On-Demand	Anodyne	ADRB1	20	46
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819177567	FH	On-Demand	Anodyne	ADRB3	43	44
O=Cc1ccccc1OCC(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819177570	FH	On-Demand	Anodyne	SLC18A2	41	37
O=Cc1ccccc1OCC(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819177570	FH	On-Demand	Anodyne	GRIN2B	38	45
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1cccc(O)c1	ZINC000819177596	DD	On-Demand	Anodyne	ADRB2	42	38
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1cccc(O)c1	ZINC000819177596	DD	On-Demand	Anodyne	ADRB1	63	39
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1cccc(O)c1	ZINC000819177596	DD	On-Demand	Anodyne	ADRB3	49	39
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1cccc(O)c1	ZINC000819177598	DD	On-Demand	Anodyne	ADRB2	42	38
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1cccc(O)c1	ZINC000819177598	DD	On-Demand	Anodyne	ADRB1	63	39
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1cccc(O)c1	ZINC000819177598	DD	On-Demand	Anodyne	ADRB3	49	39
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cccnc1	ZINC000819177599	CE	On-Demand	Anodyne	ADRB2	55	51
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cccnc1	ZINC000819177599	CE	On-Demand	Anodyne	ADRB1	41	61
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cccnc1	ZINC000819177599	CE	On-Demand	Anodyne	ADRB3	103	61
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cccnc1	ZINC000819177601	CE	On-Demand	Anodyne	ADRB2	55	51
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cccnc1	ZINC000819177601	CE	On-Demand	Anodyne	ADRB1	41	61
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cccnc1	ZINC000819177601	CE	On-Demand	Anodyne	ADRB3	103	61
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1c(F)cccc1F	ZINC000819177610	DF	On-Demand	Anodyne	ADRB2	45	41
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1c(F)cccc1F	ZINC000819177612	DF	On-Demand	Anodyne	ADRB2	45	41
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(O)c(F)c2)cc1	ZINC000819177628	ED	On-Demand	Anodyne	ADRB2	55	47
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(O)c(F)c2)cc1	ZINC000819177628	ED	On-Demand	Anodyne	ADRB3	59	44
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(O)c(F)c2)cc1	ZINC000819177630	ED	On-Demand	Anodyne	ADRB2	55	47
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(O)c(F)c2)cc1	ZINC000819177630	ED	On-Demand	Anodyne	ADRB3	59	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc3c(c2)COC3)CC1	ZINC000819177661	GF	On-Demand	Anodyne	GPR119	45	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc3c(c2)COC3)CC1	ZINC000819177662	GF	On-Demand	Anodyne	GPR119	45	46
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)[C@H]1CN(C)CCO1	ZINC000819177675	FD	On-Demand	Anodyne	GPR119	26	41
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)[C@@H]1CN(C)CCO1	ZINC000819177678	FD	On-Demand	Anodyne	GPR119	26	41
O[C@@H](CN[C@H]1CCO[C@]2(CCSC2)C1)c1ccc(Cl)cc1	ZINC000819177797	EG	On-Demand	Anodyne	ADRB3	17	41
O[C@@H](CN[C@H]1CCO[C@@]2(CCSC2)C1)c1ccc(Cl)cc1	ZINC000819177798	EG	On-Demand	Anodyne	ADRB3	17	41
O[C@@H](CN[C@@H]1CCO[C@]2(CCSC2)C1)c1ccc(Cl)cc1	ZINC000819177799	EG	On-Demand	Anodyne	ADRB3	17	41
O[C@@H](CN[C@@H]1CCO[C@@]2(CCSC2)C1)c1ccc(Cl)cc1	ZINC000819177800	EG	On-Demand	Anodyne	ADRB3	17	41
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@@H]1CN(C)CCO1	ZINC000819177901	CD	On-Demand	Anodyne	ADRB1	28	44
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@@H]1CN(C)CCO1	ZINC000819177901	CD	On-Demand	Anodyne	ADRB3	43	44
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@@H]1CN(C)CCO1	ZINC000819177901	CD	On-Demand	Anodyne	IGF1R	28	40
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@@H]1CN(C)CCO1	ZINC000819177901	CD	On-Demand	Anodyne	CYP3A4	47	37
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@H]1CN(C)CCO1	ZINC000819177904	CD	On-Demand	Anodyne	ADRB1	28	44
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@H]1CN(C)CCO1	ZINC000819177904	CD	On-Demand	Anodyne	ADRB3	43	44
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@H]1CN(C)CCO1	ZINC000819177904	CD	On-Demand	Anodyne	IGF1R	28	40
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@H]1CN(C)CCO1	ZINC000819177904	CD	On-Demand	Anodyne	CYP3A4	47	37
O[C@@H](CNCc1ccc2c(c1)COC2)c1ccccc1	ZINC000819178081	CF	On-Demand	Anodyne	ADRB2	15	43
O[C@H](CNCc1ccc2c(c1)COC2)c1ccccc1	ZINC000819178082	CF	On-Demand	Anodyne	ADRB2	15	43
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2nc(-c3ccccc3)no2)CC1	ZINC000819178114	FE	On-Demand	Anodyne	ETHR	22	40
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2nc(-c3ccccc3)no2)CC1	ZINC000819178115	FE	On-Demand	Anodyne	ETHR	22	40
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2nc(-c3ccccc3)no2)CC1	ZINC000819178116	FE	On-Demand	Anodyne	ETHR	22	40
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2nc(-c3ccccc3)no2)CC1	ZINC000819178117	FE	On-Demand	Anodyne	ETHR	22	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccn(C3CCCC3)n2)CC1	ZINC000819178131	GG	On-Demand	Anodyne	GPR119	51	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccn(C3CCCC3)n2)CC1	ZINC000819178132	GG	On-Demand	Anodyne	GPR119	51	44
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819178197	GG	On-Demand	Anodyne	ADRB1	18	44
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819178197	GG	On-Demand	Anodyne	GPR119	48	49
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819178198	GG	On-Demand	Anodyne	ADRB1	18	44
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819178198	GG	On-Demand	Anodyne	GPR119	48	49
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819178199	GG	On-Demand	Anodyne	ADRB1	18	44
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819178199	GG	On-Demand	Anodyne	GPR119	48	49
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819178200	GG	On-Demand	Anodyne	ADRB1	18	44
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819178200	GG	On-Demand	Anodyne	GPR119	48	49
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819178203	DF	On-Demand	Anodyne	ADRB2	64	48
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819178203	DF	On-Demand	Anodyne	ADRB1	28	46
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819178203	DF	On-Demand	Anodyne	ADRB3	43	46
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819178205	DF	On-Demand	Anodyne	ADRB2	64	48
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819178205	DF	On-Demand	Anodyne	ADRB1	28	46
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819178205	DF	On-Demand	Anodyne	ADRB3	43	46
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cccc(Br)c1	ZINC000819178218	FG	On-Demand	Anodyne	ADRB2	57	47
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cccc(Br)c1	ZINC000819178218	FG	On-Demand	Anodyne	ADRB1	31	47
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cccc(Br)c1	ZINC000819178218	FG	On-Demand	Anodyne	ADRB3	51	47
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cccc(Br)c1	ZINC000819178220	FG	On-Demand	Anodyne	ADRB2	57	47
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cccc(Br)c1	ZINC000819178220	FG	On-Demand	Anodyne	ADRB1	31	47
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cccc(Br)c1	ZINC000819178220	FG	On-Demand	Anodyne	ADRB3	51	47
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1cc2ccccc2o1	ZINC000819178221	EH	On-Demand	Anodyne	ADRB2	25	60
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1cc2ccccc2o1	ZINC000819178222	EH	On-Demand	Anodyne	ADRB2	25	60
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(O)cc2)c1	ZINC000819178225	DE	On-Demand	Bother	ADRB2	96	49
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(O)cc2)c1	ZINC000819178225	DE	On-Demand	Bother	ADRB1	109	48
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(O)cc2)c1	ZINC000819178225	DE	On-Demand	Bother	ADRB3	172	48
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(O)cc2)c1	ZINC000819178225	DE	On-Demand	Bother	CACNA1D	54	33
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(O)cc2)c1	ZINC000819178226	DE	On-Demand	Bother	ADRB2	96	49
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(O)cc2)c1	ZINC000819178226	DE	On-Demand	Bother	ADRB1	109	48
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(O)cc2)c1	ZINC000819178226	DE	On-Demand	Bother	ADRB3	172	48
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(O)cc2)c1	ZINC000819178226	DE	On-Demand	Bother	CACNA1D	54	33
Cc1ccccc1[C@@H](O)CN[C@H](C)Cc1cccc(O)c1	ZINC000819178229	CF	On-Demand	Anodyne	ADRB2	50	45
Cc1ccccc1[C@@H](O)CN[C@H](C)Cc1cccc(O)c1	ZINC000819178229	CF	On-Demand	Anodyne	ADRB1	23	41
Cc1ccccc1[C@@H](O)CN[C@H](C)Cc1cccc(O)c1	ZINC000819178229	CF	On-Demand	Anodyne	ADRB3	41	38
Cc1ccccc1[C@@H](O)CN[C@@H](C)Cc1cccc(O)c1	ZINC000819178230	CF	On-Demand	Anodyne	ADRB2	50	45
Cc1ccccc1[C@@H](O)CN[C@@H](C)Cc1cccc(O)c1	ZINC000819178230	CF	On-Demand	Anodyne	ADRB1	23	41
Cc1ccccc1[C@@H](O)CN[C@@H](C)Cc1cccc(O)c1	ZINC000819178230	CF	On-Demand	Anodyne	ADRB3	41	38
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819178237	FH	On-Demand	Anodyne	ADRB2	64	45
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819178237	FH	On-Demand	Anodyne	ADRB1	28	45
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819178237	FH	On-Demand	Anodyne	ADRB3	43	43
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819178239	FH	On-Demand	Anodyne	ADRB2	64	45
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819178239	FH	On-Demand	Anodyne	ADRB1	28	45
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819178239	FH	On-Demand	Anodyne	ADRB3	43	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2cccc(O)c2)CC1	ZINC000819178240	FF	On-Demand	Anodyne	GPR119	46	51
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2cccc(O)c2)CC1	ZINC000819178241	FF	On-Demand	Anodyne	GPR119	46	51
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(O)cc2)CC1	ZINC000819178252	FE	On-Demand	Anodyne	GRIN2B	23	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(O)cc2)CC1	ZINC000819178252	FE	On-Demand	Anodyne	GPR119	54	50
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(O)cc2)CC1	ZINC000819178253	FE	On-Demand	Anodyne	GRIN2B	23	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(O)cc2)CC1	ZINC000819178253	FE	On-Demand	Anodyne	GPR119	54	50
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819178262	FI	On-Demand	Anodyne	ADRB2	27	61
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819178262	FI	On-Demand	Anodyne	ADRB1	21	49
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819178263	FI	On-Demand	Anodyne	ADRB2	27	61
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819178263	FI	On-Demand	Anodyne	ADRB1	21	49
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819178264	FI	On-Demand	Anodyne	ADRB2	27	61
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819178264	FI	On-Demand	Anodyne	ADRB1	21	49
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819178265	FI	On-Demand	Anodyne	ADRB2	27	61
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819178265	FI	On-Demand	Anodyne	ADRB1	21	49
Oc1cccc(CCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819178268	CF	On-Demand	Anodyne	ADRB2	96	53
Oc1cccc(CCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819178268	CF	On-Demand	Anodyne	ADRB1	87	48
Oc1cccc(CCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819178268	CF	On-Demand	Anodyne	ADRB3	102	48
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819178269	FF	On-Demand	Anodyne	ADRB2	19	55
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819178269	FF	On-Demand	Anodyne	ADRB1	23	55
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819178269	FF	On-Demand	Anodyne	ADRB3	20	55
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819178270	FF	On-Demand	Anodyne	ADRB2	19	55
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819178270	FF	On-Demand	Anodyne	ADRB1	23	55
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819178270	FF	On-Demand	Anodyne	ADRB3	20	55
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819178271	FF	On-Demand	Anodyne	ADRB2	19	55
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819178271	FF	On-Demand	Anodyne	ADRB1	23	55
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819178271	FF	On-Demand	Anodyne	ADRB3	20	55
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819178272	FF	On-Demand	Anodyne	ADRB2	19	55
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819178272	FF	On-Demand	Anodyne	ADRB1	23	55
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819178272	FF	On-Demand	Anodyne	ADRB3	20	55
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(F)cn1	ZINC000819178275	CE	On-Demand	Anodyne	ADRB2	43	38
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(F)cn1	ZINC000819178276	CE	On-Demand	Anodyne	ADRB2	43	38
Oc1ccc(CCNC[C@H](O)c2ccccc2Br)cc1	ZINC000819178277	EG	On-Demand	Anodyne	ADRB2	87	48
Oc1ccc(CCNC[C@H](O)c2ccccc2Br)cc1	ZINC000819178277	EG	On-Demand	Anodyne	ADRB1	95	48
Oc1ccc(CCNC[C@H](O)c2ccccc2Br)cc1	ZINC000819178277	EG	On-Demand	Anodyne	ADRB3	111	48
Oc1ccc(CCNC[C@H](O)c2ccccc2Br)cc1	ZINC000819178277	EG	On-Demand	Anodyne	SLC6A5	24	40
Oc1ccc(CCNC[C@@H](O)c2ccccc2Br)cc1	ZINC000819178278	EG	On-Demand	Anodyne	ADRB2	87	48
Oc1ccc(CCNC[C@@H](O)c2ccccc2Br)cc1	ZINC000819178278	EG	On-Demand	Anodyne	ADRB1	95	48
Oc1ccc(CCNC[C@@H](O)c2ccccc2Br)cc1	ZINC000819178278	EG	On-Demand	Anodyne	ADRB3	111	48
Oc1ccc(CCNC[C@@H](O)c2ccccc2Br)cc1	ZINC000819178278	EG	On-Demand	Anodyne	SLC6A5	24	40
Oc1cccc(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819178287	CE	On-Demand	Anodyne	ADRB2	84	45
Oc1cccc(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819178287	CE	On-Demand	Anodyne	ADRB1	73	50
Oc1cccc(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819178287	CE	On-Demand	Anodyne	ADRB3	106	50
Oc1cccc(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819178288	CE	On-Demand	Anodyne	ADRB2	84	45
Oc1cccc(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819178288	CE	On-Demand	Anodyne	ADRB1	73	50
Oc1cccc(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819178288	CE	On-Demand	Anodyne	ADRB3	106	50
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CN1C(=O)N[C@H](Cc3ccccc3)C1=O)C2	ZINC000819178328	FE	On-Demand	Anodyne	GALR1	48	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](CN1C(=O)N[C@H](Cc3ccccc3)C1=O)C2	ZINC000819178329	FE	On-Demand	Anodyne	GALR1	48	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](CN1C(=O)N[C@@H](Cc3ccccc3)C1=O)C2	ZINC000819178330	FE	On-Demand	Anodyne	GALR1	48	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CN1C(=O)N[C@@H](Cc3ccccc3)C1=O)C2	ZINC000819178331	FE	On-Demand	Anodyne	GALR1	48	34
Cc1ncc(CCNC[C@H](O)COc2ccc3ccccc3c2)s1	ZINC000819178399	EG	On-Demand	Anodyne	ADRB2	69	54
Cc1ncc(CCNC[C@H](O)COc2ccc3ccccc3c2)s1	ZINC000819178399	EG	On-Demand	Anodyne	ADRB1	84	46
Cc1ncc(CCNC[C@H](O)COc2ccc3ccccc3c2)s1	ZINC000819178399	EG	On-Demand	Anodyne	ADRB3	61	46
Cc1ncc(CCNC[C@H](O)COc2ccc3ccccc3c2)s1	ZINC000819178399	EG	On-Demand	Anodyne	CASR	42	38
Cc1ncc(CCNC[C@H](O)COc2ccc3ccccc3c2)s1	ZINC000819178399	EG	On-Demand	Anodyne	ACOX1	81	40
Cc1ncc(CCNC[C@H](O)COc2ccc3ccccc3c2)s1	ZINC000819178399	EG	On-Demand	Anodyne	CYP2D6	17	43
Cc1ncc(CCNC[C@@H](O)COc2ccc3ccccc3c2)s1	ZINC000819178400	EG	On-Demand	Anodyne	ADRB2	69	54
Cc1ncc(CCNC[C@@H](O)COc2ccc3ccccc3c2)s1	ZINC000819178400	EG	On-Demand	Anodyne	ADRB1	84	46
Cc1ncc(CCNC[C@@H](O)COc2ccc3ccccc3c2)s1	ZINC000819178400	EG	On-Demand	Anodyne	ADRB3	61	46
Cc1ncc(CCNC[C@@H](O)COc2ccc3ccccc3c2)s1	ZINC000819178400	EG	On-Demand	Anodyne	CASR	42	38
Cc1ncc(CCNC[C@@H](O)COc2ccc3ccccc3c2)s1	ZINC000819178400	EG	On-Demand	Anodyne	ACOX1	81	40
Cc1ncc(CCNC[C@@H](O)COc2ccc3ccccc3c2)s1	ZINC000819178400	EG	On-Demand	Anodyne	CYP2D6	17	43
CCCOc1cccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819178401	EG	On-Demand	Bother	ADRB2	75	51
CCCOc1cccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819178401	EG	On-Demand	Bother	ADRB1	91	50
CCCOc1cccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819178401	EG	On-Demand	Bother	ADRB3	114	45
CCCOc1cccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819178401	EG	On-Demand	Bother	ACR	19	41
CCCOc1cccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819178402	EG	On-Demand	Bother	ADRB2	75	51
CCCOc1cccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819178402	EG	On-Demand	Bother	ADRB1	91	50
CCCOc1cccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819178402	EG	On-Demand	Bother	ADRB3	114	45
CCCOc1cccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819178402	EG	On-Demand	Bother	ACR	19	41
Cc1ncc(CCNC[C@H](O)COc2cccc3ccccc23)s1	ZINC000819178429	EG	On-Demand	Anodyne	ADRB2	55	59
Cc1ncc(CCNC[C@H](O)COc2cccc3ccccc23)s1	ZINC000819178429	EG	On-Demand	Anodyne	ADRB1	68	37
Cc1ncc(CCNC[C@H](O)COc2cccc3ccccc23)s1	ZINC000819178429	EG	On-Demand	Anodyne	ADRB3	44	54
Cc1ncc(CCNC[C@H](O)COc2cccc3ccccc23)s1	ZINC000819178429	EG	On-Demand	Anodyne	CYP2D6	22	47
Cc1ncc(CCNC[C@H](O)COc2cccc3ccccc23)s1	ZINC000819178429	EG	On-Demand	Anodyne	ABCB1	17	43
Cc1ncc(CCNC[C@@H](O)COc2cccc3ccccc23)s1	ZINC000819178430	EG	On-Demand	Anodyne	ADRB2	55	59
Cc1ncc(CCNC[C@@H](O)COc2cccc3ccccc23)s1	ZINC000819178430	EG	On-Demand	Anodyne	ADRB1	68	37
Cc1ncc(CCNC[C@@H](O)COc2cccc3ccccc23)s1	ZINC000819178430	EG	On-Demand	Anodyne	ADRB3	44	54
Cc1ncc(CCNC[C@@H](O)COc2cccc3ccccc23)s1	ZINC000819178430	EG	On-Demand	Anodyne	CYP2D6	22	47
Cc1ncc(CCNC[C@@H](O)COc2cccc3ccccc23)s1	ZINC000819178430	EG	On-Demand	Anodyne	ABCB1	17	43
Cc1ncc(CCNC[C@@H](O)Cc2cccc(Cl)c2)s1	ZINC000819178431	DF	On-Demand	Anodyne	ADRB2	16	41
Cc1ncc(CCNC[C@@H](O)Cc2cccc(Cl)c2)s1	ZINC000819178431	DF	On-Demand	Anodyne	ADRB1	36	40
Cc1ncc(CCNC[C@@H](O)Cc2cccc(Cl)c2)s1	ZINC000819178431	DF	On-Demand	Anodyne	ADRB3	30	40
Cc1ncc(CCNC[C@H](O)Cc2cccc(Cl)c2)s1	ZINC000819178432	DF	On-Demand	Anodyne	ADRB2	16	41
Cc1ncc(CCNC[C@H](O)Cc2cccc(Cl)c2)s1	ZINC000819178432	DF	On-Demand	Anodyne	ADRB1	36	40
Cc1ncc(CCNC[C@H](O)Cc2cccc(Cl)c2)s1	ZINC000819178432	DF	On-Demand	Anodyne	ADRB3	30	40
CSc1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178441	EF	On-Demand	Anodyne	ADRB2	52	47
CSc1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178441	EF	On-Demand	Anodyne	ADRB1	74	47
CSc1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178441	EF	On-Demand	Anodyne	ADRB3	51	47
CSc1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178442	EF	On-Demand	Anodyne	ADRB2	52	47
CSc1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178442	EF	On-Demand	Anodyne	ADRB1	74	47
CSc1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178442	EF	On-Demand	Anodyne	ADRB3	51	47
Cc1ncc(CCNC[C@@H](O)COc2ccccc2)s1	ZINC000819178443	CE	On-Demand	Anodyne	ADRB2	79	54
Cc1ncc(CCNC[C@@H](O)COc2ccccc2)s1	ZINC000819178443	CE	On-Demand	Anodyne	ADRB1	108	55
Cc1ncc(CCNC[C@@H](O)COc2ccccc2)s1	ZINC000819178443	CE	On-Demand	Anodyne	ADRB3	78	55
Cc1ncc(CCNC[C@@H](O)COc2ccccc2)s1	ZINC000819178443	CE	On-Demand	Anodyne	ABCB1	17	46
Cc1ncc(CCNC[C@H](O)COc2ccccc2)s1	ZINC000819178444	CE	On-Demand	Anodyne	ADRB2	79	54
Cc1ncc(CCNC[C@H](O)COc2ccccc2)s1	ZINC000819178444	CE	On-Demand	Anodyne	ADRB1	108	55
Cc1ncc(CCNC[C@H](O)COc2ccccc2)s1	ZINC000819178444	CE	On-Demand	Anodyne	ADRB3	78	55
Cc1ncc(CCNC[C@H](O)COc2ccccc2)s1	ZINC000819178444	CE	On-Demand	Anodyne	ABCB1	17	46
Cc1ncc(CCNC[C@@H](O)COC(C)C)s1	ZINC000819178447	CD	On-Demand	Anodyne	ADRB2	24	40
Cc1ncc(CCNC[C@H](O)COC(C)C)s1	ZINC000819178448	CD	On-Demand	Anodyne	ADRB2	24	40
N#Cc1ccc([C@@H](O)CNCCCc2ccccn2)cc1	ZINC000819178455	CE	On-Demand	Mild	ADRB2	18	42
N#Cc1ccc([C@@H](O)CNCCCc2ccccn2)cc1	ZINC000819178455	CE	On-Demand	Mild	ADRB1	17	42
N#Cc1ccc([C@H](O)CNCCCc2ccccn2)cc1	ZINC000819178456	CE	On-Demand	Mild	ADRB2	18	42
N#Cc1ccc([C@H](O)CNCCCc2ccccn2)cc1	ZINC000819178456	CE	On-Demand	Mild	ADRB1	17	42
Cc1ncc(CCNC[C@H](O)COc2ccccc2C)s1	ZINC000819178457	DE	On-Demand	Anodyne	ADRB2	57	58
Cc1ncc(CCNC[C@H](O)COc2ccccc2C)s1	ZINC000819178457	DE	On-Demand	Anodyne	ADRB1	70	48
Cc1ncc(CCNC[C@H](O)COc2ccccc2C)s1	ZINC000819178457	DE	On-Demand	Anodyne	ADRB3	43	42
Cc1ncc(CCNC[C@H](O)COc2ccccc2C)s1	ZINC000819178457	DE	On-Demand	Anodyne	CYP2D6	18	44
Cc1ncc(CCNC[C@H](O)COc2ccccc2C)s1	ZINC000819178457	DE	On-Demand	Anodyne	ABCB1	29	42
Cc1ncc(CCNC[C@@H](O)COc2ccccc2C)s1	ZINC000819178458	DE	On-Demand	Anodyne	ADRB2	57	58
Cc1ncc(CCNC[C@@H](O)COc2ccccc2C)s1	ZINC000819178458	DE	On-Demand	Anodyne	ADRB1	70	48
Cc1ncc(CCNC[C@@H](O)COc2ccccc2C)s1	ZINC000819178458	DE	On-Demand	Anodyne	ADRB3	43	42
Cc1ncc(CCNC[C@@H](O)COc2ccccc2C)s1	ZINC000819178458	DE	On-Demand	Anodyne	CYP2D6	18	44
Cc1ncc(CCNC[C@@H](O)COc2ccccc2C)s1	ZINC000819178458	DE	On-Demand	Anodyne	ABCB1	29	42
Cc1ncc(CCNCCS(=O)(=O)c2cccc(C#N)c2)s1	ZINC000819178459	ED	On-Demand	Mild	GRM5	15	41
Cc1ncc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)s1	ZINC000819178460	EG	On-Demand	Anodyne	ADRB3	30	43
Cc1ncc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)s1	ZINC000819178461	EG	On-Demand	Anodyne	ADRB3	30	43
Cc1ncc(CCNC[C@H](O)COc2c(C)cccc2C)s1	ZINC000819178463	DF	On-Demand	Anodyne	ADRB2	42	42
Cc1ncc(CCNC[C@H](O)COc2c(C)cccc2C)s1	ZINC000819178463	DF	On-Demand	Anodyne	ADRB1	51	39
Cc1ncc(CCNC[C@@H](O)COc2c(C)cccc2C)s1	ZINC000819178464	DF	On-Demand	Anodyne	ADRB2	42	42
Cc1ncc(CCNC[C@@H](O)COc2c(C)cccc2C)s1	ZINC000819178464	DF	On-Demand	Anodyne	ADRB1	51	39
Cc1ncc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)s1	ZINC000819178467	ED	On-Demand	Anodyne	ADRB2	32	40
Cc1ncc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)s1	ZINC000819178467	ED	On-Demand	Anodyne	ADRB3	94	40
Cc1ncc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)s1	ZINC000819178468	ED	On-Demand	Anodyne	ADRB2	32	40
Cc1ncc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)s1	ZINC000819178468	ED	On-Demand	Anodyne	ADRB3	94	40
Oc1cccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819178476	EG	On-Demand	Anodyne	ADRB2	82	44
Oc1cccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819178476	EG	On-Demand	Anodyne	ADRB1	64	43
Oc1cccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819178476	EG	On-Demand	Anodyne	ADRB3	74	43
Oc1cccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819178477	EG	On-Demand	Anodyne	ADRB2	82	44
Oc1cccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819178477	EG	On-Demand	Anodyne	ADRB1	64	43
Oc1cccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819178477	EG	On-Demand	Anodyne	ADRB3	74	43
CC(C)(C)OC(=O)CS(=O)(=O)CCNCCc1ccc(O)cc1	ZINC000819178480	ED	On-Demand	Anodyne	ADRB1	19	41
CC(C)(C)OC(=O)CS(=O)(=O)CCNCCc1ccc(O)cc1	ZINC000819178480	ED	On-Demand	Anodyne	ADRB3	19	41
Oc1cccc(CCNC[C@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819178481	FG	On-Demand	Anodyne	ADRB2	79	44
Oc1cccc(CCNC[C@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819178481	FG	On-Demand	Anodyne	ADRB1	60	47
Oc1cccc(CCNC[C@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819178481	FG	On-Demand	Anodyne	ADRB3	70	47
Oc1cccc(CCNC[C@@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819178482	FG	On-Demand	Anodyne	ADRB2	79	44
Oc1cccc(CCNC[C@@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819178482	FG	On-Demand	Anodyne	ADRB1	60	47
Oc1cccc(CCNC[C@@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819178482	FG	On-Demand	Anodyne	ADRB3	70	47
Oc1cccc(CCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819178491	CF	On-Demand	Anodyne	ADRB2	74	41
Oc1cccc(CCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819178491	CF	On-Demand	Anodyne	ADRB1	55	44
Oc1cccc(CCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819178491	CF	On-Demand	Anodyne	ADRB3	43	44
Oc1cccc(CCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819178492	CF	On-Demand	Anodyne	ADRB2	74	41
Oc1cccc(CCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819178492	CF	On-Demand	Anodyne	ADRB1	55	44
Oc1cccc(CCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819178492	CF	On-Demand	Anodyne	ADRB3	43	44
O[C@@H](CNCc1ccn(C2CCCC2)n1)c1cccc(Cl)c1	ZINC000819178506	DG	On-Demand	Anodyne	ADRB1	30	40
O[C@@H](CNCc1ccn(C2CCCC2)n1)c1cccc(Cl)c1	ZINC000819178506	DG	On-Demand	Anodyne	ADRB3	44	40
O[C@@H](CNCc1ccn(C2CCCC2)n1)c1cccc(Cl)c1	ZINC000819178506	DG	On-Demand	Anodyne	CYP3A4	42	34
O[C@H](CNCc1ccn(C2CCCC2)n1)c1cccc(Cl)c1	ZINC000819178509	DG	On-Demand	Anodyne	ADRB1	30	40
O[C@H](CNCc1ccn(C2CCCC2)n1)c1cccc(Cl)c1	ZINC000819178509	DG	On-Demand	Anodyne	ADRB3	44	40
O[C@H](CNCc1ccn(C2CCCC2)n1)c1cccc(Cl)c1	ZINC000819178509	DG	On-Demand	Anodyne	CYP3A4	42	34
Oc1cccc(CCNC[C@@H](O)C2CC2)c1	ZINC000819178514	BD	On-Demand	Anodyne	ADRB2	47	37
Oc1cccc(CCNC[C@@H](O)C2CC2)c1	ZINC000819178514	BD	On-Demand	Anodyne	ADRB1	44	37
Oc1cccc(CCNC[C@H](O)C2CC2)c1	ZINC000819178515	BD	On-Demand	Anodyne	ADRB2	47	37
Oc1cccc(CCNC[C@H](O)C2CC2)c1	ZINC000819178515	BD	On-Demand	Anodyne	ADRB1	44	37
O[C@@H](CNCCCc1ccccn1)c1ccc(Cl)c(F)c1	ZINC000819178524	DG	On-Demand	Anodyne	ADRB2	29	41
O[C@@H](CNCCCc1ccccn1)c1ccc(Cl)c(F)c1	ZINC000819178524	DG	On-Demand	Anodyne	ADRB1	22	41
O[C@H](CNCCCc1ccccn1)c1ccc(Cl)c(F)c1	ZINC000819178526	DG	On-Demand	Anodyne	ADRB2	29	41
O[C@H](CNCCCc1ccccn1)c1ccc(Cl)c(F)c1	ZINC000819178526	DG	On-Demand	Anodyne	ADRB1	22	41
O[C@@H](CNCCCc1ccccn1)c1ccc(OC(F)(F)F)cc1	ZINC000819178549	EG	On-Demand	Anodyne	ADRB2	37	43
O[C@@H](CNCCCc1ccccn1)c1ccc(OC(F)(F)F)cc1	ZINC000819178549	EG	On-Demand	Anodyne	ADRB1	36	43
O[C@@H](CNCCCc1ccccn1)c1ccc(OC(F)(F)F)cc1	ZINC000819178549	EG	On-Demand	Anodyne	ADRB3	45	45
O[C@H](CNCCCc1ccccn1)c1ccc(OC(F)(F)F)cc1	ZINC000819178551	EG	On-Demand	Anodyne	ADRB2	37	43
O[C@H](CNCCCc1ccccn1)c1ccc(OC(F)(F)F)cc1	ZINC000819178551	EG	On-Demand	Anodyne	ADRB1	36	43
O[C@H](CNCCCc1ccccn1)c1ccc(OC(F)(F)F)cc1	ZINC000819178551	EG	On-Demand	Anodyne	ADRB3	45	45
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1cccc2ccccc12	ZINC000819178566	EI	On-Demand	Anodyne	ADRB2	42	64
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1cccc2ccccc12	ZINC000819178566	EI	On-Demand	Anodyne	ADRB1	29	51
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1cccc2ccccc12	ZINC000819178566	EI	On-Demand	Anodyne	ADRB3	25	51
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1cccc2ccccc12	ZINC000819178569	EI	On-Demand	Anodyne	ADRB2	42	64
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1cccc2ccccc12	ZINC000819178569	EI	On-Demand	Anodyne	ADRB1	29	51
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1cccc2ccccc12	ZINC000819178569	EI	On-Demand	Anodyne	ADRB3	25	51
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819178580	DF	On-Demand	Mild	ADRB2	34	80
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819178580	DF	On-Demand	Mild	ADRB1	20	54
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819178580	DF	On-Demand	Mild	ADRB3	23	54
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819178582	DF	On-Demand	Mild	ADRB2	34	80
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819178582	DF	On-Demand	Mild	ADRB1	20	54
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819178582	DF	On-Demand	Mild	ADRB3	23	54
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819178584	DF	On-Demand	Mild	ADRB2	34	80
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819178584	DF	On-Demand	Mild	ADRB1	20	54
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819178584	DF	On-Demand	Mild	ADRB3	23	54
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819178586	DF	On-Demand	Mild	ADRB2	34	80
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819178586	DF	On-Demand	Mild	ADRB1	20	54
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819178586	DF	On-Demand	Mild	ADRB3	23	54
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(F)cc1	ZINC000819178601	CF	On-Demand	Anodyne	ADRB2	62	48
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(F)cc1	ZINC000819178601	CF	On-Demand	Anodyne	ADRB1	35	45
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(F)cc1	ZINC000819178601	CF	On-Demand	Anodyne	ADRB3	48	45
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819178604	CF	On-Demand	Anodyne	ADRB2	62	48
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819178604	CF	On-Demand	Anodyne	ADRB1	35	45
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819178604	CF	On-Demand	Anodyne	ADRB3	48	45
Oc1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819178605	CD	On-Demand	Anodyne	ADRB2	87	60
Oc1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819178605	CD	On-Demand	Anodyne	ADRB1	92	59
Oc1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819178605	CD	On-Demand	Anodyne	ADRB3	175	60
Oc1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819178609	CD	On-Demand	Anodyne	ADRB2	87	60
Oc1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819178609	CD	On-Demand	Anodyne	ADRB1	92	59
Oc1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819178609	CD	On-Demand	Anodyne	ADRB3	175	60
CON(C)C(=O)CCN[C@H](C)CCc1ccc(O)cc1	ZINC000819178628	CD	On-Demand	Anodyne	ADRB3	15	45
CON(C)C(=O)CCN[C@H](C)CCc1ccc(O)cc1	ZINC000819178628	CD	On-Demand	Anodyne	GRIA1	43	33
CON(C)C(=O)CCN[C@@H](C)CCc1ccc(O)cc1	ZINC000819178629	CD	On-Demand	Anodyne	ADRB3	15	45
CON(C)C(=O)CCN[C@@H](C)CCc1ccc(O)cc1	ZINC000819178629	CD	On-Demand	Anodyne	GRIA1	43	33
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(O)cc2)cc1	ZINC000819178630	ED	On-Demand	Anodyne	CA2	15	49
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(O)cc2)cc1	ZINC000819178630	ED	On-Demand	Anodyne	ADRB2	108	52
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(O)cc2)cc1	ZINC000819178630	ED	On-Demand	Anodyne	ADRB1	106	48
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(O)cc2)cc1	ZINC000819178630	ED	On-Demand	Anodyne	ADRB3	195	52
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(O)cc2)cc1	ZINC000819178630	ED	On-Demand	Anodyne	CA1	17	49
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(O)cc2)cc1	ZINC000819178632	ED	On-Demand	Anodyne	CA2	15	49
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(O)cc2)cc1	ZINC000819178632	ED	On-Demand	Anodyne	ADRB2	108	52
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(O)cc2)cc1	ZINC000819178632	ED	On-Demand	Anodyne	ADRB1	106	48
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(O)cc2)cc1	ZINC000819178632	ED	On-Demand	Anodyne	ADRB3	195	52
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(O)cc2)cc1	ZINC000819178632	ED	On-Demand	Anodyne	CA1	17	49
Cc1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)c(C)c1	ZINC000819178682	DF	On-Demand	Anodyne	ADRB2	36	44
Cc1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)c(C)c1	ZINC000819178682	DF	On-Demand	Anodyne	ADRB1	40	38
Cc1ccc(OC[C@H](O)CNCCc2cnc(C)s2)c(C)c1	ZINC000819178683	DF	On-Demand	Anodyne	ADRB2	36	44
Cc1ccc(OC[C@H](O)CNCCc2cnc(C)s2)c(C)c1	ZINC000819178683	DF	On-Demand	Anodyne	ADRB1	40	38
Cc1ncc(CCNC[C@H](O)c2ccc(Cl)cc2)s1	ZINC000819178684	CF	On-Demand	Anodyne	ADRB2	16	41
Cc1ncc(CCNC[C@H](O)c2ccc(Cl)cc2)s1	ZINC000819178684	CF	On-Demand	Anodyne	ADRB1	22	40
Cc1ncc(CCNC[C@H](O)c2ccc(Cl)cc2)s1	ZINC000819178684	CF	On-Demand	Anodyne	ADRB3	37	40
CCCOc1cccc(CCNCCC(=O)N(C)OC)c1	ZINC000819178686	CE	On-Demand	Anodyne	MTNR1A	30	40
CCCOc1cccc(CCNCCC(=O)N(C)OC)c1	ZINC000819178686	CE	On-Demand	Anodyne	MTNR1B	27	40
CCCOc1cccc(CCNCCC(=O)N(C)OC)c1	ZINC000819178686	CE	On-Demand	Anodyne	CRTM	55	35
Cc1ncc(CCNC[C@H](O)COc2ccc(C#N)cc2)s1	ZINC000819178693	DD	On-Demand	Mild	ADRB2	53	47
Cc1ncc(CCNC[C@H](O)COc2ccc(C#N)cc2)s1	ZINC000819178693	DD	On-Demand	Mild	ADRB1	81	47
Cc1ncc(CCNC[C@H](O)COc2ccc(C#N)cc2)s1	ZINC000819178693	DD	On-Demand	Mild	ADRB3	49	47
Cc1ncc(CCNC[C@@H](O)COc2ccc(C#N)cc2)s1	ZINC000819178694	DD	On-Demand	Mild	ADRB2	53	47
Cc1ncc(CCNC[C@@H](O)COc2ccc(C#N)cc2)s1	ZINC000819178694	DD	On-Demand	Mild	ADRB1	81	47
Cc1ncc(CCNC[C@@H](O)COc2ccc(C#N)cc2)s1	ZINC000819178694	DD	On-Demand	Mild	ADRB3	49	47
CCOc1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178695	EE	On-Demand	Anodyne	ADRB2	62	50
CCOc1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178695	EE	On-Demand	Anodyne	ADRB1	83	50
CCOc1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178695	EE	On-Demand	Anodyne	ADRB3	56	50
CCOc1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178696	EE	On-Demand	Anodyne	ADRB2	62	50
CCOc1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178696	EE	On-Demand	Anodyne	ADRB1	83	50
CCOc1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178696	EE	On-Demand	Anodyne	ADRB3	56	50
Cc1ncc(CCNC[C@@H](O)COc2cccc(C(F)(F)F)c2)s1	ZINC000819178717	FG	On-Demand	Anodyne	ADRB2	49	43
Cc1ncc(CCNC[C@@H](O)COc2cccc(C(F)(F)F)c2)s1	ZINC000819178717	FG	On-Demand	Anodyne	ADRB1	58	41
Cc1ncc(CCNC[C@@H](O)COc2cccc(C(F)(F)F)c2)s1	ZINC000819178717	FG	On-Demand	Anodyne	ADRB3	43	40
Cc1ncc(CCNC[C@@H](O)COc2cccc(C(F)(F)F)c2)s1	ZINC000819178717	FG	On-Demand	Anodyne	ACOX1	41	35
Cc1ncc(CCNC[C@@H](O)COc2cccc(C(F)(F)F)c2)s1	ZINC000819178717	FG	On-Demand	Anodyne	PDS	46	41
Cc1ncc(CCNC[C@H](O)COc2cccc(C(F)(F)F)c2)s1	ZINC000819178718	FG	On-Demand	Anodyne	ADRB2	49	43
Cc1ncc(CCNC[C@H](O)COc2cccc(C(F)(F)F)c2)s1	ZINC000819178718	FG	On-Demand	Anodyne	ADRB1	58	41
Cc1ncc(CCNC[C@H](O)COc2cccc(C(F)(F)F)c2)s1	ZINC000819178718	FG	On-Demand	Anodyne	ADRB3	43	40
Cc1ncc(CCNC[C@H](O)COc2cccc(C(F)(F)F)c2)s1	ZINC000819178718	FG	On-Demand	Anodyne	ACOX1	41	35
Cc1ncc(CCNC[C@H](O)COc2cccc(C(F)(F)F)c2)s1	ZINC000819178718	FG	On-Demand	Anodyne	PDS	46	41
Cc1ncc(CCNCCC(=O)Nc2cccc(Cl)c2)s1	ZINC000819178722	DG	On-Demand	Anodyne	HDAC3	16	41
Cc1ncc(CCNC[C@H](O)c2ccccc2)s1	ZINC000819178733	CE	On-Demand	Anodyne	ADRB2	43	49
Cc1ncc(CCNC[C@H](O)c2ccccc2)s1	ZINC000819178733	CE	On-Demand	Anodyne	ADRB1	56	39
Cc1ncc(CCNC[C@H](O)c2ccccc2)s1	ZINC000819178733	CE	On-Demand	Anodyne	ADRB3	103	47
Cc1ncc(CCNC[C@@H](O)c2ccccc2)s1	ZINC000819178734	CE	On-Demand	Anodyne	ADRB2	43	49
Cc1ncc(CCNC[C@@H](O)c2ccccc2)s1	ZINC000819178734	CE	On-Demand	Anodyne	ADRB1	56	39
Cc1ncc(CCNC[C@@H](O)c2ccccc2)s1	ZINC000819178734	CE	On-Demand	Anodyne	ADRB3	103	47
CCCOc1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819178736	CG	On-Demand	Anodyne	ADRB2	110	58
CCCOc1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819178736	CG	On-Demand	Anodyne	ADRB1	127	54
CCCOc1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819178736	CG	On-Demand	Anodyne	ADRB3	168	54
CCCOc1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819178736	CG	On-Demand	Anodyne	ABCB1	16	42
CCCOc1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819178736	CG	On-Demand	Anodyne	CRTM	45	34
CCCOc1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819178736	CG	On-Demand	Anodyne	PDS	61	36
CCCOc1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819178737	CG	On-Demand	Anodyne	ADRB2	110	58
CCCOc1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819178737	CG	On-Demand	Anodyne	ADRB1	127	54
CCCOc1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819178737	CG	On-Demand	Anodyne	ADRB3	168	54
CCCOc1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819178737	CG	On-Demand	Anodyne	ABCB1	16	42
CCCOc1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819178737	CG	On-Demand	Anodyne	CRTM	45	34
CCCOc1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819178737	CG	On-Demand	Anodyne	PDS	61	36
Cc1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178743	DE	On-Demand	Anodyne	ADRB2	61	51
Cc1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178743	DE	On-Demand	Anodyne	ADRB1	84	51
Cc1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178743	DE	On-Demand	Anodyne	ADRB3	58	51
Cc1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178743	DE	On-Demand	Anodyne	ACOX1	58	32
Cc1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178744	DE	On-Demand	Anodyne	ADRB2	61	51
Cc1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178744	DE	On-Demand	Anodyne	ADRB1	84	51
Cc1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178744	DE	On-Demand	Anodyne	ADRB3	58	51
Cc1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819178744	DE	On-Demand	Anodyne	ACOX1	58	32
O[C@@H](CN[C@@H]1[C@H]2CCc3ccccc3[C@@H]21)c1ccc(Cl)cc1	ZINC000819178766	DH	On-Demand	Anodyne	ADRB3	18	42
O[C@@H](CN[C@H]1[C@@H]2c3ccccc3CC[C@H]21)c1ccc(Cl)cc1	ZINC000819178767	DH	On-Demand	Anodyne	ADRB3	18	42
O[C@@H](CN[C@@H]1[C@H]2CCc3ccccc3[C@H]21)c1ccc(Cl)cc1	ZINC000819178768	DH	On-Demand	Anodyne	ADRB3	18	42
O[C@@H](CN[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21)c1ccc(Cl)cc1	ZINC000819178769	DH	On-Demand	Anodyne	ADRB3	18	42
Cc1ncc(CCNC[C@@H](O)CO[C@H]2CCCc3ccccc32)s1	ZINC000819178770	EG	On-Demand	Anodyne	ADRB3	27	40
Cc1ncc(CCNC[C@H](O)CO[C@H]2CCCc3ccccc32)s1	ZINC000819178771	EG	On-Demand	Anodyne	ADRB3	27	40
Cc1ncc(CCNC[C@H](O)CO[C@@H]2CCCc3ccccc32)s1	ZINC000819178772	EG	On-Demand	Anodyne	ADRB3	27	40
Cc1ncc(CCNC[C@@H](O)CO[C@@H]2CCCc3ccccc32)s1	ZINC000819178773	EG	On-Demand	Anodyne	ADRB3	27	40
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccccc1Br	ZINC000819178784	FG	On-Demand	Anodyne	ADRB2	45	42
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccccc1Br	ZINC000819178784	FG	On-Demand	Anodyne	ADRB1	20	40
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccccc1Br	ZINC000819178784	FG	On-Demand	Anodyne	ADRB3	40	38
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccccc1Br	ZINC000819178786	FG	On-Demand	Anodyne	ADRB2	45	42
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccccc1Br	ZINC000819178786	FG	On-Demand	Anodyne	ADRB1	20	40
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccccc1Br	ZINC000819178786	FG	On-Demand	Anodyne	ADRB3	40	38
Oc1ccc(CCNC[C@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819178787	FG	On-Demand	Anodyne	ADRB2	76	55
Oc1ccc(CCNC[C@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819178787	FG	On-Demand	Anodyne	ADRB1	79	47
Oc1ccc(CCNC[C@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819178787	FG	On-Demand	Anodyne	ADRB3	111	47
Oc1ccc(CCNC[C@@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819178788	FG	On-Demand	Anodyne	ADRB2	76	55
Oc1ccc(CCNC[C@@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819178788	FG	On-Demand	Anodyne	ADRB1	79	47
Oc1ccc(CCNC[C@@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819178788	FG	On-Demand	Anodyne	ADRB3	111	47
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819178814	FG	On-Demand	Anodyne	ADRB2	47	39
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819178814	FG	On-Demand	Anodyne	ADRB1	21	52
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819178814	FG	On-Demand	Anodyne	ADRB3	44	43
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819178816	FG	On-Demand	Anodyne	ADRB2	47	39
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819178816	FG	On-Demand	Anodyne	ADRB1	21	52
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819178816	FG	On-Demand	Anodyne	ADRB3	44	43
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cccc(O)c2)cc1	ZINC000819178822	DE	On-Demand	Bother	ADRB2	81	44
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cccc(O)c2)cc1	ZINC000819178822	DE	On-Demand	Bother	ADRB1	72	43
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cccc(O)c2)cc1	ZINC000819178822	DE	On-Demand	Bother	ADRB3	90	43
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cccc(O)c2)cc1	ZINC000819178823	DE	On-Demand	Bother	ADRB2	81	44
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cccc(O)c2)cc1	ZINC000819178823	DE	On-Demand	Bother	ADRB1	72	43
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cccc(O)c2)cc1	ZINC000819178823	DE	On-Demand	Bother	ADRB3	90	43
Oc1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819178824	CE	On-Demand	Anodyne	ADRB2	113	51
Oc1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819178824	CE	On-Demand	Anodyne	ADRB1	111	51
Oc1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819178824	CE	On-Demand	Anodyne	ADRB3	150	50
Oc1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819178825	CE	On-Demand	Anodyne	ADRB2	113	51
Oc1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819178825	CE	On-Demand	Anodyne	ADRB1	111	51
Oc1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819178825	CE	On-Demand	Anodyne	ADRB3	150	50
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccccc1	ZINC000819178837	CF	On-Demand	Anodyne	ADRB2	74	53
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccccc1	ZINC000819178837	CF	On-Demand	Anodyne	ADRB1	44	57
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccccc1	ZINC000819178837	CF	On-Demand	Anodyne	ADRB3	77	57
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccccc1	ZINC000819178838	CF	On-Demand	Anodyne	ADRB2	74	53
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccccc1	ZINC000819178838	CF	On-Demand	Anodyne	ADRB1	44	57
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccccc1	ZINC000819178838	CF	On-Demand	Anodyne	ADRB3	77	57
O=C(/C=C/c1ccc(O)cc1)N1CCC(CCc2ccccc2)CC1	ZINC000819178843	EI	On-Demand	Anodyne	SLC18A2	41	34
O=C(/C=C/c1ccc(O)cc1)N1CCC(CCc2ccccc2)CC1	ZINC000819178843	EI	On-Demand	Anodyne	GRIN2B	67	78
O=C(/C=C/c1ccc(O)cc1)N1CCC(CCc2ccccc2)CC1	ZINC000819178843	EI	On-Demand	Anodyne	SIGMAR1	16	41
O=C(/C=C/c1ccc(O)cc1)N1CCC(CCc2ccccc2)CC1	ZINC000819178843	EI	On-Demand	Anodyne	F3	25	41
O=C(/C=C/c1ccc(O)cc1)N1CCC(CCc2ccccc2)CC1	ZINC000819178843	EI	On-Demand	Anodyne	CCR2	16	48
O=C(/C=C/c1ccc(O)cc1)N1CCC(CCc2ccccc2)CC1	ZINC000819178843	EI	On-Demand	Anodyne	AKR1B10	19	49
O=C(/C=C\c1ccc(O)cc1)N1CCC(CCc2ccccc2)CC1	ZINC000819178844	EI	On-Demand	Anodyne	SLC18A2	41	34
O=C(/C=C\c1ccc(O)cc1)N1CCC(CCc2ccccc2)CC1	ZINC000819178844	EI	On-Demand	Anodyne	GRIN2B	67	78
O=C(/C=C\c1ccc(O)cc1)N1CCC(CCc2ccccc2)CC1	ZINC000819178844	EI	On-Demand	Anodyne	SIGMAR1	16	41
O=C(/C=C\c1ccc(O)cc1)N1CCC(CCc2ccccc2)CC1	ZINC000819178844	EI	On-Demand	Anodyne	F3	25	41
O=C(/C=C\c1ccc(O)cc1)N1CCC(CCc2ccccc2)CC1	ZINC000819178844	EI	On-Demand	Anodyne	CCR2	16	48
O=C(/C=C\c1ccc(O)cc1)N1CCC(CCc2ccccc2)CC1	ZINC000819178844	EI	On-Demand	Anodyne	AKR1B10	19	49
CON(C)C(=O)CCNCCc1ccc(O)cc1	ZINC000819178853	CC	On-Demand	Anodyne	ADRB3	22	40
CON(C)C(=O)CCNCCc1ccc(O)cc1	ZINC000819178853	CC	On-Demand	Anodyne	GRIA1	44	33
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCCC(F)(F)C2)cc1	ZINC000819178876	EE	On-Demand	Anodyne	ADRB3	16	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCCC(F)(F)C2)cc1	ZINC000819178877	EE	On-Demand	Anodyne	ADRB3	16	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCCC(F)(F)C2)cc1	ZINC000819178878	EE	On-Demand	Anodyne	ADRB3	16	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCCC(F)(F)C2)cc1	ZINC000819178879	EE	On-Demand	Anodyne	ADRB3	16	40
Cc1ncc(CCNC[C@@H](O)COc2ccccc2Cl)s1	ZINC000819178887	EF	On-Demand	Anodyne	ADRB2	50	57
Cc1ncc(CCNC[C@@H](O)COc2ccccc2Cl)s1	ZINC000819178887	EF	On-Demand	Anodyne	ADRB1	66	41
Cc1ncc(CCNC[C@@H](O)COc2ccccc2Cl)s1	ZINC000819178887	EF	On-Demand	Anodyne	ADRB3	40	41
Cc1ncc(CCNC[C@@H](O)COc2ccccc2Cl)s1	ZINC000819178887	EF	On-Demand	Anodyne	ABCB1	17	41
Cc1ncc(CCNC[C@H](O)COc2ccccc2Cl)s1	ZINC000819178888	EF	On-Demand	Anodyne	ADRB2	50	57
Cc1ncc(CCNC[C@H](O)COc2ccccc2Cl)s1	ZINC000819178888	EF	On-Demand	Anodyne	ADRB1	66	41
Cc1ncc(CCNC[C@H](O)COc2ccccc2Cl)s1	ZINC000819178888	EF	On-Demand	Anodyne	ADRB3	40	41
Cc1ncc(CCNC[C@H](O)COc2ccccc2Cl)s1	ZINC000819178888	EF	On-Demand	Anodyne	ABCB1	17	41
Cc1ncc(CCNC[C@@H](O)COc2ccc(Br)cc2)s1	ZINC000819178889	FF	On-Demand	Anodyne	ADRB2	56	49
Cc1ncc(CCNC[C@@H](O)COc2ccc(Br)cc2)s1	ZINC000819178889	FF	On-Demand	Anodyne	ADRB1	78	49
Cc1ncc(CCNC[C@@H](O)COc2ccc(Br)cc2)s1	ZINC000819178889	FF	On-Demand	Anodyne	ADRB3	53	49
Cc1ncc(CCNC[C@H](O)COc2ccc(Br)cc2)s1	ZINC000819178890	FF	On-Demand	Anodyne	ADRB2	56	49
Cc1ncc(CCNC[C@H](O)COc2ccc(Br)cc2)s1	ZINC000819178890	FF	On-Demand	Anodyne	ADRB1	78	49
Cc1ncc(CCNC[C@H](O)COc2ccc(Br)cc2)s1	ZINC000819178890	FF	On-Demand	Anodyne	ADRB3	53	49
Cc1ncc(CCNC[C@@H](O)COc2ccc(Cl)cc2Cl)s1	ZINC000819178917	FG	On-Demand	Anodyne	ADRB2	31	43
Cc1ncc(CCNC[C@@H](O)COc2ccc(Cl)cc2Cl)s1	ZINC000819178917	FG	On-Demand	Anodyne	ADRB1	43	37
Cc1ncc(CCNC[C@H](O)COc2ccc(Cl)cc2Cl)s1	ZINC000819178918	FG	On-Demand	Anodyne	ADRB2	31	43
Cc1ncc(CCNC[C@H](O)COc2ccc(Cl)cc2Cl)s1	ZINC000819178918	FG	On-Demand	Anodyne	ADRB1	43	37
Cc1ncc(CCNC[C@H](O)COc2ccc(C(C)(C)C)cc2)s1	ZINC000819178923	EG	On-Demand	Anodyne	ADRB2	60	49
Cc1ncc(CCNC[C@H](O)COc2ccc(C(C)(C)C)cc2)s1	ZINC000819178923	EG	On-Demand	Anodyne	ADRB1	78	49
Cc1ncc(CCNC[C@H](O)COc2ccc(C(C)(C)C)cc2)s1	ZINC000819178923	EG	On-Demand	Anodyne	ADRB3	54	49
Cc1ncc(CCNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)s1	ZINC000819178924	EG	On-Demand	Anodyne	ADRB2	60	49
Cc1ncc(CCNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)s1	ZINC000819178924	EG	On-Demand	Anodyne	ADRB1	78	49
Cc1ncc(CCNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)s1	ZINC000819178924	EG	On-Demand	Anodyne	ADRB3	54	49
Cc1ncc(CCNCCC(=O)Nc2ccccc2)s1	ZINC000819178925	CF	On-Demand	Anodyne	CDK5	16	41
CCCOc1cccc(CCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819178934	EH	On-Demand	Anodyne	ADRB2	55	51
CCCOc1cccc(CCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819178934	EH	On-Demand	Anodyne	ADRB1	66	51
CCCOc1cccc(CCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819178934	EH	On-Demand	Anodyne	ADRB3	55	47
CCCOc1cccc(CCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819178934	EH	On-Demand	Anodyne	PDS	40	35
CCCOc1cccc(CCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819178935	EH	On-Demand	Anodyne	ADRB2	55	51
CCCOc1cccc(CCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819178935	EH	On-Demand	Anodyne	ADRB1	66	51
CCCOc1cccc(CCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819178935	EH	On-Demand	Anodyne	ADRB3	55	47
CCCOc1cccc(CCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819178935	EH	On-Demand	Anodyne	PDS	40	35
Cc1ncc(CCNCCC(=O)Nc2cccc(C(F)(F)F)c2)s1	ZINC000819178936	FH	On-Demand	Anodyne	KIT	18	43
Cc1ncc(CCNCCC(=O)Nc2cccc(C(F)(F)F)c2)s1	ZINC000819178936	FH	On-Demand	Anodyne	LCK	27	42
Cc1ncc(CCNCCC(=O)Nc2cccc(C(F)(F)F)c2)s1	ZINC000819178936	FH	On-Demand	Anodyne	KDR	18	43
Cc1ncc(CCNCCC(=O)Nc2cccc(C(F)(F)F)c2)s1	ZINC000819178936	FH	On-Demand	Anodyne	TEK	28	41
Cc1ncc(CCNCCC(=O)Nc2cccc(C(F)(F)F)c2)s1	ZINC000819178936	FH	On-Demand	Anodyne	BTK	22	42
Cc1ncc(CCNC[C@H](O)COCc2ccccc2)s1	ZINC000819178939	DE	On-Demand	Anodyne	ADRB2	42	41
Cc1ncc(CCNC[C@H](O)COCc2ccccc2)s1	ZINC000819178939	DE	On-Demand	Anodyne	ADRB1	54	41
Cc1ncc(CCNC[C@H](O)COCc2ccccc2)s1	ZINC000819178939	DE	On-Demand	Anodyne	ADRB3	42	41
Cc1ncc(CCNC[C@@H](O)COCc2ccccc2)s1	ZINC000819178940	DE	On-Demand	Anodyne	ADRB2	42	41
Cc1ncc(CCNC[C@@H](O)COCc2ccccc2)s1	ZINC000819178940	DE	On-Demand	Anodyne	ADRB1	54	41
Cc1ncc(CCNC[C@@H](O)COCc2ccccc2)s1	ZINC000819178940	DE	On-Demand	Anodyne	ADRB3	42	41
Cc1ncc(CCNCCC(=O)Nc2cccc(Br)c2)s1	ZINC000819178941	FG	On-Demand	Anodyne	EGFR	63	43
Cc1ncc(CCNCCC(=O)Nc2cccc(Br)c2)s1	ZINC000819178941	FG	On-Demand	Anodyne	HDAC10	17	40
CCCOc1cccc(CCNCCS(C)(=O)=O)c1	ZINC000819178964	CD	On-Demand	Anodyne	UPP1	16	41
CCCOc1cccc(CCNCCS(C)(=O)=O)c1	ZINC000819178964	CD	On-Demand	Anodyne	MTNR1A	19	40
CCCOc1cccc(CCNCCS(C)(=O)=O)c1	ZINC000819178964	CD	On-Demand	Anodyne	CRTM	48	34
COc1ccccc1COC[C@@H](O)CNCCc1cnc(C)s1	ZINC000819178965	EE	On-Demand	Anodyne	ADRB2	36	41
COc1ccccc1COC[C@@H](O)CNCCc1cnc(C)s1	ZINC000819178965	EE	On-Demand	Anodyne	ADRB1	42	44
COc1ccccc1COC[C@@H](O)CNCCc1cnc(C)s1	ZINC000819178965	EE	On-Demand	Anodyne	ADRB3	27	44
COc1ccccc1COC[C@H](O)CNCCc1cnc(C)s1	ZINC000819178966	EE	On-Demand	Anodyne	ADRB2	36	41
COc1ccccc1COC[C@H](O)CNCCc1cnc(C)s1	ZINC000819178966	EE	On-Demand	Anodyne	ADRB1	42	44
COc1ccccc1COC[C@H](O)CNCCc1cnc(C)s1	ZINC000819178966	EE	On-Demand	Anodyne	ADRB3	27	44
O[C@@H](CNCCCc1ccccn1)c1ccc(Cl)cc1Cl	ZINC000819178979	EH	On-Demand	Anodyne	ADRB2	27	48
O[C@@H](CNCCCc1ccccn1)c1ccc(Cl)cc1Cl	ZINC000819178979	EH	On-Demand	Anodyne	ADRB1	31	48
O[C@H](CNCCCc1ccccn1)c1ccc(Cl)cc1Cl	ZINC000819178980	EH	On-Demand	Anodyne	ADRB2	27	48
O[C@H](CNCCCc1ccccn1)c1ccc(Cl)cc1Cl	ZINC000819178980	EH	On-Demand	Anodyne	ADRB1	31	48
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819178982	FE	On-Demand	Anodyne	ADRB2	55	78
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819178982	FE	On-Demand	Anodyne	ADRB1	39	50
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819178982	FE	On-Demand	Anodyne	ADRB3	69	50
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819178983	FE	On-Demand	Anodyne	ADRB2	55	78
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819178983	FE	On-Demand	Anodyne	ADRB1	39	50
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819178983	FE	On-Demand	Anodyne	ADRB3	69	50
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819178984	FE	On-Demand	Anodyne	ADRB2	55	78
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819178984	FE	On-Demand	Anodyne	ADRB1	39	50
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819178984	FE	On-Demand	Anodyne	ADRB3	69	50
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819178985	FE	On-Demand	Anodyne	ADRB2	55	78
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819178985	FE	On-Demand	Anodyne	ADRB1	39	50
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819178985	FE	On-Demand	Anodyne	ADRB3	69	50
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819178993	EH	On-Demand	Anodyne	ADRB2	57	45
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819178993	EH	On-Demand	Anodyne	ADRB1	29	47
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819178993	EH	On-Demand	Anodyne	ADRB3	46	47
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819178995	EH	On-Demand	Anodyne	ADRB2	57	45
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819178995	EH	On-Demand	Anodyne	ADRB1	29	47
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819178995	EH	On-Demand	Anodyne	ADRB3	46	47
Oc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819178996	EH	On-Demand	Anodyne	ADRB2	77	45
Oc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819178996	EH	On-Demand	Anodyne	ADRB1	87	47
Oc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819178996	EH	On-Demand	Anodyne	ADRB3	78	47
Oc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819178996	EH	On-Demand	Anodyne	SLC6A5	22	41
Oc1ccc(CCNC[C@@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819178997	EH	On-Demand	Anodyne	ADRB2	77	45
Oc1ccc(CCNC[C@@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819178997	EH	On-Demand	Anodyne	ADRB1	87	47
Oc1ccc(CCNC[C@@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819178997	EH	On-Demand	Anodyne	ADRB3	78	47
Oc1ccc(CCNC[C@@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819178997	EH	On-Demand	Anodyne	SLC6A5	22	41
Oc1cccc(CCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819179002	CF	On-Demand	Anodyne	ADRB2	87	43
Oc1cccc(CCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819179002	CF	On-Demand	Anodyne	ADRB1	66	44
Oc1cccc(CCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819179002	CF	On-Demand	Anodyne	ADRB3	49	44
Oc1cccc(CCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819179003	CF	On-Demand	Anodyne	ADRB2	87	43
Oc1cccc(CCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819179003	CF	On-Demand	Anodyne	ADRB1	66	44
Oc1cccc(CCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819179003	CF	On-Demand	Anodyne	ADRB3	49	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCCC(F)(F)C2)CC1	ZINC000819179004	FG	On-Demand	Anodyne	GPR119	26	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCCC(F)(F)C2)CC1	ZINC000819179005	FG	On-Demand	Anodyne	GPR119	26	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCCC(F)(F)C2)CC1	ZINC000819179006	FG	On-Demand	Anodyne	GPR119	26	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCCC(F)(F)C2)CC1	ZINC000819179007	FG	On-Demand	Anodyne	GPR119	26	43
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819179021	CF	On-Demand	Mild	ADRB2	45	37
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819179021	CF	On-Demand	Mild	ADRB1	20	52
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819179021	CF	On-Demand	Mild	ADRB3	33	41
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819179022	CF	On-Demand	Mild	ADRB2	45	37
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819179022	CF	On-Demand	Mild	ADRB1	20	52
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819179022	CF	On-Demand	Mild	ADRB3	33	41
Oc1ccc(CCNC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819179027	DG	On-Demand	Anodyne	ADRB2	72	43
Oc1ccc(CCNC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819179027	DG	On-Demand	Anodyne	ADRB1	79	44
Oc1ccc(CCNC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819179027	DG	On-Demand	Anodyne	ADRB3	74	44
Oc1ccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819179028	DG	On-Demand	Anodyne	ADRB2	72	43
Oc1ccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819179028	DG	On-Demand	Anodyne	ADRB1	79	44
Oc1ccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819179028	DG	On-Demand	Anodyne	ADRB3	74	44
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1cc(F)ccc1F	ZINC000819179029	DG	On-Demand	Anodyne	ADRB2	24	62
C[C@@H](CCc1ccc(O)cc1)NC[C@@H](O)c1cc(F)ccc1F	ZINC000819179029	DG	On-Demand	Anodyne	ADRB1	15	50
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1cc(F)ccc1F	ZINC000819179030	DG	On-Demand	Anodyne	ADRB2	24	62
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c1cc(F)ccc1F	ZINC000819179030	DG	On-Demand	Anodyne	ADRB1	15	50
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1cc(F)ccc1F	ZINC000819179031	DG	On-Demand	Anodyne	ADRB2	24	62
C[C@@H](CCc1ccc(O)cc1)NC[C@H](O)c1cc(F)ccc1F	ZINC000819179031	DG	On-Demand	Anodyne	ADRB1	15	50
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1cc(F)ccc1F	ZINC000819179032	DG	On-Demand	Anodyne	ADRB2	24	62
C[C@H](CCc1ccc(O)cc1)NC[C@H](O)c1cc(F)ccc1F	ZINC000819179032	DG	On-Demand	Anodyne	ADRB1	15	50
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1cc(F)ccc1F	ZINC000819179037	DF	On-Demand	Anodyne	ADRB2	40	35
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1cc(F)ccc1F	ZINC000819179037	DF	On-Demand	Anodyne	ADRB1	18	48
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1cc(F)ccc1F	ZINC000819179037	DF	On-Demand	Anodyne	ADRB3	38	40
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1cc(F)ccc1F	ZINC000819179039	DF	On-Demand	Anodyne	ADRB2	40	35
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1cc(F)ccc1F	ZINC000819179039	DF	On-Demand	Anodyne	ADRB1	18	48
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1cc(F)ccc1F	ZINC000819179039	DF	On-Demand	Anodyne	ADRB3	38	40
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819179049	DG	On-Demand	Anodyne	ADRB1	18	46
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819179049	DG	On-Demand	Anodyne	ADRB3	38	41
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1ccc(F)cc1Cl	ZINC000819179051	DG	On-Demand	Anodyne	ADRB1	18	46
C[C@@H](Cc1ccc(O)cc1)NC[C@H](O)c1ccc(F)cc1Cl	ZINC000819179051	DG	On-Demand	Anodyne	ADRB3	38	41
Oc1cccc(CCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819179057	CF	On-Demand	Anodyne	ADRB2	106	49
Oc1cccc(CCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819179057	CF	On-Demand	Anodyne	ADRB1	102	61
Oc1cccc(CCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819179057	CF	On-Demand	Anodyne	ADRB3	131	61
Oc1cccc(CCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819179058	CF	On-Demand	Anodyne	ADRB2	106	49
Oc1cccc(CCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819179058	CF	On-Demand	Anodyne	ADRB1	102	61
Oc1cccc(CCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819179058	CF	On-Demand	Anodyne	ADRB3	131	61
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(F)cc1F	ZINC000819179066	DF	On-Demand	Anodyne	ADRB2	45	41
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(F)cc1F	ZINC000819179066	DF	On-Demand	Anodyne	ADRB1	19	41
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(F)cc1F	ZINC000819179068	DF	On-Demand	Anodyne	ADRB2	45	41
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(F)cc1F	ZINC000819179068	DF	On-Demand	Anodyne	ADRB1	19	41
CN(C)c1ccc(NC(=O)CCNCCc2ccc(O)cc2)cc1	ZINC000819179074	EF	On-Demand	Anodyne	ADRB1	28	44
CN(C)c1ccc(NC(=O)CCNCCc2ccc(O)cc2)cc1	ZINC000819179074	EF	On-Demand	Anodyne	ADRB3	34	44
CN(C)c1ccc(NC(=O)CCNCCc2ccc(O)cc2)cc1	ZINC000819179074	EF	On-Demand	Anodyne	GRIA1	40	33
CC(=O)c1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819179094	EE	On-Demand	Anodyne	ADRB2	56	48
CC(=O)c1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819179094	EE	On-Demand	Anodyne	ADRB1	89	48
CC(=O)c1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819179094	EE	On-Demand	Anodyne	ADRB3	62	48
CC(=O)c1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819179094	EE	On-Demand	Anodyne	ABCB1	16	57
CC(=O)c1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819179095	EE	On-Demand	Anodyne	ADRB2	56	48
CC(=O)c1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819179095	EE	On-Demand	Anodyne	ADRB1	89	48
CC(=O)c1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819179095	EE	On-Demand	Anodyne	ADRB3	62	48
CC(=O)c1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819179095	EE	On-Demand	Anodyne	ABCB1	16	57
Cc1ncc(CCNC[C@@H](O)COc2cccc3[nH]ccc23)s1	ZINC000819179122	EF	On-Demand	Anodyne	ADRB2	35	58
Cc1ncc(CCNC[C@@H](O)COc2cccc3[nH]ccc23)s1	ZINC000819179122	EF	On-Demand	Anodyne	ADRB1	57	58
Cc1ncc(CCNC[C@@H](O)COc2cccc3[nH]ccc23)s1	ZINC000819179122	EF	On-Demand	Anodyne	ADRB3	29	58
Cc1ncc(CCNC[C@@H](O)COc2cccc3[nH]ccc23)s1	ZINC000819179122	EF	On-Demand	Anodyne	CYP2D6	18	43
Cc1ncc(CCNC[C@H](O)COc2cccc3[nH]ccc23)s1	ZINC000819179123	EF	On-Demand	Anodyne	ADRB2	35	58
Cc1ncc(CCNC[C@H](O)COc2cccc3[nH]ccc23)s1	ZINC000819179123	EF	On-Demand	Anodyne	ADRB1	57	58
Cc1ncc(CCNC[C@H](O)COc2cccc3[nH]ccc23)s1	ZINC000819179123	EF	On-Demand	Anodyne	ADRB3	29	58
Cc1ncc(CCNC[C@H](O)COc2cccc3[nH]ccc23)s1	ZINC000819179123	EF	On-Demand	Anodyne	CYP2D6	18	43
O[C@@H](CNCCCc1ccccn1)c1ccc(F)cc1Cl	ZINC000819179146	DG	On-Demand	Anodyne	ADRB2	25	47
O[C@@H](CNCCCc1ccccn1)c1ccc(F)cc1Cl	ZINC000819179146	DG	On-Demand	Anodyne	ADRB1	23	47
O[C@H](CNCCCc1ccccn1)c1ccc(F)cc1Cl	ZINC000819179147	DG	On-Demand	Anodyne	ADRB2	25	47
O[C@H](CNCCCc1ccccn1)c1ccc(F)cc1Cl	ZINC000819179147	DG	On-Demand	Anodyne	ADRB1	23	47
CCCOc1cccc(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819179162	DG	On-Demand	Anodyne	ADRB2	78	53
CCCOc1cccc(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819179162	DG	On-Demand	Anodyne	ADRB1	86	53
CCCOc1cccc(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819179162	DG	On-Demand	Anodyne	ADRB3	71	46
CCCOc1cccc(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819179162	DG	On-Demand	Anodyne	PDS	45	33
CCCOc1cccc(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819179163	DG	On-Demand	Anodyne	ADRB2	78	53
CCCOc1cccc(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819179163	DG	On-Demand	Anodyne	ADRB1	86	53
CCCOc1cccc(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819179163	DG	On-Demand	Anodyne	ADRB3	71	46
CCCOc1cccc(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819179163	DG	On-Demand	Anodyne	PDS	45	33
Cc1ncc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)s1	ZINC000819179164	DG	On-Demand	Anodyne	ADRB2	16	40
Cc1ncc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)s1	ZINC000819179164	DG	On-Demand	Anodyne	ADRB1	18	40
Cc1ncc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)s1	ZINC000819179164	DG	On-Demand	Anodyne	ADRB3	27	41
Cc1ncc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)s1	ZINC000819179165	DG	On-Demand	Anodyne	ADRB2	16	40
Cc1ncc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)s1	ZINC000819179165	DG	On-Demand	Anodyne	ADRB1	18	40
Cc1ncc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)s1	ZINC000819179165	DG	On-Demand	Anodyne	ADRB3	27	41
O[C@H](CNCC1(c2cccc(Br)c2)CCCC1)c1cccnc1	ZINC000819179176	GH	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNCC1(c2cccc(Br)c2)CCCC1)c1cccnc1	ZINC000819179176	GH	On-Demand	Anodyne	ADRB1	21	40
O[C@H](CNCC1(c2cccc(Br)c2)CCCC1)c1cccnc1	ZINC000819179176	GH	On-Demand	Anodyne	ADRB3	86	44
O[C@@H](CNCC1(c2cccc(Br)c2)CCCC1)c1cccnc1	ZINC000819179178	GH	On-Demand	Anodyne	ADRB2	20	40
O[C@@H](CNCC1(c2cccc(Br)c2)CCCC1)c1cccnc1	ZINC000819179178	GH	On-Demand	Anodyne	ADRB1	21	40
O[C@@H](CNCC1(c2cccc(Br)c2)CCCC1)c1cccnc1	ZINC000819179178	GH	On-Demand	Anodyne	ADRB3	86	44
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc(O)c1	ZINC000819179182	CF	On-Demand	Anodyne	ADRB2	85	44
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc(O)c1	ZINC000819179182	CF	On-Demand	Anodyne	ADRB1	59	44
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc(O)c1	ZINC000819179182	CF	On-Demand	Anodyne	ADRB3	42	40
CCCOc1cccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819179183	GF	On-Demand	Anodyne	ADRB2	107	52
CCCOc1cccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819179183	GF	On-Demand	Anodyne	ADRB1	112	51
CCCOc1cccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819179183	GF	On-Demand	Anodyne	ADRB3	190	44
CCCOc1cccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819179185	GF	On-Demand	Anodyne	ADRB2	107	52
CCCOc1cccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819179185	GF	On-Demand	Anodyne	ADRB1	112	51
CCCOc1cccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819179185	GF	On-Demand	Anodyne	ADRB3	190	44
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819179197	CF	On-Demand	Mild	ADRB2	52	45
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819179197	CF	On-Demand	Mild	ADRB1	23	43
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819179197	CF	On-Demand	Mild	ADRB3	42	41
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819179198	CF	On-Demand	Mild	ADRB2	52	45
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819179198	CF	On-Demand	Mild	ADRB1	23	43
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819179198	CF	On-Demand	Mild	ADRB3	42	41
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819179203	DG	On-Demand	Anodyne	ADRB2	39	40
C[C@@H](Cc1cccc(O)c1)NC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819179203	DG	On-Demand	Anodyne	ADRB1	20	43
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(F)cc1Cl	ZINC000819179205	DG	On-Demand	Anodyne	ADRB2	39	40
C[C@@H](Cc1cccc(O)c1)NC[C@H](O)c1ccc(F)cc1Cl	ZINC000819179205	DG	On-Demand	Anodyne	ADRB1	20	43
Cc1ccccc1[C@@H](O)CNCCc1ccc(O)cc1	ZINC000819179210	CF	On-Demand	Anodyne	ADRB2	98	48
Cc1ccccc1[C@@H](O)CNCCc1ccc(O)cc1	ZINC000819179210	CF	On-Demand	Anodyne	ADRB1	106	48
Cc1ccccc1[C@@H](O)CNCCc1ccc(O)cc1	ZINC000819179210	CF	On-Demand	Anodyne	ADRB3	114	48
Cc1ccccc1[C@@H](O)CNCCc1ccc(O)cc1	ZINC000819179210	CF	On-Demand	Anodyne	SLC6A5	25	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2ccccn2)cc1	ZINC000819179236	ED	On-Demand	Anodyne	ADRB2	43	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2ccccn2)cc1	ZINC000819179236	ED	On-Demand	Anodyne	ADRB1	35	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2ccccn2)cc1	ZINC000819179236	ED	On-Demand	Anodyne	ADRB3	95	40
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2ccccn2)cc1	ZINC000819179237	ED	On-Demand	Anodyne	ADRB2	43	43
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2ccccn2)cc1	ZINC000819179237	ED	On-Demand	Anodyne	ADRB1	35	43
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2ccccn2)cc1	ZINC000819179237	ED	On-Demand	Anodyne	ADRB3	95	40
Cc1ncc(CCNC[C@@H](O)CCc2ccccc2)s1	ZINC000819179238	CF	On-Demand	Anodyne	ADRB3	40	39
Cc1ncc(CCNC[C@H](O)CCc2ccccc2)s1	ZINC000819179239	CF	On-Demand	Anodyne	ADRB3	40	39
Cc1ncc(CCNC[C@H](O)COC(c2ccccc2)c2ccccc2)s1	ZINC000819179258	GH	On-Demand	Anodyne	ADRB1	41	39
Cc1ncc(CCNC[C@H](O)COC(c2ccccc2)c2ccccc2)s1	ZINC000819179258	GH	On-Demand	Anodyne	CASR	16	44
Cc1ncc(CCNC[C@@H](O)COC(c2ccccc2)c2ccccc2)s1	ZINC000819179259	GH	On-Demand	Anodyne	ADRB1	41	39
Cc1ncc(CCNC[C@@H](O)COC(c2ccccc2)c2ccccc2)s1	ZINC000819179259	GH	On-Demand	Anodyne	CASR	16	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCc2ccccn2)CC1	ZINC000819179266	FF	On-Demand	Anodyne	GPR119	49	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCc2ccccn2)CC1	ZINC000819179267	FF	On-Demand	Anodyne	GPR119	49	48
Cc1ncc(CCNC[C@@H](O)COc2cc(Cl)ccc2Cl)s1	ZINC000819179272	FG	On-Demand	Anodyne	ADRB2	30	43
Cc1ncc(CCNC[C@@H](O)COc2cc(Cl)ccc2Cl)s1	ZINC000819179272	FG	On-Demand	Anodyne	ADRB1	43	37
Cc1ncc(CCNC[C@H](O)COc2cc(Cl)ccc2Cl)s1	ZINC000819179273	FG	On-Demand	Anodyne	ADRB2	30	43
Cc1ncc(CCNC[C@H](O)COc2cc(Cl)ccc2Cl)s1	ZINC000819179273	FG	On-Demand	Anodyne	ADRB1	43	37
Cc1ncc(CCNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)s1	ZINC000819179289	ED	On-Demand	Bother	ADRB2	44	52
Cc1ncc(CCNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)s1	ZINC000819179289	ED	On-Demand	Bother	ADRB1	62	52
Cc1ncc(CCNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)s1	ZINC000819179289	ED	On-Demand	Bother	ADRB3	45	52
Cc1ncc(CCNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)s1	ZINC000819179289	ED	On-Demand	Bother	CACNA1D	62	33
Cc1ncc(CCNC[C@H](O)COc2cccc([N+](=O)[O-])c2)s1	ZINC000819179290	ED	On-Demand	Bother	ADRB2	44	52
Cc1ncc(CCNC[C@H](O)COc2cccc([N+](=O)[O-])c2)s1	ZINC000819179290	ED	On-Demand	Bother	ADRB1	62	52
Cc1ncc(CCNC[C@H](O)COc2cccc([N+](=O)[O-])c2)s1	ZINC000819179290	ED	On-Demand	Bother	ADRB3	45	52
Cc1ncc(CCNC[C@H](O)COc2cccc([N+](=O)[O-])c2)s1	ZINC000819179290	ED	On-Demand	Bother	CACNA1D	62	33
O[C@@H](CNCCCc1ccccn1)c1cc(F)ccc1F	ZINC000819179305	CF	On-Demand	Anodyne	ADRB2	15	46
O[C@H](CNCCCc1ccccn1)c1cc(F)ccc1F	ZINC000819179306	CF	On-Demand	Anodyne	ADRB2	15	46
Cc1ncc(CCNC[C@@H](O)CN2CCN(C)CC2)s1	ZINC000819179307	CC	On-Demand	Anodyne	ACOX1	54	31
Cc1ncc(CCNC[C@H](O)CN2CCN(C)CC2)s1	ZINC000819179308	CC	On-Demand	Anodyne	ACOX1	54	31
O[C@@H](CNCCCc1ccccn1)c1cccc(C(F)(F)F)c1	ZINC000819179309	DG	On-Demand	Anodyne	ADRB2	23	43
O[C@@H](CNCCCc1ccccn1)c1cccc(C(F)(F)F)c1	ZINC000819179309	DG	On-Demand	Anodyne	ADRB1	28	43
O[C@@H](CNCCCc1ccccn1)c1cccc(C(F)(F)F)c1	ZINC000819179309	DG	On-Demand	Anodyne	ADRB3	42	38
O[C@H](CNCCCc1ccccn1)c1cccc(C(F)(F)F)c1	ZINC000819179310	DG	On-Demand	Anodyne	ADRB2	23	43
O[C@H](CNCCCc1ccccn1)c1cccc(C(F)(F)F)c1	ZINC000819179310	DG	On-Demand	Anodyne	ADRB1	28	43
O[C@H](CNCCCc1ccccn1)c1cccc(C(F)(F)F)c1	ZINC000819179310	DG	On-Demand	Anodyne	ADRB3	42	38
Cc1ncc(CCNC[C@@H](O)COc2c(Cl)cccc2Cl)s1	ZINC000819179327	FG	On-Demand	Anodyne	ADRB2	40	43
Cc1ncc(CCNC[C@@H](O)COc2c(Cl)cccc2Cl)s1	ZINC000819179327	FG	On-Demand	Anodyne	ADRB1	50	38
Cc1ncc(CCNC[C@H](O)COc2c(Cl)cccc2Cl)s1	ZINC000819179328	FG	On-Demand	Anodyne	ADRB2	40	43
Cc1ncc(CCNC[C@H](O)COc2c(Cl)cccc2Cl)s1	ZINC000819179328	FG	On-Demand	Anodyne	ADRB1	50	38
Cc1ncc(CCNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000819179329	FF	On-Demand	Anodyne	GPR119	56	41
Cc1ncc(CCNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000819179330	FF	On-Demand	Anodyne	GPR119	56	41
O[C@@H](CNCCCc1ccccn1)c1ccc(F)c(Br)c1	ZINC000819179337	FG	On-Demand	Anodyne	ADRB2	29	43
O[C@@H](CNCCCc1ccccn1)c1ccc(F)c(Br)c1	ZINC000819179337	FG	On-Demand	Anodyne	ADRB1	20	43
O[C@H](CNCCCc1ccccn1)c1ccc(F)c(Br)c1	ZINC000819179338	FG	On-Demand	Anodyne	ADRB2	29	43
O[C@H](CNCCCc1ccccn1)c1ccc(F)c(Br)c1	ZINC000819179338	FG	On-Demand	Anodyne	ADRB1	20	43
O[C@@H](CNCCCc1ccccn1)c1ccc(F)cc1F	ZINC000819179358	CF	On-Demand	Anodyne	ADRB2	27	48
O[C@@H](CNCCCc1ccccn1)c1ccc(F)cc1F	ZINC000819179358	CF	On-Demand	Anodyne	ADRB1	20	48
O[C@H](CNCCCc1ccccn1)c1ccc(F)cc1F	ZINC000819179359	CF	On-Demand	Anodyne	ADRB2	27	48
O[C@H](CNCCCc1ccccn1)c1ccc(F)cc1F	ZINC000819179359	CF	On-Demand	Anodyne	ADRB1	20	48
O[C@@H](CNCCCc1ccccn1)c1cccc(Cl)c1	ZINC000819179360	CF	On-Demand	Anodyne	ADRB2	62	46
O[C@@H](CNCCCc1ccccn1)c1cccc(Cl)c1	ZINC000819179360	CF	On-Demand	Anodyne	ADRB1	72	48
O[C@@H](CNCCCc1ccccn1)c1cccc(Cl)c1	ZINC000819179360	CF	On-Demand	Anodyne	ADRB3	91	51
O[C@H](CNCCCc1ccccn1)c1cccc(Cl)c1	ZINC000819179361	CF	On-Demand	Anodyne	ADRB2	62	46
O[C@H](CNCCCc1ccccn1)c1cccc(Cl)c1	ZINC000819179361	CF	On-Demand	Anodyne	ADRB1	72	48
O[C@H](CNCCCc1ccccn1)c1cccc(Cl)c1	ZINC000819179361	CF	On-Demand	Anodyne	ADRB3	91	51
Cc1ncc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819179362	DE	On-Demand	Bother	ADRB3	76	38
Cc1ncc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819179362	DE	On-Demand	Bother	CACNA1D	56	32
Cc1ncc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819179363	DE	On-Demand	Bother	ADRB3	76	38
Cc1ncc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819179363	DE	On-Demand	Bother	CACNA1D	56	32
Cc1ncc(CCNC[C@@H](O)COc2cccc(Br)c2)s1	ZINC000819179379	FF	On-Demand	Anodyne	ADRB2	52	45
Cc1ncc(CCNC[C@@H](O)COc2cccc(Br)c2)s1	ZINC000819179379	FF	On-Demand	Anodyne	ADRB1	65	43
Cc1ncc(CCNC[C@@H](O)COc2cccc(Br)c2)s1	ZINC000819179379	FF	On-Demand	Anodyne	ADRB3	49	43
Cc1ncc(CCNC[C@@H](O)COc2cccc(Br)c2)s1	ZINC000819179379	FF	On-Demand	Anodyne	ACOX1	43	31
Cc1ncc(CCNC[C@H](O)COc2cccc(Br)c2)s1	ZINC000819179380	FF	On-Demand	Anodyne	ADRB2	52	45
Cc1ncc(CCNC[C@H](O)COc2cccc(Br)c2)s1	ZINC000819179380	FF	On-Demand	Anodyne	ADRB1	65	43
Cc1ncc(CCNC[C@H](O)COc2cccc(Br)c2)s1	ZINC000819179380	FF	On-Demand	Anodyne	ADRB3	49	43
Cc1ncc(CCNC[C@H](O)COc2cccc(Br)c2)s1	ZINC000819179380	FF	On-Demand	Anodyne	ACOX1	43	31
CCCOc1cccc(CCNC[C@H](O)C2CC2)c1	ZINC000819179384	CE	On-Demand	Anodyne	ADRB2	37	46
CCCOc1cccc(CCNC[C@H](O)C2CC2)c1	ZINC000819179384	CE	On-Demand	Anodyne	ADRB1	53	46
CCCOc1cccc(CCNC[C@H](O)C2CC2)c1	ZINC000819179384	CE	On-Demand	Anodyne	ADRB3	43	37
CCCOc1cccc(CCNC[C@@H](O)C2CC2)c1	ZINC000819179385	CE	On-Demand	Anodyne	ADRB2	37	46
CCCOc1cccc(CCNC[C@@H](O)C2CC2)c1	ZINC000819179385	CE	On-Demand	Anodyne	ADRB1	53	46
CCCOc1cccc(CCNC[C@@H](O)C2CC2)c1	ZINC000819179385	CE	On-Demand	Anodyne	ADRB3	43	37
O=S(=O)(NCCNC[C@H](O)c1cc(F)ccc1F)c1cccnc1	ZINC000819179395	FC	On-Demand	Anodyne	ADRB2	21	40
O=S(=O)(NCCNC[C@H](O)c1cc(F)ccc1F)c1cccnc1	ZINC000819179395	FC	On-Demand	Anodyne	ADRB1	22	40
O=S(=O)(NCCNC[C@H](O)c1cc(F)ccc1F)c1cccnc1	ZINC000819179395	FC	On-Demand	Anodyne	ADRB3	84	42
O=S(=O)(NCCNC[C@H](O)c1cc(F)ccc1F)c1cccnc1	ZINC000819179395	FC	On-Demand	Anodyne	TBXAS1	44	41
O=S(=O)(NCCNC[C@@H](O)c1cc(F)ccc1F)c1cccnc1	ZINC000819179397	FC	On-Demand	Anodyne	ADRB2	21	40
O=S(=O)(NCCNC[C@@H](O)c1cc(F)ccc1F)c1cccnc1	ZINC000819179397	FC	On-Demand	Anodyne	ADRB1	22	40
O=S(=O)(NCCNC[C@@H](O)c1cc(F)ccc1F)c1cccnc1	ZINC000819179397	FC	On-Demand	Anodyne	ADRB3	84	42
O=S(=O)(NCCNC[C@@H](O)c1cc(F)ccc1F)c1cccnc1	ZINC000819179397	FC	On-Demand	Anodyne	TBXAS1	44	41
CN(C)c1ccc(NC(=O)CCNCC2(Cc3ccccc3)CC2)cc1	ZINC000819179426	FH	On-Demand	Anodyne	TIMP3	42	40
Cc1ncc(CCNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)s1	ZINC000819179428	FG	On-Demand	Anodyne	ADRB2	54	46
Cc1ncc(CCNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)s1	ZINC000819179428	FG	On-Demand	Anodyne	ADRB1	75	46
Cc1ncc(CCNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)s1	ZINC000819179428	FG	On-Demand	Anodyne	GRIN1	31	55
Cc1ncc(CCNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)s1	ZINC000819179428	FG	On-Demand	Anodyne	ADRB3	53	46
Cc1ncc(CCNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)s1	ZINC000819179428	FG	On-Demand	Anodyne	ACOX1	69	37
Cc1ncc(CCNC[C@H](O)COc2ccc(Cl)c(Cl)c2)s1	ZINC000819179429	FG	On-Demand	Anodyne	ADRB2	54	46
Cc1ncc(CCNC[C@H](O)COc2ccc(Cl)c(Cl)c2)s1	ZINC000819179429	FG	On-Demand	Anodyne	ADRB1	75	46
Cc1ncc(CCNC[C@H](O)COc2ccc(Cl)c(Cl)c2)s1	ZINC000819179429	FG	On-Demand	Anodyne	GRIN1	31	55
Cc1ncc(CCNC[C@H](O)COc2ccc(Cl)c(Cl)c2)s1	ZINC000819179429	FG	On-Demand	Anodyne	ADRB3	53	46
Cc1ncc(CCNC[C@H](O)COc2ccc(Cl)c(Cl)c2)s1	ZINC000819179429	FG	On-Demand	Anodyne	ACOX1	69	37
Cc1ncc(CCNCCC(=O)Nc2cccnc2)s1	ZINC000819179463	CE	On-Demand	Anodyne	ADRB3	24	40
Cc1ncc(CCNC[C@H](O)c2cccc(Cl)c2)s1	ZINC000819179473	CF	On-Demand	Anodyne	ADRB2	50	40
Cc1ncc(CCNC[C@H](O)c2cccc(Cl)c2)s1	ZINC000819179473	CF	On-Demand	Anodyne	ADRB1	67	52
Cc1ncc(CCNC[C@H](O)c2cccc(Cl)c2)s1	ZINC000819179473	CF	On-Demand	Anodyne	ADRB3	100	52
Cc1ncc(CCNC[C@@H](O)c2cccc(Cl)c2)s1	ZINC000819179474	CF	On-Demand	Anodyne	ADRB2	50	40
Cc1ncc(CCNC[C@@H](O)c2cccc(Cl)c2)s1	ZINC000819179474	CF	On-Demand	Anodyne	ADRB1	67	52
Cc1ncc(CCNC[C@@H](O)c2cccc(Cl)c2)s1	ZINC000819179474	CF	On-Demand	Anodyne	ADRB3	100	52
O[C@@H](CNCCc1cc(Cl)ccc1Br)c1cccnc1	ZINC000819179492	FG	On-Demand	Anodyne	ADRB2	39	49
O[C@@H](CNCCc1cc(Cl)ccc1Br)c1cccnc1	ZINC000819179492	FG	On-Demand	Anodyne	ADRB1	51	49
O[C@@H](CNCCc1cc(Cl)ccc1Br)c1cccnc1	ZINC000819179492	FG	On-Demand	Anodyne	ADRB3	133	53
O[C@H](CNCCc1cc(Cl)ccc1Br)c1cccnc1	ZINC000819179493	FG	On-Demand	Anodyne	ADRB2	39	49
O[C@H](CNCCc1cc(Cl)ccc1Br)c1cccnc1	ZINC000819179493	FG	On-Demand	Anodyne	ADRB1	51	49
O[C@H](CNCCc1cc(Cl)ccc1Br)c1cccnc1	ZINC000819179493	FG	On-Demand	Anodyne	ADRB3	133	53
O=S(=O)(NCCNC[C@@H](O)c1ccccc1C(F)(F)F)c1cccnc1	ZINC000819179586	GD	On-Demand	Anodyne	ADRB2	23	40
O=S(=O)(NCCNC[C@@H](O)c1ccccc1C(F)(F)F)c1cccnc1	ZINC000819179586	GD	On-Demand	Anodyne	ADRB3	91	45
O=S(=O)(NCCNC[C@H](O)c1cccc(C(F)(F)F)c1)c1cccnc1	ZINC000819179645	GD	On-Demand	Anodyne	ADRB2	31	50
O=S(=O)(NCCNC[C@H](O)c1cccc(C(F)(F)F)c1)c1cccnc1	ZINC000819179645	GD	On-Demand	Anodyne	ADRB1	40	41
O=S(=O)(NCCNC[C@H](O)c1cccc(C(F)(F)F)c1)c1cccnc1	ZINC000819179645	GD	On-Demand	Anodyne	ADRB3	119	50
O=S(=O)(NCCNC[C@H](O)c1cccc(C(F)(F)F)c1)c1cccnc1	ZINC000819179645	GD	On-Demand	Anodyne	TBXAS1	32	40
O=S(=O)(NCCNC[C@@H](O)c1cccc(C(F)(F)F)c1)c1cccnc1	ZINC000819179647	GD	On-Demand	Anodyne	ADRB2	31	50
O=S(=O)(NCCNC[C@@H](O)c1cccc(C(F)(F)F)c1)c1cccnc1	ZINC000819179647	GD	On-Demand	Anodyne	ADRB1	40	41
O=S(=O)(NCCNC[C@@H](O)c1cccc(C(F)(F)F)c1)c1cccnc1	ZINC000819179647	GD	On-Demand	Anodyne	ADRB3	119	50
O=S(=O)(NCCNC[C@@H](O)c1cccc(C(F)(F)F)c1)c1cccnc1	ZINC000819179647	GD	On-Demand	Anodyne	TBXAS1	32	40
O=S(=O)(NCCNC[C@H](O)c1cccc(F)c1)c1cccnc1	ZINC000819179675	EC	On-Demand	Anodyne	ADRB2	34	48
O=S(=O)(NCCNC[C@H](O)c1cccc(F)c1)c1cccnc1	ZINC000819179675	EC	On-Demand	Anodyne	ADRB1	45	44
O=S(=O)(NCCNC[C@H](O)c1cccc(F)c1)c1cccnc1	ZINC000819179675	EC	On-Demand	Anodyne	ADRB3	130	49
O=S(=O)(NCCNC[C@@H](O)c1cccc(F)c1)c1cccnc1	ZINC000819179676	EC	On-Demand	Anodyne	ADRB2	34	48
O=S(=O)(NCCNC[C@@H](O)c1cccc(F)c1)c1cccnc1	ZINC000819179676	EC	On-Demand	Anodyne	ADRB1	45	44
O=S(=O)(NCCNC[C@@H](O)c1cccc(F)c1)c1cccnc1	ZINC000819179676	EC	On-Demand	Anodyne	ADRB3	130	49
O=S(=O)(NCCNC[C@H](O)c1ccc(F)cc1F)c1cccnc1	ZINC000819179680	FC	On-Demand	Anodyne	ADRB2	23	40
O=S(=O)(NCCNC[C@H](O)c1ccc(F)cc1F)c1cccnc1	ZINC000819179680	FC	On-Demand	Anodyne	ADRB1	24	40
O=S(=O)(NCCNC[C@H](O)c1ccc(F)cc1F)c1cccnc1	ZINC000819179680	FC	On-Demand	Anodyne	ADRB3	84	43
O=S(=O)(NCCNC[C@H](O)c1ccc(F)cc1F)c1cccnc1	ZINC000819179680	FC	On-Demand	Anodyne	TBXAS1	41	41
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)cc1F)c1cccnc1	ZINC000819179682	FC	On-Demand	Anodyne	ADRB2	23	40
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)cc1F)c1cccnc1	ZINC000819179682	FC	On-Demand	Anodyne	ADRB1	24	40
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)cc1F)c1cccnc1	ZINC000819179682	FC	On-Demand	Anodyne	ADRB3	84	43
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)cc1F)c1cccnc1	ZINC000819179682	FC	On-Demand	Anodyne	TBXAS1	41	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cc(Cl)ccc2Br)c1	ZINC000819179683	GH	On-Demand	Bother	ADRB1	35	46
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cc(Cl)ccc2Br)c1	ZINC000819179683	GH	On-Demand	Bother	ADRB3	53	46
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cc(Cl)ccc2Br)c1	ZINC000819179684	GH	On-Demand	Bother	ADRB1	35	46
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cc(Cl)ccc2Br)c1	ZINC000819179684	GH	On-Demand	Bother	ADRB3	53	46
CCCOc1cccc(CCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819179687	DF	On-Demand	Anodyne	ADRB2	40	47
CCCOc1cccc(CCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819179687	DF	On-Demand	Anodyne	ADRB1	53	47
CCCOc1cccc(CCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819179687	DF	On-Demand	Anodyne	ADRB3	72	43
CCCOc1cccc(CCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819179692	DF	On-Demand	Anodyne	ADRB2	40	47
CCCOc1cccc(CCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819179692	DF	On-Demand	Anodyne	ADRB1	53	47
CCCOc1cccc(CCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819179692	DF	On-Demand	Anodyne	ADRB3	72	43
O[C@@H](CNCC1(Cc2ccccc2)CC1)c1cccnc1	ZINC000819179697	CF	On-Demand	Anodyne	ADRB2	23	48
O[C@@H](CNCC1(Cc2ccccc2)CC1)c1cccnc1	ZINC000819179697	CF	On-Demand	Anodyne	ADRB1	24	43
O[C@@H](CNCC1(Cc2ccccc2)CC1)c1cccnc1	ZINC000819179697	CF	On-Demand	Anodyne	ADRB3	94	49
O[C@H](CNCC1(Cc2ccccc2)CC1)c1cccnc1	ZINC000819179698	CF	On-Demand	Anodyne	ADRB2	23	48
O[C@H](CNCC1(Cc2ccccc2)CC1)c1cccnc1	ZINC000819179698	CF	On-Demand	Anodyne	ADRB1	24	43
O[C@H](CNCC1(Cc2ccccc2)CC1)c1cccnc1	ZINC000819179698	CF	On-Demand	Anodyne	ADRB3	94	49
C[C@@H]1NC(=O)N(Cc2cc(O[C@@H]3CCN(C(=O)OC(C)(C)C)C3)ccn2)C1=O	ZINC000819179704	GD	On-Demand	Anodyne	GPR119	45	41
C[C@@H]1NC(=O)N(Cc2cc(O[C@H]3CCN(C(=O)OC(C)(C)C)C3)ccn2)C1=O	ZINC000819179705	GD	On-Demand	Anodyne	GPR119	45	41
Cc1ncc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)s1	ZINC000819179712	EG	On-Demand	Anodyne	ADRB2	23	40
Cc1ncc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)s1	ZINC000819179712	EG	On-Demand	Anodyne	ADRB3	59	39
Cc1ncc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)s1	ZINC000819179713	EG	On-Demand	Anodyne	ADRB2	23	40
Cc1ncc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)s1	ZINC000819179713	EG	On-Demand	Anodyne	ADRB3	59	39
O[C@@H](CN[C@@H]1CCOC2(CCSCC2)C1)c1cccc(Cl)c1	ZINC000819179716	EG	On-Demand	Anodyne	ADRB1	26	40
O[C@@H](CN[C@@H]1CCOC2(CCSCC2)C1)c1cccc(Cl)c1	ZINC000819179716	EG	On-Demand	Anodyne	ADRB3	41	46
O[C@@H](CN[C@H]1CCOC2(CCSCC2)C1)c1cccc(Cl)c1	ZINC000819179717	EG	On-Demand	Anodyne	ADRB1	26	40
O[C@@H](CN[C@H]1CCOC2(CCSCC2)C1)c1cccc(Cl)c1	ZINC000819179717	EG	On-Demand	Anodyne	ADRB3	41	46
O[C@H](CN[C@@H]1CCOC2(CCSCC2)C1)c1cccc(Cl)c1	ZINC000819179718	EG	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CN[C@@H]1CCOC2(CCSCC2)C1)c1cccc(Cl)c1	ZINC000819179718	EG	On-Demand	Anodyne	ADRB3	41	46
O[C@H](CN[C@H]1CCOC2(CCSCC2)C1)c1cccc(Cl)c1	ZINC000819179719	EG	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CN[C@H]1CCOC2(CCSCC2)C1)c1cccc(Cl)c1	ZINC000819179719	EG	On-Demand	Anodyne	ADRB3	41	46
CCCOc1cccc(CCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819179720	EH	On-Demand	Anodyne	ADRB2	80	54
CCCOc1cccc(CCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819179720	EH	On-Demand	Anodyne	ADRB1	80	54
CCCOc1cccc(CCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819179720	EH	On-Demand	Anodyne	ADRB3	62	47
CCCOc1cccc(CCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819179721	EH	On-Demand	Anodyne	ADRB2	80	54
CCCOc1cccc(CCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819179721	EH	On-Demand	Anodyne	ADRB1	80	54
CCCOc1cccc(CCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819179721	EH	On-Demand	Anodyne	ADRB3	62	47
Cc1ncc(CCNC[C@H](O)COc2ccc(Oc3ccccc3)cc2)s1	ZINC000819179731	GH	On-Demand	Anodyne	ADRB2	74	50
Cc1ncc(CCNC[C@H](O)COc2ccc(Oc3ccccc3)cc2)s1	ZINC000819179731	GH	On-Demand	Anodyne	ADRB1	107	51
Cc1ncc(CCNC[C@H](O)COc2ccc(Oc3ccccc3)cc2)s1	ZINC000819179731	GH	On-Demand	Anodyne	ADRB3	80	51
Cc1ncc(CCNC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)s1	ZINC000819179732	GH	On-Demand	Anodyne	ADRB2	74	50
Cc1ncc(CCNC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)s1	ZINC000819179732	GH	On-Demand	Anodyne	ADRB1	107	51
Cc1ncc(CCNC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)s1	ZINC000819179732	GH	On-Demand	Anodyne	ADRB3	80	51
O=C(CCCc1ccccc1)NCCN1C(=O)N[C@H](c2cccnc2)C1=O	ZINC000819179737	FD	On-Demand	Anodyne	TBXAS1	53	39
O=C(CCCc1ccccc1)NCCN1C(=O)N[C@H](c2cccnc2)C1=O	ZINC000819179737	FD	On-Demand	Anodyne	PTAFR	37	46
O=C(CCCc1ccccc1)NCCN1C(=O)N[C@H](c2cccnc2)C1=O	ZINC000819179737	FD	On-Demand	Anodyne	PREP	45	35
O=C(CCCc1ccccc1)NCCN1C(=O)N[C@@H](c2cccnc2)C1=O	ZINC000819179738	FD	On-Demand	Anodyne	TBXAS1	53	39
O=C(CCCc1ccccc1)NCCN1C(=O)N[C@@H](c2cccnc2)C1=O	ZINC000819179738	FD	On-Demand	Anodyne	PTAFR	37	46
O=C(CCCc1ccccc1)NCCN1C(=O)N[C@@H](c2cccnc2)C1=O	ZINC000819179738	FD	On-Demand	Anodyne	PREP	45	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](CN1C(=O)N[C@H](c3ccc(Cl)cc3)C1=O)C2	ZINC000819179762	GF	On-Demand	Anodyne	SLC6A3	25	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](CN1C(=O)N[C@@H](c3ccc(Cl)cc3)C1=O)C2	ZINC000819179763	GF	On-Demand	Anodyne	SLC6A3	25	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CN1C(=O)N[C@H](c3ccc(Cl)cc3)C1=O)C2	ZINC000819179764	GF	On-Demand	Anodyne	SLC6A3	25	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CN1C(=O)N[C@@H](c3ccc(Cl)cc3)C1=O)C2	ZINC000819179765	GF	On-Demand	Anodyne	SLC6A3	25	40
Cc1ncc(CCNC[C@@H](O)COc2ccccc2F)s1	ZINC000819179768	DE	On-Demand	Anodyne	ADRB2	50	45
Cc1ncc(CCNC[C@@H](O)COc2ccccc2F)s1	ZINC000819179768	DE	On-Demand	Anodyne	ADRB1	69	41
Cc1ncc(CCNC[C@@H](O)COc2ccccc2F)s1	ZINC000819179768	DE	On-Demand	Anodyne	ADRB3	41	41
Cc1ncc(CCNC[C@H](O)COc2ccccc2F)s1	ZINC000819179769	DE	On-Demand	Anodyne	ADRB2	50	45
Cc1ncc(CCNC[C@H](O)COc2ccccc2F)s1	ZINC000819179769	DE	On-Demand	Anodyne	ADRB1	69	41
Cc1ncc(CCNC[C@H](O)COc2ccccc2F)s1	ZINC000819179769	DE	On-Demand	Anodyne	ADRB3	41	41
O[C@@H](CNCCCc1ccccn1)c1cccnc1	ZINC000819179772	CD	On-Demand	Anodyne	ADRB2	37	51
O[C@@H](CNCCCc1ccccn1)c1cccnc1	ZINC000819179772	CD	On-Demand	Anodyne	ADRB1	41	47
O[C@@H](CNCCCc1ccccn1)c1cccnc1	ZINC000819179772	CD	On-Demand	Anodyne	ADRB3	118	51
O[C@H](CNCCCc1ccccn1)c1cccnc1	ZINC000819179773	CD	On-Demand	Anodyne	ADRB2	37	51
O[C@H](CNCCCc1ccccn1)c1cccnc1	ZINC000819179773	CD	On-Demand	Anodyne	ADRB1	41	47
O[C@H](CNCCCc1ccccn1)c1cccnc1	ZINC000819179773	CD	On-Demand	Anodyne	ADRB3	118	51
Cc1cc(F)ccc1[C@@H](O)CNCCCc1ccccn1	ZINC000819179781	CF	On-Demand	Anodyne	ADRB2	27	47
Cc1cc(F)ccc1[C@@H](O)CNCCCc1ccccn1	ZINC000819179781	CF	On-Demand	Anodyne	ADRB1	20	47
Cc1ncc(CCNC[C@H](O)COc2ccc(-c3ccccc3)cc2)s1	ZINC000819179792	FH	On-Demand	Anodyne	ADRB2	75	49
Cc1ncc(CCNC[C@H](O)COc2ccc(-c3ccccc3)cc2)s1	ZINC000819179792	FH	On-Demand	Anodyne	ADRB1	107	49
Cc1ncc(CCNC[C@H](O)COc2ccc(-c3ccccc3)cc2)s1	ZINC000819179792	FH	On-Demand	Anodyne	ADRB3	83	49
Cc1ncc(CCNC[C@H](O)COc2ccc(-c3ccccc3)cc2)s1	ZINC000819179792	FH	On-Demand	Anodyne	ACOX1	58	38
Cc1ncc(CCNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)s1	ZINC000819179793	FH	On-Demand	Anodyne	ADRB2	75	49
Cc1ncc(CCNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)s1	ZINC000819179793	FH	On-Demand	Anodyne	ADRB1	107	49
Cc1ncc(CCNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)s1	ZINC000819179793	FH	On-Demand	Anodyne	ADRB3	83	49
Cc1ncc(CCNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)s1	ZINC000819179793	FH	On-Demand	Anodyne	ACOX1	58	38
CN(CCNC[C@@H](O)c1cccnc1)S(=O)(=O)c1cccs1	ZINC000819179804	ED	On-Demand	Anodyne	ADRB2	31	42
CN(CCNC[C@@H](O)c1cccnc1)S(=O)(=O)c1cccs1	ZINC000819179804	ED	On-Demand	Anodyne	ADRB1	32	41
CN(CCNC[C@@H](O)c1cccnc1)S(=O)(=O)c1cccs1	ZINC000819179804	ED	On-Demand	Anodyne	ADRB3	109	52
CN(CCNC[C@H](O)c1cccnc1)S(=O)(=O)c1cccs1	ZINC000819179805	ED	On-Demand	Anodyne	ADRB2	31	42
CN(CCNC[C@H](O)c1cccnc1)S(=O)(=O)c1cccs1	ZINC000819179805	ED	On-Demand	Anodyne	ADRB1	32	41
CN(CCNC[C@H](O)c1cccnc1)S(=O)(=O)c1cccs1	ZINC000819179805	ED	On-Demand	Anodyne	ADRB3	109	52
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2(Cc3ccccc3)CC2)CC1	ZINC000819179812	GH	On-Demand	Anodyne	GPR119	42	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2(Cc3ccccc3)CC2)CC1	ZINC000819179812	GH	On-Demand	Anodyne	SFRP1	19	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2(Cc3ccccc3)CC2)CC1	ZINC000819179812	GH	On-Demand	Anodyne	SLC12A5	48	35
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2(Cc3ccccc3)CC2)CC1	ZINC000819179813	GH	On-Demand	Anodyne	GPR119	42	48
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2(Cc3ccccc3)CC2)CC1	ZINC000819179813	GH	On-Demand	Anodyne	SFRP1	19	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2(Cc3ccccc3)CC2)CC1	ZINC000819179813	GH	On-Demand	Anodyne	SLC12A5	48	35
CS(=O)(=O)c1ccc([C@@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819179822	GC	On-Demand	Anodyne	ADRB2	32	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819179822	GC	On-Demand	Anodyne	ADRB1	35	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819179822	GC	On-Demand	Anodyne	ADRB3	120	50
CS(=O)(=O)c1ccc([C@@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819179822	GC	On-Demand	Anodyne	TBXA2R	22	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819179822	GC	On-Demand	Anodyne	TBXAS1	48	47
CS(=O)(=O)c1ccc([C@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819179823	GC	On-Demand	Anodyne	ADRB2	32	44
CS(=O)(=O)c1ccc([C@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819179823	GC	On-Demand	Anodyne	ADRB1	35	42
CS(=O)(=O)c1ccc([C@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819179823	GC	On-Demand	Anodyne	ADRB3	120	50
CS(=O)(=O)c1ccc([C@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819179823	GC	On-Demand	Anodyne	TBXA2R	22	41
CS(=O)(=O)c1ccc([C@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819179823	GC	On-Demand	Anodyne	TBXAS1	48	47
Cc1cc(F)ccc1[C@@H](O)CNCCNS(=O)(=O)c1cccnc1	ZINC000819179853	FD	On-Demand	Anodyne	ADRB3	80	39
Cc1cc(F)ccc1[C@@H](O)CNCCNS(=O)(=O)c1cccnc1	ZINC000819179853	FD	On-Demand	Anodyne	TBXAS1	40	40
CS(=O)(=O)c1ccc([C@@H](O)CNCC2(Cc3ccccc3)CC2)cc1	ZINC000819179876	FF	On-Demand	Anodyne	ADRB3	39	43
CS(=O)(=O)c1ccc([C@H](O)CNCC2(Cc3ccccc3)CC2)cc1	ZINC000819179877	FF	On-Demand	Anodyne	ADRB3	39	43
O=S(=O)(NCCNC[C@H](O)c1ccc(F)c(F)c1)c1cccnc1	ZINC000819179880	FC	On-Demand	Anodyne	ADRB2	35	46
O=S(=O)(NCCNC[C@H](O)c1ccc(F)c(F)c1)c1cccnc1	ZINC000819179880	FC	On-Demand	Anodyne	ADRB1	37	43
O=S(=O)(NCCNC[C@H](O)c1ccc(F)c(F)c1)c1cccnc1	ZINC000819179880	FC	On-Demand	Anodyne	ADRB3	114	47
O=S(=O)(NCCNC[C@H](O)c1ccc(F)c(F)c1)c1cccnc1	ZINC000819179880	FC	On-Demand	Anodyne	TBXAS1	42	39
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)c(F)c1)c1cccnc1	ZINC000819179881	FC	On-Demand	Anodyne	ADRB2	35	46
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)c(F)c1)c1cccnc1	ZINC000819179881	FC	On-Demand	Anodyne	ADRB1	37	43
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)c(F)c1)c1cccnc1	ZINC000819179881	FC	On-Demand	Anodyne	ADRB3	114	47
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)c(F)c1)c1cccnc1	ZINC000819179881	FC	On-Demand	Anodyne	TBXAS1	42	39
O=[N+]([O-])c1ccc([C@@H](O)CNCCCc2ccccn2)cc1	ZINC000819179958	DE	On-Demand	Bother	ADRB2	19	43
O=[N+]([O-])c1ccc([C@@H](O)CNCCCc2ccccn2)cc1	ZINC000819179958	DE	On-Demand	Bother	ADRB1	16	43
O=[N+]([O-])c1ccc([C@H](O)CNCCCc2ccccn2)cc1	ZINC000819179959	DE	On-Demand	Bother	ADRB2	19	43
O=[N+]([O-])c1ccc([C@H](O)CNCCCc2ccccn2)cc1	ZINC000819179959	DE	On-Demand	Bother	ADRB1	16	43
O=S(=O)(NCCNC[C@H](O)c1cccc(Cl)c1)c1cccnc1	ZINC000819179961	FD	On-Demand	Anodyne	ADRB2	46	45
O=S(=O)(NCCNC[C@H](O)c1cccc(Cl)c1)c1cccnc1	ZINC000819179961	FD	On-Demand	Anodyne	ADRB1	69	45
O=S(=O)(NCCNC[C@H](O)c1cccc(Cl)c1)c1cccnc1	ZINC000819179961	FD	On-Demand	Anodyne	ADRB3	160	52
O=S(=O)(NCCNC[C@H](O)c1cccc(Cl)c1)c1cccnc1	ZINC000819179961	FD	On-Demand	Anodyne	TBXA2R	25	41
O=S(=O)(NCCNC[C@H](O)c1cccc(Cl)c1)c1cccnc1	ZINC000819179961	FD	On-Demand	Anodyne	TBXAS1	44	43
O=S(=O)(NCCNC[C@@H](O)c1cccc(Cl)c1)c1cccnc1	ZINC000819179962	FD	On-Demand	Anodyne	ADRB2	46	45
O=S(=O)(NCCNC[C@@H](O)c1cccc(Cl)c1)c1cccnc1	ZINC000819179962	FD	On-Demand	Anodyne	ADRB1	69	45
O=S(=O)(NCCNC[C@@H](O)c1cccc(Cl)c1)c1cccnc1	ZINC000819179962	FD	On-Demand	Anodyne	ADRB3	160	52
O=S(=O)(NCCNC[C@@H](O)c1cccc(Cl)c1)c1cccnc1	ZINC000819179962	FD	On-Demand	Anodyne	TBXA2R	25	41
O=S(=O)(NCCNC[C@@H](O)c1cccc(Cl)c1)c1cccnc1	ZINC000819179962	FD	On-Demand	Anodyne	TBXAS1	44	43
CCCOc1cccc(CCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819179995	DG	On-Demand	Mild	ADRB2	71	55
CCCOc1cccc(CCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819179995	DG	On-Demand	Mild	ADRB1	89	49
CCCOc1cccc(CCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819179995	DG	On-Demand	Mild	ADRB3	92	45
CCCOc1cccc(CCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819179999	DG	On-Demand	Mild	ADRB2	71	55
CCCOc1cccc(CCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819179999	DG	On-Demand	Mild	ADRB1	89	49
CCCOc1cccc(CCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819179999	DG	On-Demand	Mild	ADRB3	92	45
N#Cc1ccc([C@@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819180010	EC	On-Demand	Mild	ADRB2	28	41
N#Cc1ccc([C@@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819180010	EC	On-Demand	Mild	ADRB3	98	47
O[C@@H](CNCCCc1ccccn1)c1ccc(Br)cc1	ZINC000819180011	EG	On-Demand	Anodyne	ADRB2	27	44
O[C@@H](CNCCCc1ccccn1)c1ccc(Br)cc1	ZINC000819180011	EG	On-Demand	Anodyne	ADRB1	16	44
N#Cc1ccc([C@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819180012	EC	On-Demand	Mild	ADRB2	28	41
N#Cc1ccc([C@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819180012	EC	On-Demand	Mild	ADRB3	98	47
O[C@H](CNCCCc1ccccn1)c1ccc(Br)cc1	ZINC000819180015	EG	On-Demand	Anodyne	ADRB2	27	44
O[C@H](CNCCCc1ccccn1)c1ccc(Br)cc1	ZINC000819180015	EG	On-Demand	Anodyne	ADRB1	16	44
Cc1ncc(CCNC[C@H](O)c2cccc(Br)c2)s1	ZINC000819180020	EG	On-Demand	Anodyne	ADRB3	67	38
Cc1ncc(CCNC[C@@H](O)c2cccc(Br)c2)s1	ZINC000819180023	EG	On-Demand	Anodyne	ADRB3	67	38
O=C(CCCc1ccccc1)NCCN1C(=O)N[C@H](c2ccccn2)C1=O	ZINC000819180051	FD	On-Demand	Anodyne	CYSLTR2	40	31
O=C(CCCc1ccccc1)NCCN1C(=O)N[C@H](c2ccccn2)C1=O	ZINC000819180051	FD	On-Demand	Anodyne	PREP	46	41
O=C(CCCc1ccccc1)NCCN1C(=O)N[C@H](c2ccccn2)C1=O	ZINC000819180051	FD	On-Demand	Anodyne	FAAH	59	39
O=C(CCCc1ccccc1)NCCN1C(=O)N[C@H](c2ccccn2)C1=O	ZINC000819180051	FD	On-Demand	Anodyne	CES1	47	39
O=C(CCCc1ccccc1)NCCN1C(=O)N[C@H](c2ccccn2)C1=O	ZINC000819180051	FD	On-Demand	Anodyne	CES1D	55	32
O=C(CCCc1ccccc1)NCCN1C(=O)N[C@@H](c2ccccn2)C1=O	ZINC000819180056	FD	On-Demand	Anodyne	CYSLTR2	40	31
O=C(CCCc1ccccc1)NCCN1C(=O)N[C@@H](c2ccccn2)C1=O	ZINC000819180056	FD	On-Demand	Anodyne	PREP	46	41
O=C(CCCc1ccccc1)NCCN1C(=O)N[C@@H](c2ccccn2)C1=O	ZINC000819180056	FD	On-Demand	Anodyne	FAAH	59	39
O=C(CCCc1ccccc1)NCCN1C(=O)N[C@@H](c2ccccn2)C1=O	ZINC000819180056	FD	On-Demand	Anodyne	CES1	47	39
O=C(CCCc1ccccc1)NCCN1C(=O)N[C@@H](c2ccccn2)C1=O	ZINC000819180056	FD	On-Demand	Anodyne	CES1D	55	32
O=S(=O)(NCCNC[C@H](O)c1ccccc1F)c1cccnc1	ZINC000819180058	EC	On-Demand	Anodyne	ADRB2	23	40
O=S(=O)(NCCNC[C@H](O)c1ccccc1F)c1cccnc1	ZINC000819180058	EC	On-Demand	Anodyne	ADRB3	86	46
O=S(=O)(NCCNC[C@H](O)c1ccccc1F)c1cccnc1	ZINC000819180058	EC	On-Demand	Anodyne	TBXAS1	41	39
O=S(=O)(NCCNC[C@@H](O)c1ccccc1F)c1cccnc1	ZINC000819180060	EC	On-Demand	Anodyne	ADRB2	23	40
O=S(=O)(NCCNC[C@@H](O)c1ccccc1F)c1cccnc1	ZINC000819180060	EC	On-Demand	Anodyne	ADRB3	86	46
O=S(=O)(NCCNC[C@@H](O)c1ccccc1F)c1cccnc1	ZINC000819180060	EC	On-Demand	Anodyne	TBXAS1	41	39
CCCOc1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819180076	EG	On-Demand	Bother	ADRB2	68	51
CCCOc1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819180076	EG	On-Demand	Bother	ADRB1	87	47
CCCOc1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819180076	EG	On-Demand	Bother	CACNA1C	42	35
CCCOc1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819180076	EG	On-Demand	Bother	ADRB3	129	47
CCCOc1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819180076	EG	On-Demand	Bother	CACNA1D	67	35
CCCOc1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819180076	EG	On-Demand	Bother	ACR	17	41
CCCOc1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819180078	EG	On-Demand	Bother	ADRB2	68	51
CCCOc1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819180078	EG	On-Demand	Bother	ADRB1	87	47
CCCOc1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819180078	EG	On-Demand	Bother	CACNA1C	42	35
CCCOc1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819180078	EG	On-Demand	Bother	ADRB3	129	47
CCCOc1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819180078	EG	On-Demand	Bother	CACNA1D	67	35
CCCOc1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819180078	EG	On-Demand	Bother	ACR	17	41
Cc1ncc(CCNC[C@@H](O)COc2ccccc2C(F)(F)F)s1	ZINC000819180100	FG	On-Demand	Anodyne	ADRB2	47	43
Cc1ncc(CCNC[C@@H](O)COc2ccccc2C(F)(F)F)s1	ZINC000819180100	FG	On-Demand	Anodyne	ADRB1	64	36
Cc1ncc(CCNC[C@@H](O)COc2ccccc2C(F)(F)F)s1	ZINC000819180100	FG	On-Demand	Anodyne	ADRB3	36	42
Cc1ncc(CCNC[C@@H](O)COc2ccccc2C(F)(F)F)s1	ZINC000819180100	FG	On-Demand	Anodyne	ABCB1	15	42
Cc1ncc(CCNC[C@H](O)COc2ccccc2C(F)(F)F)s1	ZINC000819180101	FG	On-Demand	Anodyne	ADRB2	47	43
Cc1ncc(CCNC[C@H](O)COc2ccccc2C(F)(F)F)s1	ZINC000819180101	FG	On-Demand	Anodyne	ADRB1	64	36
Cc1ncc(CCNC[C@H](O)COc2ccccc2C(F)(F)F)s1	ZINC000819180101	FG	On-Demand	Anodyne	ADRB3	36	42
Cc1ncc(CCNC[C@H](O)COc2ccccc2C(F)(F)F)s1	ZINC000819180101	FG	On-Demand	Anodyne	ABCB1	15	42
Cc1ncc(CCNC[C@H](O)c2ccc(F)cc2)s1	ZINC000819180108	CE	On-Demand	Anodyne	ADRB2	18	41
Cc1ncc(CCNC[C@@H](O)c2ccc(F)cc2)s1	ZINC000819180109	CE	On-Demand	Anodyne	ADRB2	18	41
Cc1ncc(CCNC[C@@H](O)COCc2cccs2)s1	ZINC000819180116	DE	On-Demand	Anodyne	ADRB1	29	41
Cc1ncc(CCNC[C@@H](O)COCc2cccs2)s1	ZINC000819180116	DE	On-Demand	Anodyne	ADRB3	23	41
Cc1ncc(CCNC[C@H](O)COCc2cccs2)s1	ZINC000819180117	DE	On-Demand	Anodyne	ADRB1	29	41
Cc1ncc(CCNC[C@H](O)COCc2cccs2)s1	ZINC000819180117	DE	On-Demand	Anodyne	ADRB3	23	41
Cc1ncc(CCNC[C@H](O)Cc2ccc3ccccc3c2)s1	ZINC000819180124	EG	On-Demand	Anodyne	ADRB1	35	41
Cc1ncc(CCNC[C@H](O)Cc2ccc3ccccc3c2)s1	ZINC000819180124	EG	On-Demand	Anodyne	ADRB3	39	41
Cc1ncc(CCNC[C@H](O)Cc2ccc3ccccc3c2)s1	ZINC000819180124	EG	On-Demand	Anodyne	CASR	41	37
Cc1ncc(CCNC[C@@H](O)Cc2ccc3ccccc3c2)s1	ZINC000819180125	EG	On-Demand	Anodyne	ADRB1	35	41
Cc1ncc(CCNC[C@@H](O)Cc2ccc3ccccc3c2)s1	ZINC000819180125	EG	On-Demand	Anodyne	ADRB3	39	41
Cc1ncc(CCNC[C@@H](O)Cc2ccc3ccccc3c2)s1	ZINC000819180125	EG	On-Demand	Anodyne	CASR	41	37
CCCOc1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819180130	DF	On-Demand	Anodyne	ADRB2	82	54
CCCOc1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819180130	DF	On-Demand	Anodyne	ADRB1	103	60
CCCOc1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819180130	DF	On-Demand	Anodyne	ADRB3	182	60
CCCOc1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819180130	DF	On-Demand	Anodyne	CYP51A1	18	43
CCCOc1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819180131	DF	On-Demand	Anodyne	ADRB2	82	54
CCCOc1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819180131	DF	On-Demand	Anodyne	ADRB1	103	60
CCCOc1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819180131	DF	On-Demand	Anodyne	ADRB3	182	60
CCCOc1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819180131	DF	On-Demand	Anodyne	CYP51A1	18	43
C/C=C/c1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)c(OC)c1	ZINC000819180133	FG	On-Demand	Anodyne	ADRB2	25	59
C/C=C/c1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)c(OC)c1	ZINC000819180133	FG	On-Demand	Anodyne	ADRB1	25	59
C/C=C\c1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)c(OC)c1	ZINC000819180134	FG	On-Demand	Anodyne	ADRB2	25	59
C/C=C\c1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)c(OC)c1	ZINC000819180134	FG	On-Demand	Anodyne	ADRB1	25	59
C/C=C/c1ccc(OC[C@H](O)CNCCc2cnc(C)s2)c(OC)c1	ZINC000819180135	FG	On-Demand	Anodyne	ADRB2	25	59
C/C=C/c1ccc(OC[C@H](O)CNCCc2cnc(C)s2)c(OC)c1	ZINC000819180135	FG	On-Demand	Anodyne	ADRB1	25	59
C/C=C\c1ccc(OC[C@H](O)CNCCc2cnc(C)s2)c(OC)c1	ZINC000819180136	FG	On-Demand	Anodyne	ADRB2	25	59
C/C=C\c1ccc(OC[C@H](O)CNCCc2cnc(C)s2)c(OC)c1	ZINC000819180136	FG	On-Demand	Anodyne	ADRB1	25	59
COc1ccc(OC)c([C@H](O)CNCCCc2ccccn2)c1	ZINC000819180147	DE	On-Demand	Anodyne	ADRB2	37	45
COc1ccc(OC)c([C@H](O)CNCCCc2ccccn2)c1	ZINC000819180147	DE	On-Demand	Anodyne	ADRB1	35	45
CC(=O)c1cccc(OC[C@@H](O)CNCCc2cnc(C)s2)c1	ZINC000819180148	EE	On-Demand	Anodyne	ADRB2	55	48
CC(=O)c1cccc(OC[C@@H](O)CNCCc2cnc(C)s2)c1	ZINC000819180148	EE	On-Demand	Anodyne	ADRB1	85	45
CC(=O)c1cccc(OC[C@@H](O)CNCCc2cnc(C)s2)c1	ZINC000819180148	EE	On-Demand	Anodyne	ADRB3	60	45
CC(=O)c1cccc(OC[C@@H](O)CNCCc2cnc(C)s2)c1	ZINC000819180148	EE	On-Demand	Anodyne	ACOX1	57	34
CC(=O)c1cccc(OC[C@@H](O)CNCCc2cnc(C)s2)c1	ZINC000819180148	EE	On-Demand	Anodyne	ABCB1	21	47
CC(=O)c1cccc(OC[C@H](O)CNCCc2cnc(C)s2)c1	ZINC000819180149	EE	On-Demand	Anodyne	ADRB2	55	48
CC(=O)c1cccc(OC[C@H](O)CNCCc2cnc(C)s2)c1	ZINC000819180149	EE	On-Demand	Anodyne	ADRB1	85	45
CC(=O)c1cccc(OC[C@H](O)CNCCc2cnc(C)s2)c1	ZINC000819180149	EE	On-Demand	Anodyne	ADRB3	60	45
CC(=O)c1cccc(OC[C@H](O)CNCCc2cnc(C)s2)c1	ZINC000819180149	EE	On-Demand	Anodyne	ACOX1	57	34
CC(=O)c1cccc(OC[C@H](O)CNCCc2cnc(C)s2)c1	ZINC000819180149	EE	On-Demand	Anodyne	ABCB1	21	47
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1cccnc1	ZINC000819180173	DC	On-Demand	Anodyne	ADRB2	39	49
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1cccnc1	ZINC000819180173	DC	On-Demand	Anodyne	ADRB1	50	48
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1cccnc1	ZINC000819180173	DC	On-Demand	Anodyne	ADRB3	141	60
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1cccnc1	ZINC000819180173	DC	On-Demand	Anodyne	TBXA2R	26	43
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1cccnc1	ZINC000819180173	DC	On-Demand	Anodyne	TBXAS1	61	46
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1cccnc1	ZINC000819180173	DC	On-Demand	Anodyne	NAMPT	23	41
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1cccnc1	ZINC000819180174	DC	On-Demand	Anodyne	ADRB2	39	49
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1cccnc1	ZINC000819180174	DC	On-Demand	Anodyne	ADRB1	50	48
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1cccnc1	ZINC000819180174	DC	On-Demand	Anodyne	ADRB3	141	60
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1cccnc1	ZINC000819180174	DC	On-Demand	Anodyne	TBXA2R	26	43
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1cccnc1	ZINC000819180174	DC	On-Demand	Anodyne	TBXAS1	61	46
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1cccnc1	ZINC000819180174	DC	On-Demand	Anodyne	NAMPT	23	41
CN(CCNC[C@H](O)c1cccc(Cl)c1)S(=O)(=O)c1cccs1	ZINC000819180192	FE	On-Demand	Anodyne	ADRB1	45	44
CN(CCNC[C@H](O)c1cccc(Cl)c1)S(=O)(=O)c1cccs1	ZINC000819180192	FE	On-Demand	Anodyne	ADRB3	71	44
CN(CCNC[C@@H](O)c1cccc(Cl)c1)S(=O)(=O)c1cccs1	ZINC000819180193	FE	On-Demand	Anodyne	ADRB1	45	44
CN(CCNC[C@@H](O)c1cccc(Cl)c1)S(=O)(=O)c1cccs1	ZINC000819180193	FE	On-Demand	Anodyne	ADRB3	71	44
CN(CCNC[C@H](O)c1cccc(F)c1)S(=O)(=O)c1cccs1	ZINC000819180194	FD	On-Demand	Anodyne	ADRB1	22	40
CN(CCNC[C@H](O)c1cccc(F)c1)S(=O)(=O)c1cccs1	ZINC000819180194	FD	On-Demand	Anodyne	ADRB3	40	40
CN(CCNC[C@@H](O)c1cccc(F)c1)S(=O)(=O)c1cccs1	ZINC000819180195	FD	On-Demand	Anodyne	ADRB1	22	40
CN(CCNC[C@@H](O)c1cccc(F)c1)S(=O)(=O)c1cccs1	ZINC000819180195	FD	On-Demand	Anodyne	ADRB3	40	40
COC[C@@H](O)CNCCc1cnc(C)s1	ZINC000819180255	BC	On-Demand	Anodyne	ADRB3	25	40
Cc1ncc(CCNC[C@@H](O)COc2ccc(Cl)cc2)s1	ZINC000819180256	EF	On-Demand	Anodyne	ADRB2	56	49
Cc1ncc(CCNC[C@@H](O)COc2ccc(Cl)cc2)s1	ZINC000819180256	EF	On-Demand	Anodyne	ADRB1	82	49
Cc1ncc(CCNC[C@@H](O)COc2ccc(Cl)cc2)s1	ZINC000819180256	EF	On-Demand	Anodyne	GRIN1	25	53
Cc1ncc(CCNC[C@@H](O)COc2ccc(Cl)cc2)s1	ZINC000819180256	EF	On-Demand	Anodyne	ADRB3	57	49
Cc1ncc(CCNC[C@H](O)COc2ccc(Cl)cc2)s1	ZINC000819180257	EF	On-Demand	Anodyne	ADRB2	56	49
Cc1ncc(CCNC[C@H](O)COc2ccc(Cl)cc2)s1	ZINC000819180257	EF	On-Demand	Anodyne	ADRB1	82	49
Cc1ncc(CCNC[C@H](O)COc2ccc(Cl)cc2)s1	ZINC000819180257	EF	On-Demand	Anodyne	GRIN1	25	53
Cc1ncc(CCNC[C@H](O)COc2ccc(Cl)cc2)s1	ZINC000819180257	EF	On-Demand	Anodyne	ADRB3	57	49
Cc1ncc(CCNC[C@H](O)COCc2ccc(Cl)cc2)s1	ZINC000819180258	EF	On-Demand	Anodyne	ADRB2	31	42
Cc1ncc(CCNC[C@H](O)COCc2ccc(Cl)cc2)s1	ZINC000819180258	EF	On-Demand	Anodyne	ADRB1	45	42
Cc1ncc(CCNC[C@H](O)COCc2ccc(Cl)cc2)s1	ZINC000819180258	EF	On-Demand	Anodyne	ADRB3	38	42
Cc1ncc(CCNC[C@@H](O)COCc2ccc(Cl)cc2)s1	ZINC000819180259	EF	On-Demand	Anodyne	ADRB2	31	42
Cc1ncc(CCNC[C@@H](O)COCc2ccc(Cl)cc2)s1	ZINC000819180259	EF	On-Demand	Anodyne	ADRB1	45	42
Cc1ncc(CCNC[C@@H](O)COCc2ccc(Cl)cc2)s1	ZINC000819180259	EF	On-Demand	Anodyne	ADRB3	38	42
O[C@H](CN[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21)c1cccc(Cl)c1	ZINC000819180260	DH	On-Demand	Anodyne	ADRB1	28	43
O[C@H](CN[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21)c1cccc(Cl)c1	ZINC000819180260	DH	On-Demand	Anodyne	ADRB3	45	47
O[C@H](CN[C@H]1[C@@H]2c3ccccc3CC[C@H]21)c1cccc(Cl)c1	ZINC000819180261	DH	On-Demand	Anodyne	ADRB1	28	43
O[C@H](CN[C@H]1[C@@H]2c3ccccc3CC[C@H]21)c1cccc(Cl)c1	ZINC000819180261	DH	On-Demand	Anodyne	ADRB3	45	47
O[C@H](CN[C@@H]1[C@H]2CCc3ccccc3[C@H]21)c1cccc(Cl)c1	ZINC000819180262	DH	On-Demand	Anodyne	ADRB1	28	43
O[C@H](CN[C@@H]1[C@H]2CCc3ccccc3[C@H]21)c1cccc(Cl)c1	ZINC000819180262	DH	On-Demand	Anodyne	ADRB3	45	47
O[C@H](CN[C@@H]1[C@H]2CCc3ccccc3[C@@H]21)c1cccc(Cl)c1	ZINC000819180263	DH	On-Demand	Anodyne	ADRB1	28	43
O[C@H](CN[C@@H]1[C@H]2CCc3ccccc3[C@@H]21)c1cccc(Cl)c1	ZINC000819180263	DH	On-Demand	Anodyne	ADRB3	45	47
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCCc2ccccn2)CC1	ZINC000819180264	FF	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCCc2ccccn2)CC1	ZINC000819180265	FF	On-Demand	Anodyne	GPR119	23	41
CCCOc1cccc(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819180268	DG	On-Demand	Anodyne	ADRB2	88	54
CCCOc1cccc(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819180268	DG	On-Demand	Anodyne	ADRB1	101	54
CCCOc1cccc(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819180268	DG	On-Demand	Anodyne	ADRB3	120	47
CCCOc1cccc(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819180269	DG	On-Demand	Anodyne	ADRB2	88	54
CCCOc1cccc(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819180269	DG	On-Demand	Anodyne	ADRB1	101	54
CCCOc1cccc(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819180269	DG	On-Demand	Anodyne	ADRB3	120	47
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2ccccn2)c1	ZINC000819180302	DE	On-Demand	Bother	ADRB2	26	43
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2ccccn2)c1	ZINC000819180302	DE	On-Demand	Bother	ADRB1	40	43
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2ccccn2)c1	ZINC000819180302	DE	On-Demand	Bother	ADRB3	63	37
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2ccccn2)c1	ZINC000819180303	DE	On-Demand	Bother	ADRB2	26	43
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2ccccn2)c1	ZINC000819180303	DE	On-Demand	Bother	ADRB1	40	43
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2ccccn2)c1	ZINC000819180303	DE	On-Demand	Bother	ADRB3	63	37
CCCOc1cccc(CCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819180306	EH	On-Demand	Anodyne	ADRB2	75	54
CCCOc1cccc(CCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819180306	EH	On-Demand	Anodyne	ADRB1	87	52
CCCOc1cccc(CCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819180306	EH	On-Demand	Anodyne	ADRB3	107	52
CCCOc1cccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819180307	EH	On-Demand	Anodyne	ADRB2	75	54
CCCOc1cccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819180307	EH	On-Demand	Anodyne	ADRB1	87	52
CCCOc1cccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819180307	EH	On-Demand	Anodyne	ADRB3	107	52
Cc1ncc(CCNC[C@H](O)COc2ccc(CC#N)cc2)s1	ZINC000819180323	EE	On-Demand	Mild	ADRB2	54	50
Cc1ncc(CCNC[C@H](O)COc2ccc(CC#N)cc2)s1	ZINC000819180323	EE	On-Demand	Mild	ADRB1	82	50
Cc1ncc(CCNC[C@H](O)COc2ccc(CC#N)cc2)s1	ZINC000819180323	EE	On-Demand	Mild	GRIN1	15	44
Cc1ncc(CCNC[C@H](O)COc2ccc(CC#N)cc2)s1	ZINC000819180323	EE	On-Demand	Mild	ADRB3	55	50
Cc1ncc(CCNC[C@@H](O)COc2ccc(CC#N)cc2)s1	ZINC000819180324	EE	On-Demand	Mild	ADRB2	54	50
Cc1ncc(CCNC[C@@H](O)COc2ccc(CC#N)cc2)s1	ZINC000819180324	EE	On-Demand	Mild	ADRB1	82	50
Cc1ncc(CCNC[C@@H](O)COc2ccc(CC#N)cc2)s1	ZINC000819180324	EE	On-Demand	Mild	GRIN1	15	44
Cc1ncc(CCNC[C@@H](O)COc2ccc(CC#N)cc2)s1	ZINC000819180324	EE	On-Demand	Mild	ADRB3	55	50
Cc1ncc(CCNC[C@@H](O)COc2ccc(F)cc2)s1	ZINC000819180325	DE	On-Demand	Anodyne	ADRB2	62	49
Cc1ncc(CCNC[C@@H](O)COc2ccc(F)cc2)s1	ZINC000819180325	DE	On-Demand	Anodyne	ADRB1	87	49
Cc1ncc(CCNC[C@@H](O)COc2ccc(F)cc2)s1	ZINC000819180325	DE	On-Demand	Anodyne	GRIN1	16	53
Cc1ncc(CCNC[C@@H](O)COc2ccc(F)cc2)s1	ZINC000819180325	DE	On-Demand	Anodyne	ADRB3	57	49
Cc1ncc(CCNC[C@H](O)COc2ccc(F)cc2)s1	ZINC000819180326	DE	On-Demand	Anodyne	ADRB2	62	49
Cc1ncc(CCNC[C@H](O)COc2ccc(F)cc2)s1	ZINC000819180326	DE	On-Demand	Anodyne	ADRB1	87	49
Cc1ncc(CCNC[C@H](O)COc2ccc(F)cc2)s1	ZINC000819180326	DE	On-Demand	Anodyne	GRIN1	16	53
Cc1ncc(CCNC[C@H](O)COc2ccc(F)cc2)s1	ZINC000819180326	DE	On-Demand	Anodyne	ADRB3	57	49
Cc1ncc(CCNC[C@H](O)COCc2ccccc2Cl)s1	ZINC000819180327	EF	On-Demand	Anodyne	ADRB2	28	40
Cc1ncc(CCNC[C@H](O)COCc2ccccc2Cl)s1	ZINC000819180327	EF	On-Demand	Anodyne	ADRB1	36	42
Cc1ncc(CCNC[C@H](O)COCc2ccccc2Cl)s1	ZINC000819180327	EF	On-Demand	Anodyne	ADRB3	28	42
Cc1ncc(CCNC[C@@H](O)COCc2ccccc2Cl)s1	ZINC000819180328	EF	On-Demand	Anodyne	ADRB2	28	40
Cc1ncc(CCNC[C@@H](O)COCc2ccccc2Cl)s1	ZINC000819180328	EF	On-Demand	Anodyne	ADRB1	36	42
Cc1ncc(CCNC[C@@H](O)COCc2ccccc2Cl)s1	ZINC000819180328	EF	On-Demand	Anodyne	ADRB3	28	42
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180329	ED	On-Demand	Anodyne	ADRB2	61	64
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180329	ED	On-Demand	Anodyne	ADRB1	102	64
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180329	ED	On-Demand	Anodyne	GRIN1	29	48
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180329	ED	On-Demand	Anodyne	ADRB3	78	64
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180329	ED	On-Demand	Anodyne	ACOX1	46	35
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180330	ED	On-Demand	Anodyne	ADRB2	61	64
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180330	ED	On-Demand	Anodyne	ADRB1	102	64
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180330	ED	On-Demand	Anodyne	GRIN1	29	48
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180330	ED	On-Demand	Anodyne	ADRB3	78	64
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180330	ED	On-Demand	Anodyne	ACOX1	46	35
COC(=O)c1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180337	FD	On-Demand	Anodyne	ADRB2	60	52
COC(=O)c1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180337	FD	On-Demand	Anodyne	ADRB1	92	52
COC(=O)c1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180337	FD	On-Demand	Anodyne	ADRB3	66	52
COC(=O)c1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180337	FD	On-Demand	Anodyne	ACOX1	42	30
COC(=O)c1ccc(OC[C@@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180337	FD	On-Demand	Anodyne	ABCB1	15	47
COC(=O)c1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180338	FD	On-Demand	Anodyne	ADRB2	60	52
COC(=O)c1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180338	FD	On-Demand	Anodyne	ADRB1	92	52
COC(=O)c1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180338	FD	On-Demand	Anodyne	ADRB3	66	52
COC(=O)c1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180338	FD	On-Demand	Anodyne	ACOX1	42	30
COC(=O)c1ccc(OC[C@H](O)CNCCc2cnc(C)s2)cc1	ZINC000819180338	FD	On-Demand	Anodyne	ABCB1	15	47
CC(C)(C)OC(=O)N1CC[C@H](Oc2ccnc(CN3C(=O)CNC3=O)c2)C1	ZINC000819180366	GD	On-Demand	Anodyne	GPR119	47	42
CC(C)(C)OC(=O)N1CC[C@@H](Oc2ccnc(CN3C(=O)CNC3=O)c2)C1	ZINC000819180367	GD	On-Demand	Anodyne	GPR119	47	42
O=S(=O)(NCCNC[C@H](O)c1ccc(Cl)cc1)c1cccnc1	ZINC000819180389	FD	On-Demand	Anodyne	ADRB2	31	44
O=S(=O)(NCCNC[C@H](O)c1ccc(Cl)cc1)c1cccnc1	ZINC000819180389	FD	On-Demand	Anodyne	ADRB1	40	44
O=S(=O)(NCCNC[C@H](O)c1ccc(Cl)cc1)c1cccnc1	ZINC000819180389	FD	On-Demand	Anodyne	ADRB3	119	57
O=S(=O)(NCCNC[C@H](O)c1ccc(Cl)cc1)c1cccnc1	ZINC000819180389	FD	On-Demand	Anodyne	TBXA2R	41	34
O=S(=O)(NCCNC[C@H](O)c1ccc(Cl)cc1)c1cccnc1	ZINC000819180389	FD	On-Demand	Anodyne	TBXAS1	58	50
Cc1ccccc1[C@@H](O)CNCCNS(=O)(=O)c1cccnc1	ZINC000819180411	EC	On-Demand	Anodyne	ADRB2	25	40
Cc1ccccc1[C@@H](O)CNCCNS(=O)(=O)c1cccnc1	ZINC000819180411	EC	On-Demand	Anodyne	ADRB3	90	46
Cc1ccccc1[C@@H](O)CNCCNS(=O)(=O)c1cccnc1	ZINC000819180411	EC	On-Demand	Anodyne	TBXAS1	41	39
C#CCNC(=O)c1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819180428	GF	On-Demand	Mild	PAPA1_CARPA	57	50
C#CCNC(=O)c1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819180428	GF	On-Demand	Mild	CCKAR	43	39
C#CCNC(=O)c1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819180428	GF	On-Demand	Mild	CTSK	16	44
C#CCNC(=O)c1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819180428	GF	On-Demand	Mild	CTSL	22	50
C#CCNC(=O)c1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819180428	GF	On-Demand	Mild	CTSS	18	50
C#CCNC(=O)c1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819180428	GF	On-Demand	Mild	FPR1	43	40
C#CCNC(=O)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819180429	GF	On-Demand	Mild	PAPA1_CARPA	57	50
C#CCNC(=O)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819180429	GF	On-Demand	Mild	CCKAR	43	39
C#CCNC(=O)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819180429	GF	On-Demand	Mild	CTSK	16	44
C#CCNC(=O)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819180429	GF	On-Demand	Mild	CTSL	22	50
C#CCNC(=O)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819180429	GF	On-Demand	Mild	CTSS	18	50
C#CCNC(=O)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819180429	GF	On-Demand	Mild	FPR1	43	40
O=S(=O)(NCCNC[C@H](O)c1ccc(F)cc1)c1cccnc1	ZINC000819180443	EC	On-Demand	Anodyne	ADRB2	30	45
O=S(=O)(NCCNC[C@H](O)c1ccc(F)cc1)c1cccnc1	ZINC000819180443	EC	On-Demand	Anodyne	ADRB1	30	44
O=S(=O)(NCCNC[C@H](O)c1ccc(F)cc1)c1cccnc1	ZINC000819180443	EC	On-Demand	Anodyne	ADRB3	112	49
O=S(=O)(NCCNC[C@H](O)c1ccc(F)cc1)c1cccnc1	ZINC000819180443	EC	On-Demand	Anodyne	TBXA2R	23	41
O=S(=O)(NCCNC[C@H](O)c1ccc(F)cc1)c1cccnc1	ZINC000819180443	EC	On-Demand	Anodyne	TBXAS1	48	45
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)cc1)c1cccnc1	ZINC000819180444	EC	On-Demand	Anodyne	ADRB2	30	45
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)cc1)c1cccnc1	ZINC000819180444	EC	On-Demand	Anodyne	ADRB1	30	44
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)cc1)c1cccnc1	ZINC000819180444	EC	On-Demand	Anodyne	ADRB3	112	49
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)cc1)c1cccnc1	ZINC000819180444	EC	On-Demand	Anodyne	TBXA2R	23	41
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)cc1)c1cccnc1	ZINC000819180444	EC	On-Demand	Anodyne	TBXAS1	48	45
C[C@@](O)(C(=O)NCc1ncn(-c2ccccc2)n1)c1cccc(C(F)(F)F)c1	ZINC000819180458	GF	On-Demand	Anodyne	PDS	48	38
CC1(C)CCC[C@H]1CNC(=O)c1cc(=O)c2ccc(F)cc2o1	ZINC000819180460	DG	On-Demand	Anodyne	KCNH2	16	50
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(Cl)nc2ccccc12	ZINC000819180488	FG	On-Demand	Anodyne	TACR3	15	46
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180500	GE	On-Demand	Anodyne	PGC	51	36
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180500	GE	On-Demand	Anodyne	PAPA1_CARPA	43	46
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180500	GE	On-Demand	Anodyne	CTSK	16	46
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180500	GE	On-Demand	Anodyne	REN	65	40
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180500	GE	On-Demand	Anodyne	CAPN1	16	40
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180500	GE	On-Demand	Anodyne	POLG_HCV1	34	45
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180500	GE	On-Demand	Anodyne	SCN10A	24	45
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180500	GE	On-Demand	Anodyne	FPR1	50	39
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180501	GE	On-Demand	Anodyne	PGC	51	36
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180501	GE	On-Demand	Anodyne	PAPA1_CARPA	43	46
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180501	GE	On-Demand	Anodyne	CTSK	16	46
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180501	GE	On-Demand	Anodyne	REN	65	40
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180501	GE	On-Demand	Anodyne	CAPN1	16	40
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180501	GE	On-Demand	Anodyne	POLG_HCV1	34	45
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180501	GE	On-Demand	Anodyne	SCN10A	24	45
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180501	GE	On-Demand	Anodyne	FPR1	50	39
COc1ccc2c(C)c(CCC(=O)NCc3ncn(-c4ccccc4)n3)c(=O)oc2c1	ZINC000819180507	HF	On-Demand	Anodyne	MAOB	40	42
COc1ccc2c(C)c(CCC(=O)NCc3ncn(-c4ccccc4)n3)c(=O)oc2c1	ZINC000819180507	HF	On-Demand	Anodyne	MTNR1B	40	39
COc1ccc2c(C)c(CCC(=O)NCc3ncn(-c4ccccc4)n3)c(=O)oc2c1	ZINC000819180507	HF	On-Demand	Anodyne	NQO1	23	41
CC(C)(C)OC(=O)NCc1cccc(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819180519	HG	On-Demand	Anodyne	MMP13	16	42
CC(C)(C)OC(=O)NCc1cccc(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819180519	HG	On-Demand	Anodyne	CARM1	50	37
CC(C)(C)OC(=O)NCc1cccc(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819180519	HG	On-Demand	Anodyne	PDS	61	34
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180526	FD	On-Demand	Anodyne	F2	31	40
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000819180537	GE	On-Demand	Anodyne	P2RX7	21	41
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000819180538	GE	On-Demand	Anodyne	P2RX7	21	41
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)NCc2ncn(-c3ccccc3)n2)C1	ZINC000819180539	HF	On-Demand	Anodyne	SLC12A5	47	33
O=C(OCc1ccccc1)N1CC[C@@](F)(C(=O)NCc2ncn(-c3ccccc3)n2)C1	ZINC000819180540	HF	On-Demand	Anodyne	SLC12A5	47	33
Cc1ncc(CCNC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)s1	ZINC000819180563	FD	On-Demand	Anodyne	ADRB1	58	37
Cc1ncc(CCNC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)s1	ZINC000819180563	FD	On-Demand	Anodyne	ADRB3	41	42
Cc1ncc(CCNC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)s1	ZINC000819180563	FD	On-Demand	Anodyne	ACOX1	65	32
Cc1ncc(CCNC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)s1	ZINC000819180564	FD	On-Demand	Anodyne	ADRB1	58	37
Cc1ncc(CCNC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)s1	ZINC000819180564	FD	On-Demand	Anodyne	ADRB3	41	42
Cc1ncc(CCNC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)s1	ZINC000819180564	FD	On-Demand	Anodyne	ACOX1	65	32
Cc1ncc(CCNCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)s1	ZINC000819180569	FG	On-Demand	Anodyne	CYNT	41	45
O[C@@H](CNCCCc1ccccn1)c1cccc2ccccc12	ZINC000819180577	DG	On-Demand	Anodyne	ADRB2	25	48
O[C@@H](CNCCCc1ccccn1)c1cccc2ccccc12	ZINC000819180577	DG	On-Demand	Anodyne	ADRB1	19	48
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2[C@H]3CCc4ccccc4[C@H]32)CC1	ZINC000819180592	GG	On-Demand	Anodyne	GPR119	36	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2[C@H]3CCc4ccccc4[C@@H]32)CC1	ZINC000819180593	GG	On-Demand	Anodyne	GPR119	36	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)CC1	ZINC000819180594	GG	On-Demand	Anodyne	GPR119	36	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2[C@@H]3c4ccccc4CC[C@H]32)CC1	ZINC000819180595	GG	On-Demand	Anodyne	GPR119	36	45
O[C@H](CN[C@H]1[C@@H]2c3ccccc3CC[C@H]21)c1cccnc1	ZINC000819180598	CE	On-Demand	Anodyne	ADRB3	54	46
O[C@H](CN[C@@H]1[C@H]2CCc3ccccc3[C@H]21)c1cccnc1	ZINC000819180599	CE	On-Demand	Anodyne	ADRB3	54	46
O[C@H](CN[C@@H]1[C@H]2CCc3ccccc3[C@@H]21)c1cccnc1	ZINC000819180600	CE	On-Demand	Anodyne	ADRB3	54	46
O[C@H](CN[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21)c1cccnc1	ZINC000819180601	CE	On-Demand	Anodyne	ADRB3	54	46
CCCOc1cccc(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819180612	DG	On-Demand	Anodyne	ADRB2	79	52
CCCOc1cccc(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819180612	DG	On-Demand	Anodyne	ADRB1	92	51
CCCOc1cccc(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819180612	DG	On-Demand	Anodyne	ADRB3	134	51
CCCOc1cccc(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819180613	DG	On-Demand	Anodyne	ADRB2	79	52
CCCOc1cccc(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819180613	DG	On-Demand	Anodyne	ADRB1	92	51
CCCOc1cccc(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819180613	DG	On-Demand	Anodyne	ADRB3	134	51
CCCOc1cccc(CCNCCS(=O)(=O)CC)c1	ZINC000819180614	CE	On-Demand	Anodyne	MTNR1A	27	40
CCCOc1cccc(CCNCCS(=O)(=O)CC)c1	ZINC000819180614	CE	On-Demand	Anodyne	MTNR1B	21	40
CCCOc1cccc(CCNCCS(=O)(=O)CC)c1	ZINC000819180614	CE	On-Demand	Anodyne	CRTM	53	34
O[C@@H](CNCCCc1ccccn1)c1ccc(C(F)(F)F)cc1	ZINC000819180624	DG	On-Demand	Anodyne	ADRB2	17	42
O[C@H](CNCCCc1ccccn1)c1ccc(C(F)(F)F)cc1	ZINC000819180626	DG	On-Demand	Anodyne	ADRB2	17	42
COc1cccc(OC)c1OC[C@H](O)CNCCc1cnc(C)s1	ZINC000819180630	FE	On-Demand	Anodyne	ADRB2	50	44
COc1cccc(OC)c1OC[C@H](O)CNCCc1cnc(C)s1	ZINC000819180630	FE	On-Demand	Anodyne	ADRB1	60	44
COc1cccc(OC)c1OC[C@H](O)CNCCc1cnc(C)s1	ZINC000819180630	FE	On-Demand	Anodyne	ADRB3	37	41
O=[N+]([O-])c1ccc([C@@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819180631	FC	On-Demand	Bother	ADRB2	27	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819180631	FC	On-Demand	Bother	ADRB1	26	40
O=[N+]([O-])c1ccc([C@@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819180631	FC	On-Demand	Bother	ADRB3	102	46
O=[N+]([O-])c1ccc([C@@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819180631	FC	On-Demand	Bother	TBXA2R	18	43
O=[N+]([O-])c1ccc([C@@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819180631	FC	On-Demand	Bother	TBXAS1	42	38
COc1cccc(OC)c1OC[C@@H](O)CNCCc1cnc(C)s1	ZINC000819180632	FE	On-Demand	Anodyne	ADRB2	50	44
COc1cccc(OC)c1OC[C@@H](O)CNCCc1cnc(C)s1	ZINC000819180632	FE	On-Demand	Anodyne	ADRB1	60	44
COc1cccc(OC)c1OC[C@@H](O)CNCCc1cnc(C)s1	ZINC000819180632	FE	On-Demand	Anodyne	ADRB3	37	41
O=[N+]([O-])c1ccc([C@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819180633	FC	On-Demand	Bother	ADRB2	27	42
O=[N+]([O-])c1ccc([C@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819180633	FC	On-Demand	Bother	ADRB1	26	40
O=[N+]([O-])c1ccc([C@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819180633	FC	On-Demand	Bother	ADRB3	102	46
O=[N+]([O-])c1ccc([C@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819180633	FC	On-Demand	Bother	TBXA2R	18	43
O=[N+]([O-])c1ccc([C@H](O)CNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819180633	FC	On-Demand	Bother	TBXAS1	42	38
Cc1ncc(CCNC[C@H](O)c2cccc(F)c2)s1	ZINC000819180644	CE	On-Demand	Anodyne	ADRB2	29	40
Cc1ncc(CCNC[C@H](O)c2cccc(F)c2)s1	ZINC000819180644	CE	On-Demand	Anodyne	ADRB1	36	44
Cc1ncc(CCNC[C@H](O)c2cccc(F)c2)s1	ZINC000819180644	CE	On-Demand	Anodyne	ADRB3	78	44
Cc1ncc(CCNC[C@@H](O)c2cccc(F)c2)s1	ZINC000819180647	CE	On-Demand	Anodyne	ADRB2	29	40
Cc1ncc(CCNC[C@@H](O)c2cccc(F)c2)s1	ZINC000819180647	CE	On-Demand	Anodyne	ADRB1	36	44
Cc1ncc(CCNC[C@@H](O)c2cccc(F)c2)s1	ZINC000819180647	CE	On-Demand	Anodyne	ADRB3	78	44
CCCOc1cccc(CCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819180672	EH	On-Demand	Anodyne	ADRB2	52	50
CCCOc1cccc(CCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819180672	EH	On-Demand	Anodyne	ADRB1	66	50
CCCOc1cccc(CCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819180672	EH	On-Demand	Anodyne	ADRB3	60	45
CCCOc1cccc(CCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819180675	EH	On-Demand	Anodyne	ADRB2	52	50
CCCOc1cccc(CCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819180675	EH	On-Demand	Anodyne	ADRB1	66	50
CCCOc1cccc(CCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819180675	EH	On-Demand	Anodyne	ADRB3	60	45
CN(CCNC[C@H](O)c1ccccc1)S(=O)(=O)c1cccs1	ZINC000819180678	ED	On-Demand	Anodyne	ADRB3	49	41
CN(CCNC[C@@H](O)c1ccccc1)S(=O)(=O)c1cccs1	ZINC000819180680	ED	On-Demand	Anodyne	ADRB3	49	41
O=S(=O)(NCCNC[C@H](O)c1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819180685	GD	On-Demand	Anodyne	ADRB2	23	40
O=S(=O)(NCCNC[C@H](O)c1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819180685	GD	On-Demand	Anodyne	ADRB1	33	40
O=S(=O)(NCCNC[C@H](O)c1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819180685	GD	On-Demand	Anodyne	ADRB3	91	46
O=S(=O)(NCCNC[C@H](O)c1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819180685	GD	On-Demand	Anodyne	TBXA2R	24	41
O=S(=O)(NCCNC[C@H](O)c1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819180685	GD	On-Demand	Anodyne	TBXAS1	46	43
O=S(=O)(NCCNC[C@@H](O)c1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819180687	GD	On-Demand	Anodyne	ADRB2	23	40
O=S(=O)(NCCNC[C@@H](O)c1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819180687	GD	On-Demand	Anodyne	ADRB1	33	40
O=S(=O)(NCCNC[C@@H](O)c1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819180687	GD	On-Demand	Anodyne	ADRB3	91	46
O=S(=O)(NCCNC[C@@H](O)c1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819180687	GD	On-Demand	Anodyne	TBXA2R	24	41
O=S(=O)(NCCNC[C@@H](O)c1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819180687	GD	On-Demand	Anodyne	TBXAS1	46	43
Cc1ncc(CCNC[C@@H](O)COc2ccccc2[N+](=O)[O-])s1	ZINC000819180699	ED	On-Demand	Bother	ADRB2	44	44
Cc1ncc(CCNC[C@@H](O)COc2ccccc2[N+](=O)[O-])s1	ZINC000819180699	ED	On-Demand	Bother	ADRB1	58	44
Cc1ncc(CCNC[C@@H](O)COc2ccccc2[N+](=O)[O-])s1	ZINC000819180699	ED	On-Demand	Bother	ADRB3	38	44
Cc1ncc(CCNC[C@H](O)COc2ccccc2[N+](=O)[O-])s1	ZINC000819180701	ED	On-Demand	Bother	ADRB2	44	44
Cc1ncc(CCNC[C@H](O)COc2ccccc2[N+](=O)[O-])s1	ZINC000819180701	ED	On-Demand	Bother	ADRB1	58	44
Cc1ncc(CCNC[C@H](O)COc2ccccc2[N+](=O)[O-])s1	ZINC000819180701	ED	On-Demand	Bother	ADRB3	38	44
O=[N+]([O-])c1cccc([C@@H](O)CNCCNS(=O)(=O)c2cccnc2)c1	ZINC000819180727	FC	On-Demand	Bother	ADRB2	30	44
O=[N+]([O-])c1cccc([C@@H](O)CNCCNS(=O)(=O)c2cccnc2)c1	ZINC000819180727	FC	On-Demand	Bother	ADRB1	39	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCNS(=O)(=O)c2cccnc2)c1	ZINC000819180727	FC	On-Demand	Bother	ADRB3	120	46
O=[N+]([O-])c1cccc([C@@H](O)CNCCNS(=O)(=O)c2cccnc2)c1	ZINC000819180727	FC	On-Demand	Bother	TBXA2R	15	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCNS(=O)(=O)c2cccnc2)c1	ZINC000819180727	FC	On-Demand	Bother	TBXAS1	35	40
O=[N+]([O-])c1cccc([C@H](O)CNCCNS(=O)(=O)c2cccnc2)c1	ZINC000819180728	FC	On-Demand	Bother	ADRB2	30	44
O=[N+]([O-])c1cccc([C@H](O)CNCCNS(=O)(=O)c2cccnc2)c1	ZINC000819180728	FC	On-Demand	Bother	ADRB1	39	40
O=[N+]([O-])c1cccc([C@H](O)CNCCNS(=O)(=O)c2cccnc2)c1	ZINC000819180728	FC	On-Demand	Bother	ADRB3	120	46
O=[N+]([O-])c1cccc([C@H](O)CNCCNS(=O)(=O)c2cccnc2)c1	ZINC000819180728	FC	On-Demand	Bother	TBXA2R	15	40
O=[N+]([O-])c1cccc([C@H](O)CNCCNS(=O)(=O)c2cccnc2)c1	ZINC000819180728	FC	On-Demand	Bother	TBXAS1	35	40
O=S(=O)(NCCNC[C@H](O)c1c(F)cccc1F)c1cccnc1	ZINC000819180739	FC	On-Demand	Anodyne	ADRB2	23	41
O=S(=O)(NCCNC[C@H](O)c1c(F)cccc1F)c1cccnc1	ZINC000819180739	FC	On-Demand	Anodyne	ADRB3	89	43
O=S(=O)(NCCNC[C@H](O)c1c(F)cccc1F)c1cccnc1	ZINC000819180739	FC	On-Demand	Anodyne	TBXAS1	43	38
O=S(=O)(NCCNC[C@@H](O)c1c(F)cccc1F)c1cccnc1	ZINC000819180740	FC	On-Demand	Anodyne	ADRB2	23	41
O=S(=O)(NCCNC[C@@H](O)c1c(F)cccc1F)c1cccnc1	ZINC000819180740	FC	On-Demand	Anodyne	ADRB3	89	43
O=S(=O)(NCCNC[C@@H](O)c1c(F)cccc1F)c1cccnc1	ZINC000819180740	FC	On-Demand	Anodyne	TBXAS1	43	38
O=C(/C=C/c1cccc(OC2CCCC2)c1)NCc1ncn(-c2ccccc2)n1	ZINC000819180755	GH	On-Demand	Anodyne	HDAC8	43	35
O=C(/C=C\c1cccc(OC2CCCC2)c1)NCc1ncn(-c2ccccc2)n1	ZINC000819180756	GH	On-Demand	Anodyne	HDAC8	43	35
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)NCc1ncn(-c2ccccc2)n1	ZINC000819180759	IH	On-Demand	Anodyne	FFAR1	31	43
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)NCc1ncn(-c2ccccc2)n1	ZINC000819180760	IH	On-Demand	Anodyne	FFAR1	31	43
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180777	HD	On-Demand	Anodyne	CASP3	17	44
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180777	HD	On-Demand	Anodyne	BMP1	16	40
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180777	HD	On-Demand	Anodyne	KLK3	81	44
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180777	HD	On-Demand	Anodyne	CTSB	66	44
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180777	HD	On-Demand	Anodyne	PAPA1_CARPA	65	37
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180777	HD	On-Demand	Anodyne	CYSP_TRYCR	58	42
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180777	HD	On-Demand	Anodyne	CTSK	36	46
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180777	HD	On-Demand	Anodyne	CTSL	48	41
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180777	HD	On-Demand	Anodyne	CAPNS1	71	41
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180777	HD	On-Demand	Anodyne	MMP11	62	33
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180777	HD	On-Demand	Anodyne	FURIN	41	39
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180777	HD	On-Demand	Anodyne	CTSS	18	46
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180777	HD	On-Demand	Anodyne	CAPN1	93	47
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180777	HD	On-Demand	Anodyne	CASP1	23	41
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180777	HD	On-Demand	Anodyne	CAPN2	141	44
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180777	HD	On-Demand	Anodyne	CASP9	30	40
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180777	HD	On-Demand	Anodyne	TPSAB1	43	37
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180777	HD	On-Demand	Anodyne	NPR	68	37
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819180777	HD	On-Demand	Anodyne	PSMB5	40	40
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(-c2cccnc2)nc2ccccc12	ZINC000819180785	HH	On-Demand	Anodyne	TACR3	19	56
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819180786	HF	On-Demand	Anodyne	F2	82	46
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819180786	HF	On-Demand	Anodyne	PRSS1	22	42
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819180786	HF	On-Demand	Anodyne	ACE	32	47
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819180786	HF	On-Demand	Anodyne	FKBP1A	52	44
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819180786	HF	On-Demand	Anodyne	OPRM1	24	40
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819180786	HF	On-Demand	Anodyne	P2RY12	15	41
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819180786	HF	On-Demand	Anodyne	CELA1	27	53
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819180786	HF	On-Demand	Anodyne	GRIN2B	18	40
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819180786	HF	On-Demand	Anodyne	ELANE	38	42
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819180786	HF	On-Demand	Anodyne	CTRA_BOVIN	64	35
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819180786	HF	On-Demand	Anodyne	TRY1_BOVIN	97	45
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819180786	HF	On-Demand	Anodyne	CTSG	44	35
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819180786	HF	On-Demand	Anodyne	PREP	81	53
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819180786	HF	On-Demand	Anodyne	CELA2A	53	35
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819180786	HF	On-Demand	Anodyne	LGMN	91	51
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819180786	HF	On-Demand	Anodyne	KLK5	28	48
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819180786	HF	On-Demand	Anodyne	XIAP	41	45
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819180786	HF	On-Demand	Anodyne	BRCA1	43	30
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819180786	HF	On-Demand	Anodyne	TMPRSS11D	79	45
COc1ccc(OC)c([C@H](O)CNCCc2cnc(C)s2)c1	ZINC000819180812	DE	On-Demand	Anodyne	ADRB2	23	47
O[C@@H](CN[C@@H]1CCOC2(CCSCC2)C1)c1cccnc1	ZINC000819180828	DE	On-Demand	Anodyne	ADRB3	46	43
O[C@@H](CN[C@H]1CCOC2(CCSCC2)C1)c1cccnc1	ZINC000819180829	DE	On-Demand	Anodyne	ADRB3	46	43
O[C@H](CN[C@@H]1CCOC2(CCSCC2)C1)c1cccnc1	ZINC000819180830	DE	On-Demand	Anodyne	ADRB3	46	43
O[C@H](CN[C@H]1CCOC2(CCSCC2)C1)c1cccnc1	ZINC000819180832	DE	On-Demand	Anodyne	ADRB3	46	43
Cc1ncc(CCNCCC(=O)Nc2ccccc2F)s1	ZINC000819180834	DF	On-Demand	Anodyne	HCAR2	16	40
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(-c2nnc(S)o2)cc1	ZINC000819180837	GF	On-Demand	Anodyne	CYP73A16	57	43
Cc1ccccc1[C@@H](O)CNCCCc1ccccn1	ZINC000819180864	CF	On-Demand	Anodyne	ADRB2	20	46
Cc1ccccc1[C@@H](O)CNCCCc1ccccn1	ZINC000819180864	CF	On-Demand	Anodyne	ADRB1	18	46
C=CC[C@]1(C(=O)NCc2ncn(-c3ccccc3)n2)CCCN1C(=O)OC(C)(C)C	ZINC000819180882	HG	On-Demand	Mild	SLC12A5	41	35
C=CC[C@@]1(C(=O)NCc2ncn(-c3ccccc3)n2)CCCN1C(=O)OC(C)(C)C	ZINC000819180883	HG	On-Demand	Mild	SLC12A5	41	35
Cn1cc(-c2cccc(C(=O)NCc3ncn(-c4ccccc4)n3)c2)cn1	ZINC000819180888	FF	On-Demand	Anodyne	MAPK10	20	40
O=S(=O)(NCCNC[C@H](O)c1ccc(C(F)(F)F)cc1)c1cccnc1	ZINC000819180918	GD	On-Demand	Anodyne	ADRB2	28	46
O=S(=O)(NCCNC[C@H](O)c1ccc(C(F)(F)F)cc1)c1cccnc1	ZINC000819180918	GD	On-Demand	Anodyne	ADRB1	26	44
O=S(=O)(NCCNC[C@H](O)c1ccc(C(F)(F)F)cc1)c1cccnc1	ZINC000819180918	GD	On-Demand	Anodyne	ADRB3	101	49
O=S(=O)(NCCNC[C@H](O)c1ccc(C(F)(F)F)cc1)c1cccnc1	ZINC000819180918	GD	On-Demand	Anodyne	TBXA2R	18	43
O=S(=O)(NCCNC[C@H](O)c1ccc(C(F)(F)F)cc1)c1cccnc1	ZINC000819180918	GD	On-Demand	Anodyne	TBXAS1	39	48
O=S(=O)(NCCNC[C@@H](O)c1ccc(C(F)(F)F)cc1)c1cccnc1	ZINC000819180919	GD	On-Demand	Anodyne	ADRB2	28	46
O=S(=O)(NCCNC[C@@H](O)c1ccc(C(F)(F)F)cc1)c1cccnc1	ZINC000819180919	GD	On-Demand	Anodyne	ADRB1	26	44
O=S(=O)(NCCNC[C@@H](O)c1ccc(C(F)(F)F)cc1)c1cccnc1	ZINC000819180919	GD	On-Demand	Anodyne	ADRB3	101	49
O=S(=O)(NCCNC[C@@H](O)c1ccc(C(F)(F)F)cc1)c1cccnc1	ZINC000819180919	GD	On-Demand	Anodyne	TBXA2R	18	43
O=S(=O)(NCCNC[C@@H](O)c1ccc(C(F)(F)F)cc1)c1cccnc1	ZINC000819180919	GD	On-Demand	Anodyne	TBXAS1	39	48
COc1ccc(OC)c([C@H](O)CNCCNS(=O)(=O)c2cccnc2)c1	ZINC000819180961	GC	On-Demand	Anodyne	ADRB2	31	43
COc1ccc(OC)c([C@H](O)CNCCNS(=O)(=O)c2cccnc2)c1	ZINC000819180961	GC	On-Demand	Anodyne	ADRB1	35	44
COc1ccc(OC)c([C@H](O)CNCCNS(=O)(=O)c2cccnc2)c1	ZINC000819180961	GC	On-Demand	Anodyne	ADRB3	88	44
COc1ccc(OC)c([C@H](O)CNCCNS(=O)(=O)c2cccnc2)c1	ZINC000819180961	GC	On-Demand	Anodyne	TBXAS1	32	43
C[C@H](CC(=O)NCc1ncn(-c2ccccc2)n1)NC(=O)OC(C)(C)C	ZINC000819181007	FE	On-Demand	Anodyne	FPR1	48	35
C[C@@H](CC(=O)NCc1ncn(-c2ccccc2)n1)NC(=O)OC(C)(C)C	ZINC000819181008	FE	On-Demand	Anodyne	FPR1	48	35
O=C(NCc1ncn(-c2ccccc2)n1)c1cc2ccccc2oc1=O	ZINC000819181010	EE	On-Demand	Anodyne	MAOB	15	53
CC1(C)CCC[C@H]1CNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819181013	EF	On-Demand	Anodyne	L3MBTL3	52	34
CC1(C)CCC[C@H]1CNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819181013	EF	On-Demand	Anodyne	NAMPT	21	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	ACE	20	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	CELA1	15	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	MME	20	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	CASP3	16	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	BMP1	18	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	KLK3	83	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	CTSB	75	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	PAPA1_CARPA	81	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	CYSP_TRYCR	57	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	CTSK	41	51
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	CTSL	48	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	PGA	23	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	CAPNS1	73	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	HLA-DRB1	47	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	MMP11	47	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	CTSS	20	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	CAPN1	95	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	CASP1	27	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	CAPN2	146	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	TPSAB1	29	53
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	NPR	81	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	PSMB5	53	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	CARM1	47	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181022	GE	On-Demand	Anodyne	Q6PRC7_IXORI	55	40
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc2c(c1)CCO2	ZINC000819181023	DE	On-Demand	Anodyne	TBXA2R	20	42
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)NCc2ncn(-c3ccccc3)n2)C1	ZINC000819181027	GF	On-Demand	Anodyne	GPR119	46	43
CC1(C)CCC[C@H]1CNC(=O)c1ccc(CN2CCCCC2=O)cc1	ZINC000819181029	EH	On-Demand	Anodyne	CACNA1I	44	36
CCOC(=O)N1CCC(C(=O)NCc2ncn(-c3ccccc3)n2)CC1	ZINC000819181040	FD	On-Demand	Anodyne	P2RY12	104	40
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NCc2ncn(-c3ccccc3)n2)ccc1Cl	ZINC000819181046	IF	On-Demand	Anodyne	RPA1	40	36
O=C(NCc1ncn(-c2ccccc2)n1)c1cccn2c(I)cnc12	ZINC000819181051	IE	On-Demand	Anodyne	POLR1A	57	32
CC1(C)CCC[C@H]1CNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819181063	GG	On-Demand	Anodyne	CNR2	16	44
CC1(C)CCC[C@H]1CNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819181063	GG	On-Demand	Anodyne	CACNA1I	73	37
O=C(NCc1ncn(-c2ccccc2)n1)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819181073	HF	On-Demand	Anodyne	GRIN2B	26	50
O=C(NCc1ncn(-c2ccccc2)n1)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819181073	HF	On-Demand	Anodyne	PREP	30	41
O=C(NCc1ncn(-c2ccccc2)n1)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819181073	HF	On-Demand	Anodyne	EPHX2	23	40
O=C(NCc1ncn(-c2ccccc2)n1)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819181073	HF	On-Demand	Anodyne	TGM2	33	41
O=C(NCc1ncn(-c2ccccc2)n1)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819181073	HF	On-Demand	Anodyne	F13A1	31	41
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819181076	HD	On-Demand	Anodyne	Q9NAW4_PLAFA	43	53
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819181076	HD	On-Demand	Anodyne	TMPRSS11D	42	34
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819181076	HD	On-Demand	Anodyne	VHL	69	40
CC1(C)CCC[C@H]1CNC(=O)COc1ccc2ccc(=O)oc2c1	ZINC000819181132	EG	On-Demand	Anodyne	MAOA	53	44
CC1(C)CCC[C@H]1CNC(=O)COc1ccc2ccc(=O)oc2c1	ZINC000819181132	EG	On-Demand	Anodyne	MAOB	21	44
CC1(C)CCC[C@H]1CNC(=O)c1ccc(NC(=O)OCC(F)(F)F)cc1	ZINC000819181151	FI	On-Demand	Anodyne	GIPR	42	35
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819181153	GF	On-Demand	Anodyne	CARM1	46	37
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819181153	GF	On-Demand	Anodyne	PDS	44	36
O=C(NCc1ncn(-c2ccccc2)n1)[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819181154	GF	On-Demand	Anodyne	CARM1	46	37
O=C(NCc1ncn(-c2ccccc2)n1)[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819181154	GF	On-Demand	Anodyne	PDS	44	36
Cc1oc(-c2cccs2)nc1C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181155	FG	On-Demand	Anodyne	GPR142	42	33
CC1(C)CCC[C@H]1CNC(=O)Cn1c(S)nc2ccccc2c1=O	ZINC000819181162	EF	On-Demand	Anodyne	AVPR1B	41	41
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181163	IG	On-Demand	Anodyne	OPRM1	16	40
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181163	IG	On-Demand	Anodyne	OPRD1	63	37
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181163	IG	On-Demand	Anodyne	CFTR	66	38
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181163	IG	On-Demand	Anodyne	ADAM9	58	34
CC1(C)CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000819181170	DG	On-Demand	Bother	CACNA1I	49	32
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181171	HF	On-Demand	Anodyne	PAPA1_CARPA	40	53
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181171	HF	On-Demand	Anodyne	CCKAR	27	47
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181171	HF	On-Demand	Anodyne	REN	47	41
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181171	HF	On-Demand	Anodyne	FPR1	69	50
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181172	HF	On-Demand	Anodyne	PAPA1_CARPA	40	53
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181172	HF	On-Demand	Anodyne	CCKAR	27	47
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181172	HF	On-Demand	Anodyne	REN	47	41
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181172	HF	On-Demand	Anodyne	FPR1	69	50
O=C(Cc1ccc(S(=O)(=O)C(F)F)cc1)NCc1ncn(-c2ccccc2)n1	ZINC000819181173	HE	On-Demand	Anodyne	CA5B	33	44
O=C(Cc1ccc(S(=O)(=O)C(F)F)cc1)NCc1ncn(-c2ccccc2)n1	ZINC000819181173	HE	On-Demand	Anodyne	CA5A	38	44
NS(=O)(=O)c1ccc(Br)c(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819181179	ID	On-Demand	Anodyne	CA2	67	48
NS(=O)(=O)c1ccc(Br)c(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819181179	ID	On-Demand	Anodyne	CA1	52	43
NS(=O)(=O)c1ccc(Br)c(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819181179	ID	On-Demand	Anodyne	CA5B	49	38
NS(=O)(=O)c1ccc(Br)c(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819181179	ID	On-Demand	Anodyne	CA4	52	48
NS(=O)(=O)c1ccc(Br)c(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819181179	ID	On-Demand	Anodyne	CA5A	56	38
NS(=O)(=O)c1ccc(Br)c(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819181179	ID	On-Demand	Anodyne	CA12	31	43
NS(=O)(=O)c1ccc(Br)c(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819181179	ID	On-Demand	Anodyne	CA9	35	43
Cn1cc(/C=C/C(=O)NCc2ncn(-c3ccccc3)n2)cn1	ZINC000819181191	DD	On-Demand	Anodyne	HDAC1	27	40
Cn1cc(/C=C/C(=O)NCc2ncn(-c3ccccc3)n2)cn1	ZINC000819181191	DD	On-Demand	Anodyne	HDAC6	25	40
Cn1cc(/C=C\C(=O)NCc2ncn(-c3ccccc3)n2)cn1	ZINC000819181192	DD	On-Demand	Anodyne	HDAC1	27	40
Cn1cc(/C=C\C(=O)NCc2ncn(-c3ccccc3)n2)cn1	ZINC000819181192	DD	On-Demand	Anodyne	HDAC6	25	40
CC1(C)CCC[C@H]1CNC(=O)c1ccc(N2CCOCC2)nc1	ZINC000819181221	DE	On-Demand	Anodyne	HPGDS	25	50
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819181225	HD	On-Demand	Anodyne	CA2	31	41
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819181225	HD	On-Demand	Anodyne	CA1	24	40
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819181225	HD	On-Demand	Anodyne	CA4	29	41
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819181225	HD	On-Demand	Anodyne	CA9	17	40
CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1	ZINC000819181238	HG	On-Demand	Anodyne	PAPA1_CARPA	34	41
CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1	ZINC000819181238	HG	On-Demand	Anodyne	FPR1	46	34
CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1	ZINC000819181238	HG	On-Demand	Anodyne	AMP1_PLAFQ	40	50
CN(C)S(=O)(=O)c1cc(C(=O)NC[C@H]2CCCC2(C)C)ccc1Cl	ZINC000819181260	FG	On-Demand	Anodyne	CACNA1I	46	39
CN(C)S(=O)(=O)c1cc(C(=O)NC[C@@H]2CCCC2(C)C)ccc1Cl	ZINC000819181261	FG	On-Demand	Anodyne	CACNA1I	46	39
O=C(CCCn1ccccc1=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181276	ED	On-Demand	Anodyne	HTR7	24	40
CC1(C)CCC[C@H]1CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819181280	CH	On-Demand	Anodyne	ACE	53	39
CC1(C)CCC[C@H]1CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819181280	CH	On-Demand	Anodyne	MME	86	39
CC1(C)CCC[C@H]1CNC(=O)[C@@H](F)Cc1ccccc1	ZINC000819181280	CH	On-Demand	Anodyne	TIMP3	72	37
CC1(C)CCC[C@H]1CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819181282	CH	On-Demand	Anodyne	ACE	53	39
CC1(C)CCC[C@H]1CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819181282	CH	On-Demand	Anodyne	MME	86	39
CC1(C)CCC[C@H]1CNC(=O)[C@H](F)Cc1ccccc1	ZINC000819181282	CH	On-Demand	Anodyne	TIMP3	72	37
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(CS(=O)(=O)C(F)F)cc1	ZINC000819181290	HE	On-Demand	Anodyne	NAMPT	30	40
C#CC[C@]1(C(=O)NCc2ncn(-c3ccccc3)n2)CCCN1C(=O)OC(C)(C)C	ZINC000819181296	HF	On-Demand	Mild	SLC12A5	47	35
C#CC[C@@]1(C(=O)NCc2ncn(-c3ccccc3)n2)CCCN1C(=O)OC(C)(C)C	ZINC000819181297	HF	On-Demand	Mild	SLC12A5	47	35
C#CCCCCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181300	CE	On-Demand	Mild	HDAC10	15	40
O=C(Nc1ccccc1C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1	ZINC000819181305	GG	On-Demand	Anodyne	HCAR2	15	41
COC(=O)Nc1cc(C(=O)NCc2ncn(-c3ccccc3)n2)cc(C(F)(F)F)c1	ZINC000819181311	HG	On-Demand	Anodyne	CARM1	54	35
COC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181326	GD	On-Demand	Anodyne	PGC	51	35
COC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181326	GD	On-Demand	Anodyne	PAPA1_CARPA	51	48
COC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181326	GD	On-Demand	Anodyne	CTSL	16	48
COC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181326	GD	On-Demand	Anodyne	TACR3	15	43
COC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181326	GD	On-Demand	Anodyne	REN	56	39
COC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181326	GD	On-Demand	Anodyne	SCN10A	20	40
COC[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181326	GD	On-Demand	Anodyne	FPR1	50	40
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181327	GD	On-Demand	Anodyne	PGC	51	35
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181327	GD	On-Demand	Anodyne	PAPA1_CARPA	51	48
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181327	GD	On-Demand	Anodyne	CTSL	16	48
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181327	GD	On-Demand	Anodyne	TACR3	15	43
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181327	GD	On-Demand	Anodyne	REN	56	39
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181327	GD	On-Demand	Anodyne	SCN10A	20	40
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181327	GD	On-Demand	Anodyne	FPR1	50	40
CN(C(=O)c1cccs1)c1ccccc1C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819181345	FJ	On-Demand	Anodyne	HCN1	43	32
CN(C(=O)c1cccs1)c1ccccc1C(=O)NC[C@@H]1CCCC1(C)C	ZINC000819181345	FJ	On-Demand	Anodyne	HCN4	41	32
CN(C(=O)c1cccs1)c1ccccc1C(=O)NC[C@H]1CCCC1(C)C	ZINC000819181346	FJ	On-Demand	Anodyne	HCN1	43	32
CN(C(=O)c1cccs1)c1ccccc1C(=O)NC[C@H]1CCCC1(C)C	ZINC000819181346	FJ	On-Demand	Anodyne	HCN4	41	32
O=C(NCc1ncn(-c2ccccc2)n1)c1cnc(Cl)c(Cl)c1	ZINC000819181347	EF	On-Demand	Anodyne	P2RX7	16	41
O=C(NCc1ncn(-c2ccccc2)n1)c1cnc(Cl)c(Cl)c1	ZINC000819181347	EF	On-Demand	Anodyne	SCN10A	34	40
O=C(CCN1CCOCC1)NCc1ncn(-c2ccccc2)n1	ZINC000819181350	DC	On-Demand	Anodyne	HTR1A	16	41
O=C(CCN1CCOCC1)NCc1ncn(-c2ccccc2)n1	ZINC000819181350	DC	On-Demand	Anodyne	CASR	41	35
O=C(CCN1CCOCC1)NCc1ncn(-c2ccccc2)n1	ZINC000819181350	DC	On-Demand	Anodyne	HTR7	36	45
O=C(CCN1CCOCC1)NCc1ncn(-c2ccccc2)n1	ZINC000819181350	DC	On-Demand	Anodyne	ADCY5	17	40
O=C(CCN1CCOCC1)NCc1ncn(-c2ccccc2)n1	ZINC000819181350	DC	On-Demand	Anodyne	PTGDS	31	40
O=C(CCN1CCOCC1)NCc1ncn(-c2ccccc2)n1	ZINC000819181350	DC	On-Demand	Anodyne	EPHX2	15	41
O=C(CCN1CCOCC1)NCc1ncn(-c2ccccc2)n1	ZINC000819181350	DC	On-Demand	Anodyne	HPGDS	23	41
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000819181357	GE	On-Demand	Anodyne	CA2	17	43
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000819181357	GE	On-Demand	Anodyne	CYP24A1	28	40
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000819181367	ID	On-Demand	Anodyne	NR1H4	15	41
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000819181367	ID	On-Demand	Anodyne	STAT6	46	31
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000819181367	ID	On-Demand	Anodyne	NAMPT	38	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	MME	68	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	CTSD	22	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	PGC	64	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	CMA1	41	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	FCER2	72	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	CTSB	53	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	PAPA1_CARPA	86	61
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	CYSP_TRYCR	64	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	CCKAR	62	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	CTSK	29	61
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	CTSL	68	61
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	CACNA1B	49	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	PGA	37	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	TIMP3	61	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	TACR3	25	52
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	CAPNS1	63	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	HLA-DRB1	44	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	REN	96	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	REN1	30	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	CCKBR	21	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	CTSS	31	61
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	CAPN1	76	51
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	CAPN2	83	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	SCN10A	25	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	CTSV	50	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	FPR1	80	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	CTRB_BOVIN	30	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181371	HG	On-Demand	Anodyne	PSMB5	49	34
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819181382	HF	On-Demand	Anodyne	GRIN2B	22	45
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819181382	HF	On-Demand	Anodyne	PREP	40	45
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819181382	HF	On-Demand	Anodyne	DPP7	40	39
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819181382	HF	On-Demand	Anodyne	BIRC2	17	47
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819181382	HF	On-Demand	Anodyne	TMPRSS11D	58	38
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819181383	HF	On-Demand	Anodyne	GRIN2B	22	45
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819181383	HF	On-Demand	Anodyne	PREP	40	45
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819181383	HF	On-Demand	Anodyne	DPP7	40	39
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819181383	HF	On-Demand	Anodyne	BIRC2	17	47
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819181383	HF	On-Demand	Anodyne	TMPRSS11D	58	38
O=C(NCc1ncn(-c2ccccc2)n1)c1c(O)cccc1Cl	ZINC000819181401	EF	On-Demand	Anodyne	P2RX7	15	43
CC(C)(C)OC(=O)NC[C@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1	ZINC000819181405	HG	On-Demand	Anodyne	FPR1	41	34
CC(C)(C)OC(=O)NC[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1	ZINC000819181406	HG	On-Demand	Anodyne	FPR1	41	34
O=C(NCc1ncn(-c2ccccc2)n1)c1cccnc1-n1cccn1	ZINC000819181407	ED	On-Demand	Anodyne	AMP1_PLAFQ	42	37
C[C@@]1(C(=O)NCc2ncn(-c3ccccc3)n2)CCN(C(=O)OCc2ccccc2)C1	ZINC000819181416	HF	On-Demand	Anodyne	SLC12A5	49	35
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	ZINC000819181426	HD	On-Demand	Anodyne	CCR8	60	36
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	ZINC000819181426	HD	On-Demand	Anodyne	SFRP1	117	37
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	ZINC000819181426	HD	On-Demand	Anodyne	WNT3	75	33
O=C(N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181433	IH	On-Demand	Anodyne	KLK3	64	34
O=C(N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181433	IH	On-Demand	Anodyne	CTSB	59	40
O=C(N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181433	IH	On-Demand	Anodyne	PAPA1_CARPA	50	34
O=C(N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181433	IH	On-Demand	Anodyne	CYSP_TRYCR	53	38
O=C(N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181433	IH	On-Demand	Anodyne	CTSK	32	40
O=C(N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181433	IH	On-Demand	Anodyne	CTSL	42	38
O=C(N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181433	IH	On-Demand	Anodyne	CAPNS1	65	37
O=C(N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181433	IH	On-Demand	Anodyne	CAPN1	79	41
O=C(N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181433	IH	On-Demand	Anodyne	CAPN2	130	40
O=C(N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181433	IH	On-Demand	Anodyne	NPR	64	35
O=C(N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181433	IH	On-Demand	Anodyne	AMP1_PLAFQ	40	34
O=C(N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181433	IH	On-Demand	Anodyne	CARM1	23	40
O=C(N[C@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181434	IH	On-Demand	Anodyne	KLK3	64	34
O=C(N[C@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181434	IH	On-Demand	Anodyne	CTSB	59	40
O=C(N[C@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181434	IH	On-Demand	Anodyne	PAPA1_CARPA	50	34
O=C(N[C@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181434	IH	On-Demand	Anodyne	CYSP_TRYCR	53	38
O=C(N[C@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181434	IH	On-Demand	Anodyne	CTSK	32	40
O=C(N[C@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181434	IH	On-Demand	Anodyne	CTSL	42	38
O=C(N[C@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181434	IH	On-Demand	Anodyne	CAPNS1	65	37
O=C(N[C@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181434	IH	On-Demand	Anodyne	CAPN1	79	41
O=C(N[C@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181434	IH	On-Demand	Anodyne	CAPN2	130	40
O=C(N[C@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181434	IH	On-Demand	Anodyne	NPR	64	35
O=C(N[C@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181434	IH	On-Demand	Anodyne	AMP1_PLAFQ	40	34
O=C(N[C@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1ccccc1)OCc1ccccc1	ZINC000819181434	IH	On-Demand	Anodyne	CARM1	23	40
COc1cccc([C@H](O)C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819181450	ED	On-Demand	Anodyne	DRD4	41	32
COc1cccc([C@H](O)C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819181450	ED	On-Demand	Anodyne	MTNR1A	22	40
COc1cccc([C@H](O)C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819181450	ED	On-Demand	Anodyne	MTNR1B	23	40
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000819181471	HF	On-Demand	Anodyne	P2RX7	56	56
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CC(=O)N(Cc2ccccc2Cl)C1	ZINC000819181472	HF	On-Demand	Anodyne	P2RX7	56	56
CN(CCCC(=O)NCc1ncn(-c2ccccc2)n1)C1=NS(=O)(=O)c2ccccc21	ZINC000819181485	ID	On-Demand	Anodyne	KCNA3	41	46
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181490	HD	On-Demand	Anodyne	FPR1	48	35
CC1(C)CCC[C@H]1CNC(=O)c1csc(C=O)c1	ZINC000819181509	CG	On-Demand	Anodyne	CACNA1I	43	31
CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1cccc(Cl)c1	ZINC000819181512	IH	On-Demand	Anodyne	FPR1	40	36
CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)c1cccc(Cl)c1	ZINC000819181512	IH	On-Demand	Anodyne	AMP1_PLAFQ	19	42
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(N2CCCS2(=O)=O)cc1Cl	ZINC000819181522	IE	On-Demand	Anodyne	CDK1	16	44
Cc1nc(SC(F)(F)F)sc1CC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819181527	HH	On-Demand	Anodyne	P2RX7	25	41
O=C(CCSc1nc2ccccc2s1)NCc1ncn(-c2ccccc2)n1	ZINC000819181530	GH	On-Demand	Anodyne	HMOX2	31	42
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819181533	GF	On-Demand	Anodyne	F2	58	39
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819181533	GF	On-Demand	Anodyne	TRY1_BOVIN	48	39
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819181533	GF	On-Demand	Anodyne	CPT1A	54	35
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819181533	GF	On-Demand	Anodyne	PREP	67	52
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819181533	GF	On-Demand	Anodyne	TMPRSS11D	68	37
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819181534	GF	On-Demand	Anodyne	F2	58	39
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819181534	GF	On-Demand	Anodyne	TRY1_BOVIN	48	39
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819181534	GF	On-Demand	Anodyne	CPT1A	54	35
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819181534	GF	On-Demand	Anodyne	PREP	67	52
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819181534	GF	On-Demand	Anodyne	TMPRSS11D	68	37
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Cl)c2ncccc12	ZINC000819181536	GF	On-Demand	Anodyne	RPA1	41	32
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-n2ccnc2)nc1	ZINC000819181538	FD	On-Demand	Anodyne	NOS2	95	37
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-n2ccnc2)nc1	ZINC000819181538	FD	On-Demand	Anodyne	NAMPT	26	53
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-c2nccs2)cc1	ZINC000819181542	GF	On-Demand	Anodyne	LTA4H	23	47
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-c2nccs2)cc1	ZINC000819181542	GF	On-Demand	Anodyne	HDAC2	15	41
O=C(NCCS(=O)(=O)NCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181544	GD	On-Demand	Anodyne	NAMPT	36	43
O=C(NCCS(=O)(=O)NCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181544	GD	On-Demand	Anodyne	TMPRSS11D	92	37
O=C(NCCCc1nc2ccccc2[nH]1)NCc1ccc(C(=O)O)cc1	ZINC000819181547	FF	On-Demand	Anodyne	PIN1	24	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-n2cccn2)c(F)c1	ZINC000819181552	GD	On-Demand	Anodyne	NPY2R	66	37
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000819181553	FE	On-Demand	Anodyne	MAOB	16	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000819181553	FE	On-Demand	Anodyne	F2R	41	31
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000819181553	FE	On-Demand	Anodyne	ERBB4	42	34
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000819181553	FE	On-Demand	Anodyne	ENV	40	34
O=C(NCC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181556	ED	On-Demand	Anodyne	PLG	48	34
O=C(NCC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181556	ED	On-Demand	Anodyne	PPIA	17	40
O=C(NCC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181556	ED	On-Demand	Anodyne	GRIN2B	16	41
O=C(NCC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181556	ED	On-Demand	Anodyne	TRYP_PIG	45	32
O=C(NCC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181556	ED	On-Demand	Anodyne	HDAC1	15	43
O=C(NCC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181556	ED	On-Demand	Anodyne	CAPN2	45	36
O=C(NCC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181556	ED	On-Demand	Anodyne	TPSAB1	26	42
O=C(NCC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181556	ED	On-Demand	Anodyne	PROC	68	35
O=C(NCC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181556	ED	On-Demand	Anodyne	NPR	46	32
O=C(NCC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181556	ED	On-Demand	Anodyne	SLC12A5	63	35
O=C(NCC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181556	ED	On-Demand	Anodyne	TMPRSS11D	85	36
O=C(NCC(=O)OCc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181556	ED	On-Demand	Anodyne	PDS	44	34
O=C(NCCO)c1ccc(N2CC[C@@H](C(=O)O)C2)nn1	ZINC000819181557	CB	On-Demand	Anodyne	SCD1	68	60
O=C(NCCO)c1ccc(N2CC[C@@H](C(=O)O)C2)nn1	ZINC000819181557	CB	On-Demand	Anodyne	SCD	55	52
O=C(NCCO)c1ccc(N2CC[C@H](C(=O)O)C2)nn1	ZINC000819181558	CB	On-Demand	Anodyne	SCD1	68	60
O=C(NCCO)c1ccc(N2CC[C@H](C(=O)O)C2)nn1	ZINC000819181558	CB	On-Demand	Anodyne	SCD	55	52
O=C(NCCn1c(O)nc2ccccc21)NCc1ccc(C(=O)O)cc1	ZINC000819181559	FD	On-Demand	Anodyne	FABI	49	33
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-n2cnnn2)cc1	ZINC000819181560	FC	On-Demand	Anodyne	KCNJ1	48	37
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-n2cnnn2)cc1	ZINC000819181560	FC	On-Demand	Anodyne	RPA1	43	32
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000819181566	FF	On-Demand	Anodyne	MAOB	18	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000819181566	FF	On-Demand	Anodyne	RPA1	82	39
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-n2cccn2)cc1	ZINC000819181567	FD	On-Demand	Anodyne	AMP1_PLAFQ	64	38
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1c(F)cccc1F	ZINC000819181568	ED	On-Demand	Anodyne	AMP1_PLAFQ	25	41
O=C(NCCCOc1ccccc1F)NCc1ccc(C(=O)O)cc1	ZINC000819181569	EF	On-Demand	Anodyne	HRH2	19	46
O=C(NCCCOc1ccccc1F)NCc1ccc(C(=O)O)cc1	ZINC000819181569	EF	On-Demand	Anodyne	DRD3	16	40
O=C(NCCCOc1ccccc1F)NCc1ccc(C(=O)O)cc1	ZINC000819181569	EF	On-Demand	Anodyne	FURIN	46	34
O=C(NCCNS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181572	GD	On-Demand	Anodyne	CA2	21	47
O=C(NCCNS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181572	GD	On-Demand	Anodyne	TBXA2R	42	35
O=C(NCCNS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181572	GD	On-Demand	Anodyne	CA1	19	47
O=C(NCCNS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181572	GD	On-Demand	Anodyne	CA5B	17	40
O=C(NCCNS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181572	GD	On-Demand	Anodyne	CA4	15	47
O=C(NCCNS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181572	GD	On-Demand	Anodyne	CA5A	19	40
O=C(NCCNS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181572	GD	On-Demand	Anodyne	CA9	15	46
O=C(NCCNS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181572	GD	On-Demand	Anodyne	NAMPT	50	46
O=C(NCCNS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181572	GD	On-Demand	Anodyne	TMPRSS11D	42	32
O=C(NCCS(=O)(=O)N1CCOCC1)NCc1ccc(C(=O)O)cc1	ZINC000819181573	FB	On-Demand	Anodyne	NAMPT	39	41
O=C(NCC[C@H](O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181574	EE	On-Demand	Anodyne	ADRB3	21	47
O=C(NCC[C@H](O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181574	EE	On-Demand	Anodyne	NPY1R	20	42
O=C(NCC[C@H](O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181574	EE	On-Demand	Anodyne	FURIN	54	37
O=C(NCC[C@H](O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181574	EE	On-Demand	Anodyne	PROC	49	33
O=C(NCC[C@H](O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181574	EE	On-Demand	Anodyne	TMPRSS11D	70	33
O=C(NCC[C@@H](O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181575	EE	On-Demand	Anodyne	ADRB3	21	47
O=C(NCC[C@@H](O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181575	EE	On-Demand	Anodyne	NPY1R	20	42
O=C(NCC[C@@H](O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181575	EE	On-Demand	Anodyne	FURIN	54	37
O=C(NCC[C@@H](O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181575	EE	On-Demand	Anodyne	PROC	49	33
O=C(NCC[C@@H](O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181575	EE	On-Demand	Anodyne	TMPRSS11D	70	33
O=C(NCCS(=O)(=O)NC1CC1)NCc1ccc(C(=O)O)cc1	ZINC000819181576	EC	On-Demand	Anodyne	PLG	46	32
O=C(NCCS(=O)(=O)NC1CC1)NCc1ccc(C(=O)O)cc1	ZINC000819181576	EC	On-Demand	Anodyne	TRYP_PIG	46	32
O=C(NCCS(=O)(=O)NC1CC1)NCc1ccc(C(=O)O)cc1	ZINC000819181576	EC	On-Demand	Anodyne	TMPRSS11D	81	34
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1F	ZINC000819181577	GG	On-Demand	Anodyne	DHODH	27	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1F	ZINC000819181577	GG	On-Demand	Anodyne	HDAC1	29	45
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1F	ZINC000819181577	GG	On-Demand	Anodyne	HDAC2	27	45
O=C(NCCOc1ccc2c(c1)OCO2)NCc1ccc(C(=O)O)cc1	ZINC000819181583	FD	On-Demand	Anodyne	HRH2	24	46
O=C(NCCOc1ccc2c(c1)OCO2)NCc1ccc(C(=O)O)cc1	ZINC000819181583	FD	On-Demand	Anodyne	EDNRB	62	42
O=C(NCCOc1ccc2c(c1)OCO2)NCc1ccc(C(=O)O)cc1	ZINC000819181583	FD	On-Demand	Anodyne	EDNRA	68	42
O=C(NCCOc1ccc2c(c1)OCO2)NCc1ccc(C(=O)O)cc1	ZINC000819181583	FD	On-Demand	Anodyne	BMP1	58	44
O=C(NCCOc1ccc2c(c1)OCO2)NCc1ccc(C(=O)O)cc1	ZINC000819181583	FD	On-Demand	Anodyne	NOS2	93	35
O=C(NCCOc1ccc2c(c1)OCO2)NCc1ccc(C(=O)O)cc1	ZINC000819181583	FD	On-Demand	Anodyne	MCHR1	18	48
O=C(NCCCC(=O)N1CCC(C(=O)O)CC1)c1cccnc1	ZINC000819181584	DC	On-Demand	Anodyne	DRD4	42	32
O=C(NCCCC(=O)N1CCC(C(=O)O)CC1)c1cccnc1	ZINC000819181584	DC	On-Demand	Anodyne	DRD3	24	55
O=C(NCCCC(=O)N1CCC(C(=O)O)CC1)c1cccnc1	ZINC000819181584	DC	On-Demand	Anodyne	TBXAS1	63	39
O=C(NCCCC(=O)N1CCC(C(=O)O)CC1)c1cccnc1	ZINC000819181584	DC	On-Demand	Anodyne	PTAFR	24	41
O=C(NCCCC(=O)N1CCC(C(=O)O)CC1)c1cccnc1	ZINC000819181584	DC	On-Demand	Anodyne	C3AR1	43	41
O=C(NCCCC(=O)N1CCC(C(=O)O)CC1)c1cccnc1	ZINC000819181584	DC	On-Demand	Anodyne	PREP	25	47
O=C(NCCCC(=O)N1CCC(C(=O)O)CC1)c1cccnc1	ZINC000819181584	DC	On-Demand	Anodyne	NAMPT	32	45
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cc(Cl)cc2cccnc12	ZINC000819181585	GF	On-Demand	Anodyne	PDE4C	17	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cc(Cl)cc2cccnc12	ZINC000819181585	GF	On-Demand	Anodyne	SUCNR1	44	36
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(F)c(C(F)(F)F)c1	ZINC000819181586	GF	On-Demand	Anodyne	TAAR1	21	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(F)c(C(F)(F)F)c1	ZINC000819181586	GF	On-Demand	Anodyne	TRPM8	23	40
O=C(NCCNC(=O)N1CC[C@@H](C(=O)O)C1)c1cccnc1	ZINC000819181588	DB	On-Demand	Anodyne	DRD4	41	31
O=C(NCCNC(=O)N1CC[C@@H](C(=O)O)C1)c1cccnc1	ZINC000819181588	DB	On-Demand	Anodyne	SLC6A1	49	34
O=C(NCCNC(=O)N1CC[C@@H](C(=O)O)C1)c1cccnc1	ZINC000819181588	DB	On-Demand	Anodyne	TBXAS1	36	40
O=C(NCCNC(=O)N1CC[C@@H](C(=O)O)C1)c1cccnc1	ZINC000819181588	DB	On-Demand	Anodyne	EPHX2	16	52
O=C(NCCNC(=O)N1CC[C@@H](C(=O)O)C1)c1cccnc1	ZINC000819181588	DB	On-Demand	Anodyne	NAMPT	47	40
O=C(NCCNC(=O)N1CC[C@H](C(=O)O)C1)c1cccnc1	ZINC000819181589	DB	On-Demand	Anodyne	DRD4	41	31
O=C(NCCNC(=O)N1CC[C@H](C(=O)O)C1)c1cccnc1	ZINC000819181589	DB	On-Demand	Anodyne	SLC6A1	49	34
O=C(NCCNC(=O)N1CC[C@H](C(=O)O)C1)c1cccnc1	ZINC000819181589	DB	On-Demand	Anodyne	TBXAS1	36	40
O=C(NCCNC(=O)N1CC[C@H](C(=O)O)C1)c1cccnc1	ZINC000819181589	DB	On-Demand	Anodyne	EPHX2	16	52
O=C(NCCNC(=O)N1CC[C@H](C(=O)O)C1)c1cccnc1	ZINC000819181589	DB	On-Demand	Anodyne	NAMPT	47	40
O=C(NCCCCN1CCOCC1)NCc1ccc(C(=O)O)cc1	ZINC000819181591	ED	On-Demand	Anodyne	HTR1A	20	43
O=C(NCCCCN1CCOCC1)NCc1ccc(C(=O)O)cc1	ZINC000819181591	ED	On-Demand	Anodyne	DRD2	25	45
O=C(NCCCCN1CCOCC1)NCc1ccc(C(=O)O)cc1	ZINC000819181591	ED	On-Demand	Anodyne	DRD3	44	45
O=C(NCCCCN1CCOCC1)NCc1ccc(C(=O)O)cc1	ZINC000819181591	ED	On-Demand	Anodyne	TACR2	17	43
O=C(NCCCCN1CCOCC1)NCc1ccc(C(=O)O)cc1	ZINC000819181591	ED	On-Demand	Anodyne	CCR3	21	51
O=C(NCCCCN1CCOCC1)NCc1ccc(C(=O)O)cc1	ZINC000819181591	ED	On-Demand	Anodyne	EPHX2	30	47
O=C(NCCCCN1CCOCC1)NCc1ccc(C(=O)O)cc1	ZINC000819181591	ED	On-Demand	Anodyne	CYP2J2	48	34
O=C(NCCCCN1CCOCC1)NCc1ccc(C(=O)O)cc1	ZINC000819181591	ED	On-Demand	Anodyne	HPGDS	23	40
O=C(NCCCCN1CCOCC1)NCc1ccc(C(=O)O)cc1	ZINC000819181591	ED	On-Demand	Anodyne	NAMPT	18	43
O=C(NCCCS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181592	GE	On-Demand	Anodyne	CA2	20	52
O=C(NCCCS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181592	GE	On-Demand	Anodyne	CA1	18	52
O=C(NCCCS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181592	GE	On-Demand	Anodyne	FURIN	43	33
O=C(NCCCS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181592	GE	On-Demand	Anodyne	NAMPT	64	48
O=C(NCCCS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181592	GE	On-Demand	Anodyne	TMPRSS11D	61	33
O=C(NCCCn1cnc2ccccc21)NCc1ccc(C(=O)O)cc1	ZINC000819181593	FF	On-Demand	Anodyne	NR1I2	45	33
O=C(NCCNc1ccc(C(F)(F)F)cn1)NCc1ccc(C(=O)O)cc1	ZINC000819181594	GF	On-Demand	Anodyne	TRPV1	18	41
O=C(NCCNc1ccc(C(F)(F)F)cn1)NCc1ccc(C(=O)O)cc1	ZINC000819181594	GF	On-Demand	Anodyne	PPARD	15	40
O=C(NCCNc1ccc(C(F)(F)F)cn1)NCc1ccc(C(=O)O)cc1	ZINC000819181594	GF	On-Demand	Anodyne	MTTP	28	40
O=C(NCCNc1ccc(C(F)(F)F)cn1)NCc1ccc(C(=O)O)cc1	ZINC000819181594	GF	On-Demand	Anodyne	TRPM8	40	40
O=C(NCCc1ccc2ccccc2n1)NCc1ccc(C(=O)O)cc1	ZINC000819181595	EF	On-Demand	Anodyne	CYSLTR1	54	53
O=C(NCCc1ccc2ccccc2n1)NCc1ccc(C(=O)O)cc1	ZINC000819181595	EF	On-Demand	Anodyne	SUCNR1	26	40
O=C(NCCCNC(=O)N1CCO[C@@H](C(=O)O)C1)C1CCC1	ZINC000819181596	DB	On-Demand	Anodyne	TBK1	57	36
O=C(NCCCNC(=O)N1CCO[C@H](C(=O)O)C1)C1CCC1	ZINC000819181597	DB	On-Demand	Anodyne	TBK1	57	36
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Br)cc1	ZINC000819181600	GE	On-Demand	Anodyne	UL80	21	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Br)cc1	ZINC000819181600	GE	On-Demand	Anodyne	TPSAB1	15	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Cl)cc1F	ZINC000819181606	FE	On-Demand	Anodyne	TRPV1	15	40
O=C(NCCc1ccc2c(c1)OCO2)NCc1ccc(C(=O)O)cc1	ZINC000819181610	EE	On-Demand	Anodyne	EDNRB	20	40
O=C(NCCc1ccc2c(c1)OCO2)NCc1ccc(C(=O)O)cc1	ZINC000819181610	EE	On-Demand	Anodyne	EDNRA	25	40
O=C(NCCc1ccc2c(c1)OCO2)NCc1ccc(C(=O)O)cc1	ZINC000819181610	EE	On-Demand	Anodyne	BMP1	34	42
O=C(NCCc1ccc2c(c1)OCO2)NCc1ccc(C(=O)O)cc1	ZINC000819181610	EE	On-Demand	Anodyne	NOS2	100	41
O=C(NCCc1ccc2c(c1)OCO2)NCc1ccc(C(=O)O)cc1	ZINC000819181610	EE	On-Demand	Anodyne	MCHR1	16	45
O=C(NCCc1ccn(-c2ccc(F)cc2)n1)NCc1ccc(C(=O)O)cc1	ZINC000819181611	GF	On-Demand	Anodyne	RPA1	42	32
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000819181612	FF	On-Demand	Anodyne	DHODH	16	46
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000819181612	FF	On-Demand	Anodyne	PPARA	17	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000819181612	FF	On-Demand	Anodyne	LTA4H	16	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000819181612	FF	On-Demand	Anodyne	TRPV1	22	49
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000819181612	FF	On-Demand	Anodyne	UL80	27	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000819181612	FF	On-Demand	Anodyne	PPARD	20	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000819181612	FF	On-Demand	Anodyne	MTTP	25	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000819181612	FF	On-Demand	Anodyne	EPHX2	31	57
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000819181612	FF	On-Demand	Anodyne	ACR	16	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000819181612	FF	On-Demand	Anodyne	AMP1_PLAFQ	15	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000819181612	FF	On-Demand	Anodyne	MCHR1	20	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000819181612	FF	On-Demand	Anodyne	GIPR	46	35
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000819181612	FF	On-Demand	Anodyne	TRPM8	49	35
O=C(NCCCc1ccccn1)NCc1ccc(C(=O)O)cc1	ZINC000819181613	DE	On-Demand	Anodyne	HRH2	19	44
O=C(NCCCc1ccccn1)NCc1ccc(C(=O)O)cc1	ZINC000819181613	DE	On-Demand	Anodyne	SUCNR1	27	40
O=C(NCCc1ccccc1[N+](=O)[O-])NCc1ccc(C(=O)O)cc1	ZINC000819181614	EE	On-Demand	Bother	COLA	106	44
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cc(F)c(F)cc1Cl	ZINC000819181615	FF	On-Demand	Anodyne	HEMY	42	35
O=C(NCCO)c1ccc(N2CCC(C(=O)O)CC2)nn1	ZINC000819181616	CB	On-Demand	Anodyne	SCD1	82	65
O=C(NCCO)c1ccc(N2CCC(C(=O)O)CC2)nn1	ZINC000819181616	CB	On-Demand	Anodyne	SCD	66	56
O=C(NCCCNC(=O)C1CCC1)C1=NN(c2ccccc2)[C@H](C(=O)O)C1	ZINC000819181617	FD	On-Demand	Anodyne	TBK1	74	36
O=C(NCCCNC(=O)C1CCC1)C1=NN(c2ccccc2)[C@@H](C(=O)O)C1	ZINC000819181618	FD	On-Demand	Anodyne	TBK1	74	36
O=C(NCCCC(=O)N1CCC[C@@H]1C(=O)O)c1cccnc1	ZINC000819181623	DC	On-Demand	Anodyne	F2	19	45
O=C(NCCCC(=O)N1CCC[C@@H]1C(=O)O)c1cccnc1	ZINC000819181623	DC	On-Demand	Anodyne	ACE	59	48
O=C(NCCCC(=O)N1CCC[C@@H]1C(=O)O)c1cccnc1	ZINC000819181623	DC	On-Demand	Anodyne	FKBP1A	40	44
O=C(NCCCC(=O)N1CCC[C@@H]1C(=O)O)c1cccnc1	ZINC000819181623	DC	On-Demand	Anodyne	DRD4	42	32
O=C(NCCCC(=O)N1CCC[C@@H]1C(=O)O)c1cccnc1	ZINC000819181623	DC	On-Demand	Anodyne	DRD3	26	53
O=C(NCCCC(=O)N1CCC[C@@H]1C(=O)O)c1cccnc1	ZINC000819181623	DC	On-Demand	Anodyne	TBXAS1	56	37
O=C(NCCCC(=O)N1CCC[C@@H]1C(=O)O)c1cccnc1	ZINC000819181623	DC	On-Demand	Anodyne	PTAFR	15	40
O=C(NCCCC(=O)N1CCC[C@@H]1C(=O)O)c1cccnc1	ZINC000819181623	DC	On-Demand	Anodyne	CPT2	42	36
O=C(NCCCC(=O)N1CCC[C@@H]1C(=O)O)c1cccnc1	ZINC000819181623	DC	On-Demand	Anodyne	DPP4	15	65
O=C(NCCCC(=O)N1CCC[C@@H]1C(=O)O)c1cccnc1	ZINC000819181623	DC	On-Demand	Anodyne	PREP	127	55
O=C(NCCCC(=O)N1CCC[C@@H]1C(=O)O)c1cccnc1	ZINC000819181623	DC	On-Demand	Anodyne	NAMPT	18	40
O=C(NCCCC(=O)N1CCC[C@H]1C(=O)O)c1cccnc1	ZINC000819181624	DC	On-Demand	Anodyne	F2	19	45
O=C(NCCCC(=O)N1CCC[C@H]1C(=O)O)c1cccnc1	ZINC000819181624	DC	On-Demand	Anodyne	ACE	59	48
O=C(NCCCC(=O)N1CCC[C@H]1C(=O)O)c1cccnc1	ZINC000819181624	DC	On-Demand	Anodyne	FKBP1A	40	44
O=C(NCCCC(=O)N1CCC[C@H]1C(=O)O)c1cccnc1	ZINC000819181624	DC	On-Demand	Anodyne	DRD4	42	32
O=C(NCCCC(=O)N1CCC[C@H]1C(=O)O)c1cccnc1	ZINC000819181624	DC	On-Demand	Anodyne	DRD3	26	53
O=C(NCCCC(=O)N1CCC[C@H]1C(=O)O)c1cccnc1	ZINC000819181624	DC	On-Demand	Anodyne	TBXAS1	56	37
O=C(NCCCC(=O)N1CCC[C@H]1C(=O)O)c1cccnc1	ZINC000819181624	DC	On-Demand	Anodyne	PTAFR	15	40
O=C(NCCCC(=O)N1CCC[C@H]1C(=O)O)c1cccnc1	ZINC000819181624	DC	On-Demand	Anodyne	CPT2	42	36
O=C(NCCCC(=O)N1CCC[C@H]1C(=O)O)c1cccnc1	ZINC000819181624	DC	On-Demand	Anodyne	DPP4	15	65
O=C(NCCCC(=O)N1CCC[C@H]1C(=O)O)c1cccnc1	ZINC000819181624	DC	On-Demand	Anodyne	PREP	127	55
O=C(NCCCC(=O)N1CCC[C@H]1C(=O)O)c1cccnc1	ZINC000819181624	DC	On-Demand	Anodyne	NAMPT	18	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cc2c(cc1Cl)OCO2	ZINC000819181627	GE	On-Demand	Anodyne	NOS2	55	30
O=C(NCCN1CCN(c2ccccc2)CC1)NCc1ccc(C(=O)O)cc1	ZINC000819181628	GE	On-Demand	Anodyne	HTR1A	96	60
O=C(NCCN1CCN(c2ccccc2)CC1)NCc1ccc(C(=O)O)cc1	ZINC000819181628	GE	On-Demand	Anodyne	DRD2	79	60
O=C(NCCN1CCN(c2ccccc2)CC1)NCc1ccc(C(=O)O)cc1	ZINC000819181628	GE	On-Demand	Anodyne	DRD4	60	51
O=C(NCCN1CCN(c2ccccc2)CC1)NCc1ccc(C(=O)O)cc1	ZINC000819181628	GE	On-Demand	Anodyne	ADRA1D	21	45
O=C(NCCN1CCN(c2ccccc2)CC1)NCc1ccc(C(=O)O)cc1	ZINC000819181628	GE	On-Demand	Anodyne	HTR2A	59	48
O=C(NCCN1CCN(c2ccccc2)CC1)NCc1ccc(C(=O)O)cc1	ZINC000819181628	GE	On-Demand	Anodyne	HTR2C	28	43
O=C(NCCN1CCN(c2ccccc2)CC1)NCc1ccc(C(=O)O)cc1	ZINC000819181628	GE	On-Demand	Anodyne	ADRA1A	32	45
O=C(NCCN1CCN(c2ccccc2)CC1)NCc1ccc(C(=O)O)cc1	ZINC000819181628	GE	On-Demand	Anodyne	ADRA1B	18	45
O=C(NCCN1CCN(c2ccccc2)CC1)NCc1ccc(C(=O)O)cc1	ZINC000819181628	GE	On-Demand	Anodyne	DRD3	94	51
O=C(NCCN1CCN(c2ccccc2)CC1)NCc1ccc(C(=O)O)cc1	ZINC000819181628	GE	On-Demand	Anodyne	HTR7	91	45
O=C(NCCN1CCN(c2ccccc2)CC1)NCc1ccc(C(=O)O)cc1	ZINC000819181628	GE	On-Demand	Anodyne	SIGMAR1	18	46
O=C(NCCN1CCN(c2ccccc2)CC1)NCc1ccc(C(=O)O)cc1	ZINC000819181628	GE	On-Demand	Anodyne	UTS2R	15	40
O=C(NCCN1CCN(c2ccccc2)CC1)NCc1ccc(C(=O)O)cc1	ZINC000819181628	GE	On-Demand	Anodyne	PLD2	69	39
O=C(NCCN1CCN(c2ccccc2)CC1)NCc1ccc(C(=O)O)cc1	ZINC000819181628	GE	On-Demand	Anodyne	CYP2J2	48	34
O=C(NCc1ccc(C(=O)O)cc1)C(=O)N1CCCc2ccc(F)cc21	ZINC000819181631	FE	On-Demand	Anodyne	AVPR2	35	44
O=C(NCCOc1cccc(F)c1)NCc1ccc(C(=O)O)cc1	ZINC000819181634	EE	On-Demand	Anodyne	HRH2	30	53
O=C(NCCOc1cccc(F)c1)NCc1ccc(C(=O)O)cc1	ZINC000819181634	EE	On-Demand	Anodyne	GRIN2B	15	42
O=C(NCCOc1cccc(F)c1)NCc1ccc(C(=O)O)cc1	ZINC000819181634	EE	On-Demand	Anodyne	UL80	21	40
O=C(NCCOc1cccc(F)c1)NCc1ccc(C(=O)O)cc1	ZINC000819181634	EE	On-Demand	Anodyne	PLA2G4B	50	35
O=C(NCCOc1cccc(F)c1)NCc1ccc(C(=O)O)cc1	ZINC000819181634	EE	On-Demand	Anodyne	PDS	64	47
O=C(NCCc1ccc(Cl)nc1)NCc1ccc(C(=O)O)cc1	ZINC000819181636	EE	On-Demand	Anodyne	NACHRBETA2	40	39
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Cl)c(F)c1	ZINC000819181637	FE	On-Demand	Anodyne	MAOB	16	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Cl)c(F)c1	ZINC000819181637	FE	On-Demand	Anodyne	ENV	51	44
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Cl)c(F)c1	ZINC000819181637	FE	On-Demand	Anodyne	RPA1	68	35
O=C(NCCNS(=O)(=O)c1cccnc1)NCc1ccc(C(=O)O)cc1	ZINC000819181638	GC	On-Demand	Anodyne	TBXA2R	35	45
O=C(NCCNS(=O)(=O)c1cccnc1)NCc1ccc(C(=O)O)cc1	ZINC000819181638	GC	On-Demand	Anodyne	TBXAS1	69	48
O=C(NCCNS(=O)(=O)c1cccnc1)NCc1ccc(C(=O)O)cc1	ZINC000819181638	GC	On-Demand	Anodyne	CYP2C9	19	47
O=C(NCCNS(=O)(=O)c1cccnc1)NCc1ccc(C(=O)O)cc1	ZINC000819181638	GC	On-Demand	Anodyne	NAMPT	154	58
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Cc2ccncc2)cc1	ZINC000819181639	GF	On-Demand	Anodyne	LTA4H	17	47
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Cc2ccncc2)cc1	ZINC000819181639	GF	On-Demand	Anodyne	NAMPT	48	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819181646	FG	On-Demand	Anodyne	DHODH	15	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819181646	FG	On-Demand	Anodyne	MME	50	54
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819181646	FG	On-Demand	Anodyne	LTA4H	30	44
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819181646	FG	On-Demand	Anodyne	TPH1	33	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819181646	FG	On-Demand	Anodyne	PRNP	54	45
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819181646	FG	On-Demand	Anodyne	ROCK2	17	50
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819181646	FG	On-Demand	Anodyne	HDAC1	25	44
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819181646	FG	On-Demand	Anodyne	HDAC2	26	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819181646	FG	On-Demand	Anodyne	SLC1A2	21	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819181646	FG	On-Demand	Anodyne	TPSAB1	15	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819181646	FG	On-Demand	Anodyne	NAMPT	29	40
O=C(NCCCC(=O)N1CCO[C@@H](C(=O)O)C1)c1cccnc1	ZINC000819181648	DB	On-Demand	Anodyne	TBXAS1	49	38
O=C(NCCCC(=O)N1CCO[C@H](C(=O)O)C1)c1cccnc1	ZINC000819181649	DB	On-Demand	Anodyne	TBXAS1	49	38
O=C(NCCCC(=O)N1CC[C@@H](C(=O)O)C1)c1cccnc1	ZINC000819181650	DC	On-Demand	Anodyne	DRD4	41	32
O=C(NCCCC(=O)N1CC[C@@H](C(=O)O)C1)c1cccnc1	ZINC000819181650	DC	On-Demand	Anodyne	TBXAS1	55	39
O=C(NCCCC(=O)N1CC[C@@H](C(=O)O)C1)c1cccnc1	ZINC000819181650	DC	On-Demand	Anodyne	PTAFR	18	40
O=C(NCCCC(=O)N1CC[C@@H](C(=O)O)C1)c1cccnc1	ZINC000819181650	DC	On-Demand	Anodyne	C3AR1	42	39
O=C(NCCCC(=O)N1CC[C@@H](C(=O)O)C1)c1cccnc1	ZINC000819181650	DC	On-Demand	Anodyne	PREP	23	45
O=C(NCCCC(=O)N1CC[C@@H](C(=O)O)C1)c1cccnc1	ZINC000819181650	DC	On-Demand	Anodyne	NAMPT	30	44
O=C(NCCCC(=O)N1CC[C@H](C(=O)O)C1)c1cccnc1	ZINC000819181651	DC	On-Demand	Anodyne	DRD4	41	32
O=C(NCCCC(=O)N1CC[C@H](C(=O)O)C1)c1cccnc1	ZINC000819181651	DC	On-Demand	Anodyne	TBXAS1	55	39
O=C(NCCCC(=O)N1CC[C@H](C(=O)O)C1)c1cccnc1	ZINC000819181651	DC	On-Demand	Anodyne	PTAFR	18	40
O=C(NCCCC(=O)N1CC[C@H](C(=O)O)C1)c1cccnc1	ZINC000819181651	DC	On-Demand	Anodyne	C3AR1	42	39
O=C(NCCCC(=O)N1CC[C@H](C(=O)O)C1)c1cccnc1	ZINC000819181651	DC	On-Demand	Anodyne	PREP	23	45
O=C(NCCCC(=O)N1CC[C@H](C(=O)O)C1)c1cccnc1	ZINC000819181651	DC	On-Demand	Anodyne	NAMPT	30	44
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Cl)c2cccnc12	ZINC000819181660	GF	On-Demand	Anodyne	RPA1	45	32
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(-n2nccn2)cc1	ZINC000819181661	FD	On-Demand	Anodyne	RPA1	53	33
O=C(NCCOc1ccc(F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819181662	EE	On-Demand	Anodyne	HRH2	21	43
O=C(NCCOc1ccc(F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819181662	EE	On-Demand	Anodyne	LTA4H	35	43
O=C(NCCOc1ccc(F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819181662	EE	On-Demand	Anodyne	RARB	15	40
O=C(NCCOc1ccc(F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819181662	EE	On-Demand	Anodyne	PLA2G4B	61	39
O=C(NCCS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181666	FD	On-Demand	Anodyne	CA2	19	48
O=C(NCCS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181666	FD	On-Demand	Anodyne	CA1	16	48
O=C(NCCS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181666	FD	On-Demand	Anodyne	CA5B	17	41
O=C(NCCS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181666	FD	On-Demand	Anodyne	CA5A	19	41
O=C(NCCS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181666	FD	On-Demand	Anodyne	NAMPT	62	50
O=C(NCCS(=O)(=O)c1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181666	FD	On-Demand	Anodyne	TMPRSS11D	55	33
O=C(NCCN1Cc2ccccc2C1)NCc1ccc(C(=O)O)cc1	ZINC000819181667	EE	On-Demand	Anodyne	HTR1A	20	41
O=C(NCCN1Cc2ccccc2C1)NCc1ccc(C(=O)O)cc1	ZINC000819181667	EE	On-Demand	Anodyne	DRD2	25	42
O=C(NCCN1Cc2ccccc2C1)NCc1ccc(C(=O)O)cc1	ZINC000819181667	EE	On-Demand	Anodyne	DRD4	40	32
O=C(NCCN1Cc2ccccc2C1)NCc1ccc(C(=O)O)cc1	ZINC000819181667	EE	On-Demand	Anodyne	AVPR2	27	44
O=C(NCCN1Cc2ccccc2C1)NCc1ccc(C(=O)O)cc1	ZINC000819181667	EE	On-Demand	Anodyne	DRD3	32	42
O=C(NCCN1Cc2ccccc2C1)NCc1ccc(C(=O)O)cc1	ZINC000819181667	EE	On-Demand	Anodyne	SIGMAR1	17	41
O=C(NCCN1Cc2ccccc2C1)NCc1ccc(C(=O)O)cc1	ZINC000819181667	EE	On-Demand	Anodyne	PLD2	49	35
O=C(NCCN1Cc2ccccc2C1)NCc1ccc(C(=O)O)cc1	ZINC000819181667	EE	On-Demand	Anodyne	CYP2J2	46	33
O=C(NCCN1Cc2ccccc2C1)NCc1ccc(C(=O)O)cc1	ZINC000819181667	EE	On-Demand	Anodyne	NOD1	17	40
O=C(NCCN1Cc2ccccc2C1)NCc1ccc(C(=O)O)cc1	ZINC000819181667	EE	On-Demand	Anodyne	NOD2	46	38
O=C(NCCN1Cc2ccccc2C1)NCc1ccc(C(=O)O)cc1	ZINC000819181667	EE	On-Demand	Anodyne	NAMPT	20	44
O=C(NCCc1nc2ccccc2[nH]1)NCc1ccc(C(=O)O)cc1	ZINC000819181675	EE	On-Demand	Anodyne	PIN1	25	41
O=C(NCCCNC1CCCCC1)NCc1ccc(C(=O)O)cc1	ZINC000819181676	EE	On-Demand	Anodyne	EPHX2	19	45
O=C(NCCCNC1CCCCC1)NCc1ccc(C(=O)O)cc1	ZINC000819181676	EE	On-Demand	Anodyne	PROC	47	39
O=C(NCCNc1cnccn1)NCc1ccc(C(=O)O)cc1	ZINC000819181677	DD	On-Demand	Anodyne	NAMPT	35	41
O=C(NCCNc1ccc([N+](=O)[O-])cc1)NCc1ccc(C(=O)O)cc1	ZINC000819181681	FE	On-Demand	Bother	MMP8	28	42
O=C(NCCNc1ccc([N+](=O)[O-])cc1)NCc1ccc(C(=O)O)cc1	ZINC000819181681	FE	On-Demand	Bother	MMP9	15	42
O=C(NCCNc1ccc([N+](=O)[O-])cc1)NCc1ccc(C(=O)O)cc1	ZINC000819181681	FE	On-Demand	Bother	MMP1	20	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000819181696	GE	On-Demand	Bother	TAAR1	20	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000819181696	GE	On-Demand	Bother	IMDH_CRYPV	15	44
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000819181696	GE	On-Demand	Bother	RPA1	42	32
O=C(NCCNS(=O)(=O)Cc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181699	GD	On-Demand	Anodyne	F2	22	44
O=C(NCCNS(=O)(=O)Cc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181699	GD	On-Demand	Anodyne	PLG	65	36
O=C(NCCNS(=O)(=O)Cc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181699	GD	On-Demand	Anodyne	CA2	15	47
O=C(NCCNS(=O)(=O)Cc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181699	GD	On-Demand	Anodyne	KLKB1	41	37
O=C(NCCNS(=O)(=O)Cc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181699	GD	On-Demand	Anodyne	TRYP_PIG	52	36
O=C(NCCNS(=O)(=O)Cc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181699	GD	On-Demand	Anodyne	CA5A	15	40
O=C(NCCNS(=O)(=O)Cc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181699	GD	On-Demand	Anodyne	NAMPT	36	43
O=C(NCCNS(=O)(=O)Cc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181699	GD	On-Demand	Anodyne	TMPRSS11D	118	43
O=C(NC[C@H](O)c1cccnc1)C1=NN(c2ccccc2)[C@@H](C(=O)O)C1	ZINC000819181700	FC	On-Demand	Anodyne	ADRB3	55	41
O=C(NC[C@H](O)c1cccnc1)C1=NN(c2ccccc2)[C@@H](C(=O)O)C1	ZINC000819181700	FC	On-Demand	Anodyne	SCD1	19	44
O=C(NC[C@H](O)c1cccnc1)C1=NN(c2ccccc2)[C@@H](C(=O)O)C1	ZINC000819181700	FC	On-Demand	Anodyne	SCD	31	40
O=C(NC[C@H](O)c1cccnc1)C1=NN(c2ccccc2)[C@H](C(=O)O)C1	ZINC000819181701	FC	On-Demand	Anodyne	ADRB3	55	41
O=C(NC[C@H](O)c1cccnc1)C1=NN(c2ccccc2)[C@H](C(=O)O)C1	ZINC000819181701	FC	On-Demand	Anodyne	SCD1	19	44
O=C(NC[C@H](O)c1cccnc1)C1=NN(c2ccccc2)[C@H](C(=O)O)C1	ZINC000819181701	FC	On-Demand	Anodyne	SCD	31	40
O=C(NC[C@@H](O)c1cccnc1)C1=NN(c2ccccc2)[C@@H](C(=O)O)C1	ZINC000819181702	FC	On-Demand	Anodyne	ADRB3	55	41
O=C(NC[C@@H](O)c1cccnc1)C1=NN(c2ccccc2)[C@@H](C(=O)O)C1	ZINC000819181702	FC	On-Demand	Anodyne	SCD1	19	44
O=C(NC[C@@H](O)c1cccnc1)C1=NN(c2ccccc2)[C@@H](C(=O)O)C1	ZINC000819181702	FC	On-Demand	Anodyne	SCD	31	40
O=C(NC[C@@H](O)c1cccnc1)C1=NN(c2ccccc2)[C@H](C(=O)O)C1	ZINC000819181703	FC	On-Demand	Anodyne	ADRB3	55	41
O=C(NC[C@@H](O)c1cccnc1)C1=NN(c2ccccc2)[C@H](C(=O)O)C1	ZINC000819181703	FC	On-Demand	Anodyne	SCD1	19	44
O=C(NC[C@@H](O)c1cccnc1)C1=NN(c2ccccc2)[C@H](C(=O)O)C1	ZINC000819181703	FC	On-Demand	Anodyne	SCD	31	40
O=C(NCCO)c1ccc(N2CCO[C@@H](C(=O)O)C2)nn1	ZINC000819181704	CA	On-Demand	Anodyne	SCD1	59	49
O=C(NCCO)c1ccc(N2CCO[C@@H](C(=O)O)C2)nn1	ZINC000819181704	CA	On-Demand	Anodyne	SCD	47	42
O=C(NCCO)c1ccc(N2CCO[C@H](C(=O)O)C2)nn1	ZINC000819181705	CA	On-Demand	Anodyne	SCD1	59	49
O=C(NCCO)c1ccc(N2CCO[C@H](C(=O)O)C2)nn1	ZINC000819181705	CA	On-Demand	Anodyne	SCD	47	42
O=C(NCCS(=O)(=O)Cc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181707	GD	On-Demand	Anodyne	PLG	53	34
O=C(NCCS(=O)(=O)Cc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181707	GD	On-Demand	Anodyne	TRYP_PIG	48	34
O=C(NCCS(=O)(=O)Cc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181707	GD	On-Demand	Anodyne	NAMPT	34	43
O=C(NCCS(=O)(=O)Cc1ccccc1)NCc1ccc(C(=O)O)cc1	ZINC000819181707	GD	On-Demand	Anodyne	TMPRSS11D	104	39
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cc(Cl)ccc1Cl	ZINC000819181716	FF	On-Demand	Anodyne	RPA1	51	34
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	ZINC000819181718	GD	On-Demand	Anodyne	SSTR3	19	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	ZINC000819181718	GD	On-Demand	Anodyne	EPHX2	37	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(C(=O)NC2CC2)cc1	ZINC000819181718	GD	On-Demand	Anodyne	GIPR	56	35
O=C(NCCCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181724	ED	On-Demand	Anodyne	ACE	28	48
O=C(NCCCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181724	ED	On-Demand	Anodyne	FKBP1A	33	41
O=C(NCCCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181724	ED	On-Demand	Anodyne	SLC6A1	56	34
O=C(NCCCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181724	ED	On-Demand	Anodyne	GRIN2B	31	40
O=C(NCCCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181724	ED	On-Demand	Anodyne	CTSB	34	44
O=C(NCCCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181724	ED	On-Demand	Anodyne	CTSK	29	44
O=C(NCCCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181724	ED	On-Demand	Anodyne	PREP	74	56
O=C(NCCCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181724	ED	On-Demand	Anodyne	CAPN1	47	40
O=C(NCCCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181724	ED	On-Demand	Anodyne	CAPN2	76	40
O=C(NCCCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181724	ED	On-Demand	Anodyne	TGM2	41	47
O=C(NCCCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181724	ED	On-Demand	Anodyne	NPR	64	38
O=C(NCCCC(=O)N1CC[C@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181724	ED	On-Demand	Anodyne	SLC12A5	50	38
O=C(NCCCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181725	ED	On-Demand	Anodyne	ACE	28	48
O=C(NCCCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181725	ED	On-Demand	Anodyne	FKBP1A	33	41
O=C(NCCCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181725	ED	On-Demand	Anodyne	SLC6A1	56	34
O=C(NCCCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181725	ED	On-Demand	Anodyne	GRIN2B	31	40
O=C(NCCCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181725	ED	On-Demand	Anodyne	CTSB	34	44
O=C(NCCCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181725	ED	On-Demand	Anodyne	CTSK	29	44
O=C(NCCCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181725	ED	On-Demand	Anodyne	PREP	74	56
O=C(NCCCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181725	ED	On-Demand	Anodyne	CAPN1	47	40
O=C(NCCCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181725	ED	On-Demand	Anodyne	CAPN2	76	40
O=C(NCCCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181725	ED	On-Demand	Anodyne	TGM2	41	47
O=C(NCCCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181725	ED	On-Demand	Anodyne	NPR	64	38
O=C(NCCCC(=O)N1CC[C@@H](C(=O)O)C1)OCc1ccccc1	ZINC000819181725	ED	On-Demand	Anodyne	SLC12A5	50	38
CCNC(=O)C(C)(C)CNC[C@@H](O)c1cccc(F)c1	ZINC000819181821	CD	On-Demand	Anodyne	ADRB1	22	41
CCNC(=O)C(C)(C)CNC[C@@H](O)c1cccc(F)c1	ZINC000819181821	CD	On-Demand	Anodyne	ADRB3	29	41
CCNC(=O)C(C)(C)CNC[C@H](O)c1cccc(F)c1	ZINC000819181822	CD	On-Demand	Anodyne	ADRB1	22	41
CCNC(=O)C(C)(C)CNC[C@H](O)c1cccc(F)c1	ZINC000819181822	CD	On-Demand	Anodyne	ADRB3	29	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](N1C(=O)N[C@H](Cc3ccccc3)C1=O)C2	ZINC000819181833	FD	On-Demand	Anodyne	GALR1	48	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](N1C(=O)N[C@@H](Cc3ccccc3)C1=O)C2	ZINC000819181834	FD	On-Demand	Anodyne	GALR1	48	35
CCNC(=O)C(C)(C)CNC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819181847	GC	On-Demand	Clean	DRD4	43	36
CCNC(=O)C(C)(C)CNC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819181847	GC	On-Demand	Clean	ABCB1	34	40
CCNC(=O)C(C)(C)CNC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819181848	GC	On-Demand	Clean	DRD4	43	36
CCNC(=O)C(C)(C)CNC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819181848	GC	On-Demand	Clean	ABCB1	34	40
CC(C)CN1CCC[C@@H](CNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819181871	EF	On-Demand	Anodyne	CCR3	59	34
CC(C)CN1CCC[C@H](CNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819181872	EF	On-Demand	Anodyne	CCR3	59	34
CC(C)CN1CCC[C@@H](CNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819181873	EF	On-Demand	Anodyne	CCR3	59	34
CC(C)CN1CCC[C@H](CNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819181874	EF	On-Demand	Anodyne	CCR3	59	34
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CCCN(CC(C)C)C1	ZINC000819181891	DG	On-Demand	Anodyne	CCR3	59	35
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CCCN(CC(C)C)C1	ZINC000819181892	DG	On-Demand	Anodyne	CCR3	59	35
O[C@@H](CNC[C@@H]1CCCn2ccnc21)c1cccnc1	ZINC000819181921	CD	On-Demand	Anodyne	ADRB1	21	40
O[C@@H](CNC[C@@H]1CCCn2ccnc21)c1cccnc1	ZINC000819181921	CD	On-Demand	Anodyne	ADRB3	81	41
O[C@@H](CNC[C@H]1CCCn2ccnc21)c1cccnc1	ZINC000819181922	CD	On-Demand	Anodyne	ADRB1	21	40
O[C@@H](CNC[C@H]1CCCn2ccnc21)c1cccnc1	ZINC000819181922	CD	On-Demand	Anodyne	ADRB3	81	41
O[C@H](CNC[C@@H]1CCCn2ccnc21)c1cccnc1	ZINC000819181923	CD	On-Demand	Anodyne	ADRB1	21	40
O[C@H](CNC[C@@H]1CCCn2ccnc21)c1cccnc1	ZINC000819181923	CD	On-Demand	Anodyne	ADRB3	81	41
O[C@H](CNC[C@H]1CCCn2ccnc21)c1cccnc1	ZINC000819181924	CD	On-Demand	Anodyne	ADRB1	21	40
O[C@H](CNC[C@H]1CCCn2ccnc21)c1cccnc1	ZINC000819181924	CD	On-Demand	Anodyne	ADRB3	81	41
CCNC(=O)C(C)(C)CNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819181960	EE	On-Demand	Anodyne	PDS	46	34
CCNC(=O)C(C)(C)CNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819181961	EE	On-Demand	Anodyne	PDS	46	34
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181968	IG	On-Demand	Anodyne	F2	36	41
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181968	IG	On-Demand	Anodyne	PLG	29	41
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181968	IG	On-Demand	Anodyne	ACHE	23	41
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181968	IG	On-Demand	Anodyne	GHRHR	60	35
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181968	IG	On-Demand	Anodyne	P2RY12	87	37
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181968	IG	On-Demand	Anodyne	UGCG	45	38
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181968	IG	On-Demand	Anodyne	MC4R	71	38
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181968	IG	On-Demand	Anodyne	CCR1	37	45
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181968	IG	On-Demand	Anodyne	PREP	17	41
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181968	IG	On-Demand	Anodyne	DPP7	44	36
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181968	IG	On-Demand	Anodyne	ST14	84	41
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181968	IG	On-Demand	Anodyne	TMPRSS6	40	39
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181969	IG	On-Demand	Anodyne	F2	36	41
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181969	IG	On-Demand	Anodyne	PLG	29	41
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181969	IG	On-Demand	Anodyne	ACHE	23	41
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181969	IG	On-Demand	Anodyne	GHRHR	60	35
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181969	IG	On-Demand	Anodyne	P2RY12	87	37
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181969	IG	On-Demand	Anodyne	UGCG	45	38
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181969	IG	On-Demand	Anodyne	MC4R	71	38
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181969	IG	On-Demand	Anodyne	CCR1	37	45
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181969	IG	On-Demand	Anodyne	PREP	17	41
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181969	IG	On-Demand	Anodyne	DPP7	44	36
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181969	IG	On-Demand	Anodyne	ST14	84	41
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000819181969	IG	On-Demand	Anodyne	TMPRSS6	40	39
CC(C)CN1CCC[C@@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819182012	CE	On-Demand	Anodyne	ADRB2	20	41
CC(C)CN1CCC[C@@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819182012	CE	On-Demand	Anodyne	ADRB1	21	40
CC(C)CN1CCC[C@@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819182012	CE	On-Demand	Anodyne	ADRB3	82	43
CC(C)CN1CCC[C@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819182013	CE	On-Demand	Anodyne	ADRB2	20	41
CC(C)CN1CCC[C@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819182013	CE	On-Demand	Anodyne	ADRB1	21	40
CC(C)CN1CCC[C@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819182013	CE	On-Demand	Anodyne	ADRB3	82	43
CC(C)CN1CCC[C@@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819182014	CE	On-Demand	Anodyne	ADRB2	20	41
CC(C)CN1CCC[C@@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819182014	CE	On-Demand	Anodyne	ADRB1	21	40
CC(C)CN1CCC[C@@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819182014	CE	On-Demand	Anodyne	ADRB3	82	43
CC(C)CN1CCC[C@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819182015	CE	On-Demand	Anodyne	ADRB2	20	41
CC(C)CN1CCC[C@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819182015	CE	On-Demand	Anodyne	ADRB1	21	40
CC(C)CN1CCC[C@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819182015	CE	On-Demand	Anodyne	ADRB3	82	43
CC(C)CN1CCC[C@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819182016	EF	On-Demand	Bother	CACNA1D	41	36
CC(C)CN1CCC[C@@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819182017	EF	On-Demand	Bother	CACNA1D	41	36
CC(C)CN1CCC[C@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819182018	EF	On-Demand	Bother	CACNA1D	41	36
CC(C)CN1CCC[C@@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819182019	EF	On-Demand	Bother	CACNA1D	41	36
O[C@H](CNC[C@@H]1CCCn2ccnc21)c1cccc(Cl)c1	ZINC000819182031	DF	On-Demand	Anodyne	ADRB1	28	41
O[C@H](CNC[C@@H]1CCCn2ccnc21)c1cccc(Cl)c1	ZINC000819182031	DF	On-Demand	Anodyne	ADRB3	41	41
O[C@H](CNC[C@@H]1CCCn2ccnc21)c1cccc(Cl)c1	ZINC000819182031	DF	On-Demand	Anodyne	CYP3A4	45	35
O[C@@H](CNC[C@H]1CCCn2ccnc21)c1cccc(Cl)c1	ZINC000819182032	DF	On-Demand	Anodyne	ADRB1	28	41
O[C@@H](CNC[C@H]1CCCn2ccnc21)c1cccc(Cl)c1	ZINC000819182032	DF	On-Demand	Anodyne	ADRB3	41	41
O[C@@H](CNC[C@H]1CCCn2ccnc21)c1cccc(Cl)c1	ZINC000819182032	DF	On-Demand	Anodyne	CYP3A4	45	35
O[C@H](CNC[C@H]1CCCn2ccnc21)c1cccc(Cl)c1	ZINC000819182033	DF	On-Demand	Anodyne	ADRB1	28	41
O[C@H](CNC[C@H]1CCCn2ccnc21)c1cccc(Cl)c1	ZINC000819182033	DF	On-Demand	Anodyne	ADRB3	41	41
O[C@H](CNC[C@H]1CCCn2ccnc21)c1cccc(Cl)c1	ZINC000819182033	DF	On-Demand	Anodyne	CYP3A4	45	35
O[C@@H](CNC[C@@H]1CCCn2ccnc21)c1cccc(Cl)c1	ZINC000819182034	DF	On-Demand	Anodyne	ADRB1	28	41
O[C@@H](CNC[C@@H]1CCCn2ccnc21)c1cccc(Cl)c1	ZINC000819182034	DF	On-Demand	Anodyne	ADRB3	41	41
O[C@@H](CNC[C@@H]1CCCn2ccnc21)c1cccc(Cl)c1	ZINC000819182034	DF	On-Demand	Anodyne	CYP3A4	45	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](N1C(=O)[C@@H](Cc3ccccc3)N(C3CC3)C1=O)C2	ZINC000819182101	GF	On-Demand	Anodyne	SLC6A3	16	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](N1C(=O)[C@H](Cc3ccccc3)N(C3CC3)C1=O)C2	ZINC000819182104	GF	On-Demand	Anodyne	SLC6A3	16	43
CCNC(=O)C(C)(C)CNC[C@H](O)c1ccc(C#N)cc1	ZINC000819182131	CD	On-Demand	Mild	CTRB_BOVIN	46	33
CCNC(=O)C(C)(C)CNC[C@@H](O)c1ccc(C#N)cc1	ZINC000819182132	CD	On-Demand	Mild	CTRB_BOVIN	46	33
CC(C)CN1CCC[C@@H](CNC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819182151	EG	On-Demand	Anodyne	CCR3	41	33
CC(C)CN1CCC[C@H](CNC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819182152	EG	On-Demand	Anodyne	CCR3	41	33
CC(C)CN1CCC[C@@H](CNC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819182153	EG	On-Demand	Anodyne	CCR3	41	33
CC(C)CN1CCC[C@H](CNC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819182154	EG	On-Demand	Anodyne	CCR3	41	33
COC[C@@H](C)OC[C@@H](O)CNCc1ccc(OC)c(C#N)c1	ZINC000819182161	DD	On-Demand	Mild	ADRB1	40	30
COC[C@@H](C)OC[C@H](O)CNCc1ccc(OC)c(C#N)c1	ZINC000819182162	DD	On-Demand	Mild	ADRB1	40	30
CC(C)CN1CCC[C@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819182189	CF	On-Demand	Anodyne	SLC6A3	15	44
CC(C)CN1CCC[C@@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819182190	CF	On-Demand	Anodyne	SLC6A3	15	44
CC(C)CN1CCC[C@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819182191	CF	On-Demand	Anodyne	SLC6A3	15	44
CC(C)CN1CCC[C@@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819182192	CF	On-Demand	Anodyne	SLC6A3	15	44
CON(C)C(=O)CCNCCNS(=O)(=O)c1cccnc1	ZINC000819182195	DB	On-Demand	Anodyne	TBXA2R	22	41
CON(C)C(=O)CCNCCNS(=O)(=O)c1cccnc1	ZINC000819182195	DB	On-Demand	Anodyne	TBXAS1	51	42
CCOc1ccc(OC[C@@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182260	FE	On-Demand	Mild	ADRB2	44	48
CCOc1ccc(OC[C@@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182260	FE	On-Demand	Mild	ADRB1	63	46
CCOc1ccc(OC[C@@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182260	FE	On-Demand	Mild	GRIN1	16	40
CCOc1ccc(OC[C@@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182260	FE	On-Demand	Mild	ADRB3	33	44
CCOc1ccc(OC[C@@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182260	FE	On-Demand	Mild	CASR	46	43
CCOc1ccc(OC[C@@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182260	FE	On-Demand	Mild	CYP2D6	17	43
CCOc1ccc(OC[C@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182261	FE	On-Demand	Mild	ADRB2	44	48
CCOc1ccc(OC[C@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182261	FE	On-Demand	Mild	ADRB1	63	46
CCOc1ccc(OC[C@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182261	FE	On-Demand	Mild	GRIN1	16	40
CCOc1ccc(OC[C@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182261	FE	On-Demand	Mild	ADRB3	33	44
CCOc1ccc(OC[C@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182261	FE	On-Demand	Mild	CASR	46	43
CCOc1ccc(OC[C@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182261	FE	On-Demand	Mild	CYP2D6	17	43
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182262	ED	On-Demand	Anodyne	ADRB2	50	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182262	ED	On-Demand	Anodyne	ADRB1	86	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182262	ED	On-Demand	Anodyne	GRIN1	27	45
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182262	ED	On-Demand	Anodyne	ADRB3	52	53
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182263	ED	On-Demand	Anodyne	ADRB2	50	55
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182263	ED	On-Demand	Anodyne	ADRB1	86	55
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182263	ED	On-Demand	Anodyne	GRIN1	27	45
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182263	ED	On-Demand	Anodyne	ADRB3	52	53
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ncccc2C(F)(F)F)c1	ZINC000819182317	FF	On-Demand	Bother	ADRB3	41	39
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ncccc2C(F)(F)F)c1	ZINC000819182319	FF	On-Demand	Bother	ADRB3	41	39
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1cccnc1	ZINC000819182334	EE	On-Demand	Anodyne	ADRB2	26	54
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1cccnc1	ZINC000819182334	EE	On-Demand	Anodyne	ADRB1	37	57
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1cccnc1	ZINC000819182334	EE	On-Demand	Anodyne	ADRB3	106	57
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1cccnc1	ZINC000819182335	EE	On-Demand	Anodyne	ADRB2	26	54
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1cccnc1	ZINC000819182335	EE	On-Demand	Anodyne	ADRB1	37	57
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1cccnc1	ZINC000819182335	EE	On-Demand	Anodyne	ADRB3	106	57
O[C@@H](CNCCOc1ncccc1F)c1cccc(C(F)(F)F)c1	ZINC000819182341	EF	On-Demand	Anodyne	ADRB1	25	42
O[C@@H](CNCCOc1ncccc1F)c1cccc(C(F)(F)F)c1	ZINC000819182341	EF	On-Demand	Anodyne	ADRB3	34	42
O[C@H](CNCCOc1ncccc1F)c1cccc(C(F)(F)F)c1	ZINC000819182343	EF	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CNCCOc1ncccc1F)c1cccc(C(F)(F)F)c1	ZINC000819182343	EF	On-Demand	Anodyne	ADRB3	34	42
O=S(=O)(NCCNC[C@H](O)c1ccc(F)cc1Cl)c1cccnc1	ZINC000819182344	FD	On-Demand	Anodyne	ADRB3	76	41
O=S(=O)(NCCNC[C@H](O)c1ccc(F)cc1Cl)c1cccnc1	ZINC000819182344	FD	On-Demand	Anodyne	TBXAS1	41	40
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)cc1Cl)c1cccnc1	ZINC000819182346	FD	On-Demand	Anodyne	ADRB3	76	41
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)cc1Cl)c1cccnc1	ZINC000819182346	FD	On-Demand	Anodyne	TBXAS1	41	40
CCNC(=O)C(C)(C)CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819182373	FD	On-Demand	Anodyne	GPR119	27	43
CCNC(=O)C(C)(C)CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819182374	FD	On-Demand	Anodyne	GPR119	27	43
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182422	FD	On-Demand	Mild	ADRB2	51	49
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182422	FD	On-Demand	Mild	ADRB1	84	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182422	FD	On-Demand	Mild	GRIN1	19	43
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182422	FD	On-Demand	Mild	ADRB3	49	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182422	FD	On-Demand	Mild	CASR	46	44
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182422	FD	On-Demand	Mild	CYP2D6	17	42
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182423	FD	On-Demand	Mild	ADRB2	51	49
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182423	FD	On-Demand	Mild	ADRB1	84	46
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182423	FD	On-Demand	Mild	GRIN1	19	43
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182423	FD	On-Demand	Mild	ADRB3	49	46
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182423	FD	On-Demand	Mild	CASR	46	44
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000819182423	FD	On-Demand	Mild	CYP2D6	17	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ncccc2F)c1	ZINC000819182432	DD	On-Demand	Bother	ADRB3	44	38
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ncccc2F)c1	ZINC000819182433	DD	On-Demand	Bother	ADRB3	44	38
O[C@@H](CNCCOc1ncccc1F)c1ccc(OC(F)(F)F)cc1	ZINC000819182456	FF	On-Demand	Anodyne	ADRB2	16	42
O[C@@H](CNCCOc1ncccc1F)c1ccc(OC(F)(F)F)cc1	ZINC000819182456	FF	On-Demand	Anodyne	ADRB1	20	43
O[C@@H](CNCCOc1ncccc1F)c1ccc(OC(F)(F)F)cc1	ZINC000819182456	FF	On-Demand	Anodyne	ADRB3	28	43
O[C@H](CNCCOc1ncccc1F)c1ccc(OC(F)(F)F)cc1	ZINC000819182457	FF	On-Demand	Anodyne	ADRB2	16	42
O[C@H](CNCCOc1ncccc1F)c1ccc(OC(F)(F)F)cc1	ZINC000819182457	FF	On-Demand	Anodyne	ADRB1	20	43
O[C@H](CNCCOc1ncccc1F)c1ccc(OC(F)(F)F)cc1	ZINC000819182457	FF	On-Demand	Anodyne	ADRB3	28	43
O[C@@H](CNCCOc1ncccc1F)c1cccc(Br)c1	ZINC000819182460	FF	On-Demand	Anodyne	ADRB1	28	41
O[C@@H](CNCCOc1ncccc1F)c1cccc(Br)c1	ZINC000819182460	FF	On-Demand	Anodyne	ADRB3	38	41
O[C@H](CNCCOc1ncccc1F)c1cccc(Br)c1	ZINC000819182461	FF	On-Demand	Anodyne	ADRB1	28	41
O[C@H](CNCCOc1ncccc1F)c1cccc(Br)c1	ZINC000819182461	FF	On-Demand	Anodyne	ADRB3	38	41
O=C(CCNCc1cccc(F)n1)Nc1cccc(C(F)(F)F)c1	ZINC000819182483	EG	On-Demand	Anodyne	KDR	17	41
O=C(CCNCc1cccc(F)n1)Nc1cccc(C(F)(F)F)c1	ZINC000819182483	EG	On-Demand	Anodyne	RIPK1	41	37
O[C@@H](CNCCOc1ncccc1F)c1ccccc1	ZINC000819182516	CD	On-Demand	Anodyne	ADRB2	20	44
O[C@@H](CNCCOc1ncccc1F)c1ccccc1	ZINC000819182516	CD	On-Demand	Anodyne	ADRB1	35	44
O[C@@H](CNCCOc1ncccc1F)c1ccccc1	ZINC000819182516	CD	On-Demand	Anodyne	ADRB3	63	44
O[C@H](CNCCOc1ncccc1F)c1ccccc1	ZINC000819182517	CD	On-Demand	Anodyne	ADRB2	20	44
O[C@H](CNCCOc1ncccc1F)c1ccccc1	ZINC000819182517	CD	On-Demand	Anodyne	ADRB1	35	44
O[C@H](CNCCOc1ncccc1F)c1ccccc1	ZINC000819182517	CD	On-Demand	Anodyne	ADRB3	63	44
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)c(F)c1)c1cccs1	ZINC000819182518	FD	On-Demand	Anodyne	ADRB2	20	40
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)c(F)c1)c1cccs1	ZINC000819182518	FD	On-Demand	Anodyne	ADRB1	21	40
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)c(F)c1)c1cccs1	ZINC000819182518	FD	On-Demand	Anodyne	ADRB3	36	44
O=S(=O)(NCCNC[C@H](O)c1ccc(F)c(F)c1)c1cccs1	ZINC000819182519	FD	On-Demand	Anodyne	ADRB2	20	40
O=S(=O)(NCCNC[C@H](O)c1ccc(F)c(F)c1)c1cccs1	ZINC000819182519	FD	On-Demand	Anodyne	ADRB1	21	40
O=S(=O)(NCCNC[C@H](O)c1ccc(F)c(F)c1)c1cccs1	ZINC000819182519	FD	On-Demand	Anodyne	ADRB3	36	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ncccc2F)cc1	ZINC000819182520	FD	On-Demand	Anodyne	ADRB2	25	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ncccc2F)cc1	ZINC000819182520	FD	On-Demand	Anodyne	ADRB3	81	43
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ncccc2F)cc1	ZINC000819182521	FD	On-Demand	Anodyne	ADRB2	25	40
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ncccc2F)cc1	ZINC000819182521	FD	On-Demand	Anodyne	ADRB3	81	43
O=[N+]([O-])c1cccc([C@H](O)CNCCNS(=O)(=O)c2cccs2)c1	ZINC000819182527	FD	On-Demand	Bother	ADRB1	22	41
O=[N+]([O-])c1cccc([C@H](O)CNCCNS(=O)(=O)c2cccs2)c1	ZINC000819182527	FD	On-Demand	Bother	ADRB3	40	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCNS(=O)(=O)c2cccs2)c1	ZINC000819182528	FD	On-Demand	Bother	ADRB1	22	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCNS(=O)(=O)c2cccs2)c1	ZINC000819182528	FD	On-Demand	Bother	ADRB3	40	41
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1ccccc1	ZINC000819182529	EF	On-Demand	Anodyne	ADRB2	15	42
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1ccccc1	ZINC000819182529	EF	On-Demand	Anodyne	ADRB1	33	48
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1ccccc1	ZINC000819182529	EF	On-Demand	Anodyne	ADRB3	59	48
CC(C)CN1CCC[C@H](CNC[C@H](O)c2ccc(F)cn2)C1	ZINC000819182571	DE	On-Demand	Anodyne	CCR3	44	33
CC(C)CN1CCC[C@H](CNC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819182572	DE	On-Demand	Anodyne	CCR3	44	33
CC(C)CN1CCC[C@@H](CNC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819182573	DE	On-Demand	Anodyne	CCR3	44	33
CC(C)CN1CCC[C@@H](CNC[C@H](O)c2ccc(F)cn2)C1	ZINC000819182574	DE	On-Demand	Anodyne	CCR3	44	33
CCNC(=O)C(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000819182607	CC	On-Demand	Anodyne	ADRB2	23	43
CCNC(=O)C(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000819182607	CC	On-Demand	Anodyne	ADRB1	27	45
CCNC(=O)C(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000819182607	CC	On-Demand	Anodyne	ADRB3	97	46
CCNC(=O)C(C)(C)CNC[C@H](O)c1cccnc1	ZINC000819182608	CC	On-Demand	Anodyne	ADRB2	23	43
CCNC(=O)C(C)(C)CNC[C@H](O)c1cccnc1	ZINC000819182608	CC	On-Demand	Anodyne	ADRB1	27	45
CCNC(=O)C(C)(C)CNC[C@H](O)c1cccnc1	ZINC000819182608	CC	On-Demand	Anodyne	ADRB3	97	46
CCNC(=O)C(C)(C)CNC[C@H](O)c1cc(OC)ccc1OC	ZINC000819182621	DD	On-Demand	Anodyne	MTNR1A	41	45
CCNC(=O)C(C)(C)CNC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819182622	DD	On-Demand	Anodyne	MTNR1A	41	45
CCNC(=O)C(C)(C)CNC[C@@H](O)c1ccccc1	ZINC000819182627	CD	On-Demand	Anodyne	ADRB1	22	40
CCNC(=O)C(C)(C)CNC[C@@H](O)c1ccccc1	ZINC000819182627	CD	On-Demand	Anodyne	ADRB3	40	40
CCNC(=O)C(C)(C)CNC[C@H](O)c1ccccc1	ZINC000819182628	CD	On-Demand	Anodyne	ADRB1	22	40
CCNC(=O)C(C)(C)CNC[C@H](O)c1ccccc1	ZINC000819182628	CD	On-Demand	Anodyne	ADRB3	40	40
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1ccccc1	ZINC000819182630	EF	On-Demand	Anodyne	ADRB2	15	42
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1ccccc1	ZINC000819182630	EF	On-Demand	Anodyne	ADRB1	33	48
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1ccccc1	ZINC000819182630	EF	On-Demand	Anodyne	ADRB3	59	48
O=S(=O)(NCCNC[C@@H](O)c1ccc(C(F)(F)F)cc1)c1cccs1	ZINC000819182661	GE	On-Demand	Anodyne	ADRB3	21	42
O=S(=O)(NCCNC[C@H](O)c1ccc(C(F)(F)F)cc1)c1cccs1	ZINC000819182662	GE	On-Demand	Anodyne	ADRB3	21	42
COC(=O)c1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182669	ED	On-Demand	Anodyne	ADRB2	50	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182669	ED	On-Demand	Anodyne	ADRB1	79	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182669	ED	On-Demand	Anodyne	ADRB3	48	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182669	ED	On-Demand	Anodyne	ABCB1	16	44
COC(=O)c1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182670	ED	On-Demand	Anodyne	ADRB2	50	46
COC(=O)c1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182670	ED	On-Demand	Anodyne	ADRB1	79	46
COC(=O)c1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182670	ED	On-Demand	Anodyne	ADRB3	48	46
COC(=O)c1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182670	ED	On-Demand	Anodyne	ABCB1	16	44
O=S(=O)(NCCNC[C@@H](O)c1cccc(F)c1)c1cccs1	ZINC000819182673	ED	On-Demand	Anodyne	ADRB2	17	43
O=S(=O)(NCCNC[C@@H](O)c1cccc(F)c1)c1cccs1	ZINC000819182673	ED	On-Demand	Anodyne	ADRB1	25	43
O=S(=O)(NCCNC[C@@H](O)c1cccc(F)c1)c1cccs1	ZINC000819182673	ED	On-Demand	Anodyne	ADRB3	53	49
O=S(=O)(NCCNC[C@H](O)c1cccc(F)c1)c1cccs1	ZINC000819182674	ED	On-Demand	Anodyne	ADRB2	17	43
O=S(=O)(NCCNC[C@H](O)c1cccc(F)c1)c1cccs1	ZINC000819182674	ED	On-Demand	Anodyne	ADRB1	25	43
O=S(=O)(NCCNC[C@H](O)c1cccc(F)c1)c1cccs1	ZINC000819182674	ED	On-Demand	Anodyne	ADRB3	53	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(F)n1	ZINC000819182679	GF	On-Demand	Anodyne	CTSD	93	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(F)n1	ZINC000819182679	GF	On-Demand	Anodyne	PGC	55	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(F)n1	ZINC000819182679	GF	On-Demand	Anodyne	PAPA1_CARPA	32	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(F)n1	ZINC000819182679	GF	On-Demand	Anodyne	BACE2	38	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(F)n1	ZINC000819182679	GF	On-Demand	Anodyne	REN	76	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(F)n1	ZINC000819182679	GF	On-Demand	Anodyne	REN1	20	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(F)n1	ZINC000819182679	GF	On-Demand	Anodyne	BACE1	93	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccc(F)n1	ZINC000819182679	GF	On-Demand	Anodyne	FPR1	49	39
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1cccc(-c2ccccn2)c1	ZINC000819182683	FG	On-Demand	Anodyne	FAAH	15	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1cccc(-c2ccccn2)c1	ZINC000819182683	FG	On-Demand	Anodyne	PDS	55	31
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1cccc(-c2ccccn2)c1	ZINC000819182684	FG	On-Demand	Anodyne	FAAH	15	42
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1cccc(-c2ccccn2)c1	ZINC000819182684	FG	On-Demand	Anodyne	PDS	55	31
O[C@@H](CNCCOc1ncccc1F)c1ccc(Br)cc1	ZINC000819182685	FF	On-Demand	Anodyne	ADRB3	18	41
O[C@H](CNCCOc1ncccc1F)c1ccc(Br)cc1	ZINC000819182686	FF	On-Demand	Anodyne	ADRB3	18	41
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1cccc(F)c1	ZINC000819182696	EF	On-Demand	Anodyne	ADRB1	29	42
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1cccc(F)c1	ZINC000819182696	EF	On-Demand	Anodyne	ADRB3	43	42
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1cccc(F)c1	ZINC000819182697	EF	On-Demand	Anodyne	ADRB1	29	42
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1cccc(F)c1	ZINC000819182697	EF	On-Demand	Anodyne	ADRB3	43	42
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1ccc(C(F)(F)F)cc1	ZINC000819182714	GH	On-Demand	Anodyne	ADRB1	15	43
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1ccc(C(F)(F)F)cc1	ZINC000819182714	GH	On-Demand	Anodyne	ADRB3	22	43
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1ccc(C(F)(F)F)cc1	ZINC000819182715	GH	On-Demand	Anodyne	ADRB1	15	43
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1ccc(C(F)(F)F)cc1	ZINC000819182715	GH	On-Demand	Anodyne	ADRB3	22	43
O=S(=O)(NCCNC[C@@H](O)c1cccc(Cl)c1)c1cccs1	ZINC000819182722	FE	On-Demand	Anodyne	ADRB1	53	47
O=S(=O)(NCCNC[C@@H](O)c1cccc(Cl)c1)c1cccs1	ZINC000819182722	FE	On-Demand	Anodyne	ADRB3	78	47
O=S(=O)(NCCNC[C@H](O)c1cccc(Cl)c1)c1cccs1	ZINC000819182723	FE	On-Demand	Anodyne	ADRB1	53	47
O=S(=O)(NCCNC[C@H](O)c1cccc(Cl)c1)c1cccs1	ZINC000819182723	FE	On-Demand	Anodyne	ADRB3	78	47
C[C@H](NC[C@H](O)c1cccnc1)[C@H](OC1CCOCC1)c1ccccc1	ZINC000819182736	FG	On-Demand	Anodyne	ADRB1	17	42
C[C@H](NC[C@H](O)c1cccnc1)[C@H](OC1CCOCC1)c1ccccc1	ZINC000819182736	FG	On-Demand	Anodyne	ADRB3	47	42
C[C@H](NC[C@H](O)c1cccnc1)[C@@H](OC1CCOCC1)c1ccccc1	ZINC000819182737	FG	On-Demand	Anodyne	ADRB1	17	42
C[C@H](NC[C@H](O)c1cccnc1)[C@@H](OC1CCOCC1)c1ccccc1	ZINC000819182737	FG	On-Demand	Anodyne	ADRB3	47	42
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1cccc(F)n1	ZINC000819182754	DD	On-Demand	Bother	ADRB2	18	41
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1cccc(F)n1	ZINC000819182754	DD	On-Demand	Bother	ADRB1	56	38
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1cccc(F)n1	ZINC000819182756	DD	On-Demand	Bother	ADRB2	18	41
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1cccc(F)n1	ZINC000819182756	DD	On-Demand	Bother	ADRB1	56	38
C[C@H](NC[C@H](O)c1ccc(F)cc1)[C@H](OC1CCOCC1)c1ccccc1	ZINC000819182775	FH	On-Demand	Anodyne	SLC6A3	20	48
C[C@H](NC[C@H](O)c1ccc(F)cc1)[C@@H](OC1CCOCC1)c1ccccc1	ZINC000819182779	FH	On-Demand	Anodyne	SLC6A3	20	48
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCNS(=O)(=O)c1cccnc1	ZINC000819182801	GC	On-Demand	Anodyne	NAMPT	17	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCNS(=O)(=O)c1cccnc1	ZINC000819182803	GC	On-Demand	Anodyne	NAMPT	17	40
O=S(=O)(NCCNC[C@H](O)c1ccc(Cl)c(F)c1)c1cccnc1	ZINC000819182827	FD	On-Demand	Anodyne	ADRB2	33	41
O=S(=O)(NCCNC[C@H](O)c1ccc(Cl)c(F)c1)c1cccnc1	ZINC000819182827	FD	On-Demand	Anodyne	ADRB3	109	47
O=S(=O)(NCCNC[C@H](O)c1ccc(Cl)c(F)c1)c1cccnc1	ZINC000819182827	FD	On-Demand	Anodyne	TBXA2R	19	40
O=S(=O)(NCCNC[C@H](O)c1ccc(Cl)c(F)c1)c1cccnc1	ZINC000819182827	FD	On-Demand	Anodyne	TBXAS1	42	41
O=S(=O)(NCCNC[C@@H](O)c1ccc(Cl)c(F)c1)c1cccnc1	ZINC000819182830	FD	On-Demand	Anodyne	ADRB2	33	41
O=S(=O)(NCCNC[C@@H](O)c1ccc(Cl)c(F)c1)c1cccnc1	ZINC000819182830	FD	On-Demand	Anodyne	ADRB3	109	47
O=S(=O)(NCCNC[C@@H](O)c1ccc(Cl)c(F)c1)c1cccnc1	ZINC000819182830	FD	On-Demand	Anodyne	TBXA2R	19	40
O=S(=O)(NCCNC[C@@H](O)c1ccc(Cl)c(F)c1)c1cccnc1	ZINC000819182830	FD	On-Demand	Anodyne	TBXAS1	42	41
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1ccc(F)c(F)c1	ZINC000819182843	FG	On-Demand	Anodyne	ADRB1	24	40
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1ccc(F)c(F)c1	ZINC000819182843	FG	On-Demand	Anodyne	ADRB3	32	40
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1ccc(F)c(F)c1	ZINC000819182845	FG	On-Demand	Anodyne	ADRB1	24	40
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1ccc(F)c(F)c1	ZINC000819182845	FG	On-Demand	Anodyne	ADRB3	32	40
O[C@@H](CNCCOc1ncccc1F)c1ccc(Cl)cc1	ZINC000819182864	DF	On-Demand	Anodyne	ADRB3	31	40
CCC(CC)[C@H](CCNC[C@@H](O)c1cccnc1)OC	ZINC000819182866	CF	On-Demand	Anodyne	ADRB2	25	48
CCC(CC)[C@H](CCNC[C@@H](O)c1cccnc1)OC	ZINC000819182866	CF	On-Demand	Anodyne	ADRB1	28	48
CCC(CC)[C@H](CCNC[C@@H](O)c1cccnc1)OC	ZINC000819182866	CF	On-Demand	Anodyne	ADRB3	100	48
CCC(CC)[C@H](CCNC[C@H](O)c1cccnc1)OC	ZINC000819182868	CF	On-Demand	Anodyne	ADRB2	25	48
CCC(CC)[C@H](CCNC[C@H](O)c1cccnc1)OC	ZINC000819182868	CF	On-Demand	Anodyne	ADRB1	28	48
CCC(CC)[C@H](CCNC[C@H](O)c1cccnc1)OC	ZINC000819182868	CF	On-Demand	Anodyne	ADRB3	100	48
CCC(CC)[C@@H](CCNC[C@@H](O)c1cccnc1)OC	ZINC000819182870	CF	On-Demand	Anodyne	ADRB2	25	48
CCC(CC)[C@@H](CCNC[C@@H](O)c1cccnc1)OC	ZINC000819182870	CF	On-Demand	Anodyne	ADRB1	28	48
CCC(CC)[C@@H](CCNC[C@@H](O)c1cccnc1)OC	ZINC000819182870	CF	On-Demand	Anodyne	ADRB3	100	48
CCC(CC)[C@@H](CCNC[C@H](O)c1cccnc1)OC	ZINC000819182871	CF	On-Demand	Anodyne	ADRB2	25	48
CCC(CC)[C@@H](CCNC[C@H](O)c1cccnc1)OC	ZINC000819182871	CF	On-Demand	Anodyne	ADRB1	28	48
CCC(CC)[C@@H](CCNC[C@H](O)c1cccnc1)OC	ZINC000819182871	CF	On-Demand	Anodyne	ADRB3	100	48
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1cccs1	ZINC000819182879	ED	On-Demand	Anodyne	ADRB2	20	42
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1cccs1	ZINC000819182879	ED	On-Demand	Anodyne	ADRB1	31	41
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1cccs1	ZINC000819182879	ED	On-Demand	Anodyne	ADRB3	67	48
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1cccs1	ZINC000819182881	ED	On-Demand	Anodyne	ADRB2	20	42
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1cccs1	ZINC000819182881	ED	On-Demand	Anodyne	ADRB1	31	41
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1cccs1	ZINC000819182881	ED	On-Demand	Anodyne	ADRB3	67	48
Cn1cc(CNC[C@@H](O)c2cccnc2)c(C(F)(F)F)n1	ZINC000819182895	DD	On-Demand	Anodyne	ADRB2	20	40
Cn1cc(CNC[C@@H](O)c2cccnc2)c(C(F)(F)F)n1	ZINC000819182895	DD	On-Demand	Anodyne	ADRB1	21	43
Cn1cc(CNC[C@@H](O)c2cccnc2)c(C(F)(F)F)n1	ZINC000819182895	DD	On-Demand	Anodyne	ADRB3	83	43
Cn1cc(CNC[C@H](O)c2cccnc2)c(C(F)(F)F)n1	ZINC000819182897	DD	On-Demand	Anodyne	ADRB2	20	40
Cn1cc(CNC[C@H](O)c2cccnc2)c(C(F)(F)F)n1	ZINC000819182897	DD	On-Demand	Anodyne	ADRB1	21	43
Cn1cc(CNC[C@H](O)c2cccnc2)c(C(F)(F)F)n1	ZINC000819182897	DD	On-Demand	Anodyne	ADRB3	83	43
CC(C)CN1CCC[C@@H](CNC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819182911	EF	On-Demand	Anodyne	CCR3	59	34
CC(C)CN1CCC[C@H](CNC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819182913	EF	On-Demand	Anodyne	CCR3	59	34
CC(C)CN1CCC[C@@H](CNC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819182915	EF	On-Demand	Anodyne	CCR3	59	34
CC(C)CN1CCC[C@H](CNC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819182916	EF	On-Demand	Anodyne	CCR3	59	34
O=S(=O)(NCCNC[C@H](O)c1ccccc1Cl)c1cccnc1	ZINC000819182925	FD	On-Demand	Anodyne	ADRB2	24	40
O=S(=O)(NCCNC[C@H](O)c1ccccc1Cl)c1cccnc1	ZINC000819182925	FD	On-Demand	Anodyne	ADRB3	86	46
O=S(=O)(NCCNC[C@H](O)c1ccccc1Cl)c1cccnc1	ZINC000819182925	FD	On-Demand	Anodyne	TBXAS1	42	41
COc1ccc(OC)c([C@H](O)CNCCNS(=O)(=O)c2cccs2)c1	ZINC000819182957	GD	On-Demand	Anodyne	ADRB2	18	42
COc1ccc(OC)c([C@H](O)CNCCNS(=O)(=O)c2cccs2)c1	ZINC000819182957	GD	On-Demand	Anodyne	ADRB1	19	40
COc1ccc(OC)c([C@H](O)CNCCNS(=O)(=O)c2cccs2)c1	ZINC000819182957	GD	On-Demand	Anodyne	ADRB3	24	40
COCCc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182958	ED	On-Demand	Anodyne	ADRB2	46	56
COCCc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182958	ED	On-Demand	Anodyne	ADRB1	75	56
COCCc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182958	ED	On-Demand	Anodyne	GRIN1	20	42
COCCc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182958	ED	On-Demand	Anodyne	ADRB3	47	48
COCCc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182959	ED	On-Demand	Anodyne	ADRB2	46	56
COCCc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182959	ED	On-Demand	Anodyne	ADRB1	75	56
COCCc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182959	ED	On-Demand	Anodyne	GRIN1	20	42
COCCc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819182959	ED	On-Demand	Anodyne	ADRB3	47	48
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1cccc(C(F)(F)F)c1	ZINC000819182964	GH	On-Demand	Anodyne	ADRB1	30	42
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1cccc(C(F)(F)F)c1	ZINC000819182964	GH	On-Demand	Anodyne	ADRB3	41	42
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1cccc(C(F)(F)F)c1	ZINC000819182965	GH	On-Demand	Anodyne	ADRB1	30	42
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1cccc(C(F)(F)F)c1	ZINC000819182965	GH	On-Demand	Anodyne	ADRB3	41	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cccc(F)n2)CC1	ZINC000819182976	FE	On-Demand	Anodyne	GPR119	54	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cccc(F)n2)CC1	ZINC000819182977	FE	On-Demand	Anodyne	GPR119	54	51
O[C@@H](CNCCOc1ncccc1F)c1cccc(F)c1	ZINC000819182982	CE	On-Demand	Anodyne	ADRB2	20	40
O[C@@H](CNCCOc1ncccc1F)c1cccc(F)c1	ZINC000819182982	CE	On-Demand	Anodyne	ADRB1	32	40
O[C@@H](CNCCOc1ncccc1F)c1cccc(F)c1	ZINC000819182982	CE	On-Demand	Anodyne	ADRB3	50	41
O[C@H](CNCCOc1ncccc1F)c1cccc(F)c1	ZINC000819182983	CE	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNCCOc1ncccc1F)c1cccc(F)c1	ZINC000819182983	CE	On-Demand	Anodyne	ADRB1	32	40
O[C@H](CNCCOc1ncccc1F)c1cccc(F)c1	ZINC000819182983	CE	On-Demand	Anodyne	ADRB3	50	41
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1ccc(Cl)cc1	ZINC000819182993	FG	On-Demand	Anodyne	ADRB1	25	41
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1ccc(Cl)cc1	ZINC000819182993	FG	On-Demand	Anodyne	ADRB3	30	41
O[C@@H](CNCCOc1ncccc1F)c1ccc(F)c(F)c1	ZINC000819183000	DE	On-Demand	Anodyne	ADRB3	35	40
O[C@H](CNCCOc1ncccc1F)c1ccc(F)c(F)c1	ZINC000819183001	DE	On-Demand	Anodyne	ADRB3	35	40
O=S(=O)(NCCNC[C@H](O)c1ccc(Cl)cc1)c1cccs1	ZINC000819183019	FE	On-Demand	Anodyne	ADRB3	34	42
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1ccc(F)cc1	ZINC000819183020	EF	On-Demand	Anodyne	ADRB1	15	42
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1ccc(F)cc1	ZINC000819183020	EF	On-Demand	Anodyne	ADRB3	26	42
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1ccc(F)cc1	ZINC000819183021	EF	On-Demand	Anodyne	ADRB1	15	42
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1ccc(F)cc1	ZINC000819183021	EF	On-Demand	Anodyne	ADRB3	26	42
CC(C)CN1CCC[C@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819183096	DF	On-Demand	Anodyne	SLC6A3	15	43
CC(C)CN1CCC[C@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819183096	DF	On-Demand	Anodyne	CCR3	76	36
CC(C)CN1CCC[C@@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819183097	DF	On-Demand	Anodyne	SLC6A3	15	43
CC(C)CN1CCC[C@@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819183097	DF	On-Demand	Anodyne	CCR3	76	36
CC(C)CN1CCC[C@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819183098	DF	On-Demand	Anodyne	SLC6A3	15	43
CC(C)CN1CCC[C@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819183098	DF	On-Demand	Anodyne	CCR3	76	36
CC(C)CN1CCC[C@@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819183099	DF	On-Demand	Anodyne	SLC6A3	15	43
CC(C)CN1CCC[C@@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819183099	DF	On-Demand	Anodyne	CCR3	76	36
CCNC(=O)C(C)(C)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819183100	DD	On-Demand	Bother	CACNA1D	54	34
CCNC(=O)C(C)(C)CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819183101	DD	On-Demand	Bother	CACNA1D	54	34
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1cccc(-c2ccccn2)c1	ZINC000819183150	FG	On-Demand	Anodyne	PDS	46	31
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1cccc(-c2ccccn2)c1	ZINC000819183151	FG	On-Demand	Anodyne	PDS	46	31
C=C(C)C(C)(C)C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	ZINC000819183196	EG	On-Demand	Reactive	PDS	43	39
CCOC(=O)CC[C@H](O)CNCc1ccc(OC)c(C#N)c1	ZINC000819183209	DD	On-Demand	Mild	CASR	33	47
CCOC(=O)CC[C@@H](O)CNCc1ccc(OC)c(C#N)c1	ZINC000819183215	DD	On-Demand	Mild	CASR	33	47
O[C@H](CNCCOc1ncccc1F)c1cccnc1	ZINC000819183225	CD	On-Demand	Anodyne	ADRB2	28	55
O[C@H](CNCCOc1ncccc1F)c1cccnc1	ZINC000819183225	CD	On-Demand	Anodyne	ADRB1	37	55
O[C@H](CNCCOc1ncccc1F)c1cccnc1	ZINC000819183225	CD	On-Demand	Anodyne	ADRB3	106	57
O[C@@H](CNCCOc1ncccc1F)c1cccnc1	ZINC000819183226	CD	On-Demand	Anodyne	ADRB2	28	55
O[C@@H](CNCCOc1ncccc1F)c1cccnc1	ZINC000819183226	CD	On-Demand	Anodyne	ADRB1	37	55
O[C@@H](CNCCOc1ncccc1F)c1cccnc1	ZINC000819183226	CD	On-Demand	Anodyne	ADRB3	106	57
O=C(Cc1nsc2ccccc12)NCc1ccc(N2CCCCC2)cc1	ZINC000819183227	FI	On-Demand	Clean	HTR1A	23	44
O=C(Cc1nsc2ccccc12)NCc1ccc(N2CCCCC2)cc1	ZINC000819183227	FI	On-Demand	Clean	DRD2	25	43
O=C(Cc1nsc2ccccc12)NCc1ccc(N2CCCCC2)cc1	ZINC000819183227	FI	On-Demand	Clean	LIPA	51	31
O=C(Cc1nsc2ccccc12)NCc1ccc(N2CCCCC2)cc1	ZINC000819183227	FI	On-Demand	Clean	CACNA1G	15	40
O[C@@H](CNCCOc1ncccc1F)c1ccc(C(F)(F)F)cc1	ZINC000819183228	EF	On-Demand	Anodyne	ADRB3	17	43
O[C@H](CNCCOc1ncccc1F)c1ccc(C(F)(F)F)cc1	ZINC000819183229	EF	On-Demand	Anodyne	ADRB3	17	43
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1cccs1	ZINC000819183251	EC	On-Demand	Anodyne	ADRB2	33	46
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1cccs1	ZINC000819183251	EC	On-Demand	Anodyne	ADRB1	36	44
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1cccs1	ZINC000819183251	EC	On-Demand	Anodyne	ADRB3	122	49
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1cccs1	ZINC000819183253	EC	On-Demand	Anodyne	ADRB2	33	46
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1cccs1	ZINC000819183253	EC	On-Demand	Anodyne	ADRB1	36	44
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1cccs1	ZINC000819183253	EC	On-Demand	Anodyne	ADRB3	122	49
COc1ccc(-n2cnnc2SCC(=O)Nc2ccc(-c3nnc4n3CCCCCC4)cc2)cc1	ZINC000819183287	JI	On-Demand	Anodyne	ENPP1	60	31
CCNC(=O)C(C)(C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819183307	CE	On-Demand	Anodyne	ADRB1	45	48
CCNC(=O)C(C)(C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819183307	CE	On-Demand	Anodyne	ADRB3	62	48
CCNC(=O)C(C)(C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819183311	CE	On-Demand	Anodyne	ADRB1	45	48
CCNC(=O)C(C)(C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819183311	CE	On-Demand	Anodyne	ADRB3	62	48
COCCCOc1cccc(CNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819183337	FH	On-Demand	Anodyne	ADRB2	16	40
COCCCOc1cccc(CNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819183337	FH	On-Demand	Anodyne	ADRB1	17	40
COCCCOc1cccc(CNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819183339	FH	On-Demand	Anodyne	ADRB2	16	40
COCCCOc1cccc(CNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819183339	FH	On-Demand	Anodyne	ADRB1	17	40
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1cccnc1	ZINC000819183403	DC	On-Demand	Anodyne	ADRB2	35	52
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1cccnc1	ZINC000819183403	DC	On-Demand	Anodyne	ADRB1	40	49
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1cccnc1	ZINC000819183403	DC	On-Demand	Anodyne	ADRB3	137	61
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1cccnc1	ZINC000819183403	DC	On-Demand	Anodyne	TBXA2R	18	42
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1cccnc1	ZINC000819183403	DC	On-Demand	Anodyne	TBXAS1	44	43
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1cccnc1	ZINC000819183404	DC	On-Demand	Anodyne	ADRB2	35	52
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1cccnc1	ZINC000819183404	DC	On-Demand	Anodyne	ADRB1	40	49
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1cccnc1	ZINC000819183404	DC	On-Demand	Anodyne	ADRB3	137	61
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1cccnc1	ZINC000819183404	DC	On-Demand	Anodyne	TBXA2R	18	42
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1cccnc1	ZINC000819183404	DC	On-Demand	Anodyne	TBXAS1	44	43
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1CC(F)(F)F	ZINC000819183409	FF	On-Demand	Anodyne	ADRB1	29	42
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1CC(F)(F)F	ZINC000819183409	FF	On-Demand	Anodyne	ADRB3	45	44
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1CC(F)(F)F	ZINC000819183409	FF	On-Demand	Anodyne	CYP3A4	47	35
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1CC(F)(F)F	ZINC000819183410	FF	On-Demand	Anodyne	ADRB1	29	42
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1CC(F)(F)F	ZINC000819183410	FF	On-Demand	Anodyne	ADRB3	45	44
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1CC(F)(F)F	ZINC000819183410	FF	On-Demand	Anodyne	CYP3A4	47	35
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1CC(F)(F)F	ZINC000819183411	FF	On-Demand	Anodyne	ADRB1	29	42
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1CC(F)(F)F	ZINC000819183411	FF	On-Demand	Anodyne	ADRB3	45	44
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1CC(F)(F)F	ZINC000819183411	FF	On-Demand	Anodyne	CYP3A4	47	35
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1CC(F)(F)F	ZINC000819183412	FF	On-Demand	Anodyne	ADRB1	29	42
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1CC(F)(F)F	ZINC000819183412	FF	On-Demand	Anodyne	ADRB3	45	44
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1CC(F)(F)F	ZINC000819183412	FF	On-Demand	Anodyne	CYP3A4	47	35
O=S(=O)(NCCNC[C@H](O)c1ccc(F)cn1)c1cccnc1	ZINC000819183413	EC	On-Demand	Anodyne	ADRB2	23	44
O=S(=O)(NCCNC[C@H](O)c1ccc(F)cn1)c1cccnc1	ZINC000819183413	EC	On-Demand	Anodyne	ADRB1	22	44
O=S(=O)(NCCNC[C@H](O)c1ccc(F)cn1)c1cccnc1	ZINC000819183413	EC	On-Demand	Anodyne	ADRB3	85	44
O=S(=O)(NCCNC[C@H](O)c1ccc(F)cn1)c1cccnc1	ZINC000819183413	EC	On-Demand	Anodyne	TBXAS1	39	41
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)cn1)c1cccnc1	ZINC000819183414	EC	On-Demand	Anodyne	ADRB2	23	44
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)cn1)c1cccnc1	ZINC000819183414	EC	On-Demand	Anodyne	ADRB1	22	44
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)cn1)c1cccnc1	ZINC000819183414	EC	On-Demand	Anodyne	ADRB3	85	44
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)cn1)c1cccnc1	ZINC000819183414	EC	On-Demand	Anodyne	TBXAS1	39	41
CC(C)CN1CCC[C@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819183423	FH	On-Demand	Anodyne	CCR2	43	39
CC(C)CN1CCC[C@@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819183424	FH	On-Demand	Anodyne	CCR2	43	39
CC(C)CN1CCC[C@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819183425	FH	On-Demand	Anodyne	CCR2	43	39
CC(C)CN1CCC[C@@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819183426	FH	On-Demand	Anodyne	CCR2	43	39
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1cccc(Cl)c1	ZINC000819183431	FG	On-Demand	Anodyne	ADRB1	53	47
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1cccc(Cl)c1	ZINC000819183431	FG	On-Demand	Anodyne	ADRB3	71	47
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1cccc(Cl)c1	ZINC000819183432	FG	On-Demand	Anodyne	ADRB1	53	47
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1cccc(Cl)c1	ZINC000819183432	FG	On-Demand	Anodyne	ADRB3	71	47
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1ccccc1C(F)(F)F	ZINC000819183449	GH	On-Demand	Anodyne	ADRB1	15	41
O[C@@H](CNCCOc1ncccc1C(F)(F)F)c1ccccc1C(F)(F)F	ZINC000819183449	GH	On-Demand	Anodyne	ADRB3	21	41
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1ccccc1C(F)(F)F	ZINC000819183450	GH	On-Demand	Anodyne	ADRB1	15	41
O[C@H](CNCCOc1ncccc1C(F)(F)F)c1ccccc1C(F)(F)F	ZINC000819183450	GH	On-Demand	Anodyne	ADRB3	21	41
O=S(=O)(NCCNC[C@@H](O)c1cccc(C(F)(F)F)c1)c1cccs1	ZINC000819183469	GE	On-Demand	Anodyne	ADRB3	39	46
O=S(=O)(NCCNC[C@H](O)c1cccc(C(F)(F)F)c1)c1cccs1	ZINC000819183470	GE	On-Demand	Anodyne	ADRB3	39	46
C/C=C\c1ccc(OC[C@H](O)CNOCC(C)C)c(OC)c1	ZINC000819183501	DF	On-Demand	Anodyne	ADRB2	18	73
C/C=C/c1ccc(OC[C@H](O)CNOCC(C)C)c(OC)c1	ZINC000819183502	DF	On-Demand	Anodyne	ADRB2	18	73
C/C=C/c1ccc(OC[C@@H](O)CNOCC(C)C)c(OC)c1	ZINC000819183506	DF	On-Demand	Anodyne	ADRB2	18	73
C/C=C\c1ccc(OC[C@@H](O)CNOCC(C)C)c(OC)c1	ZINC000819183508	DF	On-Demand	Anodyne	ADRB2	18	73
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)CCCc1nc3ccccc3[nH]1)C2	ZINC000819183516	GF	On-Demand	Anodyne	CACNA1G	23	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)CCCc1nc3ccccc3[nH]1)C2	ZINC000819183517	GF	On-Demand	Anodyne	CACNA1G	23	45
Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	ZINC000819183524	IK	On-Demand	Anodyne	PPARG	75	42
Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	ZINC000819183524	IK	On-Demand	Anodyne	PPARA	80	38
Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	ZINC000819183524	IK	On-Demand	Anodyne	PDE8B	71	42
CSc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819183533	DE	On-Demand	Anodyne	ADRB2	36	42
CSc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819183533	DE	On-Demand	Anodyne	ADRB1	53	39
CSc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819183534	DE	On-Demand	Anodyne	ADRB2	36	42
CSc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819183534	DE	On-Demand	Anodyne	ADRB1	53	39
COCCCOc1cccc(CNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819183538	GH	On-Demand	Anodyne	ADRB2	25	44
COCCCOc1cccc(CNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819183540	GH	On-Demand	Anodyne	ADRB2	25	44
O=C(C(F)=C1CCC1)N1CCN(C2CC2)CC1	ZINC000819183542	BD	On-Demand	Anodyne	L3MBTL3	61	39
O[C@@H](CNCc1ccc(COC2CCOCC2)cc1)c1cccc(F)c1	ZINC000819183559	FG	On-Demand	Anodyne	ADRB1	17	40
O[C@H](CNCc1ccc(COC2CCOCC2)cc1)c1cccc(F)c1	ZINC000819183561	FG	On-Demand	Anodyne	ADRB1	17	40
C[C@H](CC(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)n1cccn1	ZINC000819183588	FE	On-Demand	Reactive	TACR1	15	40
C[C@H](CC(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)n1cccn1	ZINC000819183588	FE	On-Demand	Reactive	CCR2	50	36
C[C@H](CC(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)n1cccn1	ZINC000819183588	FE	On-Demand	Reactive	SCD1	21	42
C[C@H](CC(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)n1cccn1	ZINC000819183588	FE	On-Demand	Reactive	CARM1	62	37
C[C@@H](CC(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)n1cccn1	ZINC000819183589	FE	On-Demand	Reactive	TACR1	15	40
C[C@@H](CC(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)n1cccn1	ZINC000819183589	FE	On-Demand	Reactive	CCR2	50	36
C[C@@H](CC(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)n1cccn1	ZINC000819183589	FE	On-Demand	Reactive	SCD1	21	42
C[C@@H](CC(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1)n1cccn1	ZINC000819183589	FE	On-Demand	Reactive	CARM1	62	37
O=C(/C=C\[C@H]1CCCO1)NCc1cccc([N+](=O)[O-])c1	ZINC000819183590	CD	On-Demand	Bother	CACNA1C	48	35
O=C(/C=C\[C@H]1CCCO1)NCc1cccc([N+](=O)[O-])c1	ZINC000819183590	CD	On-Demand	Bother	CACNA1D	76	35
O=C(/C=C\[C@H]1CCCO1)NCc1cccc([N+](=O)[O-])c1	ZINC000819183590	CD	On-Demand	Bother	LUXR	17	45
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc([N+](=O)[O-])c1	ZINC000819183591	CD	On-Demand	Bother	CACNA1C	48	35
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc([N+](=O)[O-])c1	ZINC000819183591	CD	On-Demand	Bother	CACNA1D	76	35
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc([N+](=O)[O-])c1	ZINC000819183591	CD	On-Demand	Bother	LUXR	17	45
O=C(/C=C/[C@H]1CCCO1)NCc1cccc([N+](=O)[O-])c1	ZINC000819183592	CD	On-Demand	Bother	CACNA1C	48	35
O=C(/C=C/[C@H]1CCCO1)NCc1cccc([N+](=O)[O-])c1	ZINC000819183592	CD	On-Demand	Bother	CACNA1D	76	35
O=C(/C=C/[C@H]1CCCO1)NCc1cccc([N+](=O)[O-])c1	ZINC000819183592	CD	On-Demand	Bother	LUXR	17	45
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc([N+](=O)[O-])c1	ZINC000819183593	CD	On-Demand	Bother	CACNA1C	48	35
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc([N+](=O)[O-])c1	ZINC000819183593	CD	On-Demand	Bother	CACNA1D	76	35
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc([N+](=O)[O-])c1	ZINC000819183593	CD	On-Demand	Bother	LUXR	17	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](N1C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C1=O)C2	ZINC000819183639	GE	On-Demand	Anodyne	TACR1	26	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](N1C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C1=O)C2	ZINC000819183639	GE	On-Demand	Anodyne	CCKAR	49	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](N1C(=O)N[C@@H](Cc3c[nH]c4ccccc34)C1=O)C2	ZINC000819183639	GE	On-Demand	Anodyne	CCKBR	61	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](N1C(=O)N[C@H](Cc3c[nH]c4ccccc34)C1=O)C2	ZINC000819183640	GE	On-Demand	Anodyne	TACR1	26	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](N1C(=O)N[C@H](Cc3c[nH]c4ccccc34)C1=O)C2	ZINC000819183640	GE	On-Demand	Anodyne	CCKAR	49	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](N1C(=O)N[C@H](Cc3c[nH]c4ccccc34)C1=O)C2	ZINC000819183640	GE	On-Demand	Anodyne	CCKBR	61	40
CC(C)CN1CCC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819183682	DG	On-Demand	Anodyne	ADRB2	15	40
CC(C)CN1CCC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819183682	DG	On-Demand	Anodyne	ADRB1	35	41
CC(C)CN1CCC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819183682	DG	On-Demand	Anodyne	ADRB3	50	41
CC(C)CN1CCC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819183682	DG	On-Demand	Anodyne	CYP3A4	40	33
CC(C)CN1CCC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819183683	DG	On-Demand	Anodyne	ADRB2	15	40
CC(C)CN1CCC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819183683	DG	On-Demand	Anodyne	ADRB1	35	41
CC(C)CN1CCC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819183683	DG	On-Demand	Anodyne	ADRB3	50	41
CC(C)CN1CCC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819183683	DG	On-Demand	Anodyne	CYP3A4	40	33
CC(C)CN1CCC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819183684	DG	On-Demand	Anodyne	ADRB2	15	40
CC(C)CN1CCC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819183684	DG	On-Demand	Anodyne	ADRB1	35	41
CC(C)CN1CCC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819183684	DG	On-Demand	Anodyne	ADRB3	50	41
CC(C)CN1CCC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819183684	DG	On-Demand	Anodyne	CYP3A4	40	33
CC(C)CN1CCC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819183685	DG	On-Demand	Anodyne	ADRB2	15	40
CC(C)CN1CCC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819183685	DG	On-Demand	Anodyne	ADRB1	35	41
CC(C)CN1CCC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819183685	DG	On-Demand	Anodyne	ADRB3	50	41
CC(C)CN1CCC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819183685	DG	On-Demand	Anodyne	CYP3A4	40	33
O=C1[C@H](NC[C@H](O)c2cccnc2)CCCN1CC(F)(F)F	ZINC000819183719	DD	On-Demand	Anodyne	ADRB3	67	43
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCCN1CC(F)(F)F	ZINC000819183721	DD	On-Demand	Anodyne	ADRB3	67	43
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCCN1CC(F)(F)F	ZINC000819183724	DD	On-Demand	Anodyne	ADRB3	67	43
C/C=C\c1ccc(OC[C@@H](O)CNCc2ccc(OC)c(C#N)c2)c(OC)c1	ZINC000819183725	GG	On-Demand	Mild	ADRB1	49	33
C/C=C\c1ccc(OC[C@@H](O)CNCc2ccc(OC)c(C#N)c2)c(OC)c1	ZINC000819183725	GG	On-Demand	Mild	CASR	43	39
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCCN1CC(F)(F)F	ZINC000819183726	DD	On-Demand	Anodyne	ADRB3	67	43
C/C=C\c1ccc(OC[C@H](O)CNCc2ccc(OC)c(C#N)c2)c(OC)c1	ZINC000819183727	GG	On-Demand	Mild	ADRB1	49	33
C/C=C\c1ccc(OC[C@H](O)CNCc2ccc(OC)c(C#N)c2)c(OC)c1	ZINC000819183727	GG	On-Demand	Mild	CASR	43	39
C/C=C/c1ccc(OC[C@@H](O)CNCc2ccc(OC)c(C#N)c2)c(OC)c1	ZINC000819183729	GG	On-Demand	Mild	ADRB1	49	33
C/C=C/c1ccc(OC[C@@H](O)CNCc2ccc(OC)c(C#N)c2)c(OC)c1	ZINC000819183729	GG	On-Demand	Mild	CASR	43	39
C/C=C/c1ccc(OC[C@H](O)CNCc2ccc(OC)c(C#N)c2)c(OC)c1	ZINC000819183731	GG	On-Demand	Mild	ADRB1	49	33
C/C=C/c1ccc(OC[C@H](O)CNCc2ccc(OC)c(C#N)c2)c(OC)c1	ZINC000819183731	GG	On-Demand	Mild	CASR	43	39
O=S(=O)(NCCNC[C@@H](O)C1CC1)c1cccnc1	ZINC000819183761	CB	On-Demand	Anodyne	ADRB3	72	39
O=S(=O)(NCCNC[C@@H](O)C1CC1)c1cccnc1	ZINC000819183761	CB	On-Demand	Anodyne	TBXA2R	19	41
O=S(=O)(NCCNC[C@H](O)C1CC1)c1cccnc1	ZINC000819183763	CB	On-Demand	Anodyne	ADRB3	72	39
O=S(=O)(NCCNC[C@H](O)C1CC1)c1cccnc1	ZINC000819183763	CB	On-Demand	Anodyne	TBXA2R	19	41
Cn1cc(CNC[C@@H](O)c2cccc(Cl)c2)c(C(F)(F)F)n1	ZINC000819183813	EF	On-Demand	Anodyne	ADRB1	28	40
Cn1cc(CNC[C@@H](O)c2cccc(Cl)c2)c(C(F)(F)F)n1	ZINC000819183813	EF	On-Demand	Anodyne	ADRB3	41	42
Cn1cc(CNC[C@H](O)c2cccc(Cl)c2)c(C(F)(F)F)n1	ZINC000819183814	EF	On-Demand	Anodyne	ADRB1	28	40
Cn1cc(CNC[C@H](O)c2cccc(Cl)c2)c(C(F)(F)F)n1	ZINC000819183814	EF	On-Demand	Anodyne	ADRB3	41	42
CCC(CC)[C@@H](CCNC[C@H](O)c1ccccc1)OC	ZINC000819183815	CG	On-Demand	Anodyne	ADRB2	21	44
CCC(CC)[C@@H](CCNC[C@H](O)c1ccccc1)OC	ZINC000819183815	CG	On-Demand	Anodyne	ADRB3	43	37
CCC(CC)[C@@H](CCNC[C@@H](O)c1ccccc1)OC	ZINC000819183816	CG	On-Demand	Anodyne	ADRB2	21	44
CCC(CC)[C@@H](CCNC[C@@H](O)c1ccccc1)OC	ZINC000819183816	CG	On-Demand	Anodyne	ADRB3	43	37
CCC(CC)[C@H](CCNC[C@H](O)c1ccccc1)OC	ZINC000819183817	CG	On-Demand	Anodyne	ADRB2	21	44
CCC(CC)[C@H](CCNC[C@H](O)c1ccccc1)OC	ZINC000819183817	CG	On-Demand	Anodyne	ADRB3	43	37
CCC(CC)[C@H](CCNC[C@@H](O)c1ccccc1)OC	ZINC000819183818	CG	On-Demand	Anodyne	ADRB2	21	44
CCC(CC)[C@H](CCNC[C@@H](O)c1ccccc1)OC	ZINC000819183818	CG	On-Demand	Anodyne	ADRB3	43	37
CC(C)CN1CCC[C@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819183843	DF	On-Demand	Anodyne	CCR3	53	35
CC(C)CN1CCC[C@@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819183844	DF	On-Demand	Anodyne	CCR3	53	35
CC(C)CN1CCC[C@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819183845	DF	On-Demand	Anodyne	CCR3	53	35
CC(C)CN1CCC[C@@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819183846	DF	On-Demand	Anodyne	CCR3	53	35
CN(C)c1ccc(NC(=O)CCNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819183860	GD	On-Demand	Anodyne	ADRB3	19	40
CN(C)c1ccc(NC(=O)CCNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819183860	GD	On-Demand	Anodyne	TBXAS1	44	38
CN(C)c1ccc(NC(=O)CCNCCNS(=O)(=O)c2cccnc2)cc1	ZINC000819183860	GD	On-Demand	Anodyne	NAMPT	55	46
CC(=O)Nc1ccc(OC[C@@H](O)CNOCC(C)C)cc1	ZINC000819183875	CD	On-Demand	Anodyne	ADRB2	53	70
CC(=O)Nc1ccc(OC[C@@H](O)CNOCC(C)C)cc1	ZINC000819183875	CD	On-Demand	Anodyne	ADRB1	82	70
CC(=O)Nc1ccc(OC[C@@H](O)CNOCC(C)C)cc1	ZINC000819183875	CD	On-Demand	Anodyne	ADRB3	51	56
CC(=O)Nc1ccc(OC[C@H](O)CNOCC(C)C)cc1	ZINC000819183876	CD	On-Demand	Anodyne	ADRB2	53	70
CC(=O)Nc1ccc(OC[C@H](O)CNOCC(C)C)cc1	ZINC000819183876	CD	On-Demand	Anodyne	ADRB1	82	70
CC(=O)Nc1ccc(OC[C@H](O)CNOCC(C)C)cc1	ZINC000819183876	CD	On-Demand	Anodyne	ADRB3	51	56
O=C(/C=C\[C@H]1CCCO1)NNC(=O)NCc1cccc(C(F)(F)F)c1	ZINC000819183878	FE	On-Demand	Reactive	CCR2	63	36
O=C(/C=C\[C@@H]1CCCO1)NNC(=O)NCc1cccc(C(F)(F)F)c1	ZINC000819183879	FE	On-Demand	Reactive	CCR2	63	36
O=C(/C=C/[C@H]1CCCO1)NNC(=O)NCc1cccc(C(F)(F)F)c1	ZINC000819183880	FE	On-Demand	Reactive	CCR2	63	36
O=C(/C=C/[C@@H]1CCCO1)NNC(=O)NCc1cccc(C(F)(F)F)c1	ZINC000819183881	FE	On-Demand	Reactive	CCR2	63	36
COCCCOc1cccc(CNC[C@H](O)c2cccc3ccccc23)c1	ZINC000819183882	FI	On-Demand	Anodyne	PDS	47	35
COc1cccc(OC)c1OC[C@H](O)CNOCC(C)C	ZINC000819183885	CD	On-Demand	Anodyne	ADRB2	33	48
COc1cccc(OC)c1OC[C@H](O)CNOCC(C)C	ZINC000819183885	CD	On-Demand	Anodyne	ADRB1	32	46
COc1cccc(OC)c1OC[C@@H](O)CNOCC(C)C	ZINC000819183889	CD	On-Demand	Anodyne	ADRB2	33	48
COc1cccc(OC)c1OC[C@@H](O)CNOCC(C)C	ZINC000819183889	CD	On-Demand	Anodyne	ADRB1	32	46
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)COc2ccc(C)cc2)c1	ZINC000819183911	EG	On-Demand	Anodyne	ADRB1	19	42
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)COc2ccc(C)cc2)c1	ZINC000819183911	EG	On-Demand	Anodyne	TSHR	42	33
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)COc2ccc(C)cc2)c1	ZINC000819183911	EG	On-Demand	Anodyne	MTNR1A	25	48
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)COc2ccc(C)cc2)c1	ZINC000819183911	EG	On-Demand	Anodyne	MTNR1B	25	48
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)COc2ccc(C)cc2)c1	ZINC000819183911	EG	On-Demand	Anodyne	KCNK3	47	33
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)COc2ccc(C)cc2)c1	ZINC000819183911	EG	On-Demand	Anodyne	KCNK9	43	32
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)COc2ccc(C)cc2)c1	ZINC000819183911	EG	On-Demand	Anodyne	PDS	50	34
CC(=O)Nc1cccc(CC(=O)N[C@H](C)COc2ccc(C)cc2)c1	ZINC000819183913	EG	On-Demand	Anodyne	ADRB1	19	42
CC(=O)Nc1cccc(CC(=O)N[C@H](C)COc2ccc(C)cc2)c1	ZINC000819183913	EG	On-Demand	Anodyne	TSHR	42	33
CC(=O)Nc1cccc(CC(=O)N[C@H](C)COc2ccc(C)cc2)c1	ZINC000819183913	EG	On-Demand	Anodyne	MTNR1A	25	48
CC(=O)Nc1cccc(CC(=O)N[C@H](C)COc2ccc(C)cc2)c1	ZINC000819183913	EG	On-Demand	Anodyne	MTNR1B	25	48
CC(=O)Nc1cccc(CC(=O)N[C@H](C)COc2ccc(C)cc2)c1	ZINC000819183913	EG	On-Demand	Anodyne	KCNK3	47	33
CC(=O)Nc1cccc(CC(=O)N[C@H](C)COc2ccc(C)cc2)c1	ZINC000819183913	EG	On-Demand	Anodyne	KCNK9	43	32
CC(=O)Nc1cccc(CC(=O)N[C@H](C)COc2ccc(C)cc2)c1	ZINC000819183913	EG	On-Demand	Anodyne	PDS	50	34
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)cc1)c1cccs1	ZINC000819183957	ED	On-Demand	Anodyne	ADRB3	31	41
O=S(=O)(NCCNC[C@H](O)c1ccc(F)cc1)c1cccs1	ZINC000819183960	ED	On-Demand	Anodyne	ADRB3	31	41
CN(C)c1ccc(NC(=O)CCNCCOc2ncccc2F)cc1	ZINC000819183963	EE	On-Demand	Anodyne	P2RY1	15	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccccc1-n1cccn1	ZINC000819183964	FE	On-Demand	Anodyne	AMP1_PLAFQ	21	42
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819183968	DG	On-Demand	Anodyne	DRD4	28	44
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819183968	DG	On-Demand	Anodyne	ACHE	31	40
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819183968	DG	On-Demand	Anodyne	SLC6A1	81	33
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819183968	DG	On-Demand	Anodyne	SIGMAR1	45	52
O=C(NC[C@H]1CCCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819183968	DG	On-Demand	Anodyne	CCR3	45	51
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1cccc(S(=O)(=O)NC2CC2)c1	ZINC000819183994	IF	On-Demand	Anodyne	SFRP1	47	35
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)c1cccc(S(=O)(=O)NC2CC2)c1	ZINC000819183995	IF	On-Demand	Anodyne	SFRP1	47	35
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H](CCC#N)c2ccccc2)CC1	ZINC000819183998	GH	On-Demand	Mild	GPR119	35	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H](CCC#N)c2ccccc2)CC1	ZINC000819183999	GH	On-Demand	Mild	GPR119	35	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H](CCC#N)c2ccccc2)CC1	ZINC000819184000	GH	On-Demand	Mild	GPR119	35	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H](CCC#N)c2ccccc2)CC1	ZINC000819184001	GH	On-Demand	Mild	GPR119	35	46
O[C@H](CNCc1cccc(F)n1)COc1ccccc1C(F)(F)F	ZINC000819184009	EF	On-Demand	Anodyne	ADRB2	21	44
O[C@H](CNCc1cccc(F)n1)COc1ccccc1C(F)(F)F	ZINC000819184009	EF	On-Demand	Anodyne	ADRB1	57	36
O[C@@H](CNCc1cccc(F)n1)COc1ccccc1C(F)(F)F	ZINC000819184010	EF	On-Demand	Anodyne	ADRB2	21	44
O[C@@H](CNCc1cccc(F)n1)COc1ccccc1C(F)(F)F	ZINC000819184010	EF	On-Demand	Anodyne	ADRB1	57	36
CN(C)c1ccc(NC(=O)CCNCCOc2ncccc2C(F)(F)F)cc1	ZINC000819184024	GG	On-Demand	Anodyne	P2RY1	30	46
COc1ccccc1COC[C@@H](O)CNOCC(C)C	ZINC000819184029	CD	On-Demand	Anodyne	ADRB2	22	41
COc1ccccc1COC[C@H](O)CNOCC(C)C	ZINC000819184030	CD	On-Demand	Anodyne	ADRB2	22	41
CC(C)(C)OC(=O)NCCNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819184046	FF	On-Demand	Anodyne	MTNR1A	17	43
CC(C)(C)OC(=O)NCCNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819184046	FF	On-Demand	Anodyne	MTNR1B	15	43
CC(C)(C)OC(=O)NCCNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819184046	FF	On-Demand	Anodyne	PDS	49	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(N3CCCCC3)cc1)C2	ZINC000819184061	GG	On-Demand	Clean	VHL	41	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(N3CCCCC3)cc1)C2	ZINC000819184062	GG	On-Demand	Clean	VHL	41	35
O[C@@H](CNCc1ccc(COC2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819184066	GH	On-Demand	Anodyne	ADRB2	25	40
O[C@@H](CNCc1ccc(COC2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819184066	GH	On-Demand	Anodyne	ADRB1	43	45
O[C@@H](CNCc1ccc(COC2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819184066	GH	On-Demand	Anodyne	ADRB3	54	45
O[C@@H](CNCc1ccc(COC2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819184066	GH	On-Demand	Anodyne	CYP3A4	47	37
O[C@H](CNCc1ccc(COC2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819184067	GH	On-Demand	Anodyne	ADRB2	25	40
O[C@H](CNCc1ccc(COC2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819184067	GH	On-Demand	Anodyne	ADRB1	43	45
O[C@H](CNCc1ccc(COC2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819184067	GH	On-Demand	Anodyne	ADRB3	54	45
O[C@H](CNCc1ccc(COC2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819184067	GH	On-Demand	Anodyne	CYP3A4	47	37
N#Cc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184087	DD	On-Demand	Mild	ADRB2	33	40
N#Cc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184087	DD	On-Demand	Mild	ADRB1	60	36
N#Cc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184088	DD	On-Demand	Mild	ADRB2	33	40
N#Cc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184088	DD	On-Demand	Mild	ADRB1	60	36
O[C@H](CNCc1cccc(F)n1)COc1cccc(Br)c1	ZINC000819184117	FF	On-Demand	Anodyne	ADRB2	23	40
O[C@@H](CNCc1cccc(F)n1)COc1cccc(Br)c1	ZINC000819184118	FF	On-Demand	Anodyne	ADRB2	23	40
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2cccc(F)n2)c1	ZINC000819184125	DD	On-Demand	Bother	ADRB2	18	46
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2cccc(F)n2)c1	ZINC000819184125	DD	On-Demand	Bother	ADRB1	25	46
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2cccc(F)n2)c1	ZINC000819184125	DD	On-Demand	Bother	ADRB3	18	46
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2cccc(F)n2)c1	ZINC000819184126	DD	On-Demand	Bother	ADRB2	18	46
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2cccc(F)n2)c1	ZINC000819184126	DD	On-Demand	Bother	ADRB1	25	46
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2cccc(F)n2)c1	ZINC000819184126	DD	On-Demand	Bother	ADRB3	18	46
COc1cccc(C(C)(C)CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819184129	GF	On-Demand	Anodyne	ADRB3	36	40
COc1cccc(C(C)(C)CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819184130	GF	On-Demand	Anodyne	ADRB3	36	40
C[C@H](CNCCC(=O)Nc1cccc(F)c1)CNC(=O)OC(C)(C)C	ZINC000819184140	FF	On-Demand	Anodyne	PAPA1_CARPA	22	40
C[C@@H](CNCCC(=O)Nc1cccc(F)c1)CNC(=O)OC(C)(C)C	ZINC000819184141	FF	On-Demand	Anodyne	PAPA1_CARPA	22	40
Cc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184142	CE	On-Demand	Anodyne	ADRB2	46	50
Cc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184142	CE	On-Demand	Anodyne	ADRB1	64	42
Cc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184142	CE	On-Demand	Anodyne	ADRB3	38	42
Cc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184143	CE	On-Demand	Anodyne	ADRB2	46	50
Cc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184143	CE	On-Demand	Anodyne	ADRB1	64	42
Cc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184143	CE	On-Demand	Anodyne	ADRB3	38	42
CC(=O)c1cccc(OC[C@@H](O)CNCc2cccc(F)n2)c1	ZINC000819184144	DD	On-Demand	Anodyne	ADRB2	32	44
CC(=O)c1cccc(OC[C@@H](O)CNCc2cccc(F)n2)c1	ZINC000819184144	DD	On-Demand	Anodyne	ADRB1	54	39
CC(=O)c1cccc(OC[C@@H](O)CNCc2cccc(F)n2)c1	ZINC000819184144	DD	On-Demand	Anodyne	ABCB1	18	45
CC(=O)c1cccc(OC[C@@H](O)CNCc2cccc(F)n2)c1	ZINC000819184144	DD	On-Demand	Anodyne	PDS	45	35
CC(=O)c1cccc(OC[C@H](O)CNCc2cccc(F)n2)c1	ZINC000819184145	DD	On-Demand	Anodyne	ADRB2	32	44
CC(=O)c1cccc(OC[C@H](O)CNCc2cccc(F)n2)c1	ZINC000819184145	DD	On-Demand	Anodyne	ADRB1	54	39
CC(=O)c1cccc(OC[C@H](O)CNCc2cccc(F)n2)c1	ZINC000819184145	DD	On-Demand	Anodyne	ABCB1	18	45
CC(=O)c1cccc(OC[C@H](O)CNCc2cccc(F)n2)c1	ZINC000819184145	DD	On-Demand	Anodyne	PDS	45	35
O[C@H](CNCc1cccc(F)n1)COc1ccc(Cl)cc1	ZINC000819184179	DE	On-Demand	Anodyne	ADRB2	38	42
O[C@H](CNCc1cccc(F)n1)COc1ccc(Cl)cc1	ZINC000819184179	DE	On-Demand	Anodyne	ADRB1	60	42
O[C@H](CNCc1cccc(F)n1)COc1ccc(Cl)cc1	ZINC000819184179	DE	On-Demand	Anodyne	GRIN1	15	42
O[C@H](CNCc1cccc(F)n1)COc1ccc(Cl)cc1	ZINC000819184179	DE	On-Demand	Anodyne	ADRB3	34	42
O[C@@H](CNCc1cccc(F)n1)COc1ccc(Cl)cc1	ZINC000819184181	DE	On-Demand	Anodyne	ADRB2	38	42
O[C@@H](CNCc1cccc(F)n1)COc1ccc(Cl)cc1	ZINC000819184181	DE	On-Demand	Anodyne	ADRB1	60	42
O[C@@H](CNCc1cccc(F)n1)COc1ccc(Cl)cc1	ZINC000819184181	DE	On-Demand	Anodyne	GRIN1	15	42
O[C@@H](CNCc1cccc(F)n1)COc1ccc(Cl)cc1	ZINC000819184181	DE	On-Demand	Anodyne	ADRB3	34	42
COc1cccc(C(C)(C)CNC[C@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819184183	FF	On-Demand	Anodyne	DRD4	41	31
COc1cccc(C(C)(C)CNC[C@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819184183	FF	On-Demand	Anodyne	MTNR1A	45	38
COc1cccc(C(C)(C)CNC[C@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819184183	FF	On-Demand	Anodyne	MTNR1B	43	38
COc1cccc(C(C)(C)CNC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819184185	FF	On-Demand	Anodyne	DRD4	41	31
COc1cccc(C(C)(C)CNC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819184185	FF	On-Demand	Anodyne	MTNR1A	45	38
COc1cccc(C(C)(C)CNC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819184185	FF	On-Demand	Anodyne	MTNR1B	43	38
Cn1cc(CNC[C@@H](O)c2ccc(F)cc2Cl)c(C(F)(F)F)n1	ZINC000819184196	FG	On-Demand	Anodyne	P2RX7	22	44
Cn1cc(CNC[C@H](O)c2ccc(F)cc2Cl)c(C(F)(F)F)n1	ZINC000819184198	FG	On-Demand	Anodyne	P2RX7	22	44
Cc1noc(C)c1[C@H](C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819184244	DG	On-Demand	Anodyne	ADRB1	27	40
Cc1noc(C)c1[C@H](C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819184244	DG	On-Demand	Anodyne	ADRB3	40	40
Cc1noc(C)c1[C@@H](C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819184247	DG	On-Demand	Anodyne	ADRB1	27	40
Cc1noc(C)c1[C@@H](C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819184247	DG	On-Demand	Anodyne	ADRB3	40	40
Cc1noc(C)c1[C@H](C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819184249	DG	On-Demand	Anodyne	ADRB1	27	40
Cc1noc(C)c1[C@H](C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819184249	DG	On-Demand	Anodyne	ADRB3	40	40
Cc1noc(C)c1[C@@H](C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819184252	DG	On-Demand	Anodyne	ADRB1	27	40
Cc1noc(C)c1[C@@H](C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819184252	DG	On-Demand	Anodyne	ADRB3	40	40
CCC(CC)[C@@H](CCNC[C@H](O)c1cccc(F)c1)OC	ZINC000819184255	CG	On-Demand	Anodyne	ADRB1	21	43
CCC(CC)[C@@H](CCNC[C@H](O)c1cccc(F)c1)OC	ZINC000819184255	CG	On-Demand	Anodyne	ADRB3	32	43
CCC(CC)[C@@H](CCNC[C@@H](O)c1cccc(F)c1)OC	ZINC000819184257	CG	On-Demand	Anodyne	ADRB1	21	43
CCC(CC)[C@@H](CCNC[C@@H](O)c1cccc(F)c1)OC	ZINC000819184257	CG	On-Demand	Anodyne	ADRB3	32	43
CCC(CC)[C@H](CCNC[C@H](O)c1cccc(F)c1)OC	ZINC000819184259	CG	On-Demand	Anodyne	ADRB1	21	43
CCC(CC)[C@H](CCNC[C@H](O)c1cccc(F)c1)OC	ZINC000819184259	CG	On-Demand	Anodyne	ADRB3	32	43
CCC(CC)[C@H](CCNC[C@@H](O)c1cccc(F)c1)OC	ZINC000819184260	CG	On-Demand	Anodyne	ADRB1	21	43
CCC(CC)[C@H](CCNC[C@@H](O)c1cccc(F)c1)OC	ZINC000819184260	CG	On-Demand	Anodyne	ADRB3	32	43
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@H](OC1CCOCC1)c1ccccc1	ZINC000819184264	GI	On-Demand	Anodyne	ADRB1	34	45
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@H](OC1CCOCC1)c1ccccc1	ZINC000819184264	GI	On-Demand	Anodyne	ADRB3	53	45
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@H](OC1CCOCC1)c1ccccc1	ZINC000819184264	GI	On-Demand	Anodyne	CYP3A4	48	36
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@@H](OC1CCOCC1)c1ccccc1	ZINC000819184268	GI	On-Demand	Anodyne	ADRB1	34	45
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@@H](OC1CCOCC1)c1ccccc1	ZINC000819184268	GI	On-Demand	Anodyne	ADRB3	53	45
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@@H](OC1CCOCC1)c1ccccc1	ZINC000819184268	GI	On-Demand	Anodyne	CYP3A4	48	36
O=C(/C=C/[C@H]1CCCO1)NC1CCN(CC(F)(F)F)CC1	ZINC000819184274	DD	On-Demand	Anodyne	HPGDS	36	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(CC(F)(F)F)CC1	ZINC000819184277	DD	On-Demand	Anodyne	HPGDS	36	41
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(CC(F)(F)F)CC1	ZINC000819184279	DD	On-Demand	Anodyne	HPGDS	36	41
O=C(/C=C\[C@H]1CCCO1)NC1CCN(CC(F)(F)F)CC1	ZINC000819184282	DD	On-Demand	Anodyne	HPGDS	36	41
COc1cccc([S@@](=O)CC(=O)NCCNC(=O)OC(C)(C)C)c1	ZINC000819184285	FD	On-Demand	Anodyne	DRD4	42	32
COc1cccc([S@@](=O)CC(=O)NCCNC(=O)OC(C)(C)C)c1	ZINC000819184285	FD	On-Demand	Anodyne	NQO2	26	40
COc1cccc([S@@](=O)CC(=O)NCCNC(=O)OC(C)(C)C)c1	ZINC000819184285	FD	On-Demand	Anodyne	MTNR1A	61	44
COc1cccc([S@@](=O)CC(=O)NCCNC(=O)OC(C)(C)C)c1	ZINC000819184285	FD	On-Demand	Anodyne	MTNR1B	56	42
COc1ccc(OC)c([C@H](O)CNC[C@@H](c2ccccc2)C(C)(C)CO)c1	ZINC000819184299	FG	On-Demand	Anodyne	ADRB2	21	46
COc1ccc(OC)c([C@H](O)CNC[C@H](c2ccccc2)C(C)(C)CO)c1	ZINC000819184302	FG	On-Demand	Anodyne	ADRB2	21	46
CC(=O)c1cccc(OC[C@@H](O)CNOCC(C)C)c1	ZINC000819184332	CD	On-Demand	Anodyne	ADRB2	35	52
CC(=O)c1cccc(OC[C@@H](O)CNOCC(C)C)c1	ZINC000819184332	CD	On-Demand	Anodyne	ADRB1	44	47
CC(=O)c1cccc(OC[C@@H](O)CNOCC(C)C)c1	ZINC000819184332	CD	On-Demand	Anodyne	ABCB1	21	48
CC(=O)c1cccc(OC[C@@H](O)CNOCC(C)C)c1	ZINC000819184332	CD	On-Demand	Anodyne	PDS	57	38
CC(=O)c1cccc(OC[C@H](O)CNOCC(C)C)c1	ZINC000819184334	CD	On-Demand	Anodyne	ADRB2	35	52
CC(=O)c1cccc(OC[C@H](O)CNOCC(C)C)c1	ZINC000819184334	CD	On-Demand	Anodyne	ADRB1	44	47
CC(=O)c1cccc(OC[C@H](O)CNOCC(C)C)c1	ZINC000819184334	CD	On-Demand	Anodyne	ABCB1	21	48
CC(=O)c1cccc(OC[C@H](O)CNOCC(C)C)c1	ZINC000819184334	CD	On-Demand	Anodyne	PDS	57	38
NC(=O)NCc1ccc(NC(=O)C(F)=C2CCC2)cc1	ZINC000819184352	CE	On-Demand	Anodyne	TPSAB1	15	44
O=C(NC1CCN(CC(F)(F)F)CC1)C(F)=C1CCC1	ZINC000819184386	CF	On-Demand	Anodyne	HPGDS	39	45
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)c1	ZINC000819184398	GI	On-Demand	Clean	PTGIR	15	42
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N(C)C3CCCCC3)cc2)c1	ZINC000819184398	GI	On-Demand	Clean	MCHR1	15	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ccccc2Cl)c1	ZINC000819184421	EF	On-Demand	Bother	ADRB1	42	46
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ccccc2Cl)c1	ZINC000819184421	EF	On-Demand	Bother	ADRB3	49	46
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ccccc2Cl)c1	ZINC000819184421	EF	On-Demand	Bother	CACNA1D	19	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ncccc2F)CC1	ZINC000819184422	FE	On-Demand	Anodyne	GRIN2B	18	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ncccc2F)CC1	ZINC000819184422	FE	On-Demand	Anodyne	GPR119	64	55
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ccccc2Cl)c1	ZINC000819184423	EF	On-Demand	Bother	ADRB1	42	46
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ccccc2Cl)c1	ZINC000819184423	EF	On-Demand	Bother	ADRB3	49	46
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ccccc2Cl)c1	ZINC000819184423	EF	On-Demand	Bother	CACNA1D	19	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ncccc2F)CC1	ZINC000819184424	FE	On-Demand	Anodyne	GRIN2B	18	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ncccc2F)CC1	ZINC000819184424	FE	On-Demand	Anodyne	GPR119	64	55
O=C(/C=C\[C@H]1CCCO1)N1CCN(C2CC2)CC1	ZINC000819184431	CD	On-Demand	Anodyne	L3MBTL3	47	35
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C2CC2)CC1	ZINC000819184433	CD	On-Demand	Anodyne	L3MBTL3	47	35
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C2CC2)CC1	ZINC000819184434	CD	On-Demand	Anodyne	L3MBTL3	47	35
O=C(/C=C/[C@H]1CCCO1)N1CCN(C2CC2)CC1	ZINC000819184436	CD	On-Demand	Anodyne	L3MBTL3	47	35
O[C@@H](CNCCOc1ccccc1Cl)c1ccccc1Cl	ZINC000819184438	EH	On-Demand	Anodyne	ADRB2	21	49
O=C(NCc1cccc([N+](=O)[O-])c1)C(F)=C1CCC1	ZINC000819184448	CF	On-Demand	Bother	CACNA1C	52	36
O=C(NCc1cccc([N+](=O)[O-])c1)C(F)=C1CCC1	ZINC000819184448	CF	On-Demand	Bother	CACNA1D	79	36
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCCCC3)cc2)c1	ZINC000819184460	FG	On-Demand	Clean	PTGIR	15	42
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCCCC3)cc2)c1	ZINC000819184460	FG	On-Demand	Clean	KCNQ2	36	40
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCCCC3)cc2)c1	ZINC000819184460	FG	On-Demand	Clean	TAAR1	26	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCOc2ncccc2F)CC1	ZINC000819184473	GE	On-Demand	Anodyne	GPR119	62	50
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCOc2ncccc2F)CC1	ZINC000819184474	GE	On-Demand	Anodyne	GPR119	62	50
O=S(=O)(NCCNC[C@@H](O)c1ccc(Cl)c(F)c1)c1cccs1	ZINC000819184481	GE	On-Demand	Anodyne	ADRB3	28	42
O=S(=O)(NCCNC[C@H](O)c1ccc(Cl)c(F)c1)c1cccs1	ZINC000819184482	GE	On-Demand	Anodyne	ADRB3	28	42
O[C@@H](CNCCOc1ncccc1F)c1ccc(F)cc1	ZINC000819184484	CE	On-Demand	Anodyne	ADRB1	18	40
O[C@@H](CNCCOc1ncccc1F)c1ccc(F)cc1	ZINC000819184484	CE	On-Demand	Anodyne	ADRB3	27	41
O[C@H](CNCCOc1ncccc1F)c1ccc(F)cc1	ZINC000819184485	CE	On-Demand	Anodyne	ADRB1	18	40
O[C@H](CNCCOc1ncccc1F)c1ccc(F)cc1	ZINC000819184485	CE	On-Demand	Anodyne	ADRB3	27	41
O[C@@H](CNCCOc1ncccc1F)c1cccc(Cl)c1	ZINC000819184514	DF	On-Demand	Anodyne	ADRB2	34	41
O[C@@H](CNCCOc1ncccc1F)c1cccc(Cl)c1	ZINC000819184514	DF	On-Demand	Anodyne	ADRB1	58	47
O[C@@H](CNCCOc1ncccc1F)c1cccc(Cl)c1	ZINC000819184514	DF	On-Demand	Anodyne	ADRB3	74	47
O[C@H](CNCCOc1ncccc1F)c1cccc(Cl)c1	ZINC000819184515	DF	On-Demand	Anodyne	ADRB2	34	41
O[C@H](CNCCOc1ncccc1F)c1cccc(Cl)c1	ZINC000819184515	DF	On-Demand	Anodyne	ADRB1	58	47
O[C@H](CNCCOc1ncccc1F)c1cccc(Cl)c1	ZINC000819184515	DF	On-Demand	Anodyne	ADRB3	74	47
C[C@H](CNC[C@H](O)c1ccc(Br)cc1)CNC(=O)OC(C)(C)C	ZINC000819184546	GG	On-Demand	Anodyne	PAPA1_CARPA	22	41
C[C@H](CNC[C@@H](O)c1ccc(Br)cc1)CNC(=O)OC(C)(C)C	ZINC000819184547	GG	On-Demand	Anodyne	PAPA1_CARPA	22	41
C[C@@H](CNC[C@@H](O)c1ccc(Br)cc1)CNC(=O)OC(C)(C)C	ZINC000819184548	GG	On-Demand	Anodyne	PAPA1_CARPA	22	41
C[C@@H](CNC[C@H](O)c1ccc(Br)cc1)CNC(=O)OC(C)(C)C	ZINC000819184549	GG	On-Demand	Anodyne	PAPA1_CARPA	22	41
N#CCc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184550	DD	On-Demand	Mild	ADRB2	39	40
N#CCc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184550	DD	On-Demand	Mild	ADRB1	62	40
N#CCc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184550	DD	On-Demand	Mild	ADRB3	38	40
N#CCc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184551	DD	On-Demand	Mild	ADRB2	39	40
N#CCc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184551	DD	On-Demand	Mild	ADRB1	62	40
N#CCc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184551	DD	On-Demand	Mild	ADRB3	38	40
C[C@H](CNCCC(=O)Nc1ccc(Cl)cc1)CNC(=O)OC(C)(C)C	ZINC000819184562	FG	On-Demand	Anodyne	LTA4H	16	41
C[C@@H](CNCCC(=O)Nc1ccc(Cl)cc1)CNC(=O)OC(C)(C)C	ZINC000819184563	FG	On-Demand	Anodyne	LTA4H	16	41
CCN(Cc1ccc(N(C)C)cc1)C(=O)Cc1cccc(NC(C)=O)c1	ZINC000819184595	FG	On-Demand	Clean	KCNK3	16	42
C[C@H](CNC[C@H](O)CN1CCc2ccccc2C1)CNC(=O)OC(C)(C)C	ZINC000819184600	GE	On-Demand	Anodyne	NOD2	41	35
C[C@@H](CNC[C@H](O)CN1CCc2ccccc2C1)CNC(=O)OC(C)(C)C	ZINC000819184601	GE	On-Demand	Anodyne	NOD2	41	35
C[C@@H](CNC[C@@H](O)CN1CCc2ccccc2C1)CNC(=O)OC(C)(C)C	ZINC000819184602	GE	On-Demand	Anodyne	NOD2	41	35
C[C@H](CNC[C@@H](O)CN1CCc2ccccc2C1)CNC(=O)OC(C)(C)C	ZINC000819184603	GE	On-Demand	Anodyne	NOD2	41	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)CCc1ccc(OC)cc1)C2	ZINC000819184604	FF	On-Demand	Anodyne	BIRC2	23	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)CCc1ccc(OC)cc1)C2	ZINC000819184605	FF	On-Demand	Anodyne	BIRC2	23	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)CCc1ccc(OC)cc1)C2	ZINC000819184606	FF	On-Demand	Anodyne	BIRC2	23	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)CCc1ccc(OC)cc1)C2	ZINC000819184607	FF	On-Demand	Anodyne	BIRC2	23	41
O=C(NCc1ccc(-n2ccnc2)cc1)C(F)=C1CCC1	ZINC000819184614	CF	On-Demand	Anodyne	NOS2	89	37
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)CNC(=O)OC(C)(C)C	ZINC000819184615	FE	On-Demand	Bother	CACNA1D	52	34
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)CNC(=O)OC(C)(C)C	ZINC000819184616	FE	On-Demand	Bother	CACNA1D	52	34
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)CNC(=O)OC(C)(C)C	ZINC000819184617	FE	On-Demand	Bother	CACNA1D	52	34
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)CNC(=O)OC(C)(C)C	ZINC000819184618	FE	On-Demand	Bother	CACNA1D	52	34
COCCCOc1cccc(CNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819184668	EF	On-Demand	Mild	ADRB2	17	46
COCCCOc1cccc(CNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819184669	EF	On-Demand	Mild	ADRB2	17	46
O=C(Nc1ccc(-c2nnc3n2CCCCCC3)cc1)c1cn(Cc2ccccc2)nn1	ZINC000819184685	IH	On-Demand	Anodyne	CDC7	17	41
O=C(Nc1ccc(-c2nnc3n2CCCCCC3)cc1)c1cn(Cc2ccccc2)nn1	ZINC000819184685	IH	On-Demand	Anodyne	NOD2	42	36
C=C(Cl)CSc1nc(C)c(CC(=O)NCc2cccc([N+](=O)[O-])c2)s1	ZINC000819184686	GI	On-Demand	Mild	CACNA1C	44	34
C=C(Cl)CSc1nc(C)c(CC(=O)NCc2cccc([N+](=O)[O-])c2)s1	ZINC000819184686	GI	On-Demand	Mild	CACNA1D	67	33
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2(C3CC3)CCC2)CC1	ZINC000819184687	FG	On-Demand	Anodyne	GPR119	26	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2(C3CC3)CCC2)CC1	ZINC000819184689	FG	On-Demand	Anodyne	GPR119	26	42
O=C(/C=C\[C@@H]1CCCO1)NCc1ccnc(-n2ccnc2)c1	ZINC000819184690	CD	On-Demand	Anodyne	NOS2	102	39
O=C(/C=C/[C@H]1CCCO1)NCc1ccnc(-n2ccnc2)c1	ZINC000819184692	CD	On-Demand	Anodyne	NOS2	102	39
O=C(/C=C\[C@H]1CCCO1)NCc1ccnc(-n2ccnc2)c1	ZINC000819184694	CD	On-Demand	Anodyne	NOS2	102	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(CC(F)(F)F)CC1	ZINC000819184695	FE	On-Demand	Anodyne	HPGDS	36	41
O=C(/C=C/[C@@H]1CCCO1)NCc1ccnc(-n2ccnc2)c1	ZINC000819184696	CD	On-Demand	Anodyne	NOS2	102	39
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	ZINC000819184703	FG	On-Demand	Reactive	CCR2	96	42
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	ZINC000819184703	FG	On-Demand	Reactive	PDS	40	37
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	ZINC000819184707	FG	On-Demand	Reactive	CCR2	96	42
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1	ZINC000819184707	FG	On-Demand	Reactive	PDS	40	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ncc(-c2ccccc2)[nH]1	ZINC000819184710	FF	On-Demand	Anodyne	REN	51	34
CCOc1cc(Cl)ccc1CNC[C@H](O)c1ccccc1	ZINC000819184789	DH	On-Demand	Anodyne	ADRB1	33	41
CCOc1cc(Cl)ccc1CNC[C@H](O)c1ccccc1	ZINC000819184789	DH	On-Demand	Anodyne	ADRB3	58	43
CCOc1cc(Cl)ccc1CNC[C@@H](O)c1ccccc1	ZINC000819184790	DH	On-Demand	Anodyne	ADRB1	33	41
CCOc1cc(Cl)ccc1CNC[C@@H](O)c1ccccc1	ZINC000819184790	DH	On-Demand	Anodyne	ADRB3	58	43
C[C@@H]1CCCC[C@@H]1C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000819184805	CF	On-Demand	Anodyne	NOS2	107	42
C[C@@H]1CCCC[C@H]1C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000819184806	CF	On-Demand	Anodyne	NOS2	107	42
C=C(Cl)CSc1nc(C)c(CC(=O)N(CC)Cc2cnn(C)c2)s1	ZINC000819184824	GH	On-Demand	Mild	PLA2G7	47	38
CN(C)CC1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819184825	DG	On-Demand	Anodyne	ADRB1	34	43
CN(C)CC1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819184825	DG	On-Demand	Anodyne	ADRB3	51	51
CN(C)CC1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819184825	DG	On-Demand	Anodyne	CYP3A4	41	36
CN(C)CC1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819184826	DG	On-Demand	Anodyne	ADRB1	34	43
CN(C)CC1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819184826	DG	On-Demand	Anodyne	ADRB3	51	51
CN(C)CC1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819184826	DG	On-Demand	Anodyne	CYP3A4	41	36
CN(C)CC1CCC(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819184835	GF	On-Demand	Anodyne	GPR119	29	41
CN(C)CC1CCC(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819184836	GF	On-Demand	Anodyne	GPR119	29	41
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184858	EE	On-Demand	Anodyne	ADRB2	49	45
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184858	EE	On-Demand	Anodyne	ADRB1	81	46
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184858	EE	On-Demand	Anodyne	GRIN1	25	43
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184858	EE	On-Demand	Anodyne	ADRB3	54	45
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184858	EE	On-Demand	Anodyne	ABCB1	26	43
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184859	EE	On-Demand	Anodyne	ADRB2	49	45
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184859	EE	On-Demand	Anodyne	ADRB1	81	46
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184859	EE	On-Demand	Anodyne	GRIN1	25	43
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184859	EE	On-Demand	Anodyne	ADRB3	54	45
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819184859	EE	On-Demand	Anodyne	ABCB1	26	43
C[C@@H](CNC[C@@H](O)c1cccnc1)CNC(=O)OC(C)(C)C	ZINC000819184861	DD	On-Demand	Anodyne	ADRB2	24	43
C[C@@H](CNC[C@@H](O)c1cccnc1)CNC(=O)OC(C)(C)C	ZINC000819184861	DD	On-Demand	Anodyne	ADRB1	37	46
C[C@@H](CNC[C@@H](O)c1cccnc1)CNC(=O)OC(C)(C)C	ZINC000819184861	DD	On-Demand	Anodyne	ADRB3	109	46
C[C@@H](CNC[C@H](O)c1cccnc1)CNC(=O)OC(C)(C)C	ZINC000819184862	DD	On-Demand	Anodyne	ADRB2	24	43
C[C@@H](CNC[C@H](O)c1cccnc1)CNC(=O)OC(C)(C)C	ZINC000819184862	DD	On-Demand	Anodyne	ADRB1	37	46
C[C@@H](CNC[C@H](O)c1cccnc1)CNC(=O)OC(C)(C)C	ZINC000819184862	DD	On-Demand	Anodyne	ADRB3	109	46
C[C@H](CNC[C@H](O)c1cccnc1)CNC(=O)OC(C)(C)C	ZINC000819184863	DD	On-Demand	Anodyne	ADRB2	24	43
C[C@H](CNC[C@H](O)c1cccnc1)CNC(=O)OC(C)(C)C	ZINC000819184863	DD	On-Demand	Anodyne	ADRB1	37	46
C[C@H](CNC[C@H](O)c1cccnc1)CNC(=O)OC(C)(C)C	ZINC000819184863	DD	On-Demand	Anodyne	ADRB3	109	46
C[C@H](CNC[C@@H](O)c1cccnc1)CNC(=O)OC(C)(C)C	ZINC000819184864	DD	On-Demand	Anodyne	ADRB2	24	43
C[C@H](CNC[C@@H](O)c1cccnc1)CNC(=O)OC(C)(C)C	ZINC000819184864	DD	On-Demand	Anodyne	ADRB1	37	46
C[C@H](CNC[C@@H](O)c1cccnc1)CNC(=O)OC(C)(C)C	ZINC000819184864	DD	On-Demand	Anodyne	ADRB3	109	46
C[C@H](CNC[C@H](O)c1cccc2ccccc12)CNC(=O)OC(C)(C)C	ZINC000819184875	FH	On-Demand	Anodyne	FPR1	42	35
C[C@@H](CNC[C@H](O)c1cccc2ccccc12)CNC(=O)OC(C)(C)C	ZINC000819184876	FH	On-Demand	Anodyne	FPR1	42	35
C=CCC1(C(=O)NCc2ccc(-n3ccnc3)cc2)CCOCC1	ZINC000819184878	EF	On-Demand	Mild	NOS2	56	33
C=CCC1(C(=O)NCc2ccc(-n3ccnc3)cc2)CCOCC1	ZINC000819184878	EF	On-Demand	Mild	CYP2C19	17	40
O=C(NCc1ccc(-n2ccnc2)cc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819184881	GI	On-Demand	Anodyne	NOS2	79	36
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)Cc1nc(-c2ccccc2)oc1C	ZINC000819184882	HI	On-Demand	Anodyne	PPARG	82	46
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)Cc1nc(-c2ccccc2)oc1C	ZINC000819184882	HI	On-Demand	Anodyne	PPARA	87	46
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)Cc1nc(-c2ccccc2)oc1C	ZINC000819184882	HI	On-Demand	Anodyne	PDE8B	64	38
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)Cc1nc(-c2ccccc2)oc1C	ZINC000819184883	HI	On-Demand	Anodyne	PPARG	82	46
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)Cc1nc(-c2ccccc2)oc1C	ZINC000819184883	HI	On-Demand	Anodyne	PPARA	87	46
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)Cc1nc(-c2ccccc2)oc1C	ZINC000819184883	HI	On-Demand	Anodyne	PDE8B	64	38
CON(C)C(=O)CCN[C@@H](Cn1ccnc1)c1ccc(C)cc1C	ZINC000819184888	EE	On-Demand	Anodyne	CYP26A1	74	35
CON(C)C(=O)CCN[C@H](Cn1ccnc1)c1ccc(C)cc1C	ZINC000819184889	EE	On-Demand	Anodyne	CYP26A1	74	35
C[C@H](CNC[C@H](O)c1cccc(C(F)(F)F)c1)CNC(=O)OC(C)(C)C	ZINC000819184915	GG	On-Demand	Anodyne	PDS	41	37
C[C@H](CNC[C@@H](O)c1cccc(C(F)(F)F)c1)CNC(=O)OC(C)(C)C	ZINC000819184916	GG	On-Demand	Anodyne	PDS	41	37
C[C@@H](CNC[C@@H](O)c1cccc(C(F)(F)F)c1)CNC(=O)OC(C)(C)C	ZINC000819184917	GG	On-Demand	Anodyne	PDS	41	37
C[C@@H](CNC[C@H](O)c1cccc(C(F)(F)F)c1)CNC(=O)OC(C)(C)C	ZINC000819184918	GG	On-Demand	Anodyne	PDS	41	37
O[C@H](CNCc1cccc(F)n1)COc1ccc(F)cc1	ZINC000819184919	CD	On-Demand	Anodyne	ADRB2	46	43
O[C@H](CNCc1cccc(F)n1)COc1ccc(F)cc1	ZINC000819184919	CD	On-Demand	Anodyne	ADRB1	70	43
O[C@H](CNCc1cccc(F)n1)COc1ccc(F)cc1	ZINC000819184919	CD	On-Demand	Anodyne	ADRB3	39	43
O[C@@H](CNCc1cccc(F)n1)COc1ccc(F)cc1	ZINC000819184920	CD	On-Demand	Anodyne	ADRB2	46	43
O[C@@H](CNCc1cccc(F)n1)COc1ccc(F)cc1	ZINC000819184920	CD	On-Demand	Anodyne	ADRB1	70	43
O[C@@H](CNCc1cccc(F)n1)COc1ccc(F)cc1	ZINC000819184920	CD	On-Demand	Anodyne	ADRB3	39	43
COCCCOc1cccc(CNC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819184932	EG	On-Demand	Anodyne	ADRB2	15	41
COCCCOc1cccc(CNC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819184933	EG	On-Demand	Anodyne	ADRB2	15	41
O=C(NCc1ccc(N2CCCCC2)cc1)c1cc2c(cn1)OCCO2	ZINC000819184958	FF	On-Demand	Clean	NAMPT	50	38
COC(=O)c1ccc(OC[C@H](O)CNOCC(C)C)cc1	ZINC000819184969	CD	On-Demand	Anodyne	ADRB2	50	54
COC(=O)c1ccc(OC[C@H](O)CNOCC(C)C)cc1	ZINC000819184969	CD	On-Demand	Anodyne	ADRB1	68	47
COC(=O)c1ccc(OC[C@H](O)CNOCC(C)C)cc1	ZINC000819184969	CD	On-Demand	Anodyne	ADRB3	40	46
COC(=O)c1ccc(OC[C@@H](O)CNOCC(C)C)cc1	ZINC000819184970	CD	On-Demand	Anodyne	ADRB2	50	54
COC(=O)c1ccc(OC[C@@H](O)CNOCC(C)C)cc1	ZINC000819184970	CD	On-Demand	Anodyne	ADRB1	68	47
COC(=O)c1ccc(OC[C@@H](O)CNOCC(C)C)cc1	ZINC000819184970	CD	On-Demand	Anodyne	ADRB3	40	46
CC(=O)NC[C@@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819184974	GD	On-Demand	Mild	PAPA1_CARPA	31	40
CC(=O)NC[C@@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819184976	GD	On-Demand	Mild	PAPA1_CARPA	31	40
O=C(/C=C\[C@@H]1CCCO1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819184977	EF	On-Demand	Anodyne	DRD4	26	41
O=C(/C=C\[C@@H]1CCCO1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819184977	EF	On-Demand	Anodyne	SLC6A1	61	35
O=C(/C=C\[C@@H]1CCCO1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819184977	EF	On-Demand	Anodyne	HTR4	36	40
O=C(/C=C\[C@@H]1CCCO1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819184977	EF	On-Demand	Anodyne	SIGMAR1	31	48
O=C(/C=C\[C@@H]1CCCO1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819184977	EF	On-Demand	Anodyne	CCR3	24	49
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819184978	EF	On-Demand	Anodyne	DRD4	26	41
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819184978	EF	On-Demand	Anodyne	SLC6A1	61	35
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819184978	EF	On-Demand	Anodyne	HTR4	36	40
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819184978	EF	On-Demand	Anodyne	SIGMAR1	31	48
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819184978	EF	On-Demand	Anodyne	CCR3	24	49
O=C(/C=C/[C@@H]1CCCO1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819184979	EF	On-Demand	Anodyne	DRD4	26	41
O=C(/C=C/[C@@H]1CCCO1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819184979	EF	On-Demand	Anodyne	SLC6A1	61	35
O=C(/C=C/[C@@H]1CCCO1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819184979	EF	On-Demand	Anodyne	HTR4	36	40
O=C(/C=C/[C@@H]1CCCO1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819184979	EF	On-Demand	Anodyne	SIGMAR1	31	48
O=C(/C=C/[C@@H]1CCCO1)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000819184979	EF	On-Demand	Anodyne	CCR3	24	49
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819184980	EF	On-Demand	Anodyne	DRD4	26	41
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819184980	EF	On-Demand	Anodyne	SLC6A1	61	35
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819184980	EF	On-Demand	Anodyne	HTR4	36	40
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819184980	EF	On-Demand	Anodyne	SIGMAR1	31	48
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000819184980	EF	On-Demand	Anodyne	CCR3	24	49
O=C(/C=C\[C@@H]1CCCO1)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000819184983	EF	On-Demand	Anodyne	DRD2	24	44
O=C(/C=C\[C@@H]1CCCO1)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000819184983	EF	On-Demand	Anodyne	SIGMAR1	17	47
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000819184984	EF	On-Demand	Anodyne	DRD2	24	44
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000819184984	EF	On-Demand	Anodyne	SIGMAR1	17	47
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000819184985	EF	On-Demand	Anodyne	DRD2	24	44
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000819184985	EF	On-Demand	Anodyne	SIGMAR1	17	47
O=C(/C=C/[C@@H]1CCCO1)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000819184986	EF	On-Demand	Anodyne	DRD2	24	44
O=C(/C=C/[C@@H]1CCCO1)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000819184986	EF	On-Demand	Anodyne	SIGMAR1	17	47
O[C@@H](CNCc1ccc(COC2CCOCC2)cc1)c1ccccc1	ZINC000819185002	EG	On-Demand	Anodyne	ADRB3	44	39
O[C@H](CNCc1ccc(COC2CCOCC2)cc1)c1ccccc1	ZINC000819185003	EG	On-Demand	Anodyne	ADRB3	44	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185006	GF	On-Demand	Anodyne	DRD2	15	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185006	GF	On-Demand	Anodyne	DRD4	21	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185006	GF	On-Demand	Anodyne	ACHE	29	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185006	GF	On-Demand	Anodyne	CHRM4	18	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185006	GF	On-Demand	Anodyne	SIGMAR1	32	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185006	GF	On-Demand	Anodyne	CCR3	24	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185006	GF	On-Demand	Anodyne	MBTPS1	41	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185007	GF	On-Demand	Anodyne	DRD2	15	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185007	GF	On-Demand	Anodyne	DRD4	21	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185007	GF	On-Demand	Anodyne	ACHE	29	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185007	GF	On-Demand	Anodyne	CHRM4	18	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185007	GF	On-Demand	Anodyne	SIGMAR1	32	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185007	GF	On-Demand	Anodyne	CCR3	24	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185007	GF	On-Demand	Anodyne	MBTPS1	41	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185008	GF	On-Demand	Anodyne	DRD2	15	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185008	GF	On-Demand	Anodyne	DRD4	21	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185008	GF	On-Demand	Anodyne	ACHE	29	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185008	GF	On-Demand	Anodyne	CHRM4	18	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185008	GF	On-Demand	Anodyne	SIGMAR1	32	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185008	GF	On-Demand	Anodyne	CCR3	24	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185008	GF	On-Demand	Anodyne	MBTPS1	41	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185009	GF	On-Demand	Anodyne	DRD2	15	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185009	GF	On-Demand	Anodyne	DRD4	21	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185009	GF	On-Demand	Anodyne	ACHE	29	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185009	GF	On-Demand	Anodyne	CHRM4	18	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185009	GF	On-Demand	Anodyne	SIGMAR1	32	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185009	GF	On-Demand	Anodyne	CCR3	24	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCCN(Cc3ccccc3)C1)C2	ZINC000819185009	GF	On-Demand	Anodyne	MBTPS1	41	33
C=C(C)C(C)(C)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819185013	EF	On-Demand	Mild	HTR1A	60	51
C=C(C)C(C)(C)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819185013	EF	On-Demand	Mild	DRD2	44	45
C=C(C)C(C)(C)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819185013	EF	On-Demand	Mild	DRD4	61	51
C=C(C)C(C)(C)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819185013	EF	On-Demand	Mild	HTR2A	33	45
C=C(C)C(C)(C)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819185013	EF	On-Demand	Mild	HTR2C	19	40
C=C(C)C(C)(C)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819185013	EF	On-Demand	Mild	DRD3	69	44
C=C(C)C(C)(C)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000819185013	EF	On-Demand	Mild	HTR7	49	45
CS[C@H](C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819185015	CF	On-Demand	Anodyne	ADRB2	22	45
CS[C@H](C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819185015	CF	On-Demand	Anodyne	ADRB1	39	46
CS[C@H](C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819185015	CF	On-Demand	Anodyne	ADRB3	58	46
CS[C@H](C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819185021	CF	On-Demand	Anodyne	ADRB2	22	45
CS[C@H](C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819185021	CF	On-Demand	Anodyne	ADRB1	39	46
CS[C@H](C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819185021	CF	On-Demand	Anodyne	ADRB3	58	46
CC(C)(C)OC(=O)NC[C@@H]1CCCCN1C(=O)Cc1nsc2ccccc12	ZINC000819185047	GH	On-Demand	Anodyne	DRD2	15	41
CC(C)(C)OC(=O)NC[C@@H]1CCCCN1C(=O)Cc1nsc2ccccc12	ZINC000819185047	GH	On-Demand	Anodyne	PREP	20	41
CC(C)(C)OC(=O)NC[C@H]1CCCCN1C(=O)Cc1nsc2ccccc12	ZINC000819185048	GH	On-Demand	Anodyne	DRD2	15	41
CC(C)(C)OC(=O)NC[C@H]1CCCCN1C(=O)Cc1nsc2ccccc12	ZINC000819185048	GH	On-Demand	Anodyne	PREP	20	41
C=CCC1(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCOCC1	ZINC000819185055	GE	On-Demand	Mild	HTR1A	35	46
C=CCC1(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCOCC1	ZINC000819185055	GE	On-Demand	Mild	DRD2	28	41
C=CCC1(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCOCC1	ZINC000819185055	GE	On-Demand	Mild	DRD4	56	46
C=CCC1(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCOCC1	ZINC000819185055	GE	On-Demand	Mild	HTR2A	16	41
C=CCC1(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCOCC1	ZINC000819185055	GE	On-Demand	Mild	DRD3	47	42
C=CCC1(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCOCC1	ZINC000819185055	GE	On-Demand	Mild	HTR7	28	41
C=CCC1(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCOCC1	ZINC000819185055	GE	On-Demand	Mild	MMP13	20	42
C=CCCn1cc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819185067	GD	On-Demand	Mild	HTR1A	40	49
C=CCCn1cc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819185067	GD	On-Demand	Mild	DRD2	38	51
C=CCCn1cc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819185067	GD	On-Demand	Mild	DRD4	59	49
C=CCCn1cc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819185067	GD	On-Demand	Mild	HTR2A	27	48
C=CCCn1cc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819185067	GD	On-Demand	Mild	HTR2C	22	45
C=CCCn1cc(C(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819185067	GD	On-Demand	Mild	DRD3	70	51
CC(C)(C)OC(=O)NC[C@@H]1CCCCN1C(=O)c1coc(=O)c2ccccc12	ZINC000819185100	GG	On-Demand	Anodyne	INHA	64	35
CC(C)(C)OC(=O)NC[C@@H]1CCCCN1C(=O)c1coc(=O)c2ccccc12	ZINC000819185100	GG	On-Demand	Anodyne	HCRTR1	30	45
CC(C)(C)OC(=O)NC[C@@H]1CCCCN1C(=O)c1coc(=O)c2ccccc12	ZINC000819185100	GG	On-Demand	Anodyne	ACACB	15	40
CC(C)(C)OC(=O)NC[C@H]1CCCCN1C(=O)c1coc(=O)c2ccccc12	ZINC000819185103	GG	On-Demand	Anodyne	INHA	64	35
CC(C)(C)OC(=O)NC[C@H]1CCCCN1C(=O)c1coc(=O)c2ccccc12	ZINC000819185103	GG	On-Demand	Anodyne	HCRTR1	30	45
CC(C)(C)OC(=O)NC[C@H]1CCCCN1C(=O)c1coc(=O)c2ccccc12	ZINC000819185103	GG	On-Demand	Anodyne	ACACB	15	40
C[C@H](CNC[C@H](O)c1cccc(Br)c1)CNC(=O)OC(C)(C)C	ZINC000819185127	GG	On-Demand	Anodyne	ADRB3	49	39
C[C@H](CNC[C@H](O)c1cccc(Br)c1)CNC(=O)OC(C)(C)C	ZINC000819185127	GG	On-Demand	Anodyne	PAPA1_CARPA	23	42
C[C@H](CNC[C@@H](O)c1cccc(Br)c1)CNC(=O)OC(C)(C)C	ZINC000819185128	GG	On-Demand	Anodyne	ADRB3	49	39
C[C@H](CNC[C@@H](O)c1cccc(Br)c1)CNC(=O)OC(C)(C)C	ZINC000819185128	GG	On-Demand	Anodyne	PAPA1_CARPA	23	42
C[C@@H](CNC[C@@H](O)c1cccc(Br)c1)CNC(=O)OC(C)(C)C	ZINC000819185129	GG	On-Demand	Anodyne	ADRB3	49	39
C[C@@H](CNC[C@@H](O)c1cccc(Br)c1)CNC(=O)OC(C)(C)C	ZINC000819185129	GG	On-Demand	Anodyne	PAPA1_CARPA	23	42
C[C@@H](CNC[C@H](O)c1cccc(Br)c1)CNC(=O)OC(C)(C)C	ZINC000819185130	GG	On-Demand	Anodyne	ADRB3	49	39
C[C@@H](CNC[C@H](O)c1cccc(Br)c1)CNC(=O)OC(C)(C)C	ZINC000819185130	GG	On-Demand	Anodyne	PAPA1_CARPA	23	42
O[C@H](CNCc1cccc(F)n1)COc1cccc(C(F)(F)F)c1	ZINC000819185141	EF	On-Demand	Anodyne	PDS	51	44
O[C@@H](CNCc1cccc(F)n1)COc1cccc(C(F)(F)F)c1	ZINC000819185143	EF	On-Demand	Anodyne	PDS	51	44
C[C@@H](CNC[C@@H](O)C1CCCCC1)CNC(=O)OC(C)(C)C	ZINC000819185145	DF	On-Demand	Anodyne	REN	29	43
C[C@H](CNC[C@H](O)C1CCCCC1)CNC(=O)OC(C)(C)C	ZINC000819185149	DF	On-Demand	Anodyne	REN	29	43
C[C@H](CNC[C@@H](O)C1CCCCC1)CNC(=O)OC(C)(C)C	ZINC000819185151	DF	On-Demand	Anodyne	REN	29	43
C[C@@H](CNC[C@H](O)C1CCCCC1)CNC(=O)OC(C)(C)C	ZINC000819185153	DF	On-Demand	Anodyne	REN	29	43
C[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185155	FF	On-Demand	Anodyne	PAPA1_CARPA	30	42
C[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185155	FF	On-Demand	Anodyne	CTSL	18	42
C[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185155	FF	On-Demand	Anodyne	REN	30	40
C[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185155	FF	On-Demand	Anodyne	FPR1	45	41
C[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185155	FF	On-Demand	Anodyne	PDS	65	38
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1ccc(Cl)s1	ZINC000819185156	FE	On-Demand	Anodyne	ADRB3	51	37
C[C@H](CNC[C@@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185157	FF	On-Demand	Anodyne	PAPA1_CARPA	30	42
C[C@H](CNC[C@@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185157	FF	On-Demand	Anodyne	CTSL	18	42
C[C@H](CNC[C@@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185157	FF	On-Demand	Anodyne	REN	30	40
C[C@H](CNC[C@@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185157	FF	On-Demand	Anodyne	FPR1	45	41
C[C@H](CNC[C@@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185157	FF	On-Demand	Anodyne	PDS	65	38
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1ccc(Cl)s1	ZINC000819185158	FE	On-Demand	Anodyne	ADRB3	51	37
C[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185159	FF	On-Demand	Anodyne	PAPA1_CARPA	30	42
C[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185159	FF	On-Demand	Anodyne	CTSL	18	42
C[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185159	FF	On-Demand	Anodyne	REN	30	40
C[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185159	FF	On-Demand	Anodyne	FPR1	45	41
C[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185159	FF	On-Demand	Anodyne	PDS	65	38
C[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185161	FF	On-Demand	Anodyne	PAPA1_CARPA	30	42
C[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185161	FF	On-Demand	Anodyne	CTSL	18	42
C[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185161	FF	On-Demand	Anodyne	REN	30	40
C[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185161	FF	On-Demand	Anodyne	FPR1	45	41
C[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)CNC(=O)OC(C)(C)C	ZINC000819185161	FF	On-Demand	Anodyne	PDS	65	38
CC(C)(C)OC(=O)NC[C@H]1CCCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819185197	GF	On-Demand	Anodyne	HTR1D	15	41
CC(C)(C)OC(=O)NC[C@H]1CCCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819185197	GF	On-Demand	Anodyne	OPRK1	15	44
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(-n2ccnc2)cc1	ZINC000819185198	CE	On-Demand	Anodyne	NOS2	81	36
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(-n2ccnc2)cc1	ZINC000819185199	CE	On-Demand	Anodyne	NOS2	81	36
CC(C)(C)OC(=O)NC[C@@H]1CCCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819185200	GF	On-Demand	Anodyne	HTR1D	15	41
CC(C)(C)OC(=O)NC[C@@H]1CCCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819185200	GF	On-Demand	Anodyne	OPRK1	15	44
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(-n2ccnc2)cc1	ZINC000819185201	CE	On-Demand	Anodyne	NOS2	81	36
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(-n2ccnc2)cc1	ZINC000819185202	CE	On-Demand	Anodyne	NOS2	81	36
O[C@H](CNCc1cccc(F)n1)COc1ccccc1	ZINC000819185209	CD	On-Demand	Anodyne	ADRB2	52	53
O[C@H](CNCc1cccc(F)n1)COc1ccccc1	ZINC000819185209	CD	On-Demand	Anodyne	ADRB1	73	48
O[C@H](CNCc1cccc(F)n1)COc1ccccc1	ZINC000819185209	CD	On-Demand	Anodyne	ADRB3	46	48
O[C@@H](CNCc1cccc(F)n1)COc1ccccc1	ZINC000819185210	CD	On-Demand	Anodyne	ADRB2	52	53
O[C@@H](CNCc1cccc(F)n1)COc1ccccc1	ZINC000819185210	CD	On-Demand	Anodyne	ADRB1	73	48
O[C@@H](CNCc1cccc(F)n1)COc1ccccc1	ZINC000819185210	CD	On-Demand	Anodyne	ADRB3	46	48
O[C@@H](CNCC1(C2CC2)CCC1)c1cccnc1	ZINC000819185233	BE	On-Demand	Anodyne	ADRB2	21	41
O[C@@H](CNCC1(C2CC2)CCC1)c1cccnc1	ZINC000819185233	BE	On-Demand	Anodyne	ADRB1	23	43
O[C@@H](CNCC1(C2CC2)CCC1)c1cccnc1	ZINC000819185233	BE	On-Demand	Anodyne	ADRB3	91	44
O[C@H](CNCC1(C2CC2)CCC1)c1cccnc1	ZINC000819185234	BE	On-Demand	Anodyne	ADRB2	21	41
O[C@H](CNCC1(C2CC2)CCC1)c1cccnc1	ZINC000819185234	BE	On-Demand	Anodyne	ADRB1	23	43
O[C@H](CNCC1(C2CC2)CCC1)c1cccnc1	ZINC000819185234	BE	On-Demand	Anodyne	ADRB3	91	44
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)C(F)=C1CCC1	ZINC000819185235	EF	On-Demand	Reactive	CCR2	41	36
O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)C(F)=C1CCC1	ZINC000819185235	EF	On-Demand	Reactive	PDS	42	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(OCCc2ccccc2)CC1	ZINC000819185242	GG	On-Demand	Anodyne	CCKAR	18	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(OCCc2ccccc2)CC1	ZINC000819185242	GG	On-Demand	Anodyne	FPR1	44	36
CCOc1ccc(OC[C@H](O)CNOCC(C)C)cc1	ZINC000819185250	CE	On-Demand	Anodyne	ADRB2	43	51
CCOc1ccc(OC[C@H](O)CNOCC(C)C)cc1	ZINC000819185250	CE	On-Demand	Anodyne	ADRB1	51	51
CCOc1ccc(OC[C@H](O)CNOCC(C)C)cc1	ZINC000819185250	CE	On-Demand	Anodyne	ADRB3	24	45
CCOc1ccc(OC[C@@H](O)CNOCC(C)C)cc1	ZINC000819185251	CE	On-Demand	Anodyne	ADRB2	43	51
CCOc1ccc(OC[C@@H](O)CNOCC(C)C)cc1	ZINC000819185251	CE	On-Demand	Anodyne	ADRB1	51	51
CCOc1ccc(OC[C@@H](O)CNOCC(C)C)cc1	ZINC000819185251	CE	On-Demand	Anodyne	ADRB3	24	45
CC(=O)c1ccc(OC[C@@H](O)CNOCC(C)C)cc1	ZINC000819185280	CD	On-Demand	Anodyne	ADRB2	40	51
CC(=O)c1ccc(OC[C@@H](O)CNOCC(C)C)cc1	ZINC000819185280	CD	On-Demand	Anodyne	ADRB1	57	50
CC(=O)c1ccc(OC[C@@H](O)CNOCC(C)C)cc1	ZINC000819185280	CD	On-Demand	Anodyne	ADRB3	28	41
CC(=O)c1ccc(OC[C@@H](O)CNOCC(C)C)cc1	ZINC000819185280	CD	On-Demand	Anodyne	ABCB1	16	55
CC(=O)c1ccc(OC[C@H](O)CNOCC(C)C)cc1	ZINC000819185281	CD	On-Demand	Anodyne	ADRB2	40	51
CC(=O)c1ccc(OC[C@H](O)CNOCC(C)C)cc1	ZINC000819185281	CD	On-Demand	Anodyne	ADRB1	57	50
CC(=O)c1ccc(OC[C@H](O)CNOCC(C)C)cc1	ZINC000819185281	CD	On-Demand	Anodyne	ADRB3	28	41
CC(=O)c1ccc(OC[C@H](O)CNOCC(C)C)cc1	ZINC000819185281	CD	On-Demand	Anodyne	ABCB1	16	55
O[C@@H](CNCc1ccc(COC2CCOCC2)cc1)c1cccnc1	ZINC000819185300	EF	On-Demand	Anodyne	ADRB1	26	43
O[C@@H](CNCc1ccc(COC2CCOCC2)cc1)c1cccnc1	ZINC000819185300	EF	On-Demand	Anodyne	ADRB3	93	43
O[C@H](CNCc1ccc(COC2CCOCC2)cc1)c1cccnc1	ZINC000819185301	EF	On-Demand	Anodyne	ADRB1	26	43
O[C@H](CNCc1ccc(COC2CCOCC2)cc1)c1cccnc1	ZINC000819185301	EF	On-Demand	Anodyne	ADRB3	93	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ncccc1F	ZINC000819185304	GF	On-Demand	Anodyne	CTSD	90	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ncccc1F	ZINC000819185304	GF	On-Demand	Anodyne	PGC	55	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ncccc1F	ZINC000819185304	GF	On-Demand	Anodyne	PAPA1_CARPA	30	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ncccc1F	ZINC000819185304	GF	On-Demand	Anodyne	BACE2	38	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ncccc1F	ZINC000819185304	GF	On-Demand	Anodyne	REN	76	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ncccc1F	ZINC000819185304	GF	On-Demand	Anodyne	REN1	23	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ncccc1F	ZINC000819185304	GF	On-Demand	Anodyne	BACE1	93	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ncccc1F	ZINC000819185304	GF	On-Demand	Anodyne	SCN10A	21	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ncccc1F	ZINC000819185304	GF	On-Demand	Anodyne	FPR1	47	39
COc1cccc([S@@](=O)CC(=O)NCc2ccc(N3CCCCC3)cc2)c1	ZINC000819185328	GG	On-Demand	Clean	DRD4	50	41
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ncccc2F)cc1	ZINC000819185332	DD	On-Demand	Anodyne	ADRB3	64	38
CS(=O)(=O)c1ccc([C@H](O)CNCc2ncccc2F)cc1	ZINC000819185334	DD	On-Demand	Anodyne	ADRB3	64	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(-n3ccnc3)cc1)C2	ZINC000819185343	FE	On-Demand	Anodyne	NOS2	90	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(-n3ccnc3)cc1)C2	ZINC000819185343	FE	On-Demand	Anodyne	VHL	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(-n3ccnc3)cc1)C2	ZINC000819185345	FE	On-Demand	Anodyne	NOS2	90	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(-n3ccnc3)cc1)C2	ZINC000819185345	FE	On-Demand	Anodyne	VHL	40	31
C[C@@H]1CCCC[C@@H]1C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000819185362	CG	On-Demand	Anodyne	NOS2	90	42
C[C@@H]1CCCC[C@H]1C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000819185364	CG	On-Demand	Anodyne	NOS2	90	42
COc1cccc([S@@](=O)CC(=O)N[C@H](C)COc2ccc(C)cc2)c1	ZINC000819185365	FF	On-Demand	Anodyne	MTNR1A	31	53
COc1cccc([S@@](=O)CC(=O)N[C@H](C)COc2ccc(C)cc2)c1	ZINC000819185365	FF	On-Demand	Anodyne	MTNR1B	31	53
COc1cccc([S@@](=O)CC(=O)N[C@@H](C)COc2ccc(C)cc2)c1	ZINC000819185367	FF	On-Demand	Anodyne	MTNR1A	31	53
COc1cccc([S@@](=O)CC(=O)N[C@@H](C)COc2ccc(C)cc2)c1	ZINC000819185367	FF	On-Demand	Anodyne	MTNR1B	31	53
C[C@@H](CNC[C@H](O)CC1CCCC1)CNC(=O)OC(C)(C)C	ZINC000819185380	DF	On-Demand	Anodyne	CTSD	15	40
C[C@@H](CNC[C@H](O)CC1CCCC1)CNC(=O)OC(C)(C)C	ZINC000819185380	DF	On-Demand	Anodyne	ECE1	22	40
C[C@@H](CNC[C@H](O)CC1CCCC1)CNC(=O)OC(C)(C)C	ZINC000819185380	DF	On-Demand	Anodyne	REN	48	44
C[C@H](CNC[C@@H](O)CC1CCCC1)CNC(=O)OC(C)(C)C	ZINC000819185381	DF	On-Demand	Anodyne	CTSD	15	40
C[C@H](CNC[C@@H](O)CC1CCCC1)CNC(=O)OC(C)(C)C	ZINC000819185381	DF	On-Demand	Anodyne	ECE1	22	40
C[C@H](CNC[C@@H](O)CC1CCCC1)CNC(=O)OC(C)(C)C	ZINC000819185381	DF	On-Demand	Anodyne	REN	48	44
C[C@H](CNC[C@H](O)CC1CCCC1)CNC(=O)OC(C)(C)C	ZINC000819185382	DF	On-Demand	Anodyne	CTSD	15	40
C[C@H](CNC[C@H](O)CC1CCCC1)CNC(=O)OC(C)(C)C	ZINC000819185382	DF	On-Demand	Anodyne	ECE1	22	40
C[C@H](CNC[C@H](O)CC1CCCC1)CNC(=O)OC(C)(C)C	ZINC000819185382	DF	On-Demand	Anodyne	REN	48	44
C[C@@H](CNC[C@@H](O)CC1CCCC1)CNC(=O)OC(C)(C)C	ZINC000819185383	DF	On-Demand	Anodyne	CTSD	15	40
C[C@@H](CNC[C@@H](O)CC1CCCC1)CNC(=O)OC(C)(C)C	ZINC000819185383	DF	On-Demand	Anodyne	ECE1	22	40
C[C@@H](CNC[C@@H](O)CC1CCCC1)CNC(=O)OC(C)(C)C	ZINC000819185383	DF	On-Demand	Anodyne	REN	48	44
CN(C)CC1CCC(NC[C@H](O)c2cccc(Br)c2)CC1	ZINC000819185404	FG	On-Demand	Anodyne	ADRB3	18	40
CN(C)CC1CCC(NC[C@@H](O)c2cccc(Br)c2)CC1	ZINC000819185405	FG	On-Demand	Anodyne	ADRB3	18	40
O[C@H](CNCc1cccc(F)n1)COc1ccccc1Cl	ZINC000819185420	DE	On-Demand	Anodyne	ADRB2	24	48
O[C@H](CNCc1cccc(F)n1)COc1ccccc1Cl	ZINC000819185420	DE	On-Demand	Anodyne	ADRB1	57	37
O[C@@H](CNCc1cccc(F)n1)COc1ccccc1Cl	ZINC000819185421	DE	On-Demand	Anodyne	ADRB2	24	48
O[C@@H](CNCc1cccc(F)n1)COc1ccccc1Cl	ZINC000819185421	DE	On-Demand	Anodyne	ADRB1	57	37
C=CCC1(C(=O)NCc2ccnc(-n3ccnc3)c2)CCOCC1	ZINC000819185432	EE	On-Demand	Mild	NOS2	100	38
O=S(=O)(NCCNC[C@@H](O)c1cccc(F)c1)c1ccc(Cl)s1	ZINC000819185433	GE	On-Demand	Anodyne	CCR4	51	33
O=S(=O)(NCCNC[C@H](O)c1cccc(F)c1)c1ccc(Cl)s1	ZINC000819185434	GE	On-Demand	Anodyne	CCR4	51	33
O=C(Nc1ccc(Cl)cc1)N1CCCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819185441	FH	On-Demand	Anodyne	FAAH	15	46
O=C(Nc1ccc(Cl)cc1)N1CCCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819185441	FH	On-Demand	Anodyne	EPHX2	21	45
O=C(NCc1ccnc(-n2ccnc2)c1)C(F)=C1CCC1	ZINC000819185443	CE	On-Demand	Anodyne	NOS2	103	39
CC(=O)Nc1cccc(CC(=O)N2CCCC[C@@H]2CNC(=O)OC(C)(C)C)c1	ZINC000819185444	GG	On-Demand	Anodyne	OPRK1	21	46
CC(=O)Nc1cccc(CC(=O)N2CCCC[C@@H]2CNC(=O)OC(C)(C)C)c1	ZINC000819185444	GG	On-Demand	Anodyne	CMA1	28	40
CC(=O)Nc1cccc(CC(=O)N2CCCC[C@@H]2CNC(=O)OC(C)(C)C)c1	ZINC000819185444	GG	On-Demand	Anodyne	CPT1A	18	43
CC(=O)Nc1cccc(CC(=O)N2CCCC[C@H]2CNC(=O)OC(C)(C)C)c1	ZINC000819185445	GG	On-Demand	Anodyne	OPRK1	21	46
CC(=O)Nc1cccc(CC(=O)N2CCCC[C@H]2CNC(=O)OC(C)(C)C)c1	ZINC000819185445	GG	On-Demand	Anodyne	CMA1	28	40
CC(=O)Nc1cccc(CC(=O)N2CCCC[C@H]2CNC(=O)OC(C)(C)C)c1	ZINC000819185445	GG	On-Demand	Anodyne	CPT1A	18	43
O=C(/C=C\[C@H]1CCCO1)NCCC(=O)NCc1cccnc1	ZINC000819185467	DC	On-Demand	Anodyne	NAMPT	48	37
O=C(/C=C/[C@@H]1CCCO1)NCCC(=O)NCc1cccnc1	ZINC000819185468	DC	On-Demand	Anodyne	NAMPT	48	37
O=C(/C=C\[C@@H]1CCCO1)NCCC(=O)NCc1cccnc1	ZINC000819185469	DC	On-Demand	Anodyne	NAMPT	48	37
O=C(/C=C/[C@H]1CCCO1)NCCC(=O)NCc1cccnc1	ZINC000819185470	DC	On-Demand	Anodyne	NAMPT	48	37
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(C(=O)Nc2ccc(Cl)cc2)CC1	ZINC000819185471	GG	On-Demand	Anodyne	EPHX2	23	44
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(C(=O)Nc2ccc(Cl)cc2)CC1	ZINC000819185472	GG	On-Demand	Anodyne	EPHX2	23	44
O=C(/C=C/[C@H]1CCCO1)N1CCCN(C(=O)Nc2ccc(Cl)cc2)CC1	ZINC000819185473	GG	On-Demand	Anodyne	EPHX2	23	44
O=C(/C=C\[C@H]1CCCO1)N1CCCN(C(=O)Nc2ccc(Cl)cc2)CC1	ZINC000819185474	GG	On-Demand	Anodyne	EPHX2	23	44
O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)NCc1ncn(-c2ccccc2)n1	ZINC000819185478	IF	On-Demand	Anodyne	IMDH_CRYPV	15	41
COc1cccc(C(C)(C)CNC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819185499	FG	On-Demand	Anodyne	MTNR1A	19	44
COc1cccc(C(C)(C)CNC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819185500	FG	On-Demand	Anodyne	MTNR1A	19	44
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1	ZINC000819185531	JK	On-Demand	Anodyne	LIPG	44	33
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CC(c2cccc(F)c2)=NO1	ZINC000819185565	FE	On-Demand	Anodyne	LUCI_PHOPY	27	44
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CC(c2cccc(F)c2)=NO1	ZINC000819185566	FE	On-Demand	Anodyne	LUCI_PHOPY	27	44
O=C(CCCn1cncn1)NCc1ncn(-c2ccccc2)n1	ZINC000819185571	DC	On-Demand	Anodyne	HIS3	47	35
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000819185572	IF	On-Demand	Anodyne	NAMPT	55	43
CC(C)(C)OC(=O)N1CCC(OCC(=O)NCc2ncn(-c3ccccc3)n2)CC1	ZINC000819185573	HE	On-Demand	Anodyne	GPR119	51	43
CS(=O)(=O)Nc1ccc(/C=C/C(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819185590	GD	On-Demand	Anodyne	HDAC1	29	46
CS(=O)(=O)Nc1ccc(/C=C\C(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819185591	GD	On-Demand	Anodyne	HDAC1	29	46
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(=O)c2ccccc2o1	ZINC000819185596	EE	On-Demand	Anodyne	BCHE	33	44
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(=O)c2ccccc2o1	ZINC000819185596	EE	On-Demand	Anodyne	CARM1	46	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	BMP1	25	56
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	KLK3	77	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	CTSB	73	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	PAPA1_CARPA	84	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	CYSP_TRYCR	54	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	CTSK	40	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	CTSL	52	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	PGA	22	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	CAPNS1	71	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	REN	18	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	CTSS	17	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	CAPN1	91	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	CASP1	25	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	CAPN2	143	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	CASP6	15	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	CASP9	33	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	TPSAB1	29	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	NPR	73	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	CASP10	35	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	PSMB5	51	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	CARM1	40	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	Q6PRC7_IXORI	25	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185597	HG	On-Demand	Anodyne	PDS	42	33
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185602	GD	On-Demand	Anodyne	VHL	69	39
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(-n2ccc(C(F)(F)F)n2)cc1	ZINC000819185605	HG	On-Demand	Anodyne	CARM1	55	38
C=CC(=O)NCc1ccc(C(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819185608	FD	On-Demand	Anodyne	TGM2	26	44
C[C@@H](Cc1ccc(F)cc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185616	EF	On-Demand	Anodyne	MME	75	38
C[C@@H](Cc1ccc(F)cc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185616	EF	On-Demand	Anodyne	ACE2	58	37
C[C@@H](Cc1ccc(F)cc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185616	EF	On-Demand	Anodyne	AMP1_PLAFQ	47	44
C[C@@H](Cc1ccc(F)cc1)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185616	EF	On-Demand	Anodyne	CARM1	54	36
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(Cl)ncc1Cl	ZINC000819185622	EF	On-Demand	Anodyne	P2RX7	20	40
CCCCCCCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185626	DH	On-Demand	Mild	CNR1	23	50
CCCCCCCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185626	DH	On-Demand	Mild	CNR2	24	44
CCCCCCCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185626	DH	On-Demand	Mild	HDAC10	16	42
CCCCCCCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185626	DH	On-Demand	Mild	PLA2G4B	43	30
CCCCCCCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185626	DH	On-Demand	Mild	SOAT1	26	42
CCCCCCCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185626	DH	On-Demand	Mild	HDAC1	18	42
CCCCCCCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185626	DH	On-Demand	Mild	HDAC3	15	42
CCCCCCCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185626	DH	On-Demand	Mild	HDAC6	15	42
CCCCCCCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185626	DH	On-Demand	Mild	FAAH	28	44
CCCCCCCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185626	DH	On-Demand	Mild	ASAH1	39	41
CCCCCCCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185626	DH	On-Demand	Mild	NOD1	42	34
CC(C)(C)OC(=O)N1CCC(CCC(=O)NCc2ncn(-c3ccccc3)n2)CC1	ZINC000819185628	HG	On-Demand	Anodyne	CCR8	23	41
CC(C)(C)OC(=O)N1CCC(CCC(=O)NCc2ncn(-c3ccccc3)n2)CC1	ZINC000819185628	HG	On-Demand	Anodyne	GPR119	52	43
O=C(Cc1cccnc1Br)NCc1ncn(-c2ccccc2)n1	ZINC000819185652	FE	On-Demand	Anodyne	P2RX7	15	44
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1	ZINC000819185654	JK	On-Demand	Anodyne	LIPG	44	33
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1	ZINC000819185655	JK	On-Demand	Anodyne	LIPG	44	33
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1	ZINC000819185656	JK	On-Demand	Anodyne	LIPG	44	33
COc1cccc(C(C)(C)CNC[C@@H](O)c2ccccc2)c1	ZINC000819185660	CG	On-Demand	Anodyne	ADRB3	41	44
COc1cccc(C(C)(C)CNC[C@H](O)c2ccccc2)c1	ZINC000819185661	CG	On-Demand	Anodyne	ADRB3	41	44
COc1ccc(CC[C@@H](C)NC(=O)C(F)=C2CCC2)cc1	ZINC000819185662	CH	On-Demand	Anodyne	CTSL	18	41
COc1ccc(CC[C@@H](C)NC(=O)C(F)=C2CCC2)cc1	ZINC000819185662	CH	On-Demand	Anodyne	PSMB8	44	30
COc1ccc(CC[C@H](C)NC(=O)C(F)=C2CCC2)cc1	ZINC000819185663	CH	On-Demand	Anodyne	CTSL	18	41
COc1ccc(CC[C@H](C)NC(=O)C(F)=C2CCC2)cc1	ZINC000819185663	CH	On-Demand	Anodyne	PSMB8	44	30
C[C@H](CNC[C@H](O)c1ccccc1Br)CNC(=O)OC(C)(C)C	ZINC000819185684	GG	On-Demand	Anodyne	PAPA1_CARPA	29	43
C[C@H](CNC[C@@H](O)c1ccccc1Br)CNC(=O)OC(C)(C)C	ZINC000819185685	GG	On-Demand	Anodyne	PAPA1_CARPA	29	43
C[C@@H](CNC[C@@H](O)c1ccccc1Br)CNC(=O)OC(C)(C)C	ZINC000819185686	GG	On-Demand	Anodyne	PAPA1_CARPA	29	43
C[C@@H](CNC[C@H](O)c1ccccc1Br)CNC(=O)OC(C)(C)C	ZINC000819185687	GG	On-Demand	Anodyne	PAPA1_CARPA	29	43
CN(C)CC1CCC(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819185692	FD	On-Demand	Anodyne	ADRB3	18	40
CN(C)CC1CCC(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819185693	FD	On-Demand	Anodyne	ADRB3	18	40
C=C(C)C(C)(C)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000819185708	CG	On-Demand	Mild	NOS2	53	34
CCN(Cc1ccc(N(C)C)cc1)C(=O)Cc1nsc2ccccc12	ZINC000819185714	FH	On-Demand	Clean	TSPO	24	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000819185717	FE	On-Demand	Anodyne	NOS2	69	35
COc1cccc(C(C)(C)CNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819185720	FH	On-Demand	Anodyne	MTNR1A	28	53
COc1cccc(C(C)(C)CNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819185720	FH	On-Demand	Anodyne	MTNR1B	32	53
COc1cccc(C(C)(C)CNCCC(=O)N(C)OC)c1	ZINC000819185734	CD	On-Demand	Anodyne	DRD4	40	30
Cc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)c(C)c1	ZINC000819185740	DE	On-Demand	Anodyne	ADRB2	22	44
Cc1ccc(OC[C@H](O)CNCc2cccc(F)n2)c(C)c1	ZINC000819185742	DE	On-Demand	Anodyne	ADRB2	22	44
O[C@H](CNCc1cccc(F)n1)COc1ccc(Cl)c(Cl)c1	ZINC000819185744	EG	On-Demand	Anodyne	ADRB2	32	40
O[C@H](CNCc1cccc(F)n1)COc1ccc(Cl)c(Cl)c1	ZINC000819185744	EG	On-Demand	Anodyne	ADRB1	42	38
O[C@H](CNCc1cccc(F)n1)COc1ccc(Cl)c(Cl)c1	ZINC000819185744	EG	On-Demand	Anodyne	GRIN1	28	45
O[C@@H](CNCc1cccc(F)n1)COc1ccc(Cl)c(Cl)c1	ZINC000819185746	EG	On-Demand	Anodyne	ADRB2	32	40
O[C@@H](CNCc1cccc(F)n1)COc1ccc(Cl)c(Cl)c1	ZINC000819185746	EG	On-Demand	Anodyne	ADRB1	42	38
O[C@@H](CNCc1cccc(F)n1)COc1ccc(Cl)c(Cl)c1	ZINC000819185746	EG	On-Demand	Anodyne	GRIN1	28	45
O[C@@H](CNCc1cccc(COCC(F)(F)F)c1)c1cccc(Cl)c1	ZINC000819185748	FI	On-Demand	Anodyne	ADRB2	31	40
O[C@@H](CNCc1cccc(COCC(F)(F)F)c1)c1cccc(Cl)c1	ZINC000819185748	FI	On-Demand	Anodyne	ADRB1	43	44
O[C@@H](CNCc1cccc(COCC(F)(F)F)c1)c1cccc(Cl)c1	ZINC000819185748	FI	On-Demand	Anodyne	ADRB3	48	45
O[C@H](CNCc1cccc(COCC(F)(F)F)c1)c1cccc(Cl)c1	ZINC000819185749	FI	On-Demand	Anodyne	ADRB2	31	40
O[C@H](CNCc1cccc(COCC(F)(F)F)c1)c1cccc(Cl)c1	ZINC000819185749	FI	On-Demand	Anodyne	ADRB1	43	44
O[C@H](CNCc1cccc(COCC(F)(F)F)c1)c1cccc(Cl)c1	ZINC000819185749	FI	On-Demand	Anodyne	ADRB3	48	45
CN(C)CC1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819185752	CD	On-Demand	Anodyne	ADRB3	66	47
CN(C)CC1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819185753	CD	On-Demand	Anodyne	ADRB3	66	47
CCOc1cc(Cl)ccc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819185787	FG	On-Demand	Bother	ADRB3	36	41
CCOc1cc(Cl)ccc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819185787	FG	On-Demand	Bother	CACNA1D	56	33
C[C@H](CNC[C@H](O)c1ccc(Cl)c(F)c1)CNC(=O)OC(C)(C)C	ZINC000819185788	FG	On-Demand	Anodyne	ADRB1	25	42
CCOc1cc(Cl)ccc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819185789	FG	On-Demand	Bother	ADRB3	36	41
CCOc1cc(Cl)ccc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819185789	FG	On-Demand	Bother	CACNA1D	56	33
C[C@H](CNC[C@@H](O)c1ccc(Cl)c(F)c1)CNC(=O)OC(C)(C)C	ZINC000819185790	FG	On-Demand	Anodyne	ADRB1	25	42
C[C@@H](CNC[C@H](O)c1ccc(Cl)c(F)c1)CNC(=O)OC(C)(C)C	ZINC000819185792	FG	On-Demand	Anodyne	ADRB1	25	42
C[C@@H](CNC[C@@H](O)c1ccc(Cl)c(F)c1)CNC(=O)OC(C)(C)C	ZINC000819185794	FG	On-Demand	Anodyne	ADRB1	25	42
CCOc1ccc([C@@H](NCCS(=O)(=O)CC)c2cccc(Cl)c2)cc1	ZINC000819185833	GH	On-Demand	Anodyne	ADRB3	27	44
C#CCNC(=O)CCN[C@@H](c1ccc(OCC)cc1)c1cccc(Cl)c1	ZINC000819185834	FH	On-Demand	Mild	PDS	44	39
C#CCNC(=O)CCN[C@H](c1ccc(OCC)cc1)c1cccc(Cl)c1	ZINC000819185835	FH	On-Demand	Mild	PDS	44	39
O[C@@H](CNCCOc1ccccc1Cl)c1ccccc1	ZINC000819185836	CG	On-Demand	Anodyne	ADRB2	33	49
O[C@@H](CNCCOc1ccccc1Cl)c1ccccc1	ZINC000819185836	CG	On-Demand	Anodyne	ADRB1	51	49
O[C@@H](CNCCOc1ccccc1Cl)c1ccccc1	ZINC000819185836	CG	On-Demand	Anodyne	ADRB3	58	46
O[C@H](CNCCOc1ccccc1Cl)c1ccccc1	ZINC000819185837	CG	On-Demand	Anodyne	ADRB2	33	49
O[C@H](CNCCOc1ccccc1Cl)c1ccccc1	ZINC000819185837	CG	On-Demand	Anodyne	ADRB1	51	49
O[C@H](CNCCOc1ccccc1Cl)c1ccccc1	ZINC000819185837	CG	On-Demand	Anodyne	ADRB3	58	46
CCOc1cc(Cl)ccc1CNC[C@H](O)c1cccnc1	ZINC000819185842	DF	On-Demand	Anodyne	ADRB2	24	42
CCOc1cc(Cl)ccc1CNC[C@H](O)c1cccnc1	ZINC000819185842	DF	On-Demand	Anodyne	ADRB1	43	42
CCOc1cc(Cl)ccc1CNC[C@H](O)c1cccnc1	ZINC000819185842	DF	On-Demand	Anodyne	ADRB3	100	42
CCOc1cc(Cl)ccc1CNC[C@@H](O)c1cccnc1	ZINC000819185843	DF	On-Demand	Anodyne	ADRB2	24	42
CCOc1cc(Cl)ccc1CNC[C@@H](O)c1cccnc1	ZINC000819185843	DF	On-Demand	Anodyne	ADRB1	43	42
CCOc1cc(Cl)ccc1CNC[C@@H](O)c1cccnc1	ZINC000819185843	DF	On-Demand	Anodyne	ADRB3	100	42
C[C@@H](CC(=O)N1CCC([C@H]2CCCN2C(=O)OC(C)(C)C)CC1)n1cccn1	ZINC000819185845	GG	On-Demand	Anodyne	GPR119	19	41
C[C@@H](CC(=O)N1CCC([C@@H]2CCCN2C(=O)OC(C)(C)C)CC1)n1cccn1	ZINC000819185847	GG	On-Demand	Anodyne	GPR119	19	41
CC(C)(C)OC(=O)N1CCN(C(C)(C)C(=O)NCc2ncn(-c3ccccc3)n2)CC1	ZINC000819185866	IE	On-Demand	Anodyne	GPR119	36	41
CC(C)(C)OC(=O)NCc1ccc(C(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819185869	HG	On-Demand	Anodyne	HDAC1	15	41
CC(C)(C)OC(=O)NCc1ccc(C(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819185869	HG	On-Demand	Anodyne	PDS	44	33
CC(C)(C)OC(=O)N1CCCc2cc(C(=O)NCc3ncn(-c4ccccc4)n3)ccc21	ZINC000819185883	IH	On-Demand	Anodyne	AVPR2	32	41
CC(C)c1ccc2cc(C(=O)NCc3ncn(-c4ccccc4)n3)[nH]c2c1	ZINC000819185885	FH	On-Demand	Anodyne	PLD1	17	42
CC(C)(C)OC(=O)N[C@H](CC(=O)NCc1ncn(-c2ccccc2)n1)Cc1ccccc1	ZINC000819185894	IG	On-Demand	Anodyne	PGC	52	39
CC(C)(C)OC(=O)N[C@H](CC(=O)NCc1ncn(-c2ccccc2)n1)Cc1ccccc1	ZINC000819185894	IG	On-Demand	Anodyne	PAPA1_CARPA	34	45
CC(C)(C)OC(=O)N[C@H](CC(=O)NCc1ncn(-c2ccccc2)n1)Cc1ccccc1	ZINC000819185894	IG	On-Demand	Anodyne	CCKAR	50	37
CC(C)(C)OC(=O)N[C@H](CC(=O)NCc1ncn(-c2ccccc2)n1)Cc1ccccc1	ZINC000819185894	IG	On-Demand	Anodyne	REN	63	39
CC(C)(C)OC(=O)N[C@H](CC(=O)NCc1ncn(-c2ccccc2)n1)Cc1ccccc1	ZINC000819185894	IG	On-Demand	Anodyne	CCKBR	20	43
CC(C)(C)OC(=O)N[C@H](CC(=O)NCc1ncn(-c2ccccc2)n1)Cc1ccccc1	ZINC000819185894	IG	On-Demand	Anodyne	FPR1	50	38
CC(C)(C)OC(=O)N[C@@H](CC(=O)NCc1ncn(-c2ccccc2)n1)Cc1ccccc1	ZINC000819185895	IG	On-Demand	Anodyne	PGC	52	39
CC(C)(C)OC(=O)N[C@@H](CC(=O)NCc1ncn(-c2ccccc2)n1)Cc1ccccc1	ZINC000819185895	IG	On-Demand	Anodyne	PAPA1_CARPA	34	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)NCc1ncn(-c2ccccc2)n1)Cc1ccccc1	ZINC000819185895	IG	On-Demand	Anodyne	CCKAR	50	37
CC(C)(C)OC(=O)N[C@@H](CC(=O)NCc1ncn(-c2ccccc2)n1)Cc1ccccc1	ZINC000819185895	IG	On-Demand	Anodyne	REN	63	39
CC(C)(C)OC(=O)N[C@@H](CC(=O)NCc1ncn(-c2ccccc2)n1)Cc1ccccc1	ZINC000819185895	IG	On-Demand	Anodyne	CCKBR	20	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)NCc1ncn(-c2ccccc2)n1)Cc1ccccc1	ZINC000819185895	IG	On-Demand	Anodyne	FPR1	50	38
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185899	HG	On-Demand	Anodyne	F2	75	44
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185899	HG	On-Demand	Anodyne	PRSS1	17	40
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185899	HG	On-Demand	Anodyne	ACE	28	45
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185899	HG	On-Demand	Anodyne	FKBP1A	57	46
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185899	HG	On-Demand	Anodyne	CELA1	26	51
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185899	HG	On-Demand	Anodyne	GRIN2B	18	40
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185899	HG	On-Demand	Anodyne	ELANE	33	40
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185899	HG	On-Demand	Anodyne	CTRA_BOVIN	62	34
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185899	HG	On-Demand	Anodyne	TRY1_BOVIN	88	43
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185899	HG	On-Demand	Anodyne	CTSG	42	34
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185899	HG	On-Demand	Anodyne	CPT1A	63	35
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185899	HG	On-Demand	Anodyne	PREP	73	51
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185899	HG	On-Demand	Anodyne	CELA2A	51	34
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185899	HG	On-Demand	Anodyne	LGMN	87	49
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185899	HG	On-Demand	Anodyne	KLK5	27	46
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185899	HG	On-Demand	Anodyne	XIAP	34	43
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185899	HG	On-Demand	Anodyne	TMPRSS11D	76	43
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185900	HG	On-Demand	Anodyne	F2	75	44
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185900	HG	On-Demand	Anodyne	PRSS1	17	40
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185900	HG	On-Demand	Anodyne	ACE	28	45
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185900	HG	On-Demand	Anodyne	FKBP1A	57	46
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185900	HG	On-Demand	Anodyne	CELA1	26	51
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185900	HG	On-Demand	Anodyne	GRIN2B	18	40
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185900	HG	On-Demand	Anodyne	ELANE	33	40
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185900	HG	On-Demand	Anodyne	CTRA_BOVIN	62	34
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185900	HG	On-Demand	Anodyne	TRY1_BOVIN	88	43
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185900	HG	On-Demand	Anodyne	CTSG	42	34
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185900	HG	On-Demand	Anodyne	CPT1A	63	35
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185900	HG	On-Demand	Anodyne	PREP	73	51
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185900	HG	On-Demand	Anodyne	CELA2A	51	34
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185900	HG	On-Demand	Anodyne	LGMN	87	49
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185900	HG	On-Demand	Anodyne	KLK5	27	46
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185900	HG	On-Demand	Anodyne	XIAP	34	43
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819185900	HG	On-Demand	Anodyne	TMPRSS11D	76	43
O=C(NCc1ncn(-c2ccccc2)n1)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	ZINC000819185904	ID	On-Demand	Anodyne	CCR8	71	37
O=C(NCc1ncn(-c2ccccc2)n1)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F	ZINC000819185904	ID	On-Demand	Anodyne	SFRP1	78	33
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(OCc2ccccc2)ccn1	ZINC000819185910	GG	On-Demand	Anodyne	SCD1	15	42
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(OCc2ccccc2)ccn1	ZINC000819185910	GG	On-Demand	Anodyne	SCD	16	42
O=C(CCn1c(S)nc2ccccc2c1=O)NCc1ncn(-c2ccccc2)n1	ZINC000819185914	HD	On-Demand	Anodyne	HTR7	18	44
O[C@@H](CNCc1cccc(COCC(F)(F)F)c1)c1cccnc1	ZINC000819185922	EF	On-Demand	Anodyne	ADRB2	23	41
O[C@@H](CNCc1cccc(COCC(F)(F)F)c1)c1cccnc1	ZINC000819185922	EF	On-Demand	Anodyne	ADRB1	28	44
O[C@@H](CNCc1cccc(COCC(F)(F)F)c1)c1cccnc1	ZINC000819185922	EF	On-Demand	Anodyne	ADRB3	90	44
O[C@H](CNCc1cccc(COCC(F)(F)F)c1)c1cccnc1	ZINC000819185923	EF	On-Demand	Anodyne	ADRB2	23	41
O[C@H](CNCc1cccc(COCC(F)(F)F)c1)c1cccnc1	ZINC000819185923	EF	On-Demand	Anodyne	ADRB1	28	44
O[C@H](CNCc1cccc(COCC(F)(F)F)c1)c1cccnc1	ZINC000819185923	EF	On-Demand	Anodyne	ADRB3	90	44
C[C@@H](CNCCS(=O)(=O)c1ccccc1)CNC(=O)OC(C)(C)C	ZINC000819185949	FE	On-Demand	Anodyne	FPR1	41	37
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819185950	IE	On-Demand	Anodyne	NAMPT	45	41
C[C@H](CNCCS(=O)(=O)c1ccccc1)CNC(=O)OC(C)(C)C	ZINC000819185951	FE	On-Demand	Anodyne	FPR1	41	37
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(CS(=O)(=O)c2ccccc2)o1	ZINC000819185952	HF	On-Demand	Anodyne	NAMPT	34	40
CC(C)(C)OC(=O)N1CC[C@H](c2cc(C(=O)NCc3ncn(-c4ccccc4)n3)n[nH]2)C1	ZINC000819185957	IF	On-Demand	Anodyne	GPR119	28	40
O[C@H](CNCc1cccc(F)n1)COc1ccccc1F	ZINC000819185959	CD	On-Demand	Anodyne	ADRB2	25	46
O[C@H](CNCc1cccc(F)n1)COc1ccccc1F	ZINC000819185959	CD	On-Demand	Anodyne	ADRB1	59	39
O[C@@H](CNCc1cccc(F)n1)COc1ccccc1F	ZINC000819185960	CD	On-Demand	Anodyne	ADRB2	25	46
O[C@@H](CNCc1cccc(F)n1)COc1ccccc1F	ZINC000819185960	CD	On-Demand	Anodyne	ADRB1	59	39
C[C@H](C#N)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819185961	CD	On-Demand	Mild	PAPA1_CARPA	46	55
C[C@H](C#N)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819185961	CD	On-Demand	Mild	CTSK	21	52
C[C@H](C#N)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819185961	CD	On-Demand	Mild	POLG_HCV1	23	40
C[C@H](C#N)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819185961	CD	On-Demand	Mild	FPR1	45	41
CC(C)(C)OC(=O)N1CC[C@@H](c2cc(C(=O)NCc3ncn(-c4ccccc4)n3)n[nH]2)C1	ZINC000819185962	IF	On-Demand	Anodyne	GPR119	28	40
C[C@H](C#N)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819185964	CD	On-Demand	Mild	PAPA1_CARPA	46	55
C[C@H](C#N)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819185964	CD	On-Demand	Mild	CTSK	21	52
C[C@H](C#N)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819185964	CD	On-Demand	Mild	POLG_HCV1	23	40
C[C@H](C#N)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819185964	CD	On-Demand	Mild	FPR1	45	41
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2C(=O)NCc2ncn(-c3ccccc3)n2)CC1	ZINC000819185980	IG	On-Demand	Anodyne	GPR119	42	44
CS(=O)(=O)Nc1cccc(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819186000	FD	On-Demand	Anodyne	NR1I2	42	32
CSc1ccc(OC[C@H](O)CNOCC(C)C)cc1	ZINC000819186009	CE	On-Demand	Anodyne	ADRB2	32	47
CSc1ccc(OC[C@H](O)CNOCC(C)C)cc1	ZINC000819186009	CE	On-Demand	Anodyne	ADRB1	39	45
CSc1ccc(OC[C@H](O)CNOCC(C)C)cc1	ZINC000819186009	CE	On-Demand	Anodyne	ADRB3	18	42
CSc1ccc(OC[C@@H](O)CNOCC(C)C)cc1	ZINC000819186010	CE	On-Demand	Anodyne	ADRB2	32	47
CSc1ccc(OC[C@@H](O)CNOCC(C)C)cc1	ZINC000819186010	CE	On-Demand	Anodyne	ADRB1	39	45
CSc1ccc(OC[C@@H](O)CNOCC(C)C)cc1	ZINC000819186010	CE	On-Demand	Anodyne	ADRB3	18	42
COc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(OC)n1	ZINC000819186016	GF	On-Demand	Mild	PAPA1_CARPA	44	46
COc1cccc(C(C)(C)CNC[C@H](O)c2cccnc2)c1	ZINC000819186028	DF	On-Demand	Anodyne	ADRB2	26	41
COc1cccc(C(C)(C)CNC[C@H](O)c2cccnc2)c1	ZINC000819186028	DF	On-Demand	Anodyne	ADRB1	27	46
COc1cccc(C(C)(C)CNC[C@H](O)c2cccnc2)c1	ZINC000819186028	DF	On-Demand	Anodyne	ADRB3	93	46
COc1cccc(C(C)(C)CNC[C@@H](O)c2cccnc2)c1	ZINC000819186029	DF	On-Demand	Anodyne	ADRB2	26	41
COc1cccc(C(C)(C)CNC[C@@H](O)c2cccnc2)c1	ZINC000819186029	DF	On-Demand	Anodyne	ADRB1	27	46
COc1cccc(C(C)(C)CNC[C@@H](O)c2cccnc2)c1	ZINC000819186029	DF	On-Demand	Anodyne	ADRB3	93	46
CC(C)CN1CCC(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819186044	GF	On-Demand	Mild	PAPA1_CARPA	37	45
CC(C)CN1CCC(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819186045	GF	On-Demand	Mild	PAPA1_CARPA	37	45
Cc1noc(C)c1[C@@H](C)CNC[C@H](O)c1cccnc1	ZINC000819186056	CE	On-Demand	Anodyne	ADRB2	21	42
Cc1noc(C)c1[C@@H](C)CNC[C@H](O)c1cccnc1	ZINC000819186056	CE	On-Demand	Anodyne	ADRB1	22	45
Cc1noc(C)c1[C@@H](C)CNC[C@H](O)c1cccnc1	ZINC000819186056	CE	On-Demand	Anodyne	ADRB3	89	46
Cc1noc(C)c1[C@@H](C)CNC[C@@H](O)c1cccnc1	ZINC000819186057	CE	On-Demand	Anodyne	ADRB2	21	42
Cc1noc(C)c1[C@@H](C)CNC[C@@H](O)c1cccnc1	ZINC000819186057	CE	On-Demand	Anodyne	ADRB1	22	45
Cc1noc(C)c1[C@@H](C)CNC[C@@H](O)c1cccnc1	ZINC000819186057	CE	On-Demand	Anodyne	ADRB3	89	46
Cc1noc(C)c1[C@H](C)CNC[C@@H](O)c1cccnc1	ZINC000819186058	CE	On-Demand	Anodyne	ADRB2	21	42
Cc1noc(C)c1[C@H](C)CNC[C@@H](O)c1cccnc1	ZINC000819186058	CE	On-Demand	Anodyne	ADRB1	22	45
Cc1noc(C)c1[C@H](C)CNC[C@@H](O)c1cccnc1	ZINC000819186058	CE	On-Demand	Anodyne	ADRB3	89	46
Cc1noc(C)c1[C@H](C)CNC[C@H](O)c1cccnc1	ZINC000819186059	CE	On-Demand	Anodyne	ADRB2	21	42
Cc1noc(C)c1[C@H](C)CNC[C@H](O)c1cccnc1	ZINC000819186059	CE	On-Demand	Anodyne	ADRB1	22	45
Cc1noc(C)c1[C@H](C)CNC[C@H](O)c1cccnc1	ZINC000819186059	CE	On-Demand	Anodyne	ADRB3	89	46
CCN(Cc1cnn(C)c1)C(=O)C(F)=C1CCC1	ZINC000819186062	CE	On-Demand	Anodyne	PLA2G7	43	32
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1ccc(Cl)s1	ZINC000819186065	FD	On-Demand	Anodyne	ADRB2	26	45
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1ccc(Cl)s1	ZINC000819186065	FD	On-Demand	Anodyne	ADRB1	33	42
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1ccc(Cl)s1	ZINC000819186065	FD	On-Demand	Anodyne	ADRB3	111	52
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1ccc(Cl)s1	ZINC000819186066	FD	On-Demand	Anodyne	ADRB2	26	45
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1ccc(Cl)s1	ZINC000819186066	FD	On-Demand	Anodyne	ADRB1	33	42
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1ccc(Cl)s1	ZINC000819186066	FD	On-Demand	Anodyne	ADRB3	111	52
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCOc2ccccc2Cl)CC1	ZINC000819186079	GG	On-Demand	Anodyne	GPR119	45	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCOc2ccccc2Cl)CC1	ZINC000819186079	GG	On-Demand	Anodyne	SCD	17	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCOc2ccccc2Cl)CC1	ZINC000819186080	GG	On-Demand	Anodyne	GPR119	45	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCOc2ccccc2Cl)CC1	ZINC000819186080	GG	On-Demand	Anodyne	SCD	17	40
Cc1noc(C)c1[C@H](C)CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819186085	GF	On-Demand	Anodyne	GPR119	30	41
Cc1noc(C)c1[C@H](C)CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819186086	GF	On-Demand	Anodyne	GPR119	30	41
Cc1noc(C)c1[C@@H](C)CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819186087	GF	On-Demand	Anodyne	GPR119	30	41
Cc1noc(C)c1[C@@H](C)CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819186088	GF	On-Demand	Anodyne	GPR119	30	41
O=C(CCNC(=O)C(F)=C1CCC1)NCc1cccnc1	ZINC000819186103	CD	On-Demand	Anodyne	NAMPT	52	41
COc1ccc(-c2nnc(S)n2CC(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819186154	HE	On-Demand	Anodyne	AVPR1B	48	38
CS(=O)(=O)Nc1ccc(O)c(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819186155	GD	On-Demand	Clean	NR1I2	48	34
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)NCc2ncn(-c3ccccc3)n2)C1	ZINC000819186163	GF	On-Demand	Anodyne	GPR119	46	43
C=CCc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)c(OC)c1	ZINC000819186186	EE	On-Demand	Mild	ADRB2	15	42
O=C(NCc1ncn(-c2ccccc2)n1)c1cc2cccc(Cl)c2o1	ZINC000819186187	FH	On-Demand	Anodyne	NAMPT	20	40
C=CCc1ccc(OC[C@H](O)CNCc2cccc(F)n2)c(OC)c1	ZINC000819186188	EE	On-Demand	Mild	ADRB2	15	42
O=C(NCc1ncn(-c2ccccc2)n1)c1cc2ccc(OCc3ccccc3)cc2[nH]1	ZINC000819186192	HI	On-Demand	Anodyne	MAOB	15	47
O=C(NCc1ncn(-c2ccccc2)n1)c1ccnc(C(F)(F)F)c1	ZINC000819186206	EF	On-Demand	Anodyne	CARM1	58	38
O=C(NCc1ncn(-c2ccccc2)n1)c1ccnc(C(F)(F)F)c1	ZINC000819186206	EF	On-Demand	Anodyne	KDM4E	31	40
COc1cc(C(=O)NCc2ncn(-c3ccccc3)n2)cnc1Br	ZINC000819186229	GE	On-Demand	Anodyne	DRD4	41	32
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186242	FE	On-Demand	Anodyne	PGC	51	35
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186242	FE	On-Demand	Anodyne	PAPA1_CARPA	46	48
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186242	FE	On-Demand	Anodyne	CTSK	19	48
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186242	FE	On-Demand	Anodyne	TACR3	15	41
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186242	FE	On-Demand	Anodyne	REN	60	39
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186242	FE	On-Demand	Anodyne	CAPN1	30	41
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186242	FE	On-Demand	Anodyne	CAPN2	69	34
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186242	FE	On-Demand	Anodyne	SCN10A	20	42
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186242	FE	On-Demand	Anodyne	FPR1	55	38
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186242	FE	On-Demand	Anodyne	AMP1_PLAFQ	18	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC(=O)C(F)=C1CCC1	ZINC000819186249	FE	On-Demand	Anodyne	HRH4	15	40
Cc1nc(S)sc1CC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186252	EE	On-Demand	Anodyne	P2RX7	21	41
CCOc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819186267	DE	On-Demand	Anodyne	ADRB2	44	44
CCOc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819186267	DE	On-Demand	Anodyne	ADRB1	63	42
CCOc1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819186267	DE	On-Demand	Anodyne	ADRB3	37	40
CCOc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819186269	DE	On-Demand	Anodyne	ADRB2	44	44
CCOc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819186269	DE	On-Demand	Anodyne	ADRB1	63	42
CCOc1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819186269	DE	On-Demand	Anodyne	ADRB3	37	40
CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186303	IG	On-Demand	Anodyne	GHSR	18	50
CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186305	IG	On-Demand	Anodyne	GHSR	18	50
O=C(NCc1ncn(-c2ccccc2)n1)c1cccc(Cl)c1O	ZINC000819186317	EF	On-Demand	Anodyne	P2RX7	17	42
CN(C)CC1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819186330	CE	On-Demand	Anodyne	AOC3	18	41
CN(C)CC1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819186331	CE	On-Demand	Anodyne	AOC3	18	41
N#CCOc1ccccc1C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186334	EE	On-Demand	Mild	HCN1	60	32
COc1cccc(OC)c1OC[C@H](O)CNCc1cccc(F)n1	ZINC000819186337	ED	On-Demand	Anodyne	ADRB2	27	44
COc1cccc(OC)c1OC[C@@H](O)CNCc1cccc(F)n1	ZINC000819186338	ED	On-Demand	Anodyne	ADRB2	27	44
CC(=O)c1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819186339	DD	On-Demand	Anodyne	ADRB2	43	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819186339	DD	On-Demand	Anodyne	ADRB1	73	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819186339	DD	On-Demand	Anodyne	ADRB3	41	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2cccc(F)n2)cc1	ZINC000819186339	DD	On-Demand	Anodyne	ABCB1	17	54
CC(=O)c1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819186340	DD	On-Demand	Anodyne	ADRB2	43	41
CC(=O)c1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819186340	DD	On-Demand	Anodyne	ADRB1	73	42
CC(=O)c1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819186340	DD	On-Demand	Anodyne	ADRB3	41	42
CC(=O)c1ccc(OC[C@H](O)CNCc2cccc(F)n2)cc1	ZINC000819186340	DD	On-Demand	Anodyne	ABCB1	17	54
COc1cc(C(=O)NCc2ncn(-c3ccccc3)n2)ccc1OCc1ccccc1	ZINC000819186343	HH	On-Demand	Anodyne	TSHR	40	31
COc1cc(C(=O)NCc2ncn(-c3ccccc3)n2)ccc1OCc1ccccc1	ZINC000819186343	HH	On-Demand	Anodyne	PPARA	15	45
COc1cc(C(=O)NCc2ncn(-c3ccccc3)n2)ccc1OCc1ccccc1	ZINC000819186343	HH	On-Demand	Anodyne	PDGFRB	19	40
COc1cc(C(=O)NCc2ncn(-c3ccccc3)n2)ccc1OCc1ccccc1	ZINC000819186343	HH	On-Demand	Anodyne	PTGER1	59	40
COc1cc(C(=O)NCc2ncn(-c3ccccc3)n2)ccc1OCc1ccccc1	ZINC000819186343	HH	On-Demand	Anodyne	CPT1A	45	31
COc1cc(C(=O)NCc2ncn(-c3ccccc3)n2)ccc1OCc1ccccc1	ZINC000819186343	HH	On-Demand	Anodyne	ABCG2	24	40
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819186347	IG	On-Demand	Anodyne	F2	57	41
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819186347	IG	On-Demand	Anodyne	TRY1_BOVIN	56	39
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819186347	IG	On-Demand	Anodyne	PREP	40	37
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819186347	IG	On-Demand	Anodyne	TMPRSS11D	66	36
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819186348	IG	On-Demand	Anodyne	F2	57	41
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819186348	IG	On-Demand	Anodyne	TRY1_BOVIN	56	39
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819186348	IG	On-Demand	Anodyne	PREP	40	37
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819186348	IG	On-Demand	Anodyne	TMPRSS11D	66	36
O=C(Nc1ccccc1C(=O)NCc1ncn(-c2ccccc2)n1)c1cccs1	ZINC000819186353	HH	On-Demand	Anodyne	GPR142	40	31
CCOc1cc(Cl)ccc1CNC[C@H](O)c1ccc(F)cc1	ZINC000819186392	DH	On-Demand	Anodyne	ADRB3	24	42
CCOc1cc(Cl)ccc1CNC[C@@H](O)c1ccc(F)cc1	ZINC000819186393	DH	On-Demand	Anodyne	ADRB3	24	42
CS[C@H](C)CNC[C@H](O)c1cccnc1	ZINC000819186413	BD	On-Demand	Anodyne	ADRB2	24	45
CS[C@H](C)CNC[C@H](O)c1cccnc1	ZINC000819186413	BD	On-Demand	Anodyne	ADRB1	25	45
CS[C@H](C)CNC[C@H](O)c1cccnc1	ZINC000819186413	BD	On-Demand	Anodyne	ADRB3	95	46
CS[C@H](C)CNC[C@@H](O)c1cccnc1	ZINC000819186414	BD	On-Demand	Anodyne	ADRB2	24	45
CS[C@H](C)CNC[C@@H](O)c1cccnc1	ZINC000819186414	BD	On-Demand	Anodyne	ADRB1	25	45
CS[C@H](C)CNC[C@@H](O)c1cccnc1	ZINC000819186414	BD	On-Demand	Anodyne	ADRB3	95	46
C=C(C)C(C)(C)C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000819186433	CE	On-Demand	Mild	NOS2	94	36
CON(C)C(=O)CCNCCNS(=O)(=O)c1ccc(Cl)s1	ZINC000819186440	FC	On-Demand	Anodyne	CCR4	40	32
Cc1cc(OC[C@@H](O)CNCc2cccc(F)n2)c(C(C)C)cc1Cl	ZINC000819186478	FH	On-Demand	Anodyne	ADRB2	17	40
Cc1cc(OC[C@H](O)CNCc2cccc(F)n2)c(C(C)C)cc1Cl	ZINC000819186479	FH	On-Demand	Anodyne	ADRB2	17	40
C[C@H](C#N)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819186496	FH	On-Demand	Mild	CTSK	18	52
C[C@H](C#N)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819186496	FH	On-Demand	Mild	ECE1	22	43
C[C@H](C#N)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819186496	FH	On-Demand	Mild	REN	50	45
C[C@H](C#N)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819186496	FH	On-Demand	Mild	CTSH	38	41
C[C@@H](C#N)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819186497	FH	On-Demand	Mild	CTSK	18	52
C[C@@H](C#N)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819186497	FH	On-Demand	Mild	ECE1	22	43
C[C@@H](C#N)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819186497	FH	On-Demand	Mild	REN	50	45
C[C@@H](C#N)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819186497	FH	On-Demand	Mild	CTSH	38	41
C[C@@H](C#N)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819186498	FH	On-Demand	Mild	CTSK	18	52
C[C@@H](C#N)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819186498	FH	On-Demand	Mild	ECE1	22	43
C[C@@H](C#N)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819186498	FH	On-Demand	Mild	REN	50	45
C[C@@H](C#N)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819186498	FH	On-Demand	Mild	CTSH	38	41
C[C@H](C#N)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819186499	FH	On-Demand	Mild	CTSK	18	52
C[C@H](C#N)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819186499	FH	On-Demand	Mild	ECE1	22	43
C[C@H](C#N)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819186499	FH	On-Demand	Mild	REN	50	45
C[C@H](C#N)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819186499	FH	On-Demand	Mild	CTSH	38	41
COc1cccc(C(C)(C)CNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819186506	DH	On-Demand	Anodyne	ADRB2	16	40
COc1cccc(C(C)(C)CNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819186507	DH	On-Demand	Anodyne	ADRB2	16	40
CN(C)CC1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819186510	DG	On-Demand	Anodyne	ADRB3	18	43
O[C@H](CNCc1cccc(F)n1)COc1ccc(Br)cc1	ZINC000819186513	FF	On-Demand	Anodyne	ADRB2	35	42
O[C@H](CNCc1cccc(F)n1)COc1ccc(Br)cc1	ZINC000819186513	FF	On-Demand	Anodyne	ADRB1	54	42
O[C@H](CNCc1cccc(F)n1)COc1ccc(Br)cc1	ZINC000819186513	FF	On-Demand	Anodyne	ADRB3	31	42
O[C@@H](CNCc1cccc(F)n1)COc1ccc(Br)cc1	ZINC000819186514	FF	On-Demand	Anodyne	ADRB2	35	42
O[C@@H](CNCc1cccc(F)n1)COc1ccc(Br)cc1	ZINC000819186514	FF	On-Demand	Anodyne	ADRB1	54	42
O[C@@H](CNCc1cccc(F)n1)COc1ccc(Br)cc1	ZINC000819186514	FF	On-Demand	Anodyne	ADRB3	31	42
C[C@H](CNC[C@H](O)c1ccc(Cl)cc1)CNC(=O)OC(C)(C)C	ZINC000819186524	EG	On-Demand	Anodyne	ADRB1	25	42
C[C@H](CNC[C@H](O)c1ccc(Cl)cc1)CNC(=O)OC(C)(C)C	ZINC000819186524	EG	On-Demand	Anodyne	ADRB3	34	42
C[C@@H](CNC[C@H](O)c1ccc(Cl)cc1)CNC(=O)OC(C)(C)C	ZINC000819186526	EG	On-Demand	Anodyne	ADRB1	25	42
C[C@@H](CNC[C@H](O)c1ccc(Cl)cc1)CNC(=O)OC(C)(C)C	ZINC000819186526	EG	On-Demand	Anodyne	ADRB3	34	42
CCC(=O)Nc1ccccc1C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186527	EF	On-Demand	Anodyne	HCAR2	30	43
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186548	IG	On-Demand	Anodyne	FPR1	44	32
C#CCN1CCC[C@H]1C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186549	DC	On-Demand	Mild	TMPRSS11D	41	33
O=C(NCc1ncn(-c2ccccc2)n1)/C(=C\c1ccco1)NC(=O)c1ccccc1	ZINC000819186551	HF	On-Demand	Anodyne	ADAM12	36	42
O=C(NCc1ncn(-c2ccccc2)n1)/C(=C/c1ccco1)NC(=O)c1ccccc1	ZINC000819186552	HF	On-Demand	Anodyne	ADAM12	36	42
O=C(Nc1ccccc1C(=O)NCc1ncn(-c2ccccc2)n1)c1ccc(Cl)cc1	ZINC000819186555	II	On-Demand	Anodyne	F10	38	50
O=C(Nc1ccccc1C(=O)NCc1ncn(-c2ccccc2)n1)c1ccc(Cl)cc1	ZINC000819186555	II	On-Demand	Anodyne	HDAC1	44	40
O=C(Nc1ccccc1C(=O)NCc1ncn(-c2ccccc2)n1)c1ccc(Cl)cc1	ZINC000819186555	II	On-Demand	Anodyne	LUCI_LUCLA	30	40
CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)C1CCOCC1	ZINC000819186558	HE	On-Demand	Anodyne	REN	52	34
CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)C1CCOCC1	ZINC000819186558	HE	On-Demand	Anodyne	FPR1	41	35
O=C(CCCNC(=O)OCc1ccccc1)NCc1ncn(-c2ccccc2)n1	ZINC000819186561	GF	On-Demand	Anodyne	CAPN1	39	45
O=C(CCCNC(=O)OCc1ccccc1)NCc1ncn(-c2ccccc2)n1	ZINC000819186561	GF	On-Demand	Anodyne	CAPN2	64	45
O=C(CCCNC(=O)OCc1ccccc1)NCc1ncn(-c2ccccc2)n1	ZINC000819186561	GF	On-Demand	Anodyne	TPSAB1	18	40
O=C(CCCNC(=O)OCc1ccccc1)NCc1ncn(-c2ccccc2)n1	ZINC000819186561	GF	On-Demand	Anodyne	NPR	56	35
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000819186572	HH	On-Demand	Anodyne	METAP1	48	42
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000819186572	HH	On-Demand	Anodyne	TACR3	16	51
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819186574	ID	On-Demand	Anodyne	F2	60	42
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819186574	ID	On-Demand	Anodyne	TRY1_BOVIN	62	41
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819186574	ID	On-Demand	Anodyne	TMPRSS11D	72	38
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819186575	ID	On-Demand	Anodyne	F2	60	42
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819186575	ID	On-Demand	Anodyne	TRY1_BOVIN	62	41
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819186575	ID	On-Demand	Anodyne	TMPRSS11D	72	38
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819186576	ID	On-Demand	Anodyne	F2	60	42
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819186576	ID	On-Demand	Anodyne	TRY1_BOVIN	62	41
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819186576	ID	On-Demand	Anodyne	TMPRSS11D	72	38
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819186577	ID	On-Demand	Anodyne	F2	60	42
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819186577	ID	On-Demand	Anodyne	TRY1_BOVIN	62	41
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819186577	ID	On-Demand	Anodyne	TMPRSS11D	72	38
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186585	II	On-Demand	Anodyne	TACR3	15	40
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186585	II	On-Demand	Anodyne	FPR1	42	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCC(=O)NCc1cccnc1)C2	ZINC000819186637	FD	On-Demand	Anodyne	NAMPT	47	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCC(=O)NCc1cccnc1)C2	ZINC000819186638	FD	On-Demand	Anodyne	NAMPT	47	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000819186660	FD	On-Demand	Anodyne	NOS2	98	35
O=C(NCc1ccnc(-n2ccnc2)c1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819186665	GG	On-Demand	Anodyne	NOS2	101	38
O[C@@H](CNCCOc1ccccc1Cl)c1cccc(Cl)c1	ZINC000819186673	EH	On-Demand	Anodyne	ADRB2	55	44
O[C@@H](CNCCOc1ccccc1Cl)c1cccc(Cl)c1	ZINC000819186673	EH	On-Demand	Anodyne	ADRB1	73	56
O[C@@H](CNCCOc1ccccc1Cl)c1cccc(Cl)c1	ZINC000819186673	EH	On-Demand	Anodyne	ADRB3	78	56
O[C@H](CNCCOc1ccccc1Cl)c1cccc(Cl)c1	ZINC000819186674	EH	On-Demand	Anodyne	ADRB2	55	44
O[C@H](CNCCOc1ccccc1Cl)c1cccc(Cl)c1	ZINC000819186674	EH	On-Demand	Anodyne	ADRB1	73	56
O[C@H](CNCCOc1ccccc1Cl)c1cccc(Cl)c1	ZINC000819186674	EH	On-Demand	Anodyne	ADRB3	78	56
CS[C@H](C)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819186687	CD	On-Demand	Bother	CACNA1D	40	34
CS[C@H](C)CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819186690	CD	On-Demand	Bother	CACNA1D	40	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccnc(-n3ccnc3)c1)C2	ZINC000819186704	FD	On-Demand	Anodyne	NOS2	102	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccnc(-n3ccnc3)c1)C2	ZINC000819186705	FD	On-Demand	Anodyne	NOS2	102	39
O=[N+]([O-])c1cccc([C@@H](O)CNCC2(C3CC3)CCC2)c1	ZINC000819186710	CF	On-Demand	Bother	CACNA1D	52	34
O=[N+]([O-])c1cccc([C@H](O)CNCC2(C3CC3)CCC2)c1	ZINC000819186711	CF	On-Demand	Bother	CACNA1D	52	34
O[C@@H](CNCCOc1ccccc1Cl)c1cccnc1	ZINC000819186718	CE	On-Demand	Anodyne	ADRB2	33	55
O[C@@H](CNCCOc1ccccc1Cl)c1cccnc1	ZINC000819186718	CE	On-Demand	Anodyne	ADRB1	50	55
O[C@@H](CNCCOc1ccccc1Cl)c1cccnc1	ZINC000819186718	CE	On-Demand	Anodyne	ADRB3	119	57
O[C@H](CNCCOc1ccccc1Cl)c1cccnc1	ZINC000819186719	CE	On-Demand	Anodyne	ADRB2	33	55
O[C@H](CNCCOc1ccccc1Cl)c1cccnc1	ZINC000819186719	CE	On-Demand	Anodyne	ADRB1	50	55
O[C@H](CNCCOc1ccccc1Cl)c1cccnc1	ZINC000819186719	CE	On-Demand	Anodyne	ADRB3	119	57
CCOc1cc(Cl)ccc1CNC[C@H](O)c1cccc(F)c1	ZINC000819186725	DH	On-Demand	Anodyne	ADRB1	25	40
CCOc1cc(Cl)ccc1CNC[C@H](O)c1cccc(F)c1	ZINC000819186725	DH	On-Demand	Anodyne	ADRB3	39	45
CCOc1cc(Cl)ccc1CNC[C@@H](O)c1cccc(F)c1	ZINC000819186726	DH	On-Demand	Anodyne	ADRB1	25	40
CCOc1cc(Cl)ccc1CNC[C@@H](O)c1cccc(F)c1	ZINC000819186726	DH	On-Demand	Anodyne	ADRB3	39	45
C=C(C)C(C)(C)C(=O)N1CCC([C@@H]2CCCN2C(=O)OC(C)(C)C)CC1	ZINC000819186727	FI	On-Demand	Mild	GPR119	18	43
C=C(C)C(C)(C)C(=O)N1CCC([C@H]2CCCN2C(=O)OC(C)(C)C)CC1	ZINC000819186728	FI	On-Demand	Mild	GPR119	18	43
O=C(NCc1ccccc1OCCN1CCOCC1)C(F)=C1CCC1	ZINC000819186729	EE	On-Demand	Anodyne	EPHX2	21	40
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819186731	HH	On-Demand	Anodyne	PRS	25	41
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819186731	HH	On-Demand	Anodyne	TACR3	19	58
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819186731	HH	On-Demand	Anodyne	MT-CO2	48	38
C[C@@H](CC(=O)NCc1ncn(-c2ccccc2)n1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819186733	IH	On-Demand	Anodyne	GPR119	52	53
C[C@H](CC(=O)NCc1ncn(-c2ccccc2)n1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819186734	IH	On-Demand	Anodyne	GPR119	52	53
O=C(CNC(=O)OCc1ccccc1)NCc1ncn(-c2ccccc2)n1	ZINC000819186740	FD	On-Demand	Anodyne	CTSB	25	41
O=C(CNC(=O)OCc1ccccc1)NCc1ncn(-c2ccccc2)n1	ZINC000819186740	FD	On-Demand	Anodyne	CAPNS1	56	32
O=C(CNC(=O)OCc1ccccc1)NCc1ncn(-c2ccccc2)n1	ZINC000819186740	FD	On-Demand	Anodyne	CAPN1	40	35
O=C(CNC(=O)OCc1ccccc1)NCc1ncn(-c2ccccc2)n1	ZINC000819186740	FD	On-Demand	Anodyne	CAPN2	66	35
O=C(CNC(=O)OCc1ccccc1)NCc1ncn(-c2ccccc2)n1	ZINC000819186740	FD	On-Demand	Anodyne	NPR	57	34
O=C(/C=C\c1ccc2ccc(Cl)cc2n1)NCc1ncn(-c2ccccc2)n1	ZINC000819186741	GH	On-Demand	Anodyne	UL80	18	40
O=C(/C=C/c1ccc2ccc(Cl)cc2n1)NCc1ncn(-c2ccccc2)n1	ZINC000819186742	GH	On-Demand	Anodyne	UL80	18	40
O=C(NCc1ncn(-c2ccccc2)n1)c1ccnc(-n2ccnc2)c1	ZINC000819186743	ED	On-Demand	Anodyne	NOS2	63	34
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186745	GG	On-Demand	Anodyne	P2RX7	21	47
NS(=O)(=O)c1cc(C(=O)NCc2ncn(-c3ccccc3)n2)ccc1F	ZINC000819186746	GC	On-Demand	Anodyne	CA2	30	41
NS(=O)(=O)c1cc(C(=O)NCc2ncn(-c3ccccc3)n2)ccc1F	ZINC000819186746	GC	On-Demand	Anodyne	CA1	17	41
NS(=O)(=O)c1cc(C(=O)NCc2ncn(-c3ccccc3)n2)ccc1F	ZINC000819186746	GC	On-Demand	Anodyne	CA4	20	41
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819186757	IF	On-Demand	Anodyne	EPHX2	17	41
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819186757	IF	On-Demand	Anodyne	NAMPT	33	44
O=C(Cn1cccc(C(F)(F)F)c1=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186760	GD	On-Demand	Anodyne	F2	34	42
C#Cc1ccccc1CC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186761	DE	On-Demand	Mild	P2RX7	16	42
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819186774	ID	On-Demand	Anodyne	NR1H4	17	43
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819186774	ID	On-Demand	Anodyne	NAMPT	21	41
NS(=O)(=O)c1cc(C(=O)NCc2ncn(-c3ccccc3)n2)ccc1Cl	ZINC000819186775	GD	On-Demand	Anodyne	CA2	39	57
NS(=O)(=O)c1cc(C(=O)NCc2ncn(-c3ccccc3)n2)ccc1Cl	ZINC000819186775	GD	On-Demand	Anodyne	CA6	22	47
NS(=O)(=O)c1cc(C(=O)NCc2ncn(-c3ccccc3)n2)ccc1Cl	ZINC000819186775	GD	On-Demand	Anodyne	CA1	27	57
NS(=O)(=O)c1cc(C(=O)NCc2ncn(-c3ccccc3)n2)ccc1Cl	ZINC000819186775	GD	On-Demand	Anodyne	CA7	29	52
NS(=O)(=O)c1cc(C(=O)NCc2ncn(-c3ccccc3)n2)ccc1Cl	ZINC000819186775	GD	On-Demand	Anodyne	CA13	47	52
NS(=O)(=O)c1cc(C(=O)NCc2ncn(-c3ccccc3)n2)ccc1Cl	ZINC000819186775	GD	On-Demand	Anodyne	CA4	28	57
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000819186786	IF	On-Demand	Anodyne	NAMPT	38	44
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000819186786	IF	On-Demand	Anodyne	RPA1	41	39
CC(C)(C(=O)NCc1ncn(-c2ccccc2)n1)C1CCCCC1	ZINC000819186805	EG	On-Demand	Anodyne	AMY2	48	34
O=C(C#Cc1ccc2c(c1)OCO2)NCc1ncn(-c2ccccc2)n1	ZINC000819186807	ED	On-Demand	Mild	NOS2	44	32
COc1cccc(C2=NO[C@@H](C(=O)NCc3ncn(-c4ccccc4)n3)C2)c1	ZINC000819186814	GE	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C2=NO[C@@H](C(=O)NCc3ncn(-c4ccccc4)n3)C2)c1	ZINC000819186814	GE	On-Demand	Anodyne	CPT1A	41	33
COc1cccc(C2=NO[C@@H](C(=O)NCc3ncn(-c4ccccc4)n3)C2)c1	ZINC000819186814	GE	On-Demand	Anodyne	LUCI_PHOPY	33	46
COc1cccc(C2=NO[C@H](C(=O)NCc3ncn(-c4ccccc4)n3)C2)c1	ZINC000819186815	GE	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C2=NO[C@H](C(=O)NCc3ncn(-c4ccccc4)n3)C2)c1	ZINC000819186815	GE	On-Demand	Anodyne	CPT1A	41	33
COc1cccc(C2=NO[C@H](C(=O)NCc3ncn(-c4ccccc4)n3)C2)c1	ZINC000819186815	GE	On-Demand	Anodyne	LUCI_PHOPY	33	46
C[C@H](CC(=O)NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819186820	IH	On-Demand	Anodyne	GPR119	22	45
C[C@H](CC(=O)NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819186821	IH	On-Demand	Anodyne	GPR119	22	45
C[C@@H](CC(=O)NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819186822	IH	On-Demand	Anodyne	GPR119	22	45
C[C@@H](CC(=O)NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000819186823	IH	On-Demand	Anodyne	GPR119	22	45
O=S(=O)(NCCNC[C@@H](O)c1c(F)cccc1F)c1ccc(Cl)s1	ZINC000819186860	GE	On-Demand	Anodyne	CCR4	45	36
O=S(=O)(NCCNC[C@H](O)c1c(F)cccc1F)c1ccc(Cl)s1	ZINC000819186861	GE	On-Demand	Anodyne	CCR4	45	36
O=S(=O)(NCCNC[C@@H](O)c1cccc(Cl)c1)c1ccc(Cl)s1	ZINC000819186862	GF	On-Demand	Anodyne	ADRB1	46	47
O=S(=O)(NCCNC[C@@H](O)c1cccc(Cl)c1)c1ccc(Cl)s1	ZINC000819186862	GF	On-Demand	Anodyne	ADRB3	64	47
O=S(=O)(NCCNC[C@@H](O)c1cccc(Cl)c1)c1ccc(Cl)s1	ZINC000819186862	GF	On-Demand	Anodyne	CCR4	41	32
O=S(=O)(NCCNC[C@H](O)c1cccc(Cl)c1)c1ccc(Cl)s1	ZINC000819186863	GF	On-Demand	Anodyne	ADRB1	46	47
O=S(=O)(NCCNC[C@H](O)c1cccc(Cl)c1)c1ccc(Cl)s1	ZINC000819186863	GF	On-Demand	Anodyne	ADRB3	64	47
O=S(=O)(NCCNC[C@H](O)c1cccc(Cl)c1)c1ccc(Cl)s1	ZINC000819186863	GF	On-Demand	Anodyne	CCR4	41	32
C[C@H](CC(=O)NCc1ccnc(-n2ccnc2)c1)n1cccn1	ZINC000819186900	DD	On-Demand	Anodyne	NOS2	101	38
C[C@@H](CC(=O)NCc1ccnc(-n2ccnc2)c1)n1cccn1	ZINC000819186901	DD	On-Demand	Anodyne	NOS2	101	38
O[C@@H](CNCC1(C2CC2)CCC1)c1cccc(Cl)c1	ZINC000819186904	CH	On-Demand	Anodyne	ADRB1	38	44
O[C@@H](CNCC1(C2CC2)CCC1)c1cccc(Cl)c1	ZINC000819186904	CH	On-Demand	Anodyne	ADRB3	51	44
O[C@H](CNCC1(C2CC2)CCC1)c1cccc(Cl)c1	ZINC000819186905	CH	On-Demand	Anodyne	ADRB1	38	44
O[C@H](CNCC1(C2CC2)CCC1)c1cccc(Cl)c1	ZINC000819186905	CH	On-Demand	Anodyne	ADRB3	51	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCC(=O)NCc1cccnc1	ZINC000819186910	FD	On-Demand	Anodyne	NAMPT	52	36
CCOc1ccc([C@@H](NCCS(C)(=O)=O)c2cccc(Cl)c2)cc1	ZINC000819186917	FG	On-Demand	Anodyne	ADRB3	27	44
CCC(C)(C)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819186956	CH	On-Demand	Anodyne	ADRB2	25	44
CCC(C)(C)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819186956	CH	On-Demand	Anodyne	ADRB1	27	45
CCC(C)(C)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819186956	CH	On-Demand	Anodyne	ADRB3	98	45
CCC(C)(C)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819186957	CH	On-Demand	Anodyne	ADRB2	25	44
CCC(C)(C)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819186957	CH	On-Demand	Anodyne	ADRB1	27	45
CCC(C)(C)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819186957	CH	On-Demand	Anodyne	ADRB3	98	45
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CC(c2ccccc2)=NO1	ZINC000819186964	EE	On-Demand	Anodyne	LUCI_PHOPY	40	36
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CC(c2ccccc2)=NO1	ZINC000819186965	EE	On-Demand	Anodyne	LUCI_PHOPY	40	36
CC(=O)CCCCCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186977	EF	On-Demand	Anodyne	HDAC10	16	42
CC(=O)CCCCCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186977	EF	On-Demand	Anodyne	HDAC1	25	42
CC(=O)CCCCCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819186977	EF	On-Demand	Anodyne	HDAC6	16	42
O=C(C[C@H](O)c1cccc(F)c1)NCc1ncn(-c2ccccc2)n1	ZINC000819186978	EE	On-Demand	Anodyne	P2RX7	17	42
O=C(C[C@@H](O)c1cccc(F)c1)NCc1ncn(-c2ccccc2)n1	ZINC000819186979	EE	On-Demand	Anodyne	P2RX7	17	42
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)NCc1ncn(-c3ccccc3)n1)=NO2	ZINC000819186981	IE	On-Demand	Anodyne	GPR119	18	50
CC(C)(C)OC(=O)N1CCC(SCC(=O)NCc2ncn(-c3ccccc3)n2)CC1	ZINC000819186983	IG	On-Demand	Anodyne	CCR8	17	41
CC(C)(C)OC(=O)N1CCC(SCC(=O)NCc2ncn(-c3ccccc3)n2)CC1	ZINC000819186983	IG	On-Demand	Anodyne	GPR119	49	43
O=Cc1cccc(OCc2ccccc2C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819186989	HH	On-Demand	Anodyne	OPRL1	15	42
O=Cc1cccc(OCc2ccccc2C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819186989	HH	On-Demand	Anodyne	MT-CYB	47	32
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1	ZINC000819186991	IH	On-Demand	Anodyne	F2	44	39
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1	ZINC000819186991	IH	On-Demand	Anodyne	TMPRSS11D	57	33
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1	ZINC000819186992	IH	On-Demand	Anodyne	F2	44	39
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1	ZINC000819186992	IH	On-Demand	Anodyne	TMPRSS11D	57	33
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1	ZINC000819186993	IH	On-Demand	Anodyne	F2	44	39
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1	ZINC000819186993	IH	On-Demand	Anodyne	TMPRSS11D	57	33
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1	ZINC000819186994	IH	On-Demand	Anodyne	F2	44	39
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1	ZINC000819186994	IH	On-Demand	Anodyne	TMPRSS11D	57	33
NS(=O)(=O)c1ccc(F)c(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819186997	GC	On-Demand	Anodyne	CA2	66	47
NS(=O)(=O)c1ccc(F)c(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819186997	GC	On-Demand	Anodyne	CA1	50	44
NS(=O)(=O)c1ccc(F)c(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819186997	GC	On-Demand	Anodyne	CA5B	49	39
NS(=O)(=O)c1ccc(F)c(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819186997	GC	On-Demand	Anodyne	CA4	53	47
NS(=O)(=O)c1ccc(F)c(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819186997	GC	On-Demand	Anodyne	CA5A	52	39
NS(=O)(=O)c1ccc(F)c(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819186997	GC	On-Demand	Anodyne	CA12	30	44
NS(=O)(=O)c1ccc(F)c(C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819186997	GC	On-Demand	Anodyne	CA9	34	44
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(-c2ccco2)nc2ccccc12	ZINC000819186998	GI	On-Demand	Anodyne	ADORA1	25	45
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(-c2ccco2)nc2ccccc12	ZINC000819186998	GI	On-Demand	Anodyne	ADORA2A	37	45
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(-c2ccco2)nc2ccccc12	ZINC000819186998	GI	On-Demand	Anodyne	TACR3	15	52
O=C(CC12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2)NCc1ncn(-c2ccccc2)n1	ZINC000819187000	II	On-Demand	Anodyne	BOTA	27	41
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000819187027	HE	On-Demand	Anodyne	CYP24A1	28	40
O=C(Cc1ccccc1CO)NCc1ncn(-c2ccccc2)n1	ZINC000819187028	DD	On-Demand	Anodyne	P2RX7	21	42
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819187036	GF	On-Demand	Anodyne	CTSD	29	43
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819187036	GF	On-Demand	Anodyne	PAPA1_CARPA	43	39
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819187036	GF	On-Demand	Anodyne	PGA	21	43
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819187036	GF	On-Demand	Anodyne	REN	43	44
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819187036	GF	On-Demand	Anodyne	PGA5	24	41
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819187036	GF	On-Demand	Anodyne	POLG_HCV1	21	41
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819187036	GF	On-Demand	Anodyne	FPR1	55	36
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819187037	GF	On-Demand	Anodyne	CTSD	29	43
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819187037	GF	On-Demand	Anodyne	PAPA1_CARPA	43	39
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819187037	GF	On-Demand	Anodyne	PGA	21	43
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819187037	GF	On-Demand	Anodyne	REN	43	44
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819187037	GF	On-Demand	Anodyne	PGA5	24	41
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819187037	GF	On-Demand	Anodyne	POLG_HCV1	21	41
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819187037	GF	On-Demand	Anodyne	FPR1	55	36
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NCc2ncn(-c3ccccc3)n2)CC1	ZINC000819187051	HG	On-Demand	Bother	WDR5	32	40
CCCCCCn1nc(C(=O)NCc2ncn(-c3ccccc3)n2)c2ccccc2c1=O	ZINC000819187052	IG	On-Demand	Anodyne	CNR2	19	42
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(-c2ccccc2)cc1	ZINC000819187056	FH	On-Demand	Anodyne	PRNP	43	38
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(-c2ccccc2)cc1	ZINC000819187056	FH	On-Demand	Anodyne	CYP24A1	28	41
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(-c2ccccc2)cc1	ZINC000819187056	FH	On-Demand	Anodyne	LUCI_LUCLA	31	40
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(-c2ccccc2)cc1	ZINC000819187056	FH	On-Demand	Anodyne	RPA1	29	41
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NCc1ncn(-c2ccccc2)n1	ZINC000819187057	ID	On-Demand	Anodyne	GRIN2B	20	44
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)NCc1ncn(-c2ccccc2)n1	ZINC000819187057	ID	On-Demand	Anodyne	TGM2	34	41
CC(C)(C)OC(=O)N1CCN(CCC(=O)NCc2ncn(-c3ccccc3)n2)CC1	ZINC000819187058	HD	On-Demand	Anodyne	HTR7	42	42
CC(C)(C)OC(=O)N1CCN(CCC(=O)NCc2ncn(-c3ccccc3)n2)CC1	ZINC000819187058	HD	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CCC(C(F)(F)C(=O)NCc2ncn(-c3ccccc3)n2)CC1	ZINC000819187065	IG	On-Demand	Anodyne	GPR119	50	42
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(C(F)(F)F)nc1Cl	ZINC000819187084	GG	On-Demand	Anodyne	CARM1	41	35
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(S(=O)(=O)N2CCCC2)o1	ZINC000819187085	HD	On-Demand	Anodyne	LPL	45	36
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(S(=O)(=O)N2CCCC2)o1	ZINC000819187085	HD	On-Demand	Anodyne	NAMPT	58	42
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819187111	EC	On-Demand	Bother	ADRB3	27	41
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819187112	EC	On-Demand	Bother	ADRB3	27	41
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819187113	EC	On-Demand	Bother	ADRB3	27	41
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819187114	EC	On-Demand	Bother	ADRB3	27	41
O=C(/C=C/[C@H]1CCCO1)N1CCC(N2CCc3ccccc3C2)CC1	ZINC000819187145	EF	On-Demand	Anodyne	L3MBTL3	79	37
O=C(/C=C\[C@@H]1CCCO1)N1CCC(N2CCc3ccccc3C2)CC1	ZINC000819187146	EF	On-Demand	Anodyne	L3MBTL3	79	37
O=C(/C=C/[C@@H]1CCCO1)N1CCC(N2CCc3ccccc3C2)CC1	ZINC000819187147	EF	On-Demand	Anodyne	L3MBTL3	79	37
O=C(/C=C\[C@H]1CCCO1)N1CCC(N2CCc3ccccc3C2)CC1	ZINC000819187148	EF	On-Demand	Anodyne	L3MBTL3	79	37
O=C(NC1CCN(CC2CCCCC2)CC1)c1coc(=O)c2ccccc12	ZINC000819187155	FH	On-Demand	Anodyne	CNR1	26	45
O=C(NC1CCN(CC2CCCCC2)CC1)c1coc(=O)c2ccccc12	ZINC000819187155	FH	On-Demand	Anodyne	DRD4	20	45
O=C(NC1CCN(CC2CCCCC2)CC1)c1coc(=O)c2ccccc12	ZINC000819187155	FH	On-Demand	Anodyne	INHA	46	37
O=C(NC1CCN(CC2CCCCC2)CC1)c1coc(=O)c2ccccc12	ZINC000819187155	FH	On-Demand	Anodyne	HTR4	44	37
O=C(NC1CCN(CC2CCCCC2)CC1)c1coc(=O)c2ccccc12	ZINC000819187155	FH	On-Demand	Anodyne	CNR2	33	45
O=C(NC1CCN(CC2CCCCC2)CC1)c1coc(=O)c2ccccc12	ZINC000819187155	FH	On-Demand	Anodyne	SIGMAR1	26	41
O=C(NC1CCN(CC2CCCCC2)CC1)c1coc(=O)c2ccccc12	ZINC000819187155	FH	On-Demand	Anodyne	CCR8	54	46
CC(C)CN1CCC[C@@H]1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819187158	GF	On-Demand	Anodyne	GPR119	20	41
CC(C)CN1CCC[C@@H]1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819187159	GF	On-Demand	Anodyne	GPR119	20	41
C=CCC1(C(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)CCOCC1	ZINC000819187173	FI	On-Demand	Mild	AKR1C3	16	40
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819187183	FD	On-Demand	Anodyne	ADRB3	15	40
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819187184	FD	On-Demand	Anodyne	ADRB3	15	40
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819187185	FD	On-Demand	Anodyne	ADRB3	15	40
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819187186	FD	On-Demand	Anodyne	ADRB3	15	40
CC(=O)Nc1cccc(CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187208	FG	On-Demand	Anodyne	CHRM1	20	48
CC(=O)Nc1cccc(CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187208	FG	On-Demand	Anodyne	DRD2	16	44
CC(=O)Nc1cccc(CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187208	FG	On-Demand	Anodyne	DRD4	29	44
CC(=O)Nc1cccc(CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187208	FG	On-Demand	Anodyne	HTR1D	23	41
CC(=O)Nc1cccc(CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187208	FG	On-Demand	Anodyne	HTR1B	18	40
CC(=O)Nc1cccc(CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187208	FG	On-Demand	Anodyne	DRD3	15	42
CC(=O)Nc1cccc(CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187208	FG	On-Demand	Anodyne	OPRK1	24	41
CC(=O)Nc1cccc(CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187208	FG	On-Demand	Anodyne	CHRM3	20	48
CC(=O)Nc1cccc(CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187208	FG	On-Demand	Anodyne	SIGMAR1	35	51
CC(=O)Nc1cccc(CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187208	FG	On-Demand	Anodyne	CCR3	90	46
CC(=O)Nc1cccc(CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187208	FG	On-Demand	Anodyne	FAAH	22	42
CC(=O)Nc1cccc(CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187208	FG	On-Demand	Anodyne	CCR2	24	40
CC(=O)Nc1cccc(CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187208	FG	On-Demand	Anodyne	EPHX2	38	49
CC(=O)Nc1cccc(CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187208	FG	On-Demand	Anodyne	CXCR3	16	44
CC(=O)Nc1cccc(CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187208	FG	On-Demand	Anodyne	MCHR1	51	46
CC(=O)Nc1cccc(CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187208	FG	On-Demand	Anodyne	CCR8	19	44
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819187217	DC	On-Demand	Anodyne	SLC6A3	15	41
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819187217	DC	On-Demand	Anodyne	ADRB3	21	46
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819187218	DC	On-Demand	Anodyne	SLC6A3	15	41
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819187218	DC	On-Demand	Anodyne	ADRB3	21	46
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819187219	DC	On-Demand	Anodyne	SLC6A3	15	41
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819187219	DC	On-Demand	Anodyne	ADRB3	21	46
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819187220	DC	On-Demand	Anodyne	SLC6A3	15	41
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819187220	DC	On-Demand	Anodyne	ADRB3	21	46
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819187228	GD	On-Demand	Anodyne	ADRB2	16	41
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819187228	GD	On-Demand	Anodyne	ADRB1	21	41
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819187228	GD	On-Demand	Anodyne	ADRB3	42	41
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(Br)c2)C1	ZINC000819187229	GD	On-Demand	Anodyne	ADRB2	16	41
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(Br)c2)C1	ZINC000819187229	GD	On-Demand	Anodyne	ADRB1	21	41
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(Br)c2)C1	ZINC000819187229	GD	On-Demand	Anodyne	ADRB3	42	41
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2cccc(Br)c2)C1	ZINC000819187230	GD	On-Demand	Anodyne	ADRB2	16	41
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2cccc(Br)c2)C1	ZINC000819187230	GD	On-Demand	Anodyne	ADRB1	21	41
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2cccc(Br)c2)C1	ZINC000819187230	GD	On-Demand	Anodyne	ADRB3	42	41
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819187231	GD	On-Demand	Anodyne	ADRB2	16	41
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819187231	GD	On-Demand	Anodyne	ADRB1	21	41
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819187231	GD	On-Demand	Anodyne	ADRB3	42	41
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2cccc3ccccc23)C1	ZINC000819187233	ED	On-Demand	Anodyne	HTR4	45	39
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2cccc3ccccc23)C1	ZINC000819187234	ED	On-Demand	Anodyne	HTR4	45	39
O=C(CCc1cccc(OC(F)F)c1)N1CCC(c2cc3ccccc3[nH]2)CC1	ZINC000819187247	GK	On-Demand	Anodyne	CYP51A1	21	40
O=C(CCc1cccc(OC(F)F)c1)N1CCC(c2cc3ccccc3[nH]2)CC1	ZINC000819187247	GK	On-Demand	Anodyne	C3AR1	38	40
O[C@H](CNCC1(C2CC2)CC1)c1cccnc1	ZINC000819187254	BD	On-Demand	Anodyne	ADRB2	20	42
O[C@H](CNCC1(C2CC2)CC1)c1cccnc1	ZINC000819187254	BD	On-Demand	Anodyne	ADRB1	22	41
O[C@H](CNCC1(C2CC2)CC1)c1cccnc1	ZINC000819187254	BD	On-Demand	Anodyne	ADRB3	88	43
O[C@@H](CNCC1(C2CC2)CC1)c1cccnc1	ZINC000819187255	BD	On-Demand	Anodyne	ADRB2	20	42
O[C@@H](CNCC1(C2CC2)CC1)c1cccnc1	ZINC000819187255	BD	On-Demand	Anodyne	ADRB1	22	41
O[C@@H](CNCC1(C2CC2)CC1)c1cccnc1	ZINC000819187255	BD	On-Demand	Anodyne	ADRB3	88	43
O=C(NC1CCN(C(=O)C(F)=C2CCC2)CC1)C1CCCCC1	ZINC000819187279	DG	On-Demand	Anodyne	EPHX2	24	46
COc1cccc([S@@](=O)CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187281	GF	On-Demand	Anodyne	DRD4	43	32
COc1cccc([S@@](=O)CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187281	GF	On-Demand	Anodyne	DRD3	16	41
COc1cccc([S@@](=O)CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187281	GF	On-Demand	Anodyne	CCR3	36	43
COc1cccc([S@@](=O)CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187281	GF	On-Demand	Anodyne	MTNR1A	19	44
COc1cccc([S@@](=O)CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187281	GF	On-Demand	Anodyne	MTNR1B	25	44
COc1cccc([S@@](=O)CC(=O)NC2CCN(CC3CCCCC3)CC2)c1	ZINC000819187281	GF	On-Demand	Anodyne	MCHR1	19	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1nc(-c3cccs3)no1)C2	ZINC000819187282	GE	On-Demand	Anodyne	ETHR	31	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1nc(-c3cccs3)no1)C2	ZINC000819187283	GE	On-Demand	Anodyne	ETHR	31	41
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819187284	GD	On-Demand	Anodyne	ADRB3	17	40
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819187285	GD	On-Demand	Anodyne	ADRB3	17	40
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819187286	GD	On-Demand	Anodyne	ADRB3	17	40
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819187287	GD	On-Demand	Anodyne	ADRB3	17	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(C(=O)NC2CCCCC2)CC1	ZINC000819187290	GF	On-Demand	Anodyne	EPHX2	24	46
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819187309	FD	On-Demand	Anodyne	RBP4	49	32
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819187309	FD	On-Demand	Anodyne	SFRP1	52	34
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819187309	FD	On-Demand	Anodyne	RORC	15	41
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819187310	FD	On-Demand	Anodyne	RBP4	49	32
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819187310	FD	On-Demand	Anodyne	SFRP1	52	34
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819187310	FD	On-Demand	Anodyne	RORC	15	41
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819187311	FD	On-Demand	Anodyne	RBP4	49	32
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819187311	FD	On-Demand	Anodyne	SFRP1	52	34
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819187311	FD	On-Demand	Anodyne	RORC	15	41
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819187312	FD	On-Demand	Anodyne	RBP4	49	32
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819187312	FD	On-Demand	Anodyne	SFRP1	52	34
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819187312	FD	On-Demand	Anodyne	RORC	15	41
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819187326	GD	On-Demand	Anodyne	ADRB3	22	40
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819187326	GD	On-Demand	Anodyne	EPHX2	25	45
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819187327	GD	On-Demand	Anodyne	ADRB3	22	40
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819187327	GD	On-Demand	Anodyne	EPHX2	25	45
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819187328	GD	On-Demand	Anodyne	ADRB3	22	40
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819187328	GD	On-Demand	Anodyne	EPHX2	25	45
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819187329	GD	On-Demand	Anodyne	ADRB3	22	40
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819187329	GD	On-Demand	Anodyne	EPHX2	25	45
O=C(NC1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1)C1CCCCC1	ZINC000819187334	EE	On-Demand	Anodyne	EPHX2	20	44
O=C(NC1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1)C1CCCCC1	ZINC000819187335	EE	On-Demand	Anodyne	EPHX2	20	44
O=C(NC1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1)C1CCCCC1	ZINC000819187336	EE	On-Demand	Anodyne	EPHX2	20	44
O=C(NC1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1)C1CCCCC1	ZINC000819187337	EE	On-Demand	Anodyne	EPHX2	20	44
O=C(Cc1ccc(-n2cnnc2)cc1)NC1CCN(CC2CCCCC2)CC1	ZINC000819187341	GF	On-Demand	Anodyne	HTR1D	47	39
O=C(Cc1ccc(-n2cnnc2)cc1)NC1CCN(CC2CCCCC2)CC1	ZINC000819187341	GF	On-Demand	Anodyne	HTR1B	40	39
O=C(Cc1ccc(-n2cnnc2)cc1)NC1CCN(CC2CCCCC2)CC1	ZINC000819187341	GF	On-Demand	Anodyne	SIGMAR1	24	46
O=C(Cc1ccc(-n2cnnc2)cc1)NC1CCN(CC2CCCCC2)CC1	ZINC000819187341	GF	On-Demand	Anodyne	CCR3	19	40
O=C(Cc1ccc(-n2cnnc2)cc1)NC1CCN(CC2CCCCC2)CC1	ZINC000819187341	GF	On-Demand	Anodyne	MCHR1	20	40
O[C@@H](CNCCOc1ccccc1Cl)c1cccc(F)c1	ZINC000819187358	DG	On-Demand	Anodyne	ADRB2	28	40
O[C@@H](CNCCOc1ccccc1Cl)c1cccc(F)c1	ZINC000819187358	DG	On-Demand	Anodyne	ADRB1	44	45
O[C@@H](CNCCOc1ccccc1Cl)c1cccc(F)c1	ZINC000819187358	DG	On-Demand	Anodyne	ADRB3	50	45
O[C@H](CNCCOc1ccccc1Cl)c1cccc(F)c1	ZINC000819187359	DG	On-Demand	Anodyne	ADRB2	28	40
O[C@H](CNCCOc1ccccc1Cl)c1cccc(F)c1	ZINC000819187359	DG	On-Demand	Anodyne	ADRB1	44	45
O[C@H](CNCCOc1ccccc1Cl)c1cccc(F)c1	ZINC000819187359	DG	On-Demand	Anodyne	ADRB3	50	45
CC(=O)Nc1cccc(CC(=O)N2CCC(n3cccn3)CC2)c1	ZINC000819187364	EE	On-Demand	Anodyne	CCR3	51	37
CC(=O)Nc1cccc(CC(=O)N2CCC(n3cccn3)CC2)c1	ZINC000819187364	EE	On-Demand	Anodyne	EPHX2	23	43
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819187371	FD	On-Demand	Anodyne	ADRB2	15	46
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819187371	FD	On-Demand	Anodyne	ADRB3	24	46
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819187372	FD	On-Demand	Anodyne	ADRB2	15	46
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819187372	FD	On-Demand	Anodyne	ADRB3	24	46
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819187373	FD	On-Demand	Anodyne	ADRB2	15	46
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819187373	FD	On-Demand	Anodyne	ADRB3	24	46
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819187374	FD	On-Demand	Anodyne	ADRB2	15	46
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819187374	FD	On-Demand	Anodyne	ADRB3	24	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000819187375	FD	On-Demand	Anodyne	CCKAR	22	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000819187376	FD	On-Demand	Anodyne	CCKAR	22	42
O=C(Cc1nsc2ccccc12)NC1CCN(CC2CCCCC2)CC1	ZINC000819187381	FH	On-Demand	Anodyne	SIGMAR1	28	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCOC2)CC1	ZINC000819187387	DD	On-Demand	Anodyne	GPR119	26	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCOC2)CC1	ZINC000819187388	DD	On-Demand	Anodyne	GPR119	26	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCOC2)CC1	ZINC000819187389	DD	On-Demand	Anodyne	GPR119	26	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCOC2)CC1	ZINC000819187390	DD	On-Demand	Anodyne	GPR119	26	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccccc2Cl)cc1	ZINC000819187430	FE	On-Demand	Anodyne	ADRB2	38	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccccc2Cl)cc1	ZINC000819187430	FE	On-Demand	Anodyne	ADRB1	44	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccccc2Cl)cc1	ZINC000819187430	FE	On-Demand	Anodyne	ADRB3	74	42
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccccc2Cl)cc1	ZINC000819187431	FE	On-Demand	Anodyne	ADRB2	38	43
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccccc2Cl)cc1	ZINC000819187431	FE	On-Demand	Anodyne	ADRB1	44	42
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccccc2Cl)cc1	ZINC000819187431	FE	On-Demand	Anodyne	ADRB3	74	42
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(n2cccn2)CC1	ZINC000819187456	ED	On-Demand	Anodyne	KCNJ1	58	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCOC1	ZINC000819187457	FD	On-Demand	Anodyne	CTSD	120	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCOC1	ZINC000819187457	FD	On-Demand	Anodyne	PGC	71	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCOC1	ZINC000819187457	FD	On-Demand	Anodyne	PAPA1_CARPA	32	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCOC1	ZINC000819187457	FD	On-Demand	Anodyne	CTSL	15	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCOC1	ZINC000819187457	FD	On-Demand	Anodyne	BACE2	55	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCOC1	ZINC000819187457	FD	On-Demand	Anodyne	REN	96	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCOC1	ZINC000819187457	FD	On-Demand	Anodyne	REN1	23	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCOC1	ZINC000819187457	FD	On-Demand	Anodyne	BACE1	92	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCOC1	ZINC000819187457	FD	On-Demand	Anodyne	CYP3A5	21	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCOC1	ZINC000819187457	FD	On-Demand	Anodyne	FPR1	51	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCOC1	ZINC000819187457	FD	On-Demand	Anodyne	PLM1_PLAFA	31	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCOC1	ZINC000819187458	FD	On-Demand	Anodyne	CTSD	120	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCOC1	ZINC000819187458	FD	On-Demand	Anodyne	PGC	71	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCOC1	ZINC000819187458	FD	On-Demand	Anodyne	PAPA1_CARPA	32	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCOC1	ZINC000819187458	FD	On-Demand	Anodyne	CTSL	15	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCOC1	ZINC000819187458	FD	On-Demand	Anodyne	BACE2	55	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCOC1	ZINC000819187458	FD	On-Demand	Anodyne	REN	96	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCOC1	ZINC000819187458	FD	On-Demand	Anodyne	REN1	23	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCOC1	ZINC000819187458	FD	On-Demand	Anodyne	BACE1	92	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCOC1	ZINC000819187458	FD	On-Demand	Anodyne	CYP3A5	21	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCOC1	ZINC000819187458	FD	On-Demand	Anodyne	FPR1	51	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCOC1	ZINC000819187458	FD	On-Demand	Anodyne	PLM1_PLAFA	31	40
O[C@@H](CNCC1(C2CC2)CC1)c1cccc(Cl)c1	ZINC000819187467	CG	On-Demand	Anodyne	ADRB1	38	44
O[C@@H](CNCC1(C2CC2)CC1)c1cccc(Cl)c1	ZINC000819187467	CG	On-Demand	Anodyne	ADRB3	50	46
O[C@H](CNCC1(C2CC2)CC1)c1cccc(Cl)c1	ZINC000819187468	CG	On-Demand	Anodyne	ADRB1	38	44
O[C@H](CNCC1(C2CC2)CC1)c1cccc(Cl)c1	ZINC000819187468	CG	On-Demand	Anodyne	ADRB3	50	46
CC(=O)Nc1cccc(CC(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)c1	ZINC000819187469	GI	On-Demand	Anodyne	CYP51A1	21	41
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819187475	FD	On-Demand	Anodyne	ADRB1	17	41
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819187475	FD	On-Demand	Anodyne	ADRB3	31	41
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819187475	FD	On-Demand	Anodyne	CACNA1B	55	35
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819187475	FD	On-Demand	Anodyne	CCR2	48	35
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819187476	FD	On-Demand	Anodyne	ADRB1	17	41
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819187476	FD	On-Demand	Anodyne	ADRB3	31	41
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819187476	FD	On-Demand	Anodyne	CACNA1B	55	35
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819187476	FD	On-Demand	Anodyne	CCR2	48	35
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819187477	FD	On-Demand	Anodyne	ADRB1	17	41
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819187477	FD	On-Demand	Anodyne	ADRB3	31	41
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819187477	FD	On-Demand	Anodyne	CACNA1B	55	35
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819187477	FD	On-Demand	Anodyne	CCR2	48	35
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819187478	FD	On-Demand	Anodyne	ADRB1	17	41
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819187478	FD	On-Demand	Anodyne	ADRB3	31	41
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819187478	FD	On-Demand	Anodyne	CACNA1B	55	35
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819187478	FD	On-Demand	Anodyne	CCR2	48	35
COc1cccc([S@@](=O)CC(=O)NNC(=O)NC2CCCC2)c1	ZINC000819187488	ED	On-Demand	Reactive	FAAH	20	40
COc1cccc([S@@](=O)CC(=O)NNC(=O)NC2CCCC2)c1	ZINC000819187488	ED	On-Demand	Reactive	EPHX2	16	44
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819187513	EC	On-Demand	Anodyne	ADAMTS4	59	33
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819187514	EC	On-Demand	Anodyne	ADAMTS4	59	33
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819187515	EC	On-Demand	Anodyne	ADAMTS4	59	33
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819187516	EC	On-Demand	Anodyne	ADAMTS4	59	33
O=C(NNC(=O)c1cc(-c2ccc3ccccc3c2)[nH]n1)NC1CCCC1	ZINC000819187541	FG	On-Demand	Reactive	FAAH	18	44
O=C(NNC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F)NC1CCCC1	ZINC000819187555	EF	On-Demand	Reactive	EPHX2	19	44
CC(C)CN1CCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819187560	CD	On-Demand	Anodyne	ADRB3	84	43
CC(C)CN1CCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819187561	CD	On-Demand	Anodyne	ADRB3	84	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(N2CCc3ccccc3C2)CC1	ZINC000819187569	GF	On-Demand	Anodyne	PREP	19	42
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819187589	ED	On-Demand	Anodyne	ADRB3	24	42
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819187590	ED	On-Demand	Anodyne	ADRB3	24	42
COCCN(CCCc1ccccc1)C(=O)/C=C/[C@@H]1CCCO1	ZINC000819187593	DF	On-Demand	Anodyne	AMY2	43	30
COCCN(CCCc1ccccc1)C(=O)/C=C/[C@H]1CCCO1	ZINC000819187594	DF	On-Demand	Anodyne	AMY2	43	30
COCCN(CCCc1ccccc1)C(=O)/C=C\[C@@H]1CCCO1	ZINC000819187595	DF	On-Demand	Anodyne	AMY2	43	30
COCCN(CCCc1ccccc1)C(=O)/C=C\[C@H]1CCCO1	ZINC000819187596	DF	On-Demand	Anodyne	AMY2	43	30
O=C(CCc1cccc(OC(F)F)c1)NC1CCN(CC2CCCCC2)CC1	ZINC000819187618	GI	On-Demand	Anodyne	HRH2	22	41
O=C(CCc1cccc(OC(F)F)c1)NC1CCN(CC2CCCCC2)CC1	ZINC000819187618	GI	On-Demand	Anodyne	SIGMAR1	28	42
O=C(CCc1cccc(OC(F)F)c1)NC1CCN(CC2CCCCC2)CC1	ZINC000819187618	GI	On-Demand	Anodyne	CCR3	45	40
O=C(CCc1cccc(OC(F)F)c1)NC1CCN(CC2CCCCC2)CC1	ZINC000819187618	GI	On-Demand	Anodyne	C3AR1	41	39
O=C(CCc1cccc(OC(F)F)c1)NC1CCN(CC2CCCCC2)CC1	ZINC000819187618	GI	On-Demand	Anodyne	FAAH	23	45
O=C(CCc1cccc(OC(F)F)c1)NC1CCN(CC2CCCCC2)CC1	ZINC000819187618	GI	On-Demand	Anodyne	MCHR1	20	41
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CCN(S(C)(=O)=O)C1	ZINC000819187644	ED	On-Demand	Anodyne	ADAMTS4	45	36
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CCN(S(C)(=O)=O)C1	ZINC000819187647	ED	On-Demand	Anodyne	ADAMTS4	45	36
CC(=O)Nc1cccc(CC(=O)NNC(=O)NC2CCCC2)c1	ZINC000819187673	DD	On-Demand	Reactive	SIGMAR1	18	40
CC(=O)Nc1cccc(CC(=O)NNC(=O)NC2CCCC2)c1	ZINC000819187673	DD	On-Demand	Reactive	FAAH	18	46
CC(=O)Nc1cccc(CC(=O)NNC(=O)NC2CCCC2)c1	ZINC000819187673	DD	On-Demand	Reactive	EPHX2	40	51
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819187674	FD	On-Demand	Anodyne	CACNA1I	41	33
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819187675	FD	On-Demand	Anodyne	CACNA1I	41	33
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819187676	FD	On-Demand	Anodyne	CACNA1I	41	33
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819187677	FD	On-Demand	Anodyne	CACNA1I	41	33
Cc1ccccc1[C@@H](O)CNCCOc1ccccc1Cl	ZINC000819187693	DG	On-Demand	Anodyne	ADRB2	22	46
COc1ccc(OC)c([C@H](O)CNC2CCC(N3CCC(C)CC3)CC2)c1	ZINC000819187715	GG	On-Demand	Anodyne	ADRA1D	22	41
COc1ccc(OC)c([C@H](O)CNC2CCC(N3CCC(C)CC3)CC2)c1	ZINC000819187715	GG	On-Demand	Anodyne	ADRA1A	16	41
COc1ccc(OC)c([C@H](O)CNC2CCC(N3CCC(C)CC3)CC2)c1	ZINC000819187715	GG	On-Demand	Anodyne	ADRA1B	18	41
O=C(Cc1ccc(-n2cnnc2)cc1)NNC(=O)NC1CCCC1	ZINC000819187742	ED	On-Demand	Reactive	EPHX2	21	41
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(c2cc3ccccc3[nH]2)CC1	ZINC000819187744	GH	On-Demand	Anodyne	HTR1D	65	37
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(c2cc3ccccc3[nH]2)CC1	ZINC000819187744	GH	On-Demand	Anodyne	HTR1B	53	36
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(c2cc3ccccc3[nH]2)CC1	ZINC000819187744	GH	On-Demand	Anodyne	KCNJ1	60	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(NC(=O)C2CCCCC2)CC1	ZINC000819187754	GF	On-Demand	Anodyne	EPHX2	22	42
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819187758	DC	On-Demand	Anodyne	ADRB2	17	45
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819187758	DC	On-Demand	Anodyne	ADRB1	20	41
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819187758	DC	On-Demand	Anodyne	ADRB3	40	45
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819187759	DC	On-Demand	Anodyne	ADRB2	17	45
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819187759	DC	On-Demand	Anodyne	ADRB1	20	41
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819187759	DC	On-Demand	Anodyne	ADRB3	40	45
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819187760	DC	On-Demand	Anodyne	ADRB2	17	45
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819187760	DC	On-Demand	Anodyne	ADRB1	20	41
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819187760	DC	On-Demand	Anodyne	ADRB3	40	45
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819187761	DC	On-Demand	Anodyne	ADRB2	17	45
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819187761	DC	On-Demand	Anodyne	ADRB1	20	41
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819187761	DC	On-Demand	Anodyne	ADRB3	40	45
O=[N+]([O-])c1cccc([C@@H](O)CNCC2(C3CC3)CC2)c1	ZINC000819187762	CE	On-Demand	Bother	CACNA1D	52	34
O=[N+]([O-])c1cccc([C@H](O)CNCC2(C3CC3)CC2)c1	ZINC000819187763	CE	On-Demand	Bother	CACNA1D	52	34
O[C@@H](CNCCOc1ccccc1Cl)c1ccc(Cl)cc1	ZINC000819187808	EH	On-Demand	Anodyne	ADRB2	25	44
O[C@@H](CNCCOc1ccccc1Cl)c1ccc(Cl)cc1	ZINC000819187808	EH	On-Demand	Anodyne	ADRB1	37	43
O[C@@H](CNCCOc1ccccc1Cl)c1ccc(Cl)cc1	ZINC000819187808	EH	On-Demand	Anodyne	ADRB3	37	43
O=C(NC1CCCCC1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819187814	DG	On-Demand	Anodyne	EPHX2	27	52
O=C(NC1CCN(c2nc3ccccc3s2)CC1)C(F)=C1CCC1	ZINC000819187849	EH	On-Demand	Anodyne	LTA4H	22	41
O=C(CCc1cccc(OC(F)F)c1)NNC(=O)NC1CCCC1	ZINC000819187852	EE	On-Demand	Reactive	HRH2	15	42
O=C(CCc1cccc(OC(F)F)c1)NNC(=O)NC1CCCC1	ZINC000819187852	EE	On-Demand	Reactive	FAAH	22	47
O=C(CCc1cccc(OC(F)F)c1)NNC(=O)NC1CCCC1	ZINC000819187852	EE	On-Demand	Reactive	EPHX2	23	41
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(F)c(Br)c2)C1	ZINC000819187856	GD	On-Demand	Anodyne	ADRB3	18	46
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(F)c(Br)c2)C1	ZINC000819187857	GD	On-Demand	Anodyne	ADRB3	18	46
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(F)c(Br)c2)C1	ZINC000819187858	GD	On-Demand	Anodyne	ADRB3	18	46
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2ccc(F)c(Br)c2)C1	ZINC000819187859	GD	On-Demand	Anodyne	ADRB3	18	46
C=CCCn1cc(C(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)nn1	ZINC000819187871	EG	On-Demand	Mild	AKR1C3	17	41
O=C(C(F)=C1CCC1)N1CCN2CCCC[C@@H]2C1	ZINC000819187872	CE	On-Demand	Anodyne	L3MBTL3	61	40
O=C(C(F)=C1CCC1)N1CCN2CCCC[C@H]2C1	ZINC000819187873	CE	On-Demand	Anodyne	L3MBTL3	61	40
C[C@@H]1CCCC[C@H]1C(=O)N1CCC(c2cc3ccccc3[nH]2)CC1	ZINC000819187906	DJ	On-Demand	Anodyne	AKR1C3	17	40
C[C@@H]1CCCC[C@@H]1C(=O)N1CCC(c2cc3ccccc3[nH]2)CC1	ZINC000819187908	DJ	On-Demand	Anodyne	AKR1C3	17	40
CC(C)CN1CCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819187925	DG	On-Demand	Anodyne	ADRB1	34	40
CC(C)CN1CCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819187925	DG	On-Demand	Anodyne	ADRB3	49	40
CC(C)CN1CCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819187925	DG	On-Demand	Anodyne	CYP3A4	41	33
CC(C)CN1CCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819187926	DG	On-Demand	Anodyne	ADRB1	34	40
CC(C)CN1CCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819187926	DG	On-Demand	Anodyne	ADRB3	49	40
CC(C)CN1CCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819187926	DG	On-Demand	Anodyne	CYP3A4	41	33
O=C(/C=C/[C@@H]1CCCO1)N1CCN2CCCC[C@@H]2C1	ZINC000819187930	CD	On-Demand	Anodyne	L3MBTL3	49	39
O=C(/C=C/[C@@H]1CCCO1)N1CCN2CCCC[C@H]2C1	ZINC000819187931	CD	On-Demand	Anodyne	L3MBTL3	49	39
O=C(/C=C\[C@@H]1CCCO1)N1CCN2CCCC[C@H]2C1	ZINC000819187932	CD	On-Demand	Anodyne	L3MBTL3	49	39
O=C(/C=C\[C@@H]1CCCO1)N1CCN2CCCC[C@@H]2C1	ZINC000819187933	CD	On-Demand	Anodyne	L3MBTL3	49	39
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819187937	FH	On-Demand	Anodyne	EGFR	32	47
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819187937	FH	On-Demand	Anodyne	ERBB2	52	46
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819187937	FH	On-Demand	Anodyne	GRM4	45	42
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819187937	FH	On-Demand	Anodyne	ERBB4	15	43
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819187938	FH	On-Demand	Anodyne	EGFR	32	47
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819187938	FH	On-Demand	Anodyne	ERBB2	52	46
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819187938	FH	On-Demand	Anodyne	GRM4	45	42
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819187938	FH	On-Demand	Anodyne	ERBB4	15	43
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819187939	FH	On-Demand	Anodyne	EGFR	32	47
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819187939	FH	On-Demand	Anodyne	ERBB2	52	46
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819187939	FH	On-Demand	Anodyne	GRM4	45	42
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819187939	FH	On-Demand	Anodyne	ERBB4	15	43
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819187940	FH	On-Demand	Anodyne	EGFR	32	47
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819187940	FH	On-Demand	Anodyne	ERBB2	52	46
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819187940	FH	On-Demand	Anodyne	GRM4	45	42
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819187940	FH	On-Demand	Anodyne	ERBB4	15	43
O=C(CCc1cccc(OC(F)F)c1)N1CCC(n2cccn2)CC1	ZINC000819187941	EG	On-Demand	Anodyne	C3AR1	42	42
C#CCN(Cc1ccc(F)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819187979	GG	On-Demand	Mild	PAPA1_CARPA	48	55
C#CCN(Cc1ccc(F)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819187979	GG	On-Demand	Mild	CTSK	17	40
C#CCN(Cc1ccc(F)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819187980	GG	On-Demand	Mild	PAPA1_CARPA	48	55
C#CCN(Cc1ccc(F)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819187980	GG	On-Demand	Mild	CTSK	17	40
C#CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819187981	FG	On-Demand	Mild	PAPA1_CARPA	31	41
C#CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819187982	FG	On-Demand	Mild	PAPA1_CARPA	31	41
O=C(N[C@H]1CCN(Cc2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819187997	DE	On-Demand	Anodyne	ACE	40	43
O=C(N[C@H]1CCN(Cc2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819187997	DE	On-Demand	Anodyne	MME	25	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819187998	DE	On-Demand	Anodyne	ACE	40	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819187998	DE	On-Demand	Anodyne	MME	25	43
O=C(C(F)=C1CCC1)N1CCC(N2CCc3ccccc3C2)CC1	ZINC000819188009	EG	On-Demand	Anodyne	L3MBTL3	78	40
CC(=O)N(C)c1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819188018	GG	On-Demand	Mild	PAPA1_CARPA	43	44
CC(=O)N(C)c1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819188019	GG	On-Demand	Mild	PAPA1_CARPA	43	44
C=C(C)C(C)(C)C(=O)N1CCC(c2cc3ccccc3[nH]2)CC1	ZINC000819188025	DI	On-Demand	Mild	AKR1C3	19	46
O=C(NC1CCCCC1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819188030	EE	On-Demand	Anodyne	EPHX2	22	50
O=C(NC1CCCCC1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819188031	EE	On-Demand	Anodyne	EPHX2	22	50
O=C(NC1CCCCC1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819188032	EE	On-Demand	Anodyne	EPHX2	22	50
O=C(NC1CCCCC1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819188033	EE	On-Demand	Anodyne	EPHX2	22	50
CC(C)CN1CCC[C@@H]1CNC[C@@H](O)c1ccccc1	ZINC000819188034	CE	On-Demand	Anodyne	SLC18A2	36	40
CC(C)CN1CCC[C@@H]1CNC[C@@H](O)c1ccccc1	ZINC000819188034	CE	On-Demand	Anodyne	Q8WSF8_APLCA	18	40
CC(C)CN1CCC[C@@H]1CNC[C@H](O)c1ccccc1	ZINC000819188035	CE	On-Demand	Anodyne	SLC18A2	36	40
CC(C)CN1CCC[C@@H]1CNC[C@H](O)c1ccccc1	ZINC000819188035	CE	On-Demand	Anodyne	Q8WSF8_APLCA	18	40
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819188036	ED	On-Demand	Anodyne	ADRB2	32	41
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819188036	ED	On-Demand	Anodyne	ADRB1	51	42
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819188036	ED	On-Demand	Anodyne	ADRB3	78	48
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819188036	ED	On-Demand	Anodyne	IGF1R	28	42
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819188036	ED	On-Demand	Anodyne	CYP3A4	48	36
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819188037	ED	On-Demand	Anodyne	ADRB2	32	41
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819188037	ED	On-Demand	Anodyne	ADRB1	51	42
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819188037	ED	On-Demand	Anodyne	ADRB3	78	48
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819188037	ED	On-Demand	Anodyne	IGF1R	28	42
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819188037	ED	On-Demand	Anodyne	CYP3A4	48	36
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819188038	ED	On-Demand	Anodyne	ADRB2	32	41
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819188038	ED	On-Demand	Anodyne	ADRB1	51	42
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819188038	ED	On-Demand	Anodyne	ADRB3	78	48
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819188038	ED	On-Demand	Anodyne	IGF1R	28	42
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819188038	ED	On-Demand	Anodyne	CYP3A4	48	36
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819188039	ED	On-Demand	Anodyne	ADRB2	32	41
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819188039	ED	On-Demand	Anodyne	ADRB1	51	42
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819188039	ED	On-Demand	Anodyne	ADRB3	78	48
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819188039	ED	On-Demand	Anodyne	IGF1R	28	42
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819188039	ED	On-Demand	Anodyne	CYP3A4	48	36
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819188047	EC	On-Demand	Anodyne	ADRB2	17	48
CS(=O)(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819188047	EC	On-Demand	Anodyne	ADRB3	24	48
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819188048	EC	On-Demand	Anodyne	ADRB2	17	48
CS(=O)(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819188048	EC	On-Demand	Anodyne	ADRB3	24	48
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819188049	EC	On-Demand	Anodyne	ADRB2	17	48
CS(=O)(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819188049	EC	On-Demand	Anodyne	ADRB3	24	48
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819188050	EC	On-Demand	Anodyne	ADRB2	17	48
CS(=O)(=O)N1CC[C@H](CNC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819188050	EC	On-Demand	Anodyne	ADRB3	24	48
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)ncn1	ZINC000819188072	GE	On-Demand	Anodyne	CTSD	79	42
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)ncn1	ZINC000819188072	GE	On-Demand	Anodyne	PGC	56	37
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)ncn1	ZINC000819188072	GE	On-Demand	Anodyne	PAPA1_CARPA	29	42
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)ncn1	ZINC000819188072	GE	On-Demand	Anodyne	BACE2	46	38
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)ncn1	ZINC000819188072	GE	On-Demand	Anodyne	REN	79	47
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)ncn1	ZINC000819188072	GE	On-Demand	Anodyne	REN1	21	43
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)ncn1	ZINC000819188072	GE	On-Demand	Anodyne	BACE1	86	43
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)ncn1	ZINC000819188072	GE	On-Demand	Anodyne	FPR1	48	40
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)ncn1	ZINC000819188072	GE	On-Demand	Anodyne	PLM2_PLAFA	48	34
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC23CCC(CC2)C3)CC1	ZINC000819188101	FG	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC23CCC(CC2)C3)CC1	ZINC000819188102	FG	On-Demand	Anodyne	GPR119	32	42
C[C@H]1Cc2cc(-c3ccc(CNC[C@H](O)c4cccnc4)cc3)ccc2O1	ZINC000819188106	FH	On-Demand	Anodyne	ADRB2	22	41
C[C@H]1Cc2cc(-c3ccc(CNC[C@H](O)c4cccnc4)cc3)ccc2O1	ZINC000819188106	FH	On-Demand	Anodyne	ADRB1	36	43
C[C@H]1Cc2cc(-c3ccc(CNC[C@H](O)c4cccnc4)cc3)ccc2O1	ZINC000819188106	FH	On-Demand	Anodyne	ADRB3	109	46
C[C@H]1Cc2cc(-c3ccc(CNC[C@@H](O)c4cccnc4)cc3)ccc2O1	ZINC000819188107	FH	On-Demand	Anodyne	ADRB2	22	41
C[C@H]1Cc2cc(-c3ccc(CNC[C@@H](O)c4cccnc4)cc3)ccc2O1	ZINC000819188107	FH	On-Demand	Anodyne	ADRB1	36	43
C[C@H]1Cc2cc(-c3ccc(CNC[C@@H](O)c4cccnc4)cc3)ccc2O1	ZINC000819188107	FH	On-Demand	Anodyne	ADRB3	109	46
C[C@@H]1Cc2cc(-c3ccc(CNC[C@@H](O)c4cccnc4)cc3)ccc2O1	ZINC000819188108	FH	On-Demand	Anodyne	ADRB2	22	41
C[C@@H]1Cc2cc(-c3ccc(CNC[C@@H](O)c4cccnc4)cc3)ccc2O1	ZINC000819188108	FH	On-Demand	Anodyne	ADRB1	36	43
C[C@@H]1Cc2cc(-c3ccc(CNC[C@@H](O)c4cccnc4)cc3)ccc2O1	ZINC000819188108	FH	On-Demand	Anodyne	ADRB3	109	46
C[C@@H]1Cc2cc(-c3ccc(CNC[C@H](O)c4cccnc4)cc3)ccc2O1	ZINC000819188109	FH	On-Demand	Anodyne	ADRB2	22	41
C[C@@H]1Cc2cc(-c3ccc(CNC[C@H](O)c4cccnc4)cc3)ccc2O1	ZINC000819188109	FH	On-Demand	Anodyne	ADRB1	36	43
C[C@@H]1Cc2cc(-c3ccc(CNC[C@H](O)c4cccnc4)cc3)ccc2O1	ZINC000819188109	FH	On-Demand	Anodyne	ADRB3	109	46
C=CCCOCCNC[C@@H](O)c1cccnc1	ZINC000819188113	BD	On-Demand	Mild	ADRB2	27	51
C=CCCOCCNC[C@@H](O)c1cccnc1	ZINC000819188113	BD	On-Demand	Mild	ADRB1	33	51
C=CCCOCCNC[C@@H](O)c1cccnc1	ZINC000819188113	BD	On-Demand	Mild	ADRB3	103	53
C=CCCOCCNC[C@H](O)c1cccnc1	ZINC000819188114	BD	On-Demand	Mild	ADRB2	27	51
C=CCCOCCNC[C@H](O)c1cccnc1	ZINC000819188114	BD	On-Demand	Mild	ADRB1	33	51
C=CCCOCCNC[C@H](O)c1cccnc1	ZINC000819188114	BD	On-Demand	Mild	ADRB3	103	53
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2CCS(=O)(=O)CC2)CC1	ZINC000819188117	GD	On-Demand	Anodyne	GPR119	31	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2CCS(=O)(=O)CC2)CC1	ZINC000819188118	GD	On-Demand	Anodyne	GPR119	31	42
C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCC1	ZINC000819188127	CE	On-Demand	Bother	ADRB2	15	44
C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCC1	ZINC000819188127	CE	On-Demand	Bother	ADRB3	48	36
C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCC1	ZINC000819188127	CE	On-Demand	Bother	CACNA1D	52	34
C[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCC1	ZINC000819188129	CE	On-Demand	Bother	ADRB2	15	44
C[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCC1	ZINC000819188129	CE	On-Demand	Bother	ADRB3	48	36
C[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCC1	ZINC000819188129	CE	On-Demand	Bother	CACNA1D	52	34
C=CCCOCCNC[C@H](O)c1ccc(C)cc1	ZINC000819188131	BE	On-Demand	Mild	ADRB2	24	43
C=CCCOCCNC[C@@H](O)c1ccc(C)cc1	ZINC000819188132	BE	On-Demand	Mild	ADRB2	24	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cnn(Cc2ccccc2)c1	ZINC000819188152	GD	On-Demand	Anodyne	ITK	21	55
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cnn(Cc2ccccc2)c1	ZINC000819188152	GD	On-Demand	Anodyne	PANC	69	52
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cnn(CC(F)(F)F)c1	ZINC000819188153	FD	On-Demand	Anodyne	PANC	55	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(F)cc1	ZINC000819188155	DD	On-Demand	Anodyne	LTA4H	24	45
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(F)cc1	ZINC000819188155	DD	On-Demand	Anodyne	TPSAB1	15	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(F)cc1	ZINC000819188155	DD	On-Demand	Anodyne	AMP1_PLAFQ	17	46
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1CCc2ccccc21	ZINC000819188157	DF	On-Demand	Anodyne	PLG	44	33
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1CCc2ccccc21	ZINC000819188157	DF	On-Demand	Anodyne	TRYP_PIG	46	33
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1CCc2ccccc21	ZINC000819188157	DF	On-Demand	Anodyne	PROC	60	36
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1CCc2ccccc21	ZINC000819188158	DF	On-Demand	Anodyne	PLG	44	33
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1CCc2ccccc21	ZINC000819188158	DF	On-Demand	Anodyne	TRYP_PIG	46	33
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1CCc2ccccc21	ZINC000819188158	DF	On-Demand	Anodyne	PROC	60	36
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000819188161	GF	On-Demand	Anodyne	PPIA	29	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000819188161	GF	On-Demand	Anodyne	PDGFRB	27	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000819188161	GF	On-Demand	Anodyne	UL80	24	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000819188161	GF	On-Demand	Anodyne	PDS	51	34
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2c(c1)OCCCO2	ZINC000819188162	FD	On-Demand	Anodyne	NOS2	41	31
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2c(c1)OCCO2	ZINC000819188163	FD	On-Demand	Anodyne	NOS2	56	31
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2ncsc2c1	ZINC000819188165	FE	On-Demand	Anodyne	PRMT3	65	38
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819188168	GD	On-Demand	Anodyne	NOD1	18	42
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819188168	GD	On-Demand	Anodyne	NOD2	48	40
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819188169	GD	On-Demand	Anodyne	NOD1	18	42
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819188169	GD	On-Demand	Anodyne	NOD2	48	40
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CC2)CC1	ZINC000819188170	EE	On-Demand	Anodyne	CHRM1	15	45
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CC2)CC1	ZINC000819188170	EE	On-Demand	Anodyne	DRD4	18	44
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CC2)CC1	ZINC000819188170	EE	On-Demand	Anodyne	CHRM3	19	46
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CC2)CC1	ZINC000819188170	EE	On-Demand	Anodyne	LTA4H	22	43
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CC2)CC1	ZINC000819188170	EE	On-Demand	Anodyne	SIGMAR1	30	43
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CC2)CC1	ZINC000819188170	EE	On-Demand	Anodyne	CCR3	40	43
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CC2)CC1	ZINC000819188170	EE	On-Demand	Anodyne	SLC6A5	33	40
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CC2)CC1	ZINC000819188170	EE	On-Demand	Anodyne	EPHX2	41	42
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CC2)CC1	ZINC000819188170	EE	On-Demand	Anodyne	CXCR3	22	43
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CC2)CC1	ZINC000819188170	EE	On-Demand	Anodyne	MCHR1	23	52
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000819188171	GG	On-Demand	Anodyne	SLC1A1	27	50
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000819188171	GG	On-Demand	Anodyne	SLC1A3	31	50
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2c(c1)Cc1ccccc1-2	ZINC000819188171	GG	On-Demand	Anodyne	SLC1A2	25	50
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](CO)c1cccc(Br)c1	ZINC000819188172	GF	On-Demand	Anodyne	PTGER4	22	42
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](CO)c1cccc(Br)c1	ZINC000819188172	GF	On-Demand	Anodyne	PDS	42	39
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](CO)c1cccc(Br)c1	ZINC000819188173	GF	On-Demand	Anodyne	PTGER4	22	42
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](CO)c1cccc(Br)c1	ZINC000819188173	GF	On-Demand	Anodyne	PDS	42	39
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(F)c1	ZINC000819188177	DD	On-Demand	Anodyne	AMP1_PLAFQ	23	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(F)c1	ZINC000819188177	DD	On-Demand	Anodyne	TAAR1	29	44
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(F)c1	ZINC000819188177	DD	On-Demand	Anodyne	KCNK3	54	45
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H]1CCN(CC(F)(F)F)C1	ZINC000819188180	FE	On-Demand	Anodyne	CCR3	38	46
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H]1CCN(CC(F)(F)F)C1	ZINC000819188180	FE	On-Demand	Anodyne	CACNA1I	71	40
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H]1CCN(CC(F)(F)F)C1	ZINC000819188181	FE	On-Demand	Anodyne	CCR3	38	46
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H]1CCN(CC(F)(F)F)C1	ZINC000819188181	FE	On-Demand	Anodyne	CACNA1I	71	40
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000819188182	FG	On-Demand	Anodyne	ANPEP	19	50
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000819188182	FG	On-Demand	Anodyne	CTSF	48	33
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000819188182	FG	On-Demand	Anodyne	CTSL	17	41
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000819188182	FG	On-Demand	Anodyne	MTTP	47	46
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](c1ccccc1)C(F)(F)F	ZINC000819188182	FG	On-Demand	Anodyne	PROC	50	35
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](c1ccccc1)C(F)(F)F	ZINC000819188183	FG	On-Demand	Anodyne	ANPEP	19	50
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](c1ccccc1)C(F)(F)F	ZINC000819188183	FG	On-Demand	Anodyne	CTSF	48	33
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](c1ccccc1)C(F)(F)F	ZINC000819188183	FG	On-Demand	Anodyne	CTSL	17	41
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](c1ccccc1)C(F)(F)F	ZINC000819188183	FG	On-Demand	Anodyne	MTTP	47	46
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](c1ccccc1)C(F)(F)F	ZINC000819188183	FG	On-Demand	Anodyne	PROC	50	35
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000819188186	FD	On-Demand	Anodyne	SIGMAR1	19	42
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000819188186	FD	On-Demand	Anodyne	SLC18A3	73	40
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000819188186	FD	On-Demand	Anodyne	EPHX2	38	41
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000819188187	FD	On-Demand	Anodyne	SIGMAR1	19	42
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000819188187	FD	On-Demand	Anodyne	SLC18A3	73	40
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000819188187	FD	On-Demand	Anodyne	EPHX2	38	41
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000819188188	FD	On-Demand	Anodyne	SIGMAR1	19	42
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000819188188	FD	On-Demand	Anodyne	SLC18A3	73	40
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000819188188	FD	On-Demand	Anodyne	EPHX2	38	41
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000819188189	FD	On-Demand	Anodyne	SIGMAR1	19	42
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000819188189	FD	On-Demand	Anodyne	SLC18A3	73	40
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000819188189	FD	On-Demand	Anodyne	EPHX2	38	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OC(F)F)c1	ZINC000819188190	FE	On-Demand	Anodyne	UL80	28	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OC(F)F)c1	ZINC000819188190	FE	On-Demand	Anodyne	GRM4	15	45
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OC(F)F)c1	ZINC000819188190	FE	On-Demand	Anodyne	TAAR1	46	48
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OC(F)F)c1	ZINC000819188190	FE	On-Demand	Anodyne	KCNK3	46	36
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OC(F)F)c1	ZINC000819188190	FE	On-Demand	Anodyne	PDS	54	36
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cnccc1-c1cccc(F)c1	ZINC000819188192	GF	On-Demand	Anodyne	ROCK2	40	42
O=S1(=O)CCC(CNC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819188198	DD	On-Demand	Anodyne	SLC6A3	20	42
O=S1(=O)CCC(CNC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819188201	DD	On-Demand	Anodyne	SLC6A3	20	42
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(N2CCOCC2)c(F)c1	ZINC000819188205	GE	On-Demand	Clean	NPY2R	58	34
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(N2CCOCC2)c(F)c1	ZINC000819188205	GE	On-Demand	Clean	PIK3CA	15	41
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(N2CCOCC2)c(F)c1	ZINC000819188205	GE	On-Demand	Clean	MTOR	22	41
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-n2cccn2)cc1	ZINC000819188213	FF	On-Demand	Anodyne	AMP1_PLAFQ	70	43
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-n2cccn2)cc1	ZINC000819188213	FF	On-Demand	Anodyne	RPA1	53	34
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000819188214	GD	On-Demand	Anodyne	SIGMAR1	20	45
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000819188214	GD	On-Demand	Anodyne	SLC18A3	77	43
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000819188214	GD	On-Demand	Anodyne	EPHX2	41	51
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000819188216	GD	On-Demand	Anodyne	SIGMAR1	20	45
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000819188216	GD	On-Demand	Anodyne	SLC18A3	77	43
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000819188216	GD	On-Demand	Anodyne	EPHX2	41	51
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000819188218	GD	On-Demand	Anodyne	SIGMAR1	20	45
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000819188218	GD	On-Demand	Anodyne	SLC18A3	77	43
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000819188218	GD	On-Demand	Anodyne	EPHX2	41	51
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000819188219	GD	On-Demand	Anodyne	SIGMAR1	20	45
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000819188219	GD	On-Demand	Anodyne	SLC18A3	77	43
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000819188219	GD	On-Demand	Anodyne	EPHX2	41	51
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1Cl	ZINC000819188220	EE	On-Demand	Anodyne	CXCL8	31	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1Cl	ZINC000819188220	EE	On-Demand	Anodyne	KCNQ2	41	38
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1Cl	ZINC000819188220	EE	On-Demand	Anodyne	HDAC1	24	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1Cl	ZINC000819188220	EE	On-Demand	Anodyne	HDAC2	21	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1Cl	ZINC000819188220	EE	On-Demand	Anodyne	EPHB3	50	34
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819188222	GD	On-Demand	Anodyne	DRD4	19	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819188222	GD	On-Demand	Anodyne	MAPK14	30	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819188222	GD	On-Demand	Anodyne	CCR3	30	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819188222	GD	On-Demand	Anodyne	EPHX2	22	44
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819188222	GD	On-Demand	Anodyne	MCHR1	20	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819188222	GD	On-Demand	Anodyne	KCNK3	76	36
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(Cn2cncn2)c1	ZINC000819188231	GD	On-Demand	Anodyne	CYP19A1	23	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc2c(c1)COC2	ZINC000819188233	EE	On-Demand	Anodyne	RARA	41	31
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccccn2)CC1	ZINC000819188234	FE	On-Demand	Anodyne	CHRM1	16	56
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccccn2)CC1	ZINC000819188234	FE	On-Demand	Anodyne	DRD4	30	60
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccccn2)CC1	ZINC000819188234	FE	On-Demand	Anodyne	ACHE	27	44
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccccn2)CC1	ZINC000819188234	FE	On-Demand	Anodyne	CHRM3	20	56
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccccn2)CC1	ZINC000819188234	FE	On-Demand	Anodyne	LTA4H	35	44
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccccn2)CC1	ZINC000819188234	FE	On-Demand	Anodyne	SIGMAR1	27	48
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccccn2)CC1	ZINC000819188234	FE	On-Demand	Anodyne	SSTR5	54	41
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccccn2)CC1	ZINC000819188234	FE	On-Demand	Anodyne	CCR3	33	40
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccccn2)CC1	ZINC000819188234	FE	On-Demand	Anodyne	SLC6A5	33	46
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccccn2)CC1	ZINC000819188234	FE	On-Demand	Anodyne	EPHX2	31	48
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccccn2)CC1	ZINC000819188234	FE	On-Demand	Anodyne	MCHR1	44	50
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccccn2)CC1	ZINC000819188234	FE	On-Demand	Anodyne	HPGDS	38	40
C=CCCOCCNC[C@H](O)c1cccc2ccccc12	ZINC000819188235	CG	On-Demand	Mild	ADRB2	19	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cnn(-c2ccccc2)c1	ZINC000819188236	FD	On-Demand	Anodyne	MAPK10	15	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cnn(-c2ccccc2)c1	ZINC000819188236	FD	On-Demand	Anodyne	PANC	49	38
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2c(c1)oc1ccccc12	ZINC000819188237	GH	On-Demand	Anodyne	UL80	31	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2c(c1)oc1ccccc12	ZINC000819188237	GH	On-Demand	Anodyne	ECE1	20	44
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(-n2cnnn2)c1	ZINC000819188241	FC	On-Demand	Anodyne	KCNJ1	45	35
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(-n2cnnn2)c1	ZINC000819188241	FC	On-Demand	Anodyne	RPA1	44	32
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1Br	ZINC000819188243	GE	On-Demand	Anodyne	HDAC1	24	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1Br	ZINC000819188243	GE	On-Demand	Anodyne	HDAC2	22	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1F	ZINC000819188251	DD	On-Demand	Anodyne	HDAC1	32	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1F	ZINC000819188251	DD	On-Demand	Anodyne	HDAC2	24	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1F	ZINC000819188251	DD	On-Demand	Anodyne	AMP1_PLAFQ	26	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000819188252	ED	On-Demand	Bother	CACNA1C	41	36
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000819188252	ED	On-Demand	Bother	PPIA	17	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000819188252	ED	On-Demand	Bother	CACNA1D	67	36
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000819188252	ED	On-Demand	Bother	AKR1C3	29	54
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc2cnccc12	ZINC000819188256	EE	On-Demand	Anodyne	TRPV1	35	63
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc2cnccc12	ZINC000819188256	EE	On-Demand	Anodyne	CDK5	24	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc2cnccc12	ZINC000819188256	EE	On-Demand	Anodyne	NAMPT	69	41
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1C[C@@H]1Cc1ccccc1	ZINC000819188258	DF	On-Demand	Anodyne	PLG	51	32
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1C[C@@H]1Cc1ccccc1	ZINC000819188258	DF	On-Demand	Anodyne	TRYP_PIG	46	32
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1C[C@@H]1Cc1ccccc1	ZINC000819188258	DF	On-Demand	Anodyne	EPHX2	15	50
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1C[C@@H]1Cc1ccccc1	ZINC000819188258	DF	On-Demand	Anodyne	PROC	51	31
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1C[C@@H]1Cc1ccccc1	ZINC000819188258	DF	On-Demand	Anodyne	TMPRSS11D	53	33
C=CCCOCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819188260	CF	On-Demand	Mild	ADRB2	50	44
C=CCCOCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819188260	CF	On-Demand	Mild	ADRB1	61	49
C=CCCOCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819188260	CF	On-Demand	Mild	ADRB3	69	49
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1C[C@H]1Cc1ccccc1	ZINC000819188261	DF	On-Demand	Anodyne	PLG	51	32
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1C[C@H]1Cc1ccccc1	ZINC000819188261	DF	On-Demand	Anodyne	TRYP_PIG	46	32
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1C[C@H]1Cc1ccccc1	ZINC000819188261	DF	On-Demand	Anodyne	EPHX2	15	50
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1C[C@H]1Cc1ccccc1	ZINC000819188261	DF	On-Demand	Anodyne	PROC	51	31
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1C[C@H]1Cc1ccccc1	ZINC000819188261	DF	On-Demand	Anodyne	TMPRSS11D	53	33
C=CCCOCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819188262	CF	On-Demand	Mild	ADRB2	50	44
C=CCCOCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819188262	CF	On-Demand	Mild	ADRB1	61	49
C=CCCOCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819188262	CF	On-Demand	Mild	ADRB3	69	49
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1C[C@@H]1Cc1ccccc1	ZINC000819188263	DF	On-Demand	Anodyne	PLG	51	32
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1C[C@@H]1Cc1ccccc1	ZINC000819188263	DF	On-Demand	Anodyne	TRYP_PIG	46	32
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1C[C@@H]1Cc1ccccc1	ZINC000819188263	DF	On-Demand	Anodyne	EPHX2	15	50
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1C[C@@H]1Cc1ccccc1	ZINC000819188263	DF	On-Demand	Anodyne	PROC	51	31
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1C[C@@H]1Cc1ccccc1	ZINC000819188263	DF	On-Demand	Anodyne	TMPRSS11D	53	33
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1C[C@H]1Cc1ccccc1	ZINC000819188266	DF	On-Demand	Anodyne	PLG	51	32
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1C[C@H]1Cc1ccccc1	ZINC000819188266	DF	On-Demand	Anodyne	TRYP_PIG	46	32
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1C[C@H]1Cc1ccccc1	ZINC000819188266	DF	On-Demand	Anodyne	EPHX2	15	50
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1C[C@H]1Cc1ccccc1	ZINC000819188266	DF	On-Demand	Anodyne	PROC	51	31
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1C[C@H]1Cc1ccccc1	ZINC000819188266	DF	On-Demand	Anodyne	TMPRSS11D	53	33
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000819188267	GF	On-Demand	Anodyne	MPL	65	36
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000819188267	GF	On-Demand	Anodyne	ROCK1	26	60
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000819188267	GF	On-Demand	Anodyne	ROCK2	20	60
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000819188267	GF	On-Demand	Anodyne	HDAC1	35	49
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000819188267	GF	On-Demand	Anodyne	HDAC2	28	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000819188267	GF	On-Demand	Anodyne	HDAC6	15	49
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000819188267	GF	On-Demand	Anodyne	PKN1	15	47
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000819188267	GF	On-Demand	Anodyne	HDAC9	15	48
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000819188267	GF	On-Demand	Anodyne	IKBKE	15	47
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000819188267	GF	On-Demand	Anodyne	PAK1	15	47
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000819188267	GF	On-Demand	Anodyne	GIPR	42	35
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000819188267	GF	On-Demand	Anodyne	DMPK	15	47
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1nc(-c2ccccc2)cs1	ZINC000819188267	GF	On-Demand	Anodyne	VCP	15	42
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1CCS(=O)(=O)c2ccccc21	ZINC000819188274	FE	On-Demand	Anodyne	PLG	46	31
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1CCS(=O)(=O)c2ccccc21	ZINC000819188274	FE	On-Demand	Anodyne	TRYP_PIG	46	31
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1CCS(=O)(=O)c2ccccc21	ZINC000819188274	FE	On-Demand	Anodyne	PROC	42	32
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1CCS(=O)(=O)c2ccccc21	ZINC000819188274	FE	On-Demand	Anodyne	TMPRSS11D	41	32
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1CCS(=O)(=O)c2ccccc21	ZINC000819188277	FE	On-Demand	Anodyne	PLG	46	31
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1CCS(=O)(=O)c2ccccc21	ZINC000819188277	FE	On-Demand	Anodyne	TRYP_PIG	46	31
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1CCS(=O)(=O)c2ccccc21	ZINC000819188277	FE	On-Demand	Anodyne	PROC	42	32
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1CCS(=O)(=O)c2ccccc21	ZINC000819188277	FE	On-Demand	Anodyne	TMPRSS11D	41	32
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1Oc1ccccc1	ZINC000819188288	GG	On-Demand	Anodyne	INHA	32	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1Oc1ccccc1	ZINC000819188288	GG	On-Demand	Anodyne	LTA4H	29	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1Oc1ccccc1	ZINC000819188288	GG	On-Demand	Anodyne	HDAC1	17	48
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1Oc1ccccc1	ZINC000819188288	GG	On-Demand	Anodyne	HDAC2	18	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1Oc1ccccc1	ZINC000819188288	GG	On-Demand	Anodyne	PDS	41	33
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(Cl)nc1	ZINC000819188290	DE	On-Demand	Anodyne	NAMPT	34	54
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(Cl)nc1	ZINC000819188290	DE	On-Demand	Anodyne	NACHRBETA2	49	46
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC(F)(F)F)CC1	ZINC000819188292	FE	On-Demand	Anodyne	DRD4	18	44
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC(F)(F)F)CC1	ZINC000819188292	FE	On-Demand	Anodyne	LTA4H	21	40
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC(F)(F)F)CC1	ZINC000819188292	FE	On-Demand	Anodyne	SIGMAR1	21	46
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC(F)(F)F)CC1	ZINC000819188292	FE	On-Demand	Anodyne	CCR3	23	41
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC(F)(F)F)CC1	ZINC000819188292	FE	On-Demand	Anodyne	CCR2	52	36
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC(F)(F)F)CC1	ZINC000819188292	FE	On-Demand	Anodyne	SLC6A5	34	44
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC(F)(F)F)CC1	ZINC000819188292	FE	On-Demand	Anodyne	EPHX2	42	41
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC(F)(F)F)CC1	ZINC000819188292	FE	On-Demand	Anodyne	MCHR1	29	54
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC(F)(F)F)CC1	ZINC000819188292	FE	On-Demand	Anodyne	HPGDS	46	52
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	ZINC000819188294	GD	On-Demand	Anodyne	DHODH	26	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1	ZINC000819188294	GD	On-Demand	Anodyne	EPHX2	22	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OC(F)(F)F)c1	ZINC000819188299	GF	On-Demand	Anodyne	PPARG	18	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OC(F)(F)F)c1	ZINC000819188299	GF	On-Demand	Anodyne	DHODH	21	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OC(F)(F)F)c1	ZINC000819188299	GF	On-Demand	Anodyne	GRIN2B	18	46
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OC(F)(F)F)c1	ZINC000819188299	GF	On-Demand	Anodyne	UL80	32	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OC(F)(F)F)c1	ZINC000819188299	GF	On-Demand	Anodyne	EPHX2	27	44
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OC(F)(F)F)c1	ZINC000819188299	GF	On-Demand	Anodyne	SCN10A	22	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OC(F)(F)F)c1	ZINC000819188299	GF	On-Demand	Anodyne	TAAR1	47	49
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OC(F)(F)F)c1	ZINC000819188299	GF	On-Demand	Anodyne	KCNK3	49	37
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OC(F)(F)F)c1	ZINC000819188299	GF	On-Demand	Anodyne	PDS	60	37
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1ccco1	ZINC000819188301	DD	On-Demand	Anodyne	TMPRSS11D	40	32
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1ccco1	ZINC000819188303	DD	On-Demand	Anodyne	TMPRSS11D	40	32
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(-c2nccs2)c1	ZINC000819188305	GF	On-Demand	Anodyne	HDAC2	16	42
C[C@@H](NC[C@@H](O)c1cccnc1)c1cn[nH]c1	ZINC000819188311	BD	On-Demand	Anodyne	ADRB2	20	40
C[C@@H](NC[C@@H](O)c1cccnc1)c1cn[nH]c1	ZINC000819188311	BD	On-Demand	Anodyne	ADRB1	23	47
C[C@@H](NC[C@@H](O)c1cccnc1)c1cn[nH]c1	ZINC000819188311	BD	On-Demand	Anodyne	ADRB3	66	47
C[C@H](NC[C@H](O)c1cccnc1)c1cn[nH]c1	ZINC000819188312	BD	On-Demand	Anodyne	ADRB2	20	40
C[C@H](NC[C@H](O)c1cccnc1)c1cn[nH]c1	ZINC000819188312	BD	On-Demand	Anodyne	ADRB1	23	47
C[C@H](NC[C@H](O)c1cccnc1)c1cn[nH]c1	ZINC000819188312	BD	On-Demand	Anodyne	ADRB3	66	47
O[C@@H](CNCCC1Cc2ccccc2C1)c1ccccc1	ZINC000819188323	CG	On-Demand	Anodyne	ADRB2	16	47
O[C@@H](CNCCC1Cc2ccccc2C1)c1ccccc1	ZINC000819188323	CG	On-Demand	Anodyne	ADRB3	44	40
O[C@H](CNCCC1Cc2ccccc2C1)c1ccccc1	ZINC000819188324	CG	On-Demand	Anodyne	ADRB2	16	47
O[C@H](CNCCC1Cc2ccccc2C1)c1ccccc1	ZINC000819188324	CG	On-Demand	Anodyne	ADRB3	44	40
O[C@@H](CNCCCOc1ncc(C(F)(F)F)cc1Cl)c1cccnc1	ZINC000819188335	GG	On-Demand	Anodyne	ADRB2	29	48
O[C@@H](CNCCCOc1ncc(C(F)(F)F)cc1Cl)c1cccnc1	ZINC000819188335	GG	On-Demand	Anodyne	ADRB1	42	51
O[C@@H](CNCCCOc1ncc(C(F)(F)F)cc1Cl)c1cccnc1	ZINC000819188335	GG	On-Demand	Anodyne	ADRB3	108	48
O[C@H](CNCCCOc1ncc(C(F)(F)F)cc1Cl)c1cccnc1	ZINC000819188336	GG	On-Demand	Anodyne	ADRB2	29	48
O[C@H](CNCCCOc1ncc(C(F)(F)F)cc1Cl)c1cccnc1	ZINC000819188336	GG	On-Demand	Anodyne	ADRB1	42	51
O[C@H](CNCCCOc1ncc(C(F)(F)F)cc1Cl)c1cccnc1	ZINC000819188336	GG	On-Demand	Anodyne	ADRB3	108	48
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1cccc(F)c1	ZINC000819188337	DE	On-Demand	Anodyne	ADRB2	42	42
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1cccc(F)c1	ZINC000819188337	DE	On-Demand	Anodyne	ADRB1	45	45
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1cccc(F)c1	ZINC000819188337	DE	On-Demand	Anodyne	ADRB3	103	45
O[C@H](CNCCc1cnc(C2CC2)nc1)c1cccc(F)c1	ZINC000819188338	DE	On-Demand	Anodyne	ADRB2	42	42
O[C@H](CNCCc1cnc(C2CC2)nc1)c1cccc(F)c1	ZINC000819188338	DE	On-Demand	Anodyne	ADRB1	45	45
O[C@H](CNCCc1cnc(C2CC2)nc1)c1cccc(F)c1	ZINC000819188338	DE	On-Demand	Anodyne	ADRB3	103	45
O=S(=O)(c1cccc(F)c1)N(CCCNC[C@H](O)c1ccccc1)C1CC1	ZINC000819188350	GF	On-Demand	Anodyne	ADRB3	44	37
O=S(=O)(c1cccc(F)c1)N(CCCNC[C@@H](O)c1ccccc1)C1CC1	ZINC000819188351	GF	On-Demand	Anodyne	ADRB3	44	37
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1-c1ccccc1	ZINC000819188360	FG	On-Demand	Anodyne	HDAC1	26	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(Br)c1	ZINC000819188361	GE	On-Demand	Anodyne	UL80	29	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(Br)c1	ZINC000819188361	GE	On-Demand	Anodyne	TAAR1	21	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(Br)c1	ZINC000819188361	GE	On-Demand	Anodyne	AKR1C3	28	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(Br)c1	ZINC000819188361	GE	On-Demand	Anodyne	KCNK3	47	34
O=C(NCc1ccc(C(=O)O)cc1)NCc1cc(O)nc2ccccc12	ZINC000819188364	FF	On-Demand	Anodyne	CYSLTR1	15	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1cc(O)nc2ccccc12	ZINC000819188364	FF	On-Demand	Anodyne	TSPO	18	42
O=C(NCc1ccc(C(=O)O)cc1)NCc1cc(O)nc2ccccc12	ZINC000819188364	FF	On-Demand	Anodyne	UL80	18	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1cc(O)nc2ccccc12	ZINC000819188364	FF	On-Demand	Anodyne	BCHE	57	34
O=C(NCc1ccc(C(=O)O)cc1)NCc1cc(O)nc2ccccc12	ZINC000819188364	FF	On-Demand	Anodyne	TACR3	23	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(-n2cccn2)c1	ZINC000819188365	FD	On-Demand	Anodyne	AMP1_PLAFQ	52	32
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819188366	EF	On-Demand	Anodyne	ADRB2	48	40
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819188366	EF	On-Demand	Anodyne	ADRB1	53	62
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819188366	EF	On-Demand	Anodyne	ADRB3	73	62
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819188366	EF	On-Demand	Anodyne	PTGER4	25	49
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819188366	EF	On-Demand	Anodyne	PDS	69	39
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819188367	EF	On-Demand	Anodyne	ADRB2	48	40
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819188367	EF	On-Demand	Anodyne	ADRB1	53	62
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819188367	EF	On-Demand	Anodyne	ADRB3	73	62
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819188367	EF	On-Demand	Anodyne	PTGER4	25	49
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819188367	EF	On-Demand	Anodyne	PDS	69	39
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc2cccnc12	ZINC000819188368	EE	On-Demand	Anodyne	HDAC1	23	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc2cccnc12	ZINC000819188368	EE	On-Demand	Anodyne	TNKS	15	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cnn(-c2ccccn2)c1	ZINC000819188371	FD	On-Demand	Anodyne	PANC	48	38
O=C(NCc1ccc(C(=O)O)cc1)NC1CCC(N2CCCCC2)CC1	ZINC000819188372	FF	On-Demand	Anodyne	EPHX2	41	52
O=C(NCc1ccc(C(=O)O)cc1)NC1CCC(N2CCCCC2)CC1	ZINC000819188372	FF	On-Demand	Anodyne	PROC	44	34
O=C(NCc1ccc(C(=O)O)cc1)NC1CCC(N2CCCCC2)CC1	ZINC000819188372	FF	On-Demand	Anodyne	L3MBTL3	120	44
O=C(NCc1ccc(C(=O)O)cc1)NC1CCC(N2CCCCC2)CC1	ZINC000819188372	FF	On-Demand	Anodyne	TMPRSS11D	58	35
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cnc2ccccc2c1	ZINC000819188374	EE	On-Demand	Anodyne	CYSLTR1	23	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cnc2ccccc2c1	ZINC000819188374	EE	On-Demand	Anodyne	UL80	30	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cnc2ccccc2c1	ZINC000819188374	EE	On-Demand	Anodyne	TPH1	52	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cnc2ccccc2c1	ZINC000819188374	EE	On-Demand	Anodyne	HDAC1	17	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cnc2ccccc2c1	ZINC000819188374	EE	On-Demand	Anodyne	NAMPT	36	45
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cnn(CC(F)F)c1	ZINC000819188375	FD	On-Demand	Anodyne	PANC	55	41
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1cccc(F)c1	ZINC000819188378	EE	On-Demand	Anodyne	ADRB2	40	38
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1cccc(F)c1	ZINC000819188378	EE	On-Demand	Anodyne	ADRB1	30	46
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1cccc(F)c1	ZINC000819188378	EE	On-Demand	Anodyne	ADRB3	41	46
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1cccc(F)c1	ZINC000819188379	EE	On-Demand	Anodyne	ADRB2	40	38
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1cccc(F)c1	ZINC000819188379	EE	On-Demand	Anodyne	ADRB1	30	46
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1cccc(F)c1	ZINC000819188379	EE	On-Demand	Anodyne	ADRB3	41	46
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](CO)c1ccccc1	ZINC000819188380	DD	On-Demand	Anodyne	ANPEP	25	50
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](CO)c1ccccc1	ZINC000819188380	DD	On-Demand	Anodyne	TACR3	29	40
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](CO)c1ccccc1	ZINC000819188380	DD	On-Demand	Anodyne	SOAT1	21	41
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](CO)c1ccccc1	ZINC000819188380	DD	On-Demand	Anodyne	FURIN	41	35
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](CO)c1ccccc1	ZINC000819188380	DD	On-Demand	Anodyne	MTTP	23	40
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](CO)c1ccccc1	ZINC000819188380	DD	On-Demand	Anodyne	PROC	40	35
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](CO)c1ccccc1	ZINC000819188381	DD	On-Demand	Anodyne	ANPEP	25	50
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](CO)c1ccccc1	ZINC000819188381	DD	On-Demand	Anodyne	TACR3	29	40
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](CO)c1ccccc1	ZINC000819188381	DD	On-Demand	Anodyne	SOAT1	21	41
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](CO)c1ccccc1	ZINC000819188381	DD	On-Demand	Anodyne	FURIN	41	35
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](CO)c1ccccc1	ZINC000819188381	DD	On-Demand	Anodyne	MTTP	23	40
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](CO)c1ccccc1	ZINC000819188381	DD	On-Demand	Anodyne	PROC	40	35
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1c2ccccc2C[C@@H]1O	ZINC000819188383	ED	On-Demand	Anodyne	PLM1_PLAFA	51	49
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1c2ccccc2C[C@@H]1O	ZINC000819188383	ED	On-Demand	Anodyne	PLM2_PLAFA	94	49
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1c2ccccc2C[C@H]1O	ZINC000819188384	ED	On-Demand	Anodyne	PLM1_PLAFA	51	49
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1c2ccccc2C[C@H]1O	ZINC000819188384	ED	On-Demand	Anodyne	PLM2_PLAFA	94	49
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1c2ccccc2C[C@@H]1O	ZINC000819188385	ED	On-Demand	Anodyne	PLM1_PLAFA	51	49
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1c2ccccc2C[C@@H]1O	ZINC000819188385	ED	On-Demand	Anodyne	PLM2_PLAFA	94	49
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@@H](O)C1	ZINC000819188386	CD	On-Demand	Anodyne	EPHX2	30	48
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1CCC[C@H](O)C1	ZINC000819188387	CD	On-Demand	Anodyne	EPHX2	30	48
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@@H](O)C1	ZINC000819188388	CD	On-Demand	Anodyne	EPHX2	30	48
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1CCC[C@H](O)C1	ZINC000819188389	CD	On-Demand	Anodyne	EPHX2	30	48
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2ccccc2c1	ZINC000819188390	EF	On-Demand	Anodyne	CYSLTR1	22	46
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2ccccc2c1	ZINC000819188390	EF	On-Demand	Anodyne	KCNJ11	48	32
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2ccccc2c1	ZINC000819188390	EF	On-Demand	Anodyne	UL80	37	48
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2ccccc2c1	ZINC000819188390	EF	On-Demand	Anodyne	TPH1	54	39
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2ccccc2c1	ZINC000819188390	EF	On-Demand	Anodyne	HDAC1	18	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2ccccc2c1	ZINC000819188390	EF	On-Demand	Anodyne	PLAU	18	44
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2ccccc2c1	ZINC000819188390	EF	On-Demand	Anodyne	AKR1C3	19	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2ccccc2c1	ZINC000819188390	EF	On-Demand	Anodyne	IMDH_CRYPV	24	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2ccccc2c1	ZINC000819188390	EF	On-Demand	Anodyne	NAMPT	23	41
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-n2ccnc2)nc1	ZINC000819188392	FD	On-Demand	Anodyne	TBXAS1	18	45
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-n2ccnc2)nc1	ZINC000819188392	FD	On-Demand	Anodyne	NOS2	99	39
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-n2ccnc2)nc1	ZINC000819188392	FD	On-Demand	Anodyne	NAMPT	52	62
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(NC(=O)C2CC2)c1	ZINC000819188393	GD	On-Demand	Anodyne	KLKB1	18	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(NC(=O)C2CC2)c1	ZINC000819188393	GD	On-Demand	Anodyne	LTA4H	17	45
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(NC(=O)C2CC2)c1	ZINC000819188393	GD	On-Demand	Anodyne	KCNK3	49	48
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)COc1ccccc1	ZINC000819188395	ED	On-Demand	Anodyne	ADRB2	53	48
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)COc1ccccc1	ZINC000819188395	ED	On-Demand	Anodyne	ADRB1	90	49
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)COc1ccccc1	ZINC000819188395	ED	On-Demand	Anodyne	ADRB3	62	49
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)COc1ccccc1	ZINC000819188395	ED	On-Demand	Anodyne	ABCB1	34	44
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)COc1ccccc1	ZINC000819188395	ED	On-Demand	Anodyne	PDS	85	46
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)COc1ccccc1	ZINC000819188396	ED	On-Demand	Anodyne	ADRB2	53	48
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)COc1ccccc1	ZINC000819188396	ED	On-Demand	Anodyne	ADRB1	90	49
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)COc1ccccc1	ZINC000819188396	ED	On-Demand	Anodyne	ADRB3	62	49
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)COc1ccccc1	ZINC000819188396	ED	On-Demand	Anodyne	ABCB1	34	44
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)COc1ccccc1	ZINC000819188396	ED	On-Demand	Anodyne	PDS	85	46
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)COc1ccc(F)cc1	ZINC000819188397	FD	On-Demand	Anodyne	ADRB2	40	43
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)COc1ccc(F)cc1	ZINC000819188397	FD	On-Demand	Anodyne	ADRB1	76	45
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)COc1ccc(F)cc1	ZINC000819188397	FD	On-Demand	Anodyne	ADRB3	49	45
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)COc1ccc(F)cc1	ZINC000819188397	FD	On-Demand	Anodyne	ABCB1	19	43
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)COc1ccc(F)cc1	ZINC000819188397	FD	On-Demand	Anodyne	PDS	52	36
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)COc1ccc(F)cc1	ZINC000819188399	FD	On-Demand	Anodyne	ADRB2	40	43
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)COc1ccc(F)cc1	ZINC000819188399	FD	On-Demand	Anodyne	ADRB1	76	45
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)COc1ccc(F)cc1	ZINC000819188399	FD	On-Demand	Anodyne	ADRB3	49	45
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)COc1ccc(F)cc1	ZINC000819188399	FD	On-Demand	Anodyne	ABCB1	19	43
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)COc1ccc(F)cc1	ZINC000819188399	FD	On-Demand	Anodyne	PDS	52	36
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc2ccncc12	ZINC000819188401	EE	On-Demand	Anodyne	TRPV1	31	53
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc2ccncc12	ZINC000819188401	EE	On-Demand	Anodyne	UL80	28	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc2ccncc12	ZINC000819188401	EE	On-Demand	Anodyne	CDK5	26	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc2ccncc12	ZINC000819188401	EE	On-Demand	Anodyne	NAMPT	74	42
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1ccccc1	ZINC000819188402	CE	On-Demand	Anodyne	ADRB2	54	53
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1ccccc1	ZINC000819188402	CE	On-Demand	Anodyne	ADRB1	64	43
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1ccccc1	ZINC000819188402	CE	On-Demand	Anodyne	ADRB3	128	48
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1ccccc1F	ZINC000819188403	EE	On-Demand	Anodyne	FURIN	46	33
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1ccccc1F	ZINC000819188403	EE	On-Demand	Anodyne	TMPRSS11D	47	33
O[C@H](CNCCc1cnc(C2CC2)nc1)c1ccccc1	ZINC000819188404	CE	On-Demand	Anodyne	ADRB2	54	53
O[C@H](CNCCc1cnc(C2CC2)nc1)c1ccccc1	ZINC000819188404	CE	On-Demand	Anodyne	ADRB1	64	43
O[C@H](CNCCc1cnc(C2CC2)nc1)c1ccccc1	ZINC000819188404	CE	On-Demand	Anodyne	ADRB3	128	48
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1ccccc1F	ZINC000819188405	EE	On-Demand	Anodyne	FURIN	46	33
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1ccccc1F	ZINC000819188405	EE	On-Demand	Anodyne	TMPRSS11D	47	33
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccncc2)CC1	ZINC000819188407	FE	On-Demand	Anodyne	CHRM2	15	43
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccncc2)CC1	ZINC000819188407	FE	On-Demand	Anodyne	DRD4	33	52
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccncc2)CC1	ZINC000819188407	FE	On-Demand	Anodyne	ACHE	34	50
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccncc2)CC1	ZINC000819188407	FE	On-Demand	Anodyne	CHRM3	24	53
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccncc2)CC1	ZINC000819188407	FE	On-Demand	Anodyne	LTA4H	35	48
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccncc2)CC1	ZINC000819188407	FE	On-Demand	Anodyne	SIGMAR1	36	49
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccncc2)CC1	ZINC000819188407	FE	On-Demand	Anodyne	SSTR5	55	40
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccncc2)CC1	ZINC000819188407	FE	On-Demand	Anodyne	CCR3	39	43
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccncc2)CC1	ZINC000819188407	FE	On-Demand	Anodyne	UTS2R	18	40
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccncc2)CC1	ZINC000819188407	FE	On-Demand	Anodyne	SLC6A5	36	48
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccncc2)CC1	ZINC000819188407	FE	On-Demand	Anodyne	EPHX2	31	48
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccncc2)CC1	ZINC000819188407	FE	On-Demand	Anodyne	CXCR3	46	42
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccncc2)CC1	ZINC000819188407	FE	On-Demand	Anodyne	MCHR1	57	59
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(Cc2ccncc2)CC1	ZINC000819188407	FE	On-Demand	Anodyne	NAMPT	43	33
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1CCCC(F)(F)C1	ZINC000819188409	DF	On-Demand	Anodyne	EPHX2	22	47
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1CCCC(F)(F)C1	ZINC000819188412	DF	On-Demand	Anodyne	EPHX2	22	47
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1ccccc1C(F)(F)F	ZINC000819188413	FG	On-Demand	Anodyne	ADRB3	44	35
O[C@H](CNCCc1cnc(C2CC2)nc1)c1ccccc1C(F)(F)F	ZINC000819188415	FG	On-Demand	Anodyne	ADRB3	44	35
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1CCN(c2c(F)cccc2F)C1=O	ZINC000819188416	GE	On-Demand	Anodyne	PLG	54	33
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1CCN(c2c(F)cccc2F)C1=O	ZINC000819188416	GE	On-Demand	Anodyne	TRYP_PIG	48	33
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1CCN(c2c(F)cccc2F)C1=O	ZINC000819188419	GE	On-Demand	Anodyne	PLG	54	33
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1CCN(c2c(F)cccc2F)C1=O	ZINC000819188419	GE	On-Demand	Anodyne	TRYP_PIG	48	33
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(-c2nnco2)c1	ZINC000819188421	FD	On-Demand	Anodyne	PTGIR	15	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(-c2nnco2)c1	ZINC000819188421	FD	On-Demand	Anodyne	PTPN11	43	32
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000819188430	GF	On-Demand	Anodyne	GCGR	55	47
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000819188430	GF	On-Demand	Anodyne	DHODH	17	46
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000819188430	GF	On-Demand	Anodyne	PPARA	16	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000819188430	GF	On-Demand	Anodyne	GRIN2B	18	46
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000819188430	GF	On-Demand	Anodyne	LTA4H	31	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000819188430	GF	On-Demand	Anodyne	P2RY1	55	38
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000819188430	GF	On-Demand	Anodyne	EPHX2	59	48
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000819188430	GF	On-Demand	Anodyne	ACR	51	38
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000819188430	GF	On-Demand	Anodyne	GIPR	53	46
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000819188430	GF	On-Demand	Anodyne	SHH	46	35
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000819188430	GF	On-Demand	Anodyne	NOD2	26	47
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(C2CC2)CC1	ZINC000819188432	DD	On-Demand	Anodyne	LTA4H	29	40
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(C2CC2)CC1	ZINC000819188432	DD	On-Demand	Anodyne	CCR2	21	43
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(C2CC2)CC1	ZINC000819188432	DD	On-Demand	Anodyne	SLC6A5	37	45
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(C2CC2)CC1	ZINC000819188432	DD	On-Demand	Anodyne	EPHX2	43	49
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(C2CC2)CC1	ZINC000819188432	DD	On-Demand	Anodyne	TGM2	18	40
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(C2CC2)CC1	ZINC000819188432	DD	On-Demand	Anodyne	L3MBTL3	70	37
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(C2CC2)CC1	ZINC000819188432	DD	On-Demand	Anodyne	TMPRSS11D	47	32
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1ccc(F)cc1	ZINC000819188434	EE	On-Demand	Anodyne	ADRB3	21	43
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1ccc(F)cc1	ZINC000819188434	EE	On-Demand	Anodyne	AMP1_PLAFQ	15	42
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819188436	EE	On-Demand	Anodyne	ADRB3	21	43
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819188436	EE	On-Demand	Anodyne	AMP1_PLAFQ	15	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	ZINC000819188439	GD	On-Demand	Anodyne	KIT	25	45
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	ZINC000819188439	GD	On-Demand	Anodyne	BRAF	22	45
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(c2cccs2)CC1	ZINC000819188444	FF	On-Demand	Anodyne	EPHX2	32	46
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)COc1cccc(F)c1	ZINC000819188451	FD	On-Demand	Anodyne	ADRB1	56	43
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)COc1cccc(F)c1	ZINC000819188451	FD	On-Demand	Anodyne	ADRB3	40	43
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)COc1cccc(F)c1	ZINC000819188451	FD	On-Demand	Anodyne	PDS	86	52
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)COc1cccc(F)c1	ZINC000819188452	FD	On-Demand	Anodyne	ADRB1	56	43
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)COc1cccc(F)c1	ZINC000819188452	FD	On-Demand	Anodyne	ADRB3	40	43
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)COc1cccc(F)c1	ZINC000819188452	FD	On-Demand	Anodyne	PDS	86	52
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2[nH]ncc2c1	ZINC000819188458	ED	On-Demand	Anodyne	MAOB	17	49
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2[nH]ncc2c1	ZINC000819188458	ED	On-Demand	Anodyne	ROCK1	25	54
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2[nH]ncc2c1	ZINC000819188458	ED	On-Demand	Anodyne	ROCK2	28	54
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1cccnc1	ZINC000819188466	CD	On-Demand	Anodyne	ADRB2	46	51
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1cccnc1	ZINC000819188466	CD	On-Demand	Anodyne	ADRB1	55	49
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1cccnc1	ZINC000819188466	CD	On-Demand	Anodyne	ADRB3	150	53
O[C@H](CNCCc1cnc(C2CC2)nc1)c1cccnc1	ZINC000819188468	CD	On-Demand	Anodyne	ADRB2	46	51
O[C@H](CNCCc1cnc(C2CC2)nc1)c1cccnc1	ZINC000819188468	CD	On-Demand	Anodyne	ADRB1	55	49
O[C@H](CNCCc1cnc(C2CC2)nc1)c1cccnc1	ZINC000819188468	CD	On-Demand	Anodyne	ADRB3	150	53
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1OC(F)(F)F	ZINC000819188470	GF	On-Demand	Anodyne	HDAC1	22	45
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1ccc(F)c(Br)c1	ZINC000819188473	GG	On-Demand	Anodyne	ADRB2	25	40
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1ccc(F)c(Br)c1	ZINC000819188473	GG	On-Demand	Anodyne	ADRB3	46	37
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	ZINC000819188474	FD	On-Demand	Anodyne	PANC	61	45
O[C@H](CNCCc1cnc(C2CC2)nc1)c1ccc(F)c(Br)c1	ZINC000819188475	GG	On-Demand	Anodyne	ADRB2	25	40
O[C@H](CNCCc1cnc(C2CC2)nc1)c1ccc(F)c(Br)c1	ZINC000819188475	GG	On-Demand	Anodyne	ADRB3	46	37
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cnn(C[C@H]2CCCO2)c1	ZINC000819188476	FD	On-Demand	Anodyne	PANC	61	45
COc1ccc(OC)c([C@H](O)CNCCCNC(=O)C(C)C)c1	ZINC000819188478	DD	On-Demand	Anodyne	ADRB2	38	47
COc1ccc(OC)c([C@H](O)CNCCCNC(=O)C(C)C)c1	ZINC000819188478	DD	On-Demand	Anodyne	NQO2	23	45
COc1ccc(OC)c([C@H](O)CNCCCNC(=O)C(C)C)c1	ZINC000819188478	DD	On-Demand	Anodyne	MTNR1A	61	45
COc1ccc(OC)c([C@H](O)CNCCCNC(=O)C(C)C)c1	ZINC000819188478	DD	On-Demand	Anodyne	MTNR1B	49	47
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(Cl)o1	ZINC000819188479	DF	On-Demand	Anodyne	RPA1	44	32
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cnn(CC2CC2)c1	ZINC000819188483	ED	On-Demand	Anodyne	RPS6KA3	17	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cnn(CC2CC2)c1	ZINC000819188483	ED	On-Demand	Anodyne	PANC	62	46
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccnc(Oc2ccccc2)c1	ZINC000819188486	GF	On-Demand	Anodyne	LTA4H	40	38
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccnc(Oc2ccccc2)c1	ZINC000819188486	GF	On-Demand	Anodyne	UL80	20	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccnc(Oc2ccccc2)c1	ZINC000819188486	GF	On-Demand	Anodyne	AMP1_PLAFQ	30	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccnc(Oc2ccccc2)c1	ZINC000819188486	GF	On-Demand	Anodyne	PDS	48	33
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cnc(C3CC3)nc2)c1	ZINC000819188487	EE	On-Demand	Bother	ADRB1	46	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cnc(C3CC3)nc2)c1	ZINC000819188487	EE	On-Demand	Bother	ADRB3	108	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc2c(c1)OCCO2	ZINC000819188488	EE	On-Demand	Anodyne	NOS2	89	35
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cnc(C3CC3)nc2)c1	ZINC000819188489	EE	On-Demand	Bother	ADRB1	46	40
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cnc(C3CC3)nc2)c1	ZINC000819188489	EE	On-Demand	Bother	ADRB3	108	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cnn(-c2ccccc2F)c1	ZINC000819188490	GD	On-Demand	Anodyne	PANC	47	36
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819188496	EF	On-Demand	Anodyne	ADRB1	22	45
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819188496	EF	On-Demand	Anodyne	ADRB3	31	45
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819188496	EF	On-Demand	Anodyne	PTGER4	22	42
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819188496	EF	On-Demand	Anodyne	AMP1_PLAFQ	15	42
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1ccc(Cl)cc1	ZINC000819188498	EF	On-Demand	Anodyne	ADRB1	22	45
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1ccc(Cl)cc1	ZINC000819188498	EF	On-Demand	Anodyne	ADRB3	31	45
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1ccc(Cl)cc1	ZINC000819188498	EF	On-Demand	Anodyne	PTGER4	22	42
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1ccc(Cl)cc1	ZINC000819188498	EF	On-Demand	Anodyne	AMP1_PLAFQ	15	42
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CCCCC2)CC1	ZINC000819188501	FG	On-Demand	Anodyne	CHRM1	15	53
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CCCCC2)CC1	ZINC000819188501	FG	On-Demand	Anodyne	DRD4	18	42
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CCCCC2)CC1	ZINC000819188501	FG	On-Demand	Anodyne	CHRM3	20	53
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CCCCC2)CC1	ZINC000819188501	FG	On-Demand	Anodyne	LTA4H	23	41
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CCCCC2)CC1	ZINC000819188501	FG	On-Demand	Anodyne	SIGMAR1	30	40
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CCCCC2)CC1	ZINC000819188501	FG	On-Demand	Anodyne	CCR3	39	46
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CCCCC2)CC1	ZINC000819188501	FG	On-Demand	Anodyne	CCR5	30	45
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CCCCC2)CC1	ZINC000819188501	FG	On-Demand	Anodyne	EPHX2	46	53
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CCCCC2)CC1	ZINC000819188501	FG	On-Demand	Anodyne	CXCR3	20	41
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CCCCC2)CC1	ZINC000819188501	FG	On-Demand	Anodyne	PROC	47	37
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(CC2CCCCC2)CC1	ZINC000819188501	FG	On-Demand	Anodyne	MCHR1	19	49
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1ccccc1	ZINC000819188503	DD	On-Demand	Anodyne	ADRB1	28	55
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1ccccc1	ZINC000819188503	DD	On-Demand	Anodyne	ADRB3	43	55
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1ccccc1	ZINC000819188503	DD	On-Demand	Anodyne	ANPEP	18	48
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1ccccc1	ZINC000819188503	DD	On-Demand	Anodyne	SOAT1	18	40
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1ccccc1	ZINC000819188503	DD	On-Demand	Anodyne	FURIN	50	35
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1ccccc1	ZINC000819188503	DD	On-Demand	Anodyne	NAMPT	15	40
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1ccccc1	ZINC000819188503	DD	On-Demand	Anodyne	TMPRSS11D	80	36
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)c1ccccc1	ZINC000819188503	DD	On-Demand	Anodyne	PDS	48	34
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1ccccc1	ZINC000819188505	DD	On-Demand	Anodyne	ADRB1	28	55
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1ccccc1	ZINC000819188505	DD	On-Demand	Anodyne	ADRB3	43	55
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1ccccc1	ZINC000819188505	DD	On-Demand	Anodyne	ANPEP	18	48
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1ccccc1	ZINC000819188505	DD	On-Demand	Anodyne	SOAT1	18	40
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1ccccc1	ZINC000819188505	DD	On-Demand	Anodyne	FURIN	50	35
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1ccccc1	ZINC000819188505	DD	On-Demand	Anodyne	NAMPT	15	40
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1ccccc1	ZINC000819188505	DD	On-Demand	Anodyne	TMPRSS11D	80	36
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)c1ccccc1	ZINC000819188505	DD	On-Demand	Anodyne	PDS	48	34
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819188513	FF	On-Demand	Anodyne	KIT	15	47
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819188513	FF	On-Demand	Anodyne	PTGER4	17	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819188513	FF	On-Demand	Anodyne	UL80	33	46
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819188513	FF	On-Demand	Anodyne	KDR	18	47
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819188513	FF	On-Demand	Anodyne	SLC1A1	20	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819188513	FF	On-Demand	Anodyne	CCR2	54	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819188513	FF	On-Demand	Anodyne	EPHX2	18	47
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819188513	FF	On-Demand	Anodyne	SLC1A2	32	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819188513	FF	On-Demand	Anodyne	AMP1_PLAFQ	22	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819188513	FF	On-Demand	Anodyne	AKR1C3	26	58
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819188513	FF	On-Demand	Anodyne	KCNK3	51	49
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819188513	FF	On-Demand	Anodyne	PDS	48	44
NC(=O)c1cc(N2CCCCC2)ccc1NC(=O)c1cn(Cc2ccccc2)nn1	ZINC000819188515	HF	On-Demand	Anodyne	KCNQ2	46	37
NC(=O)c1cc(N2CCCCC2)ccc1NC(=O)c1cn(Cc2ccccc2)nn1	ZINC000819188515	HF	On-Demand	Anodyne	STAT6	29	41
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-c2cccnc2)cc1	ZINC000819188516	FG	On-Demand	Anodyne	TBXAS1	42	38
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-c2cccnc2)cc1	ZINC000819188516	FG	On-Demand	Anodyne	PTAFR	21	48
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-c2cccnc2)cc1	ZINC000819188516	FG	On-Demand	Anodyne	CHRNA7	17	43
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-c2cccnc2)cc1	ZINC000819188516	FG	On-Demand	Anodyne	CYP11B2	46	43
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-c2cccnc2)cc1	ZINC000819188516	FG	On-Demand	Anodyne	ROCK2	19	48
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-c2cccnc2)cc1	ZINC000819188516	FG	On-Demand	Anodyne	HDAC1	18	47
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-c2cccnc2)cc1	ZINC000819188516	FG	On-Demand	Anodyne	NAMPT	114	53
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-c2cccnc2)cc1	ZINC000819188516	FG	On-Demand	Anodyne	RPA1	44	32
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1CC(F)(F)F	ZINC000819188517	GF	On-Demand	Anodyne	KCNJ11	43	33
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1CCc2cc(F)ccc21	ZINC000819188519	EG	On-Demand	Anodyne	BDKRB1	45	38
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1ccc(F)c(F)c1	ZINC000819188521	DE	On-Demand	Anodyne	ADRB3	65	39
O[C@H](CNCCc1cnc(C2CC2)nc1)c1ccc(F)c(F)c1	ZINC000819188522	DE	On-Demand	Anodyne	ADRB3	65	39
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2cnc(C3CC3)nc2)CC1	ZINC000819188523	GE	On-Demand	Anodyne	GPR119	49	47
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2cnc(C3CC3)nc2)CC1	ZINC000819188524	GE	On-Demand	Anodyne	GPR119	49	47
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC[C@H](O)c1ccccc1	ZINC000819188527	CD	On-Demand	Anodyne	XIAP	40	38
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC[C@H](O)c1ccccc1	ZINC000819188528	CD	On-Demand	Anodyne	XIAP	40	38
CC[C@H]1CN(C(C)=O)CC[C@H]1NC[C@H](O)c1ccccc1	ZINC000819188529	CD	On-Demand	Anodyne	XIAP	40	38
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC[C@H](O)c1ccccc1	ZINC000819188530	CD	On-Demand	Anodyne	XIAP	40	38
C=CCCOCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819188550	CD	On-Demand	Mild	ADRB3	40	36
C=CCCOCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819188551	CD	On-Demand	Mild	ADRB3	40	36
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1CCc2cc(F)ccc21	ZINC000819188552	EG	On-Demand	Anodyne	BDKRB1	45	38
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(N2CC=CC2)c1	ZINC000819188554	FF	On-Demand	Anodyne	RPA1	50	35
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-n2cncn2)nc1	ZINC000819188555	FD	On-Demand	Anodyne	NAMPT	22	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(CN2CCOCC2)c1	ZINC000819188557	GE	On-Demand	Anodyne	ACHE	28	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(CN2CCOCC2)c1	ZINC000819188557	GE	On-Demand	Anodyne	HRH2	27	48
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(CN2CCOCC2)c1	ZINC000819188557	GE	On-Demand	Anodyne	CHRM3	27	45
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(CN2CCOCC2)c1	ZINC000819188557	GE	On-Demand	Anodyne	SIGMAR1	38	43
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(CN2CCOCC2)c1	ZINC000819188557	GE	On-Demand	Anodyne	CCR3	16	46
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(CN2CCOCC2)c1	ZINC000819188557	GE	On-Demand	Anodyne	EPHX2	27	41
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(CN2CCOCC2)c1	ZINC000819188557	GE	On-Demand	Anodyne	MCHR1	17	42
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(CN2CCOCC2)c1	ZINC000819188557	GE	On-Demand	Anodyne	DPOL_VZVD	24	43
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(CN2CCOCC2)c1	ZINC000819188557	GE	On-Demand	Anodyne	NPFFR1	44	35
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1CCSc2ccc(F)cc21	ZINC000819188558	FH	On-Demand	Anodyne	SSTR3	20	41
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1CCSc2ccc(F)cc21	ZINC000819188559	FH	On-Demand	Anodyne	SSTR3	20	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(-c2cnco2)c1	ZINC000819188566	FE	On-Demand	Anodyne	PTGIR	16	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(-c2cnco2)c1	ZINC000819188566	FE	On-Demand	Anodyne	PTPN11	43	34
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H]1CCN(C2CC2)C1	ZINC000819188569	DD	On-Demand	Anodyne	CCR3	22	41
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H]1CCN(C2CC2)C1	ZINC000819188569	DD	On-Demand	Anodyne	PROC	47	34
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H]1CCN(C2CC2)C1	ZINC000819188569	DD	On-Demand	Anodyne	CACNA1I	58	37
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H]1CCN(C2CC2)C1	ZINC000819188570	DD	On-Demand	Anodyne	CCR3	22	41
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H]1CCN(C2CC2)C1	ZINC000819188570	DD	On-Demand	Anodyne	PROC	47	34
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H]1CCN(C2CC2)C1	ZINC000819188570	DD	On-Demand	Anodyne	CACNA1I	58	37
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(Cl)c1	ZINC000819188571	EE	On-Demand	Anodyne	ADRB3	15	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(Cl)c1	ZINC000819188571	EE	On-Demand	Anodyne	UL80	30	44
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(Cl)c1	ZINC000819188571	EE	On-Demand	Anodyne	FBP1	18	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(Cl)c1	ZINC000819188571	EE	On-Demand	Anodyne	AMP1_PLAFQ	25	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(Cl)c1	ZINC000819188571	EE	On-Demand	Anodyne	TAAR1	26	47
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(Cl)c1	ZINC000819188571	EE	On-Demand	Anodyne	AKR1C3	29	50
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(Cl)c1	ZINC000819188571	EE	On-Demand	Anodyne	KCNK3	54	45
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(Cl)c1	ZINC000819188571	EE	On-Demand	Anodyne	PDS	44	37
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(OCC(F)F)cc1	ZINC000819188574	GE	On-Demand	Anodyne	LTA4H	39	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(OCC(F)F)cc1	ZINC000819188574	GE	On-Demand	Anodyne	PDS	63	39
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc2ccccc12	ZINC000819188576	EF	On-Demand	Anodyne	KCNJ11	60	33
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc2ccccc12	ZINC000819188576	EF	On-Demand	Anodyne	TRPV1	25	49
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc2ccccc12	ZINC000819188576	EF	On-Demand	Anodyne	UL80	32	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc2ccccc12	ZINC000819188576	EF	On-Demand	Anodyne	HDAC2	24	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc2ccccc12	ZINC000819188576	EF	On-Demand	Anodyne	CASP9	15	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc2ccccc12	ZINC000819188576	EF	On-Demand	Anodyne	TPSAB1	15	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc2ccccc12	ZINC000819188576	EF	On-Demand	Anodyne	HDAH	19	44
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc2ccccc12	ZINC000819188576	EF	On-Demand	Anodyne	GPR35	16	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1cc(-c2ccccc2)no1	ZINC000819188577	FG	On-Demand	Anodyne	HDAC1	27	41
O=C(NCc1ccc(C(=O)O)cc1)NCc1cc(-c2ccccc2)no1	ZINC000819188577	FG	On-Demand	Anodyne	HDAC2	26	41
O=C(NCc1ccc(C(=O)O)cc1)NCc1cc(-c2ccccc2)no1	ZINC000819188577	FG	On-Demand	Anodyne	NAMPT	15	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000819188578	FF	On-Demand	Anodyne	TBXAS1	19	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000819188578	FF	On-Demand	Anodyne	NOS2	97	36
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819188580	GG	On-Demand	Anodyne	LTA4H	77	56
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819188580	GG	On-Demand	Anodyne	CA1	26	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819188580	GG	On-Demand	Anodyne	MMP13	15	44
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819188580	GG	On-Demand	Anodyne	UL80	28	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819188580	GG	On-Demand	Anodyne	RAF1	19	46
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819188580	GG	On-Demand	Anodyne	FAAH	20	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819188580	GG	On-Demand	Anodyne	NPY5R	27	47
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819188580	GG	On-Demand	Anodyne	ACR	54	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819188580	GG	On-Demand	Anodyne	AMP1_PLAFQ	42	44
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819188580	GG	On-Demand	Anodyne	F13A1	21	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819188580	GG	On-Demand	Anodyne	NOD2	40	36
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819188580	GG	On-Demand	Anodyne	NAMPT	27	51
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819188580	GG	On-Demand	Anodyne	PDS	45	35
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-n2ccnc2)cc1	ZINC000819188583	FF	On-Demand	Anodyne	TBXAS1	28	54
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-n2ccnc2)cc1	ZINC000819188583	FF	On-Demand	Anodyne	NOS2	96	38
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-n2ccnc2)cc1	ZINC000819188583	FF	On-Demand	Anodyne	NAMPT	31	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(-n2ccnc2)cc1	ZINC000819188583	FF	On-Demand	Anodyne	RPA1	57	34
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(N2CCCC2)cc1	ZINC000819188584	FF	On-Demand	Clean	AVPR2	15	41
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(N2CCCC2)cc1	ZINC000819188584	FF	On-Demand	Clean	NAMPT	31	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(N2CCCC2)cc1	ZINC000819188584	FF	On-Demand	Clean	RPA1	40	33
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(C2CCCC2)CC1	ZINC000819188587	EF	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(C2CCCC2)CC1	ZINC000819188587	EF	On-Demand	Anodyne	CCR2	15	40
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(C2CCCC2)CC1	ZINC000819188587	EF	On-Demand	Anodyne	SLC6A5	36	44
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(C2CCCC2)CC1	ZINC000819188587	EF	On-Demand	Anodyne	EPHX2	48	53
O=C(NCc1ccc(C(=O)O)cc1)NC1CCN(C2CCCC2)CC1	ZINC000819188587	EF	On-Demand	Anodyne	L3MBTL3	82	38
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1C(F)(F)F	ZINC000819188589	FF	On-Demand	Anodyne	TRPV1	17	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1C(F)(F)F	ZINC000819188589	FF	On-Demand	Anodyne	HDAC1	18	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1C(F)(F)F	ZINC000819188589	FF	On-Demand	Anodyne	NR1H3	19	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1C(F)(F)F	ZINC000819188589	FF	On-Demand	Anodyne	RBP4	59	37
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1nc(-c2cccs2)cs1	ZINC000819188590	GF	On-Demand	Anodyne	MPL	46	34
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1nc(-c2cccs2)cs1	ZINC000819188590	GF	On-Demand	Anodyne	ROCK1	22	48
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1nc(-c2cccs2)cs1	ZINC000819188590	GF	On-Demand	Anodyne	ROCK2	15	48
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1nc(-c2cccs2)cs1	ZINC000819188590	GF	On-Demand	Anodyne	HDAC1	15	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1nc(-c2cccs2)cs1	ZINC000819188590	GF	On-Demand	Anodyne	RPS6KB2	33	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2c(c1)OCO2	ZINC000819188591	ED	On-Demand	Anodyne	EDNRA	33	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2c(c1)OCO2	ZINC000819188591	ED	On-Demand	Anodyne	NOS2	94	35
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](CO)Cc1ccccc1	ZINC000819188592	EE	On-Demand	Anodyne	MME	44	40
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](CO)Cc1ccccc1	ZINC000819188592	EE	On-Demand	Anodyne	CTRB1	17	41
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](CO)Cc1ccccc1	ZINC000819188592	EE	On-Demand	Anodyne	PROC	40	36
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](CO)Cc1ccccc1	ZINC000819188592	EE	On-Demand	Anodyne	AMP1_PLAFQ	38	42
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](CO)Cc1ccccc1	ZINC000819188592	EE	On-Demand	Anodyne	PDS	40	32
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](CO)Cc1ccccc1	ZINC000819188593	EE	On-Demand	Anodyne	MME	44	40
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](CO)Cc1ccccc1	ZINC000819188593	EE	On-Demand	Anodyne	CTRB1	17	41
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](CO)Cc1ccccc1	ZINC000819188593	EE	On-Demand	Anodyne	PROC	40	36
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](CO)Cc1ccccc1	ZINC000819188593	EE	On-Demand	Anodyne	AMP1_PLAFQ	38	42
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](CO)Cc1ccccc1	ZINC000819188593	EE	On-Demand	Anodyne	PDS	40	32
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1OCC(F)F	ZINC000819188594	GE	On-Demand	Anodyne	AMP1_PLAFQ	22	40
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1OCC(F)F	ZINC000819188594	GE	On-Demand	Anodyne	PDS	57	39
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(N2CCOCC2)cc1	ZINC000819188596	FE	On-Demand	Clean	PIK3CA	27	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(N2CCOCC2)cc1	ZINC000819188596	FE	On-Demand	Clean	MTOR	46	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(N2CCOCC2)cc1	ZINC000819188596	FE	On-Demand	Clean	EPHX2	16	42
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(N2CCOCC2)cc1	ZINC000819188596	FE	On-Demand	Clean	PIK3CG	22	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(N2CCOCC2)cc1	ZINC000819188596	FE	On-Demand	Clean	AKR1C3	16	42
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(N2CCOCC2)cc1	ZINC000819188596	FE	On-Demand	Clean	STAT6	63	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(N2CCOCC2)cc1	ZINC000819188596	FE	On-Demand	Clean	RPA1	45	32
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](CO)Cc1ccccc1	ZINC000819188600	ED	On-Demand	Anodyne	MME	92	46
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](CO)Cc1ccccc1	ZINC000819188600	ED	On-Demand	Anodyne	ANPEP	62	36
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](CO)Cc1ccccc1	ZINC000819188600	ED	On-Demand	Anodyne	PAPA1_CARPA	31	40
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](CO)Cc1ccccc1	ZINC000819188600	ED	On-Demand	Anodyne	CTRB1	26	42
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](CO)Cc1ccccc1	ZINC000819188600	ED	On-Demand	Anodyne	FURIN	50	36
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](CO)Cc1ccccc1	ZINC000819188600	ED	On-Demand	Anodyne	PROC	41	39
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](CO)Cc1ccccc1	ZINC000819188600	ED	On-Demand	Anodyne	AMP1_PLAFQ	46	43
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](CO)Cc1ccccc1	ZINC000819188600	ED	On-Demand	Anodyne	TMPRSS11D	54	39
O=C(NCc1ccc(C(=O)O)cc1)N[C@H](CO)Cc1ccccc1	ZINC000819188600	ED	On-Demand	Anodyne	PDS	46	33
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](CO)Cc1ccccc1	ZINC000819188601	ED	On-Demand	Anodyne	MME	92	46
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](CO)Cc1ccccc1	ZINC000819188601	ED	On-Demand	Anodyne	ANPEP	62	36
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](CO)Cc1ccccc1	ZINC000819188601	ED	On-Demand	Anodyne	PAPA1_CARPA	31	40
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](CO)Cc1ccccc1	ZINC000819188601	ED	On-Demand	Anodyne	CTRB1	26	42
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](CO)Cc1ccccc1	ZINC000819188601	ED	On-Demand	Anodyne	FURIN	50	36
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](CO)Cc1ccccc1	ZINC000819188601	ED	On-Demand	Anodyne	PROC	41	39
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](CO)Cc1ccccc1	ZINC000819188601	ED	On-Demand	Anodyne	AMP1_PLAFQ	46	43
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](CO)Cc1ccccc1	ZINC000819188601	ED	On-Demand	Anodyne	TMPRSS11D	54	39
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H](CO)Cc1ccccc1	ZINC000819188601	ED	On-Demand	Anodyne	PDS	46	33
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OCCF)c1	ZINC000819188602	FD	On-Demand	Anodyne	ADRB1	16	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OCCF)c1	ZINC000819188602	FD	On-Demand	Anodyne	UL80	26	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OCCF)c1	ZINC000819188602	FD	On-Demand	Anodyne	PLA2G4B	44	34
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OCCF)c1	ZINC000819188602	FD	On-Demand	Anodyne	EPHX2	22	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OCCF)c1	ZINC000819188602	FD	On-Demand	Anodyne	TAAR1	42	39
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(OCCF)c1	ZINC000819188602	FD	On-Demand	Anodyne	PDS	61	43
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819188603	GF	On-Demand	Anodyne	AVPR2	16	43
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819188603	GF	On-Demand	Anodyne	PREP	18	50
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819188603	GF	On-Demand	Anodyne	EPHX2	21	45
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819188603	GF	On-Demand	Anodyne	DPP7	48	37
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819188603	GF	On-Demand	Anodyne	MLYCD	22	50
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819188603	GF	On-Demand	Anodyne	L3MBTL3	90	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819188603	GF	On-Demand	Anodyne	NAMPT	32	53
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1Cc1ccccc1	ZINC000819188604	GG	On-Demand	Anodyne	HDAC1	19	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1Cc1ccccc1	ZINC000819188604	GG	On-Demand	Anodyne	HDAC2	20	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccccc1Cc1ccccc1	ZINC000819188604	GG	On-Demand	Anodyne	FURIN	46	34
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccnc1N1CCOCC1	ZINC000819188608	GC	On-Demand	Anodyne	PIK3CA	51	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccnc1N1CCOCC1	ZINC000819188608	GC	On-Demand	Anodyne	MTOR	65	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccnc1N1CCOCC1	ZINC000819188608	GC	On-Demand	Anodyne	PIK3CG	28	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccnc1N1CCOCC1	ZINC000819188608	GC	On-Demand	Anodyne	SCN10A	19	43
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccnc1N1CCOCC1	ZINC000819188608	GC	On-Demand	Anodyne	NAMPT	31	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2ncccc2c1	ZINC000819188610	EE	On-Demand	Anodyne	PPIA	28	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2ncccc2c1	ZINC000819188610	EE	On-Demand	Anodyne	TRPV1	18	45
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2ncccc2c1	ZINC000819188610	EE	On-Demand	Anodyne	UL80	35	41
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc2ncccc2c1	ZINC000819188610	EE	On-Demand	Anodyne	NAMPT	42	38
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccc(CC(F)(F)F)c1	ZINC000819188611	GF	On-Demand	Anodyne	KCNK3	42	35
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccnc1Oc1ccccc1	ZINC000819188612	GF	On-Demand	Anodyne	P2RY1	55	44
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1cccnc1Oc1ccccc1	ZINC000819188612	GF	On-Demand	Anodyne	NAMPT	41	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(Oc2ccccc2)nc1	ZINC000819188613	GH	On-Demand	Anodyne	ACACB	19	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(Oc2ccccc2)nc1	ZINC000819188613	GH	On-Demand	Anodyne	NAMPT	40	46
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccc(Oc2ccccc2)nc1	ZINC000819188613	GH	On-Demand	Anodyne	PDS	55	36
O=C(NCc1ccc(C(=O)O)cc1)NC[C@H](O)CN1CCCCC1	ZINC000819188614	ED	On-Demand	Anodyne	ABCB1	20	42
O=C(NCc1ccc(C(=O)O)cc1)NC[C@@H](O)CN1CCCCC1	ZINC000819188615	ED	On-Demand	Anodyne	ABCB1	20	42
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Oc2ccncc2)cc1	ZINC000819188624	GF	On-Demand	Anodyne	LTA4H	56	45
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Oc2ccncc2)cc1	ZINC000819188624	GF	On-Demand	Anodyne	RAF1	31	44
O=C(NCc1ccc(C(=O)O)cc1)C(=O)Nc1ccc(Oc2ccncc2)cc1	ZINC000819188624	GF	On-Demand	Anodyne	NAMPT	31	48
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1CCN(C2CCOCC2)C1=O	ZINC000819188625	FC	On-Demand	Anodyne	PLG	43	31
O=C(NCc1ccc(C(=O)O)cc1)N[C@H]1CCN(C2CCOCC2)C1=O	ZINC000819188625	FC	On-Demand	Anodyne	TRYP_PIG	45	31
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1CCN(C2CCOCC2)C1=O	ZINC000819188626	FC	On-Demand	Anodyne	PLG	43	31
O=C(NCc1ccc(C(=O)O)cc1)N[C@@H]1CCN(C2CCOCC2)C1=O	ZINC000819188626	FC	On-Demand	Anodyne	TRYP_PIG	45	31
O=[N+]([O-])c1cccc([C@@H](O)CNCC2CCS(=O)(=O)CC2)c1	ZINC000819188640	ED	On-Demand	Bother	CACNA1D	45	35
O=[N+]([O-])c1cccc([C@H](O)CNCC2CCS(=O)(=O)CC2)c1	ZINC000819188641	ED	On-Demand	Bother	CACNA1D	45	35
Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccc(N2CCCCC2)cc1C(N)=O	ZINC000819188642	HH	On-Demand	Anodyne	PPARG	70	42
Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccc(N2CCCCC2)cc1C(N)=O	ZINC000819188642	HH	On-Demand	Anodyne	PPARA	75	40
Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccc(N2CCCCC2)cc1C(N)=O	ZINC000819188642	HH	On-Demand	Anodyne	PDE8B	63	37
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1cccc(Br)c1	ZINC000819188648	FF	On-Demand	Anodyne	ADRB2	39	42
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1cccc(Br)c1	ZINC000819188648	FF	On-Demand	Anodyne	ADRB1	43	41
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1cccc(Br)c1	ZINC000819188648	FF	On-Demand	Anodyne	ADRB3	92	42
O[C@H](CNCCc1cnc(C2CC2)nc1)c1cccc(Br)c1	ZINC000819188649	FF	On-Demand	Anodyne	ADRB2	39	42
O[C@H](CNCCc1cnc(C2CC2)nc1)c1cccc(Br)c1	ZINC000819188649	FF	On-Demand	Anodyne	ADRB1	43	41
O[C@H](CNCCc1cnc(C2CC2)nc1)c1cccc(Br)c1	ZINC000819188649	FF	On-Demand	Anodyne	ADRB3	92	42
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1ccc(OC(F)(F)F)cc1	ZINC000819188654	FG	On-Demand	Anodyne	ADRB2	34	40
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1ccc(OC(F)(F)F)cc1	ZINC000819188654	FG	On-Demand	Anodyne	ADRB3	59	44
O[C@H](CNCCc1cnc(C2CC2)nc1)c1ccc(OC(F)(F)F)cc1	ZINC000819188655	FG	On-Demand	Anodyne	ADRB2	34	40
O[C@H](CNCCc1cnc(C2CC2)nc1)c1ccc(OC(F)(F)F)cc1	ZINC000819188655	FG	On-Demand	Anodyne	ADRB3	59	44
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C1CCC1	ZINC000819188680	EF	On-Demand	Anodyne	GPR119	41	47
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C1CCC1	ZINC000819188682	EF	On-Demand	Anodyne	GPR119	41	47
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1ccc(Cl)c(F)c1	ZINC000819188730	EG	On-Demand	Anodyne	ADRB3	50	39
O[C@H](CNCCc1cnc(C2CC2)nc1)c1ccc(Cl)c(F)c1	ZINC000819188731	EG	On-Demand	Anodyne	ADRB3	50	39
CN1Cc2ccccc2[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819188732	CD	On-Demand	Anodyne	ADRB3	56	40
CN1Cc2ccccc2[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819188733	CD	On-Demand	Anodyne	ADRB3	56	40
CN1Cc2ccccc2[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819188734	CD	On-Demand	Anodyne	ADRB3	56	40
CN1Cc2ccccc2[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819188735	CD	On-Demand	Anodyne	ADRB3	56	40
NC(=O)c1cc(N2CCCCC2)ccc1NC(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1	ZINC000819188741	JK	On-Demand	Anodyne	KCNQ2	22	40
NC(=O)c1cc(N2CCCCC2)ccc1NC(=O)Cc1cnn(-c2ccccc2)c1	ZINC000819188742	HG	On-Demand	Anodyne	KCNQ2	30	42
NC(=O)c1cc(N2CCCCC2)ccc1NC(=O)Cc1cnn(-c2ccccc2)c1	ZINC000819188742	HG	On-Demand	Anodyne	HCAR2	15	49
NC(=O)c1cc(N2CCCCC2)ccc1NC(=O)Cc1cnn(-c2ccccc2)c1	ZINC000819188742	HG	On-Demand	Anodyne	STAT6	42	41
O[C@@H](CNCCCOc1ncc(C(F)(F)F)cc1Cl)c1ccccc1	ZINC000819188743	FH	On-Demand	Anodyne	ADRB1	40	43
O[C@@H](CNCCCOc1ncc(C(F)(F)F)cc1Cl)c1ccccc1	ZINC000819188743	FH	On-Demand	Anodyne	ADRB3	51	43
O[C@H](CNCCCOc1ncc(C(F)(F)F)cc1Cl)c1ccccc1	ZINC000819188744	FH	On-Demand	Anodyne	ADRB1	40	43
O[C@H](CNCCCOc1ncc(C(F)(F)F)cc1Cl)c1ccccc1	ZINC000819188744	FH	On-Demand	Anodyne	ADRB3	51	43
O[C@@H](CNCC12CCC(CC1)C2)c1cccnc1	ZINC000819188745	BE	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNCC12CCC(CC1)C2)c1cccnc1	ZINC000819188745	BE	On-Demand	Anodyne	ADRB1	21	41
O[C@@H](CNCC12CCC(CC1)C2)c1cccnc1	ZINC000819188745	BE	On-Demand	Anodyne	ADRB3	83	42
O[C@H](CNCC12CCC(CC1)C2)c1cccnc1	ZINC000819188746	BE	On-Demand	Anodyne	ADRB2	19	40
O[C@H](CNCC12CCC(CC1)C2)c1cccnc1	ZINC000819188746	BE	On-Demand	Anodyne	ADRB1	21	41
O[C@H](CNCC12CCC(CC1)C2)c1cccnc1	ZINC000819188746	BE	On-Demand	Anodyne	ADRB3	83	42
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)[C@H]1COc2ccccc21	ZINC000819188747	GG	On-Demand	Anodyne	GPR119	42	47
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)[C@@H]1COc2ccccc21	ZINC000819188753	GG	On-Demand	Anodyne	GPR119	42	47
O[C@@H](CNCCC1Cc2ccccc2C1)c1cccc(F)c1	ZINC000819188777	CG	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CNCCC1Cc2ccccc2C1)c1cccc(F)c1	ZINC000819188777	CG	On-Demand	Anodyne	ADRB3	38	40
O[C@H](CNCCC1Cc2ccccc2C1)c1cccc(F)c1	ZINC000819188779	CG	On-Demand	Anodyne	ADRB1	20	40
O[C@H](CNCCC1Cc2ccccc2C1)c1cccc(F)c1	ZINC000819188779	CG	On-Demand	Anodyne	ADRB3	38	40
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1cccc(C(F)(F)F)c1	ZINC000819188818	FG	On-Demand	Anodyne	ADRB2	34	40
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1cccc(C(F)(F)F)c1	ZINC000819188818	FG	On-Demand	Anodyne	ADRB1	39	41
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1cccc(C(F)(F)F)c1	ZINC000819188818	FG	On-Demand	Anodyne	ADRB3	85	41
O[C@H](CNCCc1cnc(C2CC2)nc1)c1cccc(C(F)(F)F)c1	ZINC000819188823	FG	On-Demand	Anodyne	ADRB2	34	40
O[C@H](CNCCc1cnc(C2CC2)nc1)c1cccc(C(F)(F)F)c1	ZINC000819188823	FG	On-Demand	Anodyne	ADRB1	39	41
O[C@H](CNCCc1cnc(C2CC2)nc1)c1cccc(C(F)(F)F)c1	ZINC000819188823	FG	On-Demand	Anodyne	ADRB3	85	41
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@@H]2CCN(c3ccccn3)C2)CC1	ZINC000819188875	GE	On-Demand	Anodyne	GPR119	33	56
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@H]2CCN(c3ccccn3)C2)CC1	ZINC000819188879	GE	On-Demand	Anodyne	GPR119	33	56
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@@H]2CCN(c3ccccn3)C2)CC1	ZINC000819188882	GE	On-Demand	Anodyne	GPR119	33	56
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@H]2CCN(c3ccccn3)C2)CC1	ZINC000819188885	GE	On-Demand	Anodyne	GPR119	33	56
Cc1cc(F)ccc1[C@@H](O)CNCCCNC(=O)C(C)C	ZINC000819188890	CD	On-Demand	Anodyne	GRIA1	42	30
Cc1cc(F)ccc1[C@@H](O)CNCCCNC(=O)C(C)C	ZINC000819188890	CD	On-Demand	Anodyne	LEF	114	36
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819188898	FD	On-Demand	Anodyne	LRRK2	34	44
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819188900	FD	On-Demand	Anodyne	LRRK2	34	44
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819188902	FD	On-Demand	Anodyne	LRRK2	34	44
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819188904	FD	On-Demand	Anodyne	LRRK2	34	44
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@H]1CCN(c2ccccn2)C1	ZINC000819188916	FD	On-Demand	Anodyne	SFRP1	42	33
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@@H]1CCN(c2ccccn2)C1	ZINC000819188919	FD	On-Demand	Anodyne	SFRP1	42	33
CC(=O)Nc1cccc(CC(=O)N(CCc2ccccc2)C2CC2)c1	ZINC000819188931	EG	On-Demand	Anodyne	NA	17	44
CC(=O)Nc1cccc(CC(=O)N(CCc2ccccc2)C2CC2)c1	ZINC000819188931	EG	On-Demand	Anodyne	PTGIR	15	40
CC(=O)Nc1cccc(CC(=O)N(CCc2ccccc2)C2CC2)c1	ZINC000819188931	EG	On-Demand	Anodyne	CCR5	21	40
CC(=O)Nc1cccc(CC(=O)N(CCc2ccccc2)C2CC2)c1	ZINC000819188931	EG	On-Demand	Anodyne	MBTPS1	49	35
CC(=O)Nc1cccc(CC(=O)N(CCc2ccccc2)C2CC2)c1	ZINC000819188931	EG	On-Demand	Anodyne	KCNK3	41	33
O=S1(=O)CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819188935	DD	On-Demand	Anodyne	ADRB2	33	40
O=S1(=O)CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819188935	DD	On-Demand	Anodyne	ADRB1	54	46
O=S1(=O)CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819188935	DD	On-Demand	Anodyne	ADRB3	66	46
O=S1(=O)CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819188935	DD	On-Demand	Anodyne	CYP3A4	45	34
O=S1(=O)CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819188938	DD	On-Demand	Anodyne	ADRB2	33	40
O=S1(=O)CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819188938	DD	On-Demand	Anodyne	ADRB1	54	46
O=S1(=O)CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819188938	DD	On-Demand	Anodyne	ADRB3	66	46
O=S1(=O)CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819188938	DD	On-Demand	Anodyne	CYP3A4	45	34
Cc1oc(-c2ccccc2)nc1CC(=O)n1ccccc1=NC1CCCCC1	ZINC000819188946	GJ	On-Demand	Anodyne	PPARG	75	41
Cc1oc(-c2ccccc2)nc1CC(=O)n1ccccc1=NC1CCCCC1	ZINC000819188946	GJ	On-Demand	Anodyne	PPARA	80	40
Cc1oc(-c2ccccc2)nc1CC(=O)n1ccccc1=NC1CCCCC1	ZINC000819188946	GJ	On-Demand	Anodyne	PDE8B	64	39
C[C@H](CNC[C@H](O)c1ccc(Cl)c(F)c1)S(C)(=O)=O	ZINC000819188955	DD	On-Demand	Anodyne	ADRB3	27	41
C[C@H](CNC[C@@H](O)c1ccc(Cl)c(F)c1)S(C)(=O)=O	ZINC000819188958	DD	On-Demand	Anodyne	ADRB3	27	41
C[C@@H](CNC[C@@H](O)c1ccc(Cl)c(F)c1)S(C)(=O)=O	ZINC000819188961	DD	On-Demand	Anodyne	ADRB3	27	41
C[C@@H](CNC[C@H](O)c1ccc(Cl)c(F)c1)S(C)(=O)=O	ZINC000819188964	DD	On-Demand	Anodyne	ADRB3	27	41
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(c2ccccn2)C1	ZINC000819188972	CE	On-Demand	Anodyne	EBP	25	42
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(c2ccccn2)C1	ZINC000819188975	CE	On-Demand	Anodyne	EBP	25	42
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccccc1Cl	ZINC000819188976	DF	On-Demand	Anodyne	ADRB3	15	43
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccccc1Cl	ZINC000819188976	DF	On-Demand	Anodyne	EBP	23	42
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccccc1Cl	ZINC000819188977	DF	On-Demand	Anodyne	ADRB3	15	43
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccccc1Cl	ZINC000819188977	DF	On-Demand	Anodyne	EBP	23	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCC2=CCCC2)c1	ZINC000819188981	CF	On-Demand	Bother	ADRB3	54	37
O=[N+]([O-])c1cccc([C@H](O)CNCCC2=CCCC2)c1	ZINC000819188983	CF	On-Demand	Bother	ADRB3	54	37
C[C@H](CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)S(C)(=O)=O	ZINC000819188990	ED	On-Demand	Anodyne	ADRB3	30	44
C[C@@H](CNC[C@H](O)c1ccc(OC(F)(F)F)cc1)S(C)(=O)=O	ZINC000819188992	ED	On-Demand	Anodyne	ADRB3	30	44
C[C@@H](CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)S(C)(=O)=O	ZINC000819188994	ED	On-Demand	Anodyne	ADRB3	30	44
C[C@H](CNC[C@H](O)c1ccc(OC(F)(F)F)cc1)S(C)(=O)=O	ZINC000819188996	ED	On-Demand	Anodyne	ADRB3	30	44
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1cccnc1	ZINC000819188999	CD	On-Demand	Anodyne	ADRB3	67	50
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1cccnc1	ZINC000819189001	CD	On-Demand	Anodyne	ADRB3	67	50
O[C@H](CN[C@@H]1CCN(c2ccccn2)C1)c1cccnc1	ZINC000819189003	CD	On-Demand	Anodyne	ADRB3	67	50
O[C@H](CN[C@H]1CCN(c2ccccn2)C1)c1cccnc1	ZINC000819189005	CD	On-Demand	Anodyne	ADRB3	67	50
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1ccc(Cl)cc1	ZINC000819189042	DF	On-Demand	Anodyne	ADRB2	28	44
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1ccc(Cl)cc1	ZINC000819189042	DF	On-Demand	Anodyne	ADRB1	35	41
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1ccc(Cl)cc1	ZINC000819189042	DF	On-Demand	Anodyne	ADRB3	65	42
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	CELA1	17	42
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	CTSD	145	47
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	PGC	89	43
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	CMA1	32	43
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	CTRA_BOVIN	20	43
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	PAPA1_CARPA	36	44
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	CCKAR	35	41
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	CTSK	24	47
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	CTSL	25	44
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	PGA	62	43
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	BACE2	60	47
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	TACR3	21	40
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	CAPNS1	67	30
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	ECE1	41	42
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	REN	168	55
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	REN1	62	50
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	CAPN1	51	41
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	CAPN2	44	35
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	CTSE	60	40
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	BACE1	97	46
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	PGA5	60	34
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	FPR1	65	50
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	PLM1_PLAFA	37	49
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	PLM2_PLAFA	45	35
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCC1	ZINC000819189047	FG	On-Demand	Anodyne	Q82323_9DELA	58	30
COc1ccc(OC)c([C@H](O)CNCCc2cnc(C3CC3)nc2)c1	ZINC000819189062	EE	On-Demand	Anodyne	ADRB2	33	49
COc1ccc(OC)c([C@H](O)CNCCc2cnc(C3CC3)nc2)c1	ZINC000819189062	EE	On-Demand	Anodyne	ADRB1	38	42
O=C(/C=C/[C@@H]1CCCO1)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000819189063	ED	On-Demand	Anodyne	ADAM10	32	40
O=C(/C=C\[C@@H]1CCCO1)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000819189066	ED	On-Demand	Anodyne	ADAM10	32	40
O=C(/C=C/[C@H]1CCCO1)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000819189069	ED	On-Demand	Anodyne	ADAM10	32	40
O=C(/C=C\[C@H]1CCCO1)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000819189071	ED	On-Demand	Anodyne	ADAM10	32	40
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1cccc(Cl)c1	ZINC000819189075	DF	On-Demand	Anodyne	ADRB2	63	40
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1cccc(Cl)c1	ZINC000819189075	DF	On-Demand	Anodyne	ADRB1	79	55
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1cccc(Cl)c1	ZINC000819189075	DF	On-Demand	Anodyne	ADRB3	130	56
O[C@H](CNCCc1cnc(C2CC2)nc1)c1cccc(Cl)c1	ZINC000819189077	DF	On-Demand	Anodyne	ADRB2	63	40
O[C@H](CNCCc1cnc(C2CC2)nc1)c1cccc(Cl)c1	ZINC000819189077	DF	On-Demand	Anodyne	ADRB1	79	55
O[C@H](CNCCc1cnc(C2CC2)nc1)c1cccc(Cl)c1	ZINC000819189077	DF	On-Demand	Anodyne	ADRB3	130	56
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cnc(C3CC3)nc2)cc1	ZINC000819189171	FD	On-Demand	Anodyne	ADRB2	53	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cnc(C3CC3)nc2)cc1	ZINC000819189171	FD	On-Demand	Anodyne	ADRB1	50	39
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cnc(C3CC3)nc2)cc1	ZINC000819189171	FD	On-Demand	Anodyne	ADRB3	132	42
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cnc(C3CC3)nc2)cc1	ZINC000819189173	FD	On-Demand	Anodyne	ADRB2	53	42
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cnc(C3CC3)nc2)cc1	ZINC000819189173	FD	On-Demand	Anodyne	ADRB1	50	39
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cnc(C3CC3)nc2)cc1	ZINC000819189173	FD	On-Demand	Anodyne	ADRB3	132	42
CS(=O)(=O)N1CCC[C@@H]1CNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819189203	GD	On-Demand	Anodyne	EPHX2	26	40
CS(=O)(=O)N1CCC[C@@H]1CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819189207	GD	On-Demand	Anodyne	EPHX2	26	40
Cc1cc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)ncn1	ZINC000819189208	FD	On-Demand	Anodyne	GPR119	76	46
Cc1cc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)ncn1	ZINC000819189211	FD	On-Demand	Anodyne	GPR119	76	46
O=S(=O)(c1cccc(F)c1)N(CCCNC[C@H](O)c1cccnc1)C1CC1	ZINC000819189212	GE	On-Demand	Anodyne	ADRB2	32	42
O=S(=O)(c1cccc(F)c1)N(CCCNC[C@H](O)c1cccnc1)C1CC1	ZINC000819189212	GE	On-Demand	Anodyne	ADRB1	33	41
O=S(=O)(c1cccc(F)c1)N(CCCNC[C@H](O)c1cccnc1)C1CC1	ZINC000819189212	GE	On-Demand	Anodyne	ADRB3	104	45
O=S(=O)(c1cccc(F)c1)N(CCCNC[C@@H](O)c1cccnc1)C1CC1	ZINC000819189213	GE	On-Demand	Anodyne	ADRB2	32	42
O=S(=O)(c1cccc(F)c1)N(CCCNC[C@@H](O)c1cccnc1)C1CC1	ZINC000819189213	GE	On-Demand	Anodyne	ADRB1	33	41
O=S(=O)(c1cccc(F)c1)N(CCCNC[C@@H](O)c1cccnc1)C1CC1	ZINC000819189213	GE	On-Demand	Anodyne	ADRB3	104	45
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1ccc(Br)cc1	ZINC000819189239	FF	On-Demand	Anodyne	ADRB2	27	47
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1ccc(Br)cc1	ZINC000819189239	FF	On-Demand	Anodyne	ADRB3	52	42
O[C@H](CNCCc1cnc(C2CC2)nc1)c1ccc(Br)cc1	ZINC000819189240	FF	On-Demand	Anodyne	ADRB2	27	47
O[C@H](CNCCc1cnc(C2CC2)nc1)c1ccc(Br)cc1	ZINC000819189240	FF	On-Demand	Anodyne	ADRB3	52	42
Cc1cc(F)ccc1[C@@H](O)CNCCOCc1ccc(Cl)cc1	ZINC000819189276	EH	On-Demand	Anodyne	ADRB2	22	48
Cc1cc(F)ccc1[C@@H](O)CNCCOCc1ccc(Cl)cc1	ZINC000819189276	EH	On-Demand	Anodyne	LEF	48	35
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1cc(F)ccc1F	ZINC000819189277	EG	On-Demand	Anodyne	ADRB2	15	49
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1cc(F)ccc1F	ZINC000819189277	EG	On-Demand	Anodyne	ADRB1	26	40
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1cc(F)ccc1F	ZINC000819189277	EG	On-Demand	Anodyne	ADRB3	24	40
O[C@H](CNCCOCc1ccc(Cl)cc1)c1cc(F)ccc1F	ZINC000819189278	EG	On-Demand	Anodyne	ADRB2	15	49
O[C@H](CNCCOCc1ccc(Cl)cc1)c1cc(F)ccc1F	ZINC000819189278	EG	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CNCCOCc1ccc(Cl)cc1)c1cc(F)ccc1F	ZINC000819189278	EG	On-Demand	Anodyne	ADRB3	24	40
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1ccc(C(F)(F)F)cc1	ZINC000819189283	FG	On-Demand	Anodyne	ADRB2	22	40
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1ccc(C(F)(F)F)cc1	ZINC000819189283	FG	On-Demand	Anodyne	ADRB3	43	40
O[C@H](CNCCc1cnc(C2CC2)nc1)c1ccc(C(F)(F)F)cc1	ZINC000819189284	FG	On-Demand	Anodyne	ADRB2	22	40
O[C@H](CNCCc1cnc(C2CC2)nc1)c1ccc(C(F)(F)F)cc1	ZINC000819189284	FG	On-Demand	Anodyne	ADRB3	43	40
CCC1(CNC[C@H](O)c2cccnc2)CCN(Cc2ccccc2)CC1	ZINC000819189289	FG	On-Demand	Anodyne	ADRB2	18	41
CCC1(CNC[C@H](O)c2cccnc2)CCN(Cc2ccccc2)CC1	ZINC000819189289	FG	On-Demand	Anodyne	ADRB1	21	40
CCC1(CNC[C@H](O)c2cccnc2)CCN(Cc2ccccc2)CC1	ZINC000819189289	FG	On-Demand	Anodyne	ADRB3	81	48
CCC1(CNC[C@@H](O)c2cccnc2)CCN(Cc2ccccc2)CC1	ZINC000819189290	FG	On-Demand	Anodyne	ADRB2	18	41
CCC1(CNC[C@@H](O)c2cccnc2)CCN(Cc2ccccc2)CC1	ZINC000819189290	FG	On-Demand	Anodyne	ADRB1	21	40
CCC1(CNC[C@@H](O)c2cccnc2)CCN(Cc2ccccc2)CC1	ZINC000819189290	FG	On-Demand	Anodyne	ADRB3	81	48
O=C1C[C@H](CNC[C@H](O)c2ccc(F)cc2)CN1Cc1ccccc1	ZINC000819189292	EE	On-Demand	Anodyne	SLC6A3	26	46
O=C1C[C@@H](CNC[C@H](O)c2ccc(F)cc2)CN1Cc1ccccc1	ZINC000819189296	EE	On-Demand	Anodyne	SLC6A3	26	46
O=C1C[C@@H](CNC[C@@H](O)c2ccc(F)cc2)CN1Cc1ccccc1	ZINC000819189298	EE	On-Demand	Anodyne	SLC6A3	26	46
O=C1C[C@H](CNC[C@@H](O)c2ccc(F)cc2)CN1Cc1ccccc1	ZINC000819189300	EE	On-Demand	Anodyne	SLC6A3	26	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccc3cccnc13)C2	ZINC000819189304	FF	On-Demand	Anodyne	P2RX7	41	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccc3cccnc13)C2	ZINC000819189305	FF	On-Demand	Anodyne	P2RX7	41	37
C[C@H](CO)CCCNC[C@H](O)c1cccnc1	ZINC000819189317	BD	On-Demand	Anodyne	ADRB2	41	49
C[C@H](CO)CCCNC[C@H](O)c1cccnc1	ZINC000819189317	BD	On-Demand	Anodyne	ADRB1	45	49
C[C@H](CO)CCCNC[C@H](O)c1cccnc1	ZINC000819189317	BD	On-Demand	Anodyne	ADRB3	119	49
C[C@@H](CO)CCCNC[C@@H](O)c1cccnc1	ZINC000819189318	BD	On-Demand	Anodyne	ADRB2	41	49
C[C@@H](CO)CCCNC[C@@H](O)c1cccnc1	ZINC000819189318	BD	On-Demand	Anodyne	ADRB1	45	49
C[C@@H](CO)CCCNC[C@@H](O)c1cccnc1	ZINC000819189318	BD	On-Demand	Anodyne	ADRB3	119	49
C[C@H](CO)CCCNC[C@@H](O)c1cccnc1	ZINC000819189319	BD	On-Demand	Anodyne	ADRB2	41	49
C[C@H](CO)CCCNC[C@@H](O)c1cccnc1	ZINC000819189319	BD	On-Demand	Anodyne	ADRB1	45	49
C[C@H](CO)CCCNC[C@@H](O)c1cccnc1	ZINC000819189319	BD	On-Demand	Anodyne	ADRB3	119	49
C[C@@H](CO)CCCNC[C@H](O)c1cccnc1	ZINC000819189320	BD	On-Demand	Anodyne	ADRB2	41	49
C[C@@H](CO)CCCNC[C@H](O)c1cccnc1	ZINC000819189320	BD	On-Demand	Anodyne	ADRB1	45	49
C[C@@H](CO)CCCNC[C@H](O)c1cccnc1	ZINC000819189320	BD	On-Demand	Anodyne	ADRB3	119	49
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819189325	EG	On-Demand	Bother	ADRB2	58	41
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819189325	EG	On-Demand	Bother	ADRB1	55	47
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819189325	EG	On-Demand	Bother	ADRB3	71	47
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819189326	EG	On-Demand	Bother	ADRB2	58	41
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819189326	EG	On-Demand	Bother	ADRB1	55	47
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819189326	EG	On-Demand	Bother	ADRB3	71	47
Cc1ccccc1[C@@H](O)CNCc1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000819189335	GF	On-Demand	Anodyne	ADRB3	41	36
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819189353	FG	On-Demand	Bother	ADRB2	68	42
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819189353	FG	On-Demand	Bother	ADRB1	61	41
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819189353	FG	On-Demand	Bother	ADRB3	79	42
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819189353	FG	On-Demand	Bother	CACNA1D	50	37
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819189354	FG	On-Demand	Bother	ADRB2	68	42
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819189354	FG	On-Demand	Bother	ADRB1	61	41
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819189354	FG	On-Demand	Bother	ADRB3	79	42
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819189354	FG	On-Demand	Bother	CACNA1D	50	37
O[C@H](CNCCOc1cccc(C(F)(F)F)n1)c1cccc(C(F)(F)F)c1	ZINC000819189362	GH	On-Demand	Anodyne	ADRB1	27	41
O[C@H](CNCCOc1cccc(C(F)(F)F)n1)c1cccc(C(F)(F)F)c1	ZINC000819189362	GH	On-Demand	Anodyne	ADRB3	33	41
O[C@@H](CNCCOc1cccc(C(F)(F)F)n1)c1cccc(C(F)(F)F)c1	ZINC000819189363	GH	On-Demand	Anodyne	ADRB1	27	41
O[C@@H](CNCCOc1cccc(C(F)(F)F)n1)c1cccc(C(F)(F)F)c1	ZINC000819189363	GH	On-Demand	Anodyne	ADRB3	33	41
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819189406	GE	On-Demand	Anodyne	GPR119	23	42
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819189407	GE	On-Demand	Anodyne	GPR119	23	42
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819189408	GE	On-Demand	Anodyne	GPR119	23	42
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819189409	GE	On-Demand	Anodyne	GPR119	23	42
O=S1(=O)CCC(CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819189418	DD	On-Demand	Anodyne	ADRB1	21	40
O=S1(=O)CCC(CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819189418	DD	On-Demand	Anodyne	ADRB3	30	40
O=S1(=O)CCC(CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819189419	DD	On-Demand	Anodyne	ADRB1	21	40
O=S1(=O)CCC(CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819189419	DD	On-Demand	Anodyne	ADRB3	30	40
COc1ccc(OC)c([C@H](O)CNCC2CCS(=O)(=O)CC2)c1	ZINC000819189439	ED	On-Demand	Anodyne	MTNR1A	17	40
CCC[C@H](CC)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819189459	CF	On-Demand	Anodyne	PAPA1_CARPA	17	40
CCC[C@H](CC)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819189459	CF	On-Demand	Anodyne	CTSK	20	45
CCC[C@H](CC)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819189459	CF	On-Demand	Anodyne	PGA5	21	40
CCC[C@@H](CC)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819189460	CF	On-Demand	Anodyne	PAPA1_CARPA	17	40
CCC[C@@H](CC)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819189460	CF	On-Demand	Anodyne	CTSK	20	45
CCC[C@@H](CC)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819189460	CF	On-Demand	Anodyne	PGA5	21	40
CCC1(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCN(Cc2ccccc2)CC1	ZINC000819189466	GH	On-Demand	Bother	SIGMAR1	30	44
CCC1(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)CCN(Cc2ccccc2)CC1	ZINC000819189467	GH	On-Demand	Bother	SIGMAR1	30	44
CCC1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)CC1	ZINC000819189471	GH	On-Demand	Bother	SIGMAR1	23	46
CCC1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)CC1	ZINC000819189473	GH	On-Demand	Bother	SIGMAR1	23	46
O[C@@H](CNCCC1=CCCC1)c1cccnc1	ZINC000819189476	BE	On-Demand	Anodyne	ADRB2	34	48
O[C@@H](CNCCC1=CCCC1)c1cccnc1	ZINC000819189476	BE	On-Demand	Anodyne	ADRB1	41	46
O[C@@H](CNCCC1=CCCC1)c1cccnc1	ZINC000819189476	BE	On-Demand	Anodyne	ADRB3	132	50
O[C@H](CNCCC1=CCCC1)c1cccnc1	ZINC000819189477	BE	On-Demand	Anodyne	ADRB2	34	48
O[C@H](CNCCC1=CCCC1)c1cccnc1	ZINC000819189477	BE	On-Demand	Anodyne	ADRB1	41	46
O[C@H](CNCCC1=CCCC1)c1cccnc1	ZINC000819189477	BE	On-Demand	Anodyne	ADRB3	132	50
CS(=O)(=O)N1CCC[C@@H]1CNC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819189526	FD	On-Demand	Anodyne	P2RX7	16	40
CS(=O)(=O)N1CCC[C@@H]1CNC[C@H](O)c1ccc(F)cc1Cl	ZINC000819189528	FD	On-Demand	Anodyne	P2RX7	16	40
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1ccc(F)cc1	ZINC000819189556	DG	On-Demand	Anodyne	ADRB2	29	52
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1ccc(F)cc1	ZINC000819189556	DG	On-Demand	Anodyne	ADRB1	34	42
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1ccc(F)cc1	ZINC000819189556	DG	On-Demand	Anodyne	ADRB3	36	42
O[C@H](CNCCOCc1ccc(Cl)cc1)c1ccc(F)cc1	ZINC000819189558	DG	On-Demand	Anodyne	ADRB2	29	52
O[C@H](CNCCOCc1ccc(Cl)cc1)c1ccc(F)cc1	ZINC000819189558	DG	On-Demand	Anodyne	ADRB1	34	42
O[C@H](CNCCOCc1ccc(Cl)cc1)c1ccc(F)cc1	ZINC000819189558	DG	On-Demand	Anodyne	ADRB3	36	42
CCC1(CNCCC(=O)N(C)OC)CCN(Cc2ccccc2)CC1	ZINC000819189563	EF	On-Demand	Anodyne	SIGMAR1	54	40
CCC1(CNCCC(=O)N(C)OC)CCN(Cc2ccccc2)CC1	ZINC000819189563	EF	On-Demand	Anodyne	NPFFR2	35	43
CCC1(CNCCC(=O)N(C)OC)CCN(Cc2ccccc2)CC1	ZINC000819189563	EF	On-Demand	Anodyne	NPFFR1	47	43
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1cccc2ccccc12	ZINC000819189581	EG	On-Demand	Anodyne	ADRB2	41	34
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1cccc2ccccc12	ZINC000819189581	EG	On-Demand	Anodyne	ADRB3	42	36
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1cccc(F)c1	ZINC000819189587	DG	On-Demand	Anodyne	ADRB2	45	51
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1cccc(F)c1	ZINC000819189587	DG	On-Demand	Anodyne	ADRB1	55	47
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1cccc(F)c1	ZINC000819189587	DG	On-Demand	Anodyne	ADRB3	69	47
O[C@H](CNCCOCc1ccc(Cl)cc1)c1cccc(F)c1	ZINC000819189588	DG	On-Demand	Anodyne	ADRB2	45	51
O[C@H](CNCCOCc1ccc(Cl)cc1)c1cccc(F)c1	ZINC000819189588	DG	On-Demand	Anodyne	ADRB1	55	47
O[C@H](CNCCOCc1ccc(Cl)cc1)c1cccc(F)c1	ZINC000819189588	DG	On-Demand	Anodyne	ADRB3	69	47
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819189612	EG	On-Demand	Bother	ADRB2	46	40
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819189612	EG	On-Demand	Bother	ADRB1	44	41
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819189612	EG	On-Demand	Bother	ADRB3	35	41
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819189613	EG	On-Demand	Bother	ADRB2	46	40
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819189613	EG	On-Demand	Bother	ADRB1	44	41
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819189613	EG	On-Demand	Bother	ADRB3	35	41
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819189619	FH	On-Demand	Bother	ADRB2	55	42
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819189619	FH	On-Demand	Bother	ADRB1	54	45
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819189619	FH	On-Demand	Bother	ADRB3	40	45
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819189620	FH	On-Demand	Bother	ADRB2	55	42
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819189620	FH	On-Demand	Bother	ADRB1	54	45
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819189620	FH	On-Demand	Bother	ADRB3	40	45
CN1Cc2ccccc2[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819189627	DF	On-Demand	Anodyne	SLC6A2	15	40
CN1Cc2ccccc2[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819189628	DF	On-Demand	Anodyne	SLC6A2	15	40
CN1Cc2ccccc2[C@@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819189629	DF	On-Demand	Anodyne	SLC6A2	15	40
CN1Cc2ccccc2[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819189630	DF	On-Demand	Anodyne	SLC6A2	15	40
CN1Cc2ccccc2[C@@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819189631	GF	On-Demand	Anodyne	GPR119	35	45
CN1Cc2ccccc2[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819189632	GF	On-Demand	Anodyne	GPR119	35	45
CN1Cc2ccccc2[C@@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819189633	GF	On-Demand	Anodyne	GPR119	35	45
CN1Cc2ccccc2[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819189634	GF	On-Demand	Anodyne	GPR119	35	45
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819189635	DD	On-Demand	Bother	ADRB2	29	41
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819189635	DD	On-Demand	Bother	ADRB1	35	41
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819189635	DD	On-Demand	Bother	ADRB3	58	41
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819189636	DD	On-Demand	Bother	ADRB2	29	41
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819189636	DD	On-Demand	Bother	ADRB1	35	41
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819189636	DD	On-Demand	Bother	ADRB3	58	41
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819189671	DF	On-Demand	Bother	ADRB2	61	40
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819189671	DF	On-Demand	Bother	ADRB1	50	42
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819189671	DF	On-Demand	Bother	ADRB3	43	42
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819189671	DF	On-Demand	Bother	CACNA1D	43	38
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819189672	DF	On-Demand	Bother	ADRB2	61	40
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819189672	DF	On-Demand	Bother	ADRB1	50	42
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819189672	DF	On-Demand	Bother	ADRB3	43	42
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819189672	DF	On-Demand	Bother	CACNA1D	43	38
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819189691	GG	On-Demand	Bother	ADRB2	59	41
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819189691	GG	On-Demand	Bother	ADRB1	54	45
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819189691	GG	On-Demand	Bother	ADRB3	68	45
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819189692	GG	On-Demand	Bother	ADRB2	59	41
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819189692	GG	On-Demand	Bother	ADRB1	54	45
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819189692	GG	On-Demand	Bother	ADRB3	68	45
NC(=O)c1cc(N2CCCCC2)ccc1NC(=O)CNC(=O)Nc1ccccc1	ZINC000819189703	GF	On-Demand	Anodyne	LPL	54	38
Cc1cc(CNC[C@@H](O)c2cccnc2)ncn1	ZINC000819189713	BD	On-Demand	Anodyne	ADRB2	21	44
Cc1cc(CNC[C@@H](O)c2cccnc2)ncn1	ZINC000819189713	BD	On-Demand	Anodyne	ADRB1	23	44
Cc1cc(CNC[C@@H](O)c2cccnc2)ncn1	ZINC000819189713	BD	On-Demand	Anodyne	ADRB3	88	44
Cc1cc(CNC[C@H](O)c2cccnc2)ncn1	ZINC000819189715	BD	On-Demand	Anodyne	ADRB2	21	44
Cc1cc(CNC[C@H](O)c2cccnc2)ncn1	ZINC000819189715	BD	On-Demand	Anodyne	ADRB1	23	44
Cc1cc(CNC[C@H](O)c2cccnc2)ncn1	ZINC000819189715	BD	On-Demand	Anodyne	ADRB3	88	44
CS(=O)(=O)N1CCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819189717	ED	On-Demand	Anodyne	ADRB1	43	42
CS(=O)(=O)N1CCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819189717	ED	On-Demand	Anodyne	ADRB3	67	42
CS(=O)(=O)N1CCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819189717	ED	On-Demand	Anodyne	CYP3A4	46	34
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCc2cnc(C3CC3)nc2)CC1	ZINC000819189718	GF	On-Demand	Anodyne	GPR119	32	45
CS(=O)(=O)N1CCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819189719	ED	On-Demand	Anodyne	ADRB1	43	42
CS(=O)(=O)N1CCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819189719	ED	On-Demand	Anodyne	ADRB3	67	42
CS(=O)(=O)N1CCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819189719	ED	On-Demand	Anodyne	CYP3A4	46	34
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCc2cnc(C3CC3)nc2)CC1	ZINC000819189720	GF	On-Demand	Anodyne	GPR119	32	45
CS(=O)(=O)N1CCC[C@@H]1CNC[C@H](O)c1ccccc1	ZINC000819189728	CC	On-Demand	Anodyne	ADRB3	45	39
CS(=O)(=O)N1CCC[C@@H]1CNC[C@H](O)c1ccccc1	ZINC000819189728	CC	On-Demand	Anodyne	Q8WSF8_APLCA	18	42
CS(=O)(=O)N1CCC[C@@H]1CNC[C@@H](O)c1ccccc1	ZINC000819189729	CC	On-Demand	Anodyne	ADRB3	45	39
CS(=O)(=O)N1CCC[C@@H]1CNC[C@@H](O)c1ccccc1	ZINC000819189729	CC	On-Demand	Anodyne	Q8WSF8_APLCA	18	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCN(c3ccccn3)C2)CC1	ZINC000819189737	GE	On-Demand	Anodyne	GPR119	51	62
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCN(c3ccccn3)C2)CC1	ZINC000819189740	GE	On-Demand	Anodyne	GPR119	51	62
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCN(c3ccccn3)C2)CC1	ZINC000819189742	GE	On-Demand	Anodyne	GPR119	51	62
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCN(c3ccccn3)C2)CC1	ZINC000819189745	GE	On-Demand	Anodyne	GPR119	51	62
CCC1(CNCCS(=O)(=O)CC)CCN(Cc2ccccc2)CC1	ZINC000819189768	FF	On-Demand	Anodyne	SIGMAR1	62	41
CCC1(CNCCS(=O)(=O)CC)CCN(Cc2ccccc2)CC1	ZINC000819189768	FF	On-Demand	Anodyne	NPFFR2	31	44
CCC1(CNCCS(=O)(=O)CC)CCN(Cc2ccccc2)CC1	ZINC000819189768	FF	On-Demand	Anodyne	NPFFR1	45	44
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1ccc(F)cc1	ZINC000819189772	DE	On-Demand	Anodyne	ADRB2	31	44
O[C@@H](CNCCc1cnc(C2CC2)nc1)c1ccc(F)cc1	ZINC000819189772	DE	On-Demand	Anodyne	ADRB3	65	37
O[C@H](CNCCc1cnc(C2CC2)nc1)c1ccc(F)cc1	ZINC000819189773	DE	On-Demand	Anodyne	ADRB2	31	44
O[C@H](CNCCc1cnc(C2CC2)nc1)c1ccc(F)cc1	ZINC000819189773	DE	On-Demand	Anodyne	ADRB3	65	37
COc1cccc([S@@](=O)CC(=O)NNC(=O)NC(C)C)c1	ZINC000819189797	DC	On-Demand	Reactive	MTNR1A	36	41
COc1cccc([S@@](=O)CC(=O)NNC(=O)NC(C)C)c1	ZINC000819189797	DC	On-Demand	Reactive	MTNR1B	36	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1ccc2ccccc2n1	ZINC000819189813	FF	On-Demand	Anodyne	CYSLTR1	36	40
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(CN2CCCCCC2)cc1	ZINC000819189825	EH	On-Demand	Anodyne	HRH3	23	41
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(CN2CCCCCC2)cc1	ZINC000819189825	EH	On-Demand	Anodyne	SIGMAR1	15	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(CN2CCCCCC2)cc1	ZINC000819189828	EH	On-Demand	Anodyne	HRH3	23	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(CN2CCCCCC2)cc1	ZINC000819189828	EH	On-Demand	Anodyne	SIGMAR1	15	41
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(CN2CCCCCC2)cc1	ZINC000819189830	EH	On-Demand	Anodyne	HRH3	23	41
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(CN2CCCCCC2)cc1	ZINC000819189830	EH	On-Demand	Anodyne	SIGMAR1	15	41
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(CN2CCCCCC2)cc1	ZINC000819189833	EH	On-Demand	Anodyne	HRH3	23	41
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(CN2CCCCCC2)cc1	ZINC000819189833	EH	On-Demand	Anodyne	SIGMAR1	15	41
O[C@@H](CNCCC1=CCCC1)c1ccc(OC(F)(F)F)cc1	ZINC000819189860	DH	On-Demand	Anodyne	ADRB3	17	43
O[C@H](CNCCC1=CCCC1)c1ccc(OC(F)(F)F)cc1	ZINC000819189862	DH	On-Demand	Anodyne	ADRB3	17	43
C#CC[C@H](NC[C@@H](O)COc1ccc(C(C)=O)cc1)c1ccccc1	ZINC000819189865	EF	On-Demand	Mild	ADRB2	44	51
C#CC[C@H](NC[C@@H](O)COc1ccc(C(C)=O)cc1)c1ccccc1	ZINC000819189865	EF	On-Demand	Mild	ADRB1	58	48
C#CC[C@H](NC[C@@H](O)COc1ccc(C(C)=O)cc1)c1ccccc1	ZINC000819189865	EF	On-Demand	Mild	ADRB3	36	41
C#CC[C@H](NC[C@@H](O)COc1ccc(C(C)=O)cc1)c1ccccc1	ZINC000819189865	EF	On-Demand	Mild	ABCB1	22	61
C#CC[C@H](NC[C@H](O)COc1ccc(C(C)=O)cc1)c1ccccc1	ZINC000819189867	EF	On-Demand	Mild	ADRB2	44	51
C#CC[C@H](NC[C@H](O)COc1ccc(C(C)=O)cc1)c1ccccc1	ZINC000819189867	EF	On-Demand	Mild	ADRB1	58	48
C#CC[C@H](NC[C@H](O)COc1ccc(C(C)=O)cc1)c1ccccc1	ZINC000819189867	EF	On-Demand	Mild	ADRB3	36	41
C#CC[C@H](NC[C@H](O)COc1ccc(C(C)=O)cc1)c1ccccc1	ZINC000819189867	EF	On-Demand	Mild	ABCB1	22	61
C#CC[C@@H](NC[C@H](O)COc1ccc(C(C)=O)cc1)c1ccccc1	ZINC000819189869	EF	On-Demand	Mild	ADRB2	44	51
C#CC[C@@H](NC[C@H](O)COc1ccc(C(C)=O)cc1)c1ccccc1	ZINC000819189869	EF	On-Demand	Mild	ADRB1	58	48
C#CC[C@@H](NC[C@H](O)COc1ccc(C(C)=O)cc1)c1ccccc1	ZINC000819189869	EF	On-Demand	Mild	ADRB3	36	41
C#CC[C@@H](NC[C@H](O)COc1ccc(C(C)=O)cc1)c1ccccc1	ZINC000819189869	EF	On-Demand	Mild	ABCB1	22	61
C#CC[C@@H](NC[C@@H](O)COc1ccc(C(C)=O)cc1)c1ccccc1	ZINC000819189871	EF	On-Demand	Mild	ADRB2	44	51
C#CC[C@@H](NC[C@@H](O)COc1ccc(C(C)=O)cc1)c1ccccc1	ZINC000819189871	EF	On-Demand	Mild	ADRB1	58	48
C#CC[C@@H](NC[C@@H](O)COc1ccc(C(C)=O)cc1)c1ccccc1	ZINC000819189871	EF	On-Demand	Mild	ADRB3	36	41
C#CC[C@@H](NC[C@@H](O)COc1ccc(C(C)=O)cc1)c1ccccc1	ZINC000819189871	EF	On-Demand	Mild	ABCB1	22	61
COc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(F)=C1CCC1	ZINC000819189879	EF	On-Demand	Anodyne	LRRK2	33	45
C[C@H](NC[C@H](O)c1cccc2ccccc12)C1CCC1	ZINC000819189916	CH	On-Demand	Anodyne	ADRB2	18	46
C[C@H](NC[C@H](O)c1cccc2ccccc12)C1CCC1	ZINC000819189916	CH	On-Demand	Anodyne	ADRB1	18	46
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2Br)c1	ZINC000819189968	FG	On-Demand	Bother	ADRB2	53	39
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2Br)c1	ZINC000819189968	FG	On-Demand	Bother	ADRB1	49	43
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2Br)c1	ZINC000819189968	FG	On-Demand	Bother	ADRB3	46	43
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2Br)c1	ZINC000819189968	FG	On-Demand	Bother	CACNA1D	55	35
O=C(/C=C\[C@H]1CCCO1)NCCc1c[nH]c2cc(Cl)ccc12	ZINC000819189969	DG	On-Demand	Anodyne	ACHE	23	40
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819189970	FG	On-Demand	Bother	ADRB2	53	39
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819189970	FG	On-Demand	Bother	ADRB1	49	43
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819189970	FG	On-Demand	Bother	ADRB3	46	43
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819189970	FG	On-Demand	Bother	CACNA1D	55	35
O=C(/C=C\[C@@H]1CCCO1)NCCc1c[nH]c2cc(Cl)ccc12	ZINC000819189974	DG	On-Demand	Anodyne	ACHE	23	40
O=C(/C=C/[C@H]1CCCO1)NCCc1c[nH]c2cc(Cl)ccc12	ZINC000819189976	DG	On-Demand	Anodyne	ACHE	23	40
O=C(/C=C/[C@@H]1CCCO1)NCCc1c[nH]c2cc(Cl)ccc12	ZINC000819189978	DG	On-Demand	Anodyne	ACHE	23	40
COc1ccc(-n2cnnc2SCC(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	ZINC000819189990	JE	On-Demand	Anodyne	MMP13	33	40
COc1ccc(-n2cnnc2SCC(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	ZINC000819189990	JE	On-Demand	Anodyne	MMP2	24	40
COc1ccc(-n2cnnc2SCC(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	ZINC000819189990	JE	On-Demand	Anodyne	MMP3	34	40
COc1ccc(-n2cnnc2SCC(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	ZINC000819189990	JE	On-Demand	Anodyne	MMP1	28	40
COc1ccc(-n2cnnc2SCC(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)cc1	ZINC000819189990	JE	On-Demand	Anodyne	ENPP1	67	33
C[C@@H](CO)CCCNC[C@H](O)c1cccc2ccccc12	ZINC000819190000	CF	On-Demand	Anodyne	ADRB2	34	41
C[C@@H](CO)CCCNC[C@H](O)c1cccc2ccccc12	ZINC000819190000	CF	On-Demand	Anodyne	ADRB1	23	41
C[C@H](CO)CCCNC[C@H](O)c1cccc2ccccc12	ZINC000819190001	CF	On-Demand	Anodyne	ADRB2	34	41
C[C@H](CO)CCCNC[C@H](O)c1cccc2ccccc12	ZINC000819190001	CF	On-Demand	Anodyne	ADRB1	23	41
CC[C@@H](NC[C@H](O)c1ccccc1)[C@H](c1ccc(C)cc1)n1cncn1	ZINC000819190011	FG	On-Demand	Anodyne	CYP26A1	15	42
CC[C@@H](NC[C@@H](O)c1ccccc1)[C@@H](c1ccc(C)cc1)n1cncn1	ZINC000819190012	FG	On-Demand	Anodyne	CYP26A1	15	42
CC[C@@H](NC[C@@H](O)c1ccccc1)[C@H](c1ccc(C)cc1)n1cncn1	ZINC000819190013	FG	On-Demand	Anodyne	CYP26A1	15	42
CC[C@@H](NC[C@H](O)c1ccccc1)[C@@H](c1ccc(C)cc1)n1cncn1	ZINC000819190016	FG	On-Demand	Anodyne	CYP26A1	15	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cnc(C3CC3)nc2)cc1	ZINC000819190019	EE	On-Demand	Bother	ADRB3	65	39
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cnc(C3CC3)nc2)cc1	ZINC000819190020	EE	On-Demand	Bother	ADRB3	65	39
Cc1ccccc1[C@@H](O)CNCCCNC(=O)C(C)C	ZINC000819190024	CD	On-Demand	Anodyne	GRIA1	51	34
Cc1ccccc1[C@@H](O)CNCCCNC(=O)C(C)C	ZINC000819190024	CD	On-Demand	Anodyne	SOAT1	17	40
Cc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ncn1	ZINC000819190045	CD	On-Demand	Bother	CACNA1C	45	36
Cc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ncn1	ZINC000819190045	CD	On-Demand	Bother	CACNA1D	69	34
Cc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ncn1	ZINC000819190046	CD	On-Demand	Bother	CACNA1C	45	36
Cc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ncn1	ZINC000819190046	CD	On-Demand	Bother	CACNA1D	69	34
Cc1cc(CNC[C@H](O)c2cccc(Cl)c2)ncn1	ZINC000819190055	CE	On-Demand	Anodyne	ADRB1	32	42
Cc1cc(CNC[C@H](O)c2cccc(Cl)c2)ncn1	ZINC000819190055	CE	On-Demand	Anodyne	ADRB3	45	42
Cc1cc(CNC[C@@H](O)c2cccc(Cl)c2)ncn1	ZINC000819190056	CE	On-Demand	Anodyne	ADRB1	32	42
Cc1cc(CNC[C@@H](O)c2cccc(Cl)c2)ncn1	ZINC000819190056	CE	On-Demand	Anodyne	ADRB3	45	42
C=CCCOCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819190065	CF	On-Demand	Mild	ADRB2	27	42
C=CCCOCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819190065	CF	On-Demand	Mild	ADRB1	21	42
C=CCCOCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819190065	CF	On-Demand	Mild	ADRB3	20	42
C=CCCOCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819190066	CF	On-Demand	Mild	ADRB2	27	42
C=CCCOCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819190066	CF	On-Demand	Mild	ADRB1	21	42
C=CCCOCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819190066	CF	On-Demand	Mild	ADRB3	20	42
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)S(C)(=O)=O	ZINC000819190106	DC	On-Demand	Bother	ADRB3	56	35
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)S(C)(=O)=O	ZINC000819190107	DC	On-Demand	Bother	ADRB3	56	35
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)S(C)(=O)=O	ZINC000819190108	DC	On-Demand	Bother	ADRB3	56	35
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)S(C)(=O)=O	ZINC000819190109	DC	On-Demand	Bother	ADRB3	56	35
O=[N+]([O-])c1cccc([C@@H](O)CNCCC2Cc3ccccc3C2)c1	ZINC000819190119	EG	On-Demand	Bother	ADRB3	41	34
O=[N+]([O-])c1cccc([C@H](O)CNCCC2Cc3ccccc3C2)c1	ZINC000819190120	EG	On-Demand	Bother	ADRB3	41	34
O=S(=O)(Cc1ccccc1CNC[C@H](O)c1cccnc1)N1CCCC1	ZINC000819190135	GD	On-Demand	Anodyne	ADRB2	22	42
O=S(=O)(Cc1ccccc1CNC[C@H](O)c1cccnc1)N1CCCC1	ZINC000819190135	GD	On-Demand	Anodyne	ADRB3	95	54
O=S(=O)(Cc1ccccc1CNC[C@@H](O)c1cccnc1)N1CCCC1	ZINC000819190138	GD	On-Demand	Anodyne	ADRB2	22	42
O=S(=O)(Cc1ccccc1CNC[C@@H](O)c1cccnc1)N1CCCC1	ZINC000819190138	GD	On-Demand	Anodyne	ADRB3	95	54
CN(C)c1ccc(NC(=O)CCNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819190143	FF	On-Demand	Bother	CACNA1C	45	35
CN(C)c1ccc(NC(=O)CCNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819190143	FF	On-Demand	Bother	CACNA1D	74	35
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccc(Cl)cc1	ZINC000819190196	DF	On-Demand	Anodyne	ADRB1	19	40
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccc(Cl)cc1	ZINC000819190196	DF	On-Demand	Anodyne	DRD4	21	40
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccc(Cl)cc1	ZINC000819190196	DF	On-Demand	Anodyne	ADRB3	30	40
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccc(Cl)cc1	ZINC000819190198	DF	On-Demand	Anodyne	ADRB1	19	40
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccc(Cl)cc1	ZINC000819190198	DF	On-Demand	Anodyne	DRD4	21	40
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccc(Cl)cc1	ZINC000819190198	DF	On-Demand	Anodyne	ADRB3	30	40
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1ccccc1	ZINC000819190207	DG	On-Demand	Anodyne	ADRB2	49	51
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1ccccc1	ZINC000819190207	DG	On-Demand	Anodyne	ADRB1	70	45
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1ccccc1	ZINC000819190207	DG	On-Demand	Anodyne	ADRB3	88	48
O[C@H](CNCCOCc1ccc(Cl)cc1)c1ccccc1	ZINC000819190209	DG	On-Demand	Anodyne	ADRB2	49	51
O[C@H](CNCCOCc1ccc(Cl)cc1)c1ccccc1	ZINC000819190209	DG	On-Demand	Anodyne	ADRB1	70	45
O[C@H](CNCCOCc1ccc(Cl)cc1)c1ccccc1	ZINC000819190209	DG	On-Demand	Anodyne	ADRB3	88	48
O[C@H](CNCCOc1cccc(C(F)(F)F)n1)c1cccnc1	ZINC000819190220	EE	On-Demand	Anodyne	ADRB2	31	52
O[C@H](CNCCOc1cccc(C(F)(F)F)n1)c1cccnc1	ZINC000819190220	EE	On-Demand	Anodyne	ADRB1	41	58
O[C@H](CNCCOc1cccc(C(F)(F)F)n1)c1cccnc1	ZINC000819190220	EE	On-Demand	Anodyne	ADRB3	111	58
C[C@@H](CC(=O)N(CCc1ccccc1)C1CC1)n1cccn1	ZINC000819190222	CG	On-Demand	Anodyne	MBTPS1	43	32
O[C@@H](CNCCOc1cccc(C(F)(F)F)n1)c1cccnc1	ZINC000819190223	EE	On-Demand	Anodyne	ADRB2	31	52
O[C@@H](CNCCOc1cccc(C(F)(F)F)n1)c1cccnc1	ZINC000819190223	EE	On-Demand	Anodyne	ADRB1	41	58
O[C@@H](CNCCOc1cccc(C(F)(F)F)n1)c1cccnc1	ZINC000819190223	EE	On-Demand	Anodyne	ADRB3	111	58
O[C@H](CNCCOCc1ccc(Cl)cc1)c1cc2ccccc2o1	ZINC000819190235	EH	On-Demand	Anodyne	ADRB2	19	44
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819190241	FG	On-Demand	Bother	ADRB2	67	41
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819190241	FG	On-Demand	Bother	ADRB1	71	43
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819190241	FG	On-Demand	Bother	ADRB3	86	48
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819190241	FG	On-Demand	Bother	CACNA1D	52	35
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819190243	FG	On-Demand	Bother	ADRB2	67	41
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819190243	FG	On-Demand	Bother	ADRB1	71	43
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819190243	FG	On-Demand	Bother	ADRB3	86	48
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819190243	FG	On-Demand	Bother	CACNA1D	52	35
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1ccccc1F	ZINC000819190253	DG	On-Demand	Anodyne	ADRB2	27	48
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1ccccc1F	ZINC000819190253	DG	On-Demand	Anodyne	ADRB1	36	40
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1ccccc1F	ZINC000819190253	DG	On-Demand	Anodyne	ADRB3	30	40
O[C@H](CNCCOCc1ccc(Cl)cc1)c1ccccc1F	ZINC000819190254	DG	On-Demand	Anodyne	ADRB2	27	48
O[C@H](CNCCOCc1ccc(Cl)cc1)c1ccccc1F	ZINC000819190254	DG	On-Demand	Anodyne	ADRB1	36	40
O[C@H](CNCCOCc1ccc(Cl)cc1)c1ccccc1F	ZINC000819190254	DG	On-Demand	Anodyne	ADRB3	30	40
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1cccnc1	ZINC000819190256	DF	On-Demand	Anodyne	ADRB2	42	53
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1cccnc1	ZINC000819190256	DF	On-Demand	Anodyne	ADRB1	58	53
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1cccnc1	ZINC000819190256	DF	On-Demand	Anodyne	ADRB3	135	58
O[C@H](CNCCOCc1ccc(Cl)cc1)c1cccnc1	ZINC000819190258	DF	On-Demand	Anodyne	ADRB2	42	53
O[C@H](CNCCOCc1ccc(Cl)cc1)c1cccnc1	ZINC000819190258	DF	On-Demand	Anodyne	ADRB1	58	53
O[C@H](CNCCOCc1ccc(Cl)cc1)c1cccnc1	ZINC000819190258	DF	On-Demand	Anodyne	ADRB3	135	58
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CC(=O)N(Cc3ccccc3)C2)c1	ZINC000819190262	GE	On-Demand	Anodyne	DRD4	18	40
COc1ccc(OC)c([C@H](O)CNC[C@H]2CC(=O)N(Cc3ccccc3)C2)c1	ZINC000819190270	GE	On-Demand	Anodyne	DRD4	18	40
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819190277	DF	On-Demand	Bother	ADRB2	74	45
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819190277	DF	On-Demand	Bother	ADRB1	65	42
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819190277	DF	On-Demand	Bother	CACNA1C	49	39
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819190277	DF	On-Demand	Bother	ADRB3	92	43
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819190277	DF	On-Demand	Bother	CACNA1D	76	39
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819190279	DF	On-Demand	Bother	ADRB2	74	45
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819190279	DF	On-Demand	Bother	ADRB1	65	42
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819190279	DF	On-Demand	Bother	CACNA1C	49	39
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819190279	DF	On-Demand	Bother	ADRB3	92	43
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819190279	DF	On-Demand	Bother	CACNA1D	76	39
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819190293	DF	On-Demand	Anodyne	ADRB1	41	45
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819190293	DF	On-Demand	Anodyne	ADRB3	63	48
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819190293	DF	On-Demand	Anodyne	IGF1R	28	40
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819190293	DF	On-Demand	Anodyne	CYP3A4	50	40
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819190294	DF	On-Demand	Anodyne	ADRB1	41	45
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819190294	DF	On-Demand	Anodyne	ADRB3	63	48
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819190294	DF	On-Demand	Anodyne	IGF1R	28	40
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819190294	DF	On-Demand	Anodyne	CYP3A4	50	40
O[C@H](CN[C@@H]1CCN(c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819190296	DF	On-Demand	Anodyne	ADRB1	41	45
O[C@H](CN[C@@H]1CCN(c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819190296	DF	On-Demand	Anodyne	ADRB3	63	48
O[C@H](CN[C@@H]1CCN(c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819190296	DF	On-Demand	Anodyne	IGF1R	28	40
O[C@H](CN[C@@H]1CCN(c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819190296	DF	On-Demand	Anodyne	CYP3A4	50	40
O[C@H](CN[C@H]1CCN(c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819190298	DF	On-Demand	Anodyne	ADRB1	41	45
O[C@H](CN[C@H]1CCN(c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819190298	DF	On-Demand	Anodyne	ADRB3	63	48
O[C@H](CN[C@H]1CCN(c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819190298	DF	On-Demand	Anodyne	IGF1R	28	40
O[C@H](CN[C@H]1CCN(c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819190298	DF	On-Demand	Anodyne	CYP3A4	50	40
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccc(F)cc1	ZINC000819190332	DE	On-Demand	Anodyne	DRD4	19	40
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccc(F)cc1	ZINC000819190334	DE	On-Demand	Anodyne	DRD4	19	40
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819190336	DG	On-Demand	Bother	ADRB2	59	43
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819190336	DG	On-Demand	Bother	ADRB1	56	43
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819190336	DG	On-Demand	Bother	ADRB3	47	43
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819190336	DG	On-Demand	Bother	CACNA1D	61	37
O[C@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccc(F)cc1	ZINC000819190337	DE	On-Demand	Anodyne	DRD4	19	40
O[C@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccc(F)cc1	ZINC000819190338	DE	On-Demand	Anodyne	DRD4	19	40
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1ccc(F)cc1F	ZINC000819190340	EG	On-Demand	Anodyne	ADRB2	29	51
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1ccc(F)cc1F	ZINC000819190340	EG	On-Demand	Anodyne	ADRB1	33	44
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1ccc(F)cc1F	ZINC000819190340	EG	On-Demand	Anodyne	ADRB3	27	44
O[C@H](CNCCOCc1ccc(Cl)cc1)c1ccc(F)cc1F	ZINC000819190342	EG	On-Demand	Anodyne	ADRB2	29	51
O[C@H](CNCCOCc1ccc(Cl)cc1)c1ccc(F)cc1F	ZINC000819190342	EG	On-Demand	Anodyne	ADRB1	33	44
O[C@H](CNCCOCc1ccc(Cl)cc1)c1ccc(F)cc1F	ZINC000819190342	EG	On-Demand	Anodyne	ADRB3	27	44
CCOc1cccc([C@@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819190344	CH	On-Demand	Anodyne	KCNQ2	33	40
CCOc1cccc([C@@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819190344	CH	On-Demand	Anodyne	ACACA	18	40
CCOc1cccc([C@@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819190344	CH	On-Demand	Anodyne	ACACB	20	48
CCOc1cccc([C@@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819190344	CH	On-Demand	Anodyne	PDS	71	46
CCOc1cccc([C@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819190345	CH	On-Demand	Anodyne	KCNQ2	33	40
CCOc1cccc([C@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819190345	CH	On-Demand	Anodyne	ACACA	18	40
CCOc1cccc([C@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819190345	CH	On-Demand	Anodyne	ACACB	20	48
CCOc1cccc([C@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819190345	CH	On-Demand	Anodyne	PDS	71	46
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1c(F)cccc1F	ZINC000819190362	EG	On-Demand	Anodyne	ADRB1	26	40
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1c(F)cccc1F	ZINC000819190362	EG	On-Demand	Anodyne	ADRB3	25	40
O[C@H](CNCCOCc1ccc(Cl)cc1)c1c(F)cccc1F	ZINC000819190363	EG	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CNCCOCc1ccc(Cl)cc1)c1c(F)cccc1F	ZINC000819190363	EG	On-Demand	Anodyne	ADRB3	25	40
CCC1(CNC[C@@H](O)c2ccc(C#N)cc2)CCN(Cc2ccccc2)CC1	ZINC000819190394	GH	On-Demand	Mild	SIGMAR1	28	40
CCC1(CNC[C@H](O)c2ccc(C#N)cc2)CCN(Cc2ccccc2)CC1	ZINC000819190397	GH	On-Demand	Mild	SIGMAR1	28	40
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819190422	CE	On-Demand	Bother	ADRB2	83	46
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819190422	CE	On-Demand	Bother	ADRB1	93	48
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819190422	CE	On-Demand	Bother	CACNA1C	48	40
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819190422	CE	On-Demand	Bother	ADRB3	138	48
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819190422	CE	On-Demand	Bother	CACNA1D	72	40
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819190425	CE	On-Demand	Bother	ADRB2	83	46
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819190425	CE	On-Demand	Bother	ADRB1	93	48
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819190425	CE	On-Demand	Bother	CACNA1C	48	40
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819190425	CE	On-Demand	Bother	ADRB3	138	48
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819190425	CE	On-Demand	Bother	CACNA1D	72	40
CCCCCCCCNC[C@H](O)c1cccnc1	ZINC000819190427	CG	On-Demand	Mild	ADRB2	45	55
CCCCCCCCNC[C@H](O)c1cccnc1	ZINC000819190427	CG	On-Demand	Mild	ADRB1	58	55
CCCCCCCCNC[C@H](O)c1cccnc1	ZINC000819190427	CG	On-Demand	Mild	ADRB3	135	55
CCCCCCCCNC[C@H](O)c1cccnc1	ZINC000819190427	CG	On-Demand	Mild	KCNA5	16	40
CCCCCCCCNC[C@H](O)c1cccnc1	ZINC000819190427	CG	On-Demand	Mild	CYP51A1	16	40
CN1Cc2ccccc2[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819190429	DF	On-Demand	Anodyne	SLC6A2	24	43
CCCCCCCCNC[C@@H](O)c1cccnc1	ZINC000819190431	CG	On-Demand	Mild	ADRB2	45	55
CCCCCCCCNC[C@@H](O)c1cccnc1	ZINC000819190431	CG	On-Demand	Mild	ADRB1	58	55
CCCCCCCCNC[C@@H](O)c1cccnc1	ZINC000819190431	CG	On-Demand	Mild	ADRB3	135	55
CCCCCCCCNC[C@@H](O)c1cccnc1	ZINC000819190431	CG	On-Demand	Mild	KCNA5	16	40
CCCCCCCCNC[C@@H](O)c1cccnc1	ZINC000819190431	CG	On-Demand	Mild	CYP51A1	16	40
CN1Cc2ccccc2[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819190433	DF	On-Demand	Anodyne	SLC6A2	24	43
CN1Cc2ccccc2[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819190435	DF	On-Demand	Anodyne	SLC6A2	24	43
CN1Cc2ccccc2[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819190437	DF	On-Demand	Anodyne	SLC6A2	24	43
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3ccccn3)C2)cc1	ZINC000819190456	FD	On-Demand	Anodyne	ADRB3	33	43
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3ccccn3)C2)cc1	ZINC000819190456	FD	On-Demand	Anodyne	GPR119	16	53
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3ccccn3)C2)cc1	ZINC000819190457	FD	On-Demand	Anodyne	ADRB3	33	43
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3ccccn3)C2)cc1	ZINC000819190457	FD	On-Demand	Anodyne	GPR119	16	53
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3ccccn3)C2)cc1	ZINC000819190460	FD	On-Demand	Anodyne	ADRB3	33	43
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3ccccn3)C2)cc1	ZINC000819190460	FD	On-Demand	Anodyne	GPR119	16	53
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccccn3)C2)cc1	ZINC000819190461	FD	On-Demand	Anodyne	ADRB3	33	43
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccccn3)C2)cc1	ZINC000819190461	FD	On-Demand	Anodyne	GPR119	16	53
O=C(c1cccc(S(=O)(=O)NC2CC2)c1)n1ccccc1=NC1CCCCC1	ZINC000819190521	GF	On-Demand	Anodyne	SFRP1	86	36
O=C(c1cccc(S(=O)(=O)NC2CC2)c1)n1ccccc1=NC1CCCCC1	ZINC000819190521	GF	On-Demand	Anodyne	WNT3	40	33
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819190528	DF	On-Demand	Bother	ADRB1	34	42
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819190528	DF	On-Demand	Bother	ADRB3	41	42
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819190528	DF	On-Demand	Bother	CACNA1D	63	36
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819190531	DF	On-Demand	Bother	ADRB1	34	42
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819190531	DF	On-Demand	Bother	ADRB3	41	42
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819190531	DF	On-Demand	Bother	CACNA1D	63	36
C[C@@H](CO)CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819190532	CE	On-Demand	Anodyne	ADRB2	66	44
C[C@@H](CO)CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819190532	CE	On-Demand	Anodyne	ADRB1	66	49
C[C@@H](CO)CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819190532	CE	On-Demand	Anodyne	ADRB3	75	49
C[C@H](CO)CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819190534	CE	On-Demand	Anodyne	ADRB2	66	44
C[C@H](CO)CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819190534	CE	On-Demand	Anodyne	ADRB1	66	49
C[C@H](CO)CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819190534	CE	On-Demand	Anodyne	ADRB3	75	49
C[C@@H](CO)CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819190536	CE	On-Demand	Anodyne	ADRB2	66	44
C[C@@H](CO)CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819190536	CE	On-Demand	Anodyne	ADRB1	66	49
C[C@@H](CO)CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819190536	CE	On-Demand	Anodyne	ADRB3	75	49
C[C@H](CO)CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819190538	CE	On-Demand	Anodyne	ADRB2	66	44
C[C@H](CO)CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819190538	CE	On-Demand	Anodyne	ADRB1	66	49
C[C@H](CO)CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819190538	CE	On-Demand	Anodyne	ADRB3	75	49
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819190568	DF	On-Demand	Bother	ADRB2	63	42
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819190568	DF	On-Demand	Bother	ADRB1	58	47
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819190568	DF	On-Demand	Bother	ADRB3	82	47
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819190568	DF	On-Demand	Bother	CACNA1D	46	39
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819190573	DF	On-Demand	Bother	ADRB2	63	42
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819190573	DF	On-Demand	Bother	ADRB1	58	47
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819190573	DF	On-Demand	Bother	ADRB3	82	47
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819190573	DF	On-Demand	Bother	CACNA1D	46	39
CS(=O)(=O)N1CCC[C@@H]1CNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819190579	FD	On-Demand	Anodyne	CACNA1B	54	35
CS(=O)(=O)N1CCC[C@@H]1CNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819190579	FD	On-Demand	Anodyne	BDKRB1	17	40
CS(=O)(=O)N1CCC[C@@H]1CNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819190581	FD	On-Demand	Anodyne	CACNA1B	54	35
CS(=O)(=O)N1CCC[C@@H]1CNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819190581	FD	On-Demand	Anodyne	BDKRB1	17	40
C[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)S(C)(=O)=O	ZINC000819190601	FD	On-Demand	Anodyne	GPR119	56	50
C[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)S(C)(=O)=O	ZINC000819190602	FD	On-Demand	Anodyne	GPR119	56	50
C[C@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)S(C)(=O)=O	ZINC000819190604	FD	On-Demand	Anodyne	GPR119	56	50
C[C@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)S(C)(=O)=O	ZINC000819190605	FD	On-Demand	Anodyne	GPR119	56	50
N#Cc1ccc([C@@H](O)CNCCOc2cccc(C(F)(F)F)n2)cc1	ZINC000819190608	FF	On-Demand	Mild	ADRB1	15	40
N#Cc1ccc([C@@H](O)CNCCOc2cccc(C(F)(F)F)n2)cc1	ZINC000819190608	FF	On-Demand	Mild	ADRB3	16	40
N#Cc1ccc([C@H](O)CNCCOc2cccc(C(F)(F)F)n2)cc1	ZINC000819190609	FF	On-Demand	Mild	ADRB1	15	40
N#Cc1ccc([C@H](O)CNCCOc2cccc(C(F)(F)F)n2)cc1	ZINC000819190609	FF	On-Demand	Mild	ADRB3	16	40
C[C@@](O)(CNCCc1cccc([N+](=O)[O-])c1)c1ccc(Br)cc1F	ZINC000819190614	GH	On-Demand	Bother	CACNA1D	51	34
O[C@H](CNCCOc1cccc(C(F)(F)F)n1)c1ccc(C(F)(F)F)cc1	ZINC000819190624	GH	On-Demand	Anodyne	ADRB1	21	40
O[C@H](CNCCOc1cccc(C(F)(F)F)n1)c1ccc(C(F)(F)F)cc1	ZINC000819190624	GH	On-Demand	Anodyne	ADRB3	24	40
O[C@@H](CNCCOc1cccc(C(F)(F)F)n1)c1ccc(C(F)(F)F)cc1	ZINC000819190626	GH	On-Demand	Anodyne	ADRB1	21	40
O[C@@H](CNCCOc1cccc(C(F)(F)F)n1)c1ccc(C(F)(F)F)cc1	ZINC000819190626	GH	On-Demand	Anodyne	ADRB3	24	40
CC[C@@H](NC[C@H](O)c1cccnc1)c1c(C)noc1C	ZINC000819190637	CE	On-Demand	Anodyne	ADRB1	17	41
CC[C@@H](NC[C@H](O)c1cccnc1)c1c(C)noc1C	ZINC000819190637	CE	On-Demand	Anodyne	ADRB3	60	41
CC[C@@H](NC[C@@H](O)c1cccnc1)c1c(C)noc1C	ZINC000819190640	CE	On-Demand	Anodyne	ADRB1	17	41
CC[C@@H](NC[C@@H](O)c1cccnc1)c1c(C)noc1C	ZINC000819190640	CE	On-Demand	Anodyne	ADRB3	60	41
C[C@@H](CO)CCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819190649	CD	On-Demand	Bother	ADRB2	41	35
C[C@@H](CO)CCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819190649	CD	On-Demand	Bother	ADRB1	45	37
C[C@@H](CO)CCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819190649	CD	On-Demand	Bother	ADRB3	51	38
C[C@H](CO)CCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819190650	CD	On-Demand	Bother	ADRB2	41	35
C[C@H](CO)CCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819190650	CD	On-Demand	Bother	ADRB1	45	37
C[C@H](CO)CCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819190650	CD	On-Demand	Bother	ADRB3	51	38
C[C@@H](CO)CCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819190651	CD	On-Demand	Bother	ADRB2	41	35
C[C@@H](CO)CCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819190651	CD	On-Demand	Bother	ADRB1	45	37
C[C@@H](CO)CCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819190651	CD	On-Demand	Bother	ADRB3	51	38
C[C@H](CO)CCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819190652	CD	On-Demand	Bother	ADRB2	41	35
C[C@H](CO)CCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819190652	CD	On-Demand	Bother	ADRB1	45	37
C[C@H](CO)CCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819190652	CD	On-Demand	Bother	ADRB3	51	38
CN1Cc2ccccc2[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819190663	DG	On-Demand	Anodyne	ADRB3	40	40
CN1Cc2ccccc2[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819190663	DG	On-Demand	Anodyne	CYP3A4	40	34
CN1Cc2ccccc2[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819190664	DG	On-Demand	Anodyne	ADRB3	40	40
CN1Cc2ccccc2[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819190664	DG	On-Demand	Anodyne	CYP3A4	40	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1ccc3ccccc3n1)C2	ZINC000819190717	FF	On-Demand	Anodyne	CYSLTR1	29	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1ccc3ccccc3n1)C2	ZINC000819190717	FF	On-Demand	Anodyne	ALOX5AP	47	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1ccc3ccccc3n1)C2	ZINC000819190718	FF	On-Demand	Anodyne	CYSLTR1	29	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1ccc3ccccc3n1)C2	ZINC000819190718	FF	On-Demand	Anodyne	ALOX5AP	47	37
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1cccc(F)c1	ZINC000819190720	DE	On-Demand	Anodyne	DRD4	15	40
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1cccc(F)c1	ZINC000819190721	DE	On-Demand	Anodyne	DRD4	15	40
O[C@H](CN[C@@H]1CCN(c2ccccn2)C1)c1cccc(F)c1	ZINC000819190722	DE	On-Demand	Anodyne	DRD4	15	40
O[C@H](CN[C@H]1CCN(c2ccccn2)C1)c1cccc(F)c1	ZINC000819190723	DE	On-Demand	Anodyne	DRD4	15	40
CCOc1cccc([C@H](C)NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819190737	CF	On-Demand	Anodyne	KCNQ2	53	38
CCOc1cccc([C@H](C)NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819190738	CF	On-Demand	Anodyne	KCNQ2	53	38
CCOc1cccc([C@H](C)NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819190739	CF	On-Demand	Anodyne	KCNQ2	53	38
CCOc1cccc([C@H](C)NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819190740	CF	On-Demand	Anodyne	KCNQ2	53	38
N#Cc1ccc([C@H](O)CN[C@H]2CCN(c3ccccn3)C2)cc1	ZINC000819190741	DD	On-Demand	Mild	ADRB3	17	42
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(c3ccccn3)C2)cc1	ZINC000819190742	DD	On-Demand	Mild	ADRB3	17	42
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(c3ccccn3)C2)cc1	ZINC000819190743	DD	On-Demand	Mild	ADRB3	17	42
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(c3ccccn3)C2)cc1	ZINC000819190744	DD	On-Demand	Mild	ADRB3	17	42
CC(=O)Nc1cccc(CC(=O)NNC(=O)NC(C)C)c1	ZINC000819190753	CC	On-Demand	Reactive	ANPEP	19	42
CC(=O)Nc1cccc(CC(=O)NNC(=O)NC(C)C)c1	ZINC000819190753	CC	On-Demand	Reactive	PAPA1_CARPA	25	41
CN1Cc2ccccc2[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819190777	DG	On-Demand	Anodyne	ADRB3	40	40
CN1Cc2ccccc2[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819190777	DG	On-Demand	Anodyne	CYP3A4	40	34
CN1Cc2ccccc2[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819190780	DG	On-Demand	Anodyne	ADRB3	40	40
CN1Cc2ccccc2[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819190780	DG	On-Demand	Anodyne	CYP3A4	40	34
O=C(/C=C/[C@@H]1CCCO1)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819190781	EH	On-Demand	Anodyne	MME	58	37
O=C1C[C@H](CNC[C@H](O)c2ccc(F)cc2Cl)CN1Cc1ccccc1	ZINC000819190782	GG	On-Demand	Anodyne	P2RX7	24	42
O=C(/C=C\[C@H]1CCCO1)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819190783	EH	On-Demand	Anodyne	MME	58	37
O=C1C[C@H](CNC[C@@H](O)c2ccc(F)cc2Cl)CN1Cc1ccccc1	ZINC000819190784	GG	On-Demand	Anodyne	P2RX7	24	42
O=C(/C=C\[C@@H]1CCCO1)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819190785	EH	On-Demand	Anodyne	MME	58	37
O=C1C[C@@H](CNC[C@@H](O)c2ccc(F)cc2Cl)CN1Cc1ccccc1	ZINC000819190786	GG	On-Demand	Anodyne	P2RX7	24	42
O=C(/C=C/[C@H]1CCCO1)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819190787	EH	On-Demand	Anodyne	MME	58	37
O=C1C[C@@H](CNC[C@H](O)c2ccc(F)cc2Cl)CN1Cc1ccccc1	ZINC000819190788	GG	On-Demand	Anodyne	P2RX7	24	42
O=C(Cc1nsc2ccccc12)N(CCc1ccccc1)C1CC1	ZINC000819190815	EI	On-Demand	Anodyne	C5AR1	24	43
CCc1nn(C)c(CC)c1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819190825	EE	On-Demand	Bother	CACNA1D	44	32
CCc1nn(C)c(CC)c1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819190826	EE	On-Demand	Bother	CACNA1D	44	32
COc1ccc(OC)c([C@H](O)CNC[C@H](C)S(C)(=O)=O)c1	ZINC000819190870	DC	On-Demand	Anodyne	MTNR1A	18	41
COc1ccc(OC)c([C@H](O)CNC[C@@H](C)S(C)(=O)=O)c1	ZINC000819190873	DC	On-Demand	Anodyne	MTNR1A	18	41
CCc1nn(C)c(CC)c1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819190875	GF	On-Demand	Anodyne	GPR119	26	41
CCc1nn(C)c(CC)c1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819190877	GF	On-Demand	Anodyne	GPR119	26	41
CCCN(CCNC[C@H](O)c1cccnc1)C(=O)OC(C)(C)C	ZINC000819190885	DE	On-Demand	Anodyne	ADRB2	24	43
CCCN(CCNC[C@H](O)c1cccnc1)C(=O)OC(C)(C)C	ZINC000819190885	DE	On-Demand	Anodyne	ADRB1	35	43
CCCN(CCNC[C@H](O)c1cccnc1)C(=O)OC(C)(C)C	ZINC000819190885	DE	On-Demand	Anodyne	ADRB3	106	46
CCCN(CCNC[C@@H](O)c1cccnc1)C(=O)OC(C)(C)C	ZINC000819190886	DE	On-Demand	Anodyne	ADRB2	24	43
CCCN(CCNC[C@@H](O)c1cccnc1)C(=O)OC(C)(C)C	ZINC000819190886	DE	On-Demand	Anodyne	ADRB1	35	43
CCCN(CCNC[C@@H](O)c1cccnc1)C(=O)OC(C)(C)C	ZINC000819190886	DE	On-Demand	Anodyne	ADRB3	106	46
COc1ccc(OC)c([C@H](O)CNCCc2cccc([N+](=O)[O-])c2)c1	ZINC000819190895	EE	On-Demand	Bother	ADRB2	64	49
COc1ccc(OC)c([C@H](O)CNCCc2cccc([N+](=O)[O-])c2)c1	ZINC000819190895	EE	On-Demand	Bother	ADRB1	66	48
COc1ccc(OC)c([C@H](O)CNCCc2cccc([N+](=O)[O-])c2)c1	ZINC000819190895	EE	On-Demand	Bother	CACNA1C	43	38
COc1ccc(OC)c([C@H](O)CNCCc2cccc([N+](=O)[O-])c2)c1	ZINC000819190895	EE	On-Demand	Bother	ADRB3	55	48
COc1ccc(OC)c([C@H](O)CNCCc2cccc([N+](=O)[O-])c2)c1	ZINC000819190895	EE	On-Demand	Bother	CACNA1D	70	38
COc1ccc(OC)c([C@H](O)CNCCc2cccc([N+](=O)[O-])c2)c1	ZINC000819190895	EE	On-Demand	Bother	MTNR1A	26	42
CN1Cc2ccccc2[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819190907	DF	On-Demand	Anodyne	SLC6A3	22	41
CN1Cc2ccccc2[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819190908	DF	On-Demand	Anodyne	SLC6A3	22	41
CN1Cc2ccccc2[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819190909	DF	On-Demand	Anodyne	SLC6A3	22	41
CN1Cc2ccccc2[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819190910	DF	On-Demand	Anodyne	SLC6A3	22	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCc1cccc([N+](=O)[O-])c1	ZINC000819190915	FE	On-Demand	Bother	CACNA1C	58	38
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCc1cccc([N+](=O)[O-])c1	ZINC000819190915	FE	On-Demand	Bother	CACNA1D	87	37
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCc1cccc([N+](=O)[O-])c1	ZINC000819190916	FE	On-Demand	Bother	CACNA1C	58	38
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCc1cccc([N+](=O)[O-])c1	ZINC000819190916	FE	On-Demand	Bother	CACNA1D	87	37
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819190924	DF	On-Demand	Bother	ADRB2	54	43
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819190924	DF	On-Demand	Bother	ADRB1	49	43
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819190924	DF	On-Demand	Bother	ADRB3	47	43
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819190924	DF	On-Demand	Bother	CACNA1D	56	35
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819190925	DF	On-Demand	Bother	ADRB2	54	43
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819190925	DF	On-Demand	Bother	ADRB1	49	43
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819190925	DF	On-Demand	Bother	ADRB3	47	43
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819190925	DF	On-Demand	Bother	CACNA1D	56	35
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819190926	EE	On-Demand	Bother	ADRB2	73	44
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819190926	EE	On-Demand	Bother	ADRB1	77	46
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819190926	EE	On-Demand	Bother	CACNA1C	48	37
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819190926	EE	On-Demand	Bother	ADRB3	127	47
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819190926	EE	On-Demand	Bother	CACNA1D	75	37
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819190927	EE	On-Demand	Bother	ADRB2	73	44
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819190927	EE	On-Demand	Bother	ADRB1	77	46
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819190927	EE	On-Demand	Bother	CACNA1C	48	37
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819190927	EE	On-Demand	Bother	ADRB3	127	47
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819190927	EE	On-Demand	Bother	CACNA1D	75	37
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819190935	CD	On-Demand	Bother	ADRB2	67	57
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819190935	CD	On-Demand	Bother	ADRB1	75	56
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819190935	CD	On-Demand	Bother	ADRB3	164	58
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819190935	CD	On-Demand	Bother	TBXAS1	17	40
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819190935	CD	On-Demand	Bother	CACNA1D	40	33
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819190936	CD	On-Demand	Bother	ADRB2	67	57
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819190936	CD	On-Demand	Bother	ADRB1	75	56
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819190936	CD	On-Demand	Bother	ADRB3	164	58
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819190936	CD	On-Demand	Bother	TBXAS1	17	40
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819190936	CD	On-Demand	Bother	CACNA1D	40	33
O[C@H](CNCCOc1cccc(C(F)(F)F)n1)c1cccc(F)c1	ZINC000819190939	EF	On-Demand	Anodyne	ADRB1	28	41
O[C@H](CNCCOc1cccc(C(F)(F)F)n1)c1cccc(F)c1	ZINC000819190939	EF	On-Demand	Anodyne	ADRB3	35	41
O[C@@H](CNCCOc1cccc(C(F)(F)F)n1)c1cccc(F)c1	ZINC000819190940	EF	On-Demand	Anodyne	ADRB1	28	41
O[C@@H](CNCCOc1cccc(C(F)(F)F)n1)c1cccc(F)c1	ZINC000819190940	EF	On-Demand	Anodyne	ADRB3	35	41
CS(=O)(=O)N1CCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819190977	CC	On-Demand	Anodyne	ADRB2	26	41
CS(=O)(=O)N1CCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819190977	CC	On-Demand	Anodyne	ADRB1	28	41
CS(=O)(=O)N1CCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819190977	CC	On-Demand	Anodyne	ADRB3	102	49
CS(=O)(=O)N1CCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819190978	CC	On-Demand	Anodyne	ADRB2	26	41
CS(=O)(=O)N1CCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819190978	CC	On-Demand	Anodyne	ADRB1	28	41
CS(=O)(=O)N1CCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819190978	CC	On-Demand	Anodyne	ADRB3	102	49
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccccc1F	ZINC000819190979	DE	On-Demand	Anodyne	EBP	23	42
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccccc1F	ZINC000819190980	DE	On-Demand	Anodyne	EBP	23	42
O[C@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccccc1F	ZINC000819190981	DE	On-Demand	Anodyne	EBP	23	42
O[C@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccccc1F	ZINC000819190982	DE	On-Demand	Anodyne	EBP	23	42
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819190986	FG	On-Demand	Anodyne	ADRB3	17	43
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819190987	FG	On-Demand	Anodyne	ADRB3	17	43
O[C@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819190988	FG	On-Demand	Anodyne	ADRB3	17	43
O[C@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819190989	FG	On-Demand	Anodyne	ADRB3	17	43
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190996	CD	On-Demand	Anodyne	ADRB2	17	40
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190996	CD	On-Demand	Anodyne	ADRB1	22	40
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190996	CD	On-Demand	Anodyne	DRD4	21	42
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190996	CD	On-Demand	Anodyne	ADRB3	37	40
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190996	CD	On-Demand	Anodyne	EBP	24	40
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190997	CD	On-Demand	Anodyne	ADRB2	17	40
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190997	CD	On-Demand	Anodyne	ADRB1	22	40
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190997	CD	On-Demand	Anodyne	DRD4	21	42
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190997	CD	On-Demand	Anodyne	ADRB3	37	40
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190997	CD	On-Demand	Anodyne	EBP	24	40
O[C@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190998	CD	On-Demand	Anodyne	ADRB2	17	40
O[C@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190998	CD	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190998	CD	On-Demand	Anodyne	DRD4	21	42
O[C@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190998	CD	On-Demand	Anodyne	ADRB3	37	40
O[C@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190998	CD	On-Demand	Anodyne	EBP	24	40
O[C@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190999	CD	On-Demand	Anodyne	ADRB2	17	40
O[C@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190999	CD	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190999	CD	On-Demand	Anodyne	DRD4	21	42
O[C@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190999	CD	On-Demand	Anodyne	ADRB3	37	40
O[C@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccccc1	ZINC000819190999	CD	On-Demand	Anodyne	EBP	24	40
O[C@@H](CNCCC1=CCCC1)c1cccc(Cl)c1	ZINC000819191008	CG	On-Demand	Anodyne	ADRB2	48	40
O[C@@H](CNCCC1=CCCC1)c1cccc(Cl)c1	ZINC000819191008	CG	On-Demand	Anodyne	ADRB1	61	52
O[C@@H](CNCCC1=CCCC1)c1cccc(Cl)c1	ZINC000819191008	CG	On-Demand	Anodyne	ADRB3	80	52
O[C@H](CNCCC1=CCCC1)c1cccc(Cl)c1	ZINC000819191009	CG	On-Demand	Anodyne	ADRB2	48	40
O[C@H](CNCCC1=CCCC1)c1cccc(Cl)c1	ZINC000819191009	CG	On-Demand	Anodyne	ADRB1	61	52
O[C@H](CNCCC1=CCCC1)c1cccc(Cl)c1	ZINC000819191009	CG	On-Demand	Anodyne	ADRB3	80	52
CON(C)C(=O)CCN[C@@H]1CCN(c2ccccn2)C1	ZINC000819191018	CC	On-Demand	Anodyne	DRD4	23	41
CON(C)C(=O)CCN[C@H]1CCN(c2ccccn2)C1	ZINC000819191019	CC	On-Demand	Anodyne	DRD4	23	41
Cc1ccccc1[C@@H](O)CNCCOCc1ccc(Cl)cc1	ZINC000819191026	DG	On-Demand	Anodyne	ADRB2	40	49
Cc1ccccc1[C@@H](O)CNCCOCc1ccc(Cl)cc1	ZINC000819191026	DG	On-Demand	Anodyne	ADRB1	41	41
Cc1ccccc1[C@@H](O)CNCCOCc1ccc(Cl)cc1	ZINC000819191026	DG	On-Demand	Anodyne	ADRB3	35	41
C[C@@H](Cc1nc2ccccc2s1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819191028	GG	On-Demand	Anodyne	FPR1	41	33
O=C(NCCc1c[nH]c2cc(Cl)ccc12)C(F)=C1CCC1	ZINC000819191031	DH	On-Demand	Anodyne	ACHE	32	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3cc(Cl)ccc13)C2	ZINC000819191034	GG	On-Demand	Anodyne	MTNR1A	16	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3cc(Cl)ccc13)C2	ZINC000819191034	GG	On-Demand	Anodyne	CCKBR	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3cc(Cl)ccc13)C2	ZINC000819191035	GG	On-Demand	Anodyne	MTNR1A	16	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3cc(Cl)ccc13)C2	ZINC000819191035	GG	On-Demand	Anodyne	CCKBR	20	40
CS(=O)(=O)N1CCC[C@@H]1CNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819191048	ED	On-Demand	Anodyne	ADRB3	20	40
CS(=O)(=O)N1CCC[C@@H]1CNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819191049	ED	On-Demand	Anodyne	ADRB3	20	40
Cc1cccc(C(C)(C)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819191064	GH	On-Demand	Mild	PAPA1_CARPA	54	48
Cc1cccc(C(C)(C)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819191064	GH	On-Demand	Mild	CTSK	15	45
Cc1cccc(C(C)(C)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819191064	GH	On-Demand	Mild	CTSL	34	48
Cc1cccc(C(C)(C)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819191064	GH	On-Demand	Mild	CTSS	24	51
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(CCc1ccccc1)C1CC1)C2	ZINC000819191071	FG	On-Demand	Anodyne	MBTPS1	59	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(CCc1ccccc1)C1CC1)C2	ZINC000819191072	FG	On-Demand	Anodyne	MBTPS1	59	36
O[C@@H](CNCCC1Cc2ccccc2C1)c1ccc(F)c(F)c1	ZINC000819191073	DG	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CNCCC1Cc2ccccc2C1)c1ccc(F)c(F)c1	ZINC000819191074	DG	On-Demand	Anodyne	ADRB2	15	40
COc1cccc([S@](=O)CC(=O)N(CCc2ccccc2)C2CC2)c1	ZINC000819191099	FG	On-Demand	Anodyne	MBTPS1	41	36
COc1cccc([S@@](=O)CC(=O)N(CCc2ccccc2)C2CC2)c1	ZINC000819191100	FG	On-Demand	Anodyne	MBTPS1	41	36
CCCN(CCNC[C@H](O)c1ccccc1)C(=O)OC(C)(C)C	ZINC000819191103	DF	On-Demand	Anodyne	ADRB2	21	41
CCCN(CCNC[C@H](O)c1ccccc1)C(=O)OC(C)(C)C	ZINC000819191103	DF	On-Demand	Anodyne	ADRB1	33	41
CCCN(CCNC[C@H](O)c1ccccc1)C(=O)OC(C)(C)C	ZINC000819191103	DF	On-Demand	Anodyne	ADRB3	46	47
CCCN(CCNC[C@@H](O)c1ccccc1)C(=O)OC(C)(C)C	ZINC000819191104	DF	On-Demand	Anodyne	ADRB2	21	41
CCCN(CCNC[C@@H](O)c1ccccc1)C(=O)OC(C)(C)C	ZINC000819191104	DF	On-Demand	Anodyne	ADRB1	33	41
CCCN(CCNC[C@@H](O)c1ccccc1)C(=O)OC(C)(C)C	ZINC000819191104	DF	On-Demand	Anodyne	ADRB3	46	47
O=[N+]([O-])c1cccc(CCNC[C@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819191117	FE	On-Demand	Bother	ADRB2	65	55
O=[N+]([O-])c1cccc(CCNC[C@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819191117	FE	On-Demand	Bother	ADRB1	97	55
O=[N+]([O-])c1cccc(CCNC[C@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819191117	FE	On-Demand	Bother	ADRB3	69	55
O=[N+]([O-])c1cccc(CCNC[C@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819191117	FE	On-Demand	Bother	CACNA1D	58	35
O=[N+]([O-])c1cccc(CCNC[C@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819191117	FE	On-Demand	Bother	ABCB1	24	43
O=[N+]([O-])c1cccc(CCNC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819191119	FE	On-Demand	Bother	ADRB2	65	55
O=[N+]([O-])c1cccc(CCNC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819191119	FE	On-Demand	Bother	ADRB1	97	55
O=[N+]([O-])c1cccc(CCNC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819191119	FE	On-Demand	Bother	ADRB3	69	55
O=[N+]([O-])c1cccc(CCNC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819191119	FE	On-Demand	Bother	CACNA1D	58	35
O=[N+]([O-])c1cccc(CCNC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819191119	FE	On-Demand	Bother	ABCB1	24	43
O=[N+]([O-])c1cccc(CCNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819191121	FE	On-Demand	Bother	ADRB2	66	64
O=[N+]([O-])c1cccc(CCNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819191121	FE	On-Demand	Bother	ADRB1	108	64
O=[N+]([O-])c1cccc(CCNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819191121	FE	On-Demand	Bother	GRIN1	18	50
O=[N+]([O-])c1cccc(CCNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819191121	FE	On-Demand	Bother	CACNA1C	45	35
O=[N+]([O-])c1cccc(CCNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819191121	FE	On-Demand	Bother	ADRB3	73	64
O=[N+]([O-])c1cccc(CCNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819191121	FE	On-Demand	Bother	CACNA1D	74	35
O=[N+]([O-])c1cccc(CCNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819191121	FE	On-Demand	Bother	ABCB1	15	47
O=[N+]([O-])c1cccc(CCNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819191121	FE	On-Demand	Bother	ACR	15	46
O=[N+]([O-])c1cccc(CCNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819191121	FE	On-Demand	Bother	PDS	45	48
O=[N+]([O-])c1cccc(CCNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819191123	FE	On-Demand	Bother	ADRB2	66	64
O=[N+]([O-])c1cccc(CCNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819191123	FE	On-Demand	Bother	ADRB1	108	64
O=[N+]([O-])c1cccc(CCNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819191123	FE	On-Demand	Bother	GRIN1	18	50
O=[N+]([O-])c1cccc(CCNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819191123	FE	On-Demand	Bother	CACNA1C	45	35
O=[N+]([O-])c1cccc(CCNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819191123	FE	On-Demand	Bother	ADRB3	73	64
O=[N+]([O-])c1cccc(CCNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819191123	FE	On-Demand	Bother	CACNA1D	74	35
O=[N+]([O-])c1cccc(CCNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819191123	FE	On-Demand	Bother	ABCB1	15	47
O=[N+]([O-])c1cccc(CCNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819191123	FE	On-Demand	Bother	ACR	15	46
O=[N+]([O-])c1cccc(CCNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819191123	FE	On-Demand	Bother	PDS	45	48
O[C@H](CNCCOc1cccc(C(F)(F)F)n1)c1ccccc1	ZINC000819191124	EF	On-Demand	Anodyne	ADRB2	24	40
O[C@H](CNCCOc1cccc(C(F)(F)F)n1)c1ccccc1	ZINC000819191124	EF	On-Demand	Anodyne	ADRB1	36	45
O[C@H](CNCCOc1cccc(C(F)(F)F)n1)c1ccccc1	ZINC000819191124	EF	On-Demand	Anodyne	ADRB3	53	45
O[C@@H](CNCCOc1cccc(C(F)(F)F)n1)c1ccccc1	ZINC000819191126	EF	On-Demand	Anodyne	ADRB2	24	40
O[C@@H](CNCCOc1cccc(C(F)(F)F)n1)c1ccccc1	ZINC000819191126	EF	On-Demand	Anodyne	ADRB1	36	45
O[C@@H](CNCCOc1cccc(C(F)(F)F)n1)c1ccccc1	ZINC000819191126	EF	On-Demand	Anodyne	ADRB3	53	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2cccc([N+](=O)[O-])c2)CC1	ZINC000819191127	GF	On-Demand	Bother	CACNA1C	59	35
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2cccc([N+](=O)[O-])c2)CC1	ZINC000819191127	GF	On-Demand	Bother	CACNA1D	88	34
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2cccc([N+](=O)[O-])c2)CC1	ZINC000819191127	GF	On-Demand	Bother	GPR119	38	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2cccc([N+](=O)[O-])c2)CC1	ZINC000819191129	GF	On-Demand	Bother	CACNA1C	59	35
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2cccc([N+](=O)[O-])c2)CC1	ZINC000819191129	GF	On-Demand	Bother	CACNA1D	88	34
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2cccc([N+](=O)[O-])c2)CC1	ZINC000819191129	GF	On-Demand	Bother	GPR119	38	48
O=[N+]([O-])c1ccc(S(=O)(=O)CCNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191136	GE	On-Demand	Bother	CACNA1D	46	35
O=[N+]([O-])c1ccc(S(=O)(=O)CCNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191136	GE	On-Demand	Bother	MMP8	22	41
O=[N+]([O-])c1ccc(S(=O)(=O)CCNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191136	GE	On-Demand	Bother	MMP1	15	41
CN(C[C@@H](O)CNCCc1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C	ZINC000819191142	FD	On-Demand	Bother	ADRB1	26	42
CN(C[C@@H](O)CNCCc1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C	ZINC000819191142	FD	On-Demand	Bother	CACNA1C	51	35
CN(C[C@@H](O)CNCCc1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C	ZINC000819191142	FD	On-Demand	Bother	ADRB3	22	42
CN(C[C@@H](O)CNCCc1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C	ZINC000819191142	FD	On-Demand	Bother	CACNA1D	77	35
CN(C[C@H](O)CNCCc1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C	ZINC000819191143	FD	On-Demand	Bother	ADRB1	26	42
CN(C[C@H](O)CNCCc1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C	ZINC000819191143	FD	On-Demand	Bother	CACNA1C	51	35
CN(C[C@H](O)CNCCc1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C	ZINC000819191143	FD	On-Demand	Bother	ADRB3	22	42
CN(C[C@H](O)CNCCc1cccc([N+](=O)[O-])c1)C(=O)OC(C)(C)C	ZINC000819191143	FD	On-Demand	Bother	CACNA1D	77	35
C#CCNC(=O)CCNCCc1ccc(Oc2ccc(OC)cc2)cc1	ZINC000819191176	FF	On-Demand	Mild	MTNR1A	51	36
C#CCNC(=O)CCNCCc1ccc(Oc2ccc(OC)cc2)cc1	ZINC000819191176	FF	On-Demand	Mild	MTNR1B	40	34
C#CCNC(=O)CCNCCc1ccc(Oc2ccc(OC)cc2)cc1	ZINC000819191176	FF	On-Demand	Mild	CA9	17	46
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191182	EE	On-Demand	Bother	ADRB2	74	44
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191182	EE	On-Demand	Bother	ADRB1	68	43
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191182	EE	On-Demand	Bother	CACNA1C	46	36
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191182	EE	On-Demand	Bother	ADRB3	95	43
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191182	EE	On-Demand	Bother	CACNA1D	71	36
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191184	EE	On-Demand	Bother	ADRB2	74	44
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191184	EE	On-Demand	Bother	ADRB1	68	43
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191184	EE	On-Demand	Bother	CACNA1C	46	36
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191184	EE	On-Demand	Bother	ADRB3	95	43
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191184	EE	On-Demand	Bother	CACNA1D	71	36
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1F	ZINC000819191200	FH	On-Demand	Mild	PAPA1_CARPA	54	52
C[C@H](CO)CCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819191235	CF	On-Demand	Anodyne	ADRB2	40	43
C[C@H](CO)CCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819191235	CF	On-Demand	Anodyne	ADRB1	30	43
C[C@H](CO)CCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819191235	CF	On-Demand	Anodyne	ADRB3	28	43
C[C@H](CO)CCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819191237	CF	On-Demand	Anodyne	ADRB2	40	43
C[C@H](CO)CCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819191237	CF	On-Demand	Anodyne	ADRB1	30	43
C[C@H](CO)CCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819191237	CF	On-Demand	Anodyne	ADRB3	28	43
C[C@@H](CO)CCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819191238	CF	On-Demand	Anodyne	ADRB2	40	43
C[C@@H](CO)CCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819191238	CF	On-Demand	Anodyne	ADRB1	30	43
C[C@@H](CO)CCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819191238	CF	On-Demand	Anodyne	ADRB3	28	43
C[C@@H](CO)CCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819191240	CF	On-Demand	Anodyne	ADRB2	40	43
C[C@@H](CO)CCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819191240	CF	On-Demand	Anodyne	ADRB1	30	43
C[C@@H](CO)CCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819191240	CF	On-Demand	Anodyne	ADRB3	28	43
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819191258	FG	On-Demand	Bother	ADRB2	52	41
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819191258	FG	On-Demand	Bother	ADRB1	54	42
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819191258	FG	On-Demand	Bother	ADRB3	89	43
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819191259	FG	On-Demand	Bother	ADRB2	52	41
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819191259	FG	On-Demand	Bother	ADRB1	54	42
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819191259	FG	On-Demand	Bother	ADRB3	89	43
Cc1cccc(C(C)(C)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819191265	GH	On-Demand	Mild	PAPA1_CARPA	54	48
Cc1cccc(C(C)(C)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819191265	GH	On-Demand	Mild	CTSK	15	45
Cc1cccc(C(C)(C)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819191265	GH	On-Demand	Mild	CTSL	34	48
Cc1cccc(C(C)(C)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819191265	GH	On-Demand	Mild	CTSS	24	51
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccc(F)cc1F	ZINC000819191271	DE	On-Demand	Anodyne	DRD4	17	41
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccc(F)cc1F	ZINC000819191272	DE	On-Demand	Anodyne	DRD4	17	41
O[C@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccc(F)cc1F	ZINC000819191273	DE	On-Demand	Anodyne	DRD4	17	41
O[C@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccc(F)cc1F	ZINC000819191274	DE	On-Demand	Anodyne	DRD4	17	41
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1ccc(F)c(F)c1	ZINC000819191275	EG	On-Demand	Anodyne	ADRB2	52	56
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1ccc(F)c(F)c1	ZINC000819191275	EG	On-Demand	Anodyne	ADRB1	45	46
O[C@@H](CNCCOCc1ccc(Cl)cc1)c1ccc(F)c(F)c1	ZINC000819191275	EG	On-Demand	Anodyne	ADRB3	49	46
O[C@H](CNCCOCc1ccc(Cl)cc1)c1ccc(F)c(F)c1	ZINC000819191276	EG	On-Demand	Anodyne	ADRB2	52	56
O[C@H](CNCCOCc1ccc(Cl)cc1)c1ccc(F)c(F)c1	ZINC000819191276	EG	On-Demand	Anodyne	ADRB1	45	46
O[C@H](CNCCOCc1ccc(Cl)cc1)c1ccc(F)c(F)c1	ZINC000819191276	EG	On-Demand	Anodyne	ADRB3	49	46
CN(C)c1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nc1	ZINC000819191281	FF	On-Demand	Mild	PAPA1_CARPA	42	43
CN(C)c1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)nc1	ZINC000819191282	FF	On-Demand	Mild	PAPA1_CARPA	42	43
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819191284	EF	On-Demand	Anodyne	L3MBTL3	66	34
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819191285	EF	On-Demand	Anodyne	L3MBTL3	66	34
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819191286	EF	On-Demand	Anodyne	L3MBTL3	66	34
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCc2ccc(Cl)cc2)c1	ZINC000819191295	FG	On-Demand	Bother	ADRB2	39	47
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCc2ccc(Cl)cc2)c1	ZINC000819191295	FG	On-Demand	Bother	ADRB1	51	43
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCc2ccc(Cl)cc2)c1	ZINC000819191295	FG	On-Demand	Bother	ADRB3	63	43
O=[N+]([O-])c1cccc([C@H](O)CNCCOCc2ccc(Cl)cc2)c1	ZINC000819191296	FG	On-Demand	Bother	ADRB2	39	47
O=[N+]([O-])c1cccc([C@H](O)CNCCOCc2ccc(Cl)cc2)c1	ZINC000819191296	FG	On-Demand	Bother	ADRB1	51	43
O=[N+]([O-])c1cccc([C@H](O)CNCCOCc2ccc(Cl)cc2)c1	ZINC000819191296	FG	On-Demand	Bother	ADRB3	63	43
CS(=O)(=O)c1ccc([C@H](O)CNCCOCc2ccc(Cl)cc2)cc1	ZINC000819191309	GF	On-Demand	Anodyne	ADRB2	36	48
CS(=O)(=O)c1ccc([C@H](O)CNCCOCc2ccc(Cl)cc2)cc1	ZINC000819191309	GF	On-Demand	Anodyne	ADRB1	46	45
CS(=O)(=O)c1ccc([C@H](O)CNCCOCc2ccc(Cl)cc2)cc1	ZINC000819191309	GF	On-Demand	Anodyne	ADRB3	78	45
CS(=O)(=O)c1ccc([C@@H](O)CNCCOCc2ccc(Cl)cc2)cc1	ZINC000819191310	GF	On-Demand	Anodyne	ADRB2	36	48
CS(=O)(=O)c1ccc([C@@H](O)CNCCOCc2ccc(Cl)cc2)cc1	ZINC000819191310	GF	On-Demand	Anodyne	ADRB1	46	45
CS(=O)(=O)c1ccc([C@@H](O)CNCCOCc2ccc(Cl)cc2)cc1	ZINC000819191310	GF	On-Demand	Anodyne	ADRB3	78	45
CCC1(CNCCS(C)(=O)=O)CCN(Cc2ccccc2)CC1	ZINC000819191311	EE	On-Demand	Anodyne	SIGMAR1	60	40
CCC1(CNCCS(C)(=O)=O)CCN(Cc2ccccc2)CC1	ZINC000819191311	EE	On-Demand	Anodyne	NPFFR2	31	43
CCC1(CNCCS(C)(=O)=O)CCN(Cc2ccccc2)CC1	ZINC000819191311	EE	On-Demand	Anodyne	NPFFR1	44	43
CS(=O)(=O)N1CCC[C@@H]1CNC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819191329	FD	On-Demand	Anodyne	SFRP1	98	35
CS(=O)(=O)N1CCC[C@@H]1CNC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819191329	FD	On-Demand	Anodyne	WNT3	72	34
CS(=O)(=O)N1CCC[C@@H]1CNC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819191330	FD	On-Demand	Anodyne	SFRP1	98	35
CS(=O)(=O)N1CCC[C@@H]1CNC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819191330	FD	On-Demand	Anodyne	WNT3	72	34
O=[N+]([O-])c1ccc([C@@H](O)CNCCOCc2ccc(Cl)cc2)cc1	ZINC000819191341	FG	On-Demand	Bother	ADRB2	22	48
O=[N+]([O-])c1ccc([C@@H](O)CNCCOCc2ccc(Cl)cc2)cc1	ZINC000819191341	FG	On-Demand	Bother	ADRB1	30	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCOCc2ccc(Cl)cc2)cc1	ZINC000819191341	FG	On-Demand	Bother	ADRB3	33	42
O=[N+]([O-])c1ccc([C@H](O)CNCCOCc2ccc(Cl)cc2)cc1	ZINC000819191342	FG	On-Demand	Bother	ADRB2	22	48
O=[N+]([O-])c1ccc([C@H](O)CNCCOCc2ccc(Cl)cc2)cc1	ZINC000819191342	FG	On-Demand	Bother	ADRB1	30	42
O=[N+]([O-])c1ccc([C@H](O)CNCCOCc2ccc(Cl)cc2)cc1	ZINC000819191342	FG	On-Demand	Bother	ADRB3	33	42
C[C@@H](Cc1nc2ccccc2s1)NC(=O)C(F)=C1CCC1	ZINC000819191346	DH	On-Demand	Anodyne	TMPRSS6	40	32
COc1ccc(C(=O)N2CCCC2)cc1NC(=O)C(F)=C1CCC1	ZINC000819191348	EG	On-Demand	Anodyne	L3MBTL3	46	35
COc1ccc(OC)c([C@H](O)CNCCOCc2ccc(Cl)cc2)c1	ZINC000819191359	FG	On-Demand	Anodyne	ADRB2	37	49
COc1ccc(OC)c([C@H](O)CNCCOCc2ccc(Cl)cc2)c1	ZINC000819191359	FG	On-Demand	Anodyne	ADRB1	42	42
COc1ccc(OC)c([C@H](O)CNCCOCc2ccc(Cl)cc2)c1	ZINC000819191359	FG	On-Demand	Anodyne	ADRB3	38	42
Cc1cc(F)ccc1[C@@H](O)CNCCC[C@@H](C)CO	ZINC000819191369	CE	On-Demand	Anodyne	LEF	43	32
O=S(=O)(Cc1ccccc1CNC[C@H](O)c1cccc(F)c1)N1CCCC1	ZINC000819191375	GF	On-Demand	Anodyne	ADRB3	16	41
Cc1cc(F)ccc1[C@@H](O)CNCCC[C@H](C)CO	ZINC000819191376	CE	On-Demand	Anodyne	LEF	43	32
O=S(=O)(Cc1ccccc1CNC[C@@H](O)c1cccc(F)c1)N1CCCC1	ZINC000819191377	GF	On-Demand	Anodyne	ADRB3	16	41
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCc2cccc([N+](=O)[O-])c2)CC1	ZINC000819191384	GF	On-Demand	Bother	CACNA1C	50	35
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCc2cccc([N+](=O)[O-])c2)CC1	ZINC000819191384	GF	On-Demand	Bother	CACNA1D	80	35
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCc2cccc([N+](=O)[O-])c2)CC1	ZINC000819191385	GF	On-Demand	Bother	CACNA1C	50	35
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCc2cccc([N+](=O)[O-])c2)CC1	ZINC000819191385	GF	On-Demand	Bother	CACNA1D	80	35
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819191440	DF	On-Demand	Bother	ADRB2	61	41
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819191440	DF	On-Demand	Bother	ADRB1	64	50
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819191440	DF	On-Demand	Bother	CACNA1C	32	41
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819191440	DF	On-Demand	Bother	ADRB3	105	50
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819191440	DF	On-Demand	Bother	CACNA1D	52	41
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819191442	DF	On-Demand	Bother	ADRB2	61	41
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819191442	DF	On-Demand	Bother	ADRB1	64	50
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819191442	DF	On-Demand	Bother	CACNA1C	32	41
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819191442	DF	On-Demand	Bother	ADRB3	105	50
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819191442	DF	On-Demand	Bother	CACNA1D	52	41
O=C(Cc1ccc(-n2cnnc2)cc1)N(CCc1ccccc1)C1CC1	ZINC000819191457	EG	On-Demand	Anodyne	HTR1D	44	39
O=C(Cc1ccc(-n2cnnc2)cc1)N(CCc1ccccc1)C1CC1	ZINC000819191457	EG	On-Demand	Anodyne	C5AR1	22	42
O=C(Cc1ccc(-n2cnnc2)cc1)N(CCc1ccccc1)C1CC1	ZINC000819191457	EG	On-Demand	Anodyne	MBTPS1	64	32
CC(C)(C)OC(=O)NC1C[C@@H]2CCC[C@H](C1)C2NC[C@H](O)c1ccccc1	ZINC000819191487	FH	On-Demand	Anodyne	PGC	41	31
CC(C)(C)OC(=O)NC1C[C@@H]2CCC[C@H](C1)C2NC[C@H](O)c1ccccc1	ZINC000819191487	FH	On-Demand	Anodyne	FPR1	40	37
CC(C)(C)OC(=O)NC1C[C@@H]2CCC[C@H](C1)C2NC[C@@H](O)c1ccccc1	ZINC000819191489	FH	On-Demand	Anodyne	PGC	41	31
CC(C)(C)OC(=O)NC1C[C@@H]2CCC[C@H](C1)C2NC[C@@H](O)c1ccccc1	ZINC000819191489	FH	On-Demand	Anodyne	FPR1	40	37
O=[N+]([O-])c1cccc(CCNC[C@@H](O)C2CC2)c1	ZINC000819191503	CD	On-Demand	Bother	ADRB1	25	43
O=[N+]([O-])c1cccc(CCNC[C@@H](O)C2CC2)c1	ZINC000819191503	CD	On-Demand	Bother	CACNA1C	57	37
O=[N+]([O-])c1cccc(CCNC[C@@H](O)C2CC2)c1	ZINC000819191503	CD	On-Demand	Bother	ADRB3	24	43
O=[N+]([O-])c1cccc(CCNC[C@@H](O)C2CC2)c1	ZINC000819191503	CD	On-Demand	Bother	CACNA1D	87	36
O=[N+]([O-])c1cccc(CCNC[C@@H](O)C2CC2)c1	ZINC000819191503	CD	On-Demand	Bother	LUXR	17	45
O=[N+]([O-])c1cccc(CCNC[C@H](O)C2CC2)c1	ZINC000819191504	CD	On-Demand	Bother	ADRB1	25	43
O=[N+]([O-])c1cccc(CCNC[C@H](O)C2CC2)c1	ZINC000819191504	CD	On-Demand	Bother	CACNA1C	57	37
O=[N+]([O-])c1cccc(CCNC[C@H](O)C2CC2)c1	ZINC000819191504	CD	On-Demand	Bother	ADRB3	24	43
O=[N+]([O-])c1cccc(CCNC[C@H](O)C2CC2)c1	ZINC000819191504	CD	On-Demand	Bother	CACNA1D	87	36
O=[N+]([O-])c1cccc(CCNC[C@H](O)C2CC2)c1	ZINC000819191504	CD	On-Demand	Bother	LUXR	17	45
C[C@H](CNC[C@@H](O)c1cccc(C(F)(F)F)c1)S(C)(=O)=O	ZINC000819191520	ED	On-Demand	Anodyne	ADRB2	17	40
C[C@H](CNC[C@@H](O)c1cccc(C(F)(F)F)c1)S(C)(=O)=O	ZINC000819191520	ED	On-Demand	Anodyne	ADRB3	54	37
C[C@@H](CNC[C@H](O)c1cccc(C(F)(F)F)c1)S(C)(=O)=O	ZINC000819191521	ED	On-Demand	Anodyne	ADRB2	17	40
C[C@@H](CNC[C@H](O)c1cccc(C(F)(F)F)c1)S(C)(=O)=O	ZINC000819191521	ED	On-Demand	Anodyne	ADRB3	54	37
C[C@@H](CNC[C@@H](O)c1cccc(C(F)(F)F)c1)S(C)(=O)=O	ZINC000819191522	ED	On-Demand	Anodyne	ADRB2	17	40
C[C@@H](CNC[C@@H](O)c1cccc(C(F)(F)F)c1)S(C)(=O)=O	ZINC000819191522	ED	On-Demand	Anodyne	ADRB3	54	37
C[C@H](CNC[C@H](O)c1cccc(C(F)(F)F)c1)S(C)(=O)=O	ZINC000819191523	ED	On-Demand	Anodyne	ADRB2	17	40
C[C@H](CNC[C@H](O)c1cccc(C(F)(F)F)c1)S(C)(=O)=O	ZINC000819191523	ED	On-Demand	Anodyne	ADRB3	54	37
CON(C)C(=O)CCNCCc1cccc([N+](=O)[O-])c1	ZINC000819191530	CD	On-Demand	Bother	CACNA1C	68	43
CON(C)C(=O)CCNCCc1cccc([N+](=O)[O-])c1	ZINC000819191530	CD	On-Demand	Bother	CACNA1D	105	42
C#CC[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819191532	FG	On-Demand	Mild	GPR119	41	48
C#CC[C@@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819191534	FG	On-Demand	Mild	GPR119	41	48
C#CC[C@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819191536	FG	On-Demand	Mild	GPR119	41	48
C#CC[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819191538	FG	On-Demand	Mild	GPR119	41	48
O=C1C[C@H](CNC[C@H](O)c2cccnc2)CN1Cc1ccccc1	ZINC000819191540	ED	On-Demand	Anodyne	ADRB2	21	44
O=C1C[C@H](CNC[C@H](O)c2cccnc2)CN1Cc1ccccc1	ZINC000819191540	ED	On-Demand	Anodyne	ADRB3	94	51
O=C1C[C@@H](CNC[C@@H](O)c2cccnc2)CN1Cc1ccccc1	ZINC000819191542	ED	On-Demand	Anodyne	ADRB2	21	44
O=C1C[C@@H](CNC[C@@H](O)c2cccnc2)CN1Cc1ccccc1	ZINC000819191542	ED	On-Demand	Anodyne	ADRB3	94	51
O=C1C[C@H](CNC[C@@H](O)c2cccnc2)CN1Cc1ccccc1	ZINC000819191544	ED	On-Demand	Anodyne	ADRB2	21	44
O=C1C[C@H](CNC[C@@H](O)c2cccnc2)CN1Cc1ccccc1	ZINC000819191544	ED	On-Demand	Anodyne	ADRB3	94	51
O=C1C[C@@H](CNC[C@H](O)c2cccnc2)CN1Cc1ccccc1	ZINC000819191546	ED	On-Demand	Anodyne	ADRB2	21	44
O=C1C[C@@H](CNC[C@H](O)c2cccnc2)CN1Cc1ccccc1	ZINC000819191546	ED	On-Demand	Anodyne	ADRB3	94	51
O[C@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819191583	FF	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819191583	FF	On-Demand	Anodyne	ADRB1	16	40
O[C@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819191583	FF	On-Demand	Anodyne	ADRB3	28	40
O[C@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819191584	FF	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819191584	FF	On-Demand	Anodyne	ADRB1	16	40
O[C@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819191584	FF	On-Demand	Anodyne	ADRB3	28	40
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819191585	FF	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819191585	FF	On-Demand	Anodyne	ADRB1	16	40
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819191585	FF	On-Demand	Anodyne	ADRB3	28	40
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819191586	FF	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819191586	FF	On-Demand	Anodyne	ADRB1	16	40
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819191586	FF	On-Demand	Anodyne	ADRB3	28	40
N#Cc1ccc([C@H](O)CNCCOCc2ccc(Cl)cc2)cc1	ZINC000819191605	EG	On-Demand	Mild	ADRB2	20	49
N#Cc1ccc([C@H](O)CNCCOCc2ccc(Cl)cc2)cc1	ZINC000819191605	EG	On-Demand	Mild	ADRB1	25	40
N#Cc1ccc([C@H](O)CNCCOCc2ccc(Cl)cc2)cc1	ZINC000819191605	EG	On-Demand	Mild	ADRB3	25	40
N#Cc1ccc([C@@H](O)CNCCOCc2ccc(Cl)cc2)cc1	ZINC000819191606	EG	On-Demand	Mild	ADRB2	20	49
N#Cc1ccc([C@@H](O)CNCCOCc2ccc(Cl)cc2)cc1	ZINC000819191606	EG	On-Demand	Mild	ADRB1	25	40
N#Cc1ccc([C@@H](O)CNCCOCc2ccc(Cl)cc2)cc1	ZINC000819191606	EG	On-Demand	Mild	ADRB3	25	40
O[C@@H](CN[C@@H]1CCN(c2ccccn2)C1)c1c(F)cccc1F	ZINC000819191608	DE	On-Demand	Anodyne	EBP	23	44
O[C@H](CN[C@@H]1CCN(c2ccccn2)C1)c1c(F)cccc1F	ZINC000819191609	DE	On-Demand	Anodyne	EBP	23	44
O[C@H](CN[C@H]1CCN(c2ccccn2)C1)c1c(F)cccc1F	ZINC000819191610	DE	On-Demand	Anodyne	EBP	23	44
O[C@@H](CN[C@H]1CCN(c2ccccn2)C1)c1c(F)cccc1F	ZINC000819191611	DE	On-Demand	Anodyne	EBP	23	44
CCC1(CNC[C@H](O)C2CC2)CCN(Cc2ccccc2)CC1	ZINC000819191625	DG	On-Demand	Anodyne	ACHE	29	41
CCC1(CNC[C@H](O)C2CC2)CCN(Cc2ccccc2)CC1	ZINC000819191625	DG	On-Demand	Anodyne	SIGMAR1	66	47
CCC1(CNC[C@H](O)C2CC2)CCN(Cc2ccccc2)CC1	ZINC000819191625	DG	On-Demand	Anodyne	NPFFR2	28	42
CCC1(CNC[C@H](O)C2CC2)CCN(Cc2ccccc2)CC1	ZINC000819191625	DG	On-Demand	Anodyne	NPFFR1	43	42
CCC1(CNC[C@@H](O)C2CC2)CCN(Cc2ccccc2)CC1	ZINC000819191626	DG	On-Demand	Anodyne	ACHE	29	41
CCC1(CNC[C@@H](O)C2CC2)CCN(Cc2ccccc2)CC1	ZINC000819191626	DG	On-Demand	Anodyne	SIGMAR1	66	47
CCC1(CNC[C@@H](O)C2CC2)CCN(Cc2ccccc2)CC1	ZINC000819191626	DG	On-Demand	Anodyne	NPFFR2	28	42
CCC1(CNC[C@@H](O)C2CC2)CCN(Cc2ccccc2)CC1	ZINC000819191626	DG	On-Demand	Anodyne	NPFFR1	43	42
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819191638	FG	On-Demand	Bother	ADRB2	48	38
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819191638	FG	On-Demand	Bother	ADRB1	45	41
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819191638	FG	On-Demand	Bother	ADRB3	49	41
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819191638	FG	On-Demand	Bother	CACNA1D	49	35
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819191639	FG	On-Demand	Bother	ADRB2	48	38
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819191639	FG	On-Demand	Bother	ADRB1	45	41
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819191639	FG	On-Demand	Bother	ADRB3	49	41
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819191639	FG	On-Demand	Bother	CACNA1D	49	35
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191643	FD	On-Demand	Bother	ADRB2	76	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191643	FD	On-Demand	Bother	ADRB1	73	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191643	FD	On-Demand	Bother	CACNA1C	41	35
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191643	FD	On-Demand	Bother	ADRB3	140	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191643	FD	On-Demand	Bother	CACNA1D	62	35
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191644	FD	On-Demand	Bother	ADRB2	76	42
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191644	FD	On-Demand	Bother	ADRB1	73	43
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191644	FD	On-Demand	Bother	CACNA1C	41	35
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191644	FD	On-Demand	Bother	ADRB3	140	44
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc([N+](=O)[O-])c2)cc1	ZINC000819191644	FD	On-Demand	Bother	CACNA1D	62	35
O=[N+]([O-])c1cccc(CCNC[C@H](O)Cn2cc([N+](=O)[O-])cn2)c1	ZINC000819191652	EC	On-Demand	Bother	ADRB3	15	42
O=[N+]([O-])c1cccc(CCNC[C@@H](O)Cn2cc([N+](=O)[O-])cn2)c1	ZINC000819191653	EC	On-Demand	Bother	ADRB3	15	42
C#CC[C@H](NCC1(O)CCC(C(=O)OCC)CC1)c1ccccc1	ZINC000819191658	EF	On-Demand	Mild	TIMP3	46	32
C#CC[C@@H](NCC1(O)CCC(C(=O)OCC)CC1)c1ccccc1	ZINC000819191659	EF	On-Demand	Mild	TIMP3	46	32
O[C@H](CNCCOc1cccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819191664	FG	On-Demand	Anodyne	ADRB1	54	46
O[C@H](CNCCOc1cccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819191664	FG	On-Demand	Anodyne	ADRB3	64	46
O[C@@H](CNCCOc1cccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819191665	FG	On-Demand	Anodyne	ADRB1	54	46
O[C@@H](CNCCOc1cccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819191665	FG	On-Demand	Anodyne	ADRB3	64	46
Cc1cc(C(=O)NCCc2ccc(Br)cc2Cl)n2nc(C)cc2n1	ZINC000819191707	HH	On-Demand	Anodyne	CNR1	15	43
O=C1C[C@H](CNC[C@H](O)c2cccc(Cl)c2)CN1Cc1ccccc1	ZINC000819191712	FG	On-Demand	Anodyne	ADRB1	46	44
O=C1C[C@H](CNC[C@H](O)c2cccc(Cl)c2)CN1Cc1ccccc1	ZINC000819191712	FG	On-Demand	Anodyne	ADRB3	57	44
O=C1C[C@@H](CNC[C@H](O)c2cccc(Cl)c2)CN1Cc1ccccc1	ZINC000819191713	FG	On-Demand	Anodyne	ADRB1	46	44
O=C1C[C@@H](CNC[C@H](O)c2cccc(Cl)c2)CN1Cc1ccccc1	ZINC000819191713	FG	On-Demand	Anodyne	ADRB3	57	44
O=C1C[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)CN1Cc1ccccc1	ZINC000819191715	FG	On-Demand	Anodyne	ADRB1	46	44
O=C1C[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)CN1Cc1ccccc1	ZINC000819191715	FG	On-Demand	Anodyne	ADRB3	57	44
O=C1C[C@H](CNC[C@@H](O)c2cccc(Cl)c2)CN1Cc1ccccc1	ZINC000819191717	FG	On-Demand	Anodyne	ADRB1	46	44
O=C1C[C@H](CNC[C@@H](O)c2cccc(Cl)c2)CN1Cc1ccccc1	ZINC000819191717	FG	On-Demand	Anodyne	ADRB3	57	44
NC(=O)c1cc(N2CCCCC2)ccc1NC(=O)c1cccc(S(=O)(=O)NC2CC2)c1	ZINC000819191722	IE	On-Demand	Anodyne	CCR8	83	41
NC(=O)c1cc(N2CCCCC2)ccc1NC(=O)c1cccc(S(=O)(=O)NC2CC2)c1	ZINC000819191722	IE	On-Demand	Anodyne	SFRP1	79	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCC2Cc3ccccc3C2)cc1	ZINC000819191724	FF	On-Demand	Anodyne	ADRB3	52	39
CS(=O)(=O)c1ccc([C@H](O)CNCCC2Cc3ccccc3C2)cc1	ZINC000819191727	FF	On-Demand	Anodyne	ADRB3	52	39
O[C@H](CNCCC1Cc2ccccc2C1)c1cccnc1	ZINC000819191729	CF	On-Demand	Anodyne	ADRB2	26	46
O[C@H](CNCCC1Cc2ccccc2C1)c1cccnc1	ZINC000819191729	CF	On-Demand	Anodyne	ADRB1	29	44
O[C@H](CNCCC1Cc2ccccc2C1)c1cccnc1	ZINC000819191729	CF	On-Demand	Anodyne	ADRB3	103	47
O[C@@H](CNCCC1Cc2ccccc2C1)c1cccnc1	ZINC000819191730	CF	On-Demand	Anodyne	ADRB2	26	46
O[C@@H](CNCCC1Cc2ccccc2C1)c1cccnc1	ZINC000819191730	CF	On-Demand	Anodyne	ADRB1	29	44
O[C@@H](CNCCC1Cc2ccccc2C1)c1cccnc1	ZINC000819191730	CF	On-Demand	Anodyne	ADRB3	103	47
CC(C)(C)OC(=O)NC1C[C@@H]2CCC[C@H](C1)C2NC[C@@H](O)c1cccnc1	ZINC000819191735	GG	On-Demand	Anodyne	ADRB1	18	40
CC(C)(C)OC(=O)NC1C[C@@H]2CCC[C@H](C1)C2NC[C@@H](O)c1cccnc1	ZINC000819191735	GG	On-Demand	Anodyne	ADRB3	63	45
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819191736	FG	On-Demand	Bother	ADRB2	60	41
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819191736	FG	On-Demand	Bother	ADRB1	62	43
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819191736	FG	On-Demand	Bother	ADRB3	96	43
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819191736	FG	On-Demand	Bother	CACNA1D	49	34
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819191738	FG	On-Demand	Bother	ADRB2	60	41
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819191738	FG	On-Demand	Bother	ADRB1	62	43
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819191738	FG	On-Demand	Bother	ADRB3	96	43
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819191738	FG	On-Demand	Bother	CACNA1D	49	34
CC(C)(C)OC(=O)NC1C[C@@H]2CCC[C@H](C1)C2NC[C@H](O)c1cccnc1	ZINC000819191739	GG	On-Demand	Anodyne	ADRB1	18	40
CC(C)(C)OC(=O)NC1C[C@@H]2CCC[C@H](C1)C2NC[C@H](O)c1cccnc1	ZINC000819191739	GG	On-Demand	Anodyne	ADRB3	63	45
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819191740	HH	On-Demand	Anodyne	NQO2	19	44
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819191740	HH	On-Demand	Anodyne	PAPA1_CARPA	35	41
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1OC	ZINC000819191752	GH	On-Demand	Mild	PAPA1_CARPA	56	46
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1OC	ZINC000819191752	GH	On-Demand	Mild	CTSK	18	43
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1OC	ZINC000819191752	GH	On-Demand	Mild	FPR1	43	37
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819191765	ID	On-Demand	Anodyne	F2	54	42
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819191765	ID	On-Demand	Anodyne	TRY1_BOVIN	53	39
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819191765	ID	On-Demand	Anodyne	PREP	53	39
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819191765	ID	On-Demand	Anodyne	TMPRSS11D	59	39
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819191767	ID	On-Demand	Anodyne	F2	54	42
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819191767	ID	On-Demand	Anodyne	TRY1_BOVIN	53	39
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819191767	ID	On-Demand	Anodyne	PREP	53	39
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819191767	ID	On-Demand	Anodyne	TMPRSS11D	59	39
O=C(Nc1ccccc1C(=O)NCc1ncn(-c2ccccc2)n1)OCc1ccccc1	ZINC000819191816	IH	On-Demand	Anodyne	CAPN2	41	34
O=C(Nc1ccccc1C(=O)NCc1ncn(-c2ccccc2)n1)OCc1ccccc1	ZINC000819191816	IH	On-Demand	Anodyne	NPR	51	33
Cc1nc(O)nc(O)c1CCC(=O)NCCc1ccc(Br)cc1Cl	ZINC000819191831	HF	On-Demand	Anodyne	P2RX7	25	42
CC(C)c1nn(C)c(Cl)c1C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819191835	HJ	On-Demand	Anodyne	CNR1	15	40
CC(=O)CCCCCCC(=O)NCCc1ccc(Br)cc1Cl	ZINC000819191840	GJ	On-Demand	Anodyne	HDAC8	19	42
CC(=O)CCCCCCC(=O)NCCc1ccc(Br)cc1Cl	ZINC000819191840	GJ	On-Demand	Anodyne	MTNR1A	26	44
CC(=O)CCCCCCC(=O)NCCc1ccc(Br)cc1Cl	ZINC000819191840	GJ	On-Demand	Anodyne	MTNR1B	16	44
CC(=O)CCCCCCC(=O)NCCc1ccc(Br)cc1Cl	ZINC000819191840	GJ	On-Demand	Anodyne	HDAC1	17	40
CC(=O)CCCCCCC(=O)NCCc1ccc(Br)cc1Cl	ZINC000819191840	GJ	On-Demand	Anodyne	HDAC9	40	38
O=C(COc1ccc2ccc(=O)oc2c1)NCc1ncn(-c2ccccc2)n1	ZINC000819191843	GE	On-Demand	Anodyne	MAOB	26	47
O=C(COc1ccc2ccc(=O)oc2c1)NCc1ncn(-c2ccccc2)n1	ZINC000819191843	GE	On-Demand	Anodyne	BCHE	17	42
O=C(/C=C\c1ccncn1)NCCc1ccc(Br)cc1Cl	ZINC000819191876	FG	On-Demand	Anodyne	BOTA	18	41
O=C(/C=C/c1ccncn1)NCCc1ccc(Br)cc1Cl	ZINC000819191877	FG	On-Demand	Anodyne	BOTA	18	41
O=C(CN1C(=O)c2ccccc2S1(=O)=O)NCc1ncn(-c2ccccc2)n1	ZINC000819191899	GC	On-Demand	Anodyne	CELA2A	17	43
N#CCOc1cccc(CC(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819191905	EE	On-Demand	Mild	PDS	42	35
O=C(NCc1ncn(-c2ccccc2)n1)c1cccnc1Cl	ZINC000819191907	DE	On-Demand	Anodyne	G2YM83_BOTF4	73	38
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(OC(F)(F)Cl)cc1	ZINC000819191908	GG	On-Demand	Anodyne	GCGR	41	39
Cn1cc(/C=C/C(=O)NCCc2ccc(Br)cc2Cl)c(=O)n(C)c1=O	ZINC000819191912	ID	On-Demand	Anodyne	BOTA	26	45
Cn1cc(/C=C\C(=O)NCCc2ccc(Br)cc2Cl)c(=O)n(C)c1=O	ZINC000819191913	ID	On-Demand	Anodyne	BOTA	26	45
Cc1noc(C2CC2)c1C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819191918	GI	On-Demand	Anodyne	P2RX7	24	42
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819191919	HF	On-Demand	Anodyne	F2	82	46
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819191919	HF	On-Demand	Anodyne	PRSS1	22	42
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819191919	HF	On-Demand	Anodyne	ACE	32	47
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819191919	HF	On-Demand	Anodyne	FKBP1A	52	44
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819191919	HF	On-Demand	Anodyne	OPRM1	24	40
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819191919	HF	On-Demand	Anodyne	P2RY12	15	41
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819191919	HF	On-Demand	Anodyne	CELA1	27	53
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819191919	HF	On-Demand	Anodyne	GRIN2B	18	40
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819191919	HF	On-Demand	Anodyne	ELANE	38	42
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819191919	HF	On-Demand	Anodyne	CTRA_BOVIN	64	35
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819191919	HF	On-Demand	Anodyne	TRY1_BOVIN	97	45
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819191919	HF	On-Demand	Anodyne	CTSG	44	35
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819191919	HF	On-Demand	Anodyne	PREP	81	53
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819191919	HF	On-Demand	Anodyne	CELA2A	53	35
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819191919	HF	On-Demand	Anodyne	LGMN	91	51
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819191919	HF	On-Demand	Anodyne	KLK5	28	48
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819191919	HF	On-Demand	Anodyne	XIAP	41	45
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819191919	HF	On-Demand	Anodyne	BRCA1	43	30
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819191919	HF	On-Demand	Anodyne	TMPRSS11D	79	45
Cn1nc(C(=O)NCCc2ccc(Br)cc2Cl)c2ccccc2c1=O	ZINC000819191925	HG	On-Demand	Anodyne	CNR1	24	43
Cn1nc(C(=O)NCCc2ccc(Br)cc2Cl)c2ccccc2c1=O	ZINC000819191925	HG	On-Demand	Anodyne	P2RX7	43	39
Cn1nc(C(=O)NCCc2ccc(Br)cc2Cl)c2ccccc2c1=O	ZINC000819191925	HG	On-Demand	Anodyne	IMDH_CRYPV	28	46
NS(=O)(=O)c1cc(C(=O)NCCc2ccc(Br)cc2Cl)ccc1F	ZINC000819191928	IF	On-Demand	Anodyne	CA2	30	52
NS(=O)(=O)c1cc(C(=O)NCCc2ccc(Br)cc2Cl)ccc1F	ZINC000819191928	IF	On-Demand	Anodyne	CA1	23	52
NS(=O)(=O)c1cc(C(=O)NCCc2ccc(Br)cc2Cl)ccc1F	ZINC000819191928	IF	On-Demand	Anodyne	MC5R	18	40
NS(=O)(=O)c1cc(C(=O)NCCc2ccc(Br)cc2Cl)ccc1F	ZINC000819191928	IF	On-Demand	Anodyne	CA4	21	52
C#Cc1cncc(C(=O)NCCc2ccc(Br)cc2Cl)c1	ZINC000819191936	FG	On-Demand	Mild	SCN10A	37	40
C#CCNC(=O)CCNC1CN(S(=O)(=O)c2ccc(OC)cc2)C1	ZINC000819191962	FB	On-Demand	Mild	BMP1	34	40
C#CCNC(=O)CCNC1CN(S(=O)(=O)c2ccc(OC)cc2)C1	ZINC000819191962	FB	On-Demand	Mild	MMP13	68	45
C#CCNC(=O)CCNC1CN(S(=O)(=O)c2ccc(OC)cc2)C1	ZINC000819191962	FB	On-Demand	Mild	MMP2	40	43
C#CCNC(=O)CCNC1CN(S(=O)(=O)c2ccc(OC)cc2)C1	ZINC000819191962	FB	On-Demand	Mild	MMP3	71	45
C#CCNC(=O)CCNC1CN(S(=O)(=O)c2ccc(OC)cc2)C1	ZINC000819191962	FB	On-Demand	Mild	MMP8	37	40
C#CCNC(=O)CCNC1CN(S(=O)(=O)c2ccc(OC)cc2)C1	ZINC000819191962	FB	On-Demand	Mild	MMP9	50	43
C#CCNC(=O)CCNC1CN(S(=O)(=O)c2ccc(OC)cc2)C1	ZINC000819191962	FB	On-Demand	Mild	TGM2	21	40
C#CCNC(=O)CCNC1CN(S(=O)(=O)c2ccc(OC)cc2)C1	ZINC000819191962	FB	On-Demand	Mild	MMP7	53	40
C#CCNC(=O)CCNC1CN(S(=O)(=O)c2ccc(OC)cc2)C1	ZINC000819191962	FB	On-Demand	Mild	MMP1	68	45
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819191999	DG	On-Demand	Bother	ADRB2	79	43
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819191999	DG	On-Demand	Bother	ADRB1	89	57
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819191999	DG	On-Demand	Bother	ADRB3	127	58
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819191999	DG	On-Demand	Bother	CACNA1D	58	36
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819192001	DG	On-Demand	Bother	ADRB2	79	43
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819192001	DG	On-Demand	Bother	ADRB1	89	57
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819192001	DG	On-Demand	Bother	ADRB3	127	58
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819192001	DG	On-Demand	Bother	CACNA1D	58	36
CN1N=C(C(=O)NCCc2ccc(Br)cc2Cl)CCC1=O	ZINC000819192009	FE	On-Demand	Anodyne	CNR1	17	40
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819192012	DG	On-Demand	Bother	ADRB2	72	45
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819192012	DG	On-Demand	Bother	ADRB1	73	47
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819192012	DG	On-Demand	Bother	CACNA1C	32	41
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819192012	DG	On-Demand	Bother	ADRB3	93	47
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819192012	DG	On-Demand	Bother	CACNA1D	55	41
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819192014	DF	On-Demand	Bother	ADRB2	44	38
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819192014	DF	On-Demand	Bother	ADRB1	42	42
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819192014	DF	On-Demand	Bother	ADRB3	44	42
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819192014	DF	On-Demand	Bother	CACNA1D	41	38
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819192016	DF	On-Demand	Bother	ADRB2	44	38
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819192016	DF	On-Demand	Bother	ADRB1	42	42
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819192016	DF	On-Demand	Bother	ADRB3	44	42
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819192016	DF	On-Demand	Bother	CACNA1D	41	38
C[C@@H](CO)CCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819192017	DF	On-Demand	Anodyne	ADRB3	31	44
C[C@H](CO)CCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819192019	DF	On-Demand	Anodyne	ADRB3	31	44
O=C(NCc1ncn(-c2ccccc2)n1)c1cc(=O)c2ccc(F)cc2o1	ZINC000819192020	FE	On-Demand	Anodyne	P2RX7	17	41
C[C@@H](CO)CCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819192022	DF	On-Demand	Anodyne	ADRB3	31	44
C[C@H](CO)CCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819192023	DF	On-Demand	Anodyne	ADRB3	31	44
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819192026	ID	On-Demand	Anodyne	F2	51	41
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819192026	ID	On-Demand	Anodyne	FKBP1A	29	41
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819192026	ID	On-Demand	Anodyne	TRY1_BOVIN	55	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819192026	ID	On-Demand	Anodyne	PREP	45	35
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819192026	ID	On-Demand	Anodyne	XIAP	26	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819192026	ID	On-Demand	Anodyne	TMPRSS11D	62	39
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819192029	ID	On-Demand	Anodyne	F2	51	41
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819192029	ID	On-Demand	Anodyne	FKBP1A	29	41
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819192029	ID	On-Demand	Anodyne	TRY1_BOVIN	55	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819192029	ID	On-Demand	Anodyne	PREP	45	35
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819192029	ID	On-Demand	Anodyne	XIAP	26	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819192029	ID	On-Demand	Anodyne	TMPRSS11D	62	39
COc1ccc(OC)c([C@H](O)CNCCC2Cc3ccccc3C2)c1	ZINC000819192030	EG	On-Demand	Anodyne	ADRB2	15	44
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)C(F)(F)F	ZINC000819192042	FD	On-Demand	Anodyne	F2	62	43
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)C(F)(F)F	ZINC000819192042	FD	On-Demand	Anodyne	ELANE	48	39
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)C(F)(F)F	ZINC000819192042	FD	On-Demand	Anodyne	TRY1_BOVIN	67	40
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)C(F)(F)F	ZINC000819192042	FD	On-Demand	Anodyne	PREP	53	42
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)C(F)(F)F	ZINC000819192042	FD	On-Demand	Anodyne	XIAP	28	40
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCCN1C(=O)C(F)(F)F	ZINC000819192042	FD	On-Demand	Anodyne	TMPRSS11D	67	36
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)C(F)(F)F	ZINC000819192046	FD	On-Demand	Anodyne	F2	62	43
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)C(F)(F)F	ZINC000819192046	FD	On-Demand	Anodyne	ELANE	48	39
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)C(F)(F)F	ZINC000819192046	FD	On-Demand	Anodyne	TRY1_BOVIN	67	40
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)C(F)(F)F	ZINC000819192046	FD	On-Demand	Anodyne	PREP	53	42
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)C(F)(F)F	ZINC000819192046	FD	On-Demand	Anodyne	XIAP	28	40
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCCN1C(=O)C(F)(F)F	ZINC000819192046	FD	On-Demand	Anodyne	TMPRSS11D	67	36
Cc1ccccc1[C@@H](O)CNCCc1cccc([N+](=O)[O-])c1	ZINC000819192069	DF	On-Demand	Bother	ADRB2	72	41
Cc1ccccc1[C@@H](O)CNCCc1cccc([N+](=O)[O-])c1	ZINC000819192069	DF	On-Demand	Bother	ADRB1	62	43
Cc1ccccc1[C@@H](O)CNCCc1cccc([N+](=O)[O-])c1	ZINC000819192069	DF	On-Demand	Bother	CACNA1C	57	39
Cc1ccccc1[C@@H](O)CNCCc1cccc([N+](=O)[O-])c1	ZINC000819192069	DF	On-Demand	Bother	ADRB3	55	43
Cc1ccccc1[C@@H](O)CNCCc1cccc([N+](=O)[O-])c1	ZINC000819192069	DF	On-Demand	Bother	CACNA1D	88	39
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCC2Cc3ccccc3C2)CC1	ZINC000819192117	GG	On-Demand	Anodyne	CCR8	28	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCC2Cc3ccccc3C2)CC1	ZINC000819192117	GG	On-Demand	Anodyne	GPR119	49	48
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCC2Cc3ccccc3C2)CC1	ZINC000819192119	GG	On-Demand	Anodyne	CCR8	28	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCC2Cc3ccccc3C2)CC1	ZINC000819192119	GG	On-Demand	Anodyne	GPR119	49	48
O=C(Cc1cc(F)c(Cl)cc1[N+](=O)[O-])NCc1ncn(-c2ccccc2)n1	ZINC000819192136	GF	On-Demand	Bother	P2RX7	38	48
O=C(NCc1ncn(-c2ccccc2)n1)c1nc(Cl)ccc1F	ZINC000819192143	EE	On-Demand	Anodyne	P2RX7	27	42
O=C(NCc1ncn(-c2ccccc2)n1)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819192145	GD	On-Demand	Anodyne	SLC18A3	15	40
O=C(NCc1ncn(-c2ccccc2)n1)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819192145	GD	On-Demand	Anodyne	EPHX2	23	44
O=C(NCc1ncn(-c2ccccc2)n1)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819192145	GD	On-Demand	Anodyne	NAMPT	29	45
CCCN(CCNC[C@H](O)c1cccc(F)c1)C(=O)OC(C)(C)C	ZINC000819192167	EG	On-Demand	Anodyne	ADRB1	29	42
CCCN(CCNC[C@H](O)c1cccc(F)c1)C(=O)OC(C)(C)C	ZINC000819192167	EG	On-Demand	Anodyne	ADRB3	35	42
CCCN(CCNC[C@@H](O)c1cccc(F)c1)C(=O)OC(C)(C)C	ZINC000819192168	EG	On-Demand	Anodyne	ADRB1	29	42
CCCN(CCNC[C@@H](O)c1cccc(F)c1)C(=O)OC(C)(C)C	ZINC000819192168	EG	On-Demand	Anodyne	ADRB3	35	42
O=C(NCCc1ccc(Br)cc1Cl)c1ccnc(F)c1	ZINC000819192189	FH	On-Demand	Anodyne	KDM4E	23	41
NC(=S)c1ccc(C(=O)NCCc2ccc(Br)cc2Cl)cc1	ZINC000819192200	GH	On-Demand	Anodyne	MC5R	19	41
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CC(=O)N(C2CCCC2)C1	ZINC000819192201	FD	On-Demand	Anodyne	INHA	24	49
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CC(=O)N(C2CCCC2)C1	ZINC000819192202	FD	On-Demand	Anodyne	INHA	24	49
O=C(NCCc1ccc(Br)cc1Cl)[C@@H](O)c1cccnc1	ZINC000819192209	FF	On-Demand	Anodyne	KCNA5	21	43
O=C(NCCc1ccc(Br)cc1Cl)[C@H](O)c1cccnc1	ZINC000819192210	FF	On-Demand	Anodyne	KCNA5	21	43
COc1ccc(OC)c([C@H](O)CNCCc2ccncc2C)c1	ZINC000819192217	DE	On-Demand	Anodyne	ADRB2	22	49
COc1ccc(OC)c([C@H](O)CNCCc2ccncc2C)c1	ZINC000819192217	DE	On-Demand	Anodyne	ADRB1	27	42
COc1ccc(OC)c([C@H](O)CNCCc2ccncc2C)c1	ZINC000819192217	DE	On-Demand	Anodyne	ADRB3	29	42
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H](F)Cc1ccccc1	ZINC000819192228	DE	On-Demand	Anodyne	MME	48	36
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H](F)Cc1ccccc1	ZINC000819192228	DE	On-Demand	Anodyne	AMP1_PLAFQ	40	40
O=C(NCc1ncn(-c2ccccc2)n1)[C@H](F)Cc1ccccc1	ZINC000819192229	DE	On-Demand	Anodyne	MME	48	36
O=C(NCc1ncn(-c2ccccc2)n1)[C@H](F)Cc1ccccc1	ZINC000819192229	DE	On-Demand	Anodyne	AMP1_PLAFQ	40	40
O=C(Cc1ccccc1CO)NCCc1ccc(Br)cc1Cl	ZINC000819192233	GG	On-Demand	Anodyne	CA9	18	43
O=C(Cc1n[nH]c2c1CCCC2)NCCc1ccc(Br)cc1Cl	ZINC000819192234	GH	On-Demand	Anodyne	ACHE	22	40
O=C(NCCc1ccc(Br)cc1Cl)c1ccnc(Cl)c1F	ZINC000819192236	GI	On-Demand	Anodyne	P2RX7	19	42
COC[C@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192237	IG	On-Demand	Anodyne	PAPA1_CARPA	42	49
COC[C@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192237	IG	On-Demand	Anodyne	FPR1	40	35
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192238	IG	On-Demand	Anodyne	PAPA1_CARPA	42	49
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192238	IG	On-Demand	Anodyne	FPR1	40	35
O=C(NCCc1ccc(Br)cc1Cl)c1ccc(F)nc1	ZINC000819192239	FH	On-Demand	Anodyne	P2RX7	20	42
O=C(NCCc1ccc(Br)cc1Cl)c1ccc(F)nc1	ZINC000819192239	FH	On-Demand	Anodyne	MC5R	17	40
O=C1CC[C@@H](C(=O)NCCc2ccc(Br)cc2Cl)CCN1	ZINC000819192244	FF	On-Demand	Anodyne	P2RX7	24	41
O=C1CC[C@H](C(=O)NCCc2ccc(Br)cc2Cl)CCN1	ZINC000819192245	FF	On-Demand	Anodyne	P2RX7	24	41
O=C(NCCc1ccc(Br)cc1Cl)c1cccc(N2CCOC2=O)c1	ZINC000819192246	HI	On-Demand	Anodyne	DRD4	43	33
O=C(NCCc1ccc(Br)cc1Cl)c1cccnc1F	ZINC000819192354	FH	On-Demand	Anodyne	P2RX7	22	42
O=C(/C=C\c1ccc(O)c(O)c1)NCc1ncn(-c2ccccc2)n1	ZINC000819192363	EE	On-Demand	Clean	HDAC1	23	41
O=C(/C=C\c1ccc(O)c(O)c1)NCc1ncn(-c2ccccc2)n1	ZINC000819192363	EE	On-Demand	Clean	HDAC6	23	41
O=C(/C=C/c1ccc(O)c(O)c1)NCc1ncn(-c2ccccc2)n1	ZINC000819192365	EE	On-Demand	Clean	HDAC1	23	41
O=C(/C=C/c1ccc(O)c(O)c1)NCc1ncn(-c2ccccc2)n1	ZINC000819192365	EE	On-Demand	Clean	HDAC6	23	41
O=C(CCCCCn1c(S)nc2ccccc2c1=O)NCc1ncn(-c2ccccc2)n1	ZINC000819192368	IG	On-Demand	Anodyne	HTR7	27	45
Cn1nc(Br)cc1C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192376	HH	On-Demand	Anodyne	CNR1	19	44
CN1Cc2ccccc2[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819192381	FH	On-Demand	Anodyne	RBP4	43	36
CN1Cc2ccccc2[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819192385	FH	On-Demand	Anodyne	RBP4	43	36
CN1Cc2ccccc2[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819192389	FH	On-Demand	Anodyne	RBP4	43	36
CN1Cc2ccccc2[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819192392	FH	On-Demand	Anodyne	RBP4	43	36
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819192395	FG	On-Demand	Bother	ADRB2	59	40
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819192395	FG	On-Demand	Bother	ADRB1	53	40
O=[N+]([O-])c1cccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819192395	FG	On-Demand	Bother	ADRB3	71	43
O=C(Cc1ccc(Cl)cc1Br)NCc1ncn(-c2ccccc2)n1	ZINC000819192396	HH	On-Demand	Anodyne	P2RX7	55	48
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(-c2ccc(Cl)cc2)cc1F	ZINC000819192398	HJ	On-Demand	Anodyne	P2RX7	15	40
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(-c2ccc(Cl)cc2)cc1F	ZINC000819192398	HJ	On-Demand	Anodyne	SCN10A	39	43
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(-c2ccc(Cl)cc2)cc1F	ZINC000819192398	HJ	On-Demand	Anodyne	LUCI_LUCLA	31	40
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(-c2ccc(Cl)cc2)cc1F	ZINC000819192398	HJ	On-Demand	Anodyne	PTGES2	42	29
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819192399	FG	On-Demand	Bother	ADRB2	59	40
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819192399	FG	On-Demand	Bother	ADRB1	53	40
O=[N+]([O-])c1cccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819192399	FG	On-Demand	Bother	ADRB3	71	43
O=C(/C=C\c1cnccn1)NCCc1ccc(Br)cc1Cl	ZINC000819192400	FG	On-Demand	Anodyne	BOTA	21	40
O=C(/C=C/c1cnccn1)NCCc1ccc(Br)cc1Cl	ZINC000819192402	FG	On-Demand	Anodyne	BOTA	21	40
O=C(NCCc1ccc(Br)cc1Cl)c1ncccn1	ZINC000819192407	EF	On-Demand	Anodyne	P2RX7	15	41
O=C(COc1ccc(-c2ccccc2)cc1)NCc1ncn(-c2ccccc2)n1	ZINC000819192409	GH	On-Demand	Anodyne	ADORA2B	16	40
O=CNc1ccc(C(=O)NCCc2ccc(Br)cc2Cl)cc1	ZINC000819192417	GH	On-Demand	Anodyne	MC5R	19	41
O[C@H](CNCCOc1cccc(C(F)(F)F)n1)c1ccc(F)cc1	ZINC000819192434	EF	On-Demand	Anodyne	ADRB1	24	40
O[C@H](CNCCOc1cccc(C(F)(F)F)n1)c1ccc(F)cc1	ZINC000819192434	EF	On-Demand	Anodyne	ADRB3	29	40
O[C@@H](CNCCOc1cccc(C(F)(F)F)n1)c1ccc(F)cc1	ZINC000819192437	EF	On-Demand	Anodyne	ADRB1	24	40
O[C@@H](CNCCOc1cccc(C(F)(F)F)n1)c1ccc(F)cc1	ZINC000819192437	EF	On-Demand	Anodyne	ADRB3	29	40
C[Si](C)(C)c1ccc(CC(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819192439	FF	On-Demand	Anodyne	P2RX7	25	44
O=C(NCCc1ccc(Br)cc1Cl)c1cc(=O)c2ccccc2o1	ZINC000819192443	HI	On-Demand	Anodyne	BCHE	35	43
O=C(NCCc1ccc(Br)cc1Cl)c1cc(=O)c2ccccc2o1	ZINC000819192443	HI	On-Demand	Anodyne	ABCG2	28	45
O=C(NCCc1ccc(Br)cc1Cl)c1cc(=O)c2ccccc2o1	ZINC000819192443	HI	On-Demand	Anodyne	TNKS	27	43
O=C(NCCc1ccc(Br)cc1Cl)c1cc(=O)c2ccccc2o1	ZINC000819192443	HI	On-Demand	Anodyne	GPR35	51	35
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc([N+](=O)[O-])c1	ZINC000819192481	DF	On-Demand	Bother	ADRB2	55	40
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc([N+](=O)[O-])c1	ZINC000819192481	DF	On-Demand	Bother	ADRB1	45	40
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc([N+](=O)[O-])c1	ZINC000819192481	DF	On-Demand	Bother	CACNA1C	48	40
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc([N+](=O)[O-])c1	ZINC000819192481	DF	On-Demand	Bother	CACNA1D	75	40
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc2c(c1)-c1ccccc1C2	ZINC000819192490	FH	On-Demand	Anodyne	TBXA2R	20	45
COC(=O)N[C@@H](C(=O)NCCc1ccc(Br)cc1Cl)C(C)C	ZINC000819192501	GG	On-Demand	Anodyne	CASP9	21	40
COC(=O)N[C@H](C(=O)NCCc1ccc(Br)cc1Cl)C(C)C	ZINC000819192502	GG	On-Demand	Anodyne	CASP9	21	40
C[C@H](CO)CCCNC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819192516	DG	On-Demand	Anodyne	ADRB2	20	40
C[C@H](CO)CCCNC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819192516	DG	On-Demand	Anodyne	ADRB1	29	40
C[C@H](CO)CCCNC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819192516	DG	On-Demand	Anodyne	ADRB3	20	40
O=C(NCCc1ccc(Br)cc1Cl)c1cc2nn[nH]c2cc1F	ZINC000819192518	GG	On-Demand	Anodyne	ALPL	40	33
C[C@H](CO)CCCNC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819192519	DG	On-Demand	Anodyne	ADRB2	20	40
C[C@H](CO)CCCNC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819192519	DG	On-Demand	Anodyne	ADRB1	29	40
C[C@H](CO)CCCNC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819192519	DG	On-Demand	Anodyne	ADRB3	20	40
C[C@@H](CO)CCCNC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819192522	DG	On-Demand	Anodyne	ADRB2	20	40
C[C@@H](CO)CCCNC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819192522	DG	On-Demand	Anodyne	ADRB1	29	40
C[C@@H](CO)CCCNC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819192522	DG	On-Demand	Anodyne	ADRB3	20	40
O=C(/C=C/c1cncc(O)c1)NCCc1ccc(Br)cc1Cl	ZINC000819192525	GH	On-Demand	Anodyne	BOTA	18	40
O=C(/C=C\c1cncc(O)c1)NCCc1ccc(Br)cc1Cl	ZINC000819192526	GH	On-Demand	Anodyne	BOTA	18	40
C[C@@H](CO)CCCNC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819192527	DG	On-Demand	Anodyne	ADRB2	20	40
C[C@@H](CO)CCCNC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819192527	DG	On-Demand	Anodyne	ADRB1	29	40
C[C@@H](CO)CCCNC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819192527	DG	On-Demand	Anodyne	ADRB3	20	40
COc1ccc(OC)c([C@H](O)CNCCOc2cccc(C(F)(F)F)n2)c1	ZINC000819192531	GF	On-Demand	Anodyne	ADRB2	18	42
COc1ccccc1/C(C)=C/C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819192561	EF	On-Demand	Anodyne	KCNA3	41	39
COc1ccccc1/C(C)=C\C(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819192562	EF	On-Demand	Anodyne	KCNA3	41	39
C=CCc1cc(C(=O)NCc2ncn(-c3ccccc3)n2)cc(OC)c1OC	ZINC000819192564	GF	On-Demand	Mild	CYP24A1	21	40
C=CCc1cc(C(=O)NCc2ncn(-c3ccccc3)n2)cc(OC)c1OC	ZINC000819192564	GF	On-Demand	Mild	CYP27B1	16	40
Cn1cc(/C=C\C(=O)NCCc2ccc(Br)cc2Cl)cn1	ZINC000819192574	FG	On-Demand	Anodyne	BOTA	23	42
Cn1cc(/C=C/C(=O)NCCc2ccc(Br)cc2Cl)cn1	ZINC000819192575	FG	On-Demand	Anodyne	BOTA	23	42
CC(C)(C)OC(=O)NCC(=O)NCC(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192576	IE	On-Demand	Anodyne	NQO2	17	41
O=C(Cc1ccc(F)cn1)NCc1ncn(-c2ccccc2)n1	ZINC000819192580	DD	On-Demand	Anodyne	P2RX7	38	48
CC(C)(C)OC(=O)N1CCC(C(=O)NCCc2ccc(Br)cc2Cl)CC1	ZINC000819192595	II	On-Demand	Anodyne	EPHX2	29	50
CC(C)(C)OC(=O)N1CCC(C(=O)NCCc2ccc(Br)cc2Cl)CC1	ZINC000819192595	II	On-Demand	Anodyne	GPR119	41	40
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192601	HH	On-Demand	Anodyne	ANPEP	30	45
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192601	HH	On-Demand	Anodyne	CTSB	31	41
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192601	HH	On-Demand	Anodyne	PAPA1_CARPA	44	38
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192601	HH	On-Demand	Anodyne	CTSK	39	42
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192601	HH	On-Demand	Anodyne	CTSL	31	40
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192601	HH	On-Demand	Anodyne	CAPNS1	53	37
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192601	HH	On-Demand	Anodyne	CTSS	24	41
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192601	HH	On-Demand	Anodyne	CAPN1	69	42
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192601	HH	On-Demand	Anodyne	CAPN2	109	41
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192601	HH	On-Demand	Anodyne	FPR1	48	35
COC(=O)N[C@@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192601	HH	On-Demand	Anodyne	NPR	66	38
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192602	HH	On-Demand	Anodyne	ANPEP	30	45
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192602	HH	On-Demand	Anodyne	CTSB	31	41
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192602	HH	On-Demand	Anodyne	PAPA1_CARPA	44	38
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192602	HH	On-Demand	Anodyne	CTSK	39	42
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192602	HH	On-Demand	Anodyne	CTSL	31	40
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192602	HH	On-Demand	Anodyne	CAPNS1	53	37
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192602	HH	On-Demand	Anodyne	CTSS	24	41
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192602	HH	On-Demand	Anodyne	CAPN1	69	42
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192602	HH	On-Demand	Anodyne	CAPN2	109	41
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192602	HH	On-Demand	Anodyne	FPR1	48	35
COC(=O)N[C@H](CC(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192602	HH	On-Demand	Anodyne	NPR	66	38
CCOC(=O)Nc1ccc(C(=O)NCc2ncn(-c3ccccc3)n2)cc1	ZINC000819192605	FF	On-Demand	Anodyne	PRNP	56	35
C[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)NCc2ncn(-c3ccccc3)n2)C1	ZINC000819192626	GF	On-Demand	Anodyne	VHL	48	32
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)NCc2ncn(-c3ccccc3)n2)C1	ZINC000819192627	GF	On-Demand	Anodyne	VHL	48	32
C[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)NCc2ncn(-c3ccccc3)n2)C1	ZINC000819192628	GF	On-Demand	Anodyne	VHL	48	32
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)NCc2ncn(-c3ccccc3)n2)C1	ZINC000819192629	GF	On-Demand	Anodyne	VHL	48	32
CC(C)(C)OC(=O)NCCC(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192633	HH	On-Demand	Anodyne	NQO2	15	44
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(N2CCOCC2)nc1	ZINC000819192639	FD	On-Demand	Anodyne	HDAC1	18	42
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(N2CCOCC2)nc1	ZINC000819192639	FD	On-Demand	Anodyne	SCD1	16	41
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(N2CCOCC2)nc1	ZINC000819192639	FD	On-Demand	Anodyne	SCD	17	41
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(N2CCOCC2)nc1	ZINC000819192639	FD	On-Demand	Anodyne	DGAT1	38	43
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(N2CCOCC2)nc1	ZINC000819192639	FD	On-Demand	Anodyne	HPGDS	36	46
O=C(CCCCN1CCCC1)NCc1ncn(-c2ccccc2)n1	ZINC000819192658	EE	On-Demand	Anodyne	HTR1A	40	44
O=C(CCCCN1CCCC1)NCc1ncn(-c2ccccc2)n1	ZINC000819192658	EE	On-Demand	Anodyne	DRD2	28	44
O=C(CCCCN1CCCC1)NCc1ncn(-c2ccccc2)n1	ZINC000819192658	EE	On-Demand	Anodyne	DRD3	31	42
O=C(CCCCN1CCCC1)NCc1ncn(-c2ccccc2)n1	ZINC000819192658	EE	On-Demand	Anodyne	HTR7	76	47
O=C(CCCCN1CCCC1)NCc1ncn(-c2ccccc2)n1	ZINC000819192658	EE	On-Demand	Anodyne	HRH3	29	42
O=C(CCCCN1CCCC1)NCc1ncn(-c2ccccc2)n1	ZINC000819192658	EE	On-Demand	Anodyne	CHRNA7	17	47
O=C(CCCCN1CCCC1)NCc1ncn(-c2ccccc2)n1	ZINC000819192658	EE	On-Demand	Anodyne	HNMT	89	36
Cc1cccc(C(=O)Nc2ccccc2C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819192668	HH	On-Demand	Anodyne	KCNK3	90	43
Cc1cccc(C(=O)Nc2ccccc2C(=O)NCc2ncn(-c3ccccc3)n2)c1	ZINC000819192668	HH	On-Demand	Anodyne	KCNK9	50	43
Cc1c(Br)cccc1CC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819192676	GG	On-Demand	Anodyne	P2RX7	28	53
O=C(NCCc1ccc(Br)cc1Cl)c1cc(Cl)ncc1Cl	ZINC000819192678	HJ	On-Demand	Anodyne	P2RX7	15	47
O=C(/C=C/c1ccc[nH]1)NCCc1ccc(Br)cc1Cl	ZINC000819192688	FH	On-Demand	Anodyne	BOTA	15	42
O=C(/C=C\c1ccc[nH]1)NCCc1ccc(Br)cc1Cl	ZINC000819192689	FH	On-Demand	Anodyne	BOTA	15	42
C#CCN1CCC(C(=O)NCCc2ccc(Br)cc2Cl)CC1	ZINC000819192695	GG	On-Demand	Mild	EPHX2	17	44
CCOC(=O)N[C@H](C(=O)NCCc1ccc(Br)cc1Cl)C(C)C	ZINC000819192696	HH	On-Demand	Anodyne	HLA-DRB1	53	39
CCOC(=O)N[C@H](C(=O)NCCc1ccc(Br)cc1Cl)C(C)C	ZINC000819192696	HH	On-Demand	Anodyne	CASP9	28	43
CCOC(=O)N[C@@H](C(=O)NCCc1ccc(Br)cc1Cl)C(C)C	ZINC000819192697	HH	On-Demand	Anodyne	HLA-DRB1	53	39
CCOC(=O)N[C@@H](C(=O)NCCc1ccc(Br)cc1Cl)C(C)C	ZINC000819192697	HH	On-Demand	Anodyne	CASP9	28	43
CCOC(=O)N1CCC(C(=O)NCCc2ccc(Br)cc2Cl)CC1	ZINC000819192703	HH	On-Demand	Anodyne	MTNR1A	16	40
CCOC(=O)N1CCC(C(=O)NCCc2ccc(Br)cc2Cl)CC1	ZINC000819192703	HH	On-Demand	Anodyne	EPHX2	28	51
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819192704	IE	On-Demand	Anodyne	EPHX2	17	42
O=C(NCc1ncn(-c2ccccc2)n1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819192704	IE	On-Demand	Anodyne	NAMPT	33	42
CS(=O)(=O)Nc1ccc(O)c(C(=O)NCCc2ccc(Br)cc2Cl)c1	ZINC000819192705	IG	On-Demand	Clean	PYK	44	33
O=C(CCN1CCOCC1)NCCc1ccc(Br)cc1Cl	ZINC000819192707	GE	On-Demand	Anodyne	EPHX2	21	40
O=C(CNC(=O)OCc1ccccc1)NCCc1ccc(Br)cc1Cl	ZINC000819192708	IH	On-Demand	Anodyne	CTSB	21	40
O=C(CNC(=O)OCc1ccccc1)NCCc1ccc(Br)cc1Cl	ZINC000819192708	IH	On-Demand	Anodyne	CAPN2	67	36
O=C(CNC(=O)OCc1ccccc1)NCCc1ccc(Br)cc1Cl	ZINC000819192708	IH	On-Demand	Anodyne	NPR	62	39
COC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819192712	BD	On-Demand	Anodyne	PDS	44	34
CC(C)(C)OC(=O)N1CCC[C@H](CC(=O)NCc2ncn(-c3ccccc3)n2)CC1	ZINC000819192723	HG	On-Demand	Anodyne	GPR119	47	44
CC(C)(C)OC(=O)N1CCC[C@H](CC(=O)NCc2ncn(-c3ccccc3)n2)CC1	ZINC000819192723	HG	On-Demand	Anodyne	SFRP1	15	41
CC(C)(C)OC(=O)N1CCC[C@@H](CC(=O)NCc2ncn(-c3ccccc3)n2)CC1	ZINC000819192724	HG	On-Demand	Anodyne	GPR119	47	44
CC(C)(C)OC(=O)N1CCC[C@@H](CC(=O)NCc2ncn(-c3ccccc3)n2)CC1	ZINC000819192724	HG	On-Demand	Anodyne	SFRP1	15	41
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](C(=O)NCc2ncn(-c3ccccc3)n2)C1	ZINC000819192727	HF	On-Demand	Anodyne	GPR119	24	40
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](C(=O)NCc2ncn(-c3ccccc3)n2)C1	ZINC000819192728	HF	On-Demand	Anodyne	GPR119	24	40
C/C(=C\C(=O)NCc1ncn(-c2ccccc2)n1)c1cccc(C(F)(F)F)c1	ZINC000819192729	GI	On-Demand	Anodyne	CCR2	63	36
C/C(=C\C(=O)NCc1ncn(-c2ccccc2)n1)c1cccc(C(F)(F)F)c1	ZINC000819192729	GI	On-Demand	Anodyne	CARM1	51	36
C/C(=C\C(=O)NCc1ncn(-c2ccccc2)n1)c1cccc(C(F)(F)F)c1	ZINC000819192729	GI	On-Demand	Anodyne	PDS	46	35
C/C(=C/C(=O)NCc1ncn(-c2ccccc2)n1)c1cccc(C(F)(F)F)c1	ZINC000819192730	GI	On-Demand	Anodyne	CCR2	63	36
C/C(=C/C(=O)NCc1ncn(-c2ccccc2)n1)c1cccc(C(F)(F)F)c1	ZINC000819192730	GI	On-Demand	Anodyne	CARM1	51	36
C/C(=C/C(=O)NCc1ncn(-c2ccccc2)n1)c1cccc(C(F)(F)F)c1	ZINC000819192730	GI	On-Demand	Anodyne	PDS	46	35
O=C(NCCc1ccc(Br)cc1Cl)c1ccc(-c2nnc(S)o2)cc1	ZINC000819192737	II	On-Demand	Anodyne	CYP73A16	45	36
CC(C)(C)OC(=O)NCCCCC(=O)NCc1ncn(-c2ccccc2)n1	ZINC000819192739	FF	On-Demand	Anodyne	TACR3	15	41
N#Cc1cccc(OCC(=O)NCCc2ccc(Br)cc2Cl)c1	ZINC000819192746	GH	On-Demand	Mild	PDS	15	40
C[C@H](NC(=O)OC(C)(C)C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192751	HH	On-Demand	Anodyne	PAPA1_CARPA	36	42
C=CC(=O)NCc1ccc(C(=O)NCCc2ccc(Br)cc2Cl)cc1	ZINC000819192754	HH	On-Demand	Anodyne	TGM2	22	41
C=CC(=O)NCc1ccc(C(=O)NCCc2ccc(Br)cc2Cl)cc1	ZINC000819192754	HH	On-Demand	Anodyne	RPA1	26	42
O=C(Cc1ccc(Cl)cn1)NCCc1ccc(Br)cc1Cl	ZINC000819192773	GI	On-Demand	Anodyne	P2RX7	15	46
CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)C(F)(F)F	ZINC000819192793	GE	On-Demand	Anodyne	PAPA1_CARPA	35	41
CC(C)(C)OC(=O)N[C@@H](C(=O)NCc1ncn(-c2ccccc2)n1)C(F)(F)F	ZINC000819192793	GE	On-Demand	Anodyne	FPR1	45	34
NS(=O)(=O)c1ccc(F)c(C(=O)NCCc2ccc(Br)cc2Cl)c1	ZINC000819192797	IF	On-Demand	Anodyne	CA2	58	46
NS(=O)(=O)c1ccc(F)c(C(=O)NCCc2ccc(Br)cc2Cl)c1	ZINC000819192797	IF	On-Demand	Anodyne	CA1	50	46
NS(=O)(=O)c1ccc(F)c(C(=O)NCCc2ccc(Br)cc2Cl)c1	ZINC000819192797	IF	On-Demand	Anodyne	CA5B	47	38
NS(=O)(=O)c1ccc(F)c(C(=O)NCCc2ccc(Br)cc2Cl)c1	ZINC000819192797	IF	On-Demand	Anodyne	CA4	50	44
NS(=O)(=O)c1ccc(F)c(C(=O)NCCc2ccc(Br)cc2Cl)c1	ZINC000819192797	IF	On-Demand	Anodyne	CA5A	49	38
NS(=O)(=O)c1ccc(F)c(C(=O)NCCc2ccc(Br)cc2Cl)c1	ZINC000819192797	IF	On-Demand	Anodyne	CA12	33	46
NS(=O)(=O)c1ccc(F)c(C(=O)NCCc2ccc(Br)cc2Cl)c1	ZINC000819192797	IF	On-Demand	Anodyne	CA9	38	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)NCc1ncn(-c2ccccc2)n1)C1CC1	ZINC000819192804	GF	On-Demand	Anodyne	REN	47	35
CC(C)(C)OC(=O)N[C@@H](CC(=O)NCc1ncn(-c2ccccc2)n1)C1CC1	ZINC000819192804	GF	On-Demand	Anodyne	FPR1	42	34
CC(C)(C)OC(=O)N[C@H](CC(=O)NCc1ncn(-c2ccccc2)n1)C1CC1	ZINC000819192805	GF	On-Demand	Anodyne	REN	47	35
CC(C)(C)OC(=O)N[C@H](CC(=O)NCc1ncn(-c2ccccc2)n1)C1CC1	ZINC000819192805	GF	On-Demand	Anodyne	FPR1	42	34
CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192806	II	On-Demand	Anodyne	MTNR1B	23	46
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000819192814	HF	On-Demand	Anodyne	GRIN2B	29	48
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000819192814	HF	On-Demand	Anodyne	TGM2	35	41
O=C(NCc1ncn(-c2ccccc2)n1)[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000819192814	HF	On-Demand	Anodyne	F13A1	30	41
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000819192815	HF	On-Demand	Anodyne	GRIN2B	29	48
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000819192815	HF	On-Demand	Anodyne	TGM2	35	41
O=C(NCc1ncn(-c2ccccc2)n1)[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000819192815	HF	On-Demand	Anodyne	F13A1	30	41
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)NCc2ncn(-c3ccccc3)n2)C(F)(F)C1	ZINC000819192827	HF	On-Demand	Anodyne	GPR119	44	40
CC(C)(C)OC(=O)N1CC[C@H](C(=O)NCc2ncn(-c3ccccc3)n2)C(F)(F)C1	ZINC000819192828	HF	On-Demand	Anodyne	GPR119	44	40
O=C(CCCn1cncn1)NCCc1ccc(Br)cc1Cl	ZINC000819192837	FF	On-Demand	Anodyne	CNR1	23	44
O=C(NCCc1ccc(Br)cc1Cl)c1cccnc1Cl	ZINC000819192840	FI	On-Demand	Anodyne	G2YM83_BOTF4	72	36
COc1cccc([C@H](O)C(=O)NCCc2ccc(Br)cc2Cl)c1	ZINC000819192841	GH	On-Demand	Anodyne	DRD4	43	34
COc1cccc([C@H](O)C(=O)NCCc2ccc(Br)cc2Cl)c1	ZINC000819192841	GH	On-Demand	Anodyne	NQO2	38	45
COc1cccc([C@H](O)C(=O)NCCc2ccc(Br)cc2Cl)c1	ZINC000819192841	GH	On-Demand	Anodyne	MTNR1A	92	45
COc1cccc([C@H](O)C(=O)NCCc2ccc(Br)cc2Cl)c1	ZINC000819192841	GH	On-Demand	Anodyne	MTNR1B	74	42
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192852	IG	On-Demand	Anodyne	VHL	55	32
O=C(NCc1ncn(-c2ccccc2)n1)c1cc([N+](=O)[O-])ccc1N1CCCCC1	ZINC000819192853	HG	On-Demand	Bother	WDR5	32	40
O=C(NCc1ncn(-c2ccccc2)n1)[C@H](O)c1ccccc1Cl	ZINC000819192856	EE	On-Demand	Anodyne	P2RX7	16	41
Cn1ncc(C(=O)NCCc2ccc(Br)cc2Cl)c1Br	ZINC000819192868	HH	On-Demand	Anodyne	P2RX7	31	44
COC(=O)N[C@@H](C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192871	FF	On-Demand	Anodyne	NQO2	28	40
Cc1csc([C@@](O)(CC(=O)NCc2ncn(-c3ccccc3)n2)C(F)(F)F)n1	ZINC000819192873	HE	On-Demand	Anodyne	KCNJ11	54	33
Cc1csc([C@](O)(CC(=O)NCc2ncn(-c3ccccc3)n2)C(F)(F)F)n1	ZINC000819192874	HE	On-Demand	Anodyne	KCNJ11	54	33
C#CCN1CCC[C@H]1C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192875	FF	On-Demand	Mild	P2RX7	30	46
CC(C)(C)OC(=O)NCC(=O)NCCc1ccc(Br)cc1Cl	ZINC000819192879	GG	On-Demand	Anodyne	NQO2	20	42
O=C(NCCc1ccc(Br)cc1Cl)c1ccnc(F)c1F	ZINC000819192881	GH	On-Demand	Anodyne	P2RX7	17	40
CCOC(=O)CC[C@@H](C)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819192886	ED	On-Demand	Anodyne	ADRB2	25	42
CCOC(=O)CC[C@@H](C)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819192887	ED	On-Demand	Anodyne	ADRB2	25	42
CCOC(=O)CC[C@H](C)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819192888	ED	On-Demand	Anodyne	ADRB2	25	42
CCOC(=O)CC[C@H](C)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819192889	ED	On-Demand	Anodyne	ADRB2	25	42
O[C@@H](CNCCc1nc2c(s1)CCCC2)c1cccc(Br)c1	ZINC000819192898	GH	On-Demand	Anodyne	ADRB3	70	37
O[C@H](CNCCc1nc2c(s1)CCCC2)c1cccc(Br)c1	ZINC000819192899	GH	On-Demand	Anodyne	ADRB3	70	37
COC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819192909	DD	On-Demand	Anodyne	ADRB2	48	53
COC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819192909	DD	On-Demand	Anodyne	ADRB1	63	46
COC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819192909	DD	On-Demand	Anodyne	ADRB3	35	43
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819192910	DD	On-Demand	Anodyne	ADRB2	48	53
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819192910	DD	On-Demand	Anodyne	ADRB1	63	46
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819192910	DD	On-Demand	Anodyne	ADRB3	35	43
COC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819192911	DD	On-Demand	Anodyne	ADRB2	48	53
COC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819192911	DD	On-Demand	Anodyne	ADRB1	63	46
COC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819192911	DD	On-Demand	Anodyne	ADRB3	35	43
COC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819192912	DD	On-Demand	Anodyne	ADRB2	48	53
COC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819192912	DD	On-Demand	Anodyne	ADRB1	63	46
COC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819192912	DD	On-Demand	Anodyne	ADRB3	35	43
COc1ccccc1[C@@H](NC[C@H](O)COCC1CC1)c1ccccn1	ZINC000819192914	EF	On-Demand	Anodyne	ADRB2	15	40
COc1ccccc1[C@@H](NC[C@H](O)COCC1CC1)c1ccccn1	ZINC000819192914	EF	On-Demand	Anodyne	ADRB1	18	41
COc1ccccc1[C@@H](NC[C@@H](O)COCC1CC1)c1ccccn1	ZINC000819192915	EF	On-Demand	Anodyne	ADRB2	15	40
COc1ccccc1[C@@H](NC[C@@H](O)COCC1CC1)c1ccccn1	ZINC000819192915	EF	On-Demand	Anodyne	ADRB1	18	41
CCOC(=O)CC[C@@H](C)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819192917	CD	On-Demand	Mild	ADRB2	17	42
CCOC(=O)CC[C@@H](C)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819192917	CD	On-Demand	Mild	CTRB_BOVIN	49	36
CCOC(=O)CC[C@@H](C)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819192918	CD	On-Demand	Mild	ADRB2	17	42
CCOC(=O)CC[C@@H](C)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819192918	CD	On-Demand	Mild	CTRB_BOVIN	49	36
CCOC(=O)CC[C@H](C)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819192919	CD	On-Demand	Mild	ADRB2	17	42
CCOC(=O)CC[C@H](C)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819192919	CD	On-Demand	Mild	CTRB_BOVIN	49	36
CCOC(=O)CC[C@H](C)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819192920	CD	On-Demand	Mild	ADRB2	17	42
CCOC(=O)CC[C@H](C)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819192920	CD	On-Demand	Mild	CTRB_BOVIN	49	36
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1nc(-c2ccccc2)no1	ZINC000819192925	FG	On-Demand	Bother	ADRB3	43	37
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)c1nc(-c2ccccc2)no1	ZINC000819192926	FG	On-Demand	Bother	ADRB3	43	37
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)c1nc(-c2ccccc2)no1	ZINC000819192927	FG	On-Demand	Bother	ADRB3	43	37
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1nc(-c2ccccc2)no1	ZINC000819192928	FG	On-Demand	Bother	ADRB3	43	37
C[C@H](CNC[C@@H](O)c1ccc(F)cc1)c1nc(-c2ccccc2)no1	ZINC000819192955	EG	On-Demand	Anodyne	ADRB3	27	46
C[C@H](CNC[C@H](O)c1ccc(F)cc1)c1nc(-c2ccccc2)no1	ZINC000819192956	EG	On-Demand	Anodyne	ADRB3	27	46
C[C@@H](CNC[C@H](O)c1ccc(F)cc1)c1nc(-c2ccccc2)no1	ZINC000819192957	EG	On-Demand	Anodyne	ADRB3	27	46
C[C@@H](CNC[C@@H](O)c1ccc(F)cc1)c1nc(-c2ccccc2)no1	ZINC000819192958	EG	On-Demand	Anodyne	ADRB3	27	46
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1Br)c1ccc[nH]1	ZINC000819192964	FH	On-Demand	Anodyne	ADRB2	22	42
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1Br)c1ccc[nH]1	ZINC000819192964	FH	On-Demand	Anodyne	ADRB1	25	41
C[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1Br)c1ccc[nH]1	ZINC000819192966	FH	On-Demand	Anodyne	ADRB2	22	42
C[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1Br)c1ccc[nH]1	ZINC000819192966	FH	On-Demand	Anodyne	ADRB1	25	41
C[C@H](NC[C@H](O)COc1ccc(Br)cc1)c1ccc[nH]1	ZINC000819192967	EF	On-Demand	Anodyne	ADRB2	38	49
C[C@H](NC[C@H](O)COc1ccc(Br)cc1)c1ccc[nH]1	ZINC000819192967	EF	On-Demand	Anodyne	ADRB1	43	46
C[C@H](NC[C@H](O)COc1ccc(Br)cc1)c1ccc[nH]1	ZINC000819192967	EF	On-Demand	Anodyne	ADRB3	16	43
C[C@@H](NC[C@@H](O)COc1ccc(Br)cc1)c1ccc[nH]1	ZINC000819192968	EF	On-Demand	Anodyne	ADRB2	38	49
C[C@@H](NC[C@@H](O)COc1ccc(Br)cc1)c1ccc[nH]1	ZINC000819192968	EF	On-Demand	Anodyne	ADRB1	43	46
C[C@@H](NC[C@@H](O)COc1ccc(Br)cc1)c1ccc[nH]1	ZINC000819192968	EF	On-Demand	Anodyne	ADRB3	16	43
C/C=C/c1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)c(OC)c1	ZINC000819192977	EG	On-Demand	Anodyne	ADRB2	21	70
C/C=C\c1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)c(OC)c1	ZINC000819192978	EG	On-Demand	Anodyne	ADRB2	21	70
C/C=C\c1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)c(OC)c1	ZINC000819192979	EG	On-Demand	Anodyne	ADRB2	21	70
C/C=C/c1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)c(OC)c1	ZINC000819192980	EG	On-Demand	Anodyne	ADRB2	21	70
O[C@@H](CNCCc1nc2c(s1)CCCC2)c1ccc(F)cc1	ZINC000819192985	DG	On-Demand	Anodyne	ADRB2	19	41
O[C@H](CNCCc1nc2c(s1)CCCC2)c1ccc(F)cc1	ZINC000819192986	DG	On-Demand	Anodyne	ADRB2	19	41
O[C@@H](CNCCc1nc2c(s1)CCCC2)c1cccnc1	ZINC000819192987	DE	On-Demand	Anodyne	ADRB2	34	48
O[C@@H](CNCCc1nc2c(s1)CCCC2)c1cccnc1	ZINC000819192987	DE	On-Demand	Anodyne	ADRB1	39	44
O[C@@H](CNCCc1nc2c(s1)CCCC2)c1cccnc1	ZINC000819192987	DE	On-Demand	Anodyne	ADRB3	130	48
O[C@H](CNCCc1nc2c(s1)CCCC2)c1cccnc1	ZINC000819192988	DE	On-Demand	Anodyne	ADRB2	34	48
O[C@H](CNCCc1nc2c(s1)CCCC2)c1cccnc1	ZINC000819192988	DE	On-Demand	Anodyne	ADRB1	39	44
O[C@H](CNCCc1nc2c(s1)CCCC2)c1cccnc1	ZINC000819192988	DE	On-Demand	Anodyne	ADRB3	130	48
O[C@@H](CNCCc1nc2c(s1)CCCC2)c1ccccc1	ZINC000819192997	DF	On-Demand	Anodyne	ADRB2	35	48
O[C@@H](CNCCc1nc2c(s1)CCCC2)c1ccccc1	ZINC000819192997	DF	On-Demand	Anodyne	ADRB1	41	39
O[C@@H](CNCCc1nc2c(s1)CCCC2)c1ccccc1	ZINC000819192997	DF	On-Demand	Anodyne	ADRB3	87	42
O[C@H](CNCCc1nc2c(s1)CCCC2)c1ccccc1	ZINC000819192998	DF	On-Demand	Anodyne	ADRB2	35	48
O[C@H](CNCCc1nc2c(s1)CCCC2)c1ccccc1	ZINC000819192998	DF	On-Demand	Anodyne	ADRB1	41	39
O[C@H](CNCCc1nc2c(s1)CCCC2)c1ccccc1	ZINC000819192998	DF	On-Demand	Anodyne	ADRB3	87	42
Cc1cc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)c(C(C)C)cc1Cl	ZINC000819193009	FI	On-Demand	Anodyne	ADRB2	25	43
Cc1cc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)c(C(C)C)cc1Cl	ZINC000819193009	FI	On-Demand	Anodyne	ADRB1	19	40
Cc1cc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)c(C(C)C)cc1Cl	ZINC000819193010	FI	On-Demand	Anodyne	ADRB2	25	43
Cc1cc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)c(C(C)C)cc1Cl	ZINC000819193010	FI	On-Demand	Anodyne	ADRB1	19	40
Cc1cc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)c(C(C)C)cc1Cl	ZINC000819193011	FI	On-Demand	Anodyne	ADRB2	25	43
Cc1cc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)c(C(C)C)cc1Cl	ZINC000819193011	FI	On-Demand	Anodyne	ADRB1	19	40
Cc1cc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)c(C(C)C)cc1Cl	ZINC000819193012	FI	On-Demand	Anodyne	ADRB2	25	43
Cc1cc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)c(C(C)C)cc1Cl	ZINC000819193012	FI	On-Demand	Anodyne	ADRB1	19	40
C[C@H](NC[C@H](O)CO[C@H]1CCCc2ccccc21)c1ccc[nH]1	ZINC000819193024	DG	On-Demand	Anodyne	ADRB2	16	42
C[C@H](NC[C@H](O)CO[C@@H]1CCCc2ccccc21)c1ccc[nH]1	ZINC000819193025	DG	On-Demand	Anodyne	ADRB2	16	42
C[C@H](NC[C@H](O)c1cccc(Cl)c1)c1ccc[nH]1	ZINC000819193027	CG	On-Demand	Anodyne	ADRB2	21	52
C[C@H](NC[C@H](O)c1cccc(Cl)c1)c1ccc[nH]1	ZINC000819193027	CG	On-Demand	Anodyne	ADRB1	36	52
C[C@H](NC[C@H](O)c1cccc(Cl)c1)c1ccc[nH]1	ZINC000819193027	CG	On-Demand	Anodyne	ADRB3	54	52
C[C@H](NC[C@H](O)c1cccc(Cl)c1)c1ccc[nH]1	ZINC000819193027	CG	On-Demand	Anodyne	CYP3A4	46	35
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1ccc[nH]1	ZINC000819193029	CG	On-Demand	Anodyne	ADRB2	21	52
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1ccc[nH]1	ZINC000819193029	CG	On-Demand	Anodyne	ADRB1	36	52
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1ccc[nH]1	ZINC000819193029	CG	On-Demand	Anodyne	ADRB3	54	52
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1ccc[nH]1	ZINC000819193029	CG	On-Demand	Anodyne	CYP3A4	46	35
C[C@@H](NCCS(=O)(=O)c1ccc(C(C)(C)C)cc1)c1ccc[nH]1	ZINC000819193032	EG	On-Demand	Anodyne	CYNT	41	46
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2nc3c(s2)CCCC3)cc1	ZINC000819193042	GE	On-Demand	Anodyne	ADRB3	85	40
CS(=O)(=O)c1ccc([C@H](O)CNCCc2nc3c(s2)CCCC3)cc1	ZINC000819193043	GE	On-Demand	Anodyne	ADRB3	85	40
CC(=O)c1cccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)c1	ZINC000819193044	DE	On-Demand	Anodyne	ADRB2	31	52
CC(=O)c1cccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)c1	ZINC000819193044	DE	On-Demand	Anodyne	ADRB1	38	47
CC(=O)c1cccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)c1	ZINC000819193044	DE	On-Demand	Anodyne	ABCB1	18	45
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)c1	ZINC000819193045	DE	On-Demand	Anodyne	ADRB2	31	52
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)c1	ZINC000819193045	DE	On-Demand	Anodyne	ADRB1	38	47
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)c1	ZINC000819193045	DE	On-Demand	Anodyne	ABCB1	18	45
CC(=O)c1cccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)c1	ZINC000819193046	DE	On-Demand	Anodyne	ADRB2	31	52
CC(=O)c1cccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)c1	ZINC000819193046	DE	On-Demand	Anodyne	ADRB1	38	47
CC(=O)c1cccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)c1	ZINC000819193046	DE	On-Demand	Anodyne	ABCB1	18	45
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)c1	ZINC000819193047	DE	On-Demand	Anodyne	ADRB2	31	52
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)c1	ZINC000819193047	DE	On-Demand	Anodyne	ADRB1	38	47
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)c1	ZINC000819193047	DE	On-Demand	Anodyne	ABCB1	18	45
C[C@H](CNC[C@H](O)c1ccccc1)c1nc(-c2ccccc2)no1	ZINC000819193058	DG	On-Demand	Anodyne	ADRB3	52	40
C[C@H](CNC[C@@H](O)c1ccccc1)c1nc(-c2ccccc2)no1	ZINC000819193059	DG	On-Demand	Anodyne	ADRB3	52	40
C[C@@H](CNC[C@@H](O)c1ccccc1)c1nc(-c2ccccc2)no1	ZINC000819193060	DG	On-Demand	Anodyne	ADRB3	52	40
C[C@@H](CNC[C@H](O)c1ccccc1)c1nc(-c2ccccc2)no1	ZINC000819193061	DG	On-Demand	Anodyne	ADRB3	52	40
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193082	GE	On-Demand	Anodyne	ADRB1	61	37
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193082	GE	On-Demand	Anodyne	ADRB3	45	40
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193082	GE	On-Demand	Anodyne	ABCB1	38	47
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193083	GE	On-Demand	Anodyne	ADRB1	61	37
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193083	GE	On-Demand	Anodyne	ADRB3	45	40
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193083	GE	On-Demand	Anodyne	ABCB1	38	47
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193084	GE	On-Demand	Anodyne	ADRB1	61	37
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193084	GE	On-Demand	Anodyne	ADRB3	45	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193084	GE	On-Demand	Anodyne	ABCB1	38	47
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193085	GE	On-Demand	Anodyne	ADRB1	61	37
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193085	GE	On-Demand	Anodyne	ADRB3	45	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193085	GE	On-Demand	Anodyne	ABCB1	38	47
O=C1[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])CCCN1Cc1ccccc1	ZINC000819193095	GE	On-Demand	Bother	ADRB3	15	42
O=C1[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])CCCN1Cc1ccccc1	ZINC000819193095	GE	On-Demand	Bother	ABCB1	30	42
O=C1[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])CCCN1Cc1ccccc1	ZINC000819193096	GE	On-Demand	Bother	ADRB3	15	42
O=C1[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])CCCN1Cc1ccccc1	ZINC000819193096	GE	On-Demand	Bother	ABCB1	30	42
O=C1[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])CCCN1Cc1ccccc1	ZINC000819193097	GE	On-Demand	Bother	ADRB3	15	42
O=C1[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])CCCN1Cc1ccccc1	ZINC000819193097	GE	On-Demand	Bother	ABCB1	30	42
O=C1[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])CCCN1Cc1ccccc1	ZINC000819193098	GE	On-Demand	Bother	ADRB3	15	42
O=C1[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])CCCN1Cc1ccccc1	ZINC000819193098	GE	On-Demand	Bother	ABCB1	30	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819193099	GG	On-Demand	Anodyne	SSTR2	47	36
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819193100	GG	On-Demand	Anodyne	SSTR2	47	36
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCCN1c1ccccc1F	ZINC000819193101	EE	On-Demand	Anodyne	ADRB3	68	43
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCCN1c1ccccc1F	ZINC000819193102	EE	On-Demand	Anodyne	ADRB3	68	43
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCCN1c1ccccc1F	ZINC000819193103	EE	On-Demand	Anodyne	ADRB3	68	43
O=C1[C@H](NC[C@H](O)c2cccnc2)CCCN1c1ccccc1F	ZINC000819193104	EE	On-Demand	Anodyne	ADRB3	68	43
CC(C)(C)OC(=O)NC[C@@H](NC[C@H](C#N)CCC#N)c1ccc2ccccc2c1	ZINC000819193106	GI	On-Demand	Mild	PAPA1_CARPA	36	48
CC(C)(C)OC(=O)NC[C@H](NC[C@@H](C#N)CCC#N)c1ccc2ccccc2c1	ZINC000819193107	GI	On-Demand	Mild	PAPA1_CARPA	36	48
CC(C)(C)OC(=O)NC[C@H](NC[C@H](C#N)CCC#N)c1ccc2ccccc2c1	ZINC000819193108	GI	On-Demand	Mild	PAPA1_CARPA	36	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2CCC(F)(F)CC2)CC1	ZINC000819193119	FG	On-Demand	Anodyne	GPR119	30	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2CCC(F)(F)CC2)CC1	ZINC000819193120	FG	On-Demand	Anodyne	GPR119	30	47
O=C1[C@H](NC[C@H](O)C2CC2)CCCN1Cc1ccccc1	ZINC000819193141	CD	On-Demand	Anodyne	ACE	40	42
O=C1[C@H](NC[C@H](O)C2CC2)CCCN1Cc1ccccc1	ZINC000819193141	CD	On-Demand	Anodyne	MME	23	42
O=C1[C@H](NC[C@H](O)C2CC2)CCCN1Cc1ccccc1	ZINC000819193141	CD	On-Demand	Anodyne	SIGMAR1	20	43
O=C1[C@@H](NC[C@H](O)C2CC2)CCCN1Cc1ccccc1	ZINC000819193142	CD	On-Demand	Anodyne	ACE	40	42
O=C1[C@@H](NC[C@H](O)C2CC2)CCCN1Cc1ccccc1	ZINC000819193142	CD	On-Demand	Anodyne	MME	23	42
O=C1[C@@H](NC[C@H](O)C2CC2)CCCN1Cc1ccccc1	ZINC000819193142	CD	On-Demand	Anodyne	SIGMAR1	20	43
O=C1[C@H](NC[C@@H](O)C2CC2)CCCN1Cc1ccccc1	ZINC000819193143	CD	On-Demand	Anodyne	ACE	40	42
O=C1[C@H](NC[C@@H](O)C2CC2)CCCN1Cc1ccccc1	ZINC000819193143	CD	On-Demand	Anodyne	MME	23	42
O=C1[C@H](NC[C@@H](O)C2CC2)CCCN1Cc1ccccc1	ZINC000819193143	CD	On-Demand	Anodyne	SIGMAR1	20	43
O=C1[C@@H](NC[C@@H](O)C2CC2)CCCN1Cc1ccccc1	ZINC000819193144	CD	On-Demand	Anodyne	ACE	40	42
O=C1[C@@H](NC[C@@H](O)C2CC2)CCCN1Cc1ccccc1	ZINC000819193144	CD	On-Demand	Anodyne	MME	23	42
O=C1[C@@H](NC[C@@H](O)C2CC2)CCCN1Cc1ccccc1	ZINC000819193144	CD	On-Demand	Anodyne	SIGMAR1	20	43
O=C(CCN[C@@H]1CCCN(Cc2ccccc2)C1=O)Nc1cccnc1	ZINC000819193145	FE	On-Demand	Anodyne	CHRNA7	41	39
O=C(CCN[C@H]1CCCN(Cc2ccccc2)C1=O)Nc1cccnc1	ZINC000819193146	FE	On-Demand	Anodyne	CHRNA7	41	39
O=C(CCN[C@H]1CCCN(Cc2ccccc2)C1=O)Nc1cccc(Cl)c1	ZINC000819193147	GG	On-Demand	Anodyne	DRD4	15	42
O=C(CCN[C@H]1CCCN(Cc2ccccc2)C1=O)Nc1cccc(Cl)c1	ZINC000819193147	GG	On-Demand	Anodyne	F10	15	40
O=C(CCN[C@H]1CCCN(Cc2ccccc2)C1=O)Nc1cccc(Cl)c1	ZINC000819193147	GG	On-Demand	Anodyne	MCHR1	22	41
O=C(CCN[C@@H]1CCCN(Cc2ccccc2)C1=O)Nc1cccc(Cl)c1	ZINC000819193148	GG	On-Demand	Anodyne	DRD4	15	42
O=C(CCN[C@@H]1CCCN(Cc2ccccc2)C1=O)Nc1cccc(Cl)c1	ZINC000819193148	GG	On-Demand	Anodyne	F10	15	40
O=C(CCN[C@@H]1CCCN(Cc2ccccc2)C1=O)Nc1cccc(Cl)c1	ZINC000819193148	GG	On-Demand	Anodyne	MCHR1	22	41
O=C1[C@@H](NC[C@@H](O)CC(F)(F)F)CCCN1Cc1ccccc1	ZINC000819193158	EE	On-Demand	Anodyne	ACE	29	40
O=C1[C@@H](NC[C@@H](O)CC(F)(F)F)CCCN1Cc1ccccc1	ZINC000819193158	EE	On-Demand	Anodyne	MME	15	40
O=C1[C@@H](NC[C@H](O)CC(F)(F)F)CCCN1Cc1ccccc1	ZINC000819193159	EE	On-Demand	Anodyne	ACE	29	40
O=C1[C@@H](NC[C@H](O)CC(F)(F)F)CCCN1Cc1ccccc1	ZINC000819193159	EE	On-Demand	Anodyne	MME	15	40
O=C1[C@H](NC[C@@H](O)CC(F)(F)F)CCCN1Cc1ccccc1	ZINC000819193160	EE	On-Demand	Anodyne	ACE	29	40
O=C1[C@H](NC[C@@H](O)CC(F)(F)F)CCCN1Cc1ccccc1	ZINC000819193160	EE	On-Demand	Anodyne	MME	15	40
O=C1[C@H](NC[C@H](O)CC(F)(F)F)CCCN1Cc1ccccc1	ZINC000819193161	EE	On-Demand	Anodyne	ACE	29	40
O=C1[C@H](NC[C@H](O)CC(F)(F)F)CCCN1Cc1ccccc1	ZINC000819193161	EE	On-Demand	Anodyne	MME	15	40
COc1ccccc1COC[C@@H](O)CN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193162	GE	On-Demand	Anodyne	MBTPS1	40	32
COc1ccccc1COC[C@H](O)CN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193163	GE	On-Demand	Anodyne	MBTPS1	40	32
COc1ccccc1COC[C@H](O)CN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193164	GE	On-Demand	Anodyne	MBTPS1	40	32
COc1ccccc1COC[C@@H](O)CN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193165	GE	On-Demand	Anodyne	MBTPS1	40	32
O=C(CCN[C@H]1CCCN(Cc2ccccc2)C1=O)Nc1cc(F)cc(F)c1	ZINC000819193171	GG	On-Demand	Anodyne	SIGMAR1	22	44
O=C(CCN[C@@H]1CCCN(Cc2ccccc2)C1=O)Nc1cc(F)cc(F)c1	ZINC000819193172	GG	On-Demand	Anodyne	SIGMAR1	22	44
CC[C@H](O)CN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193181	CD	On-Demand	Anodyne	ACE	44	41
CC[C@H](O)CN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193181	CD	On-Demand	Anodyne	MME	24	41
C[C@H](NC[C@H](O)COc1ccccc1F)c1ccc[nH]1	ZINC000819193184	CE	On-Demand	Anodyne	ADRB2	35	52
C[C@H](NC[C@H](O)COc1ccccc1F)c1ccc[nH]1	ZINC000819193184	CE	On-Demand	Anodyne	ADRB1	45	47
C[C@@H](NC[C@@H](O)COc1ccccc1F)c1ccc[nH]1	ZINC000819193185	CE	On-Demand	Anodyne	ADRB2	35	52
C[C@@H](NC[C@@H](O)COc1ccccc1F)c1ccc[nH]1	ZINC000819193185	CE	On-Demand	Anodyne	ADRB1	45	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H](c2cccnc2)C2CC2)CC1	ZINC000819193190	GG	On-Demand	Anodyne	PTAFR	15	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H](c2cccnc2)C2CC2)CC1	ZINC000819193190	GG	On-Demand	Anodyne	GPR119	56	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H](c2cccnc2)C2CC2)CC1	ZINC000819193191	GG	On-Demand	Anodyne	PTAFR	15	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H](c2cccnc2)C2CC2)CC1	ZINC000819193191	GG	On-Demand	Anodyne	GPR119	56	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H](c2cccnc2)C2CC2)CC1	ZINC000819193192	GG	On-Demand	Anodyne	PTAFR	15	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H](c2cccnc2)C2CC2)CC1	ZINC000819193192	GG	On-Demand	Anodyne	GPR119	56	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H](c2cccnc2)C2CC2)CC1	ZINC000819193193	GG	On-Demand	Anodyne	PTAFR	15	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H](c2cccnc2)C2CC2)CC1	ZINC000819193193	GG	On-Demand	Anodyne	GPR119	56	44
CCOC(=O)CC[C@@H](C)NC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819193194	EG	On-Demand	Anodyne	ADRB2	17	42
CCOC(=O)CC[C@H](C)NC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819193195	EG	On-Demand	Anodyne	ADRB2	17	42
CCOC(=O)CC[C@@H](C)NC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819193196	EG	On-Demand	Anodyne	ADRB2	17	42
CCOC(=O)CC[C@H](C)NC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819193197	EG	On-Demand	Anodyne	ADRB2	17	42
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)c1ccc[nH]1	ZINC000819193213	CD	On-Demand	Mild	ADRB2	32	47
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)c1ccc[nH]1	ZINC000819193213	CD	On-Demand	Mild	ADRB1	44	40
C[C@@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1ccc[nH]1	ZINC000819193215	CD	On-Demand	Mild	ADRB2	32	47
C[C@@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1ccc[nH]1	ZINC000819193215	CD	On-Demand	Mild	ADRB1	44	40
C[C@@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc[nH]1	ZINC000819193231	DF	On-Demand	Bother	COLA	80	36
O[C@@H](CNCCc1nc2c(s1)CCCC2)c1cccc(C(F)(F)F)c1	ZINC000819193265	FH	On-Demand	Anodyne	ADRB2	21	41
O[C@@H](CNCCc1nc2c(s1)CCCC2)c1cccc(C(F)(F)F)c1	ZINC000819193265	FH	On-Demand	Anodyne	ADRB3	52	41
O[C@H](CNCCc1nc2c(s1)CCCC2)c1cccc(C(F)(F)F)c1	ZINC000819193266	FH	On-Demand	Anodyne	ADRB2	21	41
O[C@H](CNCCc1nc2c(s1)CCCC2)c1cccc(C(F)(F)F)c1	ZINC000819193266	FH	On-Demand	Anodyne	ADRB3	52	41
CC[C@H](O)CN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193283	CD	On-Demand	Anodyne	ACE	44	41
CC[C@H](O)CN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193283	CD	On-Demand	Anodyne	MME	24	41
O=C1[C@@H](NC[C@H](O)CC2CCCC2)CCCN1Cc1ccccc1	ZINC000819193284	EF	On-Demand	Anodyne	ACE	30	42
O=C1[C@@H](NC[C@H](O)CC2CCCC2)CCCN1Cc1ccccc1	ZINC000819193284	EF	On-Demand	Anodyne	MME	15	42
O=C1[C@@H](NC[C@@H](O)CC2CCCC2)CCCN1Cc1ccccc1	ZINC000819193285	EF	On-Demand	Anodyne	ACE	30	42
O=C1[C@@H](NC[C@@H](O)CC2CCCC2)CCCN1Cc1ccccc1	ZINC000819193285	EF	On-Demand	Anodyne	MME	15	42
O=C1[C@H](NC[C@@H](O)CC2CCCC2)CCCN1Cc1ccccc1	ZINC000819193286	EF	On-Demand	Anodyne	ACE	30	42
O=C1[C@H](NC[C@@H](O)CC2CCCC2)CCCN1Cc1ccccc1	ZINC000819193286	EF	On-Demand	Anodyne	MME	15	42
O=C1[C@H](NC[C@H](O)CC2CCCC2)CCCN1Cc1ccccc1	ZINC000819193287	EF	On-Demand	Anodyne	ACE	30	42
O=C1[C@H](NC[C@H](O)CC2CCCC2)CCCN1Cc1ccccc1	ZINC000819193287	EF	On-Demand	Anodyne	MME	15	42
O=C(CCN[C@H]1CCCN(Cc2ccccc2)C1=O)Nc1ccc(Cl)cc1	ZINC000819193294	GG	On-Demand	Anodyne	SIGMAR1	15	43
O=C(CCN[C@H]1CCCN(Cc2ccccc2)C1=O)Nc1ccc(Cl)cc1	ZINC000819193294	GG	On-Demand	Anodyne	CACNA1G	17	43
O=C(CCN[C@@H]1CCCN(Cc2ccccc2)C1=O)Nc1ccc(Cl)cc1	ZINC000819193295	GG	On-Demand	Anodyne	SIGMAR1	15	43
O=C(CCN[C@@H]1CCCN(Cc2ccccc2)C1=O)Nc1ccc(Cl)cc1	ZINC000819193295	GG	On-Demand	Anodyne	CACNA1G	17	43
O=C1[C@H](NC[C@H](O)c2ccccc2F)CCCN1Cc1ccccc1	ZINC000819193296	EF	On-Demand	Anodyne	SIGMAR1	22	40
O=C1[C@@H](NC[C@H](O)c2ccccc2F)CCCN1Cc1ccccc1	ZINC000819193297	EF	On-Demand	Anodyne	SIGMAR1	22	40
O=C1[C@@H](NC[C@@H](O)c2ccccc2F)CCCN1Cc1ccccc1	ZINC000819193298	EF	On-Demand	Anodyne	SIGMAR1	22	40
O=C1[C@H](NC[C@@H](O)c2ccccc2F)CCCN1Cc1ccccc1	ZINC000819193299	EF	On-Demand	Anodyne	SIGMAR1	22	40
O[C@H](CNC1CCC(F)(F)CC1)c1cccnc1	ZINC000819193304	CE	On-Demand	Anodyne	ADRB1	21	40
O[C@H](CNC1CCC(F)(F)CC1)c1cccnc1	ZINC000819193304	CE	On-Demand	Anodyne	ADRB3	74	49
O[C@H](CNC1CCC(F)(F)CC1)c1cccnc1	ZINC000819193304	CE	On-Demand	Anodyne	C3AR1	27	43
O[C@@H](CNC1CCC(F)(F)CC1)c1cccnc1	ZINC000819193305	CE	On-Demand	Anodyne	ADRB1	21	40
O[C@@H](CNC1CCC(F)(F)CC1)c1cccnc1	ZINC000819193305	CE	On-Demand	Anodyne	ADRB3	74	49
O[C@@H](CNC1CCC(F)(F)CC1)c1cccnc1	ZINC000819193305	CE	On-Demand	Anodyne	C3AR1	27	43
O=C1[C@@H](NCC2(O)CCC2)CCCN1Cc1ccccc1	ZINC000819193306	CD	On-Demand	Anodyne	ACE	37	42
O=C1[C@@H](NCC2(O)CCC2)CCCN1Cc1ccccc1	ZINC000819193306	CD	On-Demand	Anodyne	MME	22	42
O=C1[C@H](NCC2(O)CCC2)CCCN1Cc1ccccc1	ZINC000819193307	CD	On-Demand	Anodyne	ACE	37	42
O=C1[C@H](NCC2(O)CCC2)CCCN1Cc1ccccc1	ZINC000819193307	CD	On-Demand	Anodyne	MME	22	42
CCOC[C@H](O)CN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193322	DD	On-Demand	Anodyne	ACE	32	40
CCOC[C@H](O)CN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193324	DD	On-Demand	Anodyne	ACE	32	40
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1F	ZINC000819193337	FG	On-Demand	Anodyne	F10	17	43
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1F	ZINC000819193337	FG	On-Demand	Anodyne	ADRB3	46	41
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1F	ZINC000819193337	FG	On-Demand	Anodyne	CYP3A4	46	34
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1F	ZINC000819193338	FG	On-Demand	Anodyne	F10	17	43
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1F	ZINC000819193338	FG	On-Demand	Anodyne	ADRB3	46	41
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1F	ZINC000819193338	FG	On-Demand	Anodyne	CYP3A4	46	34
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1F	ZINC000819193339	FG	On-Demand	Anodyne	F10	17	43
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1F	ZINC000819193339	FG	On-Demand	Anodyne	ADRB3	46	41
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1F	ZINC000819193339	FG	On-Demand	Anodyne	CYP3A4	46	34
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1F	ZINC000819193340	FG	On-Demand	Anodyne	F10	17	43
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1F	ZINC000819193340	FG	On-Demand	Anodyne	ADRB3	46	41
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1c1ccccc1F	ZINC000819193340	FG	On-Demand	Anodyne	CYP3A4	46	34
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819193352	FG	On-Demand	Anodyne	ADRB1	46	43
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819193352	FG	On-Demand	Anodyne	ADRB3	59	45
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819193352	FG	On-Demand	Anodyne	CYP3A4	48	36
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819193353	FG	On-Demand	Anodyne	ADRB1	46	43
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819193353	FG	On-Demand	Anodyne	ADRB3	59	45
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819193353	FG	On-Demand	Anodyne	CYP3A4	48	36
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819193354	FG	On-Demand	Anodyne	ADRB1	46	43
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819193354	FG	On-Demand	Anodyne	ADRB3	59	45
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819193354	FG	On-Demand	Anodyne	CYP3A4	48	36
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819193355	FG	On-Demand	Anodyne	ADRB1	46	43
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819193355	FG	On-Demand	Anodyne	ADRB3	59	45
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819193355	FG	On-Demand	Anodyne	CYP3A4	48	36
O=C(NC1CCN(C(=O)c2ccncc2)CC1)C(F)=C1CCC1	ZINC000819193358	DE	On-Demand	Anodyne	EPHX2	27	52
O=C(NC1CCN(C(=O)c2ccncc2)CC1)C(F)=C1CCC1	ZINC000819193358	DE	On-Demand	Anodyne	SFRP1	16	40
O=C(NC1CCN(C(=O)c2ccncc2)CC1)C(F)=C1CCC1	ZINC000819193358	DE	On-Demand	Anodyne	L3MBTL3	82	39
O=C1[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)CCCN1Cc1ccccc1	ZINC000819193363	GH	On-Demand	Anodyne	SIGMAR1	15	42
O=C1[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)CCCN1Cc1ccccc1	ZINC000819193364	GH	On-Demand	Anodyne	SIGMAR1	15	42
O=C1[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)CCCN1Cc1ccccc1	ZINC000819193365	GH	On-Demand	Anodyne	SIGMAR1	15	42
O=C1[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)CCCN1Cc1ccccc1	ZINC000819193366	GH	On-Demand	Anodyne	SIGMAR1	15	42
O=C1[C@H](NC[C@H](O)c2cccc(F)c2)CCCN1Cc1ccccc1	ZINC000819193367	EF	On-Demand	Anodyne	SIGMAR1	15	41
O=C1[C@@H](NC[C@H](O)c2cccc(F)c2)CCCN1Cc1ccccc1	ZINC000819193368	EF	On-Demand	Anodyne	SIGMAR1	15	41
O=C1[C@@H](NC[C@@H](O)c2cccc(F)c2)CCCN1Cc1ccccc1	ZINC000819193369	EF	On-Demand	Anodyne	SIGMAR1	15	41
O=C1[C@H](NC[C@@H](O)c2cccc(F)c2)CCCN1Cc1ccccc1	ZINC000819193370	EF	On-Demand	Anodyne	SIGMAR1	15	41
C[C@H](NC[C@H](O)COc1ccccc1C(F)(F)F)c1ccc[nH]1	ZINC000819193415	EG	On-Demand	Anodyne	ADRB2	34	50
C[C@H](NC[C@H](O)COc1ccccc1C(F)(F)F)c1ccc[nH]1	ZINC000819193415	EG	On-Demand	Anodyne	ADRB1	35	46
C[C@@H](NC[C@@H](O)COc1ccccc1C(F)(F)F)c1ccc[nH]1	ZINC000819193416	EG	On-Demand	Anodyne	ADRB2	34	50
C[C@@H](NC[C@@H](O)COc1ccccc1C(F)(F)F)c1ccc[nH]1	ZINC000819193416	EG	On-Demand	Anodyne	ADRB1	35	46
C[C@@H](NCCC(=O)Nc1cccc(Br)c1)c1ccc[nH]1	ZINC000819193421	EG	On-Demand	Anodyne	EGFR	32	42
C[C@@H](NCCC(=O)Nc1cccc(Br)c1)c1ccc[nH]1	ZINC000819193421	EG	On-Demand	Anodyne	HDAC2	15	40
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819193423	EF	On-Demand	Anodyne	ADRB2	54	49
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819193423	EF	On-Demand	Anodyne	ADRB1	73	55
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819193423	EF	On-Demand	Anodyne	ADRB3	49	47
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819193423	EF	On-Demand	Anodyne	ABCB1	30	40
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819193424	EF	On-Demand	Anodyne	ADRB2	54	49
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819193424	EF	On-Demand	Anodyne	ADRB1	73	55
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819193424	EF	On-Demand	Anodyne	ADRB3	49	47
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819193424	EF	On-Demand	Anodyne	ABCB1	30	40
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819193425	EF	On-Demand	Anodyne	ADRB2	54	49
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819193425	EF	On-Demand	Anodyne	ADRB1	73	55
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819193425	EF	On-Demand	Anodyne	ADRB3	49	47
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819193425	EF	On-Demand	Anodyne	ABCB1	30	40
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819193426	EF	On-Demand	Anodyne	ADRB2	54	49
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819193426	EF	On-Demand	Anodyne	ADRB1	73	55
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819193426	EF	On-Demand	Anodyne	ADRB3	49	47
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819193426	EF	On-Demand	Anodyne	ABCB1	30	40
C[C@@H](NC[C@@H](O)COc1cccc2[nH]ccc12)c1ccc[nH]1	ZINC000819193427	CF	On-Demand	Anodyne	ADRB2	33	75
C[C@@H](NC[C@@H](O)COc1cccc2[nH]ccc12)c1ccc[nH]1	ZINC000819193427	CF	On-Demand	Anodyne	ADRB1	38	75
C[C@@H](NC[C@@H](O)COc1cccc2[nH]ccc12)c1ccc[nH]1	ZINC000819193427	CF	On-Demand	Anodyne	HTR1A	16	75
C[C@@H](NC[C@@H](O)COc1cccc2[nH]ccc12)c1ccc[nH]1	ZINC000819193427	CF	On-Demand	Anodyne	SLC6A4	18	41
C[C@H](NC[C@H](O)COc1cccc2[nH]ccc12)c1ccc[nH]1	ZINC000819193430	CF	On-Demand	Anodyne	ADRB2	33	75
C[C@H](NC[C@H](O)COc1cccc2[nH]ccc12)c1ccc[nH]1	ZINC000819193430	CF	On-Demand	Anodyne	ADRB1	38	75
C[C@H](NC[C@H](O)COc1cccc2[nH]ccc12)c1ccc[nH]1	ZINC000819193430	CF	On-Demand	Anodyne	HTR1A	16	75
C[C@H](NC[C@H](O)COc1cccc2[nH]ccc12)c1ccc[nH]1	ZINC000819193430	CF	On-Demand	Anodyne	SLC6A4	18	41
C[C@H](NC[C@H](O)Cc1ccc2ccccc2c1)c1ccc[nH]1	ZINC000819193439	CG	On-Demand	Anodyne	ADRB2	15	45
C[C@@H](NC[C@@H](O)Cc1ccc2ccccc2c1)c1ccc[nH]1	ZINC000819193440	CG	On-Demand	Anodyne	ADRB2	15	45
COc1ccccc1[C@@H](NCC1(O)CCCCC1)c1ccccn1	ZINC000819193478	EG	On-Demand	Anodyne	HCN1	41	33
Cc1cncc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819193481	EG	On-Demand	Anodyne	GRIN2B	15	40
O=C1[C@H](NC[C@@H](O)Cc2ccc3ccccc3c2)CCCN1Cc1ccccc1	ZINC000819193487	GH	On-Demand	Anodyne	MME	19	41
O=C1[C@H](NC[C@H](O)Cc2ccc3ccccc3c2)CCCN1Cc1ccccc1	ZINC000819193488	GH	On-Demand	Anodyne	MME	19	41
O=C1[C@@H](NC[C@H](O)Cc2ccc3ccccc3c2)CCCN1Cc1ccccc1	ZINC000819193489	GH	On-Demand	Anodyne	MME	19	41
O=C1[C@@H](NC[C@@H](O)Cc2ccc3ccccc3c2)CCCN1Cc1ccccc1	ZINC000819193490	GH	On-Demand	Anodyne	MME	19	41
O=C1[C@@H](NC[C@@H](O)Cc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193491	EE	On-Demand	Anodyne	ACE	56	47
O=C1[C@@H](NC[C@@H](O)Cc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193491	EE	On-Demand	Anodyne	MME	37	47
O=C1[C@@H](NC[C@@H](O)Cc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193491	EE	On-Demand	Anodyne	SIGMAR1	21	40
O=C1[C@@H](NC[C@H](O)Cc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193492	EE	On-Demand	Anodyne	ACE	56	47
O=C1[C@@H](NC[C@H](O)Cc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193492	EE	On-Demand	Anodyne	MME	37	47
O=C1[C@@H](NC[C@H](O)Cc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193492	EE	On-Demand	Anodyne	SIGMAR1	21	40
O=C1[C@H](NC[C@@H](O)Cc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193493	EE	On-Demand	Anodyne	ACE	56	47
O=C1[C@H](NC[C@@H](O)Cc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193493	EE	On-Demand	Anodyne	MME	37	47
O=C1[C@H](NC[C@@H](O)Cc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193493	EE	On-Demand	Anodyne	SIGMAR1	21	40
O=C1[C@H](NC[C@H](O)Cc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193494	EE	On-Demand	Anodyne	ACE	56	47
O=C1[C@H](NC[C@H](O)Cc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193494	EE	On-Demand	Anodyne	MME	37	47
O=C1[C@H](NC[C@H](O)Cc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193494	EE	On-Demand	Anodyne	SIGMAR1	21	40
Cc1cncc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819193555	EG	On-Demand	Anodyne	GRIN2B	15	40
CCOC(=O)CC[C@@H](C)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819193557	EF	On-Demand	Anodyne	ADRB2	22	53
CCOC(=O)CC[C@H](C)NC[C@H](O)c1ccc(Br)cc1	ZINC000819193559	EF	On-Demand	Anodyne	ADRB2	22	53
CCOC(=O)CC[C@@H](C)NC[C@H](O)c1ccc(Br)cc1	ZINC000819193560	EF	On-Demand	Anodyne	ADRB2	22	53
CCOC(=O)CC[C@H](C)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819193562	EF	On-Demand	Anodyne	ADRB2	22	53
C[C@H](NC[C@H](O)COc1ccc(F)cc1)c1ccc[nH]1	ZINC000819193571	CE	On-Demand	Anodyne	ADRB2	46	50
C[C@H](NC[C@H](O)COc1ccc(F)cc1)c1ccc[nH]1	ZINC000819193571	CE	On-Demand	Anodyne	ADRB1	52	47
C[C@H](NC[C@H](O)COc1ccc(F)cc1)c1ccc[nH]1	ZINC000819193571	CE	On-Demand	Anodyne	ADRB3	24	44
C[C@@H](NC[C@@H](O)COc1ccc(F)cc1)c1ccc[nH]1	ZINC000819193573	CE	On-Demand	Anodyne	ADRB2	46	50
C[C@@H](NC[C@@H](O)COc1ccc(F)cc1)c1ccc[nH]1	ZINC000819193573	CE	On-Demand	Anodyne	ADRB1	52	47
C[C@@H](NC[C@@H](O)COc1ccc(F)cc1)c1ccc[nH]1	ZINC000819193573	CE	On-Demand	Anodyne	ADRB3	24	44
CCOC(=O)CC[C@H](O)CN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193574	ED	On-Demand	Anodyne	ACE	47	41
CCOC(=O)CC[C@H](O)CN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193574	ED	On-Demand	Anodyne	APP	15	42
CCOC(=O)CC[C@@H](O)CN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193576	ED	On-Demand	Anodyne	ACE	47	41
CCOC(=O)CC[C@@H](O)CN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193576	ED	On-Demand	Anodyne	APP	15	42
CCOC(=O)CC[C@H](O)CN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193579	ED	On-Demand	Anodyne	ACE	47	41
CCOC(=O)CC[C@H](O)CN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193579	ED	On-Demand	Anodyne	APP	15	42
C[C@H](NC[C@H](O)COc1cc(Cl)ccc1Cl)c1ccc[nH]1	ZINC000819193580	EG	On-Demand	Anodyne	ADRB2	25	43
C[C@H](NC[C@H](O)COc1cc(Cl)ccc1Cl)c1ccc[nH]1	ZINC000819193580	EG	On-Demand	Anodyne	ADRB1	28	42
CCOC(=O)CC[C@@H](O)CN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193581	ED	On-Demand	Anodyne	ACE	47	41
CCOC(=O)CC[C@@H](O)CN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193581	ED	On-Demand	Anodyne	APP	15	42
C[C@@H](NC[C@@H](O)COc1cc(Cl)ccc1Cl)c1ccc[nH]1	ZINC000819193585	EG	On-Demand	Anodyne	ADRB2	25	43
C[C@@H](NC[C@@H](O)COc1cc(Cl)ccc1Cl)c1ccc[nH]1	ZINC000819193585	EG	On-Demand	Anodyne	ADRB1	28	42
Cc1cncc(CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819193666	CE	On-Demand	Anodyne	ADRB1	16	40
Cc1cncc(CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819193666	CE	On-Demand	Anodyne	ADRB3	29	40
Cc1cncc(CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819193667	CE	On-Demand	Anodyne	ADRB1	16	40
Cc1cncc(CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819193667	CE	On-Demand	Anodyne	ADRB3	29	40
Cc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)c(C)c1	ZINC000819193671	CF	On-Demand	Anodyne	ADRB2	29	54
Cc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)c(C)c1	ZINC000819193671	CF	On-Demand	Anodyne	ADRB1	24	44
Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)c(C)c1	ZINC000819193672	CF	On-Demand	Anodyne	ADRB2	29	54
Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)c(C)c1	ZINC000819193672	CF	On-Demand	Anodyne	ADRB1	24	44
Cc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)c(C)c1	ZINC000819193673	CF	On-Demand	Anodyne	ADRB2	29	54
Cc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)c(C)c1	ZINC000819193673	CF	On-Demand	Anodyne	ADRB1	24	44
Cc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)c(C)c1	ZINC000819193674	CF	On-Demand	Anodyne	ADRB2	29	54
Cc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)c(C)c1	ZINC000819193674	CF	On-Demand	Anodyne	ADRB1	24	44
CON(C)C(=O)CCN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193685	DD	On-Demand	Anodyne	ACE	35	40
CON(C)C(=O)CCN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193686	DD	On-Demand	Anodyne	ACE	35	40
O=C1[C@H](NC[C@H](O)c2ccccc2)CCCN1Cc1ccccc1	ZINC000819193687	DF	On-Demand	Anodyne	ACE	44	43
O=C1[C@H](NC[C@H](O)c2ccccc2)CCCN1Cc1ccccc1	ZINC000819193687	DF	On-Demand	Anodyne	MME	24	43
O=C1[C@H](NC[C@H](O)c2ccccc2)CCCN1Cc1ccccc1	ZINC000819193687	DF	On-Demand	Anodyne	BIRC8	42	32
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCCN1Cc1ccccc1	ZINC000819193688	DF	On-Demand	Anodyne	ACE	44	43
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCCN1Cc1ccccc1	ZINC000819193688	DF	On-Demand	Anodyne	MME	24	43
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCCN1Cc1ccccc1	ZINC000819193688	DF	On-Demand	Anodyne	BIRC8	42	32
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCCN1Cc1ccccc1	ZINC000819193689	DF	On-Demand	Anodyne	ACE	44	43
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCCN1Cc1ccccc1	ZINC000819193689	DF	On-Demand	Anodyne	MME	24	43
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCCN1Cc1ccccc1	ZINC000819193689	DF	On-Demand	Anodyne	BIRC8	42	32
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCCN1Cc1ccccc1	ZINC000819193690	DF	On-Demand	Anodyne	ACE	44	43
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCCN1Cc1ccccc1	ZINC000819193690	DF	On-Demand	Anodyne	MME	24	43
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCCN1Cc1ccccc1	ZINC000819193690	DF	On-Demand	Anodyne	BIRC8	42	32
O=C1[C@H](NC[C@@H](O)CN2CCc3ccccc3C2)CCCN1Cc1ccccc1	ZINC000819193691	GE	On-Demand	Anodyne	NOD2	40	34
O=C1[C@@H](NC[C@H](O)CN2CCc3ccccc3C2)CCCN1Cc1ccccc1	ZINC000819193692	GE	On-Demand	Anodyne	NOD2	40	34
O=C1[C@@H](NC[C@@H](O)CN2CCc3ccccc3C2)CCCN1Cc1ccccc1	ZINC000819193693	GE	On-Demand	Anodyne	NOD2	40	34
O=C1[C@H](NC[C@H](O)CN2CCc3ccccc3C2)CCCN1Cc1ccccc1	ZINC000819193694	GE	On-Demand	Anodyne	NOD2	40	34
NC(=O)NC(=O)CCN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193700	DC	On-Demand	Anodyne	F2	17	43
NC(=O)NC(=O)CCN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193700	DC	On-Demand	Anodyne	PRSS1	24	43
NC(=O)NC(=O)CCN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193700	DC	On-Demand	Anodyne	F10	17	42
NC(=O)NC(=O)CCN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193701	DC	On-Demand	Anodyne	F2	17	43
NC(=O)NC(=O)CCN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193701	DC	On-Demand	Anodyne	PRSS1	24	43
NC(=O)NC(=O)CCN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819193701	DC	On-Demand	Anodyne	F10	17	42
C[C@@](O)(CN[C@H]1CCCN(Cc2ccccc2)C1=O)C(F)(F)F	ZINC000819193702	EE	On-Demand	Anodyne	CACNA1G	20	41
C[C@@](O)(CN[C@@H]1CCCN(Cc2ccccc2)C1=O)C(F)(F)F	ZINC000819193704	EE	On-Demand	Anodyne	CACNA1G	20	41
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2F)CCCN1Cc1ccccc1	ZINC000819193720	FF	On-Demand	Anodyne	SIGMAR1	19	42
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2F)CCCN1Cc1ccccc1	ZINC000819193721	FF	On-Demand	Anodyne	SIGMAR1	19	42
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2F)CCCN1Cc1ccccc1	ZINC000819193722	FF	On-Demand	Anodyne	SIGMAR1	19	42
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2F)CCCN1Cc1ccccc1	ZINC000819193723	FF	On-Demand	Anodyne	SIGMAR1	19	42
O=C(CCN[C@H]1CCCN(Cc2ccccc2)C1=O)Nc1ccccc1	ZINC000819193724	FF	On-Demand	Anodyne	ACE	32	40
O=C(CCN[C@H]1CCCN(Cc2ccccc2)C1=O)Nc1ccccc1	ZINC000819193724	FF	On-Demand	Anodyne	MME	18	40
O=C(CCN[C@H]1CCCN(Cc2ccccc2)C1=O)Nc1ccccc1	ZINC000819193724	FF	On-Demand	Anodyne	SIGMAR1	19	44
O=C(CCN[C@@H]1CCCN(Cc2ccccc2)C1=O)Nc1ccccc1	ZINC000819193725	FF	On-Demand	Anodyne	ACE	32	40
O=C(CCN[C@@H]1CCCN(Cc2ccccc2)C1=O)Nc1ccccc1	ZINC000819193725	FF	On-Demand	Anodyne	MME	18	40
O=C(CCN[C@@H]1CCCN(Cc2ccccc2)C1=O)Nc1ccccc1	ZINC000819193725	FF	On-Demand	Anodyne	SIGMAR1	19	44
N#Cc1cccc(S(=O)(=O)CCN[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193732	GE	On-Demand	Mild	ITGA4	49	32
N#Cc1cccc(S(=O)(=O)CCN[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193741	GE	On-Demand	Mild	ITGA4	49	32
O=C1[C@H](NC[C@H](O)c2ccc(F)c(F)c2)CCCN1c1ccccc1F	ZINC000819193752	FF	On-Demand	Anodyne	KCNQ2	15	40
O=C1[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)CCCN1c1ccccc1F	ZINC000819193753	FF	On-Demand	Anodyne	KCNQ2	15	40
O=C1[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)CCCN1c1ccccc1F	ZINC000819193754	FF	On-Demand	Anodyne	KCNQ2	15	40
O=C1[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)CCCN1c1ccccc1F	ZINC000819193755	FF	On-Demand	Anodyne	KCNQ2	15	40
O=C1[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)CCCN1Cc1ccccc1	ZINC000819193779	GH	On-Demand	Anodyne	SIGMAR1	17	42
O=C1[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)CCCN1Cc1ccccc1	ZINC000819193784	GH	On-Demand	Anodyne	SIGMAR1	17	42
O=C1[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)CCCN1Cc1ccccc1	ZINC000819193786	GH	On-Demand	Anodyne	SIGMAR1	17	42
O=C1[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)CCCN1Cc1ccccc1	ZINC000819193788	GH	On-Demand	Anodyne	SIGMAR1	17	42
O=C1[C@H](NC[C@@H](O)CCc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193799	FF	On-Demand	Anodyne	ACE	63	50
O=C1[C@H](NC[C@@H](O)CCc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193799	FF	On-Demand	Anodyne	MME	27	43
O=C1[C@H](NC[C@@H](O)CCc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193799	FF	On-Demand	Anodyne	SAP2	40	37
O=C1[C@H](NC[C@H](O)CCc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193801	FF	On-Demand	Anodyne	ACE	63	50
O=C1[C@H](NC[C@H](O)CCc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193801	FF	On-Demand	Anodyne	MME	27	43
O=C1[C@H](NC[C@H](O)CCc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193801	FF	On-Demand	Anodyne	SAP2	40	37
O=C1[C@@H](NC[C@H](O)CCc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193804	FF	On-Demand	Anodyne	ACE	63	50
O=C1[C@@H](NC[C@H](O)CCc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193804	FF	On-Demand	Anodyne	MME	27	43
O=C1[C@@H](NC[C@H](O)CCc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193804	FF	On-Demand	Anodyne	SAP2	40	37
O=C1[C@@H](NC[C@@H](O)CCc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193806	FF	On-Demand	Anodyne	ACE	63	50
O=C1[C@@H](NC[C@@H](O)CCc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193806	FF	On-Demand	Anodyne	MME	27	43
O=C1[C@@H](NC[C@@H](O)CCc2ccccc2)CCCN1Cc1ccccc1	ZINC000819193806	FF	On-Demand	Anodyne	SAP2	40	37
O=C1[C@@H](NCC2(O)CCCC2)CCCN1Cc1ccccc1	ZINC000819193811	DE	On-Demand	Anodyne	ACE	36	42
O=C1[C@@H](NCC2(O)CCCC2)CCCN1Cc1ccccc1	ZINC000819193811	DE	On-Demand	Anodyne	MME	22	42
O=C1[C@H](NCC2(O)CCCC2)CCCN1Cc1ccccc1	ZINC000819193813	DE	On-Demand	Anodyne	ACE	36	42
O=C1[C@H](NCC2(O)CCCC2)CCCN1Cc1ccccc1	ZINC000819193813	DE	On-Demand	Anodyne	MME	22	42
O[C@@H](CNCCc1nc2c(s1)CCCC2)c1ccc(F)cn1	ZINC000819193819	DE	On-Demand	Anodyne	SLC27A1	38	40
O[C@H](CNCCc1nc2c(s1)CCCC2)c1ccc(F)cn1	ZINC000819193820	DE	On-Demand	Anodyne	SLC27A1	38	40
C[C@H](NC[C@H](O)COC1CCOCC1)c1ccc[nH]1	ZINC000819193831	CD	On-Demand	Anodyne	ADRB1	19	40
C[C@@H](NC[C@@H](O)COC1CCOCC1)c1ccc[nH]1	ZINC000819193832	CD	On-Demand	Anodyne	ADRB1	19	40
C[C@H](CNC[C@@H](O)c1cccc(F)c1)c1nc(-c2ccccc2)no1	ZINC000819193851	EG	On-Demand	Anodyne	ADRB3	42	43
C[C@H](CNC[C@H](O)c1cccc(F)c1)c1nc(-c2ccccc2)no1	ZINC000819193852	EG	On-Demand	Anodyne	ADRB3	42	43
C[C@@H](CNC[C@H](O)c1cccc(F)c1)c1nc(-c2ccccc2)no1	ZINC000819193853	EG	On-Demand	Anodyne	ADRB3	42	43
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)c1nc(-c2ccccc2)no1	ZINC000819193854	EG	On-Demand	Anodyne	ADRB3	42	43
CCOC[C@H](O)CN[C@H](C)c1ccc[nH]1	ZINC000819193866	BD	On-Demand	Anodyne	ADRB2	24	42
CCOC[C@H](O)CN[C@@H](C)c1ccc[nH]1	ZINC000819193868	BD	On-Demand	Anodyne	ADRB2	24	42
CS(=O)(=O)c1ccc([C@H](O)CNCC2(c3ccc(F)cc3F)CC2)cc1	ZINC000819193890	GF	On-Demand	Anodyne	PTGS2	20	41
CS(=O)(=O)c1ccc([C@@H](O)CNCC2(c3ccc(F)cc3F)CC2)cc1	ZINC000819193891	GF	On-Demand	Anodyne	PTGS2	20	41
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(C(=O)c2ccncc2)CC1	ZINC000819193892	ED	On-Demand	Anodyne	L3MBTL3	62	38
O=C(/C=C\[C@H]1CCCO1)NC1CCN(C(=O)c2ccncc2)CC1	ZINC000819193893	ED	On-Demand	Anodyne	L3MBTL3	62	38
O=C(/C=C/[C@H]1CCCO1)NC1CCN(C(=O)c2ccncc2)CC1	ZINC000819193894	ED	On-Demand	Anodyne	L3MBTL3	62	38
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(C(=O)c2ccncc2)CC1	ZINC000819193895	ED	On-Demand	Anodyne	L3MBTL3	62	38
CC(C)(C)OC(=O)NC[C@H](NCCC(N)=O)c1ccc2ccccc2c1	ZINC000819193912	FF	On-Demand	Anodyne	PAPA1_CARPA	18	42
CC(C)(C)OC(=O)NC[C@H](NCCC(N)=O)c1ccc2ccccc2c1	ZINC000819193912	FF	On-Demand	Anodyne	TPH1	41	36
CC(C)(C)OC(=O)NC[C@@H](NCCC(N)=O)c1ccc2ccccc2c1	ZINC000819193913	FF	On-Demand	Anodyne	PAPA1_CARPA	18	42
CC(C)(C)OC(=O)NC[C@@H](NCCC(N)=O)c1ccc2ccccc2c1	ZINC000819193913	FF	On-Demand	Anodyne	TPH1	41	36
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193922	GF	On-Demand	Anodyne	ADRB2	52	40
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193922	GF	On-Demand	Anodyne	ADRB1	71	38
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193922	GF	On-Demand	Anodyne	ADRB3	50	43
CCOc1ccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193923	GF	On-Demand	Anodyne	ADRB2	52	40
CCOc1ccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193923	GF	On-Demand	Anodyne	ADRB1	71	38
CCOc1ccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193923	GF	On-Demand	Anodyne	ADRB3	50	43
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193924	GF	On-Demand	Anodyne	ADRB2	52	40
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193924	GF	On-Demand	Anodyne	ADRB1	71	38
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193924	GF	On-Demand	Anodyne	ADRB3	50	43
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193925	GF	On-Demand	Anodyne	ADRB2	52	40
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193925	GF	On-Demand	Anodyne	ADRB1	71	38
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819193925	GF	On-Demand	Anodyne	ADRB3	50	43
COC[C@@H](O)CN[C@H](C)c1ccc[nH]1	ZINC000819193937	AC	On-Demand	Anodyne	ADRB2	24	41
COC[C@@H](O)CN[C@H](C)c1ccc[nH]1	ZINC000819193937	AC	On-Demand	Anodyne	ADRB1	20	40
COC[C@@H](O)CN[C@@H](C)c1ccc[nH]1	ZINC000819193940	AC	On-Demand	Anodyne	ADRB2	24	41
COC[C@@H](O)CN[C@@H](C)c1ccc[nH]1	ZINC000819193940	AC	On-Demand	Anodyne	ADRB1	20	40
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193961	GE	On-Demand	Anodyne	ADRB2	27	40
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193961	GE	On-Demand	Anodyne	ADRB1	47	37
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193961	GE	On-Demand	Anodyne	ADRB3	39	40
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193961	GE	On-Demand	Anodyne	ABCB1	37	45
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193961	GE	On-Demand	Anodyne	PDS	59	35
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193963	GE	On-Demand	Anodyne	ADRB2	27	40
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193963	GE	On-Demand	Anodyne	ADRB1	47	37
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193963	GE	On-Demand	Anodyne	ADRB3	39	40
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193963	GE	On-Demand	Anodyne	ABCB1	37	45
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193963	GE	On-Demand	Anodyne	PDS	59	35
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193966	GE	On-Demand	Anodyne	ADRB2	27	40
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193966	GE	On-Demand	Anodyne	ADRB1	47	37
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193966	GE	On-Demand	Anodyne	ADRB3	39	40
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193966	GE	On-Demand	Anodyne	ABCB1	37	45
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193966	GE	On-Demand	Anodyne	PDS	59	35
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193968	GE	On-Demand	Anodyne	ADRB2	27	40
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193968	GE	On-Demand	Anodyne	ADRB1	47	37
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193968	GE	On-Demand	Anodyne	ADRB3	39	40
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193968	GE	On-Demand	Anodyne	ABCB1	37	45
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819193968	GE	On-Demand	Anodyne	PDS	59	35
C[C@H](NC[C@H](O)COc1cc(F)cc(Br)c1)c1ccc[nH]1	ZINC000819193979	FG	On-Demand	Anodyne	ADRB2	20	41
C[C@H](NC[C@H](O)COc1cc(F)cc(Br)c1)c1ccc[nH]1	ZINC000819193979	FG	On-Demand	Anodyne	ADRB1	21	40
C[C@@H](NC[C@@H](O)COc1cc(F)cc(Br)c1)c1ccc[nH]1	ZINC000819193984	FG	On-Demand	Anodyne	ADRB2	20	41
C[C@@H](NC[C@@H](O)COc1cc(F)cc(Br)c1)c1ccc[nH]1	ZINC000819193984	FG	On-Demand	Anodyne	ADRB1	21	40
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194000	GE	On-Demand	Anodyne	ACE	33	40
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194000	GE	On-Demand	Anodyne	CCKAR	18	41
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194000	GE	On-Demand	Anodyne	REN	44	37
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194001	GE	On-Demand	Anodyne	ACE	33	40
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194001	GE	On-Demand	Anodyne	CCKAR	18	41
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194001	GE	On-Demand	Anodyne	REN	44	37
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194004	GE	On-Demand	Anodyne	ACE	33	40
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194004	GE	On-Demand	Anodyne	CCKAR	18	41
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194004	GE	On-Demand	Anodyne	REN	44	37
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194005	GE	On-Demand	Anodyne	ACE	33	40
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194005	GE	On-Demand	Anodyne	CCKAR	18	41
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194005	GE	On-Demand	Anodyne	REN	44	37
O=C1[C@H](NC[C@H](O)COc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194015	FE	On-Demand	Anodyne	ADRB2	46	43
O=C1[C@H](NC[C@H](O)COc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194015	FE	On-Demand	Anodyne	ADRB1	68	43
O=C1[C@H](NC[C@H](O)COc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194015	FE	On-Demand	Anodyne	ADRB3	52	43
O=C1[C@H](NC[C@H](O)COc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194015	FE	On-Demand	Anodyne	SIGMAR1	15	42
O=C1[C@@H](NC[C@H](O)COc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194016	FE	On-Demand	Anodyne	ADRB2	46	43
O=C1[C@@H](NC[C@H](O)COc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194016	FE	On-Demand	Anodyne	ADRB1	68	43
O=C1[C@@H](NC[C@H](O)COc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194016	FE	On-Demand	Anodyne	ADRB3	52	43
O=C1[C@@H](NC[C@H](O)COc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194016	FE	On-Demand	Anodyne	SIGMAR1	15	42
O=C1[C@@H](NC[C@@H](O)COc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194018	FE	On-Demand	Anodyne	ADRB2	46	43
O=C1[C@@H](NC[C@@H](O)COc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194018	FE	On-Demand	Anodyne	ADRB1	68	43
O=C1[C@@H](NC[C@@H](O)COc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194018	FE	On-Demand	Anodyne	ADRB3	52	43
O=C1[C@@H](NC[C@@H](O)COc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194018	FE	On-Demand	Anodyne	SIGMAR1	15	42
O=C1[C@H](NC[C@@H](O)COc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194019	FE	On-Demand	Anodyne	ADRB2	46	43
O=C1[C@H](NC[C@@H](O)COc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194019	FE	On-Demand	Anodyne	ADRB1	68	43
O=C1[C@H](NC[C@@H](O)COc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194019	FE	On-Demand	Anodyne	ADRB3	52	43
O=C1[C@H](NC[C@@H](O)COc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194019	FE	On-Demand	Anodyne	SIGMAR1	15	42
Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194020	FF	On-Demand	Anodyne	ADRB2	49	44
Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194020	FF	On-Demand	Anodyne	ADRB1	67	38
Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194020	FF	On-Demand	Anodyne	ADRB3	49	41
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194021	FF	On-Demand	Anodyne	ADRB2	49	44
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194021	FF	On-Demand	Anodyne	ADRB1	67	38
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194021	FF	On-Demand	Anodyne	ADRB3	49	41
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194023	FF	On-Demand	Anodyne	ADRB2	49	44
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194023	FF	On-Demand	Anodyne	ADRB1	67	38
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194023	FF	On-Demand	Anodyne	ADRB3	49	41
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194025	FF	On-Demand	Anodyne	ADRB2	49	44
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194025	FF	On-Demand	Anodyne	ADRB1	67	38
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194025	FF	On-Demand	Anodyne	ADRB3	49	41
COc1cccc(OC)c1OC[C@H](O)CN[C@H](C)c1ccc[nH]1	ZINC000819194045	DE	On-Demand	Anodyne	ADRB2	36	50
COc1cccc(OC)c1OC[C@H](O)CN[C@H](C)c1ccc[nH]1	ZINC000819194045	DE	On-Demand	Anodyne	ADRB1	34	50
COc1cccc(OC)c1OC[C@@H](O)CN[C@H](C)c1ccc[nH]1	ZINC000819194046	DE	On-Demand	Anodyne	ADRB2	36	50
COc1cccc(OC)c1OC[C@@H](O)CN[C@H](C)c1ccc[nH]1	ZINC000819194046	DE	On-Demand	Anodyne	ADRB1	34	50
COc1cccc(OC)c1OC[C@H](O)CN[C@@H](C)c1ccc[nH]1	ZINC000819194047	DE	On-Demand	Anodyne	ADRB2	36	50
COc1cccc(OC)c1OC[C@H](O)CN[C@@H](C)c1ccc[nH]1	ZINC000819194047	DE	On-Demand	Anodyne	ADRB1	34	50
COc1cccc(OC)c1OC[C@@H](O)CN[C@@H](C)c1ccc[nH]1	ZINC000819194048	DE	On-Demand	Anodyne	ADRB2	36	50
COc1cccc(OC)c1OC[C@@H](O)CN[C@@H](C)c1ccc[nH]1	ZINC000819194048	DE	On-Demand	Anodyne	ADRB1	34	50
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194057	DE	On-Demand	Anodyne	ADRB2	52	67
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194057	DE	On-Demand	Anodyne	ADRB1	76	67
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194057	DE	On-Demand	Anodyne	ADRB3	45	49
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194058	DE	On-Demand	Anodyne	ADRB2	52	67
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194058	DE	On-Demand	Anodyne	ADRB1	76	67
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194058	DE	On-Demand	Anodyne	ADRB3	45	49
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194059	DE	On-Demand	Anodyne	ADRB2	52	67
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194059	DE	On-Demand	Anodyne	ADRB1	76	67
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194059	DE	On-Demand	Anodyne	ADRB3	45	49
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194060	DE	On-Demand	Anodyne	ADRB2	52	67
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194060	DE	On-Demand	Anodyne	ADRB1	76	67
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194060	DE	On-Demand	Anodyne	ADRB3	45	49
COCCc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194067	DE	On-Demand	Anodyne	ADRB2	50	67
COCCc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194067	DE	On-Demand	Anodyne	ADRB1	65	67
COCCc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194067	DE	On-Demand	Anodyne	ADRB3	42	48
COCCc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194068	DE	On-Demand	Anodyne	ADRB2	50	67
COCCc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194068	DE	On-Demand	Anodyne	ADRB1	65	67
COCCc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194068	DE	On-Demand	Anodyne	ADRB3	42	48
COCCc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194069	DE	On-Demand	Anodyne	ADRB2	50	67
COCCc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194069	DE	On-Demand	Anodyne	ADRB1	65	67
COCCc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194069	DE	On-Demand	Anodyne	ADRB3	42	48
COCCc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194070	DE	On-Demand	Anodyne	ADRB2	50	67
COCCc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194070	DE	On-Demand	Anodyne	ADRB1	65	67
COCCc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194070	DE	On-Demand	Anodyne	ADRB3	42	48
O=C1[C@@H](NC[C@H](O)COc2ccccc2Cl)CCCN1Cc1ccccc1	ZINC000819194086	GF	On-Demand	Anodyne	ADRB2	29	41
O=C1[C@@H](NC[C@H](O)COc2ccccc2Cl)CCCN1Cc1ccccc1	ZINC000819194086	GF	On-Demand	Anodyne	ADRB3	22	44
O=C1[C@@H](NC[C@H](O)COc2ccccc2Cl)CCCN1Cc1ccccc1	ZINC000819194086	GF	On-Demand	Anodyne	ABCB1	46	44
O=C1[C@H](NC[C@@H](O)COc2ccccc2Cl)CCCN1Cc1ccccc1	ZINC000819194087	GF	On-Demand	Anodyne	ADRB2	29	41
O=C1[C@H](NC[C@@H](O)COc2ccccc2Cl)CCCN1Cc1ccccc1	ZINC000819194087	GF	On-Demand	Anodyne	ADRB3	22	44
O=C1[C@H](NC[C@@H](O)COc2ccccc2Cl)CCCN1Cc1ccccc1	ZINC000819194087	GF	On-Demand	Anodyne	ABCB1	46	44
O=C1[C@@H](NC[C@@H](O)COc2ccccc2Cl)CCCN1Cc1ccccc1	ZINC000819194088	GF	On-Demand	Anodyne	ADRB2	29	41
O=C1[C@@H](NC[C@@H](O)COc2ccccc2Cl)CCCN1Cc1ccccc1	ZINC000819194088	GF	On-Demand	Anodyne	ADRB3	22	44
O=C1[C@@H](NC[C@@H](O)COc2ccccc2Cl)CCCN1Cc1ccccc1	ZINC000819194088	GF	On-Demand	Anodyne	ABCB1	46	44
O=C1[C@H](NC[C@H](O)COc2ccccc2Cl)CCCN1Cc1ccccc1	ZINC000819194089	GF	On-Demand	Anodyne	ADRB2	29	41
O=C1[C@H](NC[C@H](O)COc2ccccc2Cl)CCCN1Cc1ccccc1	ZINC000819194089	GF	On-Demand	Anodyne	ADRB3	22	44
O=C1[C@H](NC[C@H](O)COc2ccccc2Cl)CCCN1Cc1ccccc1	ZINC000819194089	GF	On-Demand	Anodyne	ABCB1	46	44
NC(=O)CCN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194092	CC	On-Demand	Anodyne	F2	24	44
NC(=O)CCN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194092	CC	On-Demand	Anodyne	PRSS1	23	42
NC(=O)CCN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194092	CC	On-Demand	Anodyne	ACE	51	43
NC(=O)CCN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194092	CC	On-Demand	Anodyne	F10	17	42
NC(=O)CCN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194092	CC	On-Demand	Anodyne	MME	26	43
NC(=O)CCN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194092	CC	On-Demand	Anodyne	APP	15	41
NC(=O)CCN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194095	CC	On-Demand	Anodyne	F2	24	44
NC(=O)CCN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194095	CC	On-Demand	Anodyne	PRSS1	23	42
NC(=O)CCN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194095	CC	On-Demand	Anodyne	ACE	51	43
NC(=O)CCN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194095	CC	On-Demand	Anodyne	F10	17	42
NC(=O)CCN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194095	CC	On-Demand	Anodyne	MME	26	43
NC(=O)CCN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194095	CC	On-Demand	Anodyne	APP	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1ccc(OC)cc1OC)C2	ZINC000819194099	GE	On-Demand	Anodyne	NQO2	35	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1ccc(OC)cc1OC)C2	ZINC000819194099	GE	On-Demand	Anodyne	MTNR1A	90	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1ccc(OC)cc1OC)C2	ZINC000819194099	GE	On-Demand	Anodyne	MTNR1B	71	37
C[C@@H](NC[C@@H](O)COc1c(Cl)cccc1Cl)c1ccc[nH]1	ZINC000819194100	EG	On-Demand	Anodyne	ADRB2	26	45
C[C@@H](NC[C@@H](O)COc1c(Cl)cccc1Cl)c1ccc[nH]1	ZINC000819194100	EG	On-Demand	Anodyne	ADRB1	26	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1ccc(OC)cc1OC)C2	ZINC000819194102	GE	On-Demand	Anodyne	NQO2	35	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1ccc(OC)cc1OC)C2	ZINC000819194102	GE	On-Demand	Anodyne	MTNR1A	90	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1ccc(OC)cc1OC)C2	ZINC000819194102	GE	On-Demand	Anodyne	MTNR1B	71	37
C[C@H](NC[C@H](O)COc1c(Cl)cccc1Cl)c1ccc[nH]1	ZINC000819194103	EG	On-Demand	Anodyne	ADRB2	26	45
C[C@H](NC[C@H](O)COc1c(Cl)cccc1Cl)c1ccc[nH]1	ZINC000819194103	EG	On-Demand	Anodyne	ADRB1	26	45
O=C1[C@@H](NC[C@@H](O)Cc2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819194113	FG	On-Demand	Anodyne	ACE	25	40
O=C1[C@@H](NC[C@@H](O)Cc2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819194113	FG	On-Demand	Anodyne	MME	15	40
O=C1[C@@H](NC[C@@H](O)Cc2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819194113	FG	On-Demand	Anodyne	PTGER4	17	40
O=C1[C@@H](NC[C@H](O)Cc2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819194116	FG	On-Demand	Anodyne	ACE	25	40
O=C1[C@@H](NC[C@H](O)Cc2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819194116	FG	On-Demand	Anodyne	MME	15	40
O=C1[C@@H](NC[C@H](O)Cc2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819194116	FG	On-Demand	Anodyne	PTGER4	17	40
O=C1[C@H](NC[C@@H](O)Cc2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819194118	FG	On-Demand	Anodyne	ACE	25	40
O=C1[C@H](NC[C@@H](O)Cc2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819194118	FG	On-Demand	Anodyne	MME	15	40
O=C1[C@H](NC[C@@H](O)Cc2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819194118	FG	On-Demand	Anodyne	PTGER4	17	40
Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194119	CE	On-Demand	Anodyne	ADRB2	44	63
Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194119	CE	On-Demand	Anodyne	ADRB1	47	48
Cc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194119	CE	On-Demand	Anodyne	ADRB3	20	44
O=C1[C@H](NC[C@H](O)Cc2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819194120	FG	On-Demand	Anodyne	ACE	25	40
O=C1[C@H](NC[C@H](O)Cc2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819194120	FG	On-Demand	Anodyne	MME	15	40
O=C1[C@H](NC[C@H](O)Cc2cccc(Cl)c2)CCCN1Cc1ccccc1	ZINC000819194120	FG	On-Demand	Anodyne	PTGER4	17	40
Cc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194122	CE	On-Demand	Anodyne	ADRB2	44	63
Cc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194122	CE	On-Demand	Anodyne	ADRB1	47	48
Cc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194122	CE	On-Demand	Anodyne	ADRB3	20	44
Cc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194123	CE	On-Demand	Anodyne	ADRB2	44	63
Cc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194123	CE	On-Demand	Anodyne	ADRB1	47	48
Cc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194123	CE	On-Demand	Anodyne	ADRB3	20	44
Cc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194125	CE	On-Demand	Anodyne	ADRB2	44	63
Cc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194125	CE	On-Demand	Anodyne	ADRB1	47	48
Cc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194125	CE	On-Demand	Anodyne	ADRB3	20	44
C[C@@H](NC[C@@H](O)COc1ccc2ccccc2c1)c1ccc[nH]1	ZINC000819194128	DG	On-Demand	Anodyne	ADRB2	41	67
C[C@@H](NC[C@@H](O)COc1ccc2ccccc2c1)c1ccc[nH]1	ZINC000819194128	DG	On-Demand	Anodyne	ADRB1	35	45
C[C@@H](NC[C@@H](O)COc1ccc2ccccc2c1)c1ccc[nH]1	ZINC000819194128	DG	On-Demand	Anodyne	ADRB3	17	43
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)c1ccc[nH]1	ZINC000819194132	DG	On-Demand	Anodyne	ADRB2	41	67
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)c1ccc[nH]1	ZINC000819194132	DG	On-Demand	Anodyne	ADRB1	35	45
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)c1ccc[nH]1	ZINC000819194132	DG	On-Demand	Anodyne	ADRB3	17	43
O=C1[C@H](NC[C@H](O)COc2ccc(Cl)cc2)CCCN1Cc1ccccc1	ZINC000819194140	GF	On-Demand	Anodyne	ADRB1	65	39
O=C1[C@H](NC[C@H](O)COc2ccc(Cl)cc2)CCCN1Cc1ccccc1	ZINC000819194140	GF	On-Demand	Anodyne	ADRB3	50	42
CCOc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194141	DF	On-Demand	Anodyne	ADRB2	43	50
CCOc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194141	DF	On-Demand	Anodyne	ADRB1	46	50
CCOc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194141	DF	On-Demand	Anodyne	ADRB3	20	44
CCOc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194142	DF	On-Demand	Anodyne	ADRB2	43	50
CCOc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194142	DF	On-Demand	Anodyne	ADRB1	46	50
CCOc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194142	DF	On-Demand	Anodyne	ADRB3	20	44
O=C1[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)CCCN1Cc1ccccc1	ZINC000819194143	GF	On-Demand	Anodyne	ADRB1	65	39
O=C1[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)CCCN1Cc1ccccc1	ZINC000819194143	GF	On-Demand	Anodyne	ADRB3	50	42
CCOc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194144	DF	On-Demand	Anodyne	ADRB2	43	50
CCOc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194144	DF	On-Demand	Anodyne	ADRB1	46	50
CCOc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819194144	DF	On-Demand	Anodyne	ADRB3	20	44
O=C1[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)CCCN1Cc1ccccc1	ZINC000819194145	GF	On-Demand	Anodyne	ADRB1	65	39
O=C1[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)CCCN1Cc1ccccc1	ZINC000819194145	GF	On-Demand	Anodyne	ADRB3	50	42
CCOc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194146	DF	On-Demand	Anodyne	ADRB2	43	50
CCOc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194146	DF	On-Demand	Anodyne	ADRB1	46	50
CCOc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819194146	DF	On-Demand	Anodyne	ADRB3	20	44
O=C1[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)CCCN1Cc1ccccc1	ZINC000819194147	GF	On-Demand	Anodyne	ADRB1	65	39
O=C1[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)CCCN1Cc1ccccc1	ZINC000819194147	GF	On-Demand	Anodyne	ADRB3	50	42
O[C@@H](CNCC1(c2ccc(F)cc2F)CC1)c1cccnc1	ZINC000819194161	DF	On-Demand	Anodyne	ADRB2	17	40
O[C@@H](CNCC1(c2ccc(F)cc2F)CC1)c1cccnc1	ZINC000819194161	DF	On-Demand	Anodyne	ADRB1	19	41
O[C@@H](CNCC1(c2ccc(F)cc2F)CC1)c1cccnc1	ZINC000819194161	DF	On-Demand	Anodyne	ADRB3	75	41
O[C@H](CNCC1(c2ccc(F)cc2F)CC1)c1cccnc1	ZINC000819194163	DF	On-Demand	Anodyne	ADRB2	17	40
O[C@H](CNCC1(c2ccc(F)cc2F)CC1)c1cccnc1	ZINC000819194163	DF	On-Demand	Anodyne	ADRB1	19	41
O[C@H](CNCC1(c2ccc(F)cc2F)CC1)c1cccnc1	ZINC000819194163	DF	On-Demand	Anodyne	ADRB3	75	41
COc1cccc([S@@](=O)CC(=O)NNC(=O)N2CCOCC2)c1	ZINC000819194176	EB	On-Demand	Reactive	DRD4	42	33
O=[N+]([O-])c1cccc([C@H](O)CNC2CCC(F)(F)CC2)c1	ZINC000819194177	DF	On-Demand	Bother	CACNA1D	55	34
O=[N+]([O-])c1cccc([C@@H](O)CNC2CCC(F)(F)CC2)c1	ZINC000819194179	DF	On-Demand	Bother	CACNA1D	55	34
O=C1[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194180	GF	On-Demand	Anodyne	ADRB2	24	60
O=C1[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194180	GF	On-Demand	Anodyne	ADRB1	29	51
O=C1[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194180	GF	On-Demand	Anodyne	HTR1A	15	60
O=C1[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194180	GF	On-Demand	Anodyne	SLC6A4	19	44
O=C1[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194180	GF	On-Demand	Anodyne	ADRB3	20	51
O=C1[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194180	GF	On-Demand	Anodyne	ABCB1	26	41
O=C1[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194183	GF	On-Demand	Anodyne	ADRB2	24	60
O=C1[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194183	GF	On-Demand	Anodyne	ADRB1	29	51
O=C1[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194183	GF	On-Demand	Anodyne	HTR1A	15	60
O=C1[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194183	GF	On-Demand	Anodyne	SLC6A4	19	44
O=C1[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194183	GF	On-Demand	Anodyne	ADRB3	20	51
O=C1[C@@H](NC[C@@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194183	GF	On-Demand	Anodyne	ABCB1	26	41
O=C1[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194185	GF	On-Demand	Anodyne	ADRB2	24	60
O=C1[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194185	GF	On-Demand	Anodyne	ADRB1	29	51
O=C1[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194185	GF	On-Demand	Anodyne	HTR1A	15	60
O=C1[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194185	GF	On-Demand	Anodyne	SLC6A4	19	44
O=C1[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194185	GF	On-Demand	Anodyne	ADRB3	20	51
O=C1[C@@H](NC[C@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194185	GF	On-Demand	Anodyne	ABCB1	26	41
O=C1[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194187	GF	On-Demand	Anodyne	ADRB2	24	60
O=C1[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194187	GF	On-Demand	Anodyne	ADRB1	29	51
O=C1[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194187	GF	On-Demand	Anodyne	HTR1A	15	60
O=C1[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194187	GF	On-Demand	Anodyne	SLC6A4	19	44
O=C1[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194187	GF	On-Demand	Anodyne	ADRB3	20	51
O=C1[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)CCCN1Cc1ccccc1	ZINC000819194187	GF	On-Demand	Anodyne	ABCB1	26	41
O[C@H](CNC1CCC(F)(F)CC1)c1cccc(Cl)c1	ZINC000819194189	CH	On-Demand	Anodyne	ADRB1	40	45
O[C@H](CNC1CCC(F)(F)CC1)c1cccc(Cl)c1	ZINC000819194189	CH	On-Demand	Anodyne	ADRB3	55	51
O[C@H](CNC1CCC(F)(F)CC1)c1cccc(Cl)c1	ZINC000819194189	CH	On-Demand	Anodyne	CYP3A4	42	35
O[C@@H](CNC1CCC(F)(F)CC1)c1cccc(Cl)c1	ZINC000819194191	CH	On-Demand	Anodyne	ADRB1	40	45
O[C@@H](CNC1CCC(F)(F)CC1)c1cccc(Cl)c1	ZINC000819194191	CH	On-Demand	Anodyne	ADRB3	55	51
O[C@@H](CNC1CCC(F)(F)CC1)c1cccc(Cl)c1	ZINC000819194191	CH	On-Demand	Anodyne	CYP3A4	42	35
CC(C)(C)[C@@H](O)CN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194193	DE	On-Demand	Anodyne	ACE	44	43
CC(C)(C)[C@@H](O)CN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194193	DE	On-Demand	Anodyne	MME	25	43
CC(C)(C)[C@@H](O)CN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194195	DE	On-Demand	Anodyne	ACE	44	43
CC(C)(C)[C@@H](O)CN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194195	DE	On-Demand	Anodyne	MME	25	43
C[C@@H](NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccc[nH]1	ZINC000819194228	DD	On-Demand	Anodyne	ADRB3	19	43
C[C@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccc[nH]1	ZINC000819194230	DD	On-Demand	Anodyne	ADRB3	19	43
O[C@@H](CNCCc1nc2c(s1)CCCC2)c1cccc(Cl)c1	ZINC000819194234	EH	On-Demand	Anodyne	ADRB2	47	36
O[C@@H](CNCCc1nc2c(s1)CCCC2)c1cccc(Cl)c1	ZINC000819194234	EH	On-Demand	Anodyne	ADRB1	59	49
O[C@@H](CNCCc1nc2c(s1)CCCC2)c1cccc(Cl)c1	ZINC000819194234	EH	On-Demand	Anodyne	ADRB3	100	49
O[C@H](CNCCc1nc2c(s1)CCCC2)c1cccc(Cl)c1	ZINC000819194236	EH	On-Demand	Anodyne	ADRB2	47	36
O[C@H](CNCCc1nc2c(s1)CCCC2)c1cccc(Cl)c1	ZINC000819194236	EH	On-Demand	Anodyne	ADRB1	59	49
O[C@H](CNCCc1nc2c(s1)CCCC2)c1cccc(Cl)c1	ZINC000819194236	EH	On-Demand	Anodyne	ADRB3	100	49
O=C(Cc1ccc(-n2cnnc2)cc1)NNC(=O)N1CCOCC1	ZINC000819194253	EB	On-Demand	Reactive	KCNJ1	47	36
O=C(CCN[C@H]1CCCN(Cc2ccccc2)C1=O)Nc1cccc(F)c1	ZINC000819194254	FF	On-Demand	Anodyne	SIGMAR1	15	43
O=C(CCN[C@H]1CCCN(Cc2ccccc2)C1=O)Nc1cccc(F)c1	ZINC000819194254	FF	On-Demand	Anodyne	CCR3	54	37
O=C(CCN[C@@H]1CCCN(Cc2ccccc2)C1=O)Nc1cccc(F)c1	ZINC000819194255	FF	On-Demand	Anodyne	SIGMAR1	15	43
O=C(CCN[C@@H]1CCCN(Cc2ccccc2)C1=O)Nc1cccc(F)c1	ZINC000819194255	FF	On-Demand	Anodyne	CCR3	54	37
C[C@@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccc[nH]1	ZINC000819194263	CE	On-Demand	Mild	ADRB2	38	47
C[C@@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccc[nH]1	ZINC000819194263	CE	On-Demand	Mild	ADRB1	44	47
C[C@@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccc[nH]1	ZINC000819194263	CE	On-Demand	Mild	ADRB3	26	45
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccc[nH]1	ZINC000819194264	CE	On-Demand	Mild	ADRB2	38	47
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccc[nH]1	ZINC000819194264	CE	On-Demand	Mild	ADRB1	44	47
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccc[nH]1	ZINC000819194264	CE	On-Demand	Mild	ADRB3	26	45
C[C@@H](NC[C@@H](O)COc1ccc(C(C)(C)C)cc1)c1ccc[nH]1	ZINC000819194265	DG	On-Demand	Anodyne	ADRB2	38	48
C[C@@H](NC[C@@H](O)COc1ccc(C(C)(C)C)cc1)c1ccc[nH]1	ZINC000819194265	DG	On-Demand	Anodyne	ADRB1	42	45
C[C@H](NC[C@H](O)COc1ccc(C(C)(C)C)cc1)c1ccc[nH]1	ZINC000819194267	DG	On-Demand	Anodyne	ADRB2	38	48
C[C@H](NC[C@H](O)COc1ccc(C(C)(C)C)cc1)c1ccc[nH]1	ZINC000819194267	DG	On-Demand	Anodyne	ADRB1	42	45
C[C@@H](CNC[C@H](O)c1cccnc1)c1nc(-c2ccccc2)no1	ZINC000819194273	DF	On-Demand	Anodyne	ADRB2	23	48
C[C@@H](CNC[C@H](O)c1cccnc1)c1nc(-c2ccccc2)no1	ZINC000819194273	DF	On-Demand	Anodyne	ADRB1	24	47
C[C@@H](CNC[C@H](O)c1cccnc1)c1nc(-c2ccccc2)no1	ZINC000819194273	DF	On-Demand	Anodyne	ADRB3	97	49
C[C@H](CNC[C@H](O)c1cccnc1)c1nc(-c2ccccc2)no1	ZINC000819194274	DF	On-Demand	Anodyne	ADRB2	23	48
C[C@H](CNC[C@H](O)c1cccnc1)c1nc(-c2ccccc2)no1	ZINC000819194274	DF	On-Demand	Anodyne	ADRB1	24	47
C[C@H](CNC[C@H](O)c1cccnc1)c1nc(-c2ccccc2)no1	ZINC000819194274	DF	On-Demand	Anodyne	ADRB3	97	49
C[C@H](CNC[C@@H](O)c1cccnc1)c1nc(-c2ccccc2)no1	ZINC000819194275	DF	On-Demand	Anodyne	ADRB2	23	48
C[C@H](CNC[C@@H](O)c1cccnc1)c1nc(-c2ccccc2)no1	ZINC000819194275	DF	On-Demand	Anodyne	ADRB1	24	47
C[C@H](CNC[C@@H](O)c1cccnc1)c1nc(-c2ccccc2)no1	ZINC000819194275	DF	On-Demand	Anodyne	ADRB3	97	49
C[C@@H](CNC[C@@H](O)c1cccnc1)c1nc(-c2ccccc2)no1	ZINC000819194276	DF	On-Demand	Anodyne	ADRB2	23	48
C[C@@H](CNC[C@@H](O)c1cccnc1)c1nc(-c2ccccc2)no1	ZINC000819194276	DF	On-Demand	Anodyne	ADRB1	24	47
C[C@@H](CNC[C@@H](O)c1cccnc1)c1nc(-c2ccccc2)no1	ZINC000819194276	DF	On-Demand	Anodyne	ADRB3	97	49
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccc[nH]1	ZINC000819194280	FG	On-Demand	Anodyne	CTSD	87	47
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccc[nH]1	ZINC000819194280	FG	On-Demand	Anodyne	PGC	64	42
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccc[nH]1	ZINC000819194280	FG	On-Demand	Anodyne	PAPA1_CARPA	32	43
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccc[nH]1	ZINC000819194280	FG	On-Demand	Anodyne	CCKAR	41	35
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccc[nH]1	ZINC000819194280	FG	On-Demand	Anodyne	PGA	59	43
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccc[nH]1	ZINC000819194280	FG	On-Demand	Anodyne	BACE2	52	38
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccc[nH]1	ZINC000819194280	FG	On-Demand	Anodyne	REN	100	52
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccc[nH]1	ZINC000819194280	FG	On-Demand	Anodyne	REN1	38	49
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccc[nH]1	ZINC000819194280	FG	On-Demand	Anodyne	BACE1	65	44
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccc[nH]1	ZINC000819194280	FG	On-Demand	Anodyne	FPR1	53	42
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccc[nH]1	ZINC000819194280	FG	On-Demand	Anodyne	PLM1_PLAFA	35	41
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ccc[nH]1	ZINC000819194280	FG	On-Demand	Anodyne	Q82323_9DELA	49	30
COC[C@@H](O)CN[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194304	CC	On-Demand	Anodyne	ACE	37	42
COC[C@@H](O)CN[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819194306	CC	On-Demand	Anodyne	ACE	37	42
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(CN2CCCCCC2)cc1	ZINC000819194321	EG	On-Demand	Anodyne	HRH3	24	42
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(CN2CCCCCC2)cc1	ZINC000819194321	EG	On-Demand	Anodyne	SIGMAR1	17	44
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(CN2CCCCCC2)cc1	ZINC000819194322	EG	On-Demand	Anodyne	HRH3	24	42
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(CN2CCCCCC2)cc1	ZINC000819194322	EG	On-Demand	Anodyne	SIGMAR1	17	44
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(CN2CCCCCC2)cc1	ZINC000819194323	EG	On-Demand	Anodyne	HRH3	24	42
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(CN2CCCCCC2)cc1	ZINC000819194323	EG	On-Demand	Anodyne	SIGMAR1	17	44
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(CN2CCCCCC2)cc1	ZINC000819194324	EG	On-Demand	Anodyne	HRH3	24	42
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(CN2CCCCCC2)cc1	ZINC000819194324	EG	On-Demand	Anodyne	SIGMAR1	17	44
N#Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194346	GE	On-Demand	Mild	ADRB1	53	38
N#Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194346	GE	On-Demand	Mild	ADRB3	36	41
N#Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194347	GE	On-Demand	Mild	ADRB1	53	38
N#Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194347	GE	On-Demand	Mild	ADRB3	36	41
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194348	GE	On-Demand	Mild	ADRB1	53	38
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194348	GE	On-Demand	Mild	ADRB3	36	41
N#Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194349	GE	On-Demand	Mild	ADRB1	53	38
N#Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194349	GE	On-Demand	Mild	ADRB3	36	41
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(Cn2cnc3ccccc32)c1	ZINC000819194352	FG	On-Demand	Anodyne	NR1I2	42	37
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(Cn2cnc3ccccc32)c1	ZINC000819194353	FG	On-Demand	Anodyne	NR1I2	42	37
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(Cn2cnc3ccccc32)c1	ZINC000819194354	FG	On-Demand	Anodyne	NR1I2	42	37
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(Cn2cnc3ccccc32)c1	ZINC000819194355	FG	On-Demand	Anodyne	NR1I2	42	37
N#CCc1ccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194361	GE	On-Demand	Mild	ADRB1	63	38
N#CCc1ccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194361	GE	On-Demand	Mild	ADRB3	46	42
N#CCc1ccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194362	GE	On-Demand	Mild	ADRB1	63	38
N#CCc1ccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194362	GE	On-Demand	Mild	ADRB3	46	42
N#CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194364	GE	On-Demand	Mild	ADRB1	63	38
N#CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194364	GE	On-Demand	Mild	ADRB3	46	42
C[C@H](CNC[C@@H](O)c1cccc(C(F)(F)F)c1)c1nc(-c2ccccc2)no1	ZINC000819194365	GI	On-Demand	Anodyne	ADRB3	31	40
N#CCc1ccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194366	GE	On-Demand	Mild	ADRB1	63	38
N#CCc1ccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)cc1	ZINC000819194366	GE	On-Demand	Mild	ADRB3	46	42
C[C@H](CNC[C@H](O)c1cccc(C(F)(F)F)c1)c1nc(-c2ccccc2)no1	ZINC000819194367	GI	On-Demand	Anodyne	ADRB3	31	40
C[C@@H](CNC[C@H](O)c1cccc(C(F)(F)F)c1)c1nc(-c2ccccc2)no1	ZINC000819194369	GI	On-Demand	Anodyne	ADRB3	31	40
C[C@@H](CNC[C@@H](O)c1cccc(C(F)(F)F)c1)c1nc(-c2ccccc2)no1	ZINC000819194370	GI	On-Demand	Anodyne	ADRB3	31	40
O[C@@H](CNCCc1nc2c(s1)CCCC2)c1ccc(Cl)cc1	ZINC000819194376	EH	On-Demand	Anodyne	ADRB2	16	41
CC(=O)Nc1cccc(CC(=O)NNC(=O)N2CCOCC2)c1	ZINC000819194384	DC	On-Demand	Reactive	CASR	21	41
CC(=O)Nc1cccc(CC(=O)NNC(=O)N2CCOCC2)c1	ZINC000819194384	DC	On-Demand	Reactive	EPHX2	25	42
CC(=O)Nc1cccc(CC(=O)NNC(=O)N2CCOCC2)c1	ZINC000819194384	DC	On-Demand	Reactive	P2RY14	42	33
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2Cl)CCCN1c1ccccc1F	ZINC000819194389	GG	On-Demand	Anodyne	P2RX7	33	46
O[C@H](CN[C@H](c1cccnc1)C1CC1)c1cccnc1	ZINC000819194390	CE	On-Demand	Anodyne	ADRB2	21	40
O[C@H](CN[C@H](c1cccnc1)C1CC1)c1cccnc1	ZINC000819194390	CE	On-Demand	Anodyne	ADRB1	22	45
O[C@H](CN[C@H](c1cccnc1)C1CC1)c1cccnc1	ZINC000819194390	CE	On-Demand	Anodyne	ADRB3	85	48
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)CCCN1c1ccccc1F	ZINC000819194391	GG	On-Demand	Anodyne	P2RX7	33	46
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)CCCN1c1ccccc1F	ZINC000819194392	GG	On-Demand	Anodyne	P2RX7	33	46
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)CCCN1c1ccccc1F	ZINC000819194393	GG	On-Demand	Anodyne	P2RX7	33	46
O[C@@H](CN[C@H](c1cccnc1)C1CC1)c1cccnc1	ZINC000819194394	CE	On-Demand	Anodyne	ADRB2	21	40
O[C@@H](CN[C@H](c1cccnc1)C1CC1)c1cccnc1	ZINC000819194394	CE	On-Demand	Anodyne	ADRB1	22	45
O[C@@H](CN[C@H](c1cccnc1)C1CC1)c1cccnc1	ZINC000819194394	CE	On-Demand	Anodyne	ADRB3	85	48
O[C@H](CN[C@@H](c1cccnc1)C1CC1)c1cccnc1	ZINC000819194396	CE	On-Demand	Anodyne	ADRB2	21	40
O[C@H](CN[C@@H](c1cccnc1)C1CC1)c1cccnc1	ZINC000819194396	CE	On-Demand	Anodyne	ADRB1	22	45
O[C@H](CN[C@@H](c1cccnc1)C1CC1)c1cccnc1	ZINC000819194396	CE	On-Demand	Anodyne	ADRB3	85	48
O[C@@H](CN[C@@H](c1cccnc1)C1CC1)c1cccnc1	ZINC000819194397	CE	On-Demand	Anodyne	ADRB2	21	40
O[C@@H](CN[C@@H](c1cccnc1)C1CC1)c1cccnc1	ZINC000819194397	CE	On-Demand	Anodyne	ADRB1	22	45
O[C@@H](CN[C@@H](c1cccnc1)C1CC1)c1cccnc1	ZINC000819194397	CE	On-Demand	Anodyne	ADRB3	85	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(C(=O)c2ccncc2)CC1	ZINC000819194400	GD	On-Demand	Anodyne	EPHX2	23	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(C(=O)c2ccncc2)CC1	ZINC000819194400	GD	On-Demand	Anodyne	SFRP1	31	40
O[C@@H](CNCCc1nc2c(s1)CCCC2)c1cccc(F)c1	ZINC000819194431	DG	On-Demand	Anodyne	ADRB1	27	42
O[C@@H](CNCCc1nc2c(s1)CCCC2)c1cccc(F)c1	ZINC000819194431	DG	On-Demand	Anodyne	ADRB3	78	42
O[C@H](CNCCc1nc2c(s1)CCCC2)c1cccc(F)c1	ZINC000819194432	DG	On-Demand	Anodyne	ADRB1	27	42
O[C@H](CNCCc1nc2c(s1)CCCC2)c1cccc(F)c1	ZINC000819194432	DG	On-Demand	Anodyne	ADRB3	78	42
C[C@@H](NCCC(=O)Nc1ccccc1)c1ccc[nH]1	ZINC000819194442	CF	On-Demand	Anodyne	LTA4H	21	43
C[C@@H](NCCC(=O)Nc1ccccc1)c1ccc[nH]1	ZINC000819194442	CF	On-Demand	Anodyne	HDAC10	21	41
C[C@@H](NCCC(=O)Nc1ccccc1)c1ccc[nH]1	ZINC000819194442	CF	On-Demand	Anodyne	HDAC2	15	41
C[C@@H](NCCC(=O)Nc1ccccc1)c1ccc[nH]1	ZINC000819194442	CF	On-Demand	Anodyne	HDAC3	16	41
C[C@@H](NCCC(=O)Nc1ccccc1)c1ccc[nH]1	ZINC000819194442	CF	On-Demand	Anodyne	HDAC6	16	41
C[C@@H](NCCC(=O)Nc1ccccc1)c1ccc[nH]1	ZINC000819194442	CF	On-Demand	Anodyne	HDAC11	16	41
C[C@H](NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc[nH]1	ZINC000819194445	ED	On-Demand	Anodyne	ADRB2	19	40
C[C@H](NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc[nH]1	ZINC000819194445	ED	On-Demand	Anodyne	ADRB1	25	42
C[C@@H](NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc[nH]1	ZINC000819194447	ED	On-Demand	Anodyne	ADRB2	19	40
C[C@@H](NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccc[nH]1	ZINC000819194447	ED	On-Demand	Anodyne	ADRB1	25	42
Cc1cncc(CNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819194448	CG	On-Demand	Anodyne	P2RX7	18	40
Cc1cncc(CNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819194449	CG	On-Demand	Anodyne	P2RX7	18	40
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1)c1ccc[nH]1	ZINC000819194450	CF	On-Demand	Anodyne	ADRB2	40	49
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1)c1ccc[nH]1	ZINC000819194450	CF	On-Demand	Anodyne	ADRB1	46	46
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1)c1ccc[nH]1	ZINC000819194450	CF	On-Demand	Anodyne	ADRB3	20	43
C[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1)c1ccc[nH]1	ZINC000819194451	CF	On-Demand	Anodyne	ADRB2	40	49
C[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1)c1ccc[nH]1	ZINC000819194451	CF	On-Demand	Anodyne	ADRB1	46	46
C[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1)c1ccc[nH]1	ZINC000819194451	CF	On-Demand	Anodyne	ADRB3	20	43
C[C@H](NC[C@H](O)c1cccc(F)c1)c1ccc[nH]1	ZINC000819194458	BF	On-Demand	Anodyne	ADRB2	17	45
C[C@@H](NC[C@@H](O)c1cccc(F)c1)c1ccc[nH]1	ZINC000819194460	BF	On-Demand	Anodyne	ADRB2	17	45
C[C@@H](NCCC(=O)Nc1ccc(Cl)cc1)c1ccc[nH]1	ZINC000819194466	CG	On-Demand	Anodyne	IMDH_CRYPV	24	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2nc3c(s2)CCCC3)c1	ZINC000819194481	EF	On-Demand	Bother	ADRB3	74	36
O=C(NCc1ccc(C(=O)O)cc1)Nc1cnn(Cc2ccccn2)c1	ZINC000819194483	FE	On-Demand	Anodyne	RPS6KA3	19	49
O=C(NCc1ccc(C(=O)O)cc1)Nc1cnn(Cc2ccccn2)c1	ZINC000819194483	FE	On-Demand	Anodyne	PANC	57	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cnn(Cc2ccccn2)c1	ZINC000819194483	FE	On-Demand	Anodyne	NAMPT	55	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1cc(C(F)(F)F)cnc1O	ZINC000819194488	FF	On-Demand	Anodyne	TRPV1	22	49
O=C(NCc1ccc(C(=O)O)cc1)Nc1cc(C(F)(F)F)cnc1O	ZINC000819194488	FF	On-Demand	Anodyne	DDR2	19	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cc(C(F)(F)F)cnc1O	ZINC000819194488	FF	On-Demand	Anodyne	TRPM8	46	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(=O)n(Cc2ccccc2)c1	ZINC000819194489	GF	On-Demand	Anodyne	ACHE	15	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(=O)n(Cc2ccccc2)c1	ZINC000819194489	GF	On-Demand	Anodyne	SIGMAR1	15	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(=O)n(Cc2ccccc2)c1	ZINC000819194489	GF	On-Demand	Anodyne	F2R	43	35
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(=O)n(Cc2ccccc2)c1	ZINC000819194489	GF	On-Demand	Anodyne	EPHX2	15	48
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(=O)n(Cc2ccccc2)c1	ZINC000819194489	GF	On-Demand	Anodyne	NOD2	40	33
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(=O)n(Cc2ccccc2)c1	ZINC000819194489	GF	On-Demand	Anodyne	NAMPT	46	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(NC(=O)C2CC2)cc1	ZINC000819194490	FG	On-Demand	Anodyne	ROCK2	15	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(NC(=O)C2CC2)cc1	ZINC000819194490	FG	On-Demand	Anodyne	EPHX2	56	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(NC(=O)C2CC2)cc1	ZINC000819194490	FG	On-Demand	Anodyne	TPSAB1	17	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(NC(=O)C2CC2)cc1	ZINC000819194490	FG	On-Demand	Anodyne	NAMPT	54	47
O=C(NCc1nc(CNC(=O)N2CC[C@@H](C(=O)O)C2)cs1)c1ccccc1	ZINC000819194492	GD	On-Demand	Anodyne	SLC6A1	51	34
O=C(NCc1nc(CNC(=O)N2CC[C@@H](C(=O)O)C2)cs1)c1ccccc1	ZINC000819194492	GD	On-Demand	Anodyne	EPHX2	15	40
O=C(NCc1nc(CNC(=O)N2CC[C@H](C(=O)O)C2)cs1)c1ccccc1	ZINC000819194493	GD	On-Demand	Anodyne	SLC6A1	51	34
O=C(NCc1nc(CNC(=O)N2CC[C@H](C(=O)O)C2)cs1)c1ccccc1	ZINC000819194493	GD	On-Demand	Anodyne	EPHX2	15	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccnc1Br	ZINC000819194497	FF	On-Demand	Anodyne	PPIA	21	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccnc1Br	ZINC000819194497	FF	On-Demand	Anodyne	TRPV1	15	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccnc1Br	ZINC000819194497	FF	On-Demand	Anodyne	HDAC1	21	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccnc1Br	ZINC000819194497	FF	On-Demand	Anodyne	NAMPT	54	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCOC2=O)cc1	ZINC000819194498	FF	On-Demand	Anodyne	EPHX2	20	41
O=C(NCc1ccc(F)cc1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819194499	GF	On-Demand	Anodyne	CCR3	63	41
O=C(NCc1ccc(F)cc1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819194499	GF	On-Demand	Anodyne	SSTR3	19	41
O=C(NCc1ccc(F)cc1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819194499	GF	On-Demand	Anodyne	EPHX2	38	42
O=C(NCc1ccc(F)cc1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819194499	GF	On-Demand	Anodyne	CACNA1G	41	37
O=C(NCc1ccc(F)cc1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819194499	GF	On-Demand	Anodyne	GIPR	42	33
O=C(NCc1ccc(F)cc1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819194499	GF	On-Demand	Anodyne	NAMPT	41	39
O=C(NCc1ccc(F)cc1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819194500	GF	On-Demand	Anodyne	CCR3	63	41
O=C(NCc1ccc(F)cc1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819194500	GF	On-Demand	Anodyne	SSTR3	19	41
O=C(NCc1ccc(F)cc1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819194500	GF	On-Demand	Anodyne	EPHX2	38	42
O=C(NCc1ccc(F)cc1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819194500	GF	On-Demand	Anodyne	CACNA1G	41	37
O=C(NCc1ccc(F)cc1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819194500	GF	On-Demand	Anodyne	GIPR	42	33
O=C(NCc1ccc(F)cc1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819194500	GF	On-Demand	Anodyne	NAMPT	41	39
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CCN2CCOCC2)cc1	ZINC000819194501	GF	On-Demand	Anodyne	PTGER4	41	31
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CCN2CCOCC2)cc1	ZINC000819194501	GF	On-Demand	Anodyne	PIK3CA	39	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CCN2CCOCC2)cc1	ZINC000819194501	GF	On-Demand	Anodyne	MTOR	98	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CCN2CCOCC2)cc1	ZINC000819194501	GF	On-Demand	Anodyne	EPHX2	49	56
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CCN2CCOCC2)cc1	ZINC000819194501	GF	On-Demand	Anodyne	PIK3CG	35	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CCN2CCOCC2)cc1	ZINC000819194501	GF	On-Demand	Anodyne	FLT3	17	49
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CCN2CCOCC2)cc1	ZINC000819194501	GF	On-Demand	Anodyne	AURKA	15	49
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CCN2CCOCC2)cc1	ZINC000819194501	GF	On-Demand	Anodyne	NAMPT	52	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccnc(Oc2ccccc2)c1	ZINC000819194502	GH	On-Demand	Anodyne	MMP13	16	46
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccnc(Oc2ccccc2)c1	ZINC000819194502	GH	On-Demand	Anodyne	NAMPT	31	42
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccnc(Oc2ccccc2)c1	ZINC000819194502	GH	On-Demand	Anodyne	PDS	51	35
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(OCc2ccccn2)c1	ZINC000819194503	GG	On-Demand	Anodyne	HRH2	20	45
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(OCc2ccccn2)c1	ZINC000819194503	GG	On-Demand	Anodyne	CYSLTR1	43	49
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(OCc2ccccn2)c1	ZINC000819194503	GG	On-Demand	Anodyne	PPIA	30	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(OCc2ccccn2)c1	ZINC000819194503	GG	On-Demand	Anodyne	GRIN2B	15	47
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(OCc2ccccn2)c1	ZINC000819194503	GG	On-Demand	Anodyne	UL80	22	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(OCc2ccccn2)c1	ZINC000819194503	GG	On-Demand	Anodyne	SMO	19	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(OCc2ccccn2)c1	ZINC000819194503	GG	On-Demand	Anodyne	NAMPT	26	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(OCc2ccccn2)c1	ZINC000819194503	GG	On-Demand	Anodyne	PDS	67	40
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819194504	FE	On-Demand	Reactive	EPHX2	44	50
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819194507	FG	On-Demand	Anodyne	AVPR2	17	47
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819194507	FG	On-Demand	Anodyne	KCNQ2	52	37
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819194507	FG	On-Demand	Anodyne	NPY2R	109	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819194507	FG	On-Demand	Anodyne	CCR3	44	35
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819194507	FG	On-Demand	Anodyne	F2R	40	31
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819194507	FG	On-Demand	Anodyne	TAAR1	28	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819194507	FG	On-Demand	Anodyne	PRMT3	54	36
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819194507	FG	On-Demand	Anodyne	NAMPT	45	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(O)c1	ZINC000819194510	DE	On-Demand	Anodyne	RARA	42	34
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(O)c1	ZINC000819194510	DE	On-Demand	Anodyne	ROCK2	18	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(O)c1	ZINC000819194510	DE	On-Demand	Anodyne	HSD17B1	15	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(O)c1	ZINC000819194510	DE	On-Demand	Anodyne	PKN1	15	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(O)c1	ZINC000819194510	DE	On-Demand	Anodyne	IKBKE	15	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(O)c1	ZINC000819194510	DE	On-Demand	Anodyne	HSD17B2	29	41
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(O)c1	ZINC000819194510	DE	On-Demand	Anodyne	PAK1	15	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(O)c1	ZINC000819194510	DE	On-Demand	Anodyne	DMPK	15	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(O)c1	ZINC000819194510	DE	On-Demand	Anodyne	PDS	50	34
O=C(NCc1ccc(C(=O)O)cc1)NCc1coc(-c2ccccc2)n1	ZINC000819194511	FG	On-Demand	Anodyne	RPA1	41	32
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCCS2(=O)=O)cc1	ZINC000819194514	GE	On-Demand	Anodyne	CDK1	17	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCCS2(=O)=O)cc1	ZINC000819194514	GE	On-Demand	Anodyne	NAMPT	41	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1Cn1cccn1	ZINC000819194516	FF	On-Demand	Anodyne	NAMPT	34	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(Cn2cncn2)c1	ZINC000819194519	FE	On-Demand	Anodyne	CYP19A1	24	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(Cn2cncn2)c1	ZINC000819194519	FE	On-Demand	Anodyne	ROCK2	18	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(Cn2cncn2)c1	ZINC000819194519	FE	On-Demand	Anodyne	NAMPT	43	40
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccccc1Br	ZINC000819194520	GE	On-Demand	Reactive	ECR	28	42
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)C(=O)Nc1ccccn1	ZINC000819194521	FC	On-Demand	Reactive	PPIA	36	42
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)C(=O)Nc1ccccn1	ZINC000819194521	FC	On-Demand	Reactive	AKR1B10	25	40
O=C(NCc1ccc(F)cc1)c1nnc(CN2CC[C@@H](C(=O)O)C2)s1	ZINC000819194524	FD	On-Demand	Anodyne	SLC6A1	80	34
O=C(NCc1ccc(F)cc1)c1nnc(CN2CC[C@@H](C(=O)O)C2)s1	ZINC000819194524	FD	On-Demand	Anodyne	CCR3	65	39
O=C(NCc1ccc(F)cc1)c1nnc(CN2CC[C@@H](C(=O)O)C2)s1	ZINC000819194524	FD	On-Demand	Anodyne	S1PR1	20	43
O=C(NCc1ccc(F)cc1)c1nnc(CN2CC[C@@H](C(=O)O)C2)s1	ZINC000819194524	FD	On-Demand	Anodyne	S1PR5	22	41
O=C(NCc1ccc(F)cc1)c1nnc(CN2CC[C@@H](C(=O)O)C2)s1	ZINC000819194524	FD	On-Demand	Anodyne	CACNA1G	42	38
O=C(NCc1ccc(F)cc1)c1nnc(CN2CC[C@H](C(=O)O)C2)s1	ZINC000819194525	FD	On-Demand	Anodyne	SLC6A1	80	34
O=C(NCc1ccc(F)cc1)c1nnc(CN2CC[C@H](C(=O)O)C2)s1	ZINC000819194525	FD	On-Demand	Anodyne	CCR3	65	39
O=C(NCc1ccc(F)cc1)c1nnc(CN2CC[C@H](C(=O)O)C2)s1	ZINC000819194525	FD	On-Demand	Anodyne	S1PR1	20	43
O=C(NCc1ccc(F)cc1)c1nnc(CN2CC[C@H](C(=O)O)C2)s1	ZINC000819194525	FD	On-Demand	Anodyne	S1PR5	22	41
O=C(NCc1ccc(F)cc1)c1nnc(CN2CC[C@H](C(=O)O)C2)s1	ZINC000819194525	FD	On-Demand	Anodyne	CACNA1G	42	38
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-c2nccs2)cc1	ZINC000819194526	FH	On-Demand	Anodyne	PPIA	18	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-c2nccs2)cc1	ZINC000819194526	FH	On-Demand	Anodyne	LTA4H	25	48
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-c2nccs2)cc1	ZINC000819194526	FH	On-Demand	Anodyne	ROCK2	23	52
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-c2nccs2)cc1	ZINC000819194526	FH	On-Demand	Anodyne	HDAC2	16	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-c2nccs2)cc1	ZINC000819194526	FH	On-Demand	Anodyne	NAMPT	48	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2cccn2)c(F)c1	ZINC000819194529	FG	On-Demand	Anodyne	NPY2R	53	35
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2cccn2)c(F)c1	ZINC000819194529	FG	On-Demand	Anodyne	CCR3	28	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2cccn2)c(F)c1	ZINC000819194529	FG	On-Demand	Anodyne	F2R	49	30
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2cccn2)c(F)c1	ZINC000819194529	FG	On-Demand	Anodyne	ROCK2	18	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2cccn2)c(F)c1	ZINC000819194529	FG	On-Demand	Anodyne	PRMT3	41	36
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2cccn2)c(F)c1	ZINC000819194529	FG	On-Demand	Anodyne	NAMPT	51	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(S(=O)(=O)NC2CC2)c1	ZINC000819194530	GE	On-Demand	Anodyne	F2	15	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(S(=O)(=O)NC2CC2)c1	ZINC000819194530	GE	On-Demand	Anodyne	KCNA5	28	47
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(S(=O)(=O)NC2CC2)c1	ZINC000819194530	GE	On-Demand	Anodyne	CCR3	45	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(S(=O)(=O)NC2CC2)c1	ZINC000819194530	GE	On-Demand	Anodyne	ST14	78	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(S(=O)(=O)NC2CC2)c1	ZINC000819194530	GE	On-Demand	Anodyne	CCR8	41	36
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(S(=O)(=O)NC2CC2)c1	ZINC000819194530	GE	On-Demand	Anodyne	SFRP1	121	38
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(S(=O)(=O)NC2CC2)c1	ZINC000819194530	GE	On-Demand	Anodyne	WNT3	78	33
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(S(=O)(=O)NC2CC2)c1	ZINC000819194530	GE	On-Demand	Anodyne	NAMPT	81	49
O=C(NCc1ccc(C(=O)O)cc1)NCc1cn(-c2ccccc2)nn1	ZINC000819194531	FD	On-Demand	Anodyne	TMPRSS11D	40	32
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(N2CCCC2=O)c1	ZINC000819194532	FF	On-Demand	Anodyne	NAMPT	26	40
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194537	EF	On-Demand	Anodyne	SLC6A3	36	44
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194537	EF	On-Demand	Anodyne	SIGMAR1	21	50
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194538	EF	On-Demand	Anodyne	SLC6A3	36	44
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194538	EF	On-Demand	Anodyne	SIGMAR1	21	50
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194539	EF	On-Demand	Anodyne	SLC6A3	36	44
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194539	EF	On-Demand	Anodyne	SIGMAR1	21	50
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194540	EF	On-Demand	Anodyne	SLC6A3	36	44
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194540	EF	On-Demand	Anodyne	SIGMAR1	21	50
O=[N+]([O-])c1cccc([C@H](O)CNCCc2nc3c(s2)CCCC3)c1	ZINC000819194546	EF	On-Demand	Bother	ADRB3	74	36
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccnc(OCc2ccccc2)c1	ZINC000819194549	GG	On-Demand	Anodyne	PPIA	41	45
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccnc(OCc2ccccc2)c1	ZINC000819194549	GG	On-Demand	Anodyne	GRIN2B	15	42
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccnc(OCc2ccccc2)c1	ZINC000819194549	GG	On-Demand	Anodyne	PTGER1	45	42
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccnc(OCc2ccccc2)c1	ZINC000819194549	GG	On-Demand	Anodyne	NAMPT	28	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccnc(OCc2ccccc2)c1	ZINC000819194549	GG	On-Demand	Anodyne	PDS	51	33
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1-n1ccnc1	ZINC000819194552	FF	On-Demand	Anodyne	TBXAS1	25	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1-n1ccnc1	ZINC000819194552	FF	On-Demand	Anodyne	NOS2	101	37
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1-n1ccnc1	ZINC000819194552	FF	On-Demand	Anodyne	NAMPT	36	44
C[C@H](NC[C@H](O)COc1ccccc1Cl)c1ccc[nH]1	ZINC000819194554	CF	On-Demand	Anodyne	ADRB2	36	52
C[C@H](NC[C@H](O)COc1ccccc1Cl)c1ccc[nH]1	ZINC000819194554	CF	On-Demand	Anodyne	ADRB1	36	47
O=C(NCc1ccc(C(=O)O)cc1)NNc1ncccn1	ZINC000819194556	CD	On-Demand	Reactive	PPIA	32	43
C[C@@H](NC[C@@H](O)COc1ccccc1Cl)c1ccc[nH]1	ZINC000819194557	CF	On-Demand	Anodyne	ADRB2	36	52
C[C@@H](NC[C@@H](O)COc1ccccc1Cl)c1ccc[nH]1	ZINC000819194557	CF	On-Demand	Anodyne	ADRB1	36	47
O=C1[C@@H](NC[C@H](O)c2cccc3ccccc23)CCCN1Cc1ccccc1	ZINC000819194558	FH	On-Demand	Anodyne	DRD4	15	40
O=C1[C@@H](NC[C@H](O)c2cccc3ccccc23)CCCN1Cc1ccccc1	ZINC000819194558	FH	On-Demand	Anodyne	SIGMAR1	19	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCCF)c1	ZINC000819194559	EG	On-Demand	Anodyne	ADRB1	26	48
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCCF)c1	ZINC000819194559	EG	On-Demand	Anodyne	HRH2	38	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCCF)c1	ZINC000819194559	EG	On-Demand	Anodyne	LTA4H	22	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCCF)c1	ZINC000819194559	EG	On-Demand	Anodyne	UL80	29	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCCF)c1	ZINC000819194559	EG	On-Demand	Anodyne	CCR3	38	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCCF)c1	ZINC000819194559	EG	On-Demand	Anodyne	ROCK2	26	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCCF)c1	ZINC000819194559	EG	On-Demand	Anodyne	PLA2G4B	49	34
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCCF)c1	ZINC000819194559	EG	On-Demand	Anodyne	EPHX2	37	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCCF)c1	ZINC000819194559	EG	On-Demand	Anodyne	PDS	64	43
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)c1nc(-c2ccccc2)no1	ZINC000819194560	FH	On-Demand	Anodyne	ADRB1	38	44
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)c1nc(-c2ccccc2)no1	ZINC000819194560	FH	On-Demand	Anodyne	ADRB3	72	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccnc1-n1cccn1	ZINC000819194561	FD	On-Demand	Anodyne	AMP1_PLAFQ	41	32
O=C1[C@H](NC[C@H](O)c2cccc3ccccc23)CCCN1Cc1ccccc1	ZINC000819194562	FH	On-Demand	Anodyne	DRD4	15	40
O=C1[C@H](NC[C@H](O)c2cccc3ccccc23)CCCN1Cc1ccccc1	ZINC000819194562	FH	On-Demand	Anodyne	SIGMAR1	19	46
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)c1nc(-c2ccccc2)no1	ZINC000819194563	FH	On-Demand	Anodyne	ADRB1	38	44
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)c1nc(-c2ccccc2)no1	ZINC000819194563	FH	On-Demand	Anodyne	ADRB3	72	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc2oc(C3CC3)nc2c1	ZINC000819194564	FH	On-Demand	Anodyne	PRMT3	62	36
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc2oc(C3CC3)nc2c1	ZINC000819194564	FH	On-Demand	Anodyne	NAMPT	40	35
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)c1nc(-c2ccccc2)no1	ZINC000819194566	FH	On-Demand	Anodyne	ADRB1	38	44
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)c1nc(-c2ccccc2)no1	ZINC000819194566	FH	On-Demand	Anodyne	ADRB3	72	44
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)c1nc(-c2ccccc2)no1	ZINC000819194569	FH	On-Demand	Anodyne	ADRB1	38	44
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)c1nc(-c2ccccc2)no1	ZINC000819194569	FH	On-Demand	Anodyne	ADRB3	72	44
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)C1CCCC1	ZINC000819194570	DD	On-Demand	Reactive	EPHX2	15	41
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)C1CCCC1	ZINC000819194570	DD	On-Demand	Reactive	PROC	45	35
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)C1CCCC1	ZINC000819194570	DD	On-Demand	Reactive	TMPRSS11D	51	32
C[C@@H](NC[C@@H](O)COc1ccccc1)c1ccc[nH]1	ZINC000819194572	CE	On-Demand	Anodyne	ADRB2	56	63
C[C@@H](NC[C@@H](O)COc1ccccc1)c1ccc[nH]1	ZINC000819194572	CE	On-Demand	Anodyne	ADRB1	58	47
C[C@@H](NC[C@@H](O)COc1ccccc1)c1ccc[nH]1	ZINC000819194572	CE	On-Demand	Anodyne	ADRB3	32	45
O=C(NCc1ccc(C(=O)O)cc1)NCc1nccn1CCc1ccccc1	ZINC000819194573	GF	On-Demand	Anodyne	NAMPT	30	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(NC(=O)c2ccco2)cc1	ZINC000819194576	GH	On-Demand	Anodyne	PPIA	15	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(NC(=O)c2ccco2)cc1	ZINC000819194576	GH	On-Demand	Anodyne	LTA4H	19	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(NC(=O)c2ccco2)cc1	ZINC000819194576	GH	On-Demand	Anodyne	ROCK2	19	48
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(NC(=O)c2ccco2)cc1	ZINC000819194576	GH	On-Demand	Anodyne	EPHX2	16	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(NC(=O)c2ccco2)cc1	ZINC000819194576	GH	On-Demand	Anodyne	NAMPT	53	46
C[C@H](NC[C@H](O)COc1ccccc1)c1ccc[nH]1	ZINC000819194578	CE	On-Demand	Anodyne	ADRB2	56	63
C[C@H](NC[C@H](O)COc1ccccc1)c1ccc[nH]1	ZINC000819194578	CE	On-Demand	Anodyne	ADRB1	58	47
C[C@H](NC[C@H](O)COc1ccccc1)c1ccc[nH]1	ZINC000819194578	CE	On-Demand	Anodyne	ADRB3	32	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccccc1CC(F)(F)F	ZINC000819194579	FH	On-Demand	Anodyne	KCNJ11	74	35
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccccc1CC(F)(F)F	ZINC000819194579	FH	On-Demand	Anodyne	TRPV1	15	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccccc1CC(F)(F)F	ZINC000819194579	FH	On-Demand	Anodyne	HDAC1	16	47
C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccc[nH]1	ZINC000819194580	CE	On-Demand	Bother	CACNA1D	42	34
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cccc(Br)c1	ZINC000819194581	GE	On-Demand	Reactive	UL80	29	43
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cccc(Br)c1	ZINC000819194581	GE	On-Demand	Reactive	AKR1C3	26	40
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cccc(Br)c1	ZINC000819194581	GE	On-Demand	Reactive	PDS	50	40
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819194584	FD	On-Demand	Reactive	MMP2	15	46
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819194584	FD	On-Demand	Reactive	MMP8	30	46
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819194584	FD	On-Demand	Reactive	MMP9	16	46
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819194584	FD	On-Demand	Reactive	GSR	15	42
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819194584	FD	On-Demand	Reactive	MMP1	22	46
C[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccc[nH]1	ZINC000819194585	CE	On-Demand	Bother	CACNA1D	42	34
O=C(NNC(=O)N1CCO[C@@H](C(=O)O)C1)c1ccc(-n2cnnn2)cc1	ZINC000819194589	FA	On-Demand	Reactive	KCNJ1	48	36
CCOC(=O)C1CCC(O)(CN[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000819194594	GE	On-Demand	Anodyne	ACE	32	41
CCOC(=O)C1CCC(O)(CN[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000819194594	GE	On-Demand	Anodyne	FKBP1A	33	40
CCOC(=O)C1CCC(O)(CN[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000819194594	GE	On-Demand	Anodyne	TIMP3	43	32
O=C(NNC(=O)N1CCO[C@H](C(=O)O)C1)c1ccc(-n2cnnn2)cc1	ZINC000819194595	FA	On-Demand	Reactive	KCNJ1	48	36
O=C(NCc1ccc(OCc2ccccn2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819194598	GG	On-Demand	Anodyne	CYSLTR1	35	47
O=C(NCc1ccc(OCc2ccccn2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819194598	GG	On-Demand	Anodyne	PPIA	25	41
O=C(NCc1ccc(OCc2ccccn2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819194598	GG	On-Demand	Anodyne	LTA4H	42	38
O=C(NCc1ccc(OCc2ccccn2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819194598	GG	On-Demand	Anodyne	MMP13	15	40
O=C(NCc1ccc(OCc2ccccn2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819194598	GG	On-Demand	Anodyne	ADAM17	42	38
O=C(NCc1ccc(OCc2ccccn2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819194598	GG	On-Demand	Anodyne	PLA2G4B	49	40
O=C(NCc1ccc(OCc2ccccn2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819194598	GG	On-Demand	Anodyne	SMO	23	45
O=C(NCc1ccc(OCc2ccccn2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819194598	GG	On-Demand	Anodyne	PDS	44	35
CCOC(=O)C1CCC(O)(CN[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000819194599	GE	On-Demand	Anodyne	ACE	32	41
CCOC(=O)C1CCC(O)(CN[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000819194599	GE	On-Demand	Anodyne	FKBP1A	33	40
CCOC(=O)C1CCC(O)(CN[C@H]2CCCN(Cc3ccccc3)C2=O)CC1	ZINC000819194599	GE	On-Demand	Anodyne	TIMP3	43	32
O=C1[C@@H](NC[C@H](O)COc2ccccc2F)CCCN1Cc1ccccc1	ZINC000819194607	FE	On-Demand	Anodyne	ADRB2	27	43
O=C1[C@@H](NC[C@H](O)COc2ccccc2F)CCCN1Cc1ccccc1	ZINC000819194607	FE	On-Demand	Anodyne	ADRB3	19	43
O=C1[C@@H](NC[C@H](O)COc2ccccc2F)CCCN1Cc1ccccc1	ZINC000819194607	FE	On-Demand	Anodyne	ABCB1	42	43
O=C1[C@H](NC[C@@H](O)COc2ccccc2F)CCCN1Cc1ccccc1	ZINC000819194610	FE	On-Demand	Anodyne	ADRB2	27	43
O=C1[C@H](NC[C@@H](O)COc2ccccc2F)CCCN1Cc1ccccc1	ZINC000819194610	FE	On-Demand	Anodyne	ADRB3	19	43
O=C1[C@H](NC[C@@H](O)COc2ccccc2F)CCCN1Cc1ccccc1	ZINC000819194610	FE	On-Demand	Anodyne	ABCB1	42	43
C[C@H](NC[C@H](O)COc1cccc(Br)c1)c1ccc[nH]1	ZINC000819194611	EF	On-Demand	Anodyne	ADRB2	28	50
C[C@H](NC[C@H](O)COc1cccc(Br)c1)c1ccc[nH]1	ZINC000819194611	EF	On-Demand	Anodyne	ADRB1	31	50
C[C@@H](NC[C@@H](O)COc1cccc(Br)c1)c1ccc[nH]1	ZINC000819194613	EF	On-Demand	Anodyne	ADRB2	28	50
C[C@@H](NC[C@@H](O)COc1cccc(Br)c1)c1ccc[nH]1	ZINC000819194613	EF	On-Demand	Anodyne	ADRB1	31	50
O=C1[C@@H](NC[C@@H](O)COc2ccccc2F)CCCN1Cc1ccccc1	ZINC000819194614	FE	On-Demand	Anodyne	ADRB2	27	43
O=C1[C@@H](NC[C@@H](O)COc2ccccc2F)CCCN1Cc1ccccc1	ZINC000819194614	FE	On-Demand	Anodyne	ADRB3	19	43
O=C1[C@@H](NC[C@@H](O)COc2ccccc2F)CCCN1Cc1ccccc1	ZINC000819194614	FE	On-Demand	Anodyne	ABCB1	42	43
O=C1[C@H](NC[C@H](O)COc2ccccc2F)CCCN1Cc1ccccc1	ZINC000819194616	FE	On-Demand	Anodyne	ADRB2	27	43
O=C1[C@H](NC[C@H](O)COc2ccccc2F)CCCN1Cc1ccccc1	ZINC000819194616	FE	On-Demand	Anodyne	ADRB3	19	43
O=C1[C@H](NC[C@H](O)COc2ccccc2F)CCCN1Cc1ccccc1	ZINC000819194616	FE	On-Demand	Anodyne	ABCB1	42	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccccc1CN1CCOCC1	ZINC000819194641	FF	On-Demand	Anodyne	CCR3	23	47
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccccc1CN1CCOCC1	ZINC000819194641	FF	On-Demand	Anodyne	HDAC1	17	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccccc1CN1CCOCC1	ZINC000819194641	FF	On-Demand	Anodyne	EPHX2	23	44
O=C1[C@H](NC[C@H](O)c2ccc(Cl)cc2)CCCN1Cc1ccccc1	ZINC000819194642	FG	On-Demand	Anodyne	ACE	29	40
O=C1[C@H](NC[C@H](O)c2ccc(Cl)cc2)CCCN1Cc1ccccc1	ZINC000819194642	FG	On-Demand	Anodyne	SLC6A3	16	41
O=C1[C@H](NC[C@H](O)c2ccc(Cl)cc2)CCCN1Cc1ccccc1	ZINC000819194642	FG	On-Demand	Anodyne	ADRB3	27	41
O=C1[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CCCN1Cc1ccccc1	ZINC000819194643	FG	On-Demand	Anodyne	ACE	29	40
O=C1[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CCCN1Cc1ccccc1	ZINC000819194643	FG	On-Demand	Anodyne	SLC6A3	16	41
O=C1[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CCCN1Cc1ccccc1	ZINC000819194643	FG	On-Demand	Anodyne	ADRB3	27	41
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1OCC(F)(F)F	ZINC000819194646	GG	On-Demand	Anodyne	UL80	24	41
COc1ccc(OC)c([C@H](O)CNCCc2nc3c(s2)CCCC3)c1	ZINC000819194649	FF	On-Demand	Anodyne	ADRB2	22	47
COc1ccc(OC)c([C@H](O)CNCCc2nc3c(s2)CCCC3)c1	ZINC000819194649	FF	On-Demand	Anodyne	ADRB1	19	42
O=C1[C@H](NC[C@@H](O)C(F)(F)F)CCCN1Cc1ccccc1	ZINC000819194650	DD	On-Demand	Anodyne	ACE	33	41
O=C1[C@H](NC[C@@H](O)C(F)(F)F)CCCN1Cc1ccccc1	ZINC000819194650	DD	On-Demand	Anodyne	MME	19	41
O=C1[C@H](NC[C@H](O)C(F)(F)F)CCCN1Cc1ccccc1	ZINC000819194652	DD	On-Demand	Anodyne	ACE	33	41
O=C1[C@H](NC[C@H](O)C(F)(F)F)CCCN1Cc1ccccc1	ZINC000819194652	DD	On-Demand	Anodyne	MME	19	41
O=C1[C@@H](NC[C@@H](O)C(F)(F)F)CCCN1Cc1ccccc1	ZINC000819194653	DD	On-Demand	Anodyne	ACE	33	41
O=C1[C@@H](NC[C@@H](O)C(F)(F)F)CCCN1Cc1ccccc1	ZINC000819194653	DD	On-Demand	Anodyne	MME	19	41
O=C1[C@@H](NC[C@H](O)C(F)(F)F)CCCN1Cc1ccccc1	ZINC000819194654	DD	On-Demand	Anodyne	ACE	33	41
O=C1[C@@H](NC[C@H](O)C(F)(F)F)CCCN1Cc1ccccc1	ZINC000819194654	DD	On-Demand	Anodyne	MME	19	41
O=C(NCc1ccco1)c1cccc(CN2CC[C@H](C(=O)O)C2)c1	ZINC000819194662	EE	On-Demand	Anodyne	DRD2	15	47
O=C(NCc1ccco1)c1cccc(CN2CC[C@H](C(=O)O)C2)c1	ZINC000819194662	EE	On-Demand	Anodyne	DRD4	40	31
O=C(NCc1ccco1)c1cccc(CN2CC[C@H](C(=O)O)C2)c1	ZINC000819194662	EE	On-Demand	Anodyne	ACHE	18	43
O=C(NCc1ccco1)c1cccc(CN2CC[C@H](C(=O)O)C2)c1	ZINC000819194662	EE	On-Demand	Anodyne	HRH2	15	50
O=C(NCc1ccco1)c1cccc(CN2CC[C@H](C(=O)O)C2)c1	ZINC000819194662	EE	On-Demand	Anodyne	SLC6A1	104	37
O=C(NCc1ccco1)c1cccc(CN2CC[C@H](C(=O)O)C2)c1	ZINC000819194662	EE	On-Demand	Anodyne	CHRM3	23	43
O=C(NCc1ccco1)c1cccc(CN2CC[C@H](C(=O)O)C2)c1	ZINC000819194662	EE	On-Demand	Anodyne	SIGMAR1	23	42
O=C(NCc1ccco1)c1cccc(CN2CC[C@H](C(=O)O)C2)c1	ZINC000819194662	EE	On-Demand	Anodyne	CCR2	24	43
O=C(NCc1ccco1)c1cccc(CN2CC[C@H](C(=O)O)C2)c1	ZINC000819194662	EE	On-Demand	Anodyne	S1PR1	27	41
O=C(NCc1ccco1)c1cccc(CN2CC[C@H](C(=O)O)C2)c1	ZINC000819194662	EE	On-Demand	Anodyne	S1PR5	37	41
O=C(NCc1ccco1)c1cccc(CN2CC[C@H](C(=O)O)C2)c1	ZINC000819194662	EE	On-Demand	Anodyne	MCHR1	17	40
O=C(NCc1ccco1)c1cccc(CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819194664	EE	On-Demand	Anodyne	DRD2	15	47
O=C(NCc1ccco1)c1cccc(CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819194664	EE	On-Demand	Anodyne	DRD4	40	31
O=C(NCc1ccco1)c1cccc(CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819194664	EE	On-Demand	Anodyne	ACHE	18	43
O=C(NCc1ccco1)c1cccc(CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819194664	EE	On-Demand	Anodyne	HRH2	15	50
O=C(NCc1ccco1)c1cccc(CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819194664	EE	On-Demand	Anodyne	SLC6A1	104	37
O=C(NCc1ccco1)c1cccc(CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819194664	EE	On-Demand	Anodyne	CHRM3	23	43
O=C(NCc1ccco1)c1cccc(CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819194664	EE	On-Demand	Anodyne	SIGMAR1	23	42
O=C(NCc1ccco1)c1cccc(CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819194664	EE	On-Demand	Anodyne	CCR2	24	43
O=C(NCc1ccco1)c1cccc(CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819194664	EE	On-Demand	Anodyne	S1PR1	27	41
O=C(NCc1ccco1)c1cccc(CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819194664	EE	On-Demand	Anodyne	S1PR5	37	41
O=C(NCc1ccco1)c1cccc(CN2CC[C@@H](C(=O)O)C2)c1	ZINC000819194664	EE	On-Demand	Anodyne	MCHR1	17	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-c2csnn2)cc1	ZINC000819194671	FG	On-Demand	Anodyne	ROCK2	24	51
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-c2csnn2)cc1	ZINC000819194671	FG	On-Demand	Anodyne	PRMT3	50	39
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-c2csnn2)cc1	ZINC000819194671	FG	On-Demand	Anodyne	NAMPT	38	41
O=C1[C@H](NC[C@H](O)COc2ccccc2)CCCN1Cc1ccccc1	ZINC000819194677	FE	On-Demand	Anodyne	ADRB2	45	43
O=C1[C@H](NC[C@H](O)COc2ccccc2)CCCN1Cc1ccccc1	ZINC000819194677	FE	On-Demand	Anodyne	ADRB1	68	43
O=C1[C@H](NC[C@H](O)COc2ccccc2)CCCN1Cc1ccccc1	ZINC000819194677	FE	On-Demand	Anodyne	ADRB3	50	44
O=C1[C@H](NC[C@H](O)COc2ccccc2)CCCN1Cc1ccccc1	ZINC000819194677	FE	On-Demand	Anodyne	ABCB1	34	40
O=C1[C@@H](NC[C@H](O)COc2ccccc2)CCCN1Cc1ccccc1	ZINC000819194679	FE	On-Demand	Anodyne	ADRB2	45	43
O=C1[C@@H](NC[C@H](O)COc2ccccc2)CCCN1Cc1ccccc1	ZINC000819194679	FE	On-Demand	Anodyne	ADRB1	68	43
O=C1[C@@H](NC[C@H](O)COc2ccccc2)CCCN1Cc1ccccc1	ZINC000819194679	FE	On-Demand	Anodyne	ADRB3	50	44
O=C1[C@@H](NC[C@H](O)COc2ccccc2)CCCN1Cc1ccccc1	ZINC000819194679	FE	On-Demand	Anodyne	ABCB1	34	40
O=C1[C@@H](NC[C@@H](O)COc2ccccc2)CCCN1Cc1ccccc1	ZINC000819194680	FE	On-Demand	Anodyne	ADRB2	45	43
O=C1[C@@H](NC[C@@H](O)COc2ccccc2)CCCN1Cc1ccccc1	ZINC000819194680	FE	On-Demand	Anodyne	ADRB1	68	43
O=C1[C@@H](NC[C@@H](O)COc2ccccc2)CCCN1Cc1ccccc1	ZINC000819194680	FE	On-Demand	Anodyne	ADRB3	50	44
O=C1[C@@H](NC[C@@H](O)COc2ccccc2)CCCN1Cc1ccccc1	ZINC000819194680	FE	On-Demand	Anodyne	ABCB1	34	40
O=C1[C@H](NC[C@@H](O)COc2ccccc2)CCCN1Cc1ccccc1	ZINC000819194681	FE	On-Demand	Anodyne	ADRB2	45	43
O=C1[C@H](NC[C@@H](O)COc2ccccc2)CCCN1Cc1ccccc1	ZINC000819194681	FE	On-Demand	Anodyne	ADRB1	68	43
O=C1[C@H](NC[C@@H](O)COc2ccccc2)CCCN1Cc1ccccc1	ZINC000819194681	FE	On-Demand	Anodyne	ADRB3	50	44
O=C1[C@H](NC[C@@H](O)COc2ccccc2)CCCN1Cc1ccccc1	ZINC000819194681	FE	On-Demand	Anodyne	ABCB1	34	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000819194689	EG	On-Demand	Bother	PRMT3	17	44
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc[nH]1	ZINC000819194697	EF	On-Demand	Anodyne	GPR119	46	49
O=C(NCc1ccc(C(=O)O)cc1)NCc1nncn1-c1ccccc1	ZINC000819194700	FD	On-Demand	Anodyne	NAMPT	24	43
O=C(NCc1ccc(C(=O)O)cc1)NCc1nncn1-c1ccccc1	ZINC000819194700	FD	On-Demand	Anodyne	RPA1	54	36
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc[nH]1	ZINC000819194706	EF	On-Demand	Anodyne	GPR119	46	49
O=C1[C@@H](NC[C@@H](O)Cc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194711	FF	On-Demand	Anodyne	ACE	36	42
O=C1[C@@H](NC[C@@H](O)Cc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194711	FF	On-Demand	Anodyne	MME	27	42
O=C1[C@@H](NC[C@@H](O)Cc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194711	FF	On-Demand	Anodyne	SIGMAR1	18	47
O=C1[C@@H](NC[C@H](O)Cc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194712	FF	On-Demand	Anodyne	ACE	36	42
O=C1[C@@H](NC[C@H](O)Cc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194712	FF	On-Demand	Anodyne	MME	27	42
O=C1[C@@H](NC[C@H](O)Cc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194712	FF	On-Demand	Anodyne	SIGMAR1	18	47
O=C(NNC(=O)N1CCO[C@H](C(=O)O)C1)c1cccc(OC(F)F)c1	ZINC000819194713	FC	On-Demand	Reactive	DRD4	40	30
C[C@H](CNC[C@@H](O)c1ccc(C(F)(F)F)cc1)c1nc(-c2ccccc2)no1	ZINC000819194714	GI	On-Demand	Anodyne	ADRB3	21	43
O=C1[C@H](NC[C@@H](O)Cc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194715	FF	On-Demand	Anodyne	ACE	36	42
O=C1[C@H](NC[C@@H](O)Cc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194715	FF	On-Demand	Anodyne	MME	27	42
O=C1[C@H](NC[C@@H](O)Cc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194715	FF	On-Demand	Anodyne	SIGMAR1	18	47
O=C1[C@H](NC[C@H](O)Cc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194716	FF	On-Demand	Anodyne	ACE	36	42
O=C1[C@H](NC[C@H](O)Cc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194716	FF	On-Demand	Anodyne	MME	27	42
O=C1[C@H](NC[C@H](O)Cc2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000819194716	FF	On-Demand	Anodyne	SIGMAR1	18	47
O=C(NNC(=O)N1CCO[C@@H](C(=O)O)C1)c1cccc(OC(F)F)c1	ZINC000819194717	FC	On-Demand	Reactive	DRD4	40	30
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)c(C)c1	ZINC000819194718	GF	On-Demand	Anodyne	ADRB3	16	41
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)c(C)c1	ZINC000819194718	GF	On-Demand	Anodyne	ABCB1	48	41
C[C@H](CNC[C@H](O)c1ccc(C(F)(F)F)cc1)c1nc(-c2ccccc2)no1	ZINC000819194719	GI	On-Demand	Anodyne	ADRB3	21	43
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)c(C)c1	ZINC000819194720	GF	On-Demand	Anodyne	ADRB3	16	41
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(Cc3ccccc3)C2=O)c(C)c1	ZINC000819194720	GF	On-Demand	Anodyne	ABCB1	48	41
Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)c(C)c1	ZINC000819194721	GF	On-Demand	Anodyne	ADRB3	16	41
Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)c(C)c1	ZINC000819194721	GF	On-Demand	Anodyne	ABCB1	48	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	ZINC000819194722	GG	On-Demand	Anodyne	RAF1	20	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	ZINC000819194722	GG	On-Demand	Anodyne	EPHX2	55	49
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	ZINC000819194722	GG	On-Demand	Anodyne	MCHR1	20	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(Cl)c(C(=O)NC2CC2)c1	ZINC000819194722	GG	On-Demand	Anodyne	RPA1	41	32
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)c(C)c1	ZINC000819194723	GF	On-Demand	Anodyne	ADRB3	16	41
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(Cc3ccccc3)C2=O)c(C)c1	ZINC000819194723	GF	On-Demand	Anodyne	ABCB1	48	41
C[C@@H](CNC[C@H](O)c1ccc(C(F)(F)F)cc1)c1nc(-c2ccccc2)no1	ZINC000819194724	GI	On-Demand	Anodyne	ADRB3	21	43
O=C(NCc1nc(CN2CCC(C(=O)O)CC2)cs1)c1ccccc1	ZINC000819194727	FE	On-Demand	Anodyne	DRD4	27	40
O=C(NCc1nc(CN2CCC(C(=O)O)CC2)cs1)c1ccccc1	ZINC000819194727	FE	On-Demand	Anodyne	ACHE	15	45
O=C(NCc1nc(CN2CCC(C(=O)O)CC2)cs1)c1ccccc1	ZINC000819194727	FE	On-Demand	Anodyne	SIGMAR1	18	43
C[C@@H](CNC[C@@H](O)c1ccc(C(F)(F)F)cc1)c1nc(-c2ccccc2)no1	ZINC000819194728	GI	On-Demand	Anodyne	ADRB3	21	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(Cn2cccn2)c1	ZINC000819194729	FF	On-Demand	Anodyne	PTGER3	15	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(Cn2cccn2)c1	ZINC000819194729	FF	On-Demand	Anodyne	ROCK2	21	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(Cn2cccn2)c1	ZINC000819194729	FF	On-Demand	Anodyne	NAMPT	56	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(N2CCCS2(=O)=O)c1	ZINC000819194732	GE	On-Demand	Anodyne	CDK1	18	43
O=C(NCc1nc(CN2CC[C@@H](C(=O)O)C2)cs1)c1ccccc1	ZINC000819194736	ED	On-Demand	Anodyne	DRD4	24	41
O=C(NCc1nc(CN2CC[C@@H](C(=O)O)C2)cs1)c1ccccc1	ZINC000819194736	ED	On-Demand	Anodyne	SLC6A1	133	40
O=C(NCc1nc(CN2CC[C@H](C(=O)O)C2)cs1)c1ccccc1	ZINC000819194738	ED	On-Demand	Anodyne	DRD4	24	41
O=C(NCc1nc(CN2CC[C@H](C(=O)O)C2)cs1)c1ccccc1	ZINC000819194738	ED	On-Demand	Anodyne	SLC6A1	133	40
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1Cl)c1ccc[nH]1	ZINC000819194739	EG	On-Demand	Anodyne	ADRB2	25	44
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1Cl)c1ccc[nH]1	ZINC000819194739	EG	On-Demand	Anodyne	ADRB1	25	42
C[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1Cl)c1ccc[nH]1	ZINC000819194742	EG	On-Demand	Anodyne	ADRB2	25	44
C[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1Cl)c1ccc[nH]1	ZINC000819194742	EG	On-Demand	Anodyne	ADRB1	25	42
O=C(NNC(=O)N1CCO[C@H](C(=O)O)C1)c1cccc(C(F)(F)F)c1	ZINC000819194756	FC	On-Demand	Reactive	CACNA1B	46	33
O=C(NNC(=O)N1CCO[C@H](C(=O)O)C1)c1cccc(C(F)(F)F)c1	ZINC000819194756	FC	On-Demand	Reactive	CCR2	90	44
O=C(NNC(=O)N1CCO[C@H](C(=O)O)C1)c1cccc(C(F)(F)F)c1	ZINC000819194756	FC	On-Demand	Reactive	LIPG	47	32
O=C1[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)CCCN1Cc1ccccc1	ZINC000819194797	GE	On-Demand	Bother	ADRB2	19	42
O=C1[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)CCCN1Cc1ccccc1	ZINC000819194797	GE	On-Demand	Bother	ADRB1	24	42
O=C1[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)CCCN1Cc1ccccc1	ZINC000819194797	GE	On-Demand	Bother	ADRB3	23	42
O=C1[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)CCCN1Cc1ccccc1	ZINC000819194798	GE	On-Demand	Bother	ADRB2	19	42
O=C1[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)CCCN1Cc1ccccc1	ZINC000819194798	GE	On-Demand	Bother	ADRB1	24	42
O=C1[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)CCCN1Cc1ccccc1	ZINC000819194798	GE	On-Demand	Bother	ADRB3	23	42
O=C1[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCCN1Cc1ccccc1	ZINC000819194799	GE	On-Demand	Bother	ADRB2	19	42
O=C1[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCCN1Cc1ccccc1	ZINC000819194799	GE	On-Demand	Bother	ADRB1	24	42
O=C1[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCCN1Cc1ccccc1	ZINC000819194799	GE	On-Demand	Bother	ADRB3	23	42
O=C1[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCCN1Cc1ccccc1	ZINC000819194800	GE	On-Demand	Bother	ADRB2	19	42
O=C1[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCCN1Cc1ccccc1	ZINC000819194800	GE	On-Demand	Bother	ADRB1	24	42
O=C1[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCCN1Cc1ccccc1	ZINC000819194800	GE	On-Demand	Bother	ADRB3	23	42
O=C(NNC(=O)N1CCO[C@@H](C(=O)O)C1)c1cccc(C(F)(F)F)c1	ZINC000819194801	FC	On-Demand	Reactive	CACNA1B	46	33
O=C(NNC(=O)N1CCO[C@@H](C(=O)O)C1)c1cccc(C(F)(F)F)c1	ZINC000819194801	FC	On-Demand	Reactive	CCR2	90	44
O=C(NNC(=O)N1CCO[C@@H](C(=O)O)C1)c1cccc(C(F)(F)F)c1	ZINC000819194801	FC	On-Demand	Reactive	LIPG	47	32
O=C(NCc1ccc(C(=O)O)cc1)NNc1ccccn1	ZINC000819194802	CD	On-Demand	Reactive	PPIA	35	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2nccn2)nc1	ZINC000819194804	ED	On-Demand	Anodyne	NAMPT	60	45
O=C(NCc1ccc(OC(F)F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819194805	FF	On-Demand	Anodyne	SRD5A2	15	42
O=C(NCc1ccc(C(=O)O)cc1)NCc1ncc(-c2ccccc2)o1	ZINC000819194806	FG	On-Demand	Anodyne	FAAH	49	41
O=C(NCc1ccc(C(=O)O)cc1)NCc1ncc(-c2ccccc2)o1	ZINC000819194806	FG	On-Demand	Anodyne	CES1	20	41
O=C(NCc1ccc(C(=O)O)cc1)NCc1ncc(-c2ccccc2)o1	ZINC000819194806	FG	On-Demand	Anodyne	NPPA	22	41
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cccc(Cl)c1	ZINC000819194810	EE	On-Demand	Reactive	PTGER1	37	41
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cccc(Cl)c1	ZINC000819194810	EE	On-Demand	Reactive	PTGER4	16	52
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cccc(Cl)c1	ZINC000819194810	EE	On-Demand	Reactive	UL80	30	44
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cccc(Cl)c1	ZINC000819194810	EE	On-Demand	Reactive	ECR	20	40
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cccc(Cl)c1	ZINC000819194810	EE	On-Demand	Reactive	FBP1	17	42
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cccc(Cl)c1	ZINC000819194810	EE	On-Demand	Reactive	CTSV	21	41
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cccc(Cl)c1	ZINC000819194810	EE	On-Demand	Reactive	LUCI_LUCLA	15	40
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cccc(Cl)c1	ZINC000819194810	EE	On-Demand	Reactive	AKR1C3	16	43
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cccc(Cl)c1	ZINC000819194810	EE	On-Demand	Reactive	RPA1	51	38
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cccc(Cl)c1	ZINC000819194810	EE	On-Demand	Reactive	KCNK3	16	44
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cccc(Cl)c1	ZINC000819194810	EE	On-Demand	Reactive	PDS	42	37
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)NC2CC2)cc1	ZINC000819194811	FF	On-Demand	Anodyne	DRD4	15	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)NC2CC2)cc1	ZINC000819194811	FF	On-Demand	Anodyne	MAPK14	18	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)NC2CC2)cc1	ZINC000819194811	FF	On-Demand	Anodyne	CCR3	27	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)NC2CC2)cc1	ZINC000819194811	FF	On-Demand	Anodyne	EPHX2	63	50
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)NC2CC2)cc1	ZINC000819194811	FF	On-Demand	Anodyne	TPSAB1	16	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)NC2CC2)cc1	ZINC000819194811	FF	On-Demand	Anodyne	MCHR1	15	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)NC2CC2)cc1	ZINC000819194811	FF	On-Demand	Anodyne	GIPR	55	36
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)NC2CC2)cc1	ZINC000819194811	FF	On-Demand	Anodyne	NAMPT	52	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1nn(-c2ccccc2)c2c1CCC2	ZINC000819194812	GG	On-Demand	Anodyne	FABP4	41	38
O=C(NCc1ccc(C(=O)O)cc1)NCc1nn(-c2ccccc2)c2c1CCC2	ZINC000819194812	GG	On-Demand	Anodyne	RPA1	42	34
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	ZINC000819194813	GC	On-Demand	Reactive	KCNJ1	48	37
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1	ZINC000819194813	GC	On-Demand	Reactive	RPA1	60	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CC(F)(F)F)cc1	ZINC000819194814	FH	On-Demand	Anodyne	ROCK2	15	47
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CC(F)(F)F)cc1	ZINC000819194814	FH	On-Demand	Anodyne	EPHX2	34	48
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CC(F)(F)F)cc1	ZINC000819194814	FH	On-Demand	Anodyne	TPSAB1	15	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CC(F)(F)F)cc1	ZINC000819194814	FH	On-Demand	Anodyne	P96878_MYCTU	18	47
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CC(F)(F)F)cc1	ZINC000819194814	FH	On-Demand	Anodyne	NAMPT	44	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1nc(C(F)(F)F)cs1	ZINC000819194815	EG	On-Demand	Anodyne	ROCK1	16	51
O=C(NCc1ccc(OCC(F)(F)F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819194816	GG	On-Demand	Anodyne	SRD5A2	15	42
O=C(NCc1ccc(OCC(F)(F)F)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819194816	GG	On-Demand	Anodyne	PLA2G4B	43	37
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-n2cccn2)c1	ZINC000819194819	EF	On-Demand	Anodyne	CCR3	31	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-n2cccn2)c1	ZINC000819194819	EF	On-Demand	Anodyne	ROCK2	22	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-n2cccn2)c1	ZINC000819194819	EF	On-Demand	Anodyne	CCKBR	44	37
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-n2cccn2)c1	ZINC000819194819	EF	On-Demand	Anodyne	AMP1_PLAFQ	45	32
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-n2cccn2)c1	ZINC000819194819	EF	On-Demand	Anodyne	NAMPT	53	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccnc1OCC(F)(F)F	ZINC000819194822	GF	On-Demand	Anodyne	SCN10A	20	52
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc(Cl)cc1	ZINC000819194823	EE	On-Demand	Reactive	F10	16	43
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc(Cl)cc1	ZINC000819194823	EE	On-Demand	Reactive	PTGER4	18	43
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc(Cl)cc1	ZINC000819194823	EE	On-Demand	Reactive	ECR	24	40
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc(Cl)cc1	ZINC000819194823	EE	On-Demand	Reactive	RPA1	48	39
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc(Cl)cc1	ZINC000819194823	EE	On-Demand	Reactive	E3UJZ5_SPOLI	27	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(N2CCNC2=O)c1	ZINC000819194824	FE	On-Demand	Anodyne	CCR3	52	37
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(N2CCNC2=O)c1	ZINC000819194824	FE	On-Demand	Anodyne	ROCK2	16	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(F)nc1	ZINC000819194828	CE	On-Demand	Anodyne	PPIA	15	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(F)nc1	ZINC000819194828	CE	On-Demand	Anodyne	ROCK2	16	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(F)nc1	ZINC000819194828	CE	On-Demand	Anodyne	NAMPT	56	45
O=C(NNC(=O)N1CCO[C@H](C(=O)O)C1)c1ccc(COc2ccccc2)o1	ZINC000819194831	GC	On-Demand	Reactive	CYSLTR2	43	31
O=C(NNC(=O)N1CCO[C@@H](C(=O)O)C1)c1ccc(COc2ccccc2)o1	ZINC000819194832	GC	On-Demand	Reactive	CYSLTR2	43	31
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(COCC2CC2)c1	ZINC000819194833	FH	On-Demand	Anodyne	CCR3	61	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(COCC2CC2)c1	ZINC000819194833	FH	On-Demand	Anodyne	ROCK2	22	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(COCC2CC2)c1	ZINC000819194833	FH	On-Demand	Anodyne	EPHX2	29	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000819194835	GF	On-Demand	Anodyne	AVPR2	15	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000819194835	GF	On-Demand	Anodyne	CCR3	68	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000819194835	GF	On-Demand	Anodyne	ROCK2	20	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000819194835	GF	On-Demand	Anodyne	CCKBR	67	36
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000819194835	GF	On-Demand	Anodyne	PRMT3	46	33
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1CN1CCOCC1	ZINC000819194838	GE	On-Demand	Anodyne	ACHE	15	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1CN1CCOCC1	ZINC000819194838	GE	On-Demand	Anodyne	SIGMAR1	23	42
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1CN1CCOCC1	ZINC000819194838	GE	On-Demand	Anodyne	EPHX2	24	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1CN1CCOCC1	ZINC000819194838	GE	On-Demand	Anodyne	NPFFR1	43	36
O=C(NCc1ccc(C(=O)O)cc1)NNc1ccc(F)cc1	ZINC000819194839	DE	On-Demand	Reactive	LTA4H	16	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCCC2)nc1	ZINC000819194840	EF	On-Demand	Anodyne	DGAT1	45	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCCC2)nc1	ZINC000819194840	EF	On-Demand	Anodyne	NAMPT	74	47
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CN2C(=O)CCC2=O)cc1	ZINC000819194843	GE	On-Demand	Anodyne	EPHX2	27	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CN2C(=O)CCC2=O)cc1	ZINC000819194843	GE	On-Demand	Anodyne	NOD2	42	35
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CN2C(=O)CCC2=O)cc1	ZINC000819194843	GE	On-Demand	Anodyne	NAMPT	46	42
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccccc1F	ZINC000819194844	ED	On-Demand	Reactive	ECR	28	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CN2CCOC2=O)cc1	ZINC000819194847	FF	On-Demand	Anodyne	EPHX2	21	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CN2CCOC2=O)cc1	ZINC000819194847	FF	On-Demand	Anodyne	NAMPT	40	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccn(Cc2ccccc2)c1=O	ZINC000819194850	GF	On-Demand	Anodyne	PTGER3	15	53
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccn(Cc2ccccc2)c1=O	ZINC000819194850	GF	On-Demand	Anodyne	HDAC1	24	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	RARA	23	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	PPIA	36	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	KCNJ11	46	35
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	MAPK14	17	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	TRPV1	25	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	UL80	34	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	PRNP	49	50
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	ROCK2	35	52
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	NR1H4	17	47
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	HDAC1	43	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	HDAC2	33	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	EPHX2	33	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	PLAU	17	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	F7	18	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	MCHR1	17	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	TAAR1	48	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	AKR1C3	36	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	NOD2	40	34
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	NAMPT	53	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	KCNK3	148	56
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819194851	GH	On-Demand	Anodyne	KCNK9	93	51
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccoc2)c1	ZINC000819194854	GH	On-Demand	Anodyne	ROCK2	20	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccoc2)c1	ZINC000819194854	GH	On-Demand	Anodyne	KCNK3	109	62
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)c2ccoc2)c1	ZINC000819194854	GH	On-Demand	Anodyne	KCNK9	63	37
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(Cn2cccn2)cc1	ZINC000819194855	FF	On-Demand	Anodyne	LTA4H	32	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(Cn2cccn2)cc1	ZINC000819194855	FF	On-Demand	Anodyne	ROCK2	17	49
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(Cn2cccn2)cc1	ZINC000819194855	FF	On-Demand	Anodyne	EPHX2	18	49
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(Cn2cccn2)cc1	ZINC000819194855	FF	On-Demand	Anodyne	NOD2	41	34
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(Cn2cccn2)cc1	ZINC000819194855	FF	On-Demand	Anodyne	NAMPT	64	47
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccnc1N1CCCC1	ZINC000819194857	EF	On-Demand	Anodyne	KCNQ2	67	38
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccnc1N1CCCC1	ZINC000819194857	EF	On-Demand	Anodyne	TRPV1	28	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccnc1N1CCCC1	ZINC000819194857	EF	On-Demand	Anodyne	SCN2A	17	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccnc1N1CCCC1	ZINC000819194857	EF	On-Demand	Anodyne	HDAC1	23	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccnc1N1CCCC1	ZINC000819194857	EF	On-Demand	Anodyne	SCN10A	18	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccnc1N1CCCC1	ZINC000819194857	EF	On-Demand	Anodyne	NAMPT	71	44
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	ACE	92	51
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	OPRM1	23	42
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	FOLH1	18	44
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	MME	179	54
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	ANPEP	91	44
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	FCER2	55	34
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	CTSB	40	46
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	PAPA1_CARPA	43	42
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	CYSP_TRYCR	52	39
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	CTSL	40	54
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	CPA1	72	47
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	NPFFR2	49	36
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	TIMP3	70	35
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	ITGA4	39	43
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	NAALAD2	34	49
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	CAPNS1	57	37
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	ECE1	65	45
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	CTSS	17	42
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	CAPN1	68	55
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	MMP9	20	42
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	ACE2	115	47
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	CTSV	27	54
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	PIN1	47	39
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	MMP1	26	41
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	FPR1	83	46
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	NPPA	49	39
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	BLA1_STEMA	88	43
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	BRCA1	55	34
O=C(N[C@@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819194858	CD	On-Demand	Anodyne	NPFFR1	58	36
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1c[nH]c2ccccc12	ZINC000819194859	FE	On-Demand	Reactive	TACR1	15	42
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1c[nH]c2ccccc12	ZINC000819194859	FE	On-Demand	Reactive	BRS3	25	42
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1c[nH]c2ccccc12	ZINC000819194859	FE	On-Demand	Reactive	CFTR	33	41
O=C(NCc1ccc(CN2CCOCC2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819194861	GE	On-Demand	Anodyne	ACHE	24	40
O=C(NCc1ccc(CN2CCOCC2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819194861	GE	On-Demand	Anodyne	LTA4H	21	41
O=C(NCc1ccc(CN2CCOCC2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819194861	GE	On-Demand	Anodyne	HRH3	15	51
O=C(NCc1ccc(CN2CCOCC2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819194861	GE	On-Demand	Anodyne	SIGMAR1	37	46
O=C(NCc1ccc(CN2CCOCC2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819194861	GE	On-Demand	Anodyne	EPHX2	27	43
O=C(NCc1ccc(CN2CCOCC2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819194861	GE	On-Demand	Anodyne	DPOL_VZVD	26	45
O=C(NCc1ccc(CN2CCOCC2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819194861	GE	On-Demand	Anodyne	NPFFR1	44	38
O=C(NCc1ccc(C(=O)O)cc1)NNc1cccc([N+](=O)[O-])c1	ZINC000819194862	EE	On-Demand	Reactive	CACNA1C	54	40
O=C(NCc1ccc(C(=O)O)cc1)NNc1cccc([N+](=O)[O-])c1	ZINC000819194862	EE	On-Demand	Reactive	PPIA	18	44
O=C(NCc1ccc(C(=O)O)cc1)NNc1cccc([N+](=O)[O-])c1	ZINC000819194862	EE	On-Demand	Reactive	CACNA1D	82	40
O=C(NCc1ccc(C(=O)O)cc1)NNc1cccc([N+](=O)[O-])c1	ZINC000819194862	EE	On-Demand	Reactive	ACR	16	42
O=C(NCc1ccc(C(=O)O)cc1)NNc1cccc([N+](=O)[O-])c1	ZINC000819194862	EE	On-Demand	Reactive	AKR1C3	24	53
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(OC(F)F)c(F)c1	ZINC000819194863	FG	On-Demand	Anodyne	ROCK2	15	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(CC(F)(F)F)c1	ZINC000819194864	FH	On-Demand	Anodyne	PPIA	29	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(CC(F)(F)F)c1	ZINC000819194864	FH	On-Demand	Anodyne	ROCK2	26	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(CC(F)(F)F)c1	ZINC000819194864	FH	On-Demand	Anodyne	EPHX2	29	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(CC(F)(F)F)c1	ZINC000819194864	FH	On-Demand	Anodyne	NAMPT	39	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(CC(F)(F)F)c1	ZINC000819194864	FH	On-Demand	Anodyne	KCNK3	51	35
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000819194866	GF	On-Demand	Anodyne	CA2	38	54
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000819194866	GF	On-Demand	Anodyne	CA1	36	54
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000819194866	GF	On-Demand	Anodyne	CA7	18	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000819194866	GF	On-Demand	Anodyne	CA4	29	54
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000819194866	GF	On-Demand	Anodyne	CA14	17	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000819194866	GF	On-Demand	Anodyne	EPHX2	20	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000819194866	GF	On-Demand	Anodyne	CA12	29	54
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000819194866	GF	On-Demand	Anodyne	CA9	30	48
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000819194866	GF	On-Demand	Anodyne	NCE103	15	48
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000819194866	GF	On-Demand	Anodyne	PRMT3	18	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000819194866	GF	On-Demand	Anodyne	MTCA1	39	54
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000819194866	GF	On-Demand	Anodyne	P96878_MYCTU	51	54
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)C(F)F)cc1	ZINC000819194866	GF	On-Demand	Anodyne	NAMPT	83	50
O=C(NCc1ccc(C(=O)O)cc1)NCc1cnn(-c2ccccc2)c1	ZINC000819194867	FF	On-Demand	Anodyne	NAMPT	29	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000819194868	GD	On-Demand	Anodyne	NPY1R	28	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000819194868	GD	On-Demand	Anodyne	CCR3	44	37
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000819194868	GD	On-Demand	Anodyne	ROCK2	18	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000819194868	GD	On-Demand	Anodyne	EPHX2	15	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000819194868	GD	On-Demand	Anodyne	NAMPT	43	39
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000819194871	FD	On-Demand	Reactive	CACNA1C	51	38
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000819194871	FD	On-Demand	Reactive	CACNA1D	81	38
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000819194871	FD	On-Demand	Reactive	ACR	15	40
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000819194871	FD	On-Demand	Reactive	AKR1C3	18	47
O=C(NCc1ccc(C(=O)O)cc1)NNc1ccc(Cl)nc1	ZINC000819194874	DE	On-Demand	Reactive	NAMPT	21	48
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCc2cccnc2)c1	ZINC000819194875	GH	On-Demand	Anodyne	CYSLTR1	20	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCc2cccnc2)c1	ZINC000819194875	GH	On-Demand	Anodyne	PPIA	44	49
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCc2cccnc2)c1	ZINC000819194875	GH	On-Demand	Anodyne	LTA4H	22	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCc2cccnc2)c1	ZINC000819194875	GH	On-Demand	Anodyne	TRPV1	15	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCc2cccnc2)c1	ZINC000819194875	GH	On-Demand	Anodyne	UL80	27	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCc2cccnc2)c1	ZINC000819194875	GH	On-Demand	Anodyne	CHRNA7	31	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCc2cccnc2)c1	ZINC000819194875	GH	On-Demand	Anodyne	KDR	15	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCc2cccnc2)c1	ZINC000819194875	GH	On-Demand	Anodyne	ROCK2	35	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCc2cccnc2)c1	ZINC000819194875	GH	On-Demand	Anodyne	NAMPT	111	54
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCc2cccnc2)c1	ZINC000819194875	GH	On-Demand	Anodyne	PDS	56	36
O=C(NCc1ccc(C(=O)O)cc1)NCc1cn2cc(Cl)ccc2n1	ZINC000819194876	FF	On-Demand	Anodyne	MAP3K5	56	45
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1-n1cccn1	ZINC000819194879	FF	On-Demand	Anodyne	AVPR2	15	43
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1-n1cccn1	ZINC000819194879	FF	On-Demand	Anodyne	FURIN	42	33
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1-n1cccn1	ZINC000819194879	FF	On-Demand	Anodyne	AMP1_PLAFQ	49	34
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2nccn2)cc1	ZINC000819194880	EE	On-Demand	Anodyne	EPHX2	18	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2nccn2)cc1	ZINC000819194880	EE	On-Demand	Anodyne	NAMPT	58	47
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2nccn2)cc1	ZINC000819194880	EE	On-Demand	Anodyne	RPA1	60	34
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccnn1C1CCCCC1	ZINC000819194881	EG	On-Demand	Anodyne	NAMPT	53	42
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccn(-c2ccccc2)n1	ZINC000819194882	FF	On-Demand	Anodyne	RPA1	46	35
O=C(NCc1ccc(C(=O)O)cc1)NCc1csc(-c2ccco2)n1	ZINC000819194883	FG	On-Demand	Anodyne	ADORA2A	23	40
O=C(NNC(=O)N1CCO[C@H](C(=O)O)C1)c1cccc2ccccc12	ZINC000819194884	EC	On-Demand	Reactive	CNR1	15	42
O=C(NNC(=O)N1CCO[C@H](C(=O)O)C1)c1cccc2ccccc12	ZINC000819194884	EC	On-Demand	Reactive	ADCY5	17	42
O=C(NNC(=O)N1CCO[C@H](C(=O)O)C1)c1cccc2ccccc12	ZINC000819194884	EC	On-Demand	Reactive	PTGDS	22	42
O=C(NNC(=O)N1CCO[C@@H](C(=O)O)C1)c1cccc2ccccc12	ZINC000819194885	EC	On-Demand	Reactive	CNR1	15	42
O=C(NNC(=O)N1CCO[C@@H](C(=O)O)C1)c1cccc2ccccc12	ZINC000819194885	EC	On-Demand	Reactive	ADCY5	17	42
O=C(NNC(=O)N1CCO[C@@H](C(=O)O)C1)c1cccc2ccccc12	ZINC000819194885	EC	On-Demand	Reactive	PTGDS	22	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	CA2	18	57
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	RARA	20	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	AVPR2	33	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	PPIA	31	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	LTA4H	25	49
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	TRPV1	31	49
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	AURKB	17	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	HDAC8	18	51
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	PRNP	65	47
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	ROCK2	26	53
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	NR1H4	15	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	HDAC1	46	47
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	HDAC2	40	51
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	HDAC6	19	51
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	EPHX2	35	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	PLAU	19	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	F7	22	47
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	CA12	16	53
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	FLT3	19	51
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	TPSAB1	16	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	CA9	20	53
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	AURKA	18	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	TAAR1	21	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	NCE103	15	53
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	DGAT1	22	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	P96878_MYCTU	21	53
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	NOD1	18	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	NOD2	48	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	NAMPT	71	51
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000819194888	GH	On-Demand	Anodyne	KCNK3	81	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCCCC2)nc1	ZINC000819194890	FG	On-Demand	Anodyne	DGAT1	45	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCCCC2)nc1	ZINC000819194890	FG	On-Demand	Anodyne	NAMPT	72	48
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)C(=O)NC1CC1	ZINC000819194893	DB	On-Demand	Reactive	EPHX2	18	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(N2CCCCC2)c1	ZINC000819194894	FH	On-Demand	Anodyne	HRH2	20	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(N2CCCCC2)c1	ZINC000819194894	FH	On-Demand	Anodyne	AVPR2	16	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(N2CCCCC2)c1	ZINC000819194894	FH	On-Demand	Anodyne	CCR3	48	37
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(N2CCCCC2)c1	ZINC000819194894	FH	On-Demand	Anodyne	ROCK2	15	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(N2CCCCC2)c1	ZINC000819194894	FH	On-Demand	Anodyne	CCKBR	25	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(N2CCCCC2)c1	ZINC000819194894	FH	On-Demand	Anodyne	TAAR1	29	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(N2CCCCC2)c1	ZINC000819194894	FH	On-Demand	Anodyne	PRMT3	46	33
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(N2CCCCC2)c1	ZINC000819194894	FH	On-Demand	Anodyne	NAMPT	54	47
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(Oc2ccccn2)c1	ZINC000819194895	FH	On-Demand	Anodyne	PPIA	41	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(Oc2ccccn2)c1	ZINC000819194895	FH	On-Demand	Anodyne	PDGFRB	22	49
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(Oc2ccccn2)c1	ZINC000819194895	FH	On-Demand	Anodyne	LTA4H	26	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(Oc2ccccn2)c1	ZINC000819194895	FH	On-Demand	Anodyne	UL80	27	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(Oc2ccccn2)c1	ZINC000819194895	FH	On-Demand	Anodyne	P2RY1	26	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(Oc2ccccn2)c1	ZINC000819194895	FH	On-Demand	Anodyne	RAF1	22	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(Oc2ccccn2)c1	ZINC000819194895	FH	On-Demand	Anodyne	KDR	23	48
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(Oc2ccccn2)c1	ZINC000819194895	FH	On-Demand	Anodyne	ROCK2	27	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(Oc2ccccn2)c1	ZINC000819194895	FH	On-Demand	Anodyne	EPHX2	24	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(Oc2ccccn2)c1	ZINC000819194895	FH	On-Demand	Anodyne	FLT4	20	49
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(Oc2ccccn2)c1	ZINC000819194895	FH	On-Demand	Anodyne	NAMPT	56	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(Oc2ccccn2)c1	ZINC000819194895	FH	On-Demand	Anodyne	PDS	52	34
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819194898	FF	On-Demand	Anodyne	DRD4	19	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819194898	FF	On-Demand	Anodyne	MAPK14	35	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819194898	FF	On-Demand	Anodyne	CCKAR	15	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819194898	FF	On-Demand	Anodyne	CCR3	64	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819194898	FF	On-Demand	Anodyne	ROCK2	24	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819194898	FF	On-Demand	Anodyne	EPHX2	62	50
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819194898	FF	On-Demand	Anodyne	ST14	33	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819194898	FF	On-Demand	Anodyne	CXCR3	15	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819194898	FF	On-Demand	Anodyne	MCHR1	29	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819194898	FF	On-Demand	Anodyne	PRMT3	47	34
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819194898	FF	On-Demand	Anodyne	NAMPT	36	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000819194898	FF	On-Demand	Anodyne	KCNK3	80	36
Cc1cncc(CNC[C@H](O)c2cccnc2)c1	ZINC000819194909	BD	On-Demand	Anodyne	ADRB2	25	43
Cc1cncc(CNC[C@H](O)c2cccnc2)c1	ZINC000819194909	BD	On-Demand	Anodyne	ADRB1	28	45
Cc1cncc(CNC[C@H](O)c2cccnc2)c1	ZINC000819194909	BD	On-Demand	Anodyne	ADRB3	97	48
Cc1cncc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819194910	BD	On-Demand	Anodyne	ADRB2	25	43
Cc1cncc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819194910	BD	On-Demand	Anodyne	ADRB1	28	45
Cc1cncc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819194910	BD	On-Demand	Anodyne	ADRB3	97	48
C[C@@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccc[nH]1	ZINC000819194923	EH	On-Demand	Anodyne	SLC1A1	19	40
C[C@@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccc[nH]1	ZINC000819194923	EH	On-Demand	Anodyne	SLC1A3	17	40
C[C@@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)c1ccc[nH]1	ZINC000819194923	EH	On-Demand	Anodyne	SLC1A2	32	40
O[C@@H](CNCCc1nc2c(s1)CCCC2)c1ccc(OC(F)(F)F)cc1	ZINC000819194933	GH	On-Demand	Anodyne	ADRB3	21	41
O[C@H](CNCCc1nc2c(s1)CCCC2)c1ccc(OC(F)(F)F)cc1	ZINC000819194934	GH	On-Demand	Anodyne	ADRB3	21	41
C[C@@H](NC[C@@H](O)c1ccccc1)c1ccc[nH]1	ZINC000819194951	BE	On-Demand	Anodyne	ADRB2	18	41
C[C@@H](NC[C@@H](O)c1ccccc1)c1ccc[nH]1	ZINC000819194951	BE	On-Demand	Anodyne	ADRB1	15	42
C[C@@H](NC[C@@H](O)c1ccccc1)c1ccc[nH]1	ZINC000819194951	BE	On-Demand	Anodyne	ADRB3	35	42
C[C@@H](NC[C@@H](O)c1ccccc1)c1ccc[nH]1	ZINC000819194951	BE	On-Demand	Anodyne	AOC3	15	45
C[C@H](NC[C@H](O)c1ccccc1)c1ccc[nH]1	ZINC000819194952	BE	On-Demand	Anodyne	ADRB2	18	41
C[C@H](NC[C@H](O)c1ccccc1)c1ccc[nH]1	ZINC000819194952	BE	On-Demand	Anodyne	ADRB1	15	42
C[C@H](NC[C@H](O)c1ccccc1)c1ccc[nH]1	ZINC000819194952	BE	On-Demand	Anodyne	ADRB3	35	42
C[C@H](NC[C@H](O)c1ccccc1)c1ccc[nH]1	ZINC000819194952	BE	On-Demand	Anodyne	AOC3	15	45
C[C@H](CNC[C@H](O)c1ccc(F)c(F)c1)c1nc(-c2ccccc2)no1	ZINC000819194955	FG	On-Demand	Anodyne	ADRB3	25	42
C[C@@H](CNC[C@H](O)c1ccc(F)c(F)c1)c1nc(-c2ccccc2)no1	ZINC000819194956	FG	On-Demand	Anodyne	ADRB3	25	42
C[C@H](CNC[C@@H](O)c1ccc(F)c(F)c1)c1nc(-c2ccccc2)no1	ZINC000819194957	FG	On-Demand	Anodyne	ADRB3	25	42
C[C@@H](CNC[C@@H](O)c1ccc(F)c(F)c1)c1nc(-c2ccccc2)no1	ZINC000819194958	FG	On-Demand	Anodyne	ADRB3	25	42
C[C@H](NC[C@H](O)COc1cccc(C(F)(F)F)c1)c1ccc[nH]1	ZINC000819194983	EG	On-Demand	Anodyne	ADRB2	24	47
C[C@H](NC[C@H](O)COc1cccc(C(F)(F)F)c1)c1ccc[nH]1	ZINC000819194983	EG	On-Demand	Anodyne	ADRB1	29	47
C[C@H](NC[C@H](O)COc1cccc(C(F)(F)F)c1)c1ccc[nH]1	ZINC000819194983	EG	On-Demand	Anodyne	PDS	47	43
C[C@@H](NC[C@@H](O)COc1cccc(C(F)(F)F)c1)c1ccc[nH]1	ZINC000819194984	EG	On-Demand	Anodyne	ADRB2	24	47
C[C@@H](NC[C@@H](O)COc1cccc(C(F)(F)F)c1)c1ccc[nH]1	ZINC000819194984	EG	On-Demand	Anodyne	ADRB1	29	47
C[C@@H](NC[C@@H](O)COc1cccc(C(F)(F)F)c1)c1ccc[nH]1	ZINC000819194984	EG	On-Demand	Anodyne	PDS	47	43
O=C(NCc1cnn(Cc2ccc(C(=O)O)cc2)c1)OCc1ccccc1	ZINC000819195001	FG	On-Demand	Anodyne	CYSP_TRYCR	40	33
O=C(NCc1cnn(Cc2ccc(C(=O)O)cc2)c1)OCc1ccccc1	ZINC000819195001	FG	On-Demand	Anodyne	CAPNS1	42	31
O=C(NCc1cnn(Cc2ccc(C(=O)O)cc2)c1)OCc1ccccc1	ZINC000819195001	FG	On-Demand	Anodyne	CAPN2	64	36
O=C(NCc1cnn(Cc2ccc(C(=O)O)cc2)c1)OCc1ccccc1	ZINC000819195001	FG	On-Demand	Anodyne	NPR	58	34
O=C(NCc1cnn(Cc2ccc(C(=O)O)cc2)c1)OCc1ccccc1	ZINC000819195001	FG	On-Demand	Anodyne	PANC	46	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(OCC(F)(F)F)cc1	ZINC000819195005	FH	On-Demand	Anodyne	LTA4H	42	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(OCC(F)(F)F)cc1	ZINC000819195005	FH	On-Demand	Anodyne	ROCK2	16	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(OCC(F)(F)F)cc1	ZINC000819195005	FH	On-Demand	Anodyne	EPHX2	54	51
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(OCC(F)(F)F)cc1	ZINC000819195005	FH	On-Demand	Anodyne	ACR	48	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(OCC(F)(F)F)cc1	ZINC000819195005	FH	On-Demand	Anodyne	CA9	15	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(OCC(F)(F)F)cc1	ZINC000819195005	FH	On-Demand	Anodyne	NCE103	15	48
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(OCC(F)(F)F)cc1	ZINC000819195005	FH	On-Demand	Anodyne	NAMPT	36	44
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cccc2cccnc12	ZINC000819195006	FE	On-Demand	Reactive	PPIA	35	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cc2c(cc1Cl)OCO2	ZINC000819195007	EG	On-Demand	Anodyne	RPA1	44	31
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819195009	GH	On-Demand	Anodyne	GRM5	19	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819195009	GH	On-Demand	Anodyne	EPHX2	16	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819195009	GH	On-Demand	Anodyne	SPHK1	19	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819195009	GH	On-Demand	Anodyne	SMO	37	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819195009	GH	On-Demand	Anodyne	ETHR	53	44
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccccc1	ZINC000819195010	DD	On-Demand	Reactive	ECR	38	43
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccccc1	ZINC000819195010	DD	On-Demand	Reactive	HDAC8	16	44
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccccc1	ZINC000819195010	DD	On-Demand	Reactive	CTRB1	31	40
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccccc1	ZINC000819195010	DD	On-Demand	Reactive	HDAC1	27	47
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccccc1	ZINC000819195010	DD	On-Demand	Reactive	HDAC2	28	51
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccccc1	ZINC000819195010	DD	On-Demand	Reactive	HDAC6	22	51
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccccc1	ZINC000819195010	DD	On-Demand	Reactive	TPSAB1	17	42
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccccc1	ZINC000819195010	DD	On-Demand	Reactive	RPA1	28	40
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccccc1	ZINC000819195010	DD	On-Demand	Reactive	E3UJZ5_SPOLI	32	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-c2nccs2)c1	ZINC000819195012	FH	On-Demand	Anodyne	ROCK2	27	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-c2nccs2)c1	ZINC000819195012	FH	On-Demand	Anodyne	HDAC2	16	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-c2nccs2)c1	ZINC000819195012	FH	On-Demand	Anodyne	BRAF	22	46
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1Cn1cncn1	ZINC000819195013	FE	On-Demand	Anodyne	NAMPT	22	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(N2C(=O)CNC2=O)c1	ZINC000819195016	FD	On-Demand	Anodyne	ROCK2	17	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(N2C(=O)CNC2=O)c1	ZINC000819195016	FD	On-Demand	Anodyne	NAMPT	48	41
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1cc2ccccc2o1	ZINC000819195017	FE	On-Demand	Reactive	NAMPT	31	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1cc(N2CCCC2=O)ccc1Cl	ZINC000819195018	GG	On-Demand	Anodyne	HEMY	46	38
O=C(NCc1ccc(C(=O)O)cc1)Nc1cc(N2CCCC2=O)ccc1Cl	ZINC000819195018	GG	On-Demand	Anodyne	RPA1	69	35
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000819195021	GG	On-Demand	Anodyne	NPY2R	45	39
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000819195021	GG	On-Demand	Anodyne	EPHX2	15	41
O=C(NCc1ccc(Cn2cncn2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819195024	FE	On-Demand	Anodyne	CYP19A1	29	40
O=C(NCc1ccc(Cn2cncn2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819195024	FE	On-Demand	Anodyne	HIS3	59	35
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2cccn2)cc1	ZINC000819195026	EF	On-Demand	Anodyne	ROCK2	18	49
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2cccn2)cc1	ZINC000819195026	EF	On-Demand	Anodyne	EPHX2	17	49
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2cccn2)cc1	ZINC000819195026	EF	On-Demand	Anodyne	AMP1_PLAFQ	57	39
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2cccn2)cc1	ZINC000819195026	EF	On-Demand	Anodyne	NAMPT	63	47
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2cccn2)cc1	ZINC000819195026	EF	On-Demand	Anodyne	RPA1	44	32
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccccc1CN1C(=O)CCC1=O	ZINC000819195027	GE	On-Demand	Anodyne	HDAC1	15	43
O=C(NCc1ccc(C(=O)O)cc1)NCc1cn2ccccc2n1	ZINC000819195028	DE	On-Demand	Anodyne	NAMPT	26	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1cc2c(cc1Cl)OCCCO2	ZINC000819195029	GH	On-Demand	Anodyne	RPA1	41	31
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccccc1OCC(F)(F)F	ZINC000819195030	FH	On-Demand	Anodyne	HDAC1	17	55
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccn2ccnc2c1	ZINC000819195034	DE	On-Demand	Anodyne	NAMPT	22	47
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCSCC2)cc1	ZINC000819195035	FG	On-Demand	Anodyne	PIK3CA	23	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCSCC2)cc1	ZINC000819195035	FG	On-Demand	Anodyne	PRNP	40	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCSCC2)cc1	ZINC000819195035	FG	On-Demand	Anodyne	MTOR	57	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCSCC2)cc1	ZINC000819195035	FG	On-Demand	Anodyne	EPHX2	30	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCSCC2)cc1	ZINC000819195035	FG	On-Demand	Anodyne	PIK3CG	20	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCSCC2)cc1	ZINC000819195035	FG	On-Demand	Anodyne	NAMPT	44	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccccc1-n1cccn1	ZINC000819195039	EF	On-Demand	Anodyne	KCNQ2	44	36
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccccc1-n1cccn1	ZINC000819195039	EF	On-Demand	Anodyne	HDAC1	33	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccccc1-n1cccn1	ZINC000819195039	EF	On-Demand	Anodyne	AMP1_PLAFQ	44	33
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccccc1-n1cccn1	ZINC000819195039	EF	On-Demand	Anodyne	NAMPT	42	39
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2cccn2)nc1	ZINC000819195040	EE	On-Demand	Anodyne	NAMPT	67	47
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccccc1CN1CCSCC1	ZINC000819195042	GG	On-Demand	Anodyne	SIGMAR1	16	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccccc1CN1CCSCC1	ZINC000819195042	GG	On-Demand	Anodyne	CCR3	24	47
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccccc1CN1CCSCC1	ZINC000819195042	GG	On-Demand	Anodyne	HDAC1	18	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCC(F)(F)F)c1	ZINC000819195044	FH	On-Demand	Anodyne	HRH2	19	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCC(F)(F)F)c1	ZINC000819195044	FH	On-Demand	Anodyne	LTA4H	19	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCC(F)(F)F)c1	ZINC000819195044	FH	On-Demand	Anodyne	UL80	33	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCC(F)(F)F)c1	ZINC000819195044	FH	On-Demand	Anodyne	RAF1	23	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCC(F)(F)F)c1	ZINC000819195044	FH	On-Demand	Anodyne	ROCK2	25	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCC(F)(F)F)c1	ZINC000819195044	FH	On-Demand	Anodyne	EPHX2	44	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCC(F)(F)F)c1	ZINC000819195044	FH	On-Demand	Anodyne	TAAR1	42	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCC(F)(F)F)c1	ZINC000819195044	FH	On-Demand	Anodyne	KCNK3	45	35
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OCC(F)(F)F)c1	ZINC000819195044	FH	On-Demand	Anodyne	PDS	70	43
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccnc1-n1ccnc1	ZINC000819195047	FD	On-Demand	Anodyne	TBXAS1	21	44
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccnc1-n1ccnc1	ZINC000819195047	FD	On-Demand	Anodyne	NOS2	98	36
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccnc1-n1ccnc1	ZINC000819195047	FD	On-Demand	Anodyne	NAMPT	39	43
O=C(NCc1ccc(C(=O)O)cc1)NNc1ccc(OC(F)(F)F)cc1	ZINC000819195048	FG	On-Demand	Reactive	GCGR	35	40
O=C(NCc1ccc(C(=O)O)cc1)NNc1ccc(OC(F)(F)F)cc1	ZINC000819195048	FG	On-Demand	Reactive	PPARA	16	42
O=C(NCc1ccc(C(=O)O)cc1)NNc1ccc(OC(F)(F)F)cc1	ZINC000819195048	FG	On-Demand	Reactive	GRIN2B	20	48
O=C(NCc1ccc(C(=O)O)cc1)NNc1ccc(OC(F)(F)F)cc1	ZINC000819195048	FG	On-Demand	Reactive	P2RY1	57	40
O=C(NCc1ccc(C(=O)O)cc1)NNc1ccc(OC(F)(F)F)cc1	ZINC000819195048	FG	On-Demand	Reactive	EPHX2	51	45
O=C(NNc1cccnc1Cl)C1=NN(c2ccccc2)[C@@H](C(=O)O)C1	ZINC000819195049	FD	On-Demand	Reactive	G2YM83_BOTF4	46	35
O=C(NNc1cccnc1Cl)C1=NN(c2ccccc2)[C@H](C(=O)O)C1	ZINC000819195050	FD	On-Demand	Reactive	G2YM83_BOTF4	46	35
O=C(NCc1ccc(C(=O)O)cc1)Nc1nnc(Cc2ccccc2)s1	ZINC000819195051	FG	On-Demand	Anodyne	NAMPT	25	40
O=C(NCc1ccc(NC(=O)c2ccco2)cc1)NCc1ccc(C(=O)O)cc1	ZINC000819195052	GG	On-Demand	Anodyne	NAMPT	44	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OC(F)F)c1	ZINC000819195053	EG	On-Demand	Anodyne	ADRB1	16	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OC(F)F)c1	ZINC000819195053	EG	On-Demand	Anodyne	LTA4H	18	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OC(F)F)c1	ZINC000819195053	EG	On-Demand	Anodyne	UL80	32	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OC(F)F)c1	ZINC000819195053	EG	On-Demand	Anodyne	CCR3	54	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OC(F)F)c1	ZINC000819195053	EG	On-Demand	Anodyne	GRM4	15	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OC(F)F)c1	ZINC000819195053	EG	On-Demand	Anodyne	ROCK2	26	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OC(F)F)c1	ZINC000819195053	EG	On-Demand	Anodyne	EPHX2	36	51
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OC(F)F)c1	ZINC000819195053	EG	On-Demand	Anodyne	TAAR1	42	47
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OC(F)F)c1	ZINC000819195053	EG	On-Demand	Anodyne	NAMPT	30	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OC(F)F)c1	ZINC000819195053	EG	On-Demand	Anodyne	KCNK3	47	37
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(OC(F)F)c1	ZINC000819195053	EG	On-Demand	Anodyne	PDS	60	35
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccn(Cc2ccccc2)n1	ZINC000819195054	FF	On-Demand	Anodyne	HDAC1	15	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccn(Cc2ccccc2)n1	ZINC000819195054	FF	On-Demand	Anodyne	NAMPT	32	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCCC2=O)cc1	ZINC000819195056	FF	On-Demand	Anodyne	EPHX2	20	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(N2CCCC2=O)cc1	ZINC000819195056	FF	On-Demand	Anodyne	NAMPT	44	43
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(OCC(F)(F)F)c1	ZINC000819195058	GG	On-Demand	Anodyne	HRH2	24	47
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(OCC(F)(F)F)c1	ZINC000819195058	GG	On-Demand	Anodyne	GRIN2B	16	46
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(OCC(F)(F)F)c1	ZINC000819195058	GG	On-Demand	Anodyne	MMP13	22	56
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(OCC(F)(F)F)c1	ZINC000819195058	GG	On-Demand	Anodyne	UL80	26	41
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(OCC(F)(F)F)c1	ZINC000819195058	GG	On-Demand	Anodyne	PPARD	18	42
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(OCC(F)(F)F)c1	ZINC000819195058	GG	On-Demand	Anodyne	AMP1_PLAFQ	22	43
O=C(NCc1ccc(C(=O)O)cc1)NCc1cccc(OCC(F)(F)F)c1	ZINC000819195058	GG	On-Demand	Anodyne	PDS	82	48
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc2ccccc2n1	ZINC000819195060	FE	On-Demand	Reactive	CYSLTR1	33	46
O=C(NCc1ccc(C(=O)O)cc1)NCc1nc2ccccc2s1	ZINC000819195061	EF	On-Demand	Anodyne	LTA4H	16	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1nc2ccccc2s1	ZINC000819195061	EF	On-Demand	Anodyne	AKR1B1	27	41
O=C(NCc1ccc(C(=O)O)cc1)NCc1nnc2n1CCCCC2	ZINC000819195063	ED	On-Demand	Anodyne	PROC	49	33
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1Cn1ccnc1	ZINC000819195064	FF	On-Demand	Anodyne	CYP19A1	42	55
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1Cn1ccnc1	ZINC000819195064	FF	On-Demand	Anodyne	CYP11B1	71	46
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1Cn1ccnc1	ZINC000819195064	FF	On-Demand	Anodyne	TBXAS1	65	52
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1Cn1ccnc1	ZINC000819195064	FF	On-Demand	Anodyne	CYP11B2	39	46
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1Cn1ccnc1	ZINC000819195064	FF	On-Demand	Anodyne	CYP17A1	18	41
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1Cn1ccnc1	ZINC000819195064	FF	On-Demand	Anodyne	CYP27B1	50	36
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1Cn1ccnc1	ZINC000819195064	FF	On-Demand	Anodyne	NAMPT	39	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1nnc2n1CCC2	ZINC000819195065	DC	On-Demand	Anodyne	PROC	45	32
O=C(NCc1ccc(C(=O)O)cc1)NCc1nnc2n1CCC2	ZINC000819195065	DC	On-Demand	Anodyne	TMPRSS11D	43	32
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccccc1N1CCCC1=O	ZINC000819195066	FF	On-Demand	Anodyne	AVPR2	24	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccccc1N1CCCC1=O	ZINC000819195066	FF	On-Demand	Anodyne	KCNQ2	72	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccccc1N1CCCC1=O	ZINC000819195066	FF	On-Demand	Anodyne	HDAC1	25	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccccc1N1CCCC1=O	ZINC000819195066	FF	On-Demand	Anodyne	NAMPT	19	40
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1OC(F)F	ZINC000819195067	FF	On-Demand	Anodyne	FURIN	41	33
O=C(NCc1ccc(C(=O)O)cc1)NCc1ccccc1OC(F)F	ZINC000819195067	FF	On-Demand	Anodyne	AMP1_PLAFQ	40	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)C2CC2)c1	ZINC000819195068	FG	On-Demand	Anodyne	KLKB1	25	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)C2CC2)c1	ZINC000819195068	FG	On-Demand	Anodyne	LTA4H	19	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)C2CC2)c1	ZINC000819195068	FG	On-Demand	Anodyne	CCR3	59	38
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)C2CC2)c1	ZINC000819195068	FG	On-Demand	Anodyne	ROCK2	20	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)C2CC2)c1	ZINC000819195068	FG	On-Demand	Anodyne	EPHX2	53	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)C2CC2)c1	ZINC000819195068	FG	On-Demand	Anodyne	PRMT3	46	36
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)C2CC2)c1	ZINC000819195068	FG	On-Demand	Anodyne	NAMPT	47	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(NC(=O)C2CC2)c1	ZINC000819195068	FG	On-Demand	Anodyne	KCNK3	56	49
O=C(NCc1ccc(C(=O)O)cc1)NOCc1ccccc1	ZINC000819195075	DE	On-Demand	Anodyne	PPIA	29	42
O=C(NCc1ccc(C(=O)O)cc1)NOCc1ccccc1	ZINC000819195075	DE	On-Demand	Anodyne	GRIN2B	15	43
O=C(NCc1ccc(C(=O)O)cc1)NOCc1ccccc1	ZINC000819195075	DE	On-Demand	Anodyne	PTGER1	15	43
O=C(NCc1ccc(C(=O)O)cc1)NOCc1ccccc1	ZINC000819195075	DE	On-Demand	Anodyne	CTSB	42	33
O=C(NCc1ccc(C(=O)O)cc1)NOCc1ccccc1	ZINC000819195075	DE	On-Demand	Anodyne	UL80	27	41
O=C(NCc1ccc(C(=O)O)cc1)NOCc1ccccc1	ZINC000819195075	DE	On-Demand	Anodyne	CAPNS1	44	36
O=C(NCc1ccc(C(=O)O)cc1)NOCc1ccccc1	ZINC000819195075	DE	On-Demand	Anodyne	HDAC1	17	45
O=C(NCc1ccc(C(=O)O)cc1)NOCc1ccccc1	ZINC000819195075	DE	On-Demand	Anodyne	HDAC2	18	45
O=C(NCc1ccc(C(=O)O)cc1)NOCc1ccccc1	ZINC000819195075	DE	On-Demand	Anodyne	FURIN	42	34
O=C(NCc1ccc(C(=O)O)cc1)NOCc1ccccc1	ZINC000819195075	DE	On-Demand	Anodyne	CAPN1	40	37
O=C(NCc1ccc(C(=O)O)cc1)NOCc1ccccc1	ZINC000819195075	DE	On-Demand	Anodyne	CAPN2	62	37
O=C(NCc1ccc(C(=O)O)cc1)NOCc1ccccc1	ZINC000819195075	DE	On-Demand	Anodyne	TPSAB1	29	40
O=C(NCc1ccc(C(=O)O)cc1)NOCc1ccccc1	ZINC000819195075	DE	On-Demand	Anodyne	NPR	52	33
O=C(NCc1ccc(C(=O)O)cc1)NOCc1ccccc1	ZINC000819195075	DE	On-Demand	Anodyne	SLC12A5	55	34
O=C(NCc1ccc(C(=O)O)cc1)NOCc1ccccc1	ZINC000819195075	DE	On-Demand	Anodyne	TMPRSS11D	73	35
O=C(NCc1ccc(C(=O)O)cc1)NOCc1ccccc1	ZINC000819195075	DE	On-Demand	Anodyne	PDS	55	38
O=C(NCc1ccc(C(=O)O)cc1)Nc1nnc(-c2ccco2)s1	ZINC000819195076	EF	On-Demand	Anodyne	ADORA2A	16	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-n2ccnn2)c1	ZINC000819195077	EE	On-Demand	Anodyne	ROCK2	17	43
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(-n2ccnn2)c1	ZINC000819195077	EE	On-Demand	Anodyne	NAMPT	51	39
O=C(NCc1ccc(C(=O)O)cc1)NCc1nc2cc(Cl)ccc2s1	ZINC000819195080	GH	On-Demand	Anodyne	AKR1B1	23	48
O=C(NCc1ccc(C(=O)O)cc1)NCc1nc2cc(Cl)ccc2s1	ZINC000819195080	GH	On-Demand	Anodyne	UL80	20	41
O=C(NCc1ccc(C(=O)O)cc1)NCc1nc2cc(Cl)ccc2s1	ZINC000819195080	GH	On-Demand	Anodyne	AGPAT2	17	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(CN2CCOC2=O)c1	ZINC000819195082	FF	On-Demand	Anodyne	CCR3	41	36
O=C(NCc1ccc(C(=O)O)cc1)Nc1cccc(CN2CCOC2=O)c1	ZINC000819195082	FF	On-Demand	Anodyne	NAMPT	34	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819195083	GE	On-Demand	Anodyne	CA2	28	51
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819195083	GE	On-Demand	Anodyne	CA1	30	51
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819195083	GE	On-Demand	Anodyne	KCNA5	29	50
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819195083	GE	On-Demand	Anodyne	CA4	19	51
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819195083	GE	On-Demand	Anodyne	EPHX2	42	41
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819195083	GE	On-Demand	Anodyne	TGM2	33	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819195083	GE	On-Demand	Anodyne	CA12	26	51
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819195083	GE	On-Demand	Anodyne	CA9	28	51
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819195083	GE	On-Demand	Anodyne	F13A1	34	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819195083	GE	On-Demand	Anodyne	CCR8	43	36
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819195083	GE	On-Demand	Anodyne	IDO1	35	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819195083	GE	On-Demand	Anodyne	NCE103	15	45
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819195083	GE	On-Demand	Anodyne	SFRP1	98	36
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819195083	GE	On-Demand	Anodyne	WNT3	53	32
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819195083	GE	On-Demand	Anodyne	MTCA1	38	51
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819195083	GE	On-Demand	Anodyne	P96878_MYCTU	46	51
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819195083	GE	On-Demand	Anodyne	NAMPT	88	60
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc(Cl)cc1Cl	ZINC000819195084	GF	On-Demand	Reactive	F10	15	41
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc(Cl)cc1Cl	ZINC000819195084	GF	On-Demand	Reactive	P2RX7	19	43
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc(Cl)cc1Cl	ZINC000819195084	GF	On-Demand	Reactive	ECR	18	42
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc(Cl)cc1Cl	ZINC000819195084	GF	On-Demand	Reactive	PYGL	17	51
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc(Cl)cc1Cl	ZINC000819195084	GF	On-Demand	Reactive	SLC6A9	46	34
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc(Cl)cc1Cl	ZINC000819195084	GF	On-Demand	Reactive	GPR35	31	40
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc(Cl)cc1Cl	ZINC000819195084	GF	On-Demand	Reactive	RPA1	46	35
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc2ccccc2c1	ZINC000819195086	FF	On-Demand	Reactive	CYSLTR1	22	47
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc2ccccc2c1	ZINC000819195086	FF	On-Demand	Reactive	GRIN2B	16	45
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc2ccccc2c1	ZINC000819195086	FF	On-Demand	Reactive	KCNJ11	50	33
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc2ccccc2c1	ZINC000819195086	FF	On-Demand	Reactive	UL80	30	43
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc2ccccc2c1	ZINC000819195086	FF	On-Demand	Reactive	HDAC1	19	45
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc2ccccc2c1	ZINC000819195086	FF	On-Demand	Reactive	CASP1	27	40
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc2ccccc2c1	ZINC000819195086	FF	On-Demand	Reactive	PIN1	30	40
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc2ccccc2c1	ZINC000819195086	FF	On-Demand	Reactive	NCEH1	17	40
O=C(NCc1ccc(C(=O)O)cc1)NNC(=O)c1ccc2ccccc2c1	ZINC000819195086	FF	On-Demand	Reactive	NAMPT	36	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2cnnn2)cc1	ZINC000819195087	ED	On-Demand	Anodyne	EPHX2	16	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2cnnn2)cc1	ZINC000819195087	ED	On-Demand	Anodyne	F7	15	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2cnnn2)cc1	ZINC000819195087	ED	On-Demand	Anodyne	PRMT3	40	35
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2cnnn2)cc1	ZINC000819195087	ED	On-Demand	Anodyne	KCNJ1	48	37
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2cnnn2)cc1	ZINC000819195087	ED	On-Demand	Anodyne	NAMPT	45	42
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(-n2cnnn2)cc1	ZINC000819195087	ED	On-Demand	Anodyne	RPA1	49	32
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(Cl)nc1	ZINC000819195088	DF	On-Demand	Anodyne	PPIA	15	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(Cl)nc1	ZINC000819195088	DF	On-Demand	Anodyne	ROCK2	17	44
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(Cl)nc1	ZINC000819195088	DF	On-Demand	Anodyne	EPHX2	17	40
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(Cl)nc1	ZINC000819195088	DF	On-Demand	Anodyne	NAMPT	54	59
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CN2C(=O)CNC2=O)cc1	ZINC000819195089	GD	On-Demand	Anodyne	EPHX2	19	46
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CN2C(=O)CNC2=O)cc1	ZINC000819195089	GD	On-Demand	Anodyne	NOD2	40	33
O=C(NCc1ccc(C(=O)O)cc1)Nc1ccc(CN2C(=O)CNC2=O)cc1	ZINC000819195089	GD	On-Demand	Anodyne	NAMPT	47	42
CCOC(=O)CC[C@@H](C)NC[C@H](O)c1cccc2ccccc12	ZINC000819195118	DG	On-Demand	Anodyne	ADRB2	24	47
CCOC(=O)CC[C@H](C)NC[C@H](O)c1cccc2ccccc12	ZINC000819195119	DG	On-Demand	Anodyne	ADRB2	24	47
C[C@@H](CNC[C@@H](O)c1ccc(F)cn1)c1nc(-c2ccccc2)no1	ZINC000819195126	EF	On-Demand	Anodyne	ADRB3	18	41
C[C@@H](CNC[C@H](O)c1ccc(F)cn1)c1nc(-c2ccccc2)no1	ZINC000819195127	EF	On-Demand	Anodyne	ADRB3	18	41
C[C@H](CNC[C@@H](O)c1ccc(F)cn1)c1nc(-c2ccccc2)no1	ZINC000819195128	EF	On-Demand	Anodyne	ADRB3	18	41
C[C@H](CNC[C@H](O)c1ccc(F)cn1)c1nc(-c2ccccc2)no1	ZINC000819195129	EF	On-Demand	Anodyne	ADRB3	18	41
C[C@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccc[nH]1	ZINC000819195145	DE	On-Demand	Bother	ADRB2	29	47
C[C@H](NC[C@H](O)COc1ccccc1[N+](=O)[O-])c1ccc[nH]1	ZINC000819195145	DE	On-Demand	Bother	ADRB1	40	43
C[C@@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccc[nH]1	ZINC000819195146	DE	On-Demand	Bother	ADRB2	29	47
C[C@@H](NC[C@@H](O)COc1ccccc1[N+](=O)[O-])c1ccc[nH]1	ZINC000819195146	DE	On-Demand	Bother	ADRB1	40	43
Cc1cncc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819195149	CF	On-Demand	Anodyne	ADRB2	18	41
Cc1cncc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819195149	CF	On-Demand	Anodyne	ADRB1	37	44
Cc1cncc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819195149	CF	On-Demand	Anodyne	ADRB3	54	44
Cc1cncc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819195150	CF	On-Demand	Anodyne	ADRB2	18	41
Cc1cncc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819195150	CF	On-Demand	Anodyne	ADRB1	37	44
Cc1cncc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819195150	CF	On-Demand	Anodyne	ADRB3	54	44
C=CCc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)c(OC)c1	ZINC000819195157	EF	On-Demand	Mild	ADRB2	23	45
C=CCc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)c(OC)c1	ZINC000819195157	EF	On-Demand	Mild	ADRB1	21	45
C=CCc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)c(OC)c1	ZINC000819195158	EF	On-Demand	Mild	ADRB2	23	45
C=CCc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)c(OC)c1	ZINC000819195158	EF	On-Demand	Mild	ADRB1	21	45
C=CCc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)c(OC)c1	ZINC000819195159	EF	On-Demand	Mild	ADRB2	23	45
C=CCc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)c(OC)c1	ZINC000819195159	EF	On-Demand	Mild	ADRB1	21	45
C=CCc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)c(OC)c1	ZINC000819195160	EF	On-Demand	Mild	ADRB2	23	45
C=CCc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)c(OC)c1	ZINC000819195160	EF	On-Demand	Mild	ADRB1	21	45
Cc1cncc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819195161	CE	On-Demand	Bother	CACNA1C	46	35
Cc1cncc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819195161	CE	On-Demand	Bother	CACNA1D	68	35
Cc1cncc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819195162	CE	On-Demand	Bother	CACNA1C	46	35
Cc1cncc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819195162	CE	On-Demand	Bother	CACNA1D	68	35
C[C@H](NC[C@H](O)COC(c1ccccc1)c1ccccc1)c1ccc[nH]1	ZINC000819195176	FH	On-Demand	Anodyne	ADRB2	17	41
C[C@@H](NC[C@@H](O)COC(c1ccccc1)c1ccccc1)c1ccc[nH]1	ZINC000819195178	FH	On-Demand	Anodyne	ADRB2	17	41
CSc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819195179	DF	On-Demand	Anodyne	ADRB2	31	47
CSc1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819195179	DF	On-Demand	Anodyne	ADRB1	34	44
CSc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819195180	DF	On-Demand	Anodyne	ADRB2	31	47
CSc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819195180	DF	On-Demand	Anodyne	ADRB1	34	44
CSc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819195181	DF	On-Demand	Anodyne	ADRB2	31	47
CSc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819195181	DF	On-Demand	Anodyne	ADRB1	34	44
CSc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819195182	DF	On-Demand	Anodyne	ADRB2	31	47
CSc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819195182	DF	On-Demand	Anodyne	ADRB1	34	44
C[C@@H](NC[C@@H](O)COc1cccc2ccccc12)c1ccc[nH]1	ZINC000819195183	DG	On-Demand	Anodyne	ADRB2	44	67
C[C@@H](NC[C@@H](O)COc1cccc2ccccc12)c1ccc[nH]1	ZINC000819195183	DG	On-Demand	Anodyne	ADRB1	48	55
C[C@@H](NC[C@@H](O)COc1cccc2ccccc12)c1ccc[nH]1	ZINC000819195183	DG	On-Demand	Anodyne	ADRB3	18	67
C[C@@H](NC[C@@H](O)COc1cccc2ccccc12)c1ccc[nH]1	ZINC000819195183	DG	On-Demand	Anodyne	CYP2D6	19	49
C[C@H](NC[C@H](O)COc1cccc2ccccc12)c1ccc[nH]1	ZINC000819195185	DG	On-Demand	Anodyne	ADRB2	44	67
C[C@H](NC[C@H](O)COc1cccc2ccccc12)c1ccc[nH]1	ZINC000819195185	DG	On-Demand	Anodyne	ADRB1	48	55
C[C@H](NC[C@H](O)COc1cccc2ccccc12)c1ccc[nH]1	ZINC000819195185	DG	On-Demand	Anodyne	ADRB3	18	67
C[C@H](NC[C@H](O)COc1cccc2ccccc12)c1ccc[nH]1	ZINC000819195185	DG	On-Demand	Anodyne	CYP2D6	19	49
CCOC(=O)CC[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195231	DD	On-Demand	Bother	ADRB2	27	41
CCOC(=O)CC[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195231	DD	On-Demand	Bother	ADRB1	26	41
CCOC(=O)CC[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195231	DD	On-Demand	Bother	CACNA1C	63	39
CCOC(=O)CC[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195231	DD	On-Demand	Bother	ADRB3	48	39
CCOC(=O)CC[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195231	DD	On-Demand	Bother	CACNA1D	94	39
CCOC(=O)CC[C@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195232	DD	On-Demand	Bother	ADRB2	27	41
CCOC(=O)CC[C@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195232	DD	On-Demand	Bother	ADRB1	26	41
CCOC(=O)CC[C@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195232	DD	On-Demand	Bother	CACNA1C	63	39
CCOC(=O)CC[C@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195232	DD	On-Demand	Bother	ADRB3	48	39
CCOC(=O)CC[C@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195232	DD	On-Demand	Bother	CACNA1D	94	39
CCOC(=O)CC[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195233	DD	On-Demand	Bother	ADRB2	27	41
CCOC(=O)CC[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195233	DD	On-Demand	Bother	ADRB1	26	41
CCOC(=O)CC[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195233	DD	On-Demand	Bother	CACNA1C	63	39
CCOC(=O)CC[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195233	DD	On-Demand	Bother	ADRB3	48	39
CCOC(=O)CC[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195233	DD	On-Demand	Bother	CACNA1D	94	39
CCOC(=O)CC[C@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195234	DD	On-Demand	Bother	ADRB2	27	41
CCOC(=O)CC[C@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195234	DD	On-Demand	Bother	ADRB1	26	41
CCOC(=O)CC[C@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195234	DD	On-Demand	Bother	CACNA1C	63	39
CCOC(=O)CC[C@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195234	DD	On-Demand	Bother	ADRB3	48	39
CCOC(=O)CC[C@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819195234	DD	On-Demand	Bother	CACNA1D	94	39
O[C@H](CNCc1nnc2n1CCC[C@H]2C(F)(F)F)c1cccc(Cl)c1	ZINC000819195267	FG	On-Demand	Anodyne	CYP3A4	40	33
O[C@@H](CNCc1nnc2n1CCC[C@H]2C(F)(F)F)c1cccc(Cl)c1	ZINC000819195268	FG	On-Demand	Anodyne	CYP3A4	40	33
O[C@H](CNCc1nnc2n1CCC[C@@H]2C(F)(F)F)c1cccc(Cl)c1	ZINC000819195269	FG	On-Demand	Anodyne	CYP3A4	40	33
O[C@@H](CNCc1nnc2n1CCC[C@@H]2C(F)(F)F)c1cccc(Cl)c1	ZINC000819195270	FG	On-Demand	Anodyne	CYP3A4	40	33
C[C@@H](NC[C@@H](O)COCc1ccccc1)c1ccc[nH]1	ZINC000819195273	CE	On-Demand	Anodyne	ADRB2	21	50
C[C@@H](NC[C@@H](O)COCc1ccccc1)c1ccc[nH]1	ZINC000819195273	CE	On-Demand	Anodyne	ADRB1	21	40
C[C@H](NC[C@H](O)COCc1ccccc1)c1ccc[nH]1	ZINC000819195274	CE	On-Demand	Anodyne	ADRB2	21	50
C[C@H](NC[C@H](O)COCc1ccccc1)c1ccc[nH]1	ZINC000819195274	CE	On-Demand	Anodyne	ADRB1	21	40
COc1ccccc1COC[C@H](O)CN[C@@H](C)c1ccc[nH]1	ZINC000819195277	DE	On-Demand	Anodyne	ADRB2	20	41
COc1ccccc1COC[C@@H](O)CN[C@H](C)c1ccc[nH]1	ZINC000819195278	DE	On-Demand	Anodyne	ADRB2	20	41
COc1ccccc1COC[C@H](O)CN[C@H](C)c1ccc[nH]1	ZINC000819195279	DE	On-Demand	Anodyne	ADRB2	20	41
COc1ccccc1COC[C@@H](O)CN[C@@H](C)c1ccc[nH]1	ZINC000819195280	DE	On-Demand	Anodyne	ADRB2	20	41
C[C@H](NC[C@H](O)c1cccc(Br)c1)c1ccc[nH]1	ZINC000819195285	DG	On-Demand	Anodyne	ADRB2	17	45
C[C@@H](NC[C@@H](O)c1cccc(Br)c1)c1ccc[nH]1	ZINC000819195287	DG	On-Demand	Anodyne	ADRB2	17	45
C[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc[nH]1	ZINC000819195310	DE	On-Demand	Bother	ADRB2	22	46
C[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc[nH]1	ZINC000819195310	DE	On-Demand	Bother	ADRB1	25	47
C[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc[nH]1	ZINC000819195310	DE	On-Demand	Bother	CACNA1D	41	34
C[C@@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc[nH]1	ZINC000819195311	DE	On-Demand	Bother	ADRB2	22	46
C[C@@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc[nH]1	ZINC000819195311	DE	On-Demand	Bother	ADRB1	25	47
C[C@@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)c1ccc[nH]1	ZINC000819195311	DE	On-Demand	Bother	CACNA1D	41	34
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819195320	DE	On-Demand	Anodyne	ADRB2	40	50
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819195320	DE	On-Demand	Anodyne	ADRB1	52	49
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819195320	DE	On-Demand	Anodyne	ADRB3	24	41
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819195320	DE	On-Demand	Anodyne	ABCB1	15	51
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819195321	DE	On-Demand	Anodyne	ADRB2	40	50
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819195321	DE	On-Demand	Anodyne	ADRB1	52	49
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819195321	DE	On-Demand	Anodyne	ADRB3	24	41
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)c2ccc[nH]2)cc1	ZINC000819195321	DE	On-Demand	Anodyne	ABCB1	15	51
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819195322	DE	On-Demand	Anodyne	ADRB2	40	50
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819195322	DE	On-Demand	Anodyne	ADRB1	52	49
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819195322	DE	On-Demand	Anodyne	ADRB3	24	41
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819195322	DE	On-Demand	Anodyne	ABCB1	15	51
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819195323	DE	On-Demand	Anodyne	ADRB2	40	50
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819195323	DE	On-Demand	Anodyne	ADRB1	52	49
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819195323	DE	On-Demand	Anodyne	ADRB3	24	41
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc[nH]2)cc1	ZINC000819195323	DE	On-Demand	Anodyne	ABCB1	15	51
C[C@@H](NC[C@@H](O)COc1ccc(Cl)c(Cl)c1)c1ccc[nH]1	ZINC000819195328	EG	On-Demand	Anodyne	ADRB2	34	48
C[C@@H](NC[C@@H](O)COc1ccc(Cl)c(Cl)c1)c1ccc[nH]1	ZINC000819195328	EG	On-Demand	Anodyne	ADRB1	31	45
C[C@@H](NC[C@@H](O)COc1ccc(Cl)c(Cl)c1)c1ccc[nH]1	ZINC000819195328	EG	On-Demand	Anodyne	GRIN1	26	41
C[C@H](NC[C@H](O)COc1ccc(Cl)c(Cl)c1)c1ccc[nH]1	ZINC000819195330	EG	On-Demand	Anodyne	ADRB2	34	48
C[C@H](NC[C@H](O)COc1ccc(Cl)c(Cl)c1)c1ccc[nH]1	ZINC000819195330	EG	On-Demand	Anodyne	ADRB1	31	45
C[C@H](NC[C@H](O)COc1ccc(Cl)c(Cl)c1)c1ccc[nH]1	ZINC000819195330	EG	On-Demand	Anodyne	GRIN1	26	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1COc2ccccc21	ZINC000819195446	DE	On-Demand	Anodyne	NAAA	23	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1COc2ccccc21	ZINC000819195447	DE	On-Demand	Anodyne	NAAA	23	47
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](c2ccccc2)C1	ZINC000819195574	CF	On-Demand	Anodyne	SLC18A3	46	43
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](c2ccccc2)C1	ZINC000819195574	CF	On-Demand	Anodyne	ADAM10	21	47
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](c2ccccc2)C1	ZINC000819195575	CF	On-Demand	Anodyne	SLC18A3	46	43
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](c2ccccc2)C1	ZINC000819195575	CF	On-Demand	Anodyne	ADAM10	21	47
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](c2ccccc2)C1	ZINC000819195576	CF	On-Demand	Anodyne	SLC18A3	46	43
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](c2ccccc2)C1	ZINC000819195576	CF	On-Demand	Anodyne	ADAM10	21	47
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](c2ccccc2)C1	ZINC000819195577	CF	On-Demand	Anodyne	SLC18A3	46	43
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](c2ccccc2)C1	ZINC000819195577	CF	On-Demand	Anodyne	ADAM10	21	47
O[C@H](CNCc1noc(C2CC2)n1)c1cccnc1	ZINC000819195705	CD	On-Demand	Anodyne	ADRB1	20	42
O[C@H](CNCc1noc(C2CC2)n1)c1cccnc1	ZINC000819195705	CD	On-Demand	Anodyne	ADRB3	86	42
O[C@@H](CNCc1noc(C2CC2)n1)c1cccnc1	ZINC000819195706	CD	On-Demand	Anodyne	ADRB1	20	42
O[C@@H](CNCc1noc(C2CC2)n1)c1cccnc1	ZINC000819195706	CD	On-Demand	Anodyne	ADRB3	86	42
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@@H](O)c1cccc(F)c1	ZINC000819195735	EE	On-Demand	Anodyne	ADRB2	23	41
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@H](O)c1cccc(F)c1	ZINC000819195736	EE	On-Demand	Anodyne	ADRB2	23	41
O=C(CNC(=O)C(F)=C1CCC1)NCCc1ccccc1	ZINC000819195739	CD	On-Demand	Anodyne	CA5B	17	44
O=C(CNC(=O)C(F)=C1CCC1)NCCc1ccccc1	ZINC000819195739	CD	On-Demand	Anodyne	CA5A	15	44
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@H](O)c1ccccc1Cl	ZINC000819195759	FF	On-Demand	Anodyne	NPBWR1	41	37
CN1CC[C@H](CNC[C@@H](O)c2cccnc2)[C@H]1c1ccc(Cl)c(F)c1	ZINC000819195783	FG	On-Demand	Anodyne	ADRB3	55	38
CN1CC[C@H](CNC[C@H](O)c2cccnc2)[C@H]1c1ccc(Cl)c(F)c1	ZINC000819195784	FG	On-Demand	Anodyne	ADRB3	55	38
CN1CC[C@H](CNC[C@@H](O)c2cccnc2)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000819195785	FG	On-Demand	Anodyne	ADRB3	55	38
CN1CC[C@H](CNC[C@H](O)c2cccnc2)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000819195786	FG	On-Demand	Anodyne	ADRB3	55	38
O=C(C(F)=C1CCC1)N1CC[C@H](c2ccccc2)C1	ZINC000819195833	CG	On-Demand	Anodyne	SLC18A3	65	45
O=C(C(F)=C1CCC1)N1CC[C@H](c2ccccc2)C1	ZINC000819195833	CG	On-Demand	Anodyne	RBP4	42	40
O=C(C(F)=C1CCC1)N1CC[C@H](c2ccccc2)C1	ZINC000819195833	CG	On-Demand	Anodyne	ADAM10	19	44
O=C(C(F)=C1CCC1)N1CC[C@@H](c2ccccc2)C1	ZINC000819195834	CG	On-Demand	Anodyne	SLC18A3	65	45
O=C(C(F)=C1CCC1)N1CC[C@@H](c2ccccc2)C1	ZINC000819195834	CG	On-Demand	Anodyne	RBP4	42	40
O=C(C(F)=C1CCC1)N1CC[C@@H](c2ccccc2)C1	ZINC000819195834	CG	On-Demand	Anodyne	ADAM10	19	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2noc(C3CC3)n2)CC1	ZINC000819195865	FE	On-Demand	Anodyne	GPR119	25	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2noc(C3CC3)n2)CC1	ZINC000819195865	FE	On-Demand	Anodyne	ETHR	50	32
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2noc(C3CC3)n2)CC1	ZINC000819195866	FE	On-Demand	Anodyne	GPR119	25	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2noc(C3CC3)n2)CC1	ZINC000819195866	FE	On-Demand	Anodyne	ETHR	50	32
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC(=O)NCCc1ccccc1	ZINC000819195898	FD	On-Demand	Anodyne	FPR1	41	35
C[C@H](CC(=O)NCc1ccc(N(C)C)c(F)c1)n1cccn1	ZINC000819195914	DE	On-Demand	Clean	UL54	69	33
C[C@@H](CC(=O)NCc1ccc(N(C)C)c(F)c1)n1cccn1	ZINC000819195915	DE	On-Demand	Clean	UL54	69	33
N#Cc1ccc([C@@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819195942	FI	On-Demand	Mild	ADRB2	75	56
N#Cc1ccc([C@@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819195942	FI	On-Demand	Mild	ADRB1	95	44
N#Cc1ccc([C@@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819195942	FI	On-Demand	Mild	MAOB	17	50
N#Cc1ccc([C@@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819195942	FI	On-Demand	Mild	ADRB3	108	48
N#Cc1ccc([C@@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819195942	FI	On-Demand	Mild	PTGER3	49	38
N#Cc1ccc([C@@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819195942	FI	On-Demand	Mild	FFAR1	24	44
N#Cc1ccc([C@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819195944	FI	On-Demand	Mild	ADRB2	75	56
N#Cc1ccc([C@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819195944	FI	On-Demand	Mild	ADRB1	95	44
N#Cc1ccc([C@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819195944	FI	On-Demand	Mild	MAOB	17	50
N#Cc1ccc([C@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819195944	FI	On-Demand	Mild	ADRB3	108	48
N#Cc1ccc([C@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819195944	FI	On-Demand	Mild	PTGER3	49	38
N#Cc1ccc([C@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819195944	FI	On-Demand	Mild	FFAR1	24	44
Cc1cccc2c1CCN2C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819195962	FG	On-Demand	Mild	PAPA1_CARPA	38	41
Cc1cccc2c1CCN2C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819195964	FG	On-Demand	Mild	PAPA1_CARPA	38	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)C1CC1	ZINC000819196003	FG	On-Demand	Anodyne	PGC	52	33
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)C1CC1	ZINC000819196003	FG	On-Demand	Anodyne	PAPA1_CARPA	30	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)C1CC1	ZINC000819196003	FG	On-Demand	Anodyne	CTSL	17	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)C1CC1	ZINC000819196003	FG	On-Demand	Anodyne	REN	60	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)C1CC1	ZINC000819196003	FG	On-Demand	Anodyne	FPR1	47	40
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)C1CC1	ZINC000819196005	FG	On-Demand	Anodyne	PGC	52	33
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)C1CC1	ZINC000819196005	FG	On-Demand	Anodyne	PAPA1_CARPA	30	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)C1CC1	ZINC000819196005	FG	On-Demand	Anodyne	CTSL	17	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)C1CC1	ZINC000819196005	FG	On-Demand	Anodyne	REN	60	41
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)C1CC1	ZINC000819196005	FG	On-Demand	Anodyne	FPR1	47	40
CON(C)C(=O)CCNCCc1cccc(OCc2ccccc2)c1	ZINC000819196030	EF	On-Demand	Anodyne	ALOX5	17	43
CON(C)C(=O)CCNCCc1cccc(OCc2ccccc2)c1	ZINC000819196030	EF	On-Demand	Anodyne	MAOB	33	41
CON(C)C(=O)CCNCCc1cccc(OCc2ccccc2)c1	ZINC000819196030	EF	On-Demand	Anodyne	PTGER2	17	44
CON(C)C(=O)CCNCCc1cccc(OCc2ccccc2)c1	ZINC000819196030	EF	On-Demand	Anodyne	LTA4H	19	43
CON(C)C(=O)CCNCCc1cccc(OCc2ccccc2)c1	ZINC000819196030	EF	On-Demand	Anodyne	PTGER4	15	44
CON(C)C(=O)CCNCCc1cccc(OCc2ccccc2)c1	ZINC000819196030	EF	On-Demand	Anodyne	PTGER3	46	35
CON(C)C(=O)CCNCCc1cccc(OCc2ccccc2)c1	ZINC000819196030	EF	On-Demand	Anodyne	FFAR1	53	48
CON(C)C(=O)CCNCCc1cccc(OCc2ccccc2)c1	ZINC000819196030	EF	On-Demand	Anodyne	FFAR4	16	41
CON(C)C(=O)CCNCCc1cccc(OCc2ccccc2)c1	ZINC000819196030	EF	On-Demand	Anodyne	CRTM	54	40
CON(C)C(=O)CCNCCc1cccc(OCc2ccccc2)c1	ZINC000819196030	EF	On-Demand	Anodyne	PDS	54	34
C=CCCn1cc(C(=O)NCc2ccc(N(C)C)c(F)c2)nn1	ZINC000819196035	DD	On-Demand	Mild	UL54	53	31
COc1ccccc1C[C@@H]1CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819196058	DF	On-Demand	Anodyne	ACKR3	73	35
COc1ccccc1C[C@@H]1CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819196060	DF	On-Demand	Anodyne	ACKR3	73	35
COc1ccccc1C[C@@H]1CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819196062	DF	On-Demand	Anodyne	ACKR3	73	35
COc1ccccc1C[C@@H]1CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819196064	DF	On-Demand	Anodyne	ACKR3	73	35
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCO[C@H](C(C)(C)C)C2)CC1	ZINC000819196091	GG	On-Demand	Anodyne	GPR119	21	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCO[C@H](C(C)(C)C)C2)CC1	ZINC000819196094	GG	On-Demand	Anodyne	GPR119	21	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCO[C@@H](C(C)(C)C)C2)CC1	ZINC000819196096	GG	On-Demand	Anodyne	GPR119	21	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCO[C@@H](C(C)(C)C)C2)CC1	ZINC000819196098	GG	On-Demand	Anodyne	GPR119	21	40
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(CN2CCSCC2)c1	ZINC000819196118	EF	On-Demand	Anodyne	CCR3	27	40
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(CN2CCSCC2)c1	ZINC000819196120	EF	On-Demand	Anodyne	CCR3	27	40
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(CN2CCSCC2)c1	ZINC000819196122	EF	On-Demand	Anodyne	CCR3	27	40
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(CN2CCSCC2)c1	ZINC000819196132	EF	On-Demand	Anodyne	CCR3	27	40
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cccc2ccccc12)C1CC1	ZINC000819196198	FH	On-Demand	Anodyne	PGC	49	32
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cccc2ccccc12)C1CC1	ZINC000819196198	FH	On-Demand	Anodyne	REN	54	39
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cccc2ccccc12)C1CC1	ZINC000819196198	FH	On-Demand	Anodyne	FPR1	44	36
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)c1ccc(F)c(F)c1	ZINC000819196201	GI	On-Demand	Anodyne	ADRB2	80	55
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)c1ccc(F)c(F)c1	ZINC000819196201	GI	On-Demand	Anodyne	ADRB1	94	56
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)c1ccc(F)c(F)c1	ZINC000819196201	GI	On-Demand	Anodyne	ADRB3	125	56
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)c1ccc(F)c(F)c1	ZINC000819196201	GI	On-Demand	Anodyne	PTGER3	37	41
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)c1ccc(F)c(F)c1	ZINC000819196201	GI	On-Demand	Anodyne	FFAR1	17	40
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)c1ccc(F)c(F)c1	ZINC000819196203	GI	On-Demand	Anodyne	ADRB2	80	55
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)c1ccc(F)c(F)c1	ZINC000819196203	GI	On-Demand	Anodyne	ADRB1	94	56
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)c1ccc(F)c(F)c1	ZINC000819196203	GI	On-Demand	Anodyne	ADRB3	125	56
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)c1ccc(F)c(F)c1	ZINC000819196203	GI	On-Demand	Anodyne	PTGER3	37	41
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)c1ccc(F)c(F)c1	ZINC000819196203	GI	On-Demand	Anodyne	FFAR1	17	40
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccccc1Br)C1CC1	ZINC000819196219	GG	On-Demand	Anodyne	PAPA1_CARPA	28	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccccc1Br)C1CC1	ZINC000819196219	GG	On-Demand	Anodyne	REN	44	38
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccccc1Br)C1CC1	ZINC000819196219	GG	On-Demand	Anodyne	FPR1	41	37
CC(C)c1ccc2c(c1)[C@H](NC[C@H](O)c1cccnc1)CCC2	ZINC000819196221	DH	On-Demand	Anodyne	ADRB3	58	46
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccccc1Br)C1CC1	ZINC000819196223	GG	On-Demand	Anodyne	PAPA1_CARPA	28	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccccc1Br)C1CC1	ZINC000819196223	GG	On-Demand	Anodyne	REN	44	38
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccccc1Br)C1CC1	ZINC000819196223	GG	On-Demand	Anodyne	FPR1	41	37
CC(C)c1ccc2c(c1)[C@H](NC[C@@H](O)c1cccnc1)CCC2	ZINC000819196224	DH	On-Demand	Anodyne	ADRB3	58	46
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819196317	IH	On-Demand	Anodyne	ADRB2	116	52
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819196317	IH	On-Demand	Anodyne	ADRB1	124	46
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819196317	IH	On-Demand	Anodyne	ADRB3	207	48
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819196317	IH	On-Demand	Anodyne	PTGER3	47	33
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819196317	IH	On-Demand	Anodyne	FFAR1	32	42
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819196321	IH	On-Demand	Anodyne	ADRB2	116	52
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819196321	IH	On-Demand	Anodyne	ADRB1	124	46
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819196321	IH	On-Demand	Anodyne	ADRB3	207	48
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819196321	IH	On-Demand	Anodyne	PTGER3	47	33
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819196321	IH	On-Demand	Anodyne	FFAR1	32	42
O[C@@H](CNCc1cccnc1OCC(F)F)c1cccc(Cl)c1	ZINC000819196331	EG	On-Demand	Anodyne	ADRB1	28	40
O[C@@H](CNCc1cccnc1OCC(F)F)c1cccc(Cl)c1	ZINC000819196331	EG	On-Demand	Anodyne	ADRB3	41	40
Cc1c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n[nH]c1C(F)(F)F	ZINC000819196336	GG	On-Demand	Mild	PAPA1_CARPA	38	43
Cc1c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n[nH]c1C(F)(F)F	ZINC000819196337	GG	On-Demand	Mild	PAPA1_CARPA	38	43
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2ccccc2F)C1	ZINC000819196349	DE	On-Demand	Anodyne	GPR119	29	46
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2ccccc2F)C1	ZINC000819196350	DE	On-Demand	Anodyne	GPR119	29	46
CC(C)(C)OC(=O)N1CC(CNCCS(=O)(=O)c2ccc(C#N)cn2)C1	ZINC000819196355	GD	On-Demand	Mild	GPR119	43	44
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819196357	FF	On-Demand	Anodyne	ADRB2	28	50
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819196357	FF	On-Demand	Anodyne	ADRB1	54	34
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819196357	FF	On-Demand	Anodyne	ADRB3	17	40
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819196357	FF	On-Demand	Anodyne	ABCB1	45	46
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819196358	FF	On-Demand	Anodyne	ADRB2	28	50
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819196358	FF	On-Demand	Anodyne	ADRB1	54	34
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819196358	FF	On-Demand	Anodyne	ADRB3	17	40
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819196358	FF	On-Demand	Anodyne	ABCB1	45	46
CC(C)(C)OC(=O)N1CC(CNCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819196363	FG	On-Demand	Anodyne	CACNA1I	50	38
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819196375	FG	On-Demand	Anodyne	RBP4	47	33
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819196375	FG	On-Demand	Anodyne	SFRP1	50	42
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819196376	FG	On-Demand	Anodyne	RBP4	47	33
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819196376	FG	On-Demand	Anodyne	SFRP1	50	42
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819196381	FD	On-Demand	Mild	ADRB1	55	38
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819196381	FD	On-Demand	Mild	GPR119	30	49
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819196382	FD	On-Demand	Mild	ADRB1	55	38
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819196382	FD	On-Demand	Mild	GPR119	30	49
CC(=O)Nc1cccc(CC(=O)NCCCNc2ncccn2)c1	ZINC000819196390	ED	On-Demand	Anodyne	PTGIR	17	40
O[C@H](CN[C@@H]1CCCN(c2ccccc2F)C1)c1cccnc1	ZINC000819196391	DF	On-Demand	Anodyne	ADRB3	67	47
O[C@H](CN[C@H]1CCCN(c2ccccc2F)C1)c1cccnc1	ZINC000819196392	DF	On-Demand	Anodyne	ADRB3	67	47
O[C@@H](CN[C@@H]1CCCN(c2ccccc2F)C1)c1cccnc1	ZINC000819196393	DF	On-Demand	Anodyne	ADRB3	67	47
O[C@@H](CN[C@H]1CCCN(c2ccccc2F)C1)c1cccnc1	ZINC000819196394	DF	On-Demand	Anodyne	ADRB3	67	47
O=C(Cn1cc(C(=O)O)c2ccccc21)Nc1ccc(NC(=O)C2CC2)cc1	ZINC000819196422	GG	On-Demand	Anodyne	CNR1	18	42
O=C(Cn1cc(C(=O)O)c2ccccc21)Nc1ccc(NC(=O)C2CC2)cc1	ZINC000819196422	GG	On-Demand	Anodyne	CNR2	24	42
O[C@H](CNCc1cccnc1OCC(F)F)c1cccc(Cl)c1	ZINC000819196460	EG	On-Demand	Anodyne	ADRB1	28	40
O[C@H](CNCc1cccnc1OCC(F)F)c1cccc(Cl)c1	ZINC000819196460	EG	On-Demand	Anodyne	ADRB3	41	40
O=C(Nc1cccc(CN2CCSCC2)c1)C(F)=C1CCC1	ZINC000819196461	DH	On-Demand	Anodyne	CCR3	26	40
O=C(Nc1cccc(CN2CCSCC2)c1)C(F)=C1CCC1	ZINC000819196461	DH	On-Demand	Anodyne	FAAH	16	40
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)c1c(F)cccc1F	ZINC000819196462	GI	On-Demand	Anodyne	ADRB2	58	48
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)c1c(F)cccc1F	ZINC000819196462	GI	On-Demand	Anodyne	ADRB1	74	48
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)c1c(F)cccc1F	ZINC000819196462	GI	On-Demand	Anodyne	ADRB3	74	48
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)c1c(F)cccc1F	ZINC000819196462	GI	On-Demand	Anodyne	FFAR1	19	42
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)c1c(F)cccc1F	ZINC000819196463	GI	On-Demand	Anodyne	ADRB2	58	48
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)c1c(F)cccc1F	ZINC000819196463	GI	On-Demand	Anodyne	ADRB1	74	48
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)c1c(F)cccc1F	ZINC000819196463	GI	On-Demand	Anodyne	ADRB3	74	48
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)c1c(F)cccc1F	ZINC000819196463	GI	On-Demand	Anodyne	FFAR1	19	42
CC(=O)Nc1cccc(CC(=O)NCc2ccc3c(c2)CCCN3C)c1	ZINC000819196466	FF	On-Demand	Clean	PTGIR	15	40
CC(=O)Nc1cccc(CC(=O)NCc2ccc3c(c2)CCCN3C)c1	ZINC000819196466	FF	On-Demand	Clean	NOS1	16	44
CC(=O)Nc1cccc(CC(=O)NCc2ccc3c(c2)CCCN3C)c1	ZINC000819196466	FF	On-Demand	Clean	TAAR1	23	40
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819196481	FF	On-Demand	Anodyne	ADRB2	27	49
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819196481	FF	On-Demand	Anodyne	ADRB1	38	49
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819196481	FF	On-Demand	Anodyne	ADRB3	58	49
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000819196483	FF	On-Demand	Anodyne	ADRB2	27	49
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000819196483	FF	On-Demand	Anodyne	ADRB1	38	49
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000819196483	FF	On-Demand	Anodyne	ADRB3	58	49
O[C@H](CNCc1cccnc1OCC(F)F)c1cccnc1	ZINC000819196500	DD	On-Demand	Anodyne	ADRB2	19	42
O[C@H](CNCc1cccnc1OCC(F)F)c1cccnc1	ZINC000819196500	DD	On-Demand	Anodyne	ADRB1	22	42
O[C@H](CNCc1cccnc1OCC(F)F)c1cccnc1	ZINC000819196500	DD	On-Demand	Anodyne	ADRB3	79	43
O[C@@H](CNCc1cccnc1OCC(F)F)c1cccnc1	ZINC000819196502	DD	On-Demand	Anodyne	ADRB2	19	42
O[C@@H](CNCc1cccnc1OCC(F)F)c1cccnc1	ZINC000819196502	DD	On-Demand	Anodyne	ADRB1	22	42
O[C@@H](CNCc1cccnc1OCC(F)F)c1cccnc1	ZINC000819196502	DD	On-Demand	Anodyne	ADRB3	79	43
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1ccc(Cl)c(F)c1	ZINC000819196503	EE	On-Demand	Anodyne	ADRB3	50	45
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1ccc(Cl)c(F)c1	ZINC000819196505	EE	On-Demand	Anodyne	ADRB3	50	45
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1ccc(Cl)c(F)c1	ZINC000819196508	EE	On-Demand	Anodyne	ADRB3	50	45
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1ccc(Cl)c(F)c1	ZINC000819196510	EE	On-Demand	Anodyne	ADRB3	50	45
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccccc1C(F)(F)F)C1CC1	ZINC000819196513	GH	On-Demand	Anodyne	REN	41	38
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccccc1C(F)(F)F)C1CC1	ZINC000819196513	GH	On-Demand	Anodyne	FPR1	40	36
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccccc1C(F)(F)F)C1CC1	ZINC000819196516	GH	On-Demand	Anodyne	REN	41	38
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccccc1C(F)(F)F)C1CC1	ZINC000819196516	GH	On-Demand	Anodyne	FPR1	40	36
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cccnc1)C1CC1	ZINC000819196545	DE	On-Demand	Anodyne	ADRB2	19	40
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cccnc1)C1CC1	ZINC000819196545	DE	On-Demand	Anodyne	ADRB1	22	40
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cccnc1)C1CC1	ZINC000819196545	DE	On-Demand	Anodyne	ADRB3	90	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1cccnc1)C1CC1	ZINC000819196548	DE	On-Demand	Anodyne	ADRB2	19	40
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1cccnc1)C1CC1	ZINC000819196548	DE	On-Demand	Anodyne	ADRB1	22	40
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1cccnc1)C1CC1	ZINC000819196548	DE	On-Demand	Anodyne	ADRB3	90	42
CNC(=O)[C@@H]1CCC[C@H]1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819196577	FD	On-Demand	Anodyne	GPR119	25	40
CNC(=O)[C@@H]1CCC[C@H]1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819196579	FD	On-Demand	Anodyne	GPR119	25	40
CNC(=O)[C@@H]1CCC[C@@H]1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819196582	FD	On-Demand	Anodyne	GPR119	25	40
CNC(=O)[C@@H]1CCC[C@@H]1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819196584	FD	On-Demand	Anodyne	GPR119	25	40
CN1CC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)[C@H]1c1ccc(Cl)c(F)c1	ZINC000819196589	GI	On-Demand	Anodyne	CYP3A4	40	31
CN1CC[C@H](CNC[C@H](O)c2cccc(Cl)c2)[C@H]1c1ccc(Cl)c(F)c1	ZINC000819196591	GI	On-Demand	Anodyne	CYP3A4	40	31
CN1CC[C@H](CNC[C@H](O)c2cccc(Cl)c2)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000819196593	GI	On-Demand	Anodyne	CYP3A4	40	31
CN1CC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000819196595	GI	On-Demand	Anodyne	CYP3A4	40	31
C[C@H](CC(=O)NNC(=O)CCOc1ccccc1)n1cccn1	ZINC000819196598	DD	On-Demand	Reactive	CYP26A1	41	35
C[C@@H](CC(=O)NNC(=O)CCOc1ccccc1)n1cccn1	ZINC000819196599	DD	On-Demand	Reactive	CYP26A1	41	35
C=C(C)C(C)(C)C(=O)NNC(=O)CCOc1ccccc1	ZINC000819196605	CE	On-Demand	Reactive	LTA4H	28	41
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(CN2CCCCCC2)c1	ZINC000819196629	EG	On-Demand	Anodyne	HRH2	32	41
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(CN2CCCCCC2)c1	ZINC000819196629	EG	On-Demand	Anodyne	CHRM3	18	41
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(CN2CCCCCC2)c1	ZINC000819196629	EG	On-Demand	Anodyne	SIGMAR1	19	41
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(CN2CCCCCC2)c1	ZINC000819196629	EG	On-Demand	Anodyne	BDKRB1	34	40
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(CN2CCCCCC2)c1	ZINC000819196630	EG	On-Demand	Anodyne	HRH2	32	41
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(CN2CCCCCC2)c1	ZINC000819196630	EG	On-Demand	Anodyne	CHRM3	18	41
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(CN2CCCCCC2)c1	ZINC000819196630	EG	On-Demand	Anodyne	SIGMAR1	19	41
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(CN2CCCCCC2)c1	ZINC000819196630	EG	On-Demand	Anodyne	BDKRB1	34	40
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(CN2CCCCCC2)c1	ZINC000819196631	EG	On-Demand	Anodyne	HRH2	32	41
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(CN2CCCCCC2)c1	ZINC000819196631	EG	On-Demand	Anodyne	CHRM3	18	41
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(CN2CCCCCC2)c1	ZINC000819196631	EG	On-Demand	Anodyne	SIGMAR1	19	41
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(CN2CCCCCC2)c1	ZINC000819196631	EG	On-Demand	Anodyne	BDKRB1	34	40
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819196639	GD	On-Demand	Mild	ADRB1	64	41
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819196639	GD	On-Demand	Mild	GPR119	22	43
O=C(NCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)OCc1ccccc1	ZINC000819196640	II	On-Demand	Anodyne	GRIN2B	26	40
O=C(NCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)OCc1ccccc1	ZINC000819196640	II	On-Demand	Anodyne	CTSL	36	40
O=C(NCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)OCc1ccccc1	ZINC000819196640	II	On-Demand	Anodyne	P2RY1	22	40
O=C(NCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)OCc1ccccc1	ZINC000819196640	II	On-Demand	Anodyne	CCR1	29	40
O=C(NCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)OCc1ccccc1	ZINC000819196640	II	On-Demand	Anodyne	PREP	23	50
O=C(NCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)OCc1ccccc1	ZINC000819196640	II	On-Demand	Anodyne	CTSS	35	40
O=C(NCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)OCc1ccccc1	ZINC000819196640	II	On-Demand	Anodyne	CCR2	22	41
O=C(NCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)OCc1ccccc1	ZINC000819196640	II	On-Demand	Anodyne	CAPN2	57	32
O=C(NCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)OCc1ccccc1	ZINC000819196640	II	On-Demand	Anodyne	EPHX2	47	43
O=C(NCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)OCc1ccccc1	ZINC000819196640	II	On-Demand	Anodyne	TGM2	29	45
O=C(NCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)OCc1ccccc1	ZINC000819196640	II	On-Demand	Anodyne	NPR	54	33
O=C(NCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)OCc1ccccc1	ZINC000819196640	II	On-Demand	Anodyne	ETHR	41	34
COC(=O)N(C)CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196641	FF	On-Demand	Anodyne	EPHX2	54	47
O=C(NCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)OCC(F)(F)F	ZINC000819196642	IH	On-Demand	Anodyne	EPHX2	41	43
O=C(NCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)OCC(F)(F)F	ZINC000819196642	IH	On-Demand	Anodyne	ETHR	55	35
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819196643	GD	On-Demand	Mild	ADRB1	64	41
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819196643	GD	On-Demand	Mild	GPR119	22	43
O=C(c1cc[n+]([O-])cc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196645	FG	On-Demand	Anodyne	EPHX2	44	48
O=C(c1cc[n+]([O-])cc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196645	FG	On-Demand	Anodyne	L3MBTL3	43	35
CC(C)(C)OC(=O)NCCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196649	IJ	On-Demand	Anodyne	EPHX2	48	45
CC(C)(C)OC(=O)NCCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196649	IJ	On-Demand	Anodyne	ETHR	56	33
C=C(CO)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196652	EF	On-Demand	Mild	EPHX2	44	41
C=C(CO)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819196656	CD	On-Demand	Mild	ABCB1	16	45
CC(C)(C)OC(=O)NC1(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CC1	ZINC000819196658	II	On-Demand	Anodyne	EPHX2	49	40
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)cc1	ZINC000819196659	FF	On-Demand	Anodyne	ADRB2	25	42
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)cc1	ZINC000819196659	FF	On-Demand	Anodyne	ADRB1	42	38
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)cc1	ZINC000819196660	FF	On-Demand	Anodyne	ADRB2	25	42
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)cc1	ZINC000819196660	FF	On-Demand	Anodyne	ADRB1	42	38
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)cc1	ZINC000819196661	FF	On-Demand	Anodyne	ADRB2	25	42
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)cc1	ZINC000819196661	FF	On-Demand	Anodyne	ADRB1	42	38
O=C(C[C@H]1C=CS(=O)(=O)C1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196662	HG	On-Demand	Anodyne	EPHX2	28	41
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)cc1	ZINC000819196663	FF	On-Demand	Anodyne	ADRB2	25	42
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)cc1	ZINC000819196663	FF	On-Demand	Anodyne	ADRB1	42	38
O=C(C[C@@H]1C=CS(=O)(=O)C1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196664	HG	On-Demand	Anodyne	EPHX2	28	41
O=C(NCCc1ccc(Br)cc1Cl)c1ccc(CN2CCCCC2=O)cc1	ZINC000819196667	IJ	On-Demand	Anodyne	MC5R	20	42
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc2ccccc12	ZINC000819196668	GJ	On-Demand	Mild	PAPA1_CARPA	53	44
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc2ccccc12	ZINC000819196668	GJ	On-Demand	Mild	CTSL	15	44
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cccc2ccccc12	ZINC000819196668	GJ	On-Demand	Mild	FPR1	41	36
CC(C)(C)C(=O)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196676	FH	On-Demand	Anodyne	EPHX2	44	43
CCC(=O)c1cc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)ccc1F	ZINC000819196682	HK	On-Demand	Anodyne	CCR1	28	40
CCC(=O)c1cc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)ccc1F	ZINC000819196682	HK	On-Demand	Anodyne	EPHX2	41	41
CCC(=O)c1cc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)ccc1F	ZINC000819196682	HK	On-Demand	Anodyne	L3MBTL3	45	35
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819196686	GD	On-Demand	Anodyne	EDNRB	41	35
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819196686	GD	On-Demand	Anodyne	BMP1	19	40
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819196687	GD	On-Demand	Anodyne	EDNRB	41	35
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819196687	GD	On-Demand	Anodyne	BMP1	19	40
Cc1nc(CCC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cs1	ZINC000819196688	GJ	On-Demand	Anodyne	EPHX2	27	41
Cc1nc(CCC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cs1	ZINC000819196688	GJ	On-Demand	Anodyne	ETHR	69	38
CC(C)(C)OC(=O)N1CC(CNCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819196693	GD	On-Demand	Bother	GPR119	41	38
CCN1CCC[C@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819196695	FE	On-Demand	Mild	PAPA1_CARPA	38	49
CCN1CCC[C@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819196697	FE	On-Demand	Mild	PAPA1_CARPA	38	49
O[C@H](CN[C@@H]1CC[C@@H]2SCCS[C@@H]21)COc1ccc(Cl)cc1	ZINC000819196699	FG	On-Demand	Anodyne	ADRB1	35	40
O[C@H](CN[C@@H]1CC[C@H]2SCCS[C@H]12)COc1ccc(Cl)cc1	ZINC000819196701	FG	On-Demand	Anodyne	ADRB1	35	40
O[C@H](CN[C@@H]1CC[C@H]2SCCS[C@@H]12)COc1ccc(Cl)cc1	ZINC000819196703	FG	On-Demand	Anodyne	ADRB1	35	40
O=C(CCCn1ccccc1=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196704	HH	On-Demand	Anodyne	EPHX2	33	41
O=C(CCCn1ccccc1=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196704	HH	On-Demand	Anodyne	DUT	19	40
O=C(CCCn1ccccc1=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196704	HH	On-Demand	Anodyne	ETHR	47	34
O[C@H](CN[C@@H]1CC[C@@H]2SCCS[C@H]21)COc1ccc(Cl)cc1	ZINC000819196705	FG	On-Demand	Anodyne	ADRB1	35	40
COc1cccc([C@H](O)C(=O)N2CCc3cc(OC)c(Cl)cc3C2)c1	ZINC000819196709	FF	On-Demand	Anodyne	DRD4	44	35
COc1cccc([C@H](O)C(=O)N2CCc3cc(OC)c(Cl)cc3C2)c1	ZINC000819196709	FF	On-Demand	Anodyne	ABCB1B	40	33
COc1cccc([C@H](O)C(=O)N2CCc3cc(OC)c(Cl)cc3C2)c1	ZINC000819196709	FF	On-Demand	Anodyne	ABCB1	19	44
O=C(N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C1(F)CCCC1	ZINC000819196710	FJ	On-Demand	Anodyne	EPHX2	49	42
O=C(COCc1ccccn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196714	GH	On-Demand	Anodyne	EPHX2	34	44
O=C(COCc1ccccn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196714	GH	On-Demand	Anodyne	ETHR	40	32
O[C@H](CN[C@@H]1CC[C@H]2SCCS[C@@H]12)COc1ccccc1F	ZINC000819196717	EF	On-Demand	Anodyne	ADRB2	22	42
O[C@H](CN[C@@H]1CC[C@@H]2SCCS[C@H]21)COc1ccccc1F	ZINC000819196718	EF	On-Demand	Anodyne	ADRB2	22	42
O[C@H](CN[C@@H]1CC[C@H]2SCCS[C@H]12)COc1ccccc1F	ZINC000819196719	EF	On-Demand	Anodyne	ADRB2	22	42
O[C@H](CN[C@@H]1CC[C@@H]2SCCS[C@@H]21)COc1ccccc1F	ZINC000819196720	EF	On-Demand	Anodyne	ADRB2	22	42
CC(=O)c1cccc(OC[C@@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000819196721	GE	On-Demand	Anodyne	ADRB2	22	43
CC(=O)c1cccc(OC[C@@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000819196721	GE	On-Demand	Anodyne	ADRB1	40	38
CC(=O)c1cccc(OC[C@@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000819196721	GE	On-Demand	Anodyne	ABCB1	25	48
CC(=O)c1cccc(OC[C@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000819196722	GE	On-Demand	Anodyne	ADRB2	22	43
CC(=O)c1cccc(OC[C@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000819196722	GE	On-Demand	Anodyne	ADRB1	40	38
CC(=O)c1cccc(OC[C@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000819196722	GE	On-Demand	Anodyne	ABCB1	25	48
CC(C)(C)OC(=O)NCCOCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196723	IH	On-Demand	Anodyne	EPHX2	37	43
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819196724	EE	On-Demand	Anodyne	GPR119	30	48
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819196725	EE	On-Demand	Anodyne	GPR119	30	48
O=C(C1SCCS1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196727	GI	On-Demand	Anodyne	EPHX2	48	49
O=C([C@H]1CC(=O)N(c2cn[nH]c2)C1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196742	HG	On-Demand	Anodyne	EPHX2	19	41
O=C([C@@H]1CC(=O)N(c2cn[nH]c2)C1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196744	HG	On-Demand	Anodyne	EPHX2	19	41
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)cc1	ZINC000819196747	GF	On-Demand	Anodyne	ADRB2	40	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)cc1	ZINC000819196747	GF	On-Demand	Anodyne	ADRB1	70	45
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)cc1	ZINC000819196747	GF	On-Demand	Anodyne	ADRB3	48	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)cc1	ZINC000819196749	GF	On-Demand	Anodyne	ADRB2	40	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)cc1	ZINC000819196749	GF	On-Demand	Anodyne	ADRB1	70	45
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)cc1	ZINC000819196749	GF	On-Demand	Anodyne	ADRB3	48	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)cc1	ZINC000819196751	GF	On-Demand	Anodyne	ADRB2	40	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)cc1	ZINC000819196751	GF	On-Demand	Anodyne	ADRB1	70	45
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)cc1	ZINC000819196751	GF	On-Demand	Anodyne	ADRB3	48	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)cc1	ZINC000819196752	GF	On-Demand	Anodyne	ADRB2	40	42
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)cc1	ZINC000819196752	GF	On-Demand	Anodyne	ADRB1	70	45
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)cc1	ZINC000819196752	GF	On-Demand	Anodyne	ADRB3	48	42
O=C(NCCCNc1ncccn1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819196753	FG	On-Demand	Anodyne	TBK1	69	37
CC#CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196756	DG	On-Demand	Mild	EPHX2	46	45
CC(C)(C)OC(=O)NCCCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196765	IJ	On-Demand	Anodyne	EPHX2	41	43
CC(C)(C)OC(=O)NCCCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196765	IJ	On-Demand	Anodyne	ETHR	46	34
O[C@@H](CN[C@@H]1CCCN(c2ccccc2F)C1)c1cccc(F)c1	ZINC000819196767	EG	On-Demand	Anodyne	SLC6A2	15	43
O[C@@H](CN[C@@H]1CCCN(c2ccccc2F)C1)c1cccc(F)c1	ZINC000819196767	EG	On-Demand	Anodyne	KCNQ2	29	40
O[C@@H](CN[C@H]1CCCN(c2ccccc2F)C1)c1cccc(F)c1	ZINC000819196768	EG	On-Demand	Anodyne	SLC6A2	15	43
O[C@@H](CN[C@H]1CCCN(c2ccccc2F)C1)c1cccc(F)c1	ZINC000819196768	EG	On-Demand	Anodyne	KCNQ2	29	40
O[C@H](CN[C@H]1CCCN(c2ccccc2F)C1)c1cccc(F)c1	ZINC000819196769	EG	On-Demand	Anodyne	SLC6A2	15	43
O[C@H](CN[C@H]1CCCN(c2ccccc2F)C1)c1cccc(F)c1	ZINC000819196769	EG	On-Demand	Anodyne	KCNQ2	29	40
C/C=C(/C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196770	EI	On-Demand	Anodyne	EPHX2	50	43
O[C@H](CN[C@@H]1CCCN(c2ccccc2F)C1)c1cccc(F)c1	ZINC000819196771	EG	On-Demand	Anodyne	SLC6A2	15	43
O[C@H](CN[C@@H]1CCCN(c2ccccc2F)C1)c1cccc(F)c1	ZINC000819196771	EG	On-Demand	Anodyne	KCNQ2	29	40
C/C=C(\C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196774	EI	On-Demand	Anodyne	EPHX2	50	43
O=C(c1ccc2nnc(S)n2c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196779	HH	On-Demand	Anodyne	EPHX2	33	42
O=C(c1ccnc(F)c1F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196789	GI	On-Demand	Anodyne	EPHX2	46	43
O=Cc1ccc(OCC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1	ZINC000819196795	HI	On-Demand	Anodyne	EPHX2	40	43
O=Cc1ccc(OCC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1	ZINC000819196795	HI	On-Demand	Anodyne	TRAR	22	43
CCc1nn(C)c(Cl)c1C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819196797	HI	On-Demand	Anodyne	CNR1	15	40
O=C(CCCn1cccn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196801	GH	On-Demand	Anodyne	EPHX2	36	44
O=C(CCCn1cccn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196801	GH	On-Demand	Anodyne	ETHR	60	35
C#CCOCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196802	FG	On-Demand	Mild	EPHX2	31	42
C#CCOCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196802	FG	On-Demand	Mild	ETHR	51	32
CC(C)(C)OC(=O)NCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196803	HI	On-Demand	Anodyne	EPHX2	47	45
CC(C)(C)OC(=O)NCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196803	HI	On-Demand	Anodyne	ETHR	57	33
O=C1N[C@H](C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CO1	ZINC000819196807	FE	On-Demand	Anodyne	EPHX2	40	43
C=CC(=O)NCc1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1	ZINC000819196808	II	On-Demand	Anodyne	EPHX2	41	46
CN1N=C(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CCC1=O	ZINC000819196813	GF	On-Demand	Anodyne	EPHX2	39	40
C/C=C\C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196814	DH	On-Demand	Anodyne	EPHX2	44	42
C/C=C/C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196815	DH	On-Demand	Anodyne	EPHX2	44	42
O=C(c1cccnc1S)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196818	GI	On-Demand	Anodyne	EPHX2	45	44
O=C(/C=C\C1CC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196819	EI	On-Demand	Anodyne	EPHX2	41	42
O=C(/C=C/C1CC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196820	EI	On-Demand	Anodyne	EPHX2	41	42
O=C1N[C@H](C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CS1	ZINC000819196822	FG	On-Demand	Anodyne	EPHX2	37	43
O=C(c1scnc1Cl)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196823	GJ	On-Demand	Anodyne	EPHX2	39	43
CC(C)(C)OC(=O)NCCCCC(=O)NCCc1ccc(Br)cc1Cl	ZINC000819196824	II	On-Demand	Anodyne	HDAC10	15	41
O=C(C[C@@H]1CCCOC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196858	FI	On-Demand	Anodyne	CTSS	18	42
O=C(C[C@@H]1CCCOC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196858	FI	On-Demand	Anodyne	EPHX2	40	45
O=C(C[C@@H]1CCCOC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196858	FI	On-Demand	Anodyne	ETHR	51	32
O=C(C[C@H]1CCCOC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196859	FI	On-Demand	Anodyne	CTSS	18	42
O=C(C[C@H]1CCCOC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196859	FI	On-Demand	Anodyne	EPHX2	40	45
O=C(C[C@H]1CCCOC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196859	FI	On-Demand	Anodyne	ETHR	51	32
O=C(c1ccc(-c2nnc(S)o2)cc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819196861	IJ	On-Demand	Anodyne	EPHX2	33	43
Cc1ccc(OC[C@@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819196993	FE	On-Demand	Anodyne	ADRB2	36	48
Cc1ccc(OC[C@@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819196993	FE	On-Demand	Anodyne	ADRB1	57	42
Cc1ccc(OC[C@@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819196993	FE	On-Demand	Anodyne	GPR119	32	40
Cc1ccc(OC[C@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819196994	FE	On-Demand	Anodyne	ADRB2	36	48
Cc1ccc(OC[C@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819196994	FE	On-Demand	Anodyne	ADRB1	57	42
Cc1ccc(OC[C@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819196994	FE	On-Demand	Anodyne	GPR119	32	40
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819196995	FG	On-Demand	Anodyne	TACR1	19	40
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819196995	FG	On-Demand	Anodyne	CCR2	65	37
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819196996	FG	On-Demand	Anodyne	TACR1	19	40
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819196996	FG	On-Demand	Anodyne	CCR2	65	37
N#CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)cc1	ZINC000819196997	FE	On-Demand	Mild	ADRB1	40	39
N#CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)cc1	ZINC000819196998	FE	On-Demand	Mild	ADRB1	40	39
N#CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)cc1	ZINC000819196999	FE	On-Demand	Mild	ADRB1	40	39
N#CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)cc1	ZINC000819197000	FE	On-Demand	Mild	ADRB1	40	39
CC(C)(C)OC(=O)N1CC(CNCCS(=O)(=O)c2ccccc2)C1	ZINC000819197009	FD	On-Demand	Anodyne	GPR119	44	38
CC(C)(C)OC(=O)N1CC(CNCCS(=O)(=O)c2ccccc2)C1	ZINC000819197009	FD	On-Demand	Anodyne	SFRP1	40	42
CC(=O)c1ccc(OC[C@@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819197010	GE	On-Demand	Anodyne	ADRB2	28	41
CC(=O)c1ccc(OC[C@@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819197010	GE	On-Demand	Anodyne	ADRB1	53	40
CC(=O)c1ccc(OC[C@@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819197010	GE	On-Demand	Anodyne	ABCB1	16	52
CC(=O)c1ccc(OC[C@@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819197010	GE	On-Demand	Anodyne	GPR119	27	42
CC(=O)c1ccc(OC[C@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819197011	GE	On-Demand	Anodyne	ADRB2	28	41
CC(=O)c1ccc(OC[C@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819197011	GE	On-Demand	Anodyne	ADRB1	53	40
CC(=O)c1ccc(OC[C@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819197011	GE	On-Demand	Anodyne	ABCB1	16	52
CC(=O)c1ccc(OC[C@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819197011	GE	On-Demand	Anodyne	GPR119	27	42
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819197024	EE	On-Demand	Anodyne	GPR119	31	42
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819197025	EE	On-Demand	Anodyne	GPR119	31	42
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819197036	FG	On-Demand	Anodyne	CASR	40	38
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819197036	FG	On-Demand	Anodyne	TRY2_BOVIN	41	32
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819197037	FG	On-Demand	Anodyne	CASR	40	38
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819197037	FG	On-Demand	Anodyne	TRY2_BOVIN	41	32
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819197039	DE	On-Demand	Anodyne	GPR119	29	42
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819197040	DE	On-Demand	Anodyne	GPR119	29	42
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819197043	GG	On-Demand	Anodyne	GPR119	20	41
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819197043	GG	On-Demand	Anodyne	SFRP1	36	41
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819197044	GG	On-Demand	Anodyne	GPR119	20	41
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819197044	GG	On-Demand	Anodyne	SFRP1	36	41
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@@H](O)c1ccccc1	ZINC000819197050	DE	On-Demand	Anodyne	ADRB2	20	41
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@@H](O)c1ccccc1	ZINC000819197050	DE	On-Demand	Anodyne	ADRB1	22	41
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@@H](O)c1ccccc1	ZINC000819197050	DE	On-Demand	Anodyne	ADRB3	38	41
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@H](O)c1ccccc1	ZINC000819197052	DE	On-Demand	Anodyne	ADRB2	20	41
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@H](O)c1ccccc1	ZINC000819197052	DE	On-Demand	Anodyne	ADRB1	22	41
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@H](O)c1ccccc1	ZINC000819197052	DE	On-Demand	Anodyne	ADRB3	38	41
O[C@@H](CNCC1(c2ccccc2Cl)CC1)c1cccnc1	ZINC000819197062	DG	On-Demand	Anodyne	ADRB3	78	41
O[C@@H](CNCC1(c2ccccc2Cl)CC1)c1cccnc1	ZINC000819197062	DG	On-Demand	Anodyne	SCD	15	40
O[C@H](CNCC1(c2ccccc2Cl)CC1)c1cccnc1	ZINC000819197063	DG	On-Demand	Anodyne	ADRB3	78	41
O[C@H](CNCC1(c2ccccc2Cl)CC1)c1cccnc1	ZINC000819197063	DG	On-Demand	Anodyne	SCD	15	40
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@H](O)c1cccnc1	ZINC000819197104	DD	On-Demand	Anodyne	ADRB1	25	47
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@H](O)c1cccnc1	ZINC000819197104	DD	On-Demand	Anodyne	ADRB3	80	47
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@@H](O)c1cccnc1	ZINC000819197105	DD	On-Demand	Anodyne	ADRB1	25	47
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@@H](O)c1cccnc1	ZINC000819197105	DD	On-Demand	Anodyne	ADRB3	80	47
O=Cc1cc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cs1	ZINC000819197149	GI	On-Demand	Anodyne	EPHX2	42	43
N#Cc1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)nc1Cl	ZINC000819197150	HJ	On-Demand	Mild	EPHX2	33	41
NS(=O)(=O)c1cc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)ccc1F	ZINC000819197153	IG	On-Demand	Anodyne	CCR1	25	41
NS(=O)(=O)c1cc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)ccc1F	ZINC000819197153	IG	On-Demand	Anodyne	SLC9A1	36	40
NS(=O)(=O)c1cc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)ccc1F	ZINC000819197153	IG	On-Demand	Anodyne	EPHX2	37	41
O=C(/C=C\c1ccncn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197154	GH	On-Demand	Anodyne	EPHX2	28	41
O=C(/C=C/c1ccncn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197155	GH	On-Demand	Anodyne	EPHX2	28	41
O=C(c1cc(=O)c2ccc(F)cc2o1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197158	IJ	On-Demand	Anodyne	KCNH2	15	46
O=C(c1cc(=O)c2ccc(F)cc2o1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197158	IJ	On-Demand	Anodyne	MCHR1	16	46
Nc1cc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc(Cl)n1	ZINC000819197160	GI	On-Demand	Anodyne	EPHX2	36	46
Cn1cc([C@@H](O)C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cn1	ZINC000819197167	GF	On-Demand	Anodyne	EPHX2	29	42
O=C(c1csc(-c2ccccn2)n1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197170	IK	On-Demand	Anodyne	ETHR	41	32
O=C(c1ccc(Cl)nn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197171	GI	On-Demand	Anodyne	EPHX2	42	46
O=C(c1cccc(O)c1O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197172	GI	On-Demand	Clean	EPHX2	46	41
COc1cccc([C@H](O)C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c1	ZINC000819197173	HI	On-Demand	Anodyne	EPHX2	35	42
O=C(c1ccnnc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197175	FG	On-Demand	Anodyne	EPHX2	46	51
O=C([C@H]1CC1(Cl)Cl)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197176	GI	On-Demand	Anodyne	EPHX2	47	46
O=C([C@@H]1CC1(Cl)Cl)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197177	GI	On-Demand	Anodyne	EPHX2	47	46
O=C(c1cccnc1Br)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197183	IJ	On-Demand	Anodyne	EPHX2	42	44
C[C@@](O)(CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)c1ccccc1	ZINC000819197185	HJ	On-Demand	Anodyne	CCR1	27	40
C[C@@](O)(CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)c1ccccc1	ZINC000819197185	HJ	On-Demand	Anodyne	EPHX2	47	44
O=C([C@@H](O)c1ccccn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197189	GG	On-Demand	Anodyne	P2RY1	20	40
O=C([C@@H](O)c1ccccn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197189	GG	On-Demand	Anodyne	EPHX2	36	41
O=C([C@H](O)c1ccccn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197190	GG	On-Demand	Anodyne	P2RY1	20	40
O=C([C@H](O)c1ccccn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197190	GG	On-Demand	Anodyne	EPHX2	36	41
O=C(CC1OCCCO1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197191	FG	On-Demand	Anodyne	EPHX2	47	44
O=C(CC1OCCCO1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197191	FG	On-Demand	Anodyne	DGAT1	20	40
O=C(CC1OCCCO1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197191	FG	On-Demand	Anodyne	ETHR	67	36
O=C(Cc1n[nH]c2c1CCCC2)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197192	HI	On-Demand	Anodyne	EPHX2	29	41
O=C(Cc1n[nH]c2c1CCCC2)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197192	HI	On-Demand	Anodyne	ETHR	40	31
C[C@@H](CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C1CC1	ZINC000819197197	FJ	On-Demand	Anodyne	CTSS	18	44
C[C@@H](CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C1CC1	ZINC000819197197	FJ	On-Demand	Anodyne	EPHX2	50	46
CC(=O)OC(C)(C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197199	FH	On-Demand	Anodyne	EPHX2	44	44
C#CCCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197200	EI	On-Demand	Mild	EPHX2	36	43
C#CCCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197200	EI	On-Demand	Mild	ETHR	54	33
O=C(NCCc1ccc(Br)cc1Cl)c1ccc(N2CCOCC2)nc1	ZINC000819197201	HG	On-Demand	Anodyne	ADK	40	38
O=C(NCCc1ccc(Br)cc1Cl)c1ccc(N2CCOCC2)nc1	ZINC000819197201	HG	On-Demand	Anodyne	SCN10A	18	41
O=C(NCCc1ccc(Br)cc1Cl)c1ccc(N2CCOCC2)nc1	ZINC000819197201	HG	On-Demand	Anodyne	HPGDS	31	46
O=C(c1cccc(Cl)n1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197202	GJ	On-Demand	Anodyne	EPHX2	44	43
C#CCCCCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197203	FJ	On-Demand	Mild	EPHX2	36	42
C#CCCCCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197203	FJ	On-Demand	Mild	ETHR	52	32
O=C(Cc1ccc(F)cn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197204	GI	On-Demand	Anodyne	EPHX2	36	41
O=C(Cc1ccc(F)cn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197204	GI	On-Demand	Anodyne	ETHR	55	32
Cc1nc(O)nc(O)c1CCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197205	IG	On-Demand	Anodyne	EPHX2	25	40
Cc1nc(O)nc(O)c1CCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197205	IG	On-Demand	Anodyne	ETHR	62	36
O=C(c1ncccn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197206	FG	On-Demand	Anodyne	EPHX2	51	47
O=C(c1ncccn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197206	FG	On-Demand	Anodyne	RBP4	27	42
O=C(N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C(F)(F)C(F)F	ZINC000819197207	FI	On-Demand	Mild	EPHX2	43	46
N#CCOc1ccc(CC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1	ZINC000819197208	HI	On-Demand	Mild	EPHX2	30	40
N#CCOc1ccc(CC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1	ZINC000819197208	HI	On-Demand	Mild	ETHR	41	32
O=C(Cc1ccc(F)cn1)NCCc1ccc(Br)cc1Cl	ZINC000819197213	FH	On-Demand	Anodyne	P2RX7	44	44
O=C(c1cccn1Cc1ccncc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197214	IJ	On-Demand	Anodyne	CCR1	15	40
O=C(c1cccn1Cc1ccncc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197214	IJ	On-Demand	Anodyne	EPHX2	27	45
O=C(CN1CCSC1=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197215	GG	On-Demand	Anodyne	EPHX2	33	43
O=C(c1ccc(F)nc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197217	FI	On-Demand	Anodyne	EPHX2	44	53
O=C(c1ccc(F)nc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197217	FI	On-Demand	Anodyne	L3MBTL3	45	40
O=C(c1ccc(Br)nc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197218	IJ	On-Demand	Anodyne	EPHX2	42	52
O=C(c1ccc(Br)nc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197218	IJ	On-Demand	Anodyne	L3MBTL3	43	39
CO[C@@H](C)CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197224	EH	On-Demand	Anodyne	CTSS	17	42
CO[C@@H](C)CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197224	EH	On-Demand	Anodyne	EPHX2	49	46
Cc1sc(Br)nc1C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197229	IK	On-Demand	Anodyne	EPHX2	46	41
O=C(c1cnc(S)[nH]1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197244	FH	On-Demand	Anodyne	EPHX2	39	41
C#Cc1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)nc1	ZINC000819197245	FH	On-Demand	Mild	EPHX2	37	40
O=C(c1ccc2cccnn12)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197247	GI	On-Demand	Anodyne	EPHX2	40	42
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197248	IH	On-Demand	Anodyne	CACNA1B	18	41
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197248	IH	On-Demand	Anodyne	CCR1	32	41
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197248	IH	On-Demand	Anodyne	CTSS	24	40
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197248	IH	On-Demand	Anodyne	EPHX2	32	44
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819197275	EE	On-Demand	Anodyne	GHRHR	41	32
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819197275	EE	On-Demand	Anodyne	REN	43	38
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819197275	EE	On-Demand	Anodyne	FPR1	43	34
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819197275	EE	On-Demand	Anodyne	GPR119	28	40
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)CCc2ccccc2)C1	ZINC000819197277	EE	On-Demand	Anodyne	GHRHR	41	32
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)CCc2ccccc2)C1	ZINC000819197277	EE	On-Demand	Anodyne	REN	43	38
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)CCc2ccccc2)C1	ZINC000819197277	EE	On-Demand	Anodyne	FPR1	43	34
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)CCc2ccccc2)C1	ZINC000819197277	EE	On-Demand	Anodyne	GPR119	28	40
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819197280	GF	On-Demand	Anodyne	NPBWR1	41	35
C[C@@H](Cn1ncc2ccccc2c1=O)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819197284	GF	On-Demand	Anodyne	NPBWR1	41	35
CN(C)C(=O)NNC(=O)C1(c2ccc(Cl)cc2Cl)CCCCC1	ZINC000819197297	FG	On-Demand	Reactive	UGCG	36	46
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)cc1	ZINC000819197306	GE	On-Demand	Anodyne	ADRB2	33	44
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)cc1	ZINC000819197306	GE	On-Demand	Anodyne	ADRB1	54	41
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)cc1	ZINC000819197306	GE	On-Demand	Anodyne	ADRB3	33	41
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)cc1	ZINC000819197309	GE	On-Demand	Anodyne	ADRB2	33	44
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)cc1	ZINC000819197309	GE	On-Demand	Anodyne	ADRB1	54	41
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)cc1	ZINC000819197309	GE	On-Demand	Anodyne	ADRB3	33	41
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)cc1	ZINC000819197310	GE	On-Demand	Anodyne	ADRB2	33	44
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)cc1	ZINC000819197310	GE	On-Demand	Anodyne	ADRB1	54	41
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)cc1	ZINC000819197310	GE	On-Demand	Anodyne	ADRB3	33	41
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)cc1	ZINC000819197313	GE	On-Demand	Anodyne	ADRB2	33	44
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)cc1	ZINC000819197313	GE	On-Demand	Anodyne	ADRB1	54	41
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)cc1	ZINC000819197313	GE	On-Demand	Anodyne	ADRB3	33	41
CC(=O)Nc1cccc(CC(=O)Oc2ccc(OCC3CC3)cc2)c1	ZINC000819197332	EH	On-Demand	Anodyne	TSHR	50	34
CC(=O)Nc1cccc(CC(=O)Oc2ccc(OCC3CC3)cc2)c1	ZINC000819197332	EH	On-Demand	Anodyne	MTNR1A	18	41
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819197370	GD	On-Demand	Bother	ADRB1	51	34
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819197370	GD	On-Demand	Bother	ABCB1	23	43
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819197372	GD	On-Demand	Bother	ADRB1	51	34
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819197372	GD	On-Demand	Bother	ABCB1	23	43
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)cc1	ZINC000819197388	FF	On-Demand	Anodyne	ADRB2	27	40
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)cc1	ZINC000819197390	FF	On-Demand	Anodyne	ADRB2	27	40
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)cc1	ZINC000819197392	FF	On-Demand	Anodyne	ADRB2	27	40
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)cc1	ZINC000819197394	FF	On-Demand	Anodyne	ADRB2	27	40
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(CN2CCCCCC2)c1	ZINC000819197406	EG	On-Demand	Anodyne	HRH2	32	41
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(CN2CCCCCC2)c1	ZINC000819197406	EG	On-Demand	Anodyne	CHRM3	18	41
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(CN2CCCCCC2)c1	ZINC000819197406	EG	On-Demand	Anodyne	SIGMAR1	19	41
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(CN2CCCCCC2)c1	ZINC000819197406	EG	On-Demand	Anodyne	BDKRB1	34	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(CN2CCSCC2)c1	ZINC000819197408	GG	On-Demand	Anodyne	CCR3	24	40
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819197432	EE	On-Demand	Mild	GPR119	27	46
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819197434	EE	On-Demand	Mild	GPR119	27	46
COc1cccc([S@@](=O)CC(=O)NCc2ccc3c(c2)CCCN3C)c1	ZINC000819197442	FF	On-Demand	Clean	DRD4	47	36
O=C(CCOc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819197449	GF	On-Demand	Reactive	LTA4H	35	40
O=C(CCOc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819197449	GF	On-Demand	Reactive	PLA2G4A	28	43
O=C(CCOc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819197449	GF	On-Demand	Reactive	FFAR1	54	49
O=C(CCOc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819197449	GF	On-Demand	Reactive	FFAR4	45	44
O=C(CCOc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819197449	GF	On-Demand	Reactive	CRTM	56	37
O=C(CCOc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819197449	GF	On-Demand	Reactive	PDS	49	38
O=C(CCOc1ccccc1)NNC(=O)C(F)=C1CCC1	ZINC000819197469	CE	On-Demand	Reactive	LTA4H	26	40
O[C@H](CN[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1)c1cccnc1	ZINC000819197474	EF	On-Demand	Anodyne	ADRB3	56	52
O[C@@H](CN[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1)c1cccnc1	ZINC000819197475	EF	On-Demand	Anodyne	ADRB3	56	52
O[C@@H](CN[C@H]1CCN(c2ccc(Cl)c(F)c2)C1)c1cccnc1	ZINC000819197476	EF	On-Demand	Anodyne	ADRB3	56	52
O[C@H](CN[C@H]1CCN(c2ccc(Cl)c(F)c2)C1)c1cccnc1	ZINC000819197477	EF	On-Demand	Anodyne	ADRB3	56	52
CC(C)(C)OC(=O)N1CC(CNCCC(=O)Nc2ccccc2)C1	ZINC000819197525	EE	On-Demand	Anodyne	LTA4H	28	41
COc1cccc([S@@](=O)CC(=O)NCCCNc2ncccn2)c1	ZINC000819197526	ED	On-Demand	Anodyne	MTNR1A	47	44
COc1cccc([S@@](=O)CC(=O)NCCCNc2ncccn2)c1	ZINC000819197526	ED	On-Demand	Anodyne	MTNR1B	45	44
CC(=O)Nc1ccc(OC[C@@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819197530	GD	On-Demand	Anodyne	ADRB2	40	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819197530	GD	On-Demand	Anodyne	ADRB1	77	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819197530	GD	On-Demand	Anodyne	ADRB3	48	50
CC(=O)Nc1ccc(OC[C@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819197531	GD	On-Demand	Anodyne	ADRB2	40	55
CC(=O)Nc1ccc(OC[C@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819197531	GD	On-Demand	Anodyne	ADRB1	77	55
CC(=O)Nc1ccc(OC[C@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819197531	GD	On-Demand	Anodyne	ADRB3	48	50
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819197539	FE	On-Demand	Anodyne	ADRB2	40	38
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819197539	FE	On-Demand	Anodyne	ADRB1	63	42
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819197539	FE	On-Demand	Anodyne	ADRB3	38	41
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819197540	FE	On-Demand	Anodyne	ADRB2	40	38
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819197540	FE	On-Demand	Anodyne	ADRB1	63	42
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819197540	FE	On-Demand	Anodyne	ADRB3	38	41
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819197576	GD	On-Demand	Anodyne	GPR119	55	49
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819197577	GD	On-Demand	Anodyne	GPR119	55	49
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197602	IH	On-Demand	Anodyne	CACNA1B	18	41
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197602	IH	On-Demand	Anodyne	CCR1	32	41
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197602	IH	On-Demand	Anodyne	CTSS	24	40
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197602	IH	On-Demand	Anodyne	EPHX2	32	44
O=C(Cc1ccc(Cl)cn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197615	GJ	On-Demand	Anodyne	CCR1	32	43
O=C(Cc1ccc(Cl)cn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197615	GJ	On-Demand	Anodyne	EPHX2	43	42
O=C(Cc1ccc(Cl)cn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197615	GJ	On-Demand	Anodyne	ETHR	41	32
O=C(CCc1cccc(OC(F)F)c1)NCCCNc1ncccn1	ZINC000819197622	FF	On-Demand	Anodyne	MTNR1A	19	46
O=C(CCc1cccc(OC(F)F)c1)NCCCNc1ncccn1	ZINC000819197622	FF	On-Demand	Anodyne	MTNR1B	20	46
O=C(CCc1cccc(OC(F)F)c1)NCCCNc1ncccn1	ZINC000819197622	FF	On-Demand	Anodyne	CRTM	41	40
O=C(c1cccc(Br)n1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197629	IJ	On-Demand	Anodyne	EPHX2	42	41
C=C(CN(C)C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197631	FG	On-Demand	Mild	EPHX2	44	44
O=C(c1ccoc1C1(O)CCOCC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197634	II	On-Demand	Anodyne	EPHX2	39	43
O=C(c1ccnc(Cl)c1F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197640	HJ	On-Demand	Anodyne	EPHX2	43	42
O=C(c1cccc(C2OCCO2)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197642	HJ	On-Demand	Anodyne	EPHX2	45	42
O=C(c1cccc(C2OCCO2)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197642	HJ	On-Demand	Anodyne	RBP4	24	45
O=C(c1cccc(C2OCCO2)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197642	HJ	On-Demand	Anodyne	L3MBTL3	49	42
O=C(Cc1ccccc1CO)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197644	GI	On-Demand	Anodyne	P2RY1	41	37
O=C(Cc1ccccc1CO)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197644	GI	On-Demand	Anodyne	EPHX2	43	44
O=C(CC1OCCO1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197645	FG	On-Demand	Anodyne	EPHX2	52	46
O=C(CC1OCCO1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197645	FG	On-Demand	Anodyne	DGAT1	20	40
O=C(CC1OCCO1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197645	FG	On-Demand	Anodyne	ETHR	66	35
O=C(C=C1CCSCC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197650	GJ	On-Demand	Anodyne	EPHX2	36	42
O=C(c1ccc(Cl)nc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197651	GJ	On-Demand	Anodyne	EPHX2	43	68
O=C(c1ccc(Cl)nc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197651	GJ	On-Demand	Anodyne	SFRP1	21	45
O=C(C[C@H]1CSCCS1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197652	HJ	On-Demand	Anodyne	EPHX2	28	41
O=C(C[C@@H]1CSCCS1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197653	HJ	On-Demand	Anodyne	EPHX2	28	41
COC(=O)Nc1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1	ZINC000819197655	HJ	On-Demand	Anodyne	P2RY1	57	41
COC(=O)Nc1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1	ZINC000819197655	HJ	On-Demand	Anodyne	EPHX2	77	57
COC(=O)Nc1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1	ZINC000819197655	HJ	On-Demand	Anodyne	ACR	43	33
COC(=O)Nc1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1	ZINC000819197655	HJ	On-Demand	Anodyne	RBP4	26	41
COC(=O)Nc1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1	ZINC000819197655	HJ	On-Demand	Anodyne	L3MBTL3	55	35
N#Cc1ccc([C@H](O)C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1	ZINC000819197656	HH	On-Demand	Mild	FASN	41	35
N#Cc1ccc([C@H](O)C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1	ZINC000819197656	HH	On-Demand	Mild	EPHX2	27	41
N#Cc1ccc([C@@H](O)C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1	ZINC000819197657	HH	On-Demand	Mild	FASN	41	35
N#Cc1ccc([C@@H](O)C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1	ZINC000819197657	HH	On-Demand	Mild	EPHX2	27	41
O=C(c1cccnc1Cl)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197665	GJ	On-Demand	Anodyne	EPHX2	47	44
COC(=O)NC(C)(C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197666	GG	On-Demand	Anodyne	EPHX2	47	45
CC(C)n1ccc(CC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)n1	ZINC000819197667	GI	On-Demand	Anodyne	EPHX2	37	42
COC(=O)N[C@H](C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C(C)C	ZINC000819197674	HH	On-Demand	Anodyne	ELANE	56	41
COC(=O)N[C@H](C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C(C)C	ZINC000819197674	HH	On-Demand	Anodyne	CCR1	61	58
COC(=O)N[C@H](C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C(C)C	ZINC000819197674	HH	On-Demand	Anodyne	CTSS	16	41
COC(=O)N[C@H](C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C(C)C	ZINC000819197674	HH	On-Demand	Anodyne	EPHX2	46	48
COC(=O)N[C@@H](C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C(C)C	ZINC000819197675	HH	On-Demand	Anodyne	ELANE	56	41
COC(=O)N[C@@H](C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C(C)C	ZINC000819197675	HH	On-Demand	Anodyne	CCR1	61	58
COC(=O)N[C@@H](C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C(C)C	ZINC000819197675	HH	On-Demand	Anodyne	CTSS	16	41
COC(=O)N[C@@H](C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C(C)C	ZINC000819197675	HH	On-Demand	Anodyne	EPHX2	46	48
O=C(c1scnc1Br)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197679	IJ	On-Demand	Anodyne	EPHX2	39	41
O=C(C[C@H]1CCC(F)(F)C1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197685	GK	On-Demand	Anodyne	EPHX2	45	49
O=C(C[C@@H]1CCC(F)(F)C1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197686	GK	On-Demand	Anodyne	EPHX2	45	49
CCOC(=O)NCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197688	FG	On-Demand	Anodyne	EPHX2	57	48
CCOC(=O)NCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197688	FG	On-Demand	Anodyne	ETHR	46	32
O=C(c1ccc(-n2cccn2)nc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197689	HI	On-Demand	Anodyne	EPHX2	33	47
O=C(CCCCN1CCCC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197692	GJ	On-Demand	Anodyne	HRH3	37	44
O=C(CCCCN1CCCC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197692	GJ	On-Demand	Anodyne	EPHX2	37	43
O=C(CCCCN1CCCC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197692	GJ	On-Demand	Anodyne	MCHR1	15	40
O=C(CCCCN1CCCC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197692	GJ	On-Demand	Anodyne	ETHR	60	34
N#Cc1cccc(OCC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c1	ZINC000819197694	HI	On-Demand	Mild	CPT1A	38	40
N#Cc1cccc(OCC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c1	ZINC000819197694	HI	On-Demand	Mild	CPT2	40	35
N#Cc1cccc(OCC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c1	ZINC000819197694	HI	On-Demand	Mild	EPHX2	41	39
N#Cc1cccc(OCC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c1	ZINC000819197694	HI	On-Demand	Mild	CHRNA10	19	41
O=C(NCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)OCC(F)(F)F	ZINC000819197696	IH	On-Demand	Anodyne	EPHX2	47	44
O=C(NCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)OCC(F)(F)F	ZINC000819197696	IH	On-Demand	Anodyne	ETHR	52	33
O=C(C=C1CCC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197705	EI	On-Demand	Anodyne	EPHX2	40	41
Cc1cncc(/C=C/C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c1	ZINC000819197709	GJ	On-Demand	Anodyne	CCR2	21	47
Cc1cncc(/C=C\C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c1	ZINC000819197710	GJ	On-Demand	Anodyne	CCR2	21	47
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197716	HI	On-Demand	Anodyne	CCR1	35	44
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197716	HI	On-Demand	Anodyne	CTSS	17	42
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197716	HI	On-Demand	Anodyne	EPHX2	45	48
O=C(C1=CCCCO1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197724	FH	On-Demand	Anodyne	EPHX2	41	39
O=C([C@@H](F)C(F)(F)F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197725	FI	On-Demand	Mild	EPHX2	47	47
O=C([C@H](F)C(F)(F)F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197726	FI	On-Demand	Mild	EPHX2	47	47
O=C(Cn1cccc(C(F)(F)F)c1=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197733	II	On-Demand	Anodyne	EPHX2	32	40
O=C(N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C1(O)CCSCC1	ZINC000819197745	GH	On-Demand	Anodyne	EPHX2	48	42
O=C(/C=C\c1cncc(O)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197750	GI	On-Demand	Anodyne	CCR2	21	46
O=C(/C=C/c1cncc(O)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197752	GI	On-Demand	Anodyne	CCR2	21	46
CC(C)(C)C[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819197755	FI	On-Demand	Mild	CELA1	19	40
CC(C)(C)C[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819197755	FI	On-Demand	Mild	PAPA1_CARPA	30	40
CC(C)(C)C[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819197756	FI	On-Demand	Mild	CELA1	19	40
CC(C)(C)C[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819197756	FI	On-Demand	Mild	PAPA1_CARPA	30	40
CC(C)(C)C[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819197758	FI	On-Demand	Mild	CELA1	19	40
CC(C)(C)C[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819197758	FI	On-Demand	Mild	PAPA1_CARPA	30	40
CC(C)(C)C[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819197761	FI	On-Demand	Mild	CELA1	19	40
CC(C)(C)C[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819197761	FI	On-Demand	Mild	PAPA1_CARPA	30	40
O=C(N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C(F)(F)C1CCOCC1	ZINC000819197766	HI	On-Demand	Anodyne	EPHX2	47	43
COc1ccc(OC)c([C@H](O)CNCCc2csc(C(C)(C)C)n2)c1	ZINC000819197771	FG	On-Demand	Anodyne	ADRB2	18	47
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccc(F)cc1)C1CC1	ZINC000819197777	FF	On-Demand	Anodyne	PAPA1_CARPA	30	48
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccc(F)cc1)C1CC1	ZINC000819197777	FF	On-Demand	Anodyne	REN	53	39
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)Cc1ccc(F)cc1)C1CC1	ZINC000819197777	FF	On-Demand	Anodyne	FPR1	45	38
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccc(F)cc1)C1CC1	ZINC000819197778	FF	On-Demand	Anodyne	PAPA1_CARPA	30	48
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccc(F)cc1)C1CC1	ZINC000819197778	FF	On-Demand	Anodyne	REN	53	39
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)Cc1ccc(F)cc1)C1CC1	ZINC000819197778	FF	On-Demand	Anodyne	FPR1	45	38
O[C@H](CN[C@H]1CCN(c2ccc(Cl)c(F)c2)C1)c1ccc(F)c(F)c1	ZINC000819197785	FH	On-Demand	Anodyne	ADRB3	21	43
O[C@H](CN[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1)c1ccc(F)c(F)c1	ZINC000819197786	FH	On-Demand	Anodyne	ADRB3	21	43
O[C@@H](CN[C@H]1CCN(c2ccc(Cl)c(F)c2)C1)c1ccc(F)c(F)c1	ZINC000819197787	FH	On-Demand	Anodyne	ADRB3	21	43
O[C@@H](CN[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1)c1ccc(F)c(F)c1	ZINC000819197788	FH	On-Demand	Anodyne	ADRB3	21	43
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)C1CC1	ZINC000819197789	DG	On-Demand	Anodyne	ADRB2	46	44
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)C1CC1	ZINC000819197789	DG	On-Demand	Anodyne	ADRB1	64	40
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)C1CC1	ZINC000819197789	DG	On-Demand	Anodyne	ADRB3	59	40
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)C1CC1	ZINC000819197789	DG	On-Demand	Anodyne	FFAR1	25	43
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)C1CC1	ZINC000819197790	DG	On-Demand	Anodyne	ADRB2	46	44
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)C1CC1	ZINC000819197790	DG	On-Demand	Anodyne	ADRB1	64	40
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)C1CC1	ZINC000819197790	DG	On-Demand	Anodyne	ADRB3	59	40
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)C1CC1	ZINC000819197790	DG	On-Demand	Anodyne	FFAR1	25	43
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)CC1CCCC1)C1CC1	ZINC000819197799	EF	On-Demand	Anodyne	CTSK	17	57
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)CC1CCCC1)C1CC1	ZINC000819197799	EF	On-Demand	Anodyne	ECE1	22	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)CC1CCCC1)C1CC1	ZINC000819197799	EF	On-Demand	Anodyne	REN	44	44
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)CC1CCCC1)C1CC1	ZINC000819197800	EF	On-Demand	Anodyne	CTSK	17	57
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)CC1CCCC1)C1CC1	ZINC000819197800	EF	On-Demand	Anodyne	ECE1	22	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)CC1CCCC1)C1CC1	ZINC000819197800	EF	On-Demand	Anodyne	REN	44	44
Cc1ccc(OC[C@@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819197845	FE	On-Demand	Anodyne	ADRB2	19	42
Cc1ccc(OC[C@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819197847	FE	On-Demand	Anodyne	ADRB2	19	42
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2cccnc2)C1	ZINC000819197855	DD	On-Demand	Anodyne	ADRB2	19	41
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2cccnc2)C1	ZINC000819197855	DD	On-Demand	Anodyne	ADRB1	24	41
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2cccnc2)C1	ZINC000819197855	DD	On-Demand	Anodyne	ADRB3	90	42
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2cccnc2)C1	ZINC000819197855	DD	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2cccnc2)C1	ZINC000819197856	DD	On-Demand	Anodyne	ADRB2	19	41
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2cccnc2)C1	ZINC000819197856	DD	On-Demand	Anodyne	ADRB1	24	41
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2cccnc2)C1	ZINC000819197856	DD	On-Demand	Anodyne	ADRB3	90	42
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2cccnc2)C1	ZINC000819197856	DD	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819197891	GE	On-Demand	Anodyne	ADRB2	25	56
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819197891	GE	On-Demand	Anodyne	ADRB1	37	56
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819197891	GE	On-Demand	Anodyne	ADRB3	18	56
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819197892	GE	On-Demand	Anodyne	ADRB2	25	56
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819197892	GE	On-Demand	Anodyne	ADRB1	37	56
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819197892	GE	On-Demand	Anodyne	ADRB3	18	56
O[C@@H](CN[C@@H]1CC[C@H]2SCCS[C@@H]12)c1ccccc1Cl	ZINC000819197893	EG	On-Demand	Anodyne	OPRL1	18	40
O[C@@H](CN[C@@H]1CC[C@@H]2SCCS[C@@H]21)c1ccccc1Cl	ZINC000819197894	EG	On-Demand	Anodyne	OPRL1	18	40
O[C@@H](CN[C@@H]1CC[C@H]2SCCS[C@H]12)c1ccccc1Cl	ZINC000819197895	EG	On-Demand	Anodyne	OPRL1	18	40
O[C@@H](CN[C@@H]1CC[C@@H]2SCCS[C@H]21)c1ccccc1Cl	ZINC000819197896	EG	On-Demand	Anodyne	OPRL1	18	40
O[C@H](CN[C@@H]1CC[C@H]2SCCS[C@@H]12)COc1ccccc1Cl	ZINC000819197901	FG	On-Demand	Anodyne	ADRB2	22	40
O[C@H](CN[C@@H]1CC[C@H]2SCCS[C@@H]12)COc1ccccc1Cl	ZINC000819197901	FG	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CN[C@@H]1CC[C@@H]2SCCS[C@H]21)COc1ccccc1Cl	ZINC000819197902	FG	On-Demand	Anodyne	ADRB2	22	40
O[C@H](CN[C@@H]1CC[C@@H]2SCCS[C@H]21)COc1ccccc1Cl	ZINC000819197902	FG	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CN[C@@H]1CC[C@H]2SCCS[C@H]12)COc1ccccc1Cl	ZINC000819197903	FG	On-Demand	Anodyne	ADRB2	22	40
O[C@H](CN[C@@H]1CC[C@H]2SCCS[C@H]12)COc1ccccc1Cl	ZINC000819197903	FG	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CN[C@@H]1CC[C@@H]2SCCS[C@@H]21)COc1ccccc1Cl	ZINC000819197904	FG	On-Demand	Anodyne	ADRB2	22	40
O[C@H](CN[C@@H]1CC[C@@H]2SCCS[C@@H]21)COc1ccccc1Cl	ZINC000819197904	FG	On-Demand	Anodyne	ADRB1	22	40
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2c(F)cccc2F)C1	ZINC000819197912	EE	On-Demand	Anodyne	GPR119	30	47
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819197913	EE	On-Demand	Anodyne	GPR119	30	47
CC(C)(C)OC(=O)N1CC(CNCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819197918	FE	On-Demand	Anodyne	GPR119	48	39
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccccc2)C1	ZINC000819197957	ED	On-Demand	Anodyne	ADRB2	56	49
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccccc2)C1	ZINC000819197957	ED	On-Demand	Anodyne	ADRB1	81	45
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccccc2)C1	ZINC000819197957	ED	On-Demand	Anodyne	ADRB3	53	45
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccccc2)C1	ZINC000819197957	ED	On-Demand	Anodyne	CASR	18	40
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccccc2)C1	ZINC000819197957	ED	On-Demand	Anodyne	ABCB1	37	44
O=C(/C=C/c1cnc2ccccc2n1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197958	IJ	On-Demand	Anodyne	ITGAL	47	35
O=C(/C=C\c1cnc2ccccc2n1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197959	IJ	On-Demand	Anodyne	ITGAL	47	35
CS(=O)(=O)Nc1cccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c1	ZINC000819197960	IH	On-Demand	Anodyne	SLC9A1	33	40
CS(=O)(=O)Nc1cccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c1	ZINC000819197960	IH	On-Demand	Anodyne	EPHX2	52	43
CS(=O)(=O)Nc1cccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c1	ZINC000819197960	IH	On-Demand	Anodyne	RBP4	27	46
CS(=O)(=O)Nc1cccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c1	ZINC000819197960	IH	On-Demand	Anodyne	SFRP1	54	36
O=C(/C=C\c1cncc(F)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197961	GJ	On-Demand	Anodyne	CCR2	25	45
O=C(/C=C/c1cncc(F)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197962	GJ	On-Demand	Anodyne	CCR2	25	45
O=Cc1ccccc1OCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197964	HI	On-Demand	Anodyne	EPHX2	36	40
Cn1nc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c2ccccc2c1=O	ZINC000819197965	IH	On-Demand	Anodyne	EPHX2	40	38
Cn1ncc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c1Br	ZINC000819197966	II	On-Demand	Anodyne	EPHX2	46	42
Nc1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1[N+](=O)[O-]	ZINC000819197973	HI	On-Demand	Bother	EPHX2	30	40
Nc1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1[N+](=O)[O-]	ZINC000819197973	HI	On-Demand	Bother	L3MBTL3	35	44
O=C(N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C(F)(F)c1nccs1	ZINC000819197974	HJ	On-Demand	Anodyne	EPHX2	40	43
O=C(COc1ccc2ccc(=O)oc2c1)NCCc1ccc(Br)cc1Cl	ZINC000819197977	IH	On-Demand	Anodyne	MAOB	27	43
O=C(COc1ccc2ccc(=O)oc2c1)NCCc1ccc(Br)cc1Cl	ZINC000819197977	IH	On-Demand	Anodyne	MTNR1A	40	37
CC(=O)OCC(C)(C)CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197981	HI	On-Demand	Anodyne	EPHX2	47	44
O=C(C1=COCCC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197983	FH	On-Demand	Anodyne	EPHX2	43	39
O=C(c1cnc(Cl)c(Cl)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197984	HK	On-Demand	Anodyne	EPHX2	43	51
O=C(c1cnsn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197987	FG	On-Demand	Anodyne	EPHX2	42	42
O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197989	II	On-Demand	Bother	EPHX2	42	44
Cn1cc(-c2cccc(C(=O)N3CCC(c4ccc(OC(F)(F)F)cc4)CC3)c2)cn1	ZINC000819197990	IK	On-Demand	Anodyne	SLC9A1	28	40
Cn1cc(-c2cccc(C(=O)N3CCC(c4ccc(OC(F)(F)F)cc4)CC3)c2)cn1	ZINC000819197990	IK	On-Demand	Anodyne	EPHX2	35	40
Cn1cc(-c2cccc(C(=O)N3CCC(c4ccc(OC(F)(F)F)cc4)CC3)c2)cn1	ZINC000819197990	IK	On-Demand	Anodyne	RBP4	19	43
Cn1cc(-c2cccc(C(=O)N3CCC(c4ccc(OC(F)(F)F)cc4)CC3)c2)cn1	ZINC000819197990	IK	On-Demand	Anodyne	SHH	25	40
CCOC(=O)NCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197993	GG	On-Demand	Anodyne	EPHX2	52	48
CCOC(=O)NCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819197993	GG	On-Demand	Anodyne	ETHR	58	33
O=Cc1cccc(OCC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c1	ZINC000819197996	HI	On-Demand	Anodyne	EPHX2	40	40
CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819197998	IF	On-Demand	Anodyne	PAPA1_CARPA	40	46
CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819197998	IF	On-Demand	Anodyne	FPR1	41	35
O=C(NCCc1ccc(Br)cc1Cl)[C@H]1CCCN1C(=O)C(F)(F)F	ZINC000819198000	IG	On-Demand	Anodyne	F2	27	43
O=C(NCCc1ccc(Br)cc1Cl)[C@H]1CCCN1C(=O)C(F)(F)F	ZINC000819198000	IG	On-Demand	Anodyne	ELANE	44	36
O=C(NCCc1ccc(Br)cc1Cl)[C@H]1CCCN1C(=O)C(F)(F)F	ZINC000819198000	IG	On-Demand	Anodyne	P2RX7	40	48
O=C(NCCc1ccc(Br)cc1Cl)[C@@H]1CCCN1C(=O)C(F)(F)F	ZINC000819198003	IG	On-Demand	Anodyne	F2	27	43
O=C(NCCc1ccc(Br)cc1Cl)[C@@H]1CCCN1C(=O)C(F)(F)F	ZINC000819198003	IG	On-Demand	Anodyne	ELANE	44	36
O=C(NCCc1ccc(Br)cc1Cl)[C@@H]1CCCN1C(=O)C(F)(F)F	ZINC000819198003	IG	On-Demand	Anodyne	P2RX7	40	48
O=C(c1ccc(-n2ccnc2)nc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198016	HI	On-Demand	Anodyne	EPHX2	38	49
CC(C)(C)OC(=O)N[C@@H](CNCCS(=O)(=O)c1ccccc1)C1CC1	ZINC000819198017	FE	On-Demand	Anodyne	REN	45	40
CC(C)(C)OC(=O)N[C@@H](CNCCS(=O)(=O)c1ccccc1)C1CC1	ZINC000819198017	FE	On-Demand	Anodyne	FPR1	41	37
O=C(c1ccc[n+]([O-])c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198033	FG	On-Demand	Anodyne	EPHX2	42	42
O=C(c1ccnc(Cl)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198042	GJ	On-Demand	Anodyne	EPHX2	45	50
N#Cc1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)o1	ZINC000819198043	FI	On-Demand	Mild	EPHX2	41	39
N#Cc1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)o1	ZINC000819198043	FI	On-Demand	Mild	CSF1R	17	44
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198051	IH	On-Demand	Anodyne	CPT2	40	35
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198051	IH	On-Demand	Anodyne	PREP	52	42
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198051	IH	On-Demand	Anodyne	EPHX2	37	44
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198051	IH	On-Demand	Anodyne	SFRP1	48	39
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198051	IH	On-Demand	Anodyne	WNT3	58	39
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)CCOc1ccccc1	ZINC000819198055	DE	On-Demand	Reactive	ADAM17	17	41
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198056	IH	On-Demand	Anodyne	CPT2	40	35
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198056	IH	On-Demand	Anodyne	PREP	52	42
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198056	IH	On-Demand	Anodyne	EPHX2	37	44
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198056	IH	On-Demand	Anodyne	SFRP1	48	39
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198056	IH	On-Demand	Anodyne	WNT3	58	39
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)CCOc1ccccc1	ZINC000819198057	DE	On-Demand	Reactive	ADAM17	17	41
O=C(COc1ccc2ccc(=O)oc2c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198059	II	On-Demand	Anodyne	TRAR	27	43
O=C(COc1ccc2ccc(=O)oc2c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198059	II	On-Demand	Anodyne	ETHR	45	32
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000819198063	GF	On-Demand	Anodyne	HTR4	42	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000819198063	GF	On-Demand	Anodyne	CACNA1I	58	34
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccc(Br)cc1)C1CC1	ZINC000819198070	GG	On-Demand	Anodyne	PAPA1_CARPA	22	40
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccc(Br)cc1)C1CC1	ZINC000819198072	GG	On-Demand	Anodyne	PAPA1_CARPA	22	40
O=C(/C=C\C1CCOCC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198073	GI	On-Demand	Anodyne	ITGAL	48	35
O=C(/C=C/C1CCOCC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198077	GI	On-Demand	Anodyne	ITGAL	48	35
O=C(CCCCN1CCCC1)NCCc1ccc(Br)cc1Cl	ZINC000819198092	GI	On-Demand	Anodyne	HTR7	24	40
O=C(CCCCN1CCCC1)NCCc1ccc(Br)cc1Cl	ZINC000819198092	GI	On-Demand	Anodyne	CHRNA7	17	42
Cn1ncc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)n1	ZINC000819198099	FF	On-Demand	Anodyne	EPHX2	45	43
Cn1ncc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)n1	ZINC000819198099	FF	On-Demand	Anodyne	RBP4	23	40
O=C1CC(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)=NN1	ZINC000819198107	FE	On-Demand	Anodyne	EPHX2	40	41
O=C(CCN1CCOCC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198116	GG	On-Demand	Anodyne	CTSS	17	43
O=C(CCN1CCOCC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198116	GG	On-Demand	Anodyne	EPHX2	47	49
O=C(CCN1CCOCC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198116	GG	On-Demand	Anodyne	ETHR	61	35
NC(=S)c1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1	ZINC000819198119	HI	On-Demand	Anodyne	SLC9A1	40	41
NC(=S)c1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1	ZINC000819198119	HI	On-Demand	Anodyne	EPHX2	44	48
NC(=S)c1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1	ZINC000819198119	HI	On-Demand	Anodyne	L3MBTL3	62	37
Cc1noc(C2CC2)c1C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198121	GJ	On-Demand	Anodyne	EPHX2	41	44
Cc1noc(C2CC2)c1C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198121	GJ	On-Demand	Anodyne	ETHR	46	33
O=C(c1cc(F)c([N+](=O)[O-])cc1F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198126	IJ	On-Demand	Bother	EPHX2	39	40
CC(=O)CCCCCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198143	GK	On-Demand	Anodyne	EPHX2	52	47
CC(=O)CCCCCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198143	GK	On-Demand	Anodyne	ETHR	60	36
O=C(c1ccnc(C(F)(F)F)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198147	HK	On-Demand	Anodyne	EPHX2	46	50
O=C(c1ccnc(C(F)(F)F)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198147	HK	On-Demand	Anodyne	RBP4	27	42
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cccc(Br)c1)C1CC1	ZINC000819198149	GG	On-Demand	Anodyne	PAPA1_CARPA	22	41
O=C(c1cccc[n+]1[O-])N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198150	FG	On-Demand	Anodyne	EPHX2	46	39
CCO/C=C(\C#N)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198151	FH	On-Demand	Reactive	EPHX2	28	40
CCO/C=C(/C#N)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198152	FH	On-Demand	Reactive	EPHX2	28	40
C#CCCCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198153	FI	On-Demand	Mild	EPHX2	35	42
C#CCCCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198153	FI	On-Demand	Mild	ETHR	53	33
CCOC(=O)NCCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198155	HH	On-Demand	Anodyne	EPHX2	53	47
CCOC(=O)NCCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198155	HH	On-Demand	Anodyne	ETHR	58	33
CC(C)(C)OC(=O)NCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198156	HH	On-Demand	Anodyne	CTSS	18	40
CC(C)(C)OC(=O)NCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198156	HH	On-Demand	Anodyne	EPHX2	49	46
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccccc2)C1	ZINC000819198158	ED	On-Demand	Anodyne	ADRB2	56	49
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccccc2)C1	ZINC000819198158	ED	On-Demand	Anodyne	ADRB1	81	45
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccccc2)C1	ZINC000819198158	ED	On-Demand	Anodyne	ADRB3	53	45
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccccc2)C1	ZINC000819198158	ED	On-Demand	Anodyne	CASR	18	40
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccccc2)C1	ZINC000819198158	ED	On-Demand	Anodyne	ABCB1	37	44
O[C@H](CN[C@@H]1CC[C@H]2SCCS[C@H]12)COc1cccc2[nH]ccc12	ZINC000819198162	FF	On-Demand	Anodyne	ADRB1	23	66
O[C@H](CN[C@@H]1CC[C@H]2SCCS[C@H]12)COc1cccc2[nH]ccc12	ZINC000819198162	FF	On-Demand	Anodyne	HTR1A	16	66
O[C@H](CN[C@@H]1CC[C@H]2SCCS[C@H]12)COc1cccc2[nH]ccc12	ZINC000819198162	FF	On-Demand	Anodyne	SLC6A4	20	43
O[C@H](CN[C@@H]1CC[C@H]2SCCS[C@@H]12)COc1cccc2[nH]ccc12	ZINC000819198163	FF	On-Demand	Anodyne	ADRB1	23	66
O[C@H](CN[C@@H]1CC[C@H]2SCCS[C@@H]12)COc1cccc2[nH]ccc12	ZINC000819198163	FF	On-Demand	Anodyne	HTR1A	16	66
O[C@H](CN[C@@H]1CC[C@H]2SCCS[C@@H]12)COc1cccc2[nH]ccc12	ZINC000819198163	FF	On-Demand	Anodyne	SLC6A4	20	43
O[C@H](CN[C@@H]1CC[C@@H]2SCCS[C@@H]21)COc1cccc2[nH]ccc12	ZINC000819198164	FF	On-Demand	Anodyne	ADRB1	23	66
O[C@H](CN[C@@H]1CC[C@@H]2SCCS[C@@H]21)COc1cccc2[nH]ccc12	ZINC000819198164	FF	On-Demand	Anodyne	HTR1A	16	66
O[C@H](CN[C@@H]1CC[C@@H]2SCCS[C@@H]21)COc1cccc2[nH]ccc12	ZINC000819198164	FF	On-Demand	Anodyne	SLC6A4	20	43
O[C@H](CN[C@@H]1CC[C@@H]2SCCS[C@H]21)COc1cccc2[nH]ccc12	ZINC000819198165	FF	On-Demand	Anodyne	ADRB1	23	66
O[C@H](CN[C@@H]1CC[C@@H]2SCCS[C@H]21)COc1cccc2[nH]ccc12	ZINC000819198165	FF	On-Demand	Anodyne	HTR1A	16	66
O[C@H](CN[C@@H]1CC[C@@H]2SCCS[C@H]21)COc1cccc2[nH]ccc12	ZINC000819198165	FF	On-Demand	Anodyne	SLC6A4	20	43
CC(C)(C)OC(=O)N1CC(CNCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819198179	GD	On-Demand	Mild	GPR119	42	43
CSc1ccc(OC[C@@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819198195	GF	On-Demand	Anodyne	ADRB1	51	38
CSc1ccc(OC[C@@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819198195	GF	On-Demand	Anodyne	GPR119	28	42
CSc1ccc(OC[C@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819198196	GF	On-Demand	Anodyne	ADRB1	51	38
CSc1ccc(OC[C@H](O)CNCC2CN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819198196	GF	On-Demand	Anodyne	GPR119	28	42
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819198197	FF	On-Demand	Anodyne	CACNA1I	50	38
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819198197	FF	On-Demand	Anodyne	GPR119	22	41
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819198198	FF	On-Demand	Anodyne	CACNA1I	50	38
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819198198	FF	On-Demand	Anodyne	GPR119	22	41
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819198199	EE	On-Demand	Anodyne	GPR119	29	46
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819198200	EE	On-Demand	Anodyne	GPR119	29	46
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)CN2CCc3ccccc3C2)C1	ZINC000819198213	GD	On-Demand	Anodyne	NOD2	42	36
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)CN2CCc3ccccc3C2)C1	ZINC000819198214	GD	On-Demand	Anodyne	NOD2	42	36
CC(C)c1ccc2c(c1)[C@@H](NC[C@H](O)c1cccnc1)CCC2	ZINC000819198215	DH	On-Demand	Anodyne	ADRB3	58	46
CC(C)c1ccc2c(c1)[C@@H](NC[C@@H](O)c1cccnc1)CCC2	ZINC000819198216	DH	On-Demand	Anodyne	ADRB3	58	46
CC(C)(C)OC(=O)N1CC(CNCCC(=O)Nc2cccc(F)c2)C1	ZINC000819198217	FF	On-Demand	Anodyne	CCR3	28	41
CC(C)(C)OC(=O)N1CC(CNCCC(=O)Nc2cccc(F)c2)C1	ZINC000819198217	FF	On-Demand	Anodyne	GPR119	26	43
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819198232	FF	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819198232	FF	On-Demand	Anodyne	GPR119	24	42
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819198233	FF	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819198233	FF	On-Demand	Anodyne	GPR119	24	42
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819198247	GG	On-Demand	Anodyne	ADRB2	37	54
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819198247	GG	On-Demand	Anodyne	ADRB1	61	36
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819198247	GG	On-Demand	Anodyne	ADRB3	22	52
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819198247	GG	On-Demand	Anodyne	CYP2D6	19	43
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819198247	GG	On-Demand	Anodyne	ABCB1	48	45
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819198248	GG	On-Demand	Anodyne	ADRB2	37	54
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819198248	GG	On-Demand	Anodyne	ADRB1	61	36
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819198248	GG	On-Demand	Anodyne	ADRB3	22	52
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819198248	GG	On-Demand	Anodyne	CYP2D6	19	43
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819198248	GG	On-Demand	Anodyne	ABCB1	48	45
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819198249	EF	On-Demand	Anodyne	ADRB1	47	46
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819198249	EF	On-Demand	Anodyne	ADRB3	60	46
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819198249	EF	On-Demand	Anodyne	CYP3A4	47	35
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819198249	EF	On-Demand	Anodyne	CACNA1I	53	38
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819198250	EF	On-Demand	Anodyne	ADRB1	47	46
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819198250	EF	On-Demand	Anodyne	ADRB3	60	46
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819198250	EF	On-Demand	Anodyne	CYP3A4	47	35
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819198250	EF	On-Demand	Anodyne	CACNA1I	53	38
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1cccc(Br)c1)C1CC1	ZINC000819198259	GG	On-Demand	Anodyne	PAPA1_CARPA	22	41
O=C(NCC1CCN(Cc2cccs2)CC1)C(F)=C1CCC1	ZINC000819198271	DG	On-Demand	Anodyne	CACNA1I	56	35
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000819198289	FF	On-Demand	Bother	CACNA1D	54	33
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000819198291	FF	On-Demand	Bother	CACNA1D	54	33
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)CN1CCc2ccccc2C1)C1CC1	ZINC000819198292	GE	On-Demand	Anodyne	NOD2	41	35
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)CN1CCc2ccccc2C1)C1CC1	ZINC000819198293	GE	On-Demand	Anodyne	NOD2	41	35
O=C(NCCc1ccccc1Br)C(F)=C1CCC1	ZINC000819198301	DH	On-Demand	Anodyne	CA9	16	42
O[C@H](CN[C@H]1CCN(c2ccc(Cl)c(F)c2)C1)c1cccc(F)c1	ZINC000819198302	FH	On-Demand	Anodyne	ADRB3	22	46
O[C@@H](CN[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1)c1cccc(F)c1	ZINC000819198303	FH	On-Demand	Anodyne	ADRB3	22	46
O[C@@H](CN[C@H]1CCN(c2ccc(Cl)c(F)c2)C1)c1cccc(F)c1	ZINC000819198304	FH	On-Demand	Anodyne	ADRB3	22	46
O[C@H](CN[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1)c1cccc(F)c1	ZINC000819198305	FH	On-Demand	Anodyne	ADRB3	22	46
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)C1CCCCC1)C1CC1	ZINC000819198317	EF	On-Demand	Anodyne	REN	27	40
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)C1CCCCC1)C1CC1	ZINC000819198319	EF	On-Demand	Anodyne	REN	27	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H]1c1nc3ccc(C)cc3[nH]1)C2	ZINC000819198339	GG	On-Demand	Anodyne	PRCP	43	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1c1nc3ccc(C)cc3[nH]1)C2	ZINC000819198340	GG	On-Demand	Anodyne	PRCP	43	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1c1nc3ccc(C)cc3[nH]1)C2	ZINC000819198341	GG	On-Demand	Anodyne	PRCP	43	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H]1c1nc3ccc(C)cc3[nH]1)C2	ZINC000819198342	GG	On-Demand	Anodyne	PRCP	43	38
CNC(=O)[C@@H]1CCC[C@@H]1NC[C@H](O)c1cccnc1	ZINC000819198354	CC	On-Demand	Anodyne	ADRB1	28	45
CNC(=O)[C@@H]1CCC[C@@H]1NC[C@H](O)c1cccnc1	ZINC000819198354	CC	On-Demand	Anodyne	ADRB3	89	45
CNC(=O)[C@@H]1CCC[C@@H]1NC[C@@H](O)c1cccnc1	ZINC000819198355	CC	On-Demand	Anodyne	ADRB1	28	45
CNC(=O)[C@@H]1CCC[C@@H]1NC[C@@H](O)c1cccnc1	ZINC000819198355	CC	On-Demand	Anodyne	ADRB3	89	45
CNC(=O)[C@@H]1CCC[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819198356	CC	On-Demand	Anodyne	ADRB1	28	45
CNC(=O)[C@@H]1CCC[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819198356	CC	On-Demand	Anodyne	ADRB3	89	45
CNC(=O)[C@@H]1CCC[C@H]1NC[C@H](O)c1cccnc1	ZINC000819198357	CC	On-Demand	Anodyne	ADRB1	28	45
CNC(=O)[C@@H]1CCC[C@H]1NC[C@H](O)c1cccnc1	ZINC000819198357	CC	On-Demand	Anodyne	ADRB3	89	45
C[C@@](O)(C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C1CCC1	ZINC000819198358	FH	On-Demand	Anodyne	EPHX2	41	43
O=CNc1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1	ZINC000819198359	GI	On-Demand	Anodyne	EPHX2	63	53
O=CNc1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cc1	ZINC000819198359	GI	On-Demand	Anodyne	L3MBTL3	62	36
Cn1nc(Br)cc1C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198360	II	On-Demand	Anodyne	EPHX2	41	40
Cn1nc(Br)cc1C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198360	II	On-Demand	Anodyne	RBP4	22	41
O=C(Cc1cccnc1Br)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198361	IJ	On-Demand	Anodyne	P2RY1	22	41
O=C(Cc1cccnc1Br)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198361	IJ	On-Demand	Anodyne	EPHX2	40	40
O=C(Cc1cccnc1Br)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198361	IJ	On-Demand	Anodyne	ETHR	46	32
O=C(c1ccc(N2CCOC2=O)cc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198362	IJ	On-Demand	Anodyne	EPHX2	36	43
O=C(c1ccc(N2CCOC2=O)cc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198362	IJ	On-Demand	Anodyne	DGAT1	25	53
O=C(CSc1cccc[n+]1[O-])N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198363	HH	On-Demand	Anodyne	EPHX2	35	42
C#Cc1cncc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c1	ZINC000819198366	FH	On-Demand	Mild	EPHX2	37	45
CC(=O)N/C(=C\c1ccccc1)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198376	II	On-Demand	Anodyne	EPHX2	40	39
CC(=O)N/C(=C/c1ccccc1)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198377	II	On-Demand	Anodyne	EPHX2	40	39
O=C(c1nc(Br)cs1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198378	IJ	On-Demand	Anodyne	EPHX2	37	40
O=C(c1nc(Br)cs1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198378	IJ	On-Demand	Anodyne	RBP4	20	40
CCn1ncc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)n1	ZINC000819198379	FG	On-Demand	Anodyne	EPHX2	39	40
O=C(CSc1nnc(S)s1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198380	II	On-Demand	Anodyne	EPHX2	31	42
O=C(c1csc2cncn12)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198382	GI	On-Demand	Anodyne	EPHX2	38	43
O=C(c1csc2cncn12)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198382	GI	On-Demand	Anodyne	RBP4	15	42
O=C(c1nnc2ccccc2c1O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198384	HI	On-Demand	Anodyne	EPHX2	41	40
O=C(N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C1(O)CCOCC1	ZINC000819198386	FF	On-Demand	Anodyne	MMP13	19	43
O=C(N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C1(O)CCOCC1	ZINC000819198386	FF	On-Demand	Anodyne	MMP2	24	43
O=C(N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C1(O)CCOCC1	ZINC000819198386	FF	On-Demand	Anodyne	EPHX2	49	40
Cc1nonc1C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819198399	EF	On-Demand	Anodyne	CNR1	16	44
O=C(c1nc(Br)ccc1F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198405	IJ	On-Demand	Anodyne	EPHX2	40	40
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819198416	EE	On-Demand	Anodyne	GPR119	31	41
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819198417	EE	On-Demand	Anodyne	GPR119	31	41
C/C=C(/C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819198420	DH	On-Demand	Anodyne	MTNR1A	42	35
C/C=C(\C)C(=O)NCCc1ccc(Br)cc1Cl	ZINC000819198422	DH	On-Demand	Anodyne	MTNR1A	42	35
CC(C)(C)OC(=O)N1CC(CNCCC(=O)Nc2cccnc2)C1	ZINC000819198426	ED	On-Demand	Anodyne	NAMPT	17	47
C[C@H](O)c1cn(CC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)nn1	ZINC000819198430	GF	On-Demand	Anodyne	EPHX2	23	41
CCOC(=O)N1CCC(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CC1	ZINC000819198431	II	On-Demand	Anodyne	EPHX2	56	50
O[C@H](CN[C@@H]1CC[C@H]2SCCS[C@@H]12)COc1ccc2ccccc2c1	ZINC000819198433	GH	On-Demand	Anodyne	ADRB2	27	50
CC(C)c1ocnc1C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198435	GJ	On-Demand	Anodyne	EPHX2	43	42
O[C@H](CN[C@@H]1CC[C@@H]2SCCS[C@H]21)COc1ccc2ccccc2c1	ZINC000819198436	GH	On-Demand	Anodyne	ADRB2	27	50
Cc1nc(S)sc1CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198437	HJ	On-Demand	Anodyne	EPHX2	29	41
Cc1nc(S)sc1CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198437	HJ	On-Demand	Anodyne	ETHR	56	35
O[C@H](CN[C@@H]1CC[C@@H]2SCCS[C@@H]21)COc1ccc2ccccc2c1	ZINC000819198438	GH	On-Demand	Anodyne	ADRB2	27	50
O[C@H](CN[C@@H]1CC[C@H]2SCCS[C@H]12)COc1ccc2ccccc2c1	ZINC000819198439	GH	On-Demand	Anodyne	ADRB2	27	50
O=C(c1cccc(N2CCOC2=O)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198445	IJ	On-Demand	Anodyne	RBP4	15	41
O=C(c1cccc(N2CCOC2=O)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198445	IJ	On-Demand	Anodyne	DGAT1	19	48
C=CCC(F)(F)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198457	FJ	On-Demand	Mild	EPHX2	40	43
O=C(c1cccc2nccn12)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198459	GI	On-Demand	Anodyne	EPHX2	41	43
O=C(C(F)F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198463	DH	On-Demand	Anodyne	CCR1	32	40
O=C(C(F)F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198463	DH	On-Demand	Anodyne	EPHX2	51	49
Cn1cc(/C=C/C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c(=O)n(C)c1=O	ZINC000819198472	IE	On-Demand	Anodyne	ITGAL	42	34
Cn1cc(/C=C\C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c(=O)n(C)c1=O	ZINC000819198473	IE	On-Demand	Anodyne	ITGAL	42	34
CCCCCCCC(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819198474	DJ	On-Demand	Mild	HTR4	31	44
O=C(c1cccc(F)n1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198479	FI	On-Demand	Anodyne	EPHX2	46	42
O=C(c1cc2occc2[nH]1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198481	GJ	On-Demand	Anodyne	EPHX2	41	38
O=C(c1cc(=O)c2ccccc2o1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198487	HJ	On-Demand	Anodyne	TNKS	23	41
Cc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)cc1	ZINC000819198489	EF	On-Demand	Anodyne	ADRB2	29	48
Cc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)cc1	ZINC000819198489	EF	On-Demand	Anodyne	ADRB1	36	40
O=Cc1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)[nH]1	ZINC000819198490	FH	On-Demand	Anodyne	EPHX2	42	41
O=C(c1ccc(N2CCOCC2)nc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198491	IH	On-Demand	Anodyne	FASN	32	43
O=C(c1ccc(N2CCOCC2)nc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198491	IH	On-Demand	Anodyne	EPHX2	36	48
O=C(c1ccc(N2CCOCC2)nc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198491	IH	On-Demand	Anodyne	HPGDS	15	46
Cc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)cc1	ZINC000819198492	EF	On-Demand	Anodyne	ADRB2	29	48
Cc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)cc1	ZINC000819198492	EF	On-Demand	Anodyne	ADRB1	36	40
Cc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)cc1	ZINC000819198494	EF	On-Demand	Anodyne	ADRB2	29	48
Cc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)cc1	ZINC000819198494	EF	On-Demand	Anodyne	ADRB1	36	40
Cc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)cc1	ZINC000819198495	EF	On-Demand	Anodyne	ADRB2	29	48
Cc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)cc1	ZINC000819198495	EF	On-Demand	Anodyne	ADRB1	36	40
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819198497	FE	On-Demand	Bother	CACNA1C	45	35
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819198497	FE	On-Demand	Bother	CACNA1D	64	35
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819198498	FE	On-Demand	Bother	CACNA1C	45	35
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819198498	FE	On-Demand	Bother	CACNA1D	64	35
O=C([C@@H]1CCC=CO1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198501	FH	On-Demand	Anodyne	EPHX2	42	46
O=C([C@H]1CCC=CO1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198504	FH	On-Demand	Anodyne	EPHX2	42	46
Cn1nnc(Br)c1C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198509	IG	On-Demand	Anodyne	EPHX2	39	40
C=CC(=O)NCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198511	FF	On-Demand	Anodyne	EPHX2	40	43
C=CC(=O)NCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198511	FF	On-Demand	Anodyne	TGM2	15	41
C=CC(=O)NCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198511	FF	On-Demand	Anodyne	ETHR	51	32
CC(C)(C)OC(=O)N1CC(CNCCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000819198514	FG	On-Demand	Anodyne	CACNA1I	41	32
CCc1noc(CCCC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)n1	ZINC000819198523	HI	On-Demand	Anodyne	EPHX2	26	41
CCc1noc(CCCC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)n1	ZINC000819198523	HI	On-Demand	Anodyne	ETHR	70	38
O=C(CS[C@H]1CCS(=O)(=O)C1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198525	IG	On-Demand	Anodyne	EPHX2	25	40
O=C(CS[C@@H]1CCS(=O)(=O)C1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198528	IG	On-Demand	Anodyne	EPHX2	25	40
Cc1cc(F)ccc1[C@@H](O)CNCC1CN(C(=O)OC(C)(C)C)C1	ZINC000819198532	EF	On-Demand	Anodyne	GPR119	26	43
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)c1	ZINC000819198536	FF	On-Demand	Anodyne	ADRB2	21	41
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)c1	ZINC000819198536	FF	On-Demand	Anodyne	ABCB1	15	42
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)c1	ZINC000819198538	FF	On-Demand	Anodyne	ADRB2	21	41
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)c1	ZINC000819198538	FF	On-Demand	Anodyne	ABCB1	15	42
C#CCCCCCC(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819198539	DH	On-Demand	Mild	HTR4	20	41
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)c1	ZINC000819198540	FF	On-Demand	Anodyne	ADRB2	21	41
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)c1	ZINC000819198540	FF	On-Demand	Anodyne	ABCB1	15	42
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)c1	ZINC000819198542	FF	On-Demand	Anodyne	ADRB2	21	41
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)c1	ZINC000819198542	FF	On-Demand	Anodyne	ABCB1	15	42
O=C1C[C@@H](CC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CO1	ZINC000819198545	FG	On-Demand	Anodyne	EPHX2	36	45
O=C1C[C@@H](CC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CO1	ZINC000819198545	FG	On-Demand	Anodyne	DGAT1	19	40
O=C1C[C@@H](CC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CO1	ZINC000819198545	FG	On-Demand	Anodyne	ETHR	50	32
O=C1C[C@H](CC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CO1	ZINC000819198547	FG	On-Demand	Anodyne	EPHX2	36	45
O=C1C[C@H](CC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CO1	ZINC000819198547	FG	On-Demand	Anodyne	DGAT1	19	40
O=C1C[C@H](CC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CO1	ZINC000819198547	FG	On-Demand	Anodyne	ETHR	50	32
O=C(c1nc(Cl)cs1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198550	GJ	On-Demand	Anodyne	EPHX2	35	43
O=C(c1nc(Cl)cs1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198550	GJ	On-Demand	Anodyne	RBP4	20	40
Cc1nc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c2ccccn12	ZINC000819198553	HJ	On-Demand	Anodyne	EPHX2	40	39
COCCS(=O)(=O)CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198556	HE	On-Demand	Anodyne	MMP13	18	40
COCCS(=O)(=O)CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198556	HE	On-Demand	Anodyne	MMP2	21	40
COCCS(=O)(=O)CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198556	HE	On-Demand	Anodyne	MMP9	18	40
COCCS(=O)(=O)CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198556	HE	On-Demand	Anodyne	EPHX2	35	43
O=C(Cc1csc(-c2nc[nH]n2)n1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198557	IH	On-Demand	Anodyne	ETHR	67	36
CC[C@@H](O)CNC[C@H](NC(=O)OC(C)(C)C)C1CC1	ZINC000819198564	CD	On-Demand	Anodyne	CTSK	16	45
CC[C@@H](O)CNC[C@@H](NC(=O)OC(C)(C)C)C1CC1	ZINC000819198565	CD	On-Demand	Anodyne	CTSK	16	45
O[C@H](CN[C@H]1CCN(c2ccc(Cl)c(F)c2)C1)c1ccc(F)cc1	ZINC000819198581	FH	On-Demand	Anodyne	ADRB3	19	43
O[C@@H](CN[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1)c1ccc(F)cc1	ZINC000819198582	FH	On-Demand	Anodyne	ADRB3	19	43
O[C@@H](CN[C@H]1CCN(c2ccc(Cl)c(F)c2)C1)c1ccc(F)cc1	ZINC000819198583	FH	On-Demand	Anodyne	ADRB3	19	43
O[C@H](CN[C@@H]1CCN(c2ccc(Cl)c(F)c2)C1)c1ccc(F)cc1	ZINC000819198584	FH	On-Demand	Anodyne	ADRB3	19	43
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)c1ccc(F)cc1F	ZINC000819198639	GI	On-Demand	Anodyne	ADRB2	77	47
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)c1ccc(F)cc1F	ZINC000819198639	GI	On-Demand	Anodyne	ADRB1	87	50
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)c1ccc(F)cc1F	ZINC000819198639	GI	On-Demand	Anodyne	ADRB3	74	50
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)c1ccc(F)cc1F	ZINC000819198640	GI	On-Demand	Anodyne	ADRB2	77	47
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)c1ccc(F)cc1F	ZINC000819198640	GI	On-Demand	Anodyne	ADRB1	87	50
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)c1ccc(F)cc1F	ZINC000819198640	GI	On-Demand	Anodyne	ADRB3	74	50
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1cc2ccccc2o1)C1CC1	ZINC000819198679	FG	On-Demand	Anodyne	REN	44	36
C#CCNC(=O)C1CCN(C(=O)c2cnc(OC)c(Br)c2)CC1	ZINC000819198716	GD	On-Demand	Mild	PTR1	45	32
C#CCNC(=O)C1CCN(C(=O)c2cnc(OC)c(Br)c2)CC1	ZINC000819198716	GD	On-Demand	Mild	L3MBTL3	42	37
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819198739	EG	On-Demand	Anodyne	F3	66	33
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819198740	EG	On-Demand	Anodyne	F3	66	33
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819198741	EG	On-Demand	Anodyne	F3	66	33
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819198742	EG	On-Demand	Anodyne	F3	66	33
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819198768	DE	On-Demand	Anodyne	GPR119	26	48
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819198769	DE	On-Demand	Anodyne	GPR119	26	48
O[C@@H](CN[C@@H]1CCCN(c2ccccc2F)C1)c1ccc(F)cc1	ZINC000819198770	EG	On-Demand	Anodyne	SLC6A3	15	47
O[C@@H](CN[C@H]1CCCN(c2ccccc2F)C1)c1ccc(F)cc1	ZINC000819198771	EG	On-Demand	Anodyne	SLC6A3	15	47
O[C@H](CN[C@H]1CCCN(c2ccccc2F)C1)c1ccc(F)cc1	ZINC000819198772	EG	On-Demand	Anodyne	SLC6A3	15	47
O[C@H](CN[C@@H]1CCCN(c2ccccc2F)C1)c1ccc(F)cc1	ZINC000819198773	EG	On-Demand	Anodyne	SLC6A3	15	47
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCCN(c3ccccc3F)C2)cc1	ZINC000819198827	GF	On-Demand	Anodyne	ADRB3	21	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCCN(c3ccccc3F)C2)cc1	ZINC000819198829	GF	On-Demand	Anodyne	ADRB3	21	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCCN(c3ccccc3F)C2)cc1	ZINC000819198831	GF	On-Demand	Anodyne	ADRB3	21	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCCN(c3ccccc3F)C2)cc1	ZINC000819198832	GF	On-Demand	Anodyne	ADRB3	21	40
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)cc1	ZINC000819198845	GF	On-Demand	Anodyne	ADRB2	35	54
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)cc1	ZINC000819198845	GF	On-Demand	Anodyne	ADRB1	62	54
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)cc1	ZINC000819198845	GF	On-Demand	Anodyne	ADRB3	39	42
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)cc1	ZINC000819198848	GF	On-Demand	Anodyne	ADRB2	35	54
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)cc1	ZINC000819198848	GF	On-Demand	Anodyne	ADRB1	62	54
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)cc1	ZINC000819198848	GF	On-Demand	Anodyne	ADRB3	39	42
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)cc1	ZINC000819198849	GF	On-Demand	Anodyne	ADRB2	35	54
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)cc1	ZINC000819198849	GF	On-Demand	Anodyne	ADRB1	62	54
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)cc1	ZINC000819198849	GF	On-Demand	Anodyne	ADRB3	39	42
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)cc1	ZINC000819198850	GF	On-Demand	Anodyne	ADRB2	35	54
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)cc1	ZINC000819198850	GF	On-Demand	Anodyne	ADRB1	62	54
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)cc1	ZINC000819198850	GF	On-Demand	Anodyne	ADRB3	39	42
CCc1cccc2c1N(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819198863	FH	On-Demand	Mild	PAPA1_CARPA	42	42
CCc1cccc2c1N(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819198863	FH	On-Demand	Mild	FPR1	40	35
CCc1cccc2c1N(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819198866	FH	On-Demand	Mild	PAPA1_CARPA	42	42
CCc1cccc2c1N(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819198866	FH	On-Demand	Mild	FPR1	40	35
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819198870	GD	On-Demand	Bother	ADRB1	23	42
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819198870	GD	On-Demand	Bother	ADRB3	15	42
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819198871	GD	On-Demand	Bother	ADRB1	23	42
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819198871	GD	On-Demand	Bother	ADRB3	15	42
O[C@@H](CNCC1C2CC3CC(C2)CC1C3)c1cccnc1	ZINC000819198893	CF	On-Demand	Anodyne	ADRB2	20	40
O[C@@H](CNCC1C2CC3CC(C2)CC1C3)c1cccnc1	ZINC000819198893	CF	On-Demand	Anodyne	ADRB1	22	40
O[C@@H](CNCC1C2CC3CC(C2)CC1C3)c1cccnc1	ZINC000819198893	CF	On-Demand	Anodyne	ADRB3	85	44
O[C@H](CNCC1C2CC3CC(C2)CC1C3)c1cccnc1	ZINC000819198897	CF	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNCC1C2CC3CC(C2)CC1C3)c1cccnc1	ZINC000819198897	CF	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CNCC1C2CC3CC(C2)CC1C3)c1cccnc1	ZINC000819198897	CF	On-Demand	Anodyne	ADRB3	85	44
C[C@@H](CC#N)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819198899	FI	On-Demand	Mild	CTSK	15	50
C[C@@H](CC#N)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819198899	FI	On-Demand	Mild	ECE1	21	40
C[C@@H](CC#N)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819198899	FI	On-Demand	Mild	REN	41	42
C[C@@H](CC#N)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819198899	FI	On-Demand	Mild	CTSH	37	40
C[C@@H](CC#N)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819198904	FI	On-Demand	Mild	CTSK	15	50
C[C@@H](CC#N)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819198904	FI	On-Demand	Mild	ECE1	21	40
C[C@@H](CC#N)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819198904	FI	On-Demand	Mild	REN	41	42
C[C@@H](CC#N)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819198904	FI	On-Demand	Mild	CTSH	37	40
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccccc2F)C1	ZINC000819198912	FE	On-Demand	Anodyne	ADRB2	26	41
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccccc2F)C1	ZINC000819198912	FE	On-Demand	Anodyne	ADRB1	54	38
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccccc2F)C1	ZINC000819198912	FE	On-Demand	Anodyne	ABCB1	40	46
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccccc2F)C1	ZINC000819198912	FE	On-Demand	Anodyne	GPR119	29	46
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819198913	FE	On-Demand	Anodyne	ADRB2	26	41
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819198913	FE	On-Demand	Anodyne	ADRB1	54	38
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819198913	FE	On-Demand	Anodyne	ABCB1	40	46
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819198913	FE	On-Demand	Anodyne	GPR119	29	46
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819198916	GI	On-Demand	Bother	ADRB2	80	52
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819198916	GI	On-Demand	Bother	ADRB1	99	49
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819198916	GI	On-Demand	Bother	ADRB3	126	49
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819198916	GI	On-Demand	Bother	PTGER3	42	32
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819198916	GI	On-Demand	Bother	ACR	25	45
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819198916	GI	On-Demand	Bother	FFAR1	21	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819198917	GI	On-Demand	Bother	ADRB2	80	52
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819198917	GI	On-Demand	Bother	ADRB1	99	49
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819198917	GI	On-Demand	Bother	ADRB3	126	49
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819198917	GI	On-Demand	Bother	PTGER3	42	32
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819198917	GI	On-Demand	Bother	ACR	25	45
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cccc(OCc3ccccc3)c2)cc1	ZINC000819198917	GI	On-Demand	Bother	FFAR1	21	42
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)Nc1cccnc1Cl	ZINC000819198938	HE	On-Demand	Anodyne	TGM2	44	38
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)Nc1cccnc1Cl	ZINC000819198938	HE	On-Demand	Anodyne	F13A1	50	38
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)Nc1cccnc1Cl	ZINC000819198938	HE	On-Demand	Anodyne	NAMPT	55	47
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)Nc1cccnc1Cl	ZINC000819198938	HE	On-Demand	Anodyne	G2YM83_BOTF4	44	32
O=C(/C=C/[C@@H]1CCCO1)Nc1ccccc1C(=O)NCc1cccnc1	ZINC000819198946	FF	On-Demand	Anodyne	NAMPT	65	38
O=C(/C=C\[C@@H]1CCCO1)Nc1ccccc1C(=O)NCc1cccnc1	ZINC000819198948	FF	On-Demand	Anodyne	NAMPT	65	38
O=C(c1cccnc1-n1cccn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198949	HI	On-Demand	Anodyne	EPHX2	36	41
O=C(/C=C\[C@H]1CCCO1)Nc1ccccc1C(=O)NCc1cccnc1	ZINC000819198952	FF	On-Demand	Anodyne	NAMPT	65	38
O=C(c1ccnc(F)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198953	FI	On-Demand	Anodyne	EPHX2	46	48
O=C(c1ccnc(F)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198953	FI	On-Demand	Anodyne	RBP4	21	40
O=C(/C=C/[C@H]1CCCO1)Nc1ccccc1C(=O)NCc1cccnc1	ZINC000819198956	FF	On-Demand	Anodyne	NAMPT	65	38
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)Nc3cccnc3Cl)c2)C1	ZINC000819198960	HH	On-Demand	Anodyne	PPARD	16	44
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)Nc3cccnc3Cl)c2)C1	ZINC000819198960	HH	On-Demand	Anodyne	AKR1C3	55	39
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)Nc3cccnc3Cl)c2)C1	ZINC000819198960	HH	On-Demand	Anodyne	G2YM83_BOTF4	78	46
O=C(N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C(F)(F)F	ZINC000819198961	EH	On-Demand	Anodyne	EPHX2	54	60
CC[C@H]1OCC[C@H]1C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198969	FI	On-Demand	Anodyne	EPHX2	48	44
C#CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198980	CF	On-Demand	Mild	EPHX2	46	45
O=C(C1=COCC1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819198981	EH	On-Demand	Anodyne	EPHX2	45	40
O=C(NCCS(=O)(=O)N1CCOCC1)c1coc(=O)c2ccccc12	ZINC000819198999	FC	On-Demand	Anodyne	SLC6A9	32	41
O=C(CCCn1cncn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199002	GG	On-Demand	Anodyne	EPHX2	34	42
O=C(CCCn1cncn1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199002	GG	On-Demand	Anodyne	ETHR	53	33
O=C(Cc1cnn(-c2ccccc2)n1)NCCc1ccc(Br)cc1Cl	ZINC000819199004	HH	On-Demand	Anodyne	P2RX7	21	41
C#CCNC(=O)C1CCN(C(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819199008	FE	On-Demand	Mild	CACNA1G	35	43
O=C(/C=C\c1cccnc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199016	GI	On-Demand	Anodyne	CCR2	22	46
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)C1CC1)C1CC1	ZINC000819199017	CD	On-Demand	Anodyne	CTSK	15	47
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)C1CC1)C1CC1	ZINC000819199020	CD	On-Demand	Anodyne	CTSK	15	47
O=C(/C=C/c1cccnc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199024	GI	On-Demand	Anodyne	CCR2	22	46
CCCNC(=O)[C@H]1CCCN(C(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)C1	ZINC000819199032	FD	On-Demand	Anodyne	HLA-DRB3	44	31
CCCNC(=O)[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)C1	ZINC000819199034	FD	On-Demand	Anodyne	HLA-DRB3	44	31
CCCNC(=O)[C@@H]1CCCN(C(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)C1	ZINC000819199036	FD	On-Demand	Anodyne	HLA-DRB3	44	31
CCCNC(=O)[C@H]1CCCN(C(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)C1	ZINC000819199039	FD	On-Demand	Anodyne	HLA-DRB3	44	31
O=C(c1cccnc1F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199041	FI	On-Demand	Anodyne	EPHX2	46	44
C#CCC(C)(C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199046	FI	On-Demand	Mild	EPHX2	40	42
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2ccc(F)cc2Cl)CC1	ZINC000819199050	FG	On-Demand	Anodyne	P2RX7	26	53
O=S1(=O)CCC(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199052	GE	On-Demand	Anodyne	ADRB3	17	42
O=C([C@@H]1CSCCS1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199053	GI	On-Demand	Anodyne	EPHX2	35	45
O=S1(=O)CCC(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199057	GE	On-Demand	Anodyne	ADRB3	17	42
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccccc1C(=O)NCc1cccnc1	ZINC000819199059	FH	On-Demand	Anodyne	SCD	16	42
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccccc1C(=O)NCc1cccnc1	ZINC000819199059	FH	On-Demand	Anodyne	NAMPT	97	43
O=C([C@H]1CSCCS1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199061	GI	On-Demand	Anodyne	EPHX2	35	45
N#CCOc1ccccc1C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199063	HJ	On-Demand	Mild	EPHX2	45	39
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccccc1C(=O)NCc1cccnc1	ZINC000819199069	FH	On-Demand	Anodyne	SCD	16	42
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccccc1C(=O)NCc1cccnc1	ZINC000819199069	FH	On-Demand	Anodyne	NAMPT	97	43
O=C(CCN1CCOC1=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199073	GG	On-Demand	Anodyne	EPHX2	32	40
O=C(CCN1CCOC1=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199073	GG	On-Demand	Anodyne	TRAR	16	41
O=C(CCN1CCOC1=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199073	GG	On-Demand	Anodyne	ETHR	54	33
O=C(c1ccnc(Br)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199075	IJ	On-Demand	Anodyne	EPHX2	44	48
O=C(/C=C/c1ccc[nH]1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199078	FI	On-Demand	Anodyne	CCR2	20	44
O=C(/C=C\c1ccc[nH]1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199080	FI	On-Demand	Anodyne	CCR2	20	44
O=C(NCCc1ccc(Br)cc1Cl)c1cc(=O)c2ccc(F)cc2o1	ZINC000819199083	HI	On-Demand	Anodyne	KCNH2	15	50
O=C(NCCc1ccc(Br)cc1Cl)c1cc(=O)c2ccc(F)cc2o1	ZINC000819199083	HI	On-Demand	Anodyne	ABCG2	27	47
O=C(NCCc1ccc(Br)cc1Cl)c1cc(=O)c2ccc(F)cc2o1	ZINC000819199083	HI	On-Demand	Anodyne	GPR35	47	33
COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)Nc2cccnc2Cl)c1OC	ZINC000819199086	IE	On-Demand	Anodyne	G2YM83_BOTF4	72	36
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccc(F)cc2Cl)CC1	ZINC000819199092	FE	On-Demand	Anodyne	P2RX7	22	47
CC(C)c1nnnn1CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199093	GG	On-Demand	Anodyne	EPHX2	29	41
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(F)cc2Cl)CC1	ZINC000819199094	FE	On-Demand	Anodyne	P2RX7	22	47
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccc(F)cc2Cl)CC1	ZINC000819199095	FE	On-Demand	Anodyne	P2RX7	22	47
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(F)cc2Cl)CC1	ZINC000819199097	FE	On-Demand	Anodyne	P2RX7	22	47
COc1cccc([S@@](=O)CC(=O)NCCS(=O)(=O)N2CCOCC2)c1	ZINC000819199107	GB	On-Demand	Anodyne	DRD4	43	34
Cc1cc(OCC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)no1	ZINC000819199117	GH	On-Demand	Anodyne	EPHX2	51	43
Cc1cc(OCC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)no1	ZINC000819199117	GH	On-Demand	Anodyne	MCHR1	20	41
Cc1cc(OCC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)no1	ZINC000819199117	GH	On-Demand	Anodyne	ETHR	65	37
O=C(CC1CCC2(CC1)OCCO2)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199119	IJ	On-Demand	Anodyne	EPHX2	45	52
O=C(CC1CCC2(CC1)OCCO2)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199119	IJ	On-Demand	Anodyne	DGAT1	19	40
C#CCN1CCC[C@H]1C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199122	GG	On-Demand	Mild	EPHX2	36	44
C#CCN1CCC[C@H]1C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199122	GG	On-Demand	Mild	SFRP1	51	38
C#CCN1CCC[C@H]1C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199122	GG	On-Demand	Mild	WNT3	59	38
C#Cc1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cn1	ZINC000819199140	FH	On-Demand	Mild	EPHX2	42	51
C#Cc1ccc(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cn1	ZINC000819199140	FH	On-Demand	Mild	L3MBTL3	47	40
O=C(C1=COCCO1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199142	FG	On-Demand	Anodyne	EPHX2	42	39
C#CCN1CCC(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CC1	ZINC000819199143	GH	On-Demand	Mild	MMP2	19	46
C#CCN1CCC(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CC1	ZINC000819199143	GH	On-Demand	Mild	MMP14	15	46
C#CCN1CCC(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CC1	ZINC000819199143	GH	On-Demand	Mild	MMP9	17	46
C#CCN1CCC(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CC1	ZINC000819199143	GH	On-Demand	Mild	EPHX2	43	49
Cn1cc(/C=C/C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cn1	ZINC000819199144	GH	On-Demand	Anodyne	CCR2	18	46
Cn1cc(/C=C\C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)cn1	ZINC000819199145	GH	On-Demand	Anodyne	CCR2	18	46
O=C1CC[C@H](C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CCN1	ZINC000819199146	GG	On-Demand	Anodyne	EPHX2	45	48
O=C1CC[C@@H](C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)CCN1	ZINC000819199147	GG	On-Demand	Anodyne	EPHX2	45	48
COC(=O)N[C@@H](C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199148	FG	On-Demand	Anodyne	CCR1	36	45
COC(=O)N[C@@H](C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199148	FG	On-Demand	Anodyne	CTSS	17	41
COC(=O)N[C@@H](C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199148	FG	On-Demand	Anodyne	EPHX2	50	50
O=C(c1nc(Cl)ccc1F)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199149	HJ	On-Demand	Anodyne	EPHX2	44	45
CC(C)[C@H](O)CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199152	FH	On-Demand	Anodyne	CCR1	31	40
CC(C)[C@H](O)CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199152	FH	On-Demand	Anodyne	CTSS	18	47
CC(C)[C@H](O)CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199152	FH	On-Demand	Anodyne	EPHX2	57	48
C=C1c2ccccc2C(=O)N1CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199158	II	On-Demand	Anodyne	EPHX2	32	40
O=C(c1ccnc(-n2ccnc2)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199162	HI	On-Demand	Anodyne	SLC9A1	18	42
O=C(c1ccnc(-n2ccnc2)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199162	HI	On-Demand	Anodyne	EPHX2	39	47
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199163	IJ	On-Demand	Anodyne	EPHX2	29	43
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199164	IJ	On-Demand	Anodyne	EPHX2	29	43
N=C1NC(=O)[C@@H](CC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)S1	ZINC000819199165	HF	On-Demand	Anodyne	EPHX2	30	41
N=C1NC(=O)[C@H](CC(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)S1	ZINC000819199166	HF	On-Demand	Anodyne	EPHX2	30	41
Cn1cnnc1SCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199167	HG	On-Demand	Anodyne	EPHX2	40	44
Cc1nonc1C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199169	FG	On-Demand	Anodyne	EPHX2	48	42
O=C([C@@H](O)c1cccnc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199170	GG	On-Demand	Anodyne	EPHX2	32	40
O=C([C@H](O)c1cccnc1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199171	GG	On-Demand	Anodyne	EPHX2	32	40
O=C(C[C@H](O)c1cccc(F)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199172	HJ	On-Demand	Anodyne	CCR1	18	41
O=C(C[C@H](O)c1cccc(F)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199172	HJ	On-Demand	Anodyne	CCR5	41	38
O=C(C[C@H](O)c1cccc(F)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199172	HJ	On-Demand	Anodyne	EPHX2	39	41
O=C(C[C@@H](O)c1cccc(F)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199173	HJ	On-Demand	Anodyne	CCR1	18	41
O=C(C[C@@H](O)c1cccc(F)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199173	HJ	On-Demand	Anodyne	CCR5	41	38
O=C(C[C@@H](O)c1cccc(F)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199173	HJ	On-Demand	Anodyne	EPHX2	39	41
NS(=O)(=O)c1ccc(F)c(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c1	ZINC000819199178	IG	On-Demand	Anodyne	CCR1	20	41
NS(=O)(=O)c1ccc(F)c(C(=O)N2CCC(c3ccc(OC(F)(F)F)cc3)CC2)c1	ZINC000819199178	IG	On-Demand	Anodyne	EPHX2	42	44
N#CCc1ccccc1CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199181	HJ	On-Demand	Mild	P2RY1	40	37
N#CCc1ccccc1CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199181	HJ	On-Demand	Mild	EPHX2	38	41
N#CCc1ccccc1CC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199181	HJ	On-Demand	Mild	ETHR	46	34
O=C(N1CCC(c2ccc(OC(F)(F)F)cc2)CC1)C12CC(C(F)(F)F)(C1)C2	ZINC000819199188	HK	On-Demand	Anodyne	EPHX2	46	41
O=C(/C=C/c1ccc(O)c(O)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199217	HI	On-Demand	Clean	CCR2	22	49
O=C(/C=C\c1ccc(O)c(O)c1)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199219	HI	On-Demand	Clean	CCR2	22	49
Cc1sc(Cl)nc1C(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199222	HK	On-Demand	Anodyne	EPHX2	40	40
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)C1CC1	ZINC000819199229	GE	On-Demand	Anodyne	GPR119	23	42
O=C(/C=C\c1cccnc1)NCCc1ccc(Br)cc1Cl	ZINC000819199231	FH	On-Demand	Anodyne	BOTA	17	43
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)C1CC1	ZINC000819199233	GE	On-Demand	Anodyne	GPR119	23	42
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(Cc2cccs2)CC1	ZINC000819199235	EF	On-Demand	Anodyne	CACNA1I	53	34
O=C(/C=C/c1cccnc1)NCCc1ccc(Br)cc1Cl	ZINC000819199236	FH	On-Demand	Anodyne	BOTA	17	43
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(Cc2cccs2)CC1	ZINC000819199239	EF	On-Demand	Anodyne	CACNA1I	53	34
O=C(/C=C\[C@H]1CCCO1)NCC1CCN(Cc2cccs2)CC1	ZINC000819199242	EF	On-Demand	Anodyne	CACNA1I	53	34
O=C(/C=C/[C@H]1CCCO1)NCC1CCN(Cc2cccs2)CC1	ZINC000819199244	EF	On-Demand	Anodyne	CACNA1I	53	34
O=C(CCc1cncc2ccccc12)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199248	IK	On-Demand	Anodyne	ETHR	64	36
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccccc1Cl)C1CC1	ZINC000819199253	FG	On-Demand	Anodyne	REN	45	38
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1ccccc1Cl)C1CC1	ZINC000819199253	FG	On-Demand	Anodyne	FPR1	41	37
O=C(c1cc2ccccc2oc1=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199262	HJ	On-Demand	Anodyne	MAOB	15	44
O=C(c1cc2ccccc2oc1=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199262	HJ	On-Demand	Anodyne	EPHX2	40	39
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)c1cc(F)ccc1F	ZINC000819199265	GI	On-Demand	Anodyne	ADRB2	61	45
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)c1cc(F)ccc1F	ZINC000819199265	GI	On-Demand	Anodyne	ADRB1	76	50
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)c1cc(F)ccc1F	ZINC000819199265	GI	On-Demand	Anodyne	ADRB3	68	50
O[C@H](CNCCc1cccc(OCc2ccccc2)c1)c1cc(F)ccc1F	ZINC000819199265	GI	On-Demand	Anodyne	PDS	42	36
O=C([C@@H]1CCCC12OCCO2)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199267	GH	On-Demand	Anodyne	EPHX2	42	44
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)c1cc(F)ccc1F	ZINC000819199269	GI	On-Demand	Anodyne	ADRB2	61	45
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)c1cc(F)ccc1F	ZINC000819199269	GI	On-Demand	Anodyne	ADRB1	76	50
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)c1cc(F)ccc1F	ZINC000819199269	GI	On-Demand	Anodyne	ADRB3	68	50
O[C@@H](CNCCc1cccc(OCc2ccccc2)c1)c1cc(F)ccc1F	ZINC000819199269	GI	On-Demand	Anodyne	PDS	42	36
O=C([C@H]1CCCC12OCCO2)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199270	GH	On-Demand	Anodyne	EPHX2	42	44
COC(=O)N(C)CCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199274	HH	On-Demand	Anodyne	EPHX2	43	44
COC(=O)N(C)CCCC(=O)N1CCC(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819199274	HH	On-Demand	Anodyne	ETHR	41	34
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819199292	FG	On-Demand	Anodyne	ADRB1	42	43
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819199292	FG	On-Demand	Anodyne	ADRB3	64	43
CC(C)(C)OC(=O)N[C@@H](CNC[C@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819199292	FG	On-Demand	Anodyne	CYP3A4	45	35
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819199296	FG	On-Demand	Anodyne	ADRB1	42	43
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819199296	FG	On-Demand	Anodyne	ADRB3	64	43
CC(C)(C)OC(=O)N[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819199296	FG	On-Demand	Anodyne	CYP3A4	45	35
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccc(C#N)cc1	ZINC000819199310	CD	On-Demand	Reactive	CTSG	18	41
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccc(C#N)cc1	ZINC000819199310	CD	On-Demand	Reactive	CTRB1	15	41
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccc(C#N)cc1	ZINC000819199310	CD	On-Demand	Reactive	CELA2A	15	41
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccc(C#N)cc1	ZINC000819199310	CD	On-Demand	Reactive	CTRB_BOVIN	50	37
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819199375	GG	On-Demand	Anodyne	CACNA1I	52	36
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819199376	GG	On-Demand	Anodyne	CACNA1I	52	36
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COCc2ccccc2F)C1	ZINC000819199396	FE	On-Demand	Anodyne	GPR119	23	49
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COCc2ccccc2F)C1	ZINC000819199398	FE	On-Demand	Anodyne	GPR119	23	49
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc2ccccc2c1	ZINC000819199420	GJ	On-Demand	Mild	PAPA1_CARPA	52	52
O=C(CSc1cccc2cccc(Cl)c12)Nc1cccnc1Cl	ZINC000819199424	FK	On-Demand	Anodyne	G2YM83_BOTF4	66	33
O=C(CSc1cccc2cccc(Cl)c12)Nc1cccnc1Cl	ZINC000819199424	FK	On-Demand	Anodyne	FAS	24	42
CN(C)C(=O)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819199449	DD	On-Demand	Reactive	CRTM	56	35
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819199450	GG	On-Demand	Anodyne	ADRB2	41	53
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819199450	GG	On-Demand	Anodyne	ADRB1	60	42
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819199450	GG	On-Demand	Anodyne	ADRB3	37	42
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819199450	GG	On-Demand	Anodyne	CASR	41	43
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819199450	GG	On-Demand	Anodyne	ACOX1	50	37
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819199451	GG	On-Demand	Anodyne	ADRB2	41	53
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819199451	GG	On-Demand	Anodyne	ADRB1	60	42
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819199451	GG	On-Demand	Anodyne	ADRB3	37	42
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819199451	GG	On-Demand	Anodyne	CASR	41	43
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819199451	GG	On-Demand	Anodyne	ACOX1	50	37
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819199454	DE	On-Demand	Anodyne	PGC	51	35
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819199454	DE	On-Demand	Anodyne	PAPA1_CARPA	27	40
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819199454	DE	On-Demand	Anodyne	CTSL	17	40
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819199454	DE	On-Demand	Anodyne	REN	64	38
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819199454	DE	On-Demand	Anodyne	FPR1	47	37
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819199454	DE	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)Cc2ccccc2)C1	ZINC000819199455	DE	On-Demand	Anodyne	PGC	51	35
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)Cc2ccccc2)C1	ZINC000819199455	DE	On-Demand	Anodyne	PAPA1_CARPA	27	40
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)Cc2ccccc2)C1	ZINC000819199455	DE	On-Demand	Anodyne	CTSL	17	40
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)Cc2ccccc2)C1	ZINC000819199455	DE	On-Demand	Anodyne	REN	64	38
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)Cc2ccccc2)C1	ZINC000819199455	DE	On-Demand	Anodyne	FPR1	47	37
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)Cc2ccccc2)C1	ZINC000819199455	DE	On-Demand	Anodyne	GPR119	29	40
C[C@@H]1CCCC[C@H]1C(=O)NCCCNc1ncccn1	ZINC000819199460	CE	On-Demand	Anodyne	TBK1	75	36
C[C@@H]1CCCC[C@@H]1C(=O)NCCCNc1ncccn1	ZINC000819199461	CE	On-Demand	Anodyne	TBK1	75	36
O=C(CCN1c2ccccc2Sc2ccccc21)Nc1cccnc1Cl	ZINC000819199491	GK	On-Demand	Anodyne	G2YM83_BOTF4	64	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(-c3n[nH]c(C)n3)cc1)C2	ZINC000819199506	FF	On-Demand	Anodyne	MTOR	57	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(-c3n[nH]c(C)n3)cc1)C2	ZINC000819199509	FF	On-Demand	Anodyne	MTOR	57	36
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819199511	DE	On-Demand	Mild	ADRB2	81	46
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819199511	DE	On-Demand	Mild	ADRB1	85	43
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819199511	DE	On-Demand	Mild	ADRB3	97	48
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819199511	DE	On-Demand	Mild	CTRB_BOVIN	47	35
CN1CCC(N2CCC(NC(=O)C(F)=C3CCC3)CC2)CC1	ZINC000819199512	DE	On-Demand	Anodyne	SLC6A5	16	41
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819199514	DE	On-Demand	Mild	ADRB2	81	46
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819199514	DE	On-Demand	Mild	ADRB1	85	43
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819199514	DE	On-Demand	Mild	ADRB3	97	48
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819199514	DE	On-Demand	Mild	CTRB_BOVIN	47	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3cccc(OC)c3)CC1)C2	ZINC000819199520	GG	On-Demand	Anodyne	ADAM10	22	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3cccc(OC)c3)CC1)C2	ZINC000819199522	GG	On-Demand	Anodyne	ADAM10	22	42
C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cccnc3Cl)cc2[N+](=O)[O-])C1	ZINC000819199537	GI	On-Demand	Bother	TAAR1	29	47
C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cccnc3Cl)cc2[N+](=O)[O-])C1	ZINC000819199537	GI	On-Demand	Bother	G2YM83_BOTF4	70	42
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819199562	FF	On-Demand	Anodyne	ADRB1	58	43
N#Cc1ccc(OC2CCC(NC[C@H](O)c3cccc(Cl)c3)CC2)nc1	ZINC000819199566	FH	On-Demand	Mild	ADRB1	28	47
N#Cc1ccc(OC2CCC(NC[C@H](O)c3cccc(Cl)c3)CC2)nc1	ZINC000819199566	FH	On-Demand	Mild	ADRB3	42	47
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819199568	FF	On-Demand	Anodyne	ADRB1	58	43
N#Cc1ccc(OC2CCC(NC[C@@H](O)c3cccc(Cl)c3)CC2)nc1	ZINC000819199569	FH	On-Demand	Mild	ADRB1	28	47
N#Cc1ccc(OC2CCC(NC[C@@H](O)c3cccc(Cl)c3)CC2)nc1	ZINC000819199569	FH	On-Demand	Mild	ADRB3	42	47
O=S1(=O)CCC(CCNC[C@H](O)c2cccc(Br)c2)CC1	ZINC000819199590	GE	On-Demand	Anodyne	ADRB3	46	37
O[C@H](CNCCSCC(F)(F)F)c1cccc(Cl)c1	ZINC000819199591	DG	On-Demand	Anodyne	ADRB1	43	51
O[C@H](CNCCSCC(F)(F)F)c1cccc(Cl)c1	ZINC000819199591	DG	On-Demand	Anodyne	ADRB3	53	51
O=S1(=O)CCC(CCNC[C@@H](O)c2cccc(Br)c2)CC1	ZINC000819199592	GE	On-Demand	Anodyne	ADRB3	46	37
O[C@@H](CNCCSCC(F)(F)F)c1cccc(Cl)c1	ZINC000819199593	DG	On-Demand	Anodyne	ADRB1	43	51
O[C@@H](CNCCSCC(F)(F)F)c1cccc(Cl)c1	ZINC000819199593	DG	On-Demand	Anodyne	ADRB3	53	51
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819199599	EF	On-Demand	Anodyne	ADRB2	100	48
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819199599	EF	On-Demand	Anodyne	ADRB1	103	52
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819199599	EF	On-Demand	Anodyne	ADRB3	134	56
O[C@@H](CNCCCc1cccs1)c1ccc(OC(F)(F)F)cc1	ZINC000819199601	EH	On-Demand	Anodyne	ADRB3	28	44
O=S1(=O)CCC(CCNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819199602	EE	On-Demand	Anodyne	ADRB1	15	40
O=S1(=O)CCC(CCNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819199602	EE	On-Demand	Anodyne	ADRB3	24	40
O[C@H](CNCCCc1cccs1)c1ccc(OC(F)(F)F)cc1	ZINC000819199603	EH	On-Demand	Anodyne	ADRB3	28	44
COC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2C)c1	ZINC000819199622	DF	On-Demand	Anodyne	ADRB2	98	44
COC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2C)c1	ZINC000819199622	DF	On-Demand	Anodyne	ADRB1	89	45
COC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2C)c1	ZINC000819199622	DF	On-Demand	Anodyne	ADRB3	78	46
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2C)c1	ZINC000819199623	DF	On-Demand	Anodyne	ADRB2	98	44
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2C)c1	ZINC000819199623	DF	On-Demand	Anodyne	ADRB1	89	45
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2C)c1	ZINC000819199623	DF	On-Demand	Anodyne	ADRB3	78	46
O[C@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)Cc1ccccc1	ZINC000819199628	GF	On-Demand	Clean	DRD4	15	40
O[C@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)Cc1ccccc1	ZINC000819199628	GF	On-Demand	Clean	TACR2	26	40
O[C@@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)Cc1ccccc1	ZINC000819199629	GF	On-Demand	Clean	DRD4	15	40
O[C@@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)Cc1ccccc1	ZINC000819199629	GF	On-Demand	Clean	TACR2	26	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccc(OC)n1)C2	ZINC000819199636	ED	On-Demand	Anodyne	PDE8B	40	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccc(OC)n1)C2	ZINC000819199637	ED	On-Demand	Anodyne	PDE8B	40	32
CCOC(=O)N1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819199642	GE	On-Demand	Mild	P2RY12	156	40
CCOC(=O)N1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819199642	GE	On-Demand	Mild	PAPA1_CARPA	34	44
CCOC(=O)N1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819199642	GE	On-Demand	Mild	CTSK	18	41
CCOC(=O)N1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819199642	GE	On-Demand	Mild	TGM2	19	43
CCOC(=O)N1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819199643	GE	On-Demand	Mild	P2RY12	156	40
CCOC(=O)N1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819199643	GE	On-Demand	Mild	PAPA1_CARPA	34	44
CCOC(=O)N1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819199643	GE	On-Demand	Mild	CTSK	18	41
CCOC(=O)N1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819199643	GE	On-Demand	Mild	TGM2	19	43
COC(=O)c1cccc(CCNC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819199645	FE	On-Demand	Anodyne	ADRB2	91	51
COC(=O)c1cccc(CCNC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819199645	FE	On-Demand	Anodyne	ADRB1	88	51
COC(=O)c1cccc(CCNC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819199645	FE	On-Demand	Anodyne	ADRB3	75	51
COC(=O)c1cccc(CCNC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819199645	FE	On-Demand	Anodyne	MTNR1A	57	46
COC(=O)c1cccc(CCNC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819199645	FE	On-Demand	Anodyne	MTNR1B	54	40
COC(=O)c1cccc(CCNC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819199646	FE	On-Demand	Anodyne	ADRB2	91	51
COC(=O)c1cccc(CCNC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819199646	FE	On-Demand	Anodyne	ADRB1	88	51
COC(=O)c1cccc(CCNC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819199646	FE	On-Demand	Anodyne	ADRB3	75	51
COC(=O)c1cccc(CCNC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819199646	FE	On-Demand	Anodyne	MTNR1A	57	46
COC(=O)c1cccc(CCNC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819199646	FE	On-Demand	Anodyne	MTNR1B	54	40
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccnc2Cl)c1	ZINC000819199670	II	On-Demand	Anodyne	GRM4	52	40
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccnc2Cl)c1	ZINC000819199670	II	On-Demand	Anodyne	G2YM83_BOTF4	76	39
CCCCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)Nc2cccnc2Cl)c1	ZINC000819199678	IJ	On-Demand	Anodyne	GRM4	47	39
CCCCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)Nc2cccnc2Cl)c1	ZINC000819199678	IJ	On-Demand	Anodyne	KCNK3	42	38
CCCCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)Nc2cccnc2Cl)c1	ZINC000819199678	IJ	On-Demand	Anodyne	G2YM83_BOTF4	71	37
C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)Nc2cccnc2Cl)c1	ZINC000819199686	II	On-Demand	Anodyne	PPARD	15	42
C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)Nc2cccnc2Cl)c1	ZINC000819199686	II	On-Demand	Anodyne	AKR1C3	38	43
C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)Nc2cccnc2Cl)c1	ZINC000819199686	II	On-Demand	Anodyne	G2YM83_BOTF4	78	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(Oc2ccncc2)cc1	ZINC000819199713	FH	On-Demand	Anodyne	RAF1	27	46
O=S1(=O)CCC(CCNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819199717	DD	On-Demand	Anodyne	ADRB1	29	41
O=S1(=O)CCC(CCNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819199717	DD	On-Demand	Anodyne	ADRB3	44	41
O=S1(=O)CCC(CCNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819199719	DD	On-Demand	Anodyne	ADRB1	29	41
O=S1(=O)CCC(CCNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819199719	DD	On-Demand	Anodyne	ADRB3	44	41
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)C(F)=C1CCC1	ZINC000819199743	DH	On-Demand	Anodyne	F3	79	34
CN(C)C(=O)NNC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819199786	FE	On-Demand	Reactive	CNR1	58	36
CN(C)C(=O)NNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819199802	GF	On-Demand	Reactive	CTSK	20	54
CN(C)C(=O)NNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819199802	GF	On-Demand	Reactive	ECE1	22	41
CN(C)C(=O)NNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819199802	GF	On-Demand	Reactive	REN	46	42
CN(C)C(=O)NNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819199804	GF	On-Demand	Reactive	CTSK	20	54
CN(C)C(=O)NNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819199804	GF	On-Demand	Reactive	ECE1	22	41
CN(C)C(=O)NNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819199804	GF	On-Demand	Reactive	REN	46	42
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCC(C)(C)c2ccncc2)CC1	ZINC000819199812	GG	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CC(CNCCC(=O)Nc2ccccc2F)C1	ZINC000819199816	FF	On-Demand	Anodyne	GPR119	27	41
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)cc1	ZINC000819199821	GE	On-Demand	Anodyne	ADRB2	38	53
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)cc1	ZINC000819199821	GE	On-Demand	Anodyne	ADRB1	73	53
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@H]32)cc1	ZINC000819199821	GE	On-Demand	Anodyne	ADRB3	48	48
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)cc1	ZINC000819199822	GE	On-Demand	Anodyne	ADRB2	38	53
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)cc1	ZINC000819199822	GE	On-Demand	Anodyne	ADRB1	73	53
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@@H]23)cc1	ZINC000819199822	GE	On-Demand	Anodyne	ADRB3	48	48
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)cc1	ZINC000819199823	GE	On-Demand	Anodyne	ADRB2	38	53
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)cc1	ZINC000819199823	GE	On-Demand	Anodyne	ADRB1	73	53
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]3SCCS[C@@H]32)cc1	ZINC000819199823	GE	On-Demand	Anodyne	ADRB3	48	48
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)cc1	ZINC000819199824	GE	On-Demand	Anodyne	ADRB2	38	53
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)cc1	ZINC000819199824	GE	On-Demand	Anodyne	ADRB1	73	53
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]3SCCS[C@H]23)cc1	ZINC000819199824	GE	On-Demand	Anodyne	ADRB3	48	48
CC(C)(C)OC(=O)N1CC(CNC[C@H](O)COCc2ccccc2)C1	ZINC000819199839	FE	On-Demand	Anodyne	GHSR	37	40
CC(C)(C)OC(=O)N1CC(CNC[C@@H](O)COCc2ccccc2)C1	ZINC000819199840	FE	On-Demand	Anodyne	GHSR	37	40
COC(=O)c1cccc(CCNC[C@@H](O)c2cc3ccccc3o2)c1	ZINC000819199861	EG	On-Demand	Anodyne	ADRB2	55	40
COC(=O)c1cccc(CCNC[C@@H](O)c2cc3ccccc3o2)c1	ZINC000819199861	EG	On-Demand	Anodyne	ADRB1	57	39
COC(=O)c1cccc(CCNC[C@@H](O)c2cc3ccccc3o2)c1	ZINC000819199861	EG	On-Demand	Anodyne	ADRB3	61	42
CSCC[C@@H](C(=O)Nc1cccnc1Cl)N1C(=O)c2ccccc2C1=O	ZINC000819199870	GG	On-Demand	Anodyne	G2YM83_BOTF4	56	31
CSCC[C@H](C(=O)Nc1cccnc1Cl)N1C(=O)c2ccccc2C1=O	ZINC000819199871	GG	On-Demand	Anodyne	G2YM83_BOTF4	56	31
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819199872	EF	On-Demand	Anodyne	ADRB2	96	43
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819199872	EF	On-Demand	Anodyne	ADRB1	94	46
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2Cl)c1	ZINC000819199872	EF	On-Demand	Anodyne	ADRB3	81	50
O[C@@H](CNCCCc1cccs1)c1cccc(Cl)c1	ZINC000819199875	CH	On-Demand	Anodyne	ADRB2	52	42
O[C@@H](CNCCCc1cccs1)c1cccc(Cl)c1	ZINC000819199875	CH	On-Demand	Anodyne	ADRB1	57	50
O[C@@H](CNCCCc1cccs1)c1cccc(Cl)c1	ZINC000819199875	CH	On-Demand	Anodyne	ADRB3	67	50
O[C@H](CNCCCc1cccs1)c1cccc(Cl)c1	ZINC000819199876	CH	On-Demand	Anodyne	ADRB2	52	42
O[C@H](CNCCCc1cccs1)c1cccc(Cl)c1	ZINC000819199876	CH	On-Demand	Anodyne	ADRB1	57	50
O[C@H](CNCCCc1cccs1)c1cccc(Cl)c1	ZINC000819199876	CH	On-Demand	Anodyne	ADRB3	67	50
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819199881	FG	On-Demand	Anodyne	ADRB2	82	46
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819199881	FG	On-Demand	Anodyne	ADRB1	78	45
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819199881	FG	On-Demand	Anodyne	ADRB3	105	48
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819199882	FG	On-Demand	Anodyne	ADRB2	82	46
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819199882	FG	On-Demand	Anodyne	ADRB1	78	45
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819199882	FG	On-Demand	Anodyne	ADRB3	105	48
COC(=O)c1cccc(CCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819199891	GG	On-Demand	Anodyne	ADRB2	82	48
COC(=O)c1cccc(CCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819199891	GG	On-Demand	Anodyne	ADRB1	87	49
COC(=O)c1cccc(CCNC[C@H](O)c2cccc(Br)c2)c1	ZINC000819199891	GG	On-Demand	Anodyne	ADRB3	122	52
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819199892	GG	On-Demand	Anodyne	ADRB2	82	48
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819199892	GG	On-Demand	Anodyne	ADRB1	87	49
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819199892	GG	On-Demand	Anodyne	ADRB3	122	52
O[C@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccnc1	ZINC000819199895	FE	On-Demand	Clean	ADRB2	24	44
O[C@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccnc1	ZINC000819199895	FE	On-Demand	Clean	ADRB1	24	42
O[C@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccnc1	ZINC000819199895	FE	On-Demand	Clean	ADRB3	91	49
O[C@@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccnc1	ZINC000819199896	FE	On-Demand	Clean	ADRB2	24	44
O[C@@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccnc1	ZINC000819199896	FE	On-Demand	Clean	ADRB1	24	42
O[C@@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1cccnc1	ZINC000819199896	FE	On-Demand	Clean	ADRB3	91	49
COC(=O)c1cccc(CCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819199897	EF	On-Demand	Anodyne	ADRB2	108	50
COC(=O)c1cccc(CCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819199897	EF	On-Demand	Anodyne	ADRB1	114	63
COC(=O)c1cccc(CCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819199897	EF	On-Demand	Anodyne	ADRB3	155	69
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819199898	EF	On-Demand	Anodyne	ADRB2	108	50
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819199898	EF	On-Demand	Anodyne	ADRB1	114	63
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819199898	EF	On-Demand	Anodyne	ADRB3	155	69
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819199905	EF	On-Demand	Anodyne	ADRB2	92	42
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819199905	EF	On-Demand	Anodyne	ADRB1	81	46
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819199905	EF	On-Demand	Anodyne	ADRB3	65	46
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819199906	EF	On-Demand	Anodyne	ADRB2	92	42
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819199906	EF	On-Demand	Anodyne	ADRB1	81	46
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819199906	EF	On-Demand	Anodyne	ADRB3	65	46
CCOC(=O)N1CCCN(C(=O)c2cn(-c3ccccc3)nc2C(C)C)CC1	ZINC000819199928	GG	On-Demand	Anodyne	P2RY12	74	38
COC(=O)c1cccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819199932	FG	On-Demand	Anodyne	ADRB2	73	45
COC(=O)c1cccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819199932	FG	On-Demand	Anodyne	ADRB1	78	49
COC(=O)c1cccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819199932	FG	On-Demand	Anodyne	ADRB3	113	52
COC(=O)c1cccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819199932	FG	On-Demand	Anodyne	CCR2	44	40
COC(=O)c1cccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819199932	FG	On-Demand	Anodyne	PDS	41	39
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819199933	FG	On-Demand	Anodyne	ADRB2	73	45
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819199933	FG	On-Demand	Anodyne	ADRB1	78	49
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819199933	FG	On-Demand	Anodyne	ADRB3	113	52
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819199933	FG	On-Demand	Anodyne	CCR2	44	40
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819199933	FG	On-Demand	Anodyne	PDS	41	39
CCOC(=O)N1CCCN(C(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819199941	FF	On-Demand	Anodyne	P2RY12	51	37
COC(=O)c1cccc(CCNC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819199942	EF	On-Demand	Anodyne	PRSS1	15	44
COC(=O)c1cccc(CCNC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819199942	EF	On-Demand	Anodyne	ADRB2	85	47
COC(=O)c1cccc(CCNC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819199942	EF	On-Demand	Anodyne	ADRB1	84	46
COC(=O)c1cccc(CCNC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819199942	EF	On-Demand	Anodyne	ADRB3	106	49
COC(=O)c1cccc(CCNC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819199943	EF	On-Demand	Anodyne	PRSS1	15	44
COC(=O)c1cccc(CCNC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819199943	EF	On-Demand	Anodyne	ADRB2	85	47
COC(=O)c1cccc(CCNC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819199943	EF	On-Demand	Anodyne	ADRB1	84	46
COC(=O)c1cccc(CCNC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819199943	EF	On-Demand	Anodyne	ADRB3	106	49
Cn1cnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819199949	GD	On-Demand	Anodyne	CTSD	78	42
Cn1cnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819199949	GD	On-Demand	Anodyne	PGC	58	38
Cn1cnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819199949	GD	On-Demand	Anodyne	PAPA1_CARPA	31	43
Cn1cnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819199949	GD	On-Demand	Anodyne	BACE2	53	40
Cn1cnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819199949	GD	On-Demand	Anodyne	REN	80	46
Cn1cnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819199949	GD	On-Demand	Anodyne	REN1	29	46
Cn1cnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819199949	GD	On-Demand	Anodyne	BACE1	83	43
Cn1cnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819199949	GD	On-Demand	Anodyne	FPR1	50	39
Cn1cnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819199949	GD	On-Demand	Anodyne	PLM2_PLAFA	45	36
O[C@@H](CNCCCc1cccs1)c1cccc(F)c1	ZINC000819199950	CG	On-Demand	Anodyne	ADRB1	28	42
O[C@@H](CNCCCc1cccs1)c1cccc(F)c1	ZINC000819199950	CG	On-Demand	Anodyne	ADRB3	36	42
O[C@H](CNCCCc1cccs1)c1cccc(F)c1	ZINC000819199951	CG	On-Demand	Anodyne	ADRB1	28	42
O[C@H](CNCCCc1cccs1)c1cccc(F)c1	ZINC000819199951	CG	On-Demand	Anodyne	ADRB3	36	42
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCC(C)(C)c2ccncc2)CC1	ZINC000819199956	GG	On-Demand	Anodyne	GPR119	26	40
O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)Nc1cccnc1Cl	ZINC000819199962	HG	On-Demand	Anodyne	TGM2	55	39
O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)Nc1cccnc1Cl	ZINC000819199962	HG	On-Demand	Anodyne	HCAR2	34	43
O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)Nc1cccnc1Cl	ZINC000819199962	HG	On-Demand	Anodyne	F13A1	64	39
O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)Nc1cccnc1Cl	ZINC000819199962	HG	On-Demand	Anodyne	NAMPT	58	48
O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)Nc1cccnc1Cl	ZINC000819199962	HG	On-Demand	Anodyne	G2YM83_BOTF4	55	31
CCNc1ccc(C(=O)Nc2cccnc2Cl)cc1[N+](=O)[O-]	ZINC000819199965	DG	On-Demand	Bother	TAAR1	26	57
CCNc1ccc(C(=O)Nc2cccnc2Cl)cc1[N+](=O)[O-]	ZINC000819199965	DG	On-Demand	Bother	G2YM83_BOTF4	73	40
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819199975	GG	On-Demand	Anodyne	CTSD	106	45
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819199975	GG	On-Demand	Anodyne	PGC	62	38
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819199975	GG	On-Demand	Anodyne	PAPA1_CARPA	34	43
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819199975	GG	On-Demand	Anodyne	BACE2	54	45
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819199975	GG	On-Demand	Anodyne	REN	83	47
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819199975	GG	On-Demand	Anodyne	REN1	28	45
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819199975	GG	On-Demand	Anodyne	BACE1	85	45
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819199975	GG	On-Demand	Anodyne	FPR1	51	40
C[C@@H]1CC(NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819199977	GG	On-Demand	Anodyne	CTSD	106	45
C[C@@H]1CC(NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819199977	GG	On-Demand	Anodyne	PGC	62	38
C[C@@H]1CC(NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819199977	GG	On-Demand	Anodyne	PAPA1_CARPA	34	43
C[C@@H]1CC(NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819199977	GG	On-Demand	Anodyne	BACE2	54	45
C[C@@H]1CC(NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819199977	GG	On-Demand	Anodyne	REN	83	47
C[C@@H]1CC(NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819199977	GG	On-Demand	Anodyne	REN1	28	45
C[C@@H]1CC(NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819199977	GG	On-Demand	Anodyne	BACE1	85	45
C[C@@H]1CC(NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819199977	GG	On-Demand	Anodyne	FPR1	51	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(C)(C)c2ccncc2)CC1	ZINC000819199985	GF	On-Demand	Anodyne	GPR119	53	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(C)(C)c2ccncc2)CC1	ZINC000819199986	GF	On-Demand	Anodyne	GPR119	53	46
O=C(/C=C/c1ccc(I)o1)Nc1cccnc1Cl	ZINC000819199994	FH	On-Demand	Anodyne	G2YM83_BOTF4	74	37
O=C(/C=C\c1ccc(I)o1)Nc1cccnc1Cl	ZINC000819199995	FH	On-Demand	Anodyne	G2YM83_BOTF4	74	37
C#CCNC(=O)C1CCN(C(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819199996	FC	On-Demand	Mild	DRD4	41	32
C#CCNC(=O)C1CCN(C(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819199996	FC	On-Demand	Mild	MTNR1A	27	44
C#CCNC(=O)C1CCN(C(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819199996	FC	On-Demand	Mild	MTNR1B	30	44
C#CCNC(=O)C1CCN(C(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819199996	FC	On-Demand	Mild	CACNA1G	17	41
C#CCNC(=O)C1CCN(C(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819199997	FC	On-Demand	Mild	DRD4	41	32
C#CCNC(=O)C1CCN(C(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819199997	FC	On-Demand	Mild	MTNR1A	27	44
C#CCNC(=O)C1CCN(C(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819199997	FC	On-Demand	Mild	MTNR1B	30	44
C#CCNC(=O)C1CCN(C(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819199997	FC	On-Demand	Mild	CACNA1G	17	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCCOCc1ccccc1)C2	ZINC000819200002	FF	On-Demand	Anodyne	GHSR	23	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCCOCc1ccccc1)C2	ZINC000819200003	FF	On-Demand	Anodyne	GHSR	23	40
C#CCNC(=O)C1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819200017	FC	On-Demand	Mild	KCNJ1	46	39
C#CCNC(=O)C1CCN(C(=O)C2(c3ccc(C)cc3)CCC2)CC1	ZINC000819200031	EE	On-Demand	Mild	EPHX2	19	41
C=C(C)C(C)(C)C(=O)N1CCC[C@H](C(=O)NCCCCCC)C1	ZINC000819200066	DH	On-Demand	Mild	TPP2	20	43
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](C(=O)NCCCCCC)C1	ZINC000819200067	DH	On-Demand	Mild	TPP2	20	43
COC(=O)c1cccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819200075	EE	On-Demand	Bother	ADRB2	76	45
COC(=O)c1cccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819200075	EE	On-Demand	Bother	ADRB1	75	42
COC(=O)c1cccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819200075	EE	On-Demand	Bother	CACNA1C	41	36
COC(=O)c1cccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819200075	EE	On-Demand	Bother	ADRB3	94	45
COC(=O)c1cccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819200075	EE	On-Demand	Bother	CACNA1D	67	36
COC(=O)c1cccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819200075	EE	On-Demand	Bother	ACR	18	42
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819200076	EE	On-Demand	Bother	ADRB2	76	45
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819200076	EE	On-Demand	Bother	ADRB1	75	42
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819200076	EE	On-Demand	Bother	CACNA1C	41	36
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819200076	EE	On-Demand	Bother	ADRB3	94	45
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819200076	EE	On-Demand	Bother	CACNA1D	67	36
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819200076	EE	On-Demand	Bother	ACR	18	42
Cn1cnc(CNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819200077	CD	On-Demand	Anodyne	ADRB1	31	45
Cn1cnc(CNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819200077	CD	On-Demand	Anodyne	ADRB3	50	45
Cn1cnc(CNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819200078	CD	On-Demand	Anodyne	ADRB1	31	45
Cn1cnc(CNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819200078	CD	On-Demand	Anodyne	ADRB3	50	45
COC(=O)c1cccc(CCNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819200089	FF	On-Demand	Anodyne	MTNR1B	18	43
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819200105	DE	On-Demand	Anodyne	ADRB2	92	43
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819200105	DE	On-Demand	Anodyne	ADRB1	87	45
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819200105	DE	On-Demand	Anodyne	ADRB3	76	45
COC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819200106	DE	On-Demand	Anodyne	ADRB2	92	43
COC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819200106	DE	On-Demand	Anodyne	ADRB1	87	45
COC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819200106	DE	On-Demand	Anodyne	ADRB3	76	45
COC(=O)c1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819200126	DD	On-Demand	Anodyne	ADRB2	89	68
COC(=O)c1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819200126	DD	On-Demand	Anodyne	ADRB1	107	63
COC(=O)c1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819200126	DD	On-Demand	Anodyne	ADRB3	195	68
COC(=O)c1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819200126	DD	On-Demand	Anodyne	TBXAS1	42	38
COC(=O)c1cccc(CCNC[C@H](O)c2cccnc2)c1	ZINC000819200126	DD	On-Demand	Anodyne	KCNA5	19	42
COC(=O)c1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819200127	DD	On-Demand	Anodyne	ADRB2	89	68
COC(=O)c1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819200127	DD	On-Demand	Anodyne	ADRB1	107	63
COC(=O)c1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819200127	DD	On-Demand	Anodyne	ADRB3	195	68
COC(=O)c1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819200127	DD	On-Demand	Anodyne	TBXAS1	42	38
COC(=O)c1cccc(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819200127	DD	On-Demand	Anodyne	KCNA5	19	42
COC(=O)c1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819200143	EE	On-Demand	Bother	ADRB2	68	45
COC(=O)c1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819200143	EE	On-Demand	Bother	ADRB1	75	46
COC(=O)c1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819200143	EE	On-Demand	Bother	CACNA1C	61	40
COC(=O)c1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819200143	EE	On-Demand	Bother	ADRB3	109	49
COC(=O)c1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819200143	EE	On-Demand	Bother	CACNA1D	92	40
COC(=O)c1cccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819200143	EE	On-Demand	Bother	ACR	16	40
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819200144	EE	On-Demand	Bother	ADRB2	68	45
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819200144	EE	On-Demand	Bother	ADRB1	75	46
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819200144	EE	On-Demand	Bother	CACNA1C	61	40
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819200144	EE	On-Demand	Bother	ADRB3	109	49
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819200144	EE	On-Demand	Bother	CACNA1D	92	40
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819200144	EE	On-Demand	Bother	ACR	16	40
CN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)Nc2cccnc2Cl)c1	ZINC000819200162	HH	On-Demand	Anodyne	KCNK3	44	38
CN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)Nc2cccnc2Cl)c1	ZINC000819200162	HH	On-Demand	Anodyne	G2YM83_BOTF4	73	39
O=C(/C=C\[C@H]1CCCO1)NCCc1c[nH]c2cc(F)ccc12	ZINC000819200179	DF	On-Demand	Anodyne	MPO	75	38
O=C(/C=C\[C@@H]1CCCO1)NCCc1c[nH]c2cc(F)ccc12	ZINC000819200180	DF	On-Demand	Anodyne	MPO	75	38
O=C(/C=C/[C@H]1CCCO1)NCCc1c[nH]c2cc(F)ccc12	ZINC000819200181	DF	On-Demand	Anodyne	MPO	75	38
O=C(/C=C/[C@@H]1CCCO1)NCCc1c[nH]c2cc(F)ccc12	ZINC000819200182	DF	On-Demand	Anodyne	MPO	75	38
C#CCNC(=O)C1CCN(C(=O)c2c(C)ccc(Br)c2OC)CC1	ZINC000819200183	GE	On-Demand	Mild	CCR5	21	41
C[C@@H]1CC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000819200193	CE	On-Demand	Bother	CACNA1C	51	36
C[C@@H]1CC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000819200193	CE	On-Demand	Bother	CACNA1D	81	35
C[C@H]1C[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000819200194	CE	On-Demand	Bother	CACNA1C	51	36
C[C@H]1C[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000819200194	CE	On-Demand	Bother	CACNA1D	81	35
C[C@@H]1CC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000819200195	CE	On-Demand	Bother	CACNA1C	51	36
C[C@@H]1CC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000819200195	CE	On-Demand	Bother	CACNA1D	81	35
C[C@H]1C[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000819200196	CE	On-Demand	Bother	CACNA1C	51	36
C[C@H]1C[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000819200196	CE	On-Demand	Bother	CACNA1D	81	35
O=S1(=O)CCC(CCNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819200198	EE	On-Demand	Anodyne	ADRB1	60	51
O=S1(=O)CCC(CCNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819200198	EE	On-Demand	Anodyne	ADRB3	77	51
O=S1(=O)CCC(CCNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819200199	EE	On-Demand	Anodyne	ADRB1	60	51
O=S1(=O)CCC(CCNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819200199	EE	On-Demand	Anodyne	ADRB3	77	51
O=S1(=O)CCC(CCNC[C@H](O)c2ccccc2)CC1	ZINC000819200211	CD	On-Demand	Anodyne	ADRB2	19	44
O=S1(=O)CCC(CCNC[C@H](O)c2ccccc2)CC1	ZINC000819200211	CD	On-Demand	Anodyne	ADRB3	54	42
O=S1(=O)CCC(CCNC[C@@H](O)c2ccccc2)CC1	ZINC000819200212	CD	On-Demand	Anodyne	ADRB2	19	44
O=S1(=O)CCC(CCNC[C@@H](O)c2ccccc2)CC1	ZINC000819200212	CD	On-Demand	Anodyne	ADRB3	54	42
CCCNC(=O)[C@@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819200231	GE	On-Demand	Mild	HLA-DRB3	59	36
CCCNC(=O)[C@@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819200231	GE	On-Demand	Mild	PAPA1_CARPA	30	46
CCCNC(=O)[C@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819200232	GE	On-Demand	Mild	HLA-DRB3	59	36
CCCNC(=O)[C@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819200232	GE	On-Demand	Mild	PAPA1_CARPA	30	46
CCCNC(=O)[C@@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819200233	GE	On-Demand	Mild	HLA-DRB3	59	36
CCCNC(=O)[C@@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819200233	GE	On-Demand	Mild	PAPA1_CARPA	30	46
CCCNC(=O)[C@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819200234	GE	On-Demand	Mild	HLA-DRB3	59	36
CCCNC(=O)[C@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819200234	GE	On-Demand	Mild	PAPA1_CARPA	30	46
C[C@@H]1CC(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C[C@@H](C)O1	ZINC000819200235	FF	On-Demand	Anodyne	GPR119	27	41
C[C@@H]1CC(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C[C@@H](C)O1	ZINC000819200236	FF	On-Demand	Anodyne	GPR119	27	41
C[C@H]1C[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C[C@@H](C)O1	ZINC000819200237	FF	On-Demand	Anodyne	GPR119	27	41
C[C@H]1C[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C[C@@H](C)O1	ZINC000819200238	FF	On-Demand	Anodyne	GPR119	27	41
O=C(/C=C/[C@@H]1CCCO1)N(CCN1CCOCC1)c1ccccc1	ZINC000819200254	EE	On-Demand	Anodyne	CASR	46	37
O=C(/C=C\[C@H]1CCCO1)N(CCN1CCOCC1)c1ccccc1	ZINC000819200255	EE	On-Demand	Anodyne	CASR	46	37
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819200259	GD	On-Demand	Anodyne	ADRB2	101	46
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819200259	GD	On-Demand	Anodyne	ADRB1	98	43
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819200259	GD	On-Demand	Anodyne	ADRB3	179	46
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819200260	GD	On-Demand	Anodyne	ADRB2	101	46
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819200260	GD	On-Demand	Anodyne	ADRB1	98	43
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819200260	GD	On-Demand	Anodyne	ADRB3	179	46
O[C@@H](CNCCCc1cccs1)c1cccnc1	ZINC000819200268	CE	On-Demand	Anodyne	ADRB2	30	48
O[C@@H](CNCCCc1cccs1)c1cccnc1	ZINC000819200268	CE	On-Demand	Anodyne	ADRB1	33	46
O[C@@H](CNCCCc1cccs1)c1cccnc1	ZINC000819200268	CE	On-Demand	Anodyne	ADRB3	110	48
O[C@H](CNCCCc1cccs1)c1cccnc1	ZINC000819200269	CE	On-Demand	Anodyne	ADRB2	30	48
O[C@H](CNCCCc1cccs1)c1cccnc1	ZINC000819200269	CE	On-Demand	Anodyne	ADRB1	33	46
O[C@H](CNCCCc1cccs1)c1cccnc1	ZINC000819200269	CE	On-Demand	Anodyne	ADRB3	110	48
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819200284	DD	On-Demand	Anodyne	ADRB2	47	42
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819200284	DD	On-Demand	Anodyne	ADRB1	61	42
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819200284	DD	On-Demand	Anodyne	ADRB3	84	42
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819200285	DD	On-Demand	Anodyne	ADRB2	47	42
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819200285	DD	On-Demand	Anodyne	ADRB1	61	42
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819200285	DD	On-Demand	Anodyne	ADRB3	84	42
CCOC(=O)N1CCCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819200286	FD	On-Demand	Anodyne	KCNJ1	63	42
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819200287	GG	On-Demand	Anodyne	ADRB2	94	48
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819200287	GG	On-Demand	Anodyne	ADRB1	87	46
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819200287	GG	On-Demand	Anodyne	ADRB3	111	48
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819200288	GG	On-Demand	Anodyne	ADRB2	94	48
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819200288	GG	On-Demand	Anodyne	ADRB1	87	46
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819200288	GG	On-Demand	Anodyne	ADRB3	111	48
CN(C)c1ccc(NC(=O)CCNCCCc2cccs2)cc1	ZINC000819200297	EG	On-Demand	Anodyne	CA5B	27	40
CN(C)c1ccc(NC(=O)CCNCCCc2cccs2)cc1	ZINC000819200297	EG	On-Demand	Anodyne	CA5A	26	40
CN(C)c1ccc(NC(=O)CCNCCCc2cccs2)cc1	ZINC000819200297	EG	On-Demand	Anodyne	PTPRF	19	42
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819200307	GG	On-Demand	Anodyne	ADRB2	93	48
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819200307	GG	On-Demand	Anodyne	ADRB1	94	46
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819200307	GG	On-Demand	Anodyne	GRIN2B	15	40
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819200307	GG	On-Demand	Anodyne	ADRB3	121	53
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819200308	GG	On-Demand	Anodyne	ADRB2	93	48
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819200308	GG	On-Demand	Anodyne	ADRB1	94	46
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819200308	GG	On-Demand	Anodyne	GRIN2B	15	40
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819200308	GG	On-Demand	Anodyne	ADRB3	121	53
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819200317	DF	On-Demand	Anodyne	PRSS1	16	44
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819200317	DF	On-Demand	Anodyne	ADRB2	102	49
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819200317	DF	On-Demand	Anodyne	ADRB1	98	48
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819200317	DF	On-Demand	Anodyne	ADRB3	134	49
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819200318	DF	On-Demand	Anodyne	PRSS1	16	44
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819200318	DF	On-Demand	Anodyne	ADRB2	102	49
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819200318	DF	On-Demand	Anodyne	ADRB1	98	48
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(C)cc2)c1	ZINC000819200318	DF	On-Demand	Anodyne	ADRB3	134	49
COC(=O)c1cccc(CCNCCS(C)(=O)=O)c1	ZINC000819200324	CC	On-Demand	Anodyne	PTPRB	20	45
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819200344	FG	On-Demand	Anodyne	ADRB2	80	41
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819200344	FG	On-Demand	Anodyne	ADRB1	70	45
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819200344	FG	On-Demand	Anodyne	ADRB3	55	47
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819200345	FG	On-Demand	Anodyne	ADRB2	80	41
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819200345	FG	On-Demand	Anodyne	ADRB1	70	45
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819200345	FG	On-Demand	Anodyne	ADRB3	55	47
O=C(/C=C/[C@H]1CCCO1)N(CCN1CCOCC1)c1ccccc1	ZINC000819200356	EE	On-Demand	Anodyne	CASR	46	37
O=C(/C=C\[C@@H]1CCCO1)N(CCN1CCOCC1)c1ccccc1	ZINC000819200357	EE	On-Demand	Anodyne	CASR	46	37
O=C(C(F)=C1CCC1)N1CCC(c2ncc[nH]2)CC1	ZINC000819200390	CF	On-Demand	Anodyne	HTR2B	19	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3cc(F)ccc13)C2	ZINC000819200440	FF	On-Demand	Anodyne	MPO	64	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3cc(F)ccc13)C2	ZINC000819200440	FF	On-Demand	Anodyne	MTNR1A	18	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3cc(F)ccc13)C2	ZINC000819200441	FF	On-Demand	Anodyne	MPO	64	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3cc(F)ccc13)C2	ZINC000819200441	FF	On-Demand	Anodyne	MTNR1A	18	46
CN1CCC(N2CCC(NC(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)CC2)CC1	ZINC000819200449	GD	On-Demand	Anodyne	SLC6A5	16	40
O=C(NCCc1c[nH]c2cc(F)ccc12)C(F)=C1CCC1	ZINC000819200475	CG	On-Demand	Anodyne	MPO	89	43
O[C@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(F)cn1	ZINC000819200476	GF	On-Demand	Clean	SLC27A1	47	30
O[C@@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccc(F)cn1	ZINC000819200477	GF	On-Demand	Clean	SLC27A1	47	30
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819200478	CE	On-Demand	Anodyne	PRSS1	19	48
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819200478	CE	On-Demand	Anodyne	ADRB2	115	55
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819200478	CE	On-Demand	Anodyne	ADRB1	130	52
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819200478	CE	On-Demand	Anodyne	ADRB3	183	56
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2)c1	ZINC000819200478	CE	On-Demand	Anodyne	Q8WSF8_APLCA	42	37
COC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819200480	CE	On-Demand	Anodyne	PRSS1	19	48
COC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819200480	CE	On-Demand	Anodyne	ADRB2	115	55
COC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819200480	CE	On-Demand	Anodyne	ADRB1	130	52
COC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819200480	CE	On-Demand	Anodyne	ADRB3	183	56
COC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819200480	CE	On-Demand	Anodyne	Q8WSF8_APLCA	42	37
COC(=O)c1cccc(CCNC[C@H](O)C2CC2)c1	ZINC000819200485	CD	On-Demand	Anodyne	ADRB2	42	38
COC(=O)c1cccc(CCNC[C@H](O)C2CC2)c1	ZINC000819200485	CD	On-Demand	Anodyne	ADRB1	55	40
COC(=O)c1cccc(CCNC[C@H](O)C2CC2)c1	ZINC000819200485	CD	On-Demand	Anodyne	ADRB3	52	41
COC(=O)c1cccc(CCNC[C@@H](O)C2CC2)c1	ZINC000819200486	CD	On-Demand	Anodyne	ADRB2	42	38
COC(=O)c1cccc(CCNC[C@@H](O)C2CC2)c1	ZINC000819200486	CD	On-Demand	Anodyne	ADRB1	55	40
COC(=O)c1cccc(CCNC[C@@H](O)C2CC2)c1	ZINC000819200486	CD	On-Demand	Anodyne	ADRB3	52	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(Oc3ccncc3)cc1)C2	ZINC000819200492	GH	On-Demand	Anodyne	RAF1	19	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(Oc3ccncc3)cc1)C2	ZINC000819200494	GH	On-Demand	Anodyne	RAF1	19	41
C#CCNC(=O)C1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819200496	GD	On-Demand	Mild	PAPA1_CARPA	36	44
C#CCNC(=O)C1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819200500	GD	On-Demand	Mild	PAPA1_CARPA	36	44
CN(CC#N)C(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819200512	FH	On-Demand	Mild	CTSK	15	49
CN(CC#N)C(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819200512	FH	On-Demand	Mild	CTSH	37	42
CN(CC#N)C(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819200513	FH	On-Demand	Mild	CTSK	15	49
CN(CC#N)C(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819200513	FH	On-Demand	Mild	CTSH	37	42
O=C(CCNCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ccccc1	ZINC000819200515	GG	On-Demand	Clean	HTR1A	17	47
O=C(CCNCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ccccc1	ZINC000819200515	GG	On-Demand	Clean	DRD2	18	48
O=C(CCNCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ccccc1	ZINC000819200515	GG	On-Demand	Clean	DRD3	16	43
O=C(CCNCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ccccc1	ZINC000819200515	GG	On-Demand	Clean	LTA4H	20	42
O=C(CCNCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1ccccc1	ZINC000819200515	GG	On-Demand	Clean	CCR3	45	41
Cc1nn(-c2ccccc2Cl)c2sc(C(=O)Nc3cccnc3Cl)cc12	ZINC000819200519	HK	On-Demand	Anodyne	EPHB3	40	35
Cc1nn(-c2ccccc2Cl)c2sc(C(=O)Nc3cccnc3Cl)cc12	ZINC000819200519	HK	On-Demand	Anodyne	G2YM83_BOTF4	65	33
O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)C(F)=C1CCC1	ZINC000819200520	ED	On-Demand	Anodyne	DRD4	23	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000819200524	FF	On-Demand	Anodyne	CCKAR	44	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000819200524	FF	On-Demand	Anodyne	MPO	78	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2cc(F)ccc12	ZINC000819200524	FF	On-Demand	Anodyne	MTNR1A	15	45
CCCCCOc1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819200526	DJ	On-Demand	Anodyne	CYSLTR1	15	41
CCCCCOc1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819200526	DJ	On-Demand	Anodyne	CYSLTR2	56	37
CCCCCOc1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819200526	DJ	On-Demand	Anodyne	TRPV1	17	43
CCCCCOc1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819200526	DJ	On-Demand	Anodyne	LPAR2	22	40
CCCCCOc1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819200526	DJ	On-Demand	Anodyne	PRNP	48	34
CCCCCOc1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819200526	DJ	On-Demand	Anodyne	S1PR3	21	40
CCCCCOc1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819200526	DJ	On-Demand	Anodyne	PLA2G4B	100	44
CCCCCOc1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819200526	DJ	On-Demand	Anodyne	FAAH	31	44
CCCCCOc1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819200526	DJ	On-Demand	Anodyne	S1PR2	25	40
CCCCCOc1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819200526	DJ	On-Demand	Anodyne	ACR	15	40
CCCCCOc1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819200526	DJ	On-Demand	Anodyne	SMO	21	44
CCCCCOc1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819200526	DJ	On-Demand	Anodyne	G2YM83_BOTF4	80	43
Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819200528	GG	On-Demand	Anodyne	F3	56	31
COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)Nc2cccnc2Cl)cc1	ZINC000819200532	HJ	On-Demand	Anodyne	CDK2	16	63
COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)Nc2cccnc2Cl)cc1	ZINC000819200532	HJ	On-Demand	Anodyne	LUCI_LUCLA	36	41
COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)Nc2cccnc2Cl)cc1	ZINC000819200532	HJ	On-Demand	Anodyne	G2YM83_BOTF4	72	37
CC(=O)Nc1cccc(CC(=O)NNC(=O)C(=O)N2CCCC2)c1	ZINC000819200539	EB	On-Demand	Reactive	P2RY14	42	32
N#Cc1ccc(OC2CCC(NC[C@H](O)c3cccnc3)CC2)nc1	ZINC000819200549	EE	On-Demand	Mild	ADRB3	31	42
N#Cc1ccc(OC2CCC(NC[C@@H](O)c3cccnc3)CC2)nc1	ZINC000819200551	EE	On-Demand	Mild	ADRB3	31	42
COC(=O)c1cccc(CCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819200553	EF	On-Demand	Anodyne	ADRB2	77	40
COC(=O)c1cccc(CCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819200553	EF	On-Demand	Anodyne	ADRB1	72	46
COC(=O)c1cccc(CCNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819200553	EF	On-Demand	Anodyne	ADRB3	62	46
COC(=O)c1cccc(CCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819200554	EF	On-Demand	Anodyne	ADRB2	77	40
COC(=O)c1cccc(CCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819200554	EF	On-Demand	Anodyne	ADRB1	72	46
COC(=O)c1cccc(CCNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819200554	EF	On-Demand	Anodyne	ADRB3	62	46
O[C@@H](CNCCSCC(F)(F)F)c1cccnc1	ZINC000819200557	CE	On-Demand	Anodyne	ADRB2	23	46
O[C@@H](CNCCSCC(F)(F)F)c1cccnc1	ZINC000819200557	CE	On-Demand	Anodyne	ADRB1	27	47
O[C@@H](CNCCSCC(F)(F)F)c1cccnc1	ZINC000819200557	CE	On-Demand	Anodyne	ADRB3	99	47
O[C@H](CNCCSCC(F)(F)F)c1cccnc1	ZINC000819200558	CE	On-Demand	Anodyne	ADRB2	23	46
O[C@H](CNCCSCC(F)(F)F)c1cccnc1	ZINC000819200558	CE	On-Demand	Anodyne	ADRB1	27	47
O[C@H](CNCCSCC(F)(F)F)c1cccnc1	ZINC000819200558	CE	On-Demand	Anodyne	ADRB3	99	47
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819200559	FG	On-Demand	Anodyne	ADRB2	83	39
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819200559	FG	On-Demand	Anodyne	ADRB1	80	44
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819200559	FG	On-Demand	Anodyne	ADRB3	80	48
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819200559	FG	On-Demand	Anodyne	NR1H3	15	40
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819200559	FG	On-Demand	Anodyne	NR1H2	16	40
COC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819200560	FG	On-Demand	Anodyne	ADRB2	83	39
COC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819200560	FG	On-Demand	Anodyne	ADRB1	80	44
COC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819200560	FG	On-Demand	Anodyne	ADRB3	80	48
COC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819200560	FG	On-Demand	Anodyne	NR1H3	15	40
COC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819200560	FG	On-Demand	Anodyne	NR1H2	16	40
O[C@@H](CNCCCc1cccs1)c1ccccc1	ZINC000819200570	CG	On-Demand	Anodyne	ADRB3	51	42
O[C@H](CNCCCc1cccs1)c1ccccc1	ZINC000819200572	CG	On-Demand	Anodyne	ADRB3	51	42
CC(=O)Nc1cccc(CC(=O)NCCS(=O)(=O)N2CCOCC2)c1	ZINC000819200579	FB	On-Demand	Anodyne	SLC6A9	37	40
CCOC(=O)N1CCCN(C(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819200593	GH	On-Demand	Anodyne	P2RY12	179	42
CCOC(=O)N1CCCN(C(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819200593	GH	On-Demand	Anodyne	CCKAR	48	38
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819200597	EF	On-Demand	Anodyne	ADRB2	86	41
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819200597	EF	On-Demand	Anodyne	ADRB1	68	43
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819200597	EF	On-Demand	Anodyne	ADRB3	57	43
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819200597	EF	On-Demand	Anodyne	LEF	44	36
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819200598	EF	On-Demand	Anodyne	ADRB2	86	41
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819200598	EF	On-Demand	Anodyne	ADRB1	68	43
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819200598	EF	On-Demand	Anodyne	ADRB3	57	43
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819200598	EF	On-Demand	Anodyne	LEF	44	36
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819200601	EF	On-Demand	Anodyne	ADRB2	89	49
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819200601	EF	On-Demand	Anodyne	ADRB1	83	52
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819200601	EF	On-Demand	Anodyne	ADRB3	117	52
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819200602	EF	On-Demand	Anodyne	ADRB2	89	49
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819200602	EF	On-Demand	Anodyne	ADRB1	83	52
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819200602	EF	On-Demand	Anodyne	ADRB3	117	52
COc1ccccc1N(C)S(=O)(=O)c1ccc(C)c(C(=O)Nc2cccnc2Cl)c1	ZINC000819200604	II	On-Demand	Anodyne	GRM4	40	40
COc1ccccc1N(C)S(=O)(=O)c1ccc(C)c(C(=O)Nc2cccnc2Cl)c1	ZINC000819200604	II	On-Demand	Anodyne	G2YM83_BOTF4	73	37
CN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819200606	HH	On-Demand	Anodyne	F10	22	40
CN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819200606	HH	On-Demand	Anodyne	PRNP	40	32
CN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819200606	HH	On-Demand	Anodyne	GRM4	34	42
CN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819200606	HH	On-Demand	Anodyne	G2YM83_BOTF4	72	39
O[C@@H](CNCCCc1cccs1)c1ccc(F)cc1	ZINC000819200617	CG	On-Demand	Anodyne	ADRB2	22	40
O[C@H](CNCCCc1cccs1)c1ccc(F)cc1	ZINC000819200618	CG	On-Demand	Anodyne	ADRB2	22	40
COc1cccc([S@@](=O)CC(=O)NNC(=O)C(=O)N2CCCC2)c1	ZINC000819200626	FB	On-Demand	Reactive	DRD4	43	33
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819200637	FD	On-Demand	Anodyne	FKBP1A	40	36
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819200640	FD	On-Demand	Anodyne	FKBP1A	40	36
O=S(=O)(c1ccc(OCCNC[C@@H](O)Cn2cccn2)cc1)C(F)(F)F	ZINC000819200650	GD	On-Demand	Anodyne	ADRB2	21	42
O=S(=O)(c1ccc(OCCNC[C@@H](O)Cn2cccn2)cc1)C(F)(F)F	ZINC000819200650	GD	On-Demand	Anodyne	ADRB1	37	42
O=S(=O)(c1ccc(OCCNC[C@@H](O)Cn2cccn2)cc1)C(F)(F)F	ZINC000819200650	GD	On-Demand	Anodyne	ADRB3	30	41
O=S(=O)(c1ccc(OCCNC[C@H](O)Cn2cccn2)cc1)C(F)(F)F	ZINC000819200651	GD	On-Demand	Anodyne	ADRB2	21	42
O=S(=O)(c1ccc(OCCNC[C@H](O)Cn2cccn2)cc1)C(F)(F)F	ZINC000819200651	GD	On-Demand	Anodyne	ADRB1	37	42
O=S(=O)(c1ccc(OCCNC[C@H](O)Cn2cccn2)cc1)C(F)(F)F	ZINC000819200651	GD	On-Demand	Anodyne	ADRB3	30	41
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819200669	GF	On-Demand	Mild	F2	20	42
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819200669	GF	On-Demand	Mild	PLG	19	42
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819200669	GF	On-Demand	Mild	PRSS1	15	42
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819200669	GF	On-Demand	Mild	CELA1	25	40
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819200669	GF	On-Demand	Mild	HLA-DRB3	52	36
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819200669	GF	On-Demand	Mild	PAPA1_CARPA	32	40
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819200669	GF	On-Demand	Mild	TRY1_BOVIN	22	42
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819200669	GF	On-Demand	Mild	NTSR1	51	41
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819200669	GF	On-Demand	Mild	LGMN	47	40
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819200670	GF	On-Demand	Mild	F2	20	42
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819200670	GF	On-Demand	Mild	PLG	19	42
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819200670	GF	On-Demand	Mild	PRSS1	15	42
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819200670	GF	On-Demand	Mild	CELA1	25	40
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819200670	GF	On-Demand	Mild	HLA-DRB3	52	36
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819200670	GF	On-Demand	Mild	PAPA1_CARPA	32	40
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819200670	GF	On-Demand	Mild	TRY1_BOVIN	22	42
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819200670	GF	On-Demand	Mild	NTSR1	51	41
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819200670	GF	On-Demand	Mild	LGMN	47	40
CC(C)c1ccc(C[C@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819200701	GG	On-Demand	Anodyne	ADRB2	50	40
CC(C)c1ccc(C[C@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819200701	GG	On-Demand	Anodyne	ADRB1	28	52
CC(C)c1ccc(C[C@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819200701	GG	On-Demand	Anodyne	ADRB3	57	52
CC(C)c1ccc(C[C@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819200701	GG	On-Demand	Anodyne	CTSF	44	35
CC(C)c1ccc(C[C@@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819200702	GG	On-Demand	Anodyne	ADRB2	50	40
CC(C)c1ccc(C[C@@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819200702	GG	On-Demand	Anodyne	ADRB1	28	52
CC(C)c1ccc(C[C@@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819200702	GG	On-Demand	Anodyne	ADRB3	57	52
CC(C)c1ccc(C[C@@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819200702	GG	On-Demand	Anodyne	CTSF	44	35
CC(C)c1ccc(C[C@@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819200703	GG	On-Demand	Anodyne	ADRB2	50	40
CC(C)c1ccc(C[C@@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819200703	GG	On-Demand	Anodyne	ADRB1	28	52
CC(C)c1ccc(C[C@@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819200703	GG	On-Demand	Anodyne	ADRB3	57	52
CC(C)c1ccc(C[C@@H](C)NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819200703	GG	On-Demand	Anodyne	CTSF	44	35
CC(C)c1ccc(C[C@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819200704	GG	On-Demand	Anodyne	ADRB2	50	40
CC(C)c1ccc(C[C@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819200704	GG	On-Demand	Anodyne	ADRB1	28	52
CC(C)c1ccc(C[C@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819200704	GG	On-Demand	Anodyne	ADRB3	57	52
CC(C)c1ccc(C[C@H](C)NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819200704	GG	On-Demand	Anodyne	CTSF	44	35
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819200760	FG	On-Demand	Anodyne	ADRB2	84	47
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819200760	FG	On-Demand	Anodyne	ADRB1	78	52
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819200760	FG	On-Demand	Anodyne	ADRB3	105	52
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819200761	FG	On-Demand	Anodyne	ADRB2	84	47
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819200761	FG	On-Demand	Anodyne	ADRB1	78	52
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819200761	FG	On-Demand	Anodyne	ADRB3	105	52
O[C@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)COc1ccccc1	ZINC000819200774	GF	On-Demand	Clean	ADRB2	49	44
O[C@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)COc1ccccc1	ZINC000819200774	GF	On-Demand	Clean	ADRB1	79	43
O[C@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)COc1ccccc1	ZINC000819200774	GF	On-Demand	Clean	DRD4	15	46
O[C@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)COc1ccccc1	ZINC000819200774	GF	On-Demand	Clean	ADRB3	58	48
O[C@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)COc1ccccc1	ZINC000819200774	GF	On-Demand	Clean	ABCB1	53	44
O[C@@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)COc1ccccc1	ZINC000819200775	GF	On-Demand	Clean	ADRB2	49	44
O[C@@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)COc1ccccc1	ZINC000819200775	GF	On-Demand	Clean	ADRB1	79	43
O[C@@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)COc1ccccc1	ZINC000819200775	GF	On-Demand	Clean	DRD4	15	46
O[C@@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)COc1ccccc1	ZINC000819200775	GF	On-Demand	Clean	ADRB3	58	48
O[C@@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)COc1ccccc1	ZINC000819200775	GF	On-Demand	Clean	ABCB1	53	44
CCOC(=O)N1CCCN(C(=O)[C@@H](CC)Cc2ccccc2C)CC1	ZINC000819200813	EG	On-Demand	Anodyne	P2RY12	94	41
CCOC(=O)N1CCCN(C(=O)[C@H](CC)Cc2ccccc2C)CC1	ZINC000819200814	EG	On-Demand	Anodyne	P2RY12	94	41
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2Br)c1	ZINC000819200821	GG	On-Demand	Anodyne	ADRB2	87	41
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2Br)c1	ZINC000819200821	GG	On-Demand	Anodyne	ADRB1	84	43
COC(=O)c1cccc(CCNC[C@H](O)c2ccccc2Br)c1	ZINC000819200821	GG	On-Demand	Anodyne	ADRB3	76	45
COC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819200822	GG	On-Demand	Anodyne	ADRB2	87	41
COC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819200822	GG	On-Demand	Anodyne	ADRB1	84	43
COC(=O)c1cccc(CCNC[C@@H](O)c2ccccc2Br)c1	ZINC000819200822	GG	On-Demand	Anodyne	ADRB3	76	45
O=C(c1ccccc1)N1C[C@H](CNC[C@H](O)c2cccc(Cl)c2)N2CC[C@H]1C2	ZINC000819200866	GF	On-Demand	Anodyne	ADRB1	35	45
O=C(c1ccccc1)N1C[C@H](CNC[C@H](O)c2cccc(Cl)c2)N2CC[C@H]1C2	ZINC000819200866	GF	On-Demand	Anodyne	ADRB3	56	46
O=C(c1ccccc1)N1C[C@H](CNC[C@H](O)c2cccc(Cl)c2)N2CC[C@H]1C2	ZINC000819200866	GF	On-Demand	Anodyne	CYP3A4	46	34
O=C(c1ccccc1)N1C[C@@H](CNC[C@H](O)c2cccc(Cl)c2)N2CC[C@H]1C2	ZINC000819200867	GF	On-Demand	Anodyne	ADRB1	35	45
O=C(c1ccccc1)N1C[C@@H](CNC[C@H](O)c2cccc(Cl)c2)N2CC[C@H]1C2	ZINC000819200867	GF	On-Demand	Anodyne	ADRB3	56	46
O=C(c1ccccc1)N1C[C@@H](CNC[C@H](O)c2cccc(Cl)c2)N2CC[C@H]1C2	ZINC000819200867	GF	On-Demand	Anodyne	CYP3A4	46	34
O=C(c1ccccc1)N1C[C@H](CNC[C@@H](O)c2cccc(Cl)c2)N2CC[C@H]1C2	ZINC000819200868	GF	On-Demand	Anodyne	ADRB1	35	45
O=C(c1ccccc1)N1C[C@H](CNC[C@@H](O)c2cccc(Cl)c2)N2CC[C@H]1C2	ZINC000819200868	GF	On-Demand	Anodyne	ADRB3	56	46
O=C(c1ccccc1)N1C[C@H](CNC[C@@H](O)c2cccc(Cl)c2)N2CC[C@H]1C2	ZINC000819200868	GF	On-Demand	Anodyne	CYP3A4	46	34
O=C(c1ccccc1)N1C[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)N2CC[C@H]1C2	ZINC000819200869	GF	On-Demand	Anodyne	ADRB1	35	45
O=C(c1ccccc1)N1C[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)N2CC[C@H]1C2	ZINC000819200869	GF	On-Demand	Anodyne	ADRB3	56	46
O=C(c1ccccc1)N1C[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)N2CC[C@H]1C2	ZINC000819200869	GF	On-Demand	Anodyne	CYP3A4	46	34
COc1ccccc1N1CCC(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819200870	GF	On-Demand	Anodyne	HTR1A	71	44
COc1ccccc1N1CCC(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819200870	GF	On-Demand	Anodyne	DRD2	64	53
COc1ccccc1N1CCC(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819200870	GF	On-Demand	Anodyne	DRD4	32	41
COc1ccccc1N1CCC(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819200870	GF	On-Demand	Anodyne	ADRA1D	69	42
COc1ccccc1N1CCC(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819200870	GF	On-Demand	Anodyne	ADRA1A	58	42
COc1ccccc1N1CCC(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819200870	GF	On-Demand	Anodyne	ADRA1B	53	42
COc1ccccc1N1CCC(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819200870	GF	On-Demand	Anodyne	DRD3	65	44
COc1ccccc1N1CCC(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819200870	GF	On-Demand	Anodyne	HTR7	46	39
CC[C@H](O)CNCCOc1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000819200893	ED	On-Demand	Anodyne	ADRB1	57	46
CC[C@H](O)CNCCOc1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000819200893	ED	On-Demand	Anodyne	ADRB3	41	46
CC[C@@H](O)CNCCOc1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000819200894	ED	On-Demand	Anodyne	ADRB1	57	46
CC[C@@H](O)CNCCOc1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000819200894	ED	On-Demand	Anodyne	ADRB3	41	46
O=C1C[C@H](NC[C@@H](O)c2cccnc2)CN1c1ccc(Cl)c(F)c1	ZINC000819200901	EE	On-Demand	Anodyne	ADRB3	52	45
O=C1C[C@H](NC[C@H](O)c2cccnc2)CN1c1ccc(Cl)c(F)c1	ZINC000819200902	EE	On-Demand	Anodyne	ADRB3	52	45
O=C1C[C@@H](NC[C@@H](O)c2cccnc2)CN1c1ccc(Cl)c(F)c1	ZINC000819200903	EE	On-Demand	Anodyne	ADRB3	52	45
O=C1C[C@@H](NC[C@H](O)c2cccnc2)CN1c1ccc(Cl)c(F)c1	ZINC000819200904	EE	On-Demand	Anodyne	ADRB3	52	45
CCOC(=O)[C@@H]1CCCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819200919	CD	On-Demand	Anodyne	FKBP1A	42	38
CCOC(=O)[C@@H]1CCCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819200920	CD	On-Demand	Anodyne	FKBP1A	42	38
CCOC(=O)[C@@H]1CCCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819200921	CD	On-Demand	Anodyne	FKBP1A	42	38
CCOC(=O)[C@@H]1CCCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819200922	CD	On-Demand	Anodyne	FKBP1A	42	38
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2cccs2)cc1	ZINC000819200938	EE	On-Demand	Anodyne	ADRB2	28	45
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2cccs2)cc1	ZINC000819200938	EE	On-Demand	Anodyne	ADRB3	65	37
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2cccs2)cc1	ZINC000819200939	EE	On-Demand	Anodyne	ADRB2	28	45
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2cccs2)cc1	ZINC000819200939	EE	On-Demand	Anodyne	ADRB3	65	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(C(=O)N3CCCC3)cc1C)C2	ZINC000819200949	GG	On-Demand	Anodyne	L3MBTL3	50	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(C(=O)N3CCCC3)cc1C)C2	ZINC000819200950	GG	On-Demand	Anodyne	L3MBTL3	50	33
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819200976	GG	On-Demand	Anodyne	ADRB2	83	47
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819200976	GG	On-Demand	Anodyne	ADRB1	73	49
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819200976	GG	On-Demand	Anodyne	ADRB3	97	49
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819200977	GG	On-Demand	Anodyne	ADRB2	83	47
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819200977	GG	On-Demand	Anodyne	ADRB1	73	49
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)c(Br)c2)c1	ZINC000819200977	GG	On-Demand	Anodyne	ADRB3	97	49
COC(=O)c1cccc(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819200980	DE	On-Demand	Anodyne	ADRB2	84	48
COC(=O)c1cccc(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819200980	DE	On-Demand	Anodyne	ADRB1	87	55
COC(=O)c1cccc(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819200980	DE	On-Demand	Anodyne	ADRB3	132	55
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819200981	DE	On-Demand	Anodyne	ADRB2	84	48
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819200981	DE	On-Demand	Anodyne	ADRB1	87	55
COC(=O)c1cccc(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819200981	DE	On-Demand	Anodyne	ADRB3	132	55
COc1ccc(OC)c([C@H](O)CNCCCc2cccs2)c1	ZINC000819200987	DG	On-Demand	Anodyne	ADRB2	26	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCSCC(F)(F)F)CC1	ZINC000819200999	GF	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCSCC(F)(F)F)CC1	ZINC000819201000	GF	On-Demand	Anodyne	GPR119	26	41
O=C(CCNCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1cccnc1	ZINC000819201001	GF	On-Demand	Clean	PRNP	22	40
O=C(CCNCc1ccc(N2CCN(CC3CC3)CC2)cc1)Nc1cccnc1	ZINC000819201001	GF	On-Demand	Clean	NAMPT	42	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCc2cccs2)CC1	ZINC000819201007	FG	On-Demand	Anodyne	GPR119	43	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCc2cccs2)CC1	ZINC000819201008	FG	On-Demand	Anodyne	GPR119	43	44
O[C@@H](CNCCCc1cccs1)c1ccc(Cl)cc1	ZINC000819201010	CH	On-Demand	Anodyne	ADRB2	23	40
COC(=O)c1cccc(CCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819201011	EF	On-Demand	Anodyne	ADRB2	69	42
COC(=O)c1cccc(CCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819201011	EF	On-Demand	Anodyne	ADRB1	65	45
COC(=O)c1cccc(CCNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819201011	EF	On-Demand	Anodyne	ADRB3	66	45
COC(=O)c1cccc(CCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819201012	EF	On-Demand	Anodyne	ADRB2	69	42
COC(=O)c1cccc(CCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819201012	EF	On-Demand	Anodyne	ADRB1	65	45
COC(=O)c1cccc(CCNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819201012	EF	On-Demand	Anodyne	ADRB3	66	45
O[C@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccccc1	ZINC000819201018	FG	On-Demand	Clean	SLC6A3	22	40
O[C@@H](CNCc1ccc(N2CCN(CC3CC3)CC2)cc1)c1ccccc1	ZINC000819201019	FG	On-Demand	Clean	SLC6A3	22	40
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819201020	DE	On-Demand	Anodyne	ADRB2	106	48
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819201020	DE	On-Demand	Anodyne	ADRB1	96	46
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819201020	DE	On-Demand	Anodyne	ADRB3	126	48
COC(=O)c1cccc(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819201020	DE	On-Demand	Anodyne	LEF	43	41
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819201021	DE	On-Demand	Anodyne	ADRB2	106	48
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819201021	DE	On-Demand	Anodyne	ADRB1	96	46
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819201021	DE	On-Demand	Anodyne	ADRB3	126	48
COC(=O)c1cccc(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819201021	DE	On-Demand	Anodyne	LEF	43	41
O=S(=O)(c1ccc(OCCNCC2(O)CCOCC2)cc1)C(F)(F)F	ZINC000819201023	GD	On-Demand	Anodyne	MMP13	31	44
O=S(=O)(c1ccc(OCCNCC2(O)CCOCC2)cc1)C(F)(F)F	ZINC000819201023	GD	On-Demand	Anodyne	MMP8	15	44
O=C(c1ccccc1)N1C[C@H](CNC[C@@H](O)c2cccnc2)N2CC[C@H]1C2	ZINC000819201024	FD	On-Demand	Anodyne	ADRB2	16	42
O=C(c1ccccc1)N1C[C@H](CNC[C@@H](O)c2cccnc2)N2CC[C@H]1C2	ZINC000819201024	FD	On-Demand	Anodyne	ADRB1	21	40
O=C(c1ccccc1)N1C[C@H](CNC[C@@H](O)c2cccnc2)N2CC[C@H]1C2	ZINC000819201024	FD	On-Demand	Anodyne	ADRB3	80	45
O=C(c1ccccc1)N1C[C@H](CNC[C@H](O)c2cccnc2)N2CC[C@H]1C2	ZINC000819201025	FD	On-Demand	Anodyne	ADRB2	16	42
O=C(c1ccccc1)N1C[C@H](CNC[C@H](O)c2cccnc2)N2CC[C@H]1C2	ZINC000819201025	FD	On-Demand	Anodyne	ADRB1	21	40
O=C(c1ccccc1)N1C[C@H](CNC[C@H](O)c2cccnc2)N2CC[C@H]1C2	ZINC000819201025	FD	On-Demand	Anodyne	ADRB3	80	45
O=C(c1ccccc1)N1C[C@@H](CNC[C@@H](O)c2cccnc2)N2CC[C@H]1C2	ZINC000819201026	FD	On-Demand	Anodyne	ADRB2	16	42
O=C(c1ccccc1)N1C[C@@H](CNC[C@@H](O)c2cccnc2)N2CC[C@H]1C2	ZINC000819201026	FD	On-Demand	Anodyne	ADRB1	21	40
O=C(c1ccccc1)N1C[C@@H](CNC[C@@H](O)c2cccnc2)N2CC[C@H]1C2	ZINC000819201026	FD	On-Demand	Anodyne	ADRB3	80	45
O=C(c1ccccc1)N1C[C@@H](CNC[C@H](O)c2cccnc2)N2CC[C@H]1C2	ZINC000819201027	FD	On-Demand	Anodyne	ADRB2	16	42
O=C(c1ccccc1)N1C[C@@H](CNC[C@H](O)c2cccnc2)N2CC[C@H]1C2	ZINC000819201027	FD	On-Demand	Anodyne	ADRB1	21	40
O=C(c1ccccc1)N1C[C@@H](CNC[C@H](O)c2cccnc2)N2CC[C@H]1C2	ZINC000819201027	FD	On-Demand	Anodyne	ADRB3	80	45
O=C(c1ccccc1)N1C[C@H](CNC[C@H](O)c2ccc(Cl)cc2)N2CC[C@H]1C2	ZINC000819201056	GF	On-Demand	Anodyne	ADRB1	19	43
O=C(c1ccccc1)N1C[C@H](CNC[C@H](O)c2ccc(Cl)cc2)N2CC[C@H]1C2	ZINC000819201056	GF	On-Demand	Anodyne	ADRB3	31	43
O=C(c1ccccc1)N1C[C@@H](CNC[C@H](O)c2ccc(Cl)cc2)N2CC[C@H]1C2	ZINC000819201057	GF	On-Demand	Anodyne	ADRB1	19	43
O=C(c1ccccc1)N1C[C@@H](CNC[C@H](O)c2ccc(Cl)cc2)N2CC[C@H]1C2	ZINC000819201057	GF	On-Demand	Anodyne	ADRB3	31	43
COC[C@@H](O)CNCCOc1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000819201091	FC	On-Demand	Anodyne	ADRB2	49	44
COC[C@@H](O)CNCCOc1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000819201091	FC	On-Demand	Anodyne	ADRB1	77	50
COC[C@@H](O)CNCCOc1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000819201091	FC	On-Demand	Anodyne	ADRB3	54	50
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCCc3cc(F)ccc32)cc1	ZINC000819201097	FF	On-Demand	Anodyne	HTR6	46	38
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCCc3cc(F)ccc32)cc1	ZINC000819201097	FF	On-Demand	Anodyne	BDKRB1	41	37
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCCc3cc(F)ccc32)cc1	ZINC000819201098	FF	On-Demand	Anodyne	HTR6	46	38
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCCc3cc(F)ccc32)cc1	ZINC000819201098	FF	On-Demand	Anodyne	BDKRB1	41	37
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCCc3cc(F)ccc32)cc1	ZINC000819201099	FF	On-Demand	Anodyne	HTR6	46	38
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCCc3cc(F)ccc32)cc1	ZINC000819201099	FF	On-Demand	Anodyne	BDKRB1	41	37
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCCc3cc(F)ccc32)cc1	ZINC000819201100	FF	On-Demand	Anodyne	HTR6	46	38
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCCc3cc(F)ccc32)cc1	ZINC000819201100	FF	On-Demand	Anodyne	BDKRB1	41	37
CCN(CC)Cc1csc(NC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)n1	ZINC000819201112	HF	On-Demand	Anodyne	AVPR1B	16	47
CCN(CC)Cc1csc(NC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)n1	ZINC000819201112	HF	On-Demand	Anodyne	CPT1A	27	43
CCN(CC)Cc1csc(NC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)n1	ZINC000819201112	HF	On-Demand	Anodyne	CPT1B	39	43
CC(C)c1ccc(C[C@@H](C)NC[C@H](O)c2cccnc2)cc1	ZINC000819201172	CG	On-Demand	Anodyne	ADRB2	54	50
CC(C)c1ccc(C[C@@H](C)NC[C@H](O)c2cccnc2)cc1	ZINC000819201172	CG	On-Demand	Anodyne	ADRB1	41	71
CC(C)c1ccc(C[C@@H](C)NC[C@H](O)c2cccnc2)cc1	ZINC000819201172	CG	On-Demand	Anodyne	ADRB3	113	71
CC(C)c1ccc(C[C@@H](C)NC[C@H](O)c2cccnc2)cc1	ZINC000819201172	CG	On-Demand	Anodyne	CYP51A1	16	40
CC(C)c1ccc(C[C@@H](C)NC[C@@H](O)c2cccnc2)cc1	ZINC000819201173	CG	On-Demand	Anodyne	ADRB2	54	50
CC(C)c1ccc(C[C@@H](C)NC[C@@H](O)c2cccnc2)cc1	ZINC000819201173	CG	On-Demand	Anodyne	ADRB1	41	71
CC(C)c1ccc(C[C@@H](C)NC[C@@H](O)c2cccnc2)cc1	ZINC000819201173	CG	On-Demand	Anodyne	ADRB3	113	71
CC(C)c1ccc(C[C@@H](C)NC[C@@H](O)c2cccnc2)cc1	ZINC000819201173	CG	On-Demand	Anodyne	CYP51A1	16	40
CC(C)c1ccc(C[C@H](C)NC[C@@H](O)c2cccnc2)cc1	ZINC000819201174	CG	On-Demand	Anodyne	ADRB2	54	50
CC(C)c1ccc(C[C@H](C)NC[C@@H](O)c2cccnc2)cc1	ZINC000819201174	CG	On-Demand	Anodyne	ADRB1	41	71
CC(C)c1ccc(C[C@H](C)NC[C@@H](O)c2cccnc2)cc1	ZINC000819201174	CG	On-Demand	Anodyne	ADRB3	113	71
CC(C)c1ccc(C[C@H](C)NC[C@@H](O)c2cccnc2)cc1	ZINC000819201174	CG	On-Demand	Anodyne	CYP51A1	16	40
CC(C)c1ccc(C[C@H](C)NC[C@H](O)c2cccnc2)cc1	ZINC000819201175	CG	On-Demand	Anodyne	ADRB2	54	50
CC(C)c1ccc(C[C@H](C)NC[C@H](O)c2cccnc2)cc1	ZINC000819201175	CG	On-Demand	Anodyne	ADRB1	41	71
CC(C)c1ccc(C[C@H](C)NC[C@H](O)c2cccnc2)cc1	ZINC000819201175	CG	On-Demand	Anodyne	ADRB3	113	71
CC(C)c1ccc(C[C@H](C)NC[C@H](O)c2cccnc2)cc1	ZINC000819201175	CG	On-Demand	Anodyne	CYP51A1	16	40
COc1cccc([S@@](=O)CC(=O)Nc2cc(CC(C)C)nn2C)c1	ZINC000819201189	EE	On-Demand	Anodyne	MTNR1A	21	42
COc1cccc([S@@](=O)CC(=O)Nc2cc(CC(C)C)nn2C)c1	ZINC000819201189	EE	On-Demand	Anodyne	MTNR1B	24	42
CC(C)(C)[C@@H](O)CNCCOc1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000819201196	FE	On-Demand	Anodyne	ADRB1	29	40
CC(C)(C)[C@@H](O)CNCCOc1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000819201196	FE	On-Demand	Anodyne	ADRB3	27	40
O=C(NCC1CCN(S(=O)(=O)c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819201197	FF	On-Demand	Anodyne	EPHX2	18	46
O=C(NCC1CCN(S(=O)(=O)c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819201197	FF	On-Demand	Anodyne	TGM2	68	45
O=C(NCC1CCN(S(=O)(=O)c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819201197	FF	On-Demand	Anodyne	F13A1	64	45
O=C(NCC1CCN(S(=O)(=O)c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819201197	FF	On-Demand	Anodyne	AKR1C3	42	34
O=S(=O)(c1ccc(OCCNC[C@H](O)CC(F)(F)F)cc1)C(F)(F)F	ZINC000819201202	GE	On-Demand	Anodyne	ADRB1	46	45
O=S(=O)(c1ccc(OCCNC[C@H](O)CC(F)(F)F)cc1)C(F)(F)F	ZINC000819201202	GE	On-Demand	Anodyne	ADRB3	34	45
O=S(=O)(c1ccc(OCCNC[C@@H](O)CC(F)(F)F)cc1)C(F)(F)F	ZINC000819201203	GE	On-Demand	Anodyne	ADRB1	46	45
O=S(=O)(c1ccc(OCCNC[C@@H](O)CC(F)(F)F)cc1)C(F)(F)F	ZINC000819201203	GE	On-Demand	Anodyne	ADRB3	34	45
O=C(/C=C/[C@H]1CCCO1)N1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000819201206	GG	On-Demand	Anodyne	ITGAL	40	31
O=C(/C=C/[C@H]1CCCO1)N1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000819201206	GG	On-Demand	Anodyne	GRM5	15	40
O=C(/C=C/[C@H]1CCCO1)N1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000819201206	GG	On-Demand	Anodyne	EPHX2	22	41
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000819201207	GG	On-Demand	Anodyne	ITGAL	40	31
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000819201207	GG	On-Demand	Anodyne	GRM5	15	40
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000819201207	GG	On-Demand	Anodyne	EPHX2	22	41
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000819201208	GG	On-Demand	Anodyne	ITGAL	40	31
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000819201208	GG	On-Demand	Anodyne	GRM5	15	40
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000819201208	GG	On-Demand	Anodyne	EPHX2	22	41
O=C(/C=C\[C@H]1CCCO1)N1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000819201209	GG	On-Demand	Anodyne	ITGAL	40	31
O=C(/C=C\[C@H]1CCCO1)N1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000819201209	GG	On-Demand	Anodyne	GRM5	15	40
O=C(/C=C\[C@H]1CCCO1)N1CCCN(C(=O)Nc2cccc(Cl)c2)CC1	ZINC000819201209	GG	On-Demand	Anodyne	EPHX2	22	41
CCOC(=O)[C@@H]1CCCCN1C(=O)C(F)=C1CCC1	ZINC000819201265	CE	On-Demand	Anodyne	FKBP1A	75	44
CN1CCO[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819201279	FD	On-Demand	Mild	PAPA1_CARPA	37	47
CN1CCO[C@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819201280	FD	On-Demand	Mild	PAPA1_CARPA	37	47
CN1CCO[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819201281	FD	On-Demand	Mild	PAPA1_CARPA	37	47
CN1CCO[C@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819201282	FD	On-Demand	Mild	PAPA1_CARPA	37	47
O=S(=O)(c1ccc(OCCNC[C@H](O)c2cccnc2)cc1)C(F)(F)F	ZINC000819201293	GE	On-Demand	Anodyne	ADRB2	46	64
O=S(=O)(c1ccc(OCCNC[C@H](O)c2cccnc2)cc1)C(F)(F)F	ZINC000819201293	GE	On-Demand	Anodyne	ADRB1	58	64
O=S(=O)(c1ccc(OCCNC[C@H](O)c2cccnc2)cc1)C(F)(F)F	ZINC000819201293	GE	On-Demand	Anodyne	ADRB3	142	67
O=S(=O)(c1ccc(OCCNC[C@@H](O)c2cccnc2)cc1)C(F)(F)F	ZINC000819201294	GE	On-Demand	Anodyne	ADRB2	46	64
O=S(=O)(c1ccc(OCCNC[C@@H](O)c2cccnc2)cc1)C(F)(F)F	ZINC000819201294	GE	On-Demand	Anodyne	ADRB1	58	64
O=S(=O)(c1ccc(OCCNC[C@@H](O)c2cccnc2)cc1)C(F)(F)F	ZINC000819201294	GE	On-Demand	Anodyne	ADRB3	142	67
COc1ccccc1N1CCC(NC(=O)C(F)=C2CCC2)CC1	ZINC000819201297	DG	On-Demand	Anodyne	HTR1A	90	49
COc1ccccc1N1CCC(NC(=O)C(F)=C2CCC2)CC1	ZINC000819201297	DG	On-Demand	Anodyne	DRD2	76	47
COc1ccccc1N1CCC(NC(=O)C(F)=C2CCC2)CC1	ZINC000819201297	DG	On-Demand	Anodyne	DRD4	38	48
COc1ccccc1N1CCC(NC(=O)C(F)=C2CCC2)CC1	ZINC000819201297	DG	On-Demand	Anodyne	ADRA1D	81	44
COc1ccccc1N1CCC(NC(=O)C(F)=C2CCC2)CC1	ZINC000819201297	DG	On-Demand	Anodyne	HTR2A	22	40
COc1ccccc1N1CCC(NC(=O)C(F)=C2CCC2)CC1	ZINC000819201297	DG	On-Demand	Anodyne	ADRA1A	72	44
COc1ccccc1N1CCC(NC(=O)C(F)=C2CCC2)CC1	ZINC000819201297	DG	On-Demand	Anodyne	ADRA1B	63	44
COc1ccccc1N1CCC(NC(=O)C(F)=C2CCC2)CC1	ZINC000819201297	DG	On-Demand	Anodyne	DRD3	71	43
COc1ccccc1N1CCC(NC(=O)C(F)=C2CCC2)CC1	ZINC000819201297	DG	On-Demand	Anodyne	HTR7	57	46
CCN(CC)Cc1csc(NC(=O)c2ccc(SCc3cn4ccccc4n3)cc2)n1	ZINC000819201298	JK	On-Demand	Anodyne	MAP3K5	57	34
CCN(CC)Cc1csc(NC(=O)Cc2nc(-c3cccs3)oc2C)n1	ZINC000819201379	GI	On-Demand	Anodyne	PPARA	26	40
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819201423	DF	On-Demand	Anodyne	ACE	50	46
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819201423	DF	On-Demand	Anodyne	MME	123	44
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819201423	DF	On-Demand	Anodyne	ANPEP	66	39
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819201423	DF	On-Demand	Anodyne	FCER2	48	32
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819201423	DF	On-Demand	Anodyne	CCKAR	15	54
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819201423	DF	On-Demand	Anodyne	CPA1	55	41
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819201423	DF	On-Demand	Anodyne	CYP51A1	23	47
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819201423	DF	On-Demand	Anodyne	PYGL	32	54
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819201423	DF	On-Demand	Anodyne	ITGA4	18	40
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819201423	DF	On-Demand	Anodyne	NAALAD2	25	42
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819201423	DF	On-Demand	Anodyne	ECE1	54	43
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819201423	DF	On-Demand	Anodyne	CAPN1	31	47
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819201423	DF	On-Demand	Anodyne	ACE2	95	42
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819201423	DF	On-Demand	Anodyne	PIN1	60	39
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819201423	DF	On-Demand	Anodyne	FPR1	65	39
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819201423	DF	On-Demand	Anodyne	BLA1_STEMA	91	55
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819201423	DF	On-Demand	Anodyne	BRCA1	43	30
O=C(N[C@H](C(=O)O)c1ccccc1)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819201424	FD	On-Demand	Anodyne	PTAFR	18	43
O=C(N[C@H](C(=O)O)c1ccccc1)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819201424	FD	On-Demand	Anodyne	C3AR1	39	41
O=C(N[C@H](C(=O)O)c1ccccc1)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819201424	FD	On-Demand	Anodyne	SLC18A3	15	43
O=C(N[C@H](C(=O)O)c1ccccc1)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819201424	FD	On-Demand	Anodyne	MTTP	15	44
O=C(N[C@H](C(=O)O)c1ccccc1)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819201424	FD	On-Demand	Anodyne	SFRP1	20	44
O=C(N[C@H](C(=O)O)c1ccccc1)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819201424	FD	On-Demand	Anodyne	L3MBTL3	53	35
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnc2ccccn12	ZINC000819201425	DD	On-Demand	Anodyne	ACE	60	46
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnc2ccccn12	ZINC000819201425	DD	On-Demand	Anodyne	MME	135	46
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnc2ccccn12	ZINC000819201425	DD	On-Demand	Anodyne	ANPEP	78	40
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnc2ccccn12	ZINC000819201425	DD	On-Demand	Anodyne	CTSB	27	42
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnc2ccccn12	ZINC000819201425	DD	On-Demand	Anodyne	CYSP_TRYCR	48	34
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnc2ccccn12	ZINC000819201425	DD	On-Demand	Anodyne	CPA1	62	42
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnc2ccccn12	ZINC000819201425	DD	On-Demand	Anodyne	ITGA4	27	44
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnc2ccccn12	ZINC000819201425	DD	On-Demand	Anodyne	CTRB1	20	40
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnc2ccccn12	ZINC000819201425	DD	On-Demand	Anodyne	NAALAD2	32	47
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnc2ccccn12	ZINC000819201425	DD	On-Demand	Anodyne	ECE1	42	41
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnc2ccccn12	ZINC000819201425	DD	On-Demand	Anodyne	CAPN1	41	49
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnc2ccccn12	ZINC000819201425	DD	On-Demand	Anodyne	ACE2	104	42
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnc2ccccn12	ZINC000819201425	DD	On-Demand	Anodyne	FPR1	72	40
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnc2ccccn12	ZINC000819201425	DD	On-Demand	Anodyne	EPHB3	23	51
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnc2ccccn12	ZINC000819201425	DD	On-Demand	Anodyne	PSMB5	38	40
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnc2ccccn12	ZINC000819201425	DD	On-Demand	Anodyne	BLA1_STEMA	84	43
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnc2ccccn12	ZINC000819201425	DD	On-Demand	Anodyne	PSMB8	22	40
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnc2ccccn12	ZINC000819201425	DD	On-Demand	Anodyne	BRCA1	44	32
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1cnc2ccccn12	ZINC000819201425	DD	On-Demand	Anodyne	NPFFR1	50	33
O=C(N[C@H](C(=O)O)c1ccccc1)[C@H]1CCN(C2CCCCC2)C1	ZINC000819201426	EF	On-Demand	Anodyne	SLC18A3	19	40
O=C(N[C@H](C(=O)O)c1ccccc1)[C@H]1CCN(C2CCCCC2)C1	ZINC000819201426	EF	On-Demand	Anodyne	NAALAD2	19	40
O=C(N[C@H](C(=O)O)c1ccccc1)[C@H]1CCN(C2CCCCC2)C1	ZINC000819201426	EF	On-Demand	Anodyne	BIRC8	46	34
O=C(N[C@H](C(=O)O)c1ccccc1)[C@H]1CCN(C2CCCCC2)C1	ZINC000819201426	EF	On-Demand	Anodyne	L3MBTL3	46	35
O=C(O)[C@@H](NC(=O)[C@@H]1CCN(C2CCCCC2)C1)c1ccccc1	ZINC000819201427	EF	On-Demand	Anodyne	SLC18A3	19	40
O=C(O)[C@@H](NC(=O)[C@@H]1CCN(C2CCCCC2)C1)c1ccccc1	ZINC000819201427	EF	On-Demand	Anodyne	NAALAD2	19	40
O=C(O)[C@@H](NC(=O)[C@@H]1CCN(C2CCCCC2)C1)c1ccccc1	ZINC000819201427	EF	On-Demand	Anodyne	BIRC8	46	34
O=C(O)[C@@H](NC(=O)[C@@H]1CCN(C2CCCCC2)C1)c1ccccc1	ZINC000819201427	EF	On-Demand	Anodyne	L3MBTL3	46	35
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	ACE	90	48
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	OPRM1	35	44
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	OPRD1	32	41
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	MME	156	54
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	ANPEP	71	39
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	TACR1	15	42
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	FCER2	55	34
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	CTSB	31	43
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	CPA1	62	46
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	NPFFR2	48	36
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	TIMP3	82	38
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	ITGA4	78	44
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	NAALAD2	32	46
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	CAPNS1	58	35
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	ECE1	69	46
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	CAPN1	84	45
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	MMP9	15	42
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	ACE2	103	44
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	FPR1	83	43
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	NPPA	65	40
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	XIAP	23	42
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	BLA1_STEMA	77	41
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	BRCA1	55	34
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@H]1CC12CCC2	ZINC000819201432	CD	On-Demand	Anodyne	NPFFR1	40	36
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	ACE	90	48
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	OPRM1	35	44
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	OPRD1	32	41
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	MME	156	54
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	ANPEP	71	39
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	TACR1	15	42
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	FCER2	55	34
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	CTSB	31	43
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	CPA1	62	46
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	NPFFR2	48	36
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	TIMP3	82	38
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	ITGA4	78	44
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	NAALAD2	32	46
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	CAPNS1	58	35
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	ECE1	69	46
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	CAPN1	84	45
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	MMP9	15	42
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	ACE2	103	44
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	FPR1	83	43
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	NPPA	65	40
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	XIAP	23	42
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	BLA1_STEMA	77	41
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	BRCA1	55	34
O=C(O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819201433	CD	On-Demand	Anodyne	NPFFR1	40	36
O=C(N[C@H](C(=O)O)c1ccccc1)C1=CCCC1	ZINC000819201436	BE	On-Demand	Anodyne	NAALAD2	19	40
O=C(N[C@H](C(=O)O)c1ccccc1)C1CCN(C(=O)/C=C\c2ccccc2)CC1	ZINC000819201437	GF	On-Demand	Anodyne	ITGAL	42	38
O=C(N[C@H](C(=O)O)c1ccccc1)C1CCN(C(=O)/C=C\c2ccccc2)CC1	ZINC000819201437	GF	On-Demand	Anodyne	CCR2	17	44
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(=O)n(-c2cccc(F)c2)c1	ZINC000819201440	GE	On-Demand	Anodyne	ACE	39	42
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(=O)n(-c2cccc(F)c2)c1	ZINC000819201440	GE	On-Demand	Anodyne	COMT	43	30
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(=O)n(-c2cccc(F)c2)c1	ZINC000819201440	GE	On-Demand	Anodyne	MME	86	42
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(=O)n(-c2cccc(F)c2)c1	ZINC000819201440	GE	On-Demand	Anodyne	CTRA_BOVIN	28	40
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(=O)n(-c2cccc(F)c2)c1	ZINC000819201440	GE	On-Demand	Anodyne	CYSP_TRYCR	17	41
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(=O)n(-c2cccc(F)c2)c1	ZINC000819201440	GE	On-Demand	Anodyne	ITGA4	15	43
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(=O)n(-c2cccc(F)c2)c1	ZINC000819201440	GE	On-Demand	Anodyne	NAALAD2	25	41
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(=O)n(-c2cccc(F)c2)c1	ZINC000819201440	GE	On-Demand	Anodyne	CAPN1	18	45
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(=O)n(-c2cccc(F)c2)c1	ZINC000819201440	GE	On-Demand	Anodyne	ACE2	77	39
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(=O)n(-c2cccc(F)c2)c1	ZINC000819201440	GE	On-Demand	Anodyne	PIN1	51	45
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(=O)n(-c2cccc(F)c2)c1	ZINC000819201440	GE	On-Demand	Anodyne	FPR1	56	35
O=C(N[C@@H](Cc1ccccc1)C(=O)O)c1ccc(=O)n(-c2cccc(F)c2)c1	ZINC000819201440	GE	On-Demand	Anodyne	BLA1_STEMA	80	41
O=C(N[C@H](C(=O)O)c1ccccc1)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819201441	EF	On-Demand	Bother	GABRA1	15	58
O=C(N[C@H](C(=O)O)c1ccccc1)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819201441	EF	On-Demand	Bother	GABRA5	15	58
O=C(N[C@H](C(=O)O)c1ccccc1)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819201441	EF	On-Demand	Bother	GABRA2	15	58
O=C(N[C@H](C(=O)O)c1ccccc1)C(F)=C1CCCC1	ZINC000819201442	CF	On-Demand	Anodyne	NAALAD2	19	40
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1cccc2cccnc12	ZINC000819201462	DF	On-Demand	Reactive	HCRTR1	16	46
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1cccc2cccnc12	ZINC000819201462	DF	On-Demand	Reactive	G2YM83_BOTF4	53	36
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1cccc2cccnc12	ZINC000819201463	DF	On-Demand	Reactive	HCRTR1	16	46
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1cccc2cccnc12	ZINC000819201463	DF	On-Demand	Reactive	G2YM83_BOTF4	53	36
CC(C)c1ccc(C[C@H](C)NC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819201487	DH	On-Demand	Mild	ADRB2	44	36
CC(C)c1ccc(C[C@H](C)NC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819201487	DH	On-Demand	Mild	ADRB1	19	50
CC(C)c1ccc(C[C@H](C)NC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819201487	DH	On-Demand	Mild	ADRB3	40	44
CC(C)c1ccc(C[C@@H](C)NC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819201488	DH	On-Demand	Mild	ADRB2	44	36
CC(C)c1ccc(C[C@@H](C)NC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819201488	DH	On-Demand	Mild	ADRB1	19	50
CC(C)c1ccc(C[C@@H](C)NC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819201488	DH	On-Demand	Mild	ADRB3	40	44
CC(C)c1ccc(C[C@@H](C)NC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819201489	DH	On-Demand	Mild	ADRB2	44	36
CC(C)c1ccc(C[C@@H](C)NC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819201489	DH	On-Demand	Mild	ADRB1	19	50
CC(C)c1ccc(C[C@@H](C)NC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819201489	DH	On-Demand	Mild	ADRB3	40	44
CC(C)c1ccc(C[C@H](C)NC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819201490	DH	On-Demand	Mild	ADRB2	44	36
CC(C)c1ccc(C[C@H](C)NC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819201490	DH	On-Demand	Mild	ADRB1	19	50
CC(C)c1ccc(C[C@H](C)NC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819201490	DH	On-Demand	Mild	ADRB3	40	44
O=S(=O)(c1ccc(OCCNC[C@H](O)c2ccccc2)cc1)C(F)(F)F	ZINC000819201518	GF	On-Demand	Anodyne	ADRB2	49	46
O=S(=O)(c1ccc(OCCNC[C@H](O)c2ccccc2)cc1)C(F)(F)F	ZINC000819201518	GF	On-Demand	Anodyne	ADRB1	75	52
O=S(=O)(c1ccc(OCCNC[C@H](O)c2ccccc2)cc1)C(F)(F)F	ZINC000819201518	GF	On-Demand	Anodyne	ADRB3	112	52
O=S(=O)(c1ccc(OCCNC[C@@H](O)c2ccccc2)cc1)C(F)(F)F	ZINC000819201519	GF	On-Demand	Anodyne	ADRB2	49	46
O=S(=O)(c1ccc(OCCNC[C@@H](O)c2ccccc2)cc1)C(F)(F)F	ZINC000819201519	GF	On-Demand	Anodyne	ADRB1	75	52
O=S(=O)(c1ccc(OCCNC[C@@H](O)c2ccccc2)cc1)C(F)(F)F	ZINC000819201519	GF	On-Demand	Anodyne	ADRB3	112	52
O=C([C@H]1CSCN1C(=O)C(F)=C1CCC1)N1CCSCC1	ZINC000819201522	ED	On-Demand	Anodyne	PREP	21	43
O=C([C@@H]1CSCN1C(=O)C(F)=C1CCC1)N1CCSCC1	ZINC000819201523	ED	On-Demand	Anodyne	PREP	21	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cnn(CC#N)c1)C2	ZINC000819201556	DD	On-Demand	Mild	PANC	44	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cnn(CC#N)c1)C2	ZINC000819201557	DD	On-Demand	Mild	PANC	44	31
NC(=O)[C@@H]1Cc2ccccc2N1C(=O)C(F)=C1CCC1	ZINC000819201571	CD	On-Demand	Anodyne	ACE	16	42
NC(=O)[C@@H]1Cc2ccccc2N1C(=O)C(F)=C1CCC1	ZINC000819201571	CD	On-Demand	Anodyne	TPP2	56	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCCc3cc(F)ccc32)CC1	ZINC000819201572	GH	On-Demand	Anodyne	GPR119	38	51
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCCc3cc(F)ccc32)CC1	ZINC000819201573	GH	On-Demand	Anodyne	GPR119	38	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCCc3cc(F)ccc32)CC1	ZINC000819201574	GH	On-Demand	Anodyne	GPR119	38	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCCc3cc(F)ccc32)CC1	ZINC000819201575	GH	On-Demand	Anodyne	GPR119	38	51
COc1ccccc1N1CCC(NC(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819201576	EF	On-Demand	Anodyne	HTR1A	72	42
COc1ccccc1N1CCC(NC(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819201576	EF	On-Demand	Anodyne	DRD2	59	42
COc1ccccc1N1CCC(NC(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819201576	EF	On-Demand	Anodyne	DRD4	32	42
COc1ccccc1N1CCC(NC(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819201576	EF	On-Demand	Anodyne	ADRA1D	70	41
COc1ccccc1N1CCC(NC(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819201576	EF	On-Demand	Anodyne	ADRA1A	61	41
COc1ccccc1N1CCC(NC(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819201576	EF	On-Demand	Anodyne	ADRA1B	55	41
COc1ccccc1N1CCC(NC(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819201576	EF	On-Demand	Anodyne	DRD3	60	41
COc1ccccc1N1CCC(NC(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819201576	EF	On-Demand	Anodyne	HTR7	47	41
COc1ccccc1N1CCC(NC(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819201577	EF	On-Demand	Anodyne	HTR1A	72	42
COc1ccccc1N1CCC(NC(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819201577	EF	On-Demand	Anodyne	DRD2	59	42
COc1ccccc1N1CCC(NC(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819201577	EF	On-Demand	Anodyne	DRD4	32	42
COc1ccccc1N1CCC(NC(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819201577	EF	On-Demand	Anodyne	ADRA1D	70	41
COc1ccccc1N1CCC(NC(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819201577	EF	On-Demand	Anodyne	ADRA1A	61	41
COc1ccccc1N1CCC(NC(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819201577	EF	On-Demand	Anodyne	ADRA1B	55	41
COc1ccccc1N1CCC(NC(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819201577	EF	On-Demand	Anodyne	DRD3	60	41
COc1ccccc1N1CCC(NC(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819201577	EF	On-Demand	Anodyne	HTR7	47	41
COc1ccccc1N1CCC(NC(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819201578	EF	On-Demand	Anodyne	HTR1A	72	42
COc1ccccc1N1CCC(NC(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819201578	EF	On-Demand	Anodyne	DRD2	59	42
COc1ccccc1N1CCC(NC(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819201578	EF	On-Demand	Anodyne	DRD4	32	42
COc1ccccc1N1CCC(NC(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819201578	EF	On-Demand	Anodyne	ADRA1D	70	41
COc1ccccc1N1CCC(NC(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819201578	EF	On-Demand	Anodyne	ADRA1A	61	41
COc1ccccc1N1CCC(NC(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819201578	EF	On-Demand	Anodyne	ADRA1B	55	41
COc1ccccc1N1CCC(NC(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819201578	EF	On-Demand	Anodyne	DRD3	60	41
COc1ccccc1N1CCC(NC(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819201578	EF	On-Demand	Anodyne	HTR7	47	41
COc1ccccc1N1CCC(NC(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819201579	EF	On-Demand	Anodyne	HTR1A	72	42
COc1ccccc1N1CCC(NC(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819201579	EF	On-Demand	Anodyne	DRD2	59	42
COc1ccccc1N1CCC(NC(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819201579	EF	On-Demand	Anodyne	DRD4	32	42
COc1ccccc1N1CCC(NC(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819201579	EF	On-Demand	Anodyne	ADRA1D	70	41
COc1ccccc1N1CCC(NC(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819201579	EF	On-Demand	Anodyne	ADRA1A	61	41
COc1ccccc1N1CCC(NC(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819201579	EF	On-Demand	Anodyne	ADRA1B	55	41
COc1ccccc1N1CCC(NC(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819201579	EF	On-Demand	Anodyne	DRD3	60	41
COc1ccccc1N1CCC(NC(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819201579	EF	On-Demand	Anodyne	HTR7	47	41
C=C(Cl)CSc1nc(C)c(CC(=O)Nc2ncccc2OC)s1	ZINC000819201580	FH	On-Demand	Mild	ENPP1	52	36
O=C(Nc1cccc(C(=O)N2CCSCC2)c1)C(F)=C1CCC1	ZINC000819201591	EG	On-Demand	Anodyne	EPHX2	15	44
COC(=O)[C@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1cccs1	ZINC000819201628	FD	On-Demand	Anodyne	PAPA1_CARPA	26	40
CCN(CC)Cc1csc(NC(=O)Cc2nc(-c3ccccc3)oc2C)n1	ZINC000819201718	GI	On-Demand	Anodyne	PPARG	63	40
CCN(CC)Cc1csc(NC(=O)Cc2nc(-c3ccccc3)oc2C)n1	ZINC000819201718	GI	On-Demand	Anodyne	PPARA	70	40
CCN(CC)Cc1csc(NC(=O)Cc2nc(-c3ccccc3)oc2C)n1	ZINC000819201718	GI	On-Demand	Anodyne	PDE8B	62	36
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819201725	GD	On-Demand	Anodyne	EPHX2	17	43
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819201725	GD	On-Demand	Anodyne	TGM2	83	46
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819201725	GD	On-Demand	Anodyne	F13A1	82	46
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819201726	GD	On-Demand	Anodyne	EPHX2	17	43
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819201726	GD	On-Demand	Anodyne	TGM2	83	46
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819201726	GD	On-Demand	Anodyne	F13A1	82	46
O=C(/C=C/[C@H]1CCCO1)NCC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819201727	GD	On-Demand	Anodyne	EPHX2	17	43
O=C(/C=C/[C@H]1CCCO1)NCC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819201727	GD	On-Demand	Anodyne	TGM2	83	46
O=C(/C=C/[C@H]1CCCO1)NCC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819201727	GD	On-Demand	Anodyne	F13A1	82	46
O=C(/C=C\[C@H]1CCCO1)NCC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819201728	GD	On-Demand	Anodyne	EPHX2	17	43
O=C(/C=C\[C@H]1CCCO1)NCC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819201728	GD	On-Demand	Anodyne	TGM2	83	46
O=C(/C=C\[C@H]1CCCO1)NCC1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000819201728	GD	On-Demand	Anodyne	F13A1	82	46
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819201820	FD	On-Demand	Anodyne	FKBP1A	41	35
CCOC(=O)[C@@H]1CCCCN1C(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819201823	FD	On-Demand	Anodyne	FKBP1A	41	35
O=S(=O)(c1ccc(OCCNC[C@H](O)C(F)(F)F)cc1)C(F)(F)F	ZINC000819201835	GD	On-Demand	Anodyne	ADRB1	35	42
O=S(=O)(c1ccc(OCCNC[C@H](O)C(F)(F)F)cc1)C(F)(F)F	ZINC000819201835	GD	On-Demand	Anodyne	ADRB3	32	42
O=S(=O)(c1ccc(OCCNC[C@@H](O)C(F)(F)F)cc1)C(F)(F)F	ZINC000819201836	GD	On-Demand	Anodyne	ADRB1	35	42
O=S(=O)(c1ccc(OCCNC[C@@H](O)C(F)(F)F)cc1)C(F)(F)F	ZINC000819201836	GD	On-Demand	Anodyne	ADRB3	32	42
CC(=O)Nc1cccc(CC(=O)NC[C@@H]2CN3CCC[C@H]3CO2)c1	ZINC000819201841	ED	On-Demand	Anodyne	CCR3	29	41
CC(=O)Nc1cccc(CC(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)c1	ZINC000819201842	ED	On-Demand	Anodyne	CCR3	29	41
CC(=O)Nc1cccc(CC(=O)NC[C@H]2CN3CCC[C@H]3CO2)c1	ZINC000819201843	ED	On-Demand	Anodyne	CCR3	29	41
CC(=O)Nc1cccc(CC(=O)NC[C@H]2CN3CCC[C@@H]3CO2)c1	ZINC000819201844	ED	On-Demand	Anodyne	CCR3	29	41
CC(C)c1ccc(C[C@@H](C)NC[C@@H](O)C2CC2)cc1	ZINC000819201846	CG	On-Demand	Anodyne	ADRB2	18	46
CC(C)c1ccc(C[C@@H](C)NC[C@@H](O)C2CC2)cc1	ZINC000819201846	CG	On-Demand	Anodyne	ADRB1	17	41
CC(C)c1ccc(C[C@@H](C)NC[C@H](O)C2CC2)cc1	ZINC000819201847	CG	On-Demand	Anodyne	ADRB2	18	46
CC(C)c1ccc(C[C@@H](C)NC[C@H](O)C2CC2)cc1	ZINC000819201847	CG	On-Demand	Anodyne	ADRB1	17	41
CC(C)c1ccc(C[C@H](C)NC[C@H](O)C2CC2)cc1	ZINC000819201848	CG	On-Demand	Anodyne	ADRB2	18	46
CC(C)c1ccc(C[C@H](C)NC[C@H](O)C2CC2)cc1	ZINC000819201848	CG	On-Demand	Anodyne	ADRB1	17	41
CC(C)c1ccc(C[C@H](C)NC[C@@H](O)C2CC2)cc1	ZINC000819201849	CG	On-Demand	Anodyne	ADRB2	18	46
CC(C)c1ccc(C[C@H](C)NC[C@@H](O)C2CC2)cc1	ZINC000819201849	CG	On-Demand	Anodyne	ADRB1	17	41
CN(C[C@@H](O)CN[C@@H]1CCCc2cc(F)ccc21)C(=O)OC(C)(C)C	ZINC000819201852	FG	On-Demand	Anodyne	CTSD	15	42
CN(C[C@H](O)CN[C@@H]1CCCc2cc(F)ccc21)C(=O)OC(C)(C)C	ZINC000819201853	FG	On-Demand	Anodyne	CTSD	15	42
CN(C[C@@H](O)CN[C@H]1CCCc2cc(F)ccc21)C(=O)OC(C)(C)C	ZINC000819201854	FG	On-Demand	Anodyne	CTSD	15	42
CN(C[C@H](O)CN[C@H]1CCCc2cc(F)ccc21)C(=O)OC(C)(C)C	ZINC000819201855	FG	On-Demand	Anodyne	CTSD	15	42
O[C@@H](CNCC1(c2ccc(F)cc2Cl)CC1)c1cccnc1	ZINC000819201874	DG	On-Demand	Anodyne	ADRB3	64	40
O[C@H](CNCC1(c2ccc(F)cc2Cl)CC1)c1cccnc1	ZINC000819201875	DG	On-Demand	Anodyne	ADRB3	64	40
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1cccc(F)c1F	ZINC000819201887	GH	On-Demand	Anodyne	GPR119	48	61
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1cccc(F)c1F	ZINC000819201889	GH	On-Demand	Anodyne	GPR119	48	61
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NNC(=O)c1cccc3cccnc13)C2	ZINC000819201893	GD	On-Demand	Reactive	HCRTR1	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NNC(=O)c1cccc3cccnc13)C2	ZINC000819201894	GD	On-Demand	Reactive	HCRTR1	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1c3ccccc3C[C@H]1C(N)=O)C2	ZINC000819201917	FD	On-Demand	Anodyne	ACE	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1c3ccccc3C[C@H]1C(N)=O)C2	ZINC000819201918	FD	On-Demand	Anodyne	ACE	17	40
CCN(CC)Cc1csc(NC(=O)c2sc(-c3ccc(C(F)(F)F)cc3)nc2C)n1	ZINC000819201953	JK	On-Demand	Anodyne	PPARA	15	53
CCN(CC)Cc1csc(NC(=O)c2sc(-c3ccc(C(F)(F)F)cc3)nc2C)n1	ZINC000819201953	JK	On-Demand	Anodyne	PPARD	21	50
O=C(Nc1cccc(Cl)c1)N1CCCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819201970	FH	On-Demand	Anodyne	FAAH	16	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cnn(CC#N)c1	ZINC000819201973	DD	On-Demand	Mild	PANC	52	35
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(NC(=O)N2CCCCCC2)cc1	ZINC000819202007	FH	On-Demand	Anodyne	EPHX2	17	44
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(NC(=O)N2CCCCCC2)cc1	ZINC000819202008	FH	On-Demand	Anodyne	EPHX2	17	44
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(NC(=O)N2CCCCCC2)cc1	ZINC000819202009	FH	On-Demand	Anodyne	EPHX2	17	44
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(NC(=O)N2CCCCCC2)cc1	ZINC000819202010	FH	On-Demand	Anodyne	EPHX2	17	44
CSC[C@@H](C(=O)Nc1cccnc1Cl)N1C(=O)[C@H]2CCCC[C@H]2C1=O	ZINC000819202045	GF	On-Demand	Anodyne	G2YM83_BOTF4	71	37
O[C@@H](CNCC1(c2ccc(Cl)cc2Cl)CCC1)c1cccnc1	ZINC000819202051	FI	On-Demand	Anodyne	ADRB3	86	44
O[C@H](CNCC1(c2ccc(Cl)cc2Cl)CCC1)c1cccnc1	ZINC000819202052	FI	On-Demand	Anodyne	ADRB3	86	44
O[C@@H](CNCC1(Cc2ccc(F)cc2)CC1)c1cccnc1	ZINC000819202112	DF	On-Demand	Anodyne	ADRB2	23	41
O[C@@H](CNCC1(Cc2ccc(F)cc2)CC1)c1cccnc1	ZINC000819202112	DF	On-Demand	Anodyne	ADRB1	24	41
O[C@@H](CNCC1(Cc2ccc(F)cc2)CC1)c1cccnc1	ZINC000819202112	DF	On-Demand	Anodyne	ADRB3	95	43
O[C@H](CNCC1(Cc2ccc(F)cc2)CC1)c1cccnc1	ZINC000819202113	DF	On-Demand	Anodyne	ADRB2	23	41
O[C@H](CNCC1(Cc2ccc(F)cc2)CC1)c1cccnc1	ZINC000819202113	DF	On-Demand	Anodyne	ADRB1	24	41
O[C@H](CNCC1(Cc2ccc(F)cc2)CC1)c1cccnc1	ZINC000819202113	DF	On-Demand	Anodyne	ADRB3	95	43
O[C@@H](CNCCSCc1ccnc(Cl)c1)c1cccc(Cl)c1	ZINC000819202118	FH	On-Demand	Anodyne	ADRB1	40	45
O[C@@H](CNCCSCc1ccnc(Cl)c1)c1cccc(Cl)c1	ZINC000819202118	FH	On-Demand	Anodyne	ADRB3	52	45
O[C@H](CNCCSCc1ccnc(Cl)c1)c1cccc(Cl)c1	ZINC000819202119	FH	On-Demand	Anodyne	ADRB1	40	45
O[C@H](CNCCSCc1ccnc(Cl)c1)c1cccc(Cl)c1	ZINC000819202119	FH	On-Demand	Anodyne	ADRB3	52	45
CCN(CC(F)(F)F)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819202122	FF	On-Demand	Mild	PAPA1_CARPA	38	46
CCN(CC(F)(F)F)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819202122	FF	On-Demand	Mild	CTSK	18	44
CCN(CC(F)(F)F)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819202123	FF	On-Demand	Mild	PAPA1_CARPA	38	46
CCN(CC(F)(F)F)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819202123	FF	On-Demand	Mild	CTSK	18	44
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCC1(Cc2ccc(F)cc2)CC1	ZINC000819202126	FG	On-Demand	Anodyne	PAPA1_CARPA	16	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNCC1(Cc2ccc(F)cc2)CC1	ZINC000819202127	FG	On-Demand	Anodyne	PAPA1_CARPA	16	40
C[C@H]1CCC[C@H](C)N1C(=O)COc1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819202130	HI	On-Demand	Anodyne	F10	15	42
C[C@H]1CCC[C@H](C)N1C(=O)COc1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819202130	HI	On-Demand	Anodyne	CYSLTR2	48	35
C[C@H]1CCC[C@H](C)N1C(=O)COc1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819202130	HI	On-Demand	Anodyne	CPT1A	80	35
C[C@H]1CCC[C@H](C)N1C(=O)COc1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819202130	HI	On-Demand	Anodyne	G2YM83_BOTF4	80	44
O=C(C(F)=C1CCC1)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000819202144	FF	On-Demand	Anodyne	DRD4	27	42
O=C(C(F)=C1CCC1)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000819202144	FF	On-Demand	Anodyne	EBP	23	43
O[C@H](CN[C@H]1CC[C@@H](c2ccccc2)C1)Cc1ccc(F)cc1	ZINC000819202146	DH	On-Demand	Anodyne	SLC18A3	22	42
O[C@H](CN[C@H]1CC[C@H](c2ccccc2)C1)Cc1ccc(F)cc1	ZINC000819202147	DH	On-Demand	Anodyne	SLC18A3	22	42
O[C@H](CN[C@@H]1CC[C@@H](c2ccccc2)C1)Cc1ccc(F)cc1	ZINC000819202148	DH	On-Demand	Anodyne	SLC18A3	22	42
O[C@H](CN[C@@H]1CC[C@H](c2ccccc2)C1)Cc1ccc(F)cc1	ZINC000819202149	DH	On-Demand	Anodyne	SLC18A3	22	42
O=C(CSc1ncccc1C(=O)Nc1cccnc1Cl)Nc1ccc2c(c1)OCO2	ZINC000819202159	IH	On-Demand	Anodyne	GRM4	35	49
O=C(CSc1ncccc1C(=O)Nc1cccnc1Cl)Nc1ccc2c(c1)OCO2	ZINC000819202159	IH	On-Demand	Anodyne	G2YM83_BOTF4	76	38
O=C(NCCCN1CCN(c2ccncc2)CC1)C(F)=C1CCC1	ZINC000819202192	EE	On-Demand	Anodyne	HTR1A	60	46
O=C(NCCCN1CCN(c2ccncc2)CC1)C(F)=C1CCC1	ZINC000819202192	EE	On-Demand	Anodyne	DRD2	50	43
O=C(NCCCN1CCN(c2ccncc2)CC1)C(F)=C1CCC1	ZINC000819202192	EE	On-Demand	Anodyne	DRD4	31	41
O=C(NCCCN1CCN(c2ccncc2)CC1)C(F)=C1CCC1	ZINC000819202192	EE	On-Demand	Anodyne	ADRA1D	23	40
O=C(NCCCN1CCN(c2ccncc2)CC1)C(F)=C1CCC1	ZINC000819202192	EE	On-Demand	Anodyne	HTR2A	48	46
O=C(NCCCN1CCN(c2ccncc2)CC1)C(F)=C1CCC1	ZINC000819202192	EE	On-Demand	Anodyne	HTR2C	32	41
O=C(NCCCN1CCN(c2ccncc2)CC1)C(F)=C1CCC1	ZINC000819202192	EE	On-Demand	Anodyne	ADRA1A	25	42
O=C(NCCCN1CCN(c2ccncc2)CC1)C(F)=C1CCC1	ZINC000819202192	EE	On-Demand	Anodyne	DRD3	70	46
O=C(NCCCN1CCN(c2ccncc2)CC1)C(F)=C1CCC1	ZINC000819202192	EE	On-Demand	Anodyne	HTR7	53	40
O=C(Nc1ccc(NC(=O)N2CCCCCC2)cc1)C(F)=C1CCC1	ZINC000819202195	EI	On-Demand	Anodyne	EPHX2	20	53
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000819202214	GE	On-Demand	Anodyne	DRD4	25	40
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000819202215	GE	On-Demand	Anodyne	DRD4	25	40
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000819202216	GE	On-Demand	Anodyne	DRD4	25	40
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000819202217	GE	On-Demand	Anodyne	DRD4	25	40
CN(C)CCOc1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819202233	DE	On-Demand	Anodyne	EPHX2	17	40
CN(C)CCOc1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819202234	DE	On-Demand	Anodyne	EPHX2	17	40
CN(C)CCOc1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819202235	DE	On-Demand	Anodyne	EPHX2	17	40
CN(C)CCOc1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819202236	DE	On-Demand	Anodyne	EPHX2	17	40
C=CCN(c1ccc(Cl)cc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccnc2Cl)c1	ZINC000819202270	JK	On-Demand	Mild	G2YM83_BOTF4	68	33
COC[C@@H](C)NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819202277	CE	On-Demand	Anodyne	ADRB2	24	42
COC[C@@H](C)NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819202278	CE	On-Demand	Anodyne	ADRB2	24	42
C=CCN(c1ccc(OC)cc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccnc2Cl)c1	ZINC000819202279	JK	On-Demand	Mild	G2YM83_BOTF4	66	33
C#CCOc1ccc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)cc1	ZINC000819202300	FH	On-Demand	Mild	ABCB1	19	45
CCCCCCC(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819202322	DI	On-Demand	Anodyne	HTR4	31	44
CCn1c(S)nc2cc(C(=O)N3CCc4cc(OC)c(Cl)cc4C3)ccc2c1=O	ZINC000819202364	IH	On-Demand	Anodyne	ABCB1B	61	38
CCOc1ccc(/C=C(\C#N)C(=O)N2CCc3cc(OC)c(Cl)cc3C2)cc1	ZINC000819202393	GI	On-Demand	Reactive	HDAC6	29	42
CCOc1ccc(/C=C(/C#N)C(=O)N2CCc3cc(OC)c(Cl)cc3C2)cc1	ZINC000819202396	GI	On-Demand	Reactive	HDAC6	29	42
O=C1C[C@H](NC[C@H](O)c2ccc(Cl)cc2)CN1c1c(F)cccc1F	ZINC000819202438	FG	On-Demand	Anodyne	ADRB3	19	45
O=C1C[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CN1c1c(F)cccc1F	ZINC000819202439	FG	On-Demand	Anodyne	ADRB3	19	45
O[C@H](CN[C@H]1CCO[C@]2(CCOC2)C1)c1cccc(Cl)c1	ZINC000819202449	DE	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CN[C@H]1CCO[C@]2(CCOC2)C1)c1cccc(Cl)c1	ZINC000819202449	DE	On-Demand	Anodyne	ADRB3	41	46
O[C@H](CN[C@H]1CCO[C@]2(CCOC2)C1)c1cccc(Cl)c1	ZINC000819202449	DE	On-Demand	Anodyne	CYP3A4	46	38
O[C@H](CN[C@@H]1CCO[C@]2(CCOC2)C1)c1cccc(Cl)c1	ZINC000819202450	DE	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CN[C@@H]1CCO[C@]2(CCOC2)C1)c1cccc(Cl)c1	ZINC000819202450	DE	On-Demand	Anodyne	ADRB3	41	46
O[C@H](CN[C@@H]1CCO[C@]2(CCOC2)C1)c1cccc(Cl)c1	ZINC000819202450	DE	On-Demand	Anodyne	CYP3A4	46	38
O[C@H](CN[C@@H]1CCO[C@@]2(CCOC2)C1)c1cccc(Cl)c1	ZINC000819202451	DE	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CN[C@@H]1CCO[C@@]2(CCOC2)C1)c1cccc(Cl)c1	ZINC000819202451	DE	On-Demand	Anodyne	ADRB3	41	46
O[C@H](CN[C@@H]1CCO[C@@]2(CCOC2)C1)c1cccc(Cl)c1	ZINC000819202451	DE	On-Demand	Anodyne	CYP3A4	46	38
O[C@H](CN[C@H]1CCO[C@@]2(CCOC2)C1)c1cccc(Cl)c1	ZINC000819202452	DE	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CN[C@H]1CCO[C@@]2(CCOC2)C1)c1cccc(Cl)c1	ZINC000819202452	DE	On-Demand	Anodyne	ADRB3	41	46
O[C@H](CN[C@H]1CCO[C@@]2(CCOC2)C1)c1cccc(Cl)c1	ZINC000819202452	DE	On-Demand	Anodyne	CYP3A4	46	38
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(C(=O)N2CCc3ccccc32)c1	ZINC000819202504	FH	On-Demand	Anodyne	AVPR2	74	45
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(C(=O)N2CCc3ccccc32)c1	ZINC000819202504	FH	On-Demand	Anodyne	AVPR1A	23	43
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(C(=O)N2CCc3ccccc32)c1	ZINC000819202505	FH	On-Demand	Anodyne	AVPR2	74	45
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(C(=O)N2CCc3ccccc32)c1	ZINC000819202505	FH	On-Demand	Anodyne	AVPR1A	23	43
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(C(=O)N2CCc3ccccc32)c1	ZINC000819202506	FH	On-Demand	Anodyne	AVPR2	74	45
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(C(=O)N2CCc3ccccc32)c1	ZINC000819202506	FH	On-Demand	Anodyne	AVPR1A	23	43
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(C(=O)N2CCc3ccccc32)c1	ZINC000819202507	FH	On-Demand	Anodyne	AVPR2	74	45
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(C(=O)N2CCc3ccccc32)c1	ZINC000819202507	FH	On-Demand	Anodyne	AVPR1A	23	43
COC[C@@H](C)NC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819202508	CE	On-Demand	Anodyne	ADRB2	15	47
COC[C@@H](C)NC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819202509	CE	On-Demand	Anodyne	ADRB2	15	47
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819202540	GF	On-Demand	Anodyne	CTSD	97	45
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819202540	GF	On-Demand	Anodyne	PGC	63	37
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819202540	GF	On-Demand	Anodyne	PAPA1_CARPA	29	40
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819202540	GF	On-Demand	Anodyne	CCKAR	17	40
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819202540	GF	On-Demand	Anodyne	BACE2	50	45
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819202540	GF	On-Demand	Anodyne	REN	81	46
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819202540	GF	On-Demand	Anodyne	REN1	19	43
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819202540	GF	On-Demand	Anodyne	BACE1	82	45
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819202540	GF	On-Demand	Anodyne	FPR1	49	39
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819202542	GF	On-Demand	Anodyne	CTSD	97	45
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819202542	GF	On-Demand	Anodyne	PGC	63	37
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819202542	GF	On-Demand	Anodyne	PAPA1_CARPA	29	40
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819202542	GF	On-Demand	Anodyne	CCKAR	17	40
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819202542	GF	On-Demand	Anodyne	BACE2	50	45
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819202542	GF	On-Demand	Anodyne	REN	81	46
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819202542	GF	On-Demand	Anodyne	REN1	19	43
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819202542	GF	On-Demand	Anodyne	BACE1	82	45
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819202542	GF	On-Demand	Anodyne	FPR1	49	39
O[C@@H](CNCCSCc1ccnc(Cl)c1)COc1ccccc1Cl	ZINC000819202568	GH	On-Demand	Anodyne	ADRB2	29	48
O[C@@H](CNCCSCc1ccnc(Cl)c1)COc1ccccc1Cl	ZINC000819202568	GH	On-Demand	Anodyne	ADRB1	47	34
O[C@H](CNCCSCc1ccnc(Cl)c1)COc1ccccc1Cl	ZINC000819202569	GH	On-Demand	Anodyne	ADRB2	29	48
O[C@H](CNCCSCc1ccnc(Cl)c1)COc1ccccc1Cl	ZINC000819202569	GH	On-Demand	Anodyne	ADRB1	47	34
O=C([C@@H]1CSCN1C(=O)/C=C/[C@@H]1CCCO1)N1CCCC1	ZINC000819202616	DD	On-Demand	Anodyne	PREP	35	42
O=C([C@@H]1CSCN1C(=O)/C=C\[C@@H]1CCCO1)N1CCCC1	ZINC000819202617	DD	On-Demand	Anodyne	PREP	35	42
O=C([C@@H]1CSCN1C(=O)/C=C/[C@H]1CCCO1)N1CCCC1	ZINC000819202618	DD	On-Demand	Anodyne	PREP	35	42
O=C([C@@H]1CSCN1C(=O)/C=C\[C@H]1CCCO1)N1CCCC1	ZINC000819202619	DD	On-Demand	Anodyne	PREP	35	42
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000819202637	FF	On-Demand	Anodyne	NAMPT	74	40
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000819202638	FF	On-Demand	Anodyne	NAMPT	74	40
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000819202639	FF	On-Demand	Anodyne	NAMPT	74	40
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000819202640	FF	On-Demand	Anodyne	NAMPT	74	40
Cc1ccc(OC[C@@H](O)CNCCSCc2ccnc(Cl)c2)cc1	ZINC000819202646	FG	On-Demand	Anodyne	ADRB2	41	44
Cc1ccc(OC[C@@H](O)CNCCSCc2ccnc(Cl)c2)cc1	ZINC000819202646	FG	On-Demand	Anodyne	ADRB1	59	42
Cc1ccc(OC[C@@H](O)CNCCSCc2ccnc(Cl)c2)cc1	ZINC000819202646	FG	On-Demand	Anodyne	GRIN1	19	42
Cc1ccc(OC[C@@H](O)CNCCSCc2ccnc(Cl)c2)cc1	ZINC000819202646	FG	On-Demand	Anodyne	ADRB3	37	42
Cc1ccc(OC[C@H](O)CNCCSCc2ccnc(Cl)c2)cc1	ZINC000819202648	FG	On-Demand	Anodyne	ADRB2	41	44
Cc1ccc(OC[C@H](O)CNCCSCc2ccnc(Cl)c2)cc1	ZINC000819202648	FG	On-Demand	Anodyne	ADRB1	59	42
Cc1ccc(OC[C@H](O)CNCCSCc2ccnc(Cl)c2)cc1	ZINC000819202648	FG	On-Demand	Anodyne	GRIN1	19	42
Cc1ccc(OC[C@H](O)CNCCSCc2ccnc(Cl)c2)cc1	ZINC000819202648	FG	On-Demand	Anodyne	ADRB3	37	42
O[C@@H](CNCCSCc1ccnc(Cl)c1)COc1ccccc1F	ZINC000819202650	FG	On-Demand	Anodyne	ADRB1	49	38
O[C@H](CNCCSCc1ccnc(Cl)c1)COc1ccccc1F	ZINC000819202651	FG	On-Demand	Anodyne	ADRB1	49	38
O[C@@H](CNCCSCc1ccnc(Cl)c1)COc1cccc2[nH]ccc12	ZINC000819202678	GG	On-Demand	Anodyne	ADRB1	31	51
O[C@H](CNCCSCc1ccnc(Cl)c1)COc1cccc2[nH]ccc12	ZINC000819202680	GG	On-Demand	Anodyne	ADRB1	31	51
C#Cc1ccccc1CC(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819202711	EG	On-Demand	Mild	ABCB1B	57	35
C#Cc1ccccc1CC(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819202711	EG	On-Demand	Mild	ABCB1	20	50
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)CCCc2ccccc2)CC1	ZINC000819202714	FE	On-Demand	Anodyne	PREP	65	47
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)CCCc2ccccc2)CC1	ZINC000819202714	FE	On-Demand	Anodyne	FAAH	20	42
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)CCCc2ccccc2)CC1	ZINC000819202716	FE	On-Demand	Anodyne	PREP	65	47
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)CCCc2ccccc2)CC1	ZINC000819202716	FE	On-Demand	Anodyne	FAAH	20	42
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)CCCc2ccccc2)CC1	ZINC000819202717	FE	On-Demand	Anodyne	PREP	65	47
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)CCCc2ccccc2)CC1	ZINC000819202717	FE	On-Demand	Anodyne	FAAH	20	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)CCCc2ccccc2)CC1	ZINC000819202718	FE	On-Demand	Anodyne	PREP	65	47
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)CCCc2ccccc2)CC1	ZINC000819202718	FE	On-Demand	Anodyne	FAAH	20	42
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202767	ED	On-Demand	Anodyne	HTR1A	38	43
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202767	ED	On-Demand	Anodyne	DRD2	32	40
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202767	ED	On-Demand	Anodyne	HTR2A	33	43
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202767	ED	On-Demand	Anodyne	ADRA1A	15	40
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202767	ED	On-Demand	Anodyne	DRD3	52	43
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202768	ED	On-Demand	Anodyne	HTR1A	38	43
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202768	ED	On-Demand	Anodyne	DRD2	32	40
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202768	ED	On-Demand	Anodyne	HTR2A	33	43
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202768	ED	On-Demand	Anodyne	ADRA1A	15	40
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202768	ED	On-Demand	Anodyne	DRD3	52	43
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202769	ED	On-Demand	Anodyne	HTR1A	38	43
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202769	ED	On-Demand	Anodyne	DRD2	32	40
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202769	ED	On-Demand	Anodyne	HTR2A	33	43
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202769	ED	On-Demand	Anodyne	ADRA1A	15	40
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202769	ED	On-Demand	Anodyne	DRD3	52	43
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202771	ED	On-Demand	Anodyne	HTR1A	38	43
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202771	ED	On-Demand	Anodyne	DRD2	32	40
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202771	ED	On-Demand	Anodyne	HTR2A	33	43
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202771	ED	On-Demand	Anodyne	ADRA1A	15	40
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2ccncc2)CC1	ZINC000819202771	ED	On-Demand	Anodyne	DRD3	52	43
O=C(C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1)Nc1cccnc1Cl	ZINC000819202821	HJ	On-Demand	Anodyne	GRM4	32	41
O=C(C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1)Nc1cccnc1Cl	ZINC000819202821	HJ	On-Demand	Anodyne	SMO	17	40
O=C(C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1)Nc1cccnc1Cl	ZINC000819202821	HJ	On-Demand	Anodyne	G2YM83_BOTF4	73	37
O=C(C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1)Nc1cccnc1Cl	ZINC000819202823	HJ	On-Demand	Anodyne	GRM4	32	41
O=C(C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1)Nc1cccnc1Cl	ZINC000819202823	HJ	On-Demand	Anodyne	SMO	17	40
O=C(C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1)Nc1cccnc1Cl	ZINC000819202823	HJ	On-Demand	Anodyne	G2YM83_BOTF4	73	37
O[C@@H](CNCCSCc1ccnc(Cl)c1)COc1ccc(F)cc1	ZINC000819202824	FG	On-Demand	Anodyne	ADRB2	37	42
O[C@@H](CNCCSCc1ccnc(Cl)c1)COc1ccc(F)cc1	ZINC000819202824	FG	On-Demand	Anodyne	ADRB1	63	42
O[C@@H](CNCCSCc1ccnc(Cl)c1)COc1ccc(F)cc1	ZINC000819202824	FG	On-Demand	Anodyne	GRIN1	15	44
O[C@@H](CNCCSCc1ccnc(Cl)c1)COc1ccc(F)cc1	ZINC000819202824	FG	On-Demand	Anodyne	ADRB3	38	42
O[C@H](CNCCSCc1ccnc(Cl)c1)COc1ccc(F)cc1	ZINC000819202825	FG	On-Demand	Anodyne	ADRB2	37	42
O[C@H](CNCCSCc1ccnc(Cl)c1)COc1ccc(F)cc1	ZINC000819202825	FG	On-Demand	Anodyne	ADRB1	63	42
O[C@H](CNCCSCc1ccnc(Cl)c1)COc1ccc(F)cc1	ZINC000819202825	FG	On-Demand	Anodyne	GRIN1	15	44
O[C@H](CNCCSCc1ccnc(Cl)c1)COc1ccc(F)cc1	ZINC000819202825	FG	On-Demand	Anodyne	ADRB3	38	42
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	ZINC000819202852	FH	On-Demand	Anodyne	AVPR2	124	53
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	ZINC000819202852	FH	On-Demand	Anodyne	AVPR1A	68	53
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	ZINC000819202853	FH	On-Demand	Anodyne	AVPR2	124	53
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	ZINC000819202853	FH	On-Demand	Anodyne	AVPR1A	68	53
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	ZINC000819202855	FH	On-Demand	Anodyne	AVPR2	124	53
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	ZINC000819202855	FH	On-Demand	Anodyne	AVPR1A	68	53
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	ZINC000819202856	FH	On-Demand	Anodyne	AVPR2	124	53
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)N2CCc3ccccc32)cc1	ZINC000819202856	FH	On-Demand	Anodyne	AVPR1A	68	53
N#Cc1ccc(OC[C@@H](O)CNCCSCc2ccnc(Cl)c2)cc1	ZINC000819202876	GF	On-Demand	Mild	ADRB2	30	40
N#Cc1ccc(OC[C@@H](O)CNCCSCc2ccnc(Cl)c2)cc1	ZINC000819202876	GF	On-Demand	Mild	ADRB1	57	40
N#Cc1ccc(OC[C@@H](O)CNCCSCc2ccnc(Cl)c2)cc1	ZINC000819202876	GF	On-Demand	Mild	ADRB3	33	40
N#Cc1ccc(OC[C@H](O)CNCCSCc2ccnc(Cl)c2)cc1	ZINC000819202877	GF	On-Demand	Mild	ADRB2	30	40
N#Cc1ccc(OC[C@H](O)CNCCSCc2ccnc(Cl)c2)cc1	ZINC000819202877	GF	On-Demand	Mild	ADRB1	57	40
N#Cc1ccc(OC[C@H](O)CNCCSCc2ccnc(Cl)c2)cc1	ZINC000819202877	GF	On-Demand	Mild	ADRB3	33	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(NC(=O)c2ccoc2)c1	ZINC000819202897	GG	On-Demand	Anodyne	KCNK3	106	52
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(NC(=O)c2ccoc2)c1	ZINC000819202897	GG	On-Demand	Anodyne	KCNK9	66	35
CN(C)CCOc1cccc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819202965	FE	On-Demand	Anodyne	EPHX2	19	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCC(=O)NCc1ccccc1	ZINC000819202974	FD	On-Demand	Anodyne	REN	28	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCC(=O)NCc1ccccc1	ZINC000819202974	FD	On-Demand	Anodyne	FPR1	43	37
CC(=O)Nc1cccc(CC(=O)N(C)C2CCCCCCC2)c1	ZINC000819203032	DH	On-Demand	Anodyne	OPRK1	16	43
O[C@@H](CNCCSCc1ccnc(Cl)c1)COc1ccccc1	ZINC000819203060	FF	On-Demand	Anodyne	ADRB2	45	45
O[C@@H](CNCCSCc1ccnc(Cl)c1)COc1ccccc1	ZINC000819203060	FF	On-Demand	Anodyne	ADRB1	70	47
O[C@@H](CNCCSCc1ccnc(Cl)c1)COc1ccccc1	ZINC000819203060	FF	On-Demand	Anodyne	ADRB3	48	47
O[C@H](CNCCSCc1ccnc(Cl)c1)COc1ccccc1	ZINC000819203061	FF	On-Demand	Anodyne	ADRB2	45	45
O[C@H](CNCCSCc1ccnc(Cl)c1)COc1ccccc1	ZINC000819203061	FF	On-Demand	Anodyne	ADRB1	70	47
O[C@H](CNCCSCc1ccnc(Cl)c1)COc1ccccc1	ZINC000819203061	FF	On-Demand	Anodyne	ADRB3	48	47
O=C(CSc1ccccc1C(=O)Nc1cccnc1Cl)NC12CC3CC(CC(C3)C1)C2	ZINC000819203081	JK	On-Demand	Anodyne	EPHX2	45	39
O=C(CSc1ccccc1C(=O)Nc1cccnc1Cl)NC12CC3CC(CC(C3)C1)C2	ZINC000819203081	JK	On-Demand	Anodyne	G2YM83_BOTF4	82	41
O[C@@H](CNCCSCc1ccnc(Cl)c1)c1cccnc1	ZINC000819203092	DF	On-Demand	Anodyne	ADRB2	24	44
O[C@@H](CNCCSCc1ccnc(Cl)c1)c1cccnc1	ZINC000819203092	DF	On-Demand	Anodyne	ADRB1	36	44
O[C@@H](CNCCSCc1ccnc(Cl)c1)c1cccnc1	ZINC000819203092	DF	On-Demand	Anodyne	ADRB3	105	45
O[C@H](CNCCSCc1ccnc(Cl)c1)c1cccnc1	ZINC000819203093	DF	On-Demand	Anodyne	ADRB2	24	44
O[C@H](CNCCSCc1ccnc(Cl)c1)c1cccnc1	ZINC000819203093	DF	On-Demand	Anodyne	ADRB1	36	44
O[C@H](CNCCSCc1ccnc(Cl)c1)c1cccnc1	ZINC000819203093	DF	On-Demand	Anodyne	ADRB3	105	45
O[C@@H](CNCCSCc1ccnc(Cl)c1)COc1ccc(Cl)cc1	ZINC000819203101	GH	On-Demand	Anodyne	ADRB2	35	43
O[C@@H](CNCCSCc1ccnc(Cl)c1)COc1ccc(Cl)cc1	ZINC000819203101	GH	On-Demand	Anodyne	ADRB1	60	43
O[C@@H](CNCCSCc1ccnc(Cl)c1)COc1ccc(Cl)cc1	ZINC000819203101	GH	On-Demand	Anodyne	GRIN1	17	45
O[C@@H](CNCCSCc1ccnc(Cl)c1)COc1ccc(Cl)cc1	ZINC000819203101	GH	On-Demand	Anodyne	ADRB3	38	43
O[C@H](CNCCSCc1ccnc(Cl)c1)COc1ccc(Cl)cc1	ZINC000819203103	GH	On-Demand	Anodyne	ADRB2	35	43
O[C@H](CNCCSCc1ccnc(Cl)c1)COc1ccc(Cl)cc1	ZINC000819203103	GH	On-Demand	Anodyne	ADRB1	60	43
O[C@H](CNCCSCc1ccnc(Cl)c1)COc1ccc(Cl)cc1	ZINC000819203103	GH	On-Demand	Anodyne	GRIN1	17	45
O[C@H](CNCCSCc1ccnc(Cl)c1)COc1ccc(Cl)cc1	ZINC000819203103	GH	On-Demand	Anodyne	ADRB3	38	43
O=C(COc1ccc(C(=O)Nc2cccnc2Cl)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819203130	IK	On-Demand	Anodyne	PPIA	19	42
O=C(COc1ccc(C(=O)Nc2cccnc2Cl)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819203130	IK	On-Demand	Anodyne	KIT	17	44
O=C(COc1ccc(C(=O)Nc2cccnc2Cl)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819203130	IK	On-Demand	Anodyne	LCK	33	43
O=C(COc1ccc(C(=O)Nc2cccnc2Cl)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819203130	IK	On-Demand	Anodyne	TRPV1	33	42
O=C(COc1ccc(C(=O)Nc2cccnc2Cl)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819203130	IK	On-Demand	Anodyne	UL80	17	41
O=C(COc1ccc(C(=O)Nc2cccnc2Cl)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819203130	IK	On-Demand	Anodyne	P2RY1	24	47
O=C(COc1ccc(C(=O)Nc2cccnc2Cl)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819203130	IK	On-Demand	Anodyne	RAF1	36	43
O=C(COc1ccc(C(=O)Nc2cccnc2Cl)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819203130	IK	On-Demand	Anodyne	FLT1	17	44
O=C(COc1ccc(C(=O)Nc2cccnc2Cl)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819203130	IK	On-Demand	Anodyne	KDR	31	45
O=C(COc1ccc(C(=O)Nc2cccnc2Cl)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819203130	IK	On-Demand	Anodyne	LYN	18	44
O=C(COc1ccc(C(=O)Nc2cccnc2Cl)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819203130	IK	On-Demand	Anodyne	CSF1R	15	46
O=C(COc1ccc(C(=O)Nc2cccnc2Cl)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819203130	IK	On-Demand	Anodyne	TEK	59	44
O=C(COc1ccc(C(=O)Nc2cccnc2Cl)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819203130	IK	On-Demand	Anodyne	MCHR1	22	43
O=C(COc1ccc(C(=O)Nc2cccnc2Cl)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819203130	IK	On-Demand	Anodyne	BRAF	48	44
O=C(COc1ccc(C(=O)Nc2cccnc2Cl)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819203130	IK	On-Demand	Anodyne	EPHB4	23	44
O=C(COc1ccc(C(=O)Nc2cccnc2Cl)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819203130	IK	On-Demand	Anodyne	RIPK1	41	34
O=C(COc1ccc(C(=O)Nc2cccnc2Cl)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819203130	IK	On-Demand	Anodyne	KCNK3	43	43
O=C(COc1ccc(C(=O)Nc2cccnc2Cl)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819203130	IK	On-Demand	Anodyne	G2YM83_BOTF4	66	34
O=C(COc1ccc(C(=O)Nc2cccnc2Cl)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819203130	IK	On-Demand	Anodyne	PDS	41	36
O=C(COc1ccccc1C(=O)Nc1cccnc1Cl)Nc1ccc(SC(F)F)cc1	ZINC000819203140	JK	On-Demand	Anodyne	G2YM83_BOTF4	72	38
C=CCC1(C(=O)Nc2ccc(N3CCC(C(N)=O)CC3)cc2)CCOCC1	ZINC000819203146	FF	On-Demand	Mild	STAT6	54	33
COc1cccc(C2=NO[C@H](C(=O)N3CCc4cc(OC)c(Cl)cc4C3)C2)c1	ZINC000819203147	HG	On-Demand	Anodyne	ABCB1	15	41
COc1cccc(C2=NO[C@H](C(=O)N3CCc4cc(OC)c(Cl)cc4C3)C2)c1	ZINC000819203147	HG	On-Demand	Anodyne	LUCI_PHOPY	27	42
COc1cccc(C2=NO[C@@H](C(=O)N3CCc4cc(OC)c(Cl)cc4C3)C2)c1	ZINC000819203150	HG	On-Demand	Anodyne	ABCB1	15	41
COc1cccc(C2=NO[C@@H](C(=O)N3CCc4cc(OC)c(Cl)cc4C3)C2)c1	ZINC000819203150	HG	On-Demand	Anodyne	LUCI_PHOPY	27	42
O=C(CCCc1ccccc1)N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819203211	EG	On-Demand	Anodyne	SIGMAR1	15	43
O=C(CCCc1ccccc1)N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819203211	EG	On-Demand	Anodyne	PREP	57	48
O=C(CCCc1ccccc1)N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819203211	EG	On-Demand	Anodyne	FAAH	21	41
CCOC(=O)N[C@H](C(=O)N1CCc2cc(OC)c(Cl)cc2C1)C(C)C	ZINC000819203231	FG	On-Demand	Anodyne	CCR1	40	33
CCOC(=O)N[C@@H](C(=O)N1CCc2cc(OC)c(Cl)cc2C1)C(C)C	ZINC000819203233	FG	On-Demand	Anodyne	CCR1	40	33
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCCCC1	ZINC000819203238	FI	On-Demand	Mild	PAPA1_CARPA	34	43
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCCCC1	ZINC000819203238	FI	On-Demand	Mild	CTSK	18	43
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(N2CCSCC2)c(Cl)c1	ZINC000819203257	FH	On-Demand	Anodyne	NPY2R	53	44
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(N2CCSCC2)c(Cl)c1	ZINC000819203258	FH	On-Demand	Anodyne	NPY2R	53	44
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(N2CCSCC2)c(Cl)c1	ZINC000819203260	FH	On-Demand	Anodyne	NPY2R	53	44
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(N2CCSCC2)c(Cl)c1	ZINC000819203261	FH	On-Demand	Anodyne	NPY2R	53	44
C=CCN(c1ccc(Cl)cc1)S(=O)(=O)c1cccc(C(=O)Nc2cccnc2Cl)c1	ZINC000819203296	JK	On-Demand	Mild	G2YM83_BOTF4	65	33
O[C@@H](CNCCSCc1ccnc(Cl)c1)c1ccccc1	ZINC000819203302	DG	On-Demand	Anodyne	ADRB2	17	41
O[C@@H](CNCCSCc1ccnc(Cl)c1)c1ccccc1	ZINC000819203302	DG	On-Demand	Anodyne	ADRB3	53	40
O[C@H](CNCCSCc1ccnc(Cl)c1)c1ccccc1	ZINC000819203303	DG	On-Demand	Anodyne	ADRB2	17	41
O[C@H](CNCCSCc1ccnc(Cl)c1)c1ccccc1	ZINC000819203303	DG	On-Demand	Anodyne	ADRB3	53	40
CN(c1cccc(Cl)c1)S(=O)(=O)c1cccc(C(=O)Nc2cccnc2Cl)c1	ZINC000819203307	II	On-Demand	Anodyne	LUCI_LUCLA	16	40
CN(c1cccc(Cl)c1)S(=O)(=O)c1cccc(C(=O)Nc2cccnc2Cl)c1	ZINC000819203307	II	On-Demand	Anodyne	G2YM83_BOTF4	71	40
O=C(CCCSc1ccc(Cl)cc1)Nc1cccnc1Cl	ZINC000819203318	EJ	On-Demand	Anodyne	G2YM83_BOTF4	67	35
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H]1CC(=O)NC1=O	ZINC000819203321	FC	On-Demand	Mild	PAPA1_CARPA	31	40
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H]1CC(=O)NC1=O	ZINC000819203322	FC	On-Demand	Mild	PAPA1_CARPA	31	40
CN(C)CCOc1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819203347	CF	On-Demand	Anodyne	EPHX2	18	40
Cn1nc(C(=O)Nc2cccnc2Cl)c2ccccc2c1=O	ZINC000819203348	DE	On-Demand	Anodyne	IMDH_CRYPV	27	43
Cn1nc(C(=O)Nc2cccnc2Cl)c2ccccc2c1=O	ZINC000819203348	DE	On-Demand	Anodyne	G2YM83_BOTF4	74	38
CN(C(=O)CSc1ccccc1C(=O)Nc1cccnc1Cl)C1CCCCC1	ZINC000819203363	HJ	On-Demand	Anodyne	G2YM83_BOTF4	84	43
O=C(CSc1ccccc1C(=O)Nc1cccnc1Cl)NC1CCCCCCC1	ZINC000819203371	IK	On-Demand	Anodyne	CNR1	25	44
O=C(CSc1ccccc1C(=O)Nc1cccnc1Cl)NC1CCCCCCC1	ZINC000819203371	IK	On-Demand	Anodyne	CNR2	25	44
O=C(CSc1ccccc1C(=O)Nc1cccnc1Cl)NC1CCCCCCC1	ZINC000819203371	IK	On-Demand	Anodyne	G2YM83_BOTF4	83	43
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203397	GH	On-Demand	Anodyne	PAPA1_CARPA	31	40
COc1ccc(CC(=O)Nc2cccnc2Cl)cc1S(=O)(=O)N1CCOCC1	ZINC000819203436	ID	On-Demand	Anodyne	CPT1A	64	39
COc1ccc(CC(=O)Nc2cccnc2Cl)cc1S(=O)(=O)N1CCOCC1	ZINC000819203436	ID	On-Demand	Anodyne	CPT1B	67	38
CC(C)(C)OC(=O)NCC1CCN(C(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819203469	GE	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)NCC1CCN(C(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819203469	GE	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)OC(=O)NCC1CCN(C(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819203469	GE	On-Demand	Anodyne	GPR119	28	41
C=CCC1(C(=O)Nc2ccc(N3CCSCC3)c(Cl)c2)CCOCC1	ZINC000819203474	GI	On-Demand	Mild	NPY2R	45	41
Cc1ccncc1[C@@H](C)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819203476	FG	On-Demand	Anodyne	GPR119	59	46
Cc1ccncc1[C@H](C)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819203478	FG	On-Demand	Anodyne	GPR119	59	46
Cc1ccncc1[C@@H](C)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819203480	FG	On-Demand	Anodyne	GPR119	59	46
Cc1ccncc1[C@H](C)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819203482	FG	On-Demand	Anodyne	GPR119	59	46
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCC(C(N)=O)CC3)cc2)c1	ZINC000819203483	GF	On-Demand	Anodyne	TSHR	52	30
Cc1ccc(NC(=O)CSc2ccccc2C(=O)Nc2cccnc2Cl)cc1	ZINC000819203485	HK	On-Demand	Anodyne	GRM4	51	40
Cc1ccc(NC(=O)CSc2ccccc2C(=O)Nc2cccnc2Cl)cc1	ZINC000819203485	HK	On-Demand	Anodyne	G2YM83_BOTF4	81	41
O=C1C[C@@H](NC[C@H](O)c2cccnc2)CN1c1c(F)cccc1F	ZINC000819203565	ED	On-Demand	Anodyne	ADRB3	65	46
O=C1C[C@@H](NC[C@@H](O)c2cccnc2)CN1c1c(F)cccc1F	ZINC000819203567	ED	On-Demand	Anodyne	ADRB3	65	46
O=C1C[C@H](NC[C@@H](O)c2cccnc2)CN1c1c(F)cccc1F	ZINC000819203568	ED	On-Demand	Anodyne	ADRB3	65	46
O=C1C[C@H](NC[C@H](O)c2cccnc2)CN1c1c(F)cccc1F	ZINC000819203569	ED	On-Demand	Anodyne	ADRB3	65	46
O=C(CSCc1nc2ccccc2[nH]1)Nc1cccnc1Cl	ZINC000819203620	EG	On-Demand	Anodyne	STK33	37	41
CC(C)(C)OC(=O)NCC1CCN(C(=O)Cc2nsc3ccccc23)CC1	ZINC000819203697	GH	On-Demand	Anodyne	DRD2	18	44
CC(C)(C)OC(=O)NCC1CCN(C(=O)Cc2nsc3ccccc23)CC1	ZINC000819203697	GH	On-Demand	Anodyne	ACACB	18	47
NC(=O)C1CCN(c2ccccc2NC(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819203700	EE	On-Demand	Anodyne	KCNQ2	72	39
CCOC(=O)N1CCC(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)CC1	ZINC000819203703	GG	On-Demand	Anodyne	HTR4	54	42
NC(=O)C1CCN(c2ccccc2NC(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819203704	EE	On-Demand	Anodyne	KCNQ2	72	39
NC(=O)C1CCN(c2ccccc2NC(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819203707	EE	On-Demand	Anodyne	KCNQ2	72	39
NC(=O)C1CCN(c2ccccc2NC(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819203710	EE	On-Demand	Anodyne	KCNQ2	72	39
C=CCNS(=O)(=O)c1cc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)ccc1F	ZINC000819203779	IG	On-Demand	Mild	CPT1A	57	37
C=CCNS(=O)(=O)c1cc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)ccc1F	ZINC000819203779	IG	On-Demand	Mild	CPT2	44	37
C=CCNS(=O)(=O)c1cc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)ccc1F	ZINC000819203779	IG	On-Demand	Mild	HDAC6	36	43
C=CCNS(=O)(=O)c1cc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)ccc1F	ZINC000819203779	IG	On-Demand	Mild	CPT1B	42	37
O=C(CSc1ccccc1C(=O)Nc1cccnc1Cl)Nc1ccc2c(c1)OCO2	ZINC000819203836	II	On-Demand	Anodyne	GRM4	44	51
O=C(CSc1ccccc1C(=O)Nc1cccnc1Cl)Nc1ccc2c(c1)OCO2	ZINC000819203836	II	On-Demand	Anodyne	G2YM83_BOTF4	75	38
CCOC(=O)N1CCC[C@H](C(=O)N2CCc3cc(OC)c(Cl)cc3C2)C1	ZINC000819203846	GG	On-Demand	Anodyne	HTR4	46	38
CCOC(=O)N1CCC[C@@H](C(=O)N2CCc3cc(OC)c(Cl)cc3C2)C1	ZINC000819203848	GG	On-Demand	Anodyne	HTR4	46	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	GHRHR	47	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	P2RY12	109	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	CTRA_BOVIN	50	32
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	KLK3	79	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	CTSB	58	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	PAPA1_CARPA	60	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	CYSP_TRYCR	54	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	CTSG	40	32
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	CTSK	40	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	CTSL	48	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	ABCB1B	42	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	CAPNS1	58	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	CELA2A	49	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	MMP11	46	31
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	CTSS	23	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	CAPN1	84	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	CAPN2	126	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	TGM2	24	47
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	HCRTR2	15	58
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203893	IH	On-Demand	Anodyne	NPR	54	32
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	GHRHR	47	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	P2RY12	109	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	CTRA_BOVIN	50	32
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	KLK3	79	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	CTSB	58	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	PAPA1_CARPA	60	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	CYSP_TRYCR	54	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	CTSG	40	32
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	CTSK	40	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	CTSL	48	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	ABCB1B	42	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	CAPNS1	58	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	CELA2A	49	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	MMP11	46	31
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	CTSS	23	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	CAPN1	84	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	CAPN2	126	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	TGM2	24	47
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	HCRTR2	15	58
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819203894	IH	On-Demand	Anodyne	NPR	54	32
C=CCn1c(S)nc2cc(C(=O)N3CCc4cc(OC)c(Cl)cc4C3)ccc2c1=O	ZINC000819203903	IH	On-Demand	Mild	ABCB1B	44	36
O=C([C@H]1CSCN1C(=O)C(F)=C1CCC1)N1CCCC1	ZINC000819203904	CD	On-Demand	Anodyne	PREP	40	47
O=C([C@@H]1CSCN1C(=O)C(F)=C1CCC1)N1CCCC1	ZINC000819203905	CD	On-Demand	Anodyne	PREP	40	47
CC(C)(C)OC(=O)NCC1CCN(C(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819203914	GG	On-Demand	Anodyne	HTR4	43	41
CC(C)(C)OC(=O)NCC1CCN(C(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819203914	GG	On-Demand	Anodyne	ACACB	22	47
CC(C)(C)OC(=O)NCC1CCN(C(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819203914	GG	On-Demand	Anodyne	CACNA1I	42	32
CC(=O)Nc1cccc(CC(=O)N2CCC(CNC(=O)OC(C)(C)C)CC2)c1	ZINC000819203935	GF	On-Demand	Anodyne	CCR3	53	39
CC(=O)Nc1cccc(CC(=O)N2CCC(CNC(=O)OC(C)(C)C)CC2)c1	ZINC000819203935	GF	On-Demand	Anodyne	ACACB	17	41
CC(=O)Nc1cccc(CC(=O)N2CCC(CNC(=O)OC(C)(C)C)CC2)c1	ZINC000819203935	GF	On-Demand	Anodyne	ST14	43	36
CC(=O)Nc1cccc(CC(=O)N2CCC(CNC(=O)OC(C)(C)C)CC2)c1	ZINC000819203935	GF	On-Demand	Anodyne	CACNA1I	60	38
CC(=O)Nc1cccc(CC(=O)N2CCC(CNC(=O)OC(C)(C)C)CC2)c1	ZINC000819203935	GF	On-Demand	Anodyne	GPR119	24	42
Cc1ccncc1[C@H](C)NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819203951	FG	On-Demand	Anodyne	GPR119	25	41
Cc1ccncc1[C@H](C)NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819203952	FG	On-Demand	Anodyne	GPR119	25	41
Cc1ccncc1[C@@H](C)NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819203953	FG	On-Demand	Anodyne	GPR119	25	41
Cc1ccncc1[C@@H](C)NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819203954	FG	On-Demand	Anodyne	GPR119	25	41
Cn1c2ccccc2c2cc(C(=O)Nc3cccnc3Cl)sc21	ZINC000819203963	EJ	On-Demand	Anodyne	G2YM83_BOTF4	70	36
COc1ccc(-c2nnc(S)n2CC(=O)N2CCc3cc(OC)c(Cl)cc3C2)cc1	ZINC000819203987	IG	On-Demand	Anodyne	ABCB1B	65	43
COc1ccc(-c2nnc(S)n2CC(=O)N2CCc3cc(OC)c(Cl)cc3C2)cc1	ZINC000819203987	IG	On-Demand	Anodyne	ABCB1	21	55
CO[C@@H](c1ccc(F)cc1)[C@H](C)NC[C@H](O)c1ccccc1	ZINC000819204035	DG	On-Demand	Anodyne	ADRB2	23	41
CO[C@@H](c1ccc(F)cc1)[C@H](C)NC[C@H](O)c1ccccc1	ZINC000819204035	DG	On-Demand	Anodyne	AOC3	15	40
CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819204036	DG	On-Demand	Anodyne	ADRB2	23	41
CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819204036	DG	On-Demand	Anodyne	AOC3	15	40
CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819204038	DG	On-Demand	Anodyne	ADRB2	23	41
CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819204038	DG	On-Demand	Anodyne	AOC3	15	40
CO[C@@H](c1ccc(F)cc1)[C@H](C)NC[C@@H](O)c1ccccc1	ZINC000819204041	DG	On-Demand	Anodyne	ADRB2	23	41
CO[C@@H](c1ccc(F)cc1)[C@H](C)NC[C@@H](O)c1ccccc1	ZINC000819204041	DG	On-Demand	Anodyne	AOC3	15	40
CCn1c(=O)c2ccccc2n(CC(=O)N2CCc3cc(OC)c(Cl)cc3C2)c1=O	ZINC000819204056	IE	On-Demand	Anodyne	FABI	47	35
CCn1c(=O)c2ccccc2n(CC(=O)N2CCc3cc(OC)c(Cl)cc3C2)c1=O	ZINC000819204056	IE	On-Demand	Anodyne	ABCB1B	66	41
CCn1c(=O)c2ccccc2n(CC(=O)N2CCc3cc(OC)c(Cl)cc3C2)c1=O	ZINC000819204056	IE	On-Demand	Anodyne	ABCB1	15	41
COc1ccc2c(C)c(CCC(=O)N3CCc4cc(OC)c(Cl)cc4C3)c(=O)oc2c1	ZINC000819204067	II	On-Demand	Anodyne	MAOB	26	41
COc1ccc2c(C)c(CCC(=O)N3CCc4cc(OC)c(Cl)cc4C3)c(=O)oc2c1	ZINC000819204067	II	On-Demand	Anodyne	NQO1	20	40
CO/C(=C\c1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819204116	FH	On-Demand	Anodyne	ABCB1B	42	35
CO/C(=C\c1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819204116	FH	On-Demand	Anodyne	HDAC6	41	47
CO/C(=C\c1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819204116	FH	On-Demand	Anodyne	ABCB1	18	43
CO/C(=C/c1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819204117	FH	On-Demand	Anodyne	ABCB1B	42	35
CO/C(=C/c1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819204117	FH	On-Demand	Anodyne	HDAC6	41	47
CO/C(=C/c1ccccc1)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819204117	FH	On-Demand	Anodyne	ABCB1	18	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCNC(=O)Cc1cccc(F)c1	ZINC000819204177	GD	On-Demand	Anodyne	PAPA1_CARPA	23	45
CS(=O)(=O)c1ccc([C@@H](O)CNCC2(Cc3ccc(F)cc3)CC2)cc1	ZINC000819204220	GF	On-Demand	Anodyne	PTGS2	26	41
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1cc(F)ccc1F	ZINC000819204227	EG	On-Demand	Anodyne	LEF	62	34
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1cc(F)ccc1F	ZINC000819204228	EG	On-Demand	Anodyne	LEF	62	34
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)c1cccnc1	ZINC000819204236	CD	On-Demand	Anodyne	ADRB3	83	41
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)c1cccnc1	ZINC000819204237	CD	On-Demand	Anodyne	ADRB3	83	41
O[C@H](CNC[C@H]1COC2(CCCC2)O1)c1cccnc1	ZINC000819204238	CD	On-Demand	Anodyne	ADRB3	83	41
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)c1cccnc1	ZINC000819204239	CD	On-Demand	Anodyne	ADRB3	83	41
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccc(Cl)c(Cl)c1	ZINC000819204244	GG	On-Demand	Anodyne	GRIN1	22	42
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccc(Cl)c(Cl)c1	ZINC000819204245	GG	On-Demand	Anodyne	GRIN1	22	42
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccc(Cl)c(Cl)c1	ZINC000819204246	GG	On-Demand	Anodyne	GRIN1	22	42
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccc(Cl)c(Cl)c1	ZINC000819204247	GG	On-Demand	Anodyne	GRIN1	22	42
CC[C@@H](C)c1ccccc1N1C[C@@H](C(=O)Nc2cccnc2Cl)CC1=O	ZINC000819204249	FI	On-Demand	Anodyne	KCNQ2	62	36
CC[C@@H](C)c1ccccc1N1C[C@@H](C(=O)Nc2cccnc2Cl)CC1=O	ZINC000819204249	FI	On-Demand	Anodyne	G2YM83_BOTF4	65	35
CC[C@@H](C)c1ccccc1N1C[C@H](C(=O)Nc2cccnc2Cl)CC1=O	ZINC000819204251	FI	On-Demand	Anodyne	KCNQ2	62	36
CC[C@@H](C)c1ccccc1N1C[C@H](C(=O)Nc2cccnc2Cl)CC1=O	ZINC000819204251	FI	On-Demand	Anodyne	G2YM83_BOTF4	65	35
CC[C@@H](O)CNCCOc1ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc1	ZINC000819204283	GC	On-Demand	Anodyne	ADRB2	32	45
CC[C@@H](O)CNCCOc1ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc1	ZINC000819204283	GC	On-Demand	Anodyne	ADRB1	55	45
CC[C@@H](O)CNCCOc1ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc1	ZINC000819204283	GC	On-Demand	Anodyne	GRIN1	23	44
CC[C@@H](O)CNCCOc1ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc1	ZINC000819204283	GC	On-Demand	Anodyne	ADRB3	38	45
CC[C@H](O)CNCCOc1ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc1	ZINC000819204284	GC	On-Demand	Anodyne	ADRB2	32	45
CC[C@H](O)CNCCOc1ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc1	ZINC000819204284	GC	On-Demand	Anodyne	ADRB1	55	45
CC[C@H](O)CNCCOc1ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc1	ZINC000819204284	GC	On-Demand	Anodyne	GRIN1	23	44
CC[C@H](O)CNCCOc1ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc1	ZINC000819204284	GC	On-Demand	Anodyne	ADRB3	38	45
CS(=O)(=O)c1ccc([C@H](O)CNCC2(Cc3ccc(F)cc3)CC2)cc1	ZINC000819204321	GF	On-Demand	Anodyne	PTGS2	26	41
C=CCCn1cc(C(=O)Nc2ccc(N3CCSCC3)c(Cl)c2)nn1	ZINC000819204334	GG	On-Demand	Mild	NPY2R	41	37
O=C(N[C@H](C(=O)O)c1ccccc1)c1ccc2nc(O)oc2c1	ZINC000819204427	DE	On-Demand	Anodyne	MTTP	63	38
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819204432	DF	On-Demand	Anodyne	ACE	50	46
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819204432	DF	On-Demand	Anodyne	MME	123	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819204432	DF	On-Demand	Anodyne	ANPEP	66	39
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819204432	DF	On-Demand	Anodyne	FCER2	48	32
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819204432	DF	On-Demand	Anodyne	CCKAR	15	54
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819204432	DF	On-Demand	Anodyne	CPA1	55	41
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819204432	DF	On-Demand	Anodyne	CYP51A1	23	47
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819204432	DF	On-Demand	Anodyne	PYGL	32	54
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819204432	DF	On-Demand	Anodyne	ITGA4	18	40
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819204432	DF	On-Demand	Anodyne	NAALAD2	25	42
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819204432	DF	On-Demand	Anodyne	ECE1	54	43
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819204432	DF	On-Demand	Anodyne	CAPN1	31	47
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819204432	DF	On-Demand	Anodyne	ACE2	95	42
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819204432	DF	On-Demand	Anodyne	PIN1	60	39
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819204432	DF	On-Demand	Anodyne	FPR1	65	39
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819204432	DF	On-Demand	Anodyne	BLA1_STEMA	91	55
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cc2ccsc2[nH]1	ZINC000819204432	DF	On-Demand	Anodyne	BRCA1	43	30
O=C(N[C@H](C(=O)O)c1ccccc1)c1ccc(CS(=O)(=O)C(F)F)cc1	ZINC000819204434	GE	On-Demand	Anodyne	CA2	17	60
O=C(N[C@H](C(=O)O)c1ccccc1)c1ccc(CS(=O)(=O)C(F)F)cc1	ZINC000819204434	GE	On-Demand	Anodyne	MTTP	74	41
O=C(N[C@H](C(=O)O)c1ccccc1)c1ccc2nc(O)[nH]c2c1	ZINC000819204437	DD	On-Demand	Anodyne	TYMS	24	42
O=C(N[C@H](C(=O)O)c1ccccc1)c1ccc2nc(O)[nH]c2c1	ZINC000819204437	DD	On-Demand	Anodyne	FPGS	43	32
O=C(N[C@H](C(=O)O)c1ccccc1)c1ccc2nc(O)[nH]c2c1	ZINC000819204437	DD	On-Demand	Anodyne	MTTP	64	38
O=C(N[C@H](C(=O)O)c1ccccc1)c1ccc2nc(O)[nH]c2c1	ZINC000819204437	DD	On-Demand	Anodyne	F7	41	39
O=C(N[C@H](C(=O)O)c1ccccc1)c1ccc2nc(O)[nH]c2c1	ZINC000819204437	DD	On-Demand	Anodyne	PIN1	35	45
O=C(N[C@H](C(=O)O)c1ccccc1)c1ccc2c(c1)nc(O)n2CC(F)(F)F	ZINC000819204446	GF	On-Demand	Anodyne	MTTP	85	35
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	ACE	92	51
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	OPRM1	23	42
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	FOLH1	18	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	MME	179	54
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	ANPEP	91	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	FCER2	55	34
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	CTSB	40	46
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	PAPA1_CARPA	43	42
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	CYSP_TRYCR	52	39
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	CTSL	40	54
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	CPA1	72	47
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	NPFFR2	49	36
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	TIMP3	70	35
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	ITGA4	39	43
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	NAALAD2	34	49
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	CAPNS1	57	37
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	ECE1	65	45
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	CTSS	17	42
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	CAPN1	68	55
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	MMP9	20	42
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	ACE2	115	47
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	CTSV	27	54
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	PIN1	47	39
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	MMP1	26	41
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	FPR1	83	46
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	NPPA	49	39
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	BLA1_STEMA	88	43
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	BRCA1	55	34
O=C(N[C@H](Cc1ccccc1)C(=O)O)C1=CCCC1	ZINC000819204454	CD	On-Demand	Anodyne	NPFFR1	58	36
Cc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819204456	DE	On-Demand	Anodyne	ADRB2	32	48
Cc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819204456	DE	On-Demand	Anodyne	ADRB1	43	40
O=C(N[C@H](C(=O)O)c1ccccc1)c1ccc(N2CCOCC2)nc1	ZINC000819204457	ED	On-Demand	Anodyne	HDAC1	19	42
O=C(N[C@H](C(=O)O)c1ccccc1)c1ccc(N2CCOCC2)nc1	ZINC000819204457	ED	On-Demand	Anodyne	MTTP	25	48
O=C(N[C@H](C(=O)O)c1ccccc1)c1ccc(N2CCOCC2)nc1	ZINC000819204457	ED	On-Demand	Anodyne	DGAT1	34	45
O=C(N[C@H](C(=O)O)c1ccccc1)c1ccc(N2CCOCC2)nc1	ZINC000819204457	ED	On-Demand	Anodyne	HPGDS	33	48
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	ACE	90	48
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	OPRM1	35	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	OPRD1	32	41
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	MME	156	54
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	ANPEP	71	39
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	TACR1	15	42
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	FCER2	55	34
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	CTSB	31	43
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	CPA1	62	46
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	NPFFR2	48	36
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	TIMP3	82	38
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	ITGA4	78	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	NAALAD2	32	46
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	CAPNS1	58	35
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	ECE1	69	46
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	CAPN1	84	45
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	MMP9	15	42
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	ACE2	103	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	FPR1	83	43
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	NPPA	65	40
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	XIAP	23	42
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	BLA1_STEMA	77	41
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	BRCA1	55	34
O=C(N[C@H](Cc1ccccc1)C(=O)O)[C@H]1CC12CCC2	ZINC000819204459	CD	On-Demand	Anodyne	NPFFR1	40	36
Cc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819204460	DE	On-Demand	Anodyne	ADRB2	32	48
Cc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819204460	DE	On-Demand	Anodyne	ADRB1	43	40
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	ACE	90	48
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	OPRM1	35	44
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	OPRD1	32	41
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	MME	156	54
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	ANPEP	71	39
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	TACR1	15	42
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	FCER2	55	34
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	CTSB	31	43
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	CPA1	62	46
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	NPFFR2	48	36
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	TIMP3	82	38
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	ITGA4	78	44
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	NAALAD2	32	46
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	CAPNS1	58	35
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	ECE1	69	46
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	CAPN1	84	45
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	MMP9	15	42
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	ACE2	103	44
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	FPR1	83	43
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	NPPA	65	40
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	XIAP	23	42
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	BLA1_STEMA	77	41
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	BRCA1	55	34
O=C(O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1CC12CCC2	ZINC000819204465	CD	On-Demand	Anodyne	NPFFR1	40	36
Cc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819204466	DE	On-Demand	Anodyne	ADRB2	32	48
Cc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819204466	DE	On-Demand	Anodyne	ADRB1	43	40
O=C(N[C@H](C(=O)O)c1ccccc1)c1cccc(CN2C(=O)CSC2=O)c1	ZINC000819204470	GE	On-Demand	Anodyne	MTTP	42	31
Cc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819204471	DE	On-Demand	Anodyne	ADRB2	32	48
Cc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819204471	DE	On-Demand	Anodyne	ADRB1	43	40
O=C(N[C@H](C(=O)O)c1ccccc1)c1cc[n+]([O-])cc1	ZINC000819204475	CC	On-Demand	Anodyne	NAALAD2	19	41
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819204476	ED	On-Demand	Anodyne	ADRB2	29	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819204476	ED	On-Demand	Anodyne	ADRB1	53	39
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819204480	ED	On-Demand	Anodyne	ADRB2	29	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819204480	ED	On-Demand	Anodyne	ADRB1	53	39
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819204484	ED	On-Demand	Anodyne	ADRB2	29	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819204484	ED	On-Demand	Anodyne	ADRB1	53	39
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819204489	ED	On-Demand	Anodyne	ADRB2	29	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819204489	ED	On-Demand	Anodyne	ADRB1	53	39
O=C(N[C@H](C(=O)O)c1ccccc1)c1ccc2c(=O)n3c(nc2c1)CCC3	ZINC000819204491	FD	On-Demand	Anodyne	MTTP	49	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1(c3ccc(F)cc3)CCC1)C2	ZINC000819204495	FG	On-Demand	Anodyne	CACNA1G	15	46
NC(=O)C1CCN(c2ccc(NC(=O)c3cc4c(cn3)OCCO4)cc2)CC1	ZINC000819204497	GD	On-Demand	Anodyne	STAT6	53	33
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819204498	FF	On-Demand	Bother	ACE	44	46
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819204498	FF	On-Demand	Bother	GABRA1	16	50
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819204498	FF	On-Demand	Bother	MME	93	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819204498	FF	On-Demand	Bother	ANPEP	41	36
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819204498	FF	On-Demand	Bother	CCKAR	20	45
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819204498	FF	On-Demand	Bother	CPA1	40	37
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819204498	FF	On-Demand	Bother	ECE1	65	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819204498	FF	On-Demand	Bother	GABRA5	15	50
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819204498	FF	On-Demand	Bother	CAPN1	19	42
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819204498	FF	On-Demand	Bother	ACE2	61	38
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819204498	FF	On-Demand	Bother	GABRA2	15	50
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819204498	FF	On-Demand	Bother	FPR1	52	37
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819204498	FF	On-Demand	Bother	F2RL3	44	31
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819204498	FF	On-Demand	Bother	BLA1_STEMA	83	46
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819204498	FF	On-Demand	Bother	KISS1R	54	39
CN(C(=O)Cc1ccc(-n2cnnc2)cc1)C1CCCCCCC1	ZINC000819204501	EG	On-Demand	Anodyne	CCR5	19	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1(c3ccc(F)cc3)CCC1)C2	ZINC000819204502	FG	On-Demand	Anodyne	CACNA1G	15	46
O=C(N[C@H](C(=O)O)c1ccccc1)c1cnc2ccccn12	ZINC000819204509	CD	On-Demand	Anodyne	NAALAD2	20	42
O=C(N[C@H](C(=O)O)c1ccccc1)c1cnc2ccccn12	ZINC000819204509	CD	On-Demand	Anodyne	EPHB3	24	53
O=C(N[C@H](C(=O)O)c1ccccc1)c1ccc(=O)n(-c2cccc(F)c2)c1	ZINC000819204516	FF	On-Demand	Anodyne	MTTP	73	34
O=C(N[C@H](C(=O)O)c1ccccc1)c1ccc(=O)n(-c2cccc(F)c2)c1	ZINC000819204516	FF	On-Demand	Anodyne	AMP1_PLAFQ	34	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CSC[C@H]1C(=O)N1CCCC1)C2	ZINC000819204568	GD	On-Demand	Anodyne	PREP	32	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CSC[C@@H]1C(=O)N1CCCC1)C2	ZINC000819204571	GD	On-Demand	Anodyne	PREP	32	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CSC[C@H]1C(=O)N1CCCC1)C2	ZINC000819204573	GD	On-Demand	Anodyne	PREP	32	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CSC[C@@H]1C(=O)N1CCCC1)C2	ZINC000819204575	GD	On-Demand	Anodyne	PREP	32	47
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1ccc(F)cc1	ZINC000819204578	DF	On-Demand	Anodyne	ADRB2	35	40
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1ccc(F)cc1	ZINC000819204578	DF	On-Demand	Anodyne	LEF	69	40
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1ccc(F)cc1	ZINC000819204580	DF	On-Demand	Anodyne	ADRB2	35	40
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1ccc(F)cc1	ZINC000819204580	DF	On-Demand	Anodyne	LEF	69	40
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccccc1F	ZINC000819204627	ED	On-Demand	Anodyne	ADRB2	16	40
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccccc1F	ZINC000819204627	ED	On-Demand	Anodyne	ADRA1B	15	40
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccccc1F	ZINC000819204628	ED	On-Demand	Anodyne	ADRB2	16	40
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccccc1F	ZINC000819204628	ED	On-Demand	Anodyne	ADRA1B	15	40
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccccc1F	ZINC000819204629	ED	On-Demand	Anodyne	ADRB2	16	40
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccccc1F	ZINC000819204629	ED	On-Demand	Anodyne	ADRA1B	15	40
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccccc1F	ZINC000819204630	ED	On-Demand	Anodyne	ADRB2	16	40
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccccc1F	ZINC000819204630	ED	On-Demand	Anodyne	ADRA1B	15	40
CC(C)(C)OC(=O)NCC1CCN(C(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819204676	GF	On-Demand	Anodyne	ACACB	15	40
CC(C)(C)OC(=O)NCC1CCN(C(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819204676	GF	On-Demand	Anodyne	CACNA1I	42	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(NC(=O)c3ccoc3)c1)C2	ZINC000819204677	GG	On-Demand	Anodyne	KCNK3	95	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(NC(=O)c3ccoc3)c1)C2	ZINC000819204677	GG	On-Demand	Anodyne	KCNK9	51	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(NC(=O)c3ccoc3)c1)C2	ZINC000819204678	GG	On-Demand	Anodyne	KCNK3	95	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(NC(=O)c3ccoc3)c1)C2	ZINC000819204678	GG	On-Demand	Anodyne	KCNK9	51	33
Cn1nnnc1CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819204711	FC	On-Demand	Anodyne	GPR119	29	43
Cn1nnnc1CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819204713	FC	On-Demand	Anodyne	GPR119	29	43
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1c1c(F)cccc1F	ZINC000819204716	FG	On-Demand	Anodyne	ADRB1	29	43
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1c1c(F)cccc1F	ZINC000819204716	FG	On-Demand	Anodyne	ADRB3	47	47
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1c1c(F)cccc1F	ZINC000819204716	FG	On-Demand	Anodyne	CYP3A4	47	36
O=C1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CN1c1c(F)cccc1F	ZINC000819204718	FG	On-Demand	Anodyne	ADRB1	29	43
O=C1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CN1c1c(F)cccc1F	ZINC000819204718	FG	On-Demand	Anodyne	ADRB3	47	47
O=C1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CN1c1c(F)cccc1F	ZINC000819204718	FG	On-Demand	Anodyne	CYP3A4	47	36
O=C1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CN1c1c(F)cccc1F	ZINC000819204720	FG	On-Demand	Anodyne	ADRB1	29	43
O=C1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CN1c1c(F)cccc1F	ZINC000819204720	FG	On-Demand	Anodyne	ADRB3	47	47
O=C1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CN1c1c(F)cccc1F	ZINC000819204720	FG	On-Demand	Anodyne	CYP3A4	47	36
O=C1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CN1c1c(F)cccc1F	ZINC000819204722	FG	On-Demand	Anodyne	ADRB1	29	43
O=C1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CN1c1c(F)cccc1F	ZINC000819204722	FG	On-Demand	Anodyne	ADRB3	47	47
O=C1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CN1c1c(F)cccc1F	ZINC000819204722	FG	On-Demand	Anodyne	CYP3A4	47	36
CC[C@H](C(=O)N1CCC(NC(=O)/C=C/[C@@H]2CCCO2)CC1)c1ccccc1	ZINC000819204723	FG	On-Demand	Anodyne	EPHX2	18	40
CC[C@H](C(=O)N1CCC(NC(=O)/C=C\[C@H]2CCCO2)CC1)c1ccccc1	ZINC000819204725	FG	On-Demand	Anodyne	EPHX2	18	40
CC[C@H](C(=O)N1CCC(NC(=O)/C=C/[C@H]2CCCO2)CC1)c1ccccc1	ZINC000819204727	FG	On-Demand	Anodyne	EPHX2	18	40
CC[C@H](C(=O)N1CCC(NC(=O)/C=C\[C@@H]2CCCO2)CC1)c1ccccc1	ZINC000819204729	FG	On-Demand	Anodyne	EPHX2	18	40
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1	ZINC000819204743	GG	On-Demand	Anodyne	AVPR2	48	45
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1	ZINC000819204746	GG	On-Demand	Anodyne	AVPR2	48	45
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1	ZINC000819204747	GG	On-Demand	Anodyne	AVPR2	48	45
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1	ZINC000819204749	GG	On-Demand	Anodyne	AVPR2	48	45
CC(C)(C)OC(=O)NCC1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819204750	GF	On-Demand	Anodyne	HTR1B	21	42
CC(C)(C)OC(=O)NCC1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819204750	GF	On-Demand	Anodyne	ACACB	15	40
CC(C)(C)OC(=O)NCC1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819204750	GF	On-Demand	Anodyne	CACNA1I	51	43
CC(C)(C)OC(=O)NCC1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819204750	GF	On-Demand	Anodyne	GPR119	33	44
CC(C)(C)OC(=O)NCC1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819204750	GF	On-Demand	Anodyne	KCNJ1	49	36
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccccc1Cl	ZINC000819204813	EE	On-Demand	Anodyne	ADRB2	19	44
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccccc1Cl	ZINC000819204813	EE	On-Demand	Anodyne	ADRA1B	15	40
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccccc1Cl	ZINC000819204814	EE	On-Demand	Anodyne	ADRB2	19	44
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccccc1Cl	ZINC000819204814	EE	On-Demand	Anodyne	ADRA1B	15	40
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccccc1Cl	ZINC000819204815	EE	On-Demand	Anodyne	ADRB2	19	44
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccccc1Cl	ZINC000819204815	EE	On-Demand	Anodyne	ADRA1B	15	40
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccccc1Cl	ZINC000819204816	EE	On-Demand	Anodyne	ADRB2	19	44
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccccc1Cl	ZINC000819204816	EE	On-Demand	Anodyne	ADRA1B	15	40
CCOc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819204846	FE	On-Demand	Anodyne	ADRB2	31	40
CCOc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819204846	FE	On-Demand	Anodyne	ADRB1	45	39
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819204848	FE	On-Demand	Anodyne	ADRB2	31	40
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819204848	FE	On-Demand	Anodyne	ADRB1	45	39
CCOc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819204850	FE	On-Demand	Anodyne	ADRB2	31	40
CCOc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819204850	FE	On-Demand	Anodyne	ADRB1	45	39
CCOc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819204852	FE	On-Demand	Anodyne	ADRB2	31	40
CCOc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819204852	FE	On-Demand	Anodyne	ADRB1	45	39
CS(=O)(=O)c1ccc([C@@H](O)CNCC2CCN(c3ccncc3)CC2)cc1	ZINC000819204853	GE	On-Demand	Anodyne	ADRB3	33	45
CS(=O)(=O)c1ccc([C@@H](O)CNCC2CCN(c3ccncc3)CC2)cc1	ZINC000819204853	GE	On-Demand	Anodyne	GPR119	24	43
CS(=O)(=O)c1ccc([C@H](O)CNCC2CCN(c3ccncc3)CC2)cc1	ZINC000819204855	GE	On-Demand	Anodyne	ADRB3	33	45
CS(=O)(=O)c1ccc([C@H](O)CNCC2CCN(c3ccncc3)CC2)cc1	ZINC000819204855	GE	On-Demand	Anodyne	GPR119	24	43
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1cccnc1	ZINC000819204858	CE	On-Demand	Anodyne	ADRB2	39	47
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1cccnc1	ZINC000819204858	CE	On-Demand	Anodyne	ADRB1	52	45
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1cccnc1	ZINC000819204858	CE	On-Demand	Anodyne	ADRB3	127	46
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1cccnc1	ZINC000819204859	CE	On-Demand	Anodyne	ADRB2	39	47
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1cccnc1	ZINC000819204859	CE	On-Demand	Anodyne	ADRB1	52	45
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1cccnc1	ZINC000819204859	CE	On-Demand	Anodyne	ADRB3	127	46
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cccnc1Cl	ZINC000819204866	EE	On-Demand	Bother	G2YM83_BOTF4	71	36
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccc(Cl)cc1	ZINC000819204885	EE	On-Demand	Anodyne	ADRB1	43	41
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccc(Cl)cc1	ZINC000819204886	EE	On-Demand	Anodyne	ADRB1	43	41
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccc(Cl)cc1	ZINC000819204888	EE	On-Demand	Anodyne	ADRB1	43	41
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccc(Cl)cc1	ZINC000819204890	EE	On-Demand	Anodyne	ADRB1	43	41
C=CCC1(C(=O)Nc2ccc(N3CCN(C)CC3)c(Cl)c2)CCOCC1	ZINC000819204898	GG	On-Demand	Mild	NPY2R	65	45
O[C@@H](CNCC1CCN(c2ccncc2)CC1)c1ccc(Cl)cc1Cl	ZINC000819204921	GH	On-Demand	Anodyne	F10	15	50
O[C@H](CNCC1CCN(c2ccncc2)CC1)c1ccc(Cl)cc1Cl	ZINC000819204922	GH	On-Demand	Anodyne	F10	15	50
CCC1(O)CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819204933	CG	On-Demand	Anodyne	OPRL1	41	38
CC(=O)CCc1ccc2oc(C(=O)Nc3cccnc3Cl)c(C)c2c1	ZINC000819204946	FJ	On-Demand	Anodyne	G2YM83_BOTF4	68	34
O=C(CSc1ccccc1C(=O)Nc1cccnc1Cl)NCC1CCCCC1	ZINC000819204966	HJ	On-Demand	Anodyne	G2YM83_BOTF4	78	41
NC(=O)C1CCN(c2ccccc2NC(=O)C(F)=C2CCC2)CC1	ZINC000819204967	EF	On-Demand	Anodyne	KCNQ2	80	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CSC[C@H]1C(=O)N1CCCC1	ZINC000819205002	FD	On-Demand	Anodyne	PREP	41	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CSC[C@@H]1C(=O)N1CCCC1	ZINC000819205003	FD	On-Demand	Anodyne	PREP	41	51
CCCCCCn1nc(C(=O)Nc2cccnc2Cl)c2ccccc2c1=O	ZINC000819205014	GI	On-Demand	Anodyne	CNR2	16	40
CCCCCCn1nc(C(=O)Nc2cccnc2Cl)c2ccccc2c1=O	ZINC000819205014	GI	On-Demand	Anodyne	MAP1	28	40
CCCCCCn1nc(C(=O)Nc2cccnc2Cl)c2ccccc2c1=O	ZINC000819205014	GI	On-Demand	Anodyne	G2YM83_BOTF4	70	37
C[C@H]1C[C@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819205018	GF	On-Demand	Anodyne	CTSD	91	41
C[C@H]1C[C@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819205018	GF	On-Demand	Anodyne	PGC	64	36
C[C@H]1C[C@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819205018	GF	On-Demand	Anodyne	PAPA1_CARPA	28	41
C[C@H]1C[C@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819205018	GF	On-Demand	Anodyne	CCKAR	15	40
C[C@H]1C[C@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819205018	GF	On-Demand	Anodyne	BACE2	49	41
C[C@H]1C[C@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819205018	GF	On-Demand	Anodyne	REN	89	47
C[C@H]1C[C@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819205018	GF	On-Demand	Anodyne	REN1	15	42
C[C@H]1C[C@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819205018	GF	On-Demand	Anodyne	BACE1	75	41
C[C@H]1C[C@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819205018	GF	On-Demand	Anodyne	FPR1	48	40
C[C@H]1C[C@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819205018	GF	On-Demand	Anodyne	PLM1_PLAFA	17	40
O[C@H](CNCC1CCN(c2ccncc2)CC1)c1cccnc1	ZINC000819205037	DE	On-Demand	Anodyne	ADRB2	25	42
O[C@H](CNCC1CCN(c2ccncc2)CC1)c1cccnc1	ZINC000819205037	DE	On-Demand	Anodyne	ADRB1	26	42
O[C@H](CNCC1CCN(c2ccncc2)CC1)c1cccnc1	ZINC000819205037	DE	On-Demand	Anodyne	ADRB3	92	49
O[C@@H](CNCC1CCN(c2ccncc2)CC1)c1cccnc1	ZINC000819205038	DE	On-Demand	Anodyne	ADRB2	25	42
O[C@@H](CNCC1CCN(c2ccncc2)CC1)c1cccnc1	ZINC000819205038	DE	On-Demand	Anodyne	ADRB1	26	42
O[C@@H](CNCC1CCN(c2ccncc2)CC1)c1cccnc1	ZINC000819205038	DE	On-Demand	Anodyne	ADRB3	92	49
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1ccc(F)cc1Cl	ZINC000819205051	EH	On-Demand	Anodyne	LEF	42	33
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819205052	EH	On-Demand	Anodyne	LEF	42	33
COc1ccccc1COC[C@@H](O)CNC[C@@H]1COC2(CCCC2)O1	ZINC000819205063	FD	On-Demand	Anodyne	ADRA1D	27	45
COc1ccccc1COC[C@@H](O)CNC[C@@H]1COC2(CCCC2)O1	ZINC000819205063	FD	On-Demand	Anodyne	ADRA1A	19	46
COc1ccccc1COC[C@@H](O)CNC[C@@H]1COC2(CCCC2)O1	ZINC000819205063	FD	On-Demand	Anodyne	ADRA1B	26	46
COc1ccccc1COC[C@H](O)CNC[C@@H]1COC2(CCCC2)O1	ZINC000819205065	FD	On-Demand	Anodyne	ADRA1D	27	45
COc1ccccc1COC[C@H](O)CNC[C@@H]1COC2(CCCC2)O1	ZINC000819205065	FD	On-Demand	Anodyne	ADRA1A	19	46
COc1ccccc1COC[C@H](O)CNC[C@@H]1COC2(CCCC2)O1	ZINC000819205065	FD	On-Demand	Anodyne	ADRA1B	26	46
COc1ccccc1COC[C@@H](O)CNC[C@H]1COC2(CCCC2)O1	ZINC000819205067	FD	On-Demand	Anodyne	ADRA1D	27	45
COc1ccccc1COC[C@@H](O)CNC[C@H]1COC2(CCCC2)O1	ZINC000819205067	FD	On-Demand	Anodyne	ADRA1A	19	46
COc1ccccc1COC[C@@H](O)CNC[C@H]1COC2(CCCC2)O1	ZINC000819205067	FD	On-Demand	Anodyne	ADRA1B	26	46
COc1ccccc1COC[C@H](O)CNC[C@H]1COC2(CCCC2)O1	ZINC000819205069	FD	On-Demand	Anodyne	ADRA1D	27	45
COc1ccccc1COC[C@H](O)CNC[C@H]1COC2(CCCC2)O1	ZINC000819205069	FD	On-Demand	Anodyne	ADRA1A	19	46
COc1ccccc1COC[C@H](O)CNC[C@H]1COC2(CCCC2)O1	ZINC000819205069	FD	On-Demand	Anodyne	ADRA1B	26	46
COCCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819205071	FD	On-Demand	Anodyne	ADRB2	35	53
COCCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819205071	FD	On-Demand	Anodyne	ADRB1	65	53
COCCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819205071	FD	On-Demand	Anodyne	ADRB3	41	42
COCCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819205074	FD	On-Demand	Anodyne	ADRB2	35	53
COCCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819205074	FD	On-Demand	Anodyne	ADRB1	65	53
COCCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819205074	FD	On-Demand	Anodyne	ADRB3	41	42
COCCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819205076	FD	On-Demand	Anodyne	ADRB2	35	53
COCCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819205076	FD	On-Demand	Anodyne	ADRB1	65	53
COCCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819205076	FD	On-Demand	Anodyne	ADRB3	41	42
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819205077	FD	On-Demand	Anodyne	ADRB2	35	53
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819205077	FD	On-Demand	Anodyne	ADRB1	65	53
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819205077	FD	On-Demand	Anodyne	ADRB3	41	42
COC[C@@H](O)CNCCOc1ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc1	ZINC000819205084	GB	On-Demand	Anodyne	ADRB2	45	49
COC[C@@H](O)CNCCOc1ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc1	ZINC000819205084	GB	On-Demand	Anodyne	ADRB1	75	50
COC[C@@H](O)CNCCOc1ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc1	ZINC000819205084	GB	On-Demand	Anodyne	GRIN1	25	46
COC[C@@H](O)CNCCOc1ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc1	ZINC000819205084	GB	On-Demand	Anodyne	ADRB3	52	50
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1ccc(F)cc1F	ZINC000819205122	EG	On-Demand	Anodyne	LEF	49	32
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1ccc(F)cc1F	ZINC000819205124	EG	On-Demand	Anodyne	LEF	49	32
C=C(C)C(C)(C)C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	ZINC000819205156	DG	On-Demand	Mild	NPY2R	48	41
O=C(NO[C@H]1CCCCO1)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819205184	GG	On-Demand	Anodyne	CNR1	51	31
O=C(NO[C@@H]1CCCCO1)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819205187	GG	On-Demand	Anodyne	CNR1	51	31
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)Nc3cccnc3Cl)c2)CC1	ZINC000819205189	HD	On-Demand	Anodyne	PPARD	17	47
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)Nc3cccnc3Cl)c2)CC1	ZINC000819205189	HD	On-Demand	Anodyne	MAPK10	15	41
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)Nc3cccnc3Cl)c2)CC1	ZINC000819205189	HD	On-Demand	Anodyne	TGM2	55	36
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)Nc3cccnc3Cl)c2)CC1	ZINC000819205189	HD	On-Demand	Anodyne	F13A1	51	36
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)Nc3cccnc3Cl)c2)CC1	ZINC000819205189	HD	On-Demand	Anodyne	AKR1C3	60	42
CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)Nc3cccnc3Cl)c2)CC1	ZINC000819205189	HD	On-Demand	Anodyne	G2YM83_BOTF4	75	40
COc1ccc(OC)c([C@H](O)CNCCc2sccc2C)c1	ZINC000819205193	DF	On-Demand	Anodyne	ADRB2	17	49
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccc2ccccc2c1	ZINC000819205195	FF	On-Demand	Anodyne	ADRB2	26	50
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccc2ccccc2c1	ZINC000819205198	FF	On-Demand	Anodyne	ADRB2	26	50
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccc2ccccc2c1	ZINC000819205200	FF	On-Demand	Anodyne	ADRB2	26	50
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)C(F)=C1CCC1	ZINC000819205201	FI	On-Demand	Anodyne	L3MBTL3	40	35
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)C(F)=C1CCC1	ZINC000819205201	FI	On-Demand	Anodyne	HPGD	34	41
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccc2ccccc2c1	ZINC000819205202	FF	On-Demand	Anodyne	ADRB2	26	50
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205212	EE	On-Demand	Anodyne	ACE	49	43
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205212	EE	On-Demand	Anodyne	GHRHR	56	32
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205212	EE	On-Demand	Anodyne	MME	40	43
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205212	EE	On-Demand	Anodyne	MC4R	65	39
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205212	EE	On-Demand	Anodyne	TRY2_BOVIN	75	38
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205212	EE	On-Demand	Anodyne	TRY1_BOVIN	45	35
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205212	EE	On-Demand	Anodyne	CACNA1B	26	42
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205212	EE	On-Demand	Anodyne	NPFFR2	58	33
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205212	EE	On-Demand	Anodyne	CYP51A1	21	42
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205212	EE	On-Demand	Anodyne	PREP	27	55
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205212	EE	On-Demand	Anodyne	MC5R	40	34
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205212	EE	On-Demand	Anodyne	REN	46	42
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205212	EE	On-Demand	Anodyne	CAPN1	32	42
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205212	EE	On-Demand	Anodyne	ACE2	48	36
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205212	EE	On-Demand	Anodyne	ST14	58	35
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205212	EE	On-Demand	Anodyne	CALCRL	22	45
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205212	EE	On-Demand	Anodyne	BRCA1	45	32
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205212	EE	On-Demand	Anodyne	NPFFR1	42	34
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205214	EE	On-Demand	Anodyne	ACE	49	43
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205214	EE	On-Demand	Anodyne	GHRHR	56	32
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205214	EE	On-Demand	Anodyne	MME	40	43
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205214	EE	On-Demand	Anodyne	MC4R	65	39
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205214	EE	On-Demand	Anodyne	TRY2_BOVIN	75	38
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205214	EE	On-Demand	Anodyne	TRY1_BOVIN	45	35
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205214	EE	On-Demand	Anodyne	CACNA1B	26	42
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205214	EE	On-Demand	Anodyne	NPFFR2	58	33
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205214	EE	On-Demand	Anodyne	CYP51A1	21	42
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205214	EE	On-Demand	Anodyne	PREP	27	55
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205214	EE	On-Demand	Anodyne	MC5R	40	34
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205214	EE	On-Demand	Anodyne	REN	46	42
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205214	EE	On-Demand	Anodyne	CAPN1	32	42
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205214	EE	On-Demand	Anodyne	ACE2	48	36
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205214	EE	On-Demand	Anodyne	ST14	58	35
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205214	EE	On-Demand	Anodyne	CALCRL	22	45
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205214	EE	On-Demand	Anodyne	BRCA1	45	32
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205214	EE	On-Demand	Anodyne	NPFFR1	42	34
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205215	EE	On-Demand	Anodyne	ACE	49	43
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205215	EE	On-Demand	Anodyne	GHRHR	56	32
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205215	EE	On-Demand	Anodyne	MME	40	43
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205215	EE	On-Demand	Anodyne	MC4R	65	39
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205215	EE	On-Demand	Anodyne	TRY2_BOVIN	75	38
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205215	EE	On-Demand	Anodyne	TRY1_BOVIN	45	35
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205215	EE	On-Demand	Anodyne	CACNA1B	26	42
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205215	EE	On-Demand	Anodyne	NPFFR2	58	33
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205215	EE	On-Demand	Anodyne	CYP51A1	21	42
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205215	EE	On-Demand	Anodyne	PREP	27	55
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205215	EE	On-Demand	Anodyne	MC5R	40	34
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205215	EE	On-Demand	Anodyne	REN	46	42
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205215	EE	On-Demand	Anodyne	CAPN1	32	42
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205215	EE	On-Demand	Anodyne	ACE2	48	36
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205215	EE	On-Demand	Anodyne	ST14	58	35
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205215	EE	On-Demand	Anodyne	CALCRL	22	45
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205215	EE	On-Demand	Anodyne	BRCA1	45	32
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205215	EE	On-Demand	Anodyne	NPFFR1	42	34
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205216	EE	On-Demand	Anodyne	ACE	49	43
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205216	EE	On-Demand	Anodyne	GHRHR	56	32
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205216	EE	On-Demand	Anodyne	MME	40	43
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205216	EE	On-Demand	Anodyne	MC4R	65	39
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205216	EE	On-Demand	Anodyne	TRY2_BOVIN	75	38
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205216	EE	On-Demand	Anodyne	TRY1_BOVIN	45	35
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205216	EE	On-Demand	Anodyne	CACNA1B	26	42
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205216	EE	On-Demand	Anodyne	NPFFR2	58	33
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205216	EE	On-Demand	Anodyne	CYP51A1	21	42
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205216	EE	On-Demand	Anodyne	PREP	27	55
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205216	EE	On-Demand	Anodyne	MC5R	40	34
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205216	EE	On-Demand	Anodyne	REN	46	42
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205216	EE	On-Demand	Anodyne	CAPN1	32	42
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205216	EE	On-Demand	Anodyne	ACE2	48	36
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205216	EE	On-Demand	Anodyne	ST14	58	35
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205216	EE	On-Demand	Anodyne	CALCRL	22	45
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205216	EE	On-Demand	Anodyne	BRCA1	45	32
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000819205216	EE	On-Demand	Anodyne	NPFFR1	42	34
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819205223	GG	On-Demand	Anodyne	ADRB2	39	44
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819205223	GG	On-Demand	Anodyne	ADRB1	58	40
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819205223	GG	On-Demand	Anodyne	ADRB3	38	40
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819205224	GG	On-Demand	Anodyne	ADRB2	39	44
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819205224	GG	On-Demand	Anodyne	ADRB1	58	40
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819205224	GG	On-Demand	Anodyne	ADRB3	38	40
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819205225	GG	On-Demand	Anodyne	ADRB2	39	44
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819205225	GG	On-Demand	Anodyne	ADRB1	58	40
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819205225	GG	On-Demand	Anodyne	ADRB3	38	40
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819205226	GG	On-Demand	Anodyne	ADRB2	39	44
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819205226	GG	On-Demand	Anodyne	ADRB1	58	40
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819205226	GG	On-Demand	Anodyne	ADRB3	38	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	F2	24	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	ACE	63	51
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	GHRHR	54	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	MME	92	51
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	UGCG	29	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	MC4R	83	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	CTSB	25	43
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	TRY2_BOVIN	82	39
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	TRY1_BOVIN	28	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	CACNA1B	21	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	NPFFR2	47	34
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	CYP51A1	22	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	PREP	23	60
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	MC5R	46	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	CAPNS1	51	31
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	CCKBR	16	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	CAPN1	44	39
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	ACE2	70	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	DPP7	54	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	BLA1_STEMA	42	34
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205270	EF	On-Demand	Anodyne	NPFFR1	48	34
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	F2	24	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	ACE	63	51
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	GHRHR	54	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	MME	92	51
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	UGCG	29	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	MC4R	83	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	CTSB	25	43
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	TRY2_BOVIN	82	39
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	TRY1_BOVIN	28	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	CACNA1B	21	41
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	NPFFR2	47	34
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	CYP51A1	22	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	PREP	23	60
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	MC5R	46	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	CAPNS1	51	31
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	CCKBR	16	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	CAPN1	44	39
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	ACE2	70	36
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	DPP7	54	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	BLA1_STEMA	42	34
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819205271	EF	On-Demand	Anodyne	NPFFR1	48	34
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)c1	ZINC000819205280	ED	On-Demand	Anodyne	ADRB2	23	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)c1	ZINC000819205280	ED	On-Demand	Anodyne	ABCB1	16	46
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)c1	ZINC000819205281	ED	On-Demand	Anodyne	ADRB2	23	45
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)c1	ZINC000819205281	ED	On-Demand	Anodyne	ABCB1	16	46
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)c1	ZINC000819205282	ED	On-Demand	Anodyne	ADRB2	23	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)c1	ZINC000819205282	ED	On-Demand	Anodyne	ABCB1	16	46
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)c1	ZINC000819205283	ED	On-Demand	Anodyne	ADRB2	23	45
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)c1	ZINC000819205283	ED	On-Demand	Anodyne	ABCB1	16	46
N#Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)/C=C\[C@@H]2CCCO2)cc1	ZINC000819205284	FE	On-Demand	Mild	PFKFB3	41	33
N#Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)/C=C/[C@@H]2CCCO2)cc1	ZINC000819205290	FE	On-Demand	Mild	PFKFB3	41	33
N#Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)/C=C/[C@H]2CCCO2)cc1	ZINC000819205292	FE	On-Demand	Mild	PFKFB3	41	33
N#Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)/C=C\[C@H]2CCCO2)cc1	ZINC000819205294	FE	On-Demand	Mild	PFKFB3	41	33
Cn1nnnc1CCNC[C@@H](O)c1ccccc1	ZINC000819205317	BC	On-Demand	Anodyne	ADRB2	32	48
Cn1nnnc1CCNC[C@@H](O)c1ccccc1	ZINC000819205317	BC	On-Demand	Anodyne	ADRB1	43	41
Cn1nnnc1CCNC[C@@H](O)c1ccccc1	ZINC000819205317	BC	On-Demand	Anodyne	ADRB3	94	44
Cn1nnnc1CCNC[C@H](O)c1ccccc1	ZINC000819205326	BC	On-Demand	Anodyne	ADRB2	32	48
Cn1nnnc1CCNC[C@H](O)c1ccccc1	ZINC000819205326	BC	On-Demand	Anodyne	ADRB1	43	41
Cn1nnnc1CCNC[C@H](O)c1ccccc1	ZINC000819205326	BC	On-Demand	Anodyne	ADRB3	94	44
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)Nc2cccnc2Cl)cc1	ZINC000819205330	GD	On-Demand	Anodyne	G2YM83_BOTF4	64	32
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819205331	FG	On-Demand	Anodyne	L3MBTL3	62	34
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819205333	FG	On-Demand	Anodyne	L3MBTL3	62	34
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819205335	FG	On-Demand	Anodyne	L3MBTL3	62	34
COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819205337	FG	On-Demand	Anodyne	L3MBTL3	62	34
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccccc1C(F)(F)F	ZINC000819205344	GF	On-Demand	Anodyne	ADRA1B	15	41
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccccc1C(F)(F)F	ZINC000819205346	GF	On-Demand	Anodyne	ADRA1B	15	41
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccccc1C(F)(F)F	ZINC000819205348	GF	On-Demand	Anodyne	ADRA1B	15	41
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccccc1C(F)(F)F	ZINC000819205351	GF	On-Demand	Anodyne	ADRA1B	15	41
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	ZINC000819205371	DH	On-Demand	Anodyne	NPY2R	44	44
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	ZINC000819205373	DH	On-Demand	Anodyne	NPY2R	44	44
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819205429	EH	On-Demand	Anodyne	ADRB3	40	39
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819205430	EH	On-Demand	Anodyne	ADRB3	40	39
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819205437	EG	On-Demand	Anodyne	ADRB2	32	40
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819205437	EG	On-Demand	Anodyne	ADRB1	39	43
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819205437	EG	On-Demand	Anodyne	ADRB3	40	43
N#CCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819205438	ED	On-Demand	Mild	ADRB1	44	37
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819205440	ED	On-Demand	Mild	ADRB1	44	37
N#CCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819205441	ED	On-Demand	Mild	ADRB1	44	37
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1ccccc1F	ZINC000819205461	DF	On-Demand	Anodyne	ADRB2	15	41
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1ccccc1F	ZINC000819205462	DF	On-Demand	Anodyne	ADRB2	15	41
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)c1cccc(Cl)c1	ZINC000819205463	DF	On-Demand	Anodyne	ADRB3	38	40
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)c1cccc(Cl)c1	ZINC000819205464	DF	On-Demand	Anodyne	ADRB3	38	40
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)c1cccc(Cl)c1	ZINC000819205465	DF	On-Demand	Anodyne	ADRB3	38	40
O[C@H](CNC[C@H]1COC2(CCCC2)O1)c1cccc(Cl)c1	ZINC000819205466	DF	On-Demand	Anodyne	ADRB3	38	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1ccc(-c2ccccc2C#N)cc1	ZINC000819205487	GH	On-Demand	Mild	PAPA1_CARPA	30	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1ccc(-c2ccccc2C#N)cc1	ZINC000819205488	GH	On-Demand	Mild	PAPA1_CARPA	30	42
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccc(F)cc1	ZINC000819205489	ED	On-Demand	Anodyne	ADRB1	42	40
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccc(F)cc1	ZINC000819205490	ED	On-Demand	Anodyne	ADRB1	42	40
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccc(F)cc1	ZINC000819205491	ED	On-Demand	Anodyne	ADRB1	42	40
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccc(F)cc1	ZINC000819205492	ED	On-Demand	Anodyne	ADRB1	42	40
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccc(Br)cc1	ZINC000819205509	GE	On-Demand	Anodyne	ADRB1	37	40
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccc(Br)cc1	ZINC000819205510	GE	On-Demand	Anodyne	ADRB1	37	40
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccc(Br)cc1	ZINC000819205511	GE	On-Demand	Anodyne	ADRB1	37	40
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccc(Br)cc1	ZINC000819205512	GE	On-Demand	Anodyne	ADRB1	37	40
O[C@@H](CNCC1CCN(c2ccncc2)CC1)c1cccc(Cl)c1	ZINC000819205528	EG	On-Demand	Anodyne	ADRB2	17	42
O[C@@H](CNCC1CCN(c2ccncc2)CC1)c1cccc(Cl)c1	ZINC000819205528	EG	On-Demand	Anodyne	ADRB1	40	41
O[C@@H](CNCC1CCN(c2ccncc2)CC1)c1cccc(Cl)c1	ZINC000819205528	EG	On-Demand	Anodyne	ADRB3	58	41
O[C@@H](CNCC1CCN(c2ccncc2)CC1)c1cccc(Cl)c1	ZINC000819205528	EG	On-Demand	Anodyne	IGF1R	30	40
O[C@@H](CNCC1CCN(c2ccncc2)CC1)c1cccc(Cl)c1	ZINC000819205528	EG	On-Demand	Anodyne	CYP3A4	54	40
O[C@H](CNCC1CCN(c2ccncc2)CC1)c1cccc(Cl)c1	ZINC000819205529	EG	On-Demand	Anodyne	ADRB2	17	42
O[C@H](CNCC1CCN(c2ccncc2)CC1)c1cccc(Cl)c1	ZINC000819205529	EG	On-Demand	Anodyne	ADRB1	40	41
O[C@H](CNCC1CCN(c2ccncc2)CC1)c1cccc(Cl)c1	ZINC000819205529	EG	On-Demand	Anodyne	ADRB3	58	41
O[C@H](CNCC1CCN(c2ccncc2)CC1)c1cccc(Cl)c1	ZINC000819205529	EG	On-Demand	Anodyne	IGF1R	30	40
O[C@H](CNCC1CCN(c2ccncc2)CC1)c1cccc(Cl)c1	ZINC000819205529	EG	On-Demand	Anodyne	CYP3A4	54	40
CC(=O)N1CCCc2cc(NC(=O)C(F)=C3CCC3)ccc21	ZINC000819205588	DG	On-Demand	Anodyne	HSD17B3	47	35
Cn1nnnc1CCNC[C@@H](O)c1cccc(Br)c1	ZINC000819205598	EC	On-Demand	Anodyne	ADRB3	66	38
Cn1nnnc1CCNC[C@H](O)c1cccc(Br)c1	ZINC000819205599	EC	On-Demand	Anodyne	ADRB3	66	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3cc(C)ccc13)C2	ZINC000819205649	FG	On-Demand	Anodyne	MTNR1A	15	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3cc(C)ccc13)C2	ZINC000819205650	FG	On-Demand	Anodyne	MTNR1A	15	42
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1ccc(-c2ccccc2C#N)cc1	ZINC000819205671	GH	On-Demand	Mild	ADRB1	44	34
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1ccc(-c2ccccc2C#N)cc1	ZINC000819205671	GH	On-Demand	Mild	PAPA1_CARPA	34	42
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1ccc(-c2ccccc2C#N)cc1	ZINC000819205672	GH	On-Demand	Mild	ADRB1	44	34
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1ccc(-c2ccccc2C#N)cc1	ZINC000819205672	GH	On-Demand	Mild	PAPA1_CARPA	34	42
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819205684	EG	On-Demand	Anodyne	ADRB2	62	43
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819205684	EG	On-Demand	Anodyne	ADRB1	66	52
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819205684	EG	On-Demand	Anodyne	ADRB3	81	52
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819205684	EG	On-Demand	Anodyne	CYP3A4	45	33
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819205685	EG	On-Demand	Anodyne	ADRB2	62	43
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819205685	EG	On-Demand	Anodyne	ADRB1	66	52
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819205685	EG	On-Demand	Anodyne	ADRB3	81	52
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819205685	EG	On-Demand	Anodyne	CYP3A4	45	33
CCC1(O)CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819205734	CG	On-Demand	Anodyne	ADRB1	38	43
CCC1(O)CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819205734	CG	On-Demand	Anodyne	ADRB3	54	48
CCC1(O)CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819205734	CG	On-Demand	Anodyne	CYP3A4	41	35
CCC1(O)CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819205735	CG	On-Demand	Anodyne	ADRB1	38	43
CCC1(O)CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819205735	CG	On-Demand	Anodyne	ADRB3	54	48
CCC1(O)CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819205735	CG	On-Demand	Anodyne	CYP3A4	41	35
COc1ccc([C@@H](OC)[C@H](C)NC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819205743	EH	On-Demand	Anodyne	ADRB2	17	43
COc1ccc([C@@H](OC)[C@H](C)NC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819205743	EH	On-Demand	Anodyne	ADRB3	19	42
COc1ccc([C@@H](OC)[C@@H](C)NC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819205745	EH	On-Demand	Anodyne	ADRB2	17	43
COc1ccc([C@@H](OC)[C@@H](C)NC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819205745	EH	On-Demand	Anodyne	ADRB3	19	42
CSc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccn1	ZINC000819205751	DF	On-Demand	Bother	CACNA1D	54	32
CSc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccn1	ZINC000819205752	DF	On-Demand	Bother	CACNA1D	54	32
CCC1(O)CCC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819205754	DE	On-Demand	Bother	CACNA1C	49	35
CCC1(O)CCC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819205754	DE	On-Demand	Bother	CACNA1D	79	33
CCC1(O)CCC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819205755	DE	On-Demand	Bother	CACNA1C	49	35
CCC1(O)CCC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819205755	DE	On-Demand	Bother	CACNA1D	79	33
C=CCCn1cc(C(=O)Nc2ccc(N3CCN(C)CC3)c(Cl)c2)nn1	ZINC000819205758	FF	On-Demand	Mild	NPY2R	69	41
CSc1cc(CNC[C@H](O)c2cccc(Cl)c2)ccn1	ZINC000819205765	DG	On-Demand	Anodyne	ADRB1	31	42
CSc1cc(CNC[C@H](O)c2cccc(Cl)c2)ccn1	ZINC000819205765	DG	On-Demand	Anodyne	ADRB3	47	42
CSc1cc(CNC[C@@H](O)c2cccc(Cl)c2)ccn1	ZINC000819205766	DG	On-Demand	Anodyne	ADRB1	31	42
CSc1cc(CNC[C@@H](O)c2cccc(Cl)c2)ccn1	ZINC000819205766	DG	On-Demand	Anodyne	ADRB3	47	42
CSc1cc(CNC[C@@H](O)c2cccnc2)ccn1	ZINC000819205776	CE	On-Demand	Anodyne	ADRB2	22	40
CSc1cc(CNC[C@@H](O)c2cccnc2)ccn1	ZINC000819205776	CE	On-Demand	Anodyne	ADRB1	24	42
CSc1cc(CNC[C@@H](O)c2cccnc2)ccn1	ZINC000819205776	CE	On-Demand	Anodyne	ADRB3	91	46
CSc1cc(CNC[C@H](O)c2cccnc2)ccn1	ZINC000819205777	CE	On-Demand	Anodyne	ADRB2	22	40
CSc1cc(CNC[C@H](O)c2cccnc2)ccn1	ZINC000819205777	CE	On-Demand	Anodyne	ADRB1	24	42
CSc1cc(CNC[C@H](O)c2cccnc2)ccn1	ZINC000819205777	CE	On-Demand	Anodyne	ADRB3	91	46
O[C@@H](CNCC1CCN(c2ccncc2)CC1)c1ccccc1	ZINC000819205786	DF	On-Demand	Anodyne	ADRB1	17	42
O[C@@H](CNCC1CCN(c2ccncc2)CC1)c1ccccc1	ZINC000819205786	DF	On-Demand	Anodyne	ADRB3	36	42
O[C@H](CNCC1CCN(c2ccncc2)CC1)c1ccccc1	ZINC000819205787	DF	On-Demand	Anodyne	ADRB1	17	42
O[C@H](CNCC1CCN(c2ccncc2)CC1)c1ccccc1	ZINC000819205787	DF	On-Demand	Anodyne	ADRB3	36	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](C#N)c1cccc(Br)c1	ZINC000819205793	GG	On-Demand	Mild	PAPA1_CARPA	30	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](C#N)c1cccc(Br)c1	ZINC000819205794	GG	On-Demand	Mild	PAPA1_CARPA	30	45
CC[C@@H](C(=O)N1CCC(NC(=O)C(F)=C2CCC2)CC1)c1ccccc1	ZINC000819205797	FH	On-Demand	Anodyne	KCNQ2	43	39
CC[C@@H](C(=O)N1CCC(NC(=O)C(F)=C2CCC2)CC1)c1ccccc1	ZINC000819205797	FH	On-Demand	Anodyne	EPHX2	28	40
CC[C@H](C(=O)N1CCC(NC(=O)C(F)=C2CCC2)CC1)c1ccccc1	ZINC000819205798	FH	On-Demand	Anodyne	KCNQ2	43	39
CC[C@H](C(=O)N1CCC(NC(=O)C(F)=C2CCC2)CC1)c1ccccc1	ZINC000819205798	FH	On-Demand	Anodyne	EPHX2	28	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCC1CCN(c2ccncc2)CC1	ZINC000819205810	GE	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNCC1CCN(c2ccncc2)CC1	ZINC000819205811	GE	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819205830	GH	On-Demand	Anodyne	LEF	47	35
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819205831	GH	On-Demand	Anodyne	LEF	47	35
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1ccccc1	ZINC000819205857	CF	On-Demand	Anodyne	ADRB2	53	43
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1ccccc1	ZINC000819205857	CF	On-Demand	Anodyne	ADRB1	57	41
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1ccccc1	ZINC000819205857	CF	On-Demand	Anodyne	ADRB3	70	50
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1ccccc1	ZINC000819205858	CF	On-Demand	Anodyne	ADRB2	53	43
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1ccccc1	ZINC000819205858	CF	On-Demand	Anodyne	ADRB1	57	41
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1ccccc1	ZINC000819205858	CF	On-Demand	Anodyne	ADRB3	70	50
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccccc1	ZINC000819205911	DD	On-Demand	Anodyne	ADRB2	42	48
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccccc1	ZINC000819205911	DD	On-Demand	Anodyne	ADRB1	62	41
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccccc1	ZINC000819205911	DD	On-Demand	Anodyne	ADRB3	40	41
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccccc1	ZINC000819205912	DD	On-Demand	Anodyne	ADRB2	42	48
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccccc1	ZINC000819205912	DD	On-Demand	Anodyne	ADRB1	62	41
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1ccccc1	ZINC000819205912	DD	On-Demand	Anodyne	ADRB3	40	41
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccccc1	ZINC000819205913	DD	On-Demand	Anodyne	ADRB2	42	48
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccccc1	ZINC000819205913	DD	On-Demand	Anodyne	ADRB1	62	41
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccccc1	ZINC000819205913	DD	On-Demand	Anodyne	ADRB3	40	41
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccccc1	ZINC000819205914	DD	On-Demand	Anodyne	ADRB2	42	48
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccccc1	ZINC000819205914	DD	On-Demand	Anodyne	ADRB1	62	41
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1ccccc1	ZINC000819205914	DD	On-Demand	Anodyne	ADRB3	40	41
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819205945	GE	On-Demand	Anodyne	ADRB2	39	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819205945	GE	On-Demand	Anodyne	ADRB1	70	45
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819205945	GE	On-Demand	Anodyne	ADRB3	48	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819205946	GE	On-Demand	Anodyne	ADRB2	39	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819205946	GE	On-Demand	Anodyne	ADRB1	70	45
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819205946	GE	On-Demand	Anodyne	ADRB3	48	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819205947	GE	On-Demand	Anodyne	ADRB2	39	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819205947	GE	On-Demand	Anodyne	ADRB1	70	45
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819205947	GE	On-Demand	Anodyne	ADRB3	48	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819205948	GE	On-Demand	Anodyne	ADRB2	39	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819205948	GE	On-Demand	Anodyne	ADRB1	70	45
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819205948	GE	On-Demand	Anodyne	ADRB3	48	43
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1cccc(Br)c1	ZINC000819205976	FH	On-Demand	Anodyne	ADRB2	43	34
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1cccc(Br)c1	ZINC000819205976	FH	On-Demand	Anodyne	ADRB1	47	39
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1cccc(Br)c1	ZINC000819205976	FH	On-Demand	Anodyne	ADRB3	60	39
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1cccc(Br)c1	ZINC000819205977	FH	On-Demand	Anodyne	ADRB2	43	34
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1cccc(Br)c1	ZINC000819205977	FH	On-Demand	Anodyne	ADRB1	47	39
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1cccc(Br)c1	ZINC000819205977	FH	On-Demand	Anodyne	ADRB3	60	39
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1COC2(CCCC2)O1	ZINC000819206001	FD	On-Demand	Anodyne	ADRA1D	30	45
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1COC2(CCCC2)O1	ZINC000819206001	FD	On-Demand	Anodyne	ADRA1A	24	48
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1COC2(CCCC2)O1	ZINC000819206001	FD	On-Demand	Anodyne	ADRA1B	30	48
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1COC2(CCCC2)O1	ZINC000819206002	FD	On-Demand	Anodyne	ADRA1D	30	45
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1COC2(CCCC2)O1	ZINC000819206002	FD	On-Demand	Anodyne	ADRA1A	24	48
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1COC2(CCCC2)O1	ZINC000819206002	FD	On-Demand	Anodyne	ADRA1B	30	48
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1COC2(CCCC2)O1	ZINC000819206004	FD	On-Demand	Anodyne	ADRA1D	30	45
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1COC2(CCCC2)O1	ZINC000819206004	FD	On-Demand	Anodyne	ADRA1A	24	48
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1COC2(CCCC2)O1	ZINC000819206004	FD	On-Demand	Anodyne	ADRA1B	30	48
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1COC2(CCCC2)O1	ZINC000819206006	FD	On-Demand	Anodyne	ADRA1D	30	45
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1COC2(CCCC2)O1	ZINC000819206006	FD	On-Demand	Anodyne	ADRA1A	24	48
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1COC2(CCCC2)O1	ZINC000819206006	FD	On-Demand	Anodyne	ADRA1B	30	48
Cn1nnnc1CCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819206007	DD	On-Demand	Anodyne	ADRB3	60	37
Cn1nnnc1CCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819206008	DD	On-Demand	Anodyne	ADRB3	60	37
COc1ccc([C@@H](OC)[C@H](C)NC[C@H](O)c2cccc3ccccc23)cc1	ZINC000819206032	FI	On-Demand	Anodyne	ADRB2	20	45
COc1ccc([C@@H](OC)[C@@H](C)NC[C@H](O)c2cccc3ccccc23)cc1	ZINC000819206039	FI	On-Demand	Anodyne	ADRB2	20	45
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819206040	EE	On-Demand	Anodyne	ADRB1	17	56
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819206040	EE	On-Demand	Anodyne	HTR1A	15	56
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819206042	EE	On-Demand	Anodyne	ADRB1	17	56
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819206042	EE	On-Demand	Anodyne	HTR1A	15	56
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819206043	EE	On-Demand	Anodyne	ADRB1	17	56
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819206043	EE	On-Demand	Anodyne	HTR1A	15	56
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819206045	EE	On-Demand	Anodyne	ADRB1	17	56
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819206045	EE	On-Demand	Anodyne	HTR1A	15	56
Cn1nnnc1CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819206048	CC	On-Demand	Anodyne	ADRB1	19	42
Cn1nnnc1CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819206048	CC	On-Demand	Anodyne	ADRB3	37	42
CSc1cc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)ccn1	ZINC000819206091	GF	On-Demand	Anodyne	GPR119	55	47
CSc1cc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)ccn1	ZINC000819206092	GF	On-Demand	Anodyne	GPR119	55	47
CN(C1CCCCC1)S(=O)(=O)c1cccc(C(=O)Nc2cccnc2Cl)c1	ZINC000819206150	HH	On-Demand	Anodyne	G2YM83_BOTF4	77	42
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1cccc2ccccc12	ZINC000819206192	FF	On-Demand	Anodyne	ADRB2	22	52
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1cccc2ccccc12	ZINC000819206192	FF	On-Demand	Anodyne	ADRA1B	17	42
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1cccc2ccccc12	ZINC000819206192	FF	On-Demand	Anodyne	CYP2D6	15	44
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1cccc2ccccc12	ZINC000819206193	FF	On-Demand	Anodyne	ADRB2	22	52
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1cccc2ccccc12	ZINC000819206193	FF	On-Demand	Anodyne	ADRA1B	17	42
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1cccc2ccccc12	ZINC000819206193	FF	On-Demand	Anodyne	CYP2D6	15	44
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1cccc2ccccc12	ZINC000819206194	FF	On-Demand	Anodyne	ADRB2	22	52
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1cccc2ccccc12	ZINC000819206194	FF	On-Demand	Anodyne	ADRA1B	17	42
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1cccc2ccccc12	ZINC000819206194	FF	On-Demand	Anodyne	CYP2D6	15	44
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1cccc2ccccc12	ZINC000819206195	FF	On-Demand	Anodyne	ADRB2	22	52
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1cccc2ccccc12	ZINC000819206195	FF	On-Demand	Anodyne	ADRA1B	17	42
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1cccc2ccccc12	ZINC000819206195	FF	On-Demand	Anodyne	CYP2D6	15	44
Cc1cc(F)ccc1[C@@H](O)CNCCCCC(=O)OC(C)(C)C	ZINC000819206207	EG	On-Demand	Anodyne	LEF	77	34
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1ccc(C#N)cc1	ZINC000819206217	DF	On-Demand	Mild	CTRB_BOVIN	44	30
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1ccc(C#N)cc1	ZINC000819206218	DF	On-Demand	Mild	CTRB_BOVIN	44	30
Cn1nnnc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819206231	CC	On-Demand	Anodyne	ADRB2	45	38
Cn1nnnc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819206231	CC	On-Demand	Anodyne	ADRB1	61	49
Cn1nnnc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819206231	CC	On-Demand	Anodyne	ADRB3	100	52
Cn1nnnc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819206232	CC	On-Demand	Anodyne	ADRB2	45	38
Cn1nnnc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819206232	CC	On-Demand	Anodyne	ADRB1	61	49
Cn1nnnc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819206232	CC	On-Demand	Anodyne	ADRB3	100	52
O[C@@H](CNCC1CCN(c2ccncc2)CC1)c1ccccc1Cl	ZINC000819206255	EG	On-Demand	Anodyne	OPRL1	36	40
COc1ccc([C@@H](OC)[C@H](C)NC[C@H](O)c2ccccc2Cl)cc1	ZINC000819206260	EH	On-Demand	Anodyne	ADRB2	16	45
COc1ccc([C@@H](OC)[C@@H](C)NC[C@H](O)c2ccccc2Cl)cc1	ZINC000819206262	EH	On-Demand	Anodyne	ADRB2	16	45
COc1ccc(OC)c([C@H](O)CNCCc2nnnn2C)c1	ZINC000819206266	DC	On-Demand	Anodyne	ADRB2	18	46
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OCC(C)C)CC2)c1	ZINC000819206274	FE	On-Demand	Anodyne	TGM2	31	42
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OCC(C)C)CC2)c1	ZINC000819206274	FE	On-Demand	Anodyne	ST14	41	39
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OCC(C)C)CC2)c1	ZINC000819206274	FE	On-Demand	Anodyne	F13A1	51	42
Cc1ccc2nc(-c3ccccc3)cc(C(=O)Nc3cccnc3Cl)c2c1	ZINC000819206277	FK	On-Demand	Anodyne	DHODH	18	43
Cc1ccc2nc(-c3ccccc3)cc(C(=O)Nc3cccnc3Cl)c2c1	ZINC000819206277	FK	On-Demand	Anodyne	PRS	61	40
Cc1ccc2nc(-c3ccccc3)cc(C(=O)Nc3cccnc3Cl)c2c1	ZINC000819206277	FK	On-Demand	Anodyne	TACR3	25	50
Cc1ccc2nc(-c3ccccc3)cc(C(=O)Nc3cccnc3Cl)c2c1	ZINC000819206277	FK	On-Demand	Anodyne	SMO	21	41
Cc1ccc2nc(-c3ccccc3)cc(C(=O)Nc3cccnc3Cl)c2c1	ZINC000819206277	FK	On-Demand	Anodyne	MT-CO2	54	42
Cc1ccc2nc(-c3ccccc3)cc(C(=O)Nc3cccnc3Cl)c2c1	ZINC000819206277	FK	On-Demand	Anodyne	G2YM83_BOTF4	78	40
CCC1(O)CCC(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819206278	FF	On-Demand	Anodyne	GPR119	27	41
CCC1(O)CCC(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819206279	FF	On-Demand	Anodyne	GPR119	27	41
COc1ccc([C@@H](OC)[C@H](C)NCCC(=O)N(C)OC)cc1	ZINC000819206283	DD	On-Demand	Anodyne	DXR	22	40
COc1ccc([C@@H](OC)[C@@H](C)NCCC(=O)N(C)OC)cc1	ZINC000819206285	DD	On-Demand	Anodyne	DXR	22	40
COc1ccc([C@@H](OC)[C@H](C)NCCC(=O)Nc2ccc(N(C)C)cc2)cc1	ZINC000819206286	GG	On-Demand	Anodyne	MTNR1B	16	43
COc1ccc([C@@H](OC)[C@@H](C)NCCC(=O)Nc2ccc(N(C)C)cc2)cc1	ZINC000819206289	GG	On-Demand	Anodyne	MTNR1B	16	43
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)NCC3CCOCC3)nn2)C1	ZINC000819206290	GE	On-Demand	Anodyne	CACNA1I	49	33
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)NCC3CCOCC3)nn2)C1	ZINC000819206291	GE	On-Demand	Anodyne	CACNA1I	49	33
O=C(Nc1ccc(CC(=O)N2CCc3ccccc32)cc1)C(F)=C1CCC1	ZINC000819206292	FI	On-Demand	Anodyne	AVPR2	54	48
O=C(Nc1ccc(CC(=O)N2CCc3ccccc32)cc1)C(F)=C1CCC1	ZINC000819206292	FI	On-Demand	Anodyne	AVPR1A	23	43
O=C(Nc1ccc(CC(=O)N2CCc3ccccc32)cc1)C(F)=C1CCC1	ZINC000819206292	FI	On-Demand	Anodyne	NOD2	40	33
O=S(=O)(CCNC[C@H]1COC2(CCCC2)O1)c1ccccc1	ZINC000819206329	ED	On-Demand	Anodyne	ADRA1D	15	40
O=S(=O)(CCNC[C@H]1COC2(CCCC2)O1)c1ccccc1	ZINC000819206329	ED	On-Demand	Anodyne	ADRA1B	15	40
O=S(=O)(CCNC[C@@H]1COC2(CCCC2)O1)c1ccccc1	ZINC000819206330	ED	On-Demand	Anodyne	ADRA1D	15	40
O=S(=O)(CCNC[C@@H]1COC2(CCCC2)O1)c1ccccc1	ZINC000819206330	ED	On-Demand	Anodyne	ADRA1B	15	40
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819206362	FD	On-Demand	Anodyne	ADRB2	37	43
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819206362	FD	On-Demand	Anodyne	ADRB1	62	43
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819206362	FD	On-Demand	Anodyne	ADRB3	39	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819206363	FD	On-Demand	Anodyne	ADRB2	37	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819206363	FD	On-Demand	Anodyne	ADRB1	62	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819206363	FD	On-Demand	Anodyne	ADRB3	39	43
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819206364	FD	On-Demand	Anodyne	ADRB2	37	43
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819206364	FD	On-Demand	Anodyne	ADRB1	62	43
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819206364	FD	On-Demand	Anodyne	ADRB3	39	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819206365	FD	On-Demand	Anodyne	ADRB2	37	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819206365	FD	On-Demand	Anodyne	ADRB1	62	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819206365	FD	On-Demand	Anodyne	ADRB3	39	43
O=C(/C=C/[C@@H]1CCCO1)N1CCc2cc(S(=O)(=O)N3CCCCC3)ccc21	ZINC000819206370	GE	On-Demand	Anodyne	AKR1C3	44	34
O=C(/C=C/[C@H]1CCCO1)N1CCc2cc(S(=O)(=O)N3CCCCC3)ccc21	ZINC000819206371	GE	On-Demand	Anodyne	AKR1C3	44	34
O=C(/C=C\[C@@H]1CCCO1)N1CCc2cc(S(=O)(=O)N3CCCCC3)ccc21	ZINC000819206372	GE	On-Demand	Anodyne	AKR1C3	44	34
O=C(/C=C\[C@H]1CCCO1)N1CCc2cc(S(=O)(=O)N3CCCCC3)ccc21	ZINC000819206373	GE	On-Demand	Anodyne	AKR1C3	44	34
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819206408	FD	On-Demand	Anodyne	ADRB2	40	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819206408	FD	On-Demand	Anodyne	ADRB1	77	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819206408	FD	On-Demand	Anodyne	ADRB3	49	49
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819206409	FD	On-Demand	Anodyne	ADRB2	40	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819206409	FD	On-Demand	Anodyne	ADRB1	77	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819206409	FD	On-Demand	Anodyne	ADRB3	49	49
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819206410	FD	On-Demand	Anodyne	ADRB2	40	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819206410	FD	On-Demand	Anodyne	ADRB1	77	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCC3)O2)cc1	ZINC000819206410	FD	On-Demand	Anodyne	ADRB3	49	49
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819206411	FD	On-Demand	Anodyne	ADRB2	40	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819206411	FD	On-Demand	Anodyne	ADRB1	77	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCC3)O2)cc1	ZINC000819206411	FD	On-Demand	Anodyne	ADRB3	49	49
O[C@H](CNC[C@@H]1COC2(CCCC2)O1)COc1cccc(C(F)(F)F)c1	ZINC000819206413	GF	On-Demand	Anodyne	PDS	42	36
O[C@@H](CNC[C@@H]1COC2(CCCC2)O1)COc1cccc(C(F)(F)F)c1	ZINC000819206414	GF	On-Demand	Anodyne	PDS	42	36
O[C@@H](CNC[C@H]1COC2(CCCC2)O1)COc1cccc(C(F)(F)F)c1	ZINC000819206415	GF	On-Demand	Anodyne	PDS	42	36
O[C@H](CNC[C@H]1COC2(CCCC2)O1)COc1cccc(C(F)(F)F)c1	ZINC000819206416	GF	On-Demand	Anodyne	PDS	42	36
COc1ccc([C@@H](OC)[C@@H](C)NC[C@H](O)c2ccccc2)cc1	ZINC000819206430	DG	On-Demand	Anodyne	ADRB2	28	46
COc1ccc([C@@H](OC)[C@@H](C)NC[C@H](O)c2ccccc2)cc1	ZINC000819206430	DG	On-Demand	Anodyne	ADRB1	20	40
COc1ccc([C@@H](OC)[C@@H](C)NC[C@H](O)c2ccccc2)cc1	ZINC000819206430	DG	On-Demand	Anodyne	ADRB3	36	44
COc1ccc([C@@H](OC)[C@@H](C)NC[C@H](O)c2ccccc2)cc1	ZINC000819206430	DG	On-Demand	Anodyne	AOC3	20	52
COc1ccc([C@@H](OC)[C@H](C)NC[C@H](O)c2ccccc2)cc1	ZINC000819206432	DG	On-Demand	Anodyne	ADRB2	28	46
COc1ccc([C@@H](OC)[C@H](C)NC[C@H](O)c2ccccc2)cc1	ZINC000819206432	DG	On-Demand	Anodyne	ADRB1	20	40
COc1ccc([C@@H](OC)[C@H](C)NC[C@H](O)c2ccccc2)cc1	ZINC000819206432	DG	On-Demand	Anodyne	ADRB3	36	44
COc1ccc([C@@H](OC)[C@H](C)NC[C@H](O)c2ccccc2)cc1	ZINC000819206432	DG	On-Demand	Anodyne	AOC3	20	52
COc1ccc([C@@H](OC)[C@H](C)NC[C@@H](O)c2ccccc2)cc1	ZINC000819206433	DG	On-Demand	Anodyne	ADRB2	28	46
COc1ccc([C@@H](OC)[C@H](C)NC[C@@H](O)c2ccccc2)cc1	ZINC000819206433	DG	On-Demand	Anodyne	ADRB1	20	40
COc1ccc([C@@H](OC)[C@H](C)NC[C@@H](O)c2ccccc2)cc1	ZINC000819206433	DG	On-Demand	Anodyne	ADRB3	36	44
COc1ccc([C@@H](OC)[C@H](C)NC[C@@H](O)c2ccccc2)cc1	ZINC000819206433	DG	On-Demand	Anodyne	AOC3	20	52
COc1ccc([C@@H](OC)[C@@H](C)NC[C@@H](O)c2ccccc2)cc1	ZINC000819206436	DG	On-Demand	Anodyne	ADRB2	28	46
COc1ccc([C@@H](OC)[C@@H](C)NC[C@@H](O)c2ccccc2)cc1	ZINC000819206436	DG	On-Demand	Anodyne	ADRB1	20	40
COc1ccc([C@@H](OC)[C@@H](C)NC[C@@H](O)c2ccccc2)cc1	ZINC000819206436	DG	On-Demand	Anodyne	ADRB3	36	44
COc1ccc([C@@H](OC)[C@@H](C)NC[C@@H](O)c2ccccc2)cc1	ZINC000819206436	DG	On-Demand	Anodyne	AOC3	20	52
O=C(NCC(=O)N1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819206440	ED	On-Demand	Anodyne	SIGMAR1	46	42
O=C(NCC(=O)N1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819206440	ED	On-Demand	Anodyne	FAAH	21	42
O=C(NCC(=O)N1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819206440	ED	On-Demand	Anodyne	NPFFR1	42	38
Cn1nnnc1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819206443	CC	On-Demand	Anodyne	ADRB1	32	46
Cn1nnnc1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819206443	CC	On-Demand	Anodyne	ADRB3	77	46
Cn1nnnc1CCNC[C@H](O)c1cccc(F)c1	ZINC000819206444	CC	On-Demand	Anodyne	ADRB1	32	46
Cn1nnnc1CCNC[C@H](O)c1cccc(F)c1	ZINC000819206444	CC	On-Demand	Anodyne	ADRB3	77	46
CCC1(O)CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819206447	CG	On-Demand	Anodyne	ADRB3	19	43
O[C@@H](CNCC1CCN(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000819206508	EF	On-Demand	Anodyne	SLC6A3	23	44
O[C@H](CNCC1CCN(c2ccncc2)CC1)c1ccc(F)cc1	ZINC000819206509	EF	On-Demand	Anodyne	SLC6A3	23	44
O=C(/C=C/[C@@H]1CCCO1)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000819206535	FD	On-Demand	Anodyne	DRD4	30	42
O=C(/C=C/[C@@H]1CCCO1)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000819206535	FD	On-Demand	Anodyne	ACHE	28	40
O=C(/C=C/[C@@H]1CCCO1)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000819206535	FD	On-Demand	Anodyne	SIGMAR1	42	44
O=C(/C=C\[C@H]1CCCO1)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000819206536	FD	On-Demand	Anodyne	DRD4	30	42
O=C(/C=C\[C@H]1CCCO1)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000819206536	FD	On-Demand	Anodyne	ACHE	28	40
O=C(/C=C\[C@H]1CCCO1)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000819206536	FD	On-Demand	Anodyne	SIGMAR1	42	44
O=C(/C=C/[C@H]1CCCO1)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000819206537	FD	On-Demand	Anodyne	DRD4	30	42
O=C(/C=C/[C@H]1CCCO1)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000819206537	FD	On-Demand	Anodyne	ACHE	28	40
O=C(/C=C/[C@H]1CCCO1)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000819206537	FD	On-Demand	Anodyne	SIGMAR1	42	44
O=C(/C=C\[C@@H]1CCCO1)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000819206538	FD	On-Demand	Anodyne	DRD4	30	42
O=C(/C=C\[C@@H]1CCCO1)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000819206538	FD	On-Demand	Anodyne	ACHE	28	40
O=C(/C=C\[C@@H]1CCCO1)NCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000819206538	FD	On-Demand	Anodyne	SIGMAR1	42	44
CCC1(O)CCC(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819206541	ED	On-Demand	Anodyne	ADRB3	17	44
CCC1(O)CCC(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819206542	ED	On-Demand	Anodyne	ADRB3	17	44
Cn1nnnc1CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819206561	EC	On-Demand	Anodyne	ADRB3	25	43
Cn1nnnc1CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819206562	EC	On-Demand	Anodyne	ADRB3	25	43
O=C(CSc1ccc2c3c(cccc13)CC2)Nc1cccnc1Cl	ZINC000819206573	FJ	On-Demand	Anodyne	G2YM83_BOTF4	74	40
N#Cc1cccc(NC(=O)C2CCN(C(=O)C(F)=C3CCC3)CC2)c1	ZINC000819206583	EG	On-Demand	Mild	CCR3	17	41
N#Cc1cccc(NC(=O)C2CCN(C(=O)C(F)=C3CCC3)CC2)c1	ZINC000819206583	EG	On-Demand	Mild	MCHR1	40	39
CCC1(O)CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819206605	CD	On-Demand	Anodyne	ADRB3	65	47
CCC1(O)CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819206606	CD	On-Demand	Anodyne	ADRB3	65	47
Cn1nnnc1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819206625	CB	On-Demand	Bother	ADRB3	74	38
Cn1nnnc1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819206626	CB	On-Demand	Bother	ADRB3	74	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(-n2cncn2)c(Cl)c1	ZINC000819206661	GF	On-Demand	Anodyne	NPY2R	45	37
CC(=O)c1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819206667	CE	On-Demand	Anodyne	ADRB2	44	47
CC(=O)c1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819206667	CE	On-Demand	Anodyne	ADRB1	65	49
CC(=O)c1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819206667	CE	On-Demand	Anodyne	ADRB3	40	41
CC(=O)c1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819206667	CE	On-Demand	Anodyne	ABCB1	18	54
CC(=O)c1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819206668	CE	On-Demand	Anodyne	ADRB2	44	47
CC(=O)c1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819206668	CE	On-Demand	Anodyne	ADRB1	65	49
CC(=O)c1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819206668	CE	On-Demand	Anodyne	ADRB3	40	41
CC(=O)c1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819206668	CE	On-Demand	Anodyne	ABCB1	18	54
O=C(CCNOC1CCCC1)Nc1cccc(Br)c1	ZINC000819206674	EG	On-Demand	Anodyne	EGFR	23	40
O=C(CCNOC1CCCC1)Nc1cccc(Br)c1	ZINC000819206674	EG	On-Demand	Anodyne	HDAC2	19	42
CC(=O)c1cccc(OC[C@@H](O)CNOC2CCCC2)c1	ZINC000819206680	CE	On-Demand	Anodyne	ADRB2	40	48
CC(=O)c1cccc(OC[C@@H](O)CNOC2CCCC2)c1	ZINC000819206680	CE	On-Demand	Anodyne	ADRB1	57	44
CC(=O)c1cccc(OC[C@@H](O)CNOC2CCCC2)c1	ZINC000819206680	CE	On-Demand	Anodyne	ABCB1	27	49
CC(=O)c1cccc(OC[C@@H](O)CNOC2CCCC2)c1	ZINC000819206680	CE	On-Demand	Anodyne	PDS	41	35
CC(=O)c1cccc(OC[C@H](O)CNOC2CCCC2)c1	ZINC000819206681	CE	On-Demand	Anodyne	ADRB2	40	48
CC(=O)c1cccc(OC[C@H](O)CNOC2CCCC2)c1	ZINC000819206681	CE	On-Demand	Anodyne	ADRB1	57	44
CC(=O)c1cccc(OC[C@H](O)CNOC2CCCC2)c1	ZINC000819206681	CE	On-Demand	Anodyne	ABCB1	27	49
CC(=O)c1cccc(OC[C@H](O)CNOC2CCCC2)c1	ZINC000819206681	CE	On-Demand	Anodyne	PDS	41	35
COC(=O)c1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819206715	DD	On-Demand	Anodyne	ADRB2	52	50
COC(=O)c1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819206715	DD	On-Demand	Anodyne	ADRB1	73	49
COC(=O)c1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819206715	DD	On-Demand	Anodyne	ADRB3	49	43
COC(=O)c1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819206715	DD	On-Demand	Anodyne	ABCB1	15	43
COC(=O)c1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819206716	DD	On-Demand	Anodyne	ADRB2	52	50
COC(=O)c1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819206716	DD	On-Demand	Anodyne	ADRB1	73	49
COC(=O)c1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819206716	DD	On-Demand	Anodyne	ADRB3	49	43
COC(=O)c1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819206716	DD	On-Demand	Anodyne	ABCB1	15	43
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000819206722	GG	On-Demand	Bother	GPR119	43	47
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1[N+](=O)[O-]	ZINC000819206724	GG	On-Demand	Bother	GPR119	43	47
C#CCCN1CCN(C(=O)c2cnc3cc(OC)ccn23)CC1	ZINC000819206747	DD	On-Demand	Mild	DRD4	41	33
O=C(CCNOC1CCCC1)Nc1ccc(Cl)cc1	ZINC000819206766	CG	On-Demand	Anodyne	EPHX2	16	42
Cc1cc(C)n2nc(SCc3ccccc3C(=O)Nc3cccnc3Cl)nc2n1	ZINC000819206784	HI	On-Demand	Anodyne	G2YM83_BOTF4	71	36
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCSCC2)c(C)c1	ZINC000819206802	DI	On-Demand	Mild	NPY2R	42	48
O=C(CCc1ccccc1)NNC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819206811	FG	On-Demand	Reactive	GRIN2B	15	43
O[C@@H](CNCCc1cnccn1)c1ccc(F)c(Br)c1	ZINC000819206816	EE	On-Demand	Anodyne	ADRB1	30	41
O[C@@H](CNCCc1cnccn1)c1ccc(F)c(Br)c1	ZINC000819206816	EE	On-Demand	Anodyne	ADRB3	67	41
O[C@H](CNCCc1cnccn1)c1ccc(F)c(Br)c1	ZINC000819206819	EE	On-Demand	Anodyne	ADRB1	30	41
O[C@H](CNCCc1cnccn1)c1ccc(F)c(Br)c1	ZINC000819206819	EE	On-Demand	Anodyne	ADRB3	67	41
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206841	GG	On-Demand	Anodyne	ESR1	75	41
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206841	GG	On-Demand	Anodyne	ADRB2	71	46
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206841	GG	On-Demand	Anodyne	ADRB1	89	43
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206841	GG	On-Demand	Anodyne	SLC6A3	18	40
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206841	GG	On-Demand	Anodyne	ESR2	53	41
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206841	GG	On-Demand	Anodyne	ADRB3	113	43
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206841	GG	On-Demand	Anodyne	LTA4H	52	47
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206841	GG	On-Demand	Anodyne	HRH3	47	44
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206841	GG	On-Demand	Anodyne	PSMB2	42	44
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206841	GG	On-Demand	Anodyne	PSMB1	47	45
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206842	GG	On-Demand	Anodyne	ESR1	75	41
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206842	GG	On-Demand	Anodyne	ADRB2	71	46
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206842	GG	On-Demand	Anodyne	ADRB1	89	43
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206842	GG	On-Demand	Anodyne	SLC6A3	18	40
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206842	GG	On-Demand	Anodyne	ESR2	53	41
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206842	GG	On-Demand	Anodyne	ADRB3	113	43
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206842	GG	On-Demand	Anodyne	LTA4H	52	47
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206842	GG	On-Demand	Anodyne	HRH3	47	44
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206842	GG	On-Demand	Anodyne	PSMB2	42	44
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819206842	GG	On-Demand	Anodyne	PSMB1	47	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)CCc1ccccc1	ZINC000819206843	ED	On-Demand	Reactive	FPR1	44	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)CCc1ccccc1	ZINC000819206843	ED	On-Demand	Reactive	NAAA	42	39
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cnccn2)c1	ZINC000819206855	CD	On-Demand	Bother	ADRB2	37	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cnccn2)c1	ZINC000819206855	CD	On-Demand	Bother	ADRB1	50	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cnccn2)c1	ZINC000819206855	CD	On-Demand	Bother	ADRB3	127	43
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cnccn2)c1	ZINC000819206856	CD	On-Demand	Bother	ADRB2	37	42
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cnccn2)c1	ZINC000819206856	CD	On-Demand	Bother	ADRB1	50	42
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cnccn2)c1	ZINC000819206856	CD	On-Demand	Bother	ADRB3	127	43
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)C(F)(F)C2CCOCC2)CC1	ZINC000819206874	GD	On-Demand	Bother	SLC6A9	16	43
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819206878	HD	On-Demand	Bother	L3MBTL3	41	51
CC(C)n1ccc(CC(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)n1	ZINC000819206883	GD	On-Demand	Bother	COLA	68	32
CCOc1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1[N+](=O)[O-]	ZINC000819206912	IE	On-Demand	Bother	HCN1	50	34
CCOc1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1[N+](=O)[O-]	ZINC000819206912	IE	On-Demand	Bother	HCN4	42	32
CCOc1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1[N+](=O)[O-]	ZINC000819206912	IE	On-Demand	Bother	L3MBTL3	29	47
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)c2c(Cl)cccc2[N+](=O)[O-])CC1	ZINC000819206918	HF	On-Demand	Bother	L3MBTL3	31	44
CCC(=O)c1cc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)ccc1F	ZINC000819206920	GI	On-Demand	Anodyne	HDAC6	36	44
CC(C)(C)OC(=O)N[C@H]1CC[C@@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819206926	IF	On-Demand	Bother	SFRP1	60	36
CC(C)(C)OC(=O)N[C@H]1CC[C@@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819206926	IF	On-Demand	Bother	WNT3	57	36
CC(C)(C)OC(=O)N[C@H]1CC[C@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819206927	IF	On-Demand	Bother	SFRP1	60	36
CC(C)(C)OC(=O)N[C@H]1CC[C@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819206927	IF	On-Demand	Bother	WNT3	57	36
C=C1c2ccccc2C(=O)N1CC(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819206959	GG	On-Demand	Anodyne	ABCB1B	58	36
C=C1c2ccccc2C(=O)N1CC(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819206959	GG	On-Demand	Anodyne	ABCB1	19	45
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	ZINC000819206971	FD	On-Demand	Anodyne	DGAT1	41	48
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	ZINC000819206972	FD	On-Demand	Anodyne	DGAT1	41	48
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	ZINC000819206973	FD	On-Demand	Anodyne	DGAT1	41	48
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1	ZINC000819206974	FD	On-Demand	Anodyne	DGAT1	41	48
N#CCc1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819206992	CD	On-Demand	Mild	ADRB2	38	44
N#CCc1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819206992	CD	On-Demand	Mild	ADRB1	58	51
N#CCc1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819206993	CD	On-Demand	Mild	ADRB2	38	44
N#CCc1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819206993	CD	On-Demand	Mild	ADRB1	58	51
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207023	FG	On-Demand	Anodyne	ESR1	85	42
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207023	FG	On-Demand	Anodyne	ADRB2	97	53
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207023	FG	On-Demand	Anodyne	ADRB1	127	48
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207023	FG	On-Demand	Anodyne	SLC6A3	29	45
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207023	FG	On-Demand	Anodyne	KCNH2	16	41
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207023	FG	On-Demand	Anodyne	ESR2	59	42
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207023	FG	On-Demand	Anodyne	ADRB3	176	56
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207023	FG	On-Demand	Anodyne	LTA4H	99	62
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207023	FG	On-Demand	Anodyne	HRH3	70	57
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207023	FG	On-Demand	Anodyne	SIGMAR1	21	50
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207023	FG	On-Demand	Anodyne	HNMT	44	43
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207023	FG	On-Demand	Anodyne	TNK2	20	46
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207023	FG	On-Demand	Anodyne	PSMB2	50	49
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207023	FG	On-Demand	Anodyne	PSMB1	55	50
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207024	FG	On-Demand	Anodyne	ESR1	85	42
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207024	FG	On-Demand	Anodyne	ADRB2	97	53
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207024	FG	On-Demand	Anodyne	ADRB1	127	48
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207024	FG	On-Demand	Anodyne	SLC6A3	29	45
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207024	FG	On-Demand	Anodyne	KCNH2	16	41
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207024	FG	On-Demand	Anodyne	ESR2	59	42
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207024	FG	On-Demand	Anodyne	ADRB3	176	56
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207024	FG	On-Demand	Anodyne	LTA4H	99	62
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207024	FG	On-Demand	Anodyne	HRH3	70	57
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207024	FG	On-Demand	Anodyne	SIGMAR1	21	50
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207024	FG	On-Demand	Anodyne	HNMT	44	43
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207024	FG	On-Demand	Anodyne	TNK2	20	46
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207024	FG	On-Demand	Anodyne	PSMB2	50	49
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1	ZINC000819207024	FG	On-Demand	Anodyne	PSMB1	55	50
C#CCCN1CCN(C(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819207045	EC	On-Demand	Mild	DRD4	48	37
C#CCCN1CCN(C(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819207047	EC	On-Demand	Mild	DRD4	48	37
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)Nc2cccnc2Cl)cc1	ZINC000819207056	HG	On-Demand	Anodyne	FKBP1A	15	42
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)Nc2cccnc2Cl)cc1	ZINC000819207056	HG	On-Demand	Anodyne	MMP13	36	46
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)Nc2cccnc2Cl)cc1	ZINC000819207056	HG	On-Demand	Anodyne	CAPNS1	15	41
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)Nc2cccnc2Cl)cc1	ZINC000819207056	HG	On-Demand	Anodyne	MMP3	34	46
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)Nc2cccnc2Cl)cc1	ZINC000819207056	HG	On-Demand	Anodyne	MMP7	44	46
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)Nc2cccnc2Cl)cc1	ZINC000819207056	HG	On-Demand	Anodyne	MMP1	42	46
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)Nc2cccnc2Cl)cc1	ZINC000819207056	HG	On-Demand	Anodyne	G2YM83_BOTF4	59	35
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)Nc2cccnc2Cl)cc1	ZINC000819207058	HG	On-Demand	Anodyne	FKBP1A	15	42
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)Nc2cccnc2Cl)cc1	ZINC000819207058	HG	On-Demand	Anodyne	MMP13	36	46
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)Nc2cccnc2Cl)cc1	ZINC000819207058	HG	On-Demand	Anodyne	CAPNS1	15	41
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)Nc2cccnc2Cl)cc1	ZINC000819207058	HG	On-Demand	Anodyne	MMP3	34	46
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)Nc2cccnc2Cl)cc1	ZINC000819207058	HG	On-Demand	Anodyne	MMP7	44	46
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)Nc2cccnc2Cl)cc1	ZINC000819207058	HG	On-Demand	Anodyne	MMP1	42	46
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)Nc2cccnc2Cl)cc1	ZINC000819207058	HG	On-Demand	Anodyne	G2YM83_BOTF4	59	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cnn(Cc2ccccn2)c1	ZINC000819207071	FE	On-Demand	Anodyne	PANC	57	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(Oc3ccccc3)nc1)C2	ZINC000819207072	GG	On-Demand	Anodyne	VHL	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(Oc3ccccc3)nc1)C2	ZINC000819207074	GG	On-Demand	Anodyne	VHL	40	31
O=C(Nc1cnn(Cc2ccncc2)c1)C(F)=C1CCC1	ZINC000819207076	CF	On-Demand	Anodyne	ITK	15	42
O=C(Nc1cnn(Cc2ccncc2)c1)C(F)=C1CCC1	ZINC000819207076	CF	On-Demand	Anodyne	RPS6KA3	18	46
O=C(Nc1cnn(Cc2ccncc2)c1)C(F)=C1CCC1	ZINC000819207076	CF	On-Demand	Anodyne	PANC	54	37
COc1ccc([C@@H]2CCN(C(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)C2)cc1	ZINC000819207077	FF	On-Demand	Anodyne	NPBWR1	66	32
O=C(CCNOC1CCCC1)Nc1ccccc1	ZINC000819207088	BE	On-Demand	Anodyne	LTA4H	33	40
O=C(CCNOC1CCCC1)Nc1ccccc1	ZINC000819207088	BE	On-Demand	Anodyne	HDAC8	23	48
O=C(CCNOC1CCCC1)Nc1ccccc1	ZINC000819207088	BE	On-Demand	Anodyne	HDAC10	46	48
O=C(CCNOC1CCCC1)Nc1ccccc1	ZINC000819207088	BE	On-Demand	Anodyne	HDAC1	18	48
O=C(CCNOC1CCCC1)Nc1ccccc1	ZINC000819207088	BE	On-Demand	Anodyne	HDAC2	30	48
O=C(CCNOC1CCCC1)Nc1ccccc1	ZINC000819207088	BE	On-Demand	Anodyne	HDAC3	31	48
O=C(CCNOC1CCCC1)Nc1ccccc1	ZINC000819207088	BE	On-Demand	Anodyne	HDAC6	34	48
O=C(CCNOC1CCCC1)Nc1ccccc1	ZINC000819207088	BE	On-Demand	Anodyne	HDAC11	38	48
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207094	GG	On-Demand	Anodyne	ESR1	77	39
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207094	GG	On-Demand	Anodyne	ADRB2	51	47
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207094	GG	On-Demand	Anodyne	ADRB1	76	47
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207094	GG	On-Demand	Anodyne	KCNH2	16	43
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207094	GG	On-Demand	Anodyne	ESR2	54	40
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207094	GG	On-Demand	Anodyne	ADRB3	73	47
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207094	GG	On-Demand	Anodyne	LTA4H	55	48
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207094	GG	On-Demand	Anodyne	HRH3	49	47
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207094	GG	On-Demand	Anodyne	PSMB2	42	44
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207094	GG	On-Demand	Anodyne	PSMB1	47	44
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207096	GG	On-Demand	Anodyne	ESR1	77	39
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207096	GG	On-Demand	Anodyne	ADRB2	51	47
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207096	GG	On-Demand	Anodyne	ADRB1	76	47
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207096	GG	On-Demand	Anodyne	KCNH2	16	43
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207096	GG	On-Demand	Anodyne	ESR2	54	40
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207096	GG	On-Demand	Anodyne	ADRB3	73	47
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207096	GG	On-Demand	Anodyne	LTA4H	55	48
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207096	GG	On-Demand	Anodyne	HRH3	49	47
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207096	GG	On-Demand	Anodyne	PSMB2	42	44
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819207096	GG	On-Demand	Anodyne	PSMB1	47	44
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207113	FF	On-Demand	Anodyne	ESR1	58	36
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207113	FF	On-Demand	Anodyne	ADRB2	44	43
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207113	FF	On-Demand	Anodyne	ADRB1	62	43
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207113	FF	On-Demand	Anodyne	ESR2	40	37
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207113	FF	On-Demand	Anodyne	ADRB3	85	43
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207113	FF	On-Demand	Anodyne	LTA4H	55	47
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207113	FF	On-Demand	Anodyne	HRH3	43	44
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207113	FF	On-Demand	Anodyne	TNK2	15	40
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207113	FF	On-Demand	Anodyne	PSMB2	42	44
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207113	FF	On-Demand	Anodyne	PSMB1	46	44
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207114	FF	On-Demand	Anodyne	ESR1	58	36
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207114	FF	On-Demand	Anodyne	ADRB2	44	43
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207114	FF	On-Demand	Anodyne	ADRB1	62	43
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207114	FF	On-Demand	Anodyne	ESR2	40	37
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207114	FF	On-Demand	Anodyne	ADRB3	85	43
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207114	FF	On-Demand	Anodyne	LTA4H	55	47
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207114	FF	On-Demand	Anodyne	HRH3	43	44
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207114	FF	On-Demand	Anodyne	TNK2	15	40
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207114	FF	On-Demand	Anodyne	PSMB2	42	44
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cn1	ZINC000819207114	FF	On-Demand	Anodyne	PSMB1	46	44
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819207117	GG	On-Demand	Anodyne	ESR1	73	39
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819207117	GG	On-Demand	Anodyne	ADRB2	58	47
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819207117	GG	On-Demand	Anodyne	ADRB1	76	47
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819207117	GG	On-Demand	Anodyne	KCNH2	16	41
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819207117	GG	On-Demand	Anodyne	ESR2	50	39
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819207117	GG	On-Demand	Anodyne	ADRB3	66	47
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819207117	GG	On-Demand	Anodyne	LTA4H	52	46
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819207117	GG	On-Demand	Anodyne	HRH3	47	44
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819207117	GG	On-Demand	Anodyne	PSMB2	42	42
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819207117	GG	On-Demand	Anodyne	PSMB1	46	42
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819207122	GG	On-Demand	Anodyne	ESR1	80	41
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819207122	GG	On-Demand	Anodyne	ADRB2	60	48
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819207122	GG	On-Demand	Anodyne	ADRB1	79	48
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819207122	GG	On-Demand	Anodyne	ESR2	55	41
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819207122	GG	On-Demand	Anodyne	ADRB3	70	48
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819207122	GG	On-Demand	Anodyne	LTA4H	54	47
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819207122	GG	On-Demand	Anodyne	HRH3	44	48
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819207122	GG	On-Demand	Anodyne	PSMB2	42	44
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819207122	GG	On-Demand	Anodyne	PSMB1	46	44
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819207123	GG	On-Demand	Anodyne	ESR1	80	41
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819207123	GG	On-Demand	Anodyne	ADRB2	60	48
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819207123	GG	On-Demand	Anodyne	ADRB1	79	48
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819207123	GG	On-Demand	Anodyne	ESR2	55	41
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819207123	GG	On-Demand	Anodyne	ADRB3	70	48
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819207123	GG	On-Demand	Anodyne	LTA4H	54	47
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819207123	GG	On-Demand	Anodyne	HRH3	44	48
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819207123	GG	On-Demand	Anodyne	PSMB2	42	44
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819207123	GG	On-Demand	Anodyne	PSMB1	46	44
Cc1cccc2c1OCC[C@@H]2NC(=O)C[C@@H](C)n1cccn1	ZINC000819207135	CF	On-Demand	Anodyne	LUXR	50	32
Cc1cccc2c1OCC[C@@H]2NC(=O)C[C@@H](C)n1cccn1	ZINC000819207135	CF	On-Demand	Anodyne	TRAR	65	32
Cc1cccc2c1OCC[C@@H]2NC(=O)C[C@H](C)n1cccn1	ZINC000819207136	CF	On-Demand	Anodyne	LUXR	50	32
Cc1cccc2c1OCC[C@@H]2NC(=O)C[C@H](C)n1cccn1	ZINC000819207136	CF	On-Demand	Anodyne	TRAR	65	32
C[C@@]1(CNC[C@@H](O)c2cccnc2)CCCc2ccccc21	ZINC000819207152	CF	On-Demand	Anodyne	ADRB3	79	40
C[C@@]1(CNC[C@H](O)c2cccnc2)CCCc2ccccc21	ZINC000819207153	CF	On-Demand	Anodyne	ADRB3	79	40
C[C@]1(CNC[C@H](O)c2cccnc2)CCCc2ccccc21	ZINC000819207154	CF	On-Demand	Anodyne	ADRB3	79	40
C[C@]1(CNC[C@@H](O)c2cccnc2)CCCc2ccccc21	ZINC000819207155	CF	On-Demand	Anodyne	ADRB3	79	40
CO[C@@H](c1ccc(Br)cc1)[C@H](C)NC[C@H](O)c1ccccc1	ZINC000819207157	FH	On-Demand	Anodyne	ADRB2	16	57
CO[C@@H](c1ccc(Br)cc1)[C@H](C)NC[C@H](O)c1ccccc1	ZINC000819207157	FH	On-Demand	Anodyne	AOC3	15	40
CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819207158	FH	On-Demand	Anodyne	ADRB2	16	57
CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819207158	FH	On-Demand	Anodyne	AOC3	15	40
CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819207159	FH	On-Demand	Anodyne	ADRB2	16	57
CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819207159	FH	On-Demand	Anodyne	AOC3	15	40
CO[C@@H](c1ccc(Br)cc1)[C@H](C)NC[C@@H](O)c1ccccc1	ZINC000819207161	FH	On-Demand	Anodyne	ADRB2	16	57
CO[C@@H](c1ccc(Br)cc1)[C@H](C)NC[C@@H](O)c1ccccc1	ZINC000819207161	FH	On-Demand	Anodyne	AOC3	15	40
COC(=O)N[C@@H](CC(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207168	HD	On-Demand	Bother	COLA	44	31
COC(=O)N[C@@H](CC(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207168	HD	On-Demand	Bother	CAPNS1	51	32
COC(=O)N[C@@H](CC(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207168	HD	On-Demand	Bother	CAPN1	43	36
COC(=O)N[C@@H](CC(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207168	HD	On-Demand	Bother	CAPN2	58	34
COC(=O)N[C@@H](CC(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207168	HD	On-Demand	Bother	FPR1	40	33
COC(=O)N[C@H](CC(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207169	HD	On-Demand	Bother	COLA	44	31
COC(=O)N[C@H](CC(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207169	HD	On-Demand	Bother	CAPNS1	51	32
COC(=O)N[C@H](CC(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207169	HD	On-Demand	Bother	CAPN1	43	36
COC(=O)N[C@H](CC(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207169	HD	On-Demand	Bother	CAPN2	58	34
COC(=O)N[C@H](CC(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207169	HD	On-Demand	Bother	FPR1	40	33
Nc1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1[N+](=O)[O-]	ZINC000819207176	GD	On-Demand	Bother	L3MBTL3	38	53
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	ACE	24	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	CELA1	25	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	ELANE	31	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	CTRA_BOVIN	40	31
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	GSTM2	15	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	KLK3	70	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	CTSB	56	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	PAPA1_CARPA	67	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	CYSP_TRYCR	54	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	CTSK	35	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	CTSL	43	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	COLA	42	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	PREP	17	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	CAPNS1	71	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	CTSS	19	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	CAPN1	72	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	CAPN2	109	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	TGM2	38	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	NPR	72	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	PSMB5	40	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	Q6PRC7_IXORI	43	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207181	IE	On-Demand	Bother	SLC12A5	42	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cnn(Cc3ccccn3)c1)C2	ZINC000819207191	FE	On-Demand	Anodyne	PANC	54	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cnn(Cc3ccccn3)c1)C2	ZINC000819207192	FE	On-Demand	Anodyne	PANC	54	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](c3ccc(OC)cc3)C1)C2	ZINC000819207193	FF	On-Demand	Anodyne	ADAM10	18	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](c3ccc(OC)cc3)C1)C2	ZINC000819207193	FF	On-Demand	Anodyne	NPBWR1	58	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](c3ccc(OC)cc3)C1)C2	ZINC000819207194	FF	On-Demand	Anodyne	ADAM10	18	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](c3ccc(OC)cc3)C1)C2	ZINC000819207194	FF	On-Demand	Anodyne	NPBWR1	58	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3ccc(OC)cc3)C1)C2	ZINC000819207195	FF	On-Demand	Anodyne	ADAM10	18	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3ccc(OC)cc3)C1)C2	ZINC000819207195	FF	On-Demand	Anodyne	NPBWR1	58	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3ccc(OC)cc3)C1)C2	ZINC000819207196	FF	On-Demand	Anodyne	ADAM10	18	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3ccc(OC)cc3)C1)C2	ZINC000819207196	FF	On-Demand	Anodyne	NPBWR1	58	31
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207214	FG	On-Demand	Anodyne	ESR1	77	39
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207214	FG	On-Demand	Anodyne	ADRB2	64	47
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207214	FG	On-Demand	Anodyne	ADRB1	92	47
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207214	FG	On-Demand	Anodyne	KCNH2	15	41
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207214	FG	On-Demand	Anodyne	ESR2	53	38
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207214	FG	On-Demand	Anodyne	ADRB3	92	47
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207214	FG	On-Demand	Anodyne	LTA4H	76	54
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207214	FG	On-Demand	Anodyne	HRH3	56	45
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207214	FG	On-Demand	Anodyne	HNMT	36	41
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207214	FG	On-Demand	Anodyne	TNK2	15	41
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207214	FG	On-Demand	Anodyne	PSMB2	46	45
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207214	FG	On-Demand	Anodyne	PSMB1	50	45
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207215	FG	On-Demand	Anodyne	ESR1	77	39
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207215	FG	On-Demand	Anodyne	ADRB2	64	47
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207215	FG	On-Demand	Anodyne	ADRB1	92	47
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207215	FG	On-Demand	Anodyne	KCNH2	15	41
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207215	FG	On-Demand	Anodyne	ESR2	53	38
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207215	FG	On-Demand	Anodyne	ADRB3	92	47
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207215	FG	On-Demand	Anodyne	LTA4H	76	54
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207215	FG	On-Demand	Anodyne	HRH3	56	45
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207215	FG	On-Demand	Anodyne	HNMT	36	41
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207215	FG	On-Demand	Anodyne	TNK2	15	41
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207215	FG	On-Demand	Anodyne	PSMB2	46	45
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccccc1F	ZINC000819207215	FG	On-Demand	Anodyne	PSMB1	50	45
CN(C)CCn1cc(NC(=O)/C=C\[C@H]2CCCO2)cn1	ZINC000819207224	CD	On-Demand	Anodyne	PANC	40	30
CN(C)CCn1cc(NC(=O)/C=C/[C@@H]2CCCO2)cn1	ZINC000819207226	CD	On-Demand	Anodyne	PANC	40	30
CN(C)CCn1cc(NC(=O)/C=C\[C@@H]2CCCO2)cn1	ZINC000819207228	CD	On-Demand	Anodyne	PANC	40	30
C#CCNS(=O)(=O)c1cccc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)c1	ZINC000819207230	HE	On-Demand	Mild	DRD4	42	34
C#CCNS(=O)(=O)c1cccc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)c1	ZINC000819207230	HE	On-Demand	Mild	ABCB1B	51	34
C#CCNS(=O)(=O)c1cccc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)c1	ZINC000819207230	HE	On-Demand	Mild	AKR1C3	53	38
CN(C)CCn1cc(NC(=O)/C=C/[C@H]2CCCO2)cn1	ZINC000819207231	CD	On-Demand	Anodyne	PANC	40	30
O=C(c1ccnc(-n2ccnc2)c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207234	HD	On-Demand	Bother	L3MBTL3	15	41
C[C@@H](CC(=O)N1CCc2cc(C(C)(C)C)ccc21)n1cccn1	ZINC000819207244	DH	On-Demand	Anodyne	EIF2AK3	67	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1(c3ccccc3OC)CC1)C2	ZINC000819207245	FF	On-Demand	Anodyne	KCNA3	43	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1(c3ccccc3OC)CC1)C2	ZINC000819207248	FF	On-Demand	Anodyne	KCNA3	43	36
CSc1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819207255	CF	On-Demand	Anodyne	ADRB2	37	43
CSc1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819207255	CF	On-Demand	Anodyne	ADRB1	48	50
CSc1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819207258	CF	On-Demand	Anodyne	ADRB2	37	43
CSc1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819207258	CF	On-Demand	Anodyne	ADRB1	48	50
O=C(CCc1ccccc1)NNC(=O)C(F)=C1CCC1	ZINC000819207274	CE	On-Demand	Reactive	VIPR1	22	42
O=C(c1ccc([N+](=O)[O-])cc1F)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207289	HE	On-Demand	Bother	SLC6A9	26	48
CN1CCC(CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819207299	FE	On-Demand	Mild	PAPA1_CARPA	41	54
CN1CCC(CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819207302	FE	On-Demand	Mild	PAPA1_CARPA	41	54
O=C(NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819207313	FF	On-Demand	Anodyne	DRD4	15	42
O[C@@H](CNCCc1cnccn1)c1ccc(Cl)c(F)c1	ZINC000819207316	CE	On-Demand	Anodyne	ADRB3	70	39
O[C@H](CNCCc1cnccn1)c1ccc(Cl)c(F)c1	ZINC000819207318	CE	On-Demand	Anodyne	ADRB3	70	39
CO[C@@H](C)CC(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207323	ED	On-Demand	Bother	COLA	80	33
O[C@@H](CNOC1CCCC1)COC(c1ccccc1)c1ccccc1	ZINC000819207335	EH	On-Demand	Anodyne	CASR	17	45
O[C@H](CNOC1CCCC1)COC(c1ccccc1)c1ccccc1	ZINC000819207337	EH	On-Demand	Anodyne	CASR	17	45
O=C(CCNOC1CCCC1)Nc1cccc(Cl)c1	ZINC000819207339	CG	On-Demand	Anodyne	GRM5	15	42
O=C(CCNOC1CCCC1)Nc1cccc(Cl)c1	ZINC000819207339	CG	On-Demand	Anodyne	MCHR1	21	40
O[C@@H](CNCCc1cnccn1)c1cccc(Cl)c1	ZINC000819207364	CD	On-Demand	Anodyne	ADRB2	63	46
O[C@@H](CNCCc1cnccn1)c1cccc(Cl)c1	ZINC000819207364	CD	On-Demand	Anodyne	ADRB1	82	53
O[C@@H](CNCCc1cnccn1)c1cccc(Cl)c1	ZINC000819207364	CD	On-Demand	Anodyne	ADRB3	154	53
O[C@H](CNCCc1cnccn1)c1cccc(Cl)c1	ZINC000819207366	CD	On-Demand	Anodyne	ADRB2	63	46
O[C@H](CNCCc1cnccn1)c1cccc(Cl)c1	ZINC000819207366	CD	On-Demand	Anodyne	ADRB1	82	53
O[C@H](CNCCc1cnccn1)c1cccc(Cl)c1	ZINC000819207366	CD	On-Demand	Anodyne	ADRB3	154	53
CCc1nc2ccc(C(=O)Nc3cccnc3Cl)cc2nc1CC	ZINC000819207367	EI	On-Demand	Anodyne	PRNP	41	36
CCc1nc2ccc(C(=O)Nc3cccnc3Cl)cc2nc1CC	ZINC000819207367	EI	On-Demand	Anodyne	GRM4	18	40
CCc1nc2ccc(C(=O)Nc3cccnc3Cl)cc2nc1CC	ZINC000819207367	EI	On-Demand	Anodyne	KCNK3	41	36
CCc1nc2ccc(C(=O)Nc3cccnc3Cl)cc2nc1CC	ZINC000819207367	EI	On-Demand	Anodyne	G2YM83_BOTF4	78	45
O=C(c1cnc(O)c([N+](=O)[O-])c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207369	HD	On-Demand	Bother	L3MBTL3	23	46
O[C@H](CNCCc1cnccn1)c1cc2ccccc2o1	ZINC000819207371	CE	On-Demand	Anodyne	ADRB3	49	40
O=C(c1cccc(C2OCCO2)c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207380	HE	On-Demand	Bother	L3MBTL3	37	48
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)C2CCCCCCC2)CC1	ZINC000819207385	FG	On-Demand	Bother	L3MBTL3	63	48
COc1ccc(-n2c(C)nnc2SCC(=O)Nc2cccnc2Cl)cc1	ZINC000819207401	GG	On-Demand	Anodyne	ENPP1	52	36
COc1ccc(-n2c(C)nnc2SCC(=O)Nc2cccnc2Cl)cc1	ZINC000819207401	GG	On-Demand	Anodyne	FAS	34	42
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)c(C)c1	ZINC000819207404	HH	On-Demand	Anodyne	EPHX2	49	68
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)c(C)c1	ZINC000819207404	HH	On-Demand	Anodyne	TYK2	45	35
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)c(C)c1	ZINC000819207404	HH	On-Demand	Anodyne	G2YM83_BOTF4	66	34
CC[C@H](C#N)NC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819207408	FD	On-Demand	Mild	LGMN	56	32
O=C(Nc1ccc(Br)cc1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819207409	GI	On-Demand	Anodyne	EPHX2	22	47
CC[C@H](C#N)NC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819207410	FD	On-Demand	Mild	LGMN	56	32
O=CNc1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000819207429	GD	On-Demand	Bother	AVPR2	17	48
O=CNc1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000819207429	GD	On-Demand	Bother	L3MBTL3	44	44
C[C@@H](CC(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)C1CC1	ZINC000819207444	EE	On-Demand	Bother	COLA	41	31
COc1cccc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)n1	ZINC000819207449	EF	On-Demand	Anodyne	ABCB1B	60	37
COc1cccc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)n1	ZINC000819207449	EF	On-Demand	Anodyne	ABCB1	21	46
COc1cccc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)n1	ZINC000819207449	EF	On-Demand	Anodyne	ALS	51	36
C[C@@](O)(C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)C1CCC1	ZINC000819207452	FD	On-Demand	Bother	L3MBTL3	19	42
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819207454	IF	On-Demand	Bother	PREP	35	45
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819207454	IF	On-Demand	Bother	SFRP1	65	45
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819207454	IF	On-Demand	Bother	WNT3	64	40
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819207455	IF	On-Demand	Bother	PREP	35	45
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819207455	IF	On-Demand	Bother	SFRP1	65	45
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819207455	IF	On-Demand	Bother	WNT3	64	40
O=C(c1ccnc(Br)c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207456	HE	On-Demand	Bother	L3MBTL3	28	46
O=C(NCCCNC(=O)c1ccccc1)C(F)=C1CCC1	ZINC000819207467	CE	On-Demand	Anodyne	DRD3	26	40
O=C(NCCCNC(=O)c1ccccc1)C(F)=C1CCC1	ZINC000819207467	CE	On-Demand	Anodyne	BCHE	24	42
O=C(CCNOC1CCCC1)Nc1cccnc1	ZINC000819207470	BD	On-Demand	Anodyne	CHRNA7	26	41
O=C(CCNOC1CCCC1)Nc1cccnc1	ZINC000819207470	BD	On-Demand	Anodyne	NAMPT	34	46
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCSCC3)c(C)c2)c1	ZINC000819207475	GH	On-Demand	Anodyne	HTR1D	24	42
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCSCC3)c(C)c2)c1	ZINC000819207475	GH	On-Demand	Anodyne	HTR1B	25	42
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCSCC3)c(C)c2)c1	ZINC000819207475	GH	On-Demand	Anodyne	NPY2R	34	43
O[C@H](CNOC1CCCC1)COc1ccccc1C(F)(F)F	ZINC000819207493	DF	On-Demand	Anodyne	ADRB2	33	46
O[C@H](CNOC1CCCC1)COc1ccccc1C(F)(F)F	ZINC000819207493	DF	On-Demand	Anodyne	ADRB1	44	46
O[C@H](CNOC1CCCC1)COc1ccccc1C(F)(F)F	ZINC000819207493	DF	On-Demand	Anodyne	ABCB1	21	44
O[C@@H](CNOC1CCCC1)COc1ccccc1C(F)(F)F	ZINC000819207494	DF	On-Demand	Anodyne	ADRB2	33	46
O[C@@H](CNOC1CCCC1)COc1ccccc1C(F)(F)F	ZINC000819207494	DF	On-Demand	Anodyne	ADRB1	44	46
O[C@@H](CNOC1CCCC1)COc1ccccc1C(F)(F)F	ZINC000819207494	DF	On-Demand	Anodyne	ABCB1	21	44
O=C(/C=C\[C@H]1CCCO1)Nc1cnn(Cc2ccccn2)c1	ZINC000819207495	CE	On-Demand	Anodyne	RPS6KA3	18	45
O=C(/C=C\[C@H]1CCCO1)Nc1cnn(Cc2ccccn2)c1	ZINC000819207495	CE	On-Demand	Anodyne	PANC	52	35
O=C(/C=C/[C@@H]1CCCO1)Nc1cnn(Cc2ccccn2)c1	ZINC000819207496	CE	On-Demand	Anodyne	RPS6KA3	18	45
O=C(/C=C/[C@@H]1CCCO1)Nc1cnn(Cc2ccccn2)c1	ZINC000819207496	CE	On-Demand	Anodyne	PANC	52	35
O=C(/C=C/[C@H]1CCCO1)Nc1cnn(Cc2ccccn2)c1	ZINC000819207497	CE	On-Demand	Anodyne	RPS6KA3	18	45
O=C(/C=C/[C@H]1CCCO1)Nc1cnn(Cc2ccccn2)c1	ZINC000819207497	CE	On-Demand	Anodyne	PANC	52	35
O=C(/C=C\[C@@H]1CCCO1)Nc1cnn(Cc2ccccn2)c1	ZINC000819207498	CE	On-Demand	Anodyne	RPS6KA3	18	45
O=C(/C=C\[C@@H]1CCCO1)Nc1cnn(Cc2ccccn2)c1	ZINC000819207498	CE	On-Demand	Anodyne	PANC	52	35
O=C(/C=C\[C@H]1CCCO1)Nc1cnn(Cc2ccncc2)c1	ZINC000819207501	CE	On-Demand	Anodyne	RPS6KA3	18	43
O=C(/C=C\[C@H]1CCCO1)Nc1cnn(Cc2ccncc2)c1	ZINC000819207501	CE	On-Demand	Anodyne	PANC	57	38
O=C(/C=C/[C@@H]1CCCO1)Nc1cnn(Cc2ccncc2)c1	ZINC000819207502	CE	On-Demand	Anodyne	RPS6KA3	18	43
O=C(/C=C/[C@@H]1CCCO1)Nc1cnn(Cc2ccncc2)c1	ZINC000819207502	CE	On-Demand	Anodyne	PANC	57	38
O=C(/C=C\[C@@H]1CCCO1)Nc1cnn(Cc2ccncc2)c1	ZINC000819207503	CE	On-Demand	Anodyne	RPS6KA3	18	43
O=C(/C=C\[C@@H]1CCCO1)Nc1cnn(Cc2ccncc2)c1	ZINC000819207503	CE	On-Demand	Anodyne	PANC	57	38
O[C@@H](CCc1ccccc1)CNOC1CCCC1	ZINC000819207504	BE	On-Demand	Anodyne	SLC18A2	49	37
O[C@@H](CCc1ccccc1)CNOC1CCCC1	ZINC000819207504	BE	On-Demand	Anodyne	ABCB1	21	41
O=C(/C=C/[C@H]1CCCO1)Nc1cnn(Cc2ccncc2)c1	ZINC000819207505	CE	On-Demand	Anodyne	RPS6KA3	18	43
O=C(/C=C/[C@H]1CCCO1)Nc1cnn(Cc2ccncc2)c1	ZINC000819207505	CE	On-Demand	Anodyne	PANC	57	38
O[C@H](CCc1ccccc1)CNOC1CCCC1	ZINC000819207506	BE	On-Demand	Anodyne	SLC18A2	49	37
O[C@H](CCc1ccccc1)CNOC1CCCC1	ZINC000819207506	BE	On-Demand	Anodyne	ABCB1	21	41
COc1ccccc1N1CC[C@H](CNC(=O)/C=C\[C@@H]2CCCO2)C1	ZINC000819207523	EE	On-Demand	Anodyne	HTR1A	59	43
COc1ccccc1N1CC[C@H](CNC(=O)/C=C\[C@@H]2CCCO2)C1	ZINC000819207523	EE	On-Demand	Anodyne	DRD2	42	43
COc1ccccc1N1CC[C@H](CNC(=O)/C=C\[C@@H]2CCCO2)C1	ZINC000819207523	EE	On-Demand	Anodyne	DRD4	25	40
COc1ccccc1N1CC[C@H](CNC(=O)/C=C\[C@@H]2CCCO2)C1	ZINC000819207523	EE	On-Demand	Anodyne	ADRA1D	44	37
COc1ccccc1N1CC[C@H](CNC(=O)/C=C\[C@@H]2CCCO2)C1	ZINC000819207523	EE	On-Demand	Anodyne	DRD3	48	41
COc1ccccc1N1CC[C@H](CNC(=O)/C=C\[C@@H]2CCCO2)C1	ZINC000819207523	EE	On-Demand	Anodyne	HTR7	40	40
COc1ccccc1N1CC[C@H](CNC(=O)/C=C/[C@H]2CCCO2)C1	ZINC000819207525	EE	On-Demand	Anodyne	HTR1A	59	43
COc1ccccc1N1CC[C@H](CNC(=O)/C=C/[C@H]2CCCO2)C1	ZINC000819207525	EE	On-Demand	Anodyne	DRD2	42	43
COc1ccccc1N1CC[C@H](CNC(=O)/C=C/[C@H]2CCCO2)C1	ZINC000819207525	EE	On-Demand	Anodyne	DRD4	25	40
COc1ccccc1N1CC[C@H](CNC(=O)/C=C/[C@H]2CCCO2)C1	ZINC000819207525	EE	On-Demand	Anodyne	ADRA1D	44	37
COc1ccccc1N1CC[C@H](CNC(=O)/C=C/[C@H]2CCCO2)C1	ZINC000819207525	EE	On-Demand	Anodyne	DRD3	48	41
COc1ccccc1N1CC[C@H](CNC(=O)/C=C/[C@H]2CCCO2)C1	ZINC000819207525	EE	On-Demand	Anodyne	HTR7	40	40
COc1ccccc1N1CC[C@H](CNC(=O)/C=C\[C@H]2CCCO2)C1	ZINC000819207526	EE	On-Demand	Anodyne	HTR1A	59	43
COc1ccccc1N1CC[C@H](CNC(=O)/C=C\[C@H]2CCCO2)C1	ZINC000819207526	EE	On-Demand	Anodyne	DRD2	42	43
COc1ccccc1N1CC[C@H](CNC(=O)/C=C\[C@H]2CCCO2)C1	ZINC000819207526	EE	On-Demand	Anodyne	DRD4	25	40
COc1ccccc1N1CC[C@H](CNC(=O)/C=C\[C@H]2CCCO2)C1	ZINC000819207526	EE	On-Demand	Anodyne	ADRA1D	44	37
COc1ccccc1N1CC[C@H](CNC(=O)/C=C\[C@H]2CCCO2)C1	ZINC000819207526	EE	On-Demand	Anodyne	DRD3	48	41
COc1ccccc1N1CC[C@H](CNC(=O)/C=C\[C@H]2CCCO2)C1	ZINC000819207526	EE	On-Demand	Anodyne	HTR7	40	40
COc1ccccc1N1CC[C@H](CNC(=O)/C=C/[C@@H]2CCCO2)C1	ZINC000819207528	EE	On-Demand	Anodyne	HTR1A	59	43
COc1ccccc1N1CC[C@H](CNC(=O)/C=C/[C@@H]2CCCO2)C1	ZINC000819207528	EE	On-Demand	Anodyne	DRD2	42	43
COc1ccccc1N1CC[C@H](CNC(=O)/C=C/[C@@H]2CCCO2)C1	ZINC000819207528	EE	On-Demand	Anodyne	DRD4	25	40
COc1ccccc1N1CC[C@H](CNC(=O)/C=C/[C@@H]2CCCO2)C1	ZINC000819207528	EE	On-Demand	Anodyne	ADRA1D	44	37
COc1ccccc1N1CC[C@H](CNC(=O)/C=C/[C@@H]2CCCO2)C1	ZINC000819207528	EE	On-Demand	Anodyne	DRD3	48	41
COc1ccccc1N1CC[C@H](CNC(=O)/C=C/[C@@H]2CCCO2)C1	ZINC000819207528	EE	On-Demand	Anodyne	HTR7	40	40
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207532	FE	On-Demand	Anodyne	ESR1	62	36
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207532	FE	On-Demand	Anodyne	ADRB2	79	54
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207532	FE	On-Demand	Anodyne	ADRB1	109	54
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207532	FE	On-Demand	Anodyne	ESR2	43	36
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207532	FE	On-Demand	Anodyne	ADRB3	198	58
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207532	FE	On-Demand	Anodyne	LTA4H	75	56
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207532	FE	On-Demand	Anodyne	HRH3	49	46
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207532	FE	On-Demand	Anodyne	HNMT	36	40
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207532	FE	On-Demand	Anodyne	TNK2	18	45
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207532	FE	On-Demand	Anodyne	PSMB2	43	44
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207532	FE	On-Demand	Anodyne	PSMB1	47	44
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207533	FE	On-Demand	Anodyne	ESR1	62	36
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207533	FE	On-Demand	Anodyne	ADRB2	79	54
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207533	FE	On-Demand	Anodyne	ADRB1	109	54
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207533	FE	On-Demand	Anodyne	ESR2	43	36
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207533	FE	On-Demand	Anodyne	ADRB3	198	58
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207533	FE	On-Demand	Anodyne	LTA4H	75	56
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207533	FE	On-Demand	Anodyne	HRH3	49	46
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207533	FE	On-Demand	Anodyne	HNMT	36	40
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207533	FE	On-Demand	Anodyne	TNK2	18	45
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207533	FE	On-Demand	Anodyne	PSMB2	43	44
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccnc1	ZINC000819207533	FE	On-Demand	Anodyne	PSMB1	47	44
C[C@@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)c1ccccc1[N+](=O)[O-]	ZINC000819207541	FE	On-Demand	Bother	COLA	113	38
C[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)c1ccccc1[N+](=O)[O-]	ZINC000819207546	FE	On-Demand	Bother	COLA	113	38
O=C(CCNOC1CCCC1)Nc1cccc(C(F)(F)F)c1	ZINC000819207563	DG	On-Demand	Anodyne	HDAC10	18	57
O=C(CCNOC1CCCC1)Nc1cccc(C(F)(F)F)c1	ZINC000819207563	DG	On-Demand	Anodyne	HDAC3	18	41
O=C(CCNOC1CCCC1)Nc1cccc(C(F)(F)F)c1	ZINC000819207563	DG	On-Demand	Anodyne	HDAC6	16	57
O=C(CCNOC1CCCC1)Nc1cccc(C(F)(F)F)c1	ZINC000819207563	DG	On-Demand	Anodyne	CCR2	36	43
O=C(CCNOC1CCCC1)Nc1cccc(C(F)(F)F)c1	ZINC000819207563	DG	On-Demand	Anodyne	EPHX2	20	53
O=C(CCNOC1CCCC1)Nc1cccc(C(F)(F)F)c1	ZINC000819207563	DG	On-Demand	Anodyne	MCHR1	15	40
C#CCCN1CCN(C(=O)Cc2cccc(NC(C)=O)c2)CC1	ZINC000819207569	DD	On-Demand	Mild	HTR1D	23	43
C#CCCN1CCN(C(=O)Cc2cccc(NC(C)=O)c2)CC1	ZINC000819207569	DD	On-Demand	Mild	HTR1B	23	43
C#CCCN1CCN(C(=O)Cc2cccc(NC(C)=O)c2)CC1	ZINC000819207569	DD	On-Demand	Mild	KCNJ1	48	37
COCCc1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819207572	DE	On-Demand	Anodyne	ADRB2	53	65
COCCc1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819207572	DE	On-Demand	Anodyne	ADRB1	80	65
COCCc1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819207572	DE	On-Demand	Anodyne	ADRB3	53	45
COCCc1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819207574	DE	On-Demand	Anodyne	ADRB2	53	65
COCCc1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819207574	DE	On-Demand	Anodyne	ADRB1	80	65
COCCc1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819207574	DE	On-Demand	Anodyne	ADRB3	53	45
COc1ccccc1N1CC[C@H](CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819207577	GF	On-Demand	Anodyne	HTR1A	68	47
COc1ccccc1N1CC[C@H](CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819207577	GF	On-Demand	Anodyne	DRD2	55	52
COc1ccccc1N1CC[C@H](CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819207577	GF	On-Demand	Anodyne	DRD4	29	41
COc1ccccc1N1CC[C@H](CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819207577	GF	On-Demand	Anodyne	ADRA1D	52	37
COc1ccccc1N1CC[C@H](CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819207577	GF	On-Demand	Anodyne	ADRA1A	46	37
COc1ccccc1N1CC[C@H](CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819207577	GF	On-Demand	Anodyne	DRD3	59	43
COc1ccccc1N1CC[C@H](CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819207577	GF	On-Demand	Anodyne	HTR7	45	41
COc1ccccc1N1CC[C@H](CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819207577	GF	On-Demand	Anodyne	ACACB	15	41
COc1ccccc1N1CC[C@@H](CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819207579	GF	On-Demand	Anodyne	HTR1A	68	47
COc1ccccc1N1CC[C@@H](CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819207579	GF	On-Demand	Anodyne	DRD2	55	52
COc1ccccc1N1CC[C@@H](CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819207579	GF	On-Demand	Anodyne	DRD4	29	41
COc1ccccc1N1CC[C@@H](CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819207579	GF	On-Demand	Anodyne	ADRA1D	52	37
COc1ccccc1N1CC[C@@H](CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819207579	GF	On-Demand	Anodyne	ADRA1A	46	37
COc1ccccc1N1CC[C@@H](CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819207579	GF	On-Demand	Anodyne	DRD3	59	43
COc1ccccc1N1CC[C@@H](CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819207579	GF	On-Demand	Anodyne	HTR7	45	41
COc1ccccc1N1CC[C@@H](CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819207579	GF	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cnn(Cc2ccncc2)c1	ZINC000819207581	FE	On-Demand	Anodyne	RPS6KA3	16	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cnn(Cc2ccncc2)c1	ZINC000819207581	FE	On-Demand	Anodyne	PANC	62	43
Cc1cccc2c1OCC[C@@H]2NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819207597	FI	On-Demand	Anodyne	LUXR	76	48
Cc1cccc2c1OCC[C@@H]2NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819207597	FI	On-Demand	Anodyne	TRAR	79	40
Cc1cccc2c1OCC[C@@H]2NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819207597	FI	On-Demand	Anodyne	LASR	45	40
Cc1cccc2c1OCC[C@@H]2NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819207610	GH	On-Demand	Mild	PAPA1_CARPA	40	40
Cc1cccc2c1OCC[C@@H]2NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819207614	GH	On-Demand	Mild	PAPA1_CARPA	40	40
C#CCCN1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819207628	DC	On-Demand	Mild	HTR1D	62	42
C#CCCN1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819207628	DC	On-Demand	Mild	HTR1B	51	42
C#CCCN1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819207628	DC	On-Demand	Mild	KCNJ1	87	53
C/C(=C/C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)C1CC1	ZINC000819207635	EE	On-Demand	Bother	L3MBTL3	53	46
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207636	HD	On-Demand	Bother	PREP	40	51
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207636	HD	On-Demand	Bother	SFRP1	48	43
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207636	HD	On-Demand	Bother	WNT3	57	43
COC(=O)c1cc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc([N+](=O)[O-])c1	ZINC000819207643	ID	On-Demand	Bother	CACNA1D	41	37
COC(=O)c1cc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc([N+](=O)[O-])c1	ZINC000819207643	ID	On-Demand	Bother	CTRB1	21	40
COC(=O)c1cc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc([N+](=O)[O-])c1	ZINC000819207643	ID	On-Demand	Bother	L3MBTL3	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cnn(Cc3ccncc3)c1)C2	ZINC000819207674	FE	On-Demand	Anodyne	PANC	59	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cnn(Cc3ccncc3)c1)C2	ZINC000819207676	FE	On-Demand	Anodyne	PANC	59	39
O=C(c1cc[n+]([O-])cc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207684	FC	On-Demand	Bother	L3MBTL3	30	44
CCOC(=O)Nc1ccc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)cc1	ZINC000819207691	GI	On-Demand	Anodyne	CPT1A	60	39
CCOC(=O)Nc1ccc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)cc1	ZINC000819207691	GI	On-Demand	Anodyne	CPT2	46	39
CCOC(=O)Nc1ccc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)cc1	ZINC000819207691	GI	On-Demand	Anodyne	ABCB1B	34	40
CCOC(=O)Nc1ccc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)cc1	ZINC000819207691	GI	On-Demand	Anodyne	CPT1B	45	39
CCOC(=O)Nc1ccc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)cc1	ZINC000819207691	GI	On-Demand	Anodyne	ABCG2	29	41
CCOC(=O)Nc1ccc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)cc1	ZINC000819207691	GI	On-Demand	Anodyne	NOD2	42	39
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1cccc(F)c1	ZINC000819207692	DF	On-Demand	Anodyne	ADRB2	44	34
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1cccc(F)c1	ZINC000819207692	DF	On-Demand	Anodyne	ADRB1	47	47
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1cccc(F)c1	ZINC000819207692	DF	On-Demand	Anodyne	ADRB3	57	47
CCOC(=O)N1CCC(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)CC1	ZINC000819207702	HD	On-Demand	Bother	P2RY12	44	34
CCOC(=O)N1CCC(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)CC1	ZINC000819207702	HD	On-Demand	Bother	L3MBTL3	27	42
O=C(C#Cc1ccccc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207703	FD	On-Demand	Mild	L3MBTL3	18	40
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)[C@@H]2CCC=CO2)CC1	ZINC000819207710	ED	On-Demand	Bother	L3MBTL3	16	42
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)[C@H]2CCC=CO2)CC1	ZINC000819207711	ED	On-Demand	Bother	L3MBTL3	16	42
O=C(Cc1ccccc1CO)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207712	GD	On-Demand	Bother	COLA	75	33
C[C@@H](CC(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)NC(=O)OC(C)(C)C	ZINC000819207722	HE	On-Demand	Bother	COLA	44	38
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819207726	IF	On-Demand	Bother	GPR119	41	38
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819207726	IF	On-Demand	Bother	SFRP1	21	44
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819207727	IF	On-Demand	Bother	GPR119	41	38
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819207727	IF	On-Demand	Bother	SFRP1	21	44
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)c2cc(C(F)(F)F)cnc2Cl)CC1	ZINC000819207728	IG	On-Demand	Bother	SLC6A9	28	49
O=C(/C=C/c1cccc(OC2CCCC2)c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207732	IH	On-Demand	Bother	ITGAL	25	42
O=C(/C=C\c1cccc(OC2CCCC2)c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207733	IH	On-Demand	Bother	ITGAL	25	42
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207737	IF	On-Demand	Bother	CPT2	43	37
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207737	IF	On-Demand	Bother	PREP	88	58
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207737	IF	On-Demand	Bother	SFRP1	56	48
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207737	IF	On-Demand	Bother	WNT3	64	48
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207737	IF	On-Demand	Bother	L3MBTL3	15	40
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819207742	IF	On-Demand	Bother	SLC6A9	24	43
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819207743	IF	On-Demand	Bother	SLC6A9	24	43
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)c2c(O)cccc2Cl)CC1	ZINC000819207747	GF	On-Demand	Bother	L3MBTL3	15	42
O=C(/C=C\c1ccccc1Cl)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207749	GG	On-Demand	Bother	ITGAL	27	46
O=C(/C=C/c1ccccc1Cl)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207750	GG	On-Demand	Bother	ITGAL	27	46
O[C@@H](CNCCSCc1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819207779	FH	On-Demand	Anodyne	ADRB2	25	42
O[C@@H](CNCCSCc1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819207779	FH	On-Demand	Anodyne	ADRB1	39	42
O[C@@H](CNCCSCc1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819207779	FH	On-Demand	Anodyne	ADRB3	104	46
O[C@H](CNCCSCc1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819207780	FH	On-Demand	Anodyne	ADRB2	25	42
O[C@H](CNCCSCc1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819207780	FH	On-Demand	Anodyne	ADRB1	39	42
O[C@H](CNCCSCc1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819207780	FH	On-Demand	Anodyne	ADRB3	104	46
O[C@@H](CNCCc1cnccn1)c1ccc(Br)cc1	ZINC000819207801	DE	On-Demand	Anodyne	ADRB2	29	45
O[C@@H](CNCCc1cnccn1)c1ccc(Br)cc1	ZINC000819207801	DE	On-Demand	Anodyne	ADRB3	68	47
O[C@H](CNCCc1cnccn1)c1ccc(Br)cc1	ZINC000819207802	DE	On-Demand	Anodyne	ADRB2	29	45
O[C@H](CNCCc1cnccn1)c1ccc(Br)cc1	ZINC000819207802	DE	On-Demand	Anodyne	ADRB3	68	47
O[C@@H](CNOC1CCCC1)Cc1cccc(Cl)c1	ZINC000819207803	CF	On-Demand	Anodyne	ADRB1	17	41
O[C@H](CNOC1CCCC1)Cc1cccc(Cl)c1	ZINC000819207804	CF	On-Demand	Anodyne	ADRB1	17	41
C=CCc1ccc(OC[C@@H](O)CNOC2CCCC2)c(OC)c1	ZINC000819207818	DF	On-Demand	Mild	ADRB2	17	43
C=CCc1ccc(OC[C@@H](O)CNOC2CCCC2)c(OC)c1	ZINC000819207818	DF	On-Demand	Mild	ADRB1	23	44
C=CCc1ccc(OC[C@H](O)CNOC2CCCC2)c(OC)c1	ZINC000819207819	DF	On-Demand	Mild	ADRB2	17	43
C=CCc1ccc(OC[C@H](O)CNOC2CCCC2)c(OC)c1	ZINC000819207819	DF	On-Demand	Mild	ADRB1	23	44
O[C@@H](CNOC1CCCC1)COc1ccc2ccccc2c1	ZINC000819207841	DG	On-Demand	Anodyne	ADRB2	49	61
O[C@@H](CNOC1CCCC1)COc1ccc2ccccc2c1	ZINC000819207841	DG	On-Demand	Anodyne	ADRB1	54	45
O[C@@H](CNOC1CCCC1)COc1ccc2ccccc2c1	ZINC000819207841	DG	On-Demand	Anodyne	CASR	40	37
O[C@@H](CNOC1CCCC1)COc1ccc2ccccc2c1	ZINC000819207841	DG	On-Demand	Anodyne	CYP2D6	15	41
O[C@H](CNOC1CCCC1)COc1ccc2ccccc2c1	ZINC000819207842	DG	On-Demand	Anodyne	ADRB2	49	61
O[C@H](CNOC1CCCC1)COc1ccc2ccccc2c1	ZINC000819207842	DG	On-Demand	Anodyne	ADRB1	54	45
O[C@H](CNOC1CCCC1)COc1ccc2ccccc2c1	ZINC000819207842	DG	On-Demand	Anodyne	CASR	40	37
O[C@H](CNOC1CCCC1)COc1ccc2ccccc2c1	ZINC000819207842	DG	On-Demand	Anodyne	CYP2D6	15	41
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1cccc(F)c1	ZINC000819207853	DF	On-Demand	Anodyne	ADRB2	44	34
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1cccc(F)c1	ZINC000819207853	DF	On-Demand	Anodyne	ADRB1	47	47
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1cccc(F)c1	ZINC000819207853	DF	On-Demand	Anodyne	ADRB3	57	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCCOc3ccccc31)C2	ZINC000819207858	FF	On-Demand	Anodyne	XIAP	25	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCCOc3ccccc31)C2	ZINC000819207858	FF	On-Demand	Anodyne	BIRC3	50	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCCOc3ccccc31)C2	ZINC000819207858	FF	On-Demand	Anodyne	BIRC2	31	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCCOc3ccccc31)C2	ZINC000819207861	FF	On-Demand	Anodyne	XIAP	25	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCCOc3ccccc31)C2	ZINC000819207861	FF	On-Demand	Anodyne	BIRC3	50	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCCOc3ccccc31)C2	ZINC000819207861	FF	On-Demand	Anodyne	BIRC2	31	41
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819207862	EG	On-Demand	Anodyne	ADRB2	44	36
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819207862	EG	On-Demand	Anodyne	ADRB3	41	38
CC(C)(C)OC(=O)CCCCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819207862	EG	On-Demand	Anodyne	LEF	44	35
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819207863	EG	On-Demand	Anodyne	ADRB2	44	36
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819207863	EG	On-Demand	Anodyne	ADRB3	41	38
CC(C)(C)OC(=O)CCCCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819207863	EG	On-Demand	Anodyne	LEF	44	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCCOc3ccccc31)C2	ZINC000819207864	FF	On-Demand	Anodyne	XIAP	25	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCCOc3ccccc31)C2	ZINC000819207864	FF	On-Demand	Anodyne	BIRC3	50	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCCOc3ccccc31)C2	ZINC000819207864	FF	On-Demand	Anodyne	BIRC2	31	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCCOc3ccccc31)C2	ZINC000819207866	FF	On-Demand	Anodyne	XIAP	25	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCCOc3ccccc31)C2	ZINC000819207866	FF	On-Demand	Anodyne	BIRC3	50	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCCOc3ccccc31)C2	ZINC000819207866	FF	On-Demand	Anodyne	BIRC2	31	41
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207877	DE	On-Demand	Anodyne	ESR1	92	39
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207877	DE	On-Demand	Anodyne	ADRB2	39	43
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207877	DE	On-Demand	Anodyne	ADRB1	69	43
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207877	DE	On-Demand	Anodyne	ESR2	63	41
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207877	DE	On-Demand	Anodyne	ADRB3	55	43
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207877	DE	On-Demand	Anodyne	LTA4H	72	53
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207877	DE	On-Demand	Anodyne	HRH3	69	49
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207877	DE	On-Demand	Anodyne	TNK2	18	40
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207877	DE	On-Demand	Anodyne	PSMB2	47	50
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207877	DE	On-Demand	Anodyne	PSMB1	52	50
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207878	DE	On-Demand	Anodyne	ESR1	92	39
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207878	DE	On-Demand	Anodyne	ADRB2	39	43
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207878	DE	On-Demand	Anodyne	ADRB1	69	43
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207878	DE	On-Demand	Anodyne	ESR2	63	41
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207878	DE	On-Demand	Anodyne	ADRB3	55	43
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207878	DE	On-Demand	Anodyne	LTA4H	72	53
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207878	DE	On-Demand	Anodyne	HRH3	69	49
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207878	DE	On-Demand	Anodyne	TNK2	18	40
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207878	DE	On-Demand	Anodyne	PSMB2	47	50
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000819207878	DE	On-Demand	Anodyne	PSMB1	52	50
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819207881	GH	On-Demand	Anodyne	ESR1	94	39
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819207881	GH	On-Demand	Anodyne	ADRB2	43	45
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819207881	GH	On-Demand	Anodyne	ADRB1	72	45
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819207881	GH	On-Demand	Anodyne	ACHE	15	41
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819207881	GH	On-Demand	Anodyne	ESR2	63	39
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819207881	GH	On-Demand	Anodyne	ADRB3	82	45
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819207881	GH	On-Demand	Anodyne	LTA4H	70	50
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819207881	GH	On-Demand	Anodyne	HRH3	50	44
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819207881	GH	On-Demand	Anodyne	SIGMAR1	18	44
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819207881	GH	On-Demand	Anodyne	TNK2	21	43
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819207881	GH	On-Demand	Anodyne	PSMB2	43	42
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819207881	GH	On-Demand	Anodyne	PSMB1	47	42
COc1cccc([S@@](=O)CC(=O)N[C@H]2CCOc3c(C)cccc32)c1	ZINC000819207909	FF	On-Demand	Anodyne	LUXR	58	35
COc1cccc([S@@](=O)CC(=O)N[C@H]2CCOc3c(C)cccc32)c1	ZINC000819207909	FF	On-Demand	Anodyne	TRAR	63	35
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207916	FG	On-Demand	Anodyne	ESR1	83	42
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207916	FG	On-Demand	Anodyne	ADRB2	83	46
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207916	FG	On-Demand	Anodyne	ADRB1	109	49
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207916	FG	On-Demand	Anodyne	SLC6A3	18	46
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207916	FG	On-Demand	Anodyne	KCNH2	15	45
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207916	FG	On-Demand	Anodyne	ESR2	58	42
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207916	FG	On-Demand	Anodyne	ADRB3	157	49
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207916	FG	On-Demand	Anodyne	LTA4H	61	49
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207916	FG	On-Demand	Anodyne	HRH3	50	46
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207916	FG	On-Demand	Anodyne	PSMB2	43	44
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207916	FG	On-Demand	Anodyne	PSMB1	47	44
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207917	FG	On-Demand	Anodyne	ESR1	83	42
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207917	FG	On-Demand	Anodyne	ADRB2	83	46
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207917	FG	On-Demand	Anodyne	ADRB1	109	49
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207917	FG	On-Demand	Anodyne	SLC6A3	18	46
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207917	FG	On-Demand	Anodyne	KCNH2	15	45
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207917	FG	On-Demand	Anodyne	ESR2	58	42
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207917	FG	On-Demand	Anodyne	ADRB3	157	49
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207917	FG	On-Demand	Anodyne	LTA4H	61	49
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207917	FG	On-Demand	Anodyne	HRH3	50	46
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207917	FG	On-Demand	Anodyne	PSMB2	43	44
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819207917	FG	On-Demand	Anodyne	PSMB1	47	44
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207932	FG	On-Demand	Anodyne	ESR1	72	40
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207932	FG	On-Demand	Anodyne	ADRB2	70	47
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207932	FG	On-Demand	Anodyne	ADRB1	90	47
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207932	FG	On-Demand	Anodyne	SLC6A4	16	46
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207932	FG	On-Demand	Anodyne	SLC6A3	34	46
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207932	FG	On-Demand	Anodyne	KCNH2	15	45
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207932	FG	On-Demand	Anodyne	ESR2	51	41
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207932	FG	On-Demand	Anodyne	ADRB3	120	47
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207932	FG	On-Demand	Anodyne	LTA4H	64	54
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207932	FG	On-Demand	Anodyne	HRH3	51	47
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207932	FG	On-Demand	Anodyne	PSMB2	45	47
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207932	FG	On-Demand	Anodyne	PSMB1	50	47
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207933	FG	On-Demand	Anodyne	ESR1	72	40
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207933	FG	On-Demand	Anodyne	ADRB2	70	47
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207933	FG	On-Demand	Anodyne	ADRB1	90	47
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207933	FG	On-Demand	Anodyne	SLC6A4	16	46
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207933	FG	On-Demand	Anodyne	SLC6A3	34	46
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207933	FG	On-Demand	Anodyne	KCNH2	15	45
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207933	FG	On-Demand	Anodyne	ESR2	51	41
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207933	FG	On-Demand	Anodyne	ADRB3	120	47
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207933	FG	On-Demand	Anodyne	LTA4H	64	54
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207933	FG	On-Demand	Anodyne	HRH3	51	47
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207933	FG	On-Demand	Anodyne	PSMB2	45	47
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819207933	FG	On-Demand	Anodyne	PSMB1	50	47
CCCOc1nc2ccccc2cc1/C=C\C(=O)Nc1cccnc1Cl	ZINC000819207934	FJ	On-Demand	Anodyne	G2YM83_BOTF4	64	32
CCCOc1nc2ccccc2cc1/C=C/C(=O)Nc1cccnc1Cl	ZINC000819207935	FJ	On-Demand	Anodyne	G2YM83_BOTF4	64	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cnn(CCN(C)C)c1)C2	ZINC000819207939	ED	On-Demand	Anodyne	PANC	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cnn(CCN(C)C)c1)C2	ZINC000819207940	ED	On-Demand	Anodyne	PANC	40	31
O=C(/C=C\c1ccccc1OC(F)(F)F)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207965	IG	On-Demand	Bother	ITGAL	41	38
O=C(/C=C/c1ccccc1OC(F)(F)F)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819207966	IG	On-Demand	Bother	ITGAL	41	38
C/C=C(\CC)C(=O)N1CCc2cc(OC)c(Cl)cc2C1	ZINC000819207974	CH	On-Demand	Anodyne	ABCB1	15	44
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819207987	IF	On-Demand	Bother	SLC6A9	15	46
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)c2cccc(O)c2O)CC1	ZINC000819207994	FD	On-Demand	Clean	KCNMA1	17	42
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)c2c(C(F)(F)F)ccnc2Cl)CC1	ZINC000819208009	IG	On-Demand	Bother	P2RX7	35	41
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)c2c(C(F)(F)F)ccnc2Cl)CC1	ZINC000819208009	IG	On-Demand	Bother	RBP4	33	42
O=C(c1cc(F)c(C(F)(F)F)cc1F)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208011	IG	On-Demand	Bother	SLC6A9	28	47
O=C(c1cc(F)c(C(F)(F)F)cc1F)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208011	IG	On-Demand	Bother	SCD1	19	41
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)c2cccc(O)c2[N+](=O)[O-])CC1	ZINC000819208026	HD	On-Demand	Bother	KCNMA1	16	41
C#Cc1cncc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)c1	ZINC000819208030	FD	On-Demand	Mild	L3MBTL3	30	43
NC(=S)c1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000819208042	GD	On-Demand	Bother	L3MBTL3	50	45
COC(=O)Nc1ccc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)cc1	ZINC000819208045	FH	On-Demand	Anodyne	CPT1A	64	42
COC(=O)Nc1ccc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)cc1	ZINC000819208045	FH	On-Demand	Anodyne	CPT2	48	42
COC(=O)Nc1ccc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)cc1	ZINC000819208045	FH	On-Demand	Anodyne	ABCB1	15	45
COC(=O)Nc1ccc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)cc1	ZINC000819208045	FH	On-Demand	Anodyne	CPT1B	44	42
COC(=O)Nc1ccc(C(=O)N2CCc3cc(OC)c(Cl)cc3C2)cc1	ZINC000819208045	FH	On-Demand	Anodyne	ABCG2	29	41
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208052	HE	On-Demand	Bother	SLC6A9	16	42
O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208052	HE	On-Demand	Bother	L3MBTL3	19	43
N#Cc1cccc(OCC(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)c1	ZINC000819208054	GD	On-Demand	Mild	HTR1B	15	43
N#Cc1cccc(OCC(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)c1	ZINC000819208054	GD	On-Demand	Mild	CPT2	40	34
N#Cc1cccc(OCC(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)c1	ZINC000819208054	GD	On-Demand	Mild	SLC6A9	16	41
O[C@H](CNOC1CCCC1)COc1cccc2[nH]ccc12	ZINC000819208057	CE	On-Demand	Anodyne	ADRB2	26	79
O[C@H](CNOC1CCCC1)COc1cccc2[nH]ccc12	ZINC000819208057	CE	On-Demand	Anodyne	ADRB1	43	79
O[C@H](CNOC1CCCC1)COc1cccc2[nH]ccc12	ZINC000819208057	CE	On-Demand	Anodyne	HTR1A	18	79
O[C@H](CNOC1CCCC1)COc1cccc2[nH]ccc12	ZINC000819208057	CE	On-Demand	Anodyne	SLC6A4	20	47
O=C(c1ccnc(Cl)c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208060	FE	On-Demand	Bother	L3MBTL3	28	46
O[C@@H](CNOC1CCCC1)COc1cccc2[nH]ccc12	ZINC000819208061	CE	On-Demand	Anodyne	ADRB2	26	79
O[C@@H](CNOC1CCCC1)COc1cccc2[nH]ccc12	ZINC000819208061	CE	On-Demand	Anodyne	ADRB1	43	79
O[C@@H](CNOC1CCCC1)COc1cccc2[nH]ccc12	ZINC000819208061	CE	On-Demand	Anodyne	HTR1A	18	79
O[C@@H](CNOC1CCCC1)COc1cccc2[nH]ccc12	ZINC000819208061	CE	On-Demand	Anodyne	SLC6A4	20	47
O=C(c1ccc(SC(F)F)cc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208062	HH	On-Demand	Bother	L3MBTL3	26	42
O[C@@H](CNCCc1cnccn1)c1ccc(OC(F)(F)F)cc1	ZINC000819208063	EE	On-Demand	Anodyne	ADRB2	34	43
O[C@@H](CNCCc1cnccn1)c1ccc(OC(F)(F)F)cc1	ZINC000819208063	EE	On-Demand	Anodyne	ADRB1	35	41
O[C@@H](CNCCc1cnccn1)c1ccc(OC(F)(F)F)cc1	ZINC000819208063	EE	On-Demand	Anodyne	ADRB3	74	43
O[C@H](CNCCc1cnccn1)c1ccc(OC(F)(F)F)cc1	ZINC000819208065	EE	On-Demand	Anodyne	ADRB2	34	43
O[C@H](CNCCc1cnccn1)c1ccc(OC(F)(F)F)cc1	ZINC000819208065	EE	On-Demand	Anodyne	ADRB1	35	41
O[C@H](CNCCc1cnccn1)c1ccc(OC(F)(F)F)cc1	ZINC000819208065	EE	On-Demand	Anodyne	ADRB3	74	43
O[C@H](CNOC1CCCC1)c1cccc(Cl)c1	ZINC000819208074	CF	On-Demand	Anodyne	ADRB1	48	48
O[C@H](CNOC1CCCC1)c1cccc(Cl)c1	ZINC000819208074	CF	On-Demand	Anodyne	ADRB3	57	48
O[C@H](CNOC1CCCC1)c1cccc(Cl)c1	ZINC000819208074	CF	On-Demand	Anodyne	CYP3A4	46	35
O[C@@H](CNOC1CCCC1)c1cccc(Cl)c1	ZINC000819208075	CF	On-Demand	Anodyne	ADRB1	48	48
O[C@@H](CNOC1CCCC1)c1cccc(Cl)c1	ZINC000819208075	CF	On-Demand	Anodyne	ADRB3	57	48
O[C@@H](CNOC1CCCC1)c1cccc(Cl)c1	ZINC000819208075	CF	On-Demand	Anodyne	CYP3A4	46	35
O=C(NCCNC(=O)c1cccc(Br)c1)C(F)=C1CCC1	ZINC000819208081	FF	On-Demand	Anodyne	DRD4	42	32
O[C@H](CNOC1CCCC1)COc1ccc2c(c1)OCO2	ZINC000819208191	CD	On-Demand	Anodyne	ADRB1	31	42
O[C@@H](CNOC1CCCC1)COc1ccc2c(c1)OCO2	ZINC000819208196	CD	On-Demand	Anodyne	ADRB1	31	42
CC(=O)Nc1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819208219	DD	On-Demand	Anodyne	ADRB2	57	64
CC(=O)Nc1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819208219	DD	On-Demand	Anodyne	ADRB1	90	64
CC(=O)Nc1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819208219	DD	On-Demand	Anodyne	TSHR	40	30
CC(=O)Nc1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819208219	DD	On-Demand	Anodyne	ADRB3	58	52
CC(=O)Nc1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819208221	DD	On-Demand	Anodyne	ADRB2	57	64
CC(=O)Nc1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819208221	DD	On-Demand	Anodyne	ADRB1	90	64
CC(=O)Nc1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819208221	DD	On-Demand	Anodyne	TSHR	40	30
CC(=O)Nc1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819208221	DD	On-Demand	Anodyne	ADRB3	58	52
CCN(CC)S(=O)(=O)c1ccc(Br)c(C(=O)Nc2cccnc2Cl)c1	ZINC000819208249	IH	On-Demand	Anodyne	G2YM83_BOTF4	81	41
O=C(CSCC(=O)Nc1cccnc1Cl)Nc1ccc(F)cc1	ZINC000819208266	FG	On-Demand	Anodyne	P2RY1	41	40
O=C(CSCC(=O)Nc1cccnc1Cl)Nc1ccc(F)cc1	ZINC000819208266	FG	On-Demand	Anodyne	G2YM83_BOTF4	67	34
N#CCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819208298	FE	On-Demand	Mild	ADRB1	41	37
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819208300	FE	On-Demand	Mild	ADRB1	41	37
N#CCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819208302	FE	On-Demand	Mild	ADRB1	41	37
N#CCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819208305	FE	On-Demand	Mild	ADRB1	41	37
O=C(Nc1cnn(Cc2ccccn2)c1)C(F)=C1CCC1	ZINC000819208312	CF	On-Demand	Anodyne	PANC	49	33
COc1cccc(OC)c1OC[C@H](O)CNOC1CCCC1	ZINC000819208314	DD	On-Demand	Anodyne	ADRB2	37	49
COc1cccc(OC)c1OC[C@H](O)CNOC1CCCC1	ZINC000819208314	DD	On-Demand	Anodyne	ADRB1	45	49
COc1cccc(OC)c1OC[C@@H](O)CNOC1CCCC1	ZINC000819208317	DD	On-Demand	Anodyne	ADRB2	37	49
COc1cccc(OC)c1OC[C@@H](O)CNOC1CCCC1	ZINC000819208317	DD	On-Demand	Anodyne	ADRB1	45	49
O[C@H](CNOC1CCCC1)c1ccc(OC(F)(F)F)cc1	ZINC000819208319	DG	On-Demand	Anodyne	EPHX2	18	40
O[C@@H](CNOC1CCCC1)c1ccc(OC(F)(F)F)cc1	ZINC000819208320	DG	On-Demand	Anodyne	EPHX2	18	40
CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)Nc2cccnc2Cl)c1	ZINC000819208341	HE	On-Demand	Anodyne	G2YM83_BOTF4	74	39
C[C@H](CCNC(=O)c1coc(=O)c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819208354	FF	On-Demand	Anodyne	FPR1	41	37
C[C@@H](CCNC(=O)c1coc(=O)c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819208355	FF	On-Demand	Anodyne	FPR1	41	37
CN(C)CCn1cc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)cn1	ZINC000819208373	ED	On-Demand	Anodyne	PANC	52	35
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)CCc1ccccc1	ZINC000819208386	CF	On-Demand	Reactive	GRIN2B	19	44
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)CCc1ccccc1	ZINC000819208386	CF	On-Demand	Reactive	NAAA	32	41
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)CCc1ccccc1	ZINC000819208387	CF	On-Demand	Reactive	GRIN2B	19	44
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)CCc1ccccc1	ZINC000819208387	CF	On-Demand	Reactive	NAAA	32	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC[C@H]1Cc1ccccc1)C2	ZINC000819208389	FG	On-Demand	Anodyne	FKBP1A	44	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC[C@H]1Cc1ccccc1)C2	ZINC000819208389	FG	On-Demand	Anodyne	PREP	68	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCC[C@H]1Cc1ccccc1)C2	ZINC000819208390	FG	On-Demand	Anodyne	FKBP1A	44	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCC[C@H]1Cc1ccccc1)C2	ZINC000819208390	FG	On-Demand	Anodyne	PREP	68	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC[C@@H]1Cc1ccccc1)C2	ZINC000819208391	FG	On-Demand	Anodyne	FKBP1A	44	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC[C@@H]1Cc1ccccc1)C2	ZINC000819208391	FG	On-Demand	Anodyne	PREP	68	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCC[C@@H]1Cc1ccccc1)C2	ZINC000819208392	FG	On-Demand	Anodyne	FKBP1A	44	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCC[C@@H]1Cc1ccccc1)C2	ZINC000819208392	FG	On-Demand	Anodyne	PREP	68	38
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCc2cnccn2)CC1	ZINC000819208393	FD	On-Demand	Anodyne	GPR119	23	43
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCc2cnccn2)CC1	ZINC000819208394	FD	On-Demand	Anodyne	GPR119	23	43
O=C(c1ccc(-n2ccnc2S)cc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208414	IF	On-Demand	Bother	L3MBTL3	26	41
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208426	GG	On-Demand	Anodyne	ESR1	77	38
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208426	GG	On-Demand	Anodyne	ADRB2	52	44
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208426	GG	On-Demand	Anodyne	ADRB1	83	44
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208426	GG	On-Demand	Anodyne	ESR2	55	38
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208426	GG	On-Demand	Anodyne	ADRB3	90	44
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208426	GG	On-Demand	Anodyne	LTA4H	64	52
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208426	GG	On-Demand	Anodyne	HRH3	56	48
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208426	GG	On-Demand	Anodyne	TNK2	17	40
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208426	GG	On-Demand	Anodyne	PSMB2	45	46
O[C@@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208426	GG	On-Demand	Anodyne	PSMB1	50	46
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208429	GG	On-Demand	Anodyne	ESR1	77	38
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208429	GG	On-Demand	Anodyne	ADRB2	52	44
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208429	GG	On-Demand	Anodyne	ADRB1	83	44
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208429	GG	On-Demand	Anodyne	ESR2	55	38
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208429	GG	On-Demand	Anodyne	ADRB3	90	44
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208429	GG	On-Demand	Anodyne	LTA4H	64	52
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208429	GG	On-Demand	Anodyne	HRH3	56	48
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208429	GG	On-Demand	Anodyne	TNK2	17	40
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208429	GG	On-Demand	Anodyne	PSMB2	45	46
O[C@H](CNCCc1ccc(OCCN2CCCC2)cc1)c1c(F)cccc1F	ZINC000819208429	GG	On-Demand	Anodyne	PSMB1	50	46
O=C(Cc1nnc(O)c2ccccc12)Nc1cccnc1Cl	ZINC000819208433	DF	On-Demand	Anodyne	G2YM83_BOTF4	64	34
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@@H]1Cc1ccccc1	ZINC000819208442	CG	On-Demand	Anodyne	PREP	61	37
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@H]1Cc1ccccc1	ZINC000819208445	CG	On-Demand	Anodyne	PREP	61	37
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@H]1Cc1ccccc1	ZINC000819208447	CG	On-Demand	Anodyne	PREP	61	37
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000819208449	HE	On-Demand	Bother	P2RX7	17	40
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000819208449	HE	On-Demand	Bother	L3MBTL3	24	47
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208450	ID	On-Demand	Bother	PGC	43	32
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208450	ID	On-Demand	Bother	GSTM2	15	40
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208450	ID	On-Demand	Bother	FPR1	43	36
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@@H]1Cc1ccccc1	ZINC000819208451	CG	On-Demand	Anodyne	PREP	61	37
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208452	ID	On-Demand	Bother	PGC	43	32
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208452	ID	On-Demand	Bother	GSTM2	15	40
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208452	ID	On-Demand	Bother	FPR1	43	36
C#CCCN1CCN(C(=O)Cc2nsc3ccccc23)CC1	ZINC000819208454	DE	On-Demand	Mild	HTR1A	20	40
C#CCCN1CCN(C(=O)Cc2nsc3ccccc23)CC1	ZINC000819208454	DE	On-Demand	Mild	DRD2	25	40
Cc1cccc2c1OCC[C@@H]2NC(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819208457	EF	On-Demand	Anodyne	LUXR	80	41
Cc1cccc2c1OCC[C@@H]2NC(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819208457	EF	On-Demand	Anodyne	TRAR	79	41
Cc1cccc2c1OCC[C@@H]2NC(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819208457	EF	On-Demand	Anodyne	LASR	44	39
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819208465	IE	On-Demand	Bother	GPR119	42	40
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819208465	IE	On-Demand	Bother	SFRP1	73	48
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819208465	IE	On-Demand	Bother	WNT3	60	39
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819208465	IE	On-Demand	Bother	L3MBTL3	23	40
O=C(Nc1ccc(N2CCN(C(=O)C3CC3)CC2)nc1)C(F)=C1CCC1	ZINC000819208468	FE	On-Demand	Anodyne	DGAT1	44	51
O[C@@H](CNOC1CCCC1)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819208471	GH	On-Demand	Anodyne	SLC6A4	16	41
O[C@@H](CNOC1CCCC1)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819208471	GH	On-Demand	Anodyne	SLC6A3	49	42
O[C@H](CNOC1CCCC1)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819208472	GH	On-Demand	Anodyne	SLC6A4	16	41
O[C@H](CNOC1CCCC1)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819208472	GH	On-Demand	Anodyne	SLC6A3	49	42
COc1cccc(C2=NO[C@H](C(=O)N3CCN(C(=O)c4ccccc4[N+](=O)[O-])CC3)C2)c1	ZINC000819208473	IE	On-Demand	Bother	TAAR1	19	40
COc1cccc(C2=NO[C@H](C(=O)N3CCN(C(=O)c4ccccc4[N+](=O)[O-])CC3)C2)c1	ZINC000819208473	IE	On-Demand	Bother	LUCI_PHOPY	26	43
COc1cccc(C2=NO[C@@H](C(=O)N3CCN(C(=O)c4ccccc4[N+](=O)[O-])CC3)C2)c1	ZINC000819208475	IE	On-Demand	Bother	TAAR1	19	40
COc1cccc(C2=NO[C@@H](C(=O)N3CCN(C(=O)c4ccccc4[N+](=O)[O-])CC3)C2)c1	ZINC000819208475	IE	On-Demand	Bother	LUCI_PHOPY	26	43
NS(=O)(=O)c1cc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)ccc1F	ZINC000819208511	IC	On-Demand	Bother	L3MBTL3	27	44
O=[N+]([O-])c1ccccc1OC[C@H](O)CNOC1CCCC1	ZINC000819208512	CD	On-Demand	Bother	ADRB2	26	43
O=[N+]([O-])c1ccccc1OC[C@H](O)CNOC1CCCC1	ZINC000819208512	CD	On-Demand	Bother	ADRB1	49	35
O=[N+]([O-])c1ccccc1OC[C@H](O)CNOC1CCCC1	ZINC000819208512	CD	On-Demand	Bother	ABCB1	18	42
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNOC1CCCC1	ZINC000819208513	CD	On-Demand	Bother	ADRB2	26	43
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNOC1CCCC1	ZINC000819208513	CD	On-Demand	Bother	ADRB1	49	35
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNOC1CCCC1	ZINC000819208513	CD	On-Demand	Bother	ABCB1	18	42
O=C(c1ccc(SC(F)(F)F)cc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208514	IH	On-Demand	Bother	L3MBTL3	24	42
O=[N+]([O-])c1cccc([C@H](O)CNOC2CCCC2)c1	ZINC000819208532	CE	On-Demand	Bother	CACNA1C	52	38
O=[N+]([O-])c1cccc([C@H](O)CNOC2CCCC2)c1	ZINC000819208532	CE	On-Demand	Bother	CACNA1D	77	36
O=[N+]([O-])c1cccc([C@@H](O)CNOC2CCCC2)c1	ZINC000819208534	CE	On-Demand	Bother	CACNA1C	52	38
O=[N+]([O-])c1cccc([C@@H](O)CNOC2CCCC2)c1	ZINC000819208534	CE	On-Demand	Bother	CACNA1D	77	36
Cc1cc(OCC(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)ccc1[N+](=O)[O-]	ZINC000819208540	IE	On-Demand	Bother	HTR1D	17	46
Cc1cc(OCC(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)ccc1[N+](=O)[O-]	ZINC000819208540	IE	On-Demand	Bother	HTR1B	18	43
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208545	HD	On-Demand	Bother	COLA	41	37
N#Cc1ccc([C@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208547	GF	On-Demand	Mild	ESR1	62	36
N#Cc1ccc([C@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208547	GF	On-Demand	Mild	ADRB2	58	46
N#Cc1ccc([C@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208547	GF	On-Demand	Mild	ADRB1	80	46
N#Cc1ccc([C@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208547	GF	On-Demand	Mild	ESR2	42	36
N#Cc1ccc([C@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208547	GF	On-Demand	Mild	ADRB3	94	46
N#Cc1ccc([C@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208547	GF	On-Demand	Mild	LTA4H	56	48
N#Cc1ccc([C@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208547	GF	On-Demand	Mild	HRH3	47	51
N#Cc1ccc([C@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208547	GF	On-Demand	Mild	PSMB2	43	45
N#Cc1ccc([C@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208547	GF	On-Demand	Mild	PSMB1	48	45
N#Cc1ccc([C@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208547	GF	On-Demand	Mild	MEN1	40	39
C#Cc1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cn1	ZINC000819208550	FD	On-Demand	Mild	L3MBTL3	38	44
CO/C(=C\c1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208552	GF	On-Demand	Bother	TLR4	18	43
N#Cc1ccc([C@@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208554	GF	On-Demand	Mild	ESR1	62	36
N#Cc1ccc([C@@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208554	GF	On-Demand	Mild	ADRB2	58	46
N#Cc1ccc([C@@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208554	GF	On-Demand	Mild	ADRB1	80	46
N#Cc1ccc([C@@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208554	GF	On-Demand	Mild	ESR2	42	36
N#Cc1ccc([C@@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208554	GF	On-Demand	Mild	ADRB3	94	46
N#Cc1ccc([C@@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208554	GF	On-Demand	Mild	LTA4H	56	48
N#Cc1ccc([C@@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208554	GF	On-Demand	Mild	HRH3	47	51
N#Cc1ccc([C@@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208554	GF	On-Demand	Mild	PSMB2	43	45
N#Cc1ccc([C@@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208554	GF	On-Demand	Mild	PSMB1	48	45
N#Cc1ccc([C@@H](O)CNCCc2ccc(OCCN3CCCC3)cc2)cc1	ZINC000819208554	GF	On-Demand	Mild	MEN1	40	39
CO/C(=C/c1ccccc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208555	GF	On-Demand	Bother	TLR4	18	43
O[C@H](CNOC1CCCC1)COc1cccc(C(F)(F)F)c1	ZINC000819208557	DF	On-Demand	Anodyne	ADRB2	27	42
O[C@H](CNOC1CCCC1)COc1cccc(C(F)(F)F)c1	ZINC000819208557	DF	On-Demand	Anodyne	ADRB1	37	50
O[C@H](CNOC1CCCC1)COc1cccc(C(F)(F)F)c1	ZINC000819208557	DF	On-Demand	Anodyne	PDS	47	41
O[C@@H](CNOC1CCCC1)COc1cccc(C(F)(F)F)c1	ZINC000819208558	DF	On-Demand	Anodyne	ADRB2	27	42
O[C@@H](CNOC1CCCC1)COc1cccc(C(F)(F)F)c1	ZINC000819208558	DF	On-Demand	Anodyne	ADRB1	37	50
O[C@@H](CNOC1CCCC1)COc1cccc(C(F)(F)F)c1	ZINC000819208558	DF	On-Demand	Anodyne	PDS	47	41
O=[N+]([O-])c1cccc(OC[C@H](O)CNOC2CCCC2)c1	ZINC000819208570	CD	On-Demand	Bother	ADRB2	23	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNOC2CCCC2)c1	ZINC000819208570	CD	On-Demand	Bother	ADRB1	40	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNOC2CCCC2)c1	ZINC000819208570	CD	On-Demand	Bother	ADRB3	18	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNOC2CCCC2)c1	ZINC000819208570	CD	On-Demand	Bother	CACNA1D	62	34
O=[N+]([O-])c1cccc(OC[C@H](O)CNOC2CCCC2)c1	ZINC000819208570	CD	On-Demand	Bother	ACR	15	42
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOC2CCCC2)c1	ZINC000819208571	CD	On-Demand	Bother	ADRB2	23	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOC2CCCC2)c1	ZINC000819208571	CD	On-Demand	Bother	ADRB1	40	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOC2CCCC2)c1	ZINC000819208571	CD	On-Demand	Bother	ADRB3	18	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOC2CCCC2)c1	ZINC000819208571	CD	On-Demand	Bother	CACNA1D	62	34
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOC2CCCC2)c1	ZINC000819208571	CD	On-Demand	Bother	ACR	15	42
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208574	GF	On-Demand	Bother	MC4R	53	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCCNC(=O)c1ccccc1	ZINC000819208586	FD	On-Demand	Anodyne	CTSG	15	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCCNC(=O)c1ccccc1	ZINC000819208586	FD	On-Demand	Anodyne	FPR1	35	45
CC(=O)CCc1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819208590	DE	On-Demand	Anodyne	ADRB2	52	49
CC(=O)CCc1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819208590	DE	On-Demand	Anodyne	ADRB1	83	56
CC(=O)CCc1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819208590	DE	On-Demand	Anodyne	ADRB3	59	46
CC(=O)CCc1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819208590	DE	On-Demand	Anodyne	ABCB1	38	44
CC(=O)CCc1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819208593	DE	On-Demand	Anodyne	ADRB2	52	49
CC(=O)CCc1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819208593	DE	On-Demand	Anodyne	ADRB1	83	56
CC(=O)CCc1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819208593	DE	On-Demand	Anodyne	ADRB3	59	46
CC(=O)CCc1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819208593	DE	On-Demand	Anodyne	ABCB1	38	44
O[C@@H](CNCCc1cnccn1)c1ccccc1C(F)(F)F	ZINC000819208631	DE	On-Demand	Anodyne	ADRB3	71	39
O[C@H](CNCCc1cnccn1)c1ccccc1C(F)(F)F	ZINC000819208633	DE	On-Demand	Anodyne	ADRB3	71	39
CO[C@@H]1[C@H](C)[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1(C)C	ZINC000819208742	FF	On-Demand	Anodyne	GPR119	20	41
CO[C@@H]1[C@H](C)[C@@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1(C)C	ZINC000819208743	FF	On-Demand	Anodyne	GPR119	20	41
CO[C@@H]1[C@H](C)[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1(C)C	ZINC000819208744	FF	On-Demand	Anodyne	GPR119	20	41
CO[C@@H]1[C@H](C)[C@@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1(C)C	ZINC000819208745	FF	On-Demand	Anodyne	GPR119	20	41
C[C@@H](CCNC(=O)Cc1ccc(-n2cnnc2)cc1)NC(=O)OC(C)(C)C	ZINC000819208746	FE	On-Demand	Anodyne	FPR1	41	34
O[C@H](CNOC1CCCC1)c1cccnc1	ZINC000819208774	BD	On-Demand	Anodyne	ADRB1	25	46
O[C@H](CNOC1CCCC1)c1cccnc1	ZINC000819208774	BD	On-Demand	Anodyne	ADRB3	89	46
O[C@@H](CNOC1CCCC1)c1cccnc1	ZINC000819208775	BD	On-Demand	Anodyne	ADRB1	25	46
O[C@@H](CNOC1CCCC1)c1cccnc1	ZINC000819208775	BD	On-Demand	Anodyne	ADRB3	89	46
O[C@@H](CNOC1CCCC1)COc1cccc2ccccc12	ZINC000819208776	DG	On-Demand	Anodyne	ADRB2	44	61
O[C@@H](CNOC1CCCC1)COc1cccc2ccccc12	ZINC000819208776	DG	On-Demand	Anodyne	ADRB1	56	61
O[C@@H](CNOC1CCCC1)COc1cccc2ccccc12	ZINC000819208776	DG	On-Demand	Anodyne	ADRB3	19	61
O[C@@H](CNOC1CCCC1)COc1cccc2ccccc12	ZINC000819208776	DG	On-Demand	Anodyne	CYP2D6	21	49
O[C@@H](CNOC1CCCC1)COc1cccc2ccccc12	ZINC000819208776	DG	On-Demand	Anodyne	ABCB1	25	43
O[C@H](CNOC1CCCC1)COc1cccc2ccccc12	ZINC000819208777	DG	On-Demand	Anodyne	ADRB2	44	61
O[C@H](CNOC1CCCC1)COc1cccc2ccccc12	ZINC000819208777	DG	On-Demand	Anodyne	ADRB1	56	61
O[C@H](CNOC1CCCC1)COc1cccc2ccccc12	ZINC000819208777	DG	On-Demand	Anodyne	ADRB3	19	61
O[C@H](CNOC1CCCC1)COc1cccc2ccccc12	ZINC000819208777	DG	On-Demand	Anodyne	CYP2D6	21	49
O[C@H](CNOC1CCCC1)COc1cccc2ccccc12	ZINC000819208777	DG	On-Demand	Anodyne	ABCB1	25	43
COc1ccccc1N1CC[C@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819208780	DG	On-Demand	Anodyne	HTR1A	73	46
COc1ccccc1N1CC[C@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819208780	DG	On-Demand	Anodyne	DRD2	62	45
COc1ccccc1N1CC[C@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819208780	DG	On-Demand	Anodyne	DRD4	33	42
COc1ccccc1N1CC[C@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819208780	DG	On-Demand	Anodyne	ADRA1D	50	40
COc1ccccc1N1CC[C@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819208780	DG	On-Demand	Anodyne	ADRA1A	46	40
COc1ccccc1N1CC[C@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819208780	DG	On-Demand	Anodyne	ADRA1B	38	40
COc1ccccc1N1CC[C@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819208780	DG	On-Demand	Anodyne	DRD3	64	40
COc1ccccc1N1CC[C@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819208780	DG	On-Demand	Anodyne	HTR7	48	41
COc1ccccc1N1CC[C@@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819208781	DG	On-Demand	Anodyne	HTR1A	73	46
COc1ccccc1N1CC[C@@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819208781	DG	On-Demand	Anodyne	DRD2	62	45
COc1ccccc1N1CC[C@@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819208781	DG	On-Demand	Anodyne	DRD4	33	42
COc1ccccc1N1CC[C@@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819208781	DG	On-Demand	Anodyne	ADRA1D	50	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819208781	DG	On-Demand	Anodyne	ADRA1A	46	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819208781	DG	On-Demand	Anodyne	ADRA1B	38	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819208781	DG	On-Demand	Anodyne	DRD3	64	40
COc1ccccc1N1CC[C@@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819208781	DG	On-Demand	Anodyne	HTR7	48	41
CC(=O)Nc1cccc(CC(=O)N2CCc3cc(C(C)(C)C)ccc32)c1	ZINC000819208783	FI	On-Demand	Anodyne	EIF2AK3	76	42
C/C=C\c1ccc(OC[C@@H](O)CNOC2CCCC2)c(OC)c1	ZINC000819208784	DF	On-Demand	Anodyne	ADRB1	20	68
C/C=C\c1ccc(OC[C@H](O)CNOC2CCCC2)c(OC)c1	ZINC000819208785	DF	On-Demand	Anodyne	ADRB1	20	68
C/C=C/c1ccc(OC[C@@H](O)CNOC2CCCC2)c(OC)c1	ZINC000819208786	DF	On-Demand	Anodyne	ADRB1	20	68
C/C=C/c1ccc(OC[C@H](O)CNOC2CCCC2)c(OC)c1	ZINC000819208787	DF	On-Demand	Anodyne	ADRB1	20	68
CCOc1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819208803	CE	On-Demand	Anodyne	ADRB2	49	47
CCOc1ccc(OC[C@H](O)CNOC2CCCC2)cc1	ZINC000819208803	CE	On-Demand	Anodyne	ADRB1	60	53
CCOc1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819208804	CE	On-Demand	Anodyne	ADRB2	49	47
CCOc1ccc(OC[C@@H](O)CNOC2CCCC2)cc1	ZINC000819208804	CE	On-Demand	Anodyne	ADRB1	60	53
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(Cl)cn2)CC1	ZINC000819208805	FF	On-Demand	Anodyne	GPR119	60	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(Cl)cn2)CC1	ZINC000819208806	FF	On-Demand	Anodyne	GPR119	60	49
CCOC(=O)N[C@H](C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)C(C)C	ZINC000819208905	HD	On-Demand	Bother	ELANE	28	40
CCOC(=O)N[C@H](C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)C(C)C	ZINC000819208905	HD	On-Demand	Bother	CCR1	37	42
CCOC(=O)N[C@H](C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)C(C)C	ZINC000819208905	HD	On-Demand	Bother	COLA	85	32
CCOC(=O)N[C@@H](C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)C(C)C	ZINC000819208907	HD	On-Demand	Bother	ELANE	28	40
CCOC(=O)N[C@@H](C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)C(C)C	ZINC000819208907	HD	On-Demand	Bother	CCR1	37	42
CCOC(=O)N[C@@H](C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)C(C)C	ZINC000819208907	HD	On-Demand	Bother	COLA	85	32
O[C@@H](CNCCc1cnccn1)c1ccccc1Br	ZINC000819208908	DE	On-Demand	Anodyne	ADRB3	57	38
O[C@H](CNCCc1cnccn1)c1ccccc1Br	ZINC000819208909	DE	On-Demand	Anodyne	ADRB3	57	38
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208910	IE	On-Demand	Bother	HTR1D	17	50
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208910	IE	On-Demand	Bother	HTR1B	18	40
CCN(Cc1ccncc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819208913	FG	On-Demand	Mild	PAPA1_CARPA	49	42
CCN(Cc1ccncc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819208914	FG	On-Demand	Mild	PAPA1_CARPA	49	42
O=C(COc1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208916	HD	On-Demand	Bother	CPT1A	18	42
O=C(COc1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208916	HD	On-Demand	Bother	CPT2	40	32
C[C@H](C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)c1ccc(C(F)(F)F)cc1	ZINC000819208917	IH	On-Demand	Bother	SLC6A9	25	41
C[C@@H](C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)c1ccc(C(F)(F)F)cc1	ZINC000819208918	IH	On-Demand	Bother	SLC6A9	25	41
O=C(c1cnc(Cl)c(Cl)c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208943	HF	On-Demand	Bother	L3MBTL3	15	42
O=C(C#Cc1ccc(C(F)(F)F)cc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208951	IF	On-Demand	Mild	SLC6A9	17	41
CCCCC[C@@H](C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)C(C)C	ZINC000819208955	GH	On-Demand	Bother	COLA	61	31
O=C(COc1ccc2c(c1)CCC2)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208958	HE	On-Demand	Bother	HTR1D	16	45
O=C(COc1ccc2c(c1)CCC2)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208958	HE	On-Demand	Bother	CPT1A	22	43
O=C(COc1ccc2c(c1)CCC2)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208958	HE	On-Demand	Bother	CPT2	45	39
O=C(c1ccc(C2SCCS2)cc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208970	IH	On-Demand	Bother	L3MBTL3	52	45
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208996	IF	On-Demand	Bother	P2RY12	140	41
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208996	IF	On-Demand	Bother	TGM2	15	40
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819208996	IF	On-Demand	Bother	FPR1	41	33
O=C(c1cc([N+](=O)[O-])ccc1O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819209000	HD	On-Demand	Bother	KCNMA1	26	41
O=C(c1ccc2nnc(S)n2c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819209009	HD	On-Demand	Bother	L3MBTL3	19	42
COc1ccccc1[C@@H]1[C@H](C(=O)Nc2cccnc2Cl)CCC(=O)N1c1ccc(C)cc1	ZINC000819209058	IK	On-Demand	Anodyne	G2YM83_BOTF4	51	33
COc1ccccc1[C@@H]1[C@@H](C(=O)Nc2cccnc2Cl)CCC(=O)N1c1ccc(C)cc1	ZINC000819209060	IK	On-Demand	Anodyne	G2YM83_BOTF4	51	33
O=C(CCc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819209106	FG	On-Demand	Reactive	PPARA	15	40
O=C(CCc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819209106	FG	On-Demand	Reactive	PLA2G4A	31	49
O=C(CCc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819209106	FG	On-Demand	Reactive	HCAR2	20	40
O=C(CCc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819209106	FG	On-Demand	Reactive	FFAR1	60	48
O=C(CCc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819209106	FG	On-Demand	Reactive	FFAR4	43	46
O=C(CCc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819209106	FG	On-Demand	Reactive	CRTM	64	40
O=C(CCc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819209106	FG	On-Demand	Reactive	PDS	57	34
O=C(COc1cccc([N+](=O)[O-])c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819209124	HD	On-Demand	Bother	HTR1D	15	45
O=C(COc1cccc([N+](=O)[O-])c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819209124	HD	On-Demand	Bother	CPT1A	19	42
O=C(COc1cccc([N+](=O)[O-])c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819209124	HD	On-Demand	Bother	CPT2	40	34
CC(C)(C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)c1ccc([N+](=O)[O-])cc1F	ZINC000819209134	IF	On-Demand	Bother	SLC6A9	19	44
O=C(/C=C\c1ccccc1F)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819209164	GF	On-Demand	Bother	ITGAL	17	42
O=C(/C=C/c1ccccc1F)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819209168	GF	On-Demand	Bother	ITGAL	17	42
CN(CC(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)C(=O)OCc1ccccc1	ZINC000819209188	IE	On-Demand	Bother	SLC12A5	64	36
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCOc3c(C)cccc32)c1	ZINC000819209189	EG	On-Demand	Anodyne	LUXR	77	44
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCOc3c(C)cccc32)c1	ZINC000819209189	EG	On-Demand	Anodyne	TRAR	79	44
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCOc3c(C)cccc32)c1	ZINC000819209189	EG	On-Demand	Anodyne	LASR	51	44
O=C(c1ccc(-n2cccc2)nc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819209190	HE	On-Demand	Bother	L3MBTL3	15	41
CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819209194	IE	On-Demand	Bother	HCN1	55	37
CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819209194	IE	On-Demand	Bother	HCN4	45	35
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1	ZINC000819209200	GH	On-Demand	Anodyne	AVPR2	52	49
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1	ZINC000819209201	GH	On-Demand	Anodyne	AVPR2	52	49
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1	ZINC000819209204	GH	On-Demand	Anodyne	AVPR2	52	49
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1	ZINC000819209206	GH	On-Demand	Anodyne	AVPR2	52	49
CC(C)n1ncc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)c1N	ZINC000819209217	GD	On-Demand	Bother	COLA	41	31
CC(C)(C)NS(=O)(=O)c1cc(C(=O)Nc2cccnc2Cl)ccc1Cl	ZINC000819209245	HH	On-Demand	Anodyne	GRM4	36	44
CC(C)(C)NS(=O)(=O)c1cc(C(=O)Nc2cccnc2Cl)ccc1Cl	ZINC000819209245	HH	On-Demand	Anodyne	G2YM83_BOTF4	72	39
Cc1ccccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819209254	FG	On-Demand	Anodyne	ESR1	82	40
Cc1ccccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819209254	FG	On-Demand	Anodyne	ADRB2	77	47
Cc1ccccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819209254	FG	On-Demand	Anodyne	ADRB1	105	47
Cc1ccccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819209254	FG	On-Demand	Anodyne	ESR2	56	40
Cc1ccccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819209254	FG	On-Demand	Anodyne	ADRB3	98	47
Cc1ccccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819209254	FG	On-Demand	Anodyne	LTA4H	79	54
Cc1ccccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819209254	FG	On-Demand	Anodyne	HRH3	64	47
Cc1ccccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819209254	FG	On-Demand	Anodyne	HNMT	53	43
Cc1ccccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819209254	FG	On-Demand	Anodyne	TNK2	19	43
Cc1ccccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819209254	FG	On-Demand	Anodyne	PSMB2	47	45
Cc1ccccc1[C@@H](O)CNCCc1ccc(OCCN2CCCC2)cc1	ZINC000819209254	FG	On-Demand	Anodyne	PSMB1	52	45
O=C(Nc1ccc(C(=O)NCC(F)(F)F)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209261	GC	On-Demand	Anodyne	EPHX2	31	40
O=C(Nc1ccc(C(=O)NCC(F)(F)F)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209262	GC	On-Demand	Anodyne	EPHX2	31	40
O=C(Nc1ccc(C(=O)N2CCCCCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209267	FG	On-Demand	Anodyne	AVPR2	22	42
O=C(Nc1ccc(C(=O)N2CCCCCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209267	FG	On-Demand	Anodyne	NPY2R	17	42
O=C(Nc1ccc(C(=O)N2CCCCCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209267	FG	On-Demand	Anodyne	EPHX2	50	49
O=C(Nc1ccc(C(=O)N2CCCCCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209267	FG	On-Demand	Anodyne	MLYCD	19	43
O=C(Nc1ccc(C(=O)N2CCCCCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209267	FG	On-Demand	Anodyne	L3MBTL3	74	40
O=C(Nc1ccc(Br)cc1)c1cccnc1N1CC[C@@H](C(=O)O)C1	ZINC000819209268	GG	On-Demand	Anodyne	TRPV1	19	51
O=C(Nc1ccc(Br)cc1)c1cccnc1N1CC[C@H](C(=O)O)C1	ZINC000819209269	GG	On-Demand	Anodyne	TRPV1	19	51
O=C(Nc1ccc(C(=O)NC2CCOCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209271	GE	On-Demand	Anodyne	EPHX2	47	43
O=C(Nc1ccc(C(=O)Nc2ccccc2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209272	FG	On-Demand	Anodyne	RARA	17	42
O=C(Nc1ccc(C(=O)Nc2ccccc2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209272	FG	On-Demand	Anodyne	AVPR2	31	42
O=C(Nc1ccc(C(=O)Nc2ccccc2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209272	FG	On-Demand	Anodyne	AVPR1A	18	41
O=C(Nc1ccc(C(=O)Nc2ccccc2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209272	FG	On-Demand	Anodyne	PRNP	63	49
O=C(Nc1ccc(C(=O)Nc2ccccc2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209272	FG	On-Demand	Anodyne	EPHX2	37	44
O=C(Nc1ccc(C(=O)Nc2ccccc2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209272	FG	On-Demand	Anodyne	TAAR1	31	42
O=C(Nc1ccc(C(=O)Nc2ccccc2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209272	FG	On-Demand	Anodyne	SMO	20	42
O=C(Nc1ccc(C(=O)Nc2ccccc2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209272	FG	On-Demand	Anodyne	DGAT1	21	40
O=C(Nc1ccc(C(=O)Nc2ccccc2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209272	FG	On-Demand	Anodyne	KCNK3	107	44
O=C(Nc1ccc(C(=O)Nc2ccccc2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209272	FG	On-Demand	Anodyne	KCNK9	64	40
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	ACE	64	45
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	MME	116	43
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	ANPEP	65	38
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	CMA1	41	35
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	CTRA_BOVIN	29	45
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	PAPA1_CARPA	33	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	CTSL	39	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	CPA1	48	40
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	NPFFR2	33	40
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	ITGA4	36	48
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	CTRB1	25	41
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	NAALAD2	30	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	ECE1	41	39
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	CTSS	25	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	CAPN1	35	49
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	ACE2	90	42
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	CTSV	35	41
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	PIN1	43	41
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	FPR1	73	38
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	BLA1_STEMA	84	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	BRCA1	54	39
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819209273	FD	On-Demand	Anodyne	NPFFR1	38	40
O=C(Nc1ccc(-n2cccn2)c(F)c1)NC1(C(=O)O)CCCC1	ZINC000819209274	EF	On-Demand	Anodyne	NPY2R	40	34
O=C(Nc1ccc(C(=O)N2CC[C@H](C(=O)O)C2)c(O)c1)c1cc(F)cc(F)c1	ZINC000819209277	GE	On-Demand	Anodyne	SLC6A1	67	35
O=C(Nc1ccc(C(=O)N2CC[C@H](C(=O)O)C2)c(O)c1)c1cc(F)cc(F)c1	ZINC000819209277	GE	On-Demand	Anodyne	L3MBTL3	41	36
O=C(Nc1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)c(O)c1)c1cc(F)cc(F)c1	ZINC000819209278	GE	On-Demand	Anodyne	SLC6A1	67	35
O=C(Nc1ccc(C(=O)N2CC[C@@H](C(=O)O)C2)c(O)c1)c1cc(F)cc(F)c1	ZINC000819209278	GE	On-Demand	Anodyne	L3MBTL3	41	36
O=C(Nc1cc(N2CCCS2(=O)=O)ccc1F)NC1(C(=O)O)CCCC1	ZINC000819209281	GD	On-Demand	Anodyne	CDK1	17	41
O=C(Nc1ccc(C(=O)NC2CC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209282	EC	On-Demand	Anodyne	EPHX2	37	42
O=C(Nc1ccc(C(=O)NC2CC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209283	EC	On-Demand	Anodyne	EPHX2	37	42
O=C(Nc1ccc(CC(=O)N2CCOCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209284	GD	On-Demand	Anodyne	EPHX2	48	44
O=C(Nc1ccc(-c2ccccc2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209285	EE	On-Demand	Anodyne	SLC6A1	62	37
O=C(Nc1ccc(-c2ccccc2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209285	EE	On-Demand	Anodyne	DHODH	24	49
O=C(Nc1ccc(-c2ccccc2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209285	EE	On-Demand	Anodyne	CHRNA7	16	44
O=C(Nc1ccc(-c2ccccc2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209285	EE	On-Demand	Anodyne	PRNP	44	41
O=C(Nc1ccc(-c2ccccc2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209286	EE	On-Demand	Anodyne	SLC6A1	62	37
O=C(Nc1ccc(-c2ccccc2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209286	EE	On-Demand	Anodyne	DHODH	24	49
O=C(Nc1ccc(-c2ccccc2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209286	EE	On-Demand	Anodyne	CHRNA7	16	44
O=C(Nc1ccc(-c2ccccc2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209286	EE	On-Demand	Anodyne	PRNP	44	41
O=C(Nc1ccc(-n2cnnn2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209287	EB	On-Demand	Anodyne	KCNJ1	40	34
O=C(Nc1ccc(-n2cnnn2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209288	EB	On-Demand	Anodyne	KCNJ1	40	34
O=C(Nc1ccc(CCN2CCCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209289	FD	On-Demand	Anodyne	SLC6A1	135	37
O=C(Nc1ccc(CCN2CCCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209289	FD	On-Demand	Anodyne	HRH3	25	43
O=C(Nc1ccc(CCN2CCCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209289	FD	On-Demand	Anodyne	CHRNA7	15	40
O=C(Nc1ccc(CCN2CCCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209289	FD	On-Demand	Anodyne	L3MBTL3	43	42
O=C(Nc1ccc(CCN2CCCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209290	FD	On-Demand	Anodyne	SLC6A1	135	37
O=C(Nc1ccc(CCN2CCCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209290	FD	On-Demand	Anodyne	HRH3	25	43
O=C(Nc1ccc(CCN2CCCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209290	FD	On-Demand	Anodyne	CHRNA7	15	40
O=C(Nc1ccc(CCN2CCCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209290	FD	On-Demand	Anodyne	L3MBTL3	43	42
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209292	FD	On-Demand	Anodyne	PIK3CA	37	48
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209292	FD	On-Demand	Anodyne	MTOR	66	48
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209292	FD	On-Demand	Anodyne	EPHX2	59	65
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209292	FD	On-Demand	Anodyne	PIK3CG	34	48
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209292	FD	On-Demand	Anodyne	BTK	37	41
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209292	FD	On-Demand	Anodyne	L3MBTL3	42	33
O=C(Nc1ccc(-c2noc(C(F)(F)F)n2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209293	GG	On-Demand	Anodyne	MTOR	46	36
O=C(Nc1cc(N2CCCC2=O)ccc1Cl)NC1(C(=O)O)CCCC1	ZINC000819209297	FF	On-Demand	Anodyne	HEMY	44	35
O=C(Nc1ccc(CCN2CCSCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209298	GF	On-Demand	Anodyne	EPHX2	37	42
O=C(Nc1ccc(CCN2CCOCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209306	GC	On-Demand	Anodyne	CASR	47	37
O=C(Nc1ccc(CCN2CCOCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209306	GC	On-Demand	Anodyne	PIK3CA	16	42
O=C(Nc1ccc(CCN2CCOCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209306	GC	On-Demand	Anodyne	MTOR	30	42
O=C(Nc1ccc(CCN2CCOCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209306	GC	On-Demand	Anodyne	EPHX2	27	40
O=C(Nc1ccc(CCN2CCOCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209306	GC	On-Demand	Anodyne	L3MBTL3	29	44
O=C(Nc1ccc(CCN2CCOCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209307	GC	On-Demand	Anodyne	CASR	47	37
O=C(Nc1ccc(CCN2CCOCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209307	GC	On-Demand	Anodyne	PIK3CA	16	42
O=C(Nc1ccc(CCN2CCOCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209307	GC	On-Demand	Anodyne	MTOR	30	42
O=C(Nc1ccc(CCN2CCOCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209307	GC	On-Demand	Anodyne	EPHX2	27	40
O=C(Nc1ccc(CCN2CCOCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209307	GC	On-Demand	Anodyne	L3MBTL3	29	44
O=C(Nc1ccc(CCN2CCOCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209308	FE	On-Demand	Anodyne	PIK3CA	20	41
O=C(Nc1ccc(CCN2CCOCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209308	FE	On-Demand	Anodyne	MTOR	39	41
O=C(Nc1ccc(CCN2CCOCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209308	FE	On-Demand	Anodyne	EPHX2	50	47
O=C(Nc1ccc(CCN2CCOCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209308	FE	On-Demand	Anodyne	PIK3CG	19	41
O=C(Nc1cc(N2CCCC2=O)ccc1F)NC1(C(=O)O)CCCC1	ZINC000819209312	EE	On-Demand	Anodyne	HEMY	40	33
O=C(Nc1ccc(-c2ccccc2)cc1F)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209318	FE	On-Demand	Anodyne	SLC6A1	55	36
O=C(Nc1ccc(-c2ccccc2)cc1F)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209318	FE	On-Demand	Anodyne	DHODH	27	43
O=C(Nc1ccc(-c2ccccc2)cc1F)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209319	FE	On-Demand	Anodyne	SLC6A1	55	36
O=C(Nc1ccc(-c2ccccc2)cc1F)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209319	FE	On-Demand	Anodyne	DHODH	27	43
O=C(Nc1ccc(C(=O)NC2CCCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209320	FF	On-Demand	Anodyne	EPHX2	56	48
O=C(Nc1ccc(C(=O)NC2CC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209321	EE	On-Demand	Anodyne	MAPK14	16	40
O=C(Nc1ccc(C(=O)NC2CC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209321	EE	On-Demand	Anodyne	EPHX2	52	43
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209326	GC	On-Demand	Anodyne	PIK3CA	34	48
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209326	GC	On-Demand	Anodyne	MTOR	65	48
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209326	GC	On-Demand	Anodyne	EPHX2	22	56
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209326	GC	On-Demand	Anodyne	PIK3CG	30	48
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209326	GC	On-Demand	Anodyne	L3MBTL3	83	41
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209327	GC	On-Demand	Anodyne	PIK3CA	34	48
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209327	GC	On-Demand	Anodyne	MTOR	65	48
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209327	GC	On-Demand	Anodyne	EPHX2	22	56
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209327	GC	On-Demand	Anodyne	PIK3CG	30	48
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209327	GC	On-Demand	Anodyne	L3MBTL3	83	41
O=C(Nc1ccc(CC(=O)N2CCSCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209329	GE	On-Demand	Anodyne	EPHX2	34	43
O=C(Nc1ccc(C(=O)NCC(F)(F)F)cc1)NC1(C(=O)O)CCCC1	ZINC000819209330	FE	On-Demand	Anodyne	EPHX2	38	46
O=C(Nc1ccc(C(=O)NC2CCOCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209335	GC	On-Demand	Anodyne	EPHX2	29	40
O=C(Nc1ccc(C(=O)NC2CCOCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209336	GC	On-Demand	Anodyne	EPHX2	29	40
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	ACE	53	52
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	FOLH1	16	43
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	MME	134	52
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	ANPEP	72	40
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	CMA1	36	40
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	CTRA_BOVIN	31	40
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	CTSB	33	45
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	CYSP_TRYCR	55	38
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	CPA1	60	42
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	PYGL	31	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	ITGA4	16	43
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	NAALAD2	31	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	CAPNS1	52	37
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	ECE1	50	41
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	CAPN1	52	52
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	CAPN2	31	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	ACE2	93	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	PIN1	59	45
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	MMP1	15	40
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	FPR1	77	40
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1ccc(F)cc1C(F)(F)F	ZINC000819209337	FG	On-Demand	Anodyne	BLA1_STEMA	86	48
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209338	EE	On-Demand	Anodyne	AVPR2	24	43
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209338	EE	On-Demand	Anodyne	AVPR1A	15	43
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209338	EE	On-Demand	Anodyne	EPHX2	56	50
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209338	EE	On-Demand	Anodyne	MLYCD	18	42
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209338	EE	On-Demand	Anodyne	L3MBTL3	75	39
O=C(Nc1ccc(-c2noc(C(F)F)n2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209352	FG	On-Demand	Anodyne	MTOR	51	38
O=C(Nc1ccc(CCC(=O)N2CCCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819209354	FF	On-Demand	Anodyne	EPHX2	34	45
O=C(Nc1ccc(=O)n(Cc2ccccc2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209356	FC	On-Demand	Anodyne	SLC6A1	64	33
O=C(Nc1ccc(=O)n(Cc2ccccc2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209356	FC	On-Demand	Anodyne	SIGMAR1	23	44
O=C(Nc1ccc(=O)n(Cc2ccccc2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209357	FC	On-Demand	Anodyne	SLC6A1	64	33
O=C(Nc1ccc(=O)n(Cc2ccccc2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209357	FC	On-Demand	Anodyne	SIGMAR1	23	44
O=C(Nc1ccc(CCN2CCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209358	FD	On-Demand	Anodyne	SLC6A1	135	37
O=C(Nc1ccc(CCN2CCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209358	FD	On-Demand	Anodyne	HRH3	25	43
O=C(Nc1ccc(CCN2CCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209358	FD	On-Demand	Anodyne	CHRNA7	15	40
O=C(Nc1ccc(CCN2CCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209358	FD	On-Demand	Anodyne	L3MBTL3	43	42
O=C(Nc1ccc(CCN2CCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209359	FD	On-Demand	Anodyne	SLC6A1	135	37
O=C(Nc1ccc(CCN2CCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209359	FD	On-Demand	Anodyne	HRH3	25	43
O=C(Nc1ccc(CCN2CCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209359	FD	On-Demand	Anodyne	CHRNA7	15	40
O=C(Nc1ccc(CCN2CCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209359	FD	On-Demand	Anodyne	L3MBTL3	43	42
O=C(Nc1ccc(-c2ccccc2)nn1)NC1(C(=O)O)CCCC1	ZINC000819209360	EF	On-Demand	Anodyne	NPPA	59	38
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	ACE	60	45
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	MME	136	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	ANPEP	75	39
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	CTSB	17	40
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	CCKAR	31	49
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	CPA1	61	41
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	PYGL	17	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	NAALAD2	25	42
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	CAPNS1	42	35
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	MMP2	18	40
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	ECE1	79	44
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	CCKBR	17	41
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	CAPN1	39	49
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	CAPN2	22	40
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	ACE2	88	41
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	GART	49	35
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	PIN1	54	43
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	FPR1	79	41
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	NPR	40	39
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	BLA1_STEMA	85	48
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	KISS1R	41	30
O=C(N[C@H](Cc1ccccc1)C(=O)O)c1nc(=O)c2ccccc2[nH]1	ZINC000819209376	ED	On-Demand	Anodyne	SLC46A1	49	35
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209378	FC	On-Demand	Anodyne	NPY2R	26	43
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209378	FC	On-Demand	Anodyne	EPHX2	26	46
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209378	FC	On-Demand	Anodyne	L3MBTL3	105	48
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209380	FC	On-Demand	Anodyne	NPY2R	26	43
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209380	FC	On-Demand	Anodyne	EPHX2	26	46
O=C(Nc1ccc(C(=O)N2CCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209380	FC	On-Demand	Anodyne	L3MBTL3	105	48
O=C(Nc1ccc(CC(=O)N2CCOCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209383	GB	On-Demand	Anodyne	MLNR	26	41
O=C(Nc1ccc(CC(=O)N2CCOCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819209383	GB	On-Demand	Anodyne	EPHX2	21	42
O=C(Nc1ccc(CC(=O)N2CCOCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209385	GB	On-Demand	Anodyne	MLNR	26	41
O=C(Nc1ccc(CC(=O)N2CCOCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819209385	GB	On-Demand	Anodyne	EPHX2	21	42
O=C(Nc1cc(F)cc(N2CCOCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819209387	FE	On-Demand	Anodyne	EPHX2	20	42
CON(C)C(=O)CCNCc1ccccc1-n1ccnc1	ZINC000819209417	CD	On-Demand	Anodyne	NOS2	40	30
C[C@H](CC(=O)NNC(=O)CCc1ccccc1)n1cccn1	ZINC000819209433	DD	On-Demand	Reactive	CASP1	15	40
C[C@@H](CC(=O)NNC(=O)CCc1ccccc1)n1cccn1	ZINC000819209434	DD	On-Demand	Reactive	CASP1	15	40
C#CCCN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819209445	FD	On-Demand	Mild	PAPA1_CARPA	33	41
C#CCCN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819209446	FD	On-Demand	Mild	PAPA1_CARPA	33	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2cnccn2)CC1	ZINC000819209454	FD	On-Demand	Anodyne	GPR119	51	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2cnccn2)CC1	ZINC000819209455	FD	On-Demand	Anodyne	GPR119	51	51
Cc1cccc2c1OCC[C@@H]2NC(=O)Cc1nsc2ccccc12	ZINC000819209464	EH	On-Demand	Anodyne	LUXR	66	36
Cc1cccc2c1OCC[C@@H]2NC(=O)Cc1nsc2ccccc12	ZINC000819209464	EH	On-Demand	Anodyne	TRAR	72	36
Cc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819209507	EE	On-Demand	Anodyne	ADRB2	29	47
Cc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819209507	EE	On-Demand	Anodyne	ADRB1	41	40
Cc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819209508	EE	On-Demand	Anodyne	ADRB2	29	47
Cc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819209508	EE	On-Demand	Anodyne	ADRB1	41	40
Cc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819209509	EE	On-Demand	Anodyne	ADRB2	29	47
Cc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819209509	EE	On-Demand	Anodyne	ADRB1	41	40
Cc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819209510	EE	On-Demand	Anodyne	ADRB2	29	47
Cc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819209510	EE	On-Demand	Anodyne	ADRB1	41	40
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819209521	GD	On-Demand	Anodyne	ADRB2	34	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819209521	GD	On-Demand	Anodyne	ADRB1	58	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819209521	GD	On-Demand	Anodyne	ADRB3	36	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819209522	GD	On-Demand	Anodyne	ADRB2	34	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819209522	GD	On-Demand	Anodyne	ADRB1	58	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819209522	GD	On-Demand	Anodyne	ADRB3	36	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819209523	GD	On-Demand	Anodyne	ADRB2	34	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819209523	GD	On-Demand	Anodyne	ADRB1	58	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819209523	GD	On-Demand	Anodyne	ADRB3	36	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819209524	GD	On-Demand	Anodyne	ADRB2	34	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819209524	GD	On-Demand	Anodyne	ADRB1	58	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819209524	GD	On-Demand	Anodyne	ADRB3	36	42
CC(=O)Nc1cccc(CC(=O)NCC[C@@H](C)NC(=O)OC(C)(C)C)c1	ZINC000819209548	FF	On-Demand	Anodyne	CTSK	15	41
CC(=O)Nc1cccc(CC(=O)NCC[C@@H](C)NC(=O)OC(C)(C)C)c1	ZINC000819209548	FF	On-Demand	Anodyne	FPR1	50	38
CC(=O)Nc1cccc(CC(=O)NCC[C@H](C)NC(=O)OC(C)(C)C)c1	ZINC000819209549	FF	On-Demand	Anodyne	CTSK	15	41
CC(=O)Nc1cccc(CC(=O)NCC[C@H](C)NC(=O)OC(C)(C)C)c1	ZINC000819209549	FF	On-Demand	Anodyne	FPR1	50	38
COc1ccccc1COC[C@H](O)CNC[C@H]1COC2(CCCCC2)O1	ZINC000819209550	FE	On-Demand	Anodyne	ADRA1D	24	44
COc1ccccc1COC[C@H](O)CNC[C@H]1COC2(CCCCC2)O1	ZINC000819209550	FE	On-Demand	Anodyne	ADRA1A	17	48
COc1ccccc1COC[C@H](O)CNC[C@H]1COC2(CCCCC2)O1	ZINC000819209550	FE	On-Demand	Anodyne	ADRA1B	25	48
COc1ccccc1COC[C@H](O)CNC[C@@H]1COC2(CCCCC2)O1	ZINC000819209551	FE	On-Demand	Anodyne	ADRA1D	24	44
COc1ccccc1COC[C@H](O)CNC[C@@H]1COC2(CCCCC2)O1	ZINC000819209551	FE	On-Demand	Anodyne	ADRA1A	17	48
COc1ccccc1COC[C@H](O)CNC[C@@H]1COC2(CCCCC2)O1	ZINC000819209551	FE	On-Demand	Anodyne	ADRA1B	25	48
COc1ccccc1COC[C@@H](O)CNC[C@H]1COC2(CCCCC2)O1	ZINC000819209552	FE	On-Demand	Anodyne	ADRA1D	24	44
COc1ccccc1COC[C@@H](O)CNC[C@H]1COC2(CCCCC2)O1	ZINC000819209552	FE	On-Demand	Anodyne	ADRA1A	17	48
COc1ccccc1COC[C@@H](O)CNC[C@H]1COC2(CCCCC2)O1	ZINC000819209552	FE	On-Demand	Anodyne	ADRA1B	25	48
COc1ccccc1COC[C@@H](O)CNC[C@@H]1COC2(CCCCC2)O1	ZINC000819209553	FE	On-Demand	Anodyne	ADRA1D	24	44
COc1ccccc1COC[C@@H](O)CNC[C@@H]1COC2(CCCCC2)O1	ZINC000819209553	FE	On-Demand	Anodyne	ADRA1A	17	48
COc1ccccc1COC[C@@H](O)CNC[C@@H]1COC2(CCCCC2)O1	ZINC000819209553	FE	On-Demand	Anodyne	ADRA1B	25	48
O[C@H](CNC[C@H]1COC2(CCCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819209558	FF	On-Demand	Anodyne	ADRB1	17	56
O[C@H](CNC[C@H]1COC2(CCCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819209558	FF	On-Demand	Anodyne	HTR1A	15	56
O[C@@H](CNC[C@H]1COC2(CCCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819209559	FF	On-Demand	Anodyne	ADRB1	17	56
O[C@@H](CNC[C@H]1COC2(CCCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819209559	FF	On-Demand	Anodyne	HTR1A	15	56
O[C@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819209560	FF	On-Demand	Anodyne	ADRB1	17	56
O[C@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819209560	FF	On-Demand	Anodyne	HTR1A	15	56
O[C@@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819209561	FF	On-Demand	Anodyne	ADRB1	17	56
O[C@@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819209561	FF	On-Demand	Anodyne	HTR1A	15	56
Cc1ccc(C(=O)N2CCSCC2)cc1OC(=O)/C=C/[C@H]1CCCO1	ZINC000819209604	FF	On-Demand	Anodyne	L3MBTL3	41	33
Cc1ccc(C(=O)N2CCSCC2)cc1OC(=O)/C=C/[C@@H]1CCCO1	ZINC000819209605	FF	On-Demand	Anodyne	L3MBTL3	41	33
Cc1ccc(C(=O)N2CCSCC2)cc1OC(=O)/C=C\[C@H]1CCCO1	ZINC000819209606	FF	On-Demand	Anodyne	L3MBTL3	41	33
Cc1ccc(C(=O)N2CCSCC2)cc1OC(=O)/C=C\[C@@H]1CCCO1	ZINC000819209607	FF	On-Demand	Anodyne	L3MBTL3	41	33
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819209659	FE	On-Demand	Anodyne	ADRB2	26	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819209659	FE	On-Demand	Anodyne	ADRB1	51	39
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819209660	FE	On-Demand	Anodyne	ADRB2	26	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819209660	FE	On-Demand	Anodyne	ADRB1	51	39
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819209661	FE	On-Demand	Anodyne	ADRB2	26	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819209661	FE	On-Demand	Anodyne	ADRB1	51	39
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819209662	FE	On-Demand	Anodyne	ADRB2	26	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819209662	FE	On-Demand	Anodyne	ADRB1	51	39
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1COC2(CCCCC2)O1	ZINC000819209707	GE	On-Demand	Anodyne	ADRA1D	30	44
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1COC2(CCCCC2)O1	ZINC000819209707	GE	On-Demand	Anodyne	ADRA1A	23	47
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1COC2(CCCCC2)O1	ZINC000819209707	GE	On-Demand	Anodyne	ADRA1B	30	47
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1COC2(CCCCC2)O1	ZINC000819209708	GE	On-Demand	Anodyne	ADRA1D	30	44
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1COC2(CCCCC2)O1	ZINC000819209708	GE	On-Demand	Anodyne	ADRA1A	23	47
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1COC2(CCCCC2)O1	ZINC000819209708	GE	On-Demand	Anodyne	ADRA1B	30	47
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1COC2(CCCCC2)O1	ZINC000819209709	GE	On-Demand	Anodyne	ADRA1D	30	44
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1COC2(CCCCC2)O1	ZINC000819209709	GE	On-Demand	Anodyne	ADRA1A	23	47
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1COC2(CCCCC2)O1	ZINC000819209709	GE	On-Demand	Anodyne	ADRA1B	30	47
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1COC2(CCCCC2)O1	ZINC000819209710	GE	On-Demand	Anodyne	ADRA1D	30	44
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1COC2(CCCCC2)O1	ZINC000819209710	GE	On-Demand	Anodyne	ADRA1A	23	47
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1COC2(CCCCC2)O1	ZINC000819209710	GE	On-Demand	Anodyne	ADRA1B	30	47
O[C@@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1cccc(C(F)(F)F)c1	ZINC000819209785	GG	On-Demand	Anodyne	PDS	41	36
O[C@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1cccc(C(F)(F)F)c1	ZINC000819209786	GG	On-Demand	Anodyne	PDS	41	36
O[C@@H](CNC[C@H]1COC2(CCCCC2)O1)COc1cccc(C(F)(F)F)c1	ZINC000819209787	GG	On-Demand	Anodyne	PDS	41	36
O[C@H](CNC[C@H]1COC2(CCCCC2)O1)COc1cccc(C(F)(F)F)c1	ZINC000819209788	GG	On-Demand	Anodyne	PDS	41	36
Cc1c(NC(=O)CSCC(=O)Nc2cccnc2Cl)c(=O)n(-c2ccccc2)n1C	ZINC000819209797	IF	On-Demand	Anodyne	FPR2	55	48
Cc1c(NC(=O)CSCC(=O)Nc2cccnc2Cl)c(=O)n(-c2ccccc2)n1C	ZINC000819209797	IF	On-Demand	Anodyne	G2YM83_BOTF4	57	32
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(Cl)cn2)cc1	ZINC000819209805	ED	On-Demand	Anodyne	PTGS2	20	44
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(Cl)cn2)cc1	ZINC000819209806	ED	On-Demand	Anodyne	PTGS2	20	44
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccnc2Cl)ccc1Br	ZINC000819209807	HG	On-Demand	Anodyne	G2YM83_BOTF4	72	39
O=C(/C=C\c1cc(C(F)(F)F)ccc1Cl)Nc1cccnc1Cl	ZINC000819209846	FK	On-Demand	Anodyne	TRPV1	24	40
O=C(/C=C\c1cc(C(F)(F)F)ccc1Cl)Nc1cccnc1Cl	ZINC000819209846	FK	On-Demand	Anodyne	P2RY1	15	42
O=C(/C=C\c1cc(C(F)(F)F)ccc1Cl)Nc1cccnc1Cl	ZINC000819209846	FK	On-Demand	Anodyne	G2YM83_BOTF4	56	31
O=C(/C=C/c1cc(C(F)(F)F)ccc1Cl)Nc1cccnc1Cl	ZINC000819209847	FK	On-Demand	Anodyne	TRPV1	24	40
O=C(/C=C/c1cc(C(F)(F)F)ccc1Cl)Nc1cccnc1Cl	ZINC000819209847	FK	On-Demand	Anodyne	P2RY1	15	42
O=C(/C=C/c1cc(C(F)(F)F)ccc1Cl)Nc1cccnc1Cl	ZINC000819209847	FK	On-Demand	Anodyne	G2YM83_BOTF4	56	31
C=CCCC[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819209872	CF	On-Demand	Mild	ADRB3	41	38
C=CCCC[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819209873	CF	On-Demand	Mild	ADRB3	41	38
C=CCCC[C@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819209874	CF	On-Demand	Mild	ADRB3	41	38
C=CCCC[C@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819209875	CF	On-Demand	Mild	ADRB3	41	38
C[C@H](CCNC(=O)[C@H]1CCCC[C@H]1C)NC(=O)OC(C)(C)C	ZINC000819209989	DG	On-Demand	Anodyne	CTSK	18	44
C[C@H](CCNC(=O)[C@@H]1CCCC[C@H]1C)NC(=O)OC(C)(C)C	ZINC000819209990	DG	On-Demand	Anodyne	CTSK	18	44
O[C@@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1ccccc1	ZINC000819210010	DE	On-Demand	Anodyne	ADRB2	39	47
O[C@@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1ccccc1	ZINC000819210010	DE	On-Demand	Anodyne	ADRB1	58	41
O[C@@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1ccccc1	ZINC000819210010	DE	On-Demand	Anodyne	ADRB3	36	41
O[C@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1ccccc1	ZINC000819210011	DE	On-Demand	Anodyne	ADRB2	39	47
O[C@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1ccccc1	ZINC000819210011	DE	On-Demand	Anodyne	ADRB1	58	41
O[C@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1ccccc1	ZINC000819210011	DE	On-Demand	Anodyne	ADRB3	36	41
O[C@@H](CNC[C@H]1COC2(CCCCC2)O1)COc1ccccc1	ZINC000819210012	DE	On-Demand	Anodyne	ADRB2	39	47
O[C@@H](CNC[C@H]1COC2(CCCCC2)O1)COc1ccccc1	ZINC000819210012	DE	On-Demand	Anodyne	ADRB1	58	41
O[C@@H](CNC[C@H]1COC2(CCCCC2)O1)COc1ccccc1	ZINC000819210012	DE	On-Demand	Anodyne	ADRB3	36	41
O[C@H](CNC[C@H]1COC2(CCCCC2)O1)COc1ccccc1	ZINC000819210013	DE	On-Demand	Anodyne	ADRB2	39	47
O[C@H](CNC[C@H]1COC2(CCCCC2)O1)COc1ccccc1	ZINC000819210013	DE	On-Demand	Anodyne	ADRB1	58	41
O[C@H](CNC[C@H]1COC2(CCCCC2)O1)COc1ccccc1	ZINC000819210013	DE	On-Demand	Anodyne	ADRB3	36	41
CCOc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210024	FE	On-Demand	Anodyne	ADRB1	43	38
CCOc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210025	FE	On-Demand	Anodyne	ADRB1	43	38
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210026	FE	On-Demand	Anodyne	ADRB1	43	38
CCOc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210027	FE	On-Demand	Anodyne	ADRB1	43	38
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)cc1	ZINC000819210048	HG	On-Demand	Anodyne	MMP13	63	42
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)cc1	ZINC000819210048	HG	On-Demand	Anodyne	CCR3	16	40
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)cc1	ZINC000819210048	HG	On-Demand	Anodyne	ADAM17	51	39
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)cc1	ZINC000819210048	HG	On-Demand	Anodyne	MMP3	48	39
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)cc1	ZINC000819210048	HG	On-Demand	Anodyne	EPHX2	38	48
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)cc1	ZINC000819210048	HG	On-Demand	Anodyne	TGM2	53	36
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)cc1	ZINC000819210048	HG	On-Demand	Anodyne	MMP7	51	39
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)cc1	ZINC000819210048	HG	On-Demand	Anodyne	MMP1	56	39
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)cc1	ZINC000819210048	HG	On-Demand	Anodyne	F13A1	50	36
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)cc1	ZINC000819210048	HG	On-Demand	Anodyne	NAMPT	41	39
CCOc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)cc1	ZINC000819210048	HG	On-Demand	Anodyne	G2YM83_BOTF4	66	34
O[C@@H](CNC[C@@H]1COC2(CCCCC2)O1)c1cccnc1	ZINC000819210060	CD	On-Demand	Anodyne	ADRB3	82	42
O[C@@H](CNC[C@H]1COC2(CCCCC2)O1)c1cccnc1	ZINC000819210061	CD	On-Demand	Anodyne	ADRB3	82	42
O[C@H](CNC[C@@H]1COC2(CCCCC2)O1)c1cccnc1	ZINC000819210062	CD	On-Demand	Anodyne	ADRB3	82	42
O[C@H](CNC[C@H]1COC2(CCCCC2)O1)c1cccnc1	ZINC000819210063	CD	On-Demand	Anodyne	ADRB3	82	42
O=S1(=O)CC[C@]2(C[C@@H](NC[C@H](O)c3cccc(Cl)c3)CCO2)C1	ZINC000819210066	FD	On-Demand	Anodyne	ADRB1	26	40
O=S1(=O)CC[C@]2(C[C@@H](NC[C@H](O)c3cccc(Cl)c3)CCO2)C1	ZINC000819210066	FD	On-Demand	Anodyne	ADRB3	41	46
O=S1(=O)CC[C@]2(C[C@H](NC[C@@H](O)c3cccc(Cl)c3)CCO2)C1	ZINC000819210067	FD	On-Demand	Anodyne	ADRB1	26	40
O=S1(=O)CC[C@]2(C[C@H](NC[C@@H](O)c3cccc(Cl)c3)CCO2)C1	ZINC000819210067	FD	On-Demand	Anodyne	ADRB3	41	46
O=S1(=O)CC[C@]2(C[C@H](NC[C@H](O)c3cccc(Cl)c3)CCO2)C1	ZINC000819210068	FD	On-Demand	Anodyne	ADRB1	26	40
O=S1(=O)CC[C@]2(C[C@H](NC[C@H](O)c3cccc(Cl)c3)CCO2)C1	ZINC000819210068	FD	On-Demand	Anodyne	ADRB3	41	46
O=S1(=O)CC[C@]2(C[C@@H](NC[C@@H](O)c3cccc(Cl)c3)CCO2)C1	ZINC000819210069	FD	On-Demand	Anodyne	ADRB1	26	40
O=S1(=O)CC[C@]2(C[C@@H](NC[C@@H](O)c3cccc(Cl)c3)CCO2)C1	ZINC000819210069	FD	On-Demand	Anodyne	ADRB3	41	46
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210151	GE	On-Demand	Anodyne	ADRB2	33	53
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210151	GE	On-Demand	Anodyne	ADRB1	63	53
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210151	GE	On-Demand	Anodyne	ADRB3	40	42
COCCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210152	GE	On-Demand	Anodyne	ADRB2	33	53
COCCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210152	GE	On-Demand	Anodyne	ADRB1	63	53
COCCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210152	GE	On-Demand	Anodyne	ADRB3	40	42
COCCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210153	GE	On-Demand	Anodyne	ADRB2	33	53
COCCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210153	GE	On-Demand	Anodyne	ADRB1	63	53
COCCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210153	GE	On-Demand	Anodyne	ADRB3	40	42
COCCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210154	GE	On-Demand	Anodyne	ADRB2	33	53
COCCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210154	GE	On-Demand	Anodyne	ADRB1	63	53
COCCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210154	GE	On-Demand	Anodyne	ADRB3	40	42
C=CCCC[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819210164	CH	On-Demand	Mild	ADRB1	38	54
C=CCCC[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819210164	CH	On-Demand	Mild	ADRB3	60	54
C=CCCC[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819210165	CH	On-Demand	Mild	ADRB1	38	54
C=CCCC[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819210165	CH	On-Demand	Mild	ADRB3	60	54
C=CCCC[C@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819210166	CH	On-Demand	Mild	ADRB1	38	54
C=CCCC[C@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819210166	CH	On-Demand	Mild	ADRB3	60	54
C=CCCC[C@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819210167	CH	On-Demand	Mild	ADRB1	38	54
C=CCCC[C@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819210167	CH	On-Demand	Mild	ADRB3	60	54
O=C(CCc1cccc(OC(F)F)c1)Nc1ccccc1N1CCOC1=O	ZINC000819210233	GH	On-Demand	Anodyne	KCNQ2	42	39
O[C@@H](CN[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1cccc(F)c1	ZINC000819210242	EG	On-Demand	Anodyne	CYP3A4	41	36
O[C@H](CN[C@H]1CCN(c2ccc(Cl)cc2)C1)c1cccc(F)c1	ZINC000819210243	EG	On-Demand	Anodyne	CYP3A4	41	36
O[C@H](CN[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1cccc(F)c1	ZINC000819210244	EG	On-Demand	Anodyne	CYP3A4	41	36
O[C@@H](CN[C@H]1CCN(c2ccc(Cl)cc2)C1)c1cccc(F)c1	ZINC000819210245	EG	On-Demand	Anodyne	CYP3A4	41	36
O=C(Nc1cccc(Br)c1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819210246	GI	On-Demand	Anodyne	LIMK2	15	45
O[C@@H](CN[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1ccccc1	ZINC000819210252	DG	On-Demand	Anodyne	ADRB1	20	43
O[C@@H](CN[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1ccccc1	ZINC000819210252	DG	On-Demand	Anodyne	SLC6A3	17	44
O[C@@H](CN[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1ccccc1	ZINC000819210252	DG	On-Demand	Anodyne	ADRB3	34	43
O[C@H](CN[C@H]1CCN(c2ccc(Cl)cc2)C1)c1ccccc1	ZINC000819210253	DG	On-Demand	Anodyne	ADRB1	20	43
O[C@H](CN[C@H]1CCN(c2ccc(Cl)cc2)C1)c1ccccc1	ZINC000819210253	DG	On-Demand	Anodyne	SLC6A3	17	44
O[C@H](CN[C@H]1CCN(c2ccc(Cl)cc2)C1)c1ccccc1	ZINC000819210253	DG	On-Demand	Anodyne	ADRB3	34	43
O[C@H](CN[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1ccccc1	ZINC000819210254	DG	On-Demand	Anodyne	ADRB1	20	43
O[C@H](CN[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1ccccc1	ZINC000819210254	DG	On-Demand	Anodyne	SLC6A3	17	44
O[C@H](CN[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1ccccc1	ZINC000819210254	DG	On-Demand	Anodyne	ADRB3	34	43
O[C@@H](CN[C@H]1CCN(c2ccc(Cl)cc2)C1)c1ccccc1	ZINC000819210255	DG	On-Demand	Anodyne	ADRB1	20	43
O[C@@H](CN[C@H]1CCN(c2ccc(Cl)cc2)C1)c1ccccc1	ZINC000819210255	DG	On-Demand	Anodyne	SLC6A3	17	44
O[C@@H](CN[C@H]1CCN(c2ccc(Cl)cc2)C1)c1ccccc1	ZINC000819210255	DG	On-Demand	Anodyne	ADRB3	34	43
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000819210263	EH	On-Demand	Anodyne	ADRB3	18	43
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000819210264	EH	On-Demand	Anodyne	ADRB3	18	43
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(c3ccc(Cl)cc3)C2)cc1	ZINC000819210306	EG	On-Demand	Mild	ADRB3	18	44
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(c3ccc(Cl)cc3)C2)cc1	ZINC000819210307	EG	On-Demand	Mild	ADRB3	18	44
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(c3ccc(Cl)cc3)C2)cc1	ZINC000819210308	EG	On-Demand	Mild	ADRB3	18	44
N#Cc1ccc([C@H](O)CN[C@H]2CCN(c3ccc(Cl)cc3)C2)cc1	ZINC000819210309	EG	On-Demand	Mild	ADRB3	18	44
C[C@H](SCC(=O)Nc1ccc(F)cc1)C(=O)Nc1cccnc1Cl	ZINC000819210332	FH	On-Demand	Anodyne	G2YM83_BOTF4	65	34
C[C@@H](CCNC(=O)Cc1nsc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819210351	FG	On-Demand	Anodyne	FPR1	40	35
CCc1nnc2n1C[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819210359	GD	On-Demand	Mild	PAPA1_CARPA	33	42
CCc1nnc2n1C[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819210360	GD	On-Demand	Mild	PAPA1_CARPA	33	42
CCc1nnc2n1C[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819210361	GD	On-Demand	Mild	PAPA1_CARPA	33	42
CCc1nnc2n1C[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819210362	GD	On-Demand	Mild	PAPA1_CARPA	33	42
O[C@@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1ccc(F)cc1	ZINC000819210367	EE	On-Demand	Anodyne	ADRB1	40	40
O[C@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1ccc(F)cc1	ZINC000819210368	EE	On-Demand	Anodyne	ADRB1	40	40
O[C@@H](CNC[C@H]1COC2(CCCCC2)O1)COc1ccc(F)cc1	ZINC000819210369	EE	On-Demand	Anodyne	ADRB1	40	40
O[C@H](CNC[C@H]1COC2(CCCCC2)O1)COc1ccc(F)cc1	ZINC000819210370	EE	On-Demand	Anodyne	ADRB1	40	40
O[C@@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1ccc(Cl)cc1	ZINC000819210371	FF	On-Demand	Anodyne	ADRB1	40	40
O[C@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1ccc(Cl)cc1	ZINC000819210372	FF	On-Demand	Anodyne	ADRB1	40	40
O[C@@H](CNC[C@H]1COC2(CCCCC2)O1)COc1ccc(Cl)cc1	ZINC000819210373	FF	On-Demand	Anodyne	ADRB1	40	40
O[C@H](CNC[C@H]1COC2(CCCCC2)O1)COc1ccc(Cl)cc1	ZINC000819210374	FF	On-Demand	Anodyne	ADRB1	40	40
O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)Nc1cccnc1Cl	ZINC000819210413	HH	On-Demand	Anodyne	TGM2	55	39
O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)Nc1cccnc1Cl	ZINC000819210413	HH	On-Demand	Anodyne	HCAR2	34	43
O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)Nc1cccnc1Cl	ZINC000819210413	HH	On-Demand	Anodyne	F13A1	64	39
O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)Nc1cccnc1Cl	ZINC000819210413	HH	On-Demand	Anodyne	NAMPT	58	48
O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)Nc1cccnc1Cl	ZINC000819210413	HH	On-Demand	Anodyne	G2YM83_BOTF4	55	31
N#Cc1ccc([C@H](O)CNCCOCc2ccc(Cl)cc2Cl)cc1	ZINC000819210415	FH	On-Demand	Mild	ADRB2	17	45
N#Cc1ccc([C@H](O)CNCCOCc2ccc(Cl)cc2Cl)cc1	ZINC000819210415	FH	On-Demand	Mild	ADRB1	21	45
N#Cc1ccc([C@H](O)CNCCOCc2ccc(Cl)cc2Cl)cc1	ZINC000819210415	FH	On-Demand	Mild	ADRB3	19	45
N#Cc1ccc([C@@H](O)CNCCOCc2ccc(Cl)cc2Cl)cc1	ZINC000819210417	FH	On-Demand	Mild	ADRB2	17	45
N#Cc1ccc([C@@H](O)CNCCOCc2ccc(Cl)cc2Cl)cc1	ZINC000819210417	FH	On-Demand	Mild	ADRB1	21	45
N#Cc1ccc([C@@H](O)CNCCOCc2ccc(Cl)cc2Cl)cc1	ZINC000819210417	FH	On-Demand	Mild	ADRB3	19	45
C[C@@H](CC(=O)N(C1CC1)C1CCN(C(=O)OC(C)(C)C)CC1)n1cccn1	ZINC000819210425	GG	On-Demand	Anodyne	GPR119	41	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)Nc2ccccn2)c1	ZINC000819210468	GG	On-Demand	Anodyne	KCNK3	91	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(C(=O)Nc2ccccn2)c1	ZINC000819210468	GG	On-Demand	Anodyne	KCNK9	44	34
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(=O)N2CCOCC2)CC1	ZINC000819210496	FC	On-Demand	Anodyne	GPR119	30	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(=O)N2CCOCC2)CC1	ZINC000819210497	FC	On-Demand	Anodyne	GPR119	30	43
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000819210500	EF	On-Demand	Anodyne	GRIN2B	26	43
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000819210500	EF	On-Demand	Anodyne	HRH4	39	62
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000819210500	EF	On-Demand	Anodyne	AKR1C3	21	52
C#CCNC(=O)CCNC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1	ZINC000819210501	GB	On-Demand	Mild	PKM	39	45
CC(C)n1ncc2ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc21	ZINC000819210510	GI	On-Demand	Mild	PAPA1_CARPA	38	41
CC(C)n1ncc2ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc21	ZINC000819210511	GI	On-Demand	Mild	PAPA1_CARPA	38	41
O=S(=O)(c1ccc2c(c1)OCCO2)N1CC(NCC2(O)CCCCC2)C1	ZINC000819210522	GD	On-Demand	Anodyne	PKM	42	50
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ccccc3C#N)CC1)C2	ZINC000819210531	GE	On-Demand	Mild	SSTR1	70	49
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ccccc3C#N)CC1)C2	ZINC000819210532	GE	On-Demand	Mild	SSTR1	70	49
O=S(=O)(c1ccc2c(c1)OCCO2)N1CC(NC[C@H](O)C2CC2)C1	ZINC000819210547	FC	On-Demand	Anodyne	PKM	43	51
O=S(=O)(c1ccc2c(c1)OCCO2)N1CC(NC[C@@H](O)C2CC2)C1	ZINC000819210550	FC	On-Demand	Anodyne	PKM	43	51
O=C(Nc1cccc(F)c1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819210566	EG	On-Demand	Anodyne	EPHX2	20	44
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(Cl)ccc1C(=O)N1CCCCC1	ZINC000819210574	FH	On-Demand	Anodyne	L3MBTL3	41	35
O=C(/C=C/[C@H]1CCCO1)Nc1cc(Cl)ccc1C(=O)N1CCCCC1	ZINC000819210576	FH	On-Demand	Anodyne	L3MBTL3	41	35
O=C(/C=C\[C@H]1CCCO1)Nc1cc(Cl)ccc1C(=O)N1CCCCC1	ZINC000819210578	FH	On-Demand	Anodyne	L3MBTL3	41	35
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(Cl)ccc1C(=O)N1CCCCC1	ZINC000819210580	FH	On-Demand	Anodyne	L3MBTL3	41	35
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210581	GE	On-Demand	Anodyne	ADRB2	39	53
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210581	GE	On-Demand	Anodyne	ADRB1	75	53
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210581	GE	On-Demand	Anodyne	ADRB3	48	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210584	GE	On-Demand	Anodyne	ADRB2	39	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210584	GE	On-Demand	Anodyne	ADRB1	75	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210584	GE	On-Demand	Anodyne	ADRB3	48	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210586	GE	On-Demand	Anodyne	ADRB2	39	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210586	GE	On-Demand	Anodyne	ADRB1	75	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210586	GE	On-Demand	Anodyne	ADRB3	48	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210588	GE	On-Demand	Anodyne	ADRB2	39	53
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210588	GE	On-Demand	Anodyne	ADRB1	75	53
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210588	GE	On-Demand	Anodyne	ADRB3	48	48
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCN(c3ccc(Cl)cc3)C2)cc1	ZINC000819210614	FG	On-Demand	Bother	ADRB3	19	43
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCN(c3ccc(Cl)cc3)C2)cc1	ZINC000819210616	FG	On-Demand	Bother	ADRB3	19	43
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccc(Cl)cc3)C2)cc1	ZINC000819210618	FG	On-Demand	Bother	ADRB3	19	43
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCN(c3ccc(Cl)cc3)C2)cc1	ZINC000819210620	FG	On-Demand	Bother	ADRB3	19	43
O=C(CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)N1CCOCC1	ZINC000819210628	ED	On-Demand	Anodyne	CTSS	20	50
O=C(CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)N1CCOCC1	ZINC000819210628	ED	On-Demand	Anodyne	EPHX2	43	44
O=C(CNC[C@H](O)c1ccc(OC(F)(F)F)cc1)N1CCOCC1	ZINC000819210629	ED	On-Demand	Anodyne	CTSS	20	50
O=C(CNC[C@H](O)c1ccc(OC(F)(F)F)cc1)N1CCOCC1	ZINC000819210629	ED	On-Demand	Anodyne	EPHX2	43	44
O[C@H](CN[C@H]1CCN(c2ccc(Cl)cc2)C1)c1ccc(F)c(F)c1	ZINC000819210632	FH	On-Demand	Anodyne	ADRB3	26	43
O[C@@H](CN[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1ccc(F)c(F)c1	ZINC000819210633	FH	On-Demand	Anodyne	ADRB3	26	43
O[C@@H](CN[C@H]1CCN(c2ccc(Cl)cc2)C1)c1ccc(F)c(F)c1	ZINC000819210634	FH	On-Demand	Anodyne	ADRB3	26	43
O[C@H](CN[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1ccc(F)c(F)c1	ZINC000819210635	FH	On-Demand	Anodyne	ADRB3	26	43
O=C(CCN1CCCCC1)Nc1ccc(NC(=O)C(F)=C2CCC2)cc1	ZINC000819210637	FH	On-Demand	Anodyne	CHRNA7	23	51
O=C(CCN1CCCCC1)Nc1ccc(NC(=O)C(F)=C2CCC2)cc1	ZINC000819210637	FH	On-Demand	Anodyne	TERT	16	49
O[C@H](CN[C@@H]1CCCOCC1)c1ccc(F)cc1Cl	ZINC000819210642	CF	On-Demand	Anodyne	MAPK1	49	32
O[C@@H](CN[C@H]1CCCOCC1)c1ccc(F)cc1Cl	ZINC000819210643	CF	On-Demand	Anodyne	MAPK1	49	32
O[C@@H](CN[C@@H]1CCCOCC1)c1ccc(F)cc1Cl	ZINC000819210644	CF	On-Demand	Anodyne	MAPK1	49	32
O[C@H](CN[C@H]1CCCOCC1)c1ccc(F)cc1Cl	ZINC000819210645	CF	On-Demand	Anodyne	MAPK1	49	32
Cc1ccc(N2C(=O)C[C@@H](C(=O)Nc3cccnc3Cl)[C@H]2c2cccs2)cc1	ZINC000819210663	HJ	On-Demand	Anodyne	G2YM83_BOTF4	64	33
Cc1ccc(N2C(=O)C[C@@H](C(=O)Nc3cccnc3Cl)[C@@H]2c2cccs2)cc1	ZINC000819210666	HJ	On-Demand	Anodyne	G2YM83_BOTF4	64	33
Cc1ccc(N2C(=O)C[C@H](C(=O)Nc3cccnc3Cl)[C@@H]2c2cccs2)cc1	ZINC000819210667	HJ	On-Demand	Anodyne	G2YM83_BOTF4	64	33
Cc1ccc(N2C(=O)C[C@H](C(=O)Nc3cccnc3Cl)[C@H]2c2cccs2)cc1	ZINC000819210668	HJ	On-Demand	Anodyne	G2YM83_BOTF4	64	33
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)c1	ZINC000819210673	HF	On-Demand	Anodyne	EPHX2	38	52
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)c1	ZINC000819210673	HF	On-Demand	Anodyne	TYK2	55	41
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)c1	ZINC000819210673	HF	On-Demand	Anodyne	AKR1C3	57	40
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)c1	ZINC000819210673	HF	On-Demand	Anodyne	G2YM83_BOTF4	68	36
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210678	GF	On-Demand	Anodyne	ADRB2	38	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210678	GF	On-Demand	Anodyne	ADRB1	69	45
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210678	GF	On-Demand	Anodyne	ADRB3	46	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210679	GF	On-Demand	Anodyne	ADRB2	38	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210679	GF	On-Demand	Anodyne	ADRB1	69	45
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000819210679	GF	On-Demand	Anodyne	ADRB3	46	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210680	GF	On-Demand	Anodyne	ADRB2	38	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210680	GF	On-Demand	Anodyne	ADRB1	69	45
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210680	GF	On-Demand	Anodyne	ADRB3	46	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210681	GF	On-Demand	Anodyne	ADRB2	38	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210681	GF	On-Demand	Anodyne	ADRB1	69	45
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000819210681	GF	On-Demand	Anodyne	ADRB3	46	42
O[C@H](CNC[C@H]1COC2(CCCCC2)O1)COc1ccccc1Cl	ZINC000819210690	FF	On-Demand	Anodyne	ADRB2	18	43
O[C@H](CNC[C@H]1COC2(CCCCC2)O1)COc1ccccc1Cl	ZINC000819210690	FF	On-Demand	Anodyne	ADRA1B	15	41
O[C@@H](CNC[C@H]1COC2(CCCCC2)O1)COc1ccccc1Cl	ZINC000819210691	FF	On-Demand	Anodyne	ADRB2	18	43
O[C@@H](CNC[C@H]1COC2(CCCCC2)O1)COc1ccccc1Cl	ZINC000819210691	FF	On-Demand	Anodyne	ADRA1B	15	41
O[C@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1ccccc1Cl	ZINC000819210692	FF	On-Demand	Anodyne	ADRB2	18	43
O[C@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1ccccc1Cl	ZINC000819210692	FF	On-Demand	Anodyne	ADRA1B	15	41
O[C@@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1ccccc1Cl	ZINC000819210693	FF	On-Demand	Anodyne	ADRB2	18	43
O[C@@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1ccccc1Cl	ZINC000819210693	FF	On-Demand	Anodyne	ADRA1B	15	41
C=CCCC[C@H](C)NC[C@@H](O)c1cccnc1	ZINC000819210698	BE	On-Demand	Mild	ADRB1	28	54
C=CCCC[C@H](C)NC[C@@H](O)c1cccnc1	ZINC000819210698	BE	On-Demand	Mild	ADRB3	65	54
C=CCCC[C@H](C)NC[C@H](O)c1cccnc1	ZINC000819210699	BE	On-Demand	Mild	ADRB1	28	54
C=CCCC[C@H](C)NC[C@H](O)c1cccnc1	ZINC000819210699	BE	On-Demand	Mild	ADRB3	65	54
C=CCCC[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819210700	BE	On-Demand	Mild	ADRB1	28	54
C=CCCC[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819210700	BE	On-Demand	Mild	ADRB3	65	54
C=CCCC[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819210701	BE	On-Demand	Mild	ADRB1	28	54
C=CCCC[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819210701	BE	On-Demand	Mild	ADRB3	65	54
CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210720	FD	On-Demand	Mild	F2	42	47
CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210720	FD	On-Demand	Mild	PLG	30	45
CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210720	FD	On-Demand	Mild	PRSS1	22	47
CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210720	FD	On-Demand	Mild	CELA1	58	47
CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210720	FD	On-Demand	Mild	ELANE	46	38
CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210720	FD	On-Demand	Mild	TRHR	42	32
CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210720	FD	On-Demand	Mild	HLA-DRB3	60	37
CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210720	FD	On-Demand	Mild	CMA1	35	44
CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210720	FD	On-Demand	Mild	CTRA_BOVIN	40	31
CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210720	FD	On-Demand	Mild	PAPA1_CARPA	30	40
CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210720	FD	On-Demand	Mild	TRY1_BOVIN	70	45
CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210720	FD	On-Demand	Mild	NTSR1	82	44
CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210720	FD	On-Demand	Mild	CELA2A	40	31
CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210720	FD	On-Demand	Mild	LGMN	87	36
CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210722	FD	On-Demand	Mild	F2	42	47
CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210722	FD	On-Demand	Mild	PLG	30	45
CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210722	FD	On-Demand	Mild	PRSS1	22	47
CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210722	FD	On-Demand	Mild	CELA1	58	47
CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210722	FD	On-Demand	Mild	ELANE	46	38
CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210722	FD	On-Demand	Mild	TRHR	42	32
CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210722	FD	On-Demand	Mild	HLA-DRB3	60	37
CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210722	FD	On-Demand	Mild	CMA1	35	44
CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210722	FD	On-Demand	Mild	CTRA_BOVIN	40	31
CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210722	FD	On-Demand	Mild	PAPA1_CARPA	30	40
CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210722	FD	On-Demand	Mild	TRY1_BOVIN	70	45
CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210722	FD	On-Demand	Mild	NTSR1	82	44
CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210722	FD	On-Demand	Mild	CELA2A	40	31
CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819210722	FD	On-Demand	Mild	LGMN	87	36
CON(C)C(=O)CCNC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1	ZINC000819210732	GB	On-Demand	Anodyne	PKM	41	47
O=S(=O)(c1ccc2c(c1)OCCO2)N1CC(NC[C@H](O)c2ccccc2)C1	ZINC000819210734	GD	On-Demand	Anodyne	ADRB3	19	48
O=S(=O)(c1ccc2c(c1)OCCO2)N1CC(NC[C@H](O)c2ccccc2)C1	ZINC000819210734	GD	On-Demand	Anodyne	PKM	43	53
O=S(=O)(c1ccc2c(c1)OCCO2)N1CC(NC[C@@H](O)c2ccccc2)C1	ZINC000819210735	GD	On-Demand	Anodyne	ADRB3	19	48
O=S(=O)(c1ccc2c(c1)OCCO2)N1CC(NC[C@@H](O)c2ccccc2)C1	ZINC000819210735	GD	On-Demand	Anodyne	PKM	43	53
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccc(Cl)cc3)C2)cc1	ZINC000819210757	GF	On-Demand	Anodyne	ADRB3	30	48
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccc(Cl)cc3)C2)cc1	ZINC000819210757	GF	On-Demand	Anodyne	GPR119	16	44
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3ccc(Cl)cc3)C2)cc1	ZINC000819210758	GF	On-Demand	Anodyne	ADRB3	30	48
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3ccc(Cl)cc3)C2)cc1	ZINC000819210758	GF	On-Demand	Anodyne	GPR119	16	44
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3ccc(Cl)cc3)C2)cc1	ZINC000819210759	GF	On-Demand	Anodyne	ADRB3	30	48
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3ccc(Cl)cc3)C2)cc1	ZINC000819210759	GF	On-Demand	Anodyne	GPR119	16	44
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3ccc(Cl)cc3)C2)cc1	ZINC000819210760	GF	On-Demand	Anodyne	ADRB3	30	48
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3ccc(Cl)cc3)C2)cc1	ZINC000819210760	GF	On-Demand	Anodyne	GPR119	16	44
O=C(NCCCNC(=O)c1cccc(Br)c1)C(F)=C1CCC1	ZINC000819210774	FG	On-Demand	Anodyne	DRD4	41	31
O=S(=O)(c1ccc2c(c1)OCCO2)N1CC(NC[C@H](O)c2cccnc2)C1	ZINC000819210796	GC	On-Demand	Anodyne	ADRB2	17	42
O=S(=O)(c1ccc2c(c1)OCCO2)N1CC(NC[C@H](O)c2cccnc2)C1	ZINC000819210796	GC	On-Demand	Anodyne	ADRB3	80	42
O=S(=O)(c1ccc2c(c1)OCCO2)N1CC(NC[C@H](O)c2cccnc2)C1	ZINC000819210796	GC	On-Demand	Anodyne	PKM	39	44
O=S(=O)(c1ccc2c(c1)OCCO2)N1CC(NC[C@@H](O)c2cccnc2)C1	ZINC000819210797	GC	On-Demand	Anodyne	ADRB2	17	42
O=S(=O)(c1ccc2c(c1)OCCO2)N1CC(NC[C@@H](O)c2cccnc2)C1	ZINC000819210797	GC	On-Demand	Anodyne	ADRB3	80	42
O=S(=O)(c1ccc2c(c1)OCCO2)N1CC(NC[C@@H](O)c2cccnc2)C1	ZINC000819210797	GC	On-Demand	Anodyne	PKM	39	44
O=[N+]([O-])c1ccc([C@@H](O)CNCCOCc2ccc(Cl)cc2Cl)cc1	ZINC000819210813	GH	On-Demand	Bother	ADRB2	18	43
O=[N+]([O-])c1ccc([C@@H](O)CNCCOCc2ccc(Cl)cc2Cl)cc1	ZINC000819210813	GH	On-Demand	Bother	ADRB1	25	43
O=[N+]([O-])c1ccc([C@@H](O)CNCCOCc2ccc(Cl)cc2Cl)cc1	ZINC000819210813	GH	On-Demand	Bother	ADRB3	24	43
O=[N+]([O-])c1ccc([C@H](O)CNCCOCc2ccc(Cl)cc2Cl)cc1	ZINC000819210814	GH	On-Demand	Bother	ADRB2	18	43
O=[N+]([O-])c1ccc([C@H](O)CNCCOCc2ccc(Cl)cc2Cl)cc1	ZINC000819210814	GH	On-Demand	Bother	ADRB1	25	43
O=[N+]([O-])c1ccc([C@H](O)CNCCOCc2ccc(Cl)cc2Cl)cc1	ZINC000819210814	GH	On-Demand	Bother	ADRB3	24	43
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCN(c3ccc(Cl)cc3)C2)c1	ZINC000819210815	FG	On-Demand	Bother	ADRB3	28	41
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCN(c3ccc(Cl)cc3)C2)c1	ZINC000819210815	FG	On-Demand	Bother	CYP3A4	41	36
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCN(c3ccc(Cl)cc3)C2)c1	ZINC000819210816	FG	On-Demand	Bother	ADRB3	28	41
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCN(c3ccc(Cl)cc3)C2)c1	ZINC000819210816	FG	On-Demand	Bother	CYP3A4	41	36
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCN(c3ccc(Cl)cc3)C2)c1	ZINC000819210817	FG	On-Demand	Bother	ADRB3	28	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCN(c3ccc(Cl)cc3)C2)c1	ZINC000819210817	FG	On-Demand	Bother	CYP3A4	41	36
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCN(c3ccc(Cl)cc3)C2)c1	ZINC000819210818	FG	On-Demand	Bother	ADRB3	28	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCN(c3ccc(Cl)cc3)C2)c1	ZINC000819210818	FG	On-Demand	Bother	CYP3A4	41	36
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)c1	ZINC000819210870	FE	On-Demand	Anodyne	ADRB2	20	44
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCC3)O2)c1	ZINC000819210870	FE	On-Demand	Anodyne	ABCB1	15	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)c1	ZINC000819210871	FE	On-Demand	Anodyne	ADRB2	20	44
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCC3)O2)c1	ZINC000819210871	FE	On-Demand	Anodyne	ABCB1	15	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)c1	ZINC000819210872	FE	On-Demand	Anodyne	ADRB2	20	44
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2COC3(CCCCC3)O2)c1	ZINC000819210872	FE	On-Demand	Anodyne	ABCB1	15	45
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)c1	ZINC000819210873	FE	On-Demand	Anodyne	ADRB2	20	44
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCC3)O2)c1	ZINC000819210873	FE	On-Demand	Anodyne	ABCB1	15	45
O[C@H](CNC[C@H]1COC2(CCCCC2)O1)COc1ccccc1F	ZINC000819210876	EE	On-Demand	Anodyne	ADRA1B	15	41
O[C@@H](CNC[C@H]1COC2(CCCCC2)O1)COc1ccccc1F	ZINC000819210877	EE	On-Demand	Anodyne	ADRA1B	15	41
O[C@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1ccccc1F	ZINC000819210878	EE	On-Demand	Anodyne	ADRA1B	15	41
O[C@@H](CNC[C@@H]1COC2(CCCCC2)O1)COc1ccccc1F	ZINC000819210879	EE	On-Demand	Anodyne	ADRA1B	15	41
CCOc1cc2c(cc1/C=C\C(=O)Nc1cccnc1Cl)O[C@@H](C)C2	ZINC000819210896	FI	On-Demand	Anodyne	G2YM83_BOTF4	62	38
CCOc1cc2c(cc1/C=C/C(=O)Nc1cccnc1Cl)O[C@H](C)C2	ZINC000819210897	FI	On-Demand	Anodyne	G2YM83_BOTF4	62	38
CCOc1cc2c(cc1/C=C/C(=O)Nc1cccnc1Cl)O[C@@H](C)C2	ZINC000819210898	FI	On-Demand	Anodyne	G2YM83_BOTF4	62	38
CCOc1cc2c(cc1/C=C\C(=O)Nc1cccnc1Cl)O[C@H](C)C2	ZINC000819210899	FI	On-Demand	Anodyne	G2YM83_BOTF4	62	38
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)cc1	ZINC000819210900	HF	On-Demand	Anodyne	EPHX2	38	59
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)cc1	ZINC000819210900	HF	On-Demand	Anodyne	TGM2	55	38
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)cc1	ZINC000819210900	HF	On-Demand	Anodyne	F13A1	45	38
CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)cc1	ZINC000819210900	HF	On-Demand	Anodyne	G2YM83_BOTF4	67	36
C=CCCn1cc(C(=O)N(C2CC2)C2CCN(C(=O)OC(C)(C)C)CC2)nn1	ZINC000819210917	GF	On-Demand	Mild	GPR119	33	40
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)(c3ccccc3)CC2)c1	ZINC000819210936	JI	On-Demand	Anodyne	AKR1C3	59	39
CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)(c3ccccc3)CC2)c1	ZINC000819210936	JI	On-Demand	Anodyne	G2YM83_BOTF4	58	34
COC(=O)c1cccc(Cc2cnc(NC(=O)/C=C/[C@@H]3CCCO3)s2)c1	ZINC000819210964	FG	On-Demand	Anodyne	SCD1	38	41
COC(=O)c1cccc(Cc2cnc(NC(=O)/C=C/[C@@H]3CCCO3)s2)c1	ZINC000819210964	FG	On-Demand	Anodyne	SCD	35	48
COC(=O)c1cccc(Cc2cnc(NC(=O)/C=C\[C@@H]3CCCO3)s2)c1	ZINC000819210965	FG	On-Demand	Anodyne	SCD1	38	41
COC(=O)c1cccc(Cc2cnc(NC(=O)/C=C\[C@@H]3CCCO3)s2)c1	ZINC000819210965	FG	On-Demand	Anodyne	SCD	35	48
COC(=O)c1cccc(Cc2cnc(NC(=O)/C=C/[C@H]3CCCO3)s2)c1	ZINC000819210966	FG	On-Demand	Anodyne	SCD1	38	41
COC(=O)c1cccc(Cc2cnc(NC(=O)/C=C/[C@H]3CCCO3)s2)c1	ZINC000819210966	FG	On-Demand	Anodyne	SCD	35	48
COC(=O)c1cccc(Cc2cnc(NC(=O)/C=C\[C@H]3CCCO3)s2)c1	ZINC000819210967	FG	On-Demand	Anodyne	SCD1	38	41
COC(=O)c1cccc(Cc2cnc(NC(=O)/C=C\[C@H]3CCCO3)s2)c1	ZINC000819210967	FG	On-Demand	Anodyne	SCD	35	48
CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819210989	DC	On-Demand	Anodyne	CELA1	30	41
CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819210989	DC	On-Demand	Anodyne	PREP	23	42
CC(C)(C)OC(=O)N1CCC(N(C(=O)C(F)=C2CCC2)C2CC2)CC1	ZINC000819211003	FH	On-Demand	Anodyne	GPR119	37	43
O[C@@H](CNCCOCc1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819211025	EG	On-Demand	Anodyne	ADRB2	31	52
O[C@@H](CNCCOCc1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819211025	EG	On-Demand	Anodyne	ADRB1	48	52
O[C@@H](CNCCOCc1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819211025	EG	On-Demand	Anodyne	ADRB3	115	52
O[C@H](CNCCOCc1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819211026	EG	On-Demand	Anodyne	ADRB2	31	52
O[C@H](CNCCOCc1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819211026	EG	On-Demand	Anodyne	ADRB1	48	52
O[C@H](CNCCOCc1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819211026	EG	On-Demand	Anodyne	ADRB3	115	52
O=C(Nc1ccc(Cl)cc1C(=O)N1CCCC1)C(F)=C1CCC1	ZINC000819211027	EH	On-Demand	Anodyne	F10	15	40
CN(C)c1ccc(NC(=O)CCNCC(=O)N2CCOCC2)cc1	ZINC000819211028	EC	On-Demand	Anodyne	EPHX2	17	42
CC(=O)Nc1cccc(CC(=O)N2CCCN(C(=O)OCC(C)C)CC2)c1	ZINC000819211034	GF	On-Demand	Anodyne	TGM2	29	40
CC(=O)Nc1cccc(CC(=O)N2CCCN(C(=O)OCC(C)C)CC2)c1	ZINC000819211034	GF	On-Demand	Anodyne	F13A1	46	40
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(NC(=O)CCN2CCCCC2)cc1	ZINC000819211075	FG	On-Demand	Anodyne	CHRNA7	21	47
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(NC(=O)CCN2CCCCC2)cc1	ZINC000819211075	FG	On-Demand	Anodyne	TERT	16	44
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(NC(=O)CCN2CCCCC2)cc1	ZINC000819211076	FG	On-Demand	Anodyne	CHRNA7	21	47
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(NC(=O)CCN2CCCCC2)cc1	ZINC000819211076	FG	On-Demand	Anodyne	TERT	16	44
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(NC(=O)CCN2CCCCC2)cc1	ZINC000819211077	FG	On-Demand	Anodyne	CHRNA7	21	47
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(NC(=O)CCN2CCCCC2)cc1	ZINC000819211077	FG	On-Demand	Anodyne	TERT	16	44
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(NC(=O)CCN2CCCCC2)cc1	ZINC000819211078	FG	On-Demand	Anodyne	CHRNA7	21	47
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(NC(=O)CCN2CCCCC2)cc1	ZINC000819211078	FG	On-Demand	Anodyne	TERT	16	44
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000819211096	FE	On-Demand	Anodyne	GRIN2B	31	44
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000819211096	FE	On-Demand	Anodyne	HRH4	33	56
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000819211096	FE	On-Demand	Anodyne	AKR1C3	21	53
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000819211097	FE	On-Demand	Anodyne	GRIN2B	31	44
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000819211097	FE	On-Demand	Anodyne	HRH4	33	56
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000819211097	FE	On-Demand	Anodyne	AKR1C3	21	53
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000819211098	FE	On-Demand	Anodyne	GRIN2B	31	44
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000819211098	FE	On-Demand	Anodyne	HRH4	33	56
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000819211098	FE	On-Demand	Anodyne	AKR1C3	21	53
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000819211099	FE	On-Demand	Anodyne	GRIN2B	31	44
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000819211099	FE	On-Demand	Anodyne	HRH4	33	56
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2cc3ccccc3[nH]2)CC1	ZINC000819211099	FE	On-Demand	Anodyne	AKR1C3	21	53
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOCC1	ZINC000819211108	GF	On-Demand	Anodyne	CTSD	131	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOCC1	ZINC000819211108	GF	On-Demand	Anodyne	PGC	81	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOCC1	ZINC000819211108	GF	On-Demand	Anodyne	CMA1	29	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOCC1	ZINC000819211108	GF	On-Demand	Anodyne	CTRA_BOVIN	15	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOCC1	ZINC000819211108	GF	On-Demand	Anodyne	PAPA1_CARPA	29	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOCC1	ZINC000819211108	GF	On-Demand	Anodyne	CTSL	15	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOCC1	ZINC000819211108	GF	On-Demand	Anodyne	BACE2	51	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOCC1	ZINC000819211108	GF	On-Demand	Anodyne	REN	118	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOCC1	ZINC000819211108	GF	On-Demand	Anodyne	REN1	31	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOCC1	ZINC000819211108	GF	On-Demand	Anodyne	CTSE	49	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOCC1	ZINC000819211108	GF	On-Demand	Anodyne	BACE1	91	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOCC1	ZINC000819211108	GF	On-Demand	Anodyne	PGA5	41	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOCC1	ZINC000819211108	GF	On-Demand	Anodyne	FPR1	50	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCOCC1	ZINC000819211108	GF	On-Demand	Anodyne	PLM1_PLAFA	34	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOCC1	ZINC000819211109	GF	On-Demand	Anodyne	CTSD	131	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOCC1	ZINC000819211109	GF	On-Demand	Anodyne	PGC	81	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOCC1	ZINC000819211109	GF	On-Demand	Anodyne	CMA1	29	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOCC1	ZINC000819211109	GF	On-Demand	Anodyne	CTRA_BOVIN	15	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOCC1	ZINC000819211109	GF	On-Demand	Anodyne	PAPA1_CARPA	29	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOCC1	ZINC000819211109	GF	On-Demand	Anodyne	CTSL	15	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOCC1	ZINC000819211109	GF	On-Demand	Anodyne	BACE2	51	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOCC1	ZINC000819211109	GF	On-Demand	Anodyne	REN	118	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOCC1	ZINC000819211109	GF	On-Demand	Anodyne	REN1	31	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOCC1	ZINC000819211109	GF	On-Demand	Anodyne	CTSE	49	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOCC1	ZINC000819211109	GF	On-Demand	Anodyne	BACE1	91	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOCC1	ZINC000819211109	GF	On-Demand	Anodyne	PGA5	41	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOCC1	ZINC000819211109	GF	On-Demand	Anodyne	FPR1	50	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCOCC1	ZINC000819211109	GF	On-Demand	Anodyne	PLM1_PLAFA	34	41
C[C@@H]1CN(CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCO1	ZINC000819211114	FD	On-Demand	Mild	PAPA1_CARPA	36	47
C[C@@H]1CN(CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCO1	ZINC000819211116	FD	On-Demand	Mild	PAPA1_CARPA	36	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC(=O)Nc1cccc3cccnc13)C2	ZINC000819211138	GE	On-Demand	Anodyne	WNT3	17	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC(=O)Nc1cccc3cccnc13)C2	ZINC000819211139	GE	On-Demand	Anodyne	WNT3	17	41
O=C(CNC[C@@H](O)c1ccccc1C(F)(F)F)N1CCOCC1	ZINC000819211140	ED	On-Demand	Anodyne	ITGAL	55	31
O=C(CNC[C@@H](O)c1ccccc1C(F)(F)F)N1CCOCC1	ZINC000819211140	ED	On-Demand	Anodyne	RBP4	54	33
O=C(CNC[C@H](O)c1ccccc1C(F)(F)F)N1CCOCC1	ZINC000819211141	ED	On-Demand	Anodyne	ITGAL	55	31
O=C(CNC[C@H](O)c1ccccc1C(F)(F)F)N1CCOCC1	ZINC000819211141	ED	On-Demand	Anodyne	RBP4	54	33
O[C@H](CN[C@@H]1CCCOCC1)c1ccc(F)c(Br)c1	ZINC000819211142	EF	On-Demand	Anodyne	MAPK1	41	34
O[C@@H](CN[C@H]1CCCOCC1)c1ccc(F)c(Br)c1	ZINC000819211143	EF	On-Demand	Anodyne	MAPK1	41	34
O[C@@H](CN[C@@H]1CCCOCC1)c1ccc(F)c(Br)c1	ZINC000819211144	EF	On-Demand	Anodyne	MAPK1	41	34
O[C@H](CN[C@H]1CCCOCC1)c1ccc(F)c(Br)c1	ZINC000819211145	EF	On-Demand	Anodyne	MAPK1	41	34
O=C(Nc1cccc(F)c1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819211147	EF	On-Demand	Anodyne	ITGAL	40	31
O=C(Nc1cccc(F)c1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819211147	EF	On-Demand	Anodyne	EPHX2	18	42
O=C(Nc1cccc(F)c1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819211148	EF	On-Demand	Anodyne	ITGAL	40	31
O=C(Nc1cccc(F)c1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819211148	EF	On-Demand	Anodyne	EPHX2	18	42
O=C(Nc1cccc(F)c1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819211149	EF	On-Demand	Anodyne	ITGAL	40	31
O=C(Nc1cccc(F)c1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819211149	EF	On-Demand	Anodyne	EPHX2	18	42
O=C(Nc1cccc(F)c1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819211150	EF	On-Demand	Anodyne	ITGAL	40	31
O=C(Nc1cccc(F)c1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819211150	EF	On-Demand	Anodyne	EPHX2	18	42
C[C@@H]1CCCC[C@H]1C(=O)N(C1CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819211162	FI	On-Demand	Anodyne	GPR119	35	40
C[C@@H]1CCCC[C@@H]1C(=O)N(C1CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819211164	FI	On-Demand	Anodyne	GPR119	35	40
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCOCC1	ZINC000819211183	CC	On-Demand	Anodyne	ADRB1	36	48
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCOCC1	ZINC000819211183	CC	On-Demand	Anodyne	ADRB3	54	48
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCOCC1	ZINC000819211183	CC	On-Demand	Anodyne	IGF1R	28	41
O=C(CNC[C@@H](O)c1cccc(Cl)c1)N1CCOCC1	ZINC000819211183	CC	On-Demand	Anodyne	CYP3A4	49	38
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCOCC1	ZINC000819211184	CC	On-Demand	Anodyne	ADRB1	36	48
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCOCC1	ZINC000819211184	CC	On-Demand	Anodyne	ADRB3	54	48
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCOCC1	ZINC000819211184	CC	On-Demand	Anodyne	IGF1R	28	41
O=C(CNC[C@H](O)c1cccc(Cl)c1)N1CCOCC1	ZINC000819211184	CC	On-Demand	Anodyne	CYP3A4	49	38
O=C(Cc1csc(-c2ccc(Cl)cc2)n1)Nc1cccnc1Cl	ZINC000819211223	FJ	On-Demand	Anodyne	SUCNR1	33	42
O=C(Cc1csc(-c2ccc(Cl)cc2)n1)Nc1cccnc1Cl	ZINC000819211223	FJ	On-Demand	Anodyne	G2YM83_BOTF4	65	32
O[C@H](CN[C@H]1CCN(c2ccc(Cl)cc2)C1)c1ccccc1F	ZINC000819211236	EG	On-Demand	Anodyne	ADRB3	17	44
O[C@@H](CN[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1ccccc1F	ZINC000819211237	EG	On-Demand	Anodyne	ADRB3	17	44
O[C@@H](CN[C@H]1CCN(c2ccc(Cl)cc2)C1)c1ccccc1F	ZINC000819211238	EG	On-Demand	Anodyne	ADRB3	17	44
O[C@H](CN[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1ccccc1F	ZINC000819211239	EG	On-Demand	Anodyne	ADRB3	17	44
O[C@@H](CN[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1ccc(F)cc1	ZINC000819211255	EG	On-Demand	Anodyne	ADRB3	23	44
O[C@H](CN[C@H]1CCN(c2ccc(Cl)cc2)C1)c1ccc(F)cc1	ZINC000819211256	EG	On-Demand	Anodyne	ADRB3	23	44
O[C@H](CN[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1ccc(F)cc1	ZINC000819211257	EG	On-Demand	Anodyne	ADRB3	23	44
O[C@@H](CN[C@H]1CCN(c2ccc(Cl)cc2)C1)c1ccc(F)cc1	ZINC000819211258	EG	On-Demand	Anodyne	ADRB3	23	44
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCc2ccc(Cl)cc2Cl)c1	ZINC000819211265	GH	On-Demand	Bother	ADRB2	28	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCc2ccc(Cl)cc2Cl)c1	ZINC000819211265	GH	On-Demand	Bother	ADRB1	40	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCc2ccc(Cl)cc2Cl)c1	ZINC000819211265	GH	On-Demand	Bother	ADRB3	46	42
O=[N+]([O-])c1cccc([C@H](O)CNCCOCc2ccc(Cl)cc2Cl)c1	ZINC000819211266	GH	On-Demand	Bother	ADRB2	28	42
O=[N+]([O-])c1cccc([C@H](O)CNCCOCc2ccc(Cl)cc2Cl)c1	ZINC000819211266	GH	On-Demand	Bother	ADRB1	40	42
O=[N+]([O-])c1cccc([C@H](O)CNCCOCc2ccc(Cl)cc2Cl)c1	ZINC000819211266	GH	On-Demand	Bother	ADRB3	46	42
O=C(CNC[C@H](O)c1cccc2ccccc12)N1CCOCC1	ZINC000819211267	DD	On-Demand	Anodyne	ADCY5	17	41
O=C(CNC[C@H](O)c1cccc2ccccc12)N1CCOCC1	ZINC000819211267	DD	On-Demand	Anodyne	PTGDS	37	41
O[C@H](CN[C@H]1CCN(c2ccc(Cl)cc2)C1)c1cccnc1	ZINC000819211324	DF	On-Demand	Anodyne	ADRB3	70	59
O[C@H](CN[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1cccnc1	ZINC000819211325	DF	On-Demand	Anodyne	ADRB3	70	59
O[C@@H](CN[C@H]1CCN(c2ccc(Cl)cc2)C1)c1cccnc1	ZINC000819211326	DF	On-Demand	Anodyne	ADRB3	70	59
O[C@@H](CN[C@@H]1CCN(c2ccc(Cl)cc2)C1)c1cccnc1	ZINC000819211327	DF	On-Demand	Anodyne	ADRB3	70	59
Cc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819211375	EF	On-Demand	Anodyne	ADRB2	20	43
Cc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819211376	EF	On-Demand	Anodyne	ADRB2	20	43
Cc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819211377	EF	On-Demand	Anodyne	ADRB2	20	43
Cc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819211378	EF	On-Demand	Anodyne	ADRB2	20	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819211383	GE	On-Demand	Anodyne	ADRB2	25	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819211383	GE	On-Demand	Anodyne	ADRB1	51	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819211383	GE	On-Demand	Anodyne	ADRB3	30	41
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819211384	GE	On-Demand	Anodyne	ADRB2	25	41
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819211384	GE	On-Demand	Anodyne	ADRB1	51	41
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819211384	GE	On-Demand	Anodyne	ADRB3	30	41
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819211385	GE	On-Demand	Anodyne	ADRB2	25	41
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819211385	GE	On-Demand	Anodyne	ADRB1	51	41
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819211385	GE	On-Demand	Anodyne	ADRB3	30	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819211386	GE	On-Demand	Anodyne	ADRB2	25	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819211386	GE	On-Demand	Anodyne	ADRB1	51	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819211386	GE	On-Demand	Anodyne	ADRB3	30	41
O[C@H](CNC[C@H]1COC2(CCOCC2)O1)COc1cccc2[nH]ccc12	ZINC000819211417	FD	On-Demand	Anodyne	ADRB1	15	52
O[C@@H](CNC[C@H]1COC2(CCOCC2)O1)COc1cccc2[nH]ccc12	ZINC000819211418	FD	On-Demand	Anodyne	ADRB1	15	52
O[C@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1cccc2[nH]ccc12	ZINC000819211419	FD	On-Demand	Anodyne	ADRB1	15	52
O[C@@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1cccc2[nH]ccc12	ZINC000819211420	FD	On-Demand	Anodyne	ADRB1	15	52
COc1ccccc1COC[C@@H](O)CNC[C@@H]1COC2(CCC(C)CC2)O1	ZINC000819211421	GE	On-Demand	Anodyne	ADRA1D	21	43
COc1ccccc1COC[C@@H](O)CNC[C@@H]1COC2(CCC(C)CC2)O1	ZINC000819211421	GE	On-Demand	Anodyne	ADRA1A	15	43
COc1ccccc1COC[C@@H](O)CNC[C@@H]1COC2(CCC(C)CC2)O1	ZINC000819211421	GE	On-Demand	Anodyne	ADRA1B	21	43
COc1ccccc1COC[C@H](O)CNC[C@@H]1COC2(CCC(C)CC2)O1	ZINC000819211422	GE	On-Demand	Anodyne	ADRA1D	21	43
COc1ccccc1COC[C@H](O)CNC[C@@H]1COC2(CCC(C)CC2)O1	ZINC000819211422	GE	On-Demand	Anodyne	ADRA1A	15	43
COc1ccccc1COC[C@H](O)CNC[C@@H]1COC2(CCC(C)CC2)O1	ZINC000819211422	GE	On-Demand	Anodyne	ADRA1B	21	43
COc1ccccc1COC[C@@H](O)CNC[C@H]1COC2(CCC(C)CC2)O1	ZINC000819211423	GE	On-Demand	Anodyne	ADRA1D	21	43
COc1ccccc1COC[C@@H](O)CNC[C@H]1COC2(CCC(C)CC2)O1	ZINC000819211423	GE	On-Demand	Anodyne	ADRA1A	15	43
COc1ccccc1COC[C@@H](O)CNC[C@H]1COC2(CCC(C)CC2)O1	ZINC000819211423	GE	On-Demand	Anodyne	ADRA1B	21	43
COc1ccccc1COC[C@H](O)CNC[C@H]1COC2(CCC(C)CC2)O1	ZINC000819211424	GE	On-Demand	Anodyne	ADRA1D	21	43
COc1ccccc1COC[C@H](O)CNC[C@H]1COC2(CCC(C)CC2)O1	ZINC000819211424	GE	On-Demand	Anodyne	ADRA1A	15	43
COc1ccccc1COC[C@H](O)CNC[C@H]1COC2(CCC(C)CC2)O1	ZINC000819211424	GE	On-Demand	Anodyne	ADRA1B	21	43
O[C@H](CNC[C@H]1COC2(CCOCC2)O1)COc1cccc2ccccc12	ZINC000819211425	FE	On-Demand	Anodyne	ADRB2	16	50
O[C@H](CNC[C@H]1COC2(CCOCC2)O1)COc1cccc2ccccc12	ZINC000819211425	FE	On-Demand	Anodyne	ADRB1	18	46
O[C@H](CNC[C@H]1COC2(CCOCC2)O1)COc1cccc2ccccc12	ZINC000819211425	FE	On-Demand	Anodyne	ADRA1D	15	41
O[C@H](CNC[C@H]1COC2(CCOCC2)O1)COc1cccc2ccccc12	ZINC000819211425	FE	On-Demand	Anodyne	ADRA1B	16	41
O[C@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1cccc2ccccc12	ZINC000819211426	FE	On-Demand	Anodyne	ADRB2	16	50
O[C@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1cccc2ccccc12	ZINC000819211426	FE	On-Demand	Anodyne	ADRB1	18	46
O[C@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1cccc2ccccc12	ZINC000819211426	FE	On-Demand	Anodyne	ADRA1D	15	41
O[C@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1cccc2ccccc12	ZINC000819211426	FE	On-Demand	Anodyne	ADRA1B	16	41
O[C@@H](CNC[C@H]1COC2(CCOCC2)O1)COc1cccc2ccccc12	ZINC000819211427	FE	On-Demand	Anodyne	ADRB2	16	50
O[C@@H](CNC[C@H]1COC2(CCOCC2)O1)COc1cccc2ccccc12	ZINC000819211427	FE	On-Demand	Anodyne	ADRB1	18	46
O[C@@H](CNC[C@H]1COC2(CCOCC2)O1)COc1cccc2ccccc12	ZINC000819211427	FE	On-Demand	Anodyne	ADRA1D	15	41
O[C@@H](CNC[C@H]1COC2(CCOCC2)O1)COc1cccc2ccccc12	ZINC000819211427	FE	On-Demand	Anodyne	ADRA1B	16	41
O[C@@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1cccc2ccccc12	ZINC000819211428	FE	On-Demand	Anodyne	ADRB2	16	50
O[C@@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1cccc2ccccc12	ZINC000819211428	FE	On-Demand	Anodyne	ADRB1	18	46
O[C@@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1cccc2ccccc12	ZINC000819211428	FE	On-Demand	Anodyne	ADRA1D	15	41
O[C@@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1cccc2ccccc12	ZINC000819211428	FE	On-Demand	Anodyne	ADRA1B	16	41
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccccc1Cl	ZINC000819211430	FH	On-Demand	Bother	ADRB1	30	40
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccccc1Cl	ZINC000819211430	FH	On-Demand	Bother	ADRB3	24	42
C=CCC1(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)CCOCC1	ZINC000819211431	FG	On-Demand	Mild	CACNA1I	40	33
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1c(F)cccc1F	ZINC000819211432	FG	On-Demand	Bother	ADRB1	23	41
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1c(F)cccc1F	ZINC000819211432	FG	On-Demand	Bother	ADRB3	23	41
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1c(F)cccc1F	ZINC000819211433	FG	On-Demand	Bother	ADRB1	23	41
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1c(F)cccc1F	ZINC000819211433	FG	On-Demand	Bother	ADRB3	23	41
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000819211438	GF	On-Demand	Bother	ADRB2	34	53
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000819211438	GF	On-Demand	Bother	ADRB1	68	53
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000819211438	GF	On-Demand	Bother	ADRB3	52	53
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000819211438	GF	On-Demand	Bother	PDS	23	41
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000819211439	GF	On-Demand	Bother	ADRB2	34	53
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000819211439	GF	On-Demand	Bother	ADRB1	68	53
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000819211439	GF	On-Demand	Bother	ADRB3	52	53
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000819211439	GF	On-Demand	Bother	PDS	23	41
N#Cc1ccc(N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c(F)c1	ZINC000819211466	EE	On-Demand	Mild	SLC6A9	27	49
N#Cc1ccc(N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c(F)c1	ZINC000819211467	EE	On-Demand	Mild	SLC6A9	27	49
N#Cc1ccc(N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c(F)c1	ZINC000819211468	EE	On-Demand	Mild	SLC6A9	27	49
N#Cc1ccc(N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c(F)c1	ZINC000819211469	EE	On-Demand	Mild	SLC6A9	27	49
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)cc1	ZINC000819211470	GH	On-Demand	Mild	ADRB3	17	44
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)cc1	ZINC000819211471	GH	On-Demand	Mild	ADRB3	17	44
N#Cc1ccc([C@H](O)CN[C@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)cc1	ZINC000819211472	GH	On-Demand	Mild	ADRB3	17	44
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)cc1	ZINC000819211473	GH	On-Demand	Mild	ADRB3	17	44
O=C(C(F)=C1CCC1)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000819211474	FH	On-Demand	Anodyne	GRM5	25	60
O=C(C(F)=C1CCC1)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000819211474	FH	On-Demand	Anodyne	ETHR	59	54
O=C(C(F)=C1CCC1)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000819211475	FH	On-Demand	Anodyne	GRM5	25	60
O=C(C(F)=C1CCC1)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000819211475	FH	On-Demand	Anodyne	ETHR	59	54
O[C@H](CN[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1cccnc1	ZINC000819211476	EF	On-Demand	Anodyne	ADRB3	59	52
O[C@@H](CN[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1cccnc1	ZINC000819211477	EF	On-Demand	Anodyne	ADRB3	59	52
O[C@@H](CN[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1cccnc1	ZINC000819211478	EF	On-Demand	Anodyne	ADRB3	59	52
O[C@H](CN[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1cccnc1	ZINC000819211479	EF	On-Demand	Anodyne	ADRB3	59	52
O[C@@H](CNCc1ccccc1N1CCCCC1)c1ccc(F)cn1	ZINC000819211480	EG	On-Demand	Anodyne	KCNQ2	58	38
O[C@H](CNCc1ccccc1N1CCCCC1)c1ccc(F)cn1	ZINC000819211481	EG	On-Demand	Anodyne	KCNQ2	58	38
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](C)O	ZINC000819211483	BD	On-Demand	Anodyne	CTSK	15	41
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819211516	GG	On-Demand	Anodyne	HTR4	47	41
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819211516	GG	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819211516	GG	On-Demand	Anodyne	CACNA1I	54	33
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819211516	GG	On-Demand	Anodyne	CCR8	49	35
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819211517	GG	On-Demand	Anodyne	HTR4	47	41
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819211517	GG	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819211517	GG	On-Demand	Anodyne	CACNA1I	54	33
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819211517	GG	On-Demand	Anodyne	CCR8	49	35
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819211518	GI	On-Demand	Bother	ADRB1	29	45
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819211518	GI	On-Demand	Bother	ADRB3	48	45
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819211519	GI	On-Demand	Bother	ADRB1	29	45
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819211519	GI	On-Demand	Bother	ADRB3	48	45
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccc(F)cc1	ZINC000819211520	EG	On-Demand	Bother	ADRB2	21	42
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccc(F)cc1	ZINC000819211520	EG	On-Demand	Bother	ADRB1	27	41
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccc(F)cc1	ZINC000819211520	EG	On-Demand	Bother	ADRB3	41	42
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccc(F)cc1	ZINC000819211521	EG	On-Demand	Bother	ADRB2	21	42
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccc(F)cc1	ZINC000819211521	EG	On-Demand	Bother	ADRB1	27	41
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccc(F)cc1	ZINC000819211521	EG	On-Demand	Bother	ADRB3	41	42
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819211522	GF	On-Demand	Bother	ADRB2	43	45
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819211522	GF	On-Demand	Bother	ADRB1	77	45
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819211522	GF	On-Demand	Bother	ADRB3	52	45
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819211523	GF	On-Demand	Bother	ADRB2	43	45
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819211523	GF	On-Demand	Bother	ADRB1	77	45
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819211523	GF	On-Demand	Bother	ADRB3	52	45
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211585	IE	On-Demand	Bother	PREP	88	59
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211585	IE	On-Demand	Bother	SFRP1	57	49
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211585	IE	On-Demand	Bother	WNT3	65	49
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211586	IE	On-Demand	Bother	PREP	88	59
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211586	IE	On-Demand	Bother	SFRP1	57	49
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211586	IE	On-Demand	Bother	WNT3	65	49
O=C(COC1CCCCC1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211592	GE	On-Demand	Bother	L3MBTL3	23	41
O=C(c1ccnc(F)c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211594	FD	On-Demand	Bother	L3MBTL3	28	46
O=C(c1cc(Cl)nc(N2CCCC2)c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211596	IF	On-Demand	Bother	L3MBTL3	30	44
O=C(/C=C\c1ccccc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211598	FF	On-Demand	Bother	F3	18	44
O=C(/C=C/c1ccccc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211599	FF	On-Demand	Bother	F3	18	44
C[C@@H](C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)c1ccc([N+](=O)[O-])cc1F	ZINC000819211609	IF	On-Demand	Bother	SLC6A9	23	44
C[C@H](C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)c1ccc([N+](=O)[O-])cc1F	ZINC000819211610	IF	On-Demand	Bother	SLC6A9	23	44
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)c2cccnc2Cl)CC1	ZINC000819211616	FE	On-Demand	Bother	G2YM83_BOTF4	54	34
Cc1c(CC(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cccc1[N+](=O)[O-]	ZINC000819211618	HE	On-Demand	Bother	COLA	91	34
C/C(=C/C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)c1ccc([N+](=O)[O-])cc1	ZINC000819211624	HF	On-Demand	Bother	SLC6A9	15	42
Cc1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1-n1cccc1	ZINC000819211625	HG	On-Demand	Bother	L3MBTL3	27	45
CC[C@H](C)c1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000819211631	GH	On-Demand	Bother	COLA	48	33
CC[C@H](C)c1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000819211631	GH	On-Demand	Bother	L3MBTL3	24	42
CC[C@@H](C)c1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000819211632	GH	On-Demand	Bother	COLA	48	33
CC[C@@H](C)c1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000819211632	GH	On-Demand	Bother	L3MBTL3	24	42
O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211636	IF	On-Demand	Bother	L3MBTL3	54	54
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819211639	IH	On-Demand	Anodyne	PAPA1_CARPA	23	41
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819211639	IH	On-Demand	Anodyne	CCR1	33	45
C/C(=C/C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)c1ccc(C(F)(F)F)cc1	ZINC000819211641	II	On-Demand	Bother	SLC6A9	28	40
CC(C)c1ccc2cc(C(=O)N3CCN(C(=O)c4ccccc4[N+](=O)[O-])CC3)[nH]c2c1	ZINC000819211647	HH	On-Demand	Bother	GRIN2B	25	44
CC(C)c1ccc2cc(C(=O)N3CCN(C(=O)c4ccccc4[N+](=O)[O-])CC3)[nH]c2c1	ZINC000819211647	HH	On-Demand	Bother	HRH4	30	52
O=C(Cc1cccnc1Br)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211650	IE	On-Demand	Bother	COLA	57	33
O=C(c1ccc2nc(S)oc2c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211651	HF	On-Demand	Bother	L3MBTL3	23	43
N#Cc1ccc(N2CCN(C(=O)C(F)=C3CCC3)CC2)c(F)c1	ZINC000819211674	DF	On-Demand	Mild	SLC6A9	26	52
CSc1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1[N+](=O)[O-]	ZINC000819211681	IF	On-Demand	Bother	L3MBTL3	30	51
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1ccc(Cl)c(Cl)c1	ZINC000819211690	FF	On-Demand	Anodyne	ADRB3	61	45
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1ccc(Cl)c(Cl)c1	ZINC000819211692	FF	On-Demand	Anodyne	ADRB3	61	45
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1ccc(Cl)c(Cl)c1	ZINC000819211694	FF	On-Demand	Anodyne	ADRB3	61	45
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1ccc(Cl)c(Cl)c1	ZINC000819211696	FF	On-Demand	Anodyne	ADRB3	61	45
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819211698	GF	On-Demand	Anodyne	CCR3	51	38
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819211698	GF	On-Demand	Anodyne	ACACB	16	41
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819211698	GF	On-Demand	Anodyne	CACNA1I	60	36
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819211698	GF	On-Demand	Anodyne	GPR119	20	41
CC(=O)Nc1cccc(CC(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819211699	GF	On-Demand	Anodyne	CCR3	51	38
CC(=O)Nc1cccc(CC(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819211699	GF	On-Demand	Anodyne	ACACB	16	41
CC(=O)Nc1cccc(CC(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819211699	GF	On-Demand	Anodyne	CACNA1I	60	36
CC(=O)Nc1cccc(CC(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819211699	GF	On-Demand	Anodyne	GPR119	20	41
C=CC(=O)NCc1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000819211704	HD	On-Demand	Bother	TGM2	49	38
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1cccc(F)c1	ZINC000819211719	EG	On-Demand	Bother	ADRB1	35	48
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1cccc(F)c1	ZINC000819211719	EG	On-Demand	Bother	ADRB3	63	48
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819211720	EG	On-Demand	Bother	ADRB1	35	48
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819211720	EG	On-Demand	Bother	ADRB3	63	48
O[C@@H](CNCc1ccccc1N1CCCCC1)c1c(F)cccc1F	ZINC000819211730	EH	On-Demand	Anodyne	KCNQ2	69	40
O[C@H](CNCc1ccccc1N1CCCCC1)c1c(F)cccc1F	ZINC000819211731	EH	On-Demand	Anodyne	KCNQ2	69	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819211732	GF	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819211732	GF	On-Demand	Anodyne	GPR119	38	40
C[C@H](NC[C@H](O)c1ccc(OC(F)(F)F)cc1)[C@@H]1CCCCO1	ZINC000819211753	EG	On-Demand	Anodyne	CTSS	16	40
C[C@H](NC[C@H](O)c1ccc(OC(F)(F)F)cc1)[C@H]1CCCCO1	ZINC000819211756	EG	On-Demand	Anodyne	CTSS	16	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819211767	EE	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CCC(CNC(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819211768	EE	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CCC(CNC(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819211769	EE	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CCC(CNC(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819211770	EE	On-Demand	Anodyne	CACNA1I	42	32
O=C(CCN1C(=O)c2ccc(Br)cc2C1=O)Nc1cccnc1Cl	ZINC000819211771	HG	On-Demand	Anodyne	G2YM83_BOTF4	44	32
CC(C)(C)OC(=O)CS(=O)(=O)CCNCc1ccccc1N1CCCCC1	ZINC000819211776	GF	On-Demand	Anodyne	KCNQ2	68	38
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2)cc1	ZINC000819211781	GG	On-Demand	Bother	ADRB3	16	41
Cc1cc(C)c(/C=C/C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1C	ZINC000819211785	HH	On-Demand	Bother	ITGAL	18	43
Cc1cc(C)c(/C=C\C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1C	ZINC000819211786	HH	On-Demand	Bother	ITGAL	18	43
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2)cc1	ZINC000819211787	GG	On-Demand	Bother	ADRB3	16	41
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCN(c3ccc(F)c(Cl)c3)C2)cc1	ZINC000819211789	GG	On-Demand	Bother	ADRB3	16	41
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCN(c3ccc(F)c(Cl)c3)C2)cc1	ZINC000819211791	GG	On-Demand	Bother	ADRB3	16	41
C/C(=C/C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)c1ccc(F)cc1	ZINC000819211826	GG	On-Demand	Bother	SLC6A9	17	40
Cc1ccccc1[C@@H](O)CNC1CCN(S(=O)(=O)CC(C)C)CC1	ZINC000819211827	FE	On-Demand	Anodyne	CCR8	63	33
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819211828	GE	On-Demand	Anodyne	CACNA1I	65	35
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819211830	GE	On-Demand	Anodyne	CACNA1I	65	35
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)c2ccc(C(F)(F)F)nc2Cl)CC1	ZINC000819211832	IG	On-Demand	Bother	P2RX7	36	41
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)c2ccc(C(F)(F)F)nc2Cl)CC1	ZINC000819211832	IG	On-Demand	Bother	SLC6A9	16	40
O=C(c1cc(=O)c2ccccc2o1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211838	HE	On-Demand	Bother	TNKS	24	45
C/C(=C/C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)c1ccccc1	ZINC000819211851	GF	On-Demand	Bother	L3MBTL3	23	41
C=CCCn1cc(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)nn1	ZINC000819211870	FE	On-Demand	Mild	CACNA1I	53	36
O[C@H](CN[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)c1cccnc1	ZINC000819211894	FG	On-Demand	Anodyne	ADRB3	64	53
O[C@@H](CN[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)c1cccnc1	ZINC000819211896	FG	On-Demand	Anodyne	ADRB3	64	53
O=C(c1ccc(F)nc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211898	FD	On-Demand	Bother	L3MBTL3	27	43
O[C@@H](CN[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)c1cccnc1	ZINC000819211901	FG	On-Demand	Anodyne	ADRB3	64	53
COc1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1[N+](=O)[O-]	ZINC000819211902	HE	On-Demand	Bother	L3MBTL3	30	50
O[C@H](CN[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1)c1cccnc1	ZINC000819211903	FG	On-Demand	Anodyne	ADRB3	64	53
CC(=O)N1CCN(c2ccc(C(=O)Nc3cccnc3Cl)cc2[N+](=O)[O-])CC1	ZINC000819211906	HF	On-Demand	Bother	TAAR1	36	48
CC(=O)N1CCN(c2ccc(C(=O)Nc3cccnc3Cl)cc2[N+](=O)[O-])CC1	ZINC000819211906	HF	On-Demand	Bother	WDR5	36	43
CC(=O)N1CCN(c2ccc(C(=O)Nc3cccnc3Cl)cc2[N+](=O)[O-])CC1	ZINC000819211906	HF	On-Demand	Bother	G2YM83_BOTF4	68	38
O=C(c1cc(Cl)cc([N+](=O)[O-])c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211915	HF	On-Demand	Bother	L3MBTL3	23	43
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccccc1F	ZINC000819211917	EG	On-Demand	Bother	ADRB1	28	40
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccccc1F	ZINC000819211917	EG	On-Demand	Bother	ADRB3	23	41
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccccc1F	ZINC000819211919	EG	On-Demand	Bother	ADRB1	28	40
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccccc1F	ZINC000819211919	EG	On-Demand	Bother	ADRB3	23	41
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccc(F)cc1F	ZINC000819211928	FG	On-Demand	Bother	ADRB1	23	40
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccc(F)cc1F	ZINC000819211928	FG	On-Demand	Bother	ADRB3	19	40
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccc(F)cc1F	ZINC000819211929	FG	On-Demand	Bother	ADRB1	23	40
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccc(F)cc1F	ZINC000819211929	FG	On-Demand	Bother	ADRB3	19	40
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211940	HE	On-Demand	Bother	FPR1	41	34
CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211944	IC	On-Demand	Bother	GSTM2	15	40
CN(CCC(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)C(=O)OC(C)(C)C	ZINC000819211949	HE	On-Demand	Bother	SSTR1	41	40
Cc1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1C#N	ZINC000819211959	GE	On-Demand	Mild	L3MBTL3	28	47
COc1ccccc1COC[C@H](O)CNC[C@H]1COC2(CCCCCC2)O1	ZINC000819211960	GF	On-Demand	Anodyne	ADRA1D	24	44
COc1ccccc1COC[C@H](O)CNC[C@H]1COC2(CCCCCC2)O1	ZINC000819211960	GF	On-Demand	Anodyne	ADRA1A	17	48
COc1ccccc1COC[C@H](O)CNC[C@H]1COC2(CCCCCC2)O1	ZINC000819211960	GF	On-Demand	Anodyne	ADRA1B	25	48
COc1ccccc1COC[C@@H](O)CNC[C@H]1COC2(CCCCCC2)O1	ZINC000819211962	GF	On-Demand	Anodyne	ADRA1D	24	44
COc1ccccc1COC[C@@H](O)CNC[C@H]1COC2(CCCCCC2)O1	ZINC000819211962	GF	On-Demand	Anodyne	ADRA1A	17	48
COc1ccccc1COC[C@@H](O)CNC[C@H]1COC2(CCCCCC2)O1	ZINC000819211962	GF	On-Demand	Anodyne	ADRA1B	25	48
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)CC1	ZINC000819211963	IF	On-Demand	Bother	GPR119	47	44
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)CC1	ZINC000819211963	IF	On-Demand	Bother	SFRP1	52	46
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)CC1	ZINC000819211963	IF	On-Demand	Bother	WNT3	46	38
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)CC1	ZINC000819211963	IF	On-Demand	Bother	L3MBTL3	26	41
O=C(c1cc2occc2[nH]1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819211975	FE	On-Demand	Bother	HRH4	22	53
COc1ccccc1COC[C@@H](O)CNC[C@@H]1COC2(CCCCCC2)O1	ZINC000819211982	GF	On-Demand	Anodyne	ADRA1D	24	44
COc1ccccc1COC[C@@H](O)CNC[C@@H]1COC2(CCCCCC2)O1	ZINC000819211982	GF	On-Demand	Anodyne	ADRA1A	17	48
COc1ccccc1COC[C@@H](O)CNC[C@@H]1COC2(CCCCCC2)O1	ZINC000819211982	GF	On-Demand	Anodyne	ADRA1B	25	48
COc1ccccc1COC[C@H](O)CNC[C@@H]1COC2(CCCCCC2)O1	ZINC000819211983	GF	On-Demand	Anodyne	ADRA1D	24	44
COc1ccccc1COC[C@H](O)CNC[C@@H]1COC2(CCCCCC2)O1	ZINC000819211983	GF	On-Demand	Anodyne	ADRA1A	17	48
COc1ccccc1COC[C@H](O)CNC[C@@H]1COC2(CCCCCC2)O1	ZINC000819211983	GF	On-Demand	Anodyne	ADRA1B	25	48
N#Cc1ccc([C@@H](O)CNCc2ccccc2N2CCCCC2)cc1	ZINC000819211993	EG	On-Demand	Mild	KCNQ2	61	36
N#Cc1ccc([C@H](O)CNCc2ccccc2N2CCCCC2)cc1	ZINC000819211994	EG	On-Demand	Mild	KCNQ2	61	36
CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819211995	GE	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819211995	GE	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819211996	GE	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819211996	GE	On-Demand	Anodyne	CACNA1I	41	33
O[C@H](CN[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1ccccc1	ZINC000819212009	EG	On-Demand	Anodyne	ADRB1	15	41
O[C@H](CN[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1ccccc1	ZINC000819212009	EG	On-Demand	Anodyne	ADRB3	29	41
O[C@@H](CN[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1ccccc1	ZINC000819212010	EG	On-Demand	Anodyne	ADRB1	15	41
O[C@@H](CN[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1ccccc1	ZINC000819212010	EG	On-Demand	Anodyne	ADRB3	29	41
O[C@@H](CN[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1ccccc1	ZINC000819212011	EG	On-Demand	Anodyne	ADRB1	15	41
O[C@@H](CN[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1ccccc1	ZINC000819212011	EG	On-Demand	Anodyne	ADRB3	29	41
O[C@H](CN[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1ccccc1	ZINC000819212012	EG	On-Demand	Anodyne	ADRB1	15	41
O[C@H](CN[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1ccccc1	ZINC000819212012	EG	On-Demand	Anodyne	ADRB3	29	41
Cc1sc2ncnc(N3CCC(C(=O)Nc4cccnc4Cl)CC3)c2c1C	ZINC000819212017	HI	On-Demand	Anodyne	LIMK2	24	46
Cc1sc2ncnc(N3CCC(C(=O)Nc4cccnc4Cl)CC3)c2c1C	ZINC000819212017	HI	On-Demand	Anodyne	G2YM83_BOTF4	65	32
COc1ccc(OC)c([C@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000819212019	GG	On-Demand	Bother	ADRB2	23	46
COc1ccc(OC)c([C@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000819212019	GG	On-Demand	Bother	ADRB1	31	43
COc1ccc(OC)c([C@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000819212019	GG	On-Demand	Bother	ADRB3	28	43
CCCC[C@H](NC(=O)/C=C/[C@H]1CCCO1)C(=O)Nc1cccc(N2CCCC2)c1	ZINC000819212024	GH	On-Demand	Anodyne	HDAC11	42	36
CCCC[C@H](NC(=O)/C=C\[C@H]1CCCO1)C(=O)Nc1cccc(N2CCCC2)c1	ZINC000819212025	GH	On-Demand	Anodyne	HDAC11	42	36
CCCC[C@H](NC(=O)/C=C/[C@@H]1CCCO1)C(=O)Nc1cccc(N2CCCC2)c1	ZINC000819212026	GH	On-Demand	Anodyne	HDAC11	42	36
CCCC[C@H](NC(=O)/C=C\[C@@H]1CCCO1)C(=O)Nc1cccc(N2CCCC2)c1	ZINC000819212027	GH	On-Demand	Anodyne	HDAC11	42	36
C=CCCn1cc(C(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819212048	FE	On-Demand	Mild	CACNA1I	46	33
C=CCCn1cc(C(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819212049	FE	On-Demand	Mild	CACNA1I	46	33
C#CCN1CCC[C@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212054	FC	On-Demand	Mild	PREP	53	40
C#CCN1CCC[C@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212054	FC	On-Demand	Mild	WNT3	49	35
C#CCN1CCC[C@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212054	FC	On-Demand	Mild	L3MBTL3	26	41
O[C@@H](CNCc1ccccc1N1CCCCC1)c1cc(F)ccc1F	ZINC000819212059	EH	On-Demand	Anodyne	KCNQ2	68	40
O[C@@H](CNCc1ccccc1N1CCCCC1)c1cc(F)ccc1F	ZINC000819212059	EH	On-Demand	Anodyne	SCN2A	17	41
O[C@H](CNCc1ccccc1N1CCCCC1)c1cc(F)ccc1F	ZINC000819212060	EH	On-Demand	Anodyne	KCNQ2	68	40
O[C@H](CNCc1ccccc1N1CCCCC1)c1cc(F)ccc1F	ZINC000819212060	EH	On-Demand	Anodyne	SCN2A	17	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])cc1	ZINC000819212065	GF	On-Demand	Bother	ADRB2	21	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])cc1	ZINC000819212065	GF	On-Demand	Bother	ADRB3	58	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])cc1	ZINC000819212065	GF	On-Demand	Bother	COLA	50	36
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])cc1	ZINC000819212066	GF	On-Demand	Bother	ADRB2	21	42
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])cc1	ZINC000819212066	GF	On-Demand	Bother	ADRB3	58	41
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])cc1	ZINC000819212066	GF	On-Demand	Bother	COLA	50	36
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2)cc1	ZINC000819212069	FG	On-Demand	Mild	ADRB3	15	42
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2)cc1	ZINC000819212071	FG	On-Demand	Mild	ADRB3	15	42
N#Cc1ccc([C@H](O)CN[C@H]2CCN(c3ccc(F)c(Cl)c3)C2)cc1	ZINC000819212073	FG	On-Demand	Mild	ADRB3	15	42
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(c3ccc(F)c(Cl)c3)C2)cc1	ZINC000819212074	FG	On-Demand	Mild	ADRB3	15	42
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)c1	ZINC000819212076	GF	On-Demand	Anodyne	ADRB2	20	44
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)c1	ZINC000819212076	GF	On-Demand	Anodyne	ABCB1	15	45
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCCC3)O2)c1	ZINC000819212078	GF	On-Demand	Anodyne	ADRB2	20	44
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCCC3)O2)c1	ZINC000819212078	GF	On-Demand	Anodyne	ABCB1	15	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2COC3(CCCCCC3)O2)c1	ZINC000819212079	GF	On-Demand	Anodyne	ADRB2	20	44
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2COC3(CCCCCC3)O2)c1	ZINC000819212079	GF	On-Demand	Anodyne	ABCB1	15	45
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)c1	ZINC000819212081	GF	On-Demand	Anodyne	ADRB2	20	44
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)c1	ZINC000819212081	GF	On-Demand	Anodyne	ABCB1	15	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CC(C)(C)OC2(C)C)CC1	ZINC000819212090	FF	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CC(C)(C)OC2(C)C)CC1	ZINC000819212092	FF	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CC(C)(C)OC2(C)C)CC1	ZINC000819212094	FF	On-Demand	Anodyne	GPR119	23	40
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212095	HE	On-Demand	Bother	COLA	41	38
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CC(C)(C)OC2(C)C)CC1	ZINC000819212096	FF	On-Demand	Anodyne	GPR119	23	40
O[C@H](CN[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1cccc(F)c1	ZINC000819212098	FH	On-Demand	Anodyne	ADRB3	26	48
O[C@H](CN[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1cccc(F)c1	ZINC000819212098	FH	On-Demand	Anodyne	CYP3A4	40	35
O[C@@H](CN[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1cccc(F)c1	ZINC000819212100	FH	On-Demand	Anodyne	ADRB3	26	48
O[C@@H](CN[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1cccc(F)c1	ZINC000819212100	FH	On-Demand	Anodyne	CYP3A4	40	35
O=C(COc1ccc(-c2ccccc2)cc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212113	IH	On-Demand	Bother	CPT1A	58	38
O=C(COc1ccc(-c2ccccc2)cc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212113	IH	On-Demand	Bother	CPT2	44	34
O=C(c1ccc(OC(F)(F)Cl)cc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212114	IG	On-Demand	Bother	L3MBTL3	47	43
O=Cc1cc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cs1	ZINC000819212115	FE	On-Demand	Bother	L3MBTL3	19	43
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212117	IF	On-Demand	Bother	CPT2	43	37
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212117	IF	On-Demand	Bother	PREP	88	58
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212117	IF	On-Demand	Bother	SFRP1	56	48
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212117	IF	On-Demand	Bother	WNT3	64	48
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212117	IF	On-Demand	Bother	L3MBTL3	15	40
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212123	HD	On-Demand	Bother	L3MBTL3	19	43
O=C(NCC(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)OCc1ccccc1	ZINC000819212124	ID	On-Demand	Bother	PREP	18	48
O=C(NCC(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)OCc1ccccc1	ZINC000819212124	ID	On-Demand	Bother	CAPN2	56	31
O=C(NCC(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)OCc1ccccc1	ZINC000819212124	ID	On-Demand	Bother	NPR	64	34
N#Cc1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)o1	ZINC000819212125	FD	On-Demand	Mild	SLC6A9	17	41
N#Cc1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)o1	ZINC000819212125	FD	On-Demand	Mild	CSF1R	17	40
CCOC(=O)Nc1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000819212136	IF	On-Demand	Bother	AVPR2	43	48
O=C(c1cc(F)c([N+](=O)[O-])cc1F)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212145	HE	On-Demand	Bother	SLC6A9	28	44
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000819212146	HF	On-Demand	Bother	P2RX7	20	42
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000819212146	HF	On-Demand	Bother	L3MBTL3	24	47
CC(C)(C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)C1CCCCC1	ZINC000819212149	GG	On-Demand	Bother	L3MBTL3	15	42
CCC(=O)c1cc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)ccc1F	ZINC000819212167	HF	On-Demand	Bother	SLC6A9	18	41
CCC(=O)c1cc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)ccc1F	ZINC000819212167	HF	On-Demand	Bother	PARP1	47	39
CCC(=O)c1cc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)ccc1F	ZINC000819212167	HF	On-Demand	Bother	L3MBTL3	27	44
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212180	IF	On-Demand	Bother	PREP	21	41
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212181	IF	On-Demand	Bother	PREP	21	41
O[C@@H](CN[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1cccc(F)c1	ZINC000819212182	FH	On-Demand	Anodyne	ADRB3	26	48
O[C@@H](CN[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1cccc(F)c1	ZINC000819212182	FH	On-Demand	Anodyne	CYP3A4	40	35
O[C@H](CN[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1cccc(F)c1	ZINC000819212183	FH	On-Demand	Anodyne	ADRB3	26	48
O[C@H](CN[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1cccc(F)c1	ZINC000819212183	FH	On-Demand	Anodyne	CYP3A4	40	35
CC(=O)Nc1cccc(CC(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819212211	GF	On-Demand	Anodyne	CCR3	56	43
CC(=O)Nc1cccc(CC(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819212211	GF	On-Demand	Anodyne	CACNA1I	60	38
CC(=O)Nc1cccc(CC(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819212211	GF	On-Demand	Anodyne	GPR119	35	49
CC(=O)Nc1cccc(CC(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819212212	GF	On-Demand	Anodyne	CCR3	56	43
CC(=O)Nc1cccc(CC(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819212212	GF	On-Demand	Anodyne	CACNA1I	60	38
CC(=O)Nc1cccc(CC(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819212212	GF	On-Demand	Anodyne	GPR119	35	49
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccccc1Br	ZINC000819212217	GH	On-Demand	Bother	ADRB3	19	41
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccccc1Br	ZINC000819212218	GH	On-Demand	Bother	ADRB3	19	41
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212227	GE	On-Demand	Anodyne	ADRB2	34	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212227	GE	On-Demand	Anodyne	ADRB1	58	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212227	GE	On-Demand	Anodyne	ADRB3	36	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212228	GE	On-Demand	Anodyne	ADRB2	34	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212228	GE	On-Demand	Anodyne	ADRB1	58	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212228	GE	On-Demand	Anodyne	ADRB3	36	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212229	GE	On-Demand	Anodyne	ADRB2	34	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212229	GE	On-Demand	Anodyne	ADRB1	58	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212229	GE	On-Demand	Anodyne	ADRB3	36	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212230	GE	On-Demand	Anodyne	ADRB2	34	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212230	GE	On-Demand	Anodyne	ADRB1	58	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212230	GE	On-Demand	Anodyne	ADRB3	36	42
CON(C)C(=O)CCNCc1ccccc1N1CCCCC1	ZINC000819212247	DE	On-Demand	Anodyne	KCNQ2	74	40
O[C@@H](CNCc1ccccc1N1CCCCC1)c1cccc(F)c1	ZINC000819212248	EH	On-Demand	Anodyne	KCNQ2	76	51
O[C@H](CNCc1ccccc1N1CCCCC1)c1cccc(F)c1	ZINC000819212249	EH	On-Demand	Anodyne	KCNQ2	76	51
O[C@@H](CNCc1ccccc1N1CCCCC1)c1ccccc1	ZINC000819212250	DH	On-Demand	Anodyne	KCNQ2	80	43
O[C@H](CNCc1ccccc1N1CCCCC1)c1ccccc1	ZINC000819212251	DH	On-Demand	Anodyne	KCNQ2	80	43
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)cc1	ZINC000819212262	GH	On-Demand	Bother	ADRB3	17	42
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)cc1	ZINC000819212263	GH	On-Demand	Bother	ADRB3	17	42
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)cc1	ZINC000819212264	GH	On-Demand	Bother	ADRB3	17	42
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)cc1	ZINC000819212265	GH	On-Demand	Bother	ADRB3	17	42
CN1CCC(CNC(=O)C(F)=C2CCC2)CC1	ZINC000819212266	BD	On-Demand	Anodyne	CACNA1I	57	34
COc1cccc([S@@](=O)CC(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819212267	GE	On-Demand	Anodyne	DRD4	41	32
COc1cccc([S@@](=O)CC(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819212267	GE	On-Demand	Anodyne	ACACB	15	41
COc1cccc([S@@](=O)CC(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819212267	GE	On-Demand	Anodyne	CACNA1I	50	34
COc1cccc([S@](=O)CC(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819212268	GE	On-Demand	Anodyne	DRD4	41	32
COc1cccc([S@](=O)CC(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819212268	GE	On-Demand	Anodyne	ACACB	15	41
COc1cccc([S@](=O)CC(=O)N2CC[C@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819212268	GE	On-Demand	Anodyne	CACNA1I	50	34
COc1cccc([S@](=O)CC(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819212269	GE	On-Demand	Anodyne	DRD4	41	32
COc1cccc([S@](=O)CC(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819212269	GE	On-Demand	Anodyne	ACACB	15	41
COc1cccc([S@](=O)CC(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819212269	GE	On-Demand	Anodyne	CACNA1I	50	34
COc1cccc([S@@](=O)CC(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819212270	GE	On-Demand	Anodyne	DRD4	41	32
COc1cccc([S@@](=O)CC(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819212270	GE	On-Demand	Anodyne	ACACB	15	41
COc1cccc([S@@](=O)CC(=O)N2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c1	ZINC000819212270	GE	On-Demand	Anodyne	CACNA1I	50	34
O[C@H](CN[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819212271	FH	On-Demand	Anodyne	ADRB3	21	44
O[C@H](CN[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819212272	FH	On-Demand	Anodyne	ADRB3	21	44
O[C@@H](CN[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819212273	FH	On-Demand	Anodyne	ADRB3	21	44
O[C@@H](CN[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819212274	FH	On-Demand	Anodyne	ADRB3	21	44
CC(=O)Nc1cccc(CC(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819212275	GF	On-Demand	Anodyne	GRIN2B	32	43
CC(=O)Nc1cccc(CC(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819212275	GF	On-Demand	Anodyne	CCR3	54	42
CC(=O)Nc1cccc(CC(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819212275	GF	On-Demand	Anodyne	EPHX2	20	43
CC(=O)Nc1cccc(CC(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819212275	GF	On-Demand	Anodyne	ST14	40	36
CC(=O)Nc1cccc(CC(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819212275	GF	On-Demand	Anodyne	CACNA1I	72	44
CC(=O)Nc1cccc(CC(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819212275	GF	On-Demand	Anodyne	GPR119	52	55
O=C(/C=C/c1ccc2c(c1)OCO2)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212284	HE	On-Demand	Bother	ITGAL	21	53
O=C(/C=C\c1ccc2c(c1)OCO2)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212285	HE	On-Demand	Bother	ITGAL	21	53
O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212291	HD	On-Demand	Bother	L3MBTL3	43	54
O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212295	HF	On-Demand	Bother	P2RX7	22	40
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)[C@@H](F)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819212307	IH	On-Demand	Bother	SLC6A9	22	42
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)[C@H](F)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819212308	IH	On-Demand	Bother	SLC6A9	22	42
O=C(c1ccc([N+](=O)[O-])c(Cl)c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212331	HF	On-Demand	Bother	L3MBTL3	41	50
O=C(c1cc(Cl)nc(Cl)c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212342	HF	On-Demand	Bother	L3MBTL3	27	45
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000819212359	FG	On-Demand	Anodyne	GRM5	19	68
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000819212359	FG	On-Demand	Anodyne	ETHR	59	41
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000819212360	FG	On-Demand	Anodyne	GRM5	19	68
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000819212360	FG	On-Demand	Anodyne	ETHR	59	41
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000819212361	FG	On-Demand	Anodyne	GRM5	19	68
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000819212361	FG	On-Demand	Anodyne	ETHR	59	41
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000819212362	FG	On-Demand	Anodyne	GRM5	19	68
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000819212362	FG	On-Demand	Anodyne	ETHR	59	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)c1	ZINC000819212363	GH	On-Demand	Bother	ADRB3	22	44
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)c1	ZINC000819212363	GH	On-Demand	Bother	CYP3A4	40	35
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)c1	ZINC000819212364	GH	On-Demand	Bother	ADRB3	22	44
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)c1	ZINC000819212364	GH	On-Demand	Bother	CYP3A4	40	35
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)c1	ZINC000819212365	GH	On-Demand	Bother	ADRB3	22	44
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)c1	ZINC000819212365	GH	On-Demand	Bother	CYP3A4	40	35
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)c1	ZINC000819212366	GH	On-Demand	Bother	ADRB3	22	44
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCN(c3ccc(Cl)c(Cl)c3)C2)c1	ZINC000819212366	GH	On-Demand	Bother	CYP3A4	40	35
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CC=C(c3ccc(F)cc3)CC2)cc1	ZINC000819212367	GG	On-Demand	Anodyne	PTGS2	45	41
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CC=C(c3ccc(F)cc3)CC2)cc1	ZINC000819212368	GG	On-Demand	Anodyne	PTGS2	45	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CC=C(c3ccc(F)cc3)CC2)cc1	ZINC000819212369	GG	On-Demand	Anodyne	PTGS2	45	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CC=C(c3ccc(F)cc3)CC2)cc1	ZINC000819212370	GG	On-Demand	Anodyne	PTGS2	45	41
CS(=O)(=O)c1ccc([C@@H](O)CNCC2(Cc3ccccc3)CCCC2)cc1	ZINC000819212406	GH	On-Demand	Anodyne	ADRB3	41	42
CS(=O)(=O)c1ccc([C@@H](O)CNCC2(Cc3ccccc3)CCCC2)cc1	ZINC000819212406	GH	On-Demand	Anodyne	SLC12A5	19	40
CS(=O)(=O)c1ccc([C@H](O)CNCC2(Cc3ccccc3)CCCC2)cc1	ZINC000819212407	GH	On-Demand	Anodyne	ADRB3	41	42
CS(=O)(=O)c1ccc([C@H](O)CNCC2(Cc3ccccc3)CCCC2)cc1	ZINC000819212407	GH	On-Demand	Anodyne	SLC12A5	19	40
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccccc2N2CCCCC2)c1	ZINC000819212427	FG	On-Demand	Bother	KCNQ2	70	38
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccccc2N2CCCCC2)c1	ZINC000819212427	FG	On-Demand	Bother	CACNA1D	50	33
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccccc2N2CCCCC2)c1	ZINC000819212429	FG	On-Demand	Bother	KCNQ2	70	38
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccccc2N2CCCCC2)c1	ZINC000819212429	FG	On-Demand	Bother	CACNA1D	50	33
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H](N(C)C(=O)OC(C)(C)C)C2)c1	ZINC000819212430	GG	On-Demand	Anodyne	CCR3	28	40
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H](N(C)C(=O)OC(C)(C)C)C2)c1	ZINC000819212432	GG	On-Demand	Anodyne	CCR3	28	40
COc1ccc(C(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)c2ccccc12	ZINC000819212437	HI	On-Demand	Anodyne	L3MBTL3	23	41
COc1ccc(C(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)c2ccccc12	ZINC000819212437	HI	On-Demand	Anodyne	G2YM83_BOTF4	66	34
O=C(Cc1csc(NC(=O)c2ccco2)n1)Nc1cccnc1Cl	ZINC000819212441	FG	On-Demand	Anodyne	MAP1	26	43
O=C(Cc1csc(NC(=O)c2ccco2)n1)Nc1cccnc1Cl	ZINC000819212441	FG	On-Demand	Anodyne	G2YM83_BOTF4	62	30
Cc1cc(C)c2c(-n3cccc3)c(C(=O)Nc3cccnc3Cl)sc2n1	ZINC000819212448	GK	On-Demand	Anodyne	CHRM4	19	40
Cc1cc(C)c2c(-n3cccc3)c(C(=O)Nc3cccnc3Cl)sc2n1	ZINC000819212448	GK	On-Demand	Anodyne	G2YM83_BOTF4	68	35
NC(=O)[C@H]1CCCN(Cc2ccc(NC(=O)C(F)=C3CCC3)cc2)C1	ZINC000819212456	EF	On-Demand	Anodyne	SLC6A1	76	32
NC(=O)[C@@H]1CCCN(Cc2ccc(NC(=O)C(F)=C3CCC3)cc2)C1	ZINC000819212457	EF	On-Demand	Anodyne	SLC6A1	76	32
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2)c1	ZINC000819212465	GG	On-Demand	Bother	ADRB3	23	46
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2)c1	ZINC000819212467	GG	On-Demand	Bother	ADRB3	23	46
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCN(c3ccc(F)c(Cl)c3)C2)c1	ZINC000819212472	GG	On-Demand	Bother	ADRB3	23	46
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCN(c3ccc(F)c(Cl)c3)C2)c1	ZINC000819212475	GG	On-Demand	Bother	ADRB3	23	46
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1cccc(Br)c1	ZINC000819212477	GH	On-Demand	Bother	ADRB1	35	47
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1cccc(Br)c1	ZINC000819212477	GH	On-Demand	Bother	ADRB3	56	47
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1cccc(Br)c1	ZINC000819212480	GH	On-Demand	Bother	ADRB1	35	47
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1cccc(Br)c1	ZINC000819212480	GH	On-Demand	Bother	ADRB3	56	47
CC(C)(C)OC(=O)N1CCC(CNC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819212494	GF	On-Demand	Anodyne	GRIN2B	21	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819212494	GF	On-Demand	Anodyne	CACNA1I	66	49
CC(C)(C)OC(=O)N1CCC(CNC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819212494	GF	On-Demand	Anodyne	GPR119	61	56
C[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000819212516	GF	On-Demand	Anodyne	ACHE	30	40
C[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000819212516	GF	On-Demand	Anodyne	CCR5	31	42
C[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819212519	GF	On-Demand	Anodyne	ACHE	30	40
C[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819212519	GF	On-Demand	Anodyne	CCR5	31	42
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)Cc2nsc3ccccc23)C1	ZINC000819212527	GH	On-Demand	Anodyne	HTR1A	15	40
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)Cc2nsc3ccccc23)C1	ZINC000819212527	GH	On-Demand	Anodyne	DRD2	19	40
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)Cc2nsc3ccccc23)C1	ZINC000819212527	GH	On-Demand	Anodyne	CACNA1I	42	36
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)Cc2nsc3ccccc23)C1	ZINC000819212527	GH	On-Demand	Anodyne	GPR119	31	41
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)Cc2nsc3ccccc23)C1	ZINC000819212529	GH	On-Demand	Anodyne	HTR1A	15	40
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)Cc2nsc3ccccc23)C1	ZINC000819212529	GH	On-Demand	Anodyne	DRD2	19	40
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)Cc2nsc3ccccc23)C1	ZINC000819212529	GH	On-Demand	Anodyne	CACNA1I	42	36
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)Cc2nsc3ccccc23)C1	ZINC000819212529	GH	On-Demand	Anodyne	GPR119	31	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212538	GF	On-Demand	Anodyne	ADRB2	26	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212538	GF	On-Demand	Anodyne	ADRB1	51	39
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212541	GF	On-Demand	Anodyne	ADRB2	26	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212541	GF	On-Demand	Anodyne	ADRB1	51	39
Cc1c(Br)cccc1CC(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212542	IG	On-Demand	Bother	COLA	88	33
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212544	GF	On-Demand	Anodyne	ADRB2	26	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212544	GF	On-Demand	Anodyne	ADRB1	51	39
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)c2cccc(Cl)c2[N+](=O)[O-])CC1	ZINC000819212545	HF	On-Demand	Bother	P2RX7	36	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212546	GF	On-Demand	Anodyne	ADRB2	26	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819212546	GF	On-Demand	Anodyne	ADRB1	51	39
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819212548	IE	On-Demand	Bother	GPR119	42	40
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819212548	IE	On-Demand	Bother	SFRP1	73	48
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819212548	IE	On-Demand	Bother	WNT3	60	39
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819212548	IE	On-Demand	Bother	L3MBTL3	23	40
CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819212549	GE	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819212549	GE	On-Demand	Anodyne	CACNA1I	54	41
CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819212549	GE	On-Demand	Anodyne	GPR119	29	42
O=C(c1cc(-c2ccc3ccccc3c2)[nH]n1)N1CCCC[C@H]1C1OCCO1	ZINC000819212551	GH	On-Demand	Anodyne	CPT1A	87	37
CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819212552	GE	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819212552	GE	On-Demand	Anodyne	CACNA1I	54	41
CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819212552	GE	On-Demand	Anodyne	GPR119	29	42
O=C(c1cc(-c2ccc3ccccc3c2)[nH]n1)N1CCCC[C@@H]1C1OCCO1	ZINC000819212553	GH	On-Demand	Anodyne	CPT1A	87	37
O=C(c1ccc2c(c1)-c1ccccc1C2)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212560	IH	On-Demand	Bother	L3MBTL3	29	47
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212570	IE	On-Demand	Bother	PREP	20	41
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212571	IE	On-Demand	Bother	PREP	20	41
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(C2OCCO2)CC1	ZINC000819212602	ED	On-Demand	Anodyne	KCNJ1	62	40
O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212627	HF	On-Demand	Bother	GRIN2B	20	45
O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212627	HF	On-Demand	Bother	HRH4	35	77
O=C1CC[C@@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)CCN1	ZINC000819212635	FC	On-Demand	Bother	L3MBTL3	23	42
O=C1CC[C@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)CCN1	ZINC000819212637	FC	On-Demand	Bother	L3MBTL3	23	42
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CC1	ZINC000819212645	HF	On-Demand	Bother	GABRA1	17	50
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)CC1	ZINC000819212645	HF	On-Demand	Bother	GABRA2	15	50
C/C(=C/C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)c1cccc(C(F)(F)F)c1	ZINC000819212649	II	On-Demand	Bother	CACNA1B	47	39
C/C(=C/C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)c1cccc(C(F)(F)F)c1	ZINC000819212649	II	On-Demand	Bother	SLC6A9	33	40
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)CC1	ZINC000819212665	ID	On-Demand	Bother	PREP	73	45
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)CC1	ZINC000819212665	ID	On-Demand	Bother	SFRP1	49	39
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)CC1	ZINC000819212665	ID	On-Demand	Bother	WNT3	65	39
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)[C@H]2CCCN2C(=O)C(F)(F)F)CC1	ZINC000819212666	ID	On-Demand	Bother	PREP	73	45
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)[C@H]2CCCN2C(=O)C(F)(F)F)CC1	ZINC000819212666	ID	On-Demand	Bother	SFRP1	49	39
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)[C@H]2CCCN2C(=O)C(F)(F)F)CC1	ZINC000819212666	ID	On-Demand	Bother	WNT3	65	39
COC(=O)Nc1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000819212669	HE	On-Demand	Bother	AVPR2	50	51
COC(=O)Nc1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000819212669	HE	On-Demand	Bother	L3MBTL3	30	42
C/C(=C/C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)c1ccccc1C(F)(F)F	ZINC000819212693	II	On-Demand	Bother	RBP4	49	41
C/C(=C/C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)c1ccccc1C(F)(F)F	ZINC000819212693	II	On-Demand	Bother	SCD1	18	44
C/C(=C/C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)c1ccccc1C(F)(F)F	ZINC000819212693	II	On-Demand	Bother	SCD	18	40
CSCC[C@H](C(=O)Nc1cccnc1Cl)N1C(=O)[C@H]2CCCC[C@H]2C1=O	ZINC000819212695	GF	On-Demand	Anodyne	G2YM83_BOTF4	68	36
CSCC[C@@H](C(=O)Nc1cccnc1Cl)N1C(=O)[C@H]2CCCC[C@H]2C1=O	ZINC000819212700	GF	On-Demand	Anodyne	G2YM83_BOTF4	68	36
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1ccccc1N1CCCCC1	ZINC000819212704	GG	On-Demand	Anodyne	KCNQ2	70	37
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1ccccc1N1CCCCC1	ZINC000819212704	GG	On-Demand	Anodyne	FPR1	40	35
CSCC[C@H](C(=O)Nc1cccnc1Cl)N1C(=O)[C@H]2CCCC[C@@H]2C1=O	ZINC000819212705	GF	On-Demand	Anodyne	G2YM83_BOTF4	68	36
O=C(/C=C\C1CCCCC1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212706	FG	On-Demand	Bother	L3MBTL3	19	42
O=C(/C=C/C1CCCCC1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212707	FG	On-Demand	Bother	L3MBTL3	19	42
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1ccccc1N1CCCCC1	ZINC000819212708	GG	On-Demand	Anodyne	KCNQ2	70	37
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1ccccc1N1CCCCC1	ZINC000819212708	GG	On-Demand	Anodyne	FPR1	40	35
CSCC[C@H](C(=O)Nc1cccnc1Cl)N1C(=O)[C@@H]2CCCC[C@H]2C1=O	ZINC000819212710	GF	On-Demand	Anodyne	G2YM83_BOTF4	68	36
Cc1ccccc1[C@@H](O)CNCc1ccccc1N1CCCCC1	ZINC000819212735	DH	On-Demand	Anodyne	KCNQ2	72	38
O=C(c1ccc(Br)nc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212752	HE	On-Demand	Bother	L3MBTL3	27	43
O[C@@H](CNC[C@@H]1COC2(CCCCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819212763	FF	On-Demand	Anodyne	ADRB1	17	56
O[C@@H](CNC[C@@H]1COC2(CCCCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819212763	FF	On-Demand	Anodyne	HTR1A	15	56
O[C@H](CNC[C@@H]1COC2(CCCCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819212765	FF	On-Demand	Anodyne	ADRB1	17	56
O[C@H](CNC[C@@H]1COC2(CCCCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819212765	FF	On-Demand	Anodyne	HTR1A	15	56
O[C@@H](CNC[C@H]1COC2(CCCCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819212768	FF	On-Demand	Anodyne	ADRB1	17	56
O[C@@H](CNC[C@H]1COC2(CCCCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819212768	FF	On-Demand	Anodyne	HTR1A	15	56
C#CCOc1ccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000819212771	GE	On-Demand	Mild	L3MBTL3	42	43
O[C@H](CNC[C@H]1COC2(CCCCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819212773	FF	On-Demand	Anodyne	ADRB1	17	56
O[C@H](CNC[C@H]1COC2(CCCCCC2)O1)COc1cccc2[nH]ccc12	ZINC000819212773	FF	On-Demand	Anodyne	HTR1A	15	56
C[C@H](NC[C@H](O)c1cccnc1)[C@H]1CCCCO1	ZINC000819212774	CD	On-Demand	Anodyne	ADRB1	23	46
C[C@H](NC[C@H](O)c1cccnc1)[C@H]1CCCCO1	ZINC000819212774	CD	On-Demand	Anodyne	ADRB3	82	46
C[C@H](NC[C@H](O)c1cccnc1)[C@@H]1CCCCO1	ZINC000819212777	CD	On-Demand	Anodyne	ADRB1	23	46
C[C@H](NC[C@H](O)c1cccnc1)[C@@H]1CCCCO1	ZINC000819212777	CD	On-Demand	Anodyne	ADRB3	82	46
O=C(c1ccnc(C(F)(F)F)c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212778	HF	On-Demand	Bother	L3MBTL3	23	43
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)Nc3cccnc3Cl)cc2)CC1	ZINC000819212780	HD	On-Demand	Anodyne	GRM4	32	44
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)Nc3cccnc3Cl)cc2)CC1	ZINC000819212780	HD	On-Demand	Anodyne	TGM2	79	42
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)Nc3cccnc3Cl)cc2)CC1	ZINC000819212780	HD	On-Demand	Anodyne	F13A1	75	42
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)Nc3cccnc3Cl)cc2)CC1	ZINC000819212780	HD	On-Demand	Anodyne	NAMPT	41	37
CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)Nc3cccnc3Cl)cc2)CC1	ZINC000819212780	HD	On-Demand	Anodyne	G2YM83_BOTF4	74	40
O=C(/C=C/c1cccc(O)c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212787	GE	On-Demand	Bother	ITGAL	15	47
O=C(/C=C\c1cccc(O)c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212790	GE	On-Demand	Bother	ITGAL	15	47
O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212793	HD	On-Demand	Bother	L3MBTL3	23	44
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819212800	FH	On-Demand	Bother	ADRB2	23	45
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819212800	FH	On-Demand	Bother	ADRB1	31	42
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819212800	FH	On-Demand	Bother	ADRB3	37	42
Cc1ccc(N2CCCC2)c(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)c1	ZINC000819212834	HG	On-Demand	Bother	SLC6A9	31	52
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccccc2N2CCCCC2)cc1	ZINC000819212847	GF	On-Demand	Anodyne	KCNQ2	72	37
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccccc2N2CCCCC2)cc1	ZINC000819212850	GF	On-Demand	Anodyne	KCNQ2	72	37
O=C(/C=C/c1ccc(O)cc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212854	GE	On-Demand	Bother	F3	25	43
O=C(/C=C\c1ccc(O)cc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212857	GE	On-Demand	Bother	F3	25	43
O=C(CNC[C@@H](O)c1ccc(Cl)c(F)c1)NCC1CC1	ZINC000819212861	DD	On-Demand	Anodyne	CACNA1I	45	35
O=C(CNC[C@H](O)c1ccc(Cl)c(F)c1)NCC1CC1	ZINC000819212864	DD	On-Demand	Anodyne	CACNA1I	45	35
C[C@H](C(=O)Nc1cccnc1Cl)N1C(=O)c2ccc(Br)cc2C1=O	ZINC000819212872	HG	On-Demand	Anodyne	G2YM83_BOTF4	44	31
NS(=O)(=O)c1ccc(F)c(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)c1	ZINC000819212876	IC	On-Demand	Bother	CA2	23	40
NS(=O)(=O)c1ccc(F)c(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)c1	ZINC000819212876	IC	On-Demand	Bother	SLC6A9	38	43
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1cccnc1	ZINC000819212877	DF	On-Demand	Bother	ADRB2	35	46
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1cccnc1	ZINC000819212877	DF	On-Demand	Bother	ADRB1	50	49
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1cccnc1	ZINC000819212877	DF	On-Demand	Bother	ADRB3	137	56
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1cccnc1	ZINC000819212878	DF	On-Demand	Bother	ADRB2	35	46
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1cccnc1	ZINC000819212878	DF	On-Demand	Bother	ADRB1	50	49
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1cccnc1	ZINC000819212878	DF	On-Demand	Bother	ADRB3	137	56
O=C(Cc1n[nH]c2c1CCCC2)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212879	GD	On-Demand	Bother	PARP1	41	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(Cc3ccc(F)cc3)CC1)C2	ZINC000819212905	GG	On-Demand	Anodyne	GRIN2B	42	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(Cc3ccc(F)cc3)CC1)C2	ZINC000819212905	GG	On-Demand	Anodyne	CCR3	96	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(Cc3ccc(F)cc3)CC1)C2	ZINC000819212905	GG	On-Demand	Anodyne	MLNR	19	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(Cc3ccc(F)cc3)CC1)C2	ZINC000819212907	GG	On-Demand	Anodyne	GRIN2B	42	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(Cc3ccc(F)cc3)CC1)C2	ZINC000819212907	GG	On-Demand	Anodyne	CCR3	96	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(Cc3ccc(F)cc3)CC1)C2	ZINC000819212907	GG	On-Demand	Anodyne	MLNR	19	40
Cc1cc(C)c2cc(C(=O)Nc3cccnc3Cl)sc2n1	ZINC000819212908	DI	On-Demand	Anodyne	EPHB3	41	33
Cc1cc(C)c2cc(C(=O)Nc3cccnc3Cl)sc2n1	ZINC000819212908	DI	On-Demand	Anodyne	G2YM83_BOTF4	78	40
CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)c2coc(=O)c3ccccc23)C1	ZINC000819212920	FF	On-Demand	Anodyne	INHA	50	35
CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)c2coc(=O)c3ccccc23)C1	ZINC000819212920	FF	On-Demand	Anodyne	HTR4	40	38
CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)c2coc(=O)c3ccccc23)C1	ZINC000819212920	FF	On-Demand	Anodyne	ACACB	18	45
CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)c2coc(=O)c3ccccc23)C1	ZINC000819212920	FF	On-Demand	Anodyne	CACNA1I	45	33
CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)c2coc(=O)c3ccccc23)C1	ZINC000819212922	FF	On-Demand	Anodyne	INHA	50	35
CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)c2coc(=O)c3ccccc23)C1	ZINC000819212922	FF	On-Demand	Anodyne	HTR4	40	38
CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)c2coc(=O)c3ccccc23)C1	ZINC000819212922	FF	On-Demand	Anodyne	ACACB	18	45
CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)c2coc(=O)c3ccccc23)C1	ZINC000819212922	FF	On-Demand	Anodyne	CACNA1I	45	33
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(Oc2ccccc2)cc1	ZINC000819212937	EI	On-Demand	Anodyne	KCNQ2	42	36
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(Oc2ccccc2)cc1	ZINC000819212937	EI	On-Demand	Anodyne	ACACA	29	48
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(Oc2ccccc2)cc1	ZINC000819212937	EI	On-Demand	Anodyne	ACACB	28	48
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(Oc2ccccc2)cc1	ZINC000819212938	EI	On-Demand	Anodyne	KCNQ2	42	36
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(Oc2ccccc2)cc1	ZINC000819212938	EI	On-Demand	Anodyne	ACACA	29	48
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(Oc2ccccc2)cc1	ZINC000819212938	EI	On-Demand	Anodyne	ACACB	28	48
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(Oc2ccccc2)cc1	ZINC000819212939	EI	On-Demand	Anodyne	KCNQ2	42	36
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(Oc2ccccc2)cc1	ZINC000819212939	EI	On-Demand	Anodyne	ACACA	29	48
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(Oc2ccccc2)cc1	ZINC000819212939	EI	On-Demand	Anodyne	ACACB	28	48
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(Oc2ccccc2)cc1	ZINC000819212940	EI	On-Demand	Anodyne	KCNQ2	42	36
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(Oc2ccccc2)cc1	ZINC000819212940	EI	On-Demand	Anodyne	ACACA	29	48
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(Oc2ccccc2)cc1	ZINC000819212940	EI	On-Demand	Anodyne	ACACB	28	48
CC#CCCNC[C@@H](O)c1cccnc1	ZINC000819212945	BD	On-Demand	Mild	ADRB2	27	47
CC#CCCNC[C@@H](O)c1cccnc1	ZINC000819212945	BD	On-Demand	Mild	ADRB1	32	47
CC#CCCNC[C@@H](O)c1cccnc1	ZINC000819212945	BD	On-Demand	Mild	ADRB3	108	49
CC#CCCNC[C@H](O)c1cccnc1	ZINC000819212946	BD	On-Demand	Mild	ADRB2	27	47
CC#CCCNC[C@H](O)c1cccnc1	ZINC000819212946	BD	On-Demand	Mild	ADRB1	32	47
CC#CCCNC[C@H](O)c1cccnc1	ZINC000819212946	BD	On-Demand	Mild	ADRB3	108	49
COC(=O)c1cn(CC(=O)Nc2cccnc2Cl)c2ccccc12	ZINC000819212958	EG	On-Demand	Anodyne	CNR1	15	41
COC(=O)c1cn(CC(=O)Nc2cccnc2Cl)c2ccccc12	ZINC000819212958	EG	On-Demand	Anodyne	CNR2	23	43
COC(=O)c1cn(CC(=O)Nc2cccnc2Cl)c2ccccc12	ZINC000819212958	EG	On-Demand	Anodyne	G2YM83_BOTF4	65	33
COC(=O)c1cn(CC(=O)Nc2cccnc2Cl)c2ccccc12	ZINC000819212958	EG	On-Demand	Anodyne	FAS	57	47
O=C(CNC[C@@H](O)c1ccccc1C(F)(F)F)NCC1CC1	ZINC000819212976	DD	On-Demand	Anodyne	RBP4	51	37
O=C(CNC[C@H](O)c1ccccc1C(F)(F)F)NCC1CC1	ZINC000819212977	DD	On-Demand	Anodyne	RBP4	51	37
CS(=O)(=O)Nc1cccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)c1	ZINC000819212984	ID	On-Demand	Bother	AKR1C3	24	44
CS(=O)(=O)Nc1cccc(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)c1	ZINC000819212984	ID	On-Demand	Bother	L3MBTL3	23	42
CCOc1ccccc1C(F)(F)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212990	IG	On-Demand	Bother	HCN1	52	35
CCOc1ccccc1C(F)(F)C(=O)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819212990	IG	On-Demand	Bother	HCN4	43	33
CC(C)(C)OC(=O)N1CC(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819212995	HD	On-Demand	Bother	SSTR1	34	41
CC(C)(C)OC(=O)N1CC(C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819212995	HD	On-Demand	Bother	SFRP1	16	40
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)[C@H]2CC(=O)N(C3CCCC3)C2)CC1	ZINC000819212998	HD	On-Demand	Bother	INHA	20	41
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)[C@H]2CC(=O)N(C3CCCC3)C2)CC1	ZINC000819212998	HD	On-Demand	Bother	L3MBTL3	37	43
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)CC1	ZINC000819212999	HD	On-Demand	Bother	INHA	20	41
O=C(c1ccccc1[N+](=O)[O-])N1CCN(C(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)CC1	ZINC000819212999	HD	On-Demand	Bother	L3MBTL3	37	43
CCOC(=O)N1CCC[C@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819213012	HD	On-Demand	Bother	SLC6A1	63	33
CCOC(=O)N1CCC[C@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819213012	HD	On-Demand	Bother	PREP	52	43
CCOC(=O)N1CCC[C@@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819213013	HD	On-Demand	Bother	SLC6A1	63	33
CCOC(=O)N1CCC[C@@H](C(=O)N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1	ZINC000819213013	HD	On-Demand	Bother	PREP	52	43
O=C(c1ccc(Cl)nc1)N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000819213014	FE	On-Demand	Bother	L3MBTL3	23	43
O=C(c1coc(=O)c2ccccc12)N1CCC(C2OCCO2)CC1	ZINC000819213030	EE	On-Demand	Anodyne	L3MBTL3	36	44
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000819213031	GE	On-Demand	Anodyne	EPHX2	18	41
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000819213031	GE	On-Demand	Anodyne	TGM2	46	39
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000819213031	GE	On-Demand	Anodyne	NAMPT	43	45
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000819213032	GE	On-Demand	Anodyne	EPHX2	18	41
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000819213032	GE	On-Demand	Anodyne	TGM2	46	39
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000819213032	GE	On-Demand	Anodyne	NAMPT	43	45
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000819213033	GE	On-Demand	Anodyne	EPHX2	18	41
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000819213033	GE	On-Demand	Anodyne	TGM2	46	39
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000819213033	GE	On-Demand	Anodyne	NAMPT	43	45
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000819213034	GE	On-Demand	Anodyne	EPHX2	18	41
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000819213034	GE	On-Demand	Anodyne	TGM2	46	39
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000819213034	GE	On-Demand	Anodyne	NAMPT	43	45
CC#CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819213048	BE	On-Demand	Mild	ADRB2	38	40
CC#CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819213048	BE	On-Demand	Mild	ADRB1	50	50
CC#CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819213048	BE	On-Demand	Mild	ADRB3	67	50
CC#CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819213049	BE	On-Demand	Mild	ADRB2	38	40
CC#CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819213049	BE	On-Demand	Mild	ADRB1	50	50
CC#CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819213049	BE	On-Demand	Mild	ADRB3	67	50
O=C(CCc1cccc(OC(F)F)c1)N1CCCC[C@H]1C1OCCO1	ZINC000819213054	FF	On-Demand	Anodyne	CPT1A	79	34
O=C(CCc1cccc(OC(F)F)c1)N1CCCC[C@H]1C1OCCO1	ZINC000819213054	FF	On-Demand	Anodyne	CPT2	43	34
O=C(CCc1cccc(OC(F)F)c1)N1CCCC[C@H]1C1OCCO1	ZINC000819213054	FF	On-Demand	Anodyne	PREP	31	45
O=C(CCc1cccc(OC(F)F)c1)N1CCCC[C@@H]1C1OCCO1	ZINC000819213055	FF	On-Demand	Anodyne	CPT1A	79	34
O=C(CCc1cccc(OC(F)F)c1)N1CCCC[C@@H]1C1OCCO1	ZINC000819213055	FF	On-Demand	Anodyne	CPT2	43	34
O=C(CCc1cccc(OC(F)F)c1)N1CCCC[C@@H]1C1OCCO1	ZINC000819213055	FF	On-Demand	Anodyne	PREP	31	45
CC(=O)N1CCN(c2ccccc2CNC(=O)C(F)=C2CCC2)CC1	ZINC000819213058	EE	On-Demand	Anodyne	HTR7	19	40
CC(=O)N1CCN(c2ccccc2CNC(=O)C(F)=C2CCC2)CC1	ZINC000819213058	EE	On-Demand	Anodyne	KCNQ2	62	36
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)cc1	ZINC000819213076	HF	On-Demand	Mild	EPHX2	34	46
N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)Nc3cccnc3Cl)CC2)cc1	ZINC000819213076	HF	On-Demand	Mild	G2YM83_BOTF4	44	32
CC(C)(C)OC(=O)N1CCC(CNC(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819213113	GE	On-Demand	Anodyne	CACNA1I	67	38
CC(C)(C)OC(=O)N1CCC(CNC(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819213113	GE	On-Demand	Anodyne	GPR119	55	46
Cc1ccccc1[C@@H](O)CNCCc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000819213136	EG	On-Demand	Bother	ADRB3	25	41
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1COC2(CCCCCC2)O1	ZINC000819213140	GE	On-Demand	Anodyne	ADRA1D	30	44
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1COC2(CCCCCC2)O1	ZINC000819213140	GE	On-Demand	Anodyne	ADRA1A	23	47
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1COC2(CCCCCC2)O1	ZINC000819213140	GE	On-Demand	Anodyne	ADRA1B	30	47
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1COC2(CCCCCC2)O1	ZINC000819213142	GE	On-Demand	Anodyne	ADRA1D	30	44
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1COC2(CCCCCC2)O1	ZINC000819213142	GE	On-Demand	Anodyne	ADRA1A	23	47
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1COC2(CCCCCC2)O1	ZINC000819213142	GE	On-Demand	Anodyne	ADRA1B	30	47
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1COC2(CCCCCC2)O1	ZINC000819213145	GE	On-Demand	Anodyne	ADRA1D	30	44
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1COC2(CCCCCC2)O1	ZINC000819213145	GE	On-Demand	Anodyne	ADRA1A	23	47
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1COC2(CCCCCC2)O1	ZINC000819213145	GE	On-Demand	Anodyne	ADRA1B	30	47
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1COC2(CCCCCC2)O1	ZINC000819213148	GE	On-Demand	Anodyne	ADRA1D	30	44
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1COC2(CCCCCC2)O1	ZINC000819213148	GE	On-Demand	Anodyne	ADRA1A	23	47
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1COC2(CCCCCC2)O1	ZINC000819213148	GE	On-Demand	Anodyne	ADRA1B	30	47
NC(=O)C1CCN(CCc2ccc(NC(=O)C(F)=C3CCC3)cc2)CC1	ZINC000819213150	FF	On-Demand	Anodyne	LTA4H	16	44
NC(=O)C1CCN(CCc2ccc(NC(=O)C(F)=C3CCC3)cc2)CC1	ZINC000819213150	FF	On-Demand	Anodyne	CACNA1G	18	40
Cc1cc(F)ccc1[C@@H](O)CNCC(=O)NCC1CC1	ZINC000819213158	CD	On-Demand	Anodyne	CACNA1I	46	34
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819213161	EF	On-Demand	Anodyne	ADRB2	43	34
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819213163	EF	On-Demand	Anodyne	ADRB2	43	34
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819213165	EF	On-Demand	Anodyne	ADRB2	43	34
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819213166	EF	On-Demand	Anodyne	ADRB2	43	34
Cc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213169	EF	On-Demand	Anodyne	ADRB2	29	47
Cc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213169	EF	On-Demand	Anodyne	ADRB1	41	40
Cc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213172	EF	On-Demand	Anodyne	ADRB2	29	47
Cc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213172	EF	On-Demand	Anodyne	ADRB1	41	40
Cc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213174	EF	On-Demand	Anodyne	ADRB2	29	47
Cc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213174	EF	On-Demand	Anodyne	ADRB1	41	40
Cc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213176	EF	On-Demand	Anodyne	ADRB2	29	47
Cc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213176	EF	On-Demand	Anodyne	ADRB1	41	40
O=C(CNC[C@@H](O)c1cccnc1)NCC1CC1	ZINC000819213191	BC	On-Demand	Anodyne	ADRB2	22	42
O=C(CNC[C@@H](O)c1cccnc1)NCC1CC1	ZINC000819213191	BC	On-Demand	Anodyne	ADRB1	27	43
O=C(CNC[C@@H](O)c1cccnc1)NCC1CC1	ZINC000819213191	BC	On-Demand	Anodyne	ADRB3	100	46
O=C(CNC[C@@H](O)c1cccnc1)NCC1CC1	ZINC000819213191	BC	On-Demand	Anodyne	SCD	15	41
O=C(CNC[C@H](O)c1cccnc1)NCC1CC1	ZINC000819213193	BC	On-Demand	Anodyne	ADRB2	22	42
O=C(CNC[C@H](O)c1cccnc1)NCC1CC1	ZINC000819213193	BC	On-Demand	Anodyne	ADRB1	27	43
O=C(CNC[C@H](O)c1cccnc1)NCC1CC1	ZINC000819213193	BC	On-Demand	Anodyne	ADRB3	100	46
O=C(CNC[C@H](O)c1cccnc1)NCC1CC1	ZINC000819213193	BC	On-Demand	Anodyne	SCD	15	41
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccnc1	ZINC000819213228	DE	On-Demand	Anodyne	ADRB1	32	55
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccnc1	ZINC000819213228	DE	On-Demand	Anodyne	ADRB3	89	55
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccnc1	ZINC000819213230	DE	On-Demand	Anodyne	ADRB1	32	55
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccnc1	ZINC000819213230	DE	On-Demand	Anodyne	ADRB3	89	55
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccnc1	ZINC000819213232	DE	On-Demand	Anodyne	ADRB1	32	55
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccnc1	ZINC000819213232	DE	On-Demand	Anodyne	ADRB3	89	55
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccnc1	ZINC000819213233	DE	On-Demand	Anodyne	ADRB1	32	55
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccnc1	ZINC000819213233	DE	On-Demand	Anodyne	ADRB3	89	55
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819213243	FG	On-Demand	Bother	ADRB2	21	40
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819213243	FG	On-Demand	Bother	ADRB1	24	43
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819213243	FG	On-Demand	Bother	ADRB3	35	43
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819213245	FG	On-Demand	Bother	ADRB2	21	40
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819213245	FG	On-Demand	Bother	ADRB1	24	43
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819213245	FG	On-Demand	Bother	ADRB3	35	43
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1ccccc1N1CCCCC1	ZINC000819213247	GG	On-Demand	Anodyne	AVPR2	24	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1ccccc1N1CCCCC1	ZINC000819213247	GG	On-Demand	Anodyne	KCNQ2	75	39
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1ccccc1N1CCCCC1	ZINC000819213247	GG	On-Demand	Anodyne	SCN2A	17	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1ccccc1N1CCCCC1	ZINC000819213247	GG	On-Demand	Anodyne	SCN10A	16	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1ccccc1N1CCCCC1	ZINC000819213249	GG	On-Demand	Anodyne	AVPR2	24	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1ccccc1N1CCCCC1	ZINC000819213249	GG	On-Demand	Anodyne	KCNQ2	75	39
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1ccccc1N1CCCCC1	ZINC000819213249	GG	On-Demand	Anodyne	SCN2A	17	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1ccccc1N1CCCCC1	ZINC000819213249	GG	On-Demand	Anodyne	SCN10A	16	40
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819213253	FH	On-Demand	Bother	ADRB2	59	41
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819213253	FH	On-Demand	Bother	ADRB1	66	55
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819213253	FH	On-Demand	Bother	ADRB3	88	55
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819213255	FH	On-Demand	Bother	ADRB2	59	41
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819213255	FH	On-Demand	Bother	ADRB1	66	55
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819213255	FH	On-Demand	Bother	ADRB3	88	55
NC(=O)[C@@H]1CCCN(Cc2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cc2)C1	ZINC000819213261	FE	On-Demand	Anodyne	SLC6A1	55	34
NC(=O)[C@@H]1CCCN(Cc2ccc(NC(=O)/C=C\[C@H]3CCCO3)cc2)C1	ZINC000819213266	FE	On-Demand	Anodyne	SLC6A1	55	34
NC(=O)[C@@H]1CCCN(Cc2ccc(NC(=O)/C=C/[C@H]3CCCO3)cc2)C1	ZINC000819213267	FE	On-Demand	Anodyne	SLC6A1	55	34
NC(=O)[C@@H]1CCCN(Cc2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cc2)C1	ZINC000819213269	FE	On-Demand	Anodyne	SLC6A1	55	34
COCCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213289	GF	On-Demand	Anodyne	ADRB2	33	53
COCCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213289	GF	On-Demand	Anodyne	ADRB1	63	53
COCCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213289	GF	On-Demand	Anodyne	ADRB3	40	42
C[C@@](O)(CNCC(=O)NCC1CC1)c1ccc(Br)cc1Cl	ZINC000819213290	GE	On-Demand	Anodyne	CACNA1I	68	40
COCCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213291	GF	On-Demand	Anodyne	ADRB2	33	53
COCCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213291	GF	On-Demand	Anodyne	ADRB1	63	53
COCCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213291	GF	On-Demand	Anodyne	ADRB3	40	42
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213293	GF	On-Demand	Anodyne	ADRB2	33	53
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213293	GF	On-Demand	Anodyne	ADRB1	63	53
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213293	GF	On-Demand	Anodyne	ADRB3	40	42
COCCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213295	GF	On-Demand	Anodyne	ADRB2	33	53
COCCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213295	GF	On-Demand	Anodyne	ADRB1	63	53
COCCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213295	GF	On-Demand	Anodyne	ADRB3	40	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(-c3nn[nH]n3)cc1)C2	ZINC000819213322	FD	On-Demand	Anodyne	MTOR	42	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(-c3nn[nH]n3)cc1)C2	ZINC000819213323	FD	On-Demand	Anodyne	MTOR	42	35
O=C(NC1CCN(Cc2coc(-c3ccccc3)n2)CC1)C(F)=C1CCC1	ZINC000819213347	FH	On-Demand	Anodyne	DRD4	16	55
O=C(NC1CCN(Cc2coc(-c3ccccc3)n2)CC1)C(F)=C1CCC1	ZINC000819213347	FH	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(Cc2coc(-c3ccccc3)n2)CC1)C(F)=C1CCC1	ZINC000819213347	FH	On-Demand	Anodyne	PDE8B	50	31
CC(=O)c1ccc(C(=O)Nc2cccnc2Cl)s1	ZINC000819213354	CG	On-Demand	Anodyne	G2YM83_BOTF4	82	43
CN(C1CCCCC1)S(=O)(=O)c1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819213362	HH	On-Demand	Anodyne	G2YM83_BOTF4	76	42
CCN(Cc1c(F)cccc1F)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819213367	GH	On-Demand	Mild	PAPA1_CARPA	48	48
CCN(Cc1c(F)cccc1F)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819213368	GH	On-Demand	Mild	PAPA1_CARPA	48	48
COc1cccc([S@](=O)CC(=O)N2CCCC[C@H]2C2OCCO2)c1	ZINC000819213375	FD	On-Demand	Anodyne	FKBP1A	28	40
COc1cccc([S@](=O)CC(=O)N2CCCC[C@H]2C2OCCO2)c1	ZINC000819213375	FD	On-Demand	Anodyne	CPT1A	82	36
COc1cccc([S@](=O)CC(=O)N2CCCC[C@H]2C2OCCO2)c1	ZINC000819213375	FD	On-Demand	Anodyne	CPT2	40	33
COc1cccc([S@@](=O)CC(=O)N2CCCC[C@@H]2C2OCCO2)c1	ZINC000819213376	FD	On-Demand	Anodyne	FKBP1A	28	40
COc1cccc([S@@](=O)CC(=O)N2CCCC[C@@H]2C2OCCO2)c1	ZINC000819213376	FD	On-Demand	Anodyne	CPT1A	82	36
COc1cccc([S@@](=O)CC(=O)N2CCCC[C@@H]2C2OCCO2)c1	ZINC000819213376	FD	On-Demand	Anodyne	CPT2	40	33
COc1cccc([S@@](=O)CC(=O)N2CCCC[C@H]2C2OCCO2)c1	ZINC000819213377	FD	On-Demand	Anodyne	FKBP1A	28	40
COc1cccc([S@@](=O)CC(=O)N2CCCC[C@H]2C2OCCO2)c1	ZINC000819213377	FD	On-Demand	Anodyne	CPT1A	82	36
COc1cccc([S@@](=O)CC(=O)N2CCCC[C@H]2C2OCCO2)c1	ZINC000819213377	FD	On-Demand	Anodyne	CPT2	40	33
COc1cccc([S@](=O)CC(=O)N2CCCC[C@@H]2C2OCCO2)c1	ZINC000819213378	FD	On-Demand	Anodyne	FKBP1A	28	40
COc1cccc([S@](=O)CC(=O)N2CCCC[C@@H]2C2OCCO2)c1	ZINC000819213378	FD	On-Demand	Anodyne	CPT1A	82	36
COc1cccc([S@](=O)CC(=O)N2CCCC[C@@H]2C2OCCO2)c1	ZINC000819213378	FD	On-Demand	Anodyne	CPT2	40	33
O=C(NCc1cccc(S(=O)(=O)N2CCCCC2)c1)C(F)=C1CCC1	ZINC000819213390	FF	On-Demand	Anodyne	AKR1C3	54	38
O=C(NCc1cccc(S(=O)(=O)N2CCCCC2)c1)C(F)=C1CCC1	ZINC000819213390	FF	On-Demand	Anodyne	NAMPT	50	52
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000819213397	GG	On-Demand	Anodyne	DRD4	15	49
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000819213398	GG	On-Demand	Anodyne	DRD4	15	49
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000819213399	GG	On-Demand	Anodyne	DRD4	15	49
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000819213400	GG	On-Demand	Anodyne	DRD4	15	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(=O)NCC2CC2)CC1	ZINC000819213436	FD	On-Demand	Anodyne	GPR119	31	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(=O)NCC2CC2)CC1	ZINC000819213437	FD	On-Demand	Anodyne	GPR119	31	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1(c3ccc(OC)cc3)CCCC1)C2	ZINC000819213457	GG	On-Demand	Anodyne	NPBWR1	54	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1(c3ccc(OC)cc3)CCCC1)C2	ZINC000819213458	GG	On-Demand	Anodyne	NPBWR1	54	31
CCOc1ccc(OC(C)(C)C(=O)Nc2cccnc2Cl)cc1	ZINC000819213460	EH	On-Demand	Anodyne	G2YM83_BOTF4	69	36
O=C(/C=C/[C@@H]1CCCO1)N1CCC(Cc2ccc(F)cc2)CC1	ZINC000819213485	DG	On-Demand	Anodyne	GRIN2B	50	46
O=C(/C=C/[C@@H]1CCCO1)N1CCC(Cc2ccc(F)cc2)CC1	ZINC000819213485	DG	On-Demand	Anodyne	CCR3	89	37
O=C(/C=C\[C@H]1CCCO1)N1CCC(Cc2ccc(F)cc2)CC1	ZINC000819213487	DG	On-Demand	Anodyne	GRIN2B	50	46
O=C(/C=C\[C@H]1CCCO1)N1CCC(Cc2ccc(F)cc2)CC1	ZINC000819213487	DG	On-Demand	Anodyne	CCR3	89	37
O=C(/C=C/[C@H]1CCCO1)N1CCC(Cc2ccc(F)cc2)CC1	ZINC000819213488	DG	On-Demand	Anodyne	GRIN2B	50	46
O=C(/C=C/[C@H]1CCCO1)N1CCC(Cc2ccc(F)cc2)CC1	ZINC000819213488	DG	On-Demand	Anodyne	CCR3	89	37
O=C(/C=C\[C@@H]1CCCO1)N1CCC(Cc2ccc(F)cc2)CC1	ZINC000819213490	DG	On-Demand	Anodyne	GRIN2B	50	46
O=C(/C=C\[C@@H]1CCCO1)N1CCC(Cc2ccc(F)cc2)CC1	ZINC000819213490	DG	On-Demand	Anodyne	CCR3	89	37
CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)C(F)=C2CCC2)C1	ZINC000819213520	DF	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)C(F)=C2CCC2)C1	ZINC000819213522	DF	On-Demand	Anodyne	CACNA1I	46	34
O=C(CNC[C@@H](O)c1cccc(Cl)c1)NCC1CC1	ZINC000819213530	CD	On-Demand	Anodyne	ADRB2	35	43
O=C(CNC[C@@H](O)c1cccc(Cl)c1)NCC1CC1	ZINC000819213530	CD	On-Demand	Anodyne	ADRB1	53	47
O=C(CNC[C@@H](O)c1cccc(Cl)c1)NCC1CC1	ZINC000819213530	CD	On-Demand	Anodyne	ADRB3	67	47
O=C(CNC[C@@H](O)c1cccc(Cl)c1)NCC1CC1	ZINC000819213530	CD	On-Demand	Anodyne	CYP3A4	46	34
O=C(CNC[C@@H](O)c1cccc(Cl)c1)NCC1CC1	ZINC000819213530	CD	On-Demand	Anodyne	CACNA1I	57	42
O=C(CNC[C@H](O)c1cccc(Cl)c1)NCC1CC1	ZINC000819213532	CD	On-Demand	Anodyne	ADRB2	35	43
O=C(CNC[C@H](O)c1cccc(Cl)c1)NCC1CC1	ZINC000819213532	CD	On-Demand	Anodyne	ADRB1	53	47
O=C(CNC[C@H](O)c1cccc(Cl)c1)NCC1CC1	ZINC000819213532	CD	On-Demand	Anodyne	ADRB3	67	47
O=C(CNC[C@H](O)c1cccc(Cl)c1)NCC1CC1	ZINC000819213532	CD	On-Demand	Anodyne	CYP3A4	46	34
O=C(CNC[C@H](O)c1cccc(Cl)c1)NCC1CC1	ZINC000819213532	CD	On-Demand	Anodyne	CACNA1I	57	42
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819213559	GI	On-Demand	Bother	ADRB3	25	41
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819213561	GI	On-Demand	Bother	ADRB3	25	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](c3ccccc3C)C1)C2	ZINC000819213563	FG	On-Demand	Anodyne	ADAM10	28	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3ccccc3C)C1)C2	ZINC000819213565	FG	On-Demand	Anodyne	ADAM10	28	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3ccccc3C)C1)C2	ZINC000819213567	FG	On-Demand	Anodyne	ADAM10	28	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](c3ccccc3C)C1)C2	ZINC000819213570	FG	On-Demand	Anodyne	ADAM10	28	41
O[C@H](CNC[C@H]1COC2(CCCCCC2)O1)COc1ccccc1F	ZINC000819213576	FF	On-Demand	Anodyne	ADRA1B	15	41
O[C@@H](CNC[C@H]1COC2(CCCCCC2)O1)COc1ccccc1F	ZINC000819213577	FF	On-Demand	Anodyne	ADRA1B	15	41
O[C@H](CNC[C@@H]1COC2(CCCCCC2)O1)COc1ccccc1F	ZINC000819213578	FF	On-Demand	Anodyne	ADRA1B	15	41
O[C@@H](CNC[C@@H]1COC2(CCCCCC2)O1)COc1ccccc1F	ZINC000819213579	FF	On-Demand	Anodyne	ADRA1B	15	41
O=C(C(F)=C1CCC1)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000819213580	FH	On-Demand	Anodyne	GRM5	19	71
O=C(C(F)=C1CCC1)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000819213580	FH	On-Demand	Anodyne	ETHR	58	41
O=C(C(F)=C1CCC1)N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000819213581	FH	On-Demand	Anodyne	GRM5	19	71
O=C(C(F)=C1CCC1)N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000819213581	FH	On-Demand	Anodyne	ETHR	58	41
O[C@H](CN[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1c(F)cccc1F	ZINC000819213582	FH	On-Demand	Anodyne	ADRB3	15	42
O[C@@H](CN[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1c(F)cccc1F	ZINC000819213583	FH	On-Demand	Anodyne	ADRB3	15	42
O[C@@H](CN[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1c(F)cccc1F	ZINC000819213584	FH	On-Demand	Anodyne	ADRB3	15	42
O[C@H](CN[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1c(F)cccc1F	ZINC000819213585	FH	On-Demand	Anodyne	ADRB3	15	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000819213594	FG	On-Demand	Bother	ADRB1	38	48
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000819213594	FG	On-Demand	Bother	ADRB3	59	48
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000819213595	FG	On-Demand	Bother	ADRB1	38	48
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000819213595	FG	On-Demand	Bother	ADRB3	59	48
C[C@@H](CC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)n1cccn1	ZINC000819213598	FF	On-Demand	Anodyne	CACNA1I	42	34
C[C@@H](CC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)n1cccn1	ZINC000819213598	FF	On-Demand	Anodyne	GPR119	38	43
C[C@H](CC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)n1cccn1	ZINC000819213599	FF	On-Demand	Anodyne	CACNA1I	42	34
C[C@H](CC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)n1cccn1	ZINC000819213599	FF	On-Demand	Anodyne	GPR119	38	43
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@@H]1CCCCO1	ZINC000819213600	CF	On-Demand	Anodyne	ADRB2	15	44
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@@H]1CCCCO1	ZINC000819213600	CF	On-Demand	Anodyne	ADRB1	33	46
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@@H]1CCCCO1	ZINC000819213600	CF	On-Demand	Anodyne	ADRB3	47	46
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@H]1CCCCO1	ZINC000819213603	CF	On-Demand	Anodyne	ADRB2	15	44
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@H]1CCCCO1	ZINC000819213603	CF	On-Demand	Anodyne	ADRB1	33	46
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@H]1CCCCO1	ZINC000819213603	CF	On-Demand	Anodyne	ADRB3	47	46
C=C(C)C(C)(C)C(=O)N1CC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000819213608	DF	On-Demand	Mild	CACNA1I	43	34
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000819213609	DF	On-Demand	Mild	CACNA1I	43	34
O[C@@H](CNCc1ccccc1N1CCCCC1)c1ccc(F)cc1F	ZINC000819213611	EH	On-Demand	Anodyne	KCNQ2	72	42
O[C@H](CNCc1ccccc1N1CCCCC1)c1ccc(F)cc1F	ZINC000819213612	EH	On-Demand	Anodyne	KCNQ2	72	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)Cc2nsc3ccccc23)CC1	ZINC000819213613	GH	On-Demand	Anodyne	DRD2	17	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)Cc2nsc3ccccc23)CC1	ZINC000819213613	GH	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)Cc2nsc3ccccc23)CC1	ZINC000819213613	GH	On-Demand	Anodyne	CACNA1I	59	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)Cc2nsc3ccccc23)CC1	ZINC000819213613	GH	On-Demand	Anodyne	CCR8	25	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)Cc2nsc3ccccc23)CC1	ZINC000819213613	GH	On-Demand	Anodyne	GPR119	48	46
O[C@H](CNCc1ccccc1N1CCCCC1)c1cc2ccccc2o1	ZINC000819213614	FI	On-Demand	Anodyne	KCNQ2	61	35
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCCC[C@H]1C1OCCO1	ZINC000819213616	ED	On-Demand	Anodyne	OPRK1	21	46
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCCC[C@H]1C1OCCO1	ZINC000819213616	ED	On-Demand	Anodyne	KCNJ1	42	37
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCCC[C@@H]1C1OCCO1	ZINC000819213617	ED	On-Demand	Anodyne	OPRK1	21	46
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCCC[C@@H]1C1OCCO1	ZINC000819213617	ED	On-Demand	Anodyne	KCNJ1	42	37
O[C@@H](CNCC1(Cc2ccccc2)CCCC1)c1cccnc1	ZINC000819213619	DH	On-Demand	Anodyne	ADRB2	23	46
O[C@@H](CNCC1(Cc2ccccc2)CCCC1)c1cccnc1	ZINC000819213619	DH	On-Demand	Anodyne	ADRB1	23	42
O[C@@H](CNCC1(Cc2ccccc2)CCCC1)c1cccnc1	ZINC000819213619	DH	On-Demand	Anodyne	ADRB3	93	48
O[C@H](CNCC1(Cc2ccccc2)CCCC1)c1cccnc1	ZINC000819213620	DH	On-Demand	Anodyne	ADRB2	23	46
O[C@H](CNCC1(Cc2ccccc2)CCCC1)c1cccnc1	ZINC000819213620	DH	On-Demand	Anodyne	ADRB1	23	42
O[C@H](CNCC1(Cc2ccccc2)CCCC1)c1cccnc1	ZINC000819213620	DH	On-Demand	Anodyne	ADRB3	93	48
CN(CCC1CCCCC1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819213640	FI	On-Demand	Mild	PAPA1_CARPA	31	41
CN(CCC1CCCCC1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819213640	FI	On-Demand	Mild	CTSK	15	49
CN(CCC1CCCCC1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819213640	FI	On-Demand	Mild	REN	36	40
CN(CCC1CCCCC1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819213641	FI	On-Demand	Mild	PAPA1_CARPA	31	41
CN(CCC1CCCCC1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819213641	FI	On-Demand	Mild	CTSK	15	49
CN(CCC1CCCCC1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819213641	FI	On-Demand	Mild	REN	36	40
O=C(Cc1nsc2ccccc12)N1CCCC[C@H]1C1OCCO1	ZINC000819213662	EF	On-Demand	Anodyne	PREP	16	42
O=C(Cc1nsc2ccccc12)N1CCCC[C@@H]1C1OCCO1	ZINC000819213663	EF	On-Demand	Anodyne	PREP	16	42
O=C(CNC[C@@H](O)c1ccc(Cl)cc1Cl)NCC1CC1	ZINC000819213681	DE	On-Demand	Anodyne	CACNA1I	63	40
O=C(CNC[C@H](O)c1ccc(Cl)cc1Cl)NCC1CC1	ZINC000819213683	DE	On-Demand	Anodyne	CACNA1I	63	40
CCn1c(=O)c2ccccc2n(CC(=O)Nc2cccnc2Cl)c1=O	ZINC000819213684	FD	On-Demand	Anodyne	G2YM83_BOTF4	64	33
CC(=O)Nc1cccc(CC(=O)N2CCCC[C@H]2C2OCCO2)c1	ZINC000819213703	ED	On-Demand	Anodyne	OPRK1	29	48
CC(=O)Nc1cccc(CC(=O)N2CCCC[C@H]2C2OCCO2)c1	ZINC000819213703	ED	On-Demand	Anodyne	CPT1A	23	43
CC(=O)Nc1cccc(CC(=O)N2CCCC[C@@H]2C2OCCO2)c1	ZINC000819213705	ED	On-Demand	Anodyne	OPRK1	29	48
CC(=O)Nc1cccc(CC(=O)N2CCCC[C@@H]2C2OCCO2)c1	ZINC000819213705	ED	On-Demand	Anodyne	CPT1A	23	43
Cc1ccccc1[C@@H](O)CNCC(=O)NCC1CC1	ZINC000819213721	CD	On-Demand	Anodyne	HTR4	42	37
Cc1ccccc1[C@@H](O)CNCC(=O)NCC1CC1	ZINC000819213721	CD	On-Demand	Anodyne	CACNA1I	46	35
O=C(/C=C\[C@H]1CCCO1)NCCC(=O)Nc1cccnc1	ZINC000819213759	CD	On-Demand	Anodyne	NAMPT	19	40
O=C(/C=C/[C@@H]1CCCO1)NCCC(=O)Nc1cccnc1	ZINC000819213760	CD	On-Demand	Anodyne	NAMPT	19	40
O=C(/C=C\[C@@H]1CCCO1)NCCC(=O)Nc1cccnc1	ZINC000819213761	CD	On-Demand	Anodyne	NAMPT	19	40
O=C(/C=C/[C@H]1CCCO1)NCCC(=O)Nc1cccnc1	ZINC000819213762	CD	On-Demand	Anodyne	NAMPT	19	40
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(Br)c1	ZINC000819213789	GG	On-Demand	Anodyne	ADRB2	43	35
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(Br)c1	ZINC000819213789	GG	On-Demand	Anodyne	ADRB1	31	41
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(Br)c1	ZINC000819213789	GG	On-Demand	Anodyne	ADRB3	49	41
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(Br)c1	ZINC000819213789	GG	On-Demand	Anodyne	PAPA1_CARPA	20	42
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(Br)c1	ZINC000819213790	GG	On-Demand	Anodyne	ADRB2	43	35
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(Br)c1	ZINC000819213790	GG	On-Demand	Anodyne	ADRB1	31	41
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(Br)c1	ZINC000819213790	GG	On-Demand	Anodyne	ADRB3	49	41
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(Br)c1	ZINC000819213790	GG	On-Demand	Anodyne	PAPA1_CARPA	20	42
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(Br)c1	ZINC000819213791	GG	On-Demand	Anodyne	ADRB2	43	35
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(Br)c1	ZINC000819213791	GG	On-Demand	Anodyne	ADRB1	31	41
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(Br)c1	ZINC000819213791	GG	On-Demand	Anodyne	ADRB3	49	41
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(Br)c1	ZINC000819213791	GG	On-Demand	Anodyne	PAPA1_CARPA	20	42
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(Br)c1	ZINC000819213792	GG	On-Demand	Anodyne	ADRB2	43	35
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(Br)c1	ZINC000819213792	GG	On-Demand	Anodyne	ADRB1	31	41
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(Br)c1	ZINC000819213792	GG	On-Demand	Anodyne	ADRB3	49	41
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(Br)c1	ZINC000819213792	GG	On-Demand	Anodyne	PAPA1_CARPA	20	42
O=C(CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)NCC1CC1	ZINC000819213801	CC	On-Demand	Bother	CACNA1C	49	39
O=C(CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)NCC1CC1	ZINC000819213801	CC	On-Demand	Bother	CACNA1D	75	38
O=C(CNC[C@H](O)c1cccc([N+](=O)[O-])c1)NCC1CC1	ZINC000819213802	CC	On-Demand	Bother	CACNA1C	49	39
O=C(CNC[C@H](O)c1cccc([N+](=O)[O-])c1)NCC1CC1	ZINC000819213802	CC	On-Demand	Bother	CACNA1D	75	38
CC(C)(C)OC(=O)N1CCC(CNC(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819213815	GG	On-Demand	Anodyne	HTR4	64	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819213815	GG	On-Demand	Anodyne	ACACB	17	44
CC(C)(C)OC(=O)N1CCC(CNC(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819213815	GG	On-Demand	Anodyne	CACNA1I	61	37
CC(C)(C)OC(=O)N1CCC(CNC(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819213815	GG	On-Demand	Anodyne	CCR8	68	37
CC(C)(C)OC(=O)N1CCC(CNC(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819213815	GG	On-Demand	Anodyne	GPR119	45	43
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819213818	FH	On-Demand	Bother	ADRB1	20	42
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819213818	FH	On-Demand	Bother	ADRB3	26	42
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819213819	FH	On-Demand	Bother	ADRB1	20	42
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819213819	FH	On-Demand	Bother	ADRB3	26	42
O[C@H](CNC[C@H]1COC2(CCCCCC2)O1)COc1ccccc1	ZINC000819213824	EE	On-Demand	Anodyne	ADRB2	39	47
O[C@H](CNC[C@H]1COC2(CCCCCC2)O1)COc1ccccc1	ZINC000819213824	EE	On-Demand	Anodyne	ADRB1	58	41
O[C@H](CNC[C@H]1COC2(CCCCCC2)O1)COc1ccccc1	ZINC000819213824	EE	On-Demand	Anodyne	ADRB3	36	41
O[C@@H](CNC[C@@H]1COC2(CCCCCC2)O1)COc1ccccc1	ZINC000819213825	EE	On-Demand	Anodyne	ADRB2	39	47
O[C@@H](CNC[C@@H]1COC2(CCCCCC2)O1)COc1ccccc1	ZINC000819213825	EE	On-Demand	Anodyne	ADRB1	58	41
O[C@@H](CNC[C@@H]1COC2(CCCCCC2)O1)COc1ccccc1	ZINC000819213825	EE	On-Demand	Anodyne	ADRB3	36	41
O[C@H](CNC[C@@H]1COC2(CCCCCC2)O1)COc1ccccc1	ZINC000819213826	EE	On-Demand	Anodyne	ADRB2	39	47
O[C@H](CNC[C@@H]1COC2(CCCCCC2)O1)COc1ccccc1	ZINC000819213826	EE	On-Demand	Anodyne	ADRB1	58	41
O[C@H](CNC[C@@H]1COC2(CCCCCC2)O1)COc1ccccc1	ZINC000819213826	EE	On-Demand	Anodyne	ADRB3	36	41
O[C@@H](CNC[C@H]1COC2(CCCCCC2)O1)COc1ccccc1	ZINC000819213827	EE	On-Demand	Anodyne	ADRB2	39	47
O[C@@H](CNC[C@H]1COC2(CCCCCC2)O1)COc1ccccc1	ZINC000819213827	EE	On-Demand	Anodyne	ADRB1	58	41
O[C@@H](CNC[C@H]1COC2(CCCCCC2)O1)COc1ccccc1	ZINC000819213827	EE	On-Demand	Anodyne	ADRB3	36	41
CN(C[C@H](O)CNCc1ccccc1N1CCCCC1)C(=O)OC(C)(C)C	ZINC000819213828	GF	On-Demand	Anodyne	KCNQ2	69	37
CN(C[C@@H](O)CNCc1ccccc1N1CCCCC1)C(=O)OC(C)(C)C	ZINC000819213829	GF	On-Demand	Anodyne	KCNQ2	69	37
CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)Cc2nsc3ccccc23)C1	ZINC000819213832	GG	On-Demand	Anodyne	DRD2	15	43
CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)Cc2nsc3ccccc23)C1	ZINC000819213832	GG	On-Demand	Anodyne	ACACB	17	46
CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)Cc2nsc3ccccc23)C1	ZINC000819213833	GG	On-Demand	Anodyne	DRD2	15	43
CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)Cc2nsc3ccccc23)C1	ZINC000819213833	GG	On-Demand	Anodyne	ACACB	17	46
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000819213834	FG	On-Demand	Anodyne	GRM5	24	58
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000819213834	FG	On-Demand	Anodyne	ETHR	61	54
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000819213835	FG	On-Demand	Anodyne	GRM5	24	58
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000819213835	FG	On-Demand	Anodyne	ETHR	61	54
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000819213836	FG	On-Demand	Anodyne	GRM5	24	58
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000819213836	FG	On-Demand	Anodyne	ETHR	61	54
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000819213837	FG	On-Demand	Anodyne	GRM5	24	58
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1	ZINC000819213837	FG	On-Demand	Anodyne	ETHR	61	54
O=C(/C=C\[C@@H]1CCCO1)Nc1ncc(Cc2cccc(Br)c2)s1	ZINC000819213838	GI	On-Demand	Anodyne	SCD	32	44
O=C(/C=C\[C@H]1CCCO1)Nc1ncc(Cc2cccc(Br)c2)s1	ZINC000819213839	GI	On-Demand	Anodyne	SCD	32	44
O=C(/C=C/[C@H]1CCCO1)Nc1ncc(Cc2cccc(Br)c2)s1	ZINC000819213840	GI	On-Demand	Anodyne	SCD	32	44
O=C(/C=C/[C@@H]1CCCO1)Nc1ncc(Cc2cccc(Br)c2)s1	ZINC000819213841	GI	On-Demand	Anodyne	SCD	32	44
CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819213846	FD	On-Demand	Anodyne	ACACB	15	43
CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819213846	FD	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819213847	FD	On-Demand	Anodyne	ACACB	15	43
CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819213847	FD	On-Demand	Anodyne	CACNA1I	46	34
O[C@H](CN[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1ccc(F)cc1	ZINC000819213849	FH	On-Demand	Anodyne	ADRB3	22	41
O[C@@H](CN[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1ccc(F)cc1	ZINC000819213850	FH	On-Demand	Anodyne	ADRB3	22	41
O[C@@H](CN[C@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1ccc(F)cc1	ZINC000819213851	FH	On-Demand	Anodyne	ADRB3	22	41
O[C@H](CN[C@@H]1CCN(c2ccc(F)c(Cl)c2)C1)c1ccc(F)cc1	ZINC000819213852	FH	On-Demand	Anodyne	ADRB3	22	41
CN1CCC(CNC(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819213857	CD	On-Demand	Anodyne	CACNA1I	46	33
CN1CCC(CNC(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819213858	CD	On-Demand	Anodyne	CACNA1I	46	33
CN1CCC(CNC(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819213859	CD	On-Demand	Anodyne	CACNA1I	46	33
CN1CCC(CNC(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819213860	CD	On-Demand	Anodyne	CACNA1I	46	33
O[C@H](CNC[C@H]1COC2(CCCCCC2)O1)COc1ccc(F)cc1	ZINC000819213863	FF	On-Demand	Anodyne	ADRB1	40	40
O[C@@H](CNC[C@@H]1COC2(CCCCCC2)O1)COc1ccc(F)cc1	ZINC000819213864	FF	On-Demand	Anodyne	ADRB1	40	40
O[C@H](CNC[C@@H]1COC2(CCCCCC2)O1)COc1ccc(F)cc1	ZINC000819213865	FF	On-Demand	Anodyne	ADRB1	40	40
O[C@@H](CNC[C@H]1COC2(CCCCCC2)O1)COc1ccc(F)cc1	ZINC000819213866	FF	On-Demand	Anodyne	ADRB1	40	40
Cc1cc(F)ccc1[C@@H](O)CNC1CCN(S(=O)(=O)CC(C)C)CC1	ZINC000819213873	FE	On-Demand	Anodyne	ADAMTS4	43	34
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213880	GE	On-Demand	Anodyne	ADRB2	39	53
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213880	GE	On-Demand	Anodyne	ADRB1	75	53
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213880	GE	On-Demand	Anodyne	ADRB3	48	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213881	GE	On-Demand	Anodyne	ADRB2	39	53
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213881	GE	On-Demand	Anodyne	ADRB1	75	53
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213881	GE	On-Demand	Anodyne	ADRB3	48	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213882	GE	On-Demand	Anodyne	ADRB2	39	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213882	GE	On-Demand	Anodyne	ADRB1	75	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213882	GE	On-Demand	Anodyne	ADRB3	48	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213883	GE	On-Demand	Anodyne	ADRB2	39	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213883	GE	On-Demand	Anodyne	ADRB1	75	53
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819213883	GE	On-Demand	Anodyne	ADRB3	48	48
CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819213884	GH	On-Demand	Anodyne	GRIN2B	18	41
CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819213884	GH	On-Demand	Anodyne	CACNA1I	55	36
CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819213885	GH	On-Demand	Anodyne	GRIN2B	18	41
CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819213885	GH	On-Demand	Anodyne	CACNA1I	55	36
CN1CCC(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819213891	FE	On-Demand	Mild	PAPA1_CARPA	44	55
CN1CCC(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819213891	FE	On-Demand	Mild	CTSK	15	49
CN1CCC(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819213892	FE	On-Demand	Mild	PAPA1_CARPA	44	55
CN1CCC(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819213892	FE	On-Demand	Mild	CTSK	15	49
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccc(Br)cc1	ZINC000819213909	GH	On-Demand	Bother	ADRB2	16	45
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccc(Br)cc1	ZINC000819213909	GH	On-Demand	Bother	ADRB1	22	40
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccc(Br)cc1	ZINC000819213909	GH	On-Demand	Bother	ADRB3	28	40
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccc(Br)cc1	ZINC000819213910	GH	On-Demand	Bother	ADRB2	16	45
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccc(Br)cc1	ZINC000819213910	GH	On-Demand	Bother	ADRB1	22	40
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccc(Br)cc1	ZINC000819213910	GH	On-Demand	Bother	ADRB3	28	40
O=C(CNC[C@H](O)c1cccc2ccccc12)NCC1CC1	ZINC000819213971	CD	On-Demand	Anodyne	HTR4	50	38
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1ccccc1Br	ZINC000819213977	GG	On-Demand	Anodyne	PAPA1_CARPA	28	43
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccccc1Br	ZINC000819213980	GG	On-Demand	Anodyne	PAPA1_CARPA	28	43
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccccc1Br	ZINC000819213982	GG	On-Demand	Anodyne	PAPA1_CARPA	28	43
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1ccccc1Br	ZINC000819213984	GG	On-Demand	Anodyne	PAPA1_CARPA	28	43
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])cc1	ZINC000819214026	FG	On-Demand	Bother	ADRB2	17	41
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])cc1	ZINC000819214026	FG	On-Demand	Bother	ADRB1	25	40
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])cc1	ZINC000819214026	FG	On-Demand	Bother	ADRB3	35	40
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])cc1	ZINC000819214028	FG	On-Demand	Bother	ADRB2	17	41
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])cc1	ZINC000819214028	FG	On-Demand	Bother	ADRB1	25	40
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccc(Cl)cc2[N+](=O)[O-])cc1	ZINC000819214028	FG	On-Demand	Bother	ADRB3	35	40
CCC(CC)[C@@H]1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819214032	EH	On-Demand	Anodyne	ADRB1	28	41
CCC(CC)[C@@H]1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819214032	EH	On-Demand	Anodyne	ADRB3	45	45
CCC(CC)[C@@H]1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819214032	EH	On-Demand	Anodyne	CYP3A4	41	34
CCC(CC)[C@@H]1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819214034	EH	On-Demand	Anodyne	ADRB1	28	41
CCC(CC)[C@@H]1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819214034	EH	On-Demand	Anodyne	ADRB3	45	45
CCC(CC)[C@@H]1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819214034	EH	On-Demand	Anodyne	CYP3A4	41	34
CCC(CC)[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819214037	EH	On-Demand	Anodyne	ADRB1	28	41
CCC(CC)[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819214037	EH	On-Demand	Anodyne	ADRB3	45	45
CCC(CC)[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819214037	EH	On-Demand	Anodyne	CYP3A4	41	34
CCC(CC)[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819214039	EH	On-Demand	Anodyne	ADRB1	28	41
CCC(CC)[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819214039	EH	On-Demand	Anodyne	ADRB3	45	45
CCC(CC)[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819214039	EH	On-Demand	Anodyne	CYP3A4	41	34
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccc(Br)cc2)CC1	ZINC000819214075	GE	On-Demand	Anodyne	L3MBTL3	77	42
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(Br)cc2)CC1	ZINC000819214078	GE	On-Demand	Anodyne	L3MBTL3	77	42
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(Br)cc2)CC1	ZINC000819214080	GE	On-Demand	Anodyne	L3MBTL3	77	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccc(Br)cc2)CC1	ZINC000819214082	GE	On-Demand	Anodyne	L3MBTL3	77	42
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CC=C(c3ccc(F)cc3)CC2)c1	ZINC000819214094	FH	On-Demand	Bother	ADRB3	21	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CC=C(c3ccc(F)cc3)CC2)c1	ZINC000819214096	FH	On-Demand	Bother	ADRB3	21	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CC=C(c3ccc(F)cc3)CC2)c1	ZINC000819214098	FH	On-Demand	Bother	ADRB3	21	41
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CC=C(c3ccc(F)cc3)CC2)c1	ZINC000819214100	FH	On-Demand	Bother	ADRB3	21	41
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccccc1	ZINC000819214102	DG	On-Demand	Bother	ADRB2	36	44
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccccc1	ZINC000819214102	DG	On-Demand	Bother	ADRB1	51	48
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@H](O)c1ccccc1	ZINC000819214102	DG	On-Demand	Bother	ADRB3	86	48
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccccc1	ZINC000819214104	DG	On-Demand	Bother	ADRB2	36	44
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccccc1	ZINC000819214104	DG	On-Demand	Bother	ADRB1	51	48
O=[N+]([O-])c1cc(Cl)ccc1CCNC[C@@H](O)c1ccccc1	ZINC000819214104	DG	On-Demand	Bother	ADRB3	86	48
N#CCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819214109	FF	On-Demand	Mild	ADRB1	41	37
N#CCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819214115	FF	On-Demand	Mild	ADRB1	41	37
N#CCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCCCCC3)O2)cc1	ZINC000819214117	FF	On-Demand	Mild	ADRB1	41	37
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCCCCC3)O2)cc1	ZINC000819214119	FF	On-Demand	Mild	ADRB1	41	37
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819214129	GF	On-Demand	Anodyne	CACNA1I	54	43
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819214129	GF	On-Demand	Anodyne	GPR119	42	50
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819214130	GF	On-Demand	Anodyne	CACNA1I	54	43
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819214130	GF	On-Demand	Anodyne	GPR119	42	50
C[C@@](O)(CNCC(=O)NCC1CC1)c1ccc(Br)cc1F	ZINC000819214133	FD	On-Demand	Anodyne	CACNA1I	48	37
C[C@@H]1CCCC[C@H]1C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819214136	EH	On-Demand	Anodyne	CACNA1I	47	34
C[C@@H]1CCCC[C@H]1C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819214136	EH	On-Demand	Anodyne	GPR119	41	41
C[C@@H]1CCCC[C@@H]1C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819214142	EH	On-Demand	Anodyne	CACNA1I	47	34
C[C@@H]1CCCC[C@@H]1C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819214142	EH	On-Demand	Anodyne	GPR119	41	41
O[C@@H](CN[C@@H]1CCCOc2c(F)cccc21)c1cccnc1	ZINC000819214144	DF	On-Demand	Anodyne	ADRB3	45	38
O[C@@H](CN[C@H]1CCCOc2c(F)cccc21)c1cccnc1	ZINC000819214146	DF	On-Demand	Anodyne	ADRB3	45	38
C[C@H](CCNC(=O)OC(C)(C)C)NCCC(=O)Nc1ccc(Cl)cc1	ZINC000819214147	FH	On-Demand	Anodyne	LTA4H	19	46
O[C@H](CN[C@@H]1CCCOc2c(F)cccc21)c1cccnc1	ZINC000819214148	DF	On-Demand	Anodyne	ADRB3	45	38
C[C@@H](CCNC(=O)OC(C)(C)C)NCCC(=O)Nc1ccc(Cl)cc1	ZINC000819214149	FH	On-Demand	Anodyne	LTA4H	19	46
O[C@H](CN[C@H]1CCCOc2c(F)cccc21)c1cccnc1	ZINC000819214150	DF	On-Demand	Anodyne	ADRB3	45	38
O[C@H](CNCc1ccccc1N1CCCCC1)COCC1CC1	ZINC000819214154	DF	On-Demand	Anodyne	KCNQ2	58	35
O[C@@H](CNCc1ccccc1N1CCCCC1)COCC1CC1	ZINC000819214156	DF	On-Demand	Anodyne	KCNQ2	58	35
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819214197	GC	On-Demand	Anodyne	ADRB2	32	49
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819214197	GC	On-Demand	Anodyne	ADRB1	69	49
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819214197	GC	On-Demand	Anodyne	ADRB3	43	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819214198	GC	On-Demand	Anodyne	ADRB2	32	49
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819214198	GC	On-Demand	Anodyne	ADRB1	69	49
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819214198	GC	On-Demand	Anodyne	ADRB3	43	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819214199	GC	On-Demand	Anodyne	ADRB2	32	49
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819214199	GC	On-Demand	Anodyne	ADRB1	69	49
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819214199	GC	On-Demand	Anodyne	ADRB3	43	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819214200	GC	On-Demand	Anodyne	ADRB2	32	49
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819214200	GC	On-Demand	Anodyne	ADRB1	69	49
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819214200	GC	On-Demand	Anodyne	ADRB3	43	48
O[C@@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1ccc(Cl)c(Cl)c1	ZINC000819214219	GE	On-Demand	Anodyne	GRIN1	24	43
O[C@@H](CNC[C@H]1COC2(CCOCC2)O1)COc1ccc(Cl)c(Cl)c1	ZINC000819214220	GE	On-Demand	Anodyne	GRIN1	24	43
O[C@H](CNC[C@H]1COC2(CCOCC2)O1)COc1ccc(Cl)c(Cl)c1	ZINC000819214221	GE	On-Demand	Anodyne	GRIN1	24	43
O[C@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1ccc(Cl)c(Cl)c1	ZINC000819214222	GE	On-Demand	Anodyne	GRIN1	24	43
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819214277	GE	On-Demand	Anodyne	ADRB2	32	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819214277	GE	On-Demand	Anodyne	ADRB1	70	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819214277	GE	On-Demand	Anodyne	ADRB3	45	47
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819214278	GE	On-Demand	Anodyne	ADRB2	32	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819214278	GE	On-Demand	Anodyne	ADRB1	70	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819214278	GE	On-Demand	Anodyne	ADRB3	45	47
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819214279	GE	On-Demand	Anodyne	ADRB2	32	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819214279	GE	On-Demand	Anodyne	ADRB1	70	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819214279	GE	On-Demand	Anodyne	ADRB3	45	47
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819214280	GE	On-Demand	Anodyne	ADRB2	32	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819214280	GE	On-Demand	Anodyne	ADRB1	70	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819214280	GE	On-Demand	Anodyne	ADRB3	45	47
O=C(/C=C/[C@H]1CCCO1)NCC(=O)Nc1cccnc1	ZINC000819214285	CC	On-Demand	Anodyne	NAMPT	31	41
O=C(/C=C\[C@@H]1CCCO1)NCC(=O)Nc1cccnc1	ZINC000819214287	CC	On-Demand	Anodyne	NAMPT	31	41
O=C(/C=C\[C@H]1CCCO1)NCC(=O)Nc1cccnc1	ZINC000819214288	CC	On-Demand	Anodyne	NAMPT	31	41
O=C(/C=C/[C@@H]1CCCO1)NCC(=O)Nc1cccnc1	ZINC000819214289	CC	On-Demand	Anodyne	NAMPT	31	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCCc2ccc(S(C)(=O)=O)cc21	ZINC000819214314	GE	On-Demand	Anodyne	GPR119	32	41
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)Nc1cccnc1Cl	ZINC000819214316	FE	On-Demand	Bother	G2YM83_BOTF4	56	31
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2ccc(Br)cc2)CC1	ZINC000819214403	GG	On-Demand	Anodyne	L3MBTL3	56	38
O[C@@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1ccc2ccccc2c1	ZINC000819214496	FE	On-Demand	Anodyne	ADRB2	15	46
O[C@@H](CNC[C@H]1COC2(CCOCC2)O1)COc1ccc2ccccc2c1	ZINC000819214497	FE	On-Demand	Anodyne	ADRB2	15	46
O[C@H](CNC[C@H]1COC2(CCOCC2)O1)COc1ccc2ccccc2c1	ZINC000819214498	FE	On-Demand	Anodyne	ADRB2	15	46
O[C@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1ccc2ccccc2c1	ZINC000819214499	FE	On-Demand	Anodyne	ADRB2	15	46
O=C(Nc1ccc(N2CCCC2=O)c(Cl)c1)NC1(C(=O)O)CCCC1	ZINC000819214503	FF	On-Demand	Anodyne	NPY2R	44	40
O=C(Nc1ccc(Cl)cn1)NC1(C(=O)O)CCCC1	ZINC000819214505	CE	On-Demand	Anodyne	F10	46	30
O=C(Nc1ccc(Cl)cn1)NC1(C(=O)O)CCCC1	ZINC000819214505	CE	On-Demand	Anodyne	LUCI_LUCLA	38	42
O=C(Nc1cccc(C(=O)NC2CC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214508	EC	On-Demand	Anodyne	EPHX2	27	42
O=C(Nc1cccc(C(=O)NC2CC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214508	EC	On-Demand	Anodyne	KCNK3	68	40
O=C(Nc1cccc(C(=O)NC2CC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214509	EC	On-Demand	Anodyne	EPHX2	27	42
O=C(Nc1cccc(C(=O)NC2CC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214509	EC	On-Demand	Anodyne	KCNK3	68	40
O=C(Nc1cccc(C(=O)N2CCSCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819214510	GE	On-Demand	Anodyne	EPHX2	41	55
O=C(Nc1cccc(C(=O)N2CCSCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819214510	GE	On-Demand	Anodyne	KCNK3	41	33
O=C(Nc1ccc(S(=O)(=O)NC2CC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819214511	FD	On-Demand	Anodyne	EPHX2	20	40
O=C(Nc1ccc(S(=O)(=O)NC2CC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819214511	FD	On-Demand	Anodyne	MTCA1	38	42
O=C(Nc1ccc(S(=O)(=O)NC2CC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819214511	FD	On-Demand	Anodyne	P96878_MYCTU	46	42
O=C(Nc1ccc(S(=O)(=O)NC2CC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819214511	FD	On-Demand	Anodyne	NAMPT	23	47
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1COC2(CCOCC2)O1	ZINC000819214521	GC	On-Demand	Anodyne	ADRA1D	27	48
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1COC2(CCOCC2)O1	ZINC000819214521	GC	On-Demand	Anodyne	ADRA1A	21	48
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1COC2(CCOCC2)O1	ZINC000819214521	GC	On-Demand	Anodyne	ADRA1B	27	48
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1COC2(CCOCC2)O1	ZINC000819214523	GC	On-Demand	Anodyne	ADRA1D	27	48
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1COC2(CCOCC2)O1	ZINC000819214523	GC	On-Demand	Anodyne	ADRA1A	21	48
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1COC2(CCOCC2)O1	ZINC000819214523	GC	On-Demand	Anodyne	ADRA1B	27	48
O=C(Nc1ccc(OCc2ccccc2F)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214526	GE	On-Demand	Anodyne	TSHR	45	37
O=C(Nc1ccc(OCc2ccccc2F)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214526	GE	On-Demand	Anodyne	SLC6A1	73	37
O=C(Nc1ccc(OCc2ccccc2F)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214526	GE	On-Demand	Anodyne	ADAM17	37	43
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1COC2(CCOCC2)O1	ZINC000819214527	GC	On-Demand	Anodyne	ADRA1D	27	48
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1COC2(CCOCC2)O1	ZINC000819214527	GC	On-Demand	Anodyne	ADRA1A	21	48
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1COC2(CCOCC2)O1	ZINC000819214527	GC	On-Demand	Anodyne	ADRA1B	27	48
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1COC2(CCOCC2)O1	ZINC000819214530	GC	On-Demand	Anodyne	ADRA1D	27	48
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1COC2(CCOCC2)O1	ZINC000819214530	GC	On-Demand	Anodyne	ADRA1A	21	48
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1COC2(CCOCC2)O1	ZINC000819214530	GC	On-Demand	Anodyne	ADRA1B	27	48
O=C(Nc1ccc(OCc2ccccc2F)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214532	GE	On-Demand	Anodyne	TSHR	45	37
O=C(Nc1ccc(OCc2ccccc2F)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214532	GE	On-Demand	Anodyne	SLC6A1	73	37
O=C(Nc1ccc(OCc2ccccc2F)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214532	GE	On-Demand	Anodyne	ADAM17	37	43
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214544	FD	On-Demand	Anodyne	SLC6A1	52	34
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214544	FD	On-Demand	Anodyne	NPY2R	28	44
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214544	FD	On-Demand	Anodyne	PREP	25	41
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214544	FD	On-Demand	Anodyne	EPHX2	19	46
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214544	FD	On-Demand	Anodyne	L3MBTL3	94	47
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214544	FD	On-Demand	Anodyne	HPGD	41	35
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214544	FD	On-Demand	Anodyne	KCNK3	40	41
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214545	FD	On-Demand	Anodyne	SLC6A1	52	34
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214545	FD	On-Demand	Anodyne	NPY2R	28	44
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214545	FD	On-Demand	Anodyne	PREP	25	41
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214545	FD	On-Demand	Anodyne	EPHX2	19	46
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214545	FD	On-Demand	Anodyne	L3MBTL3	94	47
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214545	FD	On-Demand	Anodyne	HPGD	41	35
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214545	FD	On-Demand	Anodyne	KCNK3	40	41
O=C(CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12)Nc1cccnc1Cl	ZINC000819214553	GK	On-Demand	Anodyne	TSPO	30	56
O=C(Nc1ccc(COCc2ccccc2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214556	GE	On-Demand	Anodyne	SLC6A1	64	40
O=C(Nc1ccc(COCc2ccccc2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214556	GE	On-Demand	Anodyne	DHODH	16	41
O=C(Nc1ccc(COCc2ccccc2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214556	GE	On-Demand	Anodyne	TGM2	26	40
O=C(Nc1ccc(COCc2ccccc2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214556	GE	On-Demand	Anodyne	F13A1	37	40
O=C(Nc1ccc(COCc2ccccc2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214557	GE	On-Demand	Anodyne	SLC6A1	64	40
O=C(Nc1ccc(COCc2ccccc2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214557	GE	On-Demand	Anodyne	DHODH	16	41
O=C(Nc1ccc(COCc2ccccc2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214557	GE	On-Demand	Anodyne	TGM2	26	40
O=C(Nc1ccc(COCc2ccccc2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214557	GE	On-Demand	Anodyne	F13A1	37	40
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819214559	FF	On-Demand	Anodyne	NPY2R	19	42
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819214559	FF	On-Demand	Anodyne	EPHX2	48	54
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819214559	FF	On-Demand	Anodyne	L3MBTL3	43	40
O=C(Nc1cccc(C(=O)N2CCCCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819214559	FF	On-Demand	Anodyne	KCNK3	45	38
O=C(Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)NC1(C(=O)O)CCCC1	ZINC000819214560	GH	On-Demand	Anodyne	GRM4	24	49
O=C(Nc1ccc(S(=O)(=O)C2CCCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819214571	GF	On-Demand	Anodyne	MTCA1	40	43
O=C(Nc1ccc(S(=O)(=O)C2CCCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819214571	GF	On-Demand	Anodyne	P96878_MYCTU	50	43
O=C(Nc1ccc(S(=O)(=O)C2CCCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819214571	GF	On-Demand	Anodyne	NAMPT	26	41
O=C(Nc1cccc(C(=O)N2CCSCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214573	GC	On-Demand	Anodyne	NPY2R	19	40
O=C(Nc1cccc(C(=O)N2CCSCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214573	GC	On-Demand	Anodyne	EPHX2	19	43
O=C(Nc1cccc(C(=O)N2CCSCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214573	GC	On-Demand	Anodyne	L3MBTL3	55	41
O=C(Nc1cccc(C(=O)N2CCSCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214575	GC	On-Demand	Anodyne	NPY2R	19	40
O=C(Nc1cccc(C(=O)N2CCSCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214575	GC	On-Demand	Anodyne	EPHX2	19	43
O=C(Nc1cccc(C(=O)N2CCSCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214575	GC	On-Demand	Anodyne	L3MBTL3	55	41
O=C(Nc1cccc(C(=O)N2CCOCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214577	GC	On-Demand	Anodyne	CASR	32	41
O=C(Nc1cccc(C(=O)N2CCOCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214577	GC	On-Demand	Anodyne	NPY2R	21	40
O=C(Nc1cccc(C(=O)N2CCOCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214577	GC	On-Demand	Anodyne	EPHX2	26	53
O=C(Nc1cccc(C(=O)N2CCOCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214577	GC	On-Demand	Anodyne	L3MBTL3	57	41
O=C(Nc1cccc(C(=O)N2CCOCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214579	GC	On-Demand	Anodyne	CASR	32	41
O=C(Nc1cccc(C(=O)N2CCOCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214579	GC	On-Demand	Anodyne	NPY2R	21	40
O=C(Nc1cccc(C(=O)N2CCOCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214579	GC	On-Demand	Anodyne	EPHX2	26	53
O=C(Nc1cccc(C(=O)N2CCOCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214579	GC	On-Demand	Anodyne	L3MBTL3	57	41
O=C(Nc1ccc2nc(N3CCOCC3)sc2c1)NC1(C(=O)O)CCCC1	ZINC000819214614	GF	On-Demand	Anodyne	MTOR	41	38
O=C(Nc1ccc2nc(N3CCOCC3)sc2c1)NC1(C(=O)O)CCCC1	ZINC000819214614	GF	On-Demand	Anodyne	EPHX2	18	41
O=C(Nc1ccc(N=Nc2ccccc2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214618	FF	On-Demand	Clean	SLC6A1	40	33
O=C(Nc1ccc(N=Nc2ccccc2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214620	FF	On-Demand	Clean	SLC6A1	40	33
C[C@@H]1CCCC[C@@H]1C(=O)Nc1cccc(OCCS(C)(=O)=O)c1	ZINC000819214638	EF	On-Demand	Anodyne	EPHX2	21	45
C[C@@H]1CCCC[C@H]1C(=O)Nc1cccc(OCCS(C)(=O)=O)c1	ZINC000819214643	EF	On-Demand	Anodyne	EPHX2	21	45
O[C@@H](CNC[C@H]1COC2(CCOCC2)O1)COc1ccccc1F	ZINC000819214651	ED	On-Demand	Anodyne	ADRA1B	15	42
O[C@H](CNC[C@H]1COC2(CCOCC2)O1)COc1ccccc1F	ZINC000819214656	ED	On-Demand	Anodyne	ADRA1B	15	42
O=C(Nc1cccc(C(=O)NC2CC2)c1)NC1(C(=O)O)CCCC1	ZINC000819214659	EE	On-Demand	Anodyne	MAPK14	27	41
O=C(Nc1cccc(C(=O)NC2CC2)c1)NC1(C(=O)O)CCCC1	ZINC000819214659	EE	On-Demand	Anodyne	EPHX2	42	49
O=C(Nc1cccc(C(=O)NC2CC2)c1)NC1(C(=O)O)CCCC1	ZINC000819214659	EE	On-Demand	Anodyne	KCNK3	94	40
O=C(Nc1cccc(C(=O)NC2CC2)c1)NC1(C(=O)O)CCCC1	ZINC000819214659	EE	On-Demand	Anodyne	KCNK9	49	36
O[C@@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1ccccc1F	ZINC000819214660	ED	On-Demand	Anodyne	ADRA1B	15	42
O=C(Nc1ccc(NC(=O)c2ccccc2)nc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214662	GD	On-Demand	Anodyne	SLC6A1	46	32
O=C(Nc1ccc(NC(=O)c2ccccc2)nc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214662	GD	On-Demand	Anodyne	F10	17	45
O=C(Nc1ccc(NC(=O)c2ccccc2)nc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214662	GD	On-Demand	Anodyne	PRNP	51	38
O=C(Nc1ccc(NC(=O)c2ccccc2)nc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214662	GD	On-Demand	Anodyne	LUCI_LUCLA	37	44
O=C(Nc1ccc(NC(=O)c2ccccc2)nc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214665	GD	On-Demand	Anodyne	SLC6A1	46	32
O=C(Nc1ccc(NC(=O)c2ccccc2)nc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214665	GD	On-Demand	Anodyne	F10	17	45
O=C(Nc1ccc(NC(=O)c2ccccc2)nc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214665	GD	On-Demand	Anodyne	PRNP	51	38
O=C(Nc1ccc(NC(=O)c2ccccc2)nc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214665	GD	On-Demand	Anodyne	LUCI_LUCLA	37	44
O[C@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1ccccc1F	ZINC000819214666	ED	On-Demand	Anodyne	ADRA1B	15	42
O=C(Nc1ccc2[nH]ncc2c1)C(=O)N1CCC(C(=O)O)CC1	ZINC000819214670	DC	On-Demand	Anodyne	MAOB	15	46
O=C(Nc1ccc2[nH]ncc2c1)C(=O)N1CCC(C(=O)O)CC1	ZINC000819214670	DC	On-Demand	Anodyne	ROCK1	21	45
O=C(Nc1ccc2[nH]ncc2c1)C(=O)N1CCC(C(=O)O)CC1	ZINC000819214670	DC	On-Demand	Anodyne	ROCK2	21	52
O=C(Nc1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1)c1ccco1	ZINC000819214672	EF	On-Demand	Anodyne	ACE	55	43
O=C(Nc1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1)c1ccco1	ZINC000819214672	EF	On-Demand	Anodyne	FKBP1A	21	49
O=C(Nc1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1)c1ccco1	ZINC000819214672	EF	On-Demand	Anodyne	PREP	55	39
CC#CCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819214674	CF	On-Demand	Mild	ADRB3	17	45
CCOC[C@H](O)CNCCc1c[nH]c2cccc(OC)c12	ZINC000819214676	CD	On-Demand	Anodyne	ADRB2	22	44
CC#CCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819214677	CF	On-Demand	Mild	ADRB3	17	45
O=C(Nc1ccc(Cl)c(C(=O)NC2CC2)c1)NC1(C(=O)O)CCCC1	ZINC000819214704	FF	On-Demand	Anodyne	EPHX2	30	46
O=C(Nc1ccc(Cl)c(C(=O)NC2CC2)c1)NC1(C(=O)O)CCCC1	ZINC000819214704	FF	On-Demand	Anodyne	ENV	40	36
O=C(Nc1ccc2[nH]ncc2c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214715	DC	On-Demand	Anodyne	ROCK1	20	44
O=C(Nc1ccc2[nH]ncc2c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214715	DC	On-Demand	Anodyne	ROCK2	18	50
O=C(Nc1ccc2[nH]ncc2c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214718	DC	On-Demand	Anodyne	ROCK1	20	44
O=C(Nc1ccc2[nH]ncc2c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214718	DC	On-Demand	Anodyne	ROCK2	18	50
C#CCNC(=O)CCNCC1(Cc2ccccc2)CCCC1	ZINC000819214754	CF	On-Demand	Mild	NPFFR1	15	40
O=C(Nc1ccc(NC(=O)C2CC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214755	EC	On-Demand	Anodyne	NPY2R	15	40
O=C(Nc1ccc(NC(=O)C2CC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214755	EC	On-Demand	Anodyne	EPHX2	28	42
O=C(Nc1ccc(NC(=O)C2CC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214759	EC	On-Demand	Anodyne	NPY2R	15	40
O=C(Nc1ccc(NC(=O)C2CC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214759	EC	On-Demand	Anodyne	EPHX2	28	42
O=C(Nc1ccc(F)cc1)c1nnc(CN2CC[C@@H](C(=O)O)C2)s1	ZINC000819214763	FD	On-Demand	Anodyne	SLC6A1	91	36
O=C(Nc1ccc(F)cc1)c1nnc(CN2CC[C@H](C(=O)O)C2)s1	ZINC000819214767	FD	On-Demand	Anodyne	SLC6A1	91	36
O[C@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819214769	GF	On-Demand	Anodyne	ADRB2	28	42
O[C@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819214769	GF	On-Demand	Anodyne	ADRB1	44	39
O[C@H](CNC[C@H]1COC2(CCOCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819214776	GF	On-Demand	Anodyne	ADRB2	28	42
O[C@H](CNC[C@H]1COC2(CCOCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819214776	GF	On-Demand	Anodyne	ADRB1	44	39
O=C(Nc1ccc(N2CCCC2)nc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214778	EC	On-Demand	Anodyne	DGAT1	47	46
O=C(Nc1ccc(N2CCCC2)nc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214781	EC	On-Demand	Anodyne	DGAT1	47	46
O[C@@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819214782	GF	On-Demand	Anodyne	ADRB2	28	42
O[C@@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819214782	GF	On-Demand	Anodyne	ADRB1	44	39
O[C@@H](CNC[C@H]1COC2(CCOCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819214786	GF	On-Demand	Anodyne	ADRB2	28	42
O[C@@H](CNC[C@H]1COC2(CCOCC2)O1)COc1ccc(-c2ccccc2)cc1	ZINC000819214786	GF	On-Demand	Anodyne	ADRB1	44	39
O=C(Nc1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1)C1CC1	ZINC000819214791	DE	On-Demand	Anodyne	F2	15	43
O=C(Nc1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1)C1CC1	ZINC000819214791	DE	On-Demand	Anodyne	ACE	54	43
O=C(Nc1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1)C1CC1	ZINC000819214791	DE	On-Demand	Anodyne	FKBP1A	18	47
O=C(Nc1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1)C1CC1	ZINC000819214791	DE	On-Demand	Anodyne	UL80	54	48
O=C(Nc1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1)C1CC1	ZINC000819214791	DE	On-Demand	Anodyne	PREP	51	38
O=C(Nc1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1)C1CC1	ZINC000819214791	DE	On-Demand	Anodyne	EPHX2	19	43
O=C(Nc1ccc(N2CCCCC2)nc1)NC1(C(=O)O)CCCC1	ZINC000819214794	EF	On-Demand	Anodyne	DGAT1	38	43
COC[C@@H](O)CNCCc1c[nH]c2cccc(OC)c12	ZINC000819214806	CD	On-Demand	Anodyne	ADRB2	29	46
COC[C@@H](O)CNCCc1c[nH]c2cccc(OC)c12	ZINC000819214806	CD	On-Demand	Anodyne	ADRB3	23	40
O=C(CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)NCC1CC1	ZINC000819214808	ED	On-Demand	Anodyne	EPHX2	28	40
O=C(CNC[C@H](O)c1ccc(OC(F)(F)F)cc1)NCC1CC1	ZINC000819214810	ED	On-Demand	Anodyne	EPHX2	28	40
CC(=O)Nc1cccc(CC(=O)N2CCC(C3OCCO3)CC2)c1	ZINC000819214842	ED	On-Demand	Anodyne	EPHX2	21	41
O=C(CCc1c(-c2ccc(F)cc2)[nH]c2ccc(F)cc12)Nc1cccnc1Cl	ZINC000819214848	HK	On-Demand	Anodyne	TSPO	22	47
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819214851	FI	On-Demand	Mild	PAPA1_CARPA	38	49
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819214851	FI	On-Demand	Mild	CTSK	16	46
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819214851	FI	On-Demand	Mild	REN	44	42
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819214851	FI	On-Demand	Mild	FPR1	20	40
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819214853	FI	On-Demand	Mild	PAPA1_CARPA	38	49
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819214853	FI	On-Demand	Mild	CTSK	16	46
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819214853	FI	On-Demand	Mild	REN	44	42
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819214853	FI	On-Demand	Mild	FPR1	20	40
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819214854	FI	On-Demand	Mild	PAPA1_CARPA	38	49
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819214854	FI	On-Demand	Mild	CTSK	16	46
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819214854	FI	On-Demand	Mild	REN	44	42
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819214854	FI	On-Demand	Mild	FPR1	20	40
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819214855	FI	On-Demand	Mild	PAPA1_CARPA	38	49
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819214855	FI	On-Demand	Mild	CTSK	16	46
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819214855	FI	On-Demand	Mild	REN	44	42
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCCCC1	ZINC000819214855	FI	On-Demand	Mild	FPR1	20	40
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819214857	FG	On-Demand	Anodyne	ADRB2	40	37
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819214857	FG	On-Demand	Anodyne	ADRB1	15	46
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819214859	FG	On-Demand	Anodyne	ADRB2	40	37
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819214859	FG	On-Demand	Anodyne	ADRB1	15	46
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819214860	FG	On-Demand	Anodyne	ADRB2	40	37
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819214860	FG	On-Demand	Anodyne	ADRB1	15	46
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819214862	FG	On-Demand	Anodyne	ADRB2	40	37
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819214862	FG	On-Demand	Anodyne	ADRB1	15	46
O=C(CNC[C@@H](O)c1ccc(F)cc1Cl)NCC1CC1	ZINC000819214885	DD	On-Demand	Anodyne	CACNA1I	62	35
Cc1nc(C(C)(C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)no1	ZINC000819214895	FE	On-Demand	Mild	PAPA1_CARPA	38	44
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214898	GH	On-Demand	Anodyne	F10	19	46
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214898	GH	On-Demand	Anodyne	TRPV1	18	47
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214898	GH	On-Demand	Anodyne	CCR1	39	42
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214898	GH	On-Demand	Anodyne	CPT1A	56	38
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214898	GH	On-Demand	Anodyne	CPT2	40	37
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214898	GH	On-Demand	Anodyne	PRNP	61	42
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214898	GH	On-Demand	Anodyne	EPHX2	45	46
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214898	GH	On-Demand	Anodyne	MCHR1	19	43
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214898	GH	On-Demand	Anodyne	SMO	17	42
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214898	GH	On-Demand	Anodyne	DGAT1	18	43
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214898	GH	On-Demand	Anodyne	L3MBTL3	42	36
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214898	GH	On-Demand	Anodyne	NOD1	15	44
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214900	GH	On-Demand	Anodyne	F10	19	46
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214900	GH	On-Demand	Anodyne	TRPV1	18	47
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214900	GH	On-Demand	Anodyne	CCR1	39	42
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214900	GH	On-Demand	Anodyne	CPT1A	56	38
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214900	GH	On-Demand	Anodyne	CPT2	40	37
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214900	GH	On-Demand	Anodyne	PRNP	61	42
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214900	GH	On-Demand	Anodyne	EPHX2	45	46
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214900	GH	On-Demand	Anodyne	MCHR1	19	43
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214900	GH	On-Demand	Anodyne	SMO	17	42
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214900	GH	On-Demand	Anodyne	DGAT1	18	43
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214900	GH	On-Demand	Anodyne	L3MBTL3	42	36
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1)c1ccc(Cl)cc1	ZINC000819214900	GH	On-Demand	Anodyne	NOD1	15	44
Cc1nc(C(C)(C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)no1	ZINC000819214902	FE	On-Demand	Mild	PAPA1_CARPA	38	44
O=C(Nc1ccc(Oc2ccncc2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214904	FD	On-Demand	Anodyne	DHODH	20	44
O=C(Nc1ccc(Oc2ccncc2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214904	FD	On-Demand	Anodyne	EPHX2	19	40
O=C(Nc1ccc(Oc2ccncc2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214907	FD	On-Demand	Anodyne	DHODH	20	44
O=C(Nc1ccc(Oc2ccncc2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214907	FD	On-Demand	Anodyne	EPHX2	19	40
O=C(Nc1ccc(OCC(F)F)cc1)NC1(C(=O)O)CCCC1	ZINC000819214914	EF	On-Demand	Anodyne	EPHX2	45	39
O=C(Nc1ccc2[nH]ncc2c1)C(=O)N1CCO[C@@H](C(=O)O)C1	ZINC000819214935	DB	On-Demand	Anodyne	ROCK1	21	42
O=C(Nc1ccc2[nH]ncc2c1)C(=O)N1CCO[C@@H](C(=O)O)C1	ZINC000819214935	DB	On-Demand	Anodyne	ROCK2	16	43
O=C(Nc1ccc2[nH]ncc2c1)C(=O)N1CCO[C@H](C(=O)O)C1	ZINC000819214938	DB	On-Demand	Anodyne	ROCK1	21	42
O=C(Nc1ccc2[nH]ncc2c1)C(=O)N1CCO[C@H](C(=O)O)C1	ZINC000819214938	DB	On-Demand	Anodyne	ROCK2	16	43
O=C(Nc1ccc(Cl)c(C(=O)NC2CC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819214940	GD	On-Demand	Anodyne	EPHX2	26	41
O=C(Nc1ccc(Cl)c(C(=O)NC2CC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819214944	GD	On-Demand	Anodyne	EPHX2	26	41
O=C(Nc1cccc(C(=O)N2CCOCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819214954	FD	On-Demand	Anodyne	EPHX2	58	65
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1COC2(CCC(C)CC2)O1	ZINC000819214963	GE	On-Demand	Anodyne	ADRA1D	27	41
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1COC2(CCC(C)CC2)O1	ZINC000819214963	GE	On-Demand	Anodyne	ADRA1A	21	46
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1COC2(CCC(C)CC2)O1	ZINC000819214963	GE	On-Demand	Anodyne	ADRA1B	27	46
O=C(Nc1ccc(N2CCSCC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819214964	EF	On-Demand	Anodyne	EPHX2	28	47
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1COC2(CCC(C)CC2)O1	ZINC000819214966	GE	On-Demand	Anodyne	ADRA1D	27	41
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1COC2(CCC(C)CC2)O1	ZINC000819214966	GE	On-Demand	Anodyne	ADRA1A	21	46
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1COC2(CCC(C)CC2)O1	ZINC000819214966	GE	On-Demand	Anodyne	ADRA1B	27	46
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1COC2(CCC(C)CC2)O1	ZINC000819214968	GE	On-Demand	Anodyne	ADRA1D	27	41
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1COC2(CCC(C)CC2)O1	ZINC000819214968	GE	On-Demand	Anodyne	ADRA1A	21	46
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1COC2(CCC(C)CC2)O1	ZINC000819214968	GE	On-Demand	Anodyne	ADRA1B	27	46
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1COC2(CCC(C)CC2)O1	ZINC000819214970	GE	On-Demand	Anodyne	ADRA1D	27	41
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1COC2(CCC(C)CC2)O1	ZINC000819214970	GE	On-Demand	Anodyne	ADRA1A	21	46
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1COC2(CCC(C)CC2)O1	ZINC000819214970	GE	On-Demand	Anodyne	ADRA1B	27	46
COc1ccc(-c2nc(C(=O)Nc3cccnc3Cl)cs2)cc1OC	ZINC000819214988	GI	On-Demand	Anodyne	GRM4	38	43
COc1ccc(-c2nc(C(=O)Nc3cccnc3Cl)cs2)cc1OC	ZINC000819214988	GI	On-Demand	Anodyne	CHEK1	17	62
COc1ccc(-c2nc(C(=O)Nc3cccnc3Cl)cs2)cc1OC	ZINC000819214988	GI	On-Demand	Anodyne	G2YM83_BOTF4	68	36
O=C1[C@H](NC[C@H](O)c2ccccc2)CCCN1Cc1cccc(C(F)(F)F)c1	ZINC000819214990	GH	On-Demand	Anodyne	TACR1	34	40
O=C1[C@H](NC[C@H](O)c2ccccc2)CCCN1Cc1cccc(C(F)(F)F)c1	ZINC000819214990	GH	On-Demand	Anodyne	CCR2	40	36
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCCN1Cc1cccc(C(F)(F)F)c1	ZINC000819214991	GH	On-Demand	Anodyne	TACR1	34	40
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCCN1Cc1cccc(C(F)(F)F)c1	ZINC000819214991	GH	On-Demand	Anodyne	CCR2	40	36
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCCN1Cc1cccc(C(F)(F)F)c1	ZINC000819214992	GH	On-Demand	Anodyne	TACR1	34	40
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCCN1Cc1cccc(C(F)(F)F)c1	ZINC000819214992	GH	On-Demand	Anodyne	CCR2	40	36
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCCN1Cc1cccc(C(F)(F)F)c1	ZINC000819214994	GH	On-Demand	Anodyne	TACR1	34	40
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCCN1Cc1cccc(C(F)(F)F)c1	ZINC000819214994	GH	On-Demand	Anodyne	CCR2	40	36
O=C(Nc1cccc(-c2noc(C3CC3)n2)c1)NC1(C(=O)O)CCCC1	ZINC000819214999	FG	On-Demand	Anodyne	GRM5	20	45
O=C(Nc1cccc(-c2noc(C3CC3)n2)c1)NC1(C(=O)O)CCCC1	ZINC000819214999	FG	On-Demand	Anodyne	SMO	35	41
O=C(Nc1cccc(-c2noc(C3CC3)n2)c1)NC1(C(=O)O)CCCC1	ZINC000819214999	FG	On-Demand	Anodyne	ETHR	33	40
O=C(Nc1cccc(CN2C(=O)CNC2=O)c1)C(=O)N1CCC(C(=O)O)CC1	ZINC000819215016	GC	On-Demand	Anodyne	NPY1R	27	40
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1Cl)c1ccco1	ZINC000819215017	GG	On-Demand	Anodyne	NPY2R	41	40
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1Cl)c1ccco1	ZINC000819215017	GG	On-Demand	Anodyne	GRM4	26	49
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1Cl)c1ccco1	ZINC000819215018	GG	On-Demand	Anodyne	NPY2R	41	40
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1Cl)c1ccco1	ZINC000819215018	GG	On-Demand	Anodyne	GRM4	26	49
O=C(Nc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215019	EC	On-Demand	Anodyne	PIK3CA	36	40
O=C(Nc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215019	EC	On-Demand	Anodyne	MTOR	73	40
O=C(Nc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215019	EC	On-Demand	Anodyne	EPHX2	20	49
O=C(Nc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215019	EC	On-Demand	Anodyne	PIK3CG	32	40
O=C(Nc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215019	EC	On-Demand	Anodyne	STAT6	42	32
O=C(Nc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215020	EC	On-Demand	Anodyne	PIK3CA	36	40
O=C(Nc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215020	EC	On-Demand	Anodyne	MTOR	73	40
O=C(Nc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215020	EC	On-Demand	Anodyne	EPHX2	20	49
O=C(Nc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215020	EC	On-Demand	Anodyne	PIK3CG	32	40
O=C(Nc1ccc(N2CCOCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215020	EC	On-Demand	Anodyne	STAT6	42	32
O=C(Nc1ccc(Oc2ccccn2)cc1)NC1(C(=O)O)CCCC1	ZINC000819215021	EG	On-Demand	Anodyne	LTA4H	18	41
O=C(Nc1ccc(Oc2ccccn2)cc1)NC1(C(=O)O)CCCC1	ZINC000819215021	EG	On-Demand	Anodyne	KDR	17	40
O=C(Nc1ccc(Oc2ccccn2)cc1)NC1(C(=O)O)CCCC1	ZINC000819215021	EG	On-Demand	Anodyne	EPHX2	20	45
O=C(Nc1ccc(Oc2ccccn2)cc1)NC1(C(=O)O)CCCC1	ZINC000819215021	EG	On-Demand	Anodyne	PDGFRA	46	40
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215022	GD	On-Demand	Anodyne	ESR1	82	36
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215022	GD	On-Demand	Anodyne	HTR2A	17	40
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215022	GD	On-Demand	Anodyne	SLC6A1	149	40
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215022	GD	On-Demand	Anodyne	ESR2	58	43
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215022	GD	On-Demand	Anodyne	LTA4H	81	51
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215022	GD	On-Demand	Anodyne	HRH3	79	56
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215022	GD	On-Demand	Anodyne	EPHX2	33	45
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215022	GD	On-Demand	Anodyne	MCHR1	18	43
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215022	GD	On-Demand	Anodyne	PSMB2	48	44
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215022	GD	On-Demand	Anodyne	PSMB1	53	45
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215023	GD	On-Demand	Anodyne	ESR1	82	36
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215023	GD	On-Demand	Anodyne	HTR2A	17	40
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215023	GD	On-Demand	Anodyne	SLC6A1	149	40
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215023	GD	On-Demand	Anodyne	ESR2	58	43
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215023	GD	On-Demand	Anodyne	LTA4H	81	51
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215023	GD	On-Demand	Anodyne	HRH3	79	56
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215023	GD	On-Demand	Anodyne	EPHX2	33	45
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215023	GD	On-Demand	Anodyne	MCHR1	18	43
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215023	GD	On-Demand	Anodyne	PSMB2	48	44
O=C(Nc1ccc(OCCN2CCCCC2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215023	GD	On-Demand	Anodyne	PSMB1	53	45
O=C(Nc1ccc(Oc2ccc(Cl)cn2)cc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215024	GE	On-Demand	Anodyne	LIPE	19	40
O=C(Nc1ccc(Oc2ccc(Cl)cn2)cc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215025	GE	On-Demand	Anodyne	LIPE	19	40
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1)c1ccco1	ZINC000819215027	EE	On-Demand	Anodyne	EPHX2	18	41
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1)c1ccco1	ZINC000819215029	EE	On-Demand	Anodyne	EPHX2	18	41
O=C(Nc1ccc2c(c1)ncn2-c1ccccc1)C(=O)N1CCC(C(=O)O)CC1	ZINC000819215039	GE	On-Demand	Anodyne	HPGD	52	51
O=C(Nc1ccc2ncsc2c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215043	DD	On-Demand	Anodyne	PRMT3	41	37
O=C(Nc1ccc2ncsc2c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215045	DD	On-Demand	Anodyne	PRMT3	41	37
O=C(Nc1cccc(CN2CCCCC2=O)c1)NC1(C(=O)O)CCCC1	ZINC000819215049	FF	On-Demand	Anodyne	P2RY14	41	33
O=C(Nc1ccc(S(=O)(=O)C(F)F)cc1)NC1(C(=O)O)CCCC1	ZINC000819215051	FE	On-Demand	Anodyne	MTCA1	41	38
O=C(Nc1ccc(S(=O)(=O)C(F)F)cc1)NC1(C(=O)O)CCCC1	ZINC000819215051	FE	On-Demand	Anodyne	P96878_MYCTU	52	38
O=C(Nc1ccc(NC(=O)C2CC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819215056	EF	On-Demand	Anodyne	EPHX2	39	41
O=C(Nc1ccc(OCc2ccncc2)cc1)NC1(C(=O)O)CCCC1	ZINC000819215064	FG	On-Demand	Anodyne	PPIA	39	40
O=C(Nc1ccc(OCc2ccncc2)cc1)NC1(C(=O)O)CCCC1	ZINC000819215064	FG	On-Demand	Anodyne	EPHX2	27	42
O=C(Nc1ccc2c(c1)ncn2-c1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215066	GD	On-Demand	Anodyne	HPGD	55	52
O=C(Nc1ccc2c(c1)ncn2-c1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215068	GD	On-Demand	Anodyne	HPGD	55	52
O=C(Nc1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1Cl)c1ccco1	ZINC000819215079	GG	On-Demand	Anodyne	ACE	40	39
O=C(Nc1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1Cl)c1ccco1	ZINC000819215079	GG	On-Demand	Anodyne	GRM4	20	46
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215083	FD	On-Demand	Anodyne	HTR1A	15	43
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215083	FD	On-Demand	Anodyne	DRD4	24	41
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215083	FD	On-Demand	Anodyne	HRH2	50	45
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215083	FD	On-Demand	Anodyne	SLC6A1	138	35
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215083	FD	On-Demand	Anodyne	HRH3	16	41
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215083	FD	On-Demand	Anodyne	SIGMAR1	29	48
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215083	FD	On-Demand	Anodyne	CCR3	53	44
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215083	FD	On-Demand	Anodyne	BDKRB1	41	41
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215083	FD	On-Demand	Anodyne	FAAH	16	43
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215083	FD	On-Demand	Anodyne	MCHR1	27	41
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819215083	FD	On-Demand	Anodyne	L3MBTL3	19	40
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215085	FD	On-Demand	Anodyne	HTR1A	15	43
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215085	FD	On-Demand	Anodyne	DRD4	24	41
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215085	FD	On-Demand	Anodyne	HRH2	50	45
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215085	FD	On-Demand	Anodyne	SLC6A1	138	35
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215085	FD	On-Demand	Anodyne	HRH3	16	41
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215085	FD	On-Demand	Anodyne	SIGMAR1	29	48
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215085	FD	On-Demand	Anodyne	CCR3	53	44
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215085	FD	On-Demand	Anodyne	BDKRB1	41	41
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215085	FD	On-Demand	Anodyne	FAAH	16	43
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215085	FD	On-Demand	Anodyne	MCHR1	27	41
O=C(Nc1cccc(CN2CCCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819215085	FD	On-Demand	Anodyne	L3MBTL3	19	40
O=C(Nc1ccc(S(=O)(=O)NCC2CC2)cc1)NC1(C(=O)O)CCCC1	ZINC000819215089	GD	On-Demand	Anodyne	P96878_MYCTU	44	38
O=C(CNC[C@H](O)c1ccc(F)cc1Cl)NCC1CC1	ZINC000819215111	DD	On-Demand	Anodyne	CACNA1I	62	35
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819215119	GE	On-Demand	Anodyne	NOD2	40	34
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819215120	GE	On-Demand	Anodyne	NOD2	40	34
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819215121	GE	On-Demand	Anodyne	NOD2	40	34
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819215122	GE	On-Demand	Anodyne	NOD2	40	34
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819215137	FG	On-Demand	Anodyne	ADRB1	31	44
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819215137	FG	On-Demand	Anodyne	ADRB3	34	44
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819215137	FG	On-Demand	Anodyne	PAPA1_CARPA	29	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819215137	FG	On-Demand	Anodyne	CTSL	16	41
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819215137	FG	On-Demand	Anodyne	FPR1	44	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819215137	FG	On-Demand	Anodyne	PDS	61	37
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819215138	FG	On-Demand	Anodyne	ADRB1	31	44
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819215138	FG	On-Demand	Anodyne	ADRB3	34	44
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819215138	FG	On-Demand	Anodyne	PAPA1_CARPA	29	40
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819215138	FG	On-Demand	Anodyne	CTSL	16	41
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819215138	FG	On-Demand	Anodyne	FPR1	44	40
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819215138	FG	On-Demand	Anodyne	PDS	61	37
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819215139	FG	On-Demand	Anodyne	ADRB1	31	44
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819215139	FG	On-Demand	Anodyne	ADRB3	34	44
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819215139	FG	On-Demand	Anodyne	PAPA1_CARPA	29	40
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819215139	FG	On-Demand	Anodyne	CTSL	16	41
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819215139	FG	On-Demand	Anodyne	FPR1	44	40
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819215139	FG	On-Demand	Anodyne	PDS	61	37
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819215140	FG	On-Demand	Anodyne	ADRB1	31	44
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819215140	FG	On-Demand	Anodyne	ADRB3	34	44
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819215140	FG	On-Demand	Anodyne	PAPA1_CARPA	29	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819215140	FG	On-Demand	Anodyne	CTSL	16	41
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819215140	FG	On-Demand	Anodyne	FPR1	44	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819215140	FG	On-Demand	Anodyne	PDS	61	37
O[C@H](CN[C@H]1CCCOc2c(F)cccc21)c1cccc(Cl)c1	ZINC000819215141	EI	On-Demand	Anodyne	ADRB3	36	42
O[C@H](CN[C@@H]1CCCOc2c(F)cccc21)c1cccc(Cl)c1	ZINC000819215142	EI	On-Demand	Anodyne	ADRB3	36	42
O[C@@H](CN[C@H]1CCCOc2c(F)cccc21)c1cccc(Cl)c1	ZINC000819215143	EI	On-Demand	Anodyne	ADRB3	36	42
O[C@@H](CN[C@@H]1CCCOc2c(F)cccc21)c1cccc(Cl)c1	ZINC000819215144	EI	On-Demand	Anodyne	ADRB3	36	42
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(Br)cc1	ZINC000819215165	GG	On-Demand	Anodyne	PAPA1_CARPA	24	40
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819215166	GG	On-Demand	Anodyne	PAPA1_CARPA	24	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819215167	GG	On-Demand	Anodyne	PAPA1_CARPA	24	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(Br)cc1	ZINC000819215168	GG	On-Demand	Anodyne	PAPA1_CARPA	24	40
CC[C@@H](O)CNCCc1c[nH]c2cccc(OC)c12	ZINC000819215174	CE	On-Demand	Anodyne	ADRB2	18	42
CC[C@H](O)CNCCc1c[nH]c2cccc(OC)c12	ZINC000819215175	CE	On-Demand	Anodyne	ADRB2	18	42
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3cccc(OC)c23)c1	ZINC000819215188	FG	On-Demand	Anodyne	ADRB2	26	49
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3cccc(OC)c23)c1	ZINC000819215188	FG	On-Demand	Anodyne	ADRB1	27	40
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3cccc(OC)c23)c1	ZINC000819215188	FG	On-Demand	Anodyne	ADRB3	26	47
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3cccc(OC)c23)c1	ZINC000819215188	FG	On-Demand	Anodyne	MTNR1A	23	42
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3cccc(OC)c23)c1	ZINC000819215188	FG	On-Demand	Anodyne	MTNR1B	15	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cccnn3)CC1)C2	ZINC000819215194	FC	On-Demand	Anodyne	SSTR1	35	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cccnn3)CC1)C2	ZINC000819215194	FC	On-Demand	Anodyne	NPBWR1	46	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cccnn3)CC1)C2	ZINC000819215195	FC	On-Demand	Anodyne	SSTR1	35	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cccnn3)CC1)C2	ZINC000819215195	FC	On-Demand	Anodyne	NPBWR1	46	33
COCC[C@@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(C)o1	ZINC000819215203	GG	On-Demand	Anodyne	GPR119	35	42
COCC[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(C)o1	ZINC000819215204	GG	On-Demand	Anodyne	GPR119	35	42
COCC[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(C)o1	ZINC000819215205	GG	On-Demand	Anodyne	GPR119	35	42
COCC[C@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(C)o1	ZINC000819215206	GG	On-Demand	Anodyne	GPR119	35	42
O=C(CN1C(=O)CCOc2ccccc21)Nc1cccnc1Cl	ZINC000819215312	EE	On-Demand	Anodyne	MAPK8	15	41
O=C(CN1C(=O)CCOc2ccccc21)Nc1cccnc1Cl	ZINC000819215312	EE	On-Demand	Anodyne	G2YM83_BOTF4	65	33
CCC(CC)[C@@H]1C[C@@H](NC[C@@H](O)c2cccnc2)CCO1	ZINC000819215314	CF	On-Demand	Anodyne	ADRB3	50	43
CCC(CC)[C@@H]1C[C@H](NC[C@H](O)c2cccnc2)CCO1	ZINC000819215315	CF	On-Demand	Anodyne	ADRB3	50	43
CCC(CC)[C@@H]1C[C@@H](NC[C@H](O)c2cccnc2)CCO1	ZINC000819215316	CF	On-Demand	Anodyne	ADRB3	50	43
CCC(CC)[C@@H]1C[C@H](NC[C@@H](O)c2cccnc2)CCO1	ZINC000819215318	CF	On-Demand	Anodyne	ADRB3	50	43
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819215319	FF	On-Demand	Bother	ADRB3	45	38
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819215319	FF	On-Demand	Bother	CACNA1D	47	35
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819215320	FF	On-Demand	Bother	ADRB3	45	38
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819215320	FF	On-Demand	Bother	CACNA1D	47	35
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819215322	FF	On-Demand	Bother	ADRB3	45	38
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819215322	FF	On-Demand	Bother	CACNA1D	47	35
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819215323	FF	On-Demand	Bother	ADRB3	45	38
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819215323	FF	On-Demand	Bother	CACNA1D	47	35
O=C(C(F)=C1CCC1)N1CCC(c2n[nH]c(-c3ccccc3)n2)CC1	ZINC000819215344	EH	On-Demand	Anodyne	AKT2	44	38
C[C@@H](CCNC(=O)OC(C)(C)C)NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000819215346	GE	On-Demand	Mild	CTRB_BOVIN	44	33
C[C@H](CCNC(=O)OC(C)(C)C)NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000819215347	GE	On-Demand	Mild	CTRB_BOVIN	44	33
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc2ccccc12	ZINC000819215371	FH	On-Demand	Anodyne	FPR1	42	33
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc2ccccc12	ZINC000819215373	FH	On-Demand	Anodyne	FPR1	42	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(OCc2cscn2)c1	ZINC000819215401	GH	On-Demand	Anodyne	EPHX2	17	40
C[C@H](CCNC(=O)OC(C)(C)C)NCCC(=O)Nc1cccc(F)c1	ZINC000819215404	FG	On-Demand	Anodyne	PAPA1_CARPA	18	40
C[C@@H](CCNC(=O)OC(C)(C)C)NCCC(=O)Nc1cccc(F)c1	ZINC000819215405	FG	On-Demand	Anodyne	PAPA1_CARPA	18	40
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819215412	EG	On-Demand	Anodyne	ADRB1	17	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819215414	EG	On-Demand	Anodyne	ADRB1	17	40
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819215442	GH	On-Demand	Anodyne	ADRB3	45	39
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819215442	GH	On-Demand	Anodyne	PDS	41	37
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819215444	GH	On-Demand	Anodyne	ADRB3	45	39
C[C@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819215444	GH	On-Demand	Anodyne	PDS	41	37
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819215445	GH	On-Demand	Anodyne	ADRB3	45	39
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819215445	GH	On-Demand	Anodyne	PDS	41	37
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819215446	GH	On-Demand	Anodyne	ADRB3	45	39
C[C@@H](CCNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819215446	GH	On-Demand	Anodyne	PDS	41	37
CC(=O)Nc1cccc(CC(=O)Nc2cccc(OCCS(C)(=O)=O)c2)c1	ZINC000819215518	GE	On-Demand	Anodyne	DRTS_LEIMA	17	40
CC(=O)Nc1cccc(CC(=O)Nc2cccc(OCCS(C)(=O)=O)c2)c1	ZINC000819215518	GE	On-Demand	Anodyne	MTNR1A	35	40
CC(=O)Nc1cccc(CC(=O)Nc2cccc(OCCS(C)(=O)=O)c2)c1	ZINC000819215518	GE	On-Demand	Anodyne	MTNR1B	33	40
CC(=O)Nc1cccc(CC(=O)Nc2cccc(OCCS(C)(=O)=O)c2)c1	ZINC000819215518	GE	On-Demand	Anodyne	EPHX2	17	44
COCCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819215599	GF	On-Demand	Anodyne	ADRB2	29	48
COCCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819215599	GF	On-Demand	Anodyne	ADRB1	60	48
COCCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819215599	GF	On-Demand	Anodyne	ADRB3	38	40
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819215600	GF	On-Demand	Anodyne	ADRB2	29	48
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819215600	GF	On-Demand	Anodyne	ADRB1	60	48
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819215600	GF	On-Demand	Anodyne	ADRB3	38	40
COCCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819215601	GF	On-Demand	Anodyne	ADRB2	29	48
COCCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819215601	GF	On-Demand	Anodyne	ADRB1	60	48
COCCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819215601	GF	On-Demand	Anodyne	ADRB3	38	40
COCCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819215602	GF	On-Demand	Anodyne	ADRB2	29	48
COCCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819215602	GF	On-Demand	Anodyne	ADRB1	60	48
COCCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819215602	GF	On-Demand	Anodyne	ADRB3	38	40
Cc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819215644	ED	On-Demand	Anodyne	ADRB2	21	44
Cc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819215645	ED	On-Demand	Anodyne	ADRB2	21	44
Cc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819215646	ED	On-Demand	Anodyne	ADRB2	21	44
Cc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819215647	ED	On-Demand	Anodyne	ADRB2	21	44
O[C@@H](CNC[C@@H]1COC2(CCCCCC2)O1)c1cccnc1	ZINC000819215655	DE	On-Demand	Anodyne	ADRB3	82	42
O[C@@H](CNC[C@H]1COC2(CCCCCC2)O1)c1cccnc1	ZINC000819215656	DE	On-Demand	Anodyne	ADRB3	82	42
O[C@H](CNC[C@@H]1COC2(CCCCCC2)O1)c1cccnc1	ZINC000819215657	DE	On-Demand	Anodyne	ADRB3	82	42
O[C@H](CNC[C@H]1COC2(CCCCCC2)O1)c1cccnc1	ZINC000819215658	DE	On-Demand	Anodyne	ADRB3	82	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819215665	GD	On-Demand	Anodyne	ADRB2	35	41
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819215665	GD	On-Demand	Anodyne	ADRB1	66	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819215665	GD	On-Demand	Anodyne	ADRB3	45	41
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819215666	GD	On-Demand	Anodyne	ADRB2	35	41
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819215666	GD	On-Demand	Anodyne	ADRB1	66	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819215666	GD	On-Demand	Anodyne	ADRB3	45	41
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819215667	GD	On-Demand	Anodyne	ADRB2	35	41
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819215667	GD	On-Demand	Anodyne	ADRB1	66	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819215667	GD	On-Demand	Anodyne	ADRB3	45	41
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819215668	GD	On-Demand	Anodyne	ADRB2	35	41
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819215668	GD	On-Demand	Anodyne	ADRB1	66	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819215668	GD	On-Demand	Anodyne	ADRB3	45	41
O[C@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1cccc(C(F)(F)F)c1	ZINC000819215746	GD	On-Demand	Anodyne	PDS	40	35
O[C@@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1cccc(C(F)(F)F)c1	ZINC000819215747	GD	On-Demand	Anodyne	PDS	40	35
O[C@@H](CNC[C@H]1COC2(CCOCC2)O1)COc1cccc(C(F)(F)F)c1	ZINC000819215748	GD	On-Demand	Anodyne	PDS	40	35
O[C@H](CNC[C@H]1COC2(CCOCC2)O1)COc1cccc(C(F)(F)F)c1	ZINC000819215749	GD	On-Demand	Anodyne	PDS	40	35
COc1ccccc1COC[C@@H](O)CNC[C@@H]1COC2(CCOCC2)O1	ZINC000819215752	FD	On-Demand	Anodyne	ADRA1D	19	49
COc1ccccc1COC[C@@H](O)CNC[C@@H]1COC2(CCOCC2)O1	ZINC000819215752	FD	On-Demand	Anodyne	ADRA1B	20	49
COc1ccccc1COC[C@H](O)CNC[C@@H]1COC2(CCOCC2)O1	ZINC000819215753	FD	On-Demand	Anodyne	ADRA1D	19	49
COc1ccccc1COC[C@H](O)CNC[C@@H]1COC2(CCOCC2)O1	ZINC000819215753	FD	On-Demand	Anodyne	ADRA1B	20	49
COc1ccccc1COC[C@@H](O)CNC[C@H]1COC2(CCOCC2)O1	ZINC000819215754	FD	On-Demand	Anodyne	ADRA1D	19	49
COc1ccccc1COC[C@@H](O)CNC[C@H]1COC2(CCOCC2)O1	ZINC000819215754	FD	On-Demand	Anodyne	ADRA1B	20	49
COc1ccccc1COC[C@H](O)CNC[C@H]1COC2(CCOCC2)O1	ZINC000819215755	FD	On-Demand	Anodyne	ADRA1D	19	49
COc1ccccc1COC[C@H](O)CNC[C@H]1COC2(CCOCC2)O1	ZINC000819215755	FD	On-Demand	Anodyne	ADRA1B	20	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(OCCS(C)(=O)=O)c1	ZINC000819215764	GD	On-Demand	Anodyne	EPHX2	19	41
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819215788	GC	On-Demand	Anodyne	ADRB2	26	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819215788	GC	On-Demand	Anodyne	ADRB1	50	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819215788	GC	On-Demand	Anodyne	ADRB3	29	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819215789	GC	On-Demand	Anodyne	ADRB2	26	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819215789	GC	On-Demand	Anodyne	ADRB1	50	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819215789	GC	On-Demand	Anodyne	ADRB3	29	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819215790	GC	On-Demand	Anodyne	ADRB2	26	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819215790	GC	On-Demand	Anodyne	ADRB1	50	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819215790	GC	On-Demand	Anodyne	ADRB3	29	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819215791	GC	On-Demand	Anodyne	ADRB2	26	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819215791	GC	On-Demand	Anodyne	ADRB1	50	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819215791	GC	On-Demand	Anodyne	ADRB3	29	42
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1cccnc1	ZINC000819215894	CE	On-Demand	Anodyne	ADRB2	55	57
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1cccnc1	ZINC000819215894	CE	On-Demand	Anodyne	ADRB1	65	59
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1cccnc1	ZINC000819215894	CE	On-Demand	Anodyne	ADRB3	163	59
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1cccnc1	ZINC000819215895	CE	On-Demand	Anodyne	ADRB2	55	57
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1cccnc1	ZINC000819215895	CE	On-Demand	Anodyne	ADRB1	65	59
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1cccnc1	ZINC000819215895	CE	On-Demand	Anodyne	ADRB3	163	59
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cc(F)c(F)c(F)c2)cc1	ZINC000819215896	FE	On-Demand	Anodyne	ADRB2	69	45
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cc(F)c(F)c(F)c2)cc1	ZINC000819215896	FE	On-Demand	Anodyne	ADRB1	62	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cc(F)c(F)c(F)c2)cc1	ZINC000819215896	FE	On-Demand	Anodyne	ADRB3	141	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cc(F)c(F)c(F)c2)cc1	ZINC000819215896	FE	On-Demand	Anodyne	TBXA2R	33	40
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cc(F)c(F)c(F)c2)cc1	ZINC000819215897	FE	On-Demand	Anodyne	ADRB2	69	45
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cc(F)c(F)c(F)c2)cc1	ZINC000819215897	FE	On-Demand	Anodyne	ADRB1	62	40
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cc(F)c(F)c(F)c2)cc1	ZINC000819215897	FE	On-Demand	Anodyne	ADRB3	141	44
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cc(F)c(F)c(F)c2)cc1	ZINC000819215897	FE	On-Demand	Anodyne	TBXA2R	33	40
O=C(NCCNC[C@@H](O)c1ccc(Cl)cc1Cl)c1cc[nH]n1	ZINC000819215906	ED	On-Demand	Anodyne	ALPL	64	41
O=C(NCCNC[C@H](O)c1ccc(Cl)cc1Cl)c1cc[nH]n1	ZINC000819215907	ED	On-Demand	Anodyne	ALPL	64	41
COc1ccc(OC)c([C@H](O)CNCCNC(=O)c2cc[nH]n2)c1	ZINC000819215913	EC	On-Demand	Anodyne	MTNR1A	24	40
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccc(Br)cc1)CCC2	ZINC000819215926	GH	On-Demand	Anodyne	ADRB2	26	41
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccc(Br)cc1)CCC2	ZINC000819215926	GH	On-Demand	Anodyne	ADRB1	33	40
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccc(Br)cc1)CCC2	ZINC000819215926	GH	On-Demand	Anodyne	ADRB3	17	40
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccc(Br)cc1)CCC2	ZINC000819215926	GH	On-Demand	Anodyne	ACOX1	52	37
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccc(Br)cc1)CCC2	ZINC000819215927	GH	On-Demand	Anodyne	ADRB2	26	41
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccc(Br)cc1)CCC2	ZINC000819215927	GH	On-Demand	Anodyne	ADRB1	33	40
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccc(Br)cc1)CCC2	ZINC000819215927	GH	On-Demand	Anodyne	ADRB3	17	40
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccc(Br)cc1)CCC2	ZINC000819215927	GH	On-Demand	Anodyne	ACOX1	52	37
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccc(Br)cc1)CCC2	ZINC000819215928	GH	On-Demand	Anodyne	ADRB2	26	41
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccc(Br)cc1)CCC2	ZINC000819215928	GH	On-Demand	Anodyne	ADRB1	33	40
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccc(Br)cc1)CCC2	ZINC000819215928	GH	On-Demand	Anodyne	ADRB3	17	40
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccc(Br)cc1)CCC2	ZINC000819215928	GH	On-Demand	Anodyne	ACOX1	52	37
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccc(Br)cc1)CCC2	ZINC000819215929	GH	On-Demand	Anodyne	ADRB2	26	41
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccc(Br)cc1)CCC2	ZINC000819215929	GH	On-Demand	Anodyne	ADRB1	33	40
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccc(Br)cc1)CCC2	ZINC000819215929	GH	On-Demand	Anodyne	ADRB3	17	40
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccc(Br)cc1)CCC2	ZINC000819215929	GH	On-Demand	Anodyne	ACOX1	52	37
C[C@@H](CC(=O)N1CCCN(C(=O)Oc2ccccc2)CC1)n1cccn1	ZINC000819215937	FF	On-Demand	Anodyne	PTAFR	27	40
O=C(Cc1cc(F)cc2c1OCOC2)Nc1cccnc1Cl	ZINC000819215939	DF	On-Demand	Anodyne	G2YM83_BOTF4	67	34
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1F	ZINC000819215942	DG	On-Demand	Anodyne	ADRB2	57	40
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1F	ZINC000819215942	DG	On-Demand	Anodyne	ADRB1	54	40
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1F	ZINC000819215942	DG	On-Demand	Anodyne	ADRB3	54	40
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1F	ZINC000819215943	DG	On-Demand	Anodyne	ADRB2	57	40
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1F	ZINC000819215943	DG	On-Demand	Anodyne	ADRB1	54	40
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1F	ZINC000819215943	DG	On-Demand	Anodyne	ADRB3	54	40
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1	ZINC000819215944	CF	On-Demand	Anodyne	ADRB2	71	60
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1	ZINC000819215944	CF	On-Demand	Anodyne	ADRB1	81	48
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1	ZINC000819215944	CF	On-Demand	Anodyne	ADRB3	129	50
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1	ZINC000819215945	CF	On-Demand	Anodyne	ADRB2	71	60
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1	ZINC000819215945	CF	On-Demand	Anodyne	ADRB1	81	48
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1	ZINC000819215945	CF	On-Demand	Anodyne	ADRB3	129	50
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccccc1Cl)CCC2	ZINC000819215946	FH	On-Demand	Anodyne	ADRB2	29	43
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccccc1Cl)CCC2	ZINC000819215946	FH	On-Demand	Anodyne	ADRB3	15	47
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccccc1Cl)CCC2	ZINC000819215947	FH	On-Demand	Anodyne	ADRB2	29	43
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccccc1Cl)CCC2	ZINC000819215947	FH	On-Demand	Anodyne	ADRB3	15	47
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccccc1Cl)CCC2	ZINC000819215948	FH	On-Demand	Anodyne	ADRB2	29	43
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccccc1Cl)CCC2	ZINC000819215948	FH	On-Demand	Anodyne	ADRB3	15	47
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccccc1Cl)CCC2	ZINC000819215949	FH	On-Demand	Anodyne	ADRB2	29	43
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccccc1Cl)CCC2	ZINC000819215949	FH	On-Demand	Anodyne	ADRB3	15	47
CS(=O)(=O)NCCc1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819215985	FE	On-Demand	Anodyne	TRPV1	16	44
CS(=O)(=O)NCCc1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819215985	FE	On-Demand	Anodyne	HDAC1	37	42
CS(=O)(=O)NCCc1ccc(C(=O)Nc2cccnc2Cl)cc1	ZINC000819215985	FE	On-Demand	Anodyne	G2YM83_BOTF4	75	39
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819215986	EH	On-Demand	Anodyne	ADRB2	37	44
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819215986	EH	On-Demand	Anodyne	ADRB1	35	45
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819215986	EH	On-Demand	Anodyne	ADRB3	53	45
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819215987	EH	On-Demand	Anodyne	ADRB2	37	44
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819215987	EH	On-Demand	Anodyne	ADRB1	35	45
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819215987	EH	On-Demand	Anodyne	ADRB3	53	45
CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)Nc2cccnc2Cl)c1	ZINC000819216086	HG	On-Demand	Anodyne	KCNQ2	45	34
CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)Nc2cccnc2Cl)c1	ZINC000819216086	HG	On-Demand	Anodyne	GRM4	42	35
CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)Nc2cccnc2Cl)c1	ZINC000819216086	HG	On-Demand	Anodyne	G2YM83_BOTF4	75	40
COc1ccc(OC)c([C@H](O)CNCCc2cc(F)c(F)c(F)c2)c1	ZINC000819216101	FF	On-Demand	Anodyne	ADRB2	41	54
COc1ccc(OC)c([C@H](O)CNCCc2cc(F)c(F)c(F)c2)c1	ZINC000819216101	FF	On-Demand	Anodyne	ADRB1	47	41
COc1ccc(OC)c([C@H](O)CNCCc2cc(F)c(F)c(F)c2)c1	ZINC000819216101	FF	On-Demand	Anodyne	ADRB3	38	42
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)CCC2	ZINC000819216113	FF	On-Demand	Bother	ACOX1	47	38
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)CCC2	ZINC000819216114	FF	On-Demand	Bother	ACOX1	47	38
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)CCC2	ZINC000819216115	FF	On-Demand	Bother	ACOX1	47	38
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)CCC2	ZINC000819216116	FF	On-Demand	Bother	ACOX1	47	38
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccc3ccccc3c1)CCC2	ZINC000819216121	FI	On-Demand	Anodyne	ADRB2	35	50
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccc3ccccc3c1)CCC2	ZINC000819216121	FI	On-Demand	Anodyne	ADRB3	22	43
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccc3ccccc3c1)CCC2	ZINC000819216121	FI	On-Demand	Anodyne	ACOX1	79	43
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1ccc(F)c(Cl)c1	ZINC000819216123	EE	On-Demand	Anodyne	ADRB3	55	45
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1ccc(F)c(Cl)c1	ZINC000819216124	EE	On-Demand	Anodyne	ADRB3	55	45
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1ccc(F)c(Cl)c1	ZINC000819216125	EE	On-Demand	Anodyne	ADRB3	55	45
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1ccc(F)c(Cl)c1	ZINC000819216126	EE	On-Demand	Anodyne	ADRB3	55	45
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccc3ccccc3c1)CCC2	ZINC000819216140	FI	On-Demand	Anodyne	ADRB2	35	50
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccc3ccccc3c1)CCC2	ZINC000819216140	FI	On-Demand	Anodyne	ADRB3	22	43
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccc3ccccc3c1)CCC2	ZINC000819216140	FI	On-Demand	Anodyne	ACOX1	79	43
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccc3ccccc3c1)CCC2	ZINC000819216142	FI	On-Demand	Anodyne	ADRB2	35	50
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccc3ccccc3c1)CCC2	ZINC000819216142	FI	On-Demand	Anodyne	ADRB3	22	43
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccc3ccccc3c1)CCC2	ZINC000819216142	FI	On-Demand	Anodyne	ACOX1	79	43
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccc3ccccc3c1)CCC2	ZINC000819216144	FI	On-Demand	Anodyne	ADRB2	35	50
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccc3ccccc3c1)CCC2	ZINC000819216144	FI	On-Demand	Anodyne	ADRB3	22	43
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccc3ccccc3c1)CCC2	ZINC000819216144	FI	On-Demand	Anodyne	ACOX1	79	43
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)c(Br)c1	ZINC000819216146	GH	On-Demand	Anodyne	ADRB2	36	47
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)c(Br)c1	ZINC000819216146	GH	On-Demand	Anodyne	ADRB1	31	43
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)c(Br)c1	ZINC000819216146	GH	On-Demand	Anodyne	ADRB3	50	43
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)c(Br)c1	ZINC000819216150	GH	On-Demand	Anodyne	ADRB2	36	47
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)c(Br)c1	ZINC000819216150	GH	On-Demand	Anodyne	ADRB1	31	43
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)c(Br)c1	ZINC000819216150	GH	On-Demand	Anodyne	ADRB3	50	43
O=C1[C@H](NC[C@H](O)c2cccnc2)CCCN1Cc1cccc(C(F)(F)F)c1	ZINC000819216176	GF	On-Demand	Anodyne	ADRB3	58	41
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCCN1Cc1cccc(C(F)(F)F)c1	ZINC000819216178	GF	On-Demand	Anodyne	ADRB3	58	41
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCCN1Cc1cccc(C(F)(F)F)c1	ZINC000819216180	GF	On-Demand	Anodyne	ADRB3	58	41
O=C(NCCNC[C@@H](O)c1ccc(F)cc1F)c1cc[nH]n1	ZINC000819216181	DC	On-Demand	Anodyne	ALPL	47	43
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCCN1Cc1cccc(C(F)(F)F)c1	ZINC000819216182	GF	On-Demand	Anodyne	ADRB3	58	41
O=C(NCCNC[C@H](O)c1ccc(F)cc1F)c1cc[nH]n1	ZINC000819216183	DC	On-Demand	Anodyne	ALPL	47	43
C[C@H](Cc1ccccc1C(F)(F)F)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819216196	FH	On-Demand	Bother	ADRB2	43	37
C[C@H](Cc1ccccc1C(F)(F)F)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819216196	FH	On-Demand	Bother	ADRB1	31	42
C[C@H](Cc1ccccc1C(F)(F)F)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819216196	FH	On-Demand	Bother	ADRB3	53	42
C[C@@H](Cc1ccccc1C(F)(F)F)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819216198	FH	On-Demand	Bother	ADRB2	43	37
C[C@@H](Cc1ccccc1C(F)(F)F)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819216198	FH	On-Demand	Bother	ADRB1	31	42
C[C@@H](Cc1ccccc1C(F)(F)F)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819216198	FH	On-Demand	Bother	ADRB3	53	42
C[C@H](Cc1ccccc1C(F)(F)F)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819216199	FH	On-Demand	Bother	ADRB2	43	37
C[C@H](Cc1ccccc1C(F)(F)F)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819216199	FH	On-Demand	Bother	ADRB1	31	42
C[C@H](Cc1ccccc1C(F)(F)F)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819216199	FH	On-Demand	Bother	ADRB3	53	42
C[C@@H](Cc1ccccc1C(F)(F)F)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819216200	FH	On-Demand	Bother	ADRB2	43	37
C[C@@H](Cc1ccccc1C(F)(F)F)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819216200	FH	On-Demand	Bother	ADRB1	31	42
C[C@@H](Cc1ccccc1C(F)(F)F)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819216200	FH	On-Demand	Bother	ADRB3	53	42
COCC[C@H](NC[C@H](O)c1cccnc1)c1ccco1	ZINC000819216208	CE	On-Demand	Anodyne	ADRB1	16	42
COCC[C@H](NC[C@H](O)c1cccnc1)c1ccco1	ZINC000819216208	CE	On-Demand	Anodyne	ADRB3	45	44
COCC[C@@H](NC[C@H](O)c1cccnc1)c1ccco1	ZINC000819216210	CE	On-Demand	Anodyne	ADRB1	16	42
COCC[C@@H](NC[C@H](O)c1cccnc1)c1ccco1	ZINC000819216210	CE	On-Demand	Anodyne	ADRB3	45	44
COCC[C@H](NC[C@@H](O)c1cccnc1)c1ccco1	ZINC000819216211	CE	On-Demand	Anodyne	ADRB1	16	42
COCC[C@H](NC[C@@H](O)c1cccnc1)c1ccco1	ZINC000819216211	CE	On-Demand	Anodyne	ADRB3	45	44
COCC[C@@H](NC[C@@H](O)c1cccnc1)c1ccco1	ZINC000819216213	CE	On-Demand	Anodyne	ADRB1	16	42
COCC[C@@H](NC[C@@H](O)c1cccnc1)c1ccco1	ZINC000819216213	CE	On-Demand	Anodyne	ADRB3	45	44
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(Br)cc1	ZINC000819216227	FH	On-Demand	Anodyne	ADRB2	35	55
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(Br)cc1	ZINC000819216227	FH	On-Demand	Anodyne	ADRB1	32	42
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(Br)cc1	ZINC000819216227	FH	On-Demand	Anodyne	ADRB3	59	42
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(Br)cc1	ZINC000819216229	FH	On-Demand	Anodyne	ADRB2	35	55
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(Br)cc1	ZINC000819216229	FH	On-Demand	Anodyne	ADRB1	32	42
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(Br)cc1	ZINC000819216229	FH	On-Demand	Anodyne	ADRB3	59	42
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819216252	FD	On-Demand	Anodyne	ADRB2	18	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819216252	FD	On-Demand	Anodyne	ADRB1	40	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819216253	FD	On-Demand	Anodyne	ADRB2	18	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819216253	FD	On-Demand	Anodyne	ADRB1	40	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819216255	FD	On-Demand	Anodyne	ADRB2	18	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819216255	FD	On-Demand	Anodyne	ADRB1	40	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819216257	FD	On-Demand	Anodyne	ADRB2	18	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819216257	FD	On-Demand	Anodyne	ADRB1	40	40
O=C(NCCNC[C@@H](O)c1ccc(F)cc1Cl)c1cc[nH]n1	ZINC000819216267	ED	On-Demand	Anodyne	ALPL	53	36
O=C(NCCNC[C@H](O)c1ccc(F)cc1Cl)c1cc[nH]n1	ZINC000819216268	ED	On-Demand	Anodyne	ALPL	53	36
O=C(N[C@H]1C[C@H]1c1ccccc1C(F)(F)F)C(F)=C1CCC1	ZINC000819216299	DI	On-Demand	Anodyne	RBP4	81	39
O=C(N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)C(F)=C1CCC1	ZINC000819216301	DI	On-Demand	Anodyne	RBP4	81	39
O=C(N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F)C(F)=C1CCC1	ZINC000819216302	DI	On-Demand	Anodyne	RBP4	81	39
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819216327	GF	On-Demand	Anodyne	ADRB1	43	36
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819216328	GF	On-Demand	Anodyne	ADRB1	43	36
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819216329	GF	On-Demand	Anodyne	ADRB1	43	36
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000819216330	GF	On-Demand	Anodyne	ADRB1	43	36
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cc(F)c(F)c(F)c2)c1	ZINC000819216366	EF	On-Demand	Bother	ADRB2	40	43
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cc(F)c(F)c(F)c2)c1	ZINC000819216366	EF	On-Demand	Bother	ADRB1	47	48
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cc(F)c(F)c(F)c2)c1	ZINC000819216366	EF	On-Demand	Bother	ADRB3	104	48
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cc(F)c(F)c(F)c2)c1	ZINC000819216368	EF	On-Demand	Bother	ADRB2	40	43
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cc(F)c(F)c(F)c2)c1	ZINC000819216368	EF	On-Demand	Bother	ADRB1	47	48
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cc(F)c(F)c(F)c2)c1	ZINC000819216368	EF	On-Demand	Bother	ADRB3	104	48
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)cc1	ZINC000819216377	DG	On-Demand	Anodyne	ADRB2	53	53
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)cc1	ZINC000819216377	DG	On-Demand	Anodyne	ADRB1	51	41
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)cc1	ZINC000819216377	DG	On-Demand	Anodyne	ADRB3	75	41
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)cc1	ZINC000819216378	DG	On-Demand	Anodyne	ADRB2	53	53
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)cc1	ZINC000819216378	DG	On-Demand	Anodyne	ADRB1	51	41
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)cc1	ZINC000819216378	DG	On-Demand	Anodyne	ADRB3	75	41
O=C(NCc1ccc(F)c(Cl)c1)C(F)=C1CCC1	ZINC000819216397	CH	On-Demand	Anodyne	SSTR3	15	41
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819216402	FH	On-Demand	Anodyne	ADRB2	42	36
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819216402	FH	On-Demand	Anodyne	ADRB1	41	40
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819216402	FH	On-Demand	Anodyne	ADRB3	50	40
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819216404	FH	On-Demand	Anodyne	ADRB2	42	36
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819216404	FH	On-Demand	Anodyne	ADRB1	41	40
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819216404	FH	On-Demand	Anodyne	ADRB3	50	40
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216417	GG	On-Demand	Anodyne	ADRB2	40	38
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216417	GG	On-Demand	Anodyne	ADRB1	66	43
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216417	GG	On-Demand	Anodyne	ADRB3	47	38
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216417	GG	On-Demand	Anodyne	ACOX1	45	37
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216418	GG	On-Demand	Anodyne	ADRB2	40	38
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216418	GG	On-Demand	Anodyne	ADRB1	66	43
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216418	GG	On-Demand	Anodyne	ADRB3	47	38
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216418	GG	On-Demand	Anodyne	ACOX1	45	37
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216419	GG	On-Demand	Anodyne	ADRB2	40	38
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216419	GG	On-Demand	Anodyne	ADRB1	66	43
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216419	GG	On-Demand	Anodyne	ADRB3	47	38
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216419	GG	On-Demand	Anodyne	ACOX1	45	37
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216420	GG	On-Demand	Anodyne	ADRB2	40	38
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216420	GG	On-Demand	Anodyne	ADRB1	66	43
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216420	GG	On-Demand	Anodyne	ADRB3	47	38
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216420	GG	On-Demand	Anodyne	ACOX1	45	37
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)cc1F	ZINC000819216436	EG	On-Demand	Anodyne	ADRB2	48	41
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)cc1F	ZINC000819216437	EG	On-Demand	Anodyne	ADRB2	48	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(F)c(Cl)c1)C2	ZINC000819216438	FF	On-Demand	Anodyne	P2RX7	50	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(F)c(Cl)c1)C2	ZINC000819216439	FF	On-Demand	Anodyne	P2RX7	50	40
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216450	GF	On-Demand	Anodyne	ADRB2	40	50
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216450	GF	On-Demand	Anodyne	ADRB1	72	50
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216450	GF	On-Demand	Anodyne	ADRB3	48	44
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216450	GF	On-Demand	Anodyne	ACOX1	55	39
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216451	GF	On-Demand	Anodyne	ADRB2	40	50
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216451	GF	On-Demand	Anodyne	ADRB1	72	50
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216451	GF	On-Demand	Anodyne	ADRB3	48	44
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216451	GF	On-Demand	Anodyne	ACOX1	55	39
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216452	GF	On-Demand	Anodyne	ADRB2	40	50
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216452	GF	On-Demand	Anodyne	ADRB1	72	50
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216452	GF	On-Demand	Anodyne	ADRB3	48	44
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216452	GF	On-Demand	Anodyne	ACOX1	55	39
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216453	GF	On-Demand	Anodyne	ADRB2	40	50
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216453	GF	On-Demand	Anodyne	ADRB1	72	50
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216453	GF	On-Demand	Anodyne	ADRB3	48	44
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216453	GF	On-Demand	Anodyne	ACOX1	55	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cc(-c3ccccc3)on1)C2	ZINC000819216462	FF	On-Demand	Anodyne	PDE8B	57	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cc(-c3ccccc3)on1)C2	ZINC000819216463	FF	On-Demand	Anodyne	PDE8B	57	33
CS(=O)(=O)NCCc1ccc(C(=O)Nc2cccnc2Cl)s1	ZINC000819216464	FE	On-Demand	Anodyne	G2YM83_BOTF4	72	35
C[C@H](Cc1ccccc1C(F)(F)F)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819216471	EH	On-Demand	Mild	CTSF	52	34
C[C@H](Cc1ccccc1C(F)(F)F)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819216471	EH	On-Demand	Mild	CTSK	18	40
C[C@H](Cc1ccccc1C(F)(F)F)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819216472	EH	On-Demand	Mild	CTSF	52	34
C[C@H](Cc1ccccc1C(F)(F)F)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819216472	EH	On-Demand	Mild	CTSK	18	40
C[C@@H](Cc1ccccc1C(F)(F)F)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819216473	EH	On-Demand	Mild	CTSF	52	34
C[C@@H](Cc1ccccc1C(F)(F)F)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819216473	EH	On-Demand	Mild	CTSK	18	40
C[C@@H](Cc1ccccc1C(F)(F)F)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819216474	EH	On-Demand	Mild	CTSF	52	34
C[C@@H](Cc1ccccc1C(F)(F)F)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819216474	EH	On-Demand	Mild	CTSK	18	40
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000819216489	EG	On-Demand	Anodyne	RBP4	77	38
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000819216490	EG	On-Demand	Anodyne	RBP4	77	38
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F	ZINC000819216491	EG	On-Demand	Anodyne	RBP4	77	38
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F	ZINC000819216492	EG	On-Demand	Anodyne	RBP4	77	38
O=C(Cc1csc(-c2cccc(Br)c2)n1)Nc1cccnc1Cl	ZINC000819216539	HJ	On-Demand	Anodyne	G2YM83_BOTF4	66	32
C=CCC1(C(=O)Nc2cccc(OCCS(C)(=O)=O)c2)CCOCC1	ZINC000819216544	FE	On-Demand	Mild	EPHX2	18	42
C=CCC1(C(=O)Nc2cccc(OCCS(C)(=O)=O)c2)CCOCC1	ZINC000819216544	FE	On-Demand	Mild	LIMK2	22	44
COCCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819216548	GD	On-Demand	Anodyne	ADRB2	28	49
COCCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819216548	GD	On-Demand	Anodyne	ADRB1	56	49
COCCc1ccc(OC[C@@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819216548	GD	On-Demand	Anodyne	ADRB3	37	41
COCCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819216549	GD	On-Demand	Anodyne	ADRB2	28	49
COCCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819216549	GD	On-Demand	Anodyne	ADRB1	56	49
COCCc1ccc(OC[C@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819216549	GD	On-Demand	Anodyne	ADRB3	37	41
COCCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819216550	GD	On-Demand	Anodyne	ADRB2	28	49
COCCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819216550	GD	On-Demand	Anodyne	ADRB1	56	49
COCCc1ccc(OC[C@H](O)CNC[C@H]2COC3(CCOCC3)O2)cc1	ZINC000819216550	GD	On-Demand	Anodyne	ADRB3	37	41
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819216551	GD	On-Demand	Anodyne	ADRB2	28	49
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819216551	GD	On-Demand	Anodyne	ADRB1	56	49
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2COC3(CCOCC3)O2)cc1	ZINC000819216551	GD	On-Demand	Anodyne	ADRB3	37	41
O[C@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1ccccc1	ZINC000819216566	DC	On-Demand	Anodyne	ADRB2	30	46
O[C@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1ccccc1	ZINC000819216566	DC	On-Demand	Anodyne	ADRB1	48	40
O[C@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1ccccc1	ZINC000819216566	DC	On-Demand	Anodyne	ADRB3	32	40
O[C@@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1ccccc1	ZINC000819216567	DC	On-Demand	Anodyne	ADRB2	30	46
O[C@@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1ccccc1	ZINC000819216567	DC	On-Demand	Anodyne	ADRB1	48	40
O[C@@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1ccccc1	ZINC000819216567	DC	On-Demand	Anodyne	ADRB3	32	40
O[C@@H](CNC[C@H]1COC2(CCOCC2)O1)COc1ccccc1	ZINC000819216568	DC	On-Demand	Anodyne	ADRB2	30	46
O[C@@H](CNC[C@H]1COC2(CCOCC2)O1)COc1ccccc1	ZINC000819216568	DC	On-Demand	Anodyne	ADRB1	48	40
O[C@@H](CNC[C@H]1COC2(CCOCC2)O1)COc1ccccc1	ZINC000819216568	DC	On-Demand	Anodyne	ADRB3	32	40
O[C@H](CNC[C@H]1COC2(CCOCC2)O1)COc1ccccc1	ZINC000819216569	DC	On-Demand	Anodyne	ADRB2	30	46
O[C@H](CNC[C@H]1COC2(CCOCC2)O1)COc1ccccc1	ZINC000819216569	DC	On-Demand	Anodyne	ADRB1	48	40
O[C@H](CNC[C@H]1COC2(CCOCC2)O1)COc1ccccc1	ZINC000819216569	DC	On-Demand	Anodyne	ADRB3	32	40
Cc1ccc2c(c1)[C@@H](NC[C@@H](O)c1ccccc1)[C@@H](C)C2	ZINC000819216596	CH	On-Demand	Anodyne	ADRB3	19	41
Cc1ccc2c(c1)[C@@H](NC[C@@H](O)c1ccccc1)[C@H](C)C2	ZINC000819216597	CH	On-Demand	Anodyne	ADRB3	19	41
CCC[C@@H](NC(=O)C(F)=C1CCC1)C(=O)Nc1cccc(N2CCCC2)c1	ZINC000819216608	FH	On-Demand	Anodyne	KCNQ2	40	38
CCC[C@H](NC(=O)C(F)=C1CCC1)C(=O)Nc1cccc(N2CCCC2)c1	ZINC000819216609	FH	On-Demand	Anodyne	KCNQ2	40	38
CCOc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216612	FG	On-Demand	Anodyne	ADRB2	32	41
CCOc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216612	FG	On-Demand	Anodyne	ADRB3	20	43
CCOc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216612	FG	On-Demand	Anodyne	ACOX1	44	38
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216613	FG	On-Demand	Anodyne	ADRB2	32	41
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216613	FG	On-Demand	Anodyne	ADRB3	20	43
CCOc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216613	FG	On-Demand	Anodyne	ACOX1	44	38
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216614	FG	On-Demand	Anodyne	ADRB2	32	41
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216614	FG	On-Demand	Anodyne	ADRB3	20	43
CCOc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216614	FG	On-Demand	Anodyne	ACOX1	44	38
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216615	FG	On-Demand	Anodyne	ADRB2	32	41
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216615	FG	On-Demand	Anodyne	ADRB3	20	43
CCOc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216615	FG	On-Demand	Anodyne	ACOX1	44	38
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cc(F)c(F)c(F)c2)cc1	ZINC000819216618	EF	On-Demand	Bother	ADRB2	33	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cc(F)c(F)c(F)c2)cc1	ZINC000819216618	EF	On-Demand	Bother	ADRB1	33	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cc(F)c(F)c(F)c2)cc1	ZINC000819216618	EF	On-Demand	Bother	ADRB3	66	42
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cc(F)c(F)c(F)c2)cc1	ZINC000819216619	EF	On-Demand	Bother	ADRB2	33	42
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cc(F)c(F)c(F)c2)cc1	ZINC000819216619	EF	On-Demand	Bother	ADRB1	33	42
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cc(F)c(F)c(F)c2)cc1	ZINC000819216619	EF	On-Demand	Bother	ADRB3	66	42
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)cc1Cl	ZINC000819216655	EH	On-Demand	Anodyne	ADRB1	38	40
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)cc1Cl	ZINC000819216655	EH	On-Demand	Anodyne	ADRB3	27	40
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)cc1Cl	ZINC000819216656	EH	On-Demand	Anodyne	ADRB1	38	40
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)cc1Cl	ZINC000819216656	EH	On-Demand	Anodyne	ADRB3	27	40
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(OC(F)(F)F)cc1	ZINC000819216669	GH	On-Demand	Anodyne	ADRB2	53	46
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(OC(F)(F)F)cc1	ZINC000819216669	GH	On-Demand	Anodyne	ADRB1	57	42
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(OC(F)(F)F)cc1	ZINC000819216669	GH	On-Demand	Anodyne	ADRB3	74	49
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(OC(F)(F)F)cc1	ZINC000819216670	GH	On-Demand	Anodyne	ADRB2	53	46
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(OC(F)(F)F)cc1	ZINC000819216670	GH	On-Demand	Anodyne	ADRB1	57	42
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(OC(F)(F)F)cc1	ZINC000819216670	GH	On-Demand	Anodyne	ADRB3	74	49
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216679	EG	On-Demand	Anodyne	ADRB2	32	46
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216679	EG	On-Demand	Anodyne	ADRB1	40	41
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216679	EG	On-Demand	Anodyne	ADRB3	21	41
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216679	EG	On-Demand	Anodyne	ACOX1	70	40
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216680	EG	On-Demand	Anodyne	ADRB2	32	46
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216680	EG	On-Demand	Anodyne	ADRB1	40	41
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216680	EG	On-Demand	Anodyne	ADRB3	21	41
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819216680	EG	On-Demand	Anodyne	ACOX1	70	40
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216681	EG	On-Demand	Anodyne	ADRB2	32	46
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216681	EG	On-Demand	Anodyne	ADRB1	40	41
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216681	EG	On-Demand	Anodyne	ADRB3	21	41
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216681	EG	On-Demand	Anodyne	ACOX1	70	40
Cc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216682	EG	On-Demand	Anodyne	ADRB2	32	46
Cc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216682	EG	On-Demand	Anodyne	ADRB1	40	41
Cc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216682	EG	On-Demand	Anodyne	ADRB3	21	41
Cc1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819216682	EG	On-Demand	Anodyne	ACOX1	70	40
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccnc2Cl)n(C)c1	ZINC000819216683	FE	On-Demand	Anodyne	G2YM83_BOTF4	73	38
O[C@@H](CNC[C@H]1COC2(CCOCC2)O1)COc1ccccc1Cl	ZINC000819216722	FD	On-Demand	Anodyne	ADRA1B	15	42
O[C@H](CNC[C@H]1COC2(CCOCC2)O1)COc1ccccc1Cl	ZINC000819216723	FD	On-Demand	Anodyne	ADRA1B	15	42
O[C@@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1ccccc1Cl	ZINC000819216724	FD	On-Demand	Anodyne	ADRA1B	15	42
O[C@H](CNC[C@@H]1COC2(CCOCC2)O1)COc1ccccc1Cl	ZINC000819216725	FD	On-Demand	Anodyne	ADRA1B	15	42
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1cccc3[nH]ccc13)CCC2	ZINC000819216821	FG	On-Demand	Anodyne	ADRB2	21	63
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1cccc3[nH]ccc13)CCC2	ZINC000819216821	FG	On-Demand	Anodyne	ADRB1	23	63
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1cccc3[nH]ccc13)CCC2	ZINC000819216821	FG	On-Demand	Anodyne	HTR1A	17	63
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1cccc3[nH]ccc13)CCC2	ZINC000819216821	FG	On-Demand	Anodyne	SLC6A4	20	46
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1cccc3[nH]ccc13)CCC2	ZINC000819216822	FG	On-Demand	Anodyne	ADRB2	21	63
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1cccc3[nH]ccc13)CCC2	ZINC000819216822	FG	On-Demand	Anodyne	ADRB1	23	63
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1cccc3[nH]ccc13)CCC2	ZINC000819216822	FG	On-Demand	Anodyne	HTR1A	17	63
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1cccc3[nH]ccc13)CCC2	ZINC000819216822	FG	On-Demand	Anodyne	SLC6A4	20	46
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1cccc3[nH]ccc13)CCC2	ZINC000819216823	FG	On-Demand	Anodyne	ADRB2	21	63
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1cccc3[nH]ccc13)CCC2	ZINC000819216823	FG	On-Demand	Anodyne	ADRB1	23	63
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1cccc3[nH]ccc13)CCC2	ZINC000819216823	FG	On-Demand	Anodyne	HTR1A	17	63
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1cccc3[nH]ccc13)CCC2	ZINC000819216823	FG	On-Demand	Anodyne	SLC6A4	20	46
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1cccc3[nH]ccc13)CCC2	ZINC000819216824	FG	On-Demand	Anodyne	ADRB2	21	63
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1cccc3[nH]ccc13)CCC2	ZINC000819216824	FG	On-Demand	Anodyne	ADRB1	23	63
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1cccc3[nH]ccc13)CCC2	ZINC000819216824	FG	On-Demand	Anodyne	HTR1A	17	63
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1cccc3[nH]ccc13)CCC2	ZINC000819216824	FG	On-Demand	Anodyne	SLC6A4	20	46
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1Cl	ZINC000819216827	EH	On-Demand	Anodyne	ADRB2	52	41
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1Cl	ZINC000819216827	EH	On-Demand	Anodyne	ADRB1	50	43
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1Cl	ZINC000819216827	EH	On-Demand	Anodyne	ADRB3	47	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCNC(=O)c2cc[nH]n2)CC1	ZINC000819216856	GC	On-Demand	Anodyne	GPR119	48	48
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCNC(=O)c2cc[nH]n2)CC1	ZINC000819216857	GC	On-Demand	Anodyne	GPR119	48	48
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccccc1C)CCC2	ZINC000819216862	EG	On-Demand	Anodyne	ADRB2	34	48
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccccc1C)CCC2	ZINC000819216862	EG	On-Demand	Anodyne	ADRB3	16	48
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccccc1C)CCC2	ZINC000819216863	EG	On-Demand	Anodyne	ADRB2	34	48
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccccc1C)CCC2	ZINC000819216863	EG	On-Demand	Anodyne	ADRB3	16	48
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccccc1C)CCC2	ZINC000819216864	EG	On-Demand	Anodyne	ADRB2	34	48
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccccc1C)CCC2	ZINC000819216864	EG	On-Demand	Anodyne	ADRB3	16	48
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccccc1C)CCC2	ZINC000819216865	EG	On-Demand	Anodyne	ADRB2	34	48
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccccc1C)CCC2	ZINC000819216865	EG	On-Demand	Anodyne	ADRB3	16	48
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(CCCc2ccccc2)CC1	ZINC000819216869	EF	On-Demand	Anodyne	HRH3	15	41
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(CCCc2ccccc2)CC1	ZINC000819216869	EF	On-Demand	Anodyne	SIGMAR1	44	49
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(CCCc2ccccc2)CC1	ZINC000819216869	EF	On-Demand	Anodyne	CYP2J2	49	37
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(CCCc2ccccc2)CC1	ZINC000819216870	EF	On-Demand	Anodyne	HRH3	15	41
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(CCCc2ccccc2)CC1	ZINC000819216870	EF	On-Demand	Anodyne	SIGMAR1	44	49
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(CCCc2ccccc2)CC1	ZINC000819216870	EF	On-Demand	Anodyne	CYP2J2	49	37
O=C(/C=C/[C@H]1CCCO1)N1CCCN(CCCc2ccccc2)CC1	ZINC000819216871	EF	On-Demand	Anodyne	HRH3	15	41
O=C(/C=C/[C@H]1CCCO1)N1CCCN(CCCc2ccccc2)CC1	ZINC000819216871	EF	On-Demand	Anodyne	SIGMAR1	44	49
O=C(/C=C/[C@H]1CCCO1)N1CCCN(CCCc2ccccc2)CC1	ZINC000819216871	EF	On-Demand	Anodyne	CYP2J2	49	37
O=C(/C=C\[C@H]1CCCO1)N1CCCN(CCCc2ccccc2)CC1	ZINC000819216872	EF	On-Demand	Anodyne	HRH3	15	41
O=C(/C=C\[C@H]1CCCO1)N1CCCN(CCCc2ccccc2)CC1	ZINC000819216872	EF	On-Demand	Anodyne	SIGMAR1	44	49
O=C(/C=C\[C@H]1CCCO1)N1CCCN(CCCc2ccccc2)CC1	ZINC000819216872	EF	On-Demand	Anodyne	CYP2J2	49	37
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1Br	ZINC000819216881	FH	On-Demand	Anodyne	ADRB2	45	37
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1Br	ZINC000819216881	FH	On-Demand	Anodyne	ADRB1	41	38
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1Br	ZINC000819216881	FH	On-Demand	Anodyne	ADRB3	47	38
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1Br	ZINC000819216882	FH	On-Demand	Anodyne	ADRB2	45	37
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1Br	ZINC000819216882	FH	On-Demand	Anodyne	ADRB1	41	38
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccccc1Br	ZINC000819216882	FH	On-Demand	Anodyne	ADRB3	47	38
O=C(NCCNC[C@@H](O)c1ccccc1)c1cc[nH]n1	ZINC000819216883	CC	On-Demand	Anodyne	ADRB2	17	40
O=C(NCCNC[C@@H](O)c1ccccc1)c1cc[nH]n1	ZINC000819216883	CC	On-Demand	Anodyne	ADRB1	41	38
O=C(NCCNC[C@@H](O)c1ccccc1)c1cc[nH]n1	ZINC000819216883	CC	On-Demand	Anodyne	ADRB3	63	46
O=C(NCCNC[C@H](O)c1ccccc1)c1cc[nH]n1	ZINC000819216884	CC	On-Demand	Anodyne	ADRB2	17	40
O=C(NCCNC[C@H](O)c1ccccc1)c1cc[nH]n1	ZINC000819216884	CC	On-Demand	Anodyne	ADRB1	41	38
O=C(NCCNC[C@H](O)c1ccccc1)c1cc[nH]n1	ZINC000819216884	CC	On-Demand	Anodyne	ADRB3	63	46
O=C(NCCNC[C@@H](O)c1ccc(Cl)c(F)c1)c1cc[nH]n1	ZINC000819216927	ED	On-Demand	Anodyne	ALPL	53	38
O=C(NCCNC[C@H](O)c1ccc(Cl)c(F)c1)c1cc[nH]n1	ZINC000819216929	ED	On-Demand	Anodyne	ALPL	53	38
N#Cc1ccc([C@@H](O)CNCCNC(=O)c2cc[nH]n2)cc1	ZINC000819216931	CC	On-Demand	Mild	ADRB1	42	32
N#Cc1ccc([C@H](O)CNCCNC(=O)c2cc[nH]n2)cc1	ZINC000819216935	CC	On-Demand	Mild	ADRB1	42	32
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC(=O)Nc1ccc(-n2cccn2)cc1	ZINC000819216937	GD	On-Demand	Anodyne	AMP1_PLAFQ	32	46
O=C(/C=C/[C@@H]1CCCO1)NCC(=O)Nc1ccc(-n2cccn2)cc1	ZINC000819216995	ED	On-Demand	Anodyne	AMP1_PLAFQ	41	33
O=C(/C=C\[C@H]1CCCO1)NCC(=O)Nc1ccc(-n2cccn2)cc1	ZINC000819216997	ED	On-Demand	Anodyne	AMP1_PLAFQ	41	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F)C2	ZINC000819216998	GH	On-Demand	Anodyne	RBP4	79	35
O=C(/C=C\[C@@H]1CCCO1)NCC(=O)Nc1ccc(-n2cccn2)cc1	ZINC000819216999	ED	On-Demand	Anodyne	AMP1_PLAFQ	41	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)C2	ZINC000819217000	GH	On-Demand	Anodyne	RBP4	79	35
O=C(/C=C/[C@H]1CCCO1)NCC(=O)Nc1ccc(-n2cccn2)cc1	ZINC000819217001	ED	On-Demand	Anodyne	AMP1_PLAFQ	41	33
O=C(Oc1ccccc1)N1CCCN(C(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819217002	GE	On-Demand	Anodyne	CCKAR	37	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F)C2	ZINC000819217003	GH	On-Demand	Anodyne	RBP4	79	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1C[C@H]1c1ccccc1C(F)(F)F)C2	ZINC000819217005	GH	On-Demand	Anodyne	RBP4	79	35
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819217032	FH	On-Demand	Anodyne	ADRB2	37	42
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819217032	FH	On-Demand	Anodyne	ADRB1	38	46
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819217032	FH	On-Demand	Anodyne	ADRB3	84	46
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819217034	FH	On-Demand	Anodyne	ADRB2	37	42
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819217034	FH	On-Demand	Anodyne	ADRB1	38	46
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819217034	FH	On-Demand	Anodyne	ADRB3	84	46
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(Cl)cc1	ZINC000819217041	EH	On-Demand	Anodyne	ADRB2	44	52
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(Cl)cc1	ZINC000819217041	EH	On-Demand	Anodyne	ADRB1	49	47
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(Cl)cc1	ZINC000819217041	EH	On-Demand	Anodyne	ADRB3	74	47
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)cn1	ZINC000819217063	DF	On-Demand	Anodyne	ADRB2	19	41
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)cn1	ZINC000819217063	DF	On-Demand	Anodyne	ADRB3	38	41
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)cn1	ZINC000819217064	DF	On-Demand	Anodyne	ADRB2	19	41
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(F)cn1	ZINC000819217064	DF	On-Demand	Anodyne	ADRB3	38	41
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819217083	GF	On-Demand	Anodyne	ADRB2	37	42
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819217083	GF	On-Demand	Anodyne	ADRB1	52	38
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819217083	GF	On-Demand	Anodyne	ADRB3	34	40
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819217083	GF	On-Demand	Anodyne	ACOX1	51	39
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819217084	GF	On-Demand	Anodyne	ADRB2	37	42
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819217084	GF	On-Demand	Anodyne	ADRB1	52	38
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819217084	GF	On-Demand	Anodyne	ADRB3	34	40
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819217084	GF	On-Demand	Anodyne	ACOX1	51	39
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819217085	GF	On-Demand	Anodyne	ADRB2	37	42
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819217085	GF	On-Demand	Anodyne	ADRB1	52	38
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819217085	GF	On-Demand	Anodyne	ADRB3	34	40
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819217085	GF	On-Demand	Anodyne	ACOX1	51	39
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819217086	GF	On-Demand	Anodyne	ADRB2	37	42
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819217086	GF	On-Demand	Anodyne	ADRB1	52	38
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819217086	GF	On-Demand	Anodyne	ADRB3	34	40
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819217086	GF	On-Demand	Anodyne	ACOX1	51	39
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccc(Cl)cc1)CCC2	ZINC000819217117	FH	On-Demand	Anodyne	ADRB2	28	41
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccc(Cl)cc1)CCC2	ZINC000819217117	FH	On-Demand	Anodyne	ADRB1	35	40
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccc(Cl)cc1)CCC2	ZINC000819217117	FH	On-Demand	Anodyne	ADRB3	19	40
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccc(Cl)cc1)CCC2	ZINC000819217117	FH	On-Demand	Anodyne	ACOX1	56	37
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1)CCC2	ZINC000819217118	FH	On-Demand	Anodyne	ADRB2	28	41
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1)CCC2	ZINC000819217118	FH	On-Demand	Anodyne	ADRB1	35	40
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1)CCC2	ZINC000819217118	FH	On-Demand	Anodyne	ADRB3	19	40
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1)CCC2	ZINC000819217118	FH	On-Demand	Anodyne	ACOX1	56	37
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccc(Cl)cc1)CCC2	ZINC000819217119	FH	On-Demand	Anodyne	ADRB2	28	41
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccc(Cl)cc1)CCC2	ZINC000819217119	FH	On-Demand	Anodyne	ADRB1	35	40
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccc(Cl)cc1)CCC2	ZINC000819217119	FH	On-Demand	Anodyne	ADRB3	19	40
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccc(Cl)cc1)CCC2	ZINC000819217119	FH	On-Demand	Anodyne	ACOX1	56	37
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccc(Cl)cc1)CCC2	ZINC000819217120	FH	On-Demand	Anodyne	ADRB2	28	41
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccc(Cl)cc1)CCC2	ZINC000819217120	FH	On-Demand	Anodyne	ADRB1	35	40
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccc(Cl)cc1)CCC2	ZINC000819217120	FH	On-Demand	Anodyne	ADRB3	19	40
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccc(Cl)cc1)CCC2	ZINC000819217120	FH	On-Demand	Anodyne	ACOX1	56	37
O=C(NCCNC[C@@H](O)c1cccc(Cl)c1)c1cc[nH]n1	ZINC000819217129	DD	On-Demand	Anodyne	ADRB2	36	40
O=C(NCCNC[C@@H](O)c1cccc(Cl)c1)c1cc[nH]n1	ZINC000819217129	DD	On-Demand	Anodyne	ADRB1	56	48
O=C(NCCNC[C@@H](O)c1cccc(Cl)c1)c1cc[nH]n1	ZINC000819217129	DD	On-Demand	Anodyne	ADRB3	72	48
O=C(NCCNC[C@@H](O)c1cccc(Cl)c1)c1cc[nH]n1	ZINC000819217129	DD	On-Demand	Anodyne	ALPL	52	37
O=C(NCCNC[C@@H](O)c1cccc(Cl)c1)c1cc[nH]n1	ZINC000819217129	DD	On-Demand	Anodyne	CYP3A4	41	32
O=C(NCCNC[C@H](O)c1cccc(Cl)c1)c1cc[nH]n1	ZINC000819217130	DD	On-Demand	Anodyne	ADRB2	36	40
O=C(NCCNC[C@H](O)c1cccc(Cl)c1)c1cc[nH]n1	ZINC000819217130	DD	On-Demand	Anodyne	ADRB1	56	48
O=C(NCCNC[C@H](O)c1cccc(Cl)c1)c1cc[nH]n1	ZINC000819217130	DD	On-Demand	Anodyne	ADRB3	72	48
O=C(NCCNC[C@H](O)c1cccc(Cl)c1)c1cc[nH]n1	ZINC000819217130	DD	On-Demand	Anodyne	ALPL	52	37
O=C(NCCNC[C@H](O)c1cccc(Cl)c1)c1cc[nH]n1	ZINC000819217130	DD	On-Demand	Anodyne	CYP3A4	41	32
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)c1	ZINC000819217135	FG	On-Demand	Anodyne	ADRB2	24	42
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)c1	ZINC000819217135	FG	On-Demand	Anodyne	ADRB3	19	40
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)c1	ZINC000819217135	FG	On-Demand	Anodyne	ACOX1	55	40
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)c1	ZINC000819217136	FG	On-Demand	Anodyne	ADRB2	24	42
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)c1	ZINC000819217136	FG	On-Demand	Anodyne	ADRB3	19	40
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)c1	ZINC000819217136	FG	On-Demand	Anodyne	ACOX1	55	40
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)c1	ZINC000819217137	FG	On-Demand	Anodyne	ADRB2	24	42
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)c1	ZINC000819217137	FG	On-Demand	Anodyne	ADRB3	19	40
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)c1	ZINC000819217137	FG	On-Demand	Anodyne	ACOX1	55	40
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)c1	ZINC000819217138	FG	On-Demand	Anodyne	ADRB2	24	42
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)c1	ZINC000819217138	FG	On-Demand	Anodyne	ADRB3	19	40
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)c1	ZINC000819217138	FG	On-Demand	Anodyne	ACOX1	55	40
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccccc1F)CCC2	ZINC000819217139	EF	On-Demand	Anodyne	ADRB2	28	42
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccccc1F)CCC2	ZINC000819217139	EF	On-Demand	Anodyne	ADRB3	15	47
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccccc1F)CCC2	ZINC000819217140	EF	On-Demand	Anodyne	ADRB2	28	42
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccccc1F)CCC2	ZINC000819217140	EF	On-Demand	Anodyne	ADRB3	15	47
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccccc1F)CCC2	ZINC000819217141	EF	On-Demand	Anodyne	ADRB2	28	42
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccccc1F)CCC2	ZINC000819217141	EF	On-Demand	Anodyne	ADRB3	15	47
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccccc1F)CCC2	ZINC000819217142	EF	On-Demand	Anodyne	ADRB2	28	42
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccccc1F)CCC2	ZINC000819217142	EF	On-Demand	Anodyne	ADRB3	15	47
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(Cl)c1	ZINC000819217155	EH	On-Demand	Anodyne	ADRB2	68	46
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(Cl)c1	ZINC000819217155	EH	On-Demand	Anodyne	ADRB1	86	63
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(Cl)c1	ZINC000819217155	EH	On-Demand	Anodyne	ADRB3	128	63
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(Cl)c1	ZINC000819217156	EH	On-Demand	Anodyne	ADRB2	68	46
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(Cl)c1	ZINC000819217156	EH	On-Demand	Anodyne	ADRB1	86	63
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(Cl)c1	ZINC000819217156	EH	On-Demand	Anodyne	ADRB3	128	63
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccc(C#N)cc1)CCC2	ZINC000819217158	EF	On-Demand	Mild	ADRB2	25	41
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccc(C#N)cc1)CCC2	ZINC000819217159	EF	On-Demand	Mild	ADRB2	25	41
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccc(C#N)cc1)CCC2	ZINC000819217160	EF	On-Demand	Mild	ADRB2	25	41
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccc(C#N)cc1)CCC2	ZINC000819217161	EF	On-Demand	Mild	ADRB2	25	41
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1cccc(Br)c1)CCC2	ZINC000819217173	GH	On-Demand	Anodyne	ACOX1	59	39
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1cccc(Br)c1)CCC2	ZINC000819217174	GH	On-Demand	Anodyne	ACOX1	59	39
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1cccc(Br)c1)CCC2	ZINC000819217175	GH	On-Demand	Anodyne	ACOX1	59	39
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1cccc(Br)c1)CCC2	ZINC000819217176	GH	On-Demand	Anodyne	ACOX1	59	39
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(F)c(Cl)c1	ZINC000819217177	CF	On-Demand	Anodyne	SSTR3	18	41
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(F)c(Cl)c1	ZINC000819217178	CF	On-Demand	Anodyne	SSTR3	18	41
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(F)c(Cl)c1	ZINC000819217179	CF	On-Demand	Anodyne	SSTR3	18	41
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(F)c(Cl)c1	ZINC000819217180	CF	On-Demand	Anodyne	SSTR3	18	41
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccc(Cl)c(Cl)c1)CCC2	ZINC000819217188	GI	On-Demand	Anodyne	ACOX1	81	40
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccc(Cl)c(Cl)c1)CCC2	ZINC000819217189	GI	On-Demand	Anodyne	ACOX1	81	40
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccc(Cl)c(Cl)c1)CCC2	ZINC000819217190	GI	On-Demand	Anodyne	ACOX1	81	40
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccc(Cl)c(Cl)c1)CCC2	ZINC000819217191	GI	On-Demand	Anodyne	ACOX1	81	40
CC(=O)Nc1cccc(CC(=O)N2CCCN(C(=O)Oc3ccccc3)CC2)c1	ZINC000819217201	GF	On-Demand	Anodyne	CCR3	21	40
CC(=O)Nc1cccc(CC(=O)N2CCCN(C(=O)Oc3ccccc3)CC2)c1	ZINC000819217201	GF	On-Demand	Anodyne	FAAH	23	41
CC(=O)Nc1cccc(CC(=O)N2CCCN(C(=O)Oc3ccccc3)CC2)c1	ZINC000819217201	GF	On-Demand	Anodyne	F13A1	33	43
CC(=O)Nc1cccc(CC(=O)N2CCCN(C(=O)Oc3ccccc3)CC2)c1	ZINC000819217201	GF	On-Demand	Anodyne	P2RY14	42	33
O=C(NCCNC[C@@H](O)c1cc(F)ccc1F)c1cc[nH]n1	ZINC000819217270	DC	On-Demand	Anodyne	ALPL	42	38
O=C(NCCNC[C@H](O)c1cc(F)ccc1F)c1cc[nH]n1	ZINC000819217271	DC	On-Demand	Anodyne	ALPL	42	38
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(Br)c1	ZINC000819217272	FH	On-Demand	Anodyne	ADRB2	43	46
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(Br)c1	ZINC000819217272	FH	On-Demand	Anodyne	ADRB1	45	47
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(Br)c1	ZINC000819217272	FH	On-Demand	Anodyne	ADRB3	92	47
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(Br)c1	ZINC000819217273	FH	On-Demand	Anodyne	ADRB2	43	46
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(Br)c1	ZINC000819217273	FH	On-Demand	Anodyne	ADRB1	45	47
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(Br)c1	ZINC000819217273	FH	On-Demand	Anodyne	ADRB3	92	47
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819217274	FG	On-Demand	Anodyne	ADRB2	27	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819217274	FG	On-Demand	Anodyne	ADRB3	22	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819217274	FG	On-Demand	Anodyne	ACOX1	51	39
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819217275	FG	On-Demand	Anodyne	ADRB2	27	40
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819217275	FG	On-Demand	Anodyne	ADRB3	22	40
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCc3nc(C)sc32)cc1	ZINC000819217275	FG	On-Demand	Anodyne	ACOX1	51	39
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819217276	FG	On-Demand	Anodyne	ADRB2	27	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819217276	FG	On-Demand	Anodyne	ADRB3	22	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819217276	FG	On-Demand	Anodyne	ACOX1	51	39
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819217277	FG	On-Demand	Anodyne	ADRB2	27	40
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819217277	FG	On-Demand	Anodyne	ADRB3	22	40
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCc3nc(C)sc32)cc1	ZINC000819217277	FG	On-Demand	Anodyne	ACOX1	51	39
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819217310	FH	On-Demand	Anodyne	ADRB2	31	43
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819217310	FH	On-Demand	Anodyne	ADRB3	53	41
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819217311	FH	On-Demand	Anodyne	ADRB2	31	43
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819217311	FH	On-Demand	Anodyne	ADRB3	53	41
CCc1cccc2c1OCC[C@@H]2NC(=O)C(F)=C1CCC1	ZINC000819217312	CH	On-Demand	Anodyne	LUXR	43	32
CCc1cccc2c1OCC[C@H]2NC(=O)C(F)=C1CCC1	ZINC000819217313	CH	On-Demand	Anodyne	LUXR	43	32
O=C(NCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)c1cc[nH]n1	ZINC000819217314	FD	On-Demand	Anodyne	ADRB3	15	46
O=C(NCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)c1cc[nH]n1	ZINC000819217315	FD	On-Demand	Anodyne	ADRB3	15	46
Cc1ccccc1[C@@H](O)CNCCc1cc(F)c(F)c(F)c1	ZINC000819217316	DG	On-Demand	Anodyne	ADRB2	56	37
Cc1ccccc1[C@@H](O)CNCCc1cc(F)c(F)c(F)c1	ZINC000819217316	DG	On-Demand	Anodyne	ADRB1	50	39
Cc1ccccc1[C@@H](O)CNCCc1cc(F)c(F)c(F)c1	ZINC000819217316	DG	On-Demand	Anodyne	ADRB3	51	38
Cc1cc(F)ccc1[C@@H](O)CNCCc1cc(F)c(F)c(F)c1	ZINC000819217319	EG	On-Demand	Anodyne	ADRB2	42	39
Cc1cc(F)ccc1[C@@H](O)CNCCc1cc(F)c(F)c(F)c1	ZINC000819217319	EG	On-Demand	Anodyne	ADRB1	34	40
Cc1cc(F)ccc1[C@@H](O)CNCCc1cc(F)c(F)c(F)c1	ZINC000819217319	EG	On-Demand	Anodyne	LEF	40	37
O=C(NCCNC[C@@H](O)c1cccnc1)c1cc[nH]n1	ZINC000819217321	CB	On-Demand	Anodyne	ADRB2	25	48
O=C(NCCNC[C@@H](O)c1cccnc1)c1cc[nH]n1	ZINC000819217321	CB	On-Demand	Anodyne	ADRB1	34	48
O=C(NCCNC[C@@H](O)c1cccnc1)c1cc[nH]n1	ZINC000819217321	CB	On-Demand	Anodyne	ADRB3	108	48
O=C(NCCNC[C@H](O)c1cccnc1)c1cc[nH]n1	ZINC000819217322	CB	On-Demand	Anodyne	ADRB2	25	48
O=C(NCCNC[C@H](O)c1cccnc1)c1cc[nH]n1	ZINC000819217322	CB	On-Demand	Anodyne	ADRB1	34	48
O=C(NCCNC[C@H](O)c1cccnc1)c1cc[nH]n1	ZINC000819217322	CB	On-Demand	Anodyne	ADRB3	108	48
C[C@H](Cc1ccccc1C(F)(F)F)NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819217350	GH	On-Demand	Anodyne	SCN10A	19	42
C[C@H](Cc1ccccc1C(F)(F)F)NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819217350	GH	On-Demand	Anodyne	FPR1	44	36
C[C@H](Cc1ccccc1C(F)(F)F)NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819217351	GH	On-Demand	Anodyne	SCN10A	19	42
C[C@H](Cc1ccccc1C(F)(F)F)NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819217351	GH	On-Demand	Anodyne	FPR1	44	36
C[C@@H](Cc1ccccc1C(F)(F)F)NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819217352	GH	On-Demand	Anodyne	SCN10A	19	42
C[C@@H](Cc1ccccc1C(F)(F)F)NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819217352	GH	On-Demand	Anodyne	FPR1	44	36
C[C@@H](Cc1ccccc1C(F)(F)F)NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819217353	GH	On-Demand	Anodyne	SCN10A	19	42
C[C@@H](Cc1ccccc1C(F)(F)F)NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819217353	GH	On-Demand	Anodyne	FPR1	44	36
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1c(F)cccc1F	ZINC000819217354	EG	On-Demand	Anodyne	ADRB2	37	40
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1c(F)cccc1F	ZINC000819217354	EG	On-Demand	Anodyne	ADRB1	38	41
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1c(F)cccc1F	ZINC000819217354	EG	On-Demand	Anodyne	ADRB3	47	41
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1c(F)cccc1F	ZINC000819217355	EG	On-Demand	Anodyne	ADRB2	37	40
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1c(F)cccc1F	ZINC000819217355	EG	On-Demand	Anodyne	ADRB1	38	41
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1c(F)cccc1F	ZINC000819217355	EG	On-Demand	Anodyne	ADRB3	47	41
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(F)c1	ZINC000819217383	DG	On-Demand	Anodyne	ADRB2	50	46
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(F)c1	ZINC000819217383	DG	On-Demand	Anodyne	ADRB1	57	51
O[C@@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(F)c1	ZINC000819217383	DG	On-Demand	Anodyne	ADRB3	106	51
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(F)c1	ZINC000819217384	DG	On-Demand	Anodyne	ADRB2	50	46
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(F)c1	ZINC000819217384	DG	On-Demand	Anodyne	ADRB1	57	51
O[C@H](CNCCc1cc(F)c(F)c(F)c1)c1cccc(F)c1	ZINC000819217384	DG	On-Demand	Anodyne	ADRB3	106	51
O=C(NCCNC[C@@H](O)c1cccc(F)c1)c1cc[nH]n1	ZINC000819217390	CC	On-Demand	Anodyne	ADRB1	29	42
O=C(NCCNC[C@@H](O)c1cccc(F)c1)c1cc[nH]n1	ZINC000819217390	CC	On-Demand	Anodyne	ADRB3	43	42
O=C(NCCNC[C@H](O)c1cccc(F)c1)c1cc[nH]n1	ZINC000819217391	CC	On-Demand	Anodyne	ADRB1	29	42
O=C(NCCNC[C@H](O)c1cccc(F)c1)c1cc[nH]n1	ZINC000819217391	CC	On-Demand	Anodyne	ADRB3	43	42
Cc1nc2c(s1)[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)CCC2	ZINC000819217394	FF	On-Demand	Mild	ADRB2	29	40
Cc1nc2c(s1)[C@H](NC[C@@H](O)COc1ccc(CC#N)cc1)CCC2	ZINC000819217395	FF	On-Demand	Mild	ADRB2	29	40
Cc1nc2c(s1)[C@@H](NC[C@H](O)COc1ccc(CC#N)cc1)CCC2	ZINC000819217396	FF	On-Demand	Mild	ADRB2	29	40
Cc1nc2c(s1)[C@@H](NC[C@@H](O)COc1ccc(CC#N)cc1)CCC2	ZINC000819217397	FF	On-Demand	Mild	ADRB2	29	40
COCC[C@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccco1	ZINC000819217400	GF	On-Demand	Anodyne	GPR119	35	44
COCC[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccco1	ZINC000819217401	GF	On-Demand	Anodyne	GPR119	35	44
COCC[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccco1	ZINC000819217402	GF	On-Demand	Anodyne	GPR119	35	44
COCC[C@@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccco1	ZINC000819217403	GF	On-Demand	Anodyne	GPR119	35	44
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)[C@@H]1CCCOC1	ZINC000819217405	FE	On-Demand	Anodyne	GPR119	27	42
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)[C@H]1CCCOC1	ZINC000819217407	FE	On-Demand	Anodyne	GPR119	27	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cc(-c2ccccc2)on1	ZINC000819217416	FF	On-Demand	Anodyne	REN	47	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cc(-c2ccccc2)on1	ZINC000819217416	FF	On-Demand	Anodyne	PDE8B	48	32
O=C(NCCNC[C@H](O)c1ccc(Cl)cc1)c1cc[nH]n1	ZINC000819217426	DD	On-Demand	Anodyne	ALPL	46	34
O=C1C[C@H](CNC[C@H](O)c2ccc(F)cc2Cl)CN1C1CC1	ZINC000819217457	EE	On-Demand	Anodyne	P2RX7	19	50
O=C1C[C@@H](CNC[C@H](O)c2ccc(F)cc2Cl)CN1C1CC1	ZINC000819217458	EE	On-Demand	Anodyne	P2RX7	19	50
O=C1C[C@H](CNC[C@@H](O)c2ccc(F)cc2Cl)CN1C1CC1	ZINC000819217459	EE	On-Demand	Anodyne	P2RX7	19	50
O=C1C[C@@H](CNC[C@@H](O)c2ccc(F)cc2Cl)CN1C1CC1	ZINC000819217460	EE	On-Demand	Anodyne	P2RX7	19	50
O[C@@H](CN[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccccc1	ZINC000819217470	FF	On-Demand	Anodyne	ADRB3	28	41
O[C@H](CN[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccccc1	ZINC000819217471	FF	On-Demand	Anodyne	ADRB3	28	41
O[C@@H](CN[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccccc1	ZINC000819217472	FF	On-Demand	Anodyne	ADRB3	28	41
O[C@H](CN[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccccc1	ZINC000819217473	FF	On-Demand	Anodyne	ADRB3	28	41
O[C@@H](CNCC[C@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819217494	CF	On-Demand	Anodyne	ADRB2	41	38
O[C@@H](CNCC[C@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819217494	CF	On-Demand	Anodyne	ADRB1	56	50
O[C@@H](CNCC[C@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819217494	CF	On-Demand	Anodyne	ADRB3	73	52
O[C@@H](CNCC[C@@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819217495	CF	On-Demand	Anodyne	ADRB2	41	38
O[C@@H](CNCC[C@@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819217495	CF	On-Demand	Anodyne	ADRB1	56	50
O[C@@H](CNCC[C@@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819217495	CF	On-Demand	Anodyne	ADRB3	73	52
O[C@H](CNCC[C@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819217496	CF	On-Demand	Anodyne	ADRB2	41	38
O[C@H](CNCC[C@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819217496	CF	On-Demand	Anodyne	ADRB1	56	50
O[C@H](CNCC[C@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819217496	CF	On-Demand	Anodyne	ADRB3	73	52
O[C@H](CNCC[C@@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819217497	CF	On-Demand	Anodyne	ADRB2	41	38
O[C@H](CNCC[C@@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819217497	CF	On-Demand	Anodyne	ADRB1	56	50
O[C@H](CNCC[C@@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819217497	CF	On-Demand	Anodyne	ADRB3	73	52
COCCc1ccc(OC[C@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819217505	GG	On-Demand	Anodyne	ADRB2	31	52
COCCc1ccc(OC[C@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819217505	GG	On-Demand	Anodyne	ADRB1	49	52
COCCc1ccc(OC[C@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819217505	GG	On-Demand	Anodyne	ADRB3	32	40
COCCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819217506	GG	On-Demand	Anodyne	ADRB2	31	52
COCCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819217506	GG	On-Demand	Anodyne	ADRB1	49	52
COCCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819217506	GG	On-Demand	Anodyne	ADRB3	32	40
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819217507	GG	On-Demand	Anodyne	ADRB2	31	52
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819217507	GG	On-Demand	Anodyne	ADRB1	49	52
COCCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819217507	GG	On-Demand	Anodyne	ADRB3	32	40
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819217508	GG	On-Demand	Anodyne	ADRB2	31	52
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819217508	GG	On-Demand	Anodyne	ADRB1	49	52
COCCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819217508	GG	On-Demand	Anodyne	ADRB3	32	40
O[C@@H](CN[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccc(F)cc1	ZINC000819217548	FF	On-Demand	Anodyne	ADRB3	15	43
O[C@H](CN[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccc(F)cc1	ZINC000819217549	FF	On-Demand	Anodyne	ADRB3	15	43
O[C@@H](CN[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccc(F)cc1	ZINC000819217550	FF	On-Demand	Anodyne	ADRB3	15	43
O[C@H](CN[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccc(F)cc1	ZINC000819217551	FF	On-Demand	Anodyne	ADRB3	15	43
Cn1nc(C(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)c2ccccc2c1=O	ZINC000819217575	GF	On-Demand	Anodyne	IMDH_CRYPV	19	40
O=C(CCn1c(S)nc2ccccc2c1=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217595	IG	On-Demand	Anodyne	GRIN2D	54	30
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217598	FI	On-Demand	Anodyne	MC4R	81	46
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217598	FI	On-Demand	Anodyne	CCR1	44	47
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217598	FI	On-Demand	Anodyne	MC3R	30	40
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217598	FI	On-Demand	Anodyne	MC5R	42	40
O=C(OCc1ccccc1)N1CCC(C(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)CC1	ZINC000819217620	II	On-Demand	Anodyne	GRIN2B	19	43
O=C(OCc1ccccc1)N1CCC(C(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)CC1	ZINC000819217620	II	On-Demand	Anodyne	CCR1	26	40
O=C(OCc1ccccc1)N1CCC(C(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)CC1	ZINC000819217620	II	On-Demand	Anodyne	PREP	29	42
C=CCOCCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819217623	ED	On-Demand	Mild	GPR119	23	40
C=CCOCCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819217625	ED	On-Demand	Mild	GPR119	23	40
O[C@H](CN[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccnc1	ZINC000819217630	FE	On-Demand	Anodyne	ADRB3	58	49
O[C@H](CN[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccnc1	ZINC000819217632	FE	On-Demand	Anodyne	ADRB3	58	49
O[C@@H](CN[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccnc1	ZINC000819217635	FE	On-Demand	Anodyne	ADRB3	58	49
O[C@@H](CN[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccnc1	ZINC000819217637	FE	On-Demand	Anodyne	ADRB3	58	49
O=C(c1cc(-c2ccccn2)nc2ccccc12)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217658	IK	On-Demand	Anodyne	METAP1	46	39
O=C(c1cc(-c2ccncc2)nc2ccccc12)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217662	IK	On-Demand	Anodyne	PRS	37	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	ACE	30	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	CELA1	19	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	ELANE	29	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	MC4R	44	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	CTRA_BOVIN	53	31
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	KLK3	76	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	CTSB	58	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	PAPA1_CARPA	61	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	CYSP_TRYCR	53	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	CTSG	40	31
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	CTSK	40	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	CTSL	44	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	CCR1	45	49
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	CAPNS1	61	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	CELA2A	40	31
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	CAPN1	75	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	CAPN2	125	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	TGM2	29	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	DPP7	47	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217670	HH	On-Demand	Anodyne	NPR	59	32
O=C(c1cc([N+](=O)[O-])ccc1N1CCOCC1)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217677	IG	On-Demand	Bother	SLC6A9	18	68
O=C([C@@H](O)[C@@H](O)c1nc2ccccc2s1)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217685	HF	On-Demand	Anodyne	CCR1	23	45
O=C([C@@H](O)[C@H](O)c1nc2ccccc2s1)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217696	HF	On-Demand	Anodyne	CCR1	23	45
N#Cc1ccc(N2CCC[C@@H](NC[C@H](O)c3cccnc3)C2=O)cc1	ZINC000819217711	ED	On-Demand	Mild	ADRB3	53	45
N#Cc1ccc(N2CCC[C@@H](NC[C@@H](O)c3cccnc3)C2=O)cc1	ZINC000819217714	ED	On-Demand	Mild	ADRB3	53	45
N#Cc1ccc(N2CCC[C@H](NC[C@H](O)c3cccnc3)C2=O)cc1	ZINC000819217715	ED	On-Demand	Mild	ADRB3	53	45
N#Cc1ccc(N2CCC[C@H](NC[C@@H](O)c3cccnc3)C2=O)cc1	ZINC000819217716	ED	On-Demand	Mild	ADRB3	53	45
O=C(/C=C/c1ccccc1F)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217735	EI	On-Demand	Anodyne	ITGAL	55	37
O=C(/C=C\c1ccccc1F)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217736	EI	On-Demand	Anodyne	ITGAL	55	37
COc1ccc2c(C)c(CCC(=O)N3CCO[C@H](c4ccc(Cl)cc4)C3)c(=O)oc2c1	ZINC000819217744	II	On-Demand	Anodyne	MAOB	27	41
C=CCOc1ccc(/C=C\C(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)cc1OC	ZINC000819217747	HJ	On-Demand	Mild	ITGAL	16	41
C=CCOc1ccc(/C=C/C(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)cc1OC	ZINC000819217748	HJ	On-Demand	Mild	ITGAL	16	41
CCOC(=O)N[C@H](C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1)C(C)C	ZINC000819217752	FG	On-Demand	Anodyne	CCR1	78	52
CCOC(=O)N[C@@H](C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1)C(C)C	ZINC000819217753	FG	On-Demand	Anodyne	CCR1	78	52
O=C(/C=C/c1ccc2c(c1)OCO2)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217768	FH	On-Demand	Anodyne	ITGAL	22	43
O=C(/C=C\c1ccc2c(c1)OCO2)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819217769	FH	On-Demand	Anodyne	ITGAL	22	43
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)CC1	ZINC000819217781	HH	On-Demand	Anodyne	GPR119	43	39
C/C(=C/C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1)c1ccccc1	ZINC000819217787	EI	On-Demand	Anodyne	CCR1	35	42
Cc1cc(-c2cc(C(=O)Nc3cccnc3Cl)c3cnn(C(C)C)c3n2)c(C)o1	ZINC000819217816	HK	On-Demand	Anodyne	G2YM83_BOTF4	69	37
O=C(CNC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2)OCC1CC1	ZINC000819217832	GF	On-Demand	Anodyne	CNR1	51	32
O=C1C[C@H](CNC[C@H](O)c2ccccc2)CN1C1CC1	ZINC000819217842	CD	On-Demand	Anodyne	INHA	17	41
O=C1C[C@H](CNC[C@@H](O)c2ccccc2)CN1C1CC1	ZINC000819217843	CD	On-Demand	Anodyne	INHA	17	41
O=C1C[C@@H](CNC[C@@H](O)c2ccccc2)CN1C1CC1	ZINC000819217844	CD	On-Demand	Anodyne	INHA	17	41
O=C1C[C@@H](CNC[C@H](O)c2ccccc2)CN1C1CC1	ZINC000819217845	CD	On-Demand	Anodyne	INHA	17	41
O[C@@H](CN[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccccc1Cl	ZINC000819217849	GG	On-Demand	Anodyne	OPRL1	32	41
O[C@@H](CN[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccccc1Cl	ZINC000819217850	GG	On-Demand	Anodyne	OPRL1	32	41
C=CCOCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819217855	DE	On-Demand	Mild	ADRB3	24	41
C=CCOCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819217856	DE	On-Demand	Mild	ADRB3	24	41
O=C(Nc1ccc(F)cc1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819217866	EG	On-Demand	Anodyne	EPHX2	28	48
O=C1C[C@H](CNC[C@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819217911	DD	On-Demand	Anodyne	ADRB1	38	42
O=C1C[C@H](CNC[C@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819217911	DD	On-Demand	Anodyne	ADRB3	50	43
O=C1C[C@H](CNC[C@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819217911	DD	On-Demand	Anodyne	CYP3A4	47	35
O=C1C[C@H](CNC[C@@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819217912	DD	On-Demand	Anodyne	ADRB1	38	42
O=C1C[C@H](CNC[C@@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819217912	DD	On-Demand	Anodyne	ADRB3	50	43
O=C1C[C@H](CNC[C@@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819217912	DD	On-Demand	Anodyne	CYP3A4	47	35
O=C1C[C@@H](CNC[C@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819217913	DD	On-Demand	Anodyne	ADRB1	38	42
O=C1C[C@@H](CNC[C@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819217913	DD	On-Demand	Anodyne	ADRB3	50	43
O=C1C[C@@H](CNC[C@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819217913	DD	On-Demand	Anodyne	CYP3A4	47	35
O=C1C[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819217914	DD	On-Demand	Anodyne	ADRB1	38	42
O=C1C[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819217914	DD	On-Demand	Anodyne	ADRB3	50	43
O=C1C[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)CN1C1CC1	ZINC000819217914	DD	On-Demand	Anodyne	CYP3A4	47	35
C=CCOCCNC[C@H](O)c1ccc(C)cc1	ZINC000819217984	BD	On-Demand	Mild	ADRB2	24	42
C=CCOCCNC[C@@H](O)c1ccc(C)cc1	ZINC000819217985	BD	On-Demand	Mild	ADRB2	24	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccc(OCC(F)F)c1	ZINC000819218000	FF	On-Demand	Anodyne	PDS	96	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C#N)CC(C)C)C2	ZINC000819218008	DD	On-Demand	Mild	LGMN	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C#N)CC(C)C)C2	ZINC000819218009	DD	On-Demand	Mild	LGMN	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C#N)CC(C)C)C2	ZINC000819218010	DD	On-Demand	Mild	LGMN	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C#N)CC(C)C)C2	ZINC000819218011	DD	On-Demand	Mild	LGMN	40	31
O=C(/C=C/c1ccc2c(c1)OCO2)Nc1ccccc1SCC(F)(F)F	ZINC000819218013	GJ	On-Demand	Anodyne	KCNQ2	20	40
O=C(/C=C\c1ccc2c(c1)OCO2)Nc1ccccc1SCC(F)(F)F	ZINC000819218014	GJ	On-Demand	Anodyne	KCNQ2	20	40
O=C(/C=C/[C@H]1CCCO1)NCC(=O)N1CCc2ccccc2C1	ZINC000819218033	DD	On-Demand	Anodyne	DPP8	15	43
O=C(/C=C\[C@@H]1CCCO1)NCC(=O)N1CCc2ccccc2C1	ZINC000819218034	DD	On-Demand	Anodyne	DPP8	15	43
O=C(/C=C/[C@@H]1CCCO1)NCC(=O)N1CCc2ccccc2C1	ZINC000819218035	DD	On-Demand	Anodyne	DPP8	15	43
O=C(/C=C\[C@H]1CCCO1)NCC(=O)N1CCc2ccccc2C1	ZINC000819218036	DD	On-Demand	Anodyne	DPP8	15	43
C=C(C)C(C)(C)C(=O)Nc1ccc2c(c1)CCN2C(=O)OC(C)(C)C	ZINC000819218037	EJ	On-Demand	Mild	GPR119	16	42
O[C@H]1CCN(Cc2ccccc2CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819218041	EE	On-Demand	Anodyne	OPRK1	15	43
O[C@H]1CCN(Cc2ccccc2CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819218041	EE	On-Demand	Anodyne	SLC6A3	31	42
O[C@@H]1CCN(Cc2ccccc2CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819218042	EE	On-Demand	Anodyne	OPRK1	15	43
O[C@@H]1CCN(Cc2ccccc2CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819218042	EE	On-Demand	Anodyne	SLC6A3	31	42
O[C@H]1CCN(Cc2ccccc2CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819218043	EE	On-Demand	Anodyne	OPRK1	15	43
O[C@H]1CCN(Cc2ccccc2CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819218043	EE	On-Demand	Anodyne	SLC6A3	31	42
O[C@H](CNCc1ccccc1CN1CC[C@@H](O)C1)c1ccc(F)cc1	ZINC000819218044	EE	On-Demand	Anodyne	OPRK1	15	43
O[C@H](CNCc1ccccc1CN1CC[C@@H](O)C1)c1ccc(F)cc1	ZINC000819218044	EE	On-Demand	Anodyne	SLC6A3	31	42
CN(C)S(=O)(=O)c1cccc(CNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819218050	FD	On-Demand	Mild	ADRB2	18	47
CN(C)S(=O)(=O)c1cccc(CNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819218050	FD	On-Demand	Mild	ADRB3	15	47
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819218051	FD	On-Demand	Mild	ADRB2	18	47
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819218051	FD	On-Demand	Mild	ADRB3	15	47
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1cncc(F)c1	ZINC000819218060	FF	On-Demand	Anodyne	GPR119	47	49
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1cncc(F)c1	ZINC000819218062	FF	On-Demand	Anodyne	GPR119	47	49
C[C@@H]1CCCC[C@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819218069	FE	On-Demand	Reactive	SFRP1	88	32
C[C@@H]1CCCC[C@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819218069	FE	On-Demand	Reactive	WNT3	58	31
C[C@@H]1CCCC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819218070	FE	On-Demand	Reactive	SFRP1	88	32
C[C@@H]1CCCC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819218070	FE	On-Demand	Reactive	WNT3	58	31
COc1ccc(N2CCC(NC(=O)Cc3ccc(-n4cnnc4)cc3)CC2)cc1	ZINC000819218071	GF	On-Demand	Clean	SIGMAR1	20	56
COc1ccc(N2CCC(NC(=O)Cc3ccc(-n4cnnc4)cc3)CC2)cc1	ZINC000819218071	GF	On-Demand	Clean	PDK1	40	35
COc1ccc(N2CCC(NC(=O)Cc3ccc(-n4cnnc4)cc3)CC2)cc1	ZINC000819218071	GF	On-Demand	Clean	MCHR1	25	48
O[C@H]1CCN(Cc2ccccc2CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819218078	FF	On-Demand	Anodyne	OPRK1	19	40
O[C@H]1CCN(Cc2ccccc2CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819218078	FF	On-Demand	Anodyne	ADRB3	42	42
O[C@@H]1CCN(Cc2ccccc2CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819218079	FF	On-Demand	Anodyne	OPRK1	19	40
O[C@@H]1CCN(Cc2ccccc2CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819218079	FF	On-Demand	Anodyne	ADRB3	42	42
O[C@H]1CCN(Cc2ccccc2CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819218080	FF	On-Demand	Anodyne	OPRK1	19	40
O[C@H]1CCN(Cc2ccccc2CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819218080	FF	On-Demand	Anodyne	ADRB3	42	42
O[C@H](CNCc1ccccc1CN1CC[C@@H](O)C1)c1cccc(Cl)c1	ZINC000819218081	FF	On-Demand	Anodyne	OPRK1	19	40
O[C@H](CNCc1ccccc1CN1CC[C@@H](O)C1)c1cccc(Cl)c1	ZINC000819218081	FF	On-Demand	Anodyne	ADRB3	42	42
O[C@H]1CCN(Cc2ccccc2CNC[C@H](O)c2ccccc2)C1	ZINC000819218086	EE	On-Demand	Anodyne	OPRK1	21	42
O[C@@H]1CCN(Cc2ccccc2CNC[C@H](O)c2ccccc2)C1	ZINC000819218087	EE	On-Demand	Anodyne	OPRK1	21	42
O[C@H]1CCN(Cc2ccccc2CNC[C@@H](O)c2ccccc2)C1	ZINC000819218088	EE	On-Demand	Anodyne	OPRK1	21	42
O[C@H](CNCc1ccccc1CN1CC[C@@H](O)C1)c1ccccc1	ZINC000819218089	EE	On-Demand	Anodyne	OPRK1	21	42
Cc1nc(CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)nc2ccccc12	ZINC000819218090	FE	On-Demand	Anodyne	ACACB	15	43
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819218093	FD	On-Demand	Anodyne	ADRB2	17	48
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819218093	FD	On-Demand	Anodyne	ADRB1	25	48
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819218093	FD	On-Demand	Anodyne	ADRB3	44	48
CN(C)S(=O)(=O)c1cccc(CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819218096	FD	On-Demand	Anodyne	ADRB2	17	48
CN(C)S(=O)(=O)c1cccc(CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819218096	FD	On-Demand	Anodyne	ADRB1	25	48
CN(C)S(=O)(=O)c1cccc(CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819218096	FD	On-Demand	Anodyne	ADRB3	44	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCc3cccc(OC)c31)C2	ZINC000819218099	FF	On-Demand	Anodyne	SSTR1	44	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCc3cccc(OC)c31)C2	ZINC000819218101	FF	On-Demand	Anodyne	SSTR1	44	33
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H]2CC(=O)N(C3CC3)C2)CC1	ZINC000819218157	GD	On-Demand	Anodyne	GPR119	32	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2CC(=O)N(C3CC3)C2)CC1	ZINC000819218158	GD	On-Demand	Anodyne	GPR119	32	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2CC(=O)N(C3CC3)C2)CC1	ZINC000819218159	GD	On-Demand	Anodyne	GPR119	32	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H]2CC(=O)N(C3CC3)C2)CC1	ZINC000819218160	GD	On-Demand	Anodyne	GPR119	32	41
C=CCOCCNC[C@@H](O)c1cccnc1	ZINC000819218184	BC	On-Demand	Mild	ADRB2	30	53
C=CCOCCNC[C@@H](O)c1cccnc1	ZINC000819218184	BC	On-Demand	Mild	ADRB1	43	53
C=CCOCCNC[C@@H](O)c1cccnc1	ZINC000819218184	BC	On-Demand	Mild	ADRB3	116	57
C=CCOCCNC[C@H](O)c1cccnc1	ZINC000819218185	BC	On-Demand	Mild	ADRB2	30	53
C=CCOCCNC[C@H](O)c1cccnc1	ZINC000819218185	BC	On-Demand	Mild	ADRB1	43	53
C=CCOCCNC[C@H](O)c1cccnc1	ZINC000819218185	BC	On-Demand	Mild	ADRB3	116	57
C=CCOCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819218186	CD	On-Demand	Mild	ADRB1	40	39
C=CCOCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819218186	CD	On-Demand	Mild	ADRB3	45	39
C=CCOCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819218187	CD	On-Demand	Mild	ADRB1	40	39
C=CCOCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819218187	CD	On-Demand	Mild	ADRB3	45	39
O[C@@H](CNCC[C@@H]1CCCCO1)c1cccnc1	ZINC000819218190	CD	On-Demand	Anodyne	ADRB2	28	47
O[C@@H](CNCC[C@@H]1CCCCO1)c1cccnc1	ZINC000819218190	CD	On-Demand	Anodyne	ADRB1	36	46
O[C@@H](CNCC[C@@H]1CCCCO1)c1cccnc1	ZINC000819218190	CD	On-Demand	Anodyne	ADRB3	116	48
O[C@@H](CNCC[C@H]1CCCCO1)c1cccnc1	ZINC000819218191	CD	On-Demand	Anodyne	ADRB2	28	47
O[C@@H](CNCC[C@H]1CCCCO1)c1cccnc1	ZINC000819218191	CD	On-Demand	Anodyne	ADRB1	36	46
O[C@@H](CNCC[C@H]1CCCCO1)c1cccnc1	ZINC000819218191	CD	On-Demand	Anodyne	ADRB3	116	48
O[C@H](CNCC[C@@H]1CCCCO1)c1cccnc1	ZINC000819218192	CD	On-Demand	Anodyne	ADRB2	28	47
O[C@H](CNCC[C@@H]1CCCCO1)c1cccnc1	ZINC000819218192	CD	On-Demand	Anodyne	ADRB1	36	46
O[C@H](CNCC[C@@H]1CCCCO1)c1cccnc1	ZINC000819218192	CD	On-Demand	Anodyne	ADRB3	116	48
O[C@H](CNCC[C@H]1CCCCO1)c1cccnc1	ZINC000819218193	CD	On-Demand	Anodyne	ADRB2	28	47
O[C@H](CNCC[C@H]1CCCCO1)c1cccnc1	ZINC000819218193	CD	On-Demand	Anodyne	ADRB1	36	46
O[C@H](CNCC[C@H]1CCCCO1)c1cccnc1	ZINC000819218193	CD	On-Demand	Anodyne	ADRB3	116	48
CN(C[C@@H](O)CNCc1ccccc1CN1CC[C@@H](O)C1)C(=O)OC(C)(C)C	ZINC000819218204	GD	On-Demand	Anodyne	OPRK1	20	40
CN(C[C@@H](O)CNCc1ccccc1CN1CC[C@H](O)C1)C(=O)OC(C)(C)C	ZINC000819218205	GD	On-Demand	Anodyne	OPRK1	20	40
CN(C[C@H](O)CNCc1ccccc1CN1CC[C@H](O)C1)C(=O)OC(C)(C)C	ZINC000819218206	GD	On-Demand	Anodyne	OPRK1	20	40
CN(C[C@H](O)CNCc1ccccc1CN1CC[C@@H](O)C1)C(=O)OC(C)(C)C	ZINC000819218207	GD	On-Demand	Anodyne	OPRK1	20	40
CC(C)(C#N)CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819218227	EE	On-Demand	Mild	GPR119	30	42
CC(C)(C#N)CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819218228	EE	On-Demand	Mild	GPR119	30	42
O[C@H]1CCN(Cc2ccccc2CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819218231	GG	On-Demand	Anodyne	OPRK1	18	41
O[C@H]1CCN(Cc2ccccc2CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819218231	GG	On-Demand	Anodyne	CCR2	51	40
O[C@@H]1CCN(Cc2ccccc2CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819218232	GG	On-Demand	Anodyne	OPRK1	18	41
O[C@@H]1CCN(Cc2ccccc2CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819218232	GG	On-Demand	Anodyne	CCR2	51	40
O[C@H]1CCN(Cc2ccccc2CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819218233	GG	On-Demand	Anodyne	OPRK1	18	41
O[C@H]1CCN(Cc2ccccc2CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819218233	GG	On-Demand	Anodyne	CCR2	51	40
O[C@H](CNCc1ccccc1CN1CC[C@@H](O)C1)c1cccc(C(F)(F)F)c1	ZINC000819218234	GG	On-Demand	Anodyne	OPRK1	18	41
O[C@H](CNCc1ccccc1CN1CC[C@@H](O)C1)c1cccc(C(F)(F)F)c1	ZINC000819218234	GG	On-Demand	Anodyne	CCR2	51	40
O[C@H]1CCN(Cc2ccccc2CNC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819218236	GF	On-Demand	Anodyne	OPRK1	15	40
O[C@H]1CCN(Cc2ccccc2CNC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819218237	GF	On-Demand	Anodyne	OPRK1	15	40
O[C@@H]1CCN(Cc2ccccc2CNC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819218238	GF	On-Demand	Anodyne	OPRK1	15	40
O[C@H](CNCc1ccccc1CN1CC[C@@H](O)C1)c1ccc(Cl)c(F)c1	ZINC000819218239	GF	On-Demand	Anodyne	OPRK1	15	40
COc1ccc(N2CCC(NC(=O)[C@@H]3C[C@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819218244	FH	On-Demand	Clean	SLC6A4	22	41
COc1ccc(N2CCC(NC(=O)[C@@H]3C[C@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819218244	FH	On-Demand	Clean	SLC6A3	41	47
COc1ccc(N2CCC(NC(=O)[C@@H]3C[C@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819218244	FH	On-Demand	Clean	NPBWR1	78	37
COc1ccc(N2CCC(NC(=O)[C@@H]3C[C@@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819218245	FH	On-Demand	Clean	SLC6A4	22	41
COc1ccc(N2CCC(NC(=O)[C@@H]3C[C@@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819218245	FH	On-Demand	Clean	SLC6A3	41	47
COc1ccc(N2CCC(NC(=O)[C@@H]3C[C@@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819218245	FH	On-Demand	Clean	NPBWR1	78	37
COc1ccc(N2CCC(NC(=O)[C@H]3C[C@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819218246	FH	On-Demand	Clean	SLC6A4	22	41
COc1ccc(N2CCC(NC(=O)[C@H]3C[C@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819218246	FH	On-Demand	Clean	SLC6A3	41	47
COc1ccc(N2CCC(NC(=O)[C@H]3C[C@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819218246	FH	On-Demand	Clean	NPBWR1	78	37
COc1ccc(N2CCC(NC(=O)[C@H]3C[C@@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819218247	FH	On-Demand	Clean	SLC6A4	22	41
COc1ccc(N2CCC(NC(=O)[C@H]3C[C@@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819218247	FH	On-Demand	Clean	SLC6A3	41	47
COc1ccc(N2CCC(NC(=O)[C@H]3C[C@@H]3c3ccc(C)cc3)CC2)cc1	ZINC000819218247	FH	On-Demand	Clean	NPBWR1	78	37
COC(=O)N1CCC[C@H](NC(=O)C[S@@](=O)c2cccc(OC)c2)C1	ZINC000819218257	FD	On-Demand	Anodyne	MTNR1A	25	47
COC(=O)N1CCC[C@H](NC(=O)C[S@@](=O)c2cccc(OC)c2)C1	ZINC000819218257	FD	On-Demand	Anodyne	MTNR1B	31	47
COC(=O)N1CCC[C@H](NC(=O)C[S@](=O)c2cccc(OC)c2)C1	ZINC000819218258	FD	On-Demand	Anodyne	MTNR1A	25	47
COC(=O)N1CCC[C@H](NC(=O)C[S@](=O)c2cccc(OC)c2)C1	ZINC000819218258	FD	On-Demand	Anodyne	MTNR1B	31	47
O=C1C[C@H](CNC[C@H](O)c2ccccc2Cl)CN1C1CC1	ZINC000819218308	DD	On-Demand	Anodyne	OPRL1	42	39
O=C1C[C@@H](CNC[C@H](O)c2ccccc2Cl)CN1C1CC1	ZINC000819218310	DD	On-Demand	Anodyne	OPRL1	42	39
COC(=O)N1CCC[C@H](NC(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819218311	FF	On-Demand	Anodyne	BIRC2	32	44
N#Cc1ccc(N2CCC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819218363	FG	On-Demand	Mild	ADRB1	24	40
N#Cc1ccc(N2CCC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819218363	FG	On-Demand	Mild	ADRB3	39	40
N#Cc1ccc(N2CCC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819218363	FG	On-Demand	Mild	CYP3A4	49	38
N#Cc1ccc(N2CCC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819218364	FG	On-Demand	Mild	ADRB1	24	40
N#Cc1ccc(N2CCC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819218364	FG	On-Demand	Mild	ADRB3	39	40
N#Cc1ccc(N2CCC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819218364	FG	On-Demand	Mild	CYP3A4	49	38
N#Cc1ccc(N2CCC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819218365	FG	On-Demand	Mild	ADRB1	24	40
N#Cc1ccc(N2CCC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819218365	FG	On-Demand	Mild	ADRB3	39	40
N#Cc1ccc(N2CCC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819218365	FG	On-Demand	Mild	CYP3A4	49	38
N#Cc1ccc(N2CCC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819218366	FG	On-Demand	Mild	ADRB1	24	40
N#Cc1ccc(N2CCC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819218366	FG	On-Demand	Mild	ADRB3	39	40
N#Cc1ccc(N2CCC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819218366	FG	On-Demand	Mild	CYP3A4	49	38
O=[N+]([O-])c1cccc([C@@H](O)CNCC[C@H]2CCCCO2)c1	ZINC000819218394	CE	On-Demand	Bother	ADRB3	44	39
O=[N+]([O-])c1cccc([C@@H](O)CNCC[C@@H]2CCCCO2)c1	ZINC000819218395	CE	On-Demand	Bother	ADRB3	44	39
O=[N+]([O-])c1cccc([C@H](O)CNCC[C@H]2CCCCO2)c1	ZINC000819218396	CE	On-Demand	Bother	ADRB3	44	39
O=[N+]([O-])c1cccc([C@H](O)CNCC[C@@H]2CCCCO2)c1	ZINC000819218397	CE	On-Demand	Bother	ADRB3	44	39
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2ccccc2F)c1	ZINC000819218427	FD	On-Demand	Anodyne	ADRB2	18	43
CN(C)S(=O)(=O)c1cccc(CNC[C@@H](O)c2ccccc2F)c1	ZINC000819218428	FD	On-Demand	Anodyne	ADRB2	18	43
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000819218444	GH	On-Demand	Anodyne	PTGS2	27	41
CS(=O)(=O)c1ccc([C@H](O)CNC2CCC(c3ccc(F)cc3)CC2)cc1	ZINC000819218445	GH	On-Demand	Anodyne	PTGS2	27	41
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(OCC(F)F)c1	ZINC000819218464	DF	On-Demand	Anodyne	PDS	70	38
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(OCC(F)F)c1	ZINC000819218465	DF	On-Demand	Anodyne	PDS	70	38
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(OCC(F)F)c1	ZINC000819218466	DF	On-Demand	Anodyne	PDS	70	38
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(OCC(F)F)c1	ZINC000819218467	DF	On-Demand	Anodyne	PDS	70	38
CC(C)(C#N)CNC[C@@H](O)c1cccnc1	ZINC000819218482	BD	On-Demand	Mild	ADRB2	22	42
CC(C)(C#N)CNC[C@@H](O)c1cccnc1	ZINC000819218482	BD	On-Demand	Mild	ADRB1	24	43
CC(C)(C#N)CNC[C@@H](O)c1cccnc1	ZINC000819218482	BD	On-Demand	Mild	ADRB3	91	43
CC(C)(C#N)CNC[C@H](O)c1cccnc1	ZINC000819218487	BD	On-Demand	Mild	ADRB2	22	42
CC(C)(C#N)CNC[C@H](O)c1cccnc1	ZINC000819218487	BD	On-Demand	Mild	ADRB1	24	43
CC(C)(C#N)CNC[C@H](O)c1cccnc1	ZINC000819218487	BD	On-Demand	Mild	ADRB3	91	43
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000819218498	FD	On-Demand	Bother	OPRK1	20	43
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000819218500	FD	On-Demand	Bother	OPRK1	20	43
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccccc2CN2CC[C@H](O)C2)c1	ZINC000819218502	FD	On-Demand	Bother	OPRK1	20	43
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccccc2CN2CC[C@@H](O)C2)c1	ZINC000819218504	FD	On-Demand	Bother	OPRK1	20	43
COC(=O)N1CCC[C@H](NC(=O)Cc2cccc(NC(C)=O)c2)C1	ZINC000819218510	ED	On-Demand	Anodyne	TSHR	48	32
COC(=O)N1CCC[C@H](NC(=O)Cc2cccc(NC(C)=O)c2)C1	ZINC000819218510	ED	On-Demand	Anodyne	SIGMAR1	19	44
COC(=O)N1CCC[C@H](NC(=O)Cc2cccc(NC(C)=O)c2)C1	ZINC000819218510	ED	On-Demand	Anodyne	CCR3	52	43
COC(=O)N1CCC[C@H](NC(=O)Cc2cccc(NC(C)=O)c2)C1	ZINC000819218510	ED	On-Demand	Anodyne	EPHX2	27	44
COC(=O)N1CCC[C@H](NC(=O)Cc2cccc(NC(C)=O)c2)C1	ZINC000819218510	ED	On-Demand	Anodyne	BIRC2	30	42
O=C1C[C@H](CNC[C@H](O)c2cccc(Br)c2)CN1C1CC1	ZINC000819218531	FE	On-Demand	Anodyne	INHA	17	46
O=C1C[C@H](CNC[C@@H](O)c2cccc(Br)c2)CN1C1CC1	ZINC000819218532	FE	On-Demand	Anodyne	INHA	17	46
O=C1C[C@@H](CNC[C@H](O)c2cccc(Br)c2)CN1C1CC1	ZINC000819218534	FE	On-Demand	Anodyne	INHA	17	46
O=C1C[C@@H](CNC[C@@H](O)c2cccc(Br)c2)CN1C1CC1	ZINC000819218535	FE	On-Demand	Anodyne	INHA	17	46
O=C(Nc1ccc(F)cc1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819218542	EF	On-Demand	Anodyne	EPHX2	23	45
O=C(Nc1ccc(F)cc1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819218543	EF	On-Demand	Anodyne	EPHX2	23	45
O=C(Nc1ccc(F)cc1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819218544	EF	On-Demand	Anodyne	EPHX2	23	45
O=C(Nc1ccc(F)cc1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819218545	EF	On-Demand	Anodyne	EPHX2	23	45
Cc1cc(-c2cc(C(=O)Nc3cccnc3Cl)c3cnn(C(C)C)c3n2)c(C)s1	ZINC000819218562	IK	On-Demand	Anodyne	G2YM83_BOTF4	67	37
O[C@@H](CN[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccc(F)c1	ZINC000819218585	FF	On-Demand	Anodyne	ADRB3	24	41
O[C@H](CN[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccc(F)c1	ZINC000819218586	FF	On-Demand	Anodyne	ADRB3	24	41
O[C@@H](CN[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccc(F)c1	ZINC000819218587	FF	On-Demand	Anodyne	ADRB3	24	41
O[C@H](CN[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccc(F)c1	ZINC000819218588	FF	On-Demand	Anodyne	ADRB3	24	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1cccc(C(N)=O)c1)C2	ZINC000819218601	FD	On-Demand	Anodyne	KCNH2	40	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1cccc(C(N)=O)c1)C2	ZINC000819218602	FD	On-Demand	Anodyne	KCNH2	40	41
COc1ccc(N2CCC(NC(=O)Cc3nsc4ccccc34)CC2)cc1	ZINC000819218613	GH	On-Demand	Clean	HTR1A	22	44
COc1ccc(N2CCC(NC(=O)Cc3nsc4ccccc34)CC2)cc1	ZINC000819218613	GH	On-Demand	Clean	DRD2	23	44
COC(=O)N1CCC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819218628	GD	On-Demand	Mild	PAPA1_CARPA	36	47
COC(=O)N1CCC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819218630	GD	On-Demand	Mild	PAPA1_CARPA	36	47
COC(=O)N1CCC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819218631	GD	On-Demand	Mild	PAPA1_CARPA	36	47
COC(=O)N1CCC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819218632	GD	On-Demand	Mild	PAPA1_CARPA	36	47
COc1ccc(N2CCC(NC(=O)C3(c4ccc(C)cc4)CCC3)CC2)cc1	ZINC000819218635	GI	On-Demand	Clean	NPBWR1	56	34
C=CCOCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819218639	CE	On-Demand	Mild	ADRB2	52	43
C=CCOCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819218639	CE	On-Demand	Mild	ADRB1	67	52
C=CCOCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819218639	CE	On-Demand	Mild	ADRB3	76	52
C=CCOCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819218640	CE	On-Demand	Mild	ADRB2	52	43
C=CCOCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819218640	CE	On-Demand	Mild	ADRB1	67	52
C=CCOCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819218640	CE	On-Demand	Mild	ADRB3	76	52
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218666	FF	On-Demand	Anodyne	PRCP	19	48
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218666	FF	On-Demand	Anodyne	GRM5	15	51
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218666	FF	On-Demand	Anodyne	SMO	50	50
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218666	FF	On-Demand	Anodyne	ETHR	64	42
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218668	FF	On-Demand	Anodyne	PRCP	19	48
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218668	FF	On-Demand	Anodyne	GRM5	15	51
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218668	FF	On-Demand	Anodyne	SMO	50	50
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218668	FF	On-Demand	Anodyne	ETHR	64	42
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218669	FF	On-Demand	Anodyne	PRCP	19	48
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218669	FF	On-Demand	Anodyne	GRM5	15	51
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218669	FF	On-Demand	Anodyne	SMO	50	50
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218669	FF	On-Demand	Anodyne	ETHR	64	42
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218671	FF	On-Demand	Anodyne	PRCP	19	48
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218671	FF	On-Demand	Anodyne	GRM5	15	51
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218671	FF	On-Demand	Anodyne	SMO	50	50
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218671	FF	On-Demand	Anodyne	ETHR	64	42
CC(C)n1ncc2c(C(=O)Nc3cccnc3Cl)cc(-c3ccc4c(c3)OCCO4)nc21	ZINC000819218685	IJ	On-Demand	Anodyne	EZH2	20	57
CC(C)n1ncc2c(C(=O)Nc3cccnc3Cl)cc(-c3ccc4c(c3)OCCO4)nc21	ZINC000819218685	IJ	On-Demand	Anodyne	G2YM83_BOTF4	69	37
C=CCC1(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)CCOCC1	ZINC000819218725	FG	On-Demand	Mild	MMP13	27	43
COc1ccc(N2CCC(NC(=O)c3cc4c(cn3)OCCO4)CC2)cc1	ZINC000819218730	FE	On-Demand	Clean	PDK1	42	35
COc1ccc(N2CCC(NC(=O)c3cc4c(cn3)OCCO4)CC2)cc1	ZINC000819218730	FE	On-Demand	Clean	MCHR1	28	41
Cc1nc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc12	ZINC000819218744	GG	On-Demand	Mild	PAPA1_CARPA	54	50
Cc1nc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc12	ZINC000819218744	GG	On-Demand	Mild	CCKAR	56	37
Cc1nc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc12	ZINC000819218744	GG	On-Demand	Mild	CTSL	19	50
Cc1nc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc12	ZINC000819218744	GG	On-Demand	Mild	TACR3	19	41
Cc1nc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc12	ZINC000819218744	GG	On-Demand	Mild	REN	41	38
Cc1nc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc12	ZINC000819218744	GG	On-Demand	Mild	CTSS	17	50
Cc1nc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc12	ZINC000819218744	GG	On-Demand	Mild	FPR1	45	38
Cc1nc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc12	ZINC000819218745	GG	On-Demand	Mild	PAPA1_CARPA	54	50
Cc1nc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc12	ZINC000819218745	GG	On-Demand	Mild	CCKAR	56	37
Cc1nc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc12	ZINC000819218745	GG	On-Demand	Mild	CTSL	19	50
Cc1nc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc12	ZINC000819218745	GG	On-Demand	Mild	TACR3	19	41
Cc1nc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc12	ZINC000819218745	GG	On-Demand	Mild	REN	41	38
Cc1nc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc12	ZINC000819218745	GG	On-Demand	Mild	CTSS	17	50
Cc1nc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc12	ZINC000819218745	GG	On-Demand	Mild	FPR1	45	38
CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cc2)cc1	ZINC000819218753	GH	On-Demand	Anodyne	GCK	20	40
CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cc2)cc1	ZINC000819218753	GH	On-Demand	Anodyne	F13A1	42	33
CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cc2)cc1	ZINC000819218754	GH	On-Demand	Anodyne	GCK	20	40
CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cc2)cc1	ZINC000819218754	GH	On-Demand	Anodyne	F13A1	42	33
CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)/C=C\[C@H]3CCCO3)cc2)cc1	ZINC000819218756	GH	On-Demand	Anodyne	GCK	20	40
CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)/C=C\[C@H]3CCCO3)cc2)cc1	ZINC000819218756	GH	On-Demand	Anodyne	F13A1	42	33
CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)/C=C/[C@H]3CCCO3)cc2)cc1	ZINC000819218758	GH	On-Demand	Anodyne	GCK	20	40
CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)/C=C/[C@H]3CCCO3)cc2)cc1	ZINC000819218758	GH	On-Demand	Anodyne	F13A1	42	33
Cn1c(=O)oc2ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc21	ZINC000819218760	GF	On-Demand	Mild	PAPA1_CARPA	36	40
Cn1c(=O)oc2ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc21	ZINC000819218761	GF	On-Demand	Mild	PAPA1_CARPA	36	40
COc1ccc(CC[C@@H]2CCCCN2C(=O)/C=C\[C@H]2CCCO2)cc1OC	ZINC000819218771	FH	On-Demand	Anodyne	FKBP1A	59	41
COc1ccc(CC[C@@H]2CCCCN2C(=O)/C=C\[C@H]2CCCO2)cc1OC	ZINC000819218771	FH	On-Demand	Anodyne	ACKR3	64	35
COc1ccc(CC[C@@H]2CCCCN2C(=O)/C=C/[C@@H]2CCCO2)cc1OC	ZINC000819218772	FH	On-Demand	Anodyne	FKBP1A	59	41
COc1ccc(CC[C@@H]2CCCCN2C(=O)/C=C/[C@@H]2CCCO2)cc1OC	ZINC000819218772	FH	On-Demand	Anodyne	ACKR3	64	35
COc1ccc(CC[C@@H]2CCCCN2C(=O)/C=C/[C@H]2CCCO2)cc1OC	ZINC000819218773	FH	On-Demand	Anodyne	FKBP1A	59	41
COc1ccc(CC[C@@H]2CCCCN2C(=O)/C=C/[C@H]2CCCO2)cc1OC	ZINC000819218773	FH	On-Demand	Anodyne	ACKR3	64	35
COc1ccc(CC[C@@H]2CCCCN2C(=O)/C=C\[C@@H]2CCCO2)cc1OC	ZINC000819218774	FH	On-Demand	Anodyne	FKBP1A	59	41
COc1ccc(CC[C@@H]2CCCCN2C(=O)/C=C\[C@@H]2CCCO2)cc1OC	ZINC000819218774	FH	On-Demand	Anodyne	ACKR3	64	35
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819218801	FE	On-Demand	Anodyne	ADRB2	28	48
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819218801	FE	On-Demand	Anodyne	ADRB1	33	48
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819218801	FE	On-Demand	Anodyne	ADRB3	42	48
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819218801	FE	On-Demand	Anodyne	UL54	60	34
CC(C)(C#N)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819218805	CF	On-Demand	Mild	ADRB1	34	46
CC(C)(C#N)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819218805	CF	On-Demand	Mild	ADRB3	48	46
CC(C)(C#N)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819218806	CF	On-Demand	Mild	ADRB1	34	46
CC(C)(C#N)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819218806	CF	On-Demand	Mild	ADRB3	48	46
COC(=O)N1CCC[C@H](NC(=O)c2cn(-c3ccccc3)nc2C(C)C)C1	ZINC000819218807	FF	On-Demand	Anodyne	BIRC2	20	40
COC(=O)N1CCC[C@@H](NC(=O)c2cn(-c3ccccc3)nc2C(C)C)C1	ZINC000819218808	FF	On-Demand	Anodyne	BIRC2	20	40
CON(C)C(=O)CCNCc1ccccc1CN1CC[C@H](O)C1	ZINC000819218814	DC	On-Demand	Anodyne	OPRK1	22	42
CON(C)C(=O)CCNCc1ccccc1CN1CC[C@@H](O)C1	ZINC000819218815	DC	On-Demand	Anodyne	OPRK1	22	42
C=CCCn1cc(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)nn1	ZINC000819218823	FE	On-Demand	Mild	PDK1	40	34
O=C(NCc1cccc(OCC(F)F)c1)C(F)=C1CCC1	ZINC000819218830	CG	On-Demand	Anodyne	PDS	97	45
O=[N+]([O-])c1ccc([C@@H](O)CNCc2ccccc2CN2CC[C@H](O)C2)cc1	ZINC000819218868	FD	On-Demand	Bother	OPRK1	18	47
O=[N+]([O-])c1ccc([C@@H](O)CNCc2ccccc2CN2CC[C@@H](O)C2)cc1	ZINC000819218871	FD	On-Demand	Bother	OPRK1	18	47
O=[N+]([O-])c1ccc([C@H](O)CNCc2ccccc2CN2CC[C@H](O)C2)cc1	ZINC000819218873	FD	On-Demand	Bother	OPRK1	18	47
O=[N+]([O-])c1ccc([C@H](O)CNCc2ccccc2CN2CC[C@@H](O)C2)cc1	ZINC000819218875	FD	On-Demand	Bother	OPRK1	18	47
O=C(C(F)=C1CCC1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218881	EG	On-Demand	Anodyne	PRCP	19	49
O=C(C(F)=C1CCC1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218881	EG	On-Demand	Anodyne	GRM5	15	55
O=C(C(F)=C1CCC1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218881	EG	On-Demand	Anodyne	SMO	50	50
O=C(C(F)=C1CCC1)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819218881	EG	On-Demand	Anodyne	ETHR	71	44
O[C@@H](CN[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccc(Cl)c1	ZINC000819218898	GG	On-Demand	Anodyne	ADRB1	30	48
O[C@@H](CN[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccc(Cl)c1	ZINC000819218898	GG	On-Demand	Anodyne	ADRB3	51	50
O[C@@H](CN[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccc(Cl)c1	ZINC000819218898	GG	On-Demand	Anodyne	CYP3A4	48	37
O[C@H](CN[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccc(Cl)c1	ZINC000819218900	GG	On-Demand	Anodyne	ADRB1	30	48
O[C@H](CN[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccc(Cl)c1	ZINC000819218900	GG	On-Demand	Anodyne	ADRB3	51	50
O[C@H](CN[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccc(Cl)c1	ZINC000819218900	GG	On-Demand	Anodyne	CYP3A4	48	37
O[C@@H](CN[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccc(Cl)c1	ZINC000819218902	GG	On-Demand	Anodyne	ADRB1	30	48
O[C@@H](CN[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccc(Cl)c1	ZINC000819218902	GG	On-Demand	Anodyne	ADRB3	51	50
O[C@@H](CN[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccc(Cl)c1	ZINC000819218902	GG	On-Demand	Anodyne	CYP3A4	48	37
O[C@H](CN[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccc(Cl)c1	ZINC000819218905	GG	On-Demand	Anodyne	ADRB1	30	48
O[C@H](CN[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccc(Cl)c1	ZINC000819218905	GG	On-Demand	Anodyne	ADRB3	51	50
O[C@H](CN[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1cccc(Cl)c1	ZINC000819218905	GG	On-Demand	Anodyne	CYP3A4	48	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccc(OCC(F)F)c1)C2	ZINC000819218913	GF	On-Demand	Anodyne	PDS	75	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccc(OCC(F)F)c1)C2	ZINC000819218915	GF	On-Demand	Anodyne	PDS	75	38
O=C(NCC(=O)N1CCN(c2cccc(Cl)c2)CC1)C(F)=C1CCC1	ZINC000819218924	FF	On-Demand	Anodyne	HTR1A	19	43
O=C(NCC(=O)N1CCN(c2cccc(Cl)c2)CC1)C(F)=C1CCC1	ZINC000819218924	FF	On-Demand	Anodyne	HTR2A	15	43
COc1ccc(OC)c([C@H](O)CNCCN2CCNC(=O)C2)c1	ZINC000819218928	DB	On-Demand	Anodyne	ADRB2	19	42
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c1	ZINC000819218935	GF	On-Demand	Bother	ADRB3	20	41
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c1	ZINC000819218938	GF	On-Demand	Bother	ADRB3	20	41
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c1	ZINC000819218940	GF	On-Demand	Bother	ADRB3	20	41
COc1ccc(N2CCC(NC(=O)[C@H]3CCCC[C@H]3C)CC2)cc1	ZINC000819218941	EH	On-Demand	Clean	EPHX2	22	47
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCc3nnc(-c4ccc(F)cc4)n3C2)c1	ZINC000819218942	GF	On-Demand	Bother	ADRB3	20	41
COc1ccc(N2CCC(NC(=O)[C@@H]3CCCC[C@H]3C)CC2)cc1	ZINC000819218944	EH	On-Demand	Clean	EPHX2	22	47
COc1ccc(N2CCC(NC(=O)[C@@H]3CCCC[C@@H]3C)CC2)cc1	ZINC000819218946	EH	On-Demand	Clean	EPHX2	22	47
COc1ccc(N2CCC(NC(=O)[C@H]3CCCC[C@@H]3C)CC2)cc1	ZINC000819218948	EH	On-Demand	Clean	EPHX2	22	47
O=C(Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)Nc1cccnc1Cl	ZINC000819218950	GK	On-Demand	Anodyne	TRPV1	25	40
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2ccccc2Cl)c1	ZINC000819218963	FE	On-Demand	Anodyne	ADRB2	24	44
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2ccccc2Cl)c1	ZINC000819218963	FE	On-Demand	Anodyne	ADRB1	18	44
C=CCOCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819218986	CE	On-Demand	Mild	ADRB2	22	41
C=CCOCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819218986	CE	On-Demand	Mild	ADRB1	23	41
C=CCOCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819218986	CE	On-Demand	Mild	ADRB3	23	41
C=CCOCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819218988	CE	On-Demand	Mild	ADRB2	22	41
C=CCOCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819218988	CE	On-Demand	Mild	ADRB1	23	41
C=CCOCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819218988	CE	On-Demand	Mild	ADRB3	23	41
O[C@@H](CN[C@@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccc(Cl)cc1	ZINC000819219007	GG	On-Demand	Anodyne	ADRB3	20	49
O[C@@H](CN[C@H]1CCc2nnc(-c3ccc(F)cc3)n2C1)c1ccc(Cl)cc1	ZINC000819219009	GG	On-Demand	Anodyne	ADRB3	20	49
COC[C@@H](CNC[C@H](O)c1cccnc1)OC	ZINC000819219048	BC	On-Demand	Anodyne	ADRB2	23	46
COC[C@@H](CNC[C@H](O)c1cccnc1)OC	ZINC000819219048	BC	On-Demand	Anodyne	ADRB1	27	47
COC[C@@H](CNC[C@H](O)c1cccnc1)OC	ZINC000819219048	BC	On-Demand	Anodyne	ADRB3	93	47
COC[C@@H](CNC[C@@H](O)c1cccnc1)OC	ZINC000819219051	BC	On-Demand	Anodyne	ADRB2	23	46
COC[C@@H](CNC[C@@H](O)c1cccnc1)OC	ZINC000819219051	BC	On-Demand	Anodyne	ADRB1	27	47
COC[C@@H](CNC[C@@H](O)c1cccnc1)OC	ZINC000819219051	BC	On-Demand	Anodyne	ADRB3	93	47
COC[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819219064	CD	On-Demand	Anodyne	ADRB2	30	43
COC[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819219064	CD	On-Demand	Anodyne	ADRB1	46	46
COC[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819219064	CD	On-Demand	Anodyne	ADRB3	56	46
COC[C@@H](CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819219065	CD	On-Demand	Anodyne	ADRB2	30	43
COC[C@@H](CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819219065	CD	On-Demand	Anodyne	ADRB1	46	46
COC[C@@H](CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819219065	CD	On-Demand	Anodyne	ADRB3	56	46
O=C(Nc1cccc(NC(=O)c2ccccc2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219112	GD	On-Demand	Anodyne	SLC6A1	65	34
O=C(Nc1cccc(NC(=O)c2ccccc2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219112	GD	On-Demand	Anodyne	PRNP	52	42
O=C(Nc1cccc(NC(=O)c2ccccc2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219112	GD	On-Demand	Anodyne	CCKBR	15	41
O=C(Nc1cccc(NC(=O)c2ccccc2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219112	GD	On-Demand	Anodyne	KCNK3	131	56
O=C(Nc1cccc(NC(=O)c2ccccc2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219112	GD	On-Demand	Anodyne	KCNK9	80	46
O=C(Nc1cccc(NC(=O)c2ccccc2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219116	GD	On-Demand	Anodyne	SLC6A1	65	34
O=C(Nc1cccc(NC(=O)c2ccccc2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219116	GD	On-Demand	Anodyne	PRNP	52	42
O=C(Nc1cccc(NC(=O)c2ccccc2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219116	GD	On-Demand	Anodyne	CCKBR	15	41
O=C(Nc1cccc(NC(=O)c2ccccc2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219116	GD	On-Demand	Anodyne	KCNK3	131	56
O=C(Nc1cccc(NC(=O)c2ccccc2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219116	GD	On-Demand	Anodyne	KCNK9	80	46
O=C(Nc1cnn(-c2ccccc2)c1)NC1(C(=O)O)CCCC1	ZINC000819219128	DE	On-Demand	Anodyne	MAPK10	17	45
O=C(Nc1nc(CC(=O)N2CC[C@@H](C(=O)O)C2)cs1)c1cccc(O)c1	ZINC000819219131	GD	On-Demand	Anodyne	MPL	36	40
O=C(Nc1nc(CC(=O)N2CC[C@@H](C(=O)O)C2)cs1)c1cccc(O)c1	ZINC000819219131	GD	On-Demand	Anodyne	CPT1A	32	44
O=C(Nc1nc(CC(=O)N2CC[C@@H](C(=O)O)C2)cs1)c1cccc(O)c1	ZINC000819219131	GD	On-Demand	Anodyne	CPT1B	41	44
O=C(Nc1nc(CC(=O)N2CC[C@H](C(=O)O)C2)cs1)c1cccc(O)c1	ZINC000819219133	GD	On-Demand	Anodyne	MPL	36	40
O=C(Nc1nc(CC(=O)N2CC[C@H](C(=O)O)C2)cs1)c1cccc(O)c1	ZINC000819219133	GD	On-Demand	Anodyne	CPT1A	32	44
O=C(Nc1nc(CC(=O)N2CC[C@H](C(=O)O)C2)cs1)c1cccc(O)c1	ZINC000819219133	GD	On-Demand	Anodyne	CPT1B	41	44
O=C(Nc1cccc2cnccc12)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219137	DD	On-Demand	Anodyne	TRPV1	24	46
O=C(Nc1cccc2cnccc12)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219137	DD	On-Demand	Anodyne	CDK5	26	45
O=C(Nc1cccc2cnccc12)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219139	DD	On-Demand	Anodyne	TRPV1	24	46
O=C(Nc1cccc2cnccc12)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219139	DD	On-Demand	Anodyne	CDK5	26	45
O=C(Nc1ccccc1CN1CCOCC1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219141	FC	On-Demand	Anodyne	SLC6A1	47	33
O=C(Nc1ccccc1CN1CCOCC1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219141	FC	On-Demand	Anodyne	CASR	41	36
O=C(Nc1ccccc1CN1CCOCC1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219143	FC	On-Demand	Anodyne	SLC6A1	47	33
O=C(Nc1ccccc1CN1CCOCC1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219143	FC	On-Demand	Anodyne	CASR	41	36
O=C(Nc1ccccc1C(=O)N1CCOCC1)NC1(C(=O)O)CCCC1	ZINC000819219145	FD	On-Demand	Anodyne	EPHX2	17	44
O=C(Nc1ccccc1C(=O)N1CCOCC1)NC1(C(=O)O)CCCC1	ZINC000819219145	FD	On-Demand	Anodyne	NPSR1	15	45
O=C(Nc1cccc(OCc2ccc(F)cc2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219156	GE	On-Demand	Anodyne	CCR3	81	46
O=C(Nc1cccc(OCc2ccc(F)cc2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219156	GE	On-Demand	Anodyne	MLNR	42	35
O=C(Nc1cccc(OCc2ccc(F)cc2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219156	GE	On-Demand	Anodyne	EPHX2	28	42
O=C(Nc1cccc(OCc2ccc(F)cc2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219159	GE	On-Demand	Anodyne	CCR3	81	46
O=C(Nc1cccc(OCc2ccc(F)cc2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219159	GE	On-Demand	Anodyne	MLNR	42	35
O=C(Nc1cccc(OCc2ccc(F)cc2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219159	GE	On-Demand	Anodyne	EPHX2	28	42
O=C(Nc1ccccc1C(=O)N1CCCC1)NC1(C(=O)O)CCCC1	ZINC000819219162	EE	On-Demand	Anodyne	NPSR1	17	51
O=C(Nc1ccccc1C(=O)N1CCCC1)NC1(C(=O)O)CCCC1	ZINC000819219162	EE	On-Demand	Anodyne	HCN1	43	33
O=C(Nc1cccc(NC(=O)c2ccoc2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219165	FD	On-Demand	Anodyne	KCNK3	83	57
O=C(Nc1cccc(NC(=O)c2ccoc2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219168	FD	On-Demand	Anodyne	KCNK3	83	57
O=C(Nc1ccccc1N1CCCCC1)NC1(C(=O)O)CCCC1	ZINC000819219170	EG	On-Demand	Anodyne	KCNQ2	98	53
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)c1ccoc1	ZINC000819219172	EE	On-Demand	Anodyne	KCNK3	96	60
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)c1ccoc1	ZINC000819219172	EE	On-Demand	Anodyne	KCNK9	46	36
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)c1ccoc1	ZINC000819219174	EE	On-Demand	Anodyne	KCNK3	96	60
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)c1ccoc1	ZINC000819219174	EE	On-Demand	Anodyne	KCNK9	46	36
N#CCCNCCCCC(=O)OCc1ccccc1	ZINC000819219179	CE	On-Demand	Mild	PAPA1_CARPA	26	43
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819219187	FG	On-Demand	Anodyne	ACE	61	47
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819219187	FG	On-Demand	Anodyne	FKBP1A	22	53
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819219187	FG	On-Demand	Anodyne	AVPR2	62	46
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819219187	FG	On-Demand	Anodyne	AVPR1A	27	44
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819219187	FG	On-Demand	Anodyne	MME	16	41
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819219187	FG	On-Demand	Anodyne	LTA4H	17	42
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819219187	FG	On-Demand	Anodyne	UL80	51	40
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819219187	FG	On-Demand	Anodyne	DPP4	15	63
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819219187	FG	On-Demand	Anodyne	PRNP	68	45
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819219187	FG	On-Demand	Anodyne	PREP	77	41
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819219187	FG	On-Demand	Anodyne	TAAR1	31	40
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819219187	FG	On-Demand	Anodyne	DGAT1	29	41
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819219187	FG	On-Demand	Anodyne	WNT3	21	41
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819219187	FG	On-Demand	Anodyne	NOD1	17	40
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819219187	FG	On-Demand	Anodyne	NOD2	44	37
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CCC[C@H]2C(=O)O)cc1	ZINC000819219187	FG	On-Demand	Anodyne	KCNK3	60	42
O=C(Nc1ccccc1-n1cccn1)NC1(C(=O)O)CCCC1	ZINC000819219190	DE	On-Demand	Anodyne	KCNQ2	46	34
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819219191	GF	On-Demand	Anodyne	ADRB2	23	47
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819219191	GF	On-Demand	Anodyne	ADRB1	21	47
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819219191	GF	On-Demand	Anodyne	ADRB3	28	47
CN(C)S(=O)(=O)c1cccc(CNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819219194	GF	On-Demand	Anodyne	ADRB2	23	47
CN(C)S(=O)(=O)c1cccc(CNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819219194	GF	On-Demand	Anodyne	ADRB1	21	47
CN(C)S(=O)(=O)c1cccc(CNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819219194	GF	On-Demand	Anodyne	ADRB3	28	47
O=C(Nc1cccc(NC(=O)C2CC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219196	EC	On-Demand	Anodyne	EPHX2	23	42
O=C(Nc1cccc(NC(=O)C2CC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219196	EC	On-Demand	Anodyne	KCNK3	31	49
COC(=O)N1CCC[C@@H](NC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819219197	ED	On-Demand	Anodyne	INHA	64	36
COC(=O)N1CCC[C@@H](NC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819219197	ED	On-Demand	Anodyne	CCR8	78	44
O=C(Nc1cccc(NC(=O)C2CC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219199	EC	On-Demand	Anodyne	EPHX2	23	42
O=C(Nc1cccc(NC(=O)C2CC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219199	EC	On-Demand	Anodyne	KCNK3	31	49
COC(=O)N1CCC[C@H](NC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819219201	ED	On-Demand	Anodyne	INHA	64	36
COC(=O)N1CCC[C@H](NC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819219201	ED	On-Demand	Anodyne	CCR8	78	44
O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819219215	GE	On-Demand	Anodyne	HRH2	30	40
O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819219215	GE	On-Demand	Anodyne	CPT1A	76	43
O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819219215	GE	On-Demand	Anodyne	CPT2	44	34
O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819219215	GE	On-Demand	Anodyne	CCKBR	17	41
O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819219215	GE	On-Demand	Anodyne	EPHX2	47	49
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819219218	FG	On-Demand	Anodyne	SLC6A1	57	36
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819219218	FG	On-Demand	Anodyne	CCR3	29	40
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819219218	FG	On-Demand	Anodyne	EPHX2	21	44
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819219218	FG	On-Demand	Anodyne	TAAR1	45	51
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819219218	FG	On-Demand	Anodyne	SCD1	17	50
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819219218	FG	On-Demand	Anodyne	KCNK3	103	53
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819219218	FG	On-Demand	Anodyne	KCNK9	51	47
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819219222	FG	On-Demand	Anodyne	SLC6A1	57	36
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819219222	FG	On-Demand	Anodyne	CCR3	29	40
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819219222	FG	On-Demand	Anodyne	EPHX2	21	44
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819219222	FG	On-Demand	Anodyne	TAAR1	45	51
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819219222	FG	On-Demand	Anodyne	SCD1	17	50
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819219222	FG	On-Demand	Anodyne	KCNK3	103	53
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819219222	FG	On-Demand	Anodyne	KCNK9	51	47
O=C(Nc1cccc(NC(=O)C2CC2)c1)NC1(C(=O)O)CCCC1	ZINC000819219259	EF	On-Demand	Anodyne	EPHX2	31	42
O=C(Nc1cccc(NC(=O)C2CC2)c1)NC1(C(=O)O)CCCC1	ZINC000819219259	EF	On-Demand	Anodyne	TYK2	42	38
O=C(Nc1cccc(NC(=O)C2CC2)c1)NC1(C(=O)O)CCCC1	ZINC000819219259	EF	On-Demand	Anodyne	KCNK3	52	52
O=C(Nc1ccccc1C(=O)N1CCCC1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219262	FC	On-Demand	Anodyne	SLC6A1	93	34
O=C(Nc1ccccc1C(=O)N1CCCC1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219262	FC	On-Demand	Anodyne	NPSR1	17	49
O=C(Nc1ccccc1C(=O)N1CCCC1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219262	FC	On-Demand	Anodyne	L3MBTL3	67	45
O=C(Nc1ccccc1C(=O)N1CCCC1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219266	FC	On-Demand	Anodyne	SLC6A1	93	34
O=C(Nc1ccccc1C(=O)N1CCCC1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219266	FC	On-Demand	Anodyne	NPSR1	17	49
O=C(Nc1ccccc1C(=O)N1CCCC1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219266	FC	On-Demand	Anodyne	L3MBTL3	67	45
O=C(Nc1cccc(NC(=O)c2cccs2)c1)NC1(C(=O)O)CCCC1	ZINC000819219276	FH	On-Demand	Anodyne	KCNK3	92	60
O=C(Nc1cccc(NC(=O)c2cccs2)c1)NC1(C(=O)O)CCCC1	ZINC000819219276	FH	On-Demand	Anodyne	KCNK9	73	60
O=C(Nc1ccccc1CN1CCOCC1)NC1(C(=O)O)CCCC1	ZINC000819219279	EE	On-Demand	Anodyne	EPHX2	24	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1ccccc1CN1CC[C@H](O)C1	ZINC000819219284	GD	On-Demand	Anodyne	GPR119	15	43
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1ccccc1CN1CC[C@@H](O)C1	ZINC000819219287	GD	On-Demand	Anodyne	GPR119	15	43
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1ccccc1CN1CC[C@H](O)C1	ZINC000819219289	GD	On-Demand	Anodyne	GPR119	15	43
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1ccccc1CN1CC[C@@H](O)C1	ZINC000819219291	GD	On-Demand	Anodyne	GPR119	15	43
Cc1ccccc1[C@@H](O)CNCc1cccc(S(=O)(=O)N(C)C)c1	ZINC000819219301	EE	On-Demand	Anodyne	ADRB2	23	46
O=C(Nc1cccc(Oc2ccccn2)c1)C(=O)N1CCO[C@H](C(=O)O)C1	ZINC000819219310	FD	On-Demand	Anodyne	LIMK2	27	40
O=C(Nc1cccc(Oc2ccccn2)c1)C(=O)N1CCO[C@@H](C(=O)O)C1	ZINC000819219312	FD	On-Demand	Anodyne	LIMK2	27	40
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819219318	GF	On-Demand	Anodyne	ADRB2	19	42
CN(C)S(=O)(=O)c1cccc(CNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819219320	GF	On-Demand	Anodyne	ADRB2	19	42
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819219323	FF	On-Demand	Anodyne	AVPR2	55	44
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819219323	FF	On-Demand	Anodyne	SLC6A1	74	35
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819219323	FF	On-Demand	Anodyne	AVPR1A	30	44
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819219323	FF	On-Demand	Anodyne	TRPV1	25	42
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819219323	FF	On-Demand	Anodyne	NPY2R	36	40
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819219323	FF	On-Demand	Anodyne	PRNP	69	46
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819219323	FF	On-Demand	Anodyne	EPHX2	52	41
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819219323	FF	On-Demand	Anodyne	TAAR1	31	40
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819219323	FF	On-Demand	Anodyne	SMO	21	43
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819219323	FF	On-Demand	Anodyne	L3MBTL3	66	40
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819219323	FF	On-Demand	Anodyne	NOD2	42	35
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1	ZINC000819219323	FF	On-Demand	Anodyne	KCNK3	63	46
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819219326	FF	On-Demand	Anodyne	AVPR2	55	44
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819219326	FF	On-Demand	Anodyne	SLC6A1	74	35
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819219326	FF	On-Demand	Anodyne	AVPR1A	30	44
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819219326	FF	On-Demand	Anodyne	TRPV1	25	42
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819219326	FF	On-Demand	Anodyne	NPY2R	36	40
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819219326	FF	On-Demand	Anodyne	PRNP	69	46
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819219326	FF	On-Demand	Anodyne	EPHX2	52	41
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819219326	FF	On-Demand	Anodyne	TAAR1	31	40
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819219326	FF	On-Demand	Anodyne	SMO	21	43
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819219326	FF	On-Demand	Anodyne	L3MBTL3	66	40
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819219326	FF	On-Demand	Anodyne	NOD2	42	35
O=C(Nc1ccccc1)c1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1	ZINC000819219326	FF	On-Demand	Anodyne	KCNK3	63	46
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819219330	FG	On-Demand	Anodyne	ACE	57	47
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819219330	FG	On-Demand	Anodyne	FKBP1A	21	53
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819219330	FG	On-Demand	Anodyne	MME	16	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819219330	FG	On-Demand	Anodyne	UL80	42	45
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819219330	FG	On-Demand	Anodyne	CCR3	46	39
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819219330	FG	On-Demand	Anodyne	PREP	83	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819219330	FG	On-Demand	Anodyne	EPHX2	35	44
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819219330	FG	On-Demand	Anodyne	SFRP1	31	43
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819219330	FG	On-Demand	Anodyne	DGAT1	16	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819219330	FG	On-Demand	Anodyne	WNT3	40	32
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819219330	FG	On-Demand	Anodyne	KCNK3	52	40
O[C@H]1CCN(Cc2ccccc2CNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819219331	FF	On-Demand	Anodyne	OPRK1	16	43
O=C(Nc1ccccc1COCc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219332	GE	On-Demand	Anodyne	SLC6A1	44	42
O[C@@H]1CCN(Cc2ccccc2CNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819219333	FF	On-Demand	Anodyne	OPRK1	16	43
O=C(Nc1ccccc1COCc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219335	GE	On-Demand	Anodyne	SLC6A1	44	42
O=C(Nc1cccc(N2CCOCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819219338	EE	On-Demand	Anodyne	PIK3CA	20	41
O=C(Nc1cccc(N2CCOCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819219338	EE	On-Demand	Anodyne	MTOR	31	41
O=C(Nc1cccc(N2CCOCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819219338	EE	On-Demand	Anodyne	EPHX2	43	49
O=C(Nc1cccc(N2CCOCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819219338	EE	On-Demand	Anodyne	PIK3CG	20	41
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819219340	FG	On-Demand	Anodyne	ACE	47	49
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819219340	FG	On-Demand	Anodyne	CCR3	26	41
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819219340	FG	On-Demand	Anodyne	PREP	45	38
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819219340	FG	On-Demand	Anodyne	TAAR1	48	50
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819219340	FG	On-Demand	Anodyne	KCNK3	101	52
O=C(Nc1cccc(F)c1)c1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1	ZINC000819219340	FG	On-Demand	Anodyne	KCNK9	50	46
O=C(Nc1ccccc1-c1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219343	EE	On-Demand	Anodyne	SLC6A1	47	40
O=C(Nc1ccccc1-c1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219343	EE	On-Demand	Anodyne	CHRM3	16	46
O=C(Nc1ccccc1-c1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219344	EE	On-Demand	Anodyne	SLC6A1	47	40
O=C(Nc1ccccc1-c1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219344	EE	On-Demand	Anodyne	CHRM3	16	46
CCN(C)C(=O)[C@@H]1CSCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819219353	GD	On-Demand	Mild	PAPA1_CARPA	29	40
O=C(Nc1cccc(N2CCCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819219356	DF	On-Demand	Anodyne	EPHX2	31	41
CCN(C)C(=O)[C@@H]1CSCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819219362	GD	On-Demand	Mild	PAPA1_CARPA	29	40
CCN(C)C(=O)[C@H]1CSCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819219363	GD	On-Demand	Mild	PAPA1_CARPA	29	40
CCN(C)C(=O)[C@H]1CSCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819219365	GD	On-Demand	Mild	PAPA1_CARPA	29	40
O=C(CCCCNCC1(O)CCCC1)OCc1ccccc1	ZINC000819219380	DF	On-Demand	Anodyne	SLC12A5	67	37
O=C(CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12)Nc1cccnc1Cl	ZINC000819219388	GK	On-Demand	Anodyne	TSPO	29	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC(=O)N1CCc2ccccc2C1	ZINC000819219392	FD	On-Demand	Anodyne	PREP	16	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC(=O)N1CCc2ccccc2C1	ZINC000819219392	FD	On-Demand	Anodyne	ADAM9	45	32
O=C(Nc1cnn(C[C@H]2CCCO2)c1)C(=O)N1CCC(C(=O)O)CC1	ZINC000819219396	FC	On-Demand	Anodyne	PANC	48	33
O=C(Nc1cnn(C[C@@H]2CCCO2)c1)C(=O)N1CCC(C(=O)O)CC1	ZINC000819219401	FC	On-Demand	Anodyne	PANC	48	33
C[C@H](NC[C@H](O)c1ccccc1)C1=CCN(C)CC1	ZINC000819219424	CD	On-Demand	Anodyne	ADRB3	21	40
C[C@@H](NC[C@@H](O)c1ccccc1)C1=CCN(C)CC1	ZINC000819219426	CD	On-Demand	Anodyne	ADRB3	21	40
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H](C3OCCO3)C2)c1	ZINC000819219450	ED	On-Demand	Anodyne	P2RY14	43	33
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H](C3OCCO3)C2)c1	ZINC000819219451	ED	On-Demand	Anodyne	P2RY14	43	33
O=C(CCCCNCC1(O)CCC1)OCc1ccccc1	ZINC000819219487	CE	On-Demand	Anodyne	SLC12A5	68	37
COc1ccc(N2CCC(NC(=O)c3coc4c(C)cccc34)CC2)cc1	ZINC000819219493	FI	On-Demand	Clean	PDK1	40	33
O[C@H]1CCN(Cc2ccccc2CNC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819219495	GG	On-Demand	Anodyne	OPRK1	15	45
O[C@@H]1CCN(Cc2ccccc2CNC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819219496	GG	On-Demand	Anodyne	OPRK1	15	45
O[C@H]1CCN(Cc2ccccc2CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819219497	GG	On-Demand	Anodyne	OPRK1	15	45
O[C@H](CNCc1ccccc1CN1CC[C@@H](O)C1)c1ccc(C(F)(F)F)cc1	ZINC000819219498	GG	On-Demand	Anodyne	OPRK1	15	45
O=C(CCCCNCC1(O)CCOCC1)OCc1ccccc1	ZINC000819219544	DE	On-Demand	Anodyne	SLC12A5	44	33
COc1ccc(N2CCC(NC(=O)c3cc(Br)oc3C)CC2)cc1	ZINC000819219545	GH	On-Demand	Clean	DRD2	18	40
COc1ccc(N2CCC(NC(=O)c3cc(Br)oc3C)CC2)cc1	ZINC000819219545	GH	On-Demand	Clean	DRD3	26	40
COc1ccc(N2CCC(NC(=O)c3cc(Br)oc3C)CC2)cc1	ZINC000819219545	GH	On-Demand	Clean	CNR2	16	41
COc1ccc(N2CCC(NC(=O)c3cc(Br)oc3C)CC2)cc1	ZINC000819219545	GH	On-Demand	Clean	PDK1	43	36
COc1ccc(N2CCC(NC(=O)c3cc(Br)oc3C)CC2)cc1	ZINC000819219545	GH	On-Demand	Clean	MCHR1	22	43
COc1ccc(N2CCC(NC(=O)c3cc(Br)oc3C)CC2)cc1	ZINC000819219545	GH	On-Demand	Clean	AKR1B10	22	42
Cc1ccccc1C1(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819219563	GH	On-Demand	Mild	PAPA1_CARPA	55	49
Cc1ccccc1C1(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819219563	GH	On-Demand	Mild	CCKAR	49	38
Cc1ccccc1C1(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819219563	GH	On-Demand	Mild	CTSL	17	49
Cc1ccccc1C1(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819219563	GH	On-Demand	Mild	FPR1	44	38
O=C(Nc1cccc2ccncc12)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219564	DD	On-Demand	Anodyne	TRPV1	23	43
O=C(Nc1cccc2ccncc12)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219564	DD	On-Demand	Anodyne	CDK5	28	45
Cc1ccccc1C1(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819219565	GH	On-Demand	Mild	PAPA1_CARPA	55	49
Cc1ccccc1C1(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819219565	GH	On-Demand	Mild	CCKAR	49	38
Cc1ccccc1C1(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819219565	GH	On-Demand	Mild	CTSL	17	49
Cc1ccccc1C1(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819219565	GH	On-Demand	Mild	FPR1	44	38
O=C(Nc1cccc2ccncc12)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219566	DD	On-Demand	Anodyne	TRPV1	23	43
O=C(Nc1cccc2ccncc12)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219566	DD	On-Demand	Anodyne	CDK5	28	45
O=C(Nc1ccccc1C(=O)N1CCOCC1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219567	GC	On-Demand	Anodyne	NPSR1	15	44
O=C(Nc1ccccc1C(=O)N1CCOCC1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219569	GC	On-Demand	Anodyne	NPSR1	15	44
O=C(Nc1cccc(Oc2ccccn2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219584	FD	On-Demand	Anodyne	LIMK2	28	45
O=C(Nc1cccc(Oc2ccccn2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219586	FD	On-Demand	Anodyne	LIMK2	28	45
O=C(Nc1cccc(NC(=O)c2ccccc2)c1)NC1(C(=O)O)CCCC1	ZINC000819219588	FG	On-Demand	Anodyne	PPIA	27	45
O=C(Nc1cccc(NC(=O)c2ccccc2)c1)NC1(C(=O)O)CCCC1	ZINC000819219588	FG	On-Demand	Anodyne	PRNP	33	48
O=C(Nc1cccc(NC(=O)c2ccccc2)c1)NC1(C(=O)O)CCCC1	ZINC000819219588	FG	On-Demand	Anodyne	EPHX2	28	46
O=C(Nc1cccc(NC(=O)c2ccccc2)c1)NC1(C(=O)O)CCCC1	ZINC000819219588	FG	On-Demand	Anodyne	TAAR1	40	38
O=C(Nc1cccc(NC(=O)c2ccccc2)c1)NC1(C(=O)O)CCCC1	ZINC000819219588	FG	On-Demand	Anodyne	KCNK3	150	55
O=C(Nc1cccc(NC(=O)c2ccccc2)c1)NC1(C(=O)O)CCCC1	ZINC000819219588	FG	On-Demand	Anodyne	KCNK9	96	52
O=C(Nc1cccc(N2CCCC2=O)c1)NC1(C(=O)O)CCCC1	ZINC000819219597	EE	On-Demand	Anodyne	EPHX2	26	42
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219606	FE	On-Demand	Anodyne	ACE	39	45
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219606	FE	On-Demand	Anodyne	MME	72	39
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219606	FE	On-Demand	Anodyne	F2R	40	33
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219606	FE	On-Demand	Anodyne	ITGA4	37	42
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219606	FE	On-Demand	Anodyne	NAALAD2	31	45
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219606	FE	On-Demand	Anodyne	CAPN1	15	41
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219606	FE	On-Demand	Anodyne	ACE2	80	37
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219606	FE	On-Demand	Anodyne	FPR1	61	50
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219606	FE	On-Demand	Anodyne	BLA1_STEMA	62	34
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219606	FE	On-Demand	Anodyne	GPR142	63	35
O=C(Nc1cccc(COc2ccccc2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219615	FE	On-Demand	Anodyne	LTA4H	31	40
O=C(Nc1cccc(COc2ccccc2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219615	FE	On-Demand	Anodyne	CYSLTR2	40	31
O=C(Nc1cccc(COc2ccccc2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219615	FE	On-Demand	Anodyne	CPT1A	33	40
O=C(Nc1cccc(COc2ccccc2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219615	FE	On-Demand	Anodyne	EPHX2	26	40
O=C(Nc1cccc(COc2ccccc2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219616	FE	On-Demand	Anodyne	LTA4H	31	40
O=C(Nc1cccc(COc2ccccc2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219616	FE	On-Demand	Anodyne	CYSLTR2	40	31
O=C(Nc1cccc(COc2ccccc2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219616	FE	On-Demand	Anodyne	CPT1A	33	40
O=C(Nc1cccc(COc2ccccc2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219616	FE	On-Demand	Anodyne	EPHX2	26	40
O=C(Nc1ccccc1CN1CCSCC1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219620	GD	On-Demand	Anodyne	SLC6A1	52	33
O=C(Nc1ccccc1CN1CCSCC1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219620	GD	On-Demand	Anodyne	CCR3	15	46
O=C(Nc1ccccc1CN1CCSCC1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219621	GD	On-Demand	Anodyne	SLC6A1	52	33
O=C(Nc1ccccc1CN1CCSCC1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219621	GD	On-Demand	Anodyne	CCR3	15	46
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819219629	FG	On-Demand	Anodyne	SLC6A1	69	33
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819219629	FG	On-Demand	Anodyne	LPL	52	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819219629	FG	On-Demand	Anodyne	CCKAR	25	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819219629	FG	On-Demand	Anodyne	CCR3	45	39
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819219629	FG	On-Demand	Anodyne	CCKBR	43	36
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819219629	FG	On-Demand	Anodyne	EPHX2	81	45
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819219629	FG	On-Demand	Anodyne	LIPG	20	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1	ZINC000819219629	FG	On-Demand	Anodyne	KCNK3	59	43
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819219630	FG	On-Demand	Anodyne	SLC6A1	69	33
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819219630	FG	On-Demand	Anodyne	LPL	52	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819219630	FG	On-Demand	Anodyne	CCKAR	25	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819219630	FG	On-Demand	Anodyne	CCR3	45	39
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819219630	FG	On-Demand	Anodyne	CCKBR	43	36
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819219630	FG	On-Demand	Anodyne	EPHX2	81	45
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819219630	FG	On-Demand	Anodyne	LIPG	20	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1	ZINC000819219630	FG	On-Demand	Anodyne	KCNK3	59	43
O=C(Nc1cccc2ccncc12)C(=O)N1CCC(C(=O)O)CC1	ZINC000819219635	ED	On-Demand	Anodyne	TRPV1	26	44
O=C(Nc1cccc2ccncc12)C(=O)N1CCC(C(=O)O)CC1	ZINC000819219635	ED	On-Demand	Anodyne	CDK5	29	46
O=C(Nc1cccc(Oc2ccncc2)c1)NC1(C(=O)O)CCCC1	ZINC000819219636	EG	On-Demand	Anodyne	RAF1	37	55
O=C(Nc1cccc(Oc2ccncc2)c1)NC1(C(=O)O)CCCC1	ZINC000819219636	EG	On-Demand	Anodyne	EPHX2	28	55
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](C(=O)O)C2)nc1	ZINC000819219653	EF	On-Demand	Anodyne	F10	15	43
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](C(=O)O)C2)nc1	ZINC000819219653	EF	On-Demand	Anodyne	MPL	33	44
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](C(=O)O)C2)nc1	ZINC000819219653	EF	On-Demand	Anodyne	PRNP	32	48
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](C(=O)O)C2)nc1	ZINC000819219653	EF	On-Demand	Anodyne	HDAC1	23	45
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](C(=O)O)C2)nc1	ZINC000819219653	EF	On-Demand	Anodyne	GRM5	24	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](C(=O)O)C2)nc1	ZINC000819219653	EF	On-Demand	Anodyne	TYK2	60	38
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](C(=O)O)C2)nc1	ZINC000819219653	EF	On-Demand	Anodyne	MCHR1	22	49
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](C(=O)O)C2)nc1	ZINC000819219653	EF	On-Demand	Anodyne	TAAR1	40	48
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](C(=O)O)C2)nc1	ZINC000819219653	EF	On-Demand	Anodyne	DDR1	23	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](C(=O)O)C2)nc1	ZINC000819219653	EF	On-Demand	Anodyne	DGAT1	41	44
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](C(=O)O)C2)nc1	ZINC000819219653	EF	On-Demand	Anodyne	KCNK3	65	44
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](C(=O)O)C2)nc1	ZINC000819219655	EF	On-Demand	Anodyne	F10	15	43
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](C(=O)O)C2)nc1	ZINC000819219655	EF	On-Demand	Anodyne	MPL	33	44
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](C(=O)O)C2)nc1	ZINC000819219655	EF	On-Demand	Anodyne	PRNP	32	48
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](C(=O)O)C2)nc1	ZINC000819219655	EF	On-Demand	Anodyne	HDAC1	23	45
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](C(=O)O)C2)nc1	ZINC000819219655	EF	On-Demand	Anodyne	GRM5	24	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](C(=O)O)C2)nc1	ZINC000819219655	EF	On-Demand	Anodyne	TYK2	60	38
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](C(=O)O)C2)nc1	ZINC000819219655	EF	On-Demand	Anodyne	MCHR1	22	49
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](C(=O)O)C2)nc1	ZINC000819219655	EF	On-Demand	Anodyne	TAAR1	40	48
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](C(=O)O)C2)nc1	ZINC000819219655	EF	On-Demand	Anodyne	DDR1	23	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](C(=O)O)C2)nc1	ZINC000819219655	EF	On-Demand	Anodyne	DGAT1	41	44
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](C(=O)O)C2)nc1	ZINC000819219655	EF	On-Demand	Anodyne	KCNK3	65	44
O=C(Nc1cccc2ccccc12)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219656	DD	On-Demand	Anodyne	SLC6A1	68	35
O=C(Nc1cccc2ccccc12)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219656	DD	On-Demand	Anodyne	KCNQ2	40	35
O=C(Nc1cccc2ccccc12)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219656	DD	On-Demand	Anodyne	CCR8	72	36
O=C(Nc1cccc2ccccc12)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219658	DD	On-Demand	Anodyne	SLC6A1	68	35
O=C(Nc1cccc2ccccc12)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219658	DD	On-Demand	Anodyne	KCNQ2	40	35
O=C(Nc1cccc2ccccc12)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219658	DD	On-Demand	Anodyne	CCR8	72	36
O=C(Nc1ccccc1-n1ccnn1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219663	EC	On-Demand	Anodyne	KCNQ2	46	36
O=C(Nc1ccccc1-n1ccnn1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219665	EC	On-Demand	Anodyne	KCNQ2	46	36
O=C(Nc1ccccc1N1CCCC1=O)NC1(C(=O)O)CCCC1	ZINC000819219700	EE	On-Demand	Anodyne	KCNQ2	67	37
O=C(Nc1cccc(S(=O)(=O)NC2CC2)c1)NC1(C(=O)O)CCCC1	ZINC000819219701	FD	On-Demand	Anodyne	SFRP1	84	33
O=C(Nc1cccc(S(=O)(=O)NC2CC2)c1)NC1(C(=O)O)CCCC1	ZINC000819219701	FD	On-Demand	Anodyne	WNT3	55	33
COc1ccc(N2CCC(NC(=O)c3coc(=O)c4ccccc34)CC2)cc1	ZINC000819219782	GG	On-Demand	Clean	DRD3	20	41
COc1ccc(N2CCC(NC(=O)c3coc(=O)c4ccccc34)CC2)cc1	ZINC000819219782	GG	On-Demand	Clean	INHA	45	33
COc1ccc(N2CCC(NC(=O)c3coc(=O)c4ccccc34)CC2)cc1	ZINC000819219782	GG	On-Demand	Clean	CNR2	18	40
COc1ccc(N2CCC(NC(=O)c3coc(=O)c4ccccc34)CC2)cc1	ZINC000819219782	GG	On-Demand	Clean	PDK1	41	36
COc1ccc(N2CCC(NC(=O)c3coc(=O)c4ccccc34)CC2)cc1	ZINC000819219782	GG	On-Demand	Clean	MCHR1	15	40
CCN(Cc1ccoc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819219787	EG	On-Demand	Mild	PAPA1_CARPA	47	42
CCN(Cc1ccoc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819219788	EG	On-Demand	Mild	PAPA1_CARPA	47	42
O=C(Nc1ccccc1N1CCN(CCc2ccncc2)CC1)C(F)=C1CCC1	ZINC000819219801	GH	On-Demand	Anodyne	HTR1A	42	44
O=C(Nc1ccccc1N1CCN(CCc2ccncc2)CC1)C(F)=C1CCC1	ZINC000819219801	GH	On-Demand	Anodyne	DRD2	34	48
O=C(Nc1ccccc1N1CCN(CCc2ccncc2)CC1)C(F)=C1CCC1	ZINC000819219801	GH	On-Demand	Anodyne	HTR1D	26	40
O=C(Nc1ccccc1N1CCN(CCc2ccncc2)CC1)C(F)=C1CCC1	ZINC000819219801	GH	On-Demand	Anodyne	HTR1B	25	40
O=C(Nc1ccccc1N1CCN(CCc2ccncc2)CC1)C(F)=C1CCC1	ZINC000819219801	GH	On-Demand	Anodyne	HTR2A	17	40
O=C(Nc1ccccc1N1CCN(CCc2ccncc2)CC1)C(F)=C1CCC1	ZINC000819219801	GH	On-Demand	Anodyne	HTR7	28	40
O=C(Nc1ccccc1N1CCN(CCc2ccncc2)CC1)C(F)=C1CCC1	ZINC000819219801	GH	On-Demand	Anodyne	KCNQ2	72	40
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819219824	ED	On-Demand	Anodyne	ADRB2	31	44
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819219824	ED	On-Demand	Anodyne	ADRB1	37	44
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819219824	ED	On-Demand	Anodyne	ADRB3	116	53
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819219824	ED	On-Demand	Anodyne	KCNA5	20	42
CN(C)S(=O)(=O)c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819219825	ED	On-Demand	Anodyne	ADRB2	31	44
CN(C)S(=O)(=O)c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819219825	ED	On-Demand	Anodyne	ADRB1	37	44
CN(C)S(=O)(=O)c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819219825	ED	On-Demand	Anodyne	ADRB3	116	53
CN(C)S(=O)(=O)c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819219825	ED	On-Demand	Anodyne	KCNA5	20	42
COc1ccc(N2CCC(NC(=O)c3cnc4cc(OC)ccn34)CC2)cc1	ZINC000819219826	GF	On-Demand	Clean	DRD4	43	35
COc1ccc(N2CCC(NC(=O)c3cnc4cc(OC)ccn34)CC2)cc1	ZINC000819219826	GF	On-Demand	Clean	IGF1R	27	44
COc1ccc(N2CCC(NC(=O)c3cnc4cc(OC)ccn34)CC2)cc1	ZINC000819219826	GF	On-Demand	Clean	MAPK13	58	34
COc1ccc(N2CCC(NC(=O)c3cnc4cc(OC)ccn34)CC2)cc1	ZINC000819219826	GF	On-Demand	Clean	PDK1	40	34
COc1ccc(N2CCC(NC(=O)c3cnc4cc(OC)ccn34)CC2)cc1	ZINC000819219826	GF	On-Demand	Clean	MCHR1	17	42
C=C(C)C(C)(C)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819219832	EE	On-Demand	Reactive	SFRP1	120	35
C=C(C)C(C)(C)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000819219832	EE	On-Demand	Reactive	WNT3	82	35
COC(=O)N1CCC[C@H](NC(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)C1	ZINC000819219854	DE	On-Demand	Anodyne	SLC6A4	16	41
COC(=O)N1CCC[C@H](NC(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)C1	ZINC000819219854	DE	On-Demand	Anodyne	SLC6A3	32	41
COC(=O)N1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)C1	ZINC000819219855	DE	On-Demand	Anodyne	SLC6A4	16	41
COC(=O)N1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)C1	ZINC000819219855	DE	On-Demand	Anodyne	SLC6A3	32	41
COC(=O)N1CCC[C@H](NC(=O)[C@H]2C[C@H]2c2ccc(C)cc2)C1	ZINC000819219856	DE	On-Demand	Anodyne	SLC6A4	16	41
COC(=O)N1CCC[C@H](NC(=O)[C@H]2C[C@H]2c2ccc(C)cc2)C1	ZINC000819219856	DE	On-Demand	Anodyne	SLC6A3	32	41
COC(=O)N1CCC[C@H](NC(=O)[C@H]2C[C@@H]2c2ccc(C)cc2)C1	ZINC000819219857	DE	On-Demand	Anodyne	SLC6A4	16	41
COC(=O)N1CCC[C@H](NC(=O)[C@H]2C[C@@H]2c2ccc(C)cc2)C1	ZINC000819219857	DE	On-Demand	Anodyne	SLC6A3	32	41
CC(C)(C#N)CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819219872	CD	On-Demand	Mild	CTSF	56	39
CC(C)(C#N)CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819219872	CD	On-Demand	Mild	O49150_SOLTU	44	38
CC(C)(C#N)CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819219873	CD	On-Demand	Mild	CTSF	56	39
CC(C)(C#N)CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819219873	CD	On-Demand	Mild	O49150_SOLTU	44	38
O=C(Nc1ccccc1N1CCCC1)NC1(C(=O)O)CCCC1	ZINC000819219905	DF	On-Demand	Anodyne	KCNQ2	100	54
O=C(Nc1cccc(S(=O)(=O)NC2CC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219919	GB	On-Demand	Anodyne	ST14	48	39
O=C(Nc1cccc(S(=O)(=O)NC2CC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219919	GB	On-Demand	Anodyne	CCR8	72	34
O=C(Nc1cccc(S(=O)(=O)NC2CC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219919	GB	On-Demand	Anodyne	SFRP1	136	41
O=C(Nc1cccc(S(=O)(=O)NC2CC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219919	GB	On-Demand	Anodyne	WNT3	90	38
O=C(Nc1cccc(S(=O)(=O)NC2CC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219920	GB	On-Demand	Anodyne	ST14	48	39
O=C(Nc1cccc(S(=O)(=O)NC2CC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219920	GB	On-Demand	Anodyne	CCR8	72	34
O=C(Nc1cccc(S(=O)(=O)NC2CC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219920	GB	On-Demand	Anodyne	SFRP1	136	41
O=C(Nc1cccc(S(=O)(=O)NC2CC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219920	GB	On-Demand	Anodyne	WNT3	90	38
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219922	FF	On-Demand	Anodyne	SLC6A1	85	36
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219922	FF	On-Demand	Anodyne	NPY2R	36	40
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219922	FF	On-Demand	Anodyne	PRNP	55	45
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219922	FF	On-Demand	Anodyne	CCKBR	18	43
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219922	FF	On-Demand	Anodyne	EPHX2	33	41
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219922	FF	On-Demand	Anodyne	MCHR1	15	41
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219922	FF	On-Demand	Anodyne	TAAR1	42	39
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219922	FF	On-Demand	Anodyne	P2RY14	40	34
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219922	FF	On-Demand	Anodyne	SMO	20	40
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219922	FF	On-Demand	Anodyne	L3MBTL3	40	38
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219922	FF	On-Demand	Anodyne	KCNK3	141	60
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219922	FF	On-Demand	Anodyne	KCNK9	88	49
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219924	FF	On-Demand	Anodyne	SLC6A1	85	36
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219924	FF	On-Demand	Anodyne	NPY2R	36	40
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219924	FF	On-Demand	Anodyne	PRNP	55	45
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219924	FF	On-Demand	Anodyne	CCKBR	18	43
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219924	FF	On-Demand	Anodyne	EPHX2	33	41
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219924	FF	On-Demand	Anodyne	MCHR1	15	41
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219924	FF	On-Demand	Anodyne	TAAR1	42	39
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219924	FF	On-Demand	Anodyne	P2RY14	40	34
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219924	FF	On-Demand	Anodyne	SMO	20	40
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219924	FF	On-Demand	Anodyne	L3MBTL3	40	38
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219924	FF	On-Demand	Anodyne	KCNK3	141	60
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)c1ccccc1	ZINC000819219924	FF	On-Demand	Anodyne	KCNK9	88	49
O=C(Nc1ccccc1C(=O)N1CCCCC1)NC1(C(=O)O)CCCC1	ZINC000819219926	FF	On-Demand	Anodyne	NPSR1	18	53
O=C(Nc1ccccc1C(=O)N1CCCCC1)NC1(C(=O)O)CCCC1	ZINC000819219926	FF	On-Demand	Anodyne	HCN1	53	34
O=C(Nc1ccccc1C(=O)N1CCCCC1)NC1(C(=O)O)CCCC1	ZINC000819219926	FF	On-Demand	Anodyne	HCN4	48	31
O=C(Nc1ccccc1C(=O)N1CCCCC1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219930	FD	On-Demand	Anodyne	SLC6A1	93	34
O=C(Nc1ccccc1C(=O)N1CCCCC1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219930	FD	On-Demand	Anodyne	NPSR1	17	49
O=C(Nc1ccccc1C(=O)N1CCCCC1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219930	FD	On-Demand	Anodyne	L3MBTL3	67	45
O=C(Nc1ccccc1C(=O)N1CCCCC1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219932	FD	On-Demand	Anodyne	SLC6A1	93	34
O=C(Nc1ccccc1C(=O)N1CCCCC1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219932	FD	On-Demand	Anodyne	NPSR1	17	49
O=C(Nc1ccccc1C(=O)N1CCCCC1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219932	FD	On-Demand	Anodyne	L3MBTL3	67	45
O=C(Nc1ccccc1COc1ccccc1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219937	FE	On-Demand	Anodyne	SLC6A1	56	41
O=C(Nc1ccccc1COc1ccccc1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219939	FE	On-Demand	Anodyne	SLC6A1	56	41
O=C(Nc1cccc(N2CCOC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219945	FE	On-Demand	Anodyne	ACE	37	45
O=C(Nc1cccc(N2CCOC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219945	FE	On-Demand	Anodyne	MME	70	39
O=C(Nc1cccc(N2CCOC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219945	FE	On-Demand	Anodyne	ANPEP	41	36
O=C(Nc1cccc(N2CCOC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219945	FE	On-Demand	Anodyne	ITGA4	33	41
O=C(Nc1cccc(N2CCOC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219945	FE	On-Demand	Anodyne	NAALAD2	31	44
O=C(Nc1cccc(N2CCOC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219945	FE	On-Demand	Anodyne	CAPN1	17	41
O=C(Nc1cccc(N2CCOC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219945	FE	On-Demand	Anodyne	ACE2	69	37
O=C(Nc1cccc(N2CCOC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219945	FE	On-Demand	Anodyne	FPR1	55	49
O=C(Nc1cccc(N2CCOC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219945	FE	On-Demand	Anodyne	BLA1_STEMA	60	34
O=C(Nc1cccc(N2CCOC2=O)c1)N[C@H](Cc1ccccc1)C(=O)O	ZINC000819219945	FE	On-Demand	Anodyne	BRCA1	50	30
O=C(Nc1cccc(NC(=O)c2ccoc2)c1)NC1(C(=O)O)CCCC1	ZINC000819219946	FG	On-Demand	Anodyne	KCNK3	115	63
O=C(Nc1cccc(NC(=O)c2ccoc2)c1)NC1(C(=O)O)CCCC1	ZINC000819219946	FG	On-Demand	Anodyne	KCNK9	70	38
O=C(Nc1cccc(COC2CCCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219952	FE	On-Demand	Anodyne	SLC6A1	49	37
O=C(Nc1cccc(COC2CCCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219955	FE	On-Demand	Anodyne	SLC6A1	49	37
O=C(Nc1cccc(NC(=O)c2cccs2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219957	GD	On-Demand	Anodyne	KCNK3	53	54
O=C(Nc1cccc(NC(=O)c2cccs2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219957	GD	On-Demand	Anodyne	KCNK9	27	54
O=C(Nc1cccc(NC(=O)c2cccs2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219959	GD	On-Demand	Anodyne	KCNK3	53	54
O=C(Nc1cccc(NC(=O)c2cccs2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219959	GD	On-Demand	Anodyne	KCNK9	27	54
O=C(Nc1cnn(CC2CC2)c1)C1=NN(c2ccccc2)[C@H](C(=O)O)C1	ZINC000819219961	FD	On-Demand	Anodyne	PANC	53	37
O=C(Nc1cnn(CC2CC2)c1)C1=NN(c2ccccc2)[C@@H](C(=O)O)C1	ZINC000819219963	FD	On-Demand	Anodyne	PANC	53	37
O=C(Nc1cccc(NC(=O)c2ccncc2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219965	GD	On-Demand	Anodyne	PRNP	45	35
O=C(Nc1cccc(NC(=O)c2ccncc2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219965	GD	On-Demand	Anodyne	KCNK3	97	54
O=C(Nc1cccc(NC(=O)c2ccncc2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219965	GD	On-Demand	Anodyne	KCNK9	47	41
O=C(Nc1cccc(NC(=O)c2ccncc2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219967	GD	On-Demand	Anodyne	PRNP	45	35
O=C(Nc1cccc(NC(=O)c2ccncc2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219967	GD	On-Demand	Anodyne	KCNK3	97	54
O=C(Nc1cccc(NC(=O)c2ccncc2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219967	GD	On-Demand	Anodyne	KCNK9	47	41
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)c1ccccc1	ZINC000819219976	FG	On-Demand	Anodyne	ACE	59	46
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)c1ccccc1	ZINC000819219976	FG	On-Demand	Anodyne	FKBP1A	20	48
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)c1ccccc1	ZINC000819219976	FG	On-Demand	Anodyne	AVPR2	27	41
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)c1ccccc1	ZINC000819219976	FG	On-Demand	Anodyne	CMA1	23	40
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)c1ccccc1	ZINC000819219976	FG	On-Demand	Anodyne	UL80	48	41
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)c1ccccc1	ZINC000819219976	FG	On-Demand	Anodyne	PRNP	54	44
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)c1ccccc1	ZINC000819219976	FG	On-Demand	Anodyne	PREP	78	42
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)c1ccccc1	ZINC000819219976	FG	On-Demand	Anodyne	TAAR1	47	41
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)c1ccccc1	ZINC000819219976	FG	On-Demand	Anodyne	SFRP1	23	40
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)c1ccccc1	ZINC000819219976	FG	On-Demand	Anodyne	WNT3	23	40
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)c1ccccc1	ZINC000819219976	FG	On-Demand	Anodyne	KCNK3	136	55
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)c1ccccc1	ZINC000819219976	FG	On-Demand	Anodyne	KCNK9	82	48
O=C(Nc1cccc(OCc2cccc(F)c2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219997	GE	On-Demand	Anodyne	ERBB2	19	40
O=C(Nc1cccc(OCc2cccc(F)c2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819219997	GE	On-Demand	Anodyne	CCR3	54	41
O=C(Nc1cccc(OCc2cccc(F)c2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219999	GE	On-Demand	Anodyne	ERBB2	19	40
O=C(Nc1cccc(OCc2cccc(F)c2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819219999	GE	On-Demand	Anodyne	CCR3	54	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCO[C@H](C(=O)O)C2)nc1	ZINC000819220013	FE	On-Demand	Anodyne	CPT1A	53	35
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCO[C@H](C(=O)O)C2)nc1	ZINC000819220013	FE	On-Demand	Anodyne	PRNP	22	46
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCO[C@H](C(=O)O)C2)nc1	ZINC000819220013	FE	On-Demand	Anodyne	HDAC1	21	43
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCO[C@H](C(=O)O)C2)nc1	ZINC000819220013	FE	On-Demand	Anodyne	TAAR1	37	46
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCO[C@H](C(=O)O)C2)nc1	ZINC000819220013	FE	On-Demand	Anodyne	DDR1	23	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCO[C@H](C(=O)O)C2)nc1	ZINC000819220013	FE	On-Demand	Anodyne	DGAT1	42	51
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCO[C@H](C(=O)O)C2)nc1	ZINC000819220013	FE	On-Demand	Anodyne	KCNK3	54	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCO[C@@H](C(=O)O)C2)nc1	ZINC000819220014	FE	On-Demand	Anodyne	CPT1A	53	35
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCO[C@@H](C(=O)O)C2)nc1	ZINC000819220014	FE	On-Demand	Anodyne	PRNP	22	46
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCO[C@@H](C(=O)O)C2)nc1	ZINC000819220014	FE	On-Demand	Anodyne	HDAC1	21	43
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCO[C@@H](C(=O)O)C2)nc1	ZINC000819220014	FE	On-Demand	Anodyne	TAAR1	37	46
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCO[C@@H](C(=O)O)C2)nc1	ZINC000819220014	FE	On-Demand	Anodyne	DDR1	23	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCO[C@@H](C(=O)O)C2)nc1	ZINC000819220014	FE	On-Demand	Anodyne	DGAT1	42	51
O=C(Nc1cccc(Cl)c1)c1ccc(N2CCO[C@@H](C(=O)O)C2)nc1	ZINC000819220014	FE	On-Demand	Anodyne	KCNK3	54	41
O=C(Nc1cccc(N2CCCCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819220017	EG	On-Demand	Anodyne	EPHX2	30	40
O=C(Nc1cccc(F)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819220033	CC	On-Demand	Anodyne	SLC6A1	57	37
O=C(Nc1cccc(F)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819220033	CC	On-Demand	Anodyne	TAAR1	18	42
O=C(Nc1cccc(F)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819220036	CC	On-Demand	Anodyne	SLC6A1	57	37
O=C(Nc1cccc(F)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819220036	CC	On-Demand	Anodyne	TAAR1	18	42
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)C1CC1	ZINC000819220049	DE	On-Demand	Anodyne	ACE	52	42
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)C1CC1	ZINC000819220049	DE	On-Demand	Anodyne	FKBP1A	21	47
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)C1CC1	ZINC000819220049	DE	On-Demand	Anodyne	UL80	44	48
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)C1CC1	ZINC000819220049	DE	On-Demand	Anodyne	PREP	57	40
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)C1CC1	ZINC000819220049	DE	On-Demand	Anodyne	SFRP1	23	40
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)C1CC1	ZINC000819220049	DE	On-Demand	Anodyne	KCNK3	38	50
O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819220057	GC	On-Demand	Anodyne	CPT1A	109	45
O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819220057	GC	On-Demand	Anodyne	CPT2	47	38
O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819220057	GC	On-Demand	Anodyne	EPHX2	26	41
O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819220059	GC	On-Demand	Anodyne	CPT1A	109	45
O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819220059	GC	On-Demand	Anodyne	CPT2	47	38
O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819220059	GC	On-Demand	Anodyne	EPHX2	26	41
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)c1cccs1	ZINC000819220061	FF	On-Demand	Anodyne	NOS1	40	39
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)c1cccs1	ZINC000819220061	FF	On-Demand	Anodyne	KCNK3	59	56
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)c1cccs1	ZINC000819220061	FF	On-Demand	Anodyne	KCNK9	28	56
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)c1cccs1	ZINC000819220062	FF	On-Demand	Anodyne	NOS1	40	39
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)c1cccs1	ZINC000819220062	FF	On-Demand	Anodyne	KCNK3	59	56
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)c1cccs1	ZINC000819220062	FF	On-Demand	Anodyne	KCNK9	28	56
O=C(Nc1cccc2ccncc12)C(=O)N1CCO[C@@H](C(=O)O)C1	ZINC000819220071	EC	On-Demand	Anodyne	CDK5	25	41
O=C(Nc1cccc2ccncc12)C(=O)N1CCO[C@H](C(=O)O)C1	ZINC000819220073	EC	On-Demand	Anodyne	CDK5	25	41
O=C(Nc1cnn(CCN2CCOCC2)c1)NC1(C(=O)O)CCCC1	ZINC000819220074	FC	On-Demand	Anodyne	EPHX2	28	41
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)c1cccs1	ZINC000819220075	FG	On-Demand	Anodyne	ACE	47	39
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)c1cccs1	ZINC000819220075	FG	On-Demand	Anodyne	PREP	51	34
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)c1cccs1	ZINC000819220075	FG	On-Demand	Anodyne	NOS1	42	38
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)c1cccs1	ZINC000819220075	FG	On-Demand	Anodyne	KCNK3	60	55
O=C(Nc1cccc(NC(=O)N2CCC[C@H]2C(=O)O)c1)c1cccs1	ZINC000819220075	FG	On-Demand	Anodyne	KCNK9	32	55
O=C(Nc1ccccc1-n1cncn1)C(=O)N1CC[C@H](C(=O)O)C1	ZINC000819220081	EC	On-Demand	Anodyne	KCNQ2	46	36
O=C(Nc1ccccc1-n1cncn1)C(=O)N1CC[C@@H](C(=O)O)C1	ZINC000819220082	EC	On-Demand	Anodyne	KCNQ2	46	36
O=C(NCC(=O)N1CCc2ccccc2C1)C(F)=C1CCC1	ZINC000819220091	DE	On-Demand	Anodyne	DPP8	29	52
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819220094	GD	On-Demand	Bother	ADRB3	23	45
CN(C)S(=O)(=O)c1cccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819220095	GD	On-Demand	Bother	ADRB3	23	45
O[C@H]1CCN(Cc2ccccc2CNC[C@H](O)c2ccccc2Cl)C1	ZINC000819220102	FF	On-Demand	Anodyne	Q2TU57_MAIZE	18	40
O[C@@H]1CCN(Cc2ccccc2CNC[C@H](O)c2ccccc2Cl)C1	ZINC000819220103	FF	On-Demand	Anodyne	Q2TU57_MAIZE	18	40
O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C(F)=C1CCC1	ZINC000819220115	ED	On-Demand	Reactive	SFRP1	55	31
CC(C)(C#N)CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819220122	FF	On-Demand	Mild	CTSD	99	45
CC(C)(C#N)CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819220122	FF	On-Demand	Mild	PGC	58	40
CC(C)(C#N)CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819220122	FF	On-Demand	Mild	CTSB	37	40
CC(C)(C#N)CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819220122	FF	On-Demand	Mild	PAPA1_CARPA	65	53
CC(C)(C#N)CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819220122	FF	On-Demand	Mild	CTSK	22	52
CC(C)(C#N)CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819220122	FF	On-Demand	Mild	CTSL	25	53
CC(C)(C#N)CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819220122	FF	On-Demand	Mild	PGA	34	41
CC(C)(C#N)CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819220122	FF	On-Demand	Mild	BACE2	47	41
CC(C)(C#N)CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819220122	FF	On-Demand	Mild	TACR3	15	41
CC(C)(C#N)CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819220122	FF	On-Demand	Mild	REN	74	49
CC(C)(C#N)CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819220122	FF	On-Demand	Mild	REN1	21	47
CC(C)(C#N)CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819220122	FF	On-Demand	Mild	CTSS	15	53
CC(C)(C#N)CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819220122	FF	On-Demand	Mild	BACE1	85	44
CC(C)(C#N)CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819220122	FF	On-Demand	Mild	FPR1	52	42
CC(C)(C#N)CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819220122	FF	On-Demand	Mild	CTRB_BOVIN	59	39
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819220144	FE	On-Demand	Anodyne	ADRB2	37	51
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819220144	FE	On-Demand	Anodyne	ADRB1	50	51
CN(C)S(=O)(=O)c1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819220144	FE	On-Demand	Anodyne	ADRB3	67	55
CN(C)S(=O)(=O)c1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819220145	FE	On-Demand	Anodyne	ADRB2	37	51
CN(C)S(=O)(=O)c1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819220145	FE	On-Demand	Anodyne	ADRB1	50	51
CN(C)S(=O)(=O)c1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819220145	FE	On-Demand	Anodyne	ADRB3	67	55
O[C@@H]1CCN(Cc2ccccc2CNC[C@H](O)c2cccnc2)C1	ZINC000819220164	ED	On-Demand	Anodyne	OPRK1	16	42
O[C@@H]1CCN(Cc2ccccc2CNC[C@H](O)c2cccnc2)C1	ZINC000819220164	ED	On-Demand	Anodyne	ADRB3	74	43
O[C@H]1CCN(Cc2ccccc2CNC[C@H](O)c2cccnc2)C1	ZINC000819220165	ED	On-Demand	Anodyne	OPRK1	16	42
O[C@H]1CCN(Cc2ccccc2CNC[C@H](O)c2cccnc2)C1	ZINC000819220165	ED	On-Demand	Anodyne	ADRB3	74	43
O[C@H]1CCN(Cc2ccccc2CNC[C@@H](O)c2cccnc2)C1	ZINC000819220166	ED	On-Demand	Anodyne	OPRK1	16	42
O[C@H]1CCN(Cc2ccccc2CNC[C@@H](O)c2cccnc2)C1	ZINC000819220166	ED	On-Demand	Anodyne	ADRB3	74	43
O[C@H](CNCc1ccccc1CN1CC[C@@H](O)C1)c1cccnc1	ZINC000819220167	ED	On-Demand	Anodyne	OPRK1	16	42
O[C@H](CNCc1ccccc1CN1CC[C@@H](O)C1)c1cccnc1	ZINC000819220167	ED	On-Demand	Anodyne	ADRB3	74	43
COc1ccc(N2CCC(NC(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819220175	GF	On-Demand	Clean	HTR1A	17	45
COc1ccc(N2CCC(NC(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819220175	GF	On-Demand	Clean	DRD2	16	45
COc1ccc(N2CCC(NC(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819220175	GF	On-Demand	Clean	TSHR	63	33
COc1ccc(N2CCC(NC(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819220175	GF	On-Demand	Clean	HTR1D	28	42
COc1ccc(N2CCC(NC(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819220175	GF	On-Demand	Clean	HTR1B	27	42
COc1ccc(N2CCC(NC(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819220175	GF	On-Demand	Clean	DRD3	18	41
COc1ccc(N2CCC(NC(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819220175	GF	On-Demand	Clean	F10	15	44
COc1ccc(N2CCC(NC(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819220175	GF	On-Demand	Clean	SIGMAR1	29	54
COc1ccc(N2CCC(NC(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819220175	GF	On-Demand	Clean	CCR3	44	41
COc1ccc(N2CCC(NC(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819220175	GF	On-Demand	Clean	MTNR1A	64	48
COc1ccc(N2CCC(NC(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819220175	GF	On-Demand	Clean	MTNR1B	62	48
COc1ccc(N2CCC(NC(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819220175	GF	On-Demand	Clean	EPHX2	32	44
COc1ccc(N2CCC(NC(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819220175	GF	On-Demand	Clean	MCHR1	57	45
O=[N+]([O-])c1cccc([C@H](O)CNC2CCC(c3ccc(F)cc3)CC2)c1	ZINC000819220194	FI	On-Demand	Bother	CACNA1D	49	33
O=[N+]([O-])c1cccc([C@@H](O)CNC2CCC(c3ccc(F)cc3)CC2)c1	ZINC000819220195	FI	On-Demand	Bother	CACNA1D	49	33
COC(=O)N1CCC[C@@H](NC(=O)c2coc3c(C)cccc23)C1	ZINC000819220196	DF	On-Demand	Anodyne	CCR8	68	39
COC(=O)N1CCC[C@H](NC(=O)c2coc3c(C)cccc23)C1	ZINC000819220197	DF	On-Demand	Anodyne	CCR8	68	39
COc1ccc(N2CCC(NC(=O)C[C@H](C)n3cccn3)CC2)cc1	ZINC000819220210	EF	On-Demand	Clean	MCHR1	18	42
COc1ccc(N2CCC(NC(=O)C[C@@H](C)n3cccn3)CC2)cc1	ZINC000819220211	EF	On-Demand	Clean	MCHR1	18	42
C[C@@H](NC[C@@H](O)c1cccnc1)C1=CCN(C)CC1	ZINC000819220230	CD	On-Demand	Anodyne	ADRB1	19	45
C[C@@H](NC[C@@H](O)c1cccnc1)C1=CCN(C)CC1	ZINC000819220230	CD	On-Demand	Anodyne	ADRB3	57	45
C[C@H](NC[C@H](O)c1cccnc1)C1=CCN(C)CC1	ZINC000819220232	CD	On-Demand	Anodyne	ADRB1	19	45
C[C@H](NC[C@H](O)c1cccnc1)C1=CCN(C)CC1	ZINC000819220232	CD	On-Demand	Anodyne	ADRB3	57	45
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)c1	ZINC000819220282	FG	On-Demand	Anodyne	ADRB2	19	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)c1	ZINC000819220282	FG	On-Demand	Anodyne	ADRB3	15	43
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)c1	ZINC000819220283	FG	On-Demand	Anodyne	ADRB2	19	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)c1	ZINC000819220283	FG	On-Demand	Anodyne	ADRB3	15	43
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)c1	ZINC000819220284	FG	On-Demand	Anodyne	ADRB2	19	41
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)c1	ZINC000819220284	FG	On-Demand	Anodyne	ADRB3	15	43
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)c1	ZINC000819220285	FG	On-Demand	Anodyne	ADRB2	19	41
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)c1	ZINC000819220285	FG	On-Demand	Anodyne	ADRB3	15	43
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C(=O)/C=C/[C@@H]2CCCO2)C1	ZINC000819220292	EE	On-Demand	Anodyne	CCR3	33	41
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C(=O)/C=C/[C@@H]2CCCO2)C1	ZINC000819220292	EE	On-Demand	Anodyne	EPHX2	47	42
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C(=O)/C=C\[C@@H]2CCCO2)C1	ZINC000819220293	EE	On-Demand	Anodyne	CCR3	33	41
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C(=O)/C=C\[C@@H]2CCCO2)C1	ZINC000819220293	EE	On-Demand	Anodyne	EPHX2	47	42
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C(=O)/C=C/[C@H]2CCCO2)C1	ZINC000819220294	EE	On-Demand	Anodyne	CCR3	33	41
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C(=O)/C=C/[C@H]2CCCO2)C1	ZINC000819220294	EE	On-Demand	Anodyne	EPHX2	47	42
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C(=O)/C=C\[C@H]2CCCO2)C1	ZINC000819220295	EE	On-Demand	Anodyne	CCR3	33	41
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C(=O)/C=C\[C@H]2CCCO2)C1	ZINC000819220295	EE	On-Demand	Anodyne	EPHX2	47	42
O=C(CN1C(=O)COc2ccc(Cl)cc21)Nc1cccnc1Cl	ZINC000819220300	FF	On-Demand	Anodyne	G2YM83_BOTF4	59	32
O[C@@H](CN[C@@H]1CCCc2cn(C3CCCC3)nc21)c1cccc(Cl)c1	ZINC000819220301	FI	On-Demand	Anodyne	ADRB1	21	43
O[C@@H](CN[C@@H]1CCCc2cn(C3CCCC3)nc21)c1cccc(Cl)c1	ZINC000819220301	FI	On-Demand	Anodyne	ADRB3	35	46
O[C@@H](CN[C@H]1CCCc2cn(C3CCCC3)nc21)c1cccc(Cl)c1	ZINC000819220302	FI	On-Demand	Anodyne	ADRB1	21	43
O[C@@H](CN[C@H]1CCCc2cn(C3CCCC3)nc21)c1cccc(Cl)c1	ZINC000819220302	FI	On-Demand	Anodyne	ADRB3	35	46
O[C@H](CN[C@H]1CCCc2cn(C3CCCC3)nc21)c1cccc(Cl)c1	ZINC000819220303	FI	On-Demand	Anodyne	ADRB1	21	43
O[C@H](CN[C@H]1CCCc2cn(C3CCCC3)nc21)c1cccc(Cl)c1	ZINC000819220303	FI	On-Demand	Anodyne	ADRB3	35	46
O[C@H](CN[C@@H]1CCCc2cn(C3CCCC3)nc21)c1cccc(Cl)c1	ZINC000819220304	FI	On-Demand	Anodyne	ADRB1	21	43
O[C@H](CN[C@@H]1CCCc2cn(C3CCCC3)nc21)c1cccc(Cl)c1	ZINC000819220304	FI	On-Demand	Anodyne	ADRB3	35	46
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C1=CCN(C)CC1	ZINC000819220319	FE	On-Demand	Anodyne	GPR119	41	43
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C1=CCN(C)CC1	ZINC000819220322	FE	On-Demand	Anodyne	GPR119	41	43
CC(C)n1cc2c(n1)[C@H](NC[C@H](O)COc1ccc(F)cc1)CCC2	ZINC000819220328	EG	On-Demand	Anodyne	ADRB3	17	45
CC(C)n1cc2c(n1)[C@H](NC[C@@H](O)COc1ccc(F)cc1)CCC2	ZINC000819220329	EG	On-Demand	Anodyne	ADRB3	17	45
CC(C)n1cc2c(n1)[C@H](NC[C@H](O)COc1ccccc1C(F)(F)F)CCC2	ZINC000819220333	GH	On-Demand	Anodyne	ADRB2	16	41
CC(C)n1cc2c(n1)[C@H](NC[C@@H](O)COc1ccccc1C(F)(F)F)CCC2	ZINC000819220334	GH	On-Demand	Anodyne	ADRB2	16	41
O=C(NCCc1nc(-c2ccncc2)cs1)C(F)=C1CCC1	ZINC000819220338	DG	On-Demand	Anodyne	ROCK1	21	43
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220351	FG	On-Demand	Anodyne	ADRB2	21	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220351	FG	On-Demand	Anodyne	ADRB1	33	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220351	FG	On-Demand	Anodyne	ADRB3	18	43
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220352	FG	On-Demand	Anodyne	ADRB2	21	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220352	FG	On-Demand	Anodyne	ADRB1	33	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220352	FG	On-Demand	Anodyne	ADRB3	18	43
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220353	FG	On-Demand	Anodyne	ADRB2	21	40
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220353	FG	On-Demand	Anodyne	ADRB1	33	40
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220353	FG	On-Demand	Anodyne	ADRB3	18	43
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220354	FG	On-Demand	Anodyne	ADRB2	21	40
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220354	FG	On-Demand	Anodyne	ADRB1	33	40
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220354	FG	On-Demand	Anodyne	ADRB3	18	43
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H](C2OCCO2)C1	ZINC000819220360	ED	On-Demand	Anodyne	KCNJ1	45	36
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H](C2OCCO2)C1	ZINC000819220361	ED	On-Demand	Anodyne	KCNJ1	45	36
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(C(=O)C(F)=C2CCC2)C1	ZINC000819220426	EF	On-Demand	Anodyne	CCR3	39	43
O=C(Nc1ccc(F)cc1)N[C@H]1CCN(C(=O)C(F)=C2CCC2)C1	ZINC000819220426	EF	On-Demand	Anodyne	EPHX2	48	45
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cccc(Br)c1)C2	ZINC000819220431	GH	On-Demand	Anodyne	ADRB3	31	58
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cccc(Br)c1)C2	ZINC000819220434	GH	On-Demand	Anodyne	ADRB3	31	58
N#CCCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819220435	BD	On-Demand	Mild	ADRB3	41	36
N#CCCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819220436	BD	On-Demand	Mild	ADRB3	41	36
O=C(C(F)=C1CCC1)N1CCCC[C@H]1c1nc(-c2ccccc2)no1	ZINC000819220445	EI	On-Demand	Anodyne	CPT1A	124	57
O=C(C(F)=C1CCC1)N1CCCC[C@H]1c1nc(-c2ccccc2)no1	ZINC000819220445	EI	On-Demand	Anodyne	GRM5	24	57
O=C(C(F)=C1CCC1)N1CCCC[C@H]1c1nc(-c2ccccc2)no1	ZINC000819220445	EI	On-Demand	Anodyne	ETHR	38	43
O=C(C(F)=C1CCC1)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000819220446	EI	On-Demand	Anodyne	CPT1A	124	57
O=C(C(F)=C1CCC1)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000819220446	EI	On-Demand	Anodyne	GRM5	24	57
O=C(C(F)=C1CCC1)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000819220446	EI	On-Demand	Anodyne	ETHR	38	43
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C(=O)C(F)=C2CCC2)C1	ZINC000819220447	EF	On-Demand	Anodyne	CCR3	39	43
O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C(=O)C(F)=C2CCC2)C1	ZINC000819220447	EF	On-Demand	Anodyne	EPHX2	48	45
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)C1CC1	ZINC000819220454	DE	On-Demand	Anodyne	SPHK1	34	40
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)C1CC1	ZINC000819220456	DE	On-Demand	Anodyne	SPHK1	34	40
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220458	GI	On-Demand	Anodyne	ADRB1	30	40
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220458	GI	On-Demand	Anodyne	DRD2	15	42
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220458	GI	On-Demand	Anodyne	DRD4	49	42
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220458	GI	On-Demand	Anodyne	ACHE	37	40
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220458	GI	On-Demand	Anodyne	SLC6A3	27	50
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220458	GI	On-Demand	Anodyne	ADRB3	48	40
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220458	GI	On-Demand	Anodyne	SIGMAR1	44	53
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220458	GI	On-Demand	Anodyne	SSTR5	51	36
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220458	GI	On-Demand	Anodyne	CCR3	21	42
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220458	GI	On-Demand	Anodyne	MCHR1	33	43
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220460	GI	On-Demand	Anodyne	ADRB1	30	40
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220460	GI	On-Demand	Anodyne	DRD2	15	42
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220460	GI	On-Demand	Anodyne	DRD4	49	42
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220460	GI	On-Demand	Anodyne	ACHE	37	40
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220460	GI	On-Demand	Anodyne	SLC6A3	27	50
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220460	GI	On-Demand	Anodyne	ADRB3	48	40
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220460	GI	On-Demand	Anodyne	SIGMAR1	44	53
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220460	GI	On-Demand	Anodyne	SSTR5	51	36
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220460	GI	On-Demand	Anodyne	CCR3	21	42
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1	ZINC000819220460	GI	On-Demand	Anodyne	MCHR1	33	43
O=C(NCCCNC(=O)c1ccc(Br)cc1)C(F)=C1CCC1	ZINC000819220463	FG	On-Demand	Anodyne	HDAC9	15	40
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1cccc(Cl)c1	ZINC000819220470	GH	On-Demand	Anodyne	ADRB1	47	48
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1cccc(Cl)c1	ZINC000819220470	GH	On-Demand	Anodyne	ADRB3	77	48
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1cccc(Cl)c1	ZINC000819220472	GH	On-Demand	Anodyne	ADRB1	47	48
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1cccc(Cl)c1	ZINC000819220472	GH	On-Demand	Anodyne	ADRB3	77	48
CC(C)n1cc2c(n1)[C@H](NC[C@H](O)COc1cccc3ccccc13)CCC2	ZINC000819220534	GI	On-Demand	Anodyne	ADRB2	26	50
CC(C)n1cc2c(n1)[C@H](NC[C@H](O)COc1cccc3ccccc13)CCC2	ZINC000819220534	GI	On-Demand	Anodyne	ADRB1	23	50
CC(C)n1cc2c(n1)[C@H](NC[C@@H](O)COc1cccc3ccccc13)CCC2	ZINC000819220536	GI	On-Demand	Anodyne	ADRB2	26	50
CC(C)n1cc2c(n1)[C@H](NC[C@@H](O)COc1cccc3ccccc13)CCC2	ZINC000819220536	GI	On-Demand	Anodyne	ADRB1	23	50
O=C(C(F)=C1CCC1)N(CCc1ccccc1)Cc1cccnc1	ZINC000819220544	DI	On-Demand	Anodyne	TBXAS1	30	40
O=C(C(F)=C1CCC1)N(CCc1ccccc1)Cc1cccnc1	ZINC000819220544	DI	On-Demand	Anodyne	CHRNA7	42	38
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccccc1Br)C2	ZINC000819220611	GH	On-Demand	Anodyne	ADRB3	22	49
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccccc1Br)C2	ZINC000819220612	GH	On-Demand	Anodyne	ADRB3	22	49
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(F)cc1F)C2	ZINC000819220615	EG	On-Demand	Anodyne	ADRB3	22	49
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(F)cc1F)C2	ZINC000819220616	EG	On-Demand	Anodyne	ADRB3	22	49
COc1ccc2c(c1)CC[C@H](NCCS(C)(=O)=O)C2	ZINC000819220618	CD	On-Demand	Anodyne	NQO2	24	40
O[C@@H](CNC[C@@H]1CCCCS1)c1cccc(Cl)c1	ZINC000819220633	CG	On-Demand	Anodyne	ADRB1	40	44
O[C@@H](CNC[C@@H]1CCCCS1)c1cccc(Cl)c1	ZINC000819220633	CG	On-Demand	Anodyne	ADRB3	52	44
O[C@@H](CNC[C@H]1CCCCS1)c1cccc(Cl)c1	ZINC000819220634	CG	On-Demand	Anodyne	ADRB1	40	44
O[C@@H](CNC[C@H]1CCCCS1)c1cccc(Cl)c1	ZINC000819220634	CG	On-Demand	Anodyne	ADRB3	52	44
O[C@H](CNC[C@@H]1CCCCS1)c1cccc(Cl)c1	ZINC000819220635	CG	On-Demand	Anodyne	ADRB1	40	44
O[C@H](CNC[C@@H]1CCCCS1)c1cccc(Cl)c1	ZINC000819220635	CG	On-Demand	Anodyne	ADRB3	52	44
O[C@H](CNC[C@H]1CCCCS1)c1cccc(Cl)c1	ZINC000819220636	CG	On-Demand	Anodyne	ADRB1	40	44
O[C@H](CNC[C@H]1CCCCS1)c1cccc(Cl)c1	ZINC000819220636	CG	On-Demand	Anodyne	ADRB3	52	44
COc1ccc2c(c1)CC[C@H](NCCC(=O)N(C)OC)C2	ZINC000819220650	CD	On-Demand	Anodyne	ADRB3	16	41
COc1ccc2c(c1)CC[C@H](NCCC(=O)N(C)OC)C2	ZINC000819220650	CD	On-Demand	Anodyne	NQO2	29	42
COc1ccc2c(c1)CC[C@H](NCCC(=O)N(C)OC)C2	ZINC000819220650	CD	On-Demand	Anodyne	MTNR1A	30	41
COc1ccc2c(c1)CC[C@H](NCCC(=O)N(C)OC)C2	ZINC000819220650	CD	On-Demand	Anodyne	MTNR1B	25	40
N#CCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819220669	CE	On-Demand	Mild	ADRB2	19	41
N#CCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819220669	CE	On-Demand	Mild	ADRB1	16	41
N#CCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819220669	CE	On-Demand	Mild	ADRB3	15	41
N#CCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819220670	CE	On-Demand	Mild	ADRB2	19	41
N#CCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819220670	CE	On-Demand	Mild	ADRB1	16	41
N#CCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819220670	CE	On-Demand	Mild	ADRB3	15	41
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccc(F)cc1	ZINC000819220671	FG	On-Demand	Anodyne	ADRB3	29	48
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccc(F)cc1	ZINC000819220672	FG	On-Demand	Anodyne	ADRB3	29	48
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1cccc(F)c1	ZINC000819220673	GI	On-Demand	Anodyne	SIGMAR1	26	48
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1cccc(F)c1	ZINC000819220673	GI	On-Demand	Anodyne	CCR3	24	43
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1cccc(F)c1	ZINC000819220674	GI	On-Demand	Anodyne	SIGMAR1	26	48
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1cccc(F)c1	ZINC000819220674	GI	On-Demand	Anodyne	CCR3	24	43
CCCn1c(NC(=O)/C=C\[C@H]2CCCO2)nc2ccccc21	ZINC000819220681	CG	On-Demand	Anodyne	ITK	42	41
CCCn1c(NC(=O)/C=C/[C@@H]2CCCO2)nc2ccccc21	ZINC000819220682	CG	On-Demand	Anodyne	ITK	42	41
CCCn1c(NC(=O)/C=C/[C@H]2CCCO2)nc2ccccc21	ZINC000819220684	CG	On-Demand	Anodyne	ITK	42	41
CCCn1c(NC(=O)/C=C\[C@@H]2CCCO2)nc2ccccc21	ZINC000819220686	CG	On-Demand	Anodyne	ITK	42	41
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(F)cc1)C2	ZINC000819220687	DG	On-Demand	Anodyne	ADRB3	26	55
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(F)cc1)C2	ZINC000819220692	DG	On-Demand	Anodyne	ADRB3	26	55
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220706	EG	On-Demand	Anodyne	ADRB2	25	46
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220708	EG	On-Demand	Anodyne	ADRB2	25	46
Cc1ccc(OC[C@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220711	EG	On-Demand	Anodyne	ADRB2	25	46
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220713	EG	On-Demand	Anodyne	ADRB2	25	46
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220751	GF	On-Demand	Anodyne	ADRB2	29	52
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220751	GF	On-Demand	Anodyne	ADRB1	57	52
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220751	GF	On-Demand	Anodyne	ADRB3	34	43
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220752	GF	On-Demand	Anodyne	ADRB2	29	52
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220752	GF	On-Demand	Anodyne	ADRB1	57	52
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220752	GF	On-Demand	Anodyne	ADRB3	34	43
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220753	GF	On-Demand	Anodyne	ADRB2	29	52
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220753	GF	On-Demand	Anodyne	ADRB1	57	52
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220753	GF	On-Demand	Anodyne	ADRB3	34	43
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220754	GF	On-Demand	Anodyne	ADRB2	29	52
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220754	GF	On-Demand	Anodyne	ADRB1	57	52
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220754	GF	On-Demand	Anodyne	ADRB3	34	43
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)Nc2cccnc2Cl)c1	ZINC000819220764	II	On-Demand	Anodyne	KCNK3	46	42
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)Nc2cccnc2Cl)c1	ZINC000819220764	II	On-Demand	Anodyne	KCNK9	37	42
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)Nc2cccnc2Cl)c1	ZINC000819220764	II	On-Demand	Anodyne	G2YM83_BOTF4	78	41
CC(C)n1cc2c(n1)[C@H](NC[C@H](O)COc1ccccc1F)CCC2	ZINC000819220792	EG	On-Demand	Anodyne	ADRB2	17	43
CC(C)n1cc2c(n1)[C@H](NC[C@@H](O)COc1ccccc1F)CCC2	ZINC000819220793	EG	On-Demand	Anodyne	ADRB2	17	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCCS1	ZINC000819220833	GG	On-Demand	Anodyne	CTSD	96	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCCS1	ZINC000819220833	GG	On-Demand	Anodyne	PGC	63	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCCS1	ZINC000819220833	GG	On-Demand	Anodyne	PAPA1_CARPA	31	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCCS1	ZINC000819220833	GG	On-Demand	Anodyne	CTSL	15	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCCS1	ZINC000819220833	GG	On-Demand	Anodyne	PGA	44	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCCS1	ZINC000819220833	GG	On-Demand	Anodyne	BACE2	51	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCCS1	ZINC000819220833	GG	On-Demand	Anodyne	REN	108	53
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCCS1	ZINC000819220833	GG	On-Demand	Anodyne	REN1	23	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCCS1	ZINC000819220833	GG	On-Demand	Anodyne	BACE1	75	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCCS1	ZINC000819220833	GG	On-Demand	Anodyne	FPR1	50	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCCS1	ZINC000819220833	GG	On-Demand	Anodyne	PLM1_PLAFA	27	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCCS1	ZINC000819220834	GG	On-Demand	Anodyne	CTSD	96	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCCS1	ZINC000819220834	GG	On-Demand	Anodyne	PGC	63	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCCS1	ZINC000819220834	GG	On-Demand	Anodyne	PAPA1_CARPA	31	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCCS1	ZINC000819220834	GG	On-Demand	Anodyne	CTSL	15	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCCS1	ZINC000819220834	GG	On-Demand	Anodyne	PGA	44	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCCS1	ZINC000819220834	GG	On-Demand	Anodyne	BACE2	51	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCCS1	ZINC000819220834	GG	On-Demand	Anodyne	REN	108	53
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCCS1	ZINC000819220834	GG	On-Demand	Anodyne	REN1	23	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCCS1	ZINC000819220834	GG	On-Demand	Anodyne	BACE1	75	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCCS1	ZINC000819220834	GG	On-Demand	Anodyne	FPR1	50	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCCS1	ZINC000819220834	GG	On-Demand	Anodyne	PLM1_PLAFA	27	42
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(F)cc1C)C2	ZINC000819220849	EG	On-Demand	Anodyne	ADRB3	21	49
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(F)cc1C)C2	ZINC000819220850	EG	On-Demand	Anodyne	ADRB3	21	49
N#CCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819220865	BE	On-Demand	Mild	ADRB2	51	43
N#CCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819220865	BE	On-Demand	Mild	ADRB1	59	51
N#CCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819220865	BE	On-Demand	Mild	ADRB3	67	51
N#CCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819220866	BE	On-Demand	Mild	ADRB2	51	43
N#CCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819220866	BE	On-Demand	Mild	ADRB1	59	51
N#CCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819220866	BE	On-Demand	Mild	ADRB3	67	51
CCCn1c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc21	ZINC000819220871	GH	On-Demand	Mild	PAPA1_CARPA	41	43
CCCn1c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc21	ZINC000819220871	GH	On-Demand	Mild	FPR1	45	39
CCCn1c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc21	ZINC000819220872	GH	On-Demand	Mild	PAPA1_CARPA	41	43
CCCn1c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)nc2ccccc21	ZINC000819220872	GH	On-Demand	Mild	FPR1	45	39
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)C2	ZINC000819220873	FE	On-Demand	Anodyne	ADRB3	20	44
COc1ccc2c(c1)CC[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C2	ZINC000819220875	FE	On-Demand	Anodyne	ADRB3	20	44
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(F)cn1)C2	ZINC000819220884	DE	On-Demand	Anodyne	ADRB3	21	47
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(F)cn1)C2	ZINC000819220886	DE	On-Demand	Anodyne	ADRB3	21	47
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220920	GG	On-Demand	Anodyne	ADRB1	56	43
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220920	GG	On-Demand	Anodyne	ADRB3	40	41
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220921	GG	On-Demand	Anodyne	ADRB1	56	43
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220921	GG	On-Demand	Anodyne	ADRB3	40	41
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220922	GG	On-Demand	Anodyne	ADRB1	56	43
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220922	GG	On-Demand	Anodyne	ADRB3	40	41
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220923	GG	On-Demand	Anodyne	ADRB1	56	43
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3cn(C(C)C)nc32)cc1	ZINC000819220923	GG	On-Demand	Anodyne	ADRB3	40	41
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000819220954	GH	On-Demand	Anodyne	CPT1A	19	42
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000819220954	GH	On-Demand	Anodyne	GRM5	21	55
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000819220954	GH	On-Demand	Anodyne	SMO	36	41
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000819220954	GH	On-Demand	Anodyne	ETHR	56	39
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000819220955	GH	On-Demand	Anodyne	CPT1A	19	42
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000819220955	GH	On-Demand	Anodyne	GRM5	21	55
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000819220955	GH	On-Demand	Anodyne	SMO	36	41
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000819220955	GH	On-Demand	Anodyne	ETHR	56	39
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000819220956	GH	On-Demand	Anodyne	CPT1A	19	42
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000819220956	GH	On-Demand	Anodyne	GRM5	21	55
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000819220956	GH	On-Demand	Anodyne	SMO	36	41
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000819220956	GH	On-Demand	Anodyne	ETHR	56	39
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000819220957	GH	On-Demand	Anodyne	CPT1A	19	42
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000819220957	GH	On-Demand	Anodyne	GRM5	21	55
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000819220957	GH	On-Demand	Anodyne	SMO	36	41
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000819220957	GH	On-Demand	Anodyne	ETHR	56	39
CC(=O)Nc1cccc(CC(=O)NCc2ncc(Cl)n2C)c1	ZINC000819220977	DD	On-Demand	Anodyne	PTGIR	16	40
COc1cccc([S@@](=O)CC(=O)NCc2ncc(Cl)n2C)c1	ZINC000819221003	ED	On-Demand	Anodyne	DRD4	43	33
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2nc(-c3ccc(F)cc3)no2)c1	ZINC000819221020	GG	On-Demand	Bother	ADRB1	17	44
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2nc(-c3ccc(F)cc3)no2)c1	ZINC000819221020	GG	On-Demand	Bother	ADRB3	50	47
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819221021	ED	On-Demand	Mild	ADRB2	48	51
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819221021	ED	On-Demand	Mild	ADRB1	72	45
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819221021	ED	On-Demand	Mild	ADRB3	49	47
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2nc(-c3ccc(F)cc3)no2)c1	ZINC000819221022	GG	On-Demand	Bother	ADRB1	17	44
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2nc(-c3ccc(F)cc3)no2)c1	ZINC000819221022	GG	On-Demand	Bother	ADRB3	50	47
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819221026	ED	On-Demand	Mild	ADRB2	48	51
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819221026	ED	On-Demand	Mild	ADRB1	72	45
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819221026	ED	On-Demand	Mild	ADRB3	49	47
O=C1OCCN1c1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819221036	GE	On-Demand	Bother	ADRB1	20	44
O=C1OCCN1c1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819221036	GE	On-Demand	Bother	ADRB3	15	44
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819221038	GE	On-Demand	Bother	ADRB1	20	44
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819221038	GE	On-Demand	Bother	ADRB3	15	44
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)C2	ZINC000819221075	EF	On-Demand	Bother	ADRB3	25	54
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)C2	ZINC000819221077	EF	On-Demand	Bother	ADRB3	25	54
COc1ccc2c(c1)CC[C@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C2	ZINC000819221081	GD	On-Demand	Anodyne	ADRB3	16	40
COc1ccc2c(c1)CC[C@H](NCCS(=O)(=O)CC(=O)OC(C)(C)C)C2	ZINC000819221081	GD	On-Demand	Anodyne	NQO2	28	40
COc1cccc([S@@](=O)CC(=O)NCCN(C)C(=O)OC(C)(C)C)c1	ZINC000819221092	FD	On-Demand	Anodyne	MTNR1A	44	39
C#CCNC(=O)CCNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819221102	FF	On-Demand	Mild	CACNA1H	20	41
C#CCNC(=O)CCNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819221102	FF	On-Demand	Mild	SIGMAR1	21	44
C#CCNC(=O)CCNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819221102	FF	On-Demand	Mild	SSTR5	57	38
C#CCNC(=O)CCNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819221102	FF	On-Demand	Mild	CACNA1I	68	44
NC(=O)[C@@H]1CCCN(CCCNC(=O)/C=C/[C@@H]2CCCO2)C1	ZINC000819221164	DC	On-Demand	Anodyne	SLC6A1	40	32
NC(=O)[C@@H]1CCCN(CCCNC(=O)/C=C/[C@H]2CCCO2)C1	ZINC000819221165	DC	On-Demand	Anodyne	SLC6A1	40	32
NC(=O)[C@@H]1CCCN(CCCNC(=O)/C=C\[C@@H]2CCCO2)C1	ZINC000819221166	DC	On-Demand	Anodyne	SLC6A1	40	32
NC(=O)[C@@H]1CCCN(CCCNC(=O)/C=C\[C@H]2CCCO2)C1	ZINC000819221167	DC	On-Demand	Anodyne	SLC6A1	40	32
C=CCS(=O)(=O)CCNC[C@H](O)COc1cc(C)ccc1C	ZINC000819221168	ED	On-Demand	Mild	ADRB2	32	44
C=CCS(=O)(=O)CCNC[C@H](O)COc1cc(C)ccc1C	ZINC000819221168	ED	On-Demand	Mild	ADRB1	46	34
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cc(C)ccc1C	ZINC000819221169	ED	On-Demand	Mild	ADRB2	32	44
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cc(C)ccc1C	ZINC000819221169	ED	On-Demand	Mild	ADRB1	46	34
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccccc1F)C2	ZINC000819221175	DG	On-Demand	Anodyne	ADRB3	22	49
C=CCS(=O)(=O)CCNC[C@@H](O)c1ccccc1	ZINC000819221177	CC	On-Demand	Mild	ADRB2	18	44
C=CCS(=O)(=O)CCNC[C@@H](O)c1ccccc1	ZINC000819221177	CC	On-Demand	Mild	ADRB3	65	42
C=CCS(=O)(=O)CCNC[C@H](O)c1ccccc1	ZINC000819221178	CC	On-Demand	Mild	ADRB2	18	44
C=CCS(=O)(=O)CCNC[C@H](O)c1ccccc1	ZINC000819221178	CC	On-Demand	Mild	ADRB3	65	42
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccccc1F)C2	ZINC000819221180	DG	On-Demand	Anodyne	ADRB3	22	49
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cc(OC)ccc1OC)C2	ZINC000819221182	FF	On-Demand	Anodyne	ADRB3	22	54
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cc(OC)ccc1OC)C2	ZINC000819221183	FF	On-Demand	Anodyne	ADRB3	22	54
Cc1cc(F)ccc1[C@@H](O)CNCCCc1nc(-c2ccc(F)cc2)no1	ZINC000819221200	FH	On-Demand	Anodyne	ADRB3	15	40
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccc(F)cc1F	ZINC000819221201	GG	On-Demand	Anodyne	ADRB3	18	41
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccc(F)cc1F	ZINC000819221202	GG	On-Demand	Anodyne	ADRB3	18	41
CON(C)C(=O)CCNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819221209	FF	On-Demand	Anodyne	DRD4	27	40
CON(C)C(=O)CCNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819221209	FF	On-Demand	Anodyne	SIGMAR1	21	42
CON(C)C(=O)CCNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819221209	FF	On-Demand	Anodyne	SSTR5	68	40
CON(C)C(=O)CCNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819221209	FF	On-Demand	Anodyne	MCHR1	39	41
CON(C)C(=O)CCNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819221209	FF	On-Demand	Anodyne	CACNA1I	54	41
CC(C)n1cc2c(n1)[C@H](NC[C@H](O)COc1cccc(C(F)(F)F)c1)CCC2	ZINC000819221241	GH	On-Demand	Anodyne	PDS	40	36
CC(C)n1cc2c(n1)[C@H](NC[C@@H](O)COc1cccc(C(F)(F)F)c1)CCC2	ZINC000819221242	GH	On-Demand	Anodyne	PDS	40	36
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C1=CCN(C)CC1	ZINC000819221264	CF	On-Demand	Anodyne	ADRB1	29	45
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C1=CCN(C)CC1	ZINC000819221264	CF	On-Demand	Anodyne	ADRB3	45	45
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C1=CCN(C)CC1	ZINC000819221265	CF	On-Demand	Anodyne	ADRB1	29	45
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C1=CCN(C)CC1	ZINC000819221265	CF	On-Demand	Anodyne	ADRB3	45	45
O[C@@H](CN[C@@H]1CCCc2cn(C3CCCC3)nc21)c1cccnc1	ZINC000819221284	EG	On-Demand	Anodyne	ADRB3	69	41
O[C@H](CN[C@@H]1CCCc2cn(C3CCCC3)nc21)c1cccnc1	ZINC000819221285	EG	On-Demand	Anodyne	ADRB3	69	41
O[C@@H](CN[C@H]1CCCc2cn(C3CCCC3)nc21)c1cccnc1	ZINC000819221286	EG	On-Demand	Anodyne	ADRB3	69	41
O[C@H](CN[C@H]1CCCc2cn(C3CCCC3)nc21)c1cccnc1	ZINC000819221287	EG	On-Demand	Anodyne	ADRB3	69	41
O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1)Nc1cccnc1Cl	ZINC000819221288	JF	On-Demand	Anodyne	APP	43	36
O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1)Nc1cccnc1Cl	ZINC000819221288	JF	On-Demand	Anodyne	TGM2	74	38
O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1)Nc1cccnc1Cl	ZINC000819221288	JF	On-Demand	Anodyne	F13A1	78	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819221353	GE	On-Demand	Anodyne	ADRB1	58	39
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819221354	GE	On-Demand	Anodyne	ADRB1	58	39
CCC[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(C(F)(F)F)c1	ZINC000819221372	EI	On-Demand	Anodyne	CCR2	44	37
CCC[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(C(F)(F)F)c1	ZINC000819221373	EI	On-Demand	Anodyne	CCR2	44	37
CCC[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(C(F)(F)F)c1	ZINC000819221374	EI	On-Demand	Anodyne	CCR2	44	37
CCC[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(C(F)(F)F)c1	ZINC000819221375	EI	On-Demand	Anodyne	CCR2	44	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cc3sc(C)nc3cc1OC)C2	ZINC000819221376	GG	On-Demand	Anodyne	ACOX1	43	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cc3sc(C)nc3cc1OC)C2	ZINC000819221377	GG	On-Demand	Anodyne	ACOX1	43	31
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(C)cc1	ZINC000819221382	DC	On-Demand	Mild	ADRB2	50	49
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(C)cc1	ZINC000819221382	DC	On-Demand	Mild	ADRB1	73	49
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(C)cc1	ZINC000819221382	DC	On-Demand	Mild	GRIN1	16	45
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(C)cc1	ZINC000819221382	DC	On-Demand	Mild	ADRB3	48	49
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(C)cc1	ZINC000819221383	DC	On-Demand	Mild	ADRB2	50	49
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(C)cc1	ZINC000819221383	DC	On-Demand	Mild	ADRB1	73	49
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(C)cc1	ZINC000819221383	DC	On-Demand	Mild	GRIN1	16	45
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(C)cc1	ZINC000819221383	DC	On-Demand	Mild	ADRB3	48	49
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819221384	EC	On-Demand	Mild	ADRB1	48	38
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819221384	EC	On-Demand	Mild	ADRB3	34	43
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819221385	EC	On-Demand	Mild	ADRB1	48	38
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819221385	EC	On-Demand	Mild	ADRB3	34	43
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(F)cc1Cl)C2	ZINC000819221404	EH	On-Demand	Anodyne	ADRB3	22	49
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(F)cc1Cl)C2	ZINC000819221406	EH	On-Demand	Anodyne	ADRB3	22	49
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccc(O)nc2)CC1	ZINC000819221424	EC	On-Demand	Anodyne	L3MBTL3	56	41
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(O)nc2)CC1	ZINC000819221426	EC	On-Demand	Anodyne	L3MBTL3	56	41
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccc(O)nc2)CC1	ZINC000819221429	EC	On-Demand	Anodyne	L3MBTL3	56	41
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(O)nc2)CC1	ZINC000819221431	EC	On-Demand	Anodyne	L3MBTL3	56	41
O=C1OCCN1c1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819221433	GF	On-Demand	Anodyne	ADRB2	17	44
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819221435	GF	On-Demand	Anodyne	ADRB2	17	44
O=S1(=O)CCCC[C@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819221437	DD	On-Demand	Anodyne	ADRB1	37	43
O=S1(=O)CCCC[C@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819221437	DD	On-Demand	Anodyne	ADRB3	50	43
O=S1(=O)CCCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819221439	DD	On-Demand	Anodyne	ADRB1	37	43
O=S1(=O)CCCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819221439	DD	On-Demand	Anodyne	ADRB3	50	43
O=S1(=O)CCCC[C@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819221441	DD	On-Demand	Anodyne	ADRB1	37	43
O=S1(=O)CCCC[C@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819221441	DD	On-Demand	Anodyne	ADRB3	50	43
O=S1(=O)CCCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819221442	DD	On-Demand	Anodyne	ADRB1	37	43
O=S1(=O)CCCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819221442	DD	On-Demand	Anodyne	ADRB3	50	43
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c1	ZINC000819221451	EE	On-Demand	Anodyne	ITGAL	43	33
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c1	ZINC000819221451	EE	On-Demand	Anodyne	EPHX2	21	43
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c1	ZINC000819221451	EE	On-Demand	Anodyne	LIMK2	22	46
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c1	ZINC000819221451	EE	On-Demand	Anodyne	KCNK3	60	38
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c1	ZINC000819221451	EE	On-Demand	Anodyne	KCNK9	43	38
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c1	ZINC000819221453	EE	On-Demand	Anodyne	ITGAL	43	33
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c1	ZINC000819221453	EE	On-Demand	Anodyne	EPHX2	21	43
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c1	ZINC000819221453	EE	On-Demand	Anodyne	LIMK2	22	46
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c1	ZINC000819221453	EE	On-Demand	Anodyne	KCNK3	60	38
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c1	ZINC000819221453	EE	On-Demand	Anodyne	KCNK9	43	38
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c1	ZINC000819221454	EE	On-Demand	Anodyne	ITGAL	43	33
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c1	ZINC000819221454	EE	On-Demand	Anodyne	EPHX2	21	43
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c1	ZINC000819221454	EE	On-Demand	Anodyne	LIMK2	22	46
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c1	ZINC000819221454	EE	On-Demand	Anodyne	KCNK3	60	38
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c1	ZINC000819221454	EE	On-Demand	Anodyne	KCNK9	43	38
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c1	ZINC000819221455	EE	On-Demand	Anodyne	ITGAL	43	33
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c1	ZINC000819221455	EE	On-Demand	Anodyne	EPHX2	21	43
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c1	ZINC000819221455	EE	On-Demand	Anodyne	LIMK2	22	46
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c1	ZINC000819221455	EE	On-Demand	Anodyne	KCNK3	60	38
Cc1cccc(NC(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c1	ZINC000819221455	EE	On-Demand	Anodyne	KCNK9	43	38
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819221457	DC	On-Demand	Mild	ADRB2	38	42
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819221457	DC	On-Demand	Mild	ADRB1	69	43
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819221457	DC	On-Demand	Mild	ADRB3	40	43
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819221459	DC	On-Demand	Mild	ADRB2	38	42
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819221459	DC	On-Demand	Mild	ADRB1	69	43
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819221459	DC	On-Demand	Mild	ADRB3	40	43
C=CCS(=O)(=O)CCNC[C@@H](O)c1cccc(Br)c1	ZINC000819221461	ED	On-Demand	Mild	ADRB3	44	32
C=CCS(=O)(=O)CCNC[C@H](O)c1cccc(Br)c1	ZINC000819221462	ED	On-Demand	Mild	ADRB3	44	32
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(C)cc1)C2	ZINC000819221465	DG	On-Demand	Anodyne	ADRB3	28	60
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(C)cc1)C2	ZINC000819221466	DG	On-Demand	Anodyne	ADRB3	28	60
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccccc1	ZINC000819221470	EG	On-Demand	Anodyne	ADRB2	22	47
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccccc1	ZINC000819221470	EG	On-Demand	Anodyne	ADRB1	29	47
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccccc1	ZINC000819221470	EG	On-Demand	Anodyne	ADRB3	71	50
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccccc1	ZINC000819221472	EG	On-Demand	Anodyne	ADRB2	22	47
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccccc1	ZINC000819221472	EG	On-Demand	Anodyne	ADRB1	29	47
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccccc1	ZINC000819221472	EG	On-Demand	Anodyne	ADRB3	71	50
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819221484	EF	On-Demand	Bother	ADRB3	27	55
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819221485	EF	On-Demand	Bother	ADRB3	27	55
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1cccnc1	ZINC000819221520	EF	On-Demand	Anodyne	ADRB2	27	59
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1cccnc1	ZINC000819221520	EF	On-Demand	Anodyne	ADRB1	30	59
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1cccnc1	ZINC000819221520	EF	On-Demand	Anodyne	ADRB3	109	63
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1cccnc1	ZINC000819221521	EF	On-Demand	Anodyne	ADRB2	27	59
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1cccnc1	ZINC000819221521	EF	On-Demand	Anodyne	ADRB1	30	59
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1cccnc1	ZINC000819221521	EF	On-Demand	Anodyne	ADRB3	109	63
N#CCCCNC[C@@H](O)c1cccnc1	ZINC000819221527	BD	On-Demand	Mild	ADRB2	31	49
N#CCCCNC[C@@H](O)c1cccnc1	ZINC000819221527	BD	On-Demand	Mild	ADRB1	33	48
N#CCCCNC[C@@H](O)c1cccnc1	ZINC000819221527	BD	On-Demand	Mild	ADRB3	108	49
N#CCCCNC[C@H](O)c1cccnc1	ZINC000819221528	BD	On-Demand	Mild	ADRB2	31	49
N#CCCCNC[C@H](O)c1cccnc1	ZINC000819221528	BD	On-Demand	Mild	ADRB1	33	48
N#CCCCNC[C@H](O)c1cccnc1	ZINC000819221528	BD	On-Demand	Mild	ADRB3	108	49
CS(=O)(=O)c1ccc([C@H](O)CNCCCC#N)cc1	ZINC000819221533	CD	On-Demand	Mild	ADRB2	20	46
CS(=O)(=O)c1ccc([C@H](O)CNCCCC#N)cc1	ZINC000819221533	CD	On-Demand	Mild	ADRB3	41	38
CS(=O)(=O)c1ccc([C@H](O)CNCCCC#N)cc1	ZINC000819221533	CD	On-Demand	Mild	CTSF	51	37
COC[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819221543	CC	On-Demand	Bother	CACNA1C	55	39
COC[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819221543	CC	On-Demand	Bother	CACNA1D	85	39
COC[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819221544	CC	On-Demand	Bother	CACNA1C	55	39
COC[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819221544	CC	On-Demand	Bother	CACNA1D	85	39
CC(C)n1cc2c(n1)[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)CCC2	ZINC000819221548	FF	On-Demand	Mild	ADRB1	28	41
CC(C)n1cc2c(n1)[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)CCC2	ZINC000819221548	FF	On-Demand	Mild	ADRB3	17	41
CC(C)n1cc2c(n1)[C@H](NC[C@@H](O)COc1ccc(CC#N)cc1)CCC2	ZINC000819221551	FF	On-Demand	Mild	ADRB1	28	41
CC(C)n1cc2c(n1)[C@H](NC[C@@H](O)COc1ccc(CC#N)cc1)CCC2	ZINC000819221551	FF	On-Demand	Mild	ADRB3	17	41
CC(C)n1cc2c(n1)[C@H](NC[C@H](O)COc1ccccc1)CCC2	ZINC000819221563	EF	On-Demand	Anodyne	ADRB2	41	45
CC(C)n1cc2c(n1)[C@H](NC[C@H](O)COc1ccccc1)CCC2	ZINC000819221563	EF	On-Demand	Anodyne	ADRB1	51	41
CC(C)n1cc2c(n1)[C@H](NC[C@H](O)COc1ccccc1)CCC2	ZINC000819221563	EF	On-Demand	Anodyne	ADRB3	34	48
CC(C)n1cc2c(n1)[C@H](NC[C@@H](O)COc1ccccc1)CCC2	ZINC000819221564	EF	On-Demand	Anodyne	ADRB2	41	45
CC(C)n1cc2c(n1)[C@H](NC[C@@H](O)COc1ccccc1)CCC2	ZINC000819221564	EF	On-Demand	Anodyne	ADRB1	51	41
CC(C)n1cc2c(n1)[C@H](NC[C@@H](O)COc1ccccc1)CCC2	ZINC000819221564	EF	On-Demand	Anodyne	ADRB3	34	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(-c3n[nH]c(C4CC4)n3)cc1)C2	ZINC000819221591	GG	On-Demand	Anodyne	MTOR	44	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(-c3n[nH]c(C4CC4)n3)cc1)C2	ZINC000819221592	GG	On-Demand	Anodyne	MTOR	44	34
CC(C)n1cc2c(n1)[C@H](NC[C@H](O)COc1ccccc1Cl)CCC2	ZINC000819221593	FH	On-Demand	Anodyne	ADRB2	18	43
CC(C)n1cc2c(n1)[C@H](NC[C@@H](O)COc1ccccc1Cl)CCC2	ZINC000819221594	FH	On-Demand	Anodyne	ADRB2	18	43
O=C(/C=C/c1ccc(-c2ccc(F)cc2)s1)Nc1cccnc1Cl	ZINC000819221597	FK	On-Demand	Anodyne	G2YM83_BOTF4	56	31
O=C(/C=C\c1ccc(-c2ccc(F)cc2)s1)Nc1cccnc1Cl	ZINC000819221598	FK	On-Demand	Anodyne	G2YM83_BOTF4	56	31
C=CCS(=O)(=O)CCNCCC(=O)Nc1cccc(Br)c1	ZINC000819221649	GD	On-Demand	Mild	HDAC2	15	40
O[C@H](CNC[C@H]1CCCCS1)c1cccnc1	ZINC000819221651	CD	On-Demand	Anodyne	ADRB2	23	42
O[C@H](CNC[C@H]1CCCCS1)c1cccnc1	ZINC000819221651	CD	On-Demand	Anodyne	ADRB1	26	46
O[C@H](CNC[C@H]1CCCCS1)c1cccnc1	ZINC000819221651	CD	On-Demand	Anodyne	ADRB3	100	48
O[C@@H](CNC[C@H]1CCCCS1)c1cccnc1	ZINC000819221652	CD	On-Demand	Anodyne	ADRB2	23	42
O[C@@H](CNC[C@H]1CCCCS1)c1cccnc1	ZINC000819221652	CD	On-Demand	Anodyne	ADRB1	26	46
O[C@@H](CNC[C@H]1CCCCS1)c1cccnc1	ZINC000819221652	CD	On-Demand	Anodyne	ADRB3	100	48
O[C@H](CNC[C@@H]1CCCCS1)c1cccnc1	ZINC000819221653	CD	On-Demand	Anodyne	ADRB2	23	42
O[C@H](CNC[C@@H]1CCCCS1)c1cccnc1	ZINC000819221653	CD	On-Demand	Anodyne	ADRB1	26	46
O[C@H](CNC[C@@H]1CCCCS1)c1cccnc1	ZINC000819221653	CD	On-Demand	Anodyne	ADRB3	100	48
O[C@@H](CNC[C@@H]1CCCCS1)c1cccnc1	ZINC000819221654	CD	On-Demand	Anodyne	ADRB2	23	42
O[C@@H](CNC[C@@H]1CCCCS1)c1cccnc1	ZINC000819221654	CD	On-Demand	Anodyne	ADRB1	26	46
O[C@@H](CNC[C@@H]1CCCCS1)c1cccnc1	ZINC000819221654	CD	On-Demand	Anodyne	ADRB3	100	48
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819221655	GE	On-Demand	Anodyne	ADRB2	35	52
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819221655	GE	On-Demand	Anodyne	ADRB1	75	52
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819221655	GE	On-Demand	Anodyne	ADRB3	51	52
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819221656	GE	On-Demand	Anodyne	ADRB2	35	52
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819221656	GE	On-Demand	Anodyne	ADRB1	75	52
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819221656	GE	On-Demand	Anodyne	ADRB3	51	52
C=CCS(=O)(=O)CCNC[C@H](O)COc1cccc(C)c1	ZINC000819221665	DC	On-Demand	Mild	ADRB2	48	58
C=CCS(=O)(=O)CCNC[C@H](O)COc1cccc(C)c1	ZINC000819221665	DC	On-Demand	Mild	ADRB1	65	53
C=CCS(=O)(=O)CCNC[C@H](O)COc1cccc(C)c1	ZINC000819221665	DC	On-Demand	Mild	ADRB3	46	43
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cccc(C)c1	ZINC000819221666	DC	On-Demand	Mild	ADRB2	48	58
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cccc(C)c1	ZINC000819221666	DC	On-Demand	Mild	ADRB1	65	53
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cccc(C)c1	ZINC000819221666	DC	On-Demand	Mild	ADRB3	46	43
Cc1ccc(OC[C@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819221668	FE	On-Demand	Anodyne	ADRB2	34	43
Cc1ccc(OC[C@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819221668	FE	On-Demand	Anodyne	ADRB1	58	40
Cc1ccc(OC[C@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819221668	FE	On-Demand	Anodyne	ADRB3	38	40
Cc1ccc(OC[C@@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819221669	FE	On-Demand	Anodyne	ADRB2	34	43
Cc1ccc(OC[C@@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819221669	FE	On-Demand	Anodyne	ADRB1	58	40
Cc1ccc(OC[C@@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819221669	FE	On-Demand	Anodyne	ADRB3	38	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCCC#N)cc1	ZINC000819221673	CD	On-Demand	Mild	ADRB2	20	46
CS(=O)(=O)c1ccc([C@@H](O)CNCCCC#N)cc1	ZINC000819221673	CD	On-Demand	Mild	ADRB3	41	38
CS(=O)(=O)c1ccc([C@@H](O)CNCCCC#N)cc1	ZINC000819221673	CD	On-Demand	Mild	CTSF	51	37
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccccc1Cl)C2	ZINC000819221677	EH	On-Demand	Anodyne	ADRB3	24	54
Cc1ccccc1[C@@H](O)CNCCCc1nc(-c2ccc(F)cc2)no1	ZINC000819221683	FG	On-Demand	Anodyne	ADRB3	17	43
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819221702	ED	On-Demand	Mild	ADRB2	24	55
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819221702	ED	On-Demand	Mild	ADRB1	54	55
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819221702	ED	On-Demand	Mild	ADRB3	19	55
C=CCS(=O)(=O)CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819221703	ED	On-Demand	Mild	ADRB2	24	55
C=CCS(=O)(=O)CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819221703	ED	On-Demand	Mild	ADRB1	54	55
C=CCS(=O)(=O)CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819221703	ED	On-Demand	Mild	ADRB3	19	55
O=C1OCCN1c1ccc(CNC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819221712	FE	On-Demand	Anodyne	ADRB2	28	40
O=C1OCCN1c1ccc(CNC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819221712	FE	On-Demand	Anodyne	ADRB1	58	43
O=C1OCCN1c1ccc(CNC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819221712	FE	On-Demand	Anodyne	ADRB3	38	43
COc1ccc2c(c1)CC[C@H](NCCC(=O)Nc1ccc(N(C)C)cc1)C2	ZINC000819221713	FG	On-Demand	Anodyne	MTNR1A	20	44
COc1ccc2c(c1)CC[C@H](NCCC(=O)Nc1ccc(N(C)C)cc1)C2	ZINC000819221713	FG	On-Demand	Anodyne	MTNR1B	25	44
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819221714	FE	On-Demand	Anodyne	ADRB2	28	40
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819221714	FE	On-Demand	Anodyne	ADRB1	58	43
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819221714	FE	On-Demand	Anodyne	ADRB3	38	43
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1c(F)cccc1F)C2	ZINC000819221718	EG	On-Demand	Anodyne	ADRB3	22	50
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1c(F)cccc1F)C2	ZINC000819221721	EG	On-Demand	Anodyne	ADRB3	22	50
COc1cccc([S@@](=O)CC(=O)Nc2ccc(SC(C)(C)C)cc2)c1	ZINC000819221723	GI	On-Demand	Anodyne	MTNR1A	30	49
COc1cccc([S@@](=O)CC(=O)Nc2ccc(SC(C)(C)C)cc2)c1	ZINC000819221723	GI	On-Demand	Anodyne	MTNR1B	35	49
COc1cccc([S@@](=O)CC(=O)Nc2ccc(SC(C)(C)C)cc2)c1	ZINC000819221723	GI	On-Demand	Anodyne	ACR	30	41
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccc(F)cc1Cl	ZINC000819221740	GH	On-Demand	Anodyne	ADRB3	19	40
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccc(F)cc1Cl	ZINC000819221743	GH	On-Demand	Anodyne	ADRB3	19	40
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccccc1Cl	ZINC000819221744	GH	On-Demand	Anodyne	ADRB3	20	42
COc1ccc(OC)c([C@H](O)CNCCCC#N)c1	ZINC000819221748	CD	On-Demand	Mild	ADRB2	20	47
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H]1CCCCNC1=O	ZINC000819221756	FD	On-Demand	Mild	PAPA1_CARPA	34	40
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H]1CCCCNC1=O	ZINC000819221759	FD	On-Demand	Mild	PAPA1_CARPA	34	40
C#CCNC(=O)CCN[C@H]1CCc2cc(OC)ccc2C1	ZINC000819221775	CD	On-Demand	Mild	NQO2	34	46
C#CCNC(=O)CCN[C@H]1CCc2cc(OC)ccc2C1	ZINC000819221775	CD	On-Demand	Mild	MTNR1A	55	41
C#CCNC(=O)CCN[C@H]1CCc2cc(OC)ccc2C1	ZINC000819221775	CD	On-Demand	Mild	MTNR1B	45	41
C#CCNC(=O)CCN[C@@H]1CCc2cc(OC)ccc2C1	ZINC000819221776	CD	On-Demand	Mild	NQO2	34	46
C#CCNC(=O)CCN[C@@H]1CCc2cc(OC)ccc2C1	ZINC000819221776	CD	On-Demand	Mild	MTNR1A	55	41
C#CCNC(=O)CCN[C@@H]1CCc2cc(OC)ccc2C1	ZINC000819221776	CD	On-Demand	Mild	MTNR1B	45	41
C=CCS(=O)(=O)CCNC[C@H](O)COc1c(C)cccc1C	ZINC000819221779	ED	On-Demand	Mild	ADRB2	36	43
C=CCS(=O)(=O)CCNC[C@H](O)COc1c(C)cccc1C	ZINC000819221779	ED	On-Demand	Mild	ADRB1	41	37
C=CCS(=O)(=O)CCNC[C@@H](O)COc1c(C)cccc1C	ZINC000819221780	ED	On-Demand	Mild	ADRB2	36	43
C=CCS(=O)(=O)CCNC[C@@H](O)COc1c(C)cccc1C	ZINC000819221780	ED	On-Demand	Mild	ADRB1	41	37
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cccc(Br)c1	ZINC000819221790	GD	On-Demand	Mild	ADRB2	38	45
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cccc(Br)c1	ZINC000819221790	GD	On-Demand	Mild	ADRB1	58	42
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cccc(Br)c1	ZINC000819221790	GD	On-Demand	Mild	ADRB3	39	42
C=CCS(=O)(=O)CCNC[C@H](O)COc1cccc(Br)c1	ZINC000819221793	GD	On-Demand	Mild	ADRB2	38	45
C=CCS(=O)(=O)CCNC[C@H](O)COc1cccc(Br)c1	ZINC000819221793	GD	On-Demand	Mild	ADRB1	58	42
C=CCS(=O)(=O)CCNC[C@H](O)COc1cccc(Br)c1	ZINC000819221793	GD	On-Demand	Mild	ADRB3	39	42
O=C(Nc1cccc(-c2n[nH]c(C3CC3)n2)c1)C(F)=C1CCC1	ZINC000819221795	DH	On-Demand	Anodyne	CPT1A	18	44
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1cccc(F)c1	ZINC000819221797	FG	On-Demand	Anodyne	ADRB2	22	49
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1cccc(F)c1	ZINC000819221797	FG	On-Demand	Anodyne	ADRB1	27	45
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1cccc(F)c1	ZINC000819221797	FG	On-Demand	Anodyne	ADRB3	59	49
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1cccc(F)c1	ZINC000819221798	FG	On-Demand	Anodyne	ADRB2	22	49
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1cccc(F)c1	ZINC000819221798	FG	On-Demand	Anodyne	ADRB1	27	45
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1cccc(F)c1	ZINC000819221798	FG	On-Demand	Anodyne	ADRB3	59	49
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccc(F)cn1	ZINC000819221817	FF	On-Demand	Anodyne	ADRB3	19	45
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccc(F)cn1	ZINC000819221818	FF	On-Demand	Anodyne	ADRB3	19	45
O=C1OCCN1c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819221831	DD	On-Demand	Anodyne	ADRB2	24	44
O=C1OCCN1c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819221831	DD	On-Demand	Anodyne	ADRB1	25	44
O=C1OCCN1c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819221831	DD	On-Demand	Anodyne	ADRB3	97	48
O=C1OCCN1c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819221832	DD	On-Demand	Anodyne	ADRB2	24	44
O=C1OCCN1c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819221832	DD	On-Demand	Anodyne	ADRB1	25	44
O=C1OCCN1c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819221832	DD	On-Demand	Anodyne	ADRB3	97	48
CC(=O)Nc1cccc(CC(=O)N2CCCNC(=O)C2)c1	ZINC000819221834	CC	On-Demand	Anodyne	P2RY14	45	34
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1	ZINC000819221841	DG	On-Demand	Anodyne	CPT1A	16	42
N#Cc1ccc(OC[C@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819221842	FE	On-Demand	Mild	ADRB1	45	38
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1	ZINC000819221843	DG	On-Demand	Anodyne	CPT1A	16	42
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1	ZINC000819221844	DG	On-Demand	Anodyne	CPT1A	16	42
N#Cc1ccc(OC[C@@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819221845	FE	On-Demand	Mild	ADRB1	45	38
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1	ZINC000819221846	DG	On-Demand	Anodyne	CPT1A	16	42
COc1ccc2c(c1)CC[C@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C2	ZINC000819221848	FE	On-Demand	Anodyne	ADRB3	21	45
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)C2	ZINC000819221852	FE	On-Demand	Anodyne	ADRB3	21	45
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1cccnc1	ZINC000819221880	GH	On-Demand	Anodyne	ADRB2	19	42
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1cccnc1	ZINC000819221880	GH	On-Demand	Anodyne	ADRB1	32	42
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1cccnc1	ZINC000819221880	GH	On-Demand	Anodyne	DRD4	16	42
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1cccnc1	ZINC000819221880	GH	On-Demand	Anodyne	ADRB3	84	50
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1cccnc1	ZINC000819221880	GH	On-Demand	Anodyne	SIGMAR1	21	45
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1cccnc1	ZINC000819221880	GH	On-Demand	Anodyne	SSTR5	52	35
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1cccnc1	ZINC000819221880	GH	On-Demand	Anodyne	MCHR1	23	40
C=CCS(=O)(=O)CCNC[C@@H](O)c1cccnc1	ZINC000819221881	CC	On-Demand	Mild	ADRB2	28	45
C=CCS(=O)(=O)CCNC[C@@H](O)c1cccnc1	ZINC000819221881	CC	On-Demand	Mild	ADRB1	33	45
C=CCS(=O)(=O)CCNC[C@@H](O)c1cccnc1	ZINC000819221881	CC	On-Demand	Mild	ADRB3	114	53
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1cccnc1	ZINC000819221882	GH	On-Demand	Anodyne	ADRB2	19	42
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1cccnc1	ZINC000819221882	GH	On-Demand	Anodyne	ADRB1	32	42
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1cccnc1	ZINC000819221882	GH	On-Demand	Anodyne	DRD4	16	42
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1cccnc1	ZINC000819221882	GH	On-Demand	Anodyne	ADRB3	84	50
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1cccnc1	ZINC000819221882	GH	On-Demand	Anodyne	SIGMAR1	21	45
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1cccnc1	ZINC000819221882	GH	On-Demand	Anodyne	SSTR5	52	35
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1cccnc1	ZINC000819221882	GH	On-Demand	Anodyne	MCHR1	23	40
C=CCS(=O)(=O)CCNC[C@H](O)c1cccnc1	ZINC000819221884	CC	On-Demand	Mild	ADRB2	28	45
C=CCS(=O)(=O)CCNC[C@H](O)c1cccnc1	ZINC000819221884	CC	On-Demand	Mild	ADRB1	33	45
C=CCS(=O)(=O)CCNC[C@H](O)c1cccnc1	ZINC000819221884	CC	On-Demand	Mild	ADRB3	114	53
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccc(Cl)c(F)c1	ZINC000819221915	GH	On-Demand	Anodyne	ADRB3	27	43
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccc(Cl)c(F)c1	ZINC000819221917	GH	On-Demand	Anodyne	ADRB3	27	43
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(Cl)c(F)c1)C2	ZINC000819221936	EH	On-Demand	Anodyne	ADRB3	29	56
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819221938	FD	On-Demand	Mild	ADRB2	21	41
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819221938	FD	On-Demand	Mild	ADRB1	29	41
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(Cl)c(F)c1)C2	ZINC000819221939	EH	On-Demand	Anodyne	ADRB3	29	56
C=CCS(=O)(=O)CCNC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819221941	FD	On-Demand	Mild	ADRB2	21	41
C=CCS(=O)(=O)CCNC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819221941	FD	On-Demand	Mild	ADRB1	29	41
O=C1OCCN1c1ccc(CNC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819221942	GG	On-Demand	Anodyne	ADRB2	30	45
O=C1OCCN1c1ccc(CNC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819221942	GG	On-Demand	Anodyne	ADRB1	49	40
O=C1OCCN1c1ccc(CNC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819221942	GG	On-Demand	Anodyne	ADRB3	38	40
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819221944	GG	On-Demand	Anodyne	ADRB2	30	45
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819221944	GG	On-Demand	Anodyne	ADRB1	49	40
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819221944	GG	On-Demand	Anodyne	ADRB3	38	40
O=C1OCCN1c1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819221981	EF	On-Demand	Anodyne	ADRB3	25	40
O=C1OCCN1c1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819221982	EF	On-Demand	Anodyne	ADRB3	25	40
C=CCS(=O)(=O)CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819221987	DD	On-Demand	Mild	ADRB1	25	42
C=CCS(=O)(=O)CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819221987	DD	On-Demand	Mild	ADRB3	27	41
C=CCS(=O)(=O)CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819221988	DD	On-Demand	Mild	ADRB1	25	42
C=CCS(=O)(=O)CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819221988	DD	On-Demand	Mild	ADRB3	27	41
C=CCS(=O)(=O)CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819221989	DC	On-Demand	Mild	ADRB3	44	32
C=CCS(=O)(=O)CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819221990	DC	On-Demand	Mild	ADRB3	44	32
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819221995	GE	On-Demand	Mild	ADRB1	41	38
N#CCc1ccc(OC[C@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819221998	GE	On-Demand	Mild	ADRB1	41	38
C=CCS(=O)(=O)CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819222004	GD	On-Demand	Mild	GPR119	30	43
C=CCS(=O)(=O)CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819222005	GD	On-Demand	Mild	GPR119	30	43
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cccnc1)C2	ZINC000819222012	CE	On-Demand	Anodyne	ADRB1	29	52
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cccnc1)C2	ZINC000819222012	CE	On-Demand	Anodyne	ADRB3	71	67
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cccnc1)C2	ZINC000819222012	CE	On-Demand	Anodyne	CYP11B2	22	44
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cccnc1)C2	ZINC000819222014	CE	On-Demand	Anodyne	ADRB1	29	52
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cccnc1)C2	ZINC000819222014	CE	On-Demand	Anodyne	ADRB3	71	67
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cccnc1)C2	ZINC000819222014	CE	On-Demand	Anodyne	CYP11B2	22	44
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1c(F)cccc1F	ZINC000819222019	GG	On-Demand	Anodyne	ADRB3	18	44
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1c(F)cccc1F	ZINC000819222020	GG	On-Demand	Anodyne	ADRB3	18	44
O=C1OCCN1c1ccc(CNC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819222030	GF	On-Demand	Anodyne	ADRB1	20	49
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819222031	GF	On-Demand	Anodyne	ADRB1	20	49
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(C)cc1C	ZINC000819222037	ED	On-Demand	Mild	ADRB2	28	43
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(C)cc1C	ZINC000819222038	ED	On-Demand	Mild	ADRB2	28	43
O=C(CCNCc1ccc(N2CCOC2=O)cc1)Nc1cccnc1	ZINC000819222043	EE	On-Demand	Anodyne	NAMPT	34	41
O=C1OCCN1c1ccc(CNC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819222044	GF	On-Demand	Anodyne	ADRB2	26	40
O=C1OCCN1c1ccc(CNC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819222044	GF	On-Demand	Anodyne	ADRB1	56	41
O=C1OCCN1c1ccc(CNC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819222044	GF	On-Demand	Anodyne	GRIN1	18	43
O=C1OCCN1c1ccc(CNC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819222044	GF	On-Demand	Anodyne	ADRB3	38	40
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819222045	GF	On-Demand	Anodyne	ADRB2	26	40
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819222045	GF	On-Demand	Anodyne	ADRB1	56	41
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819222045	GF	On-Demand	Anodyne	GRIN1	18	43
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819222045	GF	On-Demand	Anodyne	ADRB3	38	40
C=CCS(=O)(=O)CCNC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819222046	FD	On-Demand	Mild	ADRB2	29	40
C=CCS(=O)(=O)CCNC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819222046	FD	On-Demand	Mild	ADRB1	37	41
C=CCS(=O)(=O)CCNC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819222047	FD	On-Demand	Mild	ADRB2	29	40
C=CCS(=O)(=O)CCNC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819222047	FD	On-Demand	Mild	ADRB1	37	41
O=C1OCCN1c1ccc(CNC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819222048	GG	On-Demand	Anodyne	ADRB2	25	49
O=C1OCCN1c1ccc(CNC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819222048	GG	On-Demand	Anodyne	ADRB1	33	45
O=C1OCCN1c1ccc(CNC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819222048	GG	On-Demand	Anodyne	ADRB3	17	45
O=C1OCCN1c1ccc(CNC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819222048	GG	On-Demand	Anodyne	MCL1	20	40
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819222049	GG	On-Demand	Anodyne	ADRB2	25	49
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819222049	GG	On-Demand	Anodyne	ADRB1	33	45
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819222049	GG	On-Demand	Anodyne	ADRB3	17	45
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819222049	GG	On-Demand	Anodyne	MCL1	20	40
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(N3CCOC3=O)cc2)c1	ZINC000819222079	GE	On-Demand	Anodyne	ADRB1	42	36
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(N3CCOC3=O)cc2)c1	ZINC000819222079	GE	On-Demand	Anodyne	ABCB1	18	45
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(N3CCOC3=O)cc2)c1	ZINC000819222080	GE	On-Demand	Anodyne	ADRB1	42	36
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(N3CCOC3=O)cc2)c1	ZINC000819222080	GE	On-Demand	Anodyne	ABCB1	18	45
CSc1ccc(OC[C@@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819222088	GF	On-Demand	Anodyne	ADRB1	48	38
CSc1ccc(OC[C@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819222089	GF	On-Demand	Anodyne	ADRB1	48	38
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819222093	DC	On-Demand	Mild	ADRB2	48	49
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819222093	DC	On-Demand	Mild	ADRB1	77	49
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819222093	DC	On-Demand	Mild	GRIN1	18	53
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819222093	DC	On-Demand	Mild	ADRB3	48	49
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(F)cc1	ZINC000819222094	DC	On-Demand	Mild	ADRB2	48	49
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(F)cc1	ZINC000819222094	DC	On-Demand	Mild	ADRB1	77	49
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(F)cc1	ZINC000819222094	DC	On-Demand	Mild	GRIN1	18	53
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(F)cc1	ZINC000819222094	DC	On-Demand	Mild	ADRB3	48	49
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccccc1Cl	ZINC000819222101	ED	On-Demand	Mild	ADRB2	41	54
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccccc1Cl	ZINC000819222101	ED	On-Demand	Mild	ADRB1	56	44
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccccc1Cl	ZINC000819222101	ED	On-Demand	Mild	ADRB3	31	41
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccccc1Cl	ZINC000819222101	ED	On-Demand	Mild	ABCB1	16	41
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccccc1Cl	ZINC000819222102	ED	On-Demand	Mild	ADRB2	41	54
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccccc1Cl	ZINC000819222102	ED	On-Demand	Mild	ADRB1	56	44
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccccc1Cl	ZINC000819222102	ED	On-Demand	Mild	ADRB3	31	41
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccccc1Cl	ZINC000819222102	ED	On-Demand	Mild	ABCB1	16	41
O=C1OCCN1c1ccc(CNC[C@H](O)COc2ccccc2)cc1	ZINC000819222105	EE	On-Demand	Anodyne	ADRB2	44	44
O=C1OCCN1c1ccc(CNC[C@H](O)COc2ccccc2)cc1	ZINC000819222105	EE	On-Demand	Anodyne	ADRB1	71	43
O=C1OCCN1c1ccc(CNC[C@H](O)COc2ccccc2)cc1	ZINC000819222105	EE	On-Demand	Anodyne	ADRB3	53	43
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2ccccc2)cc1	ZINC000819222106	EE	On-Demand	Anodyne	ADRB2	44	44
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2ccccc2)cc1	ZINC000819222106	EE	On-Demand	Anodyne	ADRB1	71	43
O=C1OCCN1c1ccc(CNC[C@@H](O)COc2ccccc2)cc1	ZINC000819222106	EE	On-Demand	Anodyne	ADRB3	53	43
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccc(F)c(F)c1	ZINC000819222137	GG	On-Demand	Anodyne	ADRB2	16	46
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccc(F)c(F)c1	ZINC000819222137	GG	On-Demand	Anodyne	ADRB3	32	46
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccc(F)c(F)c1	ZINC000819222138	GG	On-Demand	Anodyne	ADRB2	16	46
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccc(F)c(F)c1	ZINC000819222138	GG	On-Demand	Anodyne	ADRB3	32	46
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000819222139	FH	On-Demand	Anodyne	CPT1A	119	54
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000819222139	FH	On-Demand	Anodyne	GRM5	22	56
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000819222139	FH	On-Demand	Anodyne	ETHR	33	43
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000819222140	FH	On-Demand	Anodyne	CPT1A	119	54
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000819222140	FH	On-Demand	Anodyne	GRM5	22	56
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1	ZINC000819222140	FH	On-Demand	Anodyne	ETHR	33	43
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@H]1c1nc(-c2ccccc2)no1	ZINC000819222141	FH	On-Demand	Anodyne	CPT1A	119	54
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@H]1c1nc(-c2ccccc2)no1	ZINC000819222141	FH	On-Demand	Anodyne	GRM5	22	56
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@H]1c1nc(-c2ccccc2)no1	ZINC000819222141	FH	On-Demand	Anodyne	ETHR	33	43
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@H]1c1nc(-c2ccccc2)no1	ZINC000819222142	FH	On-Demand	Anodyne	CPT1A	119	54
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@H]1c1nc(-c2ccccc2)no1	ZINC000819222142	FH	On-Demand	Anodyne	GRM5	22	56
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@H]1c1nc(-c2ccccc2)no1	ZINC000819222142	FH	On-Demand	Anodyne	ETHR	33	43
COc1ccc2c(c1)CC[C@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C2	ZINC000819222161	FE	On-Demand	Anodyne	NQO2	35	42
COc1ccc2c(c1)CC[C@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C2	ZINC000819222161	FE	On-Demand	Anodyne	MTNR1A	47	40
COc1ccc2c(c1)CC[C@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)C2	ZINC000819222161	FE	On-Demand	Anodyne	MTNR1B	39	40
COc1ccc2c(c1)CC[C@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C2	ZINC000819222162	FE	On-Demand	Anodyne	NQO2	35	42
COc1ccc2c(c1)CC[C@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C2	ZINC000819222162	FE	On-Demand	Anodyne	MTNR1A	47	40
COc1ccc2c(c1)CC[C@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)C2	ZINC000819222162	FE	On-Demand	Anodyne	MTNR1B	39	40
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccccc1C)C2	ZINC000819222167	DG	On-Demand	Anodyne	ADRB3	22	50
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccccc1C)C2	ZINC000819222168	DG	On-Demand	Anodyne	ADRB3	22	50
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(C(F)(F)F)cc1)C2	ZINC000819222173	FH	On-Demand	Anodyne	ADRB3	29	61
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(C(F)(F)F)cc1)C2	ZINC000819222176	FH	On-Demand	Anodyne	ADRB3	29	61
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(C#N)cc1)C2	ZINC000819222197	DF	On-Demand	Mild	ADRB3	24	53
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(C#N)cc1)C2	ZINC000819222198	DF	On-Demand	Mild	ADRB3	24	53
O=S1(=O)CCCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819222201	CC	On-Demand	Anodyne	ADRB2	20	40
O=S1(=O)CCCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819222201	CC	On-Demand	Anodyne	ADRB1	22	42
O=S1(=O)CCCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819222201	CC	On-Demand	Anodyne	ADRB3	90	46
O=S1(=O)CCCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819222202	CC	On-Demand	Anodyne	ADRB2	20	40
O=S1(=O)CCCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819222202	CC	On-Demand	Anodyne	ADRB1	22	42
O=S1(=O)CCCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819222202	CC	On-Demand	Anodyne	ADRB3	90	46
O=S1(=O)CCCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819222203	CC	On-Demand	Anodyne	ADRB2	20	40
O=S1(=O)CCCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819222203	CC	On-Demand	Anodyne	ADRB1	22	42
O=S1(=O)CCCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819222203	CC	On-Demand	Anodyne	ADRB3	90	46
O=S1(=O)CCCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819222204	CC	On-Demand	Anodyne	ADRB2	20	40
O=S1(=O)CCCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819222204	CC	On-Demand	Anodyne	ADRB1	22	42
O=S1(=O)CCCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819222204	CC	On-Demand	Anodyne	ADRB3	90	46
COCC[C@H](Cc1ccco1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819222205	EE	On-Demand	Bother	CACNA1C	29	41
COCC[C@H](Cc1ccco1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819222205	EE	On-Demand	Bother	CACNA1D	47	41
COCC[C@H](Cc1ccco1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819222206	EE	On-Demand	Bother	CACNA1C	29	41
COCC[C@H](Cc1ccco1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819222206	EE	On-Demand	Bother	CACNA1D	47	41
COCC[C@@H](Cc1ccco1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819222207	EE	On-Demand	Bother	CACNA1C	29	41
COCC[C@@H](Cc1ccco1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819222207	EE	On-Demand	Bother	CACNA1D	47	41
COCC[C@@H](Cc1ccco1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819222208	EE	On-Demand	Bother	CACNA1C	29	41
COCC[C@@H](Cc1ccco1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819222208	EE	On-Demand	Bother	CACNA1D	47	41
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1ccccc1	ZINC000819222224	FF	On-Demand	Anodyne	F2	31	49
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1ccccc1	ZINC000819222224	FF	On-Demand	Anodyne	PLG	21	49
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1ccccc1	ZINC000819222224	FF	On-Demand	Anodyne	PRSS1	16	49
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1ccccc1	ZINC000819222224	FF	On-Demand	Anodyne	CELA1	18	40
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1ccccc1	ZINC000819222224	FF	On-Demand	Anodyne	CMA1	34	42
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1ccccc1	ZINC000819222224	FF	On-Demand	Anodyne	TRY1_BOVIN	21	49
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1ccccc1	ZINC000819222224	FF	On-Demand	Anodyne	CCKAR	18	43
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1ccccc1	ZINC000819222224	FF	On-Demand	Anodyne	CTSK	23	43
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1ccccc1	ZINC000819222224	FF	On-Demand	Anodyne	REN	72	40
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1ccccc1	ZINC000819222224	FF	On-Demand	Anodyne	MTTP	35	43
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1ccccc1	ZINC000819222224	FF	On-Demand	Anodyne	FPR1	45	40
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1	ZINC000819222226	FF	On-Demand	Anodyne	F2	31	49
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1	ZINC000819222226	FF	On-Demand	Anodyne	PLG	21	49
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1	ZINC000819222226	FF	On-Demand	Anodyne	PRSS1	16	49
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1	ZINC000819222226	FF	On-Demand	Anodyne	CELA1	18	40
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1	ZINC000819222226	FF	On-Demand	Anodyne	CMA1	34	42
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1	ZINC000819222226	FF	On-Demand	Anodyne	TRY1_BOVIN	21	49
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1	ZINC000819222226	FF	On-Demand	Anodyne	CCKAR	18	43
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1	ZINC000819222226	FF	On-Demand	Anodyne	CTSK	23	43
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1	ZINC000819222226	FF	On-Demand	Anodyne	REN	72	40
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1	ZINC000819222226	FF	On-Demand	Anodyne	MTTP	35	43
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1	ZINC000819222226	FF	On-Demand	Anodyne	FPR1	45	40
C[C@H]1[C@H](C(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)CCN1C(=O)OC(C)(C)C	ZINC000819222233	HH	On-Demand	Anodyne	MC4R	26	41
COc1cccc([C@H](O)C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819222239	CD	On-Demand	Anodyne	DRD4	41	31
COc1cccc([C@H](O)C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819222239	CD	On-Demand	Anodyne	CCR3	15	43
COc1cccc([C@H](O)C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819222242	CD	On-Demand	Anodyne	DRD4	41	31
COc1cccc([C@H](O)C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819222242	CD	On-Demand	Anodyne	CCR3	15	43
CC(C)(C)OC(=O)NCCCCCC(=O)N1CCC[C@H](CO)CC1	ZINC000819222243	EF	On-Demand	Anodyne	PREP	17	51
CC(C)(C)OC(=O)NCCCCCC(=O)N1CCC[C@@H](CO)CC1	ZINC000819222244	EF	On-Demand	Anodyne	PREP	17	51
O=C(c1cc(I)cc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819222264	IH	On-Demand	Anodyne	L3MBTL3	42	35
O=C(c1cc(I)cc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819222265	IH	On-Demand	Anodyne	L3MBTL3	42	35
CN1CCCC[C@@H]1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819222266	CD	On-Demand	Anodyne	PREP	49	45
CN1CCCC[C@H]1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819222267	CD	On-Demand	Anodyne	PREP	49	45
CN1CCCC[C@@H]1C(=O)N1CCC[C@H](CO)CC1	ZINC000819222268	CD	On-Demand	Anodyne	PREP	49	45
CN1CCCC[C@H]1C(=O)N1CCC[C@H](CO)CC1	ZINC000819222269	CD	On-Demand	Anodyne	PREP	49	45
O=C(NC[C@H]1CCCN(C(=O)C(F)=C2CCC2)C1)Nc1cccc(F)c1	ZINC000819222270	FH	On-Demand	Anodyne	CCR3	81	44
N#Cc1cccc(OCC(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819222280	CD	On-Demand	Mild	HTR1B	17	42
N#Cc1cccc(OCC(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819222280	CD	On-Demand	Mild	CPT1A	103	46
N#Cc1cccc(OCC(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819222280	CD	On-Demand	Mild	CPT2	47	39
N#Cc1cccc(OCC(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819222280	CD	On-Demand	Mild	CHRNA10	56	51
C=CCS(=O)(=O)CCNC[C@@H](O)c1cccc(F)c1	ZINC000819222281	CD	On-Demand	Mild	ADRB1	27	43
C=CCS(=O)(=O)CCNC[C@@H](O)c1cccc(F)c1	ZINC000819222281	CD	On-Demand	Mild	ADRB3	47	43
C=CCS(=O)(=O)CCNC[C@H](O)c1cccc(F)c1	ZINC000819222282	CD	On-Demand	Mild	ADRB1	27	43
C=CCS(=O)(=O)CCNC[C@H](O)c1cccc(F)c1	ZINC000819222282	CD	On-Demand	Mild	ADRB3	47	43
N#Cc1cccc(OCC(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819222289	CD	On-Demand	Mild	HTR1B	17	42
N#Cc1cccc(OCC(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819222289	CD	On-Demand	Mild	CPT1A	103	46
N#Cc1cccc(OCC(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819222289	CD	On-Demand	Mild	CPT2	47	39
N#Cc1cccc(OCC(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819222289	CD	On-Demand	Mild	CHRNA10	56	51
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)N3CCC[C@@H](CO)CC3)ccc2Cl)C[C@@H](C)O1	ZINC000819222291	IE	On-Demand	Anodyne	CNR2	15	56
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)N3CCC[C@@H](CO)CC3)ccc2Cl)C[C@@H](C)O1	ZINC000819222291	IE	On-Demand	Anodyne	L3MBTL3	62	36
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)N3CCC[C@H](CO)CC3)ccc2Cl)C[C@@H](C)O1	ZINC000819222295	IE	On-Demand	Anodyne	CNR2	15	56
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)N3CCC[C@H](CO)CC3)ccc2Cl)C[C@@H](C)O1	ZINC000819222295	IE	On-Demand	Anodyne	L3MBTL3	62	36
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)N3CCC[C@@H](CO)CC3)ccc2Cl)C[C@@H](C)O1	ZINC000819222297	IE	On-Demand	Anodyne	CNR2	15	56
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)N3CCC[C@@H](CO)CC3)ccc2Cl)C[C@@H](C)O1	ZINC000819222297	IE	On-Demand	Anodyne	L3MBTL3	62	36
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)N3CCC[C@H](CO)CC3)ccc2Cl)C[C@@H](C)O1	ZINC000819222299	IE	On-Demand	Anodyne	CNR2	15	56
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)N3CCC[C@H](CO)CC3)ccc2Cl)C[C@@H](C)O1	ZINC000819222299	IE	On-Demand	Anodyne	L3MBTL3	62	36
CC[C@H]1OCC[C@H]1C(=O)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819222317	DG	On-Demand	Anodyne	MC4R	30	42
O=C1C[C@@H](C(=O)N2CCC[C@@H](CO)CC2)CN1Cc1ccccc1Cl	ZINC000819222324	FE	On-Demand	Anodyne	P2RX7	15	41
O=C1C[C@@H](C(=O)N2CCC[C@H](CO)CC2)CN1Cc1ccccc1Cl	ZINC000819222326	FE	On-Demand	Anodyne	P2RX7	15	41
O=C1C[C@H](C(=O)N2CCC[C@H](CO)CC2)CN1Cc1ccccc1Cl	ZINC000819222327	FE	On-Demand	Anodyne	P2RX7	15	41
O=C1C[C@H](C(=O)N2CCC[C@@H](CO)CC2)CN1Cc1ccccc1Cl	ZINC000819222328	FE	On-Demand	Anodyne	P2RX7	15	41
O=C(NCC(=O)N1CCC[C@@H](CO)CC1)c1ccncc1	ZINC000819222329	CC	On-Demand	Anodyne	PREP	29	57
O=C(NCC(=O)N1CCC[C@H](CO)CC1)c1ccncc1	ZINC000819222330	CC	On-Demand	Anodyne	PREP	29	57
O=C([C@@H]1CC(=O)N(C2CCCC2)C1)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819222355	GG	On-Demand	Anodyne	INHA	18	45
O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819222358	GG	On-Demand	Anodyne	INHA	18	45
O=C(c1ccc(-n2cccc2)nc1)N1CCC[C@H](CO)CC1	ZINC000819222360	CE	On-Demand	Anodyne	L3MBTL3	79	44
O=C(c1ccc(-n2cccc2)nc1)N1CCC[C@@H](CO)CC1	ZINC000819222361	CE	On-Demand	Anodyne	L3MBTL3	79	44
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819222372	ED	On-Demand	Mild	ADRB2	43	49
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819222372	ED	On-Demand	Mild	ADRB1	74	49
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819222372	ED	On-Demand	Mild	GRIN1	25	53
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819222372	ED	On-Demand	Mild	ADRB3	50	49
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819222373	ED	On-Demand	Mild	ADRB2	43	49
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819222373	ED	On-Demand	Mild	ADRB1	74	49
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819222373	ED	On-Demand	Mild	GRIN1	25	53
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819222373	ED	On-Demand	Mild	ADRB3	50	49
C=CCS(=O)(=O)CCNC[C@H](O)c1cc(OC)ccc1OC	ZINC000819222379	EC	On-Demand	Mild	ADRB2	17	44
C=CCS(=O)(=O)CCNC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819222381	EC	On-Demand	Mild	ADRB2	17	44
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccccc1	ZINC000819222393	CC	On-Demand	Mild	ADRB2	57	51
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccccc1	ZINC000819222393	CC	On-Demand	Mild	ADRB1	89	55
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccccc1	ZINC000819222393	CC	On-Demand	Mild	ADRB3	58	55
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccccc1	ZINC000819222393	CC	On-Demand	Mild	ABCB1	18	46
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccccc1	ZINC000819222395	CC	On-Demand	Mild	ADRB2	57	51
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccccc1	ZINC000819222395	CC	On-Demand	Mild	ADRB1	89	55
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccccc1	ZINC000819222395	CC	On-Demand	Mild	ADRB3	58	55
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccccc1	ZINC000819222395	CC	On-Demand	Mild	ABCB1	18	46
CC(C)(C)OC(=O)NC[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccc(F)cc1	ZINC000819222403	GG	On-Demand	Anodyne	GPR119	17	40
CC(C)(C)OC(=O)NC[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1ccc(F)cc1	ZINC000819222407	GG	On-Demand	Anodyne	GPR119	17	40
CC(C)(C)OC(=O)NC[C@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccc(F)cc1	ZINC000819222409	GG	On-Demand	Anodyne	GPR119	17	40
O=C1OCCN1c1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819222417	EG	On-Demand	Anodyne	ADRB1	35	47
O=C1OCCN1c1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819222417	EG	On-Demand	Anodyne	ADRB3	53	47
O=C1OCCN1c1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819222417	EG	On-Demand	Anodyne	CYP3A4	46	36
O=C1OCCN1c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819222418	EG	On-Demand	Anodyne	ADRB1	35	47
O=C1OCCN1c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819222418	EG	On-Demand	Anodyne	ADRB3	53	47
O=C1OCCN1c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819222418	EG	On-Demand	Anodyne	CYP3A4	46	36
COCC[C@@H](Cc1ccco1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819222430	DG	On-Demand	Anodyne	ADRB1	25	43
COCC[C@@H](Cc1ccco1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819222430	DG	On-Demand	Anodyne	ADRB3	40	42
COCC[C@H](Cc1ccco1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819222431	DG	On-Demand	Anodyne	ADRB1	25	43
COCC[C@H](Cc1ccco1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819222431	DG	On-Demand	Anodyne	ADRB3	40	42
COCC[C@@H](Cc1ccco1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819222432	DG	On-Demand	Anodyne	ADRB1	25	43
COCC[C@@H](Cc1ccco1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819222432	DG	On-Demand	Anodyne	ADRB3	40	42
COCC[C@H](Cc1ccco1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819222433	DG	On-Demand	Anodyne	ADRB1	25	43
COCC[C@H](Cc1ccco1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819222433	DG	On-Demand	Anodyne	ADRB3	40	42
COCC[C@H](Cc1ccco1)NC[C@@H](O)c1cccnc1	ZINC000819222448	CD	On-Demand	Anodyne	ADRB3	37	42
COCC[C@@H](Cc1ccco1)NC[C@@H](O)c1cccnc1	ZINC000819222449	CD	On-Demand	Anodyne	ADRB3	37	42
COCC[C@@H](Cc1ccco1)NC[C@H](O)c1cccnc1	ZINC000819222450	CD	On-Demand	Anodyne	ADRB3	37	42
COCC[C@H](Cc1ccco1)NC[C@H](O)c1cccnc1	ZINC000819222451	CD	On-Demand	Anodyne	ADRB3	37	42
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(Br)cc1)C2	ZINC000819222453	GH	On-Demand	Anodyne	ADRB3	26	58
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(Br)cc1)C2	ZINC000819222456	GH	On-Demand	Anodyne	ADRB3	26	58
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1F	ZINC000819222457	GI	On-Demand	Anodyne	DRD4	36	42
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1F	ZINC000819222457	GI	On-Demand	Anodyne	ACHE	17	40
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1F	ZINC000819222457	GI	On-Demand	Anodyne	SIGMAR1	36	53
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1F	ZINC000819222457	GI	On-Demand	Anodyne	SSTR5	49	37
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1F	ZINC000819222457	GI	On-Demand	Anodyne	CCR3	20	42
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1F	ZINC000819222457	GI	On-Demand	Anodyne	MCHR1	33	44
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1F	ZINC000819222458	GI	On-Demand	Anodyne	DRD4	36	42
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1F	ZINC000819222458	GI	On-Demand	Anodyne	ACHE	17	40
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1F	ZINC000819222458	GI	On-Demand	Anodyne	SIGMAR1	36	53
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1F	ZINC000819222458	GI	On-Demand	Anodyne	SSTR5	49	37
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1F	ZINC000819222458	GI	On-Demand	Anodyne	CCR3	20	42
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccccc1F	ZINC000819222458	GI	On-Demand	Anodyne	MCHR1	33	44
N#CCCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819222461	CF	On-Demand	Mild	ADRB3	17	43
N#CCCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819222462	CF	On-Demand	Mild	ADRB3	17	43
O=[N+]([O-])c1ccc([C@@H](O)CNCCCc2nc(-c3ccc(F)cc3)no2)cc1	ZINC000819222467	GG	On-Demand	Bother	ADRB3	23	46
O=[N+]([O-])c1ccc([C@H](O)CNCCCc2nc(-c3ccc(F)cc3)no2)cc1	ZINC000819222468	GG	On-Demand	Bother	ADRB3	23	46
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)C1CC1)C2	ZINC000819222479	CD	On-Demand	Anodyne	ADRB3	20	46
COc1ccc2c(c1)CC[C@H](NC[C@H](O)C1CC1)C2	ZINC000819222480	CD	On-Demand	Anodyne	ADRB3	20	46
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1cc(F)ccc1F	ZINC000819222488	GG	On-Demand	Anodyne	ADRB3	17	41
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1cc(F)ccc1F	ZINC000819222489	GG	On-Demand	Anodyne	ADRB3	17	41
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)C2	ZINC000819222502	GE	On-Demand	Anodyne	ADRB1	15	51
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)C2	ZINC000819222502	GE	On-Demand	Anodyne	ADRB3	40	55
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)C2	ZINC000819222503	GE	On-Demand	Anodyne	ADRB1	15	51
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)C2	ZINC000819222503	GE	On-Demand	Anodyne	ADRB3	40	55
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819222507	EH	On-Demand	Anodyne	ADRB1	37	72
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819222507	EH	On-Demand	Anodyne	ADRB3	64	72
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819222510	EH	On-Demand	Anodyne	ADRB1	37	72
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819222510	EH	On-Demand	Anodyne	ADRB3	64	72
N#Cc1ccc([C@H](O)CNCCCc2nc(-c3ccc(F)cc3)no2)cc1	ZINC000819222515	FG	On-Demand	Mild	ADRB3	18	43
N#Cc1ccc([C@@H](O)CNCCCc2nc(-c3ccc(F)cc3)no2)cc1	ZINC000819222516	FG	On-Demand	Mild	ADRB3	18	43
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccccc1F	ZINC000819222546	DC	On-Demand	Mild	ADRB2	39	42
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccccc1F	ZINC000819222546	DC	On-Demand	Mild	ADRB1	59	43
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccccc1F	ZINC000819222546	DC	On-Demand	Mild	ADRB3	28	41
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccccc1F	ZINC000819222547	DC	On-Demand	Mild	ADRB2	39	42
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccccc1F	ZINC000819222547	DC	On-Demand	Mild	ADRB1	59	43
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccccc1F	ZINC000819222547	DC	On-Demand	Mild	ADRB3	28	41
C=CCS(=O)(=O)CCNC[C@H](O)COc1cc(C)cc(C)c1	ZINC000819222554	ED	On-Demand	Mild	ADRB2	36	49
C=CCS(=O)(=O)CCNC[C@H](O)COc1cc(C)cc(C)c1	ZINC000819222554	ED	On-Demand	Mild	ADRB1	43	40
C=CCS(=O)(=O)CCNC[C@H](O)COc1cc(C)cc(C)c1	ZINC000819222554	ED	On-Demand	Mild	ADRB3	32	42
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000819222555	ED	On-Demand	Mild	ADRB2	36	49
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000819222555	ED	On-Demand	Mild	ADRB1	43	40
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000819222555	ED	On-Demand	Mild	ADRB3	32	42
CC(C)(C)OC(=O)NC[C@H](C(=O)N1CCC[C@H](CO)CC1)c1ccc(F)cc1	ZINC000819222557	GG	On-Demand	Anodyne	GPR119	17	40
C=CCS(=O)(=O)CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819222560	FD	On-Demand	Mild	ADRB3	28	41
C=CCS(=O)(=O)CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819222562	FD	On-Demand	Mild	ADRB3	28	41
O=C(c1ccc(C(F)(F)F)c(O)c1)N1CCC[C@H](CO)CC1	ZINC000819222576	DF	On-Demand	Anodyne	SLC9A1	40	40
O=C(c1ccc(C(F)(F)F)c(O)c1)N1CCC[C@H](CO)CC1	ZINC000819222576	DF	On-Demand	Anodyne	RBP4	28	42
O=C(c1ccc(C(F)(F)F)c(O)c1)N1CCC[C@H](CO)CC1	ZINC000819222576	DF	On-Demand	Anodyne	SFRP1	108	39
O=C(c1ccc(C(F)(F)F)c(O)c1)N1CCC[C@H](CO)CC1	ZINC000819222576	DF	On-Demand	Anodyne	WNT3	75	33
O=C(c1ccc(C(F)(F)F)c(O)c1)N1CCC[C@H](CO)CC1	ZINC000819222576	DF	On-Demand	Anodyne	L3MBTL3	83	40
O=C(c1ccc(C(F)(F)F)c(O)c1)N1CCC[C@@H](CO)CC1	ZINC000819222577	DF	On-Demand	Anodyne	SLC9A1	40	40
O=C(c1ccc(C(F)(F)F)c(O)c1)N1CCC[C@@H](CO)CC1	ZINC000819222577	DF	On-Demand	Anodyne	RBP4	28	42
O=C(c1ccc(C(F)(F)F)c(O)c1)N1CCC[C@@H](CO)CC1	ZINC000819222577	DF	On-Demand	Anodyne	SFRP1	108	39
O=C(c1ccc(C(F)(F)F)c(O)c1)N1CCC[C@@H](CO)CC1	ZINC000819222577	DF	On-Demand	Anodyne	WNT3	75	33
O=C(c1ccc(C(F)(F)F)c(O)c1)N1CCC[C@@H](CO)CC1	ZINC000819222577	DF	On-Demand	Anodyne	L3MBTL3	83	40
O=C(OCc1ccccc1)N1CC[C@@](F)(C(=O)N2CCC[C@H](CO)CC2)C1	ZINC000819222592	GE	On-Demand	Anodyne	GRIN2B	34	45
O=C(OCc1ccccc1)N1CC[C@@](F)(C(=O)N2CCC[C@H](CO)CC2)C1	ZINC000819222592	GE	On-Demand	Anodyne	PREP	32	45
O=C(OCc1ccccc1)N1CC[C@@](F)(C(=O)N2CCC[C@H](CO)CC2)C1	ZINC000819222592	GE	On-Demand	Anodyne	TGM2	24	41
O=C(OCc1ccccc1)N1CC[C@@](F)(C(=O)N2CCC[C@H](CO)CC2)C1	ZINC000819222592	GE	On-Demand	Anodyne	F13A1	28	41
O=C(OCc1ccccc1)N1CC[C@@](F)(C(=O)N2CCC[C@H](CO)CC2)C1	ZINC000819222592	GE	On-Demand	Anodyne	SLC12A5	64	39
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)N2CCC[C@H](CO)CC2)C1	ZINC000819222594	GE	On-Demand	Anodyne	GRIN2B	34	45
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)N2CCC[C@H](CO)CC2)C1	ZINC000819222594	GE	On-Demand	Anodyne	PREP	32	45
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)N2CCC[C@H](CO)CC2)C1	ZINC000819222594	GE	On-Demand	Anodyne	TGM2	24	41
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)N2CCC[C@H](CO)CC2)C1	ZINC000819222594	GE	On-Demand	Anodyne	F13A1	28	41
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)N2CCC[C@H](CO)CC2)C1	ZINC000819222594	GE	On-Demand	Anodyne	SLC12A5	64	39
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)N2CCC[C@@H](CO)CC2)C1	ZINC000819222595	GE	On-Demand	Anodyne	GRIN2B	34	45
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)N2CCC[C@@H](CO)CC2)C1	ZINC000819222595	GE	On-Demand	Anodyne	PREP	32	45
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)N2CCC[C@@H](CO)CC2)C1	ZINC000819222595	GE	On-Demand	Anodyne	TGM2	24	41
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)N2CCC[C@@H](CO)CC2)C1	ZINC000819222595	GE	On-Demand	Anodyne	F13A1	28	41
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)N2CCC[C@@H](CO)CC2)C1	ZINC000819222595	GE	On-Demand	Anodyne	SLC12A5	64	39
O=C(OCc1ccccc1)N1CC[C@@](F)(C(=O)N2CCC[C@@H](CO)CC2)C1	ZINC000819222596	GE	On-Demand	Anodyne	GRIN2B	34	45
O=C(OCc1ccccc1)N1CC[C@@](F)(C(=O)N2CCC[C@@H](CO)CC2)C1	ZINC000819222596	GE	On-Demand	Anodyne	PREP	32	45
O=C(OCc1ccccc1)N1CC[C@@](F)(C(=O)N2CCC[C@@H](CO)CC2)C1	ZINC000819222596	GE	On-Demand	Anodyne	TGM2	24	41
O=C(OCc1ccccc1)N1CC[C@@](F)(C(=O)N2CCC[C@@H](CO)CC2)C1	ZINC000819222596	GE	On-Demand	Anodyne	F13A1	28	41
O=C(OCc1ccccc1)N1CC[C@@](F)(C(=O)N2CCC[C@@H](CO)CC2)C1	ZINC000819222596	GE	On-Demand	Anodyne	SLC12A5	64	39
O=C(CCCn1ccccc1=O)N1CCC[C@H](CO)CC1	ZINC000819222598	CD	On-Demand	Anodyne	DUT	20	42
CCOc1ccc(OC[C@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819222599	GF	On-Demand	Anodyne	ADRB2	34	41
CCOc1ccc(OC[C@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819222599	GF	On-Demand	Anodyne	ADRB1	59	41
O=C(CCCn1ccccc1=O)N1CCC[C@@H](CO)CC1	ZINC000819222600	CD	On-Demand	Anodyne	DUT	20	42
CCOc1ccc(OC[C@@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819222601	GF	On-Demand	Anodyne	ADRB2	34	41
CCOc1ccc(OC[C@@H](O)CNCc2ccc(N3CCOC3=O)cc2)cc1	ZINC000819222601	GF	On-Demand	Anodyne	ADRB1	59	41
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccccc1C	ZINC000819222610	DC	On-Demand	Mild	ADRB2	47	58
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccccc1C	ZINC000819222610	DC	On-Demand	Mild	ADRB1	59	38
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccccc1C	ZINC000819222610	DC	On-Demand	Mild	ADRB3	32	43
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccccc1C	ZINC000819222610	DC	On-Demand	Mild	ABCB1	31	43
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccccc1C	ZINC000819222612	DC	On-Demand	Mild	ADRB2	47	58
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccccc1C	ZINC000819222612	DC	On-Demand	Mild	ADRB1	59	38
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccccc1C	ZINC000819222612	DC	On-Demand	Mild	ADRB3	32	43
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccccc1C	ZINC000819222612	DC	On-Demand	Mild	ABCB1	31	43
O=C(CCc1nc(O)c2ccccc2n1)N1CCC[C@@H](CO)CC1	ZINC000819222629	ED	On-Demand	Anodyne	GRIN2B	23	41
O=C(CCc1nc(O)c2ccccc2n1)N1CCC[C@@H](CO)CC1	ZINC000819222629	ED	On-Demand	Anodyne	TNKS	50	31
O=C(CCc1nc(O)c2ccccc2n1)N1CCC[C@H](CO)CC1	ZINC000819222632	ED	On-Demand	Anodyne	GRIN2B	23	41
O=C(CCc1nc(O)c2ccccc2n1)N1CCC[C@H](CO)CC1	ZINC000819222632	ED	On-Demand	Anodyne	TNKS	50	31
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819222658	FD	On-Demand	Mild	ADRB2	39	45
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819222658	FD	On-Demand	Mild	ADRB1	62	45
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819222658	FD	On-Demand	Mild	GRIN1	32	52
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819222658	FD	On-Demand	Mild	ADRB3	45	48
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819222660	FD	On-Demand	Mild	ADRB2	39	45
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819222660	FD	On-Demand	Mild	ADRB1	62	45
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819222660	FD	On-Demand	Mild	GRIN1	32	52
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819222660	FD	On-Demand	Mild	ADRB3	45	48
C=CCS(=O)(=O)CCNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819222662	FD	On-Demand	Mild	CYNT	44	50
CCN(CC)S(=O)(=O)c1cc(C(=O)N2CCC[C@H](CO)CC2)ccc1F	ZINC000819222663	GE	On-Demand	Anodyne	L3MBTL3	71	36
CCN(CC)S(=O)(=O)c1cc(C(=O)N2CCC[C@@H](CO)CC2)ccc1F	ZINC000819222665	GE	On-Demand	Anodyne	L3MBTL3	71	36
O=C(c1cc2ccsc2[nH]1)N1CCC[C@H](CO)CC1	ZINC000819222680	CE	On-Demand	Anodyne	GRIN2B	38	42
O=C(c1cc2ccsc2[nH]1)N1CCC[C@H](CO)CC1	ZINC000819222680	CE	On-Demand	Anodyne	HRH4	29	61
O=C(c1cc2ccsc2[nH]1)N1CCC[C@H](CO)CC1	ZINC000819222680	CE	On-Demand	Anodyne	AKR1C3	21	50
O=C(c1cc2ccsc2[nH]1)N1CCC[C@@H](CO)CC1	ZINC000819222683	CE	On-Demand	Anodyne	GRIN2B	38	42
O=C(c1cc2ccsc2[nH]1)N1CCC[C@@H](CO)CC1	ZINC000819222683	CE	On-Demand	Anodyne	HRH4	29	61
O=C(c1cc2ccsc2[nH]1)N1CCC[C@@H](CO)CC1	ZINC000819222683	CE	On-Demand	Anodyne	AKR1C3	21	50
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819222690	GG	On-Demand	Anodyne	GRIN2B	41	39
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819222690	GG	On-Demand	Anodyne	LTA4H	24	42
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819222690	GG	On-Demand	Anodyne	ADAM17	19	40
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819222690	GG	On-Demand	Anodyne	PREP	45	37
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819222690	GG	On-Demand	Anodyne	FFAR1	33	40
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819222691	GG	On-Demand	Anodyne	GRIN2B	41	39
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819222691	GG	On-Demand	Anodyne	LTA4H	24	42
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819222691	GG	On-Demand	Anodyne	ADAM17	19	40
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819222691	GG	On-Demand	Anodyne	PREP	45	37
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819222691	GG	On-Demand	Anodyne	FFAR1	33	40
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819222692	GG	On-Demand	Anodyne	GRIN2B	41	39
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819222692	GG	On-Demand	Anodyne	LTA4H	24	42
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819222692	GG	On-Demand	Anodyne	ADAM17	19	40
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819222692	GG	On-Demand	Anodyne	PREP	45	37
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819222692	GG	On-Demand	Anodyne	FFAR1	33	40
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819222693	GG	On-Demand	Anodyne	GRIN2B	41	39
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819222693	GG	On-Demand	Anodyne	LTA4H	24	42
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819222693	GG	On-Demand	Anodyne	ADAM17	19	40
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819222693	GG	On-Demand	Anodyne	PREP	45	37
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819222693	GG	On-Demand	Anodyne	FFAR1	33	40
C[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819222696	EG	On-Demand	Anodyne	MTTP	27	41
C[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819222696	EG	On-Demand	Anodyne	EPHX2	17	43
C[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819222696	EG	On-Demand	Anodyne	MCHR1	16	42
C[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819222697	EG	On-Demand	Anodyne	MTTP	27	41
C[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819222697	EG	On-Demand	Anodyne	EPHX2	17	43
C[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819222697	EG	On-Demand	Anodyne	MCHR1	16	42
C[C@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819222698	EG	On-Demand	Anodyne	MTTP	27	41
C[C@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819222698	EG	On-Demand	Anodyne	EPHX2	17	43
C[C@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819222698	EG	On-Demand	Anodyne	MCHR1	16	42
C[C@H](C(=O)N1CCC[C@H](CO)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819222699	EG	On-Demand	Anodyne	MTTP	27	41
C[C@H](C(=O)N1CCC[C@H](CO)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819222699	EG	On-Demand	Anodyne	EPHX2	17	43
C[C@H](C(=O)N1CCC[C@H](CO)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819222699	EG	On-Demand	Anodyne	MCHR1	16	42
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCCC#N	ZINC000819222727	CD	On-Demand	Mild	PAPA1_CARPA	31	41
CC(C)(C)OC(=O)NCC[C@H](O)CNCCCC#N	ZINC000819222728	CD	On-Demand	Mild	PAPA1_CARPA	31	41
C=CCS(=O)(=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819222756	ED	On-Demand	Mild	ADRB2	45	58
C=CCS(=O)(=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819222756	ED	On-Demand	Mild	ADRB1	57	52
C=CCS(=O)(=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819222756	ED	On-Demand	Mild	ADRB3	34	51
C=CCS(=O)(=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819222756	ED	On-Demand	Mild	CYP2D6	16	42
C=CCS(=O)(=O)CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819222756	ED	On-Demand	Mild	ABCB1	19	46
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819222757	ED	On-Demand	Mild	ADRB2	45	58
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819222757	ED	On-Demand	Mild	ADRB1	57	52
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819222757	ED	On-Demand	Mild	ADRB3	34	51
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819222757	ED	On-Demand	Mild	CYP2D6	16	42
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819222757	ED	On-Demand	Mild	ABCB1	19	46
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cc3ccccc3o1)C2	ZINC000819222758	EH	On-Demand	Anodyne	ADRB3	20	45
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(Cl)cc1)C2	ZINC000819222760	EH	On-Demand	Anodyne	ADRB3	32	68
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccccc1F	ZINC000819222767	FG	On-Demand	Anodyne	ADRB3	18	43
O[C@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccccc1F	ZINC000819222769	FG	On-Demand	Anodyne	ADRB3	18	43
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccn1	ZINC000819222775	FF	On-Demand	Anodyne	ADRB1	27	40
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccn1	ZINC000819222775	FF	On-Demand	Anodyne	ADRB3	40	41
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccn1	ZINC000819222775	FF	On-Demand	Anodyne	CYP3A4	47	35
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccn1	ZINC000819222778	FF	On-Demand	Anodyne	ADRB1	27	40
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccn1	ZINC000819222778	FF	On-Demand	Anodyne	ADRB3	40	41
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccn1	ZINC000819222778	FF	On-Demand	Anodyne	CYP3A4	47	35
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccn1	ZINC000819222780	FF	On-Demand	Anodyne	ADRB1	27	40
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccn1	ZINC000819222780	FF	On-Demand	Anodyne	ADRB3	40	41
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccn1	ZINC000819222780	FF	On-Demand	Anodyne	CYP3A4	47	35
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccn1	ZINC000819222782	FF	On-Demand	Anodyne	ADRB1	27	40
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccn1	ZINC000819222782	FF	On-Demand	Anodyne	ADRB3	40	41
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1Cc1ccccn1	ZINC000819222782	FF	On-Demand	Anodyne	CYP3A4	47	35
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819222800	FC	On-Demand	Mild	ADRB3	26	41
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)C1CC1	ZINC000819222801	EG	On-Demand	Anodyne	SIGMAR1	19	44
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)C1CC1	ZINC000819222801	EG	On-Demand	Anodyne	CACNA1I	40	37
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819222803	FC	On-Demand	Mild	ADRB3	26	41
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)C1CC1	ZINC000819222804	EG	On-Demand	Anodyne	SIGMAR1	19	44
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)C1CC1	ZINC000819222804	EG	On-Demand	Anodyne	CACNA1I	40	37
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819222818	ED	On-Demand	Mild	ADRB2	28	44
C=CCS(=O)(=O)CCNC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819222818	ED	On-Demand	Mild	ADRB1	30	40
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819222820	GI	On-Demand	Anodyne	SLC6A3	27	49
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819222820	GI	On-Demand	Anodyne	ADRB3	23	43
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819222820	GI	On-Demand	Anodyne	SIGMAR1	31	52
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819222820	GI	On-Demand	Anodyne	SSTR5	38	40
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819222820	GI	On-Demand	Anodyne	CCR3	33	42
C=CCS(=O)(=O)CCNC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819222821	ED	On-Demand	Mild	ADRB2	28	44
C=CCS(=O)(=O)CCNC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819222821	ED	On-Demand	Mild	ADRB1	30	40
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819222824	GI	On-Demand	Anodyne	SLC6A3	27	49
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819222824	GI	On-Demand	Anodyne	ADRB3	23	43
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819222824	GI	On-Demand	Anodyne	SIGMAR1	31	52
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819222824	GI	On-Demand	Anodyne	SSTR5	38	40
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccc(F)cc1	ZINC000819222824	GI	On-Demand	Anodyne	CCR3	33	42
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819222827	GH	On-Demand	Anodyne	SIGMAR1	24	44
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819222827	GH	On-Demand	Anodyne	SSTR5	59	41
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819222827	GH	On-Demand	Anodyne	CCR3	21	42
O[C@@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819222827	GH	On-Demand	Anodyne	MCHR1	29	40
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1ccccc1Cl	ZINC000819222838	EH	On-Demand	Anodyne	ADRB3	18	41
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819222839	GH	On-Demand	Anodyne	SIGMAR1	24	44
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819222839	GH	On-Demand	Anodyne	SSTR5	59	41
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819222839	GH	On-Demand	Anodyne	CCR3	21	42
O[C@H](CNC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1)c1ccc(F)cn1	ZINC000819222839	GH	On-Demand	Anodyne	MCHR1	29	40
O=C(COc1ccc2ccc(=O)oc2c1)Nc1ccccc1SCC(F)(F)F	ZINC000819222844	HI	On-Demand	Anodyne	MAOB	17	44
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000819222853	FH	On-Demand	Anodyne	ADRB3	27	57
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000819222859	FH	On-Demand	Anodyne	ADRB3	27	57
C=CCS(=O)(=O)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819222889	DD	On-Demand	Mild	ADRB2	37	41
C=CCS(=O)(=O)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819222889	DD	On-Demand	Mild	ADRB1	53	51
C=CCS(=O)(=O)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819222889	DD	On-Demand	Mild	ADRB3	77	51
C=CCS(=O)(=O)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819222891	DD	On-Demand	Mild	ADRB2	37	41
C=CCS(=O)(=O)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819222891	DD	On-Demand	Mild	ADRB1	53	51
C=CCS(=O)(=O)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819222891	DD	On-Demand	Mild	ADRB3	77	51
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCCN1Cc1ccccn1	ZINC000819222911	ED	On-Demand	Anodyne	ADRB3	61	41
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCCN1Cc1ccccn1	ZINC000819222916	ED	On-Demand	Anodyne	ADRB3	61	41
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCCN1Cc1ccccn1	ZINC000819222920	ED	On-Demand	Anodyne	ADRB3	61	41
O=C1[C@H](NC[C@H](O)c2cccnc2)CCCN1Cc1ccccn1	ZINC000819222922	ED	On-Demand	Anodyne	ADRB3	61	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(F)c(F)c2F)c1	ZINC000819222929	EF	On-Demand	Bother	ADRB1	32	45
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(F)c(F)c2F)c1	ZINC000819222929	EF	On-Demand	Bother	ADRB3	58	45
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(F)c(F)c2F)c1	ZINC000819222931	EF	On-Demand	Bother	ADRB1	32	45
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(F)c(F)c2F)c1	ZINC000819222931	EF	On-Demand	Bother	ADRB3	58	45
CC(C)(C)OC(=O)NCc1cccc(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819222957	FF	On-Demand	Anodyne	PREP	31	42
CC(C)(C)OC(=O)NCc1cccc(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819222957	FF	On-Demand	Anodyne	ST14	55	35
CC(C)(C)OC(=O)NCc1cccc(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819222960	FF	On-Demand	Anodyne	PREP	31	42
CC(C)(C)OC(=O)NCc1cccc(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819222960	FF	On-Demand	Anodyne	ST14	55	35
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1ccc(OC(F)(F)F)cc1	ZINC000819222989	GH	On-Demand	Anodyne	ADRB2	26	41
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1ccc(OC(F)(F)F)cc1	ZINC000819222989	GH	On-Demand	Anodyne	ADRB3	27	44
O[C@H](CNCCc1ccc(F)c(F)c1F)c1ccc(OC(F)(F)F)cc1	ZINC000819222992	GH	On-Demand	Anodyne	ADRB2	26	41
O[C@H](CNCCc1ccc(F)c(F)c1F)c1ccc(OC(F)(F)F)cc1	ZINC000819222992	GH	On-Demand	Anodyne	ADRB3	27	44
C[C@@H]1[C@H](C(=O)N2CCC[C@@H](CO)CC2)CCCN1C(=O)OC(C)(C)C	ZINC000819222997	FF	On-Demand	Anodyne	PREP	17	53
C[C@@H]1[C@H](C(=O)N2CCC[C@H](CO)CC2)CCCN1C(=O)OC(C)(C)C	ZINC000819223000	FF	On-Demand	Anodyne	PREP	17	53
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](CO)CC2)ccc1Br	ZINC000819223004	IF	On-Demand	Anodyne	SFRP1	41	33
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](CO)CC2)ccc1Br	ZINC000819223004	IF	On-Demand	Anodyne	L3MBTL3	70	38
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](CO)CC2)ccc1Br	ZINC000819223008	IF	On-Demand	Anodyne	SFRP1	41	33
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](CO)CC2)ccc1Br	ZINC000819223008	IF	On-Demand	Anodyne	L3MBTL3	70	38
O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819223019	II	On-Demand	Bother	SLC6A9	16	51
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819223033	IE	On-Demand	Anodyne	F2	32	40
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819223044	IE	On-Demand	Anodyne	F2	32	40
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819223046	IE	On-Demand	Anodyne	F2	32	40
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819223048	IE	On-Demand	Anodyne	F2	32	40
O=C(CCCn1ccnc1)N1CCC[C@@H](CO)CC1	ZINC000819223062	CD	On-Demand	Anodyne	TBXAS1	36	44
O=C(CCCn1ccnc1)N1CCC[C@H](CO)CC1	ZINC000819223063	CD	On-Demand	Anodyne	TBXAS1	36	44
O=C(/C=C/c1ccccc1)N1CCC(C(=O)N2CCC[C@@H](CO)CC2)CC1	ZINC000819223066	FF	On-Demand	Anodyne	PREP	73	39
O=C(/C=C\c1ccccc1)N1CCC(C(=O)N2CCC[C@@H](CO)CC2)CC1	ZINC000819223067	FF	On-Demand	Anodyne	PREP	73	39
O=C(/C=C\c1ccccc1)N1CCC(C(=O)N2CCC[C@H](CO)CC2)CC1	ZINC000819223068	FF	On-Demand	Anodyne	PREP	73	39
O=C(/C=C/c1ccccc1)N1CCC(C(=O)N2CCC[C@H](CO)CC2)CC1	ZINC000819223069	FF	On-Demand	Anodyne	PREP	73	39
O=C(N1CCC[C@@H](CO)CC1)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819223074	FE	On-Demand	Anodyne	MMP13	30	46
O=C(N1CCC[C@@H](CO)CC1)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819223074	FE	On-Demand	Anodyne	APP	56	38
O=C(N1CCC[C@@H](CO)CC1)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819223074	FE	On-Demand	Anodyne	MMP9	17	46
O=C(N1CCC[C@@H](CO)CC1)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819223074	FE	On-Demand	Anodyne	CYP3A4	24	44
O=C(N1CCC[C@H](CO)CC1)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819223075	FE	On-Demand	Anodyne	MMP13	30	46
O=C(N1CCC[C@H](CO)CC1)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819223075	FE	On-Demand	Anodyne	APP	56	38
O=C(N1CCC[C@H](CO)CC1)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819223075	FE	On-Demand	Anodyne	MMP9	17	46
O=C(N1CCC[C@H](CO)CC1)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819223075	FE	On-Demand	Anodyne	CYP3A4	24	44
O=C(C1=NO[C@H](c2ccccc2)C1)N1CCC[C@H](CO)CC1	ZINC000819223079	DE	On-Demand	Anodyne	L3MBTL3	48	35
O=C(C1=NO[C@H](c2ccccc2)C1)N1CCC[C@@H](CO)CC1	ZINC000819223080	DE	On-Demand	Anodyne	L3MBTL3	48	35
O=C(C1=NO[C@@H](c2ccccc2)C1)N1CCC[C@@H](CO)CC1	ZINC000819223081	DE	On-Demand	Anodyne	L3MBTL3	48	35
O=C(C1=NO[C@@H](c2ccccc2)C1)N1CCC[C@H](CO)CC1	ZINC000819223082	DE	On-Demand	Anodyne	L3MBTL3	48	35
O=C(Cn1c(Cc2ccccc2)nc2ccccc21)N1CCC[C@H](CO)CC1	ZINC000819223083	GG	On-Demand	Anodyne	HRH1	17	46
O=C(Cn1c(Cc2ccccc2)nc2ccccc21)N1CCC[C@H](CO)CC1	ZINC000819223083	GG	On-Demand	Anodyne	PDE6D	61	34
O=C(Cn1c(Cc2ccccc2)nc2ccccc21)N1CCC[C@@H](CO)CC1	ZINC000819223084	GG	On-Demand	Anodyne	HRH1	17	46
O=C(Cn1c(Cc2ccccc2)nc2ccccc21)N1CCC[C@@H](CO)CC1	ZINC000819223084	GG	On-Demand	Anodyne	PDE6D	61	34
C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819223091	IG	On-Demand	Anodyne	SLC6A9	24	40
C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819223093	IG	On-Demand	Anodyne	SLC6A9	24	40
CN(C)S(=O)(=O)c1cc(C(=O)N2CCC[C@@H](CO)CC2)ccc1Br	ZINC000819223097	HD	On-Demand	Anodyne	L3MBTL3	76	40
CN(C)S(=O)(=O)c1cc(C(=O)N2CCC[C@H](CO)CC2)ccc1Br	ZINC000819223098	HD	On-Demand	Anodyne	L3MBTL3	76	40
CC(C)(C)OC(=O)N1CC(C)(C)[C@@H]1C(=O)N1CCC[C@H](CO)CC1	ZINC000819223099	EE	On-Demand	Anodyne	PREP	15	49
CC(C)(C)OC(=O)N1CC(C)(C)[C@@H]1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819223100	EE	On-Demand	Anodyne	PREP	15	49
CC(C)(C)OC(=O)N1CC(C)(C)[C@H]1C(=O)N1CCC[C@H](CO)CC1	ZINC000819223101	EE	On-Demand	Anodyne	PREP	15	49
CC(C)(C)OC(=O)N1CC(C)(C)[C@H]1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819223102	EE	On-Demand	Anodyne	PREP	15	49
O=C([C@@H]1C[C@H]1Cc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819223107	CE	On-Demand	Anodyne	GRIN2B	54	40
O=C([C@@H]1C[C@H]1Cc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819223107	CE	On-Demand	Anodyne	PREP	74	40
O=C([C@@H]1C[C@H]1Cc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819223108	CE	On-Demand	Anodyne	GRIN2B	54	40
O=C([C@@H]1C[C@H]1Cc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819223108	CE	On-Demand	Anodyne	PREP	74	40
O=C([C@@H]1C[C@@H]1Cc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819223109	CE	On-Demand	Anodyne	GRIN2B	54	40
O=C([C@@H]1C[C@@H]1Cc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819223109	CE	On-Demand	Anodyne	PREP	74	40
O=C([C@@H]1C[C@@H]1Cc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819223110	CE	On-Demand	Anodyne	GRIN2B	54	40
O=C([C@@H]1C[C@@H]1Cc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819223110	CE	On-Demand	Anodyne	PREP	74	40
N#CCn1c(C(=O)N2CCC[C@H](CO)CC2)cc2ccccc21	ZINC000819223111	DE	On-Demand	Mild	AKR1C3	17	40
N#CCn1c(C(=O)N2CCC[C@@H](CO)CC2)cc2ccccc21	ZINC000819223112	DE	On-Demand	Mild	AKR1C3	17	40
O=C(CSc1ccccc1C(=O)N1CCC[C@H](CO)CC1)NC1CCCCCCC1	ZINC000819223117	II	On-Demand	Anodyne	EPHX2	18	48
O=C(CSc1ccccc1C(=O)N1CCC[C@@H](CO)CC1)NC1CCCCCCC1	ZINC000819223118	II	On-Demand	Anodyne	EPHX2	18	48
O=C(c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819223121	HH	On-Demand	Anodyne	CCKAR	21	41
O=C(c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819223122	HH	On-Demand	Anodyne	CCKAR	21	41
CC(C)(C)OC(=O)NC1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CCC1	ZINC000819223135	FF	On-Demand	Bother	CACNA1D	48	32
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCC1	ZINC000819223136	FF	On-Demand	Bother	CACNA1D	48	32
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(CN2CCc3ccccc32)cc1	ZINC000819223145	EH	On-Demand	Anodyne	NOD2	43	36
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(CN2CCc3ccccc32)cc1	ZINC000819223146	EH	On-Demand	Anodyne	NOD2	43	36
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(CN2CCc3ccccc32)cc1	ZINC000819223147	EH	On-Demand	Anodyne	NOD2	43	36
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(CN2CCc3ccccc32)cc1	ZINC000819223148	EH	On-Demand	Anodyne	NOD2	43	36
C=CCS(=O)(=O)CCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819223149	ED	On-Demand	Mild	ADRB3	40	37
C=CCS(=O)(=O)CCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819223151	ED	On-Demand	Mild	ADRB3	40	37
O[C@H](CNCCCn1ccnn1)c1cccc(Cl)c1	ZINC000819223160	CD	On-Demand	Anodyne	ADRB1	45	44
O[C@H](CNCCCn1ccnn1)c1cccc(Cl)c1	ZINC000819223160	CD	On-Demand	Anodyne	ADRB3	63	47
O[C@@H](CNCCCn1ccnn1)c1cccc(Cl)c1	ZINC000819223163	CD	On-Demand	Anodyne	ADRB1	45	44
O[C@@H](CNCCCn1ccnn1)c1cccc(Cl)c1	ZINC000819223163	CD	On-Demand	Anodyne	ADRB3	63	47
CCOC(=O)N(C)C1CCN(C(=O)Cc2cccc(NC(C)=O)c2)CC1	ZINC000819223165	FE	On-Demand	Anodyne	CCR5	20	40
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1ccc(Cl)cc1	ZINC000819223181	EH	On-Demand	Anodyne	ADRB2	23	47
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1ccc(Cl)cc1	ZINC000819223181	EH	On-Demand	Anodyne	ADRB1	25	41
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1ccc(Cl)cc1	ZINC000819223181	EH	On-Demand	Anodyne	ADRB3	33	41
Cc1cccc(NC(=O)N2CCN(C(=O)C(F)=C3CCC3)CC2)c1	ZINC000819223190	EG	On-Demand	Anodyne	P2RY14	45	33
Cc1cccc(NC(=O)N2CCN(C(=O)C(F)=C3CCC3)CC2)c1	ZINC000819223190	EG	On-Demand	Anodyne	KCNK3	53	38
Cc1cccc(NC(=O)N2CCN(C(=O)C(F)=C3CCC3)CC2)c1	ZINC000819223190	EG	On-Demand	Anodyne	KCNK9	43	38
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)Cc2ccc(F)cc2)CCC1	ZINC000819223210	FF	On-Demand	Anodyne	PAPA1_CARPA	21	44
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000819223211	FD	On-Demand	Mild	ADRB2	22	41
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000819223212	FD	On-Demand	Mild	ADRB2	22	41
CC(C)(C)OC(=O)NC1(CNC[C@H](O)Cc2ccc(F)cc2)CCC1	ZINC000819223213	FF	On-Demand	Anodyne	PAPA1_CARPA	21	44
O[C@@H](CNCCCc1nc(-c2ccc(F)cc2)no1)c1ccc(Cl)cc1	ZINC000819223252	GH	On-Demand	Anodyne	ADRB3	30	45
CC(=O)Nc1cccc(CC(=O)Nc2ccc(SC(C)(C)C)cc2)c1	ZINC000819223261	FJ	On-Demand	Anodyne	IMDH_CRYPV	46	35
N#CCCCNC[C@@H](O)c1cccc(F)c1	ZINC000819223269	BD	On-Demand	Mild	ADRB1	31	42
N#CCCCNC[C@@H](O)c1cccc(F)c1	ZINC000819223269	BD	On-Demand	Mild	ADRB3	34	42
N#CCCCNC[C@H](O)c1cccc(F)c1	ZINC000819223271	BD	On-Demand	Mild	ADRB1	31	42
N#CCCCNC[C@H](O)c1cccc(F)c1	ZINC000819223271	BD	On-Demand	Mild	ADRB3	34	42
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(F)c(F)c1)C2	ZINC000819223280	EG	On-Demand	Anodyne	ADRB3	30	56
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(F)c(F)c1)C2	ZINC000819223283	EG	On-Demand	Anodyne	ADRB3	30	56
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(-c2n[nH]c(C3CC3)n2)c1	ZINC000819223314	GG	On-Demand	Anodyne	CPT1A	16	44
CC(C)(C)OC(=O)NC1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819223315	DE	On-Demand	Anodyne	ADRB1	22	40
CC(C)(C)OC(=O)NC1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819223315	DE	On-Demand	Anodyne	ADRB3	88	41
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819223318	DE	On-Demand	Anodyne	ADRB1	22	40
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819223318	DE	On-Demand	Anodyne	ADRB3	88	41
O=C(Nc1cc(Cl)ccn1)C(F)=C1CCC1	ZINC000819223321	BG	On-Demand	Anodyne	TYK2	60	34
O=C1[C@@H](NC[C@H](O)c2ccccc2Cl)CCCN1c1cccnc1	ZINC000819223337	EF	On-Demand	Anodyne	OPRL1	27	40
O=C1[C@H](NC[C@H](O)c2ccccc2Cl)CCCN1c1cccnc1	ZINC000819223341	EF	On-Demand	Anodyne	OPRL1	27	40
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccccc1C(F)(F)F)C2	ZINC000819223346	FH	On-Demand	Anodyne	ADRB3	22	51
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccccc1C(F)(F)F)C2	ZINC000819223349	FH	On-Demand	Anodyne	ADRB3	22	51
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cccc(F)c1)C2	ZINC000819223362	DG	On-Demand	Anodyne	ADRB3	28	57
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000819223365	GD	On-Demand	Mild	ADRB2	41	49
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000819223365	GD	On-Demand	Mild	ADRB1	66	49
C=CCS(=O)(=O)CCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000819223365	GD	On-Demand	Mild	ADRB3	43	49
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(Br)cc1	ZINC000819223367	GD	On-Demand	Mild	ADRB2	41	49
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(Br)cc1	ZINC000819223367	GD	On-Demand	Mild	ADRB1	66	49
C=CCS(=O)(=O)CCNC[C@H](O)COc1ccc(Br)cc1	ZINC000819223367	GD	On-Demand	Mild	ADRB3	43	49
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1cccc(C(F)(F)F)c1	ZINC000819223371	FH	On-Demand	Anodyne	ADRB2	26	41
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1cccc(C(F)(F)F)c1	ZINC000819223371	FH	On-Demand	Anodyne	ADRB1	27	43
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1cccc(C(F)(F)F)c1	ZINC000819223371	FH	On-Demand	Anodyne	ADRB3	49	43
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cccc(F)c1)C2	ZINC000819223373	DG	On-Demand	Anodyne	ADRB3	28	57
O[C@H](CNCCc1ccc(F)c(F)c1F)c1cccc(C(F)(F)F)c1	ZINC000819223375	FH	On-Demand	Anodyne	ADRB2	26	41
O[C@H](CNCCc1ccc(F)c(F)c1F)c1cccc(C(F)(F)F)c1	ZINC000819223375	FH	On-Demand	Anodyne	ADRB1	27	43
O[C@H](CNCCc1ccc(F)c(F)c1F)c1cccc(C(F)(F)F)c1	ZINC000819223375	FH	On-Demand	Anodyne	ADRB3	49	43
COc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cc(F)ccc1F)C2	ZINC000819223382	EG	On-Demand	Anodyne	ADRB3	22	49
COc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cc(F)ccc1F)C2	ZINC000819223385	EG	On-Demand	Anodyne	ADRB3	22	49
NC(=O)[C@@H]1CCCN(CCCNC(=O)C(F)=C2CCC2)C1	ZINC000819223392	CD	On-Demand	Anodyne	SLC6A1	92	35
NC(=O)[C@H]1CCCN(CCCNC(=O)C(F)=C2CCC2)C1	ZINC000819223394	CD	On-Demand	Anodyne	SLC6A1	92	35
O=C(c1ccc(COc2ccc(Cl)cc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819223399	FI	On-Demand	Anodyne	HRH3	31	48
O=C(c1ccc(COc2ccc(Cl)cc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819223399	FI	On-Demand	Anodyne	LSS	18	42
O=C(c1ccc(COc2ccc(Cl)cc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819223399	FI	On-Demand	Anodyne	SLC6A5	37	44
O=C(c1ccc(COc2ccc(Cl)cc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819223399	FI	On-Demand	Anodyne	L3MBTL3	70	41
O=C(c1ccc(COc2ccc(Cl)cc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819223400	FI	On-Demand	Anodyne	HRH3	31	48
O=C(c1ccc(COc2ccc(Cl)cc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819223400	FI	On-Demand	Anodyne	LSS	18	42
O=C(c1ccc(COc2ccc(Cl)cc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819223400	FI	On-Demand	Anodyne	SLC6A5	37	44
O=C(c1ccc(COc2ccc(Cl)cc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819223400	FI	On-Demand	Anodyne	L3MBTL3	70	41
O=C(c1cnc(-c2ccc(C(F)(F)F)cc2)s1)N1CCC[C@@H](CO)CC1	ZINC000819223403	GI	On-Demand	Anodyne	MTTP	28	40
O=C(c1cnc(-c2ccc(C(F)(F)F)cc2)s1)N1CCC[C@H](CO)CC1	ZINC000819223404	GI	On-Demand	Anodyne	MTTP	28	40
Cc1ccc(C(=O)N2CCC[C@@H](CO)CC2)cc1S(N)(=O)=O	ZINC000819223411	EC	On-Demand	Anodyne	CNR2	19	56
Cc1ccc(C(=O)N2CCC[C@@H](CO)CC2)cc1S(N)(=O)=O	ZINC000819223411	EC	On-Demand	Anodyne	L3MBTL3	81	39
Cc1ccc(C(=O)N2CCC[C@H](CO)CC2)cc1S(N)(=O)=O	ZINC000819223412	EC	On-Demand	Anodyne	CNR2	19	56
Cc1ccc(C(=O)N2CCC[C@H](CO)CC2)cc1S(N)(=O)=O	ZINC000819223412	EC	On-Demand	Anodyne	L3MBTL3	81	39
O=C(c1ccc(Oc2ccc(F)cc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819223413	EH	On-Demand	Anodyne	HRH3	27	48
O=C(c1ccc(Oc2ccc(F)cc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819223413	EH	On-Demand	Anodyne	SLC18A3	19	44
O=C(c1ccc(Oc2ccc(F)cc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819223413	EH	On-Demand	Anodyne	MMP2	15	45
O=C(c1ccc(Oc2ccc(F)cc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819223413	EH	On-Demand	Anodyne	MMP9	17	45
O=C(c1ccc(Oc2ccc(F)cc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819223413	EH	On-Demand	Anodyne	PLAU	21	47
O=C(c1ccc(Oc2ccc(F)cc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819223413	EH	On-Demand	Anodyne	ST14	17	47
O=C(c1ccc(Oc2ccc(F)cc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819223413	EH	On-Demand	Anodyne	L3MBTL3	92	45
O=C(c1ccc(Oc2ccc(F)cc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819223414	EH	On-Demand	Anodyne	HRH3	27	48
O=C(c1ccc(Oc2ccc(F)cc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819223414	EH	On-Demand	Anodyne	SLC18A3	19	44
O=C(c1ccc(Oc2ccc(F)cc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819223414	EH	On-Demand	Anodyne	MMP2	15	45
O=C(c1ccc(Oc2ccc(F)cc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819223414	EH	On-Demand	Anodyne	MMP9	17	45
O=C(c1ccc(Oc2ccc(F)cc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819223414	EH	On-Demand	Anodyne	PLAU	21	47
O=C(c1ccc(Oc2ccc(F)cc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819223414	EH	On-Demand	Anodyne	ST14	17	47
O=C(c1ccc(Oc2ccc(F)cc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819223414	EH	On-Demand	Anodyne	L3MBTL3	92	45
Cn1c(C(=O)N2CCC[C@H](CO)CC2)ccc1-c1ccccc1	ZINC000819223415	DF	On-Demand	Anodyne	L3MBTL3	50	37
Cn1c(C(=O)N2CCC[C@@H](CO)CC2)ccc1-c1ccccc1	ZINC000819223416	DF	On-Demand	Anodyne	L3MBTL3	50	37
O=C(c1cc(N2CCOC2=O)ccc1F)N1CCC[C@@H](CO)CC1	ZINC000819223421	EE	On-Demand	Anodyne	PARP1	44	35
O=C(c1cc(N2CCOC2=O)ccc1F)N1CCC[C@H](CO)CC1	ZINC000819223422	EE	On-Demand	Anodyne	PARP1	44	35
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCC[C@H](CO)CC1	ZINC000819223424	GF	On-Demand	Anodyne	PREP	88	55
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCC[C@H](CO)CC1	ZINC000819223424	GF	On-Demand	Anodyne	SFRP1	50	41
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCC[C@H](CO)CC1	ZINC000819223424	GF	On-Demand	Anodyne	WNT3	57	41
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819223425	GF	On-Demand	Anodyne	PREP	88	55
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819223425	GF	On-Demand	Anodyne	SFRP1	50	41
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819223425	GF	On-Demand	Anodyne	WNT3	57	41
CCn1c(S)nc2cc(C(=O)N3CCC[C@@H](CO)CC3)ccc2c1=O	ZINC000819223429	FD	On-Demand	Anodyne	L3MBTL3	55	35
CCn1c(S)nc2cc(C(=O)N3CCC[C@@H](CO)CC3)ccc2c1=O	ZINC000819223429	FD	On-Demand	Anodyne	HPGD	41	35
CCn1c(S)nc2cc(C(=O)N3CCC[C@H](CO)CC3)ccc2c1=O	ZINC000819223430	FD	On-Demand	Anodyne	L3MBTL3	55	35
CCn1c(S)nc2cc(C(=O)N3CCC[C@H](CO)CC3)ccc2c1=O	ZINC000819223430	FD	On-Demand	Anodyne	HPGD	41	35
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819223431	FD	On-Demand	Anodyne	CCR8	83	37
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819223431	FD	On-Demand	Anodyne	SFRP1	139	47
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819223431	FD	On-Demand	Anodyne	WNT3	92	38
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819223431	FD	On-Demand	Anodyne	L3MBTL3	67	37
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCC[C@H](CO)CC1	ZINC000819223432	FD	On-Demand	Anodyne	CCR8	83	37
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCC[C@H](CO)CC1	ZINC000819223432	FD	On-Demand	Anodyne	SFRP1	139	47
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCC[C@H](CO)CC1	ZINC000819223432	FD	On-Demand	Anodyne	WNT3	92	38
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCC[C@H](CO)CC1	ZINC000819223432	FD	On-Demand	Anodyne	L3MBTL3	67	37
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1cccc(Cl)c1	ZINC000819223436	GH	On-Demand	Anodyne	F2	21	42
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1cccc(Cl)c1	ZINC000819223436	GH	On-Demand	Anodyne	PLG	22	42
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1cccc(Cl)c1	ZINC000819223436	GH	On-Demand	Anodyne	REN	47	43
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1cccc(Cl)c1	ZINC000819223436	GH	On-Demand	Anodyne	CACNA1I	43	39
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1cccc(Cl)c1	ZINC000819223437	GH	On-Demand	Anodyne	F2	21	42
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1cccc(Cl)c1	ZINC000819223437	GH	On-Demand	Anodyne	PLG	22	42
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1cccc(Cl)c1	ZINC000819223437	GH	On-Demand	Anodyne	REN	47	43
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1cccc(Cl)c1	ZINC000819223437	GH	On-Demand	Anodyne	CACNA1I	43	39
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC[C@@H](CO)CC1	ZINC000819223441	DG	On-Demand	Anodyne	F10	22	45
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC[C@@H](CO)CC1	ZINC000819223441	DG	On-Demand	Anodyne	GRIN2B	44	53
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC[C@@H](CO)CC1	ZINC000819223441	DG	On-Demand	Anodyne	HRH4	40	67
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC[C@@H](CO)CC1	ZINC000819223441	DG	On-Demand	Anodyne	CYP51A1	25	44
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC[C@@H](CO)CC1	ZINC000819223441	DG	On-Demand	Anodyne	PYGL	85	46
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC[C@@H](CO)CC1	ZINC000819223441	DG	On-Demand	Anodyne	PYGM	15	42
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC[C@@H](CO)CC1	ZINC000819223441	DG	On-Demand	Anodyne	AKR1C3	24	55
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC[C@H](CO)CC1	ZINC000819223442	DG	On-Demand	Anodyne	F10	22	45
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC[C@H](CO)CC1	ZINC000819223442	DG	On-Demand	Anodyne	GRIN2B	44	53
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC[C@H](CO)CC1	ZINC000819223442	DG	On-Demand	Anodyne	HRH4	40	67
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC[C@H](CO)CC1	ZINC000819223442	DG	On-Demand	Anodyne	CYP51A1	25	44
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC[C@H](CO)CC1	ZINC000819223442	DG	On-Demand	Anodyne	PYGL	85	46
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC[C@H](CO)CC1	ZINC000819223442	DG	On-Demand	Anodyne	PYGM	15	42
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CCC[C@H](CO)CC1	ZINC000819223442	DG	On-Demand	Anodyne	AKR1C3	24	55
O=C(c1ccc(S(F)(F)(F)(F)F)cc1)N1CCC[C@@H](CO)CC1	ZINC000819223443	FJ	On-Demand	Reactive	MLYCD	17	40
O=C(c1ccc(S(F)(F)(F)(F)F)cc1)N1CCC[C@@H](CO)CC1	ZINC000819223443	FJ	On-Demand	Reactive	L3MBTL3	98	49
O=C(c1ccc(S(F)(F)(F)(F)F)cc1)N1CCC[C@H](CO)CC1	ZINC000819223444	FJ	On-Demand	Reactive	MLYCD	17	40
O=C(c1ccc(S(F)(F)(F)(F)F)cc1)N1CCC[C@H](CO)CC1	ZINC000819223444	FJ	On-Demand	Reactive	L3MBTL3	98	49
O=C(c1cc(-c2ccc(Br)cc2)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819223461	IJ	On-Demand	Anodyne	PRS	94	58
O=C(c1cc(-c2ccc(Br)cc2)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819223461	IJ	On-Demand	Anodyne	ACACB	16	41
O=C(c1cc(-c2ccc(Br)cc2)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819223461	IJ	On-Demand	Anodyne	TACR3	15	40
O=C(c1cc(-c2ccc(Br)cc2)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819223461	IJ	On-Demand	Anodyne	MT-CO2	49	42
O=C(c1cc(-c2ccc(Br)cc2)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819223462	IJ	On-Demand	Anodyne	PRS	94	58
O=C(c1cc(-c2ccc(Br)cc2)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819223462	IJ	On-Demand	Anodyne	ACACB	16	41
O=C(c1cc(-c2ccc(Br)cc2)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819223462	IJ	On-Demand	Anodyne	TACR3	15	40
O=C(c1cc(-c2ccc(Br)cc2)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819223462	IJ	On-Demand	Anodyne	MT-CO2	49	42
O=C(c1cc(S(=O)(=O)N2CCOCC2)ccc1F)N1CCC[C@H](CO)CC1	ZINC000819223464	HD	On-Demand	Anodyne	SLC6A9	36	40
O=C(c1cc(S(=O)(=O)N2CCOCC2)ccc1F)N1CCC[C@@H](CO)CC1	ZINC000819223465	HD	On-Demand	Anodyne	SLC6A9	36	40
O=C(c1cccnc1)N1CCC(C(=O)N2CCO[C@H](c3ccc(Cl)cc3)C2)CC1	ZINC000819223473	HG	On-Demand	Anodyne	CCR1	17	41
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC[C@@H](CO)CC3)c2c1	ZINC000819223483	FI	On-Demand	Anodyne	DHODH	15	42
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC[C@@H](CO)CC3)c2c1	ZINC000819223483	FI	On-Demand	Anodyne	PRS	57	37
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC[C@@H](CO)CC3)c2c1	ZINC000819223483	FI	On-Demand	Anodyne	Q8MHZ5_SHEEP	51	32
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC[C@@H](CO)CC3)c2c1	ZINC000819223483	FI	On-Demand	Anodyne	MT-CO2	50	37
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC[C@@H](CO)CC3)c2c1	ZINC000819223483	FI	On-Demand	Anodyne	VCP	37	40
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC[C@H](CO)CC3)c2c1	ZINC000819223484	FI	On-Demand	Anodyne	DHODH	15	42
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC[C@H](CO)CC3)c2c1	ZINC000819223484	FI	On-Demand	Anodyne	PRS	57	37
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC[C@H](CO)CC3)c2c1	ZINC000819223484	FI	On-Demand	Anodyne	Q8MHZ5_SHEEP	51	32
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC[C@H](CO)CC3)c2c1	ZINC000819223484	FI	On-Demand	Anodyne	MT-CO2	50	37
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC[C@H](CO)CC3)c2c1	ZINC000819223484	FI	On-Demand	Anodyne	VCP	37	40
C[C@@](O)(C(=O)N1CCC[C@H](CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000819223494	EF	On-Demand	Anodyne	CACNA1B	57	37
C[C@@](O)(C(=O)N1CCC[C@H](CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000819223494	EF	On-Demand	Anodyne	CCR2	48	40
C[C@@](O)(C(=O)N1CCC[C@@H](CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000819223496	EF	On-Demand	Anodyne	CACNA1B	57	37
C[C@@](O)(C(=O)N1CCC[C@@H](CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000819223496	EF	On-Demand	Anodyne	CCR2	48	40
O=C(COc1ccc2ccc(=O)oc2c1)N1CCO[C@H](c2ccc(Cl)cc2)C1	ZINC000819223498	GG	On-Demand	Anodyne	MAOB	19	42
O=C([C@@H]1CCCN1C(=O)OCC(F)(F)F)N1CCC[C@@H](CO)CC1	ZINC000819223502	FD	On-Demand	Anodyne	PREP	54	48
O=C([C@@H]1CCCN1C(=O)OCC(F)(F)F)N1CCC[C@@H](CO)CC1	ZINC000819223502	FD	On-Demand	Anodyne	SFRP1	41	36
O=C([C@@H]1CCCN1C(=O)OCC(F)(F)F)N1CCC[C@@H](CO)CC1	ZINC000819223502	FD	On-Demand	Anodyne	WNT3	46	36
O=C([C@H]1CCCN1C(=O)OCC(F)(F)F)N1CCC[C@H](CO)CC1	ZINC000819223503	FD	On-Demand	Anodyne	PREP	54	48
O=C([C@H]1CCCN1C(=O)OCC(F)(F)F)N1CCC[C@H](CO)CC1	ZINC000819223503	FD	On-Demand	Anodyne	SFRP1	41	36
O=C([C@H]1CCCN1C(=O)OCC(F)(F)F)N1CCC[C@H](CO)CC1	ZINC000819223503	FD	On-Demand	Anodyne	WNT3	46	36
O=C([C@@H]1CCCN1C(=O)OCC(F)(F)F)N1CCC[C@H](CO)CC1	ZINC000819223504	FD	On-Demand	Anodyne	PREP	54	48
O=C([C@@H]1CCCN1C(=O)OCC(F)(F)F)N1CCC[C@H](CO)CC1	ZINC000819223504	FD	On-Demand	Anodyne	SFRP1	41	36
O=C([C@@H]1CCCN1C(=O)OCC(F)(F)F)N1CCC[C@H](CO)CC1	ZINC000819223504	FD	On-Demand	Anodyne	WNT3	46	36
O[C@H](CNCCCn1ccnn1)c1cccnc1	ZINC000819223505	BC	On-Demand	Anodyne	ADRB2	24	44
O[C@H](CNCCCn1ccnn1)c1cccnc1	ZINC000819223505	BC	On-Demand	Anodyne	ADRB1	25	44
O[C@H](CNCCCn1ccnn1)c1cccnc1	ZINC000819223505	BC	On-Demand	Anodyne	ADRB3	98	47
O[C@@H](CNCCCn1ccnn1)c1cccnc1	ZINC000819223506	BC	On-Demand	Anodyne	ADRB2	24	44
O[C@@H](CNCCCn1ccnn1)c1cccnc1	ZINC000819223506	BC	On-Demand	Anodyne	ADRB1	25	44
O[C@@H](CNCCCn1ccnn1)c1cccnc1	ZINC000819223506	BC	On-Demand	Anodyne	ADRB3	98	47
O=C([C@H]1CCCN1C(=O)OCC(F)(F)F)N1CCC[C@@H](CO)CC1	ZINC000819223507	FD	On-Demand	Anodyne	PREP	54	48
O=C([C@H]1CCCN1C(=O)OCC(F)(F)F)N1CCC[C@@H](CO)CC1	ZINC000819223507	FD	On-Demand	Anodyne	SFRP1	41	36
O=C([C@H]1CCCN1C(=O)OCC(F)(F)F)N1CCC[C@@H](CO)CC1	ZINC000819223507	FD	On-Demand	Anodyne	WNT3	46	36
O=C(C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1)N1CCC[C@@H](CO)CC1	ZINC000819223541	HE	On-Demand	Anodyne	PREP	44	37
O=C(C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1)N1CCC[C@@H](CO)CC1	ZINC000819223541	HE	On-Demand	Anodyne	SFRP1	62	35
O=C(C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1)N1CCC[C@@H](CO)CC1	ZINC000819223541	HE	On-Demand	Anodyne	WNT3	61	33
COc1cccc([S@@](=O)CC(=O)NCc2cccc3c2OCCO3)c1	ZINC000819223544	FD	On-Demand	Anodyne	MTNR1A	56	44
COc1cccc([S@@](=O)CC(=O)NCc2cccc3c2OCCO3)c1	ZINC000819223544	FD	On-Demand	Anodyne	MTNR1B	46	38
O=C(C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1)N1CCC[C@@H](CO)CC1	ZINC000819223545	HE	On-Demand	Anodyne	PREP	44	37
O=C(C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1)N1CCC[C@@H](CO)CC1	ZINC000819223545	HE	On-Demand	Anodyne	SFRP1	62	35
O=C(C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1)N1CCC[C@@H](CO)CC1	ZINC000819223545	HE	On-Demand	Anodyne	WNT3	61	33
O=C(C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1)N1CCC[C@H](CO)CC1	ZINC000819223547	HE	On-Demand	Anodyne	PREP	44	37
O=C(C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1)N1CCC[C@H](CO)CC1	ZINC000819223547	HE	On-Demand	Anodyne	SFRP1	62	35
O=C(C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1)N1CCC[C@H](CO)CC1	ZINC000819223547	HE	On-Demand	Anodyne	WNT3	61	33
O=C(C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1)N1CCC[C@H](CO)CC1	ZINC000819223550	HE	On-Demand	Anodyne	PREP	44	37
O=C(C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1)N1CCC[C@H](CO)CC1	ZINC000819223550	HE	On-Demand	Anodyne	SFRP1	62	35
O=C(C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1)N1CCC[C@H](CO)CC1	ZINC000819223550	HE	On-Demand	Anodyne	WNT3	61	33
CC(C)c1nn(-c2ccccc2)cc1C(=O)NCc1cccc2c1OCCO2	ZINC000819223553	GH	On-Demand	Anodyne	CARM1	48	45
CO[C@@H](C)c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819223573	GH	On-Demand	Mild	PAPA1_CARPA	45	45
CO[C@@H](C)c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819223573	GH	On-Demand	Mild	CTSK	23	44
CO[C@@H](C)c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819223573	GH	On-Demand	Mild	CTSL	15	46
CO[C@@H](C)c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819223573	GH	On-Demand	Mild	CTSS	15	48
CO[C@@H](C)c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819223573	GH	On-Demand	Mild	FPR1	43	38
CO[C@@H](C)c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819223574	GH	On-Demand	Mild	PAPA1_CARPA	45	45
CO[C@@H](C)c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819223574	GH	On-Demand	Mild	CTSK	23	44
CO[C@@H](C)c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819223574	GH	On-Demand	Mild	CTSL	15	46
CO[C@@H](C)c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819223574	GH	On-Demand	Mild	CTSS	15	48
CO[C@@H](C)c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819223574	GH	On-Demand	Mild	FPR1	43	38
CC(C)(C)OC(=O)NC1(CNC[C@H](O)COc2ccccc2)CCC1	ZINC000819223603	FE	On-Demand	Anodyne	ADRB2	56	49
CC(C)(C)OC(=O)NC1(CNC[C@H](O)COc2ccccc2)CCC1	ZINC000819223603	FE	On-Demand	Anodyne	ADRB1	76	44
CC(C)(C)OC(=O)NC1(CNC[C@H](O)COc2ccccc2)CCC1	ZINC000819223603	FE	On-Demand	Anodyne	ADRB3	45	44
CC(C)(C)OC(=O)NC1(CNC[C@H](O)COc2ccccc2)CCC1	ZINC000819223603	FE	On-Demand	Anodyne	CASR	23	42
CC(C)(C)OC(=O)NC1(CNC[C@H](O)COc2ccccc2)CCC1	ZINC000819223603	FE	On-Demand	Anodyne	ABCB1	23	44
CC(C)(C)OC(=O)NC1(CNC[C@H](O)COc2ccccc2)CCC1	ZINC000819223603	FE	On-Demand	Anodyne	PDS	47	36
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)COc2ccccc2)CCC1	ZINC000819223604	FE	On-Demand	Anodyne	ADRB2	56	49
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)COc2ccccc2)CCC1	ZINC000819223604	FE	On-Demand	Anodyne	ADRB1	76	44
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)COc2ccccc2)CCC1	ZINC000819223604	FE	On-Demand	Anodyne	ADRB3	45	44
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)COc2ccccc2)CCC1	ZINC000819223604	FE	On-Demand	Anodyne	CASR	23	42
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)COc2ccccc2)CCC1	ZINC000819223604	FE	On-Demand	Anodyne	ABCB1	23	44
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)COc2ccccc2)CCC1	ZINC000819223604	FE	On-Demand	Anodyne	PDS	47	36
O=C(Cc1ccc(-n2cnnc2)cc1)NCc1nc2c(s1)CCCC2	ZINC000819223612	FE	On-Demand	Anodyne	SLC27A1	40	42
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1ccc(F)c(F)c1	ZINC000819223616	EG	On-Demand	Anodyne	ADRB2	31	41
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1ccc(F)c(F)c1	ZINC000819223616	EG	On-Demand	Anodyne	ADRB1	26	40
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1ccc(F)c(F)c1	ZINC000819223616	EG	On-Demand	Anodyne	ADRB3	41	40
O[C@H](CNCCc1ccc(F)c(F)c1F)c1ccc(F)c(F)c1	ZINC000819223617	EG	On-Demand	Anodyne	ADRB2	31	41
O[C@H](CNCCc1ccc(F)c(F)c1F)c1ccc(F)c(F)c1	ZINC000819223617	EG	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CNCCc1ccc(F)c(F)c1F)c1ccc(F)c(F)c1	ZINC000819223617	EG	On-Demand	Anodyne	ADRB3	41	40
O=C(NC1CCN(C(=O)CC(F)(F)F)CC1)C(F)=C1CCC1	ZINC000819223625	DE	On-Demand	Anodyne	EPHX2	25	50
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1ccc(Br)cc1	ZINC000819223644	FH	On-Demand	Anodyne	ADRB2	17	49
O[C@H](CNCCc1ccc(F)c(F)c1F)c1ccc(Br)cc1	ZINC000819223645	FH	On-Demand	Anodyne	ADRB2	17	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(C(=O)CC(F)(F)F)CC1	ZINC000819223737	GD	On-Demand	Anodyne	EPHX2	23	45
O=C(NCc1ccncc1)Nc1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819223743	FG	On-Demand	Anodyne	ROCK2	25	48
O=C(NCc1ccncc1)Nc1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819223743	FG	On-Demand	Anodyne	NAMPT	48	40
O=C(NCc1nc(-c2ccncc2)cs1)C(F)=C1CCC1	ZINC000819223763	DG	On-Demand	Anodyne	ROCK1	23	42
O=C(NCc1nc(-c2ccncc2)cs1)C(F)=C1CCC1	ZINC000819223763	DG	On-Demand	Anodyne	ROCK2	15	42
O=C(CCc1cccc(OC(F)F)c1)NCc1cccc2c1OCCO2	ZINC000819223764	FG	On-Demand	Anodyne	MTNR1A	18	45
CC(C)(C)OC(=O)NC1(CNC[C@H](O)COc2cccc3[nH]ccc23)CCC1	ZINC000819223816	GF	On-Demand	Anodyne	ADRB2	21	57
CC(C)(C)OC(=O)NC1(CNC[C@H](O)COc2cccc3[nH]ccc23)CCC1	ZINC000819223816	GF	On-Demand	Anodyne	ADRB1	43	57
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)COc2cccc3[nH]ccc23)CCC1	ZINC000819223817	GF	On-Demand	Anodyne	ADRB2	21	57
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)COc2cccc3[nH]ccc23)CCC1	ZINC000819223817	GF	On-Demand	Anodyne	ADRB1	43	57
Cc1ccc(OC[C@@H](O)CNCC2(NC(=O)OC(C)(C)C)CCC2)cc1	ZINC000819223839	FF	On-Demand	Anodyne	ADRB2	40	50
Cc1ccc(OC[C@@H](O)CNCC2(NC(=O)OC(C)(C)C)CCC2)cc1	ZINC000819223839	FF	On-Demand	Anodyne	ADRB1	54	42
Cc1ccc(OC[C@H](O)CNCC2(NC(=O)OC(C)(C)C)CCC2)cc1	ZINC000819223840	FF	On-Demand	Anodyne	ADRB2	40	50
Cc1ccc(OC[C@H](O)CNCC2(NC(=O)OC(C)(C)C)CCC2)cc1	ZINC000819223840	FF	On-Demand	Anodyne	ADRB1	54	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCn2ccnn2)CC1	ZINC000819223858	FD	On-Demand	Anodyne	GPR119	36	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCn2ccnn2)CC1	ZINC000819223859	FD	On-Demand	Anodyne	GPR119	36	40
CC(C)(C)OC(=O)NC1(CNC[C@H](O)COc2ccc(C#N)cc2)CCC1	ZINC000819223870	GE	On-Demand	Mild	ADRB1	53	35
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)COc2ccc(C#N)cc2)CCC1	ZINC000819223871	GE	On-Demand	Mild	ADRB1	53	35
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1ccc(Cl)c(F)c1	ZINC000819223872	EH	On-Demand	Anodyne	ADRB2	27	43
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1ccc(Cl)c(F)c1	ZINC000819223872	EH	On-Demand	Anodyne	ADRB1	24	42
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1ccc(Cl)c(F)c1	ZINC000819223872	EH	On-Demand	Anodyne	ADRB3	30	43
O[C@H](CNCCc1ccc(F)c(F)c1F)c1ccc(Cl)c(F)c1	ZINC000819223873	EH	On-Demand	Anodyne	ADRB2	27	43
O[C@H](CNCCc1ccc(F)c(F)c1F)c1ccc(Cl)c(F)c1	ZINC000819223873	EH	On-Demand	Anodyne	ADRB1	24	42
O[C@H](CNCCc1ccc(F)c(F)c1F)c1ccc(Cl)c(F)c1	ZINC000819223873	EH	On-Demand	Anodyne	ADRB3	30	43
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(Cl)ccn1	ZINC000819223902	CE	On-Demand	Anodyne	TYK2	51	35
O=C(/C=C/[C@H]1CCCO1)Nc1cc(Cl)ccn1	ZINC000819223903	CE	On-Demand	Anodyne	TYK2	51	35
O=C(/C=C\[C@H]1CCCO1)Nc1cc(Cl)ccn1	ZINC000819223904	CE	On-Demand	Anodyne	TYK2	51	35
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(Cl)ccn1	ZINC000819223905	CE	On-Demand	Anodyne	TYK2	51	35
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(F)c(F)c2F)cc1	ZINC000819223913	FE	On-Demand	Anodyne	ADRB2	33	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(F)c(F)c2F)cc1	ZINC000819223913	FE	On-Demand	Anodyne	ADRB3	77	39
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(F)c(F)c2F)cc1	ZINC000819223914	FE	On-Demand	Anodyne	ADRB2	33	43
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(F)c(F)c2F)cc1	ZINC000819223914	FE	On-Demand	Anodyne	ADRB3	77	39
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1cccc(F)c1	ZINC000819223928	DG	On-Demand	Anodyne	ADRB2	34	41
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1cccc(F)c1	ZINC000819223928	DG	On-Demand	Anodyne	ADRB1	37	45
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1cccc(F)c1	ZINC000819223928	DG	On-Demand	Anodyne	ADRB3	65	46
O[C@H](CNCCc1ccc(F)c(F)c1F)c1cccc(F)c1	ZINC000819223929	DG	On-Demand	Anodyne	ADRB2	34	41
O[C@H](CNCCc1ccc(F)c(F)c1F)c1cccc(F)c1	ZINC000819223929	DG	On-Demand	Anodyne	ADRB1	37	45
O[C@H](CNCCc1ccc(F)c(F)c1F)c1cccc(F)c1	ZINC000819223929	DG	On-Demand	Anodyne	ADRB3	65	46
COc1ccc(OC)c([C@H](O)CNCCc2ccc(F)c(F)c2F)c1	ZINC000819223942	FF	On-Demand	Anodyne	ADRB2	24	51
CC(C)(C)OC(=O)NC1(CNC[C@H](O)COc2ccccc2F)CCC1	ZINC000819223946	FF	On-Demand	Anodyne	ADRB2	25	41
CC(C)(C)OC(=O)NC1(CNC[C@H](O)COc2ccccc2F)CCC1	ZINC000819223946	FF	On-Demand	Anodyne	ADRB1	62	40
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)COc2ccccc2F)CCC1	ZINC000819223947	FF	On-Demand	Anodyne	ADRB2	25	41
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)COc2ccccc2F)CCC1	ZINC000819223947	FF	On-Demand	Anodyne	ADRB1	62	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cc(F)ccc1N1CCCCC1)C2	ZINC000819223957	GH	On-Demand	Anodyne	KCNQ2	49	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cc(F)ccc1N1CCCCC1)C2	ZINC000819223958	GH	On-Demand	Anodyne	KCNQ2	49	37
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccc(F)cc2F)CC1	ZINC000819223970	FD	On-Demand	Anodyne	PARP1	34	40
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(F)cc2F)CC1	ZINC000819223971	FD	On-Demand	Anodyne	PARP1	34	40
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccc(F)cc2F)CC1	ZINC000819223972	FD	On-Demand	Anodyne	PARP1	34	40
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(F)cc2F)CC1	ZINC000819223973	FD	On-Demand	Anodyne	PARP1	34	40
O=C(/C=C/c1ccc(O)cc1)Nc1ccccc1SCC(F)(F)F	ZINC000819223982	FJ	On-Demand	Anodyne	MMP2	17	60
O=C(/C=C/c1ccc(O)cc1)Nc1ccccc1SCC(F)(F)F	ZINC000819223982	FJ	On-Demand	Anodyne	MMP9	17	60
O=C(/C=C\c1ccc(O)cc1)Nc1ccccc1SCC(F)(F)F	ZINC000819223983	FJ	On-Demand	Anodyne	MMP2	17	60
O=C(/C=C\c1ccc(O)cc1)Nc1ccccc1SCC(F)(F)F	ZINC000819223983	FJ	On-Demand	Anodyne	MMP9	17	60
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)CCCN1c1cccnc1	ZINC000819223987	FF	On-Demand	Anodyne	P2RX7	18	44
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)CCCN1c1cccnc1	ZINC000819223988	FF	On-Demand	Anodyne	P2RX7	18	44
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)CCCN1c1cccnc1	ZINC000819223989	FF	On-Demand	Anodyne	P2RX7	18	44
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2Cl)CCCN1c1cccnc1	ZINC000819223990	FF	On-Demand	Anodyne	P2RX7	18	44
CC(C)(C)OC(=O)NC1(CNC[C@H](O)c2cccc(Cl)c2)CCC1	ZINC000819224002	FG	On-Demand	Anodyne	ADRB1	35	43
CC(C)(C)OC(=O)NC1(CNC[C@H](O)c2cccc(Cl)c2)CCC1	ZINC000819224002	FG	On-Demand	Anodyne	ADRB3	56	43
CC(C)(C)OC(=O)NC1(CNC[C@H](O)c2cccc(Cl)c2)CCC1	ZINC000819224002	FG	On-Demand	Anodyne	CYP3A4	45	35
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819224003	FG	On-Demand	Anodyne	ADRB1	35	43
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819224003	FG	On-Demand	Anodyne	ADRB3	56	43
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819224003	FG	On-Demand	Anodyne	CYP3A4	45	35
O[C@H](CNCCc1ccc(F)c(F)c1F)c1cccnc1	ZINC000819224019	CE	On-Demand	Anodyne	ADRB2	39	48
O[C@H](CNCCc1ccc(F)c(F)c1F)c1cccnc1	ZINC000819224019	CE	On-Demand	Anodyne	ADRB1	47	54
O[C@H](CNCCc1ccc(F)c(F)c1F)c1cccnc1	ZINC000819224019	CE	On-Demand	Anodyne	ADRB3	133	54
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1cccnc1	ZINC000819224020	CE	On-Demand	Anodyne	ADRB2	39	48
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1cccnc1	ZINC000819224020	CE	On-Demand	Anodyne	ADRB1	47	54
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1cccnc1	ZINC000819224020	CE	On-Demand	Anodyne	ADRB3	133	54
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1cccc(Cl)c1	ZINC000819224035	EH	On-Demand	Anodyne	ADRB2	59	43
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1cccc(Cl)c1	ZINC000819224035	EH	On-Demand	Anodyne	ADRB1	67	57
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1cccc(Cl)c1	ZINC000819224035	EH	On-Demand	Anodyne	ADRB3	91	60
O[C@H](CNCCc1ccc(F)c(F)c1F)c1cccc(Cl)c1	ZINC000819224036	EH	On-Demand	Anodyne	ADRB2	59	43
O[C@H](CNCCc1ccc(F)c(F)c1F)c1cccc(Cl)c1	ZINC000819224036	EH	On-Demand	Anodyne	ADRB1	67	57
O[C@H](CNCCc1ccc(F)c(F)c1F)c1cccc(Cl)c1	ZINC000819224036	EH	On-Demand	Anodyne	ADRB3	91	60
CC(C)(C)OC(=O)NC1(CNC[C@H](O)COc2ccc(F)cc2)CCC1	ZINC000819224039	FF	On-Demand	Anodyne	ADRB2	43	40
CC(C)(C)OC(=O)NC1(CNC[C@H](O)COc2ccc(F)cc2)CCC1	ZINC000819224039	FF	On-Demand	Anodyne	ADRB1	62	41
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)COc2ccc(F)cc2)CCC1	ZINC000819224040	FF	On-Demand	Anodyne	ADRB2	43	40
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)COc2ccc(F)cc2)CCC1	ZINC000819224040	FF	On-Demand	Anodyne	ADRB1	62	41
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCCN1c1cccnc1	ZINC000819224042	DD	On-Demand	Anodyne	ADRB3	42	43
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCCN1c1cccnc1	ZINC000819224043	DD	On-Demand	Anodyne	ADRB3	42	43
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCCN1c1cccnc1	ZINC000819224044	DD	On-Demand	Anodyne	ADRB3	42	43
O=C1[C@H](NC[C@H](O)c2ccccc2)CCCN1c1cccnc1	ZINC000819224045	DD	On-Demand	Anodyne	ADRB3	42	43
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)CCc2ccccc2)CCC1	ZINC000819224058	EG	On-Demand	Anodyne	PGC	46	33
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)CCc2ccccc2)CCC1	ZINC000819224058	EG	On-Demand	Anodyne	PAPA1_CARPA	29	40
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)CCc2ccccc2)CCC1	ZINC000819224058	EG	On-Demand	Anodyne	CTSK	15	50
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)CCc2ccccc2)CCC1	ZINC000819224058	EG	On-Demand	Anodyne	REN	42	36
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)CCc2ccccc2)CCC1	ZINC000819224058	EG	On-Demand	Anodyne	FPR1	45	36
CC(C)(C)OC(=O)NC1(CNC[C@H](O)CCc2ccccc2)CCC1	ZINC000819224059	EG	On-Demand	Anodyne	PGC	46	33
CC(C)(C)OC(=O)NC1(CNC[C@H](O)CCc2ccccc2)CCC1	ZINC000819224059	EG	On-Demand	Anodyne	PAPA1_CARPA	29	40
CC(C)(C)OC(=O)NC1(CNC[C@H](O)CCc2ccccc2)CCC1	ZINC000819224059	EG	On-Demand	Anodyne	CTSK	15	50
CC(C)(C)OC(=O)NC1(CNC[C@H](O)CCc2ccccc2)CCC1	ZINC000819224059	EG	On-Demand	Anodyne	REN	42	36
CC(C)(C)OC(=O)NC1(CNC[C@H](O)CCc2ccccc2)CCC1	ZINC000819224059	EG	On-Demand	Anodyne	FPR1	45	36
CC(C)(C)OC(=O)NC1(CNC[C@H](O)COc2ccccc2Cl)CCC1	ZINC000819224066	GG	On-Demand	Anodyne	ADRB2	26	49
CC(C)(C)OC(=O)NC1(CNC[C@H](O)COc2ccccc2Cl)CCC1	ZINC000819224066	GG	On-Demand	Anodyne	ADRB1	59	36
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)COc2ccccc2Cl)CCC1	ZINC000819224067	GG	On-Demand	Anodyne	ADRB2	26	49
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)COc2ccccc2Cl)CCC1	ZINC000819224067	GG	On-Demand	Anodyne	ADRB1	59	36
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1ccccc1F	ZINC000819224091	DG	On-Demand	Anodyne	ADRB2	21	42
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1ccccc1F	ZINC000819224091	DG	On-Demand	Anodyne	ADRB1	18	42
O[C@H](CNCCc1ccc(F)c(F)c1F)c1ccccc1F	ZINC000819224092	DG	On-Demand	Anodyne	ADRB2	21	42
O[C@H](CNCCc1ccc(F)c(F)c1F)c1ccccc1F	ZINC000819224092	DG	On-Demand	Anodyne	ADRB1	18	42
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(F)ccc1N1CCCCC1	ZINC000819224102	DG	On-Demand	Anodyne	KCNQ2	41	38
O=C(/C=C/[C@H]1CCCO1)Nc1cc(F)ccc1N1CCCCC1	ZINC000819224103	DG	On-Demand	Anodyne	KCNQ2	41	38
O=C(/C=C\[C@H]1CCCO1)Nc1cc(F)ccc1N1CCCCC1	ZINC000819224104	DG	On-Demand	Anodyne	KCNQ2	41	38
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(F)ccc1N1CCCCC1	ZINC000819224105	DG	On-Demand	Anodyne	KCNQ2	41	38
CC(=O)Nc1cccc(CC(=O)NCc2cccc3c2OCCO3)c1	ZINC000819224123	EE	On-Demand	Anodyne	PTGIR	15	40
CC(=O)Nc1cccc(CC(=O)NCc2cccc3c2OCCO3)c1	ZINC000819224123	EE	On-Demand	Anodyne	MTNR1A	26	55
CC(=O)Nc1cccc(CC(=O)NCc2cccc3c2OCCO3)c1	ZINC000819224123	EE	On-Demand	Anodyne	MTNR1B	18	42
C=CCC1(C(=O)Oc2ccc(NC(=O)c3ccc(C)cc3)cc2)CCOCC1	ZINC000819224128	GJ	On-Demand	Mild	PRNP	42	35
C=CCC1(C(=O)Oc2ccc(NC(=O)c3ccc(C)cc3)cc2)CCOCC1	ZINC000819224128	GJ	On-Demand	Mild	ACR	38	41
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1cccc(Br)c1	ZINC000819224129	FH	On-Demand	Anodyne	ADRB2	28	43
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1cccc(Br)c1	ZINC000819224129	FH	On-Demand	Anodyne	ADRB1	32	44
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1cccc(Br)c1	ZINC000819224129	FH	On-Demand	Anodyne	ADRB3	53	45
O[C@H](CNCCc1ccc(F)c(F)c1F)c1cccc(Br)c1	ZINC000819224130	FH	On-Demand	Anodyne	ADRB2	28	43
O[C@H](CNCCc1ccc(F)c(F)c1F)c1cccc(Br)c1	ZINC000819224130	FH	On-Demand	Anodyne	ADRB1	32	44
O[C@H](CNCCc1ccc(F)c(F)c1F)c1cccc(Br)c1	ZINC000819224130	FH	On-Demand	Anodyne	ADRB3	53	45
O=C(/C=C/[C@@H]1CCCO1)NCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000819224147	GF	On-Demand	Anodyne	ROCK2	17	43
O=C(/C=C\[C@H]1CCCO1)NCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000819224148	GF	On-Demand	Anodyne	ROCK2	17	43
O=C(/C=C/[C@H]1CCCO1)NCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000819224149	GF	On-Demand	Anodyne	ROCK2	17	43
O=C(/C=C\[C@@H]1CCCO1)NCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000819224150	GF	On-Demand	Anodyne	ROCK2	17	43
O=C1[C@H](NC[C@H](O)c2cccnc2)CCCN1c1cccnc1	ZINC000819224151	DD	On-Demand	Anodyne	ADRB2	15	41
O=C1[C@H](NC[C@H](O)c2cccnc2)CCCN1c1cccnc1	ZINC000819224151	DD	On-Demand	Anodyne	ADRB1	18	40
O=C1[C@H](NC[C@H](O)c2cccnc2)CCCN1c1cccnc1	ZINC000819224151	DD	On-Demand	Anodyne	ADRB3	70	48
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCCN1c1cccnc1	ZINC000819224152	DD	On-Demand	Anodyne	ADRB2	15	41
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCCN1c1cccnc1	ZINC000819224152	DD	On-Demand	Anodyne	ADRB1	18	40
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCCN1c1cccnc1	ZINC000819224152	DD	On-Demand	Anodyne	ADRB3	70	48
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCCN1c1cccnc1	ZINC000819224153	DD	On-Demand	Anodyne	ADRB2	15	41
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCCN1c1cccnc1	ZINC000819224153	DD	On-Demand	Anodyne	ADRB1	18	40
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCCN1c1cccnc1	ZINC000819224153	DD	On-Demand	Anodyne	ADRB3	70	48
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCCN1c1cccnc1	ZINC000819224154	DD	On-Demand	Anodyne	ADRB2	15	41
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCCN1c1cccnc1	ZINC000819224154	DD	On-Demand	Anodyne	ADRB1	18	40
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCCN1c1cccnc1	ZINC000819224154	DD	On-Demand	Anodyne	ADRB3	70	48
CC(C)(C)OC(=O)NC1(CNC[C@H](O)COc2ccc(Cl)cc2)CCC1	ZINC000819224157	GG	On-Demand	Anodyne	ADRB2	35	40
CC(C)(C)OC(=O)NC1(CNC[C@H](O)COc2ccc(Cl)cc2)CCC1	ZINC000819224157	GG	On-Demand	Anodyne	ADRB1	54	41
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)COc2ccc(Cl)cc2)CCC1	ZINC000819224158	GG	On-Demand	Anodyne	ADRB2	35	40
CC(C)(C)OC(=O)NC1(CNC[C@@H](O)COc2ccc(Cl)cc2)CCC1	ZINC000819224158	GG	On-Demand	Anodyne	ADRB1	54	41
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1ccc(F)cc1	ZINC000819224174	DG	On-Demand	Anodyne	ADRB2	23	47
O[C@H](CNCCc1ccc(F)c(F)c1F)c1ccc(F)cc1	ZINC000819224175	DG	On-Demand	Anodyne	ADRB2	23	47
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1ccccc1	ZINC000819224200	CF	On-Demand	Anodyne	ADRB2	39	52
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1ccccc1	ZINC000819224200	CF	On-Demand	Anodyne	ADRB1	49	43
O[C@@H](CNCCc1ccc(F)c(F)c1F)c1ccccc1	ZINC000819224200	CF	On-Demand	Anodyne	ADRB3	85	44
O[C@H](CNCCc1ccc(F)c(F)c1F)c1ccccc1	ZINC000819224201	CF	On-Demand	Anodyne	ADRB2	39	52
O[C@H](CNCCc1ccc(F)c(F)c1F)c1ccccc1	ZINC000819224201	CF	On-Demand	Anodyne	ADRB1	49	43
O[C@H](CNCCc1ccc(F)c(F)c1F)c1ccccc1	ZINC000819224201	CF	On-Demand	Anodyne	ADRB3	85	44
O[C@@H](CN[C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)c1ccccc1	ZINC000819224204	FH	On-Demand	Anodyne	SLC6A3	16	45
O[C@@H](CN[C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@H]21)c1ccccc1	ZINC000819224205	FH	On-Demand	Anodyne	SLC6A3	16	45
O[C@@H](CN[C@@H]1CCC[C@H]2CN(Cc3ccccc3)C[C@@H]21)c1ccccc1	ZINC000819224206	FH	On-Demand	Anodyne	SLC6A3	16	45
O[C@@H](CN[C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21)c1ccccc1	ZINC000819224207	FH	On-Demand	Anodyne	SLC6A3	16	45
CCOC(=O)N(C)C1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819224233	FD	On-Demand	Anodyne	KCNJ1	56	41
CC(C)(C)OC(=O)NC/C=C\CNCCC(=O)Nc1cccc(F)c1	ZINC000819224245	FF	On-Demand	Anodyne	PAPA1_CARPA	16	41
CC(C)(C)OC(=O)NC/C=C\CNCCC(=O)Nc1cccc(F)c1	ZINC000819224245	FF	On-Demand	Anodyne	HDAC10	19	40
CC(C)(C)OC(=O)NC/C=C/CNCCC(=O)Nc1cccc(F)c1	ZINC000819224246	FF	On-Demand	Anodyne	PAPA1_CARPA	16	41
CC(C)(C)OC(=O)NC/C=C/CNCCC(=O)Nc1cccc(F)c1	ZINC000819224246	FF	On-Demand	Anodyne	HDAC10	19	40
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819224247	FG	On-Demand	Anodyne	CTSD	15	40
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819224247	FG	On-Demand	Anodyne	PGC	49	32
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819224247	FG	On-Demand	Anodyne	SLC12A5	51	35
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@H](O)Cc2ccccc2)C1	ZINC000819224248	FG	On-Demand	Anodyne	CTSD	15	40
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@H](O)Cc2ccccc2)C1	ZINC000819224248	FG	On-Demand	Anodyne	PGC	49	32
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@H](O)Cc2ccccc2)C1	ZINC000819224248	FG	On-Demand	Anodyne	SLC12A5	51	35
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819224249	FG	On-Demand	Anodyne	CTSD	15	40
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819224249	FG	On-Demand	Anodyne	PGC	49	32
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819224249	FG	On-Demand	Anodyne	SLC12A5	51	35
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@H](O)Cc2ccccc2)C1	ZINC000819224250	FG	On-Demand	Anodyne	CTSD	15	40
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@H](O)Cc2ccccc2)C1	ZINC000819224250	FG	On-Demand	Anodyne	PGC	49	32
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@H](O)Cc2ccccc2)C1	ZINC000819224250	FG	On-Demand	Anodyne	SLC12A5	51	35
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1c(F)cccc1F	ZINC000819224260	EF	On-Demand	Anodyne	PAPA1_CARPA	28	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1c(F)cccc1F	ZINC000819224261	EF	On-Demand	Anodyne	PAPA1_CARPA	28	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1c(F)cccc1F	ZINC000819224262	EF	On-Demand	Anodyne	PAPA1_CARPA	28	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1c(F)cccc1F	ZINC000819224263	EF	On-Demand	Anodyne	PAPA1_CARPA	28	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)CN1C(=O)c2ccccc2C1=O	ZINC000819224264	GD	On-Demand	Anodyne	PAPA1_CARPA	26	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)CN1C(=O)c2ccccc2C1=O	ZINC000819224265	GD	On-Demand	Anodyne	PAPA1_CARPA	26	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)CN1C(=O)c2ccccc2C1=O	ZINC000819224266	GD	On-Demand	Anodyne	PAPA1_CARPA	26	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)CN1C(=O)c2ccccc2C1=O	ZINC000819224267	GD	On-Demand	Anodyne	PAPA1_CARPA	26	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCCN(c3cccnc3)C2=O)cc1	ZINC000819224279	GD	On-Demand	Anodyne	ADRB3	52	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCCN(c3cccnc3)C2=O)cc1	ZINC000819224280	GD	On-Demand	Anodyne	ADRB3	52	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCCN(c3cccnc3)C2=O)cc1	ZINC000819224281	GD	On-Demand	Anodyne	ADRB3	52	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCCN(c3cccnc3)C2=O)cc1	ZINC000819224282	GD	On-Demand	Anodyne	ADRB3	52	40
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819224287	GI	On-Demand	Anodyne	CCR1	41	35
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819224288	GI	On-Demand	Anodyne	CCR1	41	35
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000819224289	GI	On-Demand	Anodyne	CCR1	41	35
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000819224290	GI	On-Demand	Anodyne	CCR1	41	35
Cc1ccc(OC[C@@H](O)CNC[C@]2(C)CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819224295	GG	On-Demand	Anodyne	ADRB2	20	44
Cc1ccc(OC[C@H](O)CNC[C@]2(C)CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819224296	GG	On-Demand	Anodyne	ADRB2	20	44
Cc1ccc(OC[C@@H](O)CNC[C@@]2(C)CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819224297	GG	On-Demand	Anodyne	ADRB2	20	44
Cc1ccc(OC[C@H](O)CNC[C@@]2(C)CCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819224298	GG	On-Demand	Anodyne	ADRB2	20	44
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1c1cccnc1	ZINC000819224305	EF	On-Demand	Anodyne	ADRB1	30	40
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1c1cccnc1	ZINC000819224305	EF	On-Demand	Anodyne	ADRB3	63	40
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1c1cccnc1	ZINC000819224305	EF	On-Demand	Anodyne	CYP3A4	49	37
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1c1cccnc1	ZINC000819224306	EF	On-Demand	Anodyne	ADRB1	30	40
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1c1cccnc1	ZINC000819224306	EF	On-Demand	Anodyne	ADRB3	63	40
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1c1cccnc1	ZINC000819224306	EF	On-Demand	Anodyne	CYP3A4	49	37
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1c1cccnc1	ZINC000819224307	EF	On-Demand	Anodyne	ADRB1	30	40
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1c1cccnc1	ZINC000819224307	EF	On-Demand	Anodyne	ADRB3	63	40
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1c1cccnc1	ZINC000819224307	EF	On-Demand	Anodyne	CYP3A4	49	37
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1c1cccnc1	ZINC000819224308	EF	On-Demand	Anodyne	ADRB1	30	40
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1c1cccnc1	ZINC000819224308	EF	On-Demand	Anodyne	ADRB3	63	40
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1c1cccnc1	ZINC000819224308	EF	On-Demand	Anodyne	CYP3A4	49	37
C#CCOCCNC[C@@H](O)c1cccnc1	ZINC000819224326	BC	On-Demand	Mild	ADRB2	28	52
C#CCOCCNC[C@@H](O)c1cccnc1	ZINC000819224326	BC	On-Demand	Mild	ADRB1	34	52
C#CCOCCNC[C@@H](O)c1cccnc1	ZINC000819224326	BC	On-Demand	Mild	ADRB3	105	54
C#CCOCCNC[C@H](O)c1cccnc1	ZINC000819224327	BC	On-Demand	Mild	ADRB2	28	52
C#CCOCCNC[C@H](O)c1cccnc1	ZINC000819224327	BC	On-Demand	Mild	ADRB1	34	52
C#CCOCCNC[C@H](O)c1cccnc1	ZINC000819224327	BC	On-Demand	Mild	ADRB3	105	54
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1ccc(Br)cc1	ZINC000819224328	GG	On-Demand	Anodyne	PAPA1_CARPA	25	42
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1ccc(Br)cc1	ZINC000819224329	GG	On-Demand	Anodyne	PAPA1_CARPA	25	42
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccc(Br)cc1	ZINC000819224330	GG	On-Demand	Anodyne	PAPA1_CARPA	25	42
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccc(Br)cc1	ZINC000819224331	GG	On-Demand	Anodyne	PAPA1_CARPA	25	42
CC[C@@H](O)CNC/C=C\CNC(=O)OC(C)(C)C	ZINC000819224350	CD	On-Demand	Anodyne	CTSK	15	45
CC[C@H](O)CNC/C=C/CNC(=O)OC(C)(C)C	ZINC000819224351	CD	On-Demand	Anodyne	CTSK	15	45
CC[C@@H](O)CNC/C=C/CNC(=O)OC(C)(C)C	ZINC000819224352	CD	On-Demand	Anodyne	CTSK	15	45
CC[C@H](O)CNC/C=C\CNC(=O)OC(C)(C)C	ZINC000819224353	CD	On-Demand	Anodyne	CTSK	15	45
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819224355	FE	On-Demand	Bother	CACNA1D	45	32
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819224356	FE	On-Demand	Bother	CACNA1D	45	32
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819224357	FE	On-Demand	Bother	CACNA1D	45	32
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819224358	FE	On-Demand	Bother	CACNA1D	45	32
CC(C)(C)OC(=O)NC/C=C\CNCCC(=O)Nc1cccc(Cl)c1	ZINC000819224439	FG	On-Demand	Anodyne	HDAC10	20	42
CC(C)(C)OC(=O)NC/C=C\CNCCC(=O)Nc1cccc(Cl)c1	ZINC000819224439	FG	On-Demand	Anodyne	HDAC6	16	42
CC(C)(C)OC(=O)NC/C=C/CNCCC(=O)Nc1cccc(Cl)c1	ZINC000819224440	FG	On-Demand	Anodyne	HDAC10	20	42
CC(C)(C)OC(=O)NC/C=C/CNCCC(=O)Nc1cccc(Cl)c1	ZINC000819224440	FG	On-Demand	Anodyne	HDAC6	16	42
O=C1[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCCN1c1cccnc1	ZINC000819224447	FD	On-Demand	Bother	C3AR1	18	44
O=C1[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCCN1c1cccnc1	ZINC000819224448	FD	On-Demand	Bother	C3AR1	18	44
O=C1[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)CCCN1c1cccnc1	ZINC000819224449	FD	On-Demand	Bother	C3AR1	18	44
O=C1[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)CCCN1c1cccnc1	ZINC000819224450	FD	On-Demand	Bother	C3AR1	18	44
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819224451	GG	On-Demand	Bother	CACNA1D	43	32
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819224452	GG	On-Demand	Bother	CACNA1D	43	32
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819224453	GG	On-Demand	Bother	CACNA1D	43	32
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819224454	GG	On-Demand	Bother	CACNA1D	43	32
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@@H](O)c2cccnc2)C1	ZINC000819224455	EF	On-Demand	Anodyne	ADRB3	76	40
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@H](O)c2cccnc2)C1	ZINC000819224456	EF	On-Demand	Anodyne	ADRB3	76	40
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@H](O)c2cccnc2)C1	ZINC000819224457	EF	On-Demand	Anodyne	ADRB3	76	40
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@@H](O)c2cccnc2)C1	ZINC000819224458	EF	On-Demand	Anodyne	ADRB3	76	40
Cc1ccccc1[C@@H](O)CNC/C=C\CNC(=O)OC(C)(C)C	ZINC000819224468	DF	On-Demand	Anodyne	PAPA1_CARPA	29	45
Cc1ccccc1[C@@H](O)CNC/C=C\CNC(=O)OC(C)(C)C	ZINC000819224468	DF	On-Demand	Anodyne	FPR1	44	38
Cc1ccccc1[C@@H](O)CNC/C=C/CNC(=O)OC(C)(C)C	ZINC000819224469	DF	On-Demand	Anodyne	PAPA1_CARPA	29	45
Cc1ccccc1[C@@H](O)CNC/C=C/CNC(=O)OC(C)(C)C	ZINC000819224469	DF	On-Demand	Anodyne	FPR1	44	38
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccccc1	ZINC000819224477	DE	On-Demand	Anodyne	ADRB2	25	43
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccccc1	ZINC000819224477	DE	On-Demand	Anodyne	ADRB1	43	42
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccccc1	ZINC000819224477	DE	On-Demand	Anodyne	ADRB3	73	49
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccccc1	ZINC000819224477	DE	On-Demand	Anodyne	PAPA1_CARPA	32	47
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccccc1	ZINC000819224477	DE	On-Demand	Anodyne	CTSK	15	50
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccccc1	ZINC000819224477	DE	On-Demand	Anodyne	FPR1	47	38
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccccc1	ZINC000819224478	DE	On-Demand	Anodyne	ADRB2	25	43
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccccc1	ZINC000819224478	DE	On-Demand	Anodyne	ADRB1	43	42
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccccc1	ZINC000819224478	DE	On-Demand	Anodyne	ADRB3	73	49
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccccc1	ZINC000819224478	DE	On-Demand	Anodyne	PAPA1_CARPA	32	47
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccccc1	ZINC000819224478	DE	On-Demand	Anodyne	CTSK	15	50
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccccc1	ZINC000819224478	DE	On-Demand	Anodyne	FPR1	47	38
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1ccccc1	ZINC000819224479	DE	On-Demand	Anodyne	ADRB2	25	43
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1ccccc1	ZINC000819224479	DE	On-Demand	Anodyne	ADRB1	43	42
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1ccccc1	ZINC000819224479	DE	On-Demand	Anodyne	ADRB3	73	49
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1ccccc1	ZINC000819224479	DE	On-Demand	Anodyne	PAPA1_CARPA	32	47
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1ccccc1	ZINC000819224479	DE	On-Demand	Anodyne	CTSK	15	50
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1ccccc1	ZINC000819224479	DE	On-Demand	Anodyne	FPR1	47	38
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1ccccc1	ZINC000819224480	DE	On-Demand	Anodyne	ADRB2	25	43
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1ccccc1	ZINC000819224480	DE	On-Demand	Anodyne	ADRB1	43	42
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1ccccc1	ZINC000819224480	DE	On-Demand	Anodyne	ADRB3	73	49
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1ccccc1	ZINC000819224480	DE	On-Demand	Anodyne	PAPA1_CARPA	32	47
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1ccccc1	ZINC000819224480	DE	On-Demand	Anodyne	CTSK	15	50
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1ccccc1	ZINC000819224480	DE	On-Demand	Anodyne	FPR1	47	38
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819224491	FG	On-Demand	Anodyne	PAPA1_CARPA	28	43
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819224491	FG	On-Demand	Anodyne	FPR1	40	34
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819224492	FG	On-Demand	Anodyne	PAPA1_CARPA	28	43
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819224492	FG	On-Demand	Anodyne	FPR1	40	34
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819224493	FG	On-Demand	Anodyne	PAPA1_CARPA	28	43
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819224493	FG	On-Demand	Anodyne	FPR1	40	34
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819224494	FG	On-Demand	Anodyne	PAPA1_CARPA	28	43
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819224494	FG	On-Demand	Anodyne	FPR1	40	34
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccccc1	ZINC000819224509	DE	On-Demand	Anodyne	MME	66	37
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccccc1	ZINC000819224509	DE	On-Demand	Anodyne	CTSD	19	41
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccccc1	ZINC000819224509	DE	On-Demand	Anodyne	PGC	53	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccccc1	ZINC000819224509	DE	On-Demand	Anodyne	CTSB	24	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccccc1	ZINC000819224509	DE	On-Demand	Anodyne	PAPA1_CARPA	54	56
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccccc1	ZINC000819224509	DE	On-Demand	Anodyne	CCKAR	40	36
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccccc1	ZINC000819224509	DE	On-Demand	Anodyne	CTSK	22	56
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccccc1	ZINC000819224509	DE	On-Demand	Anodyne	CTSL	21	56
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccccc1	ZINC000819224509	DE	On-Demand	Anodyne	PGA	27	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccccc1	ZINC000819224509	DE	On-Demand	Anodyne	TACR3	18	43
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccccc1	ZINC000819224509	DE	On-Demand	Anodyne	REN	64	43
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccccc1	ZINC000819224509	DE	On-Demand	Anodyne	REN1	15	41
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccccc1	ZINC000819224509	DE	On-Demand	Anodyne	CAPN1	59	43
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccccc1	ZINC000819224509	DE	On-Demand	Anodyne	CAPN2	45	31
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccccc1	ZINC000819224509	DE	On-Demand	Anodyne	FPR1	65	44
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccccc1	ZINC000819224509	DE	On-Demand	Anodyne	PDS	43	31
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccccc1	ZINC000819224510	DE	On-Demand	Anodyne	MME	66	37
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccccc1	ZINC000819224510	DE	On-Demand	Anodyne	CTSD	19	41
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccccc1	ZINC000819224510	DE	On-Demand	Anodyne	PGC	53	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccccc1	ZINC000819224510	DE	On-Demand	Anodyne	CTSB	24	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccccc1	ZINC000819224510	DE	On-Demand	Anodyne	PAPA1_CARPA	54	56
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccccc1	ZINC000819224510	DE	On-Demand	Anodyne	CCKAR	40	36
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccccc1	ZINC000819224510	DE	On-Demand	Anodyne	CTSK	22	56
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccccc1	ZINC000819224510	DE	On-Demand	Anodyne	CTSL	21	56
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccccc1	ZINC000819224510	DE	On-Demand	Anodyne	PGA	27	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccccc1	ZINC000819224510	DE	On-Demand	Anodyne	TACR3	18	43
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccccc1	ZINC000819224510	DE	On-Demand	Anodyne	REN	64	43
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccccc1	ZINC000819224510	DE	On-Demand	Anodyne	REN1	15	41
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccccc1	ZINC000819224510	DE	On-Demand	Anodyne	CAPN1	59	43
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccccc1	ZINC000819224510	DE	On-Demand	Anodyne	CAPN2	45	31
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccccc1	ZINC000819224510	DE	On-Demand	Anodyne	FPR1	65	44
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccccc1	ZINC000819224510	DE	On-Demand	Anodyne	PDS	43	31
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccccc1	ZINC000819224511	DE	On-Demand	Anodyne	MME	66	37
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccccc1	ZINC000819224511	DE	On-Demand	Anodyne	CTSD	19	41
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccccc1	ZINC000819224511	DE	On-Demand	Anodyne	PGC	53	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccccc1	ZINC000819224511	DE	On-Demand	Anodyne	CTSB	24	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccccc1	ZINC000819224511	DE	On-Demand	Anodyne	PAPA1_CARPA	54	56
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccccc1	ZINC000819224511	DE	On-Demand	Anodyne	CCKAR	40	36
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccccc1	ZINC000819224511	DE	On-Demand	Anodyne	CTSK	22	56
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccccc1	ZINC000819224511	DE	On-Demand	Anodyne	CTSL	21	56
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccccc1	ZINC000819224511	DE	On-Demand	Anodyne	PGA	27	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccccc1	ZINC000819224511	DE	On-Demand	Anodyne	TACR3	18	43
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccccc1	ZINC000819224511	DE	On-Demand	Anodyne	REN	64	43
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccccc1	ZINC000819224511	DE	On-Demand	Anodyne	REN1	15	41
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccccc1	ZINC000819224511	DE	On-Demand	Anodyne	CAPN1	59	43
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccccc1	ZINC000819224511	DE	On-Demand	Anodyne	CAPN2	45	31
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccccc1	ZINC000819224511	DE	On-Demand	Anodyne	FPR1	65	44
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccccc1	ZINC000819224511	DE	On-Demand	Anodyne	PDS	43	31
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccccc1	ZINC000819224512	DE	On-Demand	Anodyne	MME	66	37
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccccc1	ZINC000819224512	DE	On-Demand	Anodyne	CTSD	19	41
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccccc1	ZINC000819224512	DE	On-Demand	Anodyne	PGC	53	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccccc1	ZINC000819224512	DE	On-Demand	Anodyne	CTSB	24	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccccc1	ZINC000819224512	DE	On-Demand	Anodyne	PAPA1_CARPA	54	56
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccccc1	ZINC000819224512	DE	On-Demand	Anodyne	CCKAR	40	36
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccccc1	ZINC000819224512	DE	On-Demand	Anodyne	CTSK	22	56
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccccc1	ZINC000819224512	DE	On-Demand	Anodyne	CTSL	21	56
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccccc1	ZINC000819224512	DE	On-Demand	Anodyne	PGA	27	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccccc1	ZINC000819224512	DE	On-Demand	Anodyne	TACR3	18	43
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccccc1	ZINC000819224512	DE	On-Demand	Anodyne	REN	64	43
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccccc1	ZINC000819224512	DE	On-Demand	Anodyne	REN1	15	41
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccccc1	ZINC000819224512	DE	On-Demand	Anodyne	CAPN1	59	43
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccccc1	ZINC000819224512	DE	On-Demand	Anodyne	CAPN2	45	31
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccccc1	ZINC000819224512	DE	On-Demand	Anodyne	FPR1	65	44
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccccc1	ZINC000819224512	DE	On-Demand	Anodyne	PDS	43	31
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1ccc(F)cc1	ZINC000819224525	DF	On-Demand	Anodyne	PAPA1_CARPA	25	42
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1ccc(F)cc1	ZINC000819224526	DF	On-Demand	Anodyne	PAPA1_CARPA	25	42
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccc(F)cc1	ZINC000819224527	DF	On-Demand	Anodyne	PAPA1_CARPA	25	42
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccc(F)cc1	ZINC000819224528	DF	On-Demand	Anodyne	PAPA1_CARPA	25	42
COc1cc(Br)ccc1CCCNC[C@H](O)c1ccccc1	ZINC000819224533	FH	On-Demand	Anodyne	ADRB2	48	39
COc1cc(Br)ccc1CCCNC[C@H](O)c1ccccc1	ZINC000819224533	FH	On-Demand	Anodyne	ADRB1	45	43
COc1cc(Br)ccc1CCCNC[C@H](O)c1ccccc1	ZINC000819224533	FH	On-Demand	Anodyne	ADRB3	55	41
COc1cc(Br)ccc1CCCNC[C@@H](O)c1ccccc1	ZINC000819224534	FH	On-Demand	Anodyne	ADRB2	48	39
COc1cc(Br)ccc1CCCNC[C@@H](O)c1ccccc1	ZINC000819224534	FH	On-Demand	Anodyne	ADRB1	45	43
COc1cc(Br)ccc1CCCNC[C@@H](O)c1ccccc1	ZINC000819224534	FH	On-Demand	Anodyne	ADRB3	55	41
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@H](O)COc2ccccc2F)C1	ZINC000819224552	GG	On-Demand	Anodyne	ADRB1	43	35
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@H](O)COc2ccccc2F)C1	ZINC000819224552	GG	On-Demand	Anodyne	ABCB1	24	43
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819224553	GG	On-Demand	Anodyne	ADRB1	43	35
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819224553	GG	On-Demand	Anodyne	ABCB1	24	43
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819224554	GG	On-Demand	Anodyne	ADRB1	43	35
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819224554	GG	On-Demand	Anodyne	ABCB1	24	43
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@H](O)COc2ccccc2F)C1	ZINC000819224555	GG	On-Demand	Anodyne	ADRB1	43	35
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@H](O)COc2ccccc2F)C1	ZINC000819224555	GG	On-Demand	Anodyne	ABCB1	24	43
COc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819224599	FH	On-Demand	Mild	PAPA1_CARPA	45	46
COc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819224599	FH	On-Demand	Mild	CTSL	17	44
CC(C)(C)OC(=O)NC/C=C/CNCCC(=O)Nc1ccccc1	ZINC000819224621	EF	On-Demand	Anodyne	LTA4H	32	47
CC(C)(C)OC(=O)NC/C=C/CNCCC(=O)Nc1ccccc1	ZINC000819224621	EF	On-Demand	Anodyne	PAPA1_CARPA	29	45
CC(C)(C)OC(=O)NC/C=C/CNCCC(=O)Nc1ccccc1	ZINC000819224621	EF	On-Demand	Anodyne	HDAC8	18	44
CC(C)(C)OC(=O)NC/C=C/CNCCC(=O)Nc1ccccc1	ZINC000819224621	EF	On-Demand	Anodyne	HDAC10	25	43
CC(C)(C)OC(=O)NC/C=C/CNCCC(=O)Nc1ccccc1	ZINC000819224621	EF	On-Demand	Anodyne	HDAC2	20	43
CC(C)(C)OC(=O)NC/C=C/CNCCC(=O)Nc1ccccc1	ZINC000819224621	EF	On-Demand	Anodyne	HDAC3	19	43
CC(C)(C)OC(=O)NC/C=C/CNCCC(=O)Nc1ccccc1	ZINC000819224621	EF	On-Demand	Anodyne	HDAC6	18	43
CC(C)(C)OC(=O)NC/C=C/CNCCC(=O)Nc1ccccc1	ZINC000819224621	EF	On-Demand	Anodyne	FPR1	45	35
CC(C)(C)OC(=O)NC/C=C\CNCCC(=O)Nc1ccccc1	ZINC000819224622	EF	On-Demand	Anodyne	LTA4H	32	47
CC(C)(C)OC(=O)NC/C=C\CNCCC(=O)Nc1ccccc1	ZINC000819224622	EF	On-Demand	Anodyne	PAPA1_CARPA	29	45
CC(C)(C)OC(=O)NC/C=C\CNCCC(=O)Nc1ccccc1	ZINC000819224622	EF	On-Demand	Anodyne	HDAC8	18	44
CC(C)(C)OC(=O)NC/C=C\CNCCC(=O)Nc1ccccc1	ZINC000819224622	EF	On-Demand	Anodyne	HDAC10	25	43
CC(C)(C)OC(=O)NC/C=C\CNCCC(=O)Nc1ccccc1	ZINC000819224622	EF	On-Demand	Anodyne	HDAC2	20	43
CC(C)(C)OC(=O)NC/C=C\CNCCC(=O)Nc1ccccc1	ZINC000819224622	EF	On-Demand	Anodyne	HDAC3	19	43
CC(C)(C)OC(=O)NC/C=C\CNCCC(=O)Nc1ccccc1	ZINC000819224622	EF	On-Demand	Anodyne	HDAC6	18	43
CC(C)(C)OC(=O)NC/C=C\CNCCC(=O)Nc1ccccc1	ZINC000819224622	EF	On-Demand	Anodyne	FPR1	45	35
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@@H](O)COCc2ccccc2)C1	ZINC000819224623	GG	On-Demand	Anodyne	GHSR	30	40
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@@H](O)COCc2ccccc2)C1	ZINC000819224623	GG	On-Demand	Anodyne	SLC12A5	62	37
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@@H](O)COCc2ccccc2)C1	ZINC000819224624	GG	On-Demand	Anodyne	GHSR	30	40
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@@H](O)COCc2ccccc2)C1	ZINC000819224624	GG	On-Demand	Anodyne	SLC12A5	62	37
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@H](O)COCc2ccccc2)C1	ZINC000819224625	GG	On-Demand	Anodyne	GHSR	30	40
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@H](O)COCc2ccccc2)C1	ZINC000819224625	GG	On-Demand	Anodyne	SLC12A5	62	37
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@H](O)COCc2ccccc2)C1	ZINC000819224626	GG	On-Demand	Anodyne	GHSR	30	40
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@H](O)COCc2ccccc2)C1	ZINC000819224626	GG	On-Demand	Anodyne	SLC12A5	62	37
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNCCS(=O)(=O)c2ccccc2)C1	ZINC000819224678	GG	On-Demand	Anodyne	SFRP1	32	40
CC(C)(C)OC(=O)N1CCC[C@](C)(CNCCS(=O)(=O)c2ccccc2)C1	ZINC000819224679	GG	On-Demand	Anodyne	SFRP1	32	40
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819224710	GI	On-Demand	Anodyne	ADRB1	27	41
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819224710	GI	On-Demand	Anodyne	ADRB3	44	41
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819224711	GI	On-Demand	Anodyne	ADRB1	27	41
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819224711	GI	On-Demand	Anodyne	ADRB3	44	41
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819224712	GI	On-Demand	Anodyne	ADRB1	27	41
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819224712	GI	On-Demand	Anodyne	ADRB3	44	41
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819224713	GI	On-Demand	Anodyne	ADRB1	27	41
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819224713	GI	On-Demand	Anodyne	ADRB3	44	41
CSc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cn1	ZINC000819224714	FG	On-Demand	Mild	PAPA1_CARPA	43	46
CSc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cn1	ZINC000819224715	FG	On-Demand	Mild	PAPA1_CARPA	43	46
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819224798	EE	On-Demand	Anodyne	PAPA1_CARPA	30	49
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819224798	EE	On-Demand	Anodyne	FPR1	40	34
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819224799	EE	On-Demand	Anodyne	PAPA1_CARPA	30	49
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819224799	EE	On-Demand	Anodyne	FPR1	40	34
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccc(F)cc1	ZINC000819224800	EE	On-Demand	Anodyne	PAPA1_CARPA	30	49
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccc(F)cc1	ZINC000819224800	EE	On-Demand	Anodyne	FPR1	40	34
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccc(F)cc1	ZINC000819224801	EE	On-Demand	Anodyne	PAPA1_CARPA	30	49
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccc(F)cc1	ZINC000819224801	EE	On-Demand	Anodyne	FPR1	40	34
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccc(C#N)cc1	ZINC000819224808	EE	On-Demand	Mild	CTRB_BOVIN	44	32
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccc(C#N)cc1	ZINC000819224809	EE	On-Demand	Mild	CTRB_BOVIN	44	32
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1ccc(C#N)cc1	ZINC000819224810	EE	On-Demand	Mild	CTRB_BOVIN	44	32
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1ccc(C#N)cc1	ZINC000819224811	EE	On-Demand	Mild	CTRB_BOVIN	44	32
C#CCOCCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819224822	ED	On-Demand	Mild	GPR119	25	40
C#CCOCCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819224823	ED	On-Demand	Mild	GPR119	25	40
Cc1cc(F)ccc1[C@@H](O)CNCC1(C)CCN(C(=O)OC(C)(C)C)CC1	ZINC000819224854	GH	On-Demand	Anodyne	GPR119	23	42
COc1cc(Br)ccc1CCCNC[C@H](O)c1cccnc1	ZINC000819224855	FG	On-Demand	Anodyne	ADRB2	40	43
COc1cc(Br)ccc1CCCNC[C@H](O)c1cccnc1	ZINC000819224855	FG	On-Demand	Anodyne	ADRB1	42	51
COc1cc(Br)ccc1CCCNC[C@H](O)c1cccnc1	ZINC000819224855	FG	On-Demand	Anodyne	ADRB3	112	51
COc1cc(Br)ccc1CCCNC[C@@H](O)c1cccnc1	ZINC000819224856	FG	On-Demand	Anodyne	ADRB2	40	43
COc1cc(Br)ccc1CCCNC[C@@H](O)c1cccnc1	ZINC000819224856	FG	On-Demand	Anodyne	ADRB1	42	51
COc1cc(Br)ccc1CCCNC[C@@H](O)c1cccnc1	ZINC000819224856	FG	On-Demand	Anodyne	ADRB3	112	51
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccccc1Cl	ZINC000819224901	EG	On-Demand	Anodyne	PAPA1_CARPA	28	44
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccccc1Cl	ZINC000819224901	EG	On-Demand	Anodyne	FPR1	43	37
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccccc1Cl	ZINC000819224902	EG	On-Demand	Anodyne	PAPA1_CARPA	28	44
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccccc1Cl	ZINC000819224902	EG	On-Demand	Anodyne	FPR1	43	37
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@H](O)CCc2ccccc2)C1	ZINC000819224907	GH	On-Demand	Anodyne	GHRHR	47	35
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@H](O)CCc2ccccc2)C1	ZINC000819224908	GH	On-Demand	Anodyne	GHRHR	47	35
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819224909	GH	On-Demand	Anodyne	GHRHR	47	35
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819224910	GH	On-Demand	Anodyne	GHRHR	47	35
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1cccc(Br)c1	ZINC000819224915	GG	On-Demand	Anodyne	ADRB3	53	38
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1cccc(Br)c1	ZINC000819224915	GG	On-Demand	Anodyne	PAPA1_CARPA	27	43
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1cccc(Br)c1	ZINC000819224916	GG	On-Demand	Anodyne	ADRB3	53	38
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1cccc(Br)c1	ZINC000819224916	GG	On-Demand	Anodyne	PAPA1_CARPA	27	43
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1cccc(Br)c1	ZINC000819224917	GG	On-Demand	Anodyne	ADRB3	53	38
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1cccc(Br)c1	ZINC000819224917	GG	On-Demand	Anodyne	PAPA1_CARPA	27	43
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1cccc(Br)c1	ZINC000819224918	GG	On-Demand	Anodyne	ADRB3	53	38
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1cccc(Br)c1	ZINC000819224918	GG	On-Demand	Anodyne	PAPA1_CARPA	27	43
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)CN1CCc2ccccc2C1	ZINC000819224925	GE	On-Demand	Anodyne	NOD2	45	39
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819224926	GE	On-Demand	Anodyne	NOD2	45	39
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819224927	GE	On-Demand	Anodyne	NOD2	45	39
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)CN1CCc2ccccc2C1	ZINC000819224928	GE	On-Demand	Anodyne	NOD2	45	39
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819224948	GG	On-Demand	Anodyne	ADRB1	40	38
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819224949	GG	On-Demand	Anodyne	ADRB1	40	38
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819224950	GG	On-Demand	Anodyne	ADRB1	40	38
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819224951	GG	On-Demand	Anodyne	ADRB1	40	38
CCN(CCNC(=O)C[S@@](=O)c1cccc(OC)c1)C(=O)OC(C)(C)C	ZINC000819224952	GE	On-Demand	Anodyne	MTNR1A	38	40
CCN(CCNC(=O)C[S@@](=O)c1cccc(OC)c1)C(=O)OC(C)(C)C	ZINC000819224952	GE	On-Demand	Anodyne	MTNR1B	35	40
CCN(CCNC(=O)C[S@](=O)c1cccc(OC)c1)C(=O)OC(C)(C)C	ZINC000819224953	GE	On-Demand	Anodyne	MTNR1A	38	40
CCN(CCNC(=O)C[S@](=O)c1cccc(OC)c1)C(=O)OC(C)(C)C	ZINC000819224953	GE	On-Demand	Anodyne	MTNR1B	35	40
C#CCOCCNC[C@H](O)c1ccccc1	ZINC000819224955	BC	On-Demand	Mild	ADRB1	36	40
C#CCOCCNC[C@H](O)c1ccccc1	ZINC000819224955	BC	On-Demand	Mild	ADRB3	41	44
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1cccnc1	ZINC000819224971	DD	On-Demand	Anodyne	ADRB2	27	46
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1cccnc1	ZINC000819224971	DD	On-Demand	Anodyne	ADRB1	41	47
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1cccnc1	ZINC000819224971	DD	On-Demand	Anodyne	ADRB3	116	50
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1cccnc1	ZINC000819224973	DD	On-Demand	Anodyne	ADRB2	27	46
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1cccnc1	ZINC000819224973	DD	On-Demand	Anodyne	ADRB1	41	47
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1cccnc1	ZINC000819224973	DD	On-Demand	Anodyne	ADRB3	116	50
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1cccnc1	ZINC000819224975	DD	On-Demand	Anodyne	ADRB2	27	46
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1cccnc1	ZINC000819224975	DD	On-Demand	Anodyne	ADRB1	41	47
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1cccnc1	ZINC000819224975	DD	On-Demand	Anodyne	ADRB3	116	50
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1cccnc1	ZINC000819224976	DD	On-Demand	Anodyne	ADRB2	27	46
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1cccnc1	ZINC000819224976	DD	On-Demand	Anodyne	ADRB1	41	47
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1cccnc1	ZINC000819224976	DD	On-Demand	Anodyne	ADRB3	116	50
O=C(O)[C@H]1CCCN1C(=O)C1=CCCCO1	ZINC000819224986	BC	On-Demand	Anodyne	ACE	44	40
O=C(O)[C@@H]1CCCN1C(=O)C1=CCCCO1	ZINC000819224987	BC	On-Demand	Anodyne	ACE	44	40
O=C(O)C1(NS(=O)(=O)c2ccc(Cl)nc2)CCCCC1	ZINC000819224989	DD	On-Demand	Anodyne	PLAU	21	56
O=C(O)[C@H]1CCCN1C(=O)C1CCS(=O)(=O)CC1	ZINC000819224998	CB	On-Demand	Anodyne	ACE	40	51
O=C(O)[C@H]1CCCN1C(=O)C1CCS(=O)(=O)CC1	ZINC000819224998	CB	On-Demand	Anodyne	PREP	40	39
O=C(O)[C@@H]1CCCN1C(=O)C1CCS(=O)(=O)CC1	ZINC000819225001	CB	On-Demand	Anodyne	ACE	40	51
O=C(O)[C@@H]1CCCN1C(=O)C1CCS(=O)(=O)CC1	ZINC000819225001	CB	On-Demand	Anodyne	PREP	40	39
C#CCOCCNC[C@@H](O)COc1ccc(SC)cc1	ZINC000819225011	CD	On-Demand	Mild	ADRB2	43	43
C#CCOCCNC[C@@H](O)COc1ccc(SC)cc1	ZINC000819225011	CD	On-Demand	Mild	ADRB1	64	45
C#CCOCCNC[C@@H](O)COc1ccc(SC)cc1	ZINC000819225011	CD	On-Demand	Mild	ADRB3	34	45
C#CCOCCNC[C@H](O)COc1ccc(SC)cc1	ZINC000819225013	CD	On-Demand	Mild	ADRB2	43	43
C#CCOCCNC[C@H](O)COc1ccc(SC)cc1	ZINC000819225013	CD	On-Demand	Mild	ADRB1	64	45
C#CCOCCNC[C@H](O)COc1ccc(SC)cc1	ZINC000819225013	CD	On-Demand	Mild	ADRB3	34	45
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	F2	43	41
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	PLG	29	40
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	ACE	82	53
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	FKBP1A	76	47
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	CELA1	27	57
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	GRIN2B	35	49
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	ELANE	27	42
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	MME	21	45
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	CTRA_BOVIN	47	32
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	TRY1_BOVIN	52	32
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	CPT1A	41	40
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	CPT2	45	39
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	DPP4	18	40
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	PREP	155	67
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	CELA2A	40	32
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	LGMN	79	48
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	ACE2	18	41
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	TGM2	40	44
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	KLK5	27	48
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	F13A1	45	44
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	SFRP1	49	38
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	WNT3	53	38
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	SLC12A5	72	43
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819225016	FE	On-Demand	Anodyne	TMPRSS11D	63	41
O=C(O)[C@H]1CCCN1C(=O)C1=CCCC1	ZINC000819225017	BD	On-Demand	Anodyne	ACE	51	43
O=C(O)[C@H]1CCCN1C(=O)C1=CCCC1	ZINC000819225017	BD	On-Demand	Anodyne	PREP	48	41
O=C(O)[C@@H]1CCCN1C(=O)C1=CCCC1	ZINC000819225022	BD	On-Demand	Anodyne	ACE	51	43
O=C(O)[C@@H]1CCCN1C(=O)C1=CCCC1	ZINC000819225022	BD	On-Demand	Anodyne	PREP	48	41
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)CC1CCCC1	ZINC000819225041	DF	On-Demand	Anodyne	REN	40	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)CC1CCCC1	ZINC000819225042	DF	On-Demand	Anodyne	REN	40	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)CC1CCCC1	ZINC000819225044	DF	On-Demand	Anodyne	REN	40	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)CC1CCCC1	ZINC000819225046	DF	On-Demand	Anodyne	REN	40	40
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)/C=C\c2ccccc2)CC1	ZINC000819225052	FE	On-Demand	Anodyne	ACE	50	43
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)/C=C\c2ccccc2)CC1	ZINC000819225052	FE	On-Demand	Anodyne	CPT2	41	35
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)/C=C\c2ccccc2)CC1	ZINC000819225052	FE	On-Demand	Anodyne	PREP	123	44
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)/C=C\c2ccccc2)CC1	ZINC000819225052	FE	On-Demand	Anodyne	SFRP1	46	38
O=C(O)[C@H]1CCCN1C(=O)C1CCN(C(=O)/C=C\c2ccccc2)CC1	ZINC000819225052	FE	On-Demand	Anodyne	WNT3	60	38
O=C(O)[C@H]1CCCN1C(=O)C#Cc1ccc2c(c1)OCO2	ZINC000819225056	CC	On-Demand	Mild	ACE	45	37
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1ccccc1Br	ZINC000819225058	GG	On-Demand	Anodyne	PAPA1_CARPA	29	44
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1ccccc1Br	ZINC000819225058	GG	On-Demand	Anodyne	FPR1	43	35
O=C(O)[C@@H]1CCCN1C(=O)C#Cc1ccc2c(c1)OCO2	ZINC000819225059	CC	On-Demand	Mild	ACE	45	37
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccccc1Br	ZINC000819225060	GG	On-Demand	Anodyne	PAPA1_CARPA	29	44
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccccc1Br	ZINC000819225060	GG	On-Demand	Anodyne	FPR1	43	35
O=C(Nc1nc(CC(=O)N2CCO[C@@H](C(=O)O)C2)cs1)c1cccc(O)c1	ZINC000819225061	GC	On-Demand	Anodyne	CPT1A	29	46
O=C(Nc1nc(CC(=O)N2CCO[C@@H](C(=O)O)C2)cs1)c1cccc(O)c1	ZINC000819225061	GC	On-Demand	Anodyne	CPT1B	40	46
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1ccccc1Br	ZINC000819225062	GG	On-Demand	Anodyne	PAPA1_CARPA	29	44
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1ccccc1Br	ZINC000819225062	GG	On-Demand	Anodyne	FPR1	43	35
O=C(Nc1nc(CC(=O)N2CCO[C@H](C(=O)O)C2)cs1)c1cccc(O)c1	ZINC000819225063	GC	On-Demand	Anodyne	CPT1A	29	46
O=C(Nc1nc(CC(=O)N2CCO[C@H](C(=O)O)C2)cs1)c1cccc(O)c1	ZINC000819225063	GC	On-Demand	Anodyne	CPT1B	40	46
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccccc1Br	ZINC000819225064	GG	On-Demand	Anodyne	PAPA1_CARPA	29	44
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccccc1Br	ZINC000819225064	GG	On-Demand	Anodyne	FPR1	43	35
O=C(Nc1nncs1)c1ccc(N2CCO[C@@H](C(=O)O)C2)nc1	ZINC000819225069	EC	On-Demand	Anodyne	HDAC1	18	40
O=C(Nc1nncs1)c1ccc(N2CCO[C@H](C(=O)O)C2)nc1	ZINC000819225070	EC	On-Demand	Anodyne	HDAC1	18	40
O=C(Nc1nncs1)c1ccc(N2CC[C@@H](C(=O)O)C2)nc1	ZINC000819225077	DD	On-Demand	Anodyne	MPL	34	49
O=C(Nc1nncs1)c1ccc(N2CC[C@@H](C(=O)O)C2)nc1	ZINC000819225077	DD	On-Demand	Anodyne	HDAC1	19	46
O=C(Nc1nncs1)c1ccc(N2CC[C@@H](C(=O)O)C2)nc1	ZINC000819225077	DD	On-Demand	Anodyne	HPGDS	18	41
O=C(Nc1nncs1)c1ccc(N2CC[C@H](C(=O)O)C2)nc1	ZINC000819225080	DD	On-Demand	Anodyne	MPL	34	49
O=C(Nc1nncs1)c1ccc(N2CC[C@H](C(=O)O)C2)nc1	ZINC000819225080	DD	On-Demand	Anodyne	HDAC1	19	46
O=C(Nc1nncs1)c1ccc(N2CC[C@H](C(=O)O)C2)nc1	ZINC000819225080	DD	On-Demand	Anodyne	HPGDS	18	41
O=C(O)[C@@H]1CCCN1C(=O)[C@H]1CC12CCC2	ZINC000819225081	BD	On-Demand	Anodyne	ACE	42	53
O=C(O)[C@H]1CCCN1C(=O)[C@@H]1CC12CCC2	ZINC000819225084	BD	On-Demand	Anodyne	ACE	42	53
O=C(O)[C@@H]1CCCN1C(=O)[C@@H]1CC12CCC2	ZINC000819225086	BD	On-Demand	Anodyne	ACE	42	53
O=C(O)[C@H]1CCCN1C(=O)[C@H]1CC12CCC2	ZINC000819225087	BD	On-Demand	Anodyne	ACE	42	53
O=C(O)[C@H]1CC(C(=O)N2CCN(C3CCOCC3)CC2)=NN1c1ccccc1	ZINC000819225109	GD	On-Demand	Anodyne	L3MBTL3	61	36
O=C(O)[C@@H]1CC(C(=O)N2CCN(C3CCOCC3)CC2)=NN1c1ccccc1	ZINC000819225111	GD	On-Demand	Anodyne	L3MBTL3	61	36
O=C(O)[C@H]1CCCN1C(=O)CCCc1nnc(-c2ccccc2)o1	ZINC000819225116	EE	On-Demand	Anodyne	ACE	62	49
O=C(O)[C@H]1CCCN1C(=O)CCCc1nnc(-c2ccccc2)o1	ZINC000819225116	EE	On-Demand	Anodyne	HCRTR1	20	45
O=C(O)[C@H]1CCCN1C(=O)CCCc1nnc(-c2ccccc2)o1	ZINC000819225116	EE	On-Demand	Anodyne	CPT1A	70	36
O=C(O)[C@H]1CCCN1C(=O)CCCc1nnc(-c2ccccc2)o1	ZINC000819225116	EE	On-Demand	Anodyne	CPT2	44	33
O=C(O)[C@H]1CCCN1C(=O)CCCc1nnc(-c2ccccc2)o1	ZINC000819225116	EE	On-Demand	Anodyne	PREP	118	50
O=C(O)[C@@H]1CCCN1C(=O)CCCc1nnc(-c2ccccc2)o1	ZINC000819225117	EE	On-Demand	Anodyne	ACE	62	49
O=C(O)[C@@H]1CCCN1C(=O)CCCc1nnc(-c2ccccc2)o1	ZINC000819225117	EE	On-Demand	Anodyne	HCRTR1	20	45
O=C(O)[C@@H]1CCCN1C(=O)CCCc1nnc(-c2ccccc2)o1	ZINC000819225117	EE	On-Demand	Anodyne	CPT1A	70	36
O=C(O)[C@@H]1CCCN1C(=O)CCCc1nnc(-c2ccccc2)o1	ZINC000819225117	EE	On-Demand	Anodyne	CPT2	44	33
O=C(O)[C@@H]1CCCN1C(=O)CCCc1nnc(-c2ccccc2)o1	ZINC000819225117	EE	On-Demand	Anodyne	PREP	118	50
O=C(O)[C@H]1CCCN1C(=O)CCC(=O)N1CCN(c2ncccn2)CC1	ZINC000819225118	FB	On-Demand	Anodyne	ACE	57	51
O=C(O)[C@H]1CCCN1C(=O)CCC(=O)N1CCN(c2ncccn2)CC1	ZINC000819225118	FB	On-Demand	Anodyne	CPT1A	27	60
O=C(O)[C@H]1CCCN1C(=O)CCC(=O)N1CCN(c2ncccn2)CC1	ZINC000819225118	FB	On-Demand	Anodyne	CPT2	44	42
O=C(O)[C@H]1CCCN1C(=O)CCC(=O)N1CCN(c2ncccn2)CC1	ZINC000819225118	FB	On-Demand	Anodyne	PREP	95	49
O=C(O)[C@H]1CCCN1C(=O)CCC(=O)N1CCN(c2ncccn2)CC1	ZINC000819225118	FB	On-Demand	Anodyne	TMPRSS11D	15	44
O=C(O)[C@@H]1CCCN1C(=O)CCC(=O)N1CCN(c2ncccn2)CC1	ZINC000819225119	FB	On-Demand	Anodyne	ACE	57	51
O=C(O)[C@@H]1CCCN1C(=O)CCC(=O)N1CCN(c2ncccn2)CC1	ZINC000819225119	FB	On-Demand	Anodyne	CPT1A	27	60
O=C(O)[C@@H]1CCCN1C(=O)CCC(=O)N1CCN(c2ncccn2)CC1	ZINC000819225119	FB	On-Demand	Anodyne	CPT2	44	42
O=C(O)[C@@H]1CCCN1C(=O)CCC(=O)N1CCN(c2ncccn2)CC1	ZINC000819225119	FB	On-Demand	Anodyne	PREP	95	49
O=C(O)[C@@H]1CCCN1C(=O)CCC(=O)N1CCN(c2ncccn2)CC1	ZINC000819225119	FB	On-Demand	Anodyne	TMPRSS11D	15	44
O=C(O)[C@@H]1CC(C(=O)N2CCN(CCO)CC2)=NN1c1ccccc1	ZINC000819225120	EB	On-Demand	Anodyne	HTR1A	20	40
O=C(O)[C@H]1CC(C(=O)N2CCN(CCO)CC2)=NN1c1ccccc1	ZINC000819225121	EB	On-Demand	Anodyne	HTR1A	20	40
O=C(O)C1(NC[C@@H](O)c2cccc(Cl)c2)CCCC1	ZINC000819225123	CE	On-Demand	Anodyne	ADRB1	36	46
O=C(O)C1(NC[C@@H](O)c2cccc(Cl)c2)CCCC1	ZINC000819225123	CE	On-Demand	Anodyne	ADRB3	54	48
O=C(O)C1(NC[C@H](O)c2cccc(Cl)c2)CCCC1	ZINC000819225124	CE	On-Demand	Anodyne	ADRB1	36	46
O=C(O)C1(NC[C@H](O)c2cccc(Cl)c2)CCCC1	ZINC000819225124	CE	On-Demand	Anodyne	ADRB3	54	48
O=C(O)[C@H]1CCCN1C(=O)C(F)=C1CCCC1	ZINC000819225125	BD	On-Demand	Anodyne	ACE	48	44
O=C(O)[C@@H]1CCCN1C(=O)C(F)=C1CCCC1	ZINC000819225126	BD	On-Demand	Anodyne	ACE	48	44
O=C(O)[C@@H]1CCCN1C(=O)CC1(O)CCCCC1	ZINC000819225132	CD	On-Demand	Anodyne	ACE	55	54
O=C(O)[C@@H]1CCCN1C(=O)CC1(O)CCCCC1	ZINC000819225132	CD	On-Demand	Anodyne	PREP	40	41
O=C(O)[C@@H]1CCCN1C(=O)CC1(O)CCCCC1	ZINC000819225132	CD	On-Demand	Anodyne	MVD	15	46
O=C(O)[C@H]1CCCN1C(=O)CC1(O)CCCCC1	ZINC000819225133	CD	On-Demand	Anodyne	ACE	55	54
O=C(O)[C@H]1CCCN1C(=O)CC1(O)CCCCC1	ZINC000819225133	CD	On-Demand	Anodyne	PREP	40	41
O=C(O)[C@H]1CCCN1C(=O)CC1(O)CCCCC1	ZINC000819225133	CD	On-Demand	Anodyne	MVD	15	46
O=C(O)[C@H]1CCCN1C(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	ZINC000819225136	GC	On-Demand	Anodyne	PREP	56	35
O=C(O)[C@@H]1CCCN1C(=O)[C@@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	ZINC000819225137	GC	On-Demand	Anodyne	PREP	56	35
O=C(O)[C@H]1CCCN1C(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	ZINC000819225138	GC	On-Demand	Anodyne	PREP	56	35
O=C(O)[C@@H]1CCCN1C(=O)[C@H]1CN(Cc2nc(O)c3ccccc3n2)CCO1	ZINC000819225139	GC	On-Demand	Anodyne	PREP	56	35
O=C(O)[C@H]1CC(c2nc(-c3cnccn3)no2)=NN1c1ccccc1	ZINC000819225141	ED	On-Demand	Anodyne	CPT1A	41	35
O=C(O)[C@@H]1CC(c2nc(-c3cnccn3)no2)=NN1c1ccccc1	ZINC000819225142	ED	On-Demand	Anodyne	CPT1A	41	35
O=C(O)[C@@H]1CCCN1C(=O)[C@@H]1Nc2ccccc2S(=O)(=O)N1	ZINC000819225147	EB	On-Demand	Anodyne	ACE	52	45
O=C(O)[C@@H]1CCCN1C(=O)[C@@H]1Nc2ccccc2S(=O)(=O)N1	ZINC000819225147	EB	On-Demand	Anodyne	PREP	108	39
O=C(O)[C@H]1CCCN1C(=O)[C@H]1Nc2ccccc2S(=O)(=O)N1	ZINC000819225148	EB	On-Demand	Anodyne	ACE	52	45
O=C(O)[C@H]1CCCN1C(=O)[C@H]1Nc2ccccc2S(=O)(=O)N1	ZINC000819225148	EB	On-Demand	Anodyne	PREP	108	39
O=C(O)[C@H]1CCCN1C(=O)[C@@H]1Nc2ccccc2S(=O)(=O)N1	ZINC000819225149	EB	On-Demand	Anodyne	ACE	52	45
O=C(O)[C@H]1CCCN1C(=O)[C@@H]1Nc2ccccc2S(=O)(=O)N1	ZINC000819225149	EB	On-Demand	Anodyne	PREP	108	39
O=C(O)[C@@H]1CCCN1C(=O)[C@H]1Nc2ccccc2S(=O)(=O)N1	ZINC000819225150	EB	On-Demand	Anodyne	ACE	52	45
O=C(O)[C@@H]1CCCN1C(=O)[C@H]1Nc2ccccc2S(=O)(=O)N1	ZINC000819225150	EB	On-Demand	Anodyne	PREP	108	39
O=C(O)C1(NC[C@@H](O)COc2cccc3[nH]ccc23)CCCC1	ZINC000819225151	DD	On-Demand	Anodyne	ADRB2	25	63
O=C(O)C1(NC[C@@H](O)COc2cccc3[nH]ccc23)CCCC1	ZINC000819225151	DD	On-Demand	Anodyne	ADRB1	40	62
O=C(O)C1(NC[C@@H](O)COc2cccc3[nH]ccc23)CCCC1	ZINC000819225151	DD	On-Demand	Anodyne	ADRB3	15	62
O=C(O)C1(NC[C@H](O)COc2cccc3[nH]ccc23)CCCC1	ZINC000819225152	DD	On-Demand	Anodyne	ADRB2	25	63
O=C(O)C1(NC[C@H](O)COc2cccc3[nH]ccc23)CCCC1	ZINC000819225152	DD	On-Demand	Anodyne	ADRB1	40	62
O=C(O)C1(NC[C@H](O)COc2cccc3[nH]ccc23)CCCC1	ZINC000819225152	DD	On-Demand	Anodyne	ADRB3	15	62
O=C(O)[C@H]1CCCN1C(=O)CCC(=O)N1CCC(c2ccccc2)=N1	ZINC000819225162	ED	On-Demand	Anodyne	F2	25	42
O=C(O)[C@H]1CCCN1C(=O)CCC(=O)N1CCC(c2ccccc2)=N1	ZINC000819225162	ED	On-Demand	Anodyne	ACE	75	50
O=C(O)[C@H]1CCCN1C(=O)CCC(=O)N1CCC(c2ccccc2)=N1	ZINC000819225162	ED	On-Demand	Anodyne	FKBP1A	47	39
O=C(O)[C@H]1CCCN1C(=O)CCC(=O)N1CCC(c2ccccc2)=N1	ZINC000819225162	ED	On-Demand	Anodyne	HCRTR1	16	40
O=C(O)[C@H]1CCCN1C(=O)CCC(=O)N1CCC(c2ccccc2)=N1	ZINC000819225162	ED	On-Demand	Anodyne	PRCP	16	44
O=C(O)[C@H]1CCCN1C(=O)CCC(=O)N1CCC(c2ccccc2)=N1	ZINC000819225162	ED	On-Demand	Anodyne	CPT1A	58	38
O=C(O)[C@H]1CCCN1C(=O)CCC(=O)N1CCC(c2ccccc2)=N1	ZINC000819225162	ED	On-Demand	Anodyne	CPT2	44	35
O=C(O)[C@H]1CCCN1C(=O)CCC(=O)N1CCC(c2ccccc2)=N1	ZINC000819225162	ED	On-Demand	Anodyne	DPP4	15	47
O=C(O)[C@H]1CCCN1C(=O)CCC(=O)N1CCC(c2ccccc2)=N1	ZINC000819225162	ED	On-Demand	Anodyne	PREP	113	46
O=C(O)[C@H]1CCCN1C(=O)CCCNS(=O)(=O)c1ccc(F)cc1	ZINC000819225176	FC	On-Demand	Anodyne	ACE	55	48
O=C(O)[C@H]1CCCN1C(=O)CCCNS(=O)(=O)c1ccc(F)cc1	ZINC000819225176	FC	On-Demand	Anodyne	HTR7	30	44
O=C(O)[C@H]1CCCN1C(=O)CCCNS(=O)(=O)c1ccc(F)cc1	ZINC000819225176	FC	On-Demand	Anodyne	DPP4	15	54
O=C(O)[C@H]1CCCN1C(=O)CCCNS(=O)(=O)c1ccc(F)cc1	ZINC000819225176	FC	On-Demand	Anodyne	PREP	56	41
O=C(O)[C@H]1CCCN1C(=O)CCCNS(=O)(=O)c1ccc(F)cc1	ZINC000819225176	FC	On-Demand	Anodyne	SFRP1	71	37
O=C(O)[C@H]1CCCN1C(=O)CCCNS(=O)(=O)c1ccc(F)cc1	ZINC000819225176	FC	On-Demand	Anodyne	WNT3	74	37
O=C(O)[C@@H]1CCCN1C(=O)CCCNS(=O)(=O)c1ccc(F)cc1	ZINC000819225177	FC	On-Demand	Anodyne	ACE	55	48
O=C(O)[C@@H]1CCCN1C(=O)CCCNS(=O)(=O)c1ccc(F)cc1	ZINC000819225177	FC	On-Demand	Anodyne	HTR7	30	44
O=C(O)[C@@H]1CCCN1C(=O)CCCNS(=O)(=O)c1ccc(F)cc1	ZINC000819225177	FC	On-Demand	Anodyne	DPP4	15	54
O=C(O)[C@@H]1CCCN1C(=O)CCCNS(=O)(=O)c1ccc(F)cc1	ZINC000819225177	FC	On-Demand	Anodyne	PREP	56	41
O=C(O)[C@@H]1CCCN1C(=O)CCCNS(=O)(=O)c1ccc(F)cc1	ZINC000819225177	FC	On-Demand	Anodyne	SFRP1	71	37
O=C(O)[C@@H]1CCCN1C(=O)CCCNS(=O)(=O)c1ccc(F)cc1	ZINC000819225177	FC	On-Demand	Anodyne	WNT3	74	37
O=C(O)C1(NS(=O)(=O)c2ccc3nc(O)nc(O)c3c2)CCCCC1	ZINC000819225189	FD	On-Demand	Anodyne	PLAU	17	52
O=C(O)[C@H]1CCCN1C(=O)/C=C\c1ccc(I)o1	ZINC000819225200	FD	On-Demand	Anodyne	ACE	44	37
O=C(O)[C@H]1CCCN1C(=O)CCCc1ccccc1Br	ZINC000819225201	EF	On-Demand	Anodyne	F2	19	42
O=C(O)[C@H]1CCCN1C(=O)CCCc1ccccc1Br	ZINC000819225201	EF	On-Demand	Anodyne	ACE	83	50
O=C(O)[C@H]1CCCN1C(=O)CCCc1ccccc1Br	ZINC000819225201	EF	On-Demand	Anodyne	FKBP1A	62	42
O=C(O)[C@H]1CCCN1C(=O)CCCc1ccccc1Br	ZINC000819225201	EF	On-Demand	Anodyne	MME	17	44
O=C(O)[C@H]1CCCN1C(=O)CCCc1ccccc1Br	ZINC000819225201	EF	On-Demand	Anodyne	CPT1A	16	40
O=C(O)[C@H]1CCCN1C(=O)CCCc1ccccc1Br	ZINC000819225201	EF	On-Demand	Anodyne	CPT2	45	37
O=C(O)[C@H]1CCCN1C(=O)CCCc1ccccc1Br	ZINC000819225201	EF	On-Demand	Anodyne	DPP4	18	47
O=C(O)[C@H]1CCCN1C(=O)CCCc1ccccc1Br	ZINC000819225201	EF	On-Demand	Anodyne	PREP	144	56
O=C(O)[C@@H]1CCCN1C(=O)CCCc1ccccc1Br	ZINC000819225203	EF	On-Demand	Anodyne	F2	19	42
O=C(O)[C@@H]1CCCN1C(=O)CCCc1ccccc1Br	ZINC000819225203	EF	On-Demand	Anodyne	ACE	83	50
O=C(O)[C@@H]1CCCN1C(=O)CCCc1ccccc1Br	ZINC000819225203	EF	On-Demand	Anodyne	FKBP1A	62	42
O=C(O)[C@@H]1CCCN1C(=O)CCCc1ccccc1Br	ZINC000819225203	EF	On-Demand	Anodyne	MME	17	44
O=C(O)[C@@H]1CCCN1C(=O)CCCc1ccccc1Br	ZINC000819225203	EF	On-Demand	Anodyne	CPT1A	16	40
O=C(O)[C@@H]1CCCN1C(=O)CCCc1ccccc1Br	ZINC000819225203	EF	On-Demand	Anodyne	CPT2	45	37
O=C(O)[C@@H]1CCCN1C(=O)CCCc1ccccc1Br	ZINC000819225203	EF	On-Demand	Anodyne	DPP4	18	47
O=C(O)[C@@H]1CCCN1C(=O)CCCc1ccccc1Br	ZINC000819225203	EF	On-Demand	Anodyne	PREP	144	56
O=C(O)[C@H]1CCCN1C(=O)[C@H]1CCN(C2CCCCC2)C1	ZINC000819225204	CD	On-Demand	Anodyne	ACE	44	48
O=C(O)[C@H]1CCCN1C(=O)[C@H]1CCN(C2CCCCC2)C1	ZINC000819225204	CD	On-Demand	Anodyne	PREP	53	38
O=C(O)[C@@H]1CCCN1C(=O)[C@H]1CCN(C2CCCCC2)C1	ZINC000819225205	CD	On-Demand	Anodyne	ACE	44	48
O=C(O)[C@@H]1CCCN1C(=O)[C@H]1CCN(C2CCCCC2)C1	ZINC000819225205	CD	On-Demand	Anodyne	PREP	53	38
O=C(O)[C@@H]1CCCN1C(=O)[C@@H]1CCN(C2CCCCC2)C1	ZINC000819225206	CD	On-Demand	Anodyne	ACE	44	48
O=C(O)[C@@H]1CCCN1C(=O)[C@@H]1CCN(C2CCCCC2)C1	ZINC000819225206	CD	On-Demand	Anodyne	PREP	53	38
O=C(O)[C@H]1CCCN1C(=O)[C@@H]1CCN(C2CCCCC2)C1	ZINC000819225208	CD	On-Demand	Anodyne	ACE	44	48
O=C(O)[C@H]1CCCN1C(=O)[C@@H]1CCN(C2CCCCC2)C1	ZINC000819225208	CD	On-Demand	Anodyne	PREP	53	38
O=C(O)[C@H]1CCCN1C(=O)CC1(O)CCCC1	ZINC000819225222	BC	On-Demand	Anodyne	ACE	57	55
O=C(O)[C@H]1CCCN1C(=O)CC1(O)CCCC1	ZINC000819225222	BC	On-Demand	Anodyne	PREP	42	41
O=C(O)[C@H]1CCCN1C(=O)CC1(O)CCCC1	ZINC000819225222	BC	On-Demand	Anodyne	MVD	15	47
O=C(O)[C@@H]1CCCN1C(=O)CC1(O)CCCC1	ZINC000819225223	BC	On-Demand	Anodyne	ACE	57	55
O=C(O)[C@@H]1CCCN1C(=O)CC1(O)CCCC1	ZINC000819225223	BC	On-Demand	Anodyne	PREP	42	41
O=C(O)[C@@H]1CCCN1C(=O)CC1(O)CCCC1	ZINC000819225223	BC	On-Demand	Anodyne	MVD	15	47
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819225237	FF	On-Demand	Anodyne	ADRB1	27	41
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819225237	FF	On-Demand	Anodyne	PAPA1_CARPA	30	45
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819225237	FF	On-Demand	Anodyne	CTSL	18	45
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819225237	FF	On-Demand	Anodyne	FPR1	45	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819225237	FF	On-Demand	Anodyne	PDS	59	37
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819225240	FF	On-Demand	Anodyne	ADRB1	27	41
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819225240	FF	On-Demand	Anodyne	PAPA1_CARPA	30	45
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819225240	FF	On-Demand	Anodyne	CTSL	18	45
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819225240	FF	On-Demand	Anodyne	FPR1	45	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819225240	FF	On-Demand	Anodyne	PDS	59	37
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819225241	FF	On-Demand	Anodyne	ADRB1	27	41
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819225241	FF	On-Demand	Anodyne	PAPA1_CARPA	30	45
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819225241	FF	On-Demand	Anodyne	CTSL	18	45
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819225241	FF	On-Demand	Anodyne	FPR1	45	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819225241	FF	On-Demand	Anodyne	PDS	59	37
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819225242	FF	On-Demand	Anodyne	ADRB1	27	41
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819225242	FF	On-Demand	Anodyne	PAPA1_CARPA	30	45
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819225242	FF	On-Demand	Anodyne	CTSL	18	45
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819225242	FF	On-Demand	Anodyne	FPR1	45	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819225242	FF	On-Demand	Anodyne	PDS	59	37
Cc1ccc(OC[C@H](O)CNCC2(C)CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819225248	GG	On-Demand	Anodyne	ADRB2	25	45
Cc1ccc(OC[C@H](O)CNCC2(C)CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819225248	GG	On-Demand	Anodyne	ADRB1	44	39
Cc1ccc(OC[C@H](O)CNCC2(C)CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819225248	GG	On-Demand	Anodyne	GPR119	29	40
Cc1ccc(OC[C@@H](O)CNCC2(C)CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819225249	GG	On-Demand	Anodyne	ADRB2	25	45
Cc1ccc(OC[C@@H](O)CNCC2(C)CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819225249	GG	On-Demand	Anodyne	ADRB1	44	39
Cc1ccc(OC[C@@H](O)CNCC2(C)CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819225249	GG	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1cccc(F)c1	ZINC000819225254	DF	On-Demand	Anodyne	ADRB1	33	44
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1cccc(F)c1	ZINC000819225254	DF	On-Demand	Anodyne	ADRB3	49	44
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1cccc(F)c1	ZINC000819225254	DF	On-Demand	Anodyne	PAPA1_CARPA	27	43
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1cccc(F)c1	ZINC000819225255	DF	On-Demand	Anodyne	ADRB1	33	44
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1cccc(F)c1	ZINC000819225255	DF	On-Demand	Anodyne	ADRB3	49	44
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1cccc(F)c1	ZINC000819225255	DF	On-Demand	Anodyne	PAPA1_CARPA	27	43
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1cccc(F)c1	ZINC000819225256	DF	On-Demand	Anodyne	ADRB1	33	44
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1cccc(F)c1	ZINC000819225256	DF	On-Demand	Anodyne	ADRB3	49	44
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1cccc(F)c1	ZINC000819225256	DF	On-Demand	Anodyne	PAPA1_CARPA	27	43
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1cccc(F)c1	ZINC000819225257	DF	On-Demand	Anodyne	ADRB1	33	44
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1cccc(F)c1	ZINC000819225257	DF	On-Demand	Anodyne	ADRB3	49	44
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1cccc(F)c1	ZINC000819225257	DF	On-Demand	Anodyne	PAPA1_CARPA	27	43
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2)CCCN1c1cccnc1	ZINC000819225267	EE	On-Demand	Anodyne	C3AR1	21	40
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2)CCCN1c1cccnc1	ZINC000819225268	EE	On-Demand	Anodyne	C3AR1	21	40
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2)CCCN1c1cccnc1	ZINC000819225269	EE	On-Demand	Anodyne	C3AR1	21	40
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2)CCCN1c1cccnc1	ZINC000819225270	EE	On-Demand	Anodyne	C3AR1	21	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819225275	EG	On-Demand	Anodyne	ADRB2	51	45
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819225275	EG	On-Demand	Anodyne	ADRB1	61	51
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819225275	EG	On-Demand	Anodyne	ADRB3	83	51
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819225275	EG	On-Demand	Anodyne	PAPA1_CARPA	27	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819225276	EG	On-Demand	Anodyne	ADRB2	51	45
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819225276	EG	On-Demand	Anodyne	ADRB1	61	51
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819225276	EG	On-Demand	Anodyne	ADRB3	83	51
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819225276	EG	On-Demand	Anodyne	PAPA1_CARPA	27	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1cccc(Cl)c1	ZINC000819225277	EG	On-Demand	Anodyne	ADRB2	51	45
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1cccc(Cl)c1	ZINC000819225277	EG	On-Demand	Anodyne	ADRB1	61	51
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1cccc(Cl)c1	ZINC000819225277	EG	On-Demand	Anodyne	ADRB3	83	51
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1cccc(Cl)c1	ZINC000819225277	EG	On-Demand	Anodyne	PAPA1_CARPA	27	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1cccc(Cl)c1	ZINC000819225278	EG	On-Demand	Anodyne	ADRB2	51	45
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1cccc(Cl)c1	ZINC000819225278	EG	On-Demand	Anodyne	ADRB1	61	51
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1cccc(Cl)c1	ZINC000819225278	EG	On-Demand	Anodyne	ADRB3	83	51
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1cccc(Cl)c1	ZINC000819225278	EG	On-Demand	Anodyne	PAPA1_CARPA	27	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccc(Cl)cc1	ZINC000819225287	EG	On-Demand	Anodyne	ADRB1	26	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccc(Cl)cc1	ZINC000819225287	EG	On-Demand	Anodyne	ADRB3	32	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccc(Cl)cc1	ZINC000819225288	EG	On-Demand	Anodyne	ADRB1	26	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccc(Cl)cc1	ZINC000819225288	EG	On-Demand	Anodyne	ADRB3	32	40
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@@H](O)COc2ccccc2)C1	ZINC000819225293	GG	On-Demand	Anodyne	ADRB2	37	43
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@@H](O)COc2ccccc2)C1	ZINC000819225293	GG	On-Demand	Anodyne	ADRB1	59	39
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@@H](O)COc2ccccc2)C1	ZINC000819225293	GG	On-Demand	Anodyne	ABCB1	25	41
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@H](O)COc2ccccc2)C1	ZINC000819225294	GG	On-Demand	Anodyne	ADRB2	37	43
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@H](O)COc2ccccc2)C1	ZINC000819225294	GG	On-Demand	Anodyne	ADRB1	59	39
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@H](O)COc2ccccc2)C1	ZINC000819225294	GG	On-Demand	Anodyne	ABCB1	25	41
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@@H](O)COc2ccccc2)C1	ZINC000819225295	GG	On-Demand	Anodyne	ADRB2	37	43
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@@H](O)COc2ccccc2)C1	ZINC000819225295	GG	On-Demand	Anodyne	ADRB1	59	39
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@@H](O)COc2ccccc2)C1	ZINC000819225295	GG	On-Demand	Anodyne	ABCB1	25	41
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@H](O)COc2ccccc2)C1	ZINC000819225296	GG	On-Demand	Anodyne	ADRB2	37	43
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@H](O)COc2ccccc2)C1	ZINC000819225296	GG	On-Demand	Anodyne	ADRB1	59	39
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@H](O)COc2ccccc2)C1	ZINC000819225296	GG	On-Demand	Anodyne	ABCB1	25	41
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1ccccc1F	ZINC000819225310	DF	On-Demand	Anodyne	PAPA1_CARPA	29	44
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1ccccc1F	ZINC000819225310	DF	On-Demand	Anodyne	FPR1	43	35
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccccc1F	ZINC000819225311	DF	On-Demand	Anodyne	PAPA1_CARPA	29	44
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccccc1F	ZINC000819225311	DF	On-Demand	Anodyne	FPR1	43	35
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1ccccc1F	ZINC000819225312	DF	On-Demand	Anodyne	PAPA1_CARPA	29	44
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1ccccc1F	ZINC000819225312	DF	On-Demand	Anodyne	FPR1	43	35
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccccc1F	ZINC000819225313	DF	On-Demand	Anodyne	PAPA1_CARPA	29	44
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccccc1F	ZINC000819225313	DF	On-Demand	Anodyne	FPR1	43	35
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1cccc2ccccc12	ZINC000819225314	FH	On-Demand	Anodyne	PAPA1_CARPA	28	43
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1cccc2ccccc12	ZINC000819225314	FH	On-Demand	Anodyne	FPR1	45	35
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1cccc2ccccc12	ZINC000819225315	FH	On-Demand	Anodyne	PAPA1_CARPA	28	43
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1cccc2ccccc12	ZINC000819225315	FH	On-Demand	Anodyne	FPR1	45	35
Cc1cc(F)ccc1[C@@H](O)CNC/C=C/CNC(=O)OC(C)(C)C	ZINC000819225316	EF	On-Demand	Anodyne	LEF	42	31
Cc1cc(F)ccc1[C@@H](O)CNC/C=C\CNC(=O)OC(C)(C)C	ZINC000819225317	EF	On-Demand	Anodyne	LEF	42	31
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1c(F)cccc1N1CCCC1	ZINC000819225416	FG	On-Demand	Anodyne	KCNQ2	62	38
C#CCOCCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819225432	DC	On-Demand	Mild	ADRB1	42	38
C#CCOCCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819225432	DC	On-Demand	Mild	ADRB3	20	41
C#CCOCCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819225434	DC	On-Demand	Mild	ADRB1	42	38
C#CCOCCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819225434	DC	On-Demand	Mild	ADRB3	20	41
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819225457	FG	On-Demand	Anodyne	ADRB3	40	36
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819225457	FG	On-Demand	Anodyne	PDS	42	36
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819225458	FG	On-Demand	Anodyne	ADRB3	40	36
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819225458	FG	On-Demand	Anodyne	PDS	42	36
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819225459	FG	On-Demand	Anodyne	ADRB3	40	36
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819225459	FG	On-Demand	Anodyne	PDS	42	36
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819225460	FG	On-Demand	Anodyne	ADRB3	40	36
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819225460	FG	On-Demand	Anodyne	PDS	42	36
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819225476	FG	On-Demand	Anodyne	ADRB1	25	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819225477	FG	On-Demand	Anodyne	ADRB1	25	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819225478	FG	On-Demand	Anodyne	ADRB1	25	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819225479	FG	On-Demand	Anodyne	ADRB1	25	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819225492	FG	On-Demand	Anodyne	ADRB2	16	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819225492	FG	On-Demand	Anodyne	ADRB1	24	42
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819225492	FG	On-Demand	Anodyne	ADRB3	22	42
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819225492	FG	On-Demand	Anodyne	CASR	43	42
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819225492	FG	On-Demand	Anodyne	PAPA1_CARPA	30	52
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819225492	FG	On-Demand	Anodyne	REN	16	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819225492	FG	On-Demand	Anodyne	FPR1	44	36
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819225493	FG	On-Demand	Anodyne	ADRB2	16	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819225493	FG	On-Demand	Anodyne	ADRB1	24	42
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819225493	FG	On-Demand	Anodyne	ADRB3	22	42
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819225493	FG	On-Demand	Anodyne	CASR	43	42
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819225493	FG	On-Demand	Anodyne	PAPA1_CARPA	30	52
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819225493	FG	On-Demand	Anodyne	REN	16	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819225493	FG	On-Demand	Anodyne	FPR1	44	36
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819225494	FG	On-Demand	Anodyne	ADRB2	16	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819225494	FG	On-Demand	Anodyne	ADRB1	24	42
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819225494	FG	On-Demand	Anodyne	ADRB3	22	42
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819225494	FG	On-Demand	Anodyne	CASR	43	42
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819225494	FG	On-Demand	Anodyne	PAPA1_CARPA	30	52
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819225494	FG	On-Demand	Anodyne	REN	16	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819225494	FG	On-Demand	Anodyne	FPR1	44	36
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819225495	FG	On-Demand	Anodyne	ADRB2	16	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819225495	FG	On-Demand	Anodyne	ADRB1	24	42
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819225495	FG	On-Demand	Anodyne	ADRB3	22	42
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819225495	FG	On-Demand	Anodyne	CASR	43	42
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819225495	FG	On-Demand	Anodyne	PAPA1_CARPA	30	52
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819225495	FG	On-Demand	Anodyne	REN	16	40
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819225495	FG	On-Demand	Anodyne	FPR1	44	36
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccc(Cl)cc2F)CC1	ZINC000819225507	FE	On-Demand	Anodyne	PARP1	49	39
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(Cl)cc2F)CC1	ZINC000819225508	FE	On-Demand	Anodyne	PARP1	49	39
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccc(Cl)cc2F)CC1	ZINC000819225509	FE	On-Demand	Anodyne	PARP1	49	39
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(Cl)cc2F)CC1	ZINC000819225510	FE	On-Demand	Anodyne	PARP1	49	39
CC(C)(C)OC(=O)NC/C=C\CNCCC(=O)Nc1cccnc1	ZINC000819225522	EE	On-Demand	Anodyne	NAMPT	31	55
CC(C)(C)OC(=O)NC/C=C/CNCCC(=O)Nc1cccnc1	ZINC000819225523	EE	On-Demand	Anodyne	NAMPT	31	55
CN(C)[C@@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819225536	FE	On-Demand	Mild	PAPA1_CARPA	31	40
CN(C)[C@@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819225538	FE	On-Demand	Mild	PAPA1_CARPA	31	40
CN(CCN1CCOCC1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819225595	FD	On-Demand	Mild	PAPA1_CARPA	33	40
CN(CCN1CCOCC1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819225599	FD	On-Demand	Mild	PAPA1_CARPA	33	40
CC(C)(C)OC(=O)NC/C=C/CNCCS(=O)(=O)c1ccccc1	ZINC000819225613	FE	On-Demand	Anodyne	PAPA1_CARPA	28	44
CC(C)(C)OC(=O)NC/C=C/CNCCS(=O)(=O)c1ccccc1	ZINC000819225613	FE	On-Demand	Anodyne	FPR1	41	34
CC(C)(C)OC(=O)NC/C=C\CNCCS(=O)(=O)c1ccccc1	ZINC000819225615	FE	On-Demand	Anodyne	PAPA1_CARPA	28	44
CC(C)(C)OC(=O)NC/C=C\CNCCS(=O)(=O)c1ccccc1	ZINC000819225615	FE	On-Demand	Anodyne	FPR1	41	34
O=C1[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CCCN1c1cccnc1	ZINC000819225623	EF	On-Demand	Anodyne	C3AR1	23	40
O=C1[C@H](NC[C@H](O)c2ccc(Cl)cc2)CCCN1c1cccnc1	ZINC000819225625	EF	On-Demand	Anodyne	C3AR1	23	40
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@H](O)c2c(F)cccc2F)C1	ZINC000819225646	GH	On-Demand	Anodyne	GPR119	17	42
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@H](O)c2c(F)cccc2F)C1	ZINC000819225649	GH	On-Demand	Anodyne	GPR119	17	42
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819225651	GH	On-Demand	Anodyne	GPR119	17	42
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819225653	GH	On-Demand	Anodyne	GPR119	17	42
CC(C)(C)OC(=O)NC/C=C/CNC[C@H](O)C1CCCCC1	ZINC000819225655	DF	On-Demand	Anodyne	REN	31	40
CC(=O)Nc1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819225656	ED	On-Demand	Anodyne	ADRB2	48	58
CC(=O)Nc1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819225656	ED	On-Demand	Anodyne	ADRB1	81	58
CC(=O)Nc1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819225656	ED	On-Demand	Anodyne	ADRB3	54	50
CC(C)(C)OC(=O)NC/C=C\CNC[C@H](O)C1CCCCC1	ZINC000819225657	DF	On-Demand	Anodyne	REN	31	40
CC(=O)Nc1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819225658	ED	On-Demand	Anodyne	ADRB2	48	58
CC(=O)Nc1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819225658	ED	On-Demand	Anodyne	ADRB1	81	58
CC(=O)Nc1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819225658	ED	On-Demand	Anodyne	ADRB3	54	50
CC(C)(C)OC(=O)NC/C=C/CNC[C@@H](O)C1CCCCC1	ZINC000819225659	DF	On-Demand	Anodyne	REN	31	40
CC(C)(C)OC(=O)NC/C=C\CNC[C@@H](O)C1CCCCC1	ZINC000819225661	DF	On-Demand	Anodyne	REN	31	40
Cc1ccc2cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2n1	ZINC000819225714	GI	On-Demand	Mild	PAPA1_CARPA	43	44
Cc1ccc2cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2n1	ZINC000819225715	GI	On-Demand	Mild	PAPA1_CARPA	43	44
Cc1cc(CNC[C@H](O)c2cc(F)ccc2F)ccc1Cl	ZINC000819225768	DH	On-Demand	Anodyne	LEF	65	39
Cc1cc(CNC[C@@H](O)c2cc(F)ccc2F)ccc1Cl	ZINC000819225769	DH	On-Demand	Anodyne	LEF	65	39
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000819225836	FG	On-Demand	Anodyne	ROCK2	15	42
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000819225837	FG	On-Demand	Anodyne	ROCK2	15	42
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000819225838	FG	On-Demand	Anodyne	ROCK2	15	42
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000819225839	FG	On-Demand	Anodyne	ROCK2	15	42
Cc1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)c(C)c1	ZINC000819225847	DD	On-Demand	Anodyne	ADRB2	18	45
Cc1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)c(C)c1	ZINC000819225848	DD	On-Demand	Anodyne	ADRB2	18	45
C[C@@H](CNC[C@H](O)c1ccccc1)c1nccs1	ZINC000819225849	CF	On-Demand	Anodyne	ADRB3	55	41
C[C@H](CNC[C@@H](O)c1ccccc1)c1nccs1	ZINC000819225850	CF	On-Demand	Anodyne	ADRB3	55	41
C[C@@H](CNC[C@@H](O)c1ccccc1)c1nccs1	ZINC000819225851	CF	On-Demand	Anodyne	ADRB3	55	41
C[C@H](CNC[C@H](O)c1ccccc1)c1nccs1	ZINC000819225852	CF	On-Demand	Anodyne	ADRB3	55	41
O=C(Nc1c(F)cccc1N1CCCC1)C(F)=C1CCC1	ZINC000819225877	CH	On-Demand	Anodyne	KCNQ2	70	39
Cc1ccccc1[C@@H](O)CNCCOC(C)C	ZINC000819225932	BE	On-Demand	Anodyne	ADRB2	21	40
Cc1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226045	CD	On-Demand	Anodyne	ADRB2	34	52
Cc1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226045	CD	On-Demand	Anodyne	ADRB1	37	42
Cc1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226045	CD	On-Demand	Anodyne	ADRB3	22	41
Cc1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226046	CD	On-Demand	Anodyne	ADRB2	34	52
Cc1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226046	CD	On-Demand	Anodyne	ADRB1	37	42
Cc1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226046	CD	On-Demand	Anodyne	ADRB3	22	41
C[C@@H](CNC[C@H](O)c1ccc(Cl)cc1)c1nccs1	ZINC000819226115	CG	On-Demand	Anodyne	FFAR2	24	45
C[C@H](CNC[C@H](O)c1ccc(Cl)cc1)c1nccs1	ZINC000819226117	CG	On-Demand	Anodyne	FFAR2	24	45
CCO[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@H]1OC	ZINC000819226162	CE	On-Demand	Anodyne	ADRB1	27	40
CCO[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@H]1OC	ZINC000819226162	CE	On-Demand	Anodyne	ADRB3	43	40
O=C(/C=C\[C@H]1CCCO1)Nc1c(F)cccc1N1CCCC1	ZINC000819226164	DG	On-Demand	Anodyne	KCNQ2	48	34
CCO[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)[C@H]1OC	ZINC000819226165	CE	On-Demand	Anodyne	ADRB1	27	40
CCO[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)[C@H]1OC	ZINC000819226165	CE	On-Demand	Anodyne	ADRB3	43	40
CCO[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@@H]1OC	ZINC000819226166	CE	On-Demand	Anodyne	ADRB1	27	40
CCO[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@@H]1OC	ZINC000819226166	CE	On-Demand	Anodyne	ADRB3	43	40
O=C(/C=C/[C@H]1CCCO1)Nc1c(F)cccc1N1CCCC1	ZINC000819226167	DG	On-Demand	Anodyne	KCNQ2	48	34
CCO[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)[C@@H]1OC	ZINC000819226168	CE	On-Demand	Anodyne	ADRB1	27	40
CCO[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)[C@@H]1OC	ZINC000819226168	CE	On-Demand	Anodyne	ADRB3	43	40
O=C(/C=C/[C@@H]1CCCO1)Nc1c(F)cccc1N1CCCC1	ZINC000819226169	DG	On-Demand	Anodyne	KCNQ2	48	34
O=C(/C=C\[C@@H]1CCCO1)Nc1c(F)cccc1N1CCCC1	ZINC000819226171	DG	On-Demand	Anodyne	KCNQ2	48	34
C[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1nccs1	ZINC000819226180	FF	On-Demand	Anodyne	GPR119	46	43
C[C@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1nccs1	ZINC000819226183	FF	On-Demand	Anodyne	GPR119	46	43
C[C@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1nccs1	ZINC000819226184	FF	On-Demand	Anodyne	GPR119	46	43
C[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1nccs1	ZINC000819226186	FF	On-Demand	Anodyne	GPR119	46	43
C[C@@H](CNC[C@H](O)c1cccc(F)c1)c1nccs1	ZINC000819226187	CF	On-Demand	Anodyne	ADRB1	20	42
C[C@@H](CNC[C@H](O)c1cccc(F)c1)c1nccs1	ZINC000819226187	CF	On-Demand	Anodyne	ADRB3	32	42
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)c1nccs1	ZINC000819226189	CF	On-Demand	Anodyne	ADRB1	20	42
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)c1nccs1	ZINC000819226189	CF	On-Demand	Anodyne	ADRB3	32	42
O=C(Nc1nc(CN2CCN(c3ccccn3)CC2)cs1)C(F)=C1CCC1	ZINC000819226190	GG	On-Demand	Anodyne	DRD4	24	41
O=C(Nc1nc(CN2CCN(c3ccccn3)CC2)cs1)C(F)=C1CCC1	ZINC000819226190	GG	On-Demand	Anodyne	SLC27A1	44	46
C[C@H](CNC[C@H](O)c1cccc(F)c1)c1nccs1	ZINC000819226191	CF	On-Demand	Anodyne	ADRB1	20	42
C[C@H](CNC[C@H](O)c1cccc(F)c1)c1nccs1	ZINC000819226191	CF	On-Demand	Anodyne	ADRB3	32	42
C[C@H](CNC[C@@H](O)c1cccc(F)c1)c1nccs1	ZINC000819226192	CF	On-Demand	Anodyne	ADRB1	20	42
C[C@H](CNC[C@@H](O)c1cccc(F)c1)c1nccs1	ZINC000819226192	CF	On-Demand	Anodyne	ADRB3	32	42
CCOc1cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1C	ZINC000819226234	GH	On-Demand	Mild	PAPA1_CARPA	43	45
CCOc1cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1C	ZINC000819226235	GH	On-Demand	Mild	PAPA1_CARPA	43	45
CCO[C@@H]1C[C@H](NC[C@@H](O)c2cccnc2)[C@@H]1OC	ZINC000819226240	CC	On-Demand	Anodyne	ADRB3	53	38
CCO[C@@H]1C[C@H](NC[C@H](O)c2cccnc2)[C@@H]1OC	ZINC000819226241	CC	On-Demand	Anodyne	ADRB3	53	38
CCO[C@@H]1C[C@H](NC[C@H](O)c2cccnc2)[C@H]1OC	ZINC000819226242	CC	On-Demand	Anodyne	ADRB3	53	38
CCO[C@@H]1C[C@H](NC[C@@H](O)c2cccnc2)[C@H]1OC	ZINC000819226243	CC	On-Demand	Anodyne	ADRB3	53	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1c(F)cccc1N1CCCC1)C2	ZINC000819226265	GG	On-Demand	Anodyne	KCNQ2	63	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1c(F)cccc1N1CCCC1)C2	ZINC000819226266	GG	On-Demand	Anodyne	KCNQ2	63	37
COC(=O)c1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226267	EC	On-Demand	Anodyne	ADRB2	42	45
COC(=O)c1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226267	EC	On-Demand	Anodyne	ADRB1	59	41
COC(=O)c1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226267	EC	On-Demand	Anodyne	ADRB3	42	42
COC(=O)c1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226268	EC	On-Demand	Anodyne	ADRB2	42	45
COC(=O)c1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226268	EC	On-Demand	Anodyne	ADRB1	59	41
COC(=O)c1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226268	EC	On-Demand	Anodyne	ADRB3	42	42
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)c1nccs1	ZINC000819226349	CG	On-Demand	Anodyne	ADRB2	15	42
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)c1nccs1	ZINC000819226349	CG	On-Demand	Anodyne	ADRB1	40	44
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)c1nccs1	ZINC000819226349	CG	On-Demand	Anodyne	ADRB3	60	44
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)c1nccs1	ZINC000819226350	CG	On-Demand	Anodyne	ADRB2	15	42
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)c1nccs1	ZINC000819226350	CG	On-Demand	Anodyne	ADRB1	40	44
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)c1nccs1	ZINC000819226350	CG	On-Demand	Anodyne	ADRB3	60	44
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)c1nccs1	ZINC000819226351	CG	On-Demand	Anodyne	ADRB2	15	42
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)c1nccs1	ZINC000819226351	CG	On-Demand	Anodyne	ADRB1	40	44
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)c1nccs1	ZINC000819226351	CG	On-Demand	Anodyne	ADRB3	60	44
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)c1nccs1	ZINC000819226353	CG	On-Demand	Anodyne	ADRB2	15	42
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)c1nccs1	ZINC000819226353	CG	On-Demand	Anodyne	ADRB1	40	44
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)c1nccs1	ZINC000819226353	CG	On-Demand	Anodyne	ADRB3	60	44
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226368	GH	On-Demand	Mild	PAPA1_CARPA	42	43
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226368	GH	On-Demand	Mild	CCKAR	47	37
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226368	GH	On-Demand	Mild	CTSK	15	40
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226368	GH	On-Demand	Mild	PTPN1	20	40
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226368	GH	On-Demand	Mild	FPR1	52	40
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226373	GH	On-Demand	Mild	PAPA1_CARPA	42	43
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226373	GH	On-Demand	Mild	CCKAR	47	37
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226373	GH	On-Demand	Mild	CTSK	15	40
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226373	GH	On-Demand	Mild	PTPN1	20	40
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226373	GH	On-Demand	Mild	FPR1	52	40
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226374	GH	On-Demand	Mild	PAPA1_CARPA	42	43
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226374	GH	On-Demand	Mild	CCKAR	47	37
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226374	GH	On-Demand	Mild	CTSK	15	40
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226374	GH	On-Demand	Mild	PTPN1	20	40
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226374	GH	On-Demand	Mild	FPR1	52	40
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226376	GH	On-Demand	Mild	PAPA1_CARPA	42	43
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226376	GH	On-Demand	Mild	CCKAR	47	37
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226376	GH	On-Demand	Mild	CTSK	15	40
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226376	GH	On-Demand	Mild	PTPN1	20	40
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819226376	GH	On-Demand	Mild	FPR1	52	40
O[C@@H](CNCc1nc2ccccc2n1C1CC1)c1cccnc1	ZINC000819226384	DF	On-Demand	Anodyne	ADRB3	81	48
O[C@H](CNCc1nc2ccccc2n1C1CC1)c1cccnc1	ZINC000819226385	DF	On-Demand	Anodyne	ADRB3	81	48
COC(=O)c1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226401	EC	On-Demand	Anodyne	ADRB2	49	49
COC(=O)c1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226401	EC	On-Demand	Anodyne	ADRB1	83	49
COC(=O)c1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226401	EC	On-Demand	Anodyne	ADRB3	53	49
COC(=O)c1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226402	EC	On-Demand	Anodyne	ADRB2	49	49
COC(=O)c1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226402	EC	On-Demand	Anodyne	ADRB1	83	49
COC(=O)c1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226402	EC	On-Demand	Anodyne	ADRB3	53	49
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819226415	ED	On-Demand	Anodyne	KCNQ2	47	34
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819226416	ED	On-Demand	Anodyne	KCNQ2	47	34
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819226417	ED	On-Demand	Anodyne	KCNQ2	47	34
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819226418	ED	On-Demand	Anodyne	KCNQ2	47	34
CN(C)CC1(CNC[C@H](O)c2ccccc2Cl)CCCC1	ZINC000819226421	DG	On-Demand	Anodyne	OPRL1	19	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC(C)(C)CCc1ccccc1)C2	ZINC000819226428	FG	On-Demand	Anodyne	FKBP1A	40	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC(C)(C)CCc1ccccc1)C2	ZINC000819226429	FG	On-Demand	Anodyne	FKBP1A	40	36
CCOc1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226497	ED	On-Demand	Anodyne	ADRB2	36	41
CCOc1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226497	ED	On-Demand	Anodyne	ADRB1	39	42
CCOc1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226497	ED	On-Demand	Anodyne	ADRB3	23	41
CCOc1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226498	ED	On-Demand	Anodyne	ADRB2	36	41
CCOc1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226498	ED	On-Demand	Anodyne	ADRB1	39	42
CCOc1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226498	ED	On-Demand	Anodyne	ADRB3	23	41
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H]1CCCC[C@H]1C	ZINC000819226510	FI	On-Demand	Mild	PAPA1_CARPA	33	42
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H]1CCCC[C@H]1C	ZINC000819226511	FI	On-Demand	Mild	PAPA1_CARPA	33	42
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H]1CCCC[C@@H]1C	ZINC000819226512	FI	On-Demand	Mild	PAPA1_CARPA	33	42
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H]1CCCC[C@@H]1C	ZINC000819226513	FI	On-Demand	Mild	PAPA1_CARPA	33	42
COc1cccc(OC)c1OC[C@H](O)CNC1COC(C)(C)OC1	ZINC000819226593	ED	On-Demand	Anodyne	ADRB2	31	44
COc1cccc(OC)c1OC[C@H](O)CNC1COC(C)(C)OC1	ZINC000819226593	ED	On-Demand	Anodyne	ADRB1	24	44
COc1cccc(OC)c1OC[C@@H](O)CNC1COC(C)(C)OC1	ZINC000819226594	ED	On-Demand	Anodyne	ADRB2	31	44
COc1cccc(OC)c1OC[C@@H](O)CNC1COC(C)(C)OC1	ZINC000819226594	ED	On-Demand	Anodyne	ADRB1	24	44
CC(=O)c1cccc(OC[C@@H](O)CNC2COC(C)(C)OC2)c1	ZINC000819226597	DD	On-Demand	Anodyne	ADRB2	29	47
CC(=O)c1cccc(OC[C@@H](O)CNC2COC(C)(C)OC2)c1	ZINC000819226597	DD	On-Demand	Anodyne	ADRB1	36	42
CC(=O)c1cccc(OC[C@@H](O)CNC2COC(C)(C)OC2)c1	ZINC000819226597	DD	On-Demand	Anodyne	ADRB3	27	42
CC(=O)c1cccc(OC[C@@H](O)CNC2COC(C)(C)OC2)c1	ZINC000819226597	DD	On-Demand	Anodyne	ABCB1	16	45
CC(=O)c1cccc(OC[C@H](O)CNC2COC(C)(C)OC2)c1	ZINC000819226598	DD	On-Demand	Anodyne	ADRB2	29	47
CC(=O)c1cccc(OC[C@H](O)CNC2COC(C)(C)OC2)c1	ZINC000819226598	DD	On-Demand	Anodyne	ADRB1	36	42
CC(=O)c1cccc(OC[C@H](O)CNC2COC(C)(C)OC2)c1	ZINC000819226598	DD	On-Demand	Anodyne	ADRB3	27	42
CC(=O)c1cccc(OC[C@H](O)CNC2COC(C)(C)OC2)c1	ZINC000819226598	DD	On-Demand	Anodyne	ABCB1	16	45
COCCc1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226599	ED	On-Demand	Anodyne	ADRB2	41	58
COCCc1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226599	ED	On-Demand	Anodyne	ADRB1	63	58
COCCc1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226599	ED	On-Demand	Anodyne	ADRB3	45	42
COCCc1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226600	ED	On-Demand	Anodyne	ADRB2	41	58
COCCc1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226600	ED	On-Demand	Anodyne	ADRB1	63	58
COCCc1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226600	ED	On-Demand	Anodyne	ADRB3	45	42
COc1cccc([S@@](=O)CC(=O)NCCSC(C)(C)C)c1	ZINC000819226607	EE	On-Demand	Anodyne	MTNR1A	50	44
COc1cccc([S@@](=O)CC(=O)NCCSC(C)(C)C)c1	ZINC000819226607	EE	On-Demand	Anodyne	MTNR1B	44	44
CN(C)CC1(CNC[C@H](O)c2ccccc2)CCCC1	ZINC000819226615	CE	On-Demand	Anodyne	AOC3	19	41
CN(C)CC1(CNC[C@@H](O)c2ccccc2)CCCC1	ZINC000819226616	CE	On-Demand	Anodyne	AOC3	19	41
CC(=O)Nc1cccc(CC(=O)Nc2ccc(NC(=O)OC(C)(C)C)nc2)c1	ZINC000819226617	GH	On-Demand	Anodyne	KCNK3	46	33
CC(=O)Nc1cccc(CC(=O)Nc2ccc(NC(=O)OC(C)(C)C)nc2)c1	ZINC000819226617	GH	On-Demand	Anodyne	KCNK9	44	33
O=C(NCc1ccc2c(c1)OCCCO2)C(F)=C1CCC1	ZINC000819226618	CF	On-Demand	Anodyne	NOS2	50	32
CN(C)CC1(CNC[C@H](O)c2ccc(Cl)cc2)CCCC1	ZINC000819226623	DG	On-Demand	Anodyne	UTS2	41	33
Cc1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226632	CD	On-Demand	Anodyne	ADRB2	49	51
Cc1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226632	CD	On-Demand	Anodyne	ADRB1	68	45
Cc1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226632	CD	On-Demand	Anodyne	ADRB3	43	45
Cc1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226633	CD	On-Demand	Anodyne	ADRB2	49	51
Cc1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226633	CD	On-Demand	Anodyne	ADRB1	68	45
Cc1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226633	CD	On-Demand	Anodyne	ADRB3	43	45
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(S(=O)(=O)N(C)C)c1	ZINC000819226639	FD	On-Demand	Anodyne	KCNQ2	48	35
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(S(=O)(=O)N(C)C)c1	ZINC000819226640	FD	On-Demand	Anodyne	KCNQ2	48	35
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(S(=O)(=O)N(C)C)c1	ZINC000819226642	FD	On-Demand	Anodyne	KCNQ2	48	35
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(S(=O)(=O)N(C)C)c1	ZINC000819226644	FD	On-Demand	Anodyne	KCNQ2	48	35
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1nc2ccccc2n1C1CC1	ZINC000819226654	FF	On-Demand	Anodyne	FPR2	22	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1nc2ccccc2n1C1CC1	ZINC000819226657	FF	On-Demand	Anodyne	FPR2	22	40
C[C@@H](CC(=O)N1CCC(NC(=O)Oc2ccccc2)CC1)n1cccn1	ZINC000819226664	FF	On-Demand	Anodyne	PTAFR	17	45
C[C@@H](CC(=O)N1CCC(NC(=O)Oc2ccccc2)CC1)n1cccn1	ZINC000819226664	FF	On-Demand	Anodyne	C3AR1	43	40
C[C@@H](CC(=O)N1CCC(NC(=O)Oc2ccccc2)CC1)n1cccn1	ZINC000819226664	FF	On-Demand	Anodyne	FAAH	31	41
C[C@@H](CC(=O)N1CCC(NC(=O)Oc2ccccc2)CC1)n1cccn1	ZINC000819226664	FF	On-Demand	Anodyne	EPHX2	27	42
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](c2ccccc2)CC1	ZINC000819226681	CH	On-Demand	Anodyne	SLC18A3	50	42
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](c2ccccc2)CC1	ZINC000819226681	CH	On-Demand	Anodyne	LIPE	15	46
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](c2ccccc2)CC1	ZINC000819226681	CH	On-Demand	Anodyne	ADAM10	15	41
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](c2ccccc2)CC1	ZINC000819226682	CH	On-Demand	Anodyne	SLC18A3	50	42
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](c2ccccc2)CC1	ZINC000819226682	CH	On-Demand	Anodyne	LIPE	15	46
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](c2ccccc2)CC1	ZINC000819226682	CH	On-Demand	Anodyne	ADAM10	15	41
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](c2ccccc2)CC1	ZINC000819226684	CH	On-Demand	Anodyne	SLC18A3	50	42
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](c2ccccc2)CC1	ZINC000819226684	CH	On-Demand	Anodyne	LIPE	15	46
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](c2ccccc2)CC1	ZINC000819226684	CH	On-Demand	Anodyne	ADAM10	15	41
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H](c2ccccc2)CC1	ZINC000819226686	CH	On-Demand	Anodyne	SLC18A3	50	42
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H](c2ccccc2)CC1	ZINC000819226686	CH	On-Demand	Anodyne	LIPE	15	46
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H](c2ccccc2)CC1	ZINC000819226686	CH	On-Demand	Anodyne	ADAM10	15	41
O[C@@H](CNCc1nc2ccccc2n1C1CC1)c1ccccc1Cl	ZINC000819226707	EH	On-Demand	Anodyne	OPRL1	46	38
CC(=O)CCc1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226717	FD	On-Demand	Anodyne	ADRB2	47	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226717	FD	On-Demand	Anodyne	ADRB1	75	48
CC(=O)CCc1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226717	FD	On-Demand	Anodyne	ADRB3	55	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226717	FD	On-Demand	Anodyne	ABCB1	21	42
CC(=O)CCc1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226718	FD	On-Demand	Anodyne	ADRB2	47	43
CC(=O)CCc1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226718	FD	On-Demand	Anodyne	ADRB1	75	48
CC(=O)CCc1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226718	FD	On-Demand	Anodyne	ADRB3	55	43
CC(=O)CCc1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226718	FD	On-Demand	Anodyne	ABCB1	21	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1(c3cccc(C(F)(F)F)c3)CC1)C2	ZINC000819226800	GH	On-Demand	Anodyne	CCR2	54	38
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2COC(C)(C)OC2)CC1	ZINC000819226801	FD	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2COC(C)(C)OC2)CC1	ZINC000819226802	FD	On-Demand	Anodyne	GPR119	26	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1(c3cccc(C(F)(F)F)c3)CC1)C2	ZINC000819226803	GH	On-Demand	Anodyne	CCR2	54	38
O=C(NC1CCN(C(=O)c2cc3c(cn2)OCCO3)CC1)Oc1ccccc1	ZINC000819226814	GE	On-Demand	Anodyne	FAAH	32	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1sc(-c3ccccc3)nc1C)C2	ZINC000819226826	GH	On-Demand	Anodyne	PDE8B	51	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1sc(-c3ccccc3)nc1C)C2	ZINC000819226826	GH	On-Demand	Anodyne	VHL	48	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1sc(-c3ccccc3)nc1C)C2	ZINC000819226828	GH	On-Demand	Anodyne	PDE8B	51	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1sc(-c3ccccc3)nc1C)C2	ZINC000819226828	GH	On-Demand	Anodyne	VHL	48	32
C[C@@H](CNC[C@@H](O)c1cccnc1)c1nccs1	ZINC000819226843	CD	On-Demand	Anodyne	ADRB2	25	46
C[C@@H](CNC[C@@H](O)c1cccnc1)c1nccs1	ZINC000819226843	CD	On-Demand	Anodyne	ADRB1	29	47
C[C@@H](CNC[C@@H](O)c1cccnc1)c1nccs1	ZINC000819226843	CD	On-Demand	Anodyne	ADRB3	100	47
C[C@@H](CNC[C@H](O)c1cccnc1)c1nccs1	ZINC000819226845	CD	On-Demand	Anodyne	ADRB2	25	46
C[C@@H](CNC[C@H](O)c1cccnc1)c1nccs1	ZINC000819226845	CD	On-Demand	Anodyne	ADRB1	29	47
C[C@@H](CNC[C@H](O)c1cccnc1)c1nccs1	ZINC000819226845	CD	On-Demand	Anodyne	ADRB3	100	47
C[C@H](CNC[C@H](O)c1cccnc1)c1nccs1	ZINC000819226847	CD	On-Demand	Anodyne	ADRB2	25	46
C[C@H](CNC[C@H](O)c1cccnc1)c1nccs1	ZINC000819226847	CD	On-Demand	Anodyne	ADRB1	29	47
C[C@H](CNC[C@H](O)c1cccnc1)c1nccs1	ZINC000819226847	CD	On-Demand	Anodyne	ADRB3	100	47
C[C@H](CNC[C@@H](O)c1cccnc1)c1nccs1	ZINC000819226849	CD	On-Demand	Anodyne	ADRB2	25	46
C[C@H](CNC[C@@H](O)c1cccnc1)c1nccs1	ZINC000819226849	CD	On-Demand	Anodyne	ADRB1	29	47
C[C@H](CNC[C@@H](O)c1cccnc1)c1nccs1	ZINC000819226849	CD	On-Demand	Anodyne	ADRB3	100	47
COc1nc(C)cc(C)c1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819226872	GF	On-Demand	Mild	PAPA1_CARPA	44	48
COc1nc(C)cc(C)c1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819226874	GF	On-Demand	Mild	PAPA1_CARPA	44	48
CC(=O)c1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226879	DD	On-Demand	Anodyne	ADRB2	34	43
CC(=O)c1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226879	DD	On-Demand	Anodyne	ADRB1	49	42
CC(=O)c1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226879	DD	On-Demand	Anodyne	ADRB3	31	41
CC(=O)c1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226881	DD	On-Demand	Anodyne	ADRB2	34	43
CC(=O)c1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226881	DD	On-Demand	Anodyne	ADRB1	49	42
CC(=O)c1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226881	DD	On-Demand	Anodyne	ADRB3	31	41
COc1ccc2cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc2n1	ZINC000819226909	GH	On-Demand	Mild	PAPA1_CARPA	40	43
COc1ccc2cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc2n1	ZINC000819226911	GH	On-Demand	Mild	PAPA1_CARPA	40	43
CSc1ccc(OC[C@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226914	ED	On-Demand	Anodyne	ADRB1	28	40
CSc1ccc(OC[C@@H](O)CNC2COC(C)(C)OC2)cc1	ZINC000819226916	ED	On-Demand	Anodyne	ADRB1	28	40
CN(C)CC1(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCCC1	ZINC000819226919	GF	On-Demand	Anodyne	GPR119	29	41
CN(C)CC1(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCCC1	ZINC000819226922	GF	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COC(C)(C)OC1	ZINC000819226925	GE	On-Demand	Anodyne	CTSD	111	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COC(C)(C)OC1	ZINC000819226925	GE	On-Demand	Anodyne	PGC	60	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COC(C)(C)OC1	ZINC000819226925	GE	On-Demand	Anodyne	PAPA1_CARPA	34	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COC(C)(C)OC1	ZINC000819226925	GE	On-Demand	Anodyne	BACE2	53	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COC(C)(C)OC1	ZINC000819226925	GE	On-Demand	Anodyne	REN	80	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COC(C)(C)OC1	ZINC000819226925	GE	On-Demand	Anodyne	REN1	18	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COC(C)(C)OC1	ZINC000819226925	GE	On-Demand	Anodyne	BACE1	91	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COC(C)(C)OC1	ZINC000819226925	GE	On-Demand	Anodyne	FPR1	50	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COC(C)(C)OC1	ZINC000819226925	GE	On-Demand	Anodyne	PLM2_PLAFA	49	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COC(C)(C)OC1	ZINC000819226925	GE	On-Demand	Anodyne	GAG-PRO	45	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COC(C)(C)OC1	ZINC000819226925	GE	On-Demand	Anodyne	Q82323_9DELA	63	31
CC(=O)c1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226936	DD	On-Demand	Anodyne	ADRB2	46	45
CC(=O)c1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226936	DD	On-Demand	Anodyne	ADRB1	81	45
CC(=O)c1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226936	DD	On-Demand	Anodyne	ADRB3	50	45
CC(=O)c1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226936	DD	On-Demand	Anodyne	ABCB1	16	59
CC(=O)c1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226938	DD	On-Demand	Anodyne	ADRB2	46	45
CC(=O)c1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226938	DD	On-Demand	Anodyne	ADRB1	81	45
CC(=O)c1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226938	DD	On-Demand	Anodyne	ADRB3	50	45
CC(=O)c1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226938	DD	On-Demand	Anodyne	ABCB1	16	59
CCO[C@@H]1C[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)[C@H]1OC	ZINC000819226939	DD	On-Demand	Bother	CACNA1C	51	38
CCO[C@@H]1C[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)[C@H]1OC	ZINC000819226939	DD	On-Demand	Bother	CACNA1D	80	36
CCO[C@@H]1C[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@H]1OC	ZINC000819226940	DD	On-Demand	Bother	CACNA1C	51	38
CCO[C@@H]1C[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@H]1OC	ZINC000819226940	DD	On-Demand	Bother	CACNA1D	80	36
CCO[C@@H]1C[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@H]1OC	ZINC000819226941	DD	On-Demand	Bother	CACNA1C	51	38
CCO[C@@H]1C[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@H]1OC	ZINC000819226941	DD	On-Demand	Bother	CACNA1D	80	36
CCO[C@@H]1C[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@@H]1OC	ZINC000819226943	DD	On-Demand	Bother	CACNA1C	51	38
CCO[C@@H]1C[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@@H]1OC	ZINC000819226943	DD	On-Demand	Bother	CACNA1D	80	36
CSc1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226972	ED	On-Demand	Anodyne	ADRB2	41	43
CSc1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226972	ED	On-Demand	Anodyne	ADRB1	63	43
CSc1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226972	ED	On-Demand	Anodyne	ADRB3	38	43
CSc1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226974	ED	On-Demand	Anodyne	ADRB2	41	43
CSc1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226974	ED	On-Demand	Anodyne	ADRB1	63	43
CSc1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819226974	ED	On-Demand	Anodyne	ADRB3	38	43
Cc1ccc(OC[C@H](O)CN[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)cc1	ZINC000819227027	GE	On-Demand	Mild	ADRB2	15	42
Cc1ccc(OC[C@H](O)CN[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)cc1	ZINC000819227029	GE	On-Demand	Mild	ADRB2	15	42
Cc1ccc(OC[C@H](O)CN[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2C#N)cc1	ZINC000819227030	GE	On-Demand	Mild	ADRB2	15	42
Cc1ccc(OC[C@H](O)CN[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C#N)cc1	ZINC000819227032	GE	On-Demand	Mild	ADRB2	15	42
Cc1nnc([C@@H](C)NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000819227034	FF	On-Demand	Anodyne	GPR119	39	45
Cc1nnc([C@@H](C)NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000819227037	FF	On-Demand	Anodyne	GPR119	39	45
Cc1csc([C@H](C)CNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819227044	DH	On-Demand	Anodyne	ADRB1	32	45
Cc1csc([C@H](C)CNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819227044	DH	On-Demand	Anodyne	ADRB3	52	42
Cc1csc([C@H](C)CNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819227046	DH	On-Demand	Anodyne	ADRB1	32	45
Cc1csc([C@H](C)CNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819227046	DH	On-Demand	Anodyne	ADRB3	52	42
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819227057	FE	On-Demand	Mild	PAPA1_CARPA	16	41
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819227059	FE	On-Demand	Mild	PAPA1_CARPA	16	41
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819227061	FE	On-Demand	Mild	PAPA1_CARPA	16	41
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819227063	FE	On-Demand	Mild	PAPA1_CARPA	16	41
Cc1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)c(C)c1	ZINC000819227122	DD	On-Demand	Anodyne	ADRB2	18	44
Cc1ccc(OC[C@H](O)CNCCC2(C)OCCO2)c(C)c1	ZINC000819227124	DD	On-Demand	Anodyne	ADRB2	18	44
Cc1csc([C@H](C)CNC[C@@H](O)c2cccc(F)c2)n1	ZINC000819227139	CG	On-Demand	Anodyne	ADRB3	22	41
Cc1csc([C@H](C)CNC[C@H](O)c2cccc(F)c2)n1	ZINC000819227140	CG	On-Demand	Anodyne	ADRB3	22	41
C#CCOCCNC[C@H](O)COc1ccccc1C	ZINC000819227148	CC	On-Demand	Mild	ADRB2	43	60
C#CCOCCNC[C@H](O)COc1ccccc1C	ZINC000819227148	CC	On-Demand	Mild	ADRB1	71	39
C#CCOCCNC[C@H](O)COc1ccccc1C	ZINC000819227148	CC	On-Demand	Mild	ADRB3	19	41
C#CCOCCNC[C@H](O)COc1ccccc1C	ZINC000819227148	CC	On-Demand	Mild	ABCB1	28	41
C#CCOCCNC[C@@H](O)COc1ccccc1C	ZINC000819227149	CC	On-Demand	Mild	ADRB2	43	60
C#CCOCCNC[C@@H](O)COc1ccccc1C	ZINC000819227149	CC	On-Demand	Mild	ADRB1	71	39
C#CCOCCNC[C@@H](O)COc1ccccc1C	ZINC000819227149	CC	On-Demand	Mild	ADRB3	19	41
C#CCOCCNC[C@@H](O)COc1ccccc1C	ZINC000819227149	CC	On-Demand	Mild	ABCB1	28	41
C[C@H](CCNC[C@H](O)c1cccc([N+](=O)[O-])c1)N1CCCCC1	ZINC000819227150	DE	On-Demand	Bother	ADRB3	44	35
C[C@H](CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1)N1CCCCC1	ZINC000819227151	DE	On-Demand	Bother	ADRB3	44	35
C[C@@H](CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1)N1CCCCC1	ZINC000819227152	DE	On-Demand	Bother	ADRB3	44	35
C[C@@H](CCNC[C@H](O)c1cccc([N+](=O)[O-])c1)N1CCCCC1	ZINC000819227153	DE	On-Demand	Bother	ADRB3	44	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227154	EE	On-Demand	Anodyne	GRIN2B	51	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227154	EE	On-Demand	Anodyne	PGC	52	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227154	EE	On-Demand	Anodyne	CCKAR	20	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227154	EE	On-Demand	Anodyne	REN	87	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227154	EE	On-Demand	Anodyne	ABCB1	15	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227154	EE	On-Demand	Anodyne	FPR1	46	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227154	EE	On-Demand	Anodyne	AMP1_PLAFQ	15	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227154	EE	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227154	EE	On-Demand	Anodyne	CCR8	27	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227154	EE	On-Demand	Anodyne	GPR119	46	45
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227154	EE	On-Demand	Anodyne	SFRP1	26	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227155	EE	On-Demand	Anodyne	GRIN2B	51	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227155	EE	On-Demand	Anodyne	PGC	52	34
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227155	EE	On-Demand	Anodyne	CCKAR	20	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227155	EE	On-Demand	Anodyne	REN	87	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227155	EE	On-Demand	Anodyne	ABCB1	15	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227155	EE	On-Demand	Anodyne	FPR1	46	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227155	EE	On-Demand	Anodyne	AMP1_PLAFQ	15	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227155	EE	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227155	EE	On-Demand	Anodyne	CCR8	27	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227155	EE	On-Demand	Anodyne	GPR119	46	45
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819227155	EE	On-Demand	Anodyne	SFRP1	26	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227156	EE	On-Demand	Anodyne	GRIN2B	51	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227156	EE	On-Demand	Anodyne	PGC	52	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227156	EE	On-Demand	Anodyne	CCKAR	20	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227156	EE	On-Demand	Anodyne	REN	87	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227156	EE	On-Demand	Anodyne	ABCB1	15	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227156	EE	On-Demand	Anodyne	FPR1	46	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227156	EE	On-Demand	Anodyne	AMP1_PLAFQ	15	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227156	EE	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227156	EE	On-Demand	Anodyne	CCR8	27	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227156	EE	On-Demand	Anodyne	GPR119	46	45
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227156	EE	On-Demand	Anodyne	SFRP1	26	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227157	EE	On-Demand	Anodyne	GRIN2B	51	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227157	EE	On-Demand	Anodyne	PGC	52	34
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227157	EE	On-Demand	Anodyne	CCKAR	20	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227157	EE	On-Demand	Anodyne	REN	87	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227157	EE	On-Demand	Anodyne	ABCB1	15	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227157	EE	On-Demand	Anodyne	FPR1	46	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227157	EE	On-Demand	Anodyne	AMP1_PLAFQ	15	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227157	EE	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227157	EE	On-Demand	Anodyne	CCR8	27	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227157	EE	On-Demand	Anodyne	GPR119	46	45
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819227157	EE	On-Demand	Anodyne	SFRP1	26	43
C#CCOCCNC[C@@H](O)COc1cccc(Br)c1	ZINC000819227175	ED	On-Demand	Mild	ADRB2	36	43
C#CCOCCNC[C@@H](O)COc1cccc(Br)c1	ZINC000819227175	ED	On-Demand	Mild	ADRB1	56	44
C#CCOCCNC[C@@H](O)COc1cccc(Br)c1	ZINC000819227175	ED	On-Demand	Mild	ADRB3	29	44
CCO[C@@H]1C[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)[C@@H]1OC	ZINC000819227178	FD	On-Demand	Anodyne	GPR119	20	41
CCO[C@@H]1C[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)[C@H]1OC	ZINC000819227179	FD	On-Demand	Anodyne	GPR119	20	41
CCO[C@@H]1C[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)[C@@H]1OC	ZINC000819227180	FD	On-Demand	Anodyne	GPR119	20	41
CCO[C@@H]1C[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)[C@H]1OC	ZINC000819227181	FD	On-Demand	Anodyne	GPR119	20	41
C#CCOCCNC[C@H](O)COc1cccc(Br)c1	ZINC000819227192	ED	On-Demand	Mild	ADRB2	36	43
C#CCOCCNC[C@H](O)COc1cccc(Br)c1	ZINC000819227192	ED	On-Demand	Mild	ADRB1	56	44
C#CCOCCNC[C@H](O)COc1cccc(Br)c1	ZINC000819227192	ED	On-Demand	Mild	ADRB3	29	44
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(F)cn2)C1	ZINC000819227195	EE	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(F)cn2)C1	ZINC000819227195	EE	On-Demand	Anodyne	GPR119	56	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819227198	EE	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819227198	EE	On-Demand	Anodyne	GPR119	56	43
CON(C)C(=O)CCNCc1nc2ccccc2n1C1CC1	ZINC000819227200	DD	On-Demand	Anodyne	FPR2	23	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819227201	EE	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819227201	EE	On-Demand	Anodyne	GPR119	56	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(F)cn2)C1	ZINC000819227203	EE	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(F)cn2)C1	ZINC000819227203	EE	On-Demand	Anodyne	GPR119	56	43
C#CCOCCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819227206	DD	On-Demand	Mild	ADRB2	47	44
C#CCOCCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819227206	DD	On-Demand	Mild	ADRB1	65	45
C#CCOCCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819227206	DD	On-Demand	Mild	ADRB3	35	45
C#CCOCCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819227208	DD	On-Demand	Mild	ADRB2	47	44
C#CCOCCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819227208	DD	On-Demand	Mild	ADRB1	65	45
C#CCOCCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819227208	DD	On-Demand	Mild	ADRB3	35	45
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227216	GE	On-Demand	Anodyne	ADRB2	21	41
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227216	GE	On-Demand	Anodyne	ADRB1	42	38
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227216	GE	On-Demand	Anodyne	ADRB3	28	46
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227216	GE	On-Demand	Anodyne	ABCB1	26	48
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227216	GE	On-Demand	Anodyne	CACNA1I	41	34
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227216	GE	On-Demand	Anodyne	GPR119	40	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227218	GE	On-Demand	Anodyne	ADRB2	21	41
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227218	GE	On-Demand	Anodyne	ADRB1	42	38
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227218	GE	On-Demand	Anodyne	ADRB3	28	46
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227218	GE	On-Demand	Anodyne	ABCB1	26	48
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227218	GE	On-Demand	Anodyne	CACNA1I	41	34
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227218	GE	On-Demand	Anodyne	GPR119	40	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227220	GE	On-Demand	Anodyne	ADRB2	21	41
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227220	GE	On-Demand	Anodyne	ADRB1	42	38
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227220	GE	On-Demand	Anodyne	ADRB3	28	46
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227220	GE	On-Demand	Anodyne	ABCB1	26	48
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227220	GE	On-Demand	Anodyne	CACNA1I	41	34
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227220	GE	On-Demand	Anodyne	GPR119	40	40
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227224	GE	On-Demand	Anodyne	ADRB2	21	41
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227224	GE	On-Demand	Anodyne	ADRB1	42	38
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227224	GE	On-Demand	Anodyne	ADRB3	28	46
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227224	GE	On-Demand	Anodyne	ABCB1	26	48
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227224	GE	On-Demand	Anodyne	CACNA1I	41	34
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819227224	GE	On-Demand	Anodyne	GPR119	40	40
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](N2CCCC2)C1	ZINC000819227231	CD	On-Demand	Anodyne	L3MBTL3	87	47
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](N2CCCC2)C1	ZINC000819227232	CD	On-Demand	Anodyne	L3MBTL3	87	47
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](N2CCCC2)C1	ZINC000819227233	CD	On-Demand	Anodyne	L3MBTL3	87	47
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](N2CCCC2)C1	ZINC000819227237	CD	On-Demand	Anodyne	L3MBTL3	87	47
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(SC(F)F)c1	ZINC000819227251	CH	On-Demand	Anodyne	ITGAL	41	31
C#CCOCCNC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819227253	CC	On-Demand	Mild	ADRB1	43	39
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(SC(F)F)c1	ZINC000819227254	CH	On-Demand	Anodyne	ITGAL	41	31
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(SC(F)F)c1	ZINC000819227255	CH	On-Demand	Anodyne	ITGAL	41	31
C#CCOCCNC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819227257	CC	On-Demand	Mild	ADRB1	43	39
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(SC(F)F)c1	ZINC000819227259	CH	On-Demand	Anodyne	ITGAL	41	31
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2COc3cc(F)cc(F)c32)CC1	ZINC000819227292	GF	On-Demand	Anodyne	GPR119	34	47
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2COc3cc(F)cc(F)c32)CC1	ZINC000819227297	GF	On-Demand	Anodyne	GPR119	34	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2COc3cc(F)cc(F)c32)CC1	ZINC000819227299	GF	On-Demand	Anodyne	GPR119	34	47
COC(=O)c1ccc(OC[C@H](O)CNC2CC(OC)C2)cc1	ZINC000819227301	DC	On-Demand	Anodyne	ADRB2	47	47
COC(=O)c1ccc(OC[C@H](O)CNC2CC(OC)C2)cc1	ZINC000819227301	DC	On-Demand	Anodyne	ADRB1	68	43
COC(=O)c1ccc(OC[C@H](O)CNC2CC(OC)C2)cc1	ZINC000819227301	DC	On-Demand	Anodyne	ADRB3	52	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2COc3cc(F)cc(F)c32)CC1	ZINC000819227304	GF	On-Demand	Anodyne	GPR119	34	47
O=C(NC1CCN(C(=O)Cc2nsc3ccccc23)CC1)Oc1ccccc1	ZINC000819227305	GH	On-Demand	Anodyne	C3AR1	40	38
O=C(NC1CCN(C(=O)Cc2nsc3ccccc23)CC1)Oc1ccccc1	ZINC000819227305	GH	On-Demand	Anodyne	FAAH	30	43
O=C(NC1CCN(C(=O)Cc2nsc3ccccc23)CC1)Oc1ccccc1	ZINC000819227305	GH	On-Demand	Anodyne	EPHX2	25	42
O=C(NC1CCN(C(=O)Cc2nsc3ccccc23)CC1)Oc1ccccc1	ZINC000819227305	GH	On-Demand	Anodyne	CCR8	50	35
C#CCOCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819227307	CD	On-Demand	Mild	ADRB2	23	61
C#CCOCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819227307	CD	On-Demand	Mild	ADRB1	65	61
COC(=O)c1ccc(OC[C@@H](O)CNC2CC(OC)C2)cc1	ZINC000819227309	DC	On-Demand	Anodyne	ADRB2	47	47
COC(=O)c1ccc(OC[C@@H](O)CNC2CC(OC)C2)cc1	ZINC000819227309	DC	On-Demand	Anodyne	ADRB1	68	43
COC(=O)c1ccc(OC[C@@H](O)CNC2CC(OC)C2)cc1	ZINC000819227309	DC	On-Demand	Anodyne	ADRB3	52	44
C#CCOCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819227312	CD	On-Demand	Mild	ADRB2	23	61
C#CCOCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819227312	CD	On-Demand	Mild	ADRB1	65	61
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2ccccc2)C1	ZINC000819227326	EF	On-Demand	Anodyne	CCR8	49	43
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2ccccc2)C1	ZINC000819227326	EF	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2ccccc2)C1	ZINC000819227326	EF	On-Demand	Anodyne	SFRP1	27	42
CCOc1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819227333	ED	On-Demand	Anodyne	ADRB2	49	45
CCOc1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819227333	ED	On-Demand	Anodyne	ADRB1	68	45
CCOc1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819227333	ED	On-Demand	Anodyne	ADRB3	43	45
CCOc1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819227335	ED	On-Demand	Anodyne	ADRB2	49	45
CCOc1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819227335	ED	On-Demand	Anodyne	ADRB1	68	45
CCOc1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819227335	ED	On-Demand	Anodyne	ADRB3	43	45
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819227406	GD	On-Demand	Mild	ADRB1	53	37
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819227408	GD	On-Demand	Mild	ADRB1	53	37
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819227410	GD	On-Demand	Mild	ADRB1	53	37
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819227413	GD	On-Demand	Mild	ADRB1	53	37
CON(C)C(=O)CCNCc1ccc(Cl)c(C)c1	ZINC000819227419	CE	On-Demand	Anodyne	LEF	49	34
CC[C@@H](NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2)c1nc2ccccc2[nH]1	ZINC000819227441	FF	On-Demand	Anodyne	PTPN1	29	40
CC[C@H](NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2)c1nc2ccccc2[nH]1	ZINC000819227442	FF	On-Demand	Anodyne	PTPN1	29	40
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819227454	FF	On-Demand	Anodyne	MAPK11	20	42
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819227455	FF	On-Demand	Anodyne	MAPK11	20	42
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819227456	FF	On-Demand	Anodyne	MAPK11	20	42
Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819227457	FF	On-Demand	Anodyne	MAPK11	20	42
CC[C@H](NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2)c1nc2ccccc2[nH]1	ZINC000819227459	FF	On-Demand	Anodyne	PTPN1	29	40
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2ccccc2)C1	ZINC000819227469	EF	On-Demand	Anodyne	CCR8	49	43
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2ccccc2)C1	ZINC000819227469	EF	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2ccccc2)C1	ZINC000819227469	EF	On-Demand	Anodyne	SFRP1	27	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819227472	FF	On-Demand	Anodyne	CACNA1I	61	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819227472	FF	On-Demand	Anodyne	GPR119	45	50
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819227473	FF	On-Demand	Anodyne	CACNA1I	61	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819227473	FF	On-Demand	Anodyne	GPR119	45	50
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819227474	FF	On-Demand	Anodyne	CACNA1I	61	35
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819227474	FF	On-Demand	Anodyne	GPR119	45	50
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819227475	FF	On-Demand	Anodyne	CACNA1I	61	35
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819227475	FF	On-Demand	Anodyne	GPR119	45	50
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819227476	DD	On-Demand	Anodyne	ADRB1	27	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819227476	DD	On-Demand	Anodyne	GRIN2B	20	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819227476	DD	On-Demand	Anodyne	ADRB3	90	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819227476	DD	On-Demand	Anodyne	GPR119	48	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819227477	DD	On-Demand	Anodyne	ADRB1	27	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819227477	DD	On-Demand	Anodyne	GRIN2B	20	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819227477	DD	On-Demand	Anodyne	ADRB3	90	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819227477	DD	On-Demand	Anodyne	GPR119	48	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819227478	DD	On-Demand	Anodyne	ADRB1	27	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819227478	DD	On-Demand	Anodyne	GRIN2B	20	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819227478	DD	On-Demand	Anodyne	ADRB3	90	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819227478	DD	On-Demand	Anodyne	GPR119	48	43
O=C(c1cc(-c2ccc(F)cc2)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819227486	GI	On-Demand	Anodyne	DHODH	31	46
O=C(c1cc(-c2ccc(F)cc2)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819227486	GI	On-Demand	Anodyne	GRIN2B	47	39
O=C(c1cc(-c2ccc(F)cc2)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819227486	GI	On-Demand	Anodyne	PRS	48	45
O=C(c1cc(-c2ccc(F)cc2)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819227486	GI	On-Demand	Anodyne	ACACB	16	41
O=C(c1cc(-c2ccc(F)cc2)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819227486	GI	On-Demand	Anodyne	TACR3	26	40
O=C(c1cc(-c2ccc(F)cc2)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819227486	GI	On-Demand	Anodyne	MT-CO2	49	42
O=C(c1cc(-c2ccc(F)cc2)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819227486	GI	On-Demand	Anodyne	VCP	31	41
O=C(c1cc(-c2ccc(F)cc2)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819227490	GI	On-Demand	Anodyne	DHODH	31	46
O=C(c1cc(-c2ccc(F)cc2)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819227490	GI	On-Demand	Anodyne	GRIN2B	47	39
O=C(c1cc(-c2ccc(F)cc2)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819227490	GI	On-Demand	Anodyne	PRS	48	45
O=C(c1cc(-c2ccc(F)cc2)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819227490	GI	On-Demand	Anodyne	ACACB	16	41
O=C(c1cc(-c2ccc(F)cc2)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819227490	GI	On-Demand	Anodyne	TACR3	26	40
O=C(c1cc(-c2ccc(F)cc2)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819227490	GI	On-Demand	Anodyne	MT-CO2	49	42
O=C(c1cc(-c2ccc(F)cc2)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819227490	GI	On-Demand	Anodyne	VCP	31	41
O=C(CCCCCCC(=O)N1CCC[C@@H](CO)CC1)N1CCC[C@H](CO)CC1	ZINC000819227497	GF	On-Demand	Anodyne	PREP	24	45
O=C(CCCCCCC(=O)N1CCC[C@H](CO)CC1)N1CCC[C@H](CO)CC1	ZINC000819227499	GF	On-Demand	Anodyne	PREP	24	45
O=C(CCCCCCC(=O)N1CCC[C@@H](CO)CC1)N1CCC[C@@H](CO)CC1	ZINC000819227501	GF	On-Demand	Anodyne	PREP	24	45
CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)N3CCC[C@H](CO)CC3)ccc2F)CC1	ZINC000819227503	IC	On-Demand	Anodyne	CNR2	18	47
CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)N3CCC[C@H](CO)CC3)ccc2F)CC1	ZINC000819227503	IC	On-Demand	Anodyne	L3MBTL3	71	38
CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)N3CCC[C@@H](CO)CC3)ccc2F)CC1	ZINC000819227507	IC	On-Demand	Anodyne	CNR2	18	47
CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)N3CCC[C@@H](CO)CC3)ccc2F)CC1	ZINC000819227507	IC	On-Demand	Anodyne	L3MBTL3	71	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819227508	DD	On-Demand	Anodyne	ADRB1	27	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819227508	DD	On-Demand	Anodyne	GRIN2B	20	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819227508	DD	On-Demand	Anodyne	ADRB3	90	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819227508	DD	On-Demand	Anodyne	GPR119	48	43
O[C@H](CN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21)c1cc2ccccc2o1	ZINC000819227524	GH	On-Demand	Anodyne	SIGMAR1	19	41
O[C@H](CN[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@H]21)c1cc2ccccc2o1	ZINC000819227525	GH	On-Demand	Anodyne	SIGMAR1	19	41
O[C@H](CN[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@@H]21)c1cc2ccccc2o1	ZINC000819227527	GH	On-Demand	Anodyne	SIGMAR1	19	41
COc1ccccc1/C=C(/C(=O)N1CCC[C@H](CO)CC1)c1ccccc1	ZINC000819227529	FH	On-Demand	Anodyne	ACKR3	70	36
O[C@H](CN[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]21)c1cc2ccccc2o1	ZINC000819227530	GH	On-Demand	Anodyne	SIGMAR1	19	41
COc1ccccc1/C=C(/C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1	ZINC000819227533	FH	On-Demand	Anodyne	ACKR3	70	36
O=C(N1CCC[C@H](CO)CC1)C(F)(F)Cc1ccccc1	ZINC000819227577	CE	On-Demand	Anodyne	GRIN2B	45	40
O=C(N1CCC[C@H](CO)CC1)C(F)(F)Cc1ccccc1	ZINC000819227577	CE	On-Demand	Anodyne	PREP	43	36
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227578	GE	On-Demand	Anodyne	ADRB2	25	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227578	GE	On-Demand	Anodyne	ADRB1	50	42
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227578	GE	On-Demand	Anodyne	ADRB3	31	42
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227578	GE	On-Demand	Anodyne	ABCB1	17	49
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227578	GE	On-Demand	Anodyne	CACNA1I	41	32
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227578	GE	On-Demand	Anodyne	GPR119	44	47
O=C(N1CCC[C@@H](CO)CC1)C(F)(F)Cc1ccccc1	ZINC000819227580	CE	On-Demand	Anodyne	GRIN2B	45	40
O=C(N1CCC[C@@H](CO)CC1)C(F)(F)Cc1ccccc1	ZINC000819227580	CE	On-Demand	Anodyne	PREP	43	36
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227581	GE	On-Demand	Anodyne	ADRB2	25	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227581	GE	On-Demand	Anodyne	ADRB1	50	42
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227581	GE	On-Demand	Anodyne	ADRB3	31	42
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227581	GE	On-Demand	Anodyne	ABCB1	17	49
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227581	GE	On-Demand	Anodyne	CACNA1I	41	32
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227581	GE	On-Demand	Anodyne	GPR119	44	47
O=C(c1ccc(OC2CCCC2)cc1)N1CCC[C@H](CO)CC1	ZINC000819227583	DG	On-Demand	Anodyne	PRSS2	56	32
O=C(c1ccc(OC2CCCC2)cc1)N1CCC[C@H](CO)CC1	ZINC000819227583	DG	On-Demand	Anodyne	HRH3	32	46
O=C(c1ccc(OC2CCCC2)cc1)N1CCC[C@H](CO)CC1	ZINC000819227583	DG	On-Demand	Anodyne	EPHX2	20	41
O=C(c1ccc(OC2CCCC2)cc1)N1CCC[C@H](CO)CC1	ZINC000819227583	DG	On-Demand	Anodyne	L3MBTL3	92	46
O=C(c1ccc(OC2CCCC2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819227585	DG	On-Demand	Anodyne	PRSS2	56	32
O=C(c1ccc(OC2CCCC2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819227585	DG	On-Demand	Anodyne	HRH3	32	46
O=C(c1ccc(OC2CCCC2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819227585	DG	On-Demand	Anodyne	EPHX2	20	41
O=C(c1ccc(OC2CCCC2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819227585	DG	On-Demand	Anodyne	L3MBTL3	92	46
O=C(c1cnn(Cc2ccccc2)c1Cl)N1CCC[C@H](CO)CC1	ZINC000819227587	EF	On-Demand	Anodyne	PREP	49	34
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227588	GE	On-Demand	Anodyne	ADRB2	25	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227588	GE	On-Demand	Anodyne	ADRB1	50	42
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227588	GE	On-Demand	Anodyne	ADRB3	31	42
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227588	GE	On-Demand	Anodyne	ABCB1	17	49
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227588	GE	On-Demand	Anodyne	CACNA1I	41	32
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227588	GE	On-Demand	Anodyne	GPR119	44	47
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227590	GE	On-Demand	Anodyne	ADRB2	25	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227590	GE	On-Demand	Anodyne	ADRB1	50	42
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227590	GE	On-Demand	Anodyne	ADRB3	31	42
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227590	GE	On-Demand	Anodyne	ABCB1	17	49
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227590	GE	On-Demand	Anodyne	CACNA1I	41	32
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227590	GE	On-Demand	Anodyne	GPR119	44	47
O=C(c1cnn(Cc2ccccc2)c1Cl)N1CCC[C@@H](CO)CC1	ZINC000819227591	EF	On-Demand	Anodyne	PREP	49	34
Cc1csc([C@H](C)CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000819227592	GG	On-Demand	Anodyne	GPR119	36	42
Cc1csc([C@H](C)CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000819227595	GG	On-Demand	Anodyne	GPR119	36	42
C#CCOCCNC[C@@H](O)c1cccc(F)c1	ZINC000819227606	BD	On-Demand	Mild	ADRB1	35	42
C#CCOCCNC[C@@H](O)c1cccc(F)c1	ZINC000819227606	BD	On-Demand	Mild	ADRB3	36	42
C#CCOCCNC[C@H](O)c1cccc(F)c1	ZINC000819227608	BD	On-Demand	Mild	ADRB1	35	42
C#CCOCCNC[C@H](O)c1cccc(F)c1	ZINC000819227608	BD	On-Demand	Mild	ADRB3	36	42
C[C@H](CCNC[C@@H](O)c1cccnc1)N1CCCCC1	ZINC000819227622	CD	On-Demand	Anodyne	ADRB2	27	44
C[C@H](CCNC[C@@H](O)c1cccnc1)N1CCCCC1	ZINC000819227622	CD	On-Demand	Anodyne	ADRB1	31	44
C[C@H](CCNC[C@@H](O)c1cccnc1)N1CCCCC1	ZINC000819227622	CD	On-Demand	Anodyne	ADRB3	107	53
C[C@H](CCNC[C@@H](O)c1cccnc1)N1CCCCC1	ZINC000819227622	CD	On-Demand	Anodyne	KCNA5	17	41
C[C@@H](CCNC[C@@H](O)c1cccnc1)N1CCCCC1	ZINC000819227625	CD	On-Demand	Anodyne	ADRB2	27	44
C[C@@H](CCNC[C@@H](O)c1cccnc1)N1CCCCC1	ZINC000819227625	CD	On-Demand	Anodyne	ADRB1	31	44
C[C@@H](CCNC[C@@H](O)c1cccnc1)N1CCCCC1	ZINC000819227625	CD	On-Demand	Anodyne	ADRB3	107	53
C[C@@H](CCNC[C@@H](O)c1cccnc1)N1CCCCC1	ZINC000819227625	CD	On-Demand	Anodyne	KCNA5	17	41
C[C@@H](CCNC[C@H](O)c1cccnc1)N1CCCCC1	ZINC000819227626	CD	On-Demand	Anodyne	ADRB2	27	44
C[C@@H](CCNC[C@H](O)c1cccnc1)N1CCCCC1	ZINC000819227626	CD	On-Demand	Anodyne	ADRB1	31	44
C[C@@H](CCNC[C@H](O)c1cccnc1)N1CCCCC1	ZINC000819227626	CD	On-Demand	Anodyne	ADRB3	107	53
C[C@@H](CCNC[C@H](O)c1cccnc1)N1CCCCC1	ZINC000819227626	CD	On-Demand	Anodyne	KCNA5	17	41
C[C@@H](CC(=O)N1CCC[C@@H](CO)CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819227627	GG	On-Demand	Anodyne	GPR119	33	43
C[C@H](CCNC[C@H](O)c1cccnc1)N1CCCCC1	ZINC000819227630	CD	On-Demand	Anodyne	ADRB2	27	44
C[C@H](CCNC[C@H](O)c1cccnc1)N1CCCCC1	ZINC000819227630	CD	On-Demand	Anodyne	ADRB1	31	44
C[C@H](CCNC[C@H](O)c1cccnc1)N1CCCCC1	ZINC000819227630	CD	On-Demand	Anodyne	ADRB3	107	53
C[C@H](CCNC[C@H](O)c1cccnc1)N1CCCCC1	ZINC000819227630	CD	On-Demand	Anodyne	KCNA5	17	41
C#CCOCCNC[C@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819227632	DE	On-Demand	Mild	ADRB2	23	42
C#CCOCCNC[C@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819227632	DE	On-Demand	Mild	ADRB1	55	32
C#CCOCCNC[C@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819227632	DE	On-Demand	Mild	VDR	18	42
O[C@H](CNCc1nc2ccccc2n1C1CC1)c1cccc(Cl)c1	ZINC000819227633	EH	On-Demand	Anodyne	CYP3A4	44	33
C[C@@H](CC(=O)N1CCC[C@H](CO)CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819227634	GG	On-Demand	Anodyne	GPR119	33	43
C#CCOCCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819227635	DE	On-Demand	Mild	ADRB2	23	42
C#CCOCCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819227635	DE	On-Demand	Mild	ADRB1	55	32
C#CCOCCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819227635	DE	On-Demand	Mild	VDR	18	42
O[C@@H](CNCc1nc2ccccc2n1C1CC1)c1cccc(Cl)c1	ZINC000819227636	EH	On-Demand	Anodyne	CYP3A4	44	33
Cn1cc(-c2cccc(C(=O)N3CCC[C@H](CO)CC3)c2)cn1	ZINC000819227641	DE	On-Demand	Anodyne	L3MBTL3	61	41
Cn1cc(-c2cccc(C(=O)N3CCC[C@@H](CO)CC3)c2)cn1	ZINC000819227646	DE	On-Demand	Anodyne	L3MBTL3	61	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819227653	FG	On-Demand	Anodyne	CACNA1I	65	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819227653	FG	On-Demand	Anodyne	GPR119	42	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819227658	FG	On-Demand	Anodyne	CACNA1I	65	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819227658	FG	On-Demand	Anodyne	GPR119	42	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819227663	FG	On-Demand	Anodyne	CACNA1I	65	36
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819227663	FG	On-Demand	Anodyne	GPR119	42	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819227666	FG	On-Demand	Anodyne	CACNA1I	65	36
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819227666	FG	On-Demand	Anodyne	GPR119	42	42
C#CCOCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819227704	DD	On-Demand	Mild	ADRB2	33	42
C#CCOCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819227704	DD	On-Demand	Mild	ADRB1	69	39
C#CCOCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819227704	DD	On-Demand	Mild	ADRB3	17	40
C#CCOCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819227718	DD	On-Demand	Mild	ADRB2	33	42
C#CCOCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819227718	DD	On-Demand	Mild	ADRB1	69	39
C#CCOCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819227718	DD	On-Demand	Mild	ADRB3	17	40
CC(=O)Nc1cccc(CC(=O)N2CCC(NC(=O)Oc3ccccc3)CC2)c1	ZINC000819227731	GF	On-Demand	Anodyne	TSHR	48	32
CC(=O)Nc1cccc(CC(=O)N2CCC(NC(=O)Oc3ccccc3)CC2)c1	ZINC000819227731	GF	On-Demand	Anodyne	DRD4	22	42
CC(=O)Nc1cccc(CC(=O)N2CCC(NC(=O)Oc3ccccc3)CC2)c1	ZINC000819227731	GF	On-Demand	Anodyne	LTA4H	15	41
CC(=O)Nc1cccc(CC(=O)N2CCC(NC(=O)Oc3ccccc3)CC2)c1	ZINC000819227731	GF	On-Demand	Anodyne	SIGMAR1	20	48
CC(=O)Nc1cccc(CC(=O)N2CCC(NC(=O)Oc3ccccc3)CC2)c1	ZINC000819227731	GF	On-Demand	Anodyne	CCR3	45	40
CC(=O)Nc1cccc(CC(=O)N2CCC(NC(=O)Oc3ccccc3)CC2)c1	ZINC000819227731	GF	On-Demand	Anodyne	CHRNA7	16	40
CC(=O)Nc1cccc(CC(=O)N2CCC(NC(=O)Oc3ccccc3)CC2)c1	ZINC000819227731	GF	On-Demand	Anodyne	C3AR1	40	38
CC(=O)Nc1cccc(CC(=O)N2CCC(NC(=O)Oc3ccccc3)CC2)c1	ZINC000819227731	GF	On-Demand	Anodyne	FAAH	43	47
CC(=O)Nc1cccc(CC(=O)N2CCC(NC(=O)Oc3ccccc3)CC2)c1	ZINC000819227731	GF	On-Demand	Anodyne	EPHX2	53	48
CC(=O)Nc1cccc(CC(=O)N2CCC(NC(=O)Oc3ccccc3)CC2)c1	ZINC000819227731	GF	On-Demand	Anodyne	MCHR1	34	41
CC(=O)Nc1cccc(CC(=O)N2CCC(NC(=O)Oc3ccccc3)CC2)c1	ZINC000819227731	GF	On-Demand	Anodyne	CCR8	57	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819227738	DF	On-Demand	Anodyne	SLC6A3	17	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819227738	DF	On-Demand	Anodyne	GRIN2B	28	45
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819227738	DF	On-Demand	Anodyne	ADRB3	46	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819227738	DF	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819227738	DF	On-Demand	Anodyne	CCR8	27	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819227738	DF	On-Demand	Anodyne	GPR119	46	45
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819227738	DF	On-Demand	Anodyne	SFRP1	33	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819227744	DF	On-Demand	Anodyne	SLC6A3	17	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819227744	DF	On-Demand	Anodyne	GRIN2B	28	45
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819227744	DF	On-Demand	Anodyne	ADRB3	46	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819227744	DF	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819227744	DF	On-Demand	Anodyne	CCR8	27	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819227744	DF	On-Demand	Anodyne	GPR119	46	45
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819227744	DF	On-Demand	Anodyne	SFRP1	33	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819227747	DF	On-Demand	Anodyne	SLC6A3	17	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819227747	DF	On-Demand	Anodyne	GRIN2B	28	45
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819227747	DF	On-Demand	Anodyne	ADRB3	46	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819227747	DF	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819227747	DF	On-Demand	Anodyne	CCR8	27	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819227747	DF	On-Demand	Anodyne	GPR119	46	45
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819227747	DF	On-Demand	Anodyne	SFRP1	33	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819227752	DF	On-Demand	Anodyne	SLC6A3	17	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819227752	DF	On-Demand	Anodyne	GRIN2B	28	45
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819227752	DF	On-Demand	Anodyne	ADRB3	46	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819227752	DF	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819227752	DF	On-Demand	Anodyne	CCR8	27	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819227752	DF	On-Demand	Anodyne	GPR119	46	45
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819227752	DF	On-Demand	Anodyne	SFRP1	33	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc3ccccc23)C1	ZINC000819227755	FH	On-Demand	Anodyne	HTR4	44	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc3ccccc23)C1	ZINC000819227755	FH	On-Demand	Anodyne	CACNA1I	46	32
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc3ccccc23)C1	ZINC000819227755	FH	On-Demand	Anodyne	CCR8	29	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc3ccccc23)C1	ZINC000819227755	FH	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc3ccccc23)C1	ZINC000819227760	FH	On-Demand	Anodyne	HTR4	44	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc3ccccc23)C1	ZINC000819227760	FH	On-Demand	Anodyne	CACNA1I	46	32
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc3ccccc23)C1	ZINC000819227760	FH	On-Demand	Anodyne	CCR8	29	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc3ccccc23)C1	ZINC000819227760	FH	On-Demand	Anodyne	GPR119	40	42
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227780	FF	On-Demand	Anodyne	ACE	36	43
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227780	FF	On-Demand	Anodyne	FKBP1A	70	44
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227780	FF	On-Demand	Anodyne	CELA1	27	62
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227780	FF	On-Demand	Anodyne	GRIN2B	44	46
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227780	FF	On-Demand	Anodyne	ELANE	25	40
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227780	FF	On-Demand	Anodyne	CTRA_BOVIN	53	33
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227780	FF	On-Demand	Anodyne	TRY1_BOVIN	55	33
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227780	FF	On-Demand	Anodyne	CTSG	41	33
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227780	FF	On-Demand	Anodyne	CPT1A	26	44
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227780	FF	On-Demand	Anodyne	CPT2	48	43
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227780	FF	On-Demand	Anodyne	PREP	169	83
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227780	FF	On-Demand	Anodyne	CELA2A	41	33
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227780	FF	On-Demand	Anodyne	LGMN	83	49
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227780	FF	On-Demand	Anodyne	KLK5	27	50
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227780	FF	On-Demand	Anodyne	SFRP1	53	38
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227780	FF	On-Demand	Anodyne	WNT3	58	38
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227780	FF	On-Demand	Anodyne	SLC12A5	58	41
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227780	FF	On-Demand	Anodyne	TMPRSS11D	57	36
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227784	FF	On-Demand	Anodyne	ACE	36	43
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227784	FF	On-Demand	Anodyne	FKBP1A	70	44
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227784	FF	On-Demand	Anodyne	CELA1	27	62
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227784	FF	On-Demand	Anodyne	GRIN2B	44	46
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227784	FF	On-Demand	Anodyne	ELANE	25	40
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227784	FF	On-Demand	Anodyne	CTRA_BOVIN	53	33
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227784	FF	On-Demand	Anodyne	TRY1_BOVIN	55	33
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227784	FF	On-Demand	Anodyne	CTSG	41	33
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227784	FF	On-Demand	Anodyne	CPT1A	26	44
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227784	FF	On-Demand	Anodyne	CPT2	48	43
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227784	FF	On-Demand	Anodyne	PREP	169	83
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227784	FF	On-Demand	Anodyne	CELA2A	41	33
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227784	FF	On-Demand	Anodyne	LGMN	83	49
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227784	FF	On-Demand	Anodyne	KLK5	27	50
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227784	FF	On-Demand	Anodyne	SFRP1	53	38
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227784	FF	On-Demand	Anodyne	WNT3	58	38
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227784	FF	On-Demand	Anodyne	SLC12A5	58	41
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227784	FF	On-Demand	Anodyne	TMPRSS11D	57	36
O=C1NCCc2ccc(CNC[C@H](O)c3ccc(F)cn3)cc21	ZINC000819227785	DD	On-Demand	Anodyne	CSNK1G2	50	35
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227788	FF	On-Demand	Anodyne	ACE	36	43
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227788	FF	On-Demand	Anodyne	FKBP1A	70	44
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227788	FF	On-Demand	Anodyne	CELA1	27	62
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227788	FF	On-Demand	Anodyne	GRIN2B	44	46
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227788	FF	On-Demand	Anodyne	ELANE	25	40
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227788	FF	On-Demand	Anodyne	CTRA_BOVIN	53	33
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227788	FF	On-Demand	Anodyne	TRY1_BOVIN	55	33
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227788	FF	On-Demand	Anodyne	CTSG	41	33
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227788	FF	On-Demand	Anodyne	CPT1A	26	44
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227788	FF	On-Demand	Anodyne	CPT2	48	43
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227788	FF	On-Demand	Anodyne	PREP	169	83
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227788	FF	On-Demand	Anodyne	CELA2A	41	33
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227788	FF	On-Demand	Anodyne	LGMN	83	49
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227788	FF	On-Demand	Anodyne	KLK5	27	50
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227788	FF	On-Demand	Anodyne	SFRP1	53	38
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227788	FF	On-Demand	Anodyne	WNT3	58	38
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227788	FF	On-Demand	Anodyne	SLC12A5	58	41
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819227788	FF	On-Demand	Anodyne	TMPRSS11D	57	36
O=C1NCCc2ccc(CNC[C@@H](O)c3ccc(F)cn3)cc21	ZINC000819227791	DD	On-Demand	Anodyne	CSNK1G2	50	35
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227794	FF	On-Demand	Anodyne	ACE	36	43
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227794	FF	On-Demand	Anodyne	FKBP1A	70	44
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227794	FF	On-Demand	Anodyne	CELA1	27	62
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227794	FF	On-Demand	Anodyne	GRIN2B	44	46
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227794	FF	On-Demand	Anodyne	ELANE	25	40
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227794	FF	On-Demand	Anodyne	CTRA_BOVIN	53	33
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227794	FF	On-Demand	Anodyne	TRY1_BOVIN	55	33
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227794	FF	On-Demand	Anodyne	CTSG	41	33
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227794	FF	On-Demand	Anodyne	CPT1A	26	44
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227794	FF	On-Demand	Anodyne	CPT2	48	43
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227794	FF	On-Demand	Anodyne	PREP	169	83
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227794	FF	On-Demand	Anodyne	CELA2A	41	33
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227794	FF	On-Demand	Anodyne	LGMN	83	49
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227794	FF	On-Demand	Anodyne	KLK5	27	50
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227794	FF	On-Demand	Anodyne	SFRP1	53	38
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227794	FF	On-Demand	Anodyne	WNT3	58	38
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227794	FF	On-Demand	Anodyne	SLC12A5	58	41
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819227794	FF	On-Demand	Anodyne	TMPRSS11D	57	36
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@@H](CO)CC1	ZINC000819227798	GD	On-Demand	Anodyne	CELA1	18	41
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@@H](CO)CC1	ZINC000819227798	GD	On-Demand	Anodyne	GRIN2B	54	51
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@@H](CO)CC1	ZINC000819227798	GD	On-Demand	Anodyne	SIGMAR1	16	40
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@@H](CO)CC1	ZINC000819227798	GD	On-Demand	Anodyne	PREP	55	48
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@@H](CO)CC1	ZINC000819227798	GD	On-Demand	Anodyne	TGM2	41	43
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@@H](CO)CC1	ZINC000819227798	GD	On-Demand	Anodyne	F13A1	45	43
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@H](CO)CC1	ZINC000819227802	GD	On-Demand	Anodyne	CELA1	18	41
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@H](CO)CC1	ZINC000819227802	GD	On-Demand	Anodyne	GRIN2B	54	51
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@H](CO)CC1	ZINC000819227802	GD	On-Demand	Anodyne	SIGMAR1	16	40
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@H](CO)CC1	ZINC000819227802	GD	On-Demand	Anodyne	PREP	55	48
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@H](CO)CC1	ZINC000819227802	GD	On-Demand	Anodyne	TGM2	41	43
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@H](CO)CC1	ZINC000819227802	GD	On-Demand	Anodyne	F13A1	45	43
CC(C)(C)OC(=O)N1CC[C@@H](CNCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819227823	GE	On-Demand	Mild	GPR119	47	41
CC(C)(C)OC(=O)N1CC[C@@H](CNCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819227823	GE	On-Demand	Mild	SFRP1	56	42
CC(C)(C)OC(=O)N1CC[C@H](CNCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819227828	GE	On-Demand	Mild	GPR119	47	41
CC(C)(C)OC(=O)N1CC[C@H](CNCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819227828	GE	On-Demand	Mild	SFRP1	56	42
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2cccc(F)c2)C1	ZINC000819227831	FG	On-Demand	Anodyne	GRIN2B	19	40
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2cccc(F)c2)C1	ZINC000819227831	FG	On-Demand	Anodyne	CCR3	51	44
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2cccc(F)c2)C1	ZINC000819227831	FG	On-Demand	Anodyne	CACNA1I	45	32
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2cccc(F)c2)C1	ZINC000819227831	FG	On-Demand	Anodyne	GPR119	40	49
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2cccc(F)c2)C1	ZINC000819227836	FG	On-Demand	Anodyne	GRIN2B	19	40
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2cccc(F)c2)C1	ZINC000819227836	FG	On-Demand	Anodyne	CCR3	51	44
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2cccc(F)c2)C1	ZINC000819227836	FG	On-Demand	Anodyne	CACNA1I	45	32
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2cccc(F)c2)C1	ZINC000819227836	FG	On-Demand	Anodyne	GPR119	40	49
O=C(CNc1cccc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819227841	EF	On-Demand	Anodyne	CACNA1B	48	35
O=C(CNc1cccc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819227841	EF	On-Demand	Anodyne	CCR2	72	48
O=C(CNc1cccc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819227841	EF	On-Demand	Anodyne	EPHX2	23	51
O=C(CNc1cccc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819227841	EF	On-Demand	Anodyne	LIPG	45	37
O=C(CNc1cccc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819227841	EF	On-Demand	Anodyne	SFRP1	58	37
O=C(CNc1cccc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819227841	EF	On-Demand	Anodyne	WNT3	55	37
Cc1ccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227842	FF	On-Demand	Anodyne	ADRB2	36	45
Cc1ccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227842	FF	On-Demand	Anodyne	ADRB1	56	43
Cc1ccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227842	FF	On-Demand	Anodyne	GRIN2B	17	40
Cc1ccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227842	FF	On-Demand	Anodyne	ADRB3	37	43
Cc1ccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227842	FF	On-Demand	Anodyne	GPR119	49	45
O=C(CNc1cccc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819227844	EF	On-Demand	Anodyne	CACNA1B	48	35
O=C(CNc1cccc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819227844	EF	On-Demand	Anodyne	CCR2	72	48
O=C(CNc1cccc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819227844	EF	On-Demand	Anodyne	EPHX2	23	51
O=C(CNc1cccc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819227844	EF	On-Demand	Anodyne	LIPG	45	37
O=C(CNc1cccc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819227844	EF	On-Demand	Anodyne	SFRP1	58	37
O=C(CNc1cccc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819227844	EF	On-Demand	Anodyne	WNT3	55	37
Cc1ccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227846	FF	On-Demand	Anodyne	ADRB2	36	45
Cc1ccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227846	FF	On-Demand	Anodyne	ADRB1	56	43
Cc1ccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227846	FF	On-Demand	Anodyne	GRIN2B	17	40
Cc1ccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227846	FF	On-Demand	Anodyne	ADRB3	37	43
Cc1ccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227846	FF	On-Demand	Anodyne	GPR119	49	45
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227849	FF	On-Demand	Anodyne	ADRB2	36	45
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227849	FF	On-Demand	Anodyne	ADRB1	56	43
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227849	FF	On-Demand	Anodyne	GRIN2B	17	40
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227849	FF	On-Demand	Anodyne	ADRB3	37	43
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227849	FF	On-Demand	Anodyne	GPR119	49	45
Cc1ccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227854	FF	On-Demand	Anodyne	ADRB2	36	45
Cc1ccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227854	FF	On-Demand	Anodyne	ADRB1	56	43
Cc1ccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227854	FF	On-Demand	Anodyne	GRIN2B	17	40
Cc1ccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227854	FF	On-Demand	Anodyne	ADRB3	37	43
Cc1ccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819227854	FF	On-Demand	Anodyne	GPR119	49	45
O=C(c1cc([N+](=O)[O-])ccc1N1CCOCC1)N1CCC[C@H](CO)CC1	ZINC000819227855	FD	On-Demand	Bother	SLC6A9	25	61
O=C(c1cc([N+](=O)[O-])ccc1N1CCOCC1)N1CCC[C@@H](CO)CC1	ZINC000819227859	FD	On-Demand	Bother	SLC6A9	25	61
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H](c3ccccc3)CC1)C2	ZINC000819227914	FH	On-Demand	Anodyne	ADAM10	51	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H](c3ccccc3)CC1)C2	ZINC000819227914	FH	On-Demand	Anodyne	WNT3	49	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H](c3ccccc3)CC1)C2	ZINC000819227917	FH	On-Demand	Anodyne	ADAM10	51	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H](c3ccccc3)CC1)C2	ZINC000819227917	FH	On-Demand	Anodyne	WNT3	49	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H](c3ccccc3)CC1)C2	ZINC000819227920	FH	On-Demand	Anodyne	ADAM10	51	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H](c3ccccc3)CC1)C2	ZINC000819227920	FH	On-Demand	Anodyne	WNT3	49	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H](c3ccccc3)CC1)C2	ZINC000819227922	FH	On-Demand	Anodyne	ADAM10	51	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H](c3ccccc3)CC1)C2	ZINC000819227922	FH	On-Demand	Anodyne	WNT3	49	32
C#CCOCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819227949	CC	On-Demand	Mild	ADRB2	33	50
C#CCOCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819227949	CC	On-Demand	Mild	ADRB1	55	50
C#CCOCCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819227949	CC	On-Demand	Mild	ADRB3	30	50
C#CCOCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819227950	CC	On-Demand	Mild	ADRB2	33	50
C#CCOCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819227950	CC	On-Demand	Mild	ADRB1	55	50
C#CCOCCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819227950	CC	On-Demand	Mild	ADRB3	30	50
C#CCOCCNC[C@@H](O)COc1ccccc1	ZINC000819227968	BC	On-Demand	Mild	ADRB2	65	55
C#CCOCCNC[C@@H](O)COc1ccccc1	ZINC000819227968	BC	On-Demand	Mild	ADRB1	96	58
C#CCOCCNC[C@@H](O)COc1ccccc1	ZINC000819227968	BC	On-Demand	Mild	ADRB3	58	58
C#CCOCCNC[C@H](O)COc1ccccc1	ZINC000819227969	BC	On-Demand	Mild	ADRB2	65	55
C#CCOCCNC[C@H](O)COc1ccccc1	ZINC000819227969	BC	On-Demand	Mild	ADRB1	96	58
C#CCOCCNC[C@H](O)COc1ccccc1	ZINC000819227969	BC	On-Demand	Mild	ADRB3	58	58
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2Cl)C1	ZINC000819227977	FG	On-Demand	Anodyne	CACNA1I	71	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2Cl)C1	ZINC000819227977	FG	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2Cl)C1	ZINC000819227977	FG	On-Demand	Anodyne	SFRP1	27	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2Cl)C1	ZINC000819227979	FG	On-Demand	Anodyne	CACNA1I	71	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2Cl)C1	ZINC000819227979	FG	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2Cl)C1	ZINC000819227979	FG	On-Demand	Anodyne	SFRP1	27	41
O=C(c1cc(OCc2ccccc2)ccn1)N1CCC[C@H](CO)CC1	ZINC000819228033	EF	On-Demand	Anodyne	GRIN2B	61	42
O=C(c1cc(OCc2ccccc2)ccn1)N1CCC[C@H](CO)CC1	ZINC000819228033	EF	On-Demand	Anodyne	PREP	46	36
O=C(c1cc(OCc2ccccc2)ccn1)N1CCC[C@@H](CO)CC1	ZINC000819228038	EF	On-Demand	Anodyne	GRIN2B	61	42
O=C(c1cc(OCc2ccccc2)ccn1)N1CCC[C@@H](CO)CC1	ZINC000819228038	EF	On-Demand	Anodyne	PREP	46	36
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2cc(F)cc(F)c2)C1	ZINC000819228047	GG	On-Demand	Anodyne	CCR3	18	40
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2cc(F)cc(F)c2)C1	ZINC000819228047	GG	On-Demand	Anodyne	CACNA1I	54	34
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2cc(F)cc(F)c2)C1	ZINC000819228047	GG	On-Demand	Anodyne	GPR119	38	45
O=C(c1ccc(NS(=O)(=O)/C=C\c2ccccc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819228048	HG	On-Demand	Anodyne	SFRP1	52	35
O=C(c1ccc(NS(=O)(=O)/C=C\c2ccccc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819228048	HG	On-Demand	Anodyne	L3MBTL3	73	38
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2cc(F)cc(F)c2)C1	ZINC000819228051	GG	On-Demand	Anodyne	CCR3	18	40
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2cc(F)cc(F)c2)C1	ZINC000819228051	GG	On-Demand	Anodyne	CACNA1I	54	34
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2cc(F)cc(F)c2)C1	ZINC000819228051	GG	On-Demand	Anodyne	GPR119	38	45
O=C(c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819228056	HG	On-Demand	Anodyne	SFRP1	52	35
O=C(c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819228056	HG	On-Demand	Anodyne	L3MBTL3	73	38
O=C(c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819228059	HG	On-Demand	Anodyne	SFRP1	52	35
O=C(c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819228059	HG	On-Demand	Anodyne	L3MBTL3	73	38
O=C(c1ccc(NS(=O)(=O)/C=C\c2ccccc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819228063	HG	On-Demand	Anodyne	SFRP1	52	35
O=C(c1ccc(NS(=O)(=O)/C=C\c2ccccc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819228063	HG	On-Demand	Anodyne	L3MBTL3	73	38
O=C(c1ccc(-c2ccco2)s1)N1CCC[C@@H](CO)CC1	ZINC000819228067	DG	On-Demand	Anodyne	L3MBTL3	15	41
O=C(c1ccc(-c2ccco2)s1)N1CCC[C@H](CO)CC1	ZINC000819228071	DG	On-Demand	Anodyne	L3MBTL3	15	41
O=C(c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1)N1CCC[C@H](CO)CC1	ZINC000819228091	IH	On-Demand	Anodyne	NPY2R	15	41
O=C(c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1)N1CCC[C@H](CO)CC1	ZINC000819228091	IH	On-Demand	Anodyne	L3MBTL3	53	34
O=C(c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1)N1CCC[C@@H](CO)CC1	ZINC000819228095	IH	On-Demand	Anodyne	NPY2R	15	41
O=C(c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1)N1CCC[C@@H](CO)CC1	ZINC000819228095	IH	On-Demand	Anodyne	L3MBTL3	53	34
CC(C)(C)OC(=O)N1CC[C@H](CNCCS(C)(=O)=O)C1	ZINC000819228126	DC	On-Demand	Anodyne	GPR119	47	44
CC(C)(C)OC(=O)N1CC[C@@H](CNCCS(C)(=O)=O)C1	ZINC000819228130	DC	On-Demand	Anodyne	GPR119	47	44
C#CCOCCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819228135	CC	On-Demand	Mild	ADRB2	40	45
C#CCOCCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819228135	CC	On-Demand	Mild	ADRB1	68	46
C#CCOCCNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819228135	CC	On-Demand	Mild	ADRB3	33	46
C#CCOCCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819228156	CC	On-Demand	Mild	ADRB2	40	45
C#CCOCCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819228156	CC	On-Demand	Mild	ADRB1	68	46
C#CCOCCNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819228156	CC	On-Demand	Mild	ADRB3	33	46
O=C(C1CC(OCc2ccccc2)C1)N1CCC[C@@H](CO)CC1	ZINC000819228157	DF	On-Demand	Anodyne	GRIN2B	54	41
O=C(C1CC(OCc2ccccc2)C1)N1CCC[C@@H](CO)CC1	ZINC000819228157	DF	On-Demand	Anodyne	PREP	106	48
O=C(C1CC(OCc2ccccc2)C1)N1CCC[C@H](CO)CC1	ZINC000819228161	DF	On-Demand	Anodyne	GRIN2B	54	41
O=C(C1CC(OCc2ccccc2)C1)N1CCC[C@H](CO)CC1	ZINC000819228161	DF	On-Demand	Anodyne	PREP	106	48
C#CCOCCNC[C@H](O)COc1c(C)cccc1C	ZINC000819228182	CD	On-Demand	Mild	ADRB2	32	43
C#CCOCCNC[C@H](O)COc1c(C)cccc1C	ZINC000819228182	CD	On-Demand	Mild	ADRB1	54	36
C[C@@H](C1CC1)n1nccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819228184	GG	On-Demand	Mild	PAPA1_CARPA	39	41
C[C@@H](C1CC1)n1nccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819228184	GG	On-Demand	Mild	REN	41	35
C#CCOCCNC[C@@H](O)COc1c(C)cccc1C	ZINC000819228185	CD	On-Demand	Mild	ADRB2	32	43
C#CCOCCNC[C@@H](O)COc1c(C)cccc1C	ZINC000819228185	CD	On-Demand	Mild	ADRB1	54	36
C[C@@H](C1CC1)n1nccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819228193	GG	On-Demand	Mild	PAPA1_CARPA	39	41
C[C@@H](C1CC1)n1nccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819228193	GG	On-Demand	Mild	REN	41	35
Cc1ccccc1[C@@H](O)CNC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819228242	EF	On-Demand	Anodyne	GRIN2B	20	40
Cc1ccccc1[C@@H](O)CNC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819228242	EF	On-Demand	Anodyne	CACNA1I	50	34
Cc1ccccc1[C@@H](O)CNC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819228242	EF	On-Demand	Anodyne	CCR8	60	34
Cc1ccccc1[C@@H](O)CNC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819228242	EF	On-Demand	Anodyne	GPR119	42	43
Cc1ccccc1[C@@H](O)CNC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819228242	EF	On-Demand	Anodyne	SFRP1	15	40
Cc1ccccc1[C@@H](O)CNC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819228247	EF	On-Demand	Anodyne	GRIN2B	20	40
Cc1ccccc1[C@@H](O)CNC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819228247	EF	On-Demand	Anodyne	CACNA1I	50	34
Cc1ccccc1[C@@H](O)CNC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819228247	EF	On-Demand	Anodyne	CCR8	60	34
Cc1ccccc1[C@@H](O)CNC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819228247	EF	On-Demand	Anodyne	GPR119	42	43
Cc1ccccc1[C@@H](O)CNC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819228247	EF	On-Demand	Anodyne	SFRP1	15	40
C[C@H](CCNC[C@H](O)c1cccc(F)c1)N1CCCCC1	ZINC000819228250	CF	On-Demand	Anodyne	ADRB1	23	44
C[C@H](CCNC[C@H](O)c1cccc(F)c1)N1CCCCC1	ZINC000819228250	CF	On-Demand	Anodyne	ADRB3	38	44
C[C@H](CCNC[C@@H](O)c1cccc(F)c1)N1CCCCC1	ZINC000819228252	CF	On-Demand	Anodyne	ADRB1	23	44
C[C@H](CCNC[C@@H](O)c1cccc(F)c1)N1CCCCC1	ZINC000819228252	CF	On-Demand	Anodyne	ADRB3	38	44
O=C(CN1C(=O)COc2ccc(Cl)cc21)N1CCC[C@@H](CO)CC1	ZINC000819228253	FD	On-Demand	Anodyne	UTS2R	18	43
C[C@@H](CCNC[C@@H](O)c1cccc(F)c1)N1CCCCC1	ZINC000819228256	CF	On-Demand	Anodyne	ADRB1	23	44
C[C@@H](CCNC[C@@H](O)c1cccc(F)c1)N1CCCCC1	ZINC000819228256	CF	On-Demand	Anodyne	ADRB3	38	44
O=C(CN1C(=O)COc2ccc(Cl)cc21)N1CCC[C@H](CO)CC1	ZINC000819228258	FD	On-Demand	Anodyne	UTS2R	18	43
C[C@@H](CCNC[C@H](O)c1cccc(F)c1)N1CCCCC1	ZINC000819228259	CF	On-Demand	Anodyne	ADRB1	23	44
C[C@@H](CCNC[C@H](O)c1cccc(F)c1)N1CCCCC1	ZINC000819228259	CF	On-Demand	Anodyne	ADRB3	38	44
O=C1O[C@@H](c2ccccc2)Cc2cc(C(=O)N3CCC[C@H](CO)CC3)ccc21	ZINC000819228268	GG	On-Demand	Anodyne	L3MBTL3	58	41
CC(=O)c1cccc(OC[C@@H](O)CNCCC2(C)OCCO2)c1	ZINC000819228270	DD	On-Demand	Anodyne	ADRB2	42	47
CC(=O)c1cccc(OC[C@@H](O)CNCCC2(C)OCCO2)c1	ZINC000819228270	DD	On-Demand	Anodyne	ADRB1	74	42
CC(=O)c1cccc(OC[C@@H](O)CNCCC2(C)OCCO2)c1	ZINC000819228270	DD	On-Demand	Anodyne	ADRB3	44	42
CC(=O)c1cccc(OC[C@@H](O)CNCCC2(C)OCCO2)c1	ZINC000819228270	DD	On-Demand	Anodyne	ABCB1	22	48
CC(=O)c1cccc(OC[C@H](O)CNCCC2(C)OCCO2)c1	ZINC000819228272	DD	On-Demand	Anodyne	ADRB2	42	47
CC(=O)c1cccc(OC[C@H](O)CNCCC2(C)OCCO2)c1	ZINC000819228272	DD	On-Demand	Anodyne	ADRB1	74	42
CC(=O)c1cccc(OC[C@H](O)CNCCC2(C)OCCO2)c1	ZINC000819228272	DD	On-Demand	Anodyne	ADRB3	44	42
CC(=O)c1cccc(OC[C@H](O)CNCCC2(C)OCCO2)c1	ZINC000819228272	DD	On-Demand	Anodyne	ABCB1	22	48
O=C1O[C@H](c2ccccc2)Cc2cc(C(=O)N3CCC[C@@H](CO)CC3)ccc21	ZINC000819228273	GG	On-Demand	Anodyne	L3MBTL3	58	41
O=C1O[C@@H](c2ccccc2)Cc2cc(C(=O)N3CCC[C@@H](CO)CC3)ccc21	ZINC000819228276	GG	On-Demand	Anodyne	L3MBTL3	58	41
O=C1O[C@H](c2ccccc2)Cc2cc(C(=O)N3CCC[C@H](CO)CC3)ccc21	ZINC000819228278	GG	On-Demand	Anodyne	L3MBTL3	58	41
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)N3CCC[C@H](CO)CC3)nn2)CC1	ZINC000819228299	HE	On-Demand	Anodyne	GPR119	44	38
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)N3CCC[C@@H](CO)CC3)nn2)CC1	ZINC000819228303	HE	On-Demand	Anodyne	GPR119	44	38
O=C([C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1)N1CCC[C@@H](CO)CC1	ZINC000819228305	IE	On-Demand	Anodyne	PREP	59	51
O=C([C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1)N1CCC[C@@H](CO)CC1	ZINC000819228305	IE	On-Demand	Anodyne	MMP8	25	40
O=C([C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1)N1CCC[C@H](CO)CC1	ZINC000819228307	IE	On-Demand	Anodyne	PREP	59	51
O=C([C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1)N1CCC[C@H](CO)CC1	ZINC000819228307	IE	On-Demand	Anodyne	MMP8	25	40
O=C([C@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1)N1CCC[C@H](CO)CC1	ZINC000819228309	IE	On-Demand	Anodyne	PREP	59	51
O=C([C@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1)N1CCC[C@H](CO)CC1	ZINC000819228309	IE	On-Demand	Anodyne	MMP8	25	40
O=C([C@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1)N1CCC[C@@H](CO)CC1	ZINC000819228312	IE	On-Demand	Anodyne	PREP	59	51
O=C([C@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1)N1CCC[C@@H](CO)CC1	ZINC000819228312	IE	On-Demand	Anodyne	MMP8	25	40
Cn1nc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21	ZINC000819228319	GF	On-Demand	Anodyne	GPR119	41	46
Cn1nc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21	ZINC000819228321	GF	On-Demand	Anodyne	GPR119	41	46
O=C([C@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819228340	EE	On-Demand	Anodyne	CACNA1B	47	35
O=C([C@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819228340	EE	On-Demand	Anodyne	MTTP	28	40
O=C([C@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819228340	EE	On-Demand	Anodyne	CCR2	40	39
O=C([C@@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819228342	EE	On-Demand	Anodyne	CACNA1B	47	35
O=C([C@@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819228342	EE	On-Demand	Anodyne	MTTP	28	40
O=C([C@@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819228342	EE	On-Demand	Anodyne	CCR2	40	39
O=C([C@@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819228344	EE	On-Demand	Anodyne	CACNA1B	47	35
O=C([C@@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819228344	EE	On-Demand	Anodyne	MTTP	28	40
O=C([C@@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819228344	EE	On-Demand	Anodyne	CCR2	40	39
O=C([C@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819228346	EE	On-Demand	Anodyne	CACNA1B	47	35
O=C([C@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819228346	EE	On-Demand	Anodyne	MTTP	28	40
O=C([C@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819228346	EE	On-Demand	Anodyne	CCR2	40	39
CN(C)CC1(CNC[C@H](O)c2cccc(Cl)c2)CCCC1	ZINC000819228367	DG	On-Demand	Anodyne	ADRB1	27	42
CN(C)CC1(CNC[C@H](O)c2cccc(Cl)c2)CCCC1	ZINC000819228367	DG	On-Demand	Anodyne	ADRB3	40	41
CN(C)CC1(CNC[C@@H](O)c2cccc(Cl)c2)CCCC1	ZINC000819228368	DG	On-Demand	Anodyne	ADRB1	27	42
CN(C)CC1(CNC[C@@H](O)c2cccc(Cl)c2)CCCC1	ZINC000819228368	DG	On-Demand	Anodyne	ADRB3	40	41
Cc1ccc(C(=O)N2CCC[C@H](CO)CC2)cc1NC(=O)OC(C)(C)C	ZINC000819228371	FH	On-Demand	Anodyne	MAPK11	15	40
Cc1ccc(C(=O)N2CCC[C@H](CO)CC2)cc1NC(=O)OC(C)(C)C	ZINC000819228371	FH	On-Demand	Anodyne	L3MBTL3	63	36
Cc1ccc(C(=O)N2CCC[C@@H](CO)CC2)cc1NC(=O)OC(C)(C)C	ZINC000819228375	FH	On-Demand	Anodyne	MAPK11	15	40
Cc1ccc(C(=O)N2CCC[C@@H](CO)CC2)cc1NC(=O)OC(C)(C)C	ZINC000819228375	FH	On-Demand	Anodyne	L3MBTL3	63	36
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819228377	EE	On-Demand	Anodyne	ACE	29	41
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819228377	EE	On-Demand	Anodyne	CPT1A	25	44
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819228377	EE	On-Demand	Anodyne	CPT2	49	43
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819228377	EE	On-Demand	Anodyne	PREP	173	77
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819228377	EE	On-Demand	Anodyne	SFRP1	63	49
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819228377	EE	On-Demand	Anodyne	WNT3	70	49
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819228377	EE	On-Demand	Anodyne	L3MBTL3	65	38
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819228378	EE	On-Demand	Anodyne	ACE	29	41
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819228378	EE	On-Demand	Anodyne	CPT1A	25	44
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819228378	EE	On-Demand	Anodyne	CPT2	49	43
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819228378	EE	On-Demand	Anodyne	PREP	173	77
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819228378	EE	On-Demand	Anodyne	SFRP1	63	49
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819228378	EE	On-Demand	Anodyne	WNT3	70	49
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819228378	EE	On-Demand	Anodyne	L3MBTL3	65	38
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819228380	EE	On-Demand	Anodyne	ACE	29	41
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819228380	EE	On-Demand	Anodyne	CPT1A	25	44
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819228380	EE	On-Demand	Anodyne	CPT2	49	43
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819228380	EE	On-Demand	Anodyne	PREP	173	77
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819228380	EE	On-Demand	Anodyne	SFRP1	63	49
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819228380	EE	On-Demand	Anodyne	WNT3	70	49
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819228380	EE	On-Demand	Anodyne	L3MBTL3	65	38
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819228382	EE	On-Demand	Anodyne	ACE	29	41
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819228382	EE	On-Demand	Anodyne	CPT1A	25	44
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819228382	EE	On-Demand	Anodyne	CPT2	49	43
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819228382	EE	On-Demand	Anodyne	PREP	173	77
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819228382	EE	On-Demand	Anodyne	SFRP1	63	49
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819228382	EE	On-Demand	Anodyne	WNT3	70	49
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819228382	EE	On-Demand	Anodyne	L3MBTL3	65	38
O=C(CCc1cccc(CCC(=O)N2CCC[C@@H](CO)CC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819228384	IF	On-Demand	Anodyne	GRIN2B	34	48
O=C(CCc1cccc(CCC(=O)N2CCC[C@@H](CO)CC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819228384	IF	On-Demand	Anodyne	C3AR1	42	41
O=C(CCc1cccc(CCC(=O)N2CCC[C@@H](CO)CC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819228384	IF	On-Demand	Anodyne	PREP	74	39
C#CCOCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819228415	DD	On-Demand	Mild	ADRB2	31	41
C#CCOCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819228415	DD	On-Demand	Mild	ADRB1	44	44
C#CCOCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819228415	DD	On-Demand	Mild	ADRB3	21	42
C#CCOCCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819228415	DD	On-Demand	Mild	PDS	46	39
C#CCOCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819228416	DD	On-Demand	Mild	ADRB2	31	41
C#CCOCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819228416	DD	On-Demand	Mild	ADRB1	44	44
C#CCOCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819228416	DD	On-Demand	Mild	ADRB3	21	42
C#CCOCCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819228416	DD	On-Demand	Mild	PDS	46	39
CC(C)(C)OC(=O)N1CC[C@@H](CNCCS(=O)(=O)c2ccccc2)C1	ZINC000819228423	FE	On-Demand	Anodyne	CCR8	59	44
CC(C)(C)OC(=O)N1CC[C@@H](CNCCS(=O)(=O)c2ccccc2)C1	ZINC000819228423	FE	On-Demand	Anodyne	GPR119	54	44
CC(C)(C)OC(=O)N1CC[C@@H](CNCCS(=O)(=O)c2ccccc2)C1	ZINC000819228423	FE	On-Demand	Anodyne	SFRP1	127	49
CC(C)(C)OC(=O)N1CC[C@@H](CNCCS(=O)(=O)c2ccccc2)C1	ZINC000819228423	FE	On-Demand	Anodyne	WNT3	85	40
CC(C)(C)OC(=O)N1CC[C@H](CNCCS(=O)(=O)c2ccccc2)C1	ZINC000819228424	FE	On-Demand	Anodyne	CCR8	59	44
CC(C)(C)OC(=O)N1CC[C@H](CNCCS(=O)(=O)c2ccccc2)C1	ZINC000819228424	FE	On-Demand	Anodyne	GPR119	54	44
CC(C)(C)OC(=O)N1CC[C@H](CNCCS(=O)(=O)c2ccccc2)C1	ZINC000819228424	FE	On-Demand	Anodyne	SFRP1	127	49
CC(C)(C)OC(=O)N1CC[C@H](CNCCS(=O)(=O)c2ccccc2)C1	ZINC000819228424	FE	On-Demand	Anodyne	WNT3	85	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COCc2ccc(Cl)cc2)C1	ZINC000819228433	GG	On-Demand	Anodyne	CACNA1I	62	35
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COCc2ccc(Cl)cc2)C1	ZINC000819228433	GG	On-Demand	Anodyne	GPR119	41	39
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COCc2ccc(Cl)cc2)C1	ZINC000819228434	GG	On-Demand	Anodyne	CACNA1I	62	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COCc2ccc(Cl)cc2)C1	ZINC000819228434	GG	On-Demand	Anodyne	GPR119	41	39
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COCc2ccc(Cl)cc2)C1	ZINC000819228437	GG	On-Demand	Anodyne	CACNA1I	62	35
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COCc2ccc(Cl)cc2)C1	ZINC000819228437	GG	On-Demand	Anodyne	GPR119	41	39
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COCc2ccc(Cl)cc2)C1	ZINC000819228439	GG	On-Demand	Anodyne	CACNA1I	62	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COCc2ccc(Cl)cc2)C1	ZINC000819228439	GG	On-Demand	Anodyne	GPR119	41	39
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)CC2CCCC2)C1	ZINC000819228472	EF	On-Demand	Anodyne	GPR119	29	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)CC2CCCC2)C1	ZINC000819228475	EF	On-Demand	Anodyne	GPR119	29	42
Cc1csc([C@H](C)CNC[C@@H](O)c2ccccc2)n1	ZINC000819228476	CF	On-Demand	Anodyne	ADRB3	45	39
Cc1csc([C@H](C)CNC[C@H](O)c2ccccc2)n1	ZINC000819228478	CF	On-Demand	Anodyne	ADRB3	45	39
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)CC2CCCC2)C1	ZINC000819228479	EF	On-Demand	Anodyne	GPR119	29	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)CC2CCCC2)C1	ZINC000819228482	EF	On-Demand	Anodyne	GPR119	29	42
C#CCOCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819228489	CD	On-Demand	Mild	ADRB2	49	57
C#CCOCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819228489	CD	On-Demand	Mild	ADRB1	69	47
C#CCOCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819228489	CD	On-Demand	Mild	ADRB3	39	47
C#CCOCCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819228489	CD	On-Demand	Mild	CASR	41	37
C#CCOCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819228493	CD	On-Demand	Mild	ADRB2	49	57
C#CCOCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819228493	CD	On-Demand	Mild	ADRB1	69	47
C#CCOCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819228493	CD	On-Demand	Mild	ADRB3	39	47
C#CCOCCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819228493	CD	On-Demand	Mild	CASR	41	37
C#CCOCCNC[C@H](O)COCc1ccccc1Cl	ZINC000819228495	CD	On-Demand	Mild	ADRB1	15	40
C#CCOCCNC[C@@H](O)COCc1ccccc1Cl	ZINC000819228498	CD	On-Demand	Mild	ADRB1	15	40
C#CCOCCNC[C@H](O)COCc1ccccc1	ZINC000819228501	CC	On-Demand	Mild	ADRB2	22	42
C#CCOCCNC[C@H](O)COCc1ccccc1	ZINC000819228501	CC	On-Demand	Mild	ADRB1	31	40
C#CCOCCNC[C@H](O)COCc1ccccc1	ZINC000819228501	CC	On-Demand	Mild	ADRB3	20	40
C#CCOCCNC[C@@H](O)COCc1ccccc1	ZINC000819228504	CC	On-Demand	Mild	ADRB2	22	42
C#CCOCCNC[C@@H](O)COCc1ccccc1	ZINC000819228504	CC	On-Demand	Mild	ADRB1	31	40
C#CCOCCNC[C@@H](O)COCc1ccccc1	ZINC000819228504	CC	On-Demand	Mild	ADRB3	20	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228548	EF	On-Demand	Anodyne	ACE	43	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228548	EF	On-Demand	Anodyne	SSTR2	40	34
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228548	EF	On-Demand	Anodyne	GHRHR	46	33
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228548	EF	On-Demand	Anodyne	GRIN2B	59	44
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228548	EF	On-Demand	Anodyne	CTSK	17	44
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228548	EF	On-Demand	Anodyne	MMP3	20	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228548	EF	On-Demand	Anodyne	REN	64	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228548	EF	On-Demand	Anodyne	FPR1	42	35
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228548	EF	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228548	EF	On-Demand	Anodyne	CCR8	24	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228548	EF	On-Demand	Anodyne	GPR119	42	45
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228548	EF	On-Demand	Anodyne	SFRP1	20	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228552	EF	On-Demand	Anodyne	ACE	43	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228552	EF	On-Demand	Anodyne	SSTR2	40	34
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228552	EF	On-Demand	Anodyne	GHRHR	46	33
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228552	EF	On-Demand	Anodyne	GRIN2B	59	44
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228552	EF	On-Demand	Anodyne	CTSK	17	44
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228552	EF	On-Demand	Anodyne	MMP3	20	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228552	EF	On-Demand	Anodyne	REN	64	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228552	EF	On-Demand	Anodyne	FPR1	42	35
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228552	EF	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228552	EF	On-Demand	Anodyne	CCR8	24	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228552	EF	On-Demand	Anodyne	GPR119	42	45
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228552	EF	On-Demand	Anodyne	SFRP1	20	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228555	EF	On-Demand	Anodyne	ACE	43	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228555	EF	On-Demand	Anodyne	SSTR2	40	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228555	EF	On-Demand	Anodyne	GHRHR	46	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228555	EF	On-Demand	Anodyne	GRIN2B	59	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228555	EF	On-Demand	Anodyne	CTSK	17	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228555	EF	On-Demand	Anodyne	MMP3	20	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228555	EF	On-Demand	Anodyne	REN	64	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228555	EF	On-Demand	Anodyne	FPR1	42	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228555	EF	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228555	EF	On-Demand	Anodyne	CCR8	24	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228555	EF	On-Demand	Anodyne	GPR119	42	45
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819228555	EF	On-Demand	Anodyne	SFRP1	20	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228559	EF	On-Demand	Anodyne	ACE	43	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228559	EF	On-Demand	Anodyne	SSTR2	40	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228559	EF	On-Demand	Anodyne	GHRHR	46	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228559	EF	On-Demand	Anodyne	GRIN2B	59	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228559	EF	On-Demand	Anodyne	CTSK	17	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228559	EF	On-Demand	Anodyne	MMP3	20	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228559	EF	On-Demand	Anodyne	REN	64	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228559	EF	On-Demand	Anodyne	FPR1	42	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228559	EF	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228559	EF	On-Demand	Anodyne	CCR8	24	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228559	EF	On-Demand	Anodyne	GPR119	42	45
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819228559	EF	On-Demand	Anodyne	SFRP1	20	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819228569	EF	On-Demand	Anodyne	GRIN2B	19	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819228569	EF	On-Demand	Anodyne	CACNA1I	46	31
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819228569	EF	On-Demand	Anodyne	GPR119	43	52
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819228569	EF	On-Demand	Anodyne	SFRP1	19	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819228572	EF	On-Demand	Anodyne	GRIN2B	19	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819228572	EF	On-Demand	Anodyne	CACNA1I	46	31
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819228572	EF	On-Demand	Anodyne	GPR119	43	52
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819228572	EF	On-Demand	Anodyne	SFRP1	19	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819228573	EF	On-Demand	Anodyne	GRIN2B	19	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819228573	EF	On-Demand	Anodyne	CACNA1I	46	31
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819228573	EF	On-Demand	Anodyne	GPR119	43	52
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819228573	EF	On-Demand	Anodyne	SFRP1	19	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819228574	EF	On-Demand	Anodyne	GRIN2B	19	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819228574	EF	On-Demand	Anodyne	CACNA1I	46	31
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819228574	EF	On-Demand	Anodyne	GPR119	43	52
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819228574	EF	On-Demand	Anodyne	SFRP1	19	40
C[C@H](CCNC[C@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228577	DG	On-Demand	Anodyne	ADRB2	31	40
C[C@H](CCNC[C@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228577	DG	On-Demand	Anodyne	ADRB1	47	47
C[C@H](CCNC[C@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228577	DG	On-Demand	Anodyne	ADRB3	70	47
C[C@H](CCNC[C@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228577	DG	On-Demand	Anodyne	DPP7	24	40
C[C@H](CCNC[C@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228577	DG	On-Demand	Anodyne	CYP3A4	41	34
C[C@H](CCNC[C@@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228578	DG	On-Demand	Anodyne	ADRB2	31	40
C[C@H](CCNC[C@@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228578	DG	On-Demand	Anodyne	ADRB1	47	47
C[C@H](CCNC[C@@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228578	DG	On-Demand	Anodyne	ADRB3	70	47
C[C@H](CCNC[C@@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228578	DG	On-Demand	Anodyne	DPP7	24	40
C[C@H](CCNC[C@@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228578	DG	On-Demand	Anodyne	CYP3A4	41	34
C[C@@H](CCNC[C@@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228579	DG	On-Demand	Anodyne	ADRB2	31	40
C[C@@H](CCNC[C@@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228579	DG	On-Demand	Anodyne	ADRB1	47	47
C[C@@H](CCNC[C@@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228579	DG	On-Demand	Anodyne	ADRB3	70	47
C[C@@H](CCNC[C@@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228579	DG	On-Demand	Anodyne	DPP7	24	40
C[C@@H](CCNC[C@@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228579	DG	On-Demand	Anodyne	CYP3A4	41	34
C[C@@H](CCNC[C@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228580	DG	On-Demand	Anodyne	ADRB2	31	40
C[C@@H](CCNC[C@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228580	DG	On-Demand	Anodyne	ADRB1	47	47
C[C@@H](CCNC[C@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228580	DG	On-Demand	Anodyne	ADRB3	70	47
C[C@@H](CCNC[C@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228580	DG	On-Demand	Anodyne	DPP7	24	40
C[C@@H](CCNC[C@H](O)c1cccc(Cl)c1)N1CCCCC1	ZINC000819228580	DG	On-Demand	Anodyne	CYP3A4	41	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2Br)C1	ZINC000819228583	GG	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2Br)C1	ZINC000819228583	GG	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2Br)C1	ZINC000819228587	GG	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2Br)C1	ZINC000819228587	GG	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2Br)C1	ZINC000819228589	GG	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2Br)C1	ZINC000819228589	GG	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2Br)C1	ZINC000819228590	GG	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2Br)C1	ZINC000819228590	GG	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2c(F)cccc2F)C1	ZINC000819228594	FF	On-Demand	Anodyne	CACNA1I	45	31
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2c(F)cccc2F)C1	ZINC000819228594	FF	On-Demand	Anodyne	GPR119	48	52
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2c(F)cccc2F)C1	ZINC000819228594	FF	On-Demand	Anodyne	SFRP1	15	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819228595	FF	On-Demand	Anodyne	CACNA1I	45	31
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819228595	FF	On-Demand	Anodyne	GPR119	48	52
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819228595	FF	On-Demand	Anodyne	SFRP1	15	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819228596	FF	On-Demand	Anodyne	CACNA1I	45	31
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819228596	FF	On-Demand	Anodyne	GPR119	48	52
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819228596	FF	On-Demand	Anodyne	SFRP1	15	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2c(F)cccc2F)C1	ZINC000819228597	FF	On-Demand	Anodyne	CACNA1I	45	31
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2c(F)cccc2F)C1	ZINC000819228597	FF	On-Demand	Anodyne	GPR119	48	52
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2c(F)cccc2F)C1	ZINC000819228597	FF	On-Demand	Anodyne	SFRP1	15	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819228598	EE	On-Demand	Mild	GPR119	39	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819228599	EE	On-Demand	Mild	GPR119	39	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819228600	EE	On-Demand	Mild	GPR119	39	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819228601	EE	On-Demand	Mild	GPR119	39	46
C#CCOCCNC[C@@H](O)COc1ccccc1F	ZINC000819228605	CC	On-Demand	Mild	ADRB2	32	43
C#CCOCCNC[C@@H](O)COc1ccccc1F	ZINC000819228605	CC	On-Demand	Mild	ADRB1	71	45
C#CCOCCNC[C@@H](O)COc1ccccc1F	ZINC000819228605	CC	On-Demand	Mild	ADRB3	18	40
C#CCOCCNC[C@H](O)COc1ccccc1F	ZINC000819228606	CC	On-Demand	Mild	ADRB2	32	43
C#CCOCCNC[C@H](O)COc1ccccc1F	ZINC000819228606	CC	On-Demand	Mild	ADRB1	71	45
C#CCOCCNC[C@H](O)COc1ccccc1F	ZINC000819228606	CC	On-Demand	Mild	ADRB3	18	40
C=CCC1(C(=O)N2CCC(NC(=O)Oc3ccccc3)CC2)CCOCC1	ZINC000819228650	FG	On-Demand	Mild	FAAH	24	43
O=C(NC1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1)Oc1ccccc1	ZINC000819228654	EF	On-Demand	Anodyne	C3AR1	27	41
O=C(NC1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1)Oc1ccccc1	ZINC000819228654	EF	On-Demand	Anodyne	FAAH	27	46
O=C(NC1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1)Oc1ccccc1	ZINC000819228655	EF	On-Demand	Anodyne	C3AR1	27	41
O=C(NC1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1)Oc1ccccc1	ZINC000819228655	EF	On-Demand	Anodyne	FAAH	27	46
O=C(NC1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1)Oc1ccccc1	ZINC000819228656	EF	On-Demand	Anodyne	C3AR1	27	41
O=C(NC1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1)Oc1ccccc1	ZINC000819228656	EF	On-Demand	Anodyne	FAAH	27	46
O=C(NC1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1)Oc1ccccc1	ZINC000819228657	EF	On-Demand	Anodyne	C3AR1	27	41
O=C(NC1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1)Oc1ccccc1	ZINC000819228657	EF	On-Demand	Anodyne	FAAH	27	46
CC[C@@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819228660	FG	On-Demand	Anodyne	PTPN1	30	40
CC[C@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1nc2ccccc2[nH]1	ZINC000819228661	FG	On-Demand	Anodyne	PTPN1	30	40
C=CCCn1cc(C(=O)N2CCC(NC(=O)Oc3ccccc3)CC2)nn1	ZINC000819228679	FE	On-Demand	Mild	FAAH	28	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc3c(c1)OCCCO3)C2	ZINC000819228687	FE	On-Demand	Anodyne	NOS2	65	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc3c(c1)OCCCO3)C2	ZINC000819228688	FE	On-Demand	Anodyne	NOS2	65	34
O=C(CCc1cccc(CCC(=O)N2CCC[C@@H](CO)CC2)c1)N1CCC[C@H](CO)CC1	ZINC000819228707	IF	On-Demand	Anodyne	GRIN2B	34	48
O=C(CCc1cccc(CCC(=O)N2CCC[C@@H](CO)CC2)c1)N1CCC[C@H](CO)CC1	ZINC000819228707	IF	On-Demand	Anodyne	C3AR1	42	41
O=C(CCc1cccc(CCC(=O)N2CCC[C@@H](CO)CC2)c1)N1CCC[C@H](CO)CC1	ZINC000819228707	IF	On-Demand	Anodyne	PREP	74	39
O=C(CCc1cccc(CCC(=O)N2CCC[C@H](CO)CC2)c1)N1CCC[C@H](CO)CC1	ZINC000819228708	IF	On-Demand	Anodyne	GRIN2B	34	48
O=C(CCc1cccc(CCC(=O)N2CCC[C@H](CO)CC2)c1)N1CCC[C@H](CO)CC1	ZINC000819228708	IF	On-Demand	Anodyne	C3AR1	42	41
O=C(CCc1cccc(CCC(=O)N2CCC[C@H](CO)CC2)c1)N1CCC[C@H](CO)CC1	ZINC000819228708	IF	On-Demand	Anodyne	PREP	74	39
O=C(c1c(O)cc(F)cc1F)N1CCC[C@@H](CO)CC1	ZINC000819228709	CD	On-Demand	Anodyne	L3MBTL3	40	37
O=C(c1c(O)cc(F)cc1F)N1CCC[C@H](CO)CC1	ZINC000819228710	CD	On-Demand	Anodyne	L3MBTL3	40	37
O=C(c1c(O)cccc1Cl)N1CCC[C@H](CO)CC1	ZINC000819228711	CE	On-Demand	Anodyne	CCR5	18	40
O=C(c1c(O)cccc1Cl)N1CCC[C@H](CO)CC1	ZINC000819228711	CE	On-Demand	Anodyne	L3MBTL3	83	41
O=C(c1c(O)cccc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819228712	CE	On-Demand	Anodyne	CCR5	18	40
O=C(c1c(O)cccc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819228712	CE	On-Demand	Anodyne	L3MBTL3	83	41
O=C(c1ccccc1Nc1ccc(SC(F)F)cc1)N1CCC[C@H](CO)CC1	ZINC000819228713	HJ	On-Demand	Anodyne	L3MBTL3	24	40
O=C(c1ccccc1Nc1ccc(SC(F)F)cc1)N1CCC[C@@H](CO)CC1	ZINC000819228714	HJ	On-Demand	Anodyne	L3MBTL3	24	40
O=C(C[C@H]1CCc2ccccc21)N1CCC[C@@H](CO)CC1	ZINC000819228715	CF	On-Demand	Anodyne	PREP	41	43
O=C(C[C@H]1CCc2ccccc21)N1CCC[C@H](CO)CC1	ZINC000819228716	CF	On-Demand	Anodyne	PREP	41	43
O=C(C[C@@H]1CCc2ccccc21)N1CCC[C@H](CO)CC1	ZINC000819228717	CF	On-Demand	Anodyne	PREP	41	43
O=C(C[C@@H]1CCc2ccccc21)N1CCC[C@@H](CO)CC1	ZINC000819228718	CF	On-Demand	Anodyne	PREP	41	43
Cc1nc(NC(=O)OC(C)(C)C)sc1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819228739	FG	On-Demand	Anodyne	CCR3	35	43
Cc1nc(NC(=O)OC(C)(C)C)sc1C(=O)N1CCC[C@H](CO)CC1	ZINC000819228740	FG	On-Demand	Anodyne	CCR3	35	43
O=C(CNc1ccccc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819228741	CE	On-Demand	Anodyne	SCD	22	45
O=C(CNc1ccccc1Cl)N1CCC[C@H](CO)CC1	ZINC000819228742	CE	On-Demand	Anodyne	SCD	22	45
O=C(CCn1c2ccccc2c2ccccc21)N1CCC[C@H](CO)CC1	ZINC000819228775	FH	On-Demand	Anodyne	HTR4	43	32
O=C(CCn1c2ccccc2c2ccccc21)N1CCC[C@H](CO)CC1	ZINC000819228775	FH	On-Demand	Anodyne	ETHR	41	33
O=C(CCn1c2ccccc2c2ccccc21)N1CCC[C@@H](CO)CC1	ZINC000819228776	FH	On-Demand	Anodyne	HTR4	43	32
O=C(CCn1c2ccccc2c2ccccc21)N1CCC[C@@H](CO)CC1	ZINC000819228776	FH	On-Demand	Anodyne	ETHR	41	33
C[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819228777	EG	On-Demand	Anodyne	RBP4	62	41
C[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819228777	EG	On-Demand	Anodyne	SFRP1	82	34
C[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819228777	EG	On-Demand	Anodyne	WNT3	65	34
C[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819228778	EG	On-Demand	Anodyne	RBP4	62	41
C[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819228778	EG	On-Demand	Anodyne	SFRP1	82	34
C[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819228778	EG	On-Demand	Anodyne	WNT3	65	34
C[C@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819228779	EG	On-Demand	Anodyne	RBP4	62	41
C[C@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819228779	EG	On-Demand	Anodyne	SFRP1	82	34
C[C@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819228779	EG	On-Demand	Anodyne	WNT3	65	34
C[C@H](C(=O)N1CCC[C@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819228780	EG	On-Demand	Anodyne	RBP4	62	41
C[C@H](C(=O)N1CCC[C@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819228780	EG	On-Demand	Anodyne	SFRP1	82	34
C[C@H](C(=O)N1CCC[C@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819228780	EG	On-Demand	Anodyne	WNT3	65	34
C/C(=C/C(=O)N1CCC[C@@H](CO)CC1)c1cccc(F)c1	ZINC000819228781	CF	On-Demand	Anodyne	ACKR3	64	35
C/C(=C/C(=O)N1CCC[C@H](CO)CC1)c1cccc(F)c1	ZINC000819228782	CF	On-Demand	Anodyne	ACKR3	64	35
O=C([C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl)N1CCC[C@H](CO)CC1	ZINC000819228783	IH	On-Demand	Anodyne	CPT2	43	38
O=C([C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl)N1CCC[C@H](CO)CC1	ZINC000819228783	IH	On-Demand	Anodyne	PREP	86	54
O=C([C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl)N1CCC[C@H](CO)CC1	ZINC000819228784	IH	On-Demand	Anodyne	CPT2	43	38
O=C([C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl)N1CCC[C@H](CO)CC1	ZINC000819228784	IH	On-Demand	Anodyne	PREP	86	54
O=C([C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819228785	IH	On-Demand	Anodyne	CPT2	43	38
O=C([C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819228785	IH	On-Demand	Anodyne	PREP	86	54
O=C([C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819228786	IH	On-Demand	Anodyne	CPT2	43	38
O=C([C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819228786	IH	On-Demand	Anodyne	PREP	86	54
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819228797	GE	On-Demand	Anodyne	EPHX2	15	40
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819228797	GE	On-Demand	Anodyne	ST14	64	35
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819228797	GE	On-Demand	Anodyne	SFRP1	92	38
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819228797	GE	On-Demand	Anodyne	WNT3	67	34
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819228797	GE	On-Demand	Anodyne	L3MBTL3	65	41
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819228798	GE	On-Demand	Anodyne	EPHX2	15	40
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819228798	GE	On-Demand	Anodyne	ST14	64	35
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819228798	GE	On-Demand	Anodyne	SFRP1	92	38
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819228798	GE	On-Demand	Anodyne	WNT3	67	34
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819228798	GE	On-Demand	Anodyne	L3MBTL3	65	41
CN(C)CC1(CNC[C@H](O)c2cccnc2)CCCC1	ZINC000819228885	CD	On-Demand	Anodyne	ADRB3	88	45
CN(C)CC1(CNC[C@@H](O)c2cccnc2)CCCC1	ZINC000819228888	CD	On-Demand	Anodyne	ADRB3	88	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cnn(CC(=O)N(C)C)c1)C2	ZINC000819228894	FC	On-Demand	Anodyne	PANC	44	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cnn(CC(=O)N(C)C)c1)C2	ZINC000819228895	FC	On-Demand	Anodyne	PANC	44	31
CC[C@@H](NC(=O)C(F)=C1CCC1)c1nc2ccccc2[nH]1	ZINC000819229011	CH	On-Demand	Anodyne	PTPN1	28	40
O=C(c1cc2c(Cl)cccc2s1)N1CCC[C@@H](CO)CC1	ZINC000819229020	DH	On-Demand	Anodyne	L3MBTL3	40	38
O=C(c1cc2c(Cl)cccc2s1)N1CCC[C@H](CO)CC1	ZINC000819229023	DH	On-Demand	Anodyne	L3MBTL3	40	38
O=C(c1cccc(I)c1O)N1CCC[C@H](CO)CC1	ZINC000819229033	GE	On-Demand	Anodyne	L3MBTL3	59	41
O=C(c1cccc(I)c1O)N1CCC[C@@H](CO)CC1	ZINC000819229035	GE	On-Demand	Anodyne	L3MBTL3	59	41
C#Cc1ccc(C(=O)N2CCC[C@@H](CO)CC2)cn1	ZINC000819229045	CD	On-Demand	Mild	L3MBTL3	89	47
C#Cc1ccc(C(=O)N2CCC[C@H](CO)CC2)cn1	ZINC000819229048	CD	On-Demand	Mild	L3MBTL3	89	47
CC(C)(C)OC(=O)N1CCC(CCC(=O)N2CCC[C@H](CO)CC2)CC1	ZINC000819229104	FG	On-Demand	Anodyne	PREP	16	42
CC(C)(C)OC(=O)N1CCC(CCC(=O)N2CCC[C@H](CO)CC2)CC1	ZINC000819229104	FG	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1CCC(CCC(=O)N2CCC[C@@H](CO)CC2)CC1	ZINC000819229105	FG	On-Demand	Anodyne	PREP	16	42
CC(C)(C)OC(=O)N1CCC(CCC(=O)N2CCC[C@@H](CO)CC2)CC1	ZINC000819229105	FG	On-Demand	Anodyne	GPR119	34	40
O=C(c1cc(F)c(C(F)(F)F)c(F)c1)N1CCC[C@@H](CO)CC1	ZINC000819229126	EG	On-Demand	Anodyne	L3MBTL3	54	37
O=C(c1cc(F)c(C(F)(F)F)c(F)c1)N1CCC[C@H](CO)CC1	ZINC000819229127	EG	On-Demand	Anodyne	L3MBTL3	54	37
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229136	FE	On-Demand	Anodyne	POLG_HCV1	27	46
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229137	FE	On-Demand	Anodyne	POLG_HCV1	27	46
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229138	FE	On-Demand	Anodyne	POLG_HCV1	27	46
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229139	FE	On-Demand	Anodyne	POLG_HCV1	27	46
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl)N1CCC[C@H](CO)CC1	ZINC000819229141	HF	On-Demand	Anodyne	CHRM2	23	40
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl)N1CCC[C@H](CO)CC1	ZINC000819229141	HF	On-Demand	Anodyne	EPHX2	17	43
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl)N1CCC[C@H](CO)CC1	ZINC000819229141	HF	On-Demand	Anodyne	AKR1C3	16	42
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl)N1CCC[C@H](CO)CC1	ZINC000819229141	HF	On-Demand	Anodyne	L3MBTL3	60	44
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819229142	HF	On-Demand	Anodyne	CHRM2	23	40
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819229142	HF	On-Demand	Anodyne	EPHX2	17	43
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819229142	HF	On-Demand	Anodyne	AKR1C3	16	42
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819229142	HF	On-Demand	Anodyne	L3MBTL3	60	44
O=C(c1cc2cccc(Cl)c2o1)N1CCC[C@@H](CO)CC1	ZINC000819229153	DG	On-Demand	Anodyne	L3MBTL3	44	38
O=C(c1cc2cccc(Cl)c2o1)N1CCC[C@H](CO)CC1	ZINC000819229154	DG	On-Demand	Anodyne	L3MBTL3	44	38
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819229168	IG	On-Demand	Anodyne	HCN1	49	34
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819229168	IG	On-Demand	Anodyne	HCN4	43	34
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819229168	IG	On-Demand	Anodyne	L3MBTL3	59	39
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819229170	IG	On-Demand	Anodyne	HCN1	49	34
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819229170	IG	On-Demand	Anodyne	HCN4	43	34
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819229170	IG	On-Demand	Anodyne	L3MBTL3	59	39
O=C(Cc1ccc(Br)c(Cl)c1)N1CCC[C@@H](CO)CC1	ZINC000819229171	FG	On-Demand	Anodyne	OPRK1	21	42
O=C(Cc1ccc(Br)c(Cl)c1)N1CCC[C@@H](CO)CC1	ZINC000819229171	FG	On-Demand	Anodyne	CCR3	15	42
O=C(Cc1ccc(Br)c(Cl)c1)N1CCC[C@H](CO)CC1	ZINC000819229173	FG	On-Demand	Anodyne	OPRK1	21	42
O=C(Cc1ccc(Br)c(Cl)c1)N1CCC[C@H](CO)CC1	ZINC000819229173	FG	On-Demand	Anodyne	CCR3	15	42
C[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1c(Cl)cccc1Cl	ZINC000819229174	EH	On-Demand	Anodyne	DPP7	50	37
C[C@H](C(=O)N1CCC[C@@H](CO)CC1)c1c(Cl)cccc1Cl	ZINC000819229175	EH	On-Demand	Anodyne	DPP7	50	37
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819229207	GG	On-Demand	Mild	CASR	42	36
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819229207	GG	On-Demand	Mild	PAPA1_CARPA	18	44
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819229207	GG	On-Demand	Mild	NR1H2	19	40
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819229208	GG	On-Demand	Mild	CASR	42	36
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819229208	GG	On-Demand	Mild	PAPA1_CARPA	18	44
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819229208	GG	On-Demand	Mild	NR1H2	19	40
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819229209	GG	On-Demand	Mild	CASR	42	36
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819229209	GG	On-Demand	Mild	PAPA1_CARPA	18	44
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819229209	GG	On-Demand	Mild	NR1H2	19	40
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819229210	GG	On-Demand	Mild	CASR	42	36
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819229210	GG	On-Demand	Mild	PAPA1_CARPA	18	44
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819229210	GG	On-Demand	Mild	NR1H2	19	40
Cc1cc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1Cl	ZINC000819229243	FF	On-Demand	Anodyne	ADRB3	28	41
Cc1cc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1Cl	ZINC000819229244	FF	On-Demand	Anodyne	ADRB3	28	41
O=[N+]([O-])c1ccc(S(=O)(=O)CCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819229296	FD	On-Demand	Bother	ADRB1	25	40
O=[N+]([O-])c1ccc(S(=O)(=O)CCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819229296	FD	On-Demand	Bother	ADRB3	58	40
O=[N+]([O-])c1ccc(S(=O)(=O)CCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819229297	FD	On-Demand	Bother	ADRB1	25	40
O=[N+]([O-])c1ccc(S(=O)(=O)CCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819229297	FD	On-Demand	Bother	ADRB3	58	40
O=[N+]([O-])c1ccc(S(=O)(=O)CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819229302	GD	On-Demand	Bother	ADRB3	65	35
O=[N+]([O-])c1ccc(S(=O)(=O)CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819229303	GD	On-Demand	Bother	ADRB3	65	35
Cc1csc([C@H](C)CNC[C@H](O)c2cccnc2)n1	ZINC000819229310	CE	On-Demand	Anodyne	ADRB2	25	49
Cc1csc([C@H](C)CNC[C@H](O)c2cccnc2)n1	ZINC000819229310	CE	On-Demand	Anodyne	ADRB1	26	49
Cc1csc([C@H](C)CNC[C@H](O)c2cccnc2)n1	ZINC000819229310	CE	On-Demand	Anodyne	ADRB3	99	56
Cc1csc([C@H](C)CNC[C@@H](O)c2cccnc2)n1	ZINC000819229311	CE	On-Demand	Anodyne	ADRB2	25	49
Cc1csc([C@H](C)CNC[C@@H](O)c2cccnc2)n1	ZINC000819229311	CE	On-Demand	Anodyne	ADRB1	26	49
Cc1csc([C@H](C)CNC[C@@H](O)c2cccnc2)n1	ZINC000819229311	CE	On-Demand	Anodyne	ADRB3	99	56
C[C@H](C(=O)N1CCC[C@H](CO)CC1)c1c(Cl)cccc1Cl	ZINC000819229332	EH	On-Demand	Anodyne	DPP7	50	37
C[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1c(Cl)cccc1Cl	ZINC000819229334	EH	On-Demand	Anodyne	DPP7	50	37
O=C(c1cc(-c2ccccc2)nc2cc(F)ccc12)N1CCC[C@H](CO)CC1	ZINC000819229351	GI	On-Demand	Anodyne	DHODH	36	47
O=C(c1cc(-c2ccccc2)nc2cc(F)ccc12)N1CCC[C@@H](CO)CC1	ZINC000819229354	GI	On-Demand	Anodyne	DHODH	36	47
NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](CO)CC2)ccc1F	ZINC000819229359	EC	On-Demand	Anodyne	L3MBTL3	77	39
NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](CO)CC2)ccc1F	ZINC000819229363	EC	On-Demand	Anodyne	L3MBTL3	77	39
O=C(c1cc(-c2ccccc2)nc2cc(Br)ccc12)N1CCC[C@H](CO)CC1	ZINC000819229374	IJ	On-Demand	Anodyne	PRS	70	47
O=C(c1cc(-c2ccccc2)nc2cc(Br)ccc12)N1CCC[C@@H](CO)CC1	ZINC000819229376	IJ	On-Demand	Anodyne	PRS	70	47
O=C([C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)N1CCC[C@@H](CO)CC1	ZINC000819229382	HD	On-Demand	Anodyne	APP	51	39
O=C([C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)N1CCC[C@@H](CO)CC1	ZINC000819229382	HD	On-Demand	Anodyne	ADAM17	15	45
O=C([C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)N1CCC[C@@H](CO)CC1	ZINC000819229382	HD	On-Demand	Anodyne	CYP3A4	19	40
O=C([C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)N1CCC[C@H](CO)CC1	ZINC000819229383	HD	On-Demand	Anodyne	APP	51	39
O=C([C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)N1CCC[C@H](CO)CC1	ZINC000819229383	HD	On-Demand	Anodyne	ADAM17	15	45
O=C([C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)N1CCC[C@H](CO)CC1	ZINC000819229383	HD	On-Demand	Anodyne	CYP3A4	19	40
O=C([C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)N1CCC[C@H](CO)CC1	ZINC000819229384	HD	On-Demand	Anodyne	APP	51	39
O=C([C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)N1CCC[C@H](CO)CC1	ZINC000819229384	HD	On-Demand	Anodyne	ADAM17	15	45
O=C([C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)N1CCC[C@H](CO)CC1	ZINC000819229384	HD	On-Demand	Anodyne	CYP3A4	19	40
O=C([C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)N1CCC[C@@H](CO)CC1	ZINC000819229385	HD	On-Demand	Anodyne	APP	51	39
O=C([C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)N1CCC[C@@H](CO)CC1	ZINC000819229385	HD	On-Demand	Anodyne	ADAM17	15	45
O=C([C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)N1CCC[C@@H](CO)CC1	ZINC000819229385	HD	On-Demand	Anodyne	CYP3A4	19	40
COCCn1cc(C(=O)N2CCC[C@@H](CO)CC2)ccc1=O	ZINC000819229388	DC	On-Demand	Anodyne	L3MBTL3	68	38
COCCn1cc(C(=O)N2CCC[C@H](CO)CC2)ccc1=O	ZINC000819229389	DC	On-Demand	Anodyne	L3MBTL3	68	38
CCc1nc2ccc(C(=O)N3CCC[C@H](CO)CC3)cc2nc1CC	ZINC000819229398	EF	On-Demand	Anodyne	L3MBTL3	82	41
CCc1nc2ccc(C(=O)N3CCC[C@H](CO)CC3)cc2nc1CC	ZINC000819229398	EF	On-Demand	Anodyne	HPGD	48	40
CCc1nc2ccc(C(=O)N3CCC[C@@H](CO)CC3)cc2nc1CC	ZINC000819229399	EF	On-Demand	Anodyne	L3MBTL3	82	41
CCc1nc2ccc(C(=O)N3CCC[C@@H](CO)CC3)cc2nc1CC	ZINC000819229399	EF	On-Demand	Anodyne	HPGD	48	40
COC(=O)N[C@@H](C(=O)N1CCC[C@H](CO)CC1)C(C)C	ZINC000819229402	CC	On-Demand	Anodyne	ELANE	41	38
COC(=O)N[C@@H](C(=O)N1CCC[C@H](CO)CC1)C(C)C	ZINC000819229402	CC	On-Demand	Anodyne	CCR1	45	43
COC(=O)N[C@@H](C(=O)N1CCC[C@@H](CO)CC1)C(C)C	ZINC000819229403	CC	On-Demand	Anodyne	ELANE	41	38
COC(=O)N[C@@H](C(=O)N1CCC[C@@H](CO)CC1)C(C)C	ZINC000819229403	CC	On-Demand	Anodyne	CCR1	45	43
COCc1cncc(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819229404	CD	On-Demand	Anodyne	L3MBTL3	45	34
COCc1cncc(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819229405	CD	On-Demand	Anodyne	L3MBTL3	45	34
O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1CCC[C@@H](CO)CC1	ZINC000819229410	GF	On-Demand	Bother	L3MBTL3	15	40
O=C(c1cc(F)cc([N+](=O)[O-])c1Br)N1CCC[C@H](CO)CC1	ZINC000819229411	GF	On-Demand	Bother	L3MBTL3	15	40
O=C(N[C@@]1(C(=O)N2CCC[C@H](CO)CC2)CCOC1)OCc1ccccc1	ZINC000819229432	GD	On-Demand	Anodyne	GRIN2B	27	41
O=C(N[C@@]1(C(=O)N2CCC[C@H](CO)CC2)CCOC1)OCc1ccccc1	ZINC000819229432	GD	On-Demand	Anodyne	SLC12A5	56	38
O=C(N[C@]1(C(=O)N2CCC[C@H](CO)CC2)CCOC1)OCc1ccccc1	ZINC000819229433	GD	On-Demand	Anodyne	GRIN2B	27	41
O=C(N[C@]1(C(=O)N2CCC[C@H](CO)CC2)CCOC1)OCc1ccccc1	ZINC000819229433	GD	On-Demand	Anodyne	SLC12A5	56	38
O=C(N[C@]1(C(=O)N2CCC[C@@H](CO)CC2)CCOC1)OCc1ccccc1	ZINC000819229434	GD	On-Demand	Anodyne	GRIN2B	27	41
O=C(N[C@]1(C(=O)N2CCC[C@@H](CO)CC2)CCOC1)OCc1ccccc1	ZINC000819229434	GD	On-Demand	Anodyne	SLC12A5	56	38
O=C(N[C@@]1(C(=O)N2CCC[C@@H](CO)CC2)CCOC1)OCc1ccccc1	ZINC000819229435	GD	On-Demand	Anodyne	GRIN2B	27	41
O=C(N[C@@]1(C(=O)N2CCC[C@@H](CO)CC2)CCOC1)OCc1ccccc1	ZINC000819229435	GD	On-Demand	Anodyne	SLC12A5	56	38
CN(CC(=O)N1CCC[C@H](CO)CC1)c1ccccc1	ZINC000819229442	CD	On-Demand	Anodyne	PREP	70	38
CN(CC(=O)N1CCC[C@@H](CO)CC1)c1ccccc1	ZINC000819229443	CD	On-Demand	Anodyne	PREP	70	38
O=C(c1ccc(O)c(F)c1)N1CCC[C@H](CO)CC1	ZINC000819229454	CD	On-Demand	Anodyne	L3MBTL3	93	43
O=C(c1ccc(O)c(F)c1)N1CCC[C@@H](CO)CC1	ZINC000819229455	CD	On-Demand	Anodyne	L3MBTL3	93	43
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819229613	ED	On-Demand	Anodyne	ADRB2	51	60
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819229613	ED	On-Demand	Anodyne	ADRB1	92	60
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819229613	ED	On-Demand	Anodyne	GRIN1	25	45
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819229613	ED	On-Demand	Anodyne	ADRB3	57	60
CC(=O)Nc1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819229614	ED	On-Demand	Anodyne	ADRB2	51	60
CC(=O)Nc1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819229614	ED	On-Demand	Anodyne	ADRB1	92	60
CC(=O)Nc1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819229614	ED	On-Demand	Anodyne	GRIN1	25	45
CC(=O)Nc1ccc(OC[C@H](O)CNCCC2(C)OCCO2)cc1	ZINC000819229614	ED	On-Demand	Anodyne	ADRB3	57	60
O=C1NCCc2ccc(CNC[C@H](O)c3cccc(Cl)c3)cc21	ZINC000819229652	EE	On-Demand	Anodyne	ADRB1	41	44
O=C1NCCc2ccc(CNC[C@H](O)c3cccc(Cl)c3)cc21	ZINC000819229652	EE	On-Demand	Anodyne	ADRB3	51	44
O=C1NCCc2ccc(CNC[C@@H](O)c3cccc(Cl)c3)cc21	ZINC000819229654	EE	On-Demand	Anodyne	ADRB1	41	44
O=C1NCCc2ccc(CNC[C@@H](O)c3cccc(Cl)c3)cc21	ZINC000819229654	EE	On-Demand	Anodyne	ADRB3	51	44
COC(=O)N[C@H](CC(C)C)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229708	DD	On-Demand	Anodyne	RIR1_HHV11	53	31
COC(=O)N[C@H](CC(C)C)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229708	DD	On-Demand	Anodyne	CACNA1B	17	42
COC(=O)N[C@H](CC(C)C)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229709	DD	On-Demand	Anodyne	RIR1_HHV11	53	31
COC(=O)N[C@H](CC(C)C)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229709	DD	On-Demand	Anodyne	CACNA1B	17	42
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](CO)CC2)ccc1Cl	ZINC000819229713	HF	On-Demand	Anodyne	SFRP1	45	36
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](CO)CC2)ccc1Cl	ZINC000819229713	HF	On-Demand	Anodyne	L3MBTL3	69	36
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](CO)CC2)ccc1Cl	ZINC000819229715	HF	On-Demand	Anodyne	SFRP1	45	36
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](CO)CC2)ccc1Cl	ZINC000819229715	HF	On-Demand	Anodyne	L3MBTL3	69	36
CC(C)(C)OC(=O)N1CCC(Cc2ccccc2C(=O)N2CCC[C@H](CO)CC2)CC1	ZINC000819229724	II	On-Demand	Anodyne	GRIN2B	46	38
CC(C)(C)OC(=O)N1CCC(Cc2ccccc2C(=O)N2CCC[C@H](CO)CC2)CC1	ZINC000819229724	II	On-Demand	Anodyne	GPR119	41	43
CC(C)(C)OC(=O)N1CCC(Cc2ccccc2C(=O)N2CCC[C@@H](CO)CC2)CC1	ZINC000819229725	II	On-Demand	Anodyne	GRIN2B	46	38
CC(C)(C)OC(=O)N1CCC(Cc2ccccc2C(=O)N2CCC[C@@H](CO)CC2)CC1	ZINC000819229725	II	On-Demand	Anodyne	GPR119	41	43
O=C(c1sc(-c2ccccc2)nc1C(F)F)N1CCC[C@@H](CO)CC1	ZINC000819229736	FH	On-Demand	Anodyne	GRIN2B	41	36
O=C(c1sc(-c2ccccc2)nc1C(F)F)N1CCC[C@H](CO)CC1	ZINC000819229737	FH	On-Demand	Anodyne	GRIN2B	41	36
CC(C)(C)OC(=O)NCCCCCCC(=O)N1CCC[C@H](CO)CC1	ZINC000819229746	FG	On-Demand	Anodyne	PREP	17	51
CC(C)(C)OC(=O)NCCCCCCC(=O)N1CCC[C@@H](CO)CC1	ZINC000819229748	FG	On-Demand	Anodyne	PREP	17	51
O=C(CCc1cc(C(F)(F)F)ccc1Br)N1CCC[C@@H](CO)CC1	ZINC000819229750	HI	On-Demand	Anodyne	LIPG	44	35
O=C(CCc1cc(C(F)(F)F)ccc1Br)N1CCC[C@H](CO)CC1	ZINC000819229752	HI	On-Demand	Anodyne	LIPG	44	35
O=C(CCCCc1ccc(Br)cc1)N1CCC[C@H](CO)CC1	ZINC000819229754	FH	On-Demand	Anodyne	PREP	52	42
O=C(CCCCc1ccc(Br)cc1)N1CCC[C@@H](CO)CC1	ZINC000819229757	FH	On-Demand	Anodyne	PREP	52	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	F2	49	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	PLG	50	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	PRSS1	19	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	ACE	32	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	SSTR2	45	34
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	GHRHR	63	38
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	P2RY12	56	38
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	CELA1	36	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	GRIN2B	26	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	ELANE	26	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	PGC	60	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	CMA1	35	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	CTRA_BOVIN	62	34
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	KLK3	69	33
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	CTSB	44	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	PAPA1_CARPA	49	39
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	TRY1_BOVIN	43	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	CYSP_TRYCR	48	39
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	CCKAR	51	48
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	CTSG	43	34
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	CTSK	46	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	CTSL	46	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	CACNA1B	52	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	PGA	37	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	PREP	39	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	CAPNS1	67	35
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	CELA2A	52	34
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	REN	107	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	LGMN	48	36
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	CCKBR	23	47
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	CTSS	41	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	CAPN1	73	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	CAPN2	106	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	CTSE	19	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	TGM2	38	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	KLK5	45	51
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	ST14	54	33
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229759	IF	On-Demand	Anodyne	FPR1	50	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	F2	49	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	PLG	50	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	PRSS1	19	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	ACE	32	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	SSTR2	45	34
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	GHRHR	63	38
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	P2RY12	56	38
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	CELA1	36	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	GRIN2B	26	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	ELANE	26	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	PGC	60	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	CMA1	35	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	CTRA_BOVIN	62	34
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	KLK3	69	33
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	CTSB	44	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	PAPA1_CARPA	49	39
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	TRY1_BOVIN	43	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	CYSP_TRYCR	48	39
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	CCKAR	51	48
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	CTSG	43	34
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	CTSK	46	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	CTSL	46	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	CACNA1B	52	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	PGA	37	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	PREP	39	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	CAPNS1	67	35
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	CELA2A	52	34
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	REN	107	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	LGMN	48	36
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	CCKBR	23	47
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	CTSS	41	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	CAPN1	73	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	CAPN2	106	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	CTSE	19	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	TGM2	38	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	KLK5	45	51
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	ST14	54	33
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229767	IF	On-Demand	Anodyne	FPR1	50	45
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1)N1CCC[C@H](CO)CC1	ZINC000819229781	IG	On-Demand	Anodyne	CNR2	18	66
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1)N1CCC[C@H](CO)CC1	ZINC000819229781	IG	On-Demand	Anodyne	EPHX2	26	42
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1)N1CCC[C@H](CO)CC1	ZINC000819229781	IG	On-Demand	Anodyne	L3MBTL3	88	43
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1)N1CCC[C@H](CO)CC1	ZINC000819229781	IG	On-Demand	Anodyne	HPGD	41	38
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819229783	IG	On-Demand	Anodyne	CNR2	18	66
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819229783	IG	On-Demand	Anodyne	EPHX2	26	42
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819229783	IG	On-Demand	Anodyne	L3MBTL3	88	43
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819229783	IG	On-Demand	Anodyne	HPGD	41	38
O=C(c1cccnc1-n1cccn1)N1CCC[C@@H](CO)CC1	ZINC000819229792	DD	On-Demand	Anodyne	L3MBTL3	56	39
O=C(c1cccnc1-n1cccn1)N1CCC[C@H](CO)CC1	ZINC000819229794	DD	On-Demand	Anodyne	L3MBTL3	56	39
O=C(c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl)N1CCC[C@H](CO)CC1	ZINC000819229800	HD	On-Demand	Anodyne	CHRM2	23	40
O=C(c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819229802	HD	On-Demand	Anodyne	CHRM2	23	40
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819229807	IG	On-Demand	Anodyne	SFRP1	46	38
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819229809	IG	On-Demand	Anodyne	SFRP1	46	38
CC(C)(C)OC(=O)N1CCC(Nc2ccccc2)(C(=O)N2CCC[C@H](CO)CC2)CC1	ZINC000819229818	IG	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CCC(Nc2ccccc2)(C(=O)N2CCC[C@H](CO)CC2)CC1	ZINC000819229818	IG	On-Demand	Anodyne	SFRP1	32	43
CC(C)(C)OC(=O)N1CCC(Nc2ccccc2)(C(=O)N2CCC[C@@H](CO)CC2)CC1	ZINC000819229820	IG	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CCC(Nc2ccccc2)(C(=O)N2CCC[C@@H](CO)CC2)CC1	ZINC000819229820	IG	On-Demand	Anodyne	SFRP1	32	43
COc1ccc(C(=O)N2CCC[C@@H](CO)CC2)c(Cl)c1	ZINC000819229829	CF	On-Demand	Anodyne	CHRM2	30	41
COc1ccc(C(=O)N2CCC[C@@H](CO)CC2)c(Cl)c1	ZINC000819229829	CF	On-Demand	Anodyne	L3MBTL3	43	34
COc1ccc(C(=O)N2CCC[C@H](CO)CC2)c(Cl)c1	ZINC000819229831	CF	On-Demand	Anodyne	CHRM2	30	41
COc1ccc(C(=O)N2CCC[C@H](CO)CC2)c(Cl)c1	ZINC000819229831	CF	On-Demand	Anodyne	L3MBTL3	43	34
CCOc1ccc(OC[C@H](O)CNC2CC(OC)C2)cc1	ZINC000819229836	CD	On-Demand	Anodyne	ADRB2	45	43
CCOc1ccc(OC[C@H](O)CNC2CC(OC)C2)cc1	ZINC000819229836	CD	On-Demand	Anodyne	ADRB1	51	44
CCOc1ccc(OC[C@H](O)CNC2CC(OC)C2)cc1	ZINC000819229836	CD	On-Demand	Anodyne	ADRB3	33	44
CCOc1ccc(OC[C@@H](O)CNC2CC(OC)C2)cc1	ZINC000819229838	CD	On-Demand	Anodyne	ADRB2	45	43
CCOc1ccc(OC[C@@H](O)CNC2CC(OC)C2)cc1	ZINC000819229838	CD	On-Demand	Anodyne	ADRB1	51	44
CCOc1ccc(OC[C@@H](O)CNC2CC(OC)C2)cc1	ZINC000819229838	CD	On-Demand	Anodyne	ADRB3	33	44
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229844	DF	On-Demand	Bother	SLC27A4	48	31
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229845	DF	On-Demand	Bother	SLC27A4	48	31
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819229846	DF	On-Demand	Bother	SLC27A4	48	31
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819229847	DF	On-Demand	Bother	SLC27A4	48	31
C#Cc1ccc(C(=O)N2CCC[C@@H](CO)CC2)nc1	ZINC000819229952	CD	On-Demand	Mild	L3MBTL3	50	46
C#Cc1ccc(C(=O)N2CCC[C@H](CO)CC2)nc1	ZINC000819229953	CD	On-Demand	Mild	L3MBTL3	50	46
O=C(c1cccc(Nc2ncccn2)c1)N1CCC[C@H](CO)CC1	ZINC000819229966	EE	On-Demand	Anodyne	CCR3	21	40
O=C(c1cccc(Nc2ncccn2)c1)N1CCC[C@H](CO)CC1	ZINC000819229966	EE	On-Demand	Anodyne	L3MBTL3	77	44
O=C(c1cccc(Nc2ncccn2)c1)N1CCC[C@H](CO)CC1	ZINC000819229966	EE	On-Demand	Anodyne	SMG1	18	43
O=C(c1cccc(Nc2ncccn2)c1)N1CCC[C@@H](CO)CC1	ZINC000819229967	EE	On-Demand	Anodyne	CCR3	21	40
O=C(c1cccc(Nc2ncccn2)c1)N1CCC[C@@H](CO)CC1	ZINC000819229967	EE	On-Demand	Anodyne	L3MBTL3	77	44
O=C(c1cccc(Nc2ncccn2)c1)N1CCC[C@@H](CO)CC1	ZINC000819229967	EE	On-Demand	Anodyne	SMG1	18	43
O=C(CCCc1ccccn1)N1CCC[C@H](CO)CC1	ZINC000819229972	CE	On-Demand	Anodyne	GRIN2B	18	46
O=C(CCCc1ccccn1)N1CCC[C@H](CO)CC1	ZINC000819229972	CE	On-Demand	Anodyne	PREP	57	41
O=C(CCCc1ccccn1)N1CCC[C@@H](CO)CC1	ZINC000819229973	CE	On-Demand	Anodyne	GRIN2B	18	46
O=C(CCCc1ccccn1)N1CCC[C@@H](CO)CC1	ZINC000819229973	CE	On-Demand	Anodyne	PREP	57	41
CN(C)c1cc(C(=O)N2CCC[C@@H](CO)CC2)cc(Cl)n1	ZINC000819229996	DE	On-Demand	Anodyne	L3MBTL3	42	36
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@H](CO)CC1	ZINC000819229998	HF	On-Demand	Anodyne	CNR2	18	66
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@H](CO)CC1	ZINC000819229998	HF	On-Demand	Anodyne	EPHX2	26	42
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@H](CO)CC1	ZINC000819229998	HF	On-Demand	Anodyne	L3MBTL3	88	43
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@H](CO)CC1	ZINC000819229998	HF	On-Demand	Anodyne	HPGD	41	38
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819229999	HF	On-Demand	Anodyne	CNR2	18	66
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819229999	HF	On-Demand	Anodyne	EPHX2	26	42
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819229999	HF	On-Demand	Anodyne	L3MBTL3	88	43
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819229999	HF	On-Demand	Anodyne	HPGD	41	38
O[C@H](CN[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819230009	EI	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CN[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819230009	EI	On-Demand	Anodyne	ADRB3	40	44
O[C@H](CN[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819230009	EI	On-Demand	Anodyne	CYP3A4	41	34
O[C@H](CN[C@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819230011	EI	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CN[C@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819230011	EI	On-Demand	Anodyne	ADRB3	40	44
O[C@H](CN[C@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819230011	EI	On-Demand	Anodyne	CYP3A4	41	34
O[C@H](CN[C@H]1CCO[C@H](c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819230012	EI	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CN[C@H]1CCO[C@H](c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819230012	EI	On-Demand	Anodyne	ADRB3	40	44
O[C@H](CN[C@H]1CCO[C@H](c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819230012	EI	On-Demand	Anodyne	CYP3A4	41	34
O=C(N/C(=C/c1cccnc1)C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1	ZINC000819230013	GE	On-Demand	Anodyne	C3AR1	33	40
O[C@H](CN[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819230014	EI	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CN[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819230014	EI	On-Demand	Anodyne	ADRB3	40	44
O[C@H](CN[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819230014	EI	On-Demand	Anodyne	CYP3A4	41	34
O=C(N/C(=C\c1cccnc1)C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1	ZINC000819230015	GE	On-Demand	Anodyne	C3AR1	33	40
O=C(N/C(=C\c1cccnc1)C(=O)N1CCC[C@H](CO)CC1)c1ccccc1	ZINC000819230017	GE	On-Demand	Anodyne	C3AR1	33	40
O=C(N/C(=C/c1cccnc1)C(=O)N1CCC[C@H](CO)CC1)c1ccccc1	ZINC000819230019	GE	On-Demand	Anodyne	C3AR1	33	40
CC(C)(C)OC(=O)N1CCCC(C)(C)[C@@H]1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230031	FG	On-Demand	Anodyne	PREP	16	50
CC(C)(C)OC(=O)N1CCCC(C)(C)[C@@H]1C(=O)N1CCC[C@H](CO)CC1	ZINC000819230032	FG	On-Demand	Anodyne	PREP	16	50
CC(C)(C)OC(=O)N1CCCC(C)(C)[C@H]1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230033	FG	On-Demand	Anodyne	PREP	16	50
CC(C)(C)OC(=O)N1CCCC(C)(C)[C@H]1C(=O)N1CCC[C@H](CO)CC1	ZINC000819230034	FG	On-Demand	Anodyne	PREP	16	50
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	F2	77	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	PLG	54	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	PRSS1	27	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	ACE	46	52
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	OPRM1	24	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	GHRHR	61	34
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	P2RY12	179	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	GRIN2B	35	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	ELANE	22	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	CMA1	15	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	CTRA_BOVIN	69	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	CASP3	15	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	KLK3	94	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	CTSB	62	47
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	PAPA1_CARPA	59	36
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	TRY1_BOVIN	64	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	CYSP_TRYCR	56	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	CTSG	48	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	CTSK	53	50
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	CTSL	51	50
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	CACNA1B	33	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	NPFFR2	44	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	PREP	56	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	CAPNS1	73	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	CELA2A	57	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	REN	53	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	LGMN	76	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	MMP11	50	32
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	TGM1	26	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	CCKBR	18	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	CTSS	36	50
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	CAPN1	91	47
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	CAPN2	134	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	PLAU	20	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	TGM2	48	54
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	DPP7	50	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	TPSAB1	47	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	ST14	89	35
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	NPR	44	32
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	Q9NAW4_PLAFA	35	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	TMPRSS11D	46	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819230056	GD	On-Demand	Anodyne	TMPRSS6	51	35
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	F2	77	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	PLG	54	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	PRSS1	27	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	ACE	46	52
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	OPRM1	24	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	GHRHR	61	34
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	P2RY12	179	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	GRIN2B	35	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	ELANE	22	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	CMA1	15	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	CTRA_BOVIN	69	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	CASP3	15	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	KLK3	94	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	CTSB	62	47
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	PAPA1_CARPA	59	36
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	TRY1_BOVIN	64	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	CYSP_TRYCR	56	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	CTSG	48	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	CTSK	53	50
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	CTSL	51	50
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	CACNA1B	33	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	NPFFR2	44	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	PREP	56	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	CAPNS1	73	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	CELA2A	57	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	REN	53	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	LGMN	76	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	MMP11	50	32
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	TGM1	26	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	CCKBR	18	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	CTSS	36	50
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	CAPN1	91	47
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	CAPN2	134	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	PLAU	20	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	TGM2	48	54
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	DPP7	50	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	TPSAB1	47	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	ST14	89	35
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	NPR	44	32
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	Q9NAW4_PLAFA	35	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	TMPRSS11D	46	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819230058	GD	On-Demand	Anodyne	TMPRSS6	51	35
O[C@@H](CN[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819230062	DG	On-Demand	Anodyne	SLC6A3	20	57
O[C@@H](CN[C@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819230064	DG	On-Demand	Anodyne	SLC6A3	20	57
O[C@@H](CN[C@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819230066	DG	On-Demand	Anodyne	SLC6A3	20	57
O[C@H](CN[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819230068	DG	On-Demand	Anodyne	SLC6A3	20	57
O[C@H](CN[C@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819230070	DG	On-Demand	Anodyne	SLC6A3	20	57
O[C@H](CN[C@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819230074	DG	On-Demand	Anodyne	SLC6A3	20	57
O[C@H](CN[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819230075	DG	On-Demand	Anodyne	SLC6A3	20	57
O[C@@H](CN[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819230076	DG	On-Demand	Anodyne	SLC6A3	20	57
Cc1cc(CNC[C@H](O)c2ccccc2)ccc1Cl	ZINC000819230098	CG	On-Demand	Anodyne	ADRB2	27	45
Cc1cc(CNC[C@H](O)c2ccccc2)ccc1Cl	ZINC000819230098	CG	On-Demand	Anodyne	ADRB1	37	41
Cc1cc(CNC[C@H](O)c2ccccc2)ccc1Cl	ZINC000819230098	CG	On-Demand	Anodyne	ADRB3	54	39
Cc1cc(CNC[C@@H](O)c2ccccc2)ccc1Cl	ZINC000819230104	CG	On-Demand	Anodyne	ADRB2	27	45
Cc1cc(CNC[C@@H](O)c2ccccc2)ccc1Cl	ZINC000819230104	CG	On-Demand	Anodyne	ADRB1	37	41
Cc1cc(CNC[C@@H](O)c2ccccc2)ccc1Cl	ZINC000819230104	CG	On-Demand	Anodyne	ADRB3	54	39
Cc1cc(Br)cn2cc(CCNC[C@H](O)c3ccccc3)nc12	ZINC000819230129	FG	On-Demand	Anodyne	ADRB2	18	40
Cc1cc(Br)cn2cc(CCNC[C@H](O)c3ccccc3)nc12	ZINC000819230129	FG	On-Demand	Anodyne	ADRB3	51	38
Cc1cc(Br)cn2cc(CCNC[C@@H](O)c3ccccc3)nc12	ZINC000819230132	FG	On-Demand	Anodyne	ADRB2	18	40
Cc1cc(Br)cn2cc(CCNC[C@@H](O)c3ccccc3)nc12	ZINC000819230132	FG	On-Demand	Anodyne	ADRB3	51	38
Cc1cc(Br)cn2cc(CCNC[C@H](O)c3cccnc3)nc12	ZINC000819230144	GF	On-Demand	Anodyne	ADRB2	26	41
Cc1cc(Br)cn2cc(CCNC[C@H](O)c3cccnc3)nc12	ZINC000819230144	GF	On-Demand	Anodyne	ADRB1	28	42
Cc1cc(Br)cn2cc(CCNC[C@H](O)c3cccnc3)nc12	ZINC000819230144	GF	On-Demand	Anodyne	ADRB3	100	46
Cc1cc(Br)cn2cc(CCNC[C@@H](O)c3cccnc3)nc12	ZINC000819230147	GF	On-Demand	Anodyne	ADRB2	26	41
Cc1cc(Br)cn2cc(CCNC[C@@H](O)c3cccnc3)nc12	ZINC000819230147	GF	On-Demand	Anodyne	ADRB1	28	42
Cc1cc(Br)cn2cc(CCNC[C@@H](O)c3cccnc3)nc12	ZINC000819230147	GF	On-Demand	Anodyne	ADRB3	100	46
Cc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1Cl	ZINC000819230270	DG	On-Demand	Bother	ADRB1	22	41
Cc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1Cl	ZINC000819230270	DG	On-Demand	Bother	CACNA1C	47	35
Cc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1Cl	ZINC000819230270	DG	On-Demand	Bother	CACNA1D	75	35
Cc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1Cl	ZINC000819230271	DG	On-Demand	Bother	ADRB1	22	41
Cc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1Cl	ZINC000819230271	DG	On-Demand	Bother	CACNA1C	47	35
Cc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1Cl	ZINC000819230271	DG	On-Demand	Bother	CACNA1D	75	35
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819230367	GE	On-Demand	Mild	ADRB1	43	34
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819230369	GE	On-Demand	Mild	ADRB1	43	34
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819230371	GE	On-Demand	Mild	ADRB1	43	34
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819230373	GE	On-Demand	Mild	ADRB1	43	34
CCO[C@@H]1C[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)[C@]12CCCO2	ZINC000819230383	ED	On-Demand	Bother	CACNA1D	48	33
CCO[C@@H]1C[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@]12CCCO2	ZINC000819230385	ED	On-Demand	Bother	CACNA1D	48	33
CCO[C@@H]1C[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@@]12CCCO2	ZINC000819230386	ED	On-Demand	Bother	CACNA1D	48	33
CCO[C@@H]1C[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@]12CCCO2	ZINC000819230388	ED	On-Demand	Bother	CACNA1D	48	33
O=[N+]([O-])c1ccc(S(=O)(=O)CCNC[C@H](O)c2cccnc2)cc1	ZINC000819230389	FD	On-Demand	Bother	ADRB2	28	48
O=[N+]([O-])c1ccc(S(=O)(=O)CCNC[C@H](O)c2cccnc2)cc1	ZINC000819230389	FD	On-Demand	Bother	ADRB1	30	45
O=[N+]([O-])c1ccc(S(=O)(=O)CCNC[C@H](O)c2cccnc2)cc1	ZINC000819230389	FD	On-Demand	Bother	ADRB3	115	51
O=[N+]([O-])c1ccc(S(=O)(=O)CCNC[C@@H](O)c2cccnc2)cc1	ZINC000819230391	FD	On-Demand	Bother	ADRB2	28	48
O=[N+]([O-])c1ccc(S(=O)(=O)CCNC[C@@H](O)c2cccnc2)cc1	ZINC000819230391	FD	On-Demand	Bother	ADRB1	30	45
O=[N+]([O-])c1ccc(S(=O)(=O)CCNC[C@@H](O)c2cccnc2)cc1	ZINC000819230391	FD	On-Demand	Bother	ADRB3	115	51
O[C@H](CN[C@H]1CCO[C@H](c2ccc(F)cc2)C1)c1cccnc1	ZINC000819230452	DF	On-Demand	Anodyne	ADRB3	39	42
O[C@H](CN[C@@H]1CCO[C@H](c2ccc(F)cc2)C1)c1cccnc1	ZINC000819230453	DF	On-Demand	Anodyne	ADRB3	39	42
O[C@H](CN[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1cccnc1	ZINC000819230454	DF	On-Demand	Anodyne	ADRB3	39	42
O[C@H](CN[C@H]1CCO[C@@H](c2ccc(F)cc2)C1)c1cccnc1	ZINC000819230455	DF	On-Demand	Anodyne	ADRB3	39	42
CC(=O)Nc1cccc(CC(=O)NCCSC(C)(C)C)c1	ZINC000819230498	DF	On-Demand	Anodyne	KCNK3	43	33
CC(=O)Nc1cccc(CC(=O)Nc2ccnn2C2CCCCC2)c1	ZINC000819230500	EH	On-Demand	Anodyne	CCKBR	19	40
O=C1NCCc2ccc(CNC[C@H](O)c3cccnc3)cc21	ZINC000819230512	CD	On-Demand	Anodyne	ADRB2	22	42
O=C1NCCc2ccc(CNC[C@H](O)c3cccnc3)cc21	ZINC000819230512	CD	On-Demand	Anodyne	ADRB3	96	44
O=C1NCCc2ccc(CNC[C@@H](O)c3cccnc3)cc21	ZINC000819230514	CD	On-Demand	Anodyne	ADRB2	22	42
O=C1NCCc2ccc(CNC[C@@H](O)c3cccnc3)cc21	ZINC000819230514	CD	On-Demand	Anodyne	ADRB3	96	44
COc1cccc(OC)c1OC[C@H](O)CNCCC1(C)OCCO1	ZINC000819230532	ED	On-Demand	Anodyne	ADRB2	33	44
COc1cccc(OC)c1OC[C@H](O)CNCCC1(C)OCCO1	ZINC000819230532	ED	On-Demand	Anodyne	ADRB1	46	35
COc1cccc(OC)c1OC[C@@H](O)CNCCC1(C)OCCO1	ZINC000819230533	ED	On-Demand	Anodyne	ADRB2	33	44
COc1cccc(OC)c1OC[C@@H](O)CNCCC1(C)OCCO1	ZINC000819230533	ED	On-Demand	Anodyne	ADRB1	46	35
Cc1cc(Br)cn2cc(CNC[C@H](O)c3cccnc3)nc12	ZINC000819230535	FF	On-Demand	Anodyne	ADRB3	72	41
Cc1cc(Br)cn2cc(CNC[C@@H](O)c3cccnc3)nc12	ZINC000819230537	FF	On-Demand	Anodyne	ADRB3	72	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2F)C1	ZINC000819230541	EF	On-Demand	Anodyne	GRIN2B	18	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2F)C1	ZINC000819230541	EF	On-Demand	Anodyne	CACNA1I	47	32
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2F)C1	ZINC000819230541	EF	On-Demand	Anodyne	GPR119	47	51
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2F)C1	ZINC000819230541	EF	On-Demand	Anodyne	SFRP1	21	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2F)C1	ZINC000819230545	EF	On-Demand	Anodyne	GRIN2B	18	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2F)C1	ZINC000819230545	EF	On-Demand	Anodyne	CACNA1I	47	32
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2F)C1	ZINC000819230545	EF	On-Demand	Anodyne	GPR119	47	51
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2F)C1	ZINC000819230545	EF	On-Demand	Anodyne	SFRP1	21	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2F)C1	ZINC000819230551	EF	On-Demand	Anodyne	GRIN2B	18	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2F)C1	ZINC000819230551	EF	On-Demand	Anodyne	CACNA1I	47	32
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2F)C1	ZINC000819230551	EF	On-Demand	Anodyne	GPR119	47	51
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2F)C1	ZINC000819230551	EF	On-Demand	Anodyne	SFRP1	21	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2F)C1	ZINC000819230555	EF	On-Demand	Anodyne	GRIN2B	18	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2F)C1	ZINC000819230555	EF	On-Demand	Anodyne	CACNA1I	47	32
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2F)C1	ZINC000819230555	EF	On-Demand	Anodyne	GPR119	47	51
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2F)C1	ZINC000819230555	EF	On-Demand	Anodyne	SFRP1	21	41
C#CCOCCNC[C@H](O)COc1ccccc1C(C)C	ZINC000819230579	CD	On-Demand	Mild	ADRB2	42	48
C#CCOCCNC[C@H](O)COc1ccccc1C(C)C	ZINC000819230579	CD	On-Demand	Mild	ADRB1	70	38
C#CCOCCNC[C@H](O)COc1ccccc1C(C)C	ZINC000819230579	CD	On-Demand	Mild	ADRB3	18	42
C#CCOCCNC[C@H](O)COc1ccccc1C(C)C	ZINC000819230579	CD	On-Demand	Mild	ABCB1	21	47
C#CCOCCNC[C@@H](O)COc1ccccc1C(C)C	ZINC000819230584	CD	On-Demand	Mild	ADRB2	42	48
C#CCOCCNC[C@@H](O)COc1ccccc1C(C)C	ZINC000819230584	CD	On-Demand	Mild	ADRB1	70	38
C#CCOCCNC[C@@H](O)COc1ccccc1C(C)C	ZINC000819230584	CD	On-Demand	Mild	ADRB3	18	42
C#CCOCCNC[C@@H](O)COc1ccccc1C(C)C	ZINC000819230584	CD	On-Demand	Mild	ABCB1	21	47
CC(C)(C)OC(=O)N1CC[C@@H](CNCCS(=O)(=O)c2ccc(C#N)cn2)C1	ZINC000819230589	GD	On-Demand	Mild	GPR119	61	45
CC(C)(C)OC(=O)N1CC[C@H](CNCCS(=O)(=O)c2ccc(C#N)cn2)C1	ZINC000819230593	GD	On-Demand	Mild	GPR119	61	45
CC[C@H](O)CNC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819230605	CD	On-Demand	Anodyne	GPR119	34	42
CC[C@@H](O)CNC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819230610	CD	On-Demand	Anodyne	GPR119	34	42
CC[C@H](O)CNC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819230614	CD	On-Demand	Anodyne	GPR119	34	42
CC[C@@H](O)CNC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819230616	CD	On-Demand	Anodyne	GPR119	34	42
C#CCOCCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819230617	CC	On-Demand	Mild	ADRB2	30	42
C#CCOCCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819230617	CC	On-Demand	Mild	ADRB1	63	40
C#CCOCCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819230617	CC	On-Demand	Mild	ADRB3	17	42
C#CCOCCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819230618	CC	On-Demand	Mild	ADRB2	30	42
C#CCOCCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819230618	CC	On-Demand	Mild	ADRB1	63	40
C#CCOCCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819230618	CC	On-Demand	Mild	ADRB3	17	42
C#CCOCCNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819230630	CC	On-Demand	Mild	ADRB2	48	45
C#CCOCCNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819230630	CC	On-Demand	Mild	ADRB1	81	49
C#CCOCCNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819230630	CC	On-Demand	Mild	ADRB3	46	49
C#CCOCCNC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819230630	CC	On-Demand	Mild	ABCB1	15	59
C#CCOCCNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819230631	CC	On-Demand	Mild	ADRB2	48	45
C#CCOCCNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819230631	CC	On-Demand	Mild	ADRB1	81	49
C#CCOCCNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819230631	CC	On-Demand	Mild	ADRB3	46	49
C#CCOCCNC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819230631	CC	On-Demand	Mild	ABCB1	15	59
C#CCOCCNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819230640	DD	On-Demand	Mild	CYNT	41	47
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230643	GH	On-Demand	Anodyne	RBP4	64	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230643	GH	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230643	GH	On-Demand	Anodyne	GPR119	38	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230643	GH	On-Demand	Anodyne	SFRP1	121	47
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230643	GH	On-Demand	Anodyne	WNT3	82	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230644	GH	On-Demand	Anodyne	RBP4	64	35
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230644	GH	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230644	GH	On-Demand	Anodyne	GPR119	38	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230644	GH	On-Demand	Anodyne	SFRP1	121	47
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230644	GH	On-Demand	Anodyne	WNT3	82	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230645	GH	On-Demand	Anodyne	RBP4	64	35
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230645	GH	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230645	GH	On-Demand	Anodyne	GPR119	38	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230645	GH	On-Demand	Anodyne	SFRP1	121	47
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230645	GH	On-Demand	Anodyne	WNT3	82	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230646	GH	On-Demand	Anodyne	RBP4	64	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230646	GH	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230646	GH	On-Demand	Anodyne	GPR119	38	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230646	GH	On-Demand	Anodyne	SFRP1	121	47
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819230646	GH	On-Demand	Anodyne	WNT3	82	38
CSc1ccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819230651	GF	On-Demand	Anodyne	ADRB2	27	40
CSc1ccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819230651	GF	On-Demand	Anodyne	ADRB1	50	42
CSc1ccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819230651	GF	On-Demand	Anodyne	ADRB3	33	42
CSc1ccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819230651	GF	On-Demand	Anodyne	GPR119	49	48
CSc1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819230652	GF	On-Demand	Anodyne	ADRB2	27	40
CSc1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819230652	GF	On-Demand	Anodyne	ADRB1	50	42
CSc1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819230652	GF	On-Demand	Anodyne	ADRB3	33	42
CSc1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819230652	GF	On-Demand	Anodyne	GPR119	49	48
CSc1ccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819230653	GF	On-Demand	Anodyne	ADRB2	27	40
CSc1ccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819230653	GF	On-Demand	Anodyne	ADRB1	50	42
CSc1ccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819230653	GF	On-Demand	Anodyne	ADRB3	33	42
CSc1ccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819230653	GF	On-Demand	Anodyne	GPR119	49	48
CSc1ccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819230654	GF	On-Demand	Anodyne	ADRB2	27	40
CSc1ccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819230654	GF	On-Demand	Anodyne	ADRB1	50	42
CSc1ccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819230654	GF	On-Demand	Anodyne	ADRB3	33	42
CSc1ccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000819230654	GF	On-Demand	Anodyne	GPR119	49	48
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819230669	GE	On-Demand	Anodyne	GPR119	33	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819230670	GE	On-Demand	Anodyne	GPR119	33	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819230671	GE	On-Demand	Anodyne	GPR119	33	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819230672	GE	On-Demand	Anodyne	GPR119	33	40
C=C(Cl)CSc1nc(C)c(CC(=O)NCc2c(C)nn(CC)c2C)s1	ZINC000819230710	GH	On-Demand	Mild	P2RX7	15	43
Cc1cc(CNC[C@@H](O)CCNC(=O)OC(C)(C)C)ccc1Cl	ZINC000819230772	EG	On-Demand	Anodyne	LEF	44	35
Cc1cc(CNC[C@H](O)CCNC(=O)OC(C)(C)C)ccc1Cl	ZINC000819230773	EG	On-Demand	Anodyne	LEF	44	35
C#CCOCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819230791	CD	On-Demand	Mild	ADRB2	44	46
C#CCOCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819230791	CD	On-Demand	Mild	ADRB1	73	47
C#CCOCCNC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819230791	CD	On-Demand	Mild	ADRB3	41	47
C#CCOCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819230793	CD	On-Demand	Mild	ADRB2	44	46
C#CCOCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819230793	CD	On-Demand	Mild	ADRB1	73	47
C#CCOCCNC[C@H](O)COc1ccc(Cl)cc1	ZINC000819230793	CD	On-Demand	Mild	ADRB3	41	47
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819230794	FE	On-Demand	Bother	GPR119	42	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819230797	FE	On-Demand	Bother	GPR119	42	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819230799	FE	On-Demand	Bother	GPR119	42	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819230800	FE	On-Demand	Bother	GPR119	42	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819230801	GD	On-Demand	Anodyne	ADRB3	15	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819230801	GD	On-Demand	Anodyne	GPR119	79	54
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819230801	GD	On-Demand	Anodyne	SFRP1	32	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819230802	GD	On-Demand	Anodyne	ADRB3	15	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819230802	GD	On-Demand	Anodyne	GPR119	79	54
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819230802	GD	On-Demand	Anodyne	SFRP1	32	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819230803	GD	On-Demand	Anodyne	ADRB3	15	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819230803	GD	On-Demand	Anodyne	GPR119	79	54
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819230803	GD	On-Demand	Anodyne	SFRP1	32	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819230804	GD	On-Demand	Anodyne	ADRB3	15	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819230804	GD	On-Demand	Anodyne	GPR119	79	54
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819230804	GD	On-Demand	Anodyne	SFRP1	32	42
C#CCOCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819230805	DD	On-Demand	Mild	ADRB2	41	42
C#CCOCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819230805	DD	On-Demand	Mild	ADRB1	62	43
C#CCOCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819230805	DD	On-Demand	Mild	GRIN1	29	47
C#CCOCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819230805	DD	On-Demand	Mild	ADRB3	33	43
C#CCOCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819230806	DD	On-Demand	Mild	ADRB2	41	42
C#CCOCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819230806	DD	On-Demand	Mild	ADRB1	62	43
C#CCOCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819230806	DD	On-Demand	Mild	GRIN1	29	47
C#CCOCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819230806	DD	On-Demand	Mild	ADRB3	33	43
C#CCOCCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819230807	CC	On-Demand	Mild	ADRB2	48	46
C#CCOCCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819230807	CC	On-Demand	Mild	ADRB1	76	47
C#CCOCCNC[C@@H](O)COc1ccc(F)cc1	ZINC000819230807	CC	On-Demand	Mild	ADRB3	40	47
C#CCOCCNC[C@H](O)COc1ccc(F)cc1	ZINC000819230808	CC	On-Demand	Mild	ADRB2	48	46
C#CCOCCNC[C@H](O)COc1ccc(F)cc1	ZINC000819230808	CC	On-Demand	Mild	ADRB1	76	47
C#CCOCCNC[C@H](O)COc1ccc(F)cc1	ZINC000819230808	CC	On-Demand	Mild	ADRB3	40	47
COc1ccc(OC)c([C@H](O)CNCC[C@@H](C)N2CCCCC2)c1	ZINC000819230815	EF	On-Demand	Anodyne	ADRB2	15	44
COc1ccc(OC)c([C@H](O)CNCC[C@H](C)N2CCCCC2)c1	ZINC000819230816	EF	On-Demand	Anodyne	ADRB2	15	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819230825	FE	On-Demand	Bother	CACNA1D	40	33
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819230826	FE	On-Demand	Bother	CACNA1D	40	33
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819230827	FE	On-Demand	Bother	CACNA1D	40	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819230828	FE	On-Demand	Bother	CACNA1D	40	33
C#CCOCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819230829	DD	On-Demand	Mild	ADRB3	15	41
C#CCOCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819230830	DD	On-Demand	Mild	ADRB3	15	41
C#CCOCCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000819230837	ED	On-Demand	Mild	ADRB2	42	46
C#CCOCCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000819230837	ED	On-Demand	Mild	ADRB1	66	47
C#CCOCCNC[C@@H](O)COc1ccc(Br)cc1	ZINC000819230837	ED	On-Demand	Mild	ADRB3	36	47
C#CCOCCNC[C@H](O)COc1ccc(Br)cc1	ZINC000819230838	ED	On-Demand	Mild	ADRB2	42	46
C#CCOCCNC[C@H](O)COc1ccc(Br)cc1	ZINC000819230838	ED	On-Demand	Mild	ADRB1	66	47
C#CCOCCNC[C@H](O)COc1ccc(Br)cc1	ZINC000819230838	ED	On-Demand	Mild	ADRB3	36	47
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819230839	GG	On-Demand	Anodyne	GPR119	41	39
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819230840	GG	On-Demand	Anodyne	GPR119	41	39
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819230841	GG	On-Demand	Anodyne	GPR119	41	39
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819230842	GG	On-Demand	Anodyne	GPR119	41	39
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COCc2ccccc2Cl)C1	ZINC000819230864	GG	On-Demand	Anodyne	GPR119	31	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COCc2ccccc2Cl)C1	ZINC000819230865	GG	On-Demand	Anodyne	GPR119	31	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COCc2ccccc2Cl)C1	ZINC000819230866	GG	On-Demand	Anodyne	GPR119	31	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COCc2ccccc2Cl)C1	ZINC000819230867	GG	On-Demand	Anodyne	GPR119	31	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819230876	GH	On-Demand	Anodyne	CACNA1I	47	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819230876	GH	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819230876	GH	On-Demand	Anodyne	SFRP1	25	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819230877	GH	On-Demand	Anodyne	CACNA1I	47	37
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819230877	GH	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819230877	GH	On-Demand	Anodyne	SFRP1	25	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819230878	GH	On-Demand	Anodyne	CACNA1I	47	37
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819230878	GH	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819230878	GH	On-Demand	Anodyne	SFRP1	25	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819230879	GH	On-Demand	Anodyne	CACNA1I	47	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819230879	GH	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819230879	GH	On-Demand	Anodyne	SFRP1	25	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230880	GH	On-Demand	Anodyne	CACNA1B	48	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230880	GH	On-Demand	Anodyne	CCR2	97	39
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230880	GH	On-Demand	Anodyne	CACNA1I	43	39
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230880	GH	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230880	GH	On-Demand	Anodyne	SFRP1	43	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230881	GH	On-Demand	Anodyne	CACNA1B	48	35
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230881	GH	On-Demand	Anodyne	CCR2	97	39
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230881	GH	On-Demand	Anodyne	CACNA1I	43	39
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230881	GH	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230881	GH	On-Demand	Anodyne	SFRP1	43	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230882	GH	On-Demand	Anodyne	CACNA1B	48	35
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230882	GH	On-Demand	Anodyne	CCR2	97	39
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230882	GH	On-Demand	Anodyne	CACNA1I	43	39
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230882	GH	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230882	GH	On-Demand	Anodyne	SFRP1	43	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230883	GH	On-Demand	Anodyne	CACNA1B	48	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230883	GH	On-Demand	Anodyne	CCR2	97	39
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230883	GH	On-Demand	Anodyne	CACNA1I	43	39
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230883	GH	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819230883	GH	On-Demand	Anodyne	SFRP1	43	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819230894	GH	On-Demand	Anodyne	CACNA1I	73	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819230894	GH	On-Demand	Anodyne	GPR119	38	42
Cc1nnc([C@@H](C)NC[C@H](O)c2cccnc2)s1	ZINC000819230924	CD	On-Demand	Anodyne	ADRB2	23	42
Cc1nnc([C@@H](C)NC[C@H](O)c2cccnc2)s1	ZINC000819230924	CD	On-Demand	Anodyne	ADRB1	25	46
Cc1nnc([C@@H](C)NC[C@H](O)c2cccnc2)s1	ZINC000819230924	CD	On-Demand	Anodyne	ADRB3	85	46
Cc1nnc([C@@H](C)NC[C@@H](O)c2cccnc2)s1	ZINC000819230926	CD	On-Demand	Anodyne	ADRB2	23	42
Cc1nnc([C@@H](C)NC[C@@H](O)c2cccnc2)s1	ZINC000819230926	CD	On-Demand	Anodyne	ADRB1	25	46
Cc1nnc([C@@H](C)NC[C@@H](O)c2cccnc2)s1	ZINC000819230926	CD	On-Demand	Anodyne	ADRB3	85	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819230943	GH	On-Demand	Anodyne	CACNA1I	73	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819230943	GH	On-Demand	Anodyne	GPR119	38	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819230944	GH	On-Demand	Anodyne	CACNA1I	73	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819230944	GH	On-Demand	Anodyne	GPR119	38	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819230945	GH	On-Demand	Anodyne	CACNA1I	73	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819230945	GH	On-Demand	Anodyne	GPR119	38	42
C#CCOCCNC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819230957	CD	On-Demand	Mild	ADRB2	22	46
C#CCOCCNC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819230957	CD	On-Demand	Mild	ADRB1	50	36
C#CCOCCNC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819230958	CD	On-Demand	Mild	ADRB2	22	46
C#CCOCCNC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819230958	CD	On-Demand	Mild	ADRB1	50	36
C[C@H](CCNC[C@H](O)c1ccc(Cl)cc1)N1CCCCC1	ZINC000819230973	DG	On-Demand	Anodyne	ADRB1	15	40
C[C@H](CCNC[C@H](O)c1ccc(Cl)cc1)N1CCCCC1	ZINC000819230973	DG	On-Demand	Anodyne	ADRB3	25	40
C[C@H](CCNC[C@H](O)c1ccc(Cl)cc1)N1CCCCC1	ZINC000819230973	DG	On-Demand	Anodyne	DPP7	41	39
C[C@@H](CCNC[C@H](O)c1ccc(Cl)cc1)N1CCCCC1	ZINC000819230974	DG	On-Demand	Anodyne	ADRB1	15	40
C[C@@H](CCNC[C@H](O)c1ccc(Cl)cc1)N1CCCCC1	ZINC000819230974	DG	On-Demand	Anodyne	ADRB3	25	40
C[C@@H](CCNC[C@H](O)c1ccc(Cl)cc1)N1CCCCC1	ZINC000819230974	DG	On-Demand	Anodyne	DPP7	41	39
C#CCOCCNC[C@@H](O)COc1ccc(Cl)cc1Br	ZINC000819230984	FE	On-Demand	Mild	ADRB1	40	32
C#CCOCCNC[C@H](O)COc1ccc(Cl)cc1Br	ZINC000819230985	FE	On-Demand	Mild	ADRB1	40	32
C#CCOCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819230986	CD	On-Demand	Mild	ADRB2	49	44
C#CCOCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819230986	CD	On-Demand	Mild	ADRB1	59	47
C#CCOCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819230986	CD	On-Demand	Mild	ADRB3	66	47
C#CCOCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819230987	CD	On-Demand	Mild	ADRB2	49	44
C#CCOCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819230987	CD	On-Demand	Mild	ADRB1	59	47
C#CCOCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819230987	CD	On-Demand	Mild	ADRB3	66	47
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COCc2ccccc2)C1	ZINC000819230994	FE	On-Demand	Anodyne	GRIN2B	43	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COCc2ccccc2)C1	ZINC000819230994	FE	On-Demand	Anodyne	GHSR	37	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COCc2ccccc2)C1	ZINC000819230994	FE	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COCc2ccccc2)C1	ZINC000819230994	FE	On-Demand	Anodyne	SFRP1	19	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COCc2ccccc2)C1	ZINC000819230995	FE	On-Demand	Anodyne	GRIN2B	43	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COCc2ccccc2)C1	ZINC000819230995	FE	On-Demand	Anodyne	GHSR	37	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COCc2ccccc2)C1	ZINC000819230995	FE	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COCc2ccccc2)C1	ZINC000819230995	FE	On-Demand	Anodyne	SFRP1	19	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COCc2ccccc2)C1	ZINC000819230996	FE	On-Demand	Anodyne	GRIN2B	43	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COCc2ccccc2)C1	ZINC000819230996	FE	On-Demand	Anodyne	GHSR	37	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COCc2ccccc2)C1	ZINC000819230996	FE	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COCc2ccccc2)C1	ZINC000819230996	FE	On-Demand	Anodyne	SFRP1	19	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COCc2ccccc2)C1	ZINC000819230997	FE	On-Demand	Anodyne	GRIN2B	43	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COCc2ccccc2)C1	ZINC000819230997	FE	On-Demand	Anodyne	GHSR	37	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COCc2ccccc2)C1	ZINC000819230997	FE	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COCc2ccccc2)C1	ZINC000819230997	FE	On-Demand	Anodyne	SFRP1	19	40
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819231015	GH	On-Demand	Anodyne	EPHX2	16	47
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819231015	GH	On-Demand	Anodyne	MCHR1	19	43
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819231015	GH	On-Demand	Anodyne	CACNA1I	68	41
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819231015	GH	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819231016	GH	On-Demand	Anodyne	EPHX2	16	47
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819231016	GH	On-Demand	Anodyne	MCHR1	19	43
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819231016	GH	On-Demand	Anodyne	CACNA1I	68	41
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819231016	GH	On-Demand	Anodyne	GPR119	34	41
Cc1c(F)cccc1NC(=O)CCNC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819231022	GG	On-Demand	Anodyne	GPR119	46	45
Cc1c(F)cccc1NC(=O)CCNC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819231023	GG	On-Demand	Anodyne	GPR119	46	45
C=C(Cl)CSc1nc(C)c(CC(=O)N2CC[C@H](N3CCCC3)C2)s1	ZINC000819231028	GH	On-Demand	Mild	L3MBTL3	40	35
C=C(Cl)CSc1nc(C)c(CC(=O)N2CC[C@@H](N3CCCC3)C2)s1	ZINC000819231029	GH	On-Demand	Mild	L3MBTL3	40	35
C#CCOCCNC[C@H](O)COc1ccc(C)cc1	ZINC000819231030	CC	On-Demand	Mild	ADRB2	53	56
C#CCOCCNC[C@H](O)COc1ccc(C)cc1	ZINC000819231030	CC	On-Demand	Mild	ADRB1	74	47
C#CCOCCNC[C@H](O)COc1ccc(C)cc1	ZINC000819231030	CC	On-Demand	Mild	ADRB3	44	47
C#CCOCCNC[C@@H](O)COc1ccc(C)cc1	ZINC000819231031	CC	On-Demand	Mild	ADRB2	53	56
C#CCOCCNC[C@@H](O)COc1ccc(C)cc1	ZINC000819231031	CC	On-Demand	Mild	ADRB1	74	47
C#CCOCCNC[C@@H](O)COc1ccc(C)cc1	ZINC000819231031	CC	On-Demand	Mild	ADRB3	44	47
CC(C)(C)OC(=O)N1CC[C@@H](CNCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819231032	GE	On-Demand	Mild	GPR119	53	45
CC(C)(C)OC(=O)N1CC[C@@H](CNCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819231032	GE	On-Demand	Mild	SFRP1	21	41
CC(C)(C)OC(=O)N1CC[C@H](CNCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819231033	GE	On-Demand	Mild	GPR119	53	45
CC(C)(C)OC(=O)N1CC[C@H](CNCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000819231033	GE	On-Demand	Mild	SFRP1	21	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)CN2CCc3ccccc3C2)C1	ZINC000819231040	GE	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)CN2CCc3ccccc3C2)C1	ZINC000819231041	GE	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)CN2CCc3ccccc3C2)C1	ZINC000819231042	GE	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)CN2CCc3ccccc3C2)C1	ZINC000819231135	GE	On-Demand	Anodyne	GPR119	34	41
O[C@@H](CN[C@H]1COc2cc(F)cc(F)c21)c1cccc(Cl)c1	ZINC000819231136	EG	On-Demand	Anodyne	ADRB3	36	41
O[C@@H](CN[C@@H]1COc2cc(F)cc(F)c21)c1cccc(Cl)c1	ZINC000819231137	EG	On-Demand	Anodyne	ADRB3	36	41
O[C@H](CN[C@H]1COc2cc(F)cc(F)c21)c1cccc(Cl)c1	ZINC000819231138	EG	On-Demand	Anodyne	ADRB3	36	41
O[C@H](CN[C@@H]1COc2cc(F)cc(F)c21)c1cccc(Cl)c1	ZINC000819231139	EG	On-Demand	Anodyne	ADRB3	36	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819231151	FF	On-Demand	Anodyne	CACNA1I	71	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819231151	FF	On-Demand	Anodyne	GPR119	45	52
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819231152	FF	On-Demand	Anodyne	CACNA1I	71	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819231152	FF	On-Demand	Anodyne	GPR119	45	52
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819231153	FF	On-Demand	Anodyne	CACNA1I	71	36
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819231153	FF	On-Demand	Anodyne	GPR119	45	52
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819231154	FF	On-Demand	Anodyne	CACNA1I	71	36
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819231154	FF	On-Demand	Anodyne	GPR119	45	52
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819231155	GE	On-Demand	Mild	ADRB1	51	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819231155	GE	On-Demand	Mild	ADRB3	29	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819231155	GE	On-Demand	Mild	GPR119	47	49
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819231156	GE	On-Demand	Mild	ADRB1	51	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819231156	GE	On-Demand	Mild	ADRB3	29	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819231156	GE	On-Demand	Mild	GPR119	47	49
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819231157	GE	On-Demand	Mild	ADRB1	51	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819231157	GE	On-Demand	Mild	ADRB3	29	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819231157	GE	On-Demand	Mild	GPR119	47	49
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819231158	GE	On-Demand	Mild	ADRB1	51	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819231158	GE	On-Demand	Mild	ADRB3	29	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819231158	GE	On-Demand	Mild	GPR119	47	49
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819231169	FG	On-Demand	Anodyne	CACNA1I	61	34
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819231169	FG	On-Demand	Anodyne	GPR119	43	47
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819231172	FG	On-Demand	Anodyne	CACNA1I	61	34
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819231172	FG	On-Demand	Anodyne	GPR119	43	47
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231175	GF	On-Demand	Anodyne	ADRB2	29	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231175	GF	On-Demand	Anodyne	ADRB1	56	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231175	GF	On-Demand	Anodyne	ADRB3	37	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231175	GF	On-Demand	Anodyne	CACNA1I	59	36
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231175	GF	On-Demand	Anodyne	GPR119	49	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231176	GF	On-Demand	Anodyne	ADRB2	29	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231176	GF	On-Demand	Anodyne	ADRB1	56	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231176	GF	On-Demand	Anodyne	ADRB3	37	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231176	GF	On-Demand	Anodyne	CACNA1I	59	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231176	GF	On-Demand	Anodyne	GPR119	49	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231177	GF	On-Demand	Anodyne	ADRB2	29	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231177	GF	On-Demand	Anodyne	ADRB1	56	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231177	GF	On-Demand	Anodyne	ADRB3	37	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231177	GF	On-Demand	Anodyne	CACNA1I	59	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231177	GF	On-Demand	Anodyne	GPR119	49	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231178	GF	On-Demand	Anodyne	ADRB2	29	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231178	GF	On-Demand	Anodyne	ADRB1	56	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231178	GF	On-Demand	Anodyne	ADRB3	37	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231178	GF	On-Demand	Anodyne	CACNA1I	59	36
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819231178	GF	On-Demand	Anodyne	GPR119	49	42
C#CCOCCNCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819231188	EG	On-Demand	Mild	LTA4H	54	49
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819231192	FG	On-Demand	Anodyne	ADRB1	53	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819231192	FG	On-Demand	Anodyne	ADRB3	66	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819231192	FG	On-Demand	Anodyne	CYP3A4	53	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819231192	FG	On-Demand	Anodyne	CACNA1I	73	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819231192	FG	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819231193	FG	On-Demand	Anodyne	ADRB1	53	44
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819231193	FG	On-Demand	Anodyne	ADRB3	66	44
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819231193	FG	On-Demand	Anodyne	CYP3A4	53	36
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819231193	FG	On-Demand	Anodyne	CACNA1I	73	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819231193	FG	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819231194	FG	On-Demand	Anodyne	ADRB1	53	44
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819231194	FG	On-Demand	Anodyne	ADRB3	66	44
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819231194	FG	On-Demand	Anodyne	CYP3A4	53	36
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819231194	FG	On-Demand	Anodyne	CACNA1I	73	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819231194	FG	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819231195	FG	On-Demand	Anodyne	ADRB1	53	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819231195	FG	On-Demand	Anodyne	ADRB3	66	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819231195	FG	On-Demand	Anodyne	CYP3A4	53	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819231195	FG	On-Demand	Anodyne	CACNA1I	73	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819231195	FG	On-Demand	Anodyne	GPR119	36	42
C#CCOCCNC[C@H](O)COc1cc(C)ccc1C	ZINC000819231199	CD	On-Demand	Mild	ADRB2	26	49
C#CCOCCNC[C@H](O)COc1cc(C)ccc1C	ZINC000819231199	CD	On-Demand	Mild	ADRB1	57	38
C#CCOCCNC[C@@H](O)COc1cc(C)ccc1C	ZINC000819231200	CD	On-Demand	Mild	ADRB2	26	49
C#CCOCCNC[C@@H](O)COc1cc(C)ccc1C	ZINC000819231200	CD	On-Demand	Mild	ADRB1	57	38
C#CCOCCNC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819231201	DD	On-Demand	Mild	ADRB2	29	41
C#CCOCCNC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819231201	DD	On-Demand	Mild	ADRB1	45	32
C#CCOCCNC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819231202	DD	On-Demand	Mild	ADRB2	29	41
C#CCOCCNC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819231202	DD	On-Demand	Mild	ADRB1	45	32
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)CN2CCCC2=O)C1	ZINC000819231203	EC	On-Demand	Anodyne	GPR119	27	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)CN2CCCC2=O)C1	ZINC000819231204	EC	On-Demand	Anodyne	GPR119	27	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)CN2CCCC2=O)C1	ZINC000819231205	EC	On-Demand	Anodyne	GPR119	27	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)CN2CCCC2=O)C1	ZINC000819231206	EC	On-Demand	Anodyne	GPR119	27	40
C#CCOCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819231223	CD	On-Demand	Mild	ADRB2	40	59
C#CCOCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819231223	CD	On-Demand	Mild	ADRB1	68	39
C#CCOCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819231223	CD	On-Demand	Mild	ADRB3	23	57
C#CCOCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819231223	CD	On-Demand	Mild	CYP2D6	16	44
C#CCOCCNC[C@H](O)COc1cccc2ccccc12	ZINC000819231223	CD	On-Demand	Mild	ABCB1	15	43
C#CCOCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819231224	CD	On-Demand	Mild	ADRB2	40	59
C#CCOCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819231224	CD	On-Demand	Mild	ADRB1	68	39
C#CCOCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819231224	CD	On-Demand	Mild	ADRB3	23	57
C#CCOCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819231224	CD	On-Demand	Mild	CYP2D6	16	44
C#CCOCCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819231224	CD	On-Demand	Mild	ABCB1	15	43
C#CCOCCNC[C@@H](O)c1ccccc1	ZINC000819231225	BC	On-Demand	Mild	ADRB1	36	40
C#CCOCCNC[C@@H](O)c1ccccc1	ZINC000819231225	BC	On-Demand	Mild	ADRB3	41	44
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819231227	FE	On-Demand	Anodyne	ADRB2	55	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819231227	FE	On-Demand	Anodyne	ADRB1	82	48
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819231227	FE	On-Demand	Anodyne	GRIN2B	32	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819231227	FE	On-Demand	Anodyne	ADRB3	59	48
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819231227	FE	On-Demand	Anodyne	ABCB1	43	44
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819231227	FE	On-Demand	Anodyne	CCR8	17	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819231227	FE	On-Demand	Anodyne	GPR119	50	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819231227	FE	On-Demand	Anodyne	SFRP1	21	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819231228	FE	On-Demand	Anodyne	ADRB2	55	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819231228	FE	On-Demand	Anodyne	ADRB1	82	48
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819231228	FE	On-Demand	Anodyne	GRIN2B	32	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819231228	FE	On-Demand	Anodyne	ADRB3	59	48
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819231228	FE	On-Demand	Anodyne	ABCB1	43	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819231228	FE	On-Demand	Anodyne	CCR8	17	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819231228	FE	On-Demand	Anodyne	GPR119	50	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819231228	FE	On-Demand	Anodyne	SFRP1	21	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819231229	FE	On-Demand	Anodyne	ADRB2	55	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819231229	FE	On-Demand	Anodyne	ADRB1	82	48
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819231229	FE	On-Demand	Anodyne	GRIN2B	32	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819231229	FE	On-Demand	Anodyne	ADRB3	59	48
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819231229	FE	On-Demand	Anodyne	ABCB1	43	44
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819231229	FE	On-Demand	Anodyne	CCR8	17	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819231229	FE	On-Demand	Anodyne	GPR119	50	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819231229	FE	On-Demand	Anodyne	SFRP1	21	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819231230	FE	On-Demand	Anodyne	ADRB2	55	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819231230	FE	On-Demand	Anodyne	ADRB1	82	48
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819231230	FE	On-Demand	Anodyne	GRIN2B	32	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819231230	FE	On-Demand	Anodyne	ADRB3	59	48
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819231230	FE	On-Demand	Anodyne	ABCB1	43	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819231230	FE	On-Demand	Anodyne	CCR8	17	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819231230	FE	On-Demand	Anodyne	GPR119	50	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819231230	FE	On-Demand	Anodyne	SFRP1	21	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)C2CC2)C1	ZINC000819231231	CD	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)C2CC2)C1	ZINC000819231232	CD	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)C2CC2)C1	ZINC000819231233	CD	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)C2CC2)C1	ZINC000819231234	CD	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819231243	FE	On-Demand	Anodyne	ADRB2	38	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819231243	FE	On-Demand	Anodyne	ADRB1	61	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819231243	FE	On-Demand	Anodyne	ADRB3	39	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819231243	FE	On-Demand	Anodyne	GPR119	52	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819231244	FE	On-Demand	Anodyne	ADRB2	38	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819231244	FE	On-Demand	Anodyne	ADRB1	61	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819231244	FE	On-Demand	Anodyne	ADRB3	39	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819231244	FE	On-Demand	Anodyne	GPR119	52	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819231245	FE	On-Demand	Anodyne	ADRB2	38	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819231245	FE	On-Demand	Anodyne	ADRB1	61	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819231245	FE	On-Demand	Anodyne	ADRB3	39	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819231245	FE	On-Demand	Anodyne	GPR119	52	44
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819231246	FE	On-Demand	Anodyne	ADRB2	38	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819231246	FE	On-Demand	Anodyne	ADRB1	61	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819231246	FE	On-Demand	Anodyne	ADRB3	39	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819231246	FE	On-Demand	Anodyne	GPR119	52	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819231257	FG	On-Demand	Anodyne	SLC6A3	18	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819231257	FG	On-Demand	Anodyne	CACNA1I	65	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819231257	FG	On-Demand	Anodyne	GPR119	45	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819231258	FG	On-Demand	Anodyne	SLC6A3	18	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819231258	FG	On-Demand	Anodyne	CACNA1I	65	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819231258	FG	On-Demand	Anodyne	GPR119	45	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819231259	GE	On-Demand	Bother	ADRB3	17	44
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819231259	GE	On-Demand	Bother	ABCB1	30	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819231259	GE	On-Demand	Bother	GPR119	41	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819231260	GE	On-Demand	Bother	ADRB3	17	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819231260	GE	On-Demand	Bother	ABCB1	30	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819231260	GE	On-Demand	Bother	GPR119	41	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819231261	GE	On-Demand	Bother	ADRB3	17	44
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819231261	GE	On-Demand	Bother	ABCB1	30	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819231261	GE	On-Demand	Bother	GPR119	41	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819231262	GE	On-Demand	Bother	ADRB3	17	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819231262	GE	On-Demand	Bother	ABCB1	30	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819231262	GE	On-Demand	Bother	GPR119	41	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819231280	EF	On-Demand	Anodyne	SLC6A3	26	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819231280	EF	On-Demand	Anodyne	CACNA1I	42	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819231280	EF	On-Demand	Anodyne	GPR119	48	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819231281	EF	On-Demand	Anodyne	SLC6A3	26	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819231281	EF	On-Demand	Anodyne	CACNA1I	42	37
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819231281	EF	On-Demand	Anodyne	GPR119	48	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819231282	EF	On-Demand	Anodyne	SLC6A3	26	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819231282	EF	On-Demand	Anodyne	CACNA1I	42	37
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819231282	EF	On-Demand	Anodyne	GPR119	48	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819231283	EF	On-Demand	Anodyne	SLC6A3	26	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819231283	EF	On-Demand	Anodyne	CACNA1I	42	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819231283	EF	On-Demand	Anodyne	GPR119	48	46
C#CCOCCNC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000819231290	DD	On-Demand	Mild	ADRB2	17	43
C#CCOCCNC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000819231290	DD	On-Demand	Mild	ADRB1	40	31
C#CCOCCNC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000819231291	DD	On-Demand	Mild	ADRB2	17	43
C#CCOCCNC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000819231291	DD	On-Demand	Mild	ADRB1	40	31
C#CCOCCNC[C@H](O)COc1cccc(C)c1	ZINC000819231293	CC	On-Demand	Mild	ADRB2	50	59
C#CCOCCNC[C@H](O)COc1cccc(C)c1	ZINC000819231293	CC	On-Demand	Mild	ADRB1	67	59
C#CCOCCNC[C@H](O)COc1cccc(C)c1	ZINC000819231293	CC	On-Demand	Mild	ADRB3	36	44
C#CCOCCNC[C@@H](O)COc1cccc(C)c1	ZINC000819231294	CC	On-Demand	Mild	ADRB2	50	59
C#CCOCCNC[C@@H](O)COc1cccc(C)c1	ZINC000819231294	CC	On-Demand	Mild	ADRB1	67	59
C#CCOCCNC[C@@H](O)COc1cccc(C)c1	ZINC000819231294	CC	On-Demand	Mild	ADRB3	36	44
C#CCOCCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819231302	CC	On-Demand	Mild	ADRB2	46	47
C#CCOCCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819231302	CC	On-Demand	Mild	ADRB1	75	46
C#CCOCCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819231302	CC	On-Demand	Mild	ADRB3	41	46
C#CCOCCNC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819231302	CC	On-Demand	Mild	ABCB1	21	48
C#CCOCCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819231303	CC	On-Demand	Mild	ADRB2	46	47
C#CCOCCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819231303	CC	On-Demand	Mild	ADRB1	75	46
C#CCOCCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819231303	CC	On-Demand	Mild	ADRB3	41	46
C#CCOCCNC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819231303	CC	On-Demand	Mild	ABCB1	21	48
C#CCOCCNC[C@@H](O)COc1ccccc1Cl	ZINC000819231304	CD	On-Demand	Mild	ADRB2	37	56
C#CCOCCNC[C@@H](O)COc1ccccc1Cl	ZINC000819231304	CD	On-Demand	Mild	ADRB1	68	40
C#CCOCCNC[C@@H](O)COc1ccccc1Cl	ZINC000819231304	CD	On-Demand	Mild	ADRB3	21	41
C#CCOCCNC[C@H](O)COc1ccccc1Cl	ZINC000819231305	CD	On-Demand	Mild	ADRB2	37	56
C#CCOCCNC[C@H](O)COc1ccccc1Cl	ZINC000819231305	CD	On-Demand	Mild	ADRB1	68	40
C#CCOCCNC[C@H](O)COc1ccccc1Cl	ZINC000819231305	CD	On-Demand	Mild	ADRB3	21	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819231308	GE	On-Demand	Bother	ADRB1	27	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819231308	GE	On-Demand	Bother	ADRB3	21	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819231309	GE	On-Demand	Bother	ADRB1	27	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819231309	GE	On-Demand	Bother	ADRB3	21	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819231310	GE	On-Demand	Bother	ADRB1	27	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819231310	GE	On-Demand	Bother	ADRB3	21	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819231311	GE	On-Demand	Bother	ADRB1	27	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819231311	GE	On-Demand	Bother	ADRB3	21	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(Br)c2)C1	ZINC000819231332	GG	On-Demand	Anodyne	GPR119	37	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc(Br)c2)C1	ZINC000819231333	GG	On-Demand	Anodyne	GPR119	37	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819231334	GG	On-Demand	Anodyne	GPR119	37	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819231335	GG	On-Demand	Anodyne	GPR119	37	42
C[C@@H](CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)N1CCCCC1	ZINC000819231336	GF	On-Demand	Anodyne	GPR119	23	42
C[C@H](CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)N1CCCCC1	ZINC000819231337	GF	On-Demand	Anodyne	GPR119	23	42
C[C@H](CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)N1CCCCC1	ZINC000819231338	GF	On-Demand	Anodyne	GPR119	23	42
C[C@@H](CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)N1CCCCC1	ZINC000819231339	GF	On-Demand	Anodyne	GPR119	23	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231342	GF	On-Demand	Anodyne	ADRB2	25	53
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231342	GF	On-Demand	Anodyne	ADRB1	31	53
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231342	GF	On-Demand	Anodyne	HTR1A	15	53
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231342	GF	On-Demand	Anodyne	SSTR2	53	36
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231342	GF	On-Demand	Anodyne	SLC6A4	19	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231342	GF	On-Demand	Anodyne	ADRB3	24	53
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231342	GF	On-Demand	Anodyne	ABCB1	15	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231343	GF	On-Demand	Anodyne	ADRB2	25	53
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231343	GF	On-Demand	Anodyne	ADRB1	31	53
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231343	GF	On-Demand	Anodyne	HTR1A	15	53
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231343	GF	On-Demand	Anodyne	SSTR2	53	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231343	GF	On-Demand	Anodyne	SLC6A4	19	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231343	GF	On-Demand	Anodyne	ADRB3	24	53
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231343	GF	On-Demand	Anodyne	ABCB1	15	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231344	GF	On-Demand	Anodyne	ADRB2	25	53
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231344	GF	On-Demand	Anodyne	ADRB1	31	53
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231344	GF	On-Demand	Anodyne	HTR1A	15	53
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231344	GF	On-Demand	Anodyne	SSTR2	53	36
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231344	GF	On-Demand	Anodyne	SLC6A4	19	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231344	GF	On-Demand	Anodyne	ADRB3	24	53
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231344	GF	On-Demand	Anodyne	ABCB1	15	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231345	GF	On-Demand	Anodyne	ADRB2	25	53
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231345	GF	On-Demand	Anodyne	ADRB1	31	53
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231345	GF	On-Demand	Anodyne	HTR1A	15	53
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231345	GF	On-Demand	Anodyne	SSTR2	53	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231345	GF	On-Demand	Anodyne	SLC6A4	19	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231345	GF	On-Demand	Anodyne	ADRB3	24	53
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819231345	GF	On-Demand	Anodyne	ABCB1	15	40
C#CCOCCNC[C@@H](O)CCc1ccccc1	ZINC000819231350	BD	On-Demand	Mild	ADRB2	22	40
C#CCOCCNC[C@H](O)CCc1ccccc1	ZINC000819231351	BD	On-Demand	Mild	ADRB2	22	40
C#CCOCCNC[C@H](O)COc1cc(C)cc(C)c1	ZINC000819231358	CD	On-Demand	Mild	ADRB2	33	56
C#CCOCCNC[C@H](O)COc1cc(C)cc(C)c1	ZINC000819231358	CD	On-Demand	Mild	ADRB1	42	42
C#CCOCCNC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000819231359	CD	On-Demand	Mild	ADRB2	33	56
C#CCOCCNC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000819231359	CD	On-Demand	Mild	ADRB1	42	42
C#CCOCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819231360	EE	On-Demand	Mild	ADRB2	61	47
C#CCOCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819231360	EE	On-Demand	Mild	ADRB1	95	54
C#CCOCCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819231360	EE	On-Demand	Mild	ADRB3	61	54
C#CCOCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819231361	EE	On-Demand	Mild	ADRB2	61	47
C#CCOCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819231361	EE	On-Demand	Mild	ADRB1	95	54
C#CCOCCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819231361	EE	On-Demand	Mild	ADRB3	61	54
C#CCOCCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819231362	DC	On-Demand	Mild	ADRB2	53	60
C#CCOCCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819231362	DC	On-Demand	Mild	ADRB1	94	60
C#CCOCCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819231362	DC	On-Demand	Mild	GRIN1	24	43
C#CCOCCNC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819231362	DC	On-Demand	Mild	ADRB3	56	60
C#CCOCCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819231363	DC	On-Demand	Mild	ADRB2	53	60
C#CCOCCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819231363	DC	On-Demand	Mild	ADRB1	94	60
C#CCOCCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819231363	DC	On-Demand	Mild	GRIN1	24	43
C#CCOCCNC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819231363	DC	On-Demand	Mild	ADRB3	56	60
C#CCOCCNC[C@H](O)COc1ccc(C)cc1C	ZINC000819231364	CD	On-Demand	Mild	ADRB2	24	48
C#CCOCCNC[C@H](O)COc1ccc(C)cc1C	ZINC000819231364	CD	On-Demand	Mild	ADRB1	51	37
C#CCOCCNC[C@@H](O)COc1ccc(C)cc1C	ZINC000819231365	CD	On-Demand	Mild	ADRB2	24	48
C#CCOCCNC[C@@H](O)COc1ccc(C)cc1C	ZINC000819231365	CD	On-Demand	Mild	ADRB1	51	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819231367	FF	On-Demand	Anodyne	GRIN2B	23	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819231367	FF	On-Demand	Anodyne	CCR3	35	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819231367	FF	On-Demand	Anodyne	CACNA1I	46	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819231367	FF	On-Demand	Anodyne	GPR119	51	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819231368	FF	On-Demand	Anodyne	GRIN2B	23	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819231368	FF	On-Demand	Anodyne	CCR3	35	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819231368	FF	On-Demand	Anodyne	CACNA1I	46	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819231368	FF	On-Demand	Anodyne	GPR119	51	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819231369	FF	On-Demand	Anodyne	GRIN2B	23	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819231369	FF	On-Demand	Anodyne	CCR3	35	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819231369	FF	On-Demand	Anodyne	CACNA1I	46	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819231369	FF	On-Demand	Anodyne	GPR119	51	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819231370	FF	On-Demand	Anodyne	GRIN2B	23	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819231370	FF	On-Demand	Anodyne	CCR3	35	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819231370	FF	On-Demand	Anodyne	CACNA1I	46	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819231370	FF	On-Demand	Anodyne	GPR119	51	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819231371	FG	On-Demand	Anodyne	CACNA1I	53	33
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819231371	FG	On-Demand	Anodyne	GPR119	37	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819231371	FG	On-Demand	Anodyne	SFRP1	23	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819231372	FG	On-Demand	Anodyne	CACNA1I	53	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819231372	FG	On-Demand	Anodyne	GPR119	37	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819231372	FG	On-Demand	Anodyne	SFRP1	23	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819231385	GE	On-Demand	Anodyne	BMP1	15	44
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819231385	GE	On-Demand	Anodyne	NOS2	47	33
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819231385	GE	On-Demand	Anodyne	GPR119	38	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819231386	GE	On-Demand	Anodyne	BMP1	15	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819231386	GE	On-Demand	Anodyne	NOS2	47	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819231386	GE	On-Demand	Anodyne	GPR119	38	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819231387	GE	On-Demand	Anodyne	BMP1	15	44
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819231387	GE	On-Demand	Anodyne	NOS2	47	33
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819231387	GE	On-Demand	Anodyne	GPR119	38	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819231388	GE	On-Demand	Anodyne	BMP1	15	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819231388	GE	On-Demand	Anodyne	NOS2	47	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819231388	GE	On-Demand	Anodyne	GPR119	38	42
C[C@@H](CCNC[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000819231392	CF	On-Demand	Anodyne	ADRB2	18	43
C[C@@H](CCNC[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000819231392	CF	On-Demand	Anodyne	ADRB1	29	42
C[C@@H](CCNC[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000819231392	CF	On-Demand	Anodyne	ADRB3	54	42
C[C@@H](CCNC[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000819231392	CF	On-Demand	Anodyne	DPP7	42	36
C[C@H](CCNC[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000819231393	CF	On-Demand	Anodyne	ADRB2	18	43
C[C@H](CCNC[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000819231393	CF	On-Demand	Anodyne	ADRB1	29	42
C[C@H](CCNC[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000819231393	CF	On-Demand	Anodyne	ADRB3	54	42
C[C@H](CCNC[C@@H](O)c1ccccc1)N1CCCCC1	ZINC000819231393	CF	On-Demand	Anodyne	DPP7	42	36
C[C@@H](CCNC[C@H](O)c1ccccc1)N1CCCCC1	ZINC000819231394	CF	On-Demand	Anodyne	ADRB2	18	43
C[C@@H](CCNC[C@H](O)c1ccccc1)N1CCCCC1	ZINC000819231394	CF	On-Demand	Anodyne	ADRB1	29	42
C[C@@H](CCNC[C@H](O)c1ccccc1)N1CCCCC1	ZINC000819231394	CF	On-Demand	Anodyne	ADRB3	54	42
C[C@@H](CCNC[C@H](O)c1ccccc1)N1CCCCC1	ZINC000819231394	CF	On-Demand	Anodyne	DPP7	42	36
C[C@H](CCNC[C@H](O)c1ccccc1)N1CCCCC1	ZINC000819231395	CF	On-Demand	Anodyne	ADRB2	18	43
C[C@H](CCNC[C@H](O)c1ccccc1)N1CCCCC1	ZINC000819231395	CF	On-Demand	Anodyne	ADRB1	29	42
C[C@H](CCNC[C@H](O)c1ccccc1)N1CCCCC1	ZINC000819231395	CF	On-Demand	Anodyne	ADRB3	54	42
C[C@H](CCNC[C@H](O)c1ccccc1)N1CCCCC1	ZINC000819231395	CF	On-Demand	Anodyne	DPP7	42	36
O=C(C(F)=C1CCC1)N1CC[C@@H](N2CCCC2)C1	ZINC000819231398	CE	On-Demand	Anodyne	L3MBTL3	93	49
O=C(C(F)=C1CCC1)N1CC[C@H](N2CCCC2)C1	ZINC000819231399	CE	On-Demand	Anodyne	L3MBTL3	93	49
C#CCOCCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819231404	CC	On-Demand	Mild	ADRB2	43	48
C#CCOCCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819231404	CC	On-Demand	Mild	ADRB1	76	48
C#CCOCCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819231404	CC	On-Demand	Mild	ADRB3	43	48
C#CCOCCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819231405	CC	On-Demand	Mild	ADRB2	43	48
C#CCOCCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819231405	CC	On-Demand	Mild	ADRB1	76	48
C#CCOCCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819231405	CC	On-Demand	Mild	ADRB3	43	48
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819231411	FG	On-Demand	Anodyne	CACNA1I	72	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819231411	FG	On-Demand	Anodyne	GPR119	40	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819231412	FG	On-Demand	Anodyne	CACNA1I	72	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819231412	FG	On-Demand	Anodyne	GPR119	40	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819231413	FG	On-Demand	Anodyne	CACNA1I	72	37
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819231413	FG	On-Demand	Anodyne	GPR119	40	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819231414	FG	On-Demand	Anodyne	CACNA1I	72	37
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819231414	FG	On-Demand	Anodyne	GPR119	40	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819231419	FF	On-Demand	Anodyne	CACNA1I	64	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819231419	FF	On-Demand	Anodyne	GPR119	46	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819231420	FF	On-Demand	Anodyne	CACNA1I	64	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819231420	FF	On-Demand	Anodyne	GPR119	46	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819231421	FF	On-Demand	Anodyne	CACNA1I	64	34
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819231421	FF	On-Demand	Anodyne	GPR119	46	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819231422	FF	On-Demand	Anodyne	CACNA1I	64	34
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819231422	FF	On-Demand	Anodyne	GPR119	46	46
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2ccccc2F)C1	ZINC000819231438	FG	On-Demand	Anodyne	CCR8	51	41
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2ccccc2F)C1	ZINC000819231438	FG	On-Demand	Anodyne	GPR119	45	47
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2ccccc2F)C1	ZINC000819231438	FG	On-Demand	Anodyne	SFRP1	21	40
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2ccccc2F)C1	ZINC000819231439	FG	On-Demand	Anodyne	CCR8	51	41
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2ccccc2F)C1	ZINC000819231439	FG	On-Demand	Anodyne	GPR119	45	47
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2ccccc2F)C1	ZINC000819231439	FG	On-Demand	Anodyne	SFRP1	21	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819231442	GH	On-Demand	Anodyne	TRY2_BOVIN	54	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819231442	GH	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819231442	GH	On-Demand	Anodyne	SFRP1	17	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819231443	GH	On-Demand	Anodyne	TRY2_BOVIN	54	34
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819231443	GH	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819231443	GH	On-Demand	Anodyne	SFRP1	17	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819231444	GH	On-Demand	Anodyne	TRY2_BOVIN	54	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819231444	GH	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819231444	GH	On-Demand	Anodyne	SFRP1	17	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819231445	GH	On-Demand	Anodyne	TRY2_BOVIN	54	34
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819231445	GH	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819231445	GH	On-Demand	Anodyne	SFRP1	17	40
C[C@H](CNC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)S(C)(=O)=O	ZINC000819231468	DD	On-Demand	Anodyne	GPR119	48	44
C[C@H](CNC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)S(C)(=O)=O	ZINC000819231468	DD	On-Demand	Anodyne	SFRP1	15	40
C[C@@H](CNC[C@H]1CCN(C(=O)OC(C)(C)C)C1)S(C)(=O)=O	ZINC000819231469	DD	On-Demand	Anodyne	GPR119	48	44
C[C@@H](CNC[C@H]1CCN(C(=O)OC(C)(C)C)C1)S(C)(=O)=O	ZINC000819231469	DD	On-Demand	Anodyne	SFRP1	15	40
C[C@@H](CNC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)S(C)(=O)=O	ZINC000819231470	DD	On-Demand	Anodyne	GPR119	48	44
C[C@@H](CNC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)S(C)(=O)=O	ZINC000819231470	DD	On-Demand	Anodyne	SFRP1	15	40
C[C@H](CNC[C@H]1CCN(C(=O)OC(C)(C)C)C1)S(C)(=O)=O	ZINC000819231471	DD	On-Demand	Anodyne	GPR119	48	44
C[C@H](CNC[C@H]1CCN(C(=O)OC(C)(C)C)C1)S(C)(=O)=O	ZINC000819231471	DD	On-Demand	Anodyne	SFRP1	15	40
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000819231478	GH	On-Demand	Anodyne	EPHX2	29	40
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000819231478	GH	On-Demand	Anodyne	CACNA1I	63	36
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000819231478	GH	On-Demand	Anodyne	GPR119	39	43
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000819231479	GH	On-Demand	Anodyne	EPHX2	29	40
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000819231479	GH	On-Demand	Anodyne	CACNA1I	63	36
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000819231479	GH	On-Demand	Anodyne	GPR119	39	43
C#CCOCCNC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819231493	DD	On-Demand	Mild	ADRB2	17	43
C#CCOCCNC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819231493	DD	On-Demand	Mild	ADRB1	40	31
C#CCOCCNC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819231494	DD	On-Demand	Mild	ADRB2	17	43
C#CCOCCNC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819231494	DD	On-Demand	Mild	ADRB1	40	31
C[C@H](CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)N1CCCCC1	ZINC000819231495	FG	On-Demand	Anodyne	ADRB3	15	40
C[C@H](CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)N1CCCCC1	ZINC000819231496	FG	On-Demand	Anodyne	ADRB3	15	40
C[C@@H](CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)N1CCCCC1	ZINC000819231497	FG	On-Demand	Anodyne	ADRB3	15	40
C[C@@H](CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)N1CCCCC1	ZINC000819231498	FG	On-Demand	Anodyne	ADRB3	15	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819231499	FG	On-Demand	Anodyne	PTGER4	21	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819231499	FG	On-Demand	Anodyne	ST14	57	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819231499	FG	On-Demand	Anodyne	CACNA1I	70	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819231499	FG	On-Demand	Anodyne	GPR119	35	45
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819231500	FG	On-Demand	Anodyne	PTGER4	21	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819231500	FG	On-Demand	Anodyne	ST14	57	37
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819231500	FG	On-Demand	Anodyne	CACNA1I	70	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819231500	FG	On-Demand	Anodyne	GPR119	35	45
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819231501	FG	On-Demand	Anodyne	PTGER4	21	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819231501	FG	On-Demand	Anodyne	ST14	57	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819231501	FG	On-Demand	Anodyne	CACNA1I	70	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819231501	FG	On-Demand	Anodyne	GPR119	35	45
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819231502	FG	On-Demand	Anodyne	PTGER4	21	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819231502	FG	On-Demand	Anodyne	ST14	57	37
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819231502	FG	On-Demand	Anodyne	CACNA1I	70	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819231502	FG	On-Demand	Anodyne	GPR119	35	45
COC(=O)[C@@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819231508	FD	On-Demand	Mild	PAPA1_CARPA	35	43
COC(=O)[C@@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819231510	FD	On-Demand	Mild	PAPA1_CARPA	35	43
O[C@H](CN[C@@H]1COc2cc(F)cc(F)c21)c1cccnc1	ZINC000819231521	CE	On-Demand	Anodyne	ADRB3	44	38
O[C@@H](CN[C@@H]1COc2cc(F)cc(F)c21)c1cccnc1	ZINC000819231522	CE	On-Demand	Anodyne	ADRB3	44	38
O[C@H](CN[C@H]1COc2cc(F)cc(F)c21)c1cccnc1	ZINC000819231523	CE	On-Demand	Anodyne	ADRB3	44	38
O[C@@H](CN[C@H]1COc2cc(F)cc(F)c21)c1cccnc1	ZINC000819231524	CE	On-Demand	Anodyne	ADRB3	44	38
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819231525	FE	On-Demand	Anodyne	ADRB2	28	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819231525	FE	On-Demand	Anodyne	ADRB1	58	37
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819231525	FE	On-Demand	Anodyne	ADRB3	23	47
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819231525	FE	On-Demand	Anodyne	ABCB1	45	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819231525	FE	On-Demand	Anodyne	GPR119	46	50
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819231526	FE	On-Demand	Anodyne	ADRB2	28	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819231526	FE	On-Demand	Anodyne	ADRB1	58	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819231526	FE	On-Demand	Anodyne	ADRB3	23	47
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819231526	FE	On-Demand	Anodyne	ABCB1	45	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819231526	FE	On-Demand	Anodyne	GPR119	46	50
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819231527	FE	On-Demand	Anodyne	ADRB2	28	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819231527	FE	On-Demand	Anodyne	ADRB1	58	37
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819231527	FE	On-Demand	Anodyne	ADRB3	23	47
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819231527	FE	On-Demand	Anodyne	ABCB1	45	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819231527	FE	On-Demand	Anodyne	GPR119	46	50
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819231528	FE	On-Demand	Anodyne	ADRB2	28	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819231528	FE	On-Demand	Anodyne	ADRB1	58	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819231528	FE	On-Demand	Anodyne	ADRB3	23	47
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819231528	FE	On-Demand	Anodyne	ABCB1	45	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819231528	FE	On-Demand	Anodyne	GPR119	46	50
C#CCOCCNC[C@H](O)COc1cccc(CC)c1	ZINC000819231555	CD	On-Demand	Mild	ADRB2	53	46
C#CCOCCNC[C@H](O)COc1cccc(CC)c1	ZINC000819231555	CD	On-Demand	Mild	ADRB1	76	43
C#CCOCCNC[C@H](O)COc1cccc(CC)c1	ZINC000819231555	CD	On-Demand	Mild	ADRB3	47	42
C#CCOCCNC[C@H](O)COc1cccc(CC)c1	ZINC000819231555	CD	On-Demand	Mild	PDS	44	31
C#CCOCCNC[C@@H](O)COc1cccc(CC)c1	ZINC000819231556	CD	On-Demand	Mild	ADRB2	53	46
C#CCOCCNC[C@@H](O)COc1cccc(CC)c1	ZINC000819231556	CD	On-Demand	Mild	ADRB1	76	43
C#CCOCCNC[C@@H](O)COc1cccc(CC)c1	ZINC000819231556	CD	On-Demand	Mild	ADRB3	47	42
C#CCOCCNC[C@@H](O)COc1cccc(CC)c1	ZINC000819231556	CD	On-Demand	Mild	PDS	44	31
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819231557	GF	On-Demand	Anodyne	ADRB2	30	48
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819231557	GF	On-Demand	Anodyne	ADRB1	50	32
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819231557	GF	On-Demand	Anodyne	ADRB3	23	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819231557	GF	On-Demand	Anodyne	ABCB1	47	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819231557	GF	On-Demand	Anodyne	GPR119	36	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819231558	GF	On-Demand	Anodyne	ADRB2	30	48
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819231558	GF	On-Demand	Anodyne	ADRB1	50	32
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819231558	GF	On-Demand	Anodyne	ADRB3	23	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819231558	GF	On-Demand	Anodyne	ABCB1	47	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819231558	GF	On-Demand	Anodyne	GPR119	36	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819231559	GF	On-Demand	Anodyne	ADRB2	30	48
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819231559	GF	On-Demand	Anodyne	ADRB1	50	32
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819231559	GF	On-Demand	Anodyne	ADRB3	23	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819231559	GF	On-Demand	Anodyne	ABCB1	47	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819231559	GF	On-Demand	Anodyne	GPR119	36	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819231560	GF	On-Demand	Anodyne	ADRB2	30	48
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819231560	GF	On-Demand	Anodyne	ADRB1	50	32
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819231560	GF	On-Demand	Anodyne	ADRB3	23	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819231560	GF	On-Demand	Anodyne	ABCB1	47	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819231560	GF	On-Demand	Anodyne	GPR119	36	40
CC(C)(C)OC(=O)N1CC[C@@H](CNCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819231561	GE	On-Demand	Anodyne	GPR119	60	45
CC(C)(C)OC(=O)N1CC[C@@H](CNCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819231561	GE	On-Demand	Anodyne	SFRP1	72	44
CC(C)(C)OC(=O)N1CC[C@@H](CNCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819231561	GE	On-Demand	Anodyne	WNT3	50	35
CC(C)(C)OC(=O)N1CC[C@H](CNCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819231562	GE	On-Demand	Anodyne	GPR119	60	45
CC(C)(C)OC(=O)N1CC[C@H](CNCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819231562	GE	On-Demand	Anodyne	SFRP1	72	44
CC(C)(C)OC(=O)N1CC[C@H](CNCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819231562	GE	On-Demand	Anodyne	WNT3	50	35
C#CCOCCNC[C@H](O)c1ccc(C)cc1	ZINC000819231564	BD	On-Demand	Mild	ADRB2	18	41
C#CCOCCNC[C@@H](O)c1ccc(C)cc1	ZINC000819231565	BD	On-Demand	Mild	ADRB2	18	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COCc2ccccc2F)C1	ZINC000819231588	GF	On-Demand	Anodyne	GRIN2B	20	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COCc2ccccc2F)C1	ZINC000819231588	GF	On-Demand	Anodyne	GPR119	39	53
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COCc2ccccc2F)C1	ZINC000819231589	GF	On-Demand	Anodyne	GRIN2B	20	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COCc2ccccc2F)C1	ZINC000819231589	GF	On-Demand	Anodyne	GPR119	39	53
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COCc2ccccc2F)C1	ZINC000819231590	GF	On-Demand	Anodyne	GRIN2B	20	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COCc2ccccc2F)C1	ZINC000819231590	GF	On-Demand	Anodyne	GPR119	39	53
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COCc2ccccc2F)C1	ZINC000819231591	GF	On-Demand	Anodyne	GRIN2B	20	46
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COCc2ccccc2F)C1	ZINC000819231591	GF	On-Demand	Anodyne	GPR119	39	53
C#CCOCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819231596	CD	On-Demand	Mild	ADRB2	19	40
C#CCOCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819231596	CD	On-Demand	Mild	ADRB1	15	40
C#CCOCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819231597	CD	On-Demand	Mild	ADRB2	19	40
C#CCOCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819231597	CD	On-Demand	Mild	ADRB1	15	40
C#CCOCCNC[C@H](O)COc1cc(C)c(Cl)cc1C(C)C	ZINC000819231598	EF	On-Demand	Mild	ADRB2	15	40
C#CCOCCNC[C@@H](O)COc1cc(C)c(Cl)cc1C(C)C	ZINC000819231599	EF	On-Demand	Mild	ADRB2	15	40
Cc1ccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819231606	GF	On-Demand	Anodyne	ADRB2	18	40
Cc1ccc(OC[C@@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819231606	GF	On-Demand	Anodyne	GPR119	39	40
Cc1ccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819231607	GF	On-Demand	Anodyne	ADRB2	18	40
Cc1ccc(OC[C@H](O)CNC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819231607	GF	On-Demand	Anodyne	GPR119	39	40
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819231608	GF	On-Demand	Anodyne	ADRB2	18	40
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819231608	GF	On-Demand	Anodyne	GPR119	39	40
Cc1ccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819231609	GF	On-Demand	Anodyne	ADRB2	18	40
Cc1ccc(OC[C@H](O)CNC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(C)c1	ZINC000819231609	GF	On-Demand	Anodyne	GPR119	39	40
C#CCOCCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819231616	CD	On-Demand	Mild	CASR	40	36
C#CCOCCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819231617	CD	On-Demand	Mild	CASR	40	36
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819231627	GE	On-Demand	Mild	ADRB1	61	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819231627	GE	On-Demand	Mild	ADRB3	41	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819231627	GE	On-Demand	Mild	GPR119	41	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819231628	GE	On-Demand	Mild	ADRB1	61	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819231628	GE	On-Demand	Mild	ADRB3	41	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819231628	GE	On-Demand	Mild	GPR119	41	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819231629	GE	On-Demand	Mild	ADRB1	61	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819231629	GE	On-Demand	Mild	ADRB3	41	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819231629	GE	On-Demand	Mild	GPR119	41	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819231630	GE	On-Demand	Mild	ADRB1	61	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819231630	GE	On-Demand	Mild	ADRB3	41	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819231630	GE	On-Demand	Mild	GPR119	41	43
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2cccnc2)C1	ZINC000819231645	EE	On-Demand	Anodyne	GRIN2B	20	48
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2cccnc2)C1	ZINC000819231645	EE	On-Demand	Anodyne	GPR119	42	42
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2cccnc2)C1	ZINC000819231645	EE	On-Demand	Anodyne	NAMPT	30	42
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2cccnc2)C1	ZINC000819231646	EE	On-Demand	Anodyne	GRIN2B	20	48
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2cccnc2)C1	ZINC000819231646	EE	On-Demand	Anodyne	GPR119	42	42
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2cccnc2)C1	ZINC000819231646	EE	On-Demand	Anodyne	NAMPT	30	42
O=C(O)[C@@H]1CCCN1C(=O)Nc1nc2c(s1)CCCCC2	ZINC000819231651	DE	On-Demand	Anodyne	SLC27A1	39	43
O=C(O)[C@H]1CCCN1C(=O)Nc1nc2c(s1)CCCCC2	ZINC000819231652	DE	On-Demand	Anodyne	SLC27A1	39	43
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc(O)c2cnn(-c3ccccc3)c2n1	ZINC000819231653	GD	On-Demand	Anodyne	ACE	43	41
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc(O)c2cnn(-c3ccccc3)c2n1	ZINC000819231653	GD	On-Demand	Anodyne	PREP	89	41
O=C(O)[C@H]1CCCN1C(=O)CCc1nc(O)c2cnn(-c3ccccc3)c2n1	ZINC000819231654	GD	On-Demand	Anodyne	ACE	43	41
O=C(O)[C@H]1CCCN1C(=O)CCc1nc(O)c2cnn(-c3ccccc3)c2n1	ZINC000819231654	GD	On-Demand	Anodyne	PREP	89	41
O=C(O)[C@@H]1CCCN1C(=O)Nc1cc(C2CC2)nn1-c1ccccc1	ZINC000819231655	EF	On-Demand	Anodyne	ACE	49	39
O=C(O)[C@@H]1CCCN1C(=O)Nc1cc(C2CC2)nn1-c1ccccc1	ZINC000819231655	EF	On-Demand	Anodyne	PREP	44	35
O=C(O)[C@H]1CCCN1C(=O)Nc1cc(C2CC2)nn1-c1ccccc1	ZINC000819231656	EF	On-Demand	Anodyne	ACE	49	39
O=C(O)[C@H]1CCCN1C(=O)Nc1cc(C2CC2)nn1-c1ccccc1	ZINC000819231656	EF	On-Demand	Anodyne	PREP	44	35
O=C(O)[C@H]1CCCN1C(=O)Nc1ccccc1CN1C(=O)CNC1=O	ZINC000819231657	EC	On-Demand	Anodyne	ACE	55	39
O=C(O)[C@H]1CCCN1C(=O)Nc1ccccc1CN1C(=O)CNC1=O	ZINC000819231657	EC	On-Demand	Anodyne	FKBP1A	15	40
O=C(O)[C@@H]1CCCN1C(=O)Nc1ccccc1CN1C(=O)CNC1=O	ZINC000819231658	EC	On-Demand	Anodyne	ACE	55	39
O=C(O)[C@@H]1CCCN1C(=O)Nc1ccccc1CN1C(=O)CNC1=O	ZINC000819231658	EC	On-Demand	Anodyne	FKBP1A	15	40
O=C(O)[C@H]1CCCN1C(=O)Nc1cccc(N2CCNC2=O)c1	ZINC000819231659	DD	On-Demand	Anodyne	UL80	27	40
O=C(O)[C@@H]1CCCN1C(=O)Nc1cccc(N2CCNC2=O)c1	ZINC000819231660	DD	On-Demand	Anodyne	UL80	27	40
O=C(O)[C@H]1CCCN1C(=O)CSc1nnc(S)s1	ZINC000819231661	DC	On-Demand	Anodyne	ACE	42	49
O=C(O)[C@H]1CCCN1C(=O)CSc1nnc(S)s1	ZINC000819231661	DC	On-Demand	Anodyne	PREP	41	35
O=C(O)[C@@H]1CCCN1C(=O)CSc1nnc(S)s1	ZINC000819231662	DC	On-Demand	Anodyne	ACE	42	49
O=C(O)[C@@H]1CCCN1C(=O)CSc1nnc(S)s1	ZINC000819231662	DC	On-Demand	Anodyne	PREP	41	35
O=C(O)[C@H]1CCCN1C(=O)Nc1ccc(Cl)nc1	ZINC000819231663	CD	On-Demand	Anodyne	ACE	48	41
O=C(O)[C@H]1CCCN1C(=O)Nc1ccc(Cl)nc1	ZINC000819231663	CD	On-Demand	Anodyne	UL80	43	45
O=C(O)[C@H]1CCCN1C(=O)Nc1ccc(Cl)nc1	ZINC000819231663	CD	On-Demand	Anodyne	PREP	45	37
O=C(O)[C@@H]1CCCN1C(=O)Nc1ccc(Cl)nc1	ZINC000819231664	CD	On-Demand	Anodyne	ACE	48	41
O=C(O)[C@@H]1CCCN1C(=O)Nc1ccc(Cl)nc1	ZINC000819231664	CD	On-Demand	Anodyne	UL80	43	45
O=C(O)[C@@H]1CCCN1C(=O)Nc1ccc(Cl)nc1	ZINC000819231664	CD	On-Demand	Anodyne	PREP	45	37
O=C(O)[C@@H]1CCCN1C(=O)Nc1nc(-c2ccccc2)ns1	ZINC000819231665	DE	On-Demand	Anodyne	ACE	60	43
O=C(O)[C@@H]1CCCN1C(=O)Nc1nc(-c2ccccc2)ns1	ZINC000819231665	DE	On-Demand	Anodyne	MME	16	42
O=C(O)[C@@H]1CCCN1C(=O)Nc1nc(-c2ccccc2)ns1	ZINC000819231665	DE	On-Demand	Anodyne	PREP	67	37
O=C(O)[C@H]1CCCN1C(=O)Nc1nc(-c2ccccc2)ns1	ZINC000819231666	DE	On-Demand	Anodyne	ACE	60	43
O=C(O)[C@H]1CCCN1C(=O)Nc1nc(-c2ccccc2)ns1	ZINC000819231666	DE	On-Demand	Anodyne	MME	16	42
O=C(O)[C@H]1CCCN1C(=O)Nc1nc(-c2ccccc2)ns1	ZINC000819231666	DE	On-Demand	Anodyne	PREP	67	37
O=C(O)[C@H]1CCCN1C(=O)Nc1nc(C(F)(F)F)cs1	ZINC000819231667	DE	On-Demand	Anodyne	ACE	41	38
O=C(O)[C@H]1CCCN1C(=O)Nc1nc(C(F)(F)F)cs1	ZINC000819231667	DE	On-Demand	Anodyne	WNT3	40	35
O=C(O)[C@@H]1CCCN1C(=O)Nc1nc(C(F)(F)F)cs1	ZINC000819231668	DE	On-Demand	Anodyne	ACE	41	38
O=C(O)[C@@H]1CCCN1C(=O)Nc1nc(C(F)(F)F)cs1	ZINC000819231668	DE	On-Demand	Anodyne	WNT3	40	35
O=C(O)[C@H]1CCCN1C(=O)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819231669	EF	On-Demand	Anodyne	ACE	46	39
O=C(O)[C@H]1CCCN1C(=O)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819231669	EF	On-Demand	Anodyne	CCR3	41	33
O=C(O)[C@H]1CCCN1C(=O)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819231669	EF	On-Demand	Anodyne	PREP	55	35
O=C(O)[C@H]1CCCN1C(=O)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819231669	EF	On-Demand	Anodyne	CDK5	51	40
O=C(O)[C@@H]1CCCN1C(=O)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819231670	EF	On-Demand	Anodyne	ACE	46	39
O=C(O)[C@@H]1CCCN1C(=O)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819231670	EF	On-Demand	Anodyne	CCR3	41	33
O=C(O)[C@@H]1CCCN1C(=O)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819231670	EF	On-Demand	Anodyne	PREP	55	35
O=C(O)[C@@H]1CCCN1C(=O)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819231670	EF	On-Demand	Anodyne	CDK5	51	40
O=C(O)[C@H]1CCCN1C(=O)CN1CCS(=O)(=O)CC1	ZINC000819231671	CA	On-Demand	Anodyne	ACE	47	53
O=C(O)[C@H]1CCCN1C(=O)CN1CCS(=O)(=O)CC1	ZINC000819231671	CA	On-Demand	Anodyne	PREP	33	40
O=C(O)[C@H]1CCCN1C(=O)CN1CCS(=O)(=O)CC1	ZINC000819231671	CA	On-Demand	Anodyne	MVD	15	45
O=C(O)[C@H]1CCCN1C(=O)Nc1ccc(N2CCCC2)nc1	ZINC000819231672	DD	On-Demand	Anodyne	ACE	46	37
O=C(O)[C@H]1CCCN1C(=O)Nc1ccc(N2CCCC2)nc1	ZINC000819231672	DD	On-Demand	Anodyne	UL80	42	42
O=C(O)[C@H]1CCCN1C(=O)Nc1ccc(N2CCCC2)nc1	ZINC000819231672	DD	On-Demand	Anodyne	PREP	62	37
O=C(O)[C@H]1CCCN1C(=O)Nc1ccc(N2CCCC2)nc1	ZINC000819231672	DD	On-Demand	Anodyne	DGAT1	45	43
O=C(O)[C@@H]1CCCN1C(=O)Nc1ccc(N2CCCC2)nc1	ZINC000819231673	DD	On-Demand	Anodyne	ACE	46	37
O=C(O)[C@@H]1CCCN1C(=O)Nc1ccc(N2CCCC2)nc1	ZINC000819231673	DD	On-Demand	Anodyne	UL80	42	42
O=C(O)[C@@H]1CCCN1C(=O)Nc1ccc(N2CCCC2)nc1	ZINC000819231673	DD	On-Demand	Anodyne	PREP	62	37
O=C(O)[C@@H]1CCCN1C(=O)Nc1ccc(N2CCCC2)nc1	ZINC000819231673	DD	On-Demand	Anodyne	DGAT1	45	43
O=C(O)[C@H]1CCCN1C(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000819231674	EF	On-Demand	Anodyne	ACE	74	45
O=C(O)[C@H]1CCCN1C(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000819231674	EF	On-Demand	Anodyne	FKBP1A	40	44
O=C(O)[C@H]1CCCN1C(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000819231674	EF	On-Demand	Anodyne	MME	29	44
O=C(O)[C@H]1CCCN1C(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000819231674	EF	On-Demand	Anodyne	TRY1_BOVIN	57	33
O=C(O)[C@H]1CCCN1C(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000819231674	EF	On-Demand	Anodyne	PREP	98	44
O=C(O)[C@H]1CCCN1C(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000819231674	EF	On-Demand	Anodyne	CDK5	54	47
O=C(O)[C@H]1CCCN1C(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000819231674	EF	On-Demand	Anodyne	MGEA5	37	44
O=C(O)[C@@H]1CCCN1C(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000819231675	EF	On-Demand	Anodyne	ACE	74	45
O=C(O)[C@@H]1CCCN1C(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000819231675	EF	On-Demand	Anodyne	FKBP1A	40	44
O=C(O)[C@@H]1CCCN1C(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000819231675	EF	On-Demand	Anodyne	MME	29	44
O=C(O)[C@@H]1CCCN1C(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000819231675	EF	On-Demand	Anodyne	TRY1_BOVIN	57	33
O=C(O)[C@@H]1CCCN1C(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000819231675	EF	On-Demand	Anodyne	PREP	98	44
O=C(O)[C@@H]1CCCN1C(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000819231675	EF	On-Demand	Anodyne	CDK5	54	47
O=C(O)[C@@H]1CCCN1C(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000819231675	EF	On-Demand	Anodyne	MGEA5	37	44
O=C(O)[C@H]1CCCN1C(=O)CSc1nnc(-c2ccc(Cl)cc2)o1	ZINC000819231676	FF	On-Demand	Anodyne	ACE	47	46
O=C(O)[C@H]1CCCN1C(=O)CSc1nnc(-c2ccc(Cl)cc2)o1	ZINC000819231676	FF	On-Demand	Anodyne	PREP	42	33
O=C(O)[C@@H]1CCCN1C(=O)CSc1nnc(-c2ccc(Cl)cc2)o1	ZINC000819231677	FF	On-Demand	Anodyne	ACE	47	46
O=C(O)[C@@H]1CCCN1C(=O)CSc1nnc(-c2ccc(Cl)cc2)o1	ZINC000819231677	FF	On-Demand	Anodyne	PREP	42	33
O=C(O)[C@H]1CCCN1C(=O)Nc1nc(CN2CCOCC2)cs1	ZINC000819231678	ED	On-Demand	Anodyne	CASR	28	42
O=C(O)[C@@H]1CCCN1C(=O)Nc1nc(CN2CCOCC2)cs1	ZINC000819231679	ED	On-Demand	Anodyne	CASR	28	42
O=C(O)[C@H]1CCCN1C(=O)Cc1nc2ncccn2n1	ZINC000819231680	CB	On-Demand	Anodyne	ACE	38	40
O=C(O)[C@H]1CCCN1C(=O)Cc1nc2ncccn2n1	ZINC000819231680	CB	On-Demand	Anodyne	CPT2	40	34
O=C(O)[C@H]1CCCN1C(=O)Cc1nc2ncccn2n1	ZINC000819231680	CB	On-Demand	Anodyne	PREP	50	38
O=C(O)[C@H]1CCCN1C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	ZINC000819231681	EC	On-Demand	Anodyne	ACE	50	38
O=C(O)[C@@H]1CCCN1C(=O)Nc1ccc(CN2C(=O)CNC2=O)cc1	ZINC000819231682	EC	On-Demand	Anodyne	ACE	50	38
O=C(O)[C@@H]1CCCN1C(=O)Nc1nnc(-c2ccccc2)s1	ZINC000819231683	DE	On-Demand	Anodyne	ACE	69	47
O=C(O)[C@@H]1CCCN1C(=O)Nc1nnc(-c2ccccc2)s1	ZINC000819231683	DE	On-Demand	Anodyne	FKBP1A	26	43
O=C(O)[C@@H]1CCCN1C(=O)Nc1nnc(-c2ccccc2)s1	ZINC000819231683	DE	On-Demand	Anodyne	MME	24	46
O=C(O)[C@@H]1CCCN1C(=O)Nc1nnc(-c2ccccc2)s1	ZINC000819231683	DE	On-Demand	Anodyne	TRY1_BOVIN	66	34
O=C(O)[C@@H]1CCCN1C(=O)Nc1nnc(-c2ccccc2)s1	ZINC000819231683	DE	On-Demand	Anodyne	PREP	76	40
O=C(O)[C@H]1CCCN1C(=O)Nc1nnc(-c2ccccc2)s1	ZINC000819231684	DE	On-Demand	Anodyne	ACE	69	47
O=C(O)[C@H]1CCCN1C(=O)Nc1nnc(-c2ccccc2)s1	ZINC000819231684	DE	On-Demand	Anodyne	FKBP1A	26	43
O=C(O)[C@H]1CCCN1C(=O)Nc1nnc(-c2ccccc2)s1	ZINC000819231684	DE	On-Demand	Anodyne	MME	24	46
O=C(O)[C@H]1CCCN1C(=O)Nc1nnc(-c2ccccc2)s1	ZINC000819231684	DE	On-Demand	Anodyne	TRY1_BOVIN	66	34
O=C(O)[C@H]1CCCN1C(=O)Nc1nnc(-c2ccccc2)s1	ZINC000819231684	DE	On-Demand	Anodyne	PREP	76	40
O=C(O)[C@@H]1CCCN1C(=O)CSc1nncs1	ZINC000819231685	CC	On-Demand	Anodyne	ACE	44	45
O=C(O)[C@@H]1CCCN1C(=O)CSc1nncs1	ZINC000819231685	CC	On-Demand	Anodyne	PREP	55	36
O=C(O)[C@H]1CCCN1C(=O)CSc1nncs1	ZINC000819231686	CC	On-Demand	Anodyne	ACE	44	45
O=C(O)[C@H]1CCCN1C(=O)CSc1nncs1	ZINC000819231686	CC	On-Demand	Anodyne	PREP	55	36
O=C(O)[C@H]1CCCN1C(=O)CCc1nc2ccccc2oc1=O	ZINC000819231687	DD	On-Demand	Anodyne	ACE	52	44
O=C(O)[C@H]1CCCN1C(=O)CCc1nc2ccccc2oc1=O	ZINC000819231687	DD	On-Demand	Anodyne	ELANE	24	41
O=C(O)[C@H]1CCCN1C(=O)CCc1nc2ccccc2oc1=O	ZINC000819231687	DD	On-Demand	Anodyne	HCRTR1	18	43
O=C(O)[C@H]1CCCN1C(=O)CCc1nc2ccccc2oc1=O	ZINC000819231687	DD	On-Demand	Anodyne	PRCP	26	47
O=C(O)[C@H]1CCCN1C(=O)CCc1nc2ccccc2oc1=O	ZINC000819231687	DD	On-Demand	Anodyne	CPT1A	60	35
O=C(O)[C@H]1CCCN1C(=O)CCc1nc2ccccc2oc1=O	ZINC000819231687	DD	On-Demand	Anodyne	CPT2	44	33
O=C(O)[C@H]1CCCN1C(=O)CCc1nc2ccccc2oc1=O	ZINC000819231687	DD	On-Demand	Anodyne	PREP	91	55
O=C(O)[C@H]1CCCN1C(=O)CCc1nc2ccccc2oc1=O	ZINC000819231687	DD	On-Demand	Anodyne	HCRTR2	17	45
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc2ccccc2oc1=O	ZINC000819231688	DD	On-Demand	Anodyne	ACE	52	44
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc2ccccc2oc1=O	ZINC000819231688	DD	On-Demand	Anodyne	ELANE	24	41
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc2ccccc2oc1=O	ZINC000819231688	DD	On-Demand	Anodyne	HCRTR1	18	43
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc2ccccc2oc1=O	ZINC000819231688	DD	On-Demand	Anodyne	PRCP	26	47
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc2ccccc2oc1=O	ZINC000819231688	DD	On-Demand	Anodyne	CPT1A	60	35
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc2ccccc2oc1=O	ZINC000819231688	DD	On-Demand	Anodyne	CPT2	44	33
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc2ccccc2oc1=O	ZINC000819231688	DD	On-Demand	Anodyne	PREP	91	55
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc2ccccc2oc1=O	ZINC000819231688	DD	On-Demand	Anodyne	HCRTR2	17	45
O=C(O)[C@H]1CCCN1C(=O)CCn1c(S)nnc1-c1cccs1	ZINC000819231689	FD	On-Demand	Anodyne	ACE	41	44
O=C(O)[C@H]1CCCN1C(=O)CCn1c(S)nnc1-c1cccs1	ZINC000819231689	FD	On-Demand	Anodyne	PREP	71	40
O=C(O)[C@@H]1CCCN1C(=O)CCn1c(S)nnc1-c1cccs1	ZINC000819231690	FD	On-Demand	Anodyne	ACE	41	44
O=C(O)[C@@H]1CCCN1C(=O)CCn1c(S)nnc1-c1cccs1	ZINC000819231690	FD	On-Demand	Anodyne	PREP	71	40
O=C(O)[C@@H]1CCCN1C(=O)CCSc1ccccn1	ZINC000819231691	CD	On-Demand	Anodyne	F2	18	44
O=C(O)[C@@H]1CCCN1C(=O)CCSc1ccccn1	ZINC000819231691	CD	On-Demand	Anodyne	ACE	63	48
O=C(O)[C@@H]1CCCN1C(=O)CCSc1ccccn1	ZINC000819231691	CD	On-Demand	Anodyne	FKBP1A	48	39
O=C(O)[C@@H]1CCCN1C(=O)CCSc1ccccn1	ZINC000819231691	CD	On-Demand	Anodyne	CPT1A	55	45
O=C(O)[C@@H]1CCCN1C(=O)CCSc1ccccn1	ZINC000819231691	CD	On-Demand	Anodyne	CPT2	46	38
O=C(O)[C@@H]1CCCN1C(=O)CCSc1ccccn1	ZINC000819231691	CD	On-Demand	Anodyne	PREP	114	51
O=C(O)[C@H]1CCCN1C(=O)CCSc1ccccn1	ZINC000819231692	CD	On-Demand	Anodyne	F2	18	44
O=C(O)[C@H]1CCCN1C(=O)CCSc1ccccn1	ZINC000819231692	CD	On-Demand	Anodyne	ACE	63	48
O=C(O)[C@H]1CCCN1C(=O)CCSc1ccccn1	ZINC000819231692	CD	On-Demand	Anodyne	FKBP1A	48	39
O=C(O)[C@H]1CCCN1C(=O)CCSc1ccccn1	ZINC000819231692	CD	On-Demand	Anodyne	CPT1A	55	45
O=C(O)[C@H]1CCCN1C(=O)CCSc1ccccn1	ZINC000819231692	CD	On-Demand	Anodyne	CPT2	46	38
O=C(O)[C@H]1CCCN1C(=O)CCSc1ccccn1	ZINC000819231692	CD	On-Demand	Anodyne	PREP	114	51
O=C(O)[C@H]1CCCN1C(=O)Nc1cccnc1Cl	ZINC000819231693	CD	On-Demand	Anodyne	ACE	53	39
O=C(O)[C@H]1CCCN1C(=O)Nc1cccnc1Cl	ZINC000819231693	CD	On-Demand	Anodyne	PREP	48	36
O=C(O)[C@H]1CCCN1C(=O)Nc1cccnc1Cl	ZINC000819231693	CD	On-Demand	Anodyne	G2YM83_BOTF4	69	37
O=C(O)[C@@H]1CCCN1C(=O)Nc1cccnc1Cl	ZINC000819231694	CD	On-Demand	Anodyne	ACE	53	39
O=C(O)[C@@H]1CCCN1C(=O)Nc1cccnc1Cl	ZINC000819231694	CD	On-Demand	Anodyne	PREP	48	36
O=C(O)[C@@H]1CCCN1C(=O)Nc1cccnc1Cl	ZINC000819231694	CD	On-Demand	Anodyne	G2YM83_BOTF4	69	37
O=C(O)[C@H]1CCCN1C(=O)Nc1cccc(N2C(=O)CNC2=O)c1	ZINC000819231695	EC	On-Demand	Anodyne	ACE	44	38
O=C(O)[C@H]1CCCN1C(=O)Nc1cccc(N2C(=O)CNC2=O)c1	ZINC000819231695	EC	On-Demand	Anodyne	UL80	28	41
O=C(O)[C@@H]1CCCN1C(=O)Nc1cccc(N2C(=O)CNC2=O)c1	ZINC000819231696	EC	On-Demand	Anodyne	ACE	44	38
O=C(O)[C@@H]1CCCN1C(=O)Nc1cccc(N2C(=O)CNC2=O)c1	ZINC000819231696	EC	On-Demand	Anodyne	UL80	28	41
O=C(O)[C@H]1CCCN1C(=O)CC/N=C1/NS(=O)(=O)c2ccccc21	ZINC000819231697	FC	On-Demand	Mild	ACE	47	43
O=C(O)[C@H]1CCCN1C(=O)CC/N=C1/NS(=O)(=O)c2ccccc21	ZINC000819231697	FC	On-Demand	Mild	PREP	67	40
O=C(O)[C@@H]1CCCN1C(=O)CC/N=C1/NS(=O)(=O)c2ccccc21	ZINC000819231698	FC	On-Demand	Mild	ACE	47	43
O=C(O)[C@@H]1CCCN1C(=O)CC/N=C1/NS(=O)(=O)c2ccccc21	ZINC000819231698	FC	On-Demand	Mild	PREP	67	40
O=C(O)[C@H]1CCCN1C(=O)Nc1ccc(-n2cccn2)c(F)c1	ZINC000819231699	DE	On-Demand	Anodyne	ACE	40	37
O=C(O)[C@H]1CCCN1C(=O)Nc1ccc(-n2cccn2)c(F)c1	ZINC000819231699	DE	On-Demand	Anodyne	NPY2R	66	35
O=C(O)[C@@H]1CCCN1C(=O)Nc1ccc(-n2cccn2)c(F)c1	ZINC000819231700	DE	On-Demand	Anodyne	ACE	40	37
O=C(O)[C@@H]1CCCN1C(=O)Nc1ccc(-n2cccn2)c(F)c1	ZINC000819231700	DE	On-Demand	Anodyne	NPY2R	66	35
O=C(O)[C@H]1CCCN1C(=O)Nc1nc(CN2CCCCC2)cs1	ZINC000819231701	EE	On-Demand	Anodyne	ACE	42	37
O=C(O)[C@@H]1CCCN1C(=O)Nc1nc(CN2CCCCC2)cs1	ZINC000819231702	EE	On-Demand	Anodyne	ACE	42	37
O=C(O)[C@H]1CCCN1C(=O)CCc1nnc(C2CCCC2)o1	ZINC000819231703	DD	On-Demand	Anodyne	ACE	41	49
O=C(O)[C@H]1CCCN1C(=O)CCc1nnc(C2CCCC2)o1	ZINC000819231703	DD	On-Demand	Anodyne	PREP	50	38
O=C(O)[C@@H]1CCCN1C(=O)CCc1nnc(C2CCCC2)o1	ZINC000819231704	DD	On-Demand	Anodyne	ACE	41	49
O=C(O)[C@@H]1CCCN1C(=O)CCc1nnc(C2CCCC2)o1	ZINC000819231704	DD	On-Demand	Anodyne	PREP	50	38
O=C(O)[C@H]1CCCN1C(=O)CCc1nnc(-c2ccc(Cl)cc2)o1	ZINC000819231705	EE	On-Demand	Anodyne	ACE	46	44
O=C(O)[C@H]1CCCN1C(=O)CCc1nnc(-c2ccc(Cl)cc2)o1	ZINC000819231705	EE	On-Demand	Anodyne	PREP	61	38
O=C(O)[C@@H]1CCCN1C(=O)CCc1nnc(-c2ccc(Cl)cc2)o1	ZINC000819231706	EE	On-Demand	Anodyne	ACE	46	44
O=C(O)[C@@H]1CCCN1C(=O)CCc1nnc(-c2ccc(Cl)cc2)o1	ZINC000819231706	EE	On-Demand	Anodyne	PREP	61	38
O=C(O)[C@H]1CCCN1C(=O)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000819231707	ED	On-Demand	Anodyne	ACE	40	39
O=C(O)[C@H]1CCCN1C(=O)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000819231707	ED	On-Demand	Anodyne	UL80	23	40
O=C(O)[C@@H]1CCCN1C(=O)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000819231708	ED	On-Demand	Anodyne	ACE	40	39
O=C(O)[C@@H]1CCCN1C(=O)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000819231708	ED	On-Demand	Anodyne	UL80	23	40
O=C(O)[C@H]1CCCN1C(=O)Nc1cccnc1N1CCCC1	ZINC000819231709	DD	On-Demand	Anodyne	ACE	51	38
O=C(O)[C@H]1CCCN1C(=O)Nc1cccnc1N1CCCC1	ZINC000819231709	DD	On-Demand	Anodyne	PREP	57	37
O=C(O)[C@@H]1CCCN1C(=O)Nc1cccnc1N1CCCC1	ZINC000819231710	DD	On-Demand	Anodyne	ACE	51	38
O=C(O)[C@@H]1CCCN1C(=O)Nc1cccnc1N1CCCC1	ZINC000819231710	DD	On-Demand	Anodyne	PREP	57	37
O=C(O)[C@@H]1CCCN1C(=O)CSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000819231711	GG	On-Demand	Anodyne	ACE	44	48
O=C(O)[C@@H]1CCCN1C(=O)CSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000819231711	GG	On-Demand	Anodyne	CPT1A	73	34
O=C(O)[C@@H]1CCCN1C(=O)CSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000819231711	GG	On-Demand	Anodyne	PREP	62	36
O=C(O)[C@@H]1CCCN1C(=O)CSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000819231711	GG	On-Demand	Anodyne	ALOX15	40	43
O=C(O)[C@H]1CCCN1C(=O)CSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000819231712	GG	On-Demand	Anodyne	ACE	44	48
O=C(O)[C@H]1CCCN1C(=O)CSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000819231712	GG	On-Demand	Anodyne	CPT1A	73	34
O=C(O)[C@H]1CCCN1C(=O)CSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000819231712	GG	On-Demand	Anodyne	PREP	62	36
O=C(O)[C@H]1CCCN1C(=O)CSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000819231712	GG	On-Demand	Anodyne	ALOX15	40	43
O=C(O)[C@H]1CCCN1C(=O)Cc1c[nH]c2cc(Br)ccc12	ZINC000819231713	FF	On-Demand	Anodyne	ACE	48	48
O=C(O)[C@H]1CCCN1C(=O)Cc1c[nH]c2cc(Br)ccc12	ZINC000819231713	FF	On-Demand	Anodyne	PREP	42	33
O=C(O)[C@@H]1CCCN1C(=O)Cc1c[nH]c2cc(Br)ccc12	ZINC000819231714	FF	On-Demand	Anodyne	ACE	48	48
O=C(O)[C@@H]1CCCN1C(=O)Cc1c[nH]c2cc(Br)ccc12	ZINC000819231714	FF	On-Demand	Anodyne	PREP	42	33
O=C(O)[C@H]1CCCN1C(=O)Cc1cc(Br)ccc1F	ZINC000819231715	EE	On-Demand	Anodyne	ACE	56	52
O=C(O)[C@H]1CCCN1C(=O)Cc1cc(Br)ccc1F	ZINC000819231715	EE	On-Demand	Anodyne	PREP	62	36
O=C(O)[C@@H]1CCCN1C(=O)Cc1cc(Br)ccc1F	ZINC000819231716	EE	On-Demand	Anodyne	ACE	56	52
O=C(O)[C@@H]1CCCN1C(=O)Cc1cc(Br)ccc1F	ZINC000819231716	EE	On-Demand	Anodyne	PREP	62	36
O=C(O)[C@@H]1CCCN1C(=O)CCNS(=O)(=O)/C=C/c1ccccc1	ZINC000819231717	FD	On-Demand	Anodyne	ACE	63	46
O=C(O)[C@@H]1CCCN1C(=O)CCNS(=O)(=O)/C=C/c1ccccc1	ZINC000819231717	FD	On-Demand	Anodyne	MME	15	41
O=C(O)[C@@H]1CCCN1C(=O)CCNS(=O)(=O)/C=C/c1ccccc1	ZINC000819231717	FD	On-Demand	Anodyne	PREP	89	42
O=C(O)[C@@H]1CCCN1C(=O)CCNS(=O)(=O)/C=C/c1ccccc1	ZINC000819231717	FD	On-Demand	Anodyne	WNT3	46	36
O=C(O)[C@@H]1CCCN1C(=O)CCNS(=O)(=O)/C=C/c1ccccc1	ZINC000819231717	FD	On-Demand	Anodyne	TMPRSS11D	49	31
O=C(O)[C@@H]1CCCN1C(=O)CCNS(=O)(=O)/C=C\c1ccccc1	ZINC000819231718	FD	On-Demand	Anodyne	ACE	63	46
O=C(O)[C@@H]1CCCN1C(=O)CCNS(=O)(=O)/C=C\c1ccccc1	ZINC000819231718	FD	On-Demand	Anodyne	MME	15	41
O=C(O)[C@@H]1CCCN1C(=O)CCNS(=O)(=O)/C=C\c1ccccc1	ZINC000819231718	FD	On-Demand	Anodyne	PREP	89	42
O=C(O)[C@@H]1CCCN1C(=O)CCNS(=O)(=O)/C=C\c1ccccc1	ZINC000819231718	FD	On-Demand	Anodyne	WNT3	46	36
O=C(O)[C@@H]1CCCN1C(=O)CCNS(=O)(=O)/C=C\c1ccccc1	ZINC000819231718	FD	On-Demand	Anodyne	TMPRSS11D	49	31
O=C(O)[C@H]1CCCN1C(=O)Cc1nnc(O)c2ccccc12	ZINC000819231719	DC	On-Demand	Anodyne	ACE	59	44
O=C(O)[C@H]1CCCN1C(=O)Cc1nnc(O)c2ccccc12	ZINC000819231719	DC	On-Demand	Anodyne	MME	15	41
O=C(O)[C@H]1CCCN1C(=O)Cc1nnc(O)c2ccccc12	ZINC000819231719	DC	On-Demand	Anodyne	PREP	91	39
O=C(O)[C@@H]1CCCN1C(=O)Cc1nnc(O)c2ccccc12	ZINC000819231720	DC	On-Demand	Anodyne	ACE	59	44
O=C(O)[C@@H]1CCCN1C(=O)Cc1nnc(O)c2ccccc12	ZINC000819231720	DC	On-Demand	Anodyne	MME	15	41
O=C(O)[C@@H]1CCCN1C(=O)Cc1nnc(O)c2ccccc12	ZINC000819231720	DC	On-Demand	Anodyne	PREP	91	39
O=C(O)[C@H]1CCCN1C(=O)CCc1nc[nH]n1	ZINC000819231721	BB	On-Demand	Anodyne	ACE	61	53
O=C(O)[C@H]1CCCN1C(=O)CCc1nc[nH]n1	ZINC000819231721	BB	On-Demand	Anodyne	PRCP	16	41
O=C(O)[C@H]1CCCN1C(=O)CCc1nc[nH]n1	ZINC000819231721	BB	On-Demand	Anodyne	CPT1A	68	39
O=C(O)[C@H]1CCCN1C(=O)CCc1nc[nH]n1	ZINC000819231721	BB	On-Demand	Anodyne	CPT2	44	35
O=C(O)[C@H]1CCCN1C(=O)CCc1nc[nH]n1	ZINC000819231721	BB	On-Demand	Anodyne	PREP	79	42
O=C(O)[C@H]1CCCN1C(=O)CCc1nc[nH]n1	ZINC000819231721	BB	On-Demand	Anodyne	MVD	15	46
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc[nH]n1	ZINC000819231722	BB	On-Demand	Anodyne	ACE	61	53
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc[nH]n1	ZINC000819231722	BB	On-Demand	Anodyne	PRCP	16	41
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc[nH]n1	ZINC000819231722	BB	On-Demand	Anodyne	CPT1A	68	39
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc[nH]n1	ZINC000819231722	BB	On-Demand	Anodyne	CPT2	44	35
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc[nH]n1	ZINC000819231722	BB	On-Demand	Anodyne	PREP	79	42
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc[nH]n1	ZINC000819231722	BB	On-Demand	Anodyne	MVD	15	46
O=C(O)[C@H]1CCCN1C(=O)Nc1cnc(-c2ccccc2)nc1	ZINC000819231723	DE	On-Demand	Anodyne	ACE	58	46
O=C(O)[C@H]1CCCN1C(=O)Nc1cnc(-c2ccccc2)nc1	ZINC000819231723	DE	On-Demand	Anodyne	FKBP1A	22	46
O=C(O)[C@H]1CCCN1C(=O)Nc1cnc(-c2ccccc2)nc1	ZINC000819231723	DE	On-Demand	Anodyne	UL80	41	39
O=C(O)[C@H]1CCCN1C(=O)Nc1cnc(-c2ccccc2)nc1	ZINC000819231723	DE	On-Demand	Anodyne	PREP	98	41
O=C(O)[C@H]1CCCN1C(=O)Nc1cnc(-c2ccccc2)nc1	ZINC000819231723	DE	On-Demand	Anodyne	ACE2	18	40
O=C(O)[C@@H]1CCCN1C(=O)Nc1cnc(-c2ccccc2)nc1	ZINC000819231724	DE	On-Demand	Anodyne	ACE	58	46
O=C(O)[C@@H]1CCCN1C(=O)Nc1cnc(-c2ccccc2)nc1	ZINC000819231724	DE	On-Demand	Anodyne	FKBP1A	22	46
O=C(O)[C@@H]1CCCN1C(=O)Nc1cnc(-c2ccccc2)nc1	ZINC000819231724	DE	On-Demand	Anodyne	UL80	41	39
O=C(O)[C@@H]1CCCN1C(=O)Nc1cnc(-c2ccccc2)nc1	ZINC000819231724	DE	On-Demand	Anodyne	PREP	98	41
O=C(O)[C@@H]1CCCN1C(=O)Nc1cnc(-c2ccccc2)nc1	ZINC000819231724	DE	On-Demand	Anodyne	ACE2	18	40
O=C(O)[C@H]1CCCN1C(=O)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000819231725	EF	On-Demand	Anodyne	ACE	46	40
O=C(O)[C@H]1CCCN1C(=O)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000819231725	EF	On-Demand	Anodyne	PREP	73	37
O=C(O)[C@H]1CCCN1C(=O)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000819231725	EF	On-Demand	Anodyne	CDK5	50	39
O=C(O)[C@@H]1CCCN1C(=O)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000819231726	EF	On-Demand	Anodyne	ACE	46	40
O=C(O)[C@@H]1CCCN1C(=O)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000819231726	EF	On-Demand	Anodyne	PREP	73	37
O=C(O)[C@@H]1CCCN1C(=O)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000819231726	EF	On-Demand	Anodyne	CDK5	50	39
O=C(O)[C@H]1CCCN1C(=O)CCc1nc(O)c2c3c(sc2n1)CCCC3	ZINC000819231729	GE	On-Demand	Anodyne	ACE	21	41
O=C(O)[C@H]1CCCN1C(=O)CCc1nc(O)c2c3c(sc2n1)CCCC3	ZINC000819231729	GE	On-Demand	Anodyne	PREP	56	36
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc(O)c2c3c(sc2n1)CCCC3	ZINC000819231730	GE	On-Demand	Anodyne	ACE	21	41
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc(O)c2c3c(sc2n1)CCCC3	ZINC000819231730	GE	On-Demand	Anodyne	PREP	56	36
O=C(O)[C@H]1CCCN1C(=O)Cn1c(=O)cnc2ccccc21	ZINC000819231731	DC	On-Demand	Anodyne	ACE	59	46
O=C(O)[C@H]1CCCN1C(=O)Cn1c(=O)cnc2ccccc21	ZINC000819231731	DC	On-Demand	Anodyne	MME	18	41
O=C(O)[C@H]1CCCN1C(=O)Cn1c(=O)cnc2ccccc21	ZINC000819231731	DC	On-Demand	Anodyne	CPT1A	90	41
O=C(O)[C@H]1CCCN1C(=O)Cn1c(=O)cnc2ccccc21	ZINC000819231731	DC	On-Demand	Anodyne	CPT2	48	38
O=C(O)[C@H]1CCCN1C(=O)Cn1c(=O)cnc2ccccc21	ZINC000819231731	DC	On-Demand	Anodyne	UTS2R	36	51
O=C(O)[C@H]1CCCN1C(=O)Cn1c(=O)cnc2ccccc21	ZINC000819231731	DC	On-Demand	Anodyne	PREP	113	39
O=C(O)[C@H]1CCCN1C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000819231732	EC	On-Demand	Anodyne	ACE	50	38
O=C(O)[C@H]1CCCN1C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000819231732	EC	On-Demand	Anodyne	FKBP1A	24	48
O=C(O)[C@H]1CCCN1C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000819231732	EC	On-Demand	Anodyne	PREP	51	39
O=C(O)[C@@H]1CCCN1C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000819231733	EC	On-Demand	Anodyne	ACE	50	38
O=C(O)[C@@H]1CCCN1C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000819231733	EC	On-Demand	Anodyne	FKBP1A	24	48
O=C(O)[C@@H]1CCCN1C(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000819231733	EC	On-Demand	Anodyne	PREP	51	39
O=C(O)[C@H]1CCCN1C(=O)COC/C=C\c1ccccc1	ZINC000819231734	CD	On-Demand	Anodyne	ACE	63	47
O=C(O)[C@H]1CCCN1C(=O)COC/C=C\c1ccccc1	ZINC000819231734	CD	On-Demand	Anodyne	SLC6A1	45	35
O=C(O)[C@H]1CCCN1C(=O)COC/C=C\c1ccccc1	ZINC000819231734	CD	On-Demand	Anodyne	MME	15	42
O=C(O)[C@H]1CCCN1C(=O)COC/C=C\c1ccccc1	ZINC000819231734	CD	On-Demand	Anodyne	CPT1A	68	41
O=C(O)[C@H]1CCCN1C(=O)COC/C=C\c1ccccc1	ZINC000819231734	CD	On-Demand	Anodyne	CPT2	47	40
O=C(O)[C@H]1CCCN1C(=O)COC/C=C\c1ccccc1	ZINC000819231734	CD	On-Demand	Anodyne	PREP	100	42
O=C(O)[C@H]1CCCN1C(=O)COC/C=C\c1ccccc1	ZINC000819231734	CD	On-Demand	Anodyne	MVD	15	46
O=C(O)[C@@H]1CCCN1C(=O)COC/C=C/c1ccccc1	ZINC000819231735	CD	On-Demand	Anodyne	ACE	63	47
O=C(O)[C@@H]1CCCN1C(=O)COC/C=C/c1ccccc1	ZINC000819231735	CD	On-Demand	Anodyne	SLC6A1	45	35
O=C(O)[C@@H]1CCCN1C(=O)COC/C=C/c1ccccc1	ZINC000819231735	CD	On-Demand	Anodyne	MME	15	42
O=C(O)[C@@H]1CCCN1C(=O)COC/C=C/c1ccccc1	ZINC000819231735	CD	On-Demand	Anodyne	CPT1A	68	41
O=C(O)[C@@H]1CCCN1C(=O)COC/C=C/c1ccccc1	ZINC000819231735	CD	On-Demand	Anodyne	CPT2	47	40
O=C(O)[C@@H]1CCCN1C(=O)COC/C=C/c1ccccc1	ZINC000819231735	CD	On-Demand	Anodyne	PREP	100	42
O=C(O)[C@@H]1CCCN1C(=O)COC/C=C/c1ccccc1	ZINC000819231735	CD	On-Demand	Anodyne	MVD	15	46
O=C(O)[C@H]1CCCN1C(=O)COC/C=C/c1ccccc1	ZINC000819231736	CD	On-Demand	Anodyne	ACE	63	47
O=C(O)[C@H]1CCCN1C(=O)COC/C=C/c1ccccc1	ZINC000819231736	CD	On-Demand	Anodyne	SLC6A1	45	35
O=C(O)[C@H]1CCCN1C(=O)COC/C=C/c1ccccc1	ZINC000819231736	CD	On-Demand	Anodyne	MME	15	42
O=C(O)[C@H]1CCCN1C(=O)COC/C=C/c1ccccc1	ZINC000819231736	CD	On-Demand	Anodyne	CPT1A	68	41
O=C(O)[C@H]1CCCN1C(=O)COC/C=C/c1ccccc1	ZINC000819231736	CD	On-Demand	Anodyne	CPT2	47	40
O=C(O)[C@H]1CCCN1C(=O)COC/C=C/c1ccccc1	ZINC000819231736	CD	On-Demand	Anodyne	PREP	100	42
O=C(O)[C@H]1CCCN1C(=O)COC/C=C/c1ccccc1	ZINC000819231736	CD	On-Demand	Anodyne	MVD	15	46
O=C(O)[C@@H]1CCCN1C(=O)COC/C=C\c1ccccc1	ZINC000819231737	CD	On-Demand	Anodyne	ACE	63	47
O=C(O)[C@@H]1CCCN1C(=O)COC/C=C\c1ccccc1	ZINC000819231737	CD	On-Demand	Anodyne	SLC6A1	45	35
O=C(O)[C@@H]1CCCN1C(=O)COC/C=C\c1ccccc1	ZINC000819231737	CD	On-Demand	Anodyne	MME	15	42
O=C(O)[C@@H]1CCCN1C(=O)COC/C=C\c1ccccc1	ZINC000819231737	CD	On-Demand	Anodyne	CPT1A	68	41
O=C(O)[C@@H]1CCCN1C(=O)COC/C=C\c1ccccc1	ZINC000819231737	CD	On-Demand	Anodyne	CPT2	47	40
O=C(O)[C@@H]1CCCN1C(=O)COC/C=C\c1ccccc1	ZINC000819231737	CD	On-Demand	Anodyne	PREP	100	42
O=C(O)[C@@H]1CCCN1C(=O)COC/C=C\c1ccccc1	ZINC000819231737	CD	On-Demand	Anodyne	MVD	15	46
O=C(O)[C@H]1CCCN1C(=O)Cc1cc(F)cc2c1OCOC2	ZINC000819231738	DD	On-Demand	Anodyne	ACE	47	42
O=C(O)[C@H]1CCCN1C(=O)Cc1cc(F)cc2c1OCOC2	ZINC000819231738	DD	On-Demand	Anodyne	CPT2	41	35
O=C(O)[C@H]1CCCN1C(=O)Nc1ccc2oc(=O)ccc2c1	ZINC000819231739	DD	On-Demand	Anodyne	ACE	43	37
O=C(O)[C@@H]1CCCN1C(=O)Nc1ccc2oc(=O)ccc2c1	ZINC000819231740	DD	On-Demand	Anodyne	ACE	43	37
O=C(O)[C@H]1CCCN1C(=O)CCc1nc(-c2nc[nH]n2)no1	ZINC000819231741	DB	On-Demand	Anodyne	ACE	32	43
O=C(O)[C@H]1CCCN1C(=O)CCc1nc(-c2nc[nH]n2)no1	ZINC000819231741	DB	On-Demand	Anodyne	CPT1A	72	36
O=C(O)[C@H]1CCCN1C(=O)CCc1nc(-c2nc[nH]n2)no1	ZINC000819231741	DB	On-Demand	Anodyne	PREP	41	36
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc(-c2nc[nH]n2)no1	ZINC000819231742	DB	On-Demand	Anodyne	ACE	32	43
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc(-c2nc[nH]n2)no1	ZINC000819231742	DB	On-Demand	Anodyne	CPT1A	72	36
O=C(O)[C@@H]1CCCN1C(=O)CCc1nc(-c2nc[nH]n2)no1	ZINC000819231742	DB	On-Demand	Anodyne	PREP	41	36
O=C(O)[C@H]1CCCN1C(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1	ZINC000819231743	GC	On-Demand	Anodyne	PREP	47	34
O=C(O)[C@H]1CCCN1C(=O)Cc1ccc(-n2cccc2)cc1	ZINC000819231744	CE	On-Demand	Anodyne	F2	18	40
O=C(O)[C@H]1CCCN1C(=O)Cc1ccc(-n2cccc2)cc1	ZINC000819231744	CE	On-Demand	Anodyne	ACE	63	49
O=C(O)[C@H]1CCCN1C(=O)Cc1ccc(-n2cccc2)cc1	ZINC000819231744	CE	On-Demand	Anodyne	FKBP1A	47	37
O=C(O)[C@H]1CCCN1C(=O)Cc1ccc(-n2cccc2)cc1	ZINC000819231744	CE	On-Demand	Anodyne	OPRK1	18	43
O=C(O)[C@H]1CCCN1C(=O)Cc1ccc(-n2cccc2)cc1	ZINC000819231744	CE	On-Demand	Anodyne	MME	16	43
O=C(O)[C@H]1CCCN1C(=O)Cc1ccc(-n2cccc2)cc1	ZINC000819231744	CE	On-Demand	Anodyne	PREP	105	44
O=C(O)[C@H]1CCCN1C(=O)CSc1nccc2ccccc12	ZINC000819231745	DE	On-Demand	Anodyne	ACE	53	45
O=C(O)[C@H]1CCCN1C(=O)CSc1nccc2ccccc12	ZINC000819231745	DE	On-Demand	Anodyne	HCRTR1	21	41
O=C(O)[C@H]1CCCN1C(=O)CSc1nccc2ccccc12	ZINC000819231745	DE	On-Demand	Anodyne	CPT1A	50	39
O=C(O)[C@H]1CCCN1C(=O)CSc1nccc2ccccc12	ZINC000819231745	DE	On-Demand	Anodyne	CPT2	40	38
O=C(O)[C@H]1CCCN1C(=O)CSc1nccc2ccccc12	ZINC000819231745	DE	On-Demand	Anodyne	PREP	94	42
O=C(O)[C@H]1CCCN1C(=O)CSc1nccc2ccccc12	ZINC000819231745	DE	On-Demand	Anodyne	HCRTR2	20	41
O=C(O)[C@@H]1CCCN1C(=O)CSc1nccc2ccccc12	ZINC000819231746	DE	On-Demand	Anodyne	ACE	53	45
O=C(O)[C@@H]1CCCN1C(=O)CSc1nccc2ccccc12	ZINC000819231746	DE	On-Demand	Anodyne	HCRTR1	21	41
O=C(O)[C@@H]1CCCN1C(=O)CSc1nccc2ccccc12	ZINC000819231746	DE	On-Demand	Anodyne	CPT1A	50	39
O=C(O)[C@@H]1CCCN1C(=O)CSc1nccc2ccccc12	ZINC000819231746	DE	On-Demand	Anodyne	CPT2	40	38
O=C(O)[C@@H]1CCCN1C(=O)CSc1nccc2ccccc12	ZINC000819231746	DE	On-Demand	Anodyne	PREP	94	42
O=C(O)[C@@H]1CCCN1C(=O)CSc1nccc2ccccc12	ZINC000819231746	DE	On-Demand	Anodyne	HCRTR2	20	41
O=C(O)[C@H]1CCCN1C(=O)Nc1cccc(N2CCOC2=O)c1	ZINC000819231747	DD	On-Demand	Anodyne	ACE	45	39
O=C(O)[C@@H]1CCCN1C(=O)Nc1cccc(N2CCOC2=O)c1	ZINC000819231748	DD	On-Demand	Anodyne	ACE	45	39
C=CCCn1cc(C(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)nn1	ZINC000819231749	FH	On-Demand	Mild	RBP4	41	39
C=CCCn1cc(C(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)nn1	ZINC000819231750	FH	On-Demand	Mild	RBP4	41	39
O[C@@H](CNCCc1cn2c(n1)SCC2)c1ccccc1	ZINC000819231782	CD	On-Demand	Anodyne	ADRB2	17	43
O[C@@H](CNCCc1cn2c(n1)SCC2)c1ccccc1	ZINC000819231782	CD	On-Demand	Anodyne	ADRB3	61	39
O[C@H](CNCCc1cn2c(n1)SCC2)c1ccccc1	ZINC000819231783	CD	On-Demand	Anodyne	ADRB2	17	43
O[C@H](CNCCc1cn2c(n1)SCC2)c1ccccc1	ZINC000819231783	CD	On-Demand	Anodyne	ADRB3	61	39
O=C(Cc1nsc2ccccc12)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819231818	FG	On-Demand	Anodyne	PRKDC	69	33
O=C(Cc1nsc2ccccc12)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819231818	FG	On-Demand	Anodyne	NPY2R	88	42
O=C(Cc1nsc2ccccc12)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819231818	FG	On-Demand	Anodyne	PIK3CD	20	46
O=C(Cc1nsc2ccccc12)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819231818	FG	On-Demand	Anodyne	MAPK9	24	40
O=C(Cc1nsc2ccccc12)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819231818	FG	On-Demand	Anodyne	MAPK10	21	40
O=C(Cc1nsc2ccccc12)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819231818	FG	On-Demand	Anodyne	PIK3CB	31	46
O=C(Cc1nsc2ccccc12)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819231818	FG	On-Demand	Anodyne	IMDH_CRYPV	29	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cn3c(n2)SCC3)cc1	ZINC000819231821	FD	On-Demand	Anodyne	ADRB3	53	37
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cn3c(n2)SCC3)cc1	ZINC000819231822	FD	On-Demand	Anodyne	ADRB3	53	37
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)C(C)(C)c1ccccc1	ZINC000819231835	CG	On-Demand	Anodyne	AMY2	45	32
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)C(C)(C)c1ccccc1	ZINC000819231836	CG	On-Demand	Anodyne	AMY2	45	32
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)C(C)(C)c1ccccc1	ZINC000819231837	CG	On-Demand	Anodyne	AMY2	45	32
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)C(C)(C)c1ccccc1	ZINC000819231838	CG	On-Demand	Anodyne	AMY2	45	32
C[C@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCO[C@@H]1C1CC1	ZINC000819231863	DG	On-Demand	Anodyne	CYP3A4	42	34
C[C@]1(CNC[C@H](O)c2cccc(Cl)c2)CCO[C@@H]1C1CC1	ZINC000819231864	DG	On-Demand	Anodyne	CYP3A4	42	34
C[C@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCO[C@H]1C1CC1	ZINC000819231865	DG	On-Demand	Anodyne	CYP3A4	42	34
C[C@]1(CNC[C@H](O)c2cccc(Cl)c2)CCO[C@H]1C1CC1	ZINC000819231866	DG	On-Demand	Anodyne	CYP3A4	42	34
CON(C)C(=O)c1ccc(NC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819231893	GG	On-Demand	Anodyne	MTNR1A	18	44
CON(C)C(=O)c1ccc(NC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819231893	GG	On-Demand	Anodyne	MTNR1B	24	44
Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819231896	FI	On-Demand	Anodyne	MAOB	30	41
Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819231896	FI	On-Demand	Anodyne	FFAR1	48	39
Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819231897	FI	On-Demand	Anodyne	MAOB	30	41
Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819231897	FI	On-Demand	Anodyne	FFAR1	48	39
Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819231898	FI	On-Demand	Anodyne	MAOB	30	41
Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819231898	FI	On-Demand	Anodyne	FFAR1	48	39
Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819231899	FI	On-Demand	Anodyne	MAOB	30	41
Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819231899	FI	On-Demand	Anodyne	FFAR1	48	39
COCCOc1ncccc1NC(=O)C(F)=C1CCC1	ZINC000819231905	CE	On-Demand	Anodyne	P2RY1	41	38
COCCOc1ncccc1NC(=O)C(F)=C1CCC1	ZINC000819231905	CE	On-Demand	Anodyne	G2YM83_BOTF4	52	32
CN(CCOc1cccc(CNC(=O)C(F)=C2CCC2)c1)C1CCOCC1	ZINC000819231906	GG	On-Demand	Anodyne	PDS	42	34
C[C@]1(CNC[C@H](O)c2cccnc2)CCO[C@@H]1C1CC1	ZINC000819231936	CD	On-Demand	Anodyne	ADRB3	65	41
C[C@]1(CNC[C@@H](O)c2cccnc2)CCO[C@@H]1C1CC1	ZINC000819231937	CD	On-Demand	Anodyne	ADRB3	65	41
C[C@]1(CNC[C@H](O)c2cccnc2)CCO[C@H]1C1CC1	ZINC000819231938	CD	On-Demand	Anodyne	ADRB3	65	41
C[C@]1(CNC[C@@H](O)c2cccnc2)CCO[C@H]1C1CC1	ZINC000819231939	CD	On-Demand	Anodyne	ADRB3	65	41
CCOc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819231970	GG	On-Demand	Anodyne	ADRB2	48	45
CCOc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819231970	GG	On-Demand	Anodyne	ADRB1	56	45
CCOc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819231970	GG	On-Demand	Anodyne	ADRB3	41	44
CCOc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819231970	GG	On-Demand	Anodyne	ABCB1	15	42
CCOc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819231971	GG	On-Demand	Anodyne	ADRB2	48	45
CCOc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819231971	GG	On-Demand	Anodyne	ADRB1	56	45
CCOc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819231971	GG	On-Demand	Anodyne	ADRB3	41	44
CCOc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819231971	GG	On-Demand	Anodyne	ABCB1	15	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2c(F)cccc2F)CC1	ZINC000819231978	FD	On-Demand	Anodyne	L3MBTL3	53	36
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2c(F)cccc2F)CC1	ZINC000819231979	FD	On-Demand	Anodyne	L3MBTL3	53	36
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2c(F)cccc2F)CC1	ZINC000819231980	FD	On-Demand	Anodyne	L3MBTL3	53	36
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2c(F)cccc2F)CC1	ZINC000819231981	FD	On-Demand	Anodyne	L3MBTL3	53	36
O=[N+]([O-])c1cccc([C@@H](O)CNC2Cc3ccccc3C2)c1	ZINC000819231982	CE	On-Demand	Bother	ADRB3	21	44
O=[N+]([O-])c1cccc([C@H](O)CNC2Cc3ccccc3C2)c1	ZINC000819231983	CE	On-Demand	Bother	ADRB3	21	44
Cn1nccc1CCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819231991	EE	On-Demand	Anodyne	ADRB2	45	42
Cn1nccc1CCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819231991	EE	On-Demand	Anodyne	ADRB1	63	41
Cn1nccc1CCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819231991	EE	On-Demand	Anodyne	ADRB3	40	41
Cn1nccc1CCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819231991	EE	On-Demand	Anodyne	ABCB1	17	42
Cn1nccc1CCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819231992	EE	On-Demand	Anodyne	ADRB2	45	42
Cn1nccc1CCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819231992	EE	On-Demand	Anodyne	ADRB1	63	41
Cn1nccc1CCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819231992	EE	On-Demand	Anodyne	ADRB3	40	41
Cn1nccc1CCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819231992	EE	On-Demand	Anodyne	ABCB1	17	42
N#Cc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232005	FF	On-Demand	Mild	ADRB2	34	44
N#Cc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232005	FF	On-Demand	Mild	ADRB1	46	44
N#Cc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232005	FF	On-Demand	Mild	ADRB3	29	44
N#Cc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232006	FF	On-Demand	Mild	ADRB2	34	44
N#Cc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232006	FF	On-Demand	Mild	ADRB1	46	44
N#Cc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232006	FF	On-Demand	Mild	ADRB3	29	44
CSc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232010	GH	On-Demand	Anodyne	ADRB2	37	44
CSc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232010	GH	On-Demand	Anodyne	ADRB1	48	44
CSc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232010	GH	On-Demand	Anodyne	ADRB3	35	44
CSc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232011	GH	On-Demand	Anodyne	ADRB2	37	44
CSc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232011	GH	On-Demand	Anodyne	ADRB1	48	44
CSc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232011	GH	On-Demand	Anodyne	ADRB3	35	44
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)CC1CCCC1	ZINC000819232019	DG	On-Demand	Anodyne	OPRL1	17	45
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)CC1CCCC1	ZINC000819232021	DG	On-Demand	Anodyne	OPRL1	17	45
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232032	GG	On-Demand	Anodyne	ADRB2	44	42
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232032	GG	On-Demand	Anodyne	ADRB1	66	42
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232032	GG	On-Demand	Anodyne	ADRB3	50	42
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232032	GG	On-Demand	Anodyne	ABCB1	26	52
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232034	GG	On-Demand	Anodyne	ADRB2	44	42
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232034	GG	On-Demand	Anodyne	ADRB1	66	42
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232034	GG	On-Demand	Anodyne	ADRB3	50	42
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232034	GG	On-Demand	Anodyne	ABCB1	26	52
Cc1c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n[nH]c1C1CC1	ZINC000819232037	FG	On-Demand	Mild	PAPA1_CARPA	34	41
Cc1c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n[nH]c1C1CC1	ZINC000819232038	FG	On-Demand	Mild	PAPA1_CARPA	34	41
CON(C)C(=O)c1ccc(NC(=O)c2cc(C)ccc2C2CC2)cc1	ZINC000819232041	EH	On-Demand	Anodyne	AVPR2	28	40
CON(C)C(=O)c1ccc(NC(=O)c2cc(C)ccc2C2CC2)cc1	ZINC000819232041	EH	On-Demand	Anodyne	KCNK3	73	38
CON(C)C(=O)c1ccc(NC(=O)c2cc(C)ccc2C2CC2)cc1	ZINC000819232041	EH	On-Demand	Anodyne	KCNK9	59	38
CCOCCCn1c(NC(=O)/C=C/[C@H]2CCCO2)nc2ccccc21	ZINC000819232045	EG	On-Demand	Anodyne	HRH1	21	40
CCOCCCn1c(NC(=O)/C=C\[C@H]2CCCO2)nc2ccccc21	ZINC000819232047	EG	On-Demand	Anodyne	HRH1	21	40
CCOCCCn1c(NC(=O)/C=C/[C@@H]2CCCO2)nc2ccccc21	ZINC000819232050	EG	On-Demand	Anodyne	HRH1	21	40
CCOCCCn1c(NC(=O)/C=C\[C@@H]2CCCO2)nc2ccccc21	ZINC000819232052	EG	On-Demand	Anodyne	HRH1	21	40
CN(C[C@@H](O)CNC1CCC(O)(c2ccccc2)CC1)C1CC1	ZINC000819232064	DD	On-Demand	Anodyne	OPRL1	20	44
CN(C[C@H](O)CNC1CCC(O)(c2ccccc2)CC1)C1CC1	ZINC000819232066	DD	On-Demand	Anodyne	OPRL1	20	44
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232081	GF	On-Demand	Anodyne	ADRB3	32	40
CS(=O)(=O)c1ccc([C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232083	GF	On-Demand	Anodyne	ADRB3	32	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819232103	GF	On-Demand	Anodyne	NPY2R	91	41
CON(C)C(=O)CCNCc1cc2cc(Br)ccc2[nH]1	ZINC000819232104	EE	On-Demand	Anodyne	PYGL	16	41
O[C@@H](CNCCc1cn2c(n1)SCC2)c1cccc(F)c1	ZINC000819232109	DD	On-Demand	Anodyne	ADRB1	16	41
O[C@@H](CNCCc1cn2c(n1)SCC2)c1cccc(F)c1	ZINC000819232109	DD	On-Demand	Anodyne	ADRB3	39	41
O[C@H](CNCCc1cn2c(n1)SCC2)c1cccc(F)c1	ZINC000819232110	DD	On-Demand	Anodyne	ADRB1	16	41
O[C@H](CNCCc1cn2c(n1)SCC2)c1cccc(F)c1	ZINC000819232110	DD	On-Demand	Anodyne	ADRB3	39	41
CON(C)C(=O)CCNC[C@@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000819232130	EE	On-Demand	Anodyne	CCR2	15	41
CON(C)C(=O)CCNC[C@H](c1cccc(C(F)(F)F)c1)N(C)C	ZINC000819232131	EE	On-Demand	Anodyne	CCR2	15	41
COCCOc1ncccc1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819232144	CD	On-Demand	Anodyne	G2YM83_BOTF4	44	32
COCCOc1ncccc1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819232145	CD	On-Demand	Anodyne	G2YM83_BOTF4	44	32
COCCOc1ncccc1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819232146	CD	On-Demand	Anodyne	G2YM83_BOTF4	44	32
COCCOc1ncccc1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819232147	CD	On-Demand	Anodyne	G2YM83_BOTF4	44	32
C=CCC1(C(=O)Nc2ccc(N3CCOCC3)c(F)c2)CCOCC1	ZINC000819232167	EF	On-Demand	Mild	NPY2R	74	40
C=CCC1(C(=O)Nc2ccc(N3CCOCC3)c(F)c2)CCOCC1	ZINC000819232167	EF	On-Demand	Mild	STAT6	40	33
O[C@@H](CNCCc1cn2c(n1)SCC2)c1cccc(Cl)c1	ZINC000819232172	DF	On-Demand	Anodyne	ADRB1	39	48
O[C@@H](CNCCc1cn2c(n1)SCC2)c1cccc(Cl)c1	ZINC000819232172	DF	On-Demand	Anodyne	ADRB3	64	48
O[C@@H](CNCCc1cn2c(n1)SCC2)c1cccc(Cl)c1	ZINC000819232172	DF	On-Demand	Anodyne	CYP3A4	40	34
O[C@H](CNCCc1cn2c(n1)SCC2)c1cccc(Cl)c1	ZINC000819232173	DF	On-Demand	Anodyne	ADRB1	39	48
O[C@H](CNCCc1cn2c(n1)SCC2)c1cccc(Cl)c1	ZINC000819232173	DF	On-Demand	Anodyne	ADRB3	64	48
O[C@H](CNCCc1cn2c(n1)SCC2)c1cccc(Cl)c1	ZINC000819232173	DF	On-Demand	Anodyne	CYP3A4	40	34
Cn1nccc1CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819232217	CE	On-Demand	Anodyne	ADRB2	23	40
Cn1nccc1CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819232217	CE	On-Demand	Anodyne	ADRB1	18	40
Cn1nccc1CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819232217	CE	On-Demand	Anodyne	ADRB3	43	40
Cn1nccc1CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819232219	CE	On-Demand	Anodyne	ADRB2	23	40
Cn1nccc1CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819232219	CE	On-Demand	Anodyne	ADRB1	18	40
Cn1nccc1CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819232219	CE	On-Demand	Anodyne	ADRB3	43	40
CCOC(=O)C1CCC(O)(CNC2CCC(O)(c3ccccc3)CC2)CC1	ZINC000819232225	GF	On-Demand	Anodyne	TIMP3	72	33
O=C(Nc1ccc(N2CCOCC2)c(F)c1)C(F)=C1CCC1	ZINC000819232237	DG	On-Demand	Anodyne	NPY2R	75	39
O=C(Nc1ccc(N2CCOCC2)c(F)c1)c1cc2c(cn1)OCCO2	ZINC000819232257	FE	On-Demand	Anodyne	NPY2R	82	38
O=C(Nc1ccc(N2CCOCC2)c(F)c1)c1cc2c(cn1)OCCO2	ZINC000819232257	FE	On-Demand	Anodyne	MAPK9	34	47
O=C(Nc1ccc(N2CCOCC2)c(F)c1)c1cc2c(cn1)OCCO2	ZINC000819232257	FE	On-Demand	Anodyne	MAPK10	36	47
O=C(Nc1ccc(N2CCOCC2)c(F)c1)c1cc2c(cn1)OCCO2	ZINC000819232257	FE	On-Demand	Anodyne	STAT6	49	33
O=C(Nc1ccc(N2CCOCC2)c(F)c1)c1cc2c(cn1)OCCO2	ZINC000819232257	FE	On-Demand	Anodyne	DGAT1	21	52
C=CCCn1cc(C(=O)Nc2ccc(N3CCOCC3)c(F)c2)nn1	ZINC000819232259	EE	On-Demand	Mild	NPY2R	70	35
C=CCCn1cc(C(=O)Nc2ccc(N3CCOCC3)c(F)c2)nn1	ZINC000819232259	EE	On-Demand	Mild	MAPK9	24	40
C=CCCn1cc(C(=O)Nc2ccc(N3CCOCC3)c(F)c2)nn1	ZINC000819232259	EE	On-Demand	Mild	MAPK10	22	40
C=CCCn1cc(C(=O)Nc2ccc(N3CCOCC3)c(F)c2)nn1	ZINC000819232259	EE	On-Demand	Mild	PIK3CB	15	40
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)c1ccccc1Cl	ZINC000819232283	EH	On-Demand	Anodyne	OPRL1	54	51
COc1ccccc1COC[C@@H](O)CNC1CCC(O)(c2ccccc2)CC1	ZINC000819232288	GF	On-Demand	Anodyne	ADRB2	15	41
COc1ccccc1COC[C@H](O)CNC1CCC(O)(c2ccccc2)CC1	ZINC000819232289	GF	On-Demand	Anodyne	ADRB2	15	41
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNC2Cc3ccccc3C2)CC1	ZINC000819232297	FF	On-Demand	Anodyne	PREP	23	40
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNC2Cc3ccccc3C2)CC1	ZINC000819232297	FF	On-Demand	Anodyne	GPR119	36	41
CC(C)(C)OC(=O)N1CCC[C@](O)(CNC2Cc3ccccc3C2)CC1	ZINC000819232298	FF	On-Demand	Anodyne	PREP	23	40
CC(C)(C)OC(=O)N1CCC[C@](O)(CNC2Cc3ccccc3C2)CC1	ZINC000819232298	FF	On-Demand	Anodyne	GPR119	36	41
O=C([C@H]1CCCCN1C(=O)C(F)=C1CCC1)N1CCOCC1	ZINC000819232299	DD	On-Demand	Anodyne	PREP	42	41
O=C([C@@H]1CCCCN1C(=O)C(F)=C1CCC1)N1CCOCC1	ZINC000819232300	DD	On-Demand	Anodyne	PREP	42	41
O[C@@H](CNC1Cc2ccccc2C1)c1ccc(F)c(Br)c1	ZINC000819232309	FG	On-Demand	Anodyne	ADRB3	19	42
O[C@H](CNC1Cc2ccccc2C1)c1ccc(F)c(Br)c1	ZINC000819232310	FG	On-Demand	Anodyne	ADRB3	19	42
Cn1nccc1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819232317	CD	On-Demand	Bother	ADRB1	40	38
Cn1nccc1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819232317	CD	On-Demand	Bother	ADRB3	112	38
Cn1nccc1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819232318	CD	On-Demand	Bother	ADRB1	40	38
Cn1nccc1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819232318	CD	On-Demand	Bother	ADRB3	112	38
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)Cc1ccc(C(F)(F)F)cc1	ZINC000819232328	GI	On-Demand	Anodyne	TACR1	20	40
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)Cc1ccc(C(F)(F)F)cc1	ZINC000819232329	GI	On-Demand	Anodyne	TACR1	20	40
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)COCc1cccs1	ZINC000819232330	FG	On-Demand	Anodyne	ADRB2	16	40
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)COCc1cccs1	ZINC000819232330	FG	On-Demand	Anodyne	ADRB3	15	40
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)COCc1cccs1	ZINC000819232331	FG	On-Demand	Anodyne	ADRB2	16	40
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)COCc1cccs1	ZINC000819232331	FG	On-Demand	Anodyne	ADRB3	15	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1CCC(O)(c2ccccc2)CC1	ZINC000819232332	GF	On-Demand	Bother	ADRB2	26	44
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1CCC(O)(c2ccccc2)CC1	ZINC000819232332	GF	On-Demand	Bother	ADRB1	21	42
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1CCC(O)(c2ccccc2)CC1	ZINC000819232332	GF	On-Demand	Bother	ABCB1	18	47
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1CCC(O)(c2ccccc2)CC1	ZINC000819232333	GF	On-Demand	Bother	ADRB2	26	44
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1CCC(O)(c2ccccc2)CC1	ZINC000819232333	GF	On-Demand	Bother	ADRB1	21	42
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1CCC(O)(c2ccccc2)CC1	ZINC000819232333	GF	On-Demand	Bother	ABCB1	18	47
Cn1nccc1CCNCCC(=O)Nc1ccc(Cl)cc1	ZINC000819232340	DE	On-Demand	Anodyne	HTR2A	21	46
Cn1nccc1CCNCCC(=O)Nc1ccc(Cl)cc1	ZINC000819232340	DE	On-Demand	Anodyne	IMDH_CRYPV	26	41
O=C(c1ccccc1NCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819232349	EH	On-Demand	Anodyne	GRIN2B	49	49
O=C(c1ccccc1NCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819232349	EH	On-Demand	Anodyne	PREP	31	40
O=C(c1ccccc1NCc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819232349	EH	On-Demand	Anodyne	L3MBTL3	43	54
O=C(c1ccccc1NCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819232350	EH	On-Demand	Anodyne	GRIN2B	49	49
O=C(c1ccccc1NCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819232350	EH	On-Demand	Anodyne	PREP	31	40
O=C(c1ccccc1NCc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819232350	EH	On-Demand	Anodyne	L3MBTL3	43	54
Cc1ccc(C(=O)N2CCC[C@H](CO)CC2)cc1-n1cccc1	ZINC000819232367	DG	On-Demand	Anodyne	L3MBTL3	82	39
Cc1ccc(C(=O)N2CCC[C@@H](CO)CC2)cc1-n1cccc1	ZINC000819232368	DG	On-Demand	Anodyne	L3MBTL3	82	39
O=C(c1cc(S(=O)(=O)N2CCCC2)ccc1Br)N1CCC[C@H](CO)CC1	ZINC000819232381	IE	On-Demand	Anodyne	L3MBTL3	61	43
O=C(c1cc(S(=O)(=O)N2CCCC2)ccc1Br)N1CCC[C@@H](CO)CC1	ZINC000819232382	IE	On-Demand	Anodyne	L3MBTL3	61	43
O=C([C@@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1)N1CCC[C@H](CO)CC1	ZINC000819232383	HG	On-Demand	Anodyne	CPT2	43	42
O=C([C@@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1)N1CCC[C@H](CO)CC1	ZINC000819232383	HG	On-Demand	Anodyne	PREP	78	44
O=C([C@@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1)N1CCC[C@H](CO)CC1	ZINC000819232383	HG	On-Demand	Anodyne	WNT3	43	34
O=C([C@@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1)N1CCC[C@@H](CO)CC1	ZINC000819232384	HG	On-Demand	Anodyne	CPT2	43	42
O=C([C@@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1)N1CCC[C@@H](CO)CC1	ZINC000819232384	HG	On-Demand	Anodyne	PREP	78	44
O=C([C@@H]1CCCCN1C(=O)/C=C\c1ccc(Cl)cc1)N1CCC[C@@H](CO)CC1	ZINC000819232384	HG	On-Demand	Anodyne	WNT3	43	34
O=C([C@@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1)N1CCC[C@H](CO)CC1	ZINC000819232385	HG	On-Demand	Anodyne	CPT2	43	42
O=C([C@@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1)N1CCC[C@H](CO)CC1	ZINC000819232385	HG	On-Demand	Anodyne	PREP	78	44
O=C([C@@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1)N1CCC[C@H](CO)CC1	ZINC000819232385	HG	On-Demand	Anodyne	WNT3	43	34
O=C([C@@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1)N1CCC[C@@H](CO)CC1	ZINC000819232386	HG	On-Demand	Anodyne	CPT2	43	42
O=C([C@@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1)N1CCC[C@@H](CO)CC1	ZINC000819232386	HG	On-Demand	Anodyne	PREP	78	44
O=C([C@@H]1CCCCN1C(=O)/C=C/c1ccc(Cl)cc1)N1CCC[C@@H](CO)CC1	ZINC000819232386	HG	On-Demand	Anodyne	WNT3	43	34
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1CCC[C@@H](CO)CC1	ZINC000819232389	GD	On-Demand	Anodyne	CCR8	89	37
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1CCC[C@@H](CO)CC1	ZINC000819232389	GD	On-Demand	Anodyne	SFRP1	126	39
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1CCC[C@@H](CO)CC1	ZINC000819232389	GD	On-Demand	Anodyne	WNT3	86	37
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1CCC[C@H](CO)CC1	ZINC000819232390	GD	On-Demand	Anodyne	CCR8	89	37
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1CCC[C@H](CO)CC1	ZINC000819232390	GD	On-Demand	Anodyne	SFRP1	126	39
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1CCC[C@H](CO)CC1	ZINC000819232390	GD	On-Demand	Anodyne	WNT3	86	37
O=C(c1ccc(N2CCOCC2)c(F)c1)N1CCC[C@H](CO)CC1	ZINC000819232399	ED	On-Demand	Anodyne	SLC6A9	28	48
O=C(c1ccc(N2CCOCC2)c(F)c1)N1CCC[C@H](CO)CC1	ZINC000819232399	ED	On-Demand	Anodyne	AKR1C3	24	40
O=C(c1ccc(N2CCOCC2)c(F)c1)N1CCC[C@H](CO)CC1	ZINC000819232399	ED	On-Demand	Anodyne	L3MBTL3	67	38
O=C(c1ccc(N2CCOCC2)c(F)c1)N1CCC[C@@H](CO)CC1	ZINC000819232400	ED	On-Demand	Anodyne	SLC6A9	28	48
O=C(c1ccc(N2CCOCC2)c(F)c1)N1CCC[C@@H](CO)CC1	ZINC000819232400	ED	On-Demand	Anodyne	AKR1C3	24	40
O=C(c1ccc(N2CCOCC2)c(F)c1)N1CCC[C@@H](CO)CC1	ZINC000819232400	ED	On-Demand	Anodyne	L3MBTL3	67	38
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N2CCC[C@H](CO)CC2)cc1OC	ZINC000819232409	IH	On-Demand	Anodyne	ACHE	28	44
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N2CCC[C@@H](CO)CC2)cc1OC	ZINC000819232410	IH	On-Demand	Anodyne	ACHE	28	44
O=C(c1ccnc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819232429	DE	On-Demand	Anodyne	SFRP1	40	37
O=C(c1ccnc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819232429	DE	On-Demand	Anodyne	L3MBTL3	73	38
O=C(c1ccnc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819232429	DE	On-Demand	Anodyne	HPGD	41	38
O=C(c1ccnc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819232430	DE	On-Demand	Anodyne	SFRP1	40	37
O=C(c1ccnc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819232430	DE	On-Demand	Anodyne	L3MBTL3	73	38
O=C(c1ccnc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819232430	DE	On-Demand	Anodyne	HPGD	41	38
CC(C)(C)OC(=O)N1CCC[C@H]1CCC(=O)N1CCC[C@@H](CO)CC1	ZINC000819232431	FF	On-Demand	Anodyne	PREP	16	46
CC(C)(C)OC(=O)N1CCC[C@H]1CCC(=O)N1CCC[C@H](CO)CC1	ZINC000819232432	FF	On-Demand	Anodyne	PREP	16	46
CC(C)(C)OC(=O)N1CCSC[C@@H]1CC(=O)N1CCC[C@@H](CO)CC1	ZINC000819232433	FE	On-Demand	Anodyne	PREP	15	40
CC(C)(C)OC(=O)N1CCSC[C@@H]1CC(=O)N1CCC[C@H](CO)CC1	ZINC000819232434	FE	On-Demand	Anodyne	PREP	15	40
CC(C)(C)OC(=O)N1CCSC[C@H]1CC(=O)N1CCC[C@@H](CO)CC1	ZINC000819232435	FE	On-Demand	Anodyne	PREP	15	40
CC(C)(C)OC(=O)N1CCSC[C@H]1CC(=O)N1CCC[C@H](CO)CC1	ZINC000819232436	FE	On-Demand	Anodyne	PREP	15	40
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CCC[C@H](CO)CC1	ZINC000819232439	HE	On-Demand	Anodyne	CNR2	18	67
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CCC[C@H](CO)CC1	ZINC000819232439	HE	On-Demand	Anodyne	EPHX2	25	43
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CCC[C@H](CO)CC1	ZINC000819232439	HE	On-Demand	Anodyne	L3MBTL3	91	44
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CCC[C@H](CO)CC1	ZINC000819232439	HE	On-Demand	Anodyne	HPGD	41	36
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819232440	HE	On-Demand	Anodyne	CNR2	18	67
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819232440	HE	On-Demand	Anodyne	EPHX2	25	43
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819232440	HE	On-Demand	Anodyne	L3MBTL3	91	44
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819232440	HE	On-Demand	Anodyne	HPGD	41	36
O=C(c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)N1CCC[C@H](CO)CC1	ZINC000819232445	HD	On-Demand	Anodyne	CNR2	19	53
O=C(c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)N1CCC[C@H](CO)CC1	ZINC000819232445	HD	On-Demand	Anodyne	L3MBTL3	64	38
O=C(c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819232446	HD	On-Demand	Anodyne	CNR2	19	53
O=C(c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819232446	HD	On-Demand	Anodyne	L3MBTL3	64	38
O[C@H](CNCCc1cn2c(n1)SCC2)c1cccnc1	ZINC000819232487	CD	On-Demand	Anodyne	ADRB2	26	45
O[C@H](CNCCc1cn2c(n1)SCC2)c1cccnc1	ZINC000819232487	CD	On-Demand	Anodyne	ADRB1	29	43
O[C@H](CNCCc1cn2c(n1)SCC2)c1cccnc1	ZINC000819232487	CD	On-Demand	Anodyne	ADRB3	107	48
O[C@@H](CNCCc1cn2c(n1)SCC2)c1cccnc1	ZINC000819232488	CD	On-Demand	Anodyne	ADRB2	26	45
O[C@@H](CNCCc1cn2c(n1)SCC2)c1cccnc1	ZINC000819232488	CD	On-Demand	Anodyne	ADRB1	29	43
O[C@@H](CNCCc1cn2c(n1)SCC2)c1cccnc1	ZINC000819232488	CD	On-Demand	Anodyne	ADRB3	107	48
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819232518	FF	On-Demand	Anodyne	KCNQ2	32	43
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819232518	FF	On-Demand	Anodyne	NPY2R	101	42
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819232518	FF	On-Demand	Anodyne	PIK3CA	23	46
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819232518	FF	On-Demand	Anodyne	PIK3CD	23	48
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819232518	FF	On-Demand	Anodyne	EPHX2	25	48
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819232518	FF	On-Demand	Anodyne	PIK3CB	39	48
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819232518	FF	On-Demand	Anodyne	TAAR1	26	40
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819232518	FF	On-Demand	Anodyne	STAT6	44	34
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819232545	DE	On-Demand	Anodyne	NPY2R	74	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819232546	DE	On-Demand	Anodyne	NPY2R	74	41
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819232547	DE	On-Demand	Anodyne	NPY2R	74	41
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819232548	DE	On-Demand	Anodyne	NPY2R	74	41
Cn1nccc1CCNC[C@H](O)COc1cc(F)cc(Br)c1	ZINC000819232549	FD	On-Demand	Anodyne	ADRB2	34	41
Cn1nccc1CCNC[C@H](O)COc1cc(F)cc(Br)c1	ZINC000819232549	FD	On-Demand	Anodyne	ADRB1	54	41
Cn1nccc1CCNC[C@H](O)COc1cc(F)cc(Br)c1	ZINC000819232549	FD	On-Demand	Anodyne	ADRB3	39	41
Cn1nccc1CCNC[C@@H](O)COc1cc(F)cc(Br)c1	ZINC000819232550	FD	On-Demand	Anodyne	ADRB2	34	41
Cn1nccc1CCNC[C@@H](O)COc1cc(F)cc(Br)c1	ZINC000819232550	FD	On-Demand	Anodyne	ADRB1	54	41
Cn1nccc1CCNC[C@@H](O)COc1cc(F)cc(Br)c1	ZINC000819232550	FD	On-Demand	Anodyne	ADRB3	39	41
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819232557	EC	On-Demand	Anodyne	ADRB2	61	65
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819232557	EC	On-Demand	Anodyne	ADRB1	107	65
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819232557	EC	On-Demand	Anodyne	GRIN1	30	49
CC(=O)Nc1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819232557	EC	On-Demand	Anodyne	ADRB3	86	65
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819232558	EC	On-Demand	Anodyne	ADRB2	61	65
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819232558	EC	On-Demand	Anodyne	ADRB1	107	65
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819232558	EC	On-Demand	Anodyne	GRIN1	30	49
CC(=O)Nc1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819232558	EC	On-Demand	Anodyne	ADRB3	86	65
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccc(Cl)cc1	ZINC000819232565	GG	On-Demand	Anodyne	ADRB2	37	44
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccc(Cl)cc1	ZINC000819232565	GG	On-Demand	Anodyne	ADRB1	56	44
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccc(Cl)cc1	ZINC000819232565	GG	On-Demand	Anodyne	ADRB3	43	44
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccc(Cl)cc1	ZINC000819232566	GG	On-Demand	Anodyne	ADRB2	37	44
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccc(Cl)cc1	ZINC000819232566	GG	On-Demand	Anodyne	ADRB1	56	44
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccc(Cl)cc1	ZINC000819232566	GG	On-Demand	Anodyne	ADRB3	43	44
O=C(CCNC1CCC(O)(c2ccccc2)CC1)Nc1ccc(Cl)cc1	ZINC000819232586	FI	On-Demand	Anodyne	CCR1	51	38
COC(=O)c1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232593	GF	On-Demand	Anodyne	ADRB2	51	44
COC(=O)c1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232593	GF	On-Demand	Anodyne	ADRB1	74	44
COC(=O)c1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232593	GF	On-Demand	Anodyne	ADRB3	60	44
COC(=O)c1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232593	GF	On-Demand	Anodyne	ABCB1	24	43
COC(=O)c1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232594	GF	On-Demand	Anodyne	ADRB2	51	44
COC(=O)c1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232594	GF	On-Demand	Anodyne	ADRB1	74	44
COC(=O)c1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232594	GF	On-Demand	Anodyne	ADRB3	60	44
COC(=O)c1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232594	GF	On-Demand	Anodyne	ABCB1	24	43
CC[C@@H](CC(F)(F)F)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819232597	EE	On-Demand	Anodyne	CTSF	57	41
CC[C@@H](CC(F)(F)F)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819232599	EE	On-Demand	Anodyne	CTSF	57	41
COCCc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232607	GG	On-Demand	Anodyne	ADRB2	52	53
COCCc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232607	GG	On-Demand	Anodyne	ADRB1	77	53
COCCc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232607	GG	On-Demand	Anodyne	ADRB3	57	42
COCCc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232607	GG	On-Demand	Anodyne	ABCB1	21	44
COCCc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232608	GG	On-Demand	Anodyne	ADRB2	52	53
COCCc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232608	GG	On-Demand	Anodyne	ADRB1	77	53
COCCc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232608	GG	On-Demand	Anodyne	ADRB3	57	42
COCCc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232608	GG	On-Demand	Anodyne	ABCB1	21	44
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccccc1F	ZINC000819232609	FF	On-Demand	Anodyne	ADRB2	30	51
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccccc1F	ZINC000819232609	FF	On-Demand	Anodyne	ADRB1	29	45
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccccc1F	ZINC000819232609	FF	On-Demand	Anodyne	ADRB3	22	51
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccccc1F	ZINC000819232609	FF	On-Demand	Anodyne	ABCB1	23	48
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccccc1F	ZINC000819232610	FF	On-Demand	Anodyne	ADRB2	30	51
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccccc1F	ZINC000819232610	FF	On-Demand	Anodyne	ADRB1	29	45
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccccc1F	ZINC000819232610	FF	On-Demand	Anodyne	ADRB3	22	51
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccccc1F	ZINC000819232610	FF	On-Demand	Anodyne	ABCB1	23	48
Cn1nccc1CCNC[C@@H](O)CCc1ccccc1	ZINC000819232626	CD	On-Demand	Anodyne	ADRB1	44	39
Cn1nccc1CCNC[C@@H](O)CCc1ccccc1	ZINC000819232626	CD	On-Demand	Anodyne	ADRB3	57	39
Cn1nccc1CCNC[C@H](O)CCc1ccccc1	ZINC000819232627	CD	On-Demand	Anodyne	ADRB1	44	39
Cn1nccc1CCNC[C@H](O)CCc1ccccc1	ZINC000819232627	CD	On-Demand	Anodyne	ADRB3	57	39
Cn1nccc1CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819232628	DC	On-Demand	Bother	ADRB2	44	45
Cn1nccc1CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819232628	DC	On-Demand	Bother	ADRB1	64	45
Cn1nccc1CCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819232628	DC	On-Demand	Bother	ADRB3	46	45
Cn1nccc1CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819232629	DC	On-Demand	Bother	ADRB2	44	45
Cn1nccc1CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819232629	DC	On-Demand	Bother	ADRB1	64	45
Cn1nccc1CCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819232629	DC	On-Demand	Bother	ADRB3	46	45
N#CCOc1ccc(CNC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819232630	FG	On-Demand	Mild	PLA2G4A	20	41
N#CCOc1ccc(CNC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819232630	FG	On-Demand	Mild	FFAR1	30	46
N#CCOc1ccc(CNC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819232630	FG	On-Demand	Mild	PDS	53	38
O[C@@H](CNCCC[C@H]1CCCCO1)c1ccccc1	ZINC000819232631	CF	On-Demand	Anodyne	ADRB1	23	40
O[C@@H](CNCCC[C@H]1CCCCO1)c1ccccc1	ZINC000819232631	CF	On-Demand	Anodyne	ADRB3	36	40
O[C@@H](CNCCC[C@@H]1CCCCO1)c1ccccc1	ZINC000819232632	CF	On-Demand	Anodyne	ADRB1	23	40
O[C@@H](CNCCC[C@@H]1CCCCO1)c1ccccc1	ZINC000819232632	CF	On-Demand	Anodyne	ADRB3	36	40
O[C@H](CNCCC[C@H]1CCCCO1)c1ccccc1	ZINC000819232633	CF	On-Demand	Anodyne	ADRB1	23	40
O[C@H](CNCCC[C@H]1CCCCO1)c1ccccc1	ZINC000819232633	CF	On-Demand	Anodyne	ADRB3	36	40
O[C@H](CNCCC[C@@H]1CCCCO1)c1ccccc1	ZINC000819232634	CF	On-Demand	Anodyne	ADRB1	23	40
O[C@H](CNCCC[C@@H]1CCCCO1)c1ccccc1	ZINC000819232634	CF	On-Demand	Anodyne	ADRB3	36	40
N#C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(OCc2ccccc2)cc1	ZINC000819232635	FH	On-Demand	Mild	FFAR1	16	41
N#C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(OCc2ccccc2)cc1	ZINC000819232636	FH	On-Demand	Mild	FFAR1	16	41
N#C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(OCc2ccccc2)cc1	ZINC000819232637	FH	On-Demand	Mild	FFAR1	16	41
N#C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(OCc2ccccc2)cc1	ZINC000819232638	FH	On-Demand	Mild	FFAR1	16	41
COC[C@@H](C)OC[C@@H](O)CNC1CCC(O)(c2ccccc2)CC1	ZINC000819232646	ED	On-Demand	Anodyne	ADRB2	18	40
COC[C@@H](C)OC[C@H](O)CNC1CCC(O)(c2ccccc2)CC1	ZINC000819232648	ED	On-Demand	Anodyne	ADRB2	18	40
O=C(Cn1cccc(C(F)(F)F)c1=O)N1CCC[C@@H](CO)CC1	ZINC000819232651	ED	On-Demand	Anodyne	SFRP1	41	38
O=C(Cn1cccc(C(F)(F)F)c1=O)N1CCC[C@H](CO)CC1	ZINC000819232652	ED	On-Demand	Anodyne	SFRP1	41	38
O=C(c1ccc(N2C(=O)CCC2=O)cc1)N1CCC[C@@H](CO)CC1	ZINC000819232653	ED	On-Demand	Anodyne	L3MBTL3	91	46
O=C(c1ccc(N2C(=O)CCC2=O)cc1)N1CCC[C@H](CO)CC1	ZINC000819232654	ED	On-Demand	Anodyne	L3MBTL3	91	46
O=C(c1c[nH]c2cc(Cl)ccc12)N1CCC[C@@H](CO)CC1	ZINC000819232659	DG	On-Demand	Anodyne	GRIN2B	37	45
O=C(c1c[nH]c2cc(Cl)ccc12)N1CCC[C@H](CO)CC1	ZINC000819232660	DG	On-Demand	Anodyne	GRIN2B	37	45
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@H](CO)CC1	ZINC000819232661	HH	On-Demand	Anodyne	F2	20	40
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@H](CO)CC1	ZINC000819232661	HH	On-Demand	Anodyne	PLG	15	40
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@H](CO)CC1	ZINC000819232661	HH	On-Demand	Anodyne	CELA1	23	41
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@H](CO)CC1	ZINC000819232661	HH	On-Demand	Anodyne	PGC	40	37
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@H](CO)CC1	ZINC000819232661	HH	On-Demand	Anodyne	CMA1	32	42
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@H](CO)CC1	ZINC000819232661	HH	On-Demand	Anodyne	TRY1_BOVIN	16	40
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@H](CO)CC1	ZINC000819232661	HH	On-Demand	Anodyne	CCKAR	17	41
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@H](CO)CC1	ZINC000819232661	HH	On-Demand	Anodyne	CTSK	15	41
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@H](CO)CC1	ZINC000819232661	HH	On-Demand	Anodyne	REN	68	40
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@H](CO)CC1	ZINC000819232661	HH	On-Demand	Anodyne	FPR1	45	41
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819232663	HH	On-Demand	Anodyne	F2	20	40
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819232663	HH	On-Demand	Anodyne	PLG	15	40
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819232663	HH	On-Demand	Anodyne	CELA1	23	41
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819232663	HH	On-Demand	Anodyne	PGC	40	37
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819232663	HH	On-Demand	Anodyne	CMA1	32	42
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819232663	HH	On-Demand	Anodyne	TRY1_BOVIN	16	40
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819232663	HH	On-Demand	Anodyne	CCKAR	17	41
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819232663	HH	On-Demand	Anodyne	CTSK	15	41
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819232663	HH	On-Demand	Anodyne	REN	68	40
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819232663	HH	On-Demand	Anodyne	FPR1	45	41
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819232669	GD	On-Demand	Anodyne	PREP	68	45
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819232670	GD	On-Demand	Anodyne	PREP	68	45
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819232671	GD	On-Demand	Anodyne	PREP	68	45
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819232672	GD	On-Demand	Anodyne	PREP	68	45
O=C(c1cccc(C2OCCO2)c1)N1CCC[C@@H](CO)CC1	ZINC000819232701	DD	On-Demand	Anodyne	PREP	27	40
O=C(c1cccc(C2OCCO2)c1)N1CCC[C@@H](CO)CC1	ZINC000819232701	DD	On-Demand	Anodyne	L3MBTL3	86	48
O=C(c1cccc(C2OCCO2)c1)N1CCC[C@H](CO)CC1	ZINC000819232702	DD	On-Demand	Anodyne	PREP	27	40
O=C(c1cccc(C2OCCO2)c1)N1CCC[C@H](CO)CC1	ZINC000819232702	DD	On-Demand	Anodyne	L3MBTL3	86	48
O=C(c1ccc(-n2ccc(C(F)(F)F)n2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819232715	FG	On-Demand	Anodyne	L3MBTL3	62	39
O=C(c1ccc(-n2ccc(C(F)(F)F)n2)cc1)N1CCC[C@H](CO)CC1	ZINC000819232716	FG	On-Demand	Anodyne	L3MBTL3	62	39
C#CCN1CCC[C@H]1C(=O)N1CCC[C@H](CO)CC1	ZINC000819232717	CC	On-Demand	Mild	PREP	36	42
C#CCN1CCC[C@H]1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819232718	CC	On-Demand	Mild	PREP	36	42
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](CO)CC1)C1CCOCC1	ZINC000819232719	FD	On-Demand	Anodyne	POLG_HCV1	16	41
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](CO)CC1)C1CCOCC1	ZINC000819232720	FD	On-Demand	Anodyne	POLG_HCV1	16	41
O=C(c1ccc(-n2nccc2-c2ccc(F)cc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819232729	GH	On-Demand	Anodyne	L3MBTL3	52	37
O=C(c1ccc(-n2nccc2-c2ccc(F)cc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819232730	GH	On-Demand	Anodyne	L3MBTL3	52	37
CN(CC(=O)N1CCC[C@@H](CO)CC1)c1ccc(C(F)(F)F)cc1C=O	ZINC000819232737	FF	On-Demand	Anodyne	LIPG	46	35
CN(CC(=O)N1CCC[C@H](CO)CC1)c1ccc(C(F)(F)F)cc1C=O	ZINC000819232738	FF	On-Demand	Anodyne	LIPG	46	35
COc1ccc(OC)c([C@H](O)CNCCc2c(C)oc3ccccc23)c1	ZINC000819232765	FH	On-Demand	Anodyne	ADRB2	21	47
COc1ccc(OC)c([C@H](O)CNCCc2c(C)oc3ccccc23)c1	ZINC000819232765	FH	On-Demand	Anodyne	MTNR1A	31	42
COc1ccc(OC)c([C@H](O)CNCCc2c(C)oc3ccccc23)c1	ZINC000819232765	FH	On-Demand	Anodyne	MTNR1B	29	42
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)c1	ZINC000819232823	GJ	On-Demand	Anodyne	OPRK1	16	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)c1	ZINC000819232823	GJ	On-Demand	Anodyne	CMA1	29	40
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)c1	ZINC000819232823	GJ	On-Demand	Anodyne	CTRA_BOVIN	17	40
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)c1	ZINC000819232823	GJ	On-Demand	Anodyne	CPT1A	30	41
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)c1	ZINC000819232823	GJ	On-Demand	Anodyne	RBP4	83	39
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)c1	ZINC000819232823	GJ	On-Demand	Anodyne	TAAR1	23	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)c1	ZINC000819232823	GJ	On-Demand	Anodyne	SFRP1	70	33
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)c1	ZINC000819232823	GJ	On-Demand	Anodyne	WNT3	66	33
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)c1	ZINC000819232824	GJ	On-Demand	Anodyne	OPRK1	16	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)c1	ZINC000819232824	GJ	On-Demand	Anodyne	CMA1	29	40
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)c1	ZINC000819232824	GJ	On-Demand	Anodyne	CTRA_BOVIN	17	40
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)c1	ZINC000819232824	GJ	On-Demand	Anodyne	CPT1A	30	41
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)c1	ZINC000819232824	GJ	On-Demand	Anodyne	RBP4	83	39
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)c1	ZINC000819232824	GJ	On-Demand	Anodyne	TAAR1	23	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)c1	ZINC000819232824	GJ	On-Demand	Anodyne	SFRP1	70	33
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)c1	ZINC000819232824	GJ	On-Demand	Anodyne	WNT3	66	33
CCOc1ccccc1CCNC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819232851	FE	On-Demand	Anodyne	MBTPS1	43	31
CCOc1ccccc1CCNC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819232852	FE	On-Demand	Anodyne	MBTPS1	43	31
Cn1nccc1CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819232862	DD	On-Demand	Anodyne	ADRB2	38	57
Cn1nccc1CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819232862	DD	On-Demand	Anodyne	ADRB1	54	60
Cn1nccc1CCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819232862	DD	On-Demand	Anodyne	ADRB3	39	57
Cn1nccc1CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819232864	DD	On-Demand	Anodyne	ADRB2	38	57
Cn1nccc1CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819232864	DD	On-Demand	Anodyne	ADRB1	54	60
Cn1nccc1CCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819232864	DD	On-Demand	Anodyne	ADRB3	39	57
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccc2ccccc2c1	ZINC000819232866	GH	On-Demand	Anodyne	ADRB2	35	51
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccc2ccccc2c1	ZINC000819232866	GH	On-Demand	Anodyne	ADRB1	39	43
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccc2ccccc2c1	ZINC000819232866	GH	On-Demand	Anodyne	ADRB3	29	43
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCC[C@H](CO)CC1	ZINC000819232868	EC	On-Demand	Anodyne	PREP	26	54
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccc2ccccc2c1	ZINC000819232869	GH	On-Demand	Anodyne	ADRB2	35	51
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccc2ccccc2c1	ZINC000819232869	GH	On-Demand	Anodyne	ADRB1	39	43
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccc2ccccc2c1	ZINC000819232869	GH	On-Demand	Anodyne	ADRB3	29	43
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819232870	EC	On-Demand	Anodyne	PREP	26	54
N#CCc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232871	GF	On-Demand	Mild	ADRB2	40	42
N#CCc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232871	GF	On-Demand	Mild	ADRB1	60	45
N#CCc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232871	GF	On-Demand	Mild	ADRB3	43	45
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CCC[C@@H](CO)CC1	ZINC000819232872	II	On-Demand	Anodyne	CPT2	42	37
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CCC[C@@H](CO)CC1	ZINC000819232872	II	On-Demand	Anodyne	PREP	120	56
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CCC[C@@H](CO)CC1	ZINC000819232872	II	On-Demand	Anodyne	LGMN	50	35
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CCC[C@@H](CO)CC1	ZINC000819232872	II	On-Demand	Anodyne	SFRP1	40	35
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CCC[C@@H](CO)CC1	ZINC000819232872	II	On-Demand	Anodyne	WNT3	45	35
N#CCc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232873	GF	On-Demand	Mild	ADRB2	40	42
N#CCc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232873	GF	On-Demand	Mild	ADRB1	60	45
N#CCc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819232873	GF	On-Demand	Mild	ADRB3	43	45
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CCC[C@H](CO)CC1	ZINC000819232875	II	On-Demand	Anodyne	CPT2	42	37
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CCC[C@H](CO)CC1	ZINC000819232875	II	On-Demand	Anodyne	PREP	120	56
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CCC[C@H](CO)CC1	ZINC000819232875	II	On-Demand	Anodyne	LGMN	50	35
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CCC[C@H](CO)CC1	ZINC000819232875	II	On-Demand	Anodyne	SFRP1	40	35
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CCC[C@H](CO)CC1	ZINC000819232875	II	On-Demand	Anodyne	WNT3	45	35
O=C(c1cccc(Cl)c1O)N1CCC[C@H](CO)CC1	ZINC000819232878	CE	On-Demand	Anodyne	L3MBTL3	72	44
O=C(c1cccc(Cl)c1O)N1CCC[C@@H](CO)CC1	ZINC000819232881	CE	On-Demand	Anodyne	L3MBTL3	72	44
O=C(c1cc(-c2ccccc2Cl)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819232886	GJ	On-Demand	Anodyne	CCR3	20	45
O=C(c1cc(-c2ccccc2Cl)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819232886	GJ	On-Demand	Anodyne	Q8MHZ5_SHEEP	40	31
O=C(c1cc(-c2ccccc2Cl)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819232886	GJ	On-Demand	Anodyne	SMO	17	41
O=C(c1cc(-c2ccccc2Cl)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819232887	GJ	On-Demand	Anodyne	CCR3	20	45
O=C(c1cc(-c2ccccc2Cl)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819232887	GJ	On-Demand	Anodyne	Q8MHZ5_SHEEP	40	31
O=C(c1cc(-c2ccccc2Cl)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819232887	GJ	On-Demand	Anodyne	SMO	17	41
O=C(c1cc(S(=O)(=O)N2CCC2)ccc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819232888	GD	On-Demand	Anodyne	L3MBTL3	43	42
O=C(c1cc(S(=O)(=O)N2CCC2)ccc1Cl)N1CCC[C@H](CO)CC1	ZINC000819232891	GD	On-Demand	Anodyne	L3MBTL3	43	42
O=C(c1ccccc1OC1CCC1)N1CCC[C@H](CO)CC1	ZINC000819232902	DF	On-Demand	Anodyne	GRIN2B	41	39
O=C(c1ccccc1OC1CCC1)N1CCC[C@H](CO)CC1	ZINC000819232902	DF	On-Demand	Anodyne	AKR1C3	16	42
O=C(c1ccccc1OC1CCC1)N1CCC[C@H](CO)CC1	ZINC000819232902	DF	On-Demand	Anodyne	L3MBTL3	53	43
O=C(c1ccccc1OC1CCC1)N1CCC[C@@H](CO)CC1	ZINC000819232904	DF	On-Demand	Anodyne	GRIN2B	41	39
O=C(c1ccccc1OC1CCC1)N1CCC[C@@H](CO)CC1	ZINC000819232904	DF	On-Demand	Anodyne	AKR1C3	16	42
O=C(c1ccccc1OC1CCC1)N1CCC[C@@H](CO)CC1	ZINC000819232904	DF	On-Demand	Anodyne	L3MBTL3	53	43
O=C(CCNC1CCC(O)(c2ccccc2)CC1)Nc1cccnc1	ZINC000819232909	EF	On-Demand	Anodyne	NAMPT	33	40
O=C([C@@H]1CCCCN1C(=O)/C=C\[C@@H]1CCCO1)N1CCOCC1	ZINC000819232955	DC	On-Demand	Anodyne	PREP	39	41
O=C([C@@H]1CCCCN1C(=O)/C=C/[C@H]1CCCO1)N1CCOCC1	ZINC000819232957	DC	On-Demand	Anodyne	PREP	39	41
O=C([C@@H]1CCCCN1C(=O)/C=C/[C@@H]1CCCO1)N1CCOCC1	ZINC000819232958	DC	On-Demand	Anodyne	PREP	39	41
O=C([C@@H]1CCCCN1C(=O)/C=C\[C@H]1CCCO1)N1CCOCC1	ZINC000819232960	DC	On-Demand	Anodyne	PREP	39	41
CC[C@@H](CC(F)(F)F)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819232969	FG	On-Demand	Anodyne	GPR119	31	43
CC[C@@H](CC(F)(F)F)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819232973	FG	On-Demand	Anodyne	GPR119	31	43
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)N1CCC[C@H](CO)CC1	ZINC000819232976	GE	On-Demand	Anodyne	GRIN2B	30	46
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819232978	GE	On-Demand	Anodyne	GRIN2B	30	46
Cn1nccc1CCNC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819232982	EE	On-Demand	Anodyne	ADRB2	23	42
Cn1nccc1CCNC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819232982	EE	On-Demand	Anodyne	ADRB3	40	36
Cn1nccc1CCNC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819232983	EE	On-Demand	Anodyne	ADRB2	23	42
Cn1nccc1CCNC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819232983	EE	On-Demand	Anodyne	ADRB3	40	36
COC(=O)c1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819232997	EC	On-Demand	Anodyne	ADRB2	58	53
COC(=O)c1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819232997	EC	On-Demand	Anodyne	ADRB1	97	53
COC(=O)c1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819232997	EC	On-Demand	Anodyne	GRIN1	18	44
COC(=O)c1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819232997	EC	On-Demand	Anodyne	ADRB3	68	53
COC(=O)c1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819232997	EC	On-Demand	Anodyne	ABCB1	16	49
COC(=O)c1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819232999	EC	On-Demand	Anodyne	ADRB2	58	53
COC(=O)c1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819232999	EC	On-Demand	Anodyne	ADRB1	97	53
COC(=O)c1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819232999	EC	On-Demand	Anodyne	GRIN1	18	44
COC(=O)c1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819232999	EC	On-Demand	Anodyne	ADRB3	68	53
COC(=O)c1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819232999	EC	On-Demand	Anodyne	ABCB1	16	49
CC(C)(C)OC(=O)N1CCC(n2cccc2C(=O)N2CCC[C@H](CO)CC2)CC1	ZINC000819233022	HG	On-Demand	Anodyne	GPR119	41	40
CC(C)(C)OC(=O)N1CCC(n2cccc2C(=O)N2CCC[C@H](CO)CC2)CC1	ZINC000819233022	HG	On-Demand	Anodyne	L3MBTL3	43	34
CC(C)(C)OC(=O)N1CCC(n2cccc2C(=O)N2CCC[C@@H](CO)CC2)CC1	ZINC000819233024	HG	On-Demand	Anodyne	GPR119	41	40
CC(C)(C)OC(=O)N1CCC(n2cccc2C(=O)N2CCC[C@@H](CO)CC2)CC1	ZINC000819233024	HG	On-Demand	Anodyne	L3MBTL3	43	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	F2	56	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	PLG	42	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	ACE	49	49
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	GHRHR	62	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	P2RY12	207	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	ELANE	28	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	CMA1	24	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	CTRA_BOVIN	69	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	KLK3	87	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	CTSB	66	48
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	PAPA1_CARPA	58	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	TRY1_BOVIN	51	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	CYSP_TRYCR	55	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	CTSG	47	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	CTSK	63	51
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	CTSL	57	51
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	CACNA1B	43	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	CCR1	20	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	PREP	50	46
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	CAPNS1	76	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	CELA2A	57	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	REN	82	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	MMP11	56	31
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	CCKBR	15	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	CTSS	45	51
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	CAPN1	95	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	CAPN2	140	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	PLAU	20	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	TGM2	45	52
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	DPP7	50	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	TPSAB1	51	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	ST14	46	33
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	KLK1	25	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	NPR	67	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233030	GD	On-Demand	Anodyne	BIRC2	18	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	F2	56	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	PLG	42	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	ACE	49	49
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	GHRHR	62	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	P2RY12	207	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	ELANE	28	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	CMA1	24	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	CTRA_BOVIN	69	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	KLK3	87	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	CTSB	66	48
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	PAPA1_CARPA	58	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	TRY1_BOVIN	51	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	CYSP_TRYCR	55	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	CTSG	47	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	CTSK	63	51
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	CTSL	57	51
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	CACNA1B	43	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	CCR1	20	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	PREP	50	46
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	CAPNS1	76	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	CELA2A	57	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	REN	82	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	MMP11	56	31
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	CCKBR	15	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	CTSS	45	51
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	CAPN1	95	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	CAPN2	140	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	PLAU	20	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	TGM2	45	52
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	DPP7	50	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	TPSAB1	51	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	ST14	46	33
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	KLK1	25	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	NPR	67	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233032	GD	On-Demand	Anodyne	BIRC2	18	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	F2	56	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	PLG	42	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	ACE	49	49
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	GHRHR	62	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	P2RY12	207	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	ELANE	28	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	CMA1	24	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	CTRA_BOVIN	69	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	KLK3	87	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	CTSB	66	48
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	PAPA1_CARPA	58	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	TRY1_BOVIN	51	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	CYSP_TRYCR	55	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	CTSG	47	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	CTSK	63	51
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	CTSL	57	51
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	CACNA1B	43	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	CCR1	20	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	PREP	50	46
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	CAPNS1	76	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	CELA2A	57	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	REN	82	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	MMP11	56	31
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	CCKBR	15	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	CTSS	45	51
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	CAPN1	95	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	CAPN2	140	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	PLAU	20	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	TGM2	45	52
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	DPP7	50	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	TPSAB1	51	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	ST14	46	33
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	KLK1	25	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	NPR	67	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233034	GD	On-Demand	Anodyne	BIRC2	18	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	F2	56	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	PLG	42	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	ACE	49	49
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	GHRHR	62	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	P2RY12	207	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	ELANE	28	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	CMA1	24	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	CTRA_BOVIN	69	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	KLK3	87	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	CTSB	66	48
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	PAPA1_CARPA	58	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	TRY1_BOVIN	51	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	CYSP_TRYCR	55	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	CTSG	47	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	CTSK	63	51
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	CTSL	57	51
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	CACNA1B	43	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	CCR1	20	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	PREP	50	46
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	CAPNS1	76	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	CELA2A	57	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	REN	82	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	MMP11	56	31
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	CCKBR	15	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	CTSS	45	51
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	CAPN1	95	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	CAPN2	140	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	PLAU	20	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	TGM2	45	52
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	DPP7	50	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	TPSAB1	51	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	ST14	46	33
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	KLK1	25	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	NPR	67	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233036	GD	On-Demand	Anodyne	BIRC2	18	40
O=C(Cc1cccs1)Nc1nc(CC(=O)N2CCC[C@@H](CO)CC2)cs1	ZINC000819233045	GF	On-Demand	Anodyne	ETHR	35	45
O=C(Cc1cccs1)Nc1nc(CC(=O)N2CCC[C@H](CO)CC2)cs1	ZINC000819233046	GF	On-Demand	Anodyne	ETHR	35	45
CN1CCOc2ccc(C(=O)N3CCC[C@@H](CO)CC3)cc21	ZINC000819233047	DD	On-Demand	Anodyne	L3MBTL3	78	38
CN1CCOc2ccc(C(=O)N3CCC[C@H](CO)CC3)cc21	ZINC000819233048	DD	On-Demand	Anodyne	L3MBTL3	78	38
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000819233068	EI	On-Demand	Anodyne	RBP4	88	45
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000819233069	EI	On-Demand	Anodyne	RBP4	88	45
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000819233070	EI	On-Demand	Anodyne	RBP4	88	45
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000819233071	EI	On-Demand	Anodyne	RBP4	88	45
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819233077	GE	On-Demand	Anodyne	DRD4	43	32
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819233077	GE	On-Demand	Anodyne	NPY2R	85	47
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819233077	GE	On-Demand	Anodyne	EPHX2	18	41
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819233077	GE	On-Demand	Anodyne	PIK3CB	19	50
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819233077	GE	On-Demand	Anodyne	TAAR1	35	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(N3CCOCC3)c(F)c1)C2	ZINC000819233081	GE	On-Demand	Anodyne	NPY2R	65	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(N3CCOCC3)c(F)c1)C2	ZINC000819233082	GE	On-Demand	Anodyne	NPY2R	65	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N(Cc1ccccc1)Cc1cc[nH]n1	ZINC000819233114	FF	On-Demand	Anodyne	PGC	46	31
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N(Cc1ccccc1)Cc1cc[nH]n1	ZINC000819233114	FF	On-Demand	Anodyne	REN	53	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N(Cc1ccccc1)Cc1cc[nH]n1	ZINC000819233114	FF	On-Demand	Anodyne	FPR1	46	37
O=C(c1cc(S(=O)(=O)NC2CC2)ccc1Br)N1CCC[C@@H](CO)CC1	ZINC000819233126	IE	On-Demand	Anodyne	SFRP1	125	40
O=C(c1cc(S(=O)(=O)NC2CC2)ccc1Br)N1CCC[C@@H](CO)CC1	ZINC000819233126	IE	On-Demand	Anodyne	WNT3	86	38
O=C(c1cc(S(=O)(=O)NC2CC2)ccc1Br)N1CCC[C@H](CO)CC1	ZINC000819233128	IE	On-Demand	Anodyne	SFRP1	125	40
O=C(c1cc(S(=O)(=O)NC2CC2)ccc1Br)N1CCC[C@H](CO)CC1	ZINC000819233128	IE	On-Demand	Anodyne	WNT3	86	38
C[C@@H]1[C@@H](C(=O)N2CCC[C@@H](CO)CC2)CCCN1C(=O)OC(C)(C)C	ZINC000819233130	FF	On-Demand	Anodyne	PREP	17	53
C[C@@H]1[C@@H](C(=O)N2CCC[C@H](CO)CC2)CCCN1C(=O)OC(C)(C)C	ZINC000819233132	FF	On-Demand	Anodyne	PREP	17	53
COc1cccc(C2=NO[C@@H](C(=O)N3CCC[C@@H](CO)CC3)C2)c1	ZINC000819233138	ED	On-Demand	Anodyne	LUCI_PHOPY	33	45
COc1cccc(C2=NO[C@H](C(=O)N3CCC[C@@H](CO)CC3)C2)c1	ZINC000819233139	ED	On-Demand	Anodyne	LUCI_PHOPY	33	45
COc1cccc(C2=NO[C@H](C(=O)N3CCC[C@H](CO)CC3)C2)c1	ZINC000819233141	ED	On-Demand	Anodyne	LUCI_PHOPY	33	45
COc1cccc(C2=NO[C@@H](C(=O)N3CCC[C@H](CO)CC3)C2)c1	ZINC000819233143	ED	On-Demand	Anodyne	LUCI_PHOPY	33	45
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819233157	FI	On-Demand	Anodyne	GRIN2B	45	38
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819233157	FI	On-Demand	Anodyne	PRS	39	46
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819233157	FI	On-Demand	Anodyne	ACACB	20	45
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819233157	FI	On-Demand	Anodyne	PREP	20	44
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819233157	FI	On-Demand	Anodyne	TACR3	24	46
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819233157	FI	On-Demand	Anodyne	MT-CO2	50	43
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819233157	FI	On-Demand	Anodyne	VCP	40	37
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819233157	FI	On-Demand	Anodyne	L3MBTL3	33	40
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819233160	FI	On-Demand	Anodyne	GRIN2B	45	38
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819233160	FI	On-Demand	Anodyne	PRS	39	46
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819233160	FI	On-Demand	Anodyne	ACACB	20	45
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819233160	FI	On-Demand	Anodyne	PREP	20	44
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819233160	FI	On-Demand	Anodyne	TACR3	24	46
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819233160	FI	On-Demand	Anodyne	MT-CO2	50	43
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819233160	FI	On-Demand	Anodyne	VCP	40	37
O=C(c1cc(-c2ccccc2)nc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819233160	FI	On-Demand	Anodyne	L3MBTL3	33	40
C[C@@H]1CCCCN1CCOc1ccccc1C(=O)N1CCC[C@H](CO)CC1	ZINC000819233172	FG	On-Demand	Anodyne	HRH3	46	42
C[C@@H]1CCCCN1CCOc1ccccc1C(=O)N1CCC[C@H](CO)CC1	ZINC000819233172	FG	On-Demand	Anodyne	L3MBTL3	43	40
C[C@H]1CCCCN1CCOc1ccccc1C(=O)N1CCC[C@H](CO)CC1	ZINC000819233174	FG	On-Demand	Anodyne	HRH3	46	42
C[C@H]1CCCCN1CCOc1ccccc1C(=O)N1CCC[C@H](CO)CC1	ZINC000819233174	FG	On-Demand	Anodyne	L3MBTL3	43	40
C[C@H]1CCCCN1CCOc1ccccc1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233175	FG	On-Demand	Anodyne	HRH3	46	42
C[C@H]1CCCCN1CCOc1ccccc1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233175	FG	On-Demand	Anodyne	L3MBTL3	43	40
C[C@@H]1CCCCN1CCOc1ccccc1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233176	FG	On-Demand	Anodyne	HRH3	46	42
C[C@@H]1CCCCN1CCOc1ccccc1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233176	FG	On-Demand	Anodyne	L3MBTL3	43	40
Cc1ccc(C(=O)N2CCC[C@@H](CO)CC2)c(C)c1Br	ZINC000819233195	EG	On-Demand	Anodyne	L3MBTL3	57	38
Cc1ccc(C(=O)N2CCC[C@H](CO)CC2)c(C)c1Br	ZINC000819233196	EG	On-Demand	Anodyne	L3MBTL3	57	38
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2C(=O)N2CCC[C@@H](CO)CC2)CC1	ZINC000819233201	GF	On-Demand	Anodyne	GPR119	35	42
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2C(=O)N2CCC[C@H](CO)CC2)CC1	ZINC000819233202	GF	On-Demand	Anodyne	GPR119	35	42
N#Cc1cc(O)cc(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819233225	CD	On-Demand	Mild	L3MBTL3	51	36
N#Cc1cc(O)cc(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819233226	CD	On-Demand	Mild	L3MBTL3	51	36
O=C(NCC(=O)N1CCC[C@H](CO)CC1)OCC1c2ccccc2-c2ccccc21	ZINC000819233227	HG	On-Demand	Anodyne	PREP	22	43
O=C(NCC(=O)N1CCC[C@@H](CO)CC1)OCC1c2ccccc2-c2ccccc21	ZINC000819233228	HG	On-Demand	Anodyne	PREP	22	43
CO/C(=C/c1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233231	CE	On-Demand	Anodyne	TLR4	22	40
CO/C(=C/c1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233231	CE	On-Demand	Anodyne	ACKR3	49	35
CO/C(=C\c1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233232	CE	On-Demand	Anodyne	TLR4	22	40
CO/C(=C\c1ccccc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233232	CE	On-Demand	Anodyne	ACKR3	49	35
CO/C(=C\c1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233233	CE	On-Demand	Anodyne	TLR4	22	40
CO/C(=C\c1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233233	CE	On-Demand	Anodyne	ACKR3	49	35
CO/C(=C/c1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233234	CE	On-Demand	Anodyne	TLR4	22	40
CO/C(=C/c1ccccc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233234	CE	On-Demand	Anodyne	ACKR3	49	35
O=C(c1cccc(Oc2nccs2)c1)N1CCC[C@@H](CO)CC1	ZINC000819233237	EG	On-Demand	Anodyne	L3MBTL3	55	41
O=C(c1cccc(Oc2nccs2)c1)N1CCC[C@H](CO)CC1	ZINC000819233238	EG	On-Demand	Anodyne	L3MBTL3	55	41
C#Cc1cncc(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819233239	CD	On-Demand	Mild	L3MBTL3	70	38
C#Cc1cncc(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819233240	CD	On-Demand	Mild	L3MBTL3	70	38
Cn1nccc1CCNC[C@@H](O)COc1ccc(Cl)cc1Br	ZINC000819233249	GE	On-Demand	Anodyne	ADRB1	46	37
Cn1nccc1CCNC[C@H](O)COc1ccc(Cl)cc1Br	ZINC000819233250	GE	On-Demand	Anodyne	ADRB1	46	37
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819233251	GF	On-Demand	Anodyne	ADRB2	53	52
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819233251	GF	On-Demand	Anodyne	ADRB1	85	52
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819233251	GF	On-Demand	Anodyne	TSHR	42	32
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819233251	GF	On-Demand	Anodyne	ADRB3	63	45
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819233251	GF	On-Demand	Anodyne	TIMP3	57	34
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819233251	GF	On-Demand	Anodyne	ABCB1	19	43
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819233252	GF	On-Demand	Anodyne	ADRB2	53	52
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819233252	GF	On-Demand	Anodyne	ADRB1	85	52
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819233252	GF	On-Demand	Anodyne	TSHR	42	32
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819233252	GF	On-Demand	Anodyne	ADRB3	63	45
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819233252	GF	On-Demand	Anodyne	TIMP3	57	34
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819233252	GF	On-Demand	Anodyne	ABCB1	19	43
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)c1ccc(F)cc1Cl	ZINC000819233260	FH	On-Demand	Anodyne	OPRL1	30	40
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)c1ccc(F)cc1Cl	ZINC000819233261	FH	On-Demand	Anodyne	OPRL1	30	40
CCOc1ccccc1CCNC(=O)/C=C/[C@H]1CCCO1	ZINC000819233274	CE	On-Demand	Anodyne	HCN1	50	33
CCOc1ccccc1CCNC(=O)/C=C/[C@H]1CCCO1	ZINC000819233274	CE	On-Demand	Anodyne	HCN4	43	33
CCOc1ccccc1CCNC(=O)/C=C/[C@@H]1CCCO1	ZINC000819233275	CE	On-Demand	Anodyne	HCN1	50	33
CCOc1ccccc1CCNC(=O)/C=C/[C@@H]1CCCO1	ZINC000819233275	CE	On-Demand	Anodyne	HCN4	43	33
CCOc1ccccc1CCNC(=O)/C=C\[C@H]1CCCO1	ZINC000819233276	CE	On-Demand	Anodyne	HCN1	50	33
CCOc1ccccc1CCNC(=O)/C=C\[C@H]1CCCO1	ZINC000819233276	CE	On-Demand	Anodyne	HCN4	43	33
CCOc1ccccc1CCNC(=O)/C=C\[C@@H]1CCCO1	ZINC000819233277	CE	On-Demand	Anodyne	HCN1	50	33
CCOc1ccccc1CCNC(=O)/C=C\[C@@H]1CCCO1	ZINC000819233277	CE	On-Demand	Anodyne	HCN4	43	33
CC[C@@H](CC(F)(F)F)NC[C@@H](O)c1ccccc1	ZINC000819233288	CG	On-Demand	Anodyne	ADRB3	18	42
CC[C@@H](CC(F)(F)F)NC[C@@H](O)c1ccccc1	ZINC000819233288	CG	On-Demand	Anodyne	AOC3	19	45
CC[C@@H](CC(F)(F)F)NC[C@H](O)c1ccccc1	ZINC000819233289	CG	On-Demand	Anodyne	ADRB3	18	42
CC[C@@H](CC(F)(F)F)NC[C@H](O)c1ccccc1	ZINC000819233289	CG	On-Demand	Anodyne	AOC3	19	45
Cn1nccc1CCNC[C@@H](O)Cc1ccccc1	ZINC000819233307	CD	On-Demand	Anodyne	ADRB3	44	38
Cn1nccc1CCNC[C@H](O)Cc1ccccc1	ZINC000819233308	CD	On-Demand	Anodyne	ADRB3	44	38
Cn1nccc1CCNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819233309	EF	On-Demand	Anodyne	FLT1	19	45
Cn1nccc1CCNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819233309	EF	On-Demand	Anodyne	KDR	19	44
Cn1nccc1CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819233344	EE	On-Demand	Anodyne	ADRB2	27	40
Cn1nccc1CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819233344	EE	On-Demand	Anodyne	ADRB3	41	46
Cn1nccc1CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819233346	EE	On-Demand	Anodyne	ADRB2	27	40
Cn1nccc1CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819233346	EE	On-Demand	Anodyne	ADRB3	41	46
C#CCCCC(=O)N1CCC[C@@H](CO)CC1	ZINC000819233365	BD	On-Demand	Mild	PREP	18	43
C#CCCCC(=O)N1CCC[C@H](CO)CC1	ZINC000819233367	BD	On-Demand	Mild	PREP	18	43
Cn1nccc1CCNC[C@H](O)c1ccc(Br)cc1	ZINC000819233370	DE	On-Demand	Anodyne	ADRB2	26	47
Cn1nccc1CCNC[C@H](O)c1ccc(Br)cc1	ZINC000819233370	DE	On-Demand	Anodyne	ADRB3	46	41
Cn1nccc1CCNC[C@@H](O)c1ccc(Br)cc1	ZINC000819233375	DE	On-Demand	Anodyne	ADRB2	26	47
Cn1nccc1CCNC[C@@H](O)c1ccc(Br)cc1	ZINC000819233375	DE	On-Demand	Anodyne	ADRB3	46	41
O=C(c1cc(-c2ccncc2)nc2ccc(Br)cc12)N1CCC[C@H](CO)CC1	ZINC000819233378	II	On-Demand	Anodyne	PRS	72	49
O=C(c1cc(-c2ccncc2)nc2ccc(Br)cc12)N1CCC[C@@H](CO)CC1	ZINC000819233386	II	On-Demand	Anodyne	PRS	72	49
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCC[C@H](CO)CC2)C[C@@H]2CCCC[C@H]21	ZINC000819233390	GG	On-Demand	Anodyne	PREP	31	77
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCC[C@H](CO)CC2)C[C@H]2CCCC[C@@H]21	ZINC000819233392	GG	On-Demand	Anodyne	PREP	31	77
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCC[C@H](CO)CC2)C[C@H]2CCCC[C@H]21	ZINC000819233394	GG	On-Demand	Anodyne	PREP	31	77
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCC[C@H](CO)CC2)C[C@@H]2CCCC[C@@H]21	ZINC000819233397	GG	On-Demand	Anodyne	PREP	31	77
CC(C)(C)OC(=O)N1CCC(OCC(=O)N2CCC[C@H](CO)CC2)CC1	ZINC000819233409	FE	On-Demand	Anodyne	GPR119	36	44
CC(C)(C)OC(=O)N1CCC(OCC(=O)N2CCC[C@@H](CO)CC2)CC1	ZINC000819233411	FE	On-Demand	Anodyne	GPR119	36	44
O[C@@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1ccccc1F	ZINC000819233420	EE	On-Demand	Anodyne	STAT6	50	34
O[C@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1ccccc1F	ZINC000819233423	EE	On-Demand	Anodyne	STAT6	50	34
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819233431	GE	On-Demand	Anodyne	CDK1	16	41
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819233435	GE	On-Demand	Anodyne	CDK1	16	41
COCCN(Cc1cccnc1)C(=O)C(F)=C1CCC1	ZINC000819233437	CE	On-Demand	Anodyne	CHRNA7	45	38
CC(C)c1ccc2cc(C(=O)N3CCC[C@H](CO)CC3)[nH]c2c1	ZINC000819233439	DH	On-Demand	Anodyne	GRIN2B	43	51
CC(C)c1ccc2cc(C(=O)N3CCC[C@H](CO)CC3)[nH]c2c1	ZINC000819233439	DH	On-Demand	Anodyne	HRH4	30	45
CC(C)c1ccc2cc(C(=O)N3CCC[C@H](CO)CC3)[nH]c2c1	ZINC000819233439	DH	On-Demand	Anodyne	AKR1C3	22	52
CC(C)c1ccc2cc(C(=O)N3CCC[C@@H](CO)CC3)[nH]c2c1	ZINC000819233442	DH	On-Demand	Anodyne	GRIN2B	43	51
CC(C)c1ccc2cc(C(=O)N3CCC[C@@H](CO)CC3)[nH]c2c1	ZINC000819233442	DH	On-Demand	Anodyne	HRH4	30	45
CC(C)c1ccc2cc(C(=O)N3CCC[C@@H](CO)CC3)[nH]c2c1	ZINC000819233442	DH	On-Demand	Anodyne	AKR1C3	22	52
CCCOc1nc2ccccc2cc1/C=C\C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233443	FH	On-Demand	Anodyne	ITGAL	57	34
CCCOc1nc2ccccc2cc1/C=C/C(=O)N1CCC[C@H](CO)CC1	ZINC000819233444	FH	On-Demand	Anodyne	ITGAL	57	34
CCCOc1nc2ccccc2cc1/C=C\C(=O)N1CCC[C@H](CO)CC1	ZINC000819233445	FH	On-Demand	Anodyne	ITGAL	57	34
CCCOc1nc2ccccc2cc1/C=C/C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233447	FH	On-Demand	Anodyne	ITGAL	57	34
OC1(CNCc2cnc(N3CCOCC3)c(F)c2)CCCCC1	ZINC000819233456	DD	On-Demand	Anodyne	STAT6	44	33
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819233457	DG	On-Demand	Mild	NPY2R	104	48
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819233457	DG	On-Demand	Mild	MAPK9	24	41
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819233457	DG	On-Demand	Mild	MAPK10	22	41
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819233457	DG	On-Demand	Mild	EPHX2	15	40
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819233457	DG	On-Demand	Mild	PIK3CB	17	41
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819233457	DG	On-Demand	Mild	STAT6	40	33
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233458	CF	On-Demand	Anodyne	F2	21	40
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233458	CF	On-Demand	Anodyne	MC4R	48	44
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233458	CF	On-Demand	Anodyne	CCR3	82	36
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233458	CF	On-Demand	Anodyne	DPP4	20	44
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233458	CF	On-Demand	Anodyne	MLNR	18	40
CCOCCCn1c(NC(=O)C(F)=C2CCC2)nc2ccccc21	ZINC000819233460	EH	On-Demand	Anodyne	HRH1	20	42
CCOCCCn1c(NC(=O)C(F)=C2CCC2)nc2ccccc21	ZINC000819233460	EH	On-Demand	Anodyne	ITK	33	40
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233470	CF	On-Demand	Anodyne	F2	21	40
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233470	CF	On-Demand	Anodyne	MC4R	48	44
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233470	CF	On-Demand	Anodyne	CCR3	82	36
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233470	CF	On-Demand	Anodyne	DPP4	20	44
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233470	CF	On-Demand	Anodyne	MLNR	18	40
C[C@@H](CC(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F)n1cccn1	ZINC000819233485	FI	On-Demand	Anodyne	DPP4	24	40
C[C@@H](CC(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F)n1cccn1	ZINC000819233485	FI	On-Demand	Anodyne	RBP4	69	39
C[C@@H](CC(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F)n1cccn1	ZINC000819233491	FI	On-Demand	Anodyne	DPP4	24	40
C[C@@H](CC(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F)n1cccn1	ZINC000819233491	FI	On-Demand	Anodyne	RBP4	69	39
CN(C)[C@@H](CNC[C@@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819233492	FG	On-Demand	Anodyne	ADRB2	20	43
CN(C)[C@@H](CNC[C@@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819233492	FG	On-Demand	Anodyne	ADRB1	22	41
CN(C)[C@@H](CNC[C@@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819233492	FG	On-Demand	Anodyne	ADRB3	82	43
CN(C)[C@@H](CNC[C@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819233495	FG	On-Demand	Anodyne	ADRB2	20	43
CN(C)[C@@H](CNC[C@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819233495	FG	On-Demand	Anodyne	ADRB1	22	41
CN(C)[C@@H](CNC[C@H](O)c1cccnc1)c1cccc(C(F)(F)F)c1	ZINC000819233495	FG	On-Demand	Anodyne	ADRB3	82	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](CO)CC1)Cc1ccccc1	ZINC000819233499	GG	On-Demand	Anodyne	F2	21	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](CO)CC1)Cc1ccccc1	ZINC000819233499	GG	On-Demand	Anodyne	PLG	20	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](CO)CC1)Cc1ccccc1	ZINC000819233499	GG	On-Demand	Anodyne	CELA1	23	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](CO)CC1)Cc1ccccc1	ZINC000819233499	GG	On-Demand	Anodyne	CTSD	21	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](CO)CC1)Cc1ccccc1	ZINC000819233499	GG	On-Demand	Anodyne	PGC	63	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](CO)CC1)Cc1ccccc1	ZINC000819233499	GG	On-Demand	Anodyne	CMA1	36	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](CO)CC1)Cc1ccccc1	ZINC000819233499	GG	On-Demand	Anodyne	CTRA_BOVIN	20	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](CO)CC1)Cc1ccccc1	ZINC000819233499	GG	On-Demand	Anodyne	PAPA1_CARPA	29	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](CO)CC1)Cc1ccccc1	ZINC000819233499	GG	On-Demand	Anodyne	CCKAR	49	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](CO)CC1)Cc1ccccc1	ZINC000819233499	GG	On-Demand	Anodyne	CTSK	18	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](CO)CC1)Cc1ccccc1	ZINC000819233499	GG	On-Demand	Anodyne	CTSL	24	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](CO)CC1)Cc1ccccc1	ZINC000819233499	GG	On-Demand	Anodyne	PGA	28	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](CO)CC1)Cc1ccccc1	ZINC000819233499	GG	On-Demand	Anodyne	REN	108	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](CO)CC1)Cc1ccccc1	ZINC000819233499	GG	On-Demand	Anodyne	CTSS	20	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](CO)CC1)Cc1ccccc1	ZINC000819233499	GG	On-Demand	Anodyne	CTSE	19	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](CO)CC1)Cc1ccccc1	ZINC000819233499	GG	On-Demand	Anodyne	FPR1	51	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](CO)CC1)Cc1ccccc1	ZINC000819233499	GG	On-Demand	Anodyne	SFRP1	42	37
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](CO)CC1)Cc1ccccc1	ZINC000819233499	GG	On-Demand	Anodyne	WNT3	44	34
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CO)CC1)Cc1ccccc1	ZINC000819233503	GG	On-Demand	Anodyne	F2	21	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CO)CC1)Cc1ccccc1	ZINC000819233503	GG	On-Demand	Anodyne	PLG	20	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CO)CC1)Cc1ccccc1	ZINC000819233503	GG	On-Demand	Anodyne	CELA1	23	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CO)CC1)Cc1ccccc1	ZINC000819233503	GG	On-Demand	Anodyne	CTSD	21	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CO)CC1)Cc1ccccc1	ZINC000819233503	GG	On-Demand	Anodyne	PGC	63	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CO)CC1)Cc1ccccc1	ZINC000819233503	GG	On-Demand	Anodyne	CMA1	36	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CO)CC1)Cc1ccccc1	ZINC000819233503	GG	On-Demand	Anodyne	CTRA_BOVIN	20	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CO)CC1)Cc1ccccc1	ZINC000819233503	GG	On-Demand	Anodyne	PAPA1_CARPA	29	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CO)CC1)Cc1ccccc1	ZINC000819233503	GG	On-Demand	Anodyne	CCKAR	49	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CO)CC1)Cc1ccccc1	ZINC000819233503	GG	On-Demand	Anodyne	CTSK	18	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CO)CC1)Cc1ccccc1	ZINC000819233503	GG	On-Demand	Anodyne	CTSL	24	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CO)CC1)Cc1ccccc1	ZINC000819233503	GG	On-Demand	Anodyne	PGA	28	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CO)CC1)Cc1ccccc1	ZINC000819233503	GG	On-Demand	Anodyne	REN	108	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CO)CC1)Cc1ccccc1	ZINC000819233503	GG	On-Demand	Anodyne	CTSS	20	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CO)CC1)Cc1ccccc1	ZINC000819233503	GG	On-Demand	Anodyne	CTSE	19	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CO)CC1)Cc1ccccc1	ZINC000819233503	GG	On-Demand	Anodyne	FPR1	51	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CO)CC1)Cc1ccccc1	ZINC000819233503	GG	On-Demand	Anodyne	SFRP1	42	37
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](CO)CC1)Cc1ccccc1	ZINC000819233503	GG	On-Demand	Anodyne	WNT3	44	34
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819233515	GF	On-Demand	Anodyne	CDK1	17	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCCc3sccc32)CC1	ZINC000819233524	GH	On-Demand	Anodyne	GPR119	35	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCCc3sccc32)CC1	ZINC000819233527	GH	On-Demand	Anodyne	GPR119	35	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCCc3sccc32)CC1	ZINC000819233528	GH	On-Demand	Anodyne	GPR119	35	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCCc3sccc32)CC1	ZINC000819233531	GH	On-Demand	Anodyne	GPR119	35	43
O=C(CCc1cccc(OC(F)F)c1)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819233533	GH	On-Demand	Anodyne	NPY2R	74	41
O=C(CCc1cccc(OC(F)F)c1)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819233533	GH	On-Demand	Anodyne	EPHX2	18	41
O=C(CCc1cccc(OC(F)F)c1)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819233533	GH	On-Demand	Anodyne	TAAR1	20	41
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1CCC[C@H](CO)CC1	ZINC000819233565	GH	On-Demand	Anodyne	GRIN2B	71	60
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1CCC[C@H](CO)CC1	ZINC000819233565	GH	On-Demand	Anodyne	HRH4	18	43
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1CCC[C@H](CO)CC1	ZINC000819233565	GH	On-Demand	Anodyne	AKR1C3	21	52
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1CCC[C@@H](CO)CC1	ZINC000819233566	GH	On-Demand	Anodyne	GRIN2B	71	60
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1CCC[C@@H](CO)CC1	ZINC000819233566	GH	On-Demand	Anodyne	HRH4	18	43
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1CCC[C@@H](CO)CC1	ZINC000819233566	GH	On-Demand	Anodyne	AKR1C3	21	52
O=C(c1cc(-c2ccccc2)n(-c2ccccc2)n1)N1CCC[C@@H](CO)CC1	ZINC000819233569	GH	On-Demand	Anodyne	RPA1	93	46
O=C(c1cc(-c2ccccc2)n(-c2ccccc2)n1)N1CCC[C@H](CO)CC1	ZINC000819233572	GH	On-Demand	Anodyne	RPA1	93	46
CCOC(=O)Nc1ccc(C(=O)Nc2ccccc2SCC(F)(F)F)cc1	ZINC000819233578	GK	On-Demand	Anodyne	PRNP	55	34
CCOC(=O)Nc1ccc(C(=O)Nc2ccccc2SCC(F)(F)F)cc1	ZINC000819233578	GK	On-Demand	Anodyne	HDAC1	27	43
CCOC(=O)Nc1ccc(C(=O)Nc2ccccc2SCC(F)(F)F)cc1	ZINC000819233578	GK	On-Demand	Anodyne	SHH	44	38
CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CCC[C@H](CO)CC1	ZINC000819233592	ED	On-Demand	Anodyne	PREP	22	57
CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233594	ED	On-Demand	Anodyne	PREP	22	57
Cn1nccc1CCNC[C@@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819233597	GG	On-Demand	Anodyne	ADRB2	59	46
Cn1nccc1CCNC[C@@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819233597	GG	On-Demand	Anodyne	ADRB1	87	47
Cn1nccc1CCNC[C@@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819233597	GG	On-Demand	Anodyne	ADRB3	60	47
Cn1nccc1CCNC[C@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819233599	GG	On-Demand	Anodyne	ADRB2	59	46
Cn1nccc1CCNC[C@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819233599	GG	On-Demand	Anodyne	ADRB1	87	47
Cn1nccc1CCNC[C@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819233599	GG	On-Demand	Anodyne	ADRB3	60	47
O=C(c1ccc(S(=O)(=O)N2CCOCC2)o1)N1CCC[C@@H](CO)CC1	ZINC000819233600	FC	On-Demand	Anodyne	L3MBTL3	21	42
O=C(c1ccc(S(=O)(=O)N2CCOCC2)o1)N1CCC[C@H](CO)CC1	ZINC000819233602	FC	On-Demand	Anodyne	L3MBTL3	21	42
O=C(c1ccc(OCc2cccnc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819233604	EF	On-Demand	Anodyne	GRIN2B	39	42
O=C(c1ccc(OCc2cccnc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819233604	EF	On-Demand	Anodyne	HRH3	20	45
O=C(c1ccc(OCc2cccnc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819233604	EF	On-Demand	Anodyne	SLC6A5	28	45
O=C(c1ccc(OCc2cccnc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819233604	EF	On-Demand	Anodyne	VCP	42	42
O=C(c1ccc(OCc2cccnc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819233604	EF	On-Demand	Anodyne	L3MBTL3	59	38
O=C(c1ccc(OCc2cccnc2)cc1)N1CCC[C@H](CO)CC1	ZINC000819233604	EF	On-Demand	Anodyne	NAMPT	23	46
O=C(c1ccc(OCc2cccnc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819233606	EF	On-Demand	Anodyne	GRIN2B	39	42
O=C(c1ccc(OCc2cccnc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819233606	EF	On-Demand	Anodyne	HRH3	20	45
O=C(c1ccc(OCc2cccnc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819233606	EF	On-Demand	Anodyne	SLC6A5	28	45
O=C(c1ccc(OCc2cccnc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819233606	EF	On-Demand	Anodyne	VCP	42	42
O=C(c1ccc(OCc2cccnc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819233606	EF	On-Demand	Anodyne	L3MBTL3	59	38
O=C(c1ccc(OCc2cccnc2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819233606	EF	On-Demand	Anodyne	NAMPT	23	46
O=C(c1ccccc1Oc1cccnc1)N1CCC[C@H](CO)CC1	ZINC000819233620	EG	On-Demand	Anodyne	GPBAR1	43	40
O=C(c1ccccc1Oc1cccnc1)N1CCC[C@H](CO)CC1	ZINC000819233620	EG	On-Demand	Anodyne	L3MBTL3	27	42
O=C(c1ccccc1Oc1cccnc1)N1CCC[C@@H](CO)CC1	ZINC000819233622	EG	On-Demand	Anodyne	GPBAR1	43	40
O=C(c1ccccc1Oc1cccnc1)N1CCC[C@@H](CO)CC1	ZINC000819233622	EG	On-Demand	Anodyne	L3MBTL3	27	42
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233629	GF	On-Demand	Anodyne	F2	17	41
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233629	GF	On-Demand	Anodyne	DRD2	19	43
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233629	GF	On-Demand	Anodyne	CCKAR	15	41
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819233629	GF	On-Demand	Anodyne	REN	52	37
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233630	GF	On-Demand	Anodyne	F2	17	41
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233630	GF	On-Demand	Anodyne	DRD2	19	43
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233630	GF	On-Demand	Anodyne	CCKAR	15	41
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](CO)CC1	ZINC000819233630	GF	On-Demand	Anodyne	REN	52	37
CC(=O)Nc1ccc(OC[C@H](O)CNC[Si](C)(C)c2ccccc2)cc1	ZINC000819233639	FE	On-Demand	Anodyne	ADRB2	60	58
CC(=O)Nc1ccc(OC[C@H](O)CNC[Si](C)(C)c2ccccc2)cc1	ZINC000819233639	FE	On-Demand	Anodyne	ADRB1	98	58
CC(=O)Nc1ccc(OC[C@H](O)CNC[Si](C)(C)c2ccccc2)cc1	ZINC000819233639	FE	On-Demand	Anodyne	GRIN1	28	42
CC(=O)Nc1ccc(OC[C@H](O)CNC[Si](C)(C)c2ccccc2)cc1	ZINC000819233639	FE	On-Demand	Anodyne	ADRB3	64	55
CC(=O)Nc1ccc(OC[C@H](O)CNC[Si](C)(C)c2ccccc2)cc1	ZINC000819233639	FE	On-Demand	Anodyne	ACOX1	45	41
CC(=O)Nc1ccc(OC[C@H](O)CNC[Si](C)(C)c2ccccc2)cc1	ZINC000819233639	FE	On-Demand	Anodyne	ABCB1	24	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC[Si](C)(C)c2ccccc2)cc1	ZINC000819233640	FE	On-Demand	Anodyne	ADRB2	60	58
CC(=O)Nc1ccc(OC[C@@H](O)CNC[Si](C)(C)c2ccccc2)cc1	ZINC000819233640	FE	On-Demand	Anodyne	ADRB1	98	58
CC(=O)Nc1ccc(OC[C@@H](O)CNC[Si](C)(C)c2ccccc2)cc1	ZINC000819233640	FE	On-Demand	Anodyne	GRIN1	28	42
CC(=O)Nc1ccc(OC[C@@H](O)CNC[Si](C)(C)c2ccccc2)cc1	ZINC000819233640	FE	On-Demand	Anodyne	ADRB3	64	55
CC(=O)Nc1ccc(OC[C@@H](O)CNC[Si](C)(C)c2ccccc2)cc1	ZINC000819233640	FE	On-Demand	Anodyne	ACOX1	45	41
CC(=O)Nc1ccc(OC[C@@H](O)CNC[Si](C)(C)c2ccccc2)cc1	ZINC000819233640	FE	On-Demand	Anodyne	ABCB1	24	48
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819233647	EE	On-Demand	Anodyne	ADRB3	47	39
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819233647	EE	On-Demand	Anodyne	CDK1	17	42
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819233648	EE	On-Demand	Anodyne	ADRB3	47	39
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819233648	EE	On-Demand	Anodyne	CDK1	17	42
O=C(Nc1ccc(C(=O)NCCN2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819233673	FE	On-Demand	Anodyne	DRD4	42	33
O=C(Nc1ccc(C(=O)NCCN2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819233673	FE	On-Demand	Anodyne	PIK3CA	15	47
O=C(Nc1ccc(C(=O)NCCN2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819233673	FE	On-Demand	Anodyne	PLD1	40	35
O=C(Nc1ccc(C(=O)NCCN2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819233673	FE	On-Demand	Anodyne	MTOR	23	47
O=C(Nc1ccc(C(=O)NCCN2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819233673	FE	On-Demand	Anodyne	EPHX2	30	66
O=C(Nc1ccc(C(=O)NCCN2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819233673	FE	On-Demand	Anodyne	PIK3CG	15	47
O=C(Nc1ccc(C(=O)NCCN2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819233673	FE	On-Demand	Anodyne	PLD2	62	39
O=C(Nc1ccc(C(=O)NCCN2CCOCC2)cc1)C(F)=C1CCC1	ZINC000819233673	FE	On-Demand	Anodyne	HPGDS	27	47
CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2ccccc21	ZINC000819233675	GG	On-Demand	Mild	GHRHR	46	36
CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2ccccc21	ZINC000819233675	GG	On-Demand	Mild	MC4R	15	41
CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2ccccc21	ZINC000819233675	GG	On-Demand	Mild	PAPA1_CARPA	39	42
CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2ccccc21	ZINC000819233675	GG	On-Demand	Mild	CTSK	17	41
CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2ccccc21	ZINC000819233675	GG	On-Demand	Mild	TGM2	18	41
CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2ccccc21	ZINC000819233675	GG	On-Demand	Mild	FPR1	41	34
CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2ccccc21	ZINC000819233676	GG	On-Demand	Mild	GHRHR	46	36
CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2ccccc21	ZINC000819233676	GG	On-Demand	Mild	MC4R	15	41
CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2ccccc21	ZINC000819233676	GG	On-Demand	Mild	PAPA1_CARPA	39	42
CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2ccccc21	ZINC000819233676	GG	On-Demand	Mild	CTSK	17	41
CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2ccccc21	ZINC000819233676	GG	On-Demand	Mild	TGM2	18	41
CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)Cc2ccccc21	ZINC000819233676	GG	On-Demand	Mild	FPR1	41	34
CON(C)C(=O)CCNCc1ccc(C(F)F)cc1	ZINC000819233719	CE	On-Demand	Anodyne	LEF	48	38
Cc1cc(N2CC[C@H](NC[C@@H](O)c3cccnc3)C2=O)ccc1Br	ZINC000819233729	GF	On-Demand	Anodyne	ADRB3	48	43
Cc1cc(N2CC[C@H](NC[C@H](O)c3cccnc3)C2=O)ccc1Br	ZINC000819233731	GF	On-Demand	Anodyne	ADRB3	48	43
O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819233770	GI	On-Demand	Anodyne	ITGAL	65	34
O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819233770	GI	On-Demand	Anodyne	CCR2	17	40
O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819233771	GI	On-Demand	Anodyne	ITGAL	65	34
O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819233771	GI	On-Demand	Anodyne	CCR2	17	40
O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819233772	GI	On-Demand	Anodyne	ITGAL	65	34
O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC[C@H](CO)CC1	ZINC000819233772	GI	On-Demand	Anodyne	CCR2	17	40
O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819233773	GI	On-Demand	Anodyne	ITGAL	65	34
O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC[C@@H](CO)CC1	ZINC000819233773	GI	On-Demand	Anodyne	CCR2	17	40
O=C(c1cc(S(=O)(=O)N2CCCC2)ccc1Cl)N1CCC[C@H](CO)CC1	ZINC000819233781	HE	On-Demand	Anodyne	CHRM2	25	40
O=C(c1cc(S(=O)(=O)N2CCCC2)ccc1Cl)N1CCC[C@H](CO)CC1	ZINC000819233781	HE	On-Demand	Anodyne	AKR1C3	19	40
O=C(c1cc(S(=O)(=O)N2CCCC2)ccc1Cl)N1CCC[C@H](CO)CC1	ZINC000819233781	HE	On-Demand	Anodyne	L3MBTL3	62	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2Cc3ccccc3C2)CC1	ZINC000819233782	FF	On-Demand	Anodyne	GRIN2B	15	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2Cc3ccccc3C2)CC1	ZINC000819233782	FF	On-Demand	Anodyne	CCR8	36	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2Cc3ccccc3C2)CC1	ZINC000819233782	FF	On-Demand	Anodyne	GPR119	53	52
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2Cc3ccccc3C2)CC1	ZINC000819233782	FF	On-Demand	Anodyne	SFRP1	29	40
O=C(c1cc(S(=O)(=O)N2CCCC2)ccc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819233783	HE	On-Demand	Anodyne	CHRM2	25	40
O=C(c1cc(S(=O)(=O)N2CCCC2)ccc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819233783	HE	On-Demand	Anodyne	AKR1C3	19	40
O=C(c1cc(S(=O)(=O)N2CCCC2)ccc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819233783	HE	On-Demand	Anodyne	L3MBTL3	62	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2Cc3ccccc3C2)CC1	ZINC000819233784	FF	On-Demand	Anodyne	GRIN2B	15	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2Cc3ccccc3C2)CC1	ZINC000819233784	FF	On-Demand	Anodyne	CCR8	36	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2Cc3ccccc3C2)CC1	ZINC000819233784	FF	On-Demand	Anodyne	GPR119	53	52
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2Cc3ccccc3C2)CC1	ZINC000819233784	FF	On-Demand	Anodyne	SFRP1	29	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCCC[C@@H]1C(=O)N1CCOCC1	ZINC000819233786	GD	On-Demand	Anodyne	PREP	45	50
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCCC[C@@H]1C(=O)N1CCOCC1	ZINC000819233786	GD	On-Demand	Anodyne	SFRP1	40	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCCC[C@@H]1C(=O)N1CCOCC1	ZINC000819233786	GD	On-Demand	Anodyne	WNT3	54	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCCC[C@H]1C(=O)N1CCOCC1	ZINC000819233787	GD	On-Demand	Anodyne	PREP	45	50
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCCC[C@H]1C(=O)N1CCOCC1	ZINC000819233787	GD	On-Demand	Anodyne	SFRP1	40	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCCC[C@H]1C(=O)N1CCOCC1	ZINC000819233787	GD	On-Demand	Anodyne	WNT3	54	37
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819233800	GG	On-Demand	Anodyne	ADRB2	34	46
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819233800	GG	On-Demand	Anodyne	ADRB1	45	42
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819233800	GG	On-Demand	Anodyne	ADRB3	37	46
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819233800	GG	On-Demand	Anodyne	ABCB1	29	44
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819233800	GG	On-Demand	Anodyne	PDS	63	36
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819233802	GG	On-Demand	Anodyne	ADRB2	34	46
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819233802	GG	On-Demand	Anodyne	ADRB1	45	42
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819233802	GG	On-Demand	Anodyne	ADRB3	37	46
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819233802	GG	On-Demand	Anodyne	ABCB1	29	44
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819233802	GG	On-Demand	Anodyne	PDS	63	36
O=C(c1csc(-c2ccc(O)cc2)n1)N1CCC[C@@H](CO)CC1	ZINC000819233807	EF	On-Demand	Anodyne	TRPC6	42	39
O=C(c1csc(-c2ccc(O)cc2)n1)N1CCC[C@@H](CO)CC1	ZINC000819233807	EF	On-Demand	Anodyne	TRPC3	40	39
O=C(c1csc(-c2ccc(O)cc2)n1)N1CCC[C@H](CO)CC1	ZINC000819233809	EF	On-Demand	Anodyne	TRPC6	42	39
O=C(c1csc(-c2ccc(O)cc2)n1)N1CCC[C@H](CO)CC1	ZINC000819233809	EF	On-Demand	Anodyne	TRPC3	40	39
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)N1CCC[C@H](CO)CC1)=NO2	ZINC000819233811	GE	On-Demand	Anodyne	GPR119	29	45
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)N1CCC[C@@H](CO)CC1)=NO2	ZINC000819233813	GE	On-Demand	Anodyne	GPR119	29	45
O=C(Cc1ccccc1CO)N1CCC[C@@H](CO)CC1	ZINC000819233843	CD	On-Demand	Anodyne	PREP	45	37
O=C(Cc1ccccc1CO)N1CCC[C@H](CO)CC1	ZINC000819233846	CD	On-Demand	Anodyne	PREP	45	37
Cc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819233855	FG	On-Demand	Anodyne	ADRB2	49	47
Cc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819233855	FG	On-Demand	Anodyne	ADRB1	56	46
Cc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819233855	FG	On-Demand	Anodyne	ADRB3	40	46
Cc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819233857	FG	On-Demand	Anodyne	ADRB2	49	47
Cc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819233857	FG	On-Demand	Anodyne	ADRB1	56	46
Cc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)cc1	ZINC000819233857	FG	On-Demand	Anodyne	ADRB3	40	46
Cn1nccc1CCNC[C@H](O)c1cccc2ccccc12	ZINC000819233880	CE	On-Demand	Anodyne	ADRB2	45	35
O=C(/C=C/[C@H]1CCCO1)NCCCCCc1ccccc1	ZINC000819233941	CG	On-Demand	Anodyne	FAAH	40	38
O=C(/C=C/[C@H]1CCCO1)NCCCCCc1ccccc1	ZINC000819233941	CG	On-Demand	Anodyne	CES1	49	36
O=C(/C=C/[C@H]1CCCO1)NCCCCCc1ccccc1	ZINC000819233941	CG	On-Demand	Anodyne	AMP1_PLAFQ	18	40
Cc1c(C(=O)N2CCC[C@@H](CO)CC2)ccn1C	ZINC000819233945	CD	On-Demand	Anodyne	L3MBTL3	66	37
Cc1c(C(=O)N2CCC[C@H](CO)CC2)ccn1C	ZINC000819233947	CD	On-Demand	Anodyne	L3MBTL3	66	37
Cc1ccc(C(=O)N2CCC[C@@H](CO)CC2)cc1C#N	ZINC000819233954	CE	On-Demand	Mild	HRH3	26	41
Cc1ccc(C(=O)N2CCC[C@@H](CO)CC2)cc1C#N	ZINC000819233954	CE	On-Demand	Mild	L3MBTL3	86	40
O=C(/C=C\[C@H]1CCCO1)NCCCCCc1ccccc1	ZINC000819233957	CG	On-Demand	Anodyne	FAAH	40	38
O=C(/C=C\[C@H]1CCCO1)NCCCCCc1ccccc1	ZINC000819233957	CG	On-Demand	Anodyne	CES1	49	36
O=C(/C=C\[C@H]1CCCO1)NCCCCCc1ccccc1	ZINC000819233957	CG	On-Demand	Anodyne	AMP1_PLAFQ	18	40
O=C(/C=C\[C@@H]1CCCO1)NCCCCCc1ccccc1	ZINC000819233959	CG	On-Demand	Anodyne	FAAH	40	38
O=C(/C=C\[C@@H]1CCCO1)NCCCCCc1ccccc1	ZINC000819233959	CG	On-Demand	Anodyne	CES1	49	36
O=C(/C=C\[C@@H]1CCCO1)NCCCCCc1ccccc1	ZINC000819233959	CG	On-Demand	Anodyne	AMP1_PLAFQ	18	40
O=C(/C=C/[C@@H]1CCCO1)NCCCCCc1ccccc1	ZINC000819233962	CG	On-Demand	Anodyne	FAAH	40	38
O=C(/C=C/[C@@H]1CCCO1)NCCCCCc1ccccc1	ZINC000819233962	CG	On-Demand	Anodyne	CES1	49	36
O=C(/C=C/[C@@H]1CCCO1)NCCCCCc1ccccc1	ZINC000819233962	CG	On-Demand	Anodyne	AMP1_PLAFQ	18	40
Cc1ccc(C(=O)N2CCC[C@H](CO)CC2)cc1C#N	ZINC000819233965	CE	On-Demand	Mild	HRH3	26	41
Cc1ccc(C(=O)N2CCC[C@H](CO)CC2)cc1C#N	ZINC000819233965	CE	On-Demand	Mild	L3MBTL3	86	40
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819233966	GF	On-Demand	Anodyne	CDK1	17	46
C[C@H]1CN(c2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cc2C(F)(F)F)C[C@@H](C)O1	ZINC000819233976	GH	On-Demand	Anodyne	TAAR1	22	40
C/C(=C/C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1	ZINC000819233977	CF	On-Demand	Anodyne	SLC6A1	48	35
C/C(=C/C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1	ZINC000819233977	CF	On-Demand	Anodyne	PREP	55	39
C[C@H]1CN(c2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cc2C(F)(F)F)C[C@@H](C)O1	ZINC000819233980	GH	On-Demand	Anodyne	TAAR1	22	40
C/C(=C/C(=O)N1CCC[C@H](CO)CC1)c1ccccc1	ZINC000819233981	CF	On-Demand	Anodyne	SLC6A1	48	35
C/C(=C/C(=O)N1CCC[C@H](CO)CC1)c1ccccc1	ZINC000819233981	CF	On-Demand	Anodyne	PREP	55	39
CCC1(CNC[C@H](O)c2cccnc2)CCCCC1	ZINC000819233997	CG	On-Demand	Anodyne	ADRB2	21	42
CCC1(CNC[C@H](O)c2cccnc2)CCCCC1	ZINC000819233997	CG	On-Demand	Anodyne	ADRB1	23	42
CCC1(CNC[C@H](O)c2cccnc2)CCCCC1	ZINC000819233997	CG	On-Demand	Anodyne	ADRB3	90	43
CCC1(CNC[C@@H](O)c2cccnc2)CCCCC1	ZINC000819233999	CG	On-Demand	Anodyne	ADRB2	21	42
CCC1(CNC[C@@H](O)c2cccnc2)CCCCC1	ZINC000819233999	CG	On-Demand	Anodyne	ADRB1	23	42
CCC1(CNC[C@@H](O)c2cccnc2)CCCCC1	ZINC000819233999	CG	On-Demand	Anodyne	ADRB3	90	43
O[C@@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819234003	FF	On-Demand	Anodyne	ADRB1	25	42
O[C@@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819234003	FF	On-Demand	Anodyne	ADRB3	39	42
O[C@@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819234003	FF	On-Demand	Anodyne	CYP3A4	44	35
O[C@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819234006	FF	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819234006	FF	On-Demand	Anodyne	ADRB3	39	42
O[C@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819234006	FF	On-Demand	Anodyne	CYP3A4	44	35
O[C@@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1ccccc1	ZINC000819234018	ED	On-Demand	Anodyne	STAT6	53	34
O[C@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1ccccc1	ZINC000819234021	ED	On-Demand	Anodyne	STAT6	53	34
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2cccc3ccccc23)c1	ZINC000819234024	GG	On-Demand	Anodyne	CDK1	17	46
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCC(OC)CC2)c(C(F)(F)F)c1	ZINC000819234025	GJ	On-Demand	Mild	NPY2R	56	48
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCC(OC)CC2)c(C(F)(F)F)c1	ZINC000819234025	GJ	On-Demand	Mild	TAAR1	27	43
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCC(OC)CC2)c(C(F)(F)F)c1	ZINC000819234025	GJ	On-Demand	Mild	LIPG	43	34
Cn1nccc1CCNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819234026	EE	On-Demand	Anodyne	CYNT	41	45
Cn1nccc1CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819234035	CD	On-Demand	Anodyne	ADRB1	38	40
Cn1nccc1CCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819234035	CD	On-Demand	Anodyne	ADRB3	33	40
Cc1cc(F)ccc1[C@@H](O)CNCCCC(=O)OC(C)C	ZINC000819234037	CE	On-Demand	Anodyne	LEF	81	34
Cn1nccc1CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819234038	CD	On-Demand	Anodyne	ADRB1	38	40
Cn1nccc1CCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819234038	CD	On-Demand	Anodyne	ADRB3	33	40
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2cc3ccccc3o2)c1	ZINC000819234043	GF	On-Demand	Anodyne	CDK1	15	40
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819234045	EE	On-Demand	Anodyne	ADRB3	43	38
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819234045	EE	On-Demand	Anodyne	CDK1	17	45
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819234045	EE	On-Demand	Anodyne	BACE1	16	44
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819234047	EE	On-Demand	Anodyne	ADRB3	43	38
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819234047	EE	On-Demand	Anodyne	CDK1	17	45
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819234047	EE	On-Demand	Anodyne	BACE1	16	44
O[C@@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1ccccc1Cl	ZINC000819234050	FF	On-Demand	Anodyne	STAT6	48	33
CSc1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819234065	DD	On-Demand	Anodyne	ADRB2	50	49
CSc1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819234065	DD	On-Demand	Anodyne	ADRB1	76	49
CSc1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819234065	DD	On-Demand	Anodyne	ADRB3	52	49
CSc1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819234067	DD	On-Demand	Anodyne	ADRB2	50	49
CSc1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819234067	DD	On-Demand	Anodyne	ADRB1	76	49
CSc1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819234067	DD	On-Demand	Anodyne	ADRB3	52	49
O[C@H](CN[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1cccnc1	ZINC000819234103	FI	On-Demand	Anodyne	ADRB1	20	40
O[C@H](CN[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1cccnc1	ZINC000819234103	FI	On-Demand	Anodyne	ADRB3	83	49
O[C@H](CN[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1cccnc1	ZINC000819234105	FI	On-Demand	Anodyne	ADRB1	20	40
O[C@H](CN[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1cccnc1	ZINC000819234105	FI	On-Demand	Anodyne	ADRB3	83	49
COc1cccc(OC)c1OC[C@@H](O)CNCCc1ccnn1C	ZINC000819234106	ED	On-Demand	Anodyne	ADRB2	51	45
COc1cccc(OC)c1OC[C@@H](O)CNCCc1ccnn1C	ZINC000819234106	ED	On-Demand	Anodyne	ADRB1	69	43
COc1cccc(OC)c1OC[C@@H](O)CNCCc1ccnn1C	ZINC000819234106	ED	On-Demand	Anodyne	ADRB3	44	42
O[C@@H](CN[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1cccnc1	ZINC000819234107	FI	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CN[C@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1cccnc1	ZINC000819234107	FI	On-Demand	Anodyne	ADRB3	83	49
COc1cccc(OC)c1OC[C@H](O)CNCCc1ccnn1C	ZINC000819234108	ED	On-Demand	Anodyne	ADRB2	51	45
COc1cccc(OC)c1OC[C@H](O)CNCCc1ccnn1C	ZINC000819234108	ED	On-Demand	Anodyne	ADRB1	69	43
COc1cccc(OC)c1OC[C@H](O)CNCCc1ccnn1C	ZINC000819234108	ED	On-Demand	Anodyne	ADRB3	44	42
Cn1nccc1CCNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819234109	FF	On-Demand	Anodyne	ADRB2	72	51
Cn1nccc1CCNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819234109	FF	On-Demand	Anodyne	ADRB1	108	53
Cn1nccc1CCNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819234109	FF	On-Demand	Anodyne	GRIN1	15	43
Cn1nccc1CCNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819234109	FF	On-Demand	Anodyne	ADRB3	82	53
O[C@@H](CN[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1cccnc1	ZINC000819234110	FI	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CN[C@@H]1CCCc2sc(-c3ccc(F)cc3)nc21)c1cccnc1	ZINC000819234110	FI	On-Demand	Anodyne	ADRB3	83	49
Cn1nccc1CCNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819234111	FF	On-Demand	Anodyne	ADRB2	72	51
Cn1nccc1CCNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819234111	FF	On-Demand	Anodyne	ADRB1	108	53
Cn1nccc1CCNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819234111	FF	On-Demand	Anodyne	GRIN1	15	43
Cn1nccc1CCNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819234111	FF	On-Demand	Anodyne	ADRB3	82	53
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819234143	GF	On-Demand	Anodyne	CDK1	17	44
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)C2CC2)c1	ZINC000819234144	DD	On-Demand	Anodyne	CDK1	16	41
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)C2CC2)c1	ZINC000819234145	DD	On-Demand	Anodyne	CDK1	16	41
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2NC(=O)OC(C)(C)C)c1	ZINC000819234158	GI	On-Demand	Anodyne	KCNQ2	24	40
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2NC(=O)OC(C)(C)C)c1	ZINC000819234158	GI	On-Demand	Anodyne	KCNK3	60	31
CC(=O)Nc1cccc(CC(=O)Nc2ccccc2NC(=O)OC(C)(C)C)c1	ZINC000819234158	GI	On-Demand	Anodyne	KCNK9	55	31
COc1ccccc1[C@@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819234163	CH	On-Demand	Anodyne	HTR1A	20	42
COc1ccccc1[C@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819234164	CH	On-Demand	Anodyne	HTR1A	20	42
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1c(Cl)cccc1Cl	ZINC000819234210	EH	On-Demand	Reactive	TYK2	59	44
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1c(Cl)cccc1Cl	ZINC000819234213	EH	On-Demand	Reactive	TYK2	59	44
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)CCCc1ccccc1	ZINC000819234214	DF	On-Demand	Reactive	FKBP1A	35	40
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)CCCc1ccccc1	ZINC000819234214	DF	On-Demand	Reactive	SIGMAR1	19	40
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)CCCc1ccccc1	ZINC000819234214	DF	On-Demand	Reactive	PREP	47	42
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)CCCc1ccccc1	ZINC000819234214	DF	On-Demand	Reactive	NAAA	38	41
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)CCCc1ccccc1	ZINC000819234217	DF	On-Demand	Reactive	FKBP1A	35	40
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)CCCc1ccccc1	ZINC000819234217	DF	On-Demand	Reactive	SIGMAR1	19	40
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)CCCc1ccccc1	ZINC000819234217	DF	On-Demand	Reactive	PREP	47	42
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)CCCc1ccccc1	ZINC000819234217	DF	On-Demand	Reactive	NAAA	38	41
CCC[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819234231	FG	On-Demand	Anodyne	TIMP3	54	32
CCC[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819234231	FG	On-Demand	Anodyne	CAPNS1	41	30
CCC[C@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819234231	FG	On-Demand	Anodyne	CAPN1	41	34
CCC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819234232	FG	On-Demand	Anodyne	TIMP3	54	32
CCC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819234232	FG	On-Demand	Anodyne	CAPNS1	41	30
CCC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819234232	FG	On-Demand	Anodyne	CAPN1	41	34
CCC[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819234233	FG	On-Demand	Anodyne	TIMP3	54	32
CCC[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819234233	FG	On-Demand	Anodyne	CAPNS1	41	30
CCC[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819234233	FG	On-Demand	Anodyne	CAPN1	41	34
CCC[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819234234	FG	On-Demand	Anodyne	TIMP3	54	32
CCC[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819234234	FG	On-Demand	Anodyne	CAPNS1	41	30
CCC[C@@H](Cc1ccccc1)NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819234234	FG	On-Demand	Anodyne	CAPN1	41	34
COc1cccc([S@@](=O)CC(=O)NNC(=O)CCCc2ccccc2)c1	ZINC000819234236	FD	On-Demand	Reactive	LTB4R	21	44
COc1cccc([S@@](=O)CC(=O)NNC(=O)CCCc2ccccc2)c1	ZINC000819234236	FD	On-Demand	Reactive	MTNR1A	50	45
COc1cccc([S@@](=O)CC(=O)NNC(=O)CCCc2ccccc2)c1	ZINC000819234236	FD	On-Demand	Reactive	MTNR1B	52	45
COc1cccc([S@@](=O)CC(=O)NNC(=O)CCCc2ccccc2)c1	ZINC000819234236	FD	On-Demand	Reactive	CRTM	50	34
O[C@@H](CNCCC1=CCCCCC1)c1cccnc1	ZINC000819234245	CF	On-Demand	Anodyne	ADRB2	37	48
O[C@@H](CNCCC1=CCCCCC1)c1cccnc1	ZINC000819234245	CF	On-Demand	Anodyne	ADRB1	44	49
O[C@@H](CNCCC1=CCCCCC1)c1cccnc1	ZINC000819234245	CF	On-Demand	Anodyne	ADRB3	142	53
O[C@H](CNCCC1=CCCCCC1)c1cccnc1	ZINC000819234246	CF	On-Demand	Anodyne	ADRB2	37	48
O[C@H](CNCCC1=CCCCCC1)c1cccnc1	ZINC000819234246	CF	On-Demand	Anodyne	ADRB1	44	49
O[C@H](CNCCC1=CCCCCC1)c1cccnc1	ZINC000819234246	CF	On-Demand	Anodyne	ADRB3	142	53
CC(C)(C)OC(=O)N1CCC(CC(=O)N2CCC[C@H](CO)CC2)CC1	ZINC000819234250	FF	On-Demand	Anodyne	PREP	15	43
CC(C)(C)OC(=O)N1CCC(CC(=O)N2CCC[C@@H](CO)CC2)CC1	ZINC000819234251	FF	On-Demand	Anodyne	PREP	15	43
CC(C)(C)NS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819234252	HF	On-Demand	Anodyne	SFRP1	101	41
CC(C)(C)NS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819234252	HF	On-Demand	Anodyne	WNT3	70	32
CC(C)(C)NS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819234253	HF	On-Demand	Anodyne	SFRP1	101	41
CC(C)(C)NS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819234253	HF	On-Demand	Anodyne	WNT3	70	32
Cc1cc(C)c(/C=C/C(=O)N2CCC[C@@H](CO)CC2)cc1C	ZINC000819234260	DG	On-Demand	Anodyne	ITGAL	42	34
Cc1cc(C)c(/C=C\C(=O)N2CCC[C@@H](CO)CC2)cc1C	ZINC000819234261	DG	On-Demand	Anodyne	ITGAL	42	34
Cc1cc(C)c(/C=C/C(=O)N2CCC[C@H](CO)CC2)cc1C	ZINC000819234262	DG	On-Demand	Anodyne	ITGAL	42	34
Cc1cc(C)c(/C=C\C(=O)N2CCC[C@H](CO)CC2)cc1C	ZINC000819234263	DG	On-Demand	Anodyne	ITGAL	42	34
O=C(Cc1cc2ccccc2o1)N1CCC[C@@H](CO)CC1	ZINC000819234266	CF	On-Demand	Anodyne	PREP	15	62
O=C(Cc1cc2ccccc2o1)N1CCC[C@H](CO)CC1	ZINC000819234267	CF	On-Demand	Anodyne	PREP	15	62
O=C(NCCCC(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819234288	EE	On-Demand	Anodyne	F2	23	42
O=C(NCCCC(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819234288	EE	On-Demand	Anodyne	ACE	19	48
O=C(NCCCC(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819234288	EE	On-Demand	Anodyne	GRIN2B	44	43
O=C(NCCCC(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819234288	EE	On-Demand	Anodyne	ELANE	20	40
O=C(NCCCC(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819234288	EE	On-Demand	Anodyne	CTSB	32	40
O=C(NCCCC(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819234288	EE	On-Demand	Anodyne	CTSK	26	40
O=C(NCCCC(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819234288	EE	On-Demand	Anodyne	CTSL	32	40
O=C(NCCCC(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819234288	EE	On-Demand	Anodyne	C3AR1	40	37
O=C(NCCCC(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819234288	EE	On-Demand	Anodyne	PREP	86	55
O=C(NCCCC(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819234288	EE	On-Demand	Anodyne	CAPN1	44	38
O=C(NCCCC(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819234288	EE	On-Demand	Anodyne	CAPN2	81	38
O=C(NCCCC(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819234288	EE	On-Demand	Anodyne	TGM2	41	43
O=C(NCCCC(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819234288	EE	On-Demand	Anodyne	NPR	56	35
O=C(NCCCC(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819234288	EE	On-Demand	Anodyne	F13A1	27	40
O=C(NCCCC(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819234288	EE	On-Demand	Anodyne	TMPRSS11D	30	40
O=C(NCCCC(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819234289	EE	On-Demand	Anodyne	F2	23	42
O=C(NCCCC(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819234289	EE	On-Demand	Anodyne	ACE	19	48
O=C(NCCCC(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819234289	EE	On-Demand	Anodyne	GRIN2B	44	43
O=C(NCCCC(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819234289	EE	On-Demand	Anodyne	ELANE	20	40
O=C(NCCCC(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819234289	EE	On-Demand	Anodyne	CTSB	32	40
O=C(NCCCC(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819234289	EE	On-Demand	Anodyne	CTSK	26	40
O=C(NCCCC(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819234289	EE	On-Demand	Anodyne	CTSL	32	40
O=C(NCCCC(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819234289	EE	On-Demand	Anodyne	C3AR1	40	37
O=C(NCCCC(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819234289	EE	On-Demand	Anodyne	PREP	86	55
O=C(NCCCC(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819234289	EE	On-Demand	Anodyne	CAPN1	44	38
O=C(NCCCC(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819234289	EE	On-Demand	Anodyne	CAPN2	81	38
O=C(NCCCC(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819234289	EE	On-Demand	Anodyne	TGM2	41	43
O=C(NCCCC(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819234289	EE	On-Demand	Anodyne	NPR	56	35
O=C(NCCCC(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819234289	EE	On-Demand	Anodyne	F13A1	27	40
O=C(NCCCC(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819234289	EE	On-Demand	Anodyne	TMPRSS11D	30	40
O=C([C@H](F)c1ccc(C(F)(F)F)cc1)N1CCC[C@@H](CO)CC1	ZINC000819234300	EG	On-Demand	Anodyne	MTTP	26	41
O=C([C@@H](F)c1ccc(C(F)(F)F)cc1)N1CCC[C@H](CO)CC1	ZINC000819234301	EG	On-Demand	Anodyne	MTTP	26	41
O=C([C@@H](F)c1ccc(C(F)(F)F)cc1)N1CCC[C@@H](CO)CC1	ZINC000819234302	EG	On-Demand	Anodyne	MTTP	26	41
O=C([C@H](F)c1ccc(C(F)(F)F)cc1)N1CCC[C@H](CO)CC1	ZINC000819234303	EG	On-Demand	Anodyne	MTTP	26	41
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819234315	DG	On-Demand	Anodyne	NPY2R	93	45
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819234315	DG	On-Demand	Anodyne	MTOR	53	36
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819234316	DG	On-Demand	Anodyne	NPY2R	93	45
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819234316	DG	On-Demand	Anodyne	MTOR	53	36
Cc1c(NC(=O)Cc2ccc(-n3cnnc3)cc2)n[nH]c1C1CC1	ZINC000819234342	DE	On-Demand	Anodyne	CDK2	16	41
Cc1c(NC(=O)Cc2ccc(-n3cnnc3)cc2)n[nH]c1C1CC1	ZINC000819234342	DE	On-Demand	Anodyne	CDK1	16	41
CON(C)C(=O)CCNCc1ccc(OCc2ccccc2F)cc1	ZINC000819234347	EF	On-Demand	Anodyne	FFAR4	44	38
CC(=O)Nc1cccc(CC(=O)Nc2n[nH]c(C3CC3)c2C)c1	ZINC000819234355	DF	On-Demand	Anodyne	CDK2	17	45
O=C1C[C@H](NC[C@@H](O)c2cccnc2)CN1Cc1ccccc1C(F)(F)F	ZINC000819234356	GF	On-Demand	Anodyne	ADRB3	40	45
O=C1C[C@@H](NC[C@@H](O)c2cccnc2)CN1Cc1ccccc1C(F)(F)F	ZINC000819234357	GF	On-Demand	Anodyne	ADRB3	40	45
O=C1C[C@H](NC[C@H](O)c2cccnc2)CN1Cc1ccccc1C(F)(F)F	ZINC000819234358	GF	On-Demand	Anodyne	ADRB3	40	45
O=C1C[C@@H](NC[C@H](O)c2cccnc2)CN1Cc1ccccc1C(F)(F)F	ZINC000819234359	GF	On-Demand	Anodyne	ADRB3	40	45
O=C(Nc1cc(C(F)(F)F)ccc1F)C(F)=C1CCC1	ZINC000819234382	CI	On-Demand	Anodyne	TEK	44	39
COc1ccccc1COC[C@@H](O)CNCCc1ccnn1C	ZINC000819234426	DD	On-Demand	Anodyne	ADRB2	31	41
COc1ccccc1COC[C@@H](O)CNCCc1ccnn1C	ZINC000819234426	DD	On-Demand	Anodyne	ADRB1	40	44
COc1ccccc1COC[C@@H](O)CNCCc1ccnn1C	ZINC000819234426	DD	On-Demand	Anodyne	ADRB3	27	44
COc1ccccc1COC[C@H](O)CNCCc1ccnn1C	ZINC000819234429	DD	On-Demand	Anodyne	ADRB2	31	41
COc1ccccc1COC[C@H](O)CNCCc1ccnn1C	ZINC000819234429	DD	On-Demand	Anodyne	ADRB1	40	44
COc1ccccc1COC[C@H](O)CNCCc1ccnn1C	ZINC000819234429	DD	On-Demand	Anodyne	ADRB3	27	44
O[C@@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1ccc(F)cc1F	ZINC000819234431	FE	On-Demand	Anodyne	STAT6	41	35
O[C@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1ccc(F)cc1F	ZINC000819234435	FE	On-Demand	Anodyne	STAT6	41	35
Cn1nccc1CCNC[C@H](O)COC(c1ccccc1)c1ccccc1	ZINC000819234510	FF	On-Demand	Anodyne	ADRB3	43	39
Cn1nccc1CCNC[C@@H](O)COC(c1ccccc1)c1ccccc1	ZINC000819234513	FF	On-Demand	Anodyne	ADRB3	43	39
CCc1noc(-c2ccc(CCNC(=O)/C=C/[C@@H]3CCCO3)cc2)n1	ZINC000819234524	EF	On-Demand	Anodyne	SPHK1	20	43
CCc1noc(-c2ccc(CCNC(=O)/C=C\[C@@H]3CCCO3)cc2)n1	ZINC000819234527	EF	On-Demand	Anodyne	SPHK1	20	43
CCc1noc(-c2ccc(CCNC(=O)/C=C\[C@H]3CCCO3)cc2)n1	ZINC000819234531	EF	On-Demand	Anodyne	SPHK1	20	43
CCc1noc(-c2ccc(CCNC(=O)/C=C/[C@H]3CCCO3)cc2)n1	ZINC000819234535	EF	On-Demand	Anodyne	SPHK1	20	43
CN(C[C@@H](O)CNCc1cnc(N2CCOCC2)c(F)c1)C(=O)OC(C)(C)C	ZINC000819234545	GD	On-Demand	Anodyne	STAT6	44	33
CN(C[C@H](O)CNCc1cnc(N2CCOCC2)c(F)c1)C(=O)OC(C)(C)C	ZINC000819234548	GD	On-Demand	Anodyne	STAT6	44	33
Cc1cc(F)ccc1[C@@H](O)CNCc1ccc(C(F)F)cc1	ZINC000819234566	DH	On-Demand	Anodyne	LEF	80	37
Cc1ccccc1[C@@H](O)CNCc1cccc(N2CCCS2(=O)=O)c1	ZINC000819234567	FE	On-Demand	Anodyne	CDK1	18	41
Cn1nccc1CCNCCC(=O)Nc1cccnc1	ZINC000819234568	CC	On-Demand	Anodyne	ADRB3	28	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NCCS(=O)(=O)CC(=O)OC(C)(C)C	ZINC000819234584	GD	On-Demand	Anodyne	DRD4	15	43
C[C@H]1CN(Cc2ccccc2)C[C@H]1NCCS(=O)(=O)CC(=O)OC(C)(C)C	ZINC000819234590	GD	On-Demand	Anodyne	DRD4	15	43
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NCCS(=O)(=O)CC(=O)OC(C)(C)C	ZINC000819234594	GD	On-Demand	Anodyne	DRD4	15	43
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)c1ccc(Br)cc1	ZINC000819234595	GH	On-Demand	Anodyne	OPRL1	18	48
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NCCS(=O)(=O)CC(=O)OC(C)(C)C	ZINC000819234596	GD	On-Demand	Anodyne	DRD4	15	43
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)c1ccc(Br)cc1	ZINC000819234597	GH	On-Demand	Anodyne	OPRL1	18	48
C=C(C)C(C)(C)C(=O)NNC(=O)c1c(Cl)cccc1Cl	ZINC000819234617	DG	On-Demand	Reactive	ECR	40	34
C[C@@H]1C[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819234620	CE	On-Demand	Mild	PAPA1_CARPA	41	52
C[C@@H]1C[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819234620	CE	On-Demand	Mild	CTSK	17	49
C[C@@H]1C[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819234622	CE	On-Demand	Mild	PAPA1_CARPA	41	52
C[C@@H]1C[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819234622	CE	On-Demand	Mild	CTSK	17	49
C[C@@H]1C[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819234624	CE	On-Demand	Mild	PAPA1_CARPA	41	52
C[C@@H]1C[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819234624	CE	On-Demand	Mild	CTSK	17	49
C[C@@H]1C[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819234627	CE	On-Demand	Mild	PAPA1_CARPA	41	52
C[C@@H]1C[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819234627	CE	On-Demand	Mild	CTSK	17	49
C[Si](C)(CNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccccc1	ZINC000819234629	GE	On-Demand	Anodyne	ADRB1	44	41
C[Si](C)(CNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccccc1	ZINC000819234629	GE	On-Demand	Anodyne	ACOX1	49	33
O[C@H](CN[C@@H]1CCO[C@@H](c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819234631	EH	On-Demand	Anodyne	ADRB1	29	43
O[C@H](CN[C@@H]1CCO[C@@H](c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819234631	EH	On-Demand	Anodyne	ADRB3	47	48
O[C@H](CN[C@H]1CCO[C@@H](c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819234633	EH	On-Demand	Anodyne	ADRB1	29	43
O[C@H](CN[C@H]1CCO[C@@H](c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819234633	EH	On-Demand	Anodyne	ADRB3	47	48
C[Si](C)(CNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccccc1	ZINC000819234635	GE	On-Demand	Anodyne	ADRB1	44	41
C[Si](C)(CNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)c1ccccc1	ZINC000819234635	GE	On-Demand	Anodyne	ACOX1	49	33
O[C@H](CN[C@H]1CCO[C@H](c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819234636	EH	On-Demand	Anodyne	ADRB1	29	43
O[C@H](CN[C@H]1CCO[C@H](c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819234636	EH	On-Demand	Anodyne	ADRB3	47	48
O[C@H](CN[C@@H]1CCO[C@H](c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819234638	EH	On-Demand	Anodyne	ADRB1	29	43
O[C@H](CN[C@@H]1CCO[C@H](c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819234638	EH	On-Demand	Anodyne	ADRB3	47	48
CC(=O)c1cccc(OC[C@@H](O)CNCCc2ccnn2C)c1	ZINC000819234639	DD	On-Demand	Anodyne	ADRB2	52	45
CC(=O)c1cccc(OC[C@@H](O)CNCCc2ccnn2C)c1	ZINC000819234639	DD	On-Demand	Anodyne	ADRB1	90	46
CC(=O)c1cccc(OC[C@@H](O)CNCCc2ccnn2C)c1	ZINC000819234639	DD	On-Demand	Anodyne	ADRB3	66	46
CC(=O)c1cccc(OC[C@@H](O)CNCCc2ccnn2C)c1	ZINC000819234639	DD	On-Demand	Anodyne	ABCB1	21	49
CC(=O)c1cccc(OC[C@H](O)CNCCc2ccnn2C)c1	ZINC000819234642	DD	On-Demand	Anodyne	ADRB2	52	45
CC(=O)c1cccc(OC[C@H](O)CNCCc2ccnn2C)c1	ZINC000819234642	DD	On-Demand	Anodyne	ADRB1	90	46
CC(=O)c1cccc(OC[C@H](O)CNCCc2ccnn2C)c1	ZINC000819234642	DD	On-Demand	Anodyne	ADRB3	66	46
CC(=O)c1cccc(OC[C@H](O)CNCCc2ccnn2C)c1	ZINC000819234642	DD	On-Demand	Anodyne	ABCB1	21	49
C/C=C/c1ccc(OC[C@@H](O)CNCCc2ccnn2C)c(OC)c1	ZINC000819234644	EE	On-Demand	Anodyne	ADRB2	30	58
C/C=C/c1ccc(OC[C@@H](O)CNCCc2ccnn2C)c(OC)c1	ZINC000819234644	EE	On-Demand	Anodyne	ADRB1	39	58
C/C=C\c1ccc(OC[C@@H](O)CNCCc2ccnn2C)c(OC)c1	ZINC000819234647	EE	On-Demand	Anodyne	ADRB2	30	58
C/C=C\c1ccc(OC[C@@H](O)CNCCc2ccnn2C)c(OC)c1	ZINC000819234647	EE	On-Demand	Anodyne	ADRB1	39	58
C/C=C/c1ccc(OC[C@H](O)CNCCc2ccnn2C)c(OC)c1	ZINC000819234650	EE	On-Demand	Anodyne	ADRB2	30	58
C/C=C/c1ccc(OC[C@H](O)CNCCc2ccnn2C)c(OC)c1	ZINC000819234650	EE	On-Demand	Anodyne	ADRB1	39	58
C/C=C\c1ccc(OC[C@H](O)CNCCc2ccnn2C)c(OC)c1	ZINC000819234653	EE	On-Demand	Anodyne	ADRB2	30	58
C/C=C\c1ccc(OC[C@H](O)CNCCc2ccnn2C)c(OC)c1	ZINC000819234653	EE	On-Demand	Anodyne	ADRB1	39	58
O[C@@H](CNCc1ccc(C(F)F)cc1)c1cc(F)ccc1F	ZINC000819234675	DH	On-Demand	Anodyne	LEF	49	36
O[C@H](CNCc1ccc(C(F)F)cc1)c1cc(F)ccc1F	ZINC000819234676	DH	On-Demand	Anodyne	LEF	49	36
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1cnc(N2CCOCC2)c(F)c1	ZINC000819234736	GD	On-Demand	Anodyne	STAT6	48	32
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1cnc(N2CCOCC2)c(F)c1	ZINC000819234737	GD	On-Demand	Anodyne	STAT6	48	32
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2ccc(F)cn2)c1	ZINC000819234740	FD	On-Demand	Anodyne	CDK1	16	45
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819234741	FD	On-Demand	Anodyne	CDK1	16	45
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819234754	GE	On-Demand	Anodyne	DRD4	22	43
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819234754	GE	On-Demand	Anodyne	ACHE	15	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819234754	GE	On-Demand	Anodyne	SIGMAR1	17	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819234754	GE	On-Demand	Anodyne	FPR1	43	35
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819234755	GE	On-Demand	Anodyne	DRD4	22	43
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819234755	GE	On-Demand	Anodyne	ACHE	15	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819234755	GE	On-Demand	Anodyne	SIGMAR1	17	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819234755	GE	On-Demand	Anodyne	FPR1	43	35
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819234756	GE	On-Demand	Anodyne	DRD4	22	43
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819234756	GE	On-Demand	Anodyne	ACHE	15	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819234756	GE	On-Demand	Anodyne	SIGMAR1	17	41
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819234756	GE	On-Demand	Anodyne	FPR1	43	35
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819234757	GE	On-Demand	Anodyne	DRD4	22	43
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819234757	GE	On-Demand	Anodyne	ACHE	15	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819234757	GE	On-Demand	Anodyne	SIGMAR1	17	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819234757	GE	On-Demand	Anodyne	FPR1	43	35
CN(C)CCOc1ccc(CNC(=O)C(F)=C2CCC2)cc1	ZINC000819234758	DF	On-Demand	Anodyne	LTA4H	16	42
CN(C)CCOc1ccc(CNC(=O)C(F)=C2CCC2)cc1	ZINC000819234758	DF	On-Demand	Anodyne	ESRRG	43	32
O[C@@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cccc2ccccc12	ZINC000819234762	GG	On-Demand	Anodyne	STAT6	50	35
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819234779	ED	On-Demand	Anodyne	ADRB2	25	42
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819234779	ED	On-Demand	Anodyne	ADRB1	27	43
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819234779	ED	On-Demand	Anodyne	ADRB3	101	47
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819234781	ED	On-Demand	Anodyne	ADRB2	25	42
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819234781	ED	On-Demand	Anodyne	ADRB1	27	43
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819234781	ED	On-Demand	Anodyne	ADRB3	101	47
COC(=O)c1cc(OC)ccc1NC(=O)C(F)=C1CCC1	ZINC000819234783	CF	On-Demand	Anodyne	AKR1C2	40	34
Cn1nccc1CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819234785	EE	On-Demand	Anodyne	ADRB2	66	53
Cn1nccc1CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819234785	EE	On-Demand	Anodyne	ADRB1	88	48
Cn1nccc1CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819234785	EE	On-Demand	Anodyne	ADRB3	63	48
Cn1nccc1CCNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819234785	EE	On-Demand	Anodyne	CASR	41	37
Cn1nccc1CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819234787	EE	On-Demand	Anodyne	ADRB2	66	53
Cn1nccc1CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819234787	EE	On-Demand	Anodyne	ADRB1	88	48
Cn1nccc1CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819234787	EE	On-Demand	Anodyne	ADRB3	63	48
Cn1nccc1CCNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819234787	EE	On-Demand	Anodyne	CASR	41	37
CCOc1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819234799	DD	On-Demand	Anodyne	ADRB2	60	52
CCOc1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819234799	DD	On-Demand	Anodyne	ADRB1	87	52
CCOc1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819234799	DD	On-Demand	Anodyne	GRIN1	17	45
CCOc1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819234799	DD	On-Demand	Anodyne	ADRB3	60	52
CCOc1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819234802	DD	On-Demand	Anodyne	ADRB2	60	52
CCOc1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819234802	DD	On-Demand	Anodyne	ADRB1	87	52
CCOc1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819234802	DD	On-Demand	Anodyne	GRIN1	17	45
CCOc1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819234802	DD	On-Demand	Anodyne	ADRB3	60	52
CN(C)c1ccc(NC(=O)CCNC2Cc3ccccc3C2)cc1	ZINC000819234836	DF	On-Demand	Anodyne	MTNR1B	19	40
O[C@@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1ccc(F)cc1	ZINC000819234837	EE	On-Demand	Anodyne	STAT6	41	35
Cc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)c(C)c1	ZINC000819234838	FG	On-Demand	Anodyne	ADRB2	32	44
Cc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)c(C)c1	ZINC000819234838	FG	On-Demand	Anodyne	ADRB1	19	44
Cc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)c(C)c1	ZINC000819234838	FG	On-Demand	Anodyne	ADRB3	18	40
Cc1ccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)c(C)c1	ZINC000819234838	FG	On-Demand	Anodyne	ABCB1	20	43
O[C@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1ccc(F)cc1	ZINC000819234839	EE	On-Demand	Anodyne	STAT6	41	35
Cc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)c(C)c1	ZINC000819234840	FG	On-Demand	Anodyne	ADRB2	32	44
Cc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)c(C)c1	ZINC000819234840	FG	On-Demand	Anodyne	ADRB1	19	44
Cc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)c(C)c1	ZINC000819234840	FG	On-Demand	Anodyne	ADRB3	18	40
Cc1ccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)c(C)c1	ZINC000819234840	FG	On-Demand	Anodyne	ABCB1	20	43
CC[C@@H](CC(F)(F)F)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819234852	CH	On-Demand	Anodyne	ADRB1	29	47
CC[C@@H](CC(F)(F)F)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819234852	CH	On-Demand	Anodyne	ADRB3	43	47
C=C(C)C(C)(C)C(=O)NNC(=O)CCCc1ccccc1	ZINC000819234853	CF	On-Demand	Reactive	CES1	41	38
CC[C@@H](CC(F)(F)F)NC[C@H](O)c1cccc(Cl)c1	ZINC000819234854	CH	On-Demand	Anodyne	ADRB1	29	47
CC[C@@H](CC(F)(F)F)NC[C@H](O)c1cccc(Cl)c1	ZINC000819234854	CH	On-Demand	Anodyne	ADRB3	43	47
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)COc1cccc2[nH]ccc12	ZINC000819234858	GG	On-Demand	Anodyne	ADRB2	29	74
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)COc1cccc2[nH]ccc12	ZINC000819234858	GG	On-Demand	Anodyne	ADRB1	30	74
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)COc1cccc2[nH]ccc12	ZINC000819234858	GG	On-Demand	Anodyne	ADRB3	25	54
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)COc1cccc2[nH]ccc12	ZINC000819234861	GG	On-Demand	Anodyne	ADRB2	29	74
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)COc1cccc2[nH]ccc12	ZINC000819234861	GG	On-Demand	Anodyne	ADRB1	30	74
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)COc1cccc2[nH]ccc12	ZINC000819234861	GG	On-Demand	Anodyne	ADRB3	25	54
Cn1nccc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819234903	CD	On-Demand	Anodyne	ADRB2	63	40
Cn1nccc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819234903	CD	On-Demand	Anodyne	ADRB1	76	53
Cn1nccc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819234903	CD	On-Demand	Anodyne	ADRB3	130	53
Cn1nccc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819234905	CD	On-Demand	Anodyne	ADRB2	63	40
Cn1nccc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819234905	CD	On-Demand	Anodyne	ADRB1	76	53
Cn1nccc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819234905	CD	On-Demand	Anodyne	ADRB3	130	53
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819234923	GF	On-Demand	Anodyne	CDK1	17	41
CC(=O)c1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819234932	DD	On-Demand	Anodyne	ADRB2	53	50
CC(=O)c1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819234932	DD	On-Demand	Anodyne	ADRB1	92	50
CC(=O)c1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819234932	DD	On-Demand	Anodyne	GRIN1	17	43
CC(=O)c1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819234932	DD	On-Demand	Anodyne	ADRB3	62	50
CC(=O)c1ccc(OC[C@@H](O)CNCCc2ccnn2C)cc1	ZINC000819234932	DD	On-Demand	Anodyne	ABCB1	17	59
CC(=O)c1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819234936	DD	On-Demand	Anodyne	ADRB2	53	50
CC(=O)c1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819234936	DD	On-Demand	Anodyne	ADRB1	92	50
CC(=O)c1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819234936	DD	On-Demand	Anodyne	GRIN1	17	43
CC(=O)c1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819234936	DD	On-Demand	Anodyne	ADRB3	62	50
CC(=O)c1ccc(OC[C@H](O)CNCCc2ccnn2C)cc1	ZINC000819234936	DD	On-Demand	Anodyne	ABCB1	17	59
O[C@H](CN[C@H]1CCO[C@@H](C2CC2)C1)c1cccc(Cl)c1	ZINC000819234966	CF	On-Demand	Anodyne	ADRB1	28	42
O[C@H](CN[C@H]1CCO[C@@H](C2CC2)C1)c1cccc(Cl)c1	ZINC000819234966	CF	On-Demand	Anodyne	ADRB3	45	47
O[C@H](CN[C@H]1CCO[C@@H](C2CC2)C1)c1cccc(Cl)c1	ZINC000819234966	CF	On-Demand	Anodyne	CYP3A4	46	36
O[C@@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1ccc(F)cn1	ZINC000819234967	FD	On-Demand	Anodyne	STAT6	40	35
O[C@H](CN[C@@H]1CCO[C@@H](C2CC2)C1)c1cccc(Cl)c1	ZINC000819234969	CF	On-Demand	Anodyne	ADRB1	28	42
O[C@H](CN[C@@H]1CCO[C@@H](C2CC2)C1)c1cccc(Cl)c1	ZINC000819234969	CF	On-Demand	Anodyne	ADRB3	45	47
O[C@H](CN[C@@H]1CCO[C@@H](C2CC2)C1)c1cccc(Cl)c1	ZINC000819234969	CF	On-Demand	Anodyne	CYP3A4	46	36
O[C@H](CN[C@@H]1CCO[C@H](C2CC2)C1)c1cccc(Cl)c1	ZINC000819234971	CF	On-Demand	Anodyne	ADRB1	28	42
O[C@H](CN[C@@H]1CCO[C@H](C2CC2)C1)c1cccc(Cl)c1	ZINC000819234971	CF	On-Demand	Anodyne	ADRB3	45	47
O[C@H](CN[C@@H]1CCO[C@H](C2CC2)C1)c1cccc(Cl)c1	ZINC000819234971	CF	On-Demand	Anodyne	CYP3A4	46	36
O[C@H](CN[C@H]1CCO[C@H](C2CC2)C1)c1cccc(Cl)c1	ZINC000819234973	CF	On-Demand	Anodyne	ADRB1	28	42
O[C@H](CN[C@H]1CCO[C@H](C2CC2)C1)c1cccc(Cl)c1	ZINC000819234973	CF	On-Demand	Anodyne	ADRB3	45	47
O[C@H](CN[C@H]1CCO[C@H](C2CC2)C1)c1cccc(Cl)c1	ZINC000819234973	CF	On-Demand	Anodyne	CYP3A4	46	36
O=C(CCCc1ccccc1)NNC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819234989	GH	On-Demand	Reactive	CES1	30	41
COc1cccc([S@@](=O)CC(=O)NNC(=O)CCC(C)C)c1	ZINC000819234993	ED	On-Demand	Reactive	MTNR1A	34	42
COc1cccc([S@@](=O)CC(=O)NNC(=O)CCC(C)C)c1	ZINC000819234993	ED	On-Demand	Reactive	MTNR1B	35	42
Cn1nccc1CCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819234996	EC	On-Demand	Anodyne	ADRB1	62	38
Cn1nccc1CCNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819234996	EC	On-Demand	Anodyne	ADRB3	43	45
Cn1nccc1CCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819234999	EC	On-Demand	Anodyne	ADRB1	62	38
Cn1nccc1CCNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819234999	EC	On-Demand	Anodyne	ADRB3	43	45
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)c1cc(F)ccc1F	ZINC000819235018	EG	On-Demand	Anodyne	OPRL1	17	40
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)c1cc(F)ccc1F	ZINC000819235019	EG	On-Demand	Anodyne	OPRL1	17	40
O[C@@H](CNCCC[C@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819235023	CG	On-Demand	Anodyne	ADRB2	41	41
O[C@@H](CNCCC[C@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819235023	CG	On-Demand	Anodyne	ADRB1	53	46
O[C@@H](CNCCC[C@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819235023	CG	On-Demand	Anodyne	ADRB3	60	48
O[C@@H](CNCCC[C@@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819235024	CG	On-Demand	Anodyne	ADRB2	41	41
O[C@@H](CNCCC[C@@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819235024	CG	On-Demand	Anodyne	ADRB1	53	46
O[C@@H](CNCCC[C@@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819235024	CG	On-Demand	Anodyne	ADRB3	60	48
O[C@H](CNCCC[C@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819235025	CG	On-Demand	Anodyne	ADRB2	41	41
O[C@H](CNCCC[C@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819235025	CG	On-Demand	Anodyne	ADRB1	53	46
O[C@H](CNCCC[C@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819235025	CG	On-Demand	Anodyne	ADRB3	60	48
O[C@H](CNCCC[C@@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819235026	CG	On-Demand	Anodyne	ADRB2	41	41
O[C@H](CNCCC[C@@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819235026	CG	On-Demand	Anodyne	ADRB1	53	46
O[C@H](CNCCC[C@@H]1CCCCO1)c1cccc(Cl)c1	ZINC000819235026	CG	On-Demand	Anodyne	ADRB3	60	48
Cn1nccc1CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819235027	FD	On-Demand	Anodyne	GPR119	48	44
Cn1nccc1CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819235028	FD	On-Demand	Anodyne	GPR119	48	44
O[C@H](CN[C@H]1CCO[C@H](c2ccccc2)C1)c1cccnc1	ZINC000819235067	CF	On-Demand	Anodyne	ADRB3	50	46
O[C@H](CN[C@@H]1CCO[C@H](c2ccccc2)C1)c1cccnc1	ZINC000819235068	CF	On-Demand	Anodyne	ADRB3	50	46
O[C@H](CN[C@@H]1CCO[C@@H](c2ccccc2)C1)c1cccnc1	ZINC000819235069	CF	On-Demand	Anodyne	ADRB3	50	46
O[C@H](CN[C@H]1CCO[C@@H](c2ccccc2)C1)c1cccnc1	ZINC000819235070	CF	On-Demand	Anodyne	ADRB3	50	46
O[C@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1ccc(F)cn1	ZINC000819235076	FD	On-Demand	Anodyne	STAT6	40	35
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819235079	FD	On-Demand	Anodyne	CDK1	15	43
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819235081	FD	On-Demand	Anodyne	CDK1	15	43
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2ccccc2Cl)c1	ZINC000819235093	GF	On-Demand	Anodyne	CDK1	17	44
CN(C)CCOc1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819235111	DF	On-Demand	Anodyne	ROCK2	18	41
CN(C)CCOc1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819235111	DF	On-Demand	Anodyne	PDS	61	38
O[C@@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819235113	ED	On-Demand	Anodyne	ADRB2	21	40
O[C@@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819235113	ED	On-Demand	Anodyne	ADRB1	22	41
O[C@@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819235113	ED	On-Demand	Anodyne	ADRB3	84	41
O[C@@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819235113	ED	On-Demand	Anodyne	STAT6	45	34
O[C@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819235115	ED	On-Demand	Anodyne	ADRB2	21	40
O[C@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819235115	ED	On-Demand	Anodyne	ADRB1	22	41
O[C@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819235115	ED	On-Demand	Anodyne	ADRB3	84	41
O[C@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819235115	ED	On-Demand	Anodyne	STAT6	45	34
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819235130	GE	On-Demand	Anodyne	NPY2R	75	41
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819235130	GE	On-Demand	Anodyne	MAPK9	24	40
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819235130	GE	On-Demand	Anodyne	MAPK10	27	40
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819235130	GE	On-Demand	Anodyne	PIK3CB	20	48
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819235130	GE	On-Demand	Anodyne	STAT6	56	35
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819235131	GF	On-Demand	Anodyne	ADRB1	43	46
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819235131	GF	On-Demand	Anodyne	ADRB3	59	46
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819235131	GF	On-Demand	Anodyne	CDK1	17	46
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819235131	GF	On-Demand	Anodyne	CYP3A4	40	34
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819235132	GF	On-Demand	Anodyne	ADRB1	43	46
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819235132	GF	On-Demand	Anodyne	ADRB3	59	46
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819235132	GF	On-Demand	Anodyne	CDK1	17	46
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819235132	GF	On-Demand	Anodyne	CYP3A4	40	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)CCCc1ccccc1	ZINC000819235133	FE	On-Demand	Reactive	CTSK	15	50
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)CCCc1ccccc1	ZINC000819235133	FE	On-Demand	Reactive	FPR1	45	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)CCCc1ccccc1	ZINC000819235133	FE	On-Demand	Reactive	NAAA	43	41
C[Si](C)(CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccccc1	ZINC000819235171	FD	On-Demand	Anodyne	ADRB3	37	41
C[Si](C)(CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccccc1	ZINC000819235175	FD	On-Demand	Anodyne	ADRB3	37	41
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819235205	FE	On-Demand	Anodyne	CDK1	16	48
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2cccc(F)c2)c1	ZINC000819235206	FE	On-Demand	Anodyne	CDK1	16	48
Cn1nccc1CCNCCC(=O)Nc1cccc(Cl)c1	ZINC000819235226	DE	On-Demand	Anodyne	HTR2A	15	41
CS(=O)(=O)c1ccc([C@H](O)CNCCC[C@@H]2CCCCO2)cc1	ZINC000819235247	EE	On-Demand	Anodyne	ADRB2	22	44
CS(=O)(=O)c1ccc([C@H](O)CNCCC[C@@H]2CCCCO2)cc1	ZINC000819235247	EE	On-Demand	Anodyne	ADRB1	16	41
CS(=O)(=O)c1ccc([C@H](O)CNCCC[C@@H]2CCCCO2)cc1	ZINC000819235247	EE	On-Demand	Anodyne	ADRB3	36	41
CS(=O)(=O)c1ccc([C@H](O)CNCCC[C@H]2CCCCO2)cc1	ZINC000819235249	EE	On-Demand	Anodyne	ADRB2	22	44
CS(=O)(=O)c1ccc([C@H](O)CNCCC[C@H]2CCCCO2)cc1	ZINC000819235249	EE	On-Demand	Anodyne	ADRB1	16	41
CS(=O)(=O)c1ccc([C@H](O)CNCCC[C@H]2CCCCO2)cc1	ZINC000819235249	EE	On-Demand	Anodyne	ADRB3	36	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCC[C@@H]2CCCCO2)cc1	ZINC000819235251	EE	On-Demand	Anodyne	ADRB2	22	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCC[C@@H]2CCCCO2)cc1	ZINC000819235251	EE	On-Demand	Anodyne	ADRB1	16	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCC[C@@H]2CCCCO2)cc1	ZINC000819235251	EE	On-Demand	Anodyne	ADRB3	36	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCC[C@H]2CCCCO2)cc1	ZINC000819235253	EE	On-Demand	Anodyne	ADRB2	22	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCC[C@H]2CCCCO2)cc1	ZINC000819235253	EE	On-Demand	Anodyne	ADRB1	16	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCC[C@H]2CCCCO2)cc1	ZINC000819235253	EE	On-Demand	Anodyne	ADRB3	36	41
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819235284	GF	On-Demand	Bother	ADRB2	25	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819235284	GF	On-Demand	Bother	ADRB1	27	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819235284	GF	On-Demand	Bother	ADRB3	26	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819235285	GF	On-Demand	Bother	ADRB2	25	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819235285	GF	On-Demand	Bother	ADRB1	27	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819235285	GF	On-Demand	Bother	ADRB3	26	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCC[C@@H]1C(=O)N1CCOCC1)C2	ZINC000819235286	GD	On-Demand	Anodyne	PREP	28	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCC[C@H]1C(=O)N1CCOCC1)C2	ZINC000819235287	GD	On-Demand	Anodyne	PREP	28	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC[C@@H]1C(=O)N1CCOCC1)C2	ZINC000819235288	GD	On-Demand	Anodyne	PREP	28	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC[C@H]1C(=O)N1CCOCC1)C2	ZINC000819235289	GD	On-Demand	Anodyne	PREP	28	40
O[C@@H](CNCCC[C@H]1CCCCO1)c1cccnc1	ZINC000819235299	CE	On-Demand	Anodyne	ADRB2	25	46
O[C@@H](CNCCC[C@H]1CCCCO1)c1cccnc1	ZINC000819235299	CE	On-Demand	Anodyne	ADRB1	30	45
O[C@@H](CNCCC[C@H]1CCCCO1)c1cccnc1	ZINC000819235299	CE	On-Demand	Anodyne	ADRB3	103	46
O[C@@H](CNCCC[C@@H]1CCCCO1)c1cccnc1	ZINC000819235300	CE	On-Demand	Anodyne	ADRB2	25	46
O[C@@H](CNCCC[C@@H]1CCCCO1)c1cccnc1	ZINC000819235300	CE	On-Demand	Anodyne	ADRB1	30	45
O[C@@H](CNCCC[C@@H]1CCCCO1)c1cccnc1	ZINC000819235300	CE	On-Demand	Anodyne	ADRB3	103	46
O[C@H](CNCCC[C@H]1CCCCO1)c1cccnc1	ZINC000819235301	CE	On-Demand	Anodyne	ADRB2	25	46
O[C@H](CNCCC[C@H]1CCCCO1)c1cccnc1	ZINC000819235301	CE	On-Demand	Anodyne	ADRB1	30	45
O[C@H](CNCCC[C@H]1CCCCO1)c1cccnc1	ZINC000819235301	CE	On-Demand	Anodyne	ADRB3	103	46
O[C@H](CNCCC[C@@H]1CCCCO1)c1cccnc1	ZINC000819235302	CE	On-Demand	Anodyne	ADRB2	25	46
O[C@H](CNCCC[C@@H]1CCCCO1)c1cccnc1	ZINC000819235302	CE	On-Demand	Anodyne	ADRB1	30	45
O[C@H](CNCCC[C@@H]1CCCCO1)c1cccnc1	ZINC000819235302	CE	On-Demand	Anodyne	ADRB3	103	46
Cn1nccc1CCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819235310	DE	On-Demand	Anodyne	ADRB1	28	40
Cn1nccc1CCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819235310	DE	On-Demand	Anodyne	ADRB3	34	40
Cn1nccc1CCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819235311	DE	On-Demand	Anodyne	ADRB1	28	40
Cn1nccc1CCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819235311	DE	On-Demand	Anodyne	ADRB3	34	40
CC[C@@H](CC(F)(F)F)NC[C@H](O)c1cccnc1	ZINC000819235316	CE	On-Demand	Anodyne	ADRB2	18	40
CC[C@@H](CC(F)(F)F)NC[C@H](O)c1cccnc1	ZINC000819235316	CE	On-Demand	Anodyne	ADRB1	19	47
CC[C@@H](CC(F)(F)F)NC[C@H](O)c1cccnc1	ZINC000819235316	CE	On-Demand	Anodyne	ADRB3	70	47
CC[C@@H](CC(F)(F)F)NC[C@@H](O)c1cccnc1	ZINC000819235317	CE	On-Demand	Anodyne	ADRB2	18	40
CC[C@@H](CC(F)(F)F)NC[C@@H](O)c1cccnc1	ZINC000819235317	CE	On-Demand	Anodyne	ADRB1	19	47
CC[C@@H](CC(F)(F)F)NC[C@@H](O)c1cccnc1	ZINC000819235317	CE	On-Demand	Anodyne	ADRB3	70	47
C[C@H](CC(=O)NNC(=O)CCC1CCCCC1)n1cccn1	ZINC000819235320	DE	On-Demand	Reactive	BMP1	44	33
C[C@@H](CC(=O)NNC(=O)CCC1CCCCC1)n1cccn1	ZINC000819235321	DE	On-Demand	Reactive	BMP1	44	33
CCOc1ccccc1CCNC(=O)C(F)=C1CCC1	ZINC000819235339	CG	On-Demand	Anodyne	HCN1	50	33
CCOc1ccccc1CCNC(=O)C(F)=C1CCC1	ZINC000819235339	CG	On-Demand	Anodyne	HCN4	42	32
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccccc1Cl	ZINC000819235340	GG	On-Demand	Anodyne	ADRB2	32	47
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccccc1Cl	ZINC000819235340	GG	On-Demand	Anodyne	ADRB1	24	47
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccccc1Cl	ZINC000819235340	GG	On-Demand	Anodyne	ABCB1	23	48
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccccc1Cl	ZINC000819235341	GG	On-Demand	Anodyne	ADRB2	32	47
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccccc1Cl	ZINC000819235341	GG	On-Demand	Anodyne	ADRB1	24	47
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)COc1ccccc1Cl	ZINC000819235341	GG	On-Demand	Anodyne	ABCB1	23	48
O[C@H](CNC1CCC(O)(c2ccccc2)CC1)Cc1ccc(F)cc1	ZINC000819235346	EG	On-Demand	Anodyne	OPRL1	17	42
O[C@@H](CNC1CCC(O)(c2ccccc2)CC1)Cc1ccc(F)cc1	ZINC000819235347	EG	On-Demand	Anodyne	OPRL1	17	42
COc1ccc(OC)c([C@H](O)CNCCC2=CCCCCC2)c1	ZINC000819235387	DH	On-Demand	Anodyne	ADRB2	21	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(C(F)F)cc2)CC1	ZINC000819235389	GH	On-Demand	Anodyne	GPR119	53	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(C(F)F)cc2)CC1	ZINC000819235390	GH	On-Demand	Anodyne	GPR119	53	49
O[C@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cc2ccccc2o1	ZINC000819235417	FF	On-Demand	Anodyne	STAT6	49	33
CON(C)C(=O)CCNCc1cnc(N2CCOCC2)c(F)c1	ZINC000819235430	EC	On-Demand	Anodyne	STAT6	48	32
O[C@@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cc(F)ccc1F	ZINC000819235436	FE	On-Demand	Anodyne	STAT6	41	37
O[C@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cc(F)ccc1F	ZINC000819235439	FE	On-Demand	Anodyne	STAT6	41	37
CCC(CC)(CNC[C@@H](O)c1cccnc1)c1ccc(OC)c(OC)c1	ZINC000819235442	FG	On-Demand	Anodyne	ADRB1	23	46
CCC(CC)(CNC[C@@H](O)c1cccnc1)c1ccc(OC)c(OC)c1	ZINC000819235442	FG	On-Demand	Anodyne	ADRB3	82	46
CCC(CC)(CNC[C@H](O)c1cccnc1)c1ccc(OC)c(OC)c1	ZINC000819235444	FG	On-Demand	Anodyne	ADRB1	23	46
CCC(CC)(CNC[C@H](O)c1cccnc1)c1ccc(OC)c(OC)c1	ZINC000819235444	FG	On-Demand	Anodyne	ADRB3	82	46
C[Si](C)(CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819235446	CD	On-Demand	Anodyne	ADRB2	24	46
C[Si](C)(CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819235446	CD	On-Demand	Anodyne	ADRB1	25	44
C[Si](C)(CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819235446	CD	On-Demand	Anodyne	ADRB3	96	47
C[Si](C)(CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819235451	CD	On-Demand	Anodyne	ADRB2	24	46
C[Si](C)(CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819235451	CD	On-Demand	Anodyne	ADRB1	25	44
C[Si](C)(CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819235451	CD	On-Demand	Anodyne	ADRB3	96	47
CCc1noc(-c2ccc(CCNC(=O)C(F)=C3CCC3)cc2)n1	ZINC000819235454	EG	On-Demand	Anodyne	S1PR4	23	40
CCc1noc(-c2ccc(CCNC(=O)C(F)=C3CCC3)cc2)n1	ZINC000819235454	EG	On-Demand	Anodyne	S1PR1	16	40
CCc1noc(-c2ccc(CCNC(=O)C(F)=C3CCC3)cc2)n1	ZINC000819235454	EG	On-Demand	Anodyne	SPHK1	16	41
Cn1nccc1CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819235469	FF	On-Demand	Anodyne	ADRB2	76	49
Cn1nccc1CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819235469	FF	On-Demand	Anodyne	ADRB1	114	50
Cn1nccc1CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819235469	FF	On-Demand	Anodyne	GRIN1	15	45
Cn1nccc1CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819235469	FF	On-Demand	Anodyne	ADRB3	91	50
Cn1nccc1CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819235471	FF	On-Demand	Anodyne	ADRB2	76	49
Cn1nccc1CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819235471	FF	On-Demand	Anodyne	ADRB1	114	50
Cn1nccc1CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819235471	FF	On-Demand	Anodyne	GRIN1	15	45
Cn1nccc1CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819235471	FF	On-Demand	Anodyne	ADRB3	91	50
Cc1ccccc1[C@@H](O)CNCc1cnc(N2CCOCC2)c(F)c1	ZINC000819235499	EE	On-Demand	Anodyne	STAT6	47	32
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819235502	GG	On-Demand	Anodyne	LTA4H	30	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819235503	GG	On-Demand	Anodyne	LTA4H	30	40
C[C@H]1CN(Cc2ccccc2)C[C@H]1NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819235504	GG	On-Demand	Anodyne	LTA4H	30	40
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819235505	GG	On-Demand	Anodyne	LTA4H	30	40
Cn1nccc1CCNCCC(=O)Nc1cccc(Br)c1	ZINC000819235509	FE	On-Demand	Anodyne	EGFR	31	42
Cn1nccc1CCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819235515	EE	On-Demand	Anodyne	ADRB2	54	50
Cn1nccc1CCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819235515	EE	On-Demand	Anodyne	ADRB1	78	50
Cn1nccc1CCNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819235515	EE	On-Demand	Anodyne	ADRB3	54	50
Cn1nccc1CCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819235516	EE	On-Demand	Anodyne	ADRB2	54	50
Cn1nccc1CCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819235516	EE	On-Demand	Anodyne	ADRB1	78	50
Cn1nccc1CCNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819235516	EE	On-Demand	Anodyne	ADRB3	54	50
Cn1nccc1CCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819235517	DC	On-Demand	Bother	ADRB2	42	54
Cn1nccc1CCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819235517	DC	On-Demand	Bother	ADRB1	65	54
Cn1nccc1CCNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819235517	DC	On-Demand	Bother	ADRB3	49	54
Cn1nccc1CCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819235518	DC	On-Demand	Bother	ADRB2	42	54
Cn1nccc1CCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819235518	DC	On-Demand	Bother	ADRB1	65	54
Cn1nccc1CCNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819235518	DC	On-Demand	Bother	ADRB3	49	54
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819235527	GE	On-Demand	Anodyne	CDK1	16	44
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819235528	GE	On-Demand	Anodyne	CDK1	16	44
Cc1csc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819235537	FG	On-Demand	Mild	PAPA1_CARPA	40	43
Cc1csc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819235538	FG	On-Demand	Mild	PAPA1_CARPA	40	43
COC[C@@H](O)CNC[Si](C)(C)c1ccccc1	ZINC000819235628	CC	On-Demand	Anodyne	ADRB2	24	43
O[C@@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819235629	GF	On-Demand	Anodyne	STAT6	42	32
O[C@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819235630	GF	On-Demand	Anodyne	STAT6	42	32
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819235633	GF	On-Demand	Anodyne	CDK1	16	40
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819235634	GF	On-Demand	Anodyne	CDK1	16	40
Cn1nccc1CCNCCC(=O)Nc1ccccc1	ZINC000819235647	CD	On-Demand	Anodyne	HDAC10	16	40
Cn1nccc1CCNCCC(=O)Nc1ccccc1	ZINC000819235647	CD	On-Demand	Anodyne	HDAC3	16	40
Cc1nn(C)cc1[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819235648	FE	On-Demand	Mild	PAPA1_CARPA	38	43
Cc1nn(C)cc1[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819235648	FE	On-Demand	Mild	FPR1	40	37
Cc1nn(C)cc1[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819235649	FE	On-Demand	Mild	PAPA1_CARPA	38	43
Cc1nn(C)cc1[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819235649	FE	On-Demand	Mild	FPR1	40	37
Cc1nn(C)cc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819235650	FE	On-Demand	Mild	PAPA1_CARPA	38	43
Cc1nn(C)cc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819235650	FE	On-Demand	Mild	FPR1	40	37
Cc1nn(C)cc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819235651	FE	On-Demand	Mild	PAPA1_CARPA	38	43
Cc1nn(C)cc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819235651	FE	On-Demand	Mild	FPR1	40	37
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2ccccc2F)c1	ZINC000819235652	FE	On-Demand	Anodyne	CDK1	16	43
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2ccccc2F)c1	ZINC000819235653	FE	On-Demand	Anodyne	CDK1	16	43
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819235668	GE	On-Demand	Anodyne	CDK1	15	42
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819235669	GE	On-Demand	Anodyne	CDK1	15	42
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819235673	GE	On-Demand	Anodyne	CDK1	17	45
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819235674	GE	On-Demand	Anodyne	CDK1	17	45
CON(C)C(=O)CCNCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000819235675	EC	On-Demand	Anodyne	CDK1	16	40
Cc1cc(OC[C@@H](O)CNCCc2ccnn2C)c(C(C)C)cc1Cl	ZINC000819235676	FG	On-Demand	Anodyne	ADRB1	41	37
Cc1cc(OC[C@H](O)CNCCc2ccnn2C)c(C(C)C)cc1Cl	ZINC000819235677	FG	On-Demand	Anodyne	ADRB1	41	37
O[C@@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1c(F)cccc1F	ZINC000819235704	FE	On-Demand	Anodyne	STAT6	46	35
O[C@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1c(F)cccc1F	ZINC000819235705	FE	On-Demand	Anodyne	STAT6	46	35
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819235710	GE	On-Demand	Anodyne	CDK1	16	41
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819235711	GE	On-Demand	Anodyne	CDK1	16	41
Cn1nccc1CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819235718	EE	On-Demand	Anodyne	ADRB2	57	58
Cn1nccc1CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819235718	EE	On-Demand	Anodyne	ADRB1	74	53
Cn1nccc1CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819235718	EE	On-Demand	Anodyne	ADRB3	50	53
Cn1nccc1CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819235718	EE	On-Demand	Anodyne	CYP2D6	19	44
Cn1nccc1CCNC[C@H](O)COc1cccc2ccccc12	ZINC000819235718	EE	On-Demand	Anodyne	ABCB1	19	45
Cn1nccc1CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819235719	EE	On-Demand	Anodyne	ADRB2	57	58
Cn1nccc1CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819235719	EE	On-Demand	Anodyne	ADRB1	74	53
Cn1nccc1CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819235719	EE	On-Demand	Anodyne	ADRB3	50	53
Cn1nccc1CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819235719	EE	On-Demand	Anodyne	CYP2D6	19	44
Cn1nccc1CCNC[C@@H](O)COc1cccc2ccccc12	ZINC000819235719	EE	On-Demand	Anodyne	ABCB1	19	45
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819235720	GE	On-Demand	Anodyne	CDK1	16	45
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819235721	GE	On-Demand	Anodyne	CDK1	16	45
CN(C)CCOc1cccc(CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819235728	GE	On-Demand	Anodyne	HRH2	21	41
CN(C)CCOc1cccc(CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819235728	GE	On-Demand	Anodyne	PDS	46	36
C[C@@H]1CCCc2ccccc2[C@H]1NC[C@H](O)c1cccnc1	ZINC000819235729	CG	On-Demand	Anodyne	ADRB3	63	43
C[C@@H]1CCCc2ccccc2[C@@H]1NC[C@H](O)c1cccnc1	ZINC000819235730	CG	On-Demand	Anodyne	ADRB3	63	43
C[C@@H]1CCCc2ccccc2[C@@H]1NC[C@@H](O)c1cccnc1	ZINC000819235731	CG	On-Demand	Anodyne	ADRB3	63	43
C[C@@H]1CCCc2ccccc2[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819235732	CG	On-Demand	Anodyne	ADRB3	63	43
CON(C)C(=O)CCN[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000819235733	DD	On-Demand	Anodyne	DRD4	22	48
CON(C)C(=O)CCN[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000819235734	DD	On-Demand	Anodyne	DRD4	22	48
CON(C)C(=O)CCN[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000819235735	DD	On-Demand	Anodyne	DRD4	22	48
CON(C)C(=O)CCN[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000819235736	DD	On-Demand	Anodyne	DRD4	22	48
Cn1nccc1CCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819235752	DD	On-Demand	Mild	ADRB2	50	50
Cn1nccc1CCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819235752	DD	On-Demand	Mild	ADRB1	82	50
Cn1nccc1CCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819235752	DD	On-Demand	Mild	GRIN1	15	43
Cn1nccc1CCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819235752	DD	On-Demand	Mild	ADRB3	53	50
Cn1nccc1CCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819235753	DD	On-Demand	Mild	ADRB2	50	50
Cn1nccc1CCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819235753	DD	On-Demand	Mild	ADRB1	82	50
Cn1nccc1CCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819235753	DD	On-Demand	Mild	GRIN1	15	43
Cn1nccc1CCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819235753	DD	On-Demand	Mild	ADRB3	53	50
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819235754	FE	On-Demand	Anodyne	CDK1	17	47
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819235755	FE	On-Demand	Anodyne	CDK1	17	47
CCOC[C@H](O)CNC[Si](C)(C)c1ccccc1	ZINC000819235762	CD	On-Demand	Anodyne	ADRB2	18	41
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819235772	GF	On-Demand	Anodyne	CDK1	17	43
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819235773	GF	On-Demand	Anodyne	CDK1	17	43
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819235778	FE	On-Demand	Anodyne	ADRB1	16	42
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819235778	FE	On-Demand	Anodyne	ADRB3	31	42
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819235778	FE	On-Demand	Anodyne	CDK1	17	46
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819235779	FE	On-Demand	Anodyne	ADRB1	16	42
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819235779	FE	On-Demand	Anodyne	ADRB3	31	42
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819235779	FE	On-Demand	Anodyne	CDK1	17	46
Cn1nccc1CCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819235794	EE	On-Demand	Anodyne	ADRB2	45	42
Cn1nccc1CCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819235794	EE	On-Demand	Anodyne	ADRB1	61	42
Cn1nccc1CCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819235794	EE	On-Demand	Anodyne	ADRB3	46	41
Cn1nccc1CCNC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819235794	EE	On-Demand	Anodyne	PDS	48	42
Cn1nccc1CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819235795	EE	On-Demand	Anodyne	ADRB2	45	42
Cn1nccc1CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819235795	EE	On-Demand	Anodyne	ADRB1	61	42
Cn1nccc1CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819235795	EE	On-Demand	Anodyne	ADRB3	46	41
Cn1nccc1CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819235795	EE	On-Demand	Anodyne	PDS	48	42
C[C@@H]1CCCc2ccccc2[C@@H]1NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819235804	FG	On-Demand	Anodyne	HTR6	40	33
C[C@@H]1CCCc2ccccc2[C@@H]1NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819235805	FG	On-Demand	Anodyne	HTR6	40	33
C[C@@H]1CCCc2ccccc2[C@H]1NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819235806	FG	On-Demand	Anodyne	HTR6	40	33
C[C@@H]1CCCc2ccccc2[C@H]1NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819235807	FG	On-Demand	Anodyne	HTR6	40	33
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819235812	GF	On-Demand	Anodyne	CDK1	16	41
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819235813	GF	On-Demand	Anodyne	CDK1	16	41
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819235818	GF	On-Demand	Anodyne	CDK1	16	43
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819235819	GF	On-Demand	Anodyne	CDK1	16	43
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC[C@@H](O)c1cc2ccccc2o1	ZINC000819235825	FH	On-Demand	Anodyne	SIGMAR1	22	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC[C@@H](O)c1cc2ccccc2o1	ZINC000819235826	FH	On-Demand	Anodyne	SIGMAR1	22	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC[C@@H](O)c1cc2ccccc2o1	ZINC000819235827	FH	On-Demand	Anodyne	SIGMAR1	22	44
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC[C@@H](O)c1cc2ccccc2o1	ZINC000819235828	FH	On-Demand	Anodyne	SIGMAR1	22	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819235829	GE	On-Demand	Anodyne	DRD4	29	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819235829	GE	On-Demand	Anodyne	ACHE	18	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819235829	GE	On-Demand	Anodyne	SIGMAR1	20	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819235830	GE	On-Demand	Anodyne	DRD4	29	44
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819235830	GE	On-Demand	Anodyne	ACHE	18	42
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819235830	GE	On-Demand	Anodyne	SIGMAR1	20	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819235831	GE	On-Demand	Anodyne	DRD4	29	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819235831	GE	On-Demand	Anodyne	ACHE	18	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819235831	GE	On-Demand	Anodyne	SIGMAR1	20	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819235832	GE	On-Demand	Anodyne	DRD4	29	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819235832	GE	On-Demand	Anodyne	ACHE	18	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819235832	GE	On-Demand	Anodyne	SIGMAR1	20	42
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819235841	GE	On-Demand	Anodyne	CDK1	16	44
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819235842	GE	On-Demand	Anodyne	CDK1	16	44
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1cnc(N2CCOCC2)c(F)c1	ZINC000819235843	GD	On-Demand	Anodyne	STAT6	55	35
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1cnc(N2CCOCC2)c(F)c1	ZINC000819235844	GD	On-Demand	Anodyne	STAT6	55	35
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819235853	ED	On-Demand	Anodyne	ADRB2	23	41
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819235853	ED	On-Demand	Anodyne	ADRB1	28	42
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819235853	ED	On-Demand	Anodyne	ADRB3	95	43
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819235853	ED	On-Demand	Anodyne	CDK1	16	40
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819235854	ED	On-Demand	Anodyne	ADRB2	23	41
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819235854	ED	On-Demand	Anodyne	ADRB1	28	42
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819235854	ED	On-Demand	Anodyne	ADRB3	95	43
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819235854	ED	On-Demand	Anodyne	CDK1	16	40
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819235855	GE	On-Demand	Anodyne	CDK1	16	44
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819235856	GE	On-Demand	Anodyne	CDK1	16	44
COC[C@@H](C)OC[C@@H](O)CNC[Si](C)(C)c1ccccc1	ZINC000819235863	DD	On-Demand	Anodyne	ADRB2	15	41
COC[C@@H](C)OC[C@H](O)CNC[Si](C)(C)c1ccccc1	ZINC000819235865	DD	On-Demand	Anodyne	ADRB2	15	41
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819235867	GF	On-Demand	Anodyne	ADRB1	41	43
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819235867	GF	On-Demand	Anodyne	ADRB3	51	43
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819235867	GF	On-Demand	Anodyne	CDK1	17	47
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819235868	GF	On-Demand	Anodyne	ADRB1	41	43
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819235868	GF	On-Demand	Anodyne	ADRB3	51	43
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819235868	GF	On-Demand	Anodyne	CDK1	17	47
O=S1(=O)CCCN1c1cccc(CNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819235878	FE	On-Demand	Anodyne	CDK1	17	48
O=S1(=O)CCCN1c1cccc(CNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819235879	FE	On-Demand	Anodyne	CDK1	17	48
C#CCNC(=O)CCNCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000819235888	EC	On-Demand	Mild	CDK1	17	41
CON(C)C(=O)CCNCc1cccc(N2CCCS2(=O)=O)c1	ZINC000819235893	EC	On-Demand	Anodyne	CDK1	16	42
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2cccc3ccccc23)cc1	ZINC000819235904	GG	On-Demand	Anodyne	CDK1	17	45
Cc1csc([C@H](C)NC(=O)/C=C\[C@@H]2CCCO2)n1	ZINC000819235905	CE	On-Demand	Anodyne	UL26	95	36
Cc1csc([C@H](C)NC(=O)/C=C\[C@@H]2CCCO2)n1	ZINC000819235905	CE	On-Demand	Anodyne	SCAF_EBVB9	80	33
Cc1csc([C@H](C)NC(=O)/C=C/[C@H]2CCCO2)n1	ZINC000819235906	CE	On-Demand	Anodyne	UL26	95	36
Cc1csc([C@H](C)NC(=O)/C=C/[C@H]2CCCO2)n1	ZINC000819235906	CE	On-Demand	Anodyne	SCAF_EBVB9	80	33
Cc1csc([C@H](C)NC(=O)/C=C/[C@@H]2CCCO2)n1	ZINC000819235907	CE	On-Demand	Anodyne	UL26	95	36
Cc1csc([C@H](C)NC(=O)/C=C/[C@@H]2CCCO2)n1	ZINC000819235907	CE	On-Demand	Anodyne	SCAF_EBVB9	80	33
Cc1csc([C@H](C)NC(=O)/C=C\[C@H]2CCCO2)n1	ZINC000819235908	CE	On-Demand	Anodyne	UL26	95	36
Cc1csc([C@H](C)NC(=O)/C=C\[C@H]2CCCO2)n1	ZINC000819235908	CE	On-Demand	Anodyne	SCAF_EBVB9	80	33
O[C@@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cccc(F)c1	ZINC000819235925	EE	On-Demand	Anodyne	STAT6	45	38
O[C@H](CNCc1cnc(N2CCOCC2)c(F)c1)c1cccc(F)c1	ZINC000819235926	EE	On-Demand	Anodyne	STAT6	45	38
CN(C)c1ccc(NC(=O)CCNC2CC(OCc3ccccc3)C2)cc1	ZINC000819235941	FG	On-Demand	Anodyne	LTA4H	35	42
CN(C)c1ccc(NC(=O)CCNC2CC(OCc3ccccc3)C2)cc1	ZINC000819235941	FG	On-Demand	Anodyne	TIMP3	36	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNC1CC(OCc2ccccc2)C1	ZINC000819235960	FF	On-Demand	Anodyne	CTSK	15	42
CC(C)(C)OC(=O)NC[C@](C)(O)CNC1CC(OCc2ccccc2)C1	ZINC000819235960	FF	On-Demand	Anodyne	CAPN2	40	31
CC(C)(C)OC(=O)NC[C@](C)(O)CNC1CC(OCc2ccccc2)C1	ZINC000819235960	FF	On-Demand	Anodyne	FPR1	41	34
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC1CC(OCc2ccccc2)C1	ZINC000819235961	FF	On-Demand	Anodyne	CTSK	15	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC1CC(OCc2ccccc2)C1	ZINC000819235961	FF	On-Demand	Anodyne	CAPN2	40	31
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC1CC(OCc2ccccc2)C1	ZINC000819235961	FF	On-Demand	Anodyne	FPR1	41	34
Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819235967	FI	On-Demand	Mild	MAOB	23	44
Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819235967	FI	On-Demand	Mild	FFAR1	42	35
Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819235968	FI	On-Demand	Mild	MAOB	23	44
Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819235968	FI	On-Demand	Mild	FFAR1	42	35
Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819235969	FI	On-Demand	Mild	MAOB	23	44
Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819235969	FI	On-Demand	Mild	FFAR1	42	35
Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819235970	FI	On-Demand	Mild	MAOB	23	44
Cc1cc(OCc2cccc(C#N)c2)ccc1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819235970	FI	On-Demand	Mild	FFAR1	42	35
O=C(CCCc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819235995	GG	On-Demand	Reactive	PPARA	15	41
O=C(CCCc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819235995	GG	On-Demand	Reactive	FDFT1	16	42
O=C(CCCc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819235995	GG	On-Demand	Reactive	PLA2G4A	31	46
O=C(CCCc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819235995	GG	On-Demand	Reactive	MTNR1A	17	41
O=C(CCCc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819235995	GG	On-Demand	Reactive	MTNR1B	18	41
O=C(CCCc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819235995	GG	On-Demand	Reactive	CES1	42	36
O=C(CCCc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819235995	GG	On-Demand	Reactive	AMP1_PLAFQ	32	40
O=C(CCCc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819235995	GG	On-Demand	Reactive	FFAR1	49	44
O=C(CCCc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819235995	GG	On-Demand	Reactive	FFAR4	35	43
O=C(CCCc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819235995	GG	On-Demand	Reactive	CRTM	73	45
O=C(CCCc1ccccc1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819235995	GG	On-Demand	Reactive	PDS	44	35
O[C@H](CN[C@@H]1CCO[C@H](C2CC2)C1)c1cccnc1	ZINC000819236008	CD	On-Demand	Anodyne	ADRB3	51	45
O[C@H](CN[C@@H]1CCO[C@@H](C2CC2)C1)c1cccnc1	ZINC000819236009	CD	On-Demand	Anodyne	ADRB3	51	45
O[C@H](CN[C@H]1CCO[C@@H](C2CC2)C1)c1cccnc1	ZINC000819236010	CD	On-Demand	Anodyne	ADRB3	51	45
O[C@H](CN[C@H]1CCO[C@H](C2CC2)C1)c1cccnc1	ZINC000819236011	CD	On-Demand	Anodyne	ADRB3	51	45
Cc1ccc(OC[C@@H](O)CN[C@H](C)CNC(=O)OC(C)(C)C)c(C)c1	ZINC000819236035	FF	On-Demand	Anodyne	ADRB2	30	55
Cc1ccc(OC[C@@H](O)CN[C@H](C)CNC(=O)OC(C)(C)C)c(C)c1	ZINC000819236035	FF	On-Demand	Anodyne	ADRB1	27	43
Cc1ccc(OC[C@H](O)CN[C@H](C)CNC(=O)OC(C)(C)C)c(C)c1	ZINC000819236036	FF	On-Demand	Anodyne	ADRB2	30	55
Cc1ccc(OC[C@H](O)CN[C@H](C)CNC(=O)OC(C)(C)C)c(C)c1	ZINC000819236036	FF	On-Demand	Anodyne	ADRB1	27	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1c1ccc2c(c1)OCO2	ZINC000819236043	FF	On-Demand	Anodyne	EDNRB	42	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1c1ccc2c(c1)OCO2	ZINC000819236043	FF	On-Demand	Anodyne	EDNRA	43	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1c1ccc2c(c1)OCO2	ZINC000819236044	FF	On-Demand	Anodyne	EDNRB	42	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1c1ccc2c(c1)OCO2	ZINC000819236044	FF	On-Demand	Anodyne	EDNRA	43	36
CC(=O)Nc1ccc2nc(NC(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)sc2c1	ZINC000819236047	GG	On-Demand	Anodyne	LCK	18	46
CC(=O)Nc1ccc2nc(NC(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)sc2c1	ZINC000819236047	GG	On-Demand	Anodyne	CSNK1D	42	38
N#CCCNCCCCCCOc1ccc(Cl)cc1	ZINC000819236087	CH	On-Demand	Mild	DRD4	21	56
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)[C@@H](c1ccccc1)N(C)C	ZINC000819236096	EH	On-Demand	Anodyne	ADRB1	17	40
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)[C@@H](c1ccccc1)N(C)C	ZINC000819236096	EH	On-Demand	Anodyne	AOC3	26	43
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)[C@H](c1ccccc1)N(C)C	ZINC000819236098	EH	On-Demand	Anodyne	ADRB1	17	40
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)[C@H](c1ccccc1)N(C)C	ZINC000819236098	EH	On-Demand	Anodyne	AOC3	26	43
C[C@H](NC[C@H](O)c1ccc(F)cc1)[C@@H](c1ccccc1)N(C)C	ZINC000819236100	DG	On-Demand	Anodyne	ADRB2	15	41
C[C@H](NC[C@H](O)c1ccc(F)cc1)[C@@H](c1ccccc1)N(C)C	ZINC000819236100	DG	On-Demand	Anodyne	AOC3	25	43
C[C@H](NC[C@H](O)c1ccc(F)cc1)[C@H](c1ccccc1)N(C)C	ZINC000819236102	DG	On-Demand	Anodyne	ADRB2	15	41
C[C@H](NC[C@H](O)c1ccc(F)cc1)[C@H](c1ccccc1)N(C)C	ZINC000819236102	DG	On-Demand	Anodyne	AOC3	25	43
Cn1c(=O)oc2cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc21	ZINC000819236113	GF	On-Demand	Mild	PAPA1_CARPA	36	40
Cn1c(=O)oc2cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc21	ZINC000819236114	GF	On-Demand	Mild	PAPA1_CARPA	36	40
C[C@H](NC[C@H](O)c1cccc(Br)c1)[C@@H](c1ccccc1)N(C)C	ZINC000819236116	GH	On-Demand	Anodyne	ADRB2	18	45
C[C@H](NC[C@H](O)c1cccc(Br)c1)[C@H](c1ccccc1)N(C)C	ZINC000819236118	GH	On-Demand	Anodyne	ADRB2	18	45
O=C(CCCc1ccccc1)NNC(=O)c1cc2c(cn1)OCCO2	ZINC000819236129	ED	On-Demand	Reactive	FAAH	64	37
O=C(CCCc1ccccc1)NNC(=O)c1cc2c(cn1)OCCO2	ZINC000819236129	ED	On-Demand	Reactive	CES1	67	36
O=C(CCCc1ccccc1)NNC(=O)c1cc2c(cn1)OCCO2	ZINC000819236129	ED	On-Demand	Reactive	CES1D	54	31
O=[N+]([O-])c1cccc([C@@H](O)CNC2CC(OCc3ccccc3)C2)c1	ZINC000819236164	EF	On-Demand	Bother	CACNA1C	47	41
O=[N+]([O-])c1cccc([C@@H](O)CNC2CC(OCc3ccccc3)C2)c1	ZINC000819236164	EF	On-Demand	Bother	ADRB3	40	33
O=[N+]([O-])c1cccc([C@@H](O)CNC2CC(OCc3ccccc3)C2)c1	ZINC000819236164	EF	On-Demand	Bother	CACNA1D	72	41
O=[N+]([O-])c1cccc([C@H](O)CNC2CC(OCc3ccccc3)C2)c1	ZINC000819236165	EF	On-Demand	Bother	CACNA1C	47	41
O=[N+]([O-])c1cccc([C@H](O)CNC2CC(OCc3ccccc3)C2)c1	ZINC000819236165	EF	On-Demand	Bother	ADRB3	40	33
O=[N+]([O-])c1cccc([C@H](O)CNC2CC(OCc3ccccc3)C2)c1	ZINC000819236165	EF	On-Demand	Bother	CACNA1D	72	41
CON(C)C(=O)CCNCc1cccc(-c2cccnc2)c1	ZINC000819236204	CE	On-Demand	Anodyne	CYP11B1	23	40
CON(C)C(=O)CCNCc1cccc(-c2cccnc2)c1	ZINC000819236204	CE	On-Demand	Anodyne	PTAFR	15	40
CON(C)C(=O)CCNCc1cccc(-c2cccnc2)c1	ZINC000819236204	CE	On-Demand	Anodyne	CYP11B2	39	41
CC(C)(C)OC(=O)NCCOc1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819236207	GG	On-Demand	Anodyne	HRH2	26	43
CC(C)(C)OC(=O)NCCOc1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819236208	GG	On-Demand	Anodyne	HRH2	26	43
CC(C)(C)OC(=O)NCCOc1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819236210	GG	On-Demand	Anodyne	HRH2	26	43
CC(C)(C)OC(=O)NCCOc1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819236212	GG	On-Demand	Anodyne	HRH2	26	43
CC(C)c1nn(-c2ccccc2)cc1C(=O)NCCCN1CCOC1=O	ZINC000819236214	FF	On-Demand	Anodyne	TYRO3	15	41
C[C@@H](NC[C@@H](O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000819236269	CG	On-Demand	Anodyne	ADRB2	20	44
C[C@@H](NC[C@@H](O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000819236269	CG	On-Demand	Anodyne	ADRB3	34	44
C[C@@H](NC[C@@H](O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000819236269	CG	On-Demand	Anodyne	AOC3	30	47
C[C@@H](NC[C@@H](O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000819236273	CG	On-Demand	Anodyne	ADRB2	20	44
C[C@@H](NC[C@@H](O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000819236273	CG	On-Demand	Anodyne	ADRB3	34	44
C[C@@H](NC[C@@H](O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000819236273	CG	On-Demand	Anodyne	AOC3	30	47
C[C@H](NC[C@H](O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000819236275	CG	On-Demand	Anodyne	ADRB2	20	44
C[C@H](NC[C@H](O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000819236275	CG	On-Demand	Anodyne	ADRB3	34	44
C[C@H](NC[C@H](O)c1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000819236275	CG	On-Demand	Anodyne	AOC3	30	47
C[C@H](NC[C@H](O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000819236276	CG	On-Demand	Anodyne	ADRB2	20	44
C[C@H](NC[C@H](O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000819236276	CG	On-Demand	Anodyne	ADRB3	34	44
C[C@H](NC[C@H](O)c1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000819236276	CG	On-Demand	Anodyne	AOC3	30	47
C[C@H](NC[C@H](O)c1ccccc1Cl)[C@@H](c1ccccc1)N(C)C	ZINC000819236290	EH	On-Demand	Anodyne	AOC3	18	47
C[C@H](NC[C@H](O)c1ccccc1Cl)[C@H](c1ccccc1)N(C)C	ZINC000819236292	EH	On-Demand	Anodyne	AOC3	18	47
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)c1cccnc1	ZINC000819236299	DD	On-Demand	Anodyne	ADRB3	57	48
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)c1cccnc1	ZINC000819236300	DD	On-Demand	Anodyne	ADRB3	57	48
O[C@@H](CNCCC1=CCCCCC1)c1cccc(F)c1	ZINC000819236336	CH	On-Demand	Anodyne	ADRB2	26	41
O[C@@H](CNCCC1=CCCCCC1)c1cccc(F)c1	ZINC000819236336	CH	On-Demand	Anodyne	ADRB1	27	44
O[C@@H](CNCCC1=CCCCCC1)c1cccc(F)c1	ZINC000819236336	CH	On-Demand	Anodyne	ADRB3	63	44
O[C@H](CNCCC1=CCCCCC1)c1cccc(F)c1	ZINC000819236337	CH	On-Demand	Anodyne	ADRB2	26	41
O[C@H](CNCCC1=CCCCCC1)c1cccc(F)c1	ZINC000819236337	CH	On-Demand	Anodyne	ADRB1	27	44
O[C@H](CNCCC1=CCCCCC1)c1cccc(F)c1	ZINC000819236337	CH	On-Demand	Anodyne	ADRB3	63	44
O[C@@H](CN[C@@H]1CCO[C@@H](c2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819236338	EH	On-Demand	Anodyne	ADRB3	18	42
O[C@@H](CN[C@H]1CCO[C@H](c2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819236339	EH	On-Demand	Anodyne	ADRB3	18	42
O[C@@H](CN[C@H]1CCO[C@@H](c2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819236340	EH	On-Demand	Anodyne	ADRB3	18	42
O[C@@H](CN[C@@H]1CCO[C@H](c2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819236341	EH	On-Demand	Anodyne	ADRB3	18	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NNC(=O)CCCc1ccccc1)C2	ZINC000819236347	FE	On-Demand	Reactive	SLC6A3	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NNC(=O)CCCc1ccccc1)C2	ZINC000819236347	FE	On-Demand	Reactive	PREP	49	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NNC(=O)CCCc1ccccc1)C2	ZINC000819236348	FE	On-Demand	Reactive	SLC6A3	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NNC(=O)CCCc1ccccc1)C2	ZINC000819236348	FE	On-Demand	Reactive	PREP	49	39
C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](c1ccccc1)N(C)C	ZINC000819236354	EF	On-Demand	Bother	ADRB3	41	35
C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H](c1ccccc1)N(C)C	ZINC000819236358	EF	On-Demand	Bother	ADRB3	41	35
O[C@@H](CNCCC1=CCCCCC1)c1ccccc1	ZINC000819236376	CH	On-Demand	Anodyne	ADRB2	34	53
O[C@@H](CNCCC1=CCCCCC1)c1ccccc1	ZINC000819236376	CH	On-Demand	Anodyne	ADRB1	41	45
O[C@@H](CNCCC1=CCCCCC1)c1ccccc1	ZINC000819236376	CH	On-Demand	Anodyne	ADRB3	85	47
O[C@H](CNCCC1=CCCCCC1)c1ccccc1	ZINC000819236378	CH	On-Demand	Anodyne	ADRB2	34	53
O[C@H](CNCCC1=CCCCCC1)c1ccccc1	ZINC000819236378	CH	On-Demand	Anodyne	ADRB1	41	45
O[C@H](CNCCC1=CCCCCC1)c1ccccc1	ZINC000819236378	CH	On-Demand	Anodyne	ADRB3	85	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H]1c1ccc3c(c1)OCO3)C2	ZINC000819236431	GF	On-Demand	Anodyne	EDNRB	51	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H]1c1ccc3c(c1)OCO3)C2	ZINC000819236431	GF	On-Demand	Anodyne	EDNRA	49	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H]1c1ccc3c(c1)OCO3)C2	ZINC000819236434	GF	On-Demand	Anodyne	EDNRB	51	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H]1c1ccc3c(c1)OCO3)C2	ZINC000819236434	GF	On-Demand	Anodyne	EDNRA	49	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1c1ccc3c(c1)OCO3)C2	ZINC000819236436	GF	On-Demand	Anodyne	EDNRB	51	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1c1ccc3c(c1)OCO3)C2	ZINC000819236436	GF	On-Demand	Anodyne	EDNRA	49	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1c1ccc3c(c1)OCO3)C2	ZINC000819236439	GF	On-Demand	Anodyne	EDNRB	51	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1c1ccc3c(c1)OCO3)C2	ZINC000819236439	GF	On-Demand	Anodyne	EDNRA	49	38
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)C(F)=C3CCC3)c2)CC1	ZINC000819236488	GE	On-Demand	Anodyne	TGM2	40	31
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)C(F)=C3CCC3)c2)CC1	ZINC000819236488	GE	On-Demand	Anodyne	F13A1	61	39
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)C(F)=C3CCC3)c2)CC1	ZINC000819236488	GE	On-Demand	Anodyne	AKR1C3	58	48
O=C(O)[C@@H]1CCCN1C(=O)c1ccc2c(O)nc(S)nc2c1	ZINC000819236525	DD	On-Demand	Anodyne	ACE	38	41
O=C(O)[C@@H]1CCCN1C(=O)c1ccc2c(O)nc(S)nc2c1	ZINC000819236525	DD	On-Demand	Anodyne	PREP	29	42
O=C(O)[C@H]1CCCN1C(=O)c1ccc2c(O)nc(S)nc2c1	ZINC000819236526	DD	On-Demand	Anodyne	ACE	38	41
O=C(O)[C@H]1CCCN1C(=O)c1ccc2c(O)nc(S)nc2c1	ZINC000819236526	DD	On-Demand	Anodyne	PREP	29	42
O=C(O)[C@@H]1CCCN1C(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	ZINC000819236529	DB	On-Demand	Anodyne	ACE	53	43
O=C(O)[C@@H]1CCCN1C(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	ZINC000819236529	DB	On-Demand	Anodyne	PREP	79	45
O=C(O)[C@@H]1CCCN1C(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	ZINC000819236529	DB	On-Demand	Anodyne	L3MBTL3	55	35
O=C(O)[C@H]1CCCN1C(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	ZINC000819236530	DB	On-Demand	Anodyne	ACE	53	43
O=C(O)[C@H]1CCCN1C(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	ZINC000819236530	DB	On-Demand	Anodyne	PREP	79	45
O=C(O)[C@H]1CCCN1C(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	ZINC000819236530	DB	On-Demand	Anodyne	L3MBTL3	55	35
O=C(O)[C@H]1CCCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819236531	DD	On-Demand	Bother	ACE	25	42
O=C(O)[C@@H]1CCCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819236532	DD	On-Demand	Bother	ACE	25	42
O=C(O)[C@@H]1CCCN1C(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1	ZINC000819236533	FE	On-Demand	Anodyne	ACE	48	45
O=C(O)[C@@H]1CCCN1C(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1	ZINC000819236533	FE	On-Demand	Anodyne	PTGS1	17	41
O=C(O)[C@@H]1CCCN1C(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1	ZINC000819236533	FE	On-Demand	Anodyne	PREP	68	51
O=C(O)[C@H]1CCCN1C(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1	ZINC000819236534	FE	On-Demand	Anodyne	ACE	48	45
O=C(O)[C@H]1CCCN1C(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1	ZINC000819236534	FE	On-Demand	Anodyne	PTGS1	17	41
O=C(O)[C@H]1CCCN1C(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1	ZINC000819236534	FE	On-Demand	Anodyne	PREP	68	51
O=C(O)[C@H]1CCCN1C(=O)c1ccc[n+]([O-])c1	ZINC000819236535	BC	On-Demand	Anodyne	ACE	53	46
O=C(O)[C@H]1CCCN1C(=O)c1ccc[n+]([O-])c1	ZINC000819236535	BC	On-Demand	Anodyne	PREP	67	51
O=C(O)[C@H]1CCCN1C(=O)c1ccc[n+]([O-])c1	ZINC000819236535	BC	On-Demand	Anodyne	SFRP1	41	37
O=C(O)[C@H]1CCCN1C(=O)c1ccc[n+]([O-])c1	ZINC000819236535	BC	On-Demand	Anodyne	WNT3	43	37
O=C(O)[C@H]1CCCN1C(=O)c1ccc2nc(O)oc2c1	ZINC000819236536	CD	On-Demand	Anodyne	ACE	37	40
O=C(O)[C@H]1CCCN1C(=O)c1ccc2nc(O)oc2c1	ZINC000819236536	CD	On-Demand	Anodyne	PREP	41	45
O=C(O)[C@@H]1CCCN1C(=O)c1ccc2nc(O)oc2c1	ZINC000819236537	CD	On-Demand	Anodyne	ACE	37	40
O=C(O)[C@@H]1CCCN1C(=O)c1ccc2nc(O)oc2c1	ZINC000819236537	CD	On-Demand	Anodyne	PREP	41	45
O=C(O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O	ZINC000819236538	FD	On-Demand	Anodyne	PREP	50	42
O=C(O)[C@H]1CCCN1C(=O)c1ccc2c(c1)C(=O)N(Cc1ccco1)C2=O	ZINC000819236539	FD	On-Demand	Anodyne	PREP	50	42
O=C(O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cn1	ZINC000819236540	CC	On-Demand	Bother	ACE	39	46
O=C(O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cn1	ZINC000819236540	CC	On-Demand	Bother	PREP	66	40
O=C(O)[C@@H]1CCCN1C(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819236541	CC	On-Demand	Anodyne	ACE	44	42
O=C(O)[C@@H]1CCCN1C(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819236541	CC	On-Demand	Anodyne	PREP	63	42
O=C(O)[C@H]1CCCN1C(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819236542	CC	On-Demand	Anodyne	ACE	44	42
O=C(O)[C@H]1CCCN1C(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819236542	CC	On-Demand	Anodyne	PREP	63	42
O=C(O)[C@H]1CCCN1C(=O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819236543	DD	On-Demand	Anodyne	ACE	47	44
O=C(O)[C@H]1CCCN1C(=O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819236543	DD	On-Demand	Anodyne	PREP	61	53
O=C(O)[C@H]1CCCN1C(=O)c1ccc(-c2ccco2)s1	ZINC000819236544	CF	On-Demand	Anodyne	ACE	44	39
O=C(O)[C@H]1CCCN1C(=O)c1ccc(-c2ccco2)s1	ZINC000819236544	CF	On-Demand	Anodyne	PREP	46	39
O=C(O)[C@@H]1CCCN1C(=O)c1ccc(-c2ccco2)s1	ZINC000819236545	CF	On-Demand	Anodyne	ACE	44	39
O=C(O)[C@@H]1CCCN1C(=O)c1ccc(-c2ccco2)s1	ZINC000819236545	CF	On-Demand	Anodyne	PREP	46	39
O=C(O)[C@H]1CCCN1C(=O)c1cc(COc2ccc(Cl)cc2Cl)on1	ZINC000819236548	GG	On-Demand	Anodyne	PTGER1	48	36
O=C(O)[C@H]1CCCN1C(=O)c1cc(COc2ccc(Cl)cc2Cl)on1	ZINC000819236548	GG	On-Demand	Anodyne	PREP	37	41
O=C(O)[C@@H]1CCCN1C(=O)c1cc(COc2ccc(Cl)cc2Cl)on1	ZINC000819236549	GG	On-Demand	Anodyne	PTGER1	48	36
O=C(O)[C@@H]1CCCN1C(=O)c1cc(COc2ccc(Cl)cc2Cl)on1	ZINC000819236549	GG	On-Demand	Anodyne	PREP	37	41
O=C(O)[C@H]1CCCN1C(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	ZINC000819236550	GD	On-Demand	Anodyne	PREP	32	44
O=C(O)[C@H]1CCCN1C(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	ZINC000819236550	GD	On-Demand	Anodyne	SFRP1	62	41
O=C(O)[C@H]1CCCN1C(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	ZINC000819236550	GD	On-Demand	Anodyne	WNT3	55	41
O=C(O)[C@@H]1CCCN1C(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	ZINC000819236551	GD	On-Demand	Anodyne	PREP	32	44
O=C(O)[C@@H]1CCCN1C(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	ZINC000819236551	GD	On-Demand	Anodyne	SFRP1	62	41
O=C(O)[C@@H]1CCCN1C(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	ZINC000819236551	GD	On-Demand	Anodyne	WNT3	55	41
O=C(O)[C@H]1CCCN1C(=O)c1ccc(-n2cccc2)nc1	ZINC000819236552	CD	On-Demand	Anodyne	ACE	48	44
O=C(O)[C@H]1CCCN1C(=O)c1ccc(-n2cccc2)nc1	ZINC000819236552	CD	On-Demand	Anodyne	PREP	92	44
O=C(O)[C@@H]1CCCN1C(=O)c1ccc(-n2cccc2)nc1	ZINC000819236553	CD	On-Demand	Anodyne	ACE	48	44
O=C(O)[C@@H]1CCCN1C(=O)c1ccc(-n2cccc2)nc1	ZINC000819236553	CD	On-Demand	Anodyne	PREP	92	44
O=C(O)[C@@H]1CCCN1C(=O)c1ccc(F)c(I)c1	ZINC000819236554	FE	On-Demand	Anodyne	ACE	51	45
O=C(O)[C@@H]1CCCN1C(=O)c1ccc(F)c(I)c1	ZINC000819236554	FE	On-Demand	Anodyne	PREP	54	48
O=C(O)[C@H]1CCCN1C(=O)c1ccc(F)c(I)c1	ZINC000819236555	FE	On-Demand	Anodyne	ACE	51	45
O=C(O)[C@H]1CCCN1C(=O)c1ccc(F)c(I)c1	ZINC000819236555	FE	On-Demand	Anodyne	PREP	54	48
O=C(O)[C@@H]1CCCN1C(=O)c1cc(I)c(F)cc1F	ZINC000819236556	GE	On-Demand	Anodyne	ACE	44	38
O=C(O)[C@H]1CCCN1C(=O)c1cc(I)c(F)cc1F	ZINC000819236557	GE	On-Demand	Anodyne	ACE	44	38
O=C(O)[C@H]1CCCN1C(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819236558	FD	On-Demand	Anodyne	AKR1C3	29	44
O=C(O)[C@H]1CCCN1C(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819236558	FD	On-Demand	Anodyne	SFRP1	44	33
O=C(O)[C@H]1CCCN1C(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819236558	FD	On-Demand	Anodyne	WNT3	43	33
O=C(O)[C@@H]1CCCN1C(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819236559	FD	On-Demand	Anodyne	AKR1C3	29	44
O=C(O)[C@@H]1CCCN1C(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819236559	FD	On-Demand	Anodyne	SFRP1	44	33
O=C(O)[C@@H]1CCCN1C(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819236559	FD	On-Demand	Anodyne	WNT3	43	33
O=C(O)[C@H]1CCCN1C(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819236560	DE	On-Demand	Anodyne	ACE	49	46
O=C(O)[C@H]1CCCN1C(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819236560	DE	On-Demand	Anodyne	FKBP1A	40	36
O=C(O)[C@H]1CCCN1C(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819236560	DE	On-Demand	Anodyne	SLC6A1	49	35
O=C(O)[C@H]1CCCN1C(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819236560	DE	On-Demand	Anodyne	CPT1A	69	37
O=C(O)[C@H]1CCCN1C(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819236560	DE	On-Demand	Anodyne	CPT2	43	37
O=C(O)[C@H]1CCCN1C(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819236560	DE	On-Demand	Anodyne	PREP	79	46
O=C(O)[C@H]1CCCN1C(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819236560	DE	On-Demand	Anodyne	CFTR	43	37
O=C(O)[C@H]1CCCN1C(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819236560	DE	On-Demand	Anodyne	SFRP1	65	41
O=C(O)[C@H]1CCCN1C(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819236560	DE	On-Demand	Anodyne	WNT3	58	41
O=C(O)[C@@H]1CCCN1C(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819236561	DE	On-Demand	Anodyne	ACE	49	46
O=C(O)[C@@H]1CCCN1C(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819236561	DE	On-Demand	Anodyne	FKBP1A	40	36
O=C(O)[C@@H]1CCCN1C(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819236561	DE	On-Demand	Anodyne	SLC6A1	49	35
O=C(O)[C@@H]1CCCN1C(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819236561	DE	On-Demand	Anodyne	CPT1A	69	37
O=C(O)[C@@H]1CCCN1C(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819236561	DE	On-Demand	Anodyne	CPT2	43	37
O=C(O)[C@@H]1CCCN1C(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819236561	DE	On-Demand	Anodyne	PREP	79	46
O=C(O)[C@@H]1CCCN1C(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819236561	DE	On-Demand	Anodyne	CFTR	43	37
O=C(O)[C@@H]1CCCN1C(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819236561	DE	On-Demand	Anodyne	SFRP1	65	41
O=C(O)[C@@H]1CCCN1C(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819236561	DE	On-Demand	Anodyne	WNT3	58	41
O=C(O)[C@@H]1CCCN1C(=O)c1cc(I)ccc1F	ZINC000819236562	FE	On-Demand	Anodyne	ACE	48	40
O=C(O)[C@@H]1CCCN1C(=O)c1cc(I)ccc1F	ZINC000819236562	FE	On-Demand	Anodyne	PREP	47	39
O=C(O)[C@H]1CCCN1C(=O)c1cc(I)ccc1F	ZINC000819236563	FE	On-Demand	Anodyne	ACE	48	40
O=C(O)[C@H]1CCCN1C(=O)c1cc(I)ccc1F	ZINC000819236563	FE	On-Demand	Anodyne	PREP	47	39
O=C(CCNC1CCC(O)(c2cccnc2)CC1)Nc1ccc(Cl)cc1	ZINC000819236588	FG	On-Demand	Anodyne	NAMPT	36	42
C[C@@H](CCC1CC1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819236594	CF	On-Demand	Bother	CACNA1D	41	36
C[C@@H](CCC1CC1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819236596	CF	On-Demand	Bother	CACNA1D	41	36
Cc1ccccc1[C@@H](O)CNCCCC(=O)OC(C)C	ZINC000819236600	CE	On-Demand	Anodyne	ADRB2	22	48
CCC[C@@H]1CCCC[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819236699	FI	On-Demand	Mild	PAPA1_CARPA	36	49
CCC[C@@H]1CCCC[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819236701	FI	On-Demand	Mild	PAPA1_CARPA	36	49
CCC[C@@H]1CCCC[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819236703	FI	On-Demand	Mild	PAPA1_CARPA	36	49
CCC[C@@H]1CCCC[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819236705	FI	On-Demand	Mild	PAPA1_CARPA	36	49
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2c(F)cccc2Cl)CC1	ZINC000819236737	FE	On-Demand	Anodyne	L3MBTL3	52	35
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2c(F)cccc2Cl)CC1	ZINC000819236739	FE	On-Demand	Anodyne	L3MBTL3	52	35
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2c(F)cccc2Cl)CC1	ZINC000819236742	FE	On-Demand	Anodyne	L3MBTL3	52	35
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2c(F)cccc2Cl)CC1	ZINC000819236744	FE	On-Demand	Anodyne	L3MBTL3	52	35
C[C@H](NC[C@H](O)c1cccc(F)c1)[C@@H](c1ccccc1)N(C)C	ZINC000819236762	DG	On-Demand	Anodyne	ADRB2	18	45
C[C@H](NC[C@H](O)c1cccc(F)c1)[C@H](c1ccccc1)N(C)C	ZINC000819236764	DG	On-Demand	Anodyne	ADRB2	18	45
C[C@@H](CC(=O)NNC(=O)CCCc1ccccc1)n1cccn1	ZINC000819236806	DE	On-Demand	Reactive	HDAC1	15	46
C[C@@H](CC(=O)NNC(=O)CCCc1ccccc1)n1cccn1	ZINC000819236806	DE	On-Demand	Reactive	FAAH	64	44
C[C@@H](CC(=O)NNC(=O)CCCc1ccccc1)n1cccn1	ZINC000819236806	DE	On-Demand	Reactive	CES1	63	34
C[C@@H](CC(=O)NNC(=O)CCCc1ccccc1)n1cccn1	ZINC000819236806	DE	On-Demand	Reactive	DAGLA	17	44
C[C@@H](CC(=O)NNC(=O)CCCc1ccccc1)n1cccn1	ZINC000819236806	DE	On-Demand	Reactive	CES1D	58	35
C[C@H](CC(=O)NNC(=O)CCCc1ccccc1)n1cccn1	ZINC000819236807	DE	On-Demand	Reactive	HDAC1	15	46
C[C@H](CC(=O)NNC(=O)CCCc1ccccc1)n1cccn1	ZINC000819236807	DE	On-Demand	Reactive	FAAH	64	44
C[C@H](CC(=O)NNC(=O)CCCc1ccccc1)n1cccn1	ZINC000819236807	DE	On-Demand	Reactive	CES1	63	34
C[C@H](CC(=O)NNC(=O)CCCc1ccccc1)n1cccn1	ZINC000819236807	DE	On-Demand	Reactive	DAGLA	17	44
C[C@H](CC(=O)NNC(=O)CCCc1ccccc1)n1cccn1	ZINC000819236807	DE	On-Demand	Reactive	CES1D	58	35
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236827	FD	On-Demand	Anodyne	PIK3CA	15	46
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236827	FD	On-Demand	Anodyne	PLD1	49	36
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236827	FD	On-Demand	Anodyne	MTOR	24	46
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236827	FD	On-Demand	Anodyne	EPHX2	24	60
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236827	FD	On-Demand	Anodyne	PIK3CG	16	46
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236827	FD	On-Demand	Anodyne	PLD2	66	36
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236827	FD	On-Demand	Anodyne	HPGDS	25	43
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236829	FD	On-Demand	Anodyne	PIK3CA	15	46
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236829	FD	On-Demand	Anodyne	PLD1	49	36
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236829	FD	On-Demand	Anodyne	MTOR	24	46
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236829	FD	On-Demand	Anodyne	EPHX2	24	60
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236829	FD	On-Demand	Anodyne	PIK3CG	16	46
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236829	FD	On-Demand	Anodyne	PLD2	66	36
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236829	FD	On-Demand	Anodyne	HPGDS	25	43
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236830	FD	On-Demand	Anodyne	PIK3CA	15	46
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236830	FD	On-Demand	Anodyne	PLD1	49	36
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236830	FD	On-Demand	Anodyne	MTOR	24	46
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236830	FD	On-Demand	Anodyne	EPHX2	24	60
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236830	FD	On-Demand	Anodyne	PIK3CG	16	46
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236830	FD	On-Demand	Anodyne	PLD2	66	36
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236830	FD	On-Demand	Anodyne	HPGDS	25	43
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236832	FD	On-Demand	Anodyne	PIK3CA	15	46
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236832	FD	On-Demand	Anodyne	PLD1	49	36
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236832	FD	On-Demand	Anodyne	MTOR	24	46
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236832	FD	On-Demand	Anodyne	EPHX2	24	60
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236832	FD	On-Demand	Anodyne	PIK3CG	16	46
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236832	FD	On-Demand	Anodyne	PLD2	66	36
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCOCC2)cc1	ZINC000819236832	FD	On-Demand	Anodyne	HPGDS	25	43
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@@H](c1ccccc1)N(C)C	ZINC000819236833	EH	On-Demand	Anodyne	ADRB2	23	49
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@@H](c1ccccc1)N(C)C	ZINC000819236833	EH	On-Demand	Anodyne	ADRB1	38	50
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@@H](c1ccccc1)N(C)C	ZINC000819236833	EH	On-Demand	Anodyne	ADRB3	59	50
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@@H](c1ccccc1)N(C)C	ZINC000819236833	EH	On-Demand	Anodyne	CYP3A4	40	35
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@H](c1ccccc1)N(C)C	ZINC000819236836	EH	On-Demand	Anodyne	ADRB2	23	49
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@H](c1ccccc1)N(C)C	ZINC000819236836	EH	On-Demand	Anodyne	ADRB1	38	50
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@H](c1ccccc1)N(C)C	ZINC000819236836	EH	On-Demand	Anodyne	ADRB3	59	50
C[C@H](NC[C@H](O)c1cccc(Cl)c1)[C@H](c1ccccc1)N(C)C	ZINC000819236836	EH	On-Demand	Anodyne	CYP3A4	40	35
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCO[C@@H](c3ccccc3)C2)c1	ZINC000819236848	EG	On-Demand	Bother	CACNA1D	40	34
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCO[C@H](c3ccccc3)C2)c1	ZINC000819236850	EG	On-Demand	Bother	CACNA1D	40	34
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCO[C@@H](c3ccccc3)C2)c1	ZINC000819236854	EG	On-Demand	Bother	CACNA1D	40	34
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCO[C@H](c3ccccc3)C2)c1	ZINC000819236856	EG	On-Demand	Bother	CACNA1D	40	34
O[C@H](CN[C@@H]1CCO[C@@H](c2ccccc2)C1)c1ccc(F)cc1	ZINC000819236874	DG	On-Demand	Anodyne	SLC6A3	21	60
O[C@H](CN[C@@H]1CCO[C@@H](c2ccccc2)C1)c1ccc(F)cc1	ZINC000819236874	DG	On-Demand	Anodyne	SLC18A3	16	44
O[C@H](CN[C@H]1CCO[C@@H](c2ccccc2)C1)c1ccc(F)cc1	ZINC000819236876	DG	On-Demand	Anodyne	SLC6A3	21	60
O[C@H](CN[C@H]1CCO[C@@H](c2ccccc2)C1)c1ccc(F)cc1	ZINC000819236876	DG	On-Demand	Anodyne	SLC18A3	16	44
O[C@H](CN[C@H]1CCO[C@H](c2ccccc2)C1)c1ccc(F)cc1	ZINC000819236878	DG	On-Demand	Anodyne	SLC6A3	21	60
O[C@H](CN[C@H]1CCO[C@H](c2ccccc2)C1)c1ccc(F)cc1	ZINC000819236878	DG	On-Demand	Anodyne	SLC18A3	16	44
O[C@H](CN[C@@H]1CCO[C@H](c2ccccc2)C1)c1ccc(F)cc1	ZINC000819236879	DG	On-Demand	Anodyne	SLC6A3	21	60
O[C@H](CN[C@@H]1CCO[C@H](c2ccccc2)C1)c1ccc(F)cc1	ZINC000819236879	DG	On-Demand	Anodyne	SLC18A3	16	44
O[C@@H](CNCc1csc(COc2ccccc2)n1)Cc1cccc(Cl)c1	ZINC000819236885	GI	On-Demand	Anodyne	ADRB2	21	42
O[C@@H](CNCc1csc(COc2ccccc2)n1)Cc1cccc(Cl)c1	ZINC000819236885	GI	On-Demand	Anodyne	ADRB1	43	42
O[C@@H](CNCc1csc(COc2ccccc2)n1)Cc1cccc(Cl)c1	ZINC000819236885	GI	On-Demand	Anodyne	MAOB	22	42
O[C@@H](CNCc1csc(COc2ccccc2)n1)Cc1cccc(Cl)c1	ZINC000819236885	GI	On-Demand	Anodyne	ADRB3	37	42
O[C@@H](CNCc1csc(COc2ccccc2)n1)Cc1cccc(Cl)c1	ZINC000819236885	GI	On-Demand	Anodyne	PDS	40	36
O[C@H](CNCc1csc(COc2ccccc2)n1)Cc1cccc(Cl)c1	ZINC000819236887	GI	On-Demand	Anodyne	ADRB2	21	42
O[C@H](CNCc1csc(COc2ccccc2)n1)Cc1cccc(Cl)c1	ZINC000819236887	GI	On-Demand	Anodyne	ADRB1	43	42
O[C@H](CNCc1csc(COc2ccccc2)n1)Cc1cccc(Cl)c1	ZINC000819236887	GI	On-Demand	Anodyne	MAOB	22	42
O[C@H](CNCc1csc(COc2ccccc2)n1)Cc1cccc(Cl)c1	ZINC000819236887	GI	On-Demand	Anodyne	ADRB3	37	42
O[C@H](CNCc1csc(COc2ccccc2)n1)Cc1cccc(Cl)c1	ZINC000819236887	GI	On-Demand	Anodyne	PDS	40	36
CS(=O)(=O)c1ccc([C@H](O)CNCCC2=CCCCCC2)cc1	ZINC000819236907	EF	On-Demand	Anodyne	ADRB2	35	42
CS(=O)(=O)c1ccc([C@H](O)CNCCC2=CCCCCC2)cc1	ZINC000819236907	EF	On-Demand	Anodyne	ADRB3	92	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCC2=CCCCCC2)cc1	ZINC000819236909	EF	On-Demand	Anodyne	ADRB2	35	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCC2=CCCCCC2)cc1	ZINC000819236909	EF	On-Demand	Anodyne	ADRB3	92	40
C=CCC1(C(=O)Nc2ccc(N3CCC(N(C)C)CC3)c(F)c2)CCOCC1	ZINC000819236910	GH	On-Demand	Mild	NPY2R	85	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCC2=CCCCCC2)c1	ZINC000819236939	DG	On-Demand	Bother	ADRB1	29	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCC2=CCCCCC2)c1	ZINC000819236939	DG	On-Demand	Bother	ADRB3	61	40
O=[N+]([O-])c1cccc([C@H](O)CNCCC2=CCCCCC2)c1	ZINC000819236941	DG	On-Demand	Bother	ADRB1	29	40
O=[N+]([O-])c1cccc([C@H](O)CNCCC2=CCCCCC2)c1	ZINC000819236941	DG	On-Demand	Bother	ADRB3	61	40
O[C@@H](CNCCC1=CCCCCC1)c1ccc(F)cc1	ZINC000819236961	CH	On-Demand	Anodyne	ADRB2	18	44
O[C@H](CNCCC1=CCCCCC1)c1ccc(F)cc1	ZINC000819236962	CH	On-Demand	Anodyne	ADRB2	18	44
O=C(Nc1cc(N2CCCS2(=O)=O)ccc1Cl)C(F)=C1CCC1	ZINC000819236963	FG	On-Demand	Anodyne	CDK1	18	42
CC(=O)Nc1cccc(CC(=O)NNC(=O)CCCc2ccccc2)c1	ZINC000819236985	FE	On-Demand	Reactive	PTGIR	17	42
CC(=O)Nc1cccc(CC(=O)NNC(=O)CCCc2ccccc2)c1	ZINC000819236985	FE	On-Demand	Reactive	HDAC8	27	40
CC(=O)Nc1cccc(CC(=O)NNC(=O)CCCc2ccccc2)c1	ZINC000819236985	FE	On-Demand	Reactive	HDAC1	22	50
CC(=O)Nc1cccc(CC(=O)NNC(=O)CCCc2ccccc2)c1	ZINC000819236985	FE	On-Demand	Reactive	HDAC2	22	50
CC(=O)Nc1cccc(CC(=O)NNC(=O)CCCc2ccccc2)c1	ZINC000819236985	FE	On-Demand	Reactive	HDAC3	24	40
CC(=O)Nc1cccc(CC(=O)NNC(=O)CCCc2ccccc2)c1	ZINC000819236985	FE	On-Demand	Reactive	HDAC6	24	41
CC(=O)Nc1cccc(CC(=O)NNC(=O)CCCc2ccccc2)c1	ZINC000819236985	FE	On-Demand	Reactive	FAAH	40	36
CC(=O)Nc1cccc(CC(=O)NNC(=O)CCCc2ccccc2)c1	ZINC000819236985	FE	On-Demand	Reactive	CES1	46	36
CC(=O)Nc1cccc(CC(=O)NNC(=O)CCCc2ccccc2)c1	ZINC000819236985	FE	On-Demand	Reactive	KCNK3	54	37
CNS(=O)(=O)c1ccccc1N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819236986	FD	On-Demand	Anodyne	KCNQ2	50	34
CNS(=O)(=O)c1ccccc1N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819236986	FD	On-Demand	Anodyne	SFRP1	51	31
CNS(=O)(=O)c1ccccc1N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819236986	FD	On-Demand	Anodyne	WNT3	47	31
CSc1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819236994	GF	On-Demand	Anodyne	ADRB2	29	43
CSc1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819236994	GF	On-Demand	Anodyne	ADRB1	34	43
CSc1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819236994	GF	On-Demand	Anodyne	ADRB3	26	43
CSc1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819236995	GF	On-Demand	Anodyne	ADRB2	29	43
CSc1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819236995	GF	On-Demand	Anodyne	ADRB1	34	43
CSc1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819236995	GF	On-Demand	Anodyne	ADRB3	26	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCN(c3cccc(OC)c3)C1)C2	ZINC000819237000	GE	On-Demand	Anodyne	MTNR1A	15	58
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCN(c3cccc(OC)c3)C1)C2	ZINC000819237000	GE	On-Demand	Anodyne	MTNR1B	16	58
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCN(c3cccc(OC)c3)C1)C2	ZINC000819237001	GE	On-Demand	Anodyne	MTNR1A	15	58
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCN(c3cccc(OC)c3)C1)C2	ZINC000819237001	GE	On-Demand	Anodyne	MTNR1B	16	58
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(c3cccc(OC)c3)C1)C2	ZINC000819237002	GE	On-Demand	Anodyne	MTNR1A	15	58
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(c3cccc(OC)c3)C1)C2	ZINC000819237002	GE	On-Demand	Anodyne	MTNR1B	16	58
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(c3cccc(OC)c3)C1)C2	ZINC000819237003	GE	On-Demand	Anodyne	MTNR1A	15	58
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(c3cccc(OC)c3)C1)C2	ZINC000819237003	GE	On-Demand	Anodyne	MTNR1B	16	58
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)/C=C/[C@@H]3CCCO3)c2)CC1	ZINC000819237004	GD	On-Demand	Anodyne	LPL	44	39
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)/C=C/[C@@H]3CCCO3)c2)CC1	ZINC000819237004	GD	On-Demand	Anodyne	TGM2	60	36
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)/C=C/[C@@H]3CCCO3)c2)CC1	ZINC000819237004	GD	On-Demand	Anodyne	F13A1	81	41
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)/C=C/[C@@H]3CCCO3)c2)CC1	ZINC000819237004	GD	On-Demand	Anodyne	AKR1C3	44	38
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)/C=C\[C@@H]3CCCO3)c2)CC1	ZINC000819237005	GD	On-Demand	Anodyne	LPL	44	39
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)/C=C\[C@@H]3CCCO3)c2)CC1	ZINC000819237005	GD	On-Demand	Anodyne	TGM2	60	36
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)/C=C\[C@@H]3CCCO3)c2)CC1	ZINC000819237005	GD	On-Demand	Anodyne	F13A1	81	41
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)/C=C\[C@@H]3CCCO3)c2)CC1	ZINC000819237005	GD	On-Demand	Anodyne	AKR1C3	44	38
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)/C=C/[C@H]3CCCO3)c2)CC1	ZINC000819237006	GD	On-Demand	Anodyne	LPL	44	39
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)/C=C/[C@H]3CCCO3)c2)CC1	ZINC000819237006	GD	On-Demand	Anodyne	TGM2	60	36
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)/C=C/[C@H]3CCCO3)c2)CC1	ZINC000819237006	GD	On-Demand	Anodyne	F13A1	81	41
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)/C=C/[C@H]3CCCO3)c2)CC1	ZINC000819237006	GD	On-Demand	Anodyne	AKR1C3	44	38
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)/C=C\[C@H]3CCCO3)c2)CC1	ZINC000819237007	GD	On-Demand	Anodyne	LPL	44	39
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)/C=C\[C@H]3CCCO3)c2)CC1	ZINC000819237007	GD	On-Demand	Anodyne	TGM2	60	36
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)/C=C\[C@H]3CCCO3)c2)CC1	ZINC000819237007	GD	On-Demand	Anodyne	F13A1	81	41
CN1CCCN(S(=O)(=O)c2cccc(NC(=O)/C=C\[C@H]3CCCO3)c2)CC1	ZINC000819237007	GD	On-Demand	Anodyne	AKR1C3	44	38
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)c1ccccc1	ZINC000819237008	DF	On-Demand	Anodyne	OPRL1	17	46
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)c1ccccc1	ZINC000819237008	DF	On-Demand	Anodyne	ADRB3	36	44
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)c1ccccc1	ZINC000819237009	DF	On-Demand	Anodyne	OPRL1	17	46
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)c1ccccc1	ZINC000819237009	DF	On-Demand	Anodyne	ADRB3	36	44
C[C@@H](NCCC(=O)Nc1ccc(N(C)C)cc1)[C@H](c1ccccc1)N(C)C	ZINC000819237057	FG	On-Demand	Anodyne	NPY5R	31	42
C[C@@H](NCCC(=O)Nc1ccc(N(C)C)cc1)[C@@H](c1ccccc1)N(C)C	ZINC000819237058	FG	On-Demand	Anodyne	NPY5R	31	42
O[C@@H](CNCc1csc(COc2ccccc2)n1)Cc1ccc(F)cc1	ZINC000819237059	FH	On-Demand	Anodyne	ADRB2	26	45
O[C@@H](CNCc1csc(COc2ccccc2)n1)Cc1ccc(F)cc1	ZINC000819237059	FH	On-Demand	Anodyne	ADRB1	43	45
O[C@@H](CNCc1csc(COc2ccccc2)n1)Cc1ccc(F)cc1	ZINC000819237059	FH	On-Demand	Anodyne	ADRB3	40	45
O[C@H](CNCc1csc(COc2ccccc2)n1)Cc1ccc(F)cc1	ZINC000819237060	FH	On-Demand	Anodyne	ADRB2	26	45
O[C@H](CNCc1csc(COc2ccccc2)n1)Cc1ccc(F)cc1	ZINC000819237060	FH	On-Demand	Anodyne	ADRB1	43	45
O[C@H](CNCc1csc(COc2ccccc2)n1)Cc1ccc(F)cc1	ZINC000819237060	FH	On-Demand	Anodyne	ADRB3	40	45
Cc1ccc2c(c1)nc(CNC[C@H](O)c1cccc(Cl)c1)n2C	ZINC000819237066	EG	On-Demand	Anodyne	ADRB3	35	41
Cc1ccc2c(c1)nc(CNC[C@@H](O)c1cccc(Cl)c1)n2C	ZINC000819237067	EG	On-Demand	Anodyne	ADRB3	35	41
CNC(=O)[C@@H]1CCCN1C(=O)CNC(=O)C(F)=C1CCC1	ZINC000819237076	CC	On-Demand	Anodyne	PREP	29	41
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCC(N(C)C)CC2)c(F)c1	ZINC000819237123	EH	On-Demand	Mild	NPY2R	112	46
C[C@H](NC[C@H](O)c1ccc(Br)cc1)[C@@H](c1ccccc1)N(C)C	ZINC000819237125	GH	On-Demand	Anodyne	AOC3	23	40
C[C@H](NC[C@H](O)c1ccc(Br)cc1)[C@H](c1ccccc1)N(C)C	ZINC000819237127	GH	On-Demand	Anodyne	AOC3	23	40
Cc1ccc2c(c1)nc(CNC[C@H](O)c1cccnc1)n2C	ZINC000819237138	CE	On-Demand	Anodyne	ADRB2	17	41
Cc1ccc2c(c1)nc(CNC[C@H](O)c1cccnc1)n2C	ZINC000819237138	CE	On-Demand	Anodyne	ADRB1	20	41
Cc1ccc2c(c1)nc(CNC[C@H](O)c1cccnc1)n2C	ZINC000819237138	CE	On-Demand	Anodyne	ADRB3	80	49
Cc1ccc2c(c1)nc(CNC[C@@H](O)c1cccnc1)n2C	ZINC000819237139	CE	On-Demand	Anodyne	ADRB2	17	41
Cc1ccc2c(c1)nc(CNC[C@@H](O)c1cccnc1)n2C	ZINC000819237139	CE	On-Demand	Anodyne	ADRB1	20	41
Cc1ccc2c(c1)nc(CNC[C@@H](O)c1cccnc1)n2C	ZINC000819237139	CE	On-Demand	Anodyne	ADRB3	80	49
Cc1ccc2c(c1C)OC[C@H]2NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819237163	GG	On-Demand	Mild	PAPA1_CARPA	40	40
Cc1ccc2c(c1C)OC[C@H]2NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819237164	GG	On-Demand	Mild	PAPA1_CARPA	40	40
Cc1ccc2c(c1C)OC[C@@H]2NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819237165	GG	On-Demand	Mild	PAPA1_CARPA	40	40
Cc1ccc2c(c1C)OC[C@@H]2NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819237166	GG	On-Demand	Mild	PAPA1_CARPA	40	40
C=CCCn1cc(C(=O)Nc2ccc(N3CCC(N(C)C)CC3)c(F)c2)nn1	ZINC000819237167	GF	On-Demand	Mild	NPY2R	82	41
C[C@H](NC[C@H](O)c1cccnc1)[C@H](c1ccccc1)N(C)C	ZINC000819237229	CE	On-Demand	Anodyne	ADRB2	21	40
C[C@H](NC[C@H](O)c1cccnc1)[C@H](c1ccccc1)N(C)C	ZINC000819237229	CE	On-Demand	Anodyne	ADRB1	26	50
C[C@H](NC[C@H](O)c1cccnc1)[C@H](c1ccccc1)N(C)C	ZINC000819237229	CE	On-Demand	Anodyne	ADRB3	70	50
C[C@H](NC[C@H](O)c1cccnc1)[C@H](c1ccccc1)N(C)C	ZINC000819237229	CE	On-Demand	Anodyne	KCNA5	26	41
C[C@H](NC[C@H](O)c1cccnc1)[C@H](c1ccccc1)N(C)C	ZINC000819237229	CE	On-Demand	Anodyne	CYP51A1	17	42
C[C@H](NC[C@H](O)c1cccnc1)[C@@H](c1ccccc1)N(C)C	ZINC000819237231	CE	On-Demand	Anodyne	ADRB2	21	40
C[C@H](NC[C@H](O)c1cccnc1)[C@@H](c1ccccc1)N(C)C	ZINC000819237231	CE	On-Demand	Anodyne	ADRB1	26	50
C[C@H](NC[C@H](O)c1cccnc1)[C@@H](c1ccccc1)N(C)C	ZINC000819237231	CE	On-Demand	Anodyne	ADRB3	70	50
C[C@H](NC[C@H](O)c1cccnc1)[C@@H](c1ccccc1)N(C)C	ZINC000819237231	CE	On-Demand	Anodyne	KCNA5	26	41
C[C@H](NC[C@H](O)c1cccnc1)[C@@H](c1ccccc1)N(C)C	ZINC000819237231	CE	On-Demand	Anodyne	CYP51A1	17	42
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)c1	ZINC000819237244	GE	On-Demand	Anodyne	ADRB2	26	44
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)c1	ZINC000819237244	GE	On-Demand	Anodyne	ADRB1	28	40
CC(=O)c1cccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)c1	ZINC000819237244	GE	On-Demand	Anodyne	ADRB3	30	44
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)c1	ZINC000819237246	GE	On-Demand	Anodyne	ADRB2	26	44
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)c1	ZINC000819237246	GE	On-Demand	Anodyne	ADRB1	28	40
CC(=O)c1cccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)c1	ZINC000819237246	GE	On-Demand	Anodyne	ADRB3	30	44
Cc1ccccc1CC(C)(C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819237263	GI	On-Demand	Mild	PAPA1_CARPA	53	49
Cc1ccccc1CC(C)(C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819237263	GI	On-Demand	Mild	CCKAR	42	37
Cc1ccccc1CC(C)(C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819237263	GI	On-Demand	Mild	CTSK	23	43
Cc1ccccc1CC(C)(C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819237263	GI	On-Demand	Mild	CTSL	17	49
Cc1ccccc1CC(C)(C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819237263	GI	On-Demand	Mild	TACR3	16	42
Cc1ccccc1CC(C)(C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819237263	GI	On-Demand	Mild	CTSS	15	49
Cc1ccccc1CC(C)(C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819237263	GI	On-Demand	Mild	FPR1	46	41
Cc1ccccc1CC(C)(C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819237265	GI	On-Demand	Mild	PAPA1_CARPA	53	49
Cc1ccccc1CC(C)(C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819237265	GI	On-Demand	Mild	CCKAR	42	37
Cc1ccccc1CC(C)(C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819237265	GI	On-Demand	Mild	CTSK	23	43
Cc1ccccc1CC(C)(C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819237265	GI	On-Demand	Mild	CTSL	17	49
Cc1ccccc1CC(C)(C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819237265	GI	On-Demand	Mild	TACR3	16	42
Cc1ccccc1CC(C)(C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819237265	GI	On-Demand	Mild	CTSS	15	49
Cc1ccccc1CC(C)(C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819237265	GI	On-Demand	Mild	FPR1	46	41
O=C(NCCCN1CCOC1=O)c1cc(-c2ccc3ccccc3c2)[nH]n1	ZINC000819237271	FF	On-Demand	Anodyne	HTR2A	18	41
O=C(NCCCN1CCOC1=O)c1cc(-c2ccc3ccccc3c2)[nH]n1	ZINC000819237271	FF	On-Demand	Anodyne	HTR2C	15	41
O=C(NCCCN1CCOC1=O)c1cc(-c2ccc3ccccc3c2)[nH]n1	ZINC000819237271	FF	On-Demand	Anodyne	DRD3	32	41
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819237279	GH	On-Demand	Anodyne	CCR2	15	41
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)c1ccc(C(F)(F)F)cc1	ZINC000819237281	GH	On-Demand	Anodyne	CCR2	15	41
C=CCCCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819237288	DH	On-Demand	Mild	ADRB3	22	41
C=CCCCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819237290	DH	On-Demand	Mild	ADRB3	22	41
CS(=O)(=O)c1ccc([C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237292	GD	On-Demand	Anodyne	ADRB3	46	37
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237294	GD	On-Demand	Anodyne	ADRB3	46	37
O[C@H](CNCc1nnnn1CC1CC1)c1cccc(Cl)c1	ZINC000819237296	DD	On-Demand	Anodyne	ADRB3	37	40
O[C@H](CNCc1nnnn1CC1CC1)c1cccc(Cl)c1	ZINC000819237296	DD	On-Demand	Anodyne	CYP3A4	40	33
O[C@@H](CNCc1nnnn1CC1CC1)c1cccc(Cl)c1	ZINC000819237298	DD	On-Demand	Anodyne	ADRB3	37	40
O[C@@H](CNCc1nnnn1CC1CC1)c1cccc(Cl)c1	ZINC000819237298	DD	On-Demand	Anodyne	CYP3A4	40	33
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCC(N(C)C)CC2)c(F)c1	ZINC000819237310	FI	On-Demand	Anodyne	NPY2R	102	46
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCC(N(C)C)CC2)c(F)c1	ZINC000819237314	FI	On-Demand	Anodyne	NPY2R	102	46
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)c1ccccc1C(F)(F)F	ZINC000819237336	GH	On-Demand	Anodyne	SCD1	17	40
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)c1ccccc1C(F)(F)F	ZINC000819237336	GH	On-Demand	Anodyne	SCD	22	40
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)c1ccccc1C(F)(F)F	ZINC000819237338	GH	On-Demand	Anodyne	SCD1	17	40
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)c1ccccc1C(F)(F)F	ZINC000819237338	GH	On-Demand	Anodyne	SCD	22	40
COc1ccc(OC)c([C@H](O)CNCCc2cn(C)c3cc(F)ccc23)c1	ZINC000819237343	FG	On-Demand	Anodyne	MTNR1A	15	43
C=CCCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819237361	CG	On-Demand	Mild	ADRB2	24	42
C=CCCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819237361	CG	On-Demand	Mild	ADRB1	22	42
C=CCCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819237361	CG	On-Demand	Mild	ADRB3	21	42
C=CCCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819237363	CG	On-Demand	Mild	ADRB2	24	42
C=CCCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819237363	CG	On-Demand	Mild	ADRB1	22	42
C=CCCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819237363	CG	On-Demand	Mild	ADRB3	21	42
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)c1cccc(Cl)c1	ZINC000819237373	EG	On-Demand	Anodyne	ADRB1	30	43
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)c1cccc(Cl)c1	ZINC000819237373	EG	On-Demand	Anodyne	ADRB3	50	49
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)c1cccc(Cl)c1	ZINC000819237374	EG	On-Demand	Anodyne	ADRB1	30	43
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)c1cccc(Cl)c1	ZINC000819237374	EG	On-Demand	Anodyne	ADRB3	50	49
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237377	GE	On-Demand	Anodyne	ADRB2	31	41
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237377	GE	On-Demand	Anodyne	ADRB1	47	41
CC(=O)c1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237377	GE	On-Demand	Anodyne	ADRB3	37	41
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237378	GE	On-Demand	Anodyne	ADRB2	31	41
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237378	GE	On-Demand	Anodyne	ADRB1	47	41
CC(=O)c1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237378	GE	On-Demand	Anodyne	ADRB3	37	41
Cn1cc(CCNC[C@H](O)c2ccccc2)c2ccc(F)cc21	ZINC000819237387	DG	On-Demand	Anodyne	ADRB2	32	42
Cn1cc(CCNC[C@H](O)c2ccccc2)c2ccc(F)cc21	ZINC000819237387	DG	On-Demand	Anodyne	ADRB3	80	39
Cn1cc(CCNC[C@@H](O)c2ccccc2)c2ccc(F)cc21	ZINC000819237388	DG	On-Demand	Anodyne	ADRB2	32	42
Cn1cc(CCNC[C@@H](O)c2ccccc2)c2ccc(F)cc21	ZINC000819237388	DG	On-Demand	Anodyne	ADRB3	80	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1nc3ccc(C)cc3s1)C2	ZINC000819237394	FG	On-Demand	Anodyne	LCK	25	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1nc3ccc(C)cc3s1)C2	ZINC000819237394	FG	On-Demand	Anodyne	CSNK1D	44	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1nc3ccc(C)cc3s1)C2	ZINC000819237395	FG	On-Demand	Anodyne	LCK	25	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1nc3ccc(C)cc3s1)C2	ZINC000819237395	FG	On-Demand	Anodyne	CSNK1D	44	46
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)c1ccc(OC(F)(F)F)cc1	ZINC000819237430	GG	On-Demand	Anodyne	ADRB3	18	40
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)c1ccc(OC(F)(F)F)cc1	ZINC000819237431	GG	On-Demand	Anodyne	ADRB3	18	40
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)c1cccc(F)c1	ZINC000819237432	EF	On-Demand	Anodyne	ADRB3	16	40
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)c1cccc(F)c1	ZINC000819237433	EF	On-Demand	Anodyne	ADRB3	16	40
N#CCc1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237436	GE	On-Demand	Mild	ADRB2	30	41
N#CCc1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237436	GE	On-Demand	Mild	ADRB1	42	42
N#CCc1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237436	GE	On-Demand	Mild	ADRB3	34	41
N#CCc1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237437	GE	On-Demand	Mild	ADRB2	30	41
N#CCc1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237437	GE	On-Demand	Mild	ADRB1	42	42
N#CCc1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237437	GE	On-Demand	Mild	ADRB3	34	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819237440	CC	On-Demand	Anodyne	ADRB1	30	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819237440	CC	On-Demand	Anodyne	GRIN2B	19	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819237440	CC	On-Demand	Anodyne	ADRB3	86	49
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819237440	CC	On-Demand	Anodyne	PTAFR	16	46
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819237440	CC	On-Demand	Anodyne	C3AR1	43	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819237440	CC	On-Demand	Anodyne	CCR8	29	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819237440	CC	On-Demand	Anodyne	SCD	19	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819237441	CC	On-Demand	Anodyne	ADRB1	30	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819237441	CC	On-Demand	Anodyne	GRIN2B	19	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819237441	CC	On-Demand	Anodyne	ADRB3	86	49
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819237441	CC	On-Demand	Anodyne	PTAFR	16	46
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819237441	CC	On-Demand	Anodyne	C3AR1	43	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819237441	CC	On-Demand	Anodyne	CCR8	29	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819237441	CC	On-Demand	Anodyne	SCD	19	42
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819237442	CC	On-Demand	Anodyne	ADRB1	30	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819237442	CC	On-Demand	Anodyne	GRIN2B	19	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819237442	CC	On-Demand	Anodyne	ADRB3	86	49
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819237442	CC	On-Demand	Anodyne	PTAFR	16	46
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819237442	CC	On-Demand	Anodyne	C3AR1	43	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819237442	CC	On-Demand	Anodyne	CCR8	29	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819237442	CC	On-Demand	Anodyne	SCD	19	42
CCOC(=O)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819237443	CC	On-Demand	Anodyne	ADRB1	30	41
CCOC(=O)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819237443	CC	On-Demand	Anodyne	GRIN2B	19	41
CCOC(=O)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819237443	CC	On-Demand	Anodyne	ADRB3	86	49
CCOC(=O)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819237443	CC	On-Demand	Anodyne	PTAFR	16	46
CCOC(=O)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819237443	CC	On-Demand	Anodyne	C3AR1	43	40
CCOC(=O)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819237443	CC	On-Demand	Anodyne	CCR8	29	40
CCOC(=O)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819237443	CC	On-Demand	Anodyne	SCD	19	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819237461	GD	On-Demand	Anodyne	GPR119	28	42
CCOC(=O)N1CC[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819237462	GD	On-Demand	Anodyne	GPR119	28	42
CCOC(=O)N1CC[C@@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819237463	GD	On-Demand	Anodyne	GPR119	28	42
CCOC(=O)N1CC[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819237464	GD	On-Demand	Anodyne	GPR119	28	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2nnnn2CC2CC2)CC1	ZINC000819237484	GD	On-Demand	Anodyne	GPR119	31	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2nnnn2CC2CC2)CC1	ZINC000819237485	GD	On-Demand	Anodyne	GPR119	31	42
O=C(CCNC1CCC(O)(c2cccnc2)CC1)Nc1ccccc1	ZINC000819237492	EF	On-Demand	Anodyne	NAMPT	43	43
C=CCCCCNC[C@H](O)c1ccc(C)cc1	ZINC000819237522	BF	On-Demand	Mild	ADRB2	21	42
C=CCCCCNC[C@@H](O)c1ccc(C)cc1	ZINC000819237523	BF	On-Demand	Mild	ADRB2	21	42
Cn1cc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c2ccc(F)cc21	ZINC000819237547	FG	On-Demand	Bother	ADRB3	50	39
Cn1cc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c2ccc(F)cc21	ZINC000819237548	FG	On-Demand	Bother	ADRB3	50	39
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)c1ccccc1Cl	ZINC000819237571	EG	On-Demand	Anodyne	OPRL1	39	58
Cc1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237610	FF	On-Demand	Anodyne	ADRB2	40	45
Cc1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237610	FF	On-Demand	Anodyne	ADRB1	46	45
Cc1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237610	FF	On-Demand	Anodyne	ADRB3	34	45
Cc1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237611	FF	On-Demand	Anodyne	ADRB2	40	45
Cc1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237611	FF	On-Demand	Anodyne	ADRB1	46	45
Cc1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237611	FF	On-Demand	Anodyne	ADRB3	34	45
C[C@H](c1cccc(F)c1)N1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819237612	EF	On-Demand	Anodyne	ITGAL	40	32
C[C@H](c1cccc(F)c1)N1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819237613	EF	On-Demand	Anodyne	ITGAL	40	32
C[C@H](c1cccc(F)c1)N1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819237614	EF	On-Demand	Anodyne	ITGAL	40	32
C[C@H](c1cccc(F)c1)N1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819237615	EF	On-Demand	Anodyne	ITGAL	40	32
Cn1cc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c2ccc(F)cc21	ZINC000819237677	GF	On-Demand	Anodyne	ADRB3	77	43
Cn1cc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c2ccc(F)cc21	ZINC000819237678	GF	On-Demand	Anodyne	ADRB3	77	43
N#Cc1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237688	FE	On-Demand	Mild	ADRB2	25	43
N#Cc1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237688	FE	On-Demand	Mild	ADRB1	29	43
N#Cc1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237688	FE	On-Demand	Mild	ADRB3	23	43
N#Cc1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237689	FE	On-Demand	Mild	ADRB2	25	43
N#Cc1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237689	FE	On-Demand	Mild	ADRB1	29	43
N#Cc1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237689	FE	On-Demand	Mild	ADRB3	23	43
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(SC)cc2)C1	ZINC000819237690	FD	On-Demand	Anodyne	ADRB2	35	43
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(SC)cc2)C1	ZINC000819237690	FD	On-Demand	Anodyne	ADRB1	48	43
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(SC)cc2)C1	ZINC000819237690	FD	On-Demand	Anodyne	ADRB3	37	45
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(SC)cc2)C1	ZINC000819237691	FD	On-Demand	Anodyne	ADRB2	35	43
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(SC)cc2)C1	ZINC000819237691	FD	On-Demand	Anodyne	ADRB1	48	43
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(SC)cc2)C1	ZINC000819237691	FD	On-Demand	Anodyne	ADRB3	37	45
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(SC)cc2)C1	ZINC000819237692	FD	On-Demand	Anodyne	ADRB2	35	43
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(SC)cc2)C1	ZINC000819237692	FD	On-Demand	Anodyne	ADRB1	48	43
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(SC)cc2)C1	ZINC000819237692	FD	On-Demand	Anodyne	ADRB3	37	45
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(SC)cc2)C1	ZINC000819237693	FD	On-Demand	Anodyne	ADRB2	35	43
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(SC)cc2)C1	ZINC000819237693	FD	On-Demand	Anodyne	ADRB1	48	43
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(SC)cc2)C1	ZINC000819237693	FD	On-Demand	Anodyne	ADRB3	37	45
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237694	GE	On-Demand	Anodyne	ADRB2	43	48
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237694	GE	On-Demand	Anodyne	ADRB1	76	48
CC(=O)Nc1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237694	GE	On-Demand	Anodyne	ADRB3	62	44
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237695	GE	On-Demand	Anodyne	ADRB2	43	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237695	GE	On-Demand	Anodyne	ADRB1	76	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237695	GE	On-Demand	Anodyne	ADRB3	62	44
O=[N+]([O-])c1cccc([C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)c1	ZINC000819237706	FE	On-Demand	Bother	ADRB3	18	41
O=[N+]([O-])c1cccc([C@H](O)CNC2CCC(O)(c3cccnc3)CC2)c1	ZINC000819237707	FE	On-Demand	Bother	ADRB3	18	41
C=CCCCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819237719	CF	On-Demand	Mild	ADRB3	44	38
C=CCCCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819237720	CF	On-Demand	Mild	ADRB3	44	38
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccccc1F	ZINC000819237725	FE	On-Demand	Anodyne	ADRB2	23	49
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccccc1F	ZINC000819237725	FE	On-Demand	Anodyne	ADRB1	22	41
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccccc1F	ZINC000819237725	FE	On-Demand	Anodyne	ADRB3	21	49
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccccc1F	ZINC000819237726	FE	On-Demand	Anodyne	ADRB2	23	49
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccccc1F	ZINC000819237726	FE	On-Demand	Anodyne	ADRB1	22	41
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccccc1F	ZINC000819237726	FE	On-Demand	Anodyne	ADRB3	21	49
Cn1cc(CCNC[C@@H](O)c2cccnc2)c2ccc(F)cc21	ZINC000819237758	DF	On-Demand	Anodyne	ADRB2	34	47
Cn1cc(CCNC[C@@H](O)c2cccnc2)c2ccc(F)cc21	ZINC000819237758	DF	On-Demand	Anodyne	ADRB1	35	47
Cn1cc(CCNC[C@@H](O)c2cccnc2)c2ccc(F)cc21	ZINC000819237758	DF	On-Demand	Anodyne	ADRB3	120	47
Cn1cc(CCNC[C@H](O)c2cccnc2)c2ccc(F)cc21	ZINC000819237759	DF	On-Demand	Anodyne	ADRB2	34	47
Cn1cc(CCNC[C@H](O)c2cccnc2)c2ccc(F)cc21	ZINC000819237759	DF	On-Demand	Anodyne	ADRB1	35	47
Cn1cc(CCNC[C@H](O)c2cccnc2)c2ccc(F)cc21	ZINC000819237759	DF	On-Demand	Anodyne	ADRB3	120	47
CCOc1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237768	GF	On-Demand	Anodyne	ADRB2	36	43
CCOc1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237768	GF	On-Demand	Anodyne	ADRB1	45	43
CCOc1ccc(OC[C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237768	GF	On-Demand	Anodyne	ADRB3	33	43
CCOc1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237769	GF	On-Demand	Anodyne	ADRB2	36	43
CCOc1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237769	GF	On-Demand	Anodyne	ADRB1	45	43
CCOc1ccc(OC[C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237769	GF	On-Demand	Anodyne	ADRB3	33	43
O=[N+]([O-])c1ccc([C@@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237785	FE	On-Demand	Bother	C3AR1	21	43
O=[N+]([O-])c1ccc([C@H](O)CNC2CCC(O)(c3cccnc3)CC2)cc1	ZINC000819237786	FE	On-Demand	Bother	C3AR1	21	43
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1cccc2ccccc12	ZINC000819237830	GG	On-Demand	Anodyne	ADRB2	29	47
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1cccc2ccccc12	ZINC000819237830	GG	On-Demand	Anodyne	ADRB1	24	47
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1cccc2ccccc12	ZINC000819237830	GG	On-Demand	Anodyne	ADRB3	23	46
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1cccc2ccccc12	ZINC000819237831	GG	On-Demand	Anodyne	ADRB2	29	47
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1cccc2ccccc12	ZINC000819237831	GG	On-Demand	Anodyne	ADRB1	24	47
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1cccc2ccccc12	ZINC000819237831	GG	On-Demand	Anodyne	ADRB3	23	46
Cn1cc(CCNC[C@H](O)c2cccc(F)c2)c2ccc(F)cc21	ZINC000819237840	EG	On-Demand	Anodyne	ADRB1	24	42
Cn1cc(CCNC[C@H](O)c2cccc(F)c2)c2ccc(F)cc21	ZINC000819237840	EG	On-Demand	Anodyne	ADRB3	58	43
Cn1cc(CCNC[C@@H](O)c2cccc(F)c2)c2ccc(F)cc21	ZINC000819237841	EG	On-Demand	Anodyne	ADRB1	24	42
Cn1cc(CCNC[C@@H](O)c2cccc(F)c2)c2ccc(F)cc21	ZINC000819237841	EG	On-Demand	Anodyne	ADRB3	58	43
O=C(/C=C\[C@H]1CCCO1)Nc1n[nH]c2ccc(F)cc12	ZINC000819237857	CE	On-Demand	Anodyne	GSK3A	30	42
O=C(/C=C/[C@H]1CCCO1)Nc1n[nH]c2ccc(F)cc12	ZINC000819237858	CE	On-Demand	Anodyne	GSK3A	30	42
O=C(/C=C\[C@@H]1CCCO1)Nc1n[nH]c2ccc(F)cc12	ZINC000819237859	CE	On-Demand	Anodyne	GSK3A	30	42
O=C(/C=C/[C@@H]1CCCO1)Nc1n[nH]c2ccc(F)cc12	ZINC000819237860	CE	On-Demand	Anodyne	GSK3A	30	42
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)c1cccc(Br)c1	ZINC000819237865	GG	On-Demand	Anodyne	ADRB3	17	42
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)c1cccc(Br)c1	ZINC000819237866	GG	On-Demand	Anodyne	ADRB3	17	42
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(Br)c2)C1	ZINC000819237939	GE	On-Demand	Anodyne	ADRB3	24	40
CCOC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)c(Br)c2)C1	ZINC000819237940	GE	On-Demand	Anodyne	ADRB3	24	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(Br)c2)C1	ZINC000819237941	GE	On-Demand	Anodyne	ADRB3	24	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(Br)c2)C1	ZINC000819237942	GE	On-Demand	Anodyne	ADRB3	24	40
Cn1cc(CCNC[C@H](O)c2ccc(F)cc2)c2ccc(F)cc21	ZINC000819237951	EG	On-Demand	Anodyne	ADRB2	21	43
Cn1cc(CCNC[C@@H](O)c2ccc(F)cc2)c2ccc(F)cc21	ZINC000819237952	EG	On-Demand	Anodyne	ADRB2	21	43
COc1ccc(CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819237953	GH	On-Demand	Mild	PAPA1_CARPA	53	43
COc1ccc(CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819237954	GH	On-Demand	Mild	PAPA1_CARPA	53	43
O[C@H](CNCc1nnnn1CC1CC1)c1cccnc1	ZINC000819237955	CC	On-Demand	Anodyne	ADRB3	76	41
O[C@@H](CNCc1nnnn1CC1CC1)c1cccnc1	ZINC000819237956	CC	On-Demand	Anodyne	ADRB3	76	41
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1CCC(O)(c2cccnc2)CC1	ZINC000819237996	GE	On-Demand	Bother	ADRB2	20	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC1CCC(O)(c2cccnc2)CC1	ZINC000819237996	GE	On-Demand	Bother	ADRB1	18	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1CCC(O)(c2cccnc2)CC1	ZINC000819237997	GE	On-Demand	Bother	ADRB2	20	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC1CCC(O)(c2cccnc2)CC1	ZINC000819237997	GE	On-Demand	Bother	ADRB1	18	40
O=S(=O)(CCNC1CCC(O)(c2cccnc2)CC1)c1ccccc1	ZINC000819238007	FE	On-Demand	Anodyne	TBXAS1	18	40
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccc(F)cc1	ZINC000819238019	FE	On-Demand	Anodyne	ADRB2	32	47
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccc(F)cc1	ZINC000819238019	FE	On-Demand	Anodyne	ADRB1	40	47
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccc(F)cc1	ZINC000819238019	FE	On-Demand	Anodyne	ADRB3	32	47
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccc(F)cc1	ZINC000819238020	FE	On-Demand	Anodyne	ADRB2	32	47
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccc(F)cc1	ZINC000819238020	FE	On-Demand	Anodyne	ADRB1	40	47
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccc(F)cc1	ZINC000819238020	FE	On-Demand	Anodyne	ADRB3	32	47
C=CCCCCNC[C@@H](O)c1cccnc1	ZINC000819238021	BE	On-Demand	Mild	ADRB2	27	48
C=CCCCCNC[C@@H](O)c1cccnc1	ZINC000819238021	BE	On-Demand	Mild	ADRB1	37	46
C=CCCCCNC[C@@H](O)c1cccnc1	ZINC000819238021	BE	On-Demand	Mild	ADRB3	111	48
C=CCCCCNC[C@H](O)c1cccnc1	ZINC000819238022	BE	On-Demand	Mild	ADRB2	27	48
C=CCCCCNC[C@H](O)c1cccnc1	ZINC000819238022	BE	On-Demand	Mild	ADRB1	37	46
C=CCCCCNC[C@H](O)c1cccnc1	ZINC000819238022	BE	On-Demand	Mild	ADRB3	111	48
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccccc1	ZINC000819238023	EE	On-Demand	Anodyne	ADRB2	41	50
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccccc1	ZINC000819238023	EE	On-Demand	Anodyne	ADRB1	56	50
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccccc1	ZINC000819238023	EE	On-Demand	Anodyne	ADRB3	45	50
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccccc1	ZINC000819238024	EE	On-Demand	Anodyne	ADRB2	41	50
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccccc1	ZINC000819238024	EE	On-Demand	Anodyne	ADRB1	56	50
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccccc1	ZINC000819238024	EE	On-Demand	Anodyne	ADRB3	45	50
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1n[nH]c2ccc(F)cc12	ZINC000819238037	EF	On-Demand	Anodyne	GSK3A	28	41
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1cccc2[nH]ccc12	ZINC000819238041	GF	On-Demand	Anodyne	ADRB2	19	68
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1cccc2[nH]ccc12	ZINC000819238041	GF	On-Demand	Anodyne	ADRB1	22	68
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1cccc2[nH]ccc12	ZINC000819238041	GF	On-Demand	Anodyne	ADRB3	20	50
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1cccc2[nH]ccc12	ZINC000819238042	GF	On-Demand	Anodyne	ADRB2	19	68
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1cccc2[nH]ccc12	ZINC000819238042	GF	On-Demand	Anodyne	ADRB1	22	68
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1cccc2[nH]ccc12	ZINC000819238042	GF	On-Demand	Anodyne	ADRB3	20	50
C=CCCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819238069	CG	On-Demand	Mild	ADRB2	48	42
C=CCCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819238069	CG	On-Demand	Mild	ADRB1	56	53
C=CCCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819238069	CG	On-Demand	Mild	ADRB3	67	53
C=CCCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819238070	CG	On-Demand	Mild	ADRB2	48	42
C=CCCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819238070	CG	On-Demand	Mild	ADRB1	56	53
C=CCCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819238070	CG	On-Demand	Mild	ADRB3	67	53
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](c1ccccc1)c1ccncc1)C2	ZINC000819238079	GG	On-Demand	Anodyne	BIRC8	54	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](c1ccccc1)c1ccncc1)C2	ZINC000819238080	GG	On-Demand	Anodyne	BIRC8	54	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](c1ccccc1)c1ccncc1)C2	ZINC000819238082	GG	On-Demand	Anodyne	BIRC8	54	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](c1ccccc1)c1ccncc1)C2	ZINC000819238083	GG	On-Demand	Anodyne	BIRC8	54	31
CCOC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccccc2Cl)C1	ZINC000819238129	FE	On-Demand	Anodyne	ADRB2	15	41
CCOC(=O)N1CC[C@H](NC[C@H](O)COCc2ccccc2Cl)C1	ZINC000819238130	FE	On-Demand	Anodyne	ADRB2	15	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccccc2Cl)C1	ZINC000819238131	FE	On-Demand	Anodyne	ADRB2	15	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccccc2Cl)C1	ZINC000819238132	FE	On-Demand	Anodyne	ADRB2	15	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)Cn2c3ccccc3c3ccccc32)C1	ZINC000819238156	GF	On-Demand	Anodyne	CCR8	88	44
CCOC(=O)N1CC[C@@H](NC[C@@H](O)Cn2c3ccccc3c3ccccc32)C1	ZINC000819238157	GF	On-Demand	Anodyne	CCR8	88	44
CCOC(=O)N1CC[C@H](NC[C@H](O)Cn2c3ccccc3c3ccccc32)C1	ZINC000819238158	GF	On-Demand	Anodyne	CCR8	88	44
CCOC(=O)N1CC[C@@H](NC[C@H](O)Cn2c3ccccc3c3ccccc32)C1	ZINC000819238159	GF	On-Demand	Anodyne	CCR8	88	44
CCOC(=O)N1CC[C@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819238160	FE	On-Demand	Anodyne	ADRB1	19	40
CCOC(=O)N1CC[C@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819238160	FE	On-Demand	Anodyne	ADRB3	33	45
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819238161	FE	On-Demand	Anodyne	ADRB1	19	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819238161	FE	On-Demand	Anodyne	ADRB3	33	45
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819238162	FE	On-Demand	Anodyne	ADRB1	19	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819238162	FE	On-Demand	Anodyne	ADRB3	33	45
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819238163	FE	On-Demand	Anodyne	ADRB1	19	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819238163	FE	On-Demand	Anodyne	ADRB3	33	45
CCOC(=O)N1CC[C@H](NCCC(=O)Nc2cccc(Br)c2)C1	ZINC000819238166	GF	On-Demand	Anodyne	CCR8	44	39
CCOC(=O)N1CC[C@@H](NCCC(=O)Nc2cccc(Br)c2)C1	ZINC000819238167	GF	On-Demand	Anodyne	CCR8	44	39
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238177	FG	On-Demand	Anodyne	RBP4	51	36
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238177	FG	On-Demand	Anodyne	SCD1	15	41
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238177	FG	On-Demand	Anodyne	SFRP1	45	32
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238177	FG	On-Demand	Anodyne	SCD	20	41
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238178	FG	On-Demand	Anodyne	RBP4	51	36
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238178	FG	On-Demand	Anodyne	SCD1	15	41
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238178	FG	On-Demand	Anodyne	SFRP1	45	32
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238178	FG	On-Demand	Anodyne	SCD	20	41
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238179	FG	On-Demand	Anodyne	RBP4	51	36
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238179	FG	On-Demand	Anodyne	SCD1	15	41
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238179	FG	On-Demand	Anodyne	SFRP1	45	32
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238179	FG	On-Demand	Anodyne	SCD	20	41
O=C1[C@H](NC[C@H](O)c2ccccc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238180	FG	On-Demand	Anodyne	RBP4	51	36
O=C1[C@H](NC[C@H](O)c2ccccc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238180	FG	On-Demand	Anodyne	SCD1	15	41
O=C1[C@H](NC[C@H](O)c2ccccc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238180	FG	On-Demand	Anodyne	SFRP1	45	32
O=C1[C@H](NC[C@H](O)c2ccccc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238180	FG	On-Demand	Anodyne	SCD	20	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)C1	ZINC000819238219	GD	On-Demand	Anodyne	ADRB3	29	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)C1	ZINC000819238219	GD	On-Demand	Anodyne	ACOX1	50	34
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)C1	ZINC000819238220	GD	On-Demand	Anodyne	ADRB3	29	40
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)C1	ZINC000819238220	GD	On-Demand	Anodyne	ACOX1	50	34
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)C1	ZINC000819238221	GD	On-Demand	Anodyne	ADRB3	29	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)C1	ZINC000819238221	GD	On-Demand	Anodyne	ACOX1	50	34
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)C1	ZINC000819238222	GD	On-Demand	Anodyne	ADRB3	29	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)C1	ZINC000819238222	GD	On-Demand	Anodyne	ACOX1	50	34
O[C@@H](CNCC1(CCOCc2ccccc2)CC1)c1cccnc1	ZINC000819238244	EG	On-Demand	Anodyne	ADRB2	23	43
O[C@@H](CNCC1(CCOCc2ccccc2)CC1)c1cccnc1	ZINC000819238244	EG	On-Demand	Anodyne	ADRB1	25	49
O[C@@H](CNCC1(CCOCc2ccccc2)CC1)c1cccnc1	ZINC000819238244	EG	On-Demand	Anodyne	ADRB3	89	49
O[C@H](CNCC1(CCOCc2ccccc2)CC1)c1cccnc1	ZINC000819238245	EG	On-Demand	Anodyne	ADRB2	23	43
O[C@H](CNCC1(CCOCc2ccccc2)CC1)c1cccnc1	ZINC000819238245	EG	On-Demand	Anodyne	ADRB1	25	49
O[C@H](CNCC1(CCOCc2ccccc2)CC1)c1cccnc1	ZINC000819238245	EG	On-Demand	Anodyne	ADRB3	89	49
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)c1cccc(C(F)(F)F)c1	ZINC000819238281	GH	On-Demand	Anodyne	ADRB3	15	41
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)c1cccc(C(F)(F)F)c1	ZINC000819238281	GH	On-Demand	Anodyne	CCR2	28	47
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)c1cccc(C(F)(F)F)c1	ZINC000819238282	GH	On-Demand	Anodyne	ADRB3	15	41
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)c1cccc(C(F)(F)F)c1	ZINC000819238282	GH	On-Demand	Anodyne	CCR2	28	47
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccc(Cl)cc1	ZINC000819238283	GF	On-Demand	Anodyne	ADRB2	30	43
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccc(Cl)cc1	ZINC000819238283	GF	On-Demand	Anodyne	ADRB1	40	43
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccc(Cl)cc1	ZINC000819238283	GF	On-Demand	Anodyne	ADRB3	32	43
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccc(Cl)cc1	ZINC000819238285	GF	On-Demand	Anodyne	ADRB2	30	43
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccc(Cl)cc1	ZINC000819238285	GF	On-Demand	Anodyne	ADRB1	40	43
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccc(Cl)cc1	ZINC000819238285	GF	On-Demand	Anodyne	ADRB3	32	43
O[C@@H](CNCC1(CCOCc2ccccc2)CC1)c1cccc(Cl)c1	ZINC000819238286	FI	On-Demand	Anodyne	ADRB2	34	44
O[C@@H](CNCC1(CCOCc2ccccc2)CC1)c1cccc(Cl)c1	ZINC000819238286	FI	On-Demand	Anodyne	ADRB1	47	44
O[C@@H](CNCC1(CCOCc2ccccc2)CC1)c1cccc(Cl)c1	ZINC000819238286	FI	On-Demand	Anodyne	ADRB3	56	44
O[C@H](CNCC1(CCOCc2ccccc2)CC1)c1cccc(Cl)c1	ZINC000819238289	FI	On-Demand	Anodyne	ADRB2	34	44
O[C@H](CNCC1(CCOCc2ccccc2)CC1)c1cccc(Cl)c1	ZINC000819238289	FI	On-Demand	Anodyne	ADRB1	47	44
O[C@H](CNCC1(CCOCc2ccccc2)CC1)c1cccc(Cl)c1	ZINC000819238289	FI	On-Demand	Anodyne	ADRB3	56	44
Cn1nc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c2ccccc21	ZINC000819238293	FG	On-Demand	Anodyne	ADRB2	18	40
Cn1nc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c2ccccc21	ZINC000819238293	FG	On-Demand	Anodyne	ADRB3	17	40
Cn1nc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c2ccccc21	ZINC000819238295	FG	On-Demand	Anodyne	ADRB2	18	40
Cn1nc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c2ccccc21	ZINC000819238295	FG	On-Demand	Anodyne	ADRB3	17	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238297	FD	On-Demand	Anodyne	ADRB2	32	45
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238297	FD	On-Demand	Anodyne	ADRB1	37	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238297	FD	On-Demand	Anodyne	ADRB3	36	44
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238297	FD	On-Demand	Anodyne	ACOX1	51	34
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238297	FD	On-Demand	Anodyne	ABCB1	27	48
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238299	FD	On-Demand	Anodyne	ADRB2	32	45
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238299	FD	On-Demand	Anodyne	ADRB1	37	41
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238299	FD	On-Demand	Anodyne	ADRB3	36	44
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238299	FD	On-Demand	Anodyne	ACOX1	51	34
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238299	FD	On-Demand	Anodyne	ABCB1	27	48
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238301	FD	On-Demand	Anodyne	ADRB2	32	45
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238301	FD	On-Demand	Anodyne	ADRB1	37	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238301	FD	On-Demand	Anodyne	ADRB3	36	44
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238301	FD	On-Demand	Anodyne	ACOX1	51	34
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238301	FD	On-Demand	Anodyne	ABCB1	27	48
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238303	FD	On-Demand	Anodyne	ADRB2	32	45
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238303	FD	On-Demand	Anodyne	ADRB1	37	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238303	FD	On-Demand	Anodyne	ADRB3	36	44
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238303	FD	On-Demand	Anodyne	ACOX1	51	34
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc(C(C)=O)c2)C1	ZINC000819238303	FD	On-Demand	Anodyne	ABCB1	27	48
C#Cc1cccc(N(C)C(=O)c2cc(OC)ccc2OCC(F)(F)C(F)F)c1	ZINC000819238320	GI	On-Demand	Mild	HSD17B2	30	42
CCOC(=O)N1CC[C@H](NCCC(=O)Nc2ccc(Br)cc2)C1	ZINC000819238325	GF	On-Demand	Anodyne	CCR8	52	38
CCOC(=O)N1CC[C@@H](NCCC(=O)Nc2ccc(Br)cc2)C1	ZINC000819238326	GF	On-Demand	Anodyne	CCR8	52	38
O=C(c1ccccc1C(F)(F)F)N1CCC(NCC2(O)CCCCC2)CC1	ZINC000819238331	GH	On-Demand	Anodyne	RBP4	67	43
O=C(c1ccccc1C(F)(F)F)N1CCC(NCC2(O)CCCCC2)CC1	ZINC000819238331	GH	On-Demand	Anodyne	SCD1	22	43
O=C(c1ccccc1C(F)(F)F)N1CCC(NCC2(O)CCCCC2)CC1	ZINC000819238331	GH	On-Demand	Anodyne	SFRP1	117	41
O=C(c1ccccc1C(F)(F)F)N1CCC(NCC2(O)CCCCC2)CC1	ZINC000819238331	GH	On-Demand	Anodyne	SCD	27	42
O=C(c1ccccc1C(F)(F)F)N1CCC(NCC2(O)CCCCC2)CC1	ZINC000819238331	GH	On-Demand	Anodyne	WNT3	79	35
O=C(c1ccccc1C(F)(F)F)N1CCC(NCC2(O)CCCCC2)CC1	ZINC000819238331	GH	On-Demand	Anodyne	HCN1	52	32
O=C(c1ccccc1C(F)(F)F)N1CCC(NCC2(O)CCCCC2)CC1	ZINC000819238331	GH	On-Demand	Anodyne	HCN4	50	32
CCOC(=O)N1CC[C@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238346	GF	On-Demand	Anodyne	ADRB2	20	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238346	GF	On-Demand	Anodyne	ADRB1	16	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238346	GF	On-Demand	Anodyne	CHRM1	18	48
CCOC(=O)N1CC[C@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238346	GF	On-Demand	Anodyne	SLC6A3	34	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238346	GF	On-Demand	Anodyne	P2RY12	47	35
CCOC(=O)N1CC[C@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238346	GF	On-Demand	Anodyne	CCR8	69	43
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238347	GF	On-Demand	Anodyne	ADRB2	20	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238347	GF	On-Demand	Anodyne	ADRB1	16	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238347	GF	On-Demand	Anodyne	CHRM1	18	48
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238347	GF	On-Demand	Anodyne	SLC6A3	34	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238347	GF	On-Demand	Anodyne	P2RY12	47	35
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238347	GF	On-Demand	Anodyne	CCR8	69	43
CCOC(=O)N1CC[C@@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238348	GF	On-Demand	Anodyne	ADRB2	20	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238348	GF	On-Demand	Anodyne	ADRB1	16	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238348	GF	On-Demand	Anodyne	CHRM1	18	48
CCOC(=O)N1CC[C@@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238348	GF	On-Demand	Anodyne	SLC6A3	34	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238348	GF	On-Demand	Anodyne	P2RY12	47	35
CCOC(=O)N1CC[C@@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238348	GF	On-Demand	Anodyne	CCR8	69	43
CCOC(=O)N1CC[C@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238349	GF	On-Demand	Anodyne	ADRB2	20	41
CCOC(=O)N1CC[C@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238349	GF	On-Demand	Anodyne	ADRB1	16	41
CCOC(=O)N1CC[C@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238349	GF	On-Demand	Anodyne	CHRM1	18	48
CCOC(=O)N1CC[C@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238349	GF	On-Demand	Anodyne	SLC6A3	34	40
CCOC(=O)N1CC[C@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238349	GF	On-Demand	Anodyne	P2RY12	47	35
CCOC(=O)N1CC[C@H](NC[C@H](O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819238349	GF	On-Demand	Anodyne	CCR8	69	43
CCOC(=O)N1CC[C@H](NCCS(=O)(=O)CC)C1	ZINC000819238355	CC	On-Demand	Anodyne	CCR8	50	43
CCOC(=O)N1CC[C@@H](NCCS(=O)(=O)CC)C1	ZINC000819238356	CC	On-Demand	Anodyne	CCR8	50	43
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2C(C)C)C1	ZINC000819238357	FE	On-Demand	Anodyne	ADRB2	47	69
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2C(C)C)C1	ZINC000819238357	FE	On-Demand	Anodyne	ADRB1	39	69
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2C(C)C)C1	ZINC000819238357	FE	On-Demand	Anodyne	ADRB3	31	49
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2C(C)C)C1	ZINC000819238357	FE	On-Demand	Anodyne	ABCB1	43	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2C(C)C)C1	ZINC000819238357	FE	On-Demand	Anodyne	CCR8	32	42
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2C(C)C)C1	ZINC000819238358	FE	On-Demand	Anodyne	ADRB2	47	69
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2C(C)C)C1	ZINC000819238358	FE	On-Demand	Anodyne	ADRB1	39	69
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2C(C)C)C1	ZINC000819238358	FE	On-Demand	Anodyne	ADRB3	31	49
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2C(C)C)C1	ZINC000819238358	FE	On-Demand	Anodyne	ABCB1	43	42
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2C(C)C)C1	ZINC000819238358	FE	On-Demand	Anodyne	CCR8	32	42
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2C(C)C)C1	ZINC000819238359	FE	On-Demand	Anodyne	ADRB2	47	69
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2C(C)C)C1	ZINC000819238359	FE	On-Demand	Anodyne	ADRB1	39	69
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2C(C)C)C1	ZINC000819238359	FE	On-Demand	Anodyne	ADRB3	31	49
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2C(C)C)C1	ZINC000819238359	FE	On-Demand	Anodyne	ABCB1	43	42
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2C(C)C)C1	ZINC000819238359	FE	On-Demand	Anodyne	CCR8	32	42
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2C(C)C)C1	ZINC000819238360	FE	On-Demand	Anodyne	ADRB2	47	69
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2C(C)C)C1	ZINC000819238360	FE	On-Demand	Anodyne	ADRB1	39	69
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2C(C)C)C1	ZINC000819238360	FE	On-Demand	Anodyne	ADRB3	31	49
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2C(C)C)C1	ZINC000819238360	FE	On-Demand	Anodyne	ABCB1	43	42
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2C(C)C)C1	ZINC000819238360	FE	On-Demand	Anodyne	CCR8	32	42
Cn1nc(CCNC[C@@H](O)c2ccccc2)c2ccccc21	ZINC000819238384	CE	On-Demand	Anodyne	ADRB2	32	46
Cn1nc(CCNC[C@@H](O)c2ccccc2)c2ccccc21	ZINC000819238384	CE	On-Demand	Anodyne	ADRB1	33	41
Cn1nc(CCNC[C@@H](O)c2ccccc2)c2ccccc21	ZINC000819238384	CE	On-Demand	Anodyne	ADRB3	73	42
Cn1nc(CCNC[C@H](O)c2ccccc2)c2ccccc21	ZINC000819238385	CE	On-Demand	Anodyne	ADRB2	32	46
Cn1nc(CCNC[C@H](O)c2ccccc2)c2ccccc21	ZINC000819238385	CE	On-Demand	Anodyne	ADRB1	33	41
Cn1nc(CCNC[C@H](O)c2ccccc2)c2ccccc21	ZINC000819238385	CE	On-Demand	Anodyne	ADRB3	73	42
O=C(Nc1nc2ccccc2n1CCCn1ccnc1)C(F)=C1CCC1	ZINC000819238388	FH	On-Demand	Anodyne	HMOX2	46	36
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238391	FE	On-Demand	Anodyne	ADRB2	46	49
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238391	FE	On-Demand	Anodyne	ADRB1	56	45
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238391	FE	On-Demand	Anodyne	P2RY12	82	36
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238391	FE	On-Demand	Anodyne	ADRB3	45	44
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238391	FE	On-Demand	Anodyne	ACOX1	61	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238391	FE	On-Demand	Anodyne	CCR8	36	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238392	FE	On-Demand	Anodyne	ADRB2	46	49
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238392	FE	On-Demand	Anodyne	ADRB1	56	45
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238392	FE	On-Demand	Anodyne	P2RY12	82	36
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238392	FE	On-Demand	Anodyne	ADRB3	45	44
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238392	FE	On-Demand	Anodyne	ACOX1	61	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238392	FE	On-Demand	Anodyne	CCR8	36	41
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238393	FE	On-Demand	Anodyne	ADRB2	46	49
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238393	FE	On-Demand	Anodyne	ADRB1	56	45
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238393	FE	On-Demand	Anodyne	P2RY12	82	36
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238393	FE	On-Demand	Anodyne	ADRB3	45	44
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238393	FE	On-Demand	Anodyne	ACOX1	61	41
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238393	FE	On-Demand	Anodyne	CCR8	36	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238394	FE	On-Demand	Anodyne	ADRB2	46	49
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238394	FE	On-Demand	Anodyne	ADRB1	56	45
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238394	FE	On-Demand	Anodyne	P2RY12	82	36
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238394	FE	On-Demand	Anodyne	ADRB3	45	44
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238394	FE	On-Demand	Anodyne	ACOX1	61	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819238394	FE	On-Demand	Anodyne	CCR8	36	41
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccc2ccccc2c1	ZINC000819238406	GG	On-Demand	Anodyne	ADRB2	29	46
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccc2ccccc2c1	ZINC000819238406	GG	On-Demand	Anodyne	ADRB1	28	42
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccc2ccccc2c1	ZINC000819238406	GG	On-Demand	Anodyne	ADRB3	27	42
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccc2ccccc2c1	ZINC000819238407	GG	On-Demand	Anodyne	ADRB2	29	46
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccc2ccccc2c1	ZINC000819238407	GG	On-Demand	Anodyne	ADRB1	28	42
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccc2ccccc2c1	ZINC000819238407	GG	On-Demand	Anodyne	ADRB3	27	42
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccccc1Cl	ZINC000819238425	GF	On-Demand	Anodyne	ADRB2	24	43
O[C@@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccccc1Cl	ZINC000819238425	GF	On-Demand	Anodyne	ADRB1	18	43
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccccc1Cl	ZINC000819238426	GF	On-Demand	Anodyne	ADRB2	24	43
O[C@H](CNC1CCC(O)(c2cccnc2)CC1)COc1ccccc1Cl	ZINC000819238426	GF	On-Demand	Anodyne	ADRB1	18	43
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000819238450	FD	On-Demand	Anodyne	ADRB2	39	46
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000819238450	FD	On-Demand	Anodyne	ADRB1	35	46
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000819238450	FD	On-Demand	Anodyne	ADRB3	32	44
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000819238450	FD	On-Demand	Anodyne	CCR8	39	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000819238451	FD	On-Demand	Anodyne	ADRB2	39	46
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000819238451	FD	On-Demand	Anodyne	ADRB1	35	46
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000819238451	FD	On-Demand	Anodyne	ADRB3	32	44
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2c(OC)cccc2OC)C1	ZINC000819238451	FD	On-Demand	Anodyne	CCR8	39	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000819238452	FD	On-Demand	Anodyne	ADRB2	39	46
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000819238452	FD	On-Demand	Anodyne	ADRB1	35	46
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000819238452	FD	On-Demand	Anodyne	ADRB3	32	44
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000819238452	FD	On-Demand	Anodyne	CCR8	39	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000819238453	FD	On-Demand	Anodyne	ADRB2	39	46
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000819238453	FD	On-Demand	Anodyne	ADRB1	35	46
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000819238453	FD	On-Demand	Anodyne	ADRB3	32	44
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2c(OC)cccc2OC)C1	ZINC000819238453	FD	On-Demand	Anodyne	CCR8	39	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819238459	GF	On-Demand	Anodyne	ADRB2	28	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819238459	GF	On-Demand	Anodyne	ADRB1	26	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819238459	GF	On-Demand	Anodyne	CCR8	48	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819238460	GF	On-Demand	Anodyne	ADRB2	28	42
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819238460	GF	On-Demand	Anodyne	ADRB1	26	42
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819238460	GF	On-Demand	Anodyne	CCR8	48	41
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819238461	GF	On-Demand	Anodyne	ADRB2	28	42
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819238461	GF	On-Demand	Anodyne	ADRB1	26	42
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819238461	GF	On-Demand	Anodyne	CCR8	48	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819238462	GF	On-Demand	Anodyne	ADRB2	28	42
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819238462	GF	On-Demand	Anodyne	ADRB1	26	42
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819238462	GF	On-Demand	Anodyne	CCR8	48	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819238469	GF	On-Demand	Anodyne	ADRB2	22	42
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819238469	GF	On-Demand	Anodyne	ADRB1	23	42
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819238469	GF	On-Demand	Anodyne	CCR1	44	38
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819238470	GF	On-Demand	Anodyne	ADRB2	22	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819238470	GF	On-Demand	Anodyne	ADRB1	23	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819238470	GF	On-Demand	Anodyne	CCR1	44	38
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819238471	GF	On-Demand	Anodyne	ADRB2	22	42
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819238471	GF	On-Demand	Anodyne	ADRB1	23	42
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819238471	GF	On-Demand	Anodyne	CCR1	44	38
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819238472	GF	On-Demand	Anodyne	ADRB2	22	42
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819238472	GF	On-Demand	Anodyne	ADRB1	23	42
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000819238472	GF	On-Demand	Anodyne	CCR1	44	38
Cn1nc(CCNC[C@H](O)c2cccnc2)c2ccccc21	ZINC000819238475	CD	On-Demand	Anodyne	ADRB2	40	46
Cn1nc(CCNC[C@H](O)c2cccnc2)c2ccccc21	ZINC000819238475	CD	On-Demand	Anodyne	ADRB1	35	46
Cn1nc(CCNC[C@H](O)c2cccnc2)c2ccccc21	ZINC000819238475	CD	On-Demand	Anodyne	ADRB3	117	49
Cn1nc(CCNC[C@@H](O)c2cccnc2)c2ccccc21	ZINC000819238476	CD	On-Demand	Anodyne	ADRB2	40	46
Cn1nc(CCNC[C@@H](O)c2cccnc2)c2ccccc21	ZINC000819238476	CD	On-Demand	Anodyne	ADRB1	35	46
Cn1nc(CCNC[C@@H](O)c2cccnc2)c2ccccc21	ZINC000819238476	CD	On-Demand	Anodyne	ADRB3	117	49
C#CCNC(=O)CN1CCN(C(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819238479	GB	On-Demand	Mild	DRD4	47	36
C#CCNC(=O)CN1CCN(C(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819238480	GB	On-Demand	Mild	DRD4	47	36
O=C1[C@@H](NC[C@@H](O)C2CC2)CCN1c1ccccc1C(F)(F)F	ZINC000819238487	EE	On-Demand	Anodyne	RBP4	49	34
O=C1[C@@H](NC[C@H](O)C2CC2)CCN1c1ccccc1C(F)(F)F	ZINC000819238488	EE	On-Demand	Anodyne	RBP4	49	34
O=C1[C@H](NC[C@H](O)C2CC2)CCN1c1ccccc1C(F)(F)F	ZINC000819238489	EE	On-Demand	Anodyne	RBP4	49	34
O=C1[C@H](NC[C@@H](O)C2CC2)CCN1c1ccccc1C(F)(F)F	ZINC000819238490	EE	On-Demand	Anodyne	RBP4	49	34
CCOC(=O)N1CC[C@@H](NC[C@H](O)Cn2c(-c3ccccc3)noc2=O)C1	ZINC000819238491	GC	On-Demand	Anodyne	P2RY12	95	37
CCOC(=O)N1CC[C@H](NC[C@H](O)Cn2c(-c3ccccc3)noc2=O)C1	ZINC000819238492	GC	On-Demand	Anodyne	P2RY12	95	37
CCOC(=O)N1CC[C@@H](NC[C@@H](O)Cn2c(-c3ccccc3)noc2=O)C1	ZINC000819238493	GC	On-Demand	Anodyne	P2RY12	95	37
CCOC(=O)N1CC[C@H](NC[C@@H](O)Cn2c(-c3ccccc3)noc2=O)C1	ZINC000819238494	GC	On-Demand	Anodyne	P2RY12	95	37
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819238498	FE	On-Demand	Anodyne	ADRB2	50	58
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819238498	FE	On-Demand	Anodyne	ADRB1	44	50
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819238498	FE	On-Demand	Anodyne	P2RY12	45	34
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819238498	FE	On-Demand	Anodyne	ADRB3	35	49
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819238498	FE	On-Demand	Anodyne	ACOX1	40	35
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819238498	FE	On-Demand	Anodyne	ABCB1	55	42
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819238498	FE	On-Demand	Anodyne	CCR8	79	46
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819238499	FE	On-Demand	Anodyne	ADRB2	50	58
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819238499	FE	On-Demand	Anodyne	ADRB1	44	50
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819238499	FE	On-Demand	Anodyne	P2RY12	45	34
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819238499	FE	On-Demand	Anodyne	ADRB3	35	49
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819238499	FE	On-Demand	Anodyne	ACOX1	40	35
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819238499	FE	On-Demand	Anodyne	ABCB1	55	42
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819238499	FE	On-Demand	Anodyne	CCR8	79	46
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819238500	FE	On-Demand	Anodyne	ADRB2	50	58
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819238500	FE	On-Demand	Anodyne	ADRB1	44	50
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819238500	FE	On-Demand	Anodyne	P2RY12	45	34
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819238500	FE	On-Demand	Anodyne	ADRB3	35	49
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819238500	FE	On-Demand	Anodyne	ACOX1	40	35
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819238500	FE	On-Demand	Anodyne	ABCB1	55	42
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819238500	FE	On-Demand	Anodyne	CCR8	79	46
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819238501	FE	On-Demand	Anodyne	ADRB2	50	58
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819238501	FE	On-Demand	Anodyne	ADRB1	44	50
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819238501	FE	On-Demand	Anodyne	P2RY12	45	34
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819238501	FE	On-Demand	Anodyne	ADRB3	35	49
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819238501	FE	On-Demand	Anodyne	ACOX1	40	35
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819238501	FE	On-Demand	Anodyne	ABCB1	55	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819238501	FE	On-Demand	Anodyne	CCR8	79	46
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819238519	GG	On-Demand	Anodyne	ADRB3	65	48
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819238519	GG	On-Demand	Anodyne	C3AR1	41	39
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819238519	GG	On-Demand	Anodyne	RBP4	62	50
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819238519	GG	On-Demand	Anodyne	SCD1	38	49
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819238519	GG	On-Demand	Anodyne	SFRP1	116	44
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819238519	GG	On-Demand	Anodyne	SCD	47	49
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819238519	GG	On-Demand	Anodyne	WNT3	80	35
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819238520	GG	On-Demand	Anodyne	ADRB3	65	48
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819238520	GG	On-Demand	Anodyne	C3AR1	41	39
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819238520	GG	On-Demand	Anodyne	RBP4	62	50
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819238520	GG	On-Demand	Anodyne	SCD1	38	49
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819238520	GG	On-Demand	Anodyne	SFRP1	116	44
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819238520	GG	On-Demand	Anodyne	SCD	47	49
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819238520	GG	On-Demand	Anodyne	WNT3	80	35
CCOC(=O)N1CC[C@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000819238521	GF	On-Demand	Anodyne	CCR8	66	42
CCOC(=O)N1CC[C@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000819238521	GF	On-Demand	Anodyne	CYNT	35	42
CCOC(=O)N1CC[C@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000819238521	GF	On-Demand	Anodyne	SFRP1	84	35
CCOC(=O)N1CC[C@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000819238521	GF	On-Demand	Anodyne	WNT3	62	35
CCOC(=O)N1CC[C@@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000819238522	GF	On-Demand	Anodyne	CCR8	66	42
CCOC(=O)N1CC[C@@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000819238522	GF	On-Demand	Anodyne	CYNT	35	42
CCOC(=O)N1CC[C@@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000819238522	GF	On-Demand	Anodyne	SFRP1	84	35
CCOC(=O)N1CC[C@@H](NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000819238522	GF	On-Demand	Anodyne	WNT3	62	35
CCOC(=O)N1CC[C@@H](NCCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000819238528	FD	On-Demand	Bother	CCR8	77	41
CCOC(=O)N1CC[C@H](NCCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000819238529	FD	On-Demand	Bother	CCR8	77	41
CCOC(=O)N1CC[C@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819238548	FF	On-Demand	Anodyne	NPY2R	23	43
CCOC(=O)N1CC[C@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819238548	FF	On-Demand	Anodyne	CACNA1B	41	33
CCOC(=O)N1CC[C@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819238548	FF	On-Demand	Anodyne	CCR2	82	42
CCOC(=O)N1CC[C@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819238548	FF	On-Demand	Anodyne	EPHX2	33	55
CCOC(=O)N1CC[C@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819238548	FF	On-Demand	Anodyne	SFRP1	43	32
CCOC(=O)N1CC[C@@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819238549	FF	On-Demand	Anodyne	NPY2R	23	43
CCOC(=O)N1CC[C@@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819238549	FF	On-Demand	Anodyne	CACNA1B	41	33
CCOC(=O)N1CC[C@@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819238549	FF	On-Demand	Anodyne	CCR2	82	42
CCOC(=O)N1CC[C@@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819238549	FF	On-Demand	Anodyne	EPHX2	33	55
CCOC(=O)N1CC[C@@H](NCCC(=O)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819238549	FF	On-Demand	Anodyne	SFRP1	43	32
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819238569	FD	On-Demand	Bother	ADRB2	32	48
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819238569	FD	On-Demand	Bother	ADRB1	27	48
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819238569	FD	On-Demand	Bother	ADRB3	26	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819238569	FD	On-Demand	Bother	ABCB1	28	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819238570	FD	On-Demand	Bother	ADRB2	32	48
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819238570	FD	On-Demand	Bother	ADRB1	27	48
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819238570	FD	On-Demand	Bother	ADRB3	26	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819238570	FD	On-Demand	Bother	ABCB1	28	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819238571	FD	On-Demand	Bother	ADRB2	32	48
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819238571	FD	On-Demand	Bother	ADRB1	27	48
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819238571	FD	On-Demand	Bother	ADRB3	26	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819238571	FD	On-Demand	Bother	ABCB1	28	40
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819238572	FD	On-Demand	Bother	ADRB2	32	48
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819238572	FD	On-Demand	Bother	ADRB1	27	48
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819238572	FD	On-Demand	Bother	ADRB3	26	40
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819238572	FD	On-Demand	Bother	ABCB1	28	40
CON(C)C(=O)CCNC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819238588	GE	On-Demand	Anodyne	RBP4	57	40
CON(C)C(=O)CCNC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819238588	GE	On-Demand	Anodyne	SCD1	24	42
CON(C)C(=O)CCNC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819238588	GE	On-Demand	Anodyne	SFRP1	121	41
CON(C)C(=O)CCNC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819238588	GE	On-Demand	Anodyne	SCD	28	42
CON(C)C(=O)CCNC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819238588	GE	On-Demand	Anodyne	WNT3	82	39
C#CCNC(=O)CN1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819238602	FB	On-Demand	Mild	KCNJ1	65	45
CCOC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819238603	FE	On-Demand	Anodyne	CCR2	40	38
CCOC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819238603	FE	On-Demand	Anodyne	EPHX2	20	42
CCOC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819238603	FE	On-Demand	Anodyne	MCHR1	28	44
CCOC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819238604	FE	On-Demand	Anodyne	CCR2	40	38
CCOC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819238604	FE	On-Demand	Anodyne	EPHX2	20	42
CCOC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819238604	FE	On-Demand	Anodyne	MCHR1	28	44
CCOC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819238605	FE	On-Demand	Anodyne	CCR2	40	38
CCOC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819238605	FE	On-Demand	Anodyne	EPHX2	20	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819238605	FE	On-Demand	Anodyne	MCHR1	28	44
CCOC(=O)N1CC[C@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819238606	FE	On-Demand	Anodyne	CCR2	40	38
CCOC(=O)N1CC[C@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819238606	FE	On-Demand	Anodyne	EPHX2	20	42
CCOC(=O)N1CC[C@H](NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819238606	FE	On-Demand	Anodyne	MCHR1	28	44
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238629	GE	On-Demand	Anodyne	ADRB2	39	49
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238629	GE	On-Demand	Anodyne	ADRB1	35	49
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238629	GE	On-Demand	Anodyne	ABCB1	46	43
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238629	GE	On-Demand	Anodyne	RBP4	82	35
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238629	GE	On-Demand	Anodyne	CCR8	30	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238629	GE	On-Demand	Anodyne	SFRP1	115	36
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238629	GE	On-Demand	Anodyne	SCD	31	42
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238629	GE	On-Demand	Anodyne	WNT3	78	36
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238630	GE	On-Demand	Anodyne	ADRB2	39	49
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238630	GE	On-Demand	Anodyne	ADRB1	35	49
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238630	GE	On-Demand	Anodyne	ABCB1	46	43
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238630	GE	On-Demand	Anodyne	RBP4	82	35
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238630	GE	On-Demand	Anodyne	CCR8	30	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238630	GE	On-Demand	Anodyne	SFRP1	115	36
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238630	GE	On-Demand	Anodyne	SCD	31	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238630	GE	On-Demand	Anodyne	WNT3	78	36
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238631	GE	On-Demand	Anodyne	ADRB2	39	49
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238631	GE	On-Demand	Anodyne	ADRB1	35	49
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238631	GE	On-Demand	Anodyne	ABCB1	46	43
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238631	GE	On-Demand	Anodyne	RBP4	82	35
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238631	GE	On-Demand	Anodyne	CCR8	30	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238631	GE	On-Demand	Anodyne	SFRP1	115	36
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238631	GE	On-Demand	Anodyne	SCD	31	42
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238631	GE	On-Demand	Anodyne	WNT3	78	36
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238632	GE	On-Demand	Anodyne	ADRB2	39	49
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238632	GE	On-Demand	Anodyne	ADRB1	35	49
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238632	GE	On-Demand	Anodyne	ABCB1	46	43
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238632	GE	On-Demand	Anodyne	RBP4	82	35
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238632	GE	On-Demand	Anodyne	CCR8	30	40
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238632	GE	On-Demand	Anodyne	SFRP1	115	36
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238632	GE	On-Demand	Anodyne	SCD	31	42
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819238632	GE	On-Demand	Anodyne	WNT3	78	36
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cc(C)ccc2Cl)C1	ZINC000819238633	FE	On-Demand	Anodyne	ADRB2	24	42
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cc(C)ccc2Cl)C1	ZINC000819238633	FE	On-Demand	Anodyne	ADRB1	19	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cc(C)ccc2Cl)C1	ZINC000819238634	FE	On-Demand	Anodyne	ADRB2	24	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cc(C)ccc2Cl)C1	ZINC000819238634	FE	On-Demand	Anodyne	ADRB1	19	42
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cc(C)ccc2Cl)C1	ZINC000819238635	FE	On-Demand	Anodyne	ADRB2	24	42
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cc(C)ccc2Cl)C1	ZINC000819238635	FE	On-Demand	Anodyne	ADRB1	19	42
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cc(C)ccc2Cl)C1	ZINC000819238636	FE	On-Demand	Anodyne	ADRB2	24	42
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cc(C)ccc2Cl)C1	ZINC000819238636	FE	On-Demand	Anodyne	ADRB1	19	42
C=C(C)C(C)(C)C(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000819238646	DI	On-Demand	Mild	LTA4H	20	43
C=C(C)C(C)(C)C(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000819238646	DI	On-Demand	Mild	CHRNA7	21	41
C=C(C)C(C)(C)C(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000819238646	DI	On-Demand	Mild	S1PR4	23	40
C=C(C)C(C)(C)C(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000819238646	DI	On-Demand	Mild	NAMPT	44	45
O[C@H](CNOC1CCOCC1)COc1ccccc1Cl	ZINC000819238654	DD	On-Demand	Anodyne	ADRB2	26	47
O[C@@H](CNOC1CCOCC1)COc1ccccc1Cl	ZINC000819238655	DD	On-Demand	Anodyne	ADRB2	26	47
COC(=O)CN1CCN(c2ccc(NC(=O)C[C@H](C)n3cccn3)cc2)CC1	ZINC000819238673	GD	On-Demand	Anodyne	PRNP	46	38
COC(=O)CN1CCN(c2ccc(NC(=O)C[C@@H](C)n3cccn3)cc2)CC1	ZINC000819238674	GD	On-Demand	Anodyne	PRNP	46	38
O[C@H](CNOC1CCOCC1)COc1cc(Cl)ccc1Cl	ZINC000819238681	EE	On-Demand	Anodyne	MAPK1	53	32
O[C@@H](CNOC1CCOCC1)COc1cc(Cl)ccc1Cl	ZINC000819238682	EE	On-Demand	Anodyne	MAPK1	53	32
O[C@@H](CNOC1CCOCC1)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819238687	GG	On-Demand	Anodyne	SLC6A3	40	39
O[C@H](CNOC1CCOCC1)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819238688	GG	On-Demand	Anodyne	SLC6A3	40	39
O=C(CCNOC1CCOCC1)Nc1ccc(Oc2ccccc2)cc1	ZINC000819238715	FH	On-Demand	Anodyne	LTA4H	60	49
O=C(CCNOC1CCOCC1)Nc1ccc(Oc2ccccc2)cc1	ZINC000819238715	FH	On-Demand	Anodyne	F13A1	22	42
CSc1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819238731	DD	On-Demand	Anodyne	ADRB2	25	41
CSc1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819238731	DD	On-Demand	Anodyne	ADRB1	38	44
CSc1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819238732	DD	On-Demand	Anodyne	ADRB2	25	41
CSc1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819238732	DD	On-Demand	Anodyne	ADRB1	38	44
CC(=O)CCc1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819238733	ED	On-Demand	Anodyne	ADRB2	39	47
CC(=O)CCc1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819238733	ED	On-Demand	Anodyne	ADRB1	70	50
CC(=O)CCc1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819238733	ED	On-Demand	Anodyne	ADRB3	45	43
CC(=O)CCc1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819238734	ED	On-Demand	Anodyne	ADRB2	39	47
CC(=O)CCc1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819238734	ED	On-Demand	Anodyne	ADRB1	70	50
CC(=O)CCc1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819238734	ED	On-Demand	Anodyne	ADRB3	45	43
O[C@@H](CNOC1CCOCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819238737	EE	On-Demand	Anodyne	ADRB1	31	40
O[C@@H](CNOC1CCOCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819238737	EE	On-Demand	Anodyne	HRH1	15	42
O[C@@H](CNOC1CCOCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819238737	EE	On-Demand	Anodyne	GRIN1	24	40
O[C@@H](CNOC1CCOCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819238737	EE	On-Demand	Anodyne	CCR3	16	44
O[C@@H](CNOC1CCOCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819238737	EE	On-Demand	Anodyne	MAPK1	46	33
O[C@H](CNOC1CCOCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819238738	EE	On-Demand	Anodyne	ADRB1	31	40
O[C@H](CNOC1CCOCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819238738	EE	On-Demand	Anodyne	HRH1	15	42
O[C@H](CNOC1CCOCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819238738	EE	On-Demand	Anodyne	GRIN1	24	40
O[C@H](CNOC1CCOCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819238738	EE	On-Demand	Anodyne	CCR3	16	44
O[C@H](CNOC1CCOCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819238738	EE	On-Demand	Anodyne	MAPK1	46	33
O[C@@H](CNOC1CCOCC1)COc1cccc2ccccc12	ZINC000819238742	DE	On-Demand	Anodyne	ADRB2	31	57
O[C@@H](CNOC1CCOCC1)COc1cccc2ccccc12	ZINC000819238742	DE	On-Demand	Anodyne	ADRB1	34	57
O[C@@H](CNOC1CCOCC1)COc1cccc2ccccc12	ZINC000819238742	DE	On-Demand	Anodyne	ABCB1	19	40
O[C@H](CNOC1CCOCC1)COc1cccc2ccccc12	ZINC000819238743	DE	On-Demand	Anodyne	ADRB2	31	57
O[C@H](CNOC1CCOCC1)COc1cccc2ccccc12	ZINC000819238743	DE	On-Demand	Anodyne	ADRB1	34	57
O[C@H](CNOC1CCOCC1)COc1cccc2ccccc12	ZINC000819238743	DE	On-Demand	Anodyne	ABCB1	19	40
NC(=O)CCNC(=O)c1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819238753	DD	On-Demand	Anodyne	KCNK3	68	34
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238764	FF	On-Demand	Anodyne	ADRB3	50	42
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238764	FF	On-Demand	Anodyne	SCD1	16	40
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238764	FF	On-Demand	Anodyne	SCD	23	40
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238765	FF	On-Demand	Anodyne	ADRB3	50	42
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238765	FF	On-Demand	Anodyne	SCD1	16	40
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238765	FF	On-Demand	Anodyne	SCD	23	40
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238766	FF	On-Demand	Anodyne	ADRB3	50	42
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238766	FF	On-Demand	Anodyne	SCD1	16	40
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238766	FF	On-Demand	Anodyne	SCD	23	40
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238767	FF	On-Demand	Anodyne	ADRB3	50	42
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238767	FF	On-Demand	Anodyne	SCD1	16	40
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1ccccc1C(F)(F)F	ZINC000819238767	FF	On-Demand	Anodyne	SCD	23	40
C[C@@H](CC(=O)NNC(=O)c1cccc(OC(F)F)c1)n1cccn1	ZINC000819238778	ED	On-Demand	Reactive	DRD4	40	31
C[C@H](CC(=O)NNC(=O)c1cccc(OC(F)F)c1)n1cccn1	ZINC000819238779	ED	On-Demand	Reactive	DRD4	40	31
CCOC(=O)N1CC[C@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819238780	FD	On-Demand	Mild	ITGA4	43	31
CCOC(=O)N1CC[C@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819238780	FD	On-Demand	Mild	SFRP1	40	37
CCOC(=O)N1CC[C@@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819238781	FD	On-Demand	Mild	ITGA4	43	31
CCOC(=O)N1CC[C@@H](NCCS(=O)(=O)c2cccc(C#N)c2)C1	ZINC000819238781	FD	On-Demand	Mild	SFRP1	40	37
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(OCC)cc2)C1	ZINC000819238786	FD	On-Demand	Anodyne	ADRB2	45	46
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(OCC)cc2)C1	ZINC000819238786	FD	On-Demand	Anodyne	ADRB1	61	46
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(OCC)cc2)C1	ZINC000819238786	FD	On-Demand	Anodyne	ADRB3	45	48
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(OCC)cc2)C1	ZINC000819238786	FD	On-Demand	Anodyne	ACOX1	49	32
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(OCC)cc2)C1	ZINC000819238787	FD	On-Demand	Anodyne	ADRB2	45	46
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(OCC)cc2)C1	ZINC000819238787	FD	On-Demand	Anodyne	ADRB1	61	46
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(OCC)cc2)C1	ZINC000819238787	FD	On-Demand	Anodyne	ADRB3	45	48
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(OCC)cc2)C1	ZINC000819238787	FD	On-Demand	Anodyne	ACOX1	49	32
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(OCC)cc2)C1	ZINC000819238788	FD	On-Demand	Anodyne	ADRB2	45	46
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(OCC)cc2)C1	ZINC000819238788	FD	On-Demand	Anodyne	ADRB1	61	46
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(OCC)cc2)C1	ZINC000819238788	FD	On-Demand	Anodyne	ADRB3	45	48
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(OCC)cc2)C1	ZINC000819238788	FD	On-Demand	Anodyne	ACOX1	49	32
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(OCC)cc2)C1	ZINC000819238789	FD	On-Demand	Anodyne	ADRB2	45	46
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(OCC)cc2)C1	ZINC000819238789	FD	On-Demand	Anodyne	ADRB1	61	46
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(OCC)cc2)C1	ZINC000819238789	FD	On-Demand	Anodyne	ADRB3	45	48
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(OCC)cc2)C1	ZINC000819238789	FD	On-Demand	Anodyne	ACOX1	49	32
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819238790	FD	On-Demand	Anodyne	ADRB2	47	52
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819238790	FD	On-Demand	Anodyne	ADRB1	78	52
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819238790	FD	On-Demand	Anodyne	ADRB3	57	46
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819238790	FD	On-Demand	Anodyne	ACOX1	50	36
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819238791	FD	On-Demand	Anodyne	ADRB2	47	52
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819238791	FD	On-Demand	Anodyne	ADRB1	78	52
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819238791	FD	On-Demand	Anodyne	ADRB3	57	46
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819238791	FD	On-Demand	Anodyne	ACOX1	50	36
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819238792	FD	On-Demand	Anodyne	ADRB2	47	52
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819238792	FD	On-Demand	Anodyne	ADRB1	78	52
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819238792	FD	On-Demand	Anodyne	ADRB3	57	46
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819238792	FD	On-Demand	Anodyne	ACOX1	50	36
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819238793	FD	On-Demand	Anodyne	ADRB2	47	52
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819238793	FD	On-Demand	Anodyne	ADRB1	78	52
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819238793	FD	On-Demand	Anodyne	ADRB3	57	46
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(NC(C)=O)cc2)C1	ZINC000819238793	FD	On-Demand	Anodyne	ACOX1	50	36
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819238796	GE	On-Demand	Anodyne	ADRB2	32	46
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819238796	GE	On-Demand	Anodyne	ADRB1	35	41
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819238796	GE	On-Demand	Anodyne	ADRB3	34	41
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819238796	GE	On-Demand	Anodyne	ACOX1	50	33
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819238796	GE	On-Demand	Anodyne	PDS	37	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819238797	GE	On-Demand	Anodyne	ADRB2	32	46
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819238797	GE	On-Demand	Anodyne	ADRB1	35	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819238797	GE	On-Demand	Anodyne	ADRB3	34	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819238797	GE	On-Demand	Anodyne	ACOX1	50	33
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819238797	GE	On-Demand	Anodyne	PDS	37	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819238798	GE	On-Demand	Anodyne	ADRB2	32	46
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819238798	GE	On-Demand	Anodyne	ADRB1	35	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819238798	GE	On-Demand	Anodyne	ADRB3	34	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819238798	GE	On-Demand	Anodyne	ACOX1	50	33
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819238798	GE	On-Demand	Anodyne	PDS	37	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819238799	GE	On-Demand	Anodyne	ADRB2	32	46
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819238799	GE	On-Demand	Anodyne	ADRB1	35	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819238799	GE	On-Demand	Anodyne	ADRB3	34	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819238799	GE	On-Demand	Anodyne	ACOX1	50	33
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819238799	GE	On-Demand	Anodyne	PDS	37	40
CCOC(=O)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819238806	DE	On-Demand	Anodyne	ADRB1	16	47
CCOC(=O)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819238806	DE	On-Demand	Anodyne	SLC6A3	28	40
CCOC(=O)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819238806	DE	On-Demand	Anodyne	ADRB3	27	47
CCOC(=O)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819238806	DE	On-Demand	Anodyne	EPHX2	15	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819238807	DE	On-Demand	Anodyne	ADRB1	16	47
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819238807	DE	On-Demand	Anodyne	SLC6A3	28	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819238807	DE	On-Demand	Anodyne	ADRB3	27	47
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819238807	DE	On-Demand	Anodyne	EPHX2	15	41
C/C=C\c1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OCC)C2)c(OC)c1	ZINC000819238808	GE	On-Demand	Anodyne	ADRB2	17	55
C/C=C\c1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OCC)C2)c(OC)c1	ZINC000819238808	GE	On-Demand	Anodyne	ADRB3	17	42
C/C=C/c1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OCC)C2)c(OC)c1	ZINC000819238809	GE	On-Demand	Anodyne	ADRB2	17	55
C/C=C/c1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OCC)C2)c(OC)c1	ZINC000819238809	GE	On-Demand	Anodyne	ADRB3	17	42
C/C=C\c1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OCC)C2)c(OC)c1	ZINC000819238810	GE	On-Demand	Anodyne	ADRB2	17	55
C/C=C\c1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OCC)C2)c(OC)c1	ZINC000819238810	GE	On-Demand	Anodyne	ADRB3	17	42
C/C=C/c1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OCC)C2)c(OC)c1	ZINC000819238811	GE	On-Demand	Anodyne	ADRB2	17	55
C/C=C/c1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OCC)C2)c(OC)c1	ZINC000819238811	GE	On-Demand	Anodyne	ADRB3	17	42
C=CCc1ccc(OC[C@@H](O)CNOC2CCOCC2)c(OC)c1	ZINC000819238812	ED	On-Demand	Mild	ADRB1	18	42
C=CCc1ccc(OC[C@H](O)CNOC2CCOCC2)c(OC)c1	ZINC000819238814	ED	On-Demand	Mild	ADRB1	18	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](c1ccccc1)c1cccnc1)C2	ZINC000819238818	GG	On-Demand	Anodyne	BIRC8	43	30
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](c1ccccc1)c1cccnc1)C2	ZINC000819238820	GG	On-Demand	Anodyne	BIRC8	43	30
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](c1ccccc1)c1cccnc1)C2	ZINC000819238821	GG	On-Demand	Anodyne	BIRC8	43	30
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](c1ccccc1)c1cccnc1)C2	ZINC000819238823	GG	On-Demand	Anodyne	BIRC8	43	30
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000819238826	FI	On-Demand	Anodyne	ACE2	15	41
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000819238830	FI	On-Demand	Anodyne	ACE2	15	41
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000819238832	FI	On-Demand	Anodyne	ACE2	15	41
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000819238833	FI	On-Demand	Anodyne	ACE2	15	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819238839	FE	On-Demand	Anodyne	RBP4	61	35
CCOC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819238839	FE	On-Demand	Anodyne	SFRP1	118	36
CCOC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819238839	FE	On-Demand	Anodyne	WNT3	81	36
CCOC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819238841	FE	On-Demand	Anodyne	RBP4	61	35
CCOC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819238841	FE	On-Demand	Anodyne	SFRP1	118	36
CCOC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819238841	FE	On-Demand	Anodyne	WNT3	81	36
CCOC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819238843	FE	On-Demand	Anodyne	RBP4	61	35
CCOC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819238843	FE	On-Demand	Anodyne	SFRP1	118	36
CCOC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819238843	FE	On-Demand	Anodyne	WNT3	81	36
CCOC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819238845	FE	On-Demand	Anodyne	RBP4	61	35
CCOC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819238845	FE	On-Demand	Anodyne	SFRP1	118	36
CCOC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000819238845	FE	On-Demand	Anodyne	WNT3	81	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cnn(CCN3CCOCC3)c1)C2	ZINC000819238847	GD	On-Demand	Anodyne	PANC	45	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cnn(CCN3CCOCC3)c1)C2	ZINC000819238850	GD	On-Demand	Anodyne	PANC	45	32
O[C@@H](CNOC1CCOCC1)COc1ccc2ccccc2c1	ZINC000819238854	DE	On-Demand	Anodyne	ADRB2	36	57
O[C@@H](CNOC1CCOCC1)COc1ccc2ccccc2c1	ZINC000819238854	DE	On-Demand	Anodyne	ADRB1	40	39
O[C@H](CNOC1CCOCC1)COc1ccc2ccccc2c1	ZINC000819238856	DE	On-Demand	Anodyne	ADRB2	36	57
O[C@H](CNOC1CCOCC1)COc1ccc2ccccc2c1	ZINC000819238856	DE	On-Demand	Anodyne	ADRB1	40	39
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2c(C)ccc(C)c2C)C1	ZINC000819238867	FE	On-Demand	Anodyne	ADRB2	22	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2c(C)ccc(C)c2C)C1	ZINC000819238867	FE	On-Demand	Anodyne	ADRB1	20	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2c(C)ccc(C)c2C)C1	ZINC000819238867	FE	On-Demand	Anodyne	CCR8	35	42
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2c(C)ccc(C)c2C)C1	ZINC000819238869	FE	On-Demand	Anodyne	ADRB2	22	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2c(C)ccc(C)c2C)C1	ZINC000819238869	FE	On-Demand	Anodyne	ADRB1	20	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2c(C)ccc(C)c2C)C1	ZINC000819238869	FE	On-Demand	Anodyne	CCR8	35	42
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2c(C)ccc(C)c2C)C1	ZINC000819238871	FE	On-Demand	Anodyne	ADRB2	22	41
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2c(C)ccc(C)c2C)C1	ZINC000819238871	FE	On-Demand	Anodyne	ADRB1	20	41
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2c(C)ccc(C)c2C)C1	ZINC000819238871	FE	On-Demand	Anodyne	CCR8	35	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2c(C)ccc(C)c2C)C1	ZINC000819238873	FE	On-Demand	Anodyne	ADRB2	22	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2c(C)ccc(C)c2C)C1	ZINC000819238873	FE	On-Demand	Anodyne	ADRB1	20	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2c(C)ccc(C)c2C)C1	ZINC000819238873	FE	On-Demand	Anodyne	CCR8	35	42
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819238875	GE	On-Demand	Anodyne	ADRB2	39	44
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819238875	GE	On-Demand	Anodyne	ADRB1	51	44
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819238875	GE	On-Demand	Anodyne	ADRB3	38	46
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819238875	GE	On-Demand	Anodyne	ACOX1	43	31
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819238876	GE	On-Demand	Anodyne	ADRB2	39	44
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819238876	GE	On-Demand	Anodyne	ADRB1	51	44
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819238876	GE	On-Demand	Anodyne	ADRB3	38	46
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819238876	GE	On-Demand	Anodyne	ACOX1	43	31
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819238877	GE	On-Demand	Anodyne	ADRB2	39	44
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819238877	GE	On-Demand	Anodyne	ADRB1	51	44
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819238877	GE	On-Demand	Anodyne	ADRB3	38	46
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819238877	GE	On-Demand	Anodyne	ACOX1	43	31
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819238878	GE	On-Demand	Anodyne	ADRB2	39	44
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819238878	GE	On-Demand	Anodyne	ADRB1	51	44
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819238878	GE	On-Demand	Anodyne	ADRB3	38	46
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819238878	GE	On-Demand	Anodyne	ACOX1	43	31
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819238879	FC	On-Demand	Anodyne	ADRB3	27	45
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819238879	FC	On-Demand	Anodyne	CCR5	23	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819238879	FC	On-Demand	Anodyne	CCR8	44	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819238879	FC	On-Demand	Anodyne	GPR119	62	44
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819238882	FC	On-Demand	Anodyne	ADRB3	27	45
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819238882	FC	On-Demand	Anodyne	CCR5	23	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819238882	FC	On-Demand	Anodyne	CCR8	44	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819238882	FC	On-Demand	Anodyne	GPR119	62	44
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819238884	FC	On-Demand	Anodyne	ADRB3	27	45
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819238884	FC	On-Demand	Anodyne	CCR5	23	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819238884	FC	On-Demand	Anodyne	CCR8	44	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819238884	FC	On-Demand	Anodyne	GPR119	62	44
O[C@H](CNOC1CCOCC1)c1ccc(OC(F)(F)F)cc1	ZINC000819238893	DE	On-Demand	Anodyne	CTSS	16	42
O[C@@H](CNOC1CCOCC1)c1ccc(OC(F)(F)F)cc1	ZINC000819238894	DE	On-Demand	Anodyne	CTSS	16	42
O[C@H](CNOC1CCOCC1)COc1cccc(C(F)(F)F)c1	ZINC000819238895	EE	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CNOC1CCOCC1)COc1cccc(C(F)(F)F)c1	ZINC000819238895	EE	On-Demand	Anodyne	ADRB1	24	42
O[C@H](CNOC1CCOCC1)COc1cccc(C(F)(F)F)c1	ZINC000819238895	EE	On-Demand	Anodyne	PDS	45	39
O[C@@H](CNOC1CCOCC1)COc1cccc(C(F)(F)F)c1	ZINC000819238896	EE	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CNOC1CCOCC1)COc1cccc(C(F)(F)F)c1	ZINC000819238896	EE	On-Demand	Anodyne	ADRB1	24	42
O[C@@H](CNOC1CCOCC1)COc1cccc(C(F)(F)F)c1	ZINC000819238896	EE	On-Demand	Anodyne	PDS	45	39
O[C@H](CNOC1CCOCC1)COc1ccc(-c2ccccc2)cc1	ZINC000819238897	EF	On-Demand	Anodyne	ADRB2	45	45
O[C@H](CNOC1CCOCC1)COc1ccc(-c2ccccc2)cc1	ZINC000819238897	EF	On-Demand	Anodyne	ADRB1	60	42
O[C@@H](CNOC1CCOCC1)COc1ccc(-c2ccccc2)cc1	ZINC000819238898	EF	On-Demand	Anodyne	ADRB2	45	45
O[C@@H](CNOC1CCOCC1)COc1ccc(-c2ccccc2)cc1	ZINC000819238898	EF	On-Demand	Anodyne	ADRB1	60	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCOCC1	ZINC000819238914	GE	On-Demand	Anodyne	CTSD	124	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCOCC1	ZINC000819238914	GE	On-Demand	Anodyne	PGC	77	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCOCC1	ZINC000819238914	GE	On-Demand	Anodyne	PAPA1_CARPA	32	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCOCC1	ZINC000819238914	GE	On-Demand	Anodyne	CTSL	18	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCOCC1	ZINC000819238914	GE	On-Demand	Anodyne	BACE2	53	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCOCC1	ZINC000819238914	GE	On-Demand	Anodyne	TACR3	15	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCOCC1	ZINC000819238914	GE	On-Demand	Anodyne	REN	117	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCOCC1	ZINC000819238914	GE	On-Demand	Anodyne	REN1	26	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCOCC1	ZINC000819238914	GE	On-Demand	Anodyne	CTSE	44	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCOCC1	ZINC000819238914	GE	On-Demand	Anodyne	BACE1	79	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCOCC1	ZINC000819238914	GE	On-Demand	Anodyne	PGA5	51	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCOCC1	ZINC000819238914	GE	On-Demand	Anodyne	CYP3A5	21	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCOCC1	ZINC000819238914	GE	On-Demand	Anodyne	FPR1	51	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCOCC1	ZINC000819238914	GE	On-Demand	Anodyne	PLM1_PLAFA	29	42
O=[N+]([O-])c1ccccc1OC[C@H](O)CNOC1CCOCC1	ZINC000819238932	DD	On-Demand	Bother	ADRB2	20	41
O=[N+]([O-])c1ccccc1OC[C@H](O)CNOC1CCOCC1	ZINC000819238932	DD	On-Demand	Bother	ADRB1	42	33
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNOC1CCOCC1	ZINC000819238933	DD	On-Demand	Bother	ADRB2	20	41
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNOC1CCOCC1	ZINC000819238933	DD	On-Demand	Bother	ADRB1	42	33
COc1cccc([S@@](=O)CC(=O)NCCCNC(=O)OC(C)(C)C)c1	ZINC000819238940	FD	On-Demand	Anodyne	DRD4	40	31
COc1cccc([S@@](=O)CC(=O)NCCCNC(=O)OC(C)(C)C)c1	ZINC000819238940	FD	On-Demand	Anodyne	MTNR1A	47	45
COc1cccc([S@@](=O)CC(=O)NCCCNC(=O)OC(C)(C)C)c1	ZINC000819238940	FD	On-Demand	Anodyne	MTNR1B	45	45
CCOC(=O)N1CC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819238947	FC	On-Demand	Anodyne	ADRB3	27	45
CCOC(=O)N1CC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819238947	FC	On-Demand	Anodyne	CCR5	23	41
CCOC(=O)N1CC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819238947	FC	On-Demand	Anodyne	CCR8	44	40
CCOC(=O)N1CC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819238947	FC	On-Demand	Anodyne	GPR119	62	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cnn(CCN2CCOCC2)c1	ZINC000819238957	GD	On-Demand	Anodyne	PANC	53	35
CCOC(=O)N1CC[C@H](NC[C@@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238969	ED	On-Demand	Anodyne	CHRM1	17	49
CCOC(=O)N1CC[C@H](NC[C@@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238969	ED	On-Demand	Anodyne	P2RY12	48	35
CCOC(=O)N1CC[C@H](NC[C@@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238969	ED	On-Demand	Anodyne	TGM2	22	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238969	ED	On-Demand	Anodyne	F13A1	21	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238969	ED	On-Demand	Anodyne	CCR8	44	44
C[S@@](=O)c1cccc(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819238971	CD	On-Demand	Anodyne	PREP	29	41
C[S@@](=O)c1cccc(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819238971	CD	On-Demand	Anodyne	L3MBTL3	80	45
CCOC(=O)N1CC[C@@H](NC[C@@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238972	ED	On-Demand	Anodyne	CHRM1	17	49
CCOC(=O)N1CC[C@@H](NC[C@@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238972	ED	On-Demand	Anodyne	P2RY12	48	35
CCOC(=O)N1CC[C@@H](NC[C@@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238972	ED	On-Demand	Anodyne	TGM2	22	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238972	ED	On-Demand	Anodyne	F13A1	21	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238972	ED	On-Demand	Anodyne	CCR8	44	44
CCOC(=O)N1CC[C@H](NC[C@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238975	ED	On-Demand	Anodyne	CHRM1	17	49
CCOC(=O)N1CC[C@H](NC[C@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238975	ED	On-Demand	Anodyne	P2RY12	48	35
CCOC(=O)N1CC[C@H](NC[C@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238975	ED	On-Demand	Anodyne	TGM2	22	41
CCOC(=O)N1CC[C@H](NC[C@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238975	ED	On-Demand	Anodyne	F13A1	21	41
CCOC(=O)N1CC[C@H](NC[C@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238975	ED	On-Demand	Anodyne	CCR8	44	44
CCOC(=O)N1CC[C@@H](NC[C@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238977	ED	On-Demand	Anodyne	CHRM1	17	49
CCOC(=O)N1CC[C@@H](NC[C@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238977	ED	On-Demand	Anodyne	P2RY12	48	35
CCOC(=O)N1CC[C@@H](NC[C@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238977	ED	On-Demand	Anodyne	TGM2	22	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238977	ED	On-Demand	Anodyne	F13A1	21	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)CN(C)Cc2ccccc2)C1	ZINC000819238977	ED	On-Demand	Anodyne	CCR8	44	44
C[S@@](=O)c1cccc(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819238978	CD	On-Demand	Anodyne	PREP	29	41
C[S@@](=O)c1cccc(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819238978	CD	On-Demand	Anodyne	L3MBTL3	80	45
C[S@](=O)c1cccc(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819238981	CD	On-Demand	Anodyne	PREP	29	41
C[S@](=O)c1cccc(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819238981	CD	On-Demand	Anodyne	L3MBTL3	80	45
C[S@](=O)c1cccc(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819238982	CD	On-Demand	Anodyne	PREP	29	41
C[S@](=O)c1cccc(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819238982	CD	On-Demand	Anodyne	L3MBTL3	80	45
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819238995	FD	On-Demand	Anodyne	ADRB2	37	48
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819238995	FD	On-Demand	Anodyne	ADRB1	49	43
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819238995	FD	On-Demand	Anodyne	ADRB3	37	46
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819238995	FD	On-Demand	Anodyne	ACOX1	43	30
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819238995	FD	On-Demand	Anodyne	ABCB1	15	47
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819238999	FD	On-Demand	Anodyne	ADRB2	37	48
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819238999	FD	On-Demand	Anodyne	ADRB1	49	43
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819238999	FD	On-Demand	Anodyne	ADRB3	37	46
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819238999	FD	On-Demand	Anodyne	ACOX1	43	30
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819238999	FD	On-Demand	Anodyne	ABCB1	15	47
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819239001	FD	On-Demand	Anodyne	ADRB2	37	48
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819239001	FD	On-Demand	Anodyne	ADRB1	49	43
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819239001	FD	On-Demand	Anodyne	ADRB3	37	46
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819239001	FD	On-Demand	Anodyne	ACOX1	43	30
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819239001	FD	On-Demand	Anodyne	ABCB1	15	47
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819239004	FD	On-Demand	Anodyne	ADRB2	37	48
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819239004	FD	On-Demand	Anodyne	ADRB1	49	43
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819239004	FD	On-Demand	Anodyne	ADRB3	37	46
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819239004	FD	On-Demand	Anodyne	ACOX1	43	30
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(C(C)=O)cc2)C1	ZINC000819239004	FD	On-Demand	Anodyne	ABCB1	15	47
CN(C)c1noc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000819239012	FD	On-Demand	Anodyne	GPR119	31	42
CN(C)c1noc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000819239015	FD	On-Demand	Anodyne	GPR119	31	42
Cc1ccc(C(=O)N2CCC[C@@H](CO)CC2)nc1	ZINC000819239028	BD	On-Demand	Anodyne	L3MBTL3	48	46
Cc1ccc(C(=O)N2CCC[C@H](CO)CC2)nc1	ZINC000819239031	BD	On-Demand	Anodyne	L3MBTL3	48	46
O=C(Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)N1CCC[C@@H](CO)CC1	ZINC000819239034	GH	On-Demand	Anodyne	ETHR	59	35
O=C(Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)N1CCC[C@H](CO)CC1	ZINC000819239036	GH	On-Demand	Anodyne	ETHR	59	35
CCOC(=O)N1CC[C@@H](NC[C@@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819239054	FC	On-Demand	Anodyne	CCR8	64	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819239055	FC	On-Demand	Anodyne	CCR8	64	42
CCOC(=O)N1CC[C@H](NC[C@@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819239056	FC	On-Demand	Anodyne	CCR8	64	42
CCOC(=O)N1CC[C@H](NC[C@H](O)CN2C(=O)c3ccccc3C2=O)C1	ZINC000819239057	FC	On-Demand	Anodyne	CCR8	64	42
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819239070	DD	On-Demand	Anodyne	ADRB3	27	41
CCOC(=O)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819239071	DD	On-Demand	Anodyne	ADRB3	27	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819239073	DD	On-Demand	Anodyne	ADRB3	27	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819239076	DD	On-Demand	Anodyne	ADRB3	27	41
O[C@H](CNOC1CCOCC1)COc1ccccc1	ZINC000819239084	CD	On-Demand	Anodyne	ADRB2	48	52
O[C@H](CNOC1CCOCC1)COc1ccccc1	ZINC000819239084	CD	On-Demand	Anodyne	ADRB1	64	43
O[C@H](CNOC1CCOCC1)COc1ccccc1	ZINC000819239084	CD	On-Demand	Anodyne	ADRB3	42	41
O[C@@H](CNOC1CCOCC1)COc1ccccc1	ZINC000819239087	CD	On-Demand	Anodyne	ADRB2	48	52
O[C@@H](CNOC1CCOCC1)COc1ccccc1	ZINC000819239087	CD	On-Demand	Anodyne	ADRB1	64	43
O[C@@H](CNOC1CCOCC1)COc1ccccc1	ZINC000819239087	CD	On-Demand	Anodyne	ADRB3	42	41
O=[N+]([O-])c1ccc([C@H](O)CNOC2CCOCC2)cc1	ZINC000819239094	CD	On-Demand	Bother	SLC27A4	49	33
O=[N+]([O-])c1ccc([C@@H](O)CNOC2CCOCC2)cc1	ZINC000819239096	CD	On-Demand	Bother	SLC27A4	49	33
CN(C)c1noc(CNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819239113	CD	On-Demand	Anodyne	ADRB1	26	41
CN(C)c1noc(CNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819239113	CD	On-Demand	Anodyne	ADRB3	43	44
CN(C)c1noc(CNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819239114	CD	On-Demand	Anodyne	ADRB1	26	41
CN(C)c1noc(CNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819239114	CD	On-Demand	Anodyne	ADRB3	43	44
Cc1ccc(OC[C@@H](O)CNOC2CCOCC2)c(C)c1	ZINC000819239117	CD	On-Demand	Anodyne	ADRB2	20	48
Cc1ccc(OC[C@H](O)CNOC2CCOCC2)c(C)c1	ZINC000819239119	CD	On-Demand	Anodyne	ADRB2	20	48
CCOC(=O)N1CC[C@@H](NCCC(=O)Nc2ccccc2F)C1	ZINC000819239122	DD	On-Demand	Anodyne	CCR8	92	44
CCOC(=O)N1CC[C@H](NCCC(=O)Nc2ccccc2F)C1	ZINC000819239125	DD	On-Demand	Anodyne	CCR8	92	44
C#Cc1cccc(N(CC)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819239128	FH	On-Demand	Mild	PAPA1_CARPA	38	40
C#Cc1cccc(N(CC)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819239135	FH	On-Demand	Mild	PAPA1_CARPA	38	40
COc1cccc(OC)c1OC[C@H](O)CNOC1CCOCC1	ZINC000819239152	ED	On-Demand	Anodyne	ADRB2	27	40
COc1cccc(OC)c1OC[C@H](O)CNOC1CCOCC1	ZINC000819239152	ED	On-Demand	Anodyne	ADRB1	30	40
C#CCNC(=O)CCNC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819239153	GE	On-Demand	Mild	P2RX7	43	37
C#CCNC(=O)CCNC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819239153	GE	On-Demand	Mild	RBP4	67	41
C#CCNC(=O)CCNC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819239153	GE	On-Demand	Mild	SCD1	29	46
C#CCNC(=O)CCNC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819239153	GE	On-Demand	Mild	SFRP1	122	41
C#CCNC(=O)CCNC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819239153	GE	On-Demand	Mild	SCD	31	46
C#CCNC(=O)CCNC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819239153	GE	On-Demand	Mild	WNT3	82	36
COc1cccc(OC)c1OC[C@@H](O)CNOC1CCOCC1	ZINC000819239159	ED	On-Demand	Anodyne	ADRB2	27	40
COc1cccc(OC)c1OC[C@@H](O)CNOC1CCOCC1	ZINC000819239159	ED	On-Demand	Anodyne	ADRB1	30	40
O=C(CCNOC1CCOCC1)Nc1ccccc1	ZINC000819239162	CD	On-Demand	Anodyne	HDAC8	16	45
O=C(CCNOC1CCOCC1)Nc1ccccc1	ZINC000819239162	CD	On-Demand	Anodyne	HDAC10	36	45
O=C(CCNOC1CCOCC1)Nc1ccccc1	ZINC000819239162	CD	On-Demand	Anodyne	HDAC2	24	45
O=C(CCNOC1CCOCC1)Nc1ccccc1	ZINC000819239162	CD	On-Demand	Anodyne	HDAC3	23	45
O=C(CCNOC1CCOCC1)Nc1ccccc1	ZINC000819239162	CD	On-Demand	Anodyne	HDAC6	27	45
O=C(CCNOC1CCOCC1)Nc1ccccc1	ZINC000819239162	CD	On-Demand	Anodyne	HDAC11	29	45
Cc1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819239171	CD	On-Demand	Anodyne	ADRB2	34	56
Cc1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819239171	CD	On-Demand	Anodyne	ADRB1	44	46
Cc1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819239173	CD	On-Demand	Anodyne	ADRB2	34	56
Cc1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819239173	CD	On-Demand	Anodyne	ADRB1	44	46
O=C(CCNOC1CCOCC1)Nc1cccc(Cl)c1	ZINC000819239176	CE	On-Demand	Anodyne	EPHX2	16	53
CCCCCCCCCCC(=O)N1CCC[C@H](CO)CC1	ZINC000819239180	CI	On-Demand	Mild	CQSS	51	33
CCCCCCCCCCC(=O)N1CCC[C@@H](CO)CC1	ZINC000819239182	CI	On-Demand	Mild	CQSS	51	33
O[C@H](CNOC1CCOCC1)c1ccc(F)cc1	ZINC000819239192	CD	On-Demand	Anodyne	SLC6A3	15	46
O[C@@H](CNOC1CCOCC1)c1ccc(F)cc1	ZINC000819239194	CD	On-Demand	Anodyne	SLC6A3	15	46
CC(C)(C)OC(=O)N1CCC[C@@H]1CCC(=O)N1CCC[C@@H](CO)CC1	ZINC000819239215	FF	On-Demand	Anodyne	PREP	16	46
CC(C)(C)OC(=O)N1CCC[C@@H]1CCC(=O)N1CCC[C@H](CO)CC1	ZINC000819239216	FF	On-Demand	Anodyne	PREP	16	46
C/C(=C/C(=O)N1CCC[C@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819239221	EH	On-Demand	Anodyne	SLC6A1	18	40
C/C(=C/C(=O)N1CCC[C@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819239221	EH	On-Demand	Anodyne	RBP4	77	41
C/C(=C/C(=O)N1CCC[C@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819239221	EH	On-Demand	Anodyne	SFRP1	83	34
C/C(=C/C(=O)N1CCC[C@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819239221	EH	On-Demand	Anodyne	WNT3	63	34
C/C(=C/C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819239224	EH	On-Demand	Anodyne	SLC6A1	18	40
C/C(=C/C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819239224	EH	On-Demand	Anodyne	RBP4	77	41
C/C(=C/C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819239224	EH	On-Demand	Anodyne	SFRP1	83	34
C/C(=C/C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1C(F)(F)F	ZINC000819239224	EH	On-Demand	Anodyne	WNT3	63	34
O=C(c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819239232	HF	On-Demand	Anodyne	CCR8	73	33
O=C(c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819239232	HF	On-Demand	Anodyne	SFRP1	118	44
O=C(c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819239232	HF	On-Demand	Anodyne	WNT3	79	36
O=C(c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl)N1CCC[C@H](CO)CC1	ZINC000819239233	HF	On-Demand	Anodyne	CCR8	73	33
O=C(c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl)N1CCC[C@H](CO)CC1	ZINC000819239233	HF	On-Demand	Anodyne	SFRP1	118	44
O=C(c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl)N1CCC[C@H](CO)CC1	ZINC000819239233	HF	On-Demand	Anodyne	WNT3	79	36
C/C(=C/C(=O)N1CCC[C@@H](CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000819239240	EH	On-Demand	Anodyne	ITGAL	41	33
C/C(=C/C(=O)N1CCC[C@@H](CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000819239240	EH	On-Demand	Anodyne	CACNA1B	56	37
C/C(=C/C(=O)N1CCC[C@@H](CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000819239240	EH	On-Demand	Anodyne	CCR2	81	41
C/C(=C/C(=O)N1CCC[C@@H](CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000819239240	EH	On-Demand	Anodyne	SFRP1	51	32
C/C(=C/C(=O)N1CCC[C@@H](CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000819239240	EH	On-Demand	Anodyne	WNT3	40	32
C/C(=C/C(=O)N1CCC[C@H](CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000819239241	EH	On-Demand	Anodyne	ITGAL	41	33
C/C(=C/C(=O)N1CCC[C@H](CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000819239241	EH	On-Demand	Anodyne	CACNA1B	56	37
C/C(=C/C(=O)N1CCC[C@H](CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000819239241	EH	On-Demand	Anodyne	CCR2	81	41
C/C(=C/C(=O)N1CCC[C@H](CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000819239241	EH	On-Demand	Anodyne	SFRP1	51	32
C/C(=C/C(=O)N1CCC[C@H](CO)CC1)c1cccc(C(F)(F)F)c1	ZINC000819239241	EH	On-Demand	Anodyne	WNT3	40	32
O=[N+]([O-])c1cccc([C@H](O)CNOC2CCOCC2)c1	ZINC000819239287	CD	On-Demand	Bother	CACNA1C	44	35
O=[N+]([O-])c1cccc([C@H](O)CNOC2CCOCC2)c1	ZINC000819239287	CD	On-Demand	Bother	CACNA1D	66	34
O=[N+]([O-])c1cccc([C@@H](O)CNOC2CCOCC2)c1	ZINC000819239289	CD	On-Demand	Bother	CACNA1C	44	35
O=[N+]([O-])c1cccc([C@@H](O)CNOC2CCOCC2)c1	ZINC000819239289	CD	On-Demand	Bother	CACNA1D	66	34
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239309	FD	On-Demand	Bother	ADRB2	28	43
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239309	FD	On-Demand	Bother	ADRB1	27	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239309	FD	On-Demand	Bother	CACNA1C	58	37
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239309	FD	On-Demand	Bother	ADRB3	30	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239309	FD	On-Demand	Bother	ACOX1	41	32
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239309	FD	On-Demand	Bother	CACNA1D	91	36
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239310	FD	On-Demand	Bother	ADRB2	28	43
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239310	FD	On-Demand	Bother	ADRB1	27	40
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239310	FD	On-Demand	Bother	CACNA1C	58	37
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239310	FD	On-Demand	Bother	ADRB3	30	40
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239310	FD	On-Demand	Bother	ACOX1	41	32
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239310	FD	On-Demand	Bother	CACNA1D	91	36
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239312	FD	On-Demand	Bother	ADRB2	28	43
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239312	FD	On-Demand	Bother	ADRB1	27	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239312	FD	On-Demand	Bother	CACNA1C	58	37
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239312	FD	On-Demand	Bother	ADRB3	30	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239312	FD	On-Demand	Bother	ACOX1	41	32
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239312	FD	On-Demand	Bother	CACNA1D	91	36
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239314	FD	On-Demand	Bother	ADRB2	28	43
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239314	FD	On-Demand	Bother	ADRB1	27	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239314	FD	On-Demand	Bother	CACNA1C	58	37
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239314	FD	On-Demand	Bother	ADRB3	30	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239314	FD	On-Demand	Bother	ACOX1	41	32
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819239314	FD	On-Demand	Bother	CACNA1D	91	36
CCOC(=O)N1CC[C@H](NC[C@@](C)(O)c2ccc(Br)cc2F)C1	ZINC000819239327	GF	On-Demand	Anodyne	CCR8	53	37
CCOC(=O)N1CC[C@H](NC[C@@](C)(O)c2ccc(Br)cc2F)C1	ZINC000819239327	GF	On-Demand	Anodyne	SFRP1	62	33
CCOC(=O)N1CC[C@H](NC[C@@](C)(O)c2ccc(Br)cc2F)C1	ZINC000819239327	GF	On-Demand	Anodyne	WNT3	46	33
CCOC(=O)N1CC[C@H](NC[C@](C)(O)c2ccc(Br)cc2F)C1	ZINC000819239329	GF	On-Demand	Anodyne	CCR8	53	37
CCOC(=O)N1CC[C@H](NC[C@](C)(O)c2ccc(Br)cc2F)C1	ZINC000819239329	GF	On-Demand	Anodyne	SFRP1	62	33
CCOC(=O)N1CC[C@H](NC[C@](C)(O)c2ccc(Br)cc2F)C1	ZINC000819239329	GF	On-Demand	Anodyne	WNT3	46	33
CCOC(=O)N1CC[C@@H](NC[C@@](C)(O)c2ccc(Br)cc2F)C1	ZINC000819239330	GF	On-Demand	Anodyne	CCR8	53	37
CCOC(=O)N1CC[C@@H](NC[C@@](C)(O)c2ccc(Br)cc2F)C1	ZINC000819239330	GF	On-Demand	Anodyne	SFRP1	62	33
CCOC(=O)N1CC[C@@H](NC[C@@](C)(O)c2ccc(Br)cc2F)C1	ZINC000819239330	GF	On-Demand	Anodyne	WNT3	46	33
CCOC(=O)N1CC[C@@H](NC[C@](C)(O)c2ccc(Br)cc2F)C1	ZINC000819239331	GF	On-Demand	Anodyne	CCR8	53	37
CCOC(=O)N1CC[C@@H](NC[C@](C)(O)c2ccc(Br)cc2F)C1	ZINC000819239331	GF	On-Demand	Anodyne	SFRP1	62	33
CCOC(=O)N1CC[C@@H](NC[C@](C)(O)c2ccc(Br)cc2F)C1	ZINC000819239331	GF	On-Demand	Anodyne	WNT3	46	33
O=[N+]([O-])c1cccc(OC[C@H](O)CNOC2CCOCC2)c1	ZINC000819239349	DD	On-Demand	Bother	ADRB1	24	42
O=[N+]([O-])c1cccc(OC[C@H](O)CNOC2CCOCC2)c1	ZINC000819239349	DD	On-Demand	Bother	CACNA1D	40	32
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOC2CCOCC2)c1	ZINC000819239351	DD	On-Demand	Bother	ADRB1	24	42
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOC2CCOCC2)c1	ZINC000819239351	DD	On-Demand	Bother	CACNA1D	40	32
CCOC(=O)N1CC[C@@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819239362	FD	On-Demand	Bother	SLC27A4	43	32
CCOC(=O)N1CC[C@H](NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819239364	FD	On-Demand	Bother	SLC27A4	43	32
O[C@H](CNOC1CCOCC1)COc1ccc(Cl)cc1	ZINC000819239370	DD	On-Demand	Anodyne	ADRB2	23	41
O[C@H](CNOC1CCOCC1)COc1ccc(Cl)cc1	ZINC000819239370	DD	On-Demand	Anodyne	ADRB1	39	44
O[C@@H](CNOC1CCOCC1)COc1ccc(Cl)cc1	ZINC000819239372	DD	On-Demand	Anodyne	ADRB2	23	41
O[C@@H](CNOC1CCOCC1)COc1ccc(Cl)cc1	ZINC000819239372	DD	On-Demand	Anodyne	ADRB1	39	44
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819239382	FE	On-Demand	Anodyne	P2RY12	41	35
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819239382	FE	On-Demand	Anodyne	CCR8	50	41
CCOC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819239384	FE	On-Demand	Anodyne	P2RY12	41	35
CCOC(=O)N1CC[C@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819239384	FE	On-Demand	Anodyne	CCR8	50	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819239386	FE	On-Demand	Anodyne	P2RY12	41	35
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819239386	FE	On-Demand	Anodyne	CCR8	50	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819239388	FE	On-Demand	Anodyne	P2RY12	41	35
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819239388	FE	On-Demand	Anodyne	CCR8	50	41
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239390	GE	On-Demand	Anodyne	ADRB2	29	44
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239390	GE	On-Demand	Anodyne	ADRB1	30	41
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239390	GE	On-Demand	Anodyne	ADRB3	32	40
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239390	GE	On-Demand	Anodyne	ACOX1	57	32
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239390	GE	On-Demand	Anodyne	CACNA1B	41	33
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239390	GE	On-Demand	Anodyne	CCR2	98	40
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239390	GE	On-Demand	Anodyne	PDS	55	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239392	GE	On-Demand	Anodyne	ADRB2	29	44
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239392	GE	On-Demand	Anodyne	ADRB1	30	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239392	GE	On-Demand	Anodyne	ADRB3	32	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239392	GE	On-Demand	Anodyne	ACOX1	57	32
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239392	GE	On-Demand	Anodyne	CACNA1B	41	33
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239392	GE	On-Demand	Anodyne	CCR2	98	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239392	GE	On-Demand	Anodyne	PDS	55	42
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239394	GE	On-Demand	Anodyne	ADRB2	29	44
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239394	GE	On-Demand	Anodyne	ADRB1	30	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239394	GE	On-Demand	Anodyne	ADRB3	32	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239394	GE	On-Demand	Anodyne	ACOX1	57	32
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239394	GE	On-Demand	Anodyne	CACNA1B	41	33
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239394	GE	On-Demand	Anodyne	CCR2	98	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239394	GE	On-Demand	Anodyne	PDS	55	42
CCOc1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819239395	DD	On-Demand	Anodyne	ADRB2	34	44
CCOc1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819239395	DD	On-Demand	Anodyne	ADRB1	43	46
CCOc1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819239396	DD	On-Demand	Anodyne	ADRB2	34	44
CCOc1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819239396	DD	On-Demand	Anodyne	ADRB1	43	46
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239397	GE	On-Demand	Anodyne	ADRB2	29	44
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239397	GE	On-Demand	Anodyne	ADRB1	30	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239397	GE	On-Demand	Anodyne	ADRB3	32	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239397	GE	On-Demand	Anodyne	ACOX1	57	32
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239397	GE	On-Demand	Anodyne	CACNA1B	41	33
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239397	GE	On-Demand	Anodyne	CCR2	98	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819239397	GE	On-Demand	Anodyne	PDS	55	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccccc2OC)C1	ZINC000819239407	FD	On-Demand	Anodyne	ADRB2	21	45
CCOC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccccc2OC)C1	ZINC000819239407	FD	On-Demand	Anodyne	ADRB1	15	45
CCOC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccccc2OC)C1	ZINC000819239407	FD	On-Demand	Anodyne	MBTPS1	51	32
O=C(c1cc(=O)c2ccc(F)cc2o1)N1CCC[C@@H](CO)CC1	ZINC000819239408	DE	On-Demand	Anodyne	KCNH2	15	48
CCOC(=O)N1CC[C@H](NC[C@H](O)COCc2ccccc2OC)C1	ZINC000819239409	FD	On-Demand	Anodyne	ADRB2	21	45
CCOC(=O)N1CC[C@H](NC[C@H](O)COCc2ccccc2OC)C1	ZINC000819239409	FD	On-Demand	Anodyne	ADRB1	15	45
CCOC(=O)N1CC[C@H](NC[C@H](O)COCc2ccccc2OC)C1	ZINC000819239409	FD	On-Demand	Anodyne	MBTPS1	51	32
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccccc2OC)C1	ZINC000819239410	FD	On-Demand	Anodyne	ADRB2	21	45
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccccc2OC)C1	ZINC000819239410	FD	On-Demand	Anodyne	ADRB1	15	45
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccccc2OC)C1	ZINC000819239410	FD	On-Demand	Anodyne	MBTPS1	51	32
CCOC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccccc2OC)C1	ZINC000819239412	FD	On-Demand	Anodyne	ADRB2	21	45
CCOC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccccc2OC)C1	ZINC000819239412	FD	On-Demand	Anodyne	ADRB1	15	45
CCOC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccccc2OC)C1	ZINC000819239412	FD	On-Demand	Anodyne	MBTPS1	51	32
O=C(c1cc(=O)c2ccc(F)cc2o1)N1CCC[C@H](CO)CC1	ZINC000819239414	DE	On-Demand	Anodyne	KCNH2	15	48
CCC(=O)c1cc(C(=O)N2CCC[C@@H](CO)CC2)ccc1F	ZINC000819239416	DF	On-Demand	Anodyne	L3MBTL3	88	41
CCC(=O)c1cc(C(=O)N2CCC[C@H](CO)CC2)ccc1F	ZINC000819239418	DF	On-Demand	Anodyne	L3MBTL3	88	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239422	FC	On-Demand	Anodyne	ADRB2	28	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239422	FC	On-Demand	Anodyne	CHRM2	22	45
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239422	FC	On-Demand	Anodyne	ADRB1	30	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239422	FC	On-Demand	Anodyne	ADRB3	27	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239422	FC	On-Demand	Anodyne	EDNRB	54	36
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239422	FC	On-Demand	Anodyne	EDNRA	53	38
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239422	FC	On-Demand	Anodyne	ACOX1	48	32
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239422	FC	On-Demand	Anodyne	MCHR1	21	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239424	FC	On-Demand	Anodyne	ADRB2	28	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239424	FC	On-Demand	Anodyne	CHRM2	22	45
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239424	FC	On-Demand	Anodyne	ADRB1	30	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239424	FC	On-Demand	Anodyne	ADRB3	27	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239424	FC	On-Demand	Anodyne	EDNRB	54	36
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239424	FC	On-Demand	Anodyne	EDNRA	53	38
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239424	FC	On-Demand	Anodyne	ACOX1	48	32
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239424	FC	On-Demand	Anodyne	MCHR1	21	41
Cc1ccc(C(=O)N2CCC[C@@H](CO)CC2)c(Br)n1	ZINC000819239425	EE	On-Demand	Anodyne	L3MBTL3	56	36
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239426	FC	On-Demand	Anodyne	ADRB2	28	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239426	FC	On-Demand	Anodyne	CHRM2	22	45
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239426	FC	On-Demand	Anodyne	ADRB1	30	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239426	FC	On-Demand	Anodyne	ADRB3	27	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239426	FC	On-Demand	Anodyne	EDNRB	54	36
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239426	FC	On-Demand	Anodyne	EDNRA	53	38
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239426	FC	On-Demand	Anodyne	ACOX1	48	32
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239426	FC	On-Demand	Anodyne	MCHR1	21	41
Cc1ccc(C(=O)N2CCC[C@H](CO)CC2)c(Br)n1	ZINC000819239427	EE	On-Demand	Anodyne	L3MBTL3	56	36
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239429	FC	On-Demand	Anodyne	ADRB2	28	40
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239429	FC	On-Demand	Anodyne	CHRM2	22	45
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239429	FC	On-Demand	Anodyne	ADRB1	30	40
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239429	FC	On-Demand	Anodyne	ADRB3	27	41
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239429	FC	On-Demand	Anodyne	EDNRB	54	36
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239429	FC	On-Demand	Anodyne	EDNRA	53	38
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239429	FC	On-Demand	Anodyne	ACOX1	48	32
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819239429	FC	On-Demand	Anodyne	MCHR1	21	41
COC(=O)[C@H]1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCO1	ZINC000819239438	FC	On-Demand	Mild	PAPA1_CARPA	32	44
COC(=O)[C@@H]1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCO1	ZINC000819239440	FC	On-Demand	Mild	PAPA1_CARPA	32	44
COC(=O)[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCO1	ZINC000819239442	FC	On-Demand	Mild	PAPA1_CARPA	32	44
COC(=O)[C@@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCO1	ZINC000819239443	FC	On-Demand	Mild	PAPA1_CARPA	32	44
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@@H](CO)CC1	ZINC000819239447	DD	On-Demand	Anodyne	PREP	55	49
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@@H](CO)CC1	ZINC000819239447	DD	On-Demand	Anodyne	SFRP1	41	35
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@@H](CO)CC1	ZINC000819239447	DD	On-Demand	Anodyne	WNT3	45	35
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@@H](CO)CC1	ZINC000819239452	DD	On-Demand	Anodyne	PREP	55	49
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@@H](CO)CC1	ZINC000819239452	DD	On-Demand	Anodyne	SFRP1	41	35
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@@H](CO)CC1	ZINC000819239452	DD	On-Demand	Anodyne	WNT3	45	35
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@H](CO)CC1	ZINC000819239454	DD	On-Demand	Anodyne	PREP	55	49
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@H](CO)CC1	ZINC000819239454	DD	On-Demand	Anodyne	SFRP1	41	35
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@H](CO)CC1	ZINC000819239454	DD	On-Demand	Anodyne	WNT3	45	35
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@H](CO)CC1	ZINC000819239455	DD	On-Demand	Anodyne	PREP	55	49
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@H](CO)CC1	ZINC000819239455	DD	On-Demand	Anodyne	SFRP1	41	35
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@H](CO)CC1	ZINC000819239455	DD	On-Demand	Anodyne	WNT3	45	35
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCC[C@H](CO)CC2)(n2cccn2)CC1	ZINC000819239457	HE	On-Demand	Anodyne	GPR119	35	40
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCC[C@@H](CO)CC2)(n2cccn2)CC1	ZINC000819239459	HE	On-Demand	Anodyne	GPR119	35	40
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(=O)N3CCC[C@H](CO)CC3)cc2)cc1	ZINC000819239483	IF	On-Demand	Anodyne	SFRP1	47	35
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(=O)N3CCC[C@H](CO)CC3)cc2)cc1	ZINC000819239483	IF	On-Demand	Anodyne	LIMK2	25	51
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(=O)N3CCC[C@H](CO)CC3)cc2)cc1	ZINC000819239483	IF	On-Demand	Anodyne	L3MBTL3	75	42
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(=O)N3CCC[C@@H](CO)CC3)cc2)cc1	ZINC000819239485	IF	On-Demand	Anodyne	SFRP1	47	35
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(=O)N3CCC[C@@H](CO)CC3)cc2)cc1	ZINC000819239485	IF	On-Demand	Anodyne	LIMK2	25	51
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(=O)N3CCC[C@@H](CO)CC3)cc2)cc1	ZINC000819239485	IF	On-Demand	Anodyne	L3MBTL3	75	42
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCC[C@H](CO)CC2)CC1	ZINC000819239490	GG	On-Demand	Bother	SLC6A9	25	51
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCC[C@@H](CO)CC2)CC1	ZINC000819239491	GG	On-Demand	Bother	SLC6A9	25	51
O=C(CCCC1CC1)N1CCC[C@@H](CO)CC1	ZINC000819239492	BE	On-Demand	Anodyne	PREP	15	42
O=C(CCCC1CC1)N1CCC[C@H](CO)CC1	ZINC000819239493	BE	On-Demand	Anodyne	PREP	15	42
O=C(c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@H](CO)CC1	ZINC000819239494	GE	On-Demand	Anodyne	CNR2	18	51
O=C(c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@H](CO)CC1	ZINC000819239494	GE	On-Demand	Anodyne	L3MBTL3	88	42
O=C(c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819239495	GE	On-Demand	Anodyne	CNR2	18	51
O=C(c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@@H](CO)CC1	ZINC000819239495	GE	On-Demand	Anodyne	L3MBTL3	88	42
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)N2CCC[C@@H](CO)CC2)C1	ZINC000819239500	FF	On-Demand	Anodyne	PREP	23	57
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)N2CCC[C@@H](CO)CC2)C1	ZINC000819239501	FF	On-Demand	Anodyne	PREP	23	57
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(=O)N2CCC[C@H](CO)CC2)C1	ZINC000819239502	FF	On-Demand	Anodyne	PREP	23	57
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(=O)N2CCC[C@H](CO)CC2)C1	ZINC000819239503	FF	On-Demand	Anodyne	PREP	23	57
COc1ccccc1-c1nc(C(=O)N2CCC[C@@H](CO)CC2)cs1	ZINC000819239512	EG	On-Demand	Anodyne	TRPC6	47	41
COc1ccccc1-c1nc(C(=O)N2CCC[C@@H](CO)CC2)cs1	ZINC000819239512	EG	On-Demand	Anodyne	TRPC3	39	41
COc1ccccc1-c1nc(C(=O)N2CCC[C@H](CO)CC2)cs1	ZINC000819239513	EG	On-Demand	Anodyne	TRPC6	47	41
COc1ccccc1-c1nc(C(=O)N2CCC[C@H](CO)CC2)cs1	ZINC000819239513	EG	On-Demand	Anodyne	TRPC3	39	41
COC(=O)c1ccc(C(=O)N2CCC[C@@H](CO)CC2)cc1F	ZINC000819239514	DD	On-Demand	Anodyne	L3MBTL3	85	41
COC(=O)c1ccc(C(=O)N2CCC[C@H](CO)CC2)cc1F	ZINC000819239515	DD	On-Demand	Anodyne	L3MBTL3	85	41
CC(C)(C)OC(=O)N1CCCc2cc(C(=O)N3CCC[C@H](CO)CC3)ccc21	ZINC000819239520	GH	On-Demand	Anodyne	GPR119	30	48
CC(C)(C)OC(=O)N1CCCc2cc(C(=O)N3CCC[C@H](CO)CC3)ccc21	ZINC000819239520	GH	On-Demand	Anodyne	L3MBTL3	60	34
CC(C)(C)OC(=O)N1CCCc2cc(C(=O)N3CCC[C@@H](CO)CC3)ccc21	ZINC000819239521	GH	On-Demand	Anodyne	GPR119	30	48
CC(C)(C)OC(=O)N1CCCc2cc(C(=O)N3CCC[C@@H](CO)CC3)ccc21	ZINC000819239521	GH	On-Demand	Anodyne	L3MBTL3	60	34
CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819239522	GG	On-Demand	Anodyne	PREP	51	43
CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1C(=O)N1CCC[C@H](CO)CC1	ZINC000819239523	GG	On-Demand	Anodyne	PREP	51	43
CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1C(=O)N1CCC[C@H](CO)CC1	ZINC000819239524	GG	On-Demand	Anodyne	PREP	51	43
CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819239525	GG	On-Demand	Anodyne	PREP	51	43
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCC[C@@H](CO)CC2)C[C@H]2C[C@H]21	ZINC000819239526	EE	On-Demand	Anodyne	PREP	25	64
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCC[C@H](CO)CC2)C[C@H]2C[C@H]21	ZINC000819239527	EE	On-Demand	Anodyne	PREP	25	64
CN1C[C@H](C(=O)N2CCC[C@H](CO)CC2)c2ccccc2C1=O	ZINC000819239528	DD	On-Demand	Anodyne	PREP	26	40
CN1C[C@H](C(=O)N2CCC[C@@H](CO)CC2)c2ccccc2C1=O	ZINC000819239529	DD	On-Demand	Anodyne	PREP	26	40
CN1C[C@@H](C(=O)N2CCC[C@@H](CO)CC2)c2ccccc2C1=O	ZINC000819239530	DD	On-Demand	Anodyne	PREP	26	40
CN1C[C@@H](C(=O)N2CCC[C@H](CO)CC2)c2ccccc2C1=O	ZINC000819239531	DD	On-Demand	Anodyne	PREP	26	40
O=C1CCCc2cc(C(=O)N3CCC[C@@H](CO)CC3)ccc2N1	ZINC000819239540	DE	On-Demand	Anodyne	L3MBTL3	74	38
O=C1CCCc2cc(C(=O)N3CCC[C@H](CO)CC3)ccc2N1	ZINC000819239541	DE	On-Demand	Anodyne	L3MBTL3	74	38
COCCN1C(=O)c2ccc(C(=O)N3CCC[C@@H](CO)CC3)cc2S1(=O)=O	ZINC000819239542	GC	On-Demand	Anodyne	L3MBTL3	54	33
COCCN1C(=O)c2ccc(C(=O)N3CCC[C@H](CO)CC3)cc2S1(=O)=O	ZINC000819239543	GC	On-Demand	Anodyne	L3MBTL3	54	33
O[C@H](CNOC1CCOCC1)COc1ccccc1C(F)(F)F	ZINC000819239555	EE	On-Demand	Anodyne	ADRB2	22	42
O[C@@H](CNOC1CCOCC1)COc1ccccc1C(F)(F)F	ZINC000819239556	EE	On-Demand	Anodyne	ADRB2	22	42
CC(=O)Nc1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819239586	DD	On-Demand	Anodyne	ADRB2	39	60
CC(=O)Nc1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819239586	DD	On-Demand	Anodyne	ADRB1	75	60
CC(=O)Nc1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819239586	DD	On-Demand	Anodyne	ADRB3	45	49
CC(=O)Nc1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819239587	DD	On-Demand	Anodyne	ADRB2	39	60
CC(=O)Nc1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819239587	DD	On-Demand	Anodyne	ADRB1	75	60
CC(=O)Nc1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819239587	DD	On-Demand	Anodyne	ADRB3	45	49
C=CCCn1cc(C(=O)Nc2ccc(N3CCN(CC(=O)OC)CC3)cc2)nn1	ZINC000819239596	GD	On-Demand	Mild	PRNP	41	40
CC(=O)c1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819239601	DD	On-Demand	Anodyne	ADRB2	28	45
CC(=O)c1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819239601	DD	On-Demand	Anodyne	ADRB1	46	44
CC(=O)c1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819239602	DD	On-Demand	Anodyne	ADRB2	28	45
CC(=O)c1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819239602	DD	On-Demand	Anodyne	ADRB1	46	44
O=C(CCNOC1CCOCC1)Nc1cccc(Br)c1	ZINC000819239622	EE	On-Demand	Anodyne	EGFR	24	43
O=C(CCNOC1CCOCC1)Nc1cccc(Br)c1	ZINC000819239622	EE	On-Demand	Anodyne	HDAC2	15	41
O=C(CCNOC1CCOCC1)Nc1cccc(F)c1	ZINC000819239632	CD	On-Demand	Anodyne	EPHX2	16	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819239667	GF	On-Demand	Anodyne	ADRB2	24	42
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819239667	GF	On-Demand	Anodyne	ADRB1	22	42
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819239667	GF	On-Demand	Anodyne	ADRB3	30	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819239667	GF	On-Demand	Anodyne	CCR1	50	39
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819239668	GF	On-Demand	Anodyne	ADRB2	24	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819239668	GF	On-Demand	Anodyne	ADRB1	22	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819239668	GF	On-Demand	Anodyne	ADRB3	30	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819239668	GF	On-Demand	Anodyne	CCR1	50	39
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819239669	GF	On-Demand	Anodyne	ADRB2	24	42
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819239669	GF	On-Demand	Anodyne	ADRB1	22	42
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819239669	GF	On-Demand	Anodyne	ADRB3	30	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819239669	GF	On-Demand	Anodyne	CCR1	50	39
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819239670	GF	On-Demand	Anodyne	ADRB2	24	42
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819239670	GF	On-Demand	Anodyne	ADRB1	22	42
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819239670	GF	On-Demand	Anodyne	ADRB3	30	40
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000819239670	GF	On-Demand	Anodyne	CCR1	50	39
CN(C)CCCOc1ccc(CNC(=O)C(F)=C2CCC2)cc1	ZINC000819239671	DG	On-Demand	Anodyne	LTA4H	22	41
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819239688	GH	On-Demand	Anodyne	ADRB1	17	41
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819239688	GH	On-Demand	Anodyne	ADRB3	35	41
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819239688	GH	On-Demand	Anodyne	P2RX7	28	42
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819239688	GH	On-Demand	Anodyne	MTTP	28	42
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819239688	GH	On-Demand	Anodyne	RBP4	90	41
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819239688	GH	On-Demand	Anodyne	SCD1	40	57
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819239688	GH	On-Demand	Anodyne	SFRP1	135	46
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819239688	GH	On-Demand	Anodyne	SCD	46	57
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819239688	GH	On-Demand	Anodyne	WNT3	90	39
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819239689	GH	On-Demand	Anodyne	ADRB1	17	41
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819239689	GH	On-Demand	Anodyne	ADRB3	35	41
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819239689	GH	On-Demand	Anodyne	P2RX7	28	42
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819239689	GH	On-Demand	Anodyne	MTTP	28	42
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819239689	GH	On-Demand	Anodyne	RBP4	90	41
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819239689	GH	On-Demand	Anodyne	SCD1	40	57
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819239689	GH	On-Demand	Anodyne	SFRP1	135	46
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819239689	GH	On-Demand	Anodyne	SCD	46	57
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819239689	GH	On-Demand	Anodyne	WNT3	90	39
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819239691	FE	On-Demand	Anodyne	EPHX2	50	47
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819239691	FE	On-Demand	Anodyne	MCHR1	16	41
CCOC(=O)N1CC[C@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819239692	FE	On-Demand	Anodyne	EPHX2	50	47
CCOC(=O)N1CC[C@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819239692	FE	On-Demand	Anodyne	MCHR1	16	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819239693	FE	On-Demand	Anodyne	EPHX2	50	47
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819239693	FE	On-Demand	Anodyne	MCHR1	16	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819239694	FE	On-Demand	Anodyne	EPHX2	50	47
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819239694	FE	On-Demand	Anodyne	MCHR1	16	41
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCc2cccnc2)cc1	ZINC000819239718	DG	On-Demand	Anodyne	PTAFR	17	44
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCc2cccnc2)cc1	ZINC000819239718	DG	On-Demand	Anodyne	CHRNA7	47	41
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCc2cccnc2)cc1	ZINC000819239718	DG	On-Demand	Anodyne	NAMPT	43	39
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCc2cccnc2)cc1	ZINC000819239719	DG	On-Demand	Anodyne	PTAFR	17	44
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCc2cccnc2)cc1	ZINC000819239719	DG	On-Demand	Anodyne	CHRNA7	47	41
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCc2cccnc2)cc1	ZINC000819239719	DG	On-Demand	Anodyne	NAMPT	43	39
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCc2cccnc2)cc1	ZINC000819239720	DG	On-Demand	Anodyne	PTAFR	17	44
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCc2cccnc2)cc1	ZINC000819239720	DG	On-Demand	Anodyne	CHRNA7	47	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCc2cccnc2)cc1	ZINC000819239720	DG	On-Demand	Anodyne	NAMPT	43	39
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCc2cccnc2)cc1	ZINC000819239721	DG	On-Demand	Anodyne	PTAFR	17	44
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCc2cccnc2)cc1	ZINC000819239721	DG	On-Demand	Anodyne	CHRNA7	47	41
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCc2cccnc2)cc1	ZINC000819239721	DG	On-Demand	Anodyne	NAMPT	43	39
C=CCC1(C(=O)Nc2ccc(OCc3cccnc3)cc2)CCOCC1	ZINC000819239729	FH	On-Demand	Mild	NAMPT	39	42
CCOC(=O)N1CC[C@@H](NCCC(=O)Nc2cc(OC)c(Cl)cc2OC)C1	ZINC000819239738	GF	On-Demand	Anodyne	HTR4	63	41
CCOC(=O)N1CC[C@H](NCCC(=O)Nc2cc(OC)c(Cl)cc2OC)C1	ZINC000819239739	GF	On-Demand	Anodyne	HTR4	63	41
CCOC(=O)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239745	EF	On-Demand	Anodyne	ADRB1	15	40
CCOC(=O)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239745	EF	On-Demand	Anodyne	ADRB3	28	40
CCOC(=O)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239745	EF	On-Demand	Anodyne	TACR1	46	34
CCOC(=O)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239745	EF	On-Demand	Anodyne	CACNA1B	44	35
CCOC(=O)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239745	EF	On-Demand	Anodyne	CCR2	117	41
CCOC(=O)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239745	EF	On-Demand	Anodyne	EPHX2	23	47
CCOC(=O)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239745	EF	On-Demand	Anodyne	LIPG	45	35
CCOC(=O)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239745	EF	On-Demand	Anodyne	SFRP1	60	33
CCOC(=O)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239745	EF	On-Demand	Anodyne	WNT3	40	33
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239746	EF	On-Demand	Anodyne	ADRB1	15	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239746	EF	On-Demand	Anodyne	ADRB3	28	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239746	EF	On-Demand	Anodyne	TACR1	46	34
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239746	EF	On-Demand	Anodyne	CACNA1B	44	35
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239746	EF	On-Demand	Anodyne	CCR2	117	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239746	EF	On-Demand	Anodyne	EPHX2	23	47
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239746	EF	On-Demand	Anodyne	LIPG	45	35
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239746	EF	On-Demand	Anodyne	SFRP1	60	33
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239746	EF	On-Demand	Anodyne	WNT3	40	33
O=C(NCC1(CC(=O)N2CCC[C@H](CO)CC2)CCCCC1)OCc1ccccc1	ZINC000819239748	HH	On-Demand	Anodyne	GRIN2B	30	41
O=C(NCC1(CC(=O)N2CCC[C@H](CO)CC2)CCCCC1)OCc1ccccc1	ZINC000819239748	HH	On-Demand	Anodyne	CTSK	20	40
O=C(NCC1(CC(=O)N2CCC[C@H](CO)CC2)CCCCC1)OCc1ccccc1	ZINC000819239748	HH	On-Demand	Anodyne	PREP	40	47
O=C(NCC1(CC(=O)N2CCC[C@H](CO)CC2)CCCCC1)OCc1ccccc1	ZINC000819239748	HH	On-Demand	Anodyne	SLC12A5	57	41
O=C(NCC1(CC(=O)N2CCC[C@@H](CO)CC2)CCCCC1)OCc1ccccc1	ZINC000819239749	HH	On-Demand	Anodyne	GRIN2B	30	41
O=C(NCC1(CC(=O)N2CCC[C@@H](CO)CC2)CCCCC1)OCc1ccccc1	ZINC000819239749	HH	On-Demand	Anodyne	CTSK	20	40
O=C(NCC1(CC(=O)N2CCC[C@@H](CO)CC2)CCCCC1)OCc1ccccc1	ZINC000819239749	HH	On-Demand	Anodyne	PREP	40	47
O=C(NCC1(CC(=O)N2CCC[C@@H](CO)CC2)CCCCC1)OCc1ccccc1	ZINC000819239749	HH	On-Demand	Anodyne	SLC12A5	57	41
CS(=O)(=O)NCCc1ccc(C(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819239750	FD	On-Demand	Anodyne	L3MBTL3	76	41
CS(=O)(=O)NCCc1ccc(C(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819239751	FD	On-Demand	Anodyne	L3MBTL3	76	41
N#Cc1ccccc1/C=C\C(=O)N1CCC[C@H](CO)CC1	ZINC000819239762	CE	On-Demand	Mild	ITGAL	51	35
N#Cc1ccccc1/C=C/C(=O)N1CCC[C@@H](CO)CC1	ZINC000819239763	CE	On-Demand	Mild	ITGAL	51	35
N#Cc1ccccc1/C=C/C(=O)N1CCC[C@H](CO)CC1	ZINC000819239764	CE	On-Demand	Mild	ITGAL	51	35
C[S@@](=O)c1ccc(C(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819239770	CD	On-Demand	Anodyne	L3MBTL3	94	47
C[S@@](=O)c1ccc(C(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819239771	CD	On-Demand	Anodyne	L3MBTL3	94	47
C[S@](=O)c1ccc(C(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819239772	CD	On-Demand	Anodyne	L3MBTL3	94	47
C[S@](=O)c1ccc(C(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819239773	CD	On-Demand	Anodyne	L3MBTL3	94	47
CCN(CC)S(=O)(=O)c1cc(C(=O)N2CCC[C@H](CO)CC2)ccc1Cl	ZINC000819239788	HF	On-Demand	Anodyne	L3MBTL3	71	36
CCN(CC)S(=O)(=O)c1cc(C(=O)N2CCC[C@@H](CO)CC2)ccc1Cl	ZINC000819239789	HF	On-Demand	Anodyne	L3MBTL3	71	36
O=C(c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1)N1CCC[C@H](CO)CC1	ZINC000819239794	IE	On-Demand	Anodyne	NOS2	68	34
O=C(c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1)N1CCC[C@H](CO)CC1	ZINC000819239794	IE	On-Demand	Anodyne	ST14	79	34
O=C(c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1)N1CCC[C@H](CO)CC1	ZINC000819239794	IE	On-Demand	Anodyne	SFRP1	62	37
O=C(c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1)N1CCC[C@@H](CO)CC1	ZINC000819239795	IE	On-Demand	Anodyne	NOS2	68	34
O=C(c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1)N1CCC[C@@H](CO)CC1	ZINC000819239795	IE	On-Demand	Anodyne	ST14	79	34
O=C(c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1)N1CCC[C@@H](CO)CC1	ZINC000819239795	IE	On-Demand	Anodyne	SFRP1	62	37
O=C(c1ccc(CSc2nc3ccccc3s2)cc1)N1CCC[C@H](CO)CC1	ZINC000819239798	HJ	On-Demand	Anodyne	L3MBTL3	45	35
O=C(c1ccc(CSc2nc3ccccc3s2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819239799	HJ	On-Demand	Anodyne	L3MBTL3	45	35
O=C(c1cc(-c2ccccc2)nn1-c1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819239813	GH	On-Demand	Anodyne	P2RY12	43	39
O=C(c1cc(-c2ccccc2)nn1-c1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819239815	GH	On-Demand	Anodyne	P2RY12	43	39
O=C(c1cc(Br)c2ccccc2c1)N1CCC[C@@H](CO)CC1	ZINC000819239821	FH	On-Demand	Anodyne	AKR1C3	16	41
O=C(c1cc(Br)c2ccccc2c1)N1CCC[C@@H](CO)CC1	ZINC000819239821	FH	On-Demand	Anodyne	L3MBTL3	76	40
O=C(c1cc(Br)c2ccccc2c1)N1CCC[C@H](CO)CC1	ZINC000819239824	FH	On-Demand	Anodyne	AKR1C3	16	41
O=C(c1cc(Br)c2ccccc2c1)N1CCC[C@H](CO)CC1	ZINC000819239824	FH	On-Demand	Anodyne	L3MBTL3	76	40
O=C(CCNOC1CCOCC1)Nc1cccnc1	ZINC000819239836	CD	On-Demand	Anodyne	CHRNA7	19	44
O=C(CCNOC1CCOCC1)Nc1cccnc1	ZINC000819239836	CD	On-Demand	Anodyne	NAMPT	29	40
O=C(COCc1ccccn1)N1CCC[C@@H](CO)CC1	ZINC000819239839	CD	On-Demand	Anodyne	GRIN2B	24	41
O=C(COCc1ccccn1)N1CCC[C@H](CO)CC1	ZINC000819239842	CD	On-Demand	Anodyne	GRIN2B	24	41
CN(CCC(=O)N1CCC[C@H](CO)CC1)C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000819239847	IH	On-Demand	Anodyne	SSTR1	49	47
CN(CCC(=O)N1CCC[C@@H](CO)CC1)C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000819239849	IH	On-Demand	Anodyne	SSTR1	49	47
O[C@H](CNOC1CCOCC1)c1ccccc1	ZINC000819239851	BD	On-Demand	Anodyne	Q8WSF8_APLCA	24	40
O[C@@H](CNOC1CCOCC1)c1ccccc1	ZINC000819239853	BD	On-Demand	Anodyne	Q8WSF8_APLCA	24	40
O=C(c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1)N1CCC[C@H](CO)CC1	ZINC000819239868	HE	On-Demand	Anodyne	L3MBTL3	79	38
O=C(c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1)N1CCC[C@@H](CO)CC1	ZINC000819239874	HE	On-Demand	Anodyne	L3MBTL3	79	38
COc1ccccc1/C(C)=C\C(=O)N1CCC[C@@H](CO)CC1	ZINC000819239879	DF	On-Demand	Anodyne	SLC6A1	36	40
COc1ccccc1/C(C)=C\C(=O)N1CCC[C@@H](CO)CC1	ZINC000819239879	DF	On-Demand	Anodyne	KCNA3	42	39
COc1ccccc1/C(C)=C\C(=O)N1CCC[C@@H](CO)CC1	ZINC000819239879	DF	On-Demand	Anodyne	ACKR3	66	36
COc1ccccc1/C(C)=C\C(=O)N1CCC[C@H](CO)CC1	ZINC000819239880	DF	On-Demand	Anodyne	SLC6A1	36	40
COc1ccccc1/C(C)=C\C(=O)N1CCC[C@H](CO)CC1	ZINC000819239880	DF	On-Demand	Anodyne	KCNA3	42	39
COc1ccccc1/C(C)=C\C(=O)N1CCC[C@H](CO)CC1	ZINC000819239880	DF	On-Demand	Anodyne	ACKR3	66	36
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239882	EF	On-Demand	Anodyne	ADRB1	15	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239882	EF	On-Demand	Anodyne	ADRB3	28	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239882	EF	On-Demand	Anodyne	TACR1	46	34
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239882	EF	On-Demand	Anodyne	CACNA1B	44	35
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239882	EF	On-Demand	Anodyne	CCR2	117	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239882	EF	On-Demand	Anodyne	EPHX2	23	47
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239882	EF	On-Demand	Anodyne	LIPG	45	35
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239882	EF	On-Demand	Anodyne	SFRP1	60	33
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239882	EF	On-Demand	Anodyne	WNT3	40	33
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239883	EF	On-Demand	Anodyne	ADRB1	15	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239883	EF	On-Demand	Anodyne	ADRB3	28	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239883	EF	On-Demand	Anodyne	TACR1	46	34
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239883	EF	On-Demand	Anodyne	CACNA1B	44	35
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239883	EF	On-Demand	Anodyne	CCR2	117	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239883	EF	On-Demand	Anodyne	EPHX2	23	47
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239883	EF	On-Demand	Anodyne	LIPG	45	35
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239883	EF	On-Demand	Anodyne	SFRP1	60	33
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819239883	EF	On-Demand	Anodyne	WNT3	40	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000819239888	GH	On-Demand	Anodyne	CHRNA7	36	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000819239888	GH	On-Demand	Anodyne	ADAM17	24	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000819239888	GH	On-Demand	Anodyne	NAMPT	53	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239889	GF	On-Demand	Anodyne	ADRB2	37	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239889	GF	On-Demand	Anodyne	ADRB1	47	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239889	GF	On-Demand	Anodyne	HRH1	34	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239889	GF	On-Demand	Anodyne	GRIN1	23	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239889	GF	On-Demand	Anodyne	P2RY12	46	34
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239889	GF	On-Demand	Anodyne	ADRB3	41	45
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239889	GF	On-Demand	Anodyne	ACOX1	70	35
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239889	GF	On-Demand	Anodyne	CCR3	44	51
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239890	GF	On-Demand	Anodyne	ADRB2	37	42
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239890	GF	On-Demand	Anodyne	ADRB1	47	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239890	GF	On-Demand	Anodyne	HRH1	34	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239890	GF	On-Demand	Anodyne	GRIN1	23	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239890	GF	On-Demand	Anodyne	P2RY12	46	34
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239890	GF	On-Demand	Anodyne	ADRB3	41	45
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239890	GF	On-Demand	Anodyne	ACOX1	70	35
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239890	GF	On-Demand	Anodyne	CCR3	44	51
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239891	GF	On-Demand	Anodyne	ADRB2	37	42
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239891	GF	On-Demand	Anodyne	ADRB1	47	41
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239891	GF	On-Demand	Anodyne	HRH1	34	40
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239891	GF	On-Demand	Anodyne	GRIN1	23	40
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239891	GF	On-Demand	Anodyne	P2RY12	46	34
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239891	GF	On-Demand	Anodyne	ADRB3	41	45
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239891	GF	On-Demand	Anodyne	ACOX1	70	35
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239891	GF	On-Demand	Anodyne	CCR3	44	51
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239892	GF	On-Demand	Anodyne	ADRB2	37	42
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239892	GF	On-Demand	Anodyne	ADRB1	47	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239892	GF	On-Demand	Anodyne	HRH1	34	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239892	GF	On-Demand	Anodyne	GRIN1	23	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239892	GF	On-Demand	Anodyne	P2RY12	46	34
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239892	GF	On-Demand	Anodyne	ADRB3	41	45
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239892	GF	On-Demand	Anodyne	ACOX1	70	35
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819239892	GF	On-Demand	Anodyne	CCR3	44	51
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)C2CC2)CC1	ZINC000819239905	FF	On-Demand	Anodyne	RBP4	87	40
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)C2CC2)CC1	ZINC000819239905	FF	On-Demand	Anodyne	SCD1	27	44
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)C2CC2)CC1	ZINC000819239905	FF	On-Demand	Anodyne	SFRP1	126	44
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)C2CC2)CC1	ZINC000819239905	FF	On-Demand	Anodyne	SCD	30	44
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@H](O)C2CC2)CC1	ZINC000819239905	FF	On-Demand	Anodyne	WNT3	84	39
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)C2CC2)CC1	ZINC000819239906	FF	On-Demand	Anodyne	RBP4	87	40
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)C2CC2)CC1	ZINC000819239906	FF	On-Demand	Anodyne	SCD1	27	44
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)C2CC2)CC1	ZINC000819239906	FF	On-Demand	Anodyne	SFRP1	126	44
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)C2CC2)CC1	ZINC000819239906	FF	On-Demand	Anodyne	SCD	30	44
O=C(c1ccccc1C(F)(F)F)N1CCC(NC[C@@H](O)C2CC2)CC1	ZINC000819239906	FF	On-Demand	Anodyne	WNT3	84	39
O=C(CCNOC1CCOCC1)Nc1cccc(C(F)(F)F)c1	ZINC000819239922	EF	On-Demand	Anodyne	HDAC10	15	55
O=C(CCNOC1CCOCC1)Nc1cccc(C(F)(F)F)c1	ZINC000819239922	EF	On-Demand	Anodyne	EPHX2	23	46
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000819239927	FD	On-Demand	Anodyne	ADRB2	42	51
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000819239927	FD	On-Demand	Anodyne	ADRB1	57	45
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000819239927	FD	On-Demand	Anodyne	ADRB3	44	48
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000819239927	FD	On-Demand	Anodyne	ACOX1	43	30
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000819239929	FD	On-Demand	Anodyne	ADRB2	42	51
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000819239929	FD	On-Demand	Anodyne	ADRB1	57	45
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000819239929	FD	On-Demand	Anodyne	ADRB3	44	48
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000819239929	FD	On-Demand	Anodyne	ACOX1	43	30
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000819239930	FD	On-Demand	Anodyne	ADRB2	42	51
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000819239930	FD	On-Demand	Anodyne	ADRB1	57	45
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000819239930	FD	On-Demand	Anodyne	ADRB3	44	48
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000819239930	FD	On-Demand	Anodyne	ACOX1	43	30
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000819239933	FD	On-Demand	Anodyne	ADRB2	42	51
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000819239933	FD	On-Demand	Anodyne	ADRB1	57	45
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000819239933	FD	On-Demand	Anodyne	ADRB3	44	48
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(C(=O)OC)cc2)C1	ZINC000819239933	FD	On-Demand	Anodyne	ACOX1	43	30
O[C@@H](CNOC1CCOCC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819239934	FF	On-Demand	Anodyne	ADRB2	43	48
O[C@@H](CNOC1CCOCC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819239934	FF	On-Demand	Anodyne	ADRB1	61	42
O[C@@H](CNOC1CCOCC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819239934	FF	On-Demand	Anodyne	ADRB3	40	40
O[C@H](CNOC1CCOCC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819239936	FF	On-Demand	Anodyne	ADRB2	43	48
O[C@H](CNOC1CCOCC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819239936	FF	On-Demand	Anodyne	ADRB1	61	42
O[C@H](CNOC1CCOCC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819239936	FF	On-Demand	Anodyne	ADRB3	40	40
N#CCc1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819239938	DD	On-Demand	Mild	ADRB2	24	42
N#CCc1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819239938	DD	On-Demand	Mild	ADRB1	43	45
N#CCc1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819239940	DD	On-Demand	Mild	ADRB2	24	42
N#CCc1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819239940	DD	On-Demand	Mild	ADRB1	43	45
O[C@H](CNOC1CCOCC1)COc1ccccc1F	ZINC000819239941	CD	On-Demand	Anodyne	ADRB2	25	44
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239943	GF	On-Demand	Anodyne	ADRB2	53	49
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239943	GF	On-Demand	Anodyne	ADRB1	76	49
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239943	GF	On-Demand	Anodyne	CHRM1	15	48
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239943	GF	On-Demand	Anodyne	PPARG	15	41
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239943	GF	On-Demand	Anodyne	P2RY12	133	38
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239943	GF	On-Demand	Anodyne	ADRB3	63	49
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239943	GF	On-Demand	Anodyne	MMP13	20	43
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239943	GF	On-Demand	Anodyne	ACOX1	54	41
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239943	GF	On-Demand	Anodyne	CCR8	40	41
O[C@@H](CNOC1CCOCC1)COc1ccccc1F	ZINC000819239944	CD	On-Demand	Anodyne	ADRB2	25	44
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239945	GF	On-Demand	Anodyne	ADRB2	53	49
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239945	GF	On-Demand	Anodyne	ADRB1	76	49
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239945	GF	On-Demand	Anodyne	CHRM1	15	48
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239945	GF	On-Demand	Anodyne	PPARG	15	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239945	GF	On-Demand	Anodyne	P2RY12	133	38
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239945	GF	On-Demand	Anodyne	ADRB3	63	49
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239945	GF	On-Demand	Anodyne	MMP13	20	43
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239945	GF	On-Demand	Anodyne	ACOX1	54	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239945	GF	On-Demand	Anodyne	CCR8	40	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239947	GF	On-Demand	Anodyne	ADRB2	53	49
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239947	GF	On-Demand	Anodyne	ADRB1	76	49
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239947	GF	On-Demand	Anodyne	CHRM1	15	48
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239947	GF	On-Demand	Anodyne	PPARG	15	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239947	GF	On-Demand	Anodyne	P2RY12	133	38
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239947	GF	On-Demand	Anodyne	ADRB3	63	49
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239947	GF	On-Demand	Anodyne	MMP13	20	43
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239947	GF	On-Demand	Anodyne	ACOX1	54	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239947	GF	On-Demand	Anodyne	CCR8	40	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239950	GF	On-Demand	Anodyne	ADRB2	53	49
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239950	GF	On-Demand	Anodyne	ADRB1	76	49
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239950	GF	On-Demand	Anodyne	CHRM1	15	48
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239950	GF	On-Demand	Anodyne	PPARG	15	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239950	GF	On-Demand	Anodyne	P2RY12	133	38
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239950	GF	On-Demand	Anodyne	ADRB3	63	49
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239950	GF	On-Demand	Anodyne	MMP13	20	43
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239950	GF	On-Demand	Anodyne	ACOX1	54	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819239950	GF	On-Demand	Anodyne	CCR8	40	41
O=C(/C=C/[C@@H]1CCCO1)Nc1nc2ccccc2n1CCCn1ccnc1	ZINC000819239962	FF	On-Demand	Anodyne	ITK	31	47
O=C(/C=C\[C@H]1CCCO1)Nc1nc2ccccc2n1CCCn1ccnc1	ZINC000819239965	FF	On-Demand	Anodyne	ITK	31	47
O=C(/C=C\[C@@H]1CCCO1)Nc1nc2ccccc2n1CCCn1ccnc1	ZINC000819239967	FF	On-Demand	Anodyne	ITK	31	47
O=C(/C=C/[C@H]1CCCO1)Nc1nc2ccccc2n1CCCn1ccnc1	ZINC000819239970	FF	On-Demand	Anodyne	ITK	31	47
CCOC(=O)N1CC[C@@H](NCCS(C)(=O)=O)C1	ZINC000819239971	CB	On-Demand	Anodyne	CCR8	29	40
CCOC(=O)N1CC[C@H](NCCS(C)(=O)=O)C1	ZINC000819239974	CB	On-Demand	Anodyne	CCR8	29	40
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCc2cccc(F)c2)c(F)c1	ZINC000819239977	FI	On-Demand	Anodyne	EGFR	39	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCc2cccc(F)c2)c(F)c1	ZINC000819239977	FI	On-Demand	Anodyne	ERBB2	62	41
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCc2cccc(F)c2)c(F)c1	ZINC000819239979	FI	On-Demand	Anodyne	EGFR	39	41
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCc2cccc(F)c2)c(F)c1	ZINC000819239979	FI	On-Demand	Anodyne	ERBB2	62	41
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCc2cccc(F)c2)c(F)c1	ZINC000819239981	FI	On-Demand	Anodyne	EGFR	39	41
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCc2cccc(F)c2)c(F)c1	ZINC000819239981	FI	On-Demand	Anodyne	ERBB2	62	41
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCc2cccc(F)c2)c(F)c1	ZINC000819239982	FI	On-Demand	Anodyne	EGFR	39	41
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCc2cccc(F)c2)c(F)c1	ZINC000819239982	FI	On-Demand	Anodyne	ERBB2	62	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(OCc3cccnc3)cc1)C2	ZINC000819240007	GG	On-Demand	Anodyne	CHRNA7	36	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(OCc3cccnc3)cc1)C2	ZINC000819240007	GG	On-Demand	Anodyne	ADAM17	22	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(OCc3cccnc3)cc1)C2	ZINC000819240007	GG	On-Demand	Anodyne	NAMPT	49	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(OCc3cccnc3)cc1)C2	ZINC000819240009	GG	On-Demand	Anodyne	CHRNA7	36	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(OCc3cccnc3)cc1)C2	ZINC000819240009	GG	On-Demand	Anodyne	ADAM17	22	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(OCc3cccnc3)cc1)C2	ZINC000819240009	GG	On-Demand	Anodyne	NAMPT	49	37
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819240011	FF	On-Demand	Anodyne	ADRB2	39	43
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819240011	FF	On-Demand	Anodyne	ADRB1	50	43
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819240011	FF	On-Demand	Anodyne	ADRB3	35	46
CCOC(=O)N1CC[C@H](NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819240011	FF	On-Demand	Anodyne	ACOX1	51	32
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819240013	FF	On-Demand	Anodyne	ADRB2	39	43
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819240013	FF	On-Demand	Anodyne	ADRB1	50	43
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819240013	FF	On-Demand	Anodyne	ADRB3	35	46
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819240013	FF	On-Demand	Anodyne	ACOX1	51	32
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819240015	FF	On-Demand	Anodyne	ADRB2	39	43
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819240015	FF	On-Demand	Anodyne	ADRB1	50	43
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819240015	FF	On-Demand	Anodyne	ADRB3	35	46
CCOC(=O)N1CC[C@H](NC[C@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819240015	FF	On-Demand	Anodyne	ACOX1	51	32
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819240017	FF	On-Demand	Anodyne	ADRB2	39	43
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819240017	FF	On-Demand	Anodyne	ADRB1	50	43
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819240017	FF	On-Demand	Anodyne	ADRB3	35	46
CCOC(=O)N1CC[C@@H](NC[C@H](O)COc2ccc(C(C)(C)C)cc2)C1	ZINC000819240017	FF	On-Demand	Anodyne	ACOX1	51	32
CCOC(=O)N1CC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819240035	DD	On-Demand	Bother	SLC27A4	46	35
CCOC(=O)N1CC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819240037	DD	On-Demand	Bother	SLC27A4	46	35
CCOC(=O)N1CC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819240039	DD	On-Demand	Bother	SLC27A4	46	35
CCOC(=O)N1CC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819240041	DD	On-Demand	Bother	SLC27A4	46	35
C#CCNC(=O)CN1CCN(C(=O)Cc2nsc3ccccc23)CC1	ZINC000819240046	FC	On-Demand	Mild	HTR1A	18	41
O=C(O)[C@@H]1CCCN1C(=O)c1nc(=O)c2ccccc2[nH]1	ZINC000819240049	CC	On-Demand	Anodyne	ACE	50	40
O=C(O)[C@@H]1CCCN1C(=O)c1nc(=O)c2ccccc2[nH]1	ZINC000819240049	CC	On-Demand	Anodyne	PRCP	15	42
O=C(O)[C@@H]1CCCN1C(=O)c1nc(=O)c2ccccc2[nH]1	ZINC000819240049	CC	On-Demand	Anodyne	PREP	73	41
O=C(O)[C@H]1CCCN1C(=O)c1nc(=O)c2ccccc2[nH]1	ZINC000819240050	CC	On-Demand	Anodyne	ACE	50	40
O=C(O)[C@H]1CCCN1C(=O)c1nc(=O)c2ccccc2[nH]1	ZINC000819240050	CC	On-Demand	Anodyne	PRCP	15	42
O=C(O)[C@H]1CCCN1C(=O)c1nc(=O)c2ccccc2[nH]1	ZINC000819240050	CC	On-Demand	Anodyne	PREP	73	41
O=C(O)[C@H]1CCCN1Cc1ccc(-n2ccnc2)nc1	ZINC000819240051	CD	On-Demand	Anodyne	NOS2	76	40
O=C(O)[C@@H]1CCCN1Cc1ccc(-n2ccnc2)nc1	ZINC000819240052	CD	On-Demand	Anodyne	NOS2	76	40
O=C(O)[C@H]1CCCN1C[C@H](O)c1cccc(Cl)c1	ZINC000819240053	CD	On-Demand	Anodyne	ADRB1	26	40
O=C(O)[C@H]1CCCN1C[C@H](O)c1cccc(Cl)c1	ZINC000819240053	CD	On-Demand	Anodyne	ADRB3	41	42
O=C(O)[C@H]1CCCN1C[C@H](O)c1cccc(Cl)c1	ZINC000819240053	CD	On-Demand	Anodyne	CYP3A4	44	33
O=C(O)[C@@H]1CCCN1C[C@@H](O)c1cccc(Cl)c1	ZINC000819240054	CD	On-Demand	Anodyne	ADRB1	26	40
O=C(O)[C@@H]1CCCN1C[C@@H](O)c1cccc(Cl)c1	ZINC000819240054	CD	On-Demand	Anodyne	ADRB3	41	42
O=C(O)[C@@H]1CCCN1C[C@@H](O)c1cccc(Cl)c1	ZINC000819240054	CD	On-Demand	Anodyne	CYP3A4	44	33
O=C(O)[C@@H]1CCCN1C[C@H](O)c1cccc(Cl)c1	ZINC000819240055	CD	On-Demand	Anodyne	ADRB1	26	40
O=C(O)[C@@H]1CCCN1C[C@H](O)c1cccc(Cl)c1	ZINC000819240055	CD	On-Demand	Anodyne	ADRB3	41	42
O=C(O)[C@@H]1CCCN1C[C@H](O)c1cccc(Cl)c1	ZINC000819240055	CD	On-Demand	Anodyne	CYP3A4	44	33
O=C(O)[C@H]1CCCN1C[C@@H](O)c1cccc(Cl)c1	ZINC000819240056	CD	On-Demand	Anodyne	ADRB1	26	40
O=C(O)[C@H]1CCCN1C[C@@H](O)c1cccc(Cl)c1	ZINC000819240056	CD	On-Demand	Anodyne	ADRB3	41	42
O=C(O)[C@H]1CCCN1C[C@@H](O)c1cccc(Cl)c1	ZINC000819240056	CD	On-Demand	Anodyne	CYP3A4	44	33
O=C(O)[C@@H]1CCCN1Cc1nc2cc(C(F)(F)F)ccc2o1	ZINC000819240057	DF	On-Demand	Anodyne	LIPG	52	38
O=C(O)[C@H]1CCCN1Cc1nc2cc(C(F)(F)F)ccc2o1	ZINC000819240058	DF	On-Demand	Anodyne	LIPG	52	38
O=C(O)[C@H]1CCCN1C(=O)c1nc(NCc2ccco2)ncc1Cl	ZINC000819240059	FE	On-Demand	Anodyne	PREP	67	35
O=C(O)[C@@H]1CCCN1C(=O)c1nc(NCc2ccco2)ncc1Cl	ZINC000819240060	FE	On-Demand	Anodyne	PREP	67	35
O=C(O)[C@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000819240065	CE	On-Demand	Anodyne	ACE	41	36
O=C(O)[C@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000819240065	CE	On-Demand	Anodyne	SLC6A1	77	43
O=C(O)[C@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000819240065	CE	On-Demand	Anodyne	HRH3	46	43
O=C(O)[C@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000819240065	CE	On-Demand	Anodyne	ABCC1	94	35
O=C(O)[C@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000819240065	CE	On-Demand	Anodyne	PREP	51	37
O=C(O)[C@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000819240065	CE	On-Demand	Anodyne	ABCB1A	47	34
O=C(O)[C@@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000819240066	CE	On-Demand	Anodyne	ACE	41	36
O=C(O)[C@@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000819240066	CE	On-Demand	Anodyne	SLC6A1	77	43
O=C(O)[C@@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000819240066	CE	On-Demand	Anodyne	HRH3	46	43
O=C(O)[C@@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000819240066	CE	On-Demand	Anodyne	ABCC1	94	35
O=C(O)[C@@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000819240066	CE	On-Demand	Anodyne	PREP	51	37
O=C(O)[C@@H]1CCCN1CCc1ccc(F)c(F)c1	ZINC000819240066	CE	On-Demand	Anodyne	ABCB1A	47	34
O=C(O)[C@@H]1CCCN1C(=O)c1oc2ccccc2c1CSc1ncccn1	ZINC000819240069	GG	On-Demand	Anodyne	PREP	58	36
O=C(O)[C@H]1CCCN1C(=O)c1oc2ccccc2c1CSc1ncccn1	ZINC000819240070	GG	On-Demand	Anodyne	PREP	58	36
O=C(O)[C@H]1CCCN1CCCCCCCO	ZINC000819240071	BD	On-Demand	Anodyne	ACE	15	40
O=C(O)[C@@H]1CCCN1CCCCCCCO	ZINC000819240072	BD	On-Demand	Anodyne	ACE	15	40
C#Cc1cccc(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819240078	FG	On-Demand	Mild	PAPA1_CARPA	51	42
O=C(O)[C@H]1CCCN1CC#Cc1ccc(Cl)cc1	ZINC000819240080	CE	On-Demand	Mild	ACE	24	42
O=C(O)[C@@H]1CCCN1CC#Cc1ccc(Cl)cc1	ZINC000819240081	CE	On-Demand	Mild	ACE	24	42
C#Cc1cccc(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819240082	FG	On-Demand	Mild	PAPA1_CARPA	51	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240087	FD	On-Demand	Anodyne	ADRB1	26	40
CCOC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240087	FD	On-Demand	Anodyne	GRIN2B	16	44
CCOC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240087	FD	On-Demand	Anodyne	ADRB3	25	46
CCOC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240087	FD	On-Demand	Anodyne	MMP13	20	42
CCOC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240087	FD	On-Demand	Anodyne	MMP3	20	43
CCOC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240087	FD	On-Demand	Anodyne	MMP9	17	43
CCOC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240087	FD	On-Demand	Anodyne	ADAM9	27	43
CCOC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240087	FD	On-Demand	Anodyne	MMP7	15	41
CCOC(=O)N1CC[C@@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240087	FD	On-Demand	Anodyne	MMP1	16	43
CCOC(=O)N1CC[C@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240088	FD	On-Demand	Anodyne	ADRB1	26	40
CCOC(=O)N1CC[C@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240088	FD	On-Demand	Anodyne	GRIN2B	16	44
CCOC(=O)N1CC[C@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240088	FD	On-Demand	Anodyne	ADRB3	25	46
CCOC(=O)N1CC[C@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240088	FD	On-Demand	Anodyne	MMP13	20	42
CCOC(=O)N1CC[C@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240088	FD	On-Demand	Anodyne	MMP3	20	43
CCOC(=O)N1CC[C@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240088	FD	On-Demand	Anodyne	MMP9	17	43
CCOC(=O)N1CC[C@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240088	FD	On-Demand	Anodyne	ADAM9	27	43
CCOC(=O)N1CC[C@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240088	FD	On-Demand	Anodyne	MMP7	15	41
CCOC(=O)N1CC[C@H](NC[C@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240088	FD	On-Demand	Anodyne	MMP1	16	43
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240089	FD	On-Demand	Anodyne	ADRB1	26	40
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240089	FD	On-Demand	Anodyne	GRIN2B	16	44
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240089	FD	On-Demand	Anodyne	ADRB3	25	46
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240089	FD	On-Demand	Anodyne	MMP13	20	42
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240089	FD	On-Demand	Anodyne	MMP3	20	43
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240089	FD	On-Demand	Anodyne	MMP9	17	43
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240089	FD	On-Demand	Anodyne	ADAM9	27	43
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240089	FD	On-Demand	Anodyne	MMP7	15	41
CCOC(=O)N1CC[C@@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240089	FD	On-Demand	Anodyne	MMP1	16	43
CCOC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240090	FD	On-Demand	Anodyne	ADRB1	26	40
CCOC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240090	FD	On-Demand	Anodyne	GRIN2B	16	44
CCOC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240090	FD	On-Demand	Anodyne	ADRB3	25	46
CCOC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240090	FD	On-Demand	Anodyne	MMP13	20	42
CCOC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240090	FD	On-Demand	Anodyne	MMP3	20	43
CCOC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240090	FD	On-Demand	Anodyne	MMP9	17	43
CCOC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240090	FD	On-Demand	Anodyne	ADAM9	27	43
CCOC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240090	FD	On-Demand	Anodyne	MMP7	15	41
CCOC(=O)N1CC[C@H](NC[C@@H](O)COCc2ccc(OC)cc2)C1	ZINC000819240090	FD	On-Demand	Anodyne	MMP1	16	43
CCCCCCCCOCC(=O)N1CCC[C@H](CO)CC1	ZINC000819240117	CF	On-Demand	Mild	UGCG	18	41
CCCCCCCCOCC(=O)N1CCC[C@H](CO)CC1	ZINC000819240117	CF	On-Demand	Mild	GBA2	41	41
CCCCCCCCOCC(=O)N1CCC[C@@H](CO)CC1	ZINC000819240118	CF	On-Demand	Mild	UGCG	18	41
CCCCCCCCOCC(=O)N1CCC[C@@H](CO)CC1	ZINC000819240118	CF	On-Demand	Mild	GBA2	41	41
O=C(N1CCC[C@H](CO)CC1)C1(S(=O)(=O)c2ccccc2)CC1	ZINC000819240121	ED	On-Demand	Anodyne	MMP13	26	41
O=C(N1CCC[C@H](CO)CC1)C1(S(=O)(=O)c2ccccc2)CC1	ZINC000819240121	ED	On-Demand	Anodyne	SFRP1	44	33
O=C(N1CCC[C@H](CO)CC1)C1(S(=O)(=O)c2ccccc2)CC1	ZINC000819240121	ED	On-Demand	Anodyne	WNT3	40	32
O=C(N1CCC[C@@H](CO)CC1)C1(S(=O)(=O)c2ccccc2)CC1	ZINC000819240122	ED	On-Demand	Anodyne	MMP13	26	41
O=C(N1CCC[C@@H](CO)CC1)C1(S(=O)(=O)c2ccccc2)CC1	ZINC000819240122	ED	On-Demand	Anodyne	SFRP1	44	33
O=C(N1CCC[C@@H](CO)CC1)C1(S(=O)(=O)c2ccccc2)CC1	ZINC000819240122	ED	On-Demand	Anodyne	WNT3	40	32
CC[C@@H](C)c1ccc(C(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819240129	CG	On-Demand	Anodyne	L3MBTL3	93	45
CC[C@H](C)c1ccc(C(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819240130	CG	On-Demand	Anodyne	L3MBTL3	93	45
CC[C@@H](C)c1ccc(C(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819240131	CG	On-Demand	Anodyne	L3MBTL3	93	45
CC[C@H](C)c1ccc(C(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819240132	CG	On-Demand	Anodyne	L3MBTL3	93	45
O=C(c1cc(O)c2ccsc2c1)N1CCC[C@@H](CO)CC1	ZINC000819240137	DF	On-Demand	Anodyne	L3MBTL3	70	36
O=C(c1cc(O)c2ccsc2c1)N1CCC[C@H](CO)CC1	ZINC000819240138	DF	On-Demand	Anodyne	L3MBTL3	70	36
O=C([C@H]1CCc2c(Cl)cccc21)N1CCC[C@@H](CO)CC1	ZINC000819240141	DF	On-Demand	Anodyne	PREP	40	38
O=C([C@H]1CCc2c(Cl)cccc21)N1CCC[C@@H](CO)CC1	ZINC000819240141	DF	On-Demand	Anodyne	L3MBTL3	50	38
O=C([C@@H]1CCc2c(Cl)cccc21)N1CCC[C@@H](CO)CC1	ZINC000819240142	DF	On-Demand	Anodyne	PREP	40	38
O=C([C@@H]1CCc2c(Cl)cccc21)N1CCC[C@@H](CO)CC1	ZINC000819240142	DF	On-Demand	Anodyne	L3MBTL3	50	38
O=C([C@@H]1CCc2c(Cl)cccc21)N1CCC[C@H](CO)CC1	ZINC000819240143	DF	On-Demand	Anodyne	PREP	40	38
O=C([C@@H]1CCc2c(Cl)cccc21)N1CCC[C@H](CO)CC1	ZINC000819240143	DF	On-Demand	Anodyne	L3MBTL3	50	38
O=C([C@H]1CCc2c(Cl)cccc21)N1CCC[C@H](CO)CC1	ZINC000819240144	DF	On-Demand	Anodyne	PREP	40	38
O=C([C@H]1CCc2c(Cl)cccc21)N1CCC[C@H](CO)CC1	ZINC000819240144	DF	On-Demand	Anodyne	L3MBTL3	50	38
O=C(c1ccnc(-c2ncc[nH]2)c1)N1CCC[C@@H](CO)CC1	ZINC000819240149	DD	On-Demand	Anodyne	L3MBTL3	62	38
O=C(c1ccnc(-c2ncc[nH]2)c1)N1CCC[C@H](CO)CC1	ZINC000819240150	DD	On-Demand	Anodyne	L3MBTL3	62	38
O=C(c1cc2occc2[nH]1)N1CCC[C@H](CO)CC1	ZINC000819240151	CD	On-Demand	Anodyne	GRIN2B	39	43
O=C(c1cc2occc2[nH]1)N1CCC[C@H](CO)CC1	ZINC000819240151	CD	On-Demand	Anodyne	AKR1C3	21	49
O=C(c1cc2occc2[nH]1)N1CCC[C@@H](CO)CC1	ZINC000819240152	CD	On-Demand	Anodyne	GRIN2B	39	43
O=C(c1cc2occc2[nH]1)N1CCC[C@@H](CO)CC1	ZINC000819240152	CD	On-Demand	Anodyne	AKR1C3	21	49
O=C(/C=C\c1cc(C(F)(F)F)ccc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819240163	FH	On-Demand	Anodyne	ITGAL	95	38
O=C(/C=C/c1cc(C(F)(F)F)ccc1Cl)N1CCC[C@@H](CO)CC1	ZINC000819240166	FH	On-Demand	Anodyne	ITGAL	95	38
O=C(/C=C\c1cc(C(F)(F)F)ccc1Cl)N1CCC[C@H](CO)CC1	ZINC000819240168	FH	On-Demand	Anodyne	ITGAL	95	38
O=C(/C=C/c1cc(C(F)(F)F)ccc1Cl)N1CCC[C@H](CO)CC1	ZINC000819240171	FH	On-Demand	Anodyne	ITGAL	95	38
CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N1CCC[C@H](CO)CC1	ZINC000819240215	EC	On-Demand	Anodyne	F2	15	42
CC(C)(C)OC(=O)N[C@H](CC(N)=O)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819240220	EC	On-Demand	Anodyne	F2	15	42
O=C(c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1)N1CCC[C@H](CO)CC1	ZINC000819240236	IF	On-Demand	Bother	L3MBTL3	57	37
N#Cc1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819240237	CC	On-Demand	Mild	ADRB2	19	42
N#Cc1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819240237	CC	On-Demand	Mild	ADRB1	36	45
N#Cc1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819240238	CC	On-Demand	Mild	ADRB2	19	42
N#Cc1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819240238	CC	On-Demand	Mild	ADRB1	36	45
O=C(c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819240239	IF	On-Demand	Bother	L3MBTL3	57	37
O=C(COCc1nc2ccccc2s1)N1CCC[C@@H](CO)CC1	ZINC000819240244	EE	On-Demand	Anodyne	LTA4H	24	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(Oc2ccc(C#N)cc2)CC1	ZINC000819240245	GF	On-Demand	Mild	EPHX2	18	44
O=C(COCc1nc2ccccc2s1)N1CCC[C@H](CO)CC1	ZINC000819240246	EE	On-Demand	Anodyne	LTA4H	24	43
O[C@H](CNOC1CCOCC1)COc1ccc(F)cc1	ZINC000819240257	CD	On-Demand	Anodyne	ADRB2	28	41
O[C@H](CNOC1CCOCC1)COc1ccc(F)cc1	ZINC000819240257	CD	On-Demand	Anodyne	ADRB1	44	44
O[C@@H](CNOC1CCOCC1)COc1ccc(F)cc1	ZINC000819240258	CD	On-Demand	Anodyne	ADRB2	28	41
O[C@@H](CNOC1CCOCC1)COc1ccc(F)cc1	ZINC000819240258	CD	On-Demand	Anodyne	ADRB1	44	44
COCCSc1ccc([C@@H](C)NC(=O)C(F)=C2CCC2)cc1	ZINC000819240267	DI	On-Demand	Anodyne	ACACA	17	41
COCCSc1ccc([C@H](C)NC(=O)C(F)=C2CCC2)cc1	ZINC000819240268	DI	On-Demand	Anodyne	ACACA	17	41
N#Cc1ccc(OC2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819240275	DG	On-Demand	Mild	HRH3	19	44
COCCc1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819240278	ED	On-Demand	Anodyne	ADRB2	37	61
COCCc1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819240278	ED	On-Demand	Anodyne	ADRB1	64	61
COCCc1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819240278	ED	On-Demand	Anodyne	ADRB3	39	42
COCCc1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819240279	ED	On-Demand	Anodyne	ADRB2	37	61
COCCc1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819240279	ED	On-Demand	Anodyne	ADRB1	64	61
COCCc1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819240279	ED	On-Demand	Anodyne	ADRB3	39	42
O[C@H](CNOC1CCOCC1)c1cccc(Cl)c1	ZINC000819240286	CE	On-Demand	Anodyne	ADRB1	37	45
O[C@H](CNOC1CCOCC1)c1cccc(Cl)c1	ZINC000819240286	CE	On-Demand	Anodyne	ADRB3	48	45
O[C@H](CNOC1CCOCC1)c1cccc(Cl)c1	ZINC000819240286	CE	On-Demand	Anodyne	CYP3A4	49	37
O[C@@H](CNOC1CCOCC1)c1cccc(Cl)c1	ZINC000819240287	CE	On-Demand	Anodyne	ADRB1	37	45
O[C@@H](CNOC1CCOCC1)c1cccc(Cl)c1	ZINC000819240287	CE	On-Demand	Anodyne	ADRB3	48	45
O[C@@H](CNOC1CCOCC1)c1cccc(Cl)c1	ZINC000819240287	CE	On-Demand	Anodyne	CYP3A4	49	37
CC(C)c1cccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819240403	DH	On-Demand	Bother	CACNA1C	54	39
CC(C)c1cccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819240403	DH	On-Demand	Bother	CACNA1D	84	39
CC(C)c1cccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819240404	DH	On-Demand	Bother	CACNA1C	54	39
CC(C)c1cccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819240404	DH	On-Demand	Bother	CACNA1D	84	39
CCOc1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819240410	FF	On-Demand	Anodyne	ADRB2	53	54
CCOc1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819240410	FF	On-Demand	Anodyne	ADRB1	71	54
CCOc1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819240410	FF	On-Demand	Anodyne	ADRB3	45	47
CCOc1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819240411	FF	On-Demand	Anodyne	ADRB2	53	54
CCOc1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819240411	FF	On-Demand	Anodyne	ADRB1	71	54
CCOc1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819240411	FF	On-Demand	Anodyne	ADRB3	45	47
CC(C)c1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819240417	CH	On-Demand	Anodyne	ADRB2	51	38
CC(C)c1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819240417	CH	On-Demand	Anodyne	ADRB1	51	40
CC(C)c1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819240417	CH	On-Demand	Anodyne	ADRB3	60	41
CC(C)c1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819240417	CH	On-Demand	Anodyne	BACE1	15	43
CC(C)c1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819240417	CH	On-Demand	Anodyne	AOC3	15	45
CC(C)c1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819240420	CH	On-Demand	Anodyne	ADRB2	51	38
CC(C)c1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819240420	CH	On-Demand	Anodyne	ADRB1	51	40
CC(C)c1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819240420	CH	On-Demand	Anodyne	ADRB3	60	41
CC(C)c1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819240420	CH	On-Demand	Anodyne	BACE1	15	43
CC(C)c1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819240420	CH	On-Demand	Anodyne	AOC3	15	45
C[C@@H](CC(=O)N1CCC[C@H](CO)CC1)C(=O)c1ccccc1	ZINC000819240421	DF	On-Demand	Anodyne	ACE	34	41
C[C@@H](CC(=O)N1CCC[C@H](CO)CC1)C(=O)c1ccccc1	ZINC000819240421	DF	On-Demand	Anodyne	PREP	41	36
COc1cccc([S@@](=O)CC(=O)N2CCCN(CC(N)=O)CC2)c1	ZINC000819240425	FB	On-Demand	Anodyne	DRD4	41	32
COc1cccc([S@](=O)CC(=O)N2CCCN(CC(N)=O)CC2)c1	ZINC000819240430	FB	On-Demand	Anodyne	DRD4	41	32
C/C(=C/C(=O)N1CCC[C@H](CO)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000819240431	DF	On-Demand	Bother	SLC27A4	49	31
C/C(=C/C(=O)N1CCC[C@@H](CO)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000819240432	DF	On-Demand	Bother	SLC27A4	49	31
O=C(c1ccc(-n2cccn2)nc1)N1CCC[C@@H](CO)CC1	ZINC000819240439	DD	On-Demand	Anodyne	L3MBTL3	66	41
O=C(c1ccc(-n2cccn2)nc1)N1CCC[C@H](CO)CC1	ZINC000819240440	DD	On-Demand	Anodyne	L3MBTL3	66	41
O=C(c1cc([N+](=O)[O-])c2nsnc2c1)N1CCC[C@@H](CO)CC1	ZINC000819240441	ED	On-Demand	Bother	L3MBTL3	29	40
O=C(c1cc([N+](=O)[O-])c2nsnc2c1)N1CCC[C@H](CO)CC1	ZINC000819240442	ED	On-Demand	Bother	L3MBTL3	29	40
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCc3ccccc32)c1)N1CCC[C@H](CO)CC1	ZINC000819240443	IG	On-Demand	Anodyne	L3MBTL3	52	35
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCc3ccccc32)c1)N1CCC[C@@H](CO)CC1	ZINC000819240445	IG	On-Demand	Anodyne	L3MBTL3	52	35
O=C(c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1)N1CCC[C@H](CO)CC1	ZINC000819240449	GE	On-Demand	Anodyne	L3MBTL3	55	36
O=C(c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1)N1CCC[C@H](CO)CC1	ZINC000819240449	GE	On-Demand	Anodyne	HPGD	46	41
O=C(c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1)N1CCC[C@@H](CO)CC1	ZINC000819240450	GE	On-Demand	Anodyne	L3MBTL3	55	36
O=C(c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1)N1CCC[C@@H](CO)CC1	ZINC000819240450	GE	On-Demand	Anodyne	HPGD	46	41
O=C(CCc1cncc2ccccc12)N1CCC[C@H](CO)CC1	ZINC000819240466	DF	On-Demand	Anodyne	PREP	34	41
O=C(CCc1cncc2ccccc12)N1CCC[C@@H](CO)CC1	ZINC000819240468	DF	On-Demand	Anodyne	PREP	34	41
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCN(CC(=O)OC)CC2)cc1	ZINC000819240510	FF	On-Demand	Mild	PRNP	40	39
O[C@H](CNOC1CCOCC1)COc1cccc(Br)c1	ZINC000819240516	ED	On-Demand	Anodyne	ADRB2	19	42
O[C@H](CNOC1CCOCC1)COc1cccc(Br)c1	ZINC000819240516	ED	On-Demand	Anodyne	ADRB1	29	42
O[C@@H](CNOC1CCOCC1)COc1cccc(Br)c1	ZINC000819240519	ED	On-Demand	Anodyne	ADRB2	19	42
O[C@@H](CNOC1CCOCC1)COc1cccc(Br)c1	ZINC000819240519	ED	On-Demand	Anodyne	ADRB1	29	42
O[C@H](CNOC1CCOCC1)c1ccc(Cl)c(F)c1	ZINC000819240528	CE	On-Demand	Anodyne	MAPK1	46	40
O[C@@H](CNOC1CCOCC1)c1ccc(Cl)c(F)c1	ZINC000819240530	CE	On-Demand	Anodyne	MAPK1	46	40
O=C(CCCc1ccsc1)N1CCC[C@@H](CO)CC1	ZINC000819240536	CF	On-Demand	Anodyne	PREP	46	41
O=C(CCCc1ccsc1)N1CCC[C@H](CO)CC1	ZINC000819240538	CF	On-Demand	Anodyne	PREP	46	41
CS(=O)(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819240560	ED	On-Demand	Anodyne	GRIN2B	23	46
CS(=O)(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819240560	ED	On-Demand	Anodyne	PREP	28	40
CS(=O)(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819240560	ED	On-Demand	Anodyne	ST14	70	33
CS(=O)(=O)Nc1cccc(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819240560	ED	On-Demand	Anodyne	L3MBTL3	77	43
CS(=O)(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819240563	ED	On-Demand	Anodyne	GRIN2B	23	46
CS(=O)(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819240563	ED	On-Demand	Anodyne	PREP	28	40
CS(=O)(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819240563	ED	On-Demand	Anodyne	ST14	70	33
CS(=O)(=O)Nc1cccc(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819240563	ED	On-Demand	Anodyne	L3MBTL3	77	43
COC(=O)c1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819240565	EC	On-Demand	Anodyne	ADRB2	36	47
COC(=O)c1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819240565	EC	On-Demand	Anodyne	ADRB1	57	43
COC(=O)c1ccc(OC[C@H](O)CNOC2CCOCC2)cc1	ZINC000819240565	EC	On-Demand	Anodyne	ADRB3	33	41
O=C(c1ccc(Cl)c(N2CCCC2=O)c1)N1CCC[C@@H](CO)CC1	ZINC000819240566	FF	On-Demand	Anodyne	L3MBTL3	61	37
COC(=O)c1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819240567	EC	On-Demand	Anodyne	ADRB2	36	47
COC(=O)c1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819240567	EC	On-Demand	Anodyne	ADRB1	57	43
COC(=O)c1ccc(OC[C@@H](O)CNOC2CCOCC2)cc1	ZINC000819240567	EC	On-Demand	Anodyne	ADRB3	33	41
O=C(c1ccc(Cl)c(N2CCCC2=O)c1)N1CCC[C@H](CO)CC1	ZINC000819240568	FF	On-Demand	Anodyne	L3MBTL3	61	37
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CCC[C@@H](CO)CC1	ZINC000819240570	IG	On-Demand	Anodyne	CELA1	21	50
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CCC[C@@H](CO)CC1	ZINC000819240570	IG	On-Demand	Anodyne	PREP	104	64
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CCC[C@@H](CO)CC1	ZINC000819240570	IG	On-Demand	Anodyne	LGMN	84	52
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CCC[C@@H](CO)CC1	ZINC000819240570	IG	On-Demand	Anodyne	KLK5	22	41
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CCC[C@H](CO)CC1	ZINC000819240573	IG	On-Demand	Anodyne	CELA1	21	50
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CCC[C@H](CO)CC1	ZINC000819240573	IG	On-Demand	Anodyne	PREP	104	64
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CCC[C@H](CO)CC1	ZINC000819240573	IG	On-Demand	Anodyne	LGMN	84	52
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CCC[C@H](CO)CC1	ZINC000819240573	IG	On-Demand	Anodyne	KLK5	22	41
O[C@H](CNOC1CCOCC1)COc1cccc2[nH]ccc12	ZINC000819240592	DD	On-Demand	Anodyne	ADRB2	21	65
O[C@H](CNOC1CCOCC1)COc1cccc2[nH]ccc12	ZINC000819240592	DD	On-Demand	Anodyne	ADRB1	31	65
O[C@H](CNOC1CCOCC1)COc1cccc2[nH]ccc12	ZINC000819240592	DD	On-Demand	Anodyne	HTR1A	16	65
O[C@H](CNOC1CCOCC1)COc1cccc2[nH]ccc12	ZINC000819240592	DD	On-Demand	Anodyne	SLC6A4	19	45
O=C([C@H]1CCCN1Cc1ccccn1)N1CCC[C@H](CO)CC1	ZINC000819240593	DD	On-Demand	Anodyne	PREP	67	40
O[C@@H](CNOC1CCOCC1)COc1cccc2[nH]ccc12	ZINC000819240594	DD	On-Demand	Anodyne	ADRB2	21	65
O[C@@H](CNOC1CCOCC1)COc1cccc2[nH]ccc12	ZINC000819240594	DD	On-Demand	Anodyne	ADRB1	31	65
O[C@@H](CNOC1CCOCC1)COc1cccc2[nH]ccc12	ZINC000819240594	DD	On-Demand	Anodyne	HTR1A	16	65
O[C@@H](CNOC1CCOCC1)COc1cccc2[nH]ccc12	ZINC000819240594	DD	On-Demand	Anodyne	SLC6A4	19	45
O=C([C@H]1CCCN1Cc1ccccn1)N1CCC[C@@H](CO)CC1	ZINC000819240595	DD	On-Demand	Anodyne	PREP	67	40
O=C([C@@H]1CCCN1Cc1ccccn1)N1CCC[C@H](CO)CC1	ZINC000819240598	DD	On-Demand	Anodyne	PREP	67	40
O=C([C@@H]1CCCN1Cc1ccccn1)N1CCC[C@@H](CO)CC1	ZINC000819240599	DD	On-Demand	Anodyne	PREP	67	40
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCC[C@H](CO)CC2)(S(C)(=O)=O)CC1	ZINC000819240600	HD	On-Demand	Anodyne	GPR119	38	42
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCC[C@@H](CO)CC2)(S(C)(=O)=O)CC1	ZINC000819240601	HD	On-Demand	Anodyne	GPR119	38	42
CC(=O)c1cccc(OC[C@@H](O)CNOC2CCOCC2)c1	ZINC000819240605	DD	On-Demand	Anodyne	ADRB2	27	46
CC(=O)c1cccc(OC[C@@H](O)CNOC2CCOCC2)c1	ZINC000819240605	DD	On-Demand	Anodyne	ADRB1	44	41
CC(=O)c1cccc(OC[C@@H](O)CNOC2CCOCC2)c1	ZINC000819240605	DD	On-Demand	Anodyne	ABCB1	20	47
CC(=O)c1cccc(OC[C@H](O)CNOC2CCOCC2)c1	ZINC000819240608	DD	On-Demand	Anodyne	ADRB2	27	46
CC(=O)c1cccc(OC[C@H](O)CNOC2CCOCC2)c1	ZINC000819240608	DD	On-Demand	Anodyne	ADRB1	44	41
CC(=O)c1cccc(OC[C@H](O)CNOC2CCOCC2)c1	ZINC000819240608	DD	On-Demand	Anodyne	ABCB1	20	47
O[C@H](CNOC1CCOCC1)COc1ccc(Br)cc1	ZINC000819240614	ED	On-Demand	Anodyne	ADRB2	22	41
O[C@H](CNOC1CCOCC1)COc1ccc(Br)cc1	ZINC000819240614	ED	On-Demand	Anodyne	ADRB1	37	44
O[C@@H](CNOC1CCOCC1)COc1ccc(Br)cc1	ZINC000819240616	ED	On-Demand	Anodyne	ADRB2	22	41
O[C@@H](CNOC1CCOCC1)COc1ccc(Br)cc1	ZINC000819240616	ED	On-Demand	Anodyne	ADRB1	37	44
CSc1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819240638	FG	On-Demand	Anodyne	ADRB2	38	47
CSc1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819240638	FG	On-Demand	Anodyne	ADRB1	56	47
CSc1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819240638	FG	On-Demand	Anodyne	ADRB3	36	43
CSc1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819240642	FG	On-Demand	Anodyne	ADRB2	38	47
CSc1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819240642	FG	On-Demand	Anodyne	ADRB1	56	47
CSc1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819240642	FG	On-Demand	Anodyne	ADRB3	36	43
CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc2C1	ZINC000819240671	GG	On-Demand	Mild	PAPA1_CARPA	38	42
CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc2C1	ZINC000819240672	GG	On-Demand	Mild	PAPA1_CARPA	38	42
C[C@@H](OC[C@H](O)CNCc1ccc(C(C)(C)O)cc1)c1ccc(Cl)cc1	ZINC000819240689	GH	On-Demand	Anodyne	CASR	23	42
C[C@@H](OC[C@@H](O)CNCc1ccc(C(C)(C)O)cc1)c1ccc(Cl)cc1	ZINC000819240698	GH	On-Demand	Anodyne	CASR	23	42
O=C(CCc1ccccc1F)N1CCC[C@@H](CO)CC1	ZINC000819240710	CE	On-Demand	Anodyne	C3AR1	37	43
O=C(CCc1ccccc1F)N1CCC[C@H](CO)CC1	ZINC000819240711	CE	On-Demand	Anodyne	C3AR1	37	43
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	F2	76	54
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	PLG	59	46
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	PRSS1	20	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	ACE	81	50
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	OPRM1	50	43
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	OPRD1	37	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	GHRHR	59	34
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	P2RY12	117	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CELA1	33	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	GRIN2B	42	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	ELANE	26	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	MME	74	43
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	TACR1	23	53
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	TRHR	25	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	PGC	61	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	MC4R	87	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CMA1	37	43
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CTRA_BOVIN	74	45
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	KLK3	83	39
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CTSB	78	50
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	TRY2_BOVIN	82	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	PAPA1_CARPA	71	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	TRY1_BOVIN	67	46
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CYSP_TRYCR	71	52
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	NTSR1	43	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CTSG	54	45
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CTSK	57	52
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CTSL	62	52
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CACNA1B	49	49
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CCR1	17	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	NPFFR2	67	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CYP51A1	22	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	PREP	50	50
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	MC5R	49	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CAPNS1	93	45
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	ECE1	19	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CELA2A	65	45
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	REN	121	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	LGMN	52	38
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	MMP11	69	33
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CCKBR	17	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CTSS	46	52
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CAPN1	122	49
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CASP1	24	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CAPN2	150	50
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CTSE	56	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	ACE2	68	39
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	PLAU	23	46
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	TGM2	46	52
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	PGA5	41	31
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	KLK5	41	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	TPSAB1	43	37
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	ST14	97	38
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	KLK1	26	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	FPR1	37	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	NPR	64	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	AMP1_PLAFQ	18	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	CALCRL	27	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	BRCA1	61	33
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	NPFFR1	55	32
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	Q9NAW4_PLAFA	35	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@@H](CO)CC1)OCc1ccccc1	ZINC000819240727	HG	On-Demand	Anodyne	TMPRSS6	46	33
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	F2	76	54
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	PLG	59	46
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	PRSS1	20	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	ACE	81	50
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	OPRM1	50	43
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	OPRD1	37	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	GHRHR	59	34
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	P2RY12	117	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CELA1	33	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	GRIN2B	42	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	ELANE	26	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	MME	74	43
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	TACR1	23	53
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	TRHR	25	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	PGC	61	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	MC4R	87	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CMA1	37	43
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CTRA_BOVIN	74	45
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	KLK3	83	39
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CTSB	78	50
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	TRY2_BOVIN	82	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	PAPA1_CARPA	71	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	TRY1_BOVIN	67	46
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CYSP_TRYCR	71	52
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	NTSR1	43	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CTSG	54	45
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CTSK	57	52
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CTSL	62	52
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CACNA1B	49	49
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CCR1	17	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	NPFFR2	67	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CYP51A1	22	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	PREP	50	50
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	MC5R	49	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CAPNS1	93	45
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	ECE1	19	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CELA2A	65	45
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	REN	121	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	LGMN	52	38
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	MMP11	69	33
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CCKBR	17	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CTSS	46	52
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CAPN1	122	49
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CASP1	24	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CAPN2	150	50
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CTSE	56	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	ACE2	68	39
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	PLAU	23	46
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	TGM2	46	52
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	PGA5	41	31
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	KLK5	41	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	TPSAB1	43	37
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	ST14	97	38
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	KLK1	26	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	FPR1	37	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	NPR	64	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	AMP1_PLAFQ	18	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	CALCRL	27	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	BRCA1	61	33
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	NPFFR1	55	32
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	Q9NAW4_PLAFA	35	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H](CO)CC1)OCc1ccccc1	ZINC000819240729	HG	On-Demand	Anodyne	TMPRSS6	46	33
O=C(c1ccc(Oc2ccccc2Cl)cc1)N1CCC[C@H](CO)CC1	ZINC000819240730	FI	On-Demand	Anodyne	LTA4H	19	44
O=C(c1ccc(Oc2ccccc2Cl)cc1)N1CCC[C@H](CO)CC1	ZINC000819240730	FI	On-Demand	Anodyne	HRH3	28	42
O=C(c1ccc(Oc2ccccc2Cl)cc1)N1CCC[C@H](CO)CC1	ZINC000819240730	FI	On-Demand	Anodyne	CCR8	20	45
O=C(c1ccc(Oc2ccccc2Cl)cc1)N1CCC[C@H](CO)CC1	ZINC000819240730	FI	On-Demand	Anodyne	L3MBTL3	90	45
O=C(c1ccc(Oc2ccccc2Cl)cc1)N1CCC[C@@H](CO)CC1	ZINC000819240733	FI	On-Demand	Anodyne	LTA4H	19	44
O=C(c1ccc(Oc2ccccc2Cl)cc1)N1CCC[C@@H](CO)CC1	ZINC000819240733	FI	On-Demand	Anodyne	HRH3	28	42
O=C(c1ccc(Oc2ccccc2Cl)cc1)N1CCC[C@@H](CO)CC1	ZINC000819240733	FI	On-Demand	Anodyne	CCR8	20	45
O=C(c1ccc(Oc2ccccc2Cl)cc1)N1CCC[C@@H](CO)CC1	ZINC000819240733	FI	On-Demand	Anodyne	L3MBTL3	90	45
CC(C)(C)NS(=O)(=O)c1ccc(Br)c(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819240734	IF	On-Demand	Anodyne	SFRP1	86	35
CC(C)(C)NS(=O)(=O)c1ccc(Br)c(C(=O)N2CCC[C@@H](CO)CC2)c1	ZINC000819240734	IF	On-Demand	Anodyne	WNT3	64	33
CC(C)(C)NS(=O)(=O)c1ccc(Br)c(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819240736	IF	On-Demand	Anodyne	SFRP1	86	35
CC(C)(C)NS(=O)(=O)c1ccc(Br)c(C(=O)N2CCC[C@H](CO)CC2)c1	ZINC000819240736	IF	On-Demand	Anodyne	WNT3	64	33
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)N3CCC[C@H](CO)CC3)cc2C1	ZINC000819240746	FG	On-Demand	Anodyne	GPR119	35	41
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)N3CCC[C@H](CO)CC3)cc2C1	ZINC000819240746	FG	On-Demand	Anodyne	L3MBTL3	73	38
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)N3CCC[C@@H](CO)CC3)cc2C1	ZINC000819240747	FG	On-Demand	Anodyne	GPR119	35	41
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)N3CCC[C@@H](CO)CC3)cc2C1	ZINC000819240747	FG	On-Demand	Anodyne	L3MBTL3	73	38
O=C(CCCCCCCC(=O)N1CCC[C@@H](CO)CC1)N1CCC[C@@H](CO)CC1	ZINC000819240752	HF	On-Demand	Anodyne	PREP	24	45
O=C(CCCCCCCC(=O)N1CCC[C@@H](CO)CC1)N1CCC[C@H](CO)CC1	ZINC000819240753	HF	On-Demand	Anodyne	PREP	24	45
O=C(CCCCCCCC(=O)N1CCC[C@H](CO)CC1)N1CCC[C@H](CO)CC1	ZINC000819240754	HF	On-Demand	Anodyne	PREP	24	45
C[C@H](C(=O)N1CCC[C@H](CO)CC1)c1ccc(S(C)(=O)=O)cc1	ZINC000819240755	ED	On-Demand	Anodyne	GPR119	39	42
C[C@@H](C(=O)N1CCC[C@H](CO)CC1)c1ccc(S(C)(=O)=O)cc1	ZINC000819240756	ED	On-Demand	Anodyne	GPR119	39	42
C[C@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccc(S(C)(=O)=O)cc1	ZINC000819240757	ED	On-Demand	Anodyne	GPR119	39	42
C[C@@H](C(=O)N1CCC[C@@H](CO)CC1)c1ccc(S(C)(=O)=O)cc1	ZINC000819240758	ED	On-Demand	Anodyne	GPR119	39	42
O=C(c1ccc2nc(O)oc2c1)N1CCC[C@H](CO)CC1	ZINC000819240765	CD	On-Demand	Anodyne	GRIN2B	22	40
O=C(c1ccc2nc(O)oc2c1)N1CCC[C@H](CO)CC1	ZINC000819240765	CD	On-Demand	Anodyne	L3MBTL3	76	40
O=C(c1ccc2nc(O)oc2c1)N1CCC[C@H](CO)CC1	ZINC000819240765	CD	On-Demand	Anodyne	HPGD	40	33
O=C(c1ccc2nc(O)oc2c1)N1CCC[C@@H](CO)CC1	ZINC000819240766	CD	On-Demand	Anodyne	GRIN2B	22	40
O=C(c1ccc2nc(O)oc2c1)N1CCC[C@@H](CO)CC1	ZINC000819240766	CD	On-Demand	Anodyne	L3MBTL3	76	40
O=C(c1ccc2nc(O)oc2c1)N1CCC[C@@H](CO)CC1	ZINC000819240766	CD	On-Demand	Anodyne	HPGD	40	33
O=C(c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819240775	IG	On-Demand	Anodyne	CCR4	42	32
O=C(c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819240775	IG	On-Demand	Anodyne	L3MBTL3	69	39
O=C(c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1)N1CCC[C@H](CO)CC1	ZINC000819240776	IG	On-Demand	Anodyne	CCR4	42	32
O=C(c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1)N1CCC[C@H](CO)CC1	ZINC000819240776	IG	On-Demand	Anodyne	L3MBTL3	69	39
O=C(c1ccc(S(=O)(=O)N2CCCC2)o1)N1CCC[C@@H](CO)CC1	ZINC000819240777	FD	On-Demand	Anodyne	L3MBTL3	53	46
O=C(c1ccc(S(=O)(=O)N2CCCC2)o1)N1CCC[C@H](CO)CC1	ZINC000819240778	FD	On-Demand	Anodyne	L3MBTL3	53	46
O=C(c1ccc(Cn2cncn2)cc1)N1CCC[C@H](CO)CC1	ZINC000819240785	DD	On-Demand	Anodyne	L3MBTL3	68	46
O=C(c1ccc(Cn2cncn2)cc1)N1CCC[C@@H](CO)CC1	ZINC000819240786	DD	On-Demand	Anodyne	L3MBTL3	68	46
C/C(=C/C(=O)N1CCC[C@H](CO)CC1)c1ccccc1Cl	ZINC000819240817	DG	On-Demand	Anodyne	SLC6A1	61	38
C/C(=C/C(=O)N1CCC[C@@H](CO)CC1)c1ccccc1Cl	ZINC000819240818	DG	On-Demand	Anodyne	SLC6A1	61	38
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819240890	CE	On-Demand	Anodyne	ACE	53	38
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819240890	CE	On-Demand	Anodyne	OPRM1	15	41
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819240890	CE	On-Demand	Anodyne	GRIN2B	48	36
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819240890	CE	On-Demand	Anodyne	MME	41	42
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819240890	CE	On-Demand	Anodyne	PREP	37	42
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819240890	CE	On-Demand	Anodyne	DPP7	41	37
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819240892	CE	On-Demand	Anodyne	ACE	53	38
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819240892	CE	On-Demand	Anodyne	OPRM1	15	41
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819240892	CE	On-Demand	Anodyne	GRIN2B	48	36
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819240892	CE	On-Demand	Anodyne	MME	41	42
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819240892	CE	On-Demand	Anodyne	PREP	37	42
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819240892	CE	On-Demand	Anodyne	DPP7	41	37
O=C([C@H](F)Cc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819240893	CE	On-Demand	Anodyne	ACE	53	38
O=C([C@H](F)Cc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819240893	CE	On-Demand	Anodyne	OPRM1	15	41
O=C([C@H](F)Cc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819240893	CE	On-Demand	Anodyne	GRIN2B	48	36
O=C([C@H](F)Cc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819240893	CE	On-Demand	Anodyne	MME	41	42
O=C([C@H](F)Cc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819240893	CE	On-Demand	Anodyne	PREP	37	42
O=C([C@H](F)Cc1ccccc1)N1CCC[C@@H](CO)CC1	ZINC000819240893	CE	On-Demand	Anodyne	DPP7	41	37
O=C([C@H](F)Cc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819240895	CE	On-Demand	Anodyne	ACE	53	38
O=C([C@H](F)Cc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819240895	CE	On-Demand	Anodyne	OPRM1	15	41
O=C([C@H](F)Cc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819240895	CE	On-Demand	Anodyne	GRIN2B	48	36
O=C([C@H](F)Cc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819240895	CE	On-Demand	Anodyne	MME	41	42
O=C([C@H](F)Cc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819240895	CE	On-Demand	Anodyne	PREP	37	42
O=C([C@H](F)Cc1ccccc1)N1CCC[C@H](CO)CC1	ZINC000819240895	CE	On-Demand	Anodyne	DPP7	41	37
O=C(c1cnc2[nH]cnc2c1)N1CCC[C@H](CO)CC1	ZINC000819240897	CD	On-Demand	Anodyne	L3MBTL3	40	35
O=C(c1cnc2[nH]cnc2c1)N1CCC[C@@H](CO)CC1	ZINC000819240899	CD	On-Demand	Anodyne	L3MBTL3	40	35
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819240904	EC	On-Demand	Anodyne	CA2	65	47
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819240904	EC	On-Demand	Anodyne	CA6	20	41
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819240904	EC	On-Demand	Anodyne	CA1	62	41
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819240904	EC	On-Demand	Anodyne	CA7	38	43
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819240904	EC	On-Demand	Anodyne	CA13	17	41
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819240904	EC	On-Demand	Anodyne	CA4	45	43
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819240904	EC	On-Demand	Anodyne	CA12	42	43
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819240904	EC	On-Demand	Anodyne	CA9	49	43
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819240904	EC	On-Demand	Anodyne	NCE103	19	47
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819240904	EC	On-Demand	Anodyne	CA15	18	41
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819240904	EC	On-Demand	Anodyne	A6YCJ1_9METZ	22	41
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819240906	EC	On-Demand	Anodyne	CA2	65	47
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819240906	EC	On-Demand	Anodyne	CA6	20	41
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819240906	EC	On-Demand	Anodyne	CA1	62	41
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819240906	EC	On-Demand	Anodyne	CA7	38	43
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819240906	EC	On-Demand	Anodyne	CA13	17	41
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819240906	EC	On-Demand	Anodyne	CA4	45	43
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819240906	EC	On-Demand	Anodyne	CA12	42	43
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819240906	EC	On-Demand	Anodyne	CA9	49	43
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819240906	EC	On-Demand	Anodyne	NCE103	19	47
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819240906	EC	On-Demand	Anodyne	CA15	18	41
NS(=O)(=O)c1ccc(CCC(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819240906	EC	On-Demand	Anodyne	A6YCJ1_9METZ	22	41
O=C(c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O)N1CCC[C@@H](CO)CC1	ZINC000819240911	GD	On-Demand	Anodyne	L3MBTL3	73	39
O=C(c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O)N1CCC[C@H](CO)CC1	ZINC000819240914	GD	On-Demand	Anodyne	L3MBTL3	73	39
O=C(c1noc(-c2cccc(F)c2)n1)N1CCC[C@@H](CO)CC1	ZINC000819240917	DE	On-Demand	Anodyne	ETHR	17	41
O=C(c1noc(-c2cccc(F)c2)n1)N1CCC[C@H](CO)CC1	ZINC000819240919	DE	On-Demand	Anodyne	ETHR	17	41
Cn1c(S)nnc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819240964	FD	On-Demand	Mild	PAPA1_CARPA	42	49
Cn1c(S)nnc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819240965	FD	On-Demand	Mild	PAPA1_CARPA	42	49
Cn1nc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c2ccccc21	ZINC000819241004	FD	On-Demand	Anodyne	ADRB2	38	43
Cn1nc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c2ccccc21	ZINC000819241004	FD	On-Demand	Anodyne	ADRB3	81	39
Cn1nc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c2ccccc21	ZINC000819241005	FD	On-Demand	Anodyne	ADRB2	38	43
Cn1nc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c2ccccc21	ZINC000819241005	FD	On-Demand	Anodyne	ADRB3	81	39
Cc1cc(F)ccc1[C@@H](O)CNCc1ccc(C(C)(C)O)cc1	ZINC000819241012	DG	On-Demand	Anodyne	LEF	65	37
Cn1nc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c2ccccc21	ZINC000819241013	EE	On-Demand	Bother	ADRB3	61	37
Cn1nc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c2ccccc21	ZINC000819241014	EE	On-Demand	Bother	ADRB3	61	37
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)c1	ZINC000819241043	FF	On-Demand	Anodyne	ADRB2	46	44
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)c1	ZINC000819241043	FF	On-Demand	Anodyne	ADRB1	68	44
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)c1	ZINC000819241043	FF	On-Demand	Anodyne	ADRB3	45	44
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)c1	ZINC000819241043	FF	On-Demand	Anodyne	CASR	40	35
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)c1	ZINC000819241043	FF	On-Demand	Anodyne	ABCB1	20	45
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)c1	ZINC000819241043	FF	On-Demand	Anodyne	PDS	82	37
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)c1	ZINC000819241044	FF	On-Demand	Anodyne	ADRB2	46	44
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)c1	ZINC000819241044	FF	On-Demand	Anodyne	ADRB1	68	44
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)c1	ZINC000819241044	FF	On-Demand	Anodyne	ADRB3	45	44
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)c1	ZINC000819241044	FF	On-Demand	Anodyne	CASR	40	35
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)c1	ZINC000819241044	FF	On-Demand	Anodyne	ABCB1	20	45
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)c1	ZINC000819241044	FF	On-Demand	Anodyne	PDS	82	37
Cn1nc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c2ccccc21	ZINC000819241045	EF	On-Demand	Anodyne	ADRB3	43	38
Cn1nc(CCNC[C@H](O)c2ccc(F)c(F)c2)c2ccccc21	ZINC000819241046	EF	On-Demand	Anodyne	ADRB3	43	38
Cn1nc(CCNC[C@@H](O)c2cccc(F)c2)c2ccccc21	ZINC000819241048	DF	On-Demand	Anodyne	ADRB1	30	42
Cn1nc(CCNC[C@@H](O)c2cccc(F)c2)c2ccccc21	ZINC000819241048	DF	On-Demand	Anodyne	ADRB3	57	42
Cn1nc(CCNC[C@H](O)c2cccc(F)c2)c2ccccc21	ZINC000819241049	DF	On-Demand	Anodyne	ADRB1	30	42
Cn1nc(CCNC[C@H](O)c2cccc(F)c2)c2ccccc21	ZINC000819241049	DF	On-Demand	Anodyne	ADRB3	57	42
O=C(/C=C/[C@@H]1CCCO1)Nc1nc2ccc(OC(F)(F)F)cc2s1	ZINC000819241052	FH	On-Demand	Anodyne	CSNK1D	43	51
O=C(/C=C/[C@H]1CCCO1)Nc1nc2ccc(OC(F)(F)F)cc2s1	ZINC000819241053	FH	On-Demand	Anodyne	CSNK1D	43	51
O=C(/C=C\[C@@H]1CCCO1)Nc1nc2ccc(OC(F)(F)F)cc2s1	ZINC000819241054	FH	On-Demand	Anodyne	CSNK1D	43	51
O=C(/C=C\[C@H]1CCCO1)Nc1nc2ccc(OC(F)(F)F)cc2s1	ZINC000819241055	FH	On-Demand	Anodyne	CSNK1D	43	51
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241084	GF	On-Demand	Anodyne	DRD4	16	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241084	GF	On-Demand	Anodyne	ACHE	27	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241084	GF	On-Demand	Anodyne	SLC6A3	19	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241084	GF	On-Demand	Anodyne	HTR4	41	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241084	GF	On-Demand	Anodyne	LTA4H	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241084	GF	On-Demand	Anodyne	SIGMAR1	29	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241084	GF	On-Demand	Anodyne	CACNA1I	51	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241084	GF	On-Demand	Anodyne	BIRC2	40	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241085	GF	On-Demand	Anodyne	DRD4	16	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241085	GF	On-Demand	Anodyne	ACHE	27	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241085	GF	On-Demand	Anodyne	SLC6A3	19	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241085	GF	On-Demand	Anodyne	HTR4	41	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241085	GF	On-Demand	Anodyne	LTA4H	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241085	GF	On-Demand	Anodyne	SIGMAR1	29	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241085	GF	On-Demand	Anodyne	CACNA1I	51	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241085	GF	On-Demand	Anodyne	BIRC2	40	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241086	GF	On-Demand	Anodyne	DRD4	16	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241086	GF	On-Demand	Anodyne	ACHE	27	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241086	GF	On-Demand	Anodyne	SLC6A3	19	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241086	GF	On-Demand	Anodyne	HTR4	41	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241086	GF	On-Demand	Anodyne	LTA4H	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241086	GF	On-Demand	Anodyne	SIGMAR1	29	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241086	GF	On-Demand	Anodyne	CACNA1I	51	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241086	GF	On-Demand	Anodyne	BIRC2	40	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241087	GF	On-Demand	Anodyne	DRD4	16	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241087	GF	On-Demand	Anodyne	ACHE	27	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241087	GF	On-Demand	Anodyne	SLC6A3	19	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241087	GF	On-Demand	Anodyne	HTR4	41	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241087	GF	On-Demand	Anodyne	LTA4H	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241087	GF	On-Demand	Anodyne	SIGMAR1	29	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241087	GF	On-Demand	Anodyne	CACNA1I	51	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCN(CCc3ccccc3)C1)C2	ZINC000819241087	GF	On-Demand	Anodyne	BIRC2	40	39
Cn1nc(CCNC[C@H](O)c2ccc(Cl)cc2)c2ccccc21	ZINC000819241138	EG	On-Demand	Anodyne	ADRB2	22	42
Cn1nc(CCNC[C@H](O)c2ccc(Cl)cc2)c2ccccc21	ZINC000819241138	EG	On-Demand	Anodyne	ADRB3	36	40
COc1ccc(OC)c([C@H](O)CNCCc2nn(C)c3ccccc23)c1	ZINC000819241179	FE	On-Demand	Anodyne	ADRB2	26	48
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241203	FE	On-Demand	Anodyne	ADRB2	54	50
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241203	FE	On-Demand	Anodyne	ADRB1	81	50
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241203	FE	On-Demand	Anodyne	ADRB3	56	50
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241204	FE	On-Demand	Anodyne	ADRB2	54	50
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241204	FE	On-Demand	Anodyne	ADRB1	81	50
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241204	FE	On-Demand	Anodyne	ADRB3	56	50
O=C(/C=C/[C@@H]1CCCO1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819241218	EE	On-Demand	Anodyne	HTR4	42	46
O=C(/C=C/[C@@H]1CCCO1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819241218	EE	On-Demand	Anodyne	SIGMAR1	29	43
O=C(/C=C/[C@@H]1CCCO1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819241218	EE	On-Demand	Anodyne	CACNA1I	41	33
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819241219	EE	On-Demand	Anodyne	HTR4	42	46
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819241219	EE	On-Demand	Anodyne	SIGMAR1	29	43
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819241219	EE	On-Demand	Anodyne	CACNA1I	41	33
O=C(/C=C\[C@@H]1CCCO1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819241220	EE	On-Demand	Anodyne	HTR4	42	46
O=C(/C=C\[C@@H]1CCCO1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819241220	EE	On-Demand	Anodyne	SIGMAR1	29	43
O=C(/C=C\[C@@H]1CCCO1)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819241220	EE	On-Demand	Anodyne	CACNA1I	41	33
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819241221	EE	On-Demand	Anodyne	HTR4	42	46
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819241221	EE	On-Demand	Anodyne	SIGMAR1	29	43
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819241221	EE	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(C(C)(C)O)cc2)CC1	ZINC000819241236	GG	On-Demand	Anodyne	GPR119	50	48
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(C(C)(C)O)cc2)CC1	ZINC000819241237	GG	On-Demand	Anodyne	GPR119	50	48
Cc1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)c(C)c1	ZINC000819241238	EG	On-Demand	Anodyne	ADRB2	25	45
Cc1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)c(C)c1	ZINC000819241238	EG	On-Demand	Anodyne	VDR	18	43
Cc1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)c(C)c1	ZINC000819241239	EG	On-Demand	Anodyne	ADRB2	25	45
Cc1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)c(C)c1	ZINC000819241239	EG	On-Demand	Anodyne	VDR	18	43
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241257	FE	On-Demand	Anodyne	ADRB2	54	60
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241257	FE	On-Demand	Anodyne	ADRB1	90	60
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241257	FE	On-Demand	Anodyne	GRIN1	28	42
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241257	FE	On-Demand	Anodyne	ADRB3	61	60
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241258	FE	On-Demand	Anodyne	ADRB2	54	60
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241258	FE	On-Demand	Anodyne	ADRB1	90	60
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241258	FE	On-Demand	Anodyne	GRIN1	28	42
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241258	FE	On-Demand	Anodyne	ADRB3	61	60
NC(=O)CN1CCCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819241286	EB	On-Demand	Anodyne	KCNJ1	71	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCCc3ccccc31)C2	ZINC000819241309	EG	On-Demand	Anodyne	AVPR2	42	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCCc3ccccc31)C2	ZINC000819241310	EG	On-Demand	Anodyne	AVPR2	42	40
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccccc1	ZINC000819241341	EF	On-Demand	Anodyne	ADRB2	58	51
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccccc1	ZINC000819241341	EF	On-Demand	Anodyne	ADRB1	73	48
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccccc1	ZINC000819241341	EF	On-Demand	Anodyne	ADRB3	140	49
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccccc1	ZINC000819241342	EF	On-Demand	Anodyne	ADRB2	58	51
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccccc1	ZINC000819241342	EF	On-Demand	Anodyne	ADRB1	73	48
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccccc1	ZINC000819241342	EF	On-Demand	Anodyne	ADRB3	140	49
CON(C)C(=O)CCNCc1cccc(N2CCOCC2)n1	ZINC000819241371	DC	On-Demand	Anodyne	EPHB4	45	33
COC(=O)[C@@H](CNC(=O)C(F)=C1CCC1)Cc1ccc(O)cc1	ZINC000819241382	DE	On-Demand	Anodyne	GRIA1	49	34
COC(=O)[C@@H](CNC(=O)C(F)=C1CCC1)Cc1ccc(O)cc1	ZINC000819241382	DE	On-Demand	Anodyne	YARS	40	32
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](C(=O)Nc1cc[nH]n1)c1ccccc1	ZINC000819241384	GE	On-Demand	Anodyne	AMP1_PLAFQ	18	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](C(=O)Nc1cc[nH]n1)c1ccccc1	ZINC000819241385	GE	On-Demand	Anodyne	AMP1_PLAFQ	18	41
Cc1ccccc1[C@@H](O)CNCCc1ccc(OCC(F)(F)F)nc1	ZINC000819241396	FG	On-Demand	Anodyne	ADRB3	49	39
N#Cc1ccc([C@@H](O)CNCCc2ccc(OCC(F)(F)F)nc2)cc1	ZINC000819241427	FF	On-Demand	Mild	ADRB3	44	39
N#Cc1ccc([C@H](O)CNCCc2ccc(OCC(F)(F)F)nc2)cc1	ZINC000819241428	FF	On-Demand	Mild	ADRB3	44	39
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(OCC(F)(F)F)nc2)c1	ZINC000819241431	GF	On-Demand	Bother	ADRB2	32	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(OCC(F)(F)F)nc2)c1	ZINC000819241431	GF	On-Demand	Bother	ADRB1	42	47
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(OCC(F)(F)F)nc2)c1	ZINC000819241431	GF	On-Demand	Bother	ADRB3	109	47
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(OCC(F)(F)F)nc2)c1	ZINC000819241432	GF	On-Demand	Bother	ADRB2	32	42
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(OCC(F)(F)F)nc2)c1	ZINC000819241432	GF	On-Demand	Bother	ADRB1	42	47
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(OCC(F)(F)F)nc2)c1	ZINC000819241432	GF	On-Demand	Bother	ADRB3	109	47
C=CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819241456	DF	On-Demand	Mild	PAPA1_CARPA	36	43
C=CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819241456	DF	On-Demand	Mild	CTSK	15	43
C=CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819241457	DF	On-Demand	Mild	PAPA1_CARPA	36	43
C=CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819241457	DF	On-Demand	Mild	CTSK	15	43
Cn1nc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c2ccccc21	ZINC000819241482	FG	On-Demand	Anodyne	ADRB2	27	40
Cn1nc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c2ccccc21	ZINC000819241482	FG	On-Demand	Anodyne	ADRB3	42	38
Cn1nc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c2ccccc21	ZINC000819241483	FG	On-Demand	Anodyne	ADRB2	27	40
Cn1nc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c2ccccc21	ZINC000819241483	FG	On-Demand	Anodyne	ADRB3	42	38
Cc1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241507	EF	On-Demand	Anodyne	ADRB2	49	52
Cc1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241507	EF	On-Demand	Anodyne	ADRB1	66	50
Cc1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241507	EF	On-Demand	Anodyne	ADRB3	42	46
Cc1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241508	EF	On-Demand	Anodyne	ADRB2	49	52
Cc1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241508	EF	On-Demand	Anodyne	ADRB1	66	50
Cc1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241508	EF	On-Demand	Anodyne	ADRB3	42	46
C=CCN(C(=O)CCc1cccc(OC(F)F)c1)C(C)C	ZINC000819241509	CH	On-Demand	Mild	CRTM	49	35
NC(=O)C1CCN(c2ncccc2CNC(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819241541	FD	On-Demand	Anodyne	SCN2A	17	41
NC(=O)C1CCN(c2ncccc2CNC(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819241541	FD	On-Demand	Anodyne	SCN10A	19	41
NC(=O)C1CCN(c2ncccc2CNC(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819241542	FD	On-Demand	Anodyne	SCN2A	17	41
NC(=O)C1CCN(c2ncccc2CNC(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819241542	FD	On-Demand	Anodyne	SCN10A	19	41
NC(=O)C1CCN(c2ncccc2CNC(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819241543	FD	On-Demand	Anodyne	SCN2A	17	41
NC(=O)C1CCN(c2ncccc2CNC(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819241543	FD	On-Demand	Anodyne	SCN10A	19	41
NC(=O)C1CCN(c2ncccc2CNC(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819241544	FD	On-Demand	Anodyne	SCN2A	17	41
NC(=O)C1CCN(c2ncccc2CNC(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819241544	FD	On-Demand	Anodyne	SCN10A	19	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)CC1	ZINC000819241549	GD	On-Demand	Anodyne	GPR119	28	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)CC1	ZINC000819241550	GD	On-Demand	Anodyne	GPR119	28	42
NC(=O)C1CCN(c2ncccc2CNC(=O)C(F)=C2CCC2)CC1	ZINC000819241555	ED	On-Demand	Anodyne	SCN2A	17	42
NC(=O)C1CCN(c2ncccc2CNC(=O)C(F)=C2CCC2)CC1	ZINC000819241555	ED	On-Demand	Anodyne	SCN10A	19	42
O=C(/C=C/[C@H]1CCCO1)NNC(=O)Cc1cccnc1	ZINC000819241556	CC	On-Demand	Reactive	CHRNA7	42	37
O=C(/C=C\[C@@H]1CCCO1)NNC(=O)Cc1cccnc1	ZINC000819241557	CC	On-Demand	Reactive	CHRNA7	42	37
O=C(/C=C\[C@H]1CCCO1)NNC(=O)Cc1cccnc1	ZINC000819241558	CC	On-Demand	Reactive	CHRNA7	42	37
O=C(/C=C/[C@@H]1CCCO1)NNC(=O)Cc1cccnc1	ZINC000819241560	CC	On-Demand	Reactive	CHRNA7	42	37
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC2(C1)OCCO2	ZINC000819241563	DC	On-Demand	Anodyne	KCNJ1	58	40
N#CCc1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819241568	FD	On-Demand	Mild	ADRB2	30	41
N#CCc1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819241568	FD	On-Demand	Mild	ADRB1	51	40
N#CCc1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819241568	FD	On-Demand	Mild	ADRB3	34	40
N#CCc1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819241570	FD	On-Demand	Mild	ADRB2	30	41
N#CCc1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819241570	FD	On-Demand	Mild	ADRB1	51	40
N#CCc1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819241570	FD	On-Demand	Mild	ADRB3	34	40
Cn1nc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c2ccccc21	ZINC000819241661	GG	On-Demand	Anodyne	ADRB2	33	40
Cn1nc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c2ccccc21	ZINC000819241661	GG	On-Demand	Anodyne	ADRB3	29	44
Cn1nc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c2ccccc21	ZINC000819241662	GG	On-Demand	Anodyne	ADRB2	33	40
Cn1nc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c2ccccc21	ZINC000819241662	GG	On-Demand	Anodyne	ADRB3	29	44
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241663	DG	On-Demand	Anodyne	DRD4	18	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241663	DG	On-Demand	Anodyne	ACHE	26	40
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241663	DG	On-Demand	Anodyne	SLC6A1	42	33
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241663	DG	On-Demand	Anodyne	OPRM1	17	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241663	DG	On-Demand	Anodyne	HTR4	42	46
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241663	DG	On-Demand	Anodyne	SIGMAR1	41	45
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241663	DG	On-Demand	Anodyne	CCR3	38	44
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241663	DG	On-Demand	Anodyne	CACNA1G	26	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241663	DG	On-Demand	Anodyne	CACNA1I	42	33
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241663	DG	On-Demand	Anodyne	BIRC2	54	42
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241664	DG	On-Demand	Anodyne	DRD4	18	41
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241664	DG	On-Demand	Anodyne	ACHE	26	40
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241664	DG	On-Demand	Anodyne	SLC6A1	42	33
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241664	DG	On-Demand	Anodyne	OPRM1	17	41
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241664	DG	On-Demand	Anodyne	HTR4	42	46
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241664	DG	On-Demand	Anodyne	SIGMAR1	41	45
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241664	DG	On-Demand	Anodyne	CCR3	38	44
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241664	DG	On-Demand	Anodyne	CACNA1G	26	41
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241664	DG	On-Demand	Anodyne	CACNA1I	42	33
O=C(NC[C@H]1CCN(CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819241664	DG	On-Demand	Anodyne	BIRC2	54	42
Cn1c(S)nnc1CNC(=O)C1(c2ccc(Cl)cc2Cl)CCCCC1	ZINC000819241666	GH	On-Demand	Anodyne	UGCG	35	43
N#Cc1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819241670	ED	On-Demand	Mild	ADRB2	23	42
N#Cc1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819241670	ED	On-Demand	Mild	ADRB1	48	33
N#Cc1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819241671	ED	On-Demand	Mild	ADRB2	23	42
N#Cc1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819241671	ED	On-Demand	Mild	ADRB1	48	33
Cn1c(S)nnc1CNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819241685	ED	On-Demand	Anodyne	PLA2G4A	28	42
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000819241707	FG	On-Demand	Anodyne	GRM5	21	49
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000819241707	FG	On-Demand	Anodyne	SMO	46	47
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000819241707	FG	On-Demand	Anodyne	ETHR	74	57
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000819241708	FG	On-Demand	Anodyne	GRM5	21	49
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000819241708	FG	On-Demand	Anodyne	SMO	46	47
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000819241708	FG	On-Demand	Anodyne	ETHR	74	57
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000819241709	FG	On-Demand	Anodyne	GRM5	21	49
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000819241709	FG	On-Demand	Anodyne	SMO	46	47
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000819241709	FG	On-Demand	Anodyne	ETHR	74	57
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000819241710	FG	On-Demand	Anodyne	GRM5	21	49
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000819241710	FG	On-Demand	Anodyne	SMO	46	47
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000819241710	FG	On-Demand	Anodyne	ETHR	74	57
O=C(/C=C/[C@H]1CCCO1)N1CCCCc2ccccc21	ZINC000819241719	CG	On-Demand	Anodyne	AVPR2	44	52
O=C(/C=C\[C@H]1CCCO1)N1CCCCc2ccccc21	ZINC000819241721	CG	On-Demand	Anodyne	AVPR2	44	52
O=C(/C=C/[C@@H]1CCCO1)N1CCCCc2ccccc21	ZINC000819241723	CG	On-Demand	Anodyne	AVPR2	44	52
O=C(/C=C\[C@@H]1CCCO1)N1CCCCc2ccccc21	ZINC000819241725	CG	On-Demand	Anodyne	AVPR2	44	52
C/C=C\c1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)c(OC)c1	ZINC000819241741	GG	On-Demand	Anodyne	ADRB2	15	61
C/C=C\c1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)c(OC)c1	ZINC000819241742	GG	On-Demand	Anodyne	ADRB2	15	61
C/C=C/c1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)c(OC)c1	ZINC000819241743	GG	On-Demand	Anodyne	ADRB2	15	61
C/C=C/c1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)c(OC)c1	ZINC000819241744	GG	On-Demand	Anodyne	ADRB2	15	61
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819241764	GF	On-Demand	Anodyne	DRD4	18	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819241764	GF	On-Demand	Anodyne	ACHE	27	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819241764	GF	On-Demand	Anodyne	HTR4	54	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819241764	GF	On-Demand	Anodyne	SIGMAR1	27	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819241764	GF	On-Demand	Anodyne	CCR3	25	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819241764	GF	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819241764	GF	On-Demand	Anodyne	CACNA1I	53	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819241764	GF	On-Demand	Anodyne	BIRC2	43	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819241765	GF	On-Demand	Anodyne	DRD4	18	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819241765	GF	On-Demand	Anodyne	ACHE	27	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819241765	GF	On-Demand	Anodyne	HTR4	54	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819241765	GF	On-Demand	Anodyne	SIGMAR1	27	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819241765	GF	On-Demand	Anodyne	CCR3	25	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819241765	GF	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819241765	GF	On-Demand	Anodyne	CACNA1I	53	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819241765	GF	On-Demand	Anodyne	BIRC2	43	41
Cn1nc(CCNC[C@@H](O)c2ccc(F)cc2)c2ccccc21	ZINC000819241770	DF	On-Demand	Anodyne	ADRB2	28	42
Cn1nc(CCNC[C@H](O)c2ccc(F)cc2)c2ccccc21	ZINC000819241771	DF	On-Demand	Anodyne	ADRB2	28	42
CC(C)c1cccc(CNC[C@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819241783	EG	On-Demand	Anodyne	PDS	39	41
CC(C)c1cccc(CNC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819241784	EG	On-Demand	Anodyne	PDS	39	41
CC(C)c1cccc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819241802	EG	On-Demand	Anodyne	ADRB2	46	36
CC(C)c1cccc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819241802	EG	On-Demand	Anodyne	ADRB1	43	38
CC(C)c1cccc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819241802	EG	On-Demand	Anodyne	ADRB3	72	42
CC(C)c1cccc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819241803	EG	On-Demand	Anodyne	ADRB2	46	36
CC(C)c1cccc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819241803	EG	On-Demand	Anodyne	ADRB1	43	38
CC(C)c1cccc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819241803	EG	On-Demand	Anodyne	ADRB3	72	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241814	FF	On-Demand	Anodyne	ADRB2	49	46
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241814	FF	On-Demand	Anodyne	ADRB1	77	46
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241814	FF	On-Demand	Anodyne	ADRB3	52	45
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241814	FF	On-Demand	Anodyne	ABCB1	15	54
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241815	FF	On-Demand	Anodyne	ADRB2	49	46
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241815	FF	On-Demand	Anodyne	ADRB1	77	46
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241815	FF	On-Demand	Anodyne	ADRB3	52	45
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C(C)(C)O)cc2)cc1	ZINC000819241815	FF	On-Demand	Anodyne	ABCB1	15	54
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)Cc1cccnc1	ZINC000819241831	CD	On-Demand	Reactive	CHRNA7	44	35
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)Cc1cccnc1	ZINC000819241831	CD	On-Demand	Reactive	NAMPT	49	40
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)Cc1cccnc1	ZINC000819241833	CD	On-Demand	Reactive	CHRNA7	44	35
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)Cc1cccnc1	ZINC000819241833	CD	On-Demand	Reactive	NAMPT	49	40
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(F)cc1	ZINC000819241847	ED	On-Demand	Anodyne	ADRB2	34	43
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(F)cc1	ZINC000819241847	ED	On-Demand	Anodyne	ADRB1	55	41
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(F)cc1	ZINC000819241847	ED	On-Demand	Anodyne	ADRB3	32	41
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(F)cc1	ZINC000819241849	ED	On-Demand	Anodyne	ADRB2	34	43
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(F)cc1	ZINC000819241849	ED	On-Demand	Anodyne	ADRB1	55	41
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(F)cc1	ZINC000819241849	ED	On-Demand	Anodyne	ADRB3	32	41
COC(=O)c1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819241861	FD	On-Demand	Anodyne	ADRB2	42	43
COC(=O)c1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819241861	FD	On-Demand	Anodyne	ADRB1	65	43
COC(=O)c1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819241861	FD	On-Demand	Anodyne	ADRB3	44	43
COC(=O)c1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819241862	FD	On-Demand	Anodyne	ADRB2	42	43
COC(=O)c1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819241862	FD	On-Demand	Anodyne	ADRB1	65	43
COC(=O)c1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819241862	FD	On-Demand	Anodyne	ADRB3	44	43
CC(=O)Nc1cccc(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	ZINC000819241882	GD	On-Demand	Reactive	TYK2	43	36
CC(=O)Nc1cccc(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1	ZINC000819241882	GD	On-Demand	Reactive	LIMK2	15	41
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)c1	ZINC000819241902	FD	On-Demand	Bother	ADRB2	16	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)c1	ZINC000819241902	FD	On-Demand	Bother	ADRB1	19	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)c1	ZINC000819241902	FD	On-Demand	Bother	PDS	37	41
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)c1	ZINC000819241903	FD	On-Demand	Bother	ADRB2	16	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)c1	ZINC000819241903	FD	On-Demand	Bother	ADRB1	19	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)c1	ZINC000819241903	FD	On-Demand	Bother	PDS	37	41
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)c1cccc(Cl)c1	ZINC000819241927	DE	On-Demand	Anodyne	ADRB1	29	44
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)c1cccc(Cl)c1	ZINC000819241927	DE	On-Demand	Anodyne	ADRB3	43	44
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)c1cccc(Cl)c1	ZINC000819241928	DE	On-Demand	Anodyne	ADRB1	29	44
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)c1cccc(Cl)c1	ZINC000819241928	DE	On-Demand	Anodyne	ADRB3	43	44
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccc(Cl)c1	ZINC000819241935	FH	On-Demand	Anodyne	ADRB2	59	40
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccc(Cl)c1	ZINC000819241935	FH	On-Demand	Anodyne	ADRB1	77	62
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccc(Cl)c1	ZINC000819241935	FH	On-Demand	Anodyne	ADRB3	131	62
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccc(Cl)c1	ZINC000819241936	FH	On-Demand	Anodyne	ADRB2	59	40
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccc(Cl)c1	ZINC000819241936	FH	On-Demand	Anodyne	ADRB1	77	62
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccc(Cl)c1	ZINC000819241936	FH	On-Demand	Anodyne	ADRB3	131	62
Cn1nc(CCNC[C@@H](O)c2cccc(Br)c2)c2ccccc21	ZINC000819241940	FG	On-Demand	Anodyne	ADRB2	34	40
Cn1nc(CCNC[C@@H](O)c2cccc(Br)c2)c2ccccc21	ZINC000819241940	FG	On-Demand	Anodyne	ADRB3	51	40
Cn1nc(CCNC[C@H](O)c2cccc(Br)c2)c2ccccc21	ZINC000819241941	FG	On-Demand	Anodyne	ADRB2	34	40
Cn1nc(CCNC[C@H](O)c2cccc(Br)c2)c2ccccc21	ZINC000819241941	FG	On-Demand	Anodyne	ADRB3	51	40
CC(C)c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819241956	CG	On-Demand	Anodyne	ADRB2	34	47
CC(C)c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819241956	CG	On-Demand	Anodyne	ADRB1	41	47
CC(C)c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819241956	CG	On-Demand	Anodyne	ADRB3	110	49
CC(C)c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819241956	CG	On-Demand	Anodyne	KCNA5	21	42
CC(C)c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819241957	CG	On-Demand	Anodyne	ADRB2	34	47
CC(C)c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819241957	CG	On-Demand	Anodyne	ADRB1	41	47
CC(C)c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819241957	CG	On-Demand	Anodyne	ADRB3	110	49
CC(C)c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819241957	CG	On-Demand	Anodyne	KCNA5	21	42
CC(=O)Nc1cccc(CC(=O)NC(C)(C)c2ccc(F)cc2)c1	ZINC000819241979	EG	On-Demand	Anodyne	IMDH_CRYPV	59	36
CC(=O)Nc1cccc(CC(=O)NC(C)(C)c2ccc(F)cc2)c1	ZINC000819241979	EG	On-Demand	Anodyne	KCNK3	68	41
CC(=O)Nc1cccc(CC(=O)NC(C)(C)c2ccc(F)cc2)c1	ZINC000819241979	EG	On-Demand	Anodyne	KCNK9	52	35
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(Br)cc1	ZINC000819242035	GE	On-Demand	Anodyne	ADRB2	25	42
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(Br)cc1	ZINC000819242036	GE	On-Demand	Anodyne	ADRB2	25	42
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(F)cc1Cl	ZINC000819242043	GH	On-Demand	Anodyne	ADRB1	24	41
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(F)cc1Cl	ZINC000819242043	GH	On-Demand	Anodyne	ADRB3	23	41
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(F)cc1Cl	ZINC000819242044	GH	On-Demand	Anodyne	ADRB1	24	41
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(F)cc1Cl	ZINC000819242044	GH	On-Demand	Anodyne	ADRB3	23	41
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1cccc2ccccc12	ZINC000819242045	FF	On-Demand	Anodyne	ADRB2	26	54
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1cccc2ccccc12	ZINC000819242045	FF	On-Demand	Anodyne	ADRB1	60	36
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1cccc2ccccc12	ZINC000819242045	FF	On-Demand	Anodyne	CYP2D6	18	45
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1cccc2ccccc12	ZINC000819242046	FF	On-Demand	Anodyne	ADRB2	26	54
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1cccc2ccccc12	ZINC000819242046	FF	On-Demand	Anodyne	ADRB1	60	36
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1cccc2ccccc12	ZINC000819242046	FF	On-Demand	Anodyne	CYP2D6	18	45
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc2ccccc2c1	ZINC000819242053	FF	On-Demand	Anodyne	ADRB2	32	49
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc2ccccc2c1	ZINC000819242053	FF	On-Demand	Anodyne	ADRB1	40	39
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc2ccccc2c1	ZINC000819242054	FF	On-Demand	Anodyne	ADRB2	32	49
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc2ccccc2c1	ZINC000819242054	FF	On-Demand	Anodyne	ADRB1	40	39
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccccc1Cl	ZINC000819242068	FE	On-Demand	Anodyne	ADRB2	21	47
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccccc1Cl	ZINC000819242068	FE	On-Demand	Anodyne	ADRB1	55	35
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccccc1Cl	ZINC000819242069	FE	On-Demand	Anodyne	ADRB2	21	47
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccccc1Cl	ZINC000819242069	FE	On-Demand	Anodyne	ADRB1	55	35
CS(=O)(=O)c1ccc([C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819242074	FD	On-Demand	Anodyne	TRPV1	41	32
CS(=O)(=O)c1ccc([C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819242075	FD	On-Demand	Anodyne	TRPV1	41	32
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1F	ZINC000819242083	GF	On-Demand	Anodyne	ADRB1	31	48
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1F	ZINC000819242083	GF	On-Demand	Anodyne	ADRB3	49	48
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1F	ZINC000819242084	GF	On-Demand	Anodyne	ADRB1	31	48
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1F	ZINC000819242084	GF	On-Demand	Anodyne	ADRB3	49	48
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(Cl)c(Cl)c1	ZINC000819242107	GF	On-Demand	Anodyne	GRIN1	23	43
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(Cl)c(Cl)c1	ZINC000819242108	GF	On-Demand	Anodyne	GRIN1	23	43
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1	ZINC000819242115	GG	On-Demand	Clean	GPR119	43	46
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(N(C)C)cc1	ZINC000819242118	GG	On-Demand	Clean	GPR119	43	46
CCN(C)C(=O)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819242134	CC	On-Demand	Bother	CACNA1D	53	33
CCN(C)C(=O)CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819242135	CC	On-Demand	Bother	CACNA1D	53	33
O[C@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cccc(F)c1	ZINC000819242150	FH	On-Demand	Anodyne	SFRP1	55	34
O[C@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cccc(F)c1	ZINC000819242151	FH	On-Demand	Anodyne	SFRP1	55	34
O[C@@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cccc(F)c1	ZINC000819242152	FH	On-Demand	Anodyne	SFRP1	55	34
O[C@@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cccc(F)c1	ZINC000819242153	FH	On-Demand	Anodyne	SFRP1	55	34
CCN(C)C(=O)CNC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819242205	FC	On-Demand	Clean	ABCB1	38	41
CCN(C)C(=O)CNC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819242206	FC	On-Demand	Clean	ABCB1	38	41
CCOc1ccccc1CN(CCCn1ccnc1)C(=O)C(F)=C1CCC1	ZINC000819242209	FI	On-Demand	Anodyne	TBXAS1	30	42
O=C(/C=C\[C@@H]1CCCO1)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000819242274	GH	On-Demand	Anodyne	CYP11B1	32	43
O=C(/C=C\[C@@H]1CCCO1)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000819242274	GH	On-Demand	Anodyne	CYP11B2	15	43
O=C(/C=C/[C@@H]1CCCO1)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000819242284	GH	On-Demand	Anodyne	CYP11B1	32	43
O=C(/C=C/[C@@H]1CCCO1)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000819242284	GH	On-Demand	Anodyne	CYP11B2	15	43
O=C(/C=C\[C@H]1CCCO1)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000819242286	GH	On-Demand	Anodyne	CYP11B1	32	43
O=C(/C=C\[C@H]1CCCO1)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000819242286	GH	On-Demand	Anodyne	CYP11B2	15	43
O=C(/C=C/[C@H]1CCCO1)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000819242289	GH	On-Demand	Anodyne	CYP11B1	32	43
O=C(/C=C/[C@H]1CCCO1)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000819242289	GH	On-Demand	Anodyne	CYP11B2	15	43
O=C(Cc1cccnc1)NNC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819242310	FE	On-Demand	Reactive	CHRNA7	48	39
O=C(Cc1cccnc1)NNC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819242310	FE	On-Demand	Reactive	NAMPT	51	40
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242312	FD	On-Demand	Anodyne	HTR1A	41	54
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242312	FD	On-Demand	Anodyne	DRD2	42	46
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242312	FD	On-Demand	Anodyne	DRD4	21	42
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242312	FD	On-Demand	Anodyne	HTR2A	20	42
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242312	FD	On-Demand	Anodyne	DRD3	63	40
O[C@@H](CNCc1cccc(N2CCOCC2)n1)c1cc(F)ccc1F	ZINC000819242313	EE	On-Demand	Anodyne	PIK3CB	42	37
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242314	FD	On-Demand	Anodyne	HTR1A	41	54
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242314	FD	On-Demand	Anodyne	DRD2	42	46
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242314	FD	On-Demand	Anodyne	DRD4	21	42
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242314	FD	On-Demand	Anodyne	HTR2A	20	42
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242314	FD	On-Demand	Anodyne	DRD3	63	40
O[C@H](CNCc1cccc(N2CCOCC2)n1)c1cc(F)ccc1F	ZINC000819242315	EE	On-Demand	Anodyne	PIK3CB	42	37
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242316	FD	On-Demand	Anodyne	HTR1A	41	54
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242316	FD	On-Demand	Anodyne	DRD2	42	46
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242316	FD	On-Demand	Anodyne	DRD4	21	42
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242316	FD	On-Demand	Anodyne	HTR2A	20	42
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242316	FD	On-Demand	Anodyne	DRD3	63	40
CC(=O)Nc1cccc(CC(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2)c1	ZINC000819242317	GI	On-Demand	Anodyne	TSHR	46	31
CC(=O)Nc1cccc(CC(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2)c1	ZINC000819242317	GI	On-Demand	Anodyne	NQO2	21	41
CC(=O)Nc1cccc(CC(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2)c1	ZINC000819242317	GI	On-Demand	Anodyne	MTNR1B	15	41
CC(=O)Nc1cccc(CC(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2)c1	ZINC000819242317	GI	On-Demand	Anodyne	IMDH_CRYPV	38	44
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242318	FD	On-Demand	Anodyne	HTR1A	41	54
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242318	FD	On-Demand	Anodyne	DRD2	42	46
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242318	FD	On-Demand	Anodyne	DRD4	21	42
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242318	FD	On-Demand	Anodyne	HTR2A	20	42
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCN(c2ncccn2)CC1	ZINC000819242318	FD	On-Demand	Anodyne	DRD3	63	40
O[C@@H](CNCc1cccc(N2CCOCC2)n1)c1cccc(Cl)c1	ZINC000819242330	EE	On-Demand	Anodyne	IGF1R	28	43
O[C@@H](CNCc1cccc(N2CCOCC2)n1)c1cccc(Cl)c1	ZINC000819242330	EE	On-Demand	Anodyne	CYP3A4	48	38
O[C@H](CNCc1cccc(N2CCOCC2)n1)c1cccc(Cl)c1	ZINC000819242332	EE	On-Demand	Anodyne	IGF1R	28	43
O[C@H](CNCc1cccc(N2CCOCC2)n1)c1cccc(Cl)c1	ZINC000819242332	EE	On-Demand	Anodyne	CYP3A4	48	38
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(-c2ccccc2)cc1	ZINC000819242335	GG	On-Demand	Anodyne	ADRB2	41	45
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(-c2ccccc2)cc1	ZINC000819242335	GG	On-Demand	Anodyne	ADRB1	61	43
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(-c2ccccc2)cc1	ZINC000819242335	GG	On-Demand	Anodyne	ADRB3	41	43
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(-c2ccccc2)cc1	ZINC000819242339	GG	On-Demand	Anodyne	ADRB2	41	45
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(-c2ccccc2)cc1	ZINC000819242339	GG	On-Demand	Anodyne	ADRB1	61	43
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(-c2ccccc2)cc1	ZINC000819242339	GG	On-Demand	Anodyne	ADRB3	41	43
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1cccc2[nH]ccc12	ZINC000819242356	FD	On-Demand	Anodyne	ADRB2	15	53
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1cccc2[nH]ccc12	ZINC000819242356	FD	On-Demand	Anodyne	ADRB1	35	53
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1cccc2[nH]ccc12	ZINC000819242358	FD	On-Demand	Anodyne	ADRB2	15	53
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1cccc2[nH]ccc12	ZINC000819242358	FD	On-Demand	Anodyne	ADRB1	35	53
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(F)cc1	ZINC000819242361	FG	On-Demand	Anodyne	ADRB2	34	44
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(F)cc1	ZINC000819242361	FG	On-Demand	Anodyne	ADRB1	33	41
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(F)cc1	ZINC000819242361	FG	On-Demand	Anodyne	ADRB3	73	41
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(F)cc1	ZINC000819242362	FG	On-Demand	Anodyne	ADRB2	34	44
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(F)cc1	ZINC000819242362	FG	On-Demand	Anodyne	ADRB1	33	41
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(F)cc1	ZINC000819242362	FG	On-Demand	Anodyne	ADRB3	73	41
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)c1	ZINC000819242363	GF	On-Demand	Anodyne	CCR3	40	38
CC(=O)Nc1cccc(CC(=O)N2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)c1	ZINC000819242365	GF	On-Demand	Anodyne	CCR3	40	38
O[C@@H](CNCc1cccc(N2CCOCC2)n1)c1ccc(F)cc1F	ZINC000819242385	EE	On-Demand	Anodyne	PIK3CB	41	37
O[C@H](CNCc1cccc(N2CCOCC2)n1)c1ccc(F)cc1F	ZINC000819242387	EE	On-Demand	Anodyne	PIK3CB	41	37
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819242396	ED	On-Demand	Anodyne	HTR1A	60	60
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819242396	ED	On-Demand	Anodyne	DRD2	62	49
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819242396	ED	On-Demand	Anodyne	DRD1	15	46
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819242396	ED	On-Demand	Anodyne	DRD4	35	48
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819242396	ED	On-Demand	Anodyne	ADRA1D	17	42
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819242396	ED	On-Demand	Anodyne	HTR2A	39	48
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819242396	ED	On-Demand	Anodyne	HTR2C	24	46
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819242396	ED	On-Demand	Anodyne	ADRA1A	20	42
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819242396	ED	On-Demand	Anodyne	DRD3	79	46
O=C(NCCCCN1CCN(c2ncccn2)CC1)C(F)=C1CCC1	ZINC000819242396	ED	On-Demand	Anodyne	HTR7	36	41
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccccc1F	ZINC000819242417	FG	On-Demand	Anodyne	ADRB1	37	40
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccccc1F	ZINC000819242417	FG	On-Demand	Anodyne	ADRB3	51	40
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccccc1F	ZINC000819242418	FG	On-Demand	Anodyne	ADRB1	37	40
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccccc1F	ZINC000819242418	FG	On-Demand	Anodyne	ADRB3	51	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)CCc1ccccc1OC)C2	ZINC000819242429	FF	On-Demand	Anodyne	MBTPS1	58	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)CCc1ccccc1OC)C2	ZINC000819242430	FF	On-Demand	Anodyne	MBTPS1	58	43
CC(=O)Nc1cccc(CC(=O)NCC(=O)OC(C)C)c1	ZINC000819242442	CD	On-Demand	Anodyne	KCNK3	108	37
CC(=O)Nc1cccc(CC(=O)NCC(=O)OC(C)C)c1	ZINC000819242442	CD	On-Demand	Anodyne	KCNK9	80	37
CC(=O)Nc1cccc(OCCNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819242451	GE	On-Demand	Anodyne	HRH2	24	41
CC(=O)Nc1cccc(OCCNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819242451	GE	On-Demand	Anodyne	MTNR1A	25	43
CC(=O)Nc1cccc(OCCNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819242451	GE	On-Demand	Anodyne	MTNR1B	21	43
CC(=O)Nc1cccc(OCCNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819242451	GE	On-Demand	Anodyne	EPHX2	20	43
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCN(c3ccccc3C(F)(F)F)C2)c1	ZINC000819242454	GH	On-Demand	Bother	SFRP1	92	36
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCN(c3ccccc3C(F)(F)F)C2)c1	ZINC000819242454	GH	On-Demand	Bother	WNT3	52	36
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)c1	ZINC000819242455	GH	On-Demand	Bother	SFRP1	92	36
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)c1	ZINC000819242455	GH	On-Demand	Bother	WNT3	52	36
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCN(c3ccccc3C(F)(F)F)C2)c1	ZINC000819242456	GH	On-Demand	Bother	SFRP1	92	36
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCN(c3ccccc3C(F)(F)F)C2)c1	ZINC000819242456	GH	On-Demand	Bother	WNT3	52	36
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)c1	ZINC000819242457	GH	On-Demand	Bother	SFRP1	92	36
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)c1	ZINC000819242457	GH	On-Demand	Bother	WNT3	52	36
O[C@@H](CNCc1cccc(N2CCOCC2)n1)c1cccc(C(F)(F)F)c1	ZINC000819242507	GF	On-Demand	Anodyne	PIK3CB	24	40
O[C@H](CNCc1cccc(N2CCOCC2)n1)c1cccc(C(F)(F)F)c1	ZINC000819242508	GF	On-Demand	Anodyne	PIK3CB	24	40
O[C@@H](CNCc1cccc(N2CCOCC2)n1)c1ccccc1C(F)(F)F	ZINC000819242514	GF	On-Demand	Anodyne	PIK3CB	40	37
O[C@H](CNCc1cccc(N2CCOCC2)n1)c1ccccc1C(F)(F)F	ZINC000819242515	GF	On-Demand	Anodyne	PIK3CB	40	37
O[C@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1	ZINC000819242518	FH	On-Demand	Anodyne	SCD1	25	44
O[C@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1	ZINC000819242518	FH	On-Demand	Anodyne	SFRP1	104	36
O[C@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1	ZINC000819242518	FH	On-Demand	Anodyne	SCD	24	44
O[C@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1	ZINC000819242518	FH	On-Demand	Anodyne	WNT3	66	36
O[C@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1	ZINC000819242519	FH	On-Demand	Anodyne	SCD1	25	44
O[C@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1	ZINC000819242519	FH	On-Demand	Anodyne	SFRP1	104	36
O[C@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1	ZINC000819242519	FH	On-Demand	Anodyne	SCD	24	44
O[C@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1	ZINC000819242519	FH	On-Demand	Anodyne	WNT3	66	36
O[C@@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1	ZINC000819242520	FH	On-Demand	Anodyne	SCD1	25	44
O[C@@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1	ZINC000819242520	FH	On-Demand	Anodyne	SFRP1	104	36
O[C@@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1	ZINC000819242520	FH	On-Demand	Anodyne	SCD	24	44
O[C@@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1	ZINC000819242520	FH	On-Demand	Anodyne	WNT3	66	36
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccccc1F	ZINC000819242526	ED	On-Demand	Anodyne	ADRB1	58	38
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccccc1F	ZINC000819242527	ED	On-Demand	Anodyne	ADRB1	58	38
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1nc(C(F)(F)F)n[nH]1	ZINC000819242528	FD	On-Demand	Bother	ADRB1	49	36
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1nc(C(F)(F)F)n[nH]1	ZINC000819242529	FD	On-Demand	Bother	ADRB1	49	36
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(Cl)cc1	ZINC000819242537	FH	On-Demand	Anodyne	ADRB2	29	43
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(Cl)cc1	ZINC000819242537	FH	On-Demand	Anodyne	ADRB1	33	46
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(Cl)cc1	ZINC000819242537	FH	On-Demand	Anodyne	ADRB3	68	46
CN(C)c1noc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)n1	ZINC000819242543	FD	On-Demand	Anodyne	ADRB2	21	40
CN(C)c1noc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)n1	ZINC000819242543	FD	On-Demand	Anodyne	GRIN1	28	41
CN(C)c1noc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)n1	ZINC000819242544	FD	On-Demand	Anodyne	ADRB2	21	40
CN(C)c1noc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)n1	ZINC000819242544	FD	On-Demand	Anodyne	GRIN1	28	41
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1cccc(C(F)(F)F)c1	ZINC000819242571	GE	On-Demand	Anodyne	PDS	51	42
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1cccc(C(F)(F)F)c1	ZINC000819242572	GE	On-Demand	Anodyne	PDS	51	42
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(Cl)cc1	ZINC000819242575	FE	On-Demand	Anodyne	ADRB2	28	42
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(Cl)cc1	ZINC000819242575	FE	On-Demand	Anodyne	ADRB1	42	40
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(Cl)cc1	ZINC000819242576	FE	On-Demand	Anodyne	ADRB2	28	42
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccc(Cl)cc1	ZINC000819242576	FE	On-Demand	Anodyne	ADRB1	42	40
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccccc1	ZINC000819242604	DD	On-Demand	Anodyne	ADRB2	45	48
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccccc1	ZINC000819242604	DD	On-Demand	Anodyne	ADRB1	65	46
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccccc1	ZINC000819242604	DD	On-Demand	Anodyne	ADRB3	42	46
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccccc1	ZINC000819242605	DD	On-Demand	Anodyne	ADRB2	45	48
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccccc1	ZINC000819242605	DD	On-Demand	Anodyne	ADRB1	65	46
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccccc1	ZINC000819242605	DD	On-Demand	Anodyne	ADRB3	42	46
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccc(F)c1	ZINC000819242620	FG	On-Demand	Anodyne	ADRB2	41	42
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccc(F)c1	ZINC000819242620	FG	On-Demand	Anodyne	ADRB1	47	49
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccc(F)c1	ZINC000819242620	FG	On-Demand	Anodyne	ADRB3	105	49
O[C@@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1	ZINC000819242621	FH	On-Demand	Anodyne	SCD1	25	44
O[C@@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1	ZINC000819242621	FH	On-Demand	Anodyne	SFRP1	104	36
O[C@@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1	ZINC000819242621	FH	On-Demand	Anodyne	SCD	24	44
O[C@@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1	ZINC000819242621	FH	On-Demand	Anodyne	WNT3	66	36
O[C@@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1F	ZINC000819242691	FH	On-Demand	Anodyne	SFRP1	46	33
O[C@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1F	ZINC000819242692	FH	On-Demand	Anodyne	SFRP1	46	33
O[C@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1F	ZINC000819242693	FH	On-Demand	Anodyne	SFRP1	46	33
O[C@@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccccc1F	ZINC000819242694	FH	On-Demand	Anodyne	SFRP1	46	33
O[C@@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccc(F)c(F)c1	ZINC000819242695	GH	On-Demand	Anodyne	SFRP1	88	33
O[C@@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccc(F)c(F)c1	ZINC000819242695	GH	On-Demand	Anodyne	WNT3	64	33
O[C@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccc(F)c(F)c1	ZINC000819242696	GH	On-Demand	Anodyne	SFRP1	88	33
O[C@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccc(F)c(F)c1	ZINC000819242696	GH	On-Demand	Anodyne	WNT3	64	33
O[C@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccc(F)c(F)c1	ZINC000819242697	GH	On-Demand	Anodyne	SFRP1	88	33
O[C@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccc(F)c(F)c1	ZINC000819242697	GH	On-Demand	Anodyne	WNT3	64	33
O[C@@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccc(F)c(F)c1	ZINC000819242698	GH	On-Demand	Anodyne	SFRP1	88	33
O[C@@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccc(F)c(F)c1	ZINC000819242698	GH	On-Demand	Anodyne	WNT3	64	33
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccc(F)c1	ZINC000819242721	FG	On-Demand	Anodyne	ADRB2	41	42
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccc(F)c1	ZINC000819242721	FG	On-Demand	Anodyne	ADRB1	47	49
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccc(F)c1	ZINC000819242721	FG	On-Demand	Anodyne	ADRB3	105	49
Cc1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)c(C)c1	ZINC000819242729	ED	On-Demand	Anodyne	ADRB2	15	41
Cc1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)c(C)c1	ZINC000819242730	ED	On-Demand	Anodyne	ADRB2	15	41
CC(=O)c1cccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)c1	ZINC000819242768	FD	On-Demand	Anodyne	ADRB2	29	42
CC(=O)c1cccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)c1	ZINC000819242768	FD	On-Demand	Anodyne	ADRB1	52	37
CC(=O)c1cccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)c1	ZINC000819242768	FD	On-Demand	Anodyne	ABCB1	15	43
CC(=O)c1cccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)c1	ZINC000819242768	FD	On-Demand	Anodyne	PDS	55	35
CC(=O)c1cccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)c1	ZINC000819242769	FD	On-Demand	Anodyne	ADRB2	29	42
CC(=O)c1cccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)c1	ZINC000819242769	FD	On-Demand	Anodyne	ADRB1	52	37
CC(=O)c1cccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)c1	ZINC000819242769	FD	On-Demand	Anodyne	ABCB1	15	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)c1	ZINC000819242769	FD	On-Demand	Anodyne	PDS	55	35
COc1cccc([S@@](=O)CC(=O)NCC(=O)OC(C)C)c1	ZINC000819242832	DC	On-Demand	Anodyne	MTNR1A	36	43
COc1cccc([S@@](=O)CC(=O)NCC(=O)OC(C)C)c1	ZINC000819242832	DC	On-Demand	Anodyne	MTNR1B	36	43
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccnc1	ZINC000819242833	EE	On-Demand	Anodyne	ADRB2	50	49
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccnc1	ZINC000819242833	EE	On-Demand	Anodyne	ADRB1	63	48
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccnc1	ZINC000819242833	EE	On-Demand	Anodyne	ADRB3	153	51
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccnc1	ZINC000819242835	EE	On-Demand	Anodyne	ADRB2	50	49
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccnc1	ZINC000819242835	EE	On-Demand	Anodyne	ADRB1	63	48
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccnc1	ZINC000819242835	EE	On-Demand	Anodyne	ADRB3	153	51
O[C@@H](CNCc1cccc(N2CCOCC2)n1)c1cccnc1	ZINC000819242852	DD	On-Demand	Anodyne	ADRB3	79	39
O[C@H](CNCc1cccc(N2CCOCC2)n1)c1cccnc1	ZINC000819242853	DD	On-Demand	Anodyne	ADRB3	79	39
O[C@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccc(F)cc1	ZINC000819242869	FH	On-Demand	Anodyne	SFRP1	51	33
O[C@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccc(F)cc1	ZINC000819242870	FH	On-Demand	Anodyne	SFRP1	51	33
O[C@@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccc(F)cc1	ZINC000819242871	FH	On-Demand	Anodyne	SFRP1	51	33
O[C@@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1ccc(F)cc1	ZINC000819242872	FH	On-Demand	Anodyne	SFRP1	51	33
CON(C)C(=O)CCN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000819242894	EE	On-Demand	Anodyne	SFRP1	104	37
CON(C)C(=O)CCN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000819242894	EE	On-Demand	Anodyne	WNT3	68	37
CON(C)C(=O)CCN[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000819242895	EE	On-Demand	Anodyne	SFRP1	104	37
CON(C)C(=O)CCN[C@H]1CCN(c2ccccc2C(F)(F)F)C1	ZINC000819242895	EE	On-Demand	Anodyne	WNT3	68	37
CC(=O)Nc1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819242925	FD	On-Demand	Anodyne	ADRB2	43	52
CC(=O)Nc1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819242925	FD	On-Demand	Anodyne	ADRB1	75	52
CC(=O)Nc1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819242925	FD	On-Demand	Anodyne	GRIN1	18	41
CC(=O)Nc1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819242925	FD	On-Demand	Anodyne	ADRB3	49	52
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819242926	FD	On-Demand	Anodyne	ADRB2	43	52
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819242926	FD	On-Demand	Anodyne	ADRB1	75	52
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819242926	FD	On-Demand	Anodyne	GRIN1	18	41
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819242926	FD	On-Demand	Anodyne	ADRB3	49	52
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(Cl)c(F)c1	ZINC000819242933	GH	On-Demand	Anodyne	ADRB1	30	45
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(Cl)c(F)c1	ZINC000819242933	GH	On-Demand	Anodyne	ADRB3	54	45
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(Cl)c(F)c1	ZINC000819242934	GH	On-Demand	Anodyne	ADRB1	30	45
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(Cl)c(F)c1	ZINC000819242934	GH	On-Demand	Anodyne	ADRB3	54	45
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1cccc(Br)c1	ZINC000819242961	GE	On-Demand	Anodyne	PDS	43	37
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1cccc(Br)c1	ZINC000819242963	GE	On-Demand	Anodyne	PDS	43	37
CC(=O)c1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819242977	FD	On-Demand	Anodyne	ADRB2	33	41
CC(=O)c1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819242977	FD	On-Demand	Anodyne	ADRB1	57	40
CC(=O)c1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819242977	FD	On-Demand	Anodyne	ADRB3	34	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819242978	FD	On-Demand	Anodyne	ADRB2	33	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819242978	FD	On-Demand	Anodyne	ADRB1	57	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819242978	FD	On-Demand	Anodyne	ADRB3	34	40
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccc(OCC(F)(F)F)nc2)cc1	ZINC000819242987	GF	On-Demand	Bother	ADRB2	24	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccc(OCC(F)(F)F)nc2)cc1	ZINC000819242987	GF	On-Demand	Bother	ADRB1	29	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccc(OCC(F)(F)F)nc2)cc1	ZINC000819242987	GF	On-Demand	Bother	ADRB3	72	42
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccc(OCC(F)(F)F)nc2)cc1	ZINC000819242989	GF	On-Demand	Bother	ADRB2	24	42
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccc(OCC(F)(F)F)nc2)cc1	ZINC000819242989	GF	On-Demand	Bother	ADRB1	29	42
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccc(OCC(F)(F)F)nc2)cc1	ZINC000819242989	GF	On-Demand	Bother	ADRB3	72	42
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2cccnc2)cc1F	ZINC000819243017	FD	On-Demand	Anodyne	ADRB2	22	40
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2cccnc2)cc1F	ZINC000819243017	FD	On-Demand	Anodyne	ADRB1	26	42
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2cccnc2)cc1F	ZINC000819243017	FD	On-Demand	Anodyne	ADRB3	96	43
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2cccnc2)cc1F	ZINC000819243018	FD	On-Demand	Anodyne	ADRB2	22	40
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2cccnc2)cc1F	ZINC000819243018	FD	On-Demand	Anodyne	ADRB1	26	42
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2cccnc2)cc1F	ZINC000819243018	FD	On-Demand	Anodyne	ADRB3	96	43
COC(=O)[C@@H](CNC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)Cc1ccc(O)cc1	ZINC000819243027	GD	On-Demand	Anodyne	PAPA1_CARPA	29	47
COC(=O)[C@H](CNC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)Cc1ccc(O)cc1	ZINC000819243029	GD	On-Demand	Anodyne	PAPA1_CARPA	29	47
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccc2ccccc12	ZINC000819243061	GI	On-Demand	Anodyne	ADRB1	39	42
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cccc2ccccc12	ZINC000819243061	GI	On-Demand	Anodyne	ADRB3	51	42
O=C(C(F)=C1CCC1)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000819243115	EH	On-Demand	Anodyne	CPT1A	38	41
O=C(C(F)=C1CCC1)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000819243115	EH	On-Demand	Anodyne	GRM5	21	49
O=C(C(F)=C1CCC1)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000819243115	EH	On-Demand	Anodyne	SMO	47	47
O=C(C(F)=C1CCC1)N1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000819243115	EH	On-Demand	Anodyne	ETHR	77	59
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2ccccc2)cc1F	ZINC000819243122	FE	On-Demand	Anodyne	ADRB3	42	38
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2ccccc2)cc1F	ZINC000819243123	FE	On-Demand	Anodyne	ADRB3	42	38
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(F)cc1F	ZINC000819243137	GG	On-Demand	Anodyne	ADRB1	27	41
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(F)cc1F	ZINC000819243137	GG	On-Demand	Anodyne	ADRB3	27	41
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(F)cc1F	ZINC000819243138	GG	On-Demand	Anodyne	ADRB1	27	41
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(F)cc1F	ZINC000819243138	GG	On-Demand	Anodyne	ADRB3	27	41
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(F)c(F)c1	ZINC000819243145	GG	On-Demand	Anodyne	ADRB1	31	45
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(F)c(F)c1	ZINC000819243145	GG	On-Demand	Anodyne	ADRB3	67	45
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(F)c(F)c1	ZINC000819243146	GG	On-Demand	Anodyne	ADRB1	31	45
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccc(F)c(F)c1	ZINC000819243146	GG	On-Demand	Anodyne	ADRB3	67	45
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2ccc(F)cc2)cc1F	ZINC000819243150	GE	On-Demand	Anodyne	CDK1	17	40
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2ccc(F)cc2)cc1F	ZINC000819243151	GE	On-Demand	Anodyne	CDK1	17	40
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1c(F)cccc1F	ZINC000819243154	GG	On-Demand	Anodyne	ADRB1	23	40
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1c(F)cccc1F	ZINC000819243154	GG	On-Demand	Anodyne	ADRB3	42	40
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1c(F)cccc1F	ZINC000819243155	GG	On-Demand	Anodyne	ADRB1	23	40
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1c(F)cccc1F	ZINC000819243155	GG	On-Demand	Anodyne	ADRB3	42	40
CCOc1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819243162	FD	On-Demand	Anodyne	ADRB2	35	44
CCOc1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819243162	FD	On-Demand	Anodyne	ADRB1	48	39
CCOc1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819243162	FD	On-Demand	Anodyne	ADRB3	29	40
CCOc1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819243163	FD	On-Demand	Anodyne	ADRB2	35	44
CCOc1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819243163	FD	On-Demand	Anodyne	ADRB1	48	39
CCOc1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819243163	FD	On-Demand	Anodyne	ADRB3	29	40
CN1CCC(CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819243166	FE	On-Demand	Mild	PAPA1_CARPA	31	43
CN1CCC(CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819243167	FE	On-Demand	Mild	PAPA1_CARPA	31	43
COc1cccc(OC)c1OC[C@H](O)CNCc1nc(C(F)(F)F)n[nH]1	ZINC000819243192	GD	On-Demand	Anodyne	ADRB2	23	41
COc1cccc(OC)c1OC[C@@H](O)CNCc1nc(C(F)(F)F)n[nH]1	ZINC000819243193	GD	On-Demand	Anodyne	ADRB2	23	41
O=S1(=O)CCCN1c1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1F	ZINC000819243196	GE	On-Demand	Anodyne	ADRB3	20	40
O=S1(=O)CCCN1c1ccc(CNC[C@H](O)c2cccc(F)c2)cc1F	ZINC000819243197	GE	On-Demand	Anodyne	ADRB3	20	40
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccccc1C(F)(F)F	ZINC000819243198	GE	On-Demand	Anodyne	ADRB2	22	40
O[C@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccccc1C(F)(F)F	ZINC000819243198	GE	On-Demand	Anodyne	ADRB1	57	36
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccccc1C(F)(F)F	ZINC000819243199	GE	On-Demand	Anodyne	ADRB2	22	40
O[C@@H](CNCc1nc(C(F)(F)F)n[nH]1)COc1ccccc1C(F)(F)F	ZINC000819243199	GE	On-Demand	Anodyne	ADRB1	57	36
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cc(F)ccc1F	ZINC000819243202	GG	On-Demand	Anodyne	ADRB1	22	41
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cc(F)ccc1F	ZINC000819243202	GG	On-Demand	Anodyne	ADRB3	29	41
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cc(F)ccc1F	ZINC000819243203	GG	On-Demand	Anodyne	ADRB1	22	41
O[C@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1cc(F)ccc1F	ZINC000819243203	GG	On-Demand	Anodyne	ADRB3	29	41
Cc1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819243206	ED	On-Demand	Anodyne	ADRB2	37	46
Cc1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819243206	ED	On-Demand	Anodyne	ADRB1	49	40
Cc1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819243206	ED	On-Demand	Anodyne	ADRB3	29	40
Cc1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819243207	ED	On-Demand	Anodyne	ADRB2	37	46
Cc1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819243207	ED	On-Demand	Anodyne	ADRB1	49	40
Cc1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819243207	ED	On-Demand	Anodyne	ADRB3	29	40
O=C(CCNCc1nc(C(F)(F)F)n[nH]1)Nc1cccc(C(F)(F)F)c1	ZINC000819243216	GF	On-Demand	Anodyne	KIT	18	44
O=C(CCNCc1nc(C(F)(F)F)n[nH]1)Nc1cccc(C(F)(F)F)c1	ZINC000819243216	GF	On-Demand	Anodyne	KDR	20	45
O=C(CCNCc1nc(C(F)(F)F)n[nH]1)Nc1cccc(C(F)(F)F)c1	ZINC000819243216	GF	On-Demand	Anodyne	TEK	30	41
O=C(CCNCc1nc(C(F)(F)F)n[nH]1)Nc1cccc(C(F)(F)F)c1	ZINC000819243216	GF	On-Demand	Anodyne	EPHB4	22	41
O=C(CCNCc1nc(C(F)(F)F)n[nH]1)Nc1cccc(C(F)(F)F)c1	ZINC000819243216	GF	On-Demand	Anodyne	RIPK1	49	41
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccccc1Cl	ZINC000819243223	FH	On-Demand	Anodyne	ADRB2	27	40
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccccc1Cl	ZINC000819243223	FH	On-Demand	Anodyne	ADRB1	40	43
O[C@@H](CNCCc1ccc(OCC(F)(F)F)nc1)c1ccccc1Cl	ZINC000819243223	FH	On-Demand	Anodyne	ADRB3	46	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(OCc3ccncc3)cc1)C2	ZINC000819243226	GG	On-Demand	Anodyne	ADAM17	21	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(OCc3ccncc3)cc1)C2	ZINC000819243227	GG	On-Demand	Anodyne	ADAM17	21	44
CSc1ccc(OC[C@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819243232	FE	On-Demand	Anodyne	ADRB2	25	42
CSc1ccc(OC[C@@H](O)CNCc2nc(C(F)(F)F)n[nH]2)cc1	ZINC000819243233	FE	On-Demand	Anodyne	ADRB2	25	42
O=C(CCNCc1nc(C(F)(F)F)n[nH]1)Nc1cccc(Br)c1	ZINC000819243236	GF	On-Demand	Anodyne	HDAC6	23	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCOc1ccccc1OC)C2	ZINC000819243237	GE	On-Demand	Anodyne	HTR1A	15	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCOc1ccccc1OC)C2	ZINC000819243237	GE	On-Demand	Anodyne	DRD2	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCOc1ccccc1OC)C2	ZINC000819243237	GE	On-Demand	Anodyne	DRD3	22	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCOc1ccccc1OC)C2	ZINC000819243238	GE	On-Demand	Anodyne	HTR1A	15	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCOc1ccccc1OC)C2	ZINC000819243238	GE	On-Demand	Anodyne	DRD2	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCOc1ccccc1OC)C2	ZINC000819243238	GE	On-Demand	Anodyne	DRD3	22	40
CCO[C@@H]1C[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@H]1Oc1ccccc1	ZINC000819243255	FF	On-Demand	Bother	CACNA1D	50	34
CCO[C@@H]1C[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@H]1Oc1ccccc1	ZINC000819243256	FF	On-Demand	Bother	CACNA1D	50	34
CCO[C@@H]1C[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@@H]1Oc1ccccc1	ZINC000819243257	FF	On-Demand	Bother	CACNA1D	50	34
CCO[C@@H]1C[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)[C@H]1Oc1ccccc1	ZINC000819243258	FF	On-Demand	Bother	CACNA1D	50	34
CC(=O)Nc1cccc(OCCNC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819243287	DD	On-Demand	Anodyne	MTNR1A	21	42
CC(=O)Nc1cccc(OCCNC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819243287	DD	On-Demand	Anodyne	MTNR1B	18	42
CC(=O)Nc1cccc(OCCNC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819243287	DD	On-Demand	Anodyne	EPHX2	18	40
CC(=O)Nc1cccc(OCCNC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819243288	DD	On-Demand	Anodyne	MTNR1A	21	42
CC(=O)Nc1cccc(OCCNC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819243288	DD	On-Demand	Anodyne	MTNR1B	18	42
CC(=O)Nc1cccc(OCCNC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819243288	DD	On-Demand	Anodyne	EPHX2	18	40
CC(=O)Nc1cccc(OCCNC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819243289	DD	On-Demand	Anodyne	MTNR1A	21	42
CC(=O)Nc1cccc(OCCNC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819243289	DD	On-Demand	Anodyne	MTNR1B	18	42
CC(=O)Nc1cccc(OCCNC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819243289	DD	On-Demand	Anodyne	EPHX2	18	40
CC(=O)Nc1cccc(OCCNC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819243290	DD	On-Demand	Anodyne	MTNR1A	21	42
CC(=O)Nc1cccc(OCCNC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819243290	DD	On-Demand	Anodyne	MTNR1B	18	42
CC(=O)Nc1cccc(OCCNC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819243290	DD	On-Demand	Anodyne	EPHX2	18	40
O[C@@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)C1CC1	ZINC000819243291	DF	On-Demand	Anodyne	SFRP1	87	35
O[C@@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)C1CC1	ZINC000819243291	DF	On-Demand	Anodyne	WNT3	48	35
O[C@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)C1CC1	ZINC000819243292	DF	On-Demand	Anodyne	SFRP1	87	35
O[C@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)C1CC1	ZINC000819243292	DF	On-Demand	Anodyne	WNT3	48	35
O[C@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)C1CC1	ZINC000819243293	DF	On-Demand	Anodyne	SFRP1	87	35
O[C@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)C1CC1	ZINC000819243293	DF	On-Demand	Anodyne	WNT3	48	35
O[C@@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)C1CC1	ZINC000819243294	DF	On-Demand	Anodyne	SFRP1	87	35
O[C@@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)C1CC1	ZINC000819243294	DF	On-Demand	Anodyne	WNT3	48	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCOc1cccc(NC(C)=O)c1)C2	ZINC000819243311	GE	On-Demand	Anodyne	MTNR1A	23	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCOc1cccc(NC(C)=O)c1)C2	ZINC000819243311	GE	On-Demand	Anodyne	MTNR1B	22	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCOc1cccc(NC(C)=O)c1)C2	ZINC000819243311	GE	On-Demand	Anodyne	EPHX2	19	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCOc1cccc(NC(C)=O)c1)C2	ZINC000819243312	GE	On-Demand	Anodyne	MTNR1A	23	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCOc1cccc(NC(C)=O)c1)C2	ZINC000819243312	GE	On-Demand	Anodyne	MTNR1B	22	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCOc1cccc(NC(C)=O)c1)C2	ZINC000819243312	GE	On-Demand	Anodyne	EPHX2	19	42
CCN(C)C(=O)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819243314	CD	On-Demand	Anodyne	ADRB2	16	44
CCN(C)C(=O)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819243314	CD	On-Demand	Anodyne	ADRB1	38	50
CCN(C)C(=O)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819243314	CD	On-Demand	Anodyne	ADRB3	58	47
CCN(C)C(=O)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819243315	CD	On-Demand	Anodyne	ADRB2	16	44
CCN(C)C(=O)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819243315	CD	On-Demand	Anodyne	ADRB1	38	50
CCN(C)C(=O)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819243315	CD	On-Demand	Anodyne	ADRB3	58	47
O[C@@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cccnc1	ZINC000819243328	FG	On-Demand	Anodyne	ADRB3	44	49
O[C@@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cccnc1	ZINC000819243328	FG	On-Demand	Anodyne	SCD1	27	42
O[C@@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cccnc1	ZINC000819243328	FG	On-Demand	Anodyne	SCD	31	42
O[C@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cccnc1	ZINC000819243329	FG	On-Demand	Anodyne	ADRB3	44	49
O[C@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cccnc1	ZINC000819243329	FG	On-Demand	Anodyne	SCD1	27	42
O[C@H](CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cccnc1	ZINC000819243329	FG	On-Demand	Anodyne	SCD	31	42
O[C@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cccnc1	ZINC000819243330	FG	On-Demand	Anodyne	ADRB3	44	49
O[C@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cccnc1	ZINC000819243330	FG	On-Demand	Anodyne	SCD1	27	42
O[C@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cccnc1	ZINC000819243330	FG	On-Demand	Anodyne	SCD	31	42
O[C@@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cccnc1	ZINC000819243331	FG	On-Demand	Anodyne	ADRB3	44	49
O[C@@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cccnc1	ZINC000819243331	FG	On-Demand	Anodyne	SCD1	27	42
O[C@@H](CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1)c1cccnc1	ZINC000819243331	FG	On-Demand	Anodyne	SCD	31	42
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCN(c3ccccc3C(F)(F)F)C2)cc1	ZINC000819243376	GH	On-Demand	Bother	SFRP1	67	34
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)cc1	ZINC000819243377	GH	On-Demand	Bother	SFRP1	67	34
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCN(c3ccccc3C(F)(F)F)C2)cc1	ZINC000819243378	GH	On-Demand	Bother	SFRP1	67	34
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)cc1	ZINC000819243379	GH	On-Demand	Bother	SFRP1	67	34
CC(=O)Nc1cccc(OCCNC(=O)C(F)=C2CCC2)c1	ZINC000819243384	DF	On-Demand	Anodyne	HRH2	26	43
CC(=O)Nc1cccc(OCCNC(=O)C(F)=C2CCC2)c1	ZINC000819243384	DF	On-Demand	Anodyne	MTNR1A	34	48
CC(=O)Nc1cccc(OCCNC(=O)C(F)=C2CCC2)c1	ZINC000819243384	DF	On-Demand	Anodyne	MTNR1B	32	48
Cn1c(S)nnc1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819243402	GD	On-Demand	Mild	PAPA1_CARPA	40	47
Cn1c(S)nnc1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819243403	GD	On-Demand	Mild	PAPA1_CARPA	40	47
CCO[C@@H]1C[C@@H](NCCC(=O)Nc2ccc(N(C)C)cc2)[C@H]1Oc1ccccc1	ZINC000819243423	GG	On-Demand	Anodyne	TIMP3	41	38
CCO[C@@H]1C[C@H](NCCC(=O)Nc2ccc(N(C)C)cc2)[C@H]1Oc1ccccc1	ZINC000819243424	GG	On-Demand	Anodyne	TIMP3	41	38
CCO[C@@H]1C[C@H](NCCC(=O)Nc2ccc(N(C)C)cc2)[C@@H]1Oc1ccccc1	ZINC000819243425	GG	On-Demand	Anodyne	TIMP3	41	38
CCO[C@@H]1C[C@@H](NCCC(=O)Nc2ccc(N(C)C)cc2)[C@@H]1Oc1ccccc1	ZINC000819243426	GG	On-Demand	Anodyne	TIMP3	41	38
COc1cccc([S@@](=O)CC(=O)NCCc2nnc(S)n2C)c1	ZINC000819243459	FC	On-Demand	Anodyne	DRD4	40	31
COc1cccc([S@@](=O)CC(=O)NCCc2nnc(S)n2C)c1	ZINC000819243459	FC	On-Demand	Anodyne	MTNR1A	50	38
COc1cccc([S@@](=O)CC(=O)NCCc2nnc(S)n2C)c1	ZINC000819243459	FC	On-Demand	Anodyne	MTNR1B	48	38
CCN(C)C(=O)CNC[C@@H](O)c1cccnc1	ZINC000819243461	BC	On-Demand	Anodyne	ADRB2	22	44
CCN(C)C(=O)CNC[C@@H](O)c1cccnc1	ZINC000819243461	BC	On-Demand	Anodyne	ADRB1	25	44
CCN(C)C(=O)CNC[C@@H](O)c1cccnc1	ZINC000819243461	BC	On-Demand	Anodyne	ADRB3	97	49
CCN(C)C(=O)CNC[C@H](O)c1cccnc1	ZINC000819243462	BC	On-Demand	Anodyne	ADRB2	22	44
CCN(C)C(=O)CNC[C@H](O)c1cccnc1	ZINC000819243462	BC	On-Demand	Anodyne	ADRB1	25	44
CCN(C)C(=O)CNC[C@H](O)c1cccnc1	ZINC000819243462	BC	On-Demand	Anodyne	ADRB3	97	49
CN(CCN1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1)Cc1ccccc1	ZINC000819243487	FD	On-Demand	Anodyne	SIGMAR1	29	41
CN(CCN1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1)Cc1ccccc1	ZINC000819243487	FD	On-Demand	Anodyne	CYP2J2	43	30
CN(CCN1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1)Cc1ccccc1	ZINC000819243488	FD	On-Demand	Anodyne	SIGMAR1	29	41
CN(CCN1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1)Cc1ccccc1	ZINC000819243488	FD	On-Demand	Anodyne	CYP2J2	43	30
CN(CCN1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1)Cc1ccccc1	ZINC000819243489	FD	On-Demand	Anodyne	SIGMAR1	29	41
CN(CCN1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1)Cc1ccccc1	ZINC000819243489	FD	On-Demand	Anodyne	CYP2J2	43	30
CN(CCN1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1)Cc1ccccc1	ZINC000819243490	FD	On-Demand	Anodyne	SIGMAR1	29	41
CN(CCN1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1)Cc1ccccc1	ZINC000819243490	FD	On-Demand	Anodyne	CYP2J2	43	30
O[C@@H](CNCc1cccc(N2CCOCC2)n1)c1cccc(F)c1	ZINC000819243500	ED	On-Demand	Anodyne	PIK3CB	41	40
O[C@H](CNCc1cccc(N2CCOCC2)n1)c1cccc(F)c1	ZINC000819243501	ED	On-Demand	Anodyne	PIK3CB	41	40
CCOc1ccc(OC)cc1NC(=O)C(F)=C1CCC1	ZINC000819243515	CG	On-Demand	Anodyne	MTNR1A	32	44
CCOc1ccc(OC)cc1NC(=O)C(F)=C1CCC1	ZINC000819243515	CG	On-Demand	Anodyne	MTNR1B	33	44
C[C@@H]1Cc2ccccc2N(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819243539	FH	On-Demand	Mild	PGC	45	34
C[C@@H]1Cc2ccccc2N(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819243539	FH	On-Demand	Mild	PAPA1_CARPA	41	43
C[C@@H]1Cc2ccccc2N(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819243539	FH	On-Demand	Mild	FPR1	45	36
C[C@@H]1Cc2ccccc2N(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819243541	FH	On-Demand	Mild	PGC	45	34
C[C@@H]1Cc2ccccc2N(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819243541	FH	On-Demand	Mild	PAPA1_CARPA	41	43
C[C@@H]1Cc2ccccc2N(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819243541	FH	On-Demand	Mild	FPR1	45	36
CN1CC[C@@H](CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819243548	FD	On-Demand	Mild	PAPA1_CARPA	31	43
CN1CC[C@H](CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819243549	FD	On-Demand	Mild	PAPA1_CARPA	31	43
CN1CC[C@@H](CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819243550	FD	On-Demand	Mild	PAPA1_CARPA	31	43
CN1CC[C@H](CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819243551	FD	On-Demand	Mild	PAPA1_CARPA	31	43
O[C@@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccccc1	ZINC000819243590	DH	On-Demand	Anodyne	ADRB2	15	44
O[C@@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccccc1	ZINC000819243590	DH	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccccc1	ZINC000819243590	DH	On-Demand	Anodyne	ADRB3	39	40
O[C@@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccccc1	ZINC000819243590	DH	On-Demand	Anodyne	AOC3	15	50
O[C@@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1	ZINC000819243591	DH	On-Demand	Anodyne	ADRB2	15	44
O[C@@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1	ZINC000819243591	DH	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1	ZINC000819243591	DH	On-Demand	Anodyne	ADRB3	39	40
O[C@@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1	ZINC000819243591	DH	On-Demand	Anodyne	AOC3	15	50
O[C@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccccc1	ZINC000819243592	DH	On-Demand	Anodyne	ADRB2	15	44
O[C@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccccc1	ZINC000819243592	DH	On-Demand	Anodyne	ADRB1	27	40
O[C@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccccc1	ZINC000819243592	DH	On-Demand	Anodyne	ADRB3	39	40
O[C@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccccc1	ZINC000819243592	DH	On-Demand	Anodyne	AOC3	15	50
O[C@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1	ZINC000819243593	DH	On-Demand	Anodyne	ADRB2	15	44
O[C@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1	ZINC000819243593	DH	On-Demand	Anodyne	ADRB1	27	40
O[C@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1	ZINC000819243593	DH	On-Demand	Anodyne	ADRB3	39	40
O[C@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccccc1	ZINC000819243593	DH	On-Demand	Anodyne	AOC3	15	50
CC(=O)Nc1cccc(CC(=O)N2CCc3c(C)cccc3C2)c1	ZINC000819243597	DG	On-Demand	Anodyne	P2RY14	56	41
N#Cc1ccc([C@@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819243629	EH	On-Demand	Mild	ADRB2	54	44
N#Cc1ccc([C@@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819243629	EH	On-Demand	Mild	ADRB1	43	41
N#Cc1ccc([C@@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819243629	EH	On-Demand	Mild	ADRB3	48	41
N#Cc1ccc([C@@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819243629	EH	On-Demand	Mild	LEF	29	41
N#Cc1ccc([C@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819243630	EH	On-Demand	Mild	ADRB2	54	44
N#Cc1ccc([C@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819243630	EH	On-Demand	Mild	ADRB1	43	41
N#Cc1ccc([C@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819243630	EH	On-Demand	Mild	ADRB3	48	41
N#Cc1ccc([C@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819243630	EH	On-Demand	Mild	LEF	29	41
C[C@H]1[C@@H](NC[C@@H](O)c2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243631	EG	On-Demand	Anodyne	CCKAR	17	41
C[C@H]1[C@@H](NC[C@@H](O)c2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243631	EG	On-Demand	Anodyne	WNT3	52	38
C[C@H]1[C@H](NC[C@H](O)c2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243632	EG	On-Demand	Anodyne	CCKAR	17	41
C[C@H]1[C@H](NC[C@H](O)c2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243632	EG	On-Demand	Anodyne	WNT3	52	38
C[C@H]1[C@H](NC[C@@H](O)c2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243633	EG	On-Demand	Anodyne	CCKAR	17	41
C[C@H]1[C@H](NC[C@@H](O)c2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243633	EG	On-Demand	Anodyne	WNT3	52	38
C[C@H]1[C@@H](NC[C@H](O)c2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243634	EG	On-Demand	Anodyne	CCKAR	17	41
C[C@H]1[C@@H](NC[C@H](O)c2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243634	EG	On-Demand	Anodyne	WNT3	52	38
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)c2ccc(F)cn2)CC1	ZINC000819243640	FE	On-Demand	Anodyne	GPR119	22	40
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)c2ccc(F)cn2)CC1	ZINC000819243641	FE	On-Demand	Anodyne	GPR119	22	40
C[C@@H]1[C@@H](NC[C@H](O)c2c(F)cccc2F)CCCN1C(=O)OC(C)(C)C	ZINC000819243645	FG	On-Demand	Anodyne	GPR119	20	43
C[C@@H]1[C@@H](NC[C@@H](O)c2c(F)cccc2F)CCCN1C(=O)OC(C)(C)C	ZINC000819243646	FG	On-Demand	Anodyne	GPR119	20	43
C[C@@H]1[C@@H](NC[C@H](O)c2ccc(F)cc2F)CCCN1C(=O)OC(C)(C)C	ZINC000819243657	FG	On-Demand	Anodyne	GPR119	16	42
C[C@@H]1[C@@H](NC[C@@H](O)c2ccc(F)cc2F)CCCN1C(=O)OC(C)(C)C	ZINC000819243659	FG	On-Demand	Anodyne	GPR119	16	42
CNC(=O)COc1ccc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)cc1	ZINC000819243674	FD	On-Demand	Anodyne	HDAC8	21	45
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCCc2ccc(F)cc2)c1	ZINC000819243675	EH	On-Demand	Bother	ADRB2	67	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCCc2ccc(F)cc2)c1	ZINC000819243675	EH	On-Demand	Bother	ADRB1	70	45
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCCc2ccc(F)cc2)c1	ZINC000819243675	EH	On-Demand	Bother	ADRB3	114	45
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCCc2ccc(F)cc2)c1	ZINC000819243675	EH	On-Demand	Bother	LEF	43	38
O=[N+]([O-])c1cccc([C@H](O)CNCCCCCc2ccc(F)cc2)c1	ZINC000819243676	EH	On-Demand	Bother	ADRB2	67	42
O=[N+]([O-])c1cccc([C@H](O)CNCCCCCc2ccc(F)cc2)c1	ZINC000819243676	EH	On-Demand	Bother	ADRB1	70	45
O=[N+]([O-])c1cccc([C@H](O)CNCCCCCc2ccc(F)cc2)c1	ZINC000819243676	EH	On-Demand	Bother	ADRB3	114	45
O=[N+]([O-])c1cccc([C@H](O)CNCCCCCc2ccc(F)cc2)c1	ZINC000819243676	EH	On-Demand	Bother	LEF	43	38
O[C@H](CNCCCCCc1ccc(F)cc1)c1cccnc1	ZINC000819243681	DG	On-Demand	Anodyne	ADRB2	70	54
O[C@H](CNCCCCCc1ccc(F)cc1)c1cccnc1	ZINC000819243681	DG	On-Demand	Anodyne	ADRB1	77	51
O[C@H](CNCCCCCc1ccc(F)cc1)c1cccnc1	ZINC000819243681	DG	On-Demand	Anodyne	ADRB3	166	54
O[C@@H](CNCCCCCc1ccc(F)cc1)c1cccnc1	ZINC000819243682	DG	On-Demand	Anodyne	ADRB2	70	54
O[C@@H](CNCCCCCc1ccc(F)cc1)c1cccnc1	ZINC000819243682	DG	On-Demand	Anodyne	ADRB1	77	51
O[C@@H](CNCCCCCc1ccc(F)cc1)c1cccnc1	ZINC000819243682	DG	On-Demand	Anodyne	ADRB3	166	54
C[C@@H]1[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)CCCN1C(=O)OC(C)(C)C	ZINC000819243696	FG	On-Demand	Anodyne	WNT3	52	37
C[C@@H]1[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)CCCN1C(=O)OC(C)(C)C	ZINC000819243698	FG	On-Demand	Anodyne	WNT3	52	37
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)Cc2ccc(F)cc2)CC1	ZINC000819243706	FF	On-Demand	Anodyne	GPR119	22	42
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)Cc2ccc(F)cc2)CC1	ZINC000819243707	FF	On-Demand	Anodyne	GPR119	22	42
O[C@@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccc(Cl)cc1	ZINC000819243718	EI	On-Demand	Anodyne	ADRB1	31	41
O[C@@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccc(Cl)cc1	ZINC000819243718	EI	On-Demand	Anodyne	ADRB3	45	41
O[C@@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(Cl)cc1	ZINC000819243719	EI	On-Demand	Anodyne	ADRB1	31	41
O[C@@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(Cl)cc1	ZINC000819243719	EI	On-Demand	Anodyne	ADRB3	45	41
O[C@@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(F)c(F)c1	ZINC000819243800	EH	On-Demand	Anodyne	ADRB1	25	42
O[C@@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(F)c(F)c1	ZINC000819243800	EH	On-Demand	Anodyne	ADRB3	37	42
O[C@@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccc(F)c(F)c1	ZINC000819243801	EH	On-Demand	Anodyne	ADRB1	25	42
O[C@@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccc(F)c(F)c1	ZINC000819243801	EH	On-Demand	Anodyne	ADRB3	37	42
O[C@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccc(F)c(F)c1	ZINC000819243802	EH	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccc(F)c(F)c1	ZINC000819243802	EH	On-Demand	Anodyne	ADRB3	37	42
O[C@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(F)c(F)c1	ZINC000819243803	EH	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(F)c(F)c1	ZINC000819243803	EH	On-Demand	Anodyne	ADRB3	37	42
O[C@H](CNCCCCCc1ccc(F)cc1)c1ccc(F)cn1	ZINC000819243816	DG	On-Demand	Anodyne	ADRB2	27	40
O[C@@H](CNCCCCCc1ccc(F)cc1)c1ccc(F)cn1	ZINC000819243818	DG	On-Demand	Anodyne	ADRB2	27	40
CON(C)C(=O)CCNCCCCCc1ccc(F)cc1	ZINC000819243823	CF	On-Demand	Anodyne	S1PR2	28	40
CON(C)C(=O)CCNCCCCCc1ccc(F)cc1	ZINC000819243823	CF	On-Demand	Anodyne	LEF	59	47
C[C@@H]1[C@@H](NC[C@@H](O)COc2ccccc2F)CCCN1C(=O)OC(C)(C)C	ZINC000819243832	GF	On-Demand	Anodyne	ADRB2	25	40
C[C@@H]1[C@@H](NC[C@@H](O)COc2ccccc2F)CCCN1C(=O)OC(C)(C)C	ZINC000819243832	GF	On-Demand	Anodyne	ABCB1	22	40
C[C@@H]1[C@@H](NC[C@H](O)COc2ccccc2F)CCCN1C(=O)OC(C)(C)C	ZINC000819243833	GF	On-Demand	Anodyne	ADRB2	25	40
C[C@@H]1[C@@H](NC[C@H](O)COc2ccccc2F)CCCN1C(=O)OC(C)(C)C	ZINC000819243833	GF	On-Demand	Anodyne	ABCB1	22	40
O=C(CCc1cccc(OC(F)F)c1)NCc1nnc(S)n1C1CC1	ZINC000819243842	FF	On-Demand	Anodyne	PLA2G4A	26	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cc(C(N)=O)co2)CC1	ZINC000819243850	FD	On-Demand	Anodyne	GPR119	37	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cc(C(N)=O)co2)CC1	ZINC000819243851	FD	On-Demand	Anodyne	GPR119	37	45
C[C@@H]1[C@@H](NC[C@@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243854	EF	On-Demand	Anodyne	OPRM1	18	41
C[C@@H]1[C@@H](NC[C@@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243854	EF	On-Demand	Anodyne	CELA1	25	41
C[C@@H]1[C@@H](NC[C@@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243854	EF	On-Demand	Anodyne	PGC	52	34
C[C@@H]1[C@@H](NC[C@@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243854	EF	On-Demand	Anodyne	CTRA_BOVIN	27	41
C[C@@H]1[C@@H](NC[C@@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243854	EF	On-Demand	Anodyne	CCKAR	20	44
C[C@@H]1[C@@H](NC[C@@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243854	EF	On-Demand	Anodyne	PREP	45	36
C[C@@H]1[C@@H](NC[C@@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243854	EF	On-Demand	Anodyne	REN	65	37
C[C@@H]1[C@@H](NC[C@@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243854	EF	On-Demand	Anodyne	FPR1	45	37
C[C@@H]1[C@@H](NC[C@@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243854	EF	On-Demand	Anodyne	WNT3	42	37
C[C@@H]1[C@@H](NC[C@@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243854	EF	On-Demand	Anodyne	BRCA1	45	32
C[C@@H]1[C@@H](NC[C@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243855	EF	On-Demand	Anodyne	OPRM1	18	41
C[C@@H]1[C@@H](NC[C@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243855	EF	On-Demand	Anodyne	CELA1	25	41
C[C@@H]1[C@@H](NC[C@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243855	EF	On-Demand	Anodyne	PGC	52	34
C[C@@H]1[C@@H](NC[C@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243855	EF	On-Demand	Anodyne	CTRA_BOVIN	27	41
C[C@@H]1[C@@H](NC[C@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243855	EF	On-Demand	Anodyne	CCKAR	20	44
C[C@@H]1[C@@H](NC[C@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243855	EF	On-Demand	Anodyne	PREP	45	36
C[C@@H]1[C@@H](NC[C@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243855	EF	On-Demand	Anodyne	REN	65	37
C[C@@H]1[C@@H](NC[C@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243855	EF	On-Demand	Anodyne	FPR1	45	37
C[C@@H]1[C@@H](NC[C@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243855	EF	On-Demand	Anodyne	WNT3	42	37
C[C@@H]1[C@@H](NC[C@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243855	EF	On-Demand	Anodyne	BRCA1	45	32
C[C@@H]1[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243860	GF	On-Demand	Mild	ADRB1	28	41
C[C@@H]1[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243860	GF	On-Demand	Mild	DPP4	15	41
C[C@@H]1[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243862	GF	On-Demand	Mild	ADRB1	28	41
C[C@@H]1[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)CCCN1C(=O)OC(C)(C)C	ZINC000819243862	GF	On-Demand	Mild	DPP4	15	41
CC(C)c1ccc2c(c1)[C@H](NC[C@H](O)c1cccnc1)CC2	ZINC000819243874	CH	On-Demand	Anodyne	ADRB3	57	49
CC(C)c1ccc2c(c1)[C@@H](NC[C@H](O)c1cccnc1)CC2	ZINC000819243875	CH	On-Demand	Anodyne	ADRB3	57	49
CC(C)c1ccc2c(c1)[C@@H](NC[C@@H](O)c1cccnc1)CC2	ZINC000819243876	CH	On-Demand	Anodyne	ADRB3	57	49
CC(C)c1ccc2c(c1)[C@H](NC[C@@H](O)c1cccnc1)CC2	ZINC000819243877	CH	On-Demand	Anodyne	ADRB3	57	49
O=C(C(F)=C1CCC1)N1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1	ZINC000819243885	FF	On-Demand	Anodyne	SFRP1	120	33
O=C(C(F)=C1CCC1)N1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1	ZINC000819243885	FF	On-Demand	Anodyne	WNT3	82	33
O=C(C(F)=C1CCC1)N1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1	ZINC000819243886	FF	On-Demand	Anodyne	SFRP1	120	33
O=C(C(F)=C1CCC1)N1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1	ZINC000819243886	FF	On-Demand	Anodyne	WNT3	82	33
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)C2CC2)CC1	ZINC000819243897	CD	On-Demand	Anodyne	GPR119	28	41
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)C2CC2)CC1	ZINC000819243898	CD	On-Demand	Anodyne	GPR119	28	41
C[C@@H]1[C@@H](NC[C@H](O)c2ccccc2F)CCCN1C(=O)OC(C)(C)C	ZINC000819243903	FG	On-Demand	Anodyne	SSTR2	40	34
C[C@@H]1[C@@H](NC[C@H](O)c2ccccc2F)CCCN1C(=O)OC(C)(C)C	ZINC000819243903	FG	On-Demand	Anodyne	GPR119	17	42
C[C@@H]1[C@@H](NC[C@@H](O)c2ccccc2F)CCCN1C(=O)OC(C)(C)C	ZINC000819243905	FG	On-Demand	Anodyne	SSTR2	40	34
C[C@@H]1[C@@H](NC[C@@H](O)c2ccccc2F)CCCN1C(=O)OC(C)(C)C	ZINC000819243905	FG	On-Demand	Anodyne	GPR119	17	42
O[C@@H](CNCCCCCc1ccc(F)cc1)C1CC1	ZINC000819243958	CF	On-Demand	Anodyne	LEF	43	38
O[C@H](CNCCCCCc1ccc(F)cc1)C1CC1	ZINC000819243960	CF	On-Demand	Anodyne	LEF	43	38
C[C@@]1(CNC[C@H](O)c2cccnc2)CCCN1Cc1ccccc1	ZINC000819243978	EF	On-Demand	Anodyne	ADRB2	22	41
C[C@@]1(CNC[C@H](O)c2cccnc2)CCCN1Cc1ccccc1	ZINC000819243978	EF	On-Demand	Anodyne	ADRB1	23	40
C[C@@]1(CNC[C@H](O)c2cccnc2)CCCN1Cc1ccccc1	ZINC000819243978	EF	On-Demand	Anodyne	ADRB3	88	44
C[C@@]1(CNC[C@@H](O)c2cccnc2)CCCN1Cc1ccccc1	ZINC000819243979	EF	On-Demand	Anodyne	ADRB2	22	41
C[C@@]1(CNC[C@@H](O)c2cccnc2)CCCN1Cc1ccccc1	ZINC000819243979	EF	On-Demand	Anodyne	ADRB1	23	40
C[C@@]1(CNC[C@@H](O)c2cccnc2)CCCN1Cc1ccccc1	ZINC000819243979	EF	On-Demand	Anodyne	ADRB3	88	44
C[C@]1(CNC[C@H](O)c2cccnc2)CCCN1Cc1ccccc1	ZINC000819243980	EF	On-Demand	Anodyne	ADRB2	22	41
C[C@]1(CNC[C@H](O)c2cccnc2)CCCN1Cc1ccccc1	ZINC000819243980	EF	On-Demand	Anodyne	ADRB1	23	40
C[C@]1(CNC[C@H](O)c2cccnc2)CCCN1Cc1ccccc1	ZINC000819243980	EF	On-Demand	Anodyne	ADRB3	88	44
C[C@]1(CNC[C@@H](O)c2cccnc2)CCCN1Cc1ccccc1	ZINC000819243981	EF	On-Demand	Anodyne	ADRB2	22	41
C[C@]1(CNC[C@@H](O)c2cccnc2)CCCN1Cc1ccccc1	ZINC000819243981	EF	On-Demand	Anodyne	ADRB1	23	40
C[C@]1(CNC[C@@H](O)c2cccnc2)CCCN1Cc1ccccc1	ZINC000819243981	EF	On-Demand	Anodyne	ADRB3	88	44
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)c2c(F)cccc2F)CC1	ZINC000819243991	FG	On-Demand	Anodyne	GPR119	20	44
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)c2c(F)cccc2F)CC1	ZINC000819243993	FG	On-Demand	Anodyne	GPR119	20	44
CS(=O)(=O)c1ccc([C@H](O)CNC[C@@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243994	GG	On-Demand	Anodyne	ADRB2	19	40
CS(=O)(=O)c1ccc([C@H](O)CNC[C@@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243994	GG	On-Demand	Anodyne	PTGS2	55	41
CS(=O)(=O)c1ccc([C@H](O)CNC[C@@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243994	GG	On-Demand	Anodyne	ADRB3	68	43
CS(=O)(=O)c1ccc([C@H](O)CNC[C@@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243994	GG	On-Demand	Anodyne	CTSF	58	40
CS(=O)(=O)c1ccc([C@H](O)CNC[C@@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243994	GG	On-Demand	Anodyne	CTSK	19	40
CS(=O)(=O)c1ccc([C@H](O)CNC[C@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243996	GG	On-Demand	Anodyne	ADRB2	19	40
CS(=O)(=O)c1ccc([C@H](O)CNC[C@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243996	GG	On-Demand	Anodyne	PTGS2	55	41
CS(=O)(=O)c1ccc([C@H](O)CNC[C@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243996	GG	On-Demand	Anodyne	ADRB3	68	43
CS(=O)(=O)c1ccc([C@H](O)CNC[C@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243996	GG	On-Demand	Anodyne	CTSF	58	40
CS(=O)(=O)c1ccc([C@H](O)CNC[C@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243996	GG	On-Demand	Anodyne	CTSK	19	40
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243997	GG	On-Demand	Anodyne	ADRB2	19	40
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243997	GG	On-Demand	Anodyne	PTGS2	55	41
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243997	GG	On-Demand	Anodyne	ADRB3	68	43
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243997	GG	On-Demand	Anodyne	CTSF	58	40
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243997	GG	On-Demand	Anodyne	CTSK	19	40
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243998	GG	On-Demand	Anodyne	ADRB2	19	40
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243998	GG	On-Demand	Anodyne	PTGS2	55	41
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243998	GG	On-Demand	Anodyne	ADRB3	68	43
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243998	GG	On-Demand	Anodyne	CTSF	58	40
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@H](c2ccccc2)C(F)(F)F)cc1	ZINC000819243998	GG	On-Demand	Anodyne	CTSK	19	40
CC(=O)Nc1cccc(CC(=O)N2CCC(c3nnc(S)n3C3CC3)CC2)c1	ZINC000819244029	GF	On-Demand	Anodyne	MCHR1	22	41
Cc1ccc(OC[C@H](O)CNCC2=CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819244061	GF	On-Demand	Anodyne	ADRB2	22	43
Cc1ccc(OC[C@H](O)CNCC2=CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819244061	GF	On-Demand	Anodyne	ADRB1	40	38
Cc1ccc(OC[C@H](O)CNCC2=CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819244061	GF	On-Demand	Anodyne	ACOX1	49	32
N#Cc1cccc(OC2CCN(C(=O)C(F)=C3CCC3)CC2)c1	ZINC000819244062	DG	On-Demand	Mild	HRH1	15	45
N#Cc1cccc(OC2CCN(C(=O)C(F)=C3CCC3)CC2)c1	ZINC000819244062	DG	On-Demand	Mild	CCR3	24	45
Cc1ccc(OC[C@@H](O)CNCC2=CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819244063	GF	On-Demand	Anodyne	ADRB2	22	43
Cc1ccc(OC[C@@H](O)CNCC2=CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819244063	GF	On-Demand	Anodyne	ADRB1	40	38
Cc1ccc(OC[C@@H](O)CNCC2=CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819244063	GF	On-Demand	Anodyne	ACOX1	49	32
O[C@H](CNCC1(c2ccc(F)cc2F)CCCC1)c1cccnc1	ZINC000819244068	EG	On-Demand	Anodyne	ADRB1	20	40
O[C@H](CNCC1(c2ccc(F)cc2F)CCCC1)c1cccnc1	ZINC000819244068	EG	On-Demand	Anodyne	ADRB3	80	40
O[C@@H](CNCC1(c2ccc(F)cc2F)CCCC1)c1cccnc1	ZINC000819244070	EG	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CNCC1(c2ccc(F)cc2F)CCCC1)c1cccnc1	ZINC000819244070	EG	On-Demand	Anodyne	ADRB3	80	40
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCc2ccc(Cl)cc2F)CC1	ZINC000819244082	GH	On-Demand	Anodyne	GPR119	35	42
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCc2ccc(Cl)cc2F)CC1	ZINC000819244083	GH	On-Demand	Anodyne	GPR119	35	42
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819244087	FG	On-Demand	Anodyne	GPR119	16	44
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819244089	FG	On-Demand	Anodyne	GPR119	16	44
CN1C(=O)CCc2cc(NC(=O)C(F)=C3CCC3)ccc21	ZINC000819244120	CF	On-Demand	Anodyne	NOS1	15	41
Cc1ncsc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819244121	FF	On-Demand	Mild	PAPA1_CARPA	45	48
Cc1ncsc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819244122	FF	On-Demand	Mild	PAPA1_CARPA	45	48
COc1ccc(OC)c([C@H](O)CNC[C@@H](c2ccccc2)C(F)(F)F)c1	ZINC000819244135	FH	On-Demand	Anodyne	ADRB2	18	43
COc1ccc(OC)c([C@H](O)CNC[C@H](c2ccccc2)C(F)(F)F)c1	ZINC000819244136	FH	On-Demand	Anodyne	ADRB2	18	43
C[C@@H]1[C@@H](NC[C@H](O)COCc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244150	GF	On-Demand	Anodyne	PREP	40	36
C[C@@H]1[C@@H](NC[C@@H](O)COCc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244152	GF	On-Demand	Anodyne	PREP	40	36
C[C@H]1[C@H](NC[C@@H](O)COCc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244154	GF	On-Demand	Anodyne	PREP	40	36
C[C@H]1[C@@H](NC[C@@H](O)COCc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244156	GF	On-Demand	Anodyne	PREP	40	36
C[C@H]1[C@@H](NC[C@H](O)COCc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244158	GF	On-Demand	Anodyne	PREP	40	36
C[C@H]1[C@H](NC[C@H](O)COCc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244160	GF	On-Demand	Anodyne	PREP	40	36
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819244161	FG	On-Demand	Anodyne	GPR119	18	42
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819244163	FG	On-Demand	Anodyne	GPR119	18	42
O[C@@H](CN[C@H]1CCn2ccnc2C1)c1cccc(Br)c1	ZINC000819244166	EE	On-Demand	Anodyne	ADRB3	24	41
O[C@@H](CN[C@@H]1CCn2ccnc2C1)c1cccc(Br)c1	ZINC000819244167	EE	On-Demand	Anodyne	ADRB3	24	41
O[C@H](CN[C@H]1CCn2ccnc2C1)c1cccc(Br)c1	ZINC000819244168	EE	On-Demand	Anodyne	ADRB3	24	41
O[C@H](CN[C@@H]1CCn2ccnc2C1)c1cccc(Br)c1	ZINC000819244169	EE	On-Demand	Anodyne	ADRB3	24	41
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@H]1Cc1ccc(F)cc1	ZINC000819244170	DG	On-Demand	Anodyne	CCR3	24	42
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@H]1Cc1ccc(F)cc1	ZINC000819244170	DG	On-Demand	Anodyne	WNT3A	45	32
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@@H]1Cc1ccc(F)cc1	ZINC000819244171	DG	On-Demand	Anodyne	CCR3	24	42
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@@H]1Cc1ccc(F)cc1	ZINC000819244171	DG	On-Demand	Anodyne	WNT3A	45	32
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@@H]1Cc1ccc(F)cc1	ZINC000819244172	DG	On-Demand	Anodyne	CCR3	24	42
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@@H]1Cc1ccc(F)cc1	ZINC000819244172	DG	On-Demand	Anodyne	WNT3A	45	32
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@H]1Cc1ccc(F)cc1	ZINC000819244174	DG	On-Demand	Anodyne	CCR3	24	42
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@H]1Cc1ccc(F)cc1	ZINC000819244174	DG	On-Demand	Anodyne	WNT3A	45	32
C[C@@H]1[C@@H](NC[C@H](O)c2cc(F)ccc2F)CCCN1C(=O)OC(C)(C)C	ZINC000819244184	FG	On-Demand	Anodyne	GPR119	16	44
C[C@@H]1[C@@H](NC[C@@H](O)c2cc(F)ccc2F)CCCN1C(=O)OC(C)(C)C	ZINC000819244187	FG	On-Demand	Anodyne	GPR119	16	44
CC[C@@H](NC[C@H](O)c1cccnc1)c1cccc(S(N)(=O)=O)c1	ZINC000819244191	ED	On-Demand	Anodyne	ADRB1	31	43
CC[C@@H](NC[C@H](O)c1cccnc1)c1cccc(S(N)(=O)=O)c1	ZINC000819244191	ED	On-Demand	Anodyne	ADRB3	107	43
CC[C@@H](NC[C@@H](O)c1cccnc1)c1cccc(S(N)(=O)=O)c1	ZINC000819244195	ED	On-Demand	Anodyne	ADRB1	31	43
CC[C@@H](NC[C@@H](O)c1cccnc1)c1cccc(S(N)(=O)=O)c1	ZINC000819244195	ED	On-Demand	Anodyne	ADRB3	107	43
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819244196	GG	On-Demand	Anodyne	ADRB2	18	46
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819244196	GG	On-Demand	Anodyne	ABCB1	29	44
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819244198	GG	On-Demand	Anodyne	ADRB2	18	46
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819244198	GG	On-Demand	Anodyne	ABCB1	29	44
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1	ZINC000819244215	GD	On-Demand	Anodyne	SFRP1	108	33
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1	ZINC000819244215	GD	On-Demand	Anodyne	WNT3	72	32
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1	ZINC000819244217	GD	On-Demand	Anodyne	SFRP1	108	33
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1	ZINC000819244217	GD	On-Demand	Anodyne	WNT3	72	32
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1	ZINC000819244219	GD	On-Demand	Anodyne	SFRP1	108	33
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1	ZINC000819244219	GD	On-Demand	Anodyne	WNT3	72	32
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1	ZINC000819244221	GD	On-Demand	Anodyne	SFRP1	108	33
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1	ZINC000819244221	GD	On-Demand	Anodyne	WNT3	72	32
CC(C)(C)OC(=O)N1CC=C(CNCCC(=O)Nc2ccccc2F)CC1	ZINC000819244252	GG	On-Demand	Anodyne	GPR119	15	40
COCCO[C@@H]1COCC[C@@H]1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819244271	ED	On-Demand	Bother	CACNA1C	52	36
COCCO[C@@H]1COCC[C@@H]1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819244271	ED	On-Demand	Bother	CACNA1D	80	36
COCCO[C@@H]1COCC[C@H]1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819244273	ED	On-Demand	Bother	CACNA1C	52	36
COCCO[C@@H]1COCC[C@H]1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819244273	ED	On-Demand	Bother	CACNA1D	80	36
COCCO[C@@H]1COCC[C@@H]1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819244274	ED	On-Demand	Bother	CACNA1C	52	36
COCCO[C@@H]1COCC[C@@H]1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819244274	ED	On-Demand	Bother	CACNA1D	80	36
COCCO[C@@H]1COCC[C@H]1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819244276	ED	On-Demand	Bother	CACNA1C	52	36
COCCO[C@@H]1COCC[C@H]1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819244276	ED	On-Demand	Bother	CACNA1D	80	36
O=[N+]([O-])c1ccc([C@@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819244285	EH	On-Demand	Bother	ADRB2	55	43
O=[N+]([O-])c1ccc([C@@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819244285	EH	On-Demand	Bother	ADRB1	49	43
O=[N+]([O-])c1ccc([C@@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819244285	EH	On-Demand	Bother	ADRB3	70	40
O=[N+]([O-])c1ccc([C@@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819244285	EH	On-Demand	Bother	LEF	44	42
O=[N+]([O-])c1ccc([C@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819244287	EH	On-Demand	Bother	ADRB2	55	43
O=[N+]([O-])c1ccc([C@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819244287	EH	On-Demand	Bother	ADRB1	49	43
O=[N+]([O-])c1ccc([C@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819244287	EH	On-Demand	Bother	ADRB3	70	40
O=[N+]([O-])c1ccc([C@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819244287	EH	On-Demand	Bother	LEF	44	42
C[C@@H]1[C@@H](NC[C@H](O)c2cccnc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244301	EE	On-Demand	Anodyne	ADRB1	19	40
C[C@@H]1[C@@H](NC[C@H](O)c2cccnc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244301	EE	On-Demand	Anodyne	ADRB3	68	47
C[C@@H]1[C@@H](NC[C@@H](O)c2cccnc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244302	EE	On-Demand	Anodyne	ADRB1	19	40
C[C@@H]1[C@@H](NC[C@@H](O)c2cccnc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244302	EE	On-Demand	Anodyne	ADRB3	68	47
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819244313	FG	On-Demand	Anodyne	GPR119	18	42
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819244314	FG	On-Demand	Anodyne	GPR119	18	42
O=C(O)[C@H]1CCN(C(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)C1	ZINC000819244317	EC	On-Demand	Anodyne	PREP	61	44
O=C(O)[C@H]1CCN(C(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)C1	ZINC000819244317	EC	On-Demand	Anodyne	WNT3	41	34
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)C1	ZINC000819244318	EC	On-Demand	Anodyne	PREP	61	44
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)C1	ZINC000819244318	EC	On-Demand	Anodyne	WNT3	41	34
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)C1	ZINC000819244319	EC	On-Demand	Anodyne	PREP	61	44
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)C1	ZINC000819244319	EC	On-Demand	Anodyne	WNT3	41	34
O=C(O)[C@@H]1CCN(C(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)C1	ZINC000819244320	EC	On-Demand	Anodyne	PREP	61	44
O=C(O)[C@@H]1CCN(C(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)C1	ZINC000819244320	EC	On-Demand	Anodyne	WNT3	41	34
O=C(O)[C@H]1CCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819244329	ED	On-Demand	Anodyne	CHRM2	24	44
O=C(O)[C@H]1CCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819244329	ED	On-Demand	Anodyne	CHRM1	27	44
O=C(O)[C@H]1CCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819244329	ED	On-Demand	Anodyne	SLC6A1	85	36
O=C(O)[C@H]1CCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819244329	ED	On-Demand	Anodyne	CHRM3	47	44
O=C(O)[C@H]1CCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819244329	ED	On-Demand	Anodyne	AMY2	44	32
O=C(O)[C@H]1CCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819244329	ED	On-Demand	Anodyne	CYP2J2	44	33
O=C(O)[C@@H]1CCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819244330	ED	On-Demand	Anodyne	CHRM2	24	44
O=C(O)[C@@H]1CCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819244330	ED	On-Demand	Anodyne	CHRM1	27	44
O=C(O)[C@@H]1CCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819244330	ED	On-Demand	Anodyne	SLC6A1	85	36
O=C(O)[C@@H]1CCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819244330	ED	On-Demand	Anodyne	CHRM3	47	44
O=C(O)[C@@H]1CCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819244330	ED	On-Demand	Anodyne	AMY2	44	32
O=C(O)[C@@H]1CCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819244330	ED	On-Demand	Anodyne	CYP2J2	44	33
O=C(O)[C@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244331	DD	On-Demand	Reactive	FKBP1A	42	50
O=C(O)[C@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244331	DD	On-Demand	Reactive	CASP3	51	38
O=C(O)[C@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244331	DD	On-Demand	Reactive	MMP13	44	44
O=C(O)[C@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244331	DD	On-Demand	Reactive	ITGA4	37	47
O=C(O)[C@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244331	DD	On-Demand	Reactive	CAPNS1	21	44
O=C(O)[C@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244331	DD	On-Demand	Reactive	MMP3	52	48
O=C(O)[C@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244331	DD	On-Demand	Reactive	MMP8	34	43
O=C(O)[C@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244331	DD	On-Demand	Reactive	CAPN1	18	46
O=C(O)[C@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244331	DD	On-Demand	Reactive	CASP7	70	37
O=C(O)[C@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244331	DD	On-Demand	Reactive	MMP7	56	44
O=C(O)[C@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244331	DD	On-Demand	Reactive	MMP1	48	48
O=C(O)[C@@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244332	DD	On-Demand	Reactive	FKBP1A	42	50
O=C(O)[C@@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244332	DD	On-Demand	Reactive	CASP3	51	38
O=C(O)[C@@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244332	DD	On-Demand	Reactive	MMP13	44	44
O=C(O)[C@@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244332	DD	On-Demand	Reactive	ITGA4	37	47
O=C(O)[C@@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244332	DD	On-Demand	Reactive	CAPNS1	21	44
O=C(O)[C@@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244332	DD	On-Demand	Reactive	MMP3	52	48
O=C(O)[C@@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244332	DD	On-Demand	Reactive	MMP8	34	43
O=C(O)[C@@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244332	DD	On-Demand	Reactive	CAPN1	18	46
O=C(O)[C@@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244332	DD	On-Demand	Reactive	CASP7	70	37
O=C(O)[C@@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244332	DD	On-Demand	Reactive	MMP7	56	44
O=C(O)[C@@H]1CCCN1S(=O)(=O)c1ccc(CCCl)cc1	ZINC000819244332	DD	On-Demand	Reactive	MMP1	48	48
O=C(O)C1CCN(C(=O)C2=CCCC2)CC1	ZINC000819244333	BD	On-Demand	Anodyne	L3MBTL3	79	39
O=C(O)[C@@H]1CCCN1S(=O)(=O)/C=C\c1ccc(F)cc1	ZINC000819244337	CD	On-Demand	Anodyne	ACE	15	41
O=C(O)[C@H]1CCCN1S(=O)(=O)/C=C\c1ccc(F)cc1	ZINC000819244338	CD	On-Demand	Anodyne	ACE	15	41
O=C(O)C1CCN(C(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)CC1	ZINC000819244339	FC	On-Demand	Anodyne	CPT2	41	37
O=C(O)C1CCN(C(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)CC1	ZINC000819244339	FC	On-Demand	Anodyne	PREP	80	49
O=C(O)C1CCN(C(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)CC1	ZINC000819244339	FC	On-Demand	Anodyne	SFRP1	42	36
O=C(O)C1CCN(C(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)CC1	ZINC000819244339	FC	On-Demand	Anodyne	WNT3	49	36
O=C(O)C1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)CC1	ZINC000819244340	FC	On-Demand	Anodyne	CPT2	41	37
O=C(O)C1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)CC1	ZINC000819244340	FC	On-Demand	Anodyne	PREP	80	49
O=C(O)C1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)CC1	ZINC000819244340	FC	On-Demand	Anodyne	SFRP1	42	36
O=C(O)C1CCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)CC1	ZINC000819244340	FC	On-Demand	Anodyne	WNT3	49	36
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)/C=C\c3ccccc3)CC2)C1	ZINC000819244341	FD	On-Demand	Anodyne	SLC6A1	83	35
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)/C=C\c3ccccc3)CC2)C1	ZINC000819244341	FD	On-Demand	Anodyne	ITGAL	51	43
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)/C=C\c3ccccc3)CC2)C1	ZINC000819244341	FD	On-Demand	Anodyne	F3	17	43
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)/C=C\c3ccccc3)CC2)C1	ZINC000819244341	FD	On-Demand	Anodyne	CCR2	17	42
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)/C=C\c3ccccc3)CC2)C1	ZINC000819244342	FD	On-Demand	Anodyne	SLC6A1	83	35
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)/C=C\c3ccccc3)CC2)C1	ZINC000819244342	FD	On-Demand	Anodyne	ITGAL	51	43
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)/C=C\c3ccccc3)CC2)C1	ZINC000819244342	FD	On-Demand	Anodyne	F3	17	43
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)/C=C\c3ccccc3)CC2)C1	ZINC000819244342	FD	On-Demand	Anodyne	CCR2	17	42
O=C(O)[C@@H]1CCN(C(=O)C2=CCCC2)C1	ZINC000819244343	BD	On-Demand	Anodyne	L3MBTL3	49	36
O=C(O)[C@H]1CCN(C(=O)C2=CCCC2)C1	ZINC000819244344	BD	On-Demand	Anodyne	L3MBTL3	49	36
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244345	DD	On-Demand	Anodyne	FKBP1A	18	41
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244345	DD	On-Demand	Anodyne	SLC6A1	172	45
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244345	DD	On-Demand	Anodyne	HRH3	18	48
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244345	DD	On-Demand	Anodyne	SIGMAR1	18	47
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244345	DD	On-Demand	Anodyne	CCR5	17	40
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244345	DD	On-Demand	Anodyne	CHRNA7	41	40
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244345	DD	On-Demand	Anodyne	C3AR1	41	41
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244345	DD	On-Demand	Anodyne	SLC18A3	17	47
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244345	DD	On-Demand	Anodyne	S1PR1	18	42
O=C(O)[C@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244346	DD	On-Demand	Anodyne	FKBP1A	18	41
O=C(O)[C@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244346	DD	On-Demand	Anodyne	SLC6A1	172	45
O=C(O)[C@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244346	DD	On-Demand	Anodyne	HRH3	18	48
O=C(O)[C@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244346	DD	On-Demand	Anodyne	SIGMAR1	18	47
O=C(O)[C@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244346	DD	On-Demand	Anodyne	CCR5	17	40
O=C(O)[C@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244346	DD	On-Demand	Anodyne	CHRNA7	41	40
O=C(O)[C@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244346	DD	On-Demand	Anodyne	C3AR1	41	41
O=C(O)[C@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244346	DD	On-Demand	Anodyne	SLC18A3	17	47
O=C(O)[C@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244346	DD	On-Demand	Anodyne	S1PR1	18	42
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244347	DD	On-Demand	Anodyne	FKBP1A	18	41
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244347	DD	On-Demand	Anodyne	SLC6A1	172	45
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244347	DD	On-Demand	Anodyne	HRH3	18	48
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244347	DD	On-Demand	Anodyne	SIGMAR1	18	47
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244347	DD	On-Demand	Anodyne	CCR5	17	40
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244347	DD	On-Demand	Anodyne	CHRNA7	41	40
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244347	DD	On-Demand	Anodyne	C3AR1	41	41
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244347	DD	On-Demand	Anodyne	SLC18A3	17	47
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244347	DD	On-Demand	Anodyne	S1PR1	18	42
O=C(O)[C@@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244348	DD	On-Demand	Anodyne	FKBP1A	18	41
O=C(O)[C@@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244348	DD	On-Demand	Anodyne	SLC6A1	172	45
O=C(O)[C@@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244348	DD	On-Demand	Anodyne	HRH3	18	48
O=C(O)[C@@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244348	DD	On-Demand	Anodyne	SIGMAR1	18	47
O=C(O)[C@@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244348	DD	On-Demand	Anodyne	CCR5	17	40
O=C(O)[C@@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244348	DD	On-Demand	Anodyne	CHRNA7	41	40
O=C(O)[C@@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244348	DD	On-Demand	Anodyne	C3AR1	41	41
O=C(O)[C@@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244348	DD	On-Demand	Anodyne	SLC18A3	17	47
O=C(O)[C@@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819244348	DD	On-Demand	Anodyne	S1PR1	18	42
O=C(O)[C@@H]1CCN(C(=O)C2=CCCCO2)C1	ZINC000819244350	BC	On-Demand	Anodyne	L3MBTL3	46	35
O=C(O)[C@H]1CCN(C(=O)C2=CCCCO2)C1	ZINC000819244351	BC	On-Demand	Anodyne	L3MBTL3	46	35
O=C(O)C1CCN(C(=O)C2CC(OCc3ccccc3)C2)CC1	ZINC000819244357	DE	On-Demand	Anodyne	SLC6A1	59	33
O=C(O)C1CCN(C(=O)C2CC(OCc3ccccc3)C2)CC1	ZINC000819244357	DE	On-Demand	Anodyne	GRIN2B	48	45
O=C(O)C1CCN(C(=O)C2CC(OCc3ccccc3)C2)CC1	ZINC000819244357	DE	On-Demand	Anodyne	PREP	80	45
O=C(O)C1CCN(C(=O)C2CC(OCc3ccccc3)C2)CC1	ZINC000819244357	DE	On-Demand	Anodyne	EPHX2	17	40
O=C(O)C1CCN(C(=O)C2CC(OCc3ccccc3)C2)CC1	ZINC000819244357	DE	On-Demand	Anodyne	SLC12A5	40	37
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN(CC(F)(F)F)C2)C1	ZINC000819244358	DD	On-Demand	Anodyne	SLC6A1	159	39
O=C(O)[C@H]1CCN(C(=O)[C@H]2CCCN(CC(F)(F)F)C2)C1	ZINC000819244359	DD	On-Demand	Anodyne	SLC6A1	159	39
O=C(O)[C@@H]1CCN(C(=O)[C@H]2CCCN(CC(F)(F)F)C2)C1	ZINC000819244360	DD	On-Demand	Anodyne	SLC6A1	159	39
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN(CC(F)(F)F)C2)C1	ZINC000819244361	DD	On-Demand	Anodyne	SLC6A1	159	39
O=C(O)[C@@H]1CCN(C(=O)[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000819244366	DC	On-Demand	Anodyne	CHRM2	15	43
O=C(O)[C@@H]1CCN(C(=O)[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000819244366	DC	On-Demand	Anodyne	SLC6A1	84	35
O=C(O)[C@@H]1CCN(C(=O)[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000819244366	DC	On-Demand	Anodyne	SIGMAR1	66	41
O=C(O)[C@@H]1CCN(C(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000819244367	DC	On-Demand	Anodyne	CHRM2	15	43
O=C(O)[C@@H]1CCN(C(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000819244367	DC	On-Demand	Anodyne	SLC6A1	84	35
O=C(O)[C@@H]1CCN(C(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000819244367	DC	On-Demand	Anodyne	SIGMAR1	66	41
O=C(O)[C@H]1CCN(C(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000819244368	DC	On-Demand	Anodyne	CHRM2	15	43
O=C(O)[C@H]1CCN(C(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000819244368	DC	On-Demand	Anodyne	SLC6A1	84	35
O=C(O)[C@H]1CCN(C(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000819244368	DC	On-Demand	Anodyne	SIGMAR1	66	41
O=C(O)[C@H]1CCN(C(=O)[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000819244369	DC	On-Demand	Anodyne	CHRM2	15	43
O=C(O)[C@H]1CCN(C(=O)[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000819244369	DC	On-Demand	Anodyne	SLC6A1	84	35
O=C(O)[C@H]1CCN(C(=O)[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000819244369	DC	On-Demand	Anodyne	SIGMAR1	66	41
O=C(O)[C@H]1CCN(C(=O)C2CC(OCc3ccccc3)C2)C1	ZINC000819244374	DD	On-Demand	Anodyne	SLC6A1	107	37
O=C(O)[C@H]1CCN(C(=O)C2CC(OCc3ccccc3)C2)C1	ZINC000819244374	DD	On-Demand	Anodyne	GRIN2B	38	43
O=C(O)[C@H]1CCN(C(=O)C2CC(OCc3ccccc3)C2)C1	ZINC000819244374	DD	On-Demand	Anodyne	PREP	52	41
O=C(O)[C@@H]1CCN(C(=O)C2CC(OCc3ccccc3)C2)C1	ZINC000819244375	DD	On-Demand	Anodyne	SLC6A1	107	37
O=C(O)[C@@H]1CCN(C(=O)C2CC(OCc3ccccc3)C2)C1	ZINC000819244375	DD	On-Demand	Anodyne	GRIN2B	38	43
O=C(O)[C@@H]1CCN(C(=O)C2CC(OCc3ccccc3)C2)C1	ZINC000819244375	DD	On-Demand	Anodyne	PREP	52	41
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)COc2ccccc2F)CC1	ZINC000819244377	GF	On-Demand	Anodyne	ADRB1	45	35
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)COc2ccccc2F)CC1	ZINC000819244377	GF	On-Demand	Anodyne	ABCB1	27	44
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)COc2ccccc2F)CC1	ZINC000819244378	GF	On-Demand	Anodyne	ADRB1	45	35
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)COc2ccccc2F)CC1	ZINC000819244378	GF	On-Demand	Anodyne	ABCB1	27	44
O=C(O)[C@H]1CCN(C(=O)[C@H]2CCCN2Cc2ccccn2)C1	ZINC000819244382	DC	On-Demand	Anodyne	SLC6A1	93	35
O=C(O)[C@H]1CCN(C(=O)[C@H]2CCCN2Cc2ccccn2)C1	ZINC000819244382	DC	On-Demand	Anodyne	PREP	69	42
O=C(O)[C@H]1CCN(C(=O)[C@H]2CCCN2Cc2ccccn2)C1	ZINC000819244382	DC	On-Demand	Anodyne	SFRP1	52	37
O=C(O)[C@H]1CCN(C(=O)[C@H]2CCCN2Cc2ccccn2)C1	ZINC000819244382	DC	On-Demand	Anodyne	WNT3	51	39
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2Cc2ccccn2)C1	ZINC000819244384	DC	On-Demand	Anodyne	SLC6A1	93	35
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2Cc2ccccn2)C1	ZINC000819244384	DC	On-Demand	Anodyne	PREP	69	42
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2Cc2ccccn2)C1	ZINC000819244384	DC	On-Demand	Anodyne	SFRP1	52	37
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2Cc2ccccn2)C1	ZINC000819244384	DC	On-Demand	Anodyne	WNT3	51	39
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2Cc2ccccn2)C1	ZINC000819244386	DC	On-Demand	Anodyne	SLC6A1	93	35
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2Cc2ccccn2)C1	ZINC000819244386	DC	On-Demand	Anodyne	PREP	69	42
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2Cc2ccccn2)C1	ZINC000819244386	DC	On-Demand	Anodyne	SFRP1	52	37
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2Cc2ccccn2)C1	ZINC000819244386	DC	On-Demand	Anodyne	WNT3	51	39
O=C(O)[C@@H]1CCN(C(=O)[C@H]2CCCN2Cc2ccccn2)C1	ZINC000819244388	DC	On-Demand	Anodyne	SLC6A1	93	35
O=C(O)[C@@H]1CCN(C(=O)[C@H]2CCCN2Cc2ccccn2)C1	ZINC000819244388	DC	On-Demand	Anodyne	PREP	69	42
O=C(O)[C@@H]1CCN(C(=O)[C@H]2CCCN2Cc2ccccn2)C1	ZINC000819244388	DC	On-Demand	Anodyne	SFRP1	52	37
O=C(O)[C@@H]1CCN(C(=O)[C@H]2CCCN2Cc2ccccn2)C1	ZINC000819244388	DC	On-Demand	Anodyne	WNT3	51	39
COc1cccc([S@@](=O)CC(=O)N2CCc3c(C)cccc3C2)c1	ZINC000819244405	EF	On-Demand	Anodyne	DRD4	44	35
COCCO[C@@H]1COCC[C@@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819244411	ED	On-Demand	Anodyne	ADRB1	27	40
COCCO[C@@H]1COCC[C@@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819244411	ED	On-Demand	Anodyne	ADRB3	42	41
COCCO[C@@H]1COCC[C@@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819244411	ED	On-Demand	Anodyne	IGF1R	27	42
COCCO[C@@H]1COCC[C@@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819244411	ED	On-Demand	Anodyne	CYP3A4	49	42
COCCO[C@@H]1COCC[C@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819244413	ED	On-Demand	Anodyne	ADRB1	27	40
COCCO[C@@H]1COCC[C@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819244413	ED	On-Demand	Anodyne	ADRB3	42	41
COCCO[C@@H]1COCC[C@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819244413	ED	On-Demand	Anodyne	IGF1R	27	42
COCCO[C@@H]1COCC[C@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819244413	ED	On-Demand	Anodyne	CYP3A4	49	42
COCCO[C@@H]1COCC[C@@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819244415	ED	On-Demand	Anodyne	ADRB1	27	40
COCCO[C@@H]1COCC[C@@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819244415	ED	On-Demand	Anodyne	ADRB3	42	41
COCCO[C@@H]1COCC[C@@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819244415	ED	On-Demand	Anodyne	IGF1R	27	42
COCCO[C@@H]1COCC[C@@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819244415	ED	On-Demand	Anodyne	CYP3A4	49	42
COCCO[C@@H]1COCC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819244416	ED	On-Demand	Anodyne	ADRB1	27	40
COCCO[C@@H]1COCC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819244416	ED	On-Demand	Anodyne	ADRB3	42	41
COCCO[C@@H]1COCC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819244416	ED	On-Demand	Anodyne	IGF1R	27	42
COCCO[C@@H]1COCC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819244416	ED	On-Demand	Anodyne	CYP3A4	49	42
CC[C@@H](O)CNCC1=CCN(C(=O)OC(C)(C)C)CC1	ZINC000819244434	CD	On-Demand	Anodyne	GPR119	22	40
O[C@@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccc(C(F)(F)F)cc1	ZINC000819244447	GJ	On-Demand	Anodyne	MTTP	53	39
O[C@@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(C(F)(F)F)cc1	ZINC000819244449	GJ	On-Demand	Anodyne	MTTP	53	39
O[C@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccc(C(F)(F)F)cc1	ZINC000819244451	GJ	On-Demand	Anodyne	MTTP	53	39
O[C@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(C(F)(F)F)cc1	ZINC000819244453	GJ	On-Demand	Anodyne	MTTP	53	39
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)c2cccnc2)CC1	ZINC000819244458	EE	On-Demand	Anodyne	ADRB1	20	41
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)c2cccnc2)CC1	ZINC000819244458	EE	On-Demand	Anodyne	ADRB3	73	41
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819244459	EE	On-Demand	Anodyne	ADRB1	20	41
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819244459	EE	On-Demand	Anodyne	ADRB3	73	41
CC(C)(C)OC(=O)N1CC=C(CNCCC(=O)Nc2cccnc2)CC1	ZINC000819244462	FF	On-Demand	Anodyne	NAMPT	23	40
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)COc2ccccc2)CC1	ZINC000819244475	FF	On-Demand	Anodyne	ADRB2	37	44
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)COc2ccccc2)CC1	ZINC000819244475	FF	On-Demand	Anodyne	ADRB1	58	41
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)COc2ccccc2)CC1	ZINC000819244475	FF	On-Demand	Anodyne	ADRB3	38	41
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)COc2ccccc2)CC1	ZINC000819244475	FF	On-Demand	Anodyne	ABCB1	26	42
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)COc2ccccc2)CC1	ZINC000819244476	FF	On-Demand	Anodyne	ADRB2	37	44
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)COc2ccccc2)CC1	ZINC000819244476	FF	On-Demand	Anodyne	ADRB1	58	41
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)COc2ccccc2)CC1	ZINC000819244476	FF	On-Demand	Anodyne	ADRB3	38	41
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)COc2ccccc2)CC1	ZINC000819244476	FF	On-Demand	Anodyne	ABCB1	26	42
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)c2ccccc2F)CC1	ZINC000819244477	FG	On-Demand	Anodyne	GPR119	18	44
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)c2ccccc2F)CC1	ZINC000819244478	FG	On-Demand	Anodyne	GPR119	18	44
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819244529	FH	On-Demand	Anodyne	ADRB1	31	42
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819244529	FH	On-Demand	Anodyne	ADRB3	50	42
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819244529	FH	On-Demand	Anodyne	CYP3A4	40	33
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819244530	FH	On-Demand	Anodyne	ADRB1	31	42
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819244530	FH	On-Demand	Anodyne	ADRB3	50	42
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819244530	FH	On-Demand	Anodyne	CYP3A4	40	33
CC(C)(C)OC(=O)NCC(F)(F)CNCCC(=O)Nc1ccccc1	ZINC000819244537	FF	On-Demand	Anodyne	LTA4H	19	40
O[C@@H](CN[C@H]1CCn2ccnc2C1)c1cccc(C(F)(F)F)c1	ZINC000819244539	EF	On-Demand	Anodyne	ADRB3	20	42
O[C@@H](CN[C@@H]1CCn2ccnc2C1)c1cccc(C(F)(F)F)c1	ZINC000819244540	EF	On-Demand	Anodyne	ADRB3	20	42
O[C@H](CN[C@H]1CCn2ccnc2C1)c1cccc(C(F)(F)F)c1	ZINC000819244541	EF	On-Demand	Anodyne	ADRB3	20	42
O[C@H](CN[C@@H]1CCn2ccnc2C1)c1cccc(C(F)(F)F)c1	ZINC000819244542	EF	On-Demand	Anodyne	ADRB3	20	42
COc1ccnc(N2CCN(C(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)CC2)c1	ZINC000819244581	GD	On-Demand	Anodyne	NPBWR1	87	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cc(OC)ccn3)CC1)C2	ZINC000819244582	GD	On-Demand	Anodyne	SSTR1	52	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cc(OC)ccn3)CC1)C2	ZINC000819244582	GD	On-Demand	Anodyne	NPBWR1	87	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cc(OC)ccn3)CC1)C2	ZINC000819244583	GD	On-Demand	Anodyne	SSTR1	52	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cc(OC)ccn3)CC1)C2	ZINC000819244583	GD	On-Demand	Anodyne	NPBWR1	87	36
COCCO[C@@H]1COCC[C@@H]1NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819244601	FE	On-Demand	Anodyne	CCR2	44	43
COCCO[C@@H]1COCC[C@H]1NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819244603	FE	On-Demand	Anodyne	CCR2	44	43
COCCO[C@@H]1COCC[C@@H]1NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819244605	FE	On-Demand	Anodyne	CCR2	44	43
COCCO[C@@H]1COCC[C@H]1NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819244607	FE	On-Demand	Anodyne	CCR2	44	43
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2ccc(F)c(F)c2)CC1	ZINC000819244615	DG	On-Demand	Anodyne	CCR1	23	41
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2ccc(F)c(F)c2)CC1	ZINC000819244616	DG	On-Demand	Anodyne	CCR1	23	41
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2ccc(F)c(F)c2)CC1	ZINC000819244618	DG	On-Demand	Anodyne	CCR1	23	41
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2ccc(F)c(F)c2)CC1	ZINC000819244620	DG	On-Demand	Anodyne	CCR1	23	41
CC(=O)Nc1cccc(CC(=O)NCc2nnc(S)n2C2CC2)c1	ZINC000819244640	ED	On-Demand	Anodyne	MCHR1	22	40
CC(C)n1cnnc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819244647	FE	On-Demand	Mild	PAPA1_CARPA	44	47
CC(C)n1cnnc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819244650	FE	On-Demand	Mild	PAPA1_CARPA	44	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(Oc2cccc(C#N)c2)CC1	ZINC000819244665	GF	On-Demand	Mild	EPHX2	17	48
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)c2cc(F)ccc2F)CC1	ZINC000819244708	FG	On-Demand	Anodyne	GPR119	19	46
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)c2cc(F)ccc2F)CC1	ZINC000819244710	FG	On-Demand	Anodyne	GPR119	19	46
CNC(=O)COc1ccc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819244722	GD	On-Demand	Anodyne	HDAC8	21	41
CNC(=O)COc1ccc(NC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819244724	GD	On-Demand	Anodyne	HDAC8	21	41
O=C(/C=C/[C@@H]1CCCO1)N1CCC(COc2ccccc2)CC1	ZINC000819244753	DG	On-Demand	Anodyne	GRIN2B	27	44
O=C(/C=C/[C@@H]1CCCO1)N1CCC(COc2ccccc2)CC1	ZINC000819244753	DG	On-Demand	Anodyne	SIGMAR1	15	46
O=C(/C=C/[C@@H]1CCCO1)N1CCC(COc2ccccc2)CC1	ZINC000819244753	DG	On-Demand	Anodyne	CPT1A	56	38
O=C(/C=C/[C@@H]1CCCO1)N1CCC(COc2ccccc2)CC1	ZINC000819244753	DG	On-Demand	Anodyne	CPT2	41	38
O=C(/C=C\[C@H]1CCCO1)N1CCC(COc2ccccc2)CC1	ZINC000819244755	DG	On-Demand	Anodyne	GRIN2B	27	44
O=C(/C=C\[C@H]1CCCO1)N1CCC(COc2ccccc2)CC1	ZINC000819244755	DG	On-Demand	Anodyne	SIGMAR1	15	46
O=C(/C=C\[C@H]1CCCO1)N1CCC(COc2ccccc2)CC1	ZINC000819244755	DG	On-Demand	Anodyne	CPT1A	56	38
O=C(/C=C\[C@H]1CCCO1)N1CCC(COc2ccccc2)CC1	ZINC000819244755	DG	On-Demand	Anodyne	CPT2	41	38
O=C(/C=C/[C@H]1CCCO1)N1CCC(COc2ccccc2)CC1	ZINC000819244757	DG	On-Demand	Anodyne	GRIN2B	27	44
O=C(/C=C/[C@H]1CCCO1)N1CCC(COc2ccccc2)CC1	ZINC000819244757	DG	On-Demand	Anodyne	SIGMAR1	15	46
O=C(/C=C/[C@H]1CCCO1)N1CCC(COc2ccccc2)CC1	ZINC000819244757	DG	On-Demand	Anodyne	CPT1A	56	38
O=C(/C=C/[C@H]1CCCO1)N1CCC(COc2ccccc2)CC1	ZINC000819244757	DG	On-Demand	Anodyne	CPT2	41	38
CNS(=O)(=O)c1cccc(NC(=O)CNC(=O)C(F)=C2CCC2)c1	ZINC000819244759	FD	On-Demand	Anodyne	CA4	18	50
O=C(/C=C\[C@@H]1CCCO1)N1CCC(COc2ccccc2)CC1	ZINC000819244760	DG	On-Demand	Anodyne	GRIN2B	27	44
O=C(/C=C\[C@@H]1CCCO1)N1CCC(COc2ccccc2)CC1	ZINC000819244760	DG	On-Demand	Anodyne	SIGMAR1	15	46
O=C(/C=C\[C@@H]1CCCO1)N1CCC(COc2ccccc2)CC1	ZINC000819244760	DG	On-Demand	Anodyne	CPT1A	56	38
O=C(/C=C\[C@@H]1CCCO1)N1CCC(COc2ccccc2)CC1	ZINC000819244760	DG	On-Demand	Anodyne	CPT2	41	38
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000819244771	GF	On-Demand	Anodyne	ADRB1	40	39
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000819244771	GF	On-Demand	Anodyne	GPR119	17	40
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000819244773	GF	On-Demand	Anodyne	ADRB1	40	39
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000819244773	GF	On-Demand	Anodyne	GPR119	17	40
COc1cc(Br)ccc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819244812	GG	On-Demand	Bother	CACNA1C	43	34
COc1cc(Br)ccc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819244812	GG	On-Demand	Bother	CACNA1D	64	34
COc1cc(Br)ccc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819244814	GG	On-Demand	Bother	CACNA1C	43	34
COc1cc(Br)ccc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819244814	GG	On-Demand	Bother	CACNA1D	64	34
CC(C)(C)OC(=O)NCC(F)(F)CNCCS(=O)(=O)c1ccccc1	ZINC000819244826	GE	On-Demand	Anodyne	SFRP1	45	37
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819244836	GG	On-Demand	Anodyne	ADRB2	80	61
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819244836	GG	On-Demand	Anodyne	ADRB1	67	49
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819244836	GG	On-Demand	Anodyne	PTGS2	27	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819244836	GG	On-Demand	Anodyne	ADRB3	127	46
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819244836	GG	On-Demand	Anodyne	LEF	54	44
CS(=O)(=O)c1ccc([C@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819244838	GG	On-Demand	Anodyne	ADRB2	80	61
CS(=O)(=O)c1ccc([C@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819244838	GG	On-Demand	Anodyne	ADRB1	67	49
CS(=O)(=O)c1ccc([C@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819244838	GG	On-Demand	Anodyne	PTGS2	27	40
CS(=O)(=O)c1ccc([C@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819244838	GG	On-Demand	Anodyne	ADRB3	127	46
CS(=O)(=O)c1ccc([C@H](O)CNCCCCCc2ccc(F)cc2)cc1	ZINC000819244838	GG	On-Demand	Anodyne	LEF	54	44
O[C@@H](CN[C@H]1CCn2ccnc2C1)c1ccccc1	ZINC000819244843	CD	On-Demand	Anodyne	ADRB3	43	39
O[C@@H](CN[C@@H]1CCn2ccnc2C1)c1ccccc1	ZINC000819244845	CD	On-Demand	Anodyne	ADRB3	43	39
O[C@H](CN[C@H]1CCn2ccnc2C1)c1ccccc1	ZINC000819244846	CD	On-Demand	Anodyne	ADRB3	43	39
O[C@H](CN[C@@H]1CCn2ccnc2C1)c1ccccc1	ZINC000819244848	CD	On-Demand	Anodyne	ADRB3	43	39
C#CCNC(=O)CN1CCCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819244857	GC	On-Demand	Mild	KCNJ1	62	42
O[C@H](CN[C@@H]1CCn2ccnc2C1)c1ccc(Cl)c(F)c1	ZINC000819244885	DE	On-Demand	Anodyne	ADRB3	22	40
O[C@H](CN[C@@H]1CCn2ccnc2C1)c1ccc(Cl)c(F)c1	ZINC000819244885	DE	On-Demand	Anodyne	MAPK1	47	40
O[C@@H](CN[C@H]1CCn2ccnc2C1)c1ccc(Cl)c(F)c1	ZINC000819244886	DE	On-Demand	Anodyne	ADRB3	22	40
O[C@@H](CN[C@H]1CCn2ccnc2C1)c1ccc(Cl)c(F)c1	ZINC000819244886	DE	On-Demand	Anodyne	MAPK1	47	40
O[C@@H](CN[C@@H]1CCn2ccnc2C1)c1ccc(Cl)c(F)c1	ZINC000819244888	DE	On-Demand	Anodyne	ADRB3	22	40
O[C@@H](CN[C@@H]1CCn2ccnc2C1)c1ccc(Cl)c(F)c1	ZINC000819244888	DE	On-Demand	Anodyne	MAPK1	47	40
O[C@H](CN[C@H]1CCn2ccnc2C1)c1ccc(Cl)c(F)c1	ZINC000819244890	DE	On-Demand	Anodyne	ADRB3	22	40
O[C@H](CN[C@H]1CCn2ccnc2C1)c1ccc(Cl)c(F)c1	ZINC000819244890	DE	On-Demand	Anodyne	MAPK1	47	40
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCn3ccnc3C2)c1	ZINC000819244902	DD	On-Demand	Bother	ADRB3	25	41
CC(C)(C)OC(=O)N1CC=C(CNC[C@H](O)c2ccc(F)cc2F)CC1	ZINC000819244903	FG	On-Demand	Anodyne	GPR119	18	44
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCn3ccnc3C2)c1	ZINC000819244904	DD	On-Demand	Bother	ADRB3	25	41
CC(C)(C)OC(=O)N1CC=C(CNC[C@@H](O)c2ccc(F)cc2F)CC1	ZINC000819244905	FG	On-Demand	Anodyne	GPR119	18	44
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCn3ccnc3C2)c1	ZINC000819244906	DD	On-Demand	Bother	ADRB3	25	41
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCn3ccnc3C2)c1	ZINC000819244908	DD	On-Demand	Bother	ADRB3	25	41
C[C@@H]1[C@@H](NC[C@@H](O)COc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244937	FF	On-Demand	Anodyne	ADRB2	43	45
C[C@@H]1[C@@H](NC[C@@H](O)COc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244937	FF	On-Demand	Anodyne	ADRB1	59	40
C[C@@H]1[C@@H](NC[C@@H](O)COc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244937	FF	On-Demand	Anodyne	ADRB3	45	40
C[C@@H]1[C@@H](NC[C@@H](O)COc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244937	FF	On-Demand	Anodyne	CPT1A	77	35
C[C@@H]1[C@@H](NC[C@@H](O)COc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244937	FF	On-Demand	Anodyne	WNT3	41	36
C[C@@H]1[C@@H](NC[C@H](O)COc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244938	FF	On-Demand	Anodyne	ADRB2	43	45
C[C@@H]1[C@@H](NC[C@H](O)COc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244938	FF	On-Demand	Anodyne	ADRB1	59	40
C[C@@H]1[C@@H](NC[C@H](O)COc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244938	FF	On-Demand	Anodyne	ADRB3	45	40
C[C@@H]1[C@@H](NC[C@H](O)COc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244938	FF	On-Demand	Anodyne	CPT1A	77	35
C[C@@H]1[C@@H](NC[C@H](O)COc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244938	FF	On-Demand	Anodyne	WNT3	41	36
O[C@@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1cccc(F)c1	ZINC000819244953	EH	On-Demand	Anodyne	ADRB1	27	42
O[C@@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1cccc(F)c1	ZINC000819244953	EH	On-Demand	Anodyne	ADRB3	39	42
O[C@@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1cccc(F)c1	ZINC000819244954	EH	On-Demand	Anodyne	ADRB1	27	42
O[C@@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1cccc(F)c1	ZINC000819244954	EH	On-Demand	Anodyne	ADRB3	39	42
O[C@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1cccc(F)c1	ZINC000819244955	EH	On-Demand	Anodyne	ADRB1	27	42
O[C@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1cccc(F)c1	ZINC000819244955	EH	On-Demand	Anodyne	ADRB3	39	42
O[C@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1cccc(F)c1	ZINC000819244956	EH	On-Demand	Anodyne	ADRB1	27	42
O[C@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1cccc(F)c1	ZINC000819244956	EH	On-Demand	Anodyne	ADRB3	39	42
O[C@@H](CN[C@H]1CCn2ccnc2C1)c1ccc(Cl)cc1	ZINC000819244957	CE	On-Demand	Anodyne	ADRB3	22	48
O[C@@H](CN[C@@H]1CCn2ccnc2C1)c1ccc(Cl)cc1	ZINC000819244958	CE	On-Demand	Anodyne	ADRB3	22	48
CCCN(C(=O)c1cc2c(cn1)OCCO2)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819244970	GF	On-Demand	Anodyne	GPR119	41	38
CCCN(C(=O)c1cc2c(cn1)OCCO2)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819244971	GF	On-Demand	Anodyne	GPR119	41	38
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819244975	FG	On-Demand	Anodyne	ADRB1	45	47
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819244975	FG	On-Demand	Anodyne	ADRB3	61	47
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819244976	FG	On-Demand	Anodyne	ADRB1	45	47
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819244976	FG	On-Demand	Anodyne	ADRB3	61	47
C[C@H]1[C@H](NCCS(=O)(=O)c2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244999	GF	On-Demand	Anodyne	SFRP1	104	42
C[C@H]1[C@H](NCCS(=O)(=O)c2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819244999	GF	On-Demand	Anodyne	WNT3	80	42
C[C@H]1[C@@H](NCCS(=O)(=O)c2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819245001	GF	On-Demand	Anodyne	SFRP1	104	42
C[C@H]1[C@@H](NCCS(=O)(=O)c2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819245001	GF	On-Demand	Anodyne	WNT3	80	42
C[C@@H]1[C@@H](NCCS(=O)(=O)c2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819245002	GF	On-Demand	Anodyne	SFRP1	104	42
C[C@@H]1[C@@H](NCCS(=O)(=O)c2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819245002	GF	On-Demand	Anodyne	WNT3	80	42
C#CCNC(=O)CN1CCCN(C(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819245026	GC	On-Demand	Mild	DRD4	44	34
C#CCNC(=O)CN1CCCN(C(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819245027	GC	On-Demand	Mild	DRD4	44	34
O=C(C(F)=C1CCC1)N1CCC(COc2ccccc2)CC1	ZINC000819245047	DH	On-Demand	Anodyne	GRIN2B	35	46
O=C(C(F)=C1CCC1)N1CCC(COc2ccccc2)CC1	ZINC000819245047	DH	On-Demand	Anodyne	SIGMAR1	18	49
O=C(C(F)=C1CCC1)N1CCC(COc2ccccc2)CC1	ZINC000819245047	DH	On-Demand	Anodyne	CPT1A	37	40
O=C(C(F)=C1CCC1)N1CCC(COc2ccccc2)CC1	ZINC000819245047	DH	On-Demand	Anodyne	CPT2	35	40
O=C(C(F)=C1CCC1)N1CCC(COc2ccccc2)CC1	ZINC000819245047	DH	On-Demand	Anodyne	CHRNA10	58	40
O[C@@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(Cl)c(F)c1	ZINC000819245067	FI	On-Demand	Anodyne	ADRB1	27	42
O[C@@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(Cl)c(F)c1	ZINC000819245067	FI	On-Demand	Anodyne	ADRB3	33	42
O[C@@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccc(Cl)c(F)c1	ZINC000819245068	FI	On-Demand	Anodyne	ADRB1	27	42
O[C@@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccc(Cl)c(F)c1	ZINC000819245068	FI	On-Demand	Anodyne	ADRB3	33	42
O[C@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccc(Cl)c(F)c1	ZINC000819245069	FI	On-Demand	Anodyne	ADRB1	27	42
O[C@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1ccc(Cl)c(F)c1	ZINC000819245069	FI	On-Demand	Anodyne	ADRB3	33	42
O[C@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(Cl)c(F)c1	ZINC000819245070	FI	On-Demand	Anodyne	ADRB1	27	42
O[C@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1ccc(Cl)c(F)c1	ZINC000819245070	FI	On-Demand	Anodyne	ADRB3	33	42
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H](c2ccccc2)C(F)(F)F)c1	ZINC000819245075	FH	On-Demand	Bother	ADRB3	41	37
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H](c2ccccc2)C(F)(F)F)c1	ZINC000819245076	FH	On-Demand	Bother	ADRB3	41	37
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H](c2ccccc2)C(F)(F)F)c1	ZINC000819245077	FH	On-Demand	Bother	ADRB3	41	37
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H](c2ccccc2)C(F)(F)F)c1	ZINC000819245078	FH	On-Demand	Bother	ADRB3	41	37
O[C@@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819245083	EI	On-Demand	Anodyne	ADRB2	22	44
O[C@@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819245083	EI	On-Demand	Anodyne	ADRB1	45	53
O[C@@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819245083	EI	On-Demand	Anodyne	ADRB3	66	53
O[C@@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819245084	EI	On-Demand	Anodyne	ADRB2	22	44
O[C@@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819245084	EI	On-Demand	Anodyne	ADRB1	45	53
O[C@@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819245084	EI	On-Demand	Anodyne	ADRB3	66	53
O[C@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819245085	EI	On-Demand	Anodyne	ADRB2	22	44
O[C@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819245085	EI	On-Demand	Anodyne	ADRB1	45	53
O[C@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819245085	EI	On-Demand	Anodyne	ADRB3	66	53
O[C@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819245086	EI	On-Demand	Anodyne	ADRB2	22	44
O[C@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819245086	EI	On-Demand	Anodyne	ADRB1	45	53
O[C@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819245086	EI	On-Demand	Anodyne	ADRB3	66	53
CC[C@@H](NCCS(C)(=O)=O)c1cccc(S(N)(=O)=O)c1	ZINC000819245087	DC	On-Demand	Anodyne	CA2	21	41
CC[C@@H](NCCS(C)(=O)=O)c1cccc(S(N)(=O)=O)c1	ZINC000819245087	DC	On-Demand	Anodyne	CAH_METTE	26	40
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819245103	FE	On-Demand	Anodyne	PAPA1_CARPA	29	48
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@H](O)Cc1ccc(F)cc1	ZINC000819245104	FE	On-Demand	Anodyne	PAPA1_CARPA	29	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCn3ccnc3C2)CC1	ZINC000819245127	FD	On-Demand	Anodyne	GPR119	46	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCn3ccnc3C2)CC1	ZINC000819245128	FD	On-Demand	Anodyne	GPR119	46	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCn3ccnc3C2)CC1	ZINC000819245129	FD	On-Demand	Anodyne	GPR119	46	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCn3ccnc3C2)CC1	ZINC000819245130	FD	On-Demand	Anodyne	GPR119	46	42
CC[C@@H](NCCS(=O)(=O)CC)c1cccc(S(N)(=O)=O)c1	ZINC000819245148	EC	On-Demand	Anodyne	CA2	24	42
CC[C@@H](NCCS(=O)(=O)CC)c1cccc(S(N)(=O)=O)c1	ZINC000819245148	EC	On-Demand	Anodyne	CA1	17	42
CC[C@@H](NCCS(=O)(=O)CC)c1cccc(S(N)(=O)=O)c1	ZINC000819245148	EC	On-Demand	Anodyne	CA4	18	40
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCC[C@H](CO)CC2)(c2ccccc2)CC1	ZINC000819245160	HH	On-Demand	Anodyne	GPR119	40	41
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCC[C@H](CO)CC2)(c2ccccc2)CC1	ZINC000819245160	HH	On-Demand	Anodyne	SFRP1	17	41
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCC[C@@H](CO)CC2)(c2ccccc2)CC1	ZINC000819245161	HH	On-Demand	Anodyne	GPR119	40	41
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCC[C@@H](CO)CC2)(c2ccccc2)CC1	ZINC000819245161	HH	On-Demand	Anodyne	SFRP1	17	41
CC#CCN(C)C(=O)[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819245166	DF	On-Demand	Mild	PAPA1_CARPA	42	41
CC#CCN(C)C(=O)[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819245166	DF	On-Demand	Mild	CTSK	17	50
CC#CCN(C)C(=O)[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819245166	DF	On-Demand	Mild	FPR1	43	35
CC#CCN(C)C(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	ZINC000819245168	DD	On-Demand	Mild	SFRP1	58	35
O=C(CNc1cccc(Cl)c1)N1CCC[C@@H](CO)CC1	ZINC000819245171	CE	On-Demand	Anodyne	PREP	17	40
O=C(CNc1cccc(Cl)c1)N1CCC[C@@H](CO)CC1	ZINC000819245171	CE	On-Demand	Anodyne	GRM5	18	41
O=C(CNc1cccc(Cl)c1)N1CCC[C@@H](CO)CC1	ZINC000819245171	CE	On-Demand	Anodyne	EPHX2	15	48
O=C(CNc1cccc(Cl)c1)N1CCC[C@@H](CO)CC1	ZINC000819245171	CE	On-Demand	Anodyne	CACNA1I	41	37
O=C(CNc1cccc(Cl)c1)N1CCC[C@H](CO)CC1	ZINC000819245172	CE	On-Demand	Anodyne	PREP	17	40
O=C(CNc1cccc(Cl)c1)N1CCC[C@H](CO)CC1	ZINC000819245172	CE	On-Demand	Anodyne	GRM5	18	41
O=C(CNc1cccc(Cl)c1)N1CCC[C@H](CO)CC1	ZINC000819245172	CE	On-Demand	Anodyne	EPHX2	15	48
O=C(CNc1cccc(Cl)c1)N1CCC[C@H](CO)CC1	ZINC000819245172	CE	On-Demand	Anodyne	CACNA1I	41	37
CC#CCN(C)C(=O)c1cc(S(=O)(=O)Nc2cccc(C)c2)ccc1Cl	ZINC000819245177	GH	On-Demand	Mild	LIMK2	30	52
CC#CCN(C)C(=O)c1ccccc1NC(=O)c1ccccc1	ZINC000819245179	DG	On-Demand	Mild	ECR	46	38
CC#CCN(C)C(=O)c1ccccc1NC(=O)c1ccccc1	ZINC000819245179	DG	On-Demand	Mild	NR1H4	15	41
CC#CCN(C)C(=O)c1ccccc1NC(=O)c1ccccc1	ZINC000819245179	DG	On-Demand	Mild	KCNK3	50	37
CC#CCN(C)C(=O)CCCN(C)C1=NS(=O)(=O)c2ccccc21	ZINC000819245190	ED	On-Demand	Mild	KCNA3	19	42
CC#CCN(C)C(=O)[C@@]1(F)CCN(C(=O)OCc2ccccc2)C1	ZINC000819245194	EE	On-Demand	Mild	SLC12A5	66	36
CC#CCN(C)C(=O)[C@]1(F)CCN(C(=O)OCc2ccccc2)C1	ZINC000819245195	EE	On-Demand	Mild	SLC12A5	66	36
CC#CCN(C)C(=O)c1c(C)oc2ccc(OC)cc12	ZINC000819245204	CF	On-Demand	Mild	MTNR1A	46	39
CC#CCN(C)C(=O)c1c(C)oc2ccc(OC)cc12	ZINC000819245204	CF	On-Demand	Mild	SLC22A12	21	41
CC#CCN(C)C(=O)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819245208	CE	On-Demand	Mild	PREP	69	51
CC#CCN(C)C(=O)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819245209	CE	On-Demand	Mild	PREP	69	51
CC#CCN(C)C(=O)c1cc(-c2cccnc2)nc2ccccc12	ZINC000819245211	DG	On-Demand	Mild	TSPO	26	41
CC#CCN(C)C(=O)c1cc(-c2cccnc2)nc2ccccc12	ZINC000819245211	DG	On-Demand	Mild	PRS	20	40
CC#CCN(C)C(=O)c1cc(-c2cccnc2)nc2ccccc12	ZINC000819245211	DG	On-Demand	Mild	TACR3	21	47
CC#CCN(C)C(=O)c1cc(-c2cccnc2)nc2ccccc12	ZINC000819245211	DG	On-Demand	Mild	MT-CO2	47	40
CC#CCN(C)C(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819245218	EF	On-Demand	Mild	SLC6A1	42	34
CC#CCN(C)C(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819245218	EF	On-Demand	Mild	CCR5	19	40
CC#CCN(C)C(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819245218	EF	On-Demand	Mild	PREP	54	48
CC#CCN(C)C(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819245218	EF	On-Demand	Mild	BIRC2	15	48
CC#CCN(C)C(=O)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819245218	EF	On-Demand	Mild	SLC12A5	49	36
CC#CCN(C)C(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819245219	EF	On-Demand	Mild	SLC6A1	42	34
CC#CCN(C)C(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819245219	EF	On-Demand	Mild	CCR5	19	40
CC#CCN(C)C(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819245219	EF	On-Demand	Mild	PREP	54	48
CC#CCN(C)C(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819245219	EF	On-Demand	Mild	BIRC2	15	48
CC#CCN(C)C(=O)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819245219	EF	On-Demand	Mild	SLC12A5	49	36
CC#CCN(C)C(=O)c1ccccc1NC(=O)c1cccc(Br)c1	ZINC000819245224	GH	On-Demand	Mild	ECR	19	43
CC#CCN(C)C(=O)c1ccccc1NC(=O)c1cccc(Br)c1	ZINC000819245224	GH	On-Demand	Mild	KCNK3	45	33
CC#CCN(C)C(=O)[C@@H](CCSC)NC(=O)OC(C)(C)C	ZINC000819245227	DE	On-Demand	Mild	PAPA1_CARPA	34	55
CC(C)(C)OC(=O)N1CCC[C@H](CC(=O)N2CCC[C@@H](CO)CC2)CC1	ZINC000819245239	FG	On-Demand	Anodyne	PREP	15	43
CC(C)(C)OC(=O)N1CCC[C@@H](CC(=O)N2CCC[C@@H](CO)CC2)CC1	ZINC000819245241	FG	On-Demand	Anodyne	PREP	15	43
CC(C)(C)OC(=O)N1CCC[C@H](CC(=O)N2CCC[C@H](CO)CC2)CC1	ZINC000819245243	FG	On-Demand	Anodyne	PREP	15	43
CC(C)(C)OC(=O)N1CCC[C@@H](CC(=O)N2CCC[C@H](CO)CC2)CC1	ZINC000819245246	FG	On-Demand	Anodyne	PREP	15	43
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(Cl)cc2F)cc1	ZINC000819245258	FF	On-Demand	Anodyne	PTGS2	30	40
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(Cl)cc2F)cc1	ZINC000819245258	FF	On-Demand	Anodyne	TRPV1	81	37
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(Cl)cc2F)cc1	ZINC000819245259	FF	On-Demand	Anodyne	PTGS2	30	40
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(Cl)cc2F)cc1	ZINC000819245259	FF	On-Demand	Anodyne	TRPV1	81	37
CC#CCN(C)C(=O)CCCCCCCC	ZINC000819245261	BG	On-Demand	Mild	CQSS	59	36
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@H](O)CN1CCc2ccccc2C1	ZINC000819245285	GE	On-Demand	Anodyne	NOD2	40	35
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819245286	GE	On-Demand	Anodyne	NOD2	40	35
COc1cccc([C@H](C#N)NC(=O)Cc2cccc(NC(C)=O)c2)c1OC	ZINC000819245321	FF	On-Demand	Mild	TSHR	41	31
COc1cccc([C@H](C#N)NC(=O)Cc2cccc(NC(C)=O)c2)c1OC	ZINC000819245321	FF	On-Demand	Mild	FLT4	16	41
COc1cccc([C@H](C#N)NC(=O)Cc2cccc(NC(C)=O)c2)c1OC	ZINC000819245321	FF	On-Demand	Mild	KCNK3	50	40
COc1cccc([C@H](C#N)NC(=O)Cc2cccc(NC(C)=O)c2)c1OC	ZINC000819245321	FF	On-Demand	Mild	KCNK9	43	40
COc1cccc([C@@H](C#N)NC(=O)Cc2cccc(NC(C)=O)c2)c1OC	ZINC000819245322	FF	On-Demand	Mild	TSHR	41	31
COc1cccc([C@@H](C#N)NC(=O)Cc2cccc(NC(C)=O)c2)c1OC	ZINC000819245322	FF	On-Demand	Mild	FLT4	16	41
COc1cccc([C@@H](C#N)NC(=O)Cc2cccc(NC(C)=O)c2)c1OC	ZINC000819245322	FF	On-Demand	Mild	KCNK3	50	40
COc1cccc([C@@H](C#N)NC(=O)Cc2cccc(NC(C)=O)c2)c1OC	ZINC000819245322	FF	On-Demand	Mild	KCNK9	43	40
COCCO[C@@H]1COCC[C@H]1NC[C@H](O)c1cccnc1	ZINC000819245334	CC	On-Demand	Anodyne	ADRB3	45	39
COCCO[C@@H]1COCC[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819245335	CC	On-Demand	Anodyne	ADRB3	45	39
COCCO[C@@H]1COCC[C@@H]1NC[C@@H](O)c1cccnc1	ZINC000819245336	CC	On-Demand	Anodyne	ADRB3	45	39
COCCO[C@@H]1COCC[C@@H]1NC[C@H](O)c1cccnc1	ZINC000819245337	CC	On-Demand	Anodyne	ADRB3	45	39
C[C@@H](c1cccc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1)N1CCOCC1	ZINC000819245341	GF	On-Demand	Anodyne	CASR	21	40
O[C@@H](CN[C@H]1CCn2ccnc2C1)c1cccc(Cl)c1	ZINC000819245344	CE	On-Demand	Anodyne	ADRB1	39	50
O[C@@H](CN[C@H]1CCn2ccnc2C1)c1cccc(Cl)c1	ZINC000819245344	CE	On-Demand	Anodyne	ADRB3	58	52
O[C@@H](CN[C@H]1CCn2ccnc2C1)c1cccc(Cl)c1	ZINC000819245344	CE	On-Demand	Anodyne	CYP3A4	47	38
O[C@@H](CN[C@@H]1CCn2ccnc2C1)c1cccc(Cl)c1	ZINC000819245345	CE	On-Demand	Anodyne	ADRB1	39	50
O[C@@H](CN[C@@H]1CCn2ccnc2C1)c1cccc(Cl)c1	ZINC000819245345	CE	On-Demand	Anodyne	ADRB3	58	52
O[C@@H](CN[C@@H]1CCn2ccnc2C1)c1cccc(Cl)c1	ZINC000819245345	CE	On-Demand	Anodyne	CYP3A4	47	38
O[C@H](CN[C@H]1CCn2ccnc2C1)c1cccc(Cl)c1	ZINC000819245346	CE	On-Demand	Anodyne	ADRB1	39	50
O[C@H](CN[C@H]1CCn2ccnc2C1)c1cccc(Cl)c1	ZINC000819245346	CE	On-Demand	Anodyne	ADRB3	58	52
O[C@H](CN[C@H]1CCn2ccnc2C1)c1cccc(Cl)c1	ZINC000819245346	CE	On-Demand	Anodyne	CYP3A4	47	38
O[C@H](CN[C@@H]1CCn2ccnc2C1)c1cccc(Cl)c1	ZINC000819245347	CE	On-Demand	Anodyne	ADRB1	39	50
O[C@H](CN[C@@H]1CCn2ccnc2C1)c1cccc(Cl)c1	ZINC000819245347	CE	On-Demand	Anodyne	ADRB3	58	52
O[C@H](CN[C@@H]1CCn2ccnc2C1)c1cccc(Cl)c1	ZINC000819245347	CE	On-Demand	Anodyne	CYP3A4	47	38
CC#CCN(C)C(=O)c1cc(-c2cc(OC)c(OC)c(OC)c2)nc2ccccc12	ZINC000819245352	HI	On-Demand	Mild	TACR3	31	43
CC#CCN(C)C(=O)[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819245354	EG	On-Demand	Mild	FPR1	44	36
CC#CCN(C)C(=O)[C@H](C)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819245355	EG	On-Demand	Mild	FPR1	44	36
CC#CCN(C)C(=O)[C@@H](C)[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819245356	EG	On-Demand	Mild	FPR1	44	36
CC#CCN(C)C(=O)[C@H](C)[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819245357	EG	On-Demand	Mild	FPR1	44	36
CC#CCN(C)C(=O)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819245366	DE	On-Demand	Mild	ACE	41	43
CC#CCN(C)C(=O)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819245366	DE	On-Demand	Mild	FKBP1A	62	43
CC#CCN(C)C(=O)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819245366	DE	On-Demand	Mild	OPRM1	21	41
CC#CCN(C)C(=O)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819245366	DE	On-Demand	Mild	CELA1	27	55
CC#CCN(C)C(=O)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819245366	DE	On-Demand	Mild	ELANE	26	41
CC#CCN(C)C(=O)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819245366	DE	On-Demand	Mild	CTRA_BOVIN	53	32
CC#CCN(C)C(=O)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819245366	DE	On-Demand	Mild	TRY1_BOVIN	57	33
CC#CCN(C)C(=O)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819245366	DE	On-Demand	Mild	PREP	108	55
CC#CCN(C)C(=O)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819245366	DE	On-Demand	Mild	CELA2A	48	32
CC#CCN(C)C(=O)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819245366	DE	On-Demand	Mild	LGMN	89	51
CC#CCN(C)C(=O)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819245366	DE	On-Demand	Mild	KLK5	27	49
CC#CCN(C)C(=O)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819245366	DE	On-Demand	Mild	SLC12A5	68	37
CC#CCN(C)C(=O)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819245366	DE	On-Demand	Mild	TMPRSS11D	41	34
CC#CCN(C)C(=O)c1cc(S(=O)(=O)N2CCc3ccccc3C2)ccc1Cl	ZINC000819245382	HG	On-Demand	Mild	AKR1C3	73	54
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	F2	17	42
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	ACE	26	45
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	SSTR2	93	47
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	GHRHR	33	50
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	P2RY12	41	36
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	MME	28	45
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	EDNRA	40	51
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	TACR1	39	56
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	PGC	41	38
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	MC4R	76	43
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	CCKAR	148	69
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	CTSL	23	55
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	PGA	20	45
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	BRS3	25	43
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	NMBR	45	43
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	MC3R	68	34
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	MC5R	64	34
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	MMP2	26	51
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	MMP8	34	51
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	GRPR	66	31
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	ECE1	67	50
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	REN	71	45
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	REN1	22	45
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	SSTR3	24	49
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	MMP11	92	36
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	CCKBR	117	63
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	GHSR	65	51
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	MMP9	25	51
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	MC1R	83	34
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	C5AR1	41	40
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	FPR1	48	51
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	CALCRL	17	48
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](CO)CC1	ZINC000819245383	HG	On-Demand	Anodyne	KISS1R	67	33
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	F2	17	42
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	ACE	26	45
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	SSTR2	93	47
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	GHRHR	33	50
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	P2RY12	41	36
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	MME	28	45
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	EDNRA	40	51
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	TACR1	39	56
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	PGC	41	38
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	MC4R	76	43
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	CCKAR	148	69
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	CTSL	23	55
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	PGA	20	45
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	BRS3	25	43
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	NMBR	45	43
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	MC3R	68	34
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	MC5R	64	34
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	MMP2	26	51
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	MMP8	34	51
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	GRPR	66	31
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	ECE1	67	50
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	REN	71	45
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	REN1	22	45
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	SSTR3	24	49
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	MMP11	92	36
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	CCKBR	117	63
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	GHSR	65	51
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	MMP9	25	51
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	MC1R	83	34
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	C5AR1	41	40
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	FPR1	48	51
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	CALCRL	17	48
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245384	HG	On-Demand	Anodyne	KISS1R	67	33
CC#CCN(C)C(=O)[C@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C	ZINC000819245412	EF	On-Demand	Mild	CFTR	50	32
CC#CCN(C)C(=O)[C@H]1Cc2ccccc2CN1C(=O)OC(C)(C)C	ZINC000819245412	EF	On-Demand	Mild	ADAM9	42	33
CC#CCN(C)C(=O)c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1	ZINC000819245422	FG	On-Demand	Mild	LIMK2	33	42
CC#CCN(C)C(=O)c1ccc(NS(=O)(=O)/C=C\c2ccccc2)cc1	ZINC000819245423	FG	On-Demand	Mild	LIMK2	33	42
O=C(c1ccc2c(c1)-c1ccccc1C2)N1CCC[C@H](CO)CC1	ZINC000819245424	DG	On-Demand	Anodyne	PREP	53	38
O=C(c1ccc2c(c1)-c1ccccc1C2)N1CCC[C@H](CO)CC1	ZINC000819245424	DG	On-Demand	Anodyne	L3MBTL3	88	47
O=C(c1ccc2c(c1)-c1ccccc1C2)N1CCC[C@@H](CO)CC1	ZINC000819245425	DG	On-Demand	Anodyne	PREP	53	38
O=C(c1ccc2c(c1)-c1ccccc1C2)N1CCC[C@@H](CO)CC1	ZINC000819245425	DG	On-Demand	Anodyne	L3MBTL3	88	47
O=C(c1ccc(N2CCOCC2)nc1)N1CCC[C@H](CO)CC1	ZINC000819245426	DD	On-Demand	Anodyne	HPGDS	15	46
O=C(c1ccc(N2CCOCC2)nc1)N1CCC[C@H](CO)CC1	ZINC000819245426	DD	On-Demand	Anodyne	L3MBTL3	61	41
O=C(c1ccc(N2CCOCC2)nc1)N1CCC[C@@H](CO)CC1	ZINC000819245427	DD	On-Demand	Anodyne	HPGDS	15	46
O=C(c1ccc(N2CCOCC2)nc1)N1CCC[C@@H](CO)CC1	ZINC000819245427	DD	On-Demand	Anodyne	L3MBTL3	61	41
O=C(CCCCN1CCCC1)N1CCC[C@H](CO)CC1	ZINC000819245442	CD	On-Demand	Anodyne	PREP	20	43
O=C(CCCCN1CCCC1)N1CCC[C@@H](CO)CC1	ZINC000819245443	CD	On-Demand	Anodyne	PREP	20	43
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)N1CCCC1	ZINC000819245474	FE	On-Demand	Mild	PAPA1_CARPA	44	52
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)N1CCCC1	ZINC000819245476	FE	On-Demand	Mild	PAPA1_CARPA	44	52
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(Cl)cc2F)CC1	ZINC000819245483	GH	On-Demand	Anodyne	CACNA1H	41	34
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(Cl)cc2F)CC1	ZINC000819245483	GH	On-Demand	Anodyne	MC4R	53	38
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(Cl)cc2F)CC1	ZINC000819245483	GH	On-Demand	Anodyne	GPR119	55	59
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(Cl)cc2F)CC1	ZINC000819245484	GH	On-Demand	Anodyne	CACNA1H	41	34
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(Cl)cc2F)CC1	ZINC000819245484	GH	On-Demand	Anodyne	MC4R	53	38
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(Cl)cc2F)CC1	ZINC000819245484	GH	On-Demand	Anodyne	GPR119	55	59
Cc1cccc2c1CCN(C(=O)Cc1ccc(-n3cnnc3)cc1)C2	ZINC000819245494	EF	On-Demand	Anodyne	KCNJ1	59	39
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@@H](O)c1cccnc1	ZINC000819245505	ED	On-Demand	Anodyne	ADRB2	22	41
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@@H](O)c1cccnc1	ZINC000819245505	ED	On-Demand	Anodyne	ADRB1	28	42
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@@H](O)c1cccnc1	ZINC000819245505	ED	On-Demand	Anodyne	ADRB3	98	43
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@H](O)c1cccnc1	ZINC000819245506	ED	On-Demand	Anodyne	ADRB2	22	41
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@H](O)c1cccnc1	ZINC000819245506	ED	On-Demand	Anodyne	ADRB1	28	42
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@H](O)c1cccnc1	ZINC000819245506	ED	On-Demand	Anodyne	ADRB3	98	43
CN(C)CCOc1ccc(CCNC(=O)C(F)=C2CCC2)cc1	ZINC000819245513	DF	On-Demand	Anodyne	LTA4H	17	40
O[C@H](CNCC1(c2ccc(F)cc2Cl)CCCC1)c1cccnc1	ZINC000819245523	EI	On-Demand	Anodyne	ADRB3	73	39
O[C@@H](CNCC1(c2ccc(F)cc2Cl)CCCC1)c1cccnc1	ZINC000819245524	EI	On-Demand	Anodyne	ADRB3	73	39
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@@H](O)Cc1ccccc1	ZINC000819245534	EE	On-Demand	Anodyne	CTSD	19	40
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@@H](O)Cc1ccccc1	ZINC000819245534	EE	On-Demand	Anodyne	PAPA1_CARPA	52	48
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@@H](O)Cc1ccccc1	ZINC000819245534	EE	On-Demand	Anodyne	CTSK	18	51
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@@H](O)Cc1ccccc1	ZINC000819245534	EE	On-Demand	Anodyne	CTSL	17	48
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@@H](O)Cc1ccccc1	ZINC000819245534	EE	On-Demand	Anodyne	TACR3	18	42
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@@H](O)Cc1ccccc1	ZINC000819245534	EE	On-Demand	Anodyne	REN	53	42
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@@H](O)Cc1ccccc1	ZINC000819245534	EE	On-Demand	Anodyne	FPR1	51	40
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@H](O)Cc1ccccc1	ZINC000819245535	EE	On-Demand	Anodyne	CTSD	19	40
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@H](O)Cc1ccccc1	ZINC000819245535	EE	On-Demand	Anodyne	PAPA1_CARPA	52	48
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@H](O)Cc1ccccc1	ZINC000819245535	EE	On-Demand	Anodyne	CTSK	18	51
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@H](O)Cc1ccccc1	ZINC000819245535	EE	On-Demand	Anodyne	CTSL	17	48
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@H](O)Cc1ccccc1	ZINC000819245535	EE	On-Demand	Anodyne	TACR3	18	42
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@H](O)Cc1ccccc1	ZINC000819245535	EE	On-Demand	Anodyne	REN	53	42
CC(C)(C)OC(=O)NCC(F)(F)CNC[C@H](O)Cc1ccccc1	ZINC000819245535	EE	On-Demand	Anodyne	FPR1	51	40
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	MME	70	36
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	ANPEP	43	32
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	TACR1	23	48
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	CTSD	18	44
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	PGC	60	44
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	CMA1	32	42
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	FCER2	72	33
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	CTSB	50	48
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	PAPA1_CARPA	89	58
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	CYSP_TRYCR	59	39
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	CCKAR	59	43
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	CTSK	37	55
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	CTSL	49	58
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	PGA	33	44
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	TACR3	24	49
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	CAPNS1	58	37
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	HLA-DRB1	45	46
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	REN	84	49
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	REN1	31	47
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	CCKBR	26	43
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	CTSS	22	58
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	CAPN1	56	47
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	CAPN2	58	39
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	ACE2	45	36
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	FPR1	74	49
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245539	EF	On-Demand	Mild	CTRB_BOVIN	59	45
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	MME	70	36
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	ANPEP	43	32
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	TACR1	23	48
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	CTSD	18	44
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	PGC	60	44
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	CMA1	32	42
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	FCER2	72	33
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	CTSB	50	48
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	PAPA1_CARPA	89	58
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	CYSP_TRYCR	59	39
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	CCKAR	59	43
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	CTSK	37	55
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	CTSL	49	58
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	PGA	33	44
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	TACR3	24	49
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	CAPNS1	58	37
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	HLA-DRB1	45	46
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	REN	84	49
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	REN1	31	47
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	CCKBR	26	43
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	CTSS	22	58
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	CAPN1	56	47
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	CAPN2	58	39
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	ACE2	45	36
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	FPR1	74	49
CC#CCN(C)C(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819245543	EF	On-Demand	Mild	CTRB_BOVIN	59	45
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)N1CCC[C@@H](CO)CC1	ZINC000819245553	GD	On-Demand	Anodyne	PREP	24	50
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)N1CCC[C@H](CO)CC1	ZINC000819245555	GD	On-Demand	Anodyne	PREP	24	50
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)N1CCC[C@@H](CO)CC1	ZINC000819245557	GD	On-Demand	Anodyne	PREP	24	50
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)N1CCC[C@H](CO)CC1	ZINC000819245559	GD	On-Demand	Anodyne	PREP	24	50
O[C@H](CN[C@@H]1CCn2ccnc2C1)c1ccc(F)c(F)c1	ZINC000819245562	CD	On-Demand	Anodyne	ADRB3	22	40
CC#CCN(C)C(=O)[C@@H]1CCCCN1C(=O)OC(C)(C)C	ZINC000819245571	CE	On-Demand	Mild	PREP	15	51
CC#CCN(C)C(=O)CCCCCCC	ZINC000819245584	BF	On-Demand	Mild	CQSS	59	36
CC#CCN(C)C(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819245585	EF	On-Demand	Mild	ACE	32	41
CC#CCN(C)C(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819245585	EF	On-Demand	Mild	FKBP1A	68	45
CC#CCN(C)C(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819245585	EF	On-Demand	Mild	CELA1	26	53
CC#CCN(C)C(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819245585	EF	On-Demand	Mild	PREP	99	53
CC#CCN(C)C(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819245585	EF	On-Demand	Mild	LGMN	83	48
CC#CCN(C)C(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819245585	EF	On-Demand	Mild	KLK5	26	47
CC#CCN(C)C(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819245585	EF	On-Demand	Mild	SLC12A5	68	38
CC#CCN(C)C(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819245586	EF	On-Demand	Mild	ACE	32	41
CC#CCN(C)C(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819245586	EF	On-Demand	Mild	FKBP1A	68	45
CC#CCN(C)C(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819245586	EF	On-Demand	Mild	CELA1	26	53
CC#CCN(C)C(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819245586	EF	On-Demand	Mild	PREP	99	53
CC#CCN(C)C(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819245586	EF	On-Demand	Mild	LGMN	83	48
CC#CCN(C)C(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819245586	EF	On-Demand	Mild	KLK5	26	47
CC#CCN(C)C(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819245586	EF	On-Demand	Mild	SLC12A5	68	38
CC#CCN(C)C(=O)C[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819245610	CD	On-Demand	Mild	ECE1	19	41
CC#CCN(C)C(=O)C[C@H](C)NC(=O)OC(C)(C)C	ZINC000819245611	CD	On-Demand	Mild	ECE1	19	41
CC(C)(C)OC(=O)N1CCc2ccc(C(=O)N3CCC[C@H](CO)CC3)cc2CC1	ZINC000819245614	HG	On-Demand	Anodyne	GPR119	42	44
CC(C)(C)OC(=O)N1CCc2ccc(C(=O)N3CCC[C@H](CO)CC3)cc2CC1	ZINC000819245614	HG	On-Demand	Anodyne	L3MBTL3	65	36
CC(C)(C)OC(=O)N1CCc2ccc(C(=O)N3CCC[C@@H](CO)CC3)cc2CC1	ZINC000819245615	HG	On-Demand	Anodyne	GPR119	42	44
CC(C)(C)OC(=O)N1CCc2ccc(C(=O)N3CCC[C@@H](CO)CC3)cc2CC1	ZINC000819245615	HG	On-Demand	Anodyne	L3MBTL3	65	36
CC#CCN(C)C(=O)c1ccc(OS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1	ZINC000819245620	HF	On-Demand	Mild	TBXA2R	23	41
CC#CCN(C)C(=O)c1cc2ccccc2oc1=O	ZINC000819245639	CD	On-Demand	Mild	MAOB	19	53
O[C@@H](CN[C@H]1CCn2ccnc2C1)c1ccc(F)c(F)c1	ZINC000819245651	CD	On-Demand	Anodyne	ADRB3	22	40
O[C@@H](CN[C@@H]1CCn2ccnc2C1)c1ccc(F)c(F)c1	ZINC000819245652	CD	On-Demand	Anodyne	ADRB3	22	40
O[C@H](CN[C@H]1CCn2ccnc2C1)c1ccc(F)c(F)c1	ZINC000819245653	CD	On-Demand	Anodyne	ADRB3	22	40
Cc1cccc2c1CCN(C(=O)C[C@H](C)n1cccn1)C2	ZINC000819245664	CF	On-Demand	Anodyne	DPP8	17	40
Cc1cccc2c1CCN(C(=O)C[C@@H](C)n1cccn1)C2	ZINC000819245665	CF	On-Demand	Anodyne	DPP8	17	40
COCCO[C@@H]1COCC[C@@H]1NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819245702	ED	On-Demand	Bother	SLC27A4	42	30
COCCO[C@@H]1COCC[C@H]1NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819245704	ED	On-Demand	Bother	SLC27A4	42	30
COCCO[C@@H]1COCC[C@@H]1NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819245706	ED	On-Demand	Bother	SLC27A4	42	30
COCCO[C@@H]1COCC[C@H]1NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819245708	ED	On-Demand	Bother	SLC27A4	42	30
CC#CCN(C)C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12	ZINC000819245713	EI	On-Demand	Mild	DHODH	33	47
CC#CCN(C)C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12	ZINC000819245713	EI	On-Demand	Mild	PRS	63	46
CC#CCN(C)C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12	ZINC000819245713	EI	On-Demand	Mild	TACR3	23	48
CC#CCN(C)C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12	ZINC000819245713	EI	On-Demand	Mild	MTTP	42	32
CC#CCN(C)C(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12	ZINC000819245713	EI	On-Demand	Mild	MT-CO2	53	46
O[C@@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1cccnc1	ZINC000819245717	DG	On-Demand	Anodyne	ADRB2	25	51
O[C@@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1cccnc1	ZINC000819245717	DG	On-Demand	Anodyne	ADRB1	32	54
O[C@@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1cccnc1	ZINC000819245717	DG	On-Demand	Anodyne	ADRB3	106	54
O[C@@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1cccnc1	ZINC000819245719	DG	On-Demand	Anodyne	ADRB2	25	51
O[C@@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1cccnc1	ZINC000819245719	DG	On-Demand	Anodyne	ADRB1	32	54
O[C@@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1cccnc1	ZINC000819245719	DG	On-Demand	Anodyne	ADRB3	106	54
CC#CCN(C)C(=O)c1ccc(Br)cc1NC(=O)c1ccc(OC)cc1	ZINC000819245720	HH	On-Demand	Mild	GPR35	64	44
O[C@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1cccnc1	ZINC000819245721	DG	On-Demand	Anodyne	ADRB2	25	51
O[C@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1cccnc1	ZINC000819245721	DG	On-Demand	Anodyne	ADRB1	32	54
O[C@H](CNC[C@H](c1ccccc1)C(F)(F)F)c1cccnc1	ZINC000819245721	DG	On-Demand	Anodyne	ADRB3	106	54
O[C@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1cccnc1	ZINC000819245722	DG	On-Demand	Anodyne	ADRB2	25	51
O[C@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1cccnc1	ZINC000819245722	DG	On-Demand	Anodyne	ADRB1	32	54
O[C@H](CNC[C@@H](c1ccccc1)C(F)(F)F)c1cccnc1	ZINC000819245722	DG	On-Demand	Anodyne	ADRB3	106	54
CC#CCN(C)C(=O)CCSc1nc2ccccc2s1	ZINC000819245732	DG	On-Demand	Mild	HMOX2	32	43
CC#CCN(C)C(=O)c1ccc(F)cc1NC(=O)c1ccc(OC)cc1	ZINC000819245742	FG	On-Demand	Mild	GPR35	26	42
CC#CCN(C)C(=O)c1ccccc1OCC(C)C	ZINC000819245781	CF	On-Demand	Mild	HCN1	43	35
CC#CCN(C)C(=O)c1cccn1C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819245783	FG	On-Demand	Mild	GPR119	39	40
O=Cc1cc(C(=O)N2CCC[C@H](CO)CC2)cs1	ZINC000819245793	CD	On-Demand	Anodyne	L3MBTL3	69	38
O=Cc1cc(C(=O)N2CCC[C@@H](CO)CC2)cs1	ZINC000819245794	CD	On-Demand	Anodyne	L3MBTL3	69	38
CC#CCN(C)C(=O)C[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819245795	EG	On-Demand	Mild	ALOX5	19	50
CC#CCN(C)C(=O)C[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819245795	EG	On-Demand	Mild	MAOB	21	42
CC#CCN(C)C(=O)C[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819245795	EG	On-Demand	Mild	LTA4H	21	40
CC#CCN(C)C(=O)C[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819245795	EG	On-Demand	Mild	FFAR1	58	54
CC#CCN(C)C(=O)C[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819245796	EG	On-Demand	Mild	ALOX5	19	50
CC#CCN(C)C(=O)C[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819245796	EG	On-Demand	Mild	MAOB	21	42
CC#CCN(C)C(=O)C[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819245796	EG	On-Demand	Mild	LTA4H	21	40
CC#CCN(C)C(=O)C[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819245796	EG	On-Demand	Mild	FFAR1	58	54
CC#CCN(C)C(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000819245812	DD	On-Demand	Mild	SLC6A9	15	51
CC#CCN(C)C(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819245836	ED	On-Demand	Mild	GRIN2B	18	40
CC#CCN(C)C(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819245836	ED	On-Demand	Mild	Q6PRC7_IXORI	38	40
CC#CCN(C)C(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819245836	ED	On-Demand	Mild	SLC12A5	51	34
CC#CCN(C)C(=O)c1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000819245837	DF	On-Demand	Mild	PDS	40	31
N#Cc1ccc(N2CCC[C@H]2C(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819245847	EE	On-Demand	Mild	PREP	55	40
N#Cc1ccc(N2CCC[C@@H]2C(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819245848	EE	On-Demand	Mild	PREP	55	40
N#Cc1ccc(N2CCC[C@@H]2C(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819245849	EE	On-Demand	Mild	PREP	55	40
N#Cc1ccc(N2CCC[C@H]2C(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819245850	EE	On-Demand	Mild	PREP	55	40
CC#CCN(C)C(=O)c1ccnc(-n2ccnc2)c1	ZINC000819245868	CD	On-Demand	Mild	NOS2	56	31
CC#CCN(C)C(=O)c1ccc(Cl)cc1NC(=O)c1ccoc1C	ZINC000819245871	EH	On-Demand	Mild	F10	20	40
CC#CCN(C)C(=O)c1nnc2ccccc2c1O	ZINC000819245877	CD	On-Demand	Mild	TSPO	15	42
CC#CCN(C)C(=O)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000819245890	FH	On-Demand	Mild	PRS	20	40
CC#CCN(C)C(=O)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000819245890	FH	On-Demand	Mild	TACR3	15	42
CC#CCN(C)C(=O)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000819245890	FH	On-Demand	Mild	MT-CO2	30	40
CC#CCN(C)C(=O)c1cn(C)nc1[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819245892	HG	On-Demand	Mild	PREP	31	40
CC#CCN(C)C(=O)c1cn(C)nc1[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819245893	HG	On-Demand	Mild	PREP	31	40
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)N1CCC[C@H](CO)CC1	ZINC000819245897	ED	On-Demand	Anodyne	PREP	26	42
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)N1CCC[C@@H](CO)CC1	ZINC000819245898	ED	On-Demand	Anodyne	PREP	26	42
CC#CCN(C)C(=O)c1ccc(OCc2ccccc2)c(OC)c1	ZINC000819245902	DG	On-Demand	Mild	PTGER1	52	38
CC#CCN(C)C(=O)c1ccc(OCc2ccccc2)c(OC)c1	ZINC000819245902	DG	On-Demand	Mild	GYS1	19	41
CC#CCN(C)C(=O)c1ccc(OCc2ccccc2)c(OC)c1	ZINC000819245902	DG	On-Demand	Mild	KLK_PIG	42	33
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000819245911	CE	On-Demand	Mild	CTSD	18	40
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000819245911	CE	On-Demand	Mild	PAPA1_CARPA	37	43
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000819245911	CE	On-Demand	Mild	CTSK	16	52
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000819245911	CE	On-Demand	Mild	ECE1	33	40
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000819245911	CE	On-Demand	Mild	REN	18	41
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000819245911	CE	On-Demand	Mild	POLG_HCV1	24	40
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000819245911	CE	On-Demand	Mild	FPR1	50	39
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819245918	GG	On-Demand	Bother	GPR119	42	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819245918	GG	On-Demand	Bother	SFRP1	60	39
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819245918	GG	On-Demand	Bother	WNT3	54	37
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819245919	GG	On-Demand	Bother	GPR119	42	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819245919	GG	On-Demand	Bother	SFRP1	60	39
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819245919	GG	On-Demand	Bother	WNT3	54	37
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819245920	GG	On-Demand	Bother	GPR119	42	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819245920	GG	On-Demand	Bother	SFRP1	60	39
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819245920	GG	On-Demand	Bother	WNT3	54	37
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819245921	GG	On-Demand	Bother	GPR119	42	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819245921	GG	On-Demand	Bother	SFRP1	60	39
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819245921	GG	On-Demand	Bother	WNT3	54	37
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccc(Cl)c(F)c1	ZINC000819245922	FG	On-Demand	Anodyne	CACNA1I	45	34
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccc(Cl)c(F)c1	ZINC000819245923	FG	On-Demand	Anodyne	CACNA1I	45	34
CC#CCN(C)C(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12	ZINC000819245935	EI	On-Demand	Mild	DHODH	38	49
CC#CCN(C)C(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12	ZINC000819245935	EI	On-Demand	Mild	PRS	45	38
CC#CCN(C)C(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12	ZINC000819245935	EI	On-Demand	Mild	TACR3	21	45
O[C@H](CNC[C@H]1CCC=CO1)COc1ccc(Oc2ccccc2)cc1	ZINC000819245953	FH	On-Demand	Anodyne	ADRB2	43	47
O[C@H](CNC[C@H]1CCC=CO1)COc1ccc(Oc2ccccc2)cc1	ZINC000819245953	FH	On-Demand	Anodyne	ADRB1	68	43
O[C@H](CNC[C@H]1CCC=CO1)COc1ccc(Oc2ccccc2)cc1	ZINC000819245953	FH	On-Demand	Anodyne	ADRB3	48	43
O[C@@H](CNC[C@H]1CCC=CO1)COc1ccc(Oc2ccccc2)cc1	ZINC000819245955	FH	On-Demand	Anodyne	ADRB2	43	47
O[C@@H](CNC[C@H]1CCC=CO1)COc1ccc(Oc2ccccc2)cc1	ZINC000819245955	FH	On-Demand	Anodyne	ADRB1	68	43
O[C@@H](CNC[C@H]1CCC=CO1)COc1ccc(Oc2ccccc2)cc1	ZINC000819245955	FH	On-Demand	Anodyne	ADRB3	48	43
O=C1CCCCN1Cc1ccc(C(=O)N2CCC[C@H](CO)CC2)cc1	ZINC000819245956	EE	On-Demand	Anodyne	L3MBTL3	92	48
O[C@H](CNC[C@@H]1CCC=CO1)COc1ccc(Oc2ccccc2)cc1	ZINC000819245957	FH	On-Demand	Anodyne	ADRB2	43	47
O[C@H](CNC[C@@H]1CCC=CO1)COc1ccc(Oc2ccccc2)cc1	ZINC000819245957	FH	On-Demand	Anodyne	ADRB1	68	43
O[C@H](CNC[C@@H]1CCC=CO1)COc1ccc(Oc2ccccc2)cc1	ZINC000819245957	FH	On-Demand	Anodyne	ADRB3	48	43
O=C1CCCCN1Cc1ccc(C(=O)N2CCC[C@@H](CO)CC2)cc1	ZINC000819245958	EE	On-Demand	Anodyne	L3MBTL3	92	48
O[C@@H](CNC[C@@H]1CCC=CO1)COc1ccc(Oc2ccccc2)cc1	ZINC000819245959	FH	On-Demand	Anodyne	ADRB2	43	47
O[C@@H](CNC[C@@H]1CCC=CO1)COc1ccc(Oc2ccccc2)cc1	ZINC000819245959	FH	On-Demand	Anodyne	ADRB1	68	43
O[C@@H](CNC[C@@H]1CCC=CO1)COc1ccc(Oc2ccccc2)cc1	ZINC000819245959	FH	On-Demand	Anodyne	ADRB3	48	43
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2F)CC1	ZINC000819245961	GF	On-Demand	Anodyne	ADRB2	39	50
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2F)CC1	ZINC000819245961	GF	On-Demand	Anodyne	ADRB1	40	50
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2F)CC1	ZINC000819245961	GF	On-Demand	Anodyne	ADRB3	29	47
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2F)CC1	ZINC000819245961	GF	On-Demand	Anodyne	ABCB1	29	47
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2F)CC1	ZINC000819245961	GF	On-Demand	Anodyne	GPR119	50	51
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2F)CC1	ZINC000819245961	GF	On-Demand	Anodyne	SFRP1	88	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2F)CC1	ZINC000819245961	GF	On-Demand	Anodyne	WNT3	69	37
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2F)CC1	ZINC000819245963	GF	On-Demand	Anodyne	ADRB2	39	50
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2F)CC1	ZINC000819245963	GF	On-Demand	Anodyne	ADRB1	40	50
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2F)CC1	ZINC000819245963	GF	On-Demand	Anodyne	ADRB3	29	47
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2F)CC1	ZINC000819245963	GF	On-Demand	Anodyne	ABCB1	29	47
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2F)CC1	ZINC000819245963	GF	On-Demand	Anodyne	GPR119	50	51
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2F)CC1	ZINC000819245963	GF	On-Demand	Anodyne	SFRP1	88	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2F)CC1	ZINC000819245963	GF	On-Demand	Anodyne	WNT3	69	37
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2F)CC1	ZINC000819245965	GF	On-Demand	Anodyne	ADRB2	39	50
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2F)CC1	ZINC000819245965	GF	On-Demand	Anodyne	ADRB1	40	50
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2F)CC1	ZINC000819245965	GF	On-Demand	Anodyne	ADRB3	29	47
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2F)CC1	ZINC000819245965	GF	On-Demand	Anodyne	ABCB1	29	47
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2F)CC1	ZINC000819245965	GF	On-Demand	Anodyne	GPR119	50	51
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2F)CC1	ZINC000819245965	GF	On-Demand	Anodyne	SFRP1	88	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2F)CC1	ZINC000819245965	GF	On-Demand	Anodyne	WNT3	69	37
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2F)CC1	ZINC000819245967	GF	On-Demand	Anodyne	ADRB2	39	50
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2F)CC1	ZINC000819245967	GF	On-Demand	Anodyne	ADRB1	40	50
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2F)CC1	ZINC000819245967	GF	On-Demand	Anodyne	ADRB3	29	47
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2F)CC1	ZINC000819245967	GF	On-Demand	Anodyne	ABCB1	29	47
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2F)CC1	ZINC000819245967	GF	On-Demand	Anodyne	GPR119	50	51
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2F)CC1	ZINC000819245967	GF	On-Demand	Anodyne	SFRP1	88	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2F)CC1	ZINC000819245967	GF	On-Demand	Anodyne	WNT3	69	37
CC#CCN(C)C(=O)c1cc(-c2ccc(OC)cc2)nc2ccccc12	ZINC000819245971	EI	On-Demand	Mild	TSPO	31	41
CC#CCN(C)C(=O)c1cc(-c2ccc(OC)cc2)nc2ccccc12	ZINC000819245971	EI	On-Demand	Mild	PRS	48	45
CC#CCN(C)C(=O)c1cc(-c2ccc(OC)cc2)nc2ccccc12	ZINC000819245971	EI	On-Demand	Mild	TACR3	26	54
CC#CCN(C)C(=O)c1cc(-c2ccc(OC)cc2)nc2ccccc12	ZINC000819245971	EI	On-Demand	Mild	MT-CO2	52	45
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2ccccc2Br)C1	ZINC000819245972	GG	On-Demand	Anodyne	SSTR2	47	36
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccccc2Br)C1	ZINC000819245974	GG	On-Demand	Anodyne	SSTR2	47	36
C/C(=C/C(=O)N1CCC[C@@H](CO)CC1)c1cccc(Cl)c1	ZINC000819245991	DG	On-Demand	Anodyne	CACNA1I	43	41
C/C(=C/C(=O)N1CCC[C@H](CO)CC1)c1cccc(Cl)c1	ZINC000819245993	DG	On-Demand	Anodyne	CACNA1I	43	41
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2ccccc2F)CC1	ZINC000819246005	GH	On-Demand	Anodyne	CCR8	57	42
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2ccccc2F)CC1	ZINC000819246005	GH	On-Demand	Anodyne	GPR119	51	46
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2ccccc2F)CC1	ZINC000819246005	GH	On-Demand	Anodyne	SFRP1	66	40
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2ccccc2F)CC1	ZINC000819246005	GH	On-Demand	Anodyne	WNT3	57	36
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2ccccc2F)CC1	ZINC000819246007	GH	On-Demand	Anodyne	CCR8	57	42
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2ccccc2F)CC1	ZINC000819246007	GH	On-Demand	Anodyne	GPR119	51	46
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2ccccc2F)CC1	ZINC000819246007	GH	On-Demand	Anodyne	SFRP1	66	40
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2ccccc2F)CC1	ZINC000819246007	GH	On-Demand	Anodyne	WNT3	57	36
CC#CCN(C)C(=O)c1cc(OCc2ccccc2)ccn1	ZINC000819246008	CF	On-Demand	Mild	MAOB	21	45
CC#CCN(C)C(=O)c1ccc(-c2nnc(S)o2)cc1	ZINC000819246011	CE	On-Demand	Mild	CYP73A16	57	40
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccnc1	ZINC000819246023	DD	On-Demand	Anodyne	ADRB2	22	45
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccnc1	ZINC000819246023	DD	On-Demand	Anodyne	ADRB1	24	45
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccnc1	ZINC000819246023	DD	On-Demand	Anodyne	ADRB3	88	45
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccnc1	ZINC000819246025	DD	On-Demand	Anodyne	ADRB2	22	45
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccnc1	ZINC000819246025	DD	On-Demand	Anodyne	ADRB1	24	45
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccnc1	ZINC000819246025	DD	On-Demand	Anodyne	ADRB3	88	45
CC#CCN(C)C(=O)[C@H](Cc1cn(Cc2ccccc2)cn1)NC(=O)OC(C)(C)C	ZINC000819246037	HF	On-Demand	Mild	PGC	54	35
CC#CCN(C)C(=O)[C@H](Cc1cn(Cc2ccccc2)cn1)NC(=O)OC(C)(C)C	ZINC000819246037	HF	On-Demand	Mild	CPB2	45	49
CC#CCN(C)C(=O)[C@H](Cc1cn(Cc2ccccc2)cn1)NC(=O)OC(C)(C)C	ZINC000819246037	HF	On-Demand	Mild	PAPA1_CARPA	45	42
CC#CCN(C)C(=O)[C@H](Cc1cn(Cc2ccccc2)cn1)NC(=O)OC(C)(C)C	ZINC000819246037	HF	On-Demand	Mild	REN	64	41
CC#CCN(C)C(=O)[C@H](Cc1cn(Cc2ccccc2)cn1)NC(=O)OC(C)(C)C	ZINC000819246037	HF	On-Demand	Mild	FPR1	49	38
CC#CCN(C)C(=O)c1cc(S(=O)(=O)N(C)Cc2ccccc2)ccc1Cl	ZINC000819246043	HG	On-Demand	Mild	LIMK2	26	41
CC#CCN(C)C(=O)c1c(-c2ccc(F)cc2)noc1C	ZINC000819246055	CF	On-Demand	Mild	GPBAR1	33	57
CC#CCN(C)C(=O)c1sccc1NC(=O)Cc1ccc(Br)cc1	ZINC000819246065	HH	On-Demand	Mild	FAS	37	51
Cc1nn(C)c(Cl)c1[C@@H]1CCCN1C(=O)CCc1cccc(OC(F)F)c1	ZINC000819246066	GI	On-Demand	Anodyne	CPT1A	76	40
Cc1nn(C)c(Cl)c1[C@H]1CCCN1C(=O)CCc1cccc(OC(F)F)c1	ZINC000819246067	GI	On-Demand	Anodyne	CPT1A	76	40
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccc(F)cc1Cl	ZINC000819246073	FG	On-Demand	Anodyne	CACNA1I	53	33
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccc(F)cc1Cl	ZINC000819246074	FG	On-Demand	Anodyne	CACNA1I	53	33
CC#CCN(C)C(=O)c1cc(Cl)nc2ccccc12	ZINC000819246080	CF	On-Demand	Mild	TSPO	37	41
CC(C)(C)OC(=O)N1CCC[C@@H](n2ccc(C(=O)N3CCC[C@H](CO)CC3)n2)C1	ZINC000819246081	HF	On-Demand	Anodyne	GPR119	41	37
CC(C)(C)OC(=O)N1CCC[C@@H](n2ccc(C(=O)N3CCC[C@@H](CO)CC3)n2)C1	ZINC000819246082	HF	On-Demand	Anodyne	GPR119	41	37
CC(C)(C)OC(=O)N1CCC[C@H](n2ccc(C(=O)N3CCC[C@H](CO)CC3)n2)C1	ZINC000819246083	HF	On-Demand	Anodyne	GPR119	41	37
CC(C)(C)OC(=O)N1CCC[C@H](n2ccc(C(=O)N3CCC[C@@H](CO)CC3)n2)C1	ZINC000819246084	HF	On-Demand	Anodyne	GPR119	41	37
CC#CCN(C)C(=O)[C@@]1(C)CCN(C(=O)OCc2ccccc2)C1	ZINC000819246086	EF	On-Demand	Mild	SLC12A5	66	36
CC#CCN(C)C(=O)[C@]1(C)CCN(C(=O)OCc2ccccc2)C1	ZINC000819246087	EF	On-Demand	Mild	SLC12A5	66	36
CC#CCN(C)C(=O)CSCCCC	ZINC000819246088	BE	On-Demand	Mild	CES1	17	42
CC#CCN(C)C(=O)CSCCCC	ZINC000819246088	BE	On-Demand	Mild	EST1_PIG	49	42
CC#CCN(C)C(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1	ZINC000819246092	GG	On-Demand	Mild	SGK1	46	32
CC#CCN(C)C(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1	ZINC000819246092	GG	On-Demand	Mild	LIMK2	26	46
CC#CCN(C)C(=O)c1ccccc1CC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819246097	GH	On-Demand	Mild	GPR119	42	45
O=C(c1ccc(C(F)(F)F)s1)N1CCC[C@@H](CO)CC1	ZINC000819246103	DG	On-Demand	Anodyne	SFRP1	42	32
O=C(c1ccc(C(F)(F)F)s1)N1CCC[C@@H](CO)CC1	ZINC000819246103	DG	On-Demand	Anodyne	L3MBTL3	41	46
O=C(c1ccc(C(F)(F)F)s1)N1CCC[C@H](CO)CC1	ZINC000819246104	DG	On-Demand	Anodyne	SFRP1	42	32
O=C(c1ccc(C(F)(F)F)s1)N1CCC[C@H](CO)CC1	ZINC000819246104	DG	On-Demand	Anodyne	L3MBTL3	41	46
CC(C)(C(=O)N1CCC[C@@H](CO)CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819246120	HH	On-Demand	Anodyne	LTA4H	22	41
CC(C)(C(=O)N1CCC[C@@H](CO)CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819246120	HH	On-Demand	Anodyne	CACNA1B	33	40
CC(C)(C(=O)N1CCC[C@H](CO)CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819246121	HH	On-Demand	Anodyne	LTA4H	22	41
CC(C)(C(=O)N1CCC[C@H](CO)CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819246121	HH	On-Demand	Anodyne	CACNA1B	33	40
CC(C)(C(=O)N1CCC[C@H](CO)CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819246122	HH	On-Demand	Anodyne	LTA4H	22	41
CC(C)(C(=O)N1CCC[C@H](CO)CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819246122	HH	On-Demand	Anodyne	CACNA1B	33	40
CC(C)(C(=O)N1CCC[C@@H](CO)CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819246123	HH	On-Demand	Anodyne	LTA4H	22	41
CC(C)(C(=O)N1CCC[C@@H](CO)CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819246123	HH	On-Demand	Anodyne	CACNA1B	33	40
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246128	FG	On-Demand	Mild	KLK3	86	38
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246128	FG	On-Demand	Mild	CTSB	65	48
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246128	FG	On-Demand	Mild	PAPA1_CARPA	64	48
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246128	FG	On-Demand	Mild	CYSP_TRYCR	50	38
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246128	FG	On-Demand	Mild	CTSK	38	50
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246128	FG	On-Demand	Mild	CTSL	47	49
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246128	FG	On-Demand	Mild	CAPNS1	66	39
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246128	FG	On-Demand	Mild	CTSS	18	50
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246128	FG	On-Demand	Mild	CAPN1	79	44
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246128	FG	On-Demand	Mild	CASP1	21	42
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246128	FG	On-Demand	Mild	CAPN2	124	42
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246128	FG	On-Demand	Mild	NPR	73	38
CC#CCN(C)C(=O)[C@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246129	FG	On-Demand	Mild	KLK3	86	38
CC#CCN(C)C(=O)[C@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246129	FG	On-Demand	Mild	CTSB	65	48
CC#CCN(C)C(=O)[C@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246129	FG	On-Demand	Mild	PAPA1_CARPA	64	48
CC#CCN(C)C(=O)[C@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246129	FG	On-Demand	Mild	CYSP_TRYCR	50	38
CC#CCN(C)C(=O)[C@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246129	FG	On-Demand	Mild	CTSK	38	50
CC#CCN(C)C(=O)[C@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246129	FG	On-Demand	Mild	CTSL	47	49
CC#CCN(C)C(=O)[C@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246129	FG	On-Demand	Mild	CAPNS1	66	39
CC#CCN(C)C(=O)[C@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246129	FG	On-Demand	Mild	CTSS	18	50
CC#CCN(C)C(=O)[C@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246129	FG	On-Demand	Mild	CAPN1	79	44
CC#CCN(C)C(=O)[C@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246129	FG	On-Demand	Mild	CASP1	21	42
CC#CCN(C)C(=O)[C@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246129	FG	On-Demand	Mild	CAPN2	124	42
CC#CCN(C)C(=O)[C@H](NC(=O)OCc1ccccc1)c1ccccc1	ZINC000819246129	FG	On-Demand	Mild	NPR	73	38
COc1ccc(OC)c([C@H](O)CNCCc2cn(C)c3cc(Cl)ccc23)c1	ZINC000819246181	GH	On-Demand	Anodyne	ADRB2	15	45
COc1ccc(OC)c([C@H](O)CNCCc2cn(C)c3cc(Cl)ccc23)c1	ZINC000819246181	GH	On-Demand	Anodyne	ADRB1	18	40
COc1ccc(OC)c([C@H](O)CNCCc2cn(C)c3cc(Cl)ccc23)c1	ZINC000819246181	GH	On-Demand	Anodyne	ADRB3	19	40
COc1ccc(OC)c([C@H](O)CNCCc2cn(C)c3cc(Cl)ccc23)c1	ZINC000819246181	GH	On-Demand	Anodyne	MTNR1A	15	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246184	EE	On-Demand	Anodyne	ADRB2	44	45
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246184	EE	On-Demand	Anodyne	ADRB1	75	45
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246184	EE	On-Demand	Anodyne	GRIN1	22	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246184	EE	On-Demand	Anodyne	ADRB3	53	45
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246184	EE	On-Demand	Anodyne	ABCB1	21	40
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246185	EE	On-Demand	Anodyne	ADRB2	44	45
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246185	EE	On-Demand	Anodyne	ADRB1	75	45
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246185	EE	On-Demand	Anodyne	GRIN1	22	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246185	EE	On-Demand	Anodyne	ADRB3	53	45
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246185	EE	On-Demand	Anodyne	ABCB1	21	40
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246186	EE	On-Demand	Anodyne	ADRB2	44	45
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246186	EE	On-Demand	Anodyne	ADRB1	75	45
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246186	EE	On-Demand	Anodyne	GRIN1	22	42
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246186	EE	On-Demand	Anodyne	ADRB3	53	45
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246186	EE	On-Demand	Anodyne	ABCB1	21	40
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246187	EE	On-Demand	Anodyne	ADRB2	44	45
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246187	EE	On-Demand	Anodyne	ADRB1	75	45
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246187	EE	On-Demand	Anodyne	GRIN1	22	42
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246187	EE	On-Demand	Anodyne	ADRB3	53	45
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246187	EE	On-Demand	Anodyne	ABCB1	21	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCC1CCN(CC(F)(F)F)CC1	ZINC000819246196	GE	On-Demand	Anodyne	CACNA1I	48	34
CC(C)(C)OC(=O)NC[C@](C)(O)CNCC1CCN(CC(F)(F)F)CC1	ZINC000819246197	GE	On-Demand	Anodyne	CACNA1I	48	34
Cn1cc(CCNC[C@H](O)c2ccccc2)c2ccc(Cl)cc21	ZINC000819246208	EH	On-Demand	Anodyne	ADRB2	33	44
Cn1cc(CCNC[C@H](O)c2ccccc2)c2ccc(Cl)cc21	ZINC000819246208	EH	On-Demand	Anodyne	ADRB1	41	44
Cn1cc(CCNC[C@H](O)c2ccccc2)c2ccc(Cl)cc21	ZINC000819246208	EH	On-Demand	Anodyne	ADRB3	84	48
Cn1cc(CCNC[C@@H](O)c2ccccc2)c2ccc(Cl)cc21	ZINC000819246209	EH	On-Demand	Anodyne	ADRB2	33	44
Cn1cc(CCNC[C@@H](O)c2ccccc2)c2ccc(Cl)cc21	ZINC000819246209	EH	On-Demand	Anodyne	ADRB1	41	44
Cn1cc(CCNC[C@@H](O)c2ccccc2)c2ccc(Cl)cc21	ZINC000819246209	EH	On-Demand	Anodyne	ADRB3	84	48
O[C@@H](CNC[C@@H]1CCC=CO1)COc1ccc2ccccc2c1	ZINC000819246214	DF	On-Demand	Anodyne	ADRB2	39	51
O[C@@H](CNC[C@@H]1CCC=CO1)COc1ccc2ccccc2c1	ZINC000819246214	DF	On-Demand	Anodyne	ADRB1	48	38
O[C@H](CNC[C@H]1CCC=CO1)COc1ccc2ccccc2c1	ZINC000819246215	DF	On-Demand	Anodyne	ADRB2	39	51
O[C@H](CNC[C@H]1CCC=CO1)COc1ccc2ccccc2c1	ZINC000819246215	DF	On-Demand	Anodyne	ADRB1	48	38
O[C@H](CNC[C@@H]1CCC=CO1)COc1ccc2ccccc2c1	ZINC000819246216	DF	On-Demand	Anodyne	ADRB2	39	51
O[C@H](CNC[C@@H]1CCC=CO1)COc1ccc2ccccc2c1	ZINC000819246216	DF	On-Demand	Anodyne	ADRB1	48	38
O[C@@H](CNC[C@H]1CCC=CO1)COc1ccc2ccccc2c1	ZINC000819246217	DF	On-Demand	Anodyne	ADRB2	39	51
O[C@@H](CNC[C@H]1CCC=CO1)COc1ccc2ccccc2c1	ZINC000819246217	DF	On-Demand	Anodyne	ADRB1	48	38
Cc1c(F)cccc1NC(=O)CCN[C@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819246246	GH	On-Demand	Anodyne	GPR119	50	44
Cc1c(F)cccc1NC(=O)CCN[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819246247	GH	On-Demand	Anodyne	GPR119	50	44
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccccc1	ZINC000819246248	DF	On-Demand	Anodyne	ADRB1	15	41
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccccc1	ZINC000819246248	DF	On-Demand	Anodyne	SLC6A3	30	52
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccccc1	ZINC000819246248	DF	On-Demand	Anodyne	SIGMAR1	15	45
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccccc1	ZINC000819246248	DF	On-Demand	Anodyne	HPGDS	34	41
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccccc1	ZINC000819246249	DF	On-Demand	Anodyne	ADRB1	15	41
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccccc1	ZINC000819246249	DF	On-Demand	Anodyne	SLC6A3	30	52
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccccc1	ZINC000819246249	DF	On-Demand	Anodyne	SIGMAR1	15	45
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccccc1	ZINC000819246249	DF	On-Demand	Anodyne	HPGDS	34	41
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)c1	ZINC000819246262	DD	On-Demand	Anodyne	ADRB2	27	42
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)c1	ZINC000819246262	DD	On-Demand	Anodyne	ADRB1	46	39
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)c1	ZINC000819246262	DD	On-Demand	Anodyne	ABCB1	18	47
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CCC=CO2)c1	ZINC000819246263	DD	On-Demand	Anodyne	ADRB2	27	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CCC=CO2)c1	ZINC000819246263	DD	On-Demand	Anodyne	ADRB1	46	39
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CCC=CO2)c1	ZINC000819246263	DD	On-Demand	Anodyne	ABCB1	18	47
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)c1	ZINC000819246264	DD	On-Demand	Anodyne	ADRB2	27	42
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)c1	ZINC000819246264	DD	On-Demand	Anodyne	ADRB1	46	39
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)c1	ZINC000819246264	DD	On-Demand	Anodyne	ABCB1	18	47
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)c1	ZINC000819246265	DD	On-Demand	Anodyne	ADRB2	27	42
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)c1	ZINC000819246265	DD	On-Demand	Anodyne	ADRB1	46	39
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)c1	ZINC000819246265	DD	On-Demand	Anodyne	ABCB1	18	47
CC(C)(C)OC(=O)N1CCC[C@@H]1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819246280	GG	On-Demand	Bother	ADRB3	44	34
CC(C)(C)OC(=O)N1CCC[C@@H]1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819246281	GG	On-Demand	Bother	ADRB3	44	34
CC(C)(C)OC(=O)N1CCC[C@@H]1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819246286	FG	On-Demand	Anodyne	ADRB1	32	41
CC(C)(C)OC(=O)N1CCC[C@@H]1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819246286	FG	On-Demand	Anodyne	ADRB3	52	41
CC(C)(C)OC(=O)N1CCC[C@@H]1CCNC[C@H](O)c1cccc(F)c1	ZINC000819246287	FG	On-Demand	Anodyne	ADRB1	32	41
CC(C)(C)OC(=O)N1CCC[C@@H]1CCNC[C@H](O)c1cccc(F)c1	ZINC000819246287	FG	On-Demand	Anodyne	ADRB3	52	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)CC(F)(F)F)CC1	ZINC000819246290	EF	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)CC(F)(F)F)CC1	ZINC000819246291	EF	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)CC(F)(F)F)CC1	ZINC000819246292	EF	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)CC(F)(F)F)CC1	ZINC000819246293	EF	On-Demand	Anodyne	GPR119	34	40
CS(=O)(=O)c1ccc([C@@H](O)CNCC2CCN(CC(F)(F)F)CC2)cc1	ZINC000819246294	GD	On-Demand	Anodyne	ADRB3	18	41
CS(=O)(=O)c1ccc([C@H](O)CNCC2CCN(CC(F)(F)F)CC2)cc1	ZINC000819246295	GD	On-Demand	Anodyne	ADRB3	18	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819246298	GG	On-Demand	Anodyne	ADRB2	39	50
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819246298	GG	On-Demand	Anodyne	ADRB1	42	50
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819246298	GG	On-Demand	Anodyne	ADRB3	35	43
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819246298	GG	On-Demand	Anodyne	ABCB1	31	47
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819246298	GG	On-Demand	Anodyne	GPR119	37	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819246298	GG	On-Demand	Anodyne	SFRP1	92	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819246298	GG	On-Demand	Anodyne	WNT3	69	37
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819246299	GG	On-Demand	Anodyne	ADRB2	39	50
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819246299	GG	On-Demand	Anodyne	ADRB1	42	50
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819246299	GG	On-Demand	Anodyne	ADRB3	35	43
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819246299	GG	On-Demand	Anodyne	ABCB1	31	47
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819246299	GG	On-Demand	Anodyne	GPR119	37	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819246299	GG	On-Demand	Anodyne	SFRP1	92	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819246299	GG	On-Demand	Anodyne	WNT3	69	37
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819246300	GG	On-Demand	Anodyne	ADRB2	39	50
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819246300	GG	On-Demand	Anodyne	ADRB1	42	50
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819246300	GG	On-Demand	Anodyne	ADRB3	35	43
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819246300	GG	On-Demand	Anodyne	ABCB1	31	47
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819246300	GG	On-Demand	Anodyne	GPR119	37	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819246300	GG	On-Demand	Anodyne	SFRP1	92	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819246300	GG	On-Demand	Anodyne	WNT3	69	37
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819246301	GG	On-Demand	Anodyne	ADRB2	39	50
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819246301	GG	On-Demand	Anodyne	ADRB1	42	50
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819246301	GG	On-Demand	Anodyne	ADRB3	35	43
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819246301	GG	On-Demand	Anodyne	ABCB1	31	47
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819246301	GG	On-Demand	Anodyne	GPR119	37	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819246301	GG	On-Demand	Anodyne	SFRP1	92	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819246301	GG	On-Demand	Anodyne	WNT3	69	37
O[C@H](CNC[C@H]1CCC=CO1)COc1ccccc1C(F)(F)F	ZINC000819246304	EF	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNC[C@@H]1CCC=CO1)COc1ccccc1C(F)(F)F	ZINC000819246305	EF	On-Demand	Anodyne	ADRB2	20	40
O[C@@H](CNC[C@H]1CCC=CO1)COc1ccccc1C(F)(F)F	ZINC000819246306	EF	On-Demand	Anodyne	ADRB2	20	40
O[C@@H](CNC[C@@H]1CCC=CO1)COc1ccccc1C(F)(F)F	ZINC000819246307	EF	On-Demand	Anodyne	ADRB2	20	40
CSc1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246331	DE	On-Demand	Anodyne	ADRB1	46	38
CSc1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246332	DE	On-Demand	Anodyne	ADRB1	46	38
CSc1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246333	DE	On-Demand	Anodyne	ADRB1	46	38
CSc1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246334	DE	On-Demand	Anodyne	ADRB1	46	38
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246335	GG	On-Demand	Anodyne	ADRB2	37	47
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246335	GG	On-Demand	Anodyne	ADRB1	47	44
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246335	GG	On-Demand	Anodyne	ADRB3	33	46
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246335	GG	On-Demand	Anodyne	ACOX1	44	33
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246335	GG	On-Demand	Anodyne	GPR119	49	47
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246336	GG	On-Demand	Anodyne	ADRB2	37	47
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246336	GG	On-Demand	Anodyne	ADRB1	47	44
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246336	GG	On-Demand	Anodyne	ADRB3	33	46
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246336	GG	On-Demand	Anodyne	ACOX1	44	33
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246336	GG	On-Demand	Anodyne	GPR119	49	47
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246337	GG	On-Demand	Anodyne	ADRB2	37	47
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246337	GG	On-Demand	Anodyne	ADRB1	47	44
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246337	GG	On-Demand	Anodyne	ADRB3	33	46
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246337	GG	On-Demand	Anodyne	ACOX1	44	33
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246337	GG	On-Demand	Anodyne	GPR119	49	47
Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246338	GG	On-Demand	Anodyne	ADRB2	37	47
Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246338	GG	On-Demand	Anodyne	ADRB1	47	44
Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246338	GG	On-Demand	Anodyne	ADRB3	33	46
Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246338	GG	On-Demand	Anodyne	ACOX1	44	33
Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819246338	GG	On-Demand	Anodyne	GPR119	49	47
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccc(Cl)cc1	ZINC000819246343	FG	On-Demand	Anodyne	CACNA1I	58	35
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819246344	GF	On-Demand	Mild	ADRB2	30	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819246344	GF	On-Demand	Mild	ADRB1	41	44
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819246344	GF	On-Demand	Mild	ADRB3	27	44
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819246344	GF	On-Demand	Mild	GPR119	48	44
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819246345	GF	On-Demand	Mild	ADRB2	30	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819246345	GF	On-Demand	Mild	ADRB1	41	44
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819246345	GF	On-Demand	Mild	ADRB3	27	44
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819246345	GF	On-Demand	Mild	GPR119	48	44
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819246346	GF	On-Demand	Mild	ADRB2	30	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819246346	GF	On-Demand	Mild	ADRB1	41	44
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819246346	GF	On-Demand	Mild	ADRB3	27	44
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819246346	GF	On-Demand	Mild	GPR119	48	44
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819246347	GF	On-Demand	Mild	ADRB2	30	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819246347	GF	On-Demand	Mild	ADRB1	41	44
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819246347	GF	On-Demand	Mild	ADRB3	27	44
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)CC1	ZINC000819246347	GF	On-Demand	Mild	GPR119	48	44
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2cccc(Cl)c2)CC1	ZINC000819246356	GI	On-Demand	Anodyne	NPY1R	23	40
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2cccc(Cl)c2)CC1	ZINC000819246356	GI	On-Demand	Anodyne	EPHX2	21	47
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2cccc(Cl)c2)CC1	ZINC000819246356	GI	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccc(Cl)c2)CC1	ZINC000819246357	GI	On-Demand	Anodyne	NPY1R	23	40
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccc(Cl)c2)CC1	ZINC000819246357	GI	On-Demand	Anodyne	EPHX2	21	47
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccc(Cl)c2)CC1	ZINC000819246357	GI	On-Demand	Anodyne	GPR119	39	42
Cc1nn(C)c(Cl)c1[C@@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819246358	GF	On-Demand	Anodyne	OPRK1	15	41
Cc1nn(C)c(Cl)c1[C@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819246359	GF	On-Demand	Anodyne	OPRK1	15	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2F)CC1	ZINC000819246360	GG	On-Demand	Anodyne	ADRB2	17	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2F)CC1	ZINC000819246360	GG	On-Demand	Anodyne	ADRB1	18	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2F)CC1	ZINC000819246360	GG	On-Demand	Anodyne	GRIN2B	15	43
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2F)CC1	ZINC000819246360	GG	On-Demand	Anodyne	GPR119	43	54
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2F)CC1	ZINC000819246360	GG	On-Demand	Anodyne	SFRP1	57	39
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2F)CC1	ZINC000819246360	GG	On-Demand	Anodyne	WNT3	55	36
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2F)CC1	ZINC000819246361	GG	On-Demand	Anodyne	ADRB2	17	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2F)CC1	ZINC000819246361	GG	On-Demand	Anodyne	ADRB1	18	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2F)CC1	ZINC000819246361	GG	On-Demand	Anodyne	GRIN2B	15	43
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2F)CC1	ZINC000819246361	GG	On-Demand	Anodyne	GPR119	43	54
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2F)CC1	ZINC000819246361	GG	On-Demand	Anodyne	SFRP1	57	39
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2F)CC1	ZINC000819246361	GG	On-Demand	Anodyne	WNT3	55	36
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2F)CC1	ZINC000819246362	GG	On-Demand	Anodyne	ADRB2	17	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2F)CC1	ZINC000819246362	GG	On-Demand	Anodyne	ADRB1	18	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2F)CC1	ZINC000819246362	GG	On-Demand	Anodyne	GRIN2B	15	43
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2F)CC1	ZINC000819246362	GG	On-Demand	Anodyne	GPR119	43	54
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2F)CC1	ZINC000819246362	GG	On-Demand	Anodyne	SFRP1	57	39
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2F)CC1	ZINC000819246362	GG	On-Demand	Anodyne	WNT3	55	36
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2F)CC1	ZINC000819246363	GG	On-Demand	Anodyne	ADRB2	17	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2F)CC1	ZINC000819246363	GG	On-Demand	Anodyne	ADRB1	18	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2F)CC1	ZINC000819246363	GG	On-Demand	Anodyne	GRIN2B	15	43
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2F)CC1	ZINC000819246363	GG	On-Demand	Anodyne	GPR119	43	54
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2F)CC1	ZINC000819246363	GG	On-Demand	Anodyne	SFRP1	57	39
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2F)CC1	ZINC000819246363	GG	On-Demand	Anodyne	WNT3	55	36
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cn2)CC1	ZINC000819246380	FF	On-Demand	Anodyne	GPR119	56	44
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cn2)CC1	ZINC000819246380	FF	On-Demand	Anodyne	SFRP1	48	39
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cn2)CC1	ZINC000819246380	FF	On-Demand	Anodyne	WNT3	52	36
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cn2)CC1	ZINC000819246381	FF	On-Demand	Anodyne	GPR119	56	44
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cn2)CC1	ZINC000819246381	FF	On-Demand	Anodyne	SFRP1	48	39
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cn2)CC1	ZINC000819246381	FF	On-Demand	Anodyne	WNT3	52	36
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(F)cn2)CC1	ZINC000819246382	FF	On-Demand	Anodyne	GPR119	56	44
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(F)cn2)CC1	ZINC000819246382	FF	On-Demand	Anodyne	SFRP1	48	39
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(F)cn2)CC1	ZINC000819246382	FF	On-Demand	Anodyne	WNT3	52	36
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cn2)CC1	ZINC000819246383	FF	On-Demand	Anodyne	GPR119	56	44
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cn2)CC1	ZINC000819246383	FF	On-Demand	Anodyne	SFRP1	48	39
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cn2)CC1	ZINC000819246383	FF	On-Demand	Anodyne	WNT3	52	36
O=C(NNC(=O)C1(c2ccc(Cl)cc2Cl)CCCCC1)c1cnn[nH]1	ZINC000819246387	GF	On-Demand	Reactive	ALPL	41	33
O[C@@H](CNC[C@@H]1CC12CCOCC2)c1cccnc1	ZINC000819246396	CD	On-Demand	Anodyne	ADRB3	75	41
O[C@@H](CNC[C@H]1CC12CCOCC2)c1cccnc1	ZINC000819246397	CD	On-Demand	Anodyne	ADRB3	75	41
O[C@H](CNC[C@@H]1CC12CCOCC2)c1cccnc1	ZINC000819246398	CD	On-Demand	Anodyne	ADRB3	75	41
O[C@H](CNC[C@H]1CC12CCOCC2)c1cccnc1	ZINC000819246399	CD	On-Demand	Anodyne	ADRB3	75	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCN(c3ccc(C)nn3)CC1)C2	ZINC000819246440	GD	On-Demand	Anodyne	SCD1	21	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCN(c3ccc(C)nn3)CC1)C2	ZINC000819246442	GD	On-Demand	Anodyne	SCD1	21	43
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2cc3ccccc3o2)CC1	ZINC000819246453	FH	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2cc3ccccc3o2)CC1	ZINC000819246453	FH	On-Demand	Anodyne	SFRP1	109	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2cc3ccccc3o2)CC1	ZINC000819246453	FH	On-Demand	Anodyne	WNT3	82	38
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)CC1	ZINC000819246455	FH	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)CC1	ZINC000819246455	FH	On-Demand	Anodyne	SFRP1	109	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)CC1	ZINC000819246455	FH	On-Demand	Anodyne	WNT3	82	38
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccc(F)cc1	ZINC000819246472	EF	On-Demand	Anodyne	SLC6A3	36	51
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccc(F)cc1	ZINC000819246474	EF	On-Demand	Anodyne	SLC6A3	36	51
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1cc(F)ccc1F	ZINC000819246483	FF	On-Demand	Anodyne	CACNA1I	41	32
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1cc(F)ccc1F	ZINC000819246485	FF	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)CC2CCCC2)CC1	ZINC000819246494	EG	On-Demand	Anodyne	GPR119	34	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)CC2CCCC2)CC1	ZINC000819246495	EG	On-Demand	Anodyne	GPR119	34	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)CC2CCCC2)CC1	ZINC000819246497	EG	On-Demand	Anodyne	GPR119	34	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)CC2CCCC2)CC1	ZINC000819246499	EG	On-Demand	Anodyne	GPR119	34	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)Cn2cccn2)CC1	ZINC000819246509	ED	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)Cn2cccn2)CC1	ZINC000819246510	ED	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)Cn2cccn2)CC1	ZINC000819246512	ED	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)Cn2cccn2)CC1	ZINC000819246514	ED	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000819246516	GI	On-Demand	Anodyne	EPHX2	37	44
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000819246516	GI	On-Demand	Anodyne	GPR119	47	41
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000819246518	GI	On-Demand	Anodyne	EPHX2	37	44
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2ccc(Cl)cc2)CC1	ZINC000819246518	GI	On-Demand	Anodyne	GPR119	47	41
O[C@H](CNC[C@@H]1CCC=CO1)COc1ccc(-c2ccccc2)cc1	ZINC000819246546	EG	On-Demand	Anodyne	ADRB2	49	45
O[C@H](CNC[C@@H]1CCC=CO1)COc1ccc(-c2ccccc2)cc1	ZINC000819246546	EG	On-Demand	Anodyne	ADRB1	73	41
O[C@H](CNC[C@@H]1CCC=CO1)COc1ccc(-c2ccccc2)cc1	ZINC000819246546	EG	On-Demand	Anodyne	ADRB3	52	41
O[C@@H](CNC[C@@H]1CCC=CO1)COc1ccc(-c2ccccc2)cc1	ZINC000819246547	EG	On-Demand	Anodyne	ADRB2	49	45
O[C@@H](CNC[C@@H]1CCC=CO1)COc1ccc(-c2ccccc2)cc1	ZINC000819246547	EG	On-Demand	Anodyne	ADRB1	73	41
O[C@@H](CNC[C@@H]1CCC=CO1)COc1ccc(-c2ccccc2)cc1	ZINC000819246547	EG	On-Demand	Anodyne	ADRB3	52	41
O[C@@H](CNC[C@H]1CCC=CO1)COc1ccc(-c2ccccc2)cc1	ZINC000819246548	EG	On-Demand	Anodyne	ADRB2	49	45
O[C@@H](CNC[C@H]1CCC=CO1)COc1ccc(-c2ccccc2)cc1	ZINC000819246548	EG	On-Demand	Anodyne	ADRB1	73	41
O[C@@H](CNC[C@H]1CCC=CO1)COc1ccc(-c2ccccc2)cc1	ZINC000819246548	EG	On-Demand	Anodyne	ADRB3	52	41
O[C@H](CNC[C@H]1CCC=CO1)COc1ccc(-c2ccccc2)cc1	ZINC000819246549	EG	On-Demand	Anodyne	ADRB2	49	45
O[C@H](CNC[C@H]1CCC=CO1)COc1ccc(-c2ccccc2)cc1	ZINC000819246549	EG	On-Demand	Anodyne	ADRB1	73	41
O[C@H](CNC[C@H]1CCC=CO1)COc1ccc(-c2ccccc2)cc1	ZINC000819246549	EG	On-Demand	Anodyne	ADRB3	52	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246550	DD	On-Demand	Anodyne	ADRB2	34	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246550	DD	On-Demand	Anodyne	ADRB1	59	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246551	DD	On-Demand	Anodyne	ADRB2	34	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246551	DD	On-Demand	Anodyne	ADRB1	59	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246552	DD	On-Demand	Anodyne	ADRB2	34	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246552	DD	On-Demand	Anodyne	ADRB1	59	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246553	DD	On-Demand	Anodyne	ADRB2	34	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246553	DD	On-Demand	Anodyne	ADRB1	59	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819246576	GI	On-Demand	Anodyne	SSTR2	52	37
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819246576	GI	On-Demand	Anodyne	CCR8	71	44
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819246576	GI	On-Demand	Anodyne	GPR119	46	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819246576	GI	On-Demand	Anodyne	SFRP1	81	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819246576	GI	On-Demand	Anodyne	WNT3	59	36
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819246581	GI	On-Demand	Anodyne	SSTR2	52	37
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819246581	GI	On-Demand	Anodyne	CCR8	71	44
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819246581	GI	On-Demand	Anodyne	GPR119	46	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819246581	GI	On-Demand	Anodyne	SFRP1	81	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819246581	GI	On-Demand	Anodyne	WNT3	59	36
CS(=O)(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)C(F)=C1CCC1	ZINC000819246588	FG	On-Demand	Anodyne	TRPV1	59	34
N#CCc1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246621	DD	On-Demand	Mild	ADRB2	30	40
N#CCc1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246621	DD	On-Demand	Mild	ADRB1	58	40
N#CCc1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246621	DD	On-Demand	Mild	ADRB3	35	40
N#CCc1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246623	DD	On-Demand	Mild	ADRB2	30	40
N#CCc1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246623	DD	On-Demand	Mild	ADRB1	58	40
N#CCc1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246623	DD	On-Demand	Mild	ADRB3	35	40
N#CCc1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246625	DD	On-Demand	Mild	ADRB2	30	40
N#CCc1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246625	DD	On-Demand	Mild	ADRB1	58	40
N#CCc1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246625	DD	On-Demand	Mild	ADRB3	35	40
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246626	DD	On-Demand	Mild	ADRB2	30	40
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246626	DD	On-Demand	Mild	ADRB1	58	40
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246626	DD	On-Demand	Mild	ADRB3	35	40
CC(C)(C)[C@@H]1CCC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819246628	FH	On-Demand	Anodyne	ADRB3	28	40
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819246629	FF	On-Demand	Mild	GPR119	40	46
CC(C)(C)[C@@H]1CCC[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819246630	FH	On-Demand	Anodyne	ADRB3	28	40
CC(C)(C)[C@@H]1CCC[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819246631	FH	On-Demand	Anodyne	ADRB3	28	40
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@H](O)c1ccc(C#N)cc1	ZINC000819246632	FF	On-Demand	Mild	GPR119	40	46
CC(C)(C)[C@@H]1CCC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819246633	FH	On-Demand	Anodyne	ADRB3	28	40
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@H](O)c1ccc(C#N)cc1	ZINC000819246634	FF	On-Demand	Mild	GPR119	40	46
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819246636	FF	On-Demand	Mild	GPR119	40	46
O[C@H](CNC[C@@H]1CC12CCOCC2)c1cccc(Cl)c1	ZINC000819246643	CF	On-Demand	Anodyne	ADRB1	25	40
O[C@H](CNC[C@@H]1CC12CCOCC2)c1cccc(Cl)c1	ZINC000819246643	CF	On-Demand	Anodyne	ADRB3	39	40
O[C@@H](CNC[C@H]1CC12CCOCC2)c1cccc(Cl)c1	ZINC000819246645	CF	On-Demand	Anodyne	ADRB1	25	40
O[C@@H](CNC[C@H]1CC12CCOCC2)c1cccc(Cl)c1	ZINC000819246645	CF	On-Demand	Anodyne	ADRB3	39	40
O[C@H](CNC[C@H]1CC12CCOCC2)c1cccc(Cl)c1	ZINC000819246647	CF	On-Demand	Anodyne	ADRB1	25	40
O[C@H](CNC[C@H]1CC12CCOCC2)c1cccc(Cl)c1	ZINC000819246647	CF	On-Demand	Anodyne	ADRB3	39	40
O[C@@H](CNC[C@@H]1CC12CCOCC2)c1cccc(Cl)c1	ZINC000819246648	CF	On-Demand	Anodyne	ADRB1	25	40
O[C@@H](CNC[C@@H]1CC12CCOCC2)c1cccc(Cl)c1	ZINC000819246648	CF	On-Demand	Anodyne	ADRB3	39	40
CN(C)c1ccc(NC(=O)CCNCC2CCN(CC(F)(F)F)CC2)cc1	ZINC000819246651	GF	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2cccnc2)CC1	ZINC000819246672	FF	On-Demand	Anodyne	GRIN2B	15	43
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2cccnc2)CC1	ZINC000819246672	FF	On-Demand	Anodyne	GPR119	47	46
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2cccnc2)CC1	ZINC000819246672	FF	On-Demand	Anodyne	NAMPT	15	41
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccnc2)CC1	ZINC000819246675	FF	On-Demand	Anodyne	GRIN2B	15	43
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccnc2)CC1	ZINC000819246675	FF	On-Demand	Anodyne	GPR119	47	46
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccnc2)CC1	ZINC000819246675	FF	On-Demand	Anodyne	NAMPT	15	41
Cn1cc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c2ccc(Cl)cc21	ZINC000819246684	FH	On-Demand	Bother	ADRB1	28	41
Cn1cc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c2ccc(Cl)cc21	ZINC000819246684	FH	On-Demand	Bother	ADRB3	54	43
Cn1cc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c2ccc(Cl)cc21	ZINC000819246686	FH	On-Demand	Bother	ADRB1	28	41
Cn1cc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c2ccc(Cl)cc21	ZINC000819246686	FH	On-Demand	Bother	ADRB3	54	43
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC[C@H]1CCC=CO1	ZINC000819246696	DD	On-Demand	Bother	ADRB1	45	33
O=[N+]([O-])c1ccccc1OC[C@H](O)CNC[C@@H]1CCC=CO1	ZINC000819246698	DD	On-Demand	Bother	ADRB1	45	33
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC[C@H]1CCC=CO1	ZINC000819246700	DD	On-Demand	Bother	ADRB1	45	33
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNC[C@@H]1CCC=CO1	ZINC000819246701	DD	On-Demand	Bother	ADRB1	45	33
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@@H](O)c1cc(F)ccc1F	ZINC000819246731	FG	On-Demand	Anodyne	GPR119	45	51
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@H](O)c1cc(F)ccc1F	ZINC000819246732	FG	On-Demand	Anodyne	GPR119	45	51
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@H](O)c1cc(F)ccc1F	ZINC000819246733	FG	On-Demand	Anodyne	GPR119	45	51
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@@H](O)c1cc(F)ccc1F	ZINC000819246734	FG	On-Demand	Anodyne	GPR119	45	51
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2cc(F)cc(F)c2)CC1	ZINC000819246736	GH	On-Demand	Anodyne	GPR119	41	42
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2cc(F)cc(F)c2)CC1	ZINC000819246737	GH	On-Demand	Anodyne	GPR119	41	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC=CO1	ZINC000819246740	GF	On-Demand	Anodyne	CTSD	91	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC=CO1	ZINC000819246740	GF	On-Demand	Anodyne	PGC	62	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC=CO1	ZINC000819246740	GF	On-Demand	Anodyne	PAPA1_CARPA	36	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC=CO1	ZINC000819246740	GF	On-Demand	Anodyne	CTSL	15	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC=CO1	ZINC000819246740	GF	On-Demand	Anodyne	BACE2	50	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC=CO1	ZINC000819246740	GF	On-Demand	Anodyne	REN	95	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC=CO1	ZINC000819246740	GF	On-Demand	Anodyne	REN1	33	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC=CO1	ZINC000819246740	GF	On-Demand	Anodyne	BACE1	79	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC=CO1	ZINC000819246740	GF	On-Demand	Anodyne	FPR1	51	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC=CO1	ZINC000819246740	GF	On-Demand	Anodyne	PLM1_PLAFA	31	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC=CO1	ZINC000819246741	GF	On-Demand	Anodyne	CTSD	91	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC=CO1	ZINC000819246741	GF	On-Demand	Anodyne	PGC	62	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC=CO1	ZINC000819246741	GF	On-Demand	Anodyne	PAPA1_CARPA	36	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC=CO1	ZINC000819246741	GF	On-Demand	Anodyne	CTSL	15	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC=CO1	ZINC000819246741	GF	On-Demand	Anodyne	BACE2	50	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC=CO1	ZINC000819246741	GF	On-Demand	Anodyne	REN	95	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC=CO1	ZINC000819246741	GF	On-Demand	Anodyne	REN1	33	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC=CO1	ZINC000819246741	GF	On-Demand	Anodyne	BACE1	79	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC=CO1	ZINC000819246741	GF	On-Demand	Anodyne	FPR1	51	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC=CO1	ZINC000819246741	GF	On-Demand	Anodyne	PLM1_PLAFA	31	40
O[C@@H](CNC[C@@H]1CCC=CO1)COc1cccc2[nH]ccc12	ZINC000819246756	DE	On-Demand	Anodyne	ADRB2	20	64
O[C@@H](CNC[C@@H]1CCC=CO1)COc1cccc2[nH]ccc12	ZINC000819246756	DE	On-Demand	Anodyne	ADRB1	29	64
O[C@@H](CNC[C@@H]1CCC=CO1)COc1cccc2[nH]ccc12	ZINC000819246756	DE	On-Demand	Anodyne	HTR1A	15	64
O[C@@H](CNC[C@@H]1CCC=CO1)COc1cccc2[nH]ccc12	ZINC000819246756	DE	On-Demand	Anodyne	SLC6A4	16	44
O[C@H](CNC[C@@H]1CCC=CO1)COc1cccc2[nH]ccc12	ZINC000819246757	DE	On-Demand	Anodyne	ADRB2	20	64
O[C@H](CNC[C@@H]1CCC=CO1)COc1cccc2[nH]ccc12	ZINC000819246757	DE	On-Demand	Anodyne	ADRB1	29	64
O[C@H](CNC[C@@H]1CCC=CO1)COc1cccc2[nH]ccc12	ZINC000819246757	DE	On-Demand	Anodyne	HTR1A	15	64
O[C@H](CNC[C@@H]1CCC=CO1)COc1cccc2[nH]ccc12	ZINC000819246757	DE	On-Demand	Anodyne	SLC6A4	16	44
O[C@@H](CNC[C@H]1CCC=CO1)COc1cccc2[nH]ccc12	ZINC000819246758	DE	On-Demand	Anodyne	ADRB2	20	64
O[C@@H](CNC[C@H]1CCC=CO1)COc1cccc2[nH]ccc12	ZINC000819246758	DE	On-Demand	Anodyne	ADRB1	29	64
O[C@@H](CNC[C@H]1CCC=CO1)COc1cccc2[nH]ccc12	ZINC000819246758	DE	On-Demand	Anodyne	HTR1A	15	64
O[C@@H](CNC[C@H]1CCC=CO1)COc1cccc2[nH]ccc12	ZINC000819246758	DE	On-Demand	Anodyne	SLC6A4	16	44
O[C@H](CNC[C@H]1CCC=CO1)COc1cccc2[nH]ccc12	ZINC000819246759	DE	On-Demand	Anodyne	ADRB2	20	64
O[C@H](CNC[C@H]1CCC=CO1)COc1cccc2[nH]ccc12	ZINC000819246759	DE	On-Demand	Anodyne	ADRB1	29	64
O[C@H](CNC[C@H]1CCC=CO1)COc1cccc2[nH]ccc12	ZINC000819246759	DE	On-Demand	Anodyne	HTR1A	15	64
O[C@H](CNC[C@H]1CCC=CO1)COc1cccc2[nH]ccc12	ZINC000819246759	DE	On-Demand	Anodyne	SLC6A4	16	44
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2cccc(F)c2)CC1	ZINC000819246775	GH	On-Demand	Anodyne	EPHX2	21	47
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2cccc(F)c2)CC1	ZINC000819246775	GH	On-Demand	Anodyne	GPR119	44	48
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2cccc(F)c2)CC1	ZINC000819246775	GH	On-Demand	Anodyne	SFRP1	46	39
CC(C)(C)OC(=O)N1CCC[C@H](NCCC(=O)Nc2cccc(F)c2)CC1	ZINC000819246775	GH	On-Demand	Anodyne	WNT3	42	35
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccc(F)c2)CC1	ZINC000819246776	GH	On-Demand	Anodyne	EPHX2	21	47
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccc(F)c2)CC1	ZINC000819246776	GH	On-Demand	Anodyne	GPR119	44	48
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccc(F)c2)CC1	ZINC000819246776	GH	On-Demand	Anodyne	SFRP1	46	39
CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)Nc2cccc(F)c2)CC1	ZINC000819246776	GH	On-Demand	Anodyne	WNT3	42	35
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ncn(C)n1	ZINC000819246785	FD	On-Demand	Anodyne	GPR119	55	43
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ncn(C)n1	ZINC000819246787	FD	On-Demand	Anodyne	GPR119	55	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246797	DD	On-Demand	Anodyne	ADRB2	44	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246797	DD	On-Demand	Anodyne	ADRB1	70	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246797	DD	On-Demand	Anodyne	ADRB3	46	43
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246798	DD	On-Demand	Anodyne	ADRB2	44	43
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246798	DD	On-Demand	Anodyne	ADRB1	70	43
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819246798	DD	On-Demand	Anodyne	ADRB3	46	43
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246799	DD	On-Demand	Anodyne	ADRB2	44	43
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246799	DD	On-Demand	Anodyne	ADRB1	70	43
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246799	DD	On-Demand	Anodyne	ADRB3	46	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246800	DD	On-Demand	Anodyne	ADRB2	44	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246800	DD	On-Demand	Anodyne	ADRB1	70	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819246800	DD	On-Demand	Anodyne	ADRB3	46	43
CN(C[C@H](O)CN[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1)C1CC1	ZINC000819246805	ED	On-Demand	Anodyne	SFRP1	43	39
CN(C[C@H](O)CN[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1)C1CC1	ZINC000819246805	ED	On-Demand	Anodyne	WNT3	41	35
CN(C[C@H](O)CN[C@H]1CCCN(C(=O)OC(C)(C)C)CC1)C1CC1	ZINC000819246806	ED	On-Demand	Anodyne	SFRP1	43	39
CN(C[C@H](O)CN[C@H]1CCCN(C(=O)OC(C)(C)C)CC1)C1CC1	ZINC000819246806	ED	On-Demand	Anodyne	WNT3	41	35
CN(C[C@@H](O)CN[C@H]1CCCN(C(=O)OC(C)(C)C)CC1)C1CC1	ZINC000819246807	ED	On-Demand	Anodyne	SFRP1	43	39
CN(C[C@@H](O)CN[C@H]1CCCN(C(=O)OC(C)(C)C)CC1)C1CC1	ZINC000819246807	ED	On-Demand	Anodyne	WNT3	41	35
CN(C[C@@H](O)CN[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1)C1CC1	ZINC000819246808	ED	On-Demand	Anodyne	SFRP1	43	39
CN(C[C@@H](O)CN[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1)C1CC1	ZINC000819246808	ED	On-Demand	Anodyne	WNT3	41	35
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@@H](O)c1ccc(F)cn1	ZINC000819246855	FE	On-Demand	Anodyne	GPR119	54	42
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@H](O)c1ccc(F)cn1	ZINC000819246857	FE	On-Demand	Anodyne	GPR119	54	42
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@@H](O)c1ccc(F)cn1	ZINC000819246859	FE	On-Demand	Anodyne	GPR119	54	42
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@H](O)c1ccc(F)cn1	ZINC000819246861	FE	On-Demand	Anodyne	GPR119	54	42
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819246882	GD	On-Demand	Anodyne	HTR1D	48	43
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819246882	GD	On-Demand	Anodyne	HTR1B	37	43
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819246882	GD	On-Demand	Anodyne	KCNJ1	68	44
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819246883	GD	On-Demand	Anodyne	HTR1D	48	43
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819246883	GD	On-Demand	Anodyne	HTR1B	37	43
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819246883	GD	On-Demand	Anodyne	KCNJ1	68	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(C)(C)O1	ZINC000819246892	GG	On-Demand	Anodyne	CTSD	100	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(C)(C)O1	ZINC000819246892	GG	On-Demand	Anodyne	PGC	60	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(C)(C)O1	ZINC000819246892	GG	On-Demand	Anodyne	PAPA1_CARPA	28	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(C)(C)O1	ZINC000819246892	GG	On-Demand	Anodyne	BACE2	50	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(C)(C)O1	ZINC000819246892	GG	On-Demand	Anodyne	TIMP3	57	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(C)(C)O1	ZINC000819246892	GG	On-Demand	Anodyne	REN	80	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(C)(C)O1	ZINC000819246892	GG	On-Demand	Anodyne	REN1	17	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(C)(C)O1	ZINC000819246892	GG	On-Demand	Anodyne	BACE1	88	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(C)(C)O1	ZINC000819246892	GG	On-Demand	Anodyne	FPR1	50	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(C)(C)O1	ZINC000819246893	GG	On-Demand	Anodyne	CTSD	100	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(C)(C)O1	ZINC000819246893	GG	On-Demand	Anodyne	PGC	60	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(C)(C)O1	ZINC000819246893	GG	On-Demand	Anodyne	PAPA1_CARPA	28	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(C)(C)O1	ZINC000819246893	GG	On-Demand	Anodyne	BACE2	50	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(C)(C)O1	ZINC000819246893	GG	On-Demand	Anodyne	TIMP3	57	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(C)(C)O1	ZINC000819246893	GG	On-Demand	Anodyne	REN	80	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(C)(C)O1	ZINC000819246893	GG	On-Demand	Anodyne	REN1	17	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(C)(C)O1	ZINC000819246893	GG	On-Demand	Anodyne	BACE1	88	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(C)(C)O1	ZINC000819246893	GG	On-Demand	Anodyne	FPR1	50	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCN(c3cccnn3)CC1)C2	ZINC000819246912	FD	On-Demand	Anodyne	SSTR1	25	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCN(c3cccnn3)CC1)C2	ZINC000819246913	FD	On-Demand	Anodyne	SSTR1	25	45
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](c2cccc(F)c2)C1	ZINC000819246921	CF	On-Demand	Anodyne	CCR5	52	33
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](c2cccc(F)c2)C1	ZINC000819246922	CF	On-Demand	Anodyne	CCR5	52	33
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](c2cccc(F)c2)C1	ZINC000819246923	CF	On-Demand	Anodyne	CCR5	52	33
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](c2cccc(F)c2)C1	ZINC000819246924	CF	On-Demand	Anodyne	CCR5	52	33
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)CC1	ZINC000819246937	FF	On-Demand	Mild	ADRB3	23	49
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(C#N)cc2)CC1	ZINC000819246937	FF	On-Demand	Mild	GPR119	49	43
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)CC1	ZINC000819246938	FF	On-Demand	Mild	ADRB3	23	49
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)CC1	ZINC000819246938	FF	On-Demand	Mild	GPR119	49	43
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(C#N)cc2)CC1	ZINC000819246939	FF	On-Demand	Mild	ADRB3	23	49
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(C#N)cc2)CC1	ZINC000819246939	FF	On-Demand	Mild	GPR119	49	43
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)CC1	ZINC000819246940	FF	On-Demand	Mild	ADRB3	23	49
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(C#N)cc2)CC1	ZINC000819246940	FF	On-Demand	Mild	GPR119	49	43
CCOc1ccnc(N2CCN(C(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)CC2)n1	ZINC000819246945	GD	On-Demand	Anodyne	GPR119	20	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)c1	ZINC000819246956	DD	On-Demand	Bother	ADRB2	15	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)c1	ZINC000819246956	DD	On-Demand	Bother	ADRB1	25	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)c1	ZINC000819246956	DD	On-Demand	Bother	ADRB3	16	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)c1	ZINC000819246957	DD	On-Demand	Bother	ADRB2	15	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)c1	ZINC000819246957	DD	On-Demand	Bother	ADRB1	25	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)c1	ZINC000819246957	DD	On-Demand	Bother	ADRB3	16	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@H]2CCC=CO2)c1	ZINC000819246958	DD	On-Demand	Bother	ADRB2	15	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@H]2CCC=CO2)c1	ZINC000819246958	DD	On-Demand	Bother	ADRB1	25	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNC[C@H]2CCC=CO2)c1	ZINC000819246958	DD	On-Demand	Bother	ADRB3	16	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)c1	ZINC000819246959	DD	On-Demand	Bother	ADRB2	15	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)c1	ZINC000819246959	DD	On-Demand	Bother	ADRB1	25	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)c1	ZINC000819246959	DD	On-Demand	Bother	ADRB3	16	44
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2cc(F)ccc2F)CC1	ZINC000819246961	FG	On-Demand	Anodyne	GPR119	58	53
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2cc(F)ccc2F)CC1	ZINC000819246961	FG	On-Demand	Anodyne	SFRP1	57	39
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2cc(F)ccc2F)CC1	ZINC000819246961	FG	On-Demand	Anodyne	WNT3	52	36
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)CC1	ZINC000819246962	FG	On-Demand	Anodyne	GPR119	58	53
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)CC1	ZINC000819246962	FG	On-Demand	Anodyne	SFRP1	57	39
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)CC1	ZINC000819246962	FG	On-Demand	Anodyne	WNT3	52	36
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2cc(F)ccc2F)CC1	ZINC000819246963	FG	On-Demand	Anodyne	GPR119	58	53
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2cc(F)ccc2F)CC1	ZINC000819246963	FG	On-Demand	Anodyne	SFRP1	57	39
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2cc(F)ccc2F)CC1	ZINC000819246963	FG	On-Demand	Anodyne	WNT3	52	36
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2cc(F)ccc2F)CC1	ZINC000819246964	FG	On-Demand	Anodyne	GPR119	58	53
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2cc(F)ccc2F)CC1	ZINC000819246964	FG	On-Demand	Anodyne	SFRP1	57	39
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2cc(F)ccc2F)CC1	ZINC000819246964	FG	On-Demand	Anodyne	WNT3	52	36
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccc(C(F)(F)F)c1	ZINC000819246965	GH	On-Demand	Anodyne	CACNA1I	22	42
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccc(C(F)(F)F)c1	ZINC000819246966	GH	On-Demand	Anodyne	CACNA1I	22	42
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccccc1Cl	ZINC000819246986	FG	On-Demand	Anodyne	CACNA1I	49	33
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccc(F)c1	ZINC000819246987	EF	On-Demand	Anodyne	SLC6A3	21	42
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccc(F)c1	ZINC000819246987	EF	On-Demand	Anodyne	HPGDS	33	43
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccc(F)c1	ZINC000819246988	EF	On-Demand	Anodyne	SLC6A3	21	42
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccc(F)c1	ZINC000819246988	EF	On-Demand	Anodyne	HPGDS	33	43
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccc(F)cc2)CC1	ZINC000819246994	FG	On-Demand	Anodyne	CCR3	15	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccc(F)cc2)CC1	ZINC000819246994	FG	On-Demand	Anodyne	GPR119	51	46
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccc(F)cc2)CC1	ZINC000819246994	FG	On-Demand	Anodyne	SFRP1	46	38
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2ccc(F)cc2)CC1	ZINC000819246994	FG	On-Demand	Anodyne	WNT3	46	35
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccc(F)cc2)CC1	ZINC000819246995	FG	On-Demand	Anodyne	CCR3	15	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccc(F)cc2)CC1	ZINC000819246995	FG	On-Demand	Anodyne	GPR119	51	46
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccc(F)cc2)CC1	ZINC000819246995	FG	On-Demand	Anodyne	SFRP1	46	38
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)Cc2ccc(F)cc2)CC1	ZINC000819246995	FG	On-Demand	Anodyne	WNT3	46	35
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccc(F)cc2)CC1	ZINC000819246996	FG	On-Demand	Anodyne	CCR3	15	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccc(F)cc2)CC1	ZINC000819246996	FG	On-Demand	Anodyne	GPR119	51	46
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccc(F)cc2)CC1	ZINC000819246996	FG	On-Demand	Anodyne	SFRP1	46	38
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)Cc2ccc(F)cc2)CC1	ZINC000819246996	FG	On-Demand	Anodyne	WNT3	46	35
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccc(F)cc2)CC1	ZINC000819246997	FG	On-Demand	Anodyne	CCR3	15	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccc(F)cc2)CC1	ZINC000819246997	FG	On-Demand	Anodyne	GPR119	51	46
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccc(F)cc2)CC1	ZINC000819246997	FG	On-Demand	Anodyne	SFRP1	46	38
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)Cc2ccc(F)cc2)CC1	ZINC000819246997	FG	On-Demand	Anodyne	WNT3	46	35
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819247011	GH	On-Demand	Anodyne	GPR119	40	45
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819247011	GH	On-Demand	Anodyne	SFRP1	50	38
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819247011	GH	On-Demand	Anodyne	WNT3	44	35
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819247012	GH	On-Demand	Anodyne	GPR119	40	45
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819247012	GH	On-Demand	Anodyne	SFRP1	50	38
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819247012	GH	On-Demand	Anodyne	WNT3	44	35
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819247013	GH	On-Demand	Anodyne	GPR119	40	45
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819247013	GH	On-Demand	Anodyne	SFRP1	50	38
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819247013	GH	On-Demand	Anodyne	WNT3	44	35
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819247014	GH	On-Demand	Anodyne	GPR119	40	45
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819247014	GH	On-Demand	Anodyne	SFRP1	50	38
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)Cc2cccc(Cl)c2)CC1	ZINC000819247014	GH	On-Demand	Anodyne	WNT3	44	35
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819247025	GG	On-Demand	Anodyne	ADRB2	34	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819247025	GG	On-Demand	Anodyne	ADRB1	52	43
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819247025	GG	On-Demand	Anodyne	ADRB3	42	46
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819247025	GG	On-Demand	Anodyne	GPR119	48	44
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819247026	GG	On-Demand	Anodyne	ADRB2	34	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819247026	GG	On-Demand	Anodyne	ADRB1	52	43
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819247026	GG	On-Demand	Anodyne	ADRB3	42	46
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819247026	GG	On-Demand	Anodyne	GPR119	48	44
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819247027	GG	On-Demand	Anodyne	ADRB2	34	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819247027	GG	On-Demand	Anodyne	ADRB1	52	43
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819247027	GG	On-Demand	Anodyne	ADRB3	42	46
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819247027	GG	On-Demand	Anodyne	GPR119	48	44
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819247028	GG	On-Demand	Anodyne	ADRB2	34	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819247028	GG	On-Demand	Anodyne	ADRB1	52	43
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819247028	GG	On-Demand	Anodyne	ADRB3	42	46
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819247028	GG	On-Demand	Anodyne	GPR119	48	44
Cn1cc(CCNC[C@@H](O)c2cccnc2)c2ccc(Cl)cc21	ZINC000819247030	EG	On-Demand	Anodyne	ADRB2	34	47
Cn1cc(CCNC[C@@H](O)c2cccnc2)c2ccc(Cl)cc21	ZINC000819247030	EG	On-Demand	Anodyne	ADRB1	48	47
Cn1cc(CCNC[C@@H](O)c2cccnc2)c2ccc(Cl)cc21	ZINC000819247030	EG	On-Demand	Anodyne	ADRB3	134	51
Cn1cc(CCNC[C@H](O)c2cccnc2)c2ccc(Cl)cc21	ZINC000819247031	EG	On-Demand	Anodyne	ADRB2	34	47
Cn1cc(CCNC[C@H](O)c2cccnc2)c2ccc(Cl)cc21	ZINC000819247031	EG	On-Demand	Anodyne	ADRB1	48	47
Cn1cc(CCNC[C@H](O)c2cccnc2)c2ccc(Cl)cc21	ZINC000819247031	EG	On-Demand	Anodyne	ADRB3	134	51
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@@H](O)c1ccccc1	ZINC000819247107	EF	On-Demand	Anodyne	GRIN2B	18	40
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@@H](O)c1ccccc1	ZINC000819247107	EF	On-Demand	Anodyne	GPR119	45	44
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@@H](O)c1ccccc1	ZINC000819247108	EF	On-Demand	Anodyne	GRIN2B	18	40
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@@H](O)c1ccccc1	ZINC000819247108	EF	On-Demand	Anodyne	GPR119	45	44
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NCCC(=O)Nc1ccccc1F	ZINC000819247115	GG	On-Demand	Anodyne	GPR119	41	46
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NCCC(=O)Nc1ccccc1F	ZINC000819247116	GG	On-Demand	Anodyne	GPR119	41	46
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NCCC(=O)Nc1ccccc1F	ZINC000819247117	GG	On-Demand	Anodyne	GPR119	41	46
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NCCC(=O)Nc1ccccc1F	ZINC000819247118	GG	On-Demand	Anodyne	GPR119	41	46
CCOc1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247140	DE	On-Demand	Anodyne	ADRB2	40	40
CCOc1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247140	DE	On-Demand	Anodyne	ADRB1	55	40
CCOc1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247141	DE	On-Demand	Anodyne	ADRB2	40	40
CCOc1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247141	DE	On-Demand	Anodyne	ADRB1	55	40
CCOc1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247142	DE	On-Demand	Anodyne	ADRB2	40	40
CCOc1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247142	DE	On-Demand	Anodyne	ADRB1	55	40
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247143	DE	On-Demand	Anodyne	ADRB2	40	40
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247143	DE	On-Demand	Anodyne	ADRB1	55	40
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819247149	GG	On-Demand	Anodyne	ADRB2	28	43
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819247149	GG	On-Demand	Anodyne	ADRB1	22	43
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819247149	GG	On-Demand	Anodyne	ABCB1	15	41
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819247149	GG	On-Demand	Anodyne	GPR119	39	42
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819247150	GG	On-Demand	Anodyne	ADRB2	28	43
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819247150	GG	On-Demand	Anodyne	ADRB1	22	43
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819247150	GG	On-Demand	Anodyne	ABCB1	15	41
Cc1ccc(OC[C@@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819247150	GG	On-Demand	Anodyne	GPR119	39	42
Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819247151	GG	On-Demand	Anodyne	ADRB2	28	43
Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819247151	GG	On-Demand	Anodyne	ADRB1	22	43
Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819247151	GG	On-Demand	Anodyne	ABCB1	15	41
Cc1ccc(OC[C@H](O)CN[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819247151	GG	On-Demand	Anodyne	GPR119	39	42
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819247152	GG	On-Demand	Anodyne	ADRB2	28	43
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819247152	GG	On-Demand	Anodyne	ADRB1	22	43
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819247152	GG	On-Demand	Anodyne	ABCB1	15	41
Cc1ccc(OC[C@H](O)CN[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819247152	GG	On-Demand	Anodyne	GPR119	39	42
COc1ccc(OC)c([C@H](O)CNCC2CCN(CC(F)(F)F)CC2)c1	ZINC000819247184	GF	On-Demand	Anodyne	HPGDS	30	41
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247199	DD	On-Demand	Anodyne	ADRB2	46	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247199	DD	On-Demand	Anodyne	ADRB1	81	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247199	DD	On-Demand	Anodyne	GRIN1	27	42
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247199	DD	On-Demand	Anodyne	ADRB3	55	52
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247200	DD	On-Demand	Anodyne	ADRB2	46	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247200	DD	On-Demand	Anodyne	ADRB1	81	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247200	DD	On-Demand	Anodyne	GRIN1	27	42
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247200	DD	On-Demand	Anodyne	ADRB3	55	52
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247201	DD	On-Demand	Anodyne	ADRB2	46	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247201	DD	On-Demand	Anodyne	ADRB1	81	54
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247201	DD	On-Demand	Anodyne	GRIN1	27	42
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247201	DD	On-Demand	Anodyne	ADRB3	55	52
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247202	DD	On-Demand	Anodyne	ADRB2	46	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247202	DD	On-Demand	Anodyne	ADRB1	81	54
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247202	DD	On-Demand	Anodyne	GRIN1	27	42
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247202	DD	On-Demand	Anodyne	ADRB3	55	52
COCCc1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247203	DD	On-Demand	Anodyne	ADRB2	41	55
COCCc1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247203	DD	On-Demand	Anodyne	ADRB1	71	55
COCCc1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247203	DD	On-Demand	Anodyne	GRIN1	19	41
COCCc1ccc(OC[C@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247203	DD	On-Demand	Anodyne	ADRB3	47	45
COCCc1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247204	DD	On-Demand	Anodyne	ADRB2	41	55
COCCc1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247204	DD	On-Demand	Anodyne	ADRB1	71	55
COCCc1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247204	DD	On-Demand	Anodyne	GRIN1	19	41
COCCc1ccc(OC[C@@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247204	DD	On-Demand	Anodyne	ADRB3	47	45
COCCc1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247205	DD	On-Demand	Anodyne	ADRB2	41	55
COCCc1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247205	DD	On-Demand	Anodyne	ADRB1	71	55
COCCc1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247205	DD	On-Demand	Anodyne	GRIN1	19	41
COCCc1ccc(OC[C@H](O)CNC[C@H]2CCC=CO2)cc1	ZINC000819247205	DD	On-Demand	Anodyne	ADRB3	47	45
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247206	DD	On-Demand	Anodyne	ADRB2	41	55
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247206	DD	On-Demand	Anodyne	ADRB1	71	55
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247206	DD	On-Demand	Anodyne	GRIN1	19	41
COCCc1ccc(OC[C@@H](O)CNC[C@@H]2CCC=CO2)cc1	ZINC000819247206	DD	On-Demand	Anodyne	ADRB3	47	45
CCc1csc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819247238	FG	On-Demand	Mild	PAPA1_CARPA	41	47
CCc1csc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819247239	FG	On-Demand	Mild	PAPA1_CARPA	41	47
O=C(C(F)=C1CCC1)N1CC[C@@H](c2cccc(F)c2)C1	ZINC000819247240	CH	On-Demand	Anodyne	CCR5	65	32
O=C(C(F)=C1CCC1)N1CC[C@H](c2cccc(F)c2)C1	ZINC000819247241	CH	On-Demand	Anodyne	CCR5	65	32
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@@H](O)COCc1ccccc1	ZINC000819247249	GF	On-Demand	Anodyne	GHSR	35	46
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@@H](O)COCc1ccccc1	ZINC000819247249	GF	On-Demand	Anodyne	GPR119	37	41
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@@H](O)COCc1ccccc1	ZINC000819247250	GF	On-Demand	Anodyne	GHSR	35	46
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@@H](O)COCc1ccccc1	ZINC000819247250	GF	On-Demand	Anodyne	GPR119	37	41
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@H](O)COCc1ccccc1	ZINC000819247251	GF	On-Demand	Anodyne	GHSR	35	46
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@H](O)COCc1ccccc1	ZINC000819247251	GF	On-Demand	Anodyne	GPR119	37	41
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@H](O)COCc1ccccc1	ZINC000819247252	GF	On-Demand	Anodyne	GHSR	35	46
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@H](O)COCc1ccccc1	ZINC000819247252	GF	On-Demand	Anodyne	GPR119	37	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCO[C@@H](c3ccccc3)C1)C2	ZINC000819247271	FF	On-Demand	Anodyne	ADAM10	27	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCO[C@H](c3ccccc3)C1)C2	ZINC000819247272	FF	On-Demand	Anodyne	ADAM10	27	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCO[C@H](c3ccccc3)C1)C2	ZINC000819247273	FF	On-Demand	Anodyne	ADAM10	27	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCO[C@@H](c3ccccc3)C1)C2	ZINC000819247274	FF	On-Demand	Anodyne	ADAM10	27	41
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819247290	GF	On-Demand	Bother	CACNA1D	49	33
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819247291	GF	On-Demand	Bother	CACNA1D	49	33
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819247293	GF	On-Demand	Bother	CACNA1D	49	33
O=C(CCNOC1CCCCC1)Nc1cccnc1	ZINC000819247294	CE	On-Demand	Anodyne	CHRNA7	24	43
O=C(CCNOC1CCCCC1)Nc1cccnc1	ZINC000819247294	CE	On-Demand	Anodyne	NAMPT	36	48
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819247295	GF	On-Demand	Bother	CACNA1D	49	33
O[C@H](CNOC1CCCCC1)COc1ccccc1F	ZINC000819247296	CE	On-Demand	Anodyne	ADRB2	34	49
O[C@H](CNOC1CCCCC1)COc1ccccc1F	ZINC000819247296	CE	On-Demand	Anodyne	ADRB1	49	49
O[C@H](CNOC1CCCCC1)COc1ccccc1F	ZINC000819247296	CE	On-Demand	Anodyne	ABCB1	24	45
O[C@@H](CNOC1CCCCC1)COc1ccccc1F	ZINC000819247298	CE	On-Demand	Anodyne	ADRB2	34	49
O[C@@H](CNOC1CCCCC1)COc1ccccc1F	ZINC000819247298	CE	On-Demand	Anodyne	ADRB1	49	49
O[C@@H](CNOC1CCCCC1)COc1ccccc1F	ZINC000819247298	CE	On-Demand	Anodyne	ABCB1	24	45
O=C(CCNOCCC(F)(F)F)Nc1cccc(C(F)(F)F)c1	ZINC000819247314	EH	On-Demand	Anodyne	KDR	15	40
COc1cccc(OC)c1OC[C@H](O)CNOC1CCCCC1	ZINC000819247317	EE	On-Demand	Anodyne	ADRB2	36	51
COc1cccc(OC)c1OC[C@H](O)CNOC1CCCCC1	ZINC000819247317	EE	On-Demand	Anodyne	ADRB1	44	51
CCN1CCC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819247318	FE	On-Demand	Mild	PAPA1_CARPA	36	47
COc1cccc(OC)c1OC[C@@H](O)CNOC1CCCCC1	ZINC000819247319	EE	On-Demand	Anodyne	ADRB2	36	51
COc1cccc(OC)c1OC[C@@H](O)CNOC1CCCCC1	ZINC000819247319	EE	On-Demand	Anodyne	ADRB1	44	51
CCN1CCC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819247320	FE	On-Demand	Mild	PAPA1_CARPA	36	47
CCN1CCC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819247322	FE	On-Demand	Mild	PAPA1_CARPA	36	47
CCN1CCC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819247324	FE	On-Demand	Mild	PAPA1_CARPA	36	47
CCOc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819247325	DF	On-Demand	Anodyne	ADRB2	48	46
CCOc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819247325	DF	On-Demand	Anodyne	ADRB1	58	54
CCOc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819247327	DF	On-Demand	Anodyne	ADRB2	48	46
CCOc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819247327	DF	On-Demand	Anodyne	ADRB1	58	54
C/C=C/c1ccc(OC[C@H](O)CNOC2CCCCC2)c(OC)c1	ZINC000819247362	EG	On-Demand	Anodyne	ADRB1	19	67
C/C=C\c1ccc(OC[C@H](O)CNOC2CCCCC2)c(OC)c1	ZINC000819247363	EG	On-Demand	Anodyne	ADRB1	19	67
C/C=C\c1ccc(OC[C@@H](O)CNOC2CCCCC2)c(OC)c1	ZINC000819247365	EG	On-Demand	Anodyne	ADRB1	19	67
C/C=C/c1ccc(OC[C@@H](O)CNOC2CCCCC2)c(OC)c1	ZINC000819247367	EG	On-Demand	Anodyne	ADRB1	19	67
Cc1cccc2c1CC[C@H]2NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819247375	FH	On-Demand	Mild	PAPA1_CARPA	41	41
Cc1cccc2c1CC[C@H]2NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819247375	FH	On-Demand	Mild	CTSL	15	41
Cc1cccc2c1CC[C@H]2NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819247375	FH	On-Demand	Mild	FPR1	44	38
Cc1cccc2c1CC[C@H]2NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819247377	FH	On-Demand	Mild	PAPA1_CARPA	41	41
Cc1cccc2c1CC[C@H]2NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819247377	FH	On-Demand	Mild	CTSL	15	41
Cc1cccc2c1CC[C@H]2NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819247377	FH	On-Demand	Mild	FPR1	44	38
Cc1cccc2c1CC[C@@H]2NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819247379	FH	On-Demand	Mild	PAPA1_CARPA	41	41
Cc1cccc2c1CC[C@@H]2NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819247379	FH	On-Demand	Mild	CTSL	15	41
Cc1cccc2c1CC[C@@H]2NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819247379	FH	On-Demand	Mild	FPR1	44	38
Cc1cccc2c1CC[C@@H]2NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819247381	FH	On-Demand	Mild	PAPA1_CARPA	41	41
Cc1cccc2c1CC[C@@H]2NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819247381	FH	On-Demand	Mild	CTSL	15	41
Cc1cccc2c1CC[C@@H]2NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819247381	FH	On-Demand	Mild	FPR1	44	38
CC(=O)c1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819247418	DE	On-Demand	Anodyne	ADRB2	41	46
CC(=O)c1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819247418	DE	On-Demand	Anodyne	ADRB1	61	50
CC(=O)c1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819247418	DE	On-Demand	Anodyne	ADRB3	37	40
CC(=O)c1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819247418	DE	On-Demand	Anodyne	ABCB1	18	53
CC(=O)c1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819247419	DE	On-Demand	Anodyne	ADRB2	41	46
CC(=O)c1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819247419	DE	On-Demand	Anodyne	ADRB1	61	50
CC(=O)c1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819247419	DE	On-Demand	Anodyne	ADRB3	37	40
CC(=O)c1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819247419	DE	On-Demand	Anodyne	ABCB1	18	53
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccc(F)c(F)c1	ZINC000819247425	FF	On-Demand	Anodyne	SLC6A3	19	40
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccc(F)c(F)c1	ZINC000819247427	FF	On-Demand	Anodyne	SLC6A3	19	40
O[C@@H](CNOCCC(F)(F)F)COc1cccc(C(F)(F)F)c1	ZINC000819247428	EF	On-Demand	Anodyne	ADRB2	15	41
O[C@@H](CNOCCC(F)(F)F)COc1cccc(C(F)(F)F)c1	ZINC000819247428	EF	On-Demand	Anodyne	ADRB1	19	41
O[C@@H](CNOCCC(F)(F)F)COc1cccc(C(F)(F)F)c1	ZINC000819247428	EF	On-Demand	Anodyne	PDS	49	42
O[C@H](CNOCCC(F)(F)F)COc1cccc(C(F)(F)F)c1	ZINC000819247430	EF	On-Demand	Anodyne	ADRB2	15	41
O[C@H](CNOCCC(F)(F)F)COc1cccc(C(F)(F)F)c1	ZINC000819247430	EF	On-Demand	Anodyne	ADRB1	19	41
O[C@H](CNOCCC(F)(F)F)COc1cccc(C(F)(F)F)c1	ZINC000819247430	EF	On-Demand	Anodyne	PDS	49	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819247438	GH	On-Demand	Anodyne	GPR119	45	47
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819247438	GH	On-Demand	Anodyne	SFRP1	48	38
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819247438	GH	On-Demand	Anodyne	WNT3	42	35
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819247440	GH	On-Demand	Anodyne	GPR119	45	47
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819247440	GH	On-Demand	Anodyne	SFRP1	48	38
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819247440	GH	On-Demand	Anodyne	WNT3	42	35
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819247441	GH	On-Demand	Anodyne	GPR119	45	47
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819247441	GH	On-Demand	Anodyne	SFRP1	48	38
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819247441	GH	On-Demand	Anodyne	WNT3	42	35
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819247443	GH	On-Demand	Anodyne	GPR119	45	47
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819247443	GH	On-Demand	Anodyne	SFRP1	48	38
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)CC1	ZINC000819247443	GH	On-Demand	Anodyne	WNT3	42	35
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247457	GF	On-Demand	Anodyne	ADRB2	22	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247457	GF	On-Demand	Anodyne	ADRB1	25	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247457	GF	On-Demand	Anodyne	GRIN2B	23	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247457	GF	On-Demand	Anodyne	CACNA1B	28	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247457	GF	On-Demand	Anodyne	GHSR	33	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247457	GF	On-Demand	Anodyne	CCR8	31	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247457	GF	On-Demand	Anodyne	BIRC2	17	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247457	GF	On-Demand	Anodyne	GPR119	44	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247457	GF	On-Demand	Anodyne	SFRP1	96	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247457	GF	On-Demand	Anodyne	WNT3	75	37
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247458	GF	On-Demand	Anodyne	ADRB2	22	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247458	GF	On-Demand	Anodyne	ADRB1	25	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247458	GF	On-Demand	Anodyne	GRIN2B	23	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247458	GF	On-Demand	Anodyne	CACNA1B	28	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247458	GF	On-Demand	Anodyne	GHSR	33	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247458	GF	On-Demand	Anodyne	CCR8	31	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247458	GF	On-Demand	Anodyne	BIRC2	17	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247458	GF	On-Demand	Anodyne	GPR119	44	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247458	GF	On-Demand	Anodyne	SFRP1	96	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@H](O)COCc2ccccc2)CC1	ZINC000819247458	GF	On-Demand	Anodyne	WNT3	75	37
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247459	GF	On-Demand	Anodyne	ADRB2	22	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247459	GF	On-Demand	Anodyne	ADRB1	25	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247459	GF	On-Demand	Anodyne	GRIN2B	23	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247459	GF	On-Demand	Anodyne	CACNA1B	28	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247459	GF	On-Demand	Anodyne	GHSR	33	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247459	GF	On-Demand	Anodyne	CCR8	31	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247459	GF	On-Demand	Anodyne	BIRC2	17	40
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247459	GF	On-Demand	Anodyne	GPR119	44	42
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247459	GF	On-Demand	Anodyne	SFRP1	96	41
CC(C)(C)OC(=O)N1CCC[C@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247459	GF	On-Demand	Anodyne	WNT3	75	37
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247460	GF	On-Demand	Anodyne	ADRB2	22	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247460	GF	On-Demand	Anodyne	ADRB1	25	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247460	GF	On-Demand	Anodyne	GRIN2B	23	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247460	GF	On-Demand	Anodyne	CACNA1B	28	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247460	GF	On-Demand	Anodyne	GHSR	33	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247460	GF	On-Demand	Anodyne	CCR8	31	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247460	GF	On-Demand	Anodyne	BIRC2	17	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247460	GF	On-Demand	Anodyne	GPR119	44	42
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247460	GF	On-Demand	Anodyne	SFRP1	96	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC[C@@H](O)COCc2ccccc2)CC1	ZINC000819247460	GF	On-Demand	Anodyne	WNT3	75	37
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccc(Cl)cc1Cl	ZINC000819247463	GH	On-Demand	Anodyne	CACNA1I	56	36
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1ccc(Cl)cc1Cl	ZINC000819247464	GH	On-Demand	Anodyne	CACNA1I	56	36
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccc2ccccc12	ZINC000819247475	FH	On-Demand	Anodyne	HTR4	40	36
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccc(Cl)c1	ZINC000819247476	FG	On-Demand	Anodyne	ADRB1	38	44
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccc(Cl)c1	ZINC000819247476	FG	On-Demand	Anodyne	ADRB3	53	44
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccc(Cl)c1	ZINC000819247476	FG	On-Demand	Anodyne	CYP3A4	42	33
O[C@@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccc(Cl)c1	ZINC000819247476	FG	On-Demand	Anodyne	CACNA1I	56	40
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccc(Cl)c1	ZINC000819247477	FG	On-Demand	Anodyne	ADRB1	38	44
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccc(Cl)c1	ZINC000819247477	FG	On-Demand	Anodyne	ADRB3	53	44
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccc(Cl)c1	ZINC000819247477	FG	On-Demand	Anodyne	CYP3A4	42	33
O[C@H](CNCC1CCN(CC(F)(F)F)CC1)c1cccc(Cl)c1	ZINC000819247477	FG	On-Demand	Anodyne	CACNA1I	56	40
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@@H](O)COc1ccccc1F	ZINC000819247514	GF	On-Demand	Anodyne	ADRB2	28	41
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@@H](O)COc1ccccc1F	ZINC000819247514	GF	On-Demand	Anodyne	ADRB3	19	41
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@@H](O)COc1ccccc1F	ZINC000819247514	GF	On-Demand	Anodyne	ABCB1	33	45
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@@H](O)COc1ccccc1F	ZINC000819247514	GF	On-Demand	Anodyne	GPR119	43	49
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@H](O)COc1ccccc1F	ZINC000819247515	GF	On-Demand	Anodyne	ADRB2	28	41
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@H](O)COc1ccccc1F	ZINC000819247515	GF	On-Demand	Anodyne	ADRB3	19	41
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@H](O)COc1ccccc1F	ZINC000819247515	GF	On-Demand	Anodyne	ABCB1	33	45
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@H](O)COc1ccccc1F	ZINC000819247515	GF	On-Demand	Anodyne	GPR119	43	49
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@@H](O)COc1ccccc1F	ZINC000819247516	GF	On-Demand	Anodyne	ADRB2	28	41
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@@H](O)COc1ccccc1F	ZINC000819247516	GF	On-Demand	Anodyne	ADRB3	19	41
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@@H](O)COc1ccccc1F	ZINC000819247516	GF	On-Demand	Anodyne	ABCB1	33	45
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@@H](O)COc1ccccc1F	ZINC000819247516	GF	On-Demand	Anodyne	GPR119	43	49
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@H](O)COc1ccccc1F	ZINC000819247517	GF	On-Demand	Anodyne	ADRB2	28	41
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@H](O)COc1ccccc1F	ZINC000819247517	GF	On-Demand	Anodyne	ADRB3	19	41
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@H](O)COc1ccccc1F	ZINC000819247517	GF	On-Demand	Anodyne	ABCB1	33	45
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@H](O)COc1ccccc1F	ZINC000819247517	GF	On-Demand	Anodyne	GPR119	43	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2CN(S(C)(=O)=O)C2)CC1	ZINC000819247583	GC	On-Demand	Anodyne	GPR119	45	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2CN(S(C)(=O)=O)C2)CC1	ZINC000819247585	GC	On-Demand	Anodyne	GPR119	45	45
C[C@@H]1CCCC[C@H]1C(=O)N1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819247586	EF	On-Demand	Anodyne	SLC6A3	17	44
C[C@@H]1CCCC[C@@H]1C(=O)N1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819247588	EF	On-Demand	Anodyne	SLC6A3	17	44
C[C@@H]1CCCC[C@@H]1C(=O)N1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819247591	EF	On-Demand	Anodyne	SLC6A3	17	44
C[C@@H]1CCCC[C@H]1C(=O)N1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819247593	EF	On-Demand	Anodyne	SLC6A3	17	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNOCCC(F)(F)F)CC1	ZINC000819247611	FE	On-Demand	Anodyne	GPR119	34	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNOCCC(F)(F)F)CC1	ZINC000819247612	FE	On-Demand	Anodyne	GPR119	34	43
CC(=O)c1cccc(OC[C@H](O)CNOCCC(F)(F)F)c1	ZINC000819247635	DE	On-Demand	Anodyne	ADRB2	22	45
CC(=O)c1cccc(OC[C@H](O)CNOCCC(F)(F)F)c1	ZINC000819247635	DE	On-Demand	Anodyne	ADRB1	33	40
CC(=O)c1cccc(OC[C@H](O)CNOCCC(F)(F)F)c1	ZINC000819247635	DE	On-Demand	Anodyne	ABCB1	15	44
CC(=O)c1cccc(OC[C@H](O)CNOCCC(F)(F)F)c1	ZINC000819247635	DE	On-Demand	Anodyne	PDS	60	33
CC(=O)c1cccc(OC[C@@H](O)CNOCCC(F)(F)F)c1	ZINC000819247636	DE	On-Demand	Anodyne	ADRB2	22	45
CC(=O)c1cccc(OC[C@@H](O)CNOCCC(F)(F)F)c1	ZINC000819247636	DE	On-Demand	Anodyne	ADRB1	33	40
CC(=O)c1cccc(OC[C@@H](O)CNOCCC(F)(F)F)c1	ZINC000819247636	DE	On-Demand	Anodyne	ABCB1	15	44
CC(=O)c1cccc(OC[C@@H](O)CNOCCC(F)(F)F)c1	ZINC000819247636	DE	On-Demand	Anodyne	PDS	60	33
O=[N+]([O-])c1cccc(OC[C@H](O)CNOC2CCCCC2)c1	ZINC000819247639	DE	On-Demand	Bother	ADRB2	20	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNOC2CCCCC2)c1	ZINC000819247639	DE	On-Demand	Bother	ADRB1	39	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNOC2CCCCC2)c1	ZINC000819247639	DE	On-Demand	Bother	ADRB3	16	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNOC2CCCCC2)c1	ZINC000819247639	DE	On-Demand	Bother	CACNA1D	55	33
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOC2CCCCC2)c1	ZINC000819247640	DE	On-Demand	Bother	ADRB2	20	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOC2CCCCC2)c1	ZINC000819247640	DE	On-Demand	Bother	ADRB1	39	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOC2CCCCC2)c1	ZINC000819247640	DE	On-Demand	Bother	ADRB3	16	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOC2CCCCC2)c1	ZINC000819247640	DE	On-Demand	Bother	CACNA1D	55	33
O[C@@H](CNOC1CCCCC1)COCc1ccc(Cl)cc1	ZINC000819247648	DG	On-Demand	Anodyne	ADRB1	15	42
O[C@H](CNOC1CCCCC1)COCc1ccc(Cl)cc1	ZINC000819247649	DG	On-Demand	Anodyne	ADRB1	15	42
C=CCc1ccc(OC[C@@H](O)CNOC2CCCCC2)c(OC)c1	ZINC000819247660	EG	On-Demand	Mild	ADRB2	16	42
C=CCc1ccc(OC[C@@H](O)CNOC2CCCCC2)c(OC)c1	ZINC000819247660	EG	On-Demand	Mild	ADRB1	23	44
C=CCc1ccc(OC[C@H](O)CNOC2CCCCC2)c(OC)c1	ZINC000819247661	EG	On-Demand	Mild	ADRB2	16	42
C=CCc1ccc(OC[C@H](O)CNOC2CCCCC2)c(OC)c1	ZINC000819247661	EG	On-Demand	Mild	ADRB1	23	44
N#CCc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819247681	DE	On-Demand	Mild	ADRB2	35	43
N#CCc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819247681	DE	On-Demand	Mild	ADRB1	55	52
N#CCc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819247681	DE	On-Demand	Mild	ADRB3	31	40
N#CCc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819247682	DE	On-Demand	Mild	ADRB2	35	43
N#CCc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819247682	DE	On-Demand	Mild	ADRB1	55	52
N#CCc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819247682	DE	On-Demand	Mild	ADRB3	31	40
O[C@@H](CNOCCC(F)(F)F)COc1ccc(-c2ccccc2)cc1	ZINC000819247683	FH	On-Demand	Anodyne	ADRB2	38	44
O[C@@H](CNOCCC(F)(F)F)COc1ccc(-c2ccccc2)cc1	ZINC000819247683	FH	On-Demand	Anodyne	ADRB1	50	42
O[C@@H](CNOCCC(F)(F)F)COc1ccc(-c2ccccc2)cc1	ZINC000819247683	FH	On-Demand	Anodyne	ADRB3	31	42
O[C@H](CNOCCC(F)(F)F)COc1ccc(-c2ccccc2)cc1	ZINC000819247684	FH	On-Demand	Anodyne	ADRB2	38	44
O[C@H](CNOCCC(F)(F)F)COc1ccc(-c2ccccc2)cc1	ZINC000819247684	FH	On-Demand	Anodyne	ADRB1	50	42
O[C@H](CNOCCC(F)(F)F)COc1ccc(-c2ccccc2)cc1	ZINC000819247684	FH	On-Demand	Anodyne	ADRB3	31	42
OCC[C@@H]1CCC[C@@H]1NC[C@@H](O)c1cccnc1	ZINC000819247689	CD	On-Demand	Anodyne	ADRB1	22	42
OCC[C@@H]1CCC[C@@H]1NC[C@@H](O)c1cccnc1	ZINC000819247689	CD	On-Demand	Anodyne	ADRB3	69	42
OCC[C@@H]1CCC[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819247690	CD	On-Demand	Anodyne	ADRB1	22	42
OCC[C@@H]1CCC[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819247690	CD	On-Demand	Anodyne	ADRB3	69	42
OCC[C@@H]1CCC[C@@H]1NC[C@H](O)c1cccnc1	ZINC000819247691	CD	On-Demand	Anodyne	ADRB1	22	42
OCC[C@@H]1CCC[C@@H]1NC[C@H](O)c1cccnc1	ZINC000819247691	CD	On-Demand	Anodyne	ADRB3	69	42
OCC[C@@H]1CCC[C@H]1NC[C@H](O)c1cccnc1	ZINC000819247692	CD	On-Demand	Anodyne	ADRB1	22	42
OCC[C@@H]1CCC[C@H]1NC[C@H](O)c1cccnc1	ZINC000819247692	CD	On-Demand	Anodyne	ADRB3	69	42
N#Cc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819247820	CE	On-Demand	Mild	ADRB2	29	43
N#Cc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819247820	CE	On-Demand	Mild	ADRB1	44	49
N#Cc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819247821	CE	On-Demand	Mild	ADRB2	29	43
N#Cc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819247821	CE	On-Demand	Mild	ADRB1	44	49
O=[N+]([O-])c1ccccc1OC[C@H](O)CNOCCC(F)(F)F	ZINC000819247828	DD	On-Demand	Bother	ADRB1	54	32
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNOCCC(F)(F)F	ZINC000819247829	DD	On-Demand	Bother	ADRB1	54	32
O=C(CCNOC1CCCCC1)Nc1ccccc1	ZINC000819247858	CF	On-Demand	Anodyne	HDAC8	22	47
O=C(CCNOC1CCCCC1)Nc1ccccc1	ZINC000819247858	CF	On-Demand	Anodyne	HDAC10	44	47
O=C(CCNOC1CCCCC1)Nc1ccccc1	ZINC000819247858	CF	On-Demand	Anodyne	HDAC1	15	47
O=C(CCNOC1CCCCC1)Nc1ccccc1	ZINC000819247858	CF	On-Demand	Anodyne	HDAC2	29	47
O=C(CCNOC1CCCCC1)Nc1ccccc1	ZINC000819247858	CF	On-Demand	Anodyne	HDAC3	31	47
O=C(CCNOC1CCCCC1)Nc1ccccc1	ZINC000819247858	CF	On-Demand	Anodyne	HDAC6	32	47
O=C(CCNOC1CCCCC1)Nc1ccccc1	ZINC000819247858	CF	On-Demand	Anodyne	HDAC11	37	47
CC(=O)c1cccc(OC[C@@H](O)CNOC2CCCCC2)c1	ZINC000819247864	DE	On-Demand	Anodyne	ADRB2	36	48
CC(=O)c1cccc(OC[C@@H](O)CNOC2CCCCC2)c1	ZINC000819247864	DE	On-Demand	Anodyne	ADRB1	54	44
CC(=O)c1cccc(OC[C@@H](O)CNOC2CCCCC2)c1	ZINC000819247864	DE	On-Demand	Anodyne	ABCB1	25	48
CC(=O)c1cccc(OC[C@H](O)CNOC2CCCCC2)c1	ZINC000819247865	DE	On-Demand	Anodyne	ADRB2	36	48
CC(=O)c1cccc(OC[C@H](O)CNOC2CCCCC2)c1	ZINC000819247865	DE	On-Demand	Anodyne	ADRB1	54	44
CC(=O)c1cccc(OC[C@H](O)CNOC2CCCCC2)c1	ZINC000819247865	DE	On-Demand	Anodyne	ABCB1	25	48
O=C(CCNOCCC(F)(F)F)Nc1ccc(Oc2ccccc2)cc1	ZINC000819247869	FI	On-Demand	Anodyne	LTA4H	56	50
O=C(CCNOCCC(F)(F)F)Nc1ccc(Oc2ccccc2)cc1	ZINC000819247869	FI	On-Demand	Anodyne	CA1	29	42
O[C@@H](CNOCCC(F)(F)F)COc1cccc2[nH]ccc12	ZINC000819247874	DE	On-Demand	Anodyne	ADRB2	15	60
O[C@@H](CNOCCC(F)(F)F)COc1cccc2[nH]ccc12	ZINC000819247874	DE	On-Demand	Anodyne	ADRB1	23	60
O[C@H](CNOCCC(F)(F)F)COc1cccc2[nH]ccc12	ZINC000819247875	DE	On-Demand	Anodyne	ADRB2	15	60
O[C@H](CNOCCC(F)(F)F)COc1cccc2[nH]ccc12	ZINC000819247875	DE	On-Demand	Anodyne	ADRB1	23	60
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCC[C@H]2CCO)CC1	ZINC000819247940	FE	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCC[C@@H]2CCO)CC1	ZINC000819247941	FE	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCC[C@@H]2CCO)CC1	ZINC000819247942	FE	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCC[C@H]2CCO)CC1	ZINC000819247943	FE	On-Demand	Anodyne	GPR119	25	40
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819247944	GF	On-Demand	Mild	GPR119	41	48
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819247945	GF	On-Demand	Mild	GPR119	41	48
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819247946	GF	On-Demand	Mild	GPR119	41	48
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819247947	GF	On-Demand	Mild	GPR119	41	48
Cc1ncsc1C(=O)NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819247949	GD	On-Demand	Reactive	PAPA1_CARPA	41	43
Cc1ncsc1C(=O)NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819247950	GD	On-Demand	Reactive	PAPA1_CARPA	41	43
C[C@@H](CC(=O)N1CCN(C[C@@H](O)c2ccccc2)CC1)n1cccn1	ZINC000819247952	ED	On-Demand	Anodyne	PTAFR	34	48
C[C@@H](CC(=O)N1CCN(C[C@H](O)c2ccccc2)CC1)n1cccn1	ZINC000819247954	ED	On-Demand	Anodyne	PTAFR	34	48
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NCCC(=O)Nc1cccnc1	ZINC000819247985	FF	On-Demand	Anodyne	GPR119	40	42
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NCCC(=O)Nc1cccnc1	ZINC000819247985	FF	On-Demand	Anodyne	NAMPT	20	41
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NCCC(=O)Nc1cccnc1	ZINC000819247986	FF	On-Demand	Anodyne	GPR119	40	42
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NCCC(=O)Nc1cccnc1	ZINC000819247986	FF	On-Demand	Anodyne	NAMPT	20	41
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NCCC(=O)Nc1cccnc1	ZINC000819247987	FF	On-Demand	Anodyne	GPR119	40	42
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NCCC(=O)Nc1cccnc1	ZINC000819247987	FF	On-Demand	Anodyne	NAMPT	20	41
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NCCC(=O)Nc1cccnc1	ZINC000819247988	FF	On-Demand	Anodyne	GPR119	40	42
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NCCC(=O)Nc1cccnc1	ZINC000819247988	FF	On-Demand	Anodyne	NAMPT	20	41
O[C@@H](CNOC1CCCCC1)c1cccc(Cl)c1	ZINC000819247993	CG	On-Demand	Anodyne	ADRB1	47	49
O[C@@H](CNOC1CCCCC1)c1cccc(Cl)c1	ZINC000819247993	CG	On-Demand	Anodyne	ADRB3	57	49
O[C@@H](CNOC1CCCCC1)c1cccc(Cl)c1	ZINC000819247993	CG	On-Demand	Anodyne	CYP3A4	47	36
O[C@H](CNOC1CCCCC1)c1cccc(Cl)c1	ZINC000819247994	CG	On-Demand	Anodyne	ADRB1	47	49
O[C@H](CNOC1CCCCC1)c1cccc(Cl)c1	ZINC000819247994	CG	On-Demand	Anodyne	ADRB3	57	49
O[C@H](CNOC1CCCCC1)c1cccc(Cl)c1	ZINC000819247994	CG	On-Demand	Anodyne	CYP3A4	47	36
O[C@@H](CNOC1CCCCC1)c1ccc(F)cc1	ZINC000819247995	CF	On-Demand	Anodyne	SLC6A3	21	45
O[C@H](CNOC1CCCCC1)c1ccc(F)cc1	ZINC000819247996	CF	On-Demand	Anodyne	SLC6A3	21	45
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOCCC(F)(F)F)c1	ZINC000819247997	DD	On-Demand	Bother	PDS	19	42
O=[N+]([O-])c1cccc(OC[C@H](O)CNOCCC(F)(F)F)c1	ZINC000819247998	DD	On-Demand	Bother	PDS	19	42
O[C@H](CNOC1CCCCC1)COc1ccccc1	ZINC000819248000	CE	On-Demand	Anodyne	ADRB2	61	55
O[C@H](CNOC1CCCCC1)COc1ccccc1	ZINC000819248000	CE	On-Demand	Anodyne	ADRB1	79	50
O[C@H](CNOC1CCCCC1)COc1ccccc1	ZINC000819248000	CE	On-Demand	Anodyne	ADRB3	53	47
O[C@H](CNOC1CCCCC1)COc1ccccc1	ZINC000819248000	CE	On-Demand	Anodyne	CASR	15	43
O[C@H](CNOC1CCCCC1)COc1ccccc1	ZINC000819248000	CE	On-Demand	Anodyne	ABCB1	23	43
O[C@@H](CNOC1CCCCC1)COc1ccccc1	ZINC000819248001	CE	On-Demand	Anodyne	ADRB2	61	55
O[C@@H](CNOC1CCCCC1)COc1ccccc1	ZINC000819248001	CE	On-Demand	Anodyne	ADRB1	79	50
O[C@@H](CNOC1CCCCC1)COc1ccccc1	ZINC000819248001	CE	On-Demand	Anodyne	ADRB3	53	47
O[C@@H](CNOC1CCCCC1)COc1ccccc1	ZINC000819248001	CE	On-Demand	Anodyne	CASR	15	43
O[C@@H](CNOC1CCCCC1)COc1ccccc1	ZINC000819248001	CE	On-Demand	Anodyne	ABCB1	23	43
O[C@H](CNOC1CCCCC1)COc1ccc(Br)cc1	ZINC000819248002	EG	On-Demand	Anodyne	ADRB2	34	42
O[C@H](CNOC1CCCCC1)COc1ccc(Br)cc1	ZINC000819248002	EG	On-Demand	Anodyne	ADRB1	50	51
O[C@@H](CNOC1CCCCC1)COc1ccc(Br)cc1	ZINC000819248003	EG	On-Demand	Anodyne	ADRB2	34	42
O[C@@H](CNOC1CCCCC1)COc1ccc(Br)cc1	ZINC000819248003	EG	On-Demand	Anodyne	ADRB1	50	51
O[C@@H](CNOCCC(F)(F)F)c1cccc(Cl)c1	ZINC000819248019	CF	On-Demand	Anodyne	ADRB1	32	41
O[C@@H](CNOCCC(F)(F)F)c1cccc(Cl)c1	ZINC000819248019	CF	On-Demand	Anodyne	ADRB3	43	42
O[C@H](CNOCCC(F)(F)F)c1cccc(Cl)c1	ZINC000819248020	CF	On-Demand	Anodyne	ADRB1	32	41
O[C@H](CNOCCC(F)(F)F)c1cccc(Cl)c1	ZINC000819248020	CF	On-Demand	Anodyne	ADRB3	43	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cc(F)ccc1F	ZINC000819248038	EE	On-Demand	Anodyne	P2RX7	46	39
O[C@H](CNOCCC(F)(F)F)COc1cccc2ccccc12	ZINC000819248048	EG	On-Demand	Anodyne	ADRB2	25	56
O[C@H](CNOCCC(F)(F)F)COc1cccc2ccccc12	ZINC000819248048	EG	On-Demand	Anodyne	ADRB1	46	38
O[C@H](CNOCCC(F)(F)F)COc1cccc2ccccc12	ZINC000819248048	EG	On-Demand	Anodyne	CYP2D6	20	46
O[C@@H](CNOCCC(F)(F)F)COc1cccc2ccccc12	ZINC000819248049	EG	On-Demand	Anodyne	ADRB2	25	56
O[C@@H](CNOCCC(F)(F)F)COc1cccc2ccccc12	ZINC000819248049	EG	On-Demand	Anodyne	ADRB1	46	38
O[C@@H](CNOCCC(F)(F)F)COc1cccc2ccccc12	ZINC000819248049	EG	On-Demand	Anodyne	CYP2D6	20	46
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@H](O)COCc1ccccc1F	ZINC000819248160	GF	On-Demand	Anodyne	GPR119	35	52
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@H](O)COCc1ccccc1F	ZINC000819248161	GF	On-Demand	Anodyne	GPR119	35	52
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC[C@@H](O)COCc1ccccc1F	ZINC000819248162	GF	On-Demand	Anodyne	GPR119	35	52
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC[C@@H](O)COCc1ccccc1F	ZINC000819248163	GF	On-Demand	Anodyne	GPR119	35	52
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](c3cccc(F)c3)C1)C2	ZINC000819248212	FG	On-Demand	Anodyne	CCR5	48	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](c3cccc(F)c3)C1)C2	ZINC000819248212	FG	On-Demand	Anodyne	ADAM10	24	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](c3cccc(F)c3)C1)C2	ZINC000819248213	FG	On-Demand	Anodyne	CCR5	48	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](c3cccc(F)c3)C1)C2	ZINC000819248213	FG	On-Demand	Anodyne	ADAM10	24	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3cccc(F)c3)C1)C2	ZINC000819248214	FG	On-Demand	Anodyne	CCR5	48	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3cccc(F)c3)C1)C2	ZINC000819248214	FG	On-Demand	Anodyne	ADAM10	24	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3cccc(F)c3)C1)C2	ZINC000819248215	FG	On-Demand	Anodyne	CCR5	48	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3cccc(F)c3)C1)C2	ZINC000819248215	FG	On-Demand	Anodyne	ADAM10	24	43
O=[N+]([O-])c1ccc([C@@H](O)CNOC2CCCCC2)cc1	ZINC000819248220	CE	On-Demand	Bother	SLC27A4	46	40
O=[N+]([O-])c1ccc([C@H](O)CNOC2CCCCC2)cc1	ZINC000819248221	CE	On-Demand	Bother	SLC27A4	46	40
COC(=O)c1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819248226	DE	On-Demand	Anodyne	ADRB2	49	49
COC(=O)c1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819248226	DE	On-Demand	Anodyne	ADRB1	71	50
COC(=O)c1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819248226	DE	On-Demand	Anodyne	ADRB3	46	42
COC(=O)c1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819248226	DE	On-Demand	Anodyne	ABCB1	15	42
COC(=O)c1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819248227	DE	On-Demand	Anodyne	ADRB2	49	49
COC(=O)c1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819248227	DE	On-Demand	Anodyne	ADRB1	71	50
COC(=O)c1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819248227	DE	On-Demand	Anodyne	ADRB3	46	42
COC(=O)c1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819248227	DE	On-Demand	Anodyne	ABCB1	15	42
O[C@H](CNOC1CCCCC1)COc1cccc2[nH]ccc12	ZINC000819248248	DF	On-Demand	Anodyne	ADRB2	26	79
O[C@H](CNOC1CCCCC1)COc1cccc2[nH]ccc12	ZINC000819248248	DF	On-Demand	Anodyne	ADRB1	43	79
O[C@H](CNOC1CCCCC1)COc1cccc2[nH]ccc12	ZINC000819248248	DF	On-Demand	Anodyne	HTR1A	18	79
O[C@H](CNOC1CCCCC1)COc1cccc2[nH]ccc12	ZINC000819248248	DF	On-Demand	Anodyne	SLC6A4	20	47
O[C@@H](CNOC1CCCCC1)COc1cccc2[nH]ccc12	ZINC000819248249	DF	On-Demand	Anodyne	ADRB2	26	79
O[C@@H](CNOC1CCCCC1)COc1cccc2[nH]ccc12	ZINC000819248249	DF	On-Demand	Anodyne	ADRB1	43	79
O[C@@H](CNOC1CCCCC1)COc1cccc2[nH]ccc12	ZINC000819248249	DF	On-Demand	Anodyne	HTR1A	18	79
O[C@@H](CNOC1CCCCC1)COc1cccc2[nH]ccc12	ZINC000819248249	DF	On-Demand	Anodyne	SLC6A4	20	47
O[C@H](CNOC1CCCCC1)COc1cccc(Br)c1	ZINC000819248250	EG	On-Demand	Anodyne	ADRB2	31	43
O[C@H](CNOC1CCCCC1)COc1cccc(Br)c1	ZINC000819248250	EG	On-Demand	Anodyne	ADRB1	43	47
O[C@@H](CNOC1CCCCC1)COc1cccc(Br)c1	ZINC000819248251	EG	On-Demand	Anodyne	ADRB2	31	43
O[C@@H](CNOC1CCCCC1)COc1cccc(Br)c1	ZINC000819248251	EG	On-Demand	Anodyne	ADRB1	43	47
CC(=O)Nc1cccc(CC(=O)N2CCN(C[C@H](O)c3ccccc3)CC2)c1	ZINC000819248301	GE	On-Demand	Anodyne	HTR1D	23	41
CC(=O)Nc1cccc(CC(=O)N2CCN(C[C@H](O)c3ccccc3)CC2)c1	ZINC000819248301	GE	On-Demand	Anodyne	HTR1B	19	41
CC(=O)Nc1cccc(CC(=O)N2CCN(C[C@H](O)c3ccccc3)CC2)c1	ZINC000819248301	GE	On-Demand	Anodyne	OPRK1	24	47
CC(=O)Nc1cccc(CC(=O)N2CCN(C[C@H](O)c3ccccc3)CC2)c1	ZINC000819248301	GE	On-Demand	Anodyne	CCR3	18	43
CC(=O)Nc1cccc(CC(=O)N2CCN(C[C@@H](O)c3ccccc3)CC2)c1	ZINC000819248302	GE	On-Demand	Anodyne	HTR1D	23	41
CC(=O)Nc1cccc(CC(=O)N2CCN(C[C@@H](O)c3ccccc3)CC2)c1	ZINC000819248302	GE	On-Demand	Anodyne	HTR1B	19	41
CC(=O)Nc1cccc(CC(=O)N2CCN(C[C@@H](O)c3ccccc3)CC2)c1	ZINC000819248302	GE	On-Demand	Anodyne	OPRK1	24	47
CC(=O)Nc1cccc(CC(=O)N2CCN(C[C@@H](O)c3ccccc3)CC2)c1	ZINC000819248302	GE	On-Demand	Anodyne	CCR3	18	43
Cn1c(S)nnc1[C@H]1CCCN(C(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819248307	GD	On-Demand	Anodyne	KCNJ1	46	38
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819248308	GD	On-Demand	Anodyne	KCNJ1	46	38
O=C(Cc1nsc2ccccc12)N1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819248322	GF	On-Demand	Anodyne	DRD2	21	42
O=C(Cc1nsc2ccccc12)N1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819248323	GF	On-Demand	Anodyne	DRD2	21	42
CN1CCC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819248380	ED	On-Demand	Mild	PAPA1_CARPA	37	46
CN1CCC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819248382	ED	On-Demand	Mild	PAPA1_CARPA	37	46
O[C@H](CNOCCC(F)(F)F)COc1ccccc1C(F)(F)F	ZINC000819248401	EF	On-Demand	Anodyne	ADRB1	40	33
O[C@@H](CNOCCC(F)(F)F)COc1ccccc1C(F)(F)F	ZINC000819248402	EF	On-Demand	Anodyne	ADRB1	40	33
O[C@H](CNOC1CCCCC1)COc1ccc(F)cc1	ZINC000819248408	CE	On-Demand	Anodyne	ADRB2	41	45
O[C@H](CNOC1CCCCC1)COc1ccc(F)cc1	ZINC000819248408	CE	On-Demand	Anodyne	ADRB1	55	51
O[C@H](CNOC1CCCCC1)COc1ccc(F)cc1	ZINC000819248408	CE	On-Demand	Anodyne	ADRB3	31	40
O[C@@H](CNOC1CCCCC1)COc1ccc(F)cc1	ZINC000819248409	CE	On-Demand	Anodyne	ADRB2	41	45
O[C@@H](CNOC1CCCCC1)COc1ccc(F)cc1	ZINC000819248409	CE	On-Demand	Anodyne	ADRB1	55	51
O[C@@H](CNOC1CCCCC1)COc1ccc(F)cc1	ZINC000819248409	CE	On-Demand	Anodyne	ADRB3	31	40
CC(=O)Nc1ccc(OC[C@H](O)CNOCCC(F)(F)F)cc1	ZINC000819248410	ED	On-Demand	Anodyne	ADRB2	42	59
CC(=O)Nc1ccc(OC[C@H](O)CNOCCC(F)(F)F)cc1	ZINC000819248410	ED	On-Demand	Anodyne	ADRB1	74	59
CC(=O)Nc1ccc(OC[C@H](O)CNOCCC(F)(F)F)cc1	ZINC000819248410	ED	On-Demand	Anodyne	ADRB3	46	51
CC(=O)Nc1ccc(OC[C@@H](O)CNOCCC(F)(F)F)cc1	ZINC000819248411	ED	On-Demand	Anodyne	ADRB2	42	59
CC(=O)Nc1ccc(OC[C@@H](O)CNOCCC(F)(F)F)cc1	ZINC000819248411	ED	On-Demand	Anodyne	ADRB1	74	59
CC(=O)Nc1ccc(OC[C@@H](O)CNOCCC(F)(F)F)cc1	ZINC000819248411	ED	On-Demand	Anodyne	ADRB3	46	51
O[C@@H](CNOC1CCCCC1)COCc1ccccc1	ZINC000819248434	CE	On-Demand	Anodyne	ADRB2	16	49
O[C@@H](CNOC1CCCCC1)COCc1ccccc1	ZINC000819248434	CE	On-Demand	Anodyne	ADRB1	29	41
O[C@@H](CNOC1CCCCC1)COCc1ccccc1	ZINC000819248434	CE	On-Demand	Anodyne	CTSS	23	41
O[C@H](CNOC1CCCCC1)COCc1ccccc1	ZINC000819248436	CE	On-Demand	Anodyne	ADRB2	16	49
O[C@H](CNOC1CCCCC1)COCc1ccccc1	ZINC000819248436	CE	On-Demand	Anodyne	ADRB1	29	41
O[C@H](CNOC1CCCCC1)COCc1ccccc1	ZINC000819248436	CE	On-Demand	Anodyne	CTSS	23	41
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc(C)cs1	ZINC000819248444	GH	On-Demand	Mild	PAPA1_CARPA	39	44
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc(C)cs1	ZINC000819248448	GH	On-Demand	Mild	PAPA1_CARPA	39	44
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc(C)cs1	ZINC000819248451	GH	On-Demand	Mild	PAPA1_CARPA	39	44
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc(C)cs1	ZINC000819248452	GH	On-Demand	Mild	PAPA1_CARPA	39	44
O=C(CCNOCCC(F)(F)F)Nc1cccnc1	ZINC000819248460	CD	On-Demand	Anodyne	NAMPT	23	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC1(N2CCCC2)CCOCC1	ZINC000819248495	FD	On-Demand	Anodyne	HCN1	42	36
O[C@H](CNOCCC(F)(F)F)c1cccnc1	ZINC000819248509	CD	On-Demand	Anodyne	ADRB2	19	43
O[C@H](CNOCCC(F)(F)F)c1cccnc1	ZINC000819248509	CD	On-Demand	Anodyne	ADRB1	21	44
O[C@H](CNOCCC(F)(F)F)c1cccnc1	ZINC000819248509	CD	On-Demand	Anodyne	ADRB3	81	44
O[C@@H](CNOCCC(F)(F)F)c1cccnc1	ZINC000819248510	CD	On-Demand	Anodyne	ADRB2	19	43
O[C@@H](CNOCCC(F)(F)F)c1cccnc1	ZINC000819248510	CD	On-Demand	Anodyne	ADRB1	21	44
O[C@@H](CNOCCC(F)(F)F)c1cccnc1	ZINC000819248510	CD	On-Demand	Anodyne	ADRB3	81	44
COCCc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819248520	DE	On-Demand	Anodyne	ADRB2	50	63
COCCc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819248520	DE	On-Demand	Anodyne	ADRB1	79	65
COCCc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819248520	DE	On-Demand	Anodyne	ADRB3	52	44
COCCc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819248521	DE	On-Demand	Anodyne	ADRB2	50	63
COCCc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819248521	DE	On-Demand	Anodyne	ADRB1	79	65
COCCc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819248521	DE	On-Demand	Anodyne	ADRB3	52	44
O=C(CCNOCCC(F)(F)F)Nc1cccc(Br)c1	ZINC000819248528	FG	On-Demand	Anodyne	HDAC6	18	42
O[C@H](CNOC1CCCCC1)COc1ccc2c(c1)OCO2	ZINC000819248549	DE	On-Demand	Anodyne	ADRB1	32	43
O[C@@H](CNOC1CCCCC1)COc1ccc2c(c1)OCO2	ZINC000819248550	DE	On-Demand	Anodyne	ADRB1	32	43
O[C@@H](CNOC1CCCCC1)c1ccc(OC(F)(F)F)cc1	ZINC000819248579	DG	On-Demand	Anodyne	EPHX2	17	42
O[C@H](CNOC1CCCCC1)c1ccc(OC(F)(F)F)cc1	ZINC000819248580	DG	On-Demand	Anodyne	EPHX2	17	42
CC(=O)CCc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819248583	EF	On-Demand	Anodyne	ADRB2	49	48
CC(=O)CCc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819248583	EF	On-Demand	Anodyne	ADRB1	83	57
CC(=O)CCc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819248583	EF	On-Demand	Anodyne	ADRB3	59	46
CC(=O)CCc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819248583	EF	On-Demand	Anodyne	ABCB1	35	45
CC(=O)CCc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819248584	EF	On-Demand	Anodyne	ADRB2	49	48
CC(=O)CCc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819248584	EF	On-Demand	Anodyne	ADRB1	83	57
CC(=O)CCc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819248584	EF	On-Demand	Anodyne	ADRB3	59	46
CC(=O)CCc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819248584	EF	On-Demand	Anodyne	ABCB1	35	45
Cc1ccc(OC[C@@H](O)CNOC2CCCCC2)c(C)c1	ZINC000819248587	CF	On-Demand	Anodyne	ADRB2	22	50
Cc1ccc(OC[C@@H](O)CNOC2CCCCC2)c(C)c1	ZINC000819248587	CF	On-Demand	Anodyne	ADRB1	32	42
Cc1ccc(OC[C@H](O)CNOC2CCCCC2)c(C)c1	ZINC000819248588	CF	On-Demand	Anodyne	ADRB2	22	50
Cc1ccc(OC[C@H](O)CNOC2CCCCC2)c(C)c1	ZINC000819248588	CF	On-Demand	Anodyne	ADRB1	32	42
O[C@@H](CNOCCC(F)(F)F)COc1ccc2ccccc2c1	ZINC000819248595	EG	On-Demand	Anodyne	ADRB2	29	56
O[C@@H](CNOCCC(F)(F)F)COc1ccc2ccccc2c1	ZINC000819248595	EG	On-Demand	Anodyne	CASR	40	36
O[C@H](CNOCCC(F)(F)F)COc1ccc2ccccc2c1	ZINC000819248596	EG	On-Demand	Anodyne	ADRB2	29	56
O[C@H](CNOCCC(F)(F)F)COc1ccc2ccccc2c1	ZINC000819248596	EG	On-Demand	Anodyne	CASR	40	36
O=[N+]([O-])c1cccc([C@@H](O)CNOC2CCCCC2)c1	ZINC000819248607	CE	On-Demand	Bother	CACNA1C	49	37
O=[N+]([O-])c1cccc([C@@H](O)CNOC2CCCCC2)c1	ZINC000819248607	CE	On-Demand	Bother	CACNA1D	74	35
O=[N+]([O-])c1cccc([C@H](O)CNOC2CCCCC2)c1	ZINC000819248608	CE	On-Demand	Bother	CACNA1C	49	37
O=[N+]([O-])c1cccc([C@H](O)CNOC2CCCCC2)c1	ZINC000819248608	CE	On-Demand	Bother	CACNA1D	74	35
O[C@@H](CNOC1CCCCC1)c1ccccc1	ZINC000819248620	BF	On-Demand	Anodyne	ADRB1	17	43
O[C@@H](CNOC1CCCCC1)c1ccccc1	ZINC000819248620	BF	On-Demand	Anodyne	SLC6A3	15	47
O[C@@H](CNOC1CCCCC1)c1ccccc1	ZINC000819248620	BF	On-Demand	Anodyne	ADRB3	35	43
O[C@@H](CNOC1CCCCC1)c1ccccc1	ZINC000819248620	BF	On-Demand	Anodyne	AOC3	15	46
O[C@@H](CNOC1CCCCC1)c1ccccc1	ZINC000819248620	BF	On-Demand	Anodyne	Q8WSF8_APLCA	25	42
O[C@H](CNOC1CCCCC1)c1ccccc1	ZINC000819248621	BF	On-Demand	Anodyne	ADRB1	17	43
O[C@H](CNOC1CCCCC1)c1ccccc1	ZINC000819248621	BF	On-Demand	Anodyne	SLC6A3	15	47
O[C@H](CNOC1CCCCC1)c1ccccc1	ZINC000819248621	BF	On-Demand	Anodyne	ADRB3	35	43
O[C@H](CNOC1CCCCC1)c1ccccc1	ZINC000819248621	BF	On-Demand	Anodyne	AOC3	15	46
O[C@H](CNOC1CCCCC1)c1ccccc1	ZINC000819248621	BF	On-Demand	Anodyne	Q8WSF8_APLCA	25	42
N#CCc1ccc(OC[C@H](O)CNOCCC(F)(F)F)cc1	ZINC000819248630	DD	On-Demand	Mild	ADRB1	36	40
N#CCc1ccc(OC[C@@H](O)CNOCCC(F)(F)F)cc1	ZINC000819248631	DD	On-Demand	Mild	ADRB1	36	40
CSc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819248639	DG	On-Demand	Anodyne	ADRB2	34	42
CSc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819248639	DG	On-Demand	Anodyne	ADRB1	45	51
CSc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819248640	DG	On-Demand	Anodyne	ADRB2	34	42
CSc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819248640	DG	On-Demand	Anodyne	ADRB1	45	51
O[C@H](CNOC1CCCCC1)Cc1cccc(Cl)c1	ZINC000819248644	CG	On-Demand	Anodyne	ADRB1	19	40
O[C@@H](CNOC1CCCCC1)Cc1cccc(Cl)c1	ZINC000819248645	CG	On-Demand	Anodyne	ADRB1	19	40
CC(=O)c1ccc(OC[C@H](O)CNOCCC(F)(F)F)cc1	ZINC000819248646	DE	On-Demand	Anodyne	ADRB2	29	44
CC(=O)c1ccc(OC[C@H](O)CNOCCC(F)(F)F)cc1	ZINC000819248646	DE	On-Demand	Anodyne	ADRB1	48	43
CC(=O)c1ccc(OC[C@@H](O)CNOCCC(F)(F)F)cc1	ZINC000819248647	DE	On-Demand	Anodyne	ADRB2	29	44
CC(=O)c1ccc(OC[C@@H](O)CNOCCC(F)(F)F)cc1	ZINC000819248647	DE	On-Demand	Anodyne	ADRB1	48	43
O[C@H](CNOC1CCCCC1)c1cccnc1	ZINC000819248648	BD	On-Demand	Anodyne	ADRB1	26	48
O[C@H](CNOC1CCCCC1)c1cccnc1	ZINC000819248648	BD	On-Demand	Anodyne	ADRB3	88	48
O[C@@H](CNOC1CCCCC1)c1cccnc1	ZINC000819248649	BD	On-Demand	Anodyne	ADRB1	26	48
O[C@@H](CNOC1CCCCC1)c1cccnc1	ZINC000819248649	BD	On-Demand	Anodyne	ADRB3	88	48
Cc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819248652	CF	On-Demand	Anodyne	ADRB2	46	58
Cc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819248652	CF	On-Demand	Anodyne	ADRB1	56	54
Cc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819248653	CF	On-Demand	Anodyne	ADRB2	46	58
Cc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819248653	CF	On-Demand	Anodyne	ADRB1	56	54
O[C@H](CNOC1CCCCC1)COc1ccc(Cl)cc1	ZINC000819248659	CF	On-Demand	Anodyne	ADRB2	35	43
O[C@H](CNOC1CCCCC1)COc1ccc(Cl)cc1	ZINC000819248659	CF	On-Demand	Anodyne	ADRB1	53	51
O[C@@H](CNOC1CCCCC1)COc1ccc(Cl)cc1	ZINC000819248660	CF	On-Demand	Anodyne	ADRB2	35	43
O[C@@H](CNOC1CCCCC1)COc1ccc(Cl)cc1	ZINC000819248660	CF	On-Demand	Anodyne	ADRB1	53	51
O=[N+]([O-])c1ccccc1OC[C@H](O)CNOC1CCCCC1	ZINC000819248672	DE	On-Demand	Bother	ADRB2	25	45
O=[N+]([O-])c1ccccc1OC[C@H](O)CNOC1CCCCC1	ZINC000819248672	DE	On-Demand	Bother	ADRB1	46	35
O=[N+]([O-])c1ccccc1OC[C@H](O)CNOC1CCCCC1	ZINC000819248672	DE	On-Demand	Bother	ABCB1	17	44
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNOC1CCCCC1	ZINC000819248673	DE	On-Demand	Bother	ADRB2	25	45
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNOC1CCCCC1	ZINC000819248673	DE	On-Demand	Bother	ADRB1	46	35
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNOC1CCCCC1	ZINC000819248673	DE	On-Demand	Bother	ABCB1	17	44
COc1ccccc1COC[C@@H](O)CNOC1CCCCC1	ZINC000819248678	DE	On-Demand	Anodyne	ADRB1	20	40
COc1ccccc1COC[C@H](O)CNOC1CCCCC1	ZINC000819248679	DE	On-Demand	Anodyne	ADRB1	20	40
O[C@H](CNOC1CCCCC1)COc1ccccc1Cl	ZINC000819248691	CF	On-Demand	Anodyne	ADRB2	33	49
O[C@H](CNOC1CCCCC1)COc1ccccc1Cl	ZINC000819248691	CF	On-Demand	Anodyne	ADRB1	50	49
O[C@H](CNOC1CCCCC1)COc1ccccc1Cl	ZINC000819248691	CF	On-Demand	Anodyne	ABCB1	24	45
O[C@@H](CNOC1CCCCC1)COc1ccccc1Cl	ZINC000819248692	CF	On-Demand	Anodyne	ADRB2	33	49
O[C@@H](CNOC1CCCCC1)COc1ccccc1Cl	ZINC000819248692	CF	On-Demand	Anodyne	ADRB1	50	49
O[C@@H](CNOC1CCCCC1)COc1ccccc1Cl	ZINC000819248692	CF	On-Demand	Anodyne	ABCB1	24	45
CC(=O)Nc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819248693	DE	On-Demand	Anodyne	ADRB2	54	63
CC(=O)Nc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819248693	DE	On-Demand	Anodyne	ADRB1	88	63
CC(=O)Nc1ccc(OC[C@@H](O)CNOC2CCCCC2)cc1	ZINC000819248693	DE	On-Demand	Anodyne	ADRB3	57	51
CC(=O)Nc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819248694	DE	On-Demand	Anodyne	ADRB2	54	63
CC(=O)Nc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819248694	DE	On-Demand	Anodyne	ADRB1	88	63
CC(=O)Nc1ccc(OC[C@H](O)CNOC2CCCCC2)cc1	ZINC000819248694	DE	On-Demand	Anodyne	ADRB3	57	51
O=C(O)[C@@H]1CCN(C(=O)CCCN2C(=O)c3ccccc3C2=O)C1	ZINC000819248697	EC	On-Demand	Anodyne	SLC6A1	159	42
O=C(O)[C@H]1CCN(C(=O)CCCN2C(=O)c3ccccc3C2=O)C1	ZINC000819248698	EC	On-Demand	Anodyne	SLC6A1	159	42
O=C(O)C1CCN(C(=O)CCCc2ccccc2Br)CC1	ZINC000819248701	FG	On-Demand	Anodyne	PREP	59	42
O=C(O)C1CCN(C(=O)CN[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000819248702	EE	On-Demand	Anodyne	KCNQ2	41	36
O=C(O)C1CCN(C(=O)CN[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000819248702	EE	On-Demand	Anodyne	MTTP	38	42
O=C(O)C1CCN(C(=O)CN[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000819248702	EE	On-Demand	Anodyne	RBP4	41	35
O=C(O)C1CCN(C(=O)CN[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000819248702	EE	On-Demand	Anodyne	SFRP1	96	40
O=C(O)C1CCN(C(=O)CN[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000819248702	EE	On-Demand	Anodyne	WNT3	62	40
O=C(O)C1CCN(C(=O)CN[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000819248703	EE	On-Demand	Anodyne	KCNQ2	41	36
O=C(O)C1CCN(C(=O)CN[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000819248703	EE	On-Demand	Anodyne	MTTP	38	42
O=C(O)C1CCN(C(=O)CN[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000819248703	EE	On-Demand	Anodyne	RBP4	41	35
O=C(O)C1CCN(C(=O)CN[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000819248703	EE	On-Demand	Anodyne	SFRP1	96	40
O=C(O)C1CCN(C(=O)CN[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000819248703	EE	On-Demand	Anodyne	WNT3	62	40
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248704	FD	On-Demand	Anodyne	SLC6A1	94	40
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248704	FD	On-Demand	Anodyne	CELA1	19	45
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248704	FD	On-Demand	Anodyne	GRIN2B	48	53
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248704	FD	On-Demand	Anodyne	SIGMAR1	15	42
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248704	FD	On-Demand	Anodyne	CTSK	15	41
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248704	FD	On-Demand	Anodyne	CTSL	15	41
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248704	FD	On-Demand	Anodyne	CCR5	26	47
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248704	FD	On-Demand	Anodyne	PREP	60	53
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248704	FD	On-Demand	Anodyne	TGM2	49	47
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248704	FD	On-Demand	Anodyne	F13A1	51	47
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248704	FD	On-Demand	Anodyne	SLC12A5	70	44
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248705	FD	On-Demand	Anodyne	SLC6A1	94	40
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248705	FD	On-Demand	Anodyne	CELA1	19	45
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248705	FD	On-Demand	Anodyne	GRIN2B	48	53
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248705	FD	On-Demand	Anodyne	SIGMAR1	15	42
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248705	FD	On-Demand	Anodyne	CTSK	15	41
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248705	FD	On-Demand	Anodyne	CTSL	15	41
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248705	FD	On-Demand	Anodyne	CCR5	26	47
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248705	FD	On-Demand	Anodyne	PREP	60	53
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248705	FD	On-Demand	Anodyne	TGM2	49	47
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248705	FD	On-Demand	Anodyne	F13A1	51	47
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248705	FD	On-Demand	Anodyne	SLC12A5	70	44
O=C(O)C1CCN(C(=O)CCc2nnc(C3CCCC3)o2)CC1	ZINC000819248706	DD	On-Demand	Anodyne	ETHR	49	40
O=C(O)[C@H]1CCN(C(=O)[C@@H]2Nc3ccccc3S(=O)(=O)N2)C1	ZINC000819248707	EB	On-Demand	Anodyne	SLC6A1	75	34
O=C(O)[C@@H]1CCN(C(=O)[C@H]2Nc3ccccc3S(=O)(=O)N2)C1	ZINC000819248708	EB	On-Demand	Anodyne	SLC6A1	75	34
O=C(O)[C@H]1CCN(C(=O)[C@H]2Nc3ccccc3S(=O)(=O)N2)C1	ZINC000819248709	EB	On-Demand	Anodyne	SLC6A1	75	34
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2Nc3ccccc3S(=O)(=O)N2)C1	ZINC000819248710	EB	On-Demand	Anodyne	SLC6A1	75	34
O=C(O)[C@H]1CCN(C(=O)CCC(=O)N2CCC(c3ccccc3)=N2)C1	ZINC000819248711	ED	On-Demand	Anodyne	SLC6A1	58	34
O=C(O)[C@@H]1CCN(C(=O)CCC(=O)N2CCC(c3ccccc3)=N2)C1	ZINC000819248712	ED	On-Demand	Anodyne	SLC6A1	58	34
O=C(O)C1CCN(C(=O)CCSc2ccccn2)CC1	ZINC000819248715	CD	On-Demand	Anodyne	GRIN2B	15	46
O=C(O)C1CCN(C(=O)CCSc2ccccn2)CC1	ZINC000819248715	CD	On-Demand	Anodyne	C3AR1	37	41
O=C(O)C1CCN(C(=O)CCCOc2ccc3c(c2)CCC3)CC1	ZINC000819248716	EF	On-Demand	Anodyne	PPARG	35	41
O=C(O)C1CCN(C(=O)CCCOc2ccc3c(c2)CCC3)CC1	ZINC000819248716	EF	On-Demand	Anodyne	PPARA	28	40
O=C(O)C1CCN(C(=O)CCCOc2ccc3c(c2)CCC3)CC1	ZINC000819248716	EF	On-Demand	Anodyne	HRH3	36	44
O=C(O)C1CCN(C(=O)CCCOc2ccc3c(c2)CCC3)CC1	ZINC000819248716	EF	On-Demand	Anodyne	CPT1A	23	41
O=C(O)C1CCN(C(=O)CCCOc2ccc3c(c2)CCC3)CC1	ZINC000819248716	EF	On-Demand	Anodyne	CPT2	45	41
O=C(O)[C@H]1CCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819248719	EC	On-Demand	Anodyne	HTR1A	44	61
O=C(O)[C@H]1CCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819248719	EC	On-Demand	Anodyne	DRD2	30	54
O=C(O)[C@H]1CCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819248719	EC	On-Demand	Anodyne	DRD4	47	53
O=C(O)[C@H]1CCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819248719	EC	On-Demand	Anodyne	HTR2A	18	54
O=C(O)[C@H]1CCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819248719	EC	On-Demand	Anodyne	SLC6A1	102	37
O=C(O)[C@H]1CCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819248719	EC	On-Demand	Anodyne	DRD3	22	49
O=C(O)[C@H]1CCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819248719	EC	On-Demand	Anodyne	HTR7	28	50
O=C(O)[C@H]1CCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819248719	EC	On-Demand	Anodyne	EBP	26	40
O=C(O)[C@H]1CCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819248719	EC	On-Demand	Anodyne	SSTR1	21	42
O=C(O)[C@@H]1CCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819248720	EC	On-Demand	Anodyne	HTR1A	44	61
O=C(O)[C@@H]1CCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819248720	EC	On-Demand	Anodyne	DRD2	30	54
O=C(O)[C@@H]1CCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819248720	EC	On-Demand	Anodyne	DRD4	47	53
O=C(O)[C@@H]1CCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819248720	EC	On-Demand	Anodyne	HTR2A	18	54
O=C(O)[C@@H]1CCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819248720	EC	On-Demand	Anodyne	SLC6A1	102	37
O=C(O)[C@@H]1CCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819248720	EC	On-Demand	Anodyne	DRD3	22	49
O=C(O)[C@@H]1CCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819248720	EC	On-Demand	Anodyne	HTR7	28	50
O=C(O)[C@@H]1CCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819248720	EC	On-Demand	Anodyne	EBP	26	40
O=C(O)[C@@H]1CCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819248720	EC	On-Demand	Anodyne	SSTR1	21	42
O=C(O)C1CCN(C(=O)CCSc2ccnc3cc(Cl)ccc23)CC1	ZINC000819248721	GH	On-Demand	Anodyne	HRP1_PLAFA	106	40
O=C(O)C1CCN(C(=O)CCSc2ccnc3cc(Cl)ccc23)CC1	ZINC000819248721	GH	On-Demand	Anodyne	FDFT1	24	41
O=C(O)[C@H]1CCN(C(=O)C2CCN(CC(F)(F)F)CC2)C1	ZINC000819248722	DD	On-Demand	Anodyne	HPGDS	32	40
O=C(O)[C@@H]1CCN(C(=O)C2CCN(CC(F)(F)F)CC2)C1	ZINC000819248723	DD	On-Demand	Anodyne	HPGDS	32	40
O=C(O)[C@H]1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248726	GC	On-Demand	Anodyne	SLC6A1	87	39
O=C(O)[C@H]1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248726	GC	On-Demand	Anodyne	GRIN2B	43	48
O=C(O)[C@H]1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248726	GC	On-Demand	Anodyne	SIGMAR1	16	40
O=C(O)[C@H]1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248726	GC	On-Demand	Anodyne	PREP	38	46
O=C(O)[C@H]1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248726	GC	On-Demand	Anodyne	TGM2	41	41
O=C(O)[C@H]1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248726	GC	On-Demand	Anodyne	F13A1	40	41
O=C(O)[C@H]1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248726	GC	On-Demand	Anodyne	SLC12A5	59	37
O=C(O)[C@@H]1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248727	GC	On-Demand	Anodyne	SLC6A1	87	39
O=C(O)[C@@H]1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248727	GC	On-Demand	Anodyne	GRIN2B	43	48
O=C(O)[C@@H]1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248727	GC	On-Demand	Anodyne	SIGMAR1	16	40
O=C(O)[C@@H]1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248727	GC	On-Demand	Anodyne	PREP	38	46
O=C(O)[C@@H]1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248727	GC	On-Demand	Anodyne	TGM2	41	41
O=C(O)[C@@H]1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248727	GC	On-Demand	Anodyne	F13A1	40	41
O=C(O)[C@@H]1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819248727	GC	On-Demand	Anodyne	SLC12A5	59	37
O=C(O)C1CCN(C(=O)CCCOc2ccc3c(c2)OCO3)CC1	ZINC000819248730	ED	On-Demand	Anodyne	EDNRB	80	44
O=C(O)C1CCN(C(=O)CCCOc2ccc3c(c2)OCO3)CC1	ZINC000819248730	ED	On-Demand	Anodyne	EDNRA	78	46
O=C(O)[C@@H]1CCN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819248731	FC	On-Demand	Anodyne	SFRP1	86	40
O=C(O)[C@@H]1CCN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819248731	FC	On-Demand	Anodyne	WNT3	52	35
O=C(O)[C@H]1CCN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819248732	FC	On-Demand	Anodyne	SFRP1	86	40
O=C(O)[C@H]1CCN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819248732	FC	On-Demand	Anodyne	WNT3	52	35
O=C(O)[C@@H]1CCN(C(=O)CCSc2ccnc3cc(Cl)ccc23)C1	ZINC000819248733	FG	On-Demand	Anodyne	HRP1_PLAFA	93	39
O=C(O)[C@H]1CCN(C(=O)CCSc2ccnc3cc(Cl)ccc23)C1	ZINC000819248734	FG	On-Demand	Anodyne	HRP1_PLAFA	93	39
O=C(O)C1CCN(C(=O)[C@H]2CCN(C3CCCCC3)C2)CC1	ZINC000819248735	DD	On-Demand	Anodyne	L3MBTL3	67	38
O=C(O)C1CCN(C(=O)[C@@H]2CCN(C3CCCCC3)C2)CC1	ZINC000819248736	DD	On-Demand	Anodyne	L3MBTL3	67	38
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)c3ccoc3)CC2)C1	ZINC000819248741	DD	On-Demand	Anodyne	L3MBTL3	83	41
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)c3ccoc3)CC2)C1	ZINC000819248742	DD	On-Demand	Anodyne	L3MBTL3	83	41
O=C(O)[C@@H]1CCN(C(=O)CCCOc2ccc3c(c2)OCO3)C1	ZINC000819248743	DD	On-Demand	Anodyne	EDNRB	77	43
O=C(O)[C@@H]1CCN(C(=O)CCCOc2ccc3c(c2)OCO3)C1	ZINC000819248743	DD	On-Demand	Anodyne	EDNRA	78	43
O=C(O)[C@@H]1CCN(C(=O)CCCOc2ccc3c(c2)OCO3)C1	ZINC000819248743	DD	On-Demand	Anodyne	NOS2	44	31
O=C(O)[C@H]1CCN(C(=O)CCCOc2ccc3c(c2)OCO3)C1	ZINC000819248744	DD	On-Demand	Anodyne	EDNRB	77	43
O=C(O)[C@H]1CCN(C(=O)CCCOc2ccc3c(c2)OCO3)C1	ZINC000819248744	DD	On-Demand	Anodyne	EDNRA	78	43
O=C(O)[C@H]1CCN(C(=O)CCCOc2ccc3c(c2)OCO3)C1	ZINC000819248744	DD	On-Demand	Anodyne	NOS2	44	31
O=C(O)[C@H]1CCN(C(=O)CCSc2ccccn2)C1	ZINC000819248745	CD	On-Demand	Anodyne	SLC6A1	49	35
O=C(O)[C@H]1CCN(C(=O)CCSc2ccccn2)C1	ZINC000819248745	CD	On-Demand	Anodyne	C3AR1	36	40
O=C(O)[C@@H]1CCN(C(=O)CCSc2ccccn2)C1	ZINC000819248746	CD	On-Demand	Anodyne	SLC6A1	49	35
O=C(O)[C@@H]1CCN(C(=O)CCSc2ccccn2)C1	ZINC000819248746	CD	On-Demand	Anodyne	C3AR1	36	40
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	CHRM2	23	44
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	CHRM1	15	41
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	DRD2	34	53
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	DRD4	72	53
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	ACHE	54	49
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	SLC6A1	141	39
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	HRH1	15	40
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	DRD3	23	53
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	SLC6A3	15	42
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	CHRM3	26	43
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	LTA4H	27	45
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	HRH3	35	64
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	SIGMAR1	92	63
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	CCR3	29	40
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	CCR5	56	45
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	S1PR4	21	44
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	SLC18A3	36	44
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	S1PR3	15	42
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	PREP	40	38
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	MLNR	44	37
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	FAAH	22	42
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	S1PR1	35	50
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	S1PR5	45	50
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	MCHR1	21	41
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	CACNA1G	34	45
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	SAP2	25	42
O=C(O)[C@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248752	DD	On-Demand	Anodyne	L3MBTL3	28	44
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	CHRM2	23	44
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	CHRM1	15	41
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	DRD2	34	53
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	DRD4	72	53
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	ACHE	54	49
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	SLC6A1	141	39
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	HRH1	15	40
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	DRD3	23	53
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	SLC6A3	15	42
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	CHRM3	26	43
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	LTA4H	27	45
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	HRH3	35	64
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	SIGMAR1	92	63
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	CCR3	29	40
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	CCR5	56	45
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	S1PR4	21	44
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	SLC18A3	36	44
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	S1PR3	15	42
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	PREP	40	38
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	MLNR	44	37
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	FAAH	22	42
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	S1PR1	35	50
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	S1PR5	45	50
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	MCHR1	21	41
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	CACNA1G	34	45
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	SAP2	25	42
O=C(O)[C@@H]1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819248753	DD	On-Demand	Anodyne	L3MBTL3	28	44
O=C(O)C1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)CC1	ZINC000819248756	GD	On-Demand	Anodyne	GRIN2B	51	50
O=C(O)C1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)CC1	ZINC000819248756	GD	On-Demand	Anodyne	LTA4H	17	42
O=C(O)C1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)CC1	ZINC000819248756	GD	On-Demand	Anodyne	SIGMAR1	21	41
O=C(O)C1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)CC1	ZINC000819248756	GD	On-Demand	Anodyne	PREP	44	47
O=C(O)C1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)CC1	ZINC000819248756	GD	On-Demand	Anodyne	TGM2	42	42
O=C(O)C1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)CC1	ZINC000819248756	GD	On-Demand	Anodyne	F13A1	46	42
O=C(O)C1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)CC1	ZINC000819248756	GD	On-Demand	Anodyne	CCR8	19	40
O=C(O)C1CCN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)CC1	ZINC000819248756	GD	On-Demand	Anodyne	SLC12A5	60	37
O=C(O)C1CCN(C(=O)CCCOc2ccc3c(c2)CCCC3)CC1	ZINC000819248765	EG	On-Demand	Anodyne	PPARG	37	43
O=C(O)C1CCN(C(=O)CCCOc2ccc3c(c2)CCCC3)CC1	ZINC000819248765	EG	On-Demand	Anodyne	PPARA	30	42
O=C(O)C1CCN(C(=O)CCCOc2ccc3c(c2)CCCC3)CC1	ZINC000819248765	EG	On-Demand	Anodyne	LTA4H	20	43
O=C(O)C1CCN(C(=O)CCCOc2ccc3c(c2)CCCC3)CC1	ZINC000819248765	EG	On-Demand	Anodyne	HRH3	38	44
O=C(O)C1CCN(C(=O)CCCOc2ccc3c(c2)CCCC3)CC1	ZINC000819248765	EG	On-Demand	Anodyne	CPT1A	24	41
O=C(O)C1CCN(C(=O)CCCOc2ccc3c(c2)CCCC3)CC1	ZINC000819248765	EG	On-Demand	Anodyne	CPT2	45	41
O=C(O)[C@@H]1CCN(C(=O)CCc2nc(-c3ccncc3)no2)C1	ZINC000819248766	DC	On-Demand	Anodyne	ETHR	62	42
O=C(O)[C@H]1CCN(C(=O)CCc2nc(-c3ccncc3)no2)C1	ZINC000819248767	DC	On-Demand	Anodyne	ETHR	62	42
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)C1	ZINC000819248768	GC	On-Demand	Anodyne	SLC6A1	56	32
O=C(O)[C@@H]1CCN(C(=O)[C@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)C1	ZINC000819248769	GC	On-Demand	Anodyne	SLC6A1	56	32
O=C(O)[C@H]1CCN(C(=O)[C@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)C1	ZINC000819248770	GC	On-Demand	Anodyne	SLC6A1	56	32
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CN(Cc3nc(O)c4ccccc4n3)CCO2)C1	ZINC000819248771	GC	On-Demand	Anodyne	SLC6A1	56	32
O=C(O)[C@@H]1CCN(C(=O)CCCc2ccccc2Br)C1	ZINC000819248772	EF	On-Demand	Anodyne	SLC6A1	68	38
O=C(O)[C@@H]1CCN(C(=O)CCCc2ccccc2Br)C1	ZINC000819248772	EF	On-Demand	Anodyne	PREP	46	40
O=C(O)[C@H]1CCN(C(=O)CCCc2ccccc2Br)C1	ZINC000819248773	EF	On-Demand	Anodyne	SLC6A1	68	38
O=C(O)[C@H]1CCN(C(=O)CCCc2ccccc2Br)C1	ZINC000819248773	EF	On-Demand	Anodyne	PREP	46	40
O=C(O)[C@@H]1CCN(C(=O)CCCN2C(=O)CNC2=O)C1	ZINC000819248774	CB	On-Demand	Anodyne	SLC6A1	42	33
O=C(O)[C@H]1CCN(C(=O)CCCN2C(=O)CNC2=O)C1	ZINC000819248775	CB	On-Demand	Anodyne	SLC6A1	42	33
O=C(O)[C@@H]1CCN(C(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)C1	ZINC000819248776	FC	On-Demand	Anodyne	EPHX2	26	45
O=C(O)[C@@H]1CCN(C(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)C1	ZINC000819248776	FC	On-Demand	Anodyne	TGM2	53	41
O=C(O)[C@@H]1CCN(C(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)C1	ZINC000819248776	FC	On-Demand	Anodyne	F13A1	58	40
O=C(O)[C@@H]1CCN(C(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)C1	ZINC000819248776	FC	On-Demand	Anodyne	NAMPT	74	45
O=C(O)[C@H]1CCN(C(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)C1	ZINC000819248777	FC	On-Demand	Anodyne	EPHX2	26	45
O=C(O)[C@H]1CCN(C(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)C1	ZINC000819248777	FC	On-Demand	Anodyne	TGM2	53	41
O=C(O)[C@H]1CCN(C(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)C1	ZINC000819248777	FC	On-Demand	Anodyne	F13A1	58	40
O=C(O)[C@H]1CCN(C(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)C1	ZINC000819248777	FC	On-Demand	Anodyne	NAMPT	74	45
O=C(O)[C@H]1CCN(C(=O)CCCOc2ccc3c(c2)CCC3)C1	ZINC000819248785	DE	On-Demand	Anodyne	SLC6A1	61	34
O=C(O)[C@H]1CCN(C(=O)CCCOc2ccc3c(c2)CCC3)C1	ZINC000819248785	DE	On-Demand	Anodyne	PPARG	30	40
O=C(O)[C@H]1CCN(C(=O)CCCOc2ccc3c(c2)CCC3)C1	ZINC000819248785	DE	On-Demand	Anodyne	HRH3	45	45
O=C(O)[C@H]1CCN(C(=O)CCCOc2ccc3c(c2)CCC3)C1	ZINC000819248785	DE	On-Demand	Anodyne	CPT2	43	39
O=C(O)[C@@H]1CCN(C(=O)CCCOc2ccc3c(c2)CCC3)C1	ZINC000819248786	DE	On-Demand	Anodyne	SLC6A1	61	34
O=C(O)[C@@H]1CCN(C(=O)CCCOc2ccc3c(c2)CCC3)C1	ZINC000819248786	DE	On-Demand	Anodyne	PPARG	30	40
O=C(O)[C@@H]1CCN(C(=O)CCCOc2ccc3c(c2)CCC3)C1	ZINC000819248786	DE	On-Demand	Anodyne	HRH3	45	45
O=C(O)[C@@H]1CCN(C(=O)CCCOc2ccc3c(c2)CCC3)C1	ZINC000819248786	DE	On-Demand	Anodyne	CPT2	43	39
O=C(O)[C@@H]1CCN(C(=O)CCn2c(S)nnc2-c2cccs2)C1	ZINC000819248787	FD	On-Demand	Anodyne	ETHR	57	44
O=C(O)[C@H]1CCN(C(=O)CCn2c(S)nnc2-c2cccs2)C1	ZINC000819248788	FD	On-Demand	Anodyne	ETHR	57	44
O=C(O)[C@@H]1CCN(C(=O)CCc2nc(-c3nc[nH]n3)no2)C1	ZINC000819248789	DB	On-Demand	Anodyne	ETHR	42	33
O=C(O)[C@H]1CCN(C(=O)CCc2nc(-c3nc[nH]n3)no2)C1	ZINC000819248790	DB	On-Demand	Anodyne	ETHR	42	33
O=C(O)[C@@H]1CCN(C(=O)/C=C\c2ccc(I)o2)C1	ZINC000819248795	FD	On-Demand	Anodyne	SLC6A1	40	32
O=C(O)[C@H]1CCN(C(=O)/C=C\c2ccc(I)o2)C1	ZINC000819248796	FD	On-Demand	Anodyne	SLC6A1	40	32
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)c3cccnc3)CC2)C1	ZINC000819248801	EC	On-Demand	Anodyne	SLC18A3	20	51
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)c3cccnc3)CC2)C1	ZINC000819248801	EC	On-Demand	Anodyne	MTOR	15	41
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)c3cccnc3)CC2)C1	ZINC000819248801	EC	On-Demand	Anodyne	SFRP1	17	45
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)c3cccnc3)CC2)C1	ZINC000819248801	EC	On-Demand	Anodyne	L3MBTL3	80	40
O=C(O)[C@H]1CCN(C(=O)C2CCN(C(=O)c3cccnc3)CC2)C1	ZINC000819248801	EC	On-Demand	Anodyne	NAMPT	17	42
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)c3cccnc3)CC2)C1	ZINC000819248802	EC	On-Demand	Anodyne	SLC18A3	20	51
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)c3cccnc3)CC2)C1	ZINC000819248802	EC	On-Demand	Anodyne	MTOR	15	41
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)c3cccnc3)CC2)C1	ZINC000819248802	EC	On-Demand	Anodyne	SFRP1	17	45
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)c3cccnc3)CC2)C1	ZINC000819248802	EC	On-Demand	Anodyne	L3MBTL3	80	40
O=C(O)[C@@H]1CCN(C(=O)C2CCN(C(=O)c3cccnc3)CC2)C1	ZINC000819248802	EC	On-Demand	Anodyne	NAMPT	17	42
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCN(C3CCCCC3)C2)C1	ZINC000819248803	CD	On-Demand	Anodyne	L3MBTL3	67	38
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCN(C3CCCCC3)C2)C1	ZINC000819248804	CD	On-Demand	Anodyne	L3MBTL3	67	38
O=C(O)[C@@H]1CCN(C(=O)[C@H]2CCN(C3CCCCC3)C2)C1	ZINC000819248805	CD	On-Demand	Anodyne	L3MBTL3	67	38
O=C(O)[C@H]1CCN(C(=O)[C@H]2CCN(C3CCCCC3)C2)C1	ZINC000819248806	CD	On-Demand	Anodyne	L3MBTL3	67	38
O=C(O)[C@@H]1CCN(C(=O)CCc2nc(-c3ncccn3)no2)C1	ZINC000819248809	DC	On-Demand	Anodyne	ETHR	57	37
O=C(O)[C@H]1CCN(C(=O)CCc2nc(-c3ncccn3)no2)C1	ZINC000819248810	DC	On-Demand	Anodyne	ETHR	57	37
O=C(O)[C@@H]1CCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819248811	DC	On-Demand	Anodyne	HTR1A	20	51
O=C(O)[C@@H]1CCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819248811	DC	On-Demand	Anodyne	DRD2	17	50
O=C(O)[C@@H]1CCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819248811	DC	On-Demand	Anodyne	DRD4	41	48
O=C(O)[C@@H]1CCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819248811	DC	On-Demand	Anodyne	SLC6A1	74	36
O=C(O)[C@@H]1CCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819248811	DC	On-Demand	Anodyne	EBP	26	42
O=C(O)[C@@H]1CCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819248811	DC	On-Demand	Anodyne	SSTR1	15	42
O=C(O)[C@@H]1CCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819248811	DC	On-Demand	Anodyne	MRGPRX1	20	42
O=C(O)[C@@H]1CCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819248811	DC	On-Demand	Anodyne	SLC27A1	39	44
O=C(O)[C@H]1CCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819248812	DC	On-Demand	Anodyne	HTR1A	20	51
O=C(O)[C@H]1CCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819248812	DC	On-Demand	Anodyne	DRD2	17	50
O=C(O)[C@H]1CCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819248812	DC	On-Demand	Anodyne	DRD4	41	48
O=C(O)[C@H]1CCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819248812	DC	On-Demand	Anodyne	SLC6A1	74	36
O=C(O)[C@H]1CCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819248812	DC	On-Demand	Anodyne	EBP	26	42
O=C(O)[C@H]1CCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819248812	DC	On-Demand	Anodyne	SSTR1	15	42
O=C(O)[C@H]1CCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819248812	DC	On-Demand	Anodyne	MRGPRX1	20	42
O=C(O)[C@H]1CCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819248812	DC	On-Demand	Anodyne	SLC27A1	39	44
O=C(O)C1CCN(C(=O)CCC(=O)N2CCN(c3ncccn3)CC2)CC1	ZINC000819248813	GC	On-Demand	Anodyne	ETHR	40	32
O=C(O)[C@H]1CCN(C(=O)CCSc2nc3ccccc3s2)C1	ZINC000819248814	EF	On-Demand	Anodyne	LTA4H	20	43
O=C(O)[C@H]1CCN(C(=O)CCSc2nc3ccccc3s2)C1	ZINC000819248814	EF	On-Demand	Anodyne	HMOX2	24	41
O=C(O)[C@@H]1CCN(C(=O)CCSc2nc3ccccc3s2)C1	ZINC000819248815	EF	On-Demand	Anodyne	LTA4H	20	43
O=C(O)[C@@H]1CCN(C(=O)CCSc2nc3ccccc3s2)C1	ZINC000819248815	EF	On-Demand	Anodyne	HMOX2	24	41
O=C(O)[C@H]1CCN(C(=O)CCOc2ccc3ccccc3c2)C1	ZINC000819248823	DF	On-Demand	Anodyne	SLC6A1	99	37
O=C(O)[C@H]1CCN(C(=O)CCOc2ccc3ccccc3c2)C1	ZINC000819248823	DF	On-Demand	Anodyne	PPARA	18	40
O=C(O)[C@H]1CCN(C(=O)CCOc2ccc3ccccc3c2)C1	ZINC000819248823	DF	On-Demand	Anodyne	P2RY12	24	49
O=C(O)[C@H]1CCN(C(=O)CCOc2ccc3ccccc3c2)C1	ZINC000819248823	DF	On-Demand	Anodyne	LTA4H	25	44
O=C(O)[C@H]1CCN(C(=O)CCOc2ccc3ccccc3c2)C1	ZINC000819248823	DF	On-Demand	Anodyne	CYSLTR2	47	33
O=C(O)[C@H]1CCN(C(=O)CCOc2ccc3ccccc3c2)C1	ZINC000819248823	DF	On-Demand	Anodyne	HRH3	22	44
O=C(O)[C@H]1CCN(C(=O)CCOc2ccc3ccccc3c2)C1	ZINC000819248823	DF	On-Demand	Anodyne	CPT1A	50	33
O=C(O)[C@@H]1CCN(C(=O)CCOc2ccc3ccccc3c2)C1	ZINC000819248824	DF	On-Demand	Anodyne	SLC6A1	99	37
O=C(O)[C@@H]1CCN(C(=O)CCOc2ccc3ccccc3c2)C1	ZINC000819248824	DF	On-Demand	Anodyne	PPARA	18	40
O=C(O)[C@@H]1CCN(C(=O)CCOc2ccc3ccccc3c2)C1	ZINC000819248824	DF	On-Demand	Anodyne	P2RY12	24	49
O=C(O)[C@@H]1CCN(C(=O)CCOc2ccc3ccccc3c2)C1	ZINC000819248824	DF	On-Demand	Anodyne	LTA4H	25	44
O=C(O)[C@@H]1CCN(C(=O)CCOc2ccc3ccccc3c2)C1	ZINC000819248824	DF	On-Demand	Anodyne	CYSLTR2	47	33
O=C(O)[C@@H]1CCN(C(=O)CCOc2ccc3ccccc3c2)C1	ZINC000819248824	DF	On-Demand	Anodyne	HRH3	22	44
O=C(O)[C@@H]1CCN(C(=O)CCOc2ccc3ccccc3c2)C1	ZINC000819248824	DF	On-Demand	Anodyne	CPT1A	50	33
O=C(/C=C\[C@@H]1CCCO1)NNC(=O)c1cccc(C(F)(F)F)c1	ZINC000819248898	EE	On-Demand	Reactive	CCR2	74	41
O=C(/C=C/[C@H]1CCCO1)NNC(=O)c1cccc(C(F)(F)F)c1	ZINC000819248899	EE	On-Demand	Reactive	CCR2	74	41
O=C(/C=C/[C@@H]1CCCO1)NNC(=O)c1cccc(C(F)(F)F)c1	ZINC000819248900	EE	On-Demand	Reactive	CCR2	74	41
O=C(/C=C\[C@H]1CCCO1)NNC(=O)c1cccc(C(F)(F)F)c1	ZINC000819248901	EE	On-Demand	Reactive	CCR2	74	41
CSc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)cc1	ZINC000819248933	CF	On-Demand	Anodyne	ADRB2	30	43
CSc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)cc1	ZINC000819248933	CF	On-Demand	Anodyne	ADRB1	38	48
CSc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)cc1	ZINC000819248933	CF	On-Demand	Anodyne	ADRB3	24	42
CSc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)cc1	ZINC000819248934	CF	On-Demand	Anodyne	ADRB2	30	43
CSc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)cc1	ZINC000819248934	CF	On-Demand	Anodyne	ADRB1	38	48
CSc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)cc1	ZINC000819248934	CF	On-Demand	Anodyne	ADRB3	24	42
CSc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)cc1	ZINC000819248935	CF	On-Demand	Anodyne	ADRB2	30	43
CSc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)cc1	ZINC000819248935	CF	On-Demand	Anodyne	ADRB1	38	48
CSc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)cc1	ZINC000819248935	CF	On-Demand	Anodyne	ADRB3	24	42
CSc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)cc1	ZINC000819248936	CF	On-Demand	Anodyne	ADRB2	30	43
CSc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)cc1	ZINC000819248936	CF	On-Demand	Anodyne	ADRB1	38	48
CSc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)cc1	ZINC000819248936	CF	On-Demand	Anodyne	ADRB3	24	42
CCOc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)cc1	ZINC000819248947	CF	On-Demand	Anodyne	ADRB2	39	45
CCOc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)cc1	ZINC000819248947	CF	On-Demand	Anodyne	ADRB1	45	51
CCOc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)cc1	ZINC000819248947	CF	On-Demand	Anodyne	ADRB3	29	44
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)cc1	ZINC000819248948	CF	On-Demand	Anodyne	ADRB2	39	45
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)cc1	ZINC000819248948	CF	On-Demand	Anodyne	ADRB1	45	51
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)cc1	ZINC000819248948	CF	On-Demand	Anodyne	ADRB3	29	44
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)cc1	ZINC000819248949	CF	On-Demand	Anodyne	ADRB2	39	45
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)cc1	ZINC000819248949	CF	On-Demand	Anodyne	ADRB1	45	51
CCOc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)cc1	ZINC000819248949	CF	On-Demand	Anodyne	ADRB3	29	44
CCOc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)cc1	ZINC000819248950	CF	On-Demand	Anodyne	ADRB2	39	45
CCOc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)cc1	ZINC000819248950	CF	On-Demand	Anodyne	ADRB1	45	51
CCOc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)cc1	ZINC000819248950	CF	On-Demand	Anodyne	ADRB3	29	44
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@H](O)c3ccccc3)cc2C1	ZINC000819248961	FH	On-Demand	Anodyne	ADRB3	46	42
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@@H](O)c3ccccc3)cc2C1	ZINC000819248962	FH	On-Demand	Anodyne	ADRB3	46	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC[C@@H]1c1ccccc1OC)C2	ZINC000819248973	GH	On-Demand	Anodyne	SSTR1	40	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCC[C@@H]1c1ccccc1OC)C2	ZINC000819248974	GH	On-Demand	Anodyne	SSTR1	40	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC[C@H]1c1ccccc1OC)C2	ZINC000819248975	GH	On-Demand	Anodyne	SSTR1	40	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCC[C@H]1c1ccccc1OC)C2	ZINC000819248976	GH	On-Demand	Anodyne	SSTR1	40	32
COc1ccccc1[C@@H]1CCCCN1C(=O)C(F)=C1CCC1	ZINC000819248982	DI	On-Demand	Anodyne	HTR1A	18	41
COc1ccccc1[C@@H]1CCCCN1C(=O)C(F)=C1CCC1	ZINC000819248982	DI	On-Demand	Anodyne	FKBP1A	41	36
COc1ccccc1[C@H]1CCCCN1C(=O)C(F)=C1CCC1	ZINC000819248983	DI	On-Demand	Anodyne	HTR1A	18	41
COc1ccccc1[C@H]1CCCCN1C(=O)C(F)=C1CCC1	ZINC000819248983	DI	On-Demand	Anodyne	FKBP1A	41	36
C[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819248993	CF	On-Demand	Anodyne	ADRB2	27	76
C[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819248993	CF	On-Demand	Anodyne	ADRB1	33	76
C[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819248993	CF	On-Demand	Anodyne	HTR1A	18	76
C[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819248993	CF	On-Demand	Anodyne	SLC6A4	21	46
C[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819248993	CF	On-Demand	Anodyne	ADRB3	18	61
C[C@@H]1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819248996	CF	On-Demand	Anodyne	ADRB2	27	76
C[C@@H]1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819248996	CF	On-Demand	Anodyne	ADRB1	33	76
C[C@@H]1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819248996	CF	On-Demand	Anodyne	HTR1A	18	76
C[C@@H]1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819248996	CF	On-Demand	Anodyne	SLC6A4	21	46
C[C@@H]1CC[C@H](NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819248996	CF	On-Demand	Anodyne	ADRB3	18	61
O[C@@H](CNCC1(c2ccc(C(F)(F)F)cc2)CC1)c1ccccc1	ZINC000819248997	EI	On-Demand	Anodyne	TACR1	15	44
O[C@H](CNCC1(c2ccc(C(F)(F)F)cc2)CC1)c1ccccc1	ZINC000819248998	EI	On-Demand	Anodyne	TACR1	15	44
C[C@@H]1CC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819249024	CE	On-Demand	Mild	ADRB2	38	44
C[C@@H]1CC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819249024	CE	On-Demand	Mild	ADRB1	53	52
C[C@@H]1CC[C@H](NC[C@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819249024	CE	On-Demand	Mild	ADRB3	36	40
CC#CCN(C)C(=O)c1cc(-c2ccc(OC)c(OC)c2)nc2ccccc12	ZINC000819249035	FI	On-Demand	Mild	PRS	25	41
CC#CCN(C)C(=O)c1cc(-c2ccc(OC)c(OC)c2)nc2ccccc12	ZINC000819249035	FI	On-Demand	Mild	TACR3	23	43
CC#CCN(C)C(=O)c1cc(-c2ccc(OC)c(OC)c2)nc2ccccc12	ZINC000819249035	FI	On-Demand	Mild	ABCG2	22	41
CC#CCN(C)C(=O)c1cc(-c2ccc(OC)c(OC)c2)nc2ccccc12	ZINC000819249035	FI	On-Demand	Mild	MT-CO2	47	40
CC#CCN(C)C(=O)C[C@@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000819249061	CE	On-Demand	Mild	ECE1	25	42
CC#CCN(C)C(=O)C[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000819249062	CE	On-Demand	Mild	ECE1	25	42
CC#CCN(C)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000819249065	GH	On-Demand	Mild	KCNMA1	30	42
CC#CCN(C)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000819249065	GH	On-Demand	Mild	WDR5	21	41
CC#CCN(C)C(=O)c1cc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2OC)ccc1F	ZINC000819249070	IF	On-Demand	Mild	KCNMA1	18	40
CC#CCN(C)C(=O)c1ccc(F)c(S(=O)(=O)Nc2ccc(OC)cc2)c1	ZINC000819249071	GF	On-Demand	Mild	SGK1	47	41
CC#CCN(C)C(=O)c1ccc(F)c(S(=O)(=O)Nc2ccc(OC)cc2)c1	ZINC000819249071	GF	On-Demand	Mild	LIMK2	30	42
CC#CCN(C)C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249072	GD	On-Demand	Mild	KLK3	94	40
CC#CCN(C)C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249072	GD	On-Demand	Mild	CTSB	76	52
CC#CCN(C)C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249072	GD	On-Demand	Mild	PAPA1_CARPA	68	52
CC#CCN(C)C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249072	GD	On-Demand	Mild	CYSP_TRYCR	55	39
CC#CCN(C)C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249072	GD	On-Demand	Mild	CTSK	49	52
CC#CCN(C)C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249072	GD	On-Demand	Mild	CTSL	53	52
CC#CCN(C)C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249072	GD	On-Demand	Mild	CAPNS1	69	40
CC#CCN(C)C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249072	GD	On-Demand	Mild	MMP11	41	31
CC#CCN(C)C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249072	GD	On-Demand	Mild	CTSS	24	52
CC#CCN(C)C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249072	GD	On-Demand	Mild	CAPN1	94	43
CC#CCN(C)C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249072	GD	On-Demand	Mild	CASP1	20	40
CC#CCN(C)C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249072	GD	On-Demand	Mild	CAPN2	137	43
CC#CCN(C)C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249072	GD	On-Demand	Mild	NPR	75	39
CC#CCN(C)C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249072	GD	On-Demand	Mild	PSMB5	33	43
CC#CCN(C)C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249073	GD	On-Demand	Mild	KLK3	94	40
CC#CCN(C)C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249073	GD	On-Demand	Mild	CTSB	76	52
CC#CCN(C)C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249073	GD	On-Demand	Mild	PAPA1_CARPA	68	52
CC#CCN(C)C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249073	GD	On-Demand	Mild	CYSP_TRYCR	55	39
CC#CCN(C)C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249073	GD	On-Demand	Mild	CTSK	49	52
CC#CCN(C)C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249073	GD	On-Demand	Mild	CTSL	53	52
CC#CCN(C)C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249073	GD	On-Demand	Mild	CAPNS1	69	40
CC#CCN(C)C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249073	GD	On-Demand	Mild	MMP11	41	31
CC#CCN(C)C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249073	GD	On-Demand	Mild	CTSS	24	52
CC#CCN(C)C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249073	GD	On-Demand	Mild	CAPN1	94	43
CC#CCN(C)C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249073	GD	On-Demand	Mild	CASP1	20	40
CC#CCN(C)C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249073	GD	On-Demand	Mild	CAPN2	137	43
CC#CCN(C)C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249073	GD	On-Demand	Mild	NPR	75	39
CC#CCN(C)C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1	ZINC000819249073	GD	On-Demand	Mild	PSMB5	33	43
CC#CCN(C)C(=O)c1cc2ccc(OCc3ccccc3)cc2[nH]1	ZINC000819249079	EH	On-Demand	Mild	MAOA	20	53
CC#CCN(C)C(=O)c1cc2ccc(OCc3ccccc3)cc2[nH]1	ZINC000819249079	EH	On-Demand	Mild	MAOB	25	53
CC#CCN(C)C(=O)C[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249102	EF	On-Demand	Mild	CTSD	18	41
CC#CCN(C)C(=O)C[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249102	EF	On-Demand	Mild	PGC	50	40
CC#CCN(C)C(=O)C[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249102	EF	On-Demand	Mild	CTSB	39	46
CC#CCN(C)C(=O)C[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249102	EF	On-Demand	Mild	PAPA1_CARPA	56	47
CC#CCN(C)C(=O)C[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249102	EF	On-Demand	Mild	CCKAR	44	35
CC#CCN(C)C(=O)C[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249102	EF	On-Demand	Mild	CTSK	16	49
CC#CCN(C)C(=O)C[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249102	EF	On-Demand	Mild	CTSL	20	47
CC#CCN(C)C(=O)C[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249102	EF	On-Demand	Mild	PGA	31	41
CC#CCN(C)C(=O)C[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249102	EF	On-Demand	Mild	TACR3	17	43
CC#CCN(C)C(=O)C[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249102	EF	On-Demand	Mild	REN	69	43
CC#CCN(C)C(=O)C[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249102	EF	On-Demand	Mild	REN1	20	41
CC#CCN(C)C(=O)C[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249102	EF	On-Demand	Mild	FPR1	52	42
CC#CCN(C)C(=O)C[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249102	EF	On-Demand	Mild	CTRB_BOVIN	29	41
CC#CCN(C)C(=O)C[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249103	EF	On-Demand	Mild	CTSD	18	41
CC#CCN(C)C(=O)C[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249103	EF	On-Demand	Mild	PGC	50	40
CC#CCN(C)C(=O)C[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249103	EF	On-Demand	Mild	CTSB	39	46
CC#CCN(C)C(=O)C[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249103	EF	On-Demand	Mild	PAPA1_CARPA	56	47
CC#CCN(C)C(=O)C[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249103	EF	On-Demand	Mild	CCKAR	44	35
CC#CCN(C)C(=O)C[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249103	EF	On-Demand	Mild	CTSK	16	49
CC#CCN(C)C(=O)C[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249103	EF	On-Demand	Mild	CTSL	20	47
CC#CCN(C)C(=O)C[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249103	EF	On-Demand	Mild	PGA	31	41
CC#CCN(C)C(=O)C[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249103	EF	On-Demand	Mild	TACR3	17	43
CC#CCN(C)C(=O)C[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249103	EF	On-Demand	Mild	REN	69	43
CC#CCN(C)C(=O)C[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249103	EF	On-Demand	Mild	REN1	20	41
CC#CCN(C)C(=O)C[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249103	EF	On-Demand	Mild	FPR1	52	42
CC#CCN(C)C(=O)C[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819249103	EF	On-Demand	Mild	CTRB_BOVIN	29	41
CC#CCN(C)C(=O)COc1ccc2c(C)cc(=O)oc2c1	ZINC000819249108	CD	On-Demand	Mild	MAOA	78	58
CC#CCN(C)C(=O)COc1ccc2c(C)cc(=O)oc2c1	ZINC000819249108	CD	On-Demand	Mild	MAOB	55	58
CC#CCN(C)C(=O)[C@@H](CC)CCCCCC	ZINC000819249114	BG	On-Demand	Mild	CQSS	51	31
CC#CCN(C)C(=O)[C@H](CC)CCCCCC	ZINC000819249115	BG	On-Demand	Mild	CQSS	51	31
CC#CCN(C)C(=O)[C@H](C)CCCCCC	ZINC000819249119	BG	On-Demand	Mild	NOD1	62	35
CC#CCN(C)C(=O)[C@H](C)CCCCCC	ZINC000819249119	BG	On-Demand	Mild	CQSS	40	33
CC#CCN(C)C(=O)[C@@H](C)CCCCCC	ZINC000819249120	BG	On-Demand	Mild	NOD1	62	35
CC#CCN(C)C(=O)[C@@H](C)CCCCCC	ZINC000819249120	BG	On-Demand	Mild	CQSS	40	33
C[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819249129	CE	On-Demand	Mild	ADRB2	38	44
C[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819249129	CE	On-Demand	Mild	ADRB1	53	52
C[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc(CC#N)cc2)C1	ZINC000819249129	CE	On-Demand	Mild	ADRB3	36	40
CC#CCN(C)C(=O)c1cc(-c2ccccn2)nc2ccccc12	ZINC000819249148	DG	On-Demand	Mild	METAP1	46	40
CC#CCN(C)C(=O)c1cc(-c2ccccn2)nc2ccccc12	ZINC000819249148	DG	On-Demand	Mild	TACR3	15	41
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	ACE	19	45
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	SSTR2	64	44
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	GHRHR	25	40
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	MME	25	43
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	EDNRB	55	40
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	EDNRA	29	56
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	TACR1	38	62
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	PAPA1_CARPA	50	41
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	CCKAR	150	56
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	CTSL	27	51
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	BRS3	26	40
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	NMBR	52	47
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	MC3R	61	38
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	MC5R	59	36
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	MMP2	28	46
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	MMP8	35	46
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	GRPR	67	33
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	ECE1	64	46
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	REN	35	51
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	REN1	24	51
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	SSTR3	17	54
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	MMP11	98	39
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	CCKBR	121	56
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	GHSR	61	49
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	MMP9	26	46
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	MC1R	86	39
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	MMP1	22	41
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	FPR1	51	57
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	NPR	28	43
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	KISS1R	67	34
CC#CCN(C)C(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C	ZINC000819249163	FG	On-Demand	Mild	ERAP2	40	38
CC#CCN(C)C(=O)c1ccsc1NC(=O)c1ccccc1Cl	ZINC000819249174	EH	On-Demand	Mild	ECR	42	36
CC#CCN(C)C(=O)c1cc(S(=O)(=O)NCCOc2ccccc2)ccc1Cl	ZINC000819249192	HF	On-Demand	Mild	MMP13	21	41
CC#CCN(C)C(=O)c1cc(S(=O)(=O)NCCOc2ccccc2)ccc1Cl	ZINC000819249192	HF	On-Demand	Mild	ADAM17	30	41
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	ELANE	21	45
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	ANPEP	43	39
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	TACR1	18	51
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	CTSD	24	42
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	FCER2	59	35
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	CASP3	20	53
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	BMP1	19	45
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	KLK3	117	54
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	CTSB	94	68
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	PAPA1_CARPA	100	68
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	CYSP_TRYCR	65	51
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	CTSK	68	68
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	CTSL	67	68
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	PGA	36	47
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	CAPNS1	97	54
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	MMP2	15	41
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	MMP3	27	43
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	HLA-DRB1	96	41
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	REN	36	46
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	REN1	27	41
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	MMP11	62	38
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	CTSS	35	68
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	CAPN1	128	61
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	CASP1	25	44
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	CAPN2	192	55
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	CASP9	30	41
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	MMP1	18	41
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	FPR1	77	39
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	NPR	106	48
CC#CCN(C)C(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249199	EF	On-Demand	Mild	PSMB5	56	56
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	ELANE	21	45
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	ANPEP	43	39
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	TACR1	18	51
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	CTSD	24	42
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	FCER2	59	35
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	CASP3	20	53
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	BMP1	19	45
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	KLK3	117	54
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	CTSB	94	68
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	PAPA1_CARPA	100	68
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	CYSP_TRYCR	65	51
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	CTSK	68	68
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	CTSL	67	68
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	PGA	36	47
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	CAPNS1	97	54
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	MMP2	15	41
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	MMP3	27	43
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	HLA-DRB1	96	41
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	REN	36	46
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	REN1	27	41
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	MMP11	62	38
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	CTSS	35	68
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	CAPN1	128	61
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	CASP1	25	44
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	CAPN2	192	55
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	CASP9	30	41
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	MMP1	18	41
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	FPR1	77	39
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	NPR	106	48
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OCc1ccccc1	ZINC000819249201	EF	On-Demand	Mild	PSMB5	56	56
CC#CCN(C)C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819249213	DE	On-Demand	Mild	ACE	41	43
CC#CCN(C)C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819249213	DE	On-Demand	Mild	FKBP1A	62	43
CC#CCN(C)C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819249213	DE	On-Demand	Mild	OPRM1	21	41
CC#CCN(C)C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819249213	DE	On-Demand	Mild	CELA1	27	55
CC#CCN(C)C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819249213	DE	On-Demand	Mild	ELANE	26	41
CC#CCN(C)C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819249213	DE	On-Demand	Mild	CTRA_BOVIN	53	32
CC#CCN(C)C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819249213	DE	On-Demand	Mild	TRY1_BOVIN	57	33
CC#CCN(C)C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819249213	DE	On-Demand	Mild	PREP	108	55
CC#CCN(C)C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819249213	DE	On-Demand	Mild	CELA2A	48	32
CC#CCN(C)C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819249213	DE	On-Demand	Mild	LGMN	89	51
CC#CCN(C)C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819249213	DE	On-Demand	Mild	KLK5	27	49
CC#CCN(C)C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819249213	DE	On-Demand	Mild	SLC12A5	68	37
CC#CCN(C)C(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819249213	DE	On-Demand	Mild	TMPRSS11D	41	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H](Cc3ccccc3)C1)C2	ZINC000819249234	FG	On-Demand	Anodyne	CCR3	28	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H](Cc3ccccc3)C1)C2	ZINC000819249234	FG	On-Demand	Anodyne	PREP	57	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H](Cc3ccccc3)C1)C2	ZINC000819249236	FG	On-Demand	Anodyne	CCR3	28	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H](Cc3ccccc3)C1)C2	ZINC000819249236	FG	On-Demand	Anodyne	PREP	57	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H](Cc3ccccc3)C1)C2	ZINC000819249238	FG	On-Demand	Anodyne	CCR3	28	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H](Cc3ccccc3)C1)C2	ZINC000819249238	FG	On-Demand	Anodyne	PREP	57	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H](Cc3ccccc3)C1)C2	ZINC000819249241	FG	On-Demand	Anodyne	CCR3	28	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H](Cc3ccccc3)C1)C2	ZINC000819249241	FG	On-Demand	Anodyne	PREP	57	38
CC#CCN(C)C(=O)c1ccc(Br)c(S(=O)(=O)N(C)c2ccccc2)c1	ZINC000819249246	IG	On-Demand	Mild	LIMK2	15	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Oc1ccccc1OC(F)F)C2	ZINC000819249251	FG	On-Demand	Anodyne	SLC6A3	24	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Oc1ccccc1OC(F)F)C2	ZINC000819249252	FG	On-Demand	Anodyne	SLC6A3	24	41
C[C@@H]1CC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819249257	DG	On-Demand	Anodyne	ADRB2	32	48
C[C@@H]1CC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819249257	DG	On-Demand	Anodyne	ADRB3	17	40
C[C@@H]1CC[C@H](NC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819249257	DG	On-Demand	Anodyne	ABCB1	15	44
C[C@@H]1CC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819249258	DG	On-Demand	Anodyne	ADRB2	32	48
C[C@@H]1CC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819249258	DG	On-Demand	Anodyne	ADRB3	17	40
C[C@@H]1CC[C@H](NC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819249258	DG	On-Demand	Anodyne	ABCB1	15	44
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)cc1	ZINC000819249264	DF	On-Demand	Anodyne	ADRB2	48	45
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)cc1	ZINC000819249264	DF	On-Demand	Anodyne	ADRB1	77	54
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)cc1	ZINC000819249264	DF	On-Demand	Anodyne	ADRB3	57	43
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)cc1	ZINC000819249264	DF	On-Demand	Anodyne	ABCB1	23	45
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)cc1	ZINC000819249266	DF	On-Demand	Anodyne	ADRB2	48	45
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)cc1	ZINC000819249266	DF	On-Demand	Anodyne	ADRB1	77	54
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)cc1	ZINC000819249266	DF	On-Demand	Anodyne	ADRB3	57	43
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)cc1	ZINC000819249266	DF	On-Demand	Anodyne	ABCB1	23	45
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)cc1	ZINC000819249267	DF	On-Demand	Anodyne	ADRB2	48	45
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)cc1	ZINC000819249267	DF	On-Demand	Anodyne	ADRB1	77	54
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)cc1	ZINC000819249267	DF	On-Demand	Anodyne	ADRB3	57	43
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)cc1	ZINC000819249267	DF	On-Demand	Anodyne	ABCB1	23	45
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)cc1	ZINC000819249268	DF	On-Demand	Anodyne	ADRB2	48	45
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)cc1	ZINC000819249268	DF	On-Demand	Anodyne	ADRB1	77	54
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)cc1	ZINC000819249268	DF	On-Demand	Anodyne	ADRB3	57	43
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)cc1	ZINC000819249268	DF	On-Demand	Anodyne	ABCB1	23	45
CC#CCN(C)C(=O)c1cc2ccccc2c(Cl)n1	ZINC000819249271	CF	On-Demand	Mild	TSPO	16	47
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@@H](O)Cc3ccccc3)cc2C1	ZINC000819249275	GH	On-Demand	Anodyne	FPR1	42	34
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@H](O)Cc3ccccc3)cc2C1	ZINC000819249277	GH	On-Demand	Anodyne	FPR1	42	34
C=C(C)C(C)(C)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	ZINC000819249279	DG	On-Demand	Reactive	CCR2	72	39
C=C(C)C(C)(C)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	ZINC000819249279	DG	On-Demand	Reactive	IMDH_CRYPV	48	39
C=C(C)C(C)(C)C(=O)NNC(=O)c1cccc(C(F)(F)F)c1	ZINC000819249279	DG	On-Demand	Reactive	KCNK3	24	48
CC#CCN(C)C(=O)c1ccccc1NC(=O)OCc1ccccc1	ZINC000819249288	EH	On-Demand	Mild	KLK3	44	33
CC#CCN(C)C(=O)c1ccccc1NC(=O)OCc1ccccc1	ZINC000819249288	EH	On-Demand	Mild	CTSB	35	40
CC#CCN(C)C(=O)c1ccccc1NC(=O)OCc1ccccc1	ZINC000819249288	EH	On-Demand	Mild	CTSK	18	47
CC#CCN(C)C(=O)c1ccccc1NC(=O)OCc1ccccc1	ZINC000819249288	EH	On-Demand	Mild	CTSL	20	40
CC#CCN(C)C(=O)c1ccccc1NC(=O)OCc1ccccc1	ZINC000819249288	EH	On-Demand	Mild	CAPNS1	58	33
CC#CCN(C)C(=O)c1ccccc1NC(=O)OCc1ccccc1	ZINC000819249288	EH	On-Demand	Mild	CAPN1	46	36
CC#CCN(C)C(=O)c1ccccc1NC(=O)OCc1ccccc1	ZINC000819249288	EH	On-Demand	Mild	CAPN2	76	34
CC#CCN(C)C(=O)c1ccccc1NC(=O)OCc1ccccc1	ZINC000819249288	EH	On-Demand	Mild	CASP9	15	40
CC#CCN(C)C(=O)c1ccccc1NC(=O)OCc1ccccc1	ZINC000819249288	EH	On-Demand	Mild	NPR	64	38
CC#CCN(C)C(=O)c1cc(-c2cccs2)nc2ccccc12	ZINC000819249290	DI	On-Demand	Mild	TACR3	15	50
CC#CCN(C)C(=O)[C@@H]1CC(c2cccc(OC)c2)=NO1	ZINC000819249294	CD	On-Demand	Mild	LUCI_PHOPY	40	48
CC#CCN(C)C(=O)[C@H]1CC(c2cccc(OC)c2)=NO1	ZINC000819249295	CD	On-Demand	Mild	LUCI_PHOPY	40	48
CC#CCN(C)C(=O)[C@@H]1C[C@H]1C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819249300	EF	On-Demand	Mild	GPR119	25	41
CC#CCN(C)C(=O)c1cc(-c2ccccc2)nc2ccccc12	ZINC000819249315	DH	On-Demand	Mild	TSPO	39	45
CC#CCN(C)C(=O)c1cc(-c2ccccc2)nc2ccccc12	ZINC000819249315	DH	On-Demand	Mild	PRS	58	48
CC#CCN(C)C(=O)c1cc(-c2ccccc2)nc2ccccc12	ZINC000819249315	DH	On-Demand	Mild	TACR3	40	56
CC#CCN(C)C(=O)c1cc(-c2ccccc2)nc2ccccc12	ZINC000819249315	DH	On-Demand	Mild	MT-CO2	54	47
CC#CCN(C)C(=O)c1ccccc1NC(=O)c1ccc(OC)cc1	ZINC000819249318	EG	On-Demand	Mild	ECR	24	42
CC#CCN(C)C(=O)c1ccccc1NC(=O)c1ccc(OC)cc1	ZINC000819249318	EG	On-Demand	Mild	HDAC1	22	44
CC#CCN(C)C(=O)c1cc(OC)c(OC)cc1NC(=O)c1ccccc1	ZINC000819249332	FG	On-Demand	Mild	HDAC2	18	40
CC#CCN(C)C(=O)c1cc(OC)c(OC)cc1NC(=O)c1ccccc1	ZINC000819249332	FG	On-Demand	Mild	KCNK3	51	42
CC#CCN(C)C(=O)[C@H]1CCCCN1C(=O)OC(C)(C)C	ZINC000819249337	CE	On-Demand	Mild	PREP	15	51
CC#CCN(C)C(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819249350	DG	On-Demand	Mild	TSPO	27	40
CC#CCN(C)C(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819249350	DG	On-Demand	Mild	PRS	37	44
CC#CCN(C)C(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819249350	DG	On-Demand	Mild	TACR3	17	49
CC#CCN(C)C(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819249350	DG	On-Demand	Mild	MT-CO2	51	44
CC#CCN(C)C(=O)c1cc(=O)c2ccccc2o1	ZINC000819249370	CD	On-Demand	Mild	TNKS	28	41
CC#CCN(C)C(=O)CCCCCC	ZINC000819249373	AE	On-Demand	Mild	CQSS	59	36
CC#CCN(C)C(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819249377	EH	On-Demand	Mild	KLKB1	15	41
CC#CCN(C)C(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819249377	EH	On-Demand	Mild	F10	42	53
CC#CCN(C)C(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819249377	EH	On-Demand	Mild	ECR	51	42
CC#CCN(C)C(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819249377	EH	On-Demand	Mild	HDAC1	30	41
CC#CCN(C)C(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1	ZINC000819249377	EH	On-Demand	Mild	UTS2	45	35
CC#CCN(C)C(=O)c1cccc(OC)n1	ZINC000819249412	BD	On-Demand	Mild	ALS	65	31
CC#CCN(C)C(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819249419	CD	On-Demand	Mild	L3MBTL3	56	37
CC#CCN(C)C(=O)CCCNC(=O)OCc1ccccc1	ZINC000819249422	DE	On-Demand	Mild	KLK3	69	32
CC#CCN(C)C(=O)CCCNC(=O)OCc1ccccc1	ZINC000819249422	DE	On-Demand	Mild	CTSB	42	39
CC#CCN(C)C(=O)CCCNC(=O)OCc1ccccc1	ZINC000819249422	DE	On-Demand	Mild	CTSK	18	52
CC#CCN(C)C(=O)CCCNC(=O)OCc1ccccc1	ZINC000819249422	DE	On-Demand	Mild	CAPNS1	58	34
CC#CCN(C)C(=O)CCCNC(=O)OCc1ccccc1	ZINC000819249422	DE	On-Demand	Mild	CAPN1	54	43
CC#CCN(C)C(=O)CCCNC(=O)OCc1ccccc1	ZINC000819249422	DE	On-Demand	Mild	CAPN2	91	43
CC#CCN(C)C(=O)CCCNC(=O)OCc1ccccc1	ZINC000819249422	DE	On-Demand	Mild	NPR	68	41
CC#CCN(C)C(=O)c1cc(S(=O)(=O)NCc2cccnc2)c(Cl)cc1Cl	ZINC000819249424	IF	On-Demand	Mild	NAMPT	49	36
CC#CCN(C)C(=O)c1ccc(S(=O)(=O)N2CCCC2)o1	ZINC000819249448	DD	On-Demand	Mild	LPL	40	36
CC[C@H](O)CNCc1ccc2c(c1)CN(C(=O)OC(C)(C)C)C2	ZINC000819249451	DF	On-Demand	Anodyne	GPR119	22	41
CC[C@@H](O)CNCc1ccc2c(c1)CN(C(=O)OC(C)(C)C)C2	ZINC000819249453	DF	On-Demand	Anodyne	GPR119	22	41
CC#CCN(C)C(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1	ZINC000819249514	HD	On-Demand	Mild	BMP1	46	35
COc1cccc([S@@](=O)CC(=O)N2CCC[C@H]2c2c(C)nn(C)c2Cl)c1	ZINC000819249515	GF	On-Demand	Anodyne	DRD4	40	31
COc1cccc([S@@](=O)CC(=O)N2CCC[C@H]2c2c(C)nn(C)c2Cl)c1	ZINC000819249515	GF	On-Demand	Anodyne	CPT1A	69	42
CC#CCN(C)C(=O)C[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819249517	EG	On-Demand	Mild	CTSB	15	43
CC#CCN(C)C(=O)C[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819249517	EG	On-Demand	Mild	CTSK	17	48
CC#CCN(C)C(=O)C[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819249517	EG	On-Demand	Mild	FPR1	41	35
COc1cccc([S@](=O)CC(=O)N2CCC[C@@H]2c2c(C)nn(C)c2Cl)c1	ZINC000819249518	GF	On-Demand	Anodyne	DRD4	40	31
COc1cccc([S@](=O)CC(=O)N2CCC[C@@H]2c2c(C)nn(C)c2Cl)c1	ZINC000819249518	GF	On-Demand	Anodyne	CPT1A	69	42
CC#CCN(C)C(=O)C[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819249519	EG	On-Demand	Mild	CTSB	15	43
CC#CCN(C)C(=O)C[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819249519	EG	On-Demand	Mild	CTSK	17	48
CC#CCN(C)C(=O)C[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819249519	EG	On-Demand	Mild	FPR1	41	35
COc1cccc([S@](=O)CC(=O)N2CCC[C@H]2c2c(C)nn(C)c2Cl)c1	ZINC000819249520	GF	On-Demand	Anodyne	DRD4	40	31
COc1cccc([S@](=O)CC(=O)N2CCC[C@H]2c2c(C)nn(C)c2Cl)c1	ZINC000819249520	GF	On-Demand	Anodyne	CPT1A	69	42
COc1cccc([S@@](=O)CC(=O)N2CCC[C@@H]2c2c(C)nn(C)c2Cl)c1	ZINC000819249522	GF	On-Demand	Anodyne	DRD4	40	31
COc1cccc([S@@](=O)CC(=O)N2CCC[C@@H]2c2c(C)nn(C)c2Cl)c1	ZINC000819249522	GF	On-Demand	Anodyne	CPT1A	69	42
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2c2c(C)nn(C)c2Cl)c1	ZINC000819249538	FG	On-Demand	Anodyne	OPRK1	20	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2c2c(C)nn(C)c2Cl)c1	ZINC000819249538	FG	On-Demand	Anodyne	CPT1A	24	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2c2c(C)nn(C)c2Cl)c1	ZINC000819249540	FG	On-Demand	Anodyne	OPRK1	20	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2c2c(C)nn(C)c2Cl)c1	ZINC000819249540	FG	On-Demand	Anodyne	CPT1A	24	43
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)cc1	ZINC000819249541	DE	On-Demand	Anodyne	ADRB2	50	58
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)cc1	ZINC000819249541	DE	On-Demand	Anodyne	ADRB1	83	58
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)cc1	ZINC000819249541	DE	On-Demand	Anodyne	ADRB3	58	50
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)cc1	ZINC000819249542	DE	On-Demand	Anodyne	ADRB2	50	58
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)cc1	ZINC000819249542	DE	On-Demand	Anodyne	ADRB1	83	58
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)cc1	ZINC000819249542	DE	On-Demand	Anodyne	ADRB3	58	50
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)cc1	ZINC000819249543	DE	On-Demand	Anodyne	ADRB2	50	58
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)cc1	ZINC000819249543	DE	On-Demand	Anodyne	ADRB1	83	58
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)cc1	ZINC000819249543	DE	On-Demand	Anodyne	ADRB3	58	50
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)cc1	ZINC000819249544	DE	On-Demand	Anodyne	ADRB2	50	58
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)cc1	ZINC000819249544	DE	On-Demand	Anodyne	ADRB1	83	58
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)cc1	ZINC000819249544	DE	On-Demand	Anodyne	ADRB3	58	50
CC#CCN(C)C(=O)c1ccc(OCCCCCC)c(OC)c1	ZINC000819249599	DH	On-Demand	Mild	PLA2G4B	64	49
CC#CCN(C)C(=O)/C(=C\c1ccco1)NC(=O)c1ccccc1	ZINC000819249617	DF	On-Demand	Mild	ADAM12	34	41
CC#CCN(C)C(=O)/C(=C/c1ccco1)NC(=O)c1ccccc1	ZINC000819249619	DF	On-Demand	Mild	ADAM12	34	41
CC#CCN(C)C(=O)/C=C/c1ccc(OCCN(C)C)cc1	ZINC000819249638	DE	On-Demand	Mild	ESRRG	44	33
CC#CCN(C)C(=O)/C=C\c1ccc(OCCN(C)C)cc1	ZINC000819249639	DE	On-Demand	Mild	ESRRG	44	33
CC#CCN(C)C(=O)c1cc(S(=O)(=O)Nc2ccc(Cl)cc2)ccc1Cl	ZINC000819249644	HH	On-Demand	Mild	LIMK2	29	40
CC#CCN(C)C(=O)Cn1c(=O)n(CC)c(=O)c2ccccc21	ZINC000819249649	DC	On-Demand	Mild	TSPO	18	42
CC#CCN(C)C(=O)c1cc(S(=O)(=O)NC(C)C)ccc1F	ZINC000819249650	ED	On-Demand	Mild	LEF	40	42
CC#CCN(C)C(=O)/C(=C/c1ccccc1)OC	ZINC000819249651	BE	On-Demand	Mild	TLR4	25	43
CC#CCN(C)C(=O)/C(=C\c1ccccc1)OC	ZINC000819249652	BE	On-Demand	Mild	TLR4	25	43
CC#CCN(C)C(=O)c1cc(-c2nc3ccccc3s2)nc2ccccc12	ZINC000819249657	FJ	On-Demand	Mild	TACR3	16	40
CC#CCN(C)C(=O)c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O	ZINC000819249674	HE	On-Demand	Mild	HSD17B1	21	46
CC#CCN(C)C(=O)CC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819249679	EH	On-Demand	Mild	CTSK	15	44
CC#CCN(C)C(=O)CC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819249679	EH	On-Demand	Mild	FPR1	40	34
CC#CCN(C)C(=O)CC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819249680	EH	On-Demand	Mild	CTSK	15	44
CC#CCN(C)C(=O)CC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819249680	EH	On-Demand	Mild	FPR1	40	34
CC#CCN(C)C(=O)CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S	ZINC000819249683	HG	On-Demand	Mild	AKR1B1	41	38
CC#CCN(C)C(=O)CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S	ZINC000819249684	HG	On-Demand	Mild	AKR1B1	41	38
CC#CCN(C)C(=O)Cc1csc(NC(=O)Cc2cccs2)n1	ZINC000819249686	EE	On-Demand	Mild	CA5B	31	41
CC#CCN(C)C(=O)Cc1csc(NC(=O)Cc2cccs2)n1	ZINC000819249686	EE	On-Demand	Mild	CA5A	31	41
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000819249687	CE	On-Demand	Mild	CTSD	18	40
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000819249687	CE	On-Demand	Mild	PAPA1_CARPA	37	43
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000819249687	CE	On-Demand	Mild	CTSK	16	52
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000819249687	CE	On-Demand	Mild	ECE1	33	40
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000819249687	CE	On-Demand	Mild	REN	18	41
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000819249687	CE	On-Demand	Mild	POLG_HCV1	24	40
CC#CCN(C)C(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000819249687	CE	On-Demand	Mild	FPR1	50	39
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	ELANE	28	52
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	CASP3	16	51
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	BMP1	24	52
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	KLK3	89	39
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	CTSB	79	67
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	PAPA1_CARPA	89	48
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	CYSP_TRYCR	51	41
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	CTSK	42	67
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	CTSL	53	67
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	PGA	23	44
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	CAPNS1	69	41
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	CTSS	21	67
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	CAPN1	85	52
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	CASP1	24	44
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	CAPN2	132	44
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	CASP6	15	43
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	CASP9	32	43
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	NPR	73	44
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	PSMB5	47	42
CC#CCN(C)C(=O)[C@@H](NC(=O)OCc1ccccc1)[C@@H](C)CC	ZINC000819249701	EF	On-Demand	Mild	Q6PRC7_IXORI	34	44
CC#CCN(C)C(=O)C(C)(C)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819249755	FH	On-Demand	Mild	PAPA1_CARPA	41	42
CC#CCN(C)C(=O)C(C)(C)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819249755	FH	On-Demand	Mild	CTSK	15	45
CC#CCN(C)C(=O)C(C)(C)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819249755	FH	On-Demand	Mild	FPR1	44	36
CC#CCN(C)C(=O)C(C)(C)[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819249756	FH	On-Demand	Mild	PAPA1_CARPA	41	42
CC#CCN(C)C(=O)C(C)(C)[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819249756	FH	On-Demand	Mild	CTSK	15	45
CC#CCN(C)C(=O)C(C)(C)[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819249756	FH	On-Demand	Mild	FPR1	44	36
CC#CCN(C)C(=O)c1cccc(NS(C)(=O)=O)c1	ZINC000819249764	CD	On-Demand	Mild	NR3C2	19	43
C[C@@H]1CC[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819249768	CE	On-Demand	Bother	ADRB2	28	46
C[C@@H]1CC[C@H](NC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819249768	CE	On-Demand	Bother	ADRB3	16	40
C[C@@H]1CC[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819249769	CE	On-Demand	Bother	ADRB2	28	46
C[C@@H]1CC[C@H](NC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819249769	CE	On-Demand	Bother	ADRB3	16	40
CC#CCN(C)C(=O)c1cc(-c2ccncc2)nc2ccc(Br)cc12	ZINC000819249774	GI	On-Demand	Mild	PRS	89	51
CC#CCN(C)C(=O)[C@@H](OC1CCCC1)c1ccccc1	ZINC000819249783	CG	On-Demand	Mild	AMY2	45	31
CC#CCN(C)C(=O)[C@H](OC1CCCC1)c1ccccc1	ZINC000819249785	CG	On-Demand	Mild	AMY2	45	31
CC#CCN(C)C(=O)c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1	ZINC000819249797	EE	On-Demand	Mild	HPD	40	35
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	ACE	39	41
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	TYR	34	43
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	OPRM1	32	43
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	OPRD1	28	43
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	CELA1	17	41
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	ELANE	17	44
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	MME	88	43
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	ANPEP	50	34
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	TACR1	31	63
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	CTRA_BOVIN	42	33
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	HRAS	41	41
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	FCER2	84	34
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	CASP3	17	49
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	BMP1	19	44
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	KLK3	98	44
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	CTSB	98	67
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	PAPA1_CARPA	109	67
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	CYSP_TRYCR	72	50
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	CCKAR	17	41
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	CTSK	51	67
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	CTSL	66	67
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	PGA	34	40
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	CAPNS1	87	51
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	HLA-DRB1	87	40
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	CELA2A	49	33
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	REN	31	45
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	REN1	22	41
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	MMP11	73	36
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	CTSS	30	67
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	CAPN1	125	50
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	MMP9	18	42
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	CASP1	23	43
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	CAPN2	160	56
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	ACE2	57	36
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	CASP9	29	40
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	FPR1	61	36
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	CTRB_BOVIN	45	33
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	CYP3A4	33	41
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	NPR	86	43
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	PSMB5	41	45
CC#CCN(C)C(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1	ZINC000819249802	FG	On-Demand	Mild	NPFFR1	45	32
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)cc1	ZINC000819249807	CE	On-Demand	Anodyne	ADRB2	35	43
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)cc1	ZINC000819249807	CE	On-Demand	Anodyne	ADRB1	52	47
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)cc1	ZINC000819249807	CE	On-Demand	Anodyne	ADRB3	36	43
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)cc1	ZINC000819249808	CE	On-Demand	Anodyne	ADRB2	35	43
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)cc1	ZINC000819249808	CE	On-Demand	Anodyne	ADRB1	52	47
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)cc1	ZINC000819249808	CE	On-Demand	Anodyne	ADRB3	36	43
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)cc1	ZINC000819249809	CE	On-Demand	Anodyne	ADRB2	35	43
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)cc1	ZINC000819249809	CE	On-Demand	Anodyne	ADRB1	52	47
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)cc1	ZINC000819249809	CE	On-Demand	Anodyne	ADRB3	36	43
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)cc1	ZINC000819249810	CE	On-Demand	Anodyne	ADRB2	35	43
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)cc1	ZINC000819249810	CE	On-Demand	Anodyne	ADRB1	52	47
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)cc1	ZINC000819249810	CE	On-Demand	Anodyne	ADRB3	36	43
CC#CCN(C)C(=O)[C@H](NC(=O)OC(C)(C)C)[C@H](C)CC	ZINC000819249813	CE	On-Demand	Mild	CTSD	15	47
CC#CCN(C)C(=O)[C@H](NC(=O)OC(C)(C)C)[C@H](C)CC	ZINC000819249813	CE	On-Demand	Mild	ECE1	35	47
CC#CCN(C)C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@H](C)CC	ZINC000819249815	CE	On-Demand	Mild	CTSD	15	47
CC#CCN(C)C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@H](C)CC	ZINC000819249815	CE	On-Demand	Mild	ECE1	35	47
CC#CCN(C)C(=O)[C@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000819249816	CE	On-Demand	Mild	CTSD	15	47
CC#CCN(C)C(=O)[C@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000819249816	CE	On-Demand	Mild	ECE1	35	47
CC#CCN(C)C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000819249818	CE	On-Demand	Mild	CTSD	15	47
CC#CCN(C)C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC	ZINC000819249818	CE	On-Demand	Mild	ECE1	35	47
C[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819249830	CG	On-Demand	Anodyne	ADRB2	44	57
C[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819249830	CG	On-Demand	Anodyne	ADRB1	40	45
C[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819249830	CG	On-Demand	Anodyne	ADRB3	31	41
C[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819249830	CG	On-Demand	Anodyne	CASR	40	37
C[C@@H]1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819249831	CG	On-Demand	Anodyne	ADRB2	44	57
C[C@@H]1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819249831	CG	On-Demand	Anodyne	ADRB1	40	45
C[C@@H]1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819249831	CG	On-Demand	Anodyne	ADRB3	31	41
C[C@@H]1CC[C@H](NC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819249831	CG	On-Demand	Anodyne	CASR	40	37
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@H](O)COc3ccccc3)cc2C1	ZINC000819249842	GG	On-Demand	Anodyne	ADRB2	45	43
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@H](O)COc3ccccc3)cc2C1	ZINC000819249842	GG	On-Demand	Anodyne	ADRB1	69	42
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@H](O)COc3ccccc3)cc2C1	ZINC000819249842	GG	On-Demand	Anodyne	ADRB3	47	42
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@H](O)COc3ccccc3)cc2C1	ZINC000819249842	GG	On-Demand	Anodyne	ABCB1	27	40
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@@H](O)COc3ccccc3)cc2C1	ZINC000819249843	GG	On-Demand	Anodyne	ADRB2	45	43
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@@H](O)COc3ccccc3)cc2C1	ZINC000819249843	GG	On-Demand	Anodyne	ADRB1	69	42
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@@H](O)COc3ccccc3)cc2C1	ZINC000819249843	GG	On-Demand	Anodyne	ADRB3	47	42
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@@H](O)COc3ccccc3)cc2C1	ZINC000819249843	GG	On-Demand	Anodyne	ABCB1	27	40
C[C@H](O)CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819249875	FD	On-Demand	Mild	PAPA1_CARPA	33	41
C[C@H](O)CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819249877	FD	On-Demand	Mild	PAPA1_CARPA	33	41
C[C@@H]1CC[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819249898	EF	On-Demand	Anodyne	GPR119	31	42
C[C@@H]1CC[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819249899	EF	On-Demand	Anodyne	GPR119	31	42
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)c1	ZINC000819249948	CE	On-Demand	Anodyne	ADRB2	31	44
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)c1	ZINC000819249948	CE	On-Demand	Anodyne	ADRB1	43	42
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)c1	ZINC000819249948	CE	On-Demand	Anodyne	ADRB3	33	42
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)c1	ZINC000819249948	CE	On-Demand	Anodyne	ABCB1	20	45
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)c1	ZINC000819249949	CE	On-Demand	Anodyne	ADRB2	31	44
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)c1	ZINC000819249949	CE	On-Demand	Anodyne	ADRB1	43	42
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)c1	ZINC000819249949	CE	On-Demand	Anodyne	ADRB3	33	42
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)c1	ZINC000819249949	CE	On-Demand	Anodyne	ABCB1	20	45
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)c1	ZINC000819249950	CE	On-Demand	Anodyne	ADRB2	31	44
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)c1	ZINC000819249950	CE	On-Demand	Anodyne	ADRB1	43	42
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)c1	ZINC000819249950	CE	On-Demand	Anodyne	ADRB3	33	42
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)c1	ZINC000819249950	CE	On-Demand	Anodyne	ABCB1	20	45
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)c1	ZINC000819249951	CE	On-Demand	Anodyne	ADRB2	31	44
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)c1	ZINC000819249951	CE	On-Demand	Anodyne	ADRB1	43	42
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)c1	ZINC000819249951	CE	On-Demand	Anodyne	ADRB3	33	42
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)c1	ZINC000819249951	CE	On-Demand	Anodyne	ABCB1	20	45
C[C@@H]1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819249955	CE	On-Demand	Bother	CACNA1D	42	35
C[C@@H]1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819249957	CE	On-Demand	Bother	CACNA1D	42	35
C[C@@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249962	FG	On-Demand	Anodyne	CTSD	109	47
C[C@@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249962	FG	On-Demand	Anodyne	PGC	62	38
C[C@@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249962	FG	On-Demand	Anodyne	PAPA1_CARPA	34	43
C[C@@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249962	FG	On-Demand	Anodyne	BACE2	58	47
C[C@@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249962	FG	On-Demand	Anodyne	TACR3	17	40
C[C@@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249962	FG	On-Demand	Anodyne	REN	93	48
C[C@@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249962	FG	On-Demand	Anodyne	REN1	23	45
C[C@@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249962	FG	On-Demand	Anodyne	BACE1	91	48
C[C@@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249962	FG	On-Demand	Anodyne	FPR1	52	41
C[C@@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249962	FG	On-Demand	Anodyne	PLM1_PLAFA	33	43
C[C@H]1CC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249963	FG	On-Demand	Anodyne	CTSD	109	47
C[C@H]1CC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249963	FG	On-Demand	Anodyne	PGC	62	38
C[C@H]1CC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249963	FG	On-Demand	Anodyne	PAPA1_CARPA	34	43
C[C@H]1CC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249963	FG	On-Demand	Anodyne	BACE2	58	47
C[C@H]1CC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249963	FG	On-Demand	Anodyne	TACR3	17	40
C[C@H]1CC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249963	FG	On-Demand	Anodyne	REN	93	48
C[C@H]1CC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249963	FG	On-Demand	Anodyne	REN1	23	45
C[C@H]1CC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249963	FG	On-Demand	Anodyne	BACE1	91	48
C[C@H]1CC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249963	FG	On-Demand	Anodyne	FPR1	52	41
C[C@H]1CC[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249963	FG	On-Demand	Anodyne	PLM1_PLAFA	33	43
C[C@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249964	FG	On-Demand	Anodyne	CTSD	109	47
C[C@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249964	FG	On-Demand	Anodyne	PGC	62	38
C[C@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249964	FG	On-Demand	Anodyne	PAPA1_CARPA	34	43
C[C@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249964	FG	On-Demand	Anodyne	BACE2	58	47
C[C@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249964	FG	On-Demand	Anodyne	TACR3	17	40
C[C@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249964	FG	On-Demand	Anodyne	REN	93	48
C[C@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249964	FG	On-Demand	Anodyne	REN1	23	45
C[C@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249964	FG	On-Demand	Anodyne	BACE1	91	48
C[C@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249964	FG	On-Demand	Anodyne	FPR1	52	41
C[C@H]1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819249964	FG	On-Demand	Anodyne	PLM1_PLAFA	33	43
C[C@@H]1CC[C@H](NCCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000819249978	CF	On-Demand	Bother	SERPINE1	32	40
C[C@H]1CC[C@@H](NCCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000819249979	CF	On-Demand	Bother	SERPINE1	32	40
C[C@H]1CC[C@H](NCCC(=O)Nc2ccccc2[N+](=O)[O-])C1	ZINC000819249980	CF	On-Demand	Bother	SERPINE1	32	40
CC(C)(C)OC(=O)N1Cc2ccc(CNCCC(=O)Nc3cccnc3)cc2C1	ZINC000819249991	GG	On-Demand	Anodyne	NAMPT	30	40
C[C@@H]1CC[C@H](NCCC(=O)Nc2cccnc2)C1	ZINC000819250010	BE	On-Demand	Anodyne	NAMPT	33	40
C[C@H]1CC[C@@H](NCCC(=O)Nc2cccnc2)C1	ZINC000819250011	BE	On-Demand	Anodyne	NAMPT	33	40
C[C@H]1CC[C@H](NCCC(=O)Nc2cccnc2)C1	ZINC000819250012	BE	On-Demand	Anodyne	NAMPT	33	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NNC(=O)c1cccc(C(F)(F)F)c1)C2	ZINC000819250014	GE	On-Demand	Reactive	CACNA1B	41	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NNC(=O)c1cccc(C(F)(F)F)c1)C2	ZINC000819250014	GE	On-Demand	Reactive	CCR2	95	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NNC(=O)c1cccc(C(F)(F)F)c1)C2	ZINC000819250015	GE	On-Demand	Reactive	CACNA1B	41	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NNC(=O)c1cccc(C(F)(F)F)c1)C2	ZINC000819250015	GE	On-Demand	Reactive	CCR2	95	42
C=C(C)CN1CCC(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819250030	GF	On-Demand	Mild	PAPA1_CARPA	32	43
C=C(C)CN1CCC(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819250031	GF	On-Demand	Mild	PAPA1_CARPA	32	43
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(F)=C1CCC1	ZINC000819250072	DF	On-Demand	Reactive	CCR2	71	41
O=C(NNC(=O)c1cccc(C(F)(F)F)c1)C(F)=C1CCC1	ZINC000819250072	DF	On-Demand	Reactive	KCNK3	17	47
C=C(C)C(C)(C)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1	ZINC000819250112	EG	On-Demand	Mild	NPY2R	55	40
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](Cc2ccccc2)C1	ZINC000819250194	CG	On-Demand	Anodyne	GRIN2B	41	45
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](Cc2ccccc2)C1	ZINC000819250194	CG	On-Demand	Anodyne	CCR3	20	40
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H](Cc2ccccc2)C1	ZINC000819250195	CG	On-Demand	Anodyne	GRIN2B	41	45
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H](Cc2ccccc2)C1	ZINC000819250195	CG	On-Demand	Anodyne	CCR3	20	40
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](Cc2ccccc2)C1	ZINC000819250196	CG	On-Demand	Anodyne	GRIN2B	41	45
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](Cc2ccccc2)C1	ZINC000819250196	CG	On-Demand	Anodyne	CCR3	20	40
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](Cc2ccccc2)C1	ZINC000819250197	CG	On-Demand	Anodyne	GRIN2B	41	45
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](Cc2ccccc2)C1	ZINC000819250197	CG	On-Demand	Anodyne	CCR3	20	40
Cc1nn(C)c(Cl)c1[C@@H]1CCCN1C(=O)c1coc(=O)c2ccccc12	ZINC000819250220	FG	On-Demand	Anodyne	INHA	50	33
Cc1nn(C)c(Cl)c1[C@H]1CCCN1C(=O)c1coc(=O)c2ccccc12	ZINC000819250221	FG	On-Demand	Anodyne	INHA	50	33
C=CCC1(C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000819250223	FF	On-Demand	Reactive	CCR2	70	37
C[C@@H](CC(=O)NNC(=O)c1cccc(C(F)(F)F)c1)n1cccn1	ZINC000819250224	EE	On-Demand	Reactive	CCR2	79	42
C[C@H](CC(=O)NNC(=O)c1cccc(C(F)(F)F)c1)n1cccn1	ZINC000819250225	EE	On-Demand	Reactive	CCR2	79	42
C[C@H](CNCc1ccc2c(c1)CN(C(=O)OC(C)(C)C)C2)S(C)(=O)=O	ZINC000819250235	FE	On-Demand	Anodyne	GPR119	33	42
C[C@@H](CNCc1ccc2c(c1)CN(C(=O)OC(C)(C)C)C2)S(C)(=O)=O	ZINC000819250236	FE	On-Demand	Anodyne	GPR119	33	42
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)N3Cc4ccccc4C3)nn2)C1	ZINC000819250247	GG	On-Demand	Anodyne	PREP	28	42
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)N3Cc4ccccc4C3)nn2)C1	ZINC000819250248	GG	On-Demand	Anodyne	PREP	28	42
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@H](O)c3cccnc3)cc2C1	ZINC000819250249	FG	On-Demand	Anodyne	ADRB2	21	40
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@H](O)c3cccnc3)cc2C1	ZINC000819250249	FG	On-Demand	Anodyne	ADRB1	26	41
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@H](O)c3cccnc3)cc2C1	ZINC000819250249	FG	On-Demand	Anodyne	ADRB3	96	44
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@@H](O)c3cccnc3)cc2C1	ZINC000819250250	FG	On-Demand	Anodyne	ADRB2	21	40
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@@H](O)c3cccnc3)cc2C1	ZINC000819250250	FG	On-Demand	Anodyne	ADRB1	26	41
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@@H](O)c3cccnc3)cc2C1	ZINC000819250250	FG	On-Demand	Anodyne	ADRB3	96	44
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@H](O)C3CC3)cc2C1	ZINC000819250257	EF	On-Demand	Anodyne	GPR119	28	41
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@@H](O)C3CC3)cc2C1	ZINC000819250258	EF	On-Demand	Anodyne	GPR119	28	41
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1csc2ccccc12	ZINC000819250266	DH	On-Demand	Anodyne	UL26	79	34
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1csc2ccccc12	ZINC000819250266	DH	On-Demand	Anodyne	SCAF_EBVB9	69	34
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1csc2ccccc12	ZINC000819250267	DH	On-Demand	Anodyne	UL26	79	34
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1csc2ccccc12	ZINC000819250267	DH	On-Demand	Anodyne	SCAF_EBVB9	69	34
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1csc2ccccc12	ZINC000819250268	DH	On-Demand	Anodyne	UL26	79	34
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1csc2ccccc12	ZINC000819250268	DH	On-Demand	Anodyne	SCAF_EBVB9	69	34
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1csc2ccccc12	ZINC000819250269	DH	On-Demand	Anodyne	UL26	79	34
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1csc2ccccc12	ZINC000819250269	DH	On-Demand	Anodyne	SCAF_EBVB9	69	34
O[C@@H](CNCC1(c2ccc(C(F)(F)F)cc2)CC1)c1cccnc1	ZINC000819250272	EG	On-Demand	Anodyne	ADRB2	18	40
O[C@@H](CNCC1(c2ccc(C(F)(F)F)cc2)CC1)c1cccnc1	ZINC000819250272	EG	On-Demand	Anodyne	ADRB1	19	41
O[C@@H](CNCC1(c2ccc(C(F)(F)F)cc2)CC1)c1cccnc1	ZINC000819250272	EG	On-Demand	Anodyne	ADRB3	76	42
O[C@H](CNCC1(c2ccc(C(F)(F)F)cc2)CC1)c1cccnc1	ZINC000819250273	EG	On-Demand	Anodyne	ADRB2	18	40
O[C@H](CNCC1(c2ccc(C(F)(F)F)cc2)CC1)c1cccnc1	ZINC000819250273	EG	On-Demand	Anodyne	ADRB1	19	41
O[C@H](CNCC1(c2ccc(C(F)(F)F)cc2)CC1)c1cccnc1	ZINC000819250273	EG	On-Demand	Anodyne	ADRB3	76	42
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)c1cccc2ncccc12	ZINC000819250322	DF	On-Demand	Reactive	G2YM83_BOTF4	46	35
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)c1cccc2ncccc12	ZINC000819250323	DF	On-Demand	Reactive	G2YM83_BOTF4	46	35
O[C@@H](CNCCN1CCCOCC1)c1cccc(Cl)c1	ZINC000819250334	CD	On-Demand	Anodyne	ADRB1	47	48
O[C@@H](CNCCN1CCCOCC1)c1cccc(Cl)c1	ZINC000819250334	CD	On-Demand	Anodyne	ADRB3	59	48
O[C@@H](CNCCN1CCCOCC1)c1cccc(Cl)c1	ZINC000819250334	CD	On-Demand	Anodyne	IGF1R	27	40
O[C@@H](CNCCN1CCCOCC1)c1cccc(Cl)c1	ZINC000819250334	CD	On-Demand	Anodyne	CASR	45	38
O[C@@H](CNCCN1CCCOCC1)c1cccc(Cl)c1	ZINC000819250334	CD	On-Demand	Anodyne	CYP3A4	46	36
O[C@H](CNCCN1CCCOCC1)c1cccc(Cl)c1	ZINC000819250335	CD	On-Demand	Anodyne	ADRB1	47	48
O[C@H](CNCCN1CCCOCC1)c1cccc(Cl)c1	ZINC000819250335	CD	On-Demand	Anodyne	ADRB3	59	48
O[C@H](CNCCN1CCCOCC1)c1cccc(Cl)c1	ZINC000819250335	CD	On-Demand	Anodyne	IGF1R	27	40
O[C@H](CNCCN1CCCOCC1)c1cccc(Cl)c1	ZINC000819250335	CD	On-Demand	Anodyne	CASR	45	38
O[C@H](CNCCN1CCCOCC1)c1cccc(Cl)c1	ZINC000819250335	CD	On-Demand	Anodyne	CYP3A4	46	36
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)cc1	ZINC000819250376	DD	On-Demand	Anodyne	ADRB2	45	45
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)cc1	ZINC000819250376	DD	On-Demand	Anodyne	ADRB1	64	47
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC[C@H](C)C2)cc1	ZINC000819250376	DD	On-Demand	Anodyne	ADRB3	47	45
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)cc1	ZINC000819250378	DD	On-Demand	Anodyne	ADRB2	45	45
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)cc1	ZINC000819250378	DD	On-Demand	Anodyne	ADRB1	64	47
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](C)C2)cc1	ZINC000819250378	DD	On-Demand	Anodyne	ADRB3	47	45
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)cc1	ZINC000819250379	DD	On-Demand	Anodyne	ADRB2	45	45
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)cc1	ZINC000819250379	DD	On-Demand	Anodyne	ADRB1	64	47
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](C)C2)cc1	ZINC000819250379	DD	On-Demand	Anodyne	ADRB3	47	45
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)cc1	ZINC000819250381	DD	On-Demand	Anodyne	ADRB2	45	45
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)cc1	ZINC000819250381	DD	On-Demand	Anodyne	ADRB1	64	47
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](C)C2)cc1	ZINC000819250381	DD	On-Demand	Anodyne	ADRB3	47	45
COc1ccc(OC)c([C@H](O)CNCCc2cn(C)c3cc(C)ccc23)c1	ZINC000819250447	FG	On-Demand	Anodyne	MTNR1A	17	44
O=C(C(F)=C1CCC1)N1CCN2CCC[C@@H]2C1	ZINC000819250452	BD	On-Demand	Anodyne	L3MBTL3	44	38
O=C(C(F)=C1CCC1)N1CCN2CCC[C@H]2C1	ZINC000819250453	BD	On-Demand	Anodyne	L3MBTL3	44	38
C=CCN1CCC(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819250465	FE	On-Demand	Mild	PAPA1_CARPA	34	43
C=CCN1CCC(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819250466	FE	On-Demand	Mild	PAPA1_CARPA	34	43
C[C@@H]1CC[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819250476	CE	On-Demand	Bother	ADRB2	23	42
C[C@@H]1CC[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819250476	CE	On-Demand	Bother	ADRB1	25	42
C[C@@H]1CC[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819250476	CE	On-Demand	Bother	ADRB3	20	42
C[C@@H]1CC[C@H](NC[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819250476	CE	On-Demand	Bother	CACNA1D	42	34
C[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819250477	CE	On-Demand	Bother	ADRB2	23	42
C[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819250477	CE	On-Demand	Bother	ADRB1	25	42
C[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819250477	CE	On-Demand	Bother	ADRB3	20	42
C[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819250477	CE	On-Demand	Bother	CACNA1D	42	34
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@H](O)c3cccc(F)c3)cc2C1	ZINC000819250528	GH	On-Demand	Anodyne	ADRB1	17	40
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@H](O)c3cccc(F)c3)cc2C1	ZINC000819250528	GH	On-Demand	Anodyne	ADRB3	26	40
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@@H](O)c3cccc(F)c3)cc2C1	ZINC000819250530	GH	On-Demand	Anodyne	ADRB1	17	40
CC(C)(C)OC(=O)N1Cc2ccc(CNC[C@@H](O)c3cccc(F)c3)cc2C1	ZINC000819250530	GH	On-Demand	Anodyne	ADRB3	26	40
NC(=O)C1=NO[C@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819250580	CB	On-Demand	Anodyne	LUCI_PHOPY	59	33
NC(=O)C1=NO[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819250581	CB	On-Demand	Anodyne	LUCI_PHOPY	59	33
NC(=O)C1=NO[C@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819250582	CB	On-Demand	Anodyne	LUCI_PHOPY	59	33
NC(=O)C1=NO[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819250583	CB	On-Demand	Anodyne	LUCI_PHOPY	59	33
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819250592	EB	On-Demand	Bother	ADRB1	42	31
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819250593	EB	On-Demand	Bother	ADRB1	42	31
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819250594	EB	On-Demand	Bother	ADRB1	42	31
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])C1	ZINC000819250595	EB	On-Demand	Bother	ADRB1	42	31
C[C@H]1c2ccccc2CCN1C(=O)C(F)=C1CCC1	ZINC000819250618	CH	On-Demand	Anodyne	TRPM8	25	41
O[C@@H](CNCCN1CCCOCC1)c1ccccc1	ZINC000819250629	CD	On-Demand	Anodyne	ADRB2	23	47
O[C@@H](CNCCN1CCCOCC1)c1ccccc1	ZINC000819250629	CD	On-Demand	Anodyne	ADRB3	46	42
O[C@@H](CNCCN1CCCOCC1)c1ccccc1	ZINC000819250629	CD	On-Demand	Anodyne	CASR	50	38
O[C@H](CNCCN1CCCOCC1)c1ccccc1	ZINC000819250630	CD	On-Demand	Anodyne	ADRB2	23	47
O[C@H](CNCCN1CCCOCC1)c1ccccc1	ZINC000819250630	CD	On-Demand	Anodyne	ADRB3	46	42
O[C@H](CNCCN1CCCOCC1)c1ccccc1	ZINC000819250630	CD	On-Demand	Anodyne	CASR	50	38
CN(C)c1ccc(NC(=O)CCNCCN2CCCOCC2)cc1	ZINC000819250646	ED	On-Demand	Anodyne	PRKDC	23	40
CN(C)c1ccc(NC(=O)CCNCCN2CCCOCC2)cc1	ZINC000819250646	ED	On-Demand	Anodyne	CHRNA7	18	47
CN(C)c1ccc(NC(=O)CCNCCN2CCCOCC2)cc1	ZINC000819250646	ED	On-Demand	Anodyne	EPHX2	24	43
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CC[C@@H](Cc2ccccc2)C1	ZINC000819250678	FG	On-Demand	Anodyne	FPR1	40	37
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CC[C@H](Cc2ccccc2)C1	ZINC000819250679	FG	On-Demand	Anodyne	FPR1	40	37
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CC[C@H](Cc2ccccc2)C1	ZINC000819250680	FG	On-Demand	Anodyne	FPR1	40	37
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CC[C@@H](Cc2ccccc2)C1	ZINC000819250681	FG	On-Demand	Anodyne	FPR1	40	37
CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)Cc2nsc3ccccc23)C1	ZINC000819250708	FF	On-Demand	Anodyne	DRD2	16	40
CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)Cc2nsc3ccccc23)C1	ZINC000819250708	FF	On-Demand	Anodyne	CCR8	50	35
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819250713	FG	On-Demand	Anodyne	ACHE	21	40
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819250713	FG	On-Demand	Anodyne	HTR4	44	38
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819250713	FG	On-Demand	Anodyne	SIGMAR1	24	46
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819250713	FG	On-Demand	Anodyne	CACNA1I	62	38
O=C(/C=C\[C@H]1CCCO1)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819250714	FG	On-Demand	Anodyne	ACHE	21	40
O=C(/C=C\[C@H]1CCCO1)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819250714	FG	On-Demand	Anodyne	HTR4	44	38
O=C(/C=C\[C@H]1CCCO1)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819250714	FG	On-Demand	Anodyne	SIGMAR1	24	46
O=C(/C=C\[C@H]1CCCO1)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819250714	FG	On-Demand	Anodyne	CACNA1I	62	38
O=C(/C=C/[C@H]1CCCO1)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819250715	FG	On-Demand	Anodyne	ACHE	21	40
O=C(/C=C/[C@H]1CCCO1)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819250715	FG	On-Demand	Anodyne	HTR4	44	38
O=C(/C=C/[C@H]1CCCO1)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819250715	FG	On-Demand	Anodyne	SIGMAR1	24	46
O=C(/C=C/[C@H]1CCCO1)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819250715	FG	On-Demand	Anodyne	CACNA1I	62	38
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819250716	FG	On-Demand	Anodyne	ACHE	21	40
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819250716	FG	On-Demand	Anodyne	HTR4	44	38
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819250716	FG	On-Demand	Anodyne	SIGMAR1	24	46
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819250716	FG	On-Demand	Anodyne	CACNA1I	62	38
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819250736	EC	On-Demand	Anodyne	ADRB2	24	58
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819250736	EC	On-Demand	Anodyne	ADRB1	52	32
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819250737	EC	On-Demand	Anodyne	ADRB2	24	58
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819250737	EC	On-Demand	Anodyne	ADRB1	52	32
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819250738	EC	On-Demand	Anodyne	ADRB2	24	58
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2cccc3ccccc23)C1	ZINC000819250738	EC	On-Demand	Anodyne	ADRB1	52	32
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819250739	EC	On-Demand	Anodyne	ADRB2	24	58
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819250739	EC	On-Demand	Anodyne	ADRB1	52	32
CN(C)C1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CCC1	ZINC000819250744	CD	On-Demand	Bother	CACNA1C	52	36
CN(C)C1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CCC1	ZINC000819250744	CD	On-Demand	Bother	CACNA1D	80	35
CN(C)C1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCC1	ZINC000819250745	CD	On-Demand	Bother	CACNA1C	52	36
CN(C)C1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCC1	ZINC000819250745	CD	On-Demand	Bother	CACNA1D	80	35
CC[C@@H](O)CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819250746	GD	On-Demand	Mild	PAPA1_CARPA	33	42
CC[C@H](O)CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819250747	GD	On-Demand	Mild	PAPA1_CARPA	33	42
CC[C@@H](O)CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819250748	GD	On-Demand	Mild	PAPA1_CARPA	33	42
CC[C@H](O)CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819250749	GD	On-Demand	Mild	PAPA1_CARPA	33	42
CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819250821	FD	On-Demand	Anodyne	BIRC2	17	40
CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819250821	FD	On-Demand	Anodyne	GPR119	23	41
COc1cnccc1[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819250837	CD	On-Demand	Anodyne	ADRB2	18	43
COc1cnccc1[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819250837	CD	On-Demand	Anodyne	ADRB1	21	46
COc1cnccc1[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819250837	CD	On-Demand	Anodyne	ADRB3	56	46
COc1cnccc1[C@H](C)NC[C@H](O)c1cccnc1	ZINC000819250838	CD	On-Demand	Anodyne	ADRB2	18	43
COc1cnccc1[C@H](C)NC[C@H](O)c1cccnc1	ZINC000819250838	CD	On-Demand	Anodyne	ADRB1	21	46
COc1cnccc1[C@H](C)NC[C@H](O)c1cccnc1	ZINC000819250838	CD	On-Demand	Anodyne	ADRB3	56	46
COc1cnccc1[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819250839	CD	On-Demand	Anodyne	ADRB2	18	43
COc1cnccc1[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819250839	CD	On-Demand	Anodyne	ADRB1	21	46
COc1cnccc1[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819250839	CD	On-Demand	Anodyne	ADRB3	56	46
COc1cnccc1[C@H](C)NC[C@@H](O)c1cccnc1	ZINC000819250840	CD	On-Demand	Anodyne	ADRB2	18	43
COc1cnccc1[C@H](C)NC[C@@H](O)c1cccnc1	ZINC000819250840	CD	On-Demand	Anodyne	ADRB1	21	46
COc1cnccc1[C@H](C)NC[C@@H](O)c1cccnc1	ZINC000819250840	CD	On-Demand	Anodyne	ADRB3	56	46
N#Cc1cccnc1OC1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819250843	EE	On-Demand	Mild	ADRB3	35	45
N#Cc1cccnc1OC1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819250844	EE	On-Demand	Mild	ADRB3	35	45
COc1cnccc1[C@@H](C)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819250853	GF	On-Demand	Anodyne	GPR119	49	45
COc1cnccc1[C@@H](C)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819250854	GF	On-Demand	Anodyne	GPR119	49	45
COc1cnccc1[C@H](C)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819250855	GF	On-Demand	Anodyne	GPR119	49	45
COc1cnccc1[C@H](C)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819250856	GF	On-Demand	Anodyne	GPR119	49	45
C[C@H]1c2ccccc2CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819250858	FH	On-Demand	Mild	GHRHR	41	34
C[C@H]1c2ccccc2CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819250858	FH	On-Demand	Mild	PAPA1_CARPA	38	42
C[C@H]1c2ccccc2CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819250860	FH	On-Demand	Mild	GHRHR	41	34
C[C@H]1c2ccccc2CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819250860	FH	On-Demand	Mild	PAPA1_CARPA	38	42
C[S@@](=O)CCNC(=O)C1(c2ccc(Cl)cc2Cl)CCCCC1	ZINC000819250866	FH	On-Demand	Anodyne	UGCG	35	42
COc1cnccc1[C@@H](C)NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819250869	GF	On-Demand	Anodyne	GPR119	18	44
COc1cnccc1[C@H](C)NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819250870	GF	On-Demand	Anodyne	GPR119	18	44
COc1cnccc1[C@@H](C)NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819250871	GF	On-Demand	Anodyne	GPR119	18	44
COc1cnccc1[C@H](C)NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819250872	GF	On-Demand	Anodyne	GPR119	18	44
O=[N+]([O-])c1cccc([C@@H](O)CNCCN2CCCOCC2)c1	ZINC000819250890	DC	On-Demand	Bother	CASR	45	35
O=[N+]([O-])c1cccc([C@H](O)CNCCN2CCCOCC2)c1	ZINC000819250891	DC	On-Demand	Bother	CASR	45	35
O[C@@H](CNCCN1CCCOCC1)c1cccc2ccccc12	ZINC000819250897	DE	On-Demand	Anodyne	ADCY5	18	42
O[C@@H](CNCCN1CCCOCC1)c1cccc2ccccc12	ZINC000819250897	DE	On-Demand	Anodyne	HNMT	49	34
O[C@@H](CNCCN1CCCOCC1)c1cccc2ccccc12	ZINC000819250897	DE	On-Demand	Anodyne	PTGDS	44	42
O[C@@H](CNCCN1CCCOCC1)c1cccc2ccccc12	ZINC000819250897	DE	On-Demand	Anodyne	HPGDS	24	42
Cc1ccc(OC[C@H](O)CN[C@@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC000819250910	GG	On-Demand	Anodyne	ADRB2	34	49
Cc1ccc(OC[C@H](O)CN[C@@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC000819250910	GG	On-Demand	Anodyne	ADRB1	43	43
Cc1ccc(OC[C@H](O)CN[C@@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC000819250911	GG	On-Demand	Anodyne	ADRB2	34	49
Cc1ccc(OC[C@H](O)CN[C@@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC000819250911	GG	On-Demand	Anodyne	ADRB1	43	43
Cc1ccc(OC[C@H](O)CN[C@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC000819250912	GG	On-Demand	Anodyne	ADRB2	34	49
Cc1ccc(OC[C@H](O)CN[C@H]2CCC[C@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC000819250912	GG	On-Demand	Anodyne	ADRB1	43	43
Cc1ccc(OC[C@H](O)CN[C@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC000819250913	GG	On-Demand	Anodyne	ADRB2	34	49
Cc1ccc(OC[C@H](O)CN[C@H]2CCC[C@@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC000819250913	GG	On-Demand	Anodyne	ADRB1	43	43
COc1ccc(NC(=O)c2cc(Br)oc2C)c(C(=O)NC2CC2)c1	ZINC000819250958	GH	On-Demand	Anodyne	MAPK11	20	41
COc1ccc(NC(=O)c2cc(Br)oc2C)c(C(=O)NC2CC2)c1	ZINC000819250958	GH	On-Demand	Anodyne	AKR1B10	19	40
C[S@@](=O)CCNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819250986	DD	On-Demand	Anodyne	MTNR1A	22	44
C[S@@](=O)CCNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819250986	DD	On-Demand	Anodyne	MTNR1B	20	44
C[S@@](=O)CCNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819250986	DD	On-Demand	Anodyne	CRTM	43	38
O[C@@H](CNCCN1CCCOCC1)c1cccnc1	ZINC000819250997	CC	On-Demand	Anodyne	ADRB2	31	45
O[C@@H](CNCCN1CCCOCC1)c1cccnc1	ZINC000819250997	CC	On-Demand	Anodyne	ADRB1	32	45
O[C@@H](CNCCN1CCCOCC1)c1cccnc1	ZINC000819250997	CC	On-Demand	Anodyne	ADRB3	108	49
O[C@@H](CNCCN1CCCOCC1)c1cccnc1	ZINC000819250997	CC	On-Demand	Anodyne	CASR	45	45
O[C@H](CNCCN1CCCOCC1)c1cccnc1	ZINC000819250998	CC	On-Demand	Anodyne	ADRB2	31	45
O[C@H](CNCCN1CCCOCC1)c1cccnc1	ZINC000819250998	CC	On-Demand	Anodyne	ADRB1	32	45
O[C@H](CNCCN1CCCOCC1)c1cccnc1	ZINC000819250998	CC	On-Demand	Anodyne	ADRB3	108	49
O[C@H](CNCCN1CCCOCC1)c1cccnc1	ZINC000819250998	CC	On-Demand	Anodyne	CASR	45	45
COc1ccc(NC(=O)[C@H]2C[C@@H]2c2ccc(C)cc2)c(C(=O)NC2CC2)c1	ZINC000819251033	FH	On-Demand	Anodyne	MAPK11	17	42
CN(C)CCCOc1ccc(NC(=O)C(F)=C2CCC2)cc1	ZINC000819251034	DG	On-Demand	Anodyne	LTA4H	30	42
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(Br)cc1	ZINC000819251043	FH	On-Demand	Anodyne	ADRB2	48	57
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(Br)cc1	ZINC000819251043	FH	On-Demand	Anodyne	ADRB1	46	46
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(Br)cc1	ZINC000819251043	FH	On-Demand	Anodyne	ADRB3	76	46
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(Br)cc1	ZINC000819251044	FH	On-Demand	Anodyne	ADRB2	48	57
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(Br)cc1	ZINC000819251044	FH	On-Demand	Anodyne	ADRB1	46	46
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(Br)cc1	ZINC000819251044	FH	On-Demand	Anodyne	ADRB3	76	46
CN(C)CCc1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819251045	DF	On-Demand	Anodyne	ADRB2	25	41
CN(C)CCc1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819251045	DF	On-Demand	Anodyne	ADRB1	23	46
CN(C)CCc1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819251045	DF	On-Demand	Anodyne	ADRB3	38	46
CN(C)CCc1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819251046	DF	On-Demand	Anodyne	ADRB2	25	41
CN(C)CCc1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819251046	DF	On-Demand	Anodyne	ADRB1	23	46
CN(C)CCc1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819251046	DF	On-Demand	Anodyne	ADRB3	38	46
CC[C@@](C)(NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2)c1ccccc1	ZINC000819251059	EG	On-Demand	Anodyne	AMY2	43	30
CC[C@@](C)(NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2)c1ccccc1	ZINC000819251060	EG	On-Demand	Anodyne	AMY2	43	30
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCOc3c(F)cccc32)c1	ZINC000819251066	EF	On-Demand	Bother	LUXR	21	42
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCOc3c(F)cccc32)c1	ZINC000819251067	EF	On-Demand	Bother	LUXR	21	42
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cn1	ZINC000819251077	CE	On-Demand	Anodyne	ADRB3	61	42
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cn1	ZINC000819251078	CE	On-Demand	Anodyne	ADRB3	61	42
O[C@@H](CNCCc1ccc(F)c(F)c1)c1cc(F)ccc1F	ZINC000819251080	DG	On-Demand	Anodyne	ADRB2	47	41
O[C@@H](CNCCc1ccc(F)c(F)c1)c1cc(F)ccc1F	ZINC000819251080	DG	On-Demand	Anodyne	ADRB1	42	42
O[C@@H](CNCCc1ccc(F)c(F)c1)c1cc(F)ccc1F	ZINC000819251080	DG	On-Demand	Anodyne	ADRB3	48	42
O[C@H](CNCCc1ccc(F)c(F)c1)c1cc(F)ccc1F	ZINC000819251081	DG	On-Demand	Anodyne	ADRB2	47	41
O[C@H](CNCCc1ccc(F)c(F)c1)c1cc(F)ccc1F	ZINC000819251081	DG	On-Demand	Anodyne	ADRB1	42	42
O[C@H](CNCCc1ccc(F)c(F)c1)c1cc(F)ccc1F	ZINC000819251081	DG	On-Demand	Anodyne	ADRB3	48	42
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000819251082	DG	On-Demand	Anodyne	ADRB2	58	55
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000819251082	DG	On-Demand	Anodyne	ADRB1	62	50
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000819251082	DG	On-Demand	Anodyne	ADRB3	94	50
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000819251083	DG	On-Demand	Anodyne	ADRB2	58	55
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000819251083	DG	On-Demand	Anodyne	ADRB1	62	50
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000819251083	DG	On-Demand	Anodyne	ADRB3	94	50
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000819251091	FG	On-Demand	Anodyne	SSTR2	46	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000819251091	FG	On-Demand	Anodyne	MC4R	19	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000819251091	FG	On-Demand	Anodyne	CCKAR	85	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000819251091	FG	On-Demand	Anodyne	NMBR	43	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000819251091	FG	On-Demand	Anodyne	MC5R	35	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000819251091	FG	On-Demand	Anodyne	GRPR	42	30
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000819251091	FG	On-Demand	Anodyne	CCKBR	79	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000819251091	FG	On-Demand	Anodyne	GHSR	48	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000819251091	FG	On-Demand	Anodyne	AANAT	43	30
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000819251092	FG	On-Demand	Anodyne	SSTR2	46	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000819251092	FG	On-Demand	Anodyne	MC4R	19	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000819251092	FG	On-Demand	Anodyne	CCKAR	85	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000819251092	FG	On-Demand	Anodyne	NMBR	43	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000819251092	FG	On-Demand	Anodyne	MC5R	35	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000819251092	FG	On-Demand	Anodyne	GRPR	42	30
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000819251092	FG	On-Demand	Anodyne	CCKBR	79	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000819251092	FG	On-Demand	Anodyne	GHSR	48	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCc1c[nH]c3ccccc13)C2	ZINC000819251092	FG	On-Demand	Anodyne	AANAT	43	30
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819251094	EH	On-Demand	Anodyne	ADRB2	48	48
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819251094	EH	On-Demand	Anodyne	ADRB1	50	49
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819251094	EH	On-Demand	Anodyne	ADRB3	75	49
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819251095	EH	On-Demand	Anodyne	ADRB2	48	48
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819251095	EH	On-Demand	Anodyne	ADRB1	50	49
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819251095	EH	On-Demand	Anodyne	ADRB3	75	49
Cc1cc(C(F)(F)F)ccc1CNC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819251105	GG	On-Demand	Anodyne	CCR2	39	47
Cc1cc(C(F)(F)F)ccc1CNC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819251106	GG	On-Demand	Anodyne	CCR2	39	47
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819251108	FI	On-Demand	Anodyne	HTR1A	15	44
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819251108	FI	On-Demand	Anodyne	DRD2	20	42
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819251108	FI	On-Demand	Anodyne	HTR1D	22	42
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819251108	FI	On-Demand	Anodyne	HTR1B	25	42
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819251108	FI	On-Demand	Anodyne	HTR2C	15	42
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819251108	FI	On-Demand	Anodyne	OPRK1	20	48
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819251108	FI	On-Demand	Anodyne	KCNQ2	79	54
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819251108	FI	On-Demand	Anodyne	NPY2R	99	58
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819251108	FI	On-Demand	Anodyne	TAAR1	36	47
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819251108	FI	On-Demand	Anodyne	IMDH_CRYPV	36	41
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819251108	FI	On-Demand	Anodyne	RORC	31	41
Cc1nc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cs1	ZINC000819251114	FG	On-Demand	Mild	PAPA1_CARPA	40	44
Cc1nc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cs1	ZINC000819251116	FG	On-Demand	Mild	PAPA1_CARPA	40	44
COc1ccc(NC(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)c(C(=O)NC2CC2)c1	ZINC000819251134	FH	On-Demand	Anodyne	MAPK11	17	42
COc1ccc(NC(=O)[C@H]2C[C@H]2c2ccc(C)cc2)c(C(=O)NC2CC2)c1	ZINC000819251135	FH	On-Demand	Anodyne	MAPK11	17	42
COc1ccc(NC(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)c(C(=O)NC2CC2)c1	ZINC000819251136	FH	On-Demand	Anodyne	MAPK11	17	42
COc1cccc([S@@](=O)CC(=O)NCC[S@@](C)=O)c1	ZINC000819251141	DC	On-Demand	Anodyne	DRD4	44	34
COc1cccc([S@@](=O)CC(=O)NCC[S@@](C)=O)c1	ZINC000819251141	DC	On-Demand	Anodyne	MTNR1A	71	43
COc1cccc([S@@](=O)CC(=O)NCC[S@@](C)=O)c1	ZINC000819251141	DC	On-Demand	Anodyne	MTNR1B	63	43
COc1cccc([S@@](=O)CC(=O)NCC[S@](C)=O)c1	ZINC000819251142	DC	On-Demand	Anodyne	DRD4	44	34
COc1cccc([S@@](=O)CC(=O)NCC[S@](C)=O)c1	ZINC000819251142	DC	On-Demand	Anodyne	MTNR1A	71	43
COc1cccc([S@@](=O)CC(=O)NCC[S@](C)=O)c1	ZINC000819251142	DC	On-Demand	Anodyne	MTNR1B	63	43
O[C@@H](CNCCN1CCCOCC1)c1ccc(Cl)cc1Cl	ZINC000819251145	EE	On-Demand	Anodyne	CCR4	16	40
O[C@H](CNCCN1CCCOCC1)c1ccc(Cl)cc1Cl	ZINC000819251146	EE	On-Demand	Anodyne	CCR4	16	40
CC(=O)Nc1cccc(CC(=O)NCC[S@](C)=O)c1	ZINC000819251170	CC	On-Demand	Anodyne	KCNK3	66	33
CC(=O)Nc1cccc(CC(=O)NCC[S@](C)=O)c1	ZINC000819251170	CC	On-Demand	Anodyne	KCNK9	43	33
CC(=O)Nc1cccc(CC(=O)NCC[S@@](C)=O)c1	ZINC000819251171	CC	On-Demand	Anodyne	KCNK3	66	33
CC(=O)Nc1cccc(CC(=O)NCC[S@@](C)=O)c1	ZINC000819251171	CC	On-Demand	Anodyne	KCNK9	43	33
CSc1nnc(CNC[C@@H](O)c2cccnc2)s1	ZINC000819251172	CD	On-Demand	Anodyne	ADRB2	20	42
CSc1nnc(CNC[C@@H](O)c2cccnc2)s1	ZINC000819251172	CD	On-Demand	Anodyne	ADRB1	22	43
CSc1nnc(CNC[C@@H](O)c2cccnc2)s1	ZINC000819251172	CD	On-Demand	Anodyne	ADRB3	87	43
CSc1nnc(CNC[C@H](O)c2cccnc2)s1	ZINC000819251173	CD	On-Demand	Anodyne	ADRB2	20	42
CSc1nnc(CNC[C@H](O)c2cccnc2)s1	ZINC000819251173	CD	On-Demand	Anodyne	ADRB1	22	43
CSc1nnc(CNC[C@H](O)c2cccnc2)s1	ZINC000819251173	CD	On-Demand	Anodyne	ADRB3	87	43
Cc1nc(CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n[nH]1	ZINC000819251182	FD	On-Demand	Mild	PAPA1_CARPA	43	48
Cc1nc(CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n[nH]1	ZINC000819251183	FD	On-Demand	Mild	PAPA1_CARPA	43	48
O[C@@H](CNCCN1CCCOCC1)c1cccc(C(F)(F)F)c1	ZINC000819251187	EE	On-Demand	Anodyne	CASR	40	46
O[C@H](CNCCN1CCCOCC1)c1cccc(C(F)(F)F)c1	ZINC000819251188	EE	On-Demand	Anodyne	CASR	40	46
N#Cc1cccnc1OC1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819251209	FH	On-Demand	Mild	ADRB1	29	44
N#Cc1cccnc1OC1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819251209	FH	On-Demand	Mild	ADRB3	43	44
N#Cc1cccnc1OC1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819251209	FH	On-Demand	Mild	CYP3A4	44	34
N#Cc1cccnc1OC1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819251210	FH	On-Demand	Mild	ADRB1	29	44
N#Cc1cccnc1OC1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819251210	FH	On-Demand	Mild	ADRB3	43	44
N#Cc1cccnc1OC1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819251210	FH	On-Demand	Mild	CYP3A4	44	34
CSc1nnc(CNC[C@H](O)c2cccc(Cl)c2)s1	ZINC000819251224	DF	On-Demand	Anodyne	ADRB1	29	42
CSc1nnc(CNC[C@H](O)c2cccc(Cl)c2)s1	ZINC000819251224	DF	On-Demand	Anodyne	ADRB3	43	42
CSc1nnc(CNC[C@@H](O)c2cccc(Cl)c2)s1	ZINC000819251225	DF	On-Demand	Anodyne	ADRB1	29	42
CSc1nnc(CNC[C@@H](O)c2cccc(Cl)c2)s1	ZINC000819251225	DF	On-Demand	Anodyne	ADRB3	43	42
CSc1nnc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000819251231	GE	On-Demand	Anodyne	GPR119	29	43
CSc1nnc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000819251232	GE	On-Demand	Anodyne	GPR119	29	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(F)c(F)c2)cc1	ZINC000819251240	FE	On-Demand	Anodyne	ADRB2	78	47
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(F)c(F)c2)cc1	ZINC000819251240	FE	On-Demand	Anodyne	ADRB1	73	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(F)c(F)c2)cc1	ZINC000819251240	FE	On-Demand	Anodyne	ADRB3	154	47
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc(F)c(F)c2)cc1	ZINC000819251240	FE	On-Demand	Anodyne	TBXA2R	27	40
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(F)c(F)c2)cc1	ZINC000819251241	FE	On-Demand	Anodyne	ADRB2	78	47
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(F)c(F)c2)cc1	ZINC000819251241	FE	On-Demand	Anodyne	ADRB1	73	42
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(F)c(F)c2)cc1	ZINC000819251241	FE	On-Demand	Anodyne	ADRB3	154	47
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc(F)c(F)c2)cc1	ZINC000819251241	FE	On-Demand	Anodyne	TBXA2R	27	40
CN(C)CCc1ccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819251252	GH	On-Demand	Anodyne	ADRB2	25	40
CN(C)CCc1ccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819251252	GH	On-Demand	Anodyne	ADRB3	19	47
CN(C)CCc1ccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819251253	GH	On-Demand	Anodyne	ADRB2	25	40
CN(C)CCc1ccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819251253	GH	On-Demand	Anodyne	ADRB3	19	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(-c3nn[nH]n3)cc1)C2	ZINC000819251273	FD	On-Demand	Anodyne	VHL	58	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(-c3nn[nH]n3)cc1)C2	ZINC000819251274	FD	On-Demand	Anodyne	VHL	58	33
Cc1cc(C(F)(F)F)ccc1CNC[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819251278	GG	On-Demand	Anodyne	CCR2	41	46
Cc1cc(C(F)(F)F)ccc1CNC[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819251279	GG	On-Demand	Anodyne	CCR2	41	46
O[C@@H](CNCCc1ccc(F)c(F)c1)c1cccnc1	ZINC000819251291	CE	On-Demand	Anodyne	ADRB2	61	57
O[C@@H](CNCCc1ccc(F)c(F)c1)c1cccnc1	ZINC000819251291	CE	On-Demand	Anodyne	ADRB1	70	64
O[C@@H](CNCCc1ccc(F)c(F)c1)c1cccnc1	ZINC000819251291	CE	On-Demand	Anodyne	ADRB3	169	64
O[C@@H](CNCCc1ccc(F)c(F)c1)c1cccnc1	ZINC000819251291	CE	On-Demand	Anodyne	CYP51A1	17	41
O[C@H](CNCCc1ccc(F)c(F)c1)c1cccnc1	ZINC000819251292	CE	On-Demand	Anodyne	ADRB2	61	57
O[C@H](CNCCc1ccc(F)c(F)c1)c1cccnc1	ZINC000819251292	CE	On-Demand	Anodyne	ADRB1	70	64
O[C@H](CNCCc1ccc(F)c(F)c1)c1cccnc1	ZINC000819251292	CE	On-Demand	Anodyne	ADRB3	169	64
O[C@H](CNCCc1ccc(F)c(F)c1)c1cccnc1	ZINC000819251292	CE	On-Demand	Anodyne	CYP51A1	17	41
Cc1cc(F)ccc1[C@@H](O)CNCc1ccc(CCN(C)C)cc1	ZINC000819251313	EG	On-Demand	Anodyne	LEF	54	34
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819251324	EH	On-Demand	Anodyne	ADRB2	41	45
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819251324	EH	On-Demand	Anodyne	ADRB1	39	43
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819251324	EH	On-Demand	Anodyne	ADRB3	67	43
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819251325	EH	On-Demand	Anodyne	ADRB2	41	45
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819251325	EH	On-Demand	Anodyne	ADRB1	39	43
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819251325	EH	On-Demand	Anodyne	ADRB3	67	43
C[S@@](=O)CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819251420	ED	On-Demand	Mild	PAPA1_CARPA	48	57
C[S@@](=O)CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819251420	ED	On-Demand	Mild	CTSK	17	54
C[S@@](=O)CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819251421	ED	On-Demand	Mild	PAPA1_CARPA	48	57
C[S@@](=O)CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819251421	ED	On-Demand	Mild	CTSK	17	54
Cc1ccc2c(c1)[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819251440	FH	On-Demand	Mild	PAPA1_CARPA	38	40
Cc1ccc2c(c1)[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819251441	FH	On-Demand	Mild	PAPA1_CARPA	38	40
Cc1ccc2c(c1)[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819251442	FH	On-Demand	Mild	PAPA1_CARPA	38	40
Cc1ccc2c(c1)[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819251443	FH	On-Demand	Mild	PAPA1_CARPA	38	40
C#CCNC(=O)CCNCc1ccc(OCCCC)c(Cl)c1	ZINC000819251447	DF	On-Demand	Mild	LPAR2	60	55
C#CCNC(=O)CCNCc1ccc(OCCCC)c(Cl)c1	ZINC000819251447	DF	On-Demand	Mild	S1PR3	17	55
C#CCNC(=O)CCNCc1ccc(OCCCC)c(Cl)c1	ZINC000819251447	DF	On-Demand	Mild	S1PR2	63	55
CN(C)CCc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819251451	EG	On-Demand	Anodyne	ADRB2	39	41
CN(C)CCc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819251451	EG	On-Demand	Anodyne	ADRB1	47	52
CN(C)CCc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819251451	EG	On-Demand	Anodyne	ADRB3	64	52
CN(C)CCc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819251454	EG	On-Demand	Anodyne	ADRB2	39	41
CN(C)CCc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819251454	EG	On-Demand	Anodyne	ADRB1	47	52
CN(C)CCc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819251454	EG	On-Demand	Anodyne	ADRB3	64	52
Cc1cc(C(F)(F)F)ccc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819251484	FH	On-Demand	Bother	CACNA1D	45	37
Cc1cc(C(F)(F)F)ccc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819251484	FH	On-Demand	Bother	CCR2	39	45
O=[N+]([O-])c1ccc([C@@H](O)CNCCN2CCCOCC2)cc1	ZINC000819251492	DC	On-Demand	Bother	KCNJ1	29	45
O=[N+]([O-])c1ccc([C@H](O)CNCCN2CCCOCC2)cc1	ZINC000819251493	DC	On-Demand	Bother	KCNJ1	29	45
Cc1cc(C(F)(F)F)ccc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819251494	FH	On-Demand	Bother	CACNA1D	45	37
Cc1cc(C(F)(F)F)ccc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819251494	FH	On-Demand	Bother	CCR2	39	45
Cc1ccccc1[C@@H](O)CNCCN1CCCOCC1	ZINC000819251495	CD	On-Demand	Anodyne	HNMT	43	32
O[C@@H](CNCCN1CCCOCC1)c1cccc(Br)c1	ZINC000819251523	ED	On-Demand	Anodyne	CASR	46	35
O[C@H](CNCCN1CCCOCC1)c1cccc(Br)c1	ZINC000819251524	ED	On-Demand	Anodyne	CASR	46	35
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819251530	GE	On-Demand	Anodyne	CACNA1I	22	42
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819251530	GE	On-Demand	Anodyne	GPR119	24	45
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819251534	GE	On-Demand	Anodyne	CACNA1I	22	42
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819251534	GE	On-Demand	Anodyne	GPR119	24	45
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)Cc1nsc2ccccc12	ZINC000819251546	GG	On-Demand	Anodyne	HTR1A	16	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)Cc1nsc2ccccc12	ZINC000819251546	GG	On-Demand	Anodyne	DRD2	31	40
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)Cc1nsc2ccccc12	ZINC000819251547	GG	On-Demand	Anodyne	HTR1A	16	40
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)Cc1nsc2ccccc12	ZINC000819251547	GG	On-Demand	Anodyne	DRD2	31	40
CN(C)CCc1ccc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819251554	GE	On-Demand	Anodyne	ADRB2	18	43
CN(C)CCc1ccc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819251554	GE	On-Demand	Anodyne	ADRB3	41	38
CN(C)CCc1ccc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819251555	GE	On-Demand	Anodyne	ADRB2	18	43
CN(C)CCc1ccc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819251555	GE	On-Demand	Anodyne	ADRB3	41	38
COc1cccc([S@@](=O)CC(=O)NC[C@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819251556	GE	On-Demand	Anodyne	DRD4	40	31
COc1cccc([S@@](=O)CC(=O)NC[C@@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819251559	GE	On-Demand	Anodyne	DRD4	40	31
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cc1Cl	ZINC000819251570	EH	On-Demand	Anodyne	ADRB2	51	38
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cc1Cl	ZINC000819251570	EH	On-Demand	Anodyne	ADRB1	45	44
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cc1Cl	ZINC000819251570	EH	On-Demand	Anodyne	ADRB3	38	44
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cc1Cl	ZINC000819251571	EH	On-Demand	Anodyne	ADRB2	51	38
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cc1Cl	ZINC000819251571	EH	On-Demand	Anodyne	ADRB1	45	44
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cc1Cl	ZINC000819251571	EH	On-Demand	Anodyne	ADRB3	38	44
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)c(Br)c1	ZINC000819251580	FH	On-Demand	Anodyne	ADRB2	50	50
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)c(Br)c1	ZINC000819251580	FH	On-Demand	Anodyne	ADRB1	47	45
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)c(Br)c1	ZINC000819251580	FH	On-Demand	Anodyne	ADRB3	71	45
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)c(Br)c1	ZINC000819251581	FH	On-Demand	Anodyne	ADRB2	50	50
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)c(Br)c1	ZINC000819251581	FH	On-Demand	Anodyne	ADRB1	47	45
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)c(Br)c1	ZINC000819251581	FH	On-Demand	Anodyne	ADRB3	71	45
Cc1ccccc1[C@@H](O)CNCCc1ccc(F)c(F)c1	ZINC000819251590	CG	On-Demand	Anodyne	ADRB2	68	38
Cc1ccccc1[C@@H](O)CNCCc1ccc(F)c(F)c1	ZINC000819251590	CG	On-Demand	Anodyne	ADRB1	61	43
Cc1ccccc1[C@@H](O)CNCCc1ccc(F)c(F)c1	ZINC000819251590	CG	On-Demand	Anodyne	ADRB3	65	42
Cc1ccccc1[C@@H](O)CNCCc1ccc(F)c(F)c1	ZINC000819251590	CG	On-Demand	Anodyne	LEF	49	32
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccccc1Cl	ZINC000819251600	DG	On-Demand	Anodyne	ADRB2	62	43
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccccc1Cl	ZINC000819251600	DG	On-Demand	Anodyne	ADRB1	59	47
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccccc1Cl	ZINC000819251600	DG	On-Demand	Anodyne	ADRB3	61	47
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccccc1Cl	ZINC000819251601	DG	On-Demand	Anodyne	ADRB2	62	43
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccccc1Cl	ZINC000819251601	DG	On-Demand	Anodyne	ADRB1	59	47
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccccc1Cl	ZINC000819251601	DG	On-Demand	Anodyne	ADRB3	61	47
O[C@@H](CNCC1(c2cc(C(F)(F)F)ccc2Cl)CC1)c1cccnc1	ZINC000819251606	FI	On-Demand	Anodyne	ADRB3	58	38
O[C@H](CNCC1(c2cc(C(F)(F)F)ccc2Cl)CC1)c1cccnc1	ZINC000819251607	FI	On-Demand	Anodyne	ADRB3	58	38
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](N2CCCC2)C1	ZINC000819251612	CD	On-Demand	Anodyne	L3MBTL3	58	40
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H](N2CCCC2)C1	ZINC000819251614	CD	On-Demand	Anodyne	L3MBTL3	58	40
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](N2CCCC2)C1	ZINC000819251619	CD	On-Demand	Anodyne	L3MBTL3	58	40
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](N2CCCC2)C1	ZINC000819251621	CD	On-Demand	Anodyne	L3MBTL3	58	40
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cc1F	ZINC000819251627	DG	On-Demand	Anodyne	ADRB2	59	42
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cc1F	ZINC000819251627	DG	On-Demand	Anodyne	ADRB1	49	43
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cc1F	ZINC000819251627	DG	On-Demand	Anodyne	ADRB3	49	43
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cc1F	ZINC000819251628	DG	On-Demand	Anodyne	ADRB2	59	42
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cc1F	ZINC000819251628	DG	On-Demand	Anodyne	ADRB1	49	43
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cc1F	ZINC000819251628	DG	On-Demand	Anodyne	ADRB3	49	43
CN(C)CCc1ccc(CNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819251633	EF	On-Demand	Anodyne	LEF	45	34
CN(C)CCc1ccc(CNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819251638	EF	On-Demand	Anodyne	LEF	45	34
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](N2CCCCC2)C1	ZINC000819251646	CD	On-Demand	Anodyne	L3MBTL3	84	46
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](N2CCCCC2)C1	ZINC000819251648	CD	On-Demand	Anodyne	L3MBTL3	84	46
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](N2CCCCC2)C1	ZINC000819251649	CD	On-Demand	Anodyne	L3MBTL3	84	46
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](N2CCCCC2)C1	ZINC000819251651	CD	On-Demand	Anodyne	L3MBTL3	84	46
O[C@@H](CNCCN1CCCOCC1)c1cccc(F)c1	ZINC000819251654	CD	On-Demand	Anodyne	ADRB1	16	41
O[C@@H](CNCCN1CCCOCC1)c1cccc(F)c1	ZINC000819251654	CD	On-Demand	Anodyne	ADRB3	25	41
O[C@@H](CNCCN1CCCOCC1)c1cccc(F)c1	ZINC000819251654	CD	On-Demand	Anodyne	CASR	46	38
O[C@H](CNCCN1CCCOCC1)c1cccc(F)c1	ZINC000819251655	CD	On-Demand	Anodyne	ADRB1	16	41
O[C@H](CNCCN1CCCOCC1)c1cccc(F)c1	ZINC000819251655	CD	On-Demand	Anodyne	ADRB3	25	41
O[C@H](CNCCN1CCCOCC1)c1cccc(F)c1	ZINC000819251655	CD	On-Demand	Anodyne	CASR	46	38
Cc1oc(-c2ccccc2)nc1CC(=O)n1ccccc1=NC(C)C	ZINC000819251660	EH	On-Demand	Anodyne	PPARG	77	46
Cc1oc(-c2ccccc2)nc1CC(=O)n1ccccc1=NC(C)C	ZINC000819251660	EH	On-Demand	Anodyne	PPARA	84	45
Cc1oc(-c2ccccc2)nc1CC(=O)n1ccccc1=NC(C)C	ZINC000819251660	EH	On-Demand	Anodyne	PDE8B	60	35
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1cc2ccccc2o1	ZINC000819251672	GI	On-Demand	Anodyne	GPR119	41	47
CS(=O)(=O)c1ccc([C@@H](O)CNCCN2CCCOCC2)cc1	ZINC000819251673	EC	On-Demand	Anodyne	ADRB2	26	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCN2CCCOCC2)cc1	ZINC000819251673	EC	On-Demand	Anodyne	ADRB3	50	37
CS(=O)(=O)c1ccc([C@H](O)CNCCN2CCCOCC2)cc1	ZINC000819251675	EC	On-Demand	Anodyne	ADRB2	26	40
CS(=O)(=O)c1ccc([C@H](O)CNCCN2CCCOCC2)cc1	ZINC000819251675	EC	On-Demand	Anodyne	ADRB3	50	37
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1cc2ccccc2o1	ZINC000819251679	GI	On-Demand	Anodyne	GPR119	41	47
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CC[C@@H](Cc3ccccc3)C2)cc1	ZINC000819251680	FG	On-Demand	Anodyne	ADRB3	39	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CC[C@@H](Cc3ccccc3)C2)cc1	ZINC000819251681	FG	On-Demand	Anodyne	ADRB3	39	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CC[C@H](Cc3ccccc3)C2)cc1	ZINC000819251683	FG	On-Demand	Anodyne	ADRB3	39	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CC[C@H](Cc3ccccc3)C2)cc1	ZINC000819251685	FG	On-Demand	Anodyne	ADRB3	39	41
O[C@@H](CNCCc1ccc(F)c(F)c1)c1cccc(Br)c1	ZINC000819251701	FH	On-Demand	Anodyne	ADRB2	59	48
O[C@@H](CNCCc1ccc(F)c(F)c1)c1cccc(Br)c1	ZINC000819251701	FH	On-Demand	Anodyne	ADRB1	63	51
O[C@@H](CNCCc1ccc(F)c(F)c1)c1cccc(Br)c1	ZINC000819251701	FH	On-Demand	Anodyne	ADRB3	109	51
O[C@H](CNCCc1ccc(F)c(F)c1)c1cccc(Br)c1	ZINC000819251703	FH	On-Demand	Anodyne	ADRB2	59	48
O[C@H](CNCCc1ccc(F)c(F)c1)c1cccc(Br)c1	ZINC000819251703	FH	On-Demand	Anodyne	ADRB1	63	51
O[C@H](CNCCc1ccc(F)c(F)c1)c1cccc(Br)c1	ZINC000819251703	FH	On-Demand	Anodyne	ADRB3	109	51
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccccc1	ZINC000819251712	CF	On-Demand	Anodyne	ADRB2	82	62
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccccc1	ZINC000819251712	CF	On-Demand	Anodyne	ADRB1	92	53
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccccc1	ZINC000819251712	CF	On-Demand	Anodyne	ADRB3	146	53
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccccc1	ZINC000819251714	CF	On-Demand	Anodyne	ADRB2	82	62
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccccc1	ZINC000819251714	CF	On-Demand	Anodyne	ADRB1	92	53
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccccc1	ZINC000819251714	CF	On-Demand	Anodyne	ADRB3	146	53
CC(=O)Nc1cccc(CC(=O)N2CC[C@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000819251743	FE	On-Demand	Anodyne	CMA1	19	40
CC(=O)Nc1cccc(CC(=O)N2CC[C@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000819251743	FE	On-Demand	Anodyne	EPHX2	24	41
CC(=O)Nc1cccc(CC(=O)N2CC[C@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000819251743	FE	On-Demand	Anodyne	GPR119	18	40
CC(=O)Nc1cccc(CC(=O)N2CC[C@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000819251743	FE	On-Demand	Anodyne	SFRP1	41	35
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000819251745	FE	On-Demand	Anodyne	CMA1	19	40
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000819251745	FE	On-Demand	Anodyne	EPHX2	24	41
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000819251745	FE	On-Demand	Anodyne	GPR119	18	40
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000819251745	FE	On-Demand	Anodyne	SFRP1	41	35
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(F)c(F)c1	ZINC000819251746	DG	On-Demand	Anodyne	ADRB2	54	40
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(F)c(F)c1	ZINC000819251746	DG	On-Demand	Anodyne	ADRB1	44	44
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(F)c(F)c1	ZINC000819251746	DG	On-Demand	Anodyne	ADRB3	41	39
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc(F)c(F)c1	ZINC000819251746	DG	On-Demand	Anodyne	LEF	65	36
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccccc1Br	ZINC000819251751	FH	On-Demand	Anodyne	ADRB2	58	38
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccccc1Br	ZINC000819251751	FH	On-Demand	Anodyne	ADRB1	52	42
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccccc1Br	ZINC000819251751	FH	On-Demand	Anodyne	ADRB3	62	42
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccccc1Br	ZINC000819251753	FH	On-Demand	Anodyne	ADRB2	58	38
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccccc1Br	ZINC000819251753	FH	On-Demand	Anodyne	ADRB1	52	42
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccccc1Br	ZINC000819251753	FH	On-Demand	Anodyne	ADRB3	62	42
COc1ccc(OC)c([C@H](O)CNCCN2CCCOCC2)c1	ZINC000819251769	DD	On-Demand	Anodyne	DRD4	40	32
CN(C)CCc1ccc(CNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819251772	EG	On-Demand	Anodyne	ADRB2	15	42
CN(C)CCc1ccc(CNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819251772	EG	On-Demand	Anodyne	ADRB1	16	41
CN(C)CCc1ccc(CNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819251772	EG	On-Demand	Anodyne	ADRB3	21	41
CN(C)CCc1ccc(CNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819251772	EG	On-Demand	Anodyne	UL54	43	35
CN(C)CCc1ccc(CNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819251772	EG	On-Demand	Anodyne	UTS2	45	36
Cc1cc(C(F)(F)F)ccc1CNC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819251804	GG	On-Demand	Anodyne	CCR2	44	53
Cc1cc(C(F)(F)F)ccc1CNC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819251806	GG	On-Demand	Anodyne	CCR2	44	53
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819251826	EH	On-Demand	Anodyne	ADRB2	51	37
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819251826	EH	On-Demand	Anodyne	ADRB1	49	44
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819251826	EH	On-Demand	Anodyne	ADRB3	67	44
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819251827	EH	On-Demand	Anodyne	ADRB2	51	37
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819251827	EH	On-Demand	Anodyne	ADRB1	49	44
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819251827	EH	On-Demand	Anodyne	ADRB3	67	44
C=CCCn1cc(C(=O)Nc2ccc(N3CCCC3)c(Cl)c2)nn1	ZINC000819251829	EG	On-Demand	Mild	CNR1	49	30
C=CCCn1cc(C(=O)Nc2ccc(N3CCCC3)c(Cl)c2)nn1	ZINC000819251829	EG	On-Demand	Mild	NPY2R	49	39
O[C@@H](CN[C@H]1CCOc2c(F)cccc21)c1cccc(Cl)c1	ZINC000819251830	DH	On-Demand	Anodyne	ADRB3	39	41
O[C@@H](CN[C@H]1CCOc2c(F)cccc21)c1cccc(Cl)c1	ZINC000819251830	DH	On-Demand	Anodyne	CYP3A4	41	33
O[C@H](CN[C@H]1CCOc2c(F)cccc21)c1cccc(Cl)c1	ZINC000819251831	DH	On-Demand	Anodyne	ADRB3	39	41
O[C@H](CN[C@H]1CCOc2c(F)cccc21)c1cccc(Cl)c1	ZINC000819251831	DH	On-Demand	Anodyne	CYP3A4	41	33
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000819251832	CF	On-Demand	Anodyne	ADRB2	67	55
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000819251832	CF	On-Demand	Anodyne	ADRB1	63	45
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000819251832	CF	On-Demand	Anodyne	ADRB3	91	45
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000819251833	CF	On-Demand	Anodyne	ADRB2	67	55
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000819251833	CF	On-Demand	Anodyne	ADRB1	63	45
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)cc1	ZINC000819251833	CF	On-Demand	Anodyne	ADRB3	91	45
CN(C)CCc1ccc(CNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819251836	DF	On-Demand	Anodyne	ADRB2	18	42
CN(C)CCc1ccc(CNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819251837	DF	On-Demand	Anodyne	ADRB2	18	42
CN(C)CCc1ccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819251864	FH	On-Demand	Anodyne	CCR2	23	40
CN(C)CCc1ccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819251865	FH	On-Demand	Anodyne	CCR2	23	40
CCc1nc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cs1	ZINC000819251877	FF	On-Demand	Mild	PAPA1_CARPA	45	50
CCc1nc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cs1	ZINC000819251879	FF	On-Demand	Mild	PAPA1_CARPA	45	50
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2ccc(F)c(F)c2)CC1	ZINC000819251881	GG	On-Demand	Anodyne	GPR119	54	51
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2ccc(F)c(F)c2)CC1	ZINC000819251883	GG	On-Demand	Anodyne	GPR119	54	51
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(N2CCCC2)c(Cl)c1	ZINC000819251921	DH	On-Demand	Anodyne	NPY2R	62	47
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(N2CCCC2)c(Cl)c1	ZINC000819251922	DH	On-Demand	Anodyne	NPY2R	62	47
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(N2CCCC2)c(Cl)c1	ZINC000819251923	DH	On-Demand	Anodyne	NPY2R	62	47
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(N2CCCC2)c(Cl)c1	ZINC000819251926	DH	On-Demand	Anodyne	NPY2R	62	47
CC[C@@](C)(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819251936	FI	On-Demand	Mild	PAPA1_CARPA	69	52
CC[C@@](C)(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819251936	FI	On-Demand	Mild	CTSK	33	46
CC[C@@](C)(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819251936	FI	On-Demand	Mild	CTSL	21	52
CC[C@@](C)(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819251936	FI	On-Demand	Mild	TACR3	15	43
CC[C@@](C)(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819251936	FI	On-Demand	Mild	REN	40	39
CC[C@@](C)(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819251936	FI	On-Demand	Mild	CTSS	18	55
CC[C@@](C)(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819251936	FI	On-Demand	Mild	FPR1	50	43
CC[C@@](C)(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819251936	FI	On-Demand	Mild	CTRB_BOVIN	55	39
CC[C@@](C)(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819251939	FI	On-Demand	Mild	PAPA1_CARPA	69	52
CC[C@@](C)(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819251939	FI	On-Demand	Mild	CTSK	33	46
CC[C@@](C)(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819251939	FI	On-Demand	Mild	CTSL	21	52
CC[C@@](C)(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819251939	FI	On-Demand	Mild	TACR3	15	43
CC[C@@](C)(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819251939	FI	On-Demand	Mild	REN	40	39
CC[C@@](C)(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819251939	FI	On-Demand	Mild	CTSS	18	55
CC[C@@](C)(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819251939	FI	On-Demand	Mild	FPR1	50	43
CC[C@@](C)(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819251939	FI	On-Demand	Mild	CTRB_BOVIN	55	39
CCOC(=O)Nc1ccc(OC(=O)/C=C\[C@H]2CCCO2)cc1	ZINC000819251944	DF	On-Demand	Anodyne	ACR	43	36
CCOC(=O)Nc1ccc(OC(=O)/C=C/[C@@H]2CCCO2)cc1	ZINC000819251946	DF	On-Demand	Anodyne	ACR	43	36
CN1CCC(C#N)(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819251971	FD	On-Demand	Mild	PAPA1_CARPA	37	46
CN1CCC(C#N)(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819251971	FD	On-Demand	Mild	CTSK	15	43
CN1CCC(C#N)(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819251972	FD	On-Demand	Mild	PAPA1_CARPA	37	46
CN1CCC(C#N)(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819251972	FD	On-Demand	Mild	CTSK	15	43
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CC[C@@H](Cc2ccccc2)C1	ZINC000819251984	FG	On-Demand	Anodyne	PGC	45	35
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CC[C@@H](Cc2ccccc2)C1	ZINC000819251984	FG	On-Demand	Anodyne	REN	47	40
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CC[C@@H](Cc2ccccc2)C1	ZINC000819251984	FG	On-Demand	Anodyne	FPR1	44	37
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CC[C@@H](Cc2ccccc2)C1	ZINC000819251985	FG	On-Demand	Anodyne	PGC	45	35
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CC[C@@H](Cc2ccccc2)C1	ZINC000819251985	FG	On-Demand	Anodyne	REN	47	40
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CC[C@@H](Cc2ccccc2)C1	ZINC000819251985	FG	On-Demand	Anodyne	FPR1	44	37
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CC[C@H](Cc2ccccc2)C1	ZINC000819251986	FG	On-Demand	Anodyne	PGC	45	35
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CC[C@H](Cc2ccccc2)C1	ZINC000819251986	FG	On-Demand	Anodyne	REN	47	40
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CC[C@H](Cc2ccccc2)C1	ZINC000819251986	FG	On-Demand	Anodyne	FPR1	44	37
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CC[C@H](Cc2ccccc2)C1	ZINC000819251987	FG	On-Demand	Anodyne	PGC	45	35
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CC[C@H](Cc2ccccc2)C1	ZINC000819251987	FG	On-Demand	Anodyne	REN	47	40
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CC[C@H](Cc2ccccc2)C1	ZINC000819251987	FG	On-Demand	Anodyne	FPR1	44	37
CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)c2coc(=O)c3ccccc23)C1	ZINC000819251995	FF	On-Demand	Anodyne	INHA	40	34
CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)c2coc(=O)c3ccccc23)C1	ZINC000819251995	FF	On-Demand	Anodyne	CCR8	71	36
C[S@](=O)CCNC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819252001	FE	On-Demand	Anodyne	CNR1	54	33
C[S@@](=O)CCNC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819252002	FE	On-Demand	Anodyne	CNR1	54	33
CCOC(=O)Nc1ccc(OC(=O)/C=C/[C@H]2CCCO2)cc1	ZINC000819252012	DF	On-Demand	Anodyne	ACR	43	36
CCOC(=O)Nc1ccc(OC(=O)/C=C\[C@@H]2CCCO2)cc1	ZINC000819252013	DF	On-Demand	Anodyne	ACR	43	36
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(OC(F)(F)F)cc1	ZINC000819252018	FH	On-Demand	Anodyne	ADRB2	61	47
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(OC(F)(F)F)cc1	ZINC000819252018	FH	On-Demand	Anodyne	ADRB1	66	45
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(OC(F)(F)F)cc1	ZINC000819252018	FH	On-Demand	Anodyne	ADRB3	84	51
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(OC(F)(F)F)cc1	ZINC000819252019	FH	On-Demand	Anodyne	ADRB2	61	47
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(OC(F)(F)F)cc1	ZINC000819252019	FH	On-Demand	Anodyne	ADRB1	66	45
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(OC(F)(F)F)cc1	ZINC000819252019	FH	On-Demand	Anodyne	ADRB3	84	51
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819252024	GH	On-Demand	Anodyne	DRD4	50	42
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819252024	GH	On-Demand	Anodyne	KCNQ2	60	44
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819252024	GH	On-Demand	Anodyne	NPY2R	80	51
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819252024	GH	On-Demand	Anodyne	MTNR1B	26	40
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819252024	GH	On-Demand	Anodyne	GALR2	17	41
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819252024	GH	On-Demand	Anodyne	MCHR1	17	42
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819252024	GH	On-Demand	Anodyne	TAAR1	47	46
CC(=O)Nc1cccc(CC(=O)NC[C@@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819252026	GF	On-Demand	Anodyne	CMA1	34	40
CC(=O)Nc1cccc(CC(=O)NC[C@@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819252026	GF	On-Demand	Anodyne	CCR3	29	42
CC(=O)Nc1cccc(CC(=O)NC[C@@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819252026	GF	On-Demand	Anodyne	DPP4	15	41
CC(=O)Nc1cccc(CC(=O)NC[C@@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819252026	GF	On-Demand	Anodyne	GPR119	16	44
CC(=O)Nc1cccc(CC(=O)NC[C@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819252028	GF	On-Demand	Anodyne	CMA1	34	40
CC(=O)Nc1cccc(CC(=O)NC[C@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819252028	GF	On-Demand	Anodyne	CCR3	29	42
CC(=O)Nc1cccc(CC(=O)NC[C@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819252028	GF	On-Demand	Anodyne	DPP4	15	41
CC(=O)Nc1cccc(CC(=O)NC[C@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819252028	GF	On-Demand	Anodyne	GPR119	16	44
Cc1cc(C(F)(F)F)ccc1CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819252044	GG	On-Demand	Anodyne	TRPV1	58	33
Cc1cc(C(F)(F)F)ccc1CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819252044	GG	On-Demand	Anodyne	CCR2	39	48
Cc1cc(C(F)(F)F)ccc1CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819252046	GG	On-Demand	Anodyne	TRPV1	58	33
Cc1cc(C(F)(F)F)ccc1CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819252046	GG	On-Demand	Anodyne	CCR2	39	48
Cc1cc(C(F)(F)F)ccc1CNCCS(=O)(=O)CC(=O)OC(C)(C)C	ZINC000819252065	GF	On-Demand	Anodyne	CCR2	32	42
CON(C)C(=O)CCNCc1ccc(C(F)(F)F)cc1C	ZINC000819252118	DF	On-Demand	Anodyne	PPARD	21	41
CON(C)C(=O)CCNCc1ccc(C(F)(F)F)cc1C	ZINC000819252118	DF	On-Demand	Anodyne	CCR2	34	47
N#Cc1cccnc1OC1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819252122	FH	On-Demand	Mild	ADRB3	16	40
O[C@@H](CNCCc1ccc(F)c(F)c1)c1c(F)cccc1F	ZINC000819252129	DG	On-Demand	Anodyne	ADRB2	47	42
O[C@@H](CNCCc1ccc(F)c(F)c1)c1c(F)cccc1F	ZINC000819252129	DG	On-Demand	Anodyne	ADRB1	49	45
O[C@@H](CNCCc1ccc(F)c(F)c1)c1c(F)cccc1F	ZINC000819252129	DG	On-Demand	Anodyne	ADRB3	62	45
O[C@H](CNCCc1ccc(F)c(F)c1)c1c(F)cccc1F	ZINC000819252131	DG	On-Demand	Anodyne	ADRB2	47	42
O[C@H](CNCCc1ccc(F)c(F)c1)c1c(F)cccc1F	ZINC000819252131	DG	On-Demand	Anodyne	ADRB1	49	45
O[C@H](CNCCc1ccc(F)c(F)c1)c1c(F)cccc1F	ZINC000819252131	DG	On-Demand	Anodyne	ADRB3	62	45
CC(C)(C)OC(=O)N[C@H]1CCN(C(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819252140	GG	On-Demand	Anodyne	C3AR1	42	40
O[C@@H](CNCCc1ccc(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819252161	EH	On-Demand	Anodyne	ADRB2	51	44
O[C@@H](CNCCc1ccc(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819252161	EH	On-Demand	Anodyne	ADRB1	54	50
O[C@@H](CNCCc1ccc(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819252161	EH	On-Demand	Anodyne	ADRB3	101	50
O[C@H](CNCCc1ccc(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819252163	EH	On-Demand	Anodyne	ADRB2	51	44
O[C@H](CNCCc1ccc(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819252163	EH	On-Demand	Anodyne	ADRB1	54	50
O[C@H](CNCCc1ccc(F)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819252163	EH	On-Demand	Anodyne	ADRB3	101	50
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3ccccc3C)CC1)C2	ZINC000819252219	FH	On-Demand	Anodyne	RBP4	46	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3ccccc3C)CC1)C2	ZINC000819252220	FH	On-Demand	Anodyne	RBP4	46	37
N#Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252225	DB	On-Demand	Mild	ADRB1	49	34
N#Cc1ccc(OC[C@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252226	DB	On-Demand	Mild	ADRB1	49	34
N#Cc1ccc(OC[C@@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252227	DB	On-Demand	Mild	ADRB1	49	34
N#Cc1ccc(OC[C@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252228	DB	On-Demand	Mild	ADRB1	49	34
NC(=O)C1=NO[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819252229	CC	On-Demand	Anodyne	LUCI_PHOPY	58	33
NC(=O)C1=NO[C@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819252230	CC	On-Demand	Anodyne	LUCI_PHOPY	58	33
NC(=O)C1=NO[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819252231	CC	On-Demand	Anodyne	LUCI_PHOPY	58	33
NC(=O)C1=NO[C@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819252232	CC	On-Demand	Anodyne	LUCI_PHOPY	58	33
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1CC(C(N)=O)=NO1	ZINC000819252265	FB	On-Demand	Anodyne	ADRB2	18	41
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1CC(C(N)=O)=NO1	ZINC000819252265	FB	On-Demand	Anodyne	ADRA1D	16	40
COc1cccc(OC)c1OC[C@H](O)CNC[C@H]1CC(C(N)=O)=NO1	ZINC000819252265	FB	On-Demand	Anodyne	ADRA1B	15	40
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1CC(C(N)=O)=NO1	ZINC000819252266	FB	On-Demand	Anodyne	ADRB2	18	41
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1CC(C(N)=O)=NO1	ZINC000819252266	FB	On-Demand	Anodyne	ADRA1D	16	40
COc1cccc(OC)c1OC[C@H](O)CNC[C@@H]1CC(C(N)=O)=NO1	ZINC000819252266	FB	On-Demand	Anodyne	ADRA1B	15	40
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1CC(C(N)=O)=NO1	ZINC000819252267	FB	On-Demand	Anodyne	ADRB2	18	41
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1CC(C(N)=O)=NO1	ZINC000819252267	FB	On-Demand	Anodyne	ADRA1D	16	40
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@H]1CC(C(N)=O)=NO1	ZINC000819252267	FB	On-Demand	Anodyne	ADRA1B	15	40
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1CC(C(N)=O)=NO1	ZINC000819252268	FB	On-Demand	Anodyne	ADRB2	18	41
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1CC(C(N)=O)=NO1	ZINC000819252268	FB	On-Demand	Anodyne	ADRA1D	16	40
COc1cccc(OC)c1OC[C@@H](O)CNC[C@H]1CC(C(N)=O)=NO1	ZINC000819252268	FB	On-Demand	Anodyne	ADRA1B	15	40
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COCc2ccccc2)C1	ZINC000819252289	DB	On-Demand	Anodyne	LUCI_PHOPY	55	32
NC(=O)C1=NO[C@H](CNC[C@@H](O)COCc2ccccc2)C1	ZINC000819252290	DB	On-Demand	Anodyne	LUCI_PHOPY	55	32
NC(=O)C1=NO[C@@H](CNC[C@H](O)COCc2ccccc2)C1	ZINC000819252291	DB	On-Demand	Anodyne	LUCI_PHOPY	55	32
NC(=O)C1=NO[C@H](CNC[C@H](O)COCc2ccccc2)C1	ZINC000819252292	DB	On-Demand	Anodyne	LUCI_PHOPY	55	32
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccccc1F	ZINC000819252301	CF	On-Demand	Anodyne	ADRB2	62	42
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccccc1F	ZINC000819252301	CF	On-Demand	Anodyne	ADRB1	63	44
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccccc1F	ZINC000819252301	CF	On-Demand	Anodyne	ADRB3	72	44
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccccc1F	ZINC000819252302	CF	On-Demand	Anodyne	ADRB2	62	42
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccccc1F	ZINC000819252302	CF	On-Demand	Anodyne	ADRB1	63	44
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccccc1F	ZINC000819252302	CF	On-Demand	Anodyne	ADRB3	72	44
CC(=O)Nc1cccc(CC(=O)N2CCC(N(C)C(=O)OC(C)(C)C)CC2)c1	ZINC000819252307	GG	On-Demand	Anodyne	GPR119	18	42
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)c(F)c1	ZINC000819252331	DG	On-Demand	Anodyne	ADRB2	67	50
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)c(F)c1	ZINC000819252331	DG	On-Demand	Anodyne	ADRB1	65	49
O[C@@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)c(F)c1	ZINC000819252331	DG	On-Demand	Anodyne	ADRB3	100	49
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)c(F)c1	ZINC000819252332	DG	On-Demand	Anodyne	ADRB2	67	50
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)c(F)c1	ZINC000819252332	DG	On-Demand	Anodyne	ADRB1	65	49
O[C@H](CNCCc1ccc(F)c(F)c1)c1ccc(F)c(F)c1	ZINC000819252332	DG	On-Demand	Anodyne	ADRB3	100	49
COc1ccc(OC)c([C@H](O)CNCCc2ccc(F)c(F)c2)c1	ZINC000819252343	EF	On-Demand	Anodyne	ADRB2	54	55
COc1ccc(OC)c([C@H](O)CNCCc2ccc(F)c(F)c2)c1	ZINC000819252343	EF	On-Demand	Anodyne	ADRB1	58	45
COc1ccc(OC)c([C@H](O)CNCCc2ccc(F)c(F)c2)c1	ZINC000819252343	EF	On-Demand	Anodyne	ADRB3	52	45
O=C(C(F)=C1CCC1)N1CC[C@@H](N2CCCCC2)C1	ZINC000819252347	CE	On-Demand	Anodyne	L3MBTL3	92	48
O=C(C(F)=C1CCC1)N1CC[C@H](N2CCCCC2)C1	ZINC000819252348	CE	On-Demand	Anodyne	L3MBTL3	92	48
CC[C@@](C)(NC(=O)Cc1cccc(NC(C)=O)c1)c1ccccc1	ZINC000819252354	DH	On-Demand	Anodyne	IMDH_CRYPV	52	37
CC[C@@](C)(NC(=O)Cc1cccc(NC(C)=O)c1)c1ccccc1	ZINC000819252354	DH	On-Demand	Anodyne	KCNK3	77	35
CC[C@@](C)(NC(=O)Cc1cccc(NC(C)=O)c1)c1ccccc1	ZINC000819252354	DH	On-Demand	Anodyne	KCNK9	43	35
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCOc3c(F)cccc32)cc1	ZINC000819252364	EF	On-Demand	Bother	LUXR	17	40
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCOc3c(F)cccc32)cc1	ZINC000819252365	EF	On-Demand	Bother	LUXR	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(Cl)cc1OC)C2	ZINC000819252392	FF	On-Demand	Anodyne	P2RX7	60	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(Cl)cc1OC)C2	ZINC000819252393	FF	On-Demand	Anodyne	P2RX7	60	40
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1	ZINC000819252419	FH	On-Demand	Anodyne	NPY2R	27	42
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1	ZINC000819252419	FH	On-Demand	Anodyne	L3MBTL3	49	33
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1	ZINC000819252420	FH	On-Demand	Anodyne	NPY2R	27	42
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1	ZINC000819252420	FH	On-Demand	Anodyne	L3MBTL3	49	33
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1	ZINC000819252421	FH	On-Demand	Anodyne	NPY2R	27	42
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1	ZINC000819252421	FH	On-Demand	Anodyne	L3MBTL3	49	33
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1	ZINC000819252422	FH	On-Demand	Anodyne	NPY2R	27	42
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1	ZINC000819252422	FH	On-Demand	Anodyne	L3MBTL3	49	33
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000819252454	GD	On-Demand	Anodyne	ADRB2	37	42
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000819252454	GD	On-Demand	Anodyne	ADRB1	66	46
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000819252454	GD	On-Demand	Anodyne	ADRB3	46	46
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000819252455	GD	On-Demand	Anodyne	ADRB2	37	42
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000819252455	GD	On-Demand	Anodyne	ADRB1	66	46
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000819252455	GD	On-Demand	Anodyne	ADRB3	46	46
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000819252456	GD	On-Demand	Anodyne	ADRB2	37	42
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000819252456	GD	On-Demand	Anodyne	ADRB1	66	46
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000819252456	GD	On-Demand	Anodyne	ADRB3	46	46
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000819252457	GD	On-Demand	Anodyne	ADRB2	37	42
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000819252457	GD	On-Demand	Anodyne	ADRB1	66	46
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)C1	ZINC000819252457	GD	On-Demand	Anodyne	ADRB3	46	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(N3CCCC3)c(Cl)c1)C2	ZINC000819252464	GH	On-Demand	Anodyne	NPY2R	55	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(N3CCCC3)c(Cl)c1)C2	ZINC000819252467	GH	On-Demand	Anodyne	NPY2R	55	43
Cc1ccccc1[C@@H]([C@H](C)NC[C@H](O)c1ccccc1)N(C)C	ZINC000819252494	DG	On-Demand	Anodyne	AOC3	19	40
Cc1ccccc1[C@@H]([C@@H](C)NC[C@H](O)c1ccccc1)N(C)C	ZINC000819252496	DG	On-Demand	Anodyne	AOC3	19	40
Cc1ccccc1[C@@H]([C@@H](C)NC[C@@H](O)c1ccccc1)N(C)C	ZINC000819252498	DG	On-Demand	Anodyne	AOC3	19	40
Cc1ccccc1[C@@H]([C@H](C)NC[C@@H](O)c1ccccc1)N(C)C	ZINC000819252500	DG	On-Demand	Anodyne	AOC3	19	40
CC(C)c1ccccc1CNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819252505	FG	On-Demand	Anodyne	ADRB2	32	40
CC(C)c1ccccc1CNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819252505	FG	On-Demand	Anodyne	ADRB1	44	40
CN(C)CCc1ccc(CNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819252506	EF	On-Demand	Anodyne	ADRB2	21	41
CC(C)c1ccccc1CNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819252507	FG	On-Demand	Anodyne	ADRB2	32	40
CC(C)c1ccccc1CNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819252507	FG	On-Demand	Anodyne	ADRB1	44	40
CN(C)CCc1ccc(CNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819252508	EF	On-Demand	Anodyne	ADRB2	21	41
O[C@H](CNCCc1ccc(F)c(F)c1)COCC1CC1	ZINC000819252565	CD	On-Demand	Anodyne	ADRB2	27	42
O[C@H](CNCCc1ccc(F)c(F)c1)COCC1CC1	ZINC000819252565	CD	On-Demand	Anodyne	ADRB1	55	49
O[C@H](CNCCc1ccc(F)c(F)c1)COCC1CC1	ZINC000819252565	CD	On-Demand	Anodyne	ADRB3	45	42
O[C@@H](CNCCc1ccc(F)c(F)c1)COCC1CC1	ZINC000819252566	CD	On-Demand	Anodyne	ADRB2	27	42
O[C@@H](CNCCc1ccc(F)c(F)c1)COCC1CC1	ZINC000819252566	CD	On-Demand	Anodyne	ADRB1	55	49
O[C@@H](CNCCc1ccc(F)c(F)c1)COCC1CC1	ZINC000819252566	CD	On-Demand	Anodyne	ADRB3	45	42
O=C(/C=C/[C@H]1CCCO1)NCCCc1c[nH]c2ccccc12	ZINC000819252578	CF	On-Demand	Anodyne	ACHE	28	40
O=C(/C=C/[C@H]1CCCO1)NCCCc1c[nH]c2ccccc12	ZINC000819252578	CF	On-Demand	Anodyne	CCKAR	34	40
O=C(/C=C/[C@H]1CCCO1)NCCCc1c[nH]c2ccccc12	ZINC000819252578	CF	On-Demand	Anodyne	BCHE	17	40
O=C(/C=C/[C@H]1CCCO1)NCCCc1c[nH]c2ccccc12	ZINC000819252578	CF	On-Demand	Anodyne	CCKBR	39	40
O=C(/C=C/[C@@H]1CCCO1)NCCCc1c[nH]c2ccccc12	ZINC000819252579	CF	On-Demand	Anodyne	ACHE	28	40
O=C(/C=C/[C@@H]1CCCO1)NCCCc1c[nH]c2ccccc12	ZINC000819252579	CF	On-Demand	Anodyne	CCKAR	34	40
O=C(/C=C/[C@@H]1CCCO1)NCCCc1c[nH]c2ccccc12	ZINC000819252579	CF	On-Demand	Anodyne	BCHE	17	40
O=C(/C=C/[C@@H]1CCCO1)NCCCc1c[nH]c2ccccc12	ZINC000819252579	CF	On-Demand	Anodyne	CCKBR	39	40
O=C(/C=C\[C@H]1CCCO1)NCCCc1c[nH]c2ccccc12	ZINC000819252580	CF	On-Demand	Anodyne	ACHE	28	40
O=C(/C=C\[C@H]1CCCO1)NCCCc1c[nH]c2ccccc12	ZINC000819252580	CF	On-Demand	Anodyne	CCKAR	34	40
O=C(/C=C\[C@H]1CCCO1)NCCCc1c[nH]c2ccccc12	ZINC000819252580	CF	On-Demand	Anodyne	BCHE	17	40
O=C(/C=C\[C@H]1CCCO1)NCCCc1c[nH]c2ccccc12	ZINC000819252580	CF	On-Demand	Anodyne	CCKBR	39	40
O=C(/C=C\[C@@H]1CCCO1)NCCCc1c[nH]c2ccccc12	ZINC000819252581	CF	On-Demand	Anodyne	ACHE	28	40
O=C(/C=C\[C@@H]1CCCO1)NCCCc1c[nH]c2ccccc12	ZINC000819252581	CF	On-Demand	Anodyne	CCKAR	34	40
O=C(/C=C\[C@@H]1CCCO1)NCCCc1c[nH]c2ccccc12	ZINC000819252581	CF	On-Demand	Anodyne	BCHE	17	40
O=C(/C=C\[C@@H]1CCCO1)NCCCc1c[nH]c2ccccc12	ZINC000819252581	CF	On-Demand	Anodyne	CCKBR	39	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cccc3cc[nH]c23)CC1	ZINC000819252588	FG	On-Demand	Anodyne	GPR119	38	51
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cccc3cc[nH]c23)CC1	ZINC000819252589	FG	On-Demand	Anodyne	GPR119	38	51
Cc1cccc(CNC[C@H](O)c2cccnc2)c1Br	ZINC000819252590	DF	On-Demand	Anodyne	ADRB2	20	44
Cc1cccc(CNC[C@H](O)c2cccnc2)c1Br	ZINC000819252590	DF	On-Demand	Anodyne	ADRB1	23	44
Cc1cccc(CNC[C@H](O)c2cccnc2)c1Br	ZINC000819252590	DF	On-Demand	Anodyne	ADRB3	86	46
Cc1cccc(CNC[C@@H](O)c2cccnc2)c1Br	ZINC000819252591	DF	On-Demand	Anodyne	ADRB2	20	44
Cc1cccc(CNC[C@@H](O)c2cccnc2)c1Br	ZINC000819252591	DF	On-Demand	Anodyne	ADRB1	23	44
Cc1cccc(CNC[C@@H](O)c2cccnc2)c1Br	ZINC000819252591	DF	On-Demand	Anodyne	ADRB3	86	46
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(F)c(F)c2)c1	ZINC000819252598	DF	On-Demand	Bother	ADRB2	57	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(F)c(F)c2)c1	ZINC000819252598	DF	On-Demand	Bother	ADRB1	63	52
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(F)c(F)c2)c1	ZINC000819252598	DF	On-Demand	Bother	CACNA1C	21	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(F)c(F)c2)c1	ZINC000819252598	DF	On-Demand	Bother	ADRB3	119	52
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(F)c(F)c2)c1	ZINC000819252598	DF	On-Demand	Bother	CACNA1D	32	41
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(F)c(F)c2)c1	ZINC000819252599	DF	On-Demand	Bother	ADRB2	57	42
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(F)c(F)c2)c1	ZINC000819252599	DF	On-Demand	Bother	ADRB1	63	52
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(F)c(F)c2)c1	ZINC000819252599	DF	On-Demand	Bother	CACNA1C	21	41
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(F)c(F)c2)c1	ZINC000819252599	DF	On-Demand	Bother	ADRB3	119	52
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(F)c(F)c2)c1	ZINC000819252599	DF	On-Demand	Bother	CACNA1D	32	41
O=C(C(F)=C1CCC1)N1CCC[C@@H](N2CCCC2)C1	ZINC000819252604	CE	On-Demand	Anodyne	L3MBTL3	64	42
O=C(C(F)=C1CCC1)N1CCC[C@H](N2CCCC2)C1	ZINC000819252605	CE	On-Demand	Anodyne	L3MBTL3	64	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCCN(C(=O)CC2CCCC2)CC1	ZINC000819252606	GF	On-Demand	Anodyne	ADAM10	19	41
C=CCC1(C(=O)Nc2ccc(N3CCCC3)c(Cl)c2)CCOCC1	ZINC000819252607	EI	On-Demand	Mild	NPY2R	52	45
COC(=O)C1CCC(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819252650	GE	On-Demand	Mild	PAPA1_CARPA	43	50
COC(=O)C1CCC(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819252653	GE	On-Demand	Mild	PAPA1_CARPA	43	50
CN(C)CCc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819252654	CE	On-Demand	Anodyne	ADRB2	34	48
CN(C)CCc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819252654	CE	On-Demand	Anodyne	ADRB1	41	43
CN(C)CCc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819252654	CE	On-Demand	Anodyne	ADRB3	119	49
CN(C)CCc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819252654	CE	On-Demand	Anodyne	CYP51A1	19	46
CN(C)CCc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819252657	CE	On-Demand	Anodyne	ADRB2	34	48
CN(C)CCc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819252657	CE	On-Demand	Anodyne	ADRB1	41	43
CN(C)CCc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819252657	CE	On-Demand	Anodyne	ADRB3	119	49
CN(C)CCc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819252657	CE	On-Demand	Anodyne	CYP51A1	19	46
Cc1cc(C(F)(F)F)ccc1CNC[C@H](O)c1ccc(C#N)cc1	ZINC000819252670	EH	On-Demand	Mild	CCR2	35	49
Cc1cc(C(F)(F)F)ccc1CNC[C@@H](O)c1ccc(C#N)cc1	ZINC000819252672	EH	On-Demand	Mild	CCR2	35	49
CCOc1ccc(OC[C@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252740	EC	On-Demand	Anodyne	ADRB2	30	41
CCOc1ccc(OC[C@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252740	EC	On-Demand	Anodyne	ADRB1	51	39
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252742	EC	On-Demand	Anodyne	ADRB2	30	41
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252742	EC	On-Demand	Anodyne	ADRB1	51	39
CCOc1ccc(OC[C@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252744	EC	On-Demand	Anodyne	ADRB2	30	41
CCOc1ccc(OC[C@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252744	EC	On-Demand	Anodyne	ADRB1	51	39
CCOc1ccc(OC[C@@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252745	EC	On-Demand	Anodyne	ADRB2	30	41
CCOc1ccc(OC[C@@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252745	EC	On-Demand	Anodyne	ADRB1	51	39
CN(C)CCc1ccc(CNC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819252746	GG	On-Demand	Anodyne	ADRB2	21	40
CN(C)CCc1ccc(CNC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819252746	GG	On-Demand	Anodyne	ADRB3	32	41
CN(C)CCc1ccc(CNC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819252748	GG	On-Demand	Anodyne	ADRB2	21	40
CN(C)CCc1ccc(CNC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819252748	GG	On-Demand	Anodyne	ADRB3	32	41
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252752	FB	On-Demand	Anodyne	ADRB2	33	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252752	FB	On-Demand	Anodyne	ADRB1	54	41
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252752	FB	On-Demand	Anodyne	ADRB3	35	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252753	FB	On-Demand	Anodyne	ADRB2	33	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252753	FB	On-Demand	Anodyne	ADRB1	54	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252753	FB	On-Demand	Anodyne	ADRB3	35	41
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252754	FB	On-Demand	Anodyne	ADRB2	33	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252754	FB	On-Demand	Anodyne	ADRB1	54	41
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252754	FB	On-Demand	Anodyne	ADRB3	35	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252755	FB	On-Demand	Anodyne	ADRB2	33	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252755	FB	On-Demand	Anodyne	ADRB1	54	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819252755	FB	On-Demand	Anodyne	ADRB3	35	41
CC(C)c1ccccc1CNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819252757	FG	On-Demand	Bother	COLA	71	40
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819252775	EC	On-Demand	Anodyne	ADRB1	51	43
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819252776	EC	On-Demand	Anodyne	ADRB1	51	43
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819252777	EC	On-Demand	Anodyne	ADRB1	51	43
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819252778	EC	On-Demand	Anodyne	ADRB1	51	43
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819252790	EC	On-Demand	Anodyne	ADRB2	18	49
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819252790	EC	On-Demand	Anodyne	ADRB1	43	32
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819252791	EC	On-Demand	Anodyne	ADRB2	18	49
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819252791	EC	On-Demand	Anodyne	ADRB1	43	32
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819252792	EC	On-Demand	Anodyne	ADRB2	18	49
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccccc2Cl)C1	ZINC000819252792	EC	On-Demand	Anodyne	ADRB1	43	32
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819252793	EC	On-Demand	Anodyne	ADRB2	18	49
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819252793	EC	On-Demand	Anodyne	ADRB1	43	32
CSc1ccc(NC(=O)Cn2cc(NC(=O)/C=C\[C@H]3CCCO3)cn2)cc1	ZINC000819252815	GF	On-Demand	Anodyne	PANC	45	32
CSc1ccc(NC(=O)Cn2cc(NC(=O)/C=C/[C@@H]3CCCO3)cn2)cc1	ZINC000819252816	GF	On-Demand	Anodyne	PANC	45	32
CSc1ccc(NC(=O)Cn2cc(NC(=O)/C=C\[C@@H]3CCCO3)cn2)cc1	ZINC000819252817	GF	On-Demand	Anodyne	PANC	45	32
CSc1ccc(NC(=O)Cn2cc(NC(=O)/C=C/[C@H]3CCCO3)cn2)cc1	ZINC000819252818	GF	On-Demand	Anodyne	PANC	45	32
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1ccc(F)c(F)c1	ZINC000819252819	EE	On-Demand	Anodyne	ADRB1	46	37
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1ccc(F)c(F)c1	ZINC000819252819	EE	On-Demand	Anodyne	ADRB3	46	37
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1ccc(F)c(F)c1	ZINC000819252819	EE	On-Demand	Anodyne	LEF	40	31
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1ccc(F)c(F)c1	ZINC000819252820	EE	On-Demand	Anodyne	ADRB1	46	37
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1ccc(F)c(F)c1	ZINC000819252820	EE	On-Demand	Anodyne	ADRB3	46	37
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1ccc(F)c(F)c1	ZINC000819252820	EE	On-Demand	Anodyne	LEF	40	31
CN(C)CCc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819252826	CF	On-Demand	Anodyne	ADRB2	35	51
CN(C)CCc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819252826	CF	On-Demand	Anodyne	ADRB1	35	42
CN(C)CCc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819252826	CF	On-Demand	Anodyne	ADRB3	62	46
CN(C)CCc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819252826	CF	On-Demand	Anodyne	AOC3	28	43
CN(C)CCc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819252827	CF	On-Demand	Anodyne	ADRB2	35	51
CN(C)CCc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819252827	CF	On-Demand	Anodyne	ADRB1	35	42
CN(C)CCc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819252827	CF	On-Demand	Anodyne	ADRB3	62	46
CN(C)CCc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819252827	CF	On-Demand	Anodyne	AOC3	28	43
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252829	FE	On-Demand	Anodyne	DRD4	30	49
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252829	FE	On-Demand	Anodyne	SLC6A1	56	36
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252829	FE	On-Demand	Anodyne	KCNH2	17	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252829	FE	On-Demand	Anodyne	CHRM3	22	41
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252829	FE	On-Demand	Anodyne	SIGMAR1	31	64
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252829	FE	On-Demand	Anodyne	SSTR5	48	37
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252829	FE	On-Demand	Anodyne	CCR3	51	52
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252829	FE	On-Demand	Anodyne	MLNR	48	43
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252829	FE	On-Demand	Anodyne	CCR2	17	40
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252829	FE	On-Demand	Anodyne	S1PR1	24	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252829	FE	On-Demand	Anodyne	S1PR5	22	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252829	FE	On-Demand	Anodyne	CXCR3	40	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252829	FE	On-Demand	Anodyne	MCHR1	56	52
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252829	FE	On-Demand	Anodyne	CACNA1G	33	42
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252830	FE	On-Demand	Anodyne	DRD4	30	49
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252830	FE	On-Demand	Anodyne	SLC6A1	56	36
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252830	FE	On-Demand	Anodyne	KCNH2	17	42
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252830	FE	On-Demand	Anodyne	CHRM3	22	41
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252830	FE	On-Demand	Anodyne	SIGMAR1	31	64
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252830	FE	On-Demand	Anodyne	SSTR5	48	37
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252830	FE	On-Demand	Anodyne	CCR3	51	52
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252830	FE	On-Demand	Anodyne	MLNR	48	43
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252830	FE	On-Demand	Anodyne	CCR2	17	40
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252830	FE	On-Demand	Anodyne	S1PR1	24	42
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252830	FE	On-Demand	Anodyne	S1PR5	22	42
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252830	FE	On-Demand	Anodyne	CXCR3	40	42
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252830	FE	On-Demand	Anodyne	MCHR1	56	52
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)c(F)c3)CC2)C1	ZINC000819252830	FE	On-Demand	Anodyne	CACNA1G	33	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C3CCCC3)CC2)C1	ZINC000819252831	DD	On-Demand	Anodyne	EPHX2	21	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C3CCCC3)CC2)C1	ZINC000819252831	DD	On-Demand	Anodyne	L3MBTL3	82	40
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C3CCCC3)CC2)C1	ZINC000819252832	DD	On-Demand	Anodyne	EPHX2	21	42
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C3CCCC3)CC2)C1	ZINC000819252832	DD	On-Demand	Anodyne	L3MBTL3	82	40
O=C(O)[C@@H]1CCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000819252833	ED	On-Demand	Anodyne	SLC6A1	158	49
O=C(O)[C@@H]1CCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000819252833	ED	On-Demand	Anodyne	CCR5	42	43
O=C(O)[C@@H]1CCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000819252833	ED	On-Demand	Anodyne	DPP7	41	38
O=C(O)[C@@H]1CCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000819252833	ED	On-Demand	Anodyne	BIRC2	28	42
O=C(O)[C@H]1CCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000819252834	ED	On-Demand	Anodyne	SLC6A1	158	49
O=C(O)[C@H]1CCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000819252834	ED	On-Demand	Anodyne	CCR5	42	43
O=C(O)[C@H]1CCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000819252834	ED	On-Demand	Anodyne	DPP7	41	38
O=C(O)[C@H]1CCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000819252834	ED	On-Demand	Anodyne	BIRC2	28	42
O=C(O)[C@@H]1CCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000819252835	ED	On-Demand	Anodyne	SLC6A1	158	49
O=C(O)[C@@H]1CCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000819252835	ED	On-Demand	Anodyne	CCR5	42	43
O=C(O)[C@@H]1CCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000819252835	ED	On-Demand	Anodyne	DPP7	41	38
O=C(O)[C@@H]1CCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000819252835	ED	On-Demand	Anodyne	BIRC2	28	42
O=C(O)[C@H]1CCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000819252836	ED	On-Demand	Anodyne	SLC6A1	158	49
O=C(O)[C@H]1CCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000819252836	ED	On-Demand	Anodyne	CCR5	42	43
O=C(O)[C@H]1CCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000819252836	ED	On-Demand	Anodyne	DPP7	41	38
O=C(O)[C@H]1CCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000819252836	ED	On-Demand	Anodyne	BIRC2	28	42
O=C(O)[C@@H]1CCN(C(=O)N[C@H]2CCN(CC(F)(F)F)C2)C1	ZINC000819252841	DC	On-Demand	Anodyne	HPGDS	35	44
O=C(O)[C@H]1CCN(C(=O)N[C@@H]2CCN(CC(F)(F)F)C2)C1	ZINC000819252842	DC	On-Demand	Anodyne	HPGDS	35	44
O=C(O)[C@H]1CCN(C(=O)N[C@H]2CCN(CC(F)(F)F)C2)C1	ZINC000819252843	DC	On-Demand	Anodyne	HPGDS	35	44
O[C@@H](CNCCc1ccc(F)c(F)c1)c1cccc(Cl)c1	ZINC000819252844	DG	On-Demand	Anodyne	ADRB2	82	48
O[C@@H](CNCCc1ccc(F)c(F)c1)c1cccc(Cl)c1	ZINC000819252844	DG	On-Demand	Anodyne	ADRB1	96	66
O[C@@H](CNCCc1ccc(F)c(F)c1)c1cccc(Cl)c1	ZINC000819252844	DG	On-Demand	Anodyne	ADRB3	144	66
O=C(O)[C@@H]1CCN(C(=O)N[C@@H]2CCN(CC(F)(F)F)C2)C1	ZINC000819252845	DC	On-Demand	Anodyne	HPGDS	35	44
O[C@H](CNCCc1ccc(F)c(F)c1)c1cccc(Cl)c1	ZINC000819252846	DG	On-Demand	Anodyne	ADRB2	82	48
O[C@H](CNCCc1ccc(F)c(F)c1)c1cccc(Cl)c1	ZINC000819252846	DG	On-Demand	Anodyne	ADRB1	96	66
O[C@H](CNCCc1ccc(F)c(F)c1)c1cccc(Cl)c1	ZINC000819252846	DG	On-Demand	Anodyne	ADRB3	144	66
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CC3CCCCC3)CC2)C1	ZINC000819252847	EE	On-Demand	Anodyne	SIGMAR1	15	44
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CC3CCCCC3)CC2)C1	ZINC000819252847	EE	On-Demand	Anodyne	EPHX2	21	40
O[C@@H](CNCCc1ccc(F)c(F)c1)c1cccc(F)c1	ZINC000819252848	CF	On-Demand	Anodyne	ADRB2	66	48
O[C@@H](CNCCc1ccc(F)c(F)c1)c1cccc(F)c1	ZINC000819252848	CF	On-Demand	Anodyne	ADRB1	73	53
O[C@@H](CNCCc1ccc(F)c(F)c1)c1cccc(F)c1	ZINC000819252848	CF	On-Demand	Anodyne	ADRB3	122	53
O[C@H](CNCCc1ccc(F)c(F)c1)c1cccc(F)c1	ZINC000819252849	CF	On-Demand	Anodyne	ADRB2	66	48
O[C@H](CNCCc1ccc(F)c(F)c1)c1cccc(F)c1	ZINC000819252849	CF	On-Demand	Anodyne	ADRB1	73	53
O[C@H](CNCCc1ccc(F)c(F)c1)c1cccc(F)c1	ZINC000819252849	CF	On-Demand	Anodyne	ADRB3	122	53
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CC3CCCCC3)CC2)C1	ZINC000819252850	EE	On-Demand	Anodyne	SIGMAR1	15	44
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CC3CCCCC3)CC2)C1	ZINC000819252850	EE	On-Demand	Anodyne	EPHX2	21	40
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000819252852	FD	On-Demand	Anodyne	SLC6A1	96	43
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000819252852	FD	On-Demand	Anodyne	CCR3	18	44
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000819252852	FD	On-Demand	Anodyne	EPHX2	41	67
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000819252852	FD	On-Demand	Anodyne	SFRP1	43	38
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000819252852	FD	On-Demand	Anodyne	L3MBTL3	47	42
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000819252854	FD	On-Demand	Anodyne	SLC6A1	96	43
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000819252854	FD	On-Demand	Anodyne	CCR3	18	44
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000819252854	FD	On-Demand	Anodyne	EPHX2	41	67
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000819252854	FD	On-Demand	Anodyne	SFRP1	43	38
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000819252854	FD	On-Demand	Anodyne	L3MBTL3	47	42
O=C(O)[C@@H]1CCN(C(=O)Cn2ncc3ccccc3c2=O)C1	ZINC000819252856	DC	On-Demand	Anodyne	SLC6A1	56	35
O=C(O)[C@H]1CCN(C(=O)Cn2ncc3ccccc3c2=O)C1	ZINC000819252858	DC	On-Demand	Anodyne	SLC6A1	56	35
O=C(O)[C@@H]1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)C1	ZINC000819252868	EC	On-Demand	Anodyne	SLC18A3	65	45
O=C(O)[C@@H]1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)C1	ZINC000819252868	EC	On-Demand	Anodyne	EPHX2	27	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)C1	ZINC000819252870	EC	On-Demand	Anodyne	SLC18A3	65	45
O=C(O)[C@@H]1CCN(C(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)C1	ZINC000819252870	EC	On-Demand	Anodyne	EPHX2	27	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)C1	ZINC000819252872	EC	On-Demand	Anodyne	SLC18A3	65	45
O=C(O)[C@@H]1CCN(C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)C1	ZINC000819252872	EC	On-Demand	Anodyne	EPHX2	27	42
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCCC2)c(Cl)c1	ZINC000819252873	GH	On-Demand	Anodyne	CNR1	49	31
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCCC2)c(Cl)c1	ZINC000819252873	GH	On-Demand	Anodyne	HTR1D	17	40
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCCC2)c(Cl)c1	ZINC000819252873	GH	On-Demand	Anodyne	HTR1B	15	40
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCCC2)c(Cl)c1	ZINC000819252873	GH	On-Demand	Anodyne	KCNQ2	54	46
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCCC2)c(Cl)c1	ZINC000819252873	GH	On-Demand	Anodyne	NPY2R	64	53
O=C(O)[C@@H]1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)C1	ZINC000819252874	EC	On-Demand	Anodyne	SLC18A3	65	45
O=C(O)[C@@H]1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)C1	ZINC000819252874	EC	On-Demand	Anodyne	EPHX2	27	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(S(=O)(=O)C3CCOCC3)CC2)C1	ZINC000819252875	GC	On-Demand	Anodyne	EPHX2	23	53
O=C(O)[C@H]1CCN(C(=O)NC2CCN(S(=O)(=O)C3CCOCC3)CC2)C1	ZINC000819252876	GC	On-Demand	Anodyne	EPHX2	23	53
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819252883	ED	On-Demand	Anodyne	DRD4	32	47
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819252883	ED	On-Demand	Anodyne	ACHE	20	43
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819252883	ED	On-Demand	Anodyne	HRH3	18	56
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819252883	ED	On-Demand	Anodyne	SIGMAR1	32	51
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819252883	ED	On-Demand	Anodyne	SSTR5	49	38
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819252883	ED	On-Demand	Anodyne	CCR3	31	45
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819252883	ED	On-Demand	Anodyne	EPHX2	29	42
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819252883	ED	On-Demand	Anodyne	MCHR1	42	47
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819252883	ED	On-Demand	Anodyne	CACNA1G	18	42
CC[C@@](C)(NC(=O)C(F)=C1CCC1)c1ccccc1	ZINC000819252896	CH	On-Demand	Anodyne	AMY2	54	32
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819252897	ED	On-Demand	Anodyne	DRD4	32	47
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819252897	ED	On-Demand	Anodyne	ACHE	20	43
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819252897	ED	On-Demand	Anodyne	HRH3	18	56
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819252897	ED	On-Demand	Anodyne	SIGMAR1	32	51
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819252897	ED	On-Demand	Anodyne	SSTR5	49	38
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819252897	ED	On-Demand	Anodyne	CCR3	31	45
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819252897	ED	On-Demand	Anodyne	EPHX2	29	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819252897	ED	On-Demand	Anodyne	MCHR1	42	47
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819252897	ED	On-Demand	Anodyne	CACNA1G	18	42
O=C(O)[C@H]1CCN(C(=O)CSc2nnc(-c3ccc4ccccc4c3)o2)C1	ZINC000819252903	GF	On-Demand	Anodyne	ALOX15	38	43
O=C(O)[C@@H]1CCN(C(=O)CSc2nnc(-c3ccc4ccccc4c3)o2)C1	ZINC000819252905	GF	On-Demand	Anodyne	ALOX15	38	43
O=C(O)C1CCN(C(=O)NC2CCC(N3CCCCC3)CC2)CC1	ZINC000819252907	EE	On-Demand	Anodyne	L3MBTL3	90	42
O=C(O)C1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)CC1	ZINC000819252909	FD	On-Demand	Anodyne	SLC18A3	68	45
O=C(O)C1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)CC1	ZINC000819252909	FD	On-Demand	Anodyne	EPHX2	29	40
O=C(O)C1CCN(C(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)CC1	ZINC000819252910	FD	On-Demand	Anodyne	SLC18A3	68	45
O=C(O)C1CCN(C(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)CC1	ZINC000819252910	FD	On-Demand	Anodyne	EPHX2	29	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)c1coc(=O)c2ccccc12	ZINC000819252911	FF	On-Demand	Anodyne	INHA	51	33
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)c1coc(=O)c2ccccc12	ZINC000819252911	FF	On-Demand	Anodyne	HCRTR1	34	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)c1coc(=O)c2ccccc12	ZINC000819252911	FF	On-Demand	Anodyne	HCRTR2	15	40
O=C(O)C1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)CC1	ZINC000819252912	FD	On-Demand	Anodyne	SLC18A3	68	45
O=C(O)C1CCN(C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)CC1	ZINC000819252912	FD	On-Demand	Anodyne	EPHX2	29	40
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)c1coc(=O)c2ccccc12	ZINC000819252913	FF	On-Demand	Anodyne	INHA	51	33
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)c1coc(=O)c2ccccc12	ZINC000819252913	FF	On-Demand	Anodyne	HCRTR1	34	40
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)c1coc(=O)c2ccccc12	ZINC000819252913	FF	On-Demand	Anodyne	HCRTR2	15	40
O=C(O)C1CCN(C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)CC1	ZINC000819252914	FD	On-Demand	Anodyne	SLC18A3	68	45
O=C(O)C1CCN(C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)CC1	ZINC000819252914	FD	On-Demand	Anodyne	EPHX2	29	40
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccc(F)c(F)c2)cc1	ZINC000819252921	DF	On-Demand	Bother	ADRB2	45	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccc(F)c(F)c2)cc1	ZINC000819252921	DF	On-Demand	Bother	ADRB1	46	44
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2ccc(F)c(F)c2)cc1	ZINC000819252921	DF	On-Demand	Bother	ADRB3	85	44
O=C(O)[C@@H]1CCN(C(=O)Cn2c(S)nc3ccccc3c2=O)C1	ZINC000819252926	EC	On-Demand	Anodyne	SLC6A1	42	33
O=C(O)[C@H]1CCN(C(=O)Cn2c(S)nc3ccccc3c2=O)C1	ZINC000819252927	EC	On-Demand	Anodyne	SLC6A1	42	33
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccc(F)c(F)c2)cc1	ZINC000819252928	DF	On-Demand	Bother	ADRB2	45	42
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccc(F)c(F)c2)cc1	ZINC000819252928	DF	On-Demand	Bother	ADRB1	46	44
O=[N+]([O-])c1ccc([C@H](O)CNCCc2ccc(F)c(F)c2)cc1	ZINC000819252928	DF	On-Demand	Bother	ADRB3	85	44
O=C(O)[C@@H]1CCN(C(=O)COC/C=C/c2ccccc2)C1	ZINC000819252929	CD	On-Demand	Anodyne	SLC6A1	110	39
O=C(O)[C@H]1CCN(C(=O)COC/C=C/c2ccccc2)C1	ZINC000819252930	CD	On-Demand	Anodyne	SLC6A1	110	39
O=C(O)[C@@H]1CCN(C(=O)COC/C=C\c2ccccc2)C1	ZINC000819252932	CD	On-Demand	Anodyne	SLC6A1	110	39
O=C(O)[C@H]1CCN(C(=O)COC/C=C\c2ccccc2)C1	ZINC000819252933	CD	On-Demand	Anodyne	SLC6A1	110	39
O=C(O)[C@@H]1CCN(C(=O)Cc2cc(Cl)ccc2Br)C1	ZINC000819252935	EF	On-Demand	Anodyne	SLC6A1	52	35
O=C(O)[C@H]1CCN(C(=O)Cc2cc(Cl)ccc2Br)C1	ZINC000819252937	EF	On-Demand	Anodyne	SLC6A1	52	35
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	HTR1A	19	43
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	CHRM1	24	42
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	DRD2	32	45
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	DRD4	36	57
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	HTR2A	29	57
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	SLC6A1	139	40
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	OPRM1	19	46
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	DRD3	22	45
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	CHRM3	25	41
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	GRIN2B	52	36
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	LTA4H	25	45
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	HTR7	15	43
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	HRH3	22	47
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	SIGMAR1	70	67
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	CCR3	37	44
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	CCR5	51	40
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	C3AR1	40	39
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	EPHX2	46	43
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	MCHR1	26	44
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	CACNA1G	30	44
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	CYP2J2	45	33
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252939	ED	On-Demand	Anodyne	BIRC2	50	48
Cc1cc(C(F)(F)F)ccc1CNC[C@H](O)c1ccc(F)cn1	ZINC000819252940	EG	On-Demand	Anodyne	CCR2	34	41
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	HTR1A	19	43
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	CHRM1	24	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	DRD2	32	45
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	DRD4	36	57
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	HTR2A	29	57
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	SLC6A1	139	40
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	OPRM1	19	46
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	DRD3	22	45
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	CHRM3	25	41
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	GRIN2B	52	36
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	LTA4H	25	45
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	HTR7	15	43
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	HRH3	22	47
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	SIGMAR1	70	67
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	CCR3	37	44
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	CCR5	51	40
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	C3AR1	40	39
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	EPHX2	46	43
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	MCHR1	26	44
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	CACNA1G	30	44
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	CYP2J2	45	33
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819252941	ED	On-Demand	Anodyne	BIRC2	50	48
Cc1cc(C(F)(F)F)ccc1CNC[C@@H](O)c1ccc(F)cn1	ZINC000819252942	EG	On-Demand	Anodyne	CCR2	34	41
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)C1	ZINC000819252943	FC	On-Demand	Anodyne	SFRP1	107	35
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)C1	ZINC000819252943	FC	On-Demand	Anodyne	WNT3	69	32
O=C(NCCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819252946	CH	On-Demand	Anodyne	ACHE	34	44
O=C(NCCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819252946	CH	On-Demand	Anodyne	TPR	16	51
O=C(NCCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819252946	CH	On-Demand	Anodyne	CCKAR	32	40
O=C(NCCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819252946	CH	On-Demand	Anodyne	BCHE	25	40
O=C(NCCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819252946	CH	On-Demand	Anodyne	MPO	79	39
O=C(NCCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819252946	CH	On-Demand	Anodyne	BRS3	27	42
O=C(NCCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819252946	CH	On-Demand	Anodyne	NMBR	51	42
O=C(NCCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819252946	CH	On-Demand	Anodyne	MC3R	44	34
O=C(NCCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819252946	CH	On-Demand	Anodyne	MC5R	44	38
O=C(NCCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819252946	CH	On-Demand	Anodyne	GRIA1	17	42
O=C(NCCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819252946	CH	On-Demand	Anodyne	SSTR3	18	41
O=C(NCCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819252946	CH	On-Demand	Anodyne	MC1R	49	38
O=C(NCCCc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819252946	CH	On-Demand	Anodyne	KISS1R	58	31
O=C(O)[C@H]1CCN(C(=O)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)C1	ZINC000819252947	FC	On-Demand	Anodyne	SFRP1	107	35
O=C(O)[C@H]1CCN(C(=O)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)C1	ZINC000819252947	FC	On-Demand	Anodyne	WNT3	69	32
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C3CCCCC3)CC2)C1	ZINC000819252948	DD	On-Demand	Anodyne	EPHX2	21	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C3CCCCC3)CC2)C1	ZINC000819252948	DD	On-Demand	Anodyne	L3MBTL3	82	40
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C3CCCCC3)CC2)C1	ZINC000819252949	DD	On-Demand	Anodyne	EPHX2	21	42
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C3CCCCC3)CC2)C1	ZINC000819252949	DD	On-Demand	Anodyne	L3MBTL3	82	40
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000819252951	FD	On-Demand	Anodyne	DRD4	19	42
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000819252951	FD	On-Demand	Anodyne	SLC6A1	58	35
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000819252951	FD	On-Demand	Anodyne	GRIN2B	25	50
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000819252951	FD	On-Demand	Anodyne	SIGMAR1	27	49
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000819252951	FD	On-Demand	Anodyne	C3AR1	54	52
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000819252951	FD	On-Demand	Anodyne	PREP	47	39
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000819252951	FD	On-Demand	Anodyne	EPHX2	46	44
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000819252951	FD	On-Demand	Anodyne	CCR8	49	35
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000819252954	FD	On-Demand	Anodyne	DRD4	19	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000819252954	FD	On-Demand	Anodyne	SLC6A1	58	35
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000819252954	FD	On-Demand	Anodyne	GRIN2B	25	50
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000819252954	FD	On-Demand	Anodyne	SIGMAR1	27	49
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000819252954	FD	On-Demand	Anodyne	C3AR1	54	52
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000819252954	FD	On-Demand	Anodyne	PREP	47	39
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000819252954	FD	On-Demand	Anodyne	EPHX2	46	44
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)C1	ZINC000819252954	FD	On-Demand	Anodyne	CCR8	49	35
O=C(O)C1CCN(C(=O)N[C@H]2CC3(CCC3)Oc3ccccc32)CC1	ZINC000819252958	EF	On-Demand	Anodyne	EPHX2	23	48
O=C(O)C1CCN(C(=O)N[C@@H]2CC3(CCC3)Oc3ccccc32)CC1	ZINC000819252960	EF	On-Demand	Anodyne	EPHX2	23	48
CN(C)CCc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819252967	EF	On-Demand	Bother	CACNA1D	44	33
CN(C)CCc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819252968	EF	On-Demand	Bother	CACNA1D	44	33
O=C(O)C1CCN(C(=O)NC2CCN(C3CCCCC3)CC2)CC1	ZINC000819252973	EE	On-Demand	Anodyne	EPHX2	16	43
O=C(O)C1CCN(C(=O)NC2CCN(C3CCCCC3)CC2)CC1	ZINC000819252973	EE	On-Demand	Anodyne	L3MBTL3	70	38
O=C(O)[C@H]1CCN(C(=O)Cn2c(=O)cnc3ccccc32)C1	ZINC000819252978	DC	On-Demand	Anodyne	PDE6D	55	35
O=C(O)[C@H]1CCN(C(=O)Cn2c(=O)cnc3ccccc32)C1	ZINC000819252978	DC	On-Demand	Anodyne	UTS2R	19	43
O=C(O)[C@@H]1CCN(C(=O)Cn2c(=O)cnc3ccccc32)C1	ZINC000819252979	DC	On-Demand	Anodyne	PDE6D	55	35
O=C(O)[C@@H]1CCN(C(=O)Cn2c(=O)cnc3ccccc32)C1	ZINC000819252979	DC	On-Demand	Anodyne	UTS2R	19	43
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(c3ccccn3)CC2)C1	ZINC000819252980	DD	On-Demand	Anodyne	DRD4	25	40
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(c3ccccn3)CC2)C1	ZINC000819252980	DD	On-Demand	Anodyne	EBP	24	40
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(c3ccccn3)CC2)C1	ZINC000819252980	DD	On-Demand	Anodyne	EPHX2	49	48
O=C(O)[C@H]1CCN(C(=O)NC2CCN(c3ccccn3)CC2)C1	ZINC000819252981	DD	On-Demand	Anodyne	DRD4	25	40
O=C(O)[C@H]1CCN(C(=O)NC2CCN(c3ccccn3)CC2)C1	ZINC000819252981	DD	On-Demand	Anodyne	EBP	24	40
O=C(O)[C@H]1CCN(C(=O)NC2CCN(c3ccccn3)CC2)C1	ZINC000819252981	DD	On-Demand	Anodyne	EPHX2	49	48
O=C(O)[C@@H]1CCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000819252982	DF	On-Demand	Anodyne	SLC6A1	107	40
O=C(O)[C@@H]1CCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000819252982	DF	On-Demand	Anodyne	CCR5	35	41
O=C(O)[C@H]1CCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000819252983	DF	On-Demand	Anodyne	SLC6A1	107	40
O=C(O)[C@H]1CCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000819252983	DF	On-Demand	Anodyne	CCR5	35	41
O=C(O)[C@@H]1CCN(C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000819252984	DF	On-Demand	Anodyne	SLC6A1	107	40
O=C(O)[C@@H]1CCN(C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000819252984	DF	On-Demand	Anodyne	CCR5	35	41
O=C(O)[C@H]1CCN(C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000819252985	DF	On-Demand	Anodyne	SLC6A1	107	40
O=C(O)[C@H]1CCN(C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000819252985	DF	On-Demand	Anodyne	CCR5	35	41
O=C(O)C1CCN(C(=O)Cc2c[nH]c3cc(Br)ccc23)CC1	ZINC000819252986	FF	On-Demand	Anodyne	HTR1D	24	40
O=C(O)C1CCN(C(=O)Cc2c[nH]c3cc(Br)ccc23)CC1	ZINC000819252986	FF	On-Demand	Anodyne	HTR1B	15	40
O=C(O)C1CCN(C(=O)NC2CCN(C3CCCC3)CC2)CC1	ZINC000819252988	DD	On-Demand	Anodyne	L3MBTL3	71	37
O=C(O)[C@@H]1CCN(C(=O)Cc2cc3ccccc3o2)C1	ZINC000819252991	CD	On-Demand	Anodyne	SLC6A1	59	33
O=C(O)[C@H]1CCN(C(=O)Cc2cc3ccccc3o2)C1	ZINC000819252992	CD	On-Demand	Anodyne	SLC6A1	59	33
O=C(O)[C@@H]1CCN(C(=O)NC2CCN([C@@H]3CCC[C@@H]3O)CC2)C1	ZINC000819252993	EC	On-Demand	Anodyne	SLC18A3	59	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN([C@@H]3CCC[C@@H]3O)CC2)C1	ZINC000819252993	EC	On-Demand	Anodyne	EPHX2	25	40
O=C(O)[C@@H]1CCN(C(=O)NC2CCN([C@H]3CCC[C@H]3O)CC2)C1	ZINC000819252994	EC	On-Demand	Anodyne	SLC18A3	59	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN([C@H]3CCC[C@H]3O)CC2)C1	ZINC000819252994	EC	On-Demand	Anodyne	EPHX2	25	40
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819253041	DB	On-Demand	Anodyne	ADRB2	15	44
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819253041	DB	On-Demand	Anodyne	ADRB1	46	38
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819253042	DB	On-Demand	Anodyne	ADRB2	15	44
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819253042	DB	On-Demand	Anodyne	ADRB1	46	38
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819253043	DB	On-Demand	Anodyne	ADRB2	15	44
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819253043	DB	On-Demand	Anodyne	ADRB1	46	38
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819253044	DB	On-Demand	Anodyne	ADRB2	15	44
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819253044	DB	On-Demand	Anodyne	ADRB1	46	38
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819253056	FD	On-Demand	Anodyne	ADRB2	41	40
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819253056	FD	On-Demand	Anodyne	ADRB1	69	44
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819253056	FD	On-Demand	Anodyne	ADRB3	50	44
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819253056	FD	On-Demand	Anodyne	LUCI_PHOPY	41	33
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819253057	FD	On-Demand	Anodyne	ADRB2	41	40
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819253057	FD	On-Demand	Anodyne	ADRB1	69	44
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819253057	FD	On-Demand	Anodyne	ADRB3	50	44
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819253057	FD	On-Demand	Anodyne	LUCI_PHOPY	41	33
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819253058	FD	On-Demand	Anodyne	ADRB2	41	40
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819253058	FD	On-Demand	Anodyne	ADRB1	69	44
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819253058	FD	On-Demand	Anodyne	ADRB3	50	44
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819253058	FD	On-Demand	Anodyne	LUCI_PHOPY	41	33
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819253060	FD	On-Demand	Anodyne	ADRB2	41	40
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819253060	FD	On-Demand	Anodyne	ADRB1	69	44
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819253060	FD	On-Demand	Anodyne	ADRB3	50	44
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000819253060	FD	On-Demand	Anodyne	LUCI_PHOPY	41	33
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)Cc2nsc3ccccc23)C1	ZINC000819253145	GH	On-Demand	Anodyne	CCR8	71	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)Cc2nsc3ccccc23)C1	ZINC000819253145	GH	On-Demand	Anodyne	SIRT3	40	34
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)Cc2nsc3ccccc23)C1	ZINC000819253145	GH	On-Demand	Anodyne	SIRT1	40	34
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)Cc2nsc3ccccc23)C1	ZINC000819253145	GH	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)Cc2nsc3ccccc23)C1	ZINC000819253146	GH	On-Demand	Anodyne	CCR8	71	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)Cc2nsc3ccccc23)C1	ZINC000819253146	GH	On-Demand	Anodyne	SIRT3	40	34
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)Cc2nsc3ccccc23)C1	ZINC000819253146	GH	On-Demand	Anodyne	SIRT1	40	34
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)Cc2nsc3ccccc23)C1	ZINC000819253146	GH	On-Demand	Anodyne	GPR119	36	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN([C@@H]3CCC[C@H]3O)CC2)C1	ZINC000819253172	EC	On-Demand	Anodyne	SLC18A3	59	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN([C@@H]3CCC[C@H]3O)CC2)C1	ZINC000819253172	EC	On-Demand	Anodyne	EPHX2	25	40
O=C(O)[C@@H]1CCN(C(=O)NC2CCN([C@H]3CCC[C@@H]3O)CC2)C1	ZINC000819253174	EC	On-Demand	Anodyne	SLC18A3	59	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN([C@H]3CCC[C@@H]3O)CC2)C1	ZINC000819253174	EC	On-Demand	Anodyne	EPHX2	25	40
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819253175	ED	On-Demand	Anodyne	SLC6A1	86	38
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819253175	ED	On-Demand	Anodyne	PREP	15	40
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819253175	ED	On-Demand	Anodyne	EPHX2	58	66
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819253175	ED	On-Demand	Anodyne	SFRP1	54	43
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819253175	ED	On-Demand	Anodyne	SMO	42	39
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819253175	ED	On-Demand	Anodyne	L3MBTL3	95	44
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819253176	ED	On-Demand	Anodyne	SLC6A1	86	38
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819253176	ED	On-Demand	Anodyne	PREP	15	40
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819253176	ED	On-Demand	Anodyne	EPHX2	58	66
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819253176	ED	On-Demand	Anodyne	SFRP1	54	43
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819253176	ED	On-Demand	Anodyne	SMO	42	39
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819253176	ED	On-Demand	Anodyne	L3MBTL3	95	44
O=C(O)[C@H]1CCN(C(=O)NC2CCN(S(=O)(=O)C3CC3)CC2)C1	ZINC000819253181	EC	On-Demand	Anodyne	EPHX2	28	56
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(S(=O)(=O)C3CC3)CC2)C1	ZINC000819253183	EC	On-Demand	Anodyne	EPHX2	28	56
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)C3CC3)CC2)C1	ZINC000819253184	DC	On-Demand	Anodyne	EPHX2	28	45
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)C3CC3)CC2)C1	ZINC000819253185	DC	On-Demand	Anodyne	EPHX2	28	45
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	CHRM2	18	42
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	DRD2	19	47
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	CNR1	15	45
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	DRD4	57	52
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	ACHE	19	45
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	SLC6A1	55	37
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	DRD3	15	47
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	KCNH2	15	40
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	CHRM3	23	42
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	HRH3	24	46
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	SIGMAR1	40	63
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	SSTR5	43	37
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	CCR1	37	45
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	CCR3	40	48
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	CCR5	17	42
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	UTS2R	21	40
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	MLNR	40	39
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	LSS	16	40
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	FAAH	18	47
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	CCR2	15	47
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	S1PR1	17	47
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	EPHX2	35	44
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	CXCR3	51	45
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	MCHR1	60	50
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	CACNA1G	31	43
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253187	FE	On-Demand	Anodyne	ARG1	18	40
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	CHRM2	18	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	DRD2	19	47
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	CNR1	15	45
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	DRD4	57	52
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	ACHE	19	45
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	SLC6A1	55	37
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	DRD3	15	47
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	KCNH2	15	40
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	CHRM3	23	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	HRH3	24	46
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	SIGMAR1	40	63
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	SSTR5	43	37
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	CCR1	37	45
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	CCR3	40	48
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	CCR5	17	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	UTS2R	21	40
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	MLNR	40	39
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	LSS	16	40
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	FAAH	18	47
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	CCR2	15	47
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	S1PR1	17	47
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	EPHX2	35	44
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	CXCR3	51	45
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	MCHR1	60	50
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	CACNA1G	31	43
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)C1	ZINC000819253188	FE	On-Demand	Anodyne	ARG1	18	40
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	CHRM2	15	41
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	DRD2	21	53
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	DRD4	38	53
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	ACHE	17	43
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	HTR2A	19	50
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	SLC6A1	77	35
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	KCNH2	22	45
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	CHRM3	21	41
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	HRH3	21	45
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	SIGMAR1	47	62
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	SSTR5	45	40
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	CCR3	105	57
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	CCR5	18	43
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	SLC18A3	24	46
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	MLNR	69	46
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	CCR2	17	44
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	SLC6A5	24	40
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	S1PR1	22	46
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	EPHX2	31	42
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	MCHR1	58	52
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253189	ED	On-Demand	Anodyne	CACNA1G	52	54
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	CHRM2	15	41
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	DRD2	21	53
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	DRD4	38	53
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	ACHE	17	43
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	HTR2A	19	50
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	SLC6A1	77	35
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	KCNH2	22	45
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	CHRM3	21	41
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	HRH3	21	45
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	SIGMAR1	47	62
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	SSTR5	45	40
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	CCR3	105	57
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	CCR5	18	43
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	SLC18A3	24	46
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	MLNR	69	46
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	CCR2	17	44
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	SLC6A5	24	40
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	S1PR1	22	46
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	EPHX2	31	42
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	MCHR1	58	52
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819253191	ED	On-Demand	Anodyne	CACNA1G	52	54
O=C(O)[C@H]1CCN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000819253192	DD	On-Demand	Anodyne	EPHX2	16	40
O=C(O)[C@H]1CCN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000819253192	DD	On-Demand	Anodyne	L3MBTL3	105	44
O=C(O)[C@@H]1CCN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000819253193	DD	On-Demand	Anodyne	EPHX2	16	40
O=C(O)[C@@H]1CCN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000819253193	DD	On-Demand	Anodyne	L3MBTL3	105	44
O=C(O)[C@@H]1CCN(C(=O)Cc2cc(F)cc3c2OCOC3)C1	ZINC000819253198	DD	On-Demand	Anodyne	SLC6A1	52	35
O=C(O)[C@H]1CCN(C(=O)Cc2cc(F)cc3c2OCOC3)C1	ZINC000819253199	DD	On-Demand	Anodyne	SLC6A1	52	35
Cc1noc(C)c1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819253200	FF	On-Demand	Mild	PAPA1_CARPA	44	49
Cc1noc(C)c1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819253205	FF	On-Demand	Mild	PAPA1_CARPA	44	49
O=C(O)[C@H]1CCN(C(=O)Cc2ccc(-n3cccc3)cc2)C1	ZINC000819253206	CD	On-Demand	Anodyne	SLC6A1	48	35
O=C(O)[C@H]1CCN(C(=O)Cc2ccc(-n3cccc3)cc2)C1	ZINC000819253206	CD	On-Demand	Anodyne	KCNJ1	42	33
O=C(O)[C@@H]1CCN(C(=O)Cc2ccc(-n3cccc3)cc2)C1	ZINC000819253207	CD	On-Demand	Anodyne	SLC6A1	48	35
O=C(O)[C@@H]1CCN(C(=O)Cc2ccc(-n3cccc3)cc2)C1	ZINC000819253207	CD	On-Demand	Anodyne	KCNJ1	42	33
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C3CC3)CC2)C1	ZINC000819253208	CC	On-Demand	Anodyne	L3MBTL3	72	39
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C3CC3)CC2)C1	ZINC000819253209	CC	On-Demand	Anodyne	L3MBTL3	72	39
O=C(O)C1CCN(C(=O)NC2CCN(S(=O)(=O)C3CC3)CC2)CC1	ZINC000819253210	FC	On-Demand	Anodyne	EPHX2	23	55
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)c3ccco3)CC2)C1	ZINC000819253213	ED	On-Demand	Anodyne	EPHX2	28	44
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)c3ccco3)CC2)C1	ZINC000819253213	ED	On-Demand	Anodyne	L3MBTL3	55	41
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)c3ccco3)CC2)C1	ZINC000819253214	ED	On-Demand	Anodyne	EPHX2	28	44
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)c3ccco3)CC2)C1	ZINC000819253214	ED	On-Demand	Anodyne	L3MBTL3	55	41
O=C(O)C1CCN(C(=O)NC2CCN([C@@H]3CCC[C@@H]3O)CC2)CC1	ZINC000819253215	EC	On-Demand	Anodyne	SLC18A3	61	41
O=C(O)C1CCN(C(=O)NC2CCN([C@H]3CCC[C@@H]3O)CC2)CC1	ZINC000819253216	EC	On-Demand	Anodyne	SLC18A3	61	41
O=C(O)C1CCN(C(=O)NC2CCN([C@@H]3CCC[C@H]3O)CC2)CC1	ZINC000819253217	EC	On-Demand	Anodyne	SLC18A3	61	41
O=C(O)C1CCN(C(=O)NC2CCN([C@H]3CCC[C@H]3O)CC2)CC1	ZINC000819253218	EC	On-Demand	Anodyne	SLC18A3	61	41
O=C(O)[C@H]1CCN(C(=O)N[C@@H]2CC3(CCC3)Oc3ccccc32)C1	ZINC000819253220	EF	On-Demand	Anodyne	EPHX2	18	45
O=C(O)[C@H]1CCN(C(=O)N[C@H]2CC3(CCC3)Oc3ccccc32)C1	ZINC000819253221	EF	On-Demand	Anodyne	EPHX2	18	45
O=C(O)[C@@H]1CCN(C(=O)N[C@H]2CC3(CCC3)Oc3ccccc32)C1	ZINC000819253223	EF	On-Demand	Anodyne	EPHX2	18	45
O=C(O)[C@@H]1CCN(C(=O)N[C@@H]2CC3(CCC3)Oc3ccccc32)C1	ZINC000819253224	EF	On-Demand	Anodyne	EPHX2	18	45
O=C(O)C1CCN(C(=O)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)CC1	ZINC000819253233	GC	On-Demand	Anodyne	SFRP1	78	32
O=C(O)C1CCN(C(=O)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)CC1	ZINC000819253233	GC	On-Demand	Anodyne	WNT3	42	31
O=C(O)[C@@H]1CCN(C(=O)Cn2c(SC(F)F)nc3ccccc32)C1	ZINC000819253234	FE	On-Demand	Anodyne	HRH1	17	42
O=C(O)[C@@H]1CCN(C(=O)Cn2c(SC(F)F)nc3ccccc32)C1	ZINC000819253234	FE	On-Demand	Anodyne	PDE6D	63	36
O=C(O)[C@H]1CCN(C(=O)Cn2c(SC(F)F)nc3ccccc32)C1	ZINC000819253235	FE	On-Demand	Anodyne	HRH1	17	42
O=C(O)[C@H]1CCN(C(=O)Cn2c(SC(F)F)nc3ccccc32)C1	ZINC000819253235	FE	On-Demand	Anodyne	PDE6D	63	36
O=C(O)C1CCN(C(=O)Cc2cc(Cl)ccc2Br)CC1	ZINC000819253237	FF	On-Demand	Anodyne	FDFT1	21	41
O=C(O)C1CCN(C(=O)Cc2cc(Cl)ccc2Br)CC1	ZINC000819253237	FF	On-Demand	Anodyne	EPHX2	15	53
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)c3ccoc3)CC2)C1	ZINC000819253243	ED	On-Demand	Anodyne	EPHX2	22	48
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(C(=O)c3ccoc3)CC2)C1	ZINC000819253243	ED	On-Demand	Anodyne	L3MBTL3	74	38
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)c3ccoc3)CC2)C1	ZINC000819253244	ED	On-Demand	Anodyne	EPHX2	22	48
O=C(O)[C@H]1CCN(C(=O)NC2CCN(C(=O)c3ccoc3)CC2)C1	ZINC000819253244	ED	On-Demand	Anodyne	L3MBTL3	74	38
O=C(O)[C@@H]1CCN(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1	ZINC000819253249	ED	On-Demand	Anodyne	SLC6A1	76	41
O=C(O)[C@@H]1CCN(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1	ZINC000819253249	ED	On-Demand	Anodyne	CASR	51	38
O=C(O)[C@@H]1CCN(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1	ZINC000819253249	ED	On-Demand	Anodyne	CCR5	28	44
O=C(O)[C@H]1CCN(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1	ZINC000819253250	ED	On-Demand	Anodyne	SLC6A1	76	41
O=C(O)[C@H]1CCN(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1	ZINC000819253250	ED	On-Demand	Anodyne	CASR	51	38
O=C(O)[C@H]1CCN(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1	ZINC000819253250	ED	On-Demand	Anodyne	CCR5	28	44
O=C(O)[C@@H]1CCN(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)C1	ZINC000819253251	ED	On-Demand	Anodyne	SLC6A1	76	41
O=C(O)[C@@H]1CCN(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)C1	ZINC000819253251	ED	On-Demand	Anodyne	CASR	51	38
O=C(O)[C@@H]1CCN(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)C1	ZINC000819253251	ED	On-Demand	Anodyne	CCR5	28	44
O=C(O)[C@H]1CCN(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)C1	ZINC000819253253	ED	On-Demand	Anodyne	SLC6A1	76	41
O=C(O)[C@H]1CCN(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)C1	ZINC000819253253	ED	On-Demand	Anodyne	CASR	51	38
O=C(O)[C@H]1CCN(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)C1	ZINC000819253253	ED	On-Demand	Anodyne	CCR5	28	44
O=C(O)[C@@H]1CCN(C(=O)CSc2nc3ccccc3nc2N2CCCC2)C1	ZINC000819253254	GE	On-Demand	Anodyne	SLC6A1	61	34
O=C(O)[C@H]1CCN(C(=O)CSc2nc3ccccc3nc2N2CCCC2)C1	ZINC000819253255	GE	On-Demand	Anodyne	SLC6A1	61	34
O=C(O)[C@@H]1CCN(C(=O)CSc2cccc[n+]2[O-])C1	ZINC000819253266	CC	On-Demand	Anodyne	SLC6A1	116	36
O=C(O)[C@H]1CCN(C(=O)CSc2cccc[n+]2[O-])C1	ZINC000819253267	CC	On-Demand	Anodyne	SLC6A1	116	36
O=C(O)[C@@H]1CCN(C(=O)Cc2cc(Br)ccc2F)C1	ZINC000819253268	EE	On-Demand	Anodyne	SLC6A1	69	35
O=C(O)[C@H]1CCN(C(=O)Cc2cc(Br)ccc2F)C1	ZINC000819253269	EE	On-Demand	Anodyne	SLC6A1	69	35
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(CC(F)(F)F)CC2)C1	ZINC000819253274	DD	On-Demand	Anodyne	HPGDS	40	49
O=C(O)[C@H]1CCN(C(=O)NC2CCN(CC(F)(F)F)CC2)C1	ZINC000819253275	DD	On-Demand	Anodyne	HPGDS	40	49
O=C(O)C1CCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)CC1	ZINC000819253276	DG	On-Demand	Anodyne	SLC6A1	54	36
O=C(O)C1CCN(C(=O)N[C@H](CC2CC2)c2ccccc2)CC1	ZINC000819253277	DG	On-Demand	Anodyne	SLC6A1	54	36
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000819253280	ED	On-Demand	Anodyne	DRD4	27	57
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000819253280	ED	On-Demand	Anodyne	SLC6A1	57	33
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000819253280	ED	On-Demand	Anodyne	SIGMAR1	22	51
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000819253280	ED	On-Demand	Anodyne	CCR3	18	41
O=C(O)[C@@H]1CCN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000819253280	ED	On-Demand	Anodyne	EPHX2	39	45
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000819253281	ED	On-Demand	Anodyne	DRD4	27	57
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000819253281	ED	On-Demand	Anodyne	SLC6A1	57	33
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000819253281	ED	On-Demand	Anodyne	SIGMAR1	22	51
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000819253281	ED	On-Demand	Anodyne	CCR3	18	41
O=C(O)[C@H]1CCN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000819253281	ED	On-Demand	Anodyne	EPHX2	39	45
O=C(O)[C@@H]1CCN(C(=O)Cc2nnc(O)c3ccccc23)C1	ZINC000819253284	DC	On-Demand	Anodyne	SLC6A1	51	33
O=C(O)[C@H]1CCN(C(=O)Cc2nnc(O)c3ccccc23)C1	ZINC000819253285	DC	On-Demand	Anodyne	SLC6A1	51	33
N#CCc1ccc(OC[C@@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253301	EB	On-Demand	Mild	ADRB1	57	38
N#CCc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253303	EB	On-Demand	Mild	ADRB1	57	38
N#CCc1ccc(OC[C@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253304	EB	On-Demand	Mild	ADRB1	57	38
N#CCc1ccc(OC[C@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253305	EB	On-Demand	Mild	ADRB1	57	38
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCOc3c(F)cccc32)CC1	ZINC000819253364	GG	On-Demand	Anodyne	GPR119	37	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCOc3c(F)cccc32)CC1	ZINC000819253367	GG	On-Demand	Anodyne	GPR119	37	51
CCCCN(C)c1ccc(NC(=O)C[S@@](=O)c2cccc(OC)c2)cc1	ZINC000819253391	FH	On-Demand	Anodyne	MTNR1A	30	53
CCCCN(C)c1ccc(NC(=O)C[S@@](=O)c2cccc(OC)c2)cc1	ZINC000819253391	FH	On-Demand	Anodyne	MTNR1B	35	53
CCCCN(C)c1ccc(NC(=O)C[S@](=O)c2cccc(OC)c2)cc1	ZINC000819253393	FH	On-Demand	Anodyne	MTNR1A	30	53
CCCCN(C)c1ccc(NC(=O)C[S@](=O)c2cccc(OC)c2)cc1	ZINC000819253393	FH	On-Demand	Anodyne	MTNR1B	35	53
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253405	FB	On-Demand	Anodyne	ADRB2	37	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253405	FB	On-Demand	Anodyne	ADRB1	71	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253405	FB	On-Demand	Anodyne	ADRB3	45	48
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253407	FB	On-Demand	Anodyne	ADRB2	37	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253407	FB	On-Demand	Anodyne	ADRB1	71	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253407	FB	On-Demand	Anodyne	ADRB3	45	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253408	FB	On-Demand	Anodyne	ADRB2	37	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253408	FB	On-Demand	Anodyne	ADRB1	71	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253408	FB	On-Demand	Anodyne	ADRB3	45	48
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253410	FB	On-Demand	Anodyne	ADRB2	37	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253410	FB	On-Demand	Anodyne	ADRB1	71	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253410	FB	On-Demand	Anodyne	ADRB3	45	48
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819253411	CB	On-Demand	Anodyne	ADRB2	44	45
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819253411	CB	On-Demand	Anodyne	ADRB1	71	47
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819253411	CB	On-Demand	Anodyne	ADRB3	47	47
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819253413	CB	On-Demand	Anodyne	ADRB2	44	45
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819253413	CB	On-Demand	Anodyne	ADRB1	71	47
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819253413	CB	On-Demand	Anodyne	ADRB3	47	47
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819253415	CB	On-Demand	Anodyne	ADRB2	44	45
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819253415	CB	On-Demand	Anodyne	ADRB1	71	47
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819253415	CB	On-Demand	Anodyne	ADRB3	47	47
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819253417	CB	On-Demand	Anodyne	ADRB2	44	45
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819253417	CB	On-Demand	Anodyne	ADRB1	71	47
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819253417	CB	On-Demand	Anodyne	ADRB3	47	47
CN(C)C1(CNC[C@H](O)c2cccc(Cl)c2)CCC1	ZINC000819253498	CE	On-Demand	Anodyne	ADRB2	21	40
CN(C)C1(CNC[C@H](O)c2cccc(Cl)c2)CCC1	ZINC000819253498	CE	On-Demand	Anodyne	ADRB1	40	46
CN(C)C1(CNC[C@H](O)c2cccc(Cl)c2)CCC1	ZINC000819253498	CE	On-Demand	Anodyne	ADRB3	55	43
CN(C)C1(CNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819253500	CE	On-Demand	Anodyne	ADRB2	21	40
CN(C)C1(CNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819253500	CE	On-Demand	Anodyne	ADRB1	40	46
CN(C)C1(CNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819253500	CE	On-Demand	Anodyne	ADRB3	55	43
CN(Cc1ccc(F)cc1Cl)C(=O)C(F)=C1CCC1	ZINC000819253505	CH	On-Demand	Anodyne	P2RX7	55	41
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](c2ccccc2F)C1	ZINC000819253532	CF	On-Demand	Anodyne	RBP4	40	36
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](c2ccccc2F)C1	ZINC000819253534	CF	On-Demand	Anodyne	RBP4	40	36
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](c2ccccc2F)C1	ZINC000819253536	CF	On-Demand	Anodyne	RBP4	40	36
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](c2ccccc2F)C1	ZINC000819253538	CF	On-Demand	Anodyne	RBP4	40	36
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819253624	FC	On-Demand	Anodyne	ADRB1	15	43
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819253624	FC	On-Demand	Anodyne	PDS	44	38
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819253626	FC	On-Demand	Anodyne	ADRB1	15	43
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819253626	FC	On-Demand	Anodyne	PDS	44	38
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819253627	FC	On-Demand	Anodyne	ADRB1	15	43
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819253627	FC	On-Demand	Anodyne	PDS	44	38
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819253629	FC	On-Demand	Anodyne	ADRB1	15	43
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819253629	FC	On-Demand	Anodyne	PDS	44	38
CC#CCN(C)C(=O)c1ccc(COc2ccc3c(C)cc(=O)oc3c2)cc1	ZINC000819253688	GH	On-Demand	Mild	MAOA	65	48
CC#CCN(C)C(=O)c1ccc(COc2ccc3c(C)cc(=O)oc3c2)cc1	ZINC000819253688	GH	On-Demand	Mild	MAOB	67	58
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253706	HI	On-Demand	Anodyne	PAPA1_CARPA	36	48
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253706	HI	On-Demand	Anodyne	CCKAR	21	47
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253706	HI	On-Demand	Anodyne	REN	32	41
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253706	HI	On-Demand	Anodyne	FPR1	67	50
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253707	HI	On-Demand	Anodyne	PAPA1_CARPA	36	48
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253707	HI	On-Demand	Anodyne	CCKAR	21	47
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253707	HI	On-Demand	Anodyne	REN	32	41
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253707	HI	On-Demand	Anodyne	FPR1	67	50
Cc1nc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)nn1-c1ccccc1	ZINC000819253716	FH	On-Demand	Anodyne	CNR1	15	43
CS(=O)(=O)Nc1cccc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819253726	GG	On-Demand	Anodyne	NR3C2	18	41
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819253731	GI	On-Demand	Anodyne	EPHX2	15	40
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819253731	GI	On-Demand	Anodyne	GPR119	33	40
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819253731	GI	On-Demand	Anodyne	SFRP1	39	42
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819253732	GI	On-Demand	Anodyne	EPHX2	15	40
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819253732	GI	On-Demand	Anodyne	GPR119	33	40
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819253732	GI	On-Demand	Anodyne	SFRP1	39	42
O=C(/C=C/C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)Nc1ccc2n[nH]cc2c1	ZINC000819253735	GH	On-Demand	Anodyne	NR2E3	45	31
O=C(/C=C\C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)Nc1ccc2n[nH]cc2c1	ZINC000819253736	GH	On-Demand	Anodyne	NR2E3	45	31
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	ACE	50	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	CELA1	16	52
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	ELANE	29	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	MME	54	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	CASP3	20	49
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	BMP1	18	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	KLK3	81	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	CTSB	75	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	PAPA1_CARPA	80	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	CYSP_TRYCR	58	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	CTSK	46	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	CTSL	50	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	PGA	22	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	CAPNS1	71	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	HLA-DRB1	55	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	PYGM	41	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	CTSS	26	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	CAPN1	98	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	CASP1	33	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	CAPN2	154	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	PLAU	15	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	CASP6	20	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	CASP9	42	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	NPR	83	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	NAAA	58	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	PSMB5	51	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	BIRC3	50	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	BIRC2	49	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	BIRC8	46	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253746	GI	On-Demand	Anodyne	Q6PRC7_IXORI	52	39
C[C@H](CC(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)NC(=O)OC(C)(C)C	ZINC000819253750	FI	On-Demand	Anodyne	FPR1	47	38
O=C(CCc1nc(O)c2cnn(-c3ccccc3)c2n1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253752	II	On-Demand	Anodyne	TNKS	46	32
CC#CCN(C)C(=O)c1ccc(N2CCOCC2)nc1	ZINC000819253755	CD	On-Demand	Mild	HPGDS	20	44
Cn1nc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c2ccccc2c1=O	ZINC000819253757	FG	On-Demand	Anodyne	HTR3A	18	49
Cn1nc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c2ccccc2c1=O	ZINC000819253757	FG	On-Demand	Anodyne	IMDH_CRYPV	24	40
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819253758	GH	On-Demand	Anodyne	EPHX2	39	50
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819253758	GH	On-Demand	Anodyne	GPR119	31	41
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819253758	GH	On-Demand	Anodyne	SFRP1	40	43
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819253759	GH	On-Demand	Anodyne	EPHX2	39	50
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819253759	GH	On-Demand	Anodyne	GPR119	31	41
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819253759	GH	On-Demand	Anodyne	SFRP1	40	43
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253760	GG	On-Demand	Anodyne	PGC	46	33
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253760	GG	On-Demand	Anodyne	PAPA1_CARPA	40	43
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253760	GG	On-Demand	Anodyne	CTSK	16	40
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253760	GG	On-Demand	Anodyne	CTSL	18	43
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253760	GG	On-Demand	Anodyne	REN	40	40
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253760	GG	On-Demand	Anodyne	FPR1	48	40
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253761	GG	On-Demand	Anodyne	PGC	46	33
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253761	GG	On-Demand	Anodyne	PAPA1_CARPA	40	43
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253761	GG	On-Demand	Anodyne	CTSK	16	40
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253761	GG	On-Demand	Anodyne	CTSL	18	43
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253761	GG	On-Demand	Anodyne	REN	40	40
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253761	GG	On-Demand	Anodyne	FPR1	48	40
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253766	IF	On-Demand	Anodyne	ACE	24	40
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253766	IF	On-Demand	Anodyne	CASP3	24	48
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253766	IF	On-Demand	Anodyne	BMP1	16	42
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253766	IF	On-Demand	Anodyne	KLK3	82	46
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253766	IF	On-Demand	Anodyne	CTSB	66	46
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253766	IF	On-Demand	Anodyne	PAPA1_CARPA	64	38
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253766	IF	On-Demand	Anodyne	CYSP_TRYCR	58	44
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253766	IF	On-Demand	Anodyne	CTSK	41	51
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253766	IF	On-Demand	Anodyne	CTSL	52	46
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253766	IF	On-Demand	Anodyne	CAPNS1	69	39
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253766	IF	On-Demand	Anodyne	CTSS	21	48
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253766	IF	On-Demand	Anodyne	CAPN1	87	44
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253766	IF	On-Demand	Anodyne	CASP1	29	49
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253766	IF	On-Demand	Anodyne	CAPN2	144	46
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253766	IF	On-Demand	Anodyne	CASP6	19	42
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253766	IF	On-Demand	Anodyne	CASP9	43	42
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253766	IF	On-Demand	Anodyne	TGM2	26	40
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253766	IF	On-Demand	Anodyne	NPR	67	34
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253766	IF	On-Demand	Anodyne	PSMB5	42	41
O=C(C(F)=C1CCC1)N1CC[C@@H](c2ccccc2F)C1	ZINC000819253782	CH	On-Demand	Anodyne	RBP4	66	40
O=C(C(F)=C1CCC1)N1CC[C@H](c2ccccc2F)C1	ZINC000819253784	CH	On-Demand	Anodyne	RBP4	66	40
O=C(CCCNC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253799	HI	On-Demand	Anodyne	CAPNS1	42	31
O=C(CCCNC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253799	HI	On-Demand	Anodyne	CAPN1	50	42
O=C(CCCNC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253799	HI	On-Demand	Anodyne	CAPN2	95	42
O=C(CCCNC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253799	HI	On-Demand	Anodyne	TGM2	34	40
O=C(CCCNC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253799	HI	On-Demand	Anodyne	NPR	57	35
CC1(C)CCC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819253800	CG	On-Demand	Bother	CACNA1C	42	34
CC1(C)CCC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819253800	CG	On-Demand	Bother	CACNA1D	65	33
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819253802	HI	On-Demand	Anodyne	SFRP1	96	40
CC(C)(C)OC(=O)N1CCC[C@@H](OCC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819253802	HI	On-Demand	Anodyne	WNT3	68	36
CC1(C)CCC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819253804	CG	On-Demand	Bother	CACNA1C	42	34
CC1(C)CCC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819253804	CG	On-Demand	Bother	CACNA1D	65	33
COc1ccc(OC)c([C@H](O)CNCCN2CCc3c(Cl)cccc3C2)c1	ZINC000819253820	GG	On-Demand	Anodyne	DRD4	47	39
COc1ccc(OC)c([C@H](O)CNCCN2CCc3c(Cl)cccc3C2)c1	ZINC000819253820	GG	On-Demand	Anodyne	DRD3	21	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819253856	GE	On-Demand	Anodyne	SIRT3	48	38
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819253856	GE	On-Demand	Anodyne	SIRT2	49	38
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819253856	GE	On-Demand	Anodyne	SIRT1	48	38
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819253856	GE	On-Demand	Anodyne	GPR119	44	47
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819253858	GE	On-Demand	Anodyne	SIRT3	48	38
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819253858	GE	On-Demand	Anodyne	SIRT2	49	38
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819253858	GE	On-Demand	Anodyne	SIRT1	48	38
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819253858	GE	On-Demand	Anodyne	GPR119	44	47
NC(=O)C1=NO[C@H](CNCCC(=O)Nc2ccc(Oc3ccccc3)cc2)C1	ZINC000819253861	GE	On-Demand	Anodyne	LTA4H	43	45
NC(=O)C1=NO[C@H](CNCCC(=O)Nc2ccc(Oc3ccccc3)cc2)C1	ZINC000819253861	GE	On-Demand	Anodyne	F13A1	21	41
NC(=O)C1=NO[C@@H](CNCCC(=O)Nc2ccc(Oc3ccccc3)cc2)C1	ZINC000819253863	GE	On-Demand	Anodyne	LTA4H	43	45
NC(=O)C1=NO[C@@H](CNCCC(=O)Nc2ccc(Oc3ccccc3)cc2)C1	ZINC000819253863	GE	On-Demand	Anodyne	F13A1	21	41
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253917	GF	On-Demand	Anodyne	HTR1A	73	56
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253917	GF	On-Demand	Anodyne	DRD2	63	52
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253917	GF	On-Demand	Anodyne	DRD4	45	37
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253917	GF	On-Demand	Anodyne	ADRA1D	30	42
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253917	GF	On-Demand	Anodyne	HTR2A	69	54
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253917	GF	On-Demand	Anodyne	HTR2C	38	51
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253917	GF	On-Demand	Anodyne	SLC6A4	19	51
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253917	GF	On-Demand	Anodyne	ADRA1A	36	48
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253917	GF	On-Demand	Anodyne	ADRA1B	27	42
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253917	GF	On-Demand	Anodyne	DRD3	92	48
O=C(/C=C\[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253917	GF	On-Demand	Anodyne	HTR7	72	46
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253919	GF	On-Demand	Anodyne	HTR1A	73	56
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253919	GF	On-Demand	Anodyne	DRD2	63	52
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253919	GF	On-Demand	Anodyne	DRD4	45	37
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253919	GF	On-Demand	Anodyne	ADRA1D	30	42
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253919	GF	On-Demand	Anodyne	HTR2A	69	54
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253919	GF	On-Demand	Anodyne	HTR2C	38	51
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253919	GF	On-Demand	Anodyne	SLC6A4	19	51
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253919	GF	On-Demand	Anodyne	ADRA1A	36	48
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253919	GF	On-Demand	Anodyne	ADRA1B	27	42
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253919	GF	On-Demand	Anodyne	DRD3	92	48
O=C(/C=C/[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253919	GF	On-Demand	Anodyne	HTR7	72	46
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253921	GF	On-Demand	Anodyne	HTR1A	73	56
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253921	GF	On-Demand	Anodyne	DRD2	63	52
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253921	GF	On-Demand	Anodyne	DRD4	45	37
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253921	GF	On-Demand	Anodyne	ADRA1D	30	42
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253921	GF	On-Demand	Anodyne	HTR2A	69	54
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253921	GF	On-Demand	Anodyne	HTR2C	38	51
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253921	GF	On-Demand	Anodyne	SLC6A4	19	51
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253921	GF	On-Demand	Anodyne	ADRA1A	36	48
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253921	GF	On-Demand	Anodyne	ADRA1B	27	42
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253921	GF	On-Demand	Anodyne	DRD3	92	48
O=C(/C=C\[C@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253921	GF	On-Demand	Anodyne	HTR7	72	46
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253923	GF	On-Demand	Anodyne	HTR1A	73	56
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253923	GF	On-Demand	Anodyne	DRD2	63	52
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253923	GF	On-Demand	Anodyne	DRD4	45	37
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253923	GF	On-Demand	Anodyne	ADRA1D	30	42
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253923	GF	On-Demand	Anodyne	HTR2A	69	54
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253923	GF	On-Demand	Anodyne	HTR2C	38	51
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253923	GF	On-Demand	Anodyne	SLC6A4	19	51
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253923	GF	On-Demand	Anodyne	ADRA1A	36	48
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253923	GF	On-Demand	Anodyne	ADRA1B	27	42
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253923	GF	On-Demand	Anodyne	DRD3	92	48
O=C(/C=C/[C@@H]1CCCO1)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819253923	GF	On-Demand	Anodyne	HTR7	72	46
CSc1ccc(OC[C@@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253967	EC	On-Demand	Anodyne	ADRB1	44	38
CSc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253968	EC	On-Demand	Anodyne	ADRB1	44	38
CSc1ccc(OC[C@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253969	EC	On-Demand	Anodyne	ADRB1	44	38
CSc1ccc(OC[C@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819253970	EC	On-Demand	Anodyne	ADRB1	44	38
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819253986	HI	On-Demand	Anodyne	SFRP1	96	40
CC(C)(C)OC(=O)N1CCC[C@H](OCC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819253986	HI	On-Demand	Anodyne	WNT3	68	36
NS(=O)(=O)c1cc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)ccc1Cl	ZINC000819253991	GG	On-Demand	Anodyne	CA2	22	51
NS(=O)(=O)c1cc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)ccc1Cl	ZINC000819253991	GG	On-Demand	Anodyne	CA6	20	49
NS(=O)(=O)c1cc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)ccc1Cl	ZINC000819253991	GG	On-Demand	Anodyne	CA1	20	51
NS(=O)(=O)c1cc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)ccc1Cl	ZINC000819253991	GG	On-Demand	Anodyne	CA7	24	49
NS(=O)(=O)c1cc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)ccc1Cl	ZINC000819253991	GG	On-Demand	Anodyne	CA13	33	49
NS(=O)(=O)c1cc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)ccc1Cl	ZINC000819253991	GG	On-Demand	Anodyne	CA4	22	51
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	ACE	35	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	CTRA_BOVIN	53	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	CASP3	20	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	BMP1	15	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	KLK3	96	49
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	CTSB	66	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	PAPA1_CARPA	70	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	CYSP_TRYCR	60	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	CTSG	42	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	CTSK	44	50
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	CTSL	52	48
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	NPFFR2	45	34
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	CAPNS1	66	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	CELA2A	50	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	HDAC2	15	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	MMP11	50	32
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	CTSS	21	50
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	CAPN1	87	52
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	CASP1	27	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	CAPN2	140	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	CASP9	35	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	TGM2	31	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	NPR	61	32
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	CASP10	34	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819253994	IG	On-Demand	Anodyne	PSMB5	45	40
CC(C)(C)OC(=O)N1CCC(OCC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)CC1	ZINC000819253999	HI	On-Demand	Anodyne	GPR119	36	42
CN(CCCC(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)C1=NS(=O)(=O)c2ccccc21	ZINC000819254032	IH	On-Demand	Anodyne	KCNA3	27	43
CS(=O)(=O)Nc1ccc(/C=C/C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cc1	ZINC000819254034	HH	On-Demand	Anodyne	HDAC1	20	42
CS(=O)(=O)Nc1ccc(/C=C\C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cc1	ZINC000819254035	HH	On-Demand	Anodyne	HDAC1	20	42
O=C(N[C@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254044	IK	On-Demand	Anodyne	CASP3	15	53
O=C(N[C@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254044	IK	On-Demand	Anodyne	KLK3	67	35
O=C(N[C@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254044	IK	On-Demand	Anodyne	CTSB	58	41
O=C(N[C@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254044	IK	On-Demand	Anodyne	PAPA1_CARPA	46	35
O=C(N[C@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254044	IK	On-Demand	Anodyne	CYSP_TRYCR	51	38
O=C(N[C@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254044	IK	On-Demand	Anodyne	CTSK	36	44
O=C(N[C@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254044	IK	On-Demand	Anodyne	CTSL	45	39
O=C(N[C@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254044	IK	On-Demand	Anodyne	CAPNS1	63	35
O=C(N[C@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254044	IK	On-Demand	Anodyne	CTSS	17	42
O=C(N[C@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254044	IK	On-Demand	Anodyne	CAPN1	80	40
O=C(N[C@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254044	IK	On-Demand	Anodyne	CASP1	24	43
O=C(N[C@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254044	IK	On-Demand	Anodyne	CAPN2	136	41
O=C(N[C@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254044	IK	On-Demand	Anodyne	NPR	62	34
O=C(N[C@@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254045	IK	On-Demand	Anodyne	CASP3	15	53
O=C(N[C@@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254045	IK	On-Demand	Anodyne	KLK3	67	35
O=C(N[C@@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254045	IK	On-Demand	Anodyne	CTSB	58	41
O=C(N[C@@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254045	IK	On-Demand	Anodyne	PAPA1_CARPA	46	35
O=C(N[C@@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254045	IK	On-Demand	Anodyne	CYSP_TRYCR	51	38
O=C(N[C@@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254045	IK	On-Demand	Anodyne	CTSK	36	44
O=C(N[C@@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254045	IK	On-Demand	Anodyne	CTSL	45	39
O=C(N[C@@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254045	IK	On-Demand	Anodyne	CAPNS1	63	35
O=C(N[C@@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254045	IK	On-Demand	Anodyne	CTSS	17	42
O=C(N[C@@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254045	IK	On-Demand	Anodyne	CAPN1	80	40
O=C(N[C@@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254045	IK	On-Demand	Anodyne	CASP1	24	43
O=C(N[C@@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254045	IK	On-Demand	Anodyne	CAPN2	136	41
O=C(N[C@@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1ccccc1)OCc1ccccc1	ZINC000819254045	IK	On-Demand	Anodyne	NPR	62	34
CC#CCN(C)C(=O)c1sccc1NC(=O)c1ccc(Br)cc1	ZINC000819254046	GH	On-Demand	Mild	FAS	31	47
CC(C)(C)OC(=O)N1CCC(SCC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)CC1	ZINC000819254047	IJ	On-Demand	Anodyne	GPR119	37	40
NS(=O)(=O)c1cc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)ccc1F	ZINC000819254088	GF	On-Demand	Anodyne	CA2	15	43
NS(=O)(=O)c1cc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)ccc1F	ZINC000819254088	GF	On-Demand	Anodyne	CA13	16	40
NS(=O)(=O)c1cc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)ccc1F	ZINC000819254088	GF	On-Demand	Anodyne	CA4	15	41
Cc1cccc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1NC(=O)c1ccncc1	ZINC000819254089	HJ	On-Demand	Anodyne	LCK	37	41
CCCCN(C)c1ccc(NC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819254103	FI	On-Demand	Anodyne	MTNR1A	15	41
CCCCN(C)c1ccc(NC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819254103	FI	On-Demand	Anodyne	MTNR1B	19	41
O=C(/C=C\c1cccc(O)c1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254114	EI	On-Demand	Anodyne	MMP2	16	59
O=C(/C=C\c1cccc(O)c1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254114	EI	On-Demand	Anodyne	MMP9	15	59
O=C(/C=C/c1cccc(O)c1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254116	EI	On-Demand	Anodyne	MMP2	16	59
O=C(/C=C/c1cccc(O)c1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254116	EI	On-Demand	Anodyne	MMP9	15	59
O[C@@H](CN[C@H]1CCOc2c(F)cccc21)c1cccnc1	ZINC000819254144	CE	On-Demand	Anodyne	ADRB3	42	38
O[C@H](CN[C@H]1CCOc2c(F)cccc21)c1cccnc1	ZINC000819254145	CE	On-Demand	Anodyne	ADRB3	42	38
CN(C)C1(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCC1	ZINC000819254208	FE	On-Demand	Anodyne	GPR119	35	42
CN(C)C1(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCC1	ZINC000819254209	FE	On-Demand	Anodyne	GPR119	35	42
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819254217	DB	On-Demand	Anodyne	ADRB1	53	43
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819254218	DB	On-Demand	Anodyne	ADRB1	53	43
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819254219	DB	On-Demand	Anodyne	ADRB1	53	43
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819254220	DB	On-Demand	Anodyne	ADRB1	53	43
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819254238	FC	On-Demand	Anodyne	ADRB1	46	43
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819254239	FC	On-Demand	Anodyne	ADRB1	46	43
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819254240	FC	On-Demand	Anodyne	ADRB1	46	43
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819254241	FC	On-Demand	Anodyne	ADRB1	46	43
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819254246	FC	On-Demand	Anodyne	ADRB1	23	41
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2cccc(Br)c2)C1	ZINC000819254247	FC	On-Demand	Anodyne	ADRB1	23	41
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819254248	FC	On-Demand	Anodyne	ADRB1	23	41
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819254249	FC	On-Demand	Anodyne	ADRB1	23	41
COC[C@@H](O)CNCc1ccccc1C(C)C	ZINC000819254278	BD	On-Demand	Anodyne	ADRB2	25	42
O=C(CCCCNC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254293	HJ	On-Demand	Anodyne	HDAC2	15	41
O=C(CCCCNC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254293	HJ	On-Demand	Anodyne	CAPN1	49	40
O=C(CCCCNC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254293	HJ	On-Demand	Anodyne	CAPN2	92	40
O=C(CCCCNC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254293	HJ	On-Demand	Anodyne	TGM2	34	42
O=C(CCCCNC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254293	HJ	On-Demand	Anodyne	NPR	56	36
O=C(CCCCNC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254293	HJ	On-Demand	Anodyne	NAAA	15	40
Cn1nc(Br)cc1C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254294	FH	On-Demand	Anodyne	INHA	66	35
CC#CCN(C)C(=O)C(C)(C)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819254296	FH	On-Demand	Mild	ALOX5	16	49
CC#CCN(C)C(=O)C(C)(C)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819254296	FH	On-Demand	Mild	MAOB	18	42
CC#CCN(C)C(=O)C(C)(C)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819254296	FH	On-Demand	Mild	LTA4H	17	41
CC#CCN(C)C(=O)C(C)(C)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819254296	FH	On-Demand	Mild	CYP26A1	40	36
CC#CCN(C)C(=O)C(C)(C)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819254296	FH	On-Demand	Mild	FFAR1	39	50
CC#CCN(C)C(=O)C(C)(C)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819254297	FH	On-Demand	Mild	ALOX5	16	49
CC#CCN(C)C(=O)C(C)(C)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819254297	FH	On-Demand	Mild	MAOB	18	42
CC#CCN(C)C(=O)C(C)(C)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819254297	FH	On-Demand	Mild	LTA4H	17	41
CC#CCN(C)C(=O)C(C)(C)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819254297	FH	On-Demand	Mild	CYP26A1	40	36
CC#CCN(C)C(=O)C(C)(C)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819254297	FH	On-Demand	Mild	FFAR1	39	50
CC#CCN(C)C(=O)CNC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819254320	DF	On-Demand	Mild	PRNP	22	40
CC#CCN(C)C(=O)CNC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819254320	DF	On-Demand	Mild	UTS2	52	39
COc1cc(NC(=O)[C@H]2C[C@H]2C)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cc1OC	ZINC000819254321	IJ	On-Demand	Anodyne	DRD2	19	40
COc1cc(NC(=O)[C@H]2C[C@H]2C)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cc1OC	ZINC000819254321	IJ	On-Demand	Anodyne	DRD4	16	44
COc1cc(NC(=O)[C@H]2C[C@H]2C)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cc1OC	ZINC000819254321	IJ	On-Demand	Anodyne	HTR4	35	41
COc1cc(NC(=O)[C@H]2C[C@@H]2C)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cc1OC	ZINC000819254324	IJ	On-Demand	Anodyne	DRD2	19	40
COc1cc(NC(=O)[C@H]2C[C@@H]2C)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cc1OC	ZINC000819254324	IJ	On-Demand	Anodyne	DRD4	16	44
COc1cc(NC(=O)[C@H]2C[C@@H]2C)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cc1OC	ZINC000819254324	IJ	On-Demand	Anodyne	HTR4	35	41
COc1cc(NC(=O)[C@@H]2C[C@H]2C)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cc1OC	ZINC000819254326	IJ	On-Demand	Anodyne	DRD2	19	40
COc1cc(NC(=O)[C@@H]2C[C@H]2C)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cc1OC	ZINC000819254326	IJ	On-Demand	Anodyne	DRD4	16	44
COc1cc(NC(=O)[C@@H]2C[C@H]2C)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cc1OC	ZINC000819254326	IJ	On-Demand	Anodyne	HTR4	35	41
CCOC(=O)N1CCC(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)CC1	ZINC000819254344	FH	On-Demand	Anodyne	P2RY12	41	38
CCOC(=O)N1CCC(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)CC1	ZINC000819254344	FH	On-Demand	Anodyne	EPHX2	47	48
CC(C)(C)OC(=O)N1CCC(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)CC1	ZINC000819254346	GI	On-Demand	Anodyne	EPHX2	39	52
CC(C)(C)OC(=O)N1CCC(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)CC1	ZINC000819254346	GI	On-Demand	Anodyne	CCR8	15	40
CC(C)(C)OC(=O)N1CCC(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)CC1	ZINC000819254346	GI	On-Demand	Anodyne	GPR119	39	46
CC(C)(C)OC(=O)N1CCC(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)CC1	ZINC000819254346	GI	On-Demand	Anodyne	SFRP1	31	42
NS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819254351	GF	On-Demand	Anodyne	CA2	42	46
NS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819254351	GF	On-Demand	Anodyne	CA1	33	46
NS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819254351	GF	On-Demand	Anodyne	CA7	39	46
NS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819254351	GF	On-Demand	Anodyne	CA5B	36	41
NS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819254351	GF	On-Demand	Anodyne	CA4	35	45
NS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819254351	GF	On-Demand	Anodyne	CA5A	38	41
NS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819254351	GF	On-Demand	Anodyne	CA14	16	46
NS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819254351	GF	On-Demand	Anodyne	CA12	25	46
NS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819254351	GF	On-Demand	Anodyne	CA9	28	45
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1nc(-c2ccccc2)cs1	ZINC000819254371	EH	On-Demand	Anodyne	UL26	86	36
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1nc(-c2ccccc2)cs1	ZINC000819254371	EH	On-Demand	Anodyne	SCAF_EBVB9	75	36
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1nc(-c2ccccc2)cs1	ZINC000819254373	EH	On-Demand	Anodyne	UL26	86	36
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1nc(-c2ccccc2)cs1	ZINC000819254373	EH	On-Demand	Anodyne	SCAF_EBVB9	75	36
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1nc(-c2ccccc2)cs1	ZINC000819254375	EH	On-Demand	Anodyne	UL26	86	36
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1nc(-c2ccccc2)cs1	ZINC000819254375	EH	On-Demand	Anodyne	SCAF_EBVB9	75	36
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1nc(-c2ccccc2)cs1	ZINC000819254376	EH	On-Demand	Anodyne	UL26	86	36
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1nc(-c2ccccc2)cs1	ZINC000819254376	EH	On-Demand	Anodyne	SCAF_EBVB9	75	36
O=C(/C=C/c1ccc(O)cc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254377	EI	On-Demand	Anodyne	F3	25	40
O=C(/C=C/c1ccc(O)cc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254377	EI	On-Demand	Anodyne	MMP2	15	55
O=C(/C=C/c1ccc(O)cc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254377	EI	On-Demand	Anodyne	MMP9	15	55
O[C@H](CNCCN1CCc2c(Cl)cccc2C1)c1cccnc1	ZINC000819254378	EE	On-Demand	Anodyne	ADRB2	27	43
O[C@H](CNCCN1CCc2c(Cl)cccc2C1)c1cccnc1	ZINC000819254378	EE	On-Demand	Anodyne	ADRB1	37	40
O[C@H](CNCCN1CCc2c(Cl)cccc2C1)c1cccnc1	ZINC000819254378	EE	On-Demand	Anodyne	ADRB3	112	46
O[C@H](CNCCN1CCc2c(Cl)cccc2C1)c1cccnc1	ZINC000819254378	EE	On-Demand	Anodyne	SCD	20	46
O=C(/C=C\c1ccc(O)cc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254379	EI	On-Demand	Anodyne	F3	25	40
O=C(/C=C\c1ccc(O)cc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254379	EI	On-Demand	Anodyne	MMP2	15	55
O=C(/C=C\c1ccc(O)cc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254379	EI	On-Demand	Anodyne	MMP9	15	55
O[C@@H](CNCCN1CCc2c(Cl)cccc2C1)c1cccnc1	ZINC000819254380	EE	On-Demand	Anodyne	ADRB2	27	43
O[C@@H](CNCCN1CCc2c(Cl)cccc2C1)c1cccnc1	ZINC000819254380	EE	On-Demand	Anodyne	ADRB1	37	40
O[C@@H](CNCCN1CCc2c(Cl)cccc2C1)c1cccnc1	ZINC000819254380	EE	On-Demand	Anodyne	ADRB3	112	46
O[C@@H](CNCCN1CCc2c(Cl)cccc2C1)c1cccnc1	ZINC000819254380	EE	On-Demand	Anodyne	SCD	20	46
C[C@@H](CCNC[C@@H](O)c1cccnc1)CC(C)(C)C	ZINC000819254382	CG	On-Demand	Anodyne	ADRB2	29	46
C[C@@H](CCNC[C@@H](O)c1cccnc1)CC(C)(C)C	ZINC000819254382	CG	On-Demand	Anodyne	ADRB1	31	46
C[C@@H](CCNC[C@@H](O)c1cccnc1)CC(C)(C)C	ZINC000819254382	CG	On-Demand	Anodyne	ADRB3	105	49
C[C@H](CCNC[C@H](O)c1cccnc1)CC(C)(C)C	ZINC000819254384	CG	On-Demand	Anodyne	ADRB2	29	46
C[C@H](CCNC[C@H](O)c1cccnc1)CC(C)(C)C	ZINC000819254384	CG	On-Demand	Anodyne	ADRB1	31	46
C[C@H](CCNC[C@H](O)c1cccnc1)CC(C)(C)C	ZINC000819254384	CG	On-Demand	Anodyne	ADRB3	105	49
C[C@H](CCNC[C@@H](O)c1cccnc1)CC(C)(C)C	ZINC000819254386	CG	On-Demand	Anodyne	ADRB2	29	46
C[C@H](CCNC[C@@H](O)c1cccnc1)CC(C)(C)C	ZINC000819254386	CG	On-Demand	Anodyne	ADRB1	31	46
C[C@H](CCNC[C@@H](O)c1cccnc1)CC(C)(C)C	ZINC000819254386	CG	On-Demand	Anodyne	ADRB3	105	49
C[C@@H](CCNC[C@H](O)c1cccnc1)CC(C)(C)C	ZINC000819254387	CG	On-Demand	Anodyne	ADRB2	29	46
C[C@@H](CCNC[C@H](O)c1cccnc1)CC(C)(C)C	ZINC000819254387	CG	On-Demand	Anodyne	ADRB1	31	46
C[C@@H](CCNC[C@H](O)c1cccnc1)CC(C)(C)C	ZINC000819254387	CG	On-Demand	Anodyne	ADRB3	105	49
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)Cc1ccc(F)cc1Cl)C2	ZINC000819254405	FG	On-Demand	Anodyne	P2RX7	53	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)Cc1ccc(F)cc1Cl)C2	ZINC000819254406	FG	On-Demand	Anodyne	P2RX7	53	41
CON(C)C(=O)CCNCCN1CCc2c(Cl)cccc2C1	ZINC000819254438	ED	On-Demand	Anodyne	DRD4	44	37
O[C@@H](CNCCN1CCc2c(Cl)cccc2C1)c1ccccc1	ZINC000819254441	EG	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNCCN1CCc2c(Cl)cccc2C1)c1ccccc1	ZINC000819254441	EG	On-Demand	Anodyne	ADRB3	52	40
O[C@H](CNCCN1CCc2c(Cl)cccc2C1)c1ccccc1	ZINC000819254442	EG	On-Demand	Anodyne	ADRB1	27	40
O[C@H](CNCCN1CCc2c(Cl)cccc2C1)c1ccccc1	ZINC000819254442	EG	On-Demand	Anodyne	ADRB3	52	40
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)N[C@@H]1C[C@@H](c3ccccc3Cl)C1)=NO2	ZINC000819254449	II	On-Demand	Anodyne	GPR119	17	49
N#Cc1cccc(OCC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819254452	EH	On-Demand	Mild	MCHR1	19	45
N#Cc1cccc(OCC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819254452	EH	On-Demand	Mild	TNKS	27	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	ACE	29	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	CTRA_BOVIN	40	32
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	CASP3	19	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	BMP1	16	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	KLK3	89	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	CTSB	73	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	PAPA1_CARPA	77	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	CYSP_TRYCR	58	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	CTSK	51	50
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	CTSL	56	47
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	CAPNS1	69	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	MMP11	47	32
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	CTSS	30	49
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	CAPN1	92	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	CASP1	26	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	CAPN2	147	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	TGM2	26	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	TPSAB1	43	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	NPR	73	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254486	II	On-Demand	Anodyne	PSMB5	47	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	ACE	29	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	CTRA_BOVIN	40	32
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	CASP3	19	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	BMP1	16	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	KLK3	89	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	CTSB	73	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	PAPA1_CARPA	77	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	CYSP_TRYCR	58	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	CTSK	51	50
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	CTSL	56	47
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	CAPNS1	69	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	MMP11	47	32
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	CTSS	30	49
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	CAPN1	92	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	CASP1	26	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	CAPN2	147	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	TGM2	26	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	TPSAB1	43	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	NPR	73	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254487	II	On-Demand	Anodyne	PSMB5	47	41
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819254493	DB	On-Demand	Anodyne	ADRB2	34	44
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819254493	DB	On-Demand	Anodyne	ADRB1	52	43
Cc1ccc(OC[C@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819254494	DB	On-Demand	Anodyne	ADRB2	34	44
Cc1ccc(OC[C@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819254494	DB	On-Demand	Anodyne	ADRB1	52	43
Cc1ccc(OC[C@@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819254495	DB	On-Demand	Anodyne	ADRB2	34	44
Cc1ccc(OC[C@@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819254495	DB	On-Demand	Anodyne	ADRB1	52	43
Cc1ccc(OC[C@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819254496	DB	On-Demand	Anodyne	ADRB2	34	44
Cc1ccc(OC[C@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819254496	DB	On-Demand	Anodyne	ADRB1	52	43
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819254498	EB	On-Demand	Anodyne	ADRB2	24	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819254498	EB	On-Demand	Anodyne	ADRB1	44	38
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819254499	EB	On-Demand	Anodyne	ADRB2	24	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819254499	EB	On-Demand	Anodyne	ADRB1	44	38
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819254500	EB	On-Demand	Anodyne	ADRB2	24	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)cc1	ZINC000819254500	EB	On-Demand	Anodyne	ADRB1	44	38
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819254501	EB	On-Demand	Anodyne	ADRB2	24	40
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(C(N)=O)=NO2)cc1	ZINC000819254501	EB	On-Demand	Anodyne	ADRB1	44	38
NC(=O)C1=NO[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819254530	CC	On-Demand	Anodyne	ADRB1	31	42
NC(=O)C1=NO[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819254530	CC	On-Demand	Anodyne	ADRB3	44	42
NC(=O)C1=NO[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819254530	CC	On-Demand	Anodyne	CYP3A4	44	32
NC(=O)C1=NO[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819254531	CC	On-Demand	Anodyne	ADRB1	31	42
NC(=O)C1=NO[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819254531	CC	On-Demand	Anodyne	ADRB3	44	42
NC(=O)C1=NO[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819254531	CC	On-Demand	Anodyne	CYP3A4	44	32
NC(=O)C1=NO[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819254532	CC	On-Demand	Anodyne	ADRB1	31	42
NC(=O)C1=NO[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819254532	CC	On-Demand	Anodyne	ADRB3	44	42
NC(=O)C1=NO[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819254532	CC	On-Demand	Anodyne	CYP3A4	44	32
NC(=O)C1=NO[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819254533	CC	On-Demand	Anodyne	ADRB1	31	42
NC(=O)C1=NO[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819254533	CC	On-Demand	Anodyne	ADRB3	44	42
NC(=O)C1=NO[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819254533	CC	On-Demand	Anodyne	CYP3A4	44	32
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819254544	EC	On-Demand	Anodyne	ADRB2	15	52
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819254544	EC	On-Demand	Anodyne	ADRB1	26	50
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819254545	EC	On-Demand	Anodyne	ADRB2	15	52
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819254545	EC	On-Demand	Anodyne	ADRB1	26	50
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819254546	EC	On-Demand	Anodyne	ADRB2	15	52
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819254546	EC	On-Demand	Anodyne	ADRB1	26	50
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819254547	EC	On-Demand	Anodyne	ADRB2	15	52
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819254547	EC	On-Demand	Anodyne	ADRB1	26	50
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819254555	FC	On-Demand	Anodyne	ADRB2	15	41
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819254555	FC	On-Demand	Anodyne	ADRB1	50	34
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819254556	FC	On-Demand	Anodyne	ADRB2	15	41
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819254556	FC	On-Demand	Anodyne	ADRB1	50	34
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819254557	FC	On-Demand	Anodyne	ADRB2	15	41
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819254557	FC	On-Demand	Anodyne	ADRB1	50	34
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819254558	FC	On-Demand	Anodyne	ADRB2	15	41
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000819254558	FC	On-Demand	Anodyne	ADRB1	50	34
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819254565	EC	On-Demand	Anodyne	ADRB2	25	46
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819254566	EC	On-Demand	Anodyne	ADRB2	25	46
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819254567	EC	On-Demand	Anodyne	ADRB2	25	46
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819254568	EC	On-Demand	Anodyne	ADRB2	25	46
NC(=O)C1=NO[C@@H](CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819254577	FC	On-Demand	Anodyne	GRIN1	19	42
NC(=O)C1=NO[C@H](CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819254578	FC	On-Demand	Anodyne	GRIN1	19	42
NC(=O)C1=NO[C@@H](CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819254579	FC	On-Demand	Anodyne	GRIN1	19	42
NC(=O)C1=NO[C@H](CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819254580	FC	On-Demand	Anodyne	GRIN1	19	42
C[C@@H]1CCCC[C@H]1C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819254589	EH	On-Demand	Anodyne	GPR119	29	41
C[C@@H]1CCCC[C@@H]1C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819254590	EH	On-Demand	Anodyne	GPR119	29	41
C[C@@H]1CCCC[C@H]1C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819254591	EH	On-Demand	Anodyne	GPR119	29	41
C[C@@H]1CCCC[C@@H]1C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819254592	EH	On-Demand	Anodyne	GPR119	29	41
COC(=O)c1[nH]c(C)cc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819254607	GF	On-Demand	Mild	PAPA1_CARPA	43	46
COC(=O)c1[nH]c(C)cc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819254608	GF	On-Demand	Mild	PAPA1_CARPA	43	46
O=C(CSC(F)(F)F)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254627	DH	On-Demand	Anodyne	RBP4	53	37
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254635	FH	On-Demand	Anodyne	REN	24	42
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254635	FH	On-Demand	Anodyne	FPR1	45	37
CC(C)(C)OC(=O)NC1CCN(CC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)CC1	ZINC000819254643	HH	On-Demand	Anodyne	DRD4	32	40
CC(C)(C)OC(=O)NC1CCN(CC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)CC1	ZINC000819254643	HH	On-Demand	Anodyne	SIGMAR1	17	44
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819254645	GF	On-Demand	Anodyne	GPR119	50	52
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819254646	GF	On-Demand	Anodyne	GPR119	50	52
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cc2ccccc2s1	ZINC000819254651	DH	On-Demand	Anodyne	UL26	59	32
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cc2ccccc2s1	ZINC000819254651	DH	On-Demand	Anodyne	SCAF_EBVB9	58	32
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cc2ccccc2s1	ZINC000819254652	DH	On-Demand	Anodyne	UL26	59	32
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cc2ccccc2s1	ZINC000819254652	DH	On-Demand	Anodyne	SCAF_EBVB9	58	32
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cc2ccccc2s1	ZINC000819254654	DH	On-Demand	Anodyne	UL26	59	32
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cc2ccccc2s1	ZINC000819254654	DH	On-Demand	Anodyne	SCAF_EBVB9	58	32
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cc2ccccc2s1	ZINC000819254656	DH	On-Demand	Anodyne	UL26	59	32
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cc2ccccc2s1	ZINC000819254656	DH	On-Demand	Anodyne	SCAF_EBVB9	58	32
O=C1[C@H](NC[C@H](O)c2ccccc2)CCCN1C1CCCCC1	ZINC000819254670	DF	On-Demand	Anodyne	XIAP	40	40
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCCN1C1CCCCC1	ZINC000819254672	DF	On-Demand	Anodyne	XIAP	40	40
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCCN1C1CCCCC1	ZINC000819254673	DF	On-Demand	Anodyne	XIAP	40	40
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCCN1C1CCCCC1	ZINC000819254675	DF	On-Demand	Anodyne	XIAP	40	40
O=C(Cc1cccs1)Nc1nc(CC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cs1	ZINC000819254688	IJ	On-Demand	Anodyne	CA5B	30	41
O=C(Cc1cccs1)Nc1nc(CC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cs1	ZINC000819254688	IJ	On-Demand	Anodyne	CA5A	30	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819254692	GF	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819254693	GF	On-Demand	Anodyne	GPR119	29	40
C[C@H](CC(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1)n1cccn1	ZINC000819254739	FF	On-Demand	Anodyne	GPR119	29	40
O=C(CCn1c(S)nc2ccccc2c1=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254765	HH	On-Demand	Anodyne	TNKS	61	35
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819254766	HG	On-Demand	Anodyne	CA2	24	43
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819254766	HG	On-Demand	Anodyne	CA1	17	40
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819254766	HG	On-Demand	Anodyne	CA7	30	40
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819254766	HG	On-Demand	Anodyne	CA4	24	45
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819254766	HG	On-Demand	Anodyne	CA9	16	43
CC(C)(C)OC(=O)N1CCC(CC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)CC1	ZINC000819254773	HJ	On-Demand	Anodyne	EPHX2	20	43
CC(C)(C)OC(=O)N1CCC(CC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)CC1	ZINC000819254773	HJ	On-Demand	Anodyne	GPR119	41	43
CC(C)(C)OC(=O)N1CCC(CC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)CC1	ZINC000819254773	HJ	On-Demand	Anodyne	SFRP1	27	45
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254783	FG	On-Demand	Anodyne	ANPEP	33	44
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254783	FG	On-Demand	Anodyne	KLK3	42	35
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254783	FG	On-Demand	Anodyne	CTSB	42	41
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254783	FG	On-Demand	Anodyne	CTSK	49	47
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254783	FG	On-Demand	Anodyne	CTSL	41	45
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254783	FG	On-Demand	Anodyne	CAPNS1	63	36
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254783	FG	On-Demand	Anodyne	HLA-DRB1	41	33
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254783	FG	On-Demand	Anodyne	CTSS	26	45
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254783	FG	On-Demand	Anodyne	CAPN1	99	44
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254783	FG	On-Demand	Anodyne	CAPN2	140	42
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254783	FG	On-Demand	Anodyne	FPR1	72	40
COC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254783	FG	On-Demand	Anodyne	NPR	67	34
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254784	FG	On-Demand	Anodyne	ANPEP	33	44
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254784	FG	On-Demand	Anodyne	KLK3	42	35
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254784	FG	On-Demand	Anodyne	CTSB	42	41
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254784	FG	On-Demand	Anodyne	CTSK	49	47
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254784	FG	On-Demand	Anodyne	CTSL	41	45
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254784	FG	On-Demand	Anodyne	CAPNS1	63	36
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254784	FG	On-Demand	Anodyne	HLA-DRB1	41	33
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254784	FG	On-Demand	Anodyne	CTSS	26	45
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254784	FG	On-Demand	Anodyne	CAPN1	99	44
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254784	FG	On-Demand	Anodyne	CAPN2	140	42
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254784	FG	On-Demand	Anodyne	FPR1	72	40
COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254784	FG	On-Demand	Anodyne	NPR	67	34
O=C(Nc1ccc(C(=O)N2CCCCC2)c(Cl)c1)C(F)=C1CCC1	ZINC000819254836	FI	On-Demand	Anodyne	AVPR2	37	41
Cc1ccccc1C1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819254847	GI	On-Demand	Mild	F2	15	41
Cc1ccccc1C1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819254847	GI	On-Demand	Mild	GHRHR	71	37
Cc1ccccc1C1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819254847	GI	On-Demand	Mild	P2RY12	77	37
Cc1ccccc1C1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819254847	GI	On-Demand	Mild	PAPA1_CARPA	38	42
Cc1ccccc1C1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819254847	GI	On-Demand	Mild	CCKAR	24	41
Cc1ccccc1C1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819254847	GI	On-Demand	Mild	CCR1	24	43
Cc1ccccc1C1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819254847	GI	On-Demand	Mild	TGM2	22	45
Cc1ccccc1C1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819254847	GI	On-Demand	Mild	FPR1	43	35
Cc1ccccc1C1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819254848	GI	On-Demand	Mild	F2	15	41
Cc1ccccc1C1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819254848	GI	On-Demand	Mild	GHRHR	71	37
Cc1ccccc1C1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819254848	GI	On-Demand	Mild	P2RY12	77	37
Cc1ccccc1C1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819254848	GI	On-Demand	Mild	PAPA1_CARPA	38	42
Cc1ccccc1C1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819254848	GI	On-Demand	Mild	CCKAR	24	41
Cc1ccccc1C1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819254848	GI	On-Demand	Mild	CCR1	24	43
Cc1ccccc1C1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819254848	GI	On-Demand	Mild	TGM2	22	45
Cc1ccccc1C1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819254848	GI	On-Demand	Mild	FPR1	43	35
C[C@@H](CC(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1)n1cccn1	ZINC000819254849	FF	On-Demand	Anodyne	GPR119	29	40
CN(C)C1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819254850	BD	On-Demand	Anodyne	ADRB2	23	43
CN(C)C1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819254850	BD	On-Demand	Anodyne	ADRB1	25	43
CN(C)C1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819254850	BD	On-Demand	Anodyne	ADRB3	94	48
C[C@H](CC(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)n1cccn1	ZINC000819254851	FF	On-Demand	Anodyne	GPR119	29	40
C[C@@H](CC(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)n1cccn1	ZINC000819254852	FF	On-Demand	Anodyne	GPR119	29	40
CN(C)C1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819254853	BD	On-Demand	Anodyne	ADRB2	23	43
CN(C)C1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819254853	BD	On-Demand	Anodyne	ADRB1	25	43
CN(C)C1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819254853	BD	On-Demand	Anodyne	ADRB3	94	48
O=C(C(F)=C1CCC1)N1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000819254882	CD	On-Demand	Anodyne	SLC18A3	42	45
O=C(C(F)=C1CCC1)N1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000819254883	CD	On-Demand	Anodyne	SLC18A3	42	45
O=C(C(F)=C1CCC1)N1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000819254884	CD	On-Demand	Anodyne	SLC18A3	42	45
O=C(C(F)=C1CCC1)N1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000819254885	CD	On-Demand	Anodyne	SLC18A3	42	45
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCCN1C1CCCCC1	ZINC000819254898	DE	On-Demand	Anodyne	ADRB1	17	42
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCCN1C1CCCCC1	ZINC000819254898	DE	On-Demand	Anodyne	ADRB3	68	43
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCCN1C1CCCCC1	ZINC000819254899	DE	On-Demand	Anodyne	ADRB1	17	42
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCCN1C1CCCCC1	ZINC000819254899	DE	On-Demand	Anodyne	ADRB3	68	43
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCCN1C1CCCCC1	ZINC000819254900	DE	On-Demand	Anodyne	ADRB1	17	42
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCCN1C1CCCCC1	ZINC000819254900	DE	On-Demand	Anodyne	ADRB3	68	43
O=C1[C@H](NC[C@H](O)c2cccnc2)CCCN1C1CCCCC1	ZINC000819254902	DE	On-Demand	Anodyne	ADRB1	17	42
O=C1[C@H](NC[C@H](O)c2cccnc2)CCCN1C1CCCCC1	ZINC000819254902	DE	On-Demand	Anodyne	ADRB3	68	43
O[C@@H](CNCC1(c2cc(F)cc(C(F)(F)F)c2)CC1)c1cccnc1	ZINC000819254903	FH	On-Demand	Anodyne	ADRB3	65	39
O[C@H](CNCC1(c2cc(F)cc(C(F)(F)F)c2)CC1)c1cccnc1	ZINC000819254905	FH	On-Demand	Anodyne	ADRB3	65	39
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@H]2CCOc3c(F)cccc32)CC1	ZINC000819254911	GG	On-Demand	Anodyne	GPR119	27	41
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1C1CCCCC1	ZINC000819254936	FG	On-Demand	Anodyne	ADRB1	34	43
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1C1CCCCC1	ZINC000819254936	FG	On-Demand	Anodyne	ADRB3	50	43
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1C1CCCCC1	ZINC000819254936	FG	On-Demand	Anodyne	CYP3A4	51	39
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1C1CCCCC1	ZINC000819254937	FG	On-Demand	Anodyne	ADRB1	34	43
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1C1CCCCC1	ZINC000819254937	FG	On-Demand	Anodyne	ADRB3	50	43
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1C1CCCCC1	ZINC000819254937	FG	On-Demand	Anodyne	CYP3A4	51	39
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1C1CCCCC1	ZINC000819254939	FG	On-Demand	Anodyne	ADRB1	34	43
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1C1CCCCC1	ZINC000819254939	FG	On-Demand	Anodyne	ADRB3	50	43
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1C1CCCCC1	ZINC000819254939	FG	On-Demand	Anodyne	CYP3A4	51	39
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1C1CCCCC1	ZINC000819254940	FG	On-Demand	Anodyne	ADRB1	34	43
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1C1CCCCC1	ZINC000819254940	FG	On-Demand	Anodyne	ADRB3	50	43
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1C1CCCCC1	ZINC000819254940	FG	On-Demand	Anodyne	CYP3A4	51	39
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CC(C(N)=O)=NO2)c1	ZINC000819254941	EB	On-Demand	Anodyne	ADRB2	16	40
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CC(C(N)=O)=NO2)c1	ZINC000819254941	EB	On-Demand	Anodyne	ABCB1	18	46
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)c1	ZINC000819254945	EB	On-Demand	Anodyne	ADRB2	16	40
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)c1	ZINC000819254945	EB	On-Demand	Anodyne	ABCB1	18	46
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)c1	ZINC000819254948	EB	On-Demand	Anodyne	ADRB2	16	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CC(C(N)=O)=NO2)c1	ZINC000819254948	EB	On-Demand	Anodyne	ABCB1	18	46
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CC(C(N)=O)=NO2)c1	ZINC000819254951	EB	On-Demand	Anodyne	ADRB2	16	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CC(C(N)=O)=NO2)c1	ZINC000819254951	EB	On-Demand	Anodyne	ABCB1	18	46
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254972	HI	On-Demand	Anodyne	PGC	47	33
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254972	HI	On-Demand	Anodyne	PAPA1_CARPA	37	40
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254972	HI	On-Demand	Anodyne	CTSL	17	40
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254972	HI	On-Demand	Anodyne	REN	53	40
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254972	HI	On-Demand	Anodyne	POLG_HCV1	30	44
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254972	HI	On-Demand	Anodyne	FPR1	50	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCN2CCc3c(Cl)cccc3C2)c1	ZINC000819254976	GF	On-Demand	Bother	ADRB3	40	38
O=[N+]([O-])c1cccc([C@H](O)CNCCN2CCc3c(Cl)cccc3C2)c1	ZINC000819254977	GF	On-Demand	Bother	ADRB3	40	38
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254980	HI	On-Demand	Anodyne	PGC	47	33
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254980	HI	On-Demand	Anodyne	PAPA1_CARPA	37	40
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254980	HI	On-Demand	Anodyne	CTSL	17	40
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254980	HI	On-Demand	Anodyne	REN	53	40
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254980	HI	On-Demand	Anodyne	POLG_HCV1	30	44
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819254980	HI	On-Demand	Anodyne	FPR1	50	41
C=CC(=O)NCc1ccc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cc1	ZINC000819255013	FH	On-Demand	Anodyne	TGM2	45	46
C#CCN1CCC[C@H]1C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255029	DF	On-Demand	Mild	HSD11B1	46	39
O=C(Cn1cccc(C(F)(F)F)c1=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255039	GH	On-Demand	Anodyne	RBP4	79	40
CC(C)(C)OC(=O)NC1CCC(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)CC1	ZINC000819255040	HJ	On-Demand	Anodyne	EPHX2	15	40
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255043	FI	On-Demand	Anodyne	PGC	50	32
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255043	FI	On-Demand	Anodyne	PAPA1_CARPA	38	42
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255043	FI	On-Demand	Anodyne	CTSK	23	41
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255043	FI	On-Demand	Anodyne	CTSL	19	42
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255043	FI	On-Demand	Anodyne	REN	51	41
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255043	FI	On-Demand	Anodyne	CAPN2	49	34
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255043	FI	On-Demand	Anodyne	FPR1	49	41
CC#CCN(C)C(=O)[C@H](NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1ccccc1	ZINC000819255070	HE	On-Demand	Mild	MTTP	45	38
COc1ccc(-c2nnc(S)n2CC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cc1	ZINC000819255084	IH	On-Demand	Anodyne	AVPR1B	41	40
CC(C)c1ccccc1CNC[C@@H](O)c1ccccc1	ZINC000819255091	CH	On-Demand	Anodyne	ADRB2	21	41
CC(C)c1ccccc1CNC[C@@H](O)c1ccccc1	ZINC000819255091	CH	On-Demand	Anodyne	SOAT1	36	42
CC(C)c1ccccc1CNC[C@@H](O)c1ccccc1	ZINC000819255091	CH	On-Demand	Anodyne	AOC3	15	46
CC(C)c1ccccc1CNC[C@H](O)c1ccccc1	ZINC000819255093	CH	On-Demand	Anodyne	ADRB2	21	41
CC(C)c1ccccc1CNC[C@H](O)c1ccccc1	ZINC000819255093	CH	On-Demand	Anodyne	SOAT1	36	42
CC(C)c1ccccc1CNC[C@H](O)c1ccccc1	ZINC000819255093	CH	On-Demand	Anodyne	AOC3	15	46
CN(Cc1ccc(F)cc1Cl)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819255127	GI	On-Demand	Mild	PAPA1_CARPA	38	45
CN(Cc1ccc(F)cc1Cl)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819255128	GI	On-Demand	Mild	PAPA1_CARPA	38	45
COc1cc(F)c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1OC	ZINC000819255165	GG	On-Demand	Mild	PAPA1_CARPA	43	49
COc1cc(F)c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1OC	ZINC000819255166	GG	On-Demand	Mild	PAPA1_CARPA	43	49
O=C(/C=C/[C@H]1CCCO1)Nc1ccccc1NC(=O)Cc1cccs1	ZINC000819255175	FH	On-Demand	Anodyne	CA5B	32	41
O=C(/C=C/[C@H]1CCCO1)Nc1ccccc1NC(=O)Cc1cccs1	ZINC000819255175	FH	On-Demand	Anodyne	CA5A	32	41
O=C(/C=C\[C@H]1CCCO1)Nc1ccccc1NC(=O)Cc1cccs1	ZINC000819255176	FH	On-Demand	Anodyne	CA5B	32	41
O=C(/C=C\[C@H]1CCCO1)Nc1ccccc1NC(=O)Cc1cccs1	ZINC000819255176	FH	On-Demand	Anodyne	CA5A	32	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccccc1NC(=O)Cc1cccs1	ZINC000819255177	FH	On-Demand	Anodyne	CA5B	32	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccccc1NC(=O)Cc1cccs1	ZINC000819255177	FH	On-Demand	Anodyne	CA5A	32	41
O=C(/C=C/[C@@H]1CCCO1)Nc1ccccc1NC(=O)Cc1cccs1	ZINC000819255178	FH	On-Demand	Anodyne	CA5B	32	41
O=C(/C=C/[C@@H]1CCCO1)Nc1ccccc1NC(=O)Cc1cccs1	ZINC000819255178	FH	On-Demand	Anodyne	CA5A	32	41
O[C@@H](CNCCN1CCc2c(Cl)cccc2C1)c1cccc(F)c1	ZINC000819255193	EG	On-Demand	Anodyne	ADRB1	20	41
O[C@@H](CNCCN1CCc2c(Cl)cccc2C1)c1cccc(F)c1	ZINC000819255193	EG	On-Demand	Anodyne	ADRB3	34	41
O[C@H](CNCCN1CCc2c(Cl)cccc2C1)c1cccc(F)c1	ZINC000819255194	EG	On-Demand	Anodyne	ADRB1	20	41
O[C@H](CNCCN1CCc2c(Cl)cccc2C1)c1cccc(F)c1	ZINC000819255194	EG	On-Demand	Anodyne	ADRB3	34	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](c3ccccc3F)C1)C2	ZINC000819255195	FG	On-Demand	Anodyne	RBP4	54	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](c3ccccc3F)C1)C2	ZINC000819255195	FG	On-Demand	Anodyne	ADAM10	19	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3ccccc3F)C1)C2	ZINC000819255196	FG	On-Demand	Anodyne	RBP4	54	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3ccccc3F)C1)C2	ZINC000819255196	FG	On-Demand	Anodyne	ADAM10	19	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](c3ccccc3F)C1)C2	ZINC000819255197	FG	On-Demand	Anodyne	RBP4	54	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](c3ccccc3F)C1)C2	ZINC000819255197	FG	On-Demand	Anodyne	ADAM10	19	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3ccccc3F)C1)C2	ZINC000819255198	FG	On-Demand	Anodyne	RBP4	54	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3ccccc3F)C1)C2	ZINC000819255198	FG	On-Demand	Anodyne	ADAM10	19	40
O=C1[C@H](NC[C@H](O)c2ccccc2Cl)CCCN1C1CCCCC1	ZINC000819255205	FG	On-Demand	Anodyne	OPRL1	46	38
O=C1[C@@H](NC[C@H](O)c2ccccc2Cl)CCCN1C1CCCCC1	ZINC000819255206	FG	On-Demand	Anodyne	OPRL1	46	38
CCOC(=O)N[C@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)C(C)C	ZINC000819255225	FG	On-Demand	Anodyne	CASP3	17	43
CCOC(=O)N[C@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)C(C)C	ZINC000819255225	FG	On-Demand	Anodyne	PYGL	17	40
CCOC(=O)N[C@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)C(C)C	ZINC000819255225	FG	On-Demand	Anodyne	HLA-DRB1	76	41
CCOC(=O)N[C@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)C(C)C	ZINC000819255225	FG	On-Demand	Anodyne	PYGM	38	40
CCOC(=O)N[C@H](C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1)C(C)C	ZINC000819255225	FG	On-Demand	Anodyne	CASP9	41	37
CCOC(=O)N1CCC[C@H](C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819255238	FH	On-Demand	Anodyne	EPHX2	26	43
CCOC(=O)N1CCC[C@H](C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819255238	FH	On-Demand	Anodyne	BIRC2	17	41
CCOC(=O)N1CCC[C@@H](C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819255239	FH	On-Demand	Anodyne	EPHX2	26	43
CCOC(=O)N1CCC[C@@H](C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819255239	FH	On-Demand	Anodyne	BIRC2	17	41
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255240	GI	On-Demand	Anodyne	PREP	35	47
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255240	GI	On-Demand	Anodyne	LGMN	57	34
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255240	GI	On-Demand	Anodyne	XIAP	35	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255240	GI	On-Demand	Anodyne	BIRC2	40	38
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255240	GI	On-Demand	Anodyne	SFRP1	44	43
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255240	GI	On-Demand	Anodyne	WNT3	56	43
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255241	GI	On-Demand	Anodyne	PREP	35	47
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255241	GI	On-Demand	Anodyne	LGMN	57	34
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255241	GI	On-Demand	Anodyne	XIAP	35	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255241	GI	On-Demand	Anodyne	BIRC2	40	38
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255241	GI	On-Demand	Anodyne	SFRP1	44	43
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255241	GI	On-Demand	Anodyne	WNT3	56	43
COc1ccc2c(C)c(CCC(=O)N[C@@H]3C[C@@H](c4ccccc4Cl)C3)c(=O)oc2c1	ZINC000819255243	IJ	On-Demand	Anodyne	MAOB	37	43
COc1ccc2c(C)c(CCC(=O)N[C@@H]3C[C@@H](c4ccccc4Cl)C3)c(=O)oc2c1	ZINC000819255243	IJ	On-Demand	Anodyne	NQO1	29	42
O=C(CCCn1cncn1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255253	DF	On-Demand	Anodyne	HIS3	49	33
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255260	FH	On-Demand	Anodyne	EPHX2	15	40
COc1cc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cnc1Br	ZINC000819255270	GI	On-Demand	Anodyne	DRD2	21	40
COc1cc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cnc1Br	ZINC000819255270	GI	On-Demand	Anodyne	DRD3	28	40
COc1cc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cnc1Br	ZINC000819255270	GI	On-Demand	Anodyne	SSTR5	42	38
COc1cc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cnc1Br	ZINC000819255270	GI	On-Demand	Anodyne	SSTR1	40	33
NS(=O)(=O)c1ccc(Br)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819255274	IG	On-Demand	Anodyne	CA2	36	44
NS(=O)(=O)c1ccc(Br)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819255274	IG	On-Demand	Anodyne	CA1	30	44
NS(=O)(=O)c1ccc(Br)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819255274	IG	On-Demand	Anodyne	CA7	40	42
NS(=O)(=O)c1ccc(Br)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819255274	IG	On-Demand	Anodyne	CA5B	37	41
NS(=O)(=O)c1ccc(Br)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819255274	IG	On-Demand	Anodyne	CA4	31	44
NS(=O)(=O)c1ccc(Br)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819255274	IG	On-Demand	Anodyne	CA5A	38	41
NS(=O)(=O)c1ccc(Br)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819255274	IG	On-Demand	Anodyne	CA14	17	42
NS(=O)(=O)c1ccc(Br)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819255274	IG	On-Demand	Anodyne	CA12	21	44
NS(=O)(=O)c1ccc(Br)c(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819255274	IG	On-Demand	Anodyne	CA9	24	44
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255281	GI	On-Demand	Anodyne	FPR1	44	37
O=C(CCN1CCOCC1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255286	DE	On-Demand	Anodyne	HTR7	15	42
O=C(CCN1CCOCC1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255286	DE	On-Demand	Anodyne	SIGMAR1	18	40
O=C(CCN1CCOCC1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255286	DE	On-Demand	Anodyne	PRCP	27	40
CC(C)(C)OC(=O)N1CCN(CCC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)CC1	ZINC000819255312	HH	On-Demand	Anodyne	HTR1A	15	42
CC(C)(C)OC(=O)N1CCN(CCC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)CC1	ZINC000819255312	HH	On-Demand	Anodyne	DRD2	16	44
CC(C)(C)OC(=O)N1CCN(CCC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)CC1	ZINC000819255312	HH	On-Demand	Anodyne	DRD3	22	43
CC(C)(C)OC(=O)N1CCN(CCC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)CC1	ZINC000819255312	HH	On-Demand	Anodyne	HTR7	25	42
CC#CCN(C)C(=O)c1ccccc1NC(=O)c1cccc(C)c1	ZINC000819255315	DG	On-Demand	Mild	ECR	33	42
CC#CCN(C)C(=O)c1ccccc1NC(=O)c1cccc(C)c1	ZINC000819255315	DG	On-Demand	Mild	KCNK3	88	45
CC#CCN(C)C(=O)c1ccccc1NC(=O)c1cccc(C)c1	ZINC000819255315	DG	On-Demand	Mild	KCNK9	54	45
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819255363	GG	On-Demand	Anodyne	CCR8	91	44
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819255363	GG	On-Demand	Anodyne	GPR119	35	43
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819255364	GG	On-Demand	Anodyne	CCR8	91	44
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819255364	GG	On-Demand	Anodyne	GPR119	35	43
CC(=O)Nc1cccc(CC(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819255376	GF	On-Demand	Anodyne	ACHE	17	43
CC(=O)Nc1cccc(CC(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819255376	GF	On-Demand	Anodyne	CCR3	47	41
CC(=O)Nc1cccc(CC(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819255376	GF	On-Demand	Anodyne	CACNA1I	53	34
CC(=O)Nc1cccc(CC(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819255376	GF	On-Demand	Anodyne	GPR119	41	51
CC(=O)Nc1cccc(CC(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819255377	GF	On-Demand	Anodyne	ACHE	17	43
CC(=O)Nc1cccc(CC(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819255377	GF	On-Demand	Anodyne	CCR3	47	41
CC(=O)Nc1cccc(CC(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819255377	GF	On-Demand	Anodyne	CACNA1I	53	34
CC(=O)Nc1cccc(CC(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819255377	GF	On-Demand	Anodyne	GPR119	41	51
COCCN(Cc1ccc(F)cc1Cl)C(=O)C(F)=C1CCC1	ZINC000819255386	EH	On-Demand	Anodyne	P2RX7	42	40
O=C(CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819255394	HI	On-Demand	Bother	LUXR	17	40
Cn1cc(-c2cccc(C(=O)N[C@@H]3C[C@@H](c4ccccc4Cl)C3)c2)cn1	ZINC000819255427	FI	On-Demand	Anodyne	MAPK14	22	41
Cn1cc(-c2cccc(C(=O)N[C@@H]3C[C@@H](c4ccccc4Cl)C3)c2)cn1	ZINC000819255427	FI	On-Demand	Anodyne	MAPK10	17	41
Cn1cc(-c2cccc(C(=O)N[C@@H]3C[C@@H](c4ccccc4Cl)C3)c2)cn1	ZINC000819255427	FI	On-Demand	Anodyne	TYRO3	25	41
O[C@@H](CNCCOCC(F)F)c1cccnc1	ZINC000819255469	BC	On-Demand	Anodyne	ADRB2	35	53
O[C@@H](CNCCOCC(F)F)c1cccnc1	ZINC000819255469	BC	On-Demand	Anodyne	ADRB1	45	53
O[C@@H](CNCCOCC(F)F)c1cccnc1	ZINC000819255469	BC	On-Demand	Anodyne	ADRB3	120	55
O[C@H](CNCCOCC(F)F)c1cccnc1	ZINC000819255470	BC	On-Demand	Anodyne	ADRB2	35	53
O[C@H](CNCCOCC(F)F)c1cccnc1	ZINC000819255470	BC	On-Demand	Anodyne	ADRB1	45	53
O[C@H](CNCCOCC(F)F)c1cccnc1	ZINC000819255470	BC	On-Demand	Anodyne	ADRB3	120	55
O[C@H](CNOC[C@@H]1CCOC1)COc1ccccc1	ZINC000819255491	CC	On-Demand	Anodyne	ADRB2	32	45
O[C@H](CNOC[C@@H]1CCOC1)COc1ccccc1	ZINC000819255491	CC	On-Demand	Anodyne	ADRB1	49	41
O[C@@H](CNOC[C@@H]1CCOC1)COc1ccccc1	ZINC000819255492	CC	On-Demand	Anodyne	ADRB2	32	45
O[C@@H](CNOC[C@@H]1CCOC1)COc1ccccc1	ZINC000819255492	CC	On-Demand	Anodyne	ADRB1	49	41
O[C@H](CNOC[C@H]1CCOC1)COc1ccccc1	ZINC000819255493	CC	On-Demand	Anodyne	ADRB2	32	45
O[C@H](CNOC[C@H]1CCOC1)COc1ccccc1	ZINC000819255493	CC	On-Demand	Anodyne	ADRB1	49	41
O[C@@H](CNOC[C@H]1CCOC1)COc1ccccc1	ZINC000819255494	CC	On-Demand	Anodyne	ADRB2	32	45
O[C@@H](CNOC[C@H]1CCOC1)COc1ccccc1	ZINC000819255494	CC	On-Demand	Anodyne	ADRB1	49	41
COC(=O)c1ccc(OC[C@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819255503	EC	On-Demand	Anodyne	ADRB2	18	42
COC(=O)c1ccc(OC[C@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819255503	EC	On-Demand	Anodyne	ADRB1	40	41
COC(=O)c1ccc(OC[C@@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819255504	EC	On-Demand	Anodyne	ADRB2	18	42
COC(=O)c1ccc(OC[C@@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819255504	EC	On-Demand	Anodyne	ADRB1	40	41
COC(=O)c1ccc(OC[C@@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819255505	EC	On-Demand	Anodyne	ADRB2	18	42
COC(=O)c1ccc(OC[C@@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819255505	EC	On-Demand	Anodyne	ADRB1	40	41
COC(=O)c1ccc(OC[C@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819255506	EC	On-Demand	Anodyne	ADRB2	18	42
COC(=O)c1ccc(OC[C@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819255506	EC	On-Demand	Anodyne	ADRB1	40	41
O[C@H](CNOC[C@@H]1CCOC1)COc1cccc2ccccc12	ZINC000819255520	DE	On-Demand	Anodyne	ADRB2	24	50
O[C@H](CNOC[C@@H]1CCOC1)COc1cccc2ccccc12	ZINC000819255520	DE	On-Demand	Anodyne	ADRB1	26	50
O[C@H](CNOC[C@H]1CCOC1)COc1cccc2ccccc12	ZINC000819255521	DE	On-Demand	Anodyne	ADRB2	24	50
O[C@H](CNOC[C@H]1CCOC1)COc1cccc2ccccc12	ZINC000819255521	DE	On-Demand	Anodyne	ADRB1	26	50
O[C@@H](CNOC[C@H]1CCOC1)COc1cccc2ccccc12	ZINC000819255522	DE	On-Demand	Anodyne	ADRB2	24	50
O[C@@H](CNOC[C@H]1CCOC1)COc1cccc2ccccc12	ZINC000819255522	DE	On-Demand	Anodyne	ADRB1	26	50
O[C@@H](CNOC[C@@H]1CCOC1)COc1cccc2ccccc12	ZINC000819255523	DE	On-Demand	Anodyne	ADRB2	24	50
O[C@@H](CNOC[C@@H]1CCOC1)COc1cccc2ccccc12	ZINC000819255523	DE	On-Demand	Anodyne	ADRB1	26	50
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1nc(-c3ccccn3)cs1)C2	ZINC000819255546	FG	On-Demand	Anodyne	NPY5R	16	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1nc(-c3ccccn3)cs1)C2	ZINC000819255547	FG	On-Demand	Anodyne	NPY5R	16	43
O[C@@H](CNOC[C@H]1CCOC1)COc1ccc(Cl)cc1	ZINC000819255550	DD	On-Demand	Anodyne	ADRB1	24	42
O[C@H](CNOC[C@@H]1CCOC1)COc1ccc(Cl)cc1	ZINC000819255551	DD	On-Demand	Anodyne	ADRB1	24	42
O[C@H](CNOC[C@H]1CCOC1)COc1ccc(Cl)cc1	ZINC000819255552	DD	On-Demand	Anodyne	ADRB1	24	42
O[C@@H](CNOC[C@@H]1CCOC1)COc1ccc(Cl)cc1	ZINC000819255553	DD	On-Demand	Anodyne	ADRB1	24	42
CSc1ccc(OC[C@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819255558	DD	On-Demand	Anodyne	ADRB1	22	42
CSc1ccc(OC[C@@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819255559	DD	On-Demand	Anodyne	ADRB1	22	42
CSc1ccc(OC[C@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819255560	DD	On-Demand	Anodyne	ADRB1	22	42
C#CCOc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819255561	FG	On-Demand	Mild	PAPA1_CARPA	41	42
C#CCOc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819255562	FG	On-Demand	Mild	PAPA1_CARPA	41	42
CCOC(=O)c1csc(CCNC[C@H](O)c2ccc(Cl)cc2)n1	ZINC000819255584	FF	On-Demand	Anodyne	ADRB1	23	41
CCOC(=O)c1csc(CCNC[C@H](O)c2ccc(Cl)cc2)n1	ZINC000819255584	FF	On-Demand	Anodyne	ADRB3	46	41
O=S1(=O)CC(CCNC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819255615	ED	On-Demand	Anodyne	ADRB3	43	36
O=S1(=O)CC(CCNC[C@H](O)c2cccc(Br)c2)C1	ZINC000819255616	ED	On-Demand	Anodyne	ADRB3	43	36
O=S1(=O)CC(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819255627	FD	On-Demand	Anodyne	ADRB3	17	43
O=S1(=O)CC(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819255628	FD	On-Demand	Anodyne	ADRB3	17	43
CSc1ccc(OC[C@@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819255632	DD	On-Demand	Anodyne	ADRB1	22	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@@H]2NC[C@H](O)c1ccccc1	ZINC000819255633	GF	On-Demand	Anodyne	FPR1	43	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@@H]2NC[C@@H](O)c1ccccc1	ZINC000819255634	GF	On-Demand	Anodyne	FPR1	43	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@H]2NC[C@H](O)c1ccccc1	ZINC000819255635	GF	On-Demand	Anodyne	FPR1	43	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@H]2NC[C@@H](O)c1ccccc1	ZINC000819255636	GF	On-Demand	Anodyne	FPR1	43	35
O[C@@H](CNOC[C@@H]1CCOC1)COc1ccc(-c2ccccc2)cc1	ZINC000819255639	EF	On-Demand	Anodyne	ADRB1	44	40
O[C@@H](CNOC[C@H]1CCOC1)COc1ccc(-c2ccccc2)cc1	ZINC000819255640	EF	On-Demand	Anodyne	ADRB1	44	40
O[C@H](CNOC[C@H]1CCOC1)COc1ccc(-c2ccccc2)cc1	ZINC000819255641	EF	On-Demand	Anodyne	ADRB1	44	40
O[C@H](CNOC[C@@H]1CCOC1)COc1ccc(-c2ccccc2)cc1	ZINC000819255642	EF	On-Demand	Anodyne	ADRB1	44	40
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2cccc(Br)c2)cs1	ZINC000819255661	GI	On-Demand	Anodyne	MPL	21	47
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2cccc(Br)c2)cs1	ZINC000819255662	GI	On-Demand	Anodyne	MPL	21	47
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2cccc(Br)c2)cs1	ZINC000819255663	GI	On-Demand	Anodyne	MPL	21	47
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2cccc(Br)c2)cs1	ZINC000819255664	GI	On-Demand	Anodyne	MPL	21	47
O=C(CCNOC[C@H]1CCOC1)Nc1ccc(Oc2ccccc2)cc1	ZINC000819255665	FG	On-Demand	Anodyne	LTA4H	48	45
O=C(CCNOC[C@@H]1CCOC1)Nc1ccc(Oc2ccccc2)cc1	ZINC000819255666	FG	On-Demand	Anodyne	LTA4H	48	45
N#CCc1ccc(OC[C@@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819255669	DD	On-Demand	Mild	ADRB1	21	45
N#CCc1ccc(OC[C@@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819255670	DD	On-Demand	Mild	ADRB1	21	45
N#CCc1ccc(OC[C@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819255671	DD	On-Demand	Mild	ADRB1	21	45
N#CCc1ccc(OC[C@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819255672	DD	On-Demand	Mild	ADRB1	21	45
O=C(OCc1ccccc1)[C@@H](CNC[C@@H](O)C(F)(F)F)c1ccccc1	ZINC000819255749	FG	On-Demand	Anodyne	CAPN2	54	36
O=C(OCc1ccccc1)[C@H](CNC[C@@H](O)C(F)(F)F)c1ccccc1	ZINC000819255750	FG	On-Demand	Anodyne	CAPN2	54	36
O=C(OCc1ccccc1)[C@@H](CNC[C@H](O)C(F)(F)F)c1ccccc1	ZINC000819255751	FG	On-Demand	Anodyne	CAPN2	54	36
O=C(OCc1ccccc1)[C@H](CNC[C@H](O)C(F)(F)F)c1ccccc1	ZINC000819255752	FG	On-Demand	Anodyne	CAPN2	54	36
CO[C@@H](CCNC[C@@H](O)c1cccc(Cl)c1)C(F)(F)F	ZINC000819255775	DF	On-Demand	Anodyne	ADRB2	40	41
CO[C@@H](CCNC[C@@H](O)c1cccc(Cl)c1)C(F)(F)F	ZINC000819255775	DF	On-Demand	Anodyne	ADRB1	57	52
CO[C@@H](CCNC[C@@H](O)c1cccc(Cl)c1)C(F)(F)F	ZINC000819255775	DF	On-Demand	Anodyne	ADRB3	73	52
CO[C@@H](CCNC[C@H](O)c1cccc(Cl)c1)C(F)(F)F	ZINC000819255777	DF	On-Demand	Anodyne	ADRB2	40	41
CO[C@@H](CCNC[C@H](O)c1cccc(Cl)c1)C(F)(F)F	ZINC000819255777	DF	On-Demand	Anodyne	ADRB1	57	52
CO[C@@H](CCNC[C@H](O)c1cccc(Cl)c1)C(F)(F)F	ZINC000819255777	DF	On-Demand	Anodyne	ADRB3	73	52
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCC2CS(=O)(=O)C2)CC1	ZINC000819255796	GD	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCC2CS(=O)(=O)C2)CC1	ZINC000819255797	GD	On-Demand	Anodyne	GPR119	29	41
CO[C@@H](CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)C(F)(F)F	ZINC000819255802	FG	On-Demand	Anodyne	ADRB2	22	41
CO[C@@H](CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)C(F)(F)F	ZINC000819255802	FG	On-Demand	Anodyne	ADRB3	27	45
CO[C@@H](CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)C(F)(F)F	ZINC000819255804	FG	On-Demand	Anodyne	ADRB2	22	41
CO[C@@H](CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)C(F)(F)F	ZINC000819255804	FG	On-Demand	Anodyne	ADRB3	27	45
CCOC(=O)c1csc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)n1	ZINC000819255810	GG	On-Demand	Anodyne	ADRB3	26	41
CCOC(=O)c1csc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)n1	ZINC000819255811	GG	On-Demand	Anodyne	ADRB3	26	41
Cc1cccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1Br	ZINC000819255818	FG	On-Demand	Bother	CACNA1C	48	34
Cc1cccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1Br	ZINC000819255818	FG	On-Demand	Bother	CACNA1D	75	34
Cc1cccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1Br	ZINC000819255819	FG	On-Demand	Bother	CACNA1C	48	34
Cc1cccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1Br	ZINC000819255819	FG	On-Demand	Bother	CACNA1D	75	34
Cc1ccccc1[C@@H](O)CNCCc1ccccc1OC(F)F	ZINC000819255844	DG	On-Demand	Anodyne	ADRB2	29	41
Cc1ccccc1[C@@H](O)CNCCc1ccccc1OC(F)F	ZINC000819255844	DG	On-Demand	Anodyne	ADRB1	20	41
N#Cc1ccc([C@@H](O)CNCCc2ccccc2OC(F)F)cc1	ZINC000819255858	EG	On-Demand	Mild	ADRB1	41	32
N#Cc1ccc([C@H](O)CNCCc2ccccc2OC(F)F)cc1	ZINC000819255859	EG	On-Demand	Mild	ADRB1	41	32
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCOC(F)(F)F)CC1	ZINC000819255868	FE	On-Demand	Anodyne	GPR119	29	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCOC(F)(F)F)CC1	ZINC000819255869	FE	On-Demand	Anodyne	GPR119	29	45
O[C@H](CNCCOC(F)(F)F)c1cccnc1	ZINC000819255888	CD	On-Demand	Anodyne	ADRB2	31	55
O[C@H](CNCCOC(F)(F)F)c1cccnc1	ZINC000819255888	CD	On-Demand	Anodyne	ADRB1	39	56
O[C@H](CNCCOC(F)(F)F)c1cccnc1	ZINC000819255888	CD	On-Demand	Anodyne	ADRB3	113	56
O[C@@H](CNCCOC(F)(F)F)c1cccnc1	ZINC000819255889	CD	On-Demand	Anodyne	ADRB2	31	55
O[C@@H](CNCCOC(F)(F)F)c1cccnc1	ZINC000819255889	CD	On-Demand	Anodyne	ADRB1	39	56
O[C@@H](CNCCOC(F)(F)F)c1cccnc1	ZINC000819255889	CD	On-Demand	Anodyne	ADRB3	113	56
Cc1cc(C)c(-c2csc(NC(=O)/C=C\[C@H]3CCCO3)n2)c(C)c1	ZINC000819255900	EI	On-Demand	Anodyne	UL26	50	31
Cc1cc(C)c(-c2csc(NC(=O)/C=C\[C@H]3CCCO3)n2)c(C)c1	ZINC000819255900	EI	On-Demand	Anodyne	SCAF_EBVB9	43	29
Cc1cc(C)c(-c2csc(NC(=O)/C=C/[C@@H]3CCCO3)n2)c(C)c1	ZINC000819255901	EI	On-Demand	Anodyne	UL26	50	31
Cc1cc(C)c(-c2csc(NC(=O)/C=C/[C@@H]3CCCO3)n2)c(C)c1	ZINC000819255901	EI	On-Demand	Anodyne	SCAF_EBVB9	43	29
Cc1cc(C)c(-c2csc(NC(=O)/C=C/[C@H]3CCCO3)n2)c(C)c1	ZINC000819255902	EI	On-Demand	Anodyne	UL26	50	31
Cc1cc(C)c(-c2csc(NC(=O)/C=C/[C@H]3CCCO3)n2)c(C)c1	ZINC000819255902	EI	On-Demand	Anodyne	SCAF_EBVB9	43	29
Cc1cc(C)c(-c2csc(NC(=O)/C=C\[C@@H]3CCCO3)n2)c(C)c1	ZINC000819255903	EI	On-Demand	Anodyne	UL26	50	31
Cc1cc(C)c(-c2csc(NC(=O)/C=C\[C@@H]3CCCO3)n2)c(C)c1	ZINC000819255903	EI	On-Demand	Anodyne	SCAF_EBVB9	43	29
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)/C=C\[C@H]3CCCO3)c2)C1	ZINC000819255934	FD	On-Demand	Anodyne	SLC6A1	63	33
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)/C=C/[C@@H]3CCCO3)c2)C1	ZINC000819255935	FD	On-Demand	Anodyne	SLC6A1	63	33
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)/C=C\[C@@H]3CCCO3)c2)C1	ZINC000819255936	FD	On-Demand	Anodyne	SLC6A1	63	33
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)/C=C/[C@H]3CCCO3)c2)C1	ZINC000819255937	FD	On-Demand	Anodyne	SLC6A1	63	33
O=C1[C@H](NC[C@H](O)c2ccccc2Cl)CCCN1Cc1ccc(F)cc1F	ZINC000819255942	GG	On-Demand	Anodyne	P2RX7	36	40
O=C1[C@@H](NC[C@H](O)c2ccccc2Cl)CCCN1Cc1ccc(F)cc1F	ZINC000819255943	GG	On-Demand	Anodyne	P2RX7	36	40
COc1ccc(OC)c([C@H](O)CNCCc2cc(C)c(O)c(C)c2)c1	ZINC000819255948	EF	On-Demand	Anodyne	ADRB2	58	56
COc1ccc(OC)c([C@H](O)CNCCc2cc(C)c(O)c(C)c2)c1	ZINC000819255948	EF	On-Demand	Anodyne	ADRB1	51	44
COc1ccc(OC)c([C@H](O)CNCCc2cc(C)c(O)c(C)c2)c1	ZINC000819255948	EF	On-Demand	Anodyne	ADRB3	38	43
CO[C@@H](CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)C(F)(F)F	ZINC000819255990	FD	On-Demand	Anodyne	ADRB3	44	38
CO[C@@H](CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)C(F)(F)F	ZINC000819255990	FD	On-Demand	Anodyne	CTSF	51	37
CO[C@@H](CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)C(F)(F)F	ZINC000819255992	FD	On-Demand	Anodyne	ADRB3	44	38
CO[C@@H](CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)C(F)(F)F	ZINC000819255992	FD	On-Demand	Anodyne	CTSF	51	37
CO[C@@H](CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1)C(F)(F)F	ZINC000819255995	DE	On-Demand	Bother	ADRB3	44	38
CO[C@@H](CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1)C(F)(F)F	ZINC000819255995	DE	On-Demand	Bother	CACNA1D	53	36
CO[C@@H](CCNC[C@H](O)c1cccc([N+](=O)[O-])c1)C(F)(F)F	ZINC000819255997	DE	On-Demand	Bother	ADRB3	44	38
CO[C@@H](CCNC[C@H](O)c1cccc([N+](=O)[O-])c1)C(F)(F)F	ZINC000819255997	DE	On-Demand	Bother	CACNA1D	53	36
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1Cc1ccc(F)cc1F	ZINC000819255999	GG	On-Demand	Anodyne	ADRB3	41	39
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1Cc1ccc(F)cc1F	ZINC000819255999	GG	On-Demand	Anodyne	CYP3A4	44	33
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1Cc1ccc(F)cc1F	ZINC000819256000	GG	On-Demand	Anodyne	ADRB3	41	39
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCCN1Cc1ccc(F)cc1F	ZINC000819256000	GG	On-Demand	Anodyne	CYP3A4	44	33
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1Cc1ccc(F)cc1F	ZINC000819256001	GG	On-Demand	Anodyne	ADRB3	41	39
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1Cc1ccc(F)cc1F	ZINC000819256001	GG	On-Demand	Anodyne	CYP3A4	44	33
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1Cc1ccc(F)cc1F	ZINC000819256002	GG	On-Demand	Anodyne	ADRB3	41	39
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCCN1Cc1ccc(F)cc1F	ZINC000819256002	GG	On-Demand	Anodyne	CYP3A4	44	33
C[C@H](CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256014	GF	On-Demand	Anodyne	KLK3	50	34
C[C@H](CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256014	GF	On-Demand	Anodyne	CTSB	47	40
C[C@H](CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256014	GF	On-Demand	Anodyne	CAPNS1	63	32
C[C@H](CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256014	GF	On-Demand	Anodyne	CAPN1	79	38
C[C@H](CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256014	GF	On-Demand	Anodyne	CAPN2	104	38
C[C@H](CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256014	GF	On-Demand	Anodyne	NPR	63	35
C[C@@H](CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256015	GF	On-Demand	Anodyne	KLK3	50	34
C[C@@H](CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256015	GF	On-Demand	Anodyne	CTSB	47	40
C[C@@H](CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256015	GF	On-Demand	Anodyne	CAPNS1	63	32
C[C@@H](CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256015	GF	On-Demand	Anodyne	CAPN1	79	38
C[C@@H](CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256015	GF	On-Demand	Anodyne	CAPN2	104	38
C[C@@H](CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256015	GF	On-Demand	Anodyne	NPR	63	35
C[C@@H](CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256016	GF	On-Demand	Anodyne	KLK3	50	34
C[C@@H](CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256016	GF	On-Demand	Anodyne	CTSB	47	40
C[C@@H](CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256016	GF	On-Demand	Anodyne	CAPNS1	63	32
C[C@@H](CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256016	GF	On-Demand	Anodyne	CAPN1	79	38
C[C@@H](CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256016	GF	On-Demand	Anodyne	CAPN2	104	38
C[C@@H](CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256016	GF	On-Demand	Anodyne	NPR	63	35
C[C@H](CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256017	GF	On-Demand	Anodyne	KLK3	50	34
C[C@H](CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256017	GF	On-Demand	Anodyne	CTSB	47	40
C[C@H](CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256017	GF	On-Demand	Anodyne	CAPNS1	63	32
C[C@H](CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256017	GF	On-Demand	Anodyne	CAPN1	79	38
C[C@H](CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256017	GF	On-Demand	Anodyne	CAPN2	104	38
C[C@H](CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1)S(C)(=O)=O	ZINC000819256017	GF	On-Demand	Anodyne	NPR	63	35
COc1cc2c(cc1OC)CN(C(=O)CCCNC(=O)C(F)=C1CCC1)CC2	ZINC000819256020	GF	On-Demand	Anodyne	ABCB1	15	46
CO[C@@H](CCNC[C@@H](O)c1cccnc1)C(F)(F)F	ZINC000819256025	CD	On-Demand	Anodyne	ADRB2	28	50
CO[C@@H](CCNC[C@@H](O)c1cccnc1)C(F)(F)F	ZINC000819256025	CD	On-Demand	Anodyne	ADRB1	39	51
CO[C@@H](CCNC[C@@H](O)c1cccnc1)C(F)(F)F	ZINC000819256025	CD	On-Demand	Anodyne	ADRB3	116	50
CO[C@@H](CCNC[C@H](O)c1cccnc1)C(F)(F)F	ZINC000819256026	CD	On-Demand	Anodyne	ADRB2	28	50
CO[C@@H](CCNC[C@H](O)c1cccnc1)C(F)(F)F	ZINC000819256026	CD	On-Demand	Anodyne	ADRB1	39	51
CO[C@@H](CCNC[C@H](O)c1cccnc1)C(F)(F)F	ZINC000819256026	CD	On-Demand	Anodyne	ADRB3	116	50
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccccc2OC(F)F)c1	ZINC000819256035	FG	On-Demand	Bother	ADRB3	58	39
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccccc2OC(F)F)c1	ZINC000819256036	FG	On-Demand	Bother	ADRB3	58	39
CCOc1ccc(OC[C@@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819256051	DD	On-Demand	Anodyne	ADRB2	18	43
CCOc1ccc(OC[C@@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819256051	DD	On-Demand	Anodyne	ADRB1	29	44
CCOc1ccc(OC[C@@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819256052	DD	On-Demand	Anodyne	ADRB2	18	43
CCOc1ccc(OC[C@@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819256052	DD	On-Demand	Anodyne	ADRB1	29	44
CCOc1ccc(OC[C@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819256053	DD	On-Demand	Anodyne	ADRB2	18	43
CCOc1ccc(OC[C@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819256053	DD	On-Demand	Anodyne	ADRB1	29	44
CCOc1ccc(OC[C@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819256054	DD	On-Demand	Anodyne	ADRB2	18	43
CCOc1ccc(OC[C@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819256054	DD	On-Demand	Anodyne	ADRB1	29	44
O=[N+]([O-])c1cccc([C@H](O)CNCCOCC(F)F)c1	ZINC000819256059	CD	On-Demand	Bother	ADRB1	40	39
O=[N+]([O-])c1cccc([C@H](O)CNCCOCC(F)F)c1	ZINC000819256059	CD	On-Demand	Bother	ADRB3	46	39
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCC(F)F)c1	ZINC000819256060	CD	On-Demand	Bother	ADRB1	40	39
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCC(F)F)c1	ZINC000819256060	CD	On-Demand	Bother	ADRB3	46	39
CC(C)(C)OC(=O)N1CCC[C@H](CCNC(=O)C(F)=C2CCC2)C1	ZINC000819256071	EH	On-Demand	Anodyne	GPR119	22	40
CC(C)(C)OC(=O)N1CCC[C@@H](CCNC(=O)C(F)=C2CCC2)C1	ZINC000819256072	EH	On-Demand	Anodyne	GPR119	22	40
N#Cc1ccc(OC[C@@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819256078	CC	On-Demand	Mild	ADRB1	21	41
N#Cc1ccc(OC[C@@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819256079	CC	On-Demand	Mild	ADRB1	21	41
N#Cc1ccc(OC[C@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819256080	CC	On-Demand	Mild	ADRB1	21	41
N#Cc1ccc(OC[C@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819256081	CC	On-Demand	Mild	ADRB1	21	41
CC(=O)c1ccc(OC[C@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819256082	DD	On-Demand	Anodyne	ADRB1	34	41
CC(=O)c1ccc(OC[C@@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819256083	DD	On-Demand	Anodyne	ADRB1	34	41
CC(=O)c1ccc(OC[C@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819256084	DD	On-Demand	Anodyne	ADRB1	34	41
CC(=O)c1ccc(OC[C@@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819256085	DD	On-Demand	Anodyne	ADRB1	34	41
O[C@@H](CNCCc1ccccc1OC(F)F)c1ccc(F)c(F)c1	ZINC000819256100	EG	On-Demand	Anodyne	ADRB3	54	38
O[C@H](CNCCc1ccccc1OC(F)F)c1ccc(F)c(F)c1	ZINC000819256101	EG	On-Demand	Anodyne	ADRB3	54	38
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2ccccn2)cs1	ZINC000819256106	DF	On-Demand	Anodyne	NPY5R	17	54
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2ccccn2)cs1	ZINC000819256106	DF	On-Demand	Anodyne	KCNN1	28	45
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2ccccn2)cs1	ZINC000819256107	DF	On-Demand	Anodyne	NPY5R	17	54
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2ccccn2)cs1	ZINC000819256107	DF	On-Demand	Anodyne	KCNN1	28	45
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2ccccn2)cs1	ZINC000819256108	DF	On-Demand	Anodyne	NPY5R	17	54
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2ccccn2)cs1	ZINC000819256108	DF	On-Demand	Anodyne	KCNN1	28	45
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2ccccn2)cs1	ZINC000819256109	DF	On-Demand	Anodyne	NPY5R	17	54
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2ccccn2)cs1	ZINC000819256109	DF	On-Demand	Anodyne	KCNN1	28	45
O[C@@H](CNCCc1ccccc1OC(F)F)c1ccccc1F	ZINC000819256118	EG	On-Demand	Anodyne	ADRB2	20	41
O[C@@H](CNCCc1ccccc1OC(F)F)c1ccccc1F	ZINC000819256118	EG	On-Demand	Anodyne	ADRB1	17	41
O[C@H](CNCCc1ccccc1OC(F)F)c1ccccc1F	ZINC000819256119	EG	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNCCc1ccccc1OC(F)F)c1ccccc1F	ZINC000819256119	EG	On-Demand	Anodyne	ADRB1	17	41
C#CCOc1cccc(NC(=O)C2(CC=C)CCOCC2)c1	ZINC000819256148	CG	On-Demand	Mild	EPHX2	18	40
C#CCOc1cccc(NC(=O)C2(CC=C)CCOCC2)c1	ZINC000819256148	CG	On-Demand	Mild	LIMK2	22	43
O=S1(=O)CC(CCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819256170	DD	On-Demand	Anodyne	ADRB2	43	38
O=S1(=O)CC(CCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819256170	DD	On-Demand	Anodyne	ADRB1	57	51
O=S1(=O)CC(CCNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819256170	DD	On-Demand	Anodyne	ADRB3	74	51
O=S1(=O)CC(CCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819256171	DD	On-Demand	Anodyne	ADRB2	43	38
O=S1(=O)CC(CCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819256171	DD	On-Demand	Anodyne	ADRB1	57	51
O=S1(=O)CC(CCNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819256171	DD	On-Demand	Anodyne	ADRB3	74	51
CO[C@@H](CCNC[C@H](O)c1ccc(Cl)cc1)C(F)(F)F	ZINC000819256181	DF	On-Demand	Anodyne	ADRB1	22	41
CO[C@@H](CCNC[C@H](O)c1ccc(Cl)cc1)C(F)(F)F	ZINC000819256181	DF	On-Demand	Anodyne	ADRB3	30	41
O[C@@H](CNOC[C@H]1CCOC1)COc1cccc(C(F)(F)F)c1	ZINC000819256183	EE	On-Demand	Anodyne	PDS	42	37
O[C@H](CNOC[C@@H]1CCOC1)COc1cccc(C(F)(F)F)c1	ZINC000819256184	EE	On-Demand	Anodyne	PDS	42	37
O[C@H](CNOC[C@H]1CCOC1)COc1cccc(C(F)(F)F)c1	ZINC000819256185	EE	On-Demand	Anodyne	PDS	42	37
O[C@@H](CNOC[C@@H]1CCOC1)COc1cccc(C(F)(F)F)c1	ZINC000819256186	EE	On-Demand	Anodyne	PDS	42	37
O[C@H](CNOC[C@H]1CCOC1)c1cccnc1	ZINC000819256193	BC	On-Demand	Anodyne	ADRB3	44	38
O[C@@H](CNOC[C@H]1CCOC1)c1cccnc1	ZINC000819256194	BC	On-Demand	Anodyne	ADRB3	44	38
O[C@@H](CNOC[C@@H]1CCOC1)c1cccnc1	ZINC000819256195	BC	On-Demand	Anodyne	ADRB3	44	38
O[C@H](CNOC[C@@H]1CCOC1)c1cccnc1	ZINC000819256196	BC	On-Demand	Anodyne	ADRB3	44	38
CN1CCC[C@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819256197	FE	On-Demand	Mild	PAPA1_CARPA	38	49
CN1CCC[C@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819256199	FE	On-Demand	Mild	PAPA1_CARPA	38	49
O[C@@H](CNCCc1ccccc1OC(F)F)c1ccccc1	ZINC000819256223	DG	On-Demand	Anodyne	ADRB2	40	49
O[C@@H](CNCCc1ccccc1OC(F)F)c1ccccc1	ZINC000819256223	DG	On-Demand	Anodyne	ADRB1	52	42
O[C@@H](CNCCc1ccccc1OC(F)F)c1ccccc1	ZINC000819256223	DG	On-Demand	Anodyne	ADRB3	75	47
O[C@H](CNCCc1ccccc1OC(F)F)c1ccccc1	ZINC000819256224	DG	On-Demand	Anodyne	ADRB2	40	49
O[C@H](CNCCc1ccccc1OC(F)F)c1ccccc1	ZINC000819256224	DG	On-Demand	Anodyne	ADRB1	52	42
O[C@H](CNCCc1ccccc1OC(F)F)c1ccccc1	ZINC000819256224	DG	On-Demand	Anodyne	ADRB3	75	47
O[C@@H](CNOC[C@@H]1CCOC1)COc1ccc2ccccc2c1	ZINC000819256252	DE	On-Demand	Anodyne	ADRB2	18	50
O[C@H](CNOC[C@@H]1CCOC1)COc1ccc2ccccc2c1	ZINC000819256253	DE	On-Demand	Anodyne	ADRB2	18	50
O[C@H](CNOC[C@H]1CCOC1)COc1ccc2ccccc2c1	ZINC000819256255	DE	On-Demand	Anodyne	ADRB2	18	50
O[C@@H](CNOC[C@H]1CCOC1)COc1ccc2ccccc2c1	ZINC000819256258	DE	On-Demand	Anodyne	ADRB2	18	50
C#CCOc1ccc(NC(=O)[C@H]2CCCO[C@H]2C(C)C)cc1	ZINC000819256285	DG	On-Demand	Mild	PFKFB3	41	32
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)cs2)CC1	ZINC000819256299	FI	On-Demand	Anodyne	CPT1A	23	45
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)cs2)CC1	ZINC000819256299	FI	On-Demand	Anodyne	ETHR	32	40
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)cs2)CC1	ZINC000819256303	FI	On-Demand	Anodyne	CPT1A	23	45
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)cs2)CC1	ZINC000819256303	FI	On-Demand	Anodyne	ETHR	32	40
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)cs2)CC1	ZINC000819256305	FI	On-Demand	Anodyne	CPT1A	23	45
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)cs2)CC1	ZINC000819256305	FI	On-Demand	Anodyne	ETHR	32	40
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)cs2)CC1	ZINC000819256307	FI	On-Demand	Anodyne	CPT1A	23	45
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2nc(-c3ccccc3)cs2)CC1	ZINC000819256307	FI	On-Demand	Anodyne	ETHR	32	40
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CSc1nc2ccccc2s1	ZINC000819256402	JK	On-Demand	Anodyne	KCNK3	95	40
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CSc1nc2ccccc2s1	ZINC000819256402	JK	On-Demand	Anodyne	KCNK9	53	37
CO[C@@H](CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C(F)(F)F	ZINC000819256452	GF	On-Demand	Anodyne	GPR119	30	42
CO[C@@H](CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C(F)(F)F	ZINC000819256453	GF	On-Demand	Anodyne	GPR119	30	42
CCOC(=O)c1csc(CCNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819256463	FF	On-Demand	Anodyne	ADRB2	45	41
CCOC(=O)c1csc(CCNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819256463	FF	On-Demand	Anodyne	ADRB1	64	49
CCOC(=O)c1csc(CCNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819256463	FF	On-Demand	Anodyne	ADRB3	103	49
CCOC(=O)c1csc(CCNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819256464	FF	On-Demand	Anodyne	ADRB2	45	41
CCOC(=O)c1csc(CCNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819256464	FF	On-Demand	Anodyne	ADRB1	64	49
CCOC(=O)c1csc(CCNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819256464	FF	On-Demand	Anodyne	ADRB3	103	49
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCO[C@@H](c2nn[nH]n2)C1	ZINC000819256465	EB	On-Demand	Anodyne	KCNJ1	45	36
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCO[C@H](c2nn[nH]n2)C1	ZINC000819256466	EB	On-Demand	Anodyne	KCNJ1	45	36
CO[C@@H](CCNC[C@@H](O)c1cccc(F)c1)C(F)(F)F	ZINC000819256481	CE	On-Demand	Anodyne	ADRB1	30	46
CO[C@@H](CCNC[C@@H](O)c1cccc(F)c1)C(F)(F)F	ZINC000819256481	CE	On-Demand	Anodyne	ADRB3	42	46
CO[C@@H](CCNC[C@H](O)c1cccc(F)c1)C(F)(F)F	ZINC000819256483	CE	On-Demand	Anodyne	ADRB1	30	46
CO[C@@H](CCNC[C@H](O)c1cccc(F)c1)C(F)(F)F	ZINC000819256483	CE	On-Demand	Anodyne	ADRB3	42	46
CCOC(=O)c1csc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)n1	ZINC000819256489	GD	On-Demand	Anodyne	ADRB3	65	42
CCOC(=O)c1csc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)n1	ZINC000819256490	GD	On-Demand	Anodyne	ADRB3	65	42
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@@H]1c1cc2ccccc2[nH]1	ZINC000819256517	DH	On-Demand	Anodyne	CPT1A	43	33
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@@H]1c1cc2ccccc2[nH]1	ZINC000819256518	DH	On-Demand	Anodyne	CPT1A	43	33
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@H]1c1cc2ccccc2[nH]1	ZINC000819256519	DH	On-Demand	Anodyne	CPT1A	43	33
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@H]1c1cc2ccccc2[nH]1	ZINC000819256520	DH	On-Demand	Anodyne	CPT1A	43	33
O[C@@H](CNCCc1ccccc1OC(F)F)c1cccc(Br)c1	ZINC000819256541	GH	On-Demand	Anodyne	ADRB3	52	38
O[C@H](CNCCc1ccccc1OC(F)F)c1cccc(Br)c1	ZINC000819256542	GH	On-Demand	Anodyne	ADRB3	52	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1nnc(Cc2ccccc2F)s1	ZINC000819256584	GG	On-Demand	Anodyne	PAPA1_CARPA	18	41
O[C@H](CNOC[C@@H]1CCOC1)COc1cccc2[nH]ccc12	ZINC000819256589	DD	On-Demand	Anodyne	ADRB1	21	61
O[C@@H](CNOC[C@@H]1CCOC1)COc1cccc2[nH]ccc12	ZINC000819256590	DD	On-Demand	Anodyne	ADRB1	21	61
O[C@H](CNOC[C@H]1CCOC1)COc1cccc2[nH]ccc12	ZINC000819256591	DD	On-Demand	Anodyne	ADRB1	21	61
O[C@@H](CNOC[C@H]1CCOC1)COc1cccc2[nH]ccc12	ZINC000819256592	DD	On-Demand	Anodyne	ADRB1	21	61
O[C@@H](CNCCc1ccccc1OC(F)F)c1cccc(C(F)(F)F)c1	ZINC000819256593	GI	On-Demand	Anodyne	ADRB3	49	41
O[C@H](CNCCc1ccccc1OC(F)F)c1cccc(C(F)(F)F)c1	ZINC000819256594	GI	On-Demand	Anodyne	ADRB3	49	41
Cn1nc(CC(C)(C)C)cc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819256610	GH	On-Demand	Mild	PAPA1_CARPA	37	43
Cn1nc(CC(C)(C)C)cc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819256611	GH	On-Demand	Mild	PAPA1_CARPA	37	43
CO[C@@H](CCNC[C@@H](O)c1ccccc1)C(F)(F)F	ZINC000819256632	CE	On-Demand	Anodyne	ADRB2	25	45
CO[C@@H](CCNC[C@@H](O)c1ccccc1)C(F)(F)F	ZINC000819256632	CE	On-Demand	Anodyne	ADRB1	39	40
CO[C@@H](CCNC[C@@H](O)c1ccccc1)C(F)(F)F	ZINC000819256632	CE	On-Demand	Anodyne	ADRB3	56	45
CO[C@@H](CCNC[C@@H](O)c1ccccc1)C(F)(F)F	ZINC000819256632	CE	On-Demand	Anodyne	AOC3	15	43
CO[C@@H](CCNC[C@H](O)c1ccccc1)C(F)(F)F	ZINC000819256634	CE	On-Demand	Anodyne	ADRB2	25	45
CO[C@@H](CCNC[C@H](O)c1ccccc1)C(F)(F)F	ZINC000819256634	CE	On-Demand	Anodyne	ADRB1	39	40
CO[C@@H](CCNC[C@H](O)c1ccccc1)C(F)(F)F	ZINC000819256634	CE	On-Demand	Anodyne	ADRB3	56	45
CO[C@@H](CCNC[C@H](O)c1ccccc1)C(F)(F)F	ZINC000819256634	CE	On-Demand	Anodyne	AOC3	15	43
C#CCOc1cccc(NC(=O)[C@H]2CCCO[C@H]2C(C)C)c1	ZINC000819256638	DG	On-Demand	Mild	EPHX2	17	43
O=C(OCc1ccccc1)[C@@H](CNCC1(O)CCC1)c1ccccc1	ZINC000819256662	EG	On-Demand	Anodyne	SLC12A5	71	40
O=C(OCc1ccccc1)[C@H](CNCC1(O)CCC1)c1ccccc1	ZINC000819256663	EG	On-Demand	Anodyne	SLC12A5	71	40
CCOC(=O)c1csc(CCNC[C@H](O)c2cccc(Br)c2)n1	ZINC000819256691	GF	On-Demand	Anodyne	ADRB3	69	39
CCOC(=O)c1csc(CCNC[C@@H](O)c2cccc(Br)c2)n1	ZINC000819256692	GF	On-Demand	Anodyne	ADRB3	69	39
CCOC(=O)c1csc(CCNC[C@H](O)c2ccccc2)n1	ZINC000819256708	DE	On-Demand	Anodyne	ADRB2	33	42
CCOC(=O)c1csc(CCNC[C@H](O)c2ccccc2)n1	ZINC000819256708	DE	On-Demand	Anodyne	ADRB1	49	39
CCOC(=O)c1csc(CCNC[C@H](O)c2ccccc2)n1	ZINC000819256708	DE	On-Demand	Anodyne	ADRB3	98	46
CCOC(=O)c1csc(CCNC[C@@H](O)c2ccccc2)n1	ZINC000819256709	DE	On-Demand	Anodyne	ADRB2	33	42
CCOC(=O)c1csc(CCNC[C@@H](O)c2ccccc2)n1	ZINC000819256709	DE	On-Demand	Anodyne	ADRB1	49	39
CCOC(=O)c1csc(CCNC[C@@H](O)c2ccccc2)n1	ZINC000819256709	DE	On-Demand	Anodyne	ADRB3	98	46
CCCO[C@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819256763	GG	On-Demand	Mild	PAPA1_CARPA	31	42
CCCO[C@@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819256764	GG	On-Demand	Mild	PAPA1_CARPA	31	42
CCCO[C@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819256765	GG	On-Demand	Mild	PAPA1_CARPA	31	42
CCCO[C@@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819256766	GG	On-Demand	Mild	PAPA1_CARPA	31	42
O[C@H](CNOC[C@H]1CCOC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819256819	FF	On-Demand	Anodyne	ADRB2	27	42
O[C@H](CNOC[C@H]1CCOC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819256819	FF	On-Demand	Anodyne	ADRB1	47	40
O[C@H](CNOC[C@@H]1CCOC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819256820	FF	On-Demand	Anodyne	ADRB2	27	42
O[C@H](CNOC[C@@H]1CCOC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819256820	FF	On-Demand	Anodyne	ADRB1	47	40
O[C@@H](CNOC[C@H]1CCOC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819256821	FF	On-Demand	Anodyne	ADRB2	27	42
O[C@@H](CNOC[C@H]1CCOC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819256821	FF	On-Demand	Anodyne	ADRB1	47	40
O[C@@H](CNOC[C@@H]1CCOC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819256822	FF	On-Demand	Anodyne	ADRB2	27	42
O[C@@H](CNOC[C@@H]1CCOC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819256822	FF	On-Demand	Anodyne	ADRB1	47	40
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2ccccc2Cl)cs1	ZINC000819256874	EI	On-Demand	Anodyne	MPL	48	38
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2ccccc2Cl)cs1	ZINC000819256874	EI	On-Demand	Anodyne	SPHK1	20	41
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2ccccc2Cl)cs1	ZINC000819256875	EI	On-Demand	Anodyne	MPL	48	38
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2ccccc2Cl)cs1	ZINC000819256875	EI	On-Demand	Anodyne	SPHK1	20	41
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2ccccc2Cl)cs1	ZINC000819256876	EI	On-Demand	Anodyne	MPL	48	38
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2ccccc2Cl)cs1	ZINC000819256876	EI	On-Demand	Anodyne	SPHK1	20	41
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2ccccc2Cl)cs1	ZINC000819256878	EI	On-Demand	Anodyne	MPL	48	38
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2ccccc2Cl)cs1	ZINC000819256878	EI	On-Demand	Anodyne	SPHK1	20	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccccc2OC(F)F)cc1	ZINC000819256886	GF	On-Demand	Anodyne	ADRB2	54	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccccc2OC(F)F)cc1	ZINC000819256886	GF	On-Demand	Anodyne	ADRB1	44	39
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccccc2OC(F)F)cc1	ZINC000819256886	GF	On-Demand	Anodyne	ADRB3	97	40
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccccc2OC(F)F)cc1	ZINC000819256887	GF	On-Demand	Anodyne	ADRB2	54	42
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccccc2OC(F)F)cc1	ZINC000819256887	GF	On-Demand	Anodyne	ADRB1	44	39
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccccc2OC(F)F)cc1	ZINC000819256887	GF	On-Demand	Anodyne	ADRB3	97	40
O[C@H](CNCCOCC(F)F)c1ccc(OC(F)(F)F)cc1	ZINC000819256894	EE	On-Demand	Anodyne	ADRB2	29	41
O[C@H](CNCCOCC(F)F)c1ccc(OC(F)(F)F)cc1	ZINC000819256894	EE	On-Demand	Anodyne	ADRB3	27	45
O[C@@H](CNCCOCC(F)F)c1ccc(OC(F)(F)F)cc1	ZINC000819256897	EE	On-Demand	Anodyne	ADRB2	29	41
O[C@@H](CNCCOCC(F)F)c1ccc(OC(F)(F)F)cc1	ZINC000819256897	EE	On-Demand	Anodyne	ADRB3	27	45
COc1cccc(C2(CNC(=O)/C=C\[C@H]3CCCO3)CCCC2)c1	ZINC000819256905	EG	On-Demand	Anodyne	KCNA3	43	38
COc1cccc(C2(CNC(=O)/C=C\[C@H]3CCCO3)CCCC2)c1	ZINC000819256905	EG	On-Demand	Anodyne	SOAT1	15	41
COc1cccc(C2(CNC(=O)/C=C/[C@@H]3CCCO3)CCCC2)c1	ZINC000819256908	EG	On-Demand	Anodyne	KCNA3	43	38
COc1cccc(C2(CNC(=O)/C=C/[C@@H]3CCCO3)CCCC2)c1	ZINC000819256908	EG	On-Demand	Anodyne	SOAT1	15	41
COc1cccc(C2(CNC(=O)/C=C\[C@@H]3CCCO3)CCCC2)c1	ZINC000819256910	EG	On-Demand	Anodyne	KCNA3	43	38
COc1cccc(C2(CNC(=O)/C=C\[C@@H]3CCCO3)CCCC2)c1	ZINC000819256910	EG	On-Demand	Anodyne	SOAT1	15	41
COc1cccc(C2(CNC(=O)/C=C/[C@H]3CCCO3)CCCC2)c1	ZINC000819256912	EG	On-Demand	Anodyne	KCNA3	43	38
COc1cccc(C2(CNC(=O)/C=C/[C@H]3CCCO3)CCCC2)c1	ZINC000819256912	EG	On-Demand	Anodyne	SOAT1	15	41
O[C@H](CNCCOCC(F)F)c1cccc(Cl)c1	ZINC000819256915	CE	On-Demand	Anodyne	ADRB2	62	43
O[C@H](CNCCOCC(F)F)c1cccc(Cl)c1	ZINC000819256915	CE	On-Demand	Anodyne	ADRB1	72	51
O[C@H](CNCCOCC(F)F)c1cccc(Cl)c1	ZINC000819256915	CE	On-Demand	Anodyne	ADRB3	78	51
O[C@@H](CNCCOCC(F)F)c1cccc(Cl)c1	ZINC000819256919	CE	On-Demand	Anodyne	ADRB2	62	43
O[C@@H](CNCCOCC(F)F)c1cccc(Cl)c1	ZINC000819256919	CE	On-Demand	Anodyne	ADRB1	72	51
O[C@@H](CNCCOCC(F)F)c1cccc(Cl)c1	ZINC000819256919	CE	On-Demand	Anodyne	ADRB3	78	51
CC[C@@H](O)CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256927	EF	On-Demand	Anodyne	KLK3	42	33
CC[C@@H](O)CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256927	EF	On-Demand	Anodyne	CTSB	52	41
CC[C@@H](O)CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256927	EF	On-Demand	Anodyne	PAPA1_CARPA	40	33
CC[C@@H](O)CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256927	EF	On-Demand	Anodyne	CTSK	28	41
CC[C@@H](O)CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256927	EF	On-Demand	Anodyne	CAPNS1	53	33
CC[C@@H](O)CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256927	EF	On-Demand	Anodyne	CAPN1	72	40
CC[C@@H](O)CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256927	EF	On-Demand	Anodyne	CAPN2	111	41
CC[C@@H](O)CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256927	EF	On-Demand	Anodyne	NPR	60	35
CC[C@H](O)CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256929	EF	On-Demand	Anodyne	KLK3	42	33
CC[C@H](O)CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256929	EF	On-Demand	Anodyne	CTSB	52	41
CC[C@H](O)CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256929	EF	On-Demand	Anodyne	PAPA1_CARPA	40	33
CC[C@H](O)CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256929	EF	On-Demand	Anodyne	CTSK	28	41
CC[C@H](O)CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256929	EF	On-Demand	Anodyne	CAPNS1	53	33
CC[C@H](O)CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256929	EF	On-Demand	Anodyne	CAPN1	72	40
CC[C@H](O)CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256929	EF	On-Demand	Anodyne	CAPN2	111	41
CC[C@H](O)CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256929	EF	On-Demand	Anodyne	NPR	60	35
CC[C@H](O)CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256931	EF	On-Demand	Anodyne	KLK3	42	33
CC[C@H](O)CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256931	EF	On-Demand	Anodyne	CTSB	52	41
CC[C@H](O)CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256931	EF	On-Demand	Anodyne	PAPA1_CARPA	40	33
CC[C@H](O)CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256931	EF	On-Demand	Anodyne	CTSK	28	41
CC[C@H](O)CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256931	EF	On-Demand	Anodyne	CAPNS1	53	33
CC[C@H](O)CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256931	EF	On-Demand	Anodyne	CAPN1	72	40
CC[C@H](O)CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256931	EF	On-Demand	Anodyne	CAPN2	111	41
CC[C@H](O)CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256931	EF	On-Demand	Anodyne	NPR	60	35
CC[C@@H](O)CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256932	EF	On-Demand	Anodyne	KLK3	42	33
CC[C@@H](O)CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256932	EF	On-Demand	Anodyne	CTSB	52	41
CC[C@@H](O)CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256932	EF	On-Demand	Anodyne	PAPA1_CARPA	40	33
CC[C@@H](O)CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256932	EF	On-Demand	Anodyne	CTSK	28	41
CC[C@@H](O)CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256932	EF	On-Demand	Anodyne	CAPNS1	53	33
CC[C@@H](O)CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256932	EF	On-Demand	Anodyne	CAPN1	72	40
CC[C@@H](O)CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256932	EF	On-Demand	Anodyne	CAPN2	111	41
CC[C@@H](O)CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819256932	EF	On-Demand	Anodyne	NPR	60	35
O[C@@H](CNCCc1ccccc1OC(F)F)c1ccc(F)cc1	ZINC000819256953	EG	On-Demand	Anodyne	ADRB2	40	43
O[C@@H](CNCCc1ccccc1OC(F)F)c1ccc(F)cc1	ZINC000819256953	EG	On-Demand	Anodyne	ADRB3	45	40
O[C@H](CNCCc1ccccc1OC(F)F)c1ccc(F)cc1	ZINC000819256955	EG	On-Demand	Anodyne	ADRB2	40	43
O[C@H](CNCCc1ccccc1OC(F)F)c1ccc(F)cc1	ZINC000819256955	EG	On-Demand	Anodyne	ADRB3	45	40
O=C(OCc1ccccc1)[C@@H](CNCC1(O)CCOCC1)c1ccccc1	ZINC000819256970	FF	On-Demand	Anodyne	SLC12A5	58	35
O=C(OCc1ccccc1)[C@H](CNCC1(O)CCOCC1)c1ccccc1	ZINC000819256973	FF	On-Demand	Anodyne	SLC12A5	58	35
C#CCOc1cccc(NC(=O)[C@H]2C[C@H]2NC(=O)OC(C)(C)C)c1	ZINC000819256975	EF	On-Demand	Mild	EPHX2	20	40
C[C@@](O)(CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1)C(F)(F)F	ZINC000819256998	GG	On-Demand	Anodyne	CAPNS1	45	29
C[C@@](O)(CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1)C(F)(F)F	ZINC000819256998	GG	On-Demand	Anodyne	CAPN1	43	37
C[C@@](O)(CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1)C(F)(F)F	ZINC000819256998	GG	On-Demand	Anodyne	CAPN2	58	33
C[C@@](O)(CNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1)C(F)(F)F	ZINC000819256998	GG	On-Demand	Anodyne	NPR	40	34
C[C@@](O)(CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1)C(F)(F)F	ZINC000819257000	GG	On-Demand	Anodyne	CAPNS1	45	29
C[C@@](O)(CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1)C(F)(F)F	ZINC000819257000	GG	On-Demand	Anodyne	CAPN1	43	37
C[C@@](O)(CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1)C(F)(F)F	ZINC000819257000	GG	On-Demand	Anodyne	CAPN2	58	33
C[C@@](O)(CNC[C@H](C(=O)OCc1ccccc1)c1ccccc1)C(F)(F)F	ZINC000819257000	GG	On-Demand	Anodyne	NPR	40	34
O=S1(=O)CC(CCNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819257024	CC	On-Demand	Anodyne	ADRB1	25	42
O=S1(=O)CC(CCNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819257024	CC	On-Demand	Anodyne	ADRB3	42	42
O=S1(=O)CC(CCNC[C@H](O)c2cccc(F)c2)C1	ZINC000819257025	CC	On-Demand	Anodyne	ADRB1	25	42
O=S1(=O)CC(CCNC[C@H](O)c2cccc(F)c2)C1	ZINC000819257025	CC	On-Demand	Anodyne	ADRB3	42	42
CC(C)(C)OC(=O)NCC[C@H](O)CNCC(F)(F)c1ccccc1	ZINC000819257033	EF	On-Demand	Anodyne	PAPA1_CARPA	32	40
CC(C)(C)OC(=O)NCC[C@@H](O)CNCC(F)(F)c1ccccc1	ZINC000819257037	EF	On-Demand	Anodyne	PAPA1_CARPA	32	40
COc1ccc(OC)c([C@H](O)CNCCc2ccccc2OC(F)F)c1	ZINC000819257040	FG	On-Demand	Anodyne	ADRB2	32	49
COc1ccc(OC)c([C@H](O)CNCCc2ccccc2OC(F)F)c1	ZINC000819257040	FG	On-Demand	Anodyne	ADRB1	28	43
O[C@@H](CNCCOC(F)(F)F)c1ccc(OC(F)(F)F)cc1	ZINC000819257058	EF	On-Demand	Anodyne	ADRB3	26	45
O[C@H](CNCCOC(F)(F)F)c1ccc(OC(F)(F)F)cc1	ZINC000819257059	EF	On-Demand	Anodyne	ADRB3	26	45
CCOC(=O)c1csc(CCNC[C@H](O)c2cccc(F)c2)n1	ZINC000819257104	EE	On-Demand	Anodyne	ADRB1	33	45
CCOC(=O)c1csc(CCNC[C@H](O)c2cccc(F)c2)n1	ZINC000819257104	EE	On-Demand	Anodyne	ADRB3	76	45
CCOC(=O)c1csc(CCNC[C@@H](O)c2cccc(F)c2)n1	ZINC000819257107	EE	On-Demand	Anodyne	ADRB1	33	45
CCOC(=O)c1csc(CCNC[C@@H](O)c2cccc(F)c2)n1	ZINC000819257107	EE	On-Demand	Anodyne	ADRB3	76	45
CCOC(=O)c1csc(CCNC[C@H](O)c2ccc(F)c(F)c2)n1	ZINC000819257124	FE	On-Demand	Anodyne	ADRB3	48	39
CCOC(=O)c1csc(CCNC[C@@H](O)c2ccc(F)c(F)c2)n1	ZINC000819257127	FE	On-Demand	Anodyne	ADRB3	48	39
CCOC(=O)c1csc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819257135	FE	On-Demand	Bother	CACNA1C	62	41
CCOC(=O)c1csc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819257135	FE	On-Demand	Bother	ADRB3	63	38
CCOC(=O)c1csc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819257135	FE	On-Demand	Bother	CACNA1D	90	39
CCOC(=O)c1csc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819257136	FE	On-Demand	Bother	CACNA1C	62	41
CCOC(=O)c1csc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819257136	FE	On-Demand	Bother	ADRB3	63	38
CCOC(=O)c1csc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819257136	FE	On-Demand	Bother	CACNA1D	90	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@H]2NC[C@H](O)Cc1ccccc1	ZINC000819257153	GE	On-Demand	Anodyne	PGC	53	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@H]2NC[C@H](O)Cc1ccccc1	ZINC000819257153	GE	On-Demand	Anodyne	PAPA1_CARPA	31	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@H]2NC[C@H](O)Cc1ccccc1	ZINC000819257153	GE	On-Demand	Anodyne	CTSL	16	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@H]2NC[C@H](O)Cc1ccccc1	ZINC000819257153	GE	On-Demand	Anodyne	REN	64	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@H]2NC[C@H](O)Cc1ccccc1	ZINC000819257153	GE	On-Demand	Anodyne	FPR1	52	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@H]2NC[C@@H](O)Cc1ccccc1	ZINC000819257159	GE	On-Demand	Anodyne	PGC	53	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@H]2NC[C@@H](O)Cc1ccccc1	ZINC000819257159	GE	On-Demand	Anodyne	PAPA1_CARPA	31	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@H]2NC[C@@H](O)Cc1ccccc1	ZINC000819257159	GE	On-Demand	Anodyne	CTSL	16	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@H]2NC[C@@H](O)Cc1ccccc1	ZINC000819257159	GE	On-Demand	Anodyne	REN	64	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@H]2NC[C@@H](O)Cc1ccccc1	ZINC000819257159	GE	On-Demand	Anodyne	FPR1	52	41
O=C(/C=C/[C@@H]1CCCO1)N1CCc2ccccc2[C@H]1c1ccccc1	ZINC000819257162	EH	On-Demand	Anodyne	TRPM8	27	43
O=C(/C=C\[C@@H]1CCCO1)N1CCc2ccccc2[C@H]1c1ccccc1	ZINC000819257163	EH	On-Demand	Anodyne	TRPM8	27	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@@H]2NC[C@H](O)Cc1ccccc1	ZINC000819257164	GE	On-Demand	Anodyne	PGC	53	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@@H]2NC[C@H](O)Cc1ccccc1	ZINC000819257164	GE	On-Demand	Anodyne	PAPA1_CARPA	31	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@@H]2NC[C@H](O)Cc1ccccc1	ZINC000819257164	GE	On-Demand	Anodyne	CTSL	16	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@@H]2NC[C@H](O)Cc1ccccc1	ZINC000819257164	GE	On-Demand	Anodyne	REN	64	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@@H]2NC[C@H](O)Cc1ccccc1	ZINC000819257164	GE	On-Demand	Anodyne	FPR1	52	41
O=C(/C=C/[C@@H]1CCCO1)N1CCc2ccccc2[C@@H]1c1ccccc1	ZINC000819257166	EH	On-Demand	Anodyne	TRPM8	27	43
O=C(/C=C\[C@@H]1CCCO1)N1CCc2ccccc2[C@@H]1c1ccccc1	ZINC000819257167	EH	On-Demand	Anodyne	TRPM8	27	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@@H]2NC[C@@H](O)Cc1ccccc1	ZINC000819257170	GE	On-Demand	Anodyne	PGC	53	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@@H]2NC[C@@H](O)Cc1ccccc1	ZINC000819257170	GE	On-Demand	Anodyne	PAPA1_CARPA	31	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@@H]2NC[C@@H](O)Cc1ccccc1	ZINC000819257170	GE	On-Demand	Anodyne	CTSL	16	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@@H]2NC[C@@H](O)Cc1ccccc1	ZINC000819257170	GE	On-Demand	Anodyne	REN	64	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]2COC[C@H](C1)[C@@H]2NC[C@@H](O)Cc1ccccc1	ZINC000819257170	GE	On-Demand	Anodyne	FPR1	52	41
Cc1ccccc1[C@@H](O)CNCCc1cc(C)c(O)c(C)c1	ZINC000819257187	CG	On-Demand	Anodyne	ADRB2	81	40
Cc1ccccc1[C@@H](O)CNCCc1cc(C)c(O)c(C)c1	ZINC000819257187	CG	On-Demand	Anodyne	ADRB1	68	45
Cc1ccccc1[C@@H](O)CNCCc1cc(C)c(O)c(C)c1	ZINC000819257187	CG	On-Demand	Anodyne	ADRB3	56	39
N#CCCNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819257189	DG	On-Demand	Mild	PAPA1_CARPA	33	42
N#CCCNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819257189	DG	On-Demand	Mild	CTSK	18	42
N#CCCNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819257189	DG	On-Demand	Mild	CTSL	27	42
N#CCCNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819257189	DG	On-Demand	Mild	CAPN2	49	33
N#CCCNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819257191	DG	On-Demand	Mild	PAPA1_CARPA	33	42
N#CCCNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819257191	DG	On-Demand	Mild	CTSK	18	42
N#CCCNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819257191	DG	On-Demand	Mild	CTSL	27	42
N#CCCNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819257191	DG	On-Demand	Mild	CAPN2	49	33
CON(C)C(=O)CCNC[C@H](Cc1ccccc1)C(C)C	ZINC000819257203	CF	On-Demand	Anodyne	MME	61	37
CON(C)C(=O)CCNC[C@H](Cc1ccccc1)C(C)C	ZINC000819257203	CF	On-Demand	Anodyne	PAPA1_CARPA	43	34
CON(C)C(=O)CCNC[C@H](Cc1ccccc1)C(C)C	ZINC000819257203	CF	On-Demand	Anodyne	CAPNS1	43	34
CON(C)C(=O)CCNC[C@H](Cc1ccccc1)C(C)C	ZINC000819257203	CF	On-Demand	Anodyne	CAPN1	46	35
CON(C)C(=O)CCNC[C@@H](Cc1ccccc1)C(C)C	ZINC000819257205	CF	On-Demand	Anodyne	MME	61	37
CON(C)C(=O)CCNC[C@@H](Cc1ccccc1)C(C)C	ZINC000819257205	CF	On-Demand	Anodyne	PAPA1_CARPA	43	34
CON(C)C(=O)CCNC[C@@H](Cc1ccccc1)C(C)C	ZINC000819257205	CF	On-Demand	Anodyne	CAPNS1	43	34
CON(C)C(=O)CCNC[C@@H](Cc1ccccc1)C(C)C	ZINC000819257205	CF	On-Demand	Anodyne	CAPN1	46	35
O[C@@H](CNCCc1ccccc1OC(F)F)c1ccc(Cl)cc1	ZINC000819257212	EH	On-Demand	Anodyne	ADRB2	34	42
O[C@@H](CNCCc1ccccc1OC(F)F)c1ccc(Cl)cc1	ZINC000819257212	EH	On-Demand	Anodyne	ADRB1	36	43
O[C@@H](CNCCc1ccccc1OC(F)F)c1ccc(Cl)cc1	ZINC000819257212	EH	On-Demand	Anodyne	ADRB3	46	43
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(c3ccc(Cl)cc3Cl)C2)cc1	ZINC000819257215	GH	On-Demand	Mild	ADRB3	21	44
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(c3ccc(Cl)cc3Cl)C2)cc1	ZINC000819257219	GH	On-Demand	Mild	ADRB3	21	44
N#Cc1ccc([C@H](O)CN[C@H]2CCN(c3ccc(Cl)cc3Cl)C2)cc1	ZINC000819257223	GH	On-Demand	Mild	ADRB3	21	44
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(c3ccc(Cl)cc3Cl)C2)cc1	ZINC000819257227	GH	On-Demand	Mild	ADRB3	21	44
CCCOc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819257244	EH	On-Demand	Bother	ADRB1	18	45
CCCOc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819257244	EH	On-Demand	Bother	CACNA1C	47	35
CCCOc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819257244	EH	On-Demand	Bother	ADRB3	25	45
CCCOc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819257244	EH	On-Demand	Bother	CACNA1D	74	35
CCCOc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819257250	EH	On-Demand	Bother	ADRB1	18	45
CCCOc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819257250	EH	On-Demand	Bother	CACNA1C	47	35
CCCOc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819257250	EH	On-Demand	Bother	ADRB3	25	45
CCCOc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819257250	EH	On-Demand	Bother	CACNA1D	74	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1nc(-c2ccccn2)cs1	ZINC000819257280	FG	On-Demand	Anodyne	NPY5R	17	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1nc(-c2ccccn2)cs1	ZINC000819257280	FG	On-Demand	Anodyne	KCNN1	27	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N(CCC#N)c1ccc(F)cc1	ZINC000819257282	EF	On-Demand	Mild	PAPA1_CARPA	27	42
O[C@H](CNCCOCC(F)F)c1ccc(Cl)c(F)c1	ZINC000819257285	CE	On-Demand	Anodyne	ADRB2	30	42
O[C@H](CNCCOCC(F)F)c1ccc(Cl)c(F)c1	ZINC000819257285	CE	On-Demand	Anodyne	ADRB1	26	42
O[C@H](CNCCOCC(F)F)c1ccc(Cl)c(F)c1	ZINC000819257285	CE	On-Demand	Anodyne	ADRB3	26	42
O[C@@H](CNCCOCC(F)F)c1ccc(Cl)c(F)c1	ZINC000819257286	CE	On-Demand	Anodyne	ADRB2	30	42
O[C@@H](CNCCOCC(F)F)c1ccc(Cl)c(F)c1	ZINC000819257286	CE	On-Demand	Anodyne	ADRB1	26	42
O[C@@H](CNCCOCC(F)F)c1ccc(Cl)c(F)c1	ZINC000819257286	CE	On-Demand	Anodyne	ADRB3	26	42
Cc1ccc(-c2csc(NC(=O)/C=C\[C@H]3CCCO3)n2)c(C)c1	ZINC000819257331	EI	On-Demand	Anodyne	UL26	60	30
Cc1ccc(-c2csc(NC(=O)/C=C\[C@H]3CCCO3)n2)c(C)c1	ZINC000819257331	EI	On-Demand	Anodyne	SCAF_EBVB9	60	30
O[C@@H](CNCCc1ccccc1OC(F)F)c1cccnc1	ZINC000819257333	DF	On-Demand	Anodyne	ADRB2	43	48
O[C@@H](CNCCc1ccccc1OC(F)F)c1cccnc1	ZINC000819257333	DF	On-Demand	Anodyne	ADRB1	50	46
O[C@@H](CNCCc1ccccc1OC(F)F)c1cccnc1	ZINC000819257333	DF	On-Demand	Anodyne	ADRB3	132	49
O[C@H](CNCCc1ccccc1OC(F)F)c1cccnc1	ZINC000819257334	DF	On-Demand	Anodyne	ADRB2	43	48
O[C@H](CNCCc1ccccc1OC(F)F)c1cccnc1	ZINC000819257334	DF	On-Demand	Anodyne	ADRB1	50	46
O[C@H](CNCCc1ccccc1OC(F)F)c1cccnc1	ZINC000819257334	DF	On-Demand	Anodyne	ADRB3	132	49
O[C@@H](CNCCc1ccccc1OC(F)F)c1ccc(Cl)c(F)c1	ZINC000819257335	FH	On-Demand	Anodyne	ADRB3	41	38
O[C@H](CNCCc1ccccc1OC(F)F)c1ccc(Cl)c(F)c1	ZINC000819257336	FH	On-Demand	Anodyne	ADRB3	41	38
CC(C)(C)OC(=O)N1CCC[C@@H](CCNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819257342	GF	On-Demand	Anodyne	SIRT3	41	35
CC(C)(C)OC(=O)N1CCC[C@@H](CCNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819257342	GF	On-Demand	Anodyne	SIRT2	46	35
CC(C)(C)OC(=O)N1CCC[C@@H](CCNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819257342	GF	On-Demand	Anodyne	SIRT1	41	35
CC(C)(C)OC(=O)N1CCC[C@@H](CCNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819257342	GF	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CCC[C@H](CCNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819257343	GF	On-Demand	Anodyne	SIRT3	41	35
CC(C)(C)OC(=O)N1CCC[C@H](CCNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819257343	GF	On-Demand	Anodyne	SIRT2	46	35
CC(C)(C)OC(=O)N1CCC[C@H](CCNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819257343	GF	On-Demand	Anodyne	SIRT1	41	35
CC(C)(C)OC(=O)N1CCC[C@H](CCNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819257343	GF	On-Demand	Anodyne	GPR119	36	42
NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)C(F)=C3CCC3)c2)C1	ZINC000819257366	FE	On-Demand	Anodyne	SLC6A1	98	32
CC(=O)Nc1ccc(OC[C@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819257367	DC	On-Demand	Anodyne	ADRB2	26	53
CC(=O)Nc1ccc(OC[C@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819257367	DC	On-Demand	Anodyne	ADRB1	62	53
CC(=O)Nc1ccc(OC[C@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819257367	DC	On-Demand	Anodyne	ADRB3	36	46
NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)C(F)=C3CCC3)c2)C1	ZINC000819257368	FE	On-Demand	Anodyne	SLC6A1	98	32
CC(=O)Nc1ccc(OC[C@@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819257369	DC	On-Demand	Anodyne	ADRB2	26	53
CC(=O)Nc1ccc(OC[C@@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819257369	DC	On-Demand	Anodyne	ADRB1	62	53
CC(=O)Nc1ccc(OC[C@@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819257369	DC	On-Demand	Anodyne	ADRB3	36	46
CC(=O)Nc1ccc(OC[C@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819257371	DC	On-Demand	Anodyne	ADRB2	26	53
CC(=O)Nc1ccc(OC[C@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819257371	DC	On-Demand	Anodyne	ADRB1	62	53
CC(=O)Nc1ccc(OC[C@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819257371	DC	On-Demand	Anodyne	ADRB3	36	46
CC(=O)Nc1ccc(OC[C@@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819257373	DC	On-Demand	Anodyne	ADRB2	26	53
CC(=O)Nc1ccc(OC[C@@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819257373	DC	On-Demand	Anodyne	ADRB1	62	53
CC(=O)Nc1ccc(OC[C@@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819257373	DC	On-Demand	Anodyne	ADRB3	36	46
C#CCOc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819257392	FG	On-Demand	Mild	PAPA1_CARPA	43	44
C#CCOc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819257392	FG	On-Demand	Mild	HDAC8	16	47
C#CCOc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819257395	FG	On-Demand	Mild	PAPA1_CARPA	43	44
C#CCOc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819257395	FG	On-Demand	Mild	HDAC8	16	47
COc1ccc(-c2csc(NC(=O)/C=C/[C@@H]3CCCO3)n2)cc1OC	ZINC000819257414	FH	On-Demand	Anodyne	STK17B	43	45
COc1ccc(-c2csc(NC(=O)/C=C/[C@@H]3CCCO3)n2)cc1OC	ZINC000819257414	FH	On-Demand	Anodyne	STK17A	16	45
COc1ccc(-c2csc(NC(=O)/C=C\[C@H]3CCCO3)n2)cc1OC	ZINC000819257415	FH	On-Demand	Anodyne	STK17B	43	45
COc1ccc(-c2csc(NC(=O)/C=C\[C@H]3CCCO3)n2)cc1OC	ZINC000819257415	FH	On-Demand	Anodyne	STK17A	16	45
COc1ccc(-c2csc(NC(=O)/C=C/[C@H]3CCCO3)n2)cc1OC	ZINC000819257417	FH	On-Demand	Anodyne	STK17B	43	45
COc1ccc(-c2csc(NC(=O)/C=C/[C@H]3CCCO3)n2)cc1OC	ZINC000819257417	FH	On-Demand	Anodyne	STK17A	16	45
COc1ccc(-c2csc(NC(=O)/C=C\[C@@H]3CCCO3)n2)cc1OC	ZINC000819257419	FH	On-Demand	Anodyne	STK17B	43	45
COc1ccc(-c2csc(NC(=O)/C=C\[C@@H]3CCCO3)n2)cc1OC	ZINC000819257419	FH	On-Demand	Anodyne	STK17A	16	45
O=C(OCc1ccccc1)[C@@H](CNC[C@H](O)C1CC1)c1ccccc1	ZINC000819257420	EF	On-Demand	Anodyne	CAPN2	50	34
O=C(OCc1ccccc1)[C@@H](CNC[C@@H](O)C1CC1)c1ccccc1	ZINC000819257424	EF	On-Demand	Anodyne	CAPN2	50	34
O=C(OCc1ccccc1)[C@H](CNC[C@@H](O)C1CC1)c1ccccc1	ZINC000819257426	EF	On-Demand	Anodyne	CAPN2	50	34
Cc1ccc(-c2csc(NC(=O)/C=C/[C@H]3CCCO3)n2)c(C)c1	ZINC000819257441	EI	On-Demand	Anodyne	UL26	60	30
Cc1ccc(-c2csc(NC(=O)/C=C/[C@H]3CCCO3)n2)c(C)c1	ZINC000819257441	EI	On-Demand	Anodyne	SCAF_EBVB9	60	30
Cc1ccc(-c2csc(NC(=O)/C=C/[C@@H]3CCCO3)n2)c(C)c1	ZINC000819257444	EI	On-Demand	Anodyne	UL26	60	30
Cc1ccc(-c2csc(NC(=O)/C=C/[C@@H]3CCCO3)n2)c(C)c1	ZINC000819257444	EI	On-Demand	Anodyne	SCAF_EBVB9	60	30
Cc1ccc(-c2csc(NC(=O)/C=C\[C@@H]3CCCO3)n2)c(C)c1	ZINC000819257448	EI	On-Demand	Anodyne	UL26	60	30
Cc1ccc(-c2csc(NC(=O)/C=C\[C@@H]3CCCO3)n2)c(C)c1	ZINC000819257448	EI	On-Demand	Anodyne	SCAF_EBVB9	60	30
CCN(C)C(=O)[C@H](C)NC[C@@H](O)c1cccnc1	ZINC000819257478	CC	On-Demand	Anodyne	ADRB1	25	51
CCN(C)C(=O)[C@H](C)NC[C@@H](O)c1cccnc1	ZINC000819257478	CC	On-Demand	Anodyne	ADRB3	81	51
CCN(C)C(=O)[C@H](C)NC[C@@H](O)c1cccnc1	ZINC000819257478	CC	On-Demand	Anodyne	KCNA5	24	41
CCN(C)C(=O)[C@H](C)NC[C@H](O)c1cccnc1	ZINC000819257484	CC	On-Demand	Anodyne	ADRB1	25	51
CCN(C)C(=O)[C@H](C)NC[C@H](O)c1cccnc1	ZINC000819257484	CC	On-Demand	Anodyne	ADRB3	81	51
CCN(C)C(=O)[C@H](C)NC[C@H](O)c1cccnc1	ZINC000819257484	CC	On-Demand	Anodyne	KCNA5	24	41
CCN(C)C(=O)[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819257485	CC	On-Demand	Anodyne	ADRB1	25	51
CCN(C)C(=O)[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819257485	CC	On-Demand	Anodyne	ADRB3	81	51
CCN(C)C(=O)[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819257485	CC	On-Demand	Anodyne	KCNA5	24	41
CN(Cc1ncc[nH]1)C(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819257486	GI	On-Demand	Anodyne	REN	54	38
CCN(C)C(=O)[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819257488	CC	On-Demand	Anodyne	ADRB1	25	51
CCN(C)C(=O)[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819257488	CC	On-Demand	Anodyne	ADRB3	81	51
CCN(C)C(=O)[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819257488	CC	On-Demand	Anodyne	KCNA5	24	41
CN(Cc1ncc[nH]1)C(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819257489	GI	On-Demand	Anodyne	REN	54	38
CS(=O)(=O)Nc1ccc(-c2csc(NC(=O)/C=C\[C@@H]3CCCO3)n2)cc1	ZINC000819257491	GF	On-Demand	Anodyne	ROCK1	15	41
CS(=O)(=O)Nc1ccc(-c2csc(NC(=O)/C=C\[C@@H]3CCCO3)n2)cc1	ZINC000819257491	GF	On-Demand	Anodyne	SPHK2	40	33
O[C@@H](CNOC[C@H]1CCOC1)COc1ccc(Br)cc1	ZINC000819257493	ED	On-Demand	Anodyne	ADRB1	25	42
CS(=O)(=O)Nc1ccc(-c2csc(NC(=O)/C=C/[C@H]3CCCO3)n2)cc1	ZINC000819257494	GF	On-Demand	Anodyne	ROCK1	15	41
CS(=O)(=O)Nc1ccc(-c2csc(NC(=O)/C=C/[C@H]3CCCO3)n2)cc1	ZINC000819257494	GF	On-Demand	Anodyne	SPHK2	40	33
O[C@H](CNOC[C@@H]1CCOC1)COc1ccc(Br)cc1	ZINC000819257495	ED	On-Demand	Anodyne	ADRB1	25	42
CS(=O)(=O)Nc1ccc(-c2csc(NC(=O)/C=C\[C@H]3CCCO3)n2)cc1	ZINC000819257496	GF	On-Demand	Anodyne	ROCK1	15	41
CS(=O)(=O)Nc1ccc(-c2csc(NC(=O)/C=C\[C@H]3CCCO3)n2)cc1	ZINC000819257496	GF	On-Demand	Anodyne	SPHK2	40	33
O[C@H](CNOC[C@H]1CCOC1)COc1ccc(Br)cc1	ZINC000819257497	ED	On-Demand	Anodyne	ADRB1	25	42
CS(=O)(=O)Nc1ccc(-c2csc(NC(=O)/C=C/[C@@H]3CCCO3)n2)cc1	ZINC000819257498	GF	On-Demand	Anodyne	ROCK1	15	41
CS(=O)(=O)Nc1ccc(-c2csc(NC(=O)/C=C/[C@@H]3CCCO3)n2)cc1	ZINC000819257498	GF	On-Demand	Anodyne	SPHK2	40	33
O[C@@H](CNOC[C@@H]1CCOC1)COc1ccc(Br)cc1	ZINC000819257499	ED	On-Demand	Anodyne	ADRB1	25	42
Cc1cc(F)ccc1[C@@H](O)CNCCc1cc(C)c(O)c(C)c1	ZINC000819257529	DG	On-Demand	Anodyne	ADRB2	56	41
Cc1cc(F)ccc1[C@@H](O)CNCCc1cc(C)c(O)c(C)c1	ZINC000819257529	DG	On-Demand	Anodyne	ADRB1	38	45
CCOC(=O)c1csc(CCNC[C@@H](O)c2cccnc2)n1	ZINC000819257539	DD	On-Demand	Anodyne	ADRB2	34	51
CCOC(=O)c1csc(CCNC[C@@H](O)c2cccnc2)n1	ZINC000819257539	DD	On-Demand	Anodyne	ADRB1	48	51
CCOC(=O)c1csc(CCNC[C@@H](O)c2cccnc2)n1	ZINC000819257539	DD	On-Demand	Anodyne	ADRB3	142	57
CCOC(=O)c1csc(CCNC[C@H](O)c2cccnc2)n1	ZINC000819257541	DD	On-Demand	Anodyne	ADRB2	34	51
CCOC(=O)c1csc(CCNC[C@H](O)c2cccnc2)n1	ZINC000819257541	DD	On-Demand	Anodyne	ADRB1	48	51
CCOC(=O)c1csc(CCNC[C@H](O)c2cccnc2)n1	ZINC000819257541	DD	On-Demand	Anodyne	ADRB3	142	57
CCOC(=O)c1csc(CCNC[C@H](O)c2ccc(F)cc2)n1	ZINC000819257556	EE	On-Demand	Anodyne	ADRB3	40	41
CCOC(=O)c1csc(CCNC[C@@H](O)c2ccc(F)cc2)n1	ZINC000819257558	EE	On-Demand	Anodyne	ADRB3	40	41
CCN(C)C(=O)[C@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819257561	CD	On-Demand	Bother	CACNA1D	54	34
CCN(C)C(=O)[C@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819257564	CD	On-Demand	Bother	CACNA1D	54	34
CCN(C)C(=O)[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819257566	CD	On-Demand	Bother	CACNA1D	54	34
CCN(C)C(=O)[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819257567	CD	On-Demand	Bother	CACNA1D	54	34
NC(=O)CCNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819257574	ED	On-Demand	Anodyne	CAPNS1	46	30
NC(=O)CCNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819257574	ED	On-Demand	Anodyne	CAPN1	48	39
NC(=O)CCNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819257574	ED	On-Demand	Anodyne	CAPN2	66	36
NC(=O)CCNC[C@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819257574	ED	On-Demand	Anodyne	NPR	45	32
NC(=O)CCNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819257576	ED	On-Demand	Anodyne	CAPNS1	46	30
NC(=O)CCNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819257576	ED	On-Demand	Anodyne	CAPN1	48	39
NC(=O)CCNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819257576	ED	On-Demand	Anodyne	CAPN2	66	36
NC(=O)CCNC[C@@H](C(=O)OCc1ccccc1)c1ccccc1	ZINC000819257576	ED	On-Demand	Anodyne	NPR	45	32
CCOC(=O)c1csc(CCNC[C@H](O)c2ccc(C)cc2)n1	ZINC000819257583	EE	On-Demand	Anodyne	ADRB3	51	39
CCOC(=O)c1csc(CCNC[C@@H](O)c2ccc(C)cc2)n1	ZINC000819257584	EE	On-Demand	Anodyne	ADRB3	51	39
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ncnn1C	ZINC000819257587	FD	On-Demand	Anodyne	GPR119	57	43
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ncnn1C	ZINC000819257589	FD	On-Demand	Anodyne	GPR119	57	43
CC(C)(C#N)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819257605	FI	On-Demand	Mild	CTSK	17	51
CC(C)(C#N)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819257605	FI	On-Demand	Mild	ECE1	22	41
CC(C)(C#N)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819257605	FI	On-Demand	Mild	REN	43	42
CC(C)(C#N)NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819257605	FI	On-Demand	Mild	CTSH	37	41
CC(C)(C#N)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819257606	FI	On-Demand	Mild	CTSK	17	51
CC(C)(C#N)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819257606	FI	On-Demand	Mild	ECE1	22	41
CC(C)(C#N)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819257606	FI	On-Demand	Mild	REN	43	42
CC(C)(C#N)NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819257606	FI	On-Demand	Mild	CTSH	37	41
Cc1ccc(OC[C@@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819257661	CD	On-Demand	Anodyne	ADRB2	21	48
Cc1ccc(OC[C@@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819257661	CD	On-Demand	Anodyne	ADRB1	30	44
Cc1ccc(OC[C@@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819257662	CD	On-Demand	Anodyne	ADRB2	21	48
Cc1ccc(OC[C@@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819257662	CD	On-Demand	Anodyne	ADRB1	30	44
Cc1ccc(OC[C@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819257663	CD	On-Demand	Anodyne	ADRB2	21	48
Cc1ccc(OC[C@H](O)CNOC[C@H]2CCOC2)cc1	ZINC000819257663	CD	On-Demand	Anodyne	ADRB1	30	44
O=C(O)[C@@H]1CCN(C(=O)NCCCOc2ccccc2F)C1	ZINC000819257664	DD	On-Demand	Anodyne	HTR1A	18	45
O=C(O)[C@@H]1CCN(C(=O)NCCCOc2ccccc2F)C1	ZINC000819257664	DD	On-Demand	Anodyne	DRD2	19	44
O=C(O)[C@@H]1CCN(C(=O)NCCCOc2ccccc2F)C1	ZINC000819257664	DD	On-Demand	Anodyne	SLC6A1	121	38
Cc1ccc(OC[C@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819257665	CD	On-Demand	Anodyne	ADRB2	21	48
Cc1ccc(OC[C@H](O)CNOC[C@@H]2CCOC2)cc1	ZINC000819257665	CD	On-Demand	Anodyne	ADRB1	30	44
O=C(O)[C@H]1CCN(C(=O)NCCCOc2ccccc2F)C1	ZINC000819257666	DD	On-Demand	Anodyne	HTR1A	18	45
O=C(O)[C@H]1CCN(C(=O)NCCCOc2ccccc2F)C1	ZINC000819257666	DD	On-Demand	Anodyne	DRD2	19	44
O=C(O)[C@H]1CCN(C(=O)NCCCOc2ccccc2F)C1	ZINC000819257666	DD	On-Demand	Anodyne	SLC6A1	121	38
O=C(O)[C@@H]1CCN(C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000819257676	ED	On-Demand	Anodyne	HCN1	55	35
O=C(O)[C@@H]1CCN(C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000819257676	ED	On-Demand	Anodyne	HCN4	53	35
O=C(O)[C@H]1CCN(C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000819257681	ED	On-Demand	Anodyne	HCN1	55	35
O=C(O)[C@H]1CCN(C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000819257681	ED	On-Demand	Anodyne	HCN4	53	35
Cc1ccc(-c2csc(NC(=O)/C=C\[C@@H]3CCCO3)n2)cc1	ZINC000819257684	DH	On-Demand	Anodyne	MAOB	16	43
Cc1ccc(-c2csc(NC(=O)/C=C/[C@H]3CCCO3)n2)cc1	ZINC000819257685	DH	On-Demand	Anodyne	MAOB	16	43
Cc1ccc(-c2csc(NC(=O)/C=C\[C@H]3CCCO3)n2)cc1	ZINC000819257687	DH	On-Demand	Anodyne	MAOB	16	43
Cc1ccc(-c2csc(NC(=O)/C=C/[C@@H]3CCCO3)n2)cc1	ZINC000819257689	DH	On-Demand	Anodyne	MAOB	16	43
O=C(O)[C@H]1CCN(C(=O)NCCc2ccc(Cl)nc2)C1	ZINC000819257696	CD	On-Demand	Anodyne	GPBAR1	23	42
O=C(O)[C@@H]1CCN(C(=O)NCCc2ccc(Cl)nc2)C1	ZINC000819257698	CD	On-Demand	Anodyne	GPBAR1	23	42
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCCCC2)C1	ZINC000819257709	CC	On-Demand	Anodyne	SLC6A1	141	42
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCCCC2)C1	ZINC000819257709	CC	On-Demand	Anodyne	DRD3	17	41
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCCCC2)C1	ZINC000819257709	CC	On-Demand	Anodyne	HRH3	19	43
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCCCC2)C1	ZINC000819257709	CC	On-Demand	Anodyne	L3MBTL3	15	47
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCCCC2)C1	ZINC000819257710	CC	On-Demand	Anodyne	SLC6A1	141	42
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCCCC2)C1	ZINC000819257710	CC	On-Demand	Anodyne	DRD3	17	41
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCCCC2)C1	ZINC000819257710	CC	On-Demand	Anodyne	HRH3	19	43
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCCCC2)C1	ZINC000819257710	CC	On-Demand	Anodyne	L3MBTL3	15	47
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000819257720	DC	On-Demand	Anodyne	NOS2	107	41
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000819257720	DC	On-Demand	Anodyne	NAMPT	50	53
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000819257722	DC	On-Demand	Anodyne	NOS2	107	41
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000819257722	DC	On-Demand	Anodyne	NAMPT	50	53
O=C(O)[C@@H]1CCN(C(=O)NC[C@H](c2cccs2)N2CCCC2)C1	ZINC000819257732	EE	On-Demand	Anodyne	SLC6A1	56	36
O=C(O)[C@@H]1CCN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)C1	ZINC000819257734	EE	On-Demand	Anodyne	SLC6A1	56	36
O=C(O)[C@H]1CCN(C(=O)NC[C@H](c2cccs2)N2CCCC2)C1	ZINC000819257737	EE	On-Demand	Anodyne	SLC6A1	56	36
O=C(O)[C@H]1CCN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)C1	ZINC000819257739	EE	On-Demand	Anodyne	SLC6A1	56	36
O=C(O)[C@H]1CCN(C(=O)NCCc2ccc(N3CCCCC3)cc2)C1	ZINC000819257748	EE	On-Demand	Anodyne	SLC6A1	41	32
O=C(O)[C@H]1CCN(C(=O)NCCc2ccc(N3CCCCC3)cc2)C1	ZINC000819257748	EE	On-Demand	Anodyne	CTSL	15	42
O=C(O)[C@H]1CCN(C(=O)NCCc2ccc(N3CCCCC3)cc2)C1	ZINC000819257748	EE	On-Demand	Anodyne	DPP7	43	39
O=C(O)[C@H]1CCN(C(=O)NCCc2ccc(N3CCCCC3)cc2)C1	ZINC000819257748	EE	On-Demand	Anodyne	GPBAR1	25	43
O=C(O)[C@H]1CCN(C(=O)NCCc2ccc(N3CCCCC3)cc2)C1	ZINC000819257748	EE	On-Demand	Anodyne	L3MBTL3	53	42
O=C(O)[C@@H]1CCN(C(=O)NCCc2ccc(N3CCCCC3)cc2)C1	ZINC000819257749	EE	On-Demand	Anodyne	SLC6A1	41	32
O=C(O)[C@@H]1CCN(C(=O)NCCc2ccc(N3CCCCC3)cc2)C1	ZINC000819257749	EE	On-Demand	Anodyne	CTSL	15	42
O=C(O)[C@@H]1CCN(C(=O)NCCc2ccc(N3CCCCC3)cc2)C1	ZINC000819257749	EE	On-Demand	Anodyne	DPP7	43	39
O=C(O)[C@@H]1CCN(C(=O)NCCc2ccc(N3CCCCC3)cc2)C1	ZINC000819257749	EE	On-Demand	Anodyne	GPBAR1	25	43
O=C(O)[C@@H]1CCN(C(=O)NCCc2ccc(N3CCCCC3)cc2)C1	ZINC000819257749	EE	On-Demand	Anodyne	L3MBTL3	53	42
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257752	FD	On-Demand	Anodyne	HTR1A	123	63
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257752	FD	On-Demand	Anodyne	DRD2	99	57
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257752	FD	On-Demand	Anodyne	DRD1	21	42
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257752	FD	On-Demand	Anodyne	DRD4	65	47
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257752	FD	On-Demand	Anodyne	ADRA1D	50	51
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257752	FD	On-Demand	Anodyne	HTR2A	89	57
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257752	FD	On-Demand	Anodyne	HTR2C	47	52
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257752	FD	On-Demand	Anodyne	SLC6A1	126	41
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257752	FD	On-Demand	Anodyne	SLC6A4	23	44
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257752	FD	On-Demand	Anodyne	ADRA1A	74	51
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257752	FD	On-Demand	Anodyne	ADRA1B	50	51
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257752	FD	On-Demand	Anodyne	DRD3	126	57
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257752	FD	On-Demand	Anodyne	HTR4	24	44
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257752	FD	On-Demand	Anodyne	DRD5	21	45
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257752	FD	On-Demand	Anodyne	HTR7	129	46
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257752	FD	On-Demand	Anodyne	HRH3	15	45
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257752	FD	On-Demand	Anodyne	SIGMAR1	31	47
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257752	FD	On-Demand	Anodyne	CCR3	19	44
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257752	FD	On-Demand	Anodyne	HNMT	40	35
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257756	FD	On-Demand	Anodyne	HTR1A	123	63
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257756	FD	On-Demand	Anodyne	DRD2	99	57
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257756	FD	On-Demand	Anodyne	DRD1	21	42
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257756	FD	On-Demand	Anodyne	DRD4	65	47
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257756	FD	On-Demand	Anodyne	ADRA1D	50	51
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257756	FD	On-Demand	Anodyne	HTR2A	89	57
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257756	FD	On-Demand	Anodyne	HTR2C	47	52
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257756	FD	On-Demand	Anodyne	SLC6A1	126	41
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257756	FD	On-Demand	Anodyne	SLC6A4	23	44
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257756	FD	On-Demand	Anodyne	ADRA1A	74	51
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257756	FD	On-Demand	Anodyne	ADRA1B	50	51
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257756	FD	On-Demand	Anodyne	DRD3	126	57
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257756	FD	On-Demand	Anodyne	HTR4	24	44
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257756	FD	On-Demand	Anodyne	DRD5	21	45
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257756	FD	On-Demand	Anodyne	HTR7	129	46
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257756	FD	On-Demand	Anodyne	HRH3	15	45
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257756	FD	On-Demand	Anodyne	SIGMAR1	31	47
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257756	FD	On-Demand	Anodyne	CCR3	19	44
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257756	FD	On-Demand	Anodyne	HNMT	40	35
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCOCC(F)F)CC1	ZINC000819257768	FD	On-Demand	Anodyne	GPR119	28	42
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	HTR1A	74	47
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	DRD2	87	49
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	DRD4	84	45
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	ACHE	51	45
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	HRH2	33	40
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	HTR2A	62	48
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	HTR2C	37	43
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	SLC6A1	128	40
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	SLC6A4	24	41
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	ADRA1A	57	39
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	HRH1	15	50
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	ADRA1B	41	38
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	DRD3	103	52
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	HTR4	28	43
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	LTA4H	19	41
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	HTR7	59	46
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	HRH3	36	49
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	SIGMAR1	87	50
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	BCHE	22	45
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	CCR3	38	48
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	CCR5	32	42
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	FAAH	17	42
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	S1PR1	18	43
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	EPHX2	15	40
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	S1PR5	22	43
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	CACNA1G	58	41
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257771	GD	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	HTR1A	74	47
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	DRD2	87	49
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	DRD4	84	45
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	ACHE	51	45
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	HRH2	33	40
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	HTR2A	62	48
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	HTR2C	37	43
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	SLC6A1	128	40
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	SLC6A4	24	41
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	ADRA1A	57	39
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	HRH1	15	50
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	ADRA1B	41	38
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	DRD3	103	52
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	HTR4	28	43
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	LTA4H	19	41
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	HTR7	59	46
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	HRH3	36	49
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	SIGMAR1	87	50
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	BCHE	22	45
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	CCR3	38	48
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	CCR5	32	42
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	FAAH	17	42
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	S1PR1	18	43
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	EPHX2	15	40
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	S1PR5	22	43
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	CACNA1G	58	41
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819257774	GD	On-Demand	Anodyne	CYP2J2	44	31
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCOCC(F)F)CC1	ZINC000819257775	FD	On-Demand	Anodyne	GPR119	28	42
O[C@H](CNCCOCC(F)F)c1ccc(Cl)cc1Cl	ZINC000819257777	DF	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNCCOCC(F)F)c1ccc(Cl)cc1Cl	ZINC000819257777	DF	On-Demand	Anodyne	ADRB1	30	41
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(F)cn2)C1	ZINC000819257778	CC	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(F)cn2)C1	ZINC000819257778	CC	On-Demand	Anodyne	EPHX2	18	46
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(F)cn2)C1	ZINC000819257779	CC	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(F)cn2)C1	ZINC000819257779	CC	On-Demand	Anodyne	EPHX2	18	46
CO[C@@H](CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000819257780	EG	On-Demand	Anodyne	ADRB2	17	41
CO[C@@H](CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000819257780	EG	On-Demand	Anodyne	ADRB3	41	38
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257781	FD	On-Demand	Anodyne	HTR1A	120	59
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257781	FD	On-Demand	Anodyne	DRD2	96	60
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257781	FD	On-Demand	Anodyne	DRD1	20	40
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257781	FD	On-Demand	Anodyne	DRD4	64	49
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257781	FD	On-Demand	Anodyne	ADRA1D	60	54
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257781	FD	On-Demand	Anodyne	HTR2A	90	54
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257781	FD	On-Demand	Anodyne	HTR2C	50	49
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257781	FD	On-Demand	Anodyne	SLC6A1	125	41
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257781	FD	On-Demand	Anodyne	SLC6A4	23	44
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257781	FD	On-Demand	Anodyne	ADRA1A	86	54
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257781	FD	On-Demand	Anodyne	ADRA1B	60	54
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257781	FD	On-Demand	Anodyne	DRD3	119	60
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257781	FD	On-Demand	Anodyne	HTR4	22	46
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257781	FD	On-Demand	Anodyne	DRD5	21	45
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257781	FD	On-Demand	Anodyne	HTR7	132	48
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257781	FD	On-Demand	Anodyne	HRH3	15	45
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257781	FD	On-Demand	Anodyne	SIGMAR1	31	47
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257781	FD	On-Demand	Anodyne	CCR3	26	42
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257783	FD	On-Demand	Anodyne	HTR1A	120	59
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257783	FD	On-Demand	Anodyne	DRD2	96	60
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257783	FD	On-Demand	Anodyne	DRD1	20	40
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257783	FD	On-Demand	Anodyne	DRD4	64	49
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257783	FD	On-Demand	Anodyne	ADRA1D	60	54
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257783	FD	On-Demand	Anodyne	HTR2A	90	54
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257783	FD	On-Demand	Anodyne	HTR2C	50	49
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257783	FD	On-Demand	Anodyne	SLC6A1	125	41
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257783	FD	On-Demand	Anodyne	SLC6A4	23	44
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257783	FD	On-Demand	Anodyne	ADRA1A	86	54
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257783	FD	On-Demand	Anodyne	ADRA1B	60	54
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257783	FD	On-Demand	Anodyne	DRD3	119	60
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257783	FD	On-Demand	Anodyne	HTR4	22	46
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257783	FD	On-Demand	Anodyne	DRD5	21	45
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257783	FD	On-Demand	Anodyne	HTR7	132	48
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257783	FD	On-Demand	Anodyne	HRH3	15	45
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257783	FD	On-Demand	Anodyne	SIGMAR1	31	47
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819257783	FD	On-Demand	Anodyne	CCR3	26	42
CO[C@@H](CCNC[C@H](O)c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000819257784	EG	On-Demand	Anodyne	ADRB2	17	41
CO[C@@H](CCNC[C@H](O)c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000819257784	EG	On-Demand	Anodyne	ADRB3	41	38
O[C@@H](CNCCOCC(F)F)c1ccc(Cl)cc1Cl	ZINC000819257785	DF	On-Demand	Anodyne	ADRB2	20	41
O[C@@H](CNCCOCC(F)F)c1ccc(Cl)cc1Cl	ZINC000819257785	DF	On-Demand	Anodyne	ADRB1	30	41
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819257787	FC	On-Demand	Anodyne	MTOR	16	40
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819257787	FC	On-Demand	Anodyne	EPHX2	18	44
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819257787	FC	On-Demand	Anodyne	L3MBTL3	84	41
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819257791	FC	On-Demand	Anodyne	MTOR	16	40
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819257791	FC	On-Demand	Anodyne	EPHX2	18	44
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819257791	FC	On-Demand	Anodyne	L3MBTL3	84	41
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257798	EE	On-Demand	Anodyne	HRH2	23	41
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257798	EE	On-Demand	Anodyne	SLC6A1	141	37
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257798	EE	On-Demand	Anodyne	HRH3	43	51
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257798	EE	On-Demand	Anodyne	SIGMAR1	35	55
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257798	EE	On-Demand	Anodyne	BDKRB1	33	40
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257798	EE	On-Demand	Anodyne	S1PR4	17	40
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257798	EE	On-Demand	Anodyne	S1PR1	18	47
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257798	EE	On-Demand	Anodyne	EPHX2	21	49
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257798	EE	On-Demand	Anodyne	S1PR5	39	40
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257798	EE	On-Demand	Anodyne	DPP7	62	36
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257798	EE	On-Demand	Anodyne	MCHR1	17	40
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257798	EE	On-Demand	Anodyne	CACNA1G	38	40
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257798	EE	On-Demand	Anodyne	L3MBTL3	41	44
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257798	EE	On-Demand	Anodyne	NAMPT	34	41
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257801	EE	On-Demand	Anodyne	HRH2	23	41
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257801	EE	On-Demand	Anodyne	SLC6A1	141	37
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257801	EE	On-Demand	Anodyne	HRH3	43	51
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257801	EE	On-Demand	Anodyne	SIGMAR1	35	55
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257801	EE	On-Demand	Anodyne	BDKRB1	33	40
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257801	EE	On-Demand	Anodyne	S1PR4	17	40
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257801	EE	On-Demand	Anodyne	S1PR1	18	47
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257801	EE	On-Demand	Anodyne	EPHX2	21	49
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257801	EE	On-Demand	Anodyne	S1PR5	39	40
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257801	EE	On-Demand	Anodyne	DPP7	62	36
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257801	EE	On-Demand	Anodyne	MCHR1	17	40
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257801	EE	On-Demand	Anodyne	CACNA1G	38	40
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257801	EE	On-Demand	Anodyne	L3MBTL3	41	44
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819257801	EE	On-Demand	Anodyne	NAMPT	34	41
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819257803	ED	On-Demand	Anodyne	SLC6A1	51	34
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819257803	ED	On-Demand	Anodyne	PREP	20	42
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819257803	ED	On-Demand	Anodyne	EPHX2	25	46
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819257803	ED	On-Demand	Anodyne	DPP7	64	36
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819257803	ED	On-Demand	Anodyne	PROC	44	33
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819257803	ED	On-Demand	Anodyne	L3MBTL3	104	48
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819257803	ED	On-Demand	Anodyne	NAMPT	39	44
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819257803	ED	On-Demand	Anodyne	TMPRSS11D	43	32
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819257807	ED	On-Demand	Anodyne	SLC6A1	51	34
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819257807	ED	On-Demand	Anodyne	PREP	20	42
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819257807	ED	On-Demand	Anodyne	EPHX2	25	46
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819257807	ED	On-Demand	Anodyne	DPP7	64	36
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819257807	ED	On-Demand	Anodyne	PROC	44	33
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819257807	ED	On-Demand	Anodyne	L3MBTL3	104	48
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819257807	ED	On-Demand	Anodyne	NAMPT	39	44
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819257807	ED	On-Demand	Anodyne	TMPRSS11D	43	32
CCOC(=O)c1csc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)n1	ZINC000819257809	GG	On-Demand	Anodyne	ADRB3	61	39
O=C(O)[C@H]1CCN(C(=O)NCC2CCN(Cc3cccs3)CC2)C1	ZINC000819257810	FE	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)[C@H]1CCN(C(=O)NCC2CCN(Cc3cccs3)CC2)C1	ZINC000819257810	FE	On-Demand	Anodyne	CACNA1I	52	34
CCOC(=O)c1csc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)n1	ZINC000819257811	GG	On-Demand	Anodyne	ADRB3	61	39
O=C(O)[C@@H]1CCN(C(=O)NCC2CCN(Cc3cccs3)CC2)C1	ZINC000819257812	FE	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)[C@@H]1CCN(C(=O)NCC2CCN(Cc3cccs3)CC2)C1	ZINC000819257812	FE	On-Demand	Anodyne	CACNA1I	52	34
O=C(O)C1CCN(C(=O)NCc2ccc(F)cn2)CC1	ZINC000819257814	CD	On-Demand	Anodyne	EPHX2	21	51
O=C1[C@H](NC[C@H](O)c2cccnc2)CCCN1Cc1ccc(F)cc1F	ZINC000819257825	FE	On-Demand	Anodyne	ADRB3	62	40
O=C(O)[C@@H]1CCN(C(=O)NCCC2CCN(CC(F)(F)F)CC2)C1	ZINC000819257826	FD	On-Demand	Anodyne	HPGDS	32	40
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCCN1Cc1ccc(F)cc1F	ZINC000819257827	FE	On-Demand	Anodyne	ADRB3	62	40
O=C(O)[C@H]1CCN(C(=O)NCCC2CCN(CC(F)(F)F)CC2)C1	ZINC000819257828	FD	On-Demand	Anodyne	HPGDS	32	40
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCCN1Cc1ccc(F)cc1F	ZINC000819257829	FE	On-Demand	Anodyne	ADRB3	62	40
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCCN1Cc1ccc(F)cc1F	ZINC000819257831	FE	On-Demand	Anodyne	ADRB3	62	40
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819257834	ED	On-Demand	Anodyne	HRH3	24	46
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819257834	ED	On-Demand	Anodyne	SIGMAR1	25	51
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819257834	ED	On-Demand	Anodyne	S1PR1	15	44
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819257834	ED	On-Demand	Anodyne	EPHX2	18	46
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819257834	ED	On-Demand	Anodyne	DPP7	45	37
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819257834	ED	On-Demand	Anodyne	DPOL_VZVD	24	43
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819257836	ED	On-Demand	Anodyne	HRH3	24	46
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819257836	ED	On-Demand	Anodyne	SIGMAR1	25	51
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819257836	ED	On-Demand	Anodyne	S1PR1	15	44
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819257836	ED	On-Demand	Anodyne	EPHX2	18	46
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819257836	ED	On-Demand	Anodyne	DPP7	45	37
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819257836	ED	On-Demand	Anodyne	DPOL_VZVD	24	43
O=C(O)[C@H]1CCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819257838	DD	On-Demand	Anodyne	HTR1A	17	44
O=C(O)[C@H]1CCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819257838	DD	On-Demand	Anodyne	SLC6A1	153	41
O=C(O)[C@H]1CCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819257838	DD	On-Demand	Anodyne	DRD3	17	47
O=C(O)[C@H]1CCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819257838	DD	On-Demand	Anodyne	HTR7	25	47
O=C(O)[C@H]1CCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819257838	DD	On-Demand	Anodyne	PLD2	27	40
O=C(O)[C@H]1CCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819257838	DD	On-Demand	Anodyne	NOD2	40	33
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819257840	DD	On-Demand	Anodyne	HTR1A	17	44
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819257840	DD	On-Demand	Anodyne	SLC6A1	153	41
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819257840	DD	On-Demand	Anodyne	DRD3	17	47
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819257840	DD	On-Demand	Anodyne	HTR7	25	47
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819257840	DD	On-Demand	Anodyne	PLD2	27	40
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819257840	DD	On-Demand	Anodyne	NOD2	40	33
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCC3=O)cc2)C1	ZINC000819257844	ED	On-Demand	Anodyne	DPP7	44	35
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCC3=O)cc2)C1	ZINC000819257845	ED	On-Demand	Anodyne	DPP7	44	35
O=C(O)[C@@H]1CCN(C(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)C1	ZINC000819257852	FC	On-Demand	Anodyne	SLC6A1	86	34
O=C(O)[C@H]1CCN(C(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)C1	ZINC000819257854	FC	On-Demand	Anodyne	SLC6A1	86	34
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257856	ED	On-Demand	Anodyne	HRH2	23	41
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257856	ED	On-Demand	Anodyne	SLC6A1	141	37
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257856	ED	On-Demand	Anodyne	HRH3	43	51
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257856	ED	On-Demand	Anodyne	SIGMAR1	35	55
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257856	ED	On-Demand	Anodyne	BDKRB1	33	40
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257856	ED	On-Demand	Anodyne	S1PR4	17	40
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257856	ED	On-Demand	Anodyne	S1PR1	18	47
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257856	ED	On-Demand	Anodyne	EPHX2	21	49
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257856	ED	On-Demand	Anodyne	S1PR5	39	40
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257856	ED	On-Demand	Anodyne	DPP7	62	36
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257856	ED	On-Demand	Anodyne	MCHR1	17	40
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257856	ED	On-Demand	Anodyne	CACNA1G	38	40
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257856	ED	On-Demand	Anodyne	L3MBTL3	41	44
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257856	ED	On-Demand	Anodyne	NAMPT	34	41
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257857	ED	On-Demand	Anodyne	HRH2	23	41
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257857	ED	On-Demand	Anodyne	SLC6A1	141	37
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257857	ED	On-Demand	Anodyne	HRH3	43	51
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257857	ED	On-Demand	Anodyne	SIGMAR1	35	55
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257857	ED	On-Demand	Anodyne	BDKRB1	33	40
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257857	ED	On-Demand	Anodyne	S1PR4	17	40
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257857	ED	On-Demand	Anodyne	S1PR1	18	47
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257857	ED	On-Demand	Anodyne	EPHX2	21	49
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257857	ED	On-Demand	Anodyne	S1PR5	39	40
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257857	ED	On-Demand	Anodyne	DPP7	62	36
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257857	ED	On-Demand	Anodyne	MCHR1	17	40
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257857	ED	On-Demand	Anodyne	CACNA1G	38	40
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257857	ED	On-Demand	Anodyne	L3MBTL3	41	44
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819257857	ED	On-Demand	Anodyne	NAMPT	34	41
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000819257859	DD	On-Demand	Anodyne	NOS2	104	41
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000819257859	DD	On-Demand	Anodyne	NAMPT	45	41
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000819257861	DD	On-Demand	Anodyne	NOS2	104	41
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000819257861	DD	On-Demand	Anodyne	NAMPT	45	41
O=C(O)[C@H]1CCN(C(=O)NCCN2CCCc3ccccc32)C1	ZINC000819257863	DD	On-Demand	Anodyne	SLC6A1	121	36
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCCc3ccccc32)C1	ZINC000819257865	DD	On-Demand	Anodyne	SLC6A1	121	36
O=C(O)C1CCN(C(=O)NCc2cc(O)nc3ccccc23)CC1	ZINC000819257873	ED	On-Demand	Anodyne	EPHX2	37	56
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CO)c(F)c2)C1	ZINC000819257882	CC	On-Demand	Anodyne	SLC6A1	45	33
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(CO)c(F)c2)C1	ZINC000819257882	CC	On-Demand	Anodyne	EPHX2	20	54
CCC1(CC)CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819258009	CG	On-Demand	Anodyne	ADRB3	68	48
CCC1(CC)CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819258010	CG	On-Demand	Anodyne	ADRB3	68	48
O[C@@H](CNOC[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819258044	CD	On-Demand	Anodyne	ADRB3	40	39
O[C@@H](CNOC[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819258044	CD	On-Demand	Anodyne	CYP3A4	50	37
O[C@H](CNOC[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819258045	CD	On-Demand	Anodyne	ADRB3	40	39
O[C@H](CNOC[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819258045	CD	On-Demand	Anodyne	CYP3A4	50	37
O[C@@H](CNOC[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819258046	CD	On-Demand	Anodyne	ADRB3	40	39
O[C@@H](CNOC[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819258046	CD	On-Demand	Anodyne	CYP3A4	50	37
O[C@H](CNOC[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819258047	CD	On-Demand	Anodyne	ADRB3	40	39
O[C@H](CNOC[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819258047	CD	On-Demand	Anodyne	CYP3A4	50	37
O[C@@H](CNCCc1ccccc1OC(F)F)c1cccc(F)c1	ZINC000819258069	EG	On-Demand	Anodyne	ADRB2	37	40
O[C@@H](CNCCc1ccccc1OC(F)F)c1cccc(F)c1	ZINC000819258069	EG	On-Demand	Anodyne	ADRB1	41	48
O[C@@H](CNCCc1ccccc1OC(F)F)c1cccc(F)c1	ZINC000819258069	EG	On-Demand	Anodyne	ADRB3	59	48
O[C@H](CNCCc1ccccc1OC(F)F)c1cccc(F)c1	ZINC000819258070	EG	On-Demand	Anodyne	ADRB2	37	40
O[C@H](CNCCc1ccccc1OC(F)F)c1cccc(F)c1	ZINC000819258070	EG	On-Demand	Anodyne	ADRB1	41	48
O[C@H](CNCCc1ccccc1OC(F)F)c1cccc(F)c1	ZINC000819258070	EG	On-Demand	Anodyne	ADRB3	59	48
O[C@@H](CNCCc1ccccc1OC(F)F)c1cccc(Cl)c1	ZINC000819258071	EH	On-Demand	Anodyne	ADRB2	63	40
O[C@@H](CNCCc1ccccc1OC(F)F)c1cccc(Cl)c1	ZINC000819258071	EH	On-Demand	Anodyne	ADRB1	69	52
O[C@@H](CNCCc1ccccc1OC(F)F)c1cccc(Cl)c1	ZINC000819258071	EH	On-Demand	Anodyne	ADRB3	84	57
O[C@H](CNCCc1ccccc1OC(F)F)c1cccc(Cl)c1	ZINC000819258072	EH	On-Demand	Anodyne	ADRB2	63	40
O[C@H](CNCCc1ccccc1OC(F)F)c1cccc(Cl)c1	ZINC000819258072	EH	On-Demand	Anodyne	ADRB1	69	52
O[C@H](CNCCc1ccccc1OC(F)F)c1cccc(Cl)c1	ZINC000819258072	EH	On-Demand	Anodyne	ADRB3	84	57
O[C@@H](CNOC[C@H]1CCOC1)COc1ccc(F)cc1	ZINC000819258104	CD	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CNOC[C@H]1CCOC1)COc1ccc(F)cc1	ZINC000819258104	CD	On-Demand	Anodyne	ADRB1	29	42
O[C@H](CNOC[C@@H]1CCOC1)COc1ccc(F)cc1	ZINC000819258105	CD	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CNOC[C@@H]1CCOC1)COc1ccc(F)cc1	ZINC000819258105	CD	On-Demand	Anodyne	ADRB1	29	42
O[C@H](CNOC[C@H]1CCOC1)COc1ccc(F)cc1	ZINC000819258106	CD	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CNOC[C@H]1CCOC1)COc1ccc(F)cc1	ZINC000819258106	CD	On-Demand	Anodyne	ADRB1	29	42
O[C@@H](CNOC[C@@H]1CCOC1)COc1ccc(F)cc1	ZINC000819258107	CD	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CNOC[C@@H]1CCOC1)COc1ccc(F)cc1	ZINC000819258107	CD	On-Demand	Anodyne	ADRB1	29	42
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CO)c(F)c2)C1	ZINC000819258108	CC	On-Demand	Anodyne	SLC6A1	45	33
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(CO)c(F)c2)C1	ZINC000819258108	CC	On-Demand	Anodyne	EPHX2	20	54
O=C(O)[C@H]1CCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819258109	DD	On-Demand	Anodyne	HTR1A	29	42
O=C(O)[C@H]1CCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819258109	DD	On-Demand	Anodyne	DRD2	24	42
O=C(O)[C@H]1CCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819258109	DD	On-Demand	Anodyne	HTR2A	21	40
O=C(O)[C@H]1CCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819258109	DD	On-Demand	Anodyne	SLC6A1	155	40
O=C(O)[C@H]1CCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819258109	DD	On-Demand	Anodyne	DRD3	32	40
O=C(O)[C@H]1CCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819258109	DD	On-Demand	Anodyne	SIGMAR1	20	44
O=C(O)[C@H]1CCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819258109	DD	On-Demand	Anodyne	PLD1	40	35
O=C(O)[C@H]1CCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819258109	DD	On-Demand	Anodyne	EPHX2	15	41
O=C(O)[C@@H]1CCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819258110	DD	On-Demand	Anodyne	HTR1A	29	42
O=C(O)[C@@H]1CCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819258110	DD	On-Demand	Anodyne	DRD2	24	42
O=C(O)[C@@H]1CCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819258110	DD	On-Demand	Anodyne	HTR2A	21	40
O=C(O)[C@@H]1CCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819258110	DD	On-Demand	Anodyne	SLC6A1	155	40
O=C(O)[C@@H]1CCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819258110	DD	On-Demand	Anodyne	DRD3	32	40
O=C(O)[C@@H]1CCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819258110	DD	On-Demand	Anodyne	SIGMAR1	20	44
O=C(O)[C@@H]1CCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819258110	DD	On-Demand	Anodyne	PLD1	40	35
O=C(O)[C@@H]1CCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819258110	DD	On-Demand	Anodyne	EPHX2	15	41
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258111	FD	On-Demand	Anodyne	HTR1A	46	57
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258111	FD	On-Demand	Anodyne	DRD2	38	57
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258111	FD	On-Demand	Anodyne	DRD4	46	38
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258111	FD	On-Demand	Anodyne	HTR2A	44	45
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258111	FD	On-Demand	Anodyne	HTR2C	23	46
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258111	FD	On-Demand	Anodyne	SLC6A1	111	41
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258111	FD	On-Demand	Anodyne	DRD3	42	44
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258111	FD	On-Demand	Anodyne	HTR7	43	42
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258111	FD	On-Demand	Anodyne	CCR3	64	35
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258111	FD	On-Demand	Anodyne	PLD1	51	36
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258111	FD	On-Demand	Anodyne	PLD2	75	41
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258111	FD	On-Demand	Anodyne	CACNA1G	40	38
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258112	FD	On-Demand	Anodyne	HTR1A	46	57
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258112	FD	On-Demand	Anodyne	DRD2	38	57
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258112	FD	On-Demand	Anodyne	DRD4	46	38
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258112	FD	On-Demand	Anodyne	HTR2A	44	45
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258112	FD	On-Demand	Anodyne	HTR2C	23	46
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258112	FD	On-Demand	Anodyne	SLC6A1	111	41
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258112	FD	On-Demand	Anodyne	DRD3	42	44
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258112	FD	On-Demand	Anodyne	HTR7	43	42
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258112	FD	On-Demand	Anodyne	CCR3	64	35
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258112	FD	On-Demand	Anodyne	PLD1	51	36
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258112	FD	On-Demand	Anodyne	PLD2	75	41
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819258112	FD	On-Demand	Anodyne	CACNA1G	40	38
O=C(O)[C@H]1CCN(C(=O)NCc2cc(O)nc3ccccc23)C1	ZINC000819258114	DD	On-Demand	Anodyne	EPHX2	28	49
O=C(O)[C@@H]1CCN(C(=O)NCc2cc(O)nc3ccccc23)C1	ZINC000819258115	DD	On-Demand	Anodyne	EPHX2	28	49
O=C(O)[C@@H]1CCN(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)C1	ZINC000819258118	ED	On-Demand	Anodyne	SLC6A1	106	45
O=C(O)[C@H]1CCN(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)C1	ZINC000819258119	ED	On-Demand	Anodyne	SLC6A1	106	45
O=C(O)[C@@H]1CCN(C(=O)NC[C@H](c2ccccc2)N2CCCC2)C1	ZINC000819258120	ED	On-Demand	Anodyne	SLC6A1	106	45
O=C(O)[C@H]1CCN(C(=O)NC[C@H](c2ccccc2)N2CCCC2)C1	ZINC000819258121	ED	On-Demand	Anodyne	SLC6A1	106	45
O=C(O)C1CCN(C(=O)NCCc2ccc(Cl)nc2)CC1	ZINC000819258122	DD	On-Demand	Anodyne	EPHX2	17	48
O=C(O)C1CCN(C(=O)NCCc2ccc(Cl)nc2)CC1	ZINC000819258122	DD	On-Demand	Anodyne	GPBAR1	22	41
O=C(O)C1CCN(C(=O)NCCc2ccc(Cl)nc2)CC1	ZINC000819258122	DD	On-Demand	Anodyne	NACHRBETA2	41	35
O=C(O)[C@@H]1CCN(C(=O)NCC[C@H]2COc3ccccc3O2)C1	ZINC000819258123	DD	On-Demand	Anodyne	SLC6A1	46	32
O=C(O)[C@H]1CCN(C(=O)NCC[C@@H]2COc3ccccc3O2)C1	ZINC000819258124	DD	On-Demand	Anodyne	SLC6A1	46	32
O=C(O)[C@H]1CCN(C(=O)NCC[C@H]2COc3ccccc3O2)C1	ZINC000819258125	DD	On-Demand	Anodyne	SLC6A1	46	32
O=C(O)[C@@H]1CCN(C(=O)NCC[C@@H]2COc3ccccc3O2)C1	ZINC000819258126	DD	On-Demand	Anodyne	SLC6A1	46	32
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258129	FC	On-Demand	Anodyne	HTR1A	59	57
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258129	FC	On-Demand	Anodyne	DRD2	54	48
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258129	FC	On-Demand	Anodyne	DRD4	34	47
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258129	FC	On-Demand	Anodyne	ADRA1D	34	43
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258129	FC	On-Demand	Anodyne	HTR2A	48	46
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258129	FC	On-Demand	Anodyne	HTR2C	34	46
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258129	FC	On-Demand	Anodyne	SLC6A1	40	35
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258129	FC	On-Demand	Anodyne	ADRA1A	49	43
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258129	FC	On-Demand	Anodyne	ADRA1B	25	43
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258129	FC	On-Demand	Anodyne	DRD3	70	43
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258129	FC	On-Demand	Anodyne	HTR7	33	40
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258130	FC	On-Demand	Anodyne	HTR1A	59	57
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258130	FC	On-Demand	Anodyne	DRD2	54	48
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258130	FC	On-Demand	Anodyne	DRD4	34	47
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258130	FC	On-Demand	Anodyne	ADRA1D	34	43
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258130	FC	On-Demand	Anodyne	HTR2A	48	46
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258130	FC	On-Demand	Anodyne	HTR2C	34	46
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258130	FC	On-Demand	Anodyne	SLC6A1	40	35
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258130	FC	On-Demand	Anodyne	ADRA1A	49	43
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258130	FC	On-Demand	Anodyne	ADRA1B	25	43
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258130	FC	On-Demand	Anodyne	DRD3	70	43
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819258130	FC	On-Demand	Anodyne	HTR7	33	40
O=C(O)C1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1	ZINC000819258131	GD	On-Demand	Anodyne	SLC6A3	20	42
O=C(O)C1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1	ZINC000819258131	GD	On-Demand	Anodyne	HTR4	45	37
O=C(O)C1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1	ZINC000819258131	GD	On-Demand	Anodyne	GRIN2B	29	46
O=C(O)C1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1	ZINC000819258131	GD	On-Demand	Anodyne	EPHX2	17	42
O=C(O)C1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1	ZINC000819258131	GD	On-Demand	Anodyne	CACNA1I	57	37
O=C(O)C1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1	ZINC000819258132	GD	On-Demand	Anodyne	SLC6A3	20	42
O=C(O)C1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1	ZINC000819258132	GD	On-Demand	Anodyne	HTR4	45	37
O=C(O)C1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1	ZINC000819258132	GD	On-Demand	Anodyne	GRIN2B	29	46
O=C(O)C1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1	ZINC000819258132	GD	On-Demand	Anodyne	EPHX2	17	42
O=C(O)C1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1	ZINC000819258132	GD	On-Demand	Anodyne	CACNA1I	57	37
O=C(O)[C@@H]1CCN(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)C1	ZINC000819258143	DC	On-Demand	Anodyne	CACNA1I	45	33
O=C(O)[C@H]1CCN(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)C1	ZINC000819258144	DC	On-Demand	Anodyne	CACNA1I	45	33
O=C(O)[C@@H]1CCN(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)C1	ZINC000819258145	DC	On-Demand	Anodyne	CACNA1I	45	33
O=C(O)[C@H]1CCN(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)C1	ZINC000819258146	DC	On-Demand	Anodyne	CACNA1I	45	33
O=C(O)[C@@H]1CCN(C(=O)NCCCCN2CCOCC2)C1	ZINC000819258151	CC	On-Demand	Anodyne	EPHX2	19	43
O=C(O)[C@H]1CCN(C(=O)NCCCCN2CCOCC2)C1	ZINC000819258152	CC	On-Demand	Anodyne	EPHX2	19	43
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCCC2=O)C1	ZINC000819258153	CC	On-Demand	Anodyne	SLC6A1	42	32
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCCC2=O)C1	ZINC000819258153	CC	On-Demand	Anodyne	TYRO3	20	42
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCCC2=O)C1	ZINC000819258154	CC	On-Demand	Anodyne	SLC6A1	42	32
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCCC2=O)C1	ZINC000819258154	CC	On-Demand	Anodyne	TYRO3	20	42
O=C(O)[C@H]1CCN(C(=O)NCC2(N3CCOCC3)CCCCC2)C1	ZINC000819258166	ED	On-Demand	Anodyne	SMO	18	49
O=C(O)[C@H]1CCN(C(=O)NCC2(N3CCOCC3)CCCCC2)C1	ZINC000819258166	ED	On-Demand	Anodyne	HCN1	61	36
O=C(O)[C@H]1CCN(C(=O)NCC2(N3CCOCC3)CCCCC2)C1	ZINC000819258166	ED	On-Demand	Anodyne	HCN4	53	35
O=C(O)[C@@H]1CCN(C(=O)NCC2(N3CCOCC3)CCCCC2)C1	ZINC000819258167	ED	On-Demand	Anodyne	SMO	18	49
O=C(O)[C@@H]1CCN(C(=O)NCC2(N3CCOCC3)CCCCC2)C1	ZINC000819258167	ED	On-Demand	Anodyne	HCN1	61	36
O=C(O)[C@@H]1CCN(C(=O)NCC2(N3CCOCC3)CCCCC2)C1	ZINC000819258167	ED	On-Demand	Anodyne	HCN4	53	35
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	HTR1A	72	47
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	DRD2	83	48
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	DRD4	82	43
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	ACHE	49	44
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	HRH2	35	40
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	ADRA1D	49	40
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	HTR2A	65	48
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	HTR2C	41	43
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	SLC6A1	128	40
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	SLC6A4	25	42
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	ADRA1A	71	41
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	HRH1	15	50
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	ADRA1B	51	40
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	DRD3	96	49
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	HTR4	27	45
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	LTA4H	19	41
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	HTR7	62	49
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	HRH3	37	49
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	SIGMAR1	88	50
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	BCHE	20	43
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	CCR3	44	47
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	CCR5	36	42
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	FAAH	17	40
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	S1PR1	18	43
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	EPHX2	15	40
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	S1PR5	22	43
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	CACNA1G	59	41
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258173	FD	On-Demand	Anodyne	L3MBTL3	15	40
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	HTR1A	72	47
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	DRD2	83	48
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	DRD4	82	43
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	ACHE	49	44
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	HRH2	35	40
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	ADRA1D	49	40
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	HTR2A	65	48
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	HTR2C	41	43
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	SLC6A1	128	40
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	SLC6A4	25	42
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	ADRA1A	71	41
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	HRH1	15	50
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	ADRA1B	51	40
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	DRD3	96	49
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	HTR4	27	45
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	LTA4H	19	41
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	HTR7	62	49
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	HRH3	37	49
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	SIGMAR1	88	50
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	BCHE	20	43
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	CCR3	44	47
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	CCR5	36	42
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	FAAH	17	40
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	S1PR1	18	43
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	EPHX2	15	40
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	S1PR5	22	43
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	CACNA1G	59	41
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819258174	FD	On-Demand	Anodyne	L3MBTL3	15	40
O=C(O)[C@H]1CCN(C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)C1	ZINC000819258175	FE	On-Demand	Anodyne	SLC6A1	138	38
O=C(O)[C@H]1CCN(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)C1	ZINC000819258176	FE	On-Demand	Anodyne	SLC6A1	138	38
O=C(O)[C@@H]1CCN(C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)C1	ZINC000819258177	FE	On-Demand	Anodyne	SLC6A1	138	38
O=C(O)[C@@H]1CCN(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)C1	ZINC000819258178	FE	On-Demand	Anodyne	SLC6A1	138	38
O=C(O)[C@H]1CCN(C(=O)NCCn2cccc2)C1	ZINC000819258193	CC	On-Demand	Anodyne	SLC6A1	59	34
O=C(O)[C@@H]1CCN(C(=O)NCCn2cccc2)C1	ZINC000819258194	CC	On-Demand	Anodyne	SLC6A1	59	34
O=C(O)[C@@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258197	GE	On-Demand	Anodyne	DRD2	20	42
O=C(O)[C@@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258197	GE	On-Demand	Anodyne	DRD4	43	42
O=C(O)[C@@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258197	GE	On-Demand	Anodyne	ACHE	47	43
O=C(O)[C@@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258197	GE	On-Demand	Anodyne	HRH2	46	44
O=C(O)[C@@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258197	GE	On-Demand	Anodyne	SLC6A1	100	36
O=C(O)[C@@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258197	GE	On-Demand	Anodyne	DRD3	20	40
O=C(O)[C@@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258197	GE	On-Demand	Anodyne	LTA4H	20	40
O=C(O)[C@@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258197	GE	On-Demand	Anodyne	HRH3	20	46
O=C(O)[C@@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258197	GE	On-Demand	Anodyne	SIGMAR1	53	56
O=C(O)[C@@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258197	GE	On-Demand	Anodyne	BCHE	16	41
O=C(O)[C@@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258197	GE	On-Demand	Anodyne	UTS2R	15	40
O=C(O)[C@@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258197	GE	On-Demand	Anodyne	MCHR1	21	40
O=C(O)[C@@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258197	GE	On-Demand	Anodyne	CACNA1G	34	41
O=C(O)[C@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258198	GE	On-Demand	Anodyne	DRD2	20	42
O=C(O)[C@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258198	GE	On-Demand	Anodyne	DRD4	43	42
O=C(O)[C@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258198	GE	On-Demand	Anodyne	ACHE	47	43
O=C(O)[C@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258198	GE	On-Demand	Anodyne	HRH2	46	44
O=C(O)[C@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258198	GE	On-Demand	Anodyne	SLC6A1	100	36
O=C(O)[C@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258198	GE	On-Demand	Anodyne	DRD3	20	40
O=C(O)[C@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258198	GE	On-Demand	Anodyne	LTA4H	20	40
O=C(O)[C@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258198	GE	On-Demand	Anodyne	HRH3	20	46
O=C(O)[C@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258198	GE	On-Demand	Anodyne	SIGMAR1	53	56
O=C(O)[C@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258198	GE	On-Demand	Anodyne	BCHE	16	41
O=C(O)[C@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258198	GE	On-Demand	Anodyne	UTS2R	15	40
O=C(O)[C@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258198	GE	On-Demand	Anodyne	MCHR1	21	40
O=C(O)[C@H]1CCN(C(=O)NCCCOC2CCN(Cc3ccccc3)CC2)C1	ZINC000819258198	GE	On-Demand	Anodyne	CACNA1G	34	41
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCc3sccc3C2)C1	ZINC000819258199	DD	On-Demand	Anodyne	SLC6A1	105	38
O=C(O)[C@H]1CCN(C(=O)NCCN2CCc3sccc3C2)C1	ZINC000819258200	DD	On-Demand	Anodyne	SLC6A1	105	38
O=C(O)[C@@H]1CCN(C(=O)NCCc2nnc3n2CCCCC3)C1	ZINC000819258201	DC	On-Demand	Anodyne	SLC6A1	40	31
O=C(O)[C@H]1CCN(C(=O)NCCc2nnc3n2CCCCC3)C1	ZINC000819258202	DC	On-Demand	Anodyne	SLC6A1	40	31
O=C(O)[C@@H]1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000819258203	FC	On-Demand	Anodyne	FKBP1A	17	40
O=C(O)[C@@H]1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000819258203	FC	On-Demand	Anodyne	SLC6A1	65	33
O=C(O)[C@@H]1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000819258203	FC	On-Demand	Anodyne	TMPRSS11D	90	34
O=C(O)[C@H]1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000819258204	FC	On-Demand	Anodyne	FKBP1A	17	40
O=C(O)[C@H]1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000819258204	FC	On-Demand	Anodyne	SLC6A1	65	33
O=C(O)[C@H]1CCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000819258204	FC	On-Demand	Anodyne	TMPRSS11D	90	34
O=C(O)[C@@H]1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000819258205	GD	On-Demand	Anodyne	SLC6A1	81	40
O=C(O)[C@@H]1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000819258205	GD	On-Demand	Anodyne	SLC6A3	21	41
O=C(O)[C@@H]1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000819258205	GD	On-Demand	Anodyne	HTR4	43	36
O=C(O)[C@@H]1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000819258205	GD	On-Demand	Anodyne	GRIN2B	23	46
O=C(O)[C@@H]1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000819258205	GD	On-Demand	Anodyne	CACNA1I	57	36
O=C(O)[C@@H]1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000819258206	GD	On-Demand	Anodyne	SLC6A1	81	40
O=C(O)[C@@H]1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000819258206	GD	On-Demand	Anodyne	SLC6A3	21	41
O=C(O)[C@@H]1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000819258206	GD	On-Demand	Anodyne	HTR4	43	36
O=C(O)[C@@H]1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000819258206	GD	On-Demand	Anodyne	GRIN2B	23	46
O=C(O)[C@@H]1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000819258206	GD	On-Demand	Anodyne	CACNA1I	57	36
O=C(O)[C@H]1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000819258207	GD	On-Demand	Anodyne	SLC6A1	81	40
O=C(O)[C@H]1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000819258207	GD	On-Demand	Anodyne	SLC6A3	21	41
O=C(O)[C@H]1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000819258207	GD	On-Demand	Anodyne	HTR4	43	36
O=C(O)[C@H]1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000819258207	GD	On-Demand	Anodyne	GRIN2B	23	46
O=C(O)[C@H]1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000819258207	GD	On-Demand	Anodyne	CACNA1I	57	36
O=C(O)[C@H]1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000819258210	GD	On-Demand	Anodyne	SLC6A1	81	40
O=C(O)[C@H]1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000819258210	GD	On-Demand	Anodyne	SLC6A3	21	41
O=C(O)[C@H]1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000819258210	GD	On-Demand	Anodyne	HTR4	43	36
O=C(O)[C@H]1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000819258210	GD	On-Demand	Anodyne	GRIN2B	23	46
O=C(O)[C@H]1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000819258210	GD	On-Demand	Anodyne	CACNA1I	57	36
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000819258214	CD	On-Demand	Anodyne	EPHX2	19	49
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000819258214	CD	On-Demand	Anodyne	DPP7	43	33
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000819258214	CD	On-Demand	Anodyne	NAMPT	47	44
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000819258214	CD	On-Demand	Anodyne	Q8WSF8_APLCA	41	33
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000819258214	CD	On-Demand	Anodyne	NACHRBETA2	45	40
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000819258215	CD	On-Demand	Anodyne	EPHX2	19	49
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000819258215	CD	On-Demand	Anodyne	DPP7	43	33
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000819258215	CD	On-Demand	Anodyne	NAMPT	47	44
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000819258215	CD	On-Demand	Anodyne	Q8WSF8_APLCA	41	33
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(Cl)nc2)C1	ZINC000819258215	CD	On-Demand	Anodyne	NACHRBETA2	45	40
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819258216	ED	On-Demand	Anodyne	HTR1A	29	46
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819258216	ED	On-Demand	Anodyne	DRD2	25	42
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819258216	ED	On-Demand	Anodyne	HTR2A	28	43
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819258216	ED	On-Demand	Anodyne	SLC6A1	142	39
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819258216	ED	On-Demand	Anodyne	DRD3	39	53
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819258216	ED	On-Demand	Anodyne	HTR7	43	52
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819258216	ED	On-Demand	Anodyne	SIGMAR1	18	45
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819258218	ED	On-Demand	Anodyne	HTR1A	29	46
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819258218	ED	On-Demand	Anodyne	DRD2	25	42
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819258218	ED	On-Demand	Anodyne	HTR2A	28	43
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819258218	ED	On-Demand	Anodyne	SLC6A1	142	39
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819258218	ED	On-Demand	Anodyne	DRD3	39	53
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819258218	ED	On-Demand	Anodyne	HTR7	43	52
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819258218	ED	On-Demand	Anodyne	SIGMAR1	18	45
O=C(O)[C@@H]1CCN(C(=O)NC[C@@H](c2ccccc2)N2CCOCC2)C1	ZINC000819258219	ED	On-Demand	Anodyne	CASR	41	34
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCN(c3ccc(Cl)cc3Cl)C2)cc1	ZINC000819258220	GH	On-Demand	Bother	ADRB3	21	41
O=C(O)[C@H]1CCN(C(=O)NC[C@@H](c2ccccc2)N2CCOCC2)C1	ZINC000819258221	ED	On-Demand	Anodyne	CASR	41	34
O=C(O)[C@@H]1CCN(C(=O)NC[C@H](c2ccccc2)N2CCOCC2)C1	ZINC000819258222	ED	On-Demand	Anodyne	CASR	41	34
O=C(O)[C@H]1CCN(C(=O)NC[C@H](c2ccccc2)N2CCOCC2)C1	ZINC000819258223	ED	On-Demand	Anodyne	CASR	41	34
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccc(Cl)cc3Cl)C2)cc1	ZINC000819258225	GH	On-Demand	Bother	ADRB3	21	41
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCN(c3ccc(Cl)cc3Cl)C2)cc1	ZINC000819258229	GH	On-Demand	Bother	ADRB3	21	41
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCN(c3ccc(Cl)cc3Cl)C2)cc1	ZINC000819258233	GH	On-Demand	Bother	ADRB3	21	41
O=C(O)[C@@H]1CCN(C(=O)NCCc2nnc3n2CCC3)C1	ZINC000819258238	CB	On-Demand	Anodyne	SLC6A1	42	31
O=C(O)[C@H]1CCN(C(=O)NCCc2nnc3n2CCC3)C1	ZINC000819258239	CB	On-Demand	Anodyne	SLC6A1	42	31
O=C(O)[C@@H]1CCN(C(=O)NC[C@H](c2cccc(F)c2)N2CCOCC2)C1	ZINC000819258244	FD	On-Demand	Anodyne	SLC6A1	41	41
O=C(O)[C@H]1CCN(C(=O)NC[C@H](c2cccc(F)c2)N2CCOCC2)C1	ZINC000819258249	FD	On-Demand	Anodyne	SLC6A1	41	41
O=C(O)[C@H]1CCN(C(=O)NC[C@@H](c2cccc(F)c2)N2CCOCC2)C1	ZINC000819258250	FD	On-Demand	Anodyne	SLC6A1	41	41
O=C(O)[C@@H]1CCN(C(=O)NC[C@@H](c2cccc(F)c2)N2CCOCC2)C1	ZINC000819258252	FD	On-Demand	Anodyne	SLC6A1	41	41
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258271	FC	On-Demand	Anodyne	HTR1A	65	48
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258271	FC	On-Demand	Anodyne	DRD2	50	49
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258271	FC	On-Demand	Anodyne	DRD4	29	42
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258271	FC	On-Demand	Anodyne	ADRA1D	32	44
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258271	FC	On-Demand	Anodyne	HTR2A	56	48
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258271	FC	On-Demand	Anodyne	HTR2C	36	42
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258271	FC	On-Demand	Anodyne	SLC6A1	40	34
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258271	FC	On-Demand	Anodyne	ADRA1A	47	44
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258271	FC	On-Demand	Anodyne	ADRA1B	25	44
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258271	FC	On-Demand	Anodyne	DRD3	72	49
O=C(O)[C@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258271	FC	On-Demand	Anodyne	HTR7	54	39
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258273	FC	On-Demand	Anodyne	HTR1A	65	48
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258273	FC	On-Demand	Anodyne	DRD2	50	49
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258273	FC	On-Demand	Anodyne	DRD4	29	42
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258273	FC	On-Demand	Anodyne	ADRA1D	32	44
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258273	FC	On-Demand	Anodyne	HTR2A	56	48
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258273	FC	On-Demand	Anodyne	HTR2C	36	42
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258273	FC	On-Demand	Anodyne	SLC6A1	40	34
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258273	FC	On-Demand	Anodyne	ADRA1A	47	44
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258273	FC	On-Demand	Anodyne	ADRA1B	25	44
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258273	FC	On-Demand	Anodyne	DRD3	72	49
O=C(O)[C@@H]1CCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819258273	FC	On-Demand	Anodyne	HTR7	54	39
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258274	EC	On-Demand	Anodyne	HTR1A	91	54
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258274	EC	On-Demand	Anodyne	DRD2	71	54
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258274	EC	On-Demand	Anodyne	DRD4	56	48
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258274	EC	On-Demand	Anodyne	ADRA1D	21	45
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258274	EC	On-Demand	Anodyne	HTR2A	63	51
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258274	EC	On-Demand	Anodyne	HTR2C	31	43
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258274	EC	On-Demand	Anodyne	SLC6A1	145	39
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258274	EC	On-Demand	Anodyne	SLC6A4	15	40
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258274	EC	On-Demand	Anodyne	ADRA1A	33	45
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258274	EC	On-Demand	Anodyne	ADRA1B	21	45
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258274	EC	On-Demand	Anodyne	DRD3	90	51
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258274	EC	On-Demand	Anodyne	HTR4	21	44
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258274	EC	On-Demand	Anodyne	DRD5	16	41
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258274	EC	On-Demand	Anodyne	HTR7	85	45
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258274	EC	On-Demand	Anodyne	SIGMAR1	21	43
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258274	EC	On-Demand	Anodyne	PLD1	52	36
O=C(O)[C@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258274	EC	On-Demand	Anodyne	PLD2	75	40
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258275	EC	On-Demand	Anodyne	HTR1A	91	54
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258275	EC	On-Demand	Anodyne	DRD2	71	54
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258275	EC	On-Demand	Anodyne	DRD4	56	48
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258275	EC	On-Demand	Anodyne	ADRA1D	21	45
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258275	EC	On-Demand	Anodyne	HTR2A	63	51
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258275	EC	On-Demand	Anodyne	HTR2C	31	43
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258275	EC	On-Demand	Anodyne	SLC6A1	145	39
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258275	EC	On-Demand	Anodyne	SLC6A4	15	40
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258275	EC	On-Demand	Anodyne	ADRA1A	33	45
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258275	EC	On-Demand	Anodyne	ADRA1B	21	45
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258275	EC	On-Demand	Anodyne	DRD3	90	51
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258275	EC	On-Demand	Anodyne	HTR4	21	44
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258275	EC	On-Demand	Anodyne	DRD5	16	41
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258275	EC	On-Demand	Anodyne	HTR7	85	45
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258275	EC	On-Demand	Anodyne	SIGMAR1	21	43
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258275	EC	On-Demand	Anodyne	PLD1	52	36
O=C(O)[C@@H]1CCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819258275	EC	On-Demand	Anodyne	PLD2	75	40
O=C(O)C1CCN(C(=O)NCCCc2ccccn2)CC1	ZINC000819258278	CD	On-Demand	Anodyne	EPHX2	23	45
CCN(C)C(=O)[C@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819258279	CD	On-Demand	Anodyne	ADRB2	19	50
CCN(C)C(=O)[C@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819258279	CD	On-Demand	Anodyne	ADRB1	39	51
CCN(C)C(=O)[C@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819258279	CD	On-Demand	Anodyne	ADRB3	63	51
CCN(C)C(=O)[C@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819258280	CD	On-Demand	Anodyne	ADRB2	19	50
CCN(C)C(=O)[C@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819258280	CD	On-Demand	Anodyne	ADRB1	39	51
CCN(C)C(=O)[C@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819258280	CD	On-Demand	Anodyne	ADRB3	63	51
CCN(C)C(=O)[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819258281	CD	On-Demand	Anodyne	ADRB2	19	50
CCN(C)C(=O)[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819258281	CD	On-Demand	Anodyne	ADRB1	39	51
CCN(C)C(=O)[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819258281	CD	On-Demand	Anodyne	ADRB3	63	51
CCN(C)C(=O)[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819258282	CD	On-Demand	Anodyne	ADRB2	19	50
CCN(C)C(=O)[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819258282	CD	On-Demand	Anodyne	ADRB1	39	51
CCN(C)C(=O)[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819258282	CD	On-Demand	Anodyne	ADRB3	63	51
CCCOc1ccc(CNC[C@H](O)c2cccc(OC)c2)c(C)c1	ZINC000819258305	EH	On-Demand	Anodyne	ADRB1	26	44
CCCOc1ccc(CNC[C@H](O)c2cccc(OC)c2)c(C)c1	ZINC000819258305	EH	On-Demand	Anodyne	ADRB3	32	44
CCCOc1ccc(CNC[C@@H](O)c2cccc(OC)c2)c(C)c1	ZINC000819258306	EH	On-Demand	Anodyne	ADRB1	26	44
CCCOc1ccc(CNC[C@@H](O)c2cccc(OC)c2)c(C)c1	ZINC000819258306	EH	On-Demand	Anodyne	ADRB3	32	44
CCOC[C@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C(C)C	ZINC000819258328	FF	On-Demand	Anodyne	GPR119	26	42
CCOC[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C(C)C	ZINC000819258330	FF	On-Demand	Anodyne	GPR119	26	42
CON(C)C(=O)CCN[C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O	ZINC000819258339	FE	On-Demand	Anodyne	CNR1	39	40
CON(C)C(=O)CCN[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O	ZINC000819258340	FE	On-Demand	Anodyne	CNR1	39	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(F)(F)c2ccccc2)CC1	ZINC000819258394	GG	On-Demand	Anodyne	AMY2	54	32
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(F)(F)c2ccccc2)CC1	ZINC000819258394	GG	On-Demand	Anodyne	CCR8	32	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(F)(F)c2ccccc2)CC1	ZINC000819258394	GG	On-Demand	Anodyne	GPR119	47	51
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(F)(F)c2ccccc2)CC1	ZINC000819258394	GG	On-Demand	Anodyne	SFRP1	72	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(F)(F)c2ccccc2)CC1	ZINC000819258394	GG	On-Demand	Anodyne	WNT3	54	37
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(F)(F)c2ccccc2)CC1	ZINC000819258395	GG	On-Demand	Anodyne	AMY2	54	32
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(F)(F)c2ccccc2)CC1	ZINC000819258395	GG	On-Demand	Anodyne	CCR8	32	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(F)(F)c2ccccc2)CC1	ZINC000819258395	GG	On-Demand	Anodyne	GPR119	47	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(F)(F)c2ccccc2)CC1	ZINC000819258395	GG	On-Demand	Anodyne	SFRP1	72	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(F)(F)c2ccccc2)CC1	ZINC000819258395	GG	On-Demand	Anodyne	WNT3	54	37
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCN(c3ccc(Cl)cc3Cl)C2)c1	ZINC000819258401	GH	On-Demand	Bother	ADRB3	34	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCN(c3ccc(Cl)cc3Cl)C2)c1	ZINC000819258402	GH	On-Demand	Bother	ADRB3	34	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCN(c3ccc(Cl)cc3Cl)C2)c1	ZINC000819258403	GH	On-Demand	Bother	ADRB3	34	41
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCN(c3ccc(Cl)cc3Cl)C2)c1	ZINC000819258404	GH	On-Demand	Bother	ADRB3	34	41
CCC1(CC)CCC(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819258407	FG	On-Demand	Anodyne	ADRB3	18	42
CCC1(CC)CCC(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819258408	FG	On-Demand	Anodyne	ADRB3	18	42
CCCOc1ccc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c(C)c1	ZINC000819258433	GG	On-Demand	Anodyne	ADRB3	20	42
CCCOc1ccc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c(C)c1	ZINC000819258434	GG	On-Demand	Anodyne	ADRB3	20	42
O=C1CCc2cc(-c3csc(NC(=O)C(F)=C4CCC4)n3)ccc2N1	ZINC000819258454	FI	On-Demand	Anodyne	MPL	15	42
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(c3c(C)cc(C)cc3C)C2=O)cc1	ZINC000819258470	GG	On-Demand	Anodyne	ADRB2	33	44
Cc1ccc(OC[C@@H](O)CN[C@H]2CCN(c3c(C)cc(C)cc3C)C2=O)cc1	ZINC000819258471	GG	On-Demand	Anodyne	ADRB2	33	44
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCN(c3c(C)cc(C)cc3C)C2=O)cc1	ZINC000819258472	GG	On-Demand	Anodyne	ADRB2	33	44
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(c3c(C)cc(C)cc3C)C2=O)cc1	ZINC000819258473	GG	On-Demand	Anodyne	ADRB2	33	44
COc1c(CNCCC(=O)Nc2ccc(N(C)C)cc2)oc2ccccc12	ZINC000819258476	FH	On-Demand	Anodyne	MTNR1B	22	41
CS(=O)(=O)c1ccc([C@@H](O)CNCC(F)(F)c2ccccc2)cc1	ZINC000819258504	FF	On-Demand	Anodyne	ADRB3	37	43
CS(=O)(=O)c1ccc([C@@H](O)CNCC(F)(F)c2ccccc2)cc1	ZINC000819258504	FF	On-Demand	Anodyne	CTSF	57	39
CS(=O)(=O)c1ccc([C@H](O)CNCC(F)(F)c2ccccc2)cc1	ZINC000819258505	FF	On-Demand	Anodyne	ADRB3	37	43
CS(=O)(=O)c1ccc([C@H](O)CNCC(F)(F)c2ccccc2)cc1	ZINC000819258505	FF	On-Demand	Anodyne	CTSF	57	39
CCOC(=O)NC1CCC(NC[C@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000819258569	GD	On-Demand	Anodyne	ADRB2	27	40
CCOC(=O)NC1CCC(NC[C@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000819258569	GD	On-Demand	Anodyne	EDNRB	40	35
CCOC(=O)NC1CCC(NC[C@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000819258569	GD	On-Demand	Anodyne	EDNRA	41	37
CCOC(=O)NC1CCC(NC[C@@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000819258570	GD	On-Demand	Anodyne	ADRB2	27	40
CCOC(=O)NC1CCC(NC[C@@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000819258570	GD	On-Demand	Anodyne	EDNRB	40	35
CCOC(=O)NC1CCC(NC[C@@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000819258570	GD	On-Demand	Anodyne	EDNRA	41	37
CCNC(=O)C1(CNC[C@H](O)c2ccccc2Cl)CCC1	ZINC000819258579	DE	On-Demand	Anodyne	OPRL1	21	47
CCOC(=O)NC1CCC(NC[C@@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819258587	FG	On-Demand	Anodyne	ADRB3	24	40
CCOC(=O)NC1CCC(NC[C@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819258588	FG	On-Demand	Anodyne	ADRB3	24	40
C=CC(=O)NCCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819258616	DC	On-Demand	Anodyne	DRD4	41	31
C=CC(=O)NCCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819258616	DC	On-Demand	Anodyne	MTNR1A	59	45
C=CC(=O)NCCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819258616	DC	On-Demand	Anodyne	MTNR1B	55	45
C=CC(=O)NCCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819258617	DC	On-Demand	Anodyne	DRD4	41	31
C=CC(=O)NCCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819258617	DC	On-Demand	Anodyne	MTNR1A	59	45
C=CC(=O)NCCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819258617	DC	On-Demand	Anodyne	MTNR1B	55	45
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3cccnc3)C2=O)cc1	ZINC000819258620	ED	On-Demand	Anodyne	ADRB1	25	44
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3cccnc3)C2=O)cc1	ZINC000819258620	ED	On-Demand	Anodyne	ADRB3	93	46
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3cccnc3)C2=O)cc1	ZINC000819258621	ED	On-Demand	Anodyne	ADRB1	25	44
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3cccnc3)C2=O)cc1	ZINC000819258621	ED	On-Demand	Anodyne	ADRB3	93	46
CCNC(=O)C1(CNC[C@H](O)c2ccccc2)CCC1	ZINC000819258635	CD	On-Demand	Anodyne	ADRB3	44	38
CCNC(=O)C1(CNC[C@H](O)c2ccccc2)CCC1	ZINC000819258635	CD	On-Demand	Anodyne	MME	15	40
CCNC(=O)C1(CNC[C@@H](O)c2ccccc2)CCC1	ZINC000819258636	CD	On-Demand	Anodyne	ADRB3	44	38
CCNC(=O)C1(CNC[C@@H](O)c2ccccc2)CCC1	ZINC000819258636	CD	On-Demand	Anodyne	MME	15	40
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(S(=O)(=O)C[C@@H]2CCCO2)cc1	ZINC000819258639	FE	On-Demand	Anodyne	F13A1	42	34
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(S(=O)(=O)C[C@H]2CCCO2)cc1	ZINC000819258640	FE	On-Demand	Anodyne	F13A1	42	34
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(S(=O)(=O)C[C@H]2CCCO2)cc1	ZINC000819258641	FE	On-Demand	Anodyne	F13A1	42	34
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(S(=O)(=O)C[C@@H]2CCCO2)cc1	ZINC000819258642	FE	On-Demand	Anodyne	F13A1	42	34
O[C@@H](CN[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1)c1cccnc1	ZINC000819258670	FG	On-Demand	Anodyne	ADRB3	56	50
O[C@H](CN[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1)c1cccnc1	ZINC000819258671	FG	On-Demand	Anodyne	ADRB3	56	50
O[C@H](CN[C@H]1CCN(c2ccc(Cl)cc2Cl)C1)c1cccnc1	ZINC000819258672	FG	On-Demand	Anodyne	ADRB3	56	50
O[C@@H](CN[C@H]1CCN(c2ccc(Cl)cc2Cl)C1)c1cccnc1	ZINC000819258673	FG	On-Demand	Anodyne	ADRB3	56	50
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1ccc(F)c(F)c1)CC2	ZINC000819258736	EF	On-Demand	Anodyne	ADRB3	22	44
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1ccc(F)c(F)c1)CC2	ZINC000819258739	EF	On-Demand	Anodyne	ADRB3	22	44
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1ccc(F)c(F)c1)CC2	ZINC000819258741	EF	On-Demand	Anodyne	ADRB3	22	44
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1ccc(F)c(F)c1)CC2	ZINC000819258743	EF	On-Demand	Anodyne	ADRB3	22	44
CCN(C)C(=O)[C@H](C)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819258766	FD	On-Demand	Anodyne	GPR119	26	42
CCN(C)C(=O)[C@@H](C)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819258767	FD	On-Demand	Anodyne	GPR119	26	42
CCN(C)C(=O)[C@@H](C)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819258769	FD	On-Demand	Anodyne	GPR119	26	42
CCN(C)C(=O)[C@H](C)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819258771	FD	On-Demand	Anodyne	GPR119	26	42
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1ccc(Cl)cc1)CC2	ZINC000819258782	EG	On-Demand	Anodyne	ADRB3	22	51
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1ccc(Cl)cc1)CC2	ZINC000819258784	EG	On-Demand	Anodyne	ADRB3	22	51
O[C@@H](CNCC(F)(F)c1ccccc1)c1cccnc1	ZINC000819258812	CE	On-Demand	Anodyne	ADRB2	23	47
O[C@@H](CNCC(F)(F)c1ccccc1)c1cccnc1	ZINC000819258812	CE	On-Demand	Anodyne	ADRB1	25	46
O[C@@H](CNCC(F)(F)c1ccccc1)c1cccnc1	ZINC000819258812	CE	On-Demand	Anodyne	ADRB3	94	49
O[C@@H](CNCC(F)(F)c1ccccc1)c1cccnc1	ZINC000819258812	CE	On-Demand	Anodyne	KCNA5	21	40
O[C@H](CNCC(F)(F)c1ccccc1)c1cccnc1	ZINC000819258814	CE	On-Demand	Anodyne	ADRB2	23	47
O[C@H](CNCC(F)(F)c1ccccc1)c1cccnc1	ZINC000819258814	CE	On-Demand	Anodyne	ADRB1	25	46
O[C@H](CNCC(F)(F)c1ccccc1)c1cccnc1	ZINC000819258814	CE	On-Demand	Anodyne	ADRB3	94	49
O[C@H](CNCC(F)(F)c1ccccc1)c1cccnc1	ZINC000819258814	CE	On-Demand	Anodyne	KCNA5	21	40
O[C@@H](CNCC1(c2cccc(Cl)c2F)CCCC1)c1cccnc1	ZINC000819258844	EI	On-Demand	Anodyne	ADRB3	76	40
O[C@H](CNCC1(c2cccc(Cl)c2F)CCCC1)c1cccnc1	ZINC000819258845	EI	On-Demand	Anodyne	ADRB3	76	40
CCOC(=O)NC1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819258858	EG	On-Demand	Anodyne	ADRB2	22	42
CCOC(=O)NC1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819258858	EG	On-Demand	Anodyne	ADRB1	46	47
CCOC(=O)NC1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819258858	EG	On-Demand	Anodyne	ADRB3	63	57
CCOC(=O)NC1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819258858	EG	On-Demand	Anodyne	IGF1R	29	45
CCOC(=O)NC1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819258858	EG	On-Demand	Anodyne	CYP3A4	52	45
CCOC(=O)NC1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819258859	EG	On-Demand	Anodyne	ADRB2	22	42
CCOC(=O)NC1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819258859	EG	On-Demand	Anodyne	ADRB1	46	47
CCOC(=O)NC1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819258859	EG	On-Demand	Anodyne	ADRB3	63	57
CCOC(=O)NC1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819258859	EG	On-Demand	Anodyne	IGF1R	29	45
CCOC(=O)NC1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819258859	EG	On-Demand	Anodyne	CYP3A4	52	45
COC(=O)CN(CCN1CCOCC1)C(=O)C(F)=C1CCC1	ZINC000819258888	DC	On-Demand	Anodyne	CASR	48	39
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1Cc1ccc(F)cc1	ZINC000819258893	FF	On-Demand	Anodyne	ADRB1	34	43
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1Cc1ccc(F)cc1	ZINC000819258893	FF	On-Demand	Anodyne	ADRB3	51	43
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1Cc1ccc(F)cc1	ZINC000819258893	FF	On-Demand	Anodyne	CYP3A4	49	37
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1Cc1ccc(F)cc1	ZINC000819258894	FF	On-Demand	Anodyne	ADRB1	34	43
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1Cc1ccc(F)cc1	ZINC000819258894	FF	On-Demand	Anodyne	ADRB3	51	43
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1Cc1ccc(F)cc1	ZINC000819258894	FF	On-Demand	Anodyne	CYP3A4	49	37
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1Cc1ccc(F)cc1	ZINC000819258895	FF	On-Demand	Anodyne	ADRB1	34	43
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1Cc1ccc(F)cc1	ZINC000819258895	FF	On-Demand	Anodyne	ADRB3	51	43
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1Cc1ccc(F)cc1	ZINC000819258895	FF	On-Demand	Anodyne	CYP3A4	49	37
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1Cc1ccc(F)cc1	ZINC000819258896	FF	On-Demand	Anodyne	ADRB1	34	43
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1Cc1ccc(F)cc1	ZINC000819258896	FF	On-Demand	Anodyne	ADRB3	51	43
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1Cc1ccc(F)cc1	ZINC000819258896	FF	On-Demand	Anodyne	CYP3A4	49	37
CCOC(=O)NC1CCC(NC[C@H](O)c2ccc(C)cc2)CC1	ZINC000819258945	DF	On-Demand	Anodyne	ADRB3	22	47
CCOC(=O)NC1CCC(NC[C@@H](O)c2ccc(C)cc2)CC1	ZINC000819258946	DF	On-Demand	Anodyne	ADRB3	22	47
CCOC(=O)NC1CCC(NC[C@@H](O)CCc2ccccc2)CC1	ZINC000819258947	EF	On-Demand	Anodyne	ACE	45	40
CCOC(=O)NC1CCC(NC[C@@H](O)CCc2ccccc2)CC1	ZINC000819258947	EF	On-Demand	Anodyne	CTSB	22	42
CCOC(=O)NC1CCC(NC[C@@H](O)CCc2ccccc2)CC1	ZINC000819258947	EF	On-Demand	Anodyne	CTSK	23	42
CCOC(=O)NC1CCC(NC[C@@H](O)CCc2ccccc2)CC1	ZINC000819258947	EF	On-Demand	Anodyne	CTSL	25	42
CCOC(=O)NC1CCC(NC[C@@H](O)CCc2ccccc2)CC1	ZINC000819258947	EF	On-Demand	Anodyne	CAPN1	26	40
CCOC(=O)NC1CCC(NC[C@@H](O)CCc2ccccc2)CC1	ZINC000819258947	EF	On-Demand	Anodyne	CAPN2	53	40
CCOC(=O)NC1CCC(NC[C@@H](O)CCc2ccccc2)CC1	ZINC000819258947	EF	On-Demand	Anodyne	LAP3	43	35
CCOC(=O)NC1CCC(NC[C@@H](O)CCc2ccccc2)CC1	ZINC000819258947	EF	On-Demand	Anodyne	NAAA	52	38
CCOC(=O)NC1CCC(NC[C@@H](O)CCc2ccccc2)CC1	ZINC000819258947	EF	On-Demand	Anodyne	Q9NAW4_PLAFA	35	41
CCOC(=O)NC1CCC(NC[C@H](O)CCc2ccccc2)CC1	ZINC000819258948	EF	On-Demand	Anodyne	ACE	45	40
CCOC(=O)NC1CCC(NC[C@H](O)CCc2ccccc2)CC1	ZINC000819258948	EF	On-Demand	Anodyne	CTSB	22	42
CCOC(=O)NC1CCC(NC[C@H](O)CCc2ccccc2)CC1	ZINC000819258948	EF	On-Demand	Anodyne	CTSK	23	42
CCOC(=O)NC1CCC(NC[C@H](O)CCc2ccccc2)CC1	ZINC000819258948	EF	On-Demand	Anodyne	CTSL	25	42
CCOC(=O)NC1CCC(NC[C@H](O)CCc2ccccc2)CC1	ZINC000819258948	EF	On-Demand	Anodyne	CAPN1	26	40
CCOC(=O)NC1CCC(NC[C@H](O)CCc2ccccc2)CC1	ZINC000819258948	EF	On-Demand	Anodyne	CAPN2	53	40
CCOC(=O)NC1CCC(NC[C@H](O)CCc2ccccc2)CC1	ZINC000819258948	EF	On-Demand	Anodyne	LAP3	43	35
CCOC(=O)NC1CCC(NC[C@H](O)CCc2ccccc2)CC1	ZINC000819258948	EF	On-Demand	Anodyne	NAAA	52	38
CCOC(=O)NC1CCC(NC[C@H](O)CCc2ccccc2)CC1	ZINC000819258948	EF	On-Demand	Anodyne	Q9NAW4_PLAFA	35	41
COc1ccccc1-c1csc(NC(=O)C(F)=C2CCC2)n1	ZINC000819258955	DI	On-Demand	Anodyne	MPL	40	34
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1cccc(F)c1)CC2	ZINC000819259035	DF	On-Demand	Anodyne	ADRB3	21	42
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1cccc(F)c1)CC2	ZINC000819259036	DF	On-Demand	Anodyne	ADRB3	21	42
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1cccc(F)c1)CC2	ZINC000819259037	DF	On-Demand	Anodyne	ADRB3	21	42
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1cccc(F)c1)CC2	ZINC000819259038	DF	On-Demand	Anodyne	ADRB3	21	42
CS(=O)(=O)Nc1ccc(-c2csc(NC(=O)C(F)=C3CCC3)n2)cc1	ZINC000819259083	GH	On-Demand	Anodyne	ROCK1	19	45
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCCN1c1ccc(Cl)cc1Cl	ZINC000819259088	GG	On-Demand	Anodyne	ADRB3	59	40
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCCN1c1ccc(Cl)cc1Cl	ZINC000819259089	GG	On-Demand	Anodyne	ADRB3	59	40
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCCN1c1ccc(Cl)cc1Cl	ZINC000819259090	GG	On-Demand	Anodyne	ADRB3	59	40
O=C1[C@H](NC[C@H](O)c2cccnc2)CCCN1c1ccc(Cl)cc1Cl	ZINC000819259091	GG	On-Demand	Anodyne	ADRB3	59	40
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ncnn1C	ZINC000819259101	GD	On-Demand	Anodyne	CTSD	72	43
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ncnn1C	ZINC000819259101	GD	On-Demand	Anodyne	PGC	61	38
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ncnn1C	ZINC000819259101	GD	On-Demand	Anodyne	PAPA1_CARPA	28	40
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ncnn1C	ZINC000819259101	GD	On-Demand	Anodyne	PGA	46	39
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ncnn1C	ZINC000819259101	GD	On-Demand	Anodyne	BACE2	54	38
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ncnn1C	ZINC000819259101	GD	On-Demand	Anodyne	REN	87	47
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ncnn1C	ZINC000819259101	GD	On-Demand	Anodyne	REN1	35	45
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ncnn1C	ZINC000819259101	GD	On-Demand	Anodyne	BACE1	59	42
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ncnn1C	ZINC000819259101	GD	On-Demand	Anodyne	FPR1	50	39
C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)c1ncnn1C	ZINC000819259101	GD	On-Demand	Anodyne	PLM2_PLAFA	50	36
CCOC(=O)NC1CCC(NC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000819259177	FE	On-Demand	Anodyne	ADRB2	45	47
CCOC(=O)NC1CCC(NC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000819259177	FE	On-Demand	Anodyne	ADRB1	55	45
CCOC(=O)NC1CCC(NC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000819259177	FE	On-Demand	Anodyne	ADRB3	39	43
CCOC(=O)NC1CCC(NC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000819259179	FE	On-Demand	Anodyne	ADRB2	45	47
CCOC(=O)NC1CCC(NC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000819259179	FE	On-Demand	Anodyne	ADRB1	55	45
CCOC(=O)NC1CCC(NC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000819259179	FE	On-Demand	Anodyne	ADRB3	39	43
CCOC(=O)NC1CCC(NC[C@H](O)CN2CCc3ccccc3C2)CC1	ZINC000819259216	GE	On-Demand	Anodyne	NOD1	15	42
CCOC(=O)NC1CCC(NC[C@H](O)CN2CCc3ccccc3C2)CC1	ZINC000819259216	GE	On-Demand	Anodyne	NOD2	42	42
CCOC(=O)NC1CCC(NC[C@@H](O)CN2CCc3ccccc3C2)CC1	ZINC000819259217	GE	On-Demand	Anodyne	NOD1	15	42
CCOC(=O)NC1CCC(NC[C@@H](O)CN2CCc3ccccc3C2)CC1	ZINC000819259217	GE	On-Demand	Anodyne	NOD2	42	42
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1cccc(Cl)c1)CC2	ZINC000819259258	EG	On-Demand	Anodyne	ADRB1	29	54
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1cccc(Cl)c1)CC2	ZINC000819259258	EG	On-Demand	Anodyne	ADRB3	50	55
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1cccc(Cl)c1)CC2	ZINC000819259258	EG	On-Demand	Anodyne	CYP3A4	47	36
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)CC2	ZINC000819259259	EG	On-Demand	Anodyne	ADRB1	29	54
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)CC2	ZINC000819259259	EG	On-Demand	Anodyne	ADRB3	50	55
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)CC2	ZINC000819259259	EG	On-Demand	Anodyne	CYP3A4	47	36
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1cccc(Cl)c1)CC2	ZINC000819259260	EG	On-Demand	Anodyne	ADRB1	29	54
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1cccc(Cl)c1)CC2	ZINC000819259260	EG	On-Demand	Anodyne	ADRB3	50	55
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1cccc(Cl)c1)CC2	ZINC000819259260	EG	On-Demand	Anodyne	CYP3A4	47	36
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1cccc(Cl)c1)CC2	ZINC000819259261	EG	On-Demand	Anodyne	ADRB1	29	54
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1cccc(Cl)c1)CC2	ZINC000819259261	EG	On-Demand	Anodyne	ADRB3	50	55
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1cccc(Cl)c1)CC2	ZINC000819259261	EG	On-Demand	Anodyne	CYP3A4	47	36
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1ccc(C#N)cc1)CC2	ZINC000819259297	DF	On-Demand	Mild	ADRB3	18	41
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1ccc(C#N)cc1)CC2	ZINC000819259298	DF	On-Demand	Mild	ADRB3	18	41
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1ccc(C#N)cc1)CC2	ZINC000819259299	DF	On-Demand	Mild	ADRB3	18	41
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1ccc(C#N)cc1)CC2	ZINC000819259300	DF	On-Demand	Mild	ADRB3	18	41
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1ccc(Br)cc1)CC2	ZINC000819259303	GG	On-Demand	Anodyne	ADRB3	19	42
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1ccc(Br)cc1)CC2	ZINC000819259304	GG	On-Demand	Anodyne	ADRB3	19	42
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1ccc(Br)cc1)CC2	ZINC000819259305	GG	On-Demand	Anodyne	ADRB3	19	42
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1ccc(Br)cc1)CC2	ZINC000819259306	GG	On-Demand	Anodyne	ADRB3	19	42
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccc(C3CC3)cc2)c1	ZINC000819259309	DG	On-Demand	Bother	CACNA1D	57	33
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccc(C3CC3)cc2)c1	ZINC000819259310	DG	On-Demand	Bother	CACNA1D	57	33
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)C(C)(C)c1ccccc1	ZINC000819259332	DF	On-Demand	Reactive	AMY2	46	32
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)C(C)(C)c1ccccc1	ZINC000819259333	DF	On-Demand	Reactive	AMY2	46	32
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1ccc(Cl)c(F)c1)CC2	ZINC000819259342	FG	On-Demand	Anodyne	ADRB3	21	44
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1ccc(Cl)c(F)c1)CC2	ZINC000819259344	FG	On-Demand	Anodyne	ADRB3	21	44
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1ccc(Cl)c(F)c1)CC2	ZINC000819259347	FG	On-Demand	Anodyne	ADRB3	21	44
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1ccc(Cl)c(F)c1)CC2	ZINC000819259349	FG	On-Demand	Anodyne	ADRB3	21	44
COc1cccc([S@@](=O)CC(=O)NCC[S@](=O)Cc2ccccc2)c1	ZINC000819259351	GD	On-Demand	Anodyne	DRD4	43	33
COc1cccc([S@@](=O)CC(=O)NCC[S@](=O)Cc2ccccc2)c1	ZINC000819259351	GD	On-Demand	Anodyne	MTNR1A	51	44
COc1cccc([S@@](=O)CC(=O)NCC[S@](=O)Cc2ccccc2)c1	ZINC000819259351	GD	On-Demand	Anodyne	MTNR1B	52	44
COc1cccc([S@@](=O)CC(=O)NCC[S@@](=O)Cc2ccccc2)c1	ZINC000819259356	GD	On-Demand	Anodyne	DRD4	43	33
COc1cccc([S@@](=O)CC(=O)NCC[S@@](=O)Cc2ccccc2)c1	ZINC000819259356	GD	On-Demand	Anodyne	MTNR1A	51	44
COc1cccc([S@@](=O)CC(=O)NCC[S@@](=O)Cc2ccccc2)c1	ZINC000819259356	GD	On-Demand	Anodyne	MTNR1B	52	44
O=C1[C@H](NC[C@H](O)c2ccccc2F)CCN1Cc1ccc(F)cc1	ZINC000819259391	EE	On-Demand	Anodyne	SIGMAR1	17	42
O=C1[C@H](NC[C@@H](O)c2ccccc2F)CCN1Cc1ccc(F)cc1	ZINC000819259392	EE	On-Demand	Anodyne	SIGMAR1	17	42
O=C1[C@@H](NC[C@H](O)c2ccccc2F)CCN1Cc1ccc(F)cc1	ZINC000819259393	EE	On-Demand	Anodyne	SIGMAR1	17	42
O=C1[C@@H](NC[C@@H](O)c2ccccc2F)CCN1Cc1ccc(F)cc1	ZINC000819259394	EE	On-Demand	Anodyne	SIGMAR1	17	42
CCOC(=O)NC1CCC(NC[C@@H](O)Cc2ccccc2)CC1	ZINC000819259416	DE	On-Demand	Anodyne	MME	47	35
CCOC(=O)NC1CCC(NC[C@@H](O)Cc2ccccc2)CC1	ZINC000819259416	DE	On-Demand	Anodyne	CTSB	23	41
CCOC(=O)NC1CCC(NC[C@@H](O)Cc2ccccc2)CC1	ZINC000819259416	DE	On-Demand	Anodyne	CTSK	18	41
CCOC(=O)NC1CCC(NC[C@@H](O)Cc2ccccc2)CC1	ZINC000819259416	DE	On-Demand	Anodyne	CTSL	25	41
CCOC(=O)NC1CCC(NC[C@@H](O)Cc2ccccc2)CC1	ZINC000819259416	DE	On-Demand	Anodyne	TIMP3	71	38
CCOC(=O)NC1CCC(NC[C@@H](O)Cc2ccccc2)CC1	ZINC000819259416	DE	On-Demand	Anodyne	CAPNS1	68	32
CCOC(=O)NC1CCC(NC[C@@H](O)Cc2ccccc2)CC1	ZINC000819259416	DE	On-Demand	Anodyne	CAPN1	30	41
CCOC(=O)NC1CCC(NC[C@@H](O)Cc2ccccc2)CC1	ZINC000819259416	DE	On-Demand	Anodyne	CAPN2	46	41
CCOC(=O)NC1CCC(NC[C@H](O)Cc2ccccc2)CC1	ZINC000819259417	DE	On-Demand	Anodyne	MME	47	35
CCOC(=O)NC1CCC(NC[C@H](O)Cc2ccccc2)CC1	ZINC000819259417	DE	On-Demand	Anodyne	CTSB	23	41
CCOC(=O)NC1CCC(NC[C@H](O)Cc2ccccc2)CC1	ZINC000819259417	DE	On-Demand	Anodyne	CTSK	18	41
CCOC(=O)NC1CCC(NC[C@H](O)Cc2ccccc2)CC1	ZINC000819259417	DE	On-Demand	Anodyne	CTSL	25	41
CCOC(=O)NC1CCC(NC[C@H](O)Cc2ccccc2)CC1	ZINC000819259417	DE	On-Demand	Anodyne	TIMP3	71	38
CCOC(=O)NC1CCC(NC[C@H](O)Cc2ccccc2)CC1	ZINC000819259417	DE	On-Demand	Anodyne	CAPNS1	68	32
CCOC(=O)NC1CCC(NC[C@H](O)Cc2ccccc2)CC1	ZINC000819259417	DE	On-Demand	Anodyne	CAPN1	30	41
CCOC(=O)NC1CCC(NC[C@H](O)Cc2ccccc2)CC1	ZINC000819259417	DE	On-Demand	Anodyne	CAPN2	46	41
CCOC(=O)NC1CCC(NC[C@H](O)COc2ccccc2)CC1	ZINC000819259418	EE	On-Demand	Anodyne	ADRB2	60	52
CCOC(=O)NC1CCC(NC[C@H](O)COc2ccccc2)CC1	ZINC000819259418	EE	On-Demand	Anodyne	ADRB1	74	47
CCOC(=O)NC1CCC(NC[C@H](O)COc2ccccc2)CC1	ZINC000819259418	EE	On-Demand	Anodyne	ADRB3	56	47
CCOC(=O)NC1CCC(NC[C@H](O)COc2ccccc2)CC1	ZINC000819259418	EE	On-Demand	Anodyne	ABCB1	24	44
CCOC(=O)NC1CCC(NC[C@H](O)COc2ccccc2)CC1	ZINC000819259418	EE	On-Demand	Anodyne	PDS	60	38
CCOC(=O)NC1CCC(NC[C@@H](O)COc2ccccc2)CC1	ZINC000819259419	EE	On-Demand	Anodyne	ADRB2	60	52
CCOC(=O)NC1CCC(NC[C@@H](O)COc2ccccc2)CC1	ZINC000819259419	EE	On-Demand	Anodyne	ADRB1	74	47
CCOC(=O)NC1CCC(NC[C@@H](O)COc2ccccc2)CC1	ZINC000819259419	EE	On-Demand	Anodyne	ADRB3	56	47
CCOC(=O)NC1CCC(NC[C@@H](O)COc2ccccc2)CC1	ZINC000819259419	EE	On-Demand	Anodyne	ABCB1	24	44
CCOC(=O)NC1CCC(NC[C@@H](O)COc2ccccc2)CC1	ZINC000819259419	EE	On-Demand	Anodyne	PDS	60	38
N#Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3cccnc3)C2=O)cc1	ZINC000819259423	ED	On-Demand	Mild	ADRB3	67	46
N#Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3cccnc3)C2=O)cc1	ZINC000819259424	ED	On-Demand	Mild	ADRB3	67	46
N#Cc1ccc(CN2CC[C@H](NC[C@H](O)c3cccnc3)C2=O)cc1	ZINC000819259425	ED	On-Demand	Mild	ADRB3	67	46
N#Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3cccnc3)C2=O)cc1	ZINC000819259426	ED	On-Demand	Mild	ADRB3	67	46
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3cccc(C(F)(F)F)c3)C2=O)cc1	ZINC000819259433	GG	On-Demand	Anodyne	CCR2	47	42
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3cccc(C(F)(F)F)c3)C2=O)cc1	ZINC000819259436	GG	On-Demand	Anodyne	CCR2	47	42
CCOC(=O)NC1CCC(NC[C@H](O)COc2cccc(C)c2)CC1	ZINC000819259443	FE	On-Demand	Anodyne	ADRB2	39	58
CCOC(=O)NC1CCC(NC[C@H](O)COc2cccc(C)c2)CC1	ZINC000819259443	FE	On-Demand	Anodyne	ADRB1	45	53
CCOC(=O)NC1CCC(NC[C@H](O)COc2cccc(C)c2)CC1	ZINC000819259443	FE	On-Demand	Anodyne	FAAH	24	50
CCOC(=O)NC1CCC(NC[C@H](O)COc2cccc(C)c2)CC1	ZINC000819259443	FE	On-Demand	Anodyne	PDS	69	43
CCOC(=O)NC1CCC(NC[C@@H](O)COc2cccc(C)c2)CC1	ZINC000819259444	FE	On-Demand	Anodyne	ADRB2	39	58
CCOC(=O)NC1CCC(NC[C@@H](O)COc2cccc(C)c2)CC1	ZINC000819259444	FE	On-Demand	Anodyne	ADRB1	45	53
CCOC(=O)NC1CCC(NC[C@@H](O)COc2cccc(C)c2)CC1	ZINC000819259444	FE	On-Demand	Anodyne	FAAH	24	50
CCOC(=O)NC1CCC(NC[C@@H](O)COc2cccc(C)c2)CC1	ZINC000819259444	FE	On-Demand	Anodyne	PDS	69	43
O=[N+]([O-])c1cccc([C@@H](O)CNCCOC(F)(F)F)c1	ZINC000819259512	CD	On-Demand	Bother	ADRB3	41	36
O=[N+]([O-])c1cccc([C@H](O)CNCCOC(F)(F)F)c1	ZINC000819259513	CD	On-Demand	Bother	ADRB3	41	36
CCCOc1ccc(CNC[C@@H](O)c2cccnc2)c(C)c1	ZINC000819259514	DG	On-Demand	Anodyne	ADRB2	24	52
CCCOc1ccc(CNC[C@@H](O)c2cccnc2)c(C)c1	ZINC000819259514	DG	On-Demand	Anodyne	ADRB1	33	52
CCCOc1ccc(CNC[C@@H](O)c2cccnc2)c(C)c1	ZINC000819259514	DG	On-Demand	Anodyne	ADRB3	85	52
CCCOc1ccc(CNC[C@H](O)c2cccnc2)c(C)c1	ZINC000819259515	DG	On-Demand	Anodyne	ADRB2	24	52
CCCOc1ccc(CNC[C@H](O)c2cccnc2)c(C)c1	ZINC000819259515	DG	On-Demand	Anodyne	ADRB1	33	52
CCCOc1ccc(CNC[C@H](O)c2cccnc2)c(C)c1	ZINC000819259515	DG	On-Demand	Anodyne	ADRB3	85	52
CC(=O)NCCCc1ccc(-c2csc(NC(=O)C(F)=C3CCC3)n2)cc1	ZINC000819259554	GI	On-Demand	Anodyne	ROCK1	20	42
CCOC(=O)NC1CCC(NC[C@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819259582	FG	On-Demand	Anodyne	ADRB3	15	48
CCOC(=O)NC1CCC(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819259583	FG	On-Demand	Anodyne	ADRB3	15	48
O=C1[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)CCN1Cc1ccc(F)cc1	ZINC000819259611	GG	On-Demand	Anodyne	TACR1	41	36
O=C1[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)CCN1Cc1ccc(F)cc1	ZINC000819259611	GG	On-Demand	Anodyne	CCR2	31	41
O=C1[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)CCN1Cc1ccc(F)cc1	ZINC000819259612	GG	On-Demand	Anodyne	TACR1	41	36
O=C1[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)CCN1Cc1ccc(F)cc1	ZINC000819259612	GG	On-Demand	Anodyne	CCR2	31	41
O=C1[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)CCN1Cc1ccc(F)cc1	ZINC000819259613	GG	On-Demand	Anodyne	TACR1	41	36
O=C1[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)CCN1Cc1ccc(F)cc1	ZINC000819259613	GG	On-Demand	Anodyne	CCR2	31	41
O=C1[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)CCN1Cc1ccc(F)cc1	ZINC000819259614	GG	On-Demand	Anodyne	TACR1	41	36
O=C1[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)CCN1Cc1ccc(F)cc1	ZINC000819259614	GG	On-Demand	Anodyne	CCR2	31	41
CCOC(=O)NC1CCC(NCCC(=O)Nc2ccccc2)CC1	ZINC000819259618	EF	On-Demand	Anodyne	LTA4H	29	40
CCOC(=O)NC1CCC(NCCC(=O)Nc2ccccc2)CC1	ZINC000819259618	EF	On-Demand	Anodyne	EPHX2	21	41
CCOC(=O)NC1CCC(NC[C@H](O)COc2c(C)cccc2C)CC1	ZINC000819259621	FF	On-Demand	Anodyne	ADRB2	31	44
CCOC(=O)NC1CCC(NC[C@H](O)COc2c(C)cccc2C)CC1	ZINC000819259621	FF	On-Demand	Anodyne	ADRB1	23	43
CCOC(=O)NC1CCC(NC[C@@H](O)COc2c(C)cccc2C)CC1	ZINC000819259623	FF	On-Demand	Anodyne	ADRB2	31	44
CCOC(=O)NC1CCC(NC[C@@H](O)COc2c(C)cccc2C)CC1	ZINC000819259623	FF	On-Demand	Anodyne	ADRB1	23	43
O=C1[C@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1Cc1ccc(F)cc1	ZINC000819259639	FF	On-Demand	Anodyne	SLC6A3	18	46
O=C1[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1Cc1ccc(F)cc1	ZINC000819259641	FF	On-Demand	Anodyne	SLC6A3	18	46
CCOC(=O)NC1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819259644	DF	On-Demand	Anodyne	SLC6A3	23	49
O=C(CN1C(=O)c2ccccc2S1(=O)=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819259645	HF	On-Demand	Anodyne	ELANE	18	47
CCOC(=O)NC1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819259646	DF	On-Demand	Anodyne	SLC6A3	23	49
CCn1c(CNC[C@H](O)c2cccnc2)nc2cc(Br)ccc21	ZINC000819259659	GG	On-Demand	Anodyne	ADRB3	70	41
CCn1c(CNC[C@@H](O)c2cccnc2)nc2cc(Br)ccc21	ZINC000819259661	GG	On-Demand	Anodyne	ADRB3	70	41
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)CC1	ZINC000819259693	GG	On-Demand	Anodyne	FKBP1A	22	40
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)CC1	ZINC000819259693	GG	On-Demand	Anodyne	CELA1	18	42
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)CC1	ZINC000819259693	GG	On-Demand	Anodyne	GRIN2B	21	44
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)CC1	ZINC000819259693	GG	On-Demand	Anodyne	PREP	50	46
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)CC1	ZINC000819259693	GG	On-Demand	Anodyne	SLC12A5	68	41
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)CC1	ZINC000819259697	GG	On-Demand	Anodyne	FKBP1A	22	40
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)CC1	ZINC000819259697	GG	On-Demand	Anodyne	CELA1	18	42
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)CC1	ZINC000819259697	GG	On-Demand	Anodyne	GRIN2B	21	44
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)CC1	ZINC000819259697	GG	On-Demand	Anodyne	PREP	50	46
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)CC1	ZINC000819259697	GG	On-Demand	Anodyne	SLC12A5	68	41
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)CC1	ZINC000819259699	GG	On-Demand	Anodyne	FKBP1A	22	40
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)CC1	ZINC000819259699	GG	On-Demand	Anodyne	CELA1	18	42
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)CC1	ZINC000819259699	GG	On-Demand	Anodyne	GRIN2B	21	44
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)CC1	ZINC000819259699	GG	On-Demand	Anodyne	PREP	50	46
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)CC1	ZINC000819259699	GG	On-Demand	Anodyne	SLC12A5	68	41
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)CC1	ZINC000819259701	GG	On-Demand	Anodyne	FKBP1A	22	40
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)CC1	ZINC000819259701	GG	On-Demand	Anodyne	CELA1	18	42
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)CC1	ZINC000819259701	GG	On-Demand	Anodyne	GRIN2B	21	44
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)CC1	ZINC000819259701	GG	On-Demand	Anodyne	PREP	50	46
O=C(OCc1ccccc1)N1CCC(C(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)CC1	ZINC000819259701	GG	On-Demand	Anodyne	SLC12A5	68	41
CCNC(=O)C1(CNC[C@H](O)c2cccc(Cl)c2)CCC1	ZINC000819259725	DE	On-Demand	Anodyne	ADRB1	38	47
CCNC(=O)C1(CNC[C@H](O)c2cccc(Cl)c2)CCC1	ZINC000819259725	DE	On-Demand	Anodyne	ADRB3	60	47
CCNC(=O)C1(CNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819259727	DE	On-Demand	Anodyne	ADRB1	38	47
CCNC(=O)C1(CNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819259727	DE	On-Demand	Anodyne	ADRB3	60	47
O[C@@H](CNCC(F)(F)c1ccccc1)c1cccc(Cl)c1	ZINC000819259780	DH	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNCC(F)(F)c1ccccc1)c1cccc(Cl)c1	ZINC000819259780	DH	On-Demand	Anodyne	ADRB1	37	49
O[C@@H](CNCC(F)(F)c1ccccc1)c1cccc(Cl)c1	ZINC000819259780	DH	On-Demand	Anodyne	ADRB3	54	49
O[C@H](CNCC(F)(F)c1ccccc1)c1cccc(Cl)c1	ZINC000819259781	DH	On-Demand	Anodyne	ADRB2	19	40
O[C@H](CNCC(F)(F)c1ccccc1)c1cccc(Cl)c1	ZINC000819259781	DH	On-Demand	Anodyne	ADRB1	37	49
O[C@H](CNCC(F)(F)c1ccccc1)c1cccc(Cl)c1	ZINC000819259781	DH	On-Demand	Anodyne	ADRB3	54	49
CCOC(=O)NC1CCC(NC[C@H](O)c2cccc(OC)c2)CC1	ZINC000819259791	EE	On-Demand	Anodyne	ADRB2	15	40
CCOC(=O)NC1CCC(NC[C@H](O)c2cccc(OC)c2)CC1	ZINC000819259791	EE	On-Demand	Anodyne	ADRB1	22	42
CCOC(=O)NC1CCC(NC[C@H](O)c2cccc(OC)c2)CC1	ZINC000819259791	EE	On-Demand	Anodyne	ADRB3	37	45
CCOC(=O)NC1CCC(NC[C@H](O)c2cccc(OC)c2)CC1	ZINC000819259791	EE	On-Demand	Anodyne	MTNR1A	30	40
CCOC(=O)NC1CCC(NC[C@H](O)c2cccc(OC)c2)CC1	ZINC000819259791	EE	On-Demand	Anodyne	MTNR1B	31	42
CCOC(=O)NC1CCC(NC[C@H](O)c2cccc(OC)c2)CC1	ZINC000819259791	EE	On-Demand	Anodyne	FAAH	22	40
CCOC(=O)NC1CCC(NC[C@@H](O)c2cccc(OC)c2)CC1	ZINC000819259792	EE	On-Demand	Anodyne	ADRB2	15	40
CCOC(=O)NC1CCC(NC[C@@H](O)c2cccc(OC)c2)CC1	ZINC000819259792	EE	On-Demand	Anodyne	ADRB1	22	42
CCOC(=O)NC1CCC(NC[C@@H](O)c2cccc(OC)c2)CC1	ZINC000819259792	EE	On-Demand	Anodyne	ADRB3	37	45
CCOC(=O)NC1CCC(NC[C@@H](O)c2cccc(OC)c2)CC1	ZINC000819259792	EE	On-Demand	Anodyne	MTNR1A	30	40
CCOC(=O)NC1CCC(NC[C@@H](O)c2cccc(OC)c2)CC1	ZINC000819259792	EE	On-Demand	Anodyne	MTNR1B	31	42
CCOC(=O)NC1CCC(NC[C@@H](O)c2cccc(OC)c2)CC1	ZINC000819259792	EE	On-Demand	Anodyne	FAAH	22	40
COC(=O)[C@H]1CC[C@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819259807	CD	On-Demand	Anodyne	HDAC11	17	40
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1ncnn1C	ZINC000819259820	CD	On-Demand	Anodyne	ADRB1	28	44
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1ncnn1C	ZINC000819259820	CD	On-Demand	Anodyne	ADRB3	42	44
C[C@H](NC[C@H](O)c1cccc(Cl)c1)c1ncnn1C	ZINC000819259822	CD	On-Demand	Anodyne	ADRB1	28	44
C[C@H](NC[C@H](O)c1cccc(Cl)c1)c1ncnn1C	ZINC000819259822	CD	On-Demand	Anodyne	ADRB3	42	44
O[C@H](CN[C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1)c1cccnc1	ZINC000819259839	FH	On-Demand	Anodyne	ADRB3	57	45
O[C@H](CN[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1)c1cccnc1	ZINC000819259841	FH	On-Demand	Anodyne	ADRB3	57	45
C=CC(=O)NCCNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819259842	DD	On-Demand	Anodyne	CRTM	35	42
O[C@@H](CN[C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1)c1cccnc1	ZINC000819259843	FH	On-Demand	Anodyne	ADRB3	57	45
O[C@@H](CN[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1)c1cccnc1	ZINC000819259846	FH	On-Demand	Anodyne	ADRB3	57	45
C=CC(=O)NCCNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819259847	CC	On-Demand	Anodyne	KCNK3	48	34
CC(=O)NCCCc1ccc(-c2csc(NC(=O)/C=C/[C@H]3CCCO3)n2)cc1	ZINC000819259863	GH	On-Demand	Anodyne	SPHK2	42	34
CC(=O)NCCCc1ccc(-c2csc(NC(=O)/C=C\[C@@H]3CCCO3)n2)cc1	ZINC000819259865	GH	On-Demand	Anodyne	SPHK2	42	34
CC(=O)NCCCc1ccc(-c2csc(NC(=O)/C=C\[C@H]3CCCO3)n2)cc1	ZINC000819259867	GH	On-Demand	Anodyne	SPHK2	42	34
CC(=O)NCCCc1ccc(-c2csc(NC(=O)/C=C/[C@@H]3CCCO3)n2)cc1	ZINC000819259869	GH	On-Demand	Anodyne	SPHK2	42	34
O[C@@H](CNCCOC(F)(F)F)c1ccc(Cl)c(F)c1	ZINC000819259880	DF	On-Demand	Anodyne	ADRB2	22	40
O[C@@H](CNCCOC(F)(F)F)c1ccc(Cl)c(F)c1	ZINC000819259880	DF	On-Demand	Anodyne	ADRB1	22	40
O[C@@H](CNCCOC(F)(F)F)c1ccc(Cl)c(F)c1	ZINC000819259880	DF	On-Demand	Anodyne	ADRB3	22	40
O[C@H](CNCCOC(F)(F)F)c1ccc(Cl)c(F)c1	ZINC000819259881	DF	On-Demand	Anodyne	ADRB2	22	40
O[C@H](CNCCOC(F)(F)F)c1ccc(Cl)c(F)c1	ZINC000819259881	DF	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CNCCOC(F)(F)F)c1ccc(Cl)c(F)c1	ZINC000819259881	DF	On-Demand	Anodyne	ADRB3	22	40
CCCOc1ccc(CNC[C@H](O)c2ccccc2)c(C)c1	ZINC000819259883	CH	On-Demand	Anodyne	ADRB1	30	53
CCCOc1ccc(CNC[C@H](O)c2ccccc2)c(C)c1	ZINC000819259883	CH	On-Demand	Anodyne	ADRB3	45	45
CCCOc1ccc(CNC[C@@H](O)c2ccccc2)c(C)c1	ZINC000819259885	CH	On-Demand	Anodyne	ADRB1	30	53
CCCOc1ccc(CNC[C@@H](O)c2ccccc2)c(C)c1	ZINC000819259885	CH	On-Demand	Anodyne	ADRB3	45	45
CON(C)C(=O)CCN[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1	ZINC000819259900	EF	On-Demand	Anodyne	CNR1	40	41
CON(C)C(=O)CCN[C@H]1CCN(c2ccc(Cl)cc2Cl)C1	ZINC000819259902	EF	On-Demand	Anodyne	CNR1	40	41
O[C@@H](CNCCOC(F)(F)F)c1cccc(Cl)c1	ZINC000819259913	CE	On-Demand	Anodyne	ADRB2	53	41
O[C@@H](CNCCOC(F)(F)F)c1cccc(Cl)c1	ZINC000819259913	CE	On-Demand	Anodyne	ADRB1	64	52
O[C@@H](CNCCOC(F)(F)F)c1cccc(Cl)c1	ZINC000819259913	CE	On-Demand	Anodyne	ADRB3	73	52
O[C@H](CNCCOC(F)(F)F)c1cccc(Cl)c1	ZINC000819259914	CE	On-Demand	Anodyne	ADRB2	53	41
O[C@H](CNCCOC(F)(F)F)c1cccc(Cl)c1	ZINC000819259914	CE	On-Demand	Anodyne	ADRB1	64	52
O[C@H](CNCCOC(F)(F)F)c1cccc(Cl)c1	ZINC000819259914	CE	On-Demand	Anodyne	ADRB3	73	52
C#CCNC(=O)CCN[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1	ZINC000819259952	FF	On-Demand	Mild	CNR1	52	32
C#CCNC(=O)CCN[C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1	ZINC000819259953	FF	On-Demand	Mild	CNR1	52	32
N#Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccc([N+](=O)[O-])cc3)C2=O)cc1	ZINC000819259954	GD	On-Demand	Mild	KCNJ1	18	43
N#Cc1ccc(CN2CC[C@H](NC[C@H](O)c3ccc([N+](=O)[O-])cc3)C2=O)cc1	ZINC000819259957	GD	On-Demand	Mild	KCNJ1	18	43
N#Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2=O)cc1	ZINC000819259960	GD	On-Demand	Mild	KCNJ1	18	43
N#Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2=O)cc1	ZINC000819259961	GD	On-Demand	Mild	KCNJ1	18	43
C=CC(=O)NCCNC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819259964	GE	On-Demand	Anodyne	CNR1	53	33
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2noc(-c3cccs3)n2)CC1	ZINC000819259974	FE	On-Demand	Anodyne	ETHR	48	43
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2noc(-c3cccs3)n2)CC1	ZINC000819259975	FE	On-Demand	Anodyne	ETHR	48	43
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2noc(-c3cccs3)n2)CC1	ZINC000819259976	FE	On-Demand	Anodyne	ETHR	48	43
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2noc(-c3cccs3)n2)CC1	ZINC000819259977	FE	On-Demand	Anodyne	ETHR	48	43
CCOC(=O)NC1CCC(NC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819260187	FG	On-Demand	Anodyne	CCR2	67	41
CCOC(=O)NC1CCC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819260188	FG	On-Demand	Anodyne	CCR2	67	41
CCNC(=O)C1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819260233	CD	On-Demand	Anodyne	ADRB2	23	42
CCNC(=O)C1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819260233	CD	On-Demand	Anodyne	ADRB1	25	43
CCNC(=O)C1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819260233	CD	On-Demand	Anodyne	ADRB3	98	45
CCNC(=O)C1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819260234	CD	On-Demand	Anodyne	ADRB2	23	42
CCNC(=O)C1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819260234	CD	On-Demand	Anodyne	ADRB1	25	43
CCNC(=O)C1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819260234	CD	On-Demand	Anodyne	ADRB3	98	45
O=C(/C=C/[C@H]1CCCO1)N1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000819260244	GD	On-Demand	Anodyne	DRD4	17	52
O=C(/C=C\[C@@H]1CCCO1)N1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000819260245	GD	On-Demand	Anodyne	DRD4	17	52
O=C(/C=C/[C@@H]1CCCO1)N1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000819260247	GD	On-Demand	Anodyne	DRD4	17	52
O=C(/C=C\[C@H]1CCCO1)N1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000819260249	GD	On-Demand	Anodyne	DRD4	17	52
O=C(COc1ccc2c(c1)CCC2)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819260297	EF	On-Demand	Anodyne	CPT2	42	36
O=C(COc1ccc2c(c1)CCC2)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819260300	EF	On-Demand	Anodyne	CPT2	42	36
O=C(COc1ccc2c(c1)CCC2)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819260303	EF	On-Demand	Anodyne	CPT2	42	36
O=C1[C@@H](NC[C@H](O)c2cccc3ccccc23)CCN1Cc1ccc(F)cc1	ZINC000819260304	GG	On-Demand	Anodyne	SIGMAR1	15	43
O=C(COc1ccc2c(c1)CCC2)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819260305	EF	On-Demand	Anodyne	CPT2	42	36
O=C1[C@H](NC[C@H](O)c2cccc3ccccc23)CCN1Cc1ccc(F)cc1	ZINC000819260306	GG	On-Demand	Anodyne	SIGMAR1	15	43
COC(=O)[C@H]1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000819260309	CE	On-Demand	Anodyne	SLC6A4	16	42
COC(=O)[C@H]1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000819260309	CE	On-Demand	Anodyne	SLC6A3	40	42
COC(=O)[C@H]1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000819260309	CE	On-Demand	Anodyne	ADRB3	24	48
COC(=O)[C@H]1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000819260311	CE	On-Demand	Anodyne	SLC6A4	16	42
COC(=O)[C@H]1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000819260311	CE	On-Demand	Anodyne	SLC6A3	40	42
COC(=O)[C@H]1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000819260311	CE	On-Demand	Anodyne	ADRB3	24	48
COC(=O)[C@H]1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819260316	CE	On-Demand	Anodyne	SLC6A4	16	42
COC(=O)[C@H]1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819260316	CE	On-Demand	Anodyne	SLC6A3	40	42
COC(=O)[C@H]1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819260316	CE	On-Demand	Anodyne	ADRB3	24	48
COC(=O)[C@H]1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819260319	CE	On-Demand	Anodyne	SLC6A4	16	42
COC(=O)[C@H]1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819260319	CE	On-Demand	Anodyne	SLC6A3	40	42
COC(=O)[C@H]1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819260319	CE	On-Demand	Anodyne	ADRB3	24	48
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819260334	IH	On-Demand	Anodyne	FKBP1A	29	42
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819260334	IH	On-Demand	Anodyne	PREP	28	41
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819260334	IH	On-Demand	Anodyne	WNT3	52	39
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819260335	IH	On-Demand	Anodyne	FKBP1A	29	42
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819260335	IH	On-Demand	Anodyne	PREP	28	41
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819260335	IH	On-Demand	Anodyne	WNT3	52	39
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819260340	GG	On-Demand	Anodyne	CELA1	19	43
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819260340	GG	On-Demand	Anodyne	PREP	75	50
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819260340	GG	On-Demand	Anodyne	SLC12A5	61	39
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819260341	GG	On-Demand	Anodyne	CELA1	19	43
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819260341	GG	On-Demand	Anodyne	PREP	75	50
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819260341	GG	On-Demand	Anodyne	SLC12A5	61	39
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819260342	GG	On-Demand	Anodyne	CELA1	19	43
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819260342	GG	On-Demand	Anodyne	PREP	75	50
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819260342	GG	On-Demand	Anodyne	SLC12A5	61	39
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819260343	GG	On-Demand	Anodyne	CELA1	19	43
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819260343	GG	On-Demand	Anodyne	PREP	75	50
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819260343	GG	On-Demand	Anodyne	SLC12A5	61	39
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260405	GH	On-Demand	Anodyne	DRD4	31	44
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260405	GH	On-Demand	Anodyne	KCNH2	15	42
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260405	GH	On-Demand	Anodyne	SIGMAR1	32	57
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260405	GH	On-Demand	Anodyne	SSTR5	71	44
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260405	GH	On-Demand	Anodyne	CCR3	46	47
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260405	GH	On-Demand	Anodyne	UTS2R	22	44
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260405	GH	On-Demand	Anodyne	PDK1	49	38
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260405	GH	On-Demand	Anodyne	MCHR1	54	54
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260405	GH	On-Demand	Anodyne	CACNA1G	17	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260406	GH	On-Demand	Anodyne	DRD4	31	44
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260406	GH	On-Demand	Anodyne	KCNH2	15	42
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260406	GH	On-Demand	Anodyne	SIGMAR1	32	57
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260406	GH	On-Demand	Anodyne	SSTR5	71	44
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260406	GH	On-Demand	Anodyne	CCR3	46	47
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260406	GH	On-Demand	Anodyne	UTS2R	22	44
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260406	GH	On-Demand	Anodyne	PDK1	49	38
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260406	GH	On-Demand	Anodyne	MCHR1	54	54
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260406	GH	On-Demand	Anodyne	CACNA1G	17	41
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260407	GH	On-Demand	Anodyne	DRD4	31	44
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260407	GH	On-Demand	Anodyne	KCNH2	15	42
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260407	GH	On-Demand	Anodyne	SIGMAR1	32	57
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260407	GH	On-Demand	Anodyne	SSTR5	71	44
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260407	GH	On-Demand	Anodyne	CCR3	46	47
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260407	GH	On-Demand	Anodyne	UTS2R	22	44
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260407	GH	On-Demand	Anodyne	PDK1	49	38
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260407	GH	On-Demand	Anodyne	MCHR1	54	54
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260407	GH	On-Demand	Anodyne	CACNA1G	17	41
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260408	GH	On-Demand	Anodyne	DRD4	31	44
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260408	GH	On-Demand	Anodyne	KCNH2	15	42
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260408	GH	On-Demand	Anodyne	SIGMAR1	32	57
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260408	GH	On-Demand	Anodyne	SSTR5	71	44
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260408	GH	On-Demand	Anodyne	CCR3	46	47
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260408	GH	On-Demand	Anodyne	UTS2R	22	44
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260408	GH	On-Demand	Anodyne	PDK1	49	38
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260408	GH	On-Demand	Anodyne	MCHR1	54	54
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819260408	GH	On-Demand	Anodyne	CACNA1G	17	41
CCOC(=O)NC1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819260409	EG	On-Demand	Anodyne	ADRB3	24	46
CCOC(=O)NC1CCC(NC[C@@H](O)c2ccc(Cl)cc2)CC1	ZINC000819260410	EG	On-Demand	Anodyne	ADRB3	24	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNC(=O)Cc1ccccc1F	ZINC000819260416	FD	On-Demand	Reactive	PAPA1_CARPA	25	44
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccc(Cl)cc3)C2=O)cc1	ZINC000819260464	FG	On-Demand	Anodyne	ADRB3	17	42
CCNC(=O)C1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CCC1	ZINC000819260497	DD	On-Demand	Bother	CACNA1D	59	32
CCNC(=O)C1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCC1	ZINC000819260498	DD	On-Demand	Bother	CACNA1D	59	32
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccc(F)cc3)C2=O)cc1	ZINC000819260515	EF	On-Demand	Anodyne	SLC6A3	17	41
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccc(F)cc3)C2=O)cc1	ZINC000819260517	EF	On-Demand	Anodyne	SLC6A3	17	41
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccc(F)cc3)C2=O)cc1	ZINC000819260519	EF	On-Demand	Anodyne	SLC6A3	17	41
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccc3)C2=O)cc1	ZINC000819260521	DE	On-Demand	Anodyne	ADRB3	53	39
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccccc3)C2=O)cc1	ZINC000819260521	DE	On-Demand	Anodyne	BIRC8	54	31
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccccc3)C2=O)cc1	ZINC000819260524	DE	On-Demand	Anodyne	ADRB3	53	39
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccccc3)C2=O)cc1	ZINC000819260524	DE	On-Demand	Anodyne	BIRC8	54	31
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3)C2=O)cc1	ZINC000819260526	DE	On-Demand	Anodyne	ADRB3	53	39
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccccc3)C2=O)cc1	ZINC000819260526	DE	On-Demand	Anodyne	BIRC8	54	31
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1nnnn1C1CC1	ZINC000819260655	GD	On-Demand	Anodyne	GPR119	28	45
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1nnnn1C1CC1	ZINC000819260659	GD	On-Demand	Anodyne	GPR119	28	45
N#Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260696	FF	On-Demand	Mild	ADRB3	44	41
N#Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260696	FF	On-Demand	Mild	CYP3A4	48	36
N#Cc1ccc(CN2CC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260697	FF	On-Demand	Mild	ADRB3	44	41
N#Cc1ccc(CN2CC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260697	FF	On-Demand	Mild	CYP3A4	48	36
N#Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260699	FF	On-Demand	Mild	ADRB3	44	41
N#Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260699	FF	On-Demand	Mild	CYP3A4	48	36
N#Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260701	FF	On-Demand	Mild	ADRB3	44	41
N#Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260701	FF	On-Demand	Mild	CYP3A4	48	36
CCOC(=O)NC1CCC(NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819260703	GE	On-Demand	Bother	SLC27A4	51	33
O=C1[C@H](NC[C@H](O)c2ccccc2Cl)CCN1Cc1ccc(F)cc1	ZINC000819260730	FF	On-Demand	Anodyne	OPRL1	31	43
O=C1[C@@H](NC[C@H](O)c2ccccc2Cl)CCN1Cc1ccc(F)cc1	ZINC000819260731	FF	On-Demand	Anodyne	OPRL1	31	43
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1Cc1ccc(F)cc1	ZINC000819260732	ED	On-Demand	Anodyne	ADRB1	21	40
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1Cc1ccc(F)cc1	ZINC000819260732	ED	On-Demand	Anodyne	ADRB3	86	42
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1Cc1ccc(F)cc1	ZINC000819260733	ED	On-Demand	Anodyne	ADRB1	21	40
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1Cc1ccc(F)cc1	ZINC000819260733	ED	On-Demand	Anodyne	ADRB3	86	42
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1Cc1ccc(F)cc1	ZINC000819260734	ED	On-Demand	Anodyne	ADRB1	21	40
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1Cc1ccc(F)cc1	ZINC000819260734	ED	On-Demand	Anodyne	ADRB3	86	42
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1Cc1ccc(F)cc1	ZINC000819260735	ED	On-Demand	Anodyne	ADRB1	21	40
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1Cc1ccc(F)cc1	ZINC000819260735	ED	On-Demand	Anodyne	ADRB3	86	42
CCC(=O)c1cc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)ccc1F	ZINC000819260796	FJ	On-Demand	Anodyne	ECR	40	34
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819260839	HF	On-Demand	Anodyne	PREP	26	40
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819260839	HF	On-Demand	Anodyne	SLC12A5	62	36
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819260840	HF	On-Demand	Anodyne	PREP	26	40
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819260840	HF	On-Demand	Anodyne	SLC12A5	62	36
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819260841	HF	On-Demand	Anodyne	PREP	26	40
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819260841	HF	On-Demand	Anodyne	SLC12A5	62	36
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819260842	HF	On-Demand	Anodyne	PREP	26	40
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819260842	HF	On-Demand	Anodyne	SLC12A5	62	36
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3ccc(C)cc3)C2=O)cc1	ZINC000819260899	EF	On-Demand	Anodyne	ADRB3	15	41
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3ccc(C)cc3)C2=O)cc1	ZINC000819260900	EF	On-Demand	Anodyne	ADRB3	15	41
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3ccc(C)cc3)C2=O)cc1	ZINC000819260901	EF	On-Demand	Anodyne	ADRB3	15	41
CCOC(=O)NC1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819260904	DE	On-Demand	Anodyne	CHRM1	15	42
CCOC(=O)NC1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819260904	DE	On-Demand	Anodyne	SLC6A3	17	51
CCOC(=O)NC1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819260904	DE	On-Demand	Anodyne	ADRB3	44	40
CCOC(=O)NC1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819260904	DE	On-Demand	Anodyne	XIAP	32	40
CCOC(=O)NC1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819260904	DE	On-Demand	Anodyne	ACHP_LYMST	18	41
CCOC(=O)NC1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819260904	DE	On-Demand	Anodyne	Q8WSF8_APLCA	41	41
CCOC(=O)NC1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819260905	DE	On-Demand	Anodyne	CHRM1	15	42
CCOC(=O)NC1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819260905	DE	On-Demand	Anodyne	SLC6A3	17	51
CCOC(=O)NC1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819260905	DE	On-Demand	Anodyne	ADRB3	44	40
CCOC(=O)NC1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819260905	DE	On-Demand	Anodyne	XIAP	32	40
CCOC(=O)NC1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819260905	DE	On-Demand	Anodyne	ACHP_LYMST	18	41
CCOC(=O)NC1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819260905	DE	On-Demand	Anodyne	Q8WSF8_APLCA	41	41
CCOC(=O)NC1CCC(NC[C@@H](O)c2ccccc2Cl)CC1	ZINC000819260911	EG	On-Demand	Anodyne	OPRL1	32	41
CCOC(=O)NC1CCC(NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819260912	EG	On-Demand	Anodyne	OPRL1	32	41
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CSC(=S)N1CCCC1	ZINC000819260917	IJ	On-Demand	Anodyne	OPRK1	17	41
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CSC(=S)N1CCCC1	ZINC000819260917	IJ	On-Demand	Anodyne	NPY2R	45	35
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CSC(=S)N1CCCC1	ZINC000819260917	IJ	On-Demand	Anodyne	PRNP	51	35
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CSC(=S)N1CCCC1	ZINC000819260917	IJ	On-Demand	Anodyne	TAAR1	33	40
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CSC(=S)N1CCCC1	ZINC000819260917	IJ	On-Demand	Anodyne	KCNK3	102	42
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)CSC(=S)N1CCCC1	ZINC000819260917	IJ	On-Demand	Anodyne	KCNK9	55	38
CCN(C(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2)[C@@H](C)Cc1ccc(OC)cc1	ZINC000819260924	GG	On-Demand	Anodyne	PSMB8	45	32
CCN(C(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2)[C@H](C)Cc1ccc(OC)cc1	ZINC000819260926	GG	On-Demand	Anodyne	PSMB8	45	32
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260945	FG	On-Demand	Anodyne	ADRB1	42	45
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260945	FG	On-Demand	Anodyne	ADRB3	62	45
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260945	FG	On-Demand	Anodyne	IGF1R	30	40
Cc1ccc(CN2CC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260945	FG	On-Demand	Anodyne	CYP3A4	51	39
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260947	FG	On-Demand	Anodyne	ADRB1	42	45
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260947	FG	On-Demand	Anodyne	ADRB3	62	45
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260947	FG	On-Demand	Anodyne	IGF1R	30	40
Cc1ccc(CN2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260947	FG	On-Demand	Anodyne	CYP3A4	51	39
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260948	FG	On-Demand	Anodyne	ADRB1	42	45
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260948	FG	On-Demand	Anodyne	ADRB3	62	45
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260948	FG	On-Demand	Anodyne	IGF1R	30	40
Cc1ccc(CN2CC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2=O)cc1	ZINC000819260948	FG	On-Demand	Anodyne	CYP3A4	51	39
C#CCNS(=O)(=O)c1cccc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1	ZINC000819260963	HF	On-Demand	Mild	AKR1C3	15	42
O=C(C(F)=C1CCC1)N1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000819261029	FF	On-Demand	Anodyne	DRD4	18	58
O=C1[C@H](NC[C@H](O)c2ccc(F)cc2)CCN1Cc1ccc(F)cc1	ZINC000819261053	EE	On-Demand	Anodyne	SLC6A3	26	40
O=C1[C@H](NC[C@@H](O)c2ccc(F)cc2)CCN1Cc1ccc(F)cc1	ZINC000819261054	EE	On-Demand	Anodyne	SLC6A3	26	40
O=C1[C@@H](NC[C@H](O)c2ccc(F)cc2)CCN1Cc1ccc(F)cc1	ZINC000819261056	EE	On-Demand	Anodyne	SLC6A3	26	40
O=C1[C@@H](NC[C@@H](O)c2ccc(F)cc2)CCN1Cc1ccc(F)cc1	ZINC000819261057	EE	On-Demand	Anodyne	SLC6A3	26	40
O=C1[C@H](NC[C@H](O)c2ccccc2)CCN1Cc1ccc(F)cc1	ZINC000819261065	EE	On-Demand	Anodyne	SLC6A3	36	47
O=C1[C@H](NC[C@H](O)c2ccccc2)CCN1Cc1ccc(F)cc1	ZINC000819261065	EE	On-Demand	Anodyne	SIGMAR1	21	46
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCN1Cc1ccc(F)cc1	ZINC000819261067	EE	On-Demand	Anodyne	SLC6A3	36	47
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCN1Cc1ccc(F)cc1	ZINC000819261067	EE	On-Demand	Anodyne	SIGMAR1	21	46
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCN1Cc1ccc(F)cc1	ZINC000819261069	EE	On-Demand	Anodyne	SLC6A3	36	47
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCN1Cc1ccc(F)cc1	ZINC000819261069	EE	On-Demand	Anodyne	SIGMAR1	21	46
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCN1Cc1ccc(F)cc1	ZINC000819261070	EE	On-Demand	Anodyne	SLC6A3	36	47
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCN1Cc1ccc(F)cc1	ZINC000819261070	EE	On-Demand	Anodyne	SIGMAR1	21	46
CCNC(=O)C1(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCC1	ZINC000819261114	GD	On-Demand	Anodyne	GPR119	24	42
CCNC(=O)C1(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCC1	ZINC000819261115	GD	On-Demand	Anodyne	GPR119	24	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(NC(=O)C2CC2)nc1	ZINC000819261116	FE	On-Demand	Anodyne	TYK2	46	32
O=C(C(F)=C1CCC1)N1CCN(Cc2noc(-c3cccs3)n2)CC1	ZINC000819261133	FF	On-Demand	Anodyne	ETHR	35	41
CCOC(=O)NC1CCC(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819261134	GG	On-Demand	Anodyne	EPHX2	44	43
CCOC(=O)NC1CCC(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819261135	GG	On-Demand	Anodyne	EPHX2	44	43
CC(C)(C(=O)NNC(=O)CCc1cccc(OC(F)F)c1)c1ccccc1	ZINC000819261174	GG	On-Demand	Reactive	PLA2G4A	26	40
CC(C)(C(=O)NNC(=O)CCc1cccc(OC(F)F)c1)c1ccccc1	ZINC000819261174	GG	On-Demand	Reactive	CRTM	41	38
CC(C)(C(=O)NNC(=O)CCc1cccc(OC(F)F)c1)c1ccccc1	ZINC000819261174	GG	On-Demand	Reactive	PDS	54	35
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1ccc(OC(F)(F)F)cc1)CC2	ZINC000819261177	GH	On-Demand	Anodyne	ADRB3	21	41
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1ccc(OC(F)(F)F)cc1)CC2	ZINC000819261180	GH	On-Demand	Anodyne	ADRB3	21	41
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1ccc(OC(F)(F)F)cc1)CC2	ZINC000819261183	GH	On-Demand	Anodyne	ADRB3	21	41
Cc1ccc(OC[C@@H](O)CN[C@@H](C)CNC(=O)OC(C)(C)C)c(C)c1	ZINC000819261184	FF	On-Demand	Anodyne	ADRB2	30	55
Cc1ccc(OC[C@@H](O)CN[C@@H](C)CNC(=O)OC(C)(C)C)c(C)c1	ZINC000819261184	FF	On-Demand	Anodyne	ADRB1	27	43
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1ccc(OC(F)(F)F)cc1)CC2	ZINC000819261185	GH	On-Demand	Anodyne	ADRB3	21	41
Cc1ccc(OC[C@H](O)CN[C@@H](C)CNC(=O)OC(C)(C)C)c(C)c1	ZINC000819261186	FF	On-Demand	Anodyne	ADRB2	30	55
Cc1ccc(OC[C@H](O)CN[C@@H](C)CNC(=O)OC(C)(C)C)c(C)c1	ZINC000819261186	FF	On-Demand	Anodyne	ADRB1	27	43
C=CCC1(C(=O)Nc2cccc(SC(=O)N(C)C)c2)CCOCC1	ZINC000819261202	EH	On-Demand	Mild	LIMK2	22	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc2ccccc12	ZINC000819261205	EG	On-Demand	Anodyne	FPR1	43	34
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCc2ccc(C3CC3)cc2)CC1	ZINC000819261211	FH	On-Demand	Anodyne	GPR119	39	45
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCc2ccc(C3CC3)cc2)CC1	ZINC000819261215	FH	On-Demand	Anodyne	GPR119	39	45
CCN(CC(=O)OC(C)(C)C)C1CC(NC[C@H](O)c2cccnc2)C1	ZINC000819261227	ED	On-Demand	Anodyne	ADRB3	52	45
CCN(CC(=O)OC(C)(C)C)C1CC(NC[C@@H](O)c2cccnc2)C1	ZINC000819261228	ED	On-Demand	Anodyne	ADRB3	52	45
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1ccc(Cl)cc1Cl)CC2	ZINC000819261281	FH	On-Demand	Anodyne	ADRB3	20	40
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1ccc(Cl)cc1Cl)CC2	ZINC000819261284	FH	On-Demand	Anodyne	ADRB3	20	40
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1ccc(Cl)cc1Cl)CC2	ZINC000819261287	FH	On-Demand	Anodyne	ADRB3	20	40
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1ccc(Cl)cc1Cl)CC2	ZINC000819261289	FH	On-Demand	Anodyne	ADRB3	20	40
Cn1nccc1N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1=O	ZINC000819261304	GF	On-Demand	Anodyne	P2RX7	15	43
Cn1nccc1N1CCC[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1=O	ZINC000819261306	GF	On-Demand	Anodyne	P2RX7	15	43
O[C@@H](CNCC1(c2cccc(F)c2F)CCCC1)c1cccnc1	ZINC000819261307	EG	On-Demand	Anodyne	ADRB2	19	41
O[C@@H](CNCC1(c2cccc(F)c2F)CCCC1)c1cccnc1	ZINC000819261307	EG	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CNCC1(c2cccc(F)c2F)CCCC1)c1cccnc1	ZINC000819261307	EG	On-Demand	Anodyne	ADRB3	81	41
O[C@H](CNCC1(c2cccc(F)c2F)CCCC1)c1cccnc1	ZINC000819261308	EG	On-Demand	Anodyne	ADRB2	19	41
O[C@H](CNCC1(c2cccc(F)c2F)CCCC1)c1cccnc1	ZINC000819261308	EG	On-Demand	Anodyne	ADRB1	20	40
O[C@H](CNCC1(c2cccc(F)c2F)CCCC1)c1cccnc1	ZINC000819261308	EG	On-Demand	Anodyne	ADRB3	81	41
Cn1nccc1N1CCC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1=O	ZINC000819261309	GF	On-Demand	Anodyne	P2RX7	15	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccccc1	ZINC000819261310	DD	On-Demand	Anodyne	ADRB2	66	63
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccccc1	ZINC000819261310	DD	On-Demand	Anodyne	ADRB1	87	49
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccccc1	ZINC000819261310	DD	On-Demand	Anodyne	ADRB3	49	48
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccccc1	ZINC000819261310	DD	On-Demand	Anodyne	CASR	38	46
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccccc1	ZINC000819261310	DD	On-Demand	Anodyne	CYP2D6	16	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccccc1	ZINC000819261310	DD	On-Demand	Anodyne	ABCB1	26	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccccc1	ZINC000819261310	DD	On-Demand	Anodyne	FPR1	40	35
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccccc1	ZINC000819261310	DD	On-Demand	Anodyne	PDS	72	40
Cn1nccc1N1CCC[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1=O	ZINC000819261311	GF	On-Demand	Anodyne	P2RX7	15	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccccc1	ZINC000819261312	DD	On-Demand	Anodyne	ADRB2	66	63
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccccc1	ZINC000819261312	DD	On-Demand	Anodyne	ADRB1	87	49
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccccc1	ZINC000819261312	DD	On-Demand	Anodyne	ADRB3	49	48
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccccc1	ZINC000819261312	DD	On-Demand	Anodyne	CASR	38	46
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccccc1	ZINC000819261312	DD	On-Demand	Anodyne	CYP2D6	16	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccccc1	ZINC000819261312	DD	On-Demand	Anodyne	ABCB1	26	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccccc1	ZINC000819261312	DD	On-Demand	Anodyne	FPR1	40	35
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccccc1	ZINC000819261312	DD	On-Demand	Anodyne	PDS	72	40
CC(=O)Nc1cccc(CC(=O)NCC[S@@](=O)Cc2ccccc2)c1	ZINC000819261322	FE	On-Demand	Anodyne	KCNK3	59	35
CC(=O)Nc1cccc(CC(=O)NCC[S@](=O)Cc2ccccc2)c1	ZINC000819261323	FE	On-Demand	Anodyne	KCNK3	59	35
Cc1cc(-c2csc(NC(=O)/C=C/[C@H]3CCCO3)n2)c(C)o1	ZINC000819261328	DH	On-Demand	Anodyne	UL26	55	31
Cc1cc(-c2csc(NC(=O)/C=C/[C@H]3CCCO3)n2)c(C)o1	ZINC000819261328	DH	On-Demand	Anodyne	SCAF_EBVB9	47	30
Cc1cc(-c2csc(NC(=O)/C=C\[C@@H]3CCCO3)n2)c(C)o1	ZINC000819261329	DH	On-Demand	Anodyne	UL26	55	31
Cc1cc(-c2csc(NC(=O)/C=C\[C@@H]3CCCO3)n2)c(C)o1	ZINC000819261329	DH	On-Demand	Anodyne	SCAF_EBVB9	47	30
Cc1cc(-c2csc(NC(=O)/C=C\[C@H]3CCCO3)n2)c(C)o1	ZINC000819261330	DH	On-Demand	Anodyne	UL26	55	31
Cc1cc(-c2csc(NC(=O)/C=C\[C@H]3CCCO3)n2)c(C)o1	ZINC000819261330	DH	On-Demand	Anodyne	SCAF_EBVB9	47	30
Cc1cc(-c2csc(NC(=O)/C=C/[C@@H]3CCCO3)n2)c(C)o1	ZINC000819261331	DH	On-Demand	Anodyne	UL26	55	31
Cc1cc(-c2csc(NC(=O)/C=C/[C@@H]3CCCO3)n2)c(C)o1	ZINC000819261331	DH	On-Demand	Anodyne	SCAF_EBVB9	47	30
Cn1nccc1N1CCC[C@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000819261455	DC	On-Demand	Anodyne	ADRB3	62	41
Cn1nccc1N1CCC[C@@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000819261456	DC	On-Demand	Anodyne	ADRB3	62	41
Cn1nccc1N1CCC[C@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000819261457	DC	On-Demand	Anodyne	ADRB3	62	41
Cn1nccc1N1CCC[C@@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000819261458	DC	On-Demand	Anodyne	ADRB3	62	41
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)CC2	ZINC000819261475	EF	On-Demand	Bother	ADRB3	19	43
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)CC2	ZINC000819261476	EF	On-Demand	Bother	ADRB3	19	43
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)CC2	ZINC000819261477	EF	On-Demand	Bother	ADRB3	19	43
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)CC2	ZINC000819261478	EF	On-Demand	Bother	ADRB3	19	43
Cc1ccccc1[C@@H](O)CNCc1cccc([N+](=O)[O-])c1C	ZINC000819261508	DG	On-Demand	Bother	COLA	105	36
Cn1nccc1N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819261526	ED	On-Demand	Anodyne	ADRB3	40	40
Cn1nccc1N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819261526	ED	On-Demand	Anodyne	CYP3A4	50	37
Cn1nccc1N1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819261527	ED	On-Demand	Anodyne	ADRB3	40	40
Cn1nccc1N1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819261527	ED	On-Demand	Anodyne	CYP3A4	50	37
Cn1nccc1N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819261528	ED	On-Demand	Anodyne	ADRB3	40	40
Cn1nccc1N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819261528	ED	On-Demand	Anodyne	CYP3A4	50	37
Cn1nccc1N1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819261529	ED	On-Demand	Anodyne	ADRB3	40	40
Cn1nccc1N1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819261529	ED	On-Demand	Anodyne	CYP3A4	50	37
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819261554	FD	On-Demand	Anodyne	NOD2	42	35
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819261555	FD	On-Demand	Anodyne	NOD2	42	35
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819261563	FG	On-Demand	Anodyne	ADRB2	43	35
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819261563	FG	On-Demand	Anodyne	ADRB1	32	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819261563	FG	On-Demand	Anodyne	ADRB3	51	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819261563	FG	On-Demand	Anodyne	PDS	42	38
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819261564	FG	On-Demand	Anodyne	ADRB2	43	35
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819261564	FG	On-Demand	Anodyne	ADRB1	32	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819261564	FG	On-Demand	Anodyne	ADRB3	51	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819261564	FG	On-Demand	Anodyne	PDS	42	38
C[C@@H](CCCC(F)(F)F)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819261586	DG	On-Demand	Bother	ADRB2	17	40
C[C@@H](CCCC(F)(F)F)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819261587	DG	On-Demand	Bother	ADRB2	17	40
C[C@@H](CNC(=O)OC(C)(C)C)NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819261590	GH	On-Demand	Anodyne	PDS	41	38
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819261605	FH	On-Demand	Anodyne	ADRB1	15	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819261605	FH	On-Demand	Anodyne	ADRB3	25	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819261606	FH	On-Demand	Anodyne	ADRB1	15	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819261606	FH	On-Demand	Anodyne	ADRB3	25	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000819261611	GG	On-Demand	Anodyne	ADRB2	30	45
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000819261611	GG	On-Demand	Anodyne	ADRB1	28	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000819261612	GG	On-Demand	Anodyne	ADRB2	30	45
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000819261612	GG	On-Demand	Anodyne	ADRB1	28	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C)C2	ZINC000819261620	GD	On-Demand	Anodyne	OPRM1	27	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C)C2	ZINC000819261620	GD	On-Demand	Anodyne	TACR1	28	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C)C2	ZINC000819261620	GD	On-Demand	Anodyne	TIMP3	50	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)C)C2	ZINC000819261621	GD	On-Demand	Anodyne	OPRM1	27	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)C)C2	ZINC000819261621	GD	On-Demand	Anodyne	TACR1	28	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)C)C2	ZINC000819261621	GD	On-Demand	Anodyne	TIMP3	50	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C)C2	ZINC000819261622	GD	On-Demand	Anodyne	OPRM1	27	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C)C2	ZINC000819261622	GD	On-Demand	Anodyne	TACR1	28	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(=O)N(C)C)C2	ZINC000819261622	GD	On-Demand	Anodyne	TIMP3	50	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)C)C2	ZINC000819261623	GD	On-Demand	Anodyne	OPRM1	27	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)C)C2	ZINC000819261623	GD	On-Demand	Anodyne	TACR1	28	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N(C)C)C2	ZINC000819261623	GD	On-Demand	Anodyne	TIMP3	50	33
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1c(F)cccc1F	ZINC000819261633	EF	On-Demand	Anodyne	PAPA1_CARPA	27	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1c(F)cccc1F	ZINC000819261634	EF	On-Demand	Anodyne	PAPA1_CARPA	27	40
CC(C)(C)OC(=O)N1CC[C@@H](CCC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819261651	HJ	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CC[C@H](CCC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C1	ZINC000819261652	HJ	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1)Cc1ccccc1	ZINC000819261653	HH	On-Demand	Anodyne	CELA1	17	40
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1)Cc1ccccc1	ZINC000819261653	HH	On-Demand	Anodyne	PGC	54	35
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1)Cc1ccccc1	ZINC000819261653	HH	On-Demand	Anodyne	CMA1	30	40
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1)Cc1ccccc1	ZINC000819261653	HH	On-Demand	Anodyne	CTRA_BOVIN	20	40
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1)Cc1ccccc1	ZINC000819261653	HH	On-Demand	Anodyne	REN	70	41
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1)Cc1ccccc1	ZINC000819261653	HH	On-Demand	Anodyne	FPR1	47	40
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1)Cc1ccccc1	ZINC000819261654	HH	On-Demand	Anodyne	CELA1	17	40
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1)Cc1ccccc1	ZINC000819261654	HH	On-Demand	Anodyne	PGC	54	35
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1)Cc1ccccc1	ZINC000819261654	HH	On-Demand	Anodyne	CMA1	30	40
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1)Cc1ccccc1	ZINC000819261654	HH	On-Demand	Anodyne	CTRA_BOVIN	20	40
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1)Cc1ccccc1	ZINC000819261654	HH	On-Demand	Anodyne	REN	70	41
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1)Cc1ccccc1	ZINC000819261654	HH	On-Demand	Anodyne	FPR1	47	40
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1)Cc1ccccc1	ZINC000819261655	HH	On-Demand	Anodyne	CELA1	17	40
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1)Cc1ccccc1	ZINC000819261655	HH	On-Demand	Anodyne	PGC	54	35
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1)Cc1ccccc1	ZINC000819261655	HH	On-Demand	Anodyne	CMA1	30	40
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1)Cc1ccccc1	ZINC000819261655	HH	On-Demand	Anodyne	CTRA_BOVIN	20	40
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1)Cc1ccccc1	ZINC000819261655	HH	On-Demand	Anodyne	REN	70	41
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1)Cc1ccccc1	ZINC000819261655	HH	On-Demand	Anodyne	FPR1	47	40
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1)Cc1ccccc1	ZINC000819261656	HH	On-Demand	Anodyne	CELA1	17	40
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1)Cc1ccccc1	ZINC000819261656	HH	On-Demand	Anodyne	PGC	54	35
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1)Cc1ccccc1	ZINC000819261656	HH	On-Demand	Anodyne	CMA1	30	40
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1)Cc1ccccc1	ZINC000819261656	HH	On-Demand	Anodyne	CTRA_BOVIN	20	40
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1)Cc1ccccc1	ZINC000819261656	HH	On-Demand	Anodyne	REN	70	41
CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1)Cc1ccccc1	ZINC000819261656	HH	On-Demand	Anodyne	FPR1	47	40
CC(C)(C)OC(=O)N1[C@H](C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)C[C@H]2C[C@H]21	ZINC000819261715	GI	On-Demand	Anodyne	CFD	30	40
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)CC2	ZINC000819261733	GE	On-Demand	Anodyne	ADRB3	23	42
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)CC2	ZINC000819261734	GE	On-Demand	Anodyne	ADRB3	23	42
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)CC2	ZINC000819261735	GE	On-Demand	Anodyne	ADRB3	23	42
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)CC2	ZINC000819261736	GE	On-Demand	Anodyne	ADRB3	23	42
O=C(NCCN1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261788	GD	On-Demand	Anodyne	HTR1A	18	41
O=C(NCCN1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261788	GD	On-Demand	Anodyne	DRD2	16	41
O=C(NCCN1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261788	GD	On-Demand	Anodyne	DRD4	41	32
O=C(NCCN1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261788	GD	On-Demand	Anodyne	SLC6A1	51	40
O=C(NCCN1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261788	GD	On-Demand	Anodyne	PLD1	57	36
O=C(NCCN1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261788	GD	On-Demand	Anodyne	PLD2	74	36
O=C(NCCN1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261789	GD	On-Demand	Anodyne	HTR1A	18	41
O=C(NCCN1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261789	GD	On-Demand	Anodyne	DRD2	16	41
O=C(NCCN1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261789	GD	On-Demand	Anodyne	DRD4	41	32
O=C(NCCN1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261789	GD	On-Demand	Anodyne	SLC6A1	51	40
O=C(NCCN1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261789	GD	On-Demand	Anodyne	PLD1	57	36
O=C(NCCN1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261789	GD	On-Demand	Anodyne	PLD2	74	36
O=C(NCCN1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261790	GD	On-Demand	Anodyne	HTR1A	18	41
O=C(NCCN1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261790	GD	On-Demand	Anodyne	DRD2	16	41
O=C(NCCN1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261790	GD	On-Demand	Anodyne	DRD4	41	32
O=C(NCCN1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261790	GD	On-Demand	Anodyne	SLC6A1	51	40
O=C(NCCN1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261790	GD	On-Demand	Anodyne	PLD1	57	36
O=C(NCCN1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261790	GD	On-Demand	Anodyne	PLD2	74	36
O=C(NCCN1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261791	GD	On-Demand	Anodyne	HTR1A	18	41
O=C(NCCN1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261791	GD	On-Demand	Anodyne	DRD2	16	41
O=C(NCCN1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261791	GD	On-Demand	Anodyne	DRD4	41	32
O=C(NCCN1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261791	GD	On-Demand	Anodyne	SLC6A1	51	40
O=C(NCCN1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261791	GD	On-Demand	Anodyne	PLD1	57	36
O=C(NCCN1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1)c1ccccc1F	ZINC000819261791	GD	On-Demand	Anodyne	PLD2	74	36
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1ccccc1)CC2	ZINC000819261812	CF	On-Demand	Anodyne	ADRB3	24	44
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1ccccc1)CC2	ZINC000819261813	CF	On-Demand	Anodyne	ADRB3	24	44
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1ccccc1)CC2	ZINC000819261814	CF	On-Demand	Anodyne	ADRB3	24	44
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1ccccc1)CC2	ZINC000819261815	CF	On-Demand	Anodyne	ADRB3	24	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819261856	GD	On-Demand	Anodyne	ADRB2	22	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819261856	GD	On-Demand	Anodyne	ADRB1	27	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819261857	GD	On-Demand	Anodyne	ADRB2	22	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819261857	GD	On-Demand	Anodyne	ADRB1	27	41
C[C@@H](CNC(=O)OC(C)(C)C)NCCC(=O)Nc1ccccc1F	ZINC000819261868	EF	On-Demand	Anodyne	PAPA1_CARPA	22	40
CCn1c(S)nnc1CCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819261883	FD	On-Demand	Anodyne	MTNR1A	43	39
CCn1c(S)nnc1CCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819261884	FD	On-Demand	Anodyne	MTNR1A	43	39
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819261905	GG	On-Demand	Anodyne	ADRB2	34	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819261905	GG	On-Demand	Anodyne	ADRB1	35	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819261906	GG	On-Demand	Anodyne	ADRB2	34	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819261906	GG	On-Demand	Anodyne	ADRB1	35	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819261911	EF	On-Demand	Anodyne	ADRB2	50	35
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819261911	EF	On-Demand	Anodyne	ADRB1	17	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819261912	EF	On-Demand	Anodyne	ADRB2	50	35
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819261912	EF	On-Demand	Anodyne	ADRB1	17	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(Br)c1	ZINC000819261938	FF	On-Demand	Anodyne	ADRB2	50	36
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(Br)c1	ZINC000819261938	FF	On-Demand	Anodyne	ADRB1	38	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(Br)c1	ZINC000819261938	FF	On-Demand	Anodyne	ADRB3	58	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(Br)c1	ZINC000819261938	FF	On-Demand	Anodyne	PAPA1_CARPA	25	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(Br)c1	ZINC000819261939	FF	On-Demand	Anodyne	ADRB2	50	36
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(Br)c1	ZINC000819261939	FF	On-Demand	Anodyne	ADRB1	38	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(Br)c1	ZINC000819261939	FF	On-Demand	Anodyne	ADRB3	58	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(Br)c1	ZINC000819261939	FF	On-Demand	Anodyne	PAPA1_CARPA	25	43
O=C(CCc1cccc(OC(F)F)c1)NCC[S@@](=O)Cc1ccccc1	ZINC000819262001	GG	On-Demand	Anodyne	PLA2G4A	26	42
O=C(CCc1cccc(OC(F)F)c1)NCC[S@@](=O)Cc1ccccc1	ZINC000819262001	GG	On-Demand	Anodyne	CRTM	59	43
O=C(CCc1cccc(OC(F)F)c1)NCC[S@](=O)Cc1ccccc1	ZINC000819262003	GG	On-Demand	Anodyne	PLA2G4A	26	42
O=C(CCc1cccc(OC(F)F)c1)NCC[S@](=O)Cc1ccccc1	ZINC000819262003	GG	On-Demand	Anodyne	CRTM	59	43
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1cccnc1)CC2	ZINC000819262046	DE	On-Demand	Anodyne	ADRB3	59	55
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1cccnc1)CC2	ZINC000819262048	DE	On-Demand	Anodyne	ADRB3	59	55
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1cccnc1)CC2	ZINC000819262050	DE	On-Demand	Anodyne	ADRB3	59	55
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1cccnc1)CC2	ZINC000819262052	DE	On-Demand	Anodyne	ADRB3	59	55
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1ccc(C(F)(F)F)cc1)CC2	ZINC000819262058	FH	On-Demand	Anodyne	ADRB3	19	54
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1ccc(C(F)(F)F)cc1)CC2	ZINC000819262059	FH	On-Demand	Anodyne	ADRB3	19	54
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1ccc(C(F)(F)F)cc1)CC2	ZINC000819262061	FH	On-Demand	Anodyne	ADRB3	19	54
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1ccc(C(F)(F)F)cc1)CC2	ZINC000819262063	FH	On-Demand	Anodyne	ADRB3	19	54
O=C(NCCN1CCN(C(=O)C(F)=C2CCC2)CC1)c1ccccc1F	ZINC000819262065	FE	On-Demand	Anodyne	HTR1A	23	43
O=C(NCCN1CCN(C(=O)C(F)=C2CCC2)CC1)c1ccccc1F	ZINC000819262065	FE	On-Demand	Anodyne	DRD2	21	43
O=C(NCCN1CCN(C(=O)C(F)=C2CCC2)CC1)c1ccccc1F	ZINC000819262065	FE	On-Demand	Anodyne	DRD4	43	33
O=C(NCCN1CCN(C(=O)C(F)=C2CCC2)CC1)c1ccccc1F	ZINC000819262065	FE	On-Demand	Anodyne	DRD3	36	41
O=C(NCCN1CCN(C(=O)C(F)=C2CCC2)CC1)c1ccccc1F	ZINC000819262065	FE	On-Demand	Anodyne	PLD1	52	36
O=C(NCCN1CCN(C(=O)C(F)=C2CCC2)CC1)c1ccccc1F	ZINC000819262065	FE	On-Demand	Anodyne	PLD2	77	34
O[C@@H](CNC[C@H]1CCC2(CCCCC2)O1)c1cccnc1	ZINC000819262074	CF	On-Demand	Anodyne	ADRB3	82	42
O[C@@H](CNC[C@@H]1CCC2(CCCCC2)O1)c1cccnc1	ZINC000819262075	CF	On-Demand	Anodyne	ADRB3	82	42
O[C@H](CNC[C@H]1CCC2(CCCCC2)O1)c1cccnc1	ZINC000819262076	CF	On-Demand	Anodyne	ADRB3	82	42
O[C@H](CNC[C@@H]1CCC2(CCCCC2)O1)c1cccnc1	ZINC000819262077	CF	On-Demand	Anodyne	ADRB3	82	42
C[C@@H](CNC(=O)OC(C)(C)C)NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819262155	FF	On-Demand	Anodyne	LTA4H	15	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819262158	GG	On-Demand	Anodyne	ADRB2	42	49
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819262158	GG	On-Demand	Anodyne	ADRB1	51	48
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819262158	GG	On-Demand	Anodyne	GRIN1	28	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819262158	GG	On-Demand	Anodyne	ADRB3	26	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819262158	GG	On-Demand	Anodyne	PDS	31	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819262159	GG	On-Demand	Anodyne	ADRB2	42	49
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819262159	GG	On-Demand	Anodyne	ADRB1	51	48
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819262159	GG	On-Demand	Anodyne	GRIN1	28	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819262159	GG	On-Demand	Anodyne	ADRB3	26	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819262159	GG	On-Demand	Anodyne	PDS	31	44
Cc1ccccc1[C@@H](O)CNC1CCN(S(=O)(=O)C(C)(C)C)CC1	ZINC000819262164	FE	On-Demand	Anodyne	CCR8	80	36
Cc1ccccc1[C@@H](O)CNC1CCN(S(=O)(=O)C(C)(C)C)CC1	ZINC000819262164	FE	On-Demand	Anodyne	SFRP1	41	33
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819262183	EG	On-Demand	Anodyne	ADRB2	49	38
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819262183	EG	On-Demand	Anodyne	ADRB1	19	48
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819262184	EG	On-Demand	Anodyne	ADRB2	49	38
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819262184	EG	On-Demand	Anodyne	ADRB1	19	48
C[C@@H](CCCC(F)(F)F)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819262200	FF	On-Demand	Anodyne	CTSF	43	34
C[C@@H](CCCC(F)(F)F)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819262202	FF	On-Demand	Anodyne	CTSF	43	34
C[C@@H](CNC(=O)OC(C)(C)C)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819262205	GD	On-Demand	Bother	MMP8	15	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819262221	FG	On-Demand	Anodyne	ADRB2	58	68
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819262221	FG	On-Demand	Anodyne	ADRB1	65	46
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819262221	FG	On-Demand	Anodyne	ADRB3	36	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819262221	FG	On-Demand	Anodyne	CASR	45	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819262221	FG	On-Demand	Anodyne	PAPA1_CARPA	18	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819262221	FG	On-Demand	Anodyne	CYP2D6	18	48
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819262221	FG	On-Demand	Anodyne	PDS	65	35
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819262222	FG	On-Demand	Anodyne	ADRB2	58	68
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819262222	FG	On-Demand	Anodyne	ADRB1	65	46
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819262222	FG	On-Demand	Anodyne	ADRB3	36	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819262222	FG	On-Demand	Anodyne	CASR	45	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819262222	FG	On-Demand	Anodyne	PAPA1_CARPA	18	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819262222	FG	On-Demand	Anodyne	CYP2D6	18	48
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819262222	FG	On-Demand	Anodyne	PDS	65	35
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1ccc(F)cc1)CC2	ZINC000819262250	DF	On-Demand	Anodyne	ADRB3	19	42
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1ccc(F)cc1)CC2	ZINC000819262251	DF	On-Demand	Anodyne	ADRB3	19	42
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1ccc(F)cc1)CC2	ZINC000819262252	DF	On-Demand	Anodyne	ADRB3	19	42
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1ccc(F)cc1)CC2	ZINC000819262253	DF	On-Demand	Anodyne	ADRB3	19	42
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819262433	GE	On-Demand	Anodyne	SFRP1	64	35
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819262434	GE	On-Demand	Anodyne	SFRP1	64	35
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819262435	GE	On-Demand	Anodyne	SFRP1	64	35
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819262436	GE	On-Demand	Anodyne	SFRP1	64	35
O=C(Nc1cc(C(=O)N2CCCCC2)ccc1Cl)C(F)=C1CCC1	ZINC000819262475	FI	On-Demand	Anodyne	L3MBTL3	52	37
C[C@@H](CCCC(F)(F)F)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819262476	GH	On-Demand	Anodyne	GPR119	27	44
C[C@@H](CCCC(F)(F)F)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819262479	GH	On-Demand	Anodyne	GPR119	27	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(F)c1	ZINC000819262482	DE	On-Demand	Anodyne	ADRB2	53	36
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(F)c1	ZINC000819262482	DE	On-Demand	Anodyne	ADRB1	36	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(F)c1	ZINC000819262482	DE	On-Demand	Anodyne	ADRB3	56	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(F)c1	ZINC000819262482	DE	On-Demand	Anodyne	PAPA1_CARPA	25	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(F)c1	ZINC000819262483	DE	On-Demand	Anodyne	ADRB2	53	36
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(F)c1	ZINC000819262483	DE	On-Demand	Anodyne	ADRB1	36	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(F)c1	ZINC000819262483	DE	On-Demand	Anodyne	ADRB3	56	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(F)c1	ZINC000819262483	DE	On-Demand	Anodyne	PAPA1_CARPA	25	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819262506	EF	On-Demand	Anodyne	ADRB2	63	39
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819262506	EF	On-Demand	Anodyne	ADRB1	54	59
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819262506	EF	On-Demand	Anodyne	ADRB3	83	57
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819262507	EF	On-Demand	Anodyne	ADRB2	63	39
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819262507	EF	On-Demand	Anodyne	ADRB1	54	59
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819262507	EF	On-Demand	Anodyne	ADRB3	83	57
CCNC(=O)C1(CNC[C@H](O)c2cccc(F)c2)CCC1	ZINC000819262516	CD	On-Demand	Anodyne	ADRB1	17	41
CCNC(=O)C1(CNC[C@H](O)c2cccc(F)c2)CCC1	ZINC000819262516	CD	On-Demand	Anodyne	ADRB3	25	41
CCNC(=O)C1(CNC[C@@H](O)c2cccc(F)c2)CCC1	ZINC000819262517	CD	On-Demand	Anodyne	ADRB1	17	41
CCNC(=O)C1(CNC[C@@H](O)c2cccc(F)c2)CCC1	ZINC000819262517	CD	On-Demand	Anodyne	ADRB3	25	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819262518	EF	On-Demand	Anodyne	ADRB1	21	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819262518	EF	On-Demand	Anodyne	ADRB3	35	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819262525	GG	On-Demand	Anodyne	ADRB2	29	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819262526	GG	On-Demand	Anodyne	ADRB2	29	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)[C@@H](C)c1ccccc1	ZINC000819262529	DF	On-Demand	Anodyne	FPR1	43	35
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)[C@H](C)c1ccccc1	ZINC000819262530	DF	On-Demand	Anodyne	FPR1	43	35
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)[C@@H](C)c1ccccc1	ZINC000819262531	DF	On-Demand	Anodyne	FPR1	43	35
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000819262532	DF	On-Demand	Anodyne	FPR1	43	35
COC(=O)c1ccc(OC)cc1NC(=O)C(F)=C1CCC1	ZINC000819262533	CF	On-Demand	Anodyne	AKR1C2	43	39
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCC[C@H](c3ccccc3)C2)c1	ZINC000819262539	EH	On-Demand	Bother	CACNA1D	52	35
CON(C)C(=O)CCNCc1cccc([N+](=O)[O-])c1C	ZINC000819262552	CD	On-Demand	Bother	COLA	106	35
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)CC2	ZINC000819262585	FH	On-Demand	Anodyne	ADRB3	20	44
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1cccc(C(F)(F)F)c1)CC2	ZINC000819262586	FH	On-Demand	Anodyne	ADRB3	20	44
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1cccc(C(F)(F)F)c1)CC2	ZINC000819262587	FH	On-Demand	Anodyne	ADRB3	20	44
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)CC2	ZINC000819262588	FH	On-Demand	Anodyne	ADRB3	20	44
Cn1ncc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)c1I	ZINC000819262607	HG	On-Demand	Anodyne	EPHB3	61	40
Cc1ccc(C[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819262655	GH	On-Demand	Mild	PAPA1_CARPA	47	44
Cc1ccc(C[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819262655	GH	On-Demand	Mild	CTSL	15	44
Cc1ccc(C[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819262655	GH	On-Demand	Mild	FPR1	48	41
O=Cc1ccc(OCC(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cc1	ZINC000819262677	EH	On-Demand	Anodyne	TRAR	30	41
O=C(CNC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819262692	FH	On-Demand	Anodyne	CTSB	40	41
O=C(CNC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819262692	FH	On-Demand	Anodyne	CTSK	26	41
O=C(CNC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819262692	FH	On-Demand	Anodyne	CAPNS1	56	32
O=C(CNC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819262692	FH	On-Demand	Anodyne	CTSS	15	41
O=C(CNC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819262692	FH	On-Demand	Anodyne	CAPN1	57	35
O=C(CNC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819262692	FH	On-Demand	Anodyne	CASP1	15	41
O=C(CNC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819262692	FH	On-Demand	Anodyne	CAPN2	103	36
O=C(CNC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819262692	FH	On-Demand	Anodyne	NPR	61	34
O=C(OCc1ccccc1)N1CCN(CC(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)CC1	ZINC000819262735	HE	On-Demand	Anodyne	GRIN2B	19	41
O=C(OCc1ccccc1)N1CCN(CC(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)CC1	ZINC000819262735	HE	On-Demand	Anodyne	PREP	35	41
O=C(OCc1ccccc1)N1CCN(CC(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)CC1	ZINC000819262735	HE	On-Demand	Anodyne	SLC12A5	60	37
O=C(OCc1ccccc1)N1CCN(CC(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)CC1	ZINC000819262736	HE	On-Demand	Anodyne	GRIN2B	19	41
O=C(OCc1ccccc1)N1CCN(CC(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)CC1	ZINC000819262736	HE	On-Demand	Anodyne	PREP	35	41
O=C(OCc1ccccc1)N1CCN(CC(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)CC1	ZINC000819262736	HE	On-Demand	Anodyne	SLC12A5	60	37
O=C(OCc1ccccc1)N1CCN(CC(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)CC1	ZINC000819262737	HE	On-Demand	Anodyne	GRIN2B	19	41
O=C(OCc1ccccc1)N1CCN(CC(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)CC1	ZINC000819262737	HE	On-Demand	Anodyne	PREP	35	41
O=C(OCc1ccccc1)N1CCN(CC(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)CC1	ZINC000819262737	HE	On-Demand	Anodyne	SLC12A5	60	37
O=C(OCc1ccccc1)N1CCN(CC(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)CC1	ZINC000819262738	HE	On-Demand	Anodyne	GRIN2B	19	41
O=C(OCc1ccccc1)N1CCN(CC(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)CC1	ZINC000819262738	HE	On-Demand	Anodyne	PREP	35	41
O=C(OCc1ccccc1)N1CCN(CC(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)CC1	ZINC000819262738	HE	On-Demand	Anodyne	SLC12A5	60	37
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCC[C@@H](c3ccccc3)C2)c1	ZINC000819262740	EH	On-Demand	Bother	CACNA1D	52	35
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCC[C@H](c3ccccc3)C2)c1	ZINC000819262741	EH	On-Demand	Bother	CACNA1D	52	35
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCC[C@@H](c3ccccc3)C2)c1	ZINC000819262742	EH	On-Demand	Bother	CACNA1D	52	35
O=[N+]([O-])c1cccc([C@@H](O)CNCc2ccc(C3CCC3)cc2)c1	ZINC000819262747	EH	On-Demand	Bother	CACNA1D	42	32
O=[N+]([O-])c1cccc([C@H](O)CNCc2ccc(C3CCC3)cc2)c1	ZINC000819262748	EH	On-Demand	Bother	CACNA1D	42	32
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819262754	GG	On-Demand	Anodyne	ADRB2	42	33
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819262755	GG	On-Demand	Anodyne	ADRB2	42	33
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc(F)cc1	ZINC000819262781	EE	On-Demand	Anodyne	ADRB2	53	50
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc(F)cc1	ZINC000819262781	EE	On-Demand	Anodyne	ADRB1	69	50
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc(F)cc1	ZINC000819262781	EE	On-Demand	Anodyne	ADRB3	37	47
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc(F)cc1	ZINC000819262782	EE	On-Demand	Anodyne	ADRB2	53	50
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc(F)cc1	ZINC000819262782	EE	On-Demand	Anodyne	ADRB1	69	50
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc(F)cc1	ZINC000819262782	EE	On-Demand	Anodyne	ADRB3	37	47
CCNC(=O)C1(CNC[C@H](O)c2cc(OC)ccc2OC)CCC1	ZINC000819262788	ED	On-Demand	Anodyne	MTNR1A	31	40
CCNC(=O)C1(CNC[C@@H](O)c2cc(OC)ccc2OC)CCC1	ZINC000819262789	ED	On-Demand	Anodyne	MTNR1A	31	40
C[C@@H](CNC(=O)OC(C)(C)C)NCCC(=O)Nc1ccc(Cl)cc1	ZINC000819262793	FG	On-Demand	Anodyne	LTA4H	17	44
NC(=O)CCN[C@@H]1CCOc2c1ccc(Cl)c2Cl	ZINC000819262801	CE	On-Demand	Anodyne	LUXR	42	34
NC(=O)CCN[C@H]1CCOc2c1ccc(Cl)c2Cl	ZINC000819262802	CE	On-Demand	Anodyne	LUXR	42	34
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819262809	EF	On-Demand	Anodyne	ADRB1	33	45
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819262809	EF	On-Demand	Anodyne	ADRB3	38	45
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819262809	EF	On-Demand	Anodyne	PAPA1_CARPA	30	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819262809	EF	On-Demand	Anodyne	CTSL	17	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819262809	EF	On-Demand	Anodyne	FPR1	45	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819262809	EF	On-Demand	Anodyne	PDS	65	38
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819262810	EF	On-Demand	Anodyne	ADRB1	33	45
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819262810	EF	On-Demand	Anodyne	ADRB3	38	45
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819262810	EF	On-Demand	Anodyne	PAPA1_CARPA	30	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819262810	EF	On-Demand	Anodyne	CTSL	17	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819262810	EF	On-Demand	Anodyne	FPR1	45	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819262810	EF	On-Demand	Anodyne	PDS	65	38
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(Br)cc1	ZINC000819262828	FF	On-Demand	Anodyne	PAPA1_CARPA	26	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819262829	FF	On-Demand	Anodyne	PAPA1_CARPA	26	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCCNc1ccccc1	ZINC000819262832	EF	On-Demand	Anodyne	KLK5	22	41
O[C@H](CNCc1nnc2n1CCOC2)c1cccc(Cl)c1	ZINC000819262844	DD	On-Demand	Anodyne	CYP3A4	40	34
O[C@@H](CNCc1nnc2n1CCOC2)c1cccc(Cl)c1	ZINC000819262845	DD	On-Demand	Anodyne	CYP3A4	40	34
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)CC2	ZINC000819262887	EF	On-Demand	Bother	ADRB3	20	43
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)CC2	ZINC000819262888	EF	On-Demand	Bother	ADRB3	20	43
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)CC2	ZINC000819262889	EF	On-Demand	Bother	ADRB3	20	43
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)CC2	ZINC000819262890	EF	On-Demand	Bother	ADRB3	20	43
O=C(/C=C\[C@H]1CCCO1)Nc1nc2ccc(OCC(F)(F)F)cc2s1	ZINC000819262917	FH	On-Demand	Anodyne	CSNK1D	44	43
O=C(/C=C/[C@H]1CCCO1)Nc1nc2ccc(OCC(F)(F)F)cc2s1	ZINC000819262918	FH	On-Demand	Anodyne	CSNK1D	44	43
O=C(/C=C\[C@@H]1CCCO1)Nc1nc2ccc(OCC(F)(F)F)cc2s1	ZINC000819262919	FH	On-Demand	Anodyne	CSNK1D	44	43
O=C(/C=C/[C@@H]1CCCO1)Nc1nc2ccc(OCC(F)(F)F)cc2s1	ZINC000819262920	FH	On-Demand	Anodyne	CSNK1D	44	43
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1cccc(Br)c1)CC2	ZINC000819262925	GG	On-Demand	Anodyne	ADRB3	20	43
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1cccc(Br)c1)CC2	ZINC000819262926	GG	On-Demand	Anodyne	ADRB3	20	43
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1cccc(Br)c1)CC2	ZINC000819262927	GG	On-Demand	Anodyne	ADRB3	20	43
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1cccc(Br)c1)CC2	ZINC000819262928	GG	On-Demand	Anodyne	ADRB3	20	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC[S@](=O)Cc1ccccc1	ZINC000819262938	FD	On-Demand	Anodyne	FPR1	44	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC[S@@](=O)Cc1ccccc1	ZINC000819262939	FD	On-Demand	Anodyne	FPR1	44	38
CC(=O)Nc1cccc(CC(=O)NNC(=O)C(C)(C)c2ccccc2)c1	ZINC000819262949	FE	On-Demand	Reactive	KCNK3	53	35
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(C3CC3)cc2)CC1	ZINC000819262951	FH	On-Demand	Anodyne	GPR119	52	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(C3CC3)cc2)CC1	ZINC000819262952	FH	On-Demand	Anodyne	GPR119	52	49
CC(C)n1ncc2c1C[C@@H](NC[C@@H](O)c1ccc(F)c(Br)c1)CC2	ZINC000819262956	GH	On-Demand	Anodyne	ADRB3	20	42
CC(C)n1ncc2c1C[C@H](NC[C@H](O)c1ccc(F)c(Br)c1)CC2	ZINC000819262958	GH	On-Demand	Anodyne	ADRB3	20	42
CC(C)n1ncc2c1C[C@@H](NC[C@H](O)c1ccc(F)c(Br)c1)CC2	ZINC000819262960	GH	On-Demand	Anodyne	ADRB3	20	42
CC(C)n1ncc2c1C[C@H](NC[C@@H](O)c1ccc(F)c(Br)c1)CC2	ZINC000819262961	GH	On-Demand	Anodyne	ADRB3	20	42
O=C(Cn1c(S)nc2ccccc2c1=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819262972	GG	On-Demand	Anodyne	TNKS	58	34
O=C(COc1ccc2ccc(=O)oc2c1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819262977	GH	On-Demand	Anodyne	MAOA	34	40
O=C(COc1ccc2ccc(=O)oc2c1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819262977	GH	On-Demand	Anodyne	MAOB	29	45
O=C(COc1ccc2ccc(=O)oc2c1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819262977	GH	On-Demand	Anodyne	TRAR	31	41
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263015	IG	On-Demand	Anodyne	F2	42	39
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263015	IG	On-Demand	Anodyne	PREP	39	43
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263015	IG	On-Demand	Anodyne	LGMN	50	33
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263015	IG	On-Demand	Anodyne	SFRP1	34	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263015	IG	On-Demand	Anodyne	WNT3	53	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263016	IG	On-Demand	Anodyne	F2	42	39
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263016	IG	On-Demand	Anodyne	PREP	39	43
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263016	IG	On-Demand	Anodyne	LGMN	50	33
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263016	IG	On-Demand	Anodyne	SFRP1	34	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263016	IG	On-Demand	Anodyne	WNT3	53	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819263060	ED	On-Demand	Mild	ADRB2	42	48
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819263060	ED	On-Demand	Mild	ADRB1	67	39
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819263060	ED	On-Demand	Mild	ADRB3	25	45
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819263061	ED	On-Demand	Mild	ADRB2	42	48
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819263061	ED	On-Demand	Mild	ADRB1	67	39
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819263061	ED	On-Demand	Mild	ADRB3	25	45
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1ccccc1F	ZINC000819263088	DE	On-Demand	Anodyne	PAPA1_CARPA	29	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccccc1F	ZINC000819263089	DE	On-Demand	Anodyne	PAPA1_CARPA	29	44
C[C@@H](CNC(=O)OC(C)(C)C)NCCS(=O)(=O)c1ccccc1	ZINC000819263094	ED	On-Demand	Anodyne	FPR1	43	35
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1cccc2ccccc12	ZINC000819263129	FG	On-Demand	Anodyne	ADRB2	51	67
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1cccc2ccccc12	ZINC000819263129	FG	On-Demand	Anodyne	ADRB1	73	47
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1cccc2ccccc12	ZINC000819263129	FG	On-Demand	Anodyne	ADRB3	26	67
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1cccc2ccccc12	ZINC000819263129	FG	On-Demand	Anodyne	CASR	42	38
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1cccc2ccccc12	ZINC000819263129	FG	On-Demand	Anodyne	CYP2D6	24	49
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1cccc2ccccc12	ZINC000819263129	FG	On-Demand	Anodyne	ABCB1	23	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1cccc2ccccc12	ZINC000819263130	FG	On-Demand	Anodyne	ADRB2	51	67
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1cccc2ccccc12	ZINC000819263130	FG	On-Demand	Anodyne	ADRB1	73	47
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1cccc2ccccc12	ZINC000819263130	FG	On-Demand	Anodyne	ADRB3	26	67
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1cccc2ccccc12	ZINC000819263130	FG	On-Demand	Anodyne	CASR	42	38
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1cccc2ccccc12	ZINC000819263130	FG	On-Demand	Anodyne	CYP2D6	24	49
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1cccc2ccccc12	ZINC000819263130	FG	On-Demand	Anodyne	ABCB1	23	40
C[C@@H](CNC(=O)OC(C)(C)C)NCCC(=O)Nc1cccnc1	ZINC000819263153	DD	On-Demand	Anodyne	NAMPT	15	52
COCCN1C(=O)c2ccc(C(=O)N[C@@H]3C[C@@H](c4ccccc4Cl)C3)cc2S1(=O)=O	ZINC000819263159	IF	On-Demand	Anodyne	ELANE	21	41
CCOC(=O)Nc1ccc(C(=O)N[C@@H]2C[C@@H](c3ccccc3Cl)C2)cc1	ZINC000819263174	FJ	On-Demand	Anodyne	NOD2	40	38
O=C(CCCCN1CCCC1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263176	EH	On-Demand	Anodyne	HTR1A	27	55
O=C(CCCCN1CCCC1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263176	EH	On-Demand	Anodyne	DRD2	27	55
O=C(CCCCN1CCCC1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263176	EH	On-Demand	Anodyne	HTR2A	17	55
O=C(CCCCN1CCCC1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263176	EH	On-Demand	Anodyne	SLC6A1	46	37
O=C(CCCCN1CCCC1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263176	EH	On-Demand	Anodyne	HTR7	46	55
O=C(CCCCN1CCCC1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263176	EH	On-Demand	Anodyne	HRH3	20	44
O=C(CCCCN1CCCC1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263176	EH	On-Demand	Anodyne	SIGMAR1	29	41
O=C(CCCCN1CCCC1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263176	EH	On-Demand	Anodyne	CHRNA7	17	47
O=C(CCCCN1CCCC1)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263176	EH	On-Demand	Anodyne	HNMT	43	31
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263227	HD	On-Demand	Anodyne	ACE	26	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263227	HD	On-Demand	Anodyne	GHRHR	53	29
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263227	HD	On-Demand	Anodyne	CTRA_BOVIN	68	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263227	HD	On-Demand	Anodyne	KLK3	71	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263227	HD	On-Demand	Anodyne	CTSB	43	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263227	HD	On-Demand	Anodyne	PAPA1_CARPA	41	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263227	HD	On-Demand	Anodyne	TRY1_BOVIN	44	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263227	HD	On-Demand	Anodyne	CYSP_TRYCR	51	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263227	HD	On-Demand	Anodyne	CTSG	48	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263227	HD	On-Demand	Anodyne	CTSK	41	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263227	HD	On-Demand	Anodyne	CTSL	45	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263227	HD	On-Demand	Anodyne	CAPNS1	58	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263227	HD	On-Demand	Anodyne	CELA2A	57	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263227	HD	On-Demand	Anodyne	TGM1	24	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263227	HD	On-Demand	Anodyne	CAPN1	58	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263227	HD	On-Demand	Anodyne	CAPN2	95	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263227	HD	On-Demand	Anodyne	TGM2	27	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819263228	HD	On-Demand	Anodyne	ACE	26	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819263228	HD	On-Demand	Anodyne	GHRHR	53	29
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819263228	HD	On-Demand	Anodyne	CTRA_BOVIN	68	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819263228	HD	On-Demand	Anodyne	KLK3	71	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819263228	HD	On-Demand	Anodyne	CTSB	43	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819263228	HD	On-Demand	Anodyne	PAPA1_CARPA	41	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819263228	HD	On-Demand	Anodyne	TRY1_BOVIN	44	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819263228	HD	On-Demand	Anodyne	CYSP_TRYCR	51	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819263228	HD	On-Demand	Anodyne	CTSG	48	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819263228	HD	On-Demand	Anodyne	CTSK	41	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819263228	HD	On-Demand	Anodyne	CTSL	45	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819263228	HD	On-Demand	Anodyne	CAPNS1	58	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819263228	HD	On-Demand	Anodyne	CELA2A	57	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819263228	HD	On-Demand	Anodyne	TGM1	24	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819263228	HD	On-Demand	Anodyne	CAPN1	58	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819263228	HD	On-Demand	Anodyne	CAPN2	95	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819263228	HD	On-Demand	Anodyne	TGM2	27	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263229	HD	On-Demand	Anodyne	ACE	26	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263229	HD	On-Demand	Anodyne	GHRHR	53	29
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263229	HD	On-Demand	Anodyne	CTRA_BOVIN	68	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263229	HD	On-Demand	Anodyne	KLK3	71	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263229	HD	On-Demand	Anodyne	CTSB	43	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263229	HD	On-Demand	Anodyne	PAPA1_CARPA	41	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263229	HD	On-Demand	Anodyne	TRY1_BOVIN	44	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263229	HD	On-Demand	Anodyne	CYSP_TRYCR	51	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263229	HD	On-Demand	Anodyne	CTSG	48	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263229	HD	On-Demand	Anodyne	CTSK	41	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263229	HD	On-Demand	Anodyne	CTSL	45	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263229	HD	On-Demand	Anodyne	CAPNS1	58	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263229	HD	On-Demand	Anodyne	CELA2A	57	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263229	HD	On-Demand	Anodyne	TGM1	24	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263229	HD	On-Demand	Anodyne	CAPN1	58	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263229	HD	On-Demand	Anodyne	CAPN2	95	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819263229	HD	On-Demand	Anodyne	TGM2	27	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819263230	HD	On-Demand	Anodyne	ACE	26	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819263230	HD	On-Demand	Anodyne	GHRHR	53	29
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819263230	HD	On-Demand	Anodyne	CTRA_BOVIN	68	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819263230	HD	On-Demand	Anodyne	KLK3	71	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819263230	HD	On-Demand	Anodyne	CTSB	43	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819263230	HD	On-Demand	Anodyne	PAPA1_CARPA	41	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819263230	HD	On-Demand	Anodyne	TRY1_BOVIN	44	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819263230	HD	On-Demand	Anodyne	CYSP_TRYCR	51	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819263230	HD	On-Demand	Anodyne	CTSG	48	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819263230	HD	On-Demand	Anodyne	CTSK	41	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819263230	HD	On-Demand	Anodyne	CTSL	45	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819263230	HD	On-Demand	Anodyne	CAPNS1	58	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819263230	HD	On-Demand	Anodyne	CELA2A	57	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819263230	HD	On-Demand	Anodyne	TGM1	24	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819263230	HD	On-Demand	Anodyne	CAPN1	58	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819263230	HD	On-Demand	Anodyne	CAPN2	95	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819263230	HD	On-Demand	Anodyne	TGM2	27	44
N#Cc1cccc(OCC(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)c1	ZINC000819263247	DE	On-Demand	Mild	CPT1A	106	44
N#Cc1cccc(OCC(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)c1	ZINC000819263247	DE	On-Demand	Mild	CPT2	45	33
N#Cc1cccc(OCC(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)c1	ZINC000819263248	DE	On-Demand	Mild	CPT1A	106	44
N#Cc1cccc(OCC(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)c1	ZINC000819263248	DE	On-Demand	Mild	CPT2	45	33
N#Cc1cccc(OCC(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)c1	ZINC000819263249	DE	On-Demand	Mild	CPT1A	106	44
N#Cc1cccc(OCC(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)c1	ZINC000819263249	DE	On-Demand	Mild	CPT2	45	33
N#Cc1cccc(OCC(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)c1	ZINC000819263250	DE	On-Demand	Mild	CPT1A	106	44
N#Cc1cccc(OCC(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)c1	ZINC000819263250	DE	On-Demand	Mild	CPT2	45	33
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819263270	EE	On-Demand	Bother	ADRB1	27	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819263270	EE	On-Demand	Bother	CACNA1C	43	35
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819263270	EE	On-Demand	Bother	ADRB3	55	39
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819263270	EE	On-Demand	Bother	CACNA1D	66	35
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819263271	EE	On-Demand	Bother	ADRB1	27	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819263271	EE	On-Demand	Bother	CACNA1C	43	35
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819263271	EE	On-Demand	Bother	ADRB3	55	39
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819263271	EE	On-Demand	Bother	CACNA1D	66	35
C[C@@H](CNC(=O)OC(C)(C)C)NCCC(=O)Nc1cccc(F)c1	ZINC000819263273	EF	On-Demand	Anodyne	PAPA1_CARPA	20	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1ccccc1Br	ZINC000819263276	FF	On-Demand	Anodyne	PAPA1_CARPA	29	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1ccccc1Br	ZINC000819263276	FF	On-Demand	Anodyne	FPR1	41	34
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccccc1Br	ZINC000819263277	FF	On-Demand	Anodyne	PAPA1_CARPA	29	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccccc1Br	ZINC000819263277	FF	On-Demand	Anodyne	FPR1	41	34
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccccc1Cl	ZINC000819263281	FF	On-Demand	Anodyne	ADRB2	41	52
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccccc1Cl	ZINC000819263281	FF	On-Demand	Anodyne	ADRB1	68	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccccc1Cl	ZINC000819263281	FF	On-Demand	Anodyne	ADRB3	20	46
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccccc1Cl	ZINC000819263281	FF	On-Demand	Anodyne	CASR	40	39
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccccc1Cl	ZINC000819263281	FF	On-Demand	Anodyne	ABCB1	23	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccccc1Cl	ZINC000819263281	FF	On-Demand	Anodyne	PDS	15	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccccc1Cl	ZINC000819263282	FF	On-Demand	Anodyne	ADRB2	41	52
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccccc1Cl	ZINC000819263282	FF	On-Demand	Anodyne	ADRB1	68	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccccc1Cl	ZINC000819263282	FF	On-Demand	Anodyne	ADRB3	20	46
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccccc1Cl	ZINC000819263282	FF	On-Demand	Anodyne	CASR	40	39
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccccc1Cl	ZINC000819263282	FF	On-Demand	Anodyne	ABCB1	23	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccccc1Cl	ZINC000819263282	FF	On-Demand	Anodyne	PDS	15	43
CCNC(=O)C1(CNC[C@H](O)c2cccc(C(F)(F)F)c2)CCC1	ZINC000819263285	EF	On-Demand	Anodyne	CCR2	43	36
CCNC(=O)C1(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)CCC1	ZINC000819263286	EF	On-Demand	Anodyne	CCR2	43	36
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(C(=O)N2CCCCC2)ccc1Cl	ZINC000819263291	FH	On-Demand	Anodyne	L3MBTL3	69	36
O=C(/C=C/[C@H]1CCCO1)Nc1cc(C(=O)N2CCCCC2)ccc1Cl	ZINC000819263292	FH	On-Demand	Anodyne	L3MBTL3	69	36
O=C(/C=C\[C@H]1CCCO1)Nc1cc(C(=O)N2CCCCC2)ccc1Cl	ZINC000819263293	FH	On-Demand	Anodyne	L3MBTL3	69	36
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(C(=O)N2CCCCC2)ccc1Cl	ZINC000819263294	FH	On-Demand	Anodyne	L3MBTL3	69	36
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819263298	FE	On-Demand	Anodyne	ADRB2	36	70
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819263298	FE	On-Demand	Anodyne	ADRB1	57	70
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819263298	FE	On-Demand	Anodyne	ADRB3	21	70
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819263298	FE	On-Demand	Anodyne	CYP2D6	19	46
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819263299	FE	On-Demand	Anodyne	ADRB2	36	70
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819263299	FE	On-Demand	Anodyne	ADRB1	57	70
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819263299	FE	On-Demand	Anodyne	ADRB3	21	70
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819263299	FE	On-Demand	Anodyne	CYP2D6	19	46
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	ADRB2	36	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	ADRB1	27	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	ADRB3	30	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	MME	75	37
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	ANPEP	58	34
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	CTSD	24	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	PGC	54	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	PAPA1_CARPA	65	49
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	CTSK	22	51
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	CTSL	24	49
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	PGA	38	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	TACR3	19	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	CAPNS1	57	33
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	HLA-DRB1	21	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	REN	68	46
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	REN1	20	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	CAPN1	44	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	CAPN2	60	34
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	LAP3	29	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	FPR1	67	45
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	NPR	52	34
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	AMP1_PLAFQ	41	37
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1	ZINC000819263302	DE	On-Demand	Anodyne	PDS	44	33
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	ADRB2	36	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	ADRB1	27	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	ADRB3	30	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	MME	75	37
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	ANPEP	58	34
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	CTSD	24	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	PGC	54	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	PAPA1_CARPA	65	49
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	CTSK	22	51
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	CTSL	24	49
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	PGA	38	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	TACR3	19	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	CAPNS1	57	33
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	HLA-DRB1	21	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	REN	68	46
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	REN1	20	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	CAPN1	44	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	CAPN2	60	34
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	LAP3	29	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	FPR1	67	45
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	NPR	52	34
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	AMP1_PLAFQ	41	37
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1	ZINC000819263303	DE	On-Demand	Anodyne	PDS	44	33
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CO[C@H]1CCCc2ccccc21	ZINC000819263305	GF	On-Demand	Anodyne	ADRB2	18	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CO[C@@H]1CCCc2ccccc21	ZINC000819263306	GF	On-Demand	Anodyne	ADRB2	18	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CO[C@@H]1CCCc2ccccc21	ZINC000819263307	GF	On-Demand	Anodyne	ADRB2	18	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CO[C@H]1CCCc2ccccc21	ZINC000819263308	GF	On-Demand	Anodyne	ADRB2	18	41
C[C@@H](CNC(=O)OC(C)(C)C)NCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819263312	GG	On-Demand	Anodyne	CYNT	38	45
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819263317	FF	On-Demand	Anodyne	ADRB2	49	50
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819263317	FF	On-Demand	Anodyne	ADRB1	65	50
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819263317	FF	On-Demand	Anodyne	ADRB3	35	47
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc(Cl)cc1	ZINC000819263318	FF	On-Demand	Anodyne	ADRB2	49	50
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc(Cl)cc1	ZINC000819263318	FF	On-Demand	Anodyne	ADRB1	65	50
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccc(Cl)cc1	ZINC000819263318	FF	On-Demand	Anodyne	ADRB3	35	47
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819263320	FG	On-Demand	Anodyne	ADRB2	40	49
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819263320	FG	On-Demand	Anodyne	CASR	43	38
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819263320	FG	On-Demand	Anodyne	PAPA1_CARPA	30	53
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819263320	FG	On-Demand	Anodyne	REN	22	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819263320	FG	On-Demand	Anodyne	FPR1	43	36
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819263321	FG	On-Demand	Anodyne	ADRB2	40	49
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819263321	FG	On-Demand	Anodyne	CASR	43	38
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819263321	FG	On-Demand	Anodyne	PAPA1_CARPA	30	53
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819263321	FG	On-Demand	Anodyne	REN	22	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819263321	FG	On-Demand	Anodyne	FPR1	43	36
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccccc1C(F)(F)F	ZINC000819263327	GG	On-Demand	Anodyne	FPR1	45	36
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccccc1C(F)(F)F	ZINC000819263328	GG	On-Demand	Anodyne	FPR1	45	36
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccc(F)cc1	ZINC000819263341	EE	On-Demand	Anodyne	PAPA1_CARPA	30	50
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)Cc1ccc(F)cc1	ZINC000819263341	EE	On-Demand	Anodyne	FPR1	41	35
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccc(F)cc1	ZINC000819263342	EE	On-Demand	Anodyne	PAPA1_CARPA	30	50
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)Cc1ccc(F)cc1	ZINC000819263342	EE	On-Demand	Anodyne	FPR1	41	35
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccccc1F	ZINC000819263344	EE	On-Demand	Anodyne	ADRB2	38	52
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccccc1F	ZINC000819263344	EE	On-Demand	Anodyne	ADRB1	71	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccccc1F	ZINC000819263344	EE	On-Demand	Anodyne	ADRB3	15	46
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)COc1ccccc1F	ZINC000819263344	EE	On-Demand	Anodyne	ABCB1	19	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccccc1F	ZINC000819263345	EE	On-Demand	Anodyne	ADRB2	38	52
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccccc1F	ZINC000819263345	EE	On-Demand	Anodyne	ADRB1	71	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccccc1F	ZINC000819263345	EE	On-Demand	Anodyne	ADRB3	15	46
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)COc1ccccc1F	ZINC000819263345	EE	On-Demand	Anodyne	ABCB1	19	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CC1CCCC1	ZINC000819263346	DE	On-Demand	Anodyne	CTSD	15	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CC1CCCC1	ZINC000819263346	DE	On-Demand	Anodyne	ECE1	23	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CC1CCCC1	ZINC000819263346	DE	On-Demand	Anodyne	REN	49	45
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CC1CCCC1	ZINC000819263347	DE	On-Demand	Anodyne	CTSD	15	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CC1CCCC1	ZINC000819263347	DE	On-Demand	Anodyne	ECE1	23	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CC1CCCC1	ZINC000819263347	DE	On-Demand	Anodyne	REN	49	45
CCC(=O)Nc1ccccc1C(=O)N[C@@H]1C[C@@H](c2ccccc2Cl)C1	ZINC000819263399	FI	On-Demand	Anodyne	EPHB3	43	33
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CCc1ccccc1	ZINC000819263459	DE	On-Demand	Anodyne	ADRB2	26	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CCc1ccccc1	ZINC000819263459	DE	On-Demand	Anodyne	ADRB1	26	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CCc1ccccc1	ZINC000819263459	DE	On-Demand	Anodyne	MME	41	39
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CCc1ccccc1	ZINC000819263459	DE	On-Demand	Anodyne	ANPEP	48	34
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CCc1ccccc1	ZINC000819263459	DE	On-Demand	Anodyne	CTSD	21	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CCc1ccccc1	ZINC000819263459	DE	On-Demand	Anodyne	PGC	31	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CCc1ccccc1	ZINC000819263459	DE	On-Demand	Anodyne	PAPA1_CARPA	42	45
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CCc1ccccc1	ZINC000819263459	DE	On-Demand	Anodyne	CTSK	28	53
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CCc1ccccc1	ZINC000819263459	DE	On-Demand	Anodyne	CTSL	24	45
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CCc1ccccc1	ZINC000819263459	DE	On-Demand	Anodyne	PGA	37	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CCc1ccccc1	ZINC000819263459	DE	On-Demand	Anodyne	TACR3	17	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CCc1ccccc1	ZINC000819263459	DE	On-Demand	Anodyne	MMP3	36	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CCc1ccccc1	ZINC000819263459	DE	On-Demand	Anodyne	REN	55	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CCc1ccccc1	ZINC000819263459	DE	On-Demand	Anodyne	CAPN1	41	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CCc1ccccc1	ZINC000819263459	DE	On-Demand	Anodyne	CAPN2	68	34
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CCc1ccccc1	ZINC000819263459	DE	On-Demand	Anodyne	LAP3	44	36
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CCc1ccccc1	ZINC000819263459	DE	On-Demand	Anodyne	FPR1	55	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)CCc1ccccc1	ZINC000819263459	DE	On-Demand	Anodyne	NPR	62	35
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CCc1ccccc1	ZINC000819263460	DE	On-Demand	Anodyne	ADRB2	26	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CCc1ccccc1	ZINC000819263460	DE	On-Demand	Anodyne	ADRB1	26	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CCc1ccccc1	ZINC000819263460	DE	On-Demand	Anodyne	MME	41	39
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CCc1ccccc1	ZINC000819263460	DE	On-Demand	Anodyne	ANPEP	48	34
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CCc1ccccc1	ZINC000819263460	DE	On-Demand	Anodyne	CTSD	21	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CCc1ccccc1	ZINC000819263460	DE	On-Demand	Anodyne	PGC	31	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CCc1ccccc1	ZINC000819263460	DE	On-Demand	Anodyne	PAPA1_CARPA	42	45
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CCc1ccccc1	ZINC000819263460	DE	On-Demand	Anodyne	CTSK	28	53
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CCc1ccccc1	ZINC000819263460	DE	On-Demand	Anodyne	CTSL	24	45
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CCc1ccccc1	ZINC000819263460	DE	On-Demand	Anodyne	PGA	37	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CCc1ccccc1	ZINC000819263460	DE	On-Demand	Anodyne	TACR3	17	44
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CCc1ccccc1	ZINC000819263460	DE	On-Demand	Anodyne	MMP3	36	43
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CCc1ccccc1	ZINC000819263460	DE	On-Demand	Anodyne	REN	55	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CCc1ccccc1	ZINC000819263460	DE	On-Demand	Anodyne	CAPN1	41	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CCc1ccccc1	ZINC000819263460	DE	On-Demand	Anodyne	CAPN2	68	34
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CCc1ccccc1	ZINC000819263460	DE	On-Demand	Anodyne	LAP3	44	36
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CCc1ccccc1	ZINC000819263460	DE	On-Demand	Anodyne	FPR1	55	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)CCc1ccccc1	ZINC000819263460	DE	On-Demand	Anodyne	NPR	62	35
C[C@@H](CNC(=O)OC(C)(C)C)NCCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000819263463	FE	On-Demand	Bother	COLA	81	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](O)c1ccc(F)cc1	ZINC000819263475	DE	On-Demand	Anodyne	PAPA1_CARPA	26	41
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](O)c1ccc(F)cc1	ZINC000819263476	DE	On-Demand	Anodyne	PAPA1_CARPA	26	41
C[C@@H](CNC(=O)OC(C)(C)C)NCCC(=O)Nc1ccccc1	ZINC000819263492	DF	On-Demand	Anodyne	LTA4H	26	48
C[C@@H](CNC(=O)OC(C)(C)C)NCCC(=O)Nc1ccccc1	ZINC000819263492	DF	On-Demand	Anodyne	PAPA1_CARPA	30	40
C[C@@H](CNC(=O)OC(C)(C)C)NCCC(=O)Nc1ccccc1	ZINC000819263492	DF	On-Demand	Anodyne	FPR1	44	35
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCOc3c2ccc(Cl)c3Cl)c1	ZINC000819263495	GI	On-Demand	Bother	LUXR	17	42
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCOc3c2ccc(Cl)c3Cl)c1	ZINC000819263496	GI	On-Demand	Bother	LUXR	17	42
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCOc3c2ccc(Cl)c3Cl)c1	ZINC000819263497	GI	On-Demand	Bother	LUXR	17	42
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCOc3c2ccc(Cl)c3Cl)c1	ZINC000819263498	GI	On-Demand	Bother	LUXR	17	42
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@@H](C#N)CCC#N	ZINC000819263499	CD	On-Demand	Mild	PAPA1_CARPA	34	40
C[C@@H](CNC(=O)OC(C)(C)C)NC[C@H](C#N)CCC#N	ZINC000819263500	CD	On-Demand	Mild	PAPA1_CARPA	34	40
Cc1ccc(OC[C@@H](O)CN[C@@H](C)CNC(=O)OC(C)(C)C)cc1	ZINC000819263506	EE	On-Demand	Anodyne	ADRB2	52	64
Cc1ccc(OC[C@@H](O)CN[C@@H](C)CNC(=O)OC(C)(C)C)cc1	ZINC000819263506	EE	On-Demand	Anodyne	ADRB1	62	52
Cc1ccc(OC[C@@H](O)CN[C@@H](C)CNC(=O)OC(C)(C)C)cc1	ZINC000819263506	EE	On-Demand	Anodyne	ADRB3	31	48
Cc1ccc(OC[C@H](O)CN[C@@H](C)CNC(=O)OC(C)(C)C)cc1	ZINC000819263507	EE	On-Demand	Anodyne	ADRB2	52	64
Cc1ccc(OC[C@H](O)CN[C@@H](C)CNC(=O)OC(C)(C)C)cc1	ZINC000819263507	EE	On-Demand	Anodyne	ADRB1	62	52
Cc1ccc(OC[C@H](O)CN[C@@H](C)CNC(=O)OC(C)(C)C)cc1	ZINC000819263507	EE	On-Demand	Anodyne	ADRB3	31	48
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263512	DG	On-Demand	Anodyne	ACE	43	44
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263512	DG	On-Demand	Anodyne	FKBP1A	105	53
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263512	DG	On-Demand	Anodyne	CELA1	26	48
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263512	DG	On-Demand	Anodyne	ELANE	30	41
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263512	DG	On-Demand	Anodyne	CTRA_BOVIN	61	33
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263512	DG	On-Demand	Anodyne	TRY1_BOVIN	55	33
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263512	DG	On-Demand	Anodyne	CTSG	42	33
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263512	DG	On-Demand	Anodyne	PREP	103	48
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263512	DG	On-Demand	Anodyne	CELA2A	49	33
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263512	DG	On-Demand	Anodyne	LGMN	71	42
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263512	DG	On-Demand	Anodyne	KLK5	26	50
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263512	DG	On-Demand	Anodyne	SLC12A5	65	36
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263513	DG	On-Demand	Anodyne	ACE	43	44
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263513	DG	On-Demand	Anodyne	FKBP1A	105	53
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263513	DG	On-Demand	Anodyne	CELA1	26	48
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263513	DG	On-Demand	Anodyne	ELANE	30	41
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263513	DG	On-Demand	Anodyne	CTRA_BOVIN	61	33
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263513	DG	On-Demand	Anodyne	TRY1_BOVIN	55	33
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263513	DG	On-Demand	Anodyne	CTSG	42	33
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263513	DG	On-Demand	Anodyne	PREP	103	48
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263513	DG	On-Demand	Anodyne	CELA2A	49	33
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263513	DG	On-Demand	Anodyne	LGMN	71	42
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263513	DG	On-Demand	Anodyne	KLK5	26	50
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)C(F)=C1CCC1	ZINC000819263513	DG	On-Demand	Anodyne	SLC12A5	65	36
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1nsc2ccccc12	ZINC000819263514	GH	On-Demand	Anodyne	ACE	31	44
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1nsc2ccccc12	ZINC000819263514	GH	On-Demand	Anodyne	FKBP1A	77	50
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1nsc2ccccc12	ZINC000819263514	GH	On-Demand	Anodyne	CELA1	20	43
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1nsc2ccccc12	ZINC000819263514	GH	On-Demand	Anodyne	CPT2	41	33
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1nsc2ccccc12	ZINC000819263514	GH	On-Demand	Anodyne	PREP	98	48
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1nsc2ccccc12	ZINC000819263514	GH	On-Demand	Anodyne	LGMN	66	38
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1nsc2ccccc12	ZINC000819263514	GH	On-Demand	Anodyne	KLK5	23	43
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1nsc2ccccc12	ZINC000819263514	GH	On-Demand	Anodyne	TMPRSS11D	41	34
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1nsc2ccccc12	ZINC000819263515	GH	On-Demand	Anodyne	ACE	31	44
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1nsc2ccccc12	ZINC000819263515	GH	On-Demand	Anodyne	FKBP1A	77	50
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1nsc2ccccc12	ZINC000819263515	GH	On-Demand	Anodyne	CELA1	20	43
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1nsc2ccccc12	ZINC000819263515	GH	On-Demand	Anodyne	CPT2	41	33
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1nsc2ccccc12	ZINC000819263515	GH	On-Demand	Anodyne	PREP	98	48
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1nsc2ccccc12	ZINC000819263515	GH	On-Demand	Anodyne	LGMN	66	38
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1nsc2ccccc12	ZINC000819263515	GH	On-Demand	Anodyne	KLK5	23	43
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1nsc2ccccc12	ZINC000819263515	GH	On-Demand	Anodyne	TMPRSS11D	41	34
O[C@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(F)cc1Cl	ZINC000819263542	GG	On-Demand	Anodyne	DRD4	26	45
O[C@@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc(F)cc1Cl	ZINC000819263543	GG	On-Demand	Anodyne	DRD4	26	45
O[C@@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(F)cc1Cl	ZINC000819263544	GG	On-Demand	Anodyne	DRD4	26	45
O[C@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc(F)cc1Cl	ZINC000819263545	GG	On-Demand	Anodyne	DRD4	26	45
CCn1c(S)nnc1C1CCN(C(=O)c2coc3c(C)cccc23)CC1	ZINC000819263546	FH	On-Demand	Anodyne	TPSAB1	25	42
C[C@@H](CC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263552	EF	On-Demand	Anodyne	F2	39	43
C[C@@H](CC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263552	EF	On-Demand	Anodyne	PRSS1	15	43
C[C@@H](CC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263552	EF	On-Demand	Anodyne	ACE	53	46
C[C@@H](CC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263552	EF	On-Demand	Anodyne	FKBP1A	100	52
C[C@@H](CC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263552	EF	On-Demand	Anodyne	CELA1	31	45
C[C@@H](CC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263552	EF	On-Demand	Anodyne	ELANE	37	43
C[C@@H](CC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263552	EF	On-Demand	Anodyne	CTRA_BOVIN	61	33
C[C@@H](CC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263552	EF	On-Demand	Anodyne	TRY1_BOVIN	52	33
C[C@@H](CC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263552	EF	On-Demand	Anodyne	CTSG	42	33
C[C@@H](CC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263552	EF	On-Demand	Anodyne	HLA-A	41	33
C[C@@H](CC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263552	EF	On-Demand	Anodyne	DPP4	37	42
C[C@@H](CC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263552	EF	On-Demand	Anodyne	PREP	122	46
C[C@@H](CC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263552	EF	On-Demand	Anodyne	CELA2A	50	33
C[C@@H](CC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263552	EF	On-Demand	Anodyne	LGMN	77	44
C[C@@H](CC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263552	EF	On-Demand	Anodyne	KLK5	23	43
C[C@@H](CC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263552	EF	On-Demand	Anodyne	XIAP	41	37
C[C@@H](CC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263552	EF	On-Demand	Anodyne	BRCA1	43	31
C[C@@H](CC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263552	EF	On-Demand	Anodyne	SLC12A5	62	34
C[C@@H](CC(=O)N1CCC[C@@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263552	EF	On-Demand	Anodyne	TMPRSS11D	46	34
C[C@@H](CC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263554	EF	On-Demand	Anodyne	F2	39	43
C[C@@H](CC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263554	EF	On-Demand	Anodyne	PRSS1	15	43
C[C@@H](CC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263554	EF	On-Demand	Anodyne	ACE	53	46
C[C@@H](CC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263554	EF	On-Demand	Anodyne	FKBP1A	100	52
C[C@@H](CC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263554	EF	On-Demand	Anodyne	CELA1	31	45
C[C@@H](CC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263554	EF	On-Demand	Anodyne	ELANE	37	43
C[C@@H](CC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263554	EF	On-Demand	Anodyne	CTRA_BOVIN	61	33
C[C@@H](CC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263554	EF	On-Demand	Anodyne	TRY1_BOVIN	52	33
C[C@@H](CC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263554	EF	On-Demand	Anodyne	CTSG	42	33
C[C@@H](CC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263554	EF	On-Demand	Anodyne	HLA-A	41	33
C[C@@H](CC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263554	EF	On-Demand	Anodyne	DPP4	37	42
C[C@@H](CC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263554	EF	On-Demand	Anodyne	PREP	122	46
C[C@@H](CC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263554	EF	On-Demand	Anodyne	CELA2A	50	33
C[C@@H](CC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263554	EF	On-Demand	Anodyne	LGMN	77	44
C[C@@H](CC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263554	EF	On-Demand	Anodyne	KLK5	23	43
C[C@@H](CC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263554	EF	On-Demand	Anodyne	XIAP	41	37
C[C@@H](CC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263554	EF	On-Demand	Anodyne	BRCA1	43	31
C[C@@H](CC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263554	EF	On-Demand	Anodyne	SLC12A5	62	34
C[C@@H](CC(=O)N1CCC[C@H]1C(=O)OCc1ccccc1)n1cccn1	ZINC000819263554	EF	On-Demand	Anodyne	TMPRSS11D	46	34
C=CCC1(C(=O)NNC(=O)c2ccccc2OC)CCOCC1	ZINC000819263556	DD	On-Demand	Reactive	KCNA3	50	42
C=CCC1(C(=O)NNC(=O)c2ccccc2OC)CCOCC1	ZINC000819263556	DD	On-Demand	Reactive	HCN1	74	40
C=CCC1(C(=O)NNC(=O)c2ccccc2OC)CCOCC1	ZINC000819263556	DD	On-Demand	Reactive	HCN4	50	38
O[C@@H](CNC1CCN(c2cccnn2)CC1)c1ccccc1C(F)(F)F	ZINC000819263557	FF	On-Demand	Anodyne	SCD1	57	43
O[C@@H](CNC1CCN(c2cccnn2)CC1)c1ccccc1C(F)(F)F	ZINC000819263557	FF	On-Demand	Anodyne	SCD	57	43
O[C@H](CNC1CCN(c2cccnn2)CC1)c1ccccc1C(F)(F)F	ZINC000819263558	FF	On-Demand	Anodyne	SCD1	57	43
O[C@H](CNC1CCN(c2cccnn2)CC1)c1ccccc1C(F)(F)F	ZINC000819263558	FF	On-Demand	Anodyne	SCD	57	43
O[C@@H](CNC1CCN(c2cccnn2)CC1)c1ccc(Cl)cc1	ZINC000819263561	EE	On-Demand	Anodyne	ADRB3	25	40
O[C@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1cccc(Cl)c1	ZINC000819263601	FG	On-Demand	Anodyne	ADRB1	32	43
O[C@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1cccc(Cl)c1	ZINC000819263601	FG	On-Demand	Anodyne	DRD4	27	43
O[C@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1cccc(Cl)c1	ZINC000819263601	FG	On-Demand	Anodyne	ADRB3	44	43
O[C@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccc(Cl)c1	ZINC000819263602	FG	On-Demand	Anodyne	ADRB1	32	43
O[C@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccc(Cl)c1	ZINC000819263602	FG	On-Demand	Anodyne	DRD4	27	43
O[C@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccc(Cl)c1	ZINC000819263602	FG	On-Demand	Anodyne	ADRB3	44	43
O[C@@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccc(Cl)c1	ZINC000819263603	FG	On-Demand	Anodyne	ADRB1	32	43
O[C@@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccc(Cl)c1	ZINC000819263603	FG	On-Demand	Anodyne	DRD4	27	43
O[C@@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccc(Cl)c1	ZINC000819263603	FG	On-Demand	Anodyne	ADRB3	44	43
O[C@@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1cccc(Cl)c1	ZINC000819263604	FG	On-Demand	Anodyne	ADRB1	32	43
O[C@@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1cccc(Cl)c1	ZINC000819263604	FG	On-Demand	Anodyne	DRD4	27	43
O[C@@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1cccc(Cl)c1	ZINC000819263604	FG	On-Demand	Anodyne	ADRB3	44	43
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(-n3nccn3)nc2)C1	ZINC000819263611	DC	On-Demand	Anodyne	DGAT1	41	38
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(-n3nccn3)nc2)C1	ZINC000819263612	DC	On-Demand	Anodyne	DGAT1	41	38
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)c(C(F)(F)F)c1)C1CC1	ZINC000819263613	GF	On-Demand	Anodyne	TRPV1	16	45
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)c(C(F)(F)F)c1)C1CC1	ZINC000819263613	GF	On-Demand	Anodyne	MAPK1	19	40
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)c(C(F)(F)F)c1)C1CC1	ZINC000819263613	GF	On-Demand	Anodyne	EPHX2	41	45
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)c(C(F)(F)F)c1)C1CC1	ZINC000819263613	GF	On-Demand	Anodyne	RBP4	83	42
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)c(C(F)(F)F)c1)C1CC1	ZINC000819263613	GF	On-Demand	Anodyne	SFRP1	85	36
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)c(C(F)(F)F)c1)C1CC1	ZINC000819263613	GF	On-Demand	Anodyne	WNT3	58	33
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c(C(F)(F)F)c1)C1CC1	ZINC000819263614	GF	On-Demand	Anodyne	TRPV1	16	45
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c(C(F)(F)F)c1)C1CC1	ZINC000819263614	GF	On-Demand	Anodyne	MAPK1	19	40
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c(C(F)(F)F)c1)C1CC1	ZINC000819263614	GF	On-Demand	Anodyne	EPHX2	41	45
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c(C(F)(F)F)c1)C1CC1	ZINC000819263614	GF	On-Demand	Anodyne	RBP4	83	42
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c(C(F)(F)F)c1)C1CC1	ZINC000819263614	GF	On-Demand	Anodyne	SFRP1	85	36
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c(C(F)(F)F)c1)C1CC1	ZINC000819263614	GF	On-Demand	Anodyne	WNT3	58	33
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(-c3ccccc3)cc2F)C1	ZINC000819263615	EG	On-Demand	Anodyne	SLC6A1	72	38
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(-c3ccccc3)cc2F)C1	ZINC000819263615	EG	On-Demand	Anodyne	DHODH	34	46
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(-c3ccccc3)cc2F)C1	ZINC000819263615	EG	On-Demand	Anodyne	RBP4	57	37
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(-c3ccccc3)cc2F)C1	ZINC000819263615	EG	On-Demand	Anodyne	DGAT1	32	46
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(-c3ccccc3)cc2F)C1	ZINC000819263616	EG	On-Demand	Anodyne	SLC6A1	72	38
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(-c3ccccc3)cc2F)C1	ZINC000819263616	EG	On-Demand	Anodyne	DHODH	34	46
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(-c3ccccc3)cc2F)C1	ZINC000819263616	EG	On-Demand	Anodyne	RBP4	57	37
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(-c3ccccc3)cc2F)C1	ZINC000819263616	EG	On-Demand	Anodyne	DGAT1	32	46
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2CN2CCCCC2)C1	ZINC000819263617	EE	On-Demand	Anodyne	SLC6A1	158	41
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2CN2CCCCC2)C1	ZINC000819263617	EE	On-Demand	Anodyne	HRH3	21	44
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2CN2CCCCC2)C1	ZINC000819263617	EE	On-Demand	Anodyne	SIGMAR1	28	45
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2CN2CCCCC2)C1	ZINC000819263617	EE	On-Demand	Anodyne	EPHX2	35	51
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2CN2CCCCC2)C1	ZINC000819263618	EE	On-Demand	Anodyne	SLC6A1	158	41
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2CN2CCCCC2)C1	ZINC000819263618	EE	On-Demand	Anodyne	HRH3	21	44
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2CN2CCCCC2)C1	ZINC000819263618	EE	On-Demand	Anodyne	SIGMAR1	28	45
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2CN2CCCCC2)C1	ZINC000819263618	EE	On-Demand	Anodyne	EPHX2	35	51
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)C1	ZINC000819263619	GD	On-Demand	Anodyne	ESR1	69	37
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)C1	ZINC000819263619	GD	On-Demand	Anodyne	HRH2	55	44
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)C1	ZINC000819263619	GD	On-Demand	Anodyne	SLC6A1	70	35
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)C1	ZINC000819263619	GD	On-Demand	Anodyne	ESR2	47	37
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)C1	ZINC000819263619	GD	On-Demand	Anodyne	LTA4H	35	48
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)C1	ZINC000819263619	GD	On-Demand	Anodyne	CASR	40	37
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)C1	ZINC000819263619	GD	On-Demand	Anodyne	HRH3	44	42
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)C1	ZINC000819263619	GD	On-Demand	Anodyne	MMP13	20	44
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)C1	ZINC000819263619	GD	On-Demand	Anodyne	EPHX2	37	49
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)C1	ZINC000819263620	GD	On-Demand	Anodyne	ESR1	69	37
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)C1	ZINC000819263620	GD	On-Demand	Anodyne	HRH2	55	44
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)C1	ZINC000819263620	GD	On-Demand	Anodyne	SLC6A1	70	35
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)C1	ZINC000819263620	GD	On-Demand	Anodyne	ESR2	47	37
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)C1	ZINC000819263620	GD	On-Demand	Anodyne	LTA4H	35	48
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)C1	ZINC000819263620	GD	On-Demand	Anodyne	CASR	40	37
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)C1	ZINC000819263620	GD	On-Demand	Anodyne	HRH3	44	42
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)C1	ZINC000819263620	GD	On-Demand	Anodyne	MMP13	20	44
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(OCCN3CCOCC3)c2)C1	ZINC000819263620	GD	On-Demand	Anodyne	EPHX2	37	49
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819263621	FC	On-Demand	Anodyne	PREP	16	41
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819263621	FC	On-Demand	Anodyne	EPHX2	21	43
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819263621	FC	On-Demand	Anodyne	L3MBTL3	56	41
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819263622	FC	On-Demand	Anodyne	PREP	16	41
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819263622	FC	On-Demand	Anodyne	EPHX2	21	43
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819263622	FC	On-Demand	Anodyne	L3MBTL3	56	41
O=C(O)[C@@H]1CCN(C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000819263624	DC	On-Demand	Anodyne	SCN2A	17	42
O=C(O)[C@@H]1CCN(C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000819263624	DC	On-Demand	Anodyne	NOS2	100	40
O=C(O)[C@@H]1CCN(C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000819263624	DC	On-Demand	Anodyne	EPHX2	17	43
O=C(O)[C@@H]1CCN(C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000819263624	DC	On-Demand	Anodyne	SCN10A	21	42
O=C(O)[C@H]1CCN(C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000819263625	DC	On-Demand	Anodyne	SCN2A	17	42
O=C(O)[C@H]1CCN(C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000819263625	DC	On-Demand	Anodyne	NOS2	100	40
O=C(O)[C@H]1CCN(C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000819263625	DC	On-Demand	Anodyne	EPHX2	17	43
O=C(O)[C@H]1CCN(C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000819263625	DC	On-Demand	Anodyne	SCN10A	21	42
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(N3CCN(C(=O)C4CC4)CC3)nc2)C1	ZINC000819263626	GD	On-Demand	Anodyne	DGAT1	55	52
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(N3CCN(C(=O)C4CC4)CC3)nc2)C1	ZINC000819263627	GD	On-Demand	Anodyne	DGAT1	55	52
O=C(O)[C@H]1CCN(C(=O)Nc2cc(F)c(N3CCCC3)c(F)c2)C1	ZINC000819263628	EF	On-Demand	Anodyne	SLC6A1	49	33
O=C(O)[C@@H]1CCN(C(=O)Nc2cc(F)c(N3CCCC3)c(F)c2)C1	ZINC000819263629	EF	On-Demand	Anodyne	SLC6A1	49	33
O=C(O)C1CCN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)CC1	ZINC000819263630	FD	On-Demand	Anodyne	EPHX2	34	42
O=C(O)C1CCN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)CC1	ZINC000819263630	FD	On-Demand	Anodyne	TGM2	32	48
O=C(O)C1CCN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)CC1	ZINC000819263630	FD	On-Demand	Anodyne	F13A1	56	48
O=C(O)C1CCN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)CC1	ZINC000819263630	FD	On-Demand	Anodyne	CCR8	84	44
O=C(O)C1CCN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)CC1	ZINC000819263630	FD	On-Demand	Anodyne	SFRP1	134	42
O=C(O)C1CCN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)CC1	ZINC000819263630	FD	On-Demand	Anodyne	WNT3	91	42
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)C1	ZINC000819263631	FD	On-Demand	Anodyne	MLNR	24	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)C1	ZINC000819263631	FD	On-Demand	Anodyne	EPHX2	39	44
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)C1	ZINC000819263632	FD	On-Demand	Anodyne	MLNR	24	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)C1	ZINC000819263632	FD	On-Demand	Anodyne	EPHX2	39	44
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CC(=O)N3CCSCC3)cc2)C1	ZINC000819263633	GD	On-Demand	Anodyne	MLNR	24	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CC(=O)N3CCSCC3)cc2)C1	ZINC000819263633	GD	On-Demand	Anodyne	EPHX2	24	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CC(=O)N3CCSCC3)cc2)C1	ZINC000819263634	GD	On-Demand	Anodyne	MLNR	24	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CC(=O)N3CCSCC3)cc2)C1	ZINC000819263634	GD	On-Demand	Anodyne	EPHX2	24	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)C1	ZINC000819263635	FE	On-Demand	Anodyne	NPY2R	56	46
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)C1	ZINC000819263636	FE	On-Demand	Anodyne	NPY2R	56	46
O=C(O)[C@H]1CCN(C(=O)Nc2ccc([S@](=O)C(F)(F)F)cc2)C1	ZINC000819263639	FE	On-Demand	Anodyne	EPHX2	47	39
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc([S@@](=O)C(F)(F)F)cc2)C1	ZINC000819263640	FE	On-Demand	Anodyne	EPHX2	47	39
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc([S@](=O)C(F)(F)F)cc2)C1	ZINC000819263641	FE	On-Demand	Anodyne	EPHX2	47	39
O=C(O)[C@H]1CCN(C(=O)Nc2ccc([S@@](=O)C(F)(F)F)cc2)C1	ZINC000819263642	FE	On-Demand	Anodyne	EPHX2	47	39
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)C1	ZINC000819263643	FD	On-Demand	Anodyne	SLC6A1	91	35
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)C1	ZINC000819263643	FD	On-Demand	Anodyne	SIGMAR1	26	45
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)C1	ZINC000819263643	FD	On-Demand	Anodyne	EPHX2	24	48
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)C1	ZINC000819263644	FD	On-Demand	Anodyne	SLC6A1	91	35
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)C1	ZINC000819263644	FD	On-Demand	Anodyne	SIGMAR1	26	45
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)C1	ZINC000819263644	FD	On-Demand	Anodyne	EPHX2	24	48
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COCCOc3ccccc3)c2)C1	ZINC000819263645	GG	On-Demand	Anodyne	HRH2	41	41
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COCCOc3ccccc3)c2)C1	ZINC000819263645	GG	On-Demand	Anodyne	SLC6A1	45	35
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COCCOc3ccccc3)c2)C1	ZINC000819263645	GG	On-Demand	Anodyne	LTA4H	29	43
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COCCOc3ccccc3)c2)C1	ZINC000819263645	GG	On-Demand	Anodyne	CYSLTR2	52	34
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COCCOc3ccccc3)c2)C1	ZINC000819263645	GG	On-Demand	Anodyne	CCR3	23	44
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COCCOc3ccccc3)c2)C1	ZINC000819263645	GG	On-Demand	Anodyne	FAAH	24	43
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COCCOc3ccccc3)c2)C1	ZINC000819263645	GG	On-Demand	Anodyne	P2RY14	44	35
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COCCOc3ccccc3)c2)C1	ZINC000819263646	GG	On-Demand	Anodyne	HRH2	41	41
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COCCOc3ccccc3)c2)C1	ZINC000819263646	GG	On-Demand	Anodyne	SLC6A1	45	35
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COCCOc3ccccc3)c2)C1	ZINC000819263646	GG	On-Demand	Anodyne	LTA4H	29	43
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COCCOc3ccccc3)c2)C1	ZINC000819263646	GG	On-Demand	Anodyne	CYSLTR2	52	34
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COCCOc3ccccc3)c2)C1	ZINC000819263646	GG	On-Demand	Anodyne	CCR3	23	44
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COCCOc3ccccc3)c2)C1	ZINC000819263646	GG	On-Demand	Anodyne	FAAH	24	43
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COCCOc3ccccc3)c2)C1	ZINC000819263646	GG	On-Demand	Anodyne	P2RY14	44	35
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819263648	ED	On-Demand	Anodyne	ITGAL	43	36
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819263648	ED	On-Demand	Anodyne	CASR	28	41
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819263648	ED	On-Demand	Anodyne	NPY2R	23	42
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819263648	ED	On-Demand	Anodyne	EPHX2	42	57
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819263648	ED	On-Demand	Anodyne	L3MBTL3	75	43
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819263649	ED	On-Demand	Anodyne	ITGAL	43	36
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819263649	ED	On-Demand	Anodyne	CASR	28	41
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819263649	ED	On-Demand	Anodyne	NPY2R	23	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819263649	ED	On-Demand	Anodyne	EPHX2	42	57
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819263649	ED	On-Demand	Anodyne	L3MBTL3	75	43
O=C(O)C1CCN(C(=O)NCc2ccc3c(c2)COC3)CC1	ZINC000819263650	DD	On-Demand	Anodyne	EPHX2	15	52
O=C(O)C1CCN(C(=O)NCc2cn(-c3ccccc3)nn2)CC1	ZINC000819263655	ED	On-Demand	Anodyne	EPHX2	28	48
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(Cl)c3ncccc23)C1	ZINC000819263656	DF	On-Demand	Anodyne	RBP4	45	33
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(Cl)c3ncccc23)C1	ZINC000819263657	DF	On-Demand	Anodyne	RBP4	45	33
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(O)cc2)C1	ZINC000819263658	CD	On-Demand	Anodyne	EPHX2	19	49
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(O)cc2)C1	ZINC000819263658	CD	On-Demand	Anodyne	DPP7	50	35
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(O)cc2)C1	ZINC000819263658	CD	On-Demand	Anodyne	NPSR1	26	40
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(O)cc2)C1	ZINC000819263658	CD	On-Demand	Anodyne	NAMPT	37	43
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(O)cc2)C1	ZINC000819263659	CD	On-Demand	Anodyne	EPHX2	19	49
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(O)cc2)C1	ZINC000819263659	CD	On-Demand	Anodyne	DPP7	50	35
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(O)cc2)C1	ZINC000819263659	CD	On-Demand	Anodyne	NPSR1	26	40
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(O)cc2)C1	ZINC000819263659	CD	On-Demand	Anodyne	NAMPT	37	43
O=C(O)C1CCN(C(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)CC1	ZINC000819263660	GF	On-Demand	Anodyne	PDGFRB	49	40
O=C(O)C1CCN(C(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)CC1	ZINC000819263660	GF	On-Demand	Anodyne	EPHX2	19	45
O=C(O)C1CCN(C(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)CC1	ZINC000819263660	GF	On-Demand	Anodyne	SMO	37	46
O=C(O)C1CCN(C(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)CC1	ZINC000819263660	GF	On-Demand	Anodyne	ETHR	52	34
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)C1	ZINC000819263665	FE	On-Demand	Anodyne	EPHX2	32	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)C1	ZINC000819263665	FE	On-Demand	Anodyne	F13A1	15	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)C1	ZINC000819263666	FE	On-Demand	Anodyne	EPHX2	32	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)C1	ZINC000819263666	FE	On-Demand	Anodyne	F13A1	15	41
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1	ZINC000819263667	ED	On-Demand	Clean	STAT6	49	36
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1	ZINC000819263667	ED	On-Demand	Clean	NAMPT	39	40
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1	ZINC000819263668	ED	On-Demand	Clean	STAT6	49	36
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)cc2)C1	ZINC000819263668	ED	On-Demand	Clean	NAMPT	39	40
O=C(O)C1CCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)CC1	ZINC000819263669	GD	On-Demand	Anodyne	SIGMAR1	28	46
O=C(O)C1CCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)CC1	ZINC000819263669	GD	On-Demand	Anodyne	EPHX2	32	55
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(-c3nnc4n3CCC4)c2)C1	ZINC000819263670	ED	On-Demand	Anodyne	P2RY14	43	35
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(-c3nnc4n3CCC4)c2)C1	ZINC000819263671	ED	On-Demand	Anodyne	P2RY14	43	35
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(N3CCOC3=O)c2)C1	ZINC000819263672	ED	On-Demand	Anodyne	NPSR1	25	40
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(N3CCOC3=O)c2)C1	ZINC000819263673	ED	On-Demand	Anodyne	NPSR1	25	40
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1	ZINC000819263674	DD	On-Demand	Clean	SLC6A1	59	33
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1	ZINC000819263674	DD	On-Demand	Clean	EPHX2	21	47
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1	ZINC000819263674	DD	On-Demand	Clean	DPP7	55	36
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1	ZINC000819263674	DD	On-Demand	Clean	L3MBTL3	65	39
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1	ZINC000819263674	DD	On-Demand	Clean	NAMPT	36	42
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1	ZINC000819263675	DD	On-Demand	Clean	SLC6A1	59	33
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1	ZINC000819263675	DD	On-Demand	Clean	EPHX2	21	47
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1	ZINC000819263675	DD	On-Demand	Clean	DPP7	55	36
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1	ZINC000819263675	DD	On-Demand	Clean	L3MBTL3	65	39
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1	ZINC000819263675	DD	On-Demand	Clean	NAMPT	36	42
O=C(O)[C@@H]1CCN(C(=O)NCc2nncn2-c2ccccc2)C1	ZINC000819263679	DC	On-Demand	Anodyne	EPHX2	17	42
O=C(O)[C@H]1CCN(C(=O)NCc2nncn2-c2ccccc2)C1	ZINC000819263680	DC	On-Demand	Anodyne	EPHX2	17	42
O=C(O)C1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819263681	GF	On-Demand	Anodyne	ESR1	88	38
O=C(O)C1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819263681	GF	On-Demand	Anodyne	HTR2A	19	41
O=C(O)C1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819263681	GF	On-Demand	Anodyne	SLC6A1	116	37
O=C(O)C1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819263681	GF	On-Demand	Anodyne	KCNH2	16	41
O=C(O)C1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819263681	GF	On-Demand	Anodyne	ESR2	62	45
O=C(O)C1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819263681	GF	On-Demand	Anodyne	PDGFRB	58	47
O=C(O)C1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819263681	GF	On-Demand	Anodyne	LTA4H	88	57
O=C(O)C1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819263681	GF	On-Demand	Anodyne	HRH3	92	60
O=C(O)C1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819263681	GF	On-Demand	Anodyne	CHRNA7	22	41
O=C(O)C1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819263681	GF	On-Demand	Anodyne	FAAH	15	40
O=C(O)C1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819263681	GF	On-Demand	Anodyne	EPHX2	59	48
O=C(O)C1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819263681	GF	On-Demand	Anodyne	FLT3	19	47
O=C(O)C1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819263681	GF	On-Demand	Anodyne	MCHR1	19	45
O=C(O)C1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819263681	GF	On-Demand	Anodyne	PSMB2	51	47
O=C(O)C1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819263681	GF	On-Demand	Anodyne	PSMB1	56	48
O=C(O)C1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819263681	GF	On-Demand	Anodyne	TBK1	16	43
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2Cn2cncn2)C1	ZINC000819263688	EC	On-Demand	Anodyne	EPHX2	20	45
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2Cn2cncn2)C1	ZINC000819263689	EC	On-Demand	Anodyne	EPHX2	20	45
O=C(O)C1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)CC1	ZINC000819263690	FH	On-Demand	Anodyne	PDGFRB	38	43
O=C(O)C1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)CC1	ZINC000819263690	FH	On-Demand	Anodyne	GRIN2B	41	41
O=C(O)C1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)CC1	ZINC000819263690	FH	On-Demand	Anodyne	LTA4H	33	44
O=C(O)C1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)CC1	ZINC000819263690	FH	On-Demand	Anodyne	SIGMAR1	17	45
O=C(O)C1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)CC1	ZINC000819263690	FH	On-Demand	Anodyne	FAAH	15	46
O=C(O)C1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)CC1	ZINC000819263690	FH	On-Demand	Anodyne	EPHX2	61	43
O=C(O)C1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)CC1	ZINC000819263690	FH	On-Demand	Anodyne	TGM2	32	42
O=C(O)C1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)CC1	ZINC000819263690	FH	On-Demand	Anodyne	F13A1	45	42
O=C(O)C1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)CC1	ZINC000819263690	FH	On-Demand	Anodyne	SLC12A5	43	36
O=C(O)[C@@H]1CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000819263691	DC	On-Demand	Anodyne	NOS2	115	45
O=C(O)[C@H]1CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000819263692	DC	On-Demand	Anodyne	NOS2	115	45
O=C(O)C1CCN(C(=O)Nc2ccc(N3CCSCC3)cc2)CC1	ZINC000819263693	EF	On-Demand	Anodyne	MTOR	26	40
O=C(O)C1CCN(C(=O)Nc2ccc(N3CCSCC3)cc2)CC1	ZINC000819263693	EF	On-Demand	Anodyne	EPHX2	30	42
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(N3CCCC3)c(F)c2)C1	ZINC000819263694	DE	On-Demand	Anodyne	SLC6A1	65	35
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(N3CCCC3)c(F)c2)C1	ZINC000819263694	DE	On-Demand	Anodyne	KCNQ2	48	33
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(N3CCCC3)c(F)c2)C1	ZINC000819263694	DE	On-Demand	Anodyne	NPY2R	109	44
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(N3CCCC3)c(F)c2)C1	ZINC000819263694	DE	On-Demand	Anodyne	SLC6A9	15	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(N3CCCC3)c(F)c2)C1	ZINC000819263695	DE	On-Demand	Anodyne	SLC6A1	65	35
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(N3CCCC3)c(F)c2)C1	ZINC000819263695	DE	On-Demand	Anodyne	KCNQ2	48	33
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(N3CCCC3)c(F)c2)C1	ZINC000819263695	DE	On-Demand	Anodyne	NPY2R	109	44
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(N3CCCC3)c(F)c2)C1	ZINC000819263695	DE	On-Demand	Anodyne	SLC6A9	15	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(-c3nc4ccccc4o3)cc2)C1	ZINC000819263696	FG	On-Demand	Anodyne	MTOR	52	36
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(-c3nc4ccccc4o3)cc2)C1	ZINC000819263696	FG	On-Demand	Anodyne	FASN	20	43
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(-c3nc4ccccc4o3)cc2)C1	ZINC000819263696	FG	On-Demand	Anodyne	S1PR1	16	43
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(-c3nc4ccccc4o3)cc2)C1	ZINC000819263696	FG	On-Demand	Anodyne	SMO	24	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(-c3nc4ccccc4o3)cc2)C1	ZINC000819263696	FG	On-Demand	Anodyne	DGAT1	32	43
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(-c3nc4ccccc4o3)cc2)C1	ZINC000819263697	FG	On-Demand	Anodyne	MTOR	52	36
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(-c3nc4ccccc4o3)cc2)C1	ZINC000819263697	FG	On-Demand	Anodyne	FASN	20	43
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(-c3nc4ccccc4o3)cc2)C1	ZINC000819263697	FG	On-Demand	Anodyne	S1PR1	16	43
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(-c3nc4ccccc4o3)cc2)C1	ZINC000819263697	FG	On-Demand	Anodyne	SMO	24	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(-c3nc4ccccc4o3)cc2)C1	ZINC000819263697	FG	On-Demand	Anodyne	DGAT1	32	43
O=C(O)[C@@H]1CCN(C(=O)NCc2nnc3ccc(C(F)(F)F)cn23)C1	ZINC000819263702	FD	On-Demand	Anodyne	EPHX2	16	41
O=C(O)[C@H]1CCN(C(=O)NCc2nnc3ccc(C(F)(F)F)cn23)C1	ZINC000819263703	FD	On-Demand	Anodyne	EPHX2	16	41
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)C1	ZINC000819263706	GF	On-Demand	Anodyne	DRD4	17	41
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)C1	ZINC000819263706	GF	On-Demand	Anodyne	HDAC10	29	58
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)C1	ZINC000819263706	GF	On-Demand	Anodyne	HDAC3	32	58
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)C1	ZINC000819263706	GF	On-Demand	Anodyne	HDAC6	26	58
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)C1	ZINC000819263706	GF	On-Demand	Anodyne	FAAH	24	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)C1	ZINC000819263706	GF	On-Demand	Anodyne	CDC7	19	44
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)C1	ZINC000819263706	GF	On-Demand	Anodyne	P2RY14	45	37
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)C1	ZINC000819263707	GF	On-Demand	Anodyne	DRD4	17	41
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)C1	ZINC000819263707	GF	On-Demand	Anodyne	HDAC10	29	58
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)C1	ZINC000819263707	GF	On-Demand	Anodyne	HDAC3	32	58
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)C1	ZINC000819263707	GF	On-Demand	Anodyne	HDAC6	26	58
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)C1	ZINC000819263707	GF	On-Demand	Anodyne	FAAH	24	42
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)C1	ZINC000819263707	GF	On-Demand	Anodyne	CDC7	19	44
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(-c3cn(Cc4ccccc4)nn3)c2)C1	ZINC000819263707	GF	On-Demand	Anodyne	P2RY14	45	37
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCC2CC(OC(C)(C)C)C2)CC1	ZINC000819263722	GH	On-Demand	Anodyne	GPR119	30	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCC2CC(OC(C)(C)C)C2)CC1	ZINC000819263723	GH	On-Demand	Anodyne	GPR119	30	40
CCCCN1CCC(NC(=O)C(F)=C2CCC2)CC1	ZINC000819263737	CF	On-Demand	Anodyne	HTR4	36	40
O[C@@H](CNC[C@H]1CSCCN1Cc1ccccc1)c1ccc(F)cc1	ZINC000819263740	FG	On-Demand	Anodyne	SLC6A3	26	45
O[C@@H](CNC[C@@H]1CSCCN1Cc1ccccc1)c1ccc(F)cc1	ZINC000819263741	FG	On-Demand	Anodyne	SLC6A3	26	45
O[C@H](CNC[C@H]1CSCCN1Cc1ccccc1)c1ccc(F)cc1	ZINC000819263742	FG	On-Demand	Anodyne	SLC6A3	26	45
O[C@H](CNC[C@@H]1CSCCN1Cc1ccccc1)c1ccc(F)cc1	ZINC000819263743	FG	On-Demand	Anodyne	SLC6A3	26	45
COCCS(=O)(=O)c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819263774	ED	On-Demand	Anodyne	ADRB2	33	40
COCCS(=O)(=O)c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819263774	ED	On-Demand	Anodyne	ADRB1	39	40
COCCS(=O)(=O)c1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819263774	ED	On-Demand	Anodyne	ADRB3	79	44
COCCS(=O)(=O)c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819263775	ED	On-Demand	Anodyne	ADRB2	33	40
COCCS(=O)(=O)c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819263775	ED	On-Demand	Anodyne	ADRB1	39	40
COCCS(=O)(=O)c1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819263775	ED	On-Demand	Anodyne	ADRB3	79	44
COCCS(=O)(=O)c1ccc(CNC[C@H](O)c2ccc(F)cc2C)cc1	ZINC000819263800	GE	On-Demand	Anodyne	LEF	52	34
COCCS(=O)(=O)c1ccc(CNC[C@@H](O)c2ccc(F)cc2C)cc1	ZINC000819263801	GE	On-Demand	Anodyne	LEF	52	34
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819263809	EE	On-Demand	Anodyne	ACE	36	42
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819263809	EE	On-Demand	Anodyne	FKBP1A	89	51
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819263809	EE	On-Demand	Anodyne	CELA1	25	48
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819263809	EE	On-Demand	Anodyne	ELANE	26	40
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819263809	EE	On-Demand	Anodyne	CTRA_BOVIN	53	32
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819263809	EE	On-Demand	Anodyne	TRY1_BOVIN	51	32
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819263809	EE	On-Demand	Anodyne	CTSG	40	32
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819263809	EE	On-Demand	Anodyne	PREP	101	48
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819263809	EE	On-Demand	Anodyne	CELA2A	40	32
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819263809	EE	On-Demand	Anodyne	LGMN	66	41
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819263809	EE	On-Demand	Anodyne	KLK5	26	50
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819263809	EE	On-Demand	Anodyne	SLC12A5	57	36
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819263810	EE	On-Demand	Anodyne	ACE	36	42
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819263810	EE	On-Demand	Anodyne	FKBP1A	89	51
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819263810	EE	On-Demand	Anodyne	CELA1	25	48
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819263810	EE	On-Demand	Anodyne	ELANE	26	40
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819263810	EE	On-Demand	Anodyne	CTRA_BOVIN	53	32
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819263810	EE	On-Demand	Anodyne	TRY1_BOVIN	51	32
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819263810	EE	On-Demand	Anodyne	CTSG	40	32
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819263810	EE	On-Demand	Anodyne	PREP	101	48
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819263810	EE	On-Demand	Anodyne	CELA2A	40	32
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819263810	EE	On-Demand	Anodyne	LGMN	66	41
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819263810	EE	On-Demand	Anodyne	KLK5	26	50
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819263810	EE	On-Demand	Anodyne	SLC12A5	57	36
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)C1	ZINC000819263814	FG	On-Demand	Anodyne	CNR1	49	30
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)C1	ZINC000819263814	FG	On-Demand	Anodyne	SLC6A1	46	35
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)C1	ZINC000819263814	FG	On-Demand	Anodyne	KCNQ2	49	36
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)C1	ZINC000819263814	FG	On-Demand	Anodyne	NPY2R	90	55
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)C1	ZINC000819263814	FG	On-Demand	Anodyne	EPHX2	37	43
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)C1	ZINC000819263815	FG	On-Demand	Anodyne	CNR1	49	30
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)C1	ZINC000819263815	FG	On-Demand	Anodyne	SLC6A1	46	35
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)C1	ZINC000819263815	FG	On-Demand	Anodyne	KCNQ2	49	36
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)C1	ZINC000819263815	FG	On-Demand	Anodyne	NPY2R	90	55
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)C1	ZINC000819263815	FG	On-Demand	Anodyne	EPHX2	37	43
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819263816	ED	On-Demand	Anodyne	SLC6A1	49	33
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819263816	ED	On-Demand	Anodyne	CASR	47	37
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819263816	ED	On-Demand	Anodyne	HRH3	20	45
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819263816	ED	On-Demand	Anodyne	PIK3CA	26	44
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819263816	ED	On-Demand	Anodyne	MTOR	51	44
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819263816	ED	On-Demand	Anodyne	EPHX2	43	43
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819263816	ED	On-Demand	Anodyne	L3MBTL3	35	47
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819263817	ED	On-Demand	Anodyne	SLC6A1	49	33
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819263817	ED	On-Demand	Anodyne	CASR	47	37
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819263817	ED	On-Demand	Anodyne	HRH3	20	45
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819263817	ED	On-Demand	Anodyne	PIK3CA	26	44
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819263817	ED	On-Demand	Anodyne	MTOR	51	44
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819263817	ED	On-Demand	Anodyne	EPHX2	43	43
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819263817	ED	On-Demand	Anodyne	L3MBTL3	35	47
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)C1	ZINC000819263818	ED	On-Demand	Anodyne	DRD4	18	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)C1	ZINC000819263818	ED	On-Demand	Anodyne	SLC6A1	86	34
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)C1	ZINC000819263818	ED	On-Demand	Anodyne	SIGMAR1	29	46
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)C1	ZINC000819263818	ED	On-Demand	Anodyne	SAP2	33	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)C1	ZINC000819263819	ED	On-Demand	Anodyne	DRD4	18	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)C1	ZINC000819263819	ED	On-Demand	Anodyne	SLC6A1	86	34
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)C1	ZINC000819263819	ED	On-Demand	Anodyne	SIGMAR1	29	46
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)C1	ZINC000819263819	ED	On-Demand	Anodyne	SAP2	33	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(CN3CCOC3=O)c2)C1	ZINC000819263822	ED	On-Demand	Anodyne	P2RY14	43	33
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(CN3CCOC3=O)c2)C1	ZINC000819263823	ED	On-Demand	Anodyne	P2RY14	43	33
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)C1	ZINC000819263824	FG	On-Demand	Anodyne	SLC6A1	99	42
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)C1	ZINC000819263824	FG	On-Demand	Anodyne	PDGFRB	27	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)C1	ZINC000819263824	FG	On-Demand	Anodyne	GRIN2B	38	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)C1	ZINC000819263824	FG	On-Demand	Anodyne	LTA4H	37	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)C1	ZINC000819263824	FG	On-Demand	Anodyne	SIGMAR1	17	44
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)C1	ZINC000819263824	FG	On-Demand	Anodyne	EPHX2	53	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)C1	ZINC000819263824	FG	On-Demand	Anodyne	TGM2	32	42
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)C1	ZINC000819263824	FG	On-Demand	Anodyne	F13A1	45	42
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)C1	ZINC000819263824	FG	On-Demand	Anodyne	SLC12A5	42	35
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)C1	ZINC000819263825	FG	On-Demand	Anodyne	SLC6A1	99	42
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)C1	ZINC000819263825	FG	On-Demand	Anodyne	PDGFRB	27	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)C1	ZINC000819263825	FG	On-Demand	Anodyne	GRIN2B	38	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)C1	ZINC000819263825	FG	On-Demand	Anodyne	LTA4H	37	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)C1	ZINC000819263825	FG	On-Demand	Anodyne	SIGMAR1	17	44
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)C1	ZINC000819263825	FG	On-Demand	Anodyne	EPHX2	53	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)C1	ZINC000819263825	FG	On-Demand	Anodyne	TGM2	32	42
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)C1	ZINC000819263825	FG	On-Demand	Anodyne	F13A1	45	42
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(COCc3ccccc3)cc2)C1	ZINC000819263825	FG	On-Demand	Anodyne	SLC12A5	42	35
O=C(O)C1CCN(C(=O)Nc2ccc(CC(F)(F)F)cc2)CC1	ZINC000819263826	EG	On-Demand	Anodyne	TRPV1	15	44
O=C(O)C1CCN(C(=O)Nc2ccc(CC(F)(F)F)cc2)CC1	ZINC000819263826	EG	On-Demand	Anodyne	EPHX2	61	40
O=C(O)C1CCN(C(=O)Nc2ccc(CC(F)(F)F)cc2)CC1	ZINC000819263826	EG	On-Demand	Anodyne	RBP4	53	37
O=C(O)C1CCN(C(=O)Nc2ccc(CC(F)(F)F)cc2)CC1	ZINC000819263826	EG	On-Demand	Anodyne	TRPM8	47	37
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1)C1CC1	ZINC000819263827	DD	On-Demand	Anodyne	TRPV1	17	43
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1)C1CC1	ZINC000819263827	DD	On-Demand	Anodyne	NPY2R	15	42
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1)C1CC1	ZINC000819263827	DD	On-Demand	Anodyne	EPHX2	52	44
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1)C1CC1	ZINC000819263828	DD	On-Demand	Anodyne	TRPV1	17	43
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1)C1CC1	ZINC000819263828	DD	On-Demand	Anodyne	NPY2R	15	42
O=C(Nc1ccc(NC(=O)N2CC[C@H](C(=O)O)C2)cc1)C1CC1	ZINC000819263828	DD	On-Demand	Anodyne	EPHX2	52	44
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819263829	ED	On-Demand	Anodyne	NPY2R	22	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819263829	ED	On-Demand	Anodyne	PIK3CA	39	51
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819263829	ED	On-Demand	Anodyne	MTOR	78	51
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819263829	ED	On-Demand	Anodyne	EPHX2	46	60
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819263829	ED	On-Demand	Anodyne	PIK3CG	34	51
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819263829	ED	On-Demand	Anodyne	L3MBTL3	93	44
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819263830	ED	On-Demand	Anodyne	NPY2R	22	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819263830	ED	On-Demand	Anodyne	PIK3CA	39	51
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819263830	ED	On-Demand	Anodyne	MTOR	78	51
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819263830	ED	On-Demand	Anodyne	EPHX2	46	60
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819263830	ED	On-Demand	Anodyne	PIK3CG	34	51
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819263830	ED	On-Demand	Anodyne	L3MBTL3	93	44
O=C(O)[C@@H]1CCN(C(=O)NCc2cccnc2N2CCOCC2)C1	ZINC000819263831	EC	On-Demand	Anodyne	SCN2A	18	43
O=C(O)[C@@H]1CCN(C(=O)NCc2cccnc2N2CCOCC2)C1	ZINC000819263831	EC	On-Demand	Anodyne	MTOR	42	37
O=C(O)[C@@H]1CCN(C(=O)NCc2cccnc2N2CCOCC2)C1	ZINC000819263831	EC	On-Demand	Anodyne	EPHX2	23	45
O=C(O)[C@@H]1CCN(C(=O)NCc2cccnc2N2CCOCC2)C1	ZINC000819263831	EC	On-Demand	Anodyne	SCN10A	26	51
O=C(O)[C@H]1CCN(C(=O)NCc2cccnc2N2CCOCC2)C1	ZINC000819263832	EC	On-Demand	Anodyne	SCN2A	18	43
O=C(O)[C@H]1CCN(C(=O)NCc2cccnc2N2CCOCC2)C1	ZINC000819263832	EC	On-Demand	Anodyne	MTOR	42	37
O=C(O)[C@H]1CCN(C(=O)NCc2cccnc2N2CCOCC2)C1	ZINC000819263832	EC	On-Demand	Anodyne	EPHX2	23	45
O=C(O)[C@H]1CCN(C(=O)NCc2cccnc2N2CCOCC2)C1	ZINC000819263832	EC	On-Demand	Anodyne	SCN10A	26	51
O=C(O)[C@@H]1CCN(C(=O)NCc2ccnc(-n3cccn3)c2)C1	ZINC000819263833	DC	On-Demand	Anodyne	NOS2	60	35
O=C(O)[C@@H]1CCN(C(=O)NCc2ccnc(-n3cccn3)c2)C1	ZINC000819263833	DC	On-Demand	Anodyne	EPHX2	15	41
O=C(O)[C@H]1CCN(C(=O)NCc2ccnc(-n3cccn3)c2)C1	ZINC000819263834	DC	On-Demand	Anodyne	NOS2	60	35
O=C(O)[C@H]1CCN(C(=O)NCc2ccnc(-n3cccn3)c2)C1	ZINC000819263834	DC	On-Demand	Anodyne	EPHX2	15	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3)nc2)C1	ZINC000819263835	EF	On-Demand	Anodyne	SLC6A1	56	35
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3)nc2)C1	ZINC000819263835	EF	On-Demand	Anodyne	PDGFRB	30	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3)nc2)C1	ZINC000819263835	EF	On-Demand	Anodyne	GRIN2B	31	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3)nc2)C1	ZINC000819263835	EF	On-Demand	Anodyne	FAAH	20	42
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3)nc2)C1	ZINC000819263835	EF	On-Demand	Anodyne	DPP7	19	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3)nc2)C1	ZINC000819263835	EF	On-Demand	Anodyne	DGAT1	39	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3)nc2)C1	ZINC000819263836	EF	On-Demand	Anodyne	SLC6A1	56	35
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3)nc2)C1	ZINC000819263836	EF	On-Demand	Anodyne	PDGFRB	30	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3)nc2)C1	ZINC000819263836	EF	On-Demand	Anodyne	GRIN2B	31	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3)nc2)C1	ZINC000819263836	EF	On-Demand	Anodyne	FAAH	20	42
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3)nc2)C1	ZINC000819263836	EF	On-Demand	Anodyne	DPP7	19	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3)nc2)C1	ZINC000819263836	EF	On-Demand	Anodyne	DGAT1	39	41
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COC3CCCCC3)c2)C1	ZINC000819263839	EG	On-Demand	Anodyne	SLC6A1	87	39
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COC3CCCCC3)c2)C1	ZINC000819263839	EG	On-Demand	Anodyne	GRIN2B	29	41
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COC3CCCCC3)c2)C1	ZINC000819263839	EG	On-Demand	Anodyne	CCR3	19	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COC3CCCCC3)c2)C1	ZINC000819263839	EG	On-Demand	Anodyne	CCKBR	16	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COC3CCCCC3)c2)C1	ZINC000819263839	EG	On-Demand	Anodyne	P2RY14	43	35
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COC3CCCCC3)c2)C1	ZINC000819263840	EG	On-Demand	Anodyne	SLC6A1	87	39
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COC3CCCCC3)c2)C1	ZINC000819263840	EG	On-Demand	Anodyne	GRIN2B	29	41
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COC3CCCCC3)c2)C1	ZINC000819263840	EG	On-Demand	Anodyne	CCR3	19	42
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COC3CCCCC3)c2)C1	ZINC000819263840	EG	On-Demand	Anodyne	CCKBR	16	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COC3CCCCC3)c2)C1	ZINC000819263840	EG	On-Demand	Anodyne	P2RY14	43	35
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263841	ED	On-Demand	Anodyne	DRD2	21	47
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263841	ED	On-Demand	Anodyne	HRH2	37	48
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263841	ED	On-Demand	Anodyne	SLC6A1	148	37
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263841	ED	On-Demand	Anodyne	CHRM3	32	44
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263841	ED	On-Demand	Anodyne	HRH3	28	49
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263841	ED	On-Demand	Anodyne	SIGMAR1	40	51
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263841	ED	On-Demand	Anodyne	CCR3	36	40
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263841	ED	On-Demand	Anodyne	BDKRB1	43	41
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263841	ED	On-Demand	Anodyne	PREP	18	40
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263841	ED	On-Demand	Anodyne	FAAH	21	41
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263841	ED	On-Demand	Anodyne	EPHX2	23	46
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263841	ED	On-Demand	Anodyne	MCHR1	21	41
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263841	ED	On-Demand	Anodyne	L3MBTL3	31	42
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263842	ED	On-Demand	Anodyne	DRD2	21	47
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263842	ED	On-Demand	Anodyne	HRH2	37	48
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263842	ED	On-Demand	Anodyne	SLC6A1	148	37
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263842	ED	On-Demand	Anodyne	CHRM3	32	44
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263842	ED	On-Demand	Anodyne	HRH3	28	49
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263842	ED	On-Demand	Anodyne	SIGMAR1	40	51
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263842	ED	On-Demand	Anodyne	CCR3	36	40
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263842	ED	On-Demand	Anodyne	BDKRB1	43	41
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263842	ED	On-Demand	Anodyne	PREP	18	40
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263842	ED	On-Demand	Anodyne	FAAH	21	41
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263842	ED	On-Demand	Anodyne	EPHX2	23	46
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263842	ED	On-Demand	Anodyne	MCHR1	21	41
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819263842	ED	On-Demand	Anodyne	L3MBTL3	31	42
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)C1	ZINC000819263843	ED	On-Demand	Anodyne	EPHX2	37	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)C1	ZINC000819263844	ED	On-Demand	Anodyne	EPHX2	37	41
O=C(Nc1ccc(NC(=O)N2CC[C@@H](C(=O)O)C2)cc1)[C@@H]1CCCO1	ZINC000819263845	ED	On-Demand	Anodyne	EPHX2	37	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)C1	ZINC000819263846	ED	On-Demand	Anodyne	EPHX2	37	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(-n3cnnn3)cc2)C1	ZINC000819263847	DC	On-Demand	Anodyne	KCNJ1	48	37
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(-n3cnnn3)cc2)C1	ZINC000819263848	DC	On-Demand	Anodyne	KCNJ1	48	37
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(N3CCCCC3)nc2)C1	ZINC000819263849	DE	On-Demand	Anodyne	FASN	17	43
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(N3CCCCC3)nc2)C1	ZINC000819263849	DE	On-Demand	Anodyne	DGAT1	51	48
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(N3CCCCC3)nc2)C1	ZINC000819263850	DE	On-Demand	Anodyne	FASN	17	43
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(N3CCCCC3)nc2)C1	ZINC000819263850	DE	On-Demand	Anodyne	DGAT1	51	48
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2OCCN2CCOCC2)C1	ZINC000819263852	GD	On-Demand	Anodyne	SLC6A1	119	38
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2OCCN2CCOCC2)C1	ZINC000819263852	GD	On-Demand	Anodyne	LTA4H	23	42
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2OCCN2CCOCC2)C1	ZINC000819263852	GD	On-Demand	Anodyne	EPHX2	38	42
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2OCCN2CCOCC2)C1	ZINC000819263852	GD	On-Demand	Anodyne	DPP7	15	40
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2OCCN2CCOCC2)C1	ZINC000819263853	GD	On-Demand	Anodyne	SLC6A1	119	38
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2OCCN2CCOCC2)C1	ZINC000819263853	GD	On-Demand	Anodyne	LTA4H	23	42
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2OCCN2CCOCC2)C1	ZINC000819263853	GD	On-Demand	Anodyne	EPHX2	38	42
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2OCCN2CCOCC2)C1	ZINC000819263853	GD	On-Demand	Anodyne	DPP7	15	40
O=C(O)C1CCN(C(=O)Nc2ccc(F)nc2)CC1	ZINC000819263855	CD	On-Demand	Anodyne	TRPV1	15	46
O=C(O)C1CCN(C(=O)Nc2ccc(F)nc2)CC1	ZINC000819263855	CD	On-Demand	Anodyne	EPHX2	26	41
O=C(O)C1CCN(C(=O)Nc2ccc(F)nc2)CC1	ZINC000819263855	CD	On-Demand	Anodyne	SCD1	17	43
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COCC3CC3)c2)C1	ZINC000819263856	DF	On-Demand	Anodyne	CCR3	29	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COCC3CC3)c2)C1	ZINC000819263856	DF	On-Demand	Anodyne	P2RY14	44	35
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COCC3CC3)c2)C1	ZINC000819263857	DF	On-Demand	Anodyne	CCR3	29	42
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COCC3CC3)c2)C1	ZINC000819263857	DF	On-Demand	Anodyne	P2RY14	44	35
O=C(O)[C@H]1CCN(C(=O)NCc2cn(-c3ccccc3)nc2-c2ccncc2)C1	ZINC000819263860	GF	On-Demand	Anodyne	EPHX2	15	43
O=C(O)[C@@H]1CCN(C(=O)NCc2cn(-c3ccccc3)nc2-c2ccncc2)C1	ZINC000819263861	GF	On-Demand	Anodyne	EPHX2	15	43
O=C(O)[C@@H]1CCN(C(=O)NCc2noc(-c3cccs3)n2)C1	ZINC000819263864	DD	On-Demand	Anodyne	ETHR	55	46
O=C(O)[C@H]1CCN(C(=O)NCc2noc(-c3cccs3)n2)C1	ZINC000819263865	DD	On-Demand	Anodyne	ETHR	55	46
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(CN3CCCC3=O)c2)C1	ZINC000819263866	ED	On-Demand	Anodyne	SLC6A1	40	31
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(CN3CCCC3=O)c2)C1	ZINC000819263867	ED	On-Demand	Anodyne	SLC6A1	40	31
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3F)cc2)C1	ZINC000819263868	FG	On-Demand	Anodyne	TSHR	52	38
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3F)cc2)C1	ZINC000819263868	FG	On-Demand	Anodyne	SLC6A1	97	39
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3F)cc2)C1	ZINC000819263868	FG	On-Demand	Anodyne	PDGFRB	32	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3F)cc2)C1	ZINC000819263868	FG	On-Demand	Anodyne	GRIN2B	15	42
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3F)cc2)C1	ZINC000819263868	FG	On-Demand	Anodyne	ADAM17	48	44
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3F)cc2)C1	ZINC000819263868	FG	On-Demand	Anodyne	EPHX2	49	42
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3F)cc2)C1	ZINC000819263869	FG	On-Demand	Anodyne	TSHR	52	38
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3F)cc2)C1	ZINC000819263869	FG	On-Demand	Anodyne	SLC6A1	97	39
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3F)cc2)C1	ZINC000819263869	FG	On-Demand	Anodyne	PDGFRB	32	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3F)cc2)C1	ZINC000819263869	FG	On-Demand	Anodyne	GRIN2B	15	42
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3F)cc2)C1	ZINC000819263869	FG	On-Demand	Anodyne	ADAM17	48	44
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCc3ccccc3F)cc2)C1	ZINC000819263869	FG	On-Demand	Anodyne	EPHX2	49	42
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCC(F)(F)F)nc2)C1	ZINC000819263872	ED	On-Demand	Anodyne	SLC6A1	56	34
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCC(F)(F)F)nc2)C1	ZINC000819263872	ED	On-Demand	Anodyne	EPHX2	41	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCC(F)(F)F)nc2)C1	ZINC000819263872	ED	On-Demand	Anodyne	RBP4	62	35
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCC(F)(F)F)nc2)C1	ZINC000819263872	ED	On-Demand	Anodyne	DGAT1	39	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCC(F)(F)F)nc2)C1	ZINC000819263873	ED	On-Demand	Anodyne	SLC6A1	56	34
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCC(F)(F)F)nc2)C1	ZINC000819263873	ED	On-Demand	Anodyne	EPHX2	41	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCC(F)(F)F)nc2)C1	ZINC000819263873	ED	On-Demand	Anodyne	RBP4	62	35
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCC(F)(F)F)nc2)C1	ZINC000819263873	ED	On-Demand	Anodyne	DGAT1	39	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819263874	EF	On-Demand	Anodyne	HTR2A	15	46
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819263874	EF	On-Demand	Anodyne	SLC6A1	154	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819263874	EF	On-Demand	Anodyne	HRH3	40	47
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819263874	EF	On-Demand	Anodyne	SIGMAR1	27	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819263874	EF	On-Demand	Anodyne	CCR3	45	39
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819263874	EF	On-Demand	Anodyne	CHRNA7	23	43
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819263874	EF	On-Demand	Anodyne	EPHX2	38	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819263874	EF	On-Demand	Anodyne	BIRC2	41	39
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819263874	EF	On-Demand	Anodyne	L3MBTL3	57	45
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819263875	EF	On-Demand	Anodyne	HTR2A	15	46
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819263875	EF	On-Demand	Anodyne	SLC6A1	154	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819263875	EF	On-Demand	Anodyne	HRH3	40	47
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819263875	EF	On-Demand	Anodyne	SIGMAR1	27	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819263875	EF	On-Demand	Anodyne	CCR3	45	39
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819263875	EF	On-Demand	Anodyne	CHRNA7	23	43
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819263875	EF	On-Demand	Anodyne	EPHX2	38	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819263875	EF	On-Demand	Anodyne	BIRC2	41	39
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819263875	EF	On-Demand	Anodyne	L3MBTL3	57	45
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)C1	ZINC000819263878	FG	On-Demand	Anodyne	PDGFRB	39	44
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)C1	ZINC000819263878	FG	On-Demand	Anodyne	LIPE	23	42
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)C1	ZINC000819263878	FG	On-Demand	Anodyne	FAAH	21	43
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)C1	ZINC000819263879	FG	On-Demand	Anodyne	PDGFRB	39	44
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)C1	ZINC000819263879	FG	On-Demand	Anodyne	LIPE	23	42
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)C1	ZINC000819263879	FG	On-Demand	Anodyne	FAAH	21	43
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)C1	ZINC000819263880	EF	On-Demand	Anodyne	PDGFRB	31	44
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)C1	ZINC000819263880	EF	On-Demand	Anodyne	LIPE	15	42
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)C1	ZINC000819263880	EF	On-Demand	Anodyne	S1PR2	26	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)C1	ZINC000819263880	EF	On-Demand	Anodyne	DGAT1	32	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)C1	ZINC000819263881	EF	On-Demand	Anodyne	PDGFRB	31	44
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)C1	ZINC000819263881	EF	On-Demand	Anodyne	LIPE	15	42
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)C1	ZINC000819263881	EF	On-Demand	Anodyne	S1PR2	26	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)C1	ZINC000819263881	EF	On-Demand	Anodyne	DGAT1	32	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(CN3CCCCC3=O)c2)C1	ZINC000819263882	EE	On-Demand	Anodyne	SLC6A1	45	32
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(CN3CCCCC3=O)c2)C1	ZINC000819263882	EE	On-Demand	Anodyne	CCR3	33	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(CN3CCCCC3=O)c2)C1	ZINC000819263882	EE	On-Demand	Anodyne	P2RY14	46	36
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(CN3CCCCC3=O)c2)C1	ZINC000819263883	EE	On-Demand	Anodyne	SLC6A1	45	32
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(CN3CCCCC3=O)c2)C1	ZINC000819263883	EE	On-Demand	Anodyne	CCR3	33	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(CN3CCCCC3=O)c2)C1	ZINC000819263883	EE	On-Demand	Anodyne	P2RY14	46	36
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(-n3cccn3)nc2)C1	ZINC000819263884	DD	On-Demand	Anodyne	DGAT1	43	37
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(-n3cccn3)nc2)C1	ZINC000819263885	DD	On-Demand	Anodyne	DGAT1	43	37
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263886	FE	On-Demand	Anodyne	ESR1	90	38
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263886	FE	On-Demand	Anodyne	HTR2A	19	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263886	FE	On-Demand	Anodyne	SLC6A1	158	42
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263886	FE	On-Demand	Anodyne	KCNH2	16	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263886	FE	On-Demand	Anodyne	ESR2	63	45
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263886	FE	On-Demand	Anodyne	PDGFRB	55	45
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263886	FE	On-Demand	Anodyne	LTA4H	93	54
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263886	FE	On-Demand	Anodyne	HRH3	94	60
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263886	FE	On-Demand	Anodyne	CHRNA7	23	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263886	FE	On-Demand	Anodyne	EPHX2	55	48
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263886	FE	On-Demand	Anodyne	FLT3	18	45
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263886	FE	On-Demand	Anodyne	MCHR1	21	45
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263886	FE	On-Demand	Anodyne	PSMB2	51	47
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263886	FE	On-Demand	Anodyne	PSMB1	56	48
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263886	FE	On-Demand	Anodyne	TBK1	15	43
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263887	FE	On-Demand	Anodyne	ESR1	90	38
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263887	FE	On-Demand	Anodyne	HTR2A	19	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263887	FE	On-Demand	Anodyne	SLC6A1	158	42
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263887	FE	On-Demand	Anodyne	KCNH2	16	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263887	FE	On-Demand	Anodyne	ESR2	63	45
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263887	FE	On-Demand	Anodyne	PDGFRB	55	45
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263887	FE	On-Demand	Anodyne	LTA4H	93	54
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263887	FE	On-Demand	Anodyne	HRH3	94	60
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263887	FE	On-Demand	Anodyne	CHRNA7	23	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263887	FE	On-Demand	Anodyne	EPHX2	55	48
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263887	FE	On-Demand	Anodyne	FLT3	18	45
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263887	FE	On-Demand	Anodyne	MCHR1	21	45
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263887	FE	On-Demand	Anodyne	PSMB2	51	47
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263887	FE	On-Demand	Anodyne	PSMB1	56	48
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819263887	FE	On-Demand	Anodyne	TBK1	15	43
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)C1	ZINC000819263888	EC	On-Demand	Anodyne	P2RY14	43	33
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)C1	ZINC000819263889	EC	On-Demand	Anodyne	P2RY14	43	33
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(CN3CCCC3=O)c2)C1	ZINC000819263892	ED	On-Demand	Anodyne	SLC6A1	46	32
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(CN3CCCC3=O)c2)C1	ZINC000819263892	ED	On-Demand	Anodyne	CCR3	20	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(CN3CCCC3=O)c2)C1	ZINC000819263892	ED	On-Demand	Anodyne	P2RY14	46	36
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(CN3CCCC3=O)c2)C1	ZINC000819263893	ED	On-Demand	Anodyne	SLC6A1	46	32
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(CN3CCCC3=O)c2)C1	ZINC000819263893	ED	On-Demand	Anodyne	CCR3	20	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(CN3CCCC3=O)c2)C1	ZINC000819263893	ED	On-Demand	Anodyne	P2RY14	46	36
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(-n3nccn3)cc2C(F)(F)F)C1	ZINC000819263896	FE	On-Demand	Anodyne	RBP4	70	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(-n3nccn3)cc2C(F)(F)F)C1	ZINC000819263896	FE	On-Demand	Anodyne	SFRP1	70	33
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(-n3nccn3)cc2C(F)(F)F)C1	ZINC000819263897	FE	On-Demand	Anodyne	RBP4	70	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(-n3nccn3)cc2C(F)(F)F)C1	ZINC000819263897	FE	On-Demand	Anodyne	SFRP1	70	33
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819263900	FD	On-Demand	Anodyne	EPHX2	35	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819263900	FD	On-Demand	Anodyne	TGM2	30	48
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819263900	FD	On-Demand	Anodyne	F13A1	52	48
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819263900	FD	On-Demand	Anodyne	CCR8	78	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819263900	FD	On-Demand	Anodyne	SFRP1	133	42
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819263900	FD	On-Demand	Anodyne	WNT3	90	42
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819263901	FD	On-Demand	Anodyne	EPHX2	35	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819263901	FD	On-Demand	Anodyne	TGM2	30	48
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819263901	FD	On-Demand	Anodyne	F13A1	52	48
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819263901	FD	On-Demand	Anodyne	CCR8	78	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819263901	FD	On-Demand	Anodyne	SFRP1	133	42
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)C1	ZINC000819263901	FD	On-Demand	Anodyne	WNT3	90	42
O=C(O)[C@H]1CCN(C(=O)Nc2cc(C(F)(F)F)cnc2O)C1	ZINC000819263902	DD	On-Demand	Anodyne	RBP4	56	36
O=C(O)[C@@H]1CCN(C(=O)Nc2cc(C(F)(F)F)cnc2O)C1	ZINC000819263903	DD	On-Demand	Anodyne	RBP4	56	36
O=C(O)[C@@H]1CCN(C(=O)NCc2nc(Cc3ccccc3)no2)C1	ZINC000819263905	ED	On-Demand	Anodyne	EPHX2	22	40
O=C(O)[C@H]1CCN(C(=O)NCc2nc(Cc3ccccc3)no2)C1	ZINC000819263906	ED	On-Demand	Anodyne	EPHX2	22	40
O=C(O)[C@@H]1CCN(C(=O)NCc2cn(-c3ccccc3)nn2)C1	ZINC000819263907	DC	On-Demand	Anodyne	SLC6A1	41	32
O=C(O)[C@@H]1CCN(C(=O)NCc2cn(-c3ccccc3)nn2)C1	ZINC000819263907	DC	On-Demand	Anodyne	EPHX2	19	42
O=C(O)[C@H]1CCN(C(=O)NCc2cn(-c3ccccc3)nn2)C1	ZINC000819263908	DC	On-Demand	Anodyne	SLC6A1	41	32
O=C(O)[C@H]1CCN(C(=O)NCc2cn(-c3ccccc3)nn2)C1	ZINC000819263908	DC	On-Demand	Anodyne	EPHX2	19	42
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819263911	EE	On-Demand	Anodyne	ACE	36	42
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819263911	EE	On-Demand	Anodyne	FKBP1A	89	51
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819263911	EE	On-Demand	Anodyne	CELA1	25	48
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819263911	EE	On-Demand	Anodyne	ELANE	26	40
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819263911	EE	On-Demand	Anodyne	CTRA_BOVIN	53	32
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819263911	EE	On-Demand	Anodyne	TRY1_BOVIN	51	32
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819263911	EE	On-Demand	Anodyne	CTSG	40	32
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819263911	EE	On-Demand	Anodyne	PREP	101	48
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819263911	EE	On-Demand	Anodyne	CELA2A	40	32
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819263911	EE	On-Demand	Anodyne	LGMN	66	41
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819263911	EE	On-Demand	Anodyne	KLK5	26	50
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819263911	EE	On-Demand	Anodyne	SLC12A5	57	36
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819263912	EE	On-Demand	Anodyne	ACE	36	42
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819263912	EE	On-Demand	Anodyne	FKBP1A	89	51
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819263912	EE	On-Demand	Anodyne	CELA1	25	48
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819263912	EE	On-Demand	Anodyne	ELANE	26	40
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819263912	EE	On-Demand	Anodyne	CTRA_BOVIN	53	32
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819263912	EE	On-Demand	Anodyne	TRY1_BOVIN	51	32
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819263912	EE	On-Demand	Anodyne	CTSG	40	32
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819263912	EE	On-Demand	Anodyne	PREP	101	48
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819263912	EE	On-Demand	Anodyne	CELA2A	40	32
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819263912	EE	On-Demand	Anodyne	LGMN	66	41
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819263912	EE	On-Demand	Anodyne	KLK5	26	50
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819263912	EE	On-Demand	Anodyne	SLC12A5	57	36
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1	ZINC000819263926	FE	On-Demand	Anodyne	SLC6A1	57	33
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1	ZINC000819263926	FE	On-Demand	Anodyne	HRH3	15	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1	ZINC000819263928	FE	On-Demand	Anodyne	SLC6A1	57	33
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1	ZINC000819263928	FE	On-Demand	Anodyne	HRH3	15	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(N3CCSCC3)cc2)C1	ZINC000819263930	EE	On-Demand	Anodyne	EPHX2	27	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(N3CCSCC3)cc2)C1	ZINC000819263932	EE	On-Demand	Anodyne	EPHX2	27	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(N3CCCC3)nc2)C1	ZINC000819263933	DD	On-Demand	Anodyne	FASN	17	43
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(N3CCCC3)nc2)C1	ZINC000819263933	DD	On-Demand	Anodyne	DGAT1	51	48
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(N3CCCC3)nc2)C1	ZINC000819263935	DD	On-Demand	Anodyne	FASN	17	43
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(N3CCCC3)nc2)C1	ZINC000819263935	DD	On-Demand	Anodyne	DGAT1	51	48
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2CN2CCCC2=O)C1	ZINC000819263940	ED	On-Demand	Anodyne	SLC6A1	95	36
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2CN2CCCC2=O)C1	ZINC000819263940	ED	On-Demand	Anodyne	EPHX2	23	47
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2CN2CCCC2=O)C1	ZINC000819263941	ED	On-Demand	Anodyne	SLC6A1	95	36
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2CN2CCCC2=O)C1	ZINC000819263941	ED	On-Demand	Anodyne	EPHX2	23	47
O=C(O)[C@@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)nc2)C1	ZINC000819263942	EC	On-Demand	Anodyne	NAMPT	46	46
O=C(O)[C@H]1CCN(C(=O)NCc2ccc(N3CCOCC3)nc2)C1	ZINC000819263943	EC	On-Demand	Anodyne	NAMPT	46	46
O=C(O)C1CCN(C(=O)NCc2ccn3ccnc3c2)CC1	ZINC000819263944	DD	On-Demand	Anodyne	EPHX2	19	49
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(CN3CCOCC3)c2)C1	ZINC000819263947	ED	On-Demand	Anodyne	HRH2	27	40
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(CN3CCOCC3)c2)C1	ZINC000819263947	ED	On-Demand	Anodyne	CHRM3	24	44
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(CN3CCOCC3)c2)C1	ZINC000819263947	ED	On-Demand	Anodyne	HRH3	15	42
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(CN3CCOCC3)c2)C1	ZINC000819263947	ED	On-Demand	Anodyne	SIGMAR1	28	47
O=C(O)[C@H]1CCN(C(=O)NCc2cccc(CN3CCOCC3)c2)C1	ZINC000819263947	ED	On-Demand	Anodyne	EPHX2	20	43
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(CN3CCOCC3)c2)C1	ZINC000819263948	ED	On-Demand	Anodyne	HRH2	27	40
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(CN3CCOCC3)c2)C1	ZINC000819263948	ED	On-Demand	Anodyne	CHRM3	24	44
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(CN3CCOCC3)c2)C1	ZINC000819263948	ED	On-Demand	Anodyne	HRH3	15	42
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(CN3CCOCC3)c2)C1	ZINC000819263948	ED	On-Demand	Anodyne	SIGMAR1	28	47
O=C(O)[C@@H]1CCN(C(=O)NCc2cccc(CN3CCOCC3)c2)C1	ZINC000819263948	ED	On-Demand	Anodyne	EPHX2	20	43
O=C(O)[C@@H]1CCN(C(=O)NCc2ccnc(N3CCOCC3)c2)C1	ZINC000819263949	EC	On-Demand	Anodyne	NOS2	60	34
O=C(O)[C@H]1CCN(C(=O)NCc2ccnc(N3CCOCC3)c2)C1	ZINC000819263950	EC	On-Demand	Anodyne	NOS2	60	34
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819263963	ED	On-Demand	Anodyne	SLC6A1	44	33
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819263963	ED	On-Demand	Anodyne	NPY2R	26	45
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819263963	ED	On-Demand	Anodyne	EPHX2	53	49
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819263963	ED	On-Demand	Anodyne	MLYCD	18	42
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819263963	ED	On-Demand	Anodyne	L3MBTL3	113	51
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819263965	ED	On-Demand	Anodyne	SLC6A1	44	33
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819263965	ED	On-Demand	Anodyne	NPY2R	26	45
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819263965	ED	On-Demand	Anodyne	EPHX2	53	49
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819263965	ED	On-Demand	Anodyne	MLYCD	18	42
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819263965	ED	On-Demand	Anodyne	L3MBTL3	113	51
O=C(O)C1CCN(C(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)CC1	ZINC000819263967	GD	On-Demand	Anodyne	NPY5R	20	43
O=C(O)C1CCN(C(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)CC1	ZINC000819263967	GD	On-Demand	Anodyne	EPHX2	41	40
O=C(O)C1CCN(C(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)CC1	ZINC000819263967	GD	On-Demand	Anodyne	TGM2	40	52
O=C(O)C1CCN(C(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)CC1	ZINC000819263967	GD	On-Demand	Anodyne	F13A1	67	52
O=C(O)C1CCN(C(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)CC1	ZINC000819263967	GD	On-Demand	Anodyne	SFRP1	76	35
O=C(O)C1CCN(C(=O)Nc2ccc(S(=O)(=O)NCC3CC3)cc2)CC1	ZINC000819263967	GD	On-Demand	Anodyne	WNT3	53	35
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CN3CCCC3=O)cc2)C1	ZINC000819263969	ED	On-Demand	Anodyne	SLC6A1	47	32
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CN3CCCC3=O)cc2)C1	ZINC000819263969	ED	On-Demand	Anodyne	EPHX2	32	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CN3CCCC3=O)cc2)C1	ZINC000819263970	ED	On-Demand	Anodyne	SLC6A1	47	32
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CN3CCCC3=O)cc2)C1	ZINC000819263970	ED	On-Demand	Anodyne	EPHX2	32	40
O=C(O)C1CCN(C(=O)Nc2ccc([S@](=O)C(F)(F)F)cc2)CC1	ZINC000819263971	FF	On-Demand	Anodyne	EPHX2	50	39
O=C(O)C1CCN(C(=O)Nc2ccc([S@](=O)C(F)(F)F)cc2)CC1	ZINC000819263971	FF	On-Demand	Anodyne	TRPM8	40	37
O=C(O)C1CCN(C(=O)Nc2ccc([S@@](=O)C(F)(F)F)cc2)CC1	ZINC000819263972	FF	On-Demand	Anodyne	EPHX2	50	39
O=C(O)C1CCN(C(=O)Nc2ccc([S@@](=O)C(F)(F)F)cc2)CC1	ZINC000819263972	FF	On-Demand	Anodyne	TRPM8	40	37
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(N3CCSCC3)c(Cl)c2)C1	ZINC000819263973	FF	On-Demand	Anodyne	NPY2R	70	49
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(N3CCSCC3)c(Cl)c2)C1	ZINC000819263973	FF	On-Demand	Anodyne	EPHX2	22	42
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(N3CCSCC3)c(Cl)c2)C1	ZINC000819263974	FF	On-Demand	Anodyne	NPY2R	70	49
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(N3CCSCC3)c(Cl)c2)C1	ZINC000819263974	FF	On-Demand	Anodyne	EPHX2	22	42
O=C(O)C1CCN(C(=O)Nc2ccc(Br)nc2)CC1	ZINC000819263975	EE	On-Demand	Anodyne	SCD1	16	43
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)C1	ZINC000819263976	GF	On-Demand	Anodyne	EPHX2	41	44
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)C1	ZINC000819263976	GF	On-Demand	Anodyne	TGM2	43	36
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)C1	ZINC000819263976	GF	On-Demand	Anodyne	F13A1	61	37
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)C1	ZINC000819263976	GF	On-Demand	Anodyne	SFRP1	118	38
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)C1	ZINC000819263976	GF	On-Demand	Anodyne	WNT3	80	38
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)C1	ZINC000819263976	GF	On-Demand	Anodyne	MTCA1	28	42
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)C1	ZINC000819263976	GF	On-Demand	Anodyne	P96878_MYCTU	18	42
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)C1	ZINC000819263989	GF	On-Demand	Anodyne	EPHX2	41	44
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)C1	ZINC000819263989	GF	On-Demand	Anodyne	TGM2	43	36
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)C1	ZINC000819263989	GF	On-Demand	Anodyne	F13A1	61	37
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)C1	ZINC000819263989	GF	On-Demand	Anodyne	SFRP1	118	38
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)C1	ZINC000819263989	GF	On-Demand	Anodyne	WNT3	80	38
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)C1	ZINC000819263989	GF	On-Demand	Anodyne	MTCA1	28	42
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(S(=O)(=O)c3ccc(F)cc3)cc2)C1	ZINC000819263989	GF	On-Demand	Anodyne	P96878_MYCTU	18	42
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2CN2CCOCC2)C1	ZINC000819263991	ED	On-Demand	Anodyne	SLC6A1	79	34
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2CN2CCOCC2)C1	ZINC000819263991	ED	On-Demand	Anodyne	SIGMAR1	16	42
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2CN2CCOCC2)C1	ZINC000819263991	ED	On-Demand	Anodyne	EPHX2	28	47
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2CN2CCOCC2)C1	ZINC000819263993	ED	On-Demand	Anodyne	SLC6A1	79	34
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2CN2CCOCC2)C1	ZINC000819263993	ED	On-Demand	Anodyne	SIGMAR1	16	42
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2CN2CCOCC2)C1	ZINC000819263993	ED	On-Demand	Anodyne	EPHX2	28	47
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CC(F)(F)F)cc2)C1	ZINC000819264000	DF	On-Demand	Anodyne	EPHX2	56	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccc(CC(F)(F)F)cc2)C1	ZINC000819264000	DF	On-Demand	Anodyne	RBP4	53	34
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CC(F)(F)F)cc2)C1	ZINC000819264002	DF	On-Demand	Anodyne	EPHX2	56	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ccc(CC(F)(F)F)cc2)C1	ZINC000819264002	DF	On-Demand	Anodyne	RBP4	53	34
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2CN2CCCC2)C1	ZINC000819264004	ED	On-Demand	Anodyne	SLC6A1	158	41
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2CN2CCCC2)C1	ZINC000819264004	ED	On-Demand	Anodyne	HRH3	21	44
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2CN2CCCC2)C1	ZINC000819264004	ED	On-Demand	Anodyne	SIGMAR1	28	45
O=C(O)[C@H]1CCN(C(=O)NCc2ccccc2CN2CCCC2)C1	ZINC000819264004	ED	On-Demand	Anodyne	EPHX2	35	51
O[C@@H](CNC1CC(F)(F)C1)c1cccnc1	ZINC000819264005	BD	On-Demand	Anodyne	ADRB1	20	41
O[C@@H](CNC1CC(F)(F)C1)c1cccnc1	ZINC000819264005	BD	On-Demand	Anodyne	ADRB3	79	48
O[C@H](CNC1CC(F)(F)C1)c1cccnc1	ZINC000819264006	BD	On-Demand	Anodyne	ADRB1	20	41
O[C@H](CNC1CC(F)(F)C1)c1cccnc1	ZINC000819264006	BD	On-Demand	Anodyne	ADRB3	79	48
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2CN2CCCC2)C1	ZINC000819264007	ED	On-Demand	Anodyne	SLC6A1	158	41
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2CN2CCCC2)C1	ZINC000819264007	ED	On-Demand	Anodyne	HRH3	21	44
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2CN2CCCC2)C1	ZINC000819264007	ED	On-Demand	Anodyne	SIGMAR1	28	45
O=C(O)[C@@H]1CCN(C(=O)NCc2ccccc2CN2CCCC2)C1	ZINC000819264007	ED	On-Demand	Anodyne	EPHX2	35	51
O=C(O)C1CCN(C(=O)NCc2nnc(-c3ccccc3)s2)CC1	ZINC000819264009	EE	On-Demand	Anodyne	EPHX2	25	47
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000819264035	FG	On-Demand	Anodyne	DRD4	26	45
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000819264035	FG	On-Demand	Anodyne	SIGMAR1	19	41
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000819264037	FG	On-Demand	Anodyne	DRD4	26	45
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000819264037	FG	On-Demand	Anodyne	SIGMAR1	19	41
O=C(/C=C\[C@@H]1CCCO1)NCCc1nc(-c2ccc(Cl)cc2)no1	ZINC000819264039	EF	On-Demand	Anodyne	SPHK1	34	41
O=C(/C=C/[C@H]1CCCO1)NCCc1nc(-c2ccc(Cl)cc2)no1	ZINC000819264040	EF	On-Demand	Anodyne	SPHK1	34	41
O=C(/C=C/[C@@H]1CCCO1)NCCc1nc(-c2ccc(Cl)cc2)no1	ZINC000819264041	EF	On-Demand	Anodyne	SPHK1	34	41
O=C(/C=C\[C@H]1CCCO1)NCCc1nc(-c2ccc(Cl)cc2)no1	ZINC000819264042	EF	On-Demand	Anodyne	SPHK1	34	41
O[C@@H](CNC1CCN(c2cccnn2)CC1)c1ccccc1F	ZINC000819264057	DD	On-Demand	Anodyne	SCD1	21	46
O[C@H](CNC1CCN(c2cccnn2)CC1)c1ccccc1F	ZINC000819264058	DD	On-Demand	Anodyne	SCD1	21	46
O[C@@H](CNC1CCN(c2cccnn2)CC1)c1ccc(F)cc1	ZINC000819264072	DD	On-Demand	Anodyne	ADRB3	18	41
O[C@@H](CNC1CCN(c2cccnn2)CC1)c1ccc(F)cc1	ZINC000819264072	DD	On-Demand	Anodyne	SCD1	32	45
O[C@@H](CNC1CCN(c2cccnn2)CC1)c1ccc(F)cc1	ZINC000819264072	DD	On-Demand	Anodyne	SCD	32	44
O[C@H](CNC1CCN(c2cccnn2)CC1)c1ccc(F)cc1	ZINC000819264073	DD	On-Demand	Anodyne	ADRB3	18	41
O[C@H](CNC1CCN(c2cccnn2)CC1)c1ccc(F)cc1	ZINC000819264073	DD	On-Demand	Anodyne	SCD1	32	45
O[C@H](CNC1CCN(c2cccnn2)CC1)c1ccc(F)cc1	ZINC000819264073	DD	On-Demand	Anodyne	SCD	32	44
COCCS(=O)(=O)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819264081	FD	On-Demand	Anodyne	ADRB2	34	46
COCCS(=O)(=O)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819264081	FD	On-Demand	Anodyne	ADRB1	35	44
COCCS(=O)(=O)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819264081	FD	On-Demand	Anodyne	ADRB3	119	52
COCCS(=O)(=O)c1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819264081	FD	On-Demand	Anodyne	NAMPT	47	40
COCCS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819264082	FD	On-Demand	Anodyne	ADRB2	34	46
COCCS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819264082	FD	On-Demand	Anodyne	ADRB1	35	44
COCCS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819264082	FD	On-Demand	Anodyne	ADRB3	119	52
COCCS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819264082	FD	On-Demand	Anodyne	NAMPT	47	40
O[C@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1cc2ccccc2o1	ZINC000819264108	GG	On-Demand	Anodyne	DRD4	29	42
O[C@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1cc2ccccc2o1	ZINC000819264108	GG	On-Demand	Anodyne	SIGMAR1	25	43
O[C@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cc2ccccc2o1	ZINC000819264109	GG	On-Demand	Anodyne	DRD4	29	42
O[C@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cc2ccccc2o1	ZINC000819264109	GG	On-Demand	Anodyne	SIGMAR1	25	43
Cc1ccccc1[C@@H](O)CNC1CCN(c2cccnn2)CC1	ZINC000819264130	DE	On-Demand	Anodyne	SCD1	21	42
O[C@@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1cccnc1	ZINC000819264141	ED	On-Demand	Anodyne	ADRB2	20	42
O[C@@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1cccnc1	ZINC000819264141	ED	On-Demand	Anodyne	DRD4	15	41
O[C@@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1cccnc1	ZINC000819264141	ED	On-Demand	Anodyne	ADRB3	85	44
O[C@@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccnc1	ZINC000819264142	ED	On-Demand	Anodyne	ADRB2	20	42
O[C@@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccnc1	ZINC000819264142	ED	On-Demand	Anodyne	DRD4	15	41
O[C@@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccnc1	ZINC000819264142	ED	On-Demand	Anodyne	ADRB3	85	44
O[C@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1cccnc1	ZINC000819264143	ED	On-Demand	Anodyne	ADRB2	20	42
O[C@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1cccnc1	ZINC000819264143	ED	On-Demand	Anodyne	DRD4	15	41
O[C@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1cccnc1	ZINC000819264143	ED	On-Demand	Anodyne	ADRB3	85	44
O[C@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccnc1	ZINC000819264144	ED	On-Demand	Anodyne	ADRB2	20	42
O[C@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccnc1	ZINC000819264144	ED	On-Demand	Anodyne	DRD4	15	41
O[C@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccnc1	ZINC000819264144	ED	On-Demand	Anodyne	ADRB3	85	44
O[C@@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1cccc2ccccc12	ZINC000819264161	GH	On-Demand	Anodyne	DRD4	30	46
O[C@@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1cccc2ccccc12	ZINC000819264161	GH	On-Demand	Anodyne	SIGMAR1	22	43
O[C@@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccc2ccccc12	ZINC000819264162	GH	On-Demand	Anodyne	DRD4	30	46
O[C@@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccc2ccccc12	ZINC000819264162	GH	On-Demand	Anodyne	SIGMAR1	22	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1CC(F)(F)C1	ZINC000819264164	FF	On-Demand	Anodyne	CTSD	129	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1CC(F)(F)C1	ZINC000819264164	FF	On-Demand	Anodyne	PGC	62	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1CC(F)(F)C1	ZINC000819264164	FF	On-Demand	Anodyne	CMA1	30	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1CC(F)(F)C1	ZINC000819264164	FF	On-Demand	Anodyne	CTRA_BOVIN	19	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1CC(F)(F)C1	ZINC000819264164	FF	On-Demand	Anodyne	PAPA1_CARPA	35	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1CC(F)(F)C1	ZINC000819264164	FF	On-Demand	Anodyne	CTSK	17	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1CC(F)(F)C1	ZINC000819264164	FF	On-Demand	Anodyne	CTSL	18	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1CC(F)(F)C1	ZINC000819264164	FF	On-Demand	Anodyne	PGA	50	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1CC(F)(F)C1	ZINC000819264164	FF	On-Demand	Anodyne	BACE2	60	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1CC(F)(F)C1	ZINC000819264164	FF	On-Demand	Anodyne	TACR3	17	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1CC(F)(F)C1	ZINC000819264164	FF	On-Demand	Anodyne	REN	93	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1CC(F)(F)C1	ZINC000819264164	FF	On-Demand	Anodyne	REN1	32	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1CC(F)(F)C1	ZINC000819264164	FF	On-Demand	Anodyne	BACE1	105	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1CC(F)(F)C1	ZINC000819264164	FF	On-Demand	Anodyne	FPR1	59	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1CC(F)(F)C1	ZINC000819264164	FF	On-Demand	Anodyne	PLM1_PLAFA	36	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1CC(F)(F)C1	ZINC000819264164	FF	On-Demand	Anodyne	PLM2_PLAFA	65	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1CC(F)(F)C1	ZINC000819264164	FF	On-Demand	Anodyne	Q82323_9DELA	73	33
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	F2	53	39
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	ACE	49	47
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	TSHR	63	35
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	FKBP1A	104	56
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	OPRM1	33	40
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	OPRK1	27	40
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	CELA1	26	46
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	ELANE	34	42
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	CTRA_BOVIN	59	32
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	TRY1_BOVIN	58	32
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	CTSG	41	32
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	CPT1A	50	45
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	CPT2	42	35
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	DPP4	22	40
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	PREP	104	46
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	CELA2A	49	32
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	LGMN	80	41
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	KLK5	25	46
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	BRCA1	61	34
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)c1	ZINC000819264216	GF	On-Demand	Anodyne	SLC12A5	67	36
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	F2	53	39
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	ACE	49	47
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	TSHR	63	35
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	FKBP1A	104	56
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	OPRM1	33	40
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	OPRK1	27	40
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	CELA1	26	46
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	ELANE	34	42
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	CTRA_BOVIN	59	32
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	TRY1_BOVIN	58	32
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	CTSG	41	32
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	CPT1A	50	45
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	CPT2	42	35
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	DPP4	22	40
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	PREP	104	46
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	CELA2A	49	32
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	LGMN	80	41
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	KLK5	25	46
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	BRCA1	61	34
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)c1	ZINC000819264217	GF	On-Demand	Anodyne	SLC12A5	67	36
O[C@H](CNC1CC(F)(F)C1)c1cccc(Cl)c1	ZINC000819264231	CF	On-Demand	Anodyne	ADRB1	32	46
O[C@H](CNC1CC(F)(F)C1)c1cccc(Cl)c1	ZINC000819264231	CF	On-Demand	Anodyne	ADRB3	51	50
O[C@@H](CNC1CC(F)(F)C1)c1cccc(Cl)c1	ZINC000819264232	CF	On-Demand	Anodyne	ADRB1	32	46
O[C@@H](CNC1CC(F)(F)C1)c1cccc(Cl)c1	ZINC000819264232	CF	On-Demand	Anodyne	ADRB3	51	50
CCNS(=O)(=O)CCNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819264242	FD	On-Demand	Anodyne	MTNR1A	20	46
CCNS(=O)(=O)CCNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819264242	FD	On-Demand	Anodyne	MTNR1B	17	46
CCNS(=O)(=O)CCNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819264242	FD	On-Demand	Anodyne	CRTM	43	40
O[C@@H](CNC[C@@H]1CSCCN1Cc1ccccc1)c1cccnc1	ZINC000819264259	EE	On-Demand	Anodyne	ADRB2	22	43
O[C@@H](CNC[C@@H]1CSCCN1Cc1ccccc1)c1cccnc1	ZINC000819264259	EE	On-Demand	Anodyne	ADRB1	25	41
O[C@@H](CNC[C@@H]1CSCCN1Cc1ccccc1)c1cccnc1	ZINC000819264259	EE	On-Demand	Anodyne	ADRB3	91	47
O[C@@H](CNC[C@H]1CSCCN1Cc1ccccc1)c1cccnc1	ZINC000819264260	EE	On-Demand	Anodyne	ADRB2	22	43
O[C@@H](CNC[C@H]1CSCCN1Cc1ccccc1)c1cccnc1	ZINC000819264260	EE	On-Demand	Anodyne	ADRB1	25	41
O[C@@H](CNC[C@H]1CSCCN1Cc1ccccc1)c1cccnc1	ZINC000819264260	EE	On-Demand	Anodyne	ADRB3	91	47
O[C@H](CNC[C@H]1CSCCN1Cc1ccccc1)c1cccnc1	ZINC000819264261	EE	On-Demand	Anodyne	ADRB2	22	43
O[C@H](CNC[C@H]1CSCCN1Cc1ccccc1)c1cccnc1	ZINC000819264261	EE	On-Demand	Anodyne	ADRB1	25	41
O[C@H](CNC[C@H]1CSCCN1Cc1ccccc1)c1cccnc1	ZINC000819264261	EE	On-Demand	Anodyne	ADRB3	91	47
O[C@H](CNC[C@@H]1CSCCN1Cc1ccccc1)c1cccnc1	ZINC000819264262	EE	On-Demand	Anodyne	ADRB2	22	43
O[C@H](CNC[C@@H]1CSCCN1Cc1ccccc1)c1cccnc1	ZINC000819264262	EE	On-Demand	Anodyne	ADRB1	25	41
O[C@H](CNC[C@@H]1CSCCN1Cc1ccccc1)c1cccnc1	ZINC000819264262	EE	On-Demand	Anodyne	ADRB3	91	47
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264267	FE	On-Demand	Anodyne	ACE	34	41
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264267	FE	On-Demand	Anodyne	FKBP1A	85	47
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264267	FE	On-Demand	Anodyne	CELA1	24	45
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264267	FE	On-Demand	Anodyne	ELANE	25	40
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264267	FE	On-Demand	Anodyne	CPT1A	51	35
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264267	FE	On-Demand	Anodyne	CPT2	44	34
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264267	FE	On-Demand	Anodyne	PREP	102	47
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264267	FE	On-Demand	Anodyne	LGMN	61	38
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264267	FE	On-Demand	Anodyne	KLK5	25	46
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264267	FE	On-Demand	Anodyne	SLC12A5	45	35
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264268	FE	On-Demand	Anodyne	ACE	34	41
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264268	FE	On-Demand	Anodyne	FKBP1A	85	47
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264268	FE	On-Demand	Anodyne	CELA1	24	45
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264268	FE	On-Demand	Anodyne	ELANE	25	40
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264268	FE	On-Demand	Anodyne	CPT1A	51	35
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264268	FE	On-Demand	Anodyne	CPT2	44	34
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264268	FE	On-Demand	Anodyne	PREP	102	47
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264268	FE	On-Demand	Anodyne	LGMN	61	38
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264268	FE	On-Demand	Anodyne	KLK5	25	46
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819264268	FE	On-Demand	Anodyne	SLC12A5	45	35
CCn1c(S)nnc1C1CCN(C(=O)c2cc(C)ccc2C2CC2)CC1	ZINC000819264285	FH	On-Demand	Anodyne	SLC9A1	40	36
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264307	GF	On-Demand	Anodyne	ACE	36	45
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264307	GF	On-Demand	Anodyne	FKBP1A	98	52
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264307	GF	On-Demand	Anodyne	HTR1D	41	44
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264307	GF	On-Demand	Anodyne	HTR1B	33	44
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264307	GF	On-Demand	Anodyne	CELA1	21	44
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264307	GF	On-Demand	Anodyne	CTRA_BOVIN	52	31
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264307	GF	On-Demand	Anodyne	TRY1_BOVIN	54	31
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264307	GF	On-Demand	Anodyne	CPT1A	41	36
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264307	GF	On-Demand	Anodyne	CPT2	40	34
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264307	GF	On-Demand	Anodyne	PREP	97	44
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264307	GF	On-Demand	Anodyne	CELA2A	47	31
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264307	GF	On-Demand	Anodyne	LGMN	70	39
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264307	GF	On-Demand	Anodyne	KLK5	23	44
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264307	GF	On-Demand	Anodyne	SLC12A5	42	33
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264307	GF	On-Demand	Anodyne	TMPRSS11D	45	34
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264308	GF	On-Demand	Anodyne	ACE	36	45
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264308	GF	On-Demand	Anodyne	FKBP1A	98	52
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264308	GF	On-Demand	Anodyne	HTR1D	41	44
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264308	GF	On-Demand	Anodyne	HTR1B	33	44
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264308	GF	On-Demand	Anodyne	CELA1	21	44
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264308	GF	On-Demand	Anodyne	CTRA_BOVIN	52	31
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264308	GF	On-Demand	Anodyne	TRY1_BOVIN	54	31
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264308	GF	On-Demand	Anodyne	CPT1A	41	36
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264308	GF	On-Demand	Anodyne	CPT2	40	34
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264308	GF	On-Demand	Anodyne	PREP	97	44
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264308	GF	On-Demand	Anodyne	CELA2A	47	31
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264308	GF	On-Demand	Anodyne	LGMN	70	39
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264308	GF	On-Demand	Anodyne	KLK5	23	44
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264308	GF	On-Demand	Anodyne	SLC12A5	42	33
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819264308	GF	On-Demand	Anodyne	TMPRSS11D	45	34
O=[N+]([O-])c1cccc([C@H](O)CNC2CC(F)(F)C2)c1	ZINC000819264325	CE	On-Demand	Bother	CACNA1C	43	35
O=[N+]([O-])c1cccc([C@H](O)CNC2CC(F)(F)C2)c1	ZINC000819264325	CE	On-Demand	Bother	CACNA1D	68	35
O=[N+]([O-])c1cccc([C@@H](O)CNC2CC(F)(F)C2)c1	ZINC000819264326	CE	On-Demand	Bother	CACNA1C	43	35
O=[N+]([O-])c1cccc([C@@H](O)CNC2CC(F)(F)C2)c1	ZINC000819264326	CE	On-Demand	Bother	CACNA1D	68	35
O[C@@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)C1CC1	ZINC000819264329	DD	On-Demand	Anodyne	DRD4	27	46
O[C@@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)C1CC1	ZINC000819264329	DD	On-Demand	Anodyne	SIGMAR1	32	45
O[C@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)C1CC1	ZINC000819264330	DD	On-Demand	Anodyne	DRD4	27	46
O[C@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)C1CC1	ZINC000819264330	DD	On-Demand	Anodyne	SIGMAR1	32	45
O[C@@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)C1CC1	ZINC000819264331	DD	On-Demand	Anodyne	DRD4	27	46
O[C@@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)C1CC1	ZINC000819264331	DD	On-Demand	Anodyne	SIGMAR1	32	45
O[C@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)C1CC1	ZINC000819264332	DD	On-Demand	Anodyne	DRD4	27	46
O[C@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)C1CC1	ZINC000819264332	DD	On-Demand	Anodyne	SIGMAR1	32	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@](C)(C#N)CCc1ccccc1	ZINC000819264343	FF	On-Demand	Mild	PAPA1_CARPA	35	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@](C)(C#N)CCc1ccccc1	ZINC000819264344	FF	On-Demand	Mild	PAPA1_CARPA	35	42
COCCS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819264347	FE	On-Demand	Anodyne	ADRB1	34	42
COCCS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819264347	FE	On-Demand	Anodyne	ADRB3	68	42
COCCS(=O)(=O)c1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819264348	FE	On-Demand	Anodyne	ADRB1	34	42
COCCS(=O)(=O)c1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819264348	FE	On-Demand	Anodyne	ADRB3	68	42
O[C@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(Cl)c(F)c1	ZINC000819264370	GG	On-Demand	Anodyne	DRD4	20	41
O[C@@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc(Cl)c(F)c1	ZINC000819264371	GG	On-Demand	Anodyne	DRD4	20	41
O[C@@H](CNC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(Cl)c(F)c1	ZINC000819264372	GG	On-Demand	Anodyne	DRD4	20	41
O[C@H](CNC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc(Cl)c(F)c1	ZINC000819264373	GG	On-Demand	Anodyne	DRD4	20	41
CCn1c(S)nnc1C1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819264382	GE	On-Demand	Anodyne	KCNJ1	50	41
O[C@H](CNC[C@@]1(Cc2ccc(F)cc2)CCC[C@@H]1O)c1cccnc1	ZINC000819264383	EF	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNC[C@@]1(Cc2ccc(F)cc2)CCC[C@@H]1O)c1cccnc1	ZINC000819264383	EF	On-Demand	Anodyne	ADRB3	90	41
O[C@H](CNC[C@@]1(Cc2ccc(F)cc2)CCC[C@H]1O)c1cccnc1	ZINC000819264384	EF	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNC[C@@]1(Cc2ccc(F)cc2)CCC[C@H]1O)c1cccnc1	ZINC000819264384	EF	On-Demand	Anodyne	ADRB3	90	41
O[C@H](CNC[C@]1(Cc2ccc(F)cc2)CCC[C@@H]1O)c1cccnc1	ZINC000819264385	EF	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNC[C@]1(Cc2ccc(F)cc2)CCC[C@@H]1O)c1cccnc1	ZINC000819264385	EF	On-Demand	Anodyne	ADRB3	90	41
O[C@H](CNC[C@]1(Cc2ccc(F)cc2)CCC[C@H]1O)c1cccnc1	ZINC000819264386	EF	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNC[C@]1(Cc2ccc(F)cc2)CCC[C@H]1O)c1cccnc1	ZINC000819264386	EF	On-Demand	Anodyne	ADRB3	90	41
COCCS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819264391	GF	On-Demand	Anodyne	ADRB2	52	43
COCCS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819264391	GF	On-Demand	Anodyne	ADRB1	58	46
COCCS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819264391	GF	On-Demand	Anodyne	ADRB3	84	48
COCCS(=O)(=O)c1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819264392	GF	On-Demand	Anodyne	ADRB2	52	43
COCCS(=O)(=O)c1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819264392	GF	On-Demand	Anodyne	ADRB1	58	46
COCCS(=O)(=O)c1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819264392	GF	On-Demand	Anodyne	ADRB3	84	48
O=[N+]([O-])c1ccc([C@H](O)CNC[C@H]2CN(Cc3ccccc3)CCCO2)cc1	ZINC000819264393	GF	On-Demand	Bother	DRD4	15	46
O=[N+]([O-])c1ccc([C@H](O)CNC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1	ZINC000819264394	GF	On-Demand	Bother	DRD4	15	46
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1	ZINC000819264395	GF	On-Demand	Bother	DRD4	15	46
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@H]2CN(Cc3ccccc3)CCCO2)cc1	ZINC000819264396	GF	On-Demand	Bother	DRD4	15	46
COCCS(=O)(=O)c1ccc(CNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819264418	GE	On-Demand	Anodyne	LEF	50	35
COCCS(=O)(=O)c1ccc(CNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819264419	GE	On-Demand	Anodyne	LEF	50	35
O[C@@H](CNC1CCN(c2cccnn2)CC1)c1ccc(Cl)c(F)c1	ZINC000819264434	FF	On-Demand	Anodyne	ADRB3	20	40
O[C@H](CNC1CCN(c2cccnn2)CC1)c1ccc(Cl)c(F)c1	ZINC000819264435	FF	On-Demand	Anodyne	ADRB3	20	40
Oc1cccc2c1C[C@@H](NC[C@H](O)c1cccnc1)C2	ZINC000819264444	CD	On-Demand	Anodyne	ADRB2	16	40
Oc1cccc2c1C[C@@H](NC[C@H](O)c1cccnc1)C2	ZINC000819264444	CD	On-Demand	Anodyne	ADRB3	63	53
Oc1cccc2c1C[C@H](NC[C@H](O)c1cccnc1)C2	ZINC000819264445	CD	On-Demand	Anodyne	ADRB2	16	40
Oc1cccc2c1C[C@H](NC[C@H](O)c1cccnc1)C2	ZINC000819264445	CD	On-Demand	Anodyne	ADRB3	63	53
Oc1cccc2c1C[C@H](NC[C@@H](O)c1cccnc1)C2	ZINC000819264446	CD	On-Demand	Anodyne	ADRB2	16	40
Oc1cccc2c1C[C@H](NC[C@@H](O)c1cccnc1)C2	ZINC000819264446	CD	On-Demand	Anodyne	ADRB3	63	53
Oc1cccc2c1C[C@@H](NC[C@@H](O)c1cccnc1)C2	ZINC000819264447	CD	On-Demand	Anodyne	ADRB2	16	40
Oc1cccc2c1C[C@@H](NC[C@@H](O)c1cccnc1)C2	ZINC000819264447	CD	On-Demand	Anodyne	ADRB3	63	53
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2Cc3cccc(O)c3C2)CC1	ZINC000819264448	GE	On-Demand	Anodyne	GPR119	41	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2Cc3cccc(O)c3C2)CC1	ZINC000819264449	GE	On-Demand	Anodyne	GPR119	41	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2Cc3cccc(O)c3C2)CC1	ZINC000819264450	GE	On-Demand	Anodyne	GPR119	41	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2Cc3cccc(O)c3C2)CC1	ZINC000819264451	GE	On-Demand	Anodyne	GPR119	41	49
C=CCCn1cc(C(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)nn1	ZINC000819264457	FE	On-Demand	Mild	PLG	22	41
C=CCCn1cc(C(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)nn1	ZINC000819264457	FE	On-Demand	Mild	ACE	23	40
C=CCCn1cc(C(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)nn1	ZINC000819264457	FE	On-Demand	Mild	FKBP1A	66	45
C=CCCn1cc(C(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)nn1	ZINC000819264457	FE	On-Demand	Mild	CELA1	20	43
C=CCCn1cc(C(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)nn1	ZINC000819264457	FE	On-Demand	Mild	PREP	73	43
C=CCCn1cc(C(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)nn1	ZINC000819264457	FE	On-Demand	Mild	LGMN	73	40
C=CCCn1cc(C(=O)N2CCC[C@H]2C(=O)OCc2ccccc2)nn1	ZINC000819264457	FE	On-Demand	Mild	KLK5	22	41
C=CCCn1cc(C(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)nn1	ZINC000819264458	FE	On-Demand	Mild	PLG	22	41
C=CCCn1cc(C(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)nn1	ZINC000819264458	FE	On-Demand	Mild	ACE	23	40
C=CCCn1cc(C(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)nn1	ZINC000819264458	FE	On-Demand	Mild	FKBP1A	66	45
C=CCCn1cc(C(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)nn1	ZINC000819264458	FE	On-Demand	Mild	CELA1	20	43
C=CCCn1cc(C(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)nn1	ZINC000819264458	FE	On-Demand	Mild	PREP	73	43
C=CCCn1cc(C(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)nn1	ZINC000819264458	FE	On-Demand	Mild	LGMN	73	40
C=CCCn1cc(C(=O)N2CCC[C@@H]2C(=O)OCc2ccccc2)nn1	ZINC000819264458	FE	On-Demand	Mild	KLK5	22	41
CCNS(=O)(=O)CCNC(=O)[C@@H](CC)Cc1ccccc1C	ZINC000819264463	ED	On-Demand	Anodyne	MME	31	43
CCNS(=O)(=O)CCNC(=O)[C@H](CC)Cc1ccccc1C	ZINC000819264464	ED	On-Demand	Anodyne	MME	31	43
O[C@H](CNC1CC(F)(F)C1)c1ccc(Cl)c(F)c1	ZINC000819264470	CF	On-Demand	Anodyne	MAPK1	23	40
O[C@@H](CNC1CC(F)(F)C1)c1ccc(Cl)c(F)c1	ZINC000819264471	CF	On-Demand	Anodyne	MAPK1	23	40
CON(C)C(=O)CCNC[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000819264475	ED	On-Demand	Anodyne	DRD4	35	43
CON(C)C(=O)CCNC[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000819264476	ED	On-Demand	Anodyne	DRD4	35	43
O[C@@H](CNC1CCN(c2cccnn2)CC1)c1ccc(OC(F)(F)F)cc1	ZINC000819264489	GF	On-Demand	Anodyne	SCD1	20	42
O[C@@H](CNC1CCN(c2cccnn2)CC1)c1ccc(OC(F)(F)F)cc1	ZINC000819264489	GF	On-Demand	Anodyne	SCD	21	42
O[C@H](CNC1CCN(c2cccnn2)CC1)c1ccc(OC(F)(F)F)cc1	ZINC000819264490	GF	On-Demand	Anodyne	SCD1	20	42
O[C@H](CNC1CCN(c2cccnn2)CC1)c1ccc(OC(F)(F)F)cc1	ZINC000819264490	GF	On-Demand	Anodyne	SCD	21	42
COc1ccc(OC)c([C@H](O)CNCCNS(=O)(=O)NC(C)C)c1	ZINC000819264511	FC	On-Demand	Anodyne	ADRB2	17	44
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccccc1OC	ZINC000819264515	CE	On-Demand	Reactive	ECR	16	44
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccccc1OC	ZINC000819264515	CE	On-Demand	Reactive	KCNA3	45	40
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccccc1OC	ZINC000819264515	CE	On-Demand	Reactive	KCNK3	51	47
C=C(C)C(C)(C)C(=O)NNC(=O)c1ccccc1OC	ZINC000819264515	CE	On-Demand	Reactive	KCNK9	47	47
O[C@@H](CNC1CCN(c2cccnn2)CC1)c1ccccc1Cl	ZINC000819264541	EE	On-Demand	Anodyne	OPRL1	33	43
O[C@@H](CNC1CCN(c2cccnn2)CC1)c1cccc(Cl)c1	ZINC000819264556	EE	On-Demand	Anodyne	ADRB1	38	43
O[C@@H](CNC1CCN(c2cccnn2)CC1)c1cccc(Cl)c1	ZINC000819264556	EE	On-Demand	Anodyne	ADRB3	59	45
O[C@@H](CNC1CCN(c2cccnn2)CC1)c1cccc(Cl)c1	ZINC000819264556	EE	On-Demand	Anodyne	IGF1R	28	40
O[C@@H](CNC1CCN(c2cccnn2)CC1)c1cccc(Cl)c1	ZINC000819264556	EE	On-Demand	Anodyne	CYP3A4	50	40
O[C@H](CNC1CCN(c2cccnn2)CC1)c1cccc(Cl)c1	ZINC000819264557	EE	On-Demand	Anodyne	ADRB1	38	43
O[C@H](CNC1CCN(c2cccnn2)CC1)c1cccc(Cl)c1	ZINC000819264557	EE	On-Demand	Anodyne	ADRB3	59	45
O[C@H](CNC1CCN(c2cccnn2)CC1)c1cccc(Cl)c1	ZINC000819264557	EE	On-Demand	Anodyne	IGF1R	28	40
O[C@H](CNC1CCN(c2cccnn2)CC1)c1cccc(Cl)c1	ZINC000819264557	EE	On-Demand	Anodyne	CYP3A4	50	40
Cc1ccccc1[C@@H](O)CNC[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000819264568	FF	On-Demand	Anodyne	DRD4	31	44
Cc1ccccc1[C@@H](O)CNC[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000819264570	FF	On-Demand	Anodyne	DRD4	31	44
COCCS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819264592	GD	On-Demand	Bother	CACNA1C	53	37
COCCS(=O)(=O)c1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819264592	GD	On-Demand	Bother	CACNA1D	82	37
COCCS(=O)(=O)c1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819264593	GD	On-Demand	Bother	CACNA1C	53	37
COCCS(=O)(=O)c1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819264593	GD	On-Demand	Bother	CACNA1D	82	37
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CN(Cc3ccccc3)CCCO2)c1	ZINC000819264612	GF	On-Demand	Bother	DRD4	16	45
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CN(Cc3ccccc3)CCCO2)c1	ZINC000819264613	GF	On-Demand	Bother	DRD4	16	45
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2CN(Cc3ccccc3)CCCO2)c1	ZINC000819264614	GF	On-Demand	Bother	DRD4	16	45
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CN(Cc3ccccc3)CCCO2)c1	ZINC000819264615	GF	On-Demand	Bother	DRD4	16	45
O[C@@H](CNC1CCN(c2cccnn2)CC1)c1ccccc1	ZINC000819264629	CD	On-Demand	Anodyne	SCD1	34	46
O[C@@H](CNC1CCN(c2cccnn2)CC1)c1ccccc1	ZINC000819264629	CD	On-Demand	Anodyne	SCD	30	43
O[C@H](CNC1CCN(c2cccnn2)CC1)c1ccccc1	ZINC000819264630	CD	On-Demand	Anodyne	SCD1	34	46
O[C@H](CNC1CCN(c2cccnn2)CC1)c1ccccc1	ZINC000819264630	CD	On-Demand	Anodyne	SCD	30	43
O[C@@H](CNC1CCN(c2cccnn2)CC1)c1cccc(F)c1	ZINC000819264637	DD	On-Demand	Anodyne	SCD1	29	47
O[C@@H](CNC1CCN(c2cccnn2)CC1)c1cccc(F)c1	ZINC000819264637	DD	On-Demand	Anodyne	SCD	36	47
O[C@H](CNC1CCN(c2cccnn2)CC1)c1cccc(F)c1	ZINC000819264638	DD	On-Demand	Anodyne	SCD1	29	47
O[C@H](CNC1CCN(c2cccnn2)CC1)c1cccc(F)c1	ZINC000819264638	DD	On-Demand	Anodyne	SCD	36	47
O=C(/C=C\c1ccc(I)o1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819264654	JK	On-Demand	Anodyne	LPL	42	41
O=C(/C=C\c1ccc(I)o1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819264654	JK	On-Demand	Anodyne	KCNK3	69	35
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)c1	ZINC000819264667	GF	On-Demand	Anodyne	GPR119	35	44
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2C)c1	ZINC000819264668	GF	On-Demand	Anodyne	GPR119	35	44
O[C@H](CNC[C@@H]1CCCCN1C1CC1)c1cccc(Cl)c1	ZINC000819264677	DF	On-Demand	Anodyne	ADRB1	31	43
O[C@H](CNC[C@@H]1CCCCN1C1CC1)c1cccc(Cl)c1	ZINC000819264677	DF	On-Demand	Anodyne	ADRB3	45	43
O[C@H](CNC[C@@H]1CCCCN1C1CC1)c1cccc(Cl)c1	ZINC000819264677	DF	On-Demand	Anodyne	CYP3A4	45	36
O[C@H](CNC[C@H]1CCCCN1C1CC1)c1cccc(Cl)c1	ZINC000819264678	DF	On-Demand	Anodyne	ADRB1	31	43
O[C@H](CNC[C@H]1CCCCN1C1CC1)c1cccc(Cl)c1	ZINC000819264678	DF	On-Demand	Anodyne	ADRB3	45	43
O[C@H](CNC[C@H]1CCCCN1C1CC1)c1cccc(Cl)c1	ZINC000819264678	DF	On-Demand	Anodyne	CYP3A4	45	36
O[C@@H](CNC[C@@H]1CCCCN1C1CC1)c1cccc(Cl)c1	ZINC000819264679	DF	On-Demand	Anodyne	ADRB1	31	43
O[C@@H](CNC[C@@H]1CCCCN1C1CC1)c1cccc(Cl)c1	ZINC000819264679	DF	On-Demand	Anodyne	ADRB3	45	43
O[C@@H](CNC[C@@H]1CCCCN1C1CC1)c1cccc(Cl)c1	ZINC000819264679	DF	On-Demand	Anodyne	CYP3A4	45	36
O[C@@H](CNC[C@H]1CCCCN1C1CC1)c1cccc(Cl)c1	ZINC000819264680	DF	On-Demand	Anodyne	ADRB1	31	43
O[C@@H](CNC[C@H]1CCCCN1C1CC1)c1cccc(Cl)c1	ZINC000819264680	DF	On-Demand	Anodyne	ADRB3	45	43
O[C@@H](CNC[C@H]1CCCCN1C1CC1)c1cccc(Cl)c1	ZINC000819264680	DF	On-Demand	Anodyne	CYP3A4	45	36
O=[N+]([O-])c1cccc([C@H](O)CNCCOCC(F)(F)C(F)F)c1	ZINC000819264687	EE	On-Demand	Bother	ADRB3	42	36
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCC(F)(F)C(F)F)c1	ZINC000819264688	EE	On-Demand	Bother	ADRB3	42	36
C[C@@H]1CN(CCCNC[C@@H](O)c2cccnc2)CCCO1	ZINC000819264705	CD	On-Demand	Anodyne	ADRB2	28	41
C[C@@H]1CN(CCCNC[C@@H](O)c2cccnc2)CCCO1	ZINC000819264705	CD	On-Demand	Anodyne	ADRB1	24	41
C[C@@H]1CN(CCCNC[C@@H](O)c2cccnc2)CCCO1	ZINC000819264705	CD	On-Demand	Anodyne	ADRB3	95	46
C[C@@H]1CN(CCCNC[C@H](O)c2cccnc2)CCCO1	ZINC000819264708	CD	On-Demand	Anodyne	ADRB2	28	41
C[C@@H]1CN(CCCNC[C@H](O)c2cccnc2)CCCO1	ZINC000819264708	CD	On-Demand	Anodyne	ADRB1	24	41
C[C@@H]1CN(CCCNC[C@H](O)c2cccnc2)CCCO1	ZINC000819264708	CD	On-Demand	Anodyne	ADRB3	95	46
O[C@@H](CNCC1(N2CCOCC2)CC1)c1ccccc1	ZINC000819264743	CD	On-Demand	Anodyne	HCN1	48	36
O[C@H](CNCC1(N2CCOCC2)CC1)c1ccccc1	ZINC000819264744	CD	On-Demand	Anodyne	HCN1	48	36
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1	ZINC000819264748	HI	On-Demand	Bother	PPIA	38	53
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1	ZINC000819264748	HI	On-Demand	Bother	KIT	15	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1	ZINC000819264748	HI	On-Demand	Bother	PRNP	27	47
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1	ZINC000819264748	HI	On-Demand	Bother	FLT3	15	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1	ZINC000819264748	HI	On-Demand	Bother	TAAR1	41	45
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1	ZINC000819264748	HI	On-Demand	Bother	AKR1C3	22	46
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1	ZINC000819264748	HI	On-Demand	Bother	RIPK1	22	43
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1	ZINC000819264748	HI	On-Demand	Bother	MTCA1	28	53
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1	ZINC000819264748	HI	On-Demand	Bother	P96878_MYCTU	31	53
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1	ZINC000819264748	HI	On-Demand	Bother	KCNK3	139	50
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1	ZINC000819264748	HI	On-Demand	Bother	KCNK9	90	48
C[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)Cc1nsc2ccccc12	ZINC000819264762	GG	On-Demand	Anodyne	GPR119	27	40
C[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)Cc1nsc2ccccc12	ZINC000819264763	GG	On-Demand	Anodyne	GPR119	27	40
O[C@@H](CNCC1(N2CCOCC2)CC1)c1ccccc1Br	ZINC000819264771	FD	On-Demand	Anodyne	HCN1	43	36
O[C@H](CNCC1(N2CCOCC2)CC1)c1ccccc1Br	ZINC000819264772	FD	On-Demand	Anodyne	HCN1	43	36
CS(=O)(=O)c1ccc([C@H](O)CNCCOCC(F)(F)C(F)F)cc1	ZINC000819264805	FD	On-Demand	Anodyne	CTSF	42	32
CS(=O)(=O)c1ccc([C@@H](O)CNCCOCC(F)(F)C(F)F)cc1	ZINC000819264806	FD	On-Demand	Anodyne	CTSF	42	32
O[C@H](CNCCOCC(F)(F)C(F)F)c1ccccc1	ZINC000819264811	CE	On-Demand	Anodyne	ADRB1	42	38
O[C@H](CNCCOCC(F)(F)C(F)F)c1ccccc1	ZINC000819264811	CE	On-Demand	Anodyne	ADRB3	50	44
O[C@@H](CNCCOCC(F)(F)C(F)F)c1ccccc1	ZINC000819264812	CE	On-Demand	Anodyne	ADRB1	42	38
O[C@@H](CNCCOCC(F)(F)C(F)F)c1ccccc1	ZINC000819264812	CE	On-Demand	Anodyne	ADRB3	50	44
COc1ccc(OC)c([C@H](O)CNCC2(N3CCOCC3)CC2)c1	ZINC000819264821	ED	On-Demand	Anodyne	HCN1	44	36
O[C@@H](CNCCOCC(F)(F)C(F)F)c1ccc(Cl)cc1	ZINC000819264894	EF	On-Demand	Anodyne	ADRB2	17	41
COc1cccc([S@@](=O)CC(=O)Nc2ccc3c(c2)CCCN3C)c1	ZINC000819264897	FF	On-Demand	Anodyne	DRD4	46	36
O[C@H](CNC[C@@H]1CCCCN1C1CC1)c1ccccc1	ZINC000819264921	CE	On-Demand	Anodyne	SLC18A2	20	40
O[C@H](CNC[C@@H]1CCCCN1C1CC1)c1ccccc1	ZINC000819264921	CE	On-Demand	Anodyne	Q8WSF8_APLCA	22	40
O[C@H](CNC[C@H]1CCCCN1C1CC1)c1ccccc1	ZINC000819264922	CE	On-Demand	Anodyne	SLC18A2	20	40
O[C@H](CNC[C@H]1CCCCN1C1CC1)c1ccccc1	ZINC000819264922	CE	On-Demand	Anodyne	Q8WSF8_APLCA	22	40
O[C@@H](CNC[C@@H]1CCCCN1C1CC1)c1ccccc1	ZINC000819264923	CE	On-Demand	Anodyne	SLC18A2	20	40
O[C@@H](CNC[C@@H]1CCCCN1C1CC1)c1ccccc1	ZINC000819264923	CE	On-Demand	Anodyne	Q8WSF8_APLCA	22	40
O[C@@H](CNC[C@H]1CCCCN1C1CC1)c1ccccc1	ZINC000819264924	CE	On-Demand	Anodyne	SLC18A2	20	40
O[C@@H](CNC[C@H]1CCCCN1C1CC1)c1ccccc1	ZINC000819264924	CE	On-Demand	Anodyne	Q8WSF8_APLCA	22	40
C[C@@H]1CN(CCCNC[C@H](O)c2cccc(Cl)c2)CCCO1	ZINC000819264945	EE	On-Demand	Anodyne	ADRB1	46	43
C[C@@H]1CN(CCCNC[C@H](O)c2cccc(Cl)c2)CCCO1	ZINC000819264945	EE	On-Demand	Anodyne	ADRB3	54	43
C[C@@H]1CN(CCCNC[C@@H](O)c2cccc(Cl)c2)CCCO1	ZINC000819264946	EE	On-Demand	Anodyne	ADRB1	46	43
C[C@@H]1CN(CCCNC[C@@H](O)c2cccc(Cl)c2)CCCO1	ZINC000819264946	EE	On-Demand	Anodyne	ADRB3	54	43
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(F)c(F)c1)C2	ZINC000819265070	DF	On-Demand	Anodyne	ADRB3	28	55
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1ccc(F)c(F)c1)C2	ZINC000819265071	DF	On-Demand	Anodyne	ADRB3	28	55
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(F)c(F)c1)C2	ZINC000819265072	DF	On-Demand	Anodyne	ADRB3	28	55
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1ccc(F)c(F)c1)C2	ZINC000819265073	DF	On-Demand	Anodyne	ADRB3	28	55
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCc3cc(O)ccc3C2)cc1	ZINC000819265104	EE	On-Demand	Bother	ADRB3	24	52
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCc3cc(O)ccc3C2)cc1	ZINC000819265105	EE	On-Demand	Bother	ADRB3	24	52
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCc3cc(O)ccc3C2)cc1	ZINC000819265106	EE	On-Demand	Bother	ADRB3	24	52
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCc3cc(O)ccc3C2)cc1	ZINC000819265107	EE	On-Demand	Bother	ADRB3	24	52
CCNS(=O)(=O)CCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819265156	EB	On-Demand	Anodyne	MTNR1A	55	44
CCNS(=O)(=O)CCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819265156	EB	On-Demand	Anodyne	MTNR1B	48	44
CCNS(=O)(=O)CCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819265157	EB	On-Demand	Anodyne	MTNR1A	55	44
CCNS(=O)(=O)CCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819265157	EB	On-Demand	Anodyne	MTNR1B	48	44
O[C@H](CNCCOCC(F)(F)C(F)F)c1cccc(F)c1	ZINC000819265170	DE	On-Demand	Anodyne	ADRB1	40	43
O[C@H](CNCCOCC(F)(F)C(F)F)c1cccc(F)c1	ZINC000819265170	DE	On-Demand	Anodyne	ADRB3	42	43
O[C@@H](CNCCOCC(F)(F)C(F)F)c1cccc(F)c1	ZINC000819265171	DE	On-Demand	Anodyne	ADRB1	40	43
O[C@@H](CNCCOCC(F)(F)C(F)F)c1cccc(F)c1	ZINC000819265171	DE	On-Demand	Anodyne	ADRB3	42	43
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cccnc1)C2	ZINC000819265192	CD	On-Demand	Anodyne	ADRB1	26	48
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cccnc1)C2	ZINC000819265192	CD	On-Demand	Anodyne	ADRB3	60	65
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1cccnc1)C2	ZINC000819265193	CD	On-Demand	Anodyne	ADRB1	26	48
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1cccnc1)C2	ZINC000819265193	CD	On-Demand	Anodyne	ADRB3	60	65
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cccnc1)C2	ZINC000819265194	CD	On-Demand	Anodyne	ADRB1	26	48
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cccnc1)C2	ZINC000819265194	CD	On-Demand	Anodyne	ADRB3	60	65
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1cccnc1)C2	ZINC000819265195	CD	On-Demand	Anodyne	ADRB1	26	48
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1cccnc1)C2	ZINC000819265195	CD	On-Demand	Anodyne	ADRB3	60	65
O=C(Nc1ccccc1)Nc1cccc2c1CCN(C(=O)/C=C/[C@@H]1CCCO1)C2	ZINC000819265204	GH	On-Demand	Anodyne	LPL	45	37
O=C(Nc1ccccc1)Nc1cccc2c1CCN(C(=O)/C=C\[C@@H]1CCCO1)C2	ZINC000819265205	GH	On-Demand	Anodyne	LPL	45	37
O=C(Nc1ccccc1)Nc1cccc2c1CCN(C(=O)/C=C/[C@H]1CCCO1)C2	ZINC000819265206	GH	On-Demand	Anodyne	LPL	45	37
O=C(Nc1ccccc1)Nc1cccc2c1CCN(C(=O)/C=C\[C@H]1CCCO1)C2	ZINC000819265207	GH	On-Demand	Anodyne	LPL	45	37
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(F)cc1Cl)C2	ZINC000819265208	EG	On-Demand	Anodyne	ADRB3	21	44
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1ccc(F)cc1Cl)C2	ZINC000819265209	EG	On-Demand	Anodyne	ADRB3	21	44
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(F)cc1Cl)C2	ZINC000819265210	EG	On-Demand	Anodyne	ADRB3	21	44
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1ccc(F)cc1Cl)C2	ZINC000819265211	EG	On-Demand	Anodyne	ADRB3	21	44
O[C@@H](CNCC1(N2CCOCC2)CC1)c1cccnc1	ZINC000819265212	CC	On-Demand	Anodyne	ADRB2	19	41
O[C@@H](CNCC1(N2CCOCC2)CC1)c1cccnc1	ZINC000819265212	CC	On-Demand	Anodyne	ADRB1	20	41
O[C@@H](CNCC1(N2CCOCC2)CC1)c1cccnc1	ZINC000819265212	CC	On-Demand	Anodyne	ADRB3	81	41
O[C@H](CNCC1(N2CCOCC2)CC1)c1cccnc1	ZINC000819265213	CC	On-Demand	Anodyne	ADRB2	19	41
O[C@H](CNCC1(N2CCOCC2)CC1)c1cccnc1	ZINC000819265213	CC	On-Demand	Anodyne	ADRB1	20	41
O[C@H](CNCC1(N2CCOCC2)CC1)c1cccnc1	ZINC000819265213	CC	On-Demand	Anodyne	ADRB3	81	41
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cc(F)ccc1F)C2	ZINC000819265257	DF	On-Demand	Anodyne	ADRB3	21	47
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1cc(F)ccc1F)C2	ZINC000819265258	DF	On-Demand	Anodyne	ADRB3	21	47
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cc(F)ccc1F)C2	ZINC000819265259	DF	On-Demand	Anodyne	ADRB3	21	47
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1cc(F)ccc1F)C2	ZINC000819265260	DF	On-Demand	Anodyne	ADRB3	21	47
Cc1ccccc1[C@@H](O)CNC1CCN(S(=O)(=O)C(C)C)CC1	ZINC000819265324	ED	On-Demand	Anodyne	CCR8	52	32
O[C@H](CNCCOCC(F)(F)C(F)F)c1ccc(Cl)c(F)c1	ZINC000819265363	EG	On-Demand	Anodyne	ADRB2	31	41
O[C@H](CNCCOCC(F)(F)C(F)F)c1ccc(Cl)c(F)c1	ZINC000819265363	EG	On-Demand	Anodyne	ADRB1	27	41
O[C@H](CNCCOCC(F)(F)C(F)F)c1ccc(Cl)c(F)c1	ZINC000819265363	EG	On-Demand	Anodyne	ADRB3	24	41
O[C@@H](CNCCOCC(F)(F)C(F)F)c1ccc(Cl)c(F)c1	ZINC000819265365	EG	On-Demand	Anodyne	ADRB2	31	41
O[C@@H](CNCCOCC(F)(F)C(F)F)c1ccc(Cl)c(F)c1	ZINC000819265365	EG	On-Demand	Anodyne	ADRB1	27	41
O[C@@H](CNCCOCC(F)(F)C(F)F)c1ccc(Cl)c(F)c1	ZINC000819265365	EG	On-Demand	Anodyne	ADRB3	24	41
O[C@@H](CNCCOCC(F)(F)C(F)F)c1cccnc1	ZINC000819265366	CD	On-Demand	Anodyne	ADRB2	30	51
O[C@@H](CNCCOCC(F)(F)C(F)F)c1cccnc1	ZINC000819265366	CD	On-Demand	Anodyne	ADRB1	36	52
O[C@@H](CNCCOCC(F)(F)C(F)F)c1cccnc1	ZINC000819265366	CD	On-Demand	Anodyne	ADRB3	110	52
O[C@H](CNCCOCC(F)(F)C(F)F)c1cccnc1	ZINC000819265367	CD	On-Demand	Anodyne	ADRB2	30	51
O[C@H](CNCCOCC(F)(F)C(F)F)c1cccnc1	ZINC000819265367	CD	On-Demand	Anodyne	ADRB1	36	52
O[C@H](CNCCOCC(F)(F)C(F)F)c1cccnc1	ZINC000819265367	CD	On-Demand	Anodyne	ADRB3	110	52
COc1cccc([S@@](=O)CC(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2C)c1	ZINC000819265390	GE	On-Demand	Anodyne	GPR119	30	41
COc1cccc([S@](=O)CC(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2C)c1	ZINC000819265391	GE	On-Demand	Anodyne	GPR119	30	41
COc1cccc([S@](=O)CC(=O)N2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)c1	ZINC000819265392	GE	On-Demand	Anodyne	GPR119	30	41
COc1cccc([S@@](=O)CC(=O)N2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)c1	ZINC000819265393	GE	On-Demand	Anodyne	GPR119	30	41
O[C@H](CNCCOCC(F)(F)C(F)F)c1cccc(C(F)(F)F)c1	ZINC000819265408	FG	On-Demand	Mild	ADRB3	41	36
O[C@@H](CNCCOCC(F)(F)C(F)F)c1cccc(C(F)(F)F)c1	ZINC000819265409	FG	On-Demand	Mild	ADRB3	41	36
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCc3cc(O)ccc3C2)CC1	ZINC000819265410	GF	On-Demand	Anodyne	ADRB3	20	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCc3cc(O)ccc3C2)CC1	ZINC000819265410	GF	On-Demand	Anodyne	GPR119	41	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCc3cc(O)ccc3C2)CC1	ZINC000819265411	GF	On-Demand	Anodyne	ADRB3	20	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCc3cc(O)ccc3C2)CC1	ZINC000819265411	GF	On-Demand	Anodyne	GPR119	41	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCc3cc(O)ccc3C2)CC1	ZINC000819265412	GF	On-Demand	Anodyne	ADRB3	20	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCc3cc(O)ccc3C2)CC1	ZINC000819265412	GF	On-Demand	Anodyne	GPR119	41	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCc3cc(O)ccc3C2)CC1	ZINC000819265413	GF	On-Demand	Anodyne	ADRB3	20	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCc3cc(O)ccc3C2)CC1	ZINC000819265413	GF	On-Demand	Anodyne	GPR119	41	42
Cc1ccccc1[C@@H](O)CNCC1(N2CCOCC2)CC1	ZINC000819265420	CD	On-Demand	Anodyne	HCN1	58	38
Cc1ccccc1[C@@H](O)CNCC1(N2CCOCC2)CC1	ZINC000819265420	CD	On-Demand	Anodyne	HCN4	48	31
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265431	FG	On-Demand	Anodyne	OPRM1	23	45
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265431	FG	On-Demand	Anodyne	MME	55	37
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265431	FG	On-Demand	Anodyne	FCER2	61	37
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265431	FG	On-Demand	Anodyne	TIMP3	95	43
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265431	FG	On-Demand	Anodyne	REN	53	35
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265431	FG	On-Demand	Anodyne	MMP9	17	43
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265431	FG	On-Demand	Anodyne	ACE2	41	36
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265431	FG	On-Demand	Anodyne	HDAC11	40	35
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265431	FG	On-Demand	Anodyne	MMP1	25	40
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265431	FG	On-Demand	Anodyne	FPR1	50	40
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265432	FG	On-Demand	Anodyne	OPRM1	23	45
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265432	FG	On-Demand	Anodyne	MME	55	37
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265432	FG	On-Demand	Anodyne	FCER2	61	37
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265432	FG	On-Demand	Anodyne	TIMP3	95	43
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265432	FG	On-Demand	Anodyne	REN	53	35
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265432	FG	On-Demand	Anodyne	MMP9	17	43
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265432	FG	On-Demand	Anodyne	ACE2	41	36
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265432	FG	On-Demand	Anodyne	HDAC11	40	35
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265432	FG	On-Demand	Anodyne	MMP1	25	40
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265432	FG	On-Demand	Anodyne	FPR1	50	40
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265433	FG	On-Demand	Anodyne	OPRM1	23	45
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265433	FG	On-Demand	Anodyne	MME	55	37
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265433	FG	On-Demand	Anodyne	FCER2	61	37
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265433	FG	On-Demand	Anodyne	TIMP3	95	43
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265433	FG	On-Demand	Anodyne	REN	53	35
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265433	FG	On-Demand	Anodyne	MMP9	17	43
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265433	FG	On-Demand	Anodyne	ACE2	41	36
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265433	FG	On-Demand	Anodyne	HDAC11	40	35
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265433	FG	On-Demand	Anodyne	MMP1	25	40
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265433	FG	On-Demand	Anodyne	FPR1	50	40
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265434	FG	On-Demand	Anodyne	OPRM1	23	45
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265434	FG	On-Demand	Anodyne	MME	55	37
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265434	FG	On-Demand	Anodyne	FCER2	61	37
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265434	FG	On-Demand	Anodyne	TIMP3	95	43
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265434	FG	On-Demand	Anodyne	REN	53	35
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265434	FG	On-Demand	Anodyne	MMP9	17	43
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265434	FG	On-Demand	Anodyne	ACE2	41	36
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265434	FG	On-Demand	Anodyne	HDAC11	40	35
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265434	FG	On-Demand	Anodyne	MMP1	25	40
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819265434	FG	On-Demand	Anodyne	FPR1	50	40
O[C@@H](CNC[C@H]1CCCCN1C1CC1)c1cccnc1	ZINC000819265443	CD	On-Demand	Anodyne	ADRB2	20	40
O[C@@H](CNC[C@H]1CCCCN1C1CC1)c1cccnc1	ZINC000819265443	CD	On-Demand	Anodyne	ADRB1	22	42
O[C@@H](CNC[C@H]1CCCCN1C1CC1)c1cccnc1	ZINC000819265443	CD	On-Demand	Anodyne	ADRB3	88	45
O[C@@H](CNC[C@@H]1CCCCN1C1CC1)c1cccnc1	ZINC000819265444	CD	On-Demand	Anodyne	ADRB2	20	40
O[C@@H](CNC[C@@H]1CCCCN1C1CC1)c1cccnc1	ZINC000819265444	CD	On-Demand	Anodyne	ADRB1	22	42
O[C@@H](CNC[C@@H]1CCCCN1C1CC1)c1cccnc1	ZINC000819265444	CD	On-Demand	Anodyne	ADRB3	88	45
O[C@H](CNC[C@H]1CCCCN1C1CC1)c1cccnc1	ZINC000819265445	CD	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNC[C@H]1CCCCN1C1CC1)c1cccnc1	ZINC000819265445	CD	On-Demand	Anodyne	ADRB1	22	42
O[C@H](CNC[C@H]1CCCCN1C1CC1)c1cccnc1	ZINC000819265445	CD	On-Demand	Anodyne	ADRB3	88	45
CCO[C@@H](CNC[C@@H](O)c1ccc(C)cc1)c1ccccc1	ZINC000819265463	CG	On-Demand	Anodyne	ADRB2	15	45
CCO[C@@H](CNC[C@H](O)c1ccc(C)cc1)c1ccccc1	ZINC000819265464	CG	On-Demand	Anodyne	ADRB2	15	45
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1ccc(F)cc1)C2	ZINC000819265473	DF	On-Demand	Anodyne	ADRB3	26	54
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(F)cc1)C2	ZINC000819265474	DF	On-Demand	Anodyne	ADRB3	26	54
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1ccc(F)cc1)C2	ZINC000819265475	DF	On-Demand	Anodyne	ADRB3	26	54
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(F)cc1)C2	ZINC000819265476	DF	On-Demand	Anodyne	ADRB3	26	54
Cc1ccccc1[C@@H](O)CN[C@@H]1CCc2cc(O)ccc2C1	ZINC000819265494	CF	On-Demand	Anodyne	ADRB3	21	45
Cc1ccccc1[C@@H](O)CN[C@H]1CCc2cc(O)ccc2C1	ZINC000819265495	CF	On-Demand	Anodyne	ADRB3	21	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc3c(n2)CCCC3)CC1	ZINC000819265503	GG	On-Demand	Anodyne	GPR119	46	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc3c(n2)CCCC3)CC1	ZINC000819265504	GG	On-Demand	Anodyne	GPR119	46	43
Cc1cc(N2CCC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2)n(C)n1	ZINC000819265505	EF	On-Demand	Anodyne	ADRB1	27	44
Cc1cc(N2CCC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2)n(C)n1	ZINC000819265505	EF	On-Demand	Anodyne	ADRB3	44	44
Cc1cc(N2CCC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C2)n(C)n1	ZINC000819265505	EF	On-Demand	Anodyne	CYP3A4	49	38
Cc1cc(N2CCC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2)n(C)n1	ZINC000819265506	EF	On-Demand	Anodyne	ADRB1	27	44
Cc1cc(N2CCC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2)n(C)n1	ZINC000819265506	EF	On-Demand	Anodyne	ADRB3	44	44
Cc1cc(N2CCC[C@@H](NC[C@@H](O)c3cccc(Cl)c3)C2)n(C)n1	ZINC000819265506	EF	On-Demand	Anodyne	CYP3A4	49	38
Cc1cc(N2CCC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2)n(C)n1	ZINC000819265507	EF	On-Demand	Anodyne	ADRB1	27	44
Cc1cc(N2CCC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2)n(C)n1	ZINC000819265507	EF	On-Demand	Anodyne	ADRB3	44	44
Cc1cc(N2CCC[C@H](NC[C@H](O)c3cccc(Cl)c3)C2)n(C)n1	ZINC000819265507	EF	On-Demand	Anodyne	CYP3A4	49	38
Cc1cc(N2CCC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2)n(C)n1	ZINC000819265508	EF	On-Demand	Anodyne	ADRB1	27	44
Cc1cc(N2CCC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2)n(C)n1	ZINC000819265508	EF	On-Demand	Anodyne	ADRB3	44	44
Cc1cc(N2CCC[C@@H](NC[C@H](O)c3cccc(Cl)c3)C2)n(C)n1	ZINC000819265508	EF	On-Demand	Anodyne	CYP3A4	49	38
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000819265509	FH	On-Demand	Anodyne	ADRB3	24	52
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000819265510	FH	On-Demand	Anodyne	ADRB3	24	52
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000819265511	FH	On-Demand	Anodyne	ADRB3	24	52
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000819265512	FH	On-Demand	Anodyne	ADRB3	24	52
CCO[C@@H](CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819265536	CE	On-Demand	Anodyne	ADRB2	24	45
CCO[C@@H](CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819265536	CE	On-Demand	Anodyne	ADRB1	27	45
CCO[C@@H](CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819265536	CE	On-Demand	Anodyne	ADRB3	97	46
CCO[C@@H](CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819265537	CE	On-Demand	Anodyne	ADRB2	24	45
CCO[C@@H](CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819265537	CE	On-Demand	Anodyne	ADRB1	27	45
CCO[C@@H](CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819265537	CE	On-Demand	Anodyne	ADRB3	97	46
O[C@H](CNC[C@@H]1CCCCN1C1CC1)c1cccnc1	ZINC000819265541	CD	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNC[C@@H]1CCCCN1C1CC1)c1cccnc1	ZINC000819265541	CD	On-Demand	Anodyne	ADRB1	22	42
O[C@H](CNC[C@@H]1CCCCN1C1CC1)c1cccnc1	ZINC000819265541	CD	On-Demand	Anodyne	ADRB3	88	45
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1ccc(F)cn1)C2	ZINC000819265545	DE	On-Demand	Anodyne	ADRB3	20	43
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1ccc(F)cn1)C2	ZINC000819265547	DE	On-Demand	Anodyne	ADRB3	20	43
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(F)cn1)C2	ZINC000819265549	DE	On-Demand	Anodyne	ADRB3	20	43
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(F)cn1)C2	ZINC000819265551	DE	On-Demand	Anodyne	ADRB3	20	43
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(F)c(Br)c1)C2	ZINC000819265556	GG	On-Demand	Anodyne	ADRB3	26	52
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1ccc(F)c(Br)c1)C2	ZINC000819265557	GG	On-Demand	Anodyne	ADRB3	26	52
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(F)c(Br)c1)C2	ZINC000819265558	GG	On-Demand	Anodyne	ADRB3	26	52
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1ccc(F)c(Br)c1)C2	ZINC000819265559	GG	On-Demand	Anodyne	ADRB3	26	52
O[C@@H](CNCC1(N2CCOCC2)CC1)c1ccccc1F	ZINC000819265573	CD	On-Demand	Anodyne	HCN1	43	36
O[C@H](CNCC1(N2CCOCC2)CC1)c1ccccc1F	ZINC000819265574	CD	On-Demand	Anodyne	HCN1	43	36
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cccc3ccccc13)C2	ZINC000819265580	EH	On-Demand	Anodyne	ADRB3	22	47
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1cccc3ccccc13)C2	ZINC000819265581	EH	On-Demand	Anodyne	ADRB3	22	47
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819265636	HJ	On-Demand	Bother	PPIA	23	43
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819265636	HJ	On-Demand	Bother	HDAC8	26	51
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819265636	HJ	On-Demand	Bother	NMBR	47	32
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819265636	HJ	On-Demand	Bother	MMP2	23	57
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819265636	HJ	On-Demand	Bother	MMP8	18	41
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819265636	HJ	On-Demand	Bother	HDAC1	21	53
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819265636	HJ	On-Demand	Bother	HDAC6	15	51
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819265636	HJ	On-Demand	Bother	MMP9	24	57
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819265636	HJ	On-Demand	Bother	KCNK3	49	34
C[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819265642	GE	On-Demand	Anodyne	GPR119	37	48
C[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819265643	GE	On-Demand	Anodyne	GPR119	37	48
O[C@@H](CNCC1CCN(C2CC2)CC1)c1ccc(Cl)cc1	ZINC000819265648	DF	On-Demand	Anodyne	SLC6A3	19	41
Cc1ncc(CN2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)s1	ZINC000819265649	DD	On-Demand	Anodyne	MGEA5	33	40
Cc1ncc(CN2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)s1	ZINC000819265650	DD	On-Demand	Anodyne	MGEA5	33	40
Cc1ncc(CN2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)s1	ZINC000819265651	DD	On-Demand	Anodyne	MGEA5	33	40
Cc1ncc(CN2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)s1	ZINC000819265652	DD	On-Demand	Anodyne	MGEA5	33	40
O[C@@H](CNCc1ccc(OC(F)F)cn1)c1cccc(Cl)c1	ZINC000819265653	EG	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNCc1ccc(OC(F)F)cn1)c1cccc(Cl)c1	ZINC000819265653	EG	On-Demand	Anodyne	ADRB1	41	44
O[C@@H](CNCc1ccc(OC(F)F)cn1)c1cccc(Cl)c1	ZINC000819265653	EG	On-Demand	Anodyne	ADRB3	54	44
O[C@H](CNCc1ccc(OC(F)F)cn1)c1cccc(Cl)c1	ZINC000819265654	EG	On-Demand	Anodyne	ADRB2	19	40
O[C@H](CNCc1ccc(OC(F)F)cn1)c1cccc(Cl)c1	ZINC000819265654	EG	On-Demand	Anodyne	ADRB1	41	44
O[C@H](CNCc1ccc(OC(F)F)cn1)c1cccc(Cl)c1	ZINC000819265654	EG	On-Demand	Anodyne	ADRB3	54	44
O[C@@H](CNCC1CCN(C2CC2)CC1)c1cccc(C(F)(F)F)c1	ZINC000819265660	EG	On-Demand	Anodyne	TACR1	22	40
O[C@@H](CNCC1CCN(C2CC2)CC1)c1cccc(C(F)(F)F)c1	ZINC000819265660	EG	On-Demand	Anodyne	CCR2	51	40
O[C@H](CNCC1CCN(C2CC2)CC1)c1cccc(C(F)(F)F)c1	ZINC000819265661	EG	On-Demand	Anodyne	TACR1	22	40
O[C@H](CNCC1CCN(C2CC2)CC1)c1cccc(C(F)(F)F)c1	ZINC000819265661	EG	On-Demand	Anodyne	CCR2	51	40
C[C@@H]1C[C@H](NC[C@@H](O)COc2ccccc2)CCN1C(=O)OC(C)(C)C	ZINC000819265663	FF	On-Demand	Anodyne	ADRB2	39	46
C[C@@H]1C[C@H](NC[C@@H](O)COc2ccccc2)CCN1C(=O)OC(C)(C)C	ZINC000819265663	FF	On-Demand	Anodyne	ADRB1	58	46
C[C@@H]1C[C@H](NC[C@@H](O)COc2ccccc2)CCN1C(=O)OC(C)(C)C	ZINC000819265663	FF	On-Demand	Anodyne	ADRB3	51	46
C[C@@H]1C[C@H](NC[C@H](O)COc2ccccc2)CCN1C(=O)OC(C)(C)C	ZINC000819265666	FF	On-Demand	Anodyne	ADRB2	39	46
C[C@@H]1C[C@H](NC[C@H](O)COc2ccccc2)CCN1C(=O)OC(C)(C)C	ZINC000819265666	FF	On-Demand	Anodyne	ADRB1	58	46
C[C@@H]1C[C@H](NC[C@H](O)COc2ccccc2)CCN1C(=O)OC(C)(C)C	ZINC000819265666	FF	On-Demand	Anodyne	ADRB3	51	46
C[C@@H]1C[C@H](NC[C@H](O)CCc2ccccc2)CCN1C(=O)OC(C)(C)C	ZINC000819265689	FG	On-Demand	Anodyne	REN	42	36
C[C@@H]1C[C@H](NC[C@@H](O)CCc2ccccc2)CCN1C(=O)OC(C)(C)C	ZINC000819265693	FG	On-Demand	Anodyne	REN	42	36
C[S@](=O)c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819265695	GF	On-Demand	Mild	PAPA1_CARPA	46	44
C[S@@](=O)c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819265700	GF	On-Demand	Mild	PAPA1_CARPA	46	44
C[S@@](=O)c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819265702	GF	On-Demand	Mild	PAPA1_CARPA	46	44
C[S@](=O)c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819265704	GF	On-Demand	Mild	PAPA1_CARPA	46	44
Cc1cc(N2CCC[C@H](NC[C@H](O)c3ccc(Cl)cc3)C2)n(C)n1	ZINC000819265712	EF	On-Demand	Anodyne	ADRB3	15	41
Cc1cc(N2CCC[C@@H](NC[C@H](O)c3ccc(Cl)cc3)C2)n(C)n1	ZINC000819265714	EF	On-Demand	Anodyne	ADRB3	15	41
CON(C)C(=O)CCNCc1ccc(S(N)(=O)=O)cc1C	ZINC000819265733	DC	On-Demand	Anodyne	CA2	50	38
CON(C)C(=O)CCNCc1ccc(S(N)(=O)=O)cc1C	ZINC000819265733	DC	On-Demand	Anodyne	CA1	47	38
CON(C)C(=O)CCNCc1ccc(S(N)(=O)=O)cc1C	ZINC000819265733	DC	On-Demand	Anodyne	CA7	41	33
CON(C)C(=O)CCNCc1ccc(S(N)(=O)=O)cc1C	ZINC000819265733	DC	On-Demand	Anodyne	CA5B	53	33
CON(C)C(=O)CCNCc1ccc(S(N)(=O)=O)cc1C	ZINC000819265733	DC	On-Demand	Anodyne	CA4	42	37
CON(C)C(=O)CCNCc1ccc(S(N)(=O)=O)cc1C	ZINC000819265733	DC	On-Demand	Anodyne	CA5A	56	33
O[C@@H](CNCc1ccc2c(n1)CCCC2)c1cccnc1	ZINC000819265757	CE	On-Demand	Anodyne	ADRB2	23	41
O[C@@H](CNCc1ccc2c(n1)CCCC2)c1cccnc1	ZINC000819265757	CE	On-Demand	Anodyne	ADRB3	92	42
O[C@H](CNCc1ccc2c(n1)CCCC2)c1cccnc1	ZINC000819265759	CE	On-Demand	Anodyne	ADRB2	23	41
O[C@H](CNCc1ccc2c(n1)CCCC2)c1cccnc1	ZINC000819265759	CE	On-Demand	Anodyne	ADRB3	92	42
C[C@@H]1C[C@H](NC[C@H](O)c2c(F)cccc2F)CCN1C(=O)OC(C)(C)C	ZINC000819265787	FG	On-Demand	Anodyne	GPR119	25	43
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCc3cc(O)ccc3C2)c1	ZINC000819265788	EE	On-Demand	Bother	ADRB3	25	52
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCc3cc(O)ccc3C2)c1	ZINC000819265790	EE	On-Demand	Bother	ADRB3	25	52
C[C@@H]1C[C@H](NC[C@@H](O)c2c(F)cccc2F)CCN1C(=O)OC(C)(C)C	ZINC000819265791	FG	On-Demand	Anodyne	GPR119	25	43
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCc3cc(O)ccc3C2)c1	ZINC000819265792	EE	On-Demand	Bother	ADRB3	25	52
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCc3cc(O)ccc3C2)c1	ZINC000819265794	EE	On-Demand	Bother	ADRB3	25	52
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1cccc(Br)c1)C2	ZINC000819265797	FG	On-Demand	Anodyne	ADRB3	26	52
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cccc(Br)c1)C2	ZINC000819265798	FG	On-Demand	Anodyne	ADRB3	26	52
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1cccc(Br)c1)C2	ZINC000819265799	FG	On-Demand	Anodyne	ADRB3	26	52
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cccc(Br)c1)C2	ZINC000819265800	FG	On-Demand	Anodyne	ADRB3	26	52
O[C@H](CNCc1ccc(OC(F)F)cn1)COc1ccc(Cl)c(Cl)c1	ZINC000819265805	GH	On-Demand	Anodyne	ADRB2	20	42
O[C@H](CNCc1ccc(OC(F)F)cn1)COc1ccc(Cl)c(Cl)c1	ZINC000819265805	GH	On-Demand	Anodyne	ADRB1	21	42
O[C@H](CNCc1ccc(OC(F)F)cn1)COc1ccc(Cl)c(Cl)c1	ZINC000819265805	GH	On-Demand	Anodyne	GRIN1	27	43
O[C@H](CNCc1ccc(OC(F)F)cn1)COc1ccc(Cl)c(Cl)c1	ZINC000819265805	GH	On-Demand	Anodyne	ADRB3	15	42
O[C@@H](CNCc1ccc(OC(F)F)cn1)COc1ccc(Cl)c(Cl)c1	ZINC000819265806	GH	On-Demand	Anodyne	ADRB2	20	42
O[C@@H](CNCc1ccc(OC(F)F)cn1)COc1ccc(Cl)c(Cl)c1	ZINC000819265806	GH	On-Demand	Anodyne	ADRB1	21	42
O[C@@H](CNCc1ccc(OC(F)F)cn1)COc1ccc(Cl)c(Cl)c1	ZINC000819265806	GH	On-Demand	Anodyne	GRIN1	27	43
O[C@@H](CNCc1ccc(OC(F)F)cn1)COc1ccc(Cl)c(Cl)c1	ZINC000819265806	GH	On-Demand	Anodyne	ADRB3	15	42
CC(=O)Nc1cccc(CC(=O)Nc2ccc3c(c2)CCCN3C)c1	ZINC000819265859	EG	On-Demand	Anodyne	AVPR2	17	46
CC(=O)Nc1cccc(CC(=O)Nc2ccc3c(c2)CCCN3C)c1	ZINC000819265859	EG	On-Demand	Anodyne	NPY2R	20	40
C[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819265910	FD	On-Demand	Anodyne	GPR119	25	41
C[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)c1cc2c(cn1)OCCO2	ZINC000819265911	FD	On-Demand	Anodyne	GPR119	25	41
O=C(/C=C/[C@@H]1CCCO1)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000819265913	DD	On-Demand	Bother	SLC27A4	42	31
O=C(/C=C\[C@H]1CCCO1)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000819265914	DD	On-Demand	Bother	SLC27A4	42	31
O=C(/C=C/[C@H]1CCCO1)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000819265915	DD	On-Demand	Bother	SLC27A4	42	31
O=C(/C=C\[C@@H]1CCCO1)NCCOc1ccc([N+](=O)[O-])cc1	ZINC000819265916	DD	On-Demand	Bother	SLC27A4	42	31
O=C(NCCCc1cccc(F)c1)C(F)=C1CCC1	ZINC000819265924	CG	On-Demand	Anodyne	CRTM	40	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnn1	ZINC000819265935	FE	On-Demand	Anodyne	CTSD	72	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnn1	ZINC000819265935	FE	On-Demand	Anodyne	PGC	60	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnn1	ZINC000819265935	FE	On-Demand	Anodyne	PAPA1_CARPA	32	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnn1	ZINC000819265935	FE	On-Demand	Anodyne	PGA	39	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnn1	ZINC000819265935	FE	On-Demand	Anodyne	TACR3	16	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnn1	ZINC000819265935	FE	On-Demand	Anodyne	REN	81	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnn1	ZINC000819265935	FE	On-Demand	Anodyne	REN1	26	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnn1	ZINC000819265935	FE	On-Demand	Anodyne	BACE1	70	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnn1	ZINC000819265935	FE	On-Demand	Anodyne	FPR1	48	39
O=C(C(F)=C1CCC1)N(CCCn1ccnc1)Cc1c(F)cccc1Cl	ZINC000819265989	GJ	On-Demand	Anodyne	TBXAS1	28	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)c1	ZINC000819265992	JK	On-Demand	Anodyne	PRS	43	47
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)c1	ZINC000819265992	JK	On-Demand	Anodyne	FLT1	18	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)c1	ZINC000819265992	JK	On-Demand	Anodyne	KDR	41	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)c1	ZINC000819265992	JK	On-Demand	Anodyne	TACR3	32	52
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)c1	ZINC000819265992	JK	On-Demand	Anodyne	ROCK2	27	43
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)c1	ZINC000819265992	JK	On-Demand	Anodyne	CSF1R	15	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)c1	ZINC000819265992	JK	On-Demand	Anodyne	CYP2C9	21	88
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)c1	ZINC000819265992	JK	On-Demand	Anodyne	ATR	40	46
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)c1	ZINC000819265992	JK	On-Demand	Anodyne	NR2E3	61	34
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)c1	ZINC000819265992	JK	On-Demand	Anodyne	RIPK1	45	36
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)c1	ZINC000819265992	JK	On-Demand	Anodyne	SMO	22	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)c1	ZINC000819265992	JK	On-Demand	Anodyne	MT-CO2	56	44
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)c1	ZINC000819265992	JK	On-Demand	Anodyne	KCNK3	119	48
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)c1	ZINC000819265992	JK	On-Demand	Anodyne	KCNK9	82	38
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1cccc(F)c1)C2	ZINC000819265996	DF	On-Demand	Anodyne	ADRB3	26	52
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cccc(F)c1)C2	ZINC000819265997	DF	On-Demand	Anodyne	ADRB3	26	52
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1cccc(F)c1)C2	ZINC000819265998	DF	On-Demand	Anodyne	ADRB3	26	52
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cccc(F)c1)C2	ZINC000819265999	DF	On-Demand	Anodyne	ADRB3	26	52
CCO[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000819266018	EF	On-Demand	Bother	CACNA1C	48	37
CCO[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000819266018	EF	On-Demand	Bother	ADRB3	42	34
CCO[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000819266018	EF	On-Demand	Bother	CACNA1D	68	37
CCO[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000819266021	EF	On-Demand	Bother	CACNA1C	48	37
CCO[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000819266021	EF	On-Demand	Bother	ADRB3	42	34
CCO[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000819266021	EF	On-Demand	Bother	CACNA1D	68	37
O[C@@H](CNc1cnn(Cc2nnc3n2CCCC3)c1)c1cccc(Cl)c1	ZINC000819266032	FF	On-Demand	Anodyne	CYP3A4	40	34
O[C@H](CNc1cnn(Cc2nnc3n2CCCC3)c1)c1cccc(Cl)c1	ZINC000819266033	FF	On-Demand	Anodyne	CYP3A4	40	34
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCc3cc(O)ccc3C2)cc1	ZINC000819266035	FD	On-Demand	Anodyne	ADRB1	17	50
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCc3cc(O)ccc3C2)cc1	ZINC000819266035	FD	On-Demand	Anodyne	ADRB3	30	51
O[C@@H](CNCC1CCN(C2CC2)CC1)c1ccccc1Cl	ZINC000819266036	DF	On-Demand	Anodyne	OPRL1	53	42
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCc3cc(O)ccc3C2)cc1	ZINC000819266037	FD	On-Demand	Anodyne	ADRB1	17	50
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCc3cc(O)ccc3C2)cc1	ZINC000819266037	FD	On-Demand	Anodyne	ADRB3	30	51
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCc3cc(O)ccc3C2)cc1	ZINC000819266039	FD	On-Demand	Anodyne	ADRB1	17	50
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCc3cc(O)ccc3C2)cc1	ZINC000819266039	FD	On-Demand	Anodyne	ADRB3	30	51
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCc3cc(O)ccc3C2)cc1	ZINC000819266041	FD	On-Demand	Anodyne	ADRB1	17	50
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCc3cc(O)ccc3C2)cc1	ZINC000819266041	FD	On-Demand	Anodyne	ADRB3	30	51
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(Cl)c(F)c1)C2	ZINC000819266044	EG	On-Demand	Anodyne	ADRB3	27	53
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1ccc(Cl)c(F)c1)C2	ZINC000819266046	EG	On-Demand	Anodyne	ADRB3	27	53
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(Cl)c(F)c1)C2	ZINC000819266048	EG	On-Demand	Anodyne	ADRB3	27	53
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2CCN(C3CC3)CC2)CC1	ZINC000819266049	GE	On-Demand	Anodyne	GPR119	31	42
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1ccc(Cl)c(F)c1)C2	ZINC000819266050	EG	On-Demand	Anodyne	ADRB3	27	53
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2CCN(C3CC3)CC2)CC1	ZINC000819266051	GE	On-Demand	Anodyne	GPR119	31	42
O=C(NCCCNC(=O)c1ccc(F)cc1)C(F)=C1CCC1	ZINC000819266067	DE	On-Demand	Anodyne	FOLH1	16	42
O=C(NCCCNC(=O)c1ccc(F)cc1)C(F)=C1CCC1	ZINC000819266067	DE	On-Demand	Anodyne	BCHE	23	47
O[C@@H](CNCC1CCN(C2CC2)CC1)c1cccc(F)c1	ZINC000819266071	CE	On-Demand	Anodyne	ADRB1	22	40
O[C@@H](CNCC1CCN(C2CC2)CC1)c1cccc(F)c1	ZINC000819266071	CE	On-Demand	Anodyne	ADRB3	29	40
O[C@H](CNCC1CCN(C2CC2)CC1)c1cccc(F)c1	ZINC000819266072	CE	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CNCC1CCN(C2CC2)CC1)c1cccc(F)c1	ZINC000819266072	CE	On-Demand	Anodyne	ADRB3	29	40
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccccc1C(F)(F)F)C2	ZINC000819266088	FH	On-Demand	Anodyne	ADRB3	21	46
C[C@@H]1C[C@H](NC[C@@H](O)COc2ccccc2F)CCN1C(=O)OC(C)(C)C	ZINC000819266097	GF	On-Demand	Anodyne	ADRB2	29	46
C[C@@H]1C[C@H](NC[C@@H](O)COc2ccccc2F)CCN1C(=O)OC(C)(C)C	ZINC000819266097	GF	On-Demand	Anodyne	ADRB3	23	44
C[C@@H]1C[C@H](NC[C@@H](O)COc2ccccc2F)CCN1C(=O)OC(C)(C)C	ZINC000819266097	GF	On-Demand	Anodyne	ABCB1	21	40
C[C@@H]1C[C@H](NC[C@@H](O)COc2ccccc2F)CCN1C(=O)OC(C)(C)C	ZINC000819266097	GF	On-Demand	Anodyne	GPR119	16	42
C[C@@H]1C[C@H](NC[C@H](O)COc2ccccc2F)CCN1C(=O)OC(C)(C)C	ZINC000819266098	GF	On-Demand	Anodyne	ADRB2	29	46
C[C@@H]1C[C@H](NC[C@H](O)COc2ccccc2F)CCN1C(=O)OC(C)(C)C	ZINC000819266098	GF	On-Demand	Anodyne	ADRB3	23	44
C[C@@H]1C[C@H](NC[C@H](O)COc2ccccc2F)CCN1C(=O)OC(C)(C)C	ZINC000819266098	GF	On-Demand	Anodyne	ABCB1	21	40
C[C@@H]1C[C@H](NC[C@H](O)COc2ccccc2F)CCN1C(=O)OC(C)(C)C	ZINC000819266098	GF	On-Demand	Anodyne	GPR119	16	42
O[C@@H](CNCC1CCN(C2CC2)CC1)c1ccc(Cl)cc1Cl	ZINC000819266101	EG	On-Demand	Anodyne	CACNA1I	49	34
O[C@H](CNCC1CCN(C2CC2)CC1)c1ccc(Cl)cc1Cl	ZINC000819266102	EG	On-Demand	Anodyne	CACNA1I	49	34
C[C@@H]1C[C@H](NC[C@H](O)c2cccnc2)CCN1C(=O)OC(C)(C)C	ZINC000819266120	EE	On-Demand	Anodyne	ADRB1	21	41
C[C@@H]1C[C@H](NC[C@H](O)c2cccnc2)CCN1C(=O)OC(C)(C)C	ZINC000819266120	EE	On-Demand	Anodyne	ADRB3	66	51
C[C@@H]1C[C@H](NC[C@@H](O)c2cccnc2)CCN1C(=O)OC(C)(C)C	ZINC000819266122	EE	On-Demand	Anodyne	ADRB1	21	41
C[C@@H]1C[C@H](NC[C@@H](O)c2cccnc2)CCN1C(=O)OC(C)(C)C	ZINC000819266122	EE	On-Demand	Anodyne	ADRB3	66	51
O[C@@H](CNC[C@H]1CCCCN1C1CC1)c1ccccc1Cl	ZINC000819266143	DF	On-Demand	Anodyne	OPRL1	46	42
O[C@@H](CNC[C@@H]1CCCCN1C1CC1)c1ccccc1Cl	ZINC000819266146	DF	On-Demand	Anodyne	OPRL1	46	42
O[C@@H](CNCC1CCN(C2CC2)CC1)c1ccc(F)cc1	ZINC000819266163	CE	On-Demand	Anodyne	SLC6A3	46	49
O[C@H](CNCC1CCN(C2CC2)CC1)c1ccc(F)cc1	ZINC000819266164	CE	On-Demand	Anodyne	SLC6A3	46	49
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCC3(CC2)CC3)cc1	ZINC000819266175	DE	On-Demand	Anodyne	ADRB3	26	42
CS(=O)(=O)c1ccc([C@H](O)CNC2CCC3(CC2)CC3)cc1	ZINC000819266176	DE	On-Demand	Anodyne	ADRB3	26	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1CCc2cc(O)ccc2C1	ZINC000819266177	FE	On-Demand	Anodyne	SLC6A5	26	47
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CCc2cc(O)ccc2C1	ZINC000819266178	FE	On-Demand	Anodyne	SLC6A5	26	47
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CCc2cc(O)ccc2C1	ZINC000819266179	FE	On-Demand	Anodyne	SLC6A5	26	47
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H]1CCc2cc(O)ccc2C1	ZINC000819266180	FE	On-Demand	Anodyne	SLC6A5	26	47
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@H]1CCc2cc(O)ccc2C1	ZINC000819266189	FE	On-Demand	Anodyne	ADRB3	20	40
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1CCc2cc(O)ccc2C1	ZINC000819266190	FE	On-Demand	Anodyne	ADRB3	20	40
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CCc2cc(O)ccc2C1	ZINC000819266191	FE	On-Demand	Anodyne	ADRB3	20	40
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CCc2cc(O)ccc2C1	ZINC000819266192	FE	On-Demand	Anodyne	ADRB3	20	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2CCC3(CC2)CC3)CC1	ZINC000819266198	FG	On-Demand	Anodyne	GPR119	28	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2CCC3(CC2)CC3)CC1	ZINC000819266199	FG	On-Demand	Anodyne	GPR119	28	42
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1ccccc1Cl)C2	ZINC000819266206	DG	On-Demand	Anodyne	ADRB3	22	46
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccccc1Cl)C2	ZINC000819266207	DG	On-Demand	Anodyne	ADRB3	22	46
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@H]2CCc3cc(O)ccc3C2)CC1	ZINC000819266235	GF	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@@H]2CCc3cc(O)ccc3C2)CC1	ZINC000819266236	GF	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@H]2CCc3cc(O)ccc3C2)CC1	ZINC000819266237	GF	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@@H]2CCc3cc(O)ccc3C2)CC1	ZINC000819266238	GF	On-Demand	Anodyne	GPR119	29	40
O=[N+]([O-])c1cc(CNC[C@H](O)c2cccc(Cl)c2)cc(C(F)(F)F)c1	ZINC000819266245	FI	On-Demand	Bother	ADRB1	27	43
O=[N+]([O-])c1cc(CNC[C@H](O)c2cccc(Cl)c2)cc(C(F)(F)F)c1	ZINC000819266245	FI	On-Demand	Bother	ADRB3	43	43
O=[N+]([O-])c1cc(CNC[C@@H](O)c2cccc(Cl)c2)cc(C(F)(F)F)c1	ZINC000819266247	FI	On-Demand	Bother	ADRB1	27	43
O=[N+]([O-])c1cc(CNC[C@@H](O)c2cccc(Cl)c2)cc(C(F)(F)F)c1	ZINC000819266247	FI	On-Demand	Bother	ADRB3	43	43
N#CCCNC[C@@H](O)COc1cc(F)cc(Br)c1	ZINC000819266249	DD	On-Demand	Mild	ADRB1	47	36
N#CCCNC[C@H](O)COc1cc(F)cc(Br)c1	ZINC000819266250	DD	On-Demand	Mild	ADRB1	47	36
C[C@@H]1C[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)CCN1C(=O)OC(C)(C)C	ZINC000819266253	GG	On-Demand	Anodyne	ADRB1	44	38
C[C@@H]1C[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)CCN1C(=O)OC(C)(C)C	ZINC000819266253	GG	On-Demand	Anodyne	ADRB3	38	42
C[C@@H]1C[C@H](NC[C@H](O)COc2ccc(Cl)cc2)CCN1C(=O)OC(C)(C)C	ZINC000819266255	GG	On-Demand	Anodyne	ADRB1	44	38
C[C@@H]1C[C@H](NC[C@H](O)COc2ccc(Cl)cc2)CCN1C(=O)OC(C)(C)C	ZINC000819266255	GG	On-Demand	Anodyne	ADRB3	38	42
CC(C)(C)OC(=O)NCC[C@H](O)CNCCC#N	ZINC000819266257	CC	On-Demand	Mild	PAPA1_CARPA	33	42
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCC#N	ZINC000819266258	CC	On-Demand	Mild	PAPA1_CARPA	33	42
N#CCCNC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000819266263	CE	On-Demand	Mild	ADRB2	21	43
N#CCCNC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000819266263	CE	On-Demand	Mild	ADRB1	53	36
N#CCCNC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000819266264	CE	On-Demand	Mild	ADRB2	21	43
N#CCCNC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000819266264	CE	On-Demand	Mild	ADRB1	53	36
CN(C)CCOc1ccc(N(C)C(=O)C(F)=C2CCC2)cc1	ZINC000819266276	DF	On-Demand	Anodyne	ESRRG	45	34
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000819266293	FF	On-Demand	Anodyne	CCR3	18	41
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000819266294	FF	On-Demand	Anodyne	CCR3	18	41
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000819266295	FF	On-Demand	Anodyne	CCR3	18	41
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000819266296	FF	On-Demand	Anodyne	CCR3	18	41
Cc1cscc1CNC[C@@H](O)c1cccnc1	ZINC000819266313	BE	On-Demand	Anodyne	ADRB2	23	49
Cc1cscc1CNC[C@@H](O)c1cccnc1	ZINC000819266313	BE	On-Demand	Anodyne	ADRB1	26	49
Cc1cscc1CNC[C@@H](O)c1cccnc1	ZINC000819266313	BE	On-Demand	Anodyne	ADRB3	95	49
Cc1cscc1CNC[C@H](O)c1cccnc1	ZINC000819266314	BE	On-Demand	Anodyne	ADRB2	23	49
Cc1cscc1CNC[C@H](O)c1cccnc1	ZINC000819266314	BE	On-Demand	Anodyne	ADRB1	26	49
Cc1cscc1CNC[C@H](O)c1cccnc1	ZINC000819266314	BE	On-Demand	Anodyne	ADRB3	95	49
CC(=O)Nc1cccc(CC(=O)N(C)[C@H](C)CNC(=O)OC(C)(C)C)c1	ZINC000819266323	FF	On-Demand	Anodyne	KCNK3	40	33
CC(=O)Nc1cccc(CC(=O)N(C)[C@@H](C)CNC(=O)OC(C)(C)C)c1	ZINC000819266324	FF	On-Demand	Anodyne	KCNK3	40	33
CNC(=O)[C@@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819266326	FD	On-Demand	Mild	PAPA1_CARPA	30	42
CNC(=O)[C@@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819266328	FD	On-Demand	Mild	PAPA1_CARPA	30	42
N#CCCNC[C@H](O)COc1ccc(Cl)cc1Br	ZINC000819266338	EE	On-Demand	Mild	ADRB1	53	37
N#CCCNC[C@@H](O)COc1ccc(Cl)cc1Br	ZINC000819266339	EE	On-Demand	Mild	ADRB1	53	37
CC[C@@H](C(=O)NNC(=O)Cc1cccc(NC(C)=O)c1)c1ccccc1	ZINC000819266343	FF	On-Demand	Reactive	KCNQ2	48	42
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1ccccc1C(F)(F)F)C2	ZINC000819266346	FH	On-Demand	Anodyne	ADRB3	21	46
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccccc1C(F)(F)F)C2	ZINC000819266347	FH	On-Demand	Anodyne	ADRB3	21	46
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1ccccc1C(F)(F)F)C2	ZINC000819266348	FH	On-Demand	Anodyne	ADRB3	21	46
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccccc1F)C2	ZINC000819266380	DF	On-Demand	Anodyne	ADRB3	21	45
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1ccccc1F)C2	ZINC000819266381	DF	On-Demand	Anodyne	ADRB3	21	45
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccccc1F)C2	ZINC000819266382	DF	On-Demand	Anodyne	ADRB3	21	45
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1ccccc1F)C2	ZINC000819266383	DF	On-Demand	Anodyne	ADRB3	21	45
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccccc1Br)C2	ZINC000819266386	FG	On-Demand	Anodyne	ADRB3	21	43
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1ccccc1Br)C2	ZINC000819266387	FG	On-Demand	Anodyne	ADRB3	21	43
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccccc1Br)C2	ZINC000819266388	FG	On-Demand	Anodyne	ADRB3	21	43
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1ccccc1Br)C2	ZINC000819266389	FG	On-Demand	Anodyne	ADRB3	21	43
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819266429	DG	On-Demand	Anodyne	ADRB1	37	59
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819266429	DG	On-Demand	Anodyne	ADRB3	57	66
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819266430	DG	On-Demand	Anodyne	ADRB1	37	59
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819266430	DG	On-Demand	Anodyne	ADRB3	57	66
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819266431	DG	On-Demand	Anodyne	ADRB1	37	59
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819266431	DG	On-Demand	Anodyne	ADRB3	57	66
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819266432	DG	On-Demand	Anodyne	ADRB1	37	59
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819266432	DG	On-Demand	Anodyne	ADRB3	57	66
N#Cc1ccc([C@@H](O)CN[C@H]2CCc3cc(O)ccc3C2)cc1	ZINC000819266433	DE	On-Demand	Mild	ADRB3	23	49
N#Cc1ccc([C@H](O)CN[C@@H]2CCc3cc(O)ccc3C2)cc1	ZINC000819266434	DE	On-Demand	Mild	ADRB3	23	49
N#Cc1ccc([C@@H](O)CN[C@@H]2CCc3cc(O)ccc3C2)cc1	ZINC000819266435	DE	On-Demand	Mild	ADRB3	23	49
N#Cc1ccc([C@H](O)CN[C@H]2CCc3cc(O)ccc3C2)cc1	ZINC000819266436	DE	On-Demand	Mild	ADRB3	23	49
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1	ZINC000819266441	HK	On-Demand	Bother	PPIA	29	47
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1	ZINC000819266441	HK	On-Demand	Bother	CA1	17	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1	ZINC000819266441	HK	On-Demand	Bother	GRM4	23	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1	ZINC000819266441	HK	On-Demand	Bother	KCNMA1	40	38
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1	ZINC000819266441	HK	On-Demand	Bother	TAAR1	31	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1	ZINC000819266441	HK	On-Demand	Bother	SMO	19	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1	ZINC000819266441	HK	On-Demand	Bother	KCNK3	114	48
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1	ZINC000819266441	HK	On-Demand	Bother	KCNK9	78	40
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266455	FH	On-Demand	Anodyne	DRD2	27	42
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266455	FH	On-Demand	Anodyne	DRD4	19	41
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266455	FH	On-Demand	Anodyne	ACHE	27	45
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266455	FH	On-Demand	Anodyne	HTR2A	16	47
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266455	FH	On-Demand	Anodyne	DRD3	41	42
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266455	FH	On-Demand	Anodyne	HTR4	41	37
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266455	FH	On-Demand	Anodyne	GRIN2B	58	42
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266455	FH	On-Demand	Anodyne	SIGMAR1	32	47
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266455	FH	On-Demand	Anodyne	CCR3	53	61
O=C(/C=C\[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266455	FH	On-Demand	Anodyne	CYP2J2	47	33
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266456	FH	On-Demand	Anodyne	DRD2	27	42
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266456	FH	On-Demand	Anodyne	DRD4	19	41
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266456	FH	On-Demand	Anodyne	ACHE	27	45
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266456	FH	On-Demand	Anodyne	HTR2A	16	47
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266456	FH	On-Demand	Anodyne	DRD3	41	42
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266456	FH	On-Demand	Anodyne	HTR4	41	37
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266456	FH	On-Demand	Anodyne	GRIN2B	58	42
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266456	FH	On-Demand	Anodyne	SIGMAR1	32	47
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266456	FH	On-Demand	Anodyne	CCR3	53	61
O=C(/C=C/[C@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266456	FH	On-Demand	Anodyne	CYP2J2	47	33
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266457	FH	On-Demand	Anodyne	DRD2	27	42
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266457	FH	On-Demand	Anodyne	DRD4	19	41
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266457	FH	On-Demand	Anodyne	ACHE	27	45
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266457	FH	On-Demand	Anodyne	HTR2A	16	47
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266457	FH	On-Demand	Anodyne	DRD3	41	42
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266457	FH	On-Demand	Anodyne	HTR4	41	37
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266457	FH	On-Demand	Anodyne	GRIN2B	58	42
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266457	FH	On-Demand	Anodyne	SIGMAR1	32	47
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266457	FH	On-Demand	Anodyne	CCR3	53	61
O=C(/C=C/[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266457	FH	On-Demand	Anodyne	CYP2J2	47	33
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266458	FH	On-Demand	Anodyne	DRD2	27	42
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266458	FH	On-Demand	Anodyne	DRD4	19	41
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266458	FH	On-Demand	Anodyne	ACHE	27	45
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266458	FH	On-Demand	Anodyne	HTR2A	16	47
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266458	FH	On-Demand	Anodyne	DRD3	41	42
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266458	FH	On-Demand	Anodyne	HTR4	41	37
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266458	FH	On-Demand	Anodyne	GRIN2B	58	42
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266458	FH	On-Demand	Anodyne	SIGMAR1	32	47
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266458	FH	On-Demand	Anodyne	CCR3	53	61
O=C(/C=C\[C@@H]1CCCO1)NCCCCN1CCC(Cc2ccccc2)CC1	ZINC000819266458	FH	On-Demand	Anodyne	CYP2J2	47	33
O[C@H](CNCCOCC(F)(F)C(F)F)c1cccc(Cl)c1	ZINC000819266482	EF	On-Demand	Anodyne	ADRB2	54	42
O[C@H](CNCCOCC(F)(F)C(F)F)c1cccc(Cl)c1	ZINC000819266482	EF	On-Demand	Anodyne	ADRB1	62	50
O[C@H](CNCCOCC(F)(F)C(F)F)c1cccc(Cl)c1	ZINC000819266482	EF	On-Demand	Anodyne	ADRB3	68	50
O[C@@H](CNCCOCC(F)(F)C(F)F)c1cccc(Cl)c1	ZINC000819266484	EF	On-Demand	Anodyne	ADRB2	54	42
O[C@@H](CNCCOCC(F)(F)C(F)F)c1cccc(Cl)c1	ZINC000819266484	EF	On-Demand	Anodyne	ADRB1	62	50
O[C@@H](CNCCOCC(F)(F)C(F)F)c1cccc(Cl)c1	ZINC000819266484	EF	On-Demand	Anodyne	ADRB3	68	50
Cc1cc(CNC[C@H](O)c2ccc(F)cc2F)ccc1S(N)(=O)=O	ZINC000819266569	FD	On-Demand	Anodyne	LEF	63	38
Cc1cc(CNC[C@@H](O)c2ccc(F)cc2F)ccc1S(N)(=O)=O	ZINC000819266572	FD	On-Demand	Anodyne	LEF	63	38
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1ccc(C(F)(F)F)cc1)C2	ZINC000819266592	FH	On-Demand	Anodyne	ADRB3	25	66
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(C(F)(F)F)cc1)C2	ZINC000819266594	FH	On-Demand	Anodyne	ADRB3	25	66
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1ccc(C(F)(F)F)cc1)C2	ZINC000819266596	FH	On-Demand	Anodyne	ADRB3	25	66
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(C(F)(F)F)cc1)C2	ZINC000819266598	FH	On-Demand	Anodyne	ADRB3	25	66
O[C@@H](CNCC1(N2CCOCC2)CC1)c1ccccc1Cl	ZINC000819266604	DD	On-Demand	Anodyne	OPRL1	21	40
O[C@@H](CNCC1(N2CCOCC2)CC1)c1ccccc1Cl	ZINC000819266604	DD	On-Demand	Anodyne	HCN1	43	36
O=[N+]([O-])c1cccc([C@@H](O)CNC2CCC3(CC2)CC3)c1	ZINC000819266620	CF	On-Demand	Bother	CACNA1C	40	35
O=[N+]([O-])c1cccc([C@@H](O)CNC2CCC3(CC2)CC3)c1	ZINC000819266620	CF	On-Demand	Bother	CACNA1D	63	34
O=[N+]([O-])c1cccc([C@H](O)CNC2CCC3(CC2)CC3)c1	ZINC000819266621	CF	On-Demand	Bother	CACNA1C	40	35
O=[N+]([O-])c1cccc([C@H](O)CNC2CCC3(CC2)CC3)c1	ZINC000819266621	CF	On-Demand	Bother	CACNA1D	63	34
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cccnc2Cl)c1	ZINC000819266630	FJ	On-Demand	Anodyne	PPIA	56	48
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cccnc2Cl)c1	ZINC000819266630	FJ	On-Demand	Anodyne	CA1	23	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cccnc2Cl)c1	ZINC000819266630	FJ	On-Demand	Anodyne	P2RY1	26	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cccnc2Cl)c1	ZINC000819266630	FJ	On-Demand	Anodyne	AURKB	23	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cccnc2Cl)c1	ZINC000819266630	FJ	On-Demand	Anodyne	PRNP	36	45
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cccnc2Cl)c1	ZINC000819266630	FJ	On-Demand	Anodyne	FLT1	22	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cccnc2Cl)c1	ZINC000819266630	FJ	On-Demand	Anodyne	KDR	50	47
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cccnc2Cl)c1	ZINC000819266630	FJ	On-Demand	Anodyne	GRM4	81	51
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cccnc2Cl)c1	ZINC000819266630	FJ	On-Demand	Anodyne	FLT3	21	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cccnc2Cl)c1	ZINC000819266630	FJ	On-Demand	Anodyne	TYK2	51	36
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cccnc2Cl)c1	ZINC000819266630	FJ	On-Demand	Anodyne	CSF1R	24	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cccnc2Cl)c1	ZINC000819266630	FJ	On-Demand	Anodyne	NR2E3	68	38
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cccnc2Cl)c1	ZINC000819266630	FJ	On-Demand	Anodyne	SHH	25	47
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cccnc2Cl)c1	ZINC000819266630	FJ	On-Demand	Anodyne	RIPK1	42	39
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cccnc2Cl)c1	ZINC000819266630	FJ	On-Demand	Anodyne	SMO	28	47
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cccnc2Cl)c1	ZINC000819266630	FJ	On-Demand	Anodyne	DGAT1	15	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cccnc2Cl)c1	ZINC000819266630	FJ	On-Demand	Anodyne	KCNK3	135	55
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cccnc2Cl)c1	ZINC000819266630	FJ	On-Demand	Anodyne	KCNK9	93	46
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cccnc2Cl)c1	ZINC000819266630	FJ	On-Demand	Anodyne	G2YM83_BOTF4	91	47
C[C@@H]1C[C@H](NC[C@@H](O)COCc2ccccc2)CCN1C(=O)OC(C)(C)C	ZINC000819266671	GF	On-Demand	Anodyne	GHSR	33	40
C[C@@H]1C[C@H](NC[C@H](O)COCc2ccccc2)CCN1C(=O)OC(C)(C)C	ZINC000819266677	GF	On-Demand	Anodyne	GHSR	33	40
C[C@H]1C[C@H](NC[C@@H](O)COCc2ccccc2)CCN1C(=O)OC(C)(C)C	ZINC000819266679	GF	On-Demand	Anodyne	GHSR	33	40
C[C@H]1C[C@H](NC[C@H](O)COCc2ccccc2)CCN1C(=O)OC(C)(C)C	ZINC000819266682	GF	On-Demand	Anodyne	GHSR	33	40
O[C@@H](CNCC1(N2CCOCC2)CC1)c1cccc(Cl)c1	ZINC000819266693	DD	On-Demand	Anodyne	ADRB1	27	42
O[C@@H](CNCC1(N2CCOCC2)CC1)c1cccc(Cl)c1	ZINC000819266693	DD	On-Demand	Anodyne	ADRB3	40	42
O[C@H](CNCC1(N2CCOCC2)CC1)c1cccc(Cl)c1	ZINC000819266695	DD	On-Demand	Anodyne	ADRB1	27	42
O[C@H](CNCC1(N2CCOCC2)CC1)c1cccc(Cl)c1	ZINC000819266695	DD	On-Demand	Anodyne	ADRB3	40	42
Cc1cc(CNC[C@H](O)c2cc(F)ccc2F)ccc1S(N)(=O)=O	ZINC000819266728	FD	On-Demand	Anodyne	LEF	67	40
Cc1cc(CNC[C@@H](O)c2cc(F)ccc2F)ccc1S(N)(=O)=O	ZINC000819266729	FD	On-Demand	Anodyne	LEF	67	40
Cc1cc(CNC[C@H](O)c2ccc(F)cc2)ccc1S(N)(=O)=O	ZINC000819266748	ED	On-Demand	Anodyne	LEF	80	41
Cc1cc(CNC[C@@H](O)c2ccc(F)cc2)ccc1S(N)(=O)=O	ZINC000819266749	ED	On-Demand	Anodyne	LEF	80	41
Cc1cc(CNC[C@H](O)c2ccc(F)c(F)c2)ccc1S(N)(=O)=O	ZINC000819266752	FD	On-Demand	Anodyne	LEF	48	38
Cc1cc(CNC[C@@H](O)c2ccc(F)c(F)c2)ccc1S(N)(=O)=O	ZINC000819266753	FD	On-Demand	Anodyne	LEF	48	38
O=[N+]([O-])c1cccc([C@@H](O)CNCC2CCN(C3CC3)CC2)c1	ZINC000819266754	DE	On-Demand	Bother	CACNA1C	52	36
O=[N+]([O-])c1cccc([C@@H](O)CNCC2CCN(C3CC3)CC2)c1	ZINC000819266754	DE	On-Demand	Bother	CACNA1D	80	36
O=[N+]([O-])c1cccc([C@H](O)CNCC2CCN(C3CC3)CC2)c1	ZINC000819266755	DE	On-Demand	Bother	CACNA1C	52	36
O=[N+]([O-])c1cccc([C@H](O)CNCC2CCN(C3CC3)CC2)c1	ZINC000819266755	DE	On-Demand	Bother	CACNA1D	80	36
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)C1CC1)C2	ZINC000819266762	BD	On-Demand	Anodyne	ADRB3	19	41
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)C1CC1)C2	ZINC000819266763	BD	On-Demand	Anodyne	ADRB3	19	41
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)C1CC1)C2	ZINC000819266765	BD	On-Demand	Anodyne	ADRB3	19	41
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)C1CC1)C2	ZINC000819266766	BD	On-Demand	Anodyne	ADRB3	19	41
CCO[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819266768	GG	On-Demand	Anodyne	AMY2	45	32
CCO[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819266768	GG	On-Demand	Anodyne	GPR119	43	48
CCO[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819266769	GG	On-Demand	Anodyne	AMY2	45	32
CCO[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819266769	GG	On-Demand	Anodyne	GPR119	43	48
CCO[C@@H](CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)c1ccccc1	ZINC000819266789	FH	On-Demand	Anodyne	ADRB3	22	47
CCO[C@@H](CNC[C@H](O)c1ccc(OC(F)(F)F)cc1)c1ccccc1	ZINC000819266792	FH	On-Demand	Anodyne	ADRB3	22	47
Cc1cc(N2CCC[C@@H](NC[C@H](O)c3cccnc3)C2)n(C)n1	ZINC000819266828	DD	On-Demand	Anodyne	ADRB3	48	43
Cc1cc(N2CCC[C@H](NC[C@H](O)c3cccnc3)C2)n(C)n1	ZINC000819266830	DD	On-Demand	Anodyne	ADRB3	48	43
Cc1cc(N2CCC[C@@H](NC[C@@H](O)c3cccnc3)C2)n(C)n1	ZINC000819266832	DD	On-Demand	Anodyne	ADRB3	48	43
Cc1cc(N2CCC[C@H](NC[C@@H](O)c3cccnc3)C2)n(C)n1	ZINC000819266834	DD	On-Demand	Anodyne	ADRB3	48	43
COc1ccc(OC)c([C@H](O)CNC2CCN(S(=O)(=O)C(C)C)CC2)c1	ZINC000819266886	GD	On-Demand	Anodyne	ADRA1D	17	40
COc1ccc(OC)c([C@H](O)CNC2CCN(S(=O)(=O)C(C)C)CC2)c1	ZINC000819266886	GD	On-Demand	Anodyne	ADRB3	23	46
C[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1C(=O)OC(C)(C)C	ZINC000819266967	FH	On-Demand	Anodyne	ADRB1	35	49
C[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1C(=O)OC(C)(C)C	ZINC000819266967	FH	On-Demand	Anodyne	ADRB3	56	51
C[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1C(=O)OC(C)(C)C	ZINC000819266967	FH	On-Demand	Anodyne	CYP3A4	50	39
C[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1C(=O)OC(C)(C)C	ZINC000819266969	FH	On-Demand	Anodyne	ADRB1	35	49
C[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1C(=O)OC(C)(C)C	ZINC000819266969	FH	On-Demand	Anodyne	ADRB3	56	51
C[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1C(=O)OC(C)(C)C	ZINC000819266969	FH	On-Demand	Anodyne	CYP3A4	50	39
Cc1cc(CNCCS(C)(=O)=O)ccc1S(N)(=O)=O	ZINC000819266970	DB	On-Demand	Anodyne	CA2	15	46
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1ccc(Br)cc1)C2	ZINC000819266999	FG	On-Demand	Anodyne	ADRB3	25	52
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(Br)cc1)C2	ZINC000819267000	FG	On-Demand	Anodyne	ADRB3	25	52
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1ccc(Br)cc1)C2	ZINC000819267001	FG	On-Demand	Anodyne	ADRB3	25	52
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(Br)cc1)C2	ZINC000819267002	FG	On-Demand	Anodyne	ADRB3	25	52
O[C@@H](CNCC1CCN(C2CC2)CC1)c1ccc(OC(F)(F)F)cc1	ZINC000819267017	FG	On-Demand	Anodyne	MMP2	20	43
O[C@H](CNCC1CCN(C2CC2)CC1)c1ccc(OC(F)(F)F)cc1	ZINC000819267018	FG	On-Demand	Anodyne	MMP2	20	43
CCO[C@@H](CNC[C@@H](O)c1ccc(F)cc1)c1ccccc1	ZINC000819267073	DG	On-Demand	Anodyne	SLC6A3	22	43
CCO[C@@H](CNC[C@@H](O)c1ccc(F)cc1)c1ccccc1	ZINC000819267073	DG	On-Demand	Anodyne	AOC3	15	40
CCO[C@@H](CNC[C@H](O)c1ccc(F)cc1)c1ccccc1	ZINC000819267077	DG	On-Demand	Anodyne	SLC6A3	22	43
CCO[C@@H](CNC[C@H](O)c1ccc(F)cc1)c1ccccc1	ZINC000819267077	DG	On-Demand	Anodyne	AOC3	15	40
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1c(F)cccc1F)C2	ZINC000819267082	DF	On-Demand	Anodyne	ADRB3	22	46
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1c(F)cccc1F)C2	ZINC000819267086	DF	On-Demand	Anodyne	ADRB3	22	46
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1c(F)cccc1F)C2	ZINC000819267089	DF	On-Demand	Anodyne	ADRB3	22	46
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1c(F)cccc1F)C2	ZINC000819267092	DF	On-Demand	Anodyne	ADRB3	22	46
O=C(NCc1ccc(C(=O)NCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819267145	FF	On-Demand	Anodyne	DRD4	44	34
O=C(NCc1ccc(C(=O)NCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819267145	FF	On-Demand	Anodyne	PLD1	47	37
O=C(NCc1ccc(C(=O)NCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819267145	FF	On-Demand	Anodyne	PLD2	67	39
CCO[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)c1ccccc1	ZINC000819267149	DH	On-Demand	Anodyne	ADRB2	32	43
CCO[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)c1ccccc1	ZINC000819267149	DH	On-Demand	Anodyne	ADRB1	47	46
CCO[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)c1ccccc1	ZINC000819267149	DH	On-Demand	Anodyne	ADRB3	68	46
CCO[C@@H](CNC[C@H](O)c1cccc(Cl)c1)c1ccccc1	ZINC000819267154	DH	On-Demand	Anodyne	ADRB2	32	43
CCO[C@@H](CNC[C@H](O)c1cccc(Cl)c1)c1ccccc1	ZINC000819267154	DH	On-Demand	Anodyne	ADRB1	47	46
CCO[C@@H](CNC[C@H](O)c1cccc(Cl)c1)c1ccccc1	ZINC000819267154	DH	On-Demand	Anodyne	ADRB3	68	46
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819267209	FD	On-Demand	Anodyne	DRD4	40	31
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819267209	FD	On-Demand	Anodyne	PLD1	51	37
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819267209	FD	On-Demand	Anodyne	PLD2	62	37
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819267209	FD	On-Demand	Anodyne	TGM2	17	41
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819267210	FD	On-Demand	Anodyne	DRD4	40	31
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819267210	FD	On-Demand	Anodyne	PLD1	51	37
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819267210	FD	On-Demand	Anodyne	PLD2	62	37
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819267210	FD	On-Demand	Anodyne	TGM2	17	41
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819267211	FD	On-Demand	Anodyne	DRD4	40	31
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819267211	FD	On-Demand	Anodyne	PLD1	51	37
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819267211	FD	On-Demand	Anodyne	PLD2	62	37
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819267211	FD	On-Demand	Anodyne	TGM2	17	41
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819267213	FD	On-Demand	Anodyne	DRD4	40	31
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819267213	FD	On-Demand	Anodyne	PLD1	51	37
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819267213	FD	On-Demand	Anodyne	PLD2	62	37
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819267213	FD	On-Demand	Anodyne	TGM2	17	41
Cc1cc(CNC[C@H](O)c2ccccc2F)ccc1S(N)(=O)=O	ZINC000819267362	ED	On-Demand	Anodyne	LEF	49	38
Cc1cc(CNC[C@@H](O)c2ccccc2F)ccc1S(N)(=O)=O	ZINC000819267365	ED	On-Demand	Anodyne	LEF	49	38
CON(C)C(=O)CCNc1cnn(Cc2nnc3n2CCCC3)c1	ZINC000819267404	EC	On-Demand	Anodyne	PANC	50	33
CCO[C@@H](CNC[C@@H](O)c1ccccc1)c1ccccc1	ZINC000819267435	CG	On-Demand	Anodyne	ADRB2	17	42
CCO[C@@H](CNC[C@@H](O)c1ccccc1)c1ccccc1	ZINC000819267435	CG	On-Demand	Anodyne	AOC3	16	47
CCO[C@@H](CNC[C@H](O)c1ccccc1)c1ccccc1	ZINC000819267440	CG	On-Demand	Anodyne	ADRB2	17	42
CCO[C@@H](CNC[C@H](O)c1ccccc1)c1ccccc1	ZINC000819267440	CG	On-Demand	Anodyne	AOC3	16	47
O[C@@H](CNCC1CCN(C2CC2)CC1)c1ccc(Cl)c(F)c1	ZINC000819267441	EF	On-Demand	Anodyne	CCR3	20	40
O[C@H](CNCC1CCN(C2CC2)CC1)c1ccc(Cl)c(F)c1	ZINC000819267448	EF	On-Demand	Anodyne	CCR3	20	40
C[C@H](C#N)CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819267460	FH	On-Demand	Mild	CTSK	16	49
C[C@H](C#N)CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819267460	FH	On-Demand	Mild	ECE1	22	42
C[C@H](C#N)CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819267460	FH	On-Demand	Mild	REN	44	42
C[C@H](C#N)CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819267463	FH	On-Demand	Mild	CTSK	16	49
C[C@H](C#N)CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819267463	FH	On-Demand	Mild	ECE1	22	42
C[C@H](C#N)CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819267463	FH	On-Demand	Mild	REN	44	42
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1ccc(Cl)cc1)C2	ZINC000819267474	DG	On-Demand	Anodyne	ADRB3	29	64
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(Cl)cc1)C2	ZINC000819267476	DG	On-Demand	Anodyne	ADRB3	29	64
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)c1	ZINC000819267488	JK	On-Demand	Anodyne	ABL1	16	52
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)c1	ZINC000819267488	JK	On-Demand	Anodyne	PRS	26	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)c1	ZINC000819267488	JK	On-Demand	Anodyne	CYP11B2	19	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)c1	ZINC000819267488	JK	On-Demand	Anodyne	FLT1	15	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)c1	ZINC000819267488	JK	On-Demand	Anodyne	KDR	33	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)c1	ZINC000819267488	JK	On-Demand	Anodyne	TACR3	38	49
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)c1	ZINC000819267488	JK	On-Demand	Anodyne	CSF1R	18	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)c1	ZINC000819267488	JK	On-Demand	Anodyne	CYP2C9	20	71
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)c1	ZINC000819267488	JK	On-Demand	Anodyne	ATR	40	48
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)c1	ZINC000819267488	JK	On-Demand	Anodyne	BRAF	22	48
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)c1	ZINC000819267488	JK	On-Demand	Anodyne	NR2E3	59	33
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)c1	ZINC000819267488	JK	On-Demand	Anodyne	SMO	18	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)c1	ZINC000819267488	JK	On-Demand	Anodyne	MT-CO2	52	39
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)c1	ZINC000819267488	JK	On-Demand	Anodyne	NAMPT	34	44
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)c1	ZINC000819267488	JK	On-Demand	Anodyne	KCNK3	108	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(-c3cccnc3)nc3ccccc23)c1	ZINC000819267488	JK	On-Demand	Anodyne	KCNK9	73	36
C[C@@H]1C[C@H](NCCC(=O)Nc2cccc(F)c2)CCN1C(=O)OC(C)(C)C	ZINC000819267489	GH	On-Demand	Anodyne	CCR3	21	40
CCO[C@@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccccc1	ZINC000819267492	FE	On-Demand	Anodyne	ADRB3	52	40
C[C@H]1C[C@H](NCCC(=O)Nc2cccc(F)c2)CCN1C(=O)OC(C)(C)C	ZINC000819267493	GH	On-Demand	Anodyne	CCR3	21	40
CCO[C@@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccccc1	ZINC000819267495	FE	On-Demand	Anodyne	ADRB3	52	40
CCO[C@@H](CNC[C@@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819267502	DF	On-Demand	Mild	CTRB_BOVIN	47	33
CCO[C@@H](CNC[C@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819267508	DF	On-Demand	Mild	CTRB_BOVIN	47	33
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1cccc(Br)c1	ZINC000819267511	GE	On-Demand	Anodyne	ADRB3	50	43
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1cccc(Br)c1	ZINC000819267514	GE	On-Demand	Anodyne	ADRB3	50	43
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1cccc(Br)c1	ZINC000819267516	GE	On-Demand	Anodyne	ADRB3	50	43
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1cccc(Br)c1	ZINC000819267518	GE	On-Demand	Anodyne	ADRB3	50	43
Cc1cc(CNC[C@H](O)c2cccc(Cl)c2)ccc1S(N)(=O)=O	ZINC000819267541	FE	On-Demand	Anodyne	ADRB2	51	40
Cc1cc(CNC[C@H](O)c2cccc(Cl)c2)ccc1S(N)(=O)=O	ZINC000819267541	FE	On-Demand	Anodyne	ADRB1	55	48
Cc1cc(CNC[C@H](O)c2cccc(Cl)c2)ccc1S(N)(=O)=O	ZINC000819267541	FE	On-Demand	Anodyne	ADRB3	69	49
Cc1cc(CNC[C@@H](O)c2cccc(Cl)c2)ccc1S(N)(=O)=O	ZINC000819267543	FE	On-Demand	Anodyne	ADRB2	51	40
Cc1cc(CNC[C@@H](O)c2cccc(Cl)c2)ccc1S(N)(=O)=O	ZINC000819267543	FE	On-Demand	Anodyne	ADRB1	55	48
Cc1cc(CNC[C@@H](O)c2cccc(Cl)c2)ccc1S(N)(=O)=O	ZINC000819267543	FE	On-Demand	Anodyne	ADRB3	69	49
O[C@@H](CNCC1CCN(C2CC2)CC1)c1cccnc1	ZINC000819267545	CD	On-Demand	Anodyne	ADRB2	25	44
O[C@@H](CNCC1CCN(C2CC2)CC1)c1cccnc1	ZINC000819267545	CD	On-Demand	Anodyne	ADRB1	28	44
O[C@@H](CNCC1CCN(C2CC2)CC1)c1cccnc1	ZINC000819267545	CD	On-Demand	Anodyne	ADRB3	98	45
O[C@H](CNCC1CCN(C2CC2)CC1)c1cccnc1	ZINC000819267547	CD	On-Demand	Anodyne	ADRB2	25	44
O[C@H](CNCC1CCN(C2CC2)CC1)c1cccnc1	ZINC000819267547	CD	On-Demand	Anodyne	ADRB1	28	44
O[C@H](CNCC1CCN(C2CC2)CC1)c1cccnc1	ZINC000819267547	CD	On-Demand	Anodyne	ADRB3	98	45
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(F)cc1F)C2	ZINC000819267551	DF	On-Demand	Anodyne	ADRB3	21	45
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1ccc(F)cc1F)C2	ZINC000819267552	DF	On-Demand	Anodyne	ADRB3	21	45
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(F)cc1F)C2	ZINC000819267554	DF	On-Demand	Anodyne	ADRB3	21	45
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1ccc(F)cc1F)C2	ZINC000819267556	DF	On-Demand	Anodyne	ADRB3	21	45
C[C@@H]1C[C@H](NC[C@H](O)c2ccc(F)c(F)c2)CCN1C(=O)OC(C)(C)C	ZINC000819267557	FG	On-Demand	Anodyne	ADRB3	24	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2sc3ccccc3c2Cl)c1	ZINC000819267558	HK	On-Demand	Anodyne	PPIA	28	47
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2sc3ccccc3c2Cl)c1	ZINC000819267558	HK	On-Demand	Anodyne	KCNK3	120	45
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2sc3ccccc3c2Cl)c1	ZINC000819267558	HK	On-Demand	Anodyne	KCNK9	80	39
C[C@@H]1C[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)CCN1C(=O)OC(C)(C)C	ZINC000819267559	FG	On-Demand	Anodyne	ADRB3	24	40
Cc1cc(CNC[C@H](O)c2ccccc2)ccc1S(N)(=O)=O	ZINC000819267569	DD	On-Demand	Anodyne	CA2	27	40
Cc1cc(CNC[C@H](O)c2ccccc2)ccc1S(N)(=O)=O	ZINC000819267569	DD	On-Demand	Anodyne	ADRB2	45	39
Cc1cc(CNC[C@H](O)c2ccccc2)ccc1S(N)(=O)=O	ZINC000819267569	DD	On-Demand	Anodyne	ADRB1	40	40
Cc1cc(CNC[C@H](O)c2ccccc2)ccc1S(N)(=O)=O	ZINC000819267569	DD	On-Demand	Anodyne	ADRB3	71	43
Cc1cc(CNC[C@H](O)c2ccccc2)ccc1S(N)(=O)=O	ZINC000819267569	DD	On-Demand	Anodyne	CA1	15	40
Cc1cc(CNC[C@@H](O)c2ccccc2)ccc1S(N)(=O)=O	ZINC000819267571	DD	On-Demand	Anodyne	CA2	27	40
Cc1cc(CNC[C@@H](O)c2ccccc2)ccc1S(N)(=O)=O	ZINC000819267571	DD	On-Demand	Anodyne	ADRB2	45	39
Cc1cc(CNC[C@@H](O)c2ccccc2)ccc1S(N)(=O)=O	ZINC000819267571	DD	On-Demand	Anodyne	ADRB1	40	40
Cc1cc(CNC[C@@H](O)c2ccccc2)ccc1S(N)(=O)=O	ZINC000819267571	DD	On-Demand	Anodyne	ADRB3	71	43
Cc1cc(CNC[C@@H](O)c2ccccc2)ccc1S(N)(=O)=O	ZINC000819267571	DD	On-Demand	Anodyne	CA1	15	40
C[C@H]1C[C@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1C(=O)OC(C)(C)C	ZINC000819267578	FH	On-Demand	Anodyne	ADRB3	24	48
C[C@@H]1C[C@H](NC[C@H](O)c2ccc(Cl)cc2)CCN1C(=O)OC(C)(C)C	ZINC000819267579	FH	On-Demand	Anodyne	ADRB3	24	48
CS(=O)(=O)c1ccc([C@H](O)CNCC2CCN(C3CC3)CC2)cc1	ZINC000819267588	FD	On-Demand	Anodyne	ADRB2	15	42
CS(=O)(=O)c1ccc([C@H](O)CNCC2CCN(C3CC3)CC2)cc1	ZINC000819267588	FD	On-Demand	Anodyne	ADRA1D	22	42
CS(=O)(=O)c1ccc([C@H](O)CNCC2CCN(C3CC3)CC2)cc1	ZINC000819267588	FD	On-Demand	Anodyne	ADRA1A	16	42
CS(=O)(=O)c1ccc([C@H](O)CNCC2CCN(C3CC3)CC2)cc1	ZINC000819267588	FD	On-Demand	Anodyne	ADRA1B	17	42
CS(=O)(=O)c1ccc([C@H](O)CNCC2CCN(C3CC3)CC2)cc1	ZINC000819267588	FD	On-Demand	Anodyne	ADRB3	25	42
CS(=O)(=O)c1ccc([C@@H](O)CNCC2CCN(C3CC3)CC2)cc1	ZINC000819267589	FD	On-Demand	Anodyne	ADRB2	15	42
CS(=O)(=O)c1ccc([C@@H](O)CNCC2CCN(C3CC3)CC2)cc1	ZINC000819267589	FD	On-Demand	Anodyne	ADRA1D	22	42
CS(=O)(=O)c1ccc([C@@H](O)CNCC2CCN(C3CC3)CC2)cc1	ZINC000819267589	FD	On-Demand	Anodyne	ADRA1A	16	42
CS(=O)(=O)c1ccc([C@@H](O)CNCC2CCN(C3CC3)CC2)cc1	ZINC000819267589	FD	On-Demand	Anodyne	ADRA1B	17	42
CS(=O)(=O)c1ccc([C@@H](O)CNCC2CCN(C3CC3)CC2)cc1	ZINC000819267589	FD	On-Demand	Anodyne	ADRB3	25	42
C/C(=C/C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1)c1cccc(C(F)(F)F)c1	ZINC000819267680	FI	On-Demand	Anodyne	CCR2	42	34
C/C(=C/C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1)c1cccc(C(F)(F)F)c1	ZINC000819267682	FI	On-Demand	Anodyne	CCR2	42	34
O[C@H](CNCc1ccc2c(n1)CCCC2)c1cccc(Cl)c1	ZINC000819267720	DG	On-Demand	Anodyne	ADRB1	26	41
O[C@H](CNCc1ccc2c(n1)CCCC2)c1cccc(Cl)c1	ZINC000819267720	DG	On-Demand	Anodyne	ADRB3	40	41
O[C@@H](CNCc1ccc2c(n1)CCCC2)c1cccc(Cl)c1	ZINC000819267721	DG	On-Demand	Anodyne	ADRB1	26	41
O[C@@H](CNCc1ccc2c(n1)CCCC2)c1cccc(Cl)c1	ZINC000819267721	DG	On-Demand	Anodyne	ADRB3	40	41
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1F	ZINC000819267722	JJ	On-Demand	Anodyne	PPIA	27	42
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1F	ZINC000819267722	JJ	On-Demand	Anodyne	CPT1A	69	37
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1F	ZINC000819267722	JJ	On-Demand	Anodyne	PRNP	36	42
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1F	ZINC000819267722	JJ	On-Demand	Anodyne	CA12	17	40
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1F	ZINC000819267722	JJ	On-Demand	Anodyne	CPT1B	47	36
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1F	ZINC000819267722	JJ	On-Demand	Anodyne	TAAR1	41	42
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1F	ZINC000819267722	JJ	On-Demand	Anodyne	KCNK3	127	46
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1F	ZINC000819267722	JJ	On-Demand	Anodyne	KCNK9	85	43
CON(C)C(=O)CCNCc1nc2ccc([N+](=O)[O-])cc2[nH]1	ZINC000819267739	DC	On-Demand	Bother	CACNA1D	59	35
CCO[C@@H](CNC[C@H](O)c1ccc(Cl)cc1)c1ccccc1	ZINC000819267742	DH	On-Demand	Anodyne	ADRB3	41	34
CCO[C@@H](CNC[C@H](O)c1ccc(Cl)cc1)c1ccccc1	ZINC000819267742	DH	On-Demand	Anodyne	AOC3	15	40
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(Cl)cc1Cl)C2	ZINC000819267750	FH	On-Demand	Anodyne	ADRB3	23	48
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1ccc(Cl)cc1Cl)C2	ZINC000819267751	FH	On-Demand	Anodyne	ADRB3	23	48
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(Cl)cc1Cl)C2	ZINC000819267752	FH	On-Demand	Anodyne	ADRB3	23	48
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1ccc(Cl)cc1Cl)C2	ZINC000819267753	FH	On-Demand	Anodyne	ADRB3	23	48
O[C@@H](CNCC1(c2c(Cl)cccc2Cl)CCC1)c1cccnc1	ZINC000819267762	FI	On-Demand	Anodyne	ADRB2	23	40
O[C@@H](CNCC1(c2c(Cl)cccc2Cl)CCC1)c1cccnc1	ZINC000819267762	FI	On-Demand	Anodyne	ADRB3	97	45
O[C@@H](CNCC1(c2c(Cl)cccc2Cl)CCC1)c1cccnc1	ZINC000819267762	FI	On-Demand	Anodyne	SCD	16	43
O[C@H](CNCC1(c2c(Cl)cccc2Cl)CCC1)c1cccnc1	ZINC000819267763	FI	On-Demand	Anodyne	ADRB2	23	40
O[C@H](CNCC1(c2c(Cl)cccc2Cl)CCC1)c1cccnc1	ZINC000819267763	FI	On-Demand	Anodyne	ADRB3	97	45
O[C@H](CNCC1(c2c(Cl)cccc2Cl)CCC1)c1cccnc1	ZINC000819267763	FI	On-Demand	Anodyne	SCD	16	43
C[C@@H]1C[C@H](NC[C@@H](O)c2ccccc2F)CCN1C(=O)OC(C)(C)C	ZINC000819267764	FG	On-Demand	Anodyne	GPR119	23	42
C[C@@H]1C[C@H](NC[C@H](O)c2ccccc2F)CCN1C(=O)OC(C)(C)C	ZINC000819267765	FG	On-Demand	Anodyne	GPR119	23	42
Cc1cc(CNC[C@H](O)c2cccnc2)ccc1S(N)(=O)=O	ZINC000819267775	DC	On-Demand	Anodyne	ADRB2	35	44
Cc1cc(CNC[C@H](O)c2cccnc2)ccc1S(N)(=O)=O	ZINC000819267775	DC	On-Demand	Anodyne	ADRB1	38	44
Cc1cc(CNC[C@H](O)c2cccnc2)ccc1S(N)(=O)=O	ZINC000819267775	DC	On-Demand	Anodyne	ADRB3	116	48
Cc1cc(CNC[C@@H](O)c2cccnc2)ccc1S(N)(=O)=O	ZINC000819267776	DC	On-Demand	Anodyne	ADRB2	35	44
Cc1cc(CNC[C@@H](O)c2cccnc2)ccc1S(N)(=O)=O	ZINC000819267776	DC	On-Demand	Anodyne	ADRB1	38	44
Cc1cc(CNC[C@@H](O)c2cccnc2)ccc1S(N)(=O)=O	ZINC000819267776	DC	On-Demand	Anodyne	ADRB3	116	48
COc1ccccc1-c1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819267784	DI	On-Demand	Anodyne	KCNK3	40	38
COc1ccccc1-c1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819267784	DI	On-Demand	Anodyne	KCNK9	42	38
COc1ccccc1-c1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819267785	DI	On-Demand	Anodyne	KCNK3	40	38
COc1ccccc1-c1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819267785	DI	On-Demand	Anodyne	KCNK9	42	38
COc1ccccc1-c1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819267794	DI	On-Demand	Anodyne	KCNK3	40	38
COc1ccccc1-c1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819267794	DI	On-Demand	Anodyne	KCNK9	42	38
COc1ccccc1-c1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819267796	DI	On-Demand	Anodyne	KCNK3	40	38
COc1ccccc1-c1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819267796	DI	On-Demand	Anodyne	KCNK9	42	38
CON(C)C(=O)CCN[C@@H](C)CC1CCCCC1	ZINC000819267799	CE	On-Demand	Anodyne	CTSH	37	40
CCO[C@@H](CNC[C@@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819267824	DG	On-Demand	Anodyne	ADRB1	24	42
CCO[C@@H](CNC[C@@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819267824	DG	On-Demand	Anodyne	ADRB3	33	42
CCO[C@@H](CNC[C@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819267827	DG	On-Demand	Anodyne	ADRB1	24	42
CCO[C@@H](CNC[C@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819267827	DG	On-Demand	Anodyne	ADRB3	33	42
C#CCNC(=O)CCNCc1ccc(Cl)cc1I	ZINC000819267837	GE	On-Demand	Mild	P2RX7	18	40
C[C@@H]1C[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCN1C(=O)OC(C)(C)C	ZINC000819267879	GG	On-Demand	Bother	ADRB3	17	42
C[C@@H]1C[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)CCN1C(=O)OC(C)(C)C	ZINC000819267885	GG	On-Demand	Bother	ADRB3	17	42
C[C@@H]1C[C@H](NC[C@H](O)c2ccc(F)cc2F)CCN1C(=O)OC(C)(C)C	ZINC000819267912	FG	On-Demand	Anodyne	GPR119	19	42
C[C@@H]1C[C@H](NC[C@@H](O)c2ccc(F)cc2F)CCN1C(=O)OC(C)(C)C	ZINC000819267914	FG	On-Demand	Anodyne	GPR119	19	42
Cc1ccccc1[C@@H](O)CNc1cnn(Cc2nnc3n2CCCC3)c1	ZINC000819267964	FE	On-Demand	Anodyne	PANC	44	33
Cc1cc(CNC[C@H](O)c2ccc(F)cc2Cl)ccc1S(N)(=O)=O	ZINC000819267968	FE	On-Demand	Anodyne	LEF	61	35
Cc1cc(CNC[C@@H](O)c2ccc(F)cc2Cl)ccc1S(N)(=O)=O	ZINC000819267970	FE	On-Demand	Anodyne	LEF	61	35
Oc1ccc2c(c1)CC[C@@H](NC[C@@H](O)c1ccc(OC(F)(F)F)cc1)C2	ZINC000819268049	FG	On-Demand	Anodyne	ADRB3	25	51
Oc1ccc2c(c1)CC[C@H](NC[C@@H](O)c1ccc(OC(F)(F)F)cc1)C2	ZINC000819268050	FG	On-Demand	Anodyne	ADRB3	25	51
Oc1ccc2c(c1)CC[C@@H](NC[C@H](O)c1ccc(OC(F)(F)F)cc1)C2	ZINC000819268051	FG	On-Demand	Anodyne	ADRB3	25	51
Oc1ccc2c(c1)CC[C@H](NC[C@H](O)c1ccc(OC(F)(F)F)cc1)C2	ZINC000819268052	FG	On-Demand	Anodyne	ADRB3	25	51
O=C(NCCCC(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1)OCc1ccccc1	ZINC000819268072	FF	On-Demand	Anodyne	PREP	48	34
O=C(NCCCC(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1)OCc1ccccc1	ZINC000819268072	FF	On-Demand	Anodyne	SLC12A5	55	38
O=C(NCCCC(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1)OCc1ccccc1	ZINC000819268073	FF	On-Demand	Anodyne	PREP	48	34
O=C(NCCCC(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1)OCc1ccccc1	ZINC000819268073	FF	On-Demand	Anodyne	SLC12A5	55	38
O=C(NCCCC(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1)OCc1ccccc1	ZINC000819268075	FF	On-Demand	Anodyne	PREP	48	34
O=C(NCCCC(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1)OCc1ccccc1	ZINC000819268075	FF	On-Demand	Anodyne	SLC12A5	55	38
O=C(NCCCC(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1)OCc1ccccc1	ZINC000819268076	FF	On-Demand	Anodyne	PREP	48	34
O=C(NCCCC(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1)OCc1ccccc1	ZINC000819268076	FF	On-Demand	Anodyne	SLC12A5	55	38
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	PPIA	42	53
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	TRPV1	17	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	CPT1A	52	30
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	PRNP	32	50
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	RAF1	21	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	KDR	43	39
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	GRM4	71	44
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	MAPK10	20	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	EPHX2	15	45
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	FLT3	24	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	TYK2	43	35
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	CSF1R	29	43
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	TAAR1	34	57
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	NR2E3	53	37
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	SHH	29	44
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	RIPK1	45	37
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	SMO	28	43
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	DGAT1	24	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	KCNK3	136	53
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cnc(Cl)c(Cl)c2)c1	ZINC000819268112	HK	On-Demand	Anodyne	KCNK9	87	45
Cc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1S(N)(=O)=O	ZINC000819268206	FD	On-Demand	Bother	CACNA1C	45	34
Cc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1S(N)(=O)=O	ZINC000819268206	FD	On-Demand	Bother	CACNA1D	70	34
Cc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1S(N)(=O)=O	ZINC000819268207	FD	On-Demand	Bother	CACNA1C	45	34
Cc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1S(N)(=O)=O	ZINC000819268207	FD	On-Demand	Bother	CACNA1D	70	34
C[C@@H]1C[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)CCN1C(=O)OC(C)(C)C	ZINC000819268212	GH	On-Demand	Anodyne	ADRB3	24	41
C[C@@H]1C[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)CCN1C(=O)OC(C)(C)C	ZINC000819268213	GH	On-Demand	Anodyne	ADRB3	24	41
Cc1cc(CNC[C@H](O)c2ccccc2Cl)ccc1S(N)(=O)=O	ZINC000819268244	FE	On-Demand	Anodyne	CA2	22	40
Cc1cc(CNC[C@H](O)c2ccccc2Cl)ccc1S(N)(=O)=O	ZINC000819268244	FE	On-Demand	Anodyne	CA1	19	40
Cc1cc(CNC[C@H](O)c2ccccc2Cl)ccc1S(N)(=O)=O	ZINC000819268244	FE	On-Demand	Anodyne	CA12	15	40
O[C@@H](CNCc1ccc(OC(F)F)cn1)c1ccccc1	ZINC000819268247	CF	On-Demand	Anodyne	ADRB3	23	42
O[C@H](CNCc1ccc(OC(F)F)cn1)c1ccccc1	ZINC000819268248	CF	On-Demand	Anodyne	ADRB3	23	42
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819268296	GF	On-Demand	Anodyne	FKBP1A	26	40
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819268296	GF	On-Demand	Anodyne	CELA1	18	42
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819268296	GF	On-Demand	Anodyne	GRIN2B	20	42
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819268296	GF	On-Demand	Anodyne	PREP	53	46
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819268296	GF	On-Demand	Anodyne	SLC12A5	67	39
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819268297	GF	On-Demand	Anodyne	FKBP1A	26	40
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819268297	GF	On-Demand	Anodyne	CELA1	18	42
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819268297	GF	On-Demand	Anodyne	GRIN2B	20	42
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819268297	GF	On-Demand	Anodyne	PREP	53	46
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)C1	ZINC000819268297	GF	On-Demand	Anodyne	SLC12A5	67	39
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819268298	GF	On-Demand	Anodyne	FKBP1A	26	40
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819268298	GF	On-Demand	Anodyne	CELA1	18	42
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819268298	GF	On-Demand	Anodyne	GRIN2B	20	42
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819268298	GF	On-Demand	Anodyne	PREP	53	46
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819268298	GF	On-Demand	Anodyne	SLC12A5	67	39
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819268299	GF	On-Demand	Anodyne	FKBP1A	26	40
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819268299	GF	On-Demand	Anodyne	CELA1	18	42
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819268299	GF	On-Demand	Anodyne	GRIN2B	20	42
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819268299	GF	On-Demand	Anodyne	PREP	53	46
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)C1	ZINC000819268299	GF	On-Demand	Anodyne	SLC12A5	67	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	F2	20	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	PLG	23	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	ACE	32	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	GHRHR	47	30
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	ELANE	23	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	CTRA_BOVIN	69	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	KLK3	75	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	CTSB	47	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	TRY1_BOVIN	41	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	CYSP_TRYCR	52	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	CTSG	46	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	CTSK	46	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	CTSL	50	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	PREP	24	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	CAPNS1	60	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	CELA2A	57	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	CTSS	32	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	CAPN1	68	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	CAPN2	111	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	PLAU	16	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	TGM2	26	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	KLK1	20	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	NPR	50	31
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268367	HE	On-Demand	Anodyne	SLC12A5	45	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	F2	20	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	PLG	23	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	ACE	32	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	GHRHR	47	30
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	ELANE	23	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	CTRA_BOVIN	69	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	KLK3	75	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	CTSB	47	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	TRY1_BOVIN	41	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	CYSP_TRYCR	52	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	CTSG	46	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	CTSK	46	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	CTSL	50	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	PREP	24	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	CAPNS1	60	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	CELA2A	57	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	CTSS	32	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	CAPN1	68	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	CAPN2	111	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	PLAU	16	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	TGM2	26	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	KLK1	20	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	NPR	50	31
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268368	HE	On-Demand	Anodyne	SLC12A5	45	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	F2	20	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	PLG	23	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	ACE	32	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	GHRHR	47	30
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	ELANE	23	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	CTRA_BOVIN	69	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	KLK3	75	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	CTSB	47	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	TRY1_BOVIN	41	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	CYSP_TRYCR	52	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	CTSG	46	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	CTSK	46	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	CTSL	50	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	PREP	24	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	CAPNS1	60	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	CELA2A	57	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	CTSS	32	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	CAPN1	68	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	CAPN2	111	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	PLAU	16	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	TGM2	26	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	KLK1	20	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	NPR	50	31
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268369	HE	On-Demand	Anodyne	SLC12A5	45	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	F2	20	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	PLG	23	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	ACE	32	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	GHRHR	47	30
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	ELANE	23	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	CTRA_BOVIN	69	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	KLK3	75	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	CTSB	47	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	TRY1_BOVIN	41	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	CYSP_TRYCR	52	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	CTSG	46	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	CTSK	46	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	CTSL	50	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	PREP	24	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	CAPNS1	60	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	CELA2A	57	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	CTSS	32	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	CAPN1	68	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	CAPN2	111	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	PLAU	16	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	TGM2	26	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	KLK1	20	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	NPR	50	31
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268370	HE	On-Demand	Anodyne	SLC12A5	45	35
O=C(NCC(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1)c1ccc(-c2ccccc2)cc1	ZINC000819268375	GG	On-Demand	Anodyne	PREP	15	43
O=C(NCC(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1)c1ccc(-c2ccccc2)cc1	ZINC000819268376	GG	On-Demand	Anodyne	PREP	15	43
O=C(NCC(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1)c1ccc(-c2ccccc2)cc1	ZINC000819268377	GG	On-Demand	Anodyne	PREP	15	43
O=C(NCC(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1)c1ccc(-c2ccccc2)cc1	ZINC000819268378	GG	On-Demand	Anodyne	PREP	15	43
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(OC(F)F)cn2)cc1	ZINC000819268499	FD	On-Demand	Anodyne	ADRB3	16	41
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(OC(F)F)cn2)cc1	ZINC000819268502	FD	On-Demand	Anodyne	ADRB3	16	41
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819268580	HJ	On-Demand	Anodyne	GRIN2B	22	43
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819268582	HJ	On-Demand	Anodyne	GRIN2B	22	43
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268584	HJ	On-Demand	Anodyne	GRIN2B	22	43
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819268586	HJ	On-Demand	Anodyne	GRIN2B	22	43
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)cc1	ZINC000819268593	GG	On-Demand	Anodyne	ADRB2	29	44
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)cc1	ZINC000819268593	GG	On-Demand	Anodyne	ADRB1	41	40
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)cc1	ZINC000819268593	GG	On-Demand	Anodyne	ADRB3	32	44
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)cc1	ZINC000819268593	GG	On-Demand	Anodyne	ACOX1	40	31
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)cc1	ZINC000819268596	GG	On-Demand	Anodyne	ADRB2	29	44
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)cc1	ZINC000819268596	GG	On-Demand	Anodyne	ADRB1	41	40
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)cc1	ZINC000819268596	GG	On-Demand	Anodyne	ADRB3	32	44
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)cc1	ZINC000819268596	GG	On-Demand	Anodyne	ACOX1	40	31
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1	ZINC000819268597	GG	On-Demand	Anodyne	ADRB2	29	44
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1	ZINC000819268597	GG	On-Demand	Anodyne	ADRB1	41	40
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1	ZINC000819268597	GG	On-Demand	Anodyne	ADRB3	32	44
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1	ZINC000819268597	GG	On-Demand	Anodyne	ACOX1	40	31
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1	ZINC000819268598	GG	On-Demand	Anodyne	ADRB2	29	44
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1	ZINC000819268598	GG	On-Demand	Anodyne	ADRB1	41	40
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1	ZINC000819268598	GG	On-Demand	Anodyne	ADRB3	32	44
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)cc1	ZINC000819268598	GG	On-Demand	Anodyne	ACOX1	40	31
Cc1cc(CNCCC(=O)Nc2ccc(N(C)C)cc2)ccc1S(N)(=O)=O	ZINC000819268600	GD	On-Demand	Anodyne	CA2	29	41
Cc1cc(CNCCC(=O)Nc2ccc(N(C)C)cc2)ccc1S(N)(=O)=O	ZINC000819268600	GD	On-Demand	Anodyne	CA1	27	41
Cc1cc(CNCCC(=O)Nc2ccc(N(C)C)cc2)ccc1S(N)(=O)=O	ZINC000819268600	GD	On-Demand	Anodyne	CA12	19	41
Cc1cc(CNCCC(=O)Nc2ccc(N(C)C)cc2)ccc1S(N)(=O)=O	ZINC000819268600	GD	On-Demand	Anodyne	CA9	20	41
Cc1ncc(CN2CCN(C(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)CC2)s1	ZINC000819268609	GE	On-Demand	Anodyne	MGEA5	32	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccccc1-c1nc2ccccc2[nH]1	ZINC000819268610	GI	On-Demand	Anodyne	STK33	43	39
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c(C)c1	ZINC000819268616	GG	On-Demand	Anodyne	ADRB2	17	40
Cc1ccc(OC[C@H](O)CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c(C)c1	ZINC000819268617	GG	On-Demand	Anodyne	ADRB2	17	40
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c(C)c1	ZINC000819268618	GG	On-Demand	Anodyne	ADRB2	17	40
Cc1ccc(OC[C@H](O)CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c(C)c1	ZINC000819268619	GG	On-Demand	Anodyne	ADRB2	17	40
C[C@@H]1C[C@H](NCCS(=O)(=O)c2ccccc2)CCN1C(=O)OC(C)(C)C	ZINC000819268633	GF	On-Demand	Anodyne	SFRP1	115	41
C[C@@H]1C[C@H](NCCS(=O)(=O)c2ccccc2)CCN1C(=O)OC(C)(C)C	ZINC000819268633	GF	On-Demand	Anodyne	WNT3	81	41
C[C@H]1C[C@H](NCCS(=O)(=O)c2ccccc2)CCN1C(=O)OC(C)(C)C	ZINC000819268634	GF	On-Demand	Anodyne	SFRP1	115	41
C[C@H]1C[C@H](NCCS(=O)(=O)c2ccccc2)CCN1C(=O)OC(C)(C)C	ZINC000819268634	GF	On-Demand	Anodyne	WNT3	81	41
C[C@@H]1C[C@H](NC[C@H](O)c2ccc(C#N)cc2)CCN1C(=O)OC(C)(C)C	ZINC000819268646	FF	On-Demand	Mild	ADRB3	18	40
C[C@@H]1C[C@H](NC[C@@H](O)c2ccc(C#N)cc2)CCN1C(=O)OC(C)(C)C	ZINC000819268647	FF	On-Demand	Mild	ADRB3	18	40
Cc1cc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)ccc1S(N)(=O)=O	ZINC000819268659	GE	On-Demand	Anodyne	CCR2	32	45
Cc1cc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)ccc1S(N)(=O)=O	ZINC000819268660	GE	On-Demand	Anodyne	CCR2	32	45
C=C(C)C(C)(C)C(=O)Nc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000819268779	EI	On-Demand	Mild	PDS	44	31
C[C@@H]1C[C@H](NC[C@@H](O)c2ccc(F)cc2)CCN1C(=O)OC(C)(C)C	ZINC000819268796	FG	On-Demand	Anodyne	ADRB3	21	42
C[C@@H]1C[C@H](NC[C@H](O)c2ccc(F)cc2)CCN1C(=O)OC(C)(C)C	ZINC000819268798	FG	On-Demand	Anodyne	ADRB3	21	42
C[C@@H]1C[C@H](NC[C@@H](O)c2cccc(F)c2)CCN1C(=O)OC(C)(C)C	ZINC000819268815	FG	On-Demand	Anodyne	GPR119	16	44
C[C@@H]1C[C@H](NC[C@H](O)c2cccc(F)c2)CCN1C(=O)OC(C)(C)C	ZINC000819268817	FG	On-Demand	Anodyne	GPR119	16	44
Cc1cc(CNC[C@H](O)c2cccc(F)c2)ccc1S(N)(=O)=O	ZINC000819268820	ED	On-Demand	Anodyne	ADRB1	29	41
Cc1cc(CNC[C@H](O)c2cccc(F)c2)ccc1S(N)(=O)=O	ZINC000819268820	ED	On-Demand	Anodyne	ADRB3	43	41
Cc1cc(CNC[C@@H](O)c2cccc(F)c2)ccc1S(N)(=O)=O	ZINC000819268821	ED	On-Demand	Anodyne	ADRB1	29	41
Cc1cc(CNC[C@@H](O)c2cccc(F)c2)ccc1S(N)(=O)=O	ZINC000819268821	ED	On-Demand	Anodyne	ADRB3	43	41
O[C@@H](CNc1cnn(Cc2nnc3n2CCCC3)c1)c1cccnc1	ZINC000819268859	ED	On-Demand	Anodyne	ADRB3	54	39
O[C@H](CNc1cnn(Cc2nnc3n2CCCC3)c1)c1cccnc1	ZINC000819268860	ED	On-Demand	Anodyne	ADRB3	54	39
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2nc(-c3ccncc3)cs2)CC1	ZINC000819268969	FH	On-Demand	Anodyne	ETHR	26	40
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2nc(-c3ccncc3)cs2)CC1	ZINC000819268970	FH	On-Demand	Anodyne	ETHR	26	40
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2nc(-c3ccncc3)cs2)CC1	ZINC000819268971	FH	On-Demand	Anodyne	ETHR	26	40
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2nc(-c3ccncc3)cs2)CC1	ZINC000819268972	FH	On-Demand	Anodyne	ETHR	26	40
Cc1cc(CNC[C@H](O)c2ccc(Cl)cc2)ccc1S(N)(=O)=O	ZINC000819268973	FE	On-Demand	Anodyne	ADRB2	27	41
O[C@@H](CNCC1CCN(C2CC2)CC1)c1cccc(Cl)c1	ZINC000819268984	DF	On-Demand	Anodyne	ADRB1	49	45
O[C@@H](CNCC1CCN(C2CC2)CC1)c1cccc(Cl)c1	ZINC000819268984	DF	On-Demand	Anodyne	ADRB3	61	47
O[C@@H](CNCC1CCN(C2CC2)CC1)c1cccc(Cl)c1	ZINC000819268984	DF	On-Demand	Anodyne	CYP3A4	51	39
O[C@H](CNCC1CCN(C2CC2)CC1)c1cccc(Cl)c1	ZINC000819268985	DF	On-Demand	Anodyne	ADRB1	49	45
O[C@H](CNCC1CCN(C2CC2)CC1)c1cccc(Cl)c1	ZINC000819268985	DF	On-Demand	Anodyne	ADRB3	61	47
O[C@H](CNCC1CCN(C2CC2)CC1)c1cccc(Cl)c1	ZINC000819268985	DF	On-Demand	Anodyne	CYP3A4	51	39
CC(=O)Nc1cccc(CC(=O)Nc2cccc(CNC(=O)OC(C)(C)C)c2)c1	ZINC000819268994	GH	On-Demand	Anodyne	NQO2	21	40
CC(=O)Nc1cccc(CC(=O)Nc2cccc(CNC(=O)OC(C)(C)C)c2)c1	ZINC000819268994	GH	On-Demand	Anodyne	MTNR1A	17	40
CC(=O)Nc1cccc(CC(=O)Nc2cccc(CNC(=O)OC(C)(C)C)c2)c1	ZINC000819268994	GH	On-Demand	Anodyne	MTNR1B	18	40
CC(=O)Nc1cccc(CC(=O)Nc2cccc(CNC(=O)OC(C)(C)C)c2)c1	ZINC000819268994	GH	On-Demand	Anodyne	ROCK2	15	42
CC(=O)Nc1cccc(CC(=O)Nc2cccc(CNC(=O)OC(C)(C)C)c2)c1	ZINC000819268994	GH	On-Demand	Anodyne	PDS	59	32
CC(C)(C)OC(=O)NCc1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819269022	EI	On-Demand	Anodyne	PDS	61	33
O[C@@H](CNCC1CCN(C2CC2)CC1)c1ccccc1	ZINC000819269032	CE	On-Demand	Anodyne	SLC6A3	36	48
O[C@@H](CNCC1CCN(C2CC2)CC1)c1ccccc1	ZINC000819269032	CE	On-Demand	Anodyne	GRIN2B	21	41
O[C@@H](CNCC1CCN(C2CC2)CC1)c1ccccc1	ZINC000819269032	CE	On-Demand	Anodyne	SLC18A3	19	40
O[C@@H](CNCC1CCN(C2CC2)CC1)c1ccccc1	ZINC000819269032	CE	On-Demand	Anodyne	Q8WSF8_APLCA	32	40
O[C@H](CNCC1CCN(C2CC2)CC1)c1ccccc1	ZINC000819269034	CE	On-Demand	Anodyne	SLC6A3	36	48
O[C@H](CNCC1CCN(C2CC2)CC1)c1ccccc1	ZINC000819269034	CE	On-Demand	Anodyne	GRIN2B	21	41
O[C@H](CNCC1CCN(C2CC2)CC1)c1ccccc1	ZINC000819269034	CE	On-Demand	Anodyne	SLC18A3	19	40
O[C@H](CNCC1CCN(C2CC2)CC1)c1ccccc1	ZINC000819269034	CE	On-Demand	Anodyne	Q8WSF8_APLCA	32	40
CN(CC(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1)C(=O)OCc1ccccc1	ZINC000819269050	FE	On-Demand	Anodyne	PREP	40	37
CN(CC(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1)C(=O)OCc1ccccc1	ZINC000819269050	FE	On-Demand	Anodyne	SLC12A5	72	39
CN(CC(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1)C(=O)OCc1ccccc1	ZINC000819269053	FE	On-Demand	Anodyne	PREP	40	37
CN(CC(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1)C(=O)OCc1ccccc1	ZINC000819269053	FE	On-Demand	Anodyne	SLC12A5	72	39
CN(CC(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1)C(=O)OCc1ccccc1	ZINC000819269056	FE	On-Demand	Anodyne	PREP	40	37
CN(CC(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1)C(=O)OCc1ccccc1	ZINC000819269056	FE	On-Demand	Anodyne	SLC12A5	72	39
CN(CC(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1)C(=O)OCc1ccccc1	ZINC000819269060	FE	On-Demand	Anodyne	PREP	40	37
CN(CC(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1)C(=O)OCc1ccccc1	ZINC000819269060	FE	On-Demand	Anodyne	SLC12A5	72	39
C[C@@H]1C[C@H](NC[C@H](O)c2cc(F)ccc2F)CCN1C(=O)OC(C)(C)C	ZINC000819269087	FG	On-Demand	Anodyne	GPR119	20	44
C[C@@H]1C[C@H](NC[C@@H](O)c2cc(F)ccc2F)CCN1C(=O)OC(C)(C)C	ZINC000819269089	FG	On-Demand	Anodyne	GPR119	20	44
Cc1cc(CNC[C@H](O)c2ccc(Cl)c(F)c2)ccc1S(N)(=O)=O	ZINC000819269106	FE	On-Demand	Anodyne	LEF	40	35
Cc1cc(CNC[C@@H](O)c2ccc(Cl)c(F)c2)ccc1S(N)(=O)=O	ZINC000819269108	FE	On-Demand	Anodyne	LEF	40	35
O=C(c1cc(-c2ccccn2)nc2ccccc12)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819269139	GI	On-Demand	Anodyne	METAP1	44	37
O=C(c1cc(-c2ccccn2)nc2ccccc12)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819269140	GI	On-Demand	Anodyne	METAP1	44	37
O=C(c1cc(-c2ccccn2)nc2ccccc12)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819269142	GI	On-Demand	Anodyne	METAP1	44	37
O=C(c1cc(-c2ccccn2)nc2ccccc12)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819269143	GI	On-Demand	Anodyne	METAP1	44	37
CN(C)CCOc1ccc(N(C)C(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819269172	GH	On-Demand	Anodyne	ESRRG	46	34
N#CCCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819269174	CE	On-Demand	Mild	ADRB2	15	41
N#CCCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819269175	CE	On-Demand	Mild	ADRB2	15	41
COCCc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269179	CD	On-Demand	Mild	ADRB2	58	63
COCCc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269179	CD	On-Demand	Mild	ADRB1	93	63
COCCc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269179	CD	On-Demand	Mild	GRIN1	17	47
COCCc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269179	CD	On-Demand	Mild	ADRB3	56	57
COCCc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269180	CD	On-Demand	Mild	ADRB2	58	63
COCCc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269180	CD	On-Demand	Mild	ADRB1	93	63
COCCc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269180	CD	On-Demand	Mild	GRIN1	17	47
COCCc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269180	CD	On-Demand	Mild	ADRB3	56	57
CC[C@@H](C(=O)NNC(=O)c1cc2c(cn1)OCCO2)c1ccccc1	ZINC000819269185	ED	On-Demand	Reactive	KCNQ2	41	39
CC[C@@H](C(=O)NNC(=O)C[C@H](C)n1cccn1)c1ccccc1	ZINC000819269187	DE	On-Demand	Reactive	KCNQ2	50	41
CC[C@@H](C(=O)NNC(=O)C[C@@H](C)n1cccn1)c1ccccc1	ZINC000819269189	DE	On-Demand	Reactive	KCNQ2	50	41
CCOc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269192	CD	On-Demand	Mild	ADRB2	59	50
CCOc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269192	CD	On-Demand	Mild	ADRB1	85	50
CCOc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269192	CD	On-Demand	Mild	ADRB3	50	50
CCOc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269193	CD	On-Demand	Mild	ADRB2	59	50
CCOc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269193	CD	On-Demand	Mild	ADRB1	85	50
CCOc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269193	CD	On-Demand	Mild	ADRB3	50	50
C[C@H](CC(=O)Oc1ccc(NC(=O)C2CCCCC2)cc1)n1cccn1	ZINC000819269227	FH	On-Demand	Anodyne	PFKFB3	55	35
CC(=O)Nc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269235	CC	On-Demand	Mild	ADRB2	59	65
CC(=O)Nc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269235	CC	On-Demand	Mild	ADRB1	101	65
CC(=O)Nc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269235	CC	On-Demand	Mild	GRIN1	25	47
CC(=O)Nc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269235	CC	On-Demand	Mild	ADRB3	61	65
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269236	CC	On-Demand	Mild	ADRB2	59	65
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269236	CC	On-Demand	Mild	ADRB1	101	65
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269236	CC	On-Demand	Mild	GRIN1	25	47
CC(=O)Nc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269236	CC	On-Demand	Mild	ADRB3	61	65
O=C(NC[C@H]1CCc2ccccc21)C(F)=C1CCC1	ZINC000819269243	CG	On-Demand	Anodyne	NQO2	18	40
O=C(NC[C@H]1CCc2ccccc21)C(F)=C1CCC1	ZINC000819269243	CG	On-Demand	Anodyne	MTNR1A	15	46
O=C(NC[C@H]1CCc2ccccc21)C(F)=C1CCC1	ZINC000819269243	CG	On-Demand	Anodyne	MTNR1B	17	46
O=C(NC[C@@H]1CCc2ccccc21)C(F)=C1CCC1	ZINC000819269244	CG	On-Demand	Anodyne	NQO2	18	40
O=C(NC[C@@H]1CCc2ccccc21)C(F)=C1CCC1	ZINC000819269244	CG	On-Demand	Anodyne	MTNR1A	15	46
O=C(NC[C@@H]1CCc2ccccc21)C(F)=C1CCC1	ZINC000819269244	CG	On-Demand	Anodyne	MTNR1B	17	46
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H]1CCc2ccccc21	ZINC000819269249	CF	On-Demand	Anodyne	MTNR1B	18	41
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H]1CCc2ccccc21	ZINC000819269250	CF	On-Demand	Anodyne	MTNR1B	18	41
O=C(/C=C/[C@@H]1CCCO1)NC[C@H]1CCc2ccccc21	ZINC000819269251	CF	On-Demand	Anodyne	MTNR1B	18	41
O=C(/C=C\[C@@H]1CCCO1)NC[C@H]1CCc2ccccc21	ZINC000819269252	CF	On-Demand	Anodyne	MTNR1B	18	41
C/C=C/c1ccc(OC[C@@H](O)CNCCC#N)c(OC)c1	ZINC000819269360	CD	On-Demand	Mild	ADRB2	23	67
C/C=C/c1ccc(OC[C@@H](O)CNCCC#N)c(OC)c1	ZINC000819269360	CD	On-Demand	Mild	ADRB1	49	33
C/C=C/c1ccc(OC[C@H](O)CNCCC#N)c(OC)c1	ZINC000819269361	CD	On-Demand	Mild	ADRB2	23	67
C/C=C/c1ccc(OC[C@H](O)CNCCC#N)c(OC)c1	ZINC000819269361	CD	On-Demand	Mild	ADRB1	49	33
C/C=C\c1ccc(OC[C@@H](O)CNCCC#N)c(OC)c1	ZINC000819269362	CD	On-Demand	Mild	ADRB2	23	67
C/C=C\c1ccc(OC[C@@H](O)CNCCC#N)c(OC)c1	ZINC000819269362	CD	On-Demand	Mild	ADRB1	49	33
C/C=C\c1ccc(OC[C@H](O)CNCCC#N)c(OC)c1	ZINC000819269363	CD	On-Demand	Mild	ADRB2	23	67
C/C=C\c1ccc(OC[C@H](O)CNCCC#N)c(OC)c1	ZINC000819269363	CD	On-Demand	Mild	ADRB1	49	33
N#CCCNC[C@H](O)COc1ccccc1F	ZINC000819269364	BD	On-Demand	Mild	ADRB2	40	47
N#CCCNC[C@H](O)COc1ccccc1F	ZINC000819269364	BD	On-Demand	Mild	ADRB1	77	53
N#CCCNC[C@H](O)COc1ccccc1F	ZINC000819269364	BD	On-Demand	Mild	ADRB3	25	41
N#CCCNC[C@H](O)COc1ccccc1F	ZINC000819269364	BD	On-Demand	Mild	CASR	40	38
N#CCCNC[C@@H](O)COc1ccccc1F	ZINC000819269365	BD	On-Demand	Mild	ADRB2	40	47
N#CCCNC[C@@H](O)COc1ccccc1F	ZINC000819269365	BD	On-Demand	Mild	ADRB1	77	53
N#CCCNC[C@@H](O)COc1ccccc1F	ZINC000819269365	BD	On-Demand	Mild	ADRB3	25	41
N#CCCNC[C@@H](O)COc1ccccc1F	ZINC000819269365	BD	On-Demand	Mild	CASR	40	38
C[C@@H]1C[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)CCN1C(=O)OC(C)(C)C	ZINC000819269402	GF	On-Demand	Mild	ADRB3	24	41
C[C@@H]1C[C@H](NC[C@H](O)COc2ccc(C#N)cc2)CCN1C(=O)OC(C)(C)C	ZINC000819269404	GF	On-Demand	Mild	ADRB3	24	41
N#CCCNCCC(=O)Nc1cccnc1	ZINC000819269407	BC	On-Demand	Mild	NAMPT	18	41
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000819269414	FG	On-Demand	Anodyne	P2RX7	42	40
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000819269414	FG	On-Demand	Anodyne	CCR3	35	43
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000819269415	FG	On-Demand	Anodyne	P2RX7	42	40
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000819269415	FG	On-Demand	Anodyne	CCR3	35	43
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000819269416	FG	On-Demand	Anodyne	P2RX7	42	40
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000819269416	FG	On-Demand	Anodyne	CCR3	35	43
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000819269417	FG	On-Demand	Anodyne	P2RX7	42	40
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000819269417	FG	On-Demand	Anodyne	CCR3	35	43
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)C(F)=C1CCC1	ZINC000819269426	EH	On-Demand	Anodyne	DRD2	22	48
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)C(F)=C1CCC1	ZINC000819269426	EH	On-Demand	Anodyne	KCNH2	34	43
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)C(F)=C1CCC1	ZINC000819269426	EH	On-Demand	Anodyne	LTA4H	27	48
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)C(F)=C1CCC1	ZINC000819269426	EH	On-Demand	Anodyne	SIGMAR1	19	45
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)C(F)=C1CCC1	ZINC000819269426	EH	On-Demand	Anodyne	CCR3	19	43
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)C(F)=C1CCC1	ZINC000819269426	EH	On-Demand	Anodyne	ACHP_LYMST	19	42
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)C(F)=C1CCC1	ZINC000819269426	EH	On-Demand	Anodyne	Q8WSF8_APLCA	28	40
C=CCc1ccc(OC[C@@H](O)CNCCC#N)c(OC)c1	ZINC000819269429	CD	On-Demand	Mild	ADRB2	29	49
C=CCc1ccc(OC[C@@H](O)CNCCC#N)c(OC)c1	ZINC000819269429	CD	On-Demand	Mild	ADRB1	49	33
C=CCc1ccc(OC[C@H](O)CNCCC#N)c(OC)c1	ZINC000819269430	CD	On-Demand	Mild	ADRB2	29	49
C=CCc1ccc(OC[C@H](O)CNCCC#N)c(OC)c1	ZINC000819269430	CD	On-Demand	Mild	ADRB1	49	33
C[C@@H](CC(=O)N(C)c1ccc(OCCN(C)C)cc1)n1cccn1	ZINC000819269431	EE	On-Demand	Anodyne	ESRRG	48	35
O=[N+]([O-])c1cc(CNC[C@H](O)c2cccnc2)cc(C(F)(F)F)c1	ZINC000819269455	EF	On-Demand	Bother	ADRB2	21	41
O=[N+]([O-])c1cc(CNC[C@H](O)c2cccnc2)cc(C(F)(F)F)c1	ZINC000819269455	EF	On-Demand	Bother	ADRB1	21	42
O=[N+]([O-])c1cc(CNC[C@H](O)c2cccnc2)cc(C(F)(F)F)c1	ZINC000819269455	EF	On-Demand	Bother	ADRB3	88	45
O=[N+]([O-])c1cc(CNC[C@@H](O)c2cccnc2)cc(C(F)(F)F)c1	ZINC000819269456	EF	On-Demand	Bother	ADRB2	21	41
O=[N+]([O-])c1cc(CNC[C@@H](O)c2cccnc2)cc(C(F)(F)F)c1	ZINC000819269456	EF	On-Demand	Bother	ADRB1	21	42
O=[N+]([O-])c1cc(CNC[C@@H](O)c2cccnc2)cc(C(F)(F)F)c1	ZINC000819269456	EF	On-Demand	Bother	ADRB3	88	45
O=C(c1cccnc1)N1CCC(C(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)CC1	ZINC000819269519	FE	On-Demand	Anodyne	L3MBTL3	50	34
O=C(c1cccnc1)N1CCC(C(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)CC1	ZINC000819269520	FE	On-Demand	Anodyne	L3MBTL3	50	34
O=C(c1cccnc1)N1CCC(C(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)CC1	ZINC000819269521	FE	On-Demand	Anodyne	L3MBTL3	50	34
O=C(c1cccnc1)N1CCC(C(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)CC1	ZINC000819269522	FE	On-Demand	Anodyne	L3MBTL3	50	34
CC[C@@H](C(=O)NNC(=O)C(F)=C1CCC1)c1ccccc1	ZINC000819269558	CF	On-Demand	Reactive	KCNQ2	54	44
N#CCCNC[C@H](O)COCc1cccs1	ZINC000819269560	BD	On-Demand	Mild	ADRB1	41	33
N#CCCNC[C@@H](O)COCc1cccs1	ZINC000819269561	BD	On-Demand	Mild	ADRB1	41	33
N#CCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819269562	CE	On-Demand	Mild	ADRB3	17	44
N#CCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819269563	CE	On-Demand	Mild	ADRB3	17	44
Cc1cscc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819269564	GH	On-Demand	Anodyne	CTSD	69	43
Cc1cscc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819269564	GH	On-Demand	Anodyne	PGC	49	38
Cc1cscc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819269564	GH	On-Demand	Anodyne	PAPA1_CARPA	35	44
Cc1cscc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819269564	GH	On-Demand	Anodyne	CTSK	15	48
Cc1cscc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819269564	GH	On-Demand	Anodyne	CTSL	15	44
Cc1cscc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819269564	GH	On-Demand	Anodyne	BACE2	42	38
Cc1cscc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819269564	GH	On-Demand	Anodyne	TACR3	15	42
Cc1cscc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819269564	GH	On-Demand	Anodyne	REN	72	49
Cc1cscc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819269564	GH	On-Demand	Anodyne	REN1	17	45
Cc1cscc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819269564	GH	On-Demand	Anodyne	BACE1	77	42
Cc1cscc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819269564	GH	On-Demand	Anodyne	FPR1	50	41
C=C(C)C(C)(C)C(=O)N(C)c1ccc(OCCN(C)C)cc1	ZINC000819269567	DG	On-Demand	Mild	ESRRG	48	36
COc1ccc(OC)c([C@H](O)CNCc2ccc(C)n(C)c2=O)c1	ZINC000819269590	ED	On-Demand	Anodyne	ADRB2	15	41
N#CCCNC[C@@H](O)COCc1ccccc1	ZINC000819269592	BD	On-Demand	Mild	ADRB2	26	40
N#CCCNC[C@@H](O)COCc1ccccc1	ZINC000819269592	BD	On-Demand	Mild	ADRB1	44	34
N#CCCNC[C@@H](O)COCc1ccccc1	ZINC000819269592	BD	On-Demand	Mild	ADRB3	23	40
N#CCCNC[C@@H](O)COCc1ccccc1	ZINC000819269592	BD	On-Demand	Mild	GHSR	17	42
N#CCCNC[C@H](O)COCc1ccccc1	ZINC000819269593	BD	On-Demand	Mild	ADRB2	26	40
N#CCCNC[C@H](O)COCc1ccccc1	ZINC000819269593	BD	On-Demand	Mild	ADRB1	44	34
N#CCCNC[C@H](O)COCc1ccccc1	ZINC000819269593	BD	On-Demand	Mild	ADRB3	23	40
N#CCCNC[C@H](O)COCc1ccccc1	ZINC000819269593	BD	On-Demand	Mild	GHSR	17	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)C2=NN(c3ccccc3)C(=O)CC2)c1	ZINC000819269594	II	On-Demand	Anodyne	KCNK3	100	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)C2=NN(c3ccccc3)C(=O)CC2)c1	ZINC000819269594	II	On-Demand	Anodyne	KCNK9	60	37
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819269595	EH	On-Demand	Anodyne	HTR1D	22	49
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819269595	EH	On-Demand	Anodyne	HTR1B	18	49
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819269595	EH	On-Demand	Anodyne	HTR1F	61	43
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819269595	EH	On-Demand	Anodyne	CCR2	33	57
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819269596	EH	On-Demand	Anodyne	HTR1D	22	49
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819269596	EH	On-Demand	Anodyne	HTR1B	18	49
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819269596	EH	On-Demand	Anodyne	HTR1F	61	43
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819269596	EH	On-Demand	Anodyne	CCR2	33	57
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819269597	EH	On-Demand	Anodyne	HTR1D	22	49
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819269597	EH	On-Demand	Anodyne	HTR1B	18	49
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819269597	EH	On-Demand	Anodyne	HTR1F	61	43
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819269597	EH	On-Demand	Anodyne	CCR2	33	57
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819269598	EH	On-Demand	Anodyne	HTR1D	22	49
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819269598	EH	On-Demand	Anodyne	HTR1B	18	49
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819269598	EH	On-Demand	Anodyne	HTR1F	61	43
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2c[nH]c3cc(F)ccc23)CC1	ZINC000819269598	EH	On-Demand	Anodyne	CCR2	33	57
C=CCC1(C(=O)N(C)c2ccc(OCCN(C)C)cc2)CCOCC1	ZINC000819269599	EF	On-Demand	Mild	ESRRG	44	33
N#CCCNC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819269602	CE	On-Demand	Mild	ADRB2	22	43
N#CCCNC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819269602	CE	On-Demand	Mild	ADRB1	53	36
N#CCCNC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819269603	CE	On-Demand	Mild	ADRB2	22	43
N#CCCNC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819269603	CE	On-Demand	Mild	ADRB1	53	36
N#CCCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819269608	CC	On-Demand	Mild	ADRB2	38	48
N#CCCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819269608	CC	On-Demand	Mild	ADRB1	71	48
N#CCCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819269608	CC	On-Demand	Mild	ADRB3	27	44
N#CCCNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819269608	CC	On-Demand	Mild	CASR	40	37
N#CCCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819269609	CC	On-Demand	Mild	ADRB2	38	48
N#CCCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819269609	CC	On-Demand	Mild	ADRB1	71	48
N#CCCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819269609	CC	On-Demand	Mild	ADRB3	27	44
N#CCCNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819269609	CC	On-Demand	Mild	CASR	40	37
CC[C@@H](C(=O)NNC(=O)[C@@H]1CCCO[C@@H]1C(C)C)c1ccccc1	ZINC000819269617	EF	On-Demand	Reactive	KCNQ2	43	39
CN(C)CCOc1ccc(N(C)C(=O)Cc2nsc3ccccc23)cc1	ZINC000819269627	FG	On-Demand	Anodyne	ESRRG	47	35
C=C(C)C(C)(C)C(=O)NNC(=O)[C@@H](CC)c1ccccc1	ZINC000819269644	CF	On-Demand	Reactive	KCNQ2	41	41
C=C(C)C(C)(C)C(=O)NNC(=O)[C@H](CC)c1ccccc1	ZINC000819269645	CF	On-Demand	Reactive	KCNQ2	41	41
COc1ccccc1COC[C@H](O)CNCCC#N	ZINC000819269652	CD	On-Demand	Mild	ADRB2	25	40
COc1ccccc1COC[C@H](O)CNCCC#N	ZINC000819269652	CD	On-Demand	Mild	ADRB1	52	36
COc1ccccc1COC[C@@H](O)CNCCC#N	ZINC000819269653	CD	On-Demand	Mild	ADRB2	25	40
COc1ccccc1COC[C@@H](O)CNCCC#N	ZINC000819269653	CD	On-Demand	Mild	ADRB1	52	36
N#CCCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819269654	CC	On-Demand	Mild	ADRB2	54	56
N#CCCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819269654	CC	On-Demand	Mild	ADRB1	88	56
N#CCCNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819269654	CC	On-Demand	Mild	ADRB3	53	56
N#CCCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819269655	CC	On-Demand	Mild	ADRB2	54	56
N#CCCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819269655	CC	On-Demand	Mild	ADRB1	88	56
N#CCCNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819269655	CC	On-Demand	Mild	ADRB3	53	56
CC[C@@H](C(=O)NNC(=O)c1cc(C)ccc1C1CC1)c1ccccc1	ZINC000819269679	EH	On-Demand	Reactive	KCNQ2	41	41
CON(C)C(=O)CCN[C@H](C)CC1CCCCC1	ZINC000819269690	CE	On-Demand	Anodyne	CTSH	37	40
N#CCCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819269691	CE	On-Demand	Mild	ADRB2	19	42
N#CCCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819269691	CE	On-Demand	Mild	ADRB3	19	40
N#CCCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819269691	CE	On-Demand	Mild	CASR	44	42
N#CCCNC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819269691	CE	On-Demand	Mild	CYP2D6	17	42
N#CCCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819269693	CE	On-Demand	Mild	ADRB2	19	42
N#CCCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819269693	CE	On-Demand	Mild	ADRB3	19	40
N#CCCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819269693	CE	On-Demand	Mild	CASR	44	42
N#CCCNC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819269693	CE	On-Demand	Mild	CYP2D6	17	42
CC[C@@H](C(=O)NNC(=O)C[S@](=O)c1cccc(OC)c1)c1ccccc1	ZINC000819269701	FE	On-Demand	Reactive	KCNQ2	34	44
CC[C@@H](C(=O)NNC(=O)C[S@@](=O)c1cccc(OC)c1)c1ccccc1	ZINC000819269702	FE	On-Demand	Reactive	KCNQ2	34	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCCNC(=O)c1cccc(F)c1	ZINC000819269713	GD	On-Demand	Anodyne	DRD4	40	31
CC[C@@H](C(=O)NNC(=O)CCc1cccc(OC(F)F)c1)c1ccccc1	ZINC000819269726	GH	On-Demand	Reactive	PDS	66	35
CSc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269728	CD	On-Demand	Mild	ADRB2	49	47
CSc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269728	CD	On-Demand	Mild	ADRB1	77	47
CSc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269728	CD	On-Demand	Mild	ADRB3	42	47
CSc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269729	CD	On-Demand	Mild	ADRB2	49	47
CSc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269729	CD	On-Demand	Mild	ADRB1	77	47
CSc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269729	CD	On-Demand	Mild	ADRB3	42	47
CCN1CCCC[C@@H]1CNC(=O)C(F)=C1CCC1	ZINC000819269730	CE	On-Demand	Anodyne	DRD2	33	43
CCN1CCCC[C@H]1CNC(=O)C(F)=C1CCC1	ZINC000819269732	CE	On-Demand	Anodyne	DRD2	33	43
Cc1cc(OC[C@H](O)CNCCC#N)c(C(C)C)cc1Cl	ZINC000819269754	DG	On-Demand	Mild	ADRB2	18	40
Cc1cc(OC[C@H](O)CNCCC#N)c(C(C)C)cc1Cl	ZINC000819269754	DG	On-Demand	Mild	ADRB1	48	32
Cc1cc(OC[C@@H](O)CNCCC#N)c(C(C)C)cc1Cl	ZINC000819269756	DG	On-Demand	Mild	ADRB2	18	40
Cc1cc(OC[C@@H](O)CNCCC#N)c(C(C)C)cc1Cl	ZINC000819269756	DG	On-Demand	Mild	ADRB1	48	32
Cc1ccc(OC[C@H](O)CNCCC#N)c(C)c1	ZINC000819269763	BD	On-Demand	Mild	ADRB2	31	49
Cc1ccc(OC[C@H](O)CNCCC#N)c(C)c1	ZINC000819269763	BD	On-Demand	Mild	ADRB1	63	38
Cc1ccc(OC[C@@H](O)CNCCC#N)c(C)c1	ZINC000819269765	BD	On-Demand	Mild	ADRB2	31	49
Cc1ccc(OC[C@@H](O)CNCCC#N)c(C)c1	ZINC000819269765	BD	On-Demand	Mild	ADRB1	63	38
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCC#N	ZINC000819269767	CC	On-Demand	Mild	PAPA1_CARPA	30	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCC#N	ZINC000819269769	CC	On-Demand	Mild	PAPA1_CARPA	30	42
C[C@@H]1CCCC[C@H]1C(=O)N(C)c1ccc(OCCN(C)C)cc1	ZINC000819269796	DG	On-Demand	Anodyne	LSS	18	40
C[C@@H]1CCCC[C@H]1C(=O)N(C)c1ccc(OCCN(C)C)cc1	ZINC000819269796	DG	On-Demand	Anodyne	ESRRG	45	34
C[C@@H]1CCCC[C@@H]1C(=O)N(C)c1ccc(OCCN(C)C)cc1	ZINC000819269799	DG	On-Demand	Anodyne	LSS	18	40
C[C@@H]1CCCC[C@@H]1C(=O)N(C)c1ccc(OCCN(C)C)cc1	ZINC000819269799	DG	On-Demand	Anodyne	ESRRG	45	34
CCOc1ccccc1C(F)(F)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819269805	FG	On-Demand	Anodyne	HCN1	43	33
CCOc1ccccc1C(F)(F)C(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819269805	FG	On-Demand	Anodyne	HCN4	43	33
CCOc1ccccc1C(F)(F)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819269808	FG	On-Demand	Anodyne	HCN1	43	33
CCOc1ccccc1C(F)(F)C(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819269808	FG	On-Demand	Anodyne	HCN4	43	33
CCOc1ccccc1C(F)(F)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819269809	FG	On-Demand	Anodyne	HCN1	43	33
CCOc1ccccc1C(F)(F)C(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819269809	FG	On-Demand	Anodyne	HCN4	43	33
CCOc1ccccc1C(F)(F)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819269810	FG	On-Demand	Anodyne	HCN1	43	33
CCOc1ccccc1C(F)(F)C(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819269810	FG	On-Demand	Anodyne	HCN4	43	33
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCC#N)CC1	ZINC000819269817	CD	On-Demand	Mild	GPR119	31	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCC#N)CC1	ZINC000819269819	CD	On-Demand	Mild	GPR119	31	42
CCN1CCCC[C@@H]1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819269828	FF	On-Demand	Mild	PAPA1_CARPA	38	49
CCN1CCCC[C@H]1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819269829	FF	On-Demand	Mild	PAPA1_CARPA	38	49
CCN1CCCC[C@@H]1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819269831	FF	On-Demand	Mild	PAPA1_CARPA	38	49
CCN1CCCC[C@H]1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819269833	FF	On-Demand	Mild	PAPA1_CARPA	38	49
N#CCCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819269842	BD	On-Demand	Mild	CTSV	33	44
O=C(COc1ccc(-c2ccccc2)cc1)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819269843	FH	On-Demand	Anodyne	CPT1A	131	41
O=C(COc1ccc(-c2ccccc2)cc1)N1C[C@]2(CCCO2)[C@H]1C1CC1	ZINC000819269843	FH	On-Demand	Anodyne	CPT2	48	39
O=C(COc1ccc(-c2ccccc2)cc1)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819269844	FH	On-Demand	Anodyne	CPT1A	131	41
O=C(COc1ccc(-c2ccccc2)cc1)N1C[C@@]2(CCCO2)[C@@H]1C1CC1	ZINC000819269844	FH	On-Demand	Anodyne	CPT2	48	39
N#CCCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819269845	BD	On-Demand	Mild	CTSV	33	44
O=C(COc1ccc(-c2ccccc2)cc1)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819269846	FH	On-Demand	Anodyne	CPT1A	131	41
O=C(COc1ccc(-c2ccccc2)cc1)N1C[C@@]2(CCCO2)[C@H]1C1CC1	ZINC000819269846	FH	On-Demand	Anodyne	CPT2	48	39
O=C(COc1ccc(-c2ccccc2)cc1)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819269847	FH	On-Demand	Anodyne	CPT1A	131	41
O=C(COc1ccc(-c2ccccc2)cc1)N1C[C@]2(CCCO2)[C@@H]1C1CC1	ZINC000819269847	FH	On-Demand	Anodyne	CPT2	48	39
C[C@@H](CNC(=O)OC(C)(C)C)N(C)C(=O)CCc1cccc(OC(F)F)c1	ZINC000819269875	GH	On-Demand	Anodyne	MTNR1A	17	40
C[C@@H](CNC(=O)OC(C)(C)C)N(C)C(=O)CCc1cccc(OC(F)F)c1	ZINC000819269875	GH	On-Demand	Anodyne	MTNR1B	15	40
C[C@@H](CNC(=O)OC(C)(C)C)N(C)C(=O)CCc1cccc(OC(F)F)c1	ZINC000819269875	GH	On-Demand	Anodyne	CRTM	41	36
C[C@@H](CNC(=O)OC(C)(C)C)N(C)C(=O)CCc1cccc(OC(F)F)c1	ZINC000819269875	GH	On-Demand	Anodyne	PDS	44	33
N#CCCNC[C@H](O)Cc1ccc(F)cc1	ZINC000819269882	BD	On-Demand	Mild	ADRB1	24	42
N#CCCNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819269884	BD	On-Demand	Mild	ADRB1	24	42
CC(=O)CCc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269885	CD	On-Demand	Mild	ADRB2	59	55
CC(=O)CCc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269885	CD	On-Demand	Mild	ADRB1	98	55
CC(=O)CCc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269885	CD	On-Demand	Mild	GRIN1	23	48
CC(=O)CCc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269885	CD	On-Demand	Mild	ADRB3	63	55
CC(=O)CCc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269885	CD	On-Demand	Mild	CASR	40	37
CC(=O)CCc1ccc(OC[C@@H](O)CNCCC#N)cc1	ZINC000819269885	CD	On-Demand	Mild	ABCB1	26	49
CC(=O)CCc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269887	CD	On-Demand	Mild	ADRB2	59	55
CC(=O)CCc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269887	CD	On-Demand	Mild	ADRB1	98	55
CC(=O)CCc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269887	CD	On-Demand	Mild	GRIN1	23	48
CC(=O)CCc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269887	CD	On-Demand	Mild	ADRB3	63	55
CC(=O)CCc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269887	CD	On-Demand	Mild	CASR	40	37
CC(=O)CCc1ccc(OC[C@H](O)CNCCC#N)cc1	ZINC000819269887	CD	On-Demand	Mild	ABCB1	26	49
N#CCCNC[C@H](O)COc1ccccc1Cl	ZINC000819269892	CD	On-Demand	Mild	ADRB2	42	59
N#CCCNC[C@H](O)COc1ccccc1Cl	ZINC000819269892	CD	On-Demand	Mild	ADRB1	70	47
N#CCCNC[C@H](O)COc1ccccc1Cl	ZINC000819269892	CD	On-Demand	Mild	ADRB3	26	41
N#CCCNC[C@H](O)COc1ccccc1Cl	ZINC000819269892	CD	On-Demand	Mild	CASR	42	44
N#CCCNC[C@H](O)COc1ccccc1Cl	ZINC000819269892	CD	On-Demand	Mild	CYP2D6	18	44
N#CCCNC[C@H](O)COc1ccccc1Cl	ZINC000819269892	CD	On-Demand	Mild	ABCB1	17	41
N#CCCNC[C@@H](O)COc1ccccc1Cl	ZINC000819269897	CD	On-Demand	Mild	ADRB2	42	59
N#CCCNC[C@@H](O)COc1ccccc1Cl	ZINC000819269897	CD	On-Demand	Mild	ADRB1	70	47
N#CCCNC[C@@H](O)COc1ccccc1Cl	ZINC000819269897	CD	On-Demand	Mild	ADRB3	26	41
N#CCCNC[C@@H](O)COc1ccccc1Cl	ZINC000819269897	CD	On-Demand	Mild	CASR	42	44
N#CCCNC[C@@H](O)COc1ccccc1Cl	ZINC000819269897	CD	On-Demand	Mild	CYP2D6	18	44
N#CCCNC[C@@H](O)COc1ccccc1Cl	ZINC000819269897	CD	On-Demand	Mild	ABCB1	17	41
Cc1ccccc1[C@@H](OC[C@@H](O)CNCCC#N)c1ccccc1	ZINC000819269907	DF	On-Demand	Mild	CASR	19	40
Cc1ccccc1[C@@H](OC[C@H](O)CNCCC#N)c1ccccc1	ZINC000819269909	DF	On-Demand	Mild	CASR	19	40
N#CCCNC[C@@H](O)COCc1ccccc1Cl	ZINC000819269912	CD	On-Demand	Mild	ADRB1	41	32
N#CCCNC[C@H](O)COCc1ccccc1Cl	ZINC000819269917	CD	On-Demand	Mild	ADRB1	41	32
Cc1cscc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819269918	CH	On-Demand	Anodyne	ADRB1	39	48
Cc1cscc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819269918	CH	On-Demand	Anodyne	ADRB3	55	48
Cc1cscc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819269922	CH	On-Demand	Anodyne	ADRB1	39	48
Cc1cscc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819269922	CH	On-Demand	Anodyne	ADRB3	55	48
Cc1cscc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819269954	CF	On-Demand	Bother	CACNA1C	49	35
Cc1cscc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819269954	CF	On-Demand	Bother	CACNA1D	77	34
Cc1cscc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819269955	CF	On-Demand	Bother	CACNA1C	49	35
Cc1cscc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819269955	CF	On-Demand	Bother	CACNA1D	77	34
N#CCCNCCC(=O)Nc1cccc(Br)c1	ZINC000819269957	CE	On-Demand	Mild	EGFR	29	45
N#CCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819269958	CE	On-Demand	Mild	ADRB2	46	45
N#CCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819269958	CE	On-Demand	Mild	ADRB1	74	45
N#CCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819269958	CE	On-Demand	Mild	GRIN1	30	50
N#CCCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819269958	CE	On-Demand	Mild	ADRB3	40	46
N#CCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819269960	CE	On-Demand	Mild	ADRB2	46	45
N#CCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819269960	CE	On-Demand	Mild	ADRB1	74	45
N#CCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819269960	CE	On-Demand	Mild	GRIN1	30	50
N#CCCNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819269960	CE	On-Demand	Mild	ADRB3	40	46
CN(C)CCOc1ccc(N(C)C(=O)/C=C\[C@H]2CCCO2)cc1	ZINC000819269962	DE	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1ccc(N(C)C(=O)/C=C/[C@@H]2CCCO2)cc1	ZINC000819269963	DE	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1ccc(N(C)C(=O)/C=C/[C@H]2CCCO2)cc1	ZINC000819269965	DE	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1ccc(N(C)C(=O)/C=C\[C@@H]2CCCO2)cc1	ZINC000819269967	DE	On-Demand	Anodyne	ESRRG	44	33
Cc1cscc1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819269968	FG	On-Demand	Anodyne	GPR119	45	48
Cc1cscc1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819269969	FG	On-Demand	Anodyne	GPR119	45	48
N#CCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819269998	CD	On-Demand	Mild	ADRB2	29	63
N#CCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819269998	CD	On-Demand	Mild	ADRB1	70	63
N#CCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819269998	CD	On-Demand	Mild	ADRB3	18	63
N#CCCNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819269998	CD	On-Demand	Mild	CYP2D6	19	44
N#CCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819270001	CD	On-Demand	Mild	ADRB2	29	63
N#CCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819270001	CD	On-Demand	Mild	ADRB1	70	63
N#CCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819270001	CD	On-Demand	Mild	ADRB3	18	63
N#CCCNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819270001	CD	On-Demand	Mild	CYP2D6	19	44
N#CCCNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819270069	CF	On-Demand	Mild	KDR	15	40
N#CCCNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819270069	CF	On-Demand	Mild	KCNK3	19	40
N#CCCNC[C@@H](O)COc1cccc(Br)c1	ZINC000819270091	CD	On-Demand	Mild	ADRB2	41	46
N#CCCNC[C@@H](O)COc1cccc(Br)c1	ZINC000819270091	CD	On-Demand	Mild	ADRB1	65	43
N#CCCNC[C@@H](O)COc1cccc(Br)c1	ZINC000819270091	CD	On-Demand	Mild	ADRB3	35	43
N#CCCNC[C@H](O)COc1cccc(Br)c1	ZINC000819270092	CD	On-Demand	Mild	ADRB2	41	46
N#CCCNC[C@H](O)COc1cccc(Br)c1	ZINC000819270092	CD	On-Demand	Mild	ADRB1	65	43
N#CCCNC[C@H](O)COc1cccc(Br)c1	ZINC000819270092	CD	On-Demand	Mild	ADRB3	35	43
CC[C@@H](C(=O)NNC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2)c1ccccc1	ZINC000819270121	FE	On-Demand	Reactive	KCNQ2	40	38
CC[C@@H](C(=O)NNC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2)c1ccccc1	ZINC000819270123	FE	On-Demand	Reactive	KCNQ2	40	38
C[C@@H]1C[C@H](NC[C@@H](O)COc2ccccc2Cl)CCN1C(=O)OC(C)(C)C	ZINC000819270136	GG	On-Demand	Anodyne	ADRB2	30	46
C[C@@H]1C[C@H](NC[C@@H](O)COc2ccccc2Cl)CCN1C(=O)OC(C)(C)C	ZINC000819270136	GG	On-Demand	Anodyne	ADRB1	27	46
C[C@@H]1C[C@H](NC[C@@H](O)COc2ccccc2Cl)CCN1C(=O)OC(C)(C)C	ZINC000819270136	GG	On-Demand	Anodyne	ADRB3	28	42
C[C@@H]1C[C@H](NC[C@@H](O)COc2ccccc2Cl)CCN1C(=O)OC(C)(C)C	ZINC000819270136	GG	On-Demand	Anodyne	ABCB1	24	40
C[C@@H]1C[C@H](NC[C@H](O)COc2ccccc2Cl)CCN1C(=O)OC(C)(C)C	ZINC000819270139	GG	On-Demand	Anodyne	ADRB2	30	46
C[C@@H]1C[C@H](NC[C@H](O)COc2ccccc2Cl)CCN1C(=O)OC(C)(C)C	ZINC000819270139	GG	On-Demand	Anodyne	ADRB1	27	46
C[C@@H]1C[C@H](NC[C@H](O)COc2ccccc2Cl)CCN1C(=O)OC(C)(C)C	ZINC000819270139	GG	On-Demand	Anodyne	ADRB3	28	42
C[C@@H]1C[C@H](NC[C@H](O)COc2ccccc2Cl)CCN1C(=O)OC(C)(C)C	ZINC000819270139	GG	On-Demand	Anodyne	ABCB1	24	40
CC[C@@H](C(=O)NNC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2)c1ccccc1	ZINC000819270146	FD	On-Demand	Reactive	KCNQ2	40	38
CC[C@@H](C(=O)NNC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2)c1ccccc1	ZINC000819270148	FD	On-Demand	Reactive	KCNQ2	40	38
CC(=O)c1cccc(OC[C@H](O)CNCCC#N)c1	ZINC000819270152	CD	On-Demand	Mild	ADRB2	54	51
CC(=O)c1cccc(OC[C@H](O)CNCCC#N)c1	ZINC000819270152	CD	On-Demand	Mild	ADRB1	85	46
CC(=O)c1cccc(OC[C@H](O)CNCCC#N)c1	ZINC000819270152	CD	On-Demand	Mild	ADRB3	51	45
CC(=O)c1cccc(OC[C@H](O)CNCCC#N)c1	ZINC000819270152	CD	On-Demand	Mild	CASR	40	35
CC(=O)c1cccc(OC[C@H](O)CNCCC#N)c1	ZINC000819270152	CD	On-Demand	Mild	ABCB1	25	52
CC(=O)c1cccc(OC[C@H](O)CNCCC#N)c1	ZINC000819270152	CD	On-Demand	Mild	PDS	50	37
CC(=O)c1cccc(OC[C@@H](O)CNCCC#N)c1	ZINC000819270154	CD	On-Demand	Mild	ADRB2	54	51
CC(=O)c1cccc(OC[C@@H](O)CNCCC#N)c1	ZINC000819270154	CD	On-Demand	Mild	ADRB1	85	46
CC(=O)c1cccc(OC[C@@H](O)CNCCC#N)c1	ZINC000819270154	CD	On-Demand	Mild	ADRB3	51	45
CC(=O)c1cccc(OC[C@@H](O)CNCCC#N)c1	ZINC000819270154	CD	On-Demand	Mild	CASR	40	35
CC(=O)c1cccc(OC[C@@H](O)CNCCC#N)c1	ZINC000819270154	CD	On-Demand	Mild	ABCB1	25	52
CC(=O)c1cccc(OC[C@@H](O)CNCCC#N)c1	ZINC000819270154	CD	On-Demand	Mild	PDS	50	37
N#CCCNC[C@@H](O)COCc1ccccc1F	ZINC000819270156	CD	On-Demand	Mild	ADRB1	44	42
N#CCCNC[C@H](O)COCc1ccccc1F	ZINC000819270161	CD	On-Demand	Mild	ADRB1	44	42
COc1cccc([S@](=O)CC(=O)N(C)c2ccc(OCCN(C)C)cc2)c1	ZINC000819270184	GE	On-Demand	Anodyne	ESRRG	47	34
COc1cccc([S@@](=O)CC(=O)N(C)c2ccc(OCCN(C)C)cc2)c1	ZINC000819270186	GE	On-Demand	Anodyne	ESRRG	47	34
CN(CCC(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1)C(=O)OCc1ccccc1	ZINC000819270211	FF	On-Demand	Anodyne	PREP	45	34
CN(CCC(=O)N1C[C@@]2(CCCO2)[C@H]1C1CC1)C(=O)OCc1ccccc1	ZINC000819270211	FF	On-Demand	Anodyne	SLC12A5	66	38
CN(CCC(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1)C(=O)OCc1ccccc1	ZINC000819270213	FF	On-Demand	Anodyne	PREP	45	34
CN(CCC(=O)N1C[C@@]2(CCCO2)[C@@H]1C1CC1)C(=O)OCc1ccccc1	ZINC000819270213	FF	On-Demand	Anodyne	SLC12A5	66	38
CN(CCC(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1)C(=O)OCc1ccccc1	ZINC000819270214	FF	On-Demand	Anodyne	PREP	45	34
CN(CCC(=O)N1C[C@]2(CCCO2)[C@@H]1C1CC1)C(=O)OCc1ccccc1	ZINC000819270214	FF	On-Demand	Anodyne	SLC12A5	66	38
CN(CCC(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1)C(=O)OCc1ccccc1	ZINC000819270216	FF	On-Demand	Anodyne	PREP	45	34
CN(CCC(=O)N1C[C@]2(CCCO2)[C@H]1C1CC1)C(=O)OCc1ccccc1	ZINC000819270216	FF	On-Demand	Anodyne	SLC12A5	66	38
O=C(/C=C/[C@@H]1CCCO1)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000819270291	EG	On-Demand	Anodyne	DRD2	18	44
O=C(/C=C/[C@@H]1CCCO1)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000819270291	EG	On-Demand	Anodyne	KCNH2	34	42
O=C(/C=C\[C@@H]1CCCO1)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000819270292	EG	On-Demand	Anodyne	DRD2	18	44
O=C(/C=C\[C@@H]1CCCO1)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000819270292	EG	On-Demand	Anodyne	KCNH2	34	42
O=C(/C=C\[C@H]1CCCO1)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000819270293	EG	On-Demand	Anodyne	DRD2	18	44
O=C(/C=C\[C@H]1CCCO1)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000819270293	EG	On-Demand	Anodyne	KCNH2	34	42
O=C(/C=C/[C@H]1CCCO1)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000819270294	EG	On-Demand	Anodyne	DRD2	18	44
O=C(/C=C/[C@H]1CCCO1)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000819270294	EG	On-Demand	Anodyne	KCNH2	34	42
N#CCCNC[C@@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819270296	EF	On-Demand	Mild	ADRB1	45	40
N#CCCNC[C@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819270298	EF	On-Demand	Mild	ADRB1	45	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	CA2	17	45
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	PPIA	55	63
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	CA1	51	45
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	TRPV1	20	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	CPT1A	45	34
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	PRNP	39	55
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	GRM4	60	44
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	GRM5	15	43
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	MAPK10	18	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	EPHX2	19	50
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	PLAU	15	45
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	CA12	31	49
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	FLT3	27	44
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	TYK2	29	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	CSF1R	27	45
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	CA9	31	45
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	KLK1	19	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	TAAR1	35	55
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	NR2E3	63	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	NCE103	24	45
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	SHH	37	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	SMO	29	47
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	MTCA1	29	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	P96878_MYCTU	37	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	KCNK3	145	56
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc(Cl)c2)c1	ZINC000819270370	HK	On-Demand	Anodyne	KCNK9	93	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCNC(=O)c1cccc(F)c1)C2	ZINC000819270377	GD	On-Demand	Anodyne	DRD4	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCNC(=O)c1cccc(F)c1)C2	ZINC000819270377	GD	On-Demand	Anodyne	CCR2	53	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCNC(=O)c1cccc(F)c1)C2	ZINC000819270378	GD	On-Demand	Anodyne	DRD4	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCNC(=O)c1cccc(F)c1)C2	ZINC000819270378	GD	On-Demand	Anodyne	CCR2	53	36
N#CCCNC[C@@H](O)c1cccc(F)c1	ZINC000819270385	BD	On-Demand	Mild	ADRB2	18	42
N#CCCNC[C@@H](O)c1cccc(F)c1	ZINC000819270385	BD	On-Demand	Mild	ADRB1	24	43
N#CCCNC[C@@H](O)c1cccc(F)c1	ZINC000819270385	BD	On-Demand	Mild	ADRB3	32	43
N#CCCNC[C@H](O)c1cccc(F)c1	ZINC000819270386	BD	On-Demand	Mild	ADRB2	18	42
N#CCCNC[C@H](O)c1cccc(F)c1	ZINC000819270386	BD	On-Demand	Mild	ADRB1	24	43
N#CCCNC[C@H](O)c1cccc(F)c1	ZINC000819270386	BD	On-Demand	Mild	ADRB3	32	43
O=C(NCCCNC(=O)c1cccc(F)c1)C(F)=C1CCC1	ZINC000819270387	DE	On-Demand	Anodyne	DRD4	42	32
COCCN(Cc1ccc2c(c1)OCO2)C(=O)C(F)=C1CCC1	ZINC000819270393	DF	On-Demand	Anodyne	BMP1	63	38
CC[C@@H](C(=O)NNC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819270395	FE	On-Demand	Reactive	KCNQ2	41	39
CC[C@@H](C(=O)NNC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819270395	FE	On-Demand	Reactive	FPR1	42	34
CC(=O)Nc1cccc(CC(=O)Oc2ccc(NC(=O)C3CCCCC3)cc2)c1	ZINC000819270416	GI	On-Demand	Anodyne	TSHR	60	33
CC(=O)Nc1cccc(CC(=O)Oc2ccc(NC(=O)C3CCCCC3)cc2)c1	ZINC000819270416	GI	On-Demand	Anodyne	MTNR1A	20	45
CC(=O)Nc1cccc(CC(=O)Oc2ccc(NC(=O)C3CCCCC3)cc2)c1	ZINC000819270416	GI	On-Demand	Anodyne	MTNR1B	18	45
CC(=O)Nc1cccc(CC(=O)Oc2ccc(NC(=O)C3CCCCC3)cc2)c1	ZINC000819270416	GI	On-Demand	Anodyne	FAAH	21	44
CC(=O)Nc1cccc(CC(=O)Oc2ccc(NC(=O)C3CCCCC3)cc2)c1	ZINC000819270416	GI	On-Demand	Anodyne	EPHX2	20	43
N#CCCNC[C@@H](O)COCc1ccc(Cl)cc1	ZINC000819270417	CD	On-Demand	Mild	ADRB1	27	40
N#CCCNC[C@@H](O)COCc1ccc(Cl)cc1	ZINC000819270417	CD	On-Demand	Mild	ADRB3	17	40
N#CCCNC[C@H](O)COCc1ccc(Cl)cc1	ZINC000819270418	CD	On-Demand	Mild	ADRB1	27	40
N#CCCNC[C@H](O)COCc1ccc(Cl)cc1	ZINC000819270418	CD	On-Demand	Mild	ADRB3	17	40
O=[N+]([O-])c1cc(CNC[C@H](O)c2ccccc2)cc(C(F)(F)F)c1	ZINC000819270434	EG	On-Demand	Bother	TACR1	24	46
O=[N+]([O-])c1cc(CNC[C@H](O)c2ccccc2)cc(C(F)(F)F)c1	ZINC000819270434	EG	On-Demand	Bother	CCR2	16	42
O=[N+]([O-])c1cc(CNC[C@@H](O)c2ccccc2)cc(C(F)(F)F)c1	ZINC000819270435	EG	On-Demand	Bother	TACR1	24	46
O=[N+]([O-])c1cc(CNC[C@@H](O)c2ccccc2)cc(C(F)(F)F)c1	ZINC000819270435	EG	On-Demand	Bother	CCR2	16	42
C[C@@H]1C[C@H](NC[C@@H](O)COc2ccc(F)cc2)CCN1C(=O)OC(C)(C)C	ZINC000819270446	GF	On-Demand	Anodyne	ADRB2	28	41
C[C@@H]1C[C@H](NC[C@@H](O)COc2ccc(F)cc2)CCN1C(=O)OC(C)(C)C	ZINC000819270446	GF	On-Demand	Anodyne	ADRB1	41	41
C[C@@H]1C[C@H](NC[C@@H](O)COc2ccc(F)cc2)CCN1C(=O)OC(C)(C)C	ZINC000819270446	GF	On-Demand	Anodyne	ADRB3	30	42
C[C@@H]1C[C@H](NC[C@H](O)COc2ccc(F)cc2)CCN1C(=O)OC(C)(C)C	ZINC000819270448	GF	On-Demand	Anodyne	ADRB2	28	41
C[C@@H]1C[C@H](NC[C@H](O)COc2ccc(F)cc2)CCN1C(=O)OC(C)(C)C	ZINC000819270448	GF	On-Demand	Anodyne	ADRB1	41	41
C[C@@H]1C[C@H](NC[C@H](O)COc2ccc(F)cc2)CCN1C(=O)OC(C)(C)C	ZINC000819270448	GF	On-Demand	Anodyne	ADRB3	30	42
N#CCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819270455	CD	On-Demand	Mild	ADRB2	37	45
N#CCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819270455	CD	On-Demand	Mild	ADRB1	70	46
N#CCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819270455	CD	On-Demand	Mild	ADRB3	20	42
N#CCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819270455	CD	On-Demand	Mild	CASR	41	39
N#CCCNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819270455	CD	On-Demand	Mild	CYP2D6	19	40
N#CCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819270456	CD	On-Demand	Mild	ADRB2	37	45
N#CCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819270456	CD	On-Demand	Mild	ADRB1	70	46
N#CCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819270456	CD	On-Demand	Mild	ADRB3	20	42
N#CCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819270456	CD	On-Demand	Mild	CASR	41	39
N#CCCNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819270456	CD	On-Demand	Mild	CYP2D6	19	40
CC(=O)Nc1cccc(CC(=O)N(C)c2ccc(OCCN(C)C)cc2)c1	ZINC000819270459	FF	On-Demand	Anodyne	LTA4H	23	42
CC(=O)Nc1cccc(CC(=O)N(C)c2ccc(OCCN(C)C)cc2)c1	ZINC000819270459	FF	On-Demand	Anodyne	ESRRG	44	33
CN1CCN(C)[C@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819270507	FC	On-Demand	Mild	PAPA1_CARPA	38	49
CN1CCN(C)[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819270508	FC	On-Demand	Mild	PAPA1_CARPA	38	49
CN1CCN(C)[C@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819270509	FC	On-Demand	Mild	PAPA1_CARPA	38	49
CN1CCN(C)[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819270510	FC	On-Demand	Mild	PAPA1_CARPA	38	49
O=C(Cc1ccc(-n2cnnc2)cc1)NNC(=O)C1CCC1	ZINC000819270520	CC	On-Demand	Reactive	HTR1D	43	37
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCc3cc(C#N)ccc32)CC1	ZINC000819270547	GG	On-Demand	Mild	GPR119	35	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCc3cc(C#N)ccc32)CC1	ZINC000819270548	GG	On-Demand	Mild	GPR119	35	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCc3cc(C#N)ccc32)CC1	ZINC000819270549	GG	On-Demand	Mild	GPR119	35	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCc3cc(C#N)ccc32)CC1	ZINC000819270550	GG	On-Demand	Mild	GPR119	35	42
O=C(COc1ccc2ccc(=O)oc2c1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270567	II	On-Demand	Anodyne	MAOA	33	41
O=C(COc1ccc2ccc(=O)oc2c1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270567	II	On-Demand	Anodyne	MAOB	41	52
O=C(COc1ccc2ccc(=O)oc2c1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270567	II	On-Demand	Anodyne	LPL	44	34
O=C(COc1ccc2ccc(=O)oc2c1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270567	II	On-Demand	Anodyne	CA1	37	42
O=C(COc1ccc2ccc(=O)oc2c1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270567	II	On-Demand	Anodyne	CA12	15	42
O=C(COc1ccc2ccc(=O)oc2c1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270567	II	On-Demand	Anodyne	CA9	15	42
CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819270583	FG	On-Demand	Mild	PAPA1_CARPA	40	44
CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819270583	FG	On-Demand	Mild	FPR1	42	36
CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819270584	FG	On-Demand	Mild	PAPA1_CARPA	40	44
CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819270584	FG	On-Demand	Mild	FPR1	42	36
O=C1CCCN1C[C@H]1CCCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819270594	FD	On-Demand	Anodyne	OPRK1	22	52
O=C1CCCN1C[C@@H]1CCCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819270595	FD	On-Demand	Anodyne	OPRK1	22	52
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819270597	FE	On-Demand	Anodyne	SIGMAR1	16	42
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819270597	FE	On-Demand	Anodyne	CCR3	34	40
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819270597	FE	On-Demand	Anodyne	CCR2	20	41
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819270597	FE	On-Demand	Anodyne	EPHX2	31	43
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819270597	FE	On-Demand	Anodyne	MCHR1	26	40
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819270597	FE	On-Demand	Anodyne	CCR8	37	40
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819270597	FE	On-Demand	Anodyne	GPR119	43	50
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819270597	FE	On-Demand	Anodyne	SFRP1	43	41
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819270598	FE	On-Demand	Anodyne	SIGMAR1	16	42
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819270598	FE	On-Demand	Anodyne	CCR3	34	40
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819270598	FE	On-Demand	Anodyne	CCR2	20	41
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819270598	FE	On-Demand	Anodyne	EPHX2	31	43
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819270598	FE	On-Demand	Anodyne	MCHR1	26	40
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819270598	FE	On-Demand	Anodyne	CCR8	37	40
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819270598	FE	On-Demand	Anodyne	GPR119	43	50
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819270598	FE	On-Demand	Anodyne	SFRP1	43	41
O[C@@H](CN[C@H]1[C@H]2CCC[C@H]21)c1ccccc1Cl	ZINC000819270601	CF	On-Demand	Anodyne	OPRL1	42	40
O[C@@H](CN[C@@H]1[C@H]2CCC[C@H]21)c1ccccc1Cl	ZINC000819270602	CF	On-Demand	Anodyne	OPRL1	42	40
O=C(C[C@@H]1OC(=O)c2ccccc21)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270656	HJ	On-Demand	Anodyne	CCKBR	45	34
O=C(C[C@@H]1OC(=O)c2ccccc21)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270656	HJ	On-Demand	Anodyne	KCNK3	45	33
O=C(C[C@H]1OC(=O)c2ccccc21)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270657	HJ	On-Demand	Anodyne	CCKBR	45	34
O=C(C[C@H]1OC(=O)c2ccccc21)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270657	HJ	On-Demand	Anodyne	KCNK3	45	33
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)Cc2nsc3ccccc23)C1	ZINC000819270662	FF	On-Demand	Anodyne	CCR8	77	43
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)Cc2nsc3ccccc23)C1	ZINC000819270662	FF	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)Cc2nsc3ccccc23)C1	ZINC000819270663	FF	On-Demand	Anodyne	CCR8	77	43
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)Cc2nsc3ccccc23)C1	ZINC000819270663	FF	On-Demand	Anodyne	GPR119	41	41
CS(=O)(=O)c1cccnc1CNC[C@H](O)c1ccccc1	ZINC000819270695	DD	On-Demand	Anodyne	ADRB3	57	38
CS(=O)(=O)c1cccnc1CNC[C@@H](O)c1ccccc1	ZINC000819270696	DD	On-Demand	Anodyne	ADRB3	57	38
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819270708	FF	On-Demand	Anodyne	INHA	60	34
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819270708	FF	On-Demand	Anodyne	CCR8	94	47
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819270708	FF	On-Demand	Anodyne	SFRP1	53	40
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819270709	FF	On-Demand	Anodyne	INHA	60	34
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819270709	FF	On-Demand	Anodyne	CCR8	94	47
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819270709	FF	On-Demand	Anodyne	SFRP1	53	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270726	HJ	On-Demand	Anodyne	F2	40	41
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270726	HJ	On-Demand	Anodyne	ACE	25	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270726	HJ	On-Demand	Anodyne	LPL	50	36
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270726	HJ	On-Demand	Anodyne	ELANE	46	46
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270726	HJ	On-Demand	Anodyne	CMA1	43	44
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270726	HJ	On-Demand	Anodyne	CTRA_BOVIN	23	43
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270726	HJ	On-Demand	Anodyne	CCKAR	34	44
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270726	HJ	On-Demand	Anodyne	PREP	63	46
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270726	HJ	On-Demand	Anodyne	LGMN	65	37
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270726	HJ	On-Demand	Anodyne	CCKBR	52	44
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270726	HJ	On-Demand	Anodyne	CFTR	56	36
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270726	HJ	On-Demand	Anodyne	EPHX2	39	41
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270726	HJ	On-Demand	Anodyne	SFRP1	49	44
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270726	HJ	On-Demand	Anodyne	WNT3	57	44
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270726	HJ	On-Demand	Anodyne	BRCA1	51	31
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819270726	HJ	On-Demand	Anodyne	KCNK3	47	41
O=C1CCCN1C[C@@H]1CCCCN1C(=O)c1coc(=O)c2ccccc12	ZINC000819270755	FE	On-Demand	Anodyne	HCRTR1	20	41
O=C1CCCN1C[C@H]1CCCCN1C(=O)c1coc(=O)c2ccccc12	ZINC000819270756	FE	On-Demand	Anodyne	HCRTR1	20	41
O[C@@H](CN[C@H]1[C@H]2CCC[C@H]21)c1ccc(F)cc1	ZINC000819270799	BE	On-Demand	Anodyne	SLC6A3	15	47
O[C@@H](CN[C@@H]1[C@H]2CCC[C@H]21)c1ccc(F)cc1	ZINC000819270800	BE	On-Demand	Anodyne	SLC6A3	15	47
O[C@H](CN[C@@H]1[C@H]2CCC[C@H]21)c1ccc(F)cc1	ZINC000819270801	BE	On-Demand	Anodyne	SLC6A3	15	47
O[C@H](CN[C@H]1[C@H]2CCC[C@H]21)c1ccc(F)cc1	ZINC000819270802	BE	On-Demand	Anodyne	SLC6A3	15	47
CC(=O)Nc1cccc(CC(=O)N2[C@H](C)CO[C@H](c3ccccc3)[C@H]2C)c1	ZINC000819270803	FH	On-Demand	Anodyne	TSHR	42	31
CC(=O)Nc1cccc(CC(=O)N2[C@H](C)CO[C@H](c3ccccc3)[C@H]2C)c1	ZINC000819270803	FH	On-Demand	Anodyne	MCHR1	21	40
CC(=O)Nc1cccc(CC(=O)N2[C@@H](C)[C@@H](c3ccccc3)OC[C@H]2C)c1	ZINC000819270804	FH	On-Demand	Anodyne	TSHR	42	31
CC(=O)Nc1cccc(CC(=O)N2[C@@H](C)[C@@H](c3ccccc3)OC[C@H]2C)c1	ZINC000819270804	FH	On-Demand	Anodyne	MCHR1	21	40
CC(=O)Nc1cccc(CC(=O)N2[C@H](C)CO[C@@H](c3ccccc3)[C@H]2C)c1	ZINC000819270805	FH	On-Demand	Anodyne	TSHR	42	31
CC(=O)Nc1cccc(CC(=O)N2[C@H](C)CO[C@@H](c3ccccc3)[C@H]2C)c1	ZINC000819270805	FH	On-Demand	Anodyne	MCHR1	21	40
CC(=O)Nc1cccc(CC(=O)N2[C@@H](C)[C@H](c3ccccc3)OC[C@H]2C)c1	ZINC000819270806	FH	On-Demand	Anodyne	TSHR	42	31
CC(=O)Nc1cccc(CC(=O)N2[C@@H](C)[C@H](c3ccccc3)OC[C@H]2C)c1	ZINC000819270806	FH	On-Demand	Anodyne	MCHR1	21	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	CELA1	17	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	CTSD	134	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	PGC	72	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	CMA1	34	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	CTRA_BOVIN	24	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	PAPA1_CARPA	46	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	CCKAR	43	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	CTSK	19	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	CTSL	28	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	CACNA1B	35	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	PGA	56	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	BACE2	56	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	TIMP3	50	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	TACR3	16	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	REN	125	51
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	REN1	46	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	CAPN1	34	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	BACE1	94	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	PGA5	40	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	FPR1	59	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	PLM1_PLAFA	36	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1[C@H]2CCC[C@H]21	ZINC000819270814	FF	On-Demand	Anodyne	PLM2_PLAFA	48	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	CELA1	17	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	CTSD	134	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	PGC	72	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	CMA1	34	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	CTRA_BOVIN	24	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	PAPA1_CARPA	46	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	CCKAR	43	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	CTSK	19	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	CTSL	28	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	CACNA1B	35	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	PGA	56	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	BACE2	56	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	TIMP3	50	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	TACR3	16	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	REN	125	51
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	REN1	46	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	CAPN1	34	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	BACE1	94	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	PGA5	40	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	FPR1	59	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	PLM1_PLAFA	36	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2CCC[C@H]21	ZINC000819270815	FF	On-Demand	Anodyne	PLM2_PLAFA	48	36
N#Cc1ccc2c(c1)CC[C@@H]2NC[C@@H](O)c1cccnc1	ZINC000819270820	CE	On-Demand	Mild	ADRB3	42	47
N#Cc1ccc2c(c1)CC[C@H]2NC[C@@H](O)c1cccnc1	ZINC000819270821	CE	On-Demand	Mild	ADRB3	42	47
N#Cc1ccc2c(c1)CC[C@@H]2NC[C@H](O)c1cccnc1	ZINC000819270822	CE	On-Demand	Mild	ADRB3	42	47
N#Cc1ccc2c(c1)CC[C@H]2NC[C@H](O)c1cccnc1	ZINC000819270823	CE	On-Demand	Mild	ADRB3	42	47
O=C(NCc1ccc(OCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819270829	EG	On-Demand	Anodyne	ESR1	85	39
O=C(NCc1ccc(OCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819270829	EG	On-Demand	Anodyne	KCNH2	15	41
O=C(NCc1ccc(OCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819270829	EG	On-Demand	Anodyne	ESR2	60	40
O=C(NCc1ccc(OCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819270829	EG	On-Demand	Anodyne	LTA4H	71	51
O=C(NCc1ccc(OCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819270829	EG	On-Demand	Anodyne	HRH3	71	50
O=C(NCc1ccc(OCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819270829	EG	On-Demand	Anodyne	PSMB2	47	50
O=C(NCc1ccc(OCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819270829	EG	On-Demand	Anodyne	PSMB1	52	53
CC(=O)Nc1cccc(CC(=O)NNC(=O)C2CCC2)c1	ZINC000819270855	CD	On-Demand	Reactive	SIGMAR1	15	40
O[C@@H](CN[C@H]1[C@H]2CCC[C@H]21)c1cccc(Cl)c1	ZINC000819270860	CF	On-Demand	Anodyne	ADRB1	39	45
O[C@@H](CN[C@H]1[C@H]2CCC[C@H]21)c1cccc(Cl)c1	ZINC000819270860	CF	On-Demand	Anodyne	ADRB3	53	48
O[C@@H](CN[C@H]1[C@H]2CCC[C@H]21)c1cccc(Cl)c1	ZINC000819270860	CF	On-Demand	Anodyne	CYP3A4	45	36
O[C@@H](CN[C@@H]1[C@H]2CCC[C@H]21)c1cccc(Cl)c1	ZINC000819270861	CF	On-Demand	Anodyne	ADRB1	39	45
O[C@@H](CN[C@@H]1[C@H]2CCC[C@H]21)c1cccc(Cl)c1	ZINC000819270861	CF	On-Demand	Anodyne	ADRB3	53	48
O[C@@H](CN[C@@H]1[C@H]2CCC[C@H]21)c1cccc(Cl)c1	ZINC000819270861	CF	On-Demand	Anodyne	CYP3A4	45	36
O[C@H](CN[C@@H]1[C@H]2CCC[C@H]21)c1cccc(Cl)c1	ZINC000819270862	CF	On-Demand	Anodyne	ADRB1	39	45
O[C@H](CN[C@@H]1[C@H]2CCC[C@H]21)c1cccc(Cl)c1	ZINC000819270862	CF	On-Demand	Anodyne	ADRB3	53	48
O[C@H](CN[C@@H]1[C@H]2CCC[C@H]21)c1cccc(Cl)c1	ZINC000819270862	CF	On-Demand	Anodyne	CYP3A4	45	36
O[C@H](CN[C@H]1[C@H]2CCC[C@H]21)c1cccc(Cl)c1	ZINC000819270863	CF	On-Demand	Anodyne	ADRB1	39	45
O[C@H](CN[C@H]1[C@H]2CCC[C@H]21)c1cccc(Cl)c1	ZINC000819270863	CF	On-Demand	Anodyne	ADRB3	53	48
O[C@H](CN[C@H]1[C@H]2CCC[C@H]21)c1cccc(Cl)c1	ZINC000819270863	CF	On-Demand	Anodyne	CYP3A4	45	36
CS(=O)(=O)c1cccnc1CNC[C@H](O)c1cccc(F)c1	ZINC000819270864	DD	On-Demand	Anodyne	ADRB3	38	46
CS(=O)(=O)c1cccnc1CNC[C@@H](O)c1cccc(F)c1	ZINC000819270865	DD	On-Demand	Anodyne	ADRB3	38	46
CS(=O)(=O)c1cccnc1CNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819270878	GE	On-Demand	Anodyne	ADRB3	37	41
CS(=O)(=O)c1cccnc1CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819270879	GE	On-Demand	Anodyne	ADRB3	37	41
O[C@H](CNCc1cnc(N2CCOCC2)s1)Cc1cccc(Cl)c1	ZINC000819270880	FE	On-Demand	Anodyne	STAT6	20	40
O[C@@H](CNCc1cnc(N2CCOCC2)s1)Cc1cccc(Cl)c1	ZINC000819270881	FE	On-Demand	Anodyne	STAT6	20	40
O=C(NCCCCCN1CCCCC1)C(F)=C1CCC1	ZINC000819270882	CG	On-Demand	Anodyne	HNMT	40	34
C=CCCn1cc(C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C2CCCCC2)nn1	ZINC000819270895	GG	On-Demand	Mild	REN	49	38
C=CCCn1cc(C(=O)N[C@H](CNC(=O)OC(C)(C)C)C2CCCCC2)nn1	ZINC000819270896	GG	On-Demand	Mild	REN	49	38
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819270912	ED	On-Demand	Anodyne	GPR119	42	41
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819270913	ED	On-Demand	Anodyne	GPR119	42	41
CC(=O)Nc1cccc(CC(=O)N[C@@H](CNC(=O)OC(C)(C)C)CC(C)C)c1	ZINC000819270914	GG	On-Demand	Anodyne	PAPA1_CARPA	41	38
CC(=O)Nc1cccc(CC(=O)N[C@@H](CNC(=O)OC(C)(C)C)CC(C)C)c1	ZINC000819270914	GG	On-Demand	Anodyne	REN	33	43
CC(=O)Nc1cccc(CC(=O)N[C@@H](CNC(=O)OC(C)(C)C)CC(C)C)c1	ZINC000819270914	GG	On-Demand	Anodyne	CAPN2	60	33
CC(=O)Nc1cccc(CC(=O)N[C@@H](CNC(=O)OC(C)(C)C)CC(C)C)c1	ZINC000819270914	GG	On-Demand	Anodyne	FPR1	64	40
CC(=O)Nc1cccc(CC(=O)N[C@H](CNC(=O)OC(C)(C)C)CC(C)C)c1	ZINC000819270915	GG	On-Demand	Anodyne	PAPA1_CARPA	41	38
CC(=O)Nc1cccc(CC(=O)N[C@H](CNC(=O)OC(C)(C)C)CC(C)C)c1	ZINC000819270915	GG	On-Demand	Anodyne	REN	33	43
CC(=O)Nc1cccc(CC(=O)N[C@H](CNC(=O)OC(C)(C)C)CC(C)C)c1	ZINC000819270915	GG	On-Demand	Anodyne	CAPN2	60	33
CC(=O)Nc1cccc(CC(=O)N[C@H](CNC(=O)OC(C)(C)C)CC(C)C)c1	ZINC000819270915	GG	On-Demand	Anodyne	FPR1	64	40
O=C(NNC(=O)C1CCC1)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819270959	GF	On-Demand	Reactive	CNR1	58	36
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)C1	ZINC000819270973	GH	On-Demand	Anodyne	KCNQ2	40	33
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)C1	ZINC000819270974	GH	On-Demand	Anodyne	KCNQ2	40	33
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)C1	ZINC000819270975	GH	On-Demand	Anodyne	KCNQ2	40	33
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)C1	ZINC000819270976	GH	On-Demand	Anodyne	KCNQ2	40	33
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2CN2CCSCC2)C1	ZINC000819270977	EE	On-Demand	Anodyne	SLC6A1	79	34
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2CN2CCSCC2)C1	ZINC000819270977	EE	On-Demand	Anodyne	CCR3	22	48
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2CN2CCSCC2)C1	ZINC000819270978	EE	On-Demand	Anodyne	SLC6A1	79	34
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2CN2CCSCC2)C1	ZINC000819270978	EE	On-Demand	Anodyne	CCR3	22	48
O=C(O)[C@H]1CCN(C(=O)c2cc(F)cc(Cl)c2O)C1	ZINC000819270979	CD	On-Demand	Anodyne	SLC6A1	60	41
O=C(O)[C@@H]1CCN(C(=O)c2cc(F)cc(Cl)c2O)C1	ZINC000819270980	CD	On-Demand	Anodyne	SLC6A1	60	41
O=C(O)C1CCN(C(=O)c2cc(F)cc(Cl)c2O)CC1	ZINC000819270981	DE	On-Demand	Anodyne	AKR1C2	40	37
O=C(O)C1CCN(C(=O)c2cc(F)cc(Cl)c2O)CC1	ZINC000819270981	DE	On-Demand	Anodyne	AKR1C1	43	37
O=C(O)C1CCN(C(=O)c2cc(F)cc(Cl)c2O)CC1	ZINC000819270981	DE	On-Demand	Anodyne	L3MBTL3	51	36
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)C1	ZINC000819270986	FD	On-Demand	Anodyne	ST14	47	38
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)C1	ZINC000819270986	FD	On-Demand	Anodyne	CCR8	84	41
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)C1	ZINC000819270986	FD	On-Demand	Anodyne	SFRP1	142	43
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)C1	ZINC000819270986	FD	On-Demand	Anodyne	WNT3	94	43
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)C1	ZINC000819270987	FD	On-Demand	Anodyne	ST14	47	38
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)C1	ZINC000819270987	FD	On-Demand	Anodyne	CCR8	84	41
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)C1	ZINC000819270987	FD	On-Demand	Anodyne	SFRP1	142	43
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)NC3CC3)c2)C1	ZINC000819270987	FD	On-Demand	Anodyne	WNT3	94	43
O=C(O)[C@@H]1CCN(C(=O)N=c2cc[nH]cc2)C1	ZINC000819270990	BC	On-Demand	Anodyne	SLC6A1	108	35
O=C(O)[C@H]1CCN(C(=O)N=c2cc[nH]cc2)C1	ZINC000819270991	BC	On-Demand	Anodyne	SLC6A1	108	35
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	ACE	60	49
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	FKBP1A	81	45
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	SLC6A1	127	39
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	CELA1	28	64
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	GRIN2B	28	43
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	ELANE	26	41
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	CTRA_BOVIN	61	33
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	TRY1_BOVIN	53	33
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	CTSG	42	33
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	CCR5	18	41
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	CPT1A	40	43
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	CPT2	49	42
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	PREP	160	79
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	CELA2A	50	33
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	LGMN	85	51
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	KLK5	28	52
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	SFRP1	53	38
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	WNT3	57	38
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	SLC12A5	71	42
O=C(O)[C@@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270992	ED	On-Demand	Anodyne	TMPRSS11D	63	38
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	ACE	60	49
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	FKBP1A	81	45
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	SLC6A1	127	39
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	CELA1	28	64
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	GRIN2B	28	43
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	ELANE	26	41
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	CTRA_BOVIN	61	33
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	TRY1_BOVIN	53	33
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	CTSG	42	33
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	CCR5	18	41
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	CPT1A	40	43
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	CPT2	49	42
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	PREP	160	79
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	CELA2A	50	33
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	LGMN	85	51
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	KLK5	28	52
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	SFRP1	53	38
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	WNT3	57	38
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	SLC12A5	71	42
O=C(O)[C@H]1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819270993	ED	On-Demand	Anodyne	TMPRSS11D	63	38
O=C(O)C1CCN(C(=O)Nc2cccn(CC(F)(F)F)c2=O)CC1	ZINC000819270997	ED	On-Demand	Anodyne	RBP4	60	45
O=C(O)C1CCN(C(=O)Nc2cccn(CC(F)(F)F)c2=O)CC1	ZINC000819270997	ED	On-Demand	Anodyne	CALCRL	40	46
O=C(O)C1CCN(C(=O)c2cc(Cl)c3ccccc3c2O)CC1	ZINC000819270998	EG	On-Demand	Anodyne	SLC6A1	47	38
O=C(O)C1CCN(C(=O)c2cc(Cl)c3ccccc3c2O)CC1	ZINC000819270998	EG	On-Demand	Anodyne	L3MBTL3	62	45
O=C(O)[C@H]1CCN(C(=O)Nc2cccnc2OCc2ccccc2)C1	ZINC000819270999	EF	On-Demand	Anodyne	SLC6A1	56	35
O=C(O)[C@H]1CCN(C(=O)Nc2cccnc2OCc2ccccc2)C1	ZINC000819270999	EF	On-Demand	Anodyne	PPIA	39	41
O=C(O)[C@H]1CCN(C(=O)Nc2cccnc2OCc2ccccc2)C1	ZINC000819270999	EF	On-Demand	Anodyne	GRIN2B	28	44
O=C(O)[C@H]1CCN(C(=O)Nc2cccnc2OCc2ccccc2)C1	ZINC000819270999	EF	On-Demand	Anodyne	RBP4	52	36
O=C(O)[C@H]1CCN(C(=O)Nc2cccnc2OCc2ccccc2)C1	ZINC000819270999	EF	On-Demand	Anodyne	SCD	16	41
O=C(O)[C@@H]1CCN(C(=O)Nc2cccnc2OCc2ccccc2)C1	ZINC000819271000	EF	On-Demand	Anodyne	SLC6A1	56	35
O=C(O)[C@@H]1CCN(C(=O)Nc2cccnc2OCc2ccccc2)C1	ZINC000819271000	EF	On-Demand	Anodyne	PPIA	39	41
O=C(O)[C@@H]1CCN(C(=O)Nc2cccnc2OCc2ccccc2)C1	ZINC000819271000	EF	On-Demand	Anodyne	GRIN2B	28	44
O=C(O)[C@@H]1CCN(C(=O)Nc2cccnc2OCc2ccccc2)C1	ZINC000819271000	EF	On-Demand	Anodyne	RBP4	52	36
O=C(O)[C@@H]1CCN(C(=O)Nc2cccnc2OCc2ccccc2)C1	ZINC000819271000	EF	On-Demand	Anodyne	SCD	16	41
O=C(O)[C@@H]1CCN(C(=O)Nc2cnn(Cc3ccccn3)c2)C1	ZINC000819271001	DD	On-Demand	Anodyne	RPS6KA3	18	45
O=C(O)[C@@H]1CCN(C(=O)Nc2cnn(Cc3ccccn3)c2)C1	ZINC000819271001	DD	On-Demand	Anodyne	PANC	51	35
O=C(O)[C@H]1CCN(C(=O)Nc2cnn(Cc3ccccn3)c2)C1	ZINC000819271002	DD	On-Demand	Anodyne	RPS6KA3	18	45
O=C(O)[C@H]1CCN(C(=O)Nc2cnn(Cc3ccccn3)c2)C1	ZINC000819271002	DD	On-Demand	Anodyne	PANC	51	35
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2CN2C(=O)CCC2=O)C1	ZINC000819271004	ED	On-Demand	Anodyne	SLC6A1	60	32
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2CN2C(=O)CCC2=O)C1	ZINC000819271005	ED	On-Demand	Anodyne	SLC6A1	60	32
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000819271008	FG	On-Demand	Anodyne	MAOB	15	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000819271008	FG	On-Demand	Anodyne	SLC6A1	49	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000819271008	FG	On-Demand	Anodyne	PDGFRB	17	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000819271008	FG	On-Demand	Anodyne	DRTS_LEIMA	17	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000819271008	FG	On-Demand	Anodyne	CCR3	72	49
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000819271008	FG	On-Demand	Anodyne	GYS1	40	35
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000819271008	FG	On-Demand	Anodyne	FAAH	21	44
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000819271008	FG	On-Demand	Anodyne	EPHX2	35	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000819271008	FG	On-Demand	Anodyne	SCD1	17	41
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000819271009	FG	On-Demand	Anodyne	MAOB	15	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000819271009	FG	On-Demand	Anodyne	SLC6A1	49	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000819271009	FG	On-Demand	Anodyne	PDGFRB	17	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000819271009	FG	On-Demand	Anodyne	DRTS_LEIMA	17	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000819271009	FG	On-Demand	Anodyne	CCR3	72	49
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000819271009	FG	On-Demand	Anodyne	GYS1	40	35
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000819271009	FG	On-Demand	Anodyne	FAAH	21	44
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000819271009	FG	On-Demand	Anodyne	EPHX2	35	42
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)C1	ZINC000819271009	FG	On-Demand	Anodyne	SCD1	17	41
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(Oc3ccccn3)c2)C1	ZINC000819271010	EF	On-Demand	Anodyne	PDGFRB	42	43
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(Oc3ccccn3)c2)C1	ZINC000819271010	EF	On-Demand	Anodyne	FAAH	34	42
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(Oc3ccccn3)c2)C1	ZINC000819271010	EF	On-Demand	Anodyne	CFTR	17	41
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(Oc3ccccn3)c2)C1	ZINC000819271010	EF	On-Demand	Anodyne	EPHX2	32	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(Oc3ccccn3)c2)C1	ZINC000819271010	EF	On-Demand	Anodyne	LIMK2	44	47
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(Oc3ccccn3)c2)C1	ZINC000819271011	EF	On-Demand	Anodyne	PDGFRB	42	43
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(Oc3ccccn3)c2)C1	ZINC000819271011	EF	On-Demand	Anodyne	FAAH	34	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(Oc3ccccn3)c2)C1	ZINC000819271011	EF	On-Demand	Anodyne	CFTR	17	41
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(Oc3ccccn3)c2)C1	ZINC000819271011	EF	On-Demand	Anodyne	EPHX2	32	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(Oc3ccccn3)c2)C1	ZINC000819271011	EF	On-Demand	Anodyne	LIMK2	44	47
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(N3CCCCC3)c2)C1	ZINC000819271012	DF	On-Demand	Anodyne	SLC6A1	58	32
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(N3CCCCC3)c2)C1	ZINC000819271012	DF	On-Demand	Anodyne	MAPK1	20	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(N3CCCCC3)c2)C1	ZINC000819271013	DF	On-Demand	Anodyne	SLC6A1	58	32
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(N3CCCCC3)c2)C1	ZINC000819271013	DF	On-Demand	Anodyne	MAPK1	20	42
O=C(O)[C@@H]1CCN(C(=O)c2cc3c(cc2O)CCCC3)C1	ZINC000819271014	CD	On-Demand	Anodyne	L3MBTL3	55	36
O=C(O)[C@H]1CCN(C(=O)c2cc3c(cc2O)CCCC3)C1	ZINC000819271015	CD	On-Demand	Anodyne	L3MBTL3	55	36
O=C(O)[C@@H]1CCN(C(=O)c2cc3c(OC(F)F)cccc3[nH]2)C1	ZINC000819271022	DE	On-Demand	Anodyne	GRIN2B	28	48
O=C(O)[C@@H]1CCN(C(=O)c2cc3c(OC(F)F)cccc3[nH]2)C1	ZINC000819271022	DE	On-Demand	Anodyne	HRH4	20	48
O=C(O)[C@@H]1CCN(C(=O)c2cc3c(OC(F)F)cccc3[nH]2)C1	ZINC000819271022	DE	On-Demand	Anodyne	AKR1C3	17	41
O=C(O)[C@H]1CCN(C(=O)c2cc3c(OC(F)F)cccc3[nH]2)C1	ZINC000819271023	DE	On-Demand	Anodyne	GRIN2B	28	48
O=C(O)[C@H]1CCN(C(=O)c2cc3c(OC(F)F)cccc3[nH]2)C1	ZINC000819271023	DE	On-Demand	Anodyne	HRH4	20	48
O=C(O)[C@H]1CCN(C(=O)c2cc3c(OC(F)F)cccc3[nH]2)C1	ZINC000819271023	DE	On-Demand	Anodyne	AKR1C3	17	41
O=C(O)C1CCN(C(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)CC1	ZINC000819271024	GD	On-Demand	Anodyne	EPHX2	31	41
O=C(O)C1CCN(C(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)CC1	ZINC000819271024	GD	On-Demand	Anodyne	AKR1C3	25	47
O=C(O)C1CCN(C(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)CC1	ZINC000819271024	GD	On-Demand	Anodyne	SFRP1	36	40
O=C(O)C1CCN(C(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)CC1	ZINC000819271024	GD	On-Demand	Anodyne	L3MBTL3	75	47
O=C(O)[C@H]1CCN(C(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)C1	ZINC000819271026	FD	On-Demand	Anodyne	EPHX2	30	41
O=C(O)[C@H]1CCN(C(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)C1	ZINC000819271026	FD	On-Demand	Anodyne	AKR1C3	17	52
O=C(O)[C@H]1CCN(C(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)C1	ZINC000819271026	FD	On-Demand	Anodyne	L3MBTL3	58	43
O=C(O)[C@@H]1CCN(C(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)C1	ZINC000819271027	FD	On-Demand	Anodyne	EPHX2	30	41
O=C(O)[C@@H]1CCN(C(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)C1	ZINC000819271027	FD	On-Demand	Anodyne	AKR1C3	17	52
O=C(O)[C@@H]1CCN(C(=O)c2cc(S(=O)(=O)N3CCC3)ccc2Cl)C1	ZINC000819271027	FD	On-Demand	Anodyne	L3MBTL3	58	43
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCOCC2)C1	ZINC000819271030	ED	On-Demand	Anodyne	SLC6A1	54	32
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCOCC2)C1	ZINC000819271030	ED	On-Demand	Anodyne	EPHX2	15	43
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCOCC2)C1	ZINC000819271030	ED	On-Demand	Anodyne	RBP4	58	43
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCOCC2)C1	ZINC000819271030	ED	On-Demand	Anodyne	NPSR1	15	46
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCOCC2)C1	ZINC000819271030	ED	On-Demand	Anodyne	L3MBTL3	46	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCOCC2)C1	ZINC000819271031	ED	On-Demand	Anodyne	SLC6A1	54	32
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCOCC2)C1	ZINC000819271031	ED	On-Demand	Anodyne	EPHX2	15	43
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCOCC2)C1	ZINC000819271031	ED	On-Demand	Anodyne	RBP4	58	43
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCOCC2)C1	ZINC000819271031	ED	On-Demand	Anodyne	NPSR1	15	46
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCOCC2)C1	ZINC000819271031	ED	On-Demand	Anodyne	L3MBTL3	46	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCCC2)C1	ZINC000819271032	ED	On-Demand	Anodyne	SLC6A1	108	36
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCCC2)C1	ZINC000819271032	ED	On-Demand	Anodyne	KCNQ2	43	36
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCCC2)C1	ZINC000819271032	ED	On-Demand	Anodyne	EPHX2	16	48
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCCC2)C1	ZINC000819271032	ED	On-Demand	Anodyne	RBP4	65	47
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCCC2)C1	ZINC000819271032	ED	On-Demand	Anodyne	NPSR1	18	52
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCCC2)C1	ZINC000819271032	ED	On-Demand	Anodyne	L3MBTL3	85	48
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCCC2)C1	ZINC000819271033	ED	On-Demand	Anodyne	SLC6A1	108	36
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCCC2)C1	ZINC000819271033	ED	On-Demand	Anodyne	KCNQ2	43	36
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCCC2)C1	ZINC000819271033	ED	On-Demand	Anodyne	EPHX2	16	48
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCCC2)C1	ZINC000819271033	ED	On-Demand	Anodyne	RBP4	65	47
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCCC2)C1	ZINC000819271033	ED	On-Demand	Anodyne	NPSR1	18	52
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2C(=O)N2CCCC2)C1	ZINC000819271033	ED	On-Demand	Anodyne	L3MBTL3	85	48
O=C(O)[C@H]1CCN(C(=O)Nc2cnn(C[C@H]3CCCO3)c2)C1	ZINC000819271035	DD	On-Demand	Anodyne	PANC	49	33
O=C(O)[C@H]1CCN(C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)C1	ZINC000819271036	DD	On-Demand	Anodyne	PANC	49	33
O=C(O)[C@@H]1CCN(C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)C1	ZINC000819271037	DD	On-Demand	Anodyne	PANC	49	33
O=C(O)[C@@H]1CCN(C(=O)Nc2cnn(C[C@H]3CCCO3)c2)C1	ZINC000819271038	DD	On-Demand	Anodyne	PANC	49	33
O=C(O)[C@@H]1CCN(C(=O)Nc2ccn(CCN3CCOCC3)n2)C1	ZINC000819271039	EC	On-Demand	Anodyne	SLC6A1	91	33
O=C(O)[C@@H]1CCN(C(=O)Nc2ccn(CCN3CCOCC3)n2)C1	ZINC000819271039	EC	On-Demand	Anodyne	CASR	48	36
O=C(O)[C@H]1CCN(C(=O)Nc2ccn(CCN3CCOCC3)n2)C1	ZINC000819271040	EC	On-Demand	Anodyne	SLC6A1	91	33
O=C(O)[C@H]1CCN(C(=O)Nc2ccn(CCN3CCOCC3)n2)C1	ZINC000819271040	EC	On-Demand	Anodyne	CASR	48	36
O=C(O)C1CCN(C(=O)Nc2cnn(C[C@H]3CCCO3)c2)CC1	ZINC000819271043	DD	On-Demand	Anodyne	PANC	50	34
O=C(O)C1CCN(C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)CC1	ZINC000819271044	DD	On-Demand	Anodyne	PANC	50	34
O=C(O)[C@@H]1CCN(C(=O)Nc2ccn(CC(F)F)n2)C1	ZINC000819271045	CD	On-Demand	Anodyne	SLC6A1	106	35
O=C(O)[C@H]1CCN(C(=O)Nc2ccn(CC(F)F)n2)C1	ZINC000819271046	CD	On-Demand	Anodyne	SLC6A1	106	35
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(Cn3cncn3)c2)C1	ZINC000819271050	DD	On-Demand	Anodyne	FAAH	20	43
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(Cn3cncn3)c2)C1	ZINC000819271050	DD	On-Demand	Anodyne	P2RY14	47	37
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(Cn3cncn3)c2)C1	ZINC000819271051	DD	On-Demand	Anodyne	FAAH	20	43
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(Cn3cncn3)c2)C1	ZINC000819271051	DD	On-Demand	Anodyne	P2RY14	47	37
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2COc2ccccc2)C1	ZINC000819271054	EG	On-Demand	Anodyne	SLC6A1	77	43
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2COc2ccccc2)C1	ZINC000819271054	EG	On-Demand	Anodyne	KCNQ2	51	36
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2COc2ccccc2)C1	ZINC000819271054	EG	On-Demand	Anodyne	ADAM17	44	38
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2COc2ccccc2)C1	ZINC000819271054	EG	On-Demand	Anodyne	RBP4	54	39
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2COc2ccccc2)C1	ZINC000819271055	EG	On-Demand	Anodyne	SLC6A1	77	43
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2COc2ccccc2)C1	ZINC000819271055	EG	On-Demand	Anodyne	KCNQ2	51	36
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2COc2ccccc2)C1	ZINC000819271055	EG	On-Demand	Anodyne	ADAM17	44	38
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2COc2ccccc2)C1	ZINC000819271055	EG	On-Demand	Anodyne	RBP4	54	39
O=C(O)C1CCN(C(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)CC1	ZINC000819271058	GD	On-Demand	Anodyne	EPHX2	24	40
O=C(O)C1CCN(C(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)CC1	ZINC000819271058	GD	On-Demand	Anodyne	AKR1C3	21	47
O=C(O)C1CCN(C(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)CC1	ZINC000819271058	GD	On-Demand	Anodyne	L3MBTL3	76	47
O=C(O)C1CCN(C(=O)Nc2cnn(Cc3ccccn3)c2)CC1	ZINC000819271059	ED	On-Demand	Anodyne	RPS6KA3	18	46
O=C(O)C1CCN(C(=O)Nc2cnn(Cc3ccccn3)c2)CC1	ZINC000819271059	ED	On-Demand	Anodyne	PANC	51	35
O=C(O)[C@@H]1CCN(C(=O)Nc2cccn(CC(F)(F)F)c2=O)C1	ZINC000819271060	ED	On-Demand	Anodyne	SLC6A1	63	34
O=C(O)[C@@H]1CCN(C(=O)Nc2cccn(CC(F)(F)F)c2=O)C1	ZINC000819271060	ED	On-Demand	Anodyne	RBP4	60	42
O=C(O)[C@@H]1CCN(C(=O)Nc2cccn(CC(F)(F)F)c2=O)C1	ZINC000819271060	ED	On-Demand	Anodyne	CALCRL	35	43
O=C(O)[C@H]1CCN(C(=O)Nc2cccn(CC(F)(F)F)c2=O)C1	ZINC000819271061	ED	On-Demand	Anodyne	SLC6A1	63	34
O=C(O)[C@H]1CCN(C(=O)Nc2cccn(CC(F)(F)F)c2=O)C1	ZINC000819271061	ED	On-Demand	Anodyne	RBP4	60	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccn(CC(F)(F)F)c2=O)C1	ZINC000819271061	ED	On-Demand	Anodyne	CALCRL	35	43
O=C(O)[C@@H]1CCN(C(=O)Nc2cccnc2Oc2ccccc2)C1	ZINC000819271062	EF	On-Demand	Anodyne	P2RY1	46	42
O=C(O)[C@@H]1CCN(C(=O)Nc2cccnc2Oc2ccccc2)C1	ZINC000819271062	EF	On-Demand	Anodyne	RBP4	40	35
O=C(O)[C@H]1CCN(C(=O)Nc2cccnc2Oc2ccccc2)C1	ZINC000819271063	EF	On-Demand	Anodyne	P2RY1	46	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccnc2Oc2ccccc2)C1	ZINC000819271063	EF	On-Demand	Anodyne	RBP4	40	35
O=C(O)[C@@H]1CCN(C(=O)Nc2cccnc2N2CCOCC2)C1	ZINC000819271066	DC	On-Demand	Anodyne	PIK3CA	40	39
O=C(O)[C@@H]1CCN(C(=O)Nc2cccnc2N2CCOCC2)C1	ZINC000819271066	DC	On-Demand	Anodyne	MTOR	54	37
O=C(O)[C@H]1CCN(C(=O)Nc2cccnc2N2CCOCC2)C1	ZINC000819271067	DC	On-Demand	Anodyne	PIK3CA	40	39
O=C(O)[C@H]1CCN(C(=O)Nc2cccnc2N2CCOCC2)C1	ZINC000819271067	DC	On-Demand	Anodyne	MTOR	54	37
CC(C)c1nn(-c2ccccc2)cc1C(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819271145	GH	On-Demand	Anodyne	CCR8	24	40
CC(C)c1nn(-c2ccccc2)cc1C(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819271145	GH	On-Demand	Anodyne	GPR119	30	44
CC(C)c1nn(-c2ccccc2)cc1C(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819271146	GH	On-Demand	Anodyne	CCR8	24	40
CC(C)c1nn(-c2ccccc2)cc1C(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819271146	GH	On-Demand	Anodyne	GPR119	30	44
COc1cccc([S@@](=O)CC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819271147	GD	On-Demand	Anodyne	MTNR1A	17	47
COc1cccc([S@@](=O)CC(=O)N[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819271147	GD	On-Demand	Anodyne	MTNR1B	21	47
COc1cccc([S@@](=O)CC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819271148	GD	On-Demand	Anodyne	MTNR1A	17	47
COc1cccc([S@@](=O)CC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819271148	GD	On-Demand	Anodyne	MTNR1B	21	47
O=C(O)[C@@H]1CCN(C(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)C1	ZINC000819271170	FC	On-Demand	Anodyne	EPHX2	24	42
O=C(O)[C@@H]1CCN(C(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)C1	ZINC000819271170	FC	On-Demand	Anodyne	AKR1C3	16	52
O=C(O)[C@@H]1CCN(C(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)C1	ZINC000819271170	FC	On-Demand	Anodyne	L3MBTL3	59	44
O=C(O)[C@H]1CCN(C(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)C1	ZINC000819271171	FC	On-Demand	Anodyne	EPHX2	24	42
O=C(O)[C@H]1CCN(C(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)C1	ZINC000819271171	FC	On-Demand	Anodyne	AKR1C3	16	52
O=C(O)[C@H]1CCN(C(=O)c2cc(S(=O)(=O)N3CCCC3)ccc2O)C1	ZINC000819271171	FC	On-Demand	Anodyne	L3MBTL3	59	44
O=C(O)[C@@H]1CCN(C(=O)Nc2cccnc2Br)C1	ZINC000819271172	DD	On-Demand	Anodyne	RBP4	46	36
O=C(O)[C@H]1CCN(C(=O)Nc2cccnc2Br)C1	ZINC000819271173	DD	On-Demand	Anodyne	RBP4	46	36
O=C(O)C1CCN(C(=O)Nc2ccccc2O[C@@H]2CCOC2)CC1	ZINC000819271177	EE	On-Demand	Anodyne	SCD1	18	41
O=C(O)C1CCN(C(=O)Nc2ccccc2O[C@H]2CCOC2)CC1	ZINC000819271178	EE	On-Demand	Anodyne	SCD1	18	41
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	F2	40	34
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	ACE	60	48
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	FKBP1A	75	47
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	SLC6A1	69	35
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	CELA1	29	67
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	GRIN2B	32	44
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	ELANE	27	42
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	MME	15	40
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	CTRA_BOVIN	61	33
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	TRY1_BOVIN	53	33
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	CTSG	42	33
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	CPT1A	43	47
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	CPT2	51	45
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	DPP4	18	40
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	PREP	181	86
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	CELA2A	50	33
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	LGMN	87	52
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	KLK5	29	53
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	SFRP1	56	41
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	WNT3	64	41
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	SLC12A5	76	43
O=C(O)C1CCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CC1	ZINC000819271182	FE	On-Demand	Anodyne	TMPRSS11D	63	38
O=C(O)[C@H]1CCN(C(=O)Nc2nnc(C(F)(F)F)s2)C1	ZINC000819271183	DD	On-Demand	Anodyne	RBP4	45	34
O=C(O)[C@@H]1CCN(C(=O)Nc2nnc(C(F)(F)F)s2)C1	ZINC000819271184	DD	On-Demand	Anodyne	RBP4	45	34
O=C(O)[C@@H]1CCN(C(=O)Nc2ccn(-c3ccccc3)n2)C1	ZINC000819271185	DD	On-Demand	Anodyne	SLC6A1	70	34
O=C(O)[C@H]1CCN(C(=O)Nc2ccn(-c3ccccc3)n2)C1	ZINC000819271186	DD	On-Demand	Anodyne	SLC6A1	70	34
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COCCc3ccccc3)c2)C1	ZINC000819271189	FG	On-Demand	Anodyne	FKBP1A	25	41
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COCCc3ccccc3)c2)C1	ZINC000819271189	FG	On-Demand	Anodyne	SLC6A1	56	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COCCc3ccccc3)c2)C1	ZINC000819271189	FG	On-Demand	Anodyne	CCR3	21	42
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COCCc3ccccc3)c2)C1	ZINC000819271189	FG	On-Demand	Anodyne	P2RY14	45	36
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COCCc3ccccc3)c2)C1	ZINC000819271190	FG	On-Demand	Anodyne	FKBP1A	25	41
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COCCc3ccccc3)c2)C1	ZINC000819271190	FG	On-Demand	Anodyne	SLC6A1	56	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COCCc3ccccc3)c2)C1	ZINC000819271190	FG	On-Demand	Anodyne	CCR3	21	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COCCc3ccccc3)c2)C1	ZINC000819271190	FG	On-Demand	Anodyne	P2RY14	45	36
O=C(O)[C@@H]1CCN(C(=O)c2cc3c(Br)cccc3[nH]2)C1	ZINC000819271191	EE	On-Demand	Anodyne	GRIN2B	29	50
O=C(O)[C@@H]1CCN(C(=O)c2cc3c(Br)cccc3[nH]2)C1	ZINC000819271191	EE	On-Demand	Anodyne	HRH4	25	62
O=C(O)[C@@H]1CCN(C(=O)c2cc3c(Br)cccc3[nH]2)C1	ZINC000819271191	EE	On-Demand	Anodyne	AKR1C3	17	41
O=C(O)[C@H]1CCN(C(=O)c2cc3c(Br)cccc3[nH]2)C1	ZINC000819271192	EE	On-Demand	Anodyne	GRIN2B	29	50
O=C(O)[C@H]1CCN(C(=O)c2cc3c(Br)cccc3[nH]2)C1	ZINC000819271192	EE	On-Demand	Anodyne	HRH4	25	62
O=C(O)[C@H]1CCN(C(=O)c2cc3c(Br)cccc3[nH]2)C1	ZINC000819271192	EE	On-Demand	Anodyne	AKR1C3	17	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2SCc2ccccc2)C1	ZINC000819271193	FH	On-Demand	Anodyne	ACE	49	38
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2SCc2ccccc2)C1	ZINC000819271193	FH	On-Demand	Anodyne	SLC6A1	63	35
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2SCc2ccccc2)C1	ZINC000819271193	FH	On-Demand	Anodyne	KCNQ2	76	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2SCc2ccccc2)C1	ZINC000819271193	FH	On-Demand	Anodyne	RBP4	46	37
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2SCc2ccccc2)C1	ZINC000819271194	FH	On-Demand	Anodyne	ACE	49	38
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2SCc2ccccc2)C1	ZINC000819271194	FH	On-Demand	Anodyne	SLC6A1	63	35
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2SCc2ccccc2)C1	ZINC000819271194	FH	On-Demand	Anodyne	KCNQ2	76	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2SCc2ccccc2)C1	ZINC000819271194	FH	On-Demand	Anodyne	RBP4	46	37
O=C(O)[C@@H]1CCN(C(=O)Nc2cccnn2)C1	ZINC000819271195	BC	On-Demand	Anodyne	FAAH	25	46
O=C(O)[C@H]1CCN(C(=O)Nc2cccnn2)C1	ZINC000819271196	BC	On-Demand	Anodyne	FAAH	25	46
O=C(O)[C@H]1CCN(C(=O)c2c[nH]c(C(=O)N3CCCC3)c2)C1	ZINC000819271200	DC	On-Demand	Anodyne	L3MBTL3	94	44
O=C(O)[C@@H]1CCN(C(=O)c2c[nH]c(C(=O)N3CCCC3)c2)C1	ZINC000819271201	DC	On-Demand	Anodyne	L3MBTL3	94	44
O=C(O)[C@@H]1CCN(C(=O)c2cc(Cl)c3ccccc3c2O)C1	ZINC000819271202	DF	On-Demand	Anodyne	SLC6A1	106	41
O=C(O)[C@@H]1CCN(C(=O)c2cc(Cl)c3ccccc3c2O)C1	ZINC000819271202	DF	On-Demand	Anodyne	L3MBTL3	39	40
O=C(O)[C@H]1CCN(C(=O)c2cc(Cl)c3ccccc3c2O)C1	ZINC000819271203	DF	On-Demand	Anodyne	SLC6A1	106	41
O=C(O)[C@H]1CCN(C(=O)c2cc(Cl)c3ccccc3c2O)C1	ZINC000819271203	DF	On-Demand	Anodyne	L3MBTL3	39	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2CN2CCOCC2)C1	ZINC000819271205	ED	On-Demand	Anodyne	SLC6A1	74	34
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2CN2CCOCC2)C1	ZINC000819271205	ED	On-Demand	Anodyne	CCR3	18	46
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2CN2CCOCC2)C1	ZINC000819271206	ED	On-Demand	Anodyne	SLC6A1	74	34
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2CN2CCOCC2)C1	ZINC000819271206	ED	On-Demand	Anodyne	CCR3	18	46
O=C(O)C1CCN(C(=O)c2cc(I)ccc2F)CC1	ZINC000819271209	GE	On-Demand	Anodyne	PARP1	47	36
O=C(O)C1CCN(C(=O)c2cc(I)ccc2F)CC1	ZINC000819271209	GE	On-Demand	Anodyne	L3MBTL3	70	38
O=C(O)[C@@H]1CCN(C(=O)c2cc(Oc3ccccc3)ccc2O)C1	ZINC000819271212	EF	On-Demand	Anodyne	SLC6A1	79	34
O=C(O)[C@@H]1CCN(C(=O)c2cc(Oc3ccccc3)ccc2O)C1	ZINC000819271212	EF	On-Demand	Anodyne	THRB	41	39
O=C(O)[C@@H]1CCN(C(=O)c2cc(Oc3ccccc3)ccc2O)C1	ZINC000819271212	EF	On-Demand	Anodyne	SLC18A3	18	40
O=C(O)[C@@H]1CCN(C(=O)c2cc(Oc3ccccc3)ccc2O)C1	ZINC000819271212	EF	On-Demand	Anodyne	L3MBTL3	40	44
O=C(O)[C@H]1CCN(C(=O)c2cc(Oc3ccccc3)ccc2O)C1	ZINC000819271213	EF	On-Demand	Anodyne	SLC6A1	79	34
O=C(O)[C@H]1CCN(C(=O)c2cc(Oc3ccccc3)ccc2O)C1	ZINC000819271213	EF	On-Demand	Anodyne	THRB	41	39
O=C(O)[C@H]1CCN(C(=O)c2cc(Oc3ccccc3)ccc2O)C1	ZINC000819271213	EF	On-Demand	Anodyne	SLC18A3	18	40
O=C(O)[C@H]1CCN(C(=O)c2cc(Oc3ccccc3)ccc2O)C1	ZINC000819271213	EF	On-Demand	Anodyne	L3MBTL3	40	44
O=C(O)[C@@H]1CCN(C(=O)Nc2cccnc2Cl)C1	ZINC000819271214	CD	On-Demand	Anodyne	RBP4	53	36
O=C(O)[C@@H]1CCN(C(=O)Nc2cccnc2Cl)C1	ZINC000819271214	CD	On-Demand	Anodyne	SCD	16	41
O=C(O)[C@@H]1CCN(C(=O)Nc2cccnc2Cl)C1	ZINC000819271214	CD	On-Demand	Anodyne	SMO	30	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccnc2Cl)C1	ZINC000819271214	CD	On-Demand	Anodyne	G2YM83_BOTF4	70	38
O=C(O)[C@H]1CCN(C(=O)Nc2cccnc2Cl)C1	ZINC000819271215	CD	On-Demand	Anodyne	RBP4	53	36
O=C(O)[C@H]1CCN(C(=O)Nc2cccnc2Cl)C1	ZINC000819271215	CD	On-Demand	Anodyne	SCD	16	41
O=C(O)[C@H]1CCN(C(=O)Nc2cccnc2Cl)C1	ZINC000819271215	CD	On-Demand	Anodyne	SMO	30	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccnc2Cl)C1	ZINC000819271215	CD	On-Demand	Anodyne	G2YM83_BOTF4	70	38
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)C1	ZINC000819271216	FD	On-Demand	Anodyne	SLC6A1	70	32
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)C1	ZINC000819271216	FD	On-Demand	Anodyne	CCR3	21	46
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)C1	ZINC000819271216	FD	On-Demand	Anodyne	CPT1A	119	47
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)C1	ZINC000819271216	FD	On-Demand	Anodyne	CPT2	49	39
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)C1	ZINC000819271216	FD	On-Demand	Anodyne	EPHX2	46	43
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)C1	ZINC000819271217	FD	On-Demand	Anodyne	SLC6A1	70	32
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)C1	ZINC000819271217	FD	On-Demand	Anodyne	CCR3	21	46
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)C1	ZINC000819271217	FD	On-Demand	Anodyne	CPT1A	119	47
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)C1	ZINC000819271217	FD	On-Demand	Anodyne	CPT2	49	39
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCC(=O)N3CCCC3)c2)C1	ZINC000819271217	FD	On-Demand	Anodyne	EPHX2	46	43
O=C(O)[C@@H]1CCN(C(=O)c2cc(I)ccc2F)C1	ZINC000819271220	FD	On-Demand	Anodyne	SLC6A1	53	40
O=C(O)[C@@H]1CCN(C(=O)c2cc(I)ccc2F)C1	ZINC000819271220	FD	On-Demand	Anodyne	L3MBTL3	50	34
O=C(O)[C@H]1CCN(C(=O)c2cc(I)ccc2F)C1	ZINC000819271221	FD	On-Demand	Anodyne	SLC6A1	53	40
O=C(O)[C@H]1CCN(C(=O)c2cc(I)ccc2F)C1	ZINC000819271221	FD	On-Demand	Anodyne	L3MBTL3	50	34
O=C(O)[C@@H]1CCN(C(=O)Nc2ncc(-c3ccccc3)s2)C1	ZINC000819271222	DF	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)[C@@H]1CCN(C(=O)Nc2ncc(-c3ccccc3)s2)C1	ZINC000819271222	DF	On-Demand	Anodyne	NPY5R	18	54
O=C(O)[C@@H]1CCN(C(=O)Nc2ncc(-c3ccccc3)s2)C1	ZINC000819271222	DF	On-Demand	Anodyne	CDK7	21	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ncc(-c3ccccc3)s2)C1	ZINC000819271222	DF	On-Demand	Anodyne	CDK5	44	37
O=C(O)[C@@H]1CCN(C(=O)Nc2ncc(-c3ccccc3)s2)C1	ZINC000819271222	DF	On-Demand	Anodyne	CHEK1	41	33
O=C(O)[C@@H]1CCN(C(=O)Nc2ncc(-c3ccccc3)s2)C1	ZINC000819271222	DF	On-Demand	Anodyne	LUCI_LUCLA	31	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ncc(-c3ccccc3)s2)C1	ZINC000819271222	DF	On-Demand	Anodyne	DGAT1	16	43
O=C(O)[C@H]1CCN(C(=O)Nc2ncc(-c3ccccc3)s2)C1	ZINC000819271223	DF	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)[C@H]1CCN(C(=O)Nc2ncc(-c3ccccc3)s2)C1	ZINC000819271223	DF	On-Demand	Anodyne	NPY5R	18	54
O=C(O)[C@H]1CCN(C(=O)Nc2ncc(-c3ccccc3)s2)C1	ZINC000819271223	DF	On-Demand	Anodyne	CDK7	21	41
O=C(O)[C@H]1CCN(C(=O)Nc2ncc(-c3ccccc3)s2)C1	ZINC000819271223	DF	On-Demand	Anodyne	CDK5	44	37
O=C(O)[C@H]1CCN(C(=O)Nc2ncc(-c3ccccc3)s2)C1	ZINC000819271223	DF	On-Demand	Anodyne	CHEK1	41	33
O=C(O)[C@H]1CCN(C(=O)Nc2ncc(-c3ccccc3)s2)C1	ZINC000819271223	DF	On-Demand	Anodyne	LUCI_LUCLA	31	40
O=C(O)[C@H]1CCN(C(=O)Nc2ncc(-c3ccccc3)s2)C1	ZINC000819271223	DF	On-Demand	Anodyne	DGAT1	16	43
O=C(O)[C@@H]1CCN(C(=O)c2cc(COc3ccc(Cl)cc3Cl)on2)C1	ZINC000819271224	GG	On-Demand	Anodyne	PTGER1	48	37
O=C(O)[C@H]1CCN(C(=O)c2cc(COc3ccc(Cl)cc3Cl)on2)C1	ZINC000819271225	GG	On-Demand	Anodyne	PTGER1	48	37
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271226	EG	On-Demand	Anodyne	HRH2	36	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271226	EG	On-Demand	Anodyne	SLC6A1	66	38
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271226	EG	On-Demand	Anodyne	PDGFRB	22	43
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271226	EG	On-Demand	Anodyne	LTA4H	33	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271226	EG	On-Demand	Anodyne	CYSLTR2	43	32
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271226	EG	On-Demand	Anodyne	CCR3	35	47
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271226	EG	On-Demand	Anodyne	ADAM17	31	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271226	EG	On-Demand	Anodyne	CPT1A	51	41
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271226	EG	On-Demand	Anodyne	GYS1	41	36
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271226	EG	On-Demand	Anodyne	FAAH	41	47
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271226	EG	On-Demand	Anodyne	CCKBR	20	41
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271226	EG	On-Demand	Anodyne	EPHX2	42	38
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271226	EG	On-Demand	Anodyne	DPP7	24	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271226	EG	On-Demand	Anodyne	FFAR1	31	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271226	EG	On-Demand	Anodyne	P2RY14	47	37
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271227	EG	On-Demand	Anodyne	HRH2	36	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271227	EG	On-Demand	Anodyne	SLC6A1	66	38
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271227	EG	On-Demand	Anodyne	PDGFRB	22	43
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271227	EG	On-Demand	Anodyne	LTA4H	33	42
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271227	EG	On-Demand	Anodyne	CYSLTR2	43	32
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271227	EG	On-Demand	Anodyne	CCR3	35	47
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271227	EG	On-Demand	Anodyne	ADAM17	31	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271227	EG	On-Demand	Anodyne	CPT1A	51	41
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271227	EG	On-Demand	Anodyne	GYS1	41	36
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271227	EG	On-Demand	Anodyne	FAAH	41	47
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271227	EG	On-Demand	Anodyne	CCKBR	20	41
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271227	EG	On-Demand	Anodyne	EPHX2	42	38
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271227	EG	On-Demand	Anodyne	DPP7	24	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271227	EG	On-Demand	Anodyne	FFAR1	31	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819271227	EG	On-Demand	Anodyne	P2RY14	47	37
O=C(O)[C@H]1CCN(C(=O)c2c(O)cc(F)cc2F)C1	ZINC000819271230	CD	On-Demand	Anodyne	SLC6A1	56	37
O=C(O)[C@@H]1CCN(C(=O)c2c(O)cc(F)cc2F)C1	ZINC000819271231	CD	On-Demand	Anodyne	SLC6A1	56	37
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)C1CC1	ZINC000819271232	DD	On-Demand	Anodyne	NPY2R	16	44
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)C1CC1	ZINC000819271232	DD	On-Demand	Anodyne	MAPK1	20	41
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)C1CC1	ZINC000819271232	DD	On-Demand	Anodyne	EPHX2	44	45
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)C1CC1	ZINC000819271232	DD	On-Demand	Anodyne	TYK2	42	38
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)C1CC1	ZINC000819271232	DD	On-Demand	Anodyne	LIMK2	30	41
O=C(Nc1cccc(NC(=O)N2CC[C@@H](C(=O)O)C2)c1)C1CC1	ZINC000819271232	DD	On-Demand	Anodyne	KCNK3	46	52
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)C1CC1	ZINC000819271233	DD	On-Demand	Anodyne	NPY2R	16	44
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)C1CC1	ZINC000819271233	DD	On-Demand	Anodyne	MAPK1	20	41
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)C1CC1	ZINC000819271233	DD	On-Demand	Anodyne	EPHX2	44	45
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)C1CC1	ZINC000819271233	DD	On-Demand	Anodyne	TYK2	42	38
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)C1CC1	ZINC000819271233	DD	On-Demand	Anodyne	LIMK2	30	41
O=C(Nc1cccc(NC(=O)N2CC[C@H](C(=O)O)C2)c1)C1CC1	ZINC000819271233	DD	On-Demand	Anodyne	KCNK3	46	52
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819271234	GC	On-Demand	Anodyne	LPL	45	42
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819271234	GC	On-Demand	Anodyne	CASR	23	41
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819271234	GC	On-Demand	Anodyne	EPHX2	45	54
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819271234	GC	On-Demand	Anodyne	TGM2	44	42
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819271234	GC	On-Demand	Anodyne	F13A1	70	42
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819271234	GC	On-Demand	Anodyne	AKR1C3	53	42
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819271234	GC	On-Demand	Anodyne	LIPG	18	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819271235	GC	On-Demand	Anodyne	LPL	45	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819271235	GC	On-Demand	Anodyne	CASR	23	41
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819271235	GC	On-Demand	Anodyne	EPHX2	45	54
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819271235	GC	On-Demand	Anodyne	TGM2	44	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819271235	GC	On-Demand	Anodyne	F13A1	70	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819271235	GC	On-Demand	Anodyne	AKR1C3	53	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819271235	GC	On-Demand	Anodyne	LIPG	18	42
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2S[C@H](Cl)C(F)(F)F)C1	ZINC000819271242	GH	On-Demand	Reactive	RBP4	76	42
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2S[C@@H](Cl)C(F)(F)F)C1	ZINC000819271243	GH	On-Demand	Reactive	RBP4	76	42
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2S[C@@H](Cl)C(F)(F)F)C1	ZINC000819271244	GH	On-Demand	Reactive	RBP4	76	42
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2S[C@H](Cl)C(F)(F)F)C1	ZINC000819271245	GH	On-Demand	Reactive	RBP4	76	42
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccn2)C1	ZINC000819271248	BD	On-Demand	Anodyne	SLC6A1	54	36
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccn2)C1	ZINC000819271248	BD	On-Demand	Anodyne	GRIN2B	18	45
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccn2)C1	ZINC000819271248	BD	On-Demand	Anodyne	EPHX2	26	43
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccn2)C1	ZINC000819271248	BD	On-Demand	Anodyne	MAP3K12	22	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccccn2)C1	ZINC000819271249	BD	On-Demand	Anodyne	SLC6A1	54	36
O=C(O)[C@H]1CCN(C(=O)Nc2ccccn2)C1	ZINC000819271249	BD	On-Demand	Anodyne	GRIN2B	18	45
O=C(O)[C@H]1CCN(C(=O)Nc2ccccn2)C1	ZINC000819271249	BD	On-Demand	Anodyne	EPHX2	26	43
O=C(O)[C@H]1CCN(C(=O)Nc2ccccn2)C1	ZINC000819271249	BD	On-Demand	Anodyne	MAP3K12	22	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2COCc2ccccc2)C1	ZINC000819271250	FG	On-Demand	Anodyne	SLC6A1	63	44
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2COCc2ccccc2)C1	ZINC000819271250	FG	On-Demand	Anodyne	KCNQ2	39	40
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2COCc2ccccc2)C1	ZINC000819271250	FG	On-Demand	Anodyne	CCR3	17	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccccc2COCc2ccccc2)C1	ZINC000819271250	FG	On-Demand	Anodyne	RBP4	48	38
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2COCc2ccccc2)C1	ZINC000819271251	FG	On-Demand	Anodyne	SLC6A1	63	44
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2COCc2ccccc2)C1	ZINC000819271251	FG	On-Demand	Anodyne	KCNQ2	39	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2COCc2ccccc2)C1	ZINC000819271251	FG	On-Demand	Anodyne	CCR3	17	41
O=C(O)[C@@H]1CCN(C(=O)Nc2ccccc2COCc2ccccc2)C1	ZINC000819271251	FG	On-Demand	Anodyne	RBP4	48	38
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)C1	ZINC000819271252	GF	On-Demand	Anodyne	HRH2	21	44
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)C1	ZINC000819271252	GF	On-Demand	Anodyne	MAOB	17	49
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)C1	ZINC000819271252	GF	On-Demand	Anodyne	EDNRB	65	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)C1	ZINC000819271252	GF	On-Demand	Anodyne	EDNRA	62	41
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)C1	ZINC000819271252	GF	On-Demand	Anodyne	NOS2	45	37
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)C1	ZINC000819271252	GF	On-Demand	Anodyne	PTGDR	17	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)C1	ZINC000819271252	GF	On-Demand	Anodyne	MCHR1	16	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)C1	ZINC000819271252	GF	On-Demand	Anodyne	FFAR1	36	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)C1	ZINC000819271252	GF	On-Demand	Anodyne	P2RY14	28	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)C1	ZINC000819271253	GF	On-Demand	Anodyne	HRH2	21	44
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)C1	ZINC000819271253	GF	On-Demand	Anodyne	MAOB	17	49
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)C1	ZINC000819271253	GF	On-Demand	Anodyne	EDNRB	65	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)C1	ZINC000819271253	GF	On-Demand	Anodyne	EDNRA	62	41
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)C1	ZINC000819271253	GF	On-Demand	Anodyne	NOS2	45	37
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)C1	ZINC000819271253	GF	On-Demand	Anodyne	PTGDR	17	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)C1	ZINC000819271253	GF	On-Demand	Anodyne	MCHR1	16	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)C1	ZINC000819271253	GF	On-Demand	Anodyne	FFAR1	36	42
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3ccc4c(c3)OCO4)c2)C1	ZINC000819271253	GF	On-Demand	Anodyne	P2RY14	28	40
O=C(O)[C@@H]1CCN(C(=O)Nc2ccnc(Oc3ccccc3)c2)C1	ZINC000819271254	EF	On-Demand	Anodyne	PDGFRB	31	45
O=C(O)[C@@H]1CCN(C(=O)Nc2ccnc(Oc3ccccc3)c2)C1	ZINC000819271254	EF	On-Demand	Anodyne	FAAH	35	42
O=C(O)[C@@H]1CCN(C(=O)Nc2ccnc(Oc3ccccc3)c2)C1	ZINC000819271254	EF	On-Demand	Anodyne	TYK2	41	33
O=C(O)[C@@H]1CCN(C(=O)Nc2ccnc(Oc3ccccc3)c2)C1	ZINC000819271254	EF	On-Demand	Anodyne	LIMK2	24	41
O=C(O)[C@H]1CCN(C(=O)Nc2ccnc(Oc3ccccc3)c2)C1	ZINC000819271255	EF	On-Demand	Anodyne	PDGFRB	31	45
O=C(O)[C@H]1CCN(C(=O)Nc2ccnc(Oc3ccccc3)c2)C1	ZINC000819271255	EF	On-Demand	Anodyne	FAAH	35	42
O=C(O)[C@H]1CCN(C(=O)Nc2ccnc(Oc3ccccc3)c2)C1	ZINC000819271255	EF	On-Demand	Anodyne	TYK2	41	33
O=C(O)[C@H]1CCN(C(=O)Nc2ccnc(Oc3ccccc3)c2)C1	ZINC000819271255	EF	On-Demand	Anodyne	LIMK2	24	41
O=C(O)C1CCN(C(=O)Nc2ccn(CCN3CCOCC3)n2)CC1	ZINC000819271258	FC	On-Demand	Anodyne	CASR	44	34
O=C(O)[C@@H]1CCN(C(=O)Nc2nc(CN3CCCCC3)cs2)C1	ZINC000819271260	EE	On-Demand	Anodyne	SLC6A1	60	32
O=C(O)[C@H]1CCN(C(=O)Nc2nc(CN3CCCCC3)cs2)C1	ZINC000819271261	EE	On-Demand	Anodyne	SLC6A1	60	32
O=C(O)[C@@H]1CCN(C(=O)Nc2ccnc(Oc3ccccc3Cl)c2)C1	ZINC000819271262	FG	On-Demand	Anodyne	TYK2	61	37
O=C(O)[C@@H]1CCN(C(=O)Nc2ccnc(Oc3ccccc3Cl)c2)C1	ZINC000819271262	FG	On-Demand	Anodyne	SCD1	20	47
O=C(O)[C@H]1CCN(C(=O)Nc2ccnc(Oc3ccccc3Cl)c2)C1	ZINC000819271263	FG	On-Demand	Anodyne	TYK2	61	37
O=C(O)[C@H]1CCN(C(=O)Nc2ccnc(Oc3ccccc3Cl)c2)C1	ZINC000819271263	FG	On-Demand	Anodyne	SCD1	20	47
O=C(O)C1CCN(C(=O)Nc2cccn(Cc3ccccc3)c2=O)CC1	ZINC000819271266	FE	On-Demand	Anodyne	SIGMAR1	18	42
O=C(O)C1CCN(C(=O)Nc2cccn(Cc3ccccc3)c2=O)CC1	ZINC000819271266	FE	On-Demand	Anodyne	EPHX2	15	40
O=C(O)C1CCN(C(=O)Nc2cccn(Cc3ccccc3)c2=O)CC1	ZINC000819271266	FE	On-Demand	Anodyne	RBP4	42	40
O=C(O)C1CCN(C(=O)Nc2cccn(Cc3ccccc3)c2=O)CC1	ZINC000819271266	FE	On-Demand	Anodyne	CALCRL	24	41
O=C(O)C1CCN(C(=O)Nc2cccnc2Br)CC1	ZINC000819271267	EE	On-Demand	Anodyne	RBP4	40	39
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271268	FG	On-Demand	Anodyne	SLC6A1	57	36
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271268	FG	On-Demand	Anodyne	GRIN2B	27	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271268	FG	On-Demand	Anodyne	LTA4H	18	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271268	FG	On-Demand	Anodyne	CCR3	103	55
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271268	FG	On-Demand	Anodyne	MLNR	42	35
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271268	FG	On-Demand	Anodyne	FAAH	23	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271268	FG	On-Demand	Anodyne	MET	17	45
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271268	FG	On-Demand	Anodyne	EPHX2	45	44
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271268	FG	On-Demand	Anodyne	MCHR1	23	41
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271268	FG	On-Demand	Anodyne	LIMK2	46	39
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271269	FG	On-Demand	Anodyne	SLC6A1	57	36
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271269	FG	On-Demand	Anodyne	GRIN2B	27	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271269	FG	On-Demand	Anodyne	LTA4H	18	42
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271269	FG	On-Demand	Anodyne	CCR3	103	55
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271269	FG	On-Demand	Anodyne	MLNR	42	35
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271269	FG	On-Demand	Anodyne	FAAH	23	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271269	FG	On-Demand	Anodyne	MET	17	45
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271269	FG	On-Demand	Anodyne	EPHX2	45	44
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271269	FG	On-Demand	Anodyne	MCHR1	23	41
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)C1	ZINC000819271269	FG	On-Demand	Anodyne	LIMK2	46	39
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(Cn3nc4ccccn4c3=O)c2)C1	ZINC000819271287	GD	On-Demand	Anodyne	P2RY14	43	34
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(Cn3nc4ccccn4c3=O)c2)C1	ZINC000819271290	GD	On-Demand	Anodyne	P2RY14	43	34
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3cccc(F)c3)c2)C1	ZINC000819271292	FG	On-Demand	Anodyne	SLC6A1	42	37
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3cccc(F)c3)c2)C1	ZINC000819271292	FG	On-Demand	Anodyne	CCR3	50	46
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3cccc(F)c3)c2)C1	ZINC000819271292	FG	On-Demand	Anodyne	GYS1	40	35
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3cccc(F)c3)c2)C1	ZINC000819271292	FG	On-Demand	Anodyne	FAAH	22	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3cccc(F)c3)c2)C1	ZINC000819271292	FG	On-Demand	Anodyne	EPHX2	31	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(COc3cccc(F)c3)c2)C1	ZINC000819271292	FG	On-Demand	Anodyne	P2RY14	44	37
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3cccc(F)c3)c2)C1	ZINC000819271294	FG	On-Demand	Anodyne	SLC6A1	42	37
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3cccc(F)c3)c2)C1	ZINC000819271294	FG	On-Demand	Anodyne	CCR3	50	46
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3cccc(F)c3)c2)C1	ZINC000819271294	FG	On-Demand	Anodyne	GYS1	40	35
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3cccc(F)c3)c2)C1	ZINC000819271294	FG	On-Demand	Anodyne	FAAH	22	42
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3cccc(F)c3)c2)C1	ZINC000819271294	FG	On-Demand	Anodyne	EPHX2	31	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(COc3cccc(F)c3)c2)C1	ZINC000819271294	FG	On-Demand	Anodyne	P2RY14	44	37
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(N3CCOCC3)c2)C1	ZINC000819271296	DD	On-Demand	Anodyne	MAPK1	18	40
O=C(O)[C@@H]1CCN(C(=O)Nc2cccc(N3CCOCC3)c2)C1	ZINC000819271296	DD	On-Demand	Anodyne	EPHX2	28	42
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(N3CCOCC3)c2)C1	ZINC000819271298	DD	On-Demand	Anodyne	MAPK1	18	40
O=C(O)[C@H]1CCN(C(=O)Nc2cccc(N3CCOCC3)c2)C1	ZINC000819271298	DD	On-Demand	Anodyne	EPHX2	28	42
O=C(O)[C@@H]1CCN(C(=O)Nc2cccnc2N2CCCC2)C1	ZINC000819271300	DD	On-Demand	Anodyne	TRPV1	16	48
O=C(O)[C@@H]1CCN(C(=O)Nc2cccnc2N2CCCC2)C1	ZINC000819271300	DD	On-Demand	Anodyne	RBP4	46	36
O=C(O)[C@H]1CCN(C(=O)Nc2cccnc2N2CCCC2)C1	ZINC000819271302	DD	On-Demand	Anodyne	TRPV1	16	48
O=C(O)[C@H]1CCN(C(=O)Nc2cccnc2N2CCCC2)C1	ZINC000819271302	DD	On-Demand	Anodyne	RBP4	46	36
O=C(O)[C@@H]1CCN(C(=O)c2c(O)cccc2Cl)C1	ZINC000819271306	CD	On-Demand	Anodyne	SLC6A1	58	36
O=C(O)[C@@H]1CCN(C(=O)c2c(O)cccc2Cl)C1	ZINC000819271306	CD	On-Demand	Anodyne	CCR5	16	40
O=C(O)[C@@H]1CCN(C(=O)c2c(O)cccc2Cl)C1	ZINC000819271306	CD	On-Demand	Anodyne	L3MBTL3	69	38
N#Cc1ccc2c(c1)CC[C@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819271310	DH	On-Demand	Mild	ADRB1	28	42
N#Cc1ccc2c(c1)CC[C@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819271310	DH	On-Demand	Mild	ADRB3	44	46
N#Cc1ccc2c(c1)CC[C@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819271311	DH	On-Demand	Mild	ADRB1	28	42
N#Cc1ccc2c(c1)CC[C@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819271311	DH	On-Demand	Mild	ADRB3	44	46
N#Cc1ccc2c(c1)CC[C@@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819271312	DH	On-Demand	Mild	ADRB1	28	42
N#Cc1ccc2c(c1)CC[C@@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819271312	DH	On-Demand	Mild	ADRB3	44	46
N#Cc1ccc2c(c1)CC[C@@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819271313	DH	On-Demand	Mild	ADRB1	28	42
N#Cc1ccc2c(c1)CC[C@@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819271313	DH	On-Demand	Mild	ADRB3	44	46
O=C(O)[C@H]1CCN(C(=O)c2c(O)cccc2Cl)C1	ZINC000819271315	CD	On-Demand	Anodyne	SLC6A1	58	36
O=C(O)[C@H]1CCN(C(=O)c2c(O)cccc2Cl)C1	ZINC000819271315	CD	On-Demand	Anodyne	CCR5	16	40
O=C(O)[C@H]1CCN(C(=O)c2c(O)cccc2Cl)C1	ZINC000819271315	CD	On-Demand	Anodyne	L3MBTL3	69	38
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819271349	GG	On-Demand	Anodyne	GPR119	34	46
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819271349	GG	On-Demand	Anodyne	SFRP1	29	40
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819271350	GG	On-Demand	Anodyne	GPR119	34	46
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819271350	GG	On-Demand	Anodyne	SFRP1	29	40
O[C@@H](CN[C@H]1CSc2ccc(Br)cc21)c1cccnc1	ZINC000819271368	FG	On-Demand	Anodyne	ADRB3	67	42
O[C@@H](CN[C@@H]1CSc2ccc(Br)cc21)c1cccnc1	ZINC000819271369	FG	On-Demand	Anodyne	ADRB3	67	42
O[C@H](CN[C@H]1CSc2ccc(Br)cc21)c1cccnc1	ZINC000819271370	FG	On-Demand	Anodyne	ADRB3	67	42
O[C@H](CN[C@@H]1CSc2ccc(Br)cc21)c1cccnc1	ZINC000819271371	FG	On-Demand	Anodyne	ADRB3	67	42
CC(=O)Nc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819271396	ED	On-Demand	Bother	CACNA1C	48	36
CC(=O)Nc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819271396	ED	On-Demand	Bother	ADRB3	49	36
CC(=O)Nc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819271396	ED	On-Demand	Bother	CACNA1D	78	36
CC(=O)Nc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819271397	ED	On-Demand	Bother	CACNA1C	48	36
CC(=O)Nc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819271397	ED	On-Demand	Bother	ADRB3	49	36
CC(=O)Nc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819271397	ED	On-Demand	Bother	CACNA1D	78	36
Cc1ccc(-c2n[nH]c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n2)cc1	ZINC000819271407	GG	On-Demand	Mild	PAPA1_CARPA	39	42
Cc1ccc(-c2n[nH]c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n2)cc1	ZINC000819271408	GG	On-Demand	Mild	PAPA1_CARPA	39	42
O[C@@H](CNC[C@@H]1CCCN(c2ccccc2)C1)c1ccc(Br)cc1	ZINC000819271410	GH	On-Demand	Anodyne	SLC18A3	15	43
O[C@H](CNC[C@@H]1CCCN(c2ccccc2)C1)c1ccc(Br)cc1	ZINC000819271411	GH	On-Demand	Anodyne	SLC18A3	15	43
O[C@H](CNC[C@H]1CCCN(c2ccccc2)C1)c1ccc(Br)cc1	ZINC000819271412	GH	On-Demand	Anodyne	SLC18A3	15	43
O[C@@H](CNC[C@H]1CCCN(c2ccccc2)C1)c1ccc(Br)cc1	ZINC000819271413	GH	On-Demand	Anodyne	SLC18A3	15	43
O=C(/C=C/c1cnc2ccccc2n1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271424	HJ	On-Demand	Anodyne	HDAC8	15	44
O=C(/C=C/c1cnc2ccccc2n1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271424	HJ	On-Demand	Anodyne	KCNK3	58	37
O=C(/C=C\c1cnc2ccccc2n1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271425	HJ	On-Demand	Anodyne	HDAC8	15	44
O=C(/C=C\c1cnc2ccccc2n1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271425	HJ	On-Demand	Anodyne	KCNK3	58	37
O=C(/C=C/c1nc2ccccc2s1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271428	HK	On-Demand	Anodyne	HDAC8	16	41
O=C(/C=C/c1nc2ccccc2s1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271428	HK	On-Demand	Anodyne	KCNK3	64	35
O=C(/C=C/c1nc2ccccc2s1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271428	HK	On-Demand	Anodyne	KCNK9	43	35
O=C(/C=C\c1nc2ccccc2s1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271429	HK	On-Demand	Anodyne	HDAC8	16	41
O=C(/C=C\c1nc2ccccc2s1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271429	HK	On-Demand	Anodyne	KCNK3	64	35
O=C(/C=C\c1nc2ccccc2s1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271429	HK	On-Demand	Anodyne	KCNK9	43	35
CC(=O)Nc1ccc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cn1	ZINC000819271432	FD	On-Demand	Anodyne	ADRB3	36	41
CC(=O)Nc1ccc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cn1	ZINC000819271433	FD	On-Demand	Anodyne	ADRB3	36	41
O[C@@H](CNC[C@@H]1CCCN(c2ccccc2)C1)c1ccc(F)cc1	ZINC000819271435	EG	On-Demand	Anodyne	SLC6A3	23	45
O[C@H](CNC[C@@H]1CCCN(c2ccccc2)C1)c1ccc(F)cc1	ZINC000819271436	EG	On-Demand	Anodyne	SLC6A3	23	45
O[C@H](CNC[C@H]1CCCN(c2ccccc2)C1)c1ccc(F)cc1	ZINC000819271437	EG	On-Demand	Anodyne	SLC6A3	23	45
O[C@@H](CNC[C@H]1CCCN(c2ccccc2)C1)c1ccc(F)cc1	ZINC000819271438	EG	On-Demand	Anodyne	SLC6A3	23	45
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(F)cc1)c1ccc(Cl)cc1	ZINC000819271448	DH	On-Demand	Anodyne	SLC6A3	31	44
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271450	IK	On-Demand	Anodyne	PPIA	30	43
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271450	IK	On-Demand	Anodyne	LPL	51	34
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271450	IK	On-Demand	Anodyne	MAPK14	19	46
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271450	IK	On-Demand	Anodyne	P2RX7	17	44
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271450	IK	On-Demand	Anodyne	PRNP	15	40
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271450	IK	On-Demand	Anodyne	MAPK10	19	42
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271450	IK	On-Demand	Anodyne	EPHX2	15	40
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271450	IK	On-Demand	Anodyne	TYK2	33	40
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271450	IK	On-Demand	Anodyne	FPR2	42	35
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271450	IK	On-Demand	Anodyne	DDR2	18	42
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271450	IK	On-Demand	Anodyne	KCNK3	121	41
Cc1nn(-c2ccccc2)c(Cl)c1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819271450	IK	On-Demand	Anodyne	KCNK9	82	41
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(F)cc1)c1ccccc1	ZINC000819271477	CG	On-Demand	Anodyne	SLC6A3	28	50
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(F)cc1)c1ccccc1	ZINC000819271477	CG	On-Demand	Anodyne	KDM1A	43	35
O[C@H](CN[C@@H]1C[C@H]1c1ccc(F)cc1)c1ccccc1	ZINC000819271478	CG	On-Demand	Anodyne	SLC6A3	28	50
O[C@H](CN[C@@H]1C[C@H]1c1ccc(F)cc1)c1ccccc1	ZINC000819271478	CG	On-Demand	Anodyne	KDM1A	43	35
CC(=O)Nc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cn1	ZINC000819271486	DF	On-Demand	Anodyne	ADRB2	20	45
CC(=O)Nc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cn1	ZINC000819271486	DF	On-Demand	Anodyne	ADRB1	52	49
CC(=O)Nc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cn1	ZINC000819271486	DF	On-Demand	Anodyne	ADRB3	84	49
CC(=O)Nc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cn1	ZINC000819271486	DF	On-Demand	Anodyne	UL54	42	30
CC(=O)Nc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cn1	ZINC000819271486	DF	On-Demand	Anodyne	LUCI_LUCLA	23	40
CC(=O)Nc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cn1	ZINC000819271487	DF	On-Demand	Anodyne	ADRB2	20	45
CC(=O)Nc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cn1	ZINC000819271487	DF	On-Demand	Anodyne	ADRB1	52	49
CC(=O)Nc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cn1	ZINC000819271487	DF	On-Demand	Anodyne	ADRB3	84	49
CC(=O)Nc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cn1	ZINC000819271487	DF	On-Demand	Anodyne	UL54	42	30
CC(=O)Nc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cn1	ZINC000819271487	DF	On-Demand	Anodyne	LUCI_LUCLA	23	40
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@H]2c2ccc(F)cc2)c1	ZINC000819271489	DF	On-Demand	Bother	CACNA1C	44	37
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@H]2c2ccc(F)cc2)c1	ZINC000819271489	DF	On-Demand	Bother	CACNA1D	68	33
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@H]2c2ccc(F)cc2)c1	ZINC000819271490	DF	On-Demand	Bother	CACNA1C	44	37
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@H]2c2ccc(F)cc2)c1	ZINC000819271490	DF	On-Demand	Bother	CACNA1D	68	33
O[C@@H](CN[C@@H]1[C@H]2CCC[C@H]21)c1cccnc1	ZINC000819271514	BD	On-Demand	Anodyne	ADRB1	23	43
O[C@@H](CN[C@@H]1[C@H]2CCC[C@H]21)c1cccnc1	ZINC000819271514	BD	On-Demand	Anodyne	ADRB3	85	46
O[C@@H](CN[C@H]1[C@H]2CCC[C@H]21)c1cccnc1	ZINC000819271515	BD	On-Demand	Anodyne	ADRB1	23	43
O[C@@H](CN[C@H]1[C@H]2CCC[C@H]21)c1cccnc1	ZINC000819271515	BD	On-Demand	Anodyne	ADRB3	85	46
O[C@H](CN[C@@H]1[C@H]2CCC[C@H]21)c1cccnc1	ZINC000819271516	BD	On-Demand	Anodyne	ADRB1	23	43
O[C@H](CN[C@@H]1[C@H]2CCC[C@H]21)c1cccnc1	ZINC000819271516	BD	On-Demand	Anodyne	ADRB3	85	46
O[C@H](CN[C@H]1[C@H]2CCC[C@H]21)c1cccnc1	ZINC000819271517	BD	On-Demand	Anodyne	ADRB1	23	43
O[C@H](CN[C@H]1[C@H]2CCC[C@H]21)c1cccnc1	ZINC000819271517	BD	On-Demand	Anodyne	ADRB3	85	46
Cn1nnc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819271524	CB	On-Demand	Bother	CACNA1C	51	36
Cn1nnc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819271524	CB	On-Demand	Bother	CACNA1D	79	34
Cn1nnc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819271525	CB	On-Demand	Bother	CACNA1C	51	36
Cn1nnc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819271525	CB	On-Demand	Bother	CACNA1D	79	34
N#Cc1ccc2c(c1)CC[C@H]2NC[C@H](O)c1ccc(Cl)cc1	ZINC000819271553	DH	On-Demand	Mild	ADRB3	18	43
N#Cc1ccc2c(c1)CC[C@@H]2NC[C@H](O)c1ccc(Cl)cc1	ZINC000819271554	DH	On-Demand	Mild	ADRB3	18	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](c3ccc(Cl)cc3)C1)C2	ZINC000819271631	GH	On-Demand	Anodyne	SLC6A3	23	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](c3ccc(Cl)cc3)C1)C2	ZINC000819271631	GH	On-Demand	Anodyne	CCR1	35	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](c3ccc(Cl)cc3)C1)C2	ZINC000819271631	GH	On-Demand	Anodyne	ADAM10	19	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](c3ccc(Cl)cc3)C1)C2	ZINC000819271632	GH	On-Demand	Anodyne	SLC6A3	23	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](c3ccc(Cl)cc3)C1)C2	ZINC000819271632	GH	On-Demand	Anodyne	CCR1	35	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](c3ccc(Cl)cc3)C1)C2	ZINC000819271632	GH	On-Demand	Anodyne	ADAM10	19	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3ccc(Cl)cc3)C1)C2	ZINC000819271633	GH	On-Demand	Anodyne	SLC6A3	23	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3ccc(Cl)cc3)C1)C2	ZINC000819271633	GH	On-Demand	Anodyne	CCR1	35	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3ccc(Cl)cc3)C1)C2	ZINC000819271633	GH	On-Demand	Anodyne	ADAM10	19	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3ccc(Cl)cc3)C1)C2	ZINC000819271634	GH	On-Demand	Anodyne	SLC6A3	23	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3ccc(Cl)cc3)C1)C2	ZINC000819271634	GH	On-Demand	Anodyne	CCR1	35	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3ccc(Cl)cc3)C1)C2	ZINC000819271634	GH	On-Demand	Anodyne	ADAM10	19	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(Br)cc1F)C2	ZINC000819271648	GG	On-Demand	Anodyne	P2RX7	39	51
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(Br)cc1F)C2	ZINC000819271649	GG	On-Demand	Anodyne	P2RX7	39	51
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1C[C@H]1c1cccc(F)c1	ZINC000819271650	EF	On-Demand	Anodyne	CCR5	58	33
O=C([C@H](CNC[C@@H](O)c1cccnc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819271651	GD	On-Demand	Anodyne	ADRB2	19	42
O=C([C@H](CNC[C@@H](O)c1cccnc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819271651	GD	On-Demand	Anodyne	ADRB1	23	44
O=C([C@H](CNC[C@@H](O)c1cccnc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819271651	GD	On-Demand	Anodyne	ADRB3	86	44
O=C([C@H](CNC[C@H](O)c1cccnc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819271652	GD	On-Demand	Anodyne	ADRB2	19	42
O=C([C@H](CNC[C@H](O)c1cccnc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819271652	GD	On-Demand	Anodyne	ADRB1	23	44
O=C([C@H](CNC[C@H](O)c1cccnc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819271652	GD	On-Demand	Anodyne	ADRB3	86	44
O=C([C@@H](CNC[C@H](O)c1cccnc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819271653	GD	On-Demand	Anodyne	ADRB2	19	42
O=C([C@@H](CNC[C@H](O)c1cccnc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819271653	GD	On-Demand	Anodyne	ADRB1	23	44
O=C([C@@H](CNC[C@H](O)c1cccnc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819271653	GD	On-Demand	Anodyne	ADRB3	86	44
O=C([C@@H](CNC[C@@H](O)c1cccnc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819271654	GD	On-Demand	Anodyne	ADRB2	19	42
O=C([C@@H](CNC[C@@H](O)c1cccnc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819271654	GD	On-Demand	Anodyne	ADRB1	23	44
O=C([C@@H](CNC[C@@H](O)c1cccnc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819271654	GD	On-Demand	Anodyne	ADRB3	86	44
O[C@@H](CN[C@@H]1C[C@H]1c1cccc(F)c1)c1cccc(Cl)c1	ZINC000819271661	DH	On-Demand	Anodyne	ADRB3	40	40
C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)N1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819271698	GG	On-Demand	Anodyne	KCNJ1	40	32
C[C@H]1[C@H](c2ccccc2)OC[C@@H](C)N1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819271699	GG	On-Demand	Anodyne	KCNJ1	40	32
C[C@H]1[C@@H](c2ccccc2)OC[C@@H](C)N1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819271700	GG	On-Demand	Anodyne	KCNJ1	40	32
C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)N1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819271701	GG	On-Demand	Anodyne	KCNJ1	40	32
CC(=O)Nc1cccc(CC(=O)N2CCCC[C@@H]2CN2CCCC2=O)c1	ZINC000819271708	FE	On-Demand	Anodyne	OPRK1	25	53
CC(=O)Nc1cccc(CC(=O)N2CCCC[C@H]2CN2CCCC2=O)c1	ZINC000819271709	FE	On-Demand	Anodyne	OPRK1	25	53
CS(=O)(=O)c1cccnc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819271710	ED	On-Demand	Anodyne	ADRB1	36	41
CS(=O)(=O)c1cccnc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819271710	ED	On-Demand	Anodyne	ADRB3	63	43
CS(=O)(=O)c1cccnc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819271711	ED	On-Demand	Anodyne	ADRB1	36	41
CS(=O)(=O)c1cccnc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819271711	ED	On-Demand	Anodyne	ADRB3	63	43
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819271712	FD	On-Demand	Anodyne	GPR119	52	51
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819271713	FD	On-Demand	Anodyne	GPR119	52	51
Cn1nnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819271720	GC	On-Demand	Anodyne	CTSD	85	43
Cn1nnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819271720	GC	On-Demand	Anodyne	PGC	59	40
Cn1nnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819271720	GC	On-Demand	Anodyne	PAPA1_CARPA	34	44
Cn1nnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819271720	GC	On-Demand	Anodyne	CCKAR	52	38
Cn1nnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819271720	GC	On-Demand	Anodyne	CTSL	17	44
Cn1nnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819271720	GC	On-Demand	Anodyne	PGA	42	40
Cn1nnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819271720	GC	On-Demand	Anodyne	BACE2	45	41
Cn1nnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819271720	GC	On-Demand	Anodyne	TACR3	15	40
Cn1nnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819271720	GC	On-Demand	Anodyne	CAPNS1	46	30
Cn1nnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819271720	GC	On-Demand	Anodyne	REN	91	47
Cn1nnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819271720	GC	On-Demand	Anodyne	REN1	38	49
Cn1nnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819271720	GC	On-Demand	Anodyne	BACE1	81	44
Cn1nnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819271720	GC	On-Demand	Anodyne	FPR1	54	41
Cn1nnc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819271720	GC	On-Demand	Anodyne	PLM2_PLAFA	43	34
CSC1(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCC1	ZINC000819271725	FF	On-Demand	Anodyne	GPR119	26	40
CSC1(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCC1	ZINC000819271726	FF	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CC[C@H](NC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)C1	ZINC000819271736	GH	On-Demand	Anodyne	GPR119	23	42
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)C1	ZINC000819271737	GH	On-Demand	Anodyne	GPR119	23	42
C[C@H](CC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)n1cccn1	ZINC000819271784	DD	On-Demand	Anodyne	GPR119	28	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3ccccc3)C[C@H]1C)C2	ZINC000819271824	GF	On-Demand	Anodyne	DRD4	40	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3ccccc3)C[C@H]1C)C2	ZINC000819271824	GF	On-Demand	Anodyne	ACHE	36	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3ccccc3)C[C@H]1C)C2	ZINC000819271824	GF	On-Demand	Anodyne	SIGMAR1	45	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3ccccc3)C[C@H]1C)C2	ZINC000819271824	GF	On-Demand	Anodyne	CCR1	20	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3ccccc3)C[C@H]1C)C2	ZINC000819271825	GF	On-Demand	Anodyne	DRD4	40	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3ccccc3)C[C@H]1C)C2	ZINC000819271825	GF	On-Demand	Anodyne	ACHE	36	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3ccccc3)C[C@H]1C)C2	ZINC000819271825	GF	On-Demand	Anodyne	SIGMAR1	45	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3ccccc3)C[C@H]1C)C2	ZINC000819271825	GF	On-Demand	Anodyne	CCR1	20	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(OCCCN(C)C)c1)C2	ZINC000819271830	GF	On-Demand	Anodyne	EPHX2	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(OCCCN(C)C)c1)C2	ZINC000819271831	GF	On-Demand	Anodyne	EPHX2	20	40
O[C@@H](CNC[C@@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819271846	EH	On-Demand	Anodyne	ADRB2	18	44
O[C@@H](CNC[C@@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819271846	EH	On-Demand	Anodyne	ADRB1	39	42
O[C@@H](CNC[C@@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819271846	EH	On-Demand	Anodyne	ADRB3	51	42
O[C@@H](CNC[C@@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819271846	EH	On-Demand	Anodyne	CYP3A4	46	35
O[C@H](CNC[C@@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819271847	EH	On-Demand	Anodyne	ADRB2	18	44
O[C@H](CNC[C@@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819271847	EH	On-Demand	Anodyne	ADRB1	39	42
O[C@H](CNC[C@@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819271847	EH	On-Demand	Anodyne	ADRB3	51	42
O[C@H](CNC[C@@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819271847	EH	On-Demand	Anodyne	CYP3A4	46	35
O[C@H](CNC[C@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819271848	EH	On-Demand	Anodyne	ADRB2	18	44
O[C@H](CNC[C@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819271848	EH	On-Demand	Anodyne	ADRB1	39	42
O[C@H](CNC[C@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819271848	EH	On-Demand	Anodyne	ADRB3	51	42
O[C@H](CNC[C@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819271848	EH	On-Demand	Anodyne	CYP3A4	46	35
O[C@@H](CNC[C@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819271849	EH	On-Demand	Anodyne	ADRB2	18	44
O[C@@H](CNC[C@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819271849	EH	On-Demand	Anodyne	ADRB1	39	42
O[C@@H](CNC[C@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819271849	EH	On-Demand	Anodyne	ADRB3	51	42
O[C@@H](CNC[C@H]1CCCN(c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819271849	EH	On-Demand	Anodyne	CYP3A4	46	35
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H]1CCCN(c2ccccc2)C1	ZINC000819271868	GF	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H]1CCCN(c2ccccc2)C1	ZINC000819271868	GF	On-Demand	Anodyne	PREP	22	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H]1CCCN(c2ccccc2)C1	ZINC000819271869	GF	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H]1CCCN(c2ccccc2)C1	ZINC000819271869	GF	On-Demand	Anodyne	PREP	22	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H]1CCCN(c2ccccc2)C1	ZINC000819271870	GF	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H]1CCCN(c2ccccc2)C1	ZINC000819271870	GF	On-Demand	Anodyne	PREP	22	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H]1CCCN(c2ccccc2)C1	ZINC000819271871	GF	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H]1CCCN(c2ccccc2)C1	ZINC000819271871	GF	On-Demand	Anodyne	PREP	22	40
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@H]2c2cccc(Br)c2)c1	ZINC000819271877	GH	On-Demand	Bother	CACNA1D	56	33
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@H]2c2cccc(Br)c2)c1	ZINC000819271878	GH	On-Demand	Bother	CACNA1D	56	33
CS(=O)(=O)c1cccnc1CNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819271903	FE	On-Demand	Anodyne	ADRB3	26	40
CS(=O)(=O)c1cccnc1CNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819271904	FE	On-Demand	Anodyne	ADRB3	26	40
O[C@@H](CN[C@H]1[C@H]2CCC[C@H]21)c1ccccc1	ZINC000819271905	BE	On-Demand	Anodyne	AOC3	15	49
O[C@@H](CN[C@@H]1[C@H]2CCC[C@H]21)c1ccccc1	ZINC000819271906	BE	On-Demand	Anodyne	AOC3	15	49
O[C@H](CN[C@@H]1[C@H]2CCC[C@H]21)c1ccccc1	ZINC000819271907	BE	On-Demand	Anodyne	AOC3	15	49
O[C@H](CN[C@H]1[C@H]2CCC[C@H]21)c1ccccc1	ZINC000819271908	BE	On-Demand	Anodyne	AOC3	15	49
COc1ccc(OC)c([C@H](O)CNCCCOc2cccc(C)c2C)c1	ZINC000819271922	FG	On-Demand	Anodyne	ADRB2	28	42
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272001	EF	On-Demand	Anodyne	ESR1	83	37
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272001	EF	On-Demand	Anodyne	ESR2	58	38
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272001	EF	On-Demand	Anodyne	LTA4H	62	45
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272001	EF	On-Demand	Anodyne	HRH3	59	46
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272001	EF	On-Demand	Anodyne	PSMB2	44	44
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272001	EF	On-Demand	Anodyne	PSMB1	48	44
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272002	EF	On-Demand	Anodyne	ESR1	83	37
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272002	EF	On-Demand	Anodyne	ESR2	58	38
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272002	EF	On-Demand	Anodyne	LTA4H	62	45
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272002	EF	On-Demand	Anodyne	HRH3	59	46
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272002	EF	On-Demand	Anodyne	PSMB2	44	44
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272002	EF	On-Demand	Anodyne	PSMB1	48	44
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272003	EF	On-Demand	Anodyne	ESR1	83	37
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272003	EF	On-Demand	Anodyne	ESR2	58	38
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272003	EF	On-Demand	Anodyne	LTA4H	62	45
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272003	EF	On-Demand	Anodyne	HRH3	59	46
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272003	EF	On-Demand	Anodyne	PSMB2	44	44
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272003	EF	On-Demand	Anodyne	PSMB1	48	44
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272004	EF	On-Demand	Anodyne	ESR1	83	37
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272004	EF	On-Demand	Anodyne	ESR2	58	38
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272004	EF	On-Demand	Anodyne	LTA4H	62	45
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272004	EF	On-Demand	Anodyne	HRH3	59	46
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272004	EF	On-Demand	Anodyne	PSMB2	44	44
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(OCCN2CCCC2)cc1	ZINC000819272004	EF	On-Demand	Anodyne	PSMB1	48	44
COc1cccc([S@@](=O)CC(=O)NNC(=O)C2CCC2)c1	ZINC000819272029	DC	On-Demand	Reactive	DRD4	41	31
COc1cccc([S@@](=O)CC(=O)NNC(=O)C2CCC2)c1	ZINC000819272029	DC	On-Demand	Reactive	NQO2	22	44
COc1cccc([S@@](=O)CC(=O)NNC(=O)C2CCC2)c1	ZINC000819272029	DC	On-Demand	Reactive	MTNR1A	42	44
COc1cccc([S@@](=O)CC(=O)NNC(=O)C2CCC2)c1	ZINC000819272029	DC	On-Demand	Reactive	MTNR1B	45	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC1(N2CCCCC2)CCOCC1	ZINC000819272035	GE	On-Demand	Anodyne	HCN1	52	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC1(N2CCCCC2)CCOCC1	ZINC000819272035	GE	On-Demand	Anodyne	HCN4	48	30
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCCN(c3ccccc3)C2)c1	ZINC000819272036	FG	On-Demand	Anodyne	HTR1A	15	42
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCCN(c3ccccc3)C2)c1	ZINC000819272036	FG	On-Demand	Anodyne	DRD2	15	42
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCCN(c3ccccc3)C2)c1	ZINC000819272037	FG	On-Demand	Anodyne	HTR1A	15	42
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCCN(c3ccccc3)C2)c1	ZINC000819272037	FG	On-Demand	Anodyne	DRD2	15	42
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000819272053	ED	On-Demand	Anodyne	PGA5	44	34
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000819272054	ED	On-Demand	Anodyne	PGA5	44	34
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000819272055	ED	On-Demand	Anodyne	PGA5	44	34
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000819272056	ED	On-Demand	Anodyne	PGA5	44	34
O=C(/C=C/c1ccc2ccccc2n1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272065	HK	On-Demand	Anodyne	CYSLTR1	24	41
O=C(/C=C/c1ccc2ccccc2n1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272065	HK	On-Demand	Anodyne	UL80	33	42
O=C(/C=C/c1ccc2ccccc2n1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272065	HK	On-Demand	Anodyne	HDAC8	21	43
O=C(/C=C/c1ccc2ccccc2n1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272065	HK	On-Demand	Anodyne	KCNK3	54	35
O=C(/C=C\c1ccc2ccccc2n1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272066	HK	On-Demand	Anodyne	CYSLTR1	24	41
O=C(/C=C\c1ccc2ccccc2n1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272066	HK	On-Demand	Anodyne	UL80	33	42
O=C(/C=C\c1ccc2ccccc2n1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272066	HK	On-Demand	Anodyne	HDAC8	21	43
O=C(/C=C\c1ccc2ccccc2n1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272066	HK	On-Demand	Anodyne	KCNK3	54	35
CN(C)CCCOc1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819272096	DF	On-Demand	Anodyne	EPHX2	18	42
CN(C)CCCOc1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819272097	DF	On-Demand	Anodyne	EPHX2	18	42
CN(C)CCCOc1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819272098	DF	On-Demand	Anodyne	EPHX2	18	42
CN(C)CCCOc1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819272099	DF	On-Demand	Anodyne	EPHX2	18	42
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819272102	CG	On-Demand	Anodyne	SLC6A3	22	43
O[C@H](CN[C@@H]1C[C@H]1c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819272103	CG	On-Demand	Anodyne	SLC6A3	22	43
O[C@H](CN[C@@H]1C[C@H]1c1cccc(Br)c1)c1cccnc1	ZINC000819272107	EG	On-Demand	Anodyne	ADRB3	44	40
O[C@@H](CN[C@@H]1C[C@H]1c1cccc(Br)c1)c1cccnc1	ZINC000819272108	EG	On-Demand	Anodyne	ADRB3	44	40
CC(=O)Nc1ccc(CNC[C@H](O)c2cccc(F)c2)cn1	ZINC000819272116	DE	On-Demand	Anodyne	ADRB1	34	45
CC(=O)Nc1ccc(CNC[C@H](O)c2cccc(F)c2)cn1	ZINC000819272116	DE	On-Demand	Anodyne	ADRB3	62	45
CC(=O)Nc1ccc(CNC[C@@H](O)c2cccc(F)c2)cn1	ZINC000819272117	DE	On-Demand	Anodyne	ADRB1	34	45
CC(=O)Nc1ccc(CNC[C@@H](O)c2cccc(F)c2)cn1	ZINC000819272117	DE	On-Demand	Anodyne	ADRB3	62	45
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@H]2c2cccc(F)c2)c1	ZINC000819272152	DF	On-Demand	Bother	CACNA1D	58	36
CC(=O)Nc1ccc(CNC[C@H](O)c2cccc(Br)c2)cn1	ZINC000819272155	FF	On-Demand	Anodyne	ADRB3	55	37
CC(=O)Nc1ccc(CNC[C@@H](O)c2cccc(Br)c2)cn1	ZINC000819272156	FF	On-Demand	Anodyne	ADRB3	55	37
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@H]2c2ccc(F)cc2)CC1	ZINC000819272157	GG	On-Demand	Anodyne	GPR119	45	52
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@H]2c2ccc(F)cc2)CC1	ZINC000819272157	GG	On-Demand	Anodyne	KDM1A	23	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@H]2c2ccc(F)cc2)CC1	ZINC000819272158	GG	On-Demand	Anodyne	GPR119	45	52
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@H]2c2ccc(F)cc2)CC1	ZINC000819272158	GG	On-Demand	Anodyne	KDM1A	23	40
O=C([C@@H](CNC[C@H](O)c1ccccc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819272172	GE	On-Demand	Anodyne	TRY2_BOVIN	59	40
O=C([C@@H](CNC[C@H](O)c1ccccc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819272172	GE	On-Demand	Anodyne	CPA1	15	44
O=C([C@H](CNC[C@H](O)c1ccccc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819272173	GE	On-Demand	Anodyne	TRY2_BOVIN	59	40
O=C([C@H](CNC[C@H](O)c1ccccc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819272173	GE	On-Demand	Anodyne	CPA1	15	44
O=C([C@H](CNC[C@@H](O)c1ccccc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819272174	GE	On-Demand	Anodyne	TRY2_BOVIN	59	40
O=C([C@H](CNC[C@@H](O)c1ccccc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819272174	GE	On-Demand	Anodyne	CPA1	15	44
O=C([C@@H](CNC[C@@H](O)c1ccccc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819272175	GE	On-Demand	Anodyne	TRY2_BOVIN	59	40
O=C([C@@H](CNC[C@@H](O)c1ccccc1)Cc1cccc(F)c1)N1CCOCC1	ZINC000819272175	GE	On-Demand	Anodyne	CPA1	15	44
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819272176	FG	On-Demand	Bother	SSTR1	32	41
O=[N+]([O-])c1ccc([C@H](O)CNC[C@@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819272177	FG	On-Demand	Bother	SSTR1	32	41
O=[N+]([O-])c1ccc([C@H](O)CNC[C@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819272178	FG	On-Demand	Bother	SSTR1	32	41
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819272179	FG	On-Demand	Bother	SSTR1	32	41
CN(C)CCCOc1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819272206	DG	On-Demand	Anodyne	HRH2	24	40
CN(C)CCCOc1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819272206	DG	On-Demand	Anodyne	EPHX2	18	41
CN(C)CCCOc1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819272206	DG	On-Demand	Anodyne	TAAR1	23	40
CC(=O)Nc1ccc(CNC[C@H](O)c2ccc(C)cc2)cn1	ZINC000819272207	CE	On-Demand	Anodyne	ADRB3	33	40
CC(=O)Nc1ccc(CNC[C@@H](O)c2ccc(C)cc2)cn1	ZINC000819272208	CE	On-Demand	Anodyne	ADRB3	33	40
C=C(C)C(C)(C)C(=O)NCc1ccc(Br)cc1F	ZINC000819272211	DH	On-Demand	Mild	AKR1B1	19	42
CC(=O)Nc1ccc(CNC[C@H](O)c2ccc(Cl)cc2Cl)cn1	ZINC000819272230	FG	On-Demand	Anodyne	F10	22	40
CC(=O)Nc1ccc(CNC[C@@H](O)c2ccc(Cl)cc2Cl)cn1	ZINC000819272231	FG	On-Demand	Anodyne	F10	22	40
CSC1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819272234	CE	On-Demand	Bother	CACNA1D	40	33
CSC1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819272235	CE	On-Demand	Bother	CACNA1D	40	33
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(F)cc1)c1cccc(C(F)(F)F)c1	ZINC000819272239	EI	On-Demand	Anodyne	TACR1	46	37
O[C@H](CN[C@@H]1C[C@H]1c1ccc(F)cc1)c1cccc(C(F)(F)F)c1	ZINC000819272240	EI	On-Demand	Anodyne	TACR1	46	37
O[C@@H](CNC[C@@H]1CCCN(c2ccccc2)C1)c1ccccc1Cl	ZINC000819272241	EH	On-Demand	Anodyne	OPRL1	31	40
O[C@@H](CNC[C@H]1CCCN(c2ccccc2)C1)c1ccccc1Cl	ZINC000819272242	EH	On-Demand	Anodyne	OPRL1	31	40
CC(=O)Nc1ccc(CNC[C@H](O)c2ccccc2)cn1	ZINC000819272245	CD	On-Demand	Anodyne	ADRB2	17	40
CC(=O)Nc1ccc(CNC[C@H](O)c2ccccc2)cn1	ZINC000819272245	CD	On-Demand	Anodyne	ADRB1	45	40
CC(=O)Nc1ccc(CNC[C@H](O)c2ccccc2)cn1	ZINC000819272245	CD	On-Demand	Anodyne	ADRB3	80	47
CC(=O)Nc1ccc(CNC[C@@H](O)c2ccccc2)cn1	ZINC000819272246	CD	On-Demand	Anodyne	ADRB2	17	40
CC(=O)Nc1ccc(CNC[C@@H](O)c2ccccc2)cn1	ZINC000819272246	CD	On-Demand	Anodyne	ADRB1	45	40
CC(=O)Nc1ccc(CNC[C@@H](O)c2ccccc2)cn1	ZINC000819272246	CD	On-Demand	Anodyne	ADRB3	80	47
CS(=O)(=O)c1ccc([C@H](O)CNC[C@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819272258	GF	On-Demand	Anodyne	ADRB2	16	42
CS(=O)(=O)c1ccc([C@H](O)CNC[C@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819272258	GF	On-Demand	Anodyne	ADRB3	31	42
CS(=O)(=O)c1ccc([C@H](O)CNC[C@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819272258	GF	On-Demand	Anodyne	CCR5	18	40
CS(=O)(=O)c1ccc([C@H](O)CNC[C@@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819272259	GF	On-Demand	Anodyne	ADRB2	16	42
CS(=O)(=O)c1ccc([C@H](O)CNC[C@@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819272259	GF	On-Demand	Anodyne	ADRB3	31	42
CS(=O)(=O)c1ccc([C@H](O)CNC[C@@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819272259	GF	On-Demand	Anodyne	CCR5	18	40
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819272260	GF	On-Demand	Anodyne	ADRB2	16	42
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819272260	GF	On-Demand	Anodyne	ADRB3	31	42
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819272260	GF	On-Demand	Anodyne	CCR5	18	40
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819272261	GF	On-Demand	Anodyne	ADRB2	16	42
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819272261	GF	On-Demand	Anodyne	ADRB3	31	42
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@@H]2CCCN(c3ccccc3)C2)cc1	ZINC000819272261	GF	On-Demand	Anodyne	CCR5	18	40
CC(=O)Nc1ccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)cn1	ZINC000819272263	FF	On-Demand	Anodyne	ADRB3	47	37
CC(=O)Nc1ccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)cn1	ZINC000819272263	FF	On-Demand	Anodyne	PDS	42	34
CC(=O)Nc1ccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)cn1	ZINC000819272264	FF	On-Demand	Anodyne	ADRB3	47	37
CC(=O)Nc1ccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)cn1	ZINC000819272264	FF	On-Demand	Anodyne	PDS	42	34
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(F)cc1)c1ccc(Br)cc1	ZINC000819272265	FH	On-Demand	Anodyne	SLC6A3	20	40
O[C@H](CN[C@@H]1C[C@H]1c1ccc(F)cc1)c1ccc(Br)cc1	ZINC000819272266	FH	On-Demand	Anodyne	SLC6A3	20	40
CC(=O)Nc1ccc(CNC[C@H](O)c2ccc(F)cc2C)cn1	ZINC000819272286	DE	On-Demand	Anodyne	LEF	63	33
CC(=O)Nc1ccc(CNC[C@@H](O)c2ccc(F)cc2C)cn1	ZINC000819272287	DE	On-Demand	Anodyne	LEF	63	33
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(F)cc1)c1ccccc1C(F)(F)F	ZINC000819272297	EI	On-Demand	Anodyne	KDM1A	23	41
O[C@H](CN[C@@H]1C[C@H]1c1ccc(F)cc1)c1ccccc1C(F)(F)F	ZINC000819272298	EI	On-Demand	Anodyne	KDM1A	23	41
O[C@@H](CN[C@@H]1C[C@H]1c1cccc(F)c1)c1cccnc1	ZINC000819272306	CE	On-Demand	Anodyne	ADRB1	17	41
O[C@@H](CN[C@@H]1C[C@H]1c1cccc(F)c1)c1cccnc1	ZINC000819272306	CE	On-Demand	Anodyne	ADRB3	53	41
CN(C)CCCOc1cccc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819272311	GF	On-Demand	Anodyne	EPHX2	20	43
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](c2ccc(Cl)cc2)C1	ZINC000819272315	DG	On-Demand	Anodyne	CCR1	33	42
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](c2ccc(Cl)cc2)C1	ZINC000819272316	DG	On-Demand	Anodyne	CCR1	33	42
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](c2ccc(Cl)cc2)C1	ZINC000819272317	DG	On-Demand	Anodyne	CCR1	33	42
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](c2ccc(Cl)cc2)C1	ZINC000819272318	DG	On-Demand	Anodyne	CCR1	33	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCCC(=O)N1Cc2ccccc2C1	ZINC000819272320	GE	On-Demand	Anodyne	ADAM9	46	33
C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819272353	DE	On-Demand	Anodyne	DRD4	41	38
C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819272353	DE	On-Demand	Anodyne	SLC6A1	42	32
C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819272353	DE	On-Demand	Anodyne	SIGMAR1	40	39
C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819272353	DE	On-Demand	Anodyne	CCR1	21	46
C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819272354	DE	On-Demand	Anodyne	DRD4	41	38
C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819272354	DE	On-Demand	Anodyne	SLC6A1	42	32
C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819272354	DE	On-Demand	Anodyne	SIGMAR1	40	39
C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819272354	DE	On-Demand	Anodyne	CCR1	21	46
C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819272355	DE	On-Demand	Anodyne	DRD4	41	38
C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819272355	DE	On-Demand	Anodyne	SLC6A1	42	32
C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819272355	DE	On-Demand	Anodyne	SIGMAR1	40	39
C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819272355	DE	On-Demand	Anodyne	CCR1	21	46
C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819272356	DE	On-Demand	Anodyne	DRD4	41	38
C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819272356	DE	On-Demand	Anodyne	SLC6A1	42	32
C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819272356	DE	On-Demand	Anodyne	SIGMAR1	40	39
C[C@@H]1CN(Cc2ccccc2)CCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819272356	DE	On-Demand	Anodyne	CCR1	21	46
O[C@@H](CN[C@@H]1C[C@H]1C1CCCCC1)c1ccc(F)cc1	ZINC000819272381	CG	On-Demand	Anodyne	SLC6A3	15	43
CC(C)(C)OC(=O)CS(=O)(=O)CCNC[C@@H]1CCCN(c2ccccc2)C1	ZINC000819272382	GE	On-Demand	Anodyne	SFRP1	51	35
CC(C)(C)OC(=O)CS(=O)(=O)CCNC[C@H]1CCCN(c2ccccc2)C1	ZINC000819272383	GE	On-Demand	Anodyne	SFRP1	51	35
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000819272389	DH	On-Demand	Anodyne	ADRB1	28	42
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000819272389	DH	On-Demand	Anodyne	ADRB3	41	42
O[C@H](CN[C@@H]1C[C@H]1c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000819272390	DH	On-Demand	Anodyne	ADRB1	28	42
O[C@H](CN[C@@H]1C[C@H]1c1ccc(F)cc1)c1cccc(Cl)c1	ZINC000819272390	DH	On-Demand	Anodyne	ADRB3	41	42
CC(=O)Nc1ccc(CNC[C@H](O)c2cccnc2)cn1	ZINC000819272427	CD	On-Demand	Anodyne	ADRB2	26	48
CC(=O)Nc1ccc(CNC[C@H](O)c2cccnc2)cn1	ZINC000819272427	CD	On-Demand	Anodyne	ADRB1	43	48
CC(=O)Nc1ccc(CNC[C@H](O)c2cccnc2)cn1	ZINC000819272427	CD	On-Demand	Anodyne	ADRB3	121	49
CC(=O)Nc1ccc(CNC[C@@H](O)c2cccnc2)cn1	ZINC000819272428	CD	On-Demand	Anodyne	ADRB2	26	48
CC(=O)Nc1ccc(CNC[C@@H](O)c2cccnc2)cn1	ZINC000819272428	CD	On-Demand	Anodyne	ADRB1	43	48
CC(=O)Nc1ccc(CNC[C@@H](O)c2cccnc2)cn1	ZINC000819272428	CD	On-Demand	Anodyne	ADRB3	121	49
CN(Cc1nc2ccccc2n1C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272435	GG	On-Demand	Mild	PAPA1_CARPA	45	41
CN(Cc1nc2ccccc2n1C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272436	GG	On-Demand	Mild	PAPA1_CARPA	45	41
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H]1CCN(C2CC2)C1	ZINC000819272453	FE	On-Demand	Mild	PAPA1_CARPA	30	42
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H]1CCN(C2CC2)C1	ZINC000819272454	FE	On-Demand	Mild	PAPA1_CARPA	30	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@H]2c2cccc(F)c2)CC1	ZINC000819272463	GG	On-Demand	Anodyne	CCR5	87	36
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@H]2c2cccc(F)c2)CC1	ZINC000819272463	GG	On-Demand	Anodyne	GPR119	41	56
CON(C)C(=O)CCNC[C@@H]1CCCN(c2ccccc2)C1	ZINC000819272464	DD	On-Demand	Anodyne	SLC6A1	44	31
CON(C)C(=O)CCNC[C@H]1CCCN(c2ccccc2)C1	ZINC000819272465	DD	On-Demand	Anodyne	SLC6A1	44	31
O=C(NCC1(N2CCCCC2)CCOCC1)C(F)=C1CCC1	ZINC000819272467	DF	On-Demand	Anodyne	HCN1	51	35
O=C(NCC1(N2CCCCC2)CCOCC1)C(F)=C1CCC1	ZINC000819272467	DF	On-Demand	Anodyne	HCN4	47	30
O=C(NCc1ccc(Br)cc1F)C(F)=C1CCC1	ZINC000819272477	DH	On-Demand	Anodyne	AKR1B1	19	44
CC(=O)Nc1ccc(CNC[C@H](O)c2cc(F)ccc2F)cn1	ZINC000819272478	DE	On-Demand	Anodyne	LEF	55	34
CC(=O)Nc1ccc(CNC[C@@H](O)c2cc(F)ccc2F)cn1	ZINC000819272479	DE	On-Demand	Anodyne	LEF	55	34
CC(C)(C)OC(=O)NCC[C@H](O)CNC[C@@H]1CCCN(c2ccccc2)C1	ZINC000819272483	GF	On-Demand	Anodyne	PGC	40	33
CC(C)(C)OC(=O)NCC[C@H](O)CNC[C@@H]1CCCN(c2ccccc2)C1	ZINC000819272483	GF	On-Demand	Anodyne	ACACB	15	40
CC(C)(C)OC(=O)NCC[C@H](O)CNC[C@@H]1CCCN(c2ccccc2)C1	ZINC000819272483	GF	On-Demand	Anodyne	REN	60	39
CC(C)(C)OC(=O)NCC[C@@H](O)CNC[C@H]1CCCN(c2ccccc2)C1	ZINC000819272484	GF	On-Demand	Anodyne	PGC	40	33
CC(C)(C)OC(=O)NCC[C@@H](O)CNC[C@H]1CCCN(c2ccccc2)C1	ZINC000819272484	GF	On-Demand	Anodyne	ACACB	15	40
CC(C)(C)OC(=O)NCC[C@@H](O)CNC[C@H]1CCCN(c2ccccc2)C1	ZINC000819272484	GF	On-Demand	Anodyne	REN	60	39
CC(C)(C)OC(=O)NCC[C@H](O)CNC[C@H]1CCCN(c2ccccc2)C1	ZINC000819272485	GF	On-Demand	Anodyne	PGC	40	33
CC(C)(C)OC(=O)NCC[C@H](O)CNC[C@H]1CCCN(c2ccccc2)C1	ZINC000819272485	GF	On-Demand	Anodyne	ACACB	15	40
CC(C)(C)OC(=O)NCC[C@H](O)CNC[C@H]1CCCN(c2ccccc2)C1	ZINC000819272485	GF	On-Demand	Anodyne	REN	60	39
CC(C)(C)OC(=O)NCC[C@@H](O)CNC[C@@H]1CCCN(c2ccccc2)C1	ZINC000819272486	GF	On-Demand	Anodyne	PGC	40	33
CC(C)(C)OC(=O)NCC[C@@H](O)CNC[C@@H]1CCCN(c2ccccc2)C1	ZINC000819272486	GF	On-Demand	Anodyne	ACACB	15	40
CC(C)(C)OC(=O)NCC[C@@H](O)CNC[C@@H]1CCCN(c2ccccc2)C1	ZINC000819272486	GF	On-Demand	Anodyne	REN	60	39
CC(=O)Nc1ccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cn1	ZINC000819272507	FF	On-Demand	Anodyne	ADRB3	30	43
O[C@H](CN[C@@H]1C[C@H]1c1ccc(F)cc1)c1cccnc1	ZINC000819272514	CE	On-Demand	Anodyne	ADRB3	63	40
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(F)cc1)c1cccnc1	ZINC000819272515	CE	On-Demand	Anodyne	ADRB3	63	40
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@@H]2C[C@H]2c2cccc(F)c2)CC1	ZINC000819272516	GG	On-Demand	Anodyne	GPR119	24	42
CC(=O)Nc1ccc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	ZINC000819272539	GE	On-Demand	Anodyne	GPR119	54	44
CC(=O)Nc1ccc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	ZINC000819272540	GE	On-Demand	Anodyne	GPR119	54	44
CC(=O)Nc1ccc(CNC[C@H](O)c2ccc(Cl)cc2)cn1	ZINC000819272542	DF	On-Demand	Anodyne	ADRB1	23	40
CC(=O)Nc1ccc(CNC[C@H](O)c2ccc(Cl)cc2)cn1	ZINC000819272542	DF	On-Demand	Anodyne	F10	27	40
CC(=O)Nc1ccc(CNC[C@H](O)c2ccc(Cl)cc2)cn1	ZINC000819272542	DF	On-Demand	Anodyne	ADRB3	38	40
CS(=O)(=O)c1ccc([C@@H](O)CNCc2cc(F)c(Cl)cc2F)cc1	ZINC000819272543	GF	On-Demand	Anodyne	ADRB2	15	40
CS(=O)(=O)c1ccc([C@@H](O)CNCc2cc(F)c(Cl)cc2F)cc1	ZINC000819272543	GF	On-Demand	Anodyne	PTGS2	22	42
CS(=O)(=O)c1ccc([C@@H](O)CNCc2cc(F)c(Cl)cc2F)cc1	ZINC000819272543	GF	On-Demand	Anodyne	TRPV1	55	35
CS(=O)(=O)c1ccc([C@H](O)CNCc2cc(F)c(Cl)cc2F)cc1	ZINC000819272544	GF	On-Demand	Anodyne	ADRB2	15	40
CS(=O)(=O)c1ccc([C@H](O)CNCc2cc(F)c(Cl)cc2F)cc1	ZINC000819272544	GF	On-Demand	Anodyne	PTGS2	22	42
CS(=O)(=O)c1ccc([C@H](O)CNCc2cc(F)c(Cl)cc2F)cc1	ZINC000819272544	GF	On-Demand	Anodyne	TRPV1	55	35
O[C@@H](CN[C@@H]1C[C@H]1C1CCCCC1)c1cccnc1	ZINC000819272556	CF	On-Demand	Anodyne	ADRB1	22	42
O[C@@H](CN[C@@H]1C[C@H]1C1CCCCC1)c1cccnc1	ZINC000819272556	CF	On-Demand	Anodyne	ADRB3	67	43
C[C@@H](CC(=O)NCc1ccc(Br)cc1F)n1cccn1	ZINC000819272571	EG	On-Demand	Anodyne	AKR1B1	20	41
C[C@@H](CC(=O)NCc1ccc(Br)cc1F)n1cccn1	ZINC000819272571	EG	On-Demand	Anodyne	P2RX7	31	51
C[C@H](CC(=O)NCc1ccc(Br)cc1F)n1cccn1	ZINC000819272572	EG	On-Demand	Anodyne	AKR1B1	20	41
C[C@H](CC(=O)NCc1ccc(Br)cc1F)n1cccn1	ZINC000819272572	EG	On-Demand	Anodyne	P2RX7	31	51
O[C@@H](CNC[C@H]1CCCN(c2ccccc2)C1)c1cccnc1	ZINC000819272587	DF	On-Demand	Anodyne	ADRB2	22	41
O[C@@H](CNC[C@H]1CCCN(c2ccccc2)C1)c1cccnc1	ZINC000819272587	DF	On-Demand	Anodyne	ADRB1	24	40
O[C@@H](CNC[C@H]1CCCN(c2ccccc2)C1)c1cccnc1	ZINC000819272587	DF	On-Demand	Anodyne	ADRB3	85	44
O[C@@H](CNC[C@@H]1CCCN(c2ccccc2)C1)c1cccnc1	ZINC000819272588	DF	On-Demand	Anodyne	ADRB2	22	41
O[C@@H](CNC[C@@H]1CCCN(c2ccccc2)C1)c1cccnc1	ZINC000819272588	DF	On-Demand	Anodyne	ADRB1	24	40
O[C@@H](CNC[C@@H]1CCCN(c2ccccc2)C1)c1cccnc1	ZINC000819272588	DF	On-Demand	Anodyne	ADRB3	85	44
O[C@H](CNC[C@@H]1CCCN(c2ccccc2)C1)c1cccnc1	ZINC000819272589	DF	On-Demand	Anodyne	ADRB2	22	41
O[C@H](CNC[C@@H]1CCCN(c2ccccc2)C1)c1cccnc1	ZINC000819272589	DF	On-Demand	Anodyne	ADRB1	24	40
O[C@H](CNC[C@@H]1CCCN(c2ccccc2)C1)c1cccnc1	ZINC000819272589	DF	On-Demand	Anodyne	ADRB3	85	44
O[C@H](CNC[C@H]1CCCN(c2ccccc2)C1)c1cccnc1	ZINC000819272590	DF	On-Demand	Anodyne	ADRB2	22	41
O[C@H](CNC[C@H]1CCCN(c2ccccc2)C1)c1cccnc1	ZINC000819272590	DF	On-Demand	Anodyne	ADRB1	24	40
O[C@H](CNC[C@H]1CCCN(c2ccccc2)C1)c1cccnc1	ZINC000819272590	DF	On-Demand	Anodyne	ADRB3	85	44
Cc1nc(CN2CCC(CNC(=O)C(F)=C3CCC3)CC2)oc1C	ZINC000819272605	EG	On-Demand	Anodyne	CACNA1I	57	36
COCCONC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819272614	DD	On-Demand	Anodyne	ADRB2	29	45
COCCONC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819272614	DD	On-Demand	Anodyne	ADRB1	59	35
COCCONC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819272615	DD	On-Demand	Anodyne	ADRB2	29	45
COCCONC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819272615	DD	On-Demand	Anodyne	ADRB1	59	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H](C(=O)N2CCCC2)C1	ZINC000819272633	FD	On-Demand	Anodyne	PREP	20	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H](C(=O)N2CCCC2)C1	ZINC000819272634	FD	On-Demand	Anodyne	PREP	20	43
COCCONC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819272640	CC	On-Demand	Bother	ADRB2	25	44
COCCONC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819272640	CC	On-Demand	Bother	ADRB1	30	46
COCCONC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819272640	CC	On-Demand	Bother	CACNA1C	59	40
COCCONC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819272640	CC	On-Demand	Bother	ADRB3	17	46
COCCONC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819272640	CC	On-Demand	Bother	CACNA1D	91	40
COCCONC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819272640	CC	On-Demand	Bother	PDS	34	48
COCCONC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819272641	CC	On-Demand	Bother	ADRB2	25	44
COCCONC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819272641	CC	On-Demand	Bother	ADRB1	30	46
COCCONC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819272641	CC	On-Demand	Bother	CACNA1C	59	40
COCCONC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819272641	CC	On-Demand	Bother	ADRB3	17	46
COCCONC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819272641	CC	On-Demand	Bother	CACNA1D	91	40
COCCONC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819272641	CC	On-Demand	Bother	PDS	34	48
COCCONC[C@H](O)Cc1ccccc1	ZINC000819272642	BC	On-Demand	Anodyne	MME	67	43
COCCONC[C@H](O)Cc1ccccc1	ZINC000819272642	BC	On-Demand	Anodyne	ANPEP	41	33
COCCONC[C@H](O)Cc1ccccc1	ZINC000819272642	BC	On-Demand	Anodyne	CAPN2	54	33
COCCONC[C@@H](O)Cc1ccccc1	ZINC000819272643	BC	On-Demand	Anodyne	MME	67	43
COCCONC[C@@H](O)Cc1ccccc1	ZINC000819272643	BC	On-Demand	Anodyne	ANPEP	41	33
COCCONC[C@@H](O)Cc1ccccc1	ZINC000819272643	BC	On-Demand	Anodyne	CAPN2	54	33
COCCONC[C@H](O)c1cccnc1	ZINC000819272654	BC	On-Demand	Anodyne	ADRB2	21	43
COCCONC[C@H](O)c1cccnc1	ZINC000819272654	BC	On-Demand	Anodyne	ADRB1	24	45
COCCONC[C@H](O)c1cccnc1	ZINC000819272654	BC	On-Demand	Anodyne	ADRB3	89	49
COCCONC[C@H](O)c1cccnc1	ZINC000819272654	BC	On-Demand	Anodyne	KCNA5	23	40
COCCONC[C@H](O)c1cccnc1	ZINC000819272654	BC	On-Demand	Anodyne	CYP51A1	16	40
COCCONC[C@@H](O)c1cccnc1	ZINC000819272655	BC	On-Demand	Anodyne	ADRB2	21	43
COCCONC[C@@H](O)c1cccnc1	ZINC000819272655	BC	On-Demand	Anodyne	ADRB1	24	45
COCCONC[C@@H](O)c1cccnc1	ZINC000819272655	BC	On-Demand	Anodyne	ADRB3	89	49
COCCONC[C@@H](O)c1cccnc1	ZINC000819272655	BC	On-Demand	Anodyne	KCNA5	23	40
COCCONC[C@@H](O)c1cccnc1	ZINC000819272655	BC	On-Demand	Anodyne	CYP51A1	16	40
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272668	II	On-Demand	Anodyne	CA2	28	48
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272668	II	On-Demand	Anodyne	PPIA	40	37
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272668	II	On-Demand	Anodyne	CA1	29	41
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272668	II	On-Demand	Anodyne	CA4	26	45
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272668	II	On-Demand	Anodyne	CA5A	42	38
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272668	II	On-Demand	Anodyne	EPHX2	18	45
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272668	II	On-Demand	Anodyne	CA12	29	48
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272668	II	On-Demand	Anodyne	CA9	27	42
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272668	II	On-Demand	Anodyne	IDO1	28	42
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272668	II	On-Demand	Anodyne	MTCA1	43	47
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272668	II	On-Demand	Anodyne	P96878_MYCTU	54	47
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272668	II	On-Demand	Anodyne	KCNK3	77	46
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819272668	II	On-Demand	Anodyne	KCNK9	62	34
COCCONCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819272669	DE	On-Demand	Anodyne	KIT	15	42
COCCONCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819272669	DE	On-Demand	Anodyne	LCK	27	41
COCCONCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819272669	DE	On-Demand	Anodyne	RAF1	22	43
COCCONCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819272669	DE	On-Demand	Anodyne	KDR	18	40
COCCONCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819272669	DE	On-Demand	Anodyne	TEK	30	40
COCCONCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819272669	DE	On-Demand	Anodyne	BTK	20	41
COCCONCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819272669	DE	On-Demand	Anodyne	BRAF	24	40
COCCONCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819272669	DE	On-Demand	Anodyne	KCNK3	59	44
COCCONCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819272669	DE	On-Demand	Anodyne	KCNK9	59	38
COCCONCCC(=O)Nc1cccc(Br)c1	ZINC000819272670	DD	On-Demand	Anodyne	EGFR	36	44
COCCONCCC(=O)Nc1cccc(Br)c1	ZINC000819272670	DD	On-Demand	Anodyne	HDAC10	25	44
COCCONCCC(=O)Nc1cccc(Br)c1	ZINC000819272670	DD	On-Demand	Anodyne	HDAC2	16	44
COCCONCCC(=O)Nc1cccc(Br)c1	ZINC000819272670	DD	On-Demand	Anodyne	KCNK3	54	36
COCCONCCC(=O)Nc1cccc(Br)c1	ZINC000819272670	DD	On-Demand	Anodyne	KCNK9	49	36
C=CCOc1ccc(/C=C/C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819272700	IK	On-Demand	Mild	TSHR	52	31
C=CCOc1ccc(/C=C/C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819272700	IK	On-Demand	Mild	APP	19	41
C=CCOc1ccc(/C=C/C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819272700	IK	On-Demand	Mild	HDAC8	17	43
C=CCOc1ccc(/C=C/C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819272700	IK	On-Demand	Mild	MMP2	15	49
C=CCOc1ccc(/C=C/C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819272700	IK	On-Demand	Mild	MMP9	15	49
C=CCOc1ccc(/C=C/C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819272700	IK	On-Demand	Mild	KCNK3	49	38
C=CCOc1ccc(/C=C/C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819272700	IK	On-Demand	Mild	KCNK9	43	38
C=CCOc1ccc(/C=C\C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819272701	IK	On-Demand	Mild	TSHR	52	31
C=CCOc1ccc(/C=C\C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819272701	IK	On-Demand	Mild	APP	19	41
C=CCOc1ccc(/C=C\C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819272701	IK	On-Demand	Mild	HDAC8	17	43
C=CCOc1ccc(/C=C\C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819272701	IK	On-Demand	Mild	MMP2	15	49
C=CCOc1ccc(/C=C\C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819272701	IK	On-Demand	Mild	MMP9	15	49
C=CCOc1ccc(/C=C\C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819272701	IK	On-Demand	Mild	KCNK3	49	38
C=CCOc1ccc(/C=C\C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819272701	IK	On-Demand	Mild	KCNK9	43	38
COCCONC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819272711	CD	On-Demand	Anodyne	ADRB2	17	43
COCCONC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819272712	CD	On-Demand	Anodyne	ADRB2	17	43
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272713	FH	On-Demand	Mild	PAPA1_CARPA	59	48
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272713	FH	On-Demand	Mild	CCKAR	47	38
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272713	FH	On-Demand	Mild	CTSK	25	41
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272713	FH	On-Demand	Mild	CTSL	30	48
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272713	FH	On-Demand	Mild	REN	40	36
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272713	FH	On-Demand	Mild	CTSS	21	48
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272713	FH	On-Demand	Mild	FPR1	48	41
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272713	FH	On-Demand	Mild	PLM1_PLAFA	43	38
C[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272714	FH	On-Demand	Mild	PAPA1_CARPA	59	48
C[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272714	FH	On-Demand	Mild	CCKAR	47	38
C[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272714	FH	On-Demand	Mild	CTSK	25	41
C[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272714	FH	On-Demand	Mild	CTSL	30	48
C[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272714	FH	On-Demand	Mild	REN	40	36
C[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272714	FH	On-Demand	Mild	CTSS	21	48
C[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272714	FH	On-Demand	Mild	FPR1	48	41
C[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272714	FH	On-Demand	Mild	PLM1_PLAFA	43	38
C[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272715	FH	On-Demand	Mild	PAPA1_CARPA	59	48
C[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272715	FH	On-Demand	Mild	CCKAR	47	38
C[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272715	FH	On-Demand	Mild	CTSK	25	41
C[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272715	FH	On-Demand	Mild	CTSL	30	48
C[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272715	FH	On-Demand	Mild	REN	40	36
C[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272715	FH	On-Demand	Mild	CTSS	21	48
C[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272715	FH	On-Demand	Mild	FPR1	48	41
C[C@@H]1Cc2ccccc2[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272715	FH	On-Demand	Mild	PLM1_PLAFA	43	38
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272716	FH	On-Demand	Mild	PAPA1_CARPA	59	48
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272716	FH	On-Demand	Mild	CCKAR	47	38
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272716	FH	On-Demand	Mild	CTSK	25	41
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272716	FH	On-Demand	Mild	CTSL	30	48
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272716	FH	On-Demand	Mild	REN	40	36
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272716	FH	On-Demand	Mild	CTSS	21	48
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272716	FH	On-Demand	Mild	FPR1	48	41
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819272716	FH	On-Demand	Mild	PLM1_PLAFA	43	38
COCCONC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819272717	CD	On-Demand	Anodyne	ADRB2	26	66
COCCONC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819272717	CD	On-Demand	Anodyne	ADRB1	36	66
COCCONC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819272717	CD	On-Demand	Anodyne	SLC6A4	15	42
COCCONC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819272718	CD	On-Demand	Anodyne	ADRB2	26	66
COCCONC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819272718	CD	On-Demand	Anodyne	ADRB1	36	66
COCCONC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819272718	CD	On-Demand	Anodyne	SLC6A4	15	42
COCCONCCC(=O)Nc1cccnc1	ZINC000819272732	BC	On-Demand	Anodyne	NAMPT	33	43
COCCONCCC(=O)Nc1ccccc1	ZINC000819272735	BD	On-Demand	Anodyne	LPL	19	40
COCCONCCC(=O)Nc1ccccc1	ZINC000819272735	BD	On-Demand	Anodyne	LTA4H	34	41
COCCONCCC(=O)Nc1ccccc1	ZINC000819272735	BD	On-Demand	Anodyne	CPT1A	44	31
COCCONCCC(=O)Nc1ccccc1	ZINC000819272735	BD	On-Demand	Anodyne	HDAC8	15	46
COCCONCCC(=O)Nc1ccccc1	ZINC000819272735	BD	On-Demand	Anodyne	HDAC10	20	46
COCCONCCC(=O)Nc1ccccc1	ZINC000819272735	BD	On-Demand	Anodyne	MTNR1B	15	41
COCCONCCC(=O)Nc1ccccc1	ZINC000819272735	BD	On-Demand	Anodyne	HDAC2	19	46
COCCONCCC(=O)Nc1ccccc1	ZINC000819272735	BD	On-Demand	Anodyne	HDAC3	17	46
COCCONCCC(=O)Nc1ccccc1	ZINC000819272735	BD	On-Demand	Anodyne	HDAC6	17	46
COCCONCCC(=O)Nc1ccccc1	ZINC000819272735	BD	On-Demand	Anodyne	HDAC11	15	46
COCCONCCC(=O)Nc1ccccc1	ZINC000819272735	BD	On-Demand	Anodyne	KCNK3	40	35
COCCONC[C@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819272747	DE	On-Demand	Anodyne	ADRB2	22	40
COCCONC[C@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819272747	DE	On-Demand	Anodyne	VDR	23	45
COCCONC[C@@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819272748	DE	On-Demand	Anodyne	ADRB2	22	40
COCCONC[C@@H](O)COc1ccc(C(C)(C)C)cc1C	ZINC000819272748	DE	On-Demand	Anodyne	VDR	23	45
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(C3SCCS3)cc2)c1	ZINC000819272766	IK	On-Demand	Anodyne	PPIA	28	46
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(C3SCCS3)cc2)c1	ZINC000819272766	IK	On-Demand	Anodyne	PRNP	40	49
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(C3SCCS3)cc2)c1	ZINC000819272766	IK	On-Demand	Anodyne	EPHX2	27	44
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(C3SCCS3)cc2)c1	ZINC000819272766	IK	On-Demand	Anodyne	TAAR1	45	43
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(C3SCCS3)cc2)c1	ZINC000819272766	IK	On-Demand	Anodyne	KCNK3	135	51
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(C3SCCS3)cc2)c1	ZINC000819272766	IK	On-Demand	Anodyne	KCNK9	85	47
COCCONC[C@H](O)COc1ccc2ccccc2c1	ZINC000819272788	CD	On-Demand	Anodyne	ADRB2	48	62
COCCONC[C@H](O)COc1ccc2ccccc2c1	ZINC000819272788	CD	On-Demand	Anodyne	ADRB1	51	44
COCCONC[C@H](O)COc1ccc2ccccc2c1	ZINC000819272788	CD	On-Demand	Anodyne	CYSLTR1	17	43
COCCONC[C@H](O)COc1ccc2ccccc2c1	ZINC000819272788	CD	On-Demand	Anodyne	ADRB3	30	40
COCCONC[C@H](O)COc1ccc2ccccc2c1	ZINC000819272788	CD	On-Demand	Anodyne	CASR	41	38
COCCONC[C@H](O)COc1ccc2ccccc2c1	ZINC000819272788	CD	On-Demand	Anodyne	CYP2D6	17	44
COCCONC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819272789	CD	On-Demand	Anodyne	ADRB2	48	62
COCCONC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819272789	CD	On-Demand	Anodyne	ADRB1	51	44
COCCONC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819272789	CD	On-Demand	Anodyne	CYSLTR1	17	43
COCCONC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819272789	CD	On-Demand	Anodyne	ADRB3	30	40
COCCONC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819272789	CD	On-Demand	Anodyne	CASR	41	38
COCCONC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819272789	CD	On-Demand	Anodyne	CYP2D6	17	44
COCCONC[C@H](O)COc1cccc2ccccc12	ZINC000819272798	CD	On-Demand	Anodyne	ADRB2	39	62
COCCONC[C@H](O)COc1cccc2ccccc12	ZINC000819272798	CD	On-Demand	Anodyne	ADRB1	61	33
COCCONC[C@H](O)COc1cccc2ccccc12	ZINC000819272798	CD	On-Demand	Anodyne	ADRB3	16	62
COCCONC[C@H](O)COc1cccc2ccccc12	ZINC000819272798	CD	On-Demand	Anodyne	CYP2D6	23	47
COCCONC[C@H](O)COc1cccc2ccccc12	ZINC000819272798	CD	On-Demand	Anodyne	ABCB1	31	40
COCCONC[C@@H](O)COc1cccc2ccccc12	ZINC000819272799	CD	On-Demand	Anodyne	ADRB2	39	62
COCCONC[C@@H](O)COc1cccc2ccccc12	ZINC000819272799	CD	On-Demand	Anodyne	ADRB1	61	33
COCCONC[C@@H](O)COc1cccc2ccccc12	ZINC000819272799	CD	On-Demand	Anodyne	ADRB3	16	62
COCCONC[C@@H](O)COc1cccc2ccccc12	ZINC000819272799	CD	On-Demand	Anodyne	CYP2D6	23	47
COCCONC[C@@H](O)COc1cccc2ccccc12	ZINC000819272799	CD	On-Demand	Anodyne	ABCB1	31	40
COCCONC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819272818	DC	On-Demand	Anodyne	ADRB1	27	40
COCCONC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819272819	DC	On-Demand	Anodyne	ADRB1	27	40
COCCONC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819272823	EC	On-Demand	Clean	DRD4	45	38
COCCONC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819272823	EC	On-Demand	Clean	HTR2A	16	47
COCCONC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819272823	EC	On-Demand	Clean	ABCB1	41	41
COCCONC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819272824	EC	On-Demand	Clean	DRD4	45	38
COCCONC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819272824	EC	On-Demand	Clean	HTR2A	16	47
COCCONC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819272824	EC	On-Demand	Clean	ABCB1	41	41
COCCONCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819272854	EF	On-Demand	Anodyne	LTA4H	64	53
COCCONCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819272854	EF	On-Demand	Anodyne	CA1	42	44
COCCONCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819272854	EF	On-Demand	Anodyne	MTNR1A	20	52
COCCONCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819272854	EF	On-Demand	Anodyne	MTNR1B	24	52
COCCONCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819272854	EF	On-Demand	Anodyne	MMP2	18	44
COCCONCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819272854	EF	On-Demand	Anodyne	NPY5R	26	43
COCCONCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819272854	EF	On-Demand	Anodyne	CA12	15	44
COCCONCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819272854	EF	On-Demand	Anodyne	CA9	17	44
COCCONCCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000819272854	EF	On-Demand	Anodyne	F13A1	21	40
O=C(/C=C/[C@H]1CCCO1)N1CCC(Cc2ccccc2F)CC1	ZINC000819272864	DG	On-Demand	Anodyne	GRIN2B	22	42
O=C(/C=C/[C@@H]1CCCO1)N1CCC(Cc2ccccc2F)CC1	ZINC000819272865	DG	On-Demand	Anodyne	GRIN2B	22	42
O=C(/C=C\[C@@H]1CCCO1)N1CCC(Cc2ccccc2F)CC1	ZINC000819272866	DG	On-Demand	Anodyne	GRIN2B	22	42
O=C(/C=C\[C@H]1CCCO1)N1CCC(Cc2ccccc2F)CC1	ZINC000819272867	DG	On-Demand	Anodyne	GRIN2B	22	42
O=C(CCCc1cccs1)NNC(=O)c1cc2c(cn1)OCCO2	ZINC000819272881	ED	On-Demand	Reactive	PTPRF	19	42
COCCONC[C@@H](O)c1cccc(Cl)c1	ZINC000819272884	BD	On-Demand	Anodyne	ADRB2	26	47
COCCONC[C@@H](O)c1cccc(Cl)c1	ZINC000819272884	BD	On-Demand	Anodyne	ADRB1	44	47
COCCONC[C@@H](O)c1cccc(Cl)c1	ZINC000819272884	BD	On-Demand	Anodyne	ADRB3	58	47
COCCONC[C@H](O)c1cccc(Cl)c1	ZINC000819272885	BD	On-Demand	Anodyne	ADRB2	26	47
COCCONC[C@H](O)c1cccc(Cl)c1	ZINC000819272885	BD	On-Demand	Anodyne	ADRB1	44	47
COCCONC[C@H](O)c1cccc(Cl)c1	ZINC000819272885	BD	On-Demand	Anodyne	ADRB3	58	47
COCCONC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819272886	CC	On-Demand	Bother	CACNA1C	66	42
COCCONC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819272886	CC	On-Demand	Bother	CACNA1D	98	42
COCCONC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819272887	CC	On-Demand	Bother	CACNA1C	66	42
COCCONC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819272887	CC	On-Demand	Bother	CACNA1D	98	42
COCCONCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819272914	DD	On-Demand	Anodyne	CYNT	53	52
O=C(/C=C/[C@@H]1CCCO1)NNC(=O)CCCc1cccs1	ZINC000819272942	DD	On-Demand	Reactive	PTPRF	18	41
O=C(/C=C/[C@H]1CCCO1)NNC(=O)CCCc1cccs1	ZINC000819272943	DD	On-Demand	Reactive	PTPRF	18	41
O=C(/C=C\[C@H]1CCCO1)NNC(=O)CCCc1cccs1	ZINC000819272944	DD	On-Demand	Reactive	PTPRF	18	41
O=C(/C=C\[C@@H]1CCCO1)NNC(=O)CCCc1cccs1	ZINC000819272945	DD	On-Demand	Reactive	PTPRF	18	41
O=C(CCCc1cccs1)NNC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819272978	GH	On-Demand	Reactive	PTPRF	19	42
C[C@@H](NC(=O)CCc1cccc(OC(F)F)c1)c1nc2ccc(Cl)cc2[nH]1	ZINC000819272979	GJ	On-Demand	Anodyne	PRCP	17	60
C[C@H](NC(=O)CCc1cccc(OC(F)F)c1)c1nc2ccc(Cl)cc2[nH]1	ZINC000819272980	GJ	On-Demand	Anodyne	PRCP	17	60
COCCONC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819273005	DD	On-Demand	Anodyne	ADRB2	25	43
COCCONC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819273005	DD	On-Demand	Anodyne	ADRB1	29	43
COCCONC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819273005	DD	On-Demand	Anodyne	PDS	67	46
COCCONC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819273006	DD	On-Demand	Anodyne	ADRB2	25	43
COCCONC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819273006	DD	On-Demand	Anodyne	ADRB1	29	43
COCCONC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819273006	DD	On-Demand	Anodyne	PDS	67	46
C[C@@H](CNC[C@@H](O)c1cc2ccccc2o1)NC(=O)OC(C)(C)C	ZINC000819273015	EF	On-Demand	Anodyne	FPR1	40	34
C[C@H](CNC[C@@H](O)c1cc2ccccc2o1)NC(=O)OC(C)(C)C	ZINC000819273016	EF	On-Demand	Anodyne	FPR1	40	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(Oc3ccncc3)c1)C2	ZINC000819273023	GH	On-Demand	Anodyne	RAF1	15	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(Oc3ccncc3)c1)C2	ZINC000819273024	GH	On-Demand	Anodyne	RAF1	15	45
C[C@H](CNCCS(C)(=O)=O)NC(=O)OC(C)(C)C	ZINC000819273038	CC	On-Demand	Anodyne	CTSK	17	45
C[C@@H](CNCCS(C)(=O)=O)NC(=O)OC(C)(C)C	ZINC000819273039	CC	On-Demand	Anodyne	CTSK	17	45
C[C@H](CNC[C@@H](O)c1ccccc1C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819273040	FG	On-Demand	Anodyne	FPR1	45	37
C[C@@H](CNC[C@H](O)c1ccccc1C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819273041	FG	On-Demand	Anodyne	FPR1	45	37
C[C@H](CNC[C@H](O)c1ccccc1C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819273042	FG	On-Demand	Anodyne	FPR1	45	37
C[C@@H](CNC[C@@H](O)c1ccccc1C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819273043	FG	On-Demand	Anodyne	FPR1	45	37
O=C(Nc1ccccc1)Nc1cccc(NC(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)c1	ZINC000819273067	JJ	On-Demand	Anodyne	INHA	15	47
O=C(Nc1ccccc1)Nc1cccc(NC(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)c1	ZINC000819273067	JJ	On-Demand	Anodyne	LPL	43	34
O=C(Nc1ccccc1)Nc1cccc(NC(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)c1	ZINC000819273067	JJ	On-Demand	Anodyne	PTGER3	15	47
O=C(Nc1ccccc1)Nc1cccc(NC(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)c1	ZINC000819273067	JJ	On-Demand	Anodyne	P2RX7	47	57
O=C(Nc1ccccc1)Nc1cccc(NC(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)c1	ZINC000819273068	JJ	On-Demand	Anodyne	INHA	15	47
O=C(Nc1ccccc1)Nc1cccc(NC(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)c1	ZINC000819273068	JJ	On-Demand	Anodyne	LPL	43	34
O=C(Nc1ccccc1)Nc1cccc(NC(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)c1	ZINC000819273068	JJ	On-Demand	Anodyne	PTGER3	15	47
O=C(Nc1ccccc1)Nc1cccc(NC(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)c1	ZINC000819273068	JJ	On-Demand	Anodyne	P2RX7	47	57
O=C(/C=C/[C@H]1CCCO1)NCC1(N2CCSCC2)CCCCC1	ZINC000819273075	EF	On-Demand	Anodyne	HCN1	50	31
O=C(/C=C/[C@H]1CCCO1)NCC1(N2CCSCC2)CCCCC1	ZINC000819273075	EF	On-Demand	Anodyne	HCN4	49	31
O=C(/C=C/[C@@H]1CCCO1)NCC1(N2CCSCC2)CCCCC1	ZINC000819273076	EF	On-Demand	Anodyne	HCN1	50	31
O=C(/C=C/[C@@H]1CCCO1)NCC1(N2CCSCC2)CCCCC1	ZINC000819273076	EF	On-Demand	Anodyne	HCN4	49	31
O=C(/C=C\[C@H]1CCCO1)NCC1(N2CCSCC2)CCCCC1	ZINC000819273077	EF	On-Demand	Anodyne	HCN1	50	31
O=C(/C=C\[C@H]1CCCO1)NCC1(N2CCSCC2)CCCCC1	ZINC000819273077	EF	On-Demand	Anodyne	HCN4	49	31
O=C(/C=C\[C@@H]1CCCO1)NCC1(N2CCSCC2)CCCCC1	ZINC000819273078	EF	On-Demand	Anodyne	HCN1	50	31
O=C(/C=C\[C@@H]1CCCO1)NCC1(N2CCSCC2)CCCCC1	ZINC000819273078	EF	On-Demand	Anodyne	HCN4	49	31
C[C@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)NC(=O)OC(C)(C)C	ZINC000819273079	FD	On-Demand	Anodyne	CTSF	42	32
C[C@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)NC(=O)OC(C)(C)C	ZINC000819273080	FD	On-Demand	Anodyne	CTSF	42	32
C[C@@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)NC(=O)OC(C)(C)C	ZINC000819273081	FD	On-Demand	Anodyne	CTSF	42	32
C[C@@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)NC(=O)OC(C)(C)C	ZINC000819273082	FD	On-Demand	Anodyne	CTSF	42	32
CS(=O)(=O)N1CCN(c2ccc(NC(=O)C(F)=C3CCC3)cn2)CC1	ZINC000819273085	FD	On-Demand	Anodyne	DGAT1	36	49
CS(=O)(=O)N1CCN(c2ccc(NC(=O)C(F)=C3CCC3)cn2)CC1	ZINC000819273085	FD	On-Demand	Anodyne	SLC27A1	38	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCSC1	ZINC000819273109	GF	On-Demand	Anodyne	CTSD	96	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCSC1	ZINC000819273109	GF	On-Demand	Anodyne	PGC	62	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCSC1	ZINC000819273109	GF	On-Demand	Anodyne	PAPA1_CARPA	31	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCSC1	ZINC000819273109	GF	On-Demand	Anodyne	BACE2	52	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCSC1	ZINC000819273109	GF	On-Demand	Anodyne	REN	94	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCSC1	ZINC000819273109	GF	On-Demand	Anodyne	REN1	20	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCSC1	ZINC000819273109	GF	On-Demand	Anodyne	BACE1	78	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCSC1	ZINC000819273109	GF	On-Demand	Anodyne	FPR1	50	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCSC1	ZINC000819273109	GF	On-Demand	Anodyne	PLM1_PLAFA	27	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCSC1	ZINC000819273110	GF	On-Demand	Anodyne	CTSD	96	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCSC1	ZINC000819273110	GF	On-Demand	Anodyne	PGC	62	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCSC1	ZINC000819273110	GF	On-Demand	Anodyne	PAPA1_CARPA	31	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCSC1	ZINC000819273110	GF	On-Demand	Anodyne	BACE2	52	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCSC1	ZINC000819273110	GF	On-Demand	Anodyne	REN	94	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCSC1	ZINC000819273110	GF	On-Demand	Anodyne	REN1	20	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCSC1	ZINC000819273110	GF	On-Demand	Anodyne	BACE1	78	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCSC1	ZINC000819273110	GF	On-Demand	Anodyne	FPR1	50	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCSC1	ZINC000819273110	GF	On-Demand	Anodyne	PLM1_PLAFA	27	42
C[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc2O1	ZINC000819273117	FG	On-Demand	Mild	PAPA1_CARPA	42	42
C[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc2O1	ZINC000819273117	FG	On-Demand	Mild	FPR1	41	34
COCCONC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819273144	CC	On-Demand	Mild	ADRB2	39	51
COCCONC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819273144	CC	On-Demand	Mild	ADRB1	55	51
COCCONC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819273144	CC	On-Demand	Mild	ADRB3	33	41
COCCONC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819273145	CC	On-Demand	Mild	ADRB2	39	51
COCCONC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819273145	CC	On-Demand	Mild	ADRB1	55	51
COCCONC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819273145	CC	On-Demand	Mild	ADRB3	33	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(Cc3ccccc3F)CC1)C2	ZINC000819273146	GG	On-Demand	Anodyne	GRIN2B	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(Cc3ccccc3F)CC1)C2	ZINC000819273147	GG	On-Demand	Anodyne	GRIN2B	15	40
COCCONC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819273150	CC	On-Demand	Bother	ADRB2	26	43
COCCONC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819273150	CC	On-Demand	Bother	ADRB1	60	35
COCCONC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819273150	CC	On-Demand	Bother	COLA	91	33
COCCONC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819273151	CC	On-Demand	Bother	ADRB2	26	43
COCCONC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819273151	CC	On-Demand	Bother	ADRB1	60	35
COCCONC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819273151	CC	On-Demand	Bother	COLA	91	33
COCCONCCC(=O)Nc1ccc(Br)cc1	ZINC000819273164	DD	On-Demand	Anodyne	IDO1	16	46
COCCONCCC(=O)Nc1cccc(Cl)c1	ZINC000819273167	CD	On-Demand	Anodyne	CPT1A	46	32
COCCONCCC(=O)Nc1cccc(Cl)c1	ZINC000819273167	CD	On-Demand	Anodyne	TAAR1	20	43
COCCONCCC(=O)Nc1cccc(Cl)c1	ZINC000819273167	CD	On-Demand	Anodyne	KCNK3	65	41
COCCONCCC(=O)Nc1cccc(Cl)c1	ZINC000819273167	CD	On-Demand	Anodyne	KCNK9	51	41
COCCONC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819273174	CC	On-Demand	Anodyne	ADRB2	18	41
COCCONC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819273174	CC	On-Demand	Anodyne	ADRB1	22	41
COCCONC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819273174	CC	On-Demand	Anodyne	EDNRB	60	36
COCCONC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819273174	CC	On-Demand	Anodyne	EDNRA	63	37
COCCONC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819273174	CC	On-Demand	Anodyne	BMP1	54	36
COCCONC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819273175	CC	On-Demand	Anodyne	ADRB2	18	41
COCCONC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819273175	CC	On-Demand	Anodyne	ADRB1	22	41
COCCONC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819273175	CC	On-Demand	Anodyne	EDNRB	60	36
COCCONC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819273175	CC	On-Demand	Anodyne	EDNRA	63	37
COCCONC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819273175	CC	On-Demand	Anodyne	BMP1	54	36
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	MME	85	37
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	ANPEP	49	36
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	CTSD	34	44
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	PGC	58	43
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	CTSB	39	40
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	PAPA1_CARPA	83	54
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	CYSP_TRYCR	41	35
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	CCKAR	56	39
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	CTSK	40	61
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	CTSL	36	54
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	PGA	51	43
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	TACR3	18	44
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	CAPNS1	59	33
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	HLA-DRB1	19	43
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	REN	80	48
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	REN1	25	46
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	CCKBR	22	41
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	CTSS	15	54
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	CAPN1	87	46
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	CAPN2	65	37
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	ACE2	47	36
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	BACE1	15	41
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	FPR1	75	50
C[C@@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273202	DE	On-Demand	Anodyne	CTRB_BOVIN	39	44
COCCONC[C@H](O)Cc1cccc(Cl)c1	ZINC000819273203	CD	On-Demand	Anodyne	ADRB1	21	40
COCCONC[C@H](O)Cc1cccc(Cl)c1	ZINC000819273203	CD	On-Demand	Anodyne	MAOB	20	47
COCCONC[C@H](O)Cc1cccc(Cl)c1	ZINC000819273203	CD	On-Demand	Anodyne	ADRB3	25	42
COCCONC[C@H](O)Cc1cccc(Cl)c1	ZINC000819273203	CD	On-Demand	Anodyne	CTSV	30	42
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	MME	85	37
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	ANPEP	49	36
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	CTSD	34	44
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	PGC	58	43
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	CTSB	39	40
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	PAPA1_CARPA	83	54
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	CYSP_TRYCR	41	35
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	CCKAR	56	39
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	CTSK	40	61
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	CTSL	36	54
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	PGA	51	43
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	TACR3	18	44
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	CAPNS1	59	33
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	HLA-DRB1	19	43
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	REN	80	48
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	REN1	25	46
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	CCKBR	22	41
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	CTSS	15	54
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	CAPN1	87	46
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	CAPN2	65	37
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	ACE2	47	36
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	BACE1	15	41
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	FPR1	75	50
C[C@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273204	DE	On-Demand	Anodyne	CTRB_BOVIN	39	44
COCCONC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819273205	CD	On-Demand	Anodyne	ADRB1	21	40
COCCONC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819273205	CD	On-Demand	Anodyne	MAOB	20	47
COCCONC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819273205	CD	On-Demand	Anodyne	ADRB3	25	42
COCCONC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819273205	CD	On-Demand	Anodyne	CTSV	30	42
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	MME	85	37
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	ANPEP	49	36
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	CTSD	34	44
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	PGC	58	43
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	CTSB	39	40
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	PAPA1_CARPA	83	54
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	CYSP_TRYCR	41	35
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	CCKAR	56	39
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	CTSK	40	61
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	CTSL	36	54
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	PGA	51	43
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	TACR3	18	44
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	CAPNS1	59	33
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	HLA-DRB1	19	43
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	REN	80	48
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	REN1	25	46
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	CCKBR	22	41
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	CTSS	15	54
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	CAPN1	87	46
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	CAPN2	65	37
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	ACE2	47	36
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	BACE1	15	41
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	FPR1	75	50
C[C@H](CNC[C@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273206	DE	On-Demand	Anodyne	CTRB_BOVIN	39	44
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	MME	85	37
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	ANPEP	49	36
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	CTSD	34	44
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	PGC	58	43
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	CTSB	39	40
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	PAPA1_CARPA	83	54
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	CYSP_TRYCR	41	35
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	CCKAR	56	39
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	CTSK	40	61
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	CTSL	36	54
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	PGA	51	43
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	TACR3	18	44
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	CAPNS1	59	33
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	HLA-DRB1	19	43
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	REN	80	48
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	REN1	25	46
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	CCKBR	22	41
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	CTSS	15	54
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	CAPN1	87	46
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	CAPN2	65	37
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	ACE2	47	36
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	BACE1	15	41
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	FPR1	75	50
C[C@@H](CNC[C@@H](O)Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819273208	DE	On-Demand	Anodyne	CTRB_BOVIN	39	44
C[C@H](CNC[C@@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273210	EF	On-Demand	Anodyne	ADRB1	24	41
C[C@H](CNC[C@@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273210	EF	On-Demand	Anodyne	ADRB3	28	41
C[C@H](CNC[C@@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273210	EF	On-Demand	Anodyne	PAPA1_CARPA	32	44
C[C@H](CNC[C@@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273210	EF	On-Demand	Anodyne	CTSL	22	44
C[C@H](CNC[C@@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273210	EF	On-Demand	Anodyne	REN	45	40
C[C@H](CNC[C@@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273210	EF	On-Demand	Anodyne	FPR1	51	45
C[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273211	EF	On-Demand	Anodyne	ADRB1	24	41
C[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273211	EF	On-Demand	Anodyne	ADRB3	28	41
C[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273211	EF	On-Demand	Anodyne	PAPA1_CARPA	32	44
C[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273211	EF	On-Demand	Anodyne	CTSL	22	44
C[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273211	EF	On-Demand	Anodyne	REN	45	40
C[C@H](CNC[C@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273211	EF	On-Demand	Anodyne	FPR1	51	45
C[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273213	EF	On-Demand	Anodyne	ADRB1	24	41
C[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273213	EF	On-Demand	Anodyne	ADRB3	28	41
C[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273213	EF	On-Demand	Anodyne	PAPA1_CARPA	32	44
C[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273213	EF	On-Demand	Anodyne	CTSL	22	44
C[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273213	EF	On-Demand	Anodyne	REN	45	40
C[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273213	EF	On-Demand	Anodyne	FPR1	51	45
C[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273215	EF	On-Demand	Anodyne	ADRB1	24	41
C[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273215	EF	On-Demand	Anodyne	ADRB3	28	41
C[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273215	EF	On-Demand	Anodyne	PAPA1_CARPA	32	44
C[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273215	EF	On-Demand	Anodyne	CTSL	22	44
C[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273215	EF	On-Demand	Anodyne	REN	45	40
C[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273215	EF	On-Demand	Anodyne	FPR1	51	45
CON(C)C(=O)CCNC[C@H](C)NC(=O)OC(C)(C)C	ZINC000819273230	CC	On-Demand	Anodyne	CTSK	15	43
CON(C)C(=O)CCNC[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819273231	CC	On-Demand	Anodyne	CTSK	15	43
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819273235	EF	On-Demand	Anodyne	PAPA1_CARPA	30	40
Cc1cc(F)ccc1[C@@H](O)CNC[C@H](C)NC(=O)OC(C)(C)C	ZINC000819273238	EF	On-Demand	Anodyne	PAPA1_CARPA	30	40
O[C@@H](CNCCCCn1cc(Br)cn1)c1cccc(Cl)c1	ZINC000819273239	FG	On-Demand	Anodyne	ADRB1	47	45
O[C@@H](CNCCCCn1cc(Br)cn1)c1cccc(Cl)c1	ZINC000819273239	FG	On-Demand	Anodyne	ADRB3	60	45
O[C@H](CNCCCCn1cc(Br)cn1)c1cccc(Cl)c1	ZINC000819273240	FG	On-Demand	Anodyne	ADRB1	47	45
O[C@H](CNCCCCn1cc(Br)cn1)c1cccc(Cl)c1	ZINC000819273240	FG	On-Demand	Anodyne	ADRB3	60	45
Cc1ccccc1[C@@H](O)CNC[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819273242	DF	On-Demand	Anodyne	PAPA1_CARPA	34	41
Cc1ccccc1[C@@H](O)CNC[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819273242	DF	On-Demand	Anodyne	CTSK	15	43
Cc1ccccc1[C@@H](O)CNC[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819273242	DF	On-Demand	Anodyne	FPR1	50	41
Cc1ccccc1[C@@H](O)CNC[C@H](C)NC(=O)OC(C)(C)C	ZINC000819273244	DF	On-Demand	Anodyne	PAPA1_CARPA	34	41
Cc1ccccc1[C@@H](O)CNC[C@H](C)NC(=O)OC(C)(C)C	ZINC000819273244	DF	On-Demand	Anodyne	CTSK	15	43
Cc1ccccc1[C@@H](O)CNC[C@H](C)NC(=O)OC(C)(C)C	ZINC000819273244	DF	On-Demand	Anodyne	FPR1	50	41
C[C@H](CNCCC(=O)Nc1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C	ZINC000819273246	FE	On-Demand	Bother	COLA	53	39
C[C@@H](CNCCC(=O)Nc1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C	ZINC000819273247	FE	On-Demand	Bother	COLA	53	39
C[C@@H](CNC[C@H](O)c1ccc(Cl)c(F)c1)NC(=O)OC(C)(C)C	ZINC000819273251	EG	On-Demand	Anodyne	ADRB1	17	42
C[C@@H](CNC[C@@H](O)c1ccc(Cl)c(F)c1)NC(=O)OC(C)(C)C	ZINC000819273255	EG	On-Demand	Anodyne	ADRB1	17	42
C[C@H](CNC[C@@H](O)c1ccc(Cl)c(F)c1)NC(=O)OC(C)(C)C	ZINC000819273258	EG	On-Demand	Anodyne	ADRB1	17	42
C[C@H](CNC[C@H](O)c1ccc(Cl)c(F)c1)NC(=O)OC(C)(C)C	ZINC000819273261	EG	On-Demand	Anodyne	ADRB1	17	42
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819273283	EE	On-Demand	Anodyne	DRD4	26	47
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819273283	EE	On-Demand	Anodyne	ACHE	38	43
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819273283	EE	On-Demand	Anodyne	SLC6A3	22	53
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819273283	EE	On-Demand	Anodyne	SIGMAR1	41	50
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819273286	EE	On-Demand	Anodyne	DRD4	26	47
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819273286	EE	On-Demand	Anodyne	ACHE	38	43
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819273286	EE	On-Demand	Anodyne	SLC6A3	22	53
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819273286	EE	On-Demand	Anodyne	SIGMAR1	41	50
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819273290	EE	On-Demand	Anodyne	DRD4	26	47
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819273290	EE	On-Demand	Anodyne	ACHE	38	43
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819273290	EE	On-Demand	Anodyne	SLC6A3	22	53
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819273290	EE	On-Demand	Anodyne	SIGMAR1	41	50
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819273293	EE	On-Demand	Anodyne	DRD4	26	47
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819273293	EE	On-Demand	Anodyne	ACHE	38	43
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819273293	EE	On-Demand	Anodyne	SLC6A3	22	53
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819273293	EE	On-Demand	Anodyne	SIGMAR1	41	50
CON(C)C(=O)CCNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273322	DD	On-Demand	Anodyne	CHRM2	18	40
CON(C)C(=O)CCNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273322	DD	On-Demand	Anodyne	DRD2	24	50
CON(C)C(=O)CCNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273322	DD	On-Demand	Anodyne	DRD4	54	50
CON(C)C(=O)CCNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273322	DD	On-Demand	Anodyne	ACHE	59	47
CON(C)C(=O)CCNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273322	DD	On-Demand	Anodyne	HRH1	18	40
CON(C)C(=O)CCNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273322	DD	On-Demand	Anodyne	DRD3	18	50
CON(C)C(=O)CCNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273322	DD	On-Demand	Anodyne	SLC6A3	18	42
CON(C)C(=O)CCNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273322	DD	On-Demand	Anodyne	HTR4	51	43
CON(C)C(=O)CCNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273322	DD	On-Demand	Anodyne	LTA4H	21	42
CON(C)C(=O)CCNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273322	DD	On-Demand	Anodyne	SIGMAR1	66	47
CON(C)C(=O)CCNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273322	DD	On-Demand	Anodyne	BCHE	19	41
CON(C)C(=O)CCNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273322	DD	On-Demand	Anodyne	CCR3	43	38
CON(C)C(=O)CCNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273322	DD	On-Demand	Anodyne	CCR5	32	40
CON(C)C(=O)CCNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273322	DD	On-Demand	Anodyne	SLC18A3	20	41
CON(C)C(=O)CCNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273322	DD	On-Demand	Anodyne	MCHR1	25	43
CON(C)C(=O)CCNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273322	DD	On-Demand	Anodyne	CACNA1I	49	36
CON(C)C(=O)CCNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273323	DD	On-Demand	Anodyne	CHRM2	18	40
CON(C)C(=O)CCNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273323	DD	On-Demand	Anodyne	DRD2	24	50
CON(C)C(=O)CCNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273323	DD	On-Demand	Anodyne	DRD4	54	50
CON(C)C(=O)CCNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273323	DD	On-Demand	Anodyne	ACHE	59	47
CON(C)C(=O)CCNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273323	DD	On-Demand	Anodyne	HRH1	18	40
CON(C)C(=O)CCNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273323	DD	On-Demand	Anodyne	DRD3	18	50
CON(C)C(=O)CCNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273323	DD	On-Demand	Anodyne	SLC6A3	18	42
CON(C)C(=O)CCNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273323	DD	On-Demand	Anodyne	HTR4	51	43
CON(C)C(=O)CCNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273323	DD	On-Demand	Anodyne	LTA4H	21	42
CON(C)C(=O)CCNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273323	DD	On-Demand	Anodyne	SIGMAR1	66	47
CON(C)C(=O)CCNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273323	DD	On-Demand	Anodyne	BCHE	19	41
CON(C)C(=O)CCNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273323	DD	On-Demand	Anodyne	CCR3	43	38
CON(C)C(=O)CCNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273323	DD	On-Demand	Anodyne	CCR5	32	40
CON(C)C(=O)CCNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273323	DD	On-Demand	Anodyne	SLC18A3	20	41
CON(C)C(=O)CCNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273323	DD	On-Demand	Anodyne	MCHR1	25	43
CON(C)C(=O)CCNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273323	DD	On-Demand	Anodyne	CACNA1I	49	36
C[C@@H](CNC[C@H](O)c1ccc(Cl)cc1)NC(=O)OC(C)(C)C	ZINC000819273348	EF	On-Demand	Anodyne	FPR1	37	42
C[C@H](CNC[C@H](O)c1ccc(Cl)cc1)NC(=O)OC(C)(C)C	ZINC000819273350	EF	On-Demand	Anodyne	FPR1	37	42
CCCCSCC(=O)N1CC(OCC)C1	ZINC000819273392	BD	On-Demand	Anodyne	CES1	18	41
CCCCSCC(=O)N1CC(OCC)C1	ZINC000819273392	BD	On-Demand	Anodyne	EST1_PIG	51	41
C=C(C)C(C)(C)C(=O)N[C@@H](C)c1nc2ccc(Cl)cc2[nH]1	ZINC000819273416	DH	On-Demand	Mild	PRCP	19	42
C=C(C)C(C)(C)C(=O)N[C@H](C)c1nc2ccc(Cl)cc2[nH]1	ZINC000819273417	DH	On-Demand	Mild	PRCP	19	42
O=C(CCCc1cccs1)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819273426	GG	On-Demand	Reactive	CRTM	48	34
COCCONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819273475	CC	On-Demand	Anodyne	ADRB2	36	48
COCCONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819273475	CC	On-Demand	Anodyne	ADRB1	48	43
COCCONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819273475	CC	On-Demand	Anodyne	MTNR1B	18	41
COCCONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819273475	CC	On-Demand	Anodyne	ABCB1	21	47
COCCONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819273475	CC	On-Demand	Anodyne	PDS	50	37
COCCONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819273476	CC	On-Demand	Anodyne	ADRB2	36	48
COCCONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819273476	CC	On-Demand	Anodyne	ADRB1	48	43
COCCONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819273476	CC	On-Demand	Anodyne	MTNR1B	18	41
COCCONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819273476	CC	On-Demand	Anodyne	ABCB1	21	47
COCCONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819273476	CC	On-Demand	Anodyne	PDS	50	37
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H](N3CCCCC3=O)C2)c1	ZINC000819273483	FE	On-Demand	Anodyne	INHA	16	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H](N3CCCCC3=O)C2)c1	ZINC000819273483	FE	On-Demand	Anodyne	CCR3	24	41
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H](N3CCCCC3=O)C2)c1	ZINC000819273488	FE	On-Demand	Anodyne	INHA	16	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H](N3CCCCC3=O)C2)c1	ZINC000819273488	FE	On-Demand	Anodyne	CCR3	24	41
COCCONC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819273496	CC	On-Demand	Anodyne	ADRB2	50	64
COCCONC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819273496	CC	On-Demand	Anodyne	ADRB1	81	64
COCCONC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819273496	CC	On-Demand	Anodyne	GRIN1	29	40
COCCONC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819273496	CC	On-Demand	Anodyne	ADRB3	53	55
COCCONC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819273498	CC	On-Demand	Anodyne	ADRB2	50	64
COCCONC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819273498	CC	On-Demand	Anodyne	ADRB1	81	64
COCCONC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819273498	CC	On-Demand	Anodyne	GRIN1	29	40
COCCONC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819273498	CC	On-Demand	Anodyne	ADRB3	53	55
CN1CCC(N2CC[C@@H](NC(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)C2)CC1	ZINC000819273501	FD	On-Demand	Anodyne	SLC6A5	20	45
Cc1nc(CN2CCC(CNC(=O)/C=C/[C@H]3CCCO3)CC2)oc1C	ZINC000819273504	EE	On-Demand	Anodyne	CACNA1I	54	36
O=C(c1coc(=O)c2ccccc12)N1CCC[C@H](N2CCCCC2=O)C1	ZINC000819273505	FE	On-Demand	Anodyne	L3MBTL3	23	41
O=C(c1coc(=O)c2ccccc12)N1CCC[C@@H](N2CCCCC2=O)C1	ZINC000819273506	FE	On-Demand	Anodyne	L3MBTL3	23	41
Cc1nc(CN2CCC(CNC(=O)/C=C\[C@H]3CCCO3)CC2)oc1C	ZINC000819273507	EE	On-Demand	Anodyne	CACNA1I	54	36
Cc1nc(CN2CCC(CNC(=O)/C=C\[C@@H]3CCCO3)CC2)oc1C	ZINC000819273508	EE	On-Demand	Anodyne	CACNA1I	54	36
Cc1nc(CN2CCC(CNC(=O)/C=C/[C@@H]3CCCO3)CC2)oc1C	ZINC000819273510	EE	On-Demand	Anodyne	CACNA1I	54	36
O=C(CN1CCN(C(=O)C(F)=C2CCC2)CC1)Nc1nncs1	ZINC000819273512	ED	On-Demand	Anodyne	SLC27A1	42	39
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc(Br)c1	ZINC000819273523	GI	On-Demand	Anodyne	ADRB3	39	47
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc(Br)c1	ZINC000819273525	GI	On-Demand	Anodyne	ADRB3	39	47
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccc(Br)c1	ZINC000819273527	GI	On-Demand	Anodyne	ADRB3	39	47
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccc(Br)c1	ZINC000819273529	GI	On-Demand	Anodyne	ADRB3	39	47
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc2ccccc12	ZINC000819273532	FJ	On-Demand	Anodyne	ADRB3	15	42
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc2ccccc12	ZINC000819273534	FJ	On-Demand	Anodyne	ADRB3	15	42
CC(=O)Nc1cccc(CC(=O)NNC(=O)CCCc2cccs2)c1	ZINC000819273535	FE	On-Demand	Reactive	PTPRF	21	47
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819273546	GF	On-Demand	Anodyne	PREP	32	53
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819273550	GF	On-Demand	Anodyne	PREP	32	53
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819273554	GF	On-Demand	Anodyne	PREP	32	53
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819273556	GF	On-Demand	Anodyne	PREP	32	53
C[C@H](CNC[C@H](O)COc1ccc(Cl)c(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273586	GG	On-Demand	Anodyne	ADRB2	40	43
C[C@H](CNC[C@H](O)COc1ccc(Cl)c(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273586	GG	On-Demand	Anodyne	ADRB1	52	42
C[C@H](CNC[C@H](O)COc1ccc(Cl)c(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273586	GG	On-Demand	Anodyne	GRIN1	29	44
C[C@H](CNC[C@H](O)COc1ccc(Cl)c(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273586	GG	On-Demand	Anodyne	PDS	17	41
C[C@@H](CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273587	GG	On-Demand	Anodyne	ADRB2	40	43
C[C@@H](CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273587	GG	On-Demand	Anodyne	ADRB1	52	42
C[C@@H](CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273587	GG	On-Demand	Anodyne	GRIN1	29	44
C[C@@H](CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273587	GG	On-Demand	Anodyne	PDS	17	41
C[C@@H](CNC[C@H](O)COc1ccc(Cl)c(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273588	GG	On-Demand	Anodyne	ADRB2	40	43
C[C@@H](CNC[C@H](O)COc1ccc(Cl)c(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273588	GG	On-Demand	Anodyne	ADRB1	52	42
C[C@@H](CNC[C@H](O)COc1ccc(Cl)c(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273588	GG	On-Demand	Anodyne	GRIN1	29	44
C[C@@H](CNC[C@H](O)COc1ccc(Cl)c(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273588	GG	On-Demand	Anodyne	PDS	17	41
C[C@H](CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273590	GG	On-Demand	Anodyne	ADRB2	40	43
C[C@H](CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273590	GG	On-Demand	Anodyne	ADRB1	52	42
C[C@H](CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273590	GG	On-Demand	Anodyne	GRIN1	29	44
C[C@H](CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819273590	GG	On-Demand	Anodyne	PDS	17	41
Cc1ccc(OC[C@@H](O)CNC[C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819273594	EE	On-Demand	Anodyne	ADRB2	48	55
Cc1ccc(OC[C@@H](O)CNC[C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819273594	EE	On-Demand	Anodyne	ADRB1	62	45
Cc1ccc(OC[C@@H](O)CNC[C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819273594	EE	On-Demand	Anodyne	ADRB3	34	40
Cc1ccc(OC[C@@H](O)CNC[C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819273596	EE	On-Demand	Anodyne	ADRB2	48	55
Cc1ccc(OC[C@@H](O)CNC[C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819273596	EE	On-Demand	Anodyne	ADRB1	62	45
Cc1ccc(OC[C@@H](O)CNC[C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819273596	EE	On-Demand	Anodyne	ADRB3	34	40
Cc1ccc(OC[C@H](O)CNC[C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819273598	EE	On-Demand	Anodyne	ADRB2	48	55
Cc1ccc(OC[C@H](O)CNC[C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819273598	EE	On-Demand	Anodyne	ADRB1	62	45
Cc1ccc(OC[C@H](O)CNC[C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819273598	EE	On-Demand	Anodyne	ADRB3	34	40
Cc1ccc(OC[C@H](O)CNC[C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819273600	EE	On-Demand	Anodyne	ADRB2	48	55
Cc1ccc(OC[C@H](O)CNC[C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819273600	EE	On-Demand	Anodyne	ADRB1	62	45
Cc1ccc(OC[C@H](O)CNC[C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819273600	EE	On-Demand	Anodyne	ADRB3	34	40
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccccc1	ZINC000819273606	DG	On-Demand	Anodyne	ADRB2	27	48
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccccc1	ZINC000819273606	DG	On-Demand	Anodyne	ADRB1	22	43
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccccc1	ZINC000819273606	DG	On-Demand	Anodyne	ADRB3	37	48
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1ccccc1	ZINC000819273608	DG	On-Demand	Anodyne	ADRB2	27	48
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1ccccc1	ZINC000819273608	DG	On-Demand	Anodyne	ADRB1	22	43
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1ccccc1	ZINC000819273608	DG	On-Demand	Anodyne	ADRB3	37	48
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccccc1	ZINC000819273610	DG	On-Demand	Anodyne	ADRB2	27	48
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccccc1	ZINC000819273610	DG	On-Demand	Anodyne	ADRB1	22	43
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccccc1	ZINC000819273610	DG	On-Demand	Anodyne	ADRB3	37	48
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccccc1	ZINC000819273612	DG	On-Demand	Anodyne	ADRB2	27	48
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccccc1	ZINC000819273612	DG	On-Demand	Anodyne	ADRB1	22	43
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccccc1	ZINC000819273612	DG	On-Demand	Anodyne	ADRB3	37	48
CC(=O)Nc1cccc(CC(=O)NCC[S@@](=O)C(C)(C)C)c1	ZINC000819273640	DD	On-Demand	Anodyne	KCNK3	42	32
CC(=O)Nc1cccc(CC(=O)NCC[S@](=O)C(C)(C)C)c1	ZINC000819273641	DD	On-Demand	Anodyne	KCNK3	42	32
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819273642	EG	On-Demand	Mild	ADRB3	22	46
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819273642	EG	On-Demand	Mild	CTRB_BOVIN	54	38
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819273643	EG	On-Demand	Mild	ADRB3	22	46
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819273643	EG	On-Demand	Mild	CTRB_BOVIN	54	38
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819273644	EG	On-Demand	Mild	ADRB3	22	46
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819273644	EG	On-Demand	Mild	CTRB_BOVIN	54	38
CCCCCCCC(=O)N1CC(OCC)C1	ZINC000819273645	BF	On-Demand	Mild	CQSS	58	37
C[C@@H](CNCC1(O)CCC1)NC(=O)OC(C)(C)C	ZINC000819273662	CD	On-Demand	Anodyne	CTSK	17	45
C[C@H](CNCC1(O)CCC1)NC(=O)OC(C)(C)C	ZINC000819273663	CD	On-Demand	Anodyne	CTSK	17	45
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273679	GE	On-Demand	Anodyne	DRD2	22	48
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273679	GE	On-Demand	Anodyne	DRD4	52	48
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273679	GE	On-Demand	Anodyne	ACHE	55	50
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273679	GE	On-Demand	Anodyne	DRD3	15	48
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273679	GE	On-Demand	Anodyne	HTR4	54	45
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273679	GE	On-Demand	Anodyne	SIGMAR1	49	43
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273679	GE	On-Demand	Anodyne	BCHE	18	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273679	GE	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273679	GE	On-Demand	Anodyne	CACNA1G	45	42
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273679	GE	On-Demand	Anodyne	CACNA1I	65	37
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273680	GE	On-Demand	Anodyne	DRD2	22	48
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273680	GE	On-Demand	Anodyne	DRD4	52	48
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273680	GE	On-Demand	Anodyne	ACHE	55	50
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273680	GE	On-Demand	Anodyne	DRD3	15	48
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273680	GE	On-Demand	Anodyne	HTR4	54	45
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273680	GE	On-Demand	Anodyne	SIGMAR1	49	43
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273680	GE	On-Demand	Anodyne	BCHE	18	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273680	GE	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273680	GE	On-Demand	Anodyne	CACNA1G	45	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273680	GE	On-Demand	Anodyne	CACNA1I	65	37
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273681	GE	On-Demand	Anodyne	DRD2	22	48
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273681	GE	On-Demand	Anodyne	DRD4	52	48
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273681	GE	On-Demand	Anodyne	ACHE	55	50
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273681	GE	On-Demand	Anodyne	DRD3	15	48
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273681	GE	On-Demand	Anodyne	HTR4	54	45
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273681	GE	On-Demand	Anodyne	SIGMAR1	49	43
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273681	GE	On-Demand	Anodyne	BCHE	18	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273681	GE	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273681	GE	On-Demand	Anodyne	CACNA1G	45	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273681	GE	On-Demand	Anodyne	CACNA1I	65	37
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273682	GE	On-Demand	Anodyne	DRD2	22	48
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273682	GE	On-Demand	Anodyne	DRD4	52	48
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273682	GE	On-Demand	Anodyne	ACHE	55	50
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273682	GE	On-Demand	Anodyne	DRD3	15	48
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273682	GE	On-Demand	Anodyne	HTR4	54	45
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273682	GE	On-Demand	Anodyne	SIGMAR1	49	43
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273682	GE	On-Demand	Anodyne	BCHE	18	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273682	GE	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273682	GE	On-Demand	Anodyne	CACNA1G	45	42
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273682	GE	On-Demand	Anodyne	CACNA1I	65	37
C[C@H](CNC[C@@H](O)C(C)(C)C)NC(=O)OC(C)(C)C	ZINC000819273687	CD	On-Demand	Anodyne	CTSK	18	50
C[C@H](CNC[C@H](O)C(C)(C)C)NC(=O)OC(C)(C)C	ZINC000819273689	CD	On-Demand	Anodyne	CTSK	18	50
C[C@@H](CNC[C@H](O)C(C)(C)C)NC(=O)OC(C)(C)C	ZINC000819273690	CD	On-Demand	Anodyne	CTSK	18	50
C[C@@H](CNC[C@@H](O)C(C)(C)C)NC(=O)OC(C)(C)C	ZINC000819273691	CD	On-Demand	Anodyne	CTSK	18	50
C[C@@H](CNC[C@@](C)(O)C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819273692	DD	On-Demand	Anodyne	CTSK	16	45
C[C@H](CNC[C@](C)(O)C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819273694	DD	On-Demand	Anodyne	CTSK	16	45
C[C@@H](CNC[C@](C)(O)C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819273698	DD	On-Demand	Anodyne	CTSK	16	45
C[C@H](CNC[C@@](C)(O)C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819273705	DD	On-Demand	Anodyne	CTSK	16	45
C[C@H](CNC[C@@H](O)CC(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819273707	DD	On-Demand	Anodyne	CTSK	15	45
C[C@@H](CNC[C@H](O)CC(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819273709	DD	On-Demand	Anodyne	CTSK	15	45
C[C@@H](CNC[C@@H](O)CC(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819273711	DD	On-Demand	Anodyne	CTSK	15	45
C[C@H](CNC[C@H](O)CC(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819273712	DD	On-Demand	Anodyne	CTSK	15	45
C[C@H](CNCC(C)(C)O)NC(=O)OC(C)(C)C	ZINC000819273714	BD	On-Demand	Anodyne	CTSK	19	50
C[C@@H](CNCC(C)(C)O)NC(=O)OC(C)(C)C	ZINC000819273716	BD	On-Demand	Anodyne	CTSK	19	50
CC[C@@H](O)CNC[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819273754	BD	On-Demand	Anodyne	CTSK	19	53
CC[C@H](O)CNC[C@H](C)NC(=O)OC(C)(C)C	ZINC000819273756	BD	On-Demand	Anodyne	CTSK	19	53
CC[C@@H](O)CNC[C@H](C)NC(=O)OC(C)(C)C	ZINC000819273757	BD	On-Demand	Anodyne	CTSK	19	53
CC[C@H](O)CNC[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819273759	BD	On-Demand	Anodyne	CTSK	19	53
C[C@@H](CNC[C@@H](O)C1CC1)NC(=O)OC(C)(C)C	ZINC000819273764	CD	On-Demand	Anodyne	CTSK	16	47
C[C@H](CNC[C@H](O)C1CC1)NC(=O)OC(C)(C)C	ZINC000819273766	CD	On-Demand	Anodyne	CTSK	16	47
C[C@H](CNC[C@@H](O)C1CC1)NC(=O)OC(C)(C)C	ZINC000819273767	CD	On-Demand	Anodyne	CTSK	16	47
C[C@@H](CNC[C@H](O)C1CC1)NC(=O)OC(C)(C)C	ZINC000819273769	CD	On-Demand	Anodyne	CTSK	16	47
Cc1ccccc1[C@@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273772	DG	On-Demand	Anodyne	DRD2	17	46
Cc1ccccc1[C@@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273772	DG	On-Demand	Anodyne	DRD4	46	49
Cc1ccccc1[C@@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273772	DG	On-Demand	Anodyne	ACHE	48	48
Cc1ccccc1[C@@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273772	DG	On-Demand	Anodyne	SLC6A3	17	48
Cc1ccccc1[C@@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273772	DG	On-Demand	Anodyne	HTR4	31	45
Cc1ccccc1[C@@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819273772	DG	On-Demand	Anodyne	SIGMAR1	54	45
Cc1ccccc1[C@@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273773	DG	On-Demand	Anodyne	DRD2	17	46
Cc1ccccc1[C@@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273773	DG	On-Demand	Anodyne	DRD4	46	49
Cc1ccccc1[C@@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273773	DG	On-Demand	Anodyne	ACHE	48	48
Cc1ccccc1[C@@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273773	DG	On-Demand	Anodyne	SLC6A3	17	48
Cc1ccccc1[C@@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273773	DG	On-Demand	Anodyne	HTR4	31	45
Cc1ccccc1[C@@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819273773	DG	On-Demand	Anodyne	SIGMAR1	54	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(Oc2ccncc2)c1	ZINC000819273780	FH	On-Demand	Anodyne	RAF1	29	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(Oc2ccncc2)c1	ZINC000819273780	FH	On-Demand	Anodyne	F13A1	15	41
C[C@H](CNC[C@@H](O)CN1C(=O)c2ccccc2C1=O)NC(=O)OC(C)(C)C	ZINC000819273796	GD	On-Demand	Anodyne	FPR1	41	35
C[C@H](CNC[C@H](O)CN1C(=O)c2ccccc2C1=O)NC(=O)OC(C)(C)C	ZINC000819273797	GD	On-Demand	Anodyne	FPR1	41	35
C[C@@H](CNC[C@@H](O)CN1C(=O)c2ccccc2C1=O)NC(=O)OC(C)(C)C	ZINC000819273798	GD	On-Demand	Anodyne	FPR1	41	35
C[C@@H](CNC[C@H](O)CN1C(=O)c2ccccc2C1=O)NC(=O)OC(C)(C)C	ZINC000819273799	GD	On-Demand	Anodyne	FPR1	41	35
CN(C[C@@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273800	GE	On-Demand	Anodyne	DRD4	33	43
CN(C[C@@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273800	GE	On-Demand	Anodyne	ACHE	47	46
CN(C[C@@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273800	GE	On-Demand	Anodyne	HTR4	34	42
CN(C[C@@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273800	GE	On-Demand	Anodyne	SIGMAR1	45	42
CN(C[C@@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273800	GE	On-Demand	Anodyne	CACNA1I	46	33
CN(C[C@@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273801	GE	On-Demand	Anodyne	DRD4	33	43
CN(C[C@@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273801	GE	On-Demand	Anodyne	ACHE	47	46
CN(C[C@@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273801	GE	On-Demand	Anodyne	HTR4	34	42
CN(C[C@@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273801	GE	On-Demand	Anodyne	SIGMAR1	45	42
CN(C[C@@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273801	GE	On-Demand	Anodyne	CACNA1I	46	33
CN(C[C@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273802	GE	On-Demand	Anodyne	DRD4	33	43
CN(C[C@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273802	GE	On-Demand	Anodyne	ACHE	47	46
CN(C[C@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273802	GE	On-Demand	Anodyne	HTR4	34	42
CN(C[C@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273802	GE	On-Demand	Anodyne	SIGMAR1	45	42
CN(C[C@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273802	GE	On-Demand	Anodyne	CACNA1I	46	33
CN(C[C@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273803	GE	On-Demand	Anodyne	DRD4	33	43
CN(C[C@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273803	GE	On-Demand	Anodyne	ACHE	47	46
CN(C[C@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273803	GE	On-Demand	Anodyne	HTR4	34	42
CN(C[C@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273803	GE	On-Demand	Anodyne	SIGMAR1	45	42
CN(C[C@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819273803	GE	On-Demand	Anodyne	CACNA1I	46	33
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819273805	EG	On-Demand	Mild	ADRB3	22	46
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819273805	EG	On-Demand	Mild	CTRB_BOVIN	54	38
C[C@H](CNC[C@@H](O)COc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819273808	EE	On-Demand	Anodyne	ADRB2	32	46
C[C@H](CNC[C@@H](O)COc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819273808	EE	On-Demand	Anodyne	ADRB1	66	41
C[C@H](CNC[C@@H](O)COc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819273808	EE	On-Demand	Anodyne	PAPA1_CARPA	27	41
C[C@H](CNC[C@H](O)COc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819273809	EE	On-Demand	Anodyne	ADRB2	32	46
C[C@H](CNC[C@H](O)COc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819273809	EE	On-Demand	Anodyne	ADRB1	66	41
C[C@H](CNC[C@H](O)COc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819273809	EE	On-Demand	Anodyne	PAPA1_CARPA	27	41
C[C@@H](CNC[C@@H](O)COc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819273810	EE	On-Demand	Anodyne	ADRB2	32	46
C[C@@H](CNC[C@@H](O)COc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819273810	EE	On-Demand	Anodyne	ADRB1	66	41
C[C@@H](CNC[C@@H](O)COc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819273810	EE	On-Demand	Anodyne	PAPA1_CARPA	27	41
C[C@@H](CNC[C@H](O)COc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819273811	EE	On-Demand	Anodyne	ADRB2	32	46
C[C@@H](CNC[C@H](O)COc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819273811	EE	On-Demand	Anodyne	ADRB1	66	41
C[C@@H](CNC[C@H](O)COc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819273811	EE	On-Demand	Anodyne	PAPA1_CARPA	27	41
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819273818	FE	On-Demand	Anodyne	DRD4	40	31
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819273818	FE	On-Demand	Anodyne	CHRNA7	20	41
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819273818	FE	On-Demand	Anodyne	PLD1	55	38
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819273818	FE	On-Demand	Anodyne	PLD2	67	38
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819273820	FE	On-Demand	Anodyne	DRD4	40	31
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819273820	FE	On-Demand	Anodyne	CHRNA7	20	41
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819273820	FE	On-Demand	Anodyne	PLD1	55	38
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819273820	FE	On-Demand	Anodyne	PLD2	67	38
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819273822	FE	On-Demand	Anodyne	DRD4	40	31
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819273822	FE	On-Demand	Anodyne	CHRNA7	20	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819273822	FE	On-Demand	Anodyne	PLD1	55	38
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819273822	FE	On-Demand	Anodyne	PLD2	67	38
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819273824	FE	On-Demand	Anodyne	DRD4	40	31
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819273824	FE	On-Demand	Anodyne	CHRNA7	20	41
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819273824	FE	On-Demand	Anodyne	PLD1	55	38
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000819273824	FE	On-Demand	Anodyne	PLD2	67	38
C[C@H](CNCCC(N)=O)NC(=O)OC(C)(C)C	ZINC000819273830	BC	On-Demand	Anodyne	CTSK	17	46
C[C@@H](CNCCC(N)=O)NC(=O)OC(C)(C)C	ZINC000819273832	BC	On-Demand	Anodyne	CTSK	17	46
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819273837	FG	On-Demand	Anodyne	FKBP1A	41	37
COC(=O)[C@@H]1CCCCN1C(=O)c1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819273837	FG	On-Demand	Anodyne	PREP	37	57
Cc1ccccc1[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273840	GI	On-Demand	Mild	PGC	49	32
Cc1ccccc1[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273840	GI	On-Demand	Mild	PAPA1_CARPA	43	45
Cc1ccccc1[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273840	GI	On-Demand	Mild	CCKAR	44	35
Cc1ccccc1[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273840	GI	On-Demand	Mild	REN	53	39
Cc1ccccc1[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273840	GI	On-Demand	Mild	FPR1	48	40
Cc1ccccc1[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273842	GI	On-Demand	Mild	PGC	49	32
Cc1ccccc1[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273842	GI	On-Demand	Mild	PAPA1_CARPA	43	45
Cc1ccccc1[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273842	GI	On-Demand	Mild	CCKAR	44	35
Cc1ccccc1[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273842	GI	On-Demand	Mild	REN	53	39
Cc1ccccc1[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273842	GI	On-Demand	Mild	FPR1	48	40
Cc1ccccc1[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273844	GI	On-Demand	Mild	PGC	49	32
Cc1ccccc1[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273844	GI	On-Demand	Mild	PAPA1_CARPA	43	45
Cc1ccccc1[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273844	GI	On-Demand	Mild	CCKAR	44	35
Cc1ccccc1[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273844	GI	On-Demand	Mild	REN	53	39
Cc1ccccc1[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273844	GI	On-Demand	Mild	FPR1	48	40
Cc1ccccc1[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273846	GI	On-Demand	Mild	PGC	49	32
Cc1ccccc1[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273846	GI	On-Demand	Mild	PAPA1_CARPA	43	45
Cc1ccccc1[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273846	GI	On-Demand	Mild	CCKAR	44	35
Cc1ccccc1[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273846	GI	On-Demand	Mild	REN	53	39
Cc1ccccc1[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CC1	ZINC000819273846	GI	On-Demand	Mild	FPR1	48	40
COCCONC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819273852	CD	On-Demand	Anodyne	ADRB2	20	48
COCCONC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819273855	CD	On-Demand	Anodyne	ADRB2	20	48
C[C@H](NC(=O)C[C@@H](C)n1cccn1)c1nc2ccc(Cl)cc2[nH]1	ZINC000819273858	EG	On-Demand	Anodyne	PRCP	15	44
C[C@H](NC(=O)C[C@H](C)n1cccn1)c1nc2ccc(Cl)cc2[nH]1	ZINC000819273859	EG	On-Demand	Anodyne	PRCP	15	44
C[C@@H](CNCCC#N)NC(=O)OC(C)(C)C	ZINC000819273912	BD	On-Demand	Mild	PAPA1_CARPA	38	44
C[C@@H](CNCCC#N)NC(=O)OC(C)(C)C	ZINC000819273912	BD	On-Demand	Mild	CTSK	17	47
COCCONC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819273927	CC	On-Demand	Anodyne	ADRB2	41	48
COCCONC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819273927	CC	On-Demand	Anodyne	ADRB1	58	48
COCCONC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819273927	CC	On-Demand	Anodyne	ADRB3	30	41
COCCONC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819273928	CC	On-Demand	Anodyne	ADRB2	41	48
COCCONC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819273928	CC	On-Demand	Anodyne	ADRB1	58	48
COCCONC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819273928	CC	On-Demand	Anodyne	ADRB3	30	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc3c(c2)SC2=NS(=O)(=O)CCN23)c1	ZINC000819273930	JI	On-Demand	Anodyne	KCNK3	90	37
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc3c(c2)SC2=NS(=O)(=O)CCN23)c1	ZINC000819273930	JI	On-Demand	Anodyne	KCNK9	41	36
COCCONC[C@@H](O)COc1ccccc1C(C)C	ZINC000819273977	CD	On-Demand	Anodyne	ADRB2	36	53
COCCONC[C@@H](O)COc1ccccc1C(C)C	ZINC000819273977	CD	On-Demand	Anodyne	ADRB1	59	37
COCCONC[C@@H](O)COc1ccccc1C(C)C	ZINC000819273977	CD	On-Demand	Anodyne	ABCB1	32	43
COCCONC[C@H](O)COc1ccccc1C(C)C	ZINC000819273978	CD	On-Demand	Anodyne	ADRB2	36	53
COCCONC[C@H](O)COc1ccccc1C(C)C	ZINC000819273978	CD	On-Demand	Anodyne	ADRB1	59	37
COCCONC[C@H](O)COc1ccccc1C(C)C	ZINC000819273978	CD	On-Demand	Anodyne	ABCB1	32	43
COCCONC[C@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000819273979	CD	On-Demand	Anodyne	PPARA	15	42
COCCONC[C@@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000819273980	CD	On-Demand	Anodyne	PPARA	15	42
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)CCCc1cccs1	ZINC000819273987	DG	On-Demand	Reactive	PTPRF	18	40
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)CCCc1cccs1	ZINC000819273988	DG	On-Demand	Reactive	PTPRF	18	40
CCCCCCCCC(=O)N1CC(OCC)C1	ZINC000819274033	BF	On-Demand	Mild	CQSS	58	37
CCCCCCC(=O)N1CC(OCC)C1	ZINC000819274096	BE	On-Demand	Anodyne	CQSS	58	37
C[C@@H](CNC[C@H](O)c1c(F)cccc1F)NC(=O)OC(C)(C)C	ZINC000819274100	EF	On-Demand	Anodyne	PAPA1_CARPA	32	42
C[C@@H](CNC[C@H](O)c1c(F)cccc1F)NC(=O)OC(C)(C)C	ZINC000819274100	EF	On-Demand	Anodyne	CTSK	17	41
C[C@@H](CNC[C@@H](O)c1c(F)cccc1F)NC(=O)OC(C)(C)C	ZINC000819274102	EF	On-Demand	Anodyne	PAPA1_CARPA	32	42
C[C@@H](CNC[C@@H](O)c1c(F)cccc1F)NC(=O)OC(C)(C)C	ZINC000819274102	EF	On-Demand	Anodyne	CTSK	17	41
C[C@H](CNC[C@H](O)c1c(F)cccc1F)NC(=O)OC(C)(C)C	ZINC000819274105	EF	On-Demand	Anodyne	PAPA1_CARPA	32	42
C[C@H](CNC[C@H](O)c1c(F)cccc1F)NC(=O)OC(C)(C)C	ZINC000819274105	EF	On-Demand	Anodyne	CTSK	17	41
C[C@H](CNC[C@@H](O)c1c(F)cccc1F)NC(=O)OC(C)(C)C	ZINC000819274107	EF	On-Demand	Anodyne	PAPA1_CARPA	32	42
C[C@H](CNC[C@@H](O)c1c(F)cccc1F)NC(=O)OC(C)(C)C	ZINC000819274107	EF	On-Demand	Anodyne	CTSK	17	41
C[C@@H](CNC[C@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819274116	CD	On-Demand	Anodyne	ADRB2	22	41
C[C@@H](CNC[C@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819274116	CD	On-Demand	Anodyne	ADRB1	29	48
C[C@@H](CNC[C@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819274116	CD	On-Demand	Anodyne	ADRB3	97	48
C[C@H](CNC[C@@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819274117	CD	On-Demand	Anodyne	ADRB2	22	41
C[C@H](CNC[C@@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819274117	CD	On-Demand	Anodyne	ADRB1	29	48
C[C@H](CNC[C@@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819274117	CD	On-Demand	Anodyne	ADRB3	97	48
C[C@@H](CNC[C@@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819274118	CD	On-Demand	Anodyne	ADRB2	22	41
C[C@@H](CNC[C@@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819274118	CD	On-Demand	Anodyne	ADRB1	29	48
C[C@@H](CNC[C@@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819274118	CD	On-Demand	Anodyne	ADRB3	97	48
C[C@H](CNC[C@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819274119	CD	On-Demand	Anodyne	ADRB2	22	41
C[C@H](CNC[C@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819274119	CD	On-Demand	Anodyne	ADRB1	29	48
C[C@H](CNC[C@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819274119	CD	On-Demand	Anodyne	ADRB3	97	48
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274126	CD	On-Demand	Anodyne	DRD2	16	49
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274126	CD	On-Demand	Anodyne	DRD4	44	53
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274126	CD	On-Demand	Anodyne	ACHE	50	43
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274126	CD	On-Demand	Anodyne	SLC6A3	19	52
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274126	CD	On-Demand	Anodyne	HTR4	19	41
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274126	CD	On-Demand	Anodyne	SIGMAR1	62	56
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274126	CD	On-Demand	Anodyne	CCR3	21	40
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274126	CD	On-Demand	Anodyne	SLC18A3	22	41
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274127	CD	On-Demand	Anodyne	DRD2	16	49
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274127	CD	On-Demand	Anodyne	DRD4	44	53
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274127	CD	On-Demand	Anodyne	ACHE	50	43
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274127	CD	On-Demand	Anodyne	SLC6A3	19	52
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274127	CD	On-Demand	Anodyne	HTR4	19	41
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274127	CD	On-Demand	Anodyne	SIGMAR1	62	56
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274127	CD	On-Demand	Anodyne	CCR3	21	40
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274127	CD	On-Demand	Anodyne	SLC18A3	22	41
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274128	CD	On-Demand	Anodyne	DRD2	16	49
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274128	CD	On-Demand	Anodyne	DRD4	44	53
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274128	CD	On-Demand	Anodyne	ACHE	50	43
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274128	CD	On-Demand	Anodyne	SLC6A3	19	52
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274128	CD	On-Demand	Anodyne	HTR4	19	41
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274128	CD	On-Demand	Anodyne	SIGMAR1	62	56
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274128	CD	On-Demand	Anodyne	CCR3	21	40
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274128	CD	On-Demand	Anodyne	SLC18A3	22	41
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274129	CD	On-Demand	Anodyne	DRD2	16	49
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274129	CD	On-Demand	Anodyne	DRD4	44	53
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274129	CD	On-Demand	Anodyne	ACHE	50	43
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274129	CD	On-Demand	Anodyne	SLC6A3	19	52
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274129	CD	On-Demand	Anodyne	HTR4	19	41
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274129	CD	On-Demand	Anodyne	SIGMAR1	62	56
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274129	CD	On-Demand	Anodyne	CCR3	21	40
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)C1CC1	ZINC000819274129	CD	On-Demand	Anodyne	SLC18A3	22	41
C[C@H](CS(C)(=O)=O)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819274139	GD	On-Demand	Mild	PAPA1_CARPA	34	47
C[C@H](CS(C)(=O)=O)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819274140	GD	On-Demand	Mild	PAPA1_CARPA	34	47
C[C@H](CNCC1(O)CCCC1)NC(=O)OC(C)(C)C	ZINC000819274145	CD	On-Demand	Anodyne	CTSK	17	44
C[C@@H](CNCC1(O)CCCC1)NC(=O)OC(C)(C)C	ZINC000819274146	CD	On-Demand	Anodyne	CTSK	17	44
C[C@H](CNC[C@@H](O)c1ccccc1Br)NC(=O)OC(C)(C)C	ZINC000819274155	FF	On-Demand	Anodyne	PAPA1_CARPA	34	46
C[C@H](CNC[C@@H](O)c1ccccc1Br)NC(=O)OC(C)(C)C	ZINC000819274155	FF	On-Demand	Anodyne	FPR1	46	38
C[C@@H](CNC[C@H](O)c1ccccc1Br)NC(=O)OC(C)(C)C	ZINC000819274156	FF	On-Demand	Anodyne	PAPA1_CARPA	34	46
C[C@@H](CNC[C@H](O)c1ccccc1Br)NC(=O)OC(C)(C)C	ZINC000819274156	FF	On-Demand	Anodyne	FPR1	46	38
C[C@H](CNC[C@H](O)c1ccccc1Br)NC(=O)OC(C)(C)C	ZINC000819274157	FF	On-Demand	Anodyne	PAPA1_CARPA	34	46
C[C@H](CNC[C@H](O)c1ccccc1Br)NC(=O)OC(C)(C)C	ZINC000819274157	FF	On-Demand	Anodyne	FPR1	46	38
C[C@@H](CNC[C@@H](O)c1ccccc1Br)NC(=O)OC(C)(C)C	ZINC000819274158	FF	On-Demand	Anodyne	PAPA1_CARPA	34	46
C[C@@H](CNC[C@@H](O)c1ccccc1Br)NC(=O)OC(C)(C)C	ZINC000819274158	FF	On-Demand	Anodyne	FPR1	46	38
C[C@H](CNCC1(O)CCCCC1)NC(=O)OC(C)(C)C	ZINC000819274161	CE	On-Demand	Anodyne	CTSK	15	43
C[C@@H](CNCC1(O)CCCCC1)NC(=O)OC(C)(C)C	ZINC000819274162	CE	On-Demand	Anodyne	CTSK	15	43
C[C@H](CNC[C@@H](O)C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819274165	CD	On-Demand	Anodyne	CTSK	16	46
C[C@@H](CNC[C@@H](O)C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819274166	CD	On-Demand	Anodyne	CTSK	16	46
C[C@H](CNC[C@H](O)C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819274167	CD	On-Demand	Anodyne	CTSK	16	46
C[C@@H](CNC[C@H](O)C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819274168	CD	On-Demand	Anodyne	CTSK	16	46
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1	ZINC000819274185	JH	On-Demand	Anodyne	CA2	18	45
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1	ZINC000819274185	JH	On-Demand	Anodyne	LPL	43	46
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1	ZINC000819274185	JH	On-Demand	Anodyne	CA1	44	41
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1	ZINC000819274185	JH	On-Demand	Anodyne	CA12	32	45
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1	ZINC000819274185	JH	On-Demand	Anodyne	CA9	32	41
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1	ZINC000819274185	JH	On-Demand	Anodyne	NCE103	22	40
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1	ZINC000819274185	JH	On-Demand	Anodyne	LIPG	15	46
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1	ZINC000819274185	JH	On-Demand	Anodyne	MTCA1	41	42
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1	ZINC000819274185	JH	On-Demand	Anodyne	P96878_MYCTU	52	42
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1	ZINC000819274185	JH	On-Demand	Anodyne	KCNK3	119	41
CN(C)S(=O)(=O)c1ccc(F)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1	ZINC000819274185	JH	On-Demand	Anodyne	KCNK9	85	40
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819274190	EF	On-Demand	Anodyne	ADRB2	33	46
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819274190	EF	On-Demand	Anodyne	ADRB1	50	48
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819274190	EF	On-Demand	Anodyne	ADRB3	69	48
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819274190	EF	On-Demand	Anodyne	FPR1	41	39
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819274191	EF	On-Demand	Anodyne	ADRB2	33	46
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819274191	EF	On-Demand	Anodyne	ADRB1	50	48
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819274191	EF	On-Demand	Anodyne	ADRB3	69	48
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819274191	EF	On-Demand	Anodyne	FPR1	41	39
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819274192	EF	On-Demand	Anodyne	ADRB2	33	46
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819274192	EF	On-Demand	Anodyne	ADRB1	50	48
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819274192	EF	On-Demand	Anodyne	ADRB3	69	48
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819274192	EF	On-Demand	Anodyne	FPR1	41	39
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819274193	EF	On-Demand	Anodyne	ADRB2	33	46
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819274193	EF	On-Demand	Anodyne	ADRB1	50	48
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819274193	EF	On-Demand	Anodyne	ADRB3	69	48
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819274193	EF	On-Demand	Anodyne	FPR1	41	39
C[C@@H](CNC[C@@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819274194	DE	On-Demand	Anodyne	CTSD	15	42
C[C@@H](CNC[C@@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819274194	DE	On-Demand	Anodyne	CTSK	16	56
C[C@@H](CNC[C@@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819274194	DE	On-Demand	Anodyne	ECE1	24	41
C[C@@H](CNC[C@@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819274194	DE	On-Demand	Anodyne	REN	36	43
C[C@@H](CNC[C@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819274195	DE	On-Demand	Anodyne	CTSD	15	42
C[C@@H](CNC[C@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819274195	DE	On-Demand	Anodyne	CTSK	16	56
C[C@@H](CNC[C@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819274195	DE	On-Demand	Anodyne	ECE1	24	41
C[C@@H](CNC[C@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819274195	DE	On-Demand	Anodyne	REN	36	43
C[C@H](CNC[C@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819274196	DE	On-Demand	Anodyne	CTSD	15	42
C[C@H](CNC[C@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819274196	DE	On-Demand	Anodyne	CTSK	16	56
C[C@H](CNC[C@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819274196	DE	On-Demand	Anodyne	ECE1	24	41
C[C@H](CNC[C@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819274196	DE	On-Demand	Anodyne	REN	36	43
C[C@H](CNC[C@@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819274197	DE	On-Demand	Anodyne	CTSD	15	42
C[C@H](CNC[C@@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819274197	DE	On-Demand	Anodyne	CTSK	16	56
C[C@H](CNC[C@@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819274197	DE	On-Demand	Anodyne	ECE1	24	41
C[C@H](CNC[C@@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819274197	DE	On-Demand	Anodyne	REN	36	43
C[C@@H](CNC[C@H](O)COc1cccc2[nH]ccc12)NC(=O)OC(C)(C)C	ZINC000819274204	FE	On-Demand	Anodyne	ADRB2	26	63
C[C@@H](CNC[C@H](O)COc1cccc2[nH]ccc12)NC(=O)OC(C)(C)C	ZINC000819274204	FE	On-Demand	Anodyne	ADRB1	39	63
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819274220	EI	On-Demand	Anodyne	ADRB2	37	52
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819274220	EI	On-Demand	Anodyne	ADRB1	49	52
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819274220	EI	On-Demand	Anodyne	ADRB3	72	56
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819274221	EI	On-Demand	Anodyne	ADRB2	37	52
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819274221	EI	On-Demand	Anodyne	ADRB1	49	52
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819274221	EI	On-Demand	Anodyne	ADRB3	72	56
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819274222	EI	On-Demand	Anodyne	ADRB2	37	52
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819274222	EI	On-Demand	Anodyne	ADRB1	49	52
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819274222	EI	On-Demand	Anodyne	ADRB3	72	56
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819274223	EI	On-Demand	Anodyne	ADRB2	37	52
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819274223	EI	On-Demand	Anodyne	ADRB1	49	52
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819274223	EI	On-Demand	Anodyne	ADRB3	72	56
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(F)cc1	ZINC000819274232	EG	On-Demand	Anodyne	ADRB2	22	44
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(F)cc1	ZINC000819274232	EG	On-Demand	Anodyne	ADRB3	28	47
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(F)cc1	ZINC000819274233	EG	On-Demand	Anodyne	ADRB2	22	44
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(F)cc1	ZINC000819274233	EG	On-Demand	Anodyne	ADRB3	28	47
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819274234	EG	On-Demand	Anodyne	ADRB2	22	44
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819274234	EG	On-Demand	Anodyne	ADRB3	28	47
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819274235	EG	On-Demand	Anodyne	ADRB2	22	44
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819274235	EG	On-Demand	Anodyne	ADRB3	28	47
O[C@@H](CNC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(Cl)cc1	ZINC000819274249	GH	On-Demand	Anodyne	ADRB3	18	43
COCCONC[C@@H](O)COc1ccc(SC)cc1	ZINC000819274251	CD	On-Demand	Anodyne	ADRB2	32	48
COCCONC[C@@H](O)COc1ccc(SC)cc1	ZINC000819274251	CD	On-Demand	Anodyne	ADRB1	45	48
COCCONC[C@H](O)COc1ccc(SC)cc1	ZINC000819274252	CD	On-Demand	Anodyne	ADRB2	32	48
COCCONC[C@H](O)COc1ccc(SC)cc1	ZINC000819274252	CD	On-Demand	Anodyne	ADRB1	45	48
COCC1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819274258	FE	On-Demand	Mild	PAPA1_CARPA	33	46
COCC1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819274259	FE	On-Demand	Mild	PAPA1_CARPA	33	46
COCCONC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819274317	CD	On-Demand	Anodyne	ADRB2	39	49
COCCONC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819274317	CD	On-Demand	Anodyne	ADRB1	51	49
COCCONC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819274321	CD	On-Demand	Anodyne	ADRB2	39	49
COCCONC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819274321	CD	On-Demand	Anodyne	ADRB1	51	49
COCCONC[C@H](O)CCc1ccccc1	ZINC000819274328	BD	On-Demand	Anodyne	ANPEP	41	36
COCCONC[C@H](O)CCc1ccccc1	ZINC000819274328	BD	On-Demand	Anodyne	LAP3	44	36
COCCONC[C@@H](O)CCc1ccccc1	ZINC000819274330	BD	On-Demand	Anodyne	ANPEP	41	36
COCCONC[C@@H](O)CCc1ccccc1	ZINC000819274330	BD	On-Demand	Anodyne	LAP3	44	36
COCCONCCC(=O)Nc1cccc(F)c1	ZINC000819274340	CD	On-Demand	Anodyne	KCNK3	70	41
COCCONCCC(=O)Nc1cccc(F)c1	ZINC000819274340	CD	On-Demand	Anodyne	KCNK9	64	41
CON=Cc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819274341	GJ	On-Demand	Mild	PPIA	33	44
CON=Cc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819274341	GJ	On-Demand	Mild	LPL	43	33
CON=Cc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819274341	GJ	On-Demand	Mild	CPT1A	43	30
CON=Cc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819274341	GJ	On-Demand	Mild	PRNP	34	47
CON=Cc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819274341	GJ	On-Demand	Mild	KDR	15	40
CON=Cc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819274341	GJ	On-Demand	Mild	NR1H4	15	40
CON=Cc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819274341	GJ	On-Demand	Mild	TAAR1	49	41
CON=Cc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819274341	GJ	On-Demand	Mild	SMO	20	49
CON=Cc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819274341	GJ	On-Demand	Mild	KCNK3	140	51
CON=Cc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819274341	GJ	On-Demand	Mild	KCNK9	92	48
COCCONC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819274343	DE	On-Demand	Anodyne	ADRB2	58	49
COCCONC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819274343	DE	On-Demand	Anodyne	ADRB1	77	48
COCCONC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819274343	DE	On-Demand	Anodyne	ADRB3	51	46
COCCONC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819274343	DE	On-Demand	Anodyne	MMP13	17	45
COCCONC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819274343	DE	On-Demand	Anodyne	MMP2	18	45
COCCONC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819274343	DE	On-Demand	Anodyne	ABCB1	20	43
COCCONC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819274344	DE	On-Demand	Anodyne	ADRB2	58	49
COCCONC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819274344	DE	On-Demand	Anodyne	ADRB1	77	48
COCCONC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819274344	DE	On-Demand	Anodyne	ADRB3	51	46
COCCONC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819274344	DE	On-Demand	Anodyne	MMP13	17	45
COCCONC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819274344	DE	On-Demand	Anodyne	MMP2	18	45
COCCONC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819274344	DE	On-Demand	Anodyne	ABCB1	20	43
COCCONC[C@H](O)CN1CCc2ccccc2C1	ZINC000819274345	CC	On-Demand	Anodyne	NOD1	17	40
COCCONC[C@H](O)CN1CCc2ccccc2C1	ZINC000819274345	CC	On-Demand	Anodyne	NOD2	46	40
COCCONC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819274346	CC	On-Demand	Anodyne	NOD1	17	40
COCCONC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819274346	CC	On-Demand	Anodyne	NOD2	46	40
COCCONCCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000819274372	CD	On-Demand	Bother	COLA	77	34
COC[C@H](NC[C@@H](O)c1cccnc1)[C@H]1CCCO1	ZINC000819274383	CC	On-Demand	Anodyne	ADRB1	18	41
COC[C@H](NC[C@@H](O)c1cccnc1)[C@H]1CCCO1	ZINC000819274383	CC	On-Demand	Anodyne	ADRB3	53	41
COC[C@H](NC[C@H](O)c1cccnc1)[C@@H]1CCCO1	ZINC000819274384	CC	On-Demand	Anodyne	ADRB1	18	41
COC[C@H](NC[C@H](O)c1cccnc1)[C@@H]1CCCO1	ZINC000819274384	CC	On-Demand	Anodyne	ADRB3	53	41
COC[C@H](NC[C@H](O)c1cccnc1)[C@H]1CCCO1	ZINC000819274385	CC	On-Demand	Anodyne	ADRB1	18	41
COC[C@H](NC[C@H](O)c1cccnc1)[C@H]1CCCO1	ZINC000819274385	CC	On-Demand	Anodyne	ADRB3	53	41
COC[C@H](NC[C@@H](O)c1cccnc1)[C@@H]1CCCO1	ZINC000819274386	CC	On-Demand	Anodyne	ADRB1	18	41
COC[C@H](NC[C@@H](O)c1cccnc1)[C@@H]1CCCO1	ZINC000819274386	CC	On-Demand	Anodyne	ADRB3	53	41
C[C@H](CNC[C@H](O)COc1cccc2[nH]ccc12)NC(=O)OC(C)(C)C	ZINC000819274517	FE	On-Demand	Anodyne	ADRB2	26	63
C[C@H](CNC[C@H](O)COc1cccc2[nH]ccc12)NC(=O)OC(C)(C)C	ZINC000819274517	FE	On-Demand	Anodyne	ADRB1	39	63
C[C@@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)NC(=O)OC(C)(C)C	ZINC000819274518	FE	On-Demand	Anodyne	ADRB2	26	63
C[C@@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)NC(=O)OC(C)(C)C	ZINC000819274518	FE	On-Demand	Anodyne	ADRB1	39	63
C[C@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)NC(=O)OC(C)(C)C	ZINC000819274519	FE	On-Demand	Anodyne	ADRB2	26	63
C[C@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)NC(=O)OC(C)(C)C	ZINC000819274519	FE	On-Demand	Anodyne	ADRB1	39	63
C[C@H](CNC[C@@H](O)c1cccc(Br)c1)NC(=O)OC(C)(C)C	ZINC000819274520	FF	On-Demand	Anodyne	ADRB3	42	35
C[C@H](CNC[C@@H](O)c1cccc(Br)c1)NC(=O)OC(C)(C)C	ZINC000819274520	FF	On-Demand	Anodyne	PAPA1_CARPA	30	44
C[C@@H](CNC[C@H](O)c1cccc(Br)c1)NC(=O)OC(C)(C)C	ZINC000819274521	FF	On-Demand	Anodyne	ADRB3	42	35
C[C@@H](CNC[C@H](O)c1cccc(Br)c1)NC(=O)OC(C)(C)C	ZINC000819274521	FF	On-Demand	Anodyne	PAPA1_CARPA	30	44
C[C@H](CNC[C@H](O)c1cccc(Br)c1)NC(=O)OC(C)(C)C	ZINC000819274522	FF	On-Demand	Anodyne	ADRB3	42	35
C[C@H](CNC[C@H](O)c1cccc(Br)c1)NC(=O)OC(C)(C)C	ZINC000819274522	FF	On-Demand	Anodyne	PAPA1_CARPA	30	44
C[C@@H](CNC[C@@H](O)c1cccc(Br)c1)NC(=O)OC(C)(C)C	ZINC000819274523	FF	On-Demand	Anodyne	ADRB3	42	35
C[C@@H](CNC[C@@H](O)c1cccc(Br)c1)NC(=O)OC(C)(C)C	ZINC000819274523	FF	On-Demand	Anodyne	PAPA1_CARPA	30	44
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	CA2	17	48
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	PPIA	23	47
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	LPL	56	46
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	CA1	43	40
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	CPT1A	74	39
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	CPT2	40	34
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	PRNP	27	47
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	RAF1	15	42
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	GRM4	28	41
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	CA12	22	43
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	CPT1B	41	37
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	CSF1R	17	40
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	CA9	23	43
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	TAAR1	44	53
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	NCE103	15	40
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	SHH	24	40
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	LIPG	20	46
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	IMDH_CRYPV	45	37
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	SMG1	26	40
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	KCNK3	132	49
CN(C)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)ccc1Cl	ZINC000819274532	JI	On-Demand	Anodyne	KCNK9	86	45
C[C@H](CNCCS(=O)(=O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819274533	ED	On-Demand	Anodyne	PAPA1_CARPA	35	41
C[C@H](CNCCS(=O)(=O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819274533	ED	On-Demand	Anodyne	CTSK	21	48
C[C@H](CNCCS(=O)(=O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819274533	ED	On-Demand	Anodyne	FPR1	47	38
C[C@@H](CNCCS(=O)(=O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819274534	ED	On-Demand	Anodyne	PAPA1_CARPA	35	41
C[C@@H](CNCCS(=O)(=O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819274534	ED	On-Demand	Anodyne	CTSK	21	48
C[C@@H](CNCCS(=O)(=O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819274534	ED	On-Demand	Anodyne	FPR1	47	38
C[C@@H](CNC[C@H](O)c1ccccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274536	EF	On-Demand	Anodyne	PAPA1_CARPA	33	41
C[C@@H](CNC[C@H](O)c1ccccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274536	EF	On-Demand	Anodyne	FPR1	47	41
C[C@H](CNC[C@H](O)c1ccccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274537	EF	On-Demand	Anodyne	PAPA1_CARPA	33	41
C[C@H](CNC[C@H](O)c1ccccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274537	EF	On-Demand	Anodyne	FPR1	47	41
C[C@@H](CNC[C@H](O)c1ccc(F)cc1F)NC(=O)OC(C)(C)C	ZINC000819274542	EF	On-Demand	Anodyne	PAPA1_CARPA	30	40
C[C@@H](CNC[C@@H](O)c1ccc(F)cc1F)NC(=O)OC(C)(C)C	ZINC000819274543	EF	On-Demand	Anodyne	PAPA1_CARPA	30	40
C[C@H](CNC[C@@H](O)c1ccc(F)cc1F)NC(=O)OC(C)(C)C	ZINC000819274544	EF	On-Demand	Anodyne	PAPA1_CARPA	30	40
C[C@H](CNC[C@H](O)c1ccc(F)cc1F)NC(=O)OC(C)(C)C	ZINC000819274545	EF	On-Demand	Anodyne	PAPA1_CARPA	30	40
C[C@H](CNC[C@@H](C)S(C)(=O)=O)NC(=O)OC(C)(C)C	ZINC000819274546	CC	On-Demand	Anodyne	CTSK	16	46
C[C@@H](CNC[C@H](C)S(C)(=O)=O)NC(=O)OC(C)(C)C	ZINC000819274547	CC	On-Demand	Anodyne	CTSK	16	46
C[C@@H](CNC[C@@H](C)S(C)(=O)=O)NC(=O)OC(C)(C)C	ZINC000819274548	CC	On-Demand	Anodyne	CTSK	16	46
C[C@@H](CNC[C@@H](C)NC(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000819274549	CC	On-Demand	Anodyne	CTSK	16	46
C[C@H](CNCCC(=O)Nc1cccc(C(F)(F)F)c1)NC(=O)OC(C)(C)C	ZINC000819274559	GH	On-Demand	Anodyne	CCR2	21	42
C[C@@H](CNCCC(=O)Nc1cccc(C(F)(F)F)c1)NC(=O)OC(C)(C)C	ZINC000819274560	GH	On-Demand	Anodyne	CCR2	21	42
C[C@H](CNC[C@@H](O)Cc1ccc(C(F)(F)F)cc1)NC(=O)OC(C)(C)C	ZINC000819274573	GG	On-Demand	Anodyne	PAPA1_CARPA	32	41
C[C@H](CNC[C@@H](O)Cc1ccc(C(F)(F)F)cc1)NC(=O)OC(C)(C)C	ZINC000819274573	GG	On-Demand	Anodyne	FPR1	48	38
C[C@H](CNC[C@H](O)Cc1ccc(C(F)(F)F)cc1)NC(=O)OC(C)(C)C	ZINC000819274574	GG	On-Demand	Anodyne	PAPA1_CARPA	32	41
C[C@H](CNC[C@H](O)Cc1ccc(C(F)(F)F)cc1)NC(=O)OC(C)(C)C	ZINC000819274574	GG	On-Demand	Anodyne	FPR1	48	38
C[C@@H](CNC[C@H](O)Cc1ccc(C(F)(F)F)cc1)NC(=O)OC(C)(C)C	ZINC000819274575	GG	On-Demand	Anodyne	PAPA1_CARPA	32	41
C[C@@H](CNC[C@H](O)Cc1ccc(C(F)(F)F)cc1)NC(=O)OC(C)(C)C	ZINC000819274575	GG	On-Demand	Anodyne	FPR1	48	38
C[C@@H](CNC[C@@H](O)Cc1ccc(C(F)(F)F)cc1)NC(=O)OC(C)(C)C	ZINC000819274576	GG	On-Demand	Anodyne	PAPA1_CARPA	32	41
C[C@@H](CNC[C@@H](O)Cc1ccc(C(F)(F)F)cc1)NC(=O)OC(C)(C)C	ZINC000819274576	GG	On-Demand	Anodyne	FPR1	48	38
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274581	GI	On-Demand	Anodyne	DRD2	16	47
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274581	GI	On-Demand	Anodyne	DRD4	49	47
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274581	GI	On-Demand	Anodyne	ACHE	46	42
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274581	GI	On-Demand	Anodyne	SLC6A3	17	46
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274581	GI	On-Demand	Anodyne	SIGMAR1	45	47
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274582	GI	On-Demand	Anodyne	DRD2	16	47
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274582	GI	On-Demand	Anodyne	DRD4	49	47
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274582	GI	On-Demand	Anodyne	ACHE	46	42
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274582	GI	On-Demand	Anodyne	SLC6A3	17	46
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274582	GI	On-Demand	Anodyne	SIGMAR1	45	47
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274583	GI	On-Demand	Anodyne	DRD2	16	47
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274583	GI	On-Demand	Anodyne	DRD4	49	47
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274583	GI	On-Demand	Anodyne	ACHE	46	42
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274583	GI	On-Demand	Anodyne	SLC6A3	17	46
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274583	GI	On-Demand	Anodyne	SIGMAR1	45	47
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274584	GI	On-Demand	Anodyne	DRD2	16	47
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274584	GI	On-Demand	Anodyne	DRD4	49	47
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274584	GI	On-Demand	Anodyne	ACHE	46	42
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274584	GI	On-Demand	Anodyne	SLC6A3	17	46
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)cc1Cl	ZINC000819274584	GI	On-Demand	Anodyne	SIGMAR1	45	47
C[C@H](CNC[C@@H](O)c1ccc(Br)cc1)NC(=O)OC(C)(C)C	ZINC000819274594	FF	On-Demand	Anodyne	PAPA1_CARPA	32	43
C[C@H](CNC[C@@H](O)c1ccc(Br)cc1)NC(=O)OC(C)(C)C	ZINC000819274594	FF	On-Demand	Anodyne	CTSK	15	41
C[C@@H](CNC[C@H](O)c1ccc(Br)cc1)NC(=O)OC(C)(C)C	ZINC000819274596	FF	On-Demand	Anodyne	PAPA1_CARPA	32	43
C[C@@H](CNC[C@H](O)c1ccc(Br)cc1)NC(=O)OC(C)(C)C	ZINC000819274596	FF	On-Demand	Anodyne	CTSK	15	41
C[C@H](CNC[C@H](O)c1ccc(Br)cc1)NC(=O)OC(C)(C)C	ZINC000819274597	FF	On-Demand	Anodyne	PAPA1_CARPA	32	43
C[C@H](CNC[C@H](O)c1ccc(Br)cc1)NC(=O)OC(C)(C)C	ZINC000819274597	FF	On-Demand	Anodyne	CTSK	15	41
C[C@@H](CNC[C@@H](O)c1ccc(Br)cc1)NC(=O)OC(C)(C)C	ZINC000819274599	FF	On-Demand	Anodyne	PAPA1_CARPA	32	43
C[C@@H](CNC[C@@H](O)c1ccc(Br)cc1)NC(=O)OC(C)(C)C	ZINC000819274599	FF	On-Demand	Anodyne	CTSK	15	41
O=C(CN(Cc1cccnc1)C(=O)C(F)=C1CCC1)Nc1ccc(Cl)cc1	ZINC000819274600	GI	On-Demand	Anodyne	NAMPT	41	42
C[C@H](CNC[C@@H](O)COc1ccccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274615	FF	On-Demand	Anodyne	ADRB2	33	53
C[C@H](CNC[C@@H](O)COc1ccccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274615	FF	On-Demand	Anodyne	ADRB1	60	35
C[C@H](CNC[C@@H](O)COc1ccccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274615	FF	On-Demand	Anodyne	FPR1	41	36
C[C@H](CNC[C@H](O)COc1ccccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274617	FF	On-Demand	Anodyne	ADRB2	33	53
C[C@H](CNC[C@H](O)COc1ccccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274617	FF	On-Demand	Anodyne	ADRB1	60	35
C[C@H](CNC[C@H](O)COc1ccccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274617	FF	On-Demand	Anodyne	FPR1	41	36
C[C@@H](CNC[C@@H](O)COc1ccccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274619	FF	On-Demand	Anodyne	ADRB2	33	53
C[C@@H](CNC[C@@H](O)COc1ccccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274619	FF	On-Demand	Anodyne	ADRB1	60	35
C[C@@H](CNC[C@@H](O)COc1ccccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274619	FF	On-Demand	Anodyne	FPR1	41	36
C[C@@H](CNC[C@H](O)COc1ccccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274620	FF	On-Demand	Anodyne	ADRB2	33	53
C[C@@H](CNC[C@H](O)COc1ccccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274620	FF	On-Demand	Anodyne	ADRB1	60	35
C[C@@H](CNC[C@H](O)COc1ccccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274620	FF	On-Demand	Anodyne	FPR1	41	36
N#C[C@H]1CN(C(=O)Cc2ccc(-n3cnnc3)cc2)CCN1C1CC1	ZINC000819274623	ED	On-Demand	Mild	KCNJ1	49	43
N#C[C@@H]1CN(C(=O)Cc2ccc(-n3cnnc3)cc2)CCN1C1CC1	ZINC000819274624	ED	On-Demand	Mild	KCNJ1	49	43
C[C@@H](CNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1)NC(=O)OC(C)(C)C	ZINC000819274626	GG	On-Demand	Anodyne	CYNT	49	46
C[C@H](CNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1)NC(=O)OC(C)(C)C	ZINC000819274627	GG	On-Demand	Anodyne	CYNT	49	46
C[C@@H](CNC[C@H](O)COc1cc(Cl)ccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274640	GG	On-Demand	Anodyne	ADRB2	23	40
C[C@H](CNC[C@@H](O)COc1cc(Cl)ccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274641	GG	On-Demand	Anodyne	ADRB2	23	40
C[C@@H](CNC[C@@H](O)COc1cc(Cl)ccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274642	GG	On-Demand	Anodyne	ADRB2	23	40
C[C@H](CNC[C@H](O)COc1cc(Cl)ccc1Cl)NC(=O)OC(C)(C)C	ZINC000819274643	GG	On-Demand	Anodyne	ADRB2	23	40
C[C@@H](CNC[C@@H](O)COc1ccc(Cl)cc1)NC(=O)OC(C)(C)C	ZINC000819274651	FF	On-Demand	Anodyne	ADRB2	47	45
C[C@@H](CNC[C@@H](O)COc1ccc(Cl)cc1)NC(=O)OC(C)(C)C	ZINC000819274651	FF	On-Demand	Anodyne	ADRB1	66	44
C[C@@H](CNC[C@@H](O)COc1ccc(Cl)cc1)NC(=O)OC(C)(C)C	ZINC000819274651	FF	On-Demand	Anodyne	ADRB3	37	40
C[C@@H](CNC[C@H](O)COc1ccc(Cl)cc1)NC(=O)OC(C)(C)C	ZINC000819274652	FF	On-Demand	Anodyne	ADRB2	47	45
C[C@@H](CNC[C@H](O)COc1ccc(Cl)cc1)NC(=O)OC(C)(C)C	ZINC000819274652	FF	On-Demand	Anodyne	ADRB1	66	44
C[C@@H](CNC[C@H](O)COc1ccc(Cl)cc1)NC(=O)OC(C)(C)C	ZINC000819274652	FF	On-Demand	Anodyne	ADRB3	37	40
C[C@H](CNC[C@H](O)COc1ccc(Cl)cc1)NC(=O)OC(C)(C)C	ZINC000819274653	FF	On-Demand	Anodyne	ADRB2	47	45
C[C@H](CNC[C@H](O)COc1ccc(Cl)cc1)NC(=O)OC(C)(C)C	ZINC000819274653	FF	On-Demand	Anodyne	ADRB1	66	44
C[C@H](CNC[C@H](O)COc1ccc(Cl)cc1)NC(=O)OC(C)(C)C	ZINC000819274653	FF	On-Demand	Anodyne	ADRB3	37	40
C[C@H](CNC[C@@H](O)COc1ccc(Cl)cc1)NC(=O)OC(C)(C)C	ZINC000819274654	FF	On-Demand	Anodyne	ADRB2	47	45
C[C@H](CNC[C@@H](O)COc1ccc(Cl)cc1)NC(=O)OC(C)(C)C	ZINC000819274654	FF	On-Demand	Anodyne	ADRB1	66	44
C[C@H](CNC[C@@H](O)COc1ccc(Cl)cc1)NC(=O)OC(C)(C)C	ZINC000819274654	FF	On-Demand	Anodyne	ADRB3	37	40
COc1cccc([S@@](=O)CC(=O)NCC[S@@](=O)C(C)(C)C)c1	ZINC000819274672	ED	On-Demand	Anodyne	DRD4	42	32
COc1cccc([S@@](=O)CC(=O)NCC[S@@](=O)C(C)(C)C)c1	ZINC000819274672	ED	On-Demand	Anodyne	MTNR1A	51	42
COc1cccc([S@@](=O)CC(=O)NCC[S@@](=O)C(C)(C)C)c1	ZINC000819274672	ED	On-Demand	Anodyne	MTNR1B	47	41
COc1cccc([S@@](=O)CC(=O)NCC[S@](=O)C(C)(C)C)c1	ZINC000819274674	ED	On-Demand	Anodyne	DRD4	42	32
COc1cccc([S@@](=O)CC(=O)NCC[S@](=O)C(C)(C)C)c1	ZINC000819274674	ED	On-Demand	Anodyne	MTNR1A	51	42
COc1cccc([S@@](=O)CC(=O)NCC[S@](=O)C(C)(C)C)c1	ZINC000819274674	ED	On-Demand	Anodyne	MTNR1B	47	41
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(C)cc1	ZINC000819274696	EH	On-Demand	Anodyne	ADRB2	21	46
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(C)cc1	ZINC000819274696	EH	On-Demand	Anodyne	ADRB3	29	48
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(C)cc1	ZINC000819274699	EH	On-Demand	Anodyne	ADRB2	21	46
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(C)cc1	ZINC000819274699	EH	On-Demand	Anodyne	ADRB3	29	48
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(C)cc1	ZINC000819274700	EH	On-Demand	Anodyne	ADRB2	21	46
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(C)cc1	ZINC000819274700	EH	On-Demand	Anodyne	ADRB3	29	48
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(C)cc1	ZINC000819274701	EH	On-Demand	Anodyne	ADRB2	21	46
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(C)cc1	ZINC000819274701	EH	On-Demand	Anodyne	ADRB3	29	48
C[C@@H](CNC[C@H](O)COc1ccc(Cl)cc1Cl)NC(=O)OC(C)(C)C	ZINC000819274705	GG	On-Demand	Anodyne	ADRB2	22	40
C[C@H](CNC[C@@H](O)COc1ccc(Cl)cc1Cl)NC(=O)OC(C)(C)C	ZINC000819274707	GG	On-Demand	Anodyne	ADRB2	22	40
C[C@@H](CNC[C@@H](O)COc1ccc(Cl)cc1Cl)NC(=O)OC(C)(C)C	ZINC000819274709	GG	On-Demand	Anodyne	ADRB2	22	40
C[C@H](CNC[C@H](O)COc1ccc(Cl)cc1Cl)NC(=O)OC(C)(C)C	ZINC000819274710	GG	On-Demand	Anodyne	ADRB2	22	40
CCCCC[C@@H](CC)C(=O)N1CC(OCC)C1	ZINC000819274822	BF	On-Demand	Anodyne	CQSS	51	31
C=C(C)C(C)(C)C(=O)NCC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000819274860	FE	On-Demand	Mild	CACNA1I	46	34
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274872	GH	On-Demand	Anodyne	DRD4	35	51
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274872	GH	On-Demand	Anodyne	ACHE	44	40
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274872	GH	On-Demand	Anodyne	SLC6A3	16	48
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274872	GH	On-Demand	Anodyne	HTR4	29	43
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274872	GH	On-Demand	Anodyne	SIGMAR1	49	45
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274872	GH	On-Demand	Anodyne	SLC18A3	25	40
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274873	GH	On-Demand	Anodyne	DRD4	35	51
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274873	GH	On-Demand	Anodyne	ACHE	44	40
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274873	GH	On-Demand	Anodyne	SLC6A3	16	48
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274873	GH	On-Demand	Anodyne	HTR4	29	43
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274873	GH	On-Demand	Anodyne	SIGMAR1	49	45
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274873	GH	On-Demand	Anodyne	SLC18A3	25	40
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274874	GH	On-Demand	Anodyne	DRD4	35	51
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274874	GH	On-Demand	Anodyne	ACHE	44	40
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274874	GH	On-Demand	Anodyne	SLC6A3	16	48
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274874	GH	On-Demand	Anodyne	HTR4	29	43
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274874	GH	On-Demand	Anodyne	SIGMAR1	49	45
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274874	GH	On-Demand	Anodyne	SLC18A3	25	40
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274875	GH	On-Demand	Anodyne	DRD4	35	51
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274875	GH	On-Demand	Anodyne	ACHE	44	40
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274875	GH	On-Demand	Anodyne	SLC6A3	16	48
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274875	GH	On-Demand	Anodyne	HTR4	29	43
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274875	GH	On-Demand	Anodyne	SIGMAR1	49	45
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1Br	ZINC000819274875	GH	On-Demand	Anodyne	SLC18A3	25	40
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819274878	FH	On-Demand	Anodyne	DRD2	17	46
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819274878	FH	On-Demand	Anodyne	DRD4	49	48
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819274878	FH	On-Demand	Anodyne	ACHE	51	52
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819274878	FH	On-Demand	Anodyne	DRD3	17	48
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819274878	FH	On-Demand	Anodyne	HTR4	24	43
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819274878	FH	On-Demand	Anodyne	SIGMAR1	59	50
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819274878	FH	On-Demand	Anodyne	BCHE	15	52
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819274879	FH	On-Demand	Anodyne	DRD2	17	46
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819274879	FH	On-Demand	Anodyne	DRD4	49	48
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819274879	FH	On-Demand	Anodyne	ACHE	51	52
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819274879	FH	On-Demand	Anodyne	DRD3	17	48
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819274879	FH	On-Demand	Anodyne	HTR4	24	43
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819274879	FH	On-Demand	Anodyne	SIGMAR1	59	50
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC000819274879	FH	On-Demand	Anodyne	BCHE	15	52
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819274886	FH	On-Demand	Anodyne	DRD4	34	45
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819274886	FH	On-Demand	Anodyne	SLC6A3	36	51
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819274886	FH	On-Demand	Anodyne	SIGMAR1	40	50
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819274886	FH	On-Demand	Anodyne	CCR3	42	36
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819274887	FH	On-Demand	Anodyne	DRD4	34	45
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819274887	FH	On-Demand	Anodyne	SLC6A3	36	51
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819274887	FH	On-Demand	Anodyne	SIGMAR1	40	50
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819274887	FH	On-Demand	Anodyne	CCR3	42	36
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819274888	FH	On-Demand	Anodyne	DRD4	34	45
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819274888	FH	On-Demand	Anodyne	SLC6A3	36	51
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819274888	FH	On-Demand	Anodyne	SIGMAR1	40	50
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819274888	FH	On-Demand	Anodyne	CCR3	42	36
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819274889	FH	On-Demand	Anodyne	DRD4	34	45
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819274889	FH	On-Demand	Anodyne	SLC6A3	36	51
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819274889	FH	On-Demand	Anodyne	SIGMAR1	40	50
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Cl)c(F)c1	ZINC000819274889	FH	On-Demand	Anodyne	CCR3	42	36
COc1cc(NC(=O)[C@H]2C[C@@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274911	JK	On-Demand	Anodyne	LPL	44	34
COc1cc(NC(=O)[C@H]2C[C@@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274911	JK	On-Demand	Anodyne	KDR	46	40
COc1cc(NC(=O)[C@H]2C[C@@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274911	JK	On-Demand	Anodyne	PDGFRA	45	39
COc1cc(NC(=O)[C@H]2C[C@@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274911	JK	On-Demand	Anodyne	SMO	21	44
COc1cc(NC(=O)[C@H]2C[C@@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274911	JK	On-Demand	Anodyne	KCNK3	114	50
COc1cc(NC(=O)[C@H]2C[C@@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274911	JK	On-Demand	Anodyne	KCNK9	84	50
COc1cc(NC(=O)[C@@H]2C[C@@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274912	JK	On-Demand	Anodyne	LPL	44	34
COc1cc(NC(=O)[C@@H]2C[C@@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274912	JK	On-Demand	Anodyne	KDR	46	40
COc1cc(NC(=O)[C@@H]2C[C@@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274912	JK	On-Demand	Anodyne	PDGFRA	45	39
COc1cc(NC(=O)[C@@H]2C[C@@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274912	JK	On-Demand	Anodyne	SMO	21	44
COc1cc(NC(=O)[C@@H]2C[C@@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274912	JK	On-Demand	Anodyne	KCNK3	114	50
COc1cc(NC(=O)[C@@H]2C[C@@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274912	JK	On-Demand	Anodyne	KCNK9	84	50
COc1cc(NC(=O)[C@@H]2C[C@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274913	JK	On-Demand	Anodyne	LPL	44	34
COc1cc(NC(=O)[C@@H]2C[C@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274913	JK	On-Demand	Anodyne	KDR	46	40
COc1cc(NC(=O)[C@@H]2C[C@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274913	JK	On-Demand	Anodyne	PDGFRA	45	39
COc1cc(NC(=O)[C@@H]2C[C@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274913	JK	On-Demand	Anodyne	SMO	21	44
COc1cc(NC(=O)[C@@H]2C[C@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274913	JK	On-Demand	Anodyne	KCNK3	114	50
COc1cc(NC(=O)[C@@H]2C[C@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274913	JK	On-Demand	Anodyne	KCNK9	84	50
COc1cc(NC(=O)[C@H]2C[C@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274914	JK	On-Demand	Anodyne	LPL	44	34
COc1cc(NC(=O)[C@H]2C[C@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274914	JK	On-Demand	Anodyne	KDR	46	40
COc1cc(NC(=O)[C@H]2C[C@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274914	JK	On-Demand	Anodyne	PDGFRA	45	39
COc1cc(NC(=O)[C@H]2C[C@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274914	JK	On-Demand	Anodyne	SMO	21	44
COc1cc(NC(=O)[C@H]2C[C@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274914	JK	On-Demand	Anodyne	KCNK3	114	50
COc1cc(NC(=O)[C@H]2C[C@H]2C)c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1OC	ZINC000819274914	JK	On-Demand	Anodyne	KCNK9	84	50
Cc1ccccc1[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274933	GI	On-Demand	Mild	KLK3	52	32
Cc1ccccc1[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274933	GI	On-Demand	Mild	PAPA1_CARPA	61	48
Cc1ccccc1[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274933	GI	On-Demand	Mild	CCKAR	40	36
Cc1ccccc1[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274933	GI	On-Demand	Mild	CTSK	31	47
Cc1ccccc1[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274933	GI	On-Demand	Mild	CTSL	23	48
Cc1ccccc1[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274933	GI	On-Demand	Mild	REN	37	40
Cc1ccccc1[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274933	GI	On-Demand	Mild	CTSS	18	48
Cc1ccccc1[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274933	GI	On-Demand	Mild	CAPN1	20	43
Cc1ccccc1[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274933	GI	On-Demand	Mild	FPR1	54	46
Cc1ccccc1[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274934	GI	On-Demand	Mild	KLK3	52	32
Cc1ccccc1[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274934	GI	On-Demand	Mild	PAPA1_CARPA	61	48
Cc1ccccc1[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274934	GI	On-Demand	Mild	CCKAR	40	36
Cc1ccccc1[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274934	GI	On-Demand	Mild	CTSK	31	47
Cc1ccccc1[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274934	GI	On-Demand	Mild	CTSL	23	48
Cc1ccccc1[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274934	GI	On-Demand	Mild	REN	37	40
Cc1ccccc1[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274934	GI	On-Demand	Mild	CTSS	18	48
Cc1ccccc1[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274934	GI	On-Demand	Mild	CAPN1	20	43
Cc1ccccc1[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274934	GI	On-Demand	Mild	FPR1	54	46
Cc1ccccc1[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274935	GI	On-Demand	Mild	KLK3	52	32
Cc1ccccc1[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274935	GI	On-Demand	Mild	PAPA1_CARPA	61	48
Cc1ccccc1[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274935	GI	On-Demand	Mild	CCKAR	40	36
Cc1ccccc1[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274935	GI	On-Demand	Mild	CTSK	31	47
Cc1ccccc1[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274935	GI	On-Demand	Mild	CTSL	23	48
Cc1ccccc1[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274935	GI	On-Demand	Mild	REN	37	40
Cc1ccccc1[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274935	GI	On-Demand	Mild	CTSS	18	48
Cc1ccccc1[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274935	GI	On-Demand	Mild	CAPN1	20	43
Cc1ccccc1[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274935	GI	On-Demand	Mild	FPR1	54	46
Cc1ccccc1[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274936	GI	On-Demand	Mild	KLK3	52	32
Cc1ccccc1[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274936	GI	On-Demand	Mild	PAPA1_CARPA	61	48
Cc1ccccc1[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274936	GI	On-Demand	Mild	CCKAR	40	36
Cc1ccccc1[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274936	GI	On-Demand	Mild	CTSK	31	47
Cc1ccccc1[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274936	GI	On-Demand	Mild	CTSL	23	48
Cc1ccccc1[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274936	GI	On-Demand	Mild	REN	37	40
Cc1ccccc1[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274936	GI	On-Demand	Mild	CTSS	18	48
Cc1ccccc1[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274936	GI	On-Demand	Mild	CAPN1	20	43
Cc1ccccc1[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819274936	GI	On-Demand	Mild	FPR1	54	46
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274943	FH	On-Demand	Anodyne	DRD2	15	46
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274943	FH	On-Demand	Anodyne	DRD4	35	46
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274943	FH	On-Demand	Anodyne	ACHE	43	42
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274943	FH	On-Demand	Anodyne	SLC6A3	27	54
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274943	FH	On-Demand	Anodyne	SIGMAR1	46	51
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274943	FH	On-Demand	Anodyne	CCR3	60	43
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274944	FH	On-Demand	Anodyne	DRD2	15	46
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274944	FH	On-Demand	Anodyne	DRD4	35	46
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274944	FH	On-Demand	Anodyne	ACHE	43	42
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274944	FH	On-Demand	Anodyne	SLC6A3	27	54
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274944	FH	On-Demand	Anodyne	SIGMAR1	46	51
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274944	FH	On-Demand	Anodyne	CCR3	60	43
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274945	FH	On-Demand	Anodyne	DRD2	15	46
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274945	FH	On-Demand	Anodyne	DRD4	35	46
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274945	FH	On-Demand	Anodyne	ACHE	43	42
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274945	FH	On-Demand	Anodyne	SLC6A3	27	54
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274945	FH	On-Demand	Anodyne	SIGMAR1	46	51
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274945	FH	On-Demand	Anodyne	CCR3	60	43
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274947	FH	On-Demand	Anodyne	DRD2	15	46
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274947	FH	On-Demand	Anodyne	DRD4	35	46
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274947	FH	On-Demand	Anodyne	ACHE	43	42
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274947	FH	On-Demand	Anodyne	SLC6A3	27	54
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274947	FH	On-Demand	Anodyne	SIGMAR1	46	51
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819274947	FH	On-Demand	Anodyne	CCR3	60	43
O[C@@H](CNC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(Cl)c1	ZINC000819274961	GH	On-Demand	Anodyne	ADRB1	30	45
O[C@@H](CNC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(Cl)c1	ZINC000819274961	GH	On-Demand	Anodyne	ADRB3	48	47
O[C@@H](CNC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(Cl)c1	ZINC000819274961	GH	On-Demand	Anodyne	CYP3A4	49	37
O[C@H](CNC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(Cl)c1	ZINC000819274962	GH	On-Demand	Anodyne	ADRB1	30	45
O[C@H](CNC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(Cl)c1	ZINC000819274962	GH	On-Demand	Anodyne	ADRB3	48	47
O[C@H](CNC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccc(Cl)c1	ZINC000819274962	GH	On-Demand	Anodyne	CYP3A4	49	37
O[C@@H](CNC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccnc1	ZINC000819274963	EF	On-Demand	Anodyne	ADRB3	50	46
O[C@H](CNC1CC(N2CCC(C(F)(F)F)CC2)C1)c1cccnc1	ZINC000819274964	EF	On-Demand	Anodyne	ADRB3	50	46
C[C@@H](CNC[C@@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274991	FG	On-Demand	Anodyne	ADRB2	40	64
C[C@@H](CNC[C@@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274991	FG	On-Demand	Anodyne	ADRB1	65	41
C[C@@H](CNC[C@@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274991	FG	On-Demand	Anodyne	ADRB3	18	59
C[C@@H](CNC[C@@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274991	FG	On-Demand	Anodyne	CYP2D6	23	48
C[C@@H](CNC[C@@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274991	FG	On-Demand	Anodyne	ABCB1	26	41
C[C@@H](CNC[C@@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274991	FG	On-Demand	Anodyne	FPR1	40	36
C[C@H](CNC[C@@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274992	FG	On-Demand	Anodyne	ADRB2	40	64
C[C@H](CNC[C@@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274992	FG	On-Demand	Anodyne	ADRB1	65	41
C[C@H](CNC[C@@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274992	FG	On-Demand	Anodyne	ADRB3	18	59
C[C@H](CNC[C@@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274992	FG	On-Demand	Anodyne	CYP2D6	23	48
C[C@H](CNC[C@@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274992	FG	On-Demand	Anodyne	ABCB1	26	41
C[C@H](CNC[C@@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274992	FG	On-Demand	Anodyne	FPR1	40	36
C[C@@H](CNC[C@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274993	FG	On-Demand	Anodyne	ADRB2	40	64
C[C@@H](CNC[C@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274993	FG	On-Demand	Anodyne	ADRB1	65	41
C[C@@H](CNC[C@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274993	FG	On-Demand	Anodyne	ADRB3	18	59
C[C@@H](CNC[C@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274993	FG	On-Demand	Anodyne	CYP2D6	23	48
C[C@@H](CNC[C@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274993	FG	On-Demand	Anodyne	ABCB1	26	41
C[C@@H](CNC[C@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274993	FG	On-Demand	Anodyne	FPR1	40	36
C[C@H](CNC[C@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274994	FG	On-Demand	Anodyne	ADRB2	40	64
C[C@H](CNC[C@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274994	FG	On-Demand	Anodyne	ADRB1	65	41
C[C@H](CNC[C@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274994	FG	On-Demand	Anodyne	ADRB3	18	59
C[C@H](CNC[C@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274994	FG	On-Demand	Anodyne	CYP2D6	23	48
C[C@H](CNC[C@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274994	FG	On-Demand	Anodyne	ABCB1	26	41
C[C@H](CNC[C@H](O)COc1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819274994	FG	On-Demand	Anodyne	FPR1	40	36
O=C(Nc1ccccc1)Nc1cccc(NC(=O)[C@@H]2CSCCS2)c1	ZINC000819275022	FI	On-Demand	Anodyne	EPHX2	30	46
O=C(Nc1ccccc1)Nc1cccc(NC(=O)[C@@H]2CSCCS2)c1	ZINC000819275022	FI	On-Demand	Anodyne	KCNK3	60	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)[C@H]2CSCCS2)c1	ZINC000819275023	FI	On-Demand	Anodyne	EPHX2	30	46
O=C(Nc1ccccc1)Nc1cccc(NC(=O)[C@H]2CSCCS2)c1	ZINC000819275023	FI	On-Demand	Anodyne	KCNK3	60	41
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819275024	EH	On-Demand	Anodyne	ADRB3	31	49
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819275025	EH	On-Demand	Anodyne	ADRB3	31	49
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819275026	EH	On-Demand	Anodyne	ADRB3	31	49
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819275027	EH	On-Demand	Anodyne	ADRB3	31	49
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(F)cc1F	ZINC000819275040	EH	On-Demand	Anodyne	ADRB3	15	41
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(F)cc1F	ZINC000819275041	EH	On-Demand	Anodyne	ADRB3	15	41
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(F)cc1F	ZINC000819275042	EH	On-Demand	Anodyne	ADRB3	15	41
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(F)cc1F	ZINC000819275043	EH	On-Demand	Anodyne	ADRB3	15	41
Cc1ccc(OC[C@@H](O)CNC[C@@H](C)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819275050	FF	On-Demand	Anodyne	ADRB2	24	48
Cc1ccc(OC[C@@H](O)CNC[C@H](C)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819275052	FF	On-Demand	Anodyne	ADRB2	24	48
Cc1ccc(OC[C@H](O)CNC[C@@H](C)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819275054	FF	On-Demand	Anodyne	ADRB2	24	48
Cc1ccc(OC[C@H](O)CNC[C@H](C)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819275056	FF	On-Demand	Anodyne	ADRB2	24	48
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)c1	ZINC000819275059	JK	On-Demand	Anodyne	LPL	45	43
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)c1	ZINC000819275059	JK	On-Demand	Anodyne	CA1	27	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)c1	ZINC000819275059	JK	On-Demand	Anodyne	CA12	17	49
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)c1	ZINC000819275059	JK	On-Demand	Anodyne	CA9	16	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)c1	ZINC000819275059	JK	On-Demand	Anodyne	LIPG	15	43
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)c1	ZINC000819275059	JK	On-Demand	Anodyne	MTCA1	29	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)c1	ZINC000819275059	JK	On-Demand	Anodyne	P96878_MYCTU	37	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)c1	ZINC000819275059	JK	On-Demand	Anodyne	KCNK3	92	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(CS(=O)(=O)c3ccccc3)o2)c1	ZINC000819275059	JK	On-Demand	Anodyne	KCNK9	61	35
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc3ncccc3c2)CC1	ZINC000819275061	GG	On-Demand	Anodyne	GRIN2B	18	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc3ncccc3c2)CC1	ZINC000819275061	GG	On-Demand	Anodyne	GPR119	52	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc3ncccc3c2)CC1	ZINC000819275064	GG	On-Demand	Anodyne	GRIN2B	18	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc3ncccc3c2)CC1	ZINC000819275064	GG	On-Demand	Anodyne	GPR119	52	46
C[C@H](CNC[C@@H](O)Cc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275065	EE	On-Demand	Anodyne	PAPA1_CARPA	36	53
C[C@H](CNC[C@@H](O)Cc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275065	EE	On-Demand	Anodyne	CTSK	17	46
C[C@H](CNC[C@@H](O)Cc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275065	EE	On-Demand	Anodyne	FPR1	50	39
C[C@H](CNC[C@H](O)Cc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275067	EE	On-Demand	Anodyne	PAPA1_CARPA	36	53
C[C@H](CNC[C@H](O)Cc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275067	EE	On-Demand	Anodyne	CTSK	17	46
C[C@H](CNC[C@H](O)Cc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275067	EE	On-Demand	Anodyne	FPR1	50	39
C[C@@H](CNC[C@H](O)Cc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275068	EE	On-Demand	Anodyne	PAPA1_CARPA	36	53
C[C@@H](CNC[C@H](O)Cc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275068	EE	On-Demand	Anodyne	CTSK	17	46
C[C@@H](CNC[C@H](O)Cc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275068	EE	On-Demand	Anodyne	FPR1	50	39
C[C@@H](CNC[C@@H](O)Cc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275070	EE	On-Demand	Anodyne	PAPA1_CARPA	36	53
C[C@@H](CNC[C@@H](O)Cc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275070	EE	On-Demand	Anodyne	CTSK	17	46
C[C@@H](CNC[C@@H](O)Cc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275070	EE	On-Demand	Anodyne	FPR1	50	39
C[C@@H](CNC[C@@H](O)Cn1c(-c2ccccc2)noc1=O)NC(=O)OC(C)(C)C	ZINC000819275072	GD	On-Demand	Anodyne	FPR1	41	36
C[C@H](CNC[C@H](O)Cn1c(-c2ccccc2)noc1=O)NC(=O)OC(C)(C)C	ZINC000819275074	GD	On-Demand	Anodyne	FPR1	41	36
C[C@H](CNC[C@@H](O)Cn1c(-c2ccccc2)noc1=O)NC(=O)OC(C)(C)C	ZINC000819275077	GD	On-Demand	Anodyne	FPR1	41	36
C[C@@H](CNC[C@H](O)Cn1c(-c2ccccc2)noc1=O)NC(=O)OC(C)(C)C	ZINC000819275079	GD	On-Demand	Anodyne	FPR1	41	36
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc3ccccc23)c1	ZINC000819275086	HK	On-Demand	Anodyne	PPIA	36	46
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc3ccccc23)c1	ZINC000819275086	HK	On-Demand	Anodyne	CA1	32	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc3ccccc23)c1	ZINC000819275086	HK	On-Demand	Anodyne	PRNP	21	43
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc3ccccc23)c1	ZINC000819275086	HK	On-Demand	Anodyne	KDR	32	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc3ccccc23)c1	ZINC000819275086	HK	On-Demand	Anodyne	GRM4	41	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc3ccccc23)c1	ZINC000819275086	HK	On-Demand	Anodyne	NR2E3	70	39
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc3ccccc23)c1	ZINC000819275086	HK	On-Demand	Anodyne	SHH	35	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc3ccccc23)c1	ZINC000819275086	HK	On-Demand	Anodyne	SMO	26	42
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc3ccccc23)c1	ZINC000819275086	HK	On-Demand	Anodyne	KCNK3	124	49
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(Cl)nc3ccccc23)c1	ZINC000819275086	HK	On-Demand	Anodyne	KCNK9	85	41
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819275100	DF	On-Demand	Anodyne	ADRB2	27	42
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819275100	DF	On-Demand	Anodyne	ADRB1	30	49
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819275100	DF	On-Demand	Anodyne	ADRB3	84	49
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819275102	DF	On-Demand	Anodyne	ADRB2	27	42
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819275102	DF	On-Demand	Anodyne	ADRB1	30	49
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819275102	DF	On-Demand	Anodyne	ADRB3	84	49
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819275104	DF	On-Demand	Anodyne	ADRB2	27	42
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819275104	DF	On-Demand	Anodyne	ADRB1	30	49
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819275104	DF	On-Demand	Anodyne	ADRB3	84	49
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819275106	DF	On-Demand	Anodyne	ADRB2	27	42
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819275106	DF	On-Demand	Anodyne	ADRB1	30	49
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819275106	DF	On-Demand	Anodyne	ADRB3	84	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(N2CCCC2=O)c(F)c1	ZINC000819275130	GF	On-Demand	Anodyne	NPY2R	42	35
O[C@@H](CNCCCCn1cc(Br)cn1)c1cccc(F)c1	ZINC000819275142	FF	On-Demand	Anodyne	ADRB1	21	40
O[C@@H](CNCCCCn1cc(Br)cn1)c1cccc(F)c1	ZINC000819275142	FF	On-Demand	Anodyne	ADRB3	30	40
O[C@H](CNCCCCn1cc(Br)cn1)c1cccc(F)c1	ZINC000819275144	FF	On-Demand	Anodyne	ADRB1	21	40
O[C@H](CNCCCCn1cc(Br)cn1)c1cccc(F)c1	ZINC000819275144	FF	On-Demand	Anodyne	ADRB3	30	40
C[C@H](CNC[C@H](O)[C@H](C)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275146	DF	On-Demand	Anodyne	PAPA1_CARPA	37	43
C[C@H](CNC[C@H](O)[C@H](C)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275146	DF	On-Demand	Anodyne	CTSK	25	54
C[C@H](CNC[C@H](O)[C@H](C)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275146	DF	On-Demand	Anodyne	REN	47	41
C[C@H](CNC[C@H](O)[C@H](C)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275146	DF	On-Demand	Anodyne	FPR1	50	40
C[C@H](CNC[C@@H](O)[C@H](C)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275148	DF	On-Demand	Anodyne	PAPA1_CARPA	37	43
C[C@H](CNC[C@@H](O)[C@H](C)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275148	DF	On-Demand	Anodyne	CTSK	25	54
C[C@H](CNC[C@@H](O)[C@H](C)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275148	DF	On-Demand	Anodyne	REN	47	41
C[C@H](CNC[C@@H](O)[C@H](C)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275148	DF	On-Demand	Anodyne	FPR1	50	40
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275153	GH	On-Demand	Anodyne	DRD4	31	47
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275153	GH	On-Demand	Anodyne	ACHE	46	40
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275153	GH	On-Demand	Anodyne	SLC6A3	21	51
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275153	GH	On-Demand	Anodyne	HTR4	29	41
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275153	GH	On-Demand	Anodyne	SIGMAR1	48	50
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275155	GH	On-Demand	Anodyne	DRD4	31	47
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275155	GH	On-Demand	Anodyne	ACHE	46	40
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275155	GH	On-Demand	Anodyne	SLC6A3	21	51
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275155	GH	On-Demand	Anodyne	HTR4	29	41
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275155	GH	On-Demand	Anodyne	SIGMAR1	48	50
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275157	GH	On-Demand	Anodyne	DRD4	31	47
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275157	GH	On-Demand	Anodyne	ACHE	46	40
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275157	GH	On-Demand	Anodyne	SLC6A3	21	51
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275157	GH	On-Demand	Anodyne	HTR4	29	41
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275157	GH	On-Demand	Anodyne	SIGMAR1	48	50
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275159	GH	On-Demand	Anodyne	DRD4	31	47
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275159	GH	On-Demand	Anodyne	ACHE	46	40
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275159	GH	On-Demand	Anodyne	SLC6A3	21	51
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275159	GH	On-Demand	Anodyne	HTR4	29	41
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1C(F)(F)F	ZINC000819275159	GH	On-Demand	Anodyne	SIGMAR1	48	50
C[C@@H](CNC[C@@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275162	CE	On-Demand	Anodyne	ADRB1	31	43
C[C@@H](CNC[C@@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275162	CE	On-Demand	Anodyne	ADRB3	54	43
C[C@@H](CNC[C@@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275162	CE	On-Demand	Anodyne	PAPA1_CARPA	39	44
C[C@@H](CNC[C@@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275162	CE	On-Demand	Anodyne	CTSK	27	56
C[C@@H](CNC[C@@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275162	CE	On-Demand	Anodyne	REN	36	40
C[C@@H](CNC[C@@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275162	CE	On-Demand	Anodyne	FPR1	51	42
C[C@@H](CNC[C@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275164	CE	On-Demand	Anodyne	ADRB1	31	43
C[C@@H](CNC[C@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275164	CE	On-Demand	Anodyne	ADRB3	54	43
C[C@@H](CNC[C@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275164	CE	On-Demand	Anodyne	PAPA1_CARPA	39	44
C[C@@H](CNC[C@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275164	CE	On-Demand	Anodyne	CTSK	27	56
C[C@@H](CNC[C@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275164	CE	On-Demand	Anodyne	REN	36	40
C[C@@H](CNC[C@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275164	CE	On-Demand	Anodyne	FPR1	51	42
C[C@H](CNC[C@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275166	CE	On-Demand	Anodyne	ADRB1	31	43
C[C@H](CNC[C@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275166	CE	On-Demand	Anodyne	ADRB3	54	43
C[C@H](CNC[C@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275166	CE	On-Demand	Anodyne	PAPA1_CARPA	39	44
C[C@H](CNC[C@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275166	CE	On-Demand	Anodyne	CTSK	27	56
C[C@H](CNC[C@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275166	CE	On-Demand	Anodyne	REN	36	40
C[C@H](CNC[C@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275166	CE	On-Demand	Anodyne	FPR1	51	42
C[C@H](CNC[C@@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275168	CE	On-Demand	Anodyne	ADRB1	31	43
C[C@H](CNC[C@@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275168	CE	On-Demand	Anodyne	ADRB3	54	43
C[C@H](CNC[C@@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275168	CE	On-Demand	Anodyne	PAPA1_CARPA	39	44
C[C@H](CNC[C@@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275168	CE	On-Demand	Anodyne	CTSK	27	56
C[C@H](CNC[C@@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275168	CE	On-Demand	Anodyne	REN	36	40
C[C@H](CNC[C@@H](O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275168	CE	On-Demand	Anodyne	FPR1	51	42
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275174	EG	On-Demand	Anodyne	ADRB1	51	45
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275174	EG	On-Demand	Anodyne	DRD2	17	45
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275174	EG	On-Demand	Anodyne	DRD4	46	47
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275174	EG	On-Demand	Anodyne	ACHE	46	40
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275174	EG	On-Demand	Anodyne	DRD3	15	47
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275174	EG	On-Demand	Anodyne	SLC6A3	28	51
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275174	EG	On-Demand	Anodyne	HTR4	19	41
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275174	EG	On-Demand	Anodyne	ADRB3	62	45
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275174	EG	On-Demand	Anodyne	SIGMAR1	48	47
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275174	EG	On-Demand	Anodyne	CCR5	16	42
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275176	EG	On-Demand	Anodyne	ADRB1	51	45
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275176	EG	On-Demand	Anodyne	DRD2	17	45
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275176	EG	On-Demand	Anodyne	DRD4	46	47
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275176	EG	On-Demand	Anodyne	ACHE	46	40
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275176	EG	On-Demand	Anodyne	DRD3	15	47
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275176	EG	On-Demand	Anodyne	SLC6A3	28	51
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275176	EG	On-Demand	Anodyne	HTR4	19	41
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275176	EG	On-Demand	Anodyne	ADRB3	62	45
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275176	EG	On-Demand	Anodyne	SIGMAR1	48	47
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275176	EG	On-Demand	Anodyne	CCR5	16	42
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275178	EG	On-Demand	Anodyne	ADRB1	51	45
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275178	EG	On-Demand	Anodyne	DRD2	17	45
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275178	EG	On-Demand	Anodyne	DRD4	46	47
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275178	EG	On-Demand	Anodyne	ACHE	46	40
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275178	EG	On-Demand	Anodyne	DRD3	15	47
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275178	EG	On-Demand	Anodyne	SLC6A3	28	51
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275178	EG	On-Demand	Anodyne	HTR4	19	41
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275178	EG	On-Demand	Anodyne	ADRB3	62	45
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275178	EG	On-Demand	Anodyne	SIGMAR1	48	47
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275178	EG	On-Demand	Anodyne	CCR5	16	42
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275181	EG	On-Demand	Anodyne	ADRB1	51	45
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275181	EG	On-Demand	Anodyne	DRD2	17	45
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275181	EG	On-Demand	Anodyne	DRD4	46	47
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275181	EG	On-Demand	Anodyne	ACHE	46	40
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275181	EG	On-Demand	Anodyne	DRD3	15	47
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275181	EG	On-Demand	Anodyne	SLC6A3	28	51
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275181	EG	On-Demand	Anodyne	HTR4	19	41
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275181	EG	On-Demand	Anodyne	ADRB3	62	45
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275181	EG	On-Demand	Anodyne	SIGMAR1	48	47
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc(Cl)c1	ZINC000819275181	EG	On-Demand	Anodyne	CCR5	16	42
C[C@@H](CNC[C@@H](O)COc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275182	EE	On-Demand	Anodyne	ADRB2	50	45
C[C@@H](CNC[C@@H](O)COc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275182	EE	On-Demand	Anodyne	ADRB1	70	44
C[C@@H](CNC[C@@H](O)COc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275182	EE	On-Demand	Anodyne	ADRB3	38	40
C[C@@H](CNC[C@@H](O)COc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275182	EE	On-Demand	Anodyne	PAPA1_CARPA	28	40
C[C@@H](CNC[C@H](O)COc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275184	EE	On-Demand	Anodyne	ADRB2	50	45
C[C@@H](CNC[C@H](O)COc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275184	EE	On-Demand	Anodyne	ADRB1	70	44
C[C@@H](CNC[C@H](O)COc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275184	EE	On-Demand	Anodyne	ADRB3	38	40
C[C@@H](CNC[C@H](O)COc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275184	EE	On-Demand	Anodyne	PAPA1_CARPA	28	40
C[C@H](CNC[C@H](O)COc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275185	EE	On-Demand	Anodyne	ADRB2	50	45
C[C@H](CNC[C@H](O)COc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275185	EE	On-Demand	Anodyne	ADRB1	70	44
C[C@H](CNC[C@H](O)COc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275185	EE	On-Demand	Anodyne	ADRB3	38	40
C[C@H](CNC[C@H](O)COc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275185	EE	On-Demand	Anodyne	PAPA1_CARPA	28	40
C[C@H](CNC[C@@H](O)COc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275187	EE	On-Demand	Anodyne	ADRB2	50	45
C[C@H](CNC[C@@H](O)COc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275187	EE	On-Demand	Anodyne	ADRB1	70	44
C[C@H](CNC[C@@H](O)COc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275187	EE	On-Demand	Anodyne	ADRB3	38	40
C[C@H](CNC[C@@H](O)COc1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275187	EE	On-Demand	Anodyne	PAPA1_CARPA	28	40
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819275199	FI	On-Demand	Anodyne	ADRB2	19	42
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819275199	FI	On-Demand	Anodyne	ADRB3	31	47
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819275201	FI	On-Demand	Anodyne	ADRB2	19	42
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819275201	FI	On-Demand	Anodyne	ADRB3	31	47
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819275203	FI	On-Demand	Anodyne	ADRB2	19	42
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819275203	FI	On-Demand	Anodyne	ADRB3	31	47
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819275205	FI	On-Demand	Anodyne	ADRB2	19	42
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819275205	FI	On-Demand	Anodyne	ADRB3	31	47
C[C@@H](CNC[C@H](O)COc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275216	DD	On-Demand	Anodyne	ADRB2	61	60
C[C@@H](CNC[C@H](O)COc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275216	DD	On-Demand	Anodyne	ADRB1	83	48
C[C@@H](CNC[C@H](O)COc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275216	DD	On-Demand	Anodyne	ADRB3	47	48
C[C@@H](CNC[C@H](O)COc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275216	DD	On-Demand	Anodyne	PAPA1_CARPA	35	43
C[C@@H](CNC[C@H](O)COc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275216	DD	On-Demand	Anodyne	CTSK	18	45
C[C@@H](CNC[C@H](O)COc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275216	DD	On-Demand	Anodyne	ABCB1	24	45
C[C@@H](CNC[C@H](O)COc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275216	DD	On-Demand	Anodyne	FPR1	47	39
C[C@@H](CNC[C@H](O)COc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275216	DD	On-Demand	Anodyne	PDS	57	37
C[C@@H](CNC[C@@H](O)COc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275217	DD	On-Demand	Anodyne	ADRB2	61	60
C[C@@H](CNC[C@@H](O)COc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275217	DD	On-Demand	Anodyne	ADRB1	83	48
C[C@@H](CNC[C@@H](O)COc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275217	DD	On-Demand	Anodyne	ADRB3	47	48
C[C@@H](CNC[C@@H](O)COc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275217	DD	On-Demand	Anodyne	PAPA1_CARPA	35	43
C[C@@H](CNC[C@@H](O)COc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275217	DD	On-Demand	Anodyne	CTSK	18	45
C[C@@H](CNC[C@@H](O)COc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275217	DD	On-Demand	Anodyne	ABCB1	24	45
C[C@@H](CNC[C@@H](O)COc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275217	DD	On-Demand	Anodyne	FPR1	47	39
C[C@@H](CNC[C@@H](O)COc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275217	DD	On-Demand	Anodyne	PDS	57	37
CN1CCC(N2CC[C@@H](NC(=O)C(F)=C3CCC3)C2)CC1	ZINC000819275221	CD	On-Demand	Anodyne	SLC6A5	20	44
CN1CCC(N2CC[C@H](NC(=O)C(F)=C3CCC3)C2)CC1	ZINC000819275223	CD	On-Demand	Anodyne	SLC6A5	20	44
C[C@H](CNC[C@@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819275241	DE	On-Demand	Anodyne	ADRB1	26	43
C[C@H](CNC[C@@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819275241	DE	On-Demand	Anodyne	ADRB3	38	43
C[C@H](CNC[C@@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819275241	DE	On-Demand	Anodyne	PAPA1_CARPA	30	44
C[C@H](CNC[C@@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819275241	DE	On-Demand	Anodyne	CTSK	15	43
C[C@@H](CNC[C@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819275242	DE	On-Demand	Anodyne	ADRB1	26	43
C[C@@H](CNC[C@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819275242	DE	On-Demand	Anodyne	ADRB3	38	43
C[C@@H](CNC[C@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819275242	DE	On-Demand	Anodyne	PAPA1_CARPA	30	44
C[C@@H](CNC[C@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819275242	DE	On-Demand	Anodyne	CTSK	15	43
C[C@H](CNC[C@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819275243	DE	On-Demand	Anodyne	ADRB1	26	43
C[C@H](CNC[C@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819275243	DE	On-Demand	Anodyne	ADRB3	38	43
C[C@H](CNC[C@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819275243	DE	On-Demand	Anodyne	PAPA1_CARPA	30	44
C[C@H](CNC[C@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819275243	DE	On-Demand	Anodyne	CTSK	15	43
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819275244	DE	On-Demand	Anodyne	ADRB1	26	43
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819275244	DE	On-Demand	Anodyne	ADRB3	38	43
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819275244	DE	On-Demand	Anodyne	PAPA1_CARPA	30	44
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819275244	DE	On-Demand	Anodyne	CTSK	15	43
O=C(/C=C/[C@@H]1CCCO1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F	ZINC000819275271	FG	On-Demand	Bother	COLA	100	37
O=C(/C=C\[C@H]1CCCO1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F	ZINC000819275272	FG	On-Demand	Bother	COLA	100	37
O=C(/C=C/[C@H]1CCCO1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F	ZINC000819275273	FG	On-Demand	Bother	COLA	100	37
O=C(/C=C\[C@@H]1CCCO1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F	ZINC000819275274	FG	On-Demand	Bother	COLA	100	37
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cc(C)cc(C)c1	ZINC000819275309	EH	On-Demand	Anodyne	ADRB2	23	49
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cc(C)cc(C)c1	ZINC000819275309	EH	On-Demand	Anodyne	ADRB3	27	47
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1cc(C)cc(C)c1	ZINC000819275310	EH	On-Demand	Anodyne	ADRB2	23	49
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1cc(C)cc(C)c1	ZINC000819275310	EH	On-Demand	Anodyne	ADRB3	27	47
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1cc(C)cc(C)c1	ZINC000819275311	EH	On-Demand	Anodyne	ADRB2	23	49
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1cc(C)cc(C)c1	ZINC000819275311	EH	On-Demand	Anodyne	ADRB3	27	47
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1cc(C)cc(C)c1	ZINC000819275312	EH	On-Demand	Anodyne	ADRB2	23	49
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1cc(C)cc(C)c1	ZINC000819275312	EH	On-Demand	Anodyne	ADRB3	27	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1cccc(F)c1F	ZINC000819275322	EF	On-Demand	Anodyne	NQO2	21	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1cccc(F)c1F	ZINC000819275322	EF	On-Demand	Anodyne	PAPA1_CARPA	26	40
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc2ccccc12	ZINC000819275357	FH	On-Demand	Anodyne	DRD2	15	46
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc2ccccc12	ZINC000819275357	FH	On-Demand	Anodyne	DRD4	45	52
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc2ccccc12	ZINC000819275357	FH	On-Demand	Anodyne	ACHE	49	43
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc2ccccc12	ZINC000819275357	FH	On-Demand	Anodyne	SLC6A3	17	48
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc2ccccc12	ZINC000819275357	FH	On-Demand	Anodyne	HTR4	33	45
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc2ccccc12	ZINC000819275357	FH	On-Demand	Anodyne	SIGMAR1	53	50
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccc2ccccc12	ZINC000819275357	FH	On-Demand	Anodyne	BCHE	15	41
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc2ccccc12	ZINC000819275358	FH	On-Demand	Anodyne	DRD2	15	46
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc2ccccc12	ZINC000819275358	FH	On-Demand	Anodyne	DRD4	45	52
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc2ccccc12	ZINC000819275358	FH	On-Demand	Anodyne	ACHE	49	43
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc2ccccc12	ZINC000819275358	FH	On-Demand	Anodyne	SLC6A3	17	48
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc2ccccc12	ZINC000819275358	FH	On-Demand	Anodyne	HTR4	33	45
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc2ccccc12	ZINC000819275358	FH	On-Demand	Anodyne	SIGMAR1	53	50
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccc2ccccc12	ZINC000819275358	FH	On-Demand	Anodyne	BCHE	15	41
C[C@H](CNCCS(=O)(=O)c1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275371	FE	On-Demand	Anodyne	PAPA1_CARPA	28	40
C[C@H](CNCCS(=O)(=O)c1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275371	FE	On-Demand	Anodyne	CTSK	17	40
C[C@@H](CNCCS(=O)(=O)c1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275372	FE	On-Demand	Anodyne	PAPA1_CARPA	28	40
C[C@@H](CNCCS(=O)(=O)c1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275372	FE	On-Demand	Anodyne	CTSK	17	40
C[C@H](CNC[C@@H](O)c1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819275374	DE	On-Demand	Anodyne	PAPA1_CARPA	34	46
C[C@H](CNC[C@@H](O)c1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819275374	DE	On-Demand	Anodyne	CTSK	17	43
C[C@H](CNC[C@@H](O)c1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819275374	DE	On-Demand	Anodyne	FPR1	47	38
C[C@@H](CNC[C@H](O)c1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819275375	DE	On-Demand	Anodyne	PAPA1_CARPA	34	46
C[C@@H](CNC[C@H](O)c1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819275375	DE	On-Demand	Anodyne	CTSK	17	43
C[C@@H](CNC[C@H](O)c1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819275375	DE	On-Demand	Anodyne	FPR1	47	38
C[C@H](CNC[C@H](O)c1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819275376	DE	On-Demand	Anodyne	PAPA1_CARPA	34	46
C[C@H](CNC[C@H](O)c1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819275376	DE	On-Demand	Anodyne	CTSK	17	43
C[C@H](CNC[C@H](O)c1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819275376	DE	On-Demand	Anodyne	FPR1	47	38
C[C@@H](CNC[C@@H](O)c1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819275377	DE	On-Demand	Anodyne	PAPA1_CARPA	34	46
C[C@@H](CNC[C@@H](O)c1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819275377	DE	On-Demand	Anodyne	CTSK	17	43
C[C@@H](CNC[C@@H](O)c1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819275377	DE	On-Demand	Anodyne	FPR1	47	38
C[C@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275408	FG	On-Demand	Anodyne	ADRB2	19	44
C[C@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275408	FG	On-Demand	Anodyne	CASR	41	36
C[C@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275408	FG	On-Demand	Anodyne	CTSD	17	44
C[C@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275408	FG	On-Demand	Anodyne	FCER2	29	42
C[C@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275408	FG	On-Demand	Anodyne	PAPA1_CARPA	32	56
C[C@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275408	FG	On-Demand	Anodyne	CTSL	15	56
C[C@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275408	FG	On-Demand	Anodyne	ECE1	23	44
C[C@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275408	FG	On-Demand	Anodyne	REN	38	45
C[C@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275408	FG	On-Demand	Anodyne	ACE2	25	43
C[C@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275408	FG	On-Demand	Anodyne	FPR1	49	40
C[C@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275409	FG	On-Demand	Anodyne	ADRB2	19	44
C[C@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275409	FG	On-Demand	Anodyne	CASR	41	36
C[C@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275409	FG	On-Demand	Anodyne	CTSD	17	44
C[C@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275409	FG	On-Demand	Anodyne	FCER2	29	42
C[C@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275409	FG	On-Demand	Anodyne	PAPA1_CARPA	32	56
C[C@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275409	FG	On-Demand	Anodyne	CTSL	15	56
C[C@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275409	FG	On-Demand	Anodyne	ECE1	23	44
C[C@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275409	FG	On-Demand	Anodyne	REN	38	45
C[C@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275409	FG	On-Demand	Anodyne	ACE2	25	43
C[C@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275409	FG	On-Demand	Anodyne	FPR1	49	40
C[C@@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275410	FG	On-Demand	Anodyne	ADRB2	19	44
C[C@@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275410	FG	On-Demand	Anodyne	CASR	41	36
C[C@@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275410	FG	On-Demand	Anodyne	CTSD	17	44
C[C@@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275410	FG	On-Demand	Anodyne	FCER2	29	42
C[C@@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275410	FG	On-Demand	Anodyne	PAPA1_CARPA	32	56
C[C@@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275410	FG	On-Demand	Anodyne	CTSL	15	56
C[C@@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275410	FG	On-Demand	Anodyne	ECE1	23	44
C[C@@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275410	FG	On-Demand	Anodyne	REN	38	45
C[C@@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275410	FG	On-Demand	Anodyne	ACE2	25	43
C[C@@H](CNC[C@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275410	FG	On-Demand	Anodyne	FPR1	49	40
C[C@@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275411	FG	On-Demand	Anodyne	ADRB2	19	44
C[C@@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275411	FG	On-Demand	Anodyne	CASR	41	36
C[C@@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275411	FG	On-Demand	Anodyne	CTSD	17	44
C[C@@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275411	FG	On-Demand	Anodyne	FCER2	29	42
C[C@@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275411	FG	On-Demand	Anodyne	PAPA1_CARPA	32	56
C[C@@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275411	FG	On-Demand	Anodyne	CTSL	15	56
C[C@@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275411	FG	On-Demand	Anodyne	ECE1	23	44
C[C@@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275411	FG	On-Demand	Anodyne	REN	38	45
C[C@@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275411	FG	On-Demand	Anodyne	ACE2	25	43
C[C@@H](CNC[C@@H](O)Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275411	FG	On-Demand	Anodyne	FPR1	49	40
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819275413	EG	On-Demand	Anodyne	DRD2	16	44
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819275413	EG	On-Demand	Anodyne	DRD4	40	45
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819275413	EG	On-Demand	Anodyne	ACHE	46	44
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819275413	EG	On-Demand	Anodyne	SLC6A3	25	53
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819275413	EG	On-Demand	Anodyne	HTR4	15	41
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819275413	EG	On-Demand	Anodyne	SIGMAR1	47	50
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CCN(Cc2ccccc2)C1	ZINC000819275413	EG	On-Demand	Anodyne	CCR3	59	42
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819275414	EG	On-Demand	Anodyne	DRD2	16	44
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819275414	EG	On-Demand	Anodyne	DRD4	40	45
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819275414	EG	On-Demand	Anodyne	ACHE	46	44
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819275414	EG	On-Demand	Anodyne	SLC6A3	25	53
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819275414	EG	On-Demand	Anodyne	HTR4	15	41
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819275414	EG	On-Demand	Anodyne	SIGMAR1	47	50
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819275414	EG	On-Demand	Anodyne	CCR3	59	42
C[C@H](CNCCC(=O)Nc1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819275416	EF	On-Demand	Anodyne	PAPA1_CARPA	28	42
C[C@@H](CNCCC(=O)Nc1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819275417	EF	On-Demand	Anodyne	PAPA1_CARPA	28	42
COC[C@@H](O)CNC[C@H](C)NC(=O)OC(C)(C)C	ZINC000819275423	CC	On-Demand	Anodyne	CTSK	16	48
COC[C@@H](O)CNC[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819275425	CC	On-Demand	Anodyne	CTSK	16	48
C[C@H](CNCCC(=O)Nc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819275444	EF	On-Demand	Anodyne	PAPA1_CARPA	29	41
C[C@H](CNCCC(=O)Nc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819275444	EF	On-Demand	Anodyne	FPR1	41	34
C[C@@H](CNCCC(=O)Nc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819275445	EF	On-Demand	Anodyne	PAPA1_CARPA	29	41
C[C@@H](CNCCC(=O)Nc1ccccc1F)NC(=O)OC(C)(C)C	ZINC000819275445	EF	On-Demand	Anodyne	FPR1	41	34
C[C@H](CNC[C@@H](O)CN1CCc2ccccc2C1)NC(=O)OC(C)(C)C	ZINC000819275495	FD	On-Demand	Anodyne	NOD2	41	35
C[C@@H](CNC[C@@H](O)CN1CCc2ccccc2C1)NC(=O)OC(C)(C)C	ZINC000819275496	FD	On-Demand	Anodyne	NOD2	41	35
C[C@H](CNC[C@H](O)CN1CCc2ccccc2C1)NC(=O)OC(C)(C)C	ZINC000819275497	FD	On-Demand	Anodyne	NOD2	41	35
C[C@@H](CNC[C@H](O)CN1CCc2ccccc2C1)NC(=O)OC(C)(C)C	ZINC000819275498	FD	On-Demand	Anodyne	NOD2	41	35
C[C@@H](CNC[C@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819275499	DE	On-Demand	Anodyne	CTSD	16	45
C[C@@H](CNC[C@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819275499	DE	On-Demand	Anodyne	CTSK	20	59
C[C@@H](CNC[C@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819275499	DE	On-Demand	Anodyne	ECE1	24	45
C[C@@H](CNC[C@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819275499	DE	On-Demand	Anodyne	REN	49	47
C[C@@H](CNC[C@@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819275500	DE	On-Demand	Anodyne	CTSD	16	45
C[C@@H](CNC[C@@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819275500	DE	On-Demand	Anodyne	CTSK	20	59
C[C@@H](CNC[C@@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819275500	DE	On-Demand	Anodyne	ECE1	24	45
C[C@@H](CNC[C@@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819275500	DE	On-Demand	Anodyne	REN	49	47
C[C@H](CNC[C@@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819275501	DE	On-Demand	Anodyne	CTSD	16	45
C[C@H](CNC[C@@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819275501	DE	On-Demand	Anodyne	CTSK	20	59
C[C@H](CNC[C@@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819275501	DE	On-Demand	Anodyne	ECE1	24	45
C[C@H](CNC[C@@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819275501	DE	On-Demand	Anodyne	REN	49	47
C[C@H](CNC[C@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819275502	DE	On-Demand	Anodyne	CTSD	16	45
C[C@H](CNC[C@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819275502	DE	On-Demand	Anodyne	CTSK	20	59
C[C@H](CNC[C@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819275502	DE	On-Demand	Anodyne	ECE1	24	45
C[C@H](CNC[C@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819275502	DE	On-Demand	Anodyne	REN	49	47
C[C@H](CNCCC(=O)Nc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275515	DF	On-Demand	Anodyne	LTA4H	24	47
C[C@H](CNCCC(=O)Nc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275515	DF	On-Demand	Anodyne	PAPA1_CARPA	36	43
C[C@H](CNCCC(=O)Nc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275515	DF	On-Demand	Anodyne	CTSK	20	45
C[C@H](CNCCC(=O)Nc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275515	DF	On-Demand	Anodyne	FPR1	48	38
C[C@@H](CNCCC(=O)Nc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275516	DF	On-Demand	Anodyne	LTA4H	24	47
C[C@@H](CNCCC(=O)Nc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275516	DF	On-Demand	Anodyne	PAPA1_CARPA	36	43
C[C@@H](CNCCC(=O)Nc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275516	DF	On-Demand	Anodyne	CTSK	20	45
C[C@@H](CNCCC(=O)Nc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275516	DF	On-Demand	Anodyne	FPR1	48	38
C[C@H](CNC[C@H](O)c1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819275519	EG	On-Demand	Anodyne	PAPA1_CARPA	31	40
C[C@H](CNC[C@H](O)c1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819275519	EG	On-Demand	Anodyne	REN	39	40
C[C@H](CNC[C@H](O)c1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819275519	EG	On-Demand	Anodyne	FPR1	49	38
C[C@@H](CNC[C@H](O)c1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819275520	EG	On-Demand	Anodyne	PAPA1_CARPA	31	40
C[C@@H](CNC[C@H](O)c1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819275520	EG	On-Demand	Anodyne	REN	39	40
C[C@@H](CNC[C@H](O)c1cccc2ccccc12)NC(=O)OC(C)(C)C	ZINC000819275520	EG	On-Demand	Anodyne	FPR1	49	38
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000819275534	FF	On-Demand	Bother	DRD4	27	43
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000819275534	FF	On-Demand	Bother	ACHE	41	52
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000819275534	FF	On-Demand	Bother	SLC6A3	15	46
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000819275534	FF	On-Demand	Bother	SIGMAR1	39	52
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000819275535	FF	On-Demand	Bother	DRD4	27	43
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000819275535	FF	On-Demand	Bother	ACHE	41	52
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000819275535	FF	On-Demand	Bother	SLC6A3	15	46
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000819275535	FF	On-Demand	Bother	SIGMAR1	39	52
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000819275536	FF	On-Demand	Bother	DRD4	27	43
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000819275536	FF	On-Demand	Bother	ACHE	41	52
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000819275536	FF	On-Demand	Bother	SLC6A3	15	46
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000819275536	FF	On-Demand	Bother	SIGMAR1	39	52
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000819275537	FF	On-Demand	Bother	DRD4	27	43
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000819275537	FF	On-Demand	Bother	ACHE	41	52
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000819275537	FF	On-Demand	Bother	SLC6A3	15	46
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000819275537	FF	On-Demand	Bother	SIGMAR1	39	52
C[C@@H](CNC[C@H](O)c1cc(F)ccc1F)NC(=O)OC(C)(C)C	ZINC000819275538	EF	On-Demand	Anodyne	PAPA1_CARPA	30	40
C[C@@H](CNC[C@@H](O)c1cc(F)ccc1F)NC(=O)OC(C)(C)C	ZINC000819275539	EF	On-Demand	Anodyne	PAPA1_CARPA	30	40
C[C@H](CNC[C@@H](O)c1cc(F)ccc1F)NC(=O)OC(C)(C)C	ZINC000819275540	EF	On-Demand	Anodyne	PAPA1_CARPA	30	40
C[C@H](CNC[C@H](O)c1cc(F)ccc1F)NC(=O)OC(C)(C)C	ZINC000819275541	EF	On-Demand	Anodyne	PAPA1_CARPA	30	40
C[C@H](CNC[C@H](O)c1ccc(C#N)cc1)NC(=O)OC(C)(C)C	ZINC000819275543	DE	On-Demand	Mild	CTRB_BOVIN	55	33
C[C@H](CNC[C@@H](O)c1ccc(C#N)cc1)NC(=O)OC(C)(C)C	ZINC000819275544	DE	On-Demand	Mild	CTRB_BOVIN	55	33
C[C@@H](CNC[C@@H](O)c1ccc(C#N)cc1)NC(=O)OC(C)(C)C	ZINC000819275545	DE	On-Demand	Mild	CTRB_BOVIN	55	33
C[C@@H](CNC[C@H](O)c1ccc(C#N)cc1)NC(=O)OC(C)(C)C	ZINC000819275546	DE	On-Demand	Mild	CTRB_BOVIN	55	33
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275547	GH	On-Demand	Anodyne	DRD4	33	52
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275547	GH	On-Demand	Anodyne	ACHE	42	41
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275547	GH	On-Demand	Anodyne	SLC6A3	27	50
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275547	GH	On-Demand	Anodyne	SIGMAR1	45	52
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275547	GH	On-Demand	Anodyne	SLC18A3	25	48
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275548	GH	On-Demand	Anodyne	DRD4	33	52
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275548	GH	On-Demand	Anodyne	ACHE	42	41
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275548	GH	On-Demand	Anodyne	SLC6A3	27	50
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275548	GH	On-Demand	Anodyne	SIGMAR1	45	52
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275548	GH	On-Demand	Anodyne	SLC18A3	25	48
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275549	GH	On-Demand	Anodyne	DRD4	33	52
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275549	GH	On-Demand	Anodyne	ACHE	42	41
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275549	GH	On-Demand	Anodyne	SLC6A3	27	50
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275549	GH	On-Demand	Anodyne	SIGMAR1	45	52
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275549	GH	On-Demand	Anodyne	SLC18A3	25	48
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275550	GH	On-Demand	Anodyne	DRD4	33	52
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275550	GH	On-Demand	Anodyne	ACHE	42	41
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275550	GH	On-Demand	Anodyne	SLC6A3	27	50
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275550	GH	On-Demand	Anodyne	SIGMAR1	45	52
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(Br)cc1	ZINC000819275550	GH	On-Demand	Anodyne	SLC18A3	25	48
COc1ccc(OC)c([C@H](O)CNCCc2cccc(C)n2)c1	ZINC000819275554	DE	On-Demand	Anodyne	ADRB2	24	47
COc1ccc(OC)c([C@H](O)CNCCc2cccc(C)n2)c1	ZINC000819275554	DE	On-Demand	Anodyne	ADRB1	29	40
COc1ccc(OC)c([C@H](O)CNCCc2cccc(C)n2)c1	ZINC000819275554	DE	On-Demand	Anodyne	ADRB3	24	40
COc1ccc(OC)c([C@H](O)CNCCc2cccc(C)n2)c1	ZINC000819275554	DE	On-Demand	Anodyne	MTNR1A	27	44
C[C@H](CNC[C@@H](O)c1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275568	DE	On-Demand	Anodyne	PAPA1_CARPA	32	43
C[C@H](CNC[C@@H](O)c1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275568	DE	On-Demand	Anodyne	CTSK	17	41
C[C@@H](CNC[C@H](O)c1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275569	DE	On-Demand	Anodyne	PAPA1_CARPA	32	43
C[C@@H](CNC[C@H](O)c1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275569	DE	On-Demand	Anodyne	CTSK	17	41
C[C@H](CNC[C@H](O)c1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275570	DE	On-Demand	Anodyne	PAPA1_CARPA	32	43
C[C@H](CNC[C@H](O)c1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275570	DE	On-Demand	Anodyne	CTSK	17	41
C[C@@H](CNC[C@@H](O)c1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275571	DE	On-Demand	Anodyne	PAPA1_CARPA	32	43
C[C@@H](CNC[C@@H](O)c1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819275571	DE	On-Demand	Anodyne	CTSK	17	41
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275576	DE	On-Demand	Anodyne	ADRB2	25	43
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275576	DE	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275576	DE	On-Demand	Anodyne	DRD4	27	48
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275576	DE	On-Demand	Anodyne	ACHE	40	48
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275576	DE	On-Demand	Anodyne	SLC6A3	22	50
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275576	DE	On-Demand	Anodyne	ADRB3	92	46
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275576	DE	On-Demand	Anodyne	SIGMAR1	40	49
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275577	DE	On-Demand	Anodyne	ADRB2	25	43
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275577	DE	On-Demand	Anodyne	ADRB1	27	40
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275577	DE	On-Demand	Anodyne	DRD4	27	48
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275577	DE	On-Demand	Anodyne	ACHE	40	48
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275577	DE	On-Demand	Anodyne	SLC6A3	22	50
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275577	DE	On-Demand	Anodyne	ADRB3	92	46
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275577	DE	On-Demand	Anodyne	SIGMAR1	40	49
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275578	DE	On-Demand	Anodyne	ADRB2	25	43
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275578	DE	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275578	DE	On-Demand	Anodyne	DRD4	27	48
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275578	DE	On-Demand	Anodyne	ACHE	40	48
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275578	DE	On-Demand	Anodyne	SLC6A3	22	50
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275578	DE	On-Demand	Anodyne	ADRB3	92	46
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275578	DE	On-Demand	Anodyne	SIGMAR1	40	49
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275579	DE	On-Demand	Anodyne	ADRB2	25	43
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275579	DE	On-Demand	Anodyne	ADRB1	27	40
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275579	DE	On-Demand	Anodyne	DRD4	27	48
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275579	DE	On-Demand	Anodyne	ACHE	40	48
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275579	DE	On-Demand	Anodyne	SLC6A3	22	50
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275579	DE	On-Demand	Anodyne	ADRB3	92	46
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819275579	DE	On-Demand	Anodyne	SIGMAR1	40	49
C[C@@H](CNC[C@H](O)Cc1ccccc1C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819275580	GG	On-Demand	Anodyne	PAPA1_CARPA	34	41
C[C@@H](CNC[C@H](O)Cc1ccccc1C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819275580	GG	On-Demand	Anodyne	SCN10A	17	44
C[C@@H](CNC[C@H](O)Cc1ccccc1C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819275580	GG	On-Demand	Anodyne	FPR1	51	40
C[C@@H](CNC[C@@H](O)Cc1ccccc1C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819275581	GG	On-Demand	Anodyne	PAPA1_CARPA	34	41
C[C@@H](CNC[C@@H](O)Cc1ccccc1C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819275581	GG	On-Demand	Anodyne	SCN10A	17	44
C[C@@H](CNC[C@@H](O)Cc1ccccc1C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819275581	GG	On-Demand	Anodyne	FPR1	51	40
C[C@H](CNC[C@@H](O)Cc1ccccc1C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819275582	GG	On-Demand	Anodyne	PAPA1_CARPA	34	41
C[C@H](CNC[C@@H](O)Cc1ccccc1C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819275582	GG	On-Demand	Anodyne	SCN10A	17	44
C[C@H](CNC[C@@H](O)Cc1ccccc1C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819275582	GG	On-Demand	Anodyne	FPR1	51	40
C[C@H](CNC[C@H](O)Cc1ccccc1C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819275583	GG	On-Demand	Anodyne	PAPA1_CARPA	34	41
C[C@H](CNC[C@H](O)Cc1ccccc1C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819275583	GG	On-Demand	Anodyne	SCN10A	17	44
C[C@H](CNC[C@H](O)Cc1ccccc1C(F)(F)F)NC(=O)OC(C)(C)C	ZINC000819275583	GG	On-Demand	Anodyne	FPR1	51	40
CCOC[C@H](O)CNC[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819275586	CC	On-Demand	Anodyne	CTSK	17	56
CCOC[C@H](O)CNC[C@H](C)NC(=O)OC(C)(C)C	ZINC000819275589	CC	On-Demand	Anodyne	CTSK	17	56
O[C@@H](CNCCCCn1cc(Br)cn1)c1ccccc1	ZINC000819275590	EF	On-Demand	Anodyne	ADRB2	17	40
O[C@@H](CNCCCCn1cc(Br)cn1)c1ccccc1	ZINC000819275590	EF	On-Demand	Anodyne	ADRB3	48	37
O[C@H](CNCCCCn1cc(Br)cn1)c1ccccc1	ZINC000819275591	EF	On-Demand	Anodyne	ADRB2	17	40
O[C@H](CNCCCCn1cc(Br)cn1)c1ccccc1	ZINC000819275591	EF	On-Demand	Anodyne	ADRB3	48	37
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	ADRB2	15	40
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	ADRB1	17	40
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	CTSD	22	42
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	PGC	53	41
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	CMA1	30	40
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	KLK3	41	31
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	PAPA1_CARPA	59	48
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	CCKAR	47	37
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	CTSG	22	40
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	CTSK	44	61
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	CTSL	32	48
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	PGA	47	41
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	CTRB1	33	40
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	TACR3	17	44
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	CAPNS1	46	32
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	MMP3	30	40
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	CELA2A	21	40
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	REN	68	44
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	REN1	21	42
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	CCKBR	16	41
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	CTSS	17	48
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	CAPN1	55	44
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	CAPN2	60	33
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	FPR1	64	45
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	CTRB_BOVIN	31	40
C[C@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275592	DE	On-Demand	Anodyne	NPR	48	31
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	ADRB2	15	40
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	ADRB1	17	40
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	CTSD	22	42
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	PGC	53	41
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	CMA1	30	40
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	KLK3	41	31
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	PAPA1_CARPA	59	48
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	CCKAR	47	37
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	CTSG	22	40
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	CTSK	44	61
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	CTSL	32	48
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	PGA	47	41
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	CTRB1	33	40
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	TACR3	17	44
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	CAPNS1	46	32
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	MMP3	30	40
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	CELA2A	21	40
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	REN	68	44
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	REN1	21	42
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	CCKBR	16	41
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	CTSS	17	48
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	CAPN1	55	44
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	CAPN2	60	33
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	FPR1	64	45
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	CTRB_BOVIN	31	40
C[C@@H](CNC[C@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275593	DE	On-Demand	Anodyne	NPR	48	31
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	ADRB2	15	40
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	ADRB1	17	40
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	CTSD	22	42
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	PGC	53	41
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	CMA1	30	40
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	KLK3	41	31
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	PAPA1_CARPA	59	48
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	CCKAR	47	37
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	CTSG	22	40
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	CTSK	44	61
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	CTSL	32	48
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	PGA	47	41
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	CTRB1	33	40
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	TACR3	17	44
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	CAPNS1	46	32
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	MMP3	30	40
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	CELA2A	21	40
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	REN	68	44
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	REN1	21	42
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	CCKBR	16	41
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	CTSS	17	48
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	CAPN1	55	44
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	CAPN2	60	33
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	FPR1	64	45
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	CTRB_BOVIN	31	40
C[C@@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275594	DE	On-Demand	Anodyne	NPR	48	31
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	ADRB2	15	40
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	ADRB1	17	40
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	CTSD	22	42
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	PGC	53	41
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	CMA1	30	40
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	KLK3	41	31
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	PAPA1_CARPA	59	48
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	CCKAR	47	37
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	CTSG	22	40
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	CTSK	44	61
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	CTSL	32	48
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	PGA	47	41
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	CTRB1	33	40
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	TACR3	17	44
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	CAPNS1	46	32
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	MMP3	30	40
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	CELA2A	21	40
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	REN	68	44
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	REN1	21	42
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	CCKBR	16	41
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	CTSS	17	48
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	CAPN1	55	44
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	CAPN2	60	33
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	FPR1	64	45
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	CTRB_BOVIN	31	40
C[C@H](CNC[C@@H](O)CCc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819275595	DE	On-Demand	Anodyne	NPR	48	31
C[C@@H](CNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)NC(=O)OC(C)(C)C	ZINC000819275610	GD	On-Demand	Anodyne	ADRB1	20	40
C[C@H](CNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)NC(=O)OC(C)(C)C	ZINC000819275611	GD	On-Demand	Anodyne	ADRB1	20	40
C[C@H](CNC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2)NC(=O)OC(C)(C)C	ZINC000819275612	GD	On-Demand	Anodyne	ADRB1	20	40
C[C@@H](CNC[C@H](O)COc1ccc2c(c1)CCC(=O)N2)NC(=O)OC(C)(C)C	ZINC000819275613	GD	On-Demand	Anodyne	ADRB1	20	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1ccc(F)cc1F	ZINC000819275619	EF	On-Demand	Anodyne	NQO2	15	41
O[C@@H](CNCCCCn1cc(Br)cn1)c1cccnc1	ZINC000819275636	EE	On-Demand	Anodyne	ADRB2	24	45
O[C@@H](CNCCCCn1cc(Br)cn1)c1cccnc1	ZINC000819275636	EE	On-Demand	Anodyne	ADRB1	26	43
O[C@@H](CNCCCCn1cc(Br)cn1)c1cccnc1	ZINC000819275636	EE	On-Demand	Anodyne	ADRB3	98	47
O[C@H](CNCCCCn1cc(Br)cn1)c1cccnc1	ZINC000819275637	EE	On-Demand	Anodyne	ADRB2	24	45
O[C@H](CNCCCCn1cc(Br)cn1)c1cccnc1	ZINC000819275637	EE	On-Demand	Anodyne	ADRB1	26	43
O[C@H](CNCCCCn1cc(Br)cn1)c1cccnc1	ZINC000819275637	EE	On-Demand	Anodyne	ADRB3	98	47
CS(=O)(=O)N1CCN(c2ccc(NC(=O)/C=C/[C@H]3CCCO3)cn2)CC1	ZINC000819275638	GC	On-Demand	Anodyne	TGM2	29	40
CS(=O)(=O)N1CCN(c2ccc(NC(=O)/C=C/[C@H]3CCCO3)cn2)CC1	ZINC000819275638	GC	On-Demand	Anodyne	F13A1	31	40
CS(=O)(=O)N1CCN(c2ccc(NC(=O)/C=C/[C@H]3CCCO3)cn2)CC1	ZINC000819275638	GC	On-Demand	Anodyne	DGAT1	36	45
CS(=O)(=O)N1CCN(c2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cn2)CC1	ZINC000819275639	GC	On-Demand	Anodyne	TGM2	29	40
CS(=O)(=O)N1CCN(c2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cn2)CC1	ZINC000819275639	GC	On-Demand	Anodyne	F13A1	31	40
CS(=O)(=O)N1CCN(c2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cn2)CC1	ZINC000819275639	GC	On-Demand	Anodyne	DGAT1	36	45
CS(=O)(=O)N1CCN(c2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cn2)CC1	ZINC000819275640	GC	On-Demand	Anodyne	TGM2	29	40
CS(=O)(=O)N1CCN(c2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cn2)CC1	ZINC000819275640	GC	On-Demand	Anodyne	F13A1	31	40
CS(=O)(=O)N1CCN(c2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cn2)CC1	ZINC000819275640	GC	On-Demand	Anodyne	DGAT1	36	45
CS(=O)(=O)N1CCN(c2ccc(NC(=O)/C=C\[C@H]3CCCO3)cn2)CC1	ZINC000819275641	GC	On-Demand	Anodyne	TGM2	29	40
CS(=O)(=O)N1CCN(c2ccc(NC(=O)/C=C\[C@H]3CCCO3)cn2)CC1	ZINC000819275641	GC	On-Demand	Anodyne	F13A1	31	40
CS(=O)(=O)N1CCN(c2ccc(NC(=O)/C=C\[C@H]3CCCO3)cn2)CC1	ZINC000819275641	GC	On-Demand	Anodyne	DGAT1	36	45
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C	ZINC000819275650	EE	On-Demand	Bother	CACNA1D	52	34
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C	ZINC000819275651	EE	On-Demand	Bother	CACNA1D	52	34
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C	ZINC000819275652	EE	On-Demand	Bother	CACNA1D	52	34
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C	ZINC000819275653	EE	On-Demand	Bother	CACNA1D	52	34
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819275664	GH	On-Demand	Anodyne	DRD4	27	46
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819275664	GH	On-Demand	Anodyne	ACHE	42	40
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819275664	GH	On-Demand	Anodyne	SLC6A3	29	50
O[C@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819275664	GH	On-Demand	Anodyne	SIGMAR1	38	52
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819275665	GH	On-Demand	Anodyne	DRD4	27	46
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819275665	GH	On-Demand	Anodyne	ACHE	42	40
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819275665	GH	On-Demand	Anodyne	SLC6A3	29	50
O[C@@H](CNC[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819275665	GH	On-Demand	Anodyne	SIGMAR1	38	52
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819275666	GH	On-Demand	Anodyne	DRD4	27	46
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819275666	GH	On-Demand	Anodyne	ACHE	42	40
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819275666	GH	On-Demand	Anodyne	SLC6A3	29	50
O[C@@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819275666	GH	On-Demand	Anodyne	SIGMAR1	38	52
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819275667	GH	On-Demand	Anodyne	DRD4	27	46
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819275667	GH	On-Demand	Anodyne	ACHE	42	40
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819275667	GH	On-Demand	Anodyne	SLC6A3	29	50
O[C@H](CNC[C@H]1CCN(Cc2ccccc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819275667	GH	On-Demand	Anodyne	SIGMAR1	38	52
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CC[C@H](c3ccc(F)cc3)C2)cc1	ZINC000819275718	GG	On-Demand	Anodyne	PTGS2	20	42
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CC[C@@H](c3ccc(F)cc3)C2)cc1	ZINC000819275719	GG	On-Demand	Anodyne	PTGS2	20	42
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CC[C@H](c3ccc(F)cc3)C2)cc1	ZINC000819275720	GG	On-Demand	Anodyne	PTGS2	20	42
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CC[C@@H](c3ccc(F)cc3)C2)cc1	ZINC000819275721	GG	On-Demand	Anodyne	PTGS2	20	42
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc(F)c1	ZINC000819275726	EG	On-Demand	Anodyne	ADRB3	40	47
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc(F)c1	ZINC000819275727	EG	On-Demand	Anodyne	ADRB3	40	47
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccc(F)c1	ZINC000819275728	EG	On-Demand	Anodyne	ADRB3	40	47
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccc(F)c1	ZINC000819275729	EG	On-Demand	Anodyne	ADRB3	40	47
O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819275730	EF	On-Demand	Anodyne	DRD4	44	34
O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819275730	EF	On-Demand	Anodyne	CHRNA7	20	46
O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819275730	EF	On-Demand	Anodyne	PLD1	48	37
O=C(Nc1ccc(C(=O)NCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819275730	EF	On-Demand	Anodyne	PLD2	68	40
O[C@H](CN[C@@H]1CC[C@@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819275751	CH	On-Demand	Anodyne	SLC6A3	27	59
O[C@H](CN[C@@H]1CC[C@@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819275751	CH	On-Demand	Anodyne	SLC18A3	18	46
O[C@@H](CN[C@H]1CC[C@@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819275752	CH	On-Demand	Anodyne	SLC6A3	27	59
O[C@@H](CN[C@H]1CC[C@@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819275752	CH	On-Demand	Anodyne	SLC18A3	18	46
O[C@H](CN[C@H]1CC[C@@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819275753	CH	On-Demand	Anodyne	SLC6A3	27	59
O[C@H](CN[C@H]1CC[C@@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819275753	CH	On-Demand	Anodyne	SLC18A3	18	46
O[C@@H](CN[C@@H]1CC[C@@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819275754	CH	On-Demand	Anodyne	SLC6A3	27	59
O[C@@H](CN[C@@H]1CC[C@@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819275754	CH	On-Demand	Anodyne	SLC18A3	18	46
O[C@H](CN[C@@H]1CC[C@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819275755	CH	On-Demand	Anodyne	SLC6A3	27	59
O[C@H](CN[C@@H]1CC[C@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819275755	CH	On-Demand	Anodyne	SLC18A3	18	46
O[C@@H](CN[C@@H]1CC[C@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819275756	CH	On-Demand	Anodyne	SLC6A3	27	59
O[C@@H](CN[C@@H]1CC[C@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819275756	CH	On-Demand	Anodyne	SLC18A3	18	46
O[C@@H](CN[C@H]1CC[C@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819275757	CH	On-Demand	Anodyne	SLC6A3	27	59
O[C@@H](CN[C@H]1CC[C@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819275757	CH	On-Demand	Anodyne	SLC18A3	18	46
O[C@H](CN[C@H]1CC[C@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819275758	CH	On-Demand	Anodyne	SLC6A3	27	59
O[C@H](CN[C@H]1CC[C@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819275758	CH	On-Demand	Anodyne	SLC18A3	18	46
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H](N2CCCCC2=O)C1	ZINC000819275759	FD	On-Demand	Anodyne	KCNJ1	57	36
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H](N2CCCCC2=O)C1	ZINC000819275760	FD	On-Demand	Anodyne	KCNJ1	57	36
CN1CCC(N2CC[C@H](NC(=O)/C=C\[C@@H]3CCCO3)C2)CC1	ZINC000819275761	DD	On-Demand	Anodyne	SLC6A5	17	40
CN1CCC(N2CC[C@H](NC(=O)/C=C/[C@@H]3CCCO3)C2)CC1	ZINC000819275762	DD	On-Demand	Anodyne	SLC6A5	17	40
CN1CCC(N2CC[C@H](NC(=O)/C=C/[C@H]3CCCO3)C2)CC1	ZINC000819275763	DD	On-Demand	Anodyne	SLC6A5	17	40
CN1CCC(N2CC[C@H](NC(=O)/C=C\[C@H]3CCCO3)C2)CC1	ZINC000819275764	DD	On-Demand	Anodyne	SLC6A5	17	40
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819275765	EI	On-Demand	Anodyne	ADRB2	22	44
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819275765	EI	On-Demand	Anodyne	ADRB3	35	47
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819275766	EI	On-Demand	Anodyne	ADRB2	22	44
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819275766	EI	On-Demand	Anodyne	ADRB3	35	47
O=C(O)[C@@H]1CCN(C(=O)c2cc3ccsc3[nH]2)C1	ZINC000819275772	CD	On-Demand	Anodyne	GRIN2B	24	42
O=C(O)[C@@H]1CCN(C(=O)c2cc3ccsc3[nH]2)C1	ZINC000819275772	CD	On-Demand	Anodyne	HRH4	29	62
O=C(O)[C@@H]1CCN(C(=O)c2cc3ccsc3[nH]2)C1	ZINC000819275772	CD	On-Demand	Anodyne	AKR1C3	17	40
O=C(O)[C@H]1CCN(C(=O)c2cc3ccsc3[nH]2)C1	ZINC000819275773	CD	On-Demand	Anodyne	GRIN2B	24	42
O=C(O)[C@H]1CCN(C(=O)c2cc3ccsc3[nH]2)C1	ZINC000819275773	CD	On-Demand	Anodyne	HRH4	29	62
O=C(O)[C@H]1CCN(C(=O)c2cc3ccsc3[nH]2)C1	ZINC000819275773	CD	On-Demand	Anodyne	AKR1C3	17	40
O=C(O)[C@@H]1CCN(C(=O)c2ccc(S(=O)(=O)Nc3nccs3)cc2)C1	ZINC000819275774	GD	On-Demand	Anodyne	SFRP1	40	36
O=C(O)[C@@H]1CCN(C(=O)c2ccc(S(=O)(=O)Nc3nccs3)cc2)C1	ZINC000819275774	GD	On-Demand	Anodyne	L3MBTL3	65	39
O=C(O)[C@H]1CCN(C(=O)c2ccc(S(=O)(=O)Nc3nccs3)cc2)C1	ZINC000819275775	GD	On-Demand	Anodyne	SFRP1	40	36
O=C(O)[C@H]1CCN(C(=O)c2ccc(S(=O)(=O)Nc3nccs3)cc2)C1	ZINC000819275775	GD	On-Demand	Anodyne	L3MBTL3	65	39
O=C(O)[C@H]1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)C1	ZINC000819275776	DE	On-Demand	Anodyne	SLC6A1	120	39
O=C(O)[C@H]1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)C1	ZINC000819275776	DE	On-Demand	Anodyne	SLC18A3	21	42
O=C(O)[C@H]1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)C1	ZINC000819275776	DE	On-Demand	Anodyne	RBP4	18	40
O=C(O)[C@H]1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)C1	ZINC000819275776	DE	On-Demand	Anodyne	LIPG	43	31
O=C(O)[C@H]1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)C1	ZINC000819275776	DE	On-Demand	Anodyne	SFRP1	50	38
O=C(O)[C@H]1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)C1	ZINC000819275776	DE	On-Demand	Anodyne	L3MBTL3	59	41
O=C(O)[C@@H]1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)C1	ZINC000819275777	DE	On-Demand	Anodyne	SLC6A1	120	39
O=C(O)[C@@H]1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)C1	ZINC000819275777	DE	On-Demand	Anodyne	SLC18A3	21	42
O=C(O)[C@@H]1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)C1	ZINC000819275777	DE	On-Demand	Anodyne	RBP4	18	40
O=C(O)[C@@H]1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)C1	ZINC000819275777	DE	On-Demand	Anodyne	LIPG	43	31
O=C(O)[C@@H]1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)C1	ZINC000819275777	DE	On-Demand	Anodyne	SFRP1	50	38
O=C(O)[C@@H]1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)C1	ZINC000819275777	DE	On-Demand	Anodyne	L3MBTL3	59	41
O=C(O)[C@@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2O)C1	ZINC000819275778	CC	On-Demand	Bother	L3MBTL3	34	41
O=C(O)[C@H]1CCN(C(=O)c2cccc([N+](=O)[O-])c2O)C1	ZINC000819275779	CC	On-Demand	Bother	L3MBTL3	34	41
O=C(O)C1CCN(C(=O)c2ccc(-n3cccc3)nc2)CC1	ZINC000819275780	CD	On-Demand	Anodyne	SFRP1	19	42
O=C(O)C1CCN(C(=O)c2ccc(-n3cccc3)nc2)CC1	ZINC000819275780	CD	On-Demand	Anodyne	L3MBTL3	86	47
O=C(O)[C@@H]1CCN(C(=O)c2ccc(F)c(I)c2)C1	ZINC000819275781	FD	On-Demand	Anodyne	SLC6A1	52	36
O=C(O)[C@@H]1CCN(C(=O)c2ccc(F)c(I)c2)C1	ZINC000819275781	FD	On-Demand	Anodyne	SLC18A3	20	41
O=C(O)[C@@H]1CCN(C(=O)c2ccc(F)c(I)c2)C1	ZINC000819275781	FD	On-Demand	Anodyne	L3MBTL3	84	41
O=C(O)[C@H]1CCN(C(=O)c2ccc(F)c(I)c2)C1	ZINC000819275782	FD	On-Demand	Anodyne	SLC6A1	52	36
O=C(O)[C@H]1CCN(C(=O)c2ccc(F)c(I)c2)C1	ZINC000819275782	FD	On-Demand	Anodyne	SLC18A3	20	41
O=C(O)[C@H]1CCN(C(=O)c2ccc(F)c(I)c2)C1	ZINC000819275782	FD	On-Demand	Anodyne	L3MBTL3	84	41
O=C(O)[C@@H]1CCN(C(=O)c2ccc[n+]([O-])c2)C1	ZINC000819275783	BB	On-Demand	Anodyne	SLC6A1	93	38
O=C(O)[C@@H]1CCN(C(=O)c2ccc[n+]([O-])c2)C1	ZINC000819275783	BB	On-Demand	Anodyne	L3MBTL3	75	38
O=C(O)[C@H]1CCN(C(=O)c2ccc[n+]([O-])c2)C1	ZINC000819275784	BB	On-Demand	Anodyne	SLC6A1	93	38
O=C(O)[C@H]1CCN(C(=O)c2ccc[n+]([O-])c2)C1	ZINC000819275784	BB	On-Demand	Anodyne	L3MBTL3	75	38
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)C1	ZINC000819275787	FC	On-Demand	Anodyne	SLC6A1	65	35
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)C1	ZINC000819275787	FC	On-Demand	Anodyne	CHRM3	20	42
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)C1	ZINC000819275787	FC	On-Demand	Anodyne	L3MBTL3	52	40
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)C1	ZINC000819275788	FC	On-Demand	Anodyne	SLC6A1	65	35
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)C1	ZINC000819275788	FC	On-Demand	Anodyne	CHRM3	20	42
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)C1	ZINC000819275788	FC	On-Demand	Anodyne	L3MBTL3	52	40
O=C(O)[C@@H]1CCN(C(=O)c2cccc(S(=O)(=O)NCc3ccco3)c2)C1	ZINC000819275789	GD	On-Demand	Anodyne	SFRP1	101	38
O=C(O)[C@@H]1CCN(C(=O)c2cccc(S(=O)(=O)NCc3ccco3)c2)C1	ZINC000819275789	GD	On-Demand	Anodyne	WNT3	66	34
O=C(O)[C@H]1CCN(C(=O)c2cccc(S(=O)(=O)NCc3ccco3)c2)C1	ZINC000819275790	GD	On-Demand	Anodyne	SFRP1	101	38
O=C(O)[C@H]1CCN(C(=O)c2cccc(S(=O)(=O)NCc3ccco3)c2)C1	ZINC000819275790	GD	On-Demand	Anodyne	WNT3	66	34
O=C(O)[C@@H]1CCN(C(=O)c2cccc(N3C(=O)c4ccccc4C3=O)c2)C1	ZINC000819275791	FE	On-Demand	Anodyne	PTGS1	17	41
O=C(O)[C@@H]1CCN(C(=O)c2cccc(N3C(=O)c4ccccc4C3=O)c2)C1	ZINC000819275791	FE	On-Demand	Anodyne	SLC6A1	74	34
O=C(O)[C@@H]1CCN(C(=O)c2cccc(N3C(=O)c4ccccc4C3=O)c2)C1	ZINC000819275791	FE	On-Demand	Anodyne	L3MBTL3	56	42
O=C(O)[C@H]1CCN(C(=O)c2cccc(N3C(=O)c4ccccc4C3=O)c2)C1	ZINC000819275792	FE	On-Demand	Anodyne	PTGS1	17	41
O=C(O)[C@H]1CCN(C(=O)c2cccc(N3C(=O)c4ccccc4C3=O)c2)C1	ZINC000819275792	FE	On-Demand	Anodyne	SLC6A1	74	34
O=C(O)[C@H]1CCN(C(=O)c2cccc(N3C(=O)c4ccccc4C3=O)c2)C1	ZINC000819275792	FE	On-Demand	Anodyne	L3MBTL3	56	42
O=C(O)[C@@H]1CCN(C(=O)c2cccnc2S)C1	ZINC000819275793	CC	On-Demand	Anodyne	SLC6A1	64	33
O=C(O)[C@@H]1CCN(C(=O)c2cccnc2S)C1	ZINC000819275793	CC	On-Demand	Anodyne	L3MBTL3	51	40
O=C(O)[C@H]1CCN(C(=O)c2cccnc2S)C1	ZINC000819275794	CC	On-Demand	Anodyne	SLC6A1	64	33
O=C(O)[C@H]1CCN(C(=O)c2cccnc2S)C1	ZINC000819275794	CC	On-Demand	Anodyne	L3MBTL3	51	40
O=C(O)[C@H]1CCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000819275795	EE	On-Demand	Anodyne	SLC6A1	48	31
O=C(O)[C@H]1CCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000819275795	EE	On-Demand	Anodyne	CHRNA7	47	40
O=C(O)[C@H]1CCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000819275795	EE	On-Demand	Anodyne	C3AR1	40	41
O=C(O)[C@H]1CCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000819275795	EE	On-Demand	Anodyne	SCD	22	42
O=C(O)[C@H]1CCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000819275795	EE	On-Demand	Anodyne	ACHP_LYMST	23	40
O=C(O)[C@H]1CCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000819275795	EE	On-Demand	Anodyne	L3MBTL3	24	45
O=C(O)[C@H]1CCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000819275795	EE	On-Demand	Anodyne	NAMPT	58	42
O=C(O)[C@@H]1CCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000819275796	EE	On-Demand	Anodyne	SLC6A1	48	31
O=C(O)[C@@H]1CCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000819275796	EE	On-Demand	Anodyne	CHRNA7	47	40
O=C(O)[C@@H]1CCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000819275796	EE	On-Demand	Anodyne	C3AR1	40	41
O=C(O)[C@@H]1CCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000819275796	EE	On-Demand	Anodyne	SCD	22	42
O=C(O)[C@@H]1CCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000819275796	EE	On-Demand	Anodyne	ACHP_LYMST	23	40
O=C(O)[C@@H]1CCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000819275796	EE	On-Demand	Anodyne	L3MBTL3	24	45
O=C(O)[C@@H]1CCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000819275796	EE	On-Demand	Anodyne	NAMPT	58	42
O=C(O)[C@@H]1CCN(C(=O)c2cc[n+]([O-])cc2)C1	ZINC000819275797	BB	On-Demand	Anodyne	L3MBTL3	84	44
O=C(O)[C@H]1CCN(C(=O)c2cc[n+]([O-])cc2)C1	ZINC000819275798	BB	On-Demand	Anodyne	L3MBTL3	84	44
O=C(O)C1CCN(C(=O)c2ccc(F)c(I)c2)CC1	ZINC000819275799	GE	On-Demand	Anodyne	L3MBTL3	97	46
O=C(O)[C@H]1CCN(C(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)C1	ZINC000819275800	GG	On-Demand	Anodyne	GRIN2B	39	44
O=C(O)[C@H]1CCN(C(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)C1	ZINC000819275800	GG	On-Demand	Anodyne	HTR2B	15	49
O=C(O)[C@H]1CCN(C(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)C1	ZINC000819275800	GG	On-Demand	Anodyne	L3MBTL3	48	34
O=C(O)[C@@H]1CCN(C(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)C1	ZINC000819275801	GG	On-Demand	Anodyne	GRIN2B	39	44
O=C(O)[C@@H]1CCN(C(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)C1	ZINC000819275801	GG	On-Demand	Anodyne	HTR2B	15	49
O=C(O)[C@@H]1CCN(C(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)C1	ZINC000819275801	GG	On-Demand	Anodyne	L3MBTL3	48	34
O=C(O)[C@@H]1CCN(C(=O)c2cccc(N3C(=O)CCC3=O)c2)C1	ZINC000819275806	DC	On-Demand	Anodyne	SLC6A1	60	34
O=C(O)[C@@H]1CCN(C(=O)c2cccc(N3C(=O)CCC3=O)c2)C1	ZINC000819275806	DC	On-Demand	Anodyne	L3MBTL3	63	44
O=C(O)[C@H]1CCN(C(=O)c2cccc(N3C(=O)CCC3=O)c2)C1	ZINC000819275807	DC	On-Demand	Anodyne	SLC6A1	60	34
O=C(O)[C@H]1CCN(C(=O)c2cccc(N3C(=O)CCC3=O)c2)C1	ZINC000819275807	DC	On-Demand	Anodyne	L3MBTL3	63	44
O=C(O)C1CCN(C(=O)c2ccccc2NCc2cccnc2)CC1	ZINC000819275808	EF	On-Demand	Anodyne	GRIN2B	32	44
O=C(O)C1CCN(C(=O)c2ccccc2NCc2cccnc2)CC1	ZINC000819275808	EF	On-Demand	Anodyne	CHRNA7	50	41
O=C(O)C1CCN(C(=O)c2ccccc2NCc2cccnc2)CC1	ZINC000819275808	EF	On-Demand	Anodyne	C3AR1	39	40
O=C(O)C1CCN(C(=O)c2ccccc2NCc2cccnc2)CC1	ZINC000819275808	EF	On-Demand	Anodyne	TPSAB1	21	41
O=C(O)C1CCN(C(=O)c2ccccc2NCc2cccnc2)CC1	ZINC000819275808	EF	On-Demand	Anodyne	SCD1	18	40
O=C(O)C1CCN(C(=O)c2ccccc2NCc2cccnc2)CC1	ZINC000819275808	EF	On-Demand	Anodyne	SCD	29	43
O=C(O)C1CCN(C(=O)c2ccccc2NCc2cccnc2)CC1	ZINC000819275808	EF	On-Demand	Anodyne	ACHP_LYMST	25	41
O=C(O)C1CCN(C(=O)c2ccccc2NCc2cccnc2)CC1	ZINC000819275808	EF	On-Demand	Anodyne	L3MBTL3	26	49
O=C(O)C1CCN(C(=O)c2ccccc2NCc2cccnc2)CC1	ZINC000819275808	EF	On-Demand	Anodyne	NAMPT	59	44
O=C(O)[C@@H]1CCN(C(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)C1	ZINC000819275811	DB	On-Demand	Anodyne	SLC18A3	26	43
O=C(O)[C@@H]1CCN(C(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)C1	ZINC000819275811	DB	On-Demand	Anodyne	PARP1	16	44
O=C(O)[C@@H]1CCN(C(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)C1	ZINC000819275811	DB	On-Demand	Anodyne	L3MBTL3	92	43
O=C(O)[C@H]1CCN(C(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)C1	ZINC000819275812	DB	On-Demand	Anodyne	SLC18A3	26	43
O=C(O)[C@H]1CCN(C(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)C1	ZINC000819275812	DB	On-Demand	Anodyne	PARP1	16	44
O=C(O)[C@H]1CCN(C(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)C1	ZINC000819275812	DB	On-Demand	Anodyne	L3MBTL3	92	43
O=C(O)[C@@H]1CCN(C(=O)c2ccc3nc(O)oc3c2)C1	ZINC000819275813	CD	On-Demand	Anodyne	L3MBTL3	68	40
O=C(O)[C@@H]1CCN(C(=O)c2ccc3nc(O)oc3c2)C1	ZINC000819275813	CD	On-Demand	Anodyne	HPGD	40	34
O=C(O)[C@H]1CCN(C(=O)c2ccc3nc(O)oc3c2)C1	ZINC000819275814	CD	On-Demand	Anodyne	L3MBTL3	68	40
O=C(O)[C@H]1CCN(C(=O)c2ccc3nc(O)oc3c2)C1	ZINC000819275814	CD	On-Demand	Anodyne	HPGD	40	34
O=C(O)C1CCN(C(=O)c2ccc3nnnn3c2)CC1	ZINC000819275815	CC	On-Demand	Anodyne	L3MBTL3	86	41
O=C(O)[C@@H]1CCN(C(=O)c2ccc(N3CCc4ccccc4C3)cc2)C1	ZINC000819275816	FF	On-Demand	Anodyne	SLC6A1	44	33
O=C(O)[C@@H]1CCN(C(=O)c2ccc(N3CCc4ccccc4C3)cc2)C1	ZINC000819275816	FF	On-Demand	Anodyne	SLC18A3	42	43
O=C(O)[C@@H]1CCN(C(=O)c2ccc(N3CCc4ccccc4C3)cc2)C1	ZINC000819275816	FF	On-Demand	Anodyne	L3MBTL3	82	44
O=C(O)[C@H]1CCN(C(=O)c2ccc(N3CCc4ccccc4C3)cc2)C1	ZINC000819275817	FF	On-Demand	Anodyne	SLC6A1	44	33
O=C(O)[C@H]1CCN(C(=O)c2ccc(N3CCc4ccccc4C3)cc2)C1	ZINC000819275817	FF	On-Demand	Anodyne	SLC18A3	42	43
O=C(O)[C@H]1CCN(C(=O)c2ccc(N3CCc4ccccc4C3)cc2)C1	ZINC000819275817	FF	On-Demand	Anodyne	L3MBTL3	82	44
O=C(O)[C@@H]1CCN(C(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819275818	GC	On-Demand	Anodyne	CNR2	17	57
O=C(O)[C@@H]1CCN(C(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819275818	GC	On-Demand	Anodyne	EPHX2	25	40
O=C(O)[C@@H]1CCN(C(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819275818	GC	On-Demand	Anodyne	L3MBTL3	55	37
O=C(O)[C@H]1CCN(C(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819275819	GC	On-Demand	Anodyne	CNR2	17	57
O=C(O)[C@H]1CCN(C(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819275819	GC	On-Demand	Anodyne	EPHX2	25	40
O=C(O)[C@H]1CCN(C(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)C1	ZINC000819275819	GC	On-Demand	Anodyne	L3MBTL3	55	37
O=C(O)[C@@H]1CCN(C(=O)c2ccc3nc(O)[nH]c3c2)C1	ZINC000819275820	CC	On-Demand	Anodyne	GRIN2B	35	43
O=C(O)[C@@H]1CCN(C(=O)c2ccc3nc(O)[nH]c3c2)C1	ZINC000819275820	CC	On-Demand	Anodyne	SLC18A3	17	40
O=C(O)[C@@H]1CCN(C(=O)c2ccc3nc(O)[nH]c3c2)C1	ZINC000819275820	CC	On-Demand	Anodyne	L3MBTL3	71	40
O=C(O)[C@@H]1CCN(C(=O)c2ccc3nc(O)[nH]c3c2)C1	ZINC000819275820	CC	On-Demand	Anodyne	HPGD	41	36
O=C(O)[C@H]1CCN(C(=O)c2ccc3nc(O)[nH]c3c2)C1	ZINC000819275821	CC	On-Demand	Anodyne	GRIN2B	35	43
O=C(O)[C@H]1CCN(C(=O)c2ccc3nc(O)[nH]c3c2)C1	ZINC000819275821	CC	On-Demand	Anodyne	SLC18A3	17	40
O=C(O)[C@H]1CCN(C(=O)c2ccc3nc(O)[nH]c3c2)C1	ZINC000819275821	CC	On-Demand	Anodyne	L3MBTL3	71	40
O=C(O)[C@H]1CCN(C(=O)c2ccc3nc(O)[nH]c3c2)C1	ZINC000819275821	CC	On-Demand	Anodyne	HPGD	41	36
O=C(O)[C@@H]1CCN(C(=O)c2cccnc2Sc2ccccc2)C1	ZINC000819275823	EF	On-Demand	Anodyne	SLC6A1	60	32
O=C(O)[C@H]1CCN(C(=O)c2cccnc2Sc2ccccc2)C1	ZINC000819275824	EF	On-Demand	Anodyne	SLC6A1	60	32
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275825	DD	On-Demand	Anodyne	CHRM2	17	46
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275825	DD	On-Demand	Anodyne	HTR1A	15	64
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275825	DD	On-Demand	Anodyne	DRD2	21	63
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275825	DD	On-Demand	Anodyne	DRD4	32	41
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275825	DD	On-Demand	Anodyne	ACHE	31	41
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275825	DD	On-Demand	Anodyne	HRH2	32	41
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275825	DD	On-Demand	Anodyne	SLC6A1	158	43
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275825	DD	On-Demand	Anodyne	CHRM3	28	46
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275825	DD	On-Demand	Anodyne	FABP4	28	40
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275825	DD	On-Demand	Anodyne	HRH3	38	49
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275825	DD	On-Demand	Anodyne	SIGMAR1	43	44
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275825	DD	On-Demand	Anodyne	BDKRB1	39	46
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275825	DD	On-Demand	Anodyne	PREP	36	41
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275825	DD	On-Demand	Anodyne	S1PR1	28	40
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275825	DD	On-Demand	Anodyne	PARP1	18	45
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275825	DD	On-Demand	Anodyne	S1PR5	35	40
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275825	DD	On-Demand	Anodyne	ALK	15	41
O=C(O)[C@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275825	DD	On-Demand	Anodyne	L3MBTL3	91	47
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275826	DD	On-Demand	Anodyne	CHRM2	17	46
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275826	DD	On-Demand	Anodyne	HTR1A	15	64
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275826	DD	On-Demand	Anodyne	DRD2	21	63
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275826	DD	On-Demand	Anodyne	DRD4	32	41
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275826	DD	On-Demand	Anodyne	ACHE	31	41
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275826	DD	On-Demand	Anodyne	HRH2	32	41
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275826	DD	On-Demand	Anodyne	SLC6A1	158	43
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275826	DD	On-Demand	Anodyne	CHRM3	28	46
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275826	DD	On-Demand	Anodyne	FABP4	28	40
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275826	DD	On-Demand	Anodyne	HRH3	38	49
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275826	DD	On-Demand	Anodyne	SIGMAR1	43	44
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275826	DD	On-Demand	Anodyne	BDKRB1	39	46
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275826	DD	On-Demand	Anodyne	PREP	36	41
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275826	DD	On-Demand	Anodyne	S1PR1	28	40
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275826	DD	On-Demand	Anodyne	PARP1	18	45
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275826	DD	On-Demand	Anodyne	S1PR5	35	40
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275826	DD	On-Demand	Anodyne	ALK	15	41
O=C(O)[C@@H]1CCN(C(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000819275826	DD	On-Demand	Anodyne	L3MBTL3	91	47
O=C(O)[C@H]1CCN(C(=O)c2ccccc2CN2CCOCC2)C1	ZINC000819275827	DD	On-Demand	Anodyne	SLC6A1	104	38
O=C(O)[C@@H]1CCN(C(=O)c2ccccc2CN2CCOCC2)C1	ZINC000819275828	DD	On-Demand	Anodyne	SLC6A1	104	38
O=C(O)[C@@H]1CCN(C(=O)c2ccc(-n3cccc3)nc2)C1	ZINC000819275829	CD	On-Demand	Anodyne	L3MBTL3	72	43
O=C(O)[C@H]1CCN(C(=O)c2ccc(-n3cccc3)nc2)C1	ZINC000819275830	CD	On-Demand	Anodyne	L3MBTL3	72	43
O=C(O)[C@@H]1CCN(C(=O)c2ccc(N3C(=O)CCC3=O)cc2)C1	ZINC000819275831	DC	On-Demand	Anodyne	SLC18A3	18	42
O=C(O)[C@@H]1CCN(C(=O)c2ccc(N3C(=O)CCC3=O)cc2)C1	ZINC000819275831	DC	On-Demand	Anodyne	L3MBTL3	84	46
O=C(O)[C@H]1CCN(C(=O)c2ccc(N3C(=O)CCC3=O)cc2)C1	ZINC000819275832	DC	On-Demand	Anodyne	SLC18A3	18	42
O=C(O)[C@H]1CCN(C(=O)c2ccc(N3C(=O)CCC3=O)cc2)C1	ZINC000819275832	DC	On-Demand	Anodyne	L3MBTL3	84	46
O=C(O)[C@@H]1CCN(C(=O)c2ccccc2NS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819275833	GE	On-Demand	Anodyne	SLC6A1	106	36
O=C(O)[C@@H]1CCN(C(=O)c2ccccc2NS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819275833	GE	On-Demand	Anodyne	PRTN3	56	36
O=C(O)[C@@H]1CCN(C(=O)c2ccccc2NS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819275833	GE	On-Demand	Anodyne	SFRP1	120	39
O=C(O)[C@@H]1CCN(C(=O)c2ccccc2NS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819275833	GE	On-Demand	Anodyne	WNT3	86	37
O=C(O)[C@H]1CCN(C(=O)c2ccccc2NS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819275834	GE	On-Demand	Anodyne	SLC6A1	106	36
O=C(O)[C@H]1CCN(C(=O)c2ccccc2NS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819275834	GE	On-Demand	Anodyne	PRTN3	56	36
O=C(O)[C@H]1CCN(C(=O)c2ccccc2NS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819275834	GE	On-Demand	Anodyne	SFRP1	120	39
O=C(O)[C@H]1CCN(C(=O)c2ccccc2NS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819275834	GE	On-Demand	Anodyne	WNT3	86	37
O=C(O)[C@@H]1CCN(C(=O)c2ccccc2CSC2=NCCS2)C1	ZINC000819275835	FF	On-Demand	Anodyne	SLC6A1	69	34
O=C(O)[C@H]1CCN(C(=O)c2ccccc2CSC2=NCCS2)C1	ZINC000819275836	FF	On-Demand	Anodyne	SLC6A1	69	34
O=C(O)C1CCN(C(=O)c2ccc(-c3ccco3)s2)CC1	ZINC000819275839	DF	On-Demand	Anodyne	L3MBTL3	34	45
O=C(O)[C@@H]1CCN(C(=O)c2cccnc2SC(F)F)C1	ZINC000819275840	DD	On-Demand	Anodyne	SLC6A1	41	32
O=C(O)[C@H]1CCN(C(=O)c2cccnc2SC(F)F)C1	ZINC000819275841	DD	On-Demand	Anodyne	SLC6A1	41	32
O=C(O)C1CCN(C(=O)c2cccc([N+](=O)[O-])c2O)CC1	ZINC000819275842	CD	On-Demand	Bother	L3MBTL3	62	45
O=C(O)[C@@H]1CCN(C(=O)c2ccc3nc(Cl)ccc3c2)C1	ZINC000819275843	DE	On-Demand	Anodyne	SLC18A3	15	40
O=C(O)[C@@H]1CCN(C(=O)c2ccc3nc(Cl)ccc3c2)C1	ZINC000819275843	DE	On-Demand	Anodyne	L3MBTL3	72	44
O=C(O)[C@@H]1CCN(C(=O)c2ccc3nc(Cl)ccc3c2)C1	ZINC000819275843	DE	On-Demand	Anodyne	HPGD	42	36
O=C(O)[C@H]1CCN(C(=O)c2ccc3nc(Cl)ccc3c2)C1	ZINC000819275844	DE	On-Demand	Anodyne	SLC18A3	15	40
O=C(O)[C@H]1CCN(C(=O)c2ccc3nc(Cl)ccc3c2)C1	ZINC000819275844	DE	On-Demand	Anodyne	L3MBTL3	72	44
O=C(O)[C@H]1CCN(C(=O)c2ccc3nc(Cl)ccc3c2)C1	ZINC000819275844	DE	On-Demand	Anodyne	HPGD	42	36
O=C(O)[C@@H]1CCN(C(=O)c2cccnc2SCc2ccc(F)cc2)C1	ZINC000819275845	FG	On-Demand	Anodyne	SLC6A1	75	35
O=C(O)[C@@H]1CCN(C(=O)c2cccnc2SCc2ccc(F)cc2)C1	ZINC000819275845	FG	On-Demand	Anodyne	CCR3	21	41
O=C(O)[C@H]1CCN(C(=O)c2cccnc2SCc2ccc(F)cc2)C1	ZINC000819275846	FG	On-Demand	Anodyne	SLC6A1	75	35
O=C(O)[C@H]1CCN(C(=O)c2cccnc2SCc2ccc(F)cc2)C1	ZINC000819275846	FG	On-Demand	Anodyne	CCR3	21	41
O=C(O)[C@@H]1CCN(C(=O)c2ccccc2CSc2nc3ccccc3o2)C1	ZINC000819275847	GH	On-Demand	Anodyne	SLC6A1	44	32
O=C(O)[C@H]1CCN(C(=O)c2ccccc2CSc2nc3ccccc3o2)C1	ZINC000819275848	GH	On-Demand	Anodyne	SLC6A1	44	32
O=C(O)C1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)CC1	ZINC000819275849	EF	On-Demand	Anodyne	SLC6A1	63	36
O=C(O)C1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)CC1	ZINC000819275849	EF	On-Demand	Anodyne	SLC9A1	35	42
O=C(O)C1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)CC1	ZINC000819275849	EF	On-Demand	Anodyne	EPHX2	23	44
O=C(O)C1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)CC1	ZINC000819275849	EF	On-Demand	Anodyne	RBP4	23	44
O=C(O)C1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)CC1	ZINC000819275849	EF	On-Demand	Anodyne	SFRP1	57	41
O=C(O)C1CCN(C(=O)c2cccc(OCC(F)(F)F)c2)CC1	ZINC000819275849	EF	On-Demand	Anodyne	L3MBTL3	83	45
O=C(O)[C@@H]1CCN(C(=O)c2ccc3c(O)nc(S)nc3c2)C1	ZINC000819275850	DD	On-Demand	Anodyne	L3MBTL3	61	39
O=C(O)[C@@H]1CCN(C(=O)c2ccc3c(O)nc(S)nc3c2)C1	ZINC000819275850	DD	On-Demand	Anodyne	HPGD	42	36
O=C(O)[C@H]1CCN(C(=O)c2ccc3c(O)nc(S)nc3c2)C1	ZINC000819275851	DD	On-Demand	Anodyne	L3MBTL3	61	39
O=C(O)[C@H]1CCN(C(=O)c2ccc3c(O)nc(S)nc3c2)C1	ZINC000819275851	DD	On-Demand	Anodyne	HPGD	42	36
C[C@@H](CNC[C@@H](O)COc1ccc(C#N)cc1)NC(=O)OC(C)(C)C	ZINC000819275900	ED	On-Demand	Mild	ADRB2	39	43
C[C@@H](CNC[C@@H](O)COc1ccc(C#N)cc1)NC(=O)OC(C)(C)C	ZINC000819275900	ED	On-Demand	Mild	ADRB1	59	36
C[C@H](CNC[C@H](O)COc1ccc(C#N)cc1)NC(=O)OC(C)(C)C	ZINC000819275901	ED	On-Demand	Mild	ADRB2	39	43
C[C@H](CNC[C@H](O)COc1ccc(C#N)cc1)NC(=O)OC(C)(C)C	ZINC000819275901	ED	On-Demand	Mild	ADRB1	59	36
C[C@H](CNC[C@@H](O)COc1ccc(C#N)cc1)NC(=O)OC(C)(C)C	ZINC000819275902	ED	On-Demand	Mild	ADRB2	39	43
C[C@H](CNC[C@@H](O)COc1ccc(C#N)cc1)NC(=O)OC(C)(C)C	ZINC000819275902	ED	On-Demand	Mild	ADRB1	59	36
C[C@@H](CNC[C@H](O)COc1ccc(C#N)cc1)NC(=O)OC(C)(C)C	ZINC000819275903	ED	On-Demand	Mild	ADRB2	39	43
C[C@@H](CNC[C@H](O)COc1ccc(C#N)cc1)NC(=O)OC(C)(C)C	ZINC000819275903	ED	On-Demand	Mild	ADRB1	59	36
O=C(C(F)=C1CCC1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F	ZINC000819275906	EH	On-Demand	Bother	COLA	120	41
O[C@@H](CNC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(F)cc1	ZINC000819275936	FG	On-Demand	Anodyne	SLC6A3	18	48
O[C@H](CNC1CC(N2CCC(C(F)(F)F)CC2)C1)c1ccc(F)cc1	ZINC000819275937	FG	On-Demand	Anodyne	SLC6A3	18	48
C[C@H](CNC[C@H](C#N)CCC#N)NC(=O)OC(C)(C)C	ZINC000819275943	CD	On-Demand	Mild	PAPA1_CARPA	37	42
C[C@H](CNC[C@H](C#N)CCC#N)NC(=O)OC(C)(C)C	ZINC000819275943	CD	On-Demand	Mild	CTSK	15	42
C[C@@H](CNC[C@@H](C#N)CCC#N)NC(=O)OC(C)(C)C	ZINC000819275944	CD	On-Demand	Mild	PAPA1_CARPA	37	42
C[C@@H](CNC[C@@H](C#N)CCC#N)NC(=O)OC(C)(C)C	ZINC000819275944	CD	On-Demand	Mild	CTSK	15	42
C[C@@H](CNC[C@H](C#N)CCC#N)NC(=O)OC(C)(C)C	ZINC000819275945	CD	On-Demand	Mild	PAPA1_CARPA	37	42
C[C@@H](CNC[C@H](C#N)CCC#N)NC(=O)OC(C)(C)C	ZINC000819275945	CD	On-Demand	Mild	CTSK	15	42
C[C@H](CNC[C@@H](C#N)CCC#N)NC(=O)OC(C)(C)C	ZINC000819275946	CD	On-Demand	Mild	PAPA1_CARPA	37	42
C[C@H](CNC[C@@H](C#N)CCC#N)NC(=O)OC(C)(C)C	ZINC000819275946	CD	On-Demand	Mild	CTSK	15	42
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819275967	GI	On-Demand	Anodyne	ADRB2	20	47
COCCC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819275967	GI	On-Demand	Anodyne	ADRB3	25	47
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819275968	GI	On-Demand	Anodyne	ADRB2	20	47
COCCC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(Br)cc1	ZINC000819275968	GI	On-Demand	Anodyne	ADRB3	25	47
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819275969	GI	On-Demand	Anodyne	ADRB2	20	47
COCCC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819275969	GI	On-Demand	Anodyne	ADRB3	25	47
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819275970	GI	On-Demand	Anodyne	ADRB2	20	47
COCCC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(Br)cc1	ZINC000819275970	GI	On-Demand	Anodyne	ADRB3	25	47
N#CCSc1ccccc1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819275971	HK	On-Demand	Mild	NR2E3	60	33
N#CCSc1ccccc1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819275971	HK	On-Demand	Mild	SMO	21	40
N#CCSc1ccccc1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819275971	HK	On-Demand	Mild	KCNK3	117	44
N#CCSc1ccccc1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819275971	HK	On-Demand	Mild	KCNK9	84	42
C[C@H](CNC[C@@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275986	FG	On-Demand	Anodyne	ADRB2	53	60
C[C@H](CNC[C@@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275986	FG	On-Demand	Anodyne	ADRB1	64	42
C[C@H](CNC[C@@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275986	FG	On-Demand	Anodyne	ADRB3	37	42
C[C@H](CNC[C@@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275986	FG	On-Demand	Anodyne	CASR	43	38
C[C@H](CNC[C@@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275986	FG	On-Demand	Anodyne	PAPA1_CARPA	27	43
C[C@H](CNC[C@@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275986	FG	On-Demand	Anodyne	CYP2D6	17	45
C[C@H](CNC[C@@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275986	FG	On-Demand	Anodyne	ABCB1	21	40
C[C@@H](CNC[C@@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275987	FG	On-Demand	Anodyne	ADRB2	53	60
C[C@@H](CNC[C@@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275987	FG	On-Demand	Anodyne	ADRB1	64	42
C[C@@H](CNC[C@@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275987	FG	On-Demand	Anodyne	ADRB3	37	42
C[C@@H](CNC[C@@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275987	FG	On-Demand	Anodyne	CASR	43	38
C[C@@H](CNC[C@@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275987	FG	On-Demand	Anodyne	PAPA1_CARPA	27	43
C[C@@H](CNC[C@@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275987	FG	On-Demand	Anodyne	CYP2D6	17	45
C[C@@H](CNC[C@@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275987	FG	On-Demand	Anodyne	ABCB1	21	40
C[C@H](CNC[C@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275988	FG	On-Demand	Anodyne	ADRB2	53	60
C[C@H](CNC[C@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275988	FG	On-Demand	Anodyne	ADRB1	64	42
C[C@H](CNC[C@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275988	FG	On-Demand	Anodyne	ADRB3	37	42
C[C@H](CNC[C@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275988	FG	On-Demand	Anodyne	CASR	43	38
C[C@H](CNC[C@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275988	FG	On-Demand	Anodyne	PAPA1_CARPA	27	43
C[C@H](CNC[C@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275988	FG	On-Demand	Anodyne	CYP2D6	17	45
C[C@H](CNC[C@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275988	FG	On-Demand	Anodyne	ABCB1	21	40
C[C@@H](CNC[C@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275989	FG	On-Demand	Anodyne	ADRB2	53	60
C[C@@H](CNC[C@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275989	FG	On-Demand	Anodyne	ADRB1	64	42
C[C@@H](CNC[C@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275989	FG	On-Demand	Anodyne	ADRB3	37	42
C[C@@H](CNC[C@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275989	FG	On-Demand	Anodyne	CASR	43	38
C[C@@H](CNC[C@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275989	FG	On-Demand	Anodyne	PAPA1_CARPA	27	43
C[C@@H](CNC[C@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275989	FG	On-Demand	Anodyne	CYP2D6	17	45
C[C@@H](CNC[C@H](O)COc1ccc2ccccc2c1)NC(=O)OC(C)(C)C	ZINC000819275989	FG	On-Demand	Anodyne	ABCB1	21	40
NC(=O)CN(Cc1ccccc1)C(=O)/C=C\[C@@H]1CCCO1	ZINC000819275996	CD	On-Demand	Anodyne	Q6PRC7_IXORI	46	41
NC(=O)CN(Cc1ccccc1)C(=O)/C=C/[C@H]1CCCO1	ZINC000819275997	CD	On-Demand	Anodyne	Q6PRC7_IXORI	46	41
NC(=O)CN(Cc1ccccc1)C(=O)/C=C\[C@H]1CCCO1	ZINC000819275998	CD	On-Demand	Anodyne	Q6PRC7_IXORI	46	41
NC(=O)CN(Cc1ccccc1)C(=O)/C=C/[C@@H]1CCCO1	ZINC000819275999	CD	On-Demand	Anodyne	Q6PRC7_IXORI	46	41
C[C@H](CNC[C@H](O)COc1c(Cl)cccc1Cl)NC(=O)OC(C)(C)C	ZINC000819276037	GG	On-Demand	Anodyne	ADRB2	25	40
C[C@@H](CNC[C@@H](O)COc1c(Cl)cccc1Cl)NC(=O)OC(C)(C)C	ZINC000819276038	GG	On-Demand	Anodyne	ADRB2	25	40
C[C@@H](CNC[C@H](O)COc1c(Cl)cccc1Cl)NC(=O)OC(C)(C)C	ZINC000819276039	GG	On-Demand	Anodyne	ADRB2	25	40
C[C@H](CNC[C@@H](O)COc1c(Cl)cccc1Cl)NC(=O)OC(C)(C)C	ZINC000819276040	GG	On-Demand	Anodyne	ADRB2	25	40
CS(=O)(=O)C1(CNC[C@@H](O)c2cccc(F)c2)CCC1	ZINC000819276072	DD	On-Demand	Anodyne	ADRB2	23	40
CS(=O)(=O)C1(CNC[C@@H](O)c2cccc(F)c2)CCC1	ZINC000819276072	DD	On-Demand	Anodyne	ADRB3	53	42
CS(=O)(=O)C1(CNC[C@H](O)c2cccc(F)c2)CCC1	ZINC000819276073	DD	On-Demand	Anodyne	ADRB2	23	40
CS(=O)(=O)C1(CNC[C@H](O)c2cccc(F)c2)CCC1	ZINC000819276073	DD	On-Demand	Anodyne	ADRB3	53	42
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276101	ED	On-Demand	Anodyne	ADRB2	50	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276101	ED	On-Demand	Anodyne	ADRB1	86	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276101	ED	On-Demand	Anodyne	GRIN1	29	47
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276101	ED	On-Demand	Anodyne	ADRB3	54	53
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276102	ED	On-Demand	Anodyne	ADRB2	50	55
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276102	ED	On-Demand	Anodyne	ADRB1	86	55
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276102	ED	On-Demand	Anodyne	GRIN1	29	47
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276102	ED	On-Demand	Anodyne	ADRB3	54	53
O[C@H](CNCc1cccnc1F)COc1ccc(F)cc1	ZINC000819276107	CD	On-Demand	Anodyne	ADRB2	46	43
O[C@H](CNCc1cccnc1F)COc1ccc(F)cc1	ZINC000819276107	CD	On-Demand	Anodyne	ADRB1	73	43
O[C@H](CNCc1cccnc1F)COc1ccc(F)cc1	ZINC000819276107	CD	On-Demand	Anodyne	GRIN1	15	43
O[C@H](CNCc1cccnc1F)COc1ccc(F)cc1	ZINC000819276107	CD	On-Demand	Anodyne	ADRB3	42	43
O[C@@H](CNCc1cccnc1F)COc1ccc(F)cc1	ZINC000819276108	CD	On-Demand	Anodyne	ADRB2	46	43
O[C@@H](CNCc1cccnc1F)COc1ccc(F)cc1	ZINC000819276108	CD	On-Demand	Anodyne	ADRB1	73	43
O[C@@H](CNCc1cccnc1F)COc1ccc(F)cc1	ZINC000819276108	CD	On-Demand	Anodyne	GRIN1	15	43
O[C@@H](CNCc1cccnc1F)COc1ccc(F)cc1	ZINC000819276108	CD	On-Demand	Anodyne	ADRB3	42	43
O[C@H](CNCc1cccnc1F)COc1ccccc1C(F)(F)F	ZINC000819276122	EF	On-Demand	Anodyne	ADRB2	19	40
O[C@H](CNCc1cccnc1F)COc1ccccc1C(F)(F)F	ZINC000819276122	EF	On-Demand	Anodyne	ADRB1	53	37
O[C@@H](CNCc1cccnc1F)COc1ccccc1C(F)(F)F	ZINC000819276123	EF	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNCc1cccnc1F)COc1ccccc1C(F)(F)F	ZINC000819276123	EF	On-Demand	Anodyne	ADRB1	53	37
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819276153	EF	On-Demand	Anodyne	CCR2	26	41
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819276153	EF	On-Demand	Anodyne	EPHX2	17	44
CC(=O)N1CCC[C@H](CNC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819276154	EF	On-Demand	Anodyne	CCR2	26	41
CC(=O)N1CCC[C@H](CNC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819276154	EF	On-Demand	Anodyne	EPHX2	17	44
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819276155	EF	On-Demand	Anodyne	CCR2	26	41
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819276155	EF	On-Demand	Anodyne	EPHX2	17	44
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819276156	EF	On-Demand	Anodyne	CCR2	26	41
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819276156	EF	On-Demand	Anodyne	EPHX2	17	44
CS(=O)(=O)C1(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819276157	FD	On-Demand	Anodyne	ADRB3	26	44
CS(=O)(=O)C1(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819276158	FD	On-Demand	Anodyne	ADRB3	26	44
O[C@H](CNCc1cccnc1F)COc1ccccc1F	ZINC000819276162	CD	On-Demand	Anodyne	ADRB2	22	42
O[C@H](CNCc1cccnc1F)COc1ccccc1F	ZINC000819276162	CD	On-Demand	Anodyne	ADRB1	53	42
O[C@@H](CNCc1cccnc1F)COc1ccccc1F	ZINC000819276163	CD	On-Demand	Anodyne	ADRB2	22	42
O[C@@H](CNCc1cccnc1F)COc1ccccc1F	ZINC000819276163	CD	On-Demand	Anodyne	ADRB1	53	42
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2ccccc2Cl)C1	ZINC000819276166	DE	On-Demand	Anodyne	OPRL1	37	42
CC(=O)N1CCC[C@H](CNC[C@H](O)c2ccccc2Cl)C1	ZINC000819276167	DE	On-Demand	Anodyne	OPRL1	37	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC/C=C\c1ccccc1	ZINC000819276182	DF	On-Demand	Anodyne	PAPA1_CARPA	33	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC/C=C/c1ccccc1	ZINC000819276183	DF	On-Demand	Anodyne	PAPA1_CARPA	33	40
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(C3SCCCS3)cc2)c1	ZINC000819276203	IK	On-Demand	Anodyne	PPIA	22	44
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(C3SCCCS3)cc2)c1	ZINC000819276203	IK	On-Demand	Anodyne	PRNP	29	47
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(C3SCCCS3)cc2)c1	ZINC000819276203	IK	On-Demand	Anodyne	EPHX2	27	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(C3SCCCS3)cc2)c1	ZINC000819276203	IK	On-Demand	Anodyne	TAAR1	43	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(C3SCCCS3)cc2)c1	ZINC000819276203	IK	On-Demand	Anodyne	KCNK3	128	49
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(C3SCCCS3)cc2)c1	ZINC000819276203	IK	On-Demand	Anodyne	KCNK9	78	45
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCc2cccnc2F)CC1	ZINC000819276215	FE	On-Demand	Anodyne	GPR119	40	41
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCc2cccnc2F)CC1	ZINC000819276216	FE	On-Demand	Anodyne	GPR119	40	41
CS(=O)(=O)C1(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819276224	DD	On-Demand	Anodyne	ADRB2	48	40
CS(=O)(=O)C1(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819276224	DD	On-Demand	Anodyne	ADRB1	56	46
CS(=O)(=O)C1(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819276224	DD	On-Demand	Anodyne	ADRB3	88	49
CS(=O)(=O)C1(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819276224	DD	On-Demand	Anodyne	CYP3A4	40	35
CS(=O)(=O)C1(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819276225	DD	On-Demand	Anodyne	ADRB2	48	40
CS(=O)(=O)C1(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819276225	DD	On-Demand	Anodyne	ADRB1	56	46
CS(=O)(=O)C1(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819276225	DD	On-Demand	Anodyne	ADRB3	88	49
CS(=O)(=O)C1(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819276225	DD	On-Demand	Anodyne	CYP3A4	40	35
CC(=O)N1CCC[C@H](CNC[C@H](O)c2ccc(F)cc2C)C1	ZINC000819276239	DE	On-Demand	Anodyne	CCR3	77	37
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2ccc(F)cc2C)C1	ZINC000819276240	DE	On-Demand	Anodyne	CCR3	77	37
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2ccc(F)cc2C)C1	ZINC000819276241	DE	On-Demand	Anodyne	CCR3	77	37
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2ccc(F)cc2C)C1	ZINC000819276242	DE	On-Demand	Anodyne	CCR3	77	37
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819276247	EE	On-Demand	Anodyne	P2RX7	25	44
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819276247	EE	On-Demand	Anodyne	CCR3	56	38
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819276248	EE	On-Demand	Anodyne	P2RX7	25	44
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819276248	EE	On-Demand	Anodyne	CCR3	56	38
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819276249	EE	On-Demand	Anodyne	P2RX7	25	44
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819276249	EE	On-Demand	Anodyne	CCR3	56	38
CC(=O)N1CCC[C@H](CNC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819276250	EE	On-Demand	Anodyne	P2RX7	25	44
CC(=O)N1CCC[C@H](CNC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819276250	EE	On-Demand	Anodyne	CCR3	56	38
CCOc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276257	DE	On-Demand	Anodyne	ADRB2	47	44
CCOc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276257	DE	On-Demand	Anodyne	ADRB1	67	42
CCOc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276257	DE	On-Demand	Anodyne	GRIN1	17	44
CCOc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276257	DE	On-Demand	Anodyne	ADRB3	41	39
CCOc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276258	DE	On-Demand	Anodyne	ADRB2	47	44
CCOc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276258	DE	On-Demand	Anodyne	ADRB1	67	42
CCOc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276258	DE	On-Demand	Anodyne	GRIN1	17	44
CCOc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276258	DE	On-Demand	Anodyne	ADRB3	41	39
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2(S(C)(=O)=O)CC2)CC1	ZINC000819276260	GD	On-Demand	Anodyne	GPR119	40	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2(S(C)(=O)=O)CC2)CC1	ZINC000819276261	GD	On-Demand	Anodyne	GPR119	40	45
COc1cccc([S@@](=O)CC(=O)NCCn2ccnc2C(C)C)c1	ZINC000819276268	ED	On-Demand	Anodyne	DRD4	42	32
NC(=O)c1cnn2c1C[C@@H](CNC[C@@H](O)c1ccccc1)CC2	ZINC000819276272	DC	On-Demand	Anodyne	ADRB3	44	37
NC(=O)c1cnn2c1C[C@@H](CNC[C@H](O)c1ccccc1)CC2	ZINC000819276273	DC	On-Demand	Anodyne	ADRB3	44	37
NC(=O)c1cnn2c1C[C@H](CNC[C@@H](O)c1ccccc1)CC2	ZINC000819276274	DC	On-Demand	Anodyne	ADRB3	44	37
NC(=O)c1cnn2c1C[C@H](CNC[C@H](O)c1ccccc1)CC2	ZINC000819276275	DC	On-Demand	Anodyne	ADRB3	44	37
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2cccnc2F)c1	ZINC000819276283	DD	On-Demand	Bother	ADRB1	27	45
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2cccnc2F)c1	ZINC000819276283	DD	On-Demand	Bother	ADRB3	19	45
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2cccnc2F)c1	ZINC000819276284	DD	On-Demand	Bother	ADRB1	27	45
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2cccnc2F)c1	ZINC000819276284	DD	On-Demand	Bother	ADRB3	19	45
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819276303	DE	On-Demand	Anodyne	AKT3	41	39
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819276303	DE	On-Demand	Anodyne	DPP7	37	41
CC(=O)N1CCC[C@H](CNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819276304	DE	On-Demand	Anodyne	AKT3	41	39
CC(=O)N1CCC[C@H](CNC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819276304	DE	On-Demand	Anodyne	DPP7	37	41
COCCc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276334	ED	On-Demand	Anodyne	ADRB2	45	56
COCCc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276334	ED	On-Demand	Anodyne	ADRB1	74	56
COCCc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276334	ED	On-Demand	Anodyne	GRIN1	27	42
COCCc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276334	ED	On-Demand	Anodyne	ADRB3	49	46
COCCc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276335	ED	On-Demand	Anodyne	ADRB2	45	56
COCCc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276335	ED	On-Demand	Anodyne	ADRB1	74	56
COCCc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276335	ED	On-Demand	Anodyne	GRIN1	27	42
COCCc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276335	ED	On-Demand	Anodyne	ADRB3	49	46
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819276336	EF	On-Demand	Anodyne	CACNA1I	42	33
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819276337	EF	On-Demand	Anodyne	CACNA1I	42	33
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819276338	EF	On-Demand	Anodyne	CACNA1I	42	33
CC(=O)N1CCC[C@H](CNC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819276339	EF	On-Demand	Anodyne	CACNA1I	42	33
O=C(CCNCc1cccnc1F)Nc1cccc(C(F)(F)F)c1	ZINC000819276348	EG	On-Demand	Anodyne	PPIA	15	46
O=C(CCNCc1cccnc1F)Nc1cccc(C(F)(F)F)c1	ZINC000819276348	EG	On-Demand	Anodyne	KIT	15	42
O=C(CCNCc1cccnc1F)Nc1cccc(C(F)(F)F)c1	ZINC000819276348	EG	On-Demand	Anodyne	LCK	25	42
O=C(CCNCc1cccnc1F)Nc1cccc(C(F)(F)F)c1	ZINC000819276348	EG	On-Demand	Anodyne	TRPV1	15	46
O=C(CCNCc1cccnc1F)Nc1cccc(C(F)(F)F)c1	ZINC000819276348	EG	On-Demand	Anodyne	P2RY1	16	45
O=C(CCNCc1cccnc1F)Nc1cccc(C(F)(F)F)c1	ZINC000819276348	EG	On-Demand	Anodyne	KDR	20	42
O=C(CCNCc1cccnc1F)Nc1cccc(C(F)(F)F)c1	ZINC000819276348	EG	On-Demand	Anodyne	LYN	15	40
O=C(CCNCc1cccnc1F)Nc1cccc(C(F)(F)F)c1	ZINC000819276348	EG	On-Demand	Anodyne	TEK	34	40
O=C(CCNCc1cccnc1F)Nc1cccc(C(F)(F)F)c1	ZINC000819276348	EG	On-Demand	Anodyne	BTK	18	42
O=C(CCNCc1cccnc1F)Nc1cccc(C(F)(F)F)c1	ZINC000819276348	EG	On-Demand	Anodyne	BRAF	31	40
O=C(CCNCc1cccnc1F)Nc1cccc(C(F)(F)F)c1	ZINC000819276348	EG	On-Demand	Anodyne	EPHB4	20	40
O=C(CCNCc1cccnc1F)Nc1cccc(C(F)(F)F)c1	ZINC000819276348	EG	On-Demand	Anodyne	RIPK1	56	40
Cc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276355	CE	On-Demand	Anodyne	ADRB2	48	50
Cc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276355	CE	On-Demand	Anodyne	ADRB1	69	42
Cc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276355	CE	On-Demand	Anodyne	GRIN1	16	44
Cc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276355	CE	On-Demand	Anodyne	ADRB3	43	42
Cc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276356	CE	On-Demand	Anodyne	ADRB2	48	50
Cc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276356	CE	On-Demand	Anodyne	ADRB1	69	42
Cc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276356	CE	On-Demand	Anodyne	GRIN1	16	44
Cc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276356	CE	On-Demand	Anodyne	ADRB3	43	42
COc1cccc(OC)c1OC[C@H](O)CNCc1cccnc1F	ZINC000819276362	ED	On-Demand	Anodyne	ADRB2	25	41
COc1cccc(OC)c1OC[C@@H](O)CNCc1cccnc1F	ZINC000819276363	ED	On-Demand	Anodyne	ADRB2	25	41
CC(=O)c1cccc(OC[C@@H](O)CNCc2cccnc2F)c1	ZINC000819276381	DD	On-Demand	Anodyne	ADRB2	31	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2cccnc2F)c1	ZINC000819276381	DD	On-Demand	Anodyne	ADRB1	53	39
CC(=O)c1cccc(OC[C@@H](O)CNCc2cccnc2F)c1	ZINC000819276381	DD	On-Demand	Anodyne	ABCB1	18	44
CC(=O)c1cccc(OC[C@@H](O)CNCc2cccnc2F)c1	ZINC000819276381	DD	On-Demand	Anodyne	PDS	47	35
CC(=O)c1cccc(OC[C@H](O)CNCc2cccnc2F)c1	ZINC000819276382	DD	On-Demand	Anodyne	ADRB2	31	43
CC(=O)c1cccc(OC[C@H](O)CNCc2cccnc2F)c1	ZINC000819276382	DD	On-Demand	Anodyne	ADRB1	53	39
CC(=O)c1cccc(OC[C@H](O)CNCc2cccnc2F)c1	ZINC000819276382	DD	On-Demand	Anodyne	ABCB1	18	44
CC(=O)c1cccc(OC[C@H](O)CNCc2cccnc2F)c1	ZINC000819276382	DD	On-Demand	Anodyne	PDS	47	35
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819276399	DE	On-Demand	Anodyne	ADAM10	17	40
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819276400	DE	On-Demand	Anodyne	ADAM10	17	40
NC(=O)c1cnn2c1C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)CC2	ZINC000819276405	ED	On-Demand	Anodyne	ADRB1	38	43
NC(=O)c1cnn2c1C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)CC2	ZINC000819276405	ED	On-Demand	Anodyne	ADRB3	58	43
NC(=O)c1cnn2c1C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)CC2	ZINC000819276405	ED	On-Demand	Anodyne	CYP3A4	45	34
NC(=O)c1cnn2c1C[C@H](CNC[C@H](O)c1cccc(Cl)c1)CC2	ZINC000819276406	ED	On-Demand	Anodyne	ADRB1	38	43
NC(=O)c1cnn2c1C[C@H](CNC[C@H](O)c1cccc(Cl)c1)CC2	ZINC000819276406	ED	On-Demand	Anodyne	ADRB3	58	43
NC(=O)c1cnn2c1C[C@H](CNC[C@H](O)c1cccc(Cl)c1)CC2	ZINC000819276406	ED	On-Demand	Anodyne	CYP3A4	45	34
NC(=O)c1cnn2c1C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)CC2	ZINC000819276407	ED	On-Demand	Anodyne	ADRB1	38	43
NC(=O)c1cnn2c1C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)CC2	ZINC000819276407	ED	On-Demand	Anodyne	ADRB3	58	43
NC(=O)c1cnn2c1C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)CC2	ZINC000819276407	ED	On-Demand	Anodyne	CYP3A4	45	34
NC(=O)c1cnn2c1C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)CC2	ZINC000819276408	ED	On-Demand	Anodyne	ADRB1	38	43
NC(=O)c1cnn2c1C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)CC2	ZINC000819276408	ED	On-Demand	Anodyne	ADRB3	58	43
NC(=O)c1cnn2c1C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)CC2	ZINC000819276408	ED	On-Demand	Anodyne	CYP3A4	45	34
O[C@H](CNCc1cccnc1F)COc1ccc(Cl)c(Cl)c1	ZINC000819276444	EG	On-Demand	Anodyne	ADRB2	32	41
O[C@H](CNCc1cccnc1F)COc1ccc(Cl)c(Cl)c1	ZINC000819276444	EG	On-Demand	Anodyne	ADRB1	44	41
O[C@H](CNCc1cccnc1F)COc1ccc(Cl)c(Cl)c1	ZINC000819276444	EG	On-Demand	Anodyne	GRIN1	29	45
O[C@H](CNCc1cccnc1F)COc1ccc(Cl)c(Cl)c1	ZINC000819276444	EG	On-Demand	Anodyne	ADRB3	29	41
O[C@@H](CNCc1cccnc1F)COc1ccc(Cl)c(Cl)c1	ZINC000819276445	EG	On-Demand	Anodyne	ADRB2	32	41
O[C@@H](CNCc1cccnc1F)COc1ccc(Cl)c(Cl)c1	ZINC000819276445	EG	On-Demand	Anodyne	ADRB1	44	41
O[C@@H](CNCc1cccnc1F)COc1ccc(Cl)c(Cl)c1	ZINC000819276445	EG	On-Demand	Anodyne	GRIN1	29	45
O[C@@H](CNCc1cccnc1F)COc1ccc(Cl)c(Cl)c1	ZINC000819276445	EG	On-Demand	Anodyne	ADRB3	29	41
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819276454	DD	On-Demand	Bother	CACNA1D	50	35
CC(=O)N1CCC[C@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819276455	DD	On-Demand	Bother	CACNA1D	50	35
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819276456	DD	On-Demand	Bother	CACNA1D	50	35
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819276457	DD	On-Demand	Bother	CACNA1D	50	35
CC(=O)N1CCC[C@H](CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819276468	GD	On-Demand	Anodyne	GPR119	24	41
CC(=O)N1CCC[C@@H](CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819276469	GD	On-Demand	Anodyne	GPR119	24	41
CC(=O)N1CCC[C@H](CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819276470	GD	On-Demand	Anodyne	GPR119	24	41
CC(=O)N1CCC[C@@H](CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819276471	GD	On-Demand	Anodyne	GPR119	24	41
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276494	EE	On-Demand	Anodyne	ADRB2	48	45
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276494	EE	On-Demand	Anodyne	ADRB1	82	46
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276494	EE	On-Demand	Anodyne	GRIN1	28	43
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276494	EE	On-Demand	Anodyne	ADRB3	54	46
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276494	EE	On-Demand	Anodyne	ABCB1	26	43
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276495	EE	On-Demand	Anodyne	ADRB2	48	45
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276495	EE	On-Demand	Anodyne	ADRB1	82	46
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276495	EE	On-Demand	Anodyne	GRIN1	28	43
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276495	EE	On-Demand	Anodyne	ADRB3	54	46
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276495	EE	On-Demand	Anodyne	ABCB1	26	43
CS(=O)(=O)C1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819276529	CC	On-Demand	Anodyne	ADRB2	27	44
CS(=O)(=O)C1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819276529	CC	On-Demand	Anodyne	ADRB1	30	44
CS(=O)(=O)C1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819276529	CC	On-Demand	Anodyne	ADRB3	111	48
CS(=O)(=O)C1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819276530	CC	On-Demand	Anodyne	ADRB2	27	44
CS(=O)(=O)C1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819276530	CC	On-Demand	Anodyne	ADRB1	30	44
CS(=O)(=O)C1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819276530	CC	On-Demand	Anodyne	ADRB3	111	48
O[C@H](CNCc1cccnc1F)COc1ccc(Cl)cc1	ZINC000819276542	DE	On-Demand	Anodyne	ADRB2	38	42
O[C@H](CNCc1cccnc1F)COc1ccc(Cl)cc1	ZINC000819276542	DE	On-Demand	Anodyne	ADRB1	60	42
O[C@H](CNCc1cccnc1F)COc1ccc(Cl)cc1	ZINC000819276542	DE	On-Demand	Anodyne	GRIN1	24	44
O[C@H](CNCc1cccnc1F)COc1ccc(Cl)cc1	ZINC000819276542	DE	On-Demand	Anodyne	ADRB3	36	42
O[C@H](CNCc1cccnc1F)COc1ccc(Cl)cc1	ZINC000819276542	DE	On-Demand	Anodyne	CDK4	17	41
O[C@@H](CNCc1cccnc1F)COc1ccc(Cl)cc1	ZINC000819276543	DE	On-Demand	Anodyne	ADRB2	38	42
O[C@@H](CNCc1cccnc1F)COc1ccc(Cl)cc1	ZINC000819276543	DE	On-Demand	Anodyne	ADRB1	60	42
O[C@@H](CNCc1cccnc1F)COc1ccc(Cl)cc1	ZINC000819276543	DE	On-Demand	Anodyne	GRIN1	24	44
O[C@@H](CNCc1cccnc1F)COc1ccc(Cl)cc1	ZINC000819276543	DE	On-Demand	Anodyne	ADRB3	36	42
O[C@@H](CNCc1cccnc1F)COc1ccc(Cl)cc1	ZINC000819276543	DE	On-Demand	Anodyne	CDK4	17	41
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1cccnc1F	ZINC000819276550	DD	On-Demand	Bother	ADRB1	49	39
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1cccnc1F	ZINC000819276550	DD	On-Demand	Bother	COLA	59	34
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1cccnc1F	ZINC000819276551	DD	On-Demand	Bother	ADRB1	49	39
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1cccnc1F	ZINC000819276551	DD	On-Demand	Bother	COLA	59	34
O[C@H](CNCc1cccnc1F)COc1cccc(C(F)(F)F)c1	ZINC000819276569	EF	On-Demand	Anodyne	PDS	51	42
O[C@@H](CNCc1cccnc1F)COc1cccc(C(F)(F)F)c1	ZINC000819276571	EF	On-Demand	Anodyne	PDS	51	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnc1F	ZINC000819276573	GF	On-Demand	Anodyne	CTSD	104	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnc1F	ZINC000819276573	GF	On-Demand	Anodyne	PGC	60	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnc1F	ZINC000819276573	GF	On-Demand	Anodyne	PAPA1_CARPA	35	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnc1F	ZINC000819276573	GF	On-Demand	Anodyne	CTSL	15	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnc1F	ZINC000819276573	GF	On-Demand	Anodyne	BACE2	46	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnc1F	ZINC000819276573	GF	On-Demand	Anodyne	TACR3	15	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnc1F	ZINC000819276573	GF	On-Demand	Anodyne	REN	88	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnc1F	ZINC000819276573	GF	On-Demand	Anodyne	REN1	29	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnc1F	ZINC000819276573	GF	On-Demand	Anodyne	BACE1	101	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnc1F	ZINC000819276573	GF	On-Demand	Anodyne	SCN10A	23	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1cccnc1F	ZINC000819276573	GF	On-Demand	Anodyne	FPR1	51	41
CS(=O)(=O)C1(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)CCC1	ZINC000819276608	FE	On-Demand	Anodyne	ADRB3	26	43
CS(=O)(=O)C1(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)CCC1	ZINC000819276610	FE	On-Demand	Anodyne	ADRB3	26	43
N#Cc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276611	DD	On-Demand	Mild	ADRB2	33	40
N#Cc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276611	DD	On-Demand	Mild	ADRB1	58	38
N#Cc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276611	DD	On-Demand	Mild	ADRB3	31	40
N#Cc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276612	DD	On-Demand	Mild	ADRB2	33	40
N#Cc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276612	DD	On-Demand	Mild	ADRB1	58	38
N#Cc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276612	DD	On-Demand	Mild	ADRB3	31	40
CSc1ccc(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819276619	GH	On-Demand	Mild	PAPA1_CARPA	50	43
CSc1ccc(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819276619	GH	On-Demand	Mild	CTSK	18	43
CSc1ccc(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819276619	GH	On-Demand	Mild	FPR1	43	38
CSc1ccc(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819276620	GH	On-Demand	Mild	PAPA1_CARPA	50	43
CSc1ccc(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819276620	GH	On-Demand	Mild	CTSK	18	43
CSc1ccc(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819276620	GH	On-Demand	Mild	FPR1	43	38
O[C@H](CNCc1cccnc1F)C1CCCCC1	ZINC000819276631	CE	On-Demand	Anodyne	C3AR1	22	47
O[C@@H](CNCc1cccnc1F)C1CCCCC1	ZINC000819276632	CE	On-Demand	Anodyne	C3AR1	22	47
CSc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276672	DE	On-Demand	Anodyne	ADRB2	40	42
CSc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276672	DE	On-Demand	Anodyne	ADRB1	58	38
CSc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276672	DE	On-Demand	Anodyne	GRIN1	15	42
CSc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276673	DE	On-Demand	Anodyne	ADRB2	40	42
CSc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276673	DE	On-Demand	Anodyne	ADRB1	58	38
CSc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276673	DE	On-Demand	Anodyne	GRIN1	15	42
CS(=O)(=O)C1(CNC[C@@H](O)c2ccccc2)CCC1	ZINC000819276695	CD	On-Demand	Anodyne	ADRB2	23	40
CS(=O)(=O)C1(CNC[C@@H](O)c2ccccc2)CCC1	ZINC000819276695	CD	On-Demand	Anodyne	ADRB1	22	40
CS(=O)(=O)C1(CNC[C@@H](O)c2ccccc2)CCC1	ZINC000819276695	CD	On-Demand	Anodyne	ADRB3	60	39
CS(=O)(=O)C1(CNC[C@H](O)c2ccccc2)CCC1	ZINC000819276757	CD	On-Demand	Anodyne	ADRB2	23	40
CS(=O)(=O)C1(CNC[C@H](O)c2ccccc2)CCC1	ZINC000819276757	CD	On-Demand	Anodyne	ADRB1	22	40
CS(=O)(=O)C1(CNC[C@H](O)c2ccccc2)CCC1	ZINC000819276757	CD	On-Demand	Anodyne	ADRB3	60	39
Cc1ccc(OC[C@@H](O)CNCc2cccnc2F)c(C)c1	ZINC000819276767	DE	On-Demand	Anodyne	ADRB2	17	44
Cc1ccc(OC[C@H](O)CNCc2cccnc2F)c(C)c1	ZINC000819276768	DE	On-Demand	Anodyne	ADRB2	17	44
O[C@H](CNCc1cccnc1F)COc1ccccc1	ZINC000819276783	CD	On-Demand	Anodyne	ADRB2	51	53
O[C@H](CNCc1cccnc1F)COc1ccccc1	ZINC000819276783	CD	On-Demand	Anodyne	ADRB1	72	45
O[C@H](CNCc1cccnc1F)COc1ccccc1	ZINC000819276783	CD	On-Demand	Anodyne	ADRB3	49	45
O[C@@H](CNCc1cccnc1F)COc1ccccc1	ZINC000819276784	CD	On-Demand	Anodyne	ADRB2	51	53
O[C@@H](CNCc1cccnc1F)COc1ccccc1	ZINC000819276784	CD	On-Demand	Anodyne	ADRB1	72	45
O[C@@H](CNCc1cccnc1F)COc1ccccc1	ZINC000819276784	CD	On-Demand	Anodyne	ADRB3	49	45
CC(=O)c1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276789	DD	On-Demand	Anodyne	ADRB2	44	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276789	DD	On-Demand	Anodyne	ADRB1	74	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276789	DD	On-Demand	Anodyne	GRIN1	17	43
CC(=O)c1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276789	DD	On-Demand	Anodyne	ADRB3	41	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276789	DD	On-Demand	Anodyne	ABCB1	17	54
CC(=O)c1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276790	DD	On-Demand	Anodyne	ADRB2	44	41
CC(=O)c1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276790	DD	On-Demand	Anodyne	ADRB1	74	40
CC(=O)c1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276790	DD	On-Demand	Anodyne	GRIN1	17	43
CC(=O)c1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276790	DD	On-Demand	Anodyne	ADRB3	41	41
CC(=O)c1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276790	DD	On-Demand	Anodyne	ABCB1	17	54
N#CCc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276799	DD	On-Demand	Mild	ADRB2	37	40
N#CCc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276799	DD	On-Demand	Mild	ADRB1	65	40
N#CCc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276799	DD	On-Demand	Mild	GRIN1	16	40
N#CCc1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276799	DD	On-Demand	Mild	ADRB3	41	40
N#CCc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276800	DD	On-Demand	Mild	ADRB2	37	40
N#CCc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276800	DD	On-Demand	Mild	ADRB1	65	40
N#CCc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276800	DD	On-Demand	Mild	GRIN1	16	40
N#CCc1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276800	DD	On-Demand	Mild	ADRB3	41	40
CS(=O)(=O)C1(CNC[C@@H](O)c2cccc(Br)c2)CCC1	ZINC000819276855	FE	On-Demand	Anodyne	ADRB3	49	36
CS(=O)(=O)C1(CNC[C@H](O)c2cccc(Br)c2)CCC1	ZINC000819276856	FE	On-Demand	Anodyne	ADRB3	49	36
COc1ccc(OC)c([C@H](O)CNCC2(S(C)(=O)=O)CCC2)c1	ZINC000819276880	ED	On-Demand	Anodyne	ADRB2	15	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2(S(C)(=O)=O)CCC2)CC1	ZINC000819276950	GD	On-Demand	Anodyne	GPR119	39	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2(S(C)(=O)=O)CCC2)CC1	ZINC000819276951	GD	On-Demand	Anodyne	GPR119	39	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cccnc2F)CC1	ZINC000819276952	FE	On-Demand	Anodyne	GRIN2B	19	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cccnc2F)CC1	ZINC000819276952	FE	On-Demand	Anodyne	GPR119	66	55
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cccnc2F)CC1	ZINC000819276953	FE	On-Demand	Anodyne	GRIN2B	19	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cccnc2F)CC1	ZINC000819276953	FE	On-Demand	Anodyne	GPR119	66	55
CS(=O)(=O)C1(CNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819276981	DD	On-Demand	Anodyne	ADRB2	44	39
CS(=O)(=O)C1(CNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819276981	DD	On-Demand	Anodyne	ADRB1	54	44
CS(=O)(=O)C1(CNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819276981	DD	On-Demand	Anodyne	ADRB3	86	48
CS(=O)(=O)C1(CNC[C@H](O)c2cccc(Cl)c2)CCC1	ZINC000819276982	DD	On-Demand	Anodyne	ADRB2	44	39
CS(=O)(=O)C1(CNC[C@H](O)c2cccc(Cl)c2)CCC1	ZINC000819276982	DD	On-Demand	Anodyne	ADRB1	54	44
CS(=O)(=O)C1(CNC[C@H](O)c2cccc(Cl)c2)CCC1	ZINC000819276982	DD	On-Demand	Anodyne	ADRB3	86	48
CS(=O)(=O)C1(CNC[C@@H](O)c2ccc(Cl)c(F)c2)CCC1	ZINC000819276983	EE	On-Demand	Anodyne	ADRB2	18	41
CS(=O)(=O)C1(CNC[C@H](O)c2ccc(Cl)c(F)c2)CCC1	ZINC000819276984	EE	On-Demand	Anodyne	ADRB2	18	41
O[C@H](CNCc1cccnc1F)COc1ccccc1Cl	ZINC000819276985	DE	On-Demand	Anodyne	ADRB2	22	48
O[C@H](CNCc1cccnc1F)COc1ccccc1Cl	ZINC000819276985	DE	On-Demand	Anodyne	ADRB1	51	37
O[C@@H](CNCc1cccnc1F)COc1ccccc1Cl	ZINC000819276986	DE	On-Demand	Anodyne	ADRB2	22	48
O[C@@H](CNCc1cccnc1F)COc1ccccc1Cl	ZINC000819276986	DE	On-Demand	Anodyne	ADRB1	51	37
COC(=O)c1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276994	ED	On-Demand	Anodyne	ADRB2	50	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276994	ED	On-Demand	Anodyne	ADRB1	80	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276994	ED	On-Demand	Anodyne	GRIN1	18	45
COC(=O)c1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276994	ED	On-Demand	Anodyne	ADRB3	49	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2cccnc2F)cc1	ZINC000819276994	ED	On-Demand	Anodyne	ABCB1	15	44
COC(=O)c1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276995	ED	On-Demand	Anodyne	ADRB2	50	46
COC(=O)c1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276995	ED	On-Demand	Anodyne	ADRB1	80	46
COC(=O)c1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276995	ED	On-Demand	Anodyne	GRIN1	18	45
COC(=O)c1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276995	ED	On-Demand	Anodyne	ADRB3	49	46
COC(=O)c1ccc(OC[C@H](O)CNCc2cccnc2F)cc1	ZINC000819276995	ED	On-Demand	Anodyne	ABCB1	15	44
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819277007	CD	On-Demand	Anodyne	CCR5	23	40
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819277007	CD	On-Demand	Anodyne	Q8WSF8_APLCA	23	40
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819277008	CD	On-Demand	Anodyne	CCR5	23	40
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819277008	CD	On-Demand	Anodyne	Q8WSF8_APLCA	23	40
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819277009	CD	On-Demand	Anodyne	CCR5	23	40
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819277009	CD	On-Demand	Anodyne	Q8WSF8_APLCA	23	40
CC(=O)N1CCC[C@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819277010	CD	On-Demand	Anodyne	CCR5	23	40
CC(=O)N1CCC[C@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819277010	CD	On-Demand	Anodyne	Q8WSF8_APLCA	23	40
Cc1cc(OC[C@@H](O)CNCc2cccnc2F)c(C(C)C)cc1Cl	ZINC000819277015	FH	On-Demand	Anodyne	ADRB2	15	40
Cc1cc(OC[C@H](O)CNCc2cccnc2F)c(C(C)C)cc1Cl	ZINC000819277016	FH	On-Demand	Anodyne	ADRB2	15	40
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819277070	DE	On-Demand	Anodyne	ADRB1	49	44
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819277070	DE	On-Demand	Anodyne	ADRB3	61	44
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819277070	DE	On-Demand	Anodyne	IGF1R	27	42
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819277070	DE	On-Demand	Anodyne	CYP3A4	48	38
CC(=O)N1CCC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819277071	DE	On-Demand	Anodyne	ADRB1	49	44
CC(=O)N1CCC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819277071	DE	On-Demand	Anodyne	ADRB3	61	44
CC(=O)N1CCC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819277071	DE	On-Demand	Anodyne	IGF1R	27	42
CC(=O)N1CCC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819277071	DE	On-Demand	Anodyne	CYP3A4	48	38
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819277072	DE	On-Demand	Anodyne	ADRB1	49	44
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819277072	DE	On-Demand	Anodyne	ADRB3	61	44
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819277072	DE	On-Demand	Anodyne	IGF1R	27	42
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819277072	DE	On-Demand	Anodyne	CYP3A4	48	38
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819277073	DE	On-Demand	Anodyne	ADRB1	49	44
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819277073	DE	On-Demand	Anodyne	ADRB3	61	44
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819277073	DE	On-Demand	Anodyne	IGF1R	27	42
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819277073	DE	On-Demand	Anodyne	CYP3A4	48	38
O[C@H](CNCc1cccnc1F)COc1ccc(Br)cc1	ZINC000819277078	FF	On-Demand	Anodyne	ADRB2	36	42
O[C@H](CNCc1cccnc1F)COc1ccc(Br)cc1	ZINC000819277078	FF	On-Demand	Anodyne	ADRB1	57	42
O[C@H](CNCc1cccnc1F)COc1ccc(Br)cc1	ZINC000819277078	FF	On-Demand	Anodyne	ADRB3	34	42
O[C@@H](CNCc1cccnc1F)COc1ccc(Br)cc1	ZINC000819277079	FF	On-Demand	Anodyne	ADRB2	36	42
O[C@@H](CNCc1cccnc1F)COc1ccc(Br)cc1	ZINC000819277079	FF	On-Demand	Anodyne	ADRB1	57	42
O[C@@H](CNCc1cccnc1F)COc1ccc(Br)cc1	ZINC000819277079	FF	On-Demand	Anodyne	ADRB3	34	42
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819277106	CD	On-Demand	Anodyne	CCR3	59	39
CC(=O)N1CCC[C@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819277107	CD	On-Demand	Anodyne	CCR3	59	39
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819277108	CD	On-Demand	Anodyne	CCR3	59	39
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819277109	CD	On-Demand	Anodyne	CCR3	59	39
O[C@H](CN[C@H]1CCCc2ccc(F)cc21)c1cccnc1	ZINC000819277121	CF	On-Demand	Anodyne	ADRB3	61	46
O[C@H](CN[C@@H]1CCCc2ccc(F)cc21)c1cccnc1	ZINC000819277122	CF	On-Demand	Anodyne	ADRB3	61	46
O[C@@H](CN[C@H]1CCCc2ccc(F)cc21)c1cccnc1	ZINC000819277123	CF	On-Demand	Anodyne	ADRB3	61	46
O[C@@H](CN[C@@H]1CCCc2ccc(F)cc21)c1cccnc1	ZINC000819277124	CF	On-Demand	Anodyne	ADRB3	61	46
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2c2ccc(OC)cc2)cc1	ZINC000819277160	FE	On-Demand	Anodyne	ADRB2	33	46
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2c2ccc(OC)cc2)cc1	ZINC000819277160	FE	On-Demand	Anodyne	ADRB1	50	40
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2c2ccc(OC)cc2)cc1	ZINC000819277160	FE	On-Demand	Anodyne	ADRB3	31	44
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2c2ccc(OC)cc2)cc1	ZINC000819277161	FE	On-Demand	Anodyne	ADRB2	33	46
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2c2ccc(OC)cc2)cc1	ZINC000819277161	FE	On-Demand	Anodyne	ADRB1	50	40
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2c2ccc(OC)cc2)cc1	ZINC000819277161	FE	On-Demand	Anodyne	ADRB3	31	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1c1ccc(F)c(F)c1)C2	ZINC000819277192	GG	On-Demand	Anodyne	WNT3	49	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H]1c1ccc(F)c(F)c1)C2	ZINC000819277193	GG	On-Demand	Anodyne	WNT3	49	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1c1ccc(F)c(F)c1)C2	ZINC000819277194	GG	On-Demand	Anodyne	WNT3	49	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H]1c1ccc(F)c(F)c1)C2	ZINC000819277195	GG	On-Demand	Anodyne	WNT3	49	33
CC(=O)Nc1cccc(CC(=O)NC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819277201	FE	On-Demand	Anodyne	SIGMAR1	21	46
CC(=O)Nc1cccc(CC(=O)NC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819277201	FE	On-Demand	Anodyne	EPHX2	41	47
CC(=O)Nc1cccc(CC(=O)NC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819277201	FE	On-Demand	Anodyne	ST14	43	39
CC(=O)Nc1cccc(CC(=O)NC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819277201	FE	On-Demand	Anodyne	MCHR1	35	44
CC(=O)Nc1cccc(CC(=O)NC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819277201	FE	On-Demand	Anodyne	CCR8	26	40
CC(=O)Nc1cccc(CC(=O)NC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819277201	FE	On-Demand	Anodyne	GPR119	40	45
CCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)s1	ZINC000819277253	FK	On-Demand	Anodyne	PPIA	32	41
CCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)s1	ZINC000819277253	FK	On-Demand	Anodyne	LPL	40	36
CCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)s1	ZINC000819277253	FK	On-Demand	Anodyne	EPHX2	18	45
CCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)s1	ZINC000819277253	FK	On-Demand	Anodyne	PLAU	16	41
CCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)s1	ZINC000819277253	FK	On-Demand	Anodyne	KCNK3	126	45
CCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)s1	ZINC000819277253	FK	On-Demand	Anodyne	KCNK9	89	45
CCOC(=O)C1CCC(O)(CN[C@@H]2C[C@H]2c2ccc(OC)cc2)CC1	ZINC000819277254	EF	On-Demand	Anodyne	SLC6A4	17	40
CCOC(=O)C1CCC(O)(CN[C@@H]2C[C@H]2c2ccc(OC)cc2)CC1	ZINC000819277254	EF	On-Demand	Anodyne	SLC6A3	29	40
C[C@H](c1nc(-c2cccs2)no1)N1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819277262	GF	On-Demand	Anodyne	ETHR	51	47
C[C@H](c1nc(-c2cccs2)no1)N1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819277263	GF	On-Demand	Anodyne	ETHR	51	47
C[C@H](c1nc(-c2cccs2)no1)N1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819277264	GF	On-Demand	Anodyne	ETHR	51	47
C[C@H](c1nc(-c2cccs2)no1)N1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819277265	GF	On-Demand	Anodyne	ETHR	51	47
C[C@@H]1CCCC[C@@H]1C(=O)N1CCC[C@@H]1c1ccc(F)c(F)c1	ZINC000819277328	DI	On-Demand	Anodyne	PREP	43	37
C[C@@H]1CCCC[C@@H]1C(=O)N1CCC[C@@H]1c1ccc(F)c(F)c1	ZINC000819277328	DI	On-Demand	Anodyne	WNT3	40	31
C[C@@H]1CCCC[C@@H]1C(=O)N1CCC[C@H]1c1ccc(F)c(F)c1	ZINC000819277329	DI	On-Demand	Anodyne	PREP	43	37
C[C@@H]1CCCC[C@@H]1C(=O)N1CCC[C@H]1c1ccc(F)c(F)c1	ZINC000819277329	DI	On-Demand	Anodyne	WNT3	40	31
C[C@@H]1CCCC[C@H]1C(=O)N1CCC[C@H]1c1ccc(F)c(F)c1	ZINC000819277330	DI	On-Demand	Anodyne	PREP	43	37
C[C@@H]1CCCC[C@H]1C(=O)N1CCC[C@H]1c1ccc(F)c(F)c1	ZINC000819277330	DI	On-Demand	Anodyne	WNT3	40	31
C[C@@H]1CCCC[C@H]1C(=O)N1CCC[C@@H]1c1ccc(F)c(F)c1	ZINC000819277331	DI	On-Demand	Anodyne	PREP	43	37
C[C@@H]1CCCC[C@H]1C(=O)N1CCC[C@@H]1c1ccc(F)c(F)c1	ZINC000819277331	DI	On-Demand	Anodyne	WNT3	40	31
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819277332	DD	On-Demand	Anodyne	CCR3	65	39
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819277333	DD	On-Demand	Anodyne	CCR3	65	39
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819277334	DD	On-Demand	Anodyne	CCR3	65	39
CC(=O)N1CCC[C@H](CNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819277335	DD	On-Demand	Anodyne	CCR3	65	39
CSCCONC[C@H](O)COc1cccc2ccccc12	ZINC000819277401	DE	On-Demand	Anodyne	ADRB2	27	60
CSCCONC[C@H](O)COc1cccc2ccccc12	ZINC000819277401	DE	On-Demand	Anodyne	ADRB1	33	40
CSCCONC[C@H](O)COc1cccc2ccccc12	ZINC000819277401	DE	On-Demand	Anodyne	CYP2D6	20	46
CSCCONC[C@@H](O)COc1cccc2ccccc12	ZINC000819277402	DE	On-Demand	Anodyne	ADRB2	27	60
CSCCONC[C@@H](O)COc1cccc2ccccc12	ZINC000819277402	DE	On-Demand	Anodyne	ADRB1	33	40
CSCCONC[C@@H](O)COc1cccc2ccccc12	ZINC000819277402	DE	On-Demand	Anodyne	CYP2D6	20	46
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	CA2	21	49
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	PRSS1	27	41
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	PPIA	49	47
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	LPL	47	37
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	KIT	51	42
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	MAPK14	32	43
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	CA1	55	49
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	TRPV1	27	48
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	CCKAR	17	43
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	CPT1A	53	31
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	ROCK1	46	34
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	PRNP	72	52
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	RAF1	25	41
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	KDR	51	42
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	ROCK2	35	41
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	NR1H4	17	41
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	HDAC1	28	43
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	HDAC2	21	47
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	CCKBR	27	43
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	EPHX2	30	44
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	PLAU	39	49
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	F7	24	45
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	ACR	54	37
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	CA12	32	49
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	FLT3	37	48
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	TEK	42	42
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	CA9	37	49
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	TAAR1	50	43
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	NCE103	24	41
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	SMO	31	48
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	MTCA1	35	40
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	P96878_MYCTU	46	40
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	NOD1	19	43
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	NOD2	44	43
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	NAMPT	15	43
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	KCNK3	150	53
CCOC(=O)Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819277405	HK	On-Demand	Anodyne	KCNK9	100	53
O=C(CCc1cccc(OC(F)F)c1)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000819277406	GF	On-Demand	Anodyne	SIGMAR1	17	40
O=C(CCc1cccc(OC(F)F)c1)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819277407	GF	On-Demand	Anodyne	SIGMAR1	17	40
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)c2c(F)cccc2F)CC1	ZINC000819277411	GH	On-Demand	Anodyne	GPR119	17	42
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)c2c(F)cccc2F)CC1	ZINC000819277412	GH	On-Demand	Anodyne	GPR119	17	42
CSCCONC[C@@H](O)COc1cc(C)ccc1C	ZINC000819277416	CD	On-Demand	Anodyne	ADRB2	19	48
CSCCONC[C@H](O)COc1cc(C)ccc1C	ZINC000819277417	CD	On-Demand	Anodyne	ADRB2	19	48
O[C@@H](CNC1CC(N2CCCCC2)C1)c1ccccc1Cl	ZINC000819277449	DF	On-Demand	Anodyne	OPRL1	41	39
O=C(/C=C/Sc1ccccc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819277457	GK	On-Demand	Anodyne	LPAR2	15	54
O=C(/C=C/Sc1ccccc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819277457	GK	On-Demand	Anodyne	KCNK3	97	38
O=C(/C=C/Sc1ccccc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819277457	GK	On-Demand	Anodyne	KCNK9	58	38
O=C(/C=C\Sc1ccccc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819277458	GK	On-Demand	Anodyne	LPAR2	15	54
O=C(/C=C\Sc1ccccc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819277458	GK	On-Demand	Anodyne	KCNK3	97	38
O=C(/C=C\Sc1ccccc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819277458	GK	On-Demand	Anodyne	KCNK9	58	38
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)CCc2ccccc2)CC1	ZINC000819277462	FH	On-Demand	Anodyne	GHRHR	40	33
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)CCc2ccccc2)CC1	ZINC000819277463	FH	On-Demand	Anodyne	GHRHR	40	33
CCn1ncnc1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819277472	FD	On-Demand	Anodyne	GPR119	47	44
CCn1ncnc1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819277473	FD	On-Demand	Anodyne	GPR119	47	44
C[C@H](c1nc(-c2cccs2)no1)N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819277496	GG	On-Demand	Anodyne	ETHR	43	43
CCOC(=O)CC[C@H](O)CN[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC000819277518	DD	On-Demand	Anodyne	KDM1A	23	41
CCOC(=O)CC[C@@H](O)CN[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC000819277519	DD	On-Demand	Anodyne	KDM1A	23	41
C#CCNC(=O)CCN[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC000819277551	CD	On-Demand	Mild	KDM1A	30	40
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCCN(C(C)=O)C2)c1	ZINC000819277563	ED	On-Demand	Anodyne	CCR3	20	42
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCCN(C(C)=O)C2)c1	ZINC000819277563	ED	On-Demand	Anodyne	MTNR1A	23	43
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCCN(C(C)=O)C2)c1	ZINC000819277563	ED	On-Demand	Anodyne	MTNR1B	27	43
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCCN(C(C)=O)C2)c1	ZINC000819277564	ED	On-Demand	Anodyne	CCR3	20	42
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCCN(C(C)=O)C2)c1	ZINC000819277564	ED	On-Demand	Anodyne	MTNR1A	23	43
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCCN(C(C)=O)C2)c1	ZINC000819277564	ED	On-Demand	Anodyne	MTNR1B	27	43
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819277571	EF	On-Demand	Anodyne	RBP4	72	36
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819277571	EF	On-Demand	Anodyne	SFRP1	86	34
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819277571	EF	On-Demand	Anodyne	WNT3	63	34
CC(=O)N1CCC[C@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819277572	EF	On-Demand	Anodyne	RBP4	72	36
CC(=O)N1CCC[C@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819277572	EF	On-Demand	Anodyne	SFRP1	86	34
CC(=O)N1CCC[C@H](CNC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819277572	EF	On-Demand	Anodyne	WNT3	63	34
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819277573	EF	On-Demand	Anodyne	RBP4	72	36
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819277573	EF	On-Demand	Anodyne	SFRP1	86	34
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819277573	EF	On-Demand	Anodyne	WNT3	63	34
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819277574	EF	On-Demand	Anodyne	RBP4	72	36
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819277574	EF	On-Demand	Anodyne	SFRP1	86	34
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819277574	EF	On-Demand	Anodyne	WNT3	63	34
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819277590	FE	On-Demand	Anodyne	CTSS	18	42
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819277590	FE	On-Demand	Anodyne	EPHX2	41	42
CC(=O)N1CCC[C@H](CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819277591	FE	On-Demand	Anodyne	CTSS	18	42
CC(=O)N1CCC[C@H](CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819277591	FE	On-Demand	Anodyne	EPHX2	41	42
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819277592	FE	On-Demand	Anodyne	CTSS	18	42
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819277592	FE	On-Demand	Anodyne	EPHX2	41	42
CSCCONC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819277609	CD	On-Demand	Mild	ADRB2	21	40
CSCCONC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819277609	CD	On-Demand	Mild	ADRB1	26	40
CSCCONC[C@H](O)COc1ccc(C#N)cc1	ZINC000819277610	CD	On-Demand	Mild	ADRB2	21	40
CSCCONC[C@H](O)COc1ccc(C#N)cc1	ZINC000819277610	CD	On-Demand	Mild	ADRB1	26	40
CSCCONC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819277611	CD	On-Demand	Mild	ADRB2	27	42
CSCCONC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819277611	CD	On-Demand	Mild	ADRB1	38	42
CSCCONC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819277612	CD	On-Demand	Mild	ADRB2	27	42
CSCCONC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819277612	CD	On-Demand	Mild	ADRB1	38	42
CSCCONC[C@@H](O)COc1ccccc1	ZINC000819277615	CD	On-Demand	Anodyne	ADRB2	50	55
CSCCONC[C@@H](O)COc1ccccc1	ZINC000819277615	CD	On-Demand	Anodyne	ADRB1	59	45
CSCCONC[C@@H](O)COc1ccccc1	ZINC000819277615	CD	On-Demand	Anodyne	ADRB3	35	45
CSCCONC[C@H](O)COc1ccccc1	ZINC000819277616	CD	On-Demand	Anodyne	ADRB2	50	55
CSCCONC[C@H](O)COc1ccccc1	ZINC000819277616	CD	On-Demand	Anodyne	ADRB1	59	45
CSCCONC[C@H](O)COc1ccccc1	ZINC000819277616	CD	On-Demand	Anodyne	ADRB3	35	45
O=C(Cn1c(SC(F)F)nc2ccccc21)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819277619	JK	On-Demand	Anodyne	IMDH_CRYPV	39	47
O=C(CN1C(=O)CCOc2ccccc21)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819277627	II	On-Demand	Anodyne	NPY1R	26	44
O=C(CN1C(=O)CCOc2ccccc21)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819277627	II	On-Demand	Anodyne	CCKAR	41	45
O=C(CN1C(=O)CCOc2ccccc21)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819277627	II	On-Demand	Anodyne	CCKBR	71	45
CSCCONC[C@@H](O)COc1ccc(C)cc1C	ZINC000819277645	CD	On-Demand	Anodyne	ADRB2	15	48
CSCCONC[C@H](O)COc1ccc(C)cc1C	ZINC000819277646	CD	On-Demand	Anodyne	ADRB2	15	48
CSCCONC[C@@H](O)COc1cccc(C)c1	ZINC000819277647	CD	On-Demand	Anodyne	ADRB2	25	60
CSCCONC[C@@H](O)COc1cccc(C)c1	ZINC000819277647	CD	On-Demand	Anodyne	ADRB1	24	60
CSCCONC[C@@H](O)COc1cccc(C)c1	ZINC000819277647	CD	On-Demand	Anodyne	PDS	25	40
CSCCONC[C@H](O)COc1cccc(C)c1	ZINC000819277648	CD	On-Demand	Anodyne	ADRB2	25	60
CSCCONC[C@H](O)COc1cccc(C)c1	ZINC000819277648	CD	On-Demand	Anodyne	ADRB1	24	60
CSCCONC[C@H](O)COc1cccc(C)c1	ZINC000819277648	CD	On-Demand	Anodyne	PDS	25	40
CSCCONC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819277649	CD	On-Demand	Anodyne	ADRB2	28	42
CSCCONC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819277649	CD	On-Demand	Anodyne	ADRB1	33	40
CSCCONC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819277649	CD	On-Demand	Anodyne	GRIN1	25	45
CSCCONC[C@H](O)COc1ccc(Cl)cc1	ZINC000819277650	CD	On-Demand	Anodyne	ADRB2	28	42
CSCCONC[C@H](O)COc1ccc(Cl)cc1	ZINC000819277650	CD	On-Demand	Anodyne	ADRB1	33	40
CSCCONC[C@H](O)COc1ccc(Cl)cc1	ZINC000819277650	CD	On-Demand	Anodyne	GRIN1	25	45
CSCCONC[C@@H](O)c1ccccc1	ZINC000819277683	BD	On-Demand	Anodyne	AOC3	15	46
CSCCONC[C@H](O)c1ccccc1	ZINC000819277684	BD	On-Demand	Anodyne	AOC3	15	46
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819277693	FE	On-Demand	Anodyne	CTSS	18	42
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819277693	FE	On-Demand	Anodyne	EPHX2	41	42
COc1cccc(C[C@H](C)NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819277707	CE	On-Demand	Anodyne	PTAFR	15	41
COc1cccc(C[C@H](C)NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819277708	CE	On-Demand	Anodyne	PTAFR	15	41
COc1cccc(C[C@H](C)NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819277709	CE	On-Demand	Anodyne	PTAFR	15	41
COc1cccc(C[C@H](C)NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819277710	CE	On-Demand	Anodyne	PTAFR	15	41
O=C(Cc1nsc2ccccc12)N1CCC[C@H]1c1ccc(F)c(F)c1	ZINC000819277758	FI	On-Demand	Anodyne	PREP	43	36
O=C(Cc1nsc2ccccc12)N1CCC[C@H]1c1ccc(F)c(F)c1	ZINC000819277758	FI	On-Demand	Anodyne	GRIN2D	67	36
O=C(Cc1nsc2ccccc12)N1CCC[C@@H]1c1ccc(F)c(F)c1	ZINC000819277759	FI	On-Demand	Anodyne	PREP	43	36
O=C(Cc1nsc2ccccc12)N1CCC[C@@H]1c1ccc(F)c(F)c1	ZINC000819277759	FI	On-Demand	Anodyne	GRIN2D	67	36
CN(C[C@@H](O)CN[C@@H]1CCCc2ccc(F)cc21)C(=O)OC(C)(C)C	ZINC000819277768	FG	On-Demand	Anodyne	CTSD	15	48
CN(C[C@H](O)CN[C@@H]1CCCc2ccc(F)cc21)C(=O)OC(C)(C)C	ZINC000819277769	FG	On-Demand	Anodyne	CTSD	15	48
CN(C[C@@H](O)CN[C@H]1CCCc2ccc(F)cc21)C(=O)OC(C)(C)C	ZINC000819277770	FG	On-Demand	Anodyne	CTSD	15	48
CN(C[C@H](O)CN[C@H]1CCCc2ccc(F)cc21)C(=O)OC(C)(C)C	ZINC000819277771	FG	On-Demand	Anodyne	CTSD	15	48
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819277794	GH	On-Demand	Anodyne	ADRB1	19	41
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819277794	GH	On-Demand	Anodyne	ADRB3	32	41
COc1cccc([S@@](=O)CC(=O)NC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819277796	GD	On-Demand	Anodyne	DRD4	40	31
COc1cccc([S@@](=O)CC(=O)NC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819277796	GD	On-Demand	Anodyne	CCR3	17	41
COc1cccc([S@@](=O)CC(=O)NC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819277796	GD	On-Demand	Anodyne	MCHR1	18	43
COc1cccc([S@@](=O)CC(=O)NC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819277797	GD	On-Demand	Anodyne	DRD4	40	31
COc1cccc([S@@](=O)CC(=O)NC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819277797	GD	On-Demand	Anodyne	CCR3	17	41
COc1cccc([S@@](=O)CC(=O)NC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819277797	GD	On-Demand	Anodyne	MCHR1	18	43
O[C@@H](CN[C@@H]1[C@H]2COC[C@H]21)c1cccc(Cl)c1	ZINC000819277805	CD	On-Demand	Anodyne	ADRB1	28	41
O[C@@H](CN[C@@H]1[C@H]2COC[C@H]21)c1cccc(Cl)c1	ZINC000819277805	CD	On-Demand	Anodyne	ADRB3	45	45
O[C@@H](CN[C@@H]1[C@H]2COC[C@H]21)c1cccc(Cl)c1	ZINC000819277805	CD	On-Demand	Anodyne	CYP3A4	45	36
O[C@H](CN[C@@H]1[C@H]2COC[C@H]21)c1cccc(Cl)c1	ZINC000819277806	CD	On-Demand	Anodyne	ADRB1	28	41
O[C@H](CN[C@@H]1[C@H]2COC[C@H]21)c1cccc(Cl)c1	ZINC000819277806	CD	On-Demand	Anodyne	ADRB3	45	45
O[C@H](CN[C@@H]1[C@H]2COC[C@H]21)c1cccc(Cl)c1	ZINC000819277806	CD	On-Demand	Anodyne	CYP3A4	45	36
O[C@@H](CN[C@@H]1[C@H]2COC[C@H]21)c1ccccc1	ZINC000819277855	BC	On-Demand	Anodyne	AOC3	15	47
O[C@H](CN[C@@H]1[C@H]2COC[C@H]21)c1ccccc1	ZINC000819277856	BC	On-Demand	Anodyne	AOC3	15	47
CSCCONC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819277857	CD	On-Demand	Bother	CACNA1D	58	35
CSCCONC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819277858	CD	On-Demand	Bother	CACNA1D	58	35
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819277869	GG	On-Demand	Anodyne	DRD4	18	40
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819277869	GG	On-Demand	Anodyne	CNR2	26	40
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000819277870	GG	On-Demand	Anodyne	DRD4	18	40
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000819277870	GG	On-Demand	Anodyne	CNR2	26	40
O=C(Cc1ccc(-n2cnnc2)cc1)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819277871	FD	On-Demand	Anodyne	SIGMAR1	15	44
O=C(Cc1ccc(-n2cnnc2)cc1)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819277871	FD	On-Demand	Anodyne	MCHR1	19	40
O=C(Cc1ccc(-n2cnnc2)cc1)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000819277872	FD	On-Demand	Anodyne	SIGMAR1	15	44
O=C(Cc1ccc(-n2cnnc2)cc1)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000819277872	FD	On-Demand	Anodyne	MCHR1	19	40
CSCCONC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819277886	DD	On-Demand	Bother	ADRB2	18	40
CSCCONC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819277886	DD	On-Demand	Bother	ADRB1	50	32
CSCCONC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819277887	DD	On-Demand	Bother	ADRB2	18	40
CSCCONC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819277887	DD	On-Demand	Bother	ADRB1	50	32
CN(C)c1ncc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n1C	ZINC000819277915	GD	On-Demand	Mild	PAPA1_CARPA	41	46
CN(C)c1ncc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n1C	ZINC000819277916	GD	On-Demand	Mild	PAPA1_CARPA	41	46
O=C(NCC1CCN(S(=O)(=O)C(F)F)CC1)c1cc2c(cn1)OCCO2	ZINC000819277921	GC	On-Demand	Anodyne	CACNA1I	49	34
COC[C@@H](O)CN[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC000819277930	CD	On-Demand	Anodyne	KDM1A	37	42
CSCCONCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819277944	DF	On-Demand	Anodyne	KCNK3	30	40
CSCCONCCC(=O)Nc1cccnc1	ZINC000819277954	CD	On-Demand	Anodyne	NAMPT	24	41
Cc1ccc(OC[C@@H](O)CNCCC2=CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819277958	GG	On-Demand	Anodyne	ADRB2	42	42
Cc1ccc(OC[C@@H](O)CNCCC2=CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819277958	GG	On-Demand	Anodyne	ADRB1	67	41
Cc1ccc(OC[C@@H](O)CNCCC2=CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819277958	GG	On-Demand	Anodyne	ADRB3	43	41
Cc1ccc(OC[C@@H](O)CNCCC2=CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819277958	GG	On-Demand	Anodyne	ACOX1	58	33
Cc1ccc(OC[C@H](O)CNCCC2=CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819277959	GG	On-Demand	Anodyne	ADRB2	42	42
Cc1ccc(OC[C@H](O)CNCCC2=CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819277959	GG	On-Demand	Anodyne	ADRB1	67	41
Cc1ccc(OC[C@H](O)CNCCC2=CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819277959	GG	On-Demand	Anodyne	ADRB3	43	41
Cc1ccc(OC[C@H](O)CNCCC2=CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819277959	GG	On-Demand	Anodyne	ACOX1	58	33
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)c1coc(=O)c2ccccc12	ZINC000819277971	FE	On-Demand	Anodyne	DRD4	20	44
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)c1coc(=O)c2ccccc12	ZINC000819277971	FE	On-Demand	Anodyne	INHA	35	40
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)c1coc(=O)c2ccccc12	ZINC000819277971	FE	On-Demand	Anodyne	CNR2	21	42
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)c1coc(=O)c2ccccc12	ZINC000819277971	FE	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)c1coc(=O)c2ccccc12	ZINC000819277971	FE	On-Demand	Anodyne	CCR8	65	39
O=C(NC1CCN(C[C@H]2CCCO2)CC1)c1coc(=O)c2ccccc12	ZINC000819277972	FE	On-Demand	Anodyne	DRD4	20	44
O=C(NC1CCN(C[C@H]2CCCO2)CC1)c1coc(=O)c2ccccc12	ZINC000819277972	FE	On-Demand	Anodyne	INHA	35	40
O=C(NC1CCN(C[C@H]2CCCO2)CC1)c1coc(=O)c2ccccc12	ZINC000819277972	FE	On-Demand	Anodyne	CNR2	21	42
O=C(NC1CCN(C[C@H]2CCCO2)CC1)c1coc(=O)c2ccccc12	ZINC000819277972	FE	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(C[C@H]2CCCO2)CC1)c1coc(=O)c2ccccc12	ZINC000819277972	FE	On-Demand	Anodyne	CCR8	65	39
CSCCONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819277973	CD	On-Demand	Anodyne	ADRB2	20	46
CSCCONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819277973	CD	On-Demand	Anodyne	ADRB1	29	41
CSCCONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819277973	CD	On-Demand	Anodyne	ABCB1	16	45
CSCCONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819277973	CD	On-Demand	Anodyne	PDS	61	38
CSCCONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819277974	CD	On-Demand	Anodyne	ADRB2	20	46
CSCCONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819277974	CD	On-Demand	Anodyne	ADRB1	29	41
CSCCONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819277974	CD	On-Demand	Anodyne	ABCB1	16	45
CSCCONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819277974	CD	On-Demand	Anodyne	PDS	61	38
C[C@@H](CC(=O)N1CCC[C@@H]1c1ccc(F)c(F)c1)n1cccn1	ZINC000819277979	DG	On-Demand	Anodyne	DPP4	41	41
C[C@@H](CC(=O)N1CCC[C@@H]1c1ccc(F)c(F)c1)n1cccn1	ZINC000819277979	DG	On-Demand	Anodyne	PREP	47	33
C[C@@H](CC(=O)N1CCC[C@H]1c1ccc(F)c(F)c1)n1cccn1	ZINC000819277981	DG	On-Demand	Anodyne	DPP4	41	41
C[C@@H](CC(=O)N1CCC[C@H]1c1ccc(F)c(F)c1)n1cccn1	ZINC000819277981	DG	On-Demand	Anodyne	PREP	47	33
CSCCONC[C@H](O)COc1ccccc1F	ZINC000819277982	CD	On-Demand	Anodyne	ADRB2	22	45
CSCCONC[C@H](O)COc1ccccc1F	ZINC000819277982	CD	On-Demand	Anodyne	ADRB1	49	36
CSCCONC[C@@H](O)COc1ccccc1F	ZINC000819277984	CD	On-Demand	Anodyne	ADRB2	22	45
CSCCONC[C@@H](O)COc1ccccc1F	ZINC000819277984	CD	On-Demand	Anodyne	ADRB1	49	36
CCOc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2c2ccc(OC)cc2)cc1	ZINC000819278000	FF	On-Demand	Anodyne	ADRB2	30	41
CCOc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2c2ccc(OC)cc2)cc1	ZINC000819278000	FF	On-Demand	Anodyne	ADRB1	31	41
CCOc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2c2ccc(OC)cc2)cc1	ZINC000819278000	FF	On-Demand	Anodyne	ADRB3	17	44
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2c2ccc(OC)cc2)cc1	ZINC000819278002	FF	On-Demand	Anodyne	ADRB2	30	41
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2c2ccc(OC)cc2)cc1	ZINC000819278002	FF	On-Demand	Anodyne	ADRB1	31	41
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2c2ccc(OC)cc2)cc1	ZINC000819278002	FF	On-Demand	Anodyne	ADRB3	17	44
O[C@@H](CNC1CC(N2CCCCC2)C1)c1cccc(Cl)c1	ZINC000819278014	DF	On-Demand	Anodyne	ADRB1	34	45
O[C@@H](CNC1CC(N2CCCCC2)C1)c1cccc(Cl)c1	ZINC000819278014	DF	On-Demand	Anodyne	ADRB3	52	47
O[C@@H](CNC1CC(N2CCCCC2)C1)c1cccc(Cl)c1	ZINC000819278014	DF	On-Demand	Anodyne	IGF1R	29	43
O[C@@H](CNC1CC(N2CCCCC2)C1)c1cccc(Cl)c1	ZINC000819278014	DF	On-Demand	Anodyne	CYP3A4	51	43
O[C@H](CNC1CC(N2CCCCC2)C1)c1cccc(Cl)c1	ZINC000819278016	DF	On-Demand	Anodyne	ADRB1	34	45
O[C@H](CNC1CC(N2CCCCC2)C1)c1cccc(Cl)c1	ZINC000819278016	DF	On-Demand	Anodyne	ADRB3	52	47
O[C@H](CNC1CC(N2CCCCC2)C1)c1cccc(Cl)c1	ZINC000819278016	DF	On-Demand	Anodyne	IGF1R	29	43
O[C@H](CNC1CC(N2CCCCC2)C1)c1cccc(Cl)c1	ZINC000819278016	DF	On-Demand	Anodyne	CYP3A4	51	43
CSCCONC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819278031	DD	On-Demand	Bother	PDS	20	46
CSCCONC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819278033	DD	On-Demand	Bother	PDS	20	46
CSCCONC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819278034	CD	On-Demand	Anodyne	ADRB2	19	63
CSCCONC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819278034	CD	On-Demand	Anodyne	ADRB1	24	63
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H]1c1ccc(F)c(F)c1	ZINC000819278035	FG	On-Demand	Anodyne	HTR1D	35	41
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H]1c1ccc(F)c(F)c1	ZINC000819278035	FG	On-Demand	Anodyne	HTR1B	29	41
CSCCONC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819278036	CD	On-Demand	Anodyne	ADRB2	19	63
CSCCONC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819278036	CD	On-Demand	Anodyne	ADRB1	24	63
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H]1c1ccc(F)c(F)c1	ZINC000819278038	FG	On-Demand	Anodyne	HTR1D	35	41
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H]1c1ccc(F)c(F)c1	ZINC000819278038	FG	On-Demand	Anodyne	HTR1B	29	41
O[C@@H](CNC1CC(N2CCCCC2)C1)c1ccc(Cl)cc1	ZINC000819278045	DF	On-Demand	Anodyne	ADRB3	17	43
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@@H]1c1ccc(F)c(F)c1	ZINC000819278068	GJ	On-Demand	Anodyne	CPT1A	69	39
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@@H]1c1ccc(F)c(F)c1	ZINC000819278068	GJ	On-Demand	Anodyne	PREP	61	38
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@H]1c1ccc(F)c(F)c1	ZINC000819278070	GJ	On-Demand	Anodyne	CPT1A	69	39
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@H]1c1ccc(F)c(F)c1	ZINC000819278070	GJ	On-Demand	Anodyne	PREP	61	38
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819278072	FG	On-Demand	Anodyne	ADRB1	23	44
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819278072	FG	On-Demand	Anodyne	ADRB3	41	44
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819278074	FG	On-Demand	Anodyne	ADRB1	23	44
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819278074	FG	On-Demand	Anodyne	ADRB3	41	44
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCCc2ccccc2F)CC1	ZINC000819278099	GH	On-Demand	Anodyne	GPR119	23	45
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCCc2ccccc2F)CC1	ZINC000819278100	GH	On-Demand	Anodyne	GPR119	23	45
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819278107	EF	On-Demand	Anodyne	ADRB1	30	43
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819278107	EF	On-Demand	Anodyne	ADRB3	61	43
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819278107	EF	On-Demand	Anodyne	NPY5R	33	41
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819278108	EF	On-Demand	Anodyne	ADRB1	30	43
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819278108	EF	On-Demand	Anodyne	ADRB3	61	43
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819278108	EF	On-Demand	Anodyne	NPY5R	33	41
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@@H](c3ccc(Cl)cc3)C2)c1	ZINC000819278114	EH	On-Demand	Bother	CACNA1C	43	36
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@@H](c3ccc(Cl)cc3)C2)c1	ZINC000819278114	EH	On-Demand	Bother	CACNA1D	68	36
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@@H](c3ccc(Cl)cc3)C2)c1	ZINC000819278115	EH	On-Demand	Bother	CACNA1C	43	36
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@@H](c3ccc(Cl)cc3)C2)c1	ZINC000819278115	EH	On-Demand	Bother	CACNA1D	68	36
O[C@@H](CNCCCc1ccccc1F)c1ccccc1	ZINC000819278120	CG	On-Demand	Anodyne	ADRB2	43	43
O[C@@H](CNCCCc1ccccc1F)c1ccccc1	ZINC000819278120	CG	On-Demand	Anodyne	ADRB1	47	43
O[C@@H](CNCCCc1ccccc1F)c1ccccc1	ZINC000819278120	CG	On-Demand	Anodyne	ADRB3	62	44
O[C@H](CNCCCc1ccccc1F)c1ccccc1	ZINC000819278121	CG	On-Demand	Anodyne	ADRB2	43	43
O[C@H](CNCCCc1ccccc1F)c1ccccc1	ZINC000819278121	CG	On-Demand	Anodyne	ADRB1	47	43
O[C@H](CNCCCc1ccccc1F)c1ccccc1	ZINC000819278121	CG	On-Demand	Anodyne	ADRB3	62	44
CN(C)C(=O)Nc1ccc(CNCCC(=O)Nc2ccc(N(C)C)cc2)cc1	ZINC000819278139	GF	On-Demand	Anodyne	LTA4H	24	41
CN(C)CC1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819278144	FE	On-Demand	Mild	PAPA1_CARPA	31	43
CN(C)CC1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819278145	FE	On-Demand	Mild	PAPA1_CARPA	31	43
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccccc1F	ZINC000819278159	FH	On-Demand	Anodyne	ADRB2	56	46
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccccc1F	ZINC000819278159	FH	On-Demand	Anodyne	ADRB1	60	46
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccccc1F	ZINC000819278159	FH	On-Demand	Anodyne	ADRB3	52	46
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccccc1F	ZINC000819278160	FH	On-Demand	Anodyne	ADRB2	56	46
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccccc1F	ZINC000819278160	FH	On-Demand	Anodyne	ADRB1	60	46
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccccc1F	ZINC000819278160	FH	On-Demand	Anodyne	ADRB3	52	46
CSCCONC[C@@H](O)COc1ccc(F)cc1	ZINC000819278208	CD	On-Demand	Anodyne	ADRB2	32	42
CSCCONC[C@@H](O)COc1ccc(F)cc1	ZINC000819278208	CD	On-Demand	Anodyne	ADRB1	41	40
CSCCONC[C@@H](O)COc1ccc(F)cc1	ZINC000819278208	CD	On-Demand	Anodyne	GRIN1	17	45
CSCCONC[C@H](O)COc1ccc(F)cc1	ZINC000819278209	CD	On-Demand	Anodyne	ADRB2	32	42
CSCCONC[C@H](O)COc1ccc(F)cc1	ZINC000819278209	CD	On-Demand	Anodyne	ADRB1	41	40
CSCCONC[C@H](O)COc1ccc(F)cc1	ZINC000819278209	CD	On-Demand	Anodyne	GRIN1	17	45
CSCCONC[C@@H](O)COc1c(C)cccc1C	ZINC000819278214	CD	On-Demand	Anodyne	ADRB2	18	40
CSCCONC[C@H](O)COc1c(C)cccc1C	ZINC000819278215	CD	On-Demand	Anodyne	ADRB2	18	40
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)c2cccnc2)CC1	ZINC000819278224	EF	On-Demand	Anodyne	ADRB2	24	42
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)c2cccnc2)CC1	ZINC000819278224	EF	On-Demand	Anodyne	ADRB1	40	43
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)c2cccnc2)CC1	ZINC000819278224	EF	On-Demand	Anodyne	ADRB3	117	45
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)c2cccnc2)CC1	ZINC000819278225	EF	On-Demand	Anodyne	ADRB2	24	42
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)c2cccnc2)CC1	ZINC000819278225	EF	On-Demand	Anodyne	ADRB1	40	43
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)c2cccnc2)CC1	ZINC000819278225	EF	On-Demand	Anodyne	ADRB3	117	45
CSCCONC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819278250	EF	On-Demand	Anodyne	ADRB2	44	47
CSCCONC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819278250	EF	On-Demand	Anodyne	ADRB1	53	42
CSCCONC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819278250	EF	On-Demand	Anodyne	ADRB3	34	42
CSCCONC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819278251	EF	On-Demand	Anodyne	ADRB2	44	47
CSCCONC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819278251	EF	On-Demand	Anodyne	ADRB1	53	42
CSCCONC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819278251	EF	On-Demand	Anodyne	ADRB3	34	42
CSCCONC[C@@H](O)COc1cccc(Br)c1	ZINC000819278252	EE	On-Demand	Anodyne	ADRB2	15	43
CSCCONC[C@@H](O)COc1cccc(Br)c1	ZINC000819278252	EE	On-Demand	Anodyne	ADRB1	22	43
CSCCONC[C@@H](O)COc1cccc(Br)c1	ZINC000819278252	EE	On-Demand	Anodyne	PDS	42	42
CSCCONC[C@H](O)COc1cccc(Br)c1	ZINC000819278253	EE	On-Demand	Anodyne	ADRB2	15	43
CSCCONC[C@H](O)COc1cccc(Br)c1	ZINC000819278253	EE	On-Demand	Anodyne	ADRB1	22	43
CSCCONC[C@H](O)COc1cccc(Br)c1	ZINC000819278253	EE	On-Demand	Anodyne	PDS	42	42
CSCCONCCC(=O)Nc1ccccc1	ZINC000819278278	CD	On-Demand	Anodyne	HDAC10	15	43
CSCCONCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819278297	EF	On-Demand	Anodyne	CYNT	44	50
CSCCONC[C@H](O)COc1ccccc1Cl	ZINC000819278322	CD	On-Demand	Anodyne	ADRB2	23	48
CSCCONC[C@@H](O)COc1ccccc1Cl	ZINC000819278323	CD	On-Demand	Anodyne	ADRB2	23	48
CC(=O)Nc1cccc(CC(=O)NCCCSc2nccs2)c1	ZINC000819278379	EF	On-Demand	Clean	MAP1	43	36
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCCc3ccc(F)cc32)CC1	ZINC000819278386	GH	On-Demand	Anodyne	GPR119	39	51
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCCc3ccc(F)cc32)CC1	ZINC000819278387	GH	On-Demand	Anodyne	GPR119	39	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCCc3ccc(F)cc32)CC1	ZINC000819278388	GH	On-Demand	Anodyne	GPR119	39	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCCc3ccc(F)cc32)CC1	ZINC000819278389	GH	On-Demand	Anodyne	GPR119	39	51
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(Cl)cc2)C1)c1ccc(F)cc1	ZINC000819278407	DI	On-Demand	Anodyne	SLC6A3	15	45
O[C@H](CN[C@@H]1C[C@@H](c2ccc(Cl)cc2)C1)c1ccc(F)cc1	ZINC000819278408	DI	On-Demand	Anodyne	SLC6A3	15	45
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819278469	JK	On-Demand	Anodyne	CA2	18	44
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819278469	JK	On-Demand	Anodyne	LPL	50	42
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819278469	JK	On-Demand	Anodyne	PLA2G7	33	49
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819278469	JK	On-Demand	Anodyne	CA1	58	44
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819278469	JK	On-Demand	Anodyne	PYGL	47	40
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819278469	JK	On-Demand	Anodyne	CA12	30	45
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819278469	JK	On-Demand	Anodyne	CA9	32	44
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819278469	JK	On-Demand	Anodyne	NCE103	25	42
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819278469	JK	On-Demand	Anodyne	LIPG	17	42
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819278469	JK	On-Demand	Anodyne	KCNK3	123	43
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819278469	JK	On-Demand	Anodyne	KCNK9	86	42
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cc2ccccc2o1	ZINC000819278479	GI	On-Demand	Anodyne	ADRB2	32	42
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cc2ccccc2o1	ZINC000819278479	GI	On-Demand	Anodyne	ADRB1	40	38
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cc2ccccc2o1	ZINC000819278479	GI	On-Demand	Anodyne	ADRB3	40	40
O[C@H](CN[C@@H]1CC[C@@H](c2cccc(F)c2)C1)c1ccc(F)cc1	ZINC000819278484	DH	On-Demand	Anodyne	SLC6A3	15	52
O[C@H](CN[C@H]1CC[C@@H](c2cccc(F)c2)C1)c1ccc(F)cc1	ZINC000819278485	DH	On-Demand	Anodyne	SLC6A3	15	52
O[C@H](CN[C@@H]1CC[C@H](c2cccc(F)c2)C1)c1ccc(F)cc1	ZINC000819278486	DH	On-Demand	Anodyne	SLC6A3	15	52
O[C@H](CN[C@H]1CC[C@H](c2cccc(F)c2)C1)c1ccc(F)cc1	ZINC000819278487	DH	On-Demand	Anodyne	SLC6A3	15	52
O[C@H](CN[C@@H]1C[C@H]1c1cnn(-c2ccccc2)c1)c1cccnc1	ZINC000819278527	DE	On-Demand	Anodyne	ADRB3	46	38
O[C@@H](CN[C@@H]1C[C@H]1c1cnn(-c2ccccc2)c1)c1cccnc1	ZINC000819278528	DE	On-Demand	Anodyne	ADRB3	46	38
O[C@@H](CNC1CC(N2CCCCC2)C1)c1cccnc1	ZINC000819278535	CD	On-Demand	Anodyne	ADRB1	21	41
O[C@@H](CNC1CC(N2CCCCC2)C1)c1cccnc1	ZINC000819278535	CD	On-Demand	Anodyne	ADRB3	77	47
O[C@H](CNC1CC(N2CCCCC2)C1)c1cccnc1	ZINC000819278536	CD	On-Demand	Anodyne	ADRB1	21	41
O[C@H](CNC1CC(N2CCCCC2)C1)c1cccnc1	ZINC000819278536	CD	On-Demand	Anodyne	ADRB3	77	47
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)COc2ccccc2F)CC1	ZINC000819278539	GG	On-Demand	Anodyne	ADRB1	49	39
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)COc2ccccc2F)CC1	ZINC000819278539	GG	On-Demand	Anodyne	ABCB1	34	43
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)COc2ccccc2F)CC1	ZINC000819278540	GG	On-Demand	Anodyne	ADRB1	49	39
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)COc2ccccc2F)CC1	ZINC000819278540	GG	On-Demand	Anodyne	ABCB1	34	43
O[C@@H](CNC1CC(N2CCCCC2)C1)c1ccccc1	ZINC000819278546	CE	On-Demand	Anodyne	SLC6A3	19	52
O[C@H](CNC1CC(N2CCCCC2)C1)c1ccccc1	ZINC000819278547	CE	On-Demand	Anodyne	SLC6A3	19	52
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)COc2ccccc2)CC1	ZINC000819278550	GF	On-Demand	Anodyne	ADRB2	49	44
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)COc2ccccc2)CC1	ZINC000819278550	GF	On-Demand	Anodyne	ADRB1	82	45
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)COc2ccccc2)CC1	ZINC000819278550	GF	On-Demand	Anodyne	ADRB3	56	45
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)COc2ccccc2)CC1	ZINC000819278550	GF	On-Demand	Anodyne	ACOX1	45	34
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)COc2ccccc2)CC1	ZINC000819278550	GF	On-Demand	Anodyne	ABCB1	29	41
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)COc2ccccc2)CC1	ZINC000819278551	GF	On-Demand	Anodyne	ADRB2	49	44
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)COc2ccccc2)CC1	ZINC000819278551	GF	On-Demand	Anodyne	ADRB1	82	45
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)COc2ccccc2)CC1	ZINC000819278551	GF	On-Demand	Anodyne	ADRB3	56	45
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)COc2ccccc2)CC1	ZINC000819278551	GF	On-Demand	Anodyne	ACOX1	45	34
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)COc2ccccc2)CC1	ZINC000819278551	GF	On-Demand	Anodyne	ABCB1	29	41
CC(=O)Nc1cccc(CC(=O)NC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819278554	FD	On-Demand	Anodyne	DRD4	27	41
CC(=O)Nc1cccc(CC(=O)NC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819278554	FD	On-Demand	Anodyne	SIGMAR1	19	48
CC(=O)Nc1cccc(CC(=O)NC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819278554	FD	On-Demand	Anodyne	CCR3	48	42
CC(=O)Nc1cccc(CC(=O)NC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819278554	FD	On-Demand	Anodyne	CCR2	17	40
CC(=O)Nc1cccc(CC(=O)NC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819278554	FD	On-Demand	Anodyne	EPHX2	22	41
CC(=O)Nc1cccc(CC(=O)NC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000819278554	FD	On-Demand	Anodyne	MCHR1	45	46
CC(=O)Nc1cccc(CC(=O)NC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819278555	FD	On-Demand	Anodyne	DRD4	27	41
CC(=O)Nc1cccc(CC(=O)NC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819278555	FD	On-Demand	Anodyne	SIGMAR1	19	48
CC(=O)Nc1cccc(CC(=O)NC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819278555	FD	On-Demand	Anodyne	CCR3	48	42
CC(=O)Nc1cccc(CC(=O)NC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819278555	FD	On-Demand	Anodyne	CCR2	17	40
CC(=O)Nc1cccc(CC(=O)NC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819278555	FD	On-Demand	Anodyne	EPHX2	22	41
CC(=O)Nc1cccc(CC(=O)NC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000819278555	FD	On-Demand	Anodyne	MCHR1	45	46
CSCCONC[C@@H](O)COc1ccc(Br)cc1	ZINC000819278556	EE	On-Demand	Anodyne	ADRB2	25	42
CSCCONC[C@@H](O)COc1ccc(Br)cc1	ZINC000819278556	EE	On-Demand	Anodyne	ADRB1	31	40
CSCCONC[C@H](O)COc1ccc(Br)cc1	ZINC000819278557	EE	On-Demand	Anodyne	ADRB2	25	42
CSCCONC[C@H](O)COc1ccc(Br)cc1	ZINC000819278557	EE	On-Demand	Anodyne	ADRB1	31	40
O[C@@H](CNC1CC(N2CCCCC2)C1)c1ccc(F)cc1	ZINC000819278560	CE	On-Demand	Anodyne	SLC6A3	22	50
O[C@H](CNC1CC(N2CCCCC2)C1)c1ccc(F)cc1	ZINC000819278561	CE	On-Demand	Anodyne	SLC6A3	22	50
O[C@H](CN[C@@H]1[C@H]2COC[C@H]21)c1cccnc1	ZINC000819278562	BC	On-Demand	Anodyne	ADRB3	73	43
O[C@@H](CN[C@@H]1[C@H]2COC[C@H]21)c1cccnc1	ZINC000819278563	BC	On-Demand	Anodyne	ADRB3	73	43
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)c2ccccc2F)CC1	ZINC000819278566	FG	On-Demand	Anodyne	GPR119	15	41
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)c2ccccc2F)CC1	ZINC000819278567	FG	On-Demand	Anodyne	GPR119	15	41
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819278694	EF	On-Demand	Anodyne	CACNA1B	41	34
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819278694	EF	On-Demand	Anodyne	CCR2	95	42
CC(=O)N1CCC[C@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819278695	EF	On-Demand	Anodyne	CACNA1B	41	34
CC(=O)N1CCC[C@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819278695	EF	On-Demand	Anodyne	CCR2	95	42
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819278698	EF	On-Demand	Anodyne	CACNA1B	41	34
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819278698	EF	On-Demand	Anodyne	CCR2	95	42
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819278702	EF	On-Demand	Anodyne	CACNA1B	41	34
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819278702	EF	On-Demand	Anodyne	CCR2	95	42
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819278711	DD	On-Demand	Anodyne	CCR3	69	39
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819278714	DD	On-Demand	Anodyne	CCR3	69	39
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819278718	DD	On-Demand	Anodyne	CCR3	69	39
Cc1cc(F)ccc1[C@@H](O)CNCCCc1ccccc1F	ZINC000819278720	DH	On-Demand	Anodyne	ADRB2	41	42
Cc1cc(F)ccc1[C@@H](O)CNCCCc1ccccc1F	ZINC000819278720	DH	On-Demand	Anodyne	ADRB1	24	42
Cc1cc(F)ccc1[C@@H](O)CNCCCc1ccccc1F	ZINC000819278720	DH	On-Demand	Anodyne	LEF	68	38
CC(=O)N1CCC[C@H](CNC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819278721	DD	On-Demand	Anodyne	CCR3	69	39
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819278727	GH	On-Demand	Anodyne	UL54	41	31
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2ccc(Cl)cc2Cl)cc1	ZINC000819278729	GH	On-Demand	Anodyne	UL54	41	31
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccccc1	ZINC000819278756	EG	On-Demand	Anodyne	ADRB2	85	52
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccccc1	ZINC000819278756	EG	On-Demand	Anodyne	ADRB1	103	51
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccccc1	ZINC000819278756	EG	On-Demand	Anodyne	ADRB3	141	53
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccccc1	ZINC000819278756	EG	On-Demand	Anodyne	PDS	47	39
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccccc1	ZINC000819278757	EG	On-Demand	Anodyne	ADRB2	85	52
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccccc1	ZINC000819278757	EG	On-Demand	Anodyne	ADRB1	103	51
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccccc1	ZINC000819278757	EG	On-Demand	Anodyne	ADRB3	141	53
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccccc1	ZINC000819278757	EG	On-Demand	Anodyne	PDS	47	39
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819278760	GH	On-Demand	Anodyne	ADRB3	46	39
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819278760	GH	On-Demand	Anodyne	CCR2	32	42
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819278762	GH	On-Demand	Anodyne	ADRB3	46	39
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819278762	GH	On-Demand	Anodyne	CCR2	32	42
O[C@@H](CNCCCc1ccccc1F)c1ccc(F)cc1	ZINC000819278772	CG	On-Demand	Anodyne	ADRB2	54	44
O[C@@H](CNCCCc1ccccc1F)c1ccc(F)cc1	ZINC000819278772	CG	On-Demand	Anodyne	ADRB1	36	44
O[C@H](CNCCCc1ccccc1F)c1ccc(F)cc1	ZINC000819278773	CG	On-Demand	Anodyne	ADRB2	54	44
O[C@H](CNCCCc1ccccc1F)c1ccc(F)cc1	ZINC000819278773	CG	On-Demand	Anodyne	ADRB1	36	44
O[C@H](CN[C@@H]1C[C@@H](c2ccc(Cl)cc2)C1)c1ccc(F)c(F)c1	ZINC000819278778	EI	On-Demand	Anodyne	ADRB3	20	42
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(Cl)cc2)C1)c1ccc(F)c(F)c1	ZINC000819278779	EI	On-Demand	Anodyne	ADRB3	20	42
COc1ccc(OC)c([C@H](O)CNCCCc2ccccc2F)c1	ZINC000819278783	EG	On-Demand	Anodyne	ADRB2	42	48
COc1ccc(OC)c([C@H](O)CNCCCc2ccccc2F)c1	ZINC000819278783	EG	On-Demand	Anodyne	ADRB1	31	40
COc1ccc(OC)c([C@H](O)CNCCCc2ccccc2F)c1	ZINC000819278783	EG	On-Demand	Anodyne	MTNR1A	23	40
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819278786	FF	On-Demand	Bother	ADRB3	45	39
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819278786	FF	On-Demand	Bother	CACNA1D	54	33
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819278787	FF	On-Demand	Bother	ADRB3	45	39
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819278787	FF	On-Demand	Bother	CACNA1D	54	33
COc1cccc(C[C@@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819278788	CG	On-Demand	Anodyne	MTNR1A	35	44
COc1cccc(C[C@@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819278788	CG	On-Demand	Anodyne	MTNR1B	38	44
COc1cccc(C[C@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819278791	CG	On-Demand	Anodyne	MTNR1A	35	44
COc1cccc(C[C@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819278791	CG	On-Demand	Anodyne	MTNR1B	38	44
C#CCN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819278792	ED	On-Demand	Mild	PAPA1_CARPA	32	42
COc1cccc([S@@](=O)CC(=O)NC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819278799	GD	On-Demand	Anodyne	MTNR1A	24	46
COc1cccc([S@@](=O)CC(=O)NC2CCN(C(=O)OC(C)C)CC2)c1	ZINC000819278799	GD	On-Demand	Anodyne	MTNR1B	32	46
C#CCN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819278802	ED	On-Demand	Mild	PAPA1_CARPA	32	42
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	PPIA	38	42
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	LPL	43	33
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	MAPK14	22	42
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	TRPV1	30	43
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	CCKAR	19	47
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	CPT1A	44	30
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	PRNP	42	43
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	RAF1	24	42
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	KDR	19	42
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	ROCK2	28	44
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	NR1H4	18	43
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	HDAC1	33	48
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	HDAC2	29	48
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	HDAC6	15	41
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	CCKBR	19	47
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	EPHX2	20	41
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	F7	15	40
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	FLT3	18	46
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	TAAR1	48	41
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	SMO	17	43
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	NOD2	41	34
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	NAMPT	28	47
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	KCNK3	131	45
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	KCNK9	87	44
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1	ZINC000819278823	JK	On-Demand	Anodyne	PDS	62	34
CSCCONC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819278830	CD	On-Demand	Anodyne	ADRB2	27	44
CSCCONC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819278830	CD	On-Demand	Anodyne	ADRB1	46	43
CSCCONC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819278832	CD	On-Demand	Anodyne	ADRB2	27	44
CSCCONC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819278832	CD	On-Demand	Anodyne	ADRB1	46	43
CSCCONC[C@@H](O)COc1ccc(C)cc1	ZINC000819278850	CD	On-Demand	Anodyne	ADRB2	30	56
CSCCONC[C@@H](O)COc1ccc(C)cc1	ZINC000819278850	CD	On-Demand	Anodyne	ADRB1	35	41
CSCCONC[C@@H](O)COc1ccc(C)cc1	ZINC000819278850	CD	On-Demand	Anodyne	ADRB3	15	40
CSCCONC[C@H](O)COc1ccc(C)cc1	ZINC000819278851	CD	On-Demand	Anodyne	ADRB2	30	56
CSCCONC[C@H](O)COc1ccc(C)cc1	ZINC000819278851	CD	On-Demand	Anodyne	ADRB1	35	41
CSCCONC[C@H](O)COc1ccc(C)cc1	ZINC000819278851	CD	On-Demand	Anodyne	ADRB3	15	40
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc(OCC(F)(F)F)c1	ZINC000819278853	FH	On-Demand	Anodyne	ADRB2	55	44
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc(OCC(F)(F)F)c1	ZINC000819278853	FH	On-Demand	Anodyne	ADRB1	51	44
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc(OCC(F)(F)F)c1	ZINC000819278853	FH	On-Demand	Anodyne	ADRB3	38	43
O[C@@H](CNCCCc1ccccc1F)c1ccc(F)c(F)c1	ZINC000819278859	DG	On-Demand	Anodyne	ADRB2	53	42
O[C@@H](CNCCCc1ccccc1F)c1ccc(F)c(F)c1	ZINC000819278859	DG	On-Demand	Anodyne	ADRB1	40	42
O[C@@H](CNCCCc1ccccc1F)c1ccc(F)c(F)c1	ZINC000819278859	DG	On-Demand	Anodyne	ADRB3	46	42
O[C@H](CNCCCc1ccccc1F)c1ccc(F)c(F)c1	ZINC000819278861	DG	On-Demand	Anodyne	ADRB2	53	42
O[C@H](CNCCCc1ccccc1F)c1ccc(F)c(F)c1	ZINC000819278861	DG	On-Demand	Anodyne	ADRB1	40	42
O[C@H](CNCCCc1ccccc1F)c1ccc(F)c(F)c1	ZINC000819278861	DG	On-Demand	Anodyne	ADRB3	46	42
CS(=O)(=O)c1ccc([C@@H](O)CNC2CC(N3CCCCC3)C2)cc1	ZINC000819278871	FD	On-Demand	Anodyne	ADRB3	16	41
CS(=O)(=O)c1ccc([C@H](O)CNC2CC(N3CCCCC3)C2)cc1	ZINC000819278873	FD	On-Demand	Anodyne	ADRB3	16	41
CSCCONC[C@@H](O)c1cccc(Cl)c1	ZINC000819278875	CE	On-Demand	Anodyne	ADRB1	33	41
CSCCONC[C@@H](O)c1cccc(Cl)c1	ZINC000819278875	CE	On-Demand	Anodyne	ADRB3	44	43
CSCCONC[C@H](O)c1cccc(Cl)c1	ZINC000819278876	CE	On-Demand	Anodyne	ADRB1	33	41
CSCCONC[C@H](O)c1cccc(Cl)c1	ZINC000819278876	CE	On-Demand	Anodyne	ADRB3	44	43
CC[C@H](O)CN[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC000819278879	BD	On-Demand	Anodyne	KDM1A	31	40
CSCCONC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819278882	DD	On-Demand	Anodyne	ADRB2	39	60
CSCCONC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819278882	DD	On-Demand	Anodyne	ADRB1	72	60
CSCCONC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819278882	DD	On-Demand	Anodyne	ADRB3	45	52
CSCCONC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819278885	DD	On-Demand	Anodyne	ADRB2	39	60
CSCCONC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819278885	DD	On-Demand	Anodyne	ADRB1	72	60
CSCCONC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819278885	DD	On-Demand	Anodyne	ADRB3	45	52
CSCCONC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819278904	EE	On-Demand	Anodyne	PDS	54	44
CSCCONC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819278907	EE	On-Demand	Anodyne	PDS	54	44
COCCS(=O)(=O)CC(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819278917	HF	On-Demand	Anodyne	CPT1A	53	31
CSCCONC[C@H](O)c1cccnc1	ZINC000819278921	BC	On-Demand	Anodyne	ADRB2	18	44
CSCCONC[C@H](O)c1cccnc1	ZINC000819278921	BC	On-Demand	Anodyne	ADRB1	21	44
CSCCONC[C@H](O)c1cccnc1	ZINC000819278921	BC	On-Demand	Anodyne	ADRB3	81	44
CSCCONC[C@@H](O)c1cccnc1	ZINC000819278922	BC	On-Demand	Anodyne	ADRB2	18	44
CSCCONC[C@@H](O)c1cccnc1	ZINC000819278922	BC	On-Demand	Anodyne	ADRB1	21	44
CSCCONC[C@@H](O)c1cccnc1	ZINC000819278922	BC	On-Demand	Anodyne	ADRB3	81	44
CSCCONC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819278929	EE	On-Demand	Anodyne	ADRB2	21	43
CSCCONC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819278932	EE	On-Demand	Anodyne	ADRB2	21	43
CSCCONC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819278941	EF	On-Demand	Anodyne	ADRB2	21	40
CSCCONC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819278941	EF	On-Demand	Anodyne	GRIN1	30	44
CSCCONC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819278943	EF	On-Demand	Anodyne	ADRB2	21	40
CSCCONC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819278943	EF	On-Demand	Anodyne	GRIN1	30	44
CSCCONCCC(=O)Nc1cccc(Br)c1	ZINC000819278947	EF	On-Demand	Anodyne	EGFR	24	41
CSCCONCCC(=O)Nc1cccc(Br)c1	ZINC000819278947	EF	On-Demand	Anodyne	HDAC10	21	42
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819278970	GH	On-Demand	Anodyne	ADRB1	48	49
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819278970	GH	On-Demand	Anodyne	ADRB3	69	49
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819278972	GH	On-Demand	Anodyne	ADRB1	48	49
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819278972	GH	On-Demand	Anodyne	ADRB3	69	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2COC[C@H]21	ZINC000819278973	FD	On-Demand	Anodyne	CTSD	113	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2COC[C@H]21	ZINC000819278973	FD	On-Demand	Anodyne	PGC	61	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2COC[C@H]21	ZINC000819278973	FD	On-Demand	Anodyne	PAPA1_CARPA	34	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2COC[C@H]21	ZINC000819278973	FD	On-Demand	Anodyne	CTSL	16	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2COC[C@H]21	ZINC000819278973	FD	On-Demand	Anodyne	PGA	46	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2COC[C@H]21	ZINC000819278973	FD	On-Demand	Anodyne	BACE2	53	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2COC[C@H]21	ZINC000819278973	FD	On-Demand	Anodyne	TACR3	15	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2COC[C@H]21	ZINC000819278973	FD	On-Demand	Anodyne	REN	85	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2COC[C@H]21	ZINC000819278973	FD	On-Demand	Anodyne	REN1	23	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2COC[C@H]21	ZINC000819278973	FD	On-Demand	Anodyne	BACE1	86	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2COC[C@H]21	ZINC000819278973	FD	On-Demand	Anodyne	FPR1	52	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2COC[C@H]21	ZINC000819278973	FD	On-Demand	Anodyne	PLM1_PLAFA	31	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1[C@H]2COC[C@H]21	ZINC000819278973	FD	On-Demand	Anodyne	Q82323_9DELA	53	30
C=C(C)C(C)(C)C(=O)NCC1CCN(S(=O)(=O)C(F)F)CC1	ZINC000819278989	ED	On-Demand	Mild	CACNA1I	45	31
O=C(Nc1nc2ccc(Cl)cc2n1Cc1ccccc1)C1(O)CCOCC1	ZINC000819278992	GG	On-Demand	Anodyne	TBXA2R	15	41
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000819278994	GG	On-Demand	Anodyne	ADRB2	41	41
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000819278994	GG	On-Demand	Anodyne	ADRB1	73	43
CC(C)(C)OC(=O)N1CC=C(CCNC[C@@H](O)COc2ccc(F)cc2)CC1	ZINC000819278994	GG	On-Demand	Anodyne	ADRB3	45	43
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000819278995	GG	On-Demand	Anodyne	ADRB2	41	41
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000819278995	GG	On-Demand	Anodyne	ADRB1	73	43
CC(C)(C)OC(=O)N1CC=C(CCNC[C@H](O)COc2ccc(F)cc2)CC1	ZINC000819278995	GG	On-Demand	Anodyne	ADRB3	45	43
O=C(Nc1nc2ccc(Cl)cc2n1Cc1ccccc1)c1ccc[n+]([O-])c1	ZINC000819279023	GH	On-Demand	Anodyne	CPT1A	53	32
CSCCONC[C@@H](O)COc1ccccc1C(C)C	ZINC000819279025	CE	On-Demand	Anodyne	ADRB2	28	51
CSCCONC[C@@H](O)COc1ccccc1C(C)C	ZINC000819279025	CE	On-Demand	Anodyne	ABCB1	20	40
CSCCONC[C@H](O)COc1ccccc1C(C)C	ZINC000819279028	CE	On-Demand	Anodyne	ADRB2	28	51
CSCCONC[C@H](O)COc1ccccc1C(C)C	ZINC000819279028	CE	On-Demand	Anodyne	ABCB1	20	40
O=C(Nc1nc2ccc(Cl)cc2n1Cc1ccccc1)c1cc[n+]([O-])cc1	ZINC000819279033	GH	On-Demand	Anodyne	ITK	22	41
O=C(CC1OCCCO1)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819279034	GH	On-Demand	Anodyne	TBXA2R	20	41
O=C(Nc1nc2ccc(Cl)cc2n1Cc1ccccc1)c1ccc2nnc(S)n2c1	ZINC000819279068	II	On-Demand	Anodyne	ITK	22	41
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819279094	CD	On-Demand	Anodyne	CCR3	94	37
CC(=O)N1CCC[C@@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819279094	CD	On-Demand	Anodyne	LEF	22	42
CC(=O)N1CCC[C@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819279095	CD	On-Demand	Anodyne	CCR3	94	37
CC(=O)N1CCC[C@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819279095	CD	On-Demand	Anodyne	LEF	22	42
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819279096	CD	On-Demand	Anodyne	CCR3	94	37
CC(=O)N1CCC[C@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819279096	CD	On-Demand	Anodyne	LEF	22	42
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819279097	CD	On-Demand	Anodyne	CCR3	94	37
CC(=O)N1CCC[C@@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819279097	CD	On-Demand	Anodyne	LEF	22	42
O=C(Cc1nsc2ccccc12)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000819279119	FF	On-Demand	Anodyne	SIGMAR1	15	40
O=C(Cc1nsc2ccccc12)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000819279120	FF	On-Demand	Anodyne	SIGMAR1	15	40
CSCCONC[C@@H](O)COc1ccccc1C	ZINC000819279134	CD	On-Demand	Anodyne	ADRB2	28	58
CSCCONC[C@H](O)COc1ccccc1C	ZINC000819279135	CD	On-Demand	Anodyne	ADRB2	28	58
CSCCONC[C@H](O)COc1ccc2ccccc2c1	ZINC000819279159	DE	On-Demand	Anodyne	ADRB2	32	60
CSCCONC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819279161	DE	On-Demand	Anodyne	ADRB2	32	60
C#CCN1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819279186	DC	On-Demand	Mild	HTR1D	40	39
C#CCN1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819279186	DC	On-Demand	Mild	KCNJ1	71	50
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cc(F)ccc1F	ZINC000819279191	GH	On-Demand	Anodyne	ADRB2	41	41
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cc(F)ccc1F	ZINC000819279191	GH	On-Demand	Anodyne	ADRB1	47	47
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cc(F)ccc1F	ZINC000819279191	GH	On-Demand	Anodyne	ADRB3	40	47
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cc(F)ccc1F	ZINC000819279194	GH	On-Demand	Anodyne	ADRB2	41	41
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cc(F)ccc1F	ZINC000819279194	GH	On-Demand	Anodyne	ADRB1	47	47
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cc(F)ccc1F	ZINC000819279194	GH	On-Demand	Anodyne	ADRB3	40	47
O=C(COc1ccc(C2SCCCS2)cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819279198	JK	On-Demand	Anodyne	ADORA2B	22	40
O=C(COc1ccc(C2SCCCS2)cc1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819279198	JK	On-Demand	Anodyne	HIF1A	16	47
CSCCONC[C@H](O)CN1CCc2ccccc2C1	ZINC000819279206	CD	On-Demand	Anodyne	NOD2	40	35
CSCCONC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819279208	CD	On-Demand	Anodyne	NOD2	40	35
O[C@@H](CNCCCc1ccccc1F)c1c(F)cccc1F	ZINC000819279213	DG	On-Demand	Anodyne	ADRB2	16	40
O[C@H](CNCCCc1ccccc1F)c1c(F)cccc1F	ZINC000819279214	DG	On-Demand	Anodyne	ADRB2	16	40
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)n(C)c1	ZINC000819279217	JH	On-Demand	Anodyne	LPL	41	37
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)n(C)c1	ZINC000819279217	JH	On-Demand	Anodyne	CPT1A	43	30
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)n(C)c1	ZINC000819279217	JH	On-Demand	Anodyne	CA12	15	43
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)n(C)c1	ZINC000819279217	JH	On-Demand	Anodyne	KCNK3	112	39
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)n(C)c1	ZINC000819279217	JH	On-Demand	Anodyne	KCNK9	78	38
O[C@@H](CNC1CC(N2CCCCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819279223	EG	On-Demand	Anodyne	TACR1	21	43
O[C@H](CNC1CC(N2CCCCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819279226	EG	On-Demand	Anodyne	TACR1	21	43
CSCCONCCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000819279231	CD	On-Demand	Bother	COLA	46	33
C[C@@H](NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819279233	GG	On-Demand	Anodyne	PDF	47	44
C[C@@H](NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819279233	GG	On-Demand	Anodyne	CTSK	20	55
C[C@@H](NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819279233	GG	On-Demand	Anodyne	ECE1	22	41
C[C@@H](NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819279233	GG	On-Demand	Anodyne	REN	46	43
C[C@@H](NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819279238	GG	On-Demand	Anodyne	PDF	47	44
C[C@@H](NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819279238	GG	On-Demand	Anodyne	CTSK	20	55
C[C@@H](NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819279238	GG	On-Demand	Anodyne	ECE1	22	41
C[C@@H](NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C)C(=O)N(C)C	ZINC000819279238	GG	On-Demand	Anodyne	REN	46	43
C=C(C)C(C)(C)C(=O)Nc1ccc(N2C(=O)CCC2=O)c(C)c1	ZINC000819279240	DG	On-Demand	Mild	NPY2R	29	40
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819279243	EF	On-Demand	Anodyne	ADRB2	15	40
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819279243	EF	On-Demand	Anodyne	NPY5R	29	42
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819279245	EF	On-Demand	Anodyne	ADRB2	15	40
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819279245	EF	On-Demand	Anodyne	NPY5R	29	42
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819279277	GG	On-Demand	Anodyne	ADRB3	52	41
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819279277	GG	On-Demand	Anodyne	NPY5R	31	40
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819279284	GG	On-Demand	Anodyne	ADRB3	52	41
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819279284	GG	On-Demand	Anodyne	NPY5R	31	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2ccccc2F)c1	ZINC000819279290	DF	On-Demand	Bother	ADRB1	40	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2ccccc2F)c1	ZINC000819279290	DF	On-Demand	Bother	ADRB3	51	40
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2ccccc2F)c1	ZINC000819279292	DF	On-Demand	Bother	ADRB1	40	40
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2ccccc2F)c1	ZINC000819279292	DF	On-Demand	Bother	ADRB3	51	40
CSCCONC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819279303	DF	On-Demand	Anodyne	ADRB2	25	41
CSCCONC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819279305	DF	On-Demand	Anodyne	ADRB2	25	41
COc1cccc([S@@](=O)CC(=O)N2CCC[C@@H]2c2ccc(F)c(F)c2)c1	ZINC000819279307	GG	On-Demand	Anodyne	CPT1A	62	38
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819279309	GE	On-Demand	Anodyne	ADRB3	45	37
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819279311	GE	On-Demand	Anodyne	ADRB3	45	37
COc1cccc([S@](=O)CC(=O)N2CCC[C@H]2c2ccc(F)c(F)c2)c1	ZINC000819279312	GG	On-Demand	Anodyne	CPT1A	62	38
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccccc2OCc2cn3ccccc3n2)c1	ZINC000819279314	JK	On-Demand	Anodyne	PPIA	47	43
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccccc2OCc2cn3ccccc3n2)c1	ZINC000819279314	JK	On-Demand	Anodyne	KDR	20	43
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccccc2OCc2cn3ccccc3n2)c1	ZINC000819279314	JK	On-Demand	Anodyne	KCNK3	92	48
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccccc2OCc2cn3ccccc3n2)c1	ZINC000819279314	JK	On-Demand	Anodyne	KCNK9	72	48
COc1cccc([S@@](=O)CC(=O)N2CCC[C@H]2c2ccc(F)c(F)c2)c1	ZINC000819279316	GG	On-Demand	Anodyne	CPT1A	62	38
COc1cccc([S@](=O)CC(=O)N2CCC[C@@H]2c2ccc(F)c(F)c2)c1	ZINC000819279319	GG	On-Demand	Anodyne	CPT1A	62	38
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2ccccc2F)cc1	ZINC000819279322	FE	On-Demand	Anodyne	ADRB2	52	46
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2ccccc2F)cc1	ZINC000819279322	FE	On-Demand	Anodyne	ADRB1	35	41
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2ccccc2F)cc1	ZINC000819279322	FE	On-Demand	Anodyne	ADRB3	87	41
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2ccccc2F)cc1	ZINC000819279322	FE	On-Demand	Anodyne	CTSF	47	32
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2ccccc2F)cc1	ZINC000819279324	FE	On-Demand	Anodyne	ADRB2	52	46
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2ccccc2F)cc1	ZINC000819279324	FE	On-Demand	Anodyne	ADRB1	35	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2ccccc2F)cc1	ZINC000819279324	FE	On-Demand	Anodyne	ADRB3	87	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2ccccc2F)cc1	ZINC000819279324	FE	On-Demand	Anodyne	CTSF	47	32
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2CC(N3CCCCC3)C2)CC1	ZINC000819279329	GF	On-Demand	Anodyne	GPR119	24	42
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2c2ccc(F)c(F)c2)c1	ZINC000819279331	FH	On-Demand	Anodyne	TSHR	50	36
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2c2ccc(F)c(F)c2)c1	ZINC000819279331	FH	On-Demand	Anodyne	CCR3	41	35
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2c2ccc(F)c(F)c2)c1	ZINC000819279331	FH	On-Demand	Anodyne	CPT1A	20	42
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2c2ccc(F)c(F)c2)c1	ZINC000819279331	FH	On-Demand	Anodyne	PREP	44	34
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2c2ccc(F)c(F)c2)c1	ZINC000819279331	FH	On-Demand	Anodyne	MCHR1	34	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2CC(N3CCCCC3)C2)CC1	ZINC000819279332	GF	On-Demand	Anodyne	GPR119	24	42
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2c2ccc(F)c(F)c2)c1	ZINC000819279335	FH	On-Demand	Anodyne	TSHR	50	36
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2c2ccc(F)c(F)c2)c1	ZINC000819279335	FH	On-Demand	Anodyne	CCR3	41	35
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2c2ccc(F)c(F)c2)c1	ZINC000819279335	FH	On-Demand	Anodyne	CPT1A	20	42
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2c2ccc(F)c(F)c2)c1	ZINC000819279335	FH	On-Demand	Anodyne	PREP	44	34
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2c2ccc(F)c(F)c2)c1	ZINC000819279335	FH	On-Demand	Anodyne	MCHR1	34	41
CSCCONC[C@@H](O)COc1ccc(SC)cc1	ZINC000819279379	DE	On-Demand	Anodyne	ADRB2	24	42
CSCCONC[C@@H](O)COc1ccc(SC)cc1	ZINC000819279379	DE	On-Demand	Anodyne	ADRB1	30	40
CSCCONC[C@H](O)COc1ccc(SC)cc1	ZINC000819279380	DE	On-Demand	Anodyne	ADRB2	24	42
CSCCONC[C@H](O)COc1ccc(SC)cc1	ZINC000819279380	DE	On-Demand	Anodyne	ADRB1	30	40
O=C(CN1CCSC1=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819279410	HH	On-Demand	Anodyne	IMDH_CRYPV	25	40
C#CC(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819279425	DG	On-Demand	Mild	TBXA2R	15	45
O=C(/C=C\c1cnccn1)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819279457	GI	On-Demand	Anodyne	HDAC8	15	40
O=C(/C=C/c1cnccn1)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819279458	GI	On-Demand	Anodyne	HDAC8	15	40
CCCCCCn1nc(C(=O)N2CC(OCC)C2)c2ccccc2c1=O	ZINC000819279460	FF	On-Demand	Anodyne	CNR2	15	43
C=CC(=O)NCc1ccc(C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)cc1	ZINC000819279473	IJ	On-Demand	Anodyne	PDE2A	28	40
C=CC(=O)NCc1ccc(C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)cc1	ZINC000819279473	IJ	On-Demand	Anodyne	ITK	23	42
C=CC(=O)NCc1ccc(C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)cc1	ZINC000819279473	IJ	On-Demand	Anodyne	HDAC1	27	40
Cc1noc(C2CC2)c1C(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819279488	HK	On-Demand	Anodyne	MCHR1	23	40
C[C@@H]1[C@@H](CNC[C@H](O)c2cccnc2)CCC[C@H]1C	ZINC000819279492	CF	On-Demand	Anodyne	ADRB2	20	40
C[C@@H]1[C@@H](CNC[C@H](O)c2cccnc2)CCC[C@H]1C	ZINC000819279492	CF	On-Demand	Anodyne	ADRB1	24	43
C[C@@H]1[C@@H](CNC[C@H](O)c2cccnc2)CCC[C@H]1C	ZINC000819279492	CF	On-Demand	Anodyne	ADRB3	89	46
C[C@@H]1[C@@H](CNC[C@@H](O)c2cccnc2)CCC[C@H]1C	ZINC000819279493	CF	On-Demand	Anodyne	ADRB2	20	40
C[C@@H]1[C@@H](CNC[C@@H](O)c2cccnc2)CCC[C@H]1C	ZINC000819279493	CF	On-Demand	Anodyne	ADRB1	24	43
C[C@@H]1[C@@H](CNC[C@@H](O)c2cccnc2)CCC[C@H]1C	ZINC000819279493	CF	On-Demand	Anodyne	ADRB3	89	46
Cc1ccccc1[C@@H](O)CNCCCc1ccccc1F	ZINC000819279534	CG	On-Demand	Anodyne	ADRB2	32	42
Cc1ccccc1[C@@H](O)CNCCCc1ccccc1F	ZINC000819279534	CG	On-Demand	Anodyne	ADRB1	20	42
O=C(CCSc1nc2ccccc2s1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819279539	IK	On-Demand	Anodyne	LDHA	44	45
O=C(CCSc1nc2ccccc2s1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819279539	IK	On-Demand	Anodyne	HMOX2	31	40
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819279563	DF	On-Demand	Anodyne	ADRB2	30	47
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819279563	DF	On-Demand	Anodyne	ADRB1	47	40
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819279563	DF	On-Demand	Anodyne	ADRB3	83	43
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819279563	DF	On-Demand	Anodyne	NPY5R	38	50
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819279564	DF	On-Demand	Anodyne	ADRB2	30	47
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819279564	DF	On-Demand	Anodyne	ADRB1	47	40
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819279564	DF	On-Demand	Anodyne	ADRB3	83	43
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819279564	DF	On-Demand	Anodyne	NPY5R	38	50
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)cc1	ZINC000819279565	FH	On-Demand	Anodyne	ADRB2	73	48
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)cc1	ZINC000819279565	FH	On-Demand	Anodyne	ADRB1	78	47
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)cc1	ZINC000819279565	FH	On-Demand	Anodyne	ADRB3	97	47
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)cc1	ZINC000819279566	FH	On-Demand	Anodyne	ADRB2	73	48
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)cc1	ZINC000819279566	FH	On-Demand	Anodyne	ADRB1	78	47
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)cc1	ZINC000819279566	FH	On-Demand	Anodyne	ADRB3	97	47
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cccc(F)c1	ZINC000819279571	FH	On-Demand	Anodyne	ADRB2	64	48
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cccc(F)c1	ZINC000819279571	FH	On-Demand	Anodyne	ADRB1	75	51
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cccc(F)c1	ZINC000819279571	FH	On-Demand	Anodyne	ADRB3	110	51
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cccc(F)c1	ZINC000819279572	FH	On-Demand	Anodyne	ADRB2	64	48
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cccc(F)c1	ZINC000819279572	FH	On-Demand	Anodyne	ADRB1	75	51
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cccc(F)c1	ZINC000819279572	FH	On-Demand	Anodyne	ADRB3	110	51
O=C(NCCCCn1ccnc1)C(F)=C1CCC1	ZINC000819279573	CE	On-Demand	Anodyne	TBXAS1	50	50
O=C(NCCCCn1ccnc1)C(F)=C1CCC1	ZINC000819279573	CE	On-Demand	Anodyne	QPCT	48	43
C=C(Cl)CSc1nc(C)c(CC(=O)NCCCCn2ccnc2)s1	ZINC000819279577	GH	On-Demand	Mild	TBXAS1	27	47
O[C@@H](CNCCCc1ccccc1F)c1ccccc1Cl	ZINC000819279578	DH	On-Demand	Anodyne	ADRB2	21	40
O[C@@H](CNCCCc1ccccc1F)c1ccccc1Cl	ZINC000819279578	DH	On-Demand	Anodyne	ADRB1	20	42
COC(=O)N[C@@H](C)C(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819279592	GG	On-Demand	Anodyne	ALOX5AP	20	40
CCOC(=O)NCCC(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819279634	HH	On-Demand	Anodyne	PLA2G2A	53	33
Cn1nc(C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)c2ccccc2c1=O	ZINC000819279637	II	On-Demand	Anodyne	IMDH_CRYPV	41	42
O=C(Nc1nc2ccc(Cl)cc2n1Cc1ccccc1)c1ccnc(F)c1	ZINC000819279639	GJ	On-Demand	Anodyne	ITK	20	40
CC(=O)OC(C)(C)C(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819279640	GI	On-Demand	Anodyne	PTGER1	41	39
CC(=O)OC(C)(C)C(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819279640	GI	On-Demand	Anodyne	ALOX5AP	40	38
CC(=O)OC(C)(C)C(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819279640	GI	On-Demand	Anodyne	PLA2G2A	40	35
CC(=O)OC(C)(C)C(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819279640	GI	On-Demand	Anodyne	PTGES2	65	33
O=C(CCN1CCOCC1)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819279648	GG	On-Demand	Anodyne	PTGER1	17	41
O=C(CCN1CCOCC1)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819279648	GG	On-Demand	Anodyne	CASR	47	43
O=C(CCN1CCOCC1)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819279648	GG	On-Demand	Anodyne	MCHR1	23	42
Cn1cc(/C=C/C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)cn1	ZINC000819279649	GI	On-Demand	Anodyne	HDAC8	52	46
Cn1cc(/C=C/C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)cn1	ZINC000819279649	GI	On-Demand	Anodyne	HDAC1	35	46
Cn1cc(/C=C/C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)cn1	ZINC000819279649	GI	On-Demand	Anodyne	HDAC6	37	46
Cn1cc(/C=C/C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)cn1	ZINC000819279649	GI	On-Demand	Anodyne	MCHR1	19	40
Cn1cc(/C=C\C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)cn1	ZINC000819279650	GI	On-Demand	Anodyne	HDAC8	52	46
Cn1cc(/C=C\C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)cn1	ZINC000819279650	GI	On-Demand	Anodyne	HDAC1	35	46
Cn1cc(/C=C\C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)cn1	ZINC000819279650	GI	On-Demand	Anodyne	HDAC6	37	46
Cn1cc(/C=C\C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)cn1	ZINC000819279650	GI	On-Demand	Anodyne	MCHR1	19	40
Cc1cc(OCC(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)no1	ZINC000819279653	GI	On-Demand	Anodyne	PLA2G2A	46	34
Cc1cc(OCC(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)no1	ZINC000819279653	GI	On-Demand	Anodyne	MCHR1	22	43
COc1cccc([C@H](O)C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)c1	ZINC000819279659	HI	On-Demand	Anodyne	CSNK1D	22	41
CCOc1ccccc1C(F)(F)C(=O)N1CC(OCC)C1	ZINC000819279661	CE	On-Demand	Anodyne	RBP4	49	32
CCOc1ccccc1C(F)(F)C(=O)N1CC(OCC)C1	ZINC000819279661	CE	On-Demand	Anodyne	HCN1	42	30
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819279689	DD	On-Demand	Anodyne	ADRB2	32	54
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819279689	DD	On-Demand	Anodyne	ADRB1	39	49
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819279689	DD	On-Demand	Anodyne	ADRB3	125	56
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819279689	DD	On-Demand	Anodyne	NPY5R	31	40
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819279689	DD	On-Demand	Anodyne	NAMPT	47	38
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819279690	DD	On-Demand	Anodyne	ADRB2	32	54
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819279690	DD	On-Demand	Anodyne	ADRB1	39	49
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819279690	DD	On-Demand	Anodyne	ADRB3	125	56
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819279690	DD	On-Demand	Anodyne	NPY5R	31	40
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819279690	DD	On-Demand	Anodyne	NAMPT	47	38
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819279692	FF	On-Demand	Bother	MMP8	25	41
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819279692	FF	On-Demand	Bother	MMP1	20	41
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819279693	FF	On-Demand	Bother	MMP8	25	41
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819279693	FF	On-Demand	Bother	MMP1	20	41
O[C@H](CN[C@@H]1C[C@@H](c2ccc(Cl)cc2)C1)c1ccccc1	ZINC000819279700	DH	On-Demand	Anodyne	SLC6A3	17	46
O[C@H](CN[C@@H]1C[C@@H](c2ccc(Cl)cc2)C1)c1ccccc1	ZINC000819279700	DH	On-Demand	Anodyne	ADRB3	25	42
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(Cl)cc2)C1)c1ccccc1	ZINC000819279701	DH	On-Demand	Anodyne	SLC6A3	17	46
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(Cl)cc2)C1)c1ccccc1	ZINC000819279701	DH	On-Demand	Anodyne	ADRB3	25	42
CC(C)(C)C(=O)C(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819279724	FI	On-Demand	Anodyne	TBXA2R	15	48
CC(C)(C)C(=O)C(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819279724	FI	On-Demand	Anodyne	PTGES2	82	35
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCc2ccccc2F)CC1	ZINC000819279743	GG	On-Demand	Anodyne	GPR119	45	62
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCc2ccccc2F)CC1	ZINC000819279744	GG	On-Demand	Anodyne	GPR119	45	62
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819279746	EF	On-Demand	Anodyne	LEF	49	33
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819279747	EF	On-Demand	Anodyne	LEF	49	33
Cc1ccccc1[C@@H](O)CNCCc1cccc(OCC(F)(F)F)c1	ZINC000819279749	FH	On-Demand	Anodyne	ADRB2	66	44
Cc1ccccc1[C@@H](O)CNCCc1cccc(OCC(F)(F)F)c1	ZINC000819279749	FH	On-Demand	Anodyne	ADRB1	65	45
Cc1ccccc1[C@@H](O)CNCCc1cccc(OCC(F)(F)F)c1	ZINC000819279749	FH	On-Demand	Anodyne	ADRB3	53	45
Cc1ccccc1[C@@H](O)CNCCc1cccc(OCC(F)(F)F)c1	ZINC000819279749	FH	On-Demand	Anodyne	PDS	46	37
O[C@@H](CNCCCc1ccccc1F)c1ccc(F)cc1F	ZINC000819279752	DG	On-Demand	Anodyne	ADRB2	47	44
O[C@@H](CNCCCc1ccccc1F)c1ccc(F)cc1F	ZINC000819279752	DG	On-Demand	Anodyne	ADRB1	29	44
O[C@H](CNCCCc1ccccc1F)c1ccc(F)cc1F	ZINC000819279753	DG	On-Demand	Anodyne	ADRB2	47	44
O[C@H](CNCCCc1ccccc1F)c1ccc(F)cc1F	ZINC000819279753	DG	On-Demand	Anodyne	ADRB1	29	44
O[C@@H](CNCCCc1ccccc1F)c1cccc(F)c1	ZINC000819279764	CG	On-Demand	Anodyne	ADRB2	47	39
O[C@@H](CNCCCc1ccccc1F)c1cccc(F)c1	ZINC000819279764	CG	On-Demand	Anodyne	ADRB1	44	42
O[C@@H](CNCCCc1ccccc1F)c1cccc(F)c1	ZINC000819279764	CG	On-Demand	Anodyne	ADRB3	55	42
O[C@H](CNCCCc1ccccc1F)c1cccc(F)c1	ZINC000819279765	CG	On-Demand	Anodyne	ADRB2	47	39
O[C@H](CNCCCc1ccccc1F)c1cccc(F)c1	ZINC000819279765	CG	On-Demand	Anodyne	ADRB1	44	42
O[C@H](CNCCCc1ccccc1F)c1cccc(F)c1	ZINC000819279765	CG	On-Demand	Anodyne	ADRB3	55	42
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819279767	GH	On-Demand	Anodyne	GCGR	24	44
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819279767	GH	On-Demand	Anodyne	ADRB3	42	44
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819279767	GH	On-Demand	Anodyne	EPHX2	43	36
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819279767	GH	On-Demand	Anodyne	GIPR	33	44
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819279768	GH	On-Demand	Anodyne	GCGR	24	44
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819279768	GH	On-Demand	Anodyne	ADRB3	42	44
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819279768	GH	On-Demand	Anodyne	EPHX2	43	36
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819279768	GH	On-Demand	Anodyne	GIPR	33	44
CON(C)C(=O)CCNCCc1cccc(OCC(F)(F)F)c1	ZINC000819279772	EE	On-Demand	Anodyne	CRTM	45	36
Nc1cc(C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)cc(Cl)n1	ZINC000819279790	HJ	On-Demand	Anodyne	ITK	15	41
CCn1ncnc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819279801	CD	On-Demand	Anodyne	ADRB1	27	40
CCn1ncnc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819279801	CD	On-Demand	Anodyne	ADRB3	42	40
CCn1ncnc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819279803	CD	On-Demand	Anodyne	ADRB1	27	40
CCn1ncnc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819279803	CD	On-Demand	Anodyne	ADRB3	42	40
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819279818	EF	On-Demand	Anodyne	LEF	69	39
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819279820	EF	On-Demand	Anodyne	LEF	69	39
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cccc(OCC(F)(F)F)c2)cc1	ZINC000819279824	GG	On-Demand	Bother	ADRB2	58	46
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cccc(OCC(F)(F)F)c2)cc1	ZINC000819279824	GG	On-Demand	Bother	ADRB1	69	46
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cccc(OCC(F)(F)F)c2)cc1	ZINC000819279824	GG	On-Demand	Bother	ADRB3	86	46
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cccc(OCC(F)(F)F)c2)cc1	ZINC000819279825	GG	On-Demand	Bother	ADRB2	58	46
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cccc(OCC(F)(F)F)c2)cc1	ZINC000819279825	GG	On-Demand	Bother	ADRB1	69	46
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cccc(OCC(F)(F)F)c2)cc1	ZINC000819279825	GG	On-Demand	Bother	ADRB3	86	46
O=C(CCCn1cccn1)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819279860	GI	On-Demand	Anodyne	AGTR1B	18	40
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)cn1	ZINC000819279865	FG	On-Demand	Anodyne	ADRB2	31	40
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)cn1	ZINC000819279865	FG	On-Demand	Anodyne	ADRB1	38	43
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)cn1	ZINC000819279865	FG	On-Demand	Anodyne	ADRB3	56	43
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)cn1	ZINC000819279866	FG	On-Demand	Anodyne	ADRB2	31	40
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)cn1	ZINC000819279866	FG	On-Demand	Anodyne	ADRB1	38	43
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)cn1	ZINC000819279866	FG	On-Demand	Anodyne	ADRB3	56	43
O[C@@H](CNCCCc1ccccc1F)c1ccccc1F	ZINC000819279883	CG	On-Demand	Anodyne	ADRB2	28	45
O[C@@H](CNCCCc1ccccc1F)c1ccccc1F	ZINC000819279883	CG	On-Demand	Anodyne	ADRB1	19	45
O[C@H](CNCCCc1ccccc1F)c1ccccc1F	ZINC000819279885	CG	On-Demand	Anodyne	ADRB2	28	45
O[C@H](CNCCCc1ccccc1F)c1ccccc1F	ZINC000819279885	CG	On-Demand	Anodyne	ADRB1	19	45
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cccc(OCC(F)(F)F)c2)c1	ZINC000819279904	GG	On-Demand	Bother	ADRB2	54	46
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cccc(OCC(F)(F)F)c2)c1	ZINC000819279904	GG	On-Demand	Bother	ADRB1	67	46
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cccc(OCC(F)(F)F)c2)c1	ZINC000819279904	GG	On-Demand	Bother	ADRB3	104	49
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cccc(OCC(F)(F)F)c2)c1	ZINC000819279905	GG	On-Demand	Bother	ADRB2	54	46
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cccc(OCC(F)(F)F)c2)c1	ZINC000819279905	GG	On-Demand	Bother	ADRB1	67	46
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cccc(OCC(F)(F)F)c2)c1	ZINC000819279905	GG	On-Demand	Bother	ADRB3	104	49
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819279908	FG	On-Demand	Anodyne	LEF	46	38
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819279910	FG	On-Demand	Anodyne	LEF	46	38
O=C(C[C@@H]1C=CS(=O)(=O)C1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819279928	GG	On-Demand	Anodyne	KCNK3	45	33
O=C(C[C@H]1C=CS(=O)(=O)C1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819279930	GG	On-Demand	Anodyne	KCNK3	45	33
O[C@H](CN[C@@H]1C[C@@H](c2ccc(Cl)cc2)C1)c1cccnc1	ZINC000819279956	DG	On-Demand	Anodyne	ADRB3	61	45
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(Cl)cc2)C1)c1cccnc1	ZINC000819279959	DG	On-Demand	Anodyne	ADRB3	61	45
C#Cc1ccc(C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)cn1	ZINC000819279989	GI	On-Demand	Mild	ITK	26	46
O[C@@H](CNCCCc1ccccc1F)c1cc(F)ccc1F	ZINC000819280021	DG	On-Demand	Anodyne	ADRB2	29	42
O[C@@H](CNCCCc1ccccc1F)c1cc(F)ccc1F	ZINC000819280021	DG	On-Demand	Anodyne	ADRB1	21	42
O[C@H](CNCCCc1ccccc1F)c1cc(F)ccc1F	ZINC000819280022	DG	On-Demand	Anodyne	ADRB2	29	42
O[C@H](CNCCCc1ccccc1F)c1cc(F)ccc1F	ZINC000819280022	DG	On-Demand	Anodyne	ADRB1	21	42
O=C(NCCCN1CCCC1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819280025	FE	On-Demand	Anodyne	TBK1	52	32
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1c(F)cccc1F	ZINC000819280026	GH	On-Demand	Anodyne	ADRB2	36	43
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1c(F)cccc1F	ZINC000819280026	GH	On-Demand	Anodyne	ADRB1	43	45
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1c(F)cccc1F	ZINC000819280026	GH	On-Demand	Anodyne	ADRB3	42	45
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1c(F)cccc1F	ZINC000819280027	GH	On-Demand	Anodyne	ADRB2	36	43
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1c(F)cccc1F	ZINC000819280027	GH	On-Demand	Anodyne	ADRB1	43	45
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1c(F)cccc1F	ZINC000819280027	GH	On-Demand	Anodyne	ADRB3	42	45
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819280028	GH	On-Demand	Anodyne	GIPR	45	36
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819280029	GH	On-Demand	Anodyne	GIPR	45	36
O[C@@H](CNCCCc1ccccc1F)c1ccc(Cl)cc1	ZINC000819280035	DH	On-Demand	Anodyne	ADRB2	44	42
O[C@@H](CNCCCc1ccccc1F)c1ccc(Cl)cc1	ZINC000819280035	DH	On-Demand	Anodyne	ADRB1	40	41
O[C@@H](CNCCCc1ccccc1F)c1ccc(Cl)cc1	ZINC000819280035	DH	On-Demand	Anodyne	ADRB3	36	40
O[C@H](CN[C@@H]1CC[C@H](c2cccc(F)c2)C1)c1cccnc1	ZINC000819280046	DG	On-Demand	Anodyne	ADRB3	46	44
O[C@H](CN[C@H]1CC[C@@H](c2cccc(F)c2)C1)c1cccnc1	ZINC000819280047	DG	On-Demand	Anodyne	ADRB3	46	44
O[C@H](CN[C@H]1CC[C@H](c2cccc(F)c2)C1)c1cccnc1	ZINC000819280048	DG	On-Demand	Anodyne	ADRB3	46	44
O[C@H](CN[C@@H]1CC[C@@H](c2cccc(F)c2)C1)c1cccnc1	ZINC000819280049	DG	On-Demand	Anodyne	ADRB3	46	44
O[C@@H](CNCCCc1ccccc1F)c1cccc(Cl)c1	ZINC000819280052	DH	On-Demand	Anodyne	ADRB2	66	43
O[C@@H](CNCCCc1ccccc1F)c1cccc(Cl)c1	ZINC000819280052	DH	On-Demand	Anodyne	ADRB1	66	53
O[C@@H](CNCCCc1ccccc1F)c1cccc(Cl)c1	ZINC000819280052	DH	On-Demand	Anodyne	ADRB3	77	55
O[C@H](CNCCCc1ccccc1F)c1cccc(Cl)c1	ZINC000819280053	DH	On-Demand	Anodyne	ADRB2	66	43
O[C@H](CNCCCc1ccccc1F)c1cccc(Cl)c1	ZINC000819280053	DH	On-Demand	Anodyne	ADRB1	66	53
O[C@H](CNCCCc1ccccc1F)c1cccc(Cl)c1	ZINC000819280053	DH	On-Demand	Anodyne	ADRB3	77	55
C#CCN1CCN(C(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819280054	DC	On-Demand	Mild	DRD4	44	34
C#CCN1CCN(C(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819280055	DC	On-Demand	Mild	DRD4	44	34
Cc1ccccc1[C@@H](O)CNCc1ccc(NC(=O)N(C)C)cc1	ZINC000819280057	EF	On-Demand	Anodyne	NPY5R	32	40
O[C@@H](CNCCCc1ccccc1F)c1cccnc1	ZINC000819280058	CE	On-Demand	Anodyne	ADRB2	40	50
O[C@@H](CNCCCc1ccccc1F)c1cccnc1	ZINC000819280058	CE	On-Demand	Anodyne	ADRB1	40	51
O[C@@H](CNCCCc1ccccc1F)c1cccnc1	ZINC000819280058	CE	On-Demand	Anodyne	ADRB3	117	52
O[C@H](CNCCCc1ccccc1F)c1cccnc1	ZINC000819280059	CE	On-Demand	Anodyne	ADRB2	40	50
O[C@H](CNCCCc1ccccc1F)c1cccnc1	ZINC000819280059	CE	On-Demand	Anodyne	ADRB1	40	51
O[C@H](CNCCCc1ccccc1F)c1cccnc1	ZINC000819280059	CE	On-Demand	Anodyne	ADRB3	117	52
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819280060	EG	On-Demand	Anodyne	NPY5R	31	40
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cccnc1	ZINC000819280069	EF	On-Demand	Anodyne	ADRB2	66	53
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cccnc1	ZINC000819280069	EF	On-Demand	Anodyne	ADRB1	84	62
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cccnc1	ZINC000819280069	EF	On-Demand	Anodyne	ADRB3	164	62
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cccnc1	ZINC000819280070	EF	On-Demand	Anodyne	ADRB2	66	53
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cccnc1	ZINC000819280070	EF	On-Demand	Anodyne	ADRB1	84	62
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1cccnc1	ZINC000819280070	EF	On-Demand	Anodyne	ADRB3	164	62
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)cc1F	ZINC000819280072	GH	On-Demand	Anodyne	ADRB2	60	43
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)cc1F	ZINC000819280072	GH	On-Demand	Anodyne	ADRB1	58	47
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)cc1F	ZINC000819280072	GH	On-Demand	Anodyne	ADRB3	44	47
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)cc1F	ZINC000819280073	GH	On-Demand	Anodyne	ADRB2	60	43
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)cc1F	ZINC000819280073	GH	On-Demand	Anodyne	ADRB1	58	47
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)cc1F	ZINC000819280073	GH	On-Demand	Anodyne	ADRB3	44	47
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819280074	EF	On-Demand	Anodyne	LEF	63	37
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819280075	EF	On-Demand	Anodyne	LEF	63	37
CCOC(=O)NCC(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819280101	GG	On-Demand	Anodyne	PLA2G2A	71	35
CCOC(=O)NCC(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819280101	GG	On-Demand	Anodyne	PDE6D	43	35
CCOC(=O)NCC(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819280101	GG	On-Demand	Anodyne	PLA2G2D	40	32
O=C(Cc1csc(-c2nc[nH]n2)n1)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819280103	II	On-Demand	Anodyne	PTGER1	18	45
O=C(Nc1nc2ccc(Cl)cc2n1Cc1ccccc1)C(F)F	ZINC000819280107	EH	On-Demand	Anodyne	TBXA2R	15	40
CC(C)[C@H](O)CC(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819280133	FI	On-Demand	Anodyne	ALOX5AP	23	44
CC(C)[C@H](O)CC(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819280133	FI	On-Demand	Anodyne	MCHR1	17	41
CC(C)[C@H](O)CC(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819280133	FI	On-Demand	Anodyne	PTGES2	57	34
CC(C)[C@H](O)CC(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819280133	FI	On-Demand	Anodyne	IMDH_CRYPV	34	41
Cn1nc(Br)cc1C(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819280159	II	On-Demand	Anodyne	ITK	22	40
C#CCN1CCN(C(=O)Cc2cccc(NC(C)=O)c2)CC1	ZINC000819280200	CC	On-Demand	Mild	HTR1D	21	40
C#CCN1CCN(C(=O)Cc2cccc(NC(C)=O)c2)CC1	ZINC000819280200	CC	On-Demand	Mild	HTR1B	18	40
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819280201	EG	On-Demand	Anodyne	UL54	61	36
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)c(F)c1	ZINC000819280206	GH	On-Demand	Anodyne	ADRB2	62	49
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)c(F)c1	ZINC000819280206	GH	On-Demand	Anodyne	ADRB1	67	52
O[C@@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)c(F)c1	ZINC000819280206	GH	On-Demand	Anodyne	ADRB3	86	52
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)c(F)c1	ZINC000819280207	GH	On-Demand	Anodyne	ADRB2	62	49
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)c(F)c1	ZINC000819280207	GH	On-Demand	Anodyne	ADRB1	67	52
O[C@H](CNCCc1cccc(OCC(F)(F)F)c1)c1ccc(F)c(F)c1	ZINC000819280207	GH	On-Demand	Anodyne	ADRB3	86	52
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819280230	EG	On-Demand	Anodyne	ADRB2	34	49
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819280230	EG	On-Demand	Anodyne	ADRB1	51	52
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819280230	EG	On-Demand	Anodyne	ADRB3	84	55
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819280230	EG	On-Demand	Anodyne	UL54	64	34
CN(C)C(=O)Nc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819280230	EG	On-Demand	Anodyne	NPY5R	32	42
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819280231	EG	On-Demand	Anodyne	ADRB2	34	49
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819280231	EG	On-Demand	Anodyne	ADRB1	51	52
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819280231	EG	On-Demand	Anodyne	ADRB3	84	55
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819280231	EG	On-Demand	Anodyne	UL54	64	34
CN(C)C(=O)Nc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819280231	EG	On-Demand	Anodyne	NPY5R	32	42
N#Cc1ccc([C@H](O)CNCCc2cccc(OCC(F)(F)F)c2)cc1	ZINC000819280265	FG	On-Demand	Mild	ADRB2	55	50
N#Cc1ccc([C@H](O)CNCCc2cccc(OCC(F)(F)F)c2)cc1	ZINC000819280265	FG	On-Demand	Mild	ADRB1	66	42
N#Cc1ccc([C@H](O)CNCCc2cccc(OCC(F)(F)F)c2)cc1	ZINC000819280265	FG	On-Demand	Mild	ADRB3	72	46
N#Cc1ccc([C@@H](O)CNCCc2cccc(OCC(F)(F)F)c2)cc1	ZINC000819280266	FG	On-Demand	Mild	ADRB2	55	50
N#Cc1ccc([C@@H](O)CNCCc2cccc(OCC(F)(F)F)c2)cc1	ZINC000819280266	FG	On-Demand	Mild	ADRB1	66	42
N#Cc1ccc([C@@H](O)CNCCc2cccc(OCC(F)(F)F)c2)cc1	ZINC000819280266	FG	On-Demand	Mild	ADRB3	72	46
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1C	ZINC000819280271	JJ	On-Demand	Reactive	CA12	15	43
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1C	ZINC000819280271	JJ	On-Demand	Reactive	KCNK3	73	36
COCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1C	ZINC000819280271	JJ	On-Demand	Reactive	KCNK9	50	34
O[C@@H](CN[C@@H]1C[C@H]1C1CC1)c1ccc(F)cc1	ZINC000819280276	BE	On-Demand	Anodyne	SLC6A3	19	45
O[C@@H](CNC1CC(F)(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819280284	DH	On-Demand	Anodyne	ADRB1	27	41
O[C@@H](CNC1CC(F)(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819280284	DH	On-Demand	Anodyne	ADRB3	44	46
O[C@H](CNC1CC(F)(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819280285	DH	On-Demand	Anodyne	ADRB1	27	41
O[C@H](CNC1CC(F)(c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819280285	DH	On-Demand	Anodyne	ADRB3	44	46
O[C@@H](CNC[C@H]1CCC(F)(F)C1)c1ccccc1Cl	ZINC000819280316	CG	On-Demand	Anodyne	OPRL1	52	44
O[C@@H](CNC[C@@H]1CCC(F)(F)C1)c1ccccc1Cl	ZINC000819280317	CG	On-Demand	Anodyne	OPRL1	52	44
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2C[C@H]2c2ccccc2)cc1	ZINC000819280331	EE	On-Demand	Anodyne	ADRB3	20	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2C[C@H]2c2ccccc2)cc1	ZINC000819280331	EE	On-Demand	Anodyne	EPHX2	15	40
COc1ccc(OC)c([C@H](O)CNC2CC(F)(c3cccc(Cl)c3)C2)c1	ZINC000819280332	GI	On-Demand	Anodyne	ADRB3	16	42
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@@H]2C[C@H]2c2ccccc2)CC1	ZINC000819280362	FG	On-Demand	Anodyne	EPHX2	25	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CC1	ZINC000819280368	FE	On-Demand	Mild	CTSD	96	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CC1	ZINC000819280368	FE	On-Demand	Mild	PGC	60	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CC1	ZINC000819280368	FE	On-Demand	Mild	PAPA1_CARPA	57	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CC1	ZINC000819280368	FE	On-Demand	Mild	CTSK	19	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CC1	ZINC000819280368	FE	On-Demand	Mild	CTSL	22	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CC1	ZINC000819280368	FE	On-Demand	Mild	PGA	33	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CC1	ZINC000819280368	FE	On-Demand	Mild	BACE2	51	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CC1	ZINC000819280368	FE	On-Demand	Mild	REN	73	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CC1	ZINC000819280368	FE	On-Demand	Mild	REN1	21	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CC1	ZINC000819280368	FE	On-Demand	Mild	BACE1	86	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CC1	ZINC000819280368	FE	On-Demand	Mild	FPR1	50	41
CNC(=O)C[C@H](NC[C@@H](O)c1ccccc1C(F)(F)F)c1ccccc1	ZINC000819280369	FG	On-Demand	Anodyne	SOAT1	19	44
CNC(=O)C[C@@H](NC[C@@H](O)c1ccccc1C(F)(F)F)c1ccccc1	ZINC000819280372	FG	On-Demand	Anodyne	SOAT1	19	44
CNC(=O)C[C@H](NC[C@H](O)c1ccccc1C(F)(F)F)c1ccccc1	ZINC000819280373	FG	On-Demand	Anodyne	SOAT1	19	44
CNC(=O)C[C@@H](NC[C@H](O)c1ccccc1C(F)(F)F)c1ccccc1	ZINC000819280374	FG	On-Demand	Anodyne	SOAT1	19	44
CO[C@@H](C)CC(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819280376	FI	On-Demand	Anodyne	ALOX5AP	17	40
CO[C@@H](C)CC(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819280376	FI	On-Demand	Anodyne	PLA2G2A	44	35
O[C@H](CN[C@@H]1C[C@@H](c2ccc(F)c(Br)c2)C1)c1cccnc1	ZINC000819280439	FH	On-Demand	Anodyne	ADRB3	42	42
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(F)c(Br)c2)C1)c1cccnc1	ZINC000819280440	FH	On-Demand	Anodyne	ADRB3	42	42
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819280447	IJ	On-Demand	Anodyne	CCKBR	59	39
C=C1c2ccccc2C(=O)N1[C@@H](C)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819280447	IJ	On-Demand	Anodyne	KCNK3	61	33
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819280448	IJ	On-Demand	Anodyne	CCKBR	59	39
C=C1c2ccccc2C(=O)N1[C@H](C)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819280448	IJ	On-Demand	Anodyne	KCNK3	61	33
O[C@H](CNC[C@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819280454	CE	On-Demand	Anodyne	ADRB1	22	42
O[C@H](CNC[C@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819280454	CE	On-Demand	Anodyne	ADRB3	86	43
O[C@@H](CNC[C@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819280455	CE	On-Demand	Anodyne	ADRB1	22	42
O[C@@H](CNC[C@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819280455	CE	On-Demand	Anodyne	ADRB3	86	43
O[C@@H](CNC[C@@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819280456	CE	On-Demand	Anodyne	ADRB1	22	42
O[C@@H](CNC[C@@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819280456	CE	On-Demand	Anodyne	ADRB3	86	43
O[C@H](CNC[C@@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819280457	CE	On-Demand	Anodyne	ADRB1	22	42
O[C@H](CNC[C@@H]1CCC(F)(F)C1)c1cccnc1	ZINC000819280457	CE	On-Demand	Anodyne	ADRB3	86	43
O[C@@H](CNC1CC(F)(c2cccc(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819280486	FI	On-Demand	Anodyne	ADRB3	29	42
O[C@H](CNC1CC(F)(c2cccc(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819280487	FI	On-Demand	Anodyne	ADRB3	29	42
CN(C)CCC1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819280514	GF	On-Demand	Mild	PAPA1_CARPA	31	43
CN(C)CCC1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819280515	GF	On-Demand	Mild	PAPA1_CARPA	31	43
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1C[C@H]1c1cccc2ccccc12	ZINC000819280525	FH	On-Demand	Anodyne	MTNR1A	15	40
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1C[C@H]1c1cccc2ccccc12	ZINC000819280526	FH	On-Demand	Anodyne	MTNR1A	15	40
O[C@@H](CN[C@@H]1C[C@H]1C1CC1)c1cccnc1	ZINC000819280527	BD	On-Demand	Anodyne	ADRB3	64	44
O[C@H](CN[C@@H]1C[C@H]1C1CC1)c1cccnc1	ZINC000819280528	BD	On-Demand	Anodyne	ADRB3	64	44
CON(C)C(=O)CCN[C@@H]1C[C@H]1c1ccccc1	ZINC000819280536	BD	On-Demand	Anodyne	KDM1A	42	49
N#Cc1ccccc1/C=C\C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819280551	GJ	On-Demand	Mild	KCNK3	100	40
N#Cc1ccccc1/C=C\C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819280551	GJ	On-Demand	Mild	KCNK9	52	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2CCC(F)(F)C2)CC1	ZINC000819280557	FG	On-Demand	Anodyne	GPR119	30	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H]2CCC(F)(F)C2)CC1	ZINC000819280558	FG	On-Demand	Anodyne	GPR119	30	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2CCC(F)(F)C2)CC1	ZINC000819280559	FG	On-Demand	Anodyne	GPR119	30	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H]2CCC(F)(F)C2)CC1	ZINC000819280560	FG	On-Demand	Anodyne	GPR119	30	45
CNC(=O)C[C@@H](NC[C@H](O)c1ccc(C)cc1)c1ccccc1	ZINC000819280569	DE	On-Demand	Anodyne	ADRB3	27	44
CNC(=O)C[C@@H](NC[C@@H](O)c1ccc(C)cc1)c1ccccc1	ZINC000819280570	DE	On-Demand	Anodyne	ADRB3	27	44
CNC(=O)C[C@H](NC[C@H](O)c1ccc(C)cc1)c1ccccc1	ZINC000819280571	DE	On-Demand	Anodyne	ADRB3	27	44
CNC(=O)C[C@H](NC[C@@H](O)c1ccc(C)cc1)c1ccccc1	ZINC000819280572	DE	On-Demand	Anodyne	ADRB3	27	44
CNC(=O)C[C@H](NC[C@@H](O)c1cccc(Br)c1)c1ccccc1	ZINC000819280580	GF	On-Demand	Anodyne	ADRB3	39	44
CNC(=O)C[C@@H](NC[C@@H](O)c1cccc(Br)c1)c1ccccc1	ZINC000819280581	GF	On-Demand	Anodyne	ADRB3	39	44
CNC(=O)C[C@H](NC[C@H](O)c1cccc(Br)c1)c1ccccc1	ZINC000819280582	GF	On-Demand	Anodyne	ADRB3	39	44
CNC(=O)C[C@@H](NC[C@H](O)c1cccc(Br)c1)c1ccccc1	ZINC000819280583	GF	On-Demand	Anodyne	ADRB3	39	44
C=CCC1(C(=O)Oc2cccc(NC(=O)C(C)C)c2)CCOCC1	ZINC000819280588	EH	On-Demand	Mild	LIMK2	21	40
O[C@@H](CNC[C@H]1CCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819280597	CG	On-Demand	Anodyne	ADRB1	30	42
O[C@@H](CNC[C@H]1CCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819280597	CG	On-Demand	Anodyne	ADRB3	44	42
O[C@H](CNC[C@H]1CCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819280598	CG	On-Demand	Anodyne	ADRB1	30	42
O[C@H](CNC[C@H]1CCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819280598	CG	On-Demand	Anodyne	ADRB3	44	42
O[C@@H](CNC[C@@H]1CCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819280599	CG	On-Demand	Anodyne	ADRB1	30	42
O[C@@H](CNC[C@@H]1CCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819280599	CG	On-Demand	Anodyne	ADRB3	44	42
O[C@H](CNC[C@@H]1CCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819280600	CG	On-Demand	Anodyne	ADRB1	30	42
O[C@H](CNC[C@@H]1CCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819280600	CG	On-Demand	Anodyne	ADRB3	44	42
O[C@@H](CN[C@@H]1C[C@H]1c1ccccc1Br)c1cccnc1	ZINC000819280604	EG	On-Demand	Anodyne	ADRB3	55	39
O[C@H](CN[C@@H]1C[C@H]1c1ccccc1Br)c1cccnc1	ZINC000819280605	EG	On-Demand	Anodyne	ADRB3	55	39
C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819280618	FD	On-Demand	Anodyne	CELA1	44	43
C[C@H]1CCCCN1C(=O)[C@@H](C)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819280618	FD	On-Demand	Anodyne	ELANE	16	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@H]2c2c(F)cccc2F)CC1	ZINC000819280623	GG	On-Demand	Anodyne	GPR119	45	55
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@H]2c2c(F)cccc2F)CC1	ZINC000819280624	GG	On-Demand	Anodyne	GPR119	45	55
CCOc1ccc([C@@H]2C[C@H]2NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819280627	EH	On-Demand	Anodyne	ADRB1	32	44
CCOc1ccc([C@@H]2C[C@H]2NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819280627	EH	On-Demand	Anodyne	ADRB3	47	45
CCOc1ccc([C@@H]2C[C@H]2NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819280628	EH	On-Demand	Anodyne	ADRB1	32	44
CCOc1ccc([C@@H]2C[C@H]2NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819280628	EH	On-Demand	Anodyne	ADRB3	47	45
CON(C)C(=O)CCN[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000819280647	EE	On-Demand	Anodyne	KDM1A	30	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC000819280648	GH	On-Demand	Anodyne	EPHX2	19	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC000819280648	GH	On-Demand	Anodyne	MDM2	128	38
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC000819280648	GH	On-Demand	Anodyne	GPR119	34	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC000819280649	GH	On-Demand	Anodyne	EPHX2	19	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC000819280649	GH	On-Demand	Anodyne	MDM2	128	38
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC000819280649	GH	On-Demand	Anodyne	GPR119	34	45
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC000819280650	GH	On-Demand	Anodyne	MDM2	60	36
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC000819280651	GH	On-Demand	Anodyne	MDM2	60	36
O[C@@H](CN[C@@H]1C[C@H]1c1ccc2ccccc2c1)C1CC1	ZINC000819280675	CG	On-Demand	Anodyne	SLC6A3	21	41
O[C@H](CN[C@@H]1C[C@H]1c1ccc2ccccc2c1)C1CC1	ZINC000819280676	CG	On-Demand	Anodyne	SLC6A3	21	41
C[C@@H]1CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H](C)C1	ZINC000819280680	FH	On-Demand	Mild	PAPA1_CARPA	38	49
C[C@@H]1CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H](C)C1	ZINC000819280682	FH	On-Demand	Mild	PAPA1_CARPA	38	49
CCOc1ccc([C@@H]2C[C@H]2NCCC(=O)Nc2ccc(N(C)C)cc2)cc1	ZINC000819280697	FH	On-Demand	Anodyne	SLC10A2	40	34
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@@H]2C[C@H]2c2c(F)cccc2F)CC1	ZINC000819280700	GH	On-Demand	Anodyne	GPR119	25	41
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@@H]2C[C@H]2c2c(F)cccc2F)CC1	ZINC000819280701	GH	On-Demand	Anodyne	GPR119	25	41
O[C@@H](CN[C@@H]1C[C@H]1C1CC1)c1ccccc1Cl	ZINC000819280732	CF	On-Demand	Anodyne	OPRL1	31	41
COc1cccc([S@@](=O)CC(=O)Oc2cccc(NC(=O)C(C)C)c2)c1	ZINC000819280734	GG	On-Demand	Anodyne	MTNR1A	30	47
COc1cccc([S@@](=O)CC(=O)Oc2cccc(NC(=O)C(C)C)c2)c1	ZINC000819280734	GG	On-Demand	Anodyne	MTNR1B	30	56
COc1cccc([S@@](=O)CC(=O)Oc2cccc(NC(=O)C(C)C)c2)c1	ZINC000819280734	GG	On-Demand	Anodyne	ACR	15	40
COc1cccc([S@@](=O)CC(=O)Oc2cccc(NC(=O)C(C)C)c2)c1	ZINC000819280734	GG	On-Demand	Anodyne	TAAR1	31	41
O[C@@H](CNC1CC(F)(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819280735	EI	On-Demand	Anodyne	ADRB3	34	44
O[C@H](CNC1CC(F)(c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819280736	EI	On-Demand	Anodyne	ADRB3	34	44
O[C@H](CN[C@@H]1C[C@H]1c1ccccc1)C1CC1	ZINC000819280754	BD	On-Demand	Anodyne	KDM1A	40	41
O[C@@H](CN[C@@H]1C[C@H]1c1ccccc1)C1CC1	ZINC000819280755	BD	On-Demand	Anodyne	KDM1A	40	41
O[C@@H](CNC1CC(F)(c2cccc(Cl)c2)C1)c1ccc(F)cc1	ZINC000819280785	EI	On-Demand	Anodyne	ADRB3	29	41
O[C@H](CNC1CC(F)(c2cccc(Cl)c2)C1)c1ccc(F)cc1	ZINC000819280786	EI	On-Demand	Anodyne	ADRB3	29	41
N#CCC1(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819280791	BD	On-Demand	Mild	ADRB2	20	41
N#CCC1(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819280791	BD	On-Demand	Mild	ADRB1	22	41
N#CCC1(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819280791	BD	On-Demand	Mild	ADRB3	82	41
N#CCC1(CNC[C@H](O)c2cccnc2)CC1	ZINC000819280792	BD	On-Demand	Mild	ADRB2	20	41
N#CCC1(CNC[C@H](O)c2cccnc2)CC1	ZINC000819280792	BD	On-Demand	Mild	ADRB1	22	41
N#CCC1(CNC[C@H](O)c2cccnc2)CC1	ZINC000819280792	BD	On-Demand	Mild	ADRB3	82	41
Cc1nc(O)nc(O)c1CCC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819280813	HG	On-Demand	Anodyne	KCNK3	60	35
O=C(O)[C@H]1CCN(CC(=O)N2CCC(C(=O)N3CCCCCC3)CC2)C1	ZINC000819280821	FD	On-Demand	Anodyne	SLC6A1	47	35
O=C(O)[C@@H]1CCN(CC(=O)N2CCC(C(=O)N3CCCCCC3)CC2)C1	ZINC000819280822	FD	On-Demand	Anodyne	SLC6A1	47	35
O=C(O)[C@@H]1CCN(C(=O)c2nn(-c3ccccc3C(F)(F)F)cc2O)C1	ZINC000819280823	FE	On-Demand	Anodyne	RBP4	68	38
O=C(O)[C@@H]1CCN(C(=O)c2nn(-c3ccccc3C(F)(F)F)cc2O)C1	ZINC000819280823	FE	On-Demand	Anodyne	SFRP1	82	35
O=C(O)[C@@H]1CCN(C(=O)c2nn(-c3ccccc3C(F)(F)F)cc2O)C1	ZINC000819280823	FE	On-Demand	Anodyne	WNT3	48	33
O=C(O)[C@H]1CCN(C(=O)c2nn(-c3ccccc3C(F)(F)F)cc2O)C1	ZINC000819280824	FE	On-Demand	Anodyne	RBP4	68	38
O=C(O)[C@H]1CCN(C(=O)c2nn(-c3ccccc3C(F)(F)F)cc2O)C1	ZINC000819280824	FE	On-Demand	Anodyne	SFRP1	82	35
O=C(O)[C@H]1CCN(C(=O)c2nn(-c3ccccc3C(F)(F)F)cc2O)C1	ZINC000819280824	FE	On-Demand	Anodyne	WNT3	48	33
O=C(O)[C@H]1CCN(CC(=O)N2CCN(C(=O)Nc3ccccc3)CC2)C1	ZINC000819280825	FC	On-Demand	Anodyne	SLC6A1	139	40
O=C(O)[C@H]1CCN(CC(=O)N2CCN(C(=O)Nc3ccccc3)CC2)C1	ZINC000819280825	FC	On-Demand	Anodyne	CCR3	19	40
O=C(O)[C@H]1CCN(CC(=O)N2CCN(C(=O)Nc3ccccc3)CC2)C1	ZINC000819280825	FC	On-Demand	Anodyne	MAPK1	27	52
O=C(O)[C@H]1CCN(CC(=O)N2CCN(C(=O)Nc3ccccc3)CC2)C1	ZINC000819280825	FC	On-Demand	Anodyne	EPHX2	28	44
O=C(O)[C@@H]1CCN(CC(=O)N2CCN(C(=O)Nc3ccccc3)CC2)C1	ZINC000819280826	FC	On-Demand	Anodyne	SLC6A1	139	40
O=C(O)[C@@H]1CCN(CC(=O)N2CCN(C(=O)Nc3ccccc3)CC2)C1	ZINC000819280826	FC	On-Demand	Anodyne	CCR3	19	40
O=C(O)[C@@H]1CCN(CC(=O)N2CCN(C(=O)Nc3ccccc3)CC2)C1	ZINC000819280826	FC	On-Demand	Anodyne	MAPK1	27	52
O=C(O)[C@@H]1CCN(CC(=O)N2CCN(C(=O)Nc3ccccc3)CC2)C1	ZINC000819280826	FC	On-Demand	Anodyne	EPHX2	28	44
O=C(O)C1CCN(C(=S)NCc2ccc(OC(F)(F)F)cc2)CC1	ZINC000819280833	FF	On-Demand	Anodyne	GCGR	22	45
O=C(O)C1CCN(C(=S)NCc2ccc(OC(F)(F)F)cc2)CC1	ZINC000819280833	FF	On-Demand	Anodyne	GRIN2B	15	43
O=C(O)C1CCN(C(=S)NCc2ccc(OC(F)(F)F)cc2)CC1	ZINC000819280833	FF	On-Demand	Anodyne	MMP13	20	41
O=C(O)C1CCN(C(=S)NCc2ccc(OC(F)(F)F)cc2)CC1	ZINC000819280833	FF	On-Demand	Anodyne	MMP2	25	41
O=C(O)C1CCN(C(=S)NCc2ccc(OC(F)(F)F)cc2)CC1	ZINC000819280833	FF	On-Demand	Anodyne	MMP14	17	41
O=C(O)C1CCN(C(=S)NCc2ccc(OC(F)(F)F)cc2)CC1	ZINC000819280833	FF	On-Demand	Anodyne	EPHX2	52	43
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280838	CC	On-Demand	Anodyne	ADRB2	33	49
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280838	CC	On-Demand	Anodyne	ADRB1	50	46
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280838	CC	On-Demand	Anodyne	SLC6A1	158	45
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280838	CC	On-Demand	Anodyne	PTGFR	30	41
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280838	CC	On-Demand	Anodyne	ADRB3	31	46
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280838	CC	On-Demand	Anodyne	LTA4H	30	47
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280838	CC	On-Demand	Anodyne	ACOX1	52	37
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280838	CC	On-Demand	Anodyne	CCR3	17	42
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280838	CC	On-Demand	Anodyne	CPT1A	95	36
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280838	CC	On-Demand	Anodyne	CPT2	41	35
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280838	CC	On-Demand	Anodyne	ABCB1	89	50
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280838	CC	On-Demand	Anodyne	S1PR1	16	42
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280839	CC	On-Demand	Anodyne	ADRB2	33	49
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280839	CC	On-Demand	Anodyne	ADRB1	50	46
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280839	CC	On-Demand	Anodyne	SLC6A1	158	45
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280839	CC	On-Demand	Anodyne	PTGFR	30	41
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280839	CC	On-Demand	Anodyne	ADRB3	31	46
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280839	CC	On-Demand	Anodyne	LTA4H	30	47
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280839	CC	On-Demand	Anodyne	ACOX1	52	37
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280839	CC	On-Demand	Anodyne	CCR3	17	42
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280839	CC	On-Demand	Anodyne	CPT1A	95	36
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280839	CC	On-Demand	Anodyne	CPT2	41	35
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280839	CC	On-Demand	Anodyne	ABCB1	89	50
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280839	CC	On-Demand	Anodyne	S1PR1	16	42
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280840	CC	On-Demand	Anodyne	ADRB2	33	49
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280840	CC	On-Demand	Anodyne	ADRB1	50	46
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280840	CC	On-Demand	Anodyne	SLC6A1	158	45
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280840	CC	On-Demand	Anodyne	PTGFR	30	41
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280840	CC	On-Demand	Anodyne	ADRB3	31	46
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280840	CC	On-Demand	Anodyne	LTA4H	30	47
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280840	CC	On-Demand	Anodyne	ACOX1	52	37
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280840	CC	On-Demand	Anodyne	CCR3	17	42
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280840	CC	On-Demand	Anodyne	CPT1A	95	36
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280840	CC	On-Demand	Anodyne	CPT2	41	35
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280840	CC	On-Demand	Anodyne	ABCB1	89	50
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccccc2)C1	ZINC000819280840	CC	On-Demand	Anodyne	S1PR1	16	42
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280841	CC	On-Demand	Anodyne	ADRB2	33	49
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280841	CC	On-Demand	Anodyne	ADRB1	50	46
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280841	CC	On-Demand	Anodyne	SLC6A1	158	45
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280841	CC	On-Demand	Anodyne	PTGFR	30	41
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280841	CC	On-Demand	Anodyne	ADRB3	31	46
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280841	CC	On-Demand	Anodyne	LTA4H	30	47
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280841	CC	On-Demand	Anodyne	ACOX1	52	37
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280841	CC	On-Demand	Anodyne	CCR3	17	42
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280841	CC	On-Demand	Anodyne	CPT1A	95	36
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280841	CC	On-Demand	Anodyne	CPT2	41	35
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280841	CC	On-Demand	Anodyne	ABCB1	89	50
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819280841	CC	On-Demand	Anodyne	S1PR1	16	42
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc3ccccc3c2)C1	ZINC000819280842	DF	On-Demand	Anodyne	SLC6A1	85	33
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc3ccccc3c2)C1	ZINC000819280842	DF	On-Demand	Anodyne	NPY2R	49	44
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc3ccccc3c2)C1	ZINC000819280842	DF	On-Demand	Anodyne	EPHX2	15	47
O=C(O)[C@H]1CCN(C(=S)Nc2ccc3ccccc3c2)C1	ZINC000819280843	DF	On-Demand	Anodyne	SLC6A1	85	33
O=C(O)[C@H]1CCN(C(=S)Nc2ccc3ccccc3c2)C1	ZINC000819280843	DF	On-Demand	Anodyne	NPY2R	49	44
O=C(O)[C@H]1CCN(C(=S)Nc2ccc3ccccc3c2)C1	ZINC000819280843	DF	On-Demand	Anodyne	EPHX2	15	47
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(OC(F)(F)F)cc2)C1	ZINC000819280847	EF	On-Demand	Anodyne	GCGR	16	51
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(OC(F)(F)F)cc2)C1	ZINC000819280847	EF	On-Demand	Anodyne	DHODH	17	48
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(OC(F)(F)F)cc2)C1	ZINC000819280847	EF	On-Demand	Anodyne	NPY2R	31	43
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(OC(F)(F)F)cc2)C1	ZINC000819280847	EF	On-Demand	Anodyne	P2RY1	57	42
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(OC(F)(F)F)cc2)C1	ZINC000819280847	EF	On-Demand	Anodyne	EPHX2	78	55
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(OC(F)(F)F)cc2)C1	ZINC000819280847	EF	On-Demand	Anodyne	MCHR1	19	42
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(OC(F)(F)F)cc2)C1	ZINC000819280847	EF	On-Demand	Anodyne	TRPM8	15	40
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(OC(F)(F)F)cc2)C1	ZINC000819280848	EF	On-Demand	Anodyne	GCGR	16	51
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(OC(F)(F)F)cc2)C1	ZINC000819280848	EF	On-Demand	Anodyne	DHODH	17	48
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(OC(F)(F)F)cc2)C1	ZINC000819280848	EF	On-Demand	Anodyne	NPY2R	31	43
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(OC(F)(F)F)cc2)C1	ZINC000819280848	EF	On-Demand	Anodyne	P2RY1	57	42
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(OC(F)(F)F)cc2)C1	ZINC000819280848	EF	On-Demand	Anodyne	EPHX2	78	55
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(OC(F)(F)F)cc2)C1	ZINC000819280848	EF	On-Demand	Anodyne	MCHR1	19	42
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(OC(F)(F)F)cc2)C1	ZINC000819280848	EF	On-Demand	Anodyne	TRPM8	15	40
O=C(O)[C@@H]1CCN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C1	ZINC000819280853	ED	On-Demand	Anodyne	SLC6A1	94	37
O=C(O)[C@@H]1CCN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C1	ZINC000819280853	ED	On-Demand	Anodyne	DRD5	19	40
O=C(O)[C@@H]1CCN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C1	ZINC000819280853	ED	On-Demand	Anodyne	SSTR4	52	37
O=C(O)[C@@H]1CCN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C1	ZINC000819280853	ED	On-Demand	Anodyne	SSTR5	42	37
O=C(O)[C@@H]1CCN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C1	ZINC000819280853	ED	On-Demand	Anodyne	PDE11A	46	33
O=C(O)[C@H]1CCN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C1	ZINC000819280854	ED	On-Demand	Anodyne	SLC6A1	94	37
O=C(O)[C@H]1CCN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C1	ZINC000819280854	ED	On-Demand	Anodyne	DRD5	19	40
O=C(O)[C@H]1CCN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C1	ZINC000819280854	ED	On-Demand	Anodyne	SSTR4	52	37
O=C(O)[C@H]1CCN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C1	ZINC000819280854	ED	On-Demand	Anodyne	SSTR5	42	37
O=C(O)[C@H]1CCN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C1	ZINC000819280854	ED	On-Demand	Anodyne	PDE11A	46	33
O=C(O)[C@H]1CCN(CC(=O)N2N=C(c3ccco3)C[C@@H]2c2cccs2)C1	ZINC000819280855	FE	On-Demand	Anodyne	SLC6A1	42	35
O=C(O)[C@H]1CCN(CC(=O)N2N=C(c3ccco3)C[C@H]2c2cccs2)C1	ZINC000819280856	FE	On-Demand	Anodyne	SLC6A1	42	35
O=C(O)[C@@H]1CCN(CC(=O)N2N=C(c3ccco3)C[C@H]2c2cccs2)C1	ZINC000819280857	FE	On-Demand	Anodyne	SLC6A1	42	35
O=C(O)[C@@H]1CCN(CC(=O)N2N=C(c3ccco3)C[C@@H]2c2cccs2)C1	ZINC000819280858	FE	On-Demand	Anodyne	SLC6A1	42	35
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(Cl)cc2)C1	ZINC000819280859	CE	On-Demand	Anodyne	SLC6A1	63	38
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(Cl)cc2)C1	ZINC000819280859	CE	On-Demand	Anodyne	NPY2R	38	45
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(Cl)cc2)C1	ZINC000819280859	CE	On-Demand	Anodyne	EPHX2	36	43
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccccc2NC(=O)c2ccsc2)c1	ZINC000819280860	JK	On-Demand	Anodyne	PPIA	31	44
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccccc2NC(=O)c2ccsc2)c1	ZINC000819280860	JK	On-Demand	Anodyne	PRNP	16	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccccc2NC(=O)c2ccsc2)c1	ZINC000819280860	JK	On-Demand	Anodyne	GRM4	24	47
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccccc2NC(=O)c2ccsc2)c1	ZINC000819280860	JK	On-Demand	Anodyne	NR1H4	21	53
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccccc2NC(=O)c2ccsc2)c1	ZINC000819280860	JK	On-Demand	Anodyne	SMO	22	41
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccccc2NC(=O)c2ccsc2)c1	ZINC000819280860	JK	On-Demand	Anodyne	KCNK3	138	70
O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccccc2NC(=O)c2ccsc2)c1	ZINC000819280860	JK	On-Demand	Anodyne	KCNK9	93	45
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(Cl)cc2)C1	ZINC000819280861	CE	On-Demand	Anodyne	SLC6A1	63	38
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(Cl)cc2)C1	ZINC000819280861	CE	On-Demand	Anodyne	NPY2R	38	45
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(Cl)cc2)C1	ZINC000819280861	CE	On-Demand	Anodyne	EPHX2	36	43
O=C(O)[C@@H]1CCN(CCC(=O)N2CCc3sccc3C2)C1	ZINC000819280862	DD	On-Demand	Anodyne	SLC6A1	143	40
O=C(O)[C@H]1CCN(CCC(=O)N2CCc3sccc3C2)C1	ZINC000819280863	DD	On-Demand	Anodyne	SLC6A1	143	40
O=C(O)[C@H]1CCN(C[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819280865	CD	On-Demand	Anodyne	SLC6A1	143	45
O=C(O)[C@H]1CCN(C[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819280865	CD	On-Demand	Anodyne	OPRK1	30	41
O=C(O)[C@H]1CCN(C[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819280865	CD	On-Demand	Anodyne	SLC6A3	15	44
O=C(O)[C@H]1CCN(C[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819280865	CD	On-Demand	Anodyne	ADRB3	39	41
O=C(O)[C@H]1CCN(C[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819280865	CD	On-Demand	Anodyne	CCR5	33	41
O=C(O)[C@H]1CCN(C[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819280865	CD	On-Demand	Anodyne	CYP3A4	42	34
O=C(O)[C@H]1CCN(C[C@H](O)c2cccc(Cl)c2)C1	ZINC000819280866	CD	On-Demand	Anodyne	SLC6A1	143	45
O=C(O)[C@H]1CCN(C[C@H](O)c2cccc(Cl)c2)C1	ZINC000819280866	CD	On-Demand	Anodyne	OPRK1	30	41
O=C(O)[C@H]1CCN(C[C@H](O)c2cccc(Cl)c2)C1	ZINC000819280866	CD	On-Demand	Anodyne	SLC6A3	15	44
O=C(O)[C@H]1CCN(C[C@H](O)c2cccc(Cl)c2)C1	ZINC000819280866	CD	On-Demand	Anodyne	ADRB3	39	41
O=C(O)[C@H]1CCN(C[C@H](O)c2cccc(Cl)c2)C1	ZINC000819280866	CD	On-Demand	Anodyne	CCR5	33	41
O=C(O)[C@H]1CCN(C[C@H](O)c2cccc(Cl)c2)C1	ZINC000819280866	CD	On-Demand	Anodyne	CYP3A4	42	34
O=C(O)[C@@H]1CCN(C[C@H](O)c2cccc(Cl)c2)C1	ZINC000819280867	CD	On-Demand	Anodyne	SLC6A1	143	45
O=C(O)[C@@H]1CCN(C[C@H](O)c2cccc(Cl)c2)C1	ZINC000819280867	CD	On-Demand	Anodyne	OPRK1	30	41
O=C(O)[C@@H]1CCN(C[C@H](O)c2cccc(Cl)c2)C1	ZINC000819280867	CD	On-Demand	Anodyne	SLC6A3	15	44
O=C(O)[C@@H]1CCN(C[C@H](O)c2cccc(Cl)c2)C1	ZINC000819280867	CD	On-Demand	Anodyne	ADRB3	39	41
O=C(O)[C@@H]1CCN(C[C@H](O)c2cccc(Cl)c2)C1	ZINC000819280867	CD	On-Demand	Anodyne	CCR5	33	41
O=C(O)[C@@H]1CCN(C[C@H](O)c2cccc(Cl)c2)C1	ZINC000819280867	CD	On-Demand	Anodyne	CYP3A4	42	34
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819280869	CD	On-Demand	Anodyne	SLC6A1	143	45
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819280869	CD	On-Demand	Anodyne	OPRK1	30	41
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819280869	CD	On-Demand	Anodyne	SLC6A3	15	44
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819280869	CD	On-Demand	Anodyne	ADRB3	39	41
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819280869	CD	On-Demand	Anodyne	CCR5	33	41
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819280869	CD	On-Demand	Anodyne	CYP3A4	42	34
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccccc2F)C1	ZINC000819280873	CD	On-Demand	Anodyne	SLC6A1	164	46
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccccc2F)C1	ZINC000819280873	CD	On-Demand	Anodyne	S1PR1	17	40
O=C(O)[C@H]1CCN(C[C@H](O)c2ccccc2F)C1	ZINC000819280874	CD	On-Demand	Anodyne	SLC6A1	164	46
O=C(O)[C@H]1CCN(C[C@H](O)c2ccccc2F)C1	ZINC000819280874	CD	On-Demand	Anodyne	S1PR1	17	40
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccccc2F)C1	ZINC000819280876	CD	On-Demand	Anodyne	SLC6A1	164	46
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccccc2F)C1	ZINC000819280876	CD	On-Demand	Anodyne	S1PR1	17	40
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccccc2F)C1	ZINC000819280878	CD	On-Demand	Anodyne	SLC6A1	164	46
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccccc2F)C1	ZINC000819280878	CD	On-Demand	Anodyne	S1PR1	17	40
O=C(O)[C@@H]1CCN(CC#Cc2ccc(Cl)cc2)C1	ZINC000819280879	CE	On-Demand	Mild	SLC6A1	128	42
O=C(O)[C@@H]1CCN(CC#Cc2ccc(Cl)cc2)C1	ZINC000819280879	CE	On-Demand	Mild	GRIN2C	17	43
O=C(O)[C@H]1CCN(CC#Cc2ccc(Cl)cc2)C1	ZINC000819280881	CE	On-Demand	Mild	SLC6A1	128	42
O=C(O)[C@H]1CCN(CC#Cc2ccc(Cl)cc2)C1	ZINC000819280881	CE	On-Demand	Mild	GRIN2C	17	43
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819280883	DE	On-Demand	Anodyne	SLC6A1	105	40
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819280883	DE	On-Demand	Anodyne	CCR5	24	44
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819280883	DE	On-Demand	Anodyne	LIPG	50	35
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819280887	DE	On-Demand	Anodyne	SLC6A1	105	40
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819280887	DE	On-Demand	Anodyne	CCR5	24	44
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819280887	DE	On-Demand	Anodyne	LIPG	50	35
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819280889	DE	On-Demand	Anodyne	SLC6A1	105	40
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819280889	DE	On-Demand	Anodyne	CCR5	24	44
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819280889	DE	On-Demand	Anodyne	LIPG	50	35
O=C(O)C1CCN(C[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819280891	DD	On-Demand	Anodyne	ADRB2	21	58
O=C(O)C1CCN(C[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819280891	DD	On-Demand	Anodyne	ADRB1	23	50
O=C(O)C1CCN(C[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819280891	DD	On-Demand	Anodyne	HTR1A	22	63
O=C(O)C1CCN(C[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819280891	DD	On-Demand	Anodyne	SLC6A4	23	49
O=C(O)C1CCN(C[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819280891	DD	On-Demand	Anodyne	ACOX1	33	42
O=C(O)C1CCN(C[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819280891	DD	On-Demand	Anodyne	ABCB1	84	46
O=C(O)C1CCN(C[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819280895	DD	On-Demand	Anodyne	ADRB2	21	58
O=C(O)C1CCN(C[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819280895	DD	On-Demand	Anodyne	ADRB1	23	50
O=C(O)C1CCN(C[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819280895	DD	On-Demand	Anodyne	HTR1A	22	63
O=C(O)C1CCN(C[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819280895	DD	On-Demand	Anodyne	SLC6A4	23	49
O=C(O)C1CCN(C[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819280895	DD	On-Demand	Anodyne	ACOX1	33	42
O=C(O)C1CCN(C[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819280895	DD	On-Demand	Anodyne	ABCB1	84	46
COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1C	ZINC000819280896	JK	On-Demand	Reactive	CA12	15	42
O=C(O)[C@@H]1CCN(CC(=O)C23CC4CC(CC(C4)C2)C3)C1	ZINC000819280897	CE	On-Demand	Anodyne	SLC6A1	49	33
O=C(O)[C@H]1CCN(CC(=O)C23CC4CC(CC(C4)C2)C3)C1	ZINC000819280898	CE	On-Demand	Anodyne	SLC6A1	49	33
O=C(O)[C@H]1CCN(CC(=O)N2N=C(c3cccs3)C[C@@H]2c2cccs2)C1	ZINC000819280900	GF	On-Demand	Anodyne	SLC6A1	41	38
O=C(O)[C@H]1CCN(CC(=O)N2N=C(c3cccs3)C[C@H]2c2cccs2)C1	ZINC000819280902	GF	On-Demand	Anodyne	SLC6A1	41	38
COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c1C	ZINC000819280903	JK	On-Demand	Reactive	CA12	15	42
O=C(O)[C@@H]1CCN(CC(=O)N2N=C(c3cccs3)C[C@H]2c2cccs2)C1	ZINC000819280904	GF	On-Demand	Anodyne	SLC6A1	41	38
O=C(O)[C@@H]1CCN(CC(=O)N2N=C(c3cccs3)C[C@@H]2c2cccs2)C1	ZINC000819280905	GF	On-Demand	Anodyne	SLC6A1	41	38
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819280908	CD	On-Demand	Anodyne	HTR2A	20	44
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819280908	CD	On-Demand	Anodyne	SLC6A1	139	48
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819280908	CD	On-Demand	Anodyne	SLC6A4	15	46
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819280908	CD	On-Demand	Anodyne	SLC6A3	46	46
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819280908	CD	On-Demand	Anodyne	SIGMAR1	19	47
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819280908	CD	On-Demand	Anodyne	CCR3	19	40
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819280908	CD	On-Demand	Anodyne	CCR5	20	41
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819280908	CD	On-Demand	Anodyne	SLC18A3	22	43
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819280908	CD	On-Demand	Anodyne	CACNA1G	40	37
O=C(O)[C@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819280910	CD	On-Demand	Anodyne	HTR2A	20	44
O=C(O)[C@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819280910	CD	On-Demand	Anodyne	SLC6A1	139	48
O=C(O)[C@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819280910	CD	On-Demand	Anodyne	SLC6A4	15	46
O=C(O)[C@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819280910	CD	On-Demand	Anodyne	SLC6A3	46	46
O=C(O)[C@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819280910	CD	On-Demand	Anodyne	SIGMAR1	19	47
O=C(O)[C@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819280910	CD	On-Demand	Anodyne	CCR3	19	40
O=C(O)[C@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819280910	CD	On-Demand	Anodyne	CCR5	20	41
O=C(O)[C@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819280910	CD	On-Demand	Anodyne	SLC18A3	22	43
O=C(O)[C@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819280910	CD	On-Demand	Anodyne	CACNA1G	40	37
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819280912	CD	On-Demand	Anodyne	HTR2A	20	44
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819280912	CD	On-Demand	Anodyne	SLC6A1	139	48
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819280912	CD	On-Demand	Anodyne	SLC6A4	15	46
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819280912	CD	On-Demand	Anodyne	SLC6A3	46	46
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819280912	CD	On-Demand	Anodyne	SIGMAR1	19	47
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819280912	CD	On-Demand	Anodyne	CCR3	19	40
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819280912	CD	On-Demand	Anodyne	CCR5	20	41
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819280912	CD	On-Demand	Anodyne	SLC18A3	22	43
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819280912	CD	On-Demand	Anodyne	CACNA1G	40	37
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819280914	CD	On-Demand	Anodyne	HTR2A	20	44
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819280914	CD	On-Demand	Anodyne	SLC6A1	139	48
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819280914	CD	On-Demand	Anodyne	SLC6A4	15	46
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819280914	CD	On-Demand	Anodyne	SLC6A3	46	46
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819280914	CD	On-Demand	Anodyne	SIGMAR1	19	47
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819280914	CD	On-Demand	Anodyne	CCR3	19	40
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819280914	CD	On-Demand	Anodyne	CCR5	20	41
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819280914	CD	On-Demand	Anodyne	SLC18A3	22	43
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819280914	CD	On-Demand	Anodyne	CACNA1G	40	37
O=C(O)[C@H]1CCN(CC(=O)N2CCC(OCc3ccccc3)CC2)C1	ZINC000819280916	ED	On-Demand	Anodyne	SLC6A1	150	41
O=C(O)[C@H]1CCN(CC(=O)N2CCC(OCc3ccccc3)CC2)C1	ZINC000819280916	ED	On-Demand	Anodyne	GRIN2B	37	48
O=C(O)[C@H]1CCN(CC(=O)N2CCC(OCc3ccccc3)CC2)C1	ZINC000819280916	ED	On-Demand	Anodyne	MAPK1	21	42
O=C(O)[C@H]1CCN(CC(=O)N2CCC(OCc3ccccc3)CC2)C1	ZINC000819280916	ED	On-Demand	Anodyne	LIPG	36	42
O=C(/C=C\[C@H]1CCCO1)NCCCCn1ccnc1	ZINC000819280917	CD	On-Demand	Anodyne	TBXAS1	34	44
O=C(/C=C\[C@H]1CCCO1)NCCCCn1ccnc1	ZINC000819280917	CD	On-Demand	Anodyne	QPCT	34	45
O=C(O)[C@@H]1CCN(CC(=O)N2CCC(OCc3ccccc3)CC2)C1	ZINC000819280918	ED	On-Demand	Anodyne	SLC6A1	150	41
O=C(O)[C@@H]1CCN(CC(=O)N2CCC(OCc3ccccc3)CC2)C1	ZINC000819280918	ED	On-Demand	Anodyne	GRIN2B	37	48
O=C(O)[C@@H]1CCN(CC(=O)N2CCC(OCc3ccccc3)CC2)C1	ZINC000819280918	ED	On-Demand	Anodyne	MAPK1	21	42
O=C(O)[C@@H]1CCN(CC(=O)N2CCC(OCc3ccccc3)CC2)C1	ZINC000819280918	ED	On-Demand	Anodyne	LIPG	36	42
O=C(/C=C/[C@@H]1CCCO1)NCCCCn1ccnc1	ZINC000819280919	CD	On-Demand	Anodyne	TBXAS1	34	44
O=C(/C=C/[C@@H]1CCCO1)NCCCCn1ccnc1	ZINC000819280919	CD	On-Demand	Anodyne	QPCT	34	45
O=C(O)[C@@H]1CCN(CC(=O)N2CCC[C@@H](C(F)(F)F)C2)C1	ZINC000819280920	DD	On-Demand	Anodyne	SLC6A1	78	37
O=C(/C=C\[C@@H]1CCCO1)NCCCCn1ccnc1	ZINC000819280921	CD	On-Demand	Anodyne	TBXAS1	34	44
O=C(/C=C\[C@@H]1CCCO1)NCCCCn1ccnc1	ZINC000819280921	CD	On-Demand	Anodyne	QPCT	34	45
O=C(/C=C/[C@H]1CCCO1)NCCCCn1ccnc1	ZINC000819280922	CD	On-Demand	Anodyne	TBXAS1	34	44
O=C(/C=C/[C@H]1CCCO1)NCCCCn1ccnc1	ZINC000819280922	CD	On-Demand	Anodyne	QPCT	34	45
O=C(O)[C@H]1CCN(CC(=O)N2CCC[C@H](C(F)(F)F)C2)C1	ZINC000819280923	DD	On-Demand	Anodyne	SLC6A1	78	37
O=C(O)[C@H]1CCN(CC(=O)N2CCC[C@@H](C(F)(F)F)C2)C1	ZINC000819280925	DD	On-Demand	Anodyne	SLC6A1	78	37
O=C(O)[C@@H]1CCN(CC(=O)N2CCC[C@H](C(F)(F)F)C2)C1	ZINC000819280927	DD	On-Demand	Anodyne	SLC6A1	78	37
O=C(O)[C@@H]1CCN(CCC(=O)N2CCN(c3ncccn3)CC2)C1	ZINC000819280929	EB	On-Demand	Anodyne	SLC6A1	143	38
O=C(O)[C@H]1CCN(CCC(=O)N2CCN(c3ncccn3)CC2)C1	ZINC000819280931	EB	On-Demand	Anodyne	SLC6A1	143	38
O=C(O)[C@H]1CCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280933	DE	On-Demand	Anodyne	SLC6A1	120	42
O=C(O)[C@H]1CCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280933	DE	On-Demand	Anodyne	OPRK1	26	45
O=C(O)[C@H]1CCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280933	DE	On-Demand	Anodyne	CACNA1B	41	36
O=C(O)[C@H]1CCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280933	DE	On-Demand	Anodyne	CCR5	33	44
O=C(O)[C@H]1CCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280933	DE	On-Demand	Anodyne	CCR2	77	41
O=C(O)[C@H]1CCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280933	DE	On-Demand	Anodyne	LIPG	51	35
O=C(O)[C@H]1CCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280935	DE	On-Demand	Anodyne	SLC6A1	120	42
O=C(O)[C@H]1CCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280935	DE	On-Demand	Anodyne	OPRK1	26	45
O=C(O)[C@H]1CCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280935	DE	On-Demand	Anodyne	CACNA1B	41	36
O=C(O)[C@H]1CCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280935	DE	On-Demand	Anodyne	CCR5	33	44
O=C(O)[C@H]1CCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280935	DE	On-Demand	Anodyne	CCR2	77	41
O=C(O)[C@H]1CCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280935	DE	On-Demand	Anodyne	LIPG	51	35
O=C(O)[C@@H]1CCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280936	DE	On-Demand	Anodyne	SLC6A1	120	42
O=C(O)[C@@H]1CCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280936	DE	On-Demand	Anodyne	OPRK1	26	45
O=C(O)[C@@H]1CCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280936	DE	On-Demand	Anodyne	CACNA1B	41	36
O=C(O)[C@@H]1CCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280936	DE	On-Demand	Anodyne	CCR5	33	44
O=C(O)[C@@H]1CCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280936	DE	On-Demand	Anodyne	CCR2	77	41
O=C(O)[C@@H]1CCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280936	DE	On-Demand	Anodyne	LIPG	51	35
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280937	DE	On-Demand	Anodyne	SLC6A1	120	42
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280937	DE	On-Demand	Anodyne	OPRK1	26	45
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280937	DE	On-Demand	Anodyne	CACNA1B	41	36
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280937	DE	On-Demand	Anodyne	CCR5	33	44
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280937	DE	On-Demand	Anodyne	CCR2	77	41
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819280937	DE	On-Demand	Anodyne	LIPG	51	35
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(F)(F)C1	ZINC000819280944	GH	On-Demand	Anodyne	CTSD	121	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(F)(F)C1	ZINC000819280944	GH	On-Demand	Anodyne	PGC	67	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(F)(F)C1	ZINC000819280944	GH	On-Demand	Anodyne	CMA1	31	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(F)(F)C1	ZINC000819280944	GH	On-Demand	Anodyne	CTRA_BOVIN	15	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(F)(F)C1	ZINC000819280944	GH	On-Demand	Anodyne	PAPA1_CARPA	29	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(F)(F)C1	ZINC000819280944	GH	On-Demand	Anodyne	CTSK	17	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(F)(F)C1	ZINC000819280944	GH	On-Demand	Anodyne	PGA	45	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(F)(F)C1	ZINC000819280944	GH	On-Demand	Anodyne	BACE2	56	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(F)(F)C1	ZINC000819280944	GH	On-Demand	Anodyne	TIMP3	69	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(F)(F)C1	ZINC000819280944	GH	On-Demand	Anodyne	REN	109	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(F)(F)C1	ZINC000819280944	GH	On-Demand	Anodyne	REN1	31	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(F)(F)C1	ZINC000819280944	GH	On-Demand	Anodyne	BACE1	105	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(F)(F)C1	ZINC000819280944	GH	On-Demand	Anodyne	FPR1	57	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(F)(F)C1	ZINC000819280944	GH	On-Demand	Anodyne	PLM1_PLAFA	30	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCC(F)(F)C1	ZINC000819280944	GH	On-Demand	Anodyne	Q82323_9DELA	59	31
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(F)(F)C1	ZINC000819280946	GH	On-Demand	Anodyne	CTSD	121	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(F)(F)C1	ZINC000819280946	GH	On-Demand	Anodyne	PGC	67	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(F)(F)C1	ZINC000819280946	GH	On-Demand	Anodyne	CMA1	31	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(F)(F)C1	ZINC000819280946	GH	On-Demand	Anodyne	CTRA_BOVIN	15	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(F)(F)C1	ZINC000819280946	GH	On-Demand	Anodyne	PAPA1_CARPA	29	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(F)(F)C1	ZINC000819280946	GH	On-Demand	Anodyne	CTSK	17	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(F)(F)C1	ZINC000819280946	GH	On-Demand	Anodyne	PGA	45	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(F)(F)C1	ZINC000819280946	GH	On-Demand	Anodyne	BACE2	56	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(F)(F)C1	ZINC000819280946	GH	On-Demand	Anodyne	TIMP3	69	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(F)(F)C1	ZINC000819280946	GH	On-Demand	Anodyne	REN	109	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(F)(F)C1	ZINC000819280946	GH	On-Demand	Anodyne	REN1	31	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(F)(F)C1	ZINC000819280946	GH	On-Demand	Anodyne	BACE1	105	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(F)(F)C1	ZINC000819280946	GH	On-Demand	Anodyne	FPR1	57	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(F)(F)C1	ZINC000819280946	GH	On-Demand	Anodyne	PLM1_PLAFA	30	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCC(F)(F)C1	ZINC000819280946	GH	On-Demand	Anodyne	Q82323_9DELA	59	31
O=C(O)[C@@H]1CCN(C(=O)c2cnn(-c3ccccc3F)c2-n2cccc2)C1	ZINC000819280947	FE	On-Demand	Anodyne	SLC6A1	46	35
O=C(O)[C@H]1CCN(C(=O)c2cnn(-c3ccccc3F)c2-n2cccc2)C1	ZINC000819280949	FE	On-Demand	Anodyne	SLC6A1	46	35
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc3c(c2)OCCO3)C1	ZINC000819280951	DD	On-Demand	Anodyne	NPY2R	31	40
O=C(O)[C@H]1CCN(C(=S)Nc2ccc3c(c2)OCCO3)C1	ZINC000819280955	DD	On-Demand	Anodyne	NPY2R	31	40
O=C(O)[C@@H]1CCN(C(=S)NCc2cccs2)C1	ZINC000819280957	CD	On-Demand	Anodyne	SLC6A1	76	37
O=C(O)[C@@H]1CCN(C(=S)NCc2cccs2)C1	ZINC000819280957	CD	On-Demand	Anodyne	DPP7	37	48
O=C(O)[C@H]1CCN(C(=S)NCc2cccs2)C1	ZINC000819280960	CD	On-Demand	Anodyne	SLC6A1	76	37
O=C(O)[C@H]1CCN(C(=S)NCc2cccs2)C1	ZINC000819280960	CD	On-Demand	Anodyne	DPP7	37	48
O=C(O)[C@@H]1CCN(C(=S)Nc2cccc(Cl)c2)C1	ZINC000819280961	CE	On-Demand	Anodyne	SLC6A1	54	41
O=C(O)[C@@H]1CCN(C(=S)Nc2cccc(Cl)c2)C1	ZINC000819280961	CE	On-Demand	Anodyne	NPY2R	44	40
O=C(O)[C@@H]1CCN(C(=S)Nc2cccc(Cl)c2)C1	ZINC000819280961	CE	On-Demand	Anodyne	GRM5	16	42
O=C(O)[C@@H]1CCN(C(=S)Nc2cccc(Cl)c2)C1	ZINC000819280961	CE	On-Demand	Anodyne	EPHX2	20	47
O=C(O)[C@H]1CCN(C(=S)Nc2cccc(Cl)c2)C1	ZINC000819280963	CE	On-Demand	Anodyne	SLC6A1	54	41
O=C(O)[C@H]1CCN(C(=S)Nc2cccc(Cl)c2)C1	ZINC000819280963	CE	On-Demand	Anodyne	NPY2R	44	40
O=C(O)[C@H]1CCN(C(=S)Nc2cccc(Cl)c2)C1	ZINC000819280963	CE	On-Demand	Anodyne	GRM5	16	42
O=C(O)[C@H]1CCN(C(=S)Nc2cccc(Cl)c2)C1	ZINC000819280963	CE	On-Demand	Anodyne	EPHX2	20	47
O=C(O)[C@H]1CCN(CCC(=O)N2CCOCC2)C1	ZINC000819280965	CB	On-Demand	Anodyne	SLC6A1	92	36
O=C(O)[C@@H]1CCN(CCC(=O)N2CCOCC2)C1	ZINC000819280967	CB	On-Demand	Anodyne	SLC6A1	92	36
O=C(O)[C@H]1CCN(C[C@@H](O)c2cccc(Br)c2)C1	ZINC000819280969	DD	On-Demand	Anodyne	SLC6A1	146	44
O=C(O)[C@H]1CCN(C[C@@H](O)c2cccc(Br)c2)C1	ZINC000819280969	DD	On-Demand	Anodyne	OPRK1	24	40
O=C(O)[C@H]1CCN(C[C@@H](O)c2cccc(Br)c2)C1	ZINC000819280969	DD	On-Demand	Anodyne	SLC18A3	17	50
O=C(O)[C@H]1CCN(C[C@H](O)c2cccc(Br)c2)C1	ZINC000819280970	DD	On-Demand	Anodyne	SLC6A1	146	44
O=C(O)[C@H]1CCN(C[C@H](O)c2cccc(Br)c2)C1	ZINC000819280970	DD	On-Demand	Anodyne	OPRK1	24	40
O=C(O)[C@H]1CCN(C[C@H](O)c2cccc(Br)c2)C1	ZINC000819280970	DD	On-Demand	Anodyne	SLC18A3	17	50
O=C(O)[C@@H]1CCN(C[C@H](O)c2cccc(Br)c2)C1	ZINC000819280973	DD	On-Demand	Anodyne	SLC6A1	146	44
O=C(O)[C@@H]1CCN(C[C@H](O)c2cccc(Br)c2)C1	ZINC000819280973	DD	On-Demand	Anodyne	OPRK1	24	40
O=C(O)[C@@H]1CCN(C[C@H](O)c2cccc(Br)c2)C1	ZINC000819280973	DD	On-Demand	Anodyne	SLC18A3	17	50
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cccc(Br)c2)C1	ZINC000819280974	DD	On-Demand	Anodyne	SLC6A1	146	44
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cccc(Br)c2)C1	ZINC000819280974	DD	On-Demand	Anodyne	OPRK1	24	40
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cccc(Br)c2)C1	ZINC000819280974	DD	On-Demand	Anodyne	SLC18A3	17	50
O=C(O)[C@H]1CCN(C(=S)NCCN2CCOCC2)C1	ZINC000819280978	CB	On-Demand	Anodyne	SLC6A1	41	32
CCOc1cccc([C@@H]2C[C@H]2NC[C@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819281026	FF	On-Demand	Anodyne	PDS	52	33
CCOc1cccc([C@@H]2C[C@H]2NC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819281027	FF	On-Demand	Anodyne	PDS	52	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccc(OC)cc13)C2	ZINC000819281028	GF	On-Demand	Anodyne	HTR1D	40	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccc(OC)cc13)C2	ZINC000819281028	GF	On-Demand	Anodyne	HTR1B	39	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccc(OC)cc13)C2	ZINC000819281028	GF	On-Demand	Anodyne	NQO2	39	56
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccc(OC)cc13)C2	ZINC000819281028	GF	On-Demand	Anodyne	MTNR1A	103	56
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccc(OC)cc13)C2	ZINC000819281028	GF	On-Demand	Anodyne	MTNR1B	77	56
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccc(OC)cc13)C2	ZINC000819281028	GF	On-Demand	Anodyne	ABCG2	26	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccc(OC)cc13)C2	ZINC000819281029	GF	On-Demand	Anodyne	HTR1D	40	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccc(OC)cc13)C2	ZINC000819281029	GF	On-Demand	Anodyne	HTR1B	39	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccc(OC)cc13)C2	ZINC000819281029	GF	On-Demand	Anodyne	NQO2	39	56
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccc(OC)cc13)C2	ZINC000819281029	GF	On-Demand	Anodyne	MTNR1A	103	56
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccc(OC)cc13)C2	ZINC000819281029	GF	On-Demand	Anodyne	MTNR1B	77	56
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccc(OC)cc13)C2	ZINC000819281029	GF	On-Demand	Anodyne	ABCG2	26	42
CCOc1cccc([C@@H]2C[C@H]2NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819281052	EH	On-Demand	Anodyne	ADRB3	20	40
CCOc1cccc([C@@H]2C[C@H]2NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819281052	EH	On-Demand	Anodyne	PDS	47	34
O[C@@H](CN[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1)c1cccnc1	ZINC000819281068	DF	On-Demand	Anodyne	ADRB3	58	41
O[C@H](CN[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1)c1cccnc1	ZINC000819281069	DF	On-Demand	Anodyne	ADRB3	58	41
CN(C[C@@H](O)CN[C@@H]1C[C@H]1c1cccc(Cl)c1)C(=O)OC(C)(C)C	ZINC000819281074	FG	On-Demand	Anodyne	MDM2	85	38
CN(C[C@H](O)CN[C@@H]1C[C@H]1c1cccc(Cl)c1)C(=O)OC(C)(C)C	ZINC000819281075	FG	On-Demand	Anodyne	MDM2	85	38
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(Cl)cc1)c1ccc(F)cc1	ZINC000819281080	DH	On-Demand	Anodyne	SLC6A3	31	44
O[C@H](CN[C@@H]1C[C@H]1c1ccc(Cl)cc1)c1ccc(F)cc1	ZINC000819281081	DH	On-Demand	Anodyne	SLC6A3	31	44
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(Cl)cc1)c1ccccc1	ZINC000819281090	CH	On-Demand	Anodyne	SLC6A3	35	42
O[C@H](CN[C@@H]1C[C@H]1c1ccc(Cl)cc1)c1ccccc1	ZINC000819281091	CH	On-Demand	Anodyne	SLC6A3	35	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](C#N)c1ccccc1Br	ZINC000819281101	GG	On-Demand	Mild	PAPA1_CARPA	33	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](C#N)c1ccccc1Br	ZINC000819281102	GG	On-Demand	Mild	PAPA1_CARPA	33	44
O=C(O)[C@@H]1CCN(C(=S)NCCN2CCOCC2)C1	ZINC000819281121	CB	On-Demand	Anodyne	SLC6A1	41	32
O=C(O)[C@@H]1CCN(C[C@@H](O)COCc2cccs2)C1	ZINC000819281124	CD	On-Demand	Anodyne	SLC6A1	97	40
O=C(O)[C@@H]1CCN(C[C@H](O)COCc2cccs2)C1	ZINC000819281125	CD	On-Demand	Anodyne	SLC6A1	97	40
O=C(O)[C@H]1CCN(C[C@H](O)COCc2cccs2)C1	ZINC000819281126	CD	On-Demand	Anodyne	SLC6A1	97	40
O=C(O)[C@H]1CCN(C[C@@H](O)COCc2cccs2)C1	ZINC000819281127	CD	On-Demand	Anodyne	SLC6A1	97	40
O=C(O)[C@H]1CCN(C[C@@H](O)c2cccc(F)c2)C1	ZINC000819281130	CD	On-Demand	Anodyne	SLC6A1	154	55
O=C(O)[C@H]1CCN(C[C@@H](O)c2cccc(F)c2)C1	ZINC000819281130	CD	On-Demand	Anodyne	OPRK1	26	41
O=C(O)[C@H]1CCN(C[C@@H](O)c2cccc(F)c2)C1	ZINC000819281130	CD	On-Demand	Anodyne	SLC6A3	15	46
O=C(O)[C@H]1CCN(C[C@@H](O)c2cccc(F)c2)C1	ZINC000819281130	CD	On-Demand	Anodyne	CCR5	98	41
O=C(O)[C@H]1CCN(C[C@H](O)c2cccc(F)c2)C1	ZINC000819281131	CD	On-Demand	Anodyne	SLC6A1	154	55
O=C(O)[C@H]1CCN(C[C@H](O)c2cccc(F)c2)C1	ZINC000819281131	CD	On-Demand	Anodyne	OPRK1	26	41
O=C(O)[C@H]1CCN(C[C@H](O)c2cccc(F)c2)C1	ZINC000819281131	CD	On-Demand	Anodyne	SLC6A3	15	46
O=C(O)[C@H]1CCN(C[C@H](O)c2cccc(F)c2)C1	ZINC000819281131	CD	On-Demand	Anodyne	CCR5	98	41
O=C(O)[C@@H]1CCN(C[C@H](O)c2cccc(F)c2)C1	ZINC000819281132	CD	On-Demand	Anodyne	SLC6A1	154	55
O=C(O)[C@@H]1CCN(C[C@H](O)c2cccc(F)c2)C1	ZINC000819281132	CD	On-Demand	Anodyne	OPRK1	26	41
O=C(O)[C@@H]1CCN(C[C@H](O)c2cccc(F)c2)C1	ZINC000819281132	CD	On-Demand	Anodyne	SLC6A3	15	46
O=C(O)[C@@H]1CCN(C[C@H](O)c2cccc(F)c2)C1	ZINC000819281132	CD	On-Demand	Anodyne	CCR5	98	41
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cccc(F)c2)C1	ZINC000819281133	CD	On-Demand	Anodyne	SLC6A1	154	55
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cccc(F)c2)C1	ZINC000819281133	CD	On-Demand	Anodyne	OPRK1	26	41
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cccc(F)c2)C1	ZINC000819281133	CD	On-Demand	Anodyne	SLC6A3	15	46
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cccc(F)c2)C1	ZINC000819281133	CD	On-Demand	Anodyne	CCR5	98	41
O=C(O)[C@@H]1CCN(CC(=O)N2CCN(C(=O)c3ccco3)CC2)C1	ZINC000819281134	EB	On-Demand	Anodyne	SLC6A1	85	38
O=C(O)[C@@H]1CCN(CC(=O)N2CCN(C(=O)c3ccco3)CC2)C1	ZINC000819281134	EB	On-Demand	Anodyne	MAPK1	22	42
O=C(O)[C@H]1CCN(CC(=O)N2CCN(C(=O)c3ccco3)CC2)C1	ZINC000819281135	EB	On-Demand	Anodyne	SLC6A1	85	38
O=C(O)[C@H]1CCN(CC(=O)N2CCN(C(=O)c3ccco3)CC2)C1	ZINC000819281135	EB	On-Demand	Anodyne	MAPK1	22	42
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(OC(F)F)cc2)C1	ZINC000819281136	DE	On-Demand	Anodyne	NPY2R	26	40
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(OC(F)F)cc2)C1	ZINC000819281137	DE	On-Demand	Anodyne	NPY2R	26	40
O=C(O)[C@@H]1CCN(C(=S)Nc2cccc(Br)c2)C1	ZINC000819281139	EF	On-Demand	Anodyne	NPY2R	31	42
O=C(O)[C@@H]1CCN(C(=S)Nc2cccc(Br)c2)C1	ZINC000819281139	EF	On-Demand	Anodyne	LIMK2	20	42
O=C(O)[C@H]1CCN(C(=S)Nc2cccc(Br)c2)C1	ZINC000819281140	EF	On-Demand	Anodyne	NPY2R	31	42
O=C(O)[C@H]1CCN(C(=S)Nc2cccc(Br)c2)C1	ZINC000819281140	EF	On-Demand	Anodyne	LIMK2	20	42
O=C(O)[C@H]1CCN(C[C@@H]2CC2(Cl)Cl)C1	ZINC000819281145	BD	On-Demand	Anodyne	SLC6A1	54	33
O=C(O)[C@H]1CCN(C[C@H]2CC2(Cl)Cl)C1	ZINC000819281146	BD	On-Demand	Anodyne	SLC6A1	54	33
O=C(O)[C@@H]1CCN(C[C@H]2CC2(Cl)Cl)C1	ZINC000819281147	BD	On-Demand	Anodyne	SLC6A1	54	33
O=C(O)[C@@H]1CCN(C[C@@H]2CC2(Cl)Cl)C1	ZINC000819281148	BD	On-Demand	Anodyne	SLC6A1	54	33
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(F)c(Cl)c2)C1	ZINC000819281149	DF	On-Demand	Anodyne	SLC6A1	69	38
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(F)c(Cl)c2)C1	ZINC000819281149	DF	On-Demand	Anodyne	NPY2R	80	43
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(F)c(Cl)c2)C1	ZINC000819281149	DF	On-Demand	Anodyne	EPHX2	28	43
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(F)c(Cl)c2)C1	ZINC000819281149	DF	On-Demand	Anodyne	ERBB4	44	35
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(F)c(Cl)c2)C1	ZINC000819281149	DF	On-Demand	Anodyne	MCHR1	29	41
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(F)c(Cl)c2)C1	ZINC000819281150	DF	On-Demand	Anodyne	SLC6A1	69	38
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(F)c(Cl)c2)C1	ZINC000819281150	DF	On-Demand	Anodyne	NPY2R	80	43
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(F)c(Cl)c2)C1	ZINC000819281150	DF	On-Demand	Anodyne	EPHX2	28	43
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(F)c(Cl)c2)C1	ZINC000819281150	DF	On-Demand	Anodyne	ERBB4	44	35
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(F)c(Cl)c2)C1	ZINC000819281150	DF	On-Demand	Anodyne	MCHR1	29	41
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281158	DC	On-Demand	Anodyne	SLC6A1	74	35
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281158	DC	On-Demand	Anodyne	EDNRB	81	37
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281158	DC	On-Demand	Anodyne	EDNRA	77	38
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281158	DC	On-Demand	Anodyne	ACOX1	73	33
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281158	DC	On-Demand	Anodyne	CCR1	40	34
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281158	DC	On-Demand	Anodyne	ABCB1	67	40
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281162	DC	On-Demand	Anodyne	SLC6A1	74	35
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281162	DC	On-Demand	Anodyne	EDNRB	81	37
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281162	DC	On-Demand	Anodyne	EDNRA	77	38
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281162	DC	On-Demand	Anodyne	ACOX1	73	33
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281162	DC	On-Demand	Anodyne	CCR1	40	34
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281162	DC	On-Demand	Anodyne	ABCB1	67	40
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281163	DC	On-Demand	Anodyne	SLC6A1	74	35
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281163	DC	On-Demand	Anodyne	EDNRB	81	37
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281163	DC	On-Demand	Anodyne	EDNRA	77	38
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281163	DC	On-Demand	Anodyne	ACOX1	73	33
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281163	DC	On-Demand	Anodyne	CCR1	40	34
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281163	DC	On-Demand	Anodyne	ABCB1	67	40
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281165	DC	On-Demand	Anodyne	SLC6A1	74	35
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281165	DC	On-Demand	Anodyne	EDNRB	81	37
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281165	DC	On-Demand	Anodyne	EDNRA	77	38
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281165	DC	On-Demand	Anodyne	ACOX1	73	33
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281165	DC	On-Demand	Anodyne	CCR1	40	34
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819281165	DC	On-Demand	Anodyne	ABCB1	67	40
O=C(O)[C@H]1CCN(CC(=O)N2CCC(C(=O)N3CCCC3)CC2)C1	ZINC000819281167	EC	On-Demand	Anodyne	SLC6A1	57	35
O=C(O)[C@@H]1CCN(CC(=O)N2CCC(C(=O)N3CCCC3)CC2)C1	ZINC000819281168	EC	On-Demand	Anodyne	SLC6A1	57	35
O[C@@H](CN[C@@H]1C[C@H]1c1ccccc1)c1cccc(Cl)c1	ZINC000819281170	CH	On-Demand	Anodyne	ADRB1	34	44
O[C@@H](CN[C@@H]1C[C@H]1c1ccccc1)c1cccc(Cl)c1	ZINC000819281170	CH	On-Demand	Anodyne	ADRB3	49	44
O[C@H](CN[C@@H]1C[C@H]1c1ccccc1)c1cccc(Cl)c1	ZINC000819281171	CH	On-Demand	Anodyne	ADRB1	34	44
O[C@H](CN[C@@H]1C[C@H]1c1ccccc1)c1cccc(Cl)c1	ZINC000819281171	CH	On-Demand	Anodyne	ADRB3	49	44
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	CHRM2	21	48
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	CHRM1	20	48
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	DRD2	28	55
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	DRD4	61	56
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	ACHE	44	48
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	SLC6A1	141	37
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	DRD3	22	55
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	CHRM3	27	48
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	LTA4H	22	41
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	HRH3	18	47
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	SIGMAR1	67	60
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	SSTR5	42	35
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	CCR1	15	40
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	CCR3	35	46
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	MLNR	48	39
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	S1PR1	18	44
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	EPHX2	28	49
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	S1PR5	24	44
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	MCHR1	51	48
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	CACNA1G	32	49
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	CCR8	21	42
O=C(O)[C@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281174	ED	On-Demand	Anodyne	BIRC2	19	40
CNC(=O)C[C@@H](NC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819281175	CD	On-Demand	Anodyne	ADRB2	21	43
CNC(=O)C[C@@H](NC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819281175	CD	On-Demand	Anodyne	ADRB1	25	51
CNC(=O)C[C@@H](NC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819281175	CD	On-Demand	Anodyne	ADRB3	92	51
CNC(=O)C[C@@H](NC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819281175	CD	On-Demand	Anodyne	KCNA5	25	42
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	CHRM2	21	48
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	CHRM1	20	48
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	DRD2	28	55
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	DRD4	61	56
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	ACHE	44	48
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	SLC6A1	141	37
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	DRD3	22	55
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	CHRM3	27	48
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	LTA4H	22	41
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	HRH3	18	47
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	SIGMAR1	67	60
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	SSTR5	42	35
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	CCR1	15	40
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	CCR3	35	46
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	MLNR	48	39
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	S1PR1	18	44
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	EPHX2	28	49
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	S1PR5	24	44
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	MCHR1	51	48
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	CACNA1G	32	49
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	CCR8	21	42
O=C(O)[C@@H]1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000819281176	ED	On-Demand	Anodyne	BIRC2	19	40
CNC(=O)C[C@H](NC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819281177	CD	On-Demand	Anodyne	ADRB2	21	43
CNC(=O)C[C@H](NC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819281177	CD	On-Demand	Anodyne	ADRB1	25	51
CNC(=O)C[C@H](NC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819281177	CD	On-Demand	Anodyne	ADRB3	92	51
CNC(=O)C[C@H](NC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819281177	CD	On-Demand	Anodyne	KCNA5	25	42
O=C(O)[C@H]1CCN(CC(=O)N(Cc2ccco2)CC(F)(F)F)C1	ZINC000819281178	ED	On-Demand	Anodyne	SLC6A1	94	35
CNC(=O)C[C@@H](NC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819281179	CD	On-Demand	Anodyne	ADRB2	21	43
CNC(=O)C[C@@H](NC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819281179	CD	On-Demand	Anodyne	ADRB1	25	51
CNC(=O)C[C@@H](NC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819281179	CD	On-Demand	Anodyne	ADRB3	92	51
CNC(=O)C[C@@H](NC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819281179	CD	On-Demand	Anodyne	KCNA5	25	42
O=C(O)[C@@H]1CCN(CC(=O)N(Cc2ccco2)CC(F)(F)F)C1	ZINC000819281180	ED	On-Demand	Anodyne	SLC6A1	94	35
CNC(=O)C[C@H](NC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819281181	CD	On-Demand	Anodyne	ADRB2	21	43
CNC(=O)C[C@H](NC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819281181	CD	On-Demand	Anodyne	ADRB1	25	51
CNC(=O)C[C@H](NC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819281181	CD	On-Demand	Anodyne	ADRB3	92	51
CNC(=O)C[C@H](NC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819281181	CD	On-Demand	Anodyne	KCNA5	25	42
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819281183	CD	On-Demand	Anodyne	SLC6A1	133	42
O=C(O)[C@H]1CCN(C[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819281185	CD	On-Demand	Anodyne	SLC6A1	133	42
O[C@H](CN[C@@H]1C[C@H]1C1CC1)c1cccc(Cl)c1	ZINC000819281186	CF	On-Demand	Anodyne	ADRB1	33	42
O[C@H](CN[C@@H]1C[C@H]1C1CC1)c1cccc(Cl)c1	ZINC000819281186	CF	On-Demand	Anodyne	ADRB3	46	45
O[C@H](CN[C@@H]1C[C@H]1C1CC1)c1cccc(Cl)c1	ZINC000819281186	CF	On-Demand	Anodyne	CYP3A4	46	35
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819281187	CD	On-Demand	Anodyne	SLC6A1	133	42
O[C@@H](CN[C@@H]1C[C@H]1C1CC1)c1cccc(Cl)c1	ZINC000819281188	CF	On-Demand	Anodyne	ADRB1	33	42
O[C@@H](CN[C@@H]1C[C@H]1C1CC1)c1cccc(Cl)c1	ZINC000819281188	CF	On-Demand	Anodyne	ADRB3	46	45
O[C@@H](CN[C@@H]1C[C@H]1C1CC1)c1cccc(Cl)c1	ZINC000819281188	CF	On-Demand	Anodyne	CYP3A4	46	35
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819281189	CD	On-Demand	Anodyne	SLC6A1	133	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1C1CC1	ZINC000819281190	FF	On-Demand	Anodyne	CTSD	113	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1C1CC1	ZINC000819281190	FF	On-Demand	Anodyne	PGC	63	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1C1CC1	ZINC000819281190	FF	On-Demand	Anodyne	PAPA1_CARPA	32	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1C1CC1	ZINC000819281190	FF	On-Demand	Anodyne	CCKAR	46	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1C1CC1	ZINC000819281190	FF	On-Demand	Anodyne	CTSK	15	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1C1CC1	ZINC000819281190	FF	On-Demand	Anodyne	PGA	44	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1C1CC1	ZINC000819281190	FF	On-Demand	Anodyne	BACE2	52	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1C1CC1	ZINC000819281190	FF	On-Demand	Anodyne	REN	100	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1C1CC1	ZINC000819281190	FF	On-Demand	Anodyne	REN1	29	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1C1CC1	ZINC000819281190	FF	On-Demand	Anodyne	BACE1	83	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1C1CC1	ZINC000819281190	FF	On-Demand	Anodyne	FPR1	55	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1C1CC1	ZINC000819281190	FF	On-Demand	Anodyne	PLM1_PLAFA	28	43
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccc(F)cc2F)C1	ZINC000819281191	CD	On-Demand	Anodyne	SLC6A1	140	46
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccc(F)cc2F)C1	ZINC000819281191	CD	On-Demand	Anodyne	CCR3	21	44
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819281193	CD	On-Demand	Anodyne	SLC6A1	140	46
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819281193	CD	On-Demand	Anodyne	CCR3	21	44
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819281195	CD	On-Demand	Anodyne	SLC6A1	140	46
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819281195	CD	On-Demand	Anodyne	CCR3	21	44
O=C(O)[C@H]1CCN(C[C@H](O)c2ccc(F)cc2F)C1	ZINC000819281197	CD	On-Demand	Anodyne	SLC6A1	140	46
O=C(O)[C@H]1CCN(C[C@H](O)c2ccc(F)cc2F)C1	ZINC000819281197	CD	On-Demand	Anodyne	CCR3	21	44
O=C(O)[C@@H]1CCN(C[C@@H](O)Cn2cccn2)C1	ZINC000819281203	BB	On-Demand	Anodyne	SLC6A1	49	41
O=C(O)[C@H]1CCN(C[C@H](O)Cn2cccn2)C1	ZINC000819281204	BB	On-Demand	Anodyne	SLC6A1	49	41
O=C(O)[C@H]1CCN(C[C@@H](O)Cn2cccn2)C1	ZINC000819281206	BB	On-Demand	Anodyne	SLC6A1	49	41
O=C(O)[C@@H]1CCN(C[C@H](O)Cn2cccn2)C1	ZINC000819281208	BB	On-Demand	Anodyne	SLC6A1	49	41
CC(=O)Nc1cccc(CC(=O)Oc2cccc(NC(=O)C(C)C)c2)c1	ZINC000819281209	FG	On-Demand	Anodyne	MTNR1A	22	42
CC(=O)Nc1cccc(CC(=O)Oc2cccc(NC(=O)C(C)C)c2)c1	ZINC000819281209	FG	On-Demand	Anodyne	MTNR1B	23	50
CC(=O)Nc1cccc(CC(=O)Oc2cccc(NC(=O)C(C)C)c2)c1	ZINC000819281209	FG	On-Demand	Anodyne	KCNK3	50	34
CC(=O)Nc1cccc(CC(=O)Oc2cccc(NC(=O)C(C)C)c2)c1	ZINC000819281209	FG	On-Demand	Anodyne	KCNK9	53	33
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(F)cc2)C1	ZINC000819281213	CD	On-Demand	Anodyne	SLC6A1	82	38
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(F)cc2)C1	ZINC000819281213	CD	On-Demand	Anodyne	NPY2R	33	45
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(F)cc2)C1	ZINC000819281213	CD	On-Demand	Anodyne	MLNR	37	41
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(F)cc2)C1	ZINC000819281213	CD	On-Demand	Anodyne	EPHX2	27	43
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(F)cc2)C1	ZINC000819281215	CD	On-Demand	Anodyne	SLC6A1	82	38
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(F)cc2)C1	ZINC000819281215	CD	On-Demand	Anodyne	NPY2R	33	45
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(F)cc2)C1	ZINC000819281215	CD	On-Demand	Anodyne	MLNR	37	41
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(F)cc2)C1	ZINC000819281215	CD	On-Demand	Anodyne	EPHX2	27	43
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(F)cc2F)C1	ZINC000819281217	CE	On-Demand	Anodyne	SLC6A1	68	41
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(F)cc2F)C1	ZINC000819281219	CE	On-Demand	Anodyne	SLC6A1	68	41
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc(SC(F)F)cc2)C1	ZINC000819281221	EG	On-Demand	Anodyne	NPY2R	25	40
O=C(O)[C@H]1CCN(C(=S)Nc2ccc(SC(F)F)cc2)C1	ZINC000819281222	EG	On-Demand	Anodyne	NPY2R	25	40
O=C(O)[C@@H]1CCN(C[C@@H](O)COCc2ccco2)C1	ZINC000819281224	CC	On-Demand	Anodyne	SLC6A1	106	43
CS(=O)(=O)c1ccc([C@H](O)CNCC2(C#N)CC2)cc1	ZINC000819281225	CD	On-Demand	Mild	CTSF	51	39
CS(=O)(=O)c1ccc([C@@H](O)CNCC2(C#N)CC2)cc1	ZINC000819281226	CD	On-Demand	Mild	CTSF	51	39
O=C(O)[C@@H]1CCN(C[C@H](O)COCc2ccco2)C1	ZINC000819281228	CC	On-Demand	Anodyne	SLC6A1	106	43
O=C(O)[C@H]1CCN(C[C@H](O)COCc2ccco2)C1	ZINC000819281229	CC	On-Demand	Anodyne	SLC6A1	106	43
O=C(O)[C@H]1CCN(C[C@@H](O)COCc2ccco2)C1	ZINC000819281231	CC	On-Demand	Anodyne	SLC6A1	106	43
O=C(O)[C@@H]1CCN(C(=S)NCCc2ccccc2)C1	ZINC000819281234	CD	On-Demand	Anodyne	ACE	44	39
O=C(O)[C@@H]1CCN(C(=S)NCCc2ccccc2)C1	ZINC000819281234	CD	On-Demand	Anodyne	SLC6A1	134	39
O=C(O)[C@@H]1CCN(C(=S)NCCc2ccccc2)C1	ZINC000819281234	CD	On-Demand	Anodyne	SIGMAR1	24	40
O=C(O)[C@@H]1CCN(C(=S)NCCc2ccccc2)C1	ZINC000819281234	CD	On-Demand	Anodyne	PREP	40	40
O=C(O)[C@@H]1CCN(C(=S)NCCc2ccccc2)C1	ZINC000819281234	CD	On-Demand	Anodyne	DPP7	52	47
O=C(O)[C@@H]1CCN(C(=S)NCCc2ccccc2)C1	ZINC000819281234	CD	On-Demand	Anodyne	GPBAR1	21	41
O=C(O)[C@H]1CCN(C(=S)NCCc2ccccc2)C1	ZINC000819281236	CD	On-Demand	Anodyne	ACE	44	39
O=C(O)[C@H]1CCN(C(=S)NCCc2ccccc2)C1	ZINC000819281236	CD	On-Demand	Anodyne	SLC6A1	134	39
O=C(O)[C@H]1CCN(C(=S)NCCc2ccccc2)C1	ZINC000819281236	CD	On-Demand	Anodyne	SIGMAR1	24	40
O=C(O)[C@H]1CCN(C(=S)NCCc2ccccc2)C1	ZINC000819281236	CD	On-Demand	Anodyne	PREP	40	40
O=C(O)[C@H]1CCN(C(=S)NCCc2ccccc2)C1	ZINC000819281236	CD	On-Demand	Anodyne	DPP7	52	47
O=C(O)[C@H]1CCN(C(=S)NCCc2ccccc2)C1	ZINC000819281236	CD	On-Demand	Anodyne	GPBAR1	21	41
O=C(O)C1CCN(CC#Cc2ccc(Cl)cc2)CC1	ZINC000819281237	CE	On-Demand	Mild	SIGMAR1	15	40
O=C(O)C1CCN(CC#Cc2ccc(Cl)cc2)CC1	ZINC000819281237	CE	On-Demand	Mild	GRIN2C	18	48
O=C(O)[C@@H]1CCN(C(=S)Nc2ccccc2Cl)C1	ZINC000819281252	CE	On-Demand	Anodyne	SLC6A1	111	38
O=C(O)[C@@H]1CCN(C(=S)Nc2ccccc2Cl)C1	ZINC000819281252	CE	On-Demand	Anodyne	EPHX2	15	42
O=C(O)[C@@H]1CCN(C(=S)Nc2ccccc2Cl)C1	ZINC000819281252	CE	On-Demand	Anodyne	EPHB3	57	38
O=C(O)[C@H]1CCN(C(=S)Nc2ccccc2Cl)C1	ZINC000819281254	CE	On-Demand	Anodyne	SLC6A1	111	38
O=C(O)[C@H]1CCN(C(=S)Nc2ccccc2Cl)C1	ZINC000819281254	CE	On-Demand	Anodyne	EPHX2	15	42
O=C(O)[C@H]1CCN(C(=S)Nc2ccccc2Cl)C1	ZINC000819281254	CE	On-Demand	Anodyne	EPHB3	57	38
O=C(O)[C@H]1CCN(C(=O)c2ccnc(-n3cncn3)c2)C1	ZINC000819281258	CC	On-Demand	Anodyne	L3MBTL3	48	34
O=C(O)[C@@H]1CCN(C(=O)c2ccnc(-n3cncn3)c2)C1	ZINC000819281259	CC	On-Demand	Anodyne	L3MBTL3	48	34
O=C(O)[C@@H]1CCN(CC#Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819281262	CE	On-Demand	Mild	SLC6A1	96	38
O=C(O)[C@@H]1CCN(CC#Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819281262	CE	On-Demand	Mild	GRIN2C	16	41
O=C(O)[C@@H]1CCN(CC#Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819281262	CE	On-Demand	Mild	LIPG	50	34
O=C(O)[C@H]1CCN(CC#Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819281263	CE	On-Demand	Mild	SLC6A1	96	38
O=C(O)[C@H]1CCN(CC#Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819281263	CE	On-Demand	Mild	GRIN2C	16	41
O=C(O)[C@H]1CCN(CC#Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819281263	CE	On-Demand	Mild	LIPG	50	34
O=C(O)[C@@H]1CCN(CC(=O)N2CCN(Cc3ccco3)CC2)C1	ZINC000819281264	DC	On-Demand	Anodyne	SLC6A1	71	35
O=C(O)[C@@H]1CCN(CC(=O)N2CCN(Cc3ccco3)CC2)C1	ZINC000819281264	DC	On-Demand	Anodyne	MAPK1	22	41
O=C(O)[C@H]1CCN(CC(=O)N2CCN(Cc3ccco3)CC2)C1	ZINC000819281269	DC	On-Demand	Anodyne	SLC6A1	71	35
O=C(O)[C@H]1CCN(CC(=O)N2CCN(Cc3ccco3)CC2)C1	ZINC000819281269	DC	On-Demand	Anodyne	MAPK1	22	41
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000819281271	CD	On-Demand	Bother	NPY2R	25	42
O=C(O)[C@H]1CCN(C(=S)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000819281272	CD	On-Demand	Bother	NPY2R	25	42
O=C(O)[C@H]1CCN(C[C@@H](O)c2c(F)cccc2F)C1	ZINC000819281281	CD	On-Demand	Anodyne	SLC6A1	157	44
O=C(O)[C@@H]1CCN(C[C@H](O)c2c(F)cccc2F)C1	ZINC000819281283	CD	On-Demand	Anodyne	SLC6A1	157	44
O=C(O)[C@H]1CCN(C[C@H](O)c2c(F)cccc2F)C1	ZINC000819281285	CD	On-Demand	Anodyne	SLC6A1	157	44
O=C(O)[C@@H]1CCN(C[C@@H](O)c2c(F)cccc2F)C1	ZINC000819281287	CD	On-Demand	Anodyne	SLC6A1	157	44
O=C(O)[C@@H]1CCN(CC(=O)N2CCO[C@H]3CCCC[C@@H]32)C1	ZINC000819281288	CC	On-Demand	Anodyne	SLC6A1	47	34
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819281331	DH	On-Demand	Anodyne	ADRB3	57	39
O[C@H](CN[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819281332	DH	On-Demand	Anodyne	ADRB3	57	39
COc1ccc2[nH]cc(CCNC(=O)/C=C\[C@H]3CCCO3)c2c1	ZINC000819281345	DF	On-Demand	Anodyne	HTR1A	19	44
COc1ccc2[nH]cc(CCNC(=O)/C=C\[C@H]3CCCO3)c2c1	ZINC000819281345	DF	On-Demand	Anodyne	HTR1D	39	44
COc1ccc2[nH]cc(CCNC(=O)/C=C\[C@H]3CCCO3)c2c1	ZINC000819281345	DF	On-Demand	Anodyne	NQO2	42	58
COc1ccc2[nH]cc(CCNC(=O)/C=C\[C@H]3CCCO3)c2c1	ZINC000819281345	DF	On-Demand	Anodyne	MTNR1A	103	59
COc1ccc2[nH]cc(CCNC(=O)/C=C\[C@H]3CCCO3)c2c1	ZINC000819281345	DF	On-Demand	Anodyne	MTNR1B	79	58
COc1ccc2[nH]cc(CCNC(=O)/C=C\[C@H]3CCCO3)c2c1	ZINC000819281345	DF	On-Demand	Anodyne	ABCG2	27	44
COc1ccc2[nH]cc(CCNC(=O)/C=C/[C@@H]3CCCO3)c2c1	ZINC000819281346	DF	On-Demand	Anodyne	HTR1A	19	44
COc1ccc2[nH]cc(CCNC(=O)/C=C/[C@@H]3CCCO3)c2c1	ZINC000819281346	DF	On-Demand	Anodyne	HTR1D	39	44
COc1ccc2[nH]cc(CCNC(=O)/C=C/[C@@H]3CCCO3)c2c1	ZINC000819281346	DF	On-Demand	Anodyne	NQO2	42	58
COc1ccc2[nH]cc(CCNC(=O)/C=C/[C@@H]3CCCO3)c2c1	ZINC000819281346	DF	On-Demand	Anodyne	MTNR1A	103	59
COc1ccc2[nH]cc(CCNC(=O)/C=C/[C@@H]3CCCO3)c2c1	ZINC000819281346	DF	On-Demand	Anodyne	MTNR1B	79	58
COc1ccc2[nH]cc(CCNC(=O)/C=C/[C@@H]3CCCO3)c2c1	ZINC000819281346	DF	On-Demand	Anodyne	ABCG2	27	44
COc1ccc2[nH]cc(CCNC(=O)/C=C/[C@H]3CCCO3)c2c1	ZINC000819281347	DF	On-Demand	Anodyne	HTR1A	19	44
COc1ccc2[nH]cc(CCNC(=O)/C=C/[C@H]3CCCO3)c2c1	ZINC000819281347	DF	On-Demand	Anodyne	HTR1D	39	44
COc1ccc2[nH]cc(CCNC(=O)/C=C/[C@H]3CCCO3)c2c1	ZINC000819281347	DF	On-Demand	Anodyne	NQO2	42	58
COc1ccc2[nH]cc(CCNC(=O)/C=C/[C@H]3CCCO3)c2c1	ZINC000819281347	DF	On-Demand	Anodyne	MTNR1A	103	59
COc1ccc2[nH]cc(CCNC(=O)/C=C/[C@H]3CCCO3)c2c1	ZINC000819281347	DF	On-Demand	Anodyne	MTNR1B	79	58
COc1ccc2[nH]cc(CCNC(=O)/C=C/[C@H]3CCCO3)c2c1	ZINC000819281347	DF	On-Demand	Anodyne	ABCG2	27	44
COc1ccc2[nH]cc(CCNC(=O)/C=C\[C@@H]3CCCO3)c2c1	ZINC000819281348	DF	On-Demand	Anodyne	HTR1A	19	44
COc1ccc2[nH]cc(CCNC(=O)/C=C\[C@@H]3CCCO3)c2c1	ZINC000819281348	DF	On-Demand	Anodyne	HTR1D	39	44
COc1ccc2[nH]cc(CCNC(=O)/C=C\[C@@H]3CCCO3)c2c1	ZINC000819281348	DF	On-Demand	Anodyne	NQO2	42	58
COc1ccc2[nH]cc(CCNC(=O)/C=C\[C@@H]3CCCO3)c2c1	ZINC000819281348	DF	On-Demand	Anodyne	MTNR1A	103	59
COc1ccc2[nH]cc(CCNC(=O)/C=C\[C@@H]3CCCO3)c2c1	ZINC000819281348	DF	On-Demand	Anodyne	MTNR1B	79	58
COc1ccc2[nH]cc(CCNC(=O)/C=C\[C@@H]3CCCO3)c2c1	ZINC000819281348	DF	On-Demand	Anodyne	ABCG2	27	44
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000819281364	FG	On-Demand	Anodyne	TP53	24	40
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000819281364	FG	On-Demand	Anodyne	MDM2	115	40
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000819281365	FG	On-Demand	Anodyne	TP53	24	40
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000819281365	FG	On-Demand	Anodyne	MDM2	115	40
COC[C@@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819281366	FE	On-Demand	Mild	PAPA1_CARPA	32	42
COC[C@@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819281368	FE	On-Demand	Mild	PAPA1_CARPA	32	42
CCOc1cccc([C@@H]2C[C@H]2NC[C@H](O)c2cccnc2)c1	ZINC000819281370	CF	On-Demand	Anodyne	ADRB1	20	44
CCOc1cccc([C@@H]2C[C@H]2NC[C@H](O)c2cccnc2)c1	ZINC000819281370	CF	On-Demand	Anodyne	ADRB3	52	41
CCOc1cccc([C@@H]2C[C@H]2NC[C@@H](O)c2cccnc2)c1	ZINC000819281371	CF	On-Demand	Anodyne	ADRB1	20	44
CCOc1cccc([C@@H]2C[C@H]2NC[C@@H](O)c2cccnc2)c1	ZINC000819281371	CF	On-Demand	Anodyne	ADRB3	52	41
O[C@H](CN[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1cccc(Cl)c1	ZINC000819281382	FI	On-Demand	Anodyne	ADRB1	25	40
O[C@H](CN[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1cccc(Cl)c1	ZINC000819281382	FI	On-Demand	Anodyne	ADRB3	42	40
O[C@@H](CN[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1cccc(Cl)c1	ZINC000819281383	FI	On-Demand	Anodyne	ADRB1	25	40
O[C@@H](CN[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1cccc(Cl)c1	ZINC000819281383	FI	On-Demand	Anodyne	ADRB3	42	40
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2C[C@H]2c2cccc(Cl)c2)cc1	ZINC000819281384	EG	On-Demand	Bother	MDM2	62	33
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2C[C@H]2c2cccc(Cl)c2)cc1	ZINC000819281385	EG	On-Demand	Bother	MDM2	62	33
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000819281398	FF	On-Demand	Anodyne	MDM2	95	35
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(Br)cc1)c1ccc(F)cc1	ZINC000819281401	FH	On-Demand	Anodyne	SLC6A3	20	40
O[C@H](CN[C@@H]1C[C@H]1c1ccc(Br)cc1)c1ccc(F)cc1	ZINC000819281402	FH	On-Demand	Anodyne	SLC6A3	20	40
CCOc1cccc([C@@H]2C[C@H]2NC[C@@H](O)c2ccccc2)c1	ZINC000819281412	CG	On-Demand	Anodyne	PDS	54	35
CCOc1cccc([C@@H]2C[C@H]2NC[C@H](O)c2ccccc2)c1	ZINC000819281413	CG	On-Demand	Anodyne	PDS	54	35
O[C@H](CN[C@@H]1C[C@H]1c1c(F)cccc1F)c1cccc(Cl)c1	ZINC000819281419	DH	On-Demand	Anodyne	ADRB1	27	41
O[C@H](CN[C@@H]1C[C@H]1c1c(F)cccc1F)c1cccc(Cl)c1	ZINC000819281419	DH	On-Demand	Anodyne	ADRB3	43	41
O[C@@H](CN[C@@H]1C[C@H]1c1c(F)cccc1F)c1cccc(Cl)c1	ZINC000819281420	DH	On-Demand	Anodyne	ADRB1	27	41
O[C@@H](CN[C@@H]1C[C@H]1c1c(F)cccc1F)c1cccc(Cl)c1	ZINC000819281420	DH	On-Demand	Anodyne	ADRB3	43	41
O=C(O)[C@@H]1CCN(CC(=O)N2CCO[C@@H]3CCCC[C@@H]32)C1	ZINC000819281421	CC	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)[C@@H]1CCN(CC(=O)N2CCO[C@@H]3CCCC[C@H]32)C1	ZINC000819281422	CC	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)[C@@H]1CCN(CC(=O)N2CCO[C@H]3CCCC[C@H]32)C1	ZINC000819281423	CC	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)[C@@H]1CCN(C(=O)c2csc(NC3CC3)n2)C1	ZINC000819281424	CD	On-Demand	Anodyne	TRPC6	64	45
O=C(O)[C@@H]1CCN(C(=O)c2csc(NC3CC3)n2)C1	ZINC000819281424	CD	On-Demand	Anodyne	TRPC3	57	45
O=C(O)[C@H]1CCN(C(=O)c2csc(NC3CC3)n2)C1	ZINC000819281425	CD	On-Demand	Anodyne	TRPC6	64	45
O=C(O)[C@H]1CCN(C(=O)c2csc(NC3CC3)n2)C1	ZINC000819281425	CD	On-Demand	Anodyne	TRPC3	57	45
O=C(O)[C@H]1CCN(CC[C@@H]2CCOC2=O)C1	ZINC000819281428	BC	On-Demand	Anodyne	SLC6A1	130	38
O=C1OCC[C@@H]1CCN1CC[C@@H](C(=O)O)C1	ZINC000819281429	BC	On-Demand	Anodyne	SLC6A1	130	38
O=C(O)[C@H]1CCN(CC[C@H]2CCOC2=O)C1	ZINC000819281431	BC	On-Demand	Anodyne	SLC6A1	130	38
O=C(O)[C@@H]1CCN(CC[C@@H]2CCOC2=O)C1	ZINC000819281432	BC	On-Demand	Anodyne	SLC6A1	130	38
O=C(O)[C@H]1CCN(CC(=O)N2N=C(c3ccco3)C[C@@H]2c2ccco2)C1	ZINC000819281434	FD	On-Demand	Anodyne	SLC6A1	64	34
O=C(O)[C@H]1CCN(CC(=O)N2N=C(c3ccco3)C[C@H]2c2ccco2)C1	ZINC000819281436	FD	On-Demand	Anodyne	SLC6A1	64	34
O=C(O)[C@@H]1CCN(CC(=O)N2N=C(c3ccco3)C[C@H]2c2ccco2)C1	ZINC000819281439	FD	On-Demand	Anodyne	SLC6A1	64	34
O=C(O)[C@@H]1CCN(CC(=O)N2N=C(c3ccco3)C[C@@H]2c2ccco2)C1	ZINC000819281441	FD	On-Demand	Anodyne	SLC6A1	64	34
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@H]2c2ccccc2)CC1	ZINC000819281442	FG	On-Demand	Anodyne	EPHX2	25	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@H]2c2ccccc2)CC1	ZINC000819281442	FG	On-Demand	Anodyne	CCR8	18	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@H]2c2ccccc2)CC1	ZINC000819281442	FG	On-Demand	Anodyne	GPR119	45	51
C=C(C)C(C)(C)C(=O)Oc1cccc(NC(=O)C(C)C)c1	ZINC000819281444	CH	On-Demand	Mild	KCNK3	40	36
C=C(C)C(C)(C)C(=O)Oc1cccc(NC(=O)C(C)C)c1	ZINC000819281444	CH	On-Demand	Mild	KCNK9	40	36
O=C(O)[C@@H]1CCN(CC(=O)N2CCC(c3ccccc3)=N2)C1	ZINC000819281449	DD	On-Demand	Anodyne	SLC6A1	138	39
O=C(O)[C@@H]1CCN(CC(=O)N2CCC(c3ccccc3)=N2)C1	ZINC000819281449	DD	On-Demand	Anodyne	MAPK1	20	41
O=C(O)[C@@H]1CCN(CC(=O)N2CCC(c3ccccc3)=N2)C1	ZINC000819281449	DD	On-Demand	Anodyne	S1PR1	15	42
O=C(O)[C@@H]1CCN(CC(=O)N2CCC(c3ccccc3)=N2)C1	ZINC000819281449	DD	On-Demand	Anodyne	S1PR5	25	42
O=C(O)[C@H]1CCN(CC(=O)N2CCC(c3ccccc3)=N2)C1	ZINC000819281450	DD	On-Demand	Anodyne	SLC6A1	138	39
O=C(O)[C@H]1CCN(CC(=O)N2CCC(c3ccccc3)=N2)C1	ZINC000819281450	DD	On-Demand	Anodyne	MAPK1	20	41
O=C(O)[C@H]1CCN(CC(=O)N2CCC(c3ccccc3)=N2)C1	ZINC000819281450	DD	On-Demand	Anodyne	S1PR1	15	42
O=C(O)[C@H]1CCN(CC(=O)N2CCC(c3ccccc3)=N2)C1	ZINC000819281450	DD	On-Demand	Anodyne	S1PR5	25	42
O=C(O)[C@H]1CCN(CC(=O)N(Cc2ccco2)c2ccccc2)C1	ZINC000819281456	EE	On-Demand	Anodyne	SLC6A1	119	42
O=C(O)[C@@H]1CCN(CC(=O)N(Cc2ccco2)c2ccccc2)C1	ZINC000819281458	EE	On-Demand	Anodyne	SLC6A1	119	42
O=C(NCc1ccccc1)[C@H](c1ccccc1)N1CC[C@@H](C(=O)O)C1	ZINC000819281460	EE	On-Demand	Anodyne	ACE	50	34
O=C(NCc1ccccc1)[C@H](c1ccccc1)N1CC[C@@H](C(=O)O)C1	ZINC000819281460	EE	On-Demand	Anodyne	SLC6A1	96	41
O=C(NCc1ccccc1)[C@H](c1ccccc1)N1CC[C@@H](C(=O)O)C1	ZINC000819281460	EE	On-Demand	Anodyne	SIGMAR1	15	47
O=C(NCc1ccccc1)[C@H](c1ccccc1)N1CC[C@@H](C(=O)O)C1	ZINC000819281460	EE	On-Demand	Anodyne	CCR5	34	44
O=C(NCc1ccccc1)[C@H](c1ccccc1)N1CC[C@@H](C(=O)O)C1	ZINC000819281460	EE	On-Demand	Anodyne	PREP	15	41
O=C(NCc1ccccc1)[C@H](c1ccccc1)N1CC[C@@H](C(=O)O)C1	ZINC000819281460	EE	On-Demand	Anodyne	MTTP	15	40
O=C(NCc1ccccc1)[C@H](c1ccccc1)N1CC[C@@H](C(=O)O)C1	ZINC000819281460	EE	On-Demand	Anodyne	AMP1_PLAFQ	43	42
O=C(O)[C@@H]1CCN([C@@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281461	EE	On-Demand	Anodyne	ACE	50	34
O=C(O)[C@@H]1CCN([C@@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281461	EE	On-Demand	Anodyne	SLC6A1	96	41
O=C(O)[C@@H]1CCN([C@@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281461	EE	On-Demand	Anodyne	SIGMAR1	15	47
O=C(O)[C@@H]1CCN([C@@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281461	EE	On-Demand	Anodyne	CCR5	34	44
O=C(O)[C@@H]1CCN([C@@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281461	EE	On-Demand	Anodyne	PREP	15	41
O=C(O)[C@@H]1CCN([C@@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281461	EE	On-Demand	Anodyne	MTTP	15	40
O=C(O)[C@@H]1CCN([C@@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281461	EE	On-Demand	Anodyne	AMP1_PLAFQ	43	42
O=C(O)[C@H]1CCN([C@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281462	EE	On-Demand	Anodyne	ACE	50	34
O=C(O)[C@H]1CCN([C@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281462	EE	On-Demand	Anodyne	SLC6A1	96	41
O=C(O)[C@H]1CCN([C@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281462	EE	On-Demand	Anodyne	SIGMAR1	15	47
O=C(O)[C@H]1CCN([C@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281462	EE	On-Demand	Anodyne	CCR5	34	44
O=C(O)[C@H]1CCN([C@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281462	EE	On-Demand	Anodyne	PREP	15	41
O=C(O)[C@H]1CCN([C@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281462	EE	On-Demand	Anodyne	MTTP	15	40
O=C(O)[C@H]1CCN([C@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281462	EE	On-Demand	Anodyne	AMP1_PLAFQ	43	42
O=C(O)[C@H]1CCN([C@@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281464	EE	On-Demand	Anodyne	ACE	50	34
O=C(O)[C@H]1CCN([C@@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281464	EE	On-Demand	Anodyne	SLC6A1	96	41
O=C(O)[C@H]1CCN([C@@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281464	EE	On-Demand	Anodyne	SIGMAR1	15	47
O=C(O)[C@H]1CCN([C@@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281464	EE	On-Demand	Anodyne	CCR5	34	44
O=C(O)[C@H]1CCN([C@@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281464	EE	On-Demand	Anodyne	PREP	15	41
O=C(O)[C@H]1CCN([C@@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281464	EE	On-Demand	Anodyne	MTTP	15	40
O=C(O)[C@H]1CCN([C@@H](C(=O)NCc2ccccc2)c2ccccc2)C1	ZINC000819281464	EE	On-Demand	Anodyne	AMP1_PLAFQ	43	42
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccc3ccccc3c2)C1	ZINC000819281466	CE	On-Demand	Anodyne	SLC6A1	148	44
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccc3ccccc3c2)C1	ZINC000819281466	CE	On-Demand	Anodyne	OPRK1	23	45
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccc3ccccc3c2)C1	ZINC000819281466	CE	On-Demand	Anodyne	SLC18A3	16	43
O=C(O)[C@H]1CCN(C[C@H](O)c2ccc3ccccc3c2)C1	ZINC000819281469	CE	On-Demand	Anodyne	SLC6A1	148	44
O=C(O)[C@H]1CCN(C[C@H](O)c2ccc3ccccc3c2)C1	ZINC000819281469	CE	On-Demand	Anodyne	OPRK1	23	45
O=C(O)[C@H]1CCN(C[C@H](O)c2ccc3ccccc3c2)C1	ZINC000819281469	CE	On-Demand	Anodyne	SLC18A3	16	43
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccc3ccccc3c2)C1	ZINC000819281471	CE	On-Demand	Anodyne	SLC6A1	148	44
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccc3ccccc3c2)C1	ZINC000819281471	CE	On-Demand	Anodyne	OPRK1	23	45
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccc3ccccc3c2)C1	ZINC000819281471	CE	On-Demand	Anodyne	SLC18A3	16	43
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccc3ccccc3c2)C1	ZINC000819281473	CE	On-Demand	Anodyne	SLC6A1	148	44
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccc3ccccc3c2)C1	ZINC000819281473	CE	On-Demand	Anodyne	OPRK1	23	45
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccc3ccccc3c2)C1	ZINC000819281473	CE	On-Demand	Anodyne	SLC18A3	16	43
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281475	EE	On-Demand	Anodyne	SLC6A1	79	38
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281475	EE	On-Demand	Anodyne	HRH1	37	53
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281475	EE	On-Demand	Anodyne	OPRK1	19	42
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281475	EE	On-Demand	Anodyne	ACOX1	89	38
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281475	EE	On-Demand	Anodyne	CCR3	42	53
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281475	EE	On-Demand	Anodyne	ABCB1	68	41
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281477	EE	On-Demand	Anodyne	SLC6A1	79	38
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281477	EE	On-Demand	Anodyne	HRH1	37	53
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281477	EE	On-Demand	Anodyne	OPRK1	19	42
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281477	EE	On-Demand	Anodyne	ACOX1	89	38
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281477	EE	On-Demand	Anodyne	CCR3	42	53
O=C(O)[C@H]1CCN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281477	EE	On-Demand	Anodyne	ABCB1	68	41
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@@H]1C[C@H]1c1ccccc1	ZINC000819281478	ED	On-Demand	Anodyne	KDM1A	25	40
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281479	EE	On-Demand	Anodyne	SLC6A1	79	38
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281479	EE	On-Demand	Anodyne	HRH1	37	53
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281479	EE	On-Demand	Anodyne	OPRK1	19	42
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281479	EE	On-Demand	Anodyne	ACOX1	89	38
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281479	EE	On-Demand	Anodyne	CCR3	42	53
O=C(O)[C@H]1CCN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281479	EE	On-Demand	Anodyne	ABCB1	68	41
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281481	EE	On-Demand	Anodyne	SLC6A1	79	38
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281481	EE	On-Demand	Anodyne	HRH1	37	53
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281481	EE	On-Demand	Anodyne	OPRK1	19	42
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281481	EE	On-Demand	Anodyne	ACOX1	89	38
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281481	EE	On-Demand	Anodyne	CCR3	42	53
O=C(O)[C@@H]1CCN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000819281481	EE	On-Demand	Anodyne	ABCB1	68	41
O=C(O)[C@H]1CCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819281492	DC	On-Demand	Bother	SLC6A1	57	36
O=C(O)[C@H]1CCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819281492	DC	On-Demand	Bother	ACOX1	46	35
O=C(O)[C@H]1CCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819281492	DC	On-Demand	Bother	ABCB1	67	44
O=C(O)[C@H]1CCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819281494	DC	On-Demand	Bother	SLC6A1	57	36
O=C(O)[C@H]1CCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819281494	DC	On-Demand	Bother	ACOX1	46	35
O=C(O)[C@H]1CCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819281494	DC	On-Demand	Bother	ABCB1	67	44
O=C(O)[C@@H]1CCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819281496	DC	On-Demand	Bother	SLC6A1	57	36
O=C(O)[C@@H]1CCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819281496	DC	On-Demand	Bother	ACOX1	46	35
O=C(O)[C@@H]1CCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819281496	DC	On-Demand	Bother	ABCB1	67	44
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819281498	DC	On-Demand	Bother	SLC6A1	57	36
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819281498	DC	On-Demand	Bother	ACOX1	46	35
O=C(O)[C@@H]1CCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819281498	DC	On-Demand	Bother	ABCB1	67	44
O=C(O)[C@@H]1CCN(CC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCCO3)C1	ZINC000819281500	FD	On-Demand	Anodyne	SLC6A1	127	37
O=C(O)[C@H]1CCN(CC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCCO3)C1	ZINC000819281502	FD	On-Demand	Anodyne	SLC6A1	127	37
O=C(O)[C@@H]1CCN(CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCCO3)C1	ZINC000819281506	FD	On-Demand	Anodyne	SLC6A1	127	37
O=C(O)[C@H]1CCN(CC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCCO3)C1	ZINC000819281509	FD	On-Demand	Anodyne	SLC6A1	127	37
O=C(O)[C@@H]1CCN(CCC(=O)N2CCCCC2)C1	ZINC000819281511	CC	On-Demand	Anodyne	SLC6A1	151	40
O=C(O)[C@@H]1CCN(CCC(=O)N2CCCCC2)C1	ZINC000819281511	CC	On-Demand	Anodyne	PREP	15	42
O=C(O)[C@H]1CCN(CCC(=O)N2CCCCC2)C1	ZINC000819281513	CC	On-Demand	Anodyne	SLC6A1	151	40
O=C(O)[C@H]1CCN(CCC(=O)N2CCCCC2)C1	ZINC000819281513	CC	On-Demand	Anodyne	PREP	15	42
C=C1c2ccccc2C(=O)N1CCC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819281514	IJ	On-Demand	Anodyne	HDAC6	26	40
C=C1c2ccccc2C(=O)N1CCC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819281514	IJ	On-Demand	Anodyne	CCKBR	52	37
C=C1c2ccccc2C(=O)N1CCC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819281514	IJ	On-Demand	Anodyne	KCNK3	55	34
O=C(Nc1ccccc1)C1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1	ZINC000819281515	FD	On-Demand	Anodyne	SLC6A1	137	40
O=C(Nc1ccccc1)C1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1	ZINC000819281515	FD	On-Demand	Anodyne	NPY2R	21	40
O=C(Nc1ccccc1)C1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1	ZINC000819281515	FD	On-Demand	Anodyne	CCR5	16	42
O=C(Nc1ccccc1)C1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1	ZINC000819281515	FD	On-Demand	Anodyne	MAPK1	29	58
O=C(Nc1ccccc1)C1CCN(C(=O)CN2CC[C@H](C(=O)O)C2)CC1	ZINC000819281515	FD	On-Demand	Anodyne	EPHX2	31	47
O=C(Nc1ccccc1)C1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1	ZINC000819281517	FD	On-Demand	Anodyne	SLC6A1	137	40
O=C(Nc1ccccc1)C1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1	ZINC000819281517	FD	On-Demand	Anodyne	NPY2R	21	40
O=C(Nc1ccccc1)C1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1	ZINC000819281517	FD	On-Demand	Anodyne	CCR5	16	42
O=C(Nc1ccccc1)C1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1	ZINC000819281517	FD	On-Demand	Anodyne	MAPK1	29	58
O=C(Nc1ccccc1)C1CCN(C(=O)CN2CC[C@@H](C(=O)O)C2)CC1	ZINC000819281517	FD	On-Demand	Anodyne	EPHX2	31	47
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc3c(c2)CCC3)C1	ZINC000819281523	CE	On-Demand	Anodyne	SLC6A1	53	32
O=C(O)[C@@H]1CCN(C(=S)Nc2ccc3c(c2)CCC3)C1	ZINC000819281523	CE	On-Demand	Anodyne	NPY2R	31	41
O=C(O)[C@H]1CCN(C(=S)Nc2ccc3c(c2)CCC3)C1	ZINC000819281527	CE	On-Demand	Anodyne	SLC6A1	53	32
O=C(O)[C@H]1CCN(C(=S)Nc2ccc3c(c2)CCC3)C1	ZINC000819281527	CE	On-Demand	Anodyne	NPY2R	31	41
O[C@H](CN[C@@H]1C[C@H]1c1ccccc1)c1cccnc1	ZINC000819281528	CE	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CN[C@@H]1C[C@H]1c1ccccc1)c1cccnc1	ZINC000819281528	CE	On-Demand	Anodyne	ADRB1	20	40
O[C@H](CN[C@@H]1C[C@H]1c1ccccc1)c1cccnc1	ZINC000819281528	CE	On-Demand	Anodyne	ADRB3	67	44
O[C@H](CN[C@@H]1C[C@H]1c1ccccc1)c1cccnc1	ZINC000819281528	CE	On-Demand	Anodyne	KDM1A	31	43
O[C@@H](CN[C@@H]1C[C@H]1c1ccccc1)c1cccnc1	ZINC000819281530	CE	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CN[C@@H]1C[C@H]1c1ccccc1)c1cccnc1	ZINC000819281530	CE	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CN[C@@H]1C[C@H]1c1ccccc1)c1cccnc1	ZINC000819281530	CE	On-Demand	Anodyne	ADRB3	67	44
O[C@@H](CN[C@@H]1C[C@H]1c1ccccc1)c1cccnc1	ZINC000819281530	CE	On-Demand	Anodyne	KDM1A	31	43
O=C(O)[C@@H]1CCN(CC(=O)N2CCN(C(=O)C3CC3)CC2)C1	ZINC000819281538	DB	On-Demand	Anodyne	MAPK1	22	42
O=C(O)[C@H]1CCN(CC(=O)N2CCN(C(=O)C3CC3)CC2)C1	ZINC000819281541	DB	On-Demand	Anodyne	MAPK1	22	42
O[C@@H](CN[C@@H]1C[C@H]1c1cccc(Cl)c1)c1ccccc1	ZINC000819281547	CH	On-Demand	Anodyne	ADRB3	46	40
O[C@@H](CN[C@@H]1C[C@H]1c1cccc(Cl)c1)c1ccccc1	ZINC000819281547	CH	On-Demand	Anodyne	MDM2	67	32
O[C@H](CN[C@@H]1C[C@H]1c1cccc(Cl)c1)c1ccccc1	ZINC000819281550	CH	On-Demand	Anodyne	ADRB3	46	40
O[C@H](CN[C@@H]1C[C@H]1c1cccc(Cl)c1)c1ccccc1	ZINC000819281550	CH	On-Demand	Anodyne	MDM2	67	32
CCOc1cccc([C@@H]2C[C@H]2NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819281562	EG	On-Demand	Bother	CACNA1D	53	35
CCOc1cccc([C@@H]2C[C@H]2NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819281565	EG	On-Demand	Bother	CACNA1D	53	35
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@H]2c2ccc(Cl)cc2)c1	ZINC000819281567	EG	On-Demand	Bother	CACNA1D	41	35
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@H]2c2ccc(Cl)cc2)c1	ZINC000819281568	EG	On-Demand	Bother	CACNA1D	41	35
O=C(O)[C@@H]1CCN(CC(=O)N2CCN(C(=O)c3cccs3)CC2)C1	ZINC000819281569	FC	On-Demand	Anodyne	SLC6A1	100	41
O=C(O)[C@@H]1CCN(CC(=O)N2CCN(C(=O)c3cccs3)CC2)C1	ZINC000819281569	FC	On-Demand	Anodyne	MAPK1	23	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000819281570	FH	On-Demand	Anodyne	SLC6A3	21	42
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000819281571	FH	On-Demand	Anodyne	SLC6A3	21	42
O=C(O)[C@H]1CCN(CC(=O)N2CCN(C(=O)c3cccs3)CC2)C1	ZINC000819281572	FC	On-Demand	Anodyne	SLC6A1	100	41
O=C(O)[C@H]1CCN(CC(=O)N2CCN(C(=O)c3cccs3)CC2)C1	ZINC000819281572	FC	On-Demand	Anodyne	MAPK1	23	42
O[C@@H](CN[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1cccnc1	ZINC000819281578	DF	On-Demand	Anodyne	ADRB3	41	38
O[C@H](CN[C@H]1C[C@@H]1c1ccccc1OC(F)F)c1cccnc1	ZINC000819281580	DF	On-Demand	Anodyne	ADRB3	41	38
O=C(O)C1CCN(CC#Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819281586	DF	On-Demand	Mild	GRIN2C	18	45
O=C(O)C1CCN(CC#Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819281586	DF	On-Demand	Mild	LIPG	48	34
Cc1ccccc1[C@@H](O)CN[C@@H]1C[C@H]1c1ccccc1	ZINC000819281599	CG	On-Demand	Anodyne	KDM1A	33	41
O[C@H](CN[C@@H]1C[C@H]1c1cccc(Cl)c1)c1c(F)cccc1F	ZINC000819281610	DH	On-Demand	Anodyne	MDM2	44	32
O=C(O)[C@@H]1CCN(C[C@H](O)c2cc(F)ccc2F)C1	ZINC000819281611	CD	On-Demand	Anodyne	SLC6A1	140	46
O=C(O)[C@@H]1CCN(C[C@H](O)c2cc(F)ccc2F)C1	ZINC000819281611	CD	On-Demand	Anodyne	CCR3	20	46
O[C@@H](CN[C@@H]1C[C@H]1c1cccc(Cl)c1)c1c(F)cccc1F	ZINC000819281612	DH	On-Demand	Anodyne	MDM2	44	32
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819281614	CD	On-Demand	Anodyne	SLC6A1	140	46
O=C(O)[C@@H]1CCN(C[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819281614	CD	On-Demand	Anodyne	CCR3	20	46
O=C(O)[C@H]1CCN(C[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819281617	CD	On-Demand	Anodyne	SLC6A1	140	46
O=C(O)[C@H]1CCN(C[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819281617	CD	On-Demand	Anodyne	CCR3	20	46
O=C(O)[C@H]1CCN(C[C@H](O)c2cc(F)ccc2F)C1	ZINC000819281621	CD	On-Demand	Anodyne	SLC6A1	140	46
O=C(O)[C@H]1CCN(C[C@H](O)c2cc(F)ccc2F)C1	ZINC000819281621	CD	On-Demand	Anodyne	CCR3	20	46
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281625	DE	On-Demand	Anodyne	SLC6A1	151	47
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281625	DE	On-Demand	Anodyne	OPRK1	23	43
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281625	DE	On-Demand	Anodyne	CCR5	33	41
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281625	DE	On-Demand	Anodyne	S1PR1	17	43
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281625	DE	On-Demand	Anodyne	RBP4	65	39
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281625	DE	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281625	DE	On-Demand	Anodyne	SCD1	25	41
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281625	DE	On-Demand	Anodyne	SFRP1	51	36
O=C(O)[C@@H]1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281625	DE	On-Demand	Anodyne	SCD	27	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@H]2c2cccc(Cl)c2)c1	ZINC000819281626	EG	On-Demand	Bother	CACNA1D	58	33
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@H]2c2cccc(Cl)c2)c1	ZINC000819281628	EG	On-Demand	Bother	CACNA1D	58	33
O=C(O)[C@H]1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281629	DE	On-Demand	Anodyne	SLC6A1	151	47
O=C(O)[C@H]1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281629	DE	On-Demand	Anodyne	OPRK1	23	43
O=C(O)[C@H]1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281629	DE	On-Demand	Anodyne	CCR5	33	41
O=C(O)[C@H]1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281629	DE	On-Demand	Anodyne	S1PR1	17	43
O=C(O)[C@H]1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281629	DE	On-Demand	Anodyne	RBP4	65	39
O=C(O)[C@H]1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281629	DE	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)[C@H]1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281629	DE	On-Demand	Anodyne	SCD1	25	41
O=C(O)[C@H]1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281629	DE	On-Demand	Anodyne	SFRP1	51	36
O=C(O)[C@H]1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281629	DE	On-Demand	Anodyne	SCD	27	41
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281633	DE	On-Demand	Anodyne	SLC6A1	151	47
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281633	DE	On-Demand	Anodyne	OPRK1	23	43
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281633	DE	On-Demand	Anodyne	CCR5	33	41
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281633	DE	On-Demand	Anodyne	S1PR1	17	43
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281633	DE	On-Demand	Anodyne	RBP4	65	39
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281633	DE	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281633	DE	On-Demand	Anodyne	SCD1	25	41
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281633	DE	On-Demand	Anodyne	SFRP1	51	36
O=C(O)[C@H]1CCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281633	DE	On-Demand	Anodyne	SCD	27	41
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281635	DE	On-Demand	Anodyne	SLC6A1	151	47
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281635	DE	On-Demand	Anodyne	OPRK1	23	43
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281635	DE	On-Demand	Anodyne	CCR5	33	41
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281635	DE	On-Demand	Anodyne	S1PR1	17	43
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281635	DE	On-Demand	Anodyne	RBP4	65	39
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281635	DE	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281635	DE	On-Demand	Anodyne	SCD1	25	41
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281635	DE	On-Demand	Anodyne	SFRP1	51	36
O=C(O)[C@@H]1CCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819281635	DE	On-Demand	Anodyne	SCD	27	41
O=[N+]([O-])c1cccc([C@H](O)CNC2CC(F)(c3cccc(Cl)c3)C2)c1	ZINC000819281644	FH	On-Demand	Bother	ADRB3	33	42
O=[N+]([O-])c1cccc([C@@H](O)CNC2CC(F)(c3cccc(Cl)c3)C2)c1	ZINC000819281649	FH	On-Demand	Bother	ADRB3	33	42
O[C@H](CN[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)c1cccnc1	ZINC000819281685	DH	On-Demand	Anodyne	ADRB3	52	41
O[C@H](CN[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)c1cccnc1	ZINC000819281685	DH	On-Demand	Anodyne	CYP51A1	15	41
O=C(O)[C@@H]1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819281687	DF	On-Demand	Anodyne	NPY2R	51	49
O=C(O)[C@@H]1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819281687	DF	On-Demand	Anodyne	CACNA1B	43	35
O=C(O)[C@@H]1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819281687	DF	On-Demand	Anodyne	SERPINE1	17	41
O=C(O)[C@@H]1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819281687	DF	On-Demand	Anodyne	CCR2	46	45
O=C(O)[C@@H]1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819281687	DF	On-Demand	Anodyne	EPHX2	32	54
O=C(O)[C@@H]1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819281687	DF	On-Demand	Anodyne	AKR1C3	16	45
O=C(O)[C@@H]1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819281687	DF	On-Demand	Anodyne	LIPG	49	34
O=C(O)[C@@H]1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819281687	DF	On-Demand	Anodyne	SFRP1	42	32
O=C(O)[C@@H]1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819281687	DF	On-Demand	Anodyne	KCNK3	15	43
O=C(O)[C@H]1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819281689	DF	On-Demand	Anodyne	NPY2R	51	49
O=C(O)[C@H]1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819281689	DF	On-Demand	Anodyne	CACNA1B	43	35
O=C(O)[C@H]1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819281689	DF	On-Demand	Anodyne	SERPINE1	17	41
O=C(O)[C@H]1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819281689	DF	On-Demand	Anodyne	CCR2	46	45
O=C(O)[C@H]1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819281689	DF	On-Demand	Anodyne	EPHX2	32	54
O=C(O)[C@H]1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819281689	DF	On-Demand	Anodyne	AKR1C3	16	45
O=C(O)[C@H]1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819281689	DF	On-Demand	Anodyne	LIPG	49	34
O=C(O)[C@H]1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819281689	DF	On-Demand	Anodyne	SFRP1	42	32
O=C(O)[C@H]1CCN(C(=S)Nc2cccc(C(F)(F)F)c2)C1	ZINC000819281689	DF	On-Demand	Anodyne	KCNK3	15	43
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)c1cccnc1	ZINC000819281690	DH	On-Demand	Anodyne	ADRB3	52	41
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)c1cccnc1	ZINC000819281690	DH	On-Demand	Anodyne	CYP51A1	15	41
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)N1CCN(C)CC1	ZINC000819281692	GD	On-Demand	Mild	PAPA1_CARPA	41	50
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)N1CCN(C)CC1	ZINC000819281700	GD	On-Demand	Mild	PAPA1_CARPA	41	50
O=C(O)[C@@H]1CCN(C(=S)Nc2ccccc2F)C1	ZINC000819281702	CD	On-Demand	Anodyne	SLC6A1	127	41
O=C(O)[C@@H]1CCN(C(=S)Nc2ccccc2F)C1	ZINC000819281702	CD	On-Demand	Anodyne	KCNQ2	46	36
CON(C)C(=O)CCN[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000819281703	CE	On-Demand	Anodyne	MDM2	41	32
O=C(O)[C@H]1CCN(C(=S)Nc2ccccc2F)C1	ZINC000819281706	CD	On-Demand	Anodyne	SLC6A1	127	41
O=C(O)[C@H]1CCN(C(=S)Nc2ccccc2F)C1	ZINC000819281706	CD	On-Demand	Anodyne	KCNQ2	46	36
O=C(O)[C@H]1CCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819281709	EC	On-Demand	Anodyne	HTR1A	17	55
O=C(O)[C@H]1CCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819281709	EC	On-Demand	Anodyne	DRD2	15	48
O=C(O)[C@H]1CCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819281709	EC	On-Demand	Anodyne	DRD4	37	47
O=C(O)[C@H]1CCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819281709	EC	On-Demand	Anodyne	SLC6A1	154	40
O=C(O)[C@H]1CCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819281709	EC	On-Demand	Anodyne	EBP	25	40
O=C(O)[C@H]1CCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819281709	EC	On-Demand	Anodyne	SSTR1	50	41
O[C@@H](CN[C@@H]1C[C@H]1c1ccccc1Br)c1ccccc1	ZINC000819281710	EH	On-Demand	Anodyne	MGAM	15	52
O[C@H](CN[C@@H]1C[C@H]1c1ccccc1Br)c1ccccc1	ZINC000819281713	EH	On-Demand	Anodyne	MGAM	15	52
O=C(O)[C@@H]1CCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819281714	EC	On-Demand	Anodyne	HTR1A	17	55
O=C(O)[C@@H]1CCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819281714	EC	On-Demand	Anodyne	DRD2	15	48
O=C(O)[C@@H]1CCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819281714	EC	On-Demand	Anodyne	DRD4	37	47
O=C(O)[C@@H]1CCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819281714	EC	On-Demand	Anodyne	SLC6A1	154	40
O=C(O)[C@@H]1CCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819281714	EC	On-Demand	Anodyne	EBP	25	40
O=C(O)[C@@H]1CCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819281714	EC	On-Demand	Anodyne	SSTR1	50	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@H]2c2ccccc2)c1	ZINC000819281720	CF	On-Demand	Bother	CACNA1C	60	39
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@H]2c2ccccc2)c1	ZINC000819281720	CF	On-Demand	Bother	CACNA1D	87	39
O=C(O)[C@@H]1CCN(C(=S)NCCSc2ccccc2)C1	ZINC000819281721	DE	On-Demand	Anodyne	SLC6A1	130	38
O=C(O)[C@H]1CCN(C(=S)NCCSc2ccccc2)C1	ZINC000819281722	DE	On-Demand	Anodyne	SLC6A1	130	38
O=C(O)[C@@H]1CCN(CC(=O)N2CCN(c3cnccn3)CC2)C1	ZINC000819281723	DB	On-Demand	Anodyne	MAPK1	24	48
O=C(O)[C@H]1CCN(CC(=O)N2CCN(c3cnccn3)CC2)C1	ZINC000819281724	DB	On-Demand	Anodyne	MAPK1	24	48
O=C(O)[C@H]1CCN(CC(=O)N(Cc2ccccc2)Cc2ccco2)C1	ZINC000819281725	EE	On-Demand	Anodyne	SLC6A1	102	39
O=C(O)[C@H]1CCN(CC(=O)N(Cc2ccccc2)Cc2ccco2)C1	ZINC000819281725	EE	On-Demand	Anodyne	MRGPRX1	31	47
O=C(O)[C@H]1CCN(CC(=O)N(Cc2ccccc2)Cc2ccco2)C1	ZINC000819281725	EE	On-Demand	Anodyne	WNT3A	29	41
O=C(O)[C@@H]1CCN(CC(=O)N(Cc2ccccc2)Cc2ccco2)C1	ZINC000819281726	EE	On-Demand	Anodyne	SLC6A1	102	39
O=C(O)[C@@H]1CCN(CC(=O)N(Cc2ccccc2)Cc2ccco2)C1	ZINC000819281726	EE	On-Demand	Anodyne	MRGPRX1	31	47
O=C(O)[C@@H]1CCN(CC(=O)N(Cc2ccccc2)Cc2ccco2)C1	ZINC000819281726	EE	On-Demand	Anodyne	WNT3A	29	41
O=C(O)[C@@H]1CCN(C(=O)c2nc(=O)c3ccccc3[nH]2)C1	ZINC000819281727	CC	On-Demand	Anodyne	GRIN2B	35	44
O=C(O)[C@H]1CCN(C(=O)c2nc(=O)c3ccccc3[nH]2)C1	ZINC000819281728	CC	On-Demand	Anodyne	GRIN2B	35	44
O=C(O)[C@H]1CCN(CC(=O)N2CC=C(c3c[nH]c4ccccc34)CC2)C1	ZINC000819281729	FE	On-Demand	Anodyne	SLC6A1	68	35
O=C(O)[C@H]1CCN(CC(=O)N2CC=C(c3c[nH]c4ccccc34)CC2)C1	ZINC000819281729	FE	On-Demand	Anodyne	SLC6A4	17	48
O=C(O)[C@@H]1CCN(CC(=O)N2CC=C(c3c[nH]c4ccccc34)CC2)C1	ZINC000819281730	FE	On-Demand	Anodyne	SLC6A1	68	35
O=C(O)[C@@H]1CCN(CC(=O)N2CC=C(c3c[nH]c4ccccc34)CC2)C1	ZINC000819281730	FE	On-Demand	Anodyne	SLC6A4	17	48
O[C@H](CNC1CC(F)(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819281748	DG	On-Demand	Anodyne	ADRB3	56	42
O[C@@H](CNC1CC(F)(c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819281749	DG	On-Demand	Anodyne	ADRB3	56	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1CCN(CCN(C)C)CC1)C2	ZINC000819281790	GD	On-Demand	Anodyne	CACNA1I	43	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1CCN(CCN(C)C)CC1)C2	ZINC000819281791	GD	On-Demand	Anodyne	CACNA1I	43	35
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819281792	JH	On-Demand	Anodyne	LPL	41	31
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819281792	JH	On-Demand	Anodyne	PYGL	32	52
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819281792	JH	On-Demand	Anodyne	NR2E3	62	36
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819281792	JH	On-Demand	Anodyne	SMO	20	45
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819281792	JH	On-Demand	Anodyne	KCNK3	90	49
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819281792	JH	On-Demand	Anodyne	KCNK9	69	36
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819281793	JH	On-Demand	Anodyne	LPL	41	31
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819281793	JH	On-Demand	Anodyne	PYGL	32	52
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819281793	JH	On-Demand	Anodyne	NR2E3	62	36
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819281793	JH	On-Demand	Anodyne	SMO	20	45
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819281793	JH	On-Demand	Anodyne	KCNK3	90	49
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819281793	JH	On-Demand	Anodyne	KCNK9	69	36
O=C(NCCCN1CCCCC1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819281796	FF	On-Demand	Anodyne	TBK1	49	33
C[C@@H](CCN(C)C)NC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819281802	GD	On-Demand	Anodyne	GPR119	17	40
C[C@@H](CCN(C)C)NC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819281804	GD	On-Demand	Anodyne	GPR119	17	40
Cn1cc(/C=C\C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c(=O)n(C)c1=O	ZINC000819281807	HE	On-Demand	Anodyne	CCKAR	23	42
Cn1cc(/C=C\C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c(=O)n(C)c1=O	ZINC000819281807	HE	On-Demand	Anodyne	CCKBR	45	36
Cn1cc(/C=C\C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c(=O)n(C)c1=O	ZINC000819281807	HE	On-Demand	Anodyne	KCNK3	106	40
Cn1cc(/C=C\C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c(=O)n(C)c1=O	ZINC000819281807	HE	On-Demand	Anodyne	KCNK9	69	40
N#CCC1(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819281811	CF	On-Demand	Mild	ADRB1	27	42
N#CCC1(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819281811	CF	On-Demand	Mild	ADRB3	41	42
N#CCC1(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819281812	CF	On-Demand	Mild	ADRB1	27	42
N#CCC1(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819281812	CF	On-Demand	Mild	ADRB3	41	42
O=C(/C=C\c1ccc(Cl)s1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819281826	GK	On-Demand	Anodyne	KCNK3	65	37
O=C(/C=C/c1ccc(Cl)s1)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819281827	GK	On-Demand	Anodyne	KCNK3	65	37
O[C@H](CN[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1cccnc1	ZINC000819281861	DG	On-Demand	Anodyne	ADRB1	18	41
O[C@H](CN[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1cccnc1	ZINC000819281861	DG	On-Demand	Anodyne	ADRB3	55	43
O[C@H](CN[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1cccnc1	ZINC000819281861	DG	On-Demand	Anodyne	CYP51A1	15	44
O[C@H](CN[C@@H]1C[C@H]1c1cccc2ccccc12)c1cccnc1	ZINC000819281862	DG	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CN[C@@H]1C[C@H]1c1cccc2ccccc12)c1cccnc1	ZINC000819281862	DG	On-Demand	Anodyne	ADRB1	20	40
O[C@H](CN[C@@H]1C[C@H]1c1cccc2ccccc12)c1cccnc1	ZINC000819281862	DG	On-Demand	Anodyne	ADRB3	62	40
O[C@@H](CN[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1cccnc1	ZINC000819281863	DG	On-Demand	Anodyne	ADRB1	18	41
O[C@@H](CN[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1cccnc1	ZINC000819281863	DG	On-Demand	Anodyne	ADRB3	55	43
O[C@@H](CN[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1cccnc1	ZINC000819281863	DG	On-Demand	Anodyne	CYP51A1	15	44
O[C@@H](CN[C@@H]1C[C@H]1c1cccc2ccccc12)c1cccnc1	ZINC000819281864	DG	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CN[C@@H]1C[C@H]1c1cccc2ccccc12)c1cccnc1	ZINC000819281864	DG	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CN[C@@H]1C[C@H]1c1cccc2ccccc12)c1cccnc1	ZINC000819281864	DG	On-Demand	Anodyne	ADRB3	62	40
N#CC1(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819281869	CE	On-Demand	Mild	ADRB1	28	43
N#CC1(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819281869	CE	On-Demand	Mild	ADRB3	42	43
N#CC1(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819281871	CE	On-Demand	Mild	ADRB1	28	43
N#CC1(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819281871	CE	On-Demand	Mild	ADRB3	42	43
O[C@H](CN[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1)c1cccc(Cl)c1	ZINC000819281872	EH	On-Demand	Anodyne	ADRB3	40	40
O[C@@H](CN[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1)c1cccc(Cl)c1	ZINC000819281874	EH	On-Demand	Anodyne	ADRB3	40	40
N#CC1(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819281880	BD	On-Demand	Mild	ADRB2	22	42
N#CC1(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819281880	BD	On-Demand	Mild	ADRB1	23	42
N#CC1(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819281880	BD	On-Demand	Mild	ADRB3	86	42
N#CC1(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819281880	BD	On-Demand	Mild	PTAFR	15	43
N#CC1(CNC[C@H](O)c2cccnc2)CC1	ZINC000819281882	BD	On-Demand	Mild	ADRB2	22	42
N#CC1(CNC[C@H](O)c2cccnc2)CC1	ZINC000819281882	BD	On-Demand	Mild	ADRB1	23	42
N#CC1(CNC[C@H](O)c2cccnc2)CC1	ZINC000819281882	BD	On-Demand	Mild	ADRB3	86	42
N#CC1(CNC[C@H](O)c2cccnc2)CC1	ZINC000819281882	BD	On-Demand	Mild	PTAFR	15	43
CC(=O)NCc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819281905	GF	On-Demand	Mild	PAPA1_CARPA	52	48
CC(=O)NCc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819281905	GF	On-Demand	Mild	CTSK	15	44
CC(=O)NCc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819281905	GF	On-Demand	Mild	FPR1	43	38
CC(=O)NCc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819281906	GF	On-Demand	Mild	PAPA1_CARPA	52	48
CC(=O)NCc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819281906	GF	On-Demand	Mild	CTSK	15	44
CC(=O)NCc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819281906	GF	On-Demand	Mild	FPR1	43	38
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2C[C@H]2c2ccc3ccccc3c2)cc1	ZINC000819281915	GG	On-Demand	Anodyne	SLC6A3	20	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2C[C@H]2c2ccc3ccccc3c2)cc1	ZINC000819281916	GG	On-Demand	Anodyne	SLC6A3	20	40
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1C[C@H]1c1ccc(Cl)cc1	ZINC000819281919	FG	On-Demand	Anodyne	SLC6A3	18	40
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1C[C@H]1c1ccc(Cl)cc1	ZINC000819281920	FG	On-Demand	Anodyne	SLC6A3	18	40
CCOc1cccc([C@@H]2C[C@H]2NC[C@H](O)c2ccccc2Cl)c1	ZINC000819281921	EH	On-Demand	Anodyne	PDS	48	37
O[C@H](CN[C@@H]1C[C@H]1c1ccc(Cl)cc1)c1cccnc1	ZINC000819281926	CF	On-Demand	Anodyne	ADRB3	59	43
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(Cl)cc1)c1cccnc1	ZINC000819281927	CF	On-Demand	Anodyne	ADRB3	59	43
Cc1ccccc1[C@@H](O)CN[C@@H]1C[C@H]1c1ccc(Cl)cc1	ZINC000819281929	DH	On-Demand	Anodyne	SLC6A3	27	40
C=C(C)C(C)(C)C(=O)NNc1nc2ccccc2c(=O)n1CCCOC(C)C	ZINC000819281956	GG	On-Demand	Reactive	CCKBR	15	41
CON(C)C(=O)CCN[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000819281963	DF	On-Demand	Anodyne	SLC6A4	15	44
CON(C)C(=O)CCN[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000819281963	DF	On-Demand	Anodyne	SLC6A3	22	44
CCOc1ccc([C@@H]2C[C@H]2NC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819281992	DG	On-Demand	Anodyne	SLC6A3	17	40
CCOc1ccc([C@@H]2C[C@H]2NC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819281993	DG	On-Demand	Anodyne	SLC6A3	17	40
COc1cccc([S@@](=O)CC(=O)NCCS(=O)(=O)C(C)(C)C)c1	ZINC000819281998	FD	On-Demand	Anodyne	MTNR1A	50	40
COc1cccc([S@@](=O)CC(=O)NCCS(=O)(=O)C(C)(C)C)c1	ZINC000819281998	FD	On-Demand	Anodyne	MTNR1B	46	40
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)c2c1	ZINC000819282013	FF	On-Demand	Anodyne	HTR1A	15	45
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)c2c1	ZINC000819282013	FF	On-Demand	Anodyne	HTR1D	33	45
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)c2c1	ZINC000819282013	FF	On-Demand	Anodyne	HTR1B	31	40
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)c2c1	ZINC000819282013	FF	On-Demand	Anodyne	NQO2	45	59
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)c2c1	ZINC000819282013	FF	On-Demand	Anodyne	CCKAR	44	38
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)c2c1	ZINC000819282013	FF	On-Demand	Anodyne	HTR1E	15	40
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)c2c1	ZINC000819282013	FF	On-Demand	Anodyne	MTNR1A	101	60
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)c2c1	ZINC000819282013	FF	On-Demand	Anodyne	MTNR1B	76	59
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)c2c1	ZINC000819282013	FF	On-Demand	Anodyne	CCKBR	27	40
COc1ccc2[nH]cc(CCNC(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)c2c1	ZINC000819282013	FF	On-Demand	Anodyne	ABCG2	27	44
CCOc1ccc([C@@H]2C[C@H]2NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819282018	EG	On-Demand	Bother	CACNA1C	51	38
CCOc1ccc([C@@H]2C[C@H]2NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819282018	EG	On-Demand	Bother	CACNA1D	78	35
CCOc1ccc([C@@H]2C[C@H]2NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819282019	EG	On-Demand	Bother	CACNA1C	51	38
CCOc1ccc([C@@H]2C[C@H]2NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819282019	EG	On-Demand	Bother	CACNA1D	78	35
O[C@H](CN[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1)c1cccnc1	ZINC000819282022	DG	On-Demand	Anodyne	ADRB3	41	38
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1)c1cccnc1	ZINC000819282023	DG	On-Demand	Anodyne	ADRB3	41	38
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)C1CC1	ZINC000819282049	CG	On-Demand	Anodyne	SLC6A4	16	40
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)C1CC1	ZINC000819282049	CG	On-Demand	Anodyne	SLC6A3	23	40
O[C@H](CN[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)C1CC1	ZINC000819282050	CG	On-Demand	Anodyne	SLC6A4	16	40
O[C@H](CN[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)C1CC1	ZINC000819282050	CG	On-Demand	Anodyne	SLC6A3	23	40
O[C@H](CN[C@@H]1C[C@H]1c1cccc(Cl)c1)C1CC1	ZINC000819282052	CF	On-Demand	Anodyne	MDM2	61	34
O[C@@H](CN[C@@H]1C[C@H]1c1cccc(Cl)c1)C1CC1	ZINC000819282053	CF	On-Demand	Anodyne	MDM2	61	34
CCOc1cccc([C@@H]2C[C@H]2NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819282073	EG	On-Demand	Bother	CACNA1C	58	40
CCOc1cccc([C@@H]2C[C@H]2NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819282073	EG	On-Demand	Bother	CACNA1D	91	36
CCOc1cccc([C@@H]2C[C@H]2NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819282074	EG	On-Demand	Bother	CACNA1C	58	40
CCOc1cccc([C@@H]2C[C@H]2NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819282074	EG	On-Demand	Bother	CACNA1D	91	36
CCOc1cccc([C@@H]2C[C@H]2NCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819282130	FH	On-Demand	Anodyne	MTNR1B	16	43
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2C[C@H]2c2cccc(Cl)c2)cc1	ZINC000819282135	FF	On-Demand	Anodyne	MDM2	96	35
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2C[C@H]2c2cccc(Cl)c2)cc1	ZINC000819282136	FF	On-Demand	Anodyne	MDM2	96	35
O[C@H](CN[C@@H]1C[C@H]1c1ccc(Br)cc1)c1cccnc1	ZINC000819282143	EG	On-Demand	Anodyne	ADRB3	51	43
O[C@@H](CN[C@@H]1C[C@H]1c1ccc(Br)cc1)c1cccnc1	ZINC000819282144	EG	On-Demand	Anodyne	ADRB3	51	43
COc1ccc2[nH]cc(CCNC(=O)C(F)=C3CCC3)c2c1	ZINC000819282155	DG	On-Demand	Anodyne	HTR1A	21	50
COc1ccc2[nH]cc(CCNC(=O)C(F)=C3CCC3)c2c1	ZINC000819282155	DG	On-Demand	Anodyne	ACHE	26	46
COc1ccc2[nH]cc(CCNC(=O)C(F)=C3CCC3)c2c1	ZINC000819282155	DG	On-Demand	Anodyne	HTR1D	52	50
COc1ccc2[nH]cc(CCNC(=O)C(F)=C3CCC3)c2c1	ZINC000819282155	DG	On-Demand	Anodyne	HTR1B	41	50
COc1ccc2[nH]cc(CCNC(=O)C(F)=C3CCC3)c2c1	ZINC000819282155	DG	On-Demand	Anodyne	NQO2	45	66
COc1ccc2[nH]cc(CCNC(=O)C(F)=C3CCC3)c2c1	ZINC000819282155	DG	On-Demand	Anodyne	MPO	80	42
COc1ccc2[nH]cc(CCNC(=O)C(F)=C3CCC3)c2c1	ZINC000819282155	DG	On-Demand	Anodyne	HTR1E	22	44
COc1ccc2[nH]cc(CCNC(=O)C(F)=C3CCC3)c2c1	ZINC000819282155	DG	On-Demand	Anodyne	MTNR1A	122	67
COc1ccc2[nH]cc(CCNC(=O)C(F)=C3CCC3)c2c1	ZINC000819282155	DG	On-Demand	Anodyne	MTNR1B	92	66
COc1ccc2[nH]cc(CCNC(=O)C(F)=C3CCC3)c2c1	ZINC000819282155	DG	On-Demand	Anodyne	ABCG2	28	46
CCOc1ccc([C@@H]2C[C@H]2NC[C@H](O)c2cccnc2)cc1	ZINC000819282160	CF	On-Demand	Anodyne	ADRB1	20	44
CCOc1ccc([C@@H]2C[C@H]2NC[C@H](O)c2cccnc2)cc1	ZINC000819282160	CF	On-Demand	Anodyne	ADRB3	56	44
CCOc1ccc([C@@H]2C[C@H]2NC[C@@H](O)c2cccnc2)cc1	ZINC000819282161	CF	On-Demand	Anodyne	ADRB1	20	44
CCOc1ccc([C@@H]2C[C@H]2NC[C@@H](O)c2cccnc2)cc1	ZINC000819282161	CF	On-Demand	Anodyne	ADRB3	56	44
O[C@H](CN[C@@H]1C[C@H]1c1cccc(Cl)c1)c1cccnc1	ZINC000819282176	CF	On-Demand	Anodyne	ADRB3	69	40
O[C@@H](CN[C@@H]1C[C@H]1c1cccc(Cl)c1)c1cccnc1	ZINC000819282177	CF	On-Demand	Anodyne	ADRB3	69	40
COc1cccc(/C=C(/C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)n2nnnc2C)c1	ZINC000819282178	JI	On-Demand	Anodyne	KCNK3	34	41
COc1cccc(/C=C(\C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)n2nnnc2C)c1	ZINC000819282179	JI	On-Demand	Anodyne	KCNK3	34	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1C[C@H]1c1ccc(Cl)cc1	ZINC000819282187	FG	On-Demand	Anodyne	SLC6A3	21	40
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1C[C@H]1c1ccc(Cl)cc1	ZINC000819282188	FG	On-Demand	Anodyne	SLC6A3	21	40
O[C@@H](CN[C@@H]1C[C@H]1c1c(F)cccc1F)c1cccnc1	ZINC000819282199	CF	On-Demand	Anodyne	ADRB3	66	40
O[C@H](CN[C@@H]1C[C@H]1c1c(F)cccc1F)c1cccnc1	ZINC000819282200	CF	On-Demand	Anodyne	ADRB3	66	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1	ZINC000819282208	GH	On-Demand	Anodyne	SLC6A3	27	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1	ZINC000819282208	GH	On-Demand	Anodyne	EPHX2	16	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1	ZINC000819282208	GH	On-Demand	Anodyne	GPR119	43	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1	ZINC000819282209	GH	On-Demand	Anodyne	SLC6A3	27	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1	ZINC000819282209	GH	On-Demand	Anodyne	EPHX2	16	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1	ZINC000819282209	GH	On-Demand	Anodyne	GPR119	43	48
CCOc1cccc([C@@H]2C[C@H]2NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819282225	EH	On-Demand	Anodyne	ADRB1	28	47
CCOc1cccc([C@@H]2C[C@H]2NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819282225	EH	On-Demand	Anodyne	ADRB3	42	44
CCOc1cccc([C@@H]2C[C@H]2NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819282225	EH	On-Demand	Anodyne	PDS	44	39
CCOc1cccc([C@@H]2C[C@H]2NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819282226	EH	On-Demand	Anodyne	ADRB1	28	47
CCOc1cccc([C@@H]2C[C@H]2NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819282226	EH	On-Demand	Anodyne	ADRB3	42	44
CCOc1cccc([C@@H]2C[C@H]2NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819282226	EH	On-Demand	Anodyne	PDS	44	39
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000819282246	FG	On-Demand	Anodyne	TP53	24	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000819282246	FG	On-Demand	Anodyne	MDM2	80	40
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000819282247	FG	On-Demand	Anodyne	TP53	24	40
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000819282247	FG	On-Demand	Anodyne	MDM2	80	40
CON(C)C(=O)CCN[C@@H]1C[C@H]1c1ccc(Cl)cc1	ZINC000819282253	CE	On-Demand	Anodyne	SLC6A3	26	44
O[C@@H](CN[C@@H]1C[C@H]1c1c(F)cccc1Cl)c1cccnc1	ZINC000819282272	DG	On-Demand	Anodyne	ADRB3	46	37
O[C@H](CN[C@@H]1C[C@H]1c1c(F)cccc1Cl)c1cccnc1	ZINC000819282273	DG	On-Demand	Anodyne	ADRB3	46	37
CSc1ccc(CCNC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819282318	GH	On-Demand	Anodyne	GPR119	24	43
CSc1ccc(CCNC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819282319	GH	On-Demand	Anodyne	GPR119	24	43
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1C[C@@H](c2cccc(Cl)c2)C1	ZINC000819282329	FG	On-Demand	Anodyne	MDM2	53	37
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1C[C@@H](c2cccc(Cl)c2)C1	ZINC000819282330	FG	On-Demand	Anodyne	MDM2	53	37
CSc1ccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819282331	EG	On-Demand	Bother	ADRB2	47	53
CSc1ccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819282331	EG	On-Demand	Bother	ADRB1	47	43
CSc1ccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819282331	EG	On-Demand	Bother	ADRB3	103	44
CSc1ccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819282332	EG	On-Demand	Bother	ADRB2	47	53
CSc1ccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819282332	EG	On-Demand	Bother	ADRB1	47	43
CSc1ccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819282332	EG	On-Demand	Bother	ADRB3	103	44
CN(CCNC[C@H](O)c1ccccc1)S(=O)(=O)c1ccc(F)cc1	ZINC000819282333	FD	On-Demand	Anodyne	ADRB3	72	44
CN(CCNC[C@@H](O)c1ccccc1)S(=O)(=O)c1ccc(F)cc1	ZINC000819282334	FD	On-Demand	Anodyne	ADRB3	72	44
CSc1ccc(CCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819282348	DH	On-Demand	Anodyne	ADRB2	61	47
CSc1ccc(CCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819282348	DH	On-Demand	Anodyne	ADRB1	70	41
CSc1ccc(CCNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819282348	DH	On-Demand	Anodyne	ADRB3	76	42
CSc1ccc(CCNC[C@@H](O)c2ccc(F)cc2C)cc1	ZINC000819282358	DH	On-Demand	Anodyne	ADRB2	51	51
CSc1ccc(CCNC[C@@H](O)c2ccc(F)cc2C)cc1	ZINC000819282358	DH	On-Demand	Anodyne	ADRB1	43	41
CSc1ccc(CCNC[C@@H](O)c2ccc(F)cc2C)cc1	ZINC000819282358	DH	On-Demand	Anodyne	ADRB3	44	39
CSc1ccc(CCNC[C@H](O)c2ccc(F)cc2C)cc1	ZINC000819282359	DH	On-Demand	Anodyne	ADRB2	51	51
CSc1ccc(CCNC[C@H](O)c2ccc(F)cc2C)cc1	ZINC000819282359	DH	On-Demand	Anodyne	ADRB1	43	41
CSc1ccc(CCNC[C@H](O)c2ccc(F)cc2C)cc1	ZINC000819282359	DH	On-Demand	Anodyne	ADRB3	44	39
O[C@@H](CN[C@@H]1C[C@@H](c2cccc(F)c2)C1)c1cccc(Cl)c1	ZINC000819282362	DI	On-Demand	Anodyne	ADRB1	28	40
O[C@@H](CN[C@@H]1C[C@@H](c2cccc(F)c2)C1)c1cccc(Cl)c1	ZINC000819282362	DI	On-Demand	Anodyne	ADRB3	44	44
O[C@H](CN[C@@H]1C[C@@H](c2cccc(F)c2)C1)c1cccc(Cl)c1	ZINC000819282363	DI	On-Demand	Anodyne	ADRB1	28	40
O[C@H](CN[C@@H]1C[C@@H](c2cccc(F)c2)C1)c1cccc(Cl)c1	ZINC000819282363	DI	On-Demand	Anodyne	ADRB3	44	44
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000819282364	ED	On-Demand	Anodyne	SIGMAR1	19	42
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000819282365	ED	On-Demand	Anodyne	SIGMAR1	19	42
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000819282366	ED	On-Demand	Anodyne	SIGMAR1	19	42
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000819282367	ED	On-Demand	Anodyne	SIGMAR1	19	42
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1cccc(Br)c1	ZINC000819282376	EI	On-Demand	Anodyne	SLC18A3	18	61
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1cccc(Br)c1	ZINC000819282377	EI	On-Demand	Anodyne	SLC18A3	18	61
C#Cc1cccc(N(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C)c1	ZINC000819282389	GH	On-Demand	Mild	PAPA1_CARPA	40	40
C#Cc1cccc(N(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C)c1	ZINC000819282390	GH	On-Demand	Mild	PAPA1_CARPA	40	40
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1cccnc1	ZINC000819282393	CF	On-Demand	Anodyne	ADRB1	21	40
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1cccnc1	ZINC000819282393	CF	On-Demand	Anodyne	ADRB3	68	48
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1cccnc1	ZINC000819282394	CF	On-Demand	Anodyne	ADRB1	21	40
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1cccnc1	ZINC000819282394	CF	On-Demand	Anodyne	ADRB3	68	48
CSc1ccc(CCNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819282397	DH	On-Demand	Anodyne	ADRB2	43	49
CSc1ccc(CCNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819282397	DH	On-Demand	Anodyne	ADRB1	47	41
CSc1ccc(CCNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819282397	DH	On-Demand	Anodyne	ADRB3	56	41
CSc1ccc(CCNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819282398	DH	On-Demand	Anodyne	ADRB2	43	49
CSc1ccc(CCNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819282398	DH	On-Demand	Anodyne	ADRB1	47	41
CSc1ccc(CCNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819282398	DH	On-Demand	Anodyne	ADRB3	56	41
O=C(C(F)=C1CCC1)N1CCN(C2CCC2)CC1	ZINC000819282494	CE	On-Demand	Anodyne	HRH3	20	40
O=C(C(F)=C1CCC1)N1CCN(C2CCC2)CC1	ZINC000819282494	CE	On-Demand	Anodyne	L3MBTL3	56	38
O[C@@H](CN[C@@H]1C[C@@H](c2cccc(F)c2)C1)c1ccc(Cl)cc1	ZINC000819282502	DI	On-Demand	Anodyne	ADRB3	19	42
N#Cc1ccc([C@H](O)CN[C@@H]2C[C@@H](c3cccc(Cl)c3)C2)cc1	ZINC000819282507	EH	On-Demand	Mild	ADRB3	22	43
N#Cc1ccc([C@@H](O)CN[C@@H]2C[C@@H](c3cccc(Cl)c3)C2)cc1	ZINC000819282508	EH	On-Demand	Mild	ADRB3	22	43
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccc(F)cn1	ZINC000819282529	CF	On-Demand	Anodyne	SLC18A3	15	40
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccc(F)cn1	ZINC000819282530	CF	On-Demand	Anodyne	SLC18A3	15	40
C[C@@H]([C@@H](C)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000819282546	GD	On-Demand	Mild	PAPA1_CARPA	34	45
C[C@H]([C@@H](C)S(C)(=O)=O)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819282547	GD	On-Demand	Mild	PAPA1_CARPA	34	45
C[C@H]([C@@H](C)S(C)(=O)=O)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819282548	GD	On-Demand	Mild	PAPA1_CARPA	34	45
C[C@@H]([C@@H](C)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000819282549	GD	On-Demand	Mild	PAPA1_CARPA	34	45
CSc1ccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819282550	EG	On-Demand	Bother	ADRB2	58	52
CSc1ccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819282550	EG	On-Demand	Bother	ADRB1	65	46
CSc1ccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819282550	EG	On-Demand	Bother	ADRB3	136	46
CSc1ccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819282550	EG	On-Demand	Bother	CACNA1D	43	33
CSc1ccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819282551	EG	On-Demand	Bother	ADRB2	58	52
CSc1ccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819282551	EG	On-Demand	Bother	ADRB1	65	46
CSc1ccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819282551	EG	On-Demand	Bother	ADRB3	136	46
CSc1ccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819282551	EG	On-Demand	Bother	CACNA1D	43	33
O[C@@H](CN[C@@H]1C[C@@H](c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819282561	DI	On-Demand	Anodyne	ADRB3	40	42
O[C@H](CN[C@@H]1C[C@@H](c2cccc(Cl)c2)C1)c1cccc(F)c1	ZINC000819282562	DI	On-Demand	Anodyne	ADRB3	40	42
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccc(Br)cc1	ZINC000819282575	EI	On-Demand	Anodyne	SLC18A3	18	59
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccc(Br)cc1	ZINC000819282576	EI	On-Demand	Anodyne	SLC18A3	18	59
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@@H]2C[C@@H](c3cccc(F)c3)C2)CC1	ZINC000819282589	GH	On-Demand	Anodyne	GPR119	22	42
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@@H]2C[C@@H](c3cccc(F)c3)C2)CC1	ZINC000819282590	GH	On-Demand	Anodyne	GPR119	22	42
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccccc1Cl	ZINC000819282596	DH	On-Demand	Anodyne	OPRL1	26	51
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccccc1Cl	ZINC000819282596	DH	On-Demand	Anodyne	SLC18A3	19	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@@H](c3ccccc3)C2)CC1	ZINC000819282597	FH	On-Demand	Anodyne	CCR8	28	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@@H](c3ccccc3)C2)CC1	ZINC000819282597	FH	On-Demand	Anodyne	GPR119	45	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@@H](c3ccccc3)C2)CC1	ZINC000819282598	FH	On-Demand	Anodyne	CCR8	28	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@@H](c3ccccc3)C2)CC1	ZINC000819282598	FH	On-Demand	Anodyne	GPR119	45	51
Cc1ccccc1[C@@H](O)CN[C@@H]1C[C@@H](c2ccccc2)C1	ZINC000819282633	CH	On-Demand	Anodyne	SLC18A3	20	40
CSc1ccc(CCNC[C@H](O)c2ccccc2)cc1	ZINC000819282635	CG	On-Demand	Anodyne	ADRB2	87	66
CSc1ccc(CCNC[C@H](O)c2ccccc2)cc1	ZINC000819282635	CG	On-Demand	Anodyne	ADRB1	97	51
CSc1ccc(CCNC[C@H](O)c2ccccc2)cc1	ZINC000819282635	CG	On-Demand	Anodyne	ADRB3	159	58
CSc1ccc(CCNC[C@H](O)c2ccccc2)cc1	ZINC000819282635	CG	On-Demand	Anodyne	AOC3	17	43
CSc1ccc(CCNC[C@@H](O)c2ccccc2)cc1	ZINC000819282636	CG	On-Demand	Anodyne	ADRB2	87	66
CSc1ccc(CCNC[C@@H](O)c2ccccc2)cc1	ZINC000819282636	CG	On-Demand	Anodyne	ADRB1	97	51
CSc1ccc(CCNC[C@@H](O)c2ccccc2)cc1	ZINC000819282636	CG	On-Demand	Anodyne	ADRB3	159	58
CSc1ccc(CCNC[C@@H](O)c2ccccc2)cc1	ZINC000819282636	CG	On-Demand	Anodyne	AOC3	17	43
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1c(F)cccc1F	ZINC000819282637	DH	On-Demand	Anodyne	SLC18A3	20	43
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1c(F)cccc1F	ZINC000819282638	DH	On-Demand	Anodyne	SLC18A3	20	43
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccccc1Br	ZINC000819282659	EI	On-Demand	Anodyne	SLC18A3	20	59
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccccc1Br	ZINC000819282660	EI	On-Demand	Anodyne	SLC18A3	20	59
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@@H](c3cccc(F)c3)C2)c1	ZINC000819282665	EG	On-Demand	Bother	CACNA1C	53	38
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@@H](c3cccc(F)c3)C2)c1	ZINC000819282665	EG	On-Demand	Bother	CACNA1D	85	38
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@@H](c3cccc(F)c3)C2)c1	ZINC000819282666	EG	On-Demand	Bother	CACNA1C	53	38
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@@H](c3cccc(F)c3)C2)c1	ZINC000819282666	EG	On-Demand	Bother	CACNA1D	85	38
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2C[C@@H](c3ccccc3)C2)cc1	ZINC000819282673	EF	On-Demand	Anodyne	ADRB3	34	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2C[C@@H](c3ccccc3)C2)cc1	ZINC000819282674	EF	On-Demand	Anodyne	ADRB3	34	40
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2F)C1)c1ccccc1C(F)(F)F	ZINC000819282688	FI	On-Demand	Anodyne	RBP4	52	35
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2F)C1)c1ccccc1C(F)(F)F	ZINC000819282689	FI	On-Demand	Anodyne	RBP4	52	35
CSc1ccc(CCNC[C@H](O)C2CC2)cc1	ZINC000819282702	CE	On-Demand	Anodyne	ADRB2	17	46
CSc1ccc(CCNC[C@@H](O)C2CC2)cc1	ZINC000819282703	CE	On-Demand	Anodyne	ADRB2	17	46
C[C@]1(CNCCC(=O)Nc2ccccc2F)CCN(Cc2ccccc2)C1	ZINC000819282739	FH	On-Demand	Anodyne	NPFFR1	42	40
CSc1ccc(CCNC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819282740	DF	On-Demand	Anodyne	ADRB2	38	46
CSc1ccc(CCNC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819282740	DF	On-Demand	Anodyne	ADRB3	83	38
CSc1ccc(CCNC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819282741	DF	On-Demand	Anodyne	ADRB2	38	46
CSc1ccc(CCNC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819282741	DF	On-Demand	Anodyne	ADRB3	83	38
C[C@@]1(CNCCC(=O)Nc2ccccc2F)CCN(Cc2ccccc2)C1	ZINC000819282742	FH	On-Demand	Anodyne	NPFFR1	42	40
O[C@H](CN[C@@H]1C[C@@H](c2cccc(C(F)(F)F)c2)C1)c1cccnc1	ZINC000819282743	EH	On-Demand	Anodyne	ADRB3	41	44
O[C@@H](CN[C@@H]1C[C@@H](c2cccc(C(F)(F)F)c2)C1)c1cccnc1	ZINC000819282745	EH	On-Demand	Anodyne	ADRB3	41	44
COCCN(CCC(=O)OC)C(=O)Cc1cccc(NC(C)=O)c1	ZINC000819282763	ED	On-Demand	Anodyne	KCNK3	55	33
COCCN(CCC(=O)OC)C(=O)Cc1cccc(NC(C)=O)c1	ZINC000819282763	ED	On-Demand	Anodyne	KCNK9	55	33
C[C@]1(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])CCN(Cc2ccccc2)C1	ZINC000819282766	GF	On-Demand	Bother	ABCB1	56	38
C[C@@]1(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])CCN(Cc2ccccc2)C1	ZINC000819282767	GF	On-Demand	Bother	ABCB1	56	38
C[C@]1(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])CCN(Cc2ccccc2)C1	ZINC000819282768	GF	On-Demand	Bother	ABCB1	56	38
C[C@@]1(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])CCN(Cc2ccccc2)C1	ZINC000819282770	GF	On-Demand	Bother	ABCB1	56	38
COc1ccc(OC)c([C@H](O)CNC[C@@]2(C)CCN(Cc3ccccc3)C2)c1	ZINC000819282772	GG	On-Demand	Anodyne	SIGMAR1	25	44
CSc1ccc(CCNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819282773	EI	On-Demand	Anodyne	ADRB2	40	47
CSc1ccc(CCNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819282773	EI	On-Demand	Anodyne	ADRB1	42	38
CSc1ccc(CCNC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819282773	EI	On-Demand	Anodyne	ADRB3	70	40
COc1ccc(OC)c([C@H](O)CNC[C@]2(C)CCN(Cc3ccccc3)C2)c1	ZINC000819282774	GG	On-Demand	Anodyne	SIGMAR1	25	44
O[C@H](CN[C@@H]1C[C@@H](c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819282777	DG	On-Demand	Anodyne	ADRB3	70	44
O[C@@H](CN[C@@H]1C[C@@H](c2cccc(Cl)c2)C1)c1cccnc1	ZINC000819282779	DG	On-Demand	Anodyne	ADRB3	70	44
CC(=O)c1cccc(OC[C@H](O)CNC[C@@]2(C)CCN(Cc3ccccc3)C2)c1	ZINC000819282798	GG	On-Demand	Anodyne	ADRB1	42	39
CC(=O)c1cccc(OC[C@H](O)CNC[C@@]2(C)CCN(Cc3ccccc3)C2)c1	ZINC000819282798	GG	On-Demand	Anodyne	ABCB1	53	49
CC(=O)c1cccc(OC[C@H](O)CNC[C@@]2(C)CCN(Cc3ccccc3)C2)c1	ZINC000819282798	GG	On-Demand	Anodyne	PDS	65	35
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@]2(C)CCN(Cc3ccccc3)C2)c1	ZINC000819282800	GG	On-Demand	Anodyne	ADRB1	42	39
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@]2(C)CCN(Cc3ccccc3)C2)c1	ZINC000819282800	GG	On-Demand	Anodyne	ABCB1	53	49
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@]2(C)CCN(Cc3ccccc3)C2)c1	ZINC000819282800	GG	On-Demand	Anodyne	PDS	65	35
CC(=O)c1cccc(OC[C@@H](O)CNC[C@]2(C)CCN(Cc3ccccc3)C2)c1	ZINC000819282803	GG	On-Demand	Anodyne	ADRB1	42	39
CC(=O)c1cccc(OC[C@@H](O)CNC[C@]2(C)CCN(Cc3ccccc3)C2)c1	ZINC000819282803	GG	On-Demand	Anodyne	ABCB1	53	49
CC(=O)c1cccc(OC[C@@H](O)CNC[C@]2(C)CCN(Cc3ccccc3)C2)c1	ZINC000819282803	GG	On-Demand	Anodyne	PDS	65	35
CC(=O)c1cccc(OC[C@H](O)CNC[C@]2(C)CCN(Cc3ccccc3)C2)c1	ZINC000819282805	GG	On-Demand	Anodyne	ADRB1	42	39
CC(=O)c1cccc(OC[C@H](O)CNC[C@]2(C)CCN(Cc3ccccc3)C2)c1	ZINC000819282805	GG	On-Demand	Anodyne	ABCB1	53	49
CC(=O)c1cccc(OC[C@H](O)CNC[C@]2(C)CCN(Cc3ccccc3)C2)c1	ZINC000819282805	GG	On-Demand	Anodyne	PDS	65	35
C=C(C)C(C)(C)C(=O)Oc1ccc(NC(=O)COC)cc1	ZINC000819282812	CF	On-Demand	Mild	ACR	50	37
Cc1cc(CNC[C@H](O)c2cccnc2)ccc1I	ZINC000819282834	FF	On-Demand	Anodyne	ADRB2	28	45
Cc1cc(CNC[C@H](O)c2cccnc2)ccc1I	ZINC000819282834	FF	On-Demand	Anodyne	ADRB1	32	45
Cc1cc(CNC[C@H](O)c2cccnc2)ccc1I	ZINC000819282834	FF	On-Demand	Anodyne	ADRB3	105	50
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)C(F)=C1CCC1	ZINC000819282835	EF	On-Demand	Anodyne	SIGMAR1	28	46
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)C(F)=C1CCC1	ZINC000819282835	EF	On-Demand	Anodyne	MCHR1	19	43
O[C@H](CN[C@@H]1C[C@@H](c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819282836	DH	On-Demand	Anodyne	ADRB1	30	41
O[C@H](CN[C@@H]1C[C@@H](c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819282836	DH	On-Demand	Anodyne	ADRB3	49	44
O[C@@H](CN[C@@H]1C[C@@H](c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819282837	DH	On-Demand	Anodyne	ADRB1	30	41
O[C@@H](CN[C@@H]1C[C@@H](c2cccc(Cl)c2)C1)c1ccccc1	ZINC000819282837	DH	On-Demand	Anodyne	ADRB3	49	44
Cc1cc(CNC[C@@H](O)c2cccnc2)ccc1I	ZINC000819282840	FF	On-Demand	Anodyne	ADRB2	28	45
Cc1cc(CNC[C@@H](O)c2cccnc2)ccc1I	ZINC000819282840	FF	On-Demand	Anodyne	ADRB1	32	45
Cc1cc(CNC[C@@H](O)c2cccnc2)ccc1I	ZINC000819282840	FF	On-Demand	Anodyne	ADRB3	105	50
Cc1ccc(OC[C@H](O)CNC[C@@]2(C)CCN(Cc3ccccc3)C2)c(C)c1	ZINC000819282842	GH	On-Demand	Anodyne	ADRB2	15	40
Cc1ccc(OC[C@H](O)CNC[C@@]2(C)CCN(Cc3ccccc3)C2)c(C)c1	ZINC000819282842	GH	On-Demand	Anodyne	ABCB1	55	40
Cc1ccc(OC[C@@H](O)CNC[C@@]2(C)CCN(Cc3ccccc3)C2)c(C)c1	ZINC000819282843	GH	On-Demand	Anodyne	ADRB2	15	40
Cc1ccc(OC[C@@H](O)CNC[C@@]2(C)CCN(Cc3ccccc3)C2)c(C)c1	ZINC000819282843	GH	On-Demand	Anodyne	ABCB1	55	40
Cc1ccc(OC[C@@H](O)CNC[C@]2(C)CCN(Cc3ccccc3)C2)c(C)c1	ZINC000819282844	GH	On-Demand	Anodyne	ADRB2	15	40
Cc1ccc(OC[C@@H](O)CNC[C@]2(C)CCN(Cc3ccccc3)C2)c(C)c1	ZINC000819282844	GH	On-Demand	Anodyne	ABCB1	55	40
Cc1ccc(OC[C@H](O)CNC[C@]2(C)CCN(Cc3ccccc3)C2)c(C)c1	ZINC000819282845	GH	On-Demand	Anodyne	ADRB2	15	40
Cc1ccc(OC[C@H](O)CNC[C@]2(C)CCN(Cc3ccccc3)C2)c(C)c1	ZINC000819282845	GH	On-Demand	Anodyne	ABCB1	55	40
CSc1ccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819282858	FF	On-Demand	Anodyne	ADRB2	73	53
CSc1ccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819282858	FF	On-Demand	Anodyne	ADRB1	70	42
CSc1ccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819282858	FF	On-Demand	Anodyne	ADRB3	149	47
CSc1ccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819282860	FF	On-Demand	Anodyne	ADRB2	73	53
CSc1ccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819282860	FF	On-Demand	Anodyne	ADRB1	70	42
CSc1ccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819282860	FF	On-Demand	Anodyne	ADRB3	149	47
CSc1ccc(CCNC[C@H](O)CN(C)C(=O)OC(C)(C)C)cc1	ZINC000819282868	FF	On-Demand	Anodyne	ADRB1	43	38
CSc1ccc(CCNC[C@H](O)CN(C)C(=O)OC(C)(C)C)cc1	ZINC000819282868	FF	On-Demand	Anodyne	ADRB3	42	40
CSc1ccc(CCNC[C@@H](O)CN(C)C(=O)OC(C)(C)C)cc1	ZINC000819282870	FF	On-Demand	Anodyne	ADRB1	43	38
CSc1ccc(CCNC[C@@H](O)CN(C)C(=O)OC(C)(C)C)cc1	ZINC000819282870	FF	On-Demand	Anodyne	ADRB3	42	40
CSc1ccc([C@H](C)NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819282872	GI	On-Demand	Anodyne	GPR119	54	52
CSc1ccc([C@H](C)NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819282875	GI	On-Demand	Anodyne	GPR119	54	52
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819282880	DI	On-Demand	Anodyne	ADRB1	28	40
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819282880	DI	On-Demand	Anodyne	ADRB3	45	44
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819282882	DI	On-Demand	Anodyne	ADRB1	28	40
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819282882	DI	On-Demand	Anodyne	ADRB3	45	44
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000819282883	GF	On-Demand	Anodyne	SIGMAR1	25	44
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000819282883	GF	On-Demand	Anodyne	NPFFR2	31	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000819282883	GF	On-Demand	Anodyne	NPFFR1	42	37
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@@H](c3cccc(F)c3)C2)CC1	ZINC000819282884	GH	On-Demand	Anodyne	CCR5	79	33
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@@H](c3cccc(F)c3)C2)CC1	ZINC000819282884	GH	On-Demand	Anodyne	GPR119	40	56
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000819282885	GF	On-Demand	Anodyne	SIGMAR1	25	44
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000819282885	GF	On-Demand	Anodyne	NPFFR2	31	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000819282885	GF	On-Demand	Anodyne	NPFFR1	42	37
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@@H](c3cccc(F)c3)C2)CC1	ZINC000819282886	GH	On-Demand	Anodyne	CCR5	79	33
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@@H](c3cccc(F)c3)C2)CC1	ZINC000819282886	GH	On-Demand	Anodyne	GPR119	40	56
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000819282887	GF	On-Demand	Anodyne	SIGMAR1	25	44
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000819282887	GF	On-Demand	Anodyne	NPFFR2	31	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000819282887	GF	On-Demand	Anodyne	NPFFR1	42	37
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000819282889	GF	On-Demand	Anodyne	SIGMAR1	25	44
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000819282889	GF	On-Demand	Anodyne	NPFFR2	31	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000819282889	GF	On-Demand	Anodyne	NPFFR1	42	37
CSc1ccc(CCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819282898	DH	On-Demand	Anodyne	ADRB2	52	61
CSc1ccc(CCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819282898	DH	On-Demand	Anodyne	ADRB1	52	47
CSc1ccc(CCNC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819282898	DH	On-Demand	Anodyne	ADRB3	95	47
CSc1ccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819282899	DH	On-Demand	Anodyne	ADRB2	52	61
CSc1ccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819282899	DH	On-Demand	Anodyne	ADRB1	52	47
CSc1ccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819282899	DH	On-Demand	Anodyne	ADRB3	95	47
CSc1ccc(CCNC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819282900	DG	On-Demand	Mild	ADRB2	41	54
CSc1ccc(CCNC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819282900	DG	On-Demand	Mild	ADRB1	42	39
CSc1ccc(CCNC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819282900	DG	On-Demand	Mild	ADRB3	73	42
CSc1ccc(CCNC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819282901	DG	On-Demand	Mild	ADRB2	41	54
CSc1ccc(CCNC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819282901	DG	On-Demand	Mild	ADRB1	42	39
CSc1ccc(CCNC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819282901	DG	On-Demand	Mild	ADRB3	73	42
C[C@@H]1[C@@H](NC[C@H](O)c2ccc(F)cc2)CC(=O)N1Cc1ccccc1	ZINC000819282924	EF	On-Demand	Anodyne	SLC6A3	30	41
C[C@@H]1[C@@H](NC[C@@H](O)c2ccc(F)cc2)CC(=O)N1Cc1ccccc1	ZINC000819282925	EF	On-Demand	Anodyne	SLC6A3	30	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)Cc2nsc3ccccc23)c1	ZINC000819282928	FH	On-Demand	Mild	PDS	45	37
CC[C@H](C#N)Oc1cccc(CNC(=O)Cc2nsc3ccccc23)c1	ZINC000819282929	FH	On-Demand	Mild	PDS	45	37
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H]1CCc2ccccc2C1	ZINC000819282999	GH	On-Demand	Mild	PAPA1_CARPA	49	42
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H]1CCc2ccccc2C1	ZINC000819282999	GH	On-Demand	Mild	REN	46	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(Oc3ccccn3)cc1)C2	ZINC000819283004	GH	On-Demand	Anodyne	CFTR	36	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(Oc3ccccn3)cc1)C2	ZINC000819283005	GH	On-Demand	Anodyne	CFTR	36	40
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H]1CCc2ccccc2C1	ZINC000819283007	GH	On-Demand	Mild	PAPA1_CARPA	49	42
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H]1CCc2ccccc2C1	ZINC000819283007	GH	On-Demand	Mild	REN	46	35
CC[C@H](C#N)Oc1cccc(CNC(=O)C[C@@H](C)n2cccn2)c1	ZINC000819283027	EF	On-Demand	Mild	PDS	46	36
CC[C@H](C#N)Oc1cccc(CNC(=O)C[C@H](C)n2cccn2)c1	ZINC000819283028	EF	On-Demand	Mild	PDS	46	36
CC[C@@H](C#N)Oc1cccc(CNC(=O)C[C@H](C)n2cccn2)c1	ZINC000819283030	EF	On-Demand	Mild	PDS	46	36
CC[C@@H](C#N)Oc1cccc(CNC(=O)C[C@@H](C)n2cccn2)c1	ZINC000819283033	EF	On-Demand	Mild	PDS	46	36
CCOC[C@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819283087	FF	On-Demand	Mild	PAPA1_CARPA	33	43
CCOC[C@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819283090	FF	On-Demand	Mild	PAPA1_CARPA	33	43
NC(=O)C1(NC(=O)c2nn(-c3cccc(Cl)c3F)c3c2CCC3)CCCC1	ZINC000819283092	GF	On-Demand	Anodyne	CNR1	54	33
CSc1ccc([C@@H](C)NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819283099	GI	On-Demand	Anodyne	GPR119	54	52
CSc1ccc([C@@H](C)NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819283101	GI	On-Demand	Anodyne	GPR119	54	52
O[C@H](CN[C@@H]1C[C@@H](c2cccc(C(F)(F)F)c2)C1)c1ccccc1	ZINC000819283104	EI	On-Demand	Anodyne	ADRB3	15	41
O[C@@H](CN[C@@H]1C[C@@H](c2cccc(C(F)(F)F)c2)C1)c1ccccc1	ZINC000819283107	EI	On-Demand	Anodyne	ADRB3	15	41
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1cccc(F)c1	ZINC000819283109	CG	On-Demand	Anodyne	SLC18A3	17	44
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1cccc(F)c1	ZINC000819283111	CG	On-Demand	Anodyne	SLC18A3	17	44
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)C1CC1	ZINC000819283127	BE	On-Demand	Anodyne	SLC18A3	30	42
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)C1CC1	ZINC000819283128	BE	On-Demand	Anodyne	SLC18A3	30	42
C=CCCn1cc(C(=O)Oc2ccc(NC(=O)COC)cc2)nn1	ZINC000819283136	ED	On-Demand	Mild	ACR	50	38
C=C(C)[C@@H]1OCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819283143	CD	On-Demand	Mild	ADRB1	19	40
C=C(C)[C@@H]1OCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819283143	CD	On-Demand	Mild	ADRB3	70	42
C=C(C)[C@@H]1OCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819283144	CD	On-Demand	Mild	ADRB1	19	40
C=C(C)[C@@H]1OCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819283144	CD	On-Demand	Mild	ADRB3	70	42
C=C(C)[C@@H]1OCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819283145	CD	On-Demand	Mild	ADRB1	19	40
C=C(C)[C@@H]1OCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819283145	CD	On-Demand	Mild	ADRB3	70	42
C=C(C)[C@@H]1OCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819283146	CD	On-Demand	Mild	ADRB1	19	40
C=C(C)[C@@H]1OCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819283146	CD	On-Demand	Mild	ADRB3	70	42
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccccc1F	ZINC000819283160	CG	On-Demand	Anodyne	SLC18A3	26	40
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccccc1F	ZINC000819283161	CG	On-Demand	Anodyne	SLC18A3	26	40
O[C@H](CN[C@@H]1C[C@@H](c2cccc(F)c2)C1)c1cccnc1	ZINC000819283173	CF	On-Demand	Anodyne	ADRB1	17	41
O[C@H](CN[C@@H]1C[C@@H](c2cccc(F)c2)C1)c1cccnc1	ZINC000819283173	CF	On-Demand	Anodyne	ADRB3	55	44
O[C@@H](CN[C@@H]1C[C@@H](c2cccc(F)c2)C1)c1cccnc1	ZINC000819283174	CF	On-Demand	Anodyne	ADRB1	17	41
O[C@@H](CN[C@@H]1C[C@@H](c2cccc(F)c2)C1)c1cccnc1	ZINC000819283174	CF	On-Demand	Anodyne	ADRB3	55	44
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000819283202	GI	On-Demand	Bother	CACNA1C	46	37
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000819283202	GI	On-Demand	Bother	CACNA1D	70	37
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000819283203	GI	On-Demand	Bother	CACNA1C	46	37
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@@H](c3cccc(C(F)(F)F)c3)C2)c1	ZINC000819283203	GI	On-Demand	Bother	CACNA1D	70	37
CN(Cc1cn[nH]c1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819283220	ED	On-Demand	Mild	PAPA1_CARPA	44	42
CN(Cc1cn[nH]c1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819283222	ED	On-Demand	Mild	PAPA1_CARPA	44	42
CCOc1cc(CNC(=O)C(F)=C2CCC2)ccc1OC	ZINC000819283237	CG	On-Demand	Anodyne	MT-ND1	24	42
CCOc1cc(CNC(=O)C(F)=C2CCC2)ccc1OC	ZINC000819283237	CG	On-Demand	Anodyne	DRTS_TRYCR	47	34
C[C@]1(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)CCN(Cc2ccccc2)C1	ZINC000819283243	GI	On-Demand	Anodyne	SIGMAR1	15	52
C[C@]1(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)CCN(Cc2ccccc2)C1	ZINC000819283245	GI	On-Demand	Anodyne	SIGMAR1	15	52
C[C@@]1(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)CCN(Cc2ccccc2)C1	ZINC000819283248	GI	On-Demand	Anodyne	SIGMAR1	15	52
C[C@@]1(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)CCN(Cc2ccccc2)C1	ZINC000819283251	GI	On-Demand	Anodyne	SIGMAR1	15	52
C[C@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)C1	ZINC000819283257	GF	On-Demand	Bother	ADRB2	19	47
C[C@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)C1	ZINC000819283257	GF	On-Demand	Bother	ADRB1	29	47
C[C@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)C1	ZINC000819283257	GF	On-Demand	Bother	ADRB3	23	47
C[C@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)C1	ZINC000819283257	GF	On-Demand	Bother	PDS	36	45
C[C@@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)C1	ZINC000819283259	GF	On-Demand	Bother	ADRB2	19	47
C[C@@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)C1	ZINC000819283259	GF	On-Demand	Bother	ADRB1	29	47
C[C@@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)C1	ZINC000819283259	GF	On-Demand	Bother	ADRB3	23	47
C[C@@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)C1	ZINC000819283259	GF	On-Demand	Bother	PDS	36	45
C[C@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)C1	ZINC000819283260	GF	On-Demand	Bother	ADRB2	19	47
C[C@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)C1	ZINC000819283260	GF	On-Demand	Bother	ADRB1	29	47
C[C@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)C1	ZINC000819283260	GF	On-Demand	Bother	ADRB3	23	47
C[C@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)C1	ZINC000819283260	GF	On-Demand	Bother	PDS	36	45
C[C@@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)C1	ZINC000819283261	GF	On-Demand	Bother	ADRB2	19	47
C[C@@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)C1	ZINC000819283261	GF	On-Demand	Bother	ADRB1	29	47
C[C@@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)C1	ZINC000819283261	GF	On-Demand	Bother	ADRB3	23	47
C[C@@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CCN(Cc2ccccc2)C1	ZINC000819283261	GF	On-Demand	Bother	PDS	36	45
Cc1cc(CNC[C@H](O)c2cccc(F)c2)ccc1I	ZINC000819283264	GH	On-Demand	Anodyne	ADRB1	15	42
Cc1cc(CNC[C@H](O)c2cccc(F)c2)ccc1I	ZINC000819283264	GH	On-Demand	Anodyne	ADRB3	25	42
Cc1cc(CNC[C@@H](O)c2cccc(F)c2)ccc1I	ZINC000819283268	GH	On-Demand	Anodyne	ADRB1	15	42
Cc1cc(CNC[C@@H](O)c2cccc(F)c2)ccc1I	ZINC000819283268	GH	On-Demand	Anodyne	ADRB3	25	42
C[C@@H]1CCC[C@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819283287	CG	On-Demand	Anodyne	ADRB1	37	45
C[C@@H]1CCC[C@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819283287	CG	On-Demand	Anodyne	ADRB3	51	45
C[C@@H]1CCC[C@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819283291	CG	On-Demand	Anodyne	ADRB1	37	45
C[C@@H]1CCC[C@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819283291	CG	On-Demand	Anodyne	ADRB3	51	45
CC[C@@H](C#N)Oc1cccc(CNC(=O)C2(c3ccc(C)cc3)CCC2)c1	ZINC000819283293	FI	On-Demand	Mild	PDS	40	35
CC[C@H](C#N)Oc1cccc(CNC(=O)C2(c3ccc(C)cc3)CCC2)c1	ZINC000819283296	FI	On-Demand	Mild	PDS	40	35
COc1cccc([S@@](=O)CC(=O)NCCOc2cccnc2)c1	ZINC000819283308	ED	On-Demand	Anodyne	MTNR1A	45	49
COc1cccc([S@@](=O)CC(=O)NCCOc2cccnc2)c1	ZINC000819283308	ED	On-Demand	Anodyne	MTNR1B	44	49
C[C@@]1(CNCCS(=O)(=O)c2ccc(F)cc2)CCN(Cc2ccccc2)C1	ZINC000819283323	GG	On-Demand	Anodyne	SIGMAR1	25	40
C[C@]1(CNCCS(=O)(=O)c2ccc(F)cc2)CCN(Cc2ccccc2)C1	ZINC000819283325	GG	On-Demand	Anodyne	SIGMAR1	25	40
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	TSHR	42	31
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	OPRM1	25	43
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	OPRD1	26	41
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	MME	48	40
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	LTA4H	21	46
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	ANPEP	53	45
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	TACR1	20	52
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	FCER2	52	32
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	CASP3	33	44
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	TACR2	15	41
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	RNPEP	22	40
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	PTGER3	51	34
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	KLK3	89	43
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	CTSB	83	47
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	PAPA1_CARPA	80	44
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	CYSP_TRYCR	47	42
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	CTSK	60	51
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	CTSL	61	48
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	CPA1	22	41
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	TIMP3	63	33
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	CAPNS1	81	43
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	MMP2	26	44
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	MMP3	48	48
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	MMP8	29	42
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	HLA-DRB1	50	39
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	LNPEP	17	40
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	CTSS	28	48
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	CAPN1	126	50
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	MMP9	32	42
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	CAPN2	168	46
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	ACE2	47	41
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	CASP9	40	35
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	LAP3	20	40
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	MMP1	41	44
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	FPR1	78	47
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	NPR	107	45
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	AMP1_PLAFQ	23	42
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	PSMB5	51	47
CC(=O)Nc1cccc(CC(=O)N[C@@H](CC(C)C)C(=O)OCc2ccccc2)c1	ZINC000819283326	GG	On-Demand	Anodyne	Q9NAW4_PLAFA	41	32
C#C[C@H](NC[C@H](O)Cc1ccc2ccccc2c1)C(C)C	ZINC000819283335	CF	On-Demand	Mild	ADRB2	19	48
C#C[C@H](NC[C@H](O)Cc1ccc2ccccc2c1)C(C)C	ZINC000819283335	CF	On-Demand	Mild	FCER2	30	42
C#C[C@H](NC[C@@H](O)Cc1ccc2ccccc2c1)C(C)C	ZINC000819283337	CF	On-Demand	Mild	ADRB2	19	48
C#C[C@H](NC[C@@H](O)Cc1ccc2ccccc2c1)C(C)C	ZINC000819283337	CF	On-Demand	Mild	FCER2	30	42
C#C[C@@H](NC[C@@H](O)Cc1ccc2ccccc2c1)C(C)C	ZINC000819283338	CF	On-Demand	Mild	ADRB2	19	48
C#C[C@@H](NC[C@@H](O)Cc1ccc2ccccc2c1)C(C)C	ZINC000819283338	CF	On-Demand	Mild	FCER2	30	42
C#C[C@@H](NC[C@H](O)Cc1ccc2ccccc2c1)C(C)C	ZINC000819283340	CF	On-Demand	Mild	ADRB2	19	48
C#C[C@@H](NC[C@H](O)Cc1ccc2ccccc2c1)C(C)C	ZINC000819283340	CF	On-Demand	Mild	FCER2	30	42
O[C@H](CNCc1cc(Cl)ccc1N1CCOCC1)c1cccnc1	ZINC000819283344	EE	On-Demand	Anodyne	ADRB3	74	41
O[C@H](CNCc1cc(Cl)ccc1N1CCOCC1)c1cccnc1	ZINC000819283344	EE	On-Demand	Anodyne	SCN10A	15	42
O[C@@H](CNCc1cc(Cl)ccc1N1CCOCC1)c1cccnc1	ZINC000819283345	EE	On-Demand	Anodyne	ADRB3	74	41
O[C@@H](CNCc1cc(Cl)ccc1N1CCOCC1)c1cccnc1	ZINC000819283345	EE	On-Demand	Anodyne	SCN10A	15	42
CC(=O)c1ccc(OC[C@H](O)CNC[C@@]2(C)CCN(Cc3ccccc3)C2)cc1	ZINC000819283366	GG	On-Demand	Anodyne	ADRB1	68	39
CC(=O)c1ccc(OC[C@H](O)CNC[C@@]2(C)CCN(Cc3ccccc3)C2)cc1	ZINC000819283366	GG	On-Demand	Anodyne	ADRB3	46	39
CC(=O)c1ccc(OC[C@H](O)CNC[C@@]2(C)CCN(Cc3ccccc3)C2)cc1	ZINC000819283366	GG	On-Demand	Anodyne	ABCB1	51	54
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819283367	DH	On-Demand	Anodyne	ADRB3	20	44
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccc(Cl)cc1	ZINC000819283367	DH	On-Demand	Anodyne	SLC18A3	15	45
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@]2(C)CCN(Cc3ccccc3)C2)cc1	ZINC000819283368	GG	On-Demand	Anodyne	ADRB1	68	39
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@]2(C)CCN(Cc3ccccc3)C2)cc1	ZINC000819283368	GG	On-Demand	Anodyne	ADRB3	46	39
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@]2(C)CCN(Cc3ccccc3)C2)cc1	ZINC000819283368	GG	On-Demand	Anodyne	ABCB1	51	54
CC(=O)c1ccc(OC[C@@H](O)CNC[C@]2(C)CCN(Cc3ccccc3)C2)cc1	ZINC000819283369	GG	On-Demand	Anodyne	ADRB1	68	39
CC(=O)c1ccc(OC[C@@H](O)CNC[C@]2(C)CCN(Cc3ccccc3)C2)cc1	ZINC000819283369	GG	On-Demand	Anodyne	ADRB3	46	39
CC(=O)c1ccc(OC[C@@H](O)CNC[C@]2(C)CCN(Cc3ccccc3)C2)cc1	ZINC000819283369	GG	On-Demand	Anodyne	ABCB1	51	54
CC(=O)c1ccc(OC[C@H](O)CNC[C@]2(C)CCN(Cc3ccccc3)C2)cc1	ZINC000819283371	GG	On-Demand	Anodyne	ADRB1	68	39
CC(=O)c1ccc(OC[C@H](O)CNC[C@]2(C)CCN(Cc3ccccc3)C2)cc1	ZINC000819283371	GG	On-Demand	Anodyne	ADRB3	46	39
CC(=O)c1ccc(OC[C@H](O)CNC[C@]2(C)CCN(Cc3ccccc3)C2)cc1	ZINC000819283371	GG	On-Demand	Anodyne	ABCB1	51	54
CN(CCNC[C@H](O)c1cccc(Cl)c1)S(=O)(=O)c1ccc(F)cc1	ZINC000819283386	GE	On-Demand	Anodyne	ADRB1	45	45
CN(CCNC[C@H](O)c1cccc(Cl)c1)S(=O)(=O)c1ccc(F)cc1	ZINC000819283386	GE	On-Demand	Anodyne	ADRB3	81	45
CN(CCNC[C@@H](O)c1cccc(Cl)c1)S(=O)(=O)c1ccc(F)cc1	ZINC000819283390	GE	On-Demand	Anodyne	ADRB1	45	45
CN(CCNC[C@@H](O)c1cccc(Cl)c1)S(=O)(=O)c1ccc(F)cc1	ZINC000819283390	GE	On-Demand	Anodyne	ADRB3	81	45
C[C@]1(CNC[C@@H](O)Cc2ccccc2)CCN(Cc2ccccc2)C1	ZINC000819283392	EG	On-Demand	Anodyne	SIGMAR1	44	41
O[C@H](CN[C@@H]1C[C@@H](c2cccc(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819283393	EI	On-Demand	Anodyne	ADRB3	34	40
C[C@]1(CNC[C@H](O)Cc2ccccc2)CCN(Cc2ccccc2)C1	ZINC000819283394	EG	On-Demand	Anodyne	SIGMAR1	44	41
C[C@@]1(CNC[C@@H](O)Cc2ccccc2)CCN(Cc2ccccc2)C1	ZINC000819283395	EG	On-Demand	Anodyne	SIGMAR1	44	41
C[C@@]1(CNC[C@H](O)Cc2ccccc2)CCN(Cc2ccccc2)C1	ZINC000819283396	EG	On-Demand	Anodyne	SIGMAR1	44	41
O[C@@H](CN[C@@H]1C[C@@H](c2cccc(Cl)c2)C1)c1ccc(F)c(F)c1	ZINC000819283397	EI	On-Demand	Anodyne	ADRB3	34	40
CSc1ccc(CCNC[C@@H](O)c2ccc(C)cc2)cc1	ZINC000819283421	DH	On-Demand	Anodyne	ADRB2	53	58
CSc1ccc(CCNC[C@@H](O)c2ccc(C)cc2)cc1	ZINC000819283421	DH	On-Demand	Anodyne	ADRB1	55	42
CSc1ccc(CCNC[C@@H](O)c2ccc(C)cc2)cc1	ZINC000819283421	DH	On-Demand	Anodyne	ADRB3	108	46
CSc1ccc(CCNC[C@H](O)c2ccc(C)cc2)cc1	ZINC000819283425	DH	On-Demand	Anodyne	ADRB2	53	58
CSc1ccc(CCNC[C@H](O)c2ccc(C)cc2)cc1	ZINC000819283425	DH	On-Demand	Anodyne	ADRB1	55	42
CSc1ccc(CCNC[C@H](O)c2ccc(C)cc2)cc1	ZINC000819283425	DH	On-Demand	Anodyne	ADRB3	108	46
C[C@@H]1CC(CNC[C@H](O)c2cccc(Cl)c2)C[C@@H](C)O1	ZINC000819283432	CG	On-Demand	Anodyne	ADRB1	29	45
C[C@@H]1CC(CNC[C@H](O)c2cccc(Cl)c2)C[C@@H](C)O1	ZINC000819283432	CG	On-Demand	Anodyne	ADRB3	44	42
C[C@H]1C[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C[C@@H](C)O1	ZINC000819283434	CG	On-Demand	Anodyne	ADRB1	29	45
C[C@H]1C[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C[C@@H](C)O1	ZINC000819283434	CG	On-Demand	Anodyne	ADRB3	44	42
C[C@@H]1CC(CNC[C@@H](O)c2cccc(Cl)c2)C[C@@H](C)O1	ZINC000819283436	CG	On-Demand	Anodyne	ADRB1	29	45
C[C@@H]1CC(CNC[C@@H](O)c2cccc(Cl)c2)C[C@@H](C)O1	ZINC000819283436	CG	On-Demand	Anodyne	ADRB3	44	42
C[C@H]1C[C@H](CNC[C@H](O)c2cccc(Cl)c2)C[C@@H](C)O1	ZINC000819283438	CG	On-Demand	Anodyne	ADRB1	29	45
C[C@H]1C[C@H](CNC[C@H](O)c2cccc(Cl)c2)C[C@@H](C)O1	ZINC000819283438	CG	On-Demand	Anodyne	ADRB3	44	42
CCOc1cc(CNC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)ccc1OC	ZINC000819283440	GF	On-Demand	Anodyne	SSTR5	42	36
COc1ccc(OC)c([C@H](O)CNCCc2ccc(SC)cc2)c1	ZINC000819283442	EG	On-Demand	Anodyne	ADRB2	59	58
COc1ccc(OC)c([C@H](O)CNCCc2ccc(SC)cc2)c1	ZINC000819283442	EG	On-Demand	Anodyne	ADRB1	67	41
COc1ccc(OC)c([C@H](O)CNCCc2ccc(SC)cc2)c1	ZINC000819283442	EG	On-Demand	Anodyne	ADRB3	58	44
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccc(F)c(F)c1	ZINC000819283448	DH	On-Demand	Anodyne	SLC18A3	15	41
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccc(F)c(F)c1	ZINC000819283449	DH	On-Demand	Anodyne	SLC18A3	15	41
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819283453	DH	On-Demand	Anodyne	ADRB1	35	45
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819283453	DH	On-Demand	Anodyne	ADRB3	54	49
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819283454	DH	On-Demand	Anodyne	ADRB1	35	45
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1cccc(Cl)c1	ZINC000819283454	DH	On-Demand	Anodyne	ADRB3	54	49
CSc1ccc(CCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819283455	DG	On-Demand	Anodyne	ADRB2	60	58
CSc1ccc(CCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819283455	DG	On-Demand	Anodyne	ADRB1	60	41
CSc1ccc(CCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819283455	DG	On-Demand	Anodyne	ADRB3	105	45
CSc1ccc(CCNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819283455	DG	On-Demand	Anodyne	LEF	26	41
CSc1ccc(CCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819283456	DG	On-Demand	Anodyne	ADRB2	60	58
CSc1ccc(CCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819283456	DG	On-Demand	Anodyne	ADRB1	60	41
CSc1ccc(CCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819283456	DG	On-Demand	Anodyne	ADRB3	105	45
CSc1ccc(CCNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819283456	DG	On-Demand	Anodyne	LEF	26	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@@H](c3ccccc3)C2)c1	ZINC000819283458	DG	On-Demand	Bother	CACNA1C	63	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@@H](c3ccccc3)C2)c1	ZINC000819283458	DG	On-Demand	Bother	CACNA1D	92	41
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@@H](c3ccccc3)C2)c1	ZINC000819283459	DG	On-Demand	Bother	CACNA1C	63	41
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@@H](c3ccccc3)C2)c1	ZINC000819283459	DG	On-Demand	Bother	CACNA1D	92	41
CCOc1cc(CNC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)ccc1OC	ZINC000819283510	GF	On-Demand	Anodyne	SSTR5	42	36
C[C@@H]1CC(CNC[C@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819283525	CD	On-Demand	Anodyne	ADRB2	20	42
C[C@@H]1CC(CNC[C@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819283525	CD	On-Demand	Anodyne	ADRB1	22	42
C[C@@H]1CC(CNC[C@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819283525	CD	On-Demand	Anodyne	ADRB3	89	46
C[C@@H]1CC(CNC[C@@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819283527	CD	On-Demand	Anodyne	ADRB2	20	42
C[C@@H]1CC(CNC[C@@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819283527	CD	On-Demand	Anodyne	ADRB1	22	42
C[C@@H]1CC(CNC[C@@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819283527	CD	On-Demand	Anodyne	ADRB3	89	46
C[C@H]1C[C@H](CNC[C@@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819283529	CD	On-Demand	Anodyne	ADRB2	20	42
C[C@H]1C[C@H](CNC[C@@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819283529	CD	On-Demand	Anodyne	ADRB1	22	42
C[C@H]1C[C@H](CNC[C@@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819283529	CD	On-Demand	Anodyne	ADRB3	89	46
C[C@H]1C[C@H](CNC[C@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819283531	CD	On-Demand	Anodyne	ADRB2	20	42
C[C@H]1C[C@H](CNC[C@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819283531	CD	On-Demand	Anodyne	ADRB1	22	42
C[C@H]1C[C@H](CNC[C@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819283531	CD	On-Demand	Anodyne	ADRB3	89	46
O=S(=O)(NCCCNC[C@H](O)c1cccc(F)c1)c1ccccc1Cl	ZINC000819283540	GE	On-Demand	Anodyne	ADRB3	48	41
O=S(=O)(NCCCNC[C@@H](O)c1cccc(F)c1)c1ccccc1Cl	ZINC000819283542	GE	On-Demand	Anodyne	ADRB3	48	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819283564	FG	On-Demand	Mild	PDS	53	38
CC[C@H](C#N)Oc1cccc(CNC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819283566	FG	On-Demand	Mild	PDS	53	38
C[C@]1(CNCCC(=O)Nc2ccccc2[N+](=O)[O-])CCN(Cc2ccccc2)C1	ZINC000819283586	GG	On-Demand	Bother	SIGMAR1	15	42
C[C@@]1(CNCCC(=O)Nc2ccccc2[N+](=O)[O-])CCN(Cc2ccccc2)C1	ZINC000819283589	GG	On-Demand	Bother	SIGMAR1	15	42
CSc1ccc(CCNC[C@H](O)c2ccccc2F)cc1	ZINC000819283595	DG	On-Demand	Anodyne	ADRB2	61	48
CSc1ccc(CCNC[C@H](O)c2ccccc2F)cc1	ZINC000819283595	DG	On-Demand	Anodyne	ADRB1	66	42
CSc1ccc(CCNC[C@H](O)c2ccccc2F)cc1	ZINC000819283595	DG	On-Demand	Anodyne	ADRB3	83	41
CSc1ccc(CCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819283597	DG	On-Demand	Anodyne	ADRB2	61	48
CSc1ccc(CCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819283597	DG	On-Demand	Anodyne	ADRB1	66	42
CSc1ccc(CCNC[C@@H](O)c2ccccc2F)cc1	ZINC000819283597	DG	On-Demand	Anodyne	ADRB3	83	41
COc1ccc(-c2nc(C)c([C@H](C)NC(=O)/C=C\[C@H]3CCCO3)s2)cc1	ZINC000819283615	FI	On-Demand	Anodyne	UL26	63	36
COc1ccc(-c2nc(C)c([C@H](C)NC(=O)/C=C\[C@H]3CCCO3)s2)cc1	ZINC000819283615	FI	On-Demand	Anodyne	SCAF_EBVB9	61	31
COc1ccc(-c2nc(C)c([C@H](C)NC(=O)/C=C\[C@@H]3CCCO3)s2)cc1	ZINC000819283617	FI	On-Demand	Anodyne	UL26	63	36
COc1ccc(-c2nc(C)c([C@H](C)NC(=O)/C=C\[C@@H]3CCCO3)s2)cc1	ZINC000819283617	FI	On-Demand	Anodyne	SCAF_EBVB9	61	31
COc1ccc(-c2nc(C)c([C@H](C)NC(=O)/C=C/[C@@H]3CCCO3)s2)cc1	ZINC000819283619	FI	On-Demand	Anodyne	UL26	63	36
COc1ccc(-c2nc(C)c([C@H](C)NC(=O)/C=C/[C@@H]3CCCO3)s2)cc1	ZINC000819283619	FI	On-Demand	Anodyne	SCAF_EBVB9	61	31
COc1ccc(-c2nc(C)c([C@H](C)NC(=O)/C=C/[C@H]3CCCO3)s2)cc1	ZINC000819283622	FI	On-Demand	Anodyne	UL26	63	36
COc1ccc(-c2nc(C)c([C@H](C)NC(=O)/C=C/[C@H]3CCCO3)s2)cc1	ZINC000819283622	FI	On-Demand	Anodyne	SCAF_EBVB9	61	31
CSc1ccc(CCNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819283640	GH	On-Demand	Anodyne	GPR119	50	51
O=S(=O)(NCCCNC[C@H](O)c1cccnc1)c1ccccc1Cl	ZINC000819283643	FD	On-Demand	Anodyne	ADRB2	30	46
O=S(=O)(NCCCNC[C@H](O)c1cccnc1)c1ccccc1Cl	ZINC000819283643	FD	On-Demand	Anodyne	ADRB1	35	44
O=S(=O)(NCCCNC[C@H](O)c1cccnc1)c1ccccc1Cl	ZINC000819283643	FD	On-Demand	Anodyne	ADRB3	120	51
O=S(=O)(NCCCNC[C@H](O)c1cccnc1)c1ccccc1Cl	ZINC000819283643	FD	On-Demand	Anodyne	TBXAS1	31	40
CSc1ccc(CCNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819283644	GH	On-Demand	Anodyne	GPR119	50	51
O=S(=O)(NCCCNC[C@@H](O)c1cccnc1)c1ccccc1Cl	ZINC000819283645	FD	On-Demand	Anodyne	ADRB2	30	46
O=S(=O)(NCCCNC[C@@H](O)c1cccnc1)c1ccccc1Cl	ZINC000819283645	FD	On-Demand	Anodyne	ADRB1	35	44
O=S(=O)(NCCCNC[C@@H](O)c1cccnc1)c1ccccc1Cl	ZINC000819283645	FD	On-Demand	Anodyne	ADRB3	120	51
O=S(=O)(NCCCNC[C@@H](O)c1cccnc1)c1ccccc1Cl	ZINC000819283645	FD	On-Demand	Anodyne	TBXAS1	31	40
CSc1ccc(CCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819283650	DH	On-Demand	Anodyne	ADRB2	44	49
CSc1ccc(CCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819283650	DH	On-Demand	Anodyne	ADRB1	48	41
CSc1ccc(CCNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819283650	DH	On-Demand	Anodyne	ADRB3	76	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@@H](c3ccc(Cl)c(Cl)c3)C2)c1	ZINC000819283654	GI	On-Demand	Bother	CACNA1D	52	32
CSc1ccc(CCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819283656	DH	On-Demand	Anodyne	ADRB2	44	49
CSc1ccc(CCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819283656	DH	On-Demand	Anodyne	ADRB1	48	41
CSc1ccc(CCNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819283656	DH	On-Demand	Anodyne	ADRB3	76	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(Oc2ccccn2)cc1	ZINC000819283657	FH	On-Demand	Anodyne	CFTR	31	41
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@@H](c3ccc(Cl)c(Cl)c3)C2)c1	ZINC000819283660	GI	On-Demand	Bother	CACNA1D	52	32
C[C@@]1(CNCCC(=O)NC(N)=O)CCN(Cc2ccccc2)C1	ZINC000819283662	DD	On-Demand	Anodyne	NPFFR2	41	42
C[C@@]1(CNCCC(=O)NC(N)=O)CCN(Cc2ccccc2)C1	ZINC000819283662	DD	On-Demand	Anodyne	NPFFR1	53	47
C[C@]1(CNCCC(=O)NC(N)=O)CCN(Cc2ccccc2)C1	ZINC000819283663	DD	On-Demand	Anodyne	NPFFR2	41	42
C[C@]1(CNCCC(=O)NC(N)=O)CCN(Cc2ccccc2)C1	ZINC000819283663	DD	On-Demand	Anodyne	NPFFR1	53	47
CN(C[C@H](O)CNC[C@@]1(C)CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819283671	GF	On-Demand	Anodyne	SIGMAR1	22	40
CN(C[C@H](O)CNC[C@]1(C)CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819283672	GF	On-Demand	Anodyne	SIGMAR1	22	40
CN(C[C@@H](O)CNC[C@@]1(C)CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819283674	GF	On-Demand	Anodyne	SIGMAR1	22	40
CN(C[C@@H](O)CNC[C@]1(C)CCN(Cc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819283676	GF	On-Demand	Anodyne	SIGMAR1	22	40
CSc1ccc(CCNC[C@H](O)c2cccnc2)cc1	ZINC000819283689	CF	On-Demand	Anodyne	ADRB2	65	58
CSc1ccc(CCNC[C@H](O)c2cccnc2)cc1	ZINC000819283689	CF	On-Demand	Anodyne	ADRB1	75	54
CSc1ccc(CCNC[C@H](O)c2cccnc2)cc1	ZINC000819283689	CF	On-Demand	Anodyne	ADRB3	178	62
CSc1ccc(CCNC[C@@H](O)c2cccnc2)cc1	ZINC000819283690	CF	On-Demand	Anodyne	ADRB2	65	58
CSc1ccc(CCNC[C@@H](O)c2cccnc2)cc1	ZINC000819283690	CF	On-Demand	Anodyne	ADRB1	75	54
CSc1ccc(CCNC[C@@H](O)c2cccnc2)cc1	ZINC000819283690	CF	On-Demand	Anodyne	ADRB3	178	62
O[C@H](CN[C@@H]1C[C@@H](c2ccc(Cl)c(Cl)c2)C1)c1cccnc1	ZINC000819283750	EH	On-Demand	Anodyne	ADRB3	55	45
O[C@H](CN[C@@H]1C[C@@H](c2ccc(Cl)c(Cl)c2)C1)c1cccnc1	ZINC000819283750	EH	On-Demand	Anodyne	CYP51A1	15	41
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(Cl)c(Cl)c2)C1)c1cccnc1	ZINC000819283758	EH	On-Demand	Anodyne	ADRB3	55	45
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(Cl)c(Cl)c2)C1)c1cccnc1	ZINC000819283758	EH	On-Demand	Anodyne	CYP51A1	15	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@@H](c3ccccc3F)C2)CC1	ZINC000819283784	GH	On-Demand	Anodyne	GPR119	42	55
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@@H](c3ccccc3F)C2)CC1	ZINC000819283786	GH	On-Demand	Anodyne	GPR119	42	55
CC(C)(C)OC(=O)NC[C@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1	ZINC000819283814	II	On-Demand	Anodyne	REN	46	40
CC(C)(C)OC(=O)NC[C@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1	ZINC000819283814	II	On-Demand	Anodyne	FPR1	43	35
CC(C)(C)OC(=O)NC[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1	ZINC000819283817	II	On-Demand	Anodyne	REN	46	40
CC(C)(C)OC(=O)NC[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1	ZINC000819283817	II	On-Demand	Anodyne	FPR1	43	35
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccc(F)cc1	ZINC000819283827	CG	On-Demand	Anodyne	SLC6A3	25	58
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccc(F)cc1	ZINC000819283827	CG	On-Demand	Anodyne	SLC18A3	23	55
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccc(F)cc1	ZINC000819283829	CG	On-Demand	Anodyne	SLC6A3	25	58
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccc(F)cc1	ZINC000819283829	CG	On-Demand	Anodyne	SLC18A3	23	55
CN(CCNC[C@H](O)c1cccnc1)S(=O)(=O)c1ccc(F)cc1	ZINC000819283831	FD	On-Demand	Anodyne	ADRB2	29	47
CN(CCNC[C@H](O)c1cccnc1)S(=O)(=O)c1ccc(F)cc1	ZINC000819283831	FD	On-Demand	Anodyne	ADRB1	28	44
CN(CCNC[C@H](O)c1cccnc1)S(=O)(=O)c1ccc(F)cc1	ZINC000819283831	FD	On-Demand	Anodyne	ADRB3	117	49
CN(CCNC[C@@H](O)c1cccnc1)S(=O)(=O)c1ccc(F)cc1	ZINC000819283832	FD	On-Demand	Anodyne	ADRB2	29	47
CN(CCNC[C@@H](O)c1cccnc1)S(=O)(=O)c1ccc(F)cc1	ZINC000819283832	FD	On-Demand	Anodyne	ADRB1	28	44
CN(CCNC[C@@H](O)c1cccnc1)S(=O)(=O)c1ccc(F)cc1	ZINC000819283832	FD	On-Demand	Anodyne	ADRB3	117	49
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1cc(F)ccc1F	ZINC000819283833	DH	On-Demand	Anodyne	SLC18A3	18	40
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	ZINC000819283863	HG	On-Demand	Anodyne	MPL	64	36
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	ZINC000819283863	HG	On-Demand	Anodyne	CPT1B	40	39
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	ZINC000819283863	HG	On-Demand	Anodyne	SFRP1	58	33
C=CC[C@H](CC)NC[C@H](O)c1cccc(Cl)c1	ZINC000819283905	CG	On-Demand	Mild	ADRB2	15	47
C=CC[C@H](CC)NC[C@H](O)c1cccc(Cl)c1	ZINC000819283905	CG	On-Demand	Mild	ADRB1	29	47
C=CC[C@H](CC)NC[C@H](O)c1cccc(Cl)c1	ZINC000819283905	CG	On-Demand	Mild	ADRB3	45	47
C=CC[C@H](CC)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819283910	CG	On-Demand	Mild	ADRB2	15	47
C=CC[C@H](CC)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819283910	CG	On-Demand	Mild	ADRB1	29	47
C=CC[C@H](CC)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819283910	CG	On-Demand	Mild	ADRB3	45	47
CSc1ccc([C@H](C)NC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819283917	GI	On-Demand	Anodyne	GPR119	20	43
CSc1ccc([C@H](C)NC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819283918	GI	On-Demand	Anodyne	GPR119	20	43
C[C@@H]1CCCC[C@@H]1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819283949	FH	On-Demand	Mild	PAPA1_CARPA	44	52
C[C@@H]1CCCC[C@H]1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819283951	FH	On-Demand	Mild	PAPA1_CARPA	44	52
C[C@@H]1CCCC[C@H]1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819283953	FH	On-Demand	Mild	PAPA1_CARPA	44	52
C[C@@H]1CCCC[C@@H]1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819283954	FH	On-Demand	Mild	PAPA1_CARPA	44	52
C[C@@]1(CNCCS(=O)(=O)c2ccccc2)CCN(Cc2ccccc2)C1	ZINC000819283991	FF	On-Demand	Anodyne	SIGMAR1	30	40
C[C@]1(CNCCS(=O)(=O)c2ccccc2)CCN(Cc2ccccc2)C1	ZINC000819283993	FF	On-Demand	Anodyne	SIGMAR1	30	40
C[C@@]1(CNC[C@@H](O)C2CC2)CCN(Cc2ccccc2)C1	ZINC000819284002	CE	On-Demand	Anodyne	SIGMAR1	52	42
C[C@@H]1[C@@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)CC(=O)N1Cc1ccccc1	ZINC000819284003	GE	On-Demand	Anodyne	CCKAR	21	40
C[C@@H]1[C@@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)CC(=O)N1Cc1ccccc1	ZINC000819284003	GE	On-Demand	Anodyne	FPR1	46	36
C[C@@H]1[C@@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)CC(=O)N1Cc1ccccc1	ZINC000819284004	GE	On-Demand	Anodyne	CCKAR	21	40
C[C@@H]1[C@@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)CC(=O)N1Cc1ccccc1	ZINC000819284004	GE	On-Demand	Anodyne	FPR1	46	36
C[C@]1(CNC[C@@H](O)C2CC2)CCN(Cc2ccccc2)C1	ZINC000819284006	CE	On-Demand	Anodyne	SIGMAR1	52	42
C[C@@]1(CNC[C@H](O)C2CC2)CCN(Cc2ccccc2)C1	ZINC000819284007	CE	On-Demand	Anodyne	SIGMAR1	52	42
C[C@]1(CNC[C@H](O)C2CC2)CCN(Cc2ccccc2)C1	ZINC000819284009	CE	On-Demand	Anodyne	SIGMAR1	52	42
C#C[C@H](NC[C@H](O)COc1ccc(/C=C/C)cc1OC)C(C)C	ZINC000819284017	DF	On-Demand	Mild	ADRB2	20	76
C#C[C@H](NC[C@H](O)COc1ccc(/C=C\C)cc1OC)C(C)C	ZINC000819284019	DF	On-Demand	Mild	ADRB2	20	76
C#C[C@H](NC[C@@H](O)COc1ccc(/C=C\C)cc1OC)C(C)C	ZINC000819284021	DF	On-Demand	Mild	ADRB2	20	76
C#C[C@H](NC[C@@H](O)COc1ccc(/C=C/C)cc1OC)C(C)C	ZINC000819284023	DF	On-Demand	Mild	ADRB2	20	76
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1cc(F)ccc1F	ZINC000819284028	DH	On-Demand	Anodyne	SLC18A3	18	40
CSc1ccc(CCNC[C@@H](O)c2ccccc2C)cc1	ZINC000819284030	DH	On-Demand	Anodyne	ADRB2	62	51
CSc1ccc(CCNC[C@@H](O)c2ccccc2C)cc1	ZINC000819284030	DH	On-Demand	Anodyne	ADRB1	65	40
CSc1ccc(CCNC[C@@H](O)c2ccccc2C)cc1	ZINC000819284030	DH	On-Demand	Anodyne	ADRB3	77	41
CSc1ccc(CCNC[C@H](O)c2ccccc2C)cc1	ZINC000819284033	DH	On-Demand	Anodyne	ADRB2	62	51
CSc1ccc(CCNC[C@H](O)c2ccccc2C)cc1	ZINC000819284033	DH	On-Demand	Anodyne	ADRB1	65	40
CSc1ccc(CCNC[C@H](O)c2ccccc2C)cc1	ZINC000819284033	DH	On-Demand	Anodyne	ADRB3	77	41
Cc1cc(CNC[C@H](O)c2ccc(F)cc2)ccc1I	ZINC000819284057	GH	On-Demand	Anodyne	LEF	77	39
Cc1cc(CNC[C@@H](O)c2ccc(F)cc2)ccc1I	ZINC000819284059	GH	On-Demand	Anodyne	LEF	77	39
CN(CCNC[C@H](O)c1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccc(F)cc1	ZINC000819284071	GD	On-Demand	Bother	MMP8	20	43
CON(C)C(=O)CCNCc1ccc(I)c(C)c1	ZINC000819284073	FE	On-Demand	Anodyne	LEF	41	34
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(Cl)s1	ZINC000819284074	GJ	On-Demand	Mild	PAPA1_CARPA	42	45
CN(CCNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccc(F)cc1	ZINC000819284075	GD	On-Demand	Bother	MMP8	20	43
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(Cl)s1	ZINC000819284079	GJ	On-Demand	Mild	PAPA1_CARPA	42	45
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(Cl)s1	ZINC000819284082	GJ	On-Demand	Mild	PAPA1_CARPA	42	45
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(Cl)s1	ZINC000819284085	GJ	On-Demand	Mild	PAPA1_CARPA	42	45
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@@H](c3cccc(Cl)c3)C2)c1	ZINC000819284100	EH	On-Demand	Bother	CACNA1C	53	36
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@@H](c3cccc(Cl)c3)C2)c1	ZINC000819284100	EH	On-Demand	Bother	ADRB3	39	43
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@@H](c3cccc(Cl)c3)C2)c1	ZINC000819284100	EH	On-Demand	Bother	CACNA1D	85	35
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@@H](c3cccc(Cl)c3)C2)c1	ZINC000819284103	EH	On-Demand	Bother	CACNA1C	53	36
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@@H](c3cccc(Cl)c3)C2)c1	ZINC000819284103	EH	On-Demand	Bother	ADRB3	39	43
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@@H](c3cccc(Cl)c3)C2)c1	ZINC000819284103	EH	On-Demand	Bother	CACNA1D	85	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C(=O)N1CCCC1)C(C)C)C2	ZINC000819284105	FD	On-Demand	Anodyne	ELANE	42	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C(=O)N1CCCC1)C(C)C)C2	ZINC000819284107	FD	On-Demand	Anodyne	ELANE	42	38
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@@H]2C[C@@H](c3ccccc3F)C2)CC1	ZINC000819284126	GH	On-Demand	Anodyne	GPR119	24	41
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@@H]2C[C@@H](c3ccccc3F)C2)CC1	ZINC000819284129	GH	On-Demand	Anodyne	GPR119	24	41
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2F)C1)c1cccnc1	ZINC000819284131	CF	On-Demand	Anodyne	ADRB3	61	44
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2F)C1)c1cccnc1	ZINC000819284132	CF	On-Demand	Anodyne	ADRB3	61	44
O[C@H](CN[C@@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)C1)c1cccnc1	ZINC000819284151	EH	On-Demand	Anodyne	ADRB3	48	44
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(C(F)(F)F)cc2)C1)c1cccnc1	ZINC000819284153	EH	On-Demand	Anodyne	ADRB3	48	44
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccccc1	ZINC000819284180	CG	On-Demand	Anodyne	SLC18A3	23	54
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccccc1	ZINC000819284180	CG	On-Demand	Anodyne	AOC3	15	47
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccccc1	ZINC000819284181	CG	On-Demand	Anodyne	SLC18A3	23	54
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccccc1	ZINC000819284181	CG	On-Demand	Anodyne	AOC3	15	47
CSc1ccc(CCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819284182	DH	On-Demand	Anodyne	ADRB2	58	52
CSc1ccc(CCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819284182	DH	On-Demand	Anodyne	ADRB1	54	41
CSc1ccc(CCNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819284182	DH	On-Demand	Anodyne	ADRB3	57	41
CSc1ccc(CCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819284183	DH	On-Demand	Anodyne	ADRB2	58	52
CSc1ccc(CCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819284183	DH	On-Demand	Anodyne	ADRB1	54	41
CSc1ccc(CCNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819284183	DH	On-Demand	Anodyne	ADRB3	57	41
CSc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819284186	DH	On-Demand	Anodyne	ADRB2	52	57
CSc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819284186	DH	On-Demand	Anodyne	ADRB1	60	51
CSc1ccc(CCNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819284186	DH	On-Demand	Anodyne	ADRB3	103	51
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819284191	DI	On-Demand	Anodyne	SLC18A3	19	41
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccc(F)cc1Cl	ZINC000819284192	DI	On-Demand	Anodyne	SLC18A3	19	41
CSc1ccc(CCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819284195	DG	On-Demand	Anodyne	ADRB2	70	57
CSc1ccc(CCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819284195	DG	On-Demand	Anodyne	ADRB1	73	56
CSc1ccc(CCNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819284195	DG	On-Demand	Anodyne	ADRB3	139	56
CSc1ccc(CCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819284196	DG	On-Demand	Anodyne	ADRB2	70	57
CSc1ccc(CCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819284196	DG	On-Demand	Anodyne	ADRB1	73	56
CSc1ccc(CCNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819284196	DG	On-Demand	Anodyne	ADRB3	139	56
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccc(F)cc1F	ZINC000819284197	DH	On-Demand	Anodyne	SLC18A3	18	40
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2)C1)c1ccc(F)cc1F	ZINC000819284198	DH	On-Demand	Anodyne	SLC18A3	18	40
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819284316	GI	On-Demand	Bother	CACNA1D	40	36
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819284318	GI	On-Demand	Bother	CACNA1D	40	36
CSc1ccc(CCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819284329	DH	On-Demand	Anodyne	ADRB2	88	59
CSc1ccc(CCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819284329	DH	On-Demand	Anodyne	ADRB1	106	63
CSc1ccc(CCNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819284329	DH	On-Demand	Anodyne	ADRB3	166	63
CSc1ccc(CCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819284331	DH	On-Demand	Anodyne	ADRB2	88	59
CSc1ccc(CCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819284331	DH	On-Demand	Anodyne	ADRB1	106	63
CSc1ccc(CCNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819284331	DH	On-Demand	Anodyne	ADRB3	166	63
CSc1ccc([C@@H](C)NC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819284362	GI	On-Demand	Anodyne	GPR119	20	43
CSc1ccc([C@@H](C)NC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819284363	GI	On-Demand	Anodyne	GPR119	20	43
O[C@@H](CNCc1ccncc1OCC(F)(F)F)c1cccc(Cl)c1	ZINC000819284376	FG	On-Demand	Anodyne	ADRB1	34	42
O[C@@H](CNCc1ccncc1OCC(F)(F)F)c1cccc(Cl)c1	ZINC000819284376	FG	On-Demand	Anodyne	ADRB3	48	42
O[C@H](CNCc1ccncc1OCC(F)(F)F)c1cccc(Cl)c1	ZINC000819284377	FG	On-Demand	Anodyne	ADRB1	34	42
O[C@H](CNCc1ccncc1OCC(F)(F)F)c1cccc(Cl)c1	ZINC000819284377	FG	On-Demand	Anodyne	ADRB3	48	42
O=[N+]([O-])c1cccc([C@@H](O)CNC2CCN(c3nccs3)CC2)c1	ZINC000819284378	EE	On-Demand	Bother	ADRB3	33	41
O=[N+]([O-])c1cccc([C@H](O)CNC2CCN(c3nccs3)CC2)c1	ZINC000819284379	EE	On-Demand	Bother	ADRB3	33	41
CN(C)C1(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCOCC1	ZINC000819284392	GD	On-Demand	Mild	PAPA1_CARPA	41	51
C[C@]1(CNCCC(=O)Nc2ccccc2)CCN(Cc2ccccc2)C1	ZINC000819284395	FH	On-Demand	Anodyne	DRD4	15	42
C[C@]1(CNCCC(=O)Nc2ccccc2)CCN(Cc2ccccc2)C1	ZINC000819284395	FH	On-Demand	Anodyne	SIGMAR1	40	44
C[C@]1(CNCCC(=O)Nc2ccccc2)CCN(Cc2ccccc2)C1	ZINC000819284395	FH	On-Demand	Anodyne	NPFFR2	39	41
C[C@]1(CNCCC(=O)Nc2ccccc2)CCN(Cc2ccccc2)C1	ZINC000819284395	FH	On-Demand	Anodyne	NPFFR1	50	46
C[C@@]1(CNCCC(=O)Nc2ccccc2)CCN(Cc2ccccc2)C1	ZINC000819284397	FH	On-Demand	Anodyne	DRD4	15	42
C[C@@]1(CNCCC(=O)Nc2ccccc2)CCN(Cc2ccccc2)C1	ZINC000819284397	FH	On-Demand	Anodyne	SIGMAR1	40	44
C[C@@]1(CNCCC(=O)Nc2ccccc2)CCN(Cc2ccccc2)C1	ZINC000819284397	FH	On-Demand	Anodyne	NPFFR2	39	41
C[C@@]1(CNCCC(=O)Nc2ccccc2)CCN(Cc2ccccc2)C1	ZINC000819284397	FH	On-Demand	Anodyne	NPFFR1	50	46
C[C@@H]1[C@@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)CC(=O)N1Cc1ccccc1	ZINC000819284406	GD	On-Demand	Anodyne	FPR1	41	33
C[C@@H]1[C@@H](NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)CC(=O)N1Cc1ccccc1	ZINC000819284408	GD	On-Demand	Anodyne	FPR1	41	33
CCOC(=O)C1CCC(O)(CNOCc2ccccc2OC)CC1	ZINC000819284417	EE	On-Demand	Anodyne	MBTPS1	50	33
COC(=O)[C@@H]1CC12CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819284420	GE	On-Demand	Mild	GHRHR	56	35
COC(=O)[C@@H]1CC12CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819284420	GE	On-Demand	Mild	PAPA1_CARPA	32	41
COC(=O)[C@@H]1CC12CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819284425	GE	On-Demand	Mild	GHRHR	56	35
COC(=O)[C@@H]1CC12CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819284425	GE	On-Demand	Mild	PAPA1_CARPA	32	41
CCOc1cc(CNC(=O)/C=C\[C@H]2CCCO2)ccc1OC	ZINC000819284435	DE	On-Demand	Anodyne	SSTR5	53	38
CCOc1cc(CNC(=O)/C=C/[C@@H]2CCCO2)ccc1OC	ZINC000819284437	DE	On-Demand	Anodyne	SSTR5	53	38
CCOc1cc(CNC(=O)/C=C\[C@@H]2CCCO2)ccc1OC	ZINC000819284439	DE	On-Demand	Anodyne	SSTR5	53	38
C#C[C@@H](NC[C@@H](O)c1cccnc1)C(C)C	ZINC000819284440	BD	On-Demand	Mild	ADRB2	24	40
C#C[C@@H](NC[C@@H](O)c1cccnc1)C(C)C	ZINC000819284440	BD	On-Demand	Mild	ADRB1	24	50
C#C[C@@H](NC[C@@H](O)c1cccnc1)C(C)C	ZINC000819284440	BD	On-Demand	Mild	ADRB3	77	50
CCOc1cc(CNC(=O)/C=C/[C@H]2CCCO2)ccc1OC	ZINC000819284441	DE	On-Demand	Anodyne	SSTR5	53	38
C#C[C@@H](NC[C@H](O)c1cccnc1)C(C)C	ZINC000819284442	BD	On-Demand	Mild	ADRB2	24	40
C#C[C@@H](NC[C@H](O)c1cccnc1)C(C)C	ZINC000819284442	BD	On-Demand	Mild	ADRB1	24	50
C#C[C@@H](NC[C@H](O)c1cccnc1)C(C)C	ZINC000819284442	BD	On-Demand	Mild	ADRB3	77	50
C#C[C@H](NC[C@@H](O)c1cccnc1)C(C)C	ZINC000819284444	BD	On-Demand	Mild	ADRB2	24	40
C#C[C@H](NC[C@@H](O)c1cccnc1)C(C)C	ZINC000819284444	BD	On-Demand	Mild	ADRB1	24	50
C#C[C@H](NC[C@@H](O)c1cccnc1)C(C)C	ZINC000819284444	BD	On-Demand	Mild	ADRB3	77	50
C#C[C@H](NC[C@H](O)c1cccnc1)C(C)C	ZINC000819284445	BD	On-Demand	Mild	ADRB2	24	40
C#C[C@H](NC[C@H](O)c1cccnc1)C(C)C	ZINC000819284445	BD	On-Demand	Mild	ADRB1	24	50
C#C[C@H](NC[C@H](O)c1cccnc1)C(C)C	ZINC000819284445	BD	On-Demand	Mild	ADRB3	77	50
CC[C@H](C#N)Oc1cccc(CNC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819284453	EI	On-Demand	Mild	PDS	44	37
CC[C@@H](C#N)Oc1cccc(CNC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819284455	EI	On-Demand	Mild	PDS	44	37
C#C[C@H](NCCC(=O)Nc1cccc(Br)c1)C(C)C	ZINC000819284457	DG	On-Demand	Mild	EGFR	27	42
C#C[C@H](NCCC(=O)Nc1cccc(Br)c1)C(C)C	ZINC000819284457	DG	On-Demand	Mild	HDAC10	17	42
C#C[C@@H](NCCC(=O)Nc1cccc(Br)c1)C(C)C	ZINC000819284459	DG	On-Demand	Mild	EGFR	27	42
C#C[C@@H](NCCC(=O)Nc1cccc(Br)c1)C(C)C	ZINC000819284459	DG	On-Demand	Mild	HDAC10	17	42
C#C[C@@H](NC[C@H](O)COc1cc(C)ccc1Cl)C(C)C	ZINC000819284462	CF	On-Demand	Mild	ADRB2	24	56
C#C[C@@H](NC[C@H](O)COc1cc(C)ccc1Cl)C(C)C	ZINC000819284462	CF	On-Demand	Mild	ADRB1	16	43
C#C[C@H](NC[C@@H](O)COc1cc(C)ccc1Cl)C(C)C	ZINC000819284466	CF	On-Demand	Mild	ADRB2	24	56
C#C[C@H](NC[C@@H](O)COc1cc(C)ccc1Cl)C(C)C	ZINC000819284466	CF	On-Demand	Mild	ADRB1	16	43
C[C@]1(CNC[C@@H](O)COc2ccc(CC#N)cc2)CCN(Cc2ccccc2)C1	ZINC000819284492	GF	On-Demand	Mild	ADRB1	55	39
C[C@]1(CNC[C@H](O)COc2ccc(CC#N)cc2)CCN(Cc2ccccc2)C1	ZINC000819284493	GF	On-Demand	Mild	ADRB1	55	39
C[C@@]1(CNC[C@H](O)COc2ccc(CC#N)cc2)CCN(Cc2ccccc2)C1	ZINC000819284494	GF	On-Demand	Mild	ADRB1	55	39
C[C@@]1(CNC[C@@H](O)COc2ccc(CC#N)cc2)CCN(Cc2ccccc2)C1	ZINC000819284495	GF	On-Demand	Mild	ADRB1	55	39
CN(C)C[C@@H]1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819284497	FD	On-Demand	Mild	PAPA1_CARPA	31	42
CN(C)C[C@@H]1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819284499	FD	On-Demand	Mild	PAPA1_CARPA	31	42
O[C@@H](CNCc1cc(Cl)ccc1N1CCOCC1)c1cccc(Cl)c1	ZINC000819284501	GH	On-Demand	Anodyne	ADRB1	26	41
O[C@@H](CNCc1cc(Cl)ccc1N1CCOCC1)c1cccc(Cl)c1	ZINC000819284501	GH	On-Demand	Anodyne	ADRB3	40	41
O[C@@H](CNCc1cc(Cl)ccc1N1CCOCC1)c1cccc(Cl)c1	ZINC000819284501	GH	On-Demand	Anodyne	IGF1R	24	41
O[C@@H](CNCc1cc(Cl)ccc1N1CCOCC1)c1cccc(Cl)c1	ZINC000819284501	GH	On-Demand	Anodyne	CYP3A4	43	36
O[C@H](CNCc1cc(Cl)ccc1N1CCOCC1)c1cccc(Cl)c1	ZINC000819284502	GH	On-Demand	Anodyne	ADRB1	26	41
O[C@H](CNCc1cc(Cl)ccc1N1CCOCC1)c1cccc(Cl)c1	ZINC000819284502	GH	On-Demand	Anodyne	ADRB3	40	41
O[C@H](CNCc1cc(Cl)ccc1N1CCOCC1)c1cccc(Cl)c1	ZINC000819284502	GH	On-Demand	Anodyne	IGF1R	24	41
O[C@H](CNCc1cc(Cl)ccc1N1CCOCC1)c1cccc(Cl)c1	ZINC000819284502	GH	On-Demand	Anodyne	CYP3A4	43	36
C#CCNC(=O)CCNC[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000819284504	DD	On-Demand	Mild	NPFFR1	49	45
C#CCNC(=O)CCNC[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000819284505	DD	On-Demand	Mild	NPFFR1	49	45
Cc1cc(CNC[C@H](O)c2ccccc2)ccc1I	ZINC000819284506	FG	On-Demand	Anodyne	ADRB2	28	44
Cc1cc(CNC[C@H](O)c2ccccc2)ccc1I	ZINC000819284506	FG	On-Demand	Anodyne	ADRB3	49	40
Cc1cc(CNC[C@@H](O)c2ccccc2)ccc1I	ZINC000819284507	FG	On-Demand	Anodyne	ADRB2	28	44
Cc1cc(CNC[C@@H](O)c2ccccc2)ccc1I	ZINC000819284507	FG	On-Demand	Anodyne	ADRB3	49	40
C[C@]1(CNC[C@H](O)COc2cccc3[nH]ccc23)CCN(Cc2ccccc2)C1	ZINC000819284516	GG	On-Demand	Anodyne	ADRB2	18	51
C[C@]1(CNC[C@H](O)COc2cccc3[nH]ccc23)CCN(Cc2ccccc2)C1	ZINC000819284516	GG	On-Demand	Anodyne	ADRB1	29	51
C[C@]1(CNC[C@H](O)COc2cccc3[nH]ccc23)CCN(Cc2ccccc2)C1	ZINC000819284516	GG	On-Demand	Anodyne	ABCB1	40	36
C[C@]1(CNC[C@@H](O)COc2cccc3[nH]ccc23)CCN(Cc2ccccc2)C1	ZINC000819284517	GG	On-Demand	Anodyne	ADRB2	18	51
C[C@]1(CNC[C@@H](O)COc2cccc3[nH]ccc23)CCN(Cc2ccccc2)C1	ZINC000819284517	GG	On-Demand	Anodyne	ADRB1	29	51
C[C@]1(CNC[C@@H](O)COc2cccc3[nH]ccc23)CCN(Cc2ccccc2)C1	ZINC000819284517	GG	On-Demand	Anodyne	ABCB1	40	36
C[C@@]1(CNC[C@H](O)COc2cccc3[nH]ccc23)CCN(Cc2ccccc2)C1	ZINC000819284518	GG	On-Demand	Anodyne	ADRB2	18	51
C[C@@]1(CNC[C@H](O)COc2cccc3[nH]ccc23)CCN(Cc2ccccc2)C1	ZINC000819284518	GG	On-Demand	Anodyne	ADRB1	29	51
C[C@@]1(CNC[C@H](O)COc2cccc3[nH]ccc23)CCN(Cc2ccccc2)C1	ZINC000819284518	GG	On-Demand	Anodyne	ABCB1	40	36
C[C@@]1(CNC[C@@H](O)COc2cccc3[nH]ccc23)CCN(Cc2ccccc2)C1	ZINC000819284519	GG	On-Demand	Anodyne	ADRB2	18	51
C[C@@]1(CNC[C@@H](O)COc2cccc3[nH]ccc23)CCN(Cc2ccccc2)C1	ZINC000819284519	GG	On-Demand	Anodyne	ADRB1	29	51
C[C@@]1(CNC[C@@H](O)COc2cccc3[nH]ccc23)CCN(Cc2ccccc2)C1	ZINC000819284519	GG	On-Demand	Anodyne	ABCB1	40	36
C[S@@](=O)C1(CNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819284573	DE	On-Demand	Anodyne	ADRB2	15	42
C[S@@](=O)C1(CNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819284573	DE	On-Demand	Anodyne	ADRB1	39	46
C[S@@](=O)C1(CNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819284573	DE	On-Demand	Anodyne	ADRB3	59	46
C[S@@](=O)C1(CNC[C@H](O)c2cccc(Cl)c2)CCC1	ZINC000819284575	DE	On-Demand	Anodyne	ADRB2	15	42
C[S@@](=O)C1(CNC[C@H](O)c2cccc(Cl)c2)CCC1	ZINC000819284575	DE	On-Demand	Anodyne	ADRB1	39	46
C[S@@](=O)C1(CNC[C@H](O)c2cccc(Cl)c2)CCC1	ZINC000819284575	DE	On-Demand	Anodyne	ADRB3	59	46
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1)N1CCCCC1	ZINC000819284587	GH	On-Demand	Anodyne	PREP	24	40
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1)N1CCCCC1	ZINC000819284587	GH	On-Demand	Anodyne	RBP4	72	34
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1)N1CCCCC1	ZINC000819284587	GH	On-Demand	Anodyne	SFRP1	123	38
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1)N1CCCCC1	ZINC000819284587	GH	On-Demand	Anodyne	WNT3	87	36
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1)N1CCCCC1	ZINC000819284588	GH	On-Demand	Anodyne	PREP	24	40
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1)N1CCCCC1	ZINC000819284588	GH	On-Demand	Anodyne	RBP4	72	34
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1)N1CCCCC1	ZINC000819284588	GH	On-Demand	Anodyne	SFRP1	123	38
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1)N1CCCCC1	ZINC000819284588	GH	On-Demand	Anodyne	WNT3	87	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1ccc(F)cc1Cl)C2	ZINC000819284589	FG	On-Demand	Anodyne	P2RX7	68	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1ccc(F)cc1Cl)C2	ZINC000819284590	FG	On-Demand	Anodyne	P2RX7	68	42
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819284595	CE	On-Demand	Anodyne	ADRB3	19	46
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819284596	CE	On-Demand	Anodyne	ADRB3	19	46
CO[C@H](CNC(=O)Cc1cccc(NC(C)=O)c1)C(F)(F)F	ZINC000819284606	DD	On-Demand	Anodyne	KCNK3	67	36
CO[C@H](CNC(=O)Cc1cccc(NC(C)=O)c1)C(F)(F)F	ZINC000819284606	DD	On-Demand	Anodyne	KCNK9	56	36
C#C[C@@H](NC[C@@H](O)COc1cc(C)ccc1Cl)C(C)C	ZINC000819284623	CF	On-Demand	Mild	ADRB2	24	56
C#C[C@@H](NC[C@@H](O)COc1cc(C)ccc1Cl)C(C)C	ZINC000819284623	CF	On-Demand	Mild	ADRB1	16	43
C#C[C@H](NC[C@H](O)COc1cc(C)ccc1Cl)C(C)C	ZINC000819284625	CF	On-Demand	Mild	ADRB2	24	56
C#C[C@H](NC[C@H](O)COc1cc(C)ccc1Cl)C(C)C	ZINC000819284625	CF	On-Demand	Mild	ADRB1	16	43
COCCS(=O)(=O)c1ccc(NC(=O)C(F)=C2CCC2)cc1	ZINC000819284627	EE	On-Demand	Anodyne	P96878_MYCTU	42	35
CC[C@@H](C#N)Oc1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819284642	DG	On-Demand	Mild	PDS	70	39
CC[C@H](C#N)Oc1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819284643	DG	On-Demand	Mild	PDS	70	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H](Oc3ccccc3)C1)C2	ZINC000819284691	FF	On-Demand	Anodyne	ADAM10	34	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H](Oc3ccccc3)C1)C2	ZINC000819284696	FF	On-Demand	Anodyne	ADAM10	34	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H](Oc3ccccc3)C1)C2	ZINC000819284705	FF	On-Demand	Anodyne	ADAM10	34	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H](Oc3ccccc3)C1)C2	ZINC000819284712	FF	On-Demand	Anodyne	ADAM10	34	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819284715	GI	On-Demand	Mild	PLA2G4A	27	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819284715	GI	On-Demand	Mild	PDS	63	38
CC[C@H](C#N)Oc1cccc(CNC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819284721	GI	On-Demand	Mild	PLA2G4A	27	41
CC[C@H](C#N)Oc1cccc(CNC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819284721	GI	On-Demand	Mild	PDS	63	38
C#C[C@@H](NC[C@H](O)COC(c1ccccc1)c1ccccc1)C(C)C	ZINC000819284723	EG	On-Demand	Mild	ADRB2	17	43
C#C[C@@H](NC[C@H](O)COC(c1ccccc1)c1ccccc1)C(C)C	ZINC000819284723	EG	On-Demand	Mild	CASR	17	45
C#C[C@@H](NC[C@@H](O)COC(c1ccccc1)c1ccccc1)C(C)C	ZINC000819284725	EG	On-Demand	Mild	ADRB2	17	43
C#C[C@@H](NC[C@@H](O)COC(c1ccccc1)c1ccccc1)C(C)C	ZINC000819284725	EG	On-Demand	Mild	CASR	17	45
C#C[C@H](NC[C@@H](O)COC(c1ccccc1)c1ccccc1)C(C)C	ZINC000819284727	EG	On-Demand	Mild	ADRB2	17	43
C#C[C@H](NC[C@@H](O)COC(c1ccccc1)c1ccccc1)C(C)C	ZINC000819284727	EG	On-Demand	Mild	CASR	17	45
C#C[C@H](NC[C@H](O)COC(c1ccccc1)c1ccccc1)C(C)C	ZINC000819284730	EG	On-Demand	Mild	ADRB2	17	43
C#C[C@H](NC[C@H](O)COC(c1ccccc1)c1ccccc1)C(C)C	ZINC000819284730	EG	On-Demand	Mild	CASR	17	45
Cc1cc(CNC[C@H](O)c2ccccc2F)ccc1I	ZINC000819284737	GH	On-Demand	Anodyne	LEF	46	36
C[C@@H]1CCCC[C@@H]1C(=O)NCCOc1cccnc1	ZINC000819284738	CE	On-Demand	Anodyne	CHRNA7	16	41
C[C@@H]1CCCC[C@@H]1C(=O)NCCOc1cccnc1	ZINC000819284738	CE	On-Demand	Anodyne	NAMPT	19	48
Cc1cc(CNC[C@@H](O)c2ccccc2F)ccc1I	ZINC000819284740	GH	On-Demand	Anodyne	LEF	46	36
C[C@@H]1CCCC[C@H]1C(=O)NCCOc1cccnc1	ZINC000819284741	CE	On-Demand	Anodyne	CHRNA7	16	41
C[C@@H]1CCCC[C@H]1C(=O)NCCOc1cccnc1	ZINC000819284741	CE	On-Demand	Anodyne	NAMPT	19	48
CCOC(=O)C1CCC(O)(CNC[C@]2(C)CCN(Cc3ccccc3)C2)CC1	ZINC000819284774	GF	On-Demand	Anodyne	SIGMAR1	36	45
CCOC(=O)C1CCC(O)(CNC[C@]2(C)CCN(Cc3ccccc3)C2)CC1	ZINC000819284774	GF	On-Demand	Anodyne	NPFFR1	41	37
CCOC(=O)C1CCC(O)(CNC[C@@]2(C)CCN(Cc3ccccc3)C2)CC1	ZINC000819284776	GF	On-Demand	Anodyne	SIGMAR1	36	45
CCOC(=O)C1CCC(O)(CNC[C@@]2(C)CCN(Cc3ccccc3)C2)CC1	ZINC000819284776	GF	On-Demand	Anodyne	NPFFR1	41	37
C[C@@H]1[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)CC(=O)N1Cc1ccccc1	ZINC000819284783	EE	On-Demand	Mild	CTRB_BOVIN	43	30
C[C@@H]1[C@@H](NC[C@H](O)c2ccc(C#N)cc2)CC(=O)N1Cc1ccccc1	ZINC000819284787	EE	On-Demand	Mild	CTRB_BOVIN	43	30
C#C[C@@H](NC[C@H](O)COc1ccccc1C(F)(F)F)C(C)C	ZINC000819284799	DF	On-Demand	Mild	ADRB2	36	55
C#C[C@@H](NC[C@H](O)COc1ccccc1C(F)(F)F)C(C)C	ZINC000819284799	DF	On-Demand	Mild	ADRB1	63	41
C#C[C@@H](NC[C@H](O)COc1ccccc1C(F)(F)F)C(C)C	ZINC000819284799	DF	On-Demand	Mild	ABCB1	15	42
C#C[C@H](NC[C@H](O)COc1ccccc1C(F)(F)F)C(C)C	ZINC000819284802	DF	On-Demand	Mild	ADRB2	36	55
C#C[C@H](NC[C@H](O)COc1ccccc1C(F)(F)F)C(C)C	ZINC000819284802	DF	On-Demand	Mild	ADRB1	63	41
C#C[C@H](NC[C@H](O)COc1ccccc1C(F)(F)F)C(C)C	ZINC000819284802	DF	On-Demand	Mild	ABCB1	15	42
C#C[C@H](NC[C@@H](O)COc1ccccc1C(F)(F)F)C(C)C	ZINC000819284805	DF	On-Demand	Mild	ADRB2	36	55
C#C[C@H](NC[C@@H](O)COc1ccccc1C(F)(F)F)C(C)C	ZINC000819284805	DF	On-Demand	Mild	ADRB1	63	41
C#C[C@H](NC[C@@H](O)COc1ccccc1C(F)(F)F)C(C)C	ZINC000819284805	DF	On-Demand	Mild	ABCB1	15	42
C[C@@]1(CNCCC(=O)Nc2cccnc2)CCN(Cc2ccccc2)C1	ZINC000819284806	FF	On-Demand	Anodyne	NPFFR1	42	41
C#C[C@@H](NC[C@@H](O)COc1ccccc1C(F)(F)F)C(C)C	ZINC000819284808	DF	On-Demand	Mild	ADRB2	36	55
C#C[C@@H](NC[C@@H](O)COc1ccccc1C(F)(F)F)C(C)C	ZINC000819284808	DF	On-Demand	Mild	ADRB1	63	41
C#C[C@@H](NC[C@@H](O)COc1ccccc1C(F)(F)F)C(C)C	ZINC000819284808	DF	On-Demand	Mild	ABCB1	15	42
C[C@]1(CNCCC(=O)Nc2cccnc2)CCN(Cc2ccccc2)C1	ZINC000819284809	FF	On-Demand	Anodyne	NPFFR1	42	41
O=C(/C=C\c1ccncn1)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819284811	GI	On-Demand	Anodyne	HDAC6	15	40
O=C(/C=C/c1ccncn1)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819284814	GI	On-Demand	Anodyne	HDAC6	15	40
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819284829	GG	On-Demand	Anodyne	NPY2R	19	42
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819284829	GG	On-Demand	Anodyne	EPHX2	28	41
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819284833	GG	On-Demand	Anodyne	NPY2R	19	42
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819284833	GG	On-Demand	Anodyne	EPHX2	28	41
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819284836	GG	On-Demand	Anodyne	NPY2R	19	42
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819284836	GG	On-Demand	Anodyne	EPHX2	28	41
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819284839	GG	On-Demand	Anodyne	NPY2R	19	42
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819284839	GG	On-Demand	Anodyne	EPHX2	28	41
O=C(NCCOc1cccnc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819284864	EG	On-Demand	Anodyne	NAMPT	20	40
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819284865	IJ	On-Demand	Anodyne	OPRM1	20	40
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819284865	IJ	On-Demand	Anodyne	OPRD1	69	39
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819284865	IJ	On-Demand	Anodyne	HDAC8	17	44
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819284865	IJ	On-Demand	Anodyne	CFTR	67	35
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819284865	IJ	On-Demand	Anodyne	ADAM9	58	35
CC[C@H](C#N)Oc1cccc(CNC(=O)c2cc(Br)oc2C)c1	ZINC000819284867	GH	On-Demand	Mild	PDS	44	36
CC[C@@H](C#N)Oc1cccc(CNC(=O)c2cc(Br)oc2C)c1	ZINC000819284869	GH	On-Demand	Mild	PDS	44	36
C[C@H]1C[C@H](CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C[C@@H](C)O1	ZINC000819284871	FF	On-Demand	Anodyne	GPR119	31	41
C[C@@H]1CC(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C[C@@H](C)O1	ZINC000819284873	FF	On-Demand	Anodyne	GPR119	31	41
C[C@H]1C[C@H](CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C[C@@H](C)O1	ZINC000819284876	FF	On-Demand	Anodyne	GPR119	31	41
C[C@@H]1CC(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C[C@@H](C)O1	ZINC000819284878	FF	On-Demand	Anodyne	GPR119	31	41
O=C(Nc1ccc2c(c1)CCN2C(=O)c1cccnc1)C(F)=C1CCC1	ZINC000819284897	FH	On-Demand	Anodyne	HTR2C	15	42
O=C(Nc1ccc2c(c1)CCN2C(=O)c1cccnc1)C(F)=C1CCC1	ZINC000819284897	FH	On-Demand	Anodyne	CYP11B2	22	47
C[C@]1(CNC[C@@H](O)COc2ccc(C#N)cc2)CCN(Cc2ccccc2)C1	ZINC000819284898	GF	On-Demand	Mild	ADRB2	28	40
C[C@]1(CNC[C@@H](O)COc2ccc(C#N)cc2)CCN(Cc2ccccc2)C1	ZINC000819284898	GF	On-Demand	Mild	ADRB1	52	38
C[C@@]1(CNC[C@@H](O)COc2ccc(C#N)cc2)CCN(Cc2ccccc2)C1	ZINC000819284899	GF	On-Demand	Mild	ADRB2	28	40
C[C@@]1(CNC[C@@H](O)COc2ccc(C#N)cc2)CCN(Cc2ccccc2)C1	ZINC000819284899	GF	On-Demand	Mild	ADRB1	52	38
C[C@@]1(CNC[C@H](O)COc2ccc(C#N)cc2)CCN(Cc2ccccc2)C1	ZINC000819284900	GF	On-Demand	Mild	ADRB2	28	40
C[C@@]1(CNC[C@H](O)COc2ccc(C#N)cc2)CCN(Cc2ccccc2)C1	ZINC000819284900	GF	On-Demand	Mild	ADRB1	52	38
C[C@]1(CNC[C@H](O)COc2ccc(C#N)cc2)CCN(Cc2ccccc2)C1	ZINC000819284901	GF	On-Demand	Mild	ADRB2	28	40
C[C@]1(CNC[C@H](O)COc2ccc(C#N)cc2)CCN(Cc2ccccc2)C1	ZINC000819284901	GF	On-Demand	Mild	ADRB1	52	38
CON(C)C(=O)CCNC[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000819284903	DD	On-Demand	Anodyne	NPFFR1	41	37
CON(C)C(=O)CCNC[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000819284905	DD	On-Demand	Anodyne	NPFFR1	41	37
C[C@]1(CNCC2(O)CCOCC2)CCN(Cc2ccccc2)C1	ZINC000819284921	DE	On-Demand	Anodyne	SIGMAR1	44	39
C[C@@]1(CNCC2(O)CCOCC2)CCN(Cc2ccccc2)C1	ZINC000819284923	DE	On-Demand	Anodyne	SIGMAR1	44	39
Cc1noc(C)c1[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819284935	FG	On-Demand	Mild	PAPA1_CARPA	38	45
Cc1noc(C)c1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819284938	FG	On-Demand	Mild	PAPA1_CARPA	38	45
O[C@H](CNC1CCN(c2nccs2)CC1)c1cc2ccccc2o1	ZINC000819284980	EG	On-Demand	Anodyne	ADRB2	15	41
O[C@H](CNC1CCN(c2nccs2)CC1)c1cc2ccccc2o1	ZINC000819284980	EG	On-Demand	Anodyne	ADRB3	17	41
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(c3nccs3)CC2)cc1	ZINC000819284992	GD	On-Demand	Anodyne	ADRB2	15	42
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(c3nccs3)CC2)cc1	ZINC000819284992	GD	On-Demand	Anodyne	ADRB1	17	42
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(c3nccs3)CC2)cc1	ZINC000819284992	GD	On-Demand	Anodyne	ADRB3	34	43
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(c3nccs3)CC2)cc1	ZINC000819284992	GD	On-Demand	Anodyne	GCK	15	44
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(c3nccs3)CC2)cc1	ZINC000819284993	GD	On-Demand	Anodyne	ADRB2	15	42
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(c3nccs3)CC2)cc1	ZINC000819284993	GD	On-Demand	Anodyne	ADRB1	17	42
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(c3nccs3)CC2)cc1	ZINC000819284993	GD	On-Demand	Anodyne	ADRB3	34	43
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(c3nccs3)CC2)cc1	ZINC000819284993	GD	On-Demand	Anodyne	GCK	15	44
O[C@@H](CNC1CCN(c2nccs2)CC1)c1cccc2ccccc12	ZINC000819285009	FH	On-Demand	Anodyne	ADRB2	16	43
O[C@@H](CNC1CCN(c2nccs2)CC1)c1cccc2ccccc12	ZINC000819285009	FH	On-Demand	Anodyne	ADRB3	21	43
C[C@@H]1CCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819285017	BE	On-Demand	Anodyne	ADRB1	24	44
C[C@@H]1CCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819285017	BE	On-Demand	Anodyne	ADRB3	92	48
C[C@@H]1CCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819285018	BE	On-Demand	Anodyne	ADRB1	24	44
C[C@@H]1CCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819285018	BE	On-Demand	Anodyne	ADRB3	92	48
CC[C@H](C#N)Oc1cccc(CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819285055	FF	On-Demand	Mild	PDS	49	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819285058	FF	On-Demand	Mild	PDS	49	38
CCOc1cc(CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)ccc1OC	ZINC000819285069	FF	On-Demand	Anodyne	PDE6A	41	32
CCOc1cc(CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)ccc1OC	ZINC000819285069	FF	On-Demand	Anodyne	MT-ND1	23	42
Cc1noc(C)c1[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819285071	FG	On-Demand	Mild	PAPA1_CARPA	38	45
Cc1noc(C)c1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819285074	FG	On-Demand	Mild	PAPA1_CARPA	38	45
CC[C@@H](C#N)Oc1cccc(CNC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)c1	ZINC000819285077	GJ	On-Demand	Mild	PDS	62	38
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1)N1CCCCC1	ZINC000819285078	FG	On-Demand	Anodyne	ADRB1	39	48
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1)N1CCCCC1	ZINC000819285078	FG	On-Demand	Anodyne	ADRB3	60	50
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1)N1CCCCC1	ZINC000819285078	FG	On-Demand	Anodyne	IGF1R	29	42
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1)N1CCCCC1	ZINC000819285078	FG	On-Demand	Anodyne	CYP3A4	51	42
O=C([C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1)N1CCCCC1	ZINC000819285080	FG	On-Demand	Anodyne	ADRB1	39	48
O=C([C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1)N1CCCCC1	ZINC000819285080	FG	On-Demand	Anodyne	ADRB3	60	50
O=C([C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1)N1CCCCC1	ZINC000819285080	FG	On-Demand	Anodyne	IGF1R	29	42
O=C([C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1)N1CCCCC1	ZINC000819285080	FG	On-Demand	Anodyne	CYP3A4	51	42
CC[C@H](C#N)Oc1cccc(CNC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)c1	ZINC000819285082	GJ	On-Demand	Mild	PDS	62	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@](C)(c3ccccc3)C1)C2	ZINC000819285114	FG	On-Demand	Anodyne	ADAM10	30	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@](C)(c3ccccc3)C1)C2	ZINC000819285115	FG	On-Demand	Anodyne	ADAM10	30	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@](C)(c3ccccc3)C1)C2	ZINC000819285116	FG	On-Demand	Anodyne	ADAM10	30	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@](C)(c3ccccc3)C1)C2	ZINC000819285117	FG	On-Demand	Anodyne	ADAM10	30	41
C[S@@](=O)C1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819285129	CD	On-Demand	Anodyne	ADRB2	25	44
C[S@@](=O)C1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819285129	CD	On-Demand	Anodyne	ADRB1	27	44
C[S@@](=O)C1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819285129	CD	On-Demand	Anodyne	ADRB3	101	46
C[S@@](=O)C1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819285130	CD	On-Demand	Anodyne	ADRB2	25	44
C[S@@](=O)C1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819285130	CD	On-Demand	Anodyne	ADRB1	27	44
C[S@@](=O)C1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819285130	CD	On-Demand	Anodyne	ADRB3	101	46
C=CC[C@H](CC)NC[C@@H](O)c1cccnc1	ZINC000819285138	BE	On-Demand	Mild	ADRB1	19	47
C=CC[C@H](CC)NC[C@@H](O)c1cccnc1	ZINC000819285138	BE	On-Demand	Mild	ADRB3	57	47
C=CC[C@H](CC)NC[C@H](O)c1cccnc1	ZINC000819285139	BE	On-Demand	Mild	ADRB1	19	47
C=CC[C@H](CC)NC[C@H](O)c1cccnc1	ZINC000819285139	BE	On-Demand	Mild	ADRB3	57	47
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819285194	FI	On-Demand	Anodyne	NPY2R	21	42
O=C(Nc1ccc(F)c(Cl)c1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819285194	FI	On-Demand	Anodyne	EPHX2	33	43
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819285195	EF	On-Demand	Anodyne	ADRB3	20	40
O=S(=O)(NCCCNC[C@H](O)c1ccccc1)c1ccccc1Cl	ZINC000819285196	FE	On-Demand	Anodyne	ADRB2	27	42
O=S(=O)(NCCCNC[C@H](O)c1ccccc1)c1ccccc1Cl	ZINC000819285196	FE	On-Demand	Anodyne	ADRB3	61	39
O=S(=O)(NCCCNC[C@H](O)c1ccccc1)c1ccccc1Cl	ZINC000819285196	FE	On-Demand	Anodyne	ITGAV	15	41
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819285197	EF	On-Demand	Anodyne	ADRB3	20	40
O=S(=O)(NCCCNC[C@@H](O)c1ccccc1)c1ccccc1Cl	ZINC000819285198	FE	On-Demand	Anodyne	ADRB2	27	42
O=S(=O)(NCCCNC[C@@H](O)c1ccccc1)c1ccccc1Cl	ZINC000819285198	FE	On-Demand	Anodyne	ADRB3	61	39
O=S(=O)(NCCCNC[C@@H](O)c1ccccc1)c1ccccc1Cl	ZINC000819285198	FE	On-Demand	Anodyne	ITGAV	15	41
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1)N1CCCCC1	ZINC000819285204	GH	On-Demand	Anodyne	CNR1	20	48
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1)N1CCCCC1	ZINC000819285206	GH	On-Demand	Anodyne	CNR1	20	48
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819285208	FD	On-Demand	Anodyne	ADRB3	17	41
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819285209	FD	On-Demand	Anodyne	ADRB3	17	41
C#C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285217	FF	On-Demand	Mild	CTSD	87	54
C#C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285217	FF	On-Demand	Mild	PGC	63	44
C#C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285217	FF	On-Demand	Mild	CMA1	28	41
C#C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285217	FF	On-Demand	Mild	CTRA_BOVIN	19	41
C#C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285217	FF	On-Demand	Mild	PAPA1_CARPA	75	47
C#C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285217	FF	On-Demand	Mild	CTSK	21	49
C#C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285217	FF	On-Demand	Mild	CTSL	23	47
C#C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285217	FF	On-Demand	Mild	PGA	64	44
C#C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285217	FF	On-Demand	Mild	BACE2	49	41
C#C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285217	FF	On-Demand	Mild	TACR3	17	41
C#C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285217	FF	On-Demand	Mild	HLA-DRB1	37	44
C#C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285217	FF	On-Demand	Mild	REN	86	54
C#C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285217	FF	On-Demand	Mild	REN1	36	49
C#C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285217	FF	On-Demand	Mild	CAPN1	25	41
C#C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285217	FF	On-Demand	Mild	BACE1	70	50
C#C[C@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285217	FF	On-Demand	Mild	FPR1	58	46
C#C[C@@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285219	FF	On-Demand	Mild	CTSD	87	54
C#C[C@@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285219	FF	On-Demand	Mild	PGC	63	44
C#C[C@@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285219	FF	On-Demand	Mild	CMA1	28	41
C#C[C@@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285219	FF	On-Demand	Mild	CTRA_BOVIN	19	41
C#C[C@@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285219	FF	On-Demand	Mild	PAPA1_CARPA	75	47
C#C[C@@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285219	FF	On-Demand	Mild	CTSK	21	49
C#C[C@@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285219	FF	On-Demand	Mild	CTSL	23	47
C#C[C@@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285219	FF	On-Demand	Mild	PGA	64	44
C#C[C@@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285219	FF	On-Demand	Mild	BACE2	49	41
C#C[C@@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285219	FF	On-Demand	Mild	TACR3	17	41
C#C[C@@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285219	FF	On-Demand	Mild	HLA-DRB1	37	44
C#C[C@@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285219	FF	On-Demand	Mild	REN	86	54
C#C[C@@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285219	FF	On-Demand	Mild	REN1	36	49
C#C[C@@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285219	FF	On-Demand	Mild	CAPN1	25	41
C#C[C@@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285219	FF	On-Demand	Mild	BACE1	70	50
C#C[C@@H](NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(C)C	ZINC000819285219	FF	On-Demand	Mild	FPR1	58	46
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1)N1CCCCC1	ZINC000819285243	GH	On-Demand	Anodyne	EPHX2	15	47
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1)N1CCCCC1	ZINC000819285243	GH	On-Demand	Anodyne	SFRP1	43	32
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1)N1CCCCC1	ZINC000819285243	GH	On-Demand	Anodyne	WNT3	44	30
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1)N1CCCCC1	ZINC000819285246	GH	On-Demand	Anodyne	EPHX2	15	47
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1)N1CCCCC1	ZINC000819285246	GH	On-Demand	Anodyne	SFRP1	43	32
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1)N1CCCCC1	ZINC000819285246	GH	On-Demand	Anodyne	WNT3	44	30
CCSc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819285267	GI	On-Demand	Mild	PAPA1_CARPA	43	44
CCSc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819285267	GI	On-Demand	Mild	CTSK	15	42
CCSc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819285268	GI	On-Demand	Mild	PAPA1_CARPA	43	44
CCSc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819285268	GI	On-Demand	Mild	CTSK	15	42
CC(C)(C)OC(=O)N[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1	ZINC000819285282	HI	On-Demand	Anodyne	PAPA1_CARPA	32	40
CC(C)(C)OC(=O)N[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1	ZINC000819285282	HI	On-Demand	Anodyne	REN	51	38
CC(C)(C)OC(=O)N[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1	ZINC000819285282	HI	On-Demand	Anodyne	FPR1	44	36
O=C(/C=C/c1ccnc2ccccc12)Nc1nc(CC(F)(F)F)cs1	ZINC000819285305	FI	On-Demand	Anodyne	UL26	18	47
O=C(/C=C\c1ccnc2ccccc12)Nc1nc(CC(F)(F)F)cs1	ZINC000819285306	FI	On-Demand	Anodyne	UL26	18	47
CN(Cc1cn[nH]c1)C(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819285333	GI	On-Demand	Anodyne	REN	63	41
CN(Cc1cn[nH]c1)C(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819285334	GI	On-Demand	Anodyne	REN	63	41
C=C(C)C(C)(C)C(=O)NCc1cccc(O[C@H](C#N)CC)c1	ZINC000819285335	DH	On-Demand	Mild	PDS	65	38
C=C(C)C(C)(C)C(=O)NCc1cccc(O[C@@H](C#N)CC)c1	ZINC000819285336	DH	On-Demand	Mild	PDS	65	38
CC[C@H](C#N)Oc1cccc(CNC(=O)[C@H]2CCCC[C@H]2C)c1	ZINC000819285346	DH	On-Demand	Mild	CTSK	15	43
CC[C@H](C#N)Oc1cccc(CNC(=O)[C@H]2CCCC[C@H]2C)c1	ZINC000819285346	DH	On-Demand	Mild	PDS	44	39
CC[C@H](C#N)Oc1cccc(CNC(=O)[C@H]2CCCC[C@@H]2C)c1	ZINC000819285348	DH	On-Demand	Mild	CTSK	15	43
CC[C@H](C#N)Oc1cccc(CNC(=O)[C@H]2CCCC[C@@H]2C)c1	ZINC000819285348	DH	On-Demand	Mild	PDS	44	39
CC[C@H](C#N)Oc1cccc(CNC(=O)[C@@H]2CCCC[C@H]2C)c1	ZINC000819285349	DH	On-Demand	Mild	CTSK	15	43
CC[C@H](C#N)Oc1cccc(CNC(=O)[C@@H]2CCCC[C@H]2C)c1	ZINC000819285349	DH	On-Demand	Mild	PDS	44	39
CC[C@H](C#N)Oc1cccc(CNC(=O)[C@@H]2CCCC[C@@H]2C)c1	ZINC000819285350	DH	On-Demand	Mild	CTSK	15	43
CC[C@H](C#N)Oc1cccc(CNC(=O)[C@@H]2CCCC[C@@H]2C)c1	ZINC000819285350	DH	On-Demand	Mild	PDS	44	39
C#C[C@@H](NC[C@H](O)COc1ccccc1C(C)C)C(C)C	ZINC000819285351	CF	On-Demand	Mild	ADRB2	39	56
C#C[C@@H](NC[C@H](O)COc1ccccc1C(C)C)C(C)C	ZINC000819285351	CF	On-Demand	Mild	ADRB1	52	42
C#C[C@@H](NC[C@H](O)COc1ccccc1C(C)C)C(C)C	ZINC000819285351	CF	On-Demand	Mild	ABCB1	22	41
C#C[C@@H](NC[C@@H](O)COc1ccccc1C(C)C)C(C)C	ZINC000819285353	CF	On-Demand	Mild	ADRB2	39	56
C#C[C@@H](NC[C@@H](O)COc1ccccc1C(C)C)C(C)C	ZINC000819285353	CF	On-Demand	Mild	ADRB1	52	42
C#C[C@@H](NC[C@@H](O)COc1ccccc1C(C)C)C(C)C	ZINC000819285353	CF	On-Demand	Mild	ABCB1	22	41
C#C[C@H](NC[C@H](O)COc1ccccc1C(C)C)C(C)C	ZINC000819285354	CF	On-Demand	Mild	ADRB2	39	56
C#C[C@H](NC[C@H](O)COc1ccccc1C(C)C)C(C)C	ZINC000819285354	CF	On-Demand	Mild	ADRB1	52	42
C#C[C@H](NC[C@H](O)COc1ccccc1C(C)C)C(C)C	ZINC000819285354	CF	On-Demand	Mild	ABCB1	22	41
C#C[C@H](NC[C@@H](O)COc1ccccc1C(C)C)C(C)C	ZINC000819285356	CF	On-Demand	Mild	ADRB2	39	56
C#C[C@H](NC[C@@H](O)COc1ccccc1C(C)C)C(C)C	ZINC000819285356	CF	On-Demand	Mild	ADRB1	52	42
C#C[C@H](NC[C@@H](O)COc1ccccc1C(C)C)C(C)C	ZINC000819285356	CF	On-Demand	Mild	ABCB1	22	41
CC[C@H](C#N)Oc1cccc(CNC(=O)C[S@@](=O)c2cccc(OC)c2)c1	ZINC000819285357	GF	On-Demand	Mild	MTNR1A	32	41
CC[C@H](C#N)Oc1cccc(CNC(=O)C[S@@](=O)c2cccc(OC)c2)c1	ZINC000819285357	GF	On-Demand	Mild	MTNR1B	33	41
CC[C@H](C#N)Oc1cccc(CNC(=O)C[S@@](=O)c2cccc(OC)c2)c1	ZINC000819285357	GF	On-Demand	Mild	PDS	41	40
CC[C@H](C#N)Oc1cccc(CNC(=O)C[S@](=O)c2cccc(OC)c2)c1	ZINC000819285360	GF	On-Demand	Mild	MTNR1A	32	41
CC[C@H](C#N)Oc1cccc(CNC(=O)C[S@](=O)c2cccc(OC)c2)c1	ZINC000819285360	GF	On-Demand	Mild	MTNR1B	33	41
CC[C@H](C#N)Oc1cccc(CNC(=O)C[S@](=O)c2cccc(OC)c2)c1	ZINC000819285360	GF	On-Demand	Mild	PDS	41	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)C[S@](=O)c2cccc(OC)c2)c1	ZINC000819285361	GF	On-Demand	Mild	MTNR1A	32	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)C[S@](=O)c2cccc(OC)c2)c1	ZINC000819285361	GF	On-Demand	Mild	MTNR1B	33	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)C[S@](=O)c2cccc(OC)c2)c1	ZINC000819285361	GF	On-Demand	Mild	PDS	41	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)C[S@@](=O)c2cccc(OC)c2)c1	ZINC000819285363	GF	On-Demand	Mild	MTNR1A	32	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)C[S@@](=O)c2cccc(OC)c2)c1	ZINC000819285363	GF	On-Demand	Mild	MTNR1B	33	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)C[S@@](=O)c2cccc(OC)c2)c1	ZINC000819285363	GF	On-Demand	Mild	PDS	41	40
CCOC[C@H](O)CNOCc1ccccc1OC	ZINC000819285422	CD	On-Demand	Anodyne	ADRB2	21	40
N#Cc1ccc([C@@H](O)CNC2CCN(c3nccs3)CC2)cc1	ZINC000819285468	EE	On-Demand	Mild	ADRB3	21	43
C#CCCNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819285479	BD	On-Demand	Mild	KCNK3	72	33
C#CCCNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819285479	BD	On-Demand	Mild	KCNK9	47	33
C#CCCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819285480	CC	On-Demand	Mild	DRD4	42	32
C#CCCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819285480	CC	On-Demand	Mild	MTNR1A	60	42
C#CCCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819285480	CC	On-Demand	Mild	MTNR1B	55	42
C#CCCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819285481	CC	On-Demand	Mild	DRD4	42	32
C#CCCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819285481	CC	On-Demand	Mild	MTNR1A	60	42
C#CCCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819285481	CC	On-Demand	Mild	MTNR1B	55	42
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819285503	DD	On-Demand	Bother	SLC27A4	46	35
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819285504	DD	On-Demand	Bother	SLC27A4	46	35
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CC[C@@H](C(=O)N2CCCCC2)C1	ZINC000819285512	GE	On-Demand	Anodyne	PREP	22	45
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H]1CC[C@@H](C(=O)N2CCCCC2)C1	ZINC000819285513	GE	On-Demand	Anodyne	PREP	22	45
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1)N1CCCCC1	ZINC000819285535	FG	On-Demand	Anodyne	PREP	27	47
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2ccccc2)C1)N1CCCCC1	ZINC000819285547	DE	On-Demand	Anodyne	ADRB3	41	38
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2ccccc2)C1)N1CCCCC1	ZINC000819285547	DE	On-Demand	Anodyne	PREP	55	42
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2ccccc2)C1)N1CCCCC1	ZINC000819285547	DE	On-Demand	Anodyne	SFRP1	40	32
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2ccccc2)C1)N1CCCCC1	ZINC000819285547	DE	On-Demand	Anodyne	WNT3	42	31
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2ccccc2)C1)N1CCCCC1	ZINC000819285547	DE	On-Demand	Anodyne	Q8WSF8_APLCA	33	43
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccccc2)C1)N1CCCCC1	ZINC000819285548	DE	On-Demand	Anodyne	ADRB3	41	38
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccccc2)C1)N1CCCCC1	ZINC000819285548	DE	On-Demand	Anodyne	PREP	55	42
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccccc2)C1)N1CCCCC1	ZINC000819285548	DE	On-Demand	Anodyne	SFRP1	40	32
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccccc2)C1)N1CCCCC1	ZINC000819285548	DE	On-Demand	Anodyne	WNT3	42	31
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccccc2)C1)N1CCCCC1	ZINC000819285548	DE	On-Demand	Anodyne	Q8WSF8_APLCA	33	43
COC[C@@H](O)CNOCc1ccccc1OC	ZINC000819285576	BC	On-Demand	Anodyne	ADRB2	22	41
N#Cc1ccc([C@H](O)CNC2CCN(c3nccs3)CC2)cc1	ZINC000819285597	EE	On-Demand	Mild	ADRB3	21	43
CC[C@H](C#N)Oc1cccc(CNC(=O)c2cc(Br)c(C)s2)c1	ZINC000819285648	GI	On-Demand	Mild	PDS	44	36
CC[C@@H](C#N)Oc1cccc(CNC(=O)c2cc(Br)c(C)s2)c1	ZINC000819285650	GI	On-Demand	Mild	PDS	44	36
C#C[C@H](NC[C@@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285677	CF	On-Demand	Mild	ADRB2	40	72
C#C[C@H](NC[C@@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285677	CF	On-Demand	Mild	ADRB1	56	49
C#C[C@H](NC[C@@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285677	CF	On-Demand	Mild	CASR	40	38
C#C[C@H](NC[C@@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285677	CF	On-Demand	Mild	CYP2D6	22	47
C#C[C@H](NC[C@@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285677	CF	On-Demand	Mild	ABCB1	17	40
C#C[C@@H](NC[C@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285678	CF	On-Demand	Mild	ADRB2	40	72
C#C[C@@H](NC[C@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285678	CF	On-Demand	Mild	ADRB1	56	49
C#C[C@@H](NC[C@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285678	CF	On-Demand	Mild	CASR	40	38
C#C[C@@H](NC[C@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285678	CF	On-Demand	Mild	CYP2D6	22	47
C#C[C@@H](NC[C@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285678	CF	On-Demand	Mild	ABCB1	17	40
C#C[C@@H](NC[C@@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285679	CF	On-Demand	Mild	ADRB2	40	72
C#C[C@@H](NC[C@@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285679	CF	On-Demand	Mild	ADRB1	56	49
C#C[C@@H](NC[C@@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285679	CF	On-Demand	Mild	CASR	40	38
C#C[C@@H](NC[C@@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285679	CF	On-Demand	Mild	CYP2D6	22	47
C#C[C@@H](NC[C@@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285679	CF	On-Demand	Mild	ABCB1	17	40
C#C[C@H](NC[C@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285680	CF	On-Demand	Mild	ADRB2	40	72
C#C[C@H](NC[C@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285680	CF	On-Demand	Mild	ADRB1	56	49
C#C[C@H](NC[C@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285680	CF	On-Demand	Mild	CASR	40	38
C#C[C@H](NC[C@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285680	CF	On-Demand	Mild	CYP2D6	22	47
C#C[C@H](NC[C@H](O)COc1cccc2ccccc12)C(C)C	ZINC000819285680	CF	On-Demand	Mild	ABCB1	17	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2CCC(C#N)CC2)CC1	ZINC000819285686	FF	On-Demand	Mild	GPR119	30	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2CCC(C#N)CC2)CC1	ZINC000819285688	FF	On-Demand	Mild	GPR119	30	41
C[C@@H]1CCC[C@H]1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819285706	EG	On-Demand	Anodyne	GPR119	30	41
C[C@@H]1CCC[C@H]1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819285709	EG	On-Demand	Anodyne	GPR119	30	41
CC(=O)Nc1cccc(CC(=O)N[C@@](C)(CNC(=O)OC(C)(C)C)C(C)C)c1	ZINC000819285710	GG	On-Demand	Anodyne	FPR1	49	38
CC(=O)Nc1cccc(CC(=O)N[C@](C)(CNC(=O)OC(C)(C)C)C(C)C)c1	ZINC000819285712	GG	On-Demand	Anodyne	FPR1	49	38
Cc1cccc2c1CCCN2C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819285713	FH	On-Demand	Mild	PAPA1_CARPA	38	41
C#C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)C(C)C	ZINC000819285714	CF	On-Demand	Mild	ADRB2	45	72
C#C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)C(C)C	ZINC000819285714	CF	On-Demand	Mild	ADRB1	36	48
C#C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)C(C)C	ZINC000819285714	CF	On-Demand	Mild	ADRB3	22	45
C#C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)C(C)C	ZINC000819285714	CF	On-Demand	Mild	CASR	42	39
Cc1cccc2c1CCCN2C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819285715	FH	On-Demand	Mild	PAPA1_CARPA	38	41
C#C[C@@H](NC[C@@H](O)COc1ccc2ccccc2c1)C(C)C	ZINC000819285716	CF	On-Demand	Mild	ADRB2	45	72
C#C[C@@H](NC[C@@H](O)COc1ccc2ccccc2c1)C(C)C	ZINC000819285716	CF	On-Demand	Mild	ADRB1	36	48
C#C[C@@H](NC[C@@H](O)COc1ccc2ccccc2c1)C(C)C	ZINC000819285716	CF	On-Demand	Mild	ADRB3	22	45
C#C[C@@H](NC[C@@H](O)COc1ccc2ccccc2c1)C(C)C	ZINC000819285716	CF	On-Demand	Mild	CASR	42	39
Cc1ccccc1[C@@H](O)CNCCNS(=O)(=O)c1ccc(Cl)cc1F	ZINC000819285717	GE	On-Demand	Anodyne	ADRB1	17	41
C#C[C@H](NC[C@@H](O)COc1ccc2ccccc2c1)C(C)C	ZINC000819285718	CF	On-Demand	Mild	ADRB2	45	72
C#C[C@H](NC[C@@H](O)COc1ccc2ccccc2c1)C(C)C	ZINC000819285718	CF	On-Demand	Mild	ADRB1	36	48
C#C[C@H](NC[C@@H](O)COc1ccc2ccccc2c1)C(C)C	ZINC000819285718	CF	On-Demand	Mild	ADRB3	22	45
C#C[C@H](NC[C@@H](O)COc1ccc2ccccc2c1)C(C)C	ZINC000819285718	CF	On-Demand	Mild	CASR	42	39
C#C[C@@H](NC[C@H](O)COc1ccc2ccccc2c1)C(C)C	ZINC000819285720	CF	On-Demand	Mild	ADRB2	45	72
C#C[C@@H](NC[C@H](O)COc1ccc2ccccc2c1)C(C)C	ZINC000819285720	CF	On-Demand	Mild	ADRB1	36	48
C#C[C@@H](NC[C@H](O)COc1ccc2ccccc2c1)C(C)C	ZINC000819285720	CF	On-Demand	Mild	ADRB3	22	45
C#C[C@@H](NC[C@H](O)COc1ccc2ccccc2c1)C(C)C	ZINC000819285720	CF	On-Demand	Mild	CASR	42	39
O[C@@H](CNCc1ccncc1OCC(F)(F)F)c1ccccc1	ZINC000819285722	EF	On-Demand	Anodyne	ADRB3	33	42
O[C@H](CNCc1ccncc1OCC(F)(F)F)c1ccccc1	ZINC000819285723	EF	On-Demand	Anodyne	ADRB3	33	42
C[C@@H]1[C@@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)CC(=O)N1Cc1ccccc1	ZINC000819285727	GE	On-Demand	Anodyne	FPR1	44	34
C[C@@H]1[C@@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)CC(=O)N1Cc1ccccc1	ZINC000819285729	GE	On-Demand	Anodyne	FPR1	44	34
C[S@@](=O)C1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819285730	CD	On-Demand	Bother	CACNA1D	40	32
C[S@@](=O)C1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819285732	CD	On-Demand	Bother	CACNA1D	40	32
C#C[C@@H](NC[C@H](O)COc1cccc(C(F)(F)F)c1)C(C)C	ZINC000819285733	DF	On-Demand	Mild	ADRB2	27	51
C#C[C@@H](NC[C@H](O)COc1cccc(C(F)(F)F)c1)C(C)C	ZINC000819285733	DF	On-Demand	Mild	ADRB1	31	51
C#C[C@@H](NC[C@H](O)COc1cccc(C(F)(F)F)c1)C(C)C	ZINC000819285733	DF	On-Demand	Mild	PDS	54	46
C#C[C@H](NC[C@@H](O)COc1cccc(C(F)(F)F)c1)C(C)C	ZINC000819285734	DF	On-Demand	Mild	ADRB2	27	51
C#C[C@H](NC[C@@H](O)COc1cccc(C(F)(F)F)c1)C(C)C	ZINC000819285734	DF	On-Demand	Mild	ADRB1	31	51
C#C[C@H](NC[C@@H](O)COc1cccc(C(F)(F)F)c1)C(C)C	ZINC000819285734	DF	On-Demand	Mild	PDS	54	46
C#C[C@@H](NC[C@@H](O)COc1cccc(C(F)(F)F)c1)C(C)C	ZINC000819285735	DF	On-Demand	Mild	ADRB2	27	51
C#C[C@@H](NC[C@@H](O)COc1cccc(C(F)(F)F)c1)C(C)C	ZINC000819285735	DF	On-Demand	Mild	ADRB1	31	51
C#C[C@@H](NC[C@@H](O)COc1cccc(C(F)(F)F)c1)C(C)C	ZINC000819285735	DF	On-Demand	Mild	PDS	54	46
C#C[C@H](NC[C@H](O)COc1cccc(C(F)(F)F)c1)C(C)C	ZINC000819285736	DF	On-Demand	Mild	ADRB2	27	51
C#C[C@H](NC[C@H](O)COc1cccc(C(F)(F)F)c1)C(C)C	ZINC000819285736	DF	On-Demand	Mild	ADRB1	31	51
C#C[C@H](NC[C@H](O)COc1cccc(C(F)(F)F)c1)C(C)C	ZINC000819285736	DF	On-Demand	Mild	PDS	54	46
CC[C@@H](C#N)Oc1cccc(CNC(=O)c2cc3c(cn2)OCCO3)c1	ZINC000819285739	FE	On-Demand	Mild	PDS	43	36
CC[C@H](C#N)Oc1cccc(CNC(=O)c2cc3c(cn2)OCCO3)c1	ZINC000819285741	FE	On-Demand	Mild	PDS	43	36
O=C(Nc1nc2ccc(Cl)cc2n1Cc1ccccc1)c1cccnc1Cl	ZINC000819285775	GK	On-Demand	Anodyne	G2YM83_BOTF4	72	36
Cn1cc(/C=C/C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)c(=O)n(C)c1=O	ZINC000819285776	IF	On-Demand	Anodyne	HDAC8	26	41
Cn1cc(/C=C/C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)c(=O)n(C)c1=O	ZINC000819285776	IF	On-Demand	Anodyne	HDAC1	17	41
Cn1cc(/C=C/C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)c(=O)n(C)c1=O	ZINC000819285776	IF	On-Demand	Anodyne	HDAC6	23	42
Cn1cc(/C=C\C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)c(=O)n(C)c1=O	ZINC000819285777	IF	On-Demand	Anodyne	HDAC8	26	41
Cn1cc(/C=C\C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)c(=O)n(C)c1=O	ZINC000819285777	IF	On-Demand	Anodyne	HDAC1	17	41
Cn1cc(/C=C\C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)c(=O)n(C)c1=O	ZINC000819285777	IF	On-Demand	Anodyne	HDAC6	23	42
O[C@H](CNCc1ccncc1OCC(F)(F)F)c1cccnc1	ZINC000819285782	EE	On-Demand	Anodyne	ADRB2	18	45
O[C@H](CNCc1ccncc1OCC(F)(F)F)c1cccnc1	ZINC000819285782	EE	On-Demand	Anodyne	ADRB1	22	48
O[C@H](CNCc1ccncc1OCC(F)(F)F)c1cccnc1	ZINC000819285782	EE	On-Demand	Anodyne	ADRB3	79	48
O[C@@H](CNCc1ccncc1OCC(F)(F)F)c1cccnc1	ZINC000819285784	EE	On-Demand	Anodyne	ADRB2	18	45
O[C@@H](CNCc1ccncc1OCC(F)(F)F)c1cccnc1	ZINC000819285784	EE	On-Demand	Anodyne	ADRB1	22	48
O[C@@H](CNCc1ccncc1OCC(F)(F)F)c1cccnc1	ZINC000819285784	EE	On-Demand	Anodyne	ADRB3	79	48
CC[C@@H](C#N)Oc1cccc(CNC(=O)c2cnc3cc(OC)ccn23)c1	ZINC000819285796	FF	On-Demand	Mild	ROCK1	33	45
CC[C@@H](C#N)Oc1cccc(CNC(=O)c2cnc3cc(OC)ccn23)c1	ZINC000819285796	FF	On-Demand	Mild	ROCK2	38	45
CC[C@@H](C#N)Oc1cccc(CNC(=O)c2cnc3cc(OC)ccn23)c1	ZINC000819285796	FF	On-Demand	Mild	PDS	44	40
CC[C@H](C#N)Oc1cccc(CNC(=O)c2cnc3cc(OC)ccn23)c1	ZINC000819285798	FF	On-Demand	Mild	ROCK1	33	45
CC[C@H](C#N)Oc1cccc(CNC(=O)c2cnc3cc(OC)ccn23)c1	ZINC000819285798	FF	On-Demand	Mild	ROCK2	38	45
CC[C@H](C#N)Oc1cccc(CNC(=O)c2cnc3cc(OC)ccn23)c1	ZINC000819285798	FF	On-Demand	Mild	PDS	44	40
O=C(Cc1ccc(F)cc1Cl)N1C[C@@H](NC(=O)C(F)(F)F)CC[C@@H]1C(F)(F)F	ZINC000819285817	IH	On-Demand	Mild	P2RX7	50	41
O=C(Cc1ccc(F)cc1Cl)N1C[C@@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F	ZINC000819285818	IH	On-Demand	Mild	P2RX7	50	41
O=C(Cc1ccc(F)cc1Cl)N1C[C@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F	ZINC000819285819	IH	On-Demand	Mild	P2RX7	50	41
O=C(Cc1ccc(F)cc1Cl)N1C[C@H](NC(=O)C(F)(F)F)CC[C@@H]1C(F)(F)F	ZINC000819285820	IH	On-Demand	Mild	P2RX7	50	41
CC(=O)Nc1nc(C(=O)N2C[C@H](NC(=O)C(F)(F)F)CC[C@H]2C(F)(F)F)cs1	ZINC000819285837	IE	On-Demand	Anodyne	TRPC6	49	37
CC(=O)Nc1nc(C(=O)N2C[C@H](NC(=O)C(F)(F)F)CC[C@H]2C(F)(F)F)cs1	ZINC000819285837	IE	On-Demand	Anodyne	TRPC3	44	37
CC(=O)Nc1nc(C(=O)N2C[C@@H](NC(=O)C(F)(F)F)CC[C@H]2C(F)(F)F)cs1	ZINC000819285838	IE	On-Demand	Anodyne	TRPC6	49	37
CC(=O)Nc1nc(C(=O)N2C[C@@H](NC(=O)C(F)(F)F)CC[C@H]2C(F)(F)F)cs1	ZINC000819285838	IE	On-Demand	Anodyne	TRPC3	44	37
CC(=O)Nc1nc(C(=O)N2C[C@@H](NC(=O)C(F)(F)F)CC[C@@H]2C(F)(F)F)cs1	ZINC000819285839	IE	On-Demand	Anodyne	TRPC6	49	37
CC(=O)Nc1nc(C(=O)N2C[C@@H](NC(=O)C(F)(F)F)CC[C@@H]2C(F)(F)F)cs1	ZINC000819285839	IE	On-Demand	Anodyne	TRPC3	44	37
CC(=O)Nc1nc(C(=O)N2C[C@H](NC(=O)C(F)(F)F)CC[C@@H]2C(F)(F)F)cs1	ZINC000819285840	IE	On-Demand	Anodyne	TRPC6	49	37
CC(=O)Nc1nc(C(=O)N2C[C@H](NC(=O)C(F)(F)F)CC[C@@H]2C(F)(F)F)cs1	ZINC000819285840	IE	On-Demand	Anodyne	TRPC3	44	37
O=C(COCc1ccccn1)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819285861	HI	On-Demand	Anodyne	IMDH_CRYPV	25	41
COc1ccc(NC(=O)C(=O)N2C[C@@H](NC(=O)C(F)(F)F)CC[C@@H]2C(F)(F)F)cc1	ZINC000819285870	IE	On-Demand	Anodyne	EPHX2	42	36
COc1ccc(NC(=O)C(=O)N2C[C@@H](NC(=O)C(F)(F)F)CC[C@H]2C(F)(F)F)cc1	ZINC000819285871	IE	On-Demand	Anodyne	EPHX2	42	36
COc1ccc(NC(=O)C(=O)N2C[C@H](NC(=O)C(F)(F)F)CC[C@H]2C(F)(F)F)cc1	ZINC000819285872	IE	On-Demand	Anodyne	EPHX2	42	36
COc1ccc(NC(=O)C(=O)N2C[C@H](NC(=O)C(F)(F)F)CC[C@@H]2C(F)(F)F)cc1	ZINC000819285873	IE	On-Demand	Anodyne	EPHX2	42	36
C[C@H](CS(C)(=O)=O)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819285889	FD	On-Demand	Mild	PAPA1_CARPA	42	50
C[C@H](CS(C)(=O)=O)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819285889	FD	On-Demand	Mild	CTSK	15	47
C[C@H](CS(C)(=O)=O)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819285892	FD	On-Demand	Mild	PAPA1_CARPA	42	50
C[C@H](CS(C)(=O)=O)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819285892	FD	On-Demand	Mild	CTSK	15	47
O[C@@H](CNC[C@H]1CCCN1C1CCCCC1)c1cccnc1	ZINC000819285897	DF	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNC[C@H]1CCCN1C1CCCCC1)c1cccnc1	ZINC000819285897	DF	On-Demand	Anodyne	ADRB1	22	43
O[C@@H](CNC[C@H]1CCCN1C1CCCCC1)c1cccnc1	ZINC000819285897	DF	On-Demand	Anodyne	ADRB3	86	44
O[C@H](CNC[C@H]1CCCN1C1CCCCC1)c1cccnc1	ZINC000819285898	DF	On-Demand	Anodyne	ADRB2	19	40
O[C@H](CNC[C@H]1CCCN1C1CCCCC1)c1cccnc1	ZINC000819285898	DF	On-Demand	Anodyne	ADRB1	22	43
O[C@H](CNC[C@H]1CCCN1C1CCCCC1)c1cccnc1	ZINC000819285898	DF	On-Demand	Anodyne	ADRB3	86	44
O[C@@H](CNC[C@@H]1CCCN1C1CCCCC1)c1cccnc1	ZINC000819285899	DF	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNC[C@@H]1CCCN1C1CCCCC1)c1cccnc1	ZINC000819285899	DF	On-Demand	Anodyne	ADRB1	22	43
O[C@@H](CNC[C@@H]1CCCN1C1CCCCC1)c1cccnc1	ZINC000819285899	DF	On-Demand	Anodyne	ADRB3	86	44
O[C@H](CNC[C@@H]1CCCN1C1CCCCC1)c1cccnc1	ZINC000819285900	DF	On-Demand	Anodyne	ADRB2	19	40
O[C@H](CNC[C@@H]1CCCN1C1CCCCC1)c1cccnc1	ZINC000819285900	DF	On-Demand	Anodyne	ADRB1	22	43
O[C@H](CNC[C@@H]1CCCN1C1CCCCC1)c1cccnc1	ZINC000819285900	DF	On-Demand	Anodyne	ADRB3	86	44
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1)N1CCCCC1	ZINC000819285913	FG	On-Demand	Anodyne	ADRB3	25	40
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1)N1CCCCC1	ZINC000819285914	FG	On-Demand	Anodyne	ADRB3	25	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)cc1	ZINC000819285921	GD	On-Demand	Anodyne	ADRB3	29	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)cc1	ZINC000819285921	GD	On-Demand	Anodyne	SFRP1	46	33
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)cc1	ZINC000819285921	GD	On-Demand	Anodyne	WNT3	50	32
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)cc1	ZINC000819285922	GD	On-Demand	Anodyne	ADRB3	29	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)cc1	ZINC000819285922	GD	On-Demand	Anodyne	SFRP1	46	33
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)cc1	ZINC000819285922	GD	On-Demand	Anodyne	WNT3	50	32
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819285931	DD	On-Demand	Bother	CACNA1C	66	45
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819285931	DD	On-Demand	Bother	CACNA1D	94	37
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819285932	DD	On-Demand	Bother	CACNA1C	66	45
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819285932	DD	On-Demand	Bother	CACNA1D	94	37
C#CCCNC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819285937	EF	On-Demand	Mild	CNR1	55	34
O=C([C@@H]1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1)N1CCCCC1	ZINC000819285944	FH	On-Demand	Anodyne	DPP7	20	43
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1)N1CCCCC1	ZINC000819285982	FG	On-Demand	Anodyne	ADRB3	27	46
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1)N1CCCCC1	ZINC000819285982	FG	On-Demand	Anodyne	DPP7	42	36
CC[C@H]1c2ccccc2CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819286030	GI	On-Demand	Mild	GHRHR	41	33
CC[C@H]1c2ccccc2CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819286030	GI	On-Demand	Mild	PAPA1_CARPA	37	41
CC[C@H]1c2ccccc2CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819286030	GI	On-Demand	Mild	FPR1	40	33
CC[C@H]1c2ccccc2CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819286031	GI	On-Demand	Mild	GHRHR	41	33
CC[C@H]1c2ccccc2CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819286031	GI	On-Demand	Mild	PAPA1_CARPA	37	41
CC[C@H]1c2ccccc2CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819286031	GI	On-Demand	Mild	FPR1	40	33
CC[C@@H]1c2ccccc2CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819286032	GI	On-Demand	Mild	GHRHR	41	33
CC[C@@H]1c2ccccc2CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819286032	GI	On-Demand	Mild	PAPA1_CARPA	37	41
CC[C@@H]1c2ccccc2CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819286032	GI	On-Demand	Mild	FPR1	40	33
CC[C@@H]1c2ccccc2CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819286033	GI	On-Demand	Mild	GHRHR	41	33
CC[C@@H]1c2ccccc2CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819286033	GI	On-Demand	Mild	PAPA1_CARPA	37	41
CC[C@@H]1c2ccccc2CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819286033	GI	On-Demand	Mild	FPR1	40	33
O=C(/C=C\[C@@H]1CCCO1)NCCc1nc(-c2cccc(Cl)c2)no1	ZINC000819286047	EF	On-Demand	Anodyne	GRM5	20	46
O=C(/C=C\[C@H]1CCCO1)NCCc1nc(-c2cccc(Cl)c2)no1	ZINC000819286048	EF	On-Demand	Anodyne	GRM5	20	46
O=C(/C=C/[C@H]1CCCO1)NCCc1nc(-c2cccc(Cl)c2)no1	ZINC000819286049	EF	On-Demand	Anodyne	GRM5	20	46
O=C(/C=C/[C@@H]1CCCO1)NCCc1nc(-c2cccc(Cl)c2)no1	ZINC000819286050	EF	On-Demand	Anodyne	GRM5	20	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2cccnc2)CC1	ZINC000819286068	FE	On-Demand	Anodyne	DRD4	23	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2cccnc2)CC1	ZINC000819286068	FE	On-Demand	Anodyne	ACHE	17	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2cccnc2)CC1	ZINC000819286068	FE	On-Demand	Anodyne	SIGMAR1	23	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2cccnc2)CC1	ZINC000819286068	FE	On-Demand	Anodyne	SSTR5	55	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2cccnc2)CC1	ZINC000819286068	FE	On-Demand	Anodyne	CHRNA7	44	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2cccnc2)CC1	ZINC000819286068	FE	On-Demand	Anodyne	C3AR1	40	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(Cc2cccnc2)CC1	ZINC000819286068	FE	On-Demand	Anodyne	MCHR1	33	42
CN(CCNC[C@H](O)c1cccc(F)c1)S(=O)(=O)c1ccc(F)cc1	ZINC000819286107	FD	On-Demand	Anodyne	ADRB1	27	41
CN(CCNC[C@H](O)c1cccc(F)c1)S(=O)(=O)c1ccc(F)cc1	ZINC000819286107	FD	On-Demand	Anodyne	ADRB3	62	42
CN(CCNC[C@@H](O)c1cccc(F)c1)S(=O)(=O)c1ccc(F)cc1	ZINC000819286108	FD	On-Demand	Anodyne	ADRB1	27	41
CN(CCNC[C@@H](O)c1cccc(F)c1)S(=O)(=O)c1ccc(F)cc1	ZINC000819286108	FD	On-Demand	Anodyne	ADRB3	62	42
O=C(NCCc1ccc(F)cc1Cl)C(F)=C1CCC1	ZINC000819286109	CH	On-Demand	Anodyne	P2RX7	56	42
O=C(c1cc2cc(Cl)sc2[nH]1)N1C[C@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F	ZINC000819286114	II	On-Demand	Anodyne	PYGL	21	43
O=C(c1cc2cc(Cl)sc2[nH]1)N1C[C@@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F	ZINC000819286118	II	On-Demand	Anodyne	PYGL	21	43
O=C(c1cc2cc(Cl)sc2[nH]1)N1C[C@@H](NC(=O)C(F)(F)F)CC[C@@H]1C(F)(F)F	ZINC000819286120	II	On-Demand	Anodyne	PYGL	21	43
O=C(c1cc2cc(Cl)sc2[nH]1)N1C[C@H](NC(=O)C(F)(F)F)CC[C@@H]1C(F)(F)F	ZINC000819286123	II	On-Demand	Anodyne	PYGL	21	43
N#Cc1ccc([C@H](O)CN[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)cc1	ZINC000819286167	EE	On-Demand	Mild	DPP4	15	41
N#Cc1ccc([C@@H](O)CN[C@H]2CC[C@@H](C(=O)N3CCCCC3)C2)cc1	ZINC000819286171	EE	On-Demand	Mild	DPP4	15	41
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819286186	GE	On-Demand	Anodyne	GPR119	24	40
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819286187	GE	On-Demand	Anodyne	GPR119	24	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(Cc3cccnc3)CC1)C2	ZINC000819286387	GE	On-Demand	Anodyne	DRD4	20	49
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(Cc3cccnc3)CC1)C2	ZINC000819286387	GE	On-Demand	Anodyne	SIGMAR1	21	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(Cc3cccnc3)CC1)C2	ZINC000819286387	GE	On-Demand	Anodyne	SSTR5	45	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(Cc3cccnc3)CC1)C2	ZINC000819286387	GE	On-Demand	Anodyne	CHRNA7	43	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC1CCN(Cc3cccnc3)CC1)C2	ZINC000819286387	GE	On-Demand	Anodyne	MCHR1	28	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(Cc3cccnc3)CC1)C2	ZINC000819286388	GE	On-Demand	Anodyne	DRD4	20	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(Cc3cccnc3)CC1)C2	ZINC000819286388	GE	On-Demand	Anodyne	SIGMAR1	21	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(Cc3cccnc3)CC1)C2	ZINC000819286388	GE	On-Demand	Anodyne	SSTR5	45	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(Cc3cccnc3)CC1)C2	ZINC000819286388	GE	On-Demand	Anodyne	CHRNA7	43	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC1CCN(Cc3cccnc3)CC1)C2	ZINC000819286388	GE	On-Demand	Anodyne	MCHR1	28	44
O=S(=O)(NCCNC[C@H](O)c1ccccc1F)c1ccc(Cl)cc1F	ZINC000819286403	GE	On-Demand	Anodyne	ADRB1	18	45
O=S(=O)(NCCNC[C@@H](O)c1ccccc1F)c1ccc(Cl)cc1F	ZINC000819286404	GE	On-Demand	Anodyne	ADRB1	18	45
N#CC1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819286413	CG	On-Demand	Mild	ADRB1	38	42
N#CC1CCC(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819286413	CG	On-Demand	Mild	ADRB3	49	43
N#CC1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819286414	CG	On-Demand	Mild	ADRB1	38	42
N#CC1CCC(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819286414	CG	On-Demand	Mild	ADRB3	49	43
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819286425	DF	On-Demand	Anodyne	SLC6A3	24	45
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819286425	DF	On-Demand	Anodyne	ADRB3	20	45
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819286450	GF	On-Demand	Anodyne	EPHX2	22	41
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819286450	GF	On-Demand	Anodyne	BIRC2	29	40
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819286450	GF	On-Demand	Anodyne	GPR119	41	46
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819286453	GF	On-Demand	Anodyne	EPHX2	22	41
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819286453	GF	On-Demand	Anodyne	BIRC2	29	40
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819286453	GF	On-Demand	Anodyne	GPR119	41	46
Cc1cc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n[nH]1	ZINC000819286459	ED	On-Demand	Mild	PAPA1_CARPA	46	49
Cc1cc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n[nH]1	ZINC000819286460	ED	On-Demand	Mild	PAPA1_CARPA	46	49
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1)N1CCCCC1	ZINC000819286470	GH	On-Demand	Anodyne	ADRB3	25	40
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1)N1CCCCC1	ZINC000819286470	GH	On-Demand	Anodyne	CCR2	70	41
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1)N1CCCCC1	ZINC000819286470	GH	On-Demand	Anodyne	SFRP1	66	33
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1)N1CCCCC1	ZINC000819286470	GH	On-Demand	Anodyne	WNT3	64	32
O=C([C@@H]1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1)N1CCCCC1	ZINC000819286471	GH	On-Demand	Anodyne	ADRB3	25	40
O=C([C@@H]1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1)N1CCCCC1	ZINC000819286471	GH	On-Demand	Anodyne	CCR2	70	41
O=C([C@@H]1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1)N1CCCCC1	ZINC000819286471	GH	On-Demand	Anodyne	SFRP1	66	33
O=C([C@@H]1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1)N1CCCCC1	ZINC000819286471	GH	On-Demand	Anodyne	WNT3	64	32
O=C(Nc1nc2ccc(Cl)cc2n1Cc1ccccc1)c1ccc(N2CCOCC2)nc1	ZINC000819286505	II	On-Demand	Anodyne	ITK	22	40
O=C(Nc1nc2ccc(Cl)cc2n1Cc1ccccc1)c1ccc(N2CCOCC2)nc1	ZINC000819286505	II	On-Demand	Anodyne	HDAC1	28	43
O=C(Nc1nc2ccc(Cl)cc2n1Cc1ccccc1)c1ccc(N2CCOCC2)nc1	ZINC000819286505	II	On-Demand	Anodyne	PIK3CB	41	38
O=C(Nc1nc2ccc(Cl)cc2n1Cc1ccccc1)c1ccc(N2CCOCC2)nc1	ZINC000819286505	II	On-Demand	Anodyne	DGAT1	36	43
O=C(Nc1nc2ccc(Cl)cc2n1Cc1ccccc1)c1ccc(N2CCOCC2)nc1	ZINC000819286505	II	On-Demand	Anodyne	HPGDS	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)C1CCN(Cc3ccccc3)CC1)C2	ZINC000819286513	GF	On-Demand	Anodyne	ACHE	43	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)C1CCN(Cc3ccccc3)CC1)C2	ZINC000819286513	GF	On-Demand	Anodyne	LTA4H	20	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)C1CCN(Cc3ccccc3)CC1)C2	ZINC000819286513	GF	On-Demand	Anodyne	SIGMAR1	46	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)C1CCN(Cc3ccccc3)CC1)C2	ZINC000819286513	GF	On-Demand	Anodyne	MCHR1	24	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)C1CCN(Cc3ccccc3)CC1)C2	ZINC000819286515	GF	On-Demand	Anodyne	ACHE	43	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)C1CCN(Cc3ccccc3)CC1)C2	ZINC000819286515	GF	On-Demand	Anodyne	LTA4H	20	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)C1CCN(Cc3ccccc3)CC1)C2	ZINC000819286515	GF	On-Demand	Anodyne	SIGMAR1	46	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)C1CCN(Cc3ccccc3)CC1)C2	ZINC000819286515	GF	On-Demand	Anodyne	MCHR1	24	40
O=C(O)[C@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286523	DD	On-Demand	Anodyne	DRD4	29	43
O=C(O)[C@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286523	DD	On-Demand	Anodyne	ACHE	19	43
O=C(O)[C@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286523	DD	On-Demand	Anodyne	SLC6A1	157	43
O=C(O)[C@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286523	DD	On-Demand	Anodyne	LTA4H	19	41
O=C(O)[C@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286523	DD	On-Demand	Anodyne	HRH3	36	51
O=C(O)[C@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286523	DD	On-Demand	Anodyne	SIGMAR1	36	45
O=C(O)[C@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286523	DD	On-Demand	Anodyne	CCR3	30	41
O=C(O)[C@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286523	DD	On-Demand	Anodyne	CCR5	19	41
O=C(O)[C@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286523	DD	On-Demand	Anodyne	S1PR4	22	44
O=C(O)[C@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286523	DD	On-Demand	Anodyne	SLC18A3	26	45
O=C(O)[C@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286523	DD	On-Demand	Anodyne	PREP	20	40
O=C(O)[C@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286523	DD	On-Demand	Anodyne	MLNR	42	39
O=C(O)[C@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286523	DD	On-Demand	Anodyne	S1PR1	29	58
O=C(O)[C@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286523	DD	On-Demand	Anodyne	S1PR5	47	42
O=C(O)[C@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286523	DD	On-Demand	Anodyne	CXCR3	23	43
O=C(O)[C@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286523	DD	On-Demand	Anodyne	CYP2J2	45	32
O=C(O)[C@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286523	DD	On-Demand	Anodyne	MLYCD	17	40
O=C(O)[C@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286523	DD	On-Demand	Anodyne	L3MBTL3	103	62
O=C(O)[C@@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286525	DD	On-Demand	Anodyne	DRD4	29	43
O=C(O)[C@@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286525	DD	On-Demand	Anodyne	ACHE	19	43
O=C(O)[C@@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286525	DD	On-Demand	Anodyne	SLC6A1	157	43
O=C(O)[C@@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286525	DD	On-Demand	Anodyne	LTA4H	19	41
O=C(O)[C@@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286525	DD	On-Demand	Anodyne	HRH3	36	51
O=C(O)[C@@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286525	DD	On-Demand	Anodyne	SIGMAR1	36	45
O=C(O)[C@@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286525	DD	On-Demand	Anodyne	CCR3	30	41
O=C(O)[C@@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286525	DD	On-Demand	Anodyne	CCR5	19	41
O=C(O)[C@@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286525	DD	On-Demand	Anodyne	S1PR4	22	44
O=C(O)[C@@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286525	DD	On-Demand	Anodyne	SLC18A3	26	45
O=C(O)[C@@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286525	DD	On-Demand	Anodyne	PREP	20	40
O=C(O)[C@@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286525	DD	On-Demand	Anodyne	MLNR	42	39
O=C(O)[C@@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286525	DD	On-Demand	Anodyne	S1PR1	29	58
O=C(O)[C@@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286525	DD	On-Demand	Anodyne	S1PR5	47	42
O=C(O)[C@@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286525	DD	On-Demand	Anodyne	CXCR3	23	43
O=C(O)[C@@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286525	DD	On-Demand	Anodyne	CYP2J2	45	32
O=C(O)[C@@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286525	DD	On-Demand	Anodyne	MLYCD	17	40
O=C(O)[C@@H]1CCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819286525	DD	On-Demand	Anodyne	L3MBTL3	103	62
C[C@H](CCc1cccc(F)c1)C(=O)N1C[C@@H](NC(=O)C(F)(F)F)CC[C@@H]1C(F)(F)F	ZINC000819286530	IH	On-Demand	Mild	BIRC2	16	42
O=C(O)[C@H]1CCN(Cn2nc(-c3ccc(F)cc3)c3ccccc3c2=O)C1	ZINC000819286531	FF	On-Demand	Anodyne	SLC6A1	120	40
O=C(O)[C@H]1CCN(Cn2nc(-c3ccc(F)cc3)c3ccccc3c2=O)C1	ZINC000819286531	FF	On-Demand	Anodyne	WNT3A	45	33
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccc(F)cc3)c3ccccc3c2=O)C1	ZINC000819286533	FF	On-Demand	Anodyne	SLC6A1	120	40
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccc(F)cc3)c3ccccc3c2=O)C1	ZINC000819286533	FF	On-Demand	Anodyne	WNT3A	45	33
C[C@H](CCc1cccc(F)c1)C(=O)N1C[C@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F	ZINC000819286534	IH	On-Demand	Mild	BIRC2	16	42
O=C(O)[C@@H]1CCN(Cc2cc3c(cc2O)CCC3)C1	ZINC000819286536	CD	On-Demand	Clean	SLC6A1	153	38
CC[C@H](C#N)Oc1cc(CNC(=O)[C@H](CC)Cc2ccccc2C)ccc1OC	ZINC000819286537	GJ	On-Demand	Mild	PPARG	16	43
CC[C@H](C#N)Oc1cc(CNC(=O)[C@H](CC)Cc2ccccc2C)ccc1OC	ZINC000819286537	GJ	On-Demand	Mild	PPARA	23	44
CC[C@H](C#N)Oc1cc(CNC(=O)[C@H](CC)Cc2ccccc2C)ccc1OC	ZINC000819286537	GJ	On-Demand	Mild	PPARD	18	43
C[C@H](CCc1cccc(F)c1)C(=O)N1C[C@H](NC(=O)C(F)(F)F)CC[C@@H]1C(F)(F)F	ZINC000819286538	IH	On-Demand	Mild	BIRC2	16	42
O=C(O)[C@H]1CCN(Cc2cc3c(cc2O)CCC3)C1	ZINC000819286539	CD	On-Demand	Clean	SLC6A1	153	38
C[C@H](CCc1cccc(F)c1)C(=O)N1C[C@@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F	ZINC000819286541	IH	On-Demand	Mild	BIRC2	16	42
O=C(O)[C@@H]1CCN(Cn2c(S)nnc2CCC2CCCC2)C1	ZINC000819286542	DE	On-Demand	Anodyne	SLC6A1	53	33
O=C(O)[C@H]1CCN(Cn2c(S)nnc2CCC2CCCC2)C1	ZINC000819286544	DE	On-Demand	Anodyne	SLC6A1	53	33
O=C(O)[C@H]1CCN(CN2C(=O)NC3(CCCCC3)C2=O)C1	ZINC000819286553	CC	On-Demand	Anodyne	SLC6A1	106	36
O=C(O)[C@@H]1CCN(CN2C(=O)NC3(CCCCC3)C2=O)C1	ZINC000819286554	CC	On-Demand	Anodyne	SLC6A1	106	36
O=C(O)[C@@H]1CCN(Cc2nc3cc(C(F)(F)F)ccc3o2)C1	ZINC000819286556	DF	On-Demand	Anodyne	SLC6A1	69	36
O=C(O)[C@@H]1CCN(Cc2nc3cc(C(F)(F)F)ccc3o2)C1	ZINC000819286556	DF	On-Demand	Anodyne	S1PR4	15	41
O=C(O)[C@@H]1CCN(Cc2nc3cc(C(F)(F)F)ccc3o2)C1	ZINC000819286556	DF	On-Demand	Anodyne	S1PR1	26	43
O=C(O)[C@@H]1CCN(Cc2nc3cc(C(F)(F)F)ccc3o2)C1	ZINC000819286556	DF	On-Demand	Anodyne	LIPG	55	39
O=C(O)[C@@H]1CCN(Cc2nc3cc(C(F)(F)F)ccc3o2)C1	ZINC000819286556	DF	On-Demand	Anodyne	PTGES	17	47
O=C(O)[C@H]1CCN(Cc2nc3cc(C(F)(F)F)ccc3o2)C1	ZINC000819286558	DF	On-Demand	Anodyne	SLC6A1	69	36
O=C(O)[C@H]1CCN(Cc2nc3cc(C(F)(F)F)ccc3o2)C1	ZINC000819286558	DF	On-Demand	Anodyne	S1PR4	15	41
O=C(O)[C@H]1CCN(Cc2nc3cc(C(F)(F)F)ccc3o2)C1	ZINC000819286558	DF	On-Demand	Anodyne	S1PR1	26	43
O=C(O)[C@H]1CCN(Cc2nc3cc(C(F)(F)F)ccc3o2)C1	ZINC000819286558	DF	On-Demand	Anodyne	LIPG	55	39
O=C(O)[C@H]1CCN(Cc2nc3cc(C(F)(F)F)ccc3o2)C1	ZINC000819286558	DF	On-Demand	Anodyne	PTGES	17	47
O=C(O)[C@H]1CCN(Cc2cnc3ccnn3c2)C1	ZINC000819286560	BC	On-Demand	Anodyne	SLC6A1	116	37
O=C(O)[C@H]1CCN(Cc2cnc3ccnn3c2)C1	ZINC000819286560	BC	On-Demand	Anodyne	S1PR4	18	42
O=C(O)[C@H]1CCN(Cc2cnc3ccnn3c2)C1	ZINC000819286560	BC	On-Demand	Anodyne	S1PR1	30	46
O=C(O)[C@H]1CCN(Cc2cnc3ccnn3c2)C1	ZINC000819286560	BC	On-Demand	Anodyne	S1PR5	39	46
O=C(O)[C@H]1CCN(Cc2cnc3ccnn3c2)C1	ZINC000819286560	BC	On-Demand	Anodyne	DDR1	51	37
O=C(O)[C@@H]1CCN(Cc2cnc3ccnn3c2)C1	ZINC000819286562	BC	On-Demand	Anodyne	SLC6A1	116	37
O=C(O)[C@@H]1CCN(Cc2cnc3ccnn3c2)C1	ZINC000819286562	BC	On-Demand	Anodyne	S1PR4	18	42
O=C(O)[C@@H]1CCN(Cc2cnc3ccnn3c2)C1	ZINC000819286562	BC	On-Demand	Anodyne	S1PR1	30	46
O=C(O)[C@@H]1CCN(Cc2cnc3ccnn3c2)C1	ZINC000819286562	BC	On-Demand	Anodyne	S1PR5	39	46
O=C(O)[C@@H]1CCN(Cc2cnc3ccnn3c2)C1	ZINC000819286562	BC	On-Demand	Anodyne	DDR1	51	37
O=C(CC1OCCO1)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819286563	FG	On-Demand	Anodyne	TBXA2R	18	40
O=C(O)[C@@H]1CCN(Cc2cc3c(cc2O)OCO3)C1	ZINC000819286566	CD	On-Demand	Clean	SLC6A1	135	38
O=C(O)[C@H]1CCN(Cc2cc3c(cc2O)OCO3)C1	ZINC000819286574	CD	On-Demand	Clean	SLC6A1	135	38
O=C(O)[C@@H]1CCN(Cn2[nH]c(-c3ccccc3)nc2=S)C1	ZINC000819286576	DD	On-Demand	Anodyne	SLC6A1	145	39
O=C(O)[C@@H]1CCN(Cn2[nH]c(-c3ccccc3)nc2=S)C1	ZINC000819286576	DD	On-Demand	Anodyne	S1PR1	18	41
O=C(O)[C@@H]1CCN(Cn2[nH]c(-c3ccccc3)nc2=S)C1	ZINC000819286576	DD	On-Demand	Anodyne	S1PR5	33	41
O=C(O)[C@H]1CCN(Cn2[nH]c(-c3ccccc3)nc2=S)C1	ZINC000819286578	DD	On-Demand	Anodyne	SLC6A1	145	39
O=C(O)[C@H]1CCN(Cn2[nH]c(-c3ccccc3)nc2=S)C1	ZINC000819286578	DD	On-Demand	Anodyne	S1PR1	18	41
O=C(O)[C@H]1CCN(Cn2[nH]c(-c3ccccc3)nc2=S)C1	ZINC000819286578	DD	On-Demand	Anodyne	S1PR5	33	41
O=C(O)[C@@H]1CCN(Cn2ccnc2S)C1	ZINC000819286581	BC	On-Demand	Anodyne	SLC6A1	92	34
O=C(O)[C@H]1CCN(Cn2ccnc2S)C1	ZINC000819286583	BC	On-Demand	Anodyne	SLC6A1	92	34
O=C(O)[C@@H]1CCN(Cc2c(O)ccc3ccncc23)C1	ZINC000819286586	CD	On-Demand	Clean	SLC6A1	75	34
O=C(O)[C@@H]1CCN(Cc2c(O)ccc3ccncc23)C1	ZINC000819286586	CD	On-Demand	Clean	S1PR5	17	41
O=C(O)[C@H]1CCN(Cc2c(O)ccc3ccncc23)C1	ZINC000819286589	CD	On-Demand	Clean	SLC6A1	75	34
O=C(O)[C@H]1CCN(Cc2c(O)ccc3ccncc23)C1	ZINC000819286589	CD	On-Demand	Clean	S1PR5	17	41
O=C(O)[C@@H]1CCN(Cn2cccnc2=S)C1	ZINC000819286591	BC	On-Demand	Anodyne	SLC6A1	129	38
O=C(O)[C@H]1CCN(Cn2cccnc2=S)C1	ZINC000819286593	BC	On-Demand	Anodyne	SLC6A1	129	38
O=C(O)[C@@H]1CCN(Cc2nc(O)c3oc4ccccc4c3n2)C1	ZINC000819286595	DD	On-Demand	Anodyne	SLC6A1	98	36
O=C(O)[C@@H]1CCN(Cc2nc(O)c3oc4ccccc4c3n2)C1	ZINC000819286595	DD	On-Demand	Anodyne	PIM1	22	57
O=C(O)[C@@H]1CCN(Cc2nc(O)c3oc4ccccc4c3n2)C1	ZINC000819286595	DD	On-Demand	Anodyne	PIM2	17	57
O=C(O)[C@@H]1CCN(Cc2nc(O)c3oc4ccccc4c3n2)C1	ZINC000819286595	DD	On-Demand	Anodyne	CDC7	23	57
O=C(O)[C@@H]1CCN(Cc2nc(O)c3oc4ccccc4c3n2)C1	ZINC000819286595	DD	On-Demand	Anodyne	PIM3	28	57
O=C(O)[C@H]1CCN(Cc2nc(O)c3oc4ccccc4c3n2)C1	ZINC000819286597	DD	On-Demand	Anodyne	SLC6A1	98	36
O=C(O)[C@H]1CCN(Cc2nc(O)c3oc4ccccc4c3n2)C1	ZINC000819286597	DD	On-Demand	Anodyne	PIM1	22	57
O=C(O)[C@H]1CCN(Cc2nc(O)c3oc4ccccc4c3n2)C1	ZINC000819286597	DD	On-Demand	Anodyne	PIM2	17	57
O=C(O)[C@H]1CCN(Cc2nc(O)c3oc4ccccc4c3n2)C1	ZINC000819286597	DD	On-Demand	Anodyne	CDC7	23	57
O=C(O)[C@H]1CCN(Cc2nc(O)c3oc4ccccc4c3n2)C1	ZINC000819286597	DD	On-Demand	Anodyne	PIM3	28	57
O=C(O)[C@@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819286601	EC	On-Demand	Anodyne	DRD2	15	41
O=C(O)[C@@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819286601	EC	On-Demand	Anodyne	DRD4	33	41
O=C(O)[C@@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819286601	EC	On-Demand	Anodyne	ACHE	29	41
O=C(O)[C@@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819286601	EC	On-Demand	Anodyne	SLC6A1	145	40
O=C(O)[C@@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819286601	EC	On-Demand	Anodyne	SIGMAR1	52	45
O=C(O)[C@@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819286601	EC	On-Demand	Anodyne	S1PR4	18	40
O=C(O)[C@@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819286601	EC	On-Demand	Anodyne	S1PR1	20	49
O=C(O)[C@@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819286601	EC	On-Demand	Anodyne	S1PR5	35	49
O=C(O)[C@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819286603	EC	On-Demand	Anodyne	DRD2	15	41
O=C(O)[C@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819286603	EC	On-Demand	Anodyne	DRD4	33	41
O=C(O)[C@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819286603	EC	On-Demand	Anodyne	ACHE	29	41
O=C(O)[C@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819286603	EC	On-Demand	Anodyne	SLC6A1	145	40
O=C(O)[C@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819286603	EC	On-Demand	Anodyne	SIGMAR1	52	45
O=C(O)[C@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819286603	EC	On-Demand	Anodyne	S1PR4	18	40
O=C(O)[C@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819286603	EC	On-Demand	Anodyne	S1PR1	20	49
O=C(O)[C@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819286603	EC	On-Demand	Anodyne	S1PR5	35	49
O=C(O)[C@H]1CCN(CN2C(=O)C[C@H]2c2ccc(Cl)cc2)C1	ZINC000819286607	DD	On-Demand	Anodyne	SLC6A1	90	39
O=C(O)[C@H]1CCN(CN2C(=O)C[C@H]2c2ccc(Cl)cc2)C1	ZINC000819286607	DD	On-Demand	Anodyne	GRIN2D	54	31
O=C(O)[C@@H]1CCN(CN2C(=O)C[C@@H]2c2ccc(Cl)cc2)C1	ZINC000819286608	DD	On-Demand	Anodyne	SLC6A1	90	39
O=C(O)[C@@H]1CCN(CN2C(=O)C[C@@H]2c2ccc(Cl)cc2)C1	ZINC000819286608	DD	On-Demand	Anodyne	GRIN2D	54	31
O=C(O)[C@H]1CCN(CN2C(=O)C[C@@H]2c2ccc(Cl)cc2)C1	ZINC000819286610	DD	On-Demand	Anodyne	SLC6A1	90	39
O=C(O)[C@H]1CCN(CN2C(=O)C[C@@H]2c2ccc(Cl)cc2)C1	ZINC000819286610	DD	On-Demand	Anodyne	GRIN2D	54	31
O=C(O)[C@@H]1CCN(CN2C(=O)C[C@H]2c2ccc(Cl)cc2)C1	ZINC000819286612	DD	On-Demand	Anodyne	SLC6A1	90	39
O=C(O)[C@@H]1CCN(CN2C(=O)C[C@H]2c2ccc(Cl)cc2)C1	ZINC000819286612	DD	On-Demand	Anodyne	GRIN2D	54	31
O=C(O)[C@@H]1CCN(CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)C1	ZINC000819286614	DC	On-Demand	Bother	SLC6A1	78	33
CN(C)C(=O)C1(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCCC1	ZINC000819286618	GE	On-Demand	Mild	PAPA1_CARPA	38	49
O=C(O)[C@H]1CCN(CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)C1	ZINC000819286620	DC	On-Demand	Bother	SLC6A1	78	33
CN(C)C(=O)C1(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCCC1	ZINC000819286622	GE	On-Demand	Mild	PAPA1_CARPA	38	49
O=C(O)[C@@H]1CCN(Cn2cc(-c3ccccc3)cn2)C1	ZINC000819286623	CD	On-Demand	Anodyne	SLC6A1	139	39
O=C(O)[C@@H]1CCN(Cn2cc(-c3ccccc3)cn2)C1	ZINC000819286623	CD	On-Demand	Anodyne	SIGMAR1	18	40
O=C(O)[C@@H]1CCN(Cn2cc(-c3ccccc3)cn2)C1	ZINC000819286623	CD	On-Demand	Anodyne	S1PR4	17	41
O=C(O)[C@@H]1CCN(Cn2cc(-c3ccccc3)cn2)C1	ZINC000819286623	CD	On-Demand	Anodyne	S1PR1	23	44
O=C(O)[C@@H]1CCN(Cn2cc(-c3ccccc3)cn2)C1	ZINC000819286623	CD	On-Demand	Anodyne	S1PR5	37	44
O=C(O)[C@H]1CCN(Cn2cc(-c3ccccc3)cn2)C1	ZINC000819286626	CD	On-Demand	Anodyne	SLC6A1	139	39
O=C(O)[C@H]1CCN(Cn2cc(-c3ccccc3)cn2)C1	ZINC000819286626	CD	On-Demand	Anodyne	SIGMAR1	18	40
O=C(O)[C@H]1CCN(Cn2cc(-c3ccccc3)cn2)C1	ZINC000819286626	CD	On-Demand	Anodyne	S1PR4	17	41
O=C(O)[C@H]1CCN(Cn2cc(-c3ccccc3)cn2)C1	ZINC000819286626	CD	On-Demand	Anodyne	S1PR1	23	44
O=C(O)[C@H]1CCN(Cn2cc(-c3ccccc3)cn2)C1	ZINC000819286626	CD	On-Demand	Anodyne	S1PR5	37	44
O=C(O)[C@@H]1CCN(CN2C(=O)c3cccc4cccc2c34)C1	ZINC000819286629	CE	On-Demand	Anodyne	SLC6A1	131	40
O=C(O)[C@H]1CCN(CN2C(=O)c3cccc4cccc2c34)C1	ZINC000819286631	CE	On-Demand	Anodyne	SLC6A1	131	40
O=C(O)[C@@H]1CCN(Cn2ccc(C(F)(F)F)n2)C1	ZINC000819286633	CD	On-Demand	Anodyne	SLC6A1	103	36
O=C(O)[C@@H]1CCN(Cn2ccc(C(F)(F)F)n2)C1	ZINC000819286633	CD	On-Demand	Anodyne	S1PR5	31	44
O=C(O)[C@H]1CCN(Cn2ccc(C(F)(F)F)n2)C1	ZINC000819286635	CD	On-Demand	Anodyne	SLC6A1	103	36
O=C(O)[C@H]1CCN(Cn2ccc(C(F)(F)F)n2)C1	ZINC000819286635	CD	On-Demand	Anodyne	S1PR5	31	44
O=C(O)[C@@H]1CCN(Cc2nc(O)c3cnn(-c4ccccc4)c3n2)C1	ZINC000819286637	ED	On-Demand	Anodyne	SLC6A1	101	36
CC[C@H](C#N)Oc1cc(CNC(=O)Cc2cccc(NC(C)=O)c2)ccc1OC	ZINC000819286641	GG	On-Demand	Mild	TSHR	60	32
CC[C@H](C#N)Oc1cc(CNC(=O)Cc2cccc(NC(C)=O)c2)ccc1OC	ZINC000819286641	GG	On-Demand	Mild	ROCK2	15	41
O=C(O)[C@H]1CCN(Cc2nc(O)c3cnn(-c4ccccc4)c3n2)C1	ZINC000819286662	ED	On-Demand	Anodyne	SLC6A1	101	36
O=C(O)[C@@H]1CCN(Cc2nc3cc(-c4ccc(F)cc4)sc3c(=O)[nH]2)C1	ZINC000819286669	FF	On-Demand	Anodyne	SLC6A1	74	34
O=C(O)[C@@H]1CCN(Cc2nc3cc(-c4ccc(F)cc4)sc3c(=O)[nH]2)C1	ZINC000819286669	FF	On-Demand	Anodyne	WNT3A	50	35
O=C(O)[C@H]1CCN(Cc2nc3cc(-c4ccc(F)cc4)sc3c(=O)[nH]2)C1	ZINC000819286670	FF	On-Demand	Anodyne	SLC6A1	74	34
O=C(O)[C@H]1CCN(Cc2nc3cc(-c4ccc(F)cc4)sc3c(=O)[nH]2)C1	ZINC000819286670	FF	On-Demand	Anodyne	WNT3A	50	35
O=C(O)[C@@H]1CCN(CN2C(=O)NC3(CCCCCC3)C2=O)C1	ZINC000819286671	DC	On-Demand	Anodyne	SLC6A1	106	36
O=C(O)[C@H]1CCN(CN2C(=O)NC3(CCCCCC3)C2=O)C1	ZINC000819286672	DC	On-Demand	Anodyne	SLC6A1	106	36
O=C(O)[C@@H]1CCN(Cc2cc(=O)oc3cc4c(cc23)CCC4)C1	ZINC000819286673	DE	On-Demand	Anodyne	SLC6A1	90	33
O=C(O)[C@H]1CCN(Cc2cc(=O)oc3cc4c(cc23)CCC4)C1	ZINC000819286674	DE	On-Demand	Anodyne	SLC6A1	90	33
O=C(O)[C@H]1CCN(Cn2c(C(F)(F)F)csc2=O)C1	ZINC000819286675	CD	On-Demand	Anodyne	SLC6A1	60	35
O=C(O)[C@@H]1CCN(Cn2c(C(F)(F)F)csc2=O)C1	ZINC000819286676	CD	On-Demand	Anodyne	SLC6A1	60	35
O=C(O)[C@@H]1CCN(Cc2cc(F)cc3c2OCOC3)C1	ZINC000819286677	CD	On-Demand	Anodyne	SLC6A1	123	38
O=C(O)[C@H]1CCN(Cc2cc(F)cc3c2OCOC3)C1	ZINC000819286678	CD	On-Demand	Anodyne	SLC6A1	123	38
O=C(O)C1CCN(Cc2nc3cc(F)ccc3o2)CC1	ZINC000819286679	CE	On-Demand	Anodyne	SIGMAR1	16	41
O=C(O)C1CCN(Cc2nc3cc(F)ccc3o2)CC1	ZINC000819286679	CE	On-Demand	Anodyne	S1PR1	18	43
O=C(O)[C@H]1CCN(Cc2nnc3n2CCCCC3)C1	ZINC000819286681	CC	On-Demand	Anodyne	SLC6A1	126	38
O=C(O)[C@@H]1CCN(Cc2nnc3n2CCCCC3)C1	ZINC000819286684	CC	On-Demand	Anodyne	SLC6A1	126	38
O=C(O)[C@@H]1CCN(Cc2nnnn2-c2ccc(OC(F)F)cc2)C1	ZINC000819286685	ED	On-Demand	Anodyne	SLC6A1	79	34
O=C(O)[C@H]1CCN(Cc2nnnn2-c2ccc(OC(F)F)cc2)C1	ZINC000819286687	ED	On-Demand	Anodyne	SLC6A1	79	34
O=C(O)C1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1	ZINC000819286689	DE	On-Demand	Bother	SSTR5	17	46
O=C(O)C1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1	ZINC000819286689	DE	On-Demand	Bother	VCP	21	42
O=C(O)[C@H]1CCN(Cn2[nH]c(-c3ccc(Br)cc3)nc2=S)C1	ZINC000819286691	GF	On-Demand	Anodyne	SLC6A1	61	33
O=C(O)[C@@H]1CCN(Cn2[nH]c(-c3ccc(Br)cc3)nc2=S)C1	ZINC000819286693	GF	On-Demand	Anodyne	SLC6A1	61	33
O=C(O)[C@H]1CCN(Cc2nnc(-c3cccc(F)c3)o2)C1	ZINC000819286694	CD	On-Demand	Anodyne	SLC6A1	123	39
O=C(O)[C@H]1CCN(Cc2nnc(-c3cccc(F)c3)o2)C1	ZINC000819286694	CD	On-Demand	Anodyne	S1PR4	18	41
O=C(O)[C@H]1CCN(Cc2nnc(-c3cccc(F)c3)o2)C1	ZINC000819286694	CD	On-Demand	Anodyne	S1PR1	34	41
O=C(O)[C@@H]1CCN(Cc2nnc(-c3cccc(F)c3)o2)C1	ZINC000819286695	CD	On-Demand	Anodyne	SLC6A1	123	39
O=C(O)[C@@H]1CCN(Cc2nnc(-c3cccc(F)c3)o2)C1	ZINC000819286695	CD	On-Demand	Anodyne	S1PR4	18	41
O=C(O)[C@@H]1CCN(Cc2nnc(-c3cccc(F)c3)o2)C1	ZINC000819286695	CD	On-Demand	Anodyne	S1PR1	34	41
O=C(O)[C@H]1CCN(Cn2nc(-c3ccc(F)cc3)oc2=S)C1	ZINC000819286696	DE	On-Demand	Anodyne	SLC6A1	110	39
O=C(O)[C@H]1CCN(Cn2nc(-c3ccc(F)cc3)oc2=S)C1	ZINC000819286696	DE	On-Demand	Anodyne	WNT3A	45	33
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccc(F)cc3)oc2=S)C1	ZINC000819286697	DE	On-Demand	Anodyne	SLC6A1	110	39
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccc(F)cc3)oc2=S)C1	ZINC000819286697	DE	On-Demand	Anodyne	WNT3A	45	33
O=C(O)[C@@H]1CCN(CN2CCOC2=S)C1	ZINC000819286698	BB	On-Demand	Anodyne	SLC6A1	89	35
O=C(O)[C@H]1CCN(CN2CCOC2=S)C1	ZINC000819286699	BB	On-Demand	Anodyne	SLC6A1	89	35
O=C(O)[C@H]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000819286702	DD	On-Demand	Bother	S1PR1	15	45
O=C(O)[C@@H]1CCN(Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000819286704	DD	On-Demand	Bother	S1PR1	15	45
O=C(O)[C@@H]1CCN(Cc2cccc3nsnc23)C1	ZINC000819286711	CD	On-Demand	Anodyne	SLC6A1	133	37
O=C(O)[C@@H]1CCN(Cc2cccc3nsnc23)C1	ZINC000819286711	CD	On-Demand	Anodyne	S1PR1	17	42
O=C(O)[C@H]1CCN(Cc2cccc3nsnc23)C1	ZINC000819286713	CD	On-Demand	Anodyne	SLC6A1	133	37
O=C(O)[C@H]1CCN(Cc2cccc3nsnc23)C1	ZINC000819286713	CD	On-Demand	Anodyne	S1PR1	17	42
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3)ccc2=O)C1	ZINC000819286721	CD	On-Demand	Anodyne	SLC6A1	133	40
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3)ccc2=O)C1	ZINC000819286721	CD	On-Demand	Anodyne	S1PR5	15	40
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3)ccc2=O)C1	ZINC000819286723	CD	On-Demand	Anodyne	SLC6A1	133	40
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3)ccc2=O)C1	ZINC000819286723	CD	On-Demand	Anodyne	S1PR5	15	40
O=C(O)C1CCN(Cc2cccc(Cl)n2)CC1	ZINC000819286725	CE	On-Demand	Anodyne	DRD4	34	42
O=C(O)C1CCN(Cc2cccc(Cl)n2)CC1	ZINC000819286725	CE	On-Demand	Anodyne	SLC6A1	43	33
O=C(O)C1CCN(Cc2cccc(Cl)n2)CC1	ZINC000819286725	CE	On-Demand	Anodyne	SIGMAR1	32	43
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@@]3(CCCCc4ccccc43)C2=O)C1	ZINC000819286726	FD	On-Demand	Anodyne	SLC6A1	117	35
O=C(O)[C@H]1CCN(CN2C(=O)N[C@@]3(CCCCc4ccccc43)C2=O)C1	ZINC000819286729	FD	On-Demand	Anodyne	SLC6A1	117	35
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@]3(CCCCc4ccccc43)C2=O)C1	ZINC000819286732	FD	On-Demand	Anodyne	SLC6A1	117	35
O=C(O)[C@H]1CCN(CN2C(=O)N[C@]3(CCCCc4ccccc43)C2=O)C1	ZINC000819286733	FD	On-Demand	Anodyne	SLC6A1	117	35
O=C(O)[C@@H]1CCN(Cn2c(S)nnc2Cc2cccs2)C1	ZINC000819286735	DD	On-Demand	Anodyne	SLC6A1	114	41
O=C(O)[C@H]1CCN(Cn2c(S)nnc2Cc2cccs2)C1	ZINC000819286737	DD	On-Demand	Anodyne	SLC6A1	114	41
O=C(O)[C@H]1CCN(CN2C(=O)NC(c3ccccc3)(c3ccccc3)C2=O)C1	ZINC000819286739	GD	On-Demand	Anodyne	SLC6A1	143	40
O=C(O)[C@@H]1CCN(CN2C(=O)NC(c3ccccc3)(c3ccccc3)C2=O)C1	ZINC000819286741	GD	On-Demand	Anodyne	SLC6A1	143	40
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1F	ZINC000819286787	FD	On-Demand	Anodyne	ADRB2	27	45
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1F	ZINC000819286787	FD	On-Demand	Anodyne	ADRB1	43	47
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1F	ZINC000819286787	FD	On-Demand	Anodyne	ADRB3	124	54
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1F	ZINC000819286787	FD	On-Demand	Anodyne	TBXAS1	32	41
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1F	ZINC000819286788	FD	On-Demand	Anodyne	ADRB2	27	45
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1F	ZINC000819286788	FD	On-Demand	Anodyne	ADRB1	43	47
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1F	ZINC000819286788	FD	On-Demand	Anodyne	ADRB3	124	54
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1F	ZINC000819286788	FD	On-Demand	Anodyne	TBXAS1	32	41
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1ccc(F)cc1F	ZINC000819286813	FC	On-Demand	Anodyne	ADRB2	28	46
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1ccc(F)cc1F	ZINC000819286813	FC	On-Demand	Anodyne	ADRB1	30	46
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1ccc(F)cc1F	ZINC000819286813	FC	On-Demand	Anodyne	ADRB3	112	49
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1ccc(F)cc1F	ZINC000819286814	FC	On-Demand	Anodyne	ADRB2	28	46
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1ccc(F)cc1F	ZINC000819286814	FC	On-Demand	Anodyne	ADRB1	30	46
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1ccc(F)cc1F	ZINC000819286814	FC	On-Demand	Anodyne	ADRB3	112	49
CC(=O)Nc1cccc(CC(=O)NC[C@](C)(O)c2ccccc2)c1	ZINC000819286824	EE	On-Demand	Anodyne	KCNK3	93	38
CC(=O)Nc1cccc(CC(=O)NC[C@](C)(O)c2ccccc2)c1	ZINC000819286824	EE	On-Demand	Anodyne	KCNK9	65	35
CC(=O)Nc1cccc(CC(=O)NC[C@@](C)(O)c2ccccc2)c1	ZINC000819286825	EE	On-Demand	Anodyne	KCNK3	93	38
CC(=O)Nc1cccc(CC(=O)NC[C@@](C)(O)c2ccccc2)c1	ZINC000819286825	EE	On-Demand	Anodyne	KCNK9	65	35
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819286848	CE	On-Demand	Anodyne	SLC6A3	30	46
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819286849	CE	On-Demand	Anodyne	SLC6A3	30	46
CC[C@H](C#N)Oc1cc(CNC(=O)[C@@H]2CCCC[C@H]2C)ccc1OC	ZINC000819286852	EH	On-Demand	Mild	LGMN	47	33
CC[C@H](C#N)Oc1cc(CNC(=O)[C@H]2CCCC[C@H]2C)ccc1OC	ZINC000819286853	EH	On-Demand	Mild	LGMN	47	33
CC[C@H](C#N)Oc1cc(CNC(=O)[C@H]2CCCC[C@@H]2C)ccc1OC	ZINC000819286854	EH	On-Demand	Mild	LGMN	47	33
CC[C@H](C#N)Oc1cc(CNC(=O)[C@@H]2CCCC[C@@H]2C)ccc1OC	ZINC000819286855	EH	On-Demand	Mild	LGMN	47	33
Cc1ccccc1[C@@H](O)CN[C@H]1CC[C@@H](C(=O)N2CCCCC2)C1	ZINC000819286856	EF	On-Demand	Anodyne	CCR8	43	36
O=C(/C=C\[C@H]1CCCO1)NCCc1ccc(F)cc1Cl	ZINC000819286866	CF	On-Demand	Anodyne	P2RX7	42	39
O=C(/C=C/[C@@H]1CCCO1)NCCc1ccc(F)cc1Cl	ZINC000819286867	CF	On-Demand	Anodyne	P2RX7	42	39
O=C(/C=C\[C@@H]1CCCO1)NCCc1ccc(F)cc1Cl	ZINC000819286868	CF	On-Demand	Anodyne	P2RX7	42	39
O=C(/C=C/[C@H]1CCCO1)NCCc1ccc(F)cc1Cl	ZINC000819286869	CF	On-Demand	Anodyne	P2RX7	42	39
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819286879	CE	On-Demand	Anodyne	CHRM1	19	41
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819286879	CE	On-Demand	Anodyne	SLC6A3	33	47
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819286879	CE	On-Demand	Anodyne	AOC3	15	43
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819286879	CE	On-Demand	Anodyne	ACHP_LYMST	20	43
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819286879	CE	On-Demand	Anodyne	Q8WSF8_APLCA	42	43
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819286880	CE	On-Demand	Anodyne	CHRM1	19	41
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819286880	CE	On-Demand	Anodyne	SLC6A3	33	47
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819286880	CE	On-Demand	Anodyne	AOC3	15	43
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819286880	CE	On-Demand	Anodyne	ACHP_LYMST	20	43
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819286880	CE	On-Demand	Anodyne	Q8WSF8_APLCA	42	43
COc1cccc([S@@](=O)CC(=O)NC[C@H](OC)C(F)(F)F)c1	ZINC000819286885	ED	On-Demand	Anodyne	MTNR1A	35	42
COc1cccc([S@@](=O)CC(=O)NC[C@H](OC)C(F)(F)F)c1	ZINC000819286885	ED	On-Demand	Anodyne	MTNR1B	34	42
COc1cccc([S@@](=O)CC(=O)NC[C@@H](OC)C(F)(F)F)c1	ZINC000819286886	ED	On-Demand	Anodyne	MTNR1A	35	42
COc1cccc([S@@](=O)CC(=O)NC[C@@H](OC)C(F)(F)F)c1	ZINC000819286886	ED	On-Demand	Anodyne	MTNR1B	34	42
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819286894	CD	On-Demand	Anodyne	ADRB1	23	40
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819286894	CD	On-Demand	Anodyne	ADRB3	73	47
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819286895	CD	On-Demand	Anodyne	ADRB1	23	40
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819286895	CD	On-Demand	Anodyne	ADRB3	73	47
C=C(C)C(C)(C)C(=O)NCc1ccc(OC)c(O[C@H](C#N)CC)c1	ZINC000819286896	EH	On-Demand	Mild	MT-ND1	23	42
C=C(C)C(C)(C)C(=O)NCc1ccc(OC)c(O[C@@H](C#N)CC)c1	ZINC000819286897	EH	On-Demand	Mild	MT-ND1	23	42
C[S@@](=O)C1(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCC1	ZINC000819286914	FD	On-Demand	Anodyne	GPR119	21	41
C[S@@](=O)C1(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCC1	ZINC000819286915	FD	On-Demand	Anodyne	GPR119	21	41
O=C(O)[C@@H]1CCN(Cc2nnc(-c3ccc(Cl)cc3Cl)o2)C1	ZINC000819286944	EF	On-Demand	Anodyne	SLC6A1	96	43
O=C(O)[C@@H]1CCN(Cc2nnc(-c3ccc(Cl)cc3Cl)o2)C1	ZINC000819286944	EF	On-Demand	Anodyne	S1PR1	26	41
O=C(O)[C@H]1CCN(Cc2nnc(-c3ccc(Cl)cc3Cl)o2)C1	ZINC000819286946	EF	On-Demand	Anodyne	SLC6A1	96	43
O=C(O)[C@H]1CCN(Cc2nnc(-c3ccc(Cl)cc3Cl)o2)C1	ZINC000819286946	EF	On-Demand	Anodyne	S1PR1	26	41
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccc(F)cc3)ccc2=O)C1	ZINC000819286951	DD	On-Demand	Anodyne	SLC6A1	93	38
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccc(F)cc3)ccc2=O)C1	ZINC000819286951	DD	On-Demand	Anodyne	WNT3A	46	32
O=C(O)[C@H]1CCN(Cn2nc(-c3ccc(F)cc3)ccc2=O)C1	ZINC000819286952	DD	On-Demand	Anodyne	SLC6A1	93	38
O=C(O)[C@H]1CCN(Cn2nc(-c3ccc(F)cc3)ccc2=O)C1	ZINC000819286952	DD	On-Demand	Anodyne	WNT3A	46	32
O=C(O)[C@H]1CCN(CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)C1	ZINC000819286957	CC	On-Demand	Anodyne	SLC6A1	81	36
O=C(O)[C@@H]1CCN(CN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)C1	ZINC000819286958	CC	On-Demand	Anodyne	SLC6A1	81	36
O=C(O)[C@@H]1CCN(CN2C(=O)[C@H]3CC=CC[C@H]3C2=O)C1	ZINC000819286959	CC	On-Demand	Anodyne	SLC6A1	81	36
O=C(O)[C@@H]1CCN(CN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)C1	ZINC000819286960	CC	On-Demand	Anodyne	SLC6A1	81	36
O=C(O)[C@H]1CCN(Cc2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000819286961	DD	On-Demand	Anodyne	SLC6A1	119	36
O=C(O)[C@H]1CCN(Cc2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000819286961	DD	On-Demand	Anodyne	SIGMAR1	29	43
O=C(O)[C@H]1CCN(Cc2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000819286961	DD	On-Demand	Anodyne	S1PR4	20	44
O=C(O)[C@H]1CCN(Cc2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000819286961	DD	On-Demand	Anodyne	SLC18A3	18	41
O=C(O)[C@H]1CCN(Cc2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000819286961	DD	On-Demand	Anodyne	S1PR1	30	55
O=C(O)[C@H]1CCN(Cc2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000819286961	DD	On-Demand	Anodyne	S1PR5	43	55
O=C(O)[C@@H]1CCN(Cc2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000819286962	DD	On-Demand	Anodyne	SLC6A1	119	36
O=C(O)[C@@H]1CCN(Cc2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000819286962	DD	On-Demand	Anodyne	SIGMAR1	29	43
O=C(O)[C@@H]1CCN(Cc2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000819286962	DD	On-Demand	Anodyne	S1PR4	20	44
O=C(O)[C@@H]1CCN(Cc2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000819286962	DD	On-Demand	Anodyne	SLC18A3	18	41
O=C(O)[C@@H]1CCN(Cc2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000819286962	DD	On-Demand	Anodyne	S1PR1	30	55
O=C(O)[C@@H]1CCN(Cc2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000819286962	DD	On-Demand	Anodyne	S1PR5	43	55
O=C(O)[C@@H]1CCN(Cc2ccc(-n3ccnc3)nc2)C1	ZINC000819286963	CD	On-Demand	Anodyne	SLC6A1	64	33
O=C(O)[C@@H]1CCN(Cc2ccc(-n3ccnc3)nc2)C1	ZINC000819286963	CD	On-Demand	Anodyne	NOS2	94	36
O=C(O)[C@@H]1CCN(Cc2ccc(-n3ccnc3)nc2)C1	ZINC000819286963	CD	On-Demand	Anodyne	S1PR1	24	49
O=C(O)[C@H]1CCN(Cc2ccc(-n3ccnc3)nc2)C1	ZINC000819286964	CD	On-Demand	Anodyne	SLC6A1	64	33
O=C(O)[C@H]1CCN(Cc2ccc(-n3ccnc3)nc2)C1	ZINC000819286964	CD	On-Demand	Anodyne	NOS2	94	36
O=C(O)[C@H]1CCN(Cc2ccc(-n3ccnc3)nc2)C1	ZINC000819286964	CD	On-Demand	Anodyne	S1PR1	24	49
O=C(O)C1CCN(CN2C(=O)C[C@H]2c2ccc(Cl)cc2)CC1	ZINC000819286965	DE	On-Demand	Anodyne	GRIN2D	64	32
O=C(O)C1CCN(CN2C(=O)C[C@@H]2c2ccc(Cl)cc2)CC1	ZINC000819286966	DE	On-Demand	Anodyne	GRIN2D	64	32
O=C(O)[C@@H]1CCN(CN2C(=O)NC3(CCC(c4ccccc4)CC3)C2=O)C1	ZINC000819286967	FD	On-Demand	Anodyne	SLC6A1	117	38
O=C(O)[C@@H]1CCN(CN2C(=O)NC3(CCC(c4ccccc4)CC3)C2=O)C1	ZINC000819286967	FD	On-Demand	Anodyne	CCR5	21	40
O=C(O)[C@H]1CCN(CN2C(=O)NC3(CCC(c4ccccc4)CC3)C2=O)C1	ZINC000819286968	FD	On-Demand	Anodyne	SLC6A1	117	38
O=C(O)[C@H]1CCN(CN2C(=O)NC3(CCC(c4ccccc4)CC3)C2=O)C1	ZINC000819286968	FD	On-Demand	Anodyne	CCR5	21	40
O=C(O)[C@H]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000819286969	DD	On-Demand	Bother	SLC6A1	60	36
O=C(O)[C@H]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000819286969	DD	On-Demand	Bother	S1PR4	18	43
O=C(O)[C@H]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000819286969	DD	On-Demand	Bother	S1PR1	24	44
O=C(O)[C@@H]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000819286970	DD	On-Demand	Bother	SLC6A1	60	36
O=C(O)[C@@H]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000819286970	DD	On-Demand	Bother	S1PR4	18	43
O=C(O)[C@@H]1CCN(Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1	ZINC000819286970	DD	On-Demand	Bother	S1PR1	24	44
O=C(O)[C@@H]1CCN(Cn2c(=S)ncn2-c2ccccc2)C1	ZINC000819286973	DD	On-Demand	Anodyne	SLC6A1	146	39
O=C(O)[C@H]1CCN(Cn2c(=S)ncn2-c2ccccc2)C1	ZINC000819286974	DD	On-Demand	Anodyne	SLC6A1	146	39
O=C(O)[C@@H]1CCN(CN2C(=O)C(=O)N(C3CCCC3)C2=O)C1	ZINC000819286977	DC	On-Demand	Anodyne	SLC6A1	52	34
O=C(O)[C@H]1CCN(CN2C(=O)C(=O)N(C3CCCC3)C2=O)C1	ZINC000819286978	DC	On-Demand	Anodyne	SLC6A1	52	34
O=C(O)[C@H]1CCN(CN2C(=O)CC3(CCCC3)C2=O)C1	ZINC000819286979	CC	On-Demand	Anodyne	SLC6A1	45	33
O=C(O)[C@@H]1CCN(CN2C(=O)CC3(CCCC3)C2=O)C1	ZINC000819286980	CC	On-Demand	Anodyne	SLC6A1	45	33
O=C(O)[C@@H]1CCN(CN2CCSC2=O)C1	ZINC000819286981	BC	On-Demand	Anodyne	SLC6A1	61	33
O=C(O)[C@H]1CCN(CN2CCSC2=O)C1	ZINC000819286982	BC	On-Demand	Anodyne	SLC6A1	61	33
O=C(O)[C@@H]1CCN(CCCCCCCO)C1	ZINC000819286986	BD	On-Demand	Anodyne	SLC6A1	146	48
O=C(O)[C@H]1CCN(CCCCCCCO)C1	ZINC000819286987	BD	On-Demand	Anodyne	SLC6A1	146	48
O=C(O)[C@H]1CCN(CCP(=O)(c2ccccc2)c2ccccc2)C1	ZINC000819286988	EE	On-Demand	Reactive	SLC6A1	182	47
O=C(O)[C@H]1CCN(CCP(=O)(c2ccccc2)c2ccccc2)C1	ZINC000819286988	EE	On-Demand	Reactive	S1PR5	15	42
O=C(O)[C@H]1CCN(CCP(=O)(c2ccccc2)c2ccccc2)C1	ZINC000819286988	EE	On-Demand	Reactive	CYP2J2	44	31
O=C(O)[C@@H]1CCN(CCP(=O)(c2ccccc2)c2ccccc2)C1	ZINC000819286989	EE	On-Demand	Reactive	SLC6A1	182	47
O=C(O)[C@@H]1CCN(CCP(=O)(c2ccccc2)c2ccccc2)C1	ZINC000819286989	EE	On-Demand	Reactive	S1PR5	15	42
O=C(O)[C@@H]1CCN(CCP(=O)(c2ccccc2)c2ccccc2)C1	ZINC000819286989	EE	On-Demand	Reactive	CYP2J2	44	31
O=C(O)[C@@H]1CCN(CCCN2C(=O)CNC2=O)C1	ZINC000819286992	CB	On-Demand	Anodyne	SLC6A1	146	43
O=C(O)[C@H]1CCN(CCCN2C(=O)CNC2=O)C1	ZINC000819286993	CB	On-Demand	Anodyne	SLC6A1	146	43
O=C(O)[C@@H]1CCN(Cc2nc(O)c3c4c(sc3n2)CCC4)C1	ZINC000819286994	DD	On-Demand	Anodyne	SLC6A1	48	32
O=C(O)[C@H]1CCN(Cc2nc(O)c3c4c(sc3n2)CCC4)C1	ZINC000819286995	DD	On-Demand	Anodyne	SLC6A1	48	32
O=C(O)[C@@H]1CCN(CCC2OCCCO2)C1	ZINC000819286996	BC	On-Demand	Anodyne	SLC6A1	151	42
O=C(O)[C@H]1CCN(CCC2OCCCO2)C1	ZINC000819286997	BC	On-Demand	Anodyne	SLC6A1	151	42
O=C(O)[C@@H]1CCN(Cc2nc(O)c3c(-c4ccco4)csc3n2)C1	ZINC000819286998	EF	On-Demand	Anodyne	SLC6A1	80	35
O=C(O)[C@H]1CCN(Cc2nc(O)c3c(-c4ccco4)csc3n2)C1	ZINC000819286999	EF	On-Demand	Anodyne	SLC6A1	80	35
O=C(O)[C@@H]1CCN(CN2C(=O)NC3(CCCCCCC3)C2=O)C1	ZINC000819287000	DD	On-Demand	Anodyne	SLC6A1	106	36
O=C(O)[C@H]1CCN(CN2C(=O)NC3(CCCCCCC3)C2=O)C1	ZINC000819287001	DD	On-Demand	Anodyne	SLC6A1	106	36
O=C(O)[C@H]1CCN(Cc2cnn(-c3ccc(Cl)cc3)n2)C1	ZINC000819287002	DD	On-Demand	Anodyne	SLC6A1	89	40
O=C(O)[C@@H]1CCN(Cc2cnn(-c3ccc(Cl)cc3)n2)C1	ZINC000819287003	DD	On-Demand	Anodyne	SLC6A1	89	40
O=C(O)[C@@H]1CCN(CCN2c3cccc4cccc(c34)S2(=O)=O)C1	ZINC000819287004	ED	On-Demand	Anodyne	SLC6A1	154	38
O=C(O)[C@H]1CCN(CCN2c3cccc4cccc(c34)S2(=O)=O)C1	ZINC000819287005	ED	On-Demand	Anodyne	SLC6A1	154	38
O=C(O)[C@H]1CCN(Cn2c(=O)oc3ccc(Cl)cc32)C1	ZINC000819287007	CD	On-Demand	Anodyne	SLC6A1	75	37
O=C(O)[C@@H]1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000819287008	CE	On-Demand	Bother	SLC6A1	102	38
O=C(O)[C@@H]1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000819287008	CE	On-Demand	Bother	SIGMAR1	30	43
O=C(O)[C@@H]1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000819287008	CE	On-Demand	Bother	S1PR4	19	44
O=C(O)[C@@H]1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000819287008	CE	On-Demand	Bother	S1PR1	28	52
O=C(O)[C@@H]1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000819287008	CE	On-Demand	Bother	S1PR5	42	52
O=C(O)[C@H]1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000819287009	CE	On-Demand	Bother	SLC6A1	102	38
O=C(O)[C@H]1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000819287009	CE	On-Demand	Bother	SIGMAR1	30	43
O=C(O)[C@H]1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000819287009	CE	On-Demand	Bother	S1PR4	19	44
O=C(O)[C@H]1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000819287009	CE	On-Demand	Bother	S1PR1	28	52
O=C(O)[C@H]1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000819287009	CE	On-Demand	Bother	S1PR5	42	52
O=C(O)[C@@H]1CCN(Cc2cn3cc(Br)ccc3n2)C1	ZINC000819287014	DE	On-Demand	Anodyne	SLC6A1	73	34
O=C(O)[C@H]1CCN(Cc2cn3cc(Br)ccc3n2)C1	ZINC000819287015	DE	On-Demand	Anodyne	SLC6A1	73	34
O=C(O)[C@@H]1CCN(Cc2nc(O)c3c(-c4ccccc4)csc3n2)C1	ZINC000819287016	FF	On-Demand	Anodyne	SLC6A1	109	38
O=C(O)[C@@H]1CCN(Cc2nc(O)c3c(-c4ccccc4)csc3n2)C1	ZINC000819287016	FF	On-Demand	Anodyne	S1PR4	18	42
O=C(O)[C@@H]1CCN(Cc2nc(O)c3c(-c4ccccc4)csc3n2)C1	ZINC000819287016	FF	On-Demand	Anodyne	S1PR1	31	42
O=C(O)[C@H]1CCN(Cc2nc(O)c3c(-c4ccccc4)csc3n2)C1	ZINC000819287017	FF	On-Demand	Anodyne	SLC6A1	109	38
O=C(O)[C@H]1CCN(Cc2nc(O)c3c(-c4ccccc4)csc3n2)C1	ZINC000819287017	FF	On-Demand	Anodyne	S1PR4	18	42
O=C(O)[C@H]1CCN(Cc2nc(O)c3c(-c4ccccc4)csc3n2)C1	ZINC000819287017	FF	On-Demand	Anodyne	S1PR1	31	42
O=C(O)[C@@H]1CCN(CCc2nnnn2-c2ccccc2)C1	ZINC000819287018	CC	On-Demand	Anodyne	SLC6A1	163	44
O=C(O)[C@H]1CCN(CCc2nnnn2-c2ccccc2)C1	ZINC000819287019	CC	On-Demand	Anodyne	SLC6A1	163	44
O=C(O)[C@H]1CCN(CN2C(=O)N[C@@]3(CCc4ccccc4C3)C2=O)C1	ZINC000819287020	EC	On-Demand	Anodyne	SLC6A1	117	36
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@]3(CCc4ccccc4C3)C2=O)C1	ZINC000819287021	EC	On-Demand	Anodyne	SLC6A1	117	36
O=C(O)[C@H]1CCN(CN2C(=O)N[C@]3(CCc4ccccc4C3)C2=O)C1	ZINC000819287022	EC	On-Demand	Anodyne	SLC6A1	117	36
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@@]3(CCc4ccccc4C3)C2=O)C1	ZINC000819287023	EC	On-Demand	Anodyne	SLC6A1	117	36
O=C(O)[C@@H]1CCN(Cn2cc(Cl)cn2)C1	ZINC000819287024	BC	On-Demand	Anodyne	SLC6A1	77	35
O=C(O)[C@H]1CCN(Cn2cc(Cl)cn2)C1	ZINC000819287025	BC	On-Demand	Anodyne	SLC6A1	77	35
O=C(O)[C@H]1CCN(Cc2cnc3ccccn23)C1	ZINC000819287026	BD	On-Demand	Anodyne	SLC6A1	139	40
O=C(O)[C@H]1CCN(Cc2cnc3ccccn23)C1	ZINC000819287026	BD	On-Demand	Anodyne	S1PR5	15	42
O=C(O)[C@@H]1CCN(Cc2cnc3ccccn23)C1	ZINC000819287027	BD	On-Demand	Anodyne	SLC6A1	139	40
O=C(O)[C@@H]1CCN(Cc2cnc3ccccn23)C1	ZINC000819287027	BD	On-Demand	Anodyne	S1PR5	15	42
O=C(O)[C@H]1CCN(Cn2ccn(Cc3ccccc3)c2=S)C1	ZINC000819287034	DE	On-Demand	Anodyne	DRD4	27	40
O=C(O)[C@H]1CCN(Cn2ccn(Cc3ccccc3)c2=S)C1	ZINC000819287034	DE	On-Demand	Anodyne	SLC6A1	160	41
O=C(O)[C@H]1CCN(Cn2ccn(Cc3ccccc3)c2=S)C1	ZINC000819287034	DE	On-Demand	Anodyne	SIGMAR1	51	42
O=C(O)[C@H]1CCN(Cn2ccn(Cc3ccccc3)c2=S)C1	ZINC000819287034	DE	On-Demand	Anodyne	S1PR1	20	48
O=C(O)[C@H]1CCN(Cn2ccn(Cc3ccccc3)c2=S)C1	ZINC000819287034	DE	On-Demand	Anodyne	S1PR5	33	48
O=C(O)[C@@H]1CCN(Cn2ccn(Cc3ccccc3)c2=S)C1	ZINC000819287037	DE	On-Demand	Anodyne	DRD4	27	40
O=C(O)[C@@H]1CCN(Cn2ccn(Cc3ccccc3)c2=S)C1	ZINC000819287037	DE	On-Demand	Anodyne	SLC6A1	160	41
O=C(O)[C@@H]1CCN(Cn2ccn(Cc3ccccc3)c2=S)C1	ZINC000819287037	DE	On-Demand	Anodyne	SIGMAR1	51	42
O=C(O)[C@@H]1CCN(Cn2ccn(Cc3ccccc3)c2=S)C1	ZINC000819287037	DE	On-Demand	Anodyne	S1PR1	20	48
O=C(O)[C@@H]1CCN(Cn2ccn(Cc3ccccc3)c2=S)C1	ZINC000819287037	DE	On-Demand	Anodyne	S1PR5	33	48
O=C(O)[C@H]1CCN(CCCN2CCCC2=O)C1	ZINC000819287039	BC	On-Demand	Anodyne	SLC6A1	157	43
O=C(O)[C@@H]1CCN(CCCN2CCCC2=O)C1	ZINC000819287041	BC	On-Demand	Anodyne	SLC6A1	157	43
O=C(O)[C@@H]1CCN(Cn2c(C3CC3)nn(-c3ccccc3)c2=S)C1	ZINC000819287042	EF	On-Demand	Anodyne	SLC6A1	153	42
O=C(O)[C@H]1CCN(Cn2c(C3CC3)nn(-c3ccccc3)c2=S)C1	ZINC000819287045	EF	On-Demand	Anodyne	SLC6A1	153	42
O=C(O)[C@@H]1CCN(CN2C(=O)C(=O)N(CCC3=CCCCC3)C2=O)C1	ZINC000819287047	ED	On-Demand	Anodyne	SLC6A1	76	38
O=C(O)[C@H]1CCN(CN2C(=O)C(=O)N(CCC3=CCCCC3)C2=O)C1	ZINC000819287048	ED	On-Demand	Anodyne	SLC6A1	76	38
O=C(O)[C@@H]1CCN(CCn2ccc([N+](=O)[O-])n2)C1	ZINC000819287051	CC	On-Demand	Bother	SLC6A1	155	40
O=C(O)[C@H]1CCN(CCn2ccc([N+](=O)[O-])n2)C1	ZINC000819287053	CC	On-Demand	Bother	SLC6A1	155	40
O=C(O)[C@H]1CCN(Cc2c(O)nnn2-c2ccccc2)C1	ZINC000819287055	CC	On-Demand	Anodyne	SLC6A1	154	42
O=C(O)[C@H]1CCN(Cc2c(O)nnn2-c2ccccc2)C1	ZINC000819287055	CC	On-Demand	Anodyne	S1PR5	16	45
O=C(O)[C@@H]1CCN(Cc2c(O)nnn2-c2ccccc2)C1	ZINC000819287057	CC	On-Demand	Anodyne	SLC6A1	154	42
O=C(O)[C@@H]1CCN(Cc2c(O)nnn2-c2ccccc2)C1	ZINC000819287057	CC	On-Demand	Anodyne	S1PR5	16	45
O=C(O)[C@@H]1CCN(Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1	ZINC000819287058	DD	On-Demand	Bother	SLC6A1	47	34
CN(CCCC(=O)Nc1nc(CC(F)(F)F)cs1)C1=NS(=O)(=O)c2ccccc21	ZINC000819287117	IG	On-Demand	Anodyne	KCNA3	24	47
O=S(=O)(NCCNC[C@H](O)c1cccc(F)c1)c1ccc(Cl)cc1F	ZINC000819287158	GE	On-Demand	Anodyne	ADRB1	31	44
O=S(=O)(NCCNC[C@H](O)c1cccc(F)c1)c1ccc(Cl)cc1F	ZINC000819287158	GE	On-Demand	Anodyne	ADRB3	58	44
O=S(=O)(NCCNC[C@@H](O)c1cccc(F)c1)c1ccc(Cl)cc1F	ZINC000819287159	GE	On-Demand	Anodyne	ADRB1	31	44
O=S(=O)(NCCNC[C@@H](O)c1cccc(F)c1)c1ccc(Cl)cc1F	ZINC000819287159	GE	On-Demand	Anodyne	ADRB3	58	44
O=S(=O)(NCCNC[C@H](O)c1cccc(F)c1)c1ccc(F)cc1F	ZINC000819287171	FD	On-Demand	Anodyne	ADRB1	22	43
O=S(=O)(NCCNC[C@H](O)c1cccc(F)c1)c1ccc(F)cc1F	ZINC000819287171	FD	On-Demand	Anodyne	ADRB3	52	41
O=S(=O)(NCCNC[C@@H](O)c1cccc(F)c1)c1ccc(F)cc1F	ZINC000819287172	FD	On-Demand	Anodyne	ADRB1	22	43
O=S(=O)(NCCNC[C@@H](O)c1cccc(F)c1)c1ccc(F)cc1F	ZINC000819287172	FD	On-Demand	Anodyne	ADRB3	52	41
N#C[C@@H]1CN(C(=O)/C=C\[C@@H]2CCCO2)CCN1Cc1ccccc1	ZINC000819287173	ED	On-Demand	Mild	DPP4	23	40
N#C[C@@H]1CN(C(=O)/C=C\[C@H]2CCCO2)CCN1Cc1ccccc1	ZINC000819287174	ED	On-Demand	Mild	DPP4	23	40
N#C[C@@H]1CN(C(=O)/C=C/[C@@H]2CCCO2)CCN1Cc1ccccc1	ZINC000819287175	ED	On-Demand	Mild	DPP4	23	40
N#C[C@@H]1CN(C(=O)/C=C/[C@H]2CCCO2)CCN1Cc1ccccc1	ZINC000819287176	ED	On-Demand	Mild	DPP4	23	40
C[C@@H]1CCCC[C@H]1C(=O)NC[C@@](C)(O)c1ccccc1	ZINC000819287212	CF	On-Demand	Anodyne	AMY2	50	34
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@](C)(O)c1ccccc1	ZINC000819287213	CF	On-Demand	Anodyne	AMY2	50	34
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@@](C)(O)c1ccccc1	ZINC000819287214	CF	On-Demand	Anodyne	AMY2	50	34
C[C@@H]1CCCC[C@H]1C(=O)NC[C@](C)(O)c1ccccc1	ZINC000819287215	CF	On-Demand	Anodyne	AMY2	50	34
C[S@@](=O)C1(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819287216	CD	On-Demand	Anodyne	ADRB1	36	47
C[S@@](=O)C1(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819287216	CD	On-Demand	Anodyne	ADRB3	55	47
C[S@@](=O)C1(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819287217	CD	On-Demand	Anodyne	ADRB1	36	47
C[S@@](=O)C1(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819287217	CD	On-Demand	Anodyne	ADRB3	55	47
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819287222	GE	On-Demand	Anodyne	GPR119	48	48
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819287223	GE	On-Demand	Anodyne	GPR119	48	48
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819287230	FF	On-Demand	Anodyne	INHA	54	34
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819287230	FF	On-Demand	Anodyne	CCR8	69	43
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819287231	FF	On-Demand	Anodyne	INHA	54	34
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819287231	FF	On-Demand	Anodyne	CCR8	69	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(Cc2ccccc2)[C@H](C#N)C1	ZINC000819287240	GE	On-Demand	Mild	DPP4	24	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(Cc2ccccc2)[C@H](C#N)C1	ZINC000819287240	GE	On-Demand	Mild	PREP	16	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(Cc2ccccc2)[C@@H](C#N)C1	ZINC000819287242	GE	On-Demand	Mild	DPP4	24	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(Cc2ccccc2)[C@@H](C#N)C1	ZINC000819287242	GE	On-Demand	Mild	PREP	16	40
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819287280	EG	On-Demand	Anodyne	CCR2	64	42
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819287281	EG	On-Demand	Anodyne	CCR2	64	42
O=C(O)[C@H]1CCN(Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1	ZINC000819287299	DD	On-Demand	Bother	SLC6A1	47	34
O=C(O)[C@H]1CCN(Cn2[nH]c(-c3ccc(Cl)cc3)nc2=S)C1	ZINC000819287300	EF	On-Demand	Anodyne	SLC6A1	96	41
O=C(O)[C@@H]1CCN(Cn2[nH]c(-c3ccc(Cl)cc3)nc2=S)C1	ZINC000819287303	EF	On-Demand	Anodyne	SLC6A1	96	41
O=C(O)[C@@H]1CCN(Cc2nc(O)c3ccc(Cl)cc3n2)C1	ZINC000819287305	DD	On-Demand	Anodyne	SLC6A1	96	38
O=C(O)[C@@H]1CCN(Cc2nc(O)c3ccc(Cl)cc3n2)C1	ZINC000819287305	DD	On-Demand	Anodyne	S1PR1	15	42
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2cccnc2)C1)N1CCCCC1	ZINC000819287306	DD	On-Demand	Anodyne	ADRB1	27	43
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2cccnc2)C1)N1CCCCC1	ZINC000819287306	DD	On-Demand	Anodyne	ADRB3	98	50
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2cccnc2)C1)N1CCCCC1	ZINC000819287306	DD	On-Demand	Anodyne	C3AR1	43	41
O=C(O)[C@H]1CCN(Cc2nc(O)c3ccc(Cl)cc3n2)C1	ZINC000819287307	DD	On-Demand	Anodyne	SLC6A1	96	38
O=C(O)[C@H]1CCN(Cc2nc(O)c3ccc(Cl)cc3n2)C1	ZINC000819287307	DD	On-Demand	Anodyne	S1PR1	15	42
O=C([C@@H]1CC[C@H](NC[C@H](O)c2cccnc2)C1)N1CCCCC1	ZINC000819287308	DD	On-Demand	Anodyne	ADRB1	27	43
O=C([C@@H]1CC[C@H](NC[C@H](O)c2cccnc2)C1)N1CCCCC1	ZINC000819287308	DD	On-Demand	Anodyne	ADRB3	98	50
O=C([C@@H]1CC[C@H](NC[C@H](O)c2cccnc2)C1)N1CCCCC1	ZINC000819287308	DD	On-Demand	Anodyne	C3AR1	43	41
O=C(O)[C@@H]1CCN(CN2C(=O)CC23CCC3)C1	ZINC000819287309	BC	On-Demand	Anodyne	SLC6A1	57	33
O=C(O)[C@H]1CCN(CN2C(=O)CC23CCC3)C1	ZINC000819287311	BC	On-Demand	Anodyne	SLC6A1	57	33
O=C(O)C1CCN(Cc2nnc(-c3cccc(F)c3)o2)CC1	ZINC000819287313	DE	On-Demand	Anodyne	SIGMAR1	15	41
O=C(O)C1CCN(Cc2nnc(-c3cccc(F)c3)o2)CC1	ZINC000819287313	DE	On-Demand	Anodyne	S1PR1	18	41
O=C(O)C1CCN(Cc2nnc(-c3cccc(F)c3)o2)CC1	ZINC000819287313	DE	On-Demand	Anodyne	VCP	24	44
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819287316	EF	On-Demand	Anodyne	TLR4	15	42
O=C(O)[C@@H]1CCN(CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)C1	ZINC000819287317	DC	On-Demand	Bother	SLC6A1	50	34
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819287318	EF	On-Demand	Anodyne	TLR4	15	42
O=C(O)[C@H]1CCN(CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)C1	ZINC000819287320	DC	On-Demand	Bother	SLC6A1	50	34
O=C(O)[C@H]1CCN(Cc2nc(COc3ccc(F)cc3)no2)C1	ZINC000819287322	DD	On-Demand	Anodyne	SLC6A1	106	38
O=C(O)[C@H]1CCN(Cc2nc(COc3ccc(F)cc3)no2)C1	ZINC000819287322	DD	On-Demand	Anodyne	S1PR4	18	46
O=C(O)[C@H]1CCN(Cc2nc(COc3ccc(F)cc3)no2)C1	ZINC000819287322	DD	On-Demand	Anodyne	S1PR1	25	48
O=C(O)[C@H]1CCN(Cc2nc(COc3ccc(F)cc3)no2)C1	ZINC000819287322	DD	On-Demand	Anodyne	S1PR5	33	41
O=C(O)[C@H]1CCN(Cc2nc(COc3ccc(F)cc3)no2)C1	ZINC000819287322	DD	On-Demand	Anodyne	WNT3A	45	31
O=C(O)[C@@H]1CCN(Cc2nc(COc3ccc(F)cc3)no2)C1	ZINC000819287324	DD	On-Demand	Anodyne	SLC6A1	106	38
O=C(O)[C@@H]1CCN(Cc2nc(COc3ccc(F)cc3)no2)C1	ZINC000819287324	DD	On-Demand	Anodyne	S1PR4	18	46
O=C(O)[C@@H]1CCN(Cc2nc(COc3ccc(F)cc3)no2)C1	ZINC000819287324	DD	On-Demand	Anodyne	S1PR1	25	48
O=C(O)[C@@H]1CCN(Cc2nc(COc3ccc(F)cc3)no2)C1	ZINC000819287324	DD	On-Demand	Anodyne	S1PR5	33	41
O=C(O)[C@@H]1CCN(Cc2nc(COc3ccc(F)cc3)no2)C1	ZINC000819287324	DD	On-Demand	Anodyne	WNT3A	45	31
O=C(O)[C@@H]1CCN(Cn2cc(Br)cn2)C1	ZINC000819287336	CD	On-Demand	Anodyne	SLC6A1	60	33
O=C(O)[C@H]1CCN(Cn2cc(Br)cn2)C1	ZINC000819287346	CD	On-Demand	Anodyne	SLC6A1	60	33
O=C(O)[C@H]1CCN(CCc2nc(O)c3ccccc3n2)C1	ZINC000819287347	CD	On-Demand	Anodyne	SLC6A1	161	41
O=C(O)[C@H]1CCN(CCc2nc(O)c3ccccc3n2)C1	ZINC000819287347	CD	On-Demand	Anodyne	HTR7	21	56
O=C(O)[C@H]1CCN(CCc2nc(O)c3ccccc3n2)C1	ZINC000819287347	CD	On-Demand	Anodyne	PARP1	16	54
O=C(O)[C@H]1CCN(CCc2nc(O)c3ccccc3n2)C1	ZINC000819287347	CD	On-Demand	Anodyne	CYP2J2	44	30
O=C(O)[C@H]1CCN(CCc2nc(O)c3ccccc3n2)C1	ZINC000819287347	CD	On-Demand	Anodyne	TNKS	56	31
O=C(O)[C@@H]1CCN(CCc2nc(O)c3ccccc3n2)C1	ZINC000819287348	CD	On-Demand	Anodyne	SLC6A1	161	41
O=C(O)[C@@H]1CCN(CCc2nc(O)c3ccccc3n2)C1	ZINC000819287348	CD	On-Demand	Anodyne	HTR7	21	56
O=C(O)[C@@H]1CCN(CCc2nc(O)c3ccccc3n2)C1	ZINC000819287348	CD	On-Demand	Anodyne	PARP1	16	54
O=C(O)[C@@H]1CCN(CCc2nc(O)c3ccccc3n2)C1	ZINC000819287348	CD	On-Demand	Anodyne	CYP2J2	44	30
O=C(O)[C@@H]1CCN(CCc2nc(O)c3ccccc3n2)C1	ZINC000819287348	CD	On-Demand	Anodyne	TNKS	56	31
O=C(O)[C@@H]1CCN(CN2C(=O)[C@H]3CCCCC[C@H]32)C1	ZINC000819287349	CD	On-Demand	Anodyne	SLC6A1	90	35
O=C(O)[C@@H]1CCN(CN2C(=O)[C@@H]3CCCCC[C@H]32)C1	ZINC000819287351	CD	On-Demand	Anodyne	SLC6A1	90	35
O=C(O)[C@@H]1CCN(CN2C(=O)[C@@H]3CCCCC[C@@H]32)C1	ZINC000819287353	CD	On-Demand	Anodyne	SLC6A1	90	35
O=C(O)[C@@H]1CCN(CN2C(=O)[C@H]3CCCCC[C@@H]32)C1	ZINC000819287355	CD	On-Demand	Anodyne	SLC6A1	90	35
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccc(F)c(F)c3)c3ccccc3c2=O)C1	ZINC000819287357	GF	On-Demand	Anodyne	SLC6A1	118	44
O=C(O)[C@H]1CCN(Cn2nc(-c3ccc(F)c(F)c3)c3ccccc3c2=O)C1	ZINC000819287360	GF	On-Demand	Anodyne	SLC6A1	118	44
O=C(O)C1CCN(Cc2nc(CCc3ccccc3)no2)CC1	ZINC000819287363	DE	On-Demand	Anodyne	SIGMAR1	49	40
O=C(O)C1CCN(Cc2nc(CCc3ccccc3)no2)CC1	ZINC000819287363	DE	On-Demand	Anodyne	S1PR1	27	41
O=C(O)[C@@H]1CCN(Cn2c(=S)oc3ccccc32)C1	ZINC000819287365	CE	On-Demand	Anodyne	SLC6A1	151	40
O=C(O)[C@@H]1CCN(Cn2c(=S)oc3ccccc32)C1	ZINC000819287365	CE	On-Demand	Anodyne	SIGMAR1	15	47
O=C(O)[C@H]1CCN(Cn2c(=S)oc3ccccc32)C1	ZINC000819287367	CE	On-Demand	Anodyne	SLC6A1	151	40
O=C(O)[C@H]1CCN(Cn2c(=S)oc3ccccc32)C1	ZINC000819287367	CE	On-Demand	Anodyne	SIGMAR1	15	47
O=C(O)C1CCN(Cc2ccc(-n3ccnc3)nc2)CC1	ZINC000819287371	CD	On-Demand	Anodyne	SIGMAR1	17	41
O=C(O)C1CCN(Cc2ccc(-n3ccnc3)nc2)CC1	ZINC000819287371	CD	On-Demand	Anodyne	SSTR5	25	40
O=C(O)C1CCN(Cc2ccc(-n3ccnc3)nc2)CC1	ZINC000819287371	CD	On-Demand	Anodyne	NOS2	90	37
O=C(O)[C@H]1CCN(CN2C(=O)N[C@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287377	GC	On-Demand	Anodyne	CHRM2	15	41
O=C(O)[C@H]1CCN(CN2C(=O)N[C@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287377	GC	On-Demand	Anodyne	SLC6A1	138	38
O=C(O)[C@H]1CCN(CN2C(=O)N[C@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287377	GC	On-Demand	Anodyne	CHRM3	16	41
O=C(O)[C@H]1CCN(CN2C(=O)N[C@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287377	GC	On-Demand	Anodyne	SIGMAR1	44	42
O=C(O)[C@H]1CCN(CN2C(=O)N[C@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287377	GC	On-Demand	Anodyne	S1PR1	15	44
O=C(O)[C@H]1CCN(CN2C(=O)N[C@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287377	GC	On-Demand	Anodyne	CACNA1G	17	40
O=C(O)[C@H]1CCN(CN2C(=O)N[C@@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287379	GC	On-Demand	Anodyne	CHRM2	15	41
O=C(O)[C@H]1CCN(CN2C(=O)N[C@@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287379	GC	On-Demand	Anodyne	SLC6A1	138	38
O=C(O)[C@H]1CCN(CN2C(=O)N[C@@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287379	GC	On-Demand	Anodyne	CHRM3	16	41
O=C(O)[C@H]1CCN(CN2C(=O)N[C@@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287379	GC	On-Demand	Anodyne	SIGMAR1	44	42
O=C(O)[C@H]1CCN(CN2C(=O)N[C@@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287379	GC	On-Demand	Anodyne	S1PR1	15	44
O=C(O)[C@H]1CCN(CN2C(=O)N[C@@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287379	GC	On-Demand	Anodyne	CACNA1G	17	40
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287380	GC	On-Demand	Anodyne	CHRM2	15	41
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287380	GC	On-Demand	Anodyne	SLC6A1	138	38
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287380	GC	On-Demand	Anodyne	CHRM3	16	41
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287380	GC	On-Demand	Anodyne	SIGMAR1	44	42
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287380	GC	On-Demand	Anodyne	S1PR1	15	44
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287380	GC	On-Demand	Anodyne	CACNA1G	17	40
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287381	GC	On-Demand	Anodyne	CHRM2	15	41
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287381	GC	On-Demand	Anodyne	SLC6A1	138	38
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287381	GC	On-Demand	Anodyne	CHRM3	16	41
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287381	GC	On-Demand	Anodyne	SIGMAR1	44	42
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287381	GC	On-Demand	Anodyne	S1PR1	15	44
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000819287381	GC	On-Demand	Anodyne	CACNA1G	17	40
O=C(O)[C@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287382	CD	On-Demand	Anodyne	DRD2	21	42
O=C(O)[C@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287382	CD	On-Demand	Anodyne	DRD4	48	42
O=C(O)[C@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287382	CD	On-Demand	Anodyne	SLC6A1	149	40
O=C(O)[C@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287382	CD	On-Demand	Anodyne	DRD3	17	42
O=C(O)[C@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287382	CD	On-Demand	Anodyne	LTA4H	26	45
O=C(O)[C@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287382	CD	On-Demand	Anodyne	SIGMAR1	46	46
O=C(O)[C@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287382	CD	On-Demand	Anodyne	PDE6D	21	40
O=C(O)[C@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287382	CD	On-Demand	Anodyne	S1PR4	19	45
O=C(O)[C@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287382	CD	On-Demand	Anodyne	SLC18A3	22	41
O=C(O)[C@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287382	CD	On-Demand	Anodyne	S1PR1	36	47
O=C(O)[C@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287382	CD	On-Demand	Anodyne	S1PR5	40	47
O=C(O)[C@@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287383	CD	On-Demand	Anodyne	DRD2	21	42
O=C(O)[C@@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287383	CD	On-Demand	Anodyne	DRD4	48	42
O=C(O)[C@@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287383	CD	On-Demand	Anodyne	SLC6A1	149	40
O=C(O)[C@@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287383	CD	On-Demand	Anodyne	DRD3	17	42
O=C(O)[C@@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287383	CD	On-Demand	Anodyne	LTA4H	26	45
O=C(O)[C@@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287383	CD	On-Demand	Anodyne	SIGMAR1	46	46
O=C(O)[C@@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287383	CD	On-Demand	Anodyne	PDE6D	21	40
O=C(O)[C@@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287383	CD	On-Demand	Anodyne	S1PR4	19	45
O=C(O)[C@@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287383	CD	On-Demand	Anodyne	SLC18A3	22	41
O=C(O)[C@@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287383	CD	On-Demand	Anodyne	S1PR1	36	47
O=C(O)[C@@H]1CCN(Cc2nccn2Cc2ccccc2)C1	ZINC000819287383	CD	On-Demand	Anodyne	S1PR5	40	47
O=C(O)[C@@H]1CCN(CCCS(=O)(=O)c2ccccc2)C1	ZINC000819287384	CD	On-Demand	Anodyne	HTR2A	24	46
O=C(O)[C@@H]1CCN(CCCS(=O)(=O)c2ccccc2)C1	ZINC000819287384	CD	On-Demand	Anodyne	HTR2C	15	42
O=C(O)[C@@H]1CCN(CCCS(=O)(=O)c2ccccc2)C1	ZINC000819287384	CD	On-Demand	Anodyne	SLC6A1	176	53
O=C(O)[C@@H]1CCN(CCCS(=O)(=O)c2ccccc2)C1	ZINC000819287384	CD	On-Demand	Anodyne	HTR7	29	42
O=C(O)[C@@H]1CCN(CCCS(=O)(=O)c2ccccc2)C1	ZINC000819287384	CD	On-Demand	Anodyne	SIGMAR1	30	47
O=C(O)[C@@H]1CCN(CCCS(=O)(=O)c2ccccc2)C1	ZINC000819287384	CD	On-Demand	Anodyne	CCR5	42	36
O=C(O)[C@@H]1CCN(CCCS(=O)(=O)c2ccccc2)C1	ZINC000819287384	CD	On-Demand	Anodyne	CYP2J2	50	34
O=C(O)[C@H]1CCN(CCCS(=O)(=O)c2ccccc2)C1	ZINC000819287385	CD	On-Demand	Anodyne	HTR2A	24	46
O=C(O)[C@H]1CCN(CCCS(=O)(=O)c2ccccc2)C1	ZINC000819287385	CD	On-Demand	Anodyne	HTR2C	15	42
O=C(O)[C@H]1CCN(CCCS(=O)(=O)c2ccccc2)C1	ZINC000819287385	CD	On-Demand	Anodyne	SLC6A1	176	53
O=C(O)[C@H]1CCN(CCCS(=O)(=O)c2ccccc2)C1	ZINC000819287385	CD	On-Demand	Anodyne	HTR7	29	42
O=C(O)[C@H]1CCN(CCCS(=O)(=O)c2ccccc2)C1	ZINC000819287385	CD	On-Demand	Anodyne	SIGMAR1	30	47
O=C(O)[C@H]1CCN(CCCS(=O)(=O)c2ccccc2)C1	ZINC000819287385	CD	On-Demand	Anodyne	CCR5	42	36
O=C(O)[C@H]1CCN(CCCS(=O)(=O)c2ccccc2)C1	ZINC000819287385	CD	On-Demand	Anodyne	CYP2J2	50	34
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3)cc(C(F)(F)F)c2=O)C1	ZINC000819287386	FE	On-Demand	Anodyne	SLC6A1	117	43
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3)cc(C(F)(F)F)c2=O)C1	ZINC000819287386	FE	On-Demand	Anodyne	S1PR1	21	42
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3)cc(C(F)(F)F)c2=O)C1	ZINC000819287386	FE	On-Demand	Anodyne	SFRP1	40	34
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3)cc(C(F)(F)F)c2=O)C1	ZINC000819287387	FE	On-Demand	Anodyne	SLC6A1	117	43
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3)cc(C(F)(F)F)c2=O)C1	ZINC000819287387	FE	On-Demand	Anodyne	S1PR1	21	42
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3)cc(C(F)(F)F)c2=O)C1	ZINC000819287387	FE	On-Demand	Anodyne	SFRP1	40	34
O=C(O)[C@@H]1CCN(CCn2cc([N+](=O)[O-])cn2)C1	ZINC000819287388	CC	On-Demand	Bother	SLC6A1	121	35
O=C(O)[C@H]1CCN(CCn2cc([N+](=O)[O-])cn2)C1	ZINC000819287389	CC	On-Demand	Bother	SLC6A1	121	35
O=C(O)[C@H]1CCN(CN2C(=O)C(=O)N(CCc3cccs3)C2=O)C1	ZINC000819287390	FC	On-Demand	Anodyne	SLC6A1	111	37
O=C(O)[C@@H]1CCN(CN2C(=O)C(=O)N(CCc3cccs3)C2=O)C1	ZINC000819287391	FC	On-Demand	Anodyne	SLC6A1	111	37
O=C(O)[C@@H]1CCN(Cn2cnc3cc(F)c(F)cc32)C1	ZINC000819287392	CD	On-Demand	Anodyne	SLC6A1	85	36
O=C(O)[C@H]1CCN(Cn2cnc3cc(F)c(F)cc32)C1	ZINC000819287393	CD	On-Demand	Anodyne	SLC6A1	85	36
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3)n(Cc3ccco3)c2=S)C1	ZINC000819287396	GG	On-Demand	Anodyne	SLC6A1	82	35
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3)n(Cc3ccco3)c2=S)C1	ZINC000819287397	GG	On-Demand	Anodyne	SLC6A1	82	35
O=C(O)[C@@H]1CCN(CN2CC3(CCCC3)CC2=O)C1	ZINC000819287398	CD	On-Demand	Anodyne	SLC6A1	50	33
O=C(O)[C@H]1CCN(CN2CC3(CCCC3)CC2=O)C1	ZINC000819287399	CD	On-Demand	Anodyne	SLC6A1	50	33
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)C1	ZINC000819287402	DC	On-Demand	Anodyne	SLC6A1	129	38
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)C1	ZINC000819287402	DC	On-Demand	Anodyne	GALR1	45	32
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)C1	ZINC000819287402	DC	On-Demand	Anodyne	CCR5	15	44
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)C1	ZINC000819287402	DC	On-Demand	Anodyne	CYP2J2	42	30
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)C1	ZINC000819287403	DC	On-Demand	Anodyne	SLC6A1	129	38
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)C1	ZINC000819287403	DC	On-Demand	Anodyne	GALR1	45	32
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)C1	ZINC000819287403	DC	On-Demand	Anodyne	CCR5	15	44
O=C(O)[C@@H]1CCN(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)C1	ZINC000819287403	DC	On-Demand	Anodyne	CYP2J2	42	30
O=C(O)[C@H]1CCN(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)C1	ZINC000819287404	DC	On-Demand	Anodyne	SLC6A1	129	38
O=C(O)[C@H]1CCN(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)C1	ZINC000819287404	DC	On-Demand	Anodyne	GALR1	45	32
O=C(O)[C@H]1CCN(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)C1	ZINC000819287404	DC	On-Demand	Anodyne	CCR5	15	44
O=C(O)[C@H]1CCN(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)C1	ZINC000819287404	DC	On-Demand	Anodyne	CYP2J2	42	30
O=C(O)[C@H]1CCN(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)C1	ZINC000819287405	DC	On-Demand	Anodyne	SLC6A1	129	38
O=C(O)[C@H]1CCN(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)C1	ZINC000819287405	DC	On-Demand	Anodyne	GALR1	45	32
O=C(O)[C@H]1CCN(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)C1	ZINC000819287405	DC	On-Demand	Anodyne	CCR5	15	44
O=C(O)[C@H]1CCN(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)C1	ZINC000819287405	DC	On-Demand	Anodyne	CYP2J2	42	30
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3)oc2=O)C1	ZINC000819287406	CC	On-Demand	Anodyne	SLC6A1	124	39
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3)oc2=O)C1	ZINC000819287406	CC	On-Demand	Anodyne	S1PR4	18	41
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3)oc2=O)C1	ZINC000819287406	CC	On-Demand	Anodyne	S1PR1	25	41
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3)oc2=O)C1	ZINC000819287406	CC	On-Demand	Anodyne	S1PR5	37	41
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3)oc2=O)C1	ZINC000819287406	CC	On-Demand	Anodyne	PDE8B	52	36
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3)oc2=O)C1	ZINC000819287407	CC	On-Demand	Anodyne	SLC6A1	124	39
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3)oc2=O)C1	ZINC000819287407	CC	On-Demand	Anodyne	S1PR4	18	41
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3)oc2=O)C1	ZINC000819287407	CC	On-Demand	Anodyne	S1PR1	25	41
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3)oc2=O)C1	ZINC000819287407	CC	On-Demand	Anodyne	S1PR5	37	41
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3)oc2=O)C1	ZINC000819287407	CC	On-Demand	Anodyne	PDE8B	52	36
O=C(O)[C@H]1CCN(CN2C(=O)C(=O)N(C3CCCCC3)C2=O)C1	ZINC000819287408	DC	On-Demand	Anodyne	SLC6A1	40	34
O=C(O)[C@@H]1CCN(CN2C(=O)C(=O)N(C3CCCCC3)C2=O)C1	ZINC000819287409	DC	On-Demand	Anodyne	SLC6A1	40	34
O=C(O)C1CCN(CN2C(=O)c3ccc(F)cc3C2=O)CC1	ZINC000819287410	DD	On-Demand	Anodyne	SLC6A1	50	40
O=C(O)[C@H]1CCN(Cn2nc(-c3ccc(F)cc3)oc2=O)C1	ZINC000819287411	DD	On-Demand	Anodyne	SLC6A1	85	39
O=C(O)[C@H]1CCN(Cn2nc(-c3ccc(F)cc3)oc2=O)C1	ZINC000819287411	DD	On-Demand	Anodyne	WNT3A	47	34
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccc(F)cc3)oc2=O)C1	ZINC000819287412	DD	On-Demand	Anodyne	SLC6A1	85	39
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccc(F)cc3)oc2=O)C1	ZINC000819287412	DD	On-Demand	Anodyne	WNT3A	47	34
O=C(O)[C@@H]1CCN(CN2C(=O)C[C@@H]2c2ccccc2)C1	ZINC000819287413	CD	On-Demand	Anodyne	SLC6A1	144	41
O=C(O)[C@@H]1CCN(CN2C(=O)C[C@H]2c2ccccc2)C1	ZINC000819287414	CD	On-Demand	Anodyne	SLC6A1	144	41
O=C(O)[C@H]1CCN(CN2C(=O)C[C@@H]2c2ccccc2)C1	ZINC000819287415	CD	On-Demand	Anodyne	SLC6A1	144	41
O=C(O)[C@H]1CCN(CN2C(=O)C[C@H]2c2ccccc2)C1	ZINC000819287416	CD	On-Demand	Anodyne	SLC6A1	144	41
O=C(O)[C@@H]1CCN(CCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819287417	DD	On-Demand	Anodyne	DRD2	21	44
O=C(O)[C@@H]1CCN(CCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819287417	DD	On-Demand	Anodyne	HTR2A	37	47
O=C(O)[C@@H]1CCN(CCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819287417	DD	On-Demand	Anodyne	HTR2C	19	47
O=C(O)[C@@H]1CCN(CCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819287417	DD	On-Demand	Anodyne	SLC6A1	162	45
O=C(O)[C@@H]1CCN(CCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819287417	DD	On-Demand	Anodyne	HTR7	21	41
O=C(O)[C@@H]1CCN(CCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819287417	DD	On-Demand	Anodyne	SIGMAR1	19	46
O=C(O)[C@@H]1CCN(CCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819287417	DD	On-Demand	Anodyne	CCR5	21	43
O=C(O)[C@H]1CCN(CCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819287418	DD	On-Demand	Anodyne	DRD2	21	44
O=C(O)[C@H]1CCN(CCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819287418	DD	On-Demand	Anodyne	HTR2A	37	47
O=C(O)[C@H]1CCN(CCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819287418	DD	On-Demand	Anodyne	HTR2C	19	47
O=C(O)[C@H]1CCN(CCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819287418	DD	On-Demand	Anodyne	SLC6A1	162	45
O=C(O)[C@H]1CCN(CCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819287418	DD	On-Demand	Anodyne	HTR7	21	41
O=C(O)[C@H]1CCN(CCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819287418	DD	On-Demand	Anodyne	SIGMAR1	19	46
O=C(O)[C@H]1CCN(CCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819287418	DD	On-Demand	Anodyne	CCR5	21	43
O=C(O)[C@@H]1CCN(Cc2nc(O)c3ccc(C(F)(F)F)cc3n2)C1	ZINC000819287419	EE	On-Demand	Anodyne	SLC6A1	57	36
O=C(O)[C@@H]1CCN(Cc2nc(O)c3ccc(C(F)(F)F)cc3n2)C1	ZINC000819287419	EE	On-Demand	Anodyne	LIPG	51	34
O=C(O)[C@H]1CCN(Cc2nc(O)c3ccc(C(F)(F)F)cc3n2)C1	ZINC000819287420	EE	On-Demand	Anodyne	SLC6A1	57	36
O=C(O)[C@H]1CCN(Cc2nc(O)c3ccc(C(F)(F)F)cc3n2)C1	ZINC000819287420	EE	On-Demand	Anodyne	LIPG	51	34
O=C(O)[C@@H]1CCN(CN2C(=O)CN(/C=C\c3ccccc3)C2=O)C1	ZINC000819287423	ED	On-Demand	Anodyne	SLC6A1	125	37
O=C(O)[C@H]1CCN(CN2C(=O)CN(/C=C/c3ccccc3)C2=O)C1	ZINC000819287424	ED	On-Demand	Anodyne	SLC6A1	125	37
O=C(O)[C@H]1CCN(CN2C(=O)CN(/C=C\c3ccccc3)C2=O)C1	ZINC000819287425	ED	On-Demand	Anodyne	SLC6A1	125	37
O=C(O)[C@@H]1CCN(CN2C(=O)CN(/C=C/c3ccccc3)C2=O)C1	ZINC000819287426	ED	On-Demand	Anodyne	SLC6A1	125	37
O=C(O)[C@H]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000819287427	DD	On-Demand	Bother	SLC6A1	45	34
O=C(O)[C@H]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000819287427	DD	On-Demand	Bother	S1PR4	26	46
O=C(O)[C@H]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000819287427	DD	On-Demand	Bother	S1PR1	26	46
O=C(O)[C@H]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000819287427	DD	On-Demand	Bother	S1PR5	43	45
O=C(O)[C@@H]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000819287428	DD	On-Demand	Bother	SLC6A1	45	34
O=C(O)[C@@H]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000819287428	DD	On-Demand	Bother	S1PR4	26	46
O=C(O)[C@@H]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000819287428	DD	On-Demand	Bother	S1PR1	26	46
O=C(O)[C@@H]1CCN(Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1	ZINC000819287428	DD	On-Demand	Bother	S1PR5	43	45
O=C(O)[C@@H]1CCN(CCS(=O)(=O)c2ccccc2)C1	ZINC000819287429	CC	On-Demand	Anodyne	SLC6A1	178	47
O=C(O)[C@@H]1CCN(CCS(=O)(=O)c2ccccc2)C1	ZINC000819287429	CC	On-Demand	Anodyne	CCR5	48	38
O=C(O)[C@@H]1CCN(CCS(=O)(=O)c2ccccc2)C1	ZINC000819287429	CC	On-Demand	Anodyne	CYP2J2	45	31
O=C(O)[C@H]1CCN(CCS(=O)(=O)c2ccccc2)C1	ZINC000819287430	CC	On-Demand	Anodyne	SLC6A1	178	47
O=C(O)[C@H]1CCN(CCS(=O)(=O)c2ccccc2)C1	ZINC000819287430	CC	On-Demand	Anodyne	CCR5	48	38
O=C(O)[C@H]1CCN(CCS(=O)(=O)c2ccccc2)C1	ZINC000819287430	CC	On-Demand	Anodyne	CYP2J2	45	31
O=C(O)[C@@H]1CCN(CN2CCSC2=S)C1	ZINC000819287432	BC	On-Demand	Anodyne	SLC6A1	87	35
O=C(O)[C@H]1CCN(CN2CCSC2=S)C1	ZINC000819287433	BC	On-Demand	Anodyne	SLC6A1	87	35
O=C(O)[C@@H]1CCN(CN2C(=O)c3cc(Cl)c(Cl)cc3C2=O)C1	ZINC000819287434	ED	On-Demand	Anodyne	SLC6A1	100	39
O=C(O)[C@H]1CCN(CN2C(=O)c3cc(Cl)c(Cl)cc3C2=O)C1	ZINC000819287435	ED	On-Demand	Anodyne	SLC6A1	100	39
O=C(O)[C@@H]1CCN(CN2C[C@H](O)CC2=O)C1	ZINC000819287437	BA	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)[C@H]1CCN(CN2C[C@H](O)CC2=O)C1	ZINC000819287438	BA	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)[C@@H]1CCN(CN2C[C@@H](O)CC2=O)C1	ZINC000819287439	BA	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)[C@H]1CCN(CN2C[C@@H](O)CC2=O)C1	ZINC000819287440	BA	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3)c3ccccc3c2=O)C1	ZINC000819287441	EE	On-Demand	Anodyne	SLC6A1	112	38
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3)c3ccccc3c2=O)C1	ZINC000819287442	EE	On-Demand	Anodyne	SLC6A1	112	38
O=C(O)[C@@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287445	CC	On-Demand	Anodyne	HTR1A	15	45
O=C(O)[C@@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287445	CC	On-Demand	Anodyne	HTR2A	28	41
O=C(O)[C@@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287445	CC	On-Demand	Anodyne	SLC6A1	179	45
O=C(O)[C@@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287445	CC	On-Demand	Anodyne	TBXA2R	26	42
O=C(O)[C@@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287445	CC	On-Demand	Anodyne	HTR7	55	57
O=C(O)[C@@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287445	CC	On-Demand	Anodyne	SIGMAR1	31	48
O=C(O)[C@@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287445	CC	On-Demand	Anodyne	CCR5	48	37
O=C(O)[C@@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287445	CC	On-Demand	Anodyne	AKR1C3	17	43
O=C(O)[C@@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287445	CC	On-Demand	Anodyne	SFRP1	114	40
O=C(O)[C@@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287445	CC	On-Demand	Anodyne	WNT3	73	35
O=C(O)[C@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287446	CC	On-Demand	Anodyne	HTR1A	15	45
O=C(O)[C@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287446	CC	On-Demand	Anodyne	HTR2A	28	41
O=C(O)[C@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287446	CC	On-Demand	Anodyne	SLC6A1	179	45
O=C(O)[C@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287446	CC	On-Demand	Anodyne	TBXA2R	26	42
O=C(O)[C@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287446	CC	On-Demand	Anodyne	HTR7	55	57
O=C(O)[C@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287446	CC	On-Demand	Anodyne	SIGMAR1	31	48
O=C(O)[C@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287446	CC	On-Demand	Anodyne	CCR5	48	37
O=C(O)[C@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287446	CC	On-Demand	Anodyne	AKR1C3	17	43
O=C(O)[C@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287446	CC	On-Demand	Anodyne	SFRP1	114	40
O=C(O)[C@H]1CCN(CCNS(=O)(=O)c2ccccc2)C1	ZINC000819287446	CC	On-Demand	Anodyne	WNT3	73	35
O=C(O)[C@@H]1CCN(Cc2nc(Cc3ccccc3)no2)C1	ZINC000819287447	CD	On-Demand	Anodyne	SLC6A1	129	41
O=C(O)[C@@H]1CCN(Cc2nc(Cc3ccccc3)no2)C1	ZINC000819287447	CD	On-Demand	Anodyne	CCR5	18	43
O=C(O)[C@@H]1CCN(Cc2nc(Cc3ccccc3)no2)C1	ZINC000819287447	CD	On-Demand	Anodyne	S1PR4	20	43
O=C(O)[C@@H]1CCN(Cc2nc(Cc3ccccc3)no2)C1	ZINC000819287447	CD	On-Demand	Anodyne	S1PR1	36	43
O=C(O)[C@@H]1CCN(Cc2nc(Cc3ccccc3)no2)C1	ZINC000819287447	CD	On-Demand	Anodyne	S1PR5	40	43
O=C(O)[C@H]1CCN(Cc2nc(Cc3ccccc3)no2)C1	ZINC000819287448	CD	On-Demand	Anodyne	SLC6A1	129	41
O=C(O)[C@H]1CCN(Cc2nc(Cc3ccccc3)no2)C1	ZINC000819287448	CD	On-Demand	Anodyne	CCR5	18	43
O=C(O)[C@H]1CCN(Cc2nc(Cc3ccccc3)no2)C1	ZINC000819287448	CD	On-Demand	Anodyne	S1PR4	20	43
O=C(O)[C@H]1CCN(Cc2nc(Cc3ccccc3)no2)C1	ZINC000819287448	CD	On-Demand	Anodyne	S1PR1	36	43
O=C(O)[C@H]1CCN(Cc2nc(Cc3ccccc3)no2)C1	ZINC000819287448	CD	On-Demand	Anodyne	S1PR5	40	43
O=C(O)[C@@H]1CCN(Cn2c(=O)oc3cc(Cl)ccc32)C1	ZINC000819287450	CD	On-Demand	Anodyne	SLC6A1	75	36
O=C(O)[C@H]1CCN(Cn2c(=O)oc3cc(Cl)ccc32)C1	ZINC000819287452	CD	On-Demand	Anodyne	SLC6A1	75	36
O=C(O)C1CCN(Cn2c(-c3ccccc3)csc2=S)CC1	ZINC000819287454	EH	On-Demand	Anodyne	SLC6A1	85	34
O=C(O)C1CCN(Cc2nc3cc(C(F)(F)F)ccc3o2)CC1	ZINC000819287456	EG	On-Demand	Anodyne	S1PR1	17	47
O=C(O)C1CCN(Cc2nc3cc(C(F)(F)F)ccc3o2)CC1	ZINC000819287456	EG	On-Demand	Anodyne	LIPG	54	40
O=C(O)C1CCN(Cc2nc3cc(C(F)(F)F)ccc3o2)CC1	ZINC000819287456	EG	On-Demand	Anodyne	PTGES	23	49
O=C(O)[C@@H]1CCN(Cc2ccc(S(=O)(=O)N3CCCC3)o2)C1	ZINC000819287457	EC	On-Demand	Anodyne	SLC6A1	124	38
O=C(O)[C@@H]1CCN(Cc2ccc(S(=O)(=O)N3CCCC3)o2)C1	ZINC000819287457	EC	On-Demand	Anodyne	LPL	44	35
O=C(O)[C@H]1CCN(Cc2ccc(S(=O)(=O)N3CCCC3)o2)C1	ZINC000819287459	EC	On-Demand	Anodyne	SLC6A1	124	38
O=C(O)[C@H]1CCN(Cc2ccc(S(=O)(=O)N3CCCC3)o2)C1	ZINC000819287459	EC	On-Demand	Anodyne	LPL	44	35
O=C(O)[C@@H]1CCN(Cc2c(-c3ccccc3)nc3sccn23)C1	ZINC000819287460	EF	On-Demand	Anodyne	SLC6A1	123	39
O=C(O)[C@@H]1CCN(Cc2c(-c3ccccc3)nc3sccn23)C1	ZINC000819287460	EF	On-Demand	Anodyne	S1PR4	15	42
O=C(O)[C@@H]1CCN(Cc2c(-c3ccccc3)nc3sccn23)C1	ZINC000819287460	EF	On-Demand	Anodyne	S1PR1	28	42
O=C(O)[C@@H]1CCN(Cc2c(-c3ccccc3)nc3sccn23)C1	ZINC000819287460	EF	On-Demand	Anodyne	S1PR5	34	42
O=C(O)[C@H]1CCN(Cc2c(-c3ccccc3)nc3sccn23)C1	ZINC000819287461	EF	On-Demand	Anodyne	SLC6A1	123	39
O=C(O)[C@H]1CCN(Cc2c(-c3ccccc3)nc3sccn23)C1	ZINC000819287461	EF	On-Demand	Anodyne	S1PR4	15	42
O=C(O)[C@H]1CCN(Cc2c(-c3ccccc3)nc3sccn23)C1	ZINC000819287461	EF	On-Demand	Anodyne	S1PR1	28	42
O=C(O)[C@H]1CCN(Cc2c(-c3ccccc3)nc3sccn23)C1	ZINC000819287461	EF	On-Demand	Anodyne	S1PR5	34	42
O=C(O)[C@@H]1CCN(CN2C(=O)CN(c3ccccc3)C2=O)C1	ZINC000819287462	DC	On-Demand	Anodyne	SLC6A1	137	40
O=C(O)[C@H]1CCN(CN2C(=O)CN(c3ccccc3)C2=O)C1	ZINC000819287463	DC	On-Demand	Anodyne	SLC6A1	137	40
O=C(O)[C@@H]1CCN(Cc2cccc(Cl)n2)C1	ZINC000819287464	BD	On-Demand	Anodyne	SLC6A1	152	41
O=C(O)[C@@H]1CCN(Cc2cccc(Cl)n2)C1	ZINC000819287464	BD	On-Demand	Anodyne	S1PR1	26	48
O=C(O)[C@H]1CCN(Cc2cccc(Cl)n2)C1	ZINC000819287466	BD	On-Demand	Anodyne	SLC6A1	152	41
O=C(O)[C@H]1CCN(Cc2cccc(Cl)n2)C1	ZINC000819287466	BD	On-Demand	Anodyne	S1PR1	26	48
O=C(O)[C@@H]1CCN(Cn2c(=O)oc3ccccc32)C1	ZINC000819287468	CC	On-Demand	Anodyne	SLC6A1	139	38
O=C(O)[C@@H]1CCN(Cn2c(=O)oc3ccccc32)C1	ZINC000819287468	CC	On-Demand	Anodyne	SIGMAR1	24	54
O=C(O)[C@H]1CCN(Cn2c(=O)oc3ccccc32)C1	ZINC000819287469	CC	On-Demand	Anodyne	SLC6A1	139	38
O=C(O)[C@H]1CCN(Cn2c(=O)oc3ccccc32)C1	ZINC000819287469	CC	On-Demand	Anodyne	SIGMAR1	24	54
O=C(O)[C@@H]1CCN(CN2C(=O)c3ccc(F)cc3C2=O)C1	ZINC000819287471	CC	On-Demand	Anodyne	SLC6A1	138	45
O=C(O)[C@@H]1CCN(CN2C(=O)c3ccc(F)cc3C2=O)C1	ZINC000819287471	CC	On-Demand	Anodyne	S1PR1	21	40
O=C(O)[C@H]1CCN(CN2C(=O)c3ccc(F)cc3C2=O)C1	ZINC000819287473	CC	On-Demand	Anodyne	SLC6A1	138	45
O=C(O)[C@H]1CCN(CN2C(=O)c3ccc(F)cc3C2=O)C1	ZINC000819287473	CC	On-Demand	Anodyne	S1PR1	21	40
O=C(O)[C@@H]1CCN(CN2C(=O)C(=O)N(Cc3cccs3)C2=O)C1	ZINC000819287478	EC	On-Demand	Anodyne	SLC6A1	88	36
O=C(O)[C@H]1CCN(CN2C(=O)C(=O)N(Cc3cccs3)C2=O)C1	ZINC000819287480	EC	On-Demand	Anodyne	SLC6A1	88	36
O=C(O)[C@@H]1CCN(Cc2nc(O)c3cc(-c4ccccc4)sc3n2)C1	ZINC000819287482	FF	On-Demand	Anodyne	SLC6A1	114	35
O=C(O)[C@@H]1CCN(Cc2nc(O)c3cc(-c4ccccc4)sc3n2)C1	ZINC000819287482	FF	On-Demand	Anodyne	S1PR1	36	42
O=C(O)[C@H]1CCN(Cc2nc(O)c3cc(-c4ccccc4)sc3n2)C1	ZINC000819287484	FF	On-Demand	Anodyne	SLC6A1	114	35
O=C(O)[C@H]1CCN(Cc2nc(O)c3cc(-c4ccccc4)sc3n2)C1	ZINC000819287484	FF	On-Demand	Anodyne	S1PR1	36	42
N#Cc1ccc(C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)o1	ZINC000819287516	GI	On-Demand	Mild	CSF1R	20	40
C#CCN1CCC(C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)CC1	ZINC000819287561	HI	On-Demand	Mild	SIGMAR1	21	48
C#CCN1CCC(C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)CC1	ZINC000819287561	HI	On-Demand	Mild	MCHR1	28	42
O=S(=O)(NCCNC[C@H](O)c1cccc(Cl)c1)c1ccc(F)cc1F	ZINC000819287563	GE	On-Demand	Anodyne	ADRB1	43	48
O=S(=O)(NCCNC[C@H](O)c1cccc(Cl)c1)c1ccc(F)cc1F	ZINC000819287563	GE	On-Demand	Anodyne	ADRB3	73	48
O=S(=O)(NCCNC[C@@H](O)c1cccc(Cl)c1)c1ccc(F)cc1F	ZINC000819287565	GE	On-Demand	Anodyne	ADRB1	43	48
O=S(=O)(NCCNC[C@@H](O)c1cccc(Cl)c1)c1ccc(F)cc1F	ZINC000819287565	GE	On-Demand	Anodyne	ADRB3	73	48
O=C(Nc1nc2ccc(Cl)cc2n1Cc1ccccc1)c1cccnc1S	ZINC000819287573	GJ	On-Demand	Anodyne	NR2E3	44	33
O=C(NC1CCN(Cc2cccnc2)CC1)C(F)=C1CCC1	ZINC000819287579	DF	On-Demand	Anodyne	DRD4	23	57
O=C(NC1CCN(Cc2cccnc2)CC1)C(F)=C1CCC1	ZINC000819287579	DF	On-Demand	Anodyne	ACHE	19	43
O=C(NC1CCN(Cc2cccnc2)CC1)C(F)=C1CCC1	ZINC000819287579	DF	On-Demand	Anodyne	SIGMAR1	28	46
O=C(NC1CCN(Cc2cccnc2)CC1)C(F)=C1CCC1	ZINC000819287579	DF	On-Demand	Anodyne	SSTR5	48	38
O=C(NC1CCN(Cc2cccnc2)CC1)C(F)=C1CCC1	ZINC000819287579	DF	On-Demand	Anodyne	CCR3	18	41
O=C(NC1CCN(Cc2cccnc2)CC1)C(F)=C1CCC1	ZINC000819287579	DF	On-Demand	Anodyne	CHRNA7	51	39
O=C(NC1CCN(Cc2cccnc2)CC1)C(F)=C1CCC1	ZINC000819287579	DF	On-Demand	Anodyne	C3AR1	46	44
O=C(NC1CCN(Cc2cccnc2)CC1)C(F)=C1CCC1	ZINC000819287579	DF	On-Demand	Anodyne	MCHR1	36	45
O=C(NC1CCN(Cc2cccnc2)CC1)C(F)=C1CCC1	ZINC000819287579	DF	On-Demand	Anodyne	CACNA1G	16	40
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1ccc(Cl)cc1F	ZINC000819287598	FE	On-Demand	Anodyne	ADRB2	17	41
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1ccc(Cl)cc1F	ZINC000819287598	FE	On-Demand	Anodyne	ADRB1	37	44
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1ccc(Cl)cc1F	ZINC000819287598	FE	On-Demand	Anodyne	ADRB3	79	44
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1ccc(Cl)cc1F	ZINC000819287600	FE	On-Demand	Anodyne	ADRB2	17	41
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1ccc(Cl)cc1F	ZINC000819287600	FE	On-Demand	Anodyne	ADRB1	37	44
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1ccc(Cl)cc1F	ZINC000819287600	FE	On-Demand	Anodyne	ADRB3	79	44
O=C(c1ccc(C(F)(F)F)nc1)N1C[C@H](NC(=O)C(F)(F)F)CC[C@@H]1C(F)(F)F	ZINC000819287606	IG	On-Demand	Mild	SFRP1	18	41
O=C(c1ccc(C(F)(F)F)nc1)N1C[C@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F	ZINC000819287610	IG	On-Demand	Mild	SFRP1	18	41
O=C(c1ccc(C(F)(F)F)nc1)N1C[C@@H](NC(=O)C(F)(F)F)CC[C@@H]1C(F)(F)F	ZINC000819287612	IG	On-Demand	Mild	SFRP1	18	41
O=C(c1ccc(C(F)(F)F)nc1)N1C[C@@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F	ZINC000819287614	IG	On-Demand	Mild	SFRP1	18	41
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1)N1CCCCC1	ZINC000819287645	FF	On-Demand	Anodyne	ADRB3	25	40
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1)N1CCCCC1	ZINC000819287645	FF	On-Demand	Anodyne	PREP	42	37
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1)N1CCCCC1	ZINC000819287647	FF	On-Demand	Anodyne	ADRB3	25	40
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1)N1CCCCC1	ZINC000819287647	FF	On-Demand	Anodyne	PREP	42	37
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1)N1CCCCC1	ZINC000819287669	FG	On-Demand	Anodyne	OPRL1	40	39
C[C@@H]1NC(=O)CC[C@@H]1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819287690	FD	On-Demand	Anodyne	GPR119	33	41
C[C@@H]1NC(=O)CC[C@H]1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819287692	FD	On-Demand	Anodyne	GPR119	33	41
C[C@@H]1NC(=O)CC[C@H]1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819287694	FD	On-Demand	Anodyne	GPR119	33	41
C[C@@H]1NC(=O)CC[C@@H]1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819287696	FD	On-Demand	Anodyne	GPR119	33	41
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287711	FG	On-Demand	Anodyne	DRD4	23	55
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287711	FG	On-Demand	Anodyne	SIGMAR1	18	49
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287711	FG	On-Demand	Anodyne	CCR3	24	45
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287711	FG	On-Demand	Anodyne	MLNR	22	42
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287711	FG	On-Demand	Anodyne	CCR2	32	46
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287711	FG	On-Demand	Anodyne	SLC6A5	33	44
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287711	FG	On-Demand	Anodyne	MCHR1	37	44
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287712	FG	On-Demand	Anodyne	DRD4	23	55
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287712	FG	On-Demand	Anodyne	SIGMAR1	18	49
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287712	FG	On-Demand	Anodyne	CCR3	24	45
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287712	FG	On-Demand	Anodyne	MLNR	22	42
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287712	FG	On-Demand	Anodyne	CCR2	32	46
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287712	FG	On-Demand	Anodyne	SLC6A5	33	44
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287712	FG	On-Demand	Anodyne	MCHR1	37	44
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287714	FG	On-Demand	Anodyne	DRD4	23	55
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287714	FG	On-Demand	Anodyne	SIGMAR1	18	49
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287714	FG	On-Demand	Anodyne	CCR3	24	45
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287714	FG	On-Demand	Anodyne	MLNR	22	42
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287714	FG	On-Demand	Anodyne	CCR2	32	46
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287714	FG	On-Demand	Anodyne	SLC6A5	33	44
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287714	FG	On-Demand	Anodyne	MCHR1	37	44
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]2C2CC2)cc1	ZINC000819287743	DE	On-Demand	Anodyne	ADRB2	45	59
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]2C2CC2)cc1	ZINC000819287743	DE	On-Demand	Anodyne	ADRB1	70	59
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H]2C2CC2)cc1	ZINC000819287743	DE	On-Demand	Anodyne	ADRB3	47	43
COCCc1ccc(OC[C@H](O)CN[C@H]2CC[C@H]2C2CC2)cc1	ZINC000819287744	DE	On-Demand	Anodyne	ADRB2	45	59
COCCc1ccc(OC[C@H](O)CN[C@H]2CC[C@H]2C2CC2)cc1	ZINC000819287744	DE	On-Demand	Anodyne	ADRB1	70	59
COCCc1ccc(OC[C@H](O)CN[C@H]2CC[C@H]2C2CC2)cc1	ZINC000819287744	DE	On-Demand	Anodyne	ADRB3	47	43
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]2C2CC2)cc1	ZINC000819287745	DE	On-Demand	Anodyne	ADRB2	45	59
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]2C2CC2)cc1	ZINC000819287745	DE	On-Demand	Anodyne	ADRB1	70	59
COCCc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H]2C2CC2)cc1	ZINC000819287745	DE	On-Demand	Anodyne	ADRB3	47	43
COCCc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H]2C2CC2)cc1	ZINC000819287746	DE	On-Demand	Anodyne	ADRB2	45	59
COCCc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H]2C2CC2)cc1	ZINC000819287746	DE	On-Demand	Anodyne	ADRB1	70	59
COCCc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H]2C2CC2)cc1	ZINC000819287746	DE	On-Demand	Anodyne	ADRB3	47	43
CO[C@H](CNC(=O)CCc1cccc(OC(F)F)c1)C(F)(F)F	ZINC000819287748	EF	On-Demand	Anodyne	MTNR1A	17	42
CO[C@H](CNC(=O)CCc1cccc(OC(F)F)c1)C(F)(F)F	ZINC000819287748	EF	On-Demand	Anodyne	MTNR1B	17	42
O=C([C@@H]1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1)N1CCCCC1	ZINC000819287767	EF	On-Demand	Anodyne	SLC6A3	19	46
O=C([C@@H]1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1)N1CCCCC1	ZINC000819287768	EF	On-Demand	Anodyne	SLC6A3	19	46
COCCS(=O)(=O)c1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1	ZINC000819287771	ED	On-Demand	Anodyne	F13A1	51	32
COCCS(=O)(=O)c1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1	ZINC000819287772	ED	On-Demand	Anodyne	F13A1	51	32
COCCS(=O)(=O)c1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1	ZINC000819287773	ED	On-Demand	Anodyne	F13A1	51	32
COCCS(=O)(=O)c1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1	ZINC000819287774	ED	On-Demand	Anodyne	F13A1	51	32
C#CCCNC(=O)[C@@H](CC)Cc1ccccc1C	ZINC000819287789	BF	On-Demand	Mild	MME	24	40
C#CCCNC(=O)[C@@H](CC)Cc1ccccc1C	ZINC000819287789	BF	On-Demand	Mild	AMP1_PLAFQ	18	41
C#CCCNC(=O)[C@H](CC)Cc1ccccc1C	ZINC000819287790	BF	On-Demand	Mild	MME	24	40
C#CCCNC(=O)[C@H](CC)Cc1ccccc1C	ZINC000819287790	BF	On-Demand	Mild	AMP1_PLAFQ	18	41
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819287805	DF	On-Demand	Anodyne	ADRB2	15	41
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819287805	DF	On-Demand	Anodyne	ADRB1	41	46
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819287805	DF	On-Demand	Anodyne	SLC6A3	15	41
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819287805	DF	On-Demand	Anodyne	ADRB3	59	49
CCOC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819287805	DF	On-Demand	Anodyne	CYP3A4	49	38
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819287806	DF	On-Demand	Anodyne	ADRB2	15	41
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819287806	DF	On-Demand	Anodyne	ADRB1	41	46
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819287806	DF	On-Demand	Anodyne	SLC6A3	15	41
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819287806	DF	On-Demand	Anodyne	ADRB3	59	49
CCOC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819287806	DF	On-Demand	Anodyne	CYP3A4	49	38
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287816	FG	On-Demand	Anodyne	DRD4	23	55
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287816	FG	On-Demand	Anodyne	SIGMAR1	18	49
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287816	FG	On-Demand	Anodyne	CCR3	24	45
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287816	FG	On-Demand	Anodyne	MLNR	22	42
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287816	FG	On-Demand	Anodyne	CCR2	32	46
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287816	FG	On-Demand	Anodyne	SLC6A5	33	44
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819287816	FG	On-Demand	Anodyne	MCHR1	37	44
COc1cccc([S@@](=O)CC(=O)NC[C@@](C)(O)c2ccccc2)c1	ZINC000819287864	ED	On-Demand	Anodyne	MTNR1A	37	40
COc1cccc([S@@](=O)CC(=O)NC[C@@](C)(O)c2ccccc2)c1	ZINC000819287864	ED	On-Demand	Anodyne	MTNR1B	37	40
COc1cccc([S@@](=O)CC(=O)NC[C@](C)(O)c2ccccc2)c1	ZINC000819287866	ED	On-Demand	Anodyne	MTNR1A	37	40
COc1cccc([S@@](=O)CC(=O)NC[C@](C)(O)c2ccccc2)c1	ZINC000819287866	ED	On-Demand	Anodyne	MTNR1B	37	40
O[C@H](CNCCN1CCC2(CCCCC2)CC1)c1cccnc1	ZINC000819287884	DF	On-Demand	Anodyne	ADRB2	27	45
O[C@H](CNCCN1CCC2(CCCCC2)CC1)c1cccnc1	ZINC000819287884	DF	On-Demand	Anodyne	ADRB1	32	45
O[C@H](CNCCN1CCC2(CCCCC2)CC1)c1cccnc1	ZINC000819287884	DF	On-Demand	Anodyne	ADRB3	109	52
O[C@@H](CNCCN1CCC2(CCCCC2)CC1)c1cccnc1	ZINC000819287885	DF	On-Demand	Anodyne	ADRB2	27	45
O[C@@H](CNCCN1CCC2(CCCCC2)CC1)c1cccnc1	ZINC000819287885	DF	On-Demand	Anodyne	ADRB1	32	45
O[C@@H](CNCCN1CCC2(CCCCC2)CC1)c1cccnc1	ZINC000819287885	DF	On-Demand	Anodyne	ADRB3	109	52
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287910	DD	On-Demand	Anodyne	DRD4	19	55
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287910	DD	On-Demand	Anodyne	SIGMAR1	23	49
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287910	DD	On-Demand	Anodyne	SSTR5	48	36
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287910	DD	On-Demand	Anodyne	CHRNA7	48	41
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287910	DD	On-Demand	Anodyne	C3AR1	43	41
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287910	DD	On-Demand	Anodyne	MCHR1	26	41
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287911	DD	On-Demand	Anodyne	DRD4	19	55
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287911	DD	On-Demand	Anodyne	SIGMAR1	23	49
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287911	DD	On-Demand	Anodyne	SSTR5	48	36
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287911	DD	On-Demand	Anodyne	CHRNA7	48	41
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287911	DD	On-Demand	Anodyne	C3AR1	43	41
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287911	DD	On-Demand	Anodyne	MCHR1	26	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287912	DD	On-Demand	Anodyne	DRD4	19	55
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287912	DD	On-Demand	Anodyne	SIGMAR1	23	49
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287912	DD	On-Demand	Anodyne	SSTR5	48	36
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287912	DD	On-Demand	Anodyne	CHRNA7	48	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287912	DD	On-Demand	Anodyne	C3AR1	43	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287912	DD	On-Demand	Anodyne	MCHR1	26	41
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287913	DD	On-Demand	Anodyne	DRD4	19	55
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287913	DD	On-Demand	Anodyne	SIGMAR1	23	49
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287913	DD	On-Demand	Anodyne	SSTR5	48	36
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287913	DD	On-Demand	Anodyne	CHRNA7	48	41
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287913	DD	On-Demand	Anodyne	C3AR1	43	41
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cccnc2)CC1	ZINC000819287913	DD	On-Demand	Anodyne	MCHR1	26	41
CC#CC(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819287924	DH	On-Demand	Mild	ALOX5AP	21	41
CC#CC(=O)Nc1nc2ccc(Cl)cc2n1Cc1ccccc1	ZINC000819287924	DH	On-Demand	Mild	PTGES2	78	35
CCCCSCCC(=O)N1C[C@H](NC(=O)C(F)(F)F)CC[C@@H]1C(F)(F)F	ZINC000819287926	HH	On-Demand	Anodyne	EST1_PIG	45	39
CC[C@H]1c2ccccc2CCN1C(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819287929	FG	On-Demand	Anodyne	MTNR1B	17	41
CC[C@H]1c2ccccc2CCN1C(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819287930	FG	On-Demand	Anodyne	MTNR1B	17	41
CCCCSCCC(=O)N1C[C@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F	ZINC000819287931	HH	On-Demand	Anodyne	EST1_PIG	45	39
CC[C@@H]1c2ccccc2CCN1C(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819287932	FG	On-Demand	Anodyne	MTNR1B	17	41
CCCCSCCC(=O)N1C[C@@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F	ZINC000819287933	HH	On-Demand	Anodyne	EST1_PIG	45	39
CCCCSCCC(=O)N1C[C@@H](NC(=O)C(F)(F)F)CC[C@@H]1C(F)(F)F	ZINC000819287934	HH	On-Demand	Anodyne	EST1_PIG	45	39
CC[C@@H]1c2ccccc2CCN1C(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819287935	FG	On-Demand	Anodyne	MTNR1B	17	41
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000819287960	DF	On-Demand	Anodyne	DRD2	31	47
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000819287960	DF	On-Demand	Anodyne	SIGMAR1	20	46
O=C(/C=C/[C@@H]1CCCO1)NC[C@H]1CCCN1Cc1ccccc1	ZINC000819287964	DF	On-Demand	Anodyne	DRD2	31	47
O=C(/C=C/[C@@H]1CCCO1)NC[C@H]1CCCN1Cc1ccccc1	ZINC000819287964	DF	On-Demand	Anodyne	SIGMAR1	20	46
O=C(/C=C\[C@@H]1CCCO1)NC[C@H]1CCCN1Cc1ccccc1	ZINC000819287966	DF	On-Demand	Anodyne	DRD2	31	47
O=C(/C=C\[C@@H]1CCCO1)NC[C@H]1CCCN1Cc1ccccc1	ZINC000819287966	DF	On-Demand	Anodyne	SIGMAR1	20	46
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000819287967	DF	On-Demand	Anodyne	DRD2	31	47
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000819287967	DF	On-Demand	Anodyne	SIGMAR1	20	46
N#CC1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819288045	CE	On-Demand	Mild	ADRB2	22	44
N#CC1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819288045	CE	On-Demand	Mild	ADRB1	24	44
N#CC1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819288045	CE	On-Demand	Mild	ADRB3	89	44
N#CC1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819288046	CE	On-Demand	Mild	ADRB2	22	44
N#CC1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819288046	CE	On-Demand	Mild	ADRB1	24	44
N#CC1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819288046	CE	On-Demand	Mild	ADRB3	89	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCN2CCC3(CCCCC3)CC2)cc1	ZINC000819288072	GF	On-Demand	Anodyne	ADRB3	45	36
CS(=O)(=O)c1ccc([C@H](O)CNCCN2CCC3(CCCCC3)CC2)cc1	ZINC000819288075	GF	On-Demand	Anodyne	ADRB3	45	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1coc2ccccc12	ZINC000819288103	EF	On-Demand	Anodyne	INHA	61	34
O=C(NCCc1nc(-c2cccc(Cl)c2)no1)C(F)=C1CCC1	ZINC000819288108	EG	On-Demand	Anodyne	GRM5	19	47
O=C(Nc1nc2ccc(Cl)cc2n1Cc1ccccc1)c1ccc(-n2cccn2)nc1	ZINC000819288137	IJ	On-Demand	Anodyne	ITK	23	40
COc1cccc([S@@](=O)CC(=O)N[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819288193	GE	On-Demand	Anodyne	MTNR1B	17	43
COc1cccc([S@@](=O)CC(=O)N[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819288200	GE	On-Demand	Anodyne	MTNR1B	17	43
C[S@@](=O)C1(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819288205	FD	On-Demand	Anodyne	GPR119	25	41
C[S@@](=O)C1(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819288208	FD	On-Demand	Anodyne	GPR119	25	41
C[C@@](O)(CNC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F)c1ccccc1	ZINC000819288247	FH	On-Demand	Anodyne	AMY2	43	30
O=C(/C=C/c1ccc(Br)o1)Nc1nc(CC(F)(F)F)cs1	ZINC000819288257	GI	On-Demand	Anodyne	UL26	26	45
O=C(/C=C/c1ccc(Br)o1)Nc1nc(CC(F)(F)F)cs1	ZINC000819288257	GI	On-Demand	Anodyne	SCAF_EBVB9	24	45
O=C(/C=C\c1ccc(Br)o1)Nc1nc(CC(F)(F)F)cs1	ZINC000819288258	GI	On-Demand	Anodyne	UL26	26	45
O=C(/C=C\c1ccc(Br)o1)Nc1nc(CC(F)(F)F)cs1	ZINC000819288258	GI	On-Demand	Anodyne	SCAF_EBVB9	24	45
O=S(=O)(NCCNC[C@H](O)c1ccc(F)cc1)c1ccc(Cl)cc1F	ZINC000819288291	GE	On-Demand	Anodyne	ADRB1	19	41
O=S(=O)(NCCNC[C@@H](O)c1ccc(F)cc1)c1ccc(Cl)cc1F	ZINC000819288293	GE	On-Demand	Anodyne	ADRB1	19	41
O=C(Nc1nc(CC(F)(F)F)cs1)c1cccc(CN2C(=O)CSC2=O)c1	ZINC000819288314	HH	On-Demand	Anodyne	MPL	42	34
O=C(Nc1nc(CC(F)(F)F)cs1)c1cccc(CN2C(=O)CSC2=O)c1	ZINC000819288314	HH	On-Demand	Anodyne	CPT1A	18	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cc(C(C)C)no1)C2	ZINC000819288357	EE	On-Demand	Anodyne	SLC5A7	26	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cc(C(C)C)no1)C2	ZINC000819288359	EE	On-Demand	Anodyne	SLC5A7	26	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)C2	ZINC000819288403	GF	On-Demand	Anodyne	DRD2	41	49
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)C2	ZINC000819288403	GF	On-Demand	Anodyne	SLC6A3	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)C2	ZINC000819288403	GF	On-Demand	Anodyne	LTA4H	16	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)C2	ZINC000819288403	GF	On-Demand	Anodyne	SIGMAR1	23	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)C2	ZINC000819288406	GF	On-Demand	Anodyne	DRD2	41	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)C2	ZINC000819288406	GF	On-Demand	Anodyne	SLC6A3	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)C2	ZINC000819288406	GF	On-Demand	Anodyne	LTA4H	16	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)C2	ZINC000819288406	GF	On-Demand	Anodyne	SIGMAR1	23	49
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCCN1Cc1ccccc1)C2	ZINC000819288408	GF	On-Demand	Anodyne	DRD2	41	49
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCCN1Cc1ccccc1)C2	ZINC000819288408	GF	On-Demand	Anodyne	SLC6A3	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCCN1Cc1ccccc1)C2	ZINC000819288408	GF	On-Demand	Anodyne	LTA4H	16	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCCN1Cc1ccccc1)C2	ZINC000819288408	GF	On-Demand	Anodyne	SIGMAR1	23	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCCN1Cc1ccccc1)C2	ZINC000819288410	GF	On-Demand	Anodyne	DRD2	41	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCCN1Cc1ccccc1)C2	ZINC000819288410	GF	On-Demand	Anodyne	SLC6A3	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCCN1Cc1ccccc1)C2	ZINC000819288410	GF	On-Demand	Anodyne	LTA4H	16	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCCN1Cc1ccccc1)C2	ZINC000819288410	GF	On-Demand	Anodyne	SIGMAR1	23	49
C[C@H]1CCCCCN1C(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819288439	GG	On-Demand	Anodyne	PREP	15	40
C[C@H]1CCCCCN1C(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819288441	GG	On-Demand	Anodyne	PREP	15	40
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1ccc(F)cc1F	ZINC000819288473	FD	On-Demand	Anodyne	ADRB2	18	42
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1ccc(F)cc1F	ZINC000819288473	FD	On-Demand	Anodyne	ADRB1	25	46
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1ccc(F)cc1F	ZINC000819288473	FD	On-Demand	Anodyne	ADRB3	68	40
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1ccc(F)cc1F	ZINC000819288474	FD	On-Demand	Anodyne	ADRB2	18	42
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1ccc(F)cc1F	ZINC000819288474	FD	On-Demand	Anodyne	ADRB1	25	46
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1ccc(F)cc1F	ZINC000819288474	FD	On-Demand	Anodyne	ADRB3	68	40
O=C(NC[C@H]1CCCN1Cc1ccccc1)C(F)=C1CCC1	ZINC000819288480	DG	On-Demand	Anodyne	DRD2	37	48
O=C(NC[C@H]1CCCN1Cc1ccccc1)C(F)=C1CCC1	ZINC000819288480	DG	On-Demand	Anodyne	LTA4H	17	41
O=C(NC[C@H]1CCCN1Cc1ccccc1)C(F)=C1CCC1	ZINC000819288480	DG	On-Demand	Anodyne	SIGMAR1	27	49
O=C(Nc1nc2ccc(Cl)cc2n1Cc1ccccc1)c1ccc(F)nc1	ZINC000819288491	GJ	On-Demand	Anodyne	ITK	15	40
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819288492	HH	On-Demand	Anodyne	PAPA1_CARPA	33	48
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819288492	HH	On-Demand	Anodyne	FPR1	44	46
COc1cccc([C@H](O)C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819288512	EF	On-Demand	Anodyne	ROCK1	22	46
COc1cccc([C@H](O)C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819288512	EF	On-Demand	Anodyne	ROCK2	19	46
O=C(Nc1nc2ccc(Cl)cc2n1Cc1ccccc1)c1ccc(N2CCOC2=O)cc1	ZINC000819288575	IJ	On-Demand	Anodyne	ITK	31	40
O=C1N[C@H](C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)CS1	ZINC000819288588	GH	On-Demand	Anodyne	PDE6D	47	31
O=C1N[C@H](C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)CS1	ZINC000819288588	GH	On-Demand	Anodyne	MCHR1	17	40
Cn1cnc2cc(C(=O)N3C[C@@H](NC(=O)C(F)(F)F)CC[C@H]3C(F)(F)F)ccc21	ZINC000819288606	HF	On-Demand	Anodyne	HPGD	45	38
Cn1cnc2cc(C(=O)N3C[C@@H](NC(=O)C(F)(F)F)CC[C@@H]3C(F)(F)F)ccc21	ZINC000819288607	HF	On-Demand	Anodyne	HPGD	45	38
Cn1cnc2cc(C(=O)N3C[C@H](NC(=O)C(F)(F)F)CC[C@H]3C(F)(F)F)ccc21	ZINC000819288608	HF	On-Demand	Anodyne	HPGD	45	38
Cn1cnc2cc(C(=O)N3C[C@H](NC(=O)C(F)(F)F)CC[C@@H]3C(F)(F)F)ccc21	ZINC000819288609	HF	On-Demand	Anodyne	HPGD	45	38
O=C(Nc1nc2ccc(Cl)cc2n1Cc1ccccc1)c1ncccn1	ZINC000819288628	FH	On-Demand	Anodyne	IMDH_CRYPV	21	40
O=C(c1coc2ccccc12)N1C[C@H](NC(=O)C(F)(F)F)CC[C@@H]1C(F)(F)F	ZINC000819288629	HH	On-Demand	Anodyne	INHA	88	44
O=C(c1coc2ccccc12)N1C[C@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F	ZINC000819288630	HH	On-Demand	Anodyne	INHA	88	44
O=C(c1coc2ccccc12)N1C[C@@H](NC(=O)C(F)(F)F)CC[C@@H]1C(F)(F)F	ZINC000819288631	HH	On-Demand	Anodyne	INHA	88	44
O=C(c1coc2ccccc12)N1C[C@@H](NC(=O)C(F)(F)F)CC[C@H]1C(F)(F)F	ZINC000819288632	HH	On-Demand	Anodyne	INHA	88	44
C[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819288710	IK	On-Demand	Anodyne	REN	51	37
C[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819288710	IK	On-Demand	Anodyne	FPR1	44	36
C[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819288711	IK	On-Demand	Anodyne	REN	51	37
C[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819288711	IK	On-Demand	Anodyne	FPR1	44	36
C[C@H](C(=O)Nc1nc(CC(F)(F)F)cs1)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819288712	IK	On-Demand	Anodyne	REN	51	37
C[C@H](C(=O)Nc1nc(CC(F)(F)F)cs1)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819288712	IK	On-Demand	Anodyne	FPR1	44	36
C[C@H](C(=O)Nc1nc(CC(F)(F)F)cs1)[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819288713	IK	On-Demand	Anodyne	REN	51	37
C[C@H](C(=O)Nc1nc(CC(F)(F)F)cs1)[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819288713	IK	On-Demand	Anodyne	FPR1	44	36
O=C(Nc1nc(CC(F)(F)F)cs1)c1cccc(F)n1	ZINC000819288837	DG	On-Demand	Anodyne	MPL	53	35
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(CS(=O)(=O)C(F)F)cc1	ZINC000819288857	HH	On-Demand	Anodyne	MPL	51	35
Cn1c(C(=O)N2C[C@H](NC(=O)C(F)(F)F)CC[C@@H]2C(F)(F)F)cc2ccccc21	ZINC000819288870	HG	On-Demand	Anodyne	GLRA1	15	40
Cn1c(C(=O)N2C[C@@H](NC(=O)C(F)(F)F)CC[C@H]2C(F)(F)F)cc2ccccc21	ZINC000819288871	HG	On-Demand	Anodyne	GLRA1	15	40
Cn1c(C(=O)N2C[C@H](NC(=O)C(F)(F)F)CC[C@H]2C(F)(F)F)cc2ccccc21	ZINC000819288872	HG	On-Demand	Anodyne	GLRA1	15	40
Cn1c(C(=O)N2C[C@@H](NC(=O)C(F)(F)F)CC[C@@H]2C(F)(F)F)cc2ccccc21	ZINC000819288873	HG	On-Demand	Anodyne	GLRA1	15	40
O=C1CC[C@H](C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)CCN1	ZINC000819288897	GH	On-Demand	Anodyne	PDE6D	42	32
O=C1CC[C@@H](C(=O)Nc2nc3ccc(Cl)cc3n2Cc2ccccc2)CCN1	ZINC000819288898	GH	On-Demand	Anodyne	PDE6D	42	32
O[C@H](CNCC1CCC(F)(F)CC1)c1cccnc1	ZINC000819288920	CF	On-Demand	Anodyne	ADRB2	21	42
O[C@H](CNCC1CCC(F)(F)CC1)c1cccnc1	ZINC000819288920	CF	On-Demand	Anodyne	ADRB1	23	43
O[C@H](CNCC1CCC(F)(F)CC1)c1cccnc1	ZINC000819288920	CF	On-Demand	Anodyne	ADRB3	89	46
O[C@@H](CNCC1CCC(F)(F)CC1)c1cccnc1	ZINC000819288921	CF	On-Demand	Anodyne	ADRB2	21	42
O[C@@H](CNCC1CCC(F)(F)CC1)c1cccnc1	ZINC000819288921	CF	On-Demand	Anodyne	ADRB1	23	43
O[C@@H](CNCC1CCC(F)(F)CC1)c1cccnc1	ZINC000819288921	CF	On-Demand	Anodyne	ADRB3	89	46
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cc(F)ccc1F	ZINC000819288951	EH	On-Demand	Anodyne	HTR1A	23	53
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cc(F)ccc1F	ZINC000819288951	EH	On-Demand	Anodyne	HTR1D	48	37
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cc(F)ccc1F	ZINC000819288951	EH	On-Demand	Anodyne	HTR1B	40	38
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cc(F)ccc1F	ZINC000819288951	EH	On-Demand	Anodyne	SLC6A4	27	64
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cc(F)ccc1F	ZINC000819288951	EH	On-Demand	Anodyne	MPO	132	64
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cc(F)ccc1F	ZINC000819288952	EH	On-Demand	Anodyne	HTR1A	23	53
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cc(F)ccc1F	ZINC000819288952	EH	On-Demand	Anodyne	HTR1D	48	37
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cc(F)ccc1F	ZINC000819288952	EH	On-Demand	Anodyne	HTR1B	40	38
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cc(F)ccc1F	ZINC000819288952	EH	On-Demand	Anodyne	SLC6A4	27	64
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cc(F)ccc1F	ZINC000819288952	EH	On-Demand	Anodyne	MPO	132	64
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1	ZINC000819288953	DH	On-Demand	Anodyne	HTR1A	25	62
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1	ZINC000819288953	DH	On-Demand	Anodyne	HTR1D	74	38
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1	ZINC000819288953	DH	On-Demand	Anodyne	HTR1B	60	39
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1	ZINC000819288953	DH	On-Demand	Anodyne	SLC6A4	31	67
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1	ZINC000819288953	DH	On-Demand	Anodyne	ADRB3	48	40
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1	ZINC000819288953	DH	On-Demand	Anodyne	MPO	134	67
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1	ZINC000819288954	DH	On-Demand	Anodyne	HTR1A	25	62
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1	ZINC000819288954	DH	On-Demand	Anodyne	HTR1D	74	38
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1	ZINC000819288954	DH	On-Demand	Anodyne	HTR1B	60	39
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1	ZINC000819288954	DH	On-Demand	Anodyne	SLC6A4	31	67
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1	ZINC000819288954	DH	On-Demand	Anodyne	ADRB3	48	40
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1	ZINC000819288954	DH	On-Demand	Anodyne	MPO	134	67
Cc1cc(Cl)nc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819288970	CE	On-Demand	Anodyne	ADRB2	21	42
Cc1cc(Cl)nc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819288970	CE	On-Demand	Anodyne	ADRB1	24	42
Cc1cc(Cl)nc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819288970	CE	On-Demand	Anodyne	ADRB3	87	43
Cc1cc(Cl)nc(CNC[C@H](O)c2cccnc2)c1	ZINC000819288971	CE	On-Demand	Anodyne	ADRB2	21	42
Cc1cc(Cl)nc(CNC[C@H](O)c2cccnc2)c1	ZINC000819288971	CE	On-Demand	Anodyne	ADRB1	24	42
Cc1cc(Cl)nc(CNC[C@H](O)c2cccnc2)c1	ZINC000819288971	CE	On-Demand	Anodyne	ADRB3	87	43
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc2[nH]ccc12	ZINC000819288972	DG	On-Demand	Anodyne	ADRB2	50	38
Cc1cc(F)ccc1[C@@H](O)CNCCc1cccc2[nH]ccc12	ZINC000819288972	DG	On-Demand	Anodyne	MPO	42	39
COCCn1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819288992	DD	On-Demand	Bother	CACNA1C	48	35
COCCn1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819288992	DD	On-Demand	Bother	CACNA1D	71	35
COCCn1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819288993	DD	On-Demand	Bother	CACNA1C	48	35
COCCn1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819288993	DD	On-Demand	Bother	CACNA1D	71	35
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1F	ZINC000819289014	EH	On-Demand	Anodyne	HTR1A	23	57
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1F	ZINC000819289014	EH	On-Demand	Anodyne	HTR1D	64	37
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1F	ZINC000819289014	EH	On-Demand	Anodyne	HTR1B	52	37
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1F	ZINC000819289014	EH	On-Demand	Anodyne	SLC6A4	29	62
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1F	ZINC000819289014	EH	On-Demand	Anodyne	MPO	133	62
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1F	ZINC000819289015	EH	On-Demand	Anodyne	HTR1A	23	57
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1F	ZINC000819289015	EH	On-Demand	Anodyne	HTR1D	64	37
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1F	ZINC000819289015	EH	On-Demand	Anodyne	HTR1B	52	37
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1F	ZINC000819289015	EH	On-Demand	Anodyne	SLC6A4	29	62
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccccc1F	ZINC000819289015	EH	On-Demand	Anodyne	MPO	133	62
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)c(F)c1	ZINC000819289025	EH	On-Demand	Anodyne	HTR1A	20	52
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)c(F)c1	ZINC000819289025	EH	On-Demand	Anodyne	SLC6A4	24	62
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)c(F)c1	ZINC000819289025	EH	On-Demand	Anodyne	ADRB3	21	49
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)c(F)c1	ZINC000819289025	EH	On-Demand	Anodyne	MPO	128	62
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)c(F)c1	ZINC000819289026	EH	On-Demand	Anodyne	HTR1A	20	52
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)c(F)c1	ZINC000819289026	EH	On-Demand	Anodyne	SLC6A4	24	62
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)c(F)c1	ZINC000819289026	EH	On-Demand	Anodyne	ADRB3	21	49
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)c(F)c1	ZINC000819289026	EH	On-Demand	Anodyne	MPO	128	62
CN(C[C@@H](O)CNCCCc1c[nH]c2ccc(F)cc12)C(=O)OC(C)(C)C	ZINC000819289037	GG	On-Demand	Anodyne	HTR1A	21	46
CN(C[C@@H](O)CNCCCc1c[nH]c2ccc(F)cc12)C(=O)OC(C)(C)C	ZINC000819289037	GG	On-Demand	Anodyne	SLC6A4	23	52
CN(C[C@@H](O)CNCCCc1c[nH]c2ccc(F)cc12)C(=O)OC(C)(C)C	ZINC000819289037	GG	On-Demand	Anodyne	MPO	105	52
CN(C[C@H](O)CNCCCc1c[nH]c2ccc(F)cc12)C(=O)OC(C)(C)C	ZINC000819289038	GG	On-Demand	Anodyne	HTR1A	21	46
CN(C[C@H](O)CNCCCc1c[nH]c2ccc(F)cc12)C(=O)OC(C)(C)C	ZINC000819289038	GG	On-Demand	Anodyne	SLC6A4	23	52
CN(C[C@H](O)CNCCCc1c[nH]c2ccc(F)cc12)C(=O)OC(C)(C)C	ZINC000819289038	GG	On-Demand	Anodyne	MPO	105	52
COc1cccc([S@@](=O)CC(=O)NC[C@@H](C)C(C)(C)C)c1	ZINC000819289041	DF	On-Demand	Anodyne	MTNR1A	36	45
COc1cccc([S@@](=O)CC(=O)NC[C@@H](C)C(C)(C)C)c1	ZINC000819289041	DF	On-Demand	Anodyne	MTNR1B	36	45
COc1cccc([S@@](=O)CC(=O)NC[C@H](C)C(C)(C)C)c1	ZINC000819289043	DF	On-Demand	Anodyne	MTNR1A	36	45
COc1cccc([S@@](=O)CC(=O)NC[C@H](C)C(C)(C)C)c1	ZINC000819289043	DF	On-Demand	Anodyne	MTNR1B	36	45
O=C(/C=C/[C@@H]1CCCO1)N1CCC(Oc2ccc(F)cc2)CC1	ZINC000819289057	DF	On-Demand	Anodyne	PRSS2	49	30
O=C(/C=C/[C@@H]1CCCO1)N1CCC(Oc2ccc(F)cc2)CC1	ZINC000819289057	DF	On-Demand	Anodyne	HRH3	19	41
O=C(/C=C/[C@@H]1CCCO1)N1CCC(Oc2ccc(F)cc2)CC1	ZINC000819289057	DF	On-Demand	Anodyne	EPHX2	20	45
O=C(/C=C\[C@@H]1CCCO1)N1CCC(Oc2ccc(F)cc2)CC1	ZINC000819289058	DF	On-Demand	Anodyne	PRSS2	49	30
O=C(/C=C\[C@@H]1CCCO1)N1CCC(Oc2ccc(F)cc2)CC1	ZINC000819289058	DF	On-Demand	Anodyne	HRH3	19	41
O=C(/C=C\[C@@H]1CCCO1)N1CCC(Oc2ccc(F)cc2)CC1	ZINC000819289058	DF	On-Demand	Anodyne	EPHX2	20	45
O=C(/C=C/[C@H]1CCCO1)N1CCC(Oc2ccc(F)cc2)CC1	ZINC000819289059	DF	On-Demand	Anodyne	PRSS2	49	30
O=C(/C=C/[C@H]1CCCO1)N1CCC(Oc2ccc(F)cc2)CC1	ZINC000819289059	DF	On-Demand	Anodyne	HRH3	19	41
O=C(/C=C/[C@H]1CCCO1)N1CCC(Oc2ccc(F)cc2)CC1	ZINC000819289059	DF	On-Demand	Anodyne	EPHX2	20	45
O=C(/C=C\[C@H]1CCCO1)N1CCC(Oc2ccc(F)cc2)CC1	ZINC000819289060	DF	On-Demand	Anodyne	PRSS2	49	30
O=C(/C=C\[C@H]1CCCO1)N1CCC(Oc2ccc(F)cc2)CC1	ZINC000819289060	DF	On-Demand	Anodyne	HRH3	19	41
O=C(/C=C\[C@H]1CCCO1)N1CCC(Oc2ccc(F)cc2)CC1	ZINC000819289060	DF	On-Demand	Anodyne	EPHX2	20	45
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289094	GG	On-Demand	Anodyne	HTR1A	25	50
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289094	GG	On-Demand	Anodyne	HTR1D	36	44
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289094	GG	On-Demand	Anodyne	HTR1B	31	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289094	GG	On-Demand	Anodyne	SLC6A4	24	56
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289094	GG	On-Demand	Anodyne	MPO	114	60
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289095	GG	On-Demand	Anodyne	HTR1A	25	50
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289095	GG	On-Demand	Anodyne	HTR1D	36	44
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289095	GG	On-Demand	Anodyne	HTR1B	31	42
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289095	GG	On-Demand	Anodyne	SLC6A4	24	56
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289095	GG	On-Demand	Anodyne	MPO	114	60
Cc1ccccc1[C@@H](O)CNCCc1cccc2[nH]ccc12	ZINC000819289131	CG	On-Demand	Anodyne	ADRB2	52	39
Cc1ccccc1[C@@H](O)CNCCc1cccc2[nH]ccc12	ZINC000819289131	CG	On-Demand	Anodyne	ADRB1	31	41
Cc1ccccc1[C@@H](O)CNCCc1cccc2[nH]ccc12	ZINC000819289131	CG	On-Demand	Anodyne	ADRB3	15	50
CC(C)(C)OC(=O)CS(=O)(=O)CCNCCc1cccc2[nH]ccc12	ZINC000819289135	FE	On-Demand	Anodyne	NQO2	24	40
CSc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819289140	FG	On-Demand	Anodyne	ADRB2	27	40
CSc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819289141	FG	On-Demand	Anodyne	ADRB2	27	40
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819289150	CF	On-Demand	Anodyne	HTR1A	28	53
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819289150	CF	On-Demand	Anodyne	HTR1D	88	41
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819289150	CF	On-Demand	Anodyne	HTR1B	77	41
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819289150	CF	On-Demand	Anodyne	SLC6A4	34	64
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819289150	CF	On-Demand	Anodyne	MPO	123	64
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819289151	CF	On-Demand	Anodyne	HTR1A	28	53
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819289151	CF	On-Demand	Anodyne	HTR1D	88	41
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819289151	CF	On-Demand	Anodyne	HTR1B	77	41
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819289151	CF	On-Demand	Anodyne	SLC6A4	34	64
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)C1CC1	ZINC000819289151	CF	On-Demand	Anodyne	MPO	123	64
O[C@@H](CNCC1CCC(F)(F)CC1)c1cccc(Cl)c1	ZINC000819289161	DH	On-Demand	Anodyne	ADRB2	22	40
O[C@@H](CNCC1CCC(F)(F)CC1)c1cccc(Cl)c1	ZINC000819289161	DH	On-Demand	Anodyne	ADRB1	43	42
O[C@@H](CNCC1CCC(F)(F)CC1)c1cccc(Cl)c1	ZINC000819289161	DH	On-Demand	Anodyne	ADRB3	56	43
O[C@H](CNCC1CCC(F)(F)CC1)c1cccc(Cl)c1	ZINC000819289162	DH	On-Demand	Anodyne	ADRB2	22	40
O[C@H](CNCC1CCC(F)(F)CC1)c1cccc(Cl)c1	ZINC000819289162	DH	On-Demand	Anodyne	ADRB1	43	42
O[C@H](CNCC1CCC(F)(F)CC1)c1cccc(Cl)c1	ZINC000819289162	DH	On-Demand	Anodyne	ADRB3	56	43
CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819289163	ED	On-Demand	Anodyne	ADRB1	44	42
CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819289163	ED	On-Demand	Anodyne	ADRB3	59	43
CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819289163	ED	On-Demand	Anodyne	CYP3A4	40	33
CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819289164	ED	On-Demand	Anodyne	ADRB1	44	42
CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819289164	ED	On-Demand	Anodyne	ADRB3	59	43
CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819289164	ED	On-Demand	Anodyne	CYP3A4	40	33
CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819289165	ED	On-Demand	Anodyne	ADRB1	44	42
CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819289165	ED	On-Demand	Anodyne	ADRB3	59	43
CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819289165	ED	On-Demand	Anodyne	CYP3A4	40	33
CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819289166	ED	On-Demand	Anodyne	ADRB1	44	42
CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819289166	ED	On-Demand	Anodyne	ADRB3	59	43
CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819289166	ED	On-Demand	Anodyne	CYP3A4	40	33
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2CCC(F)(F)CC2)CC1	ZINC000819289167	GG	On-Demand	Anodyne	GPR119	33	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2CCC(F)(F)CC2)CC1	ZINC000819289168	GG	On-Demand	Anodyne	GPR119	33	46
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCc2cccc3[nH]ccc23)CC1	ZINC000819289173	GG	On-Demand	Anodyne	SSTR2	52	33
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCc2cccc3[nH]ccc23)CC1	ZINC000819289174	GG	On-Demand	Anodyne	SSTR2	52	33
O=C(/C=C/[C@@H]1CCCO1)NCc1nc(-c2ccc(Cl)cc2)no1	ZINC000819289182	EF	On-Demand	Anodyne	SPHK1	33	41
O=C(/C=C\[C@H]1CCCO1)NCc1nc(-c2ccc(Cl)cc2)no1	ZINC000819289183	EF	On-Demand	Anodyne	SPHK1	33	41
O=C(/C=C/[C@H]1CCCO1)NCc1nc(-c2ccc(Cl)cc2)no1	ZINC000819289184	EF	On-Demand	Anodyne	SPHK1	33	41
O=C(/C=C\[C@@H]1CCCO1)NCc1nc(-c2ccc(Cl)cc2)no1	ZINC000819289185	EF	On-Demand	Anodyne	SPHK1	33	41
CN(C)c1ccc(NC(=O)CCNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289199	GH	On-Demand	Anodyne	HTR1A	24	49
CN(C)c1ccc(NC(=O)CCNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289199	GH	On-Demand	Anodyne	HTR1D	47	41
CN(C)c1ccc(NC(=O)CCNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289199	GH	On-Demand	Anodyne	HTR1B	39	43
CN(C)c1ccc(NC(=O)CCNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289199	GH	On-Demand	Anodyne	SLC6A4	24	58
CN(C)c1ccc(NC(=O)CCNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289199	GH	On-Demand	Anodyne	MPO	117	58
CCN(C(=O)C(F)=C1CCC1)[C@H](C)c1cccnc1	ZINC000819289233	CG	On-Demand	Anodyne	KCNA5	24	42
CCN(C(=O)C(F)=C1CCC1)[C@@H](C)c1cccnc1	ZINC000819289234	CG	On-Demand	Anodyne	KCNA5	24	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc3[nH]ccc23)cc1	ZINC000819289235	FE	On-Demand	Anodyne	ADRB2	60	36
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc3[nH]ccc23)cc1	ZINC000819289235	FE	On-Demand	Anodyne	ADRB1	46	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc3[nH]ccc23)cc1	ZINC000819289235	FE	On-Demand	Anodyne	ADRB3	75	47
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc3[nH]ccc23)cc1	ZINC000819289236	FE	On-Demand	Anodyne	ADRB2	60	36
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc3[nH]ccc23)cc1	ZINC000819289236	FE	On-Demand	Anodyne	ADRB1	46	41
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc3[nH]ccc23)cc1	ZINC000819289236	FE	On-Demand	Anodyne	ADRB3	75	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC[C@H](OCc2ccncc2)C1	ZINC000819289237	FE	On-Demand	Anodyne	GPR119	20	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC[C@@H](OCc2ccncc2)C1	ZINC000819289238	FE	On-Demand	Anodyne	GPR119	20	41
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819289278	FH	On-Demand	Anodyne	HTR1A	25	61
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819289278	FH	On-Demand	Anodyne	HTR1D	32	44
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819289278	FH	On-Demand	Anodyne	SLC6A4	27	61
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819289278	FH	On-Demand	Anodyne	MPO	109	56
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819289278	FH	On-Demand	Anodyne	MTNR1A	21	47
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819289278	FH	On-Demand	Anodyne	MTNR1B	18	46
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1	ZINC000819289285	EH	On-Demand	Anodyne	ADRB2	30	41
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1	ZINC000819289285	EH	On-Demand	Anodyne	HTR1A	23	56
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1	ZINC000819289285	EH	On-Demand	Anodyne	HTR1D	56	40
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1	ZINC000819289285	EH	On-Demand	Anodyne	HTR1B	49	40
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1	ZINC000819289285	EH	On-Demand	Anodyne	SLC6A4	28	68
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1	ZINC000819289285	EH	On-Demand	Anodyne	ADRB3	19	48
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1	ZINC000819289285	EH	On-Demand	Anodyne	MPO	138	68
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1	ZINC000819289286	EH	On-Demand	Anodyne	ADRB2	30	41
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1	ZINC000819289286	EH	On-Demand	Anodyne	HTR1A	23	56
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1	ZINC000819289286	EH	On-Demand	Anodyne	HTR1D	56	40
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1	ZINC000819289286	EH	On-Demand	Anodyne	HTR1B	49	40
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1	ZINC000819289286	EH	On-Demand	Anodyne	SLC6A4	28	68
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1	ZINC000819289286	EH	On-Demand	Anodyne	ADRB3	19	48
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1	ZINC000819289286	EH	On-Demand	Anodyne	MPO	138	68
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2Cc3ccc(Cl)cc3C2)CC1	ZINC000819289297	GG	On-Demand	Anodyne	GPR119	48	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2Cc3ccc(Cl)cc3C2)CC1	ZINC000819289298	GG	On-Demand	Anodyne	GPR119	48	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2Cc3ccc(Cl)cc3C2)CC1	ZINC000819289299	GG	On-Demand	Anodyne	GPR119	48	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2Cc3ccc(Cl)cc3C2)CC1	ZINC000819289300	GG	On-Demand	Anodyne	GPR119	48	49
CC(C)[C@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819289319	FH	On-Demand	Mild	PAPA1_CARPA	33	43
CC(C)[C@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819289319	FH	On-Demand	Mild	CTSK	18	43
CC(C)[C@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819289321	FH	On-Demand	Mild	PAPA1_CARPA	33	43
CC(C)[C@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819289321	FH	On-Demand	Mild	CTSK	18	43
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccccc2C)c1	ZINC000819289325	DF	On-Demand	Anodyne	ADRB2	26	56
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccccc2C)c1	ZINC000819289325	DF	On-Demand	Anodyne	ADRB1	48	34
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccccc2C)c1	ZINC000819289325	DF	On-Demand	Anodyne	CYP2D6	15	45
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccccc2C)c1	ZINC000819289326	DF	On-Demand	Anodyne	ADRB2	26	56
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccccc2C)c1	ZINC000819289326	DF	On-Demand	Anodyne	ADRB1	48	34
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccccc2C)c1	ZINC000819289326	DF	On-Demand	Anodyne	CYP2D6	15	45
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819289327	FE	On-Demand	Bother	ADRB2	19	40
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819289327	FE	On-Demand	Bother	ADRB1	54	33
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819289328	FE	On-Demand	Bother	ADRB2	19	40
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819289328	FE	On-Demand	Bother	ADRB1	54	33
Cc1cc(Cl)nc(CNC[C@H](O)COc2cccc(Br)c2)c1	ZINC000819289373	GG	On-Demand	Anodyne	ADRB2	25	44
Cc1cc(Cl)nc(CNC[C@H](O)COc2cccc(Br)c2)c1	ZINC000819289373	GG	On-Demand	Anodyne	ADRB1	23	44
Cc1cc(Cl)nc(CNC[C@H](O)COc2cccc(Br)c2)c1	ZINC000819289373	GG	On-Demand	Anodyne	ADRB3	16	40
Cc1cc(Cl)nc(CNC[C@H](O)COc2cccc(Br)c2)c1	ZINC000819289373	GG	On-Demand	Anodyne	PDS	60	40
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cccc(Br)c2)c1	ZINC000819289374	GG	On-Demand	Anodyne	ADRB2	25	44
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cccc(Br)c2)c1	ZINC000819289374	GG	On-Demand	Anodyne	ADRB1	23	44
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cccc(Br)c2)c1	ZINC000819289374	GG	On-Demand	Anodyne	ADRB3	16	40
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cccc(Br)c2)c1	ZINC000819289374	GG	On-Demand	Anodyne	PDS	60	40
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc(C)cc2C)c1	ZINC000819289379	EG	On-Demand	Anodyne	ADRB2	15	44
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc(C)cc2C)c1	ZINC000819289380	EG	On-Demand	Anodyne	ADRB2	15	44
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccnc1	ZINC000819289411	DF	On-Demand	Anodyne	ADRB2	27	43
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccnc1	ZINC000819289411	DF	On-Demand	Anodyne	ADRB1	30	43
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccnc1	ZINC000819289411	DF	On-Demand	Anodyne	HTR1A	17	54
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccnc1	ZINC000819289411	DF	On-Demand	Anodyne	HTR1D	46	37
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccnc1	ZINC000819289411	DF	On-Demand	Anodyne	SLC6A4	22	60
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccnc1	ZINC000819289411	DF	On-Demand	Anodyne	ADRB3	103	46
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccnc1	ZINC000819289411	DF	On-Demand	Anodyne	MPO	116	60
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccnc1	ZINC000819289412	DF	On-Demand	Anodyne	ADRB2	27	43
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccnc1	ZINC000819289412	DF	On-Demand	Anodyne	ADRB1	30	43
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccnc1	ZINC000819289412	DF	On-Demand	Anodyne	HTR1A	17	54
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccnc1	ZINC000819289412	DF	On-Demand	Anodyne	HTR1D	46	37
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccnc1	ZINC000819289412	DF	On-Demand	Anodyne	SLC6A4	22	60
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccnc1	ZINC000819289412	DF	On-Demand	Anodyne	ADRB3	103	46
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccnc1	ZINC000819289412	DF	On-Demand	Anodyne	MPO	116	60
CS(=O)(=O)NC[C@H]1CCC[C@@H]1NC[C@H](O)c1ccccc1	ZINC000819289419	DD	On-Demand	Anodyne	ADRB1	17	41
CS(=O)(=O)NC[C@H]1CCC[C@@H]1NC[C@H](O)c1ccccc1	ZINC000819289419	DD	On-Demand	Anodyne	ADRB3	38	40
CS(=O)(=O)NC[C@H]1CCC[C@H]1NC[C@H](O)c1ccccc1	ZINC000819289420	DD	On-Demand	Anodyne	ADRB1	17	41
CS(=O)(=O)NC[C@H]1CCC[C@H]1NC[C@H](O)c1ccccc1	ZINC000819289420	DD	On-Demand	Anodyne	ADRB3	38	40
CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC[C@H](O)c1ccccc1	ZINC000819289421	DD	On-Demand	Anodyne	ADRB1	17	41
CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC[C@H](O)c1ccccc1	ZINC000819289421	DD	On-Demand	Anodyne	ADRB3	38	40
CS(=O)(=O)NC[C@H]1CCC[C@@H]1NC[C@@H](O)c1ccccc1	ZINC000819289422	DD	On-Demand	Anodyne	ADRB1	17	41
CS(=O)(=O)NC[C@H]1CCC[C@@H]1NC[C@@H](O)c1ccccc1	ZINC000819289422	DD	On-Demand	Anodyne	ADRB3	38	40
CS(=O)(=O)NC[C@H]1CCC[C@H]1NC[C@@H](O)c1ccccc1	ZINC000819289423	DD	On-Demand	Anodyne	ADRB1	17	41
CS(=O)(=O)NC[C@H]1CCC[C@H]1NC[C@@H](O)c1ccccc1	ZINC000819289423	DD	On-Demand	Anodyne	ADRB3	38	40
CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC[C@@H](O)c1ccccc1	ZINC000819289424	DD	On-Demand	Anodyne	ADRB1	17	41
CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC[C@@H](O)c1ccccc1	ZINC000819289424	DD	On-Demand	Anodyne	ADRB3	38	40
CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC[C@@H](O)c1ccccc1	ZINC000819289425	DD	On-Demand	Anodyne	ADRB1	17	41
CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC[C@@H](O)c1ccccc1	ZINC000819289425	DD	On-Demand	Anodyne	ADRB3	38	40
CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC[C@H](O)c1ccccc1	ZINC000819289426	DD	On-Demand	Anodyne	ADRB1	17	41
CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC[C@H](O)c1ccccc1	ZINC000819289426	DD	On-Demand	Anodyne	ADRB3	38	40
O=C(C(F)=C1CCC1)N1CCC(Oc2ccc(F)cc2)CC1	ZINC000819289434	DH	On-Demand	Anodyne	HRH3	29	43
O=C(C(F)=C1CCC1)N1CCC(Oc2ccc(F)cc2)CC1	ZINC000819289434	DH	On-Demand	Anodyne	EPHX2	19	45
N#Cc1ccc([C@@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289435	EG	On-Demand	Mild	HTR1A	20	52
N#Cc1ccc([C@@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289435	EG	On-Demand	Mild	SLC6A4	29	58
N#Cc1ccc([C@@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289435	EG	On-Demand	Mild	MPO	112	58
N#Cc1ccc([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289436	EG	On-Demand	Mild	HTR1A	20	52
N#Cc1ccc([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289436	EG	On-Demand	Mild	SLC6A4	29	58
N#Cc1ccc([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289436	EG	On-Demand	Mild	MPO	112	58
O=C(NCc1nc(-c2cccc(Cl)c2)no1)C(F)=C1CCC1	ZINC000819289437	DG	On-Demand	Anodyne	GRM5	20	45
O=C(/C=C\[C@H]1CCCO1)NCc1nc(-c2cccc(Cl)c2)no1	ZINC000819289455	EF	On-Demand	Anodyne	GRM5	20	47
O=C(/C=C\[C@@H]1CCCO1)NCc1nc(-c2cccc(Cl)c2)no1	ZINC000819289456	EF	On-Demand	Anodyne	GRM5	20	47
O=C(/C=C/[C@H]1CCCO1)NCc1nc(-c2cccc(Cl)c2)no1	ZINC000819289457	EF	On-Demand	Anodyne	GRM5	20	47
O=C(/C=C/[C@@H]1CCCO1)NCc1nc(-c2cccc(Cl)c2)no1	ZINC000819289458	EF	On-Demand	Anodyne	GRM5	20	47
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cn1	ZINC000819289480	EG	On-Demand	Anodyne	HTR1A	19	53
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cn1	ZINC000819289480	EG	On-Demand	Anodyne	SLC6A4	23	63
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cn1	ZINC000819289480	EG	On-Demand	Anodyne	MPO	116	63
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cn1	ZINC000819289481	EG	On-Demand	Anodyne	HTR1A	19	53
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cn1	ZINC000819289481	EG	On-Demand	Anodyne	SLC6A4	23	63
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cn1	ZINC000819289481	EG	On-Demand	Anodyne	MPO	116	63
COCCc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819289495	FF	On-Demand	Anodyne	ADRB2	42	54
COCCc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819289495	FF	On-Demand	Anodyne	ADRB1	63	54
COCCc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819289495	FF	On-Demand	Anodyne	GRIN1	26	41
COCCc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819289495	FF	On-Demand	Anodyne	ADRB3	43	47
COCCc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819289496	FF	On-Demand	Anodyne	ADRB2	42	54
COCCc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819289496	FF	On-Demand	Anodyne	ADRB1	63	54
COCCc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819289496	FF	On-Demand	Anodyne	GRIN1	26	41
COCCc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819289496	FF	On-Demand	Anodyne	ADRB3	43	47
Cc1nc(CNC(=O)CC[C@@H](CC2CCCCC2)NC(=O)OC(C)(C)C)no1	ZINC000819289503	GH	On-Demand	Anodyne	BMP1	54	40
Cc1nc(CNC(=O)CC[C@@H](CC2CCCCC2)NC(=O)OC(C)(C)C)no1	ZINC000819289503	GH	On-Demand	Anodyne	REN	48	40
Cc1nc(CNC(=O)CC[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)no1	ZINC000819289504	GH	On-Demand	Anodyne	BMP1	54	40
Cc1nc(CNC(=O)CC[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)no1	ZINC000819289504	GH	On-Demand	Anodyne	REN	48	40
O[C@H](CNCCc1ccc2[nH]ccc2c1)c1ccc(C(F)(F)F)cc1	ZINC000819289521	EI	On-Demand	Anodyne	ADRB2	31	41
O[C@H](CNCCc1ccc2[nH]ccc2c1)c1ccc(C(F)(F)F)cc1	ZINC000819289521	EI	On-Demand	Anodyne	ADRB3	48	41
O[C@@H](CNCCc1ccc2[nH]ccc2c1)c1ccc(C(F)(F)F)cc1	ZINC000819289522	EI	On-Demand	Anodyne	ADRB2	31	41
O[C@@H](CNCCc1ccc2[nH]ccc2c1)c1ccc(C(F)(F)F)cc1	ZINC000819289522	EI	On-Demand	Anodyne	ADRB3	48	41
Cc1cc(Cl)nc(CNC[C@H](O)COc2cc(C)ccc2C)c1	ZINC000819289539	EG	On-Demand	Anodyne	ADRB2	19	44
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cc(C)ccc2C)c1	ZINC000819289540	EG	On-Demand	Anodyne	ADRB2	19	44
Cc1cc(Cl)nc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)c1	ZINC000819289541	FI	On-Demand	Anodyne	RAF1	17	41
Cc1cc(Cl)nc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)c1	ZINC000819289541	FI	On-Demand	Anodyne	CCR2	18	40
Cc1cc(Cl)nc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)c1	ZINC000819289541	FI	On-Demand	Anodyne	TEK	27	40
Cc1cc(Cl)nc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)c1	ZINC000819289541	FI	On-Demand	Anodyne	KCNK3	25	42
Cc1cc(Cl)nc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)c1	ZINC000819289541	FI	On-Demand	Anodyne	PDS	41	34
Cc1cc(Cl)nc(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819289547	FH	On-Demand	Anodyne	ADRB2	22	42
Cc1cc(Cl)nc(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819289547	FH	On-Demand	Anodyne	ADRB1	20	42
Cc1cc(Cl)nc(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819289547	FH	On-Demand	Anodyne	PDS	69	46
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819289548	FH	On-Demand	Anodyne	ADRB2	22	42
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819289548	FH	On-Demand	Anodyne	ADRB1	20	42
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819289548	FH	On-Demand	Anodyne	PDS	69	46
Cc1cc(Cl)nc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819289557	FE	On-Demand	Bother	ADRB2	21	43
Cc1cc(Cl)nc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819289557	FE	On-Demand	Bother	ADRB1	22	43
Cc1cc(Cl)nc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819289557	FE	On-Demand	Bother	ADRB3	16	43
Cc1cc(Cl)nc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819289557	FE	On-Demand	Bother	CACNA1D	57	33
Cc1cc(Cl)nc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819289557	FE	On-Demand	Bother	PDS	38	44
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819289558	FE	On-Demand	Bother	ADRB2	21	43
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819289558	FE	On-Demand	Bother	ADRB1	22	43
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819289558	FE	On-Demand	Bother	ADRB3	16	43
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819289558	FE	On-Demand	Bother	CACNA1D	57	33
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819289558	FE	On-Demand	Bother	PDS	38	44
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819289566	EF	On-Demand	Mild	ADRB2	35	44
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819289566	EF	On-Demand	Mild	ADRB1	49	41
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819289566	EF	On-Demand	Mild	ADRB3	32	41
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819289567	EF	On-Demand	Mild	ADRB2	35	44
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819289567	EF	On-Demand	Mild	ADRB1	49	41
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819289567	EF	On-Demand	Mild	ADRB3	32	41
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccccc2C(C)C)c1	ZINC000819289573	EH	On-Demand	Anodyne	ADRB2	27	45
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccccc2C(C)C)c1	ZINC000819289573	EH	On-Demand	Anodyne	ABCB1	15	40
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccccc2C(C)C)c1	ZINC000819289574	EH	On-Demand	Anodyne	ADRB2	27	45
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccccc2C(C)C)c1	ZINC000819289574	EH	On-Demand	Anodyne	ABCB1	15	40
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819289586	EG	On-Demand	Anodyne	ADRB2	26	52
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819289586	EG	On-Demand	Anodyne	ADRB1	48	34
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819289587	EG	On-Demand	Anodyne	ADRB2	26	52
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819289587	EG	On-Demand	Anodyne	ADRB1	48	34
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819289592	GG	On-Demand	Anodyne	ADRB2	46	44
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819289592	GG	On-Demand	Anodyne	ADRB1	71	47
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819289592	GG	On-Demand	Anodyne	GRIN1	28	42
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819289592	GG	On-Demand	Anodyne	ADRB3	49	47
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819289593	GG	On-Demand	Anodyne	ADRB2	46	44
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819289593	GG	On-Demand	Anodyne	ADRB1	71	47
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819289593	GG	On-Demand	Anodyne	GRIN1	28	42
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819289593	GG	On-Demand	Anodyne	ADRB3	49	47
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccccc2F)c1	ZINC000819289602	DF	On-Demand	Anodyne	ADRB2	23	43
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccccc2F)c1	ZINC000819289602	DF	On-Demand	Anodyne	ADRB1	55	36
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccccc2F)c1	ZINC000819289603	DF	On-Demand	Anodyne	ADRB2	23	43
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccccc2F)c1	ZINC000819289603	DF	On-Demand	Anodyne	ADRB1	55	36
CON(C)C(=O)CCNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289622	DE	On-Demand	Anodyne	HTR1A	30	57
CON(C)C(=O)CCNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289622	DE	On-Demand	Anodyne	HTR1D	65	40
CON(C)C(=O)CCNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289622	DE	On-Demand	Anodyne	HTR1B	49	42
CON(C)C(=O)CCNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289622	DE	On-Demand	Anodyne	SLC6A4	31	62
CON(C)C(=O)CCNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289622	DE	On-Demand	Anodyne	TPR	15	44
CON(C)C(=O)CCNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289622	DE	On-Demand	Anodyne	MPO	125	62
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2cccc3[nH]ccc23)CC1	ZINC000819289637	GG	On-Demand	Anodyne	SSTR2	61	38
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2cccc3[nH]ccc23)CC1	ZINC000819289637	GG	On-Demand	Anodyne	GPR119	32	48
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2cccc3[nH]ccc23)CC1	ZINC000819289638	GG	On-Demand	Anodyne	SSTR2	61	38
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2cccc3[nH]ccc23)CC1	ZINC000819289638	GG	On-Demand	Anodyne	GPR119	32	48
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)(C)C	ZINC000819289639	EG	On-Demand	Mild	PAPA1_CARPA	49	58
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)(C)C	ZINC000819289639	EG	On-Demand	Mild	CTSK	19	55
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)(C)C	ZINC000819289641	EG	On-Demand	Mild	PAPA1_CARPA	49	58
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)(C)C	ZINC000819289641	EG	On-Demand	Mild	CTSK	19	55
O=[N+]([O-])c1ccc([C@@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289649	FG	On-Demand	Bother	HTR1A	17	48
O=[N+]([O-])c1ccc([C@@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289649	FG	On-Demand	Bother	SLC6A4	20	56
O=[N+]([O-])c1ccc([C@@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289649	FG	On-Demand	Bother	MPO	109	56
O=[N+]([O-])c1ccc([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289650	FG	On-Demand	Bother	HTR1A	17	48
O=[N+]([O-])c1ccc([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289650	FG	On-Demand	Bother	SLC6A4	20	56
O=[N+]([O-])c1ccc([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289650	FG	On-Demand	Bother	MPO	109	56
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ncnn2C(C)(C)C)CC1	ZINC000819289651	GE	On-Demand	Anodyne	GPR119	50	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ncnn2C(C)(C)C)CC1	ZINC000819289652	GE	On-Demand	Anodyne	GPR119	50	46
Cc1cc(Cl)nc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819289661	GG	On-Demand	Anodyne	GPR119	42	45
Cc1cc(Cl)nc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819289662	GG	On-Demand	Anodyne	GPR119	42	45
CCOC(=O)C1CCC(O)(CNC[C@H]2CC(c3ccc(C)cc3)=NO2)CC1	ZINC000819289663	FF	On-Demand	Anodyne	LUCI_PHOPY	50	34
CCOC(=O)C1CCC(O)(CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)CC1	ZINC000819289664	FF	On-Demand	Anodyne	LUCI_PHOPY	50	34
CC[C@H](O)CNC[C@@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819289675	CD	On-Demand	Anodyne	LUCI_PHOPY	84	40
CC[C@@H](O)CNC[C@@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819289676	CD	On-Demand	Anodyne	LUCI_PHOPY	84	40
CC[C@H](O)CNC[C@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819289677	CD	On-Demand	Anodyne	LUCI_PHOPY	84	40
CC[C@@H](O)CNC[C@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819289678	CD	On-Demand	Anodyne	LUCI_PHOPY	84	40
Cc1ccccc1[C@@H](O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289687	EH	On-Demand	Anodyne	HTR1A	24	55
Cc1ccccc1[C@@H](O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289687	EH	On-Demand	Anodyne	HTR1D	64	37
Cc1ccccc1[C@@H](O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289687	EH	On-Demand	Anodyne	HTR1B	53	37
Cc1ccccc1[C@@H](O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289687	EH	On-Demand	Anodyne	SLC6A4	29	59
Cc1ccccc1[C@@H](O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289687	EH	On-Demand	Anodyne	MPO	119	60
COc1ccc(OC)c([C@H](O)CNCCc2cccc3[nH]ccc23)c1	ZINC000819289696	EG	On-Demand	Anodyne	ADRB2	47	49
COc1ccc(OC)c([C@H](O)CNCCc2cccc3[nH]ccc23)c1	ZINC000819289696	EG	On-Demand	Anodyne	ADRB1	39	45
COc1ccc(OC)c([C@H](O)CNCCc2cccc3[nH]ccc23)c1	ZINC000819289696	EG	On-Demand	Anodyne	ADRB3	27	47
COc1ccc(OC)c([C@H](O)CNCCc2cccc3[nH]ccc23)c1	ZINC000819289696	EG	On-Demand	Anodyne	NQO2	20	40
COc1ccc(OC)c([C@H](O)CNCCc2cccc3[nH]ccc23)c1	ZINC000819289696	EG	On-Demand	Anodyne	MTNR1A	39	40
COCCn1cc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	ZINC000819289765	GD	On-Demand	Anodyne	GPR119	39	45
COCCn1cc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	ZINC000819289766	GD	On-Demand	Anodyne	GPR119	39	45
CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC[C@@H](O)c1cccnc1	ZINC000819289771	DC	On-Demand	Anodyne	ADRB1	23	44
CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC[C@@H](O)c1cccnc1	ZINC000819289771	DC	On-Demand	Anodyne	ADRB3	91	46
CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819289772	DC	On-Demand	Anodyne	ADRB1	23	44
CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819289772	DC	On-Demand	Anodyne	ADRB3	91	46
CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC[C@H](O)c1cccnc1	ZINC000819289773	DC	On-Demand	Anodyne	ADRB1	23	44
CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC[C@H](O)c1cccnc1	ZINC000819289773	DC	On-Demand	Anodyne	ADRB3	91	46
CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC[C@H](O)c1cccnc1	ZINC000819289774	DC	On-Demand	Anodyne	ADRB1	23	44
CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC[C@H](O)c1cccnc1	ZINC000819289774	DC	On-Demand	Anodyne	ADRB3	91	46
COCCn1cc(CNC[C@H](O)c2ccc(F)cc2Cl)cn1	ZINC000819289775	EE	On-Demand	Anodyne	P2RX7	22	40
COCCn1cc(CNC[C@@H](O)c2ccc(F)cc2Cl)cn1	ZINC000819289776	EE	On-Demand	Anodyne	P2RX7	22	40
CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819289777	GD	On-Demand	Anodyne	ADRB3	17	40
CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819289778	GD	On-Demand	Anodyne	ADRB3	17	40
CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819289779	GD	On-Demand	Anodyne	ADRB3	17	40
CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819289780	GD	On-Demand	Anodyne	ADRB3	17	40
Cc1cc(F)ccc1[C@@H](O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289802	EI	On-Demand	Anodyne	HTR1A	22	52
Cc1cc(F)ccc1[C@@H](O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289802	EI	On-Demand	Anodyne	HTR1D	50	38
Cc1cc(F)ccc1[C@@H](O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289802	EI	On-Demand	Anodyne	HTR1B	42	39
Cc1cc(F)ccc1[C@@H](O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289802	EI	On-Demand	Anodyne	SLC6A4	26	62
Cc1cc(F)ccc1[C@@H](O)CNCCCc1c[nH]c2ccc(F)cc12	ZINC000819289802	EI	On-Demand	Anodyne	MPO	121	63
CSc1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819289808	GG	On-Demand	Anodyne	ADRB2	27	43
CSc1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819289808	GG	On-Demand	Anodyne	ADRB1	40	37
CSc1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819289808	GG	On-Demand	Anodyne	LUCI_PHOPY	57	39
CSc1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819289809	GG	On-Demand	Anodyne	ADRB2	27	43
CSc1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819289809	GG	On-Demand	Anodyne	ADRB1	40	37
CSc1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819289809	GG	On-Demand	Anodyne	LUCI_PHOPY	57	39
CSc1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819289810	GG	On-Demand	Anodyne	ADRB2	27	43
CSc1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819289810	GG	On-Demand	Anodyne	ADRB1	40	37
CSc1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819289810	GG	On-Demand	Anodyne	LUCI_PHOPY	57	39
CSc1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819289811	GG	On-Demand	Anodyne	ADRB2	27	43
CSc1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819289811	GG	On-Demand	Anodyne	ADRB1	40	37
CSc1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819289811	GG	On-Demand	Anodyne	LUCI_PHOPY	57	39
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819289814	FG	On-Demand	Bother	HTR1A	16	48
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819289814	FG	On-Demand	Bother	SLC6A4	20	53
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819289814	FG	On-Demand	Bother	ADRB3	34	48
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819289814	FG	On-Demand	Bother	MPO	111	53
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819289815	FG	On-Demand	Bother	HTR1A	16	48
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819289815	FG	On-Demand	Bother	SLC6A4	20	53
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819289815	FG	On-Demand	Bother	ADRB3	34	48
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)c1	ZINC000819289815	FG	On-Demand	Bother	MPO	111	53
COc1cc(NC(=O)/C=C/[C@@H]2CCCO2)ccc1S(=O)(=O)N1CCCC1	ZINC000819289832	GE	On-Demand	Anodyne	EPHX2	20	42
COc1cc(NC(=O)/C=C/[C@@H]2CCCO2)ccc1S(=O)(=O)N1CCCC1	ZINC000819289832	GE	On-Demand	Anodyne	F13A1	51	50
COc1cc(NC(=O)/C=C/[C@H]2CCCO2)ccc1S(=O)(=O)N1CCCC1	ZINC000819289833	GE	On-Demand	Anodyne	EPHX2	20	42
COc1cc(NC(=O)/C=C/[C@H]2CCCO2)ccc1S(=O)(=O)N1CCCC1	ZINC000819289833	GE	On-Demand	Anodyne	F13A1	51	50
COc1cc(NC(=O)/C=C\[C@H]2CCCO2)ccc1S(=O)(=O)N1CCCC1	ZINC000819289834	GE	On-Demand	Anodyne	EPHX2	20	42
COc1cc(NC(=O)/C=C\[C@H]2CCCO2)ccc1S(=O)(=O)N1CCCC1	ZINC000819289834	GE	On-Demand	Anodyne	F13A1	51	50
COc1cc(NC(=O)/C=C\[C@@H]2CCCO2)ccc1S(=O)(=O)N1CCCC1	ZINC000819289835	GE	On-Demand	Anodyne	EPHX2	20	42
COc1cc(NC(=O)/C=C\[C@@H]2CCCO2)ccc1S(=O)(=O)N1CCCC1	ZINC000819289835	GE	On-Demand	Anodyne	F13A1	51	50
CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819289840	GE	On-Demand	Anodyne	CACNA1B	50	31
CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819289841	GE	On-Demand	Anodyne	CACNA1B	50	31
CS(=O)(=O)NC[C@@H]1CCC[C@H]1NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819289842	GE	On-Demand	Anodyne	CACNA1B	50	31
CS(=O)(=O)NC[C@@H]1CCC[C@@H]1NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819289843	GE	On-Demand	Anodyne	CACNA1B	50	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cccc(F)c3F)CC1)C2	ZINC000819289856	GE	On-Demand	Anodyne	SSTR1	53	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cccc(F)c3F)CC1)C2	ZINC000819289857	GE	On-Demand	Anodyne	SSTR1	53	42
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289882	GH	On-Demand	Mild	ACE	30	41
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289882	GH	On-Demand	Mild	CELA1	23	44
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289882	GH	On-Demand	Mild	CMA1	32	40
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289882	GH	On-Demand	Mild	CTRA_BOVIN	41	31
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289882	GH	On-Demand	Mild	PAPA1_CARPA	50	46
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289882	GH	On-Demand	Mild	TRY1_BOVIN	27	40
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289882	GH	On-Demand	Mild	CTSK	26	40
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289882	GH	On-Demand	Mild	CTSL	20	46
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289882	GH	On-Demand	Mild	CELA2A	40	31
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289882	GH	On-Demand	Mild	REN	50	36
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289882	GH	On-Demand	Mild	CTSS	15	46
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289882	GH	On-Demand	Mild	FPR1	46	37
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289883	GH	On-Demand	Mild	ACE	30	41
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289883	GH	On-Demand	Mild	CELA1	23	44
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289883	GH	On-Demand	Mild	CMA1	32	40
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289883	GH	On-Demand	Mild	CTRA_BOVIN	41	31
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289883	GH	On-Demand	Mild	PAPA1_CARPA	50	46
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289883	GH	On-Demand	Mild	TRY1_BOVIN	27	40
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289883	GH	On-Demand	Mild	CTSK	26	40
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289883	GH	On-Demand	Mild	CTSL	20	46
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289883	GH	On-Demand	Mild	CELA2A	40	31
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289883	GH	On-Demand	Mild	REN	50	36
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289883	GH	On-Demand	Mild	CTSS	15	46
C[C@@H]1C[C@H](c2ccccc2)CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819289883	GH	On-Demand	Mild	FPR1	46	37
CCOC[C@H](O)CNC[C@@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819289896	CD	On-Demand	Anodyne	LUCI_PHOPY	73	37
CCOC[C@H](O)CNC[C@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819289898	CD	On-Demand	Anodyne	LUCI_PHOPY	73	37
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289926	GF	On-Demand	Anodyne	ADRB2	26	45
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289926	GF	On-Demand	Anodyne	HTR1A	18	48
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289926	GF	On-Demand	Anodyne	SLC6A4	21	56
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289926	GF	On-Demand	Anodyne	ADRB3	40	46
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289926	GF	On-Demand	Anodyne	MPO	112	57
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289927	GF	On-Demand	Anodyne	ADRB2	26	45
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289927	GF	On-Demand	Anodyne	HTR1A	18	48
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289927	GF	On-Demand	Anodyne	SLC6A4	21	56
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289927	GF	On-Demand	Anodyne	ADRB3	40	46
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2c[nH]c3ccc(F)cc23)cc1	ZINC000819289927	GF	On-Demand	Anodyne	MPO	112	57
O[C@H](CNCCc1cccc2[nH]ccc12)c1ccc(C(F)(F)F)cc1	ZINC000819289930	EI	On-Demand	Anodyne	ADRB3	24	48
O[C@@H](CNCCc1cccc2[nH]ccc12)c1ccc(C(F)(F)F)cc1	ZINC000819289931	EI	On-Demand	Anodyne	ADRB3	24	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(Oc3ccc(F)cc3)CC1)C2	ZINC000819289936	GG	On-Demand	Anodyne	EPHX2	22	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(Oc3ccc(F)cc3)CC1)C2	ZINC000819289937	GG	On-Demand	Anodyne	EPHX2	22	42
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819289968	FF	On-Demand	Anodyne	ADRB1	27	40
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819289968	FF	On-Demand	Anodyne	HDAC7	41	39
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819289968	FF	On-Demand	Anodyne	AMP1_PLAFQ	25	40
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819289968	FF	On-Demand	Anodyne	LEF	44	32
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819289968	FF	On-Demand	Anodyne	NPFFR1	23	42
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)Cc1ccc(F)cc1	ZINC000819289969	FF	On-Demand	Anodyne	ADRB1	27	40
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)Cc1ccc(F)cc1	ZINC000819289969	FF	On-Demand	Anodyne	HDAC7	41	39
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)Cc1ccc(F)cc1	ZINC000819289969	FF	On-Demand	Anodyne	AMP1_PLAFQ	25	40
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)Cc1ccc(F)cc1	ZINC000819289969	FF	On-Demand	Anodyne	LEF	44	32
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)Cc1ccc(F)cc1	ZINC000819289969	FF	On-Demand	Anodyne	NPFFR1	23	42
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819289970	FF	On-Demand	Anodyne	ADRB1	27	40
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819289970	FF	On-Demand	Anodyne	HDAC7	41	39
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819289970	FF	On-Demand	Anodyne	AMP1_PLAFQ	25	40
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819289970	FF	On-Demand	Anodyne	LEF	44	32
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819289970	FF	On-Demand	Anodyne	NPFFR1	23	42
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)Cc1ccc(F)cc1	ZINC000819289971	FF	On-Demand	Anodyne	ADRB1	27	40
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)Cc1ccc(F)cc1	ZINC000819289971	FF	On-Demand	Anodyne	HDAC7	41	39
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)Cc1ccc(F)cc1	ZINC000819289971	FF	On-Demand	Anodyne	AMP1_PLAFQ	25	40
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)Cc1ccc(F)cc1	ZINC000819289971	FF	On-Demand	Anodyne	LEF	44	32
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)Cc1ccc(F)cc1	ZINC000819289971	FF	On-Demand	Anodyne	NPFFR1	23	42
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819290015	FG	On-Demand	Anodyne	HDAC9	28	40
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819290015	FG	On-Demand	Anodyne	HDAC7	33	40
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819290017	FG	On-Demand	Anodyne	HDAC9	28	40
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819290017	FG	On-Demand	Anodyne	HDAC7	33	40
NS(=O)(=O)c1ccc2c(c1)N(C(=O)/C=C/[C@@H]1CCCO1)CC2	ZINC000819290029	DC	On-Demand	Anodyne	CA7	25	42
NS(=O)(=O)c1ccc2c(c1)N(C(=O)/C=C/[C@H]1CCCO1)CC2	ZINC000819290031	DC	On-Demand	Anodyne	CA7	25	42
NS(=O)(=O)c1ccc2c(c1)N(C(=O)/C=C\[C@@H]1CCCO1)CC2	ZINC000819290036	DC	On-Demand	Anodyne	CA7	25	42
NS(=O)(=O)c1ccc2c(c1)N(C(=O)/C=C\[C@H]1CCCO1)CC2	ZINC000819290038	DC	On-Demand	Anodyne	CA7	25	42
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1cccc2[nH]ccc12	ZINC000819290058	EF	On-Demand	Anodyne	NQO2	15	46
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1cccc2[nH]ccc12	ZINC000819290058	EF	On-Demand	Anodyne	CCKAR	58	38
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1cccc2[nH]ccc12	ZINC000819290060	EF	On-Demand	Anodyne	NQO2	15	46
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1cccc2[nH]ccc12	ZINC000819290060	EF	On-Demand	Anodyne	CCKAR	58	38
O=C(CCNCCS(=O)(=O)CCc1ccccc1)Nc1ccccc1F	ZINC000819290063	GE	On-Demand	Anodyne	CA5B	25	41
O=C(CCNCCS(=O)(=O)CCc1ccccc1)Nc1ccccc1F	ZINC000819290063	GE	On-Demand	Anodyne	CA5A	28	41
CN(C)c1ccc(NC(=O)CCNCCc2cccc3[nH]ccc23)cc1	ZINC000819290089	FG	On-Demand	Anodyne	HPGDS	27	47
CS(=O)(=O)c1cccc(C(=O)N2CCN(C(=O)C(F)=C3CCC3)CC2)c1	ZINC000819290134	GD	On-Demand	Anodyne	AKR1C3	49	40
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccc(F)c1	ZINC000819290141	EH	On-Demand	Anodyne	HTR1A	23	55
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccc(F)c1	ZINC000819290141	EH	On-Demand	Anodyne	HTR1D	50	38
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccc(F)c1	ZINC000819290141	EH	On-Demand	Anodyne	HTR1B	42	38
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccc(F)c1	ZINC000819290141	EH	On-Demand	Anodyne	SLC6A4	29	63
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccc(F)c1	ZINC000819290141	EH	On-Demand	Anodyne	ADRB3	46	55
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccc(F)c1	ZINC000819290141	EH	On-Demand	Anodyne	MPO	133	63
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccc(F)c1	ZINC000819290142	EH	On-Demand	Anodyne	HTR1A	23	55
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccc(F)c1	ZINC000819290142	EH	On-Demand	Anodyne	HTR1D	50	38
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccc(F)c1	ZINC000819290142	EH	On-Demand	Anodyne	HTR1B	42	38
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccc(F)c1	ZINC000819290142	EH	On-Demand	Anodyne	SLC6A4	29	63
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccc(F)c1	ZINC000819290142	EH	On-Demand	Anodyne	ADRB3	46	55
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1cccc(F)c1	ZINC000819290142	EH	On-Demand	Anodyne	MPO	133	63
CC(=O)Nc1cccc(CC(=O)NC[C@@H](C)C(C)(C)C)c1	ZINC000819290146	CF	On-Demand	Anodyne	KCNK3	70	33
CC(=O)Nc1cccc(CC(=O)NC[C@@H](C)C(C)(C)C)c1	ZINC000819290146	CF	On-Demand	Anodyne	KCNK9	52	33
CC(=O)Nc1cccc(CC(=O)NC[C@H](C)C(C)(C)C)c1	ZINC000819290147	CF	On-Demand	Anodyne	KCNK3	70	33
CC(=O)Nc1cccc(CC(=O)NC[C@H](C)C(C)(C)C)c1	ZINC000819290147	CF	On-Demand	Anodyne	KCNK9	52	33
O[C@H](CNCCc1cccc2[nH]ccc12)c1cccc(C(F)(F)F)c1	ZINC000819290170	EI	On-Demand	Anodyne	ADRB3	41	54
O[C@@H](CNCCc1cccc2[nH]ccc12)c1cccc(C(F)(F)F)c1	ZINC000819290171	EI	On-Demand	Anodyne	ADRB3	41	54
CCN(C(=O)/C=C\[C@@H]1CCCO1)[C@H](C)c1cccnc1	ZINC000819290207	CF	On-Demand	Anodyne	KCNA5	21	40
CCN(C(=O)/C=C/[C@@H]1CCCO1)[C@H](C)c1cccnc1	ZINC000819290208	CF	On-Demand	Anodyne	KCNA5	21	40
CCN(C(=O)/C=C/[C@@H]1CCCO1)[C@@H](C)c1cccnc1	ZINC000819290209	CF	On-Demand	Anodyne	KCNA5	21	40
CCN(C(=O)/C=C\[C@@H]1CCCO1)[C@@H](C)c1cccnc1	ZINC000819290210	CF	On-Demand	Anodyne	KCNA5	21	40
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1F	ZINC000819290215	EH	On-Demand	Anodyne	HTR1A	22	53
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1F	ZINC000819290215	EH	On-Demand	Anodyne	HTR1D	50	38
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1F	ZINC000819290215	EH	On-Demand	Anodyne	HTR1B	40	38
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1F	ZINC000819290215	EH	On-Demand	Anodyne	SLC6A4	26	67
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1F	ZINC000819290215	EH	On-Demand	Anodyne	MPO	133	67
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1F	ZINC000819290216	EH	On-Demand	Anodyne	HTR1A	22	53
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1F	ZINC000819290216	EH	On-Demand	Anodyne	HTR1D	50	38
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1F	ZINC000819290216	EH	On-Demand	Anodyne	HTR1B	40	38
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1F	ZINC000819290216	EH	On-Demand	Anodyne	SLC6A4	26	67
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1ccc(F)cc1F	ZINC000819290216	EH	On-Demand	Anodyne	MPO	133	67
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1c(F)cccc1F	ZINC000819290280	EH	On-Demand	Anodyne	HTR1A	24	55
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1c(F)cccc1F	ZINC000819290280	EH	On-Demand	Anodyne	HTR1D	53	36
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1c(F)cccc1F	ZINC000819290280	EH	On-Demand	Anodyne	HTR1B	42	37
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1c(F)cccc1F	ZINC000819290280	EH	On-Demand	Anodyne	SLC6A4	29	63
O[C@H](CNCCCc1c[nH]c2ccc(F)cc12)c1c(F)cccc1F	ZINC000819290280	EH	On-Demand	Anodyne	MPO	139	63
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1c(F)cccc1F	ZINC000819290281	EH	On-Demand	Anodyne	HTR1A	24	55
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1c(F)cccc1F	ZINC000819290281	EH	On-Demand	Anodyne	HTR1D	53	36
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1c(F)cccc1F	ZINC000819290281	EH	On-Demand	Anodyne	HTR1B	42	37
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1c(F)cccc1F	ZINC000819290281	EH	On-Demand	Anodyne	SLC6A4	29	63
O[C@@H](CNCCCc1c[nH]c2ccc(F)cc12)c1c(F)cccc1F	ZINC000819290281	EH	On-Demand	Anodyne	MPO	139	63
O[C@H](CNCCc1cccc2[nH]ccc12)c1ccc(OC(F)(F)F)cc1	ZINC000819290301	FH	On-Demand	Anodyne	ADRB2	53	39
O[C@H](CNCCc1cccc2[nH]ccc12)c1ccc(OC(F)(F)F)cc1	ZINC000819290301	FH	On-Demand	Anodyne	ADRB3	34	47
O[C@@H](CNCCc1cccc2[nH]ccc12)c1ccc(OC(F)(F)F)cc1	ZINC000819290302	FH	On-Demand	Anodyne	ADRB2	53	39
O[C@@H](CNCCc1cccc2[nH]ccc12)c1ccc(OC(F)(F)F)cc1	ZINC000819290302	FH	On-Demand	Anodyne	ADRB3	34	47
CCC[C@H]1SCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819290312	FG	On-Demand	Mild	PAPA1_CARPA	30	43
CCC[C@H]1SCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819290313	FG	On-Demand	Mild	PAPA1_CARPA	30	43
O=[N+]([O-])c1cccc([C@@H](O)CNCC2CCC(F)(F)CC2)c1	ZINC000819290339	DG	On-Demand	Bother	CACNA1C	51	36
O=[N+]([O-])c1cccc([C@@H](O)CNCC2CCC(F)(F)CC2)c1	ZINC000819290339	DG	On-Demand	Bother	CACNA1D	80	36
O=[N+]([O-])c1cccc([C@H](O)CNCC2CCC(F)(F)CC2)c1	ZINC000819290340	DG	On-Demand	Bother	CACNA1C	51	36
O=[N+]([O-])c1cccc([C@H](O)CNCC2CCC(F)(F)CC2)c1	ZINC000819290340	DG	On-Demand	Bother	CACNA1D	80	36
Cc1cc(F)ccc1[C@@H](O)CNCCS(=O)(=O)CCc1ccccc1	ZINC000819290370	FE	On-Demand	Anodyne	ADRB2	62	39
Cc1cc(F)ccc1[C@@H](O)CNCCS(=O)(=O)CCc1ccccc1	ZINC000819290370	FE	On-Demand	Anodyne	ADRB1	50	39
Cc1cc(F)ccc1[C@@H](O)CNCCS(=O)(=O)CCc1ccccc1	ZINC000819290370	FE	On-Demand	Anodyne	ADRB3	53	38
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc3[nH]ccc3c2)cc1	ZINC000819290395	FE	On-Demand	Anodyne	ADRB2	63	46
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc3[nH]ccc3c2)cc1	ZINC000819290395	FE	On-Demand	Anodyne	ADRB1	60	39
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc3[nH]ccc3c2)cc1	ZINC000819290395	FE	On-Demand	Anodyne	ADRB3	128	45
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)c1cc(F)ccc1F	ZINC000819290396	FF	On-Demand	Anodyne	HDAC9	29	41
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)c1cc(F)ccc1F	ZINC000819290396	FF	On-Demand	Anodyne	HDAC7	34	41
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1cc(F)ccc1F	ZINC000819290397	FF	On-Demand	Anodyne	HDAC9	29	41
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1cc(F)ccc1F	ZINC000819290397	FF	On-Demand	Anodyne	HDAC7	34	41
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc3[nH]ccc3c2)cc1	ZINC000819290398	FE	On-Demand	Anodyne	ADRB2	63	46
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc3[nH]ccc3c2)cc1	ZINC000819290398	FE	On-Demand	Anodyne	ADRB1	60	39
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc3[nH]ccc3c2)cc1	ZINC000819290398	FE	On-Demand	Anodyne	ADRB3	128	45
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)c1cc(F)ccc1F	ZINC000819290399	FF	On-Demand	Anodyne	HDAC9	29	41
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)c1cc(F)ccc1F	ZINC000819290399	FF	On-Demand	Anodyne	HDAC7	34	41
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1cc(F)ccc1F	ZINC000819290401	FF	On-Demand	Anodyne	HDAC9	29	41
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1cc(F)ccc1F	ZINC000819290401	FF	On-Demand	Anodyne	HDAC7	34	41
Cc1cccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1C	ZINC000819290402	FI	On-Demand	Mild	PAPA1_CARPA	45	45
Cc1cccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1C	ZINC000819290402	FI	On-Demand	Mild	CTSK	19	44
Cc1cccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1C	ZINC000819290402	FI	On-Demand	Mild	FPR1	50	42
Cc1cccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1C	ZINC000819290405	FI	On-Demand	Mild	PAPA1_CARPA	45	45
Cc1cccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1C	ZINC000819290405	FI	On-Demand	Mild	CTSK	19	44
Cc1cccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1C	ZINC000819290405	FI	On-Demand	Mild	FPR1	50	42
COc1ccc(OC)c([C@H](O)CNCCc2ccc3[nH]ccc3c2)c1	ZINC000819290421	EG	On-Demand	Anodyne	ADRB2	45	51
COc1ccc(OC)c([C@H](O)CNCCc2ccc3[nH]ccc3c2)c1	ZINC000819290421	EG	On-Demand	Anodyne	ADRB1	44	44
COc1ccc(OC)c([C@H](O)CNCCc2ccc3[nH]ccc3c2)c1	ZINC000819290421	EG	On-Demand	Anodyne	ADRB3	33	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290430	EF	On-Demand	Anodyne	ADRB2	36	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290430	EF	On-Demand	Anodyne	ADRB1	55	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290430	EF	On-Demand	Anodyne	ADRB3	32	42
CC(=O)c1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290432	EF	On-Demand	Anodyne	ADRB2	36	42
CC(=O)c1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290432	EF	On-Demand	Anodyne	ADRB1	55	42
CC(=O)c1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290432	EF	On-Demand	Anodyne	ADRB3	32	42
CC[C@@H](O)CNCCCNC(=O)/C=C/c1ccccc1	ZINC000819290449	CD	On-Demand	Anodyne	HDAC1	18	45
CC[C@@H](O)CNCCCNC(=O)/C=C/c1ccccc1	ZINC000819290449	CD	On-Demand	Anodyne	HDAC2	19	45
CC[C@@H](O)CNCCCNC(=O)/C=C/c1ccccc1	ZINC000819290449	CD	On-Demand	Anodyne	HDAC4	19	45
CC[C@@H](O)CNCCCNC(=O)/C=C/c1ccccc1	ZINC000819290449	CD	On-Demand	Anodyne	HDAC6	24	45
CC[C@@H](O)CNCCCNC(=O)/C=C/c1ccccc1	ZINC000819290449	CD	On-Demand	Anodyne	HDAC9	41	45
CC[C@@H](O)CNCCCNC(=O)/C=C/c1ccccc1	ZINC000819290449	CD	On-Demand	Anodyne	HDAC7	44	45
CC[C@@H](O)CNCCCNC(=O)/C=C\c1ccccc1	ZINC000819290451	CD	On-Demand	Anodyne	HDAC1	18	45
CC[C@@H](O)CNCCCNC(=O)/C=C\c1ccccc1	ZINC000819290451	CD	On-Demand	Anodyne	HDAC2	19	45
CC[C@@H](O)CNCCCNC(=O)/C=C\c1ccccc1	ZINC000819290451	CD	On-Demand	Anodyne	HDAC4	19	45
CC[C@@H](O)CNCCCNC(=O)/C=C\c1ccccc1	ZINC000819290451	CD	On-Demand	Anodyne	HDAC6	24	45
CC[C@@H](O)CNCCCNC(=O)/C=C\c1ccccc1	ZINC000819290451	CD	On-Demand	Anodyne	HDAC9	41	45
CC[C@@H](O)CNCCCNC(=O)/C=C\c1ccccc1	ZINC000819290451	CD	On-Demand	Anodyne	HDAC7	44	45
Cc1cc(Cl)nc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819290477	DH	On-Demand	Anodyne	ADRB1	28	42
Cc1cc(Cl)nc(CNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819290477	DH	On-Demand	Anodyne	ADRB3	42	42
Cc1cc(Cl)nc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819290479	DH	On-Demand	Anodyne	ADRB1	28	42
Cc1cc(Cl)nc(CNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819290479	DH	On-Demand	Anodyne	ADRB3	42	42
O=S(=O)(CCNC[C@@H](O)c1ccc(Cl)c(F)c1)CCc1ccccc1	ZINC000819290489	GF	On-Demand	Anodyne	ADRB2	56	42
O=S(=O)(CCNC[C@@H](O)c1ccc(Cl)c(F)c1)CCc1ccccc1	ZINC000819290489	GF	On-Demand	Anodyne	ADRB1	52	44
O=S(=O)(CCNC[C@@H](O)c1ccc(Cl)c(F)c1)CCc1ccccc1	ZINC000819290489	GF	On-Demand	Anodyne	ADRB3	101	44
O=S(=O)(CCNC[C@H](O)c1ccc(Cl)c(F)c1)CCc1ccccc1	ZINC000819290490	GF	On-Demand	Anodyne	ADRB2	56	42
O=S(=O)(CCNC[C@H](O)c1ccc(Cl)c(F)c1)CCc1ccccc1	ZINC000819290490	GF	On-Demand	Anodyne	ADRB1	52	44
O=S(=O)(CCNC[C@H](O)c1ccc(Cl)c(F)c1)CCc1ccccc1	ZINC000819290490	GF	On-Demand	Anodyne	ADRB3	101	44
Cc1cc(Cl)nc(CNC[C@H](O)COc2cccc3ccccc23)c1	ZINC000819290523	FH	On-Demand	Anodyne	ADRB2	29	58
Cc1cc(Cl)nc(CNC[C@H](O)COc2cccc3ccccc23)c1	ZINC000819290523	FH	On-Demand	Anodyne	ADRB1	46	37
Cc1cc(Cl)nc(CNC[C@H](O)COc2cccc3ccccc23)c1	ZINC000819290523	FH	On-Demand	Anodyne	CYP2D6	18	42
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cccc3ccccc23)c1	ZINC000819290525	FH	On-Demand	Anodyne	ADRB2	29	58
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cccc3ccccc23)c1	ZINC000819290525	FH	On-Demand	Anodyne	ADRB1	46	37
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cccc3ccccc23)c1	ZINC000819290525	FH	On-Demand	Anodyne	CYP2D6	18	42
CO[C@H]1CCCC[C@@H]1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819290528	FF	On-Demand	Anodyne	GPR119	25	43
CO[C@H]1CCCC[C@@H]1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819290530	FF	On-Demand	Anodyne	GPR119	25	43
CC(=O)Nc1cccc(CC(=O)NNC(=O)NCCNC(=O)OC(C)(C)C)c1	ZINC000819290531	GD	On-Demand	Reactive	NQO2	20	43
C=C(C)C(C)(C)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000819290546	DG	On-Demand	Mild	CTSK	15	43
C=C(C)C(C)(C)C(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000819290548	DG	On-Demand	Mild	CTSK	15	43
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc3ccccc3c2)c1	ZINC000819290575	FH	On-Demand	Anodyne	ADRB2	38	54
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc3ccccc3c2)c1	ZINC000819290575	FH	On-Demand	Anodyne	ADRB1	38	41
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc3ccccc3c2)c1	ZINC000819290575	FH	On-Demand	Anodyne	ADRB3	26	41
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc3ccccc3c2)c1	ZINC000819290576	FH	On-Demand	Anodyne	ADRB2	38	54
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc3ccccc3c2)c1	ZINC000819290576	FH	On-Demand	Anodyne	ADRB1	38	41
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc3ccccc3c2)c1	ZINC000819290576	FH	On-Demand	Anodyne	ADRB3	26	41
O=[N+]([O-])c1cccc([C@H](O)CNCCS(=O)(=O)CCc2ccccc2)c1	ZINC000819290592	GD	On-Demand	Bother	ADRB2	46	41
O=[N+]([O-])c1cccc([C@H](O)CNCCS(=O)(=O)CCc2ccccc2)c1	ZINC000819290592	GD	On-Demand	Bother	ADRB1	51	41
O=[N+]([O-])c1cccc([C@H](O)CNCCS(=O)(=O)CCc2ccccc2)c1	ZINC000819290592	GD	On-Demand	Bother	ADRB3	106	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCS(=O)(=O)CCc2ccccc2)c1	ZINC000819290593	GD	On-Demand	Bother	ADRB2	46	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCS(=O)(=O)CCc2ccccc2)c1	ZINC000819290593	GD	On-Demand	Bother	ADRB1	51	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCS(=O)(=O)CCc2ccccc2)c1	ZINC000819290593	GD	On-Demand	Bother	ADRB3	106	41
O=C(CCNCCS(=O)(=O)CCc1ccccc1)Nc1cccnc1	ZINC000819290594	FD	On-Demand	Anodyne	ADRB3	32	44
O=C(CCNCCS(=O)(=O)CCc1ccccc1)Nc1cccnc1	ZINC000819290594	FD	On-Demand	Anodyne	TBXAS1	53	40
O=C(CCNCCS(=O)(=O)CCc1ccccc1)Nc1cccnc1	ZINC000819290594	FD	On-Demand	Anodyne	NAMPT	44	51
Cc1cc(Cl)nc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819290604	DF	On-Demand	Bother	CACNA1D	57	33
Cc1cc(Cl)nc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819290606	DF	On-Demand	Bother	CACNA1D	57	33
CC(=O)Nc1cccc(CC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C)c1	ZINC000819290628	GF	On-Demand	Anodyne	PAPA1_CARPA	42	38
CC(=O)Nc1cccc(CC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C)c1	ZINC000819290628	GF	On-Demand	Anodyne	FPR1	45	35
CC(=O)Nc1cccc(CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)C)c1	ZINC000819290630	GF	On-Demand	Anodyne	PAPA1_CARPA	42	38
CC(=O)Nc1cccc(CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)C)c1	ZINC000819290630	GF	On-Demand	Anodyne	FPR1	45	35
O[C@@H](CNC[C@H]1CCCC(F)(F)C1)c1ccccc1Cl	ZINC000819290691	DH	On-Demand	Anodyne	OPRL1	41	40
O[C@@H](CNC[C@@H]1CCCC(F)(F)C1)c1ccccc1Cl	ZINC000819290693	DH	On-Demand	Anodyne	OPRL1	41	40
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819290710	GH	On-Demand	Anodyne	HDAC9	27	40
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819290710	GH	On-Demand	Anodyne	HDAC7	32	40
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819290712	GH	On-Demand	Anodyne	HDAC9	27	40
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819290712	GH	On-Demand	Anodyne	HDAC7	32	40
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819290713	GH	On-Demand	Anodyne	HDAC9	27	40
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819290713	GH	On-Demand	Anodyne	HDAC7	32	40
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819290714	GH	On-Demand	Anodyne	HDAC9	27	40
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819290714	GH	On-Demand	Anodyne	HDAC7	32	40
O=S(=O)(CCNC[C@H](O)c1cccnc1)CCc1ccccc1	ZINC000819290738	ED	On-Demand	Anodyne	ADRB2	62	59
O=S(=O)(CCNC[C@H](O)c1cccnc1)CCc1ccccc1	ZINC000819290738	ED	On-Demand	Anodyne	ADRB1	74	55
O=S(=O)(CCNC[C@H](O)c1cccnc1)CCc1ccccc1	ZINC000819290738	ED	On-Demand	Anodyne	ADRB3	177	63
O=S(=O)(CCNC[C@H](O)c1cccnc1)CCc1ccccc1	ZINC000819290738	ED	On-Demand	Anodyne	KCNA5	20	44
O=S(=O)(CCNC[C@@H](O)c1cccnc1)CCc1ccccc1	ZINC000819290739	ED	On-Demand	Anodyne	ADRB2	62	59
O=S(=O)(CCNC[C@@H](O)c1cccnc1)CCc1ccccc1	ZINC000819290739	ED	On-Demand	Anodyne	ADRB1	74	55
O=S(=O)(CCNC[C@@H](O)c1cccnc1)CCc1ccccc1	ZINC000819290739	ED	On-Demand	Anodyne	ADRB3	177	63
O=S(=O)(CCNC[C@@H](O)c1cccnc1)CCc1ccccc1	ZINC000819290739	ED	On-Demand	Anodyne	KCNA5	20	44
C#CCNC(=O)CCNCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1	ZINC000819290774	EF	On-Demand	Mild	DPP7	32	43
C#CCNC(=O)CCNCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1	ZINC000819290775	EF	On-Demand	Mild	DPP7	32	43
COc1cccc(OC)c1OC[C@@H](O)CNCc1cc(C)cc(Cl)n1	ZINC000819290778	FF	On-Demand	Anodyne	ADRB2	24	41
COc1cccc(OC)c1OC[C@H](O)CNCc1cc(C)cc(Cl)n1	ZINC000819290779	FF	On-Demand	Anodyne	ADRB2	24	41
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290782	FF	On-Demand	Anodyne	ADRB2	45	53
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290782	FF	On-Demand	Anodyne	ADRB1	75	53
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290782	FF	On-Demand	Anodyne	GRIN1	29	44
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290782	FF	On-Demand	Anodyne	ADRB3	51	51
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290783	FF	On-Demand	Anodyne	ADRB2	45	53
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290783	FF	On-Demand	Anodyne	ADRB1	75	53
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290783	FF	On-Demand	Anodyne	GRIN1	29	44
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290783	FF	On-Demand	Anodyne	ADRB3	51	51
O[C@H](CNCCc1ccc2[nH]ccc2c1)c1ccccc1C(F)(F)F	ZINC000819290793	EI	On-Demand	Anodyne	ADRB2	44	36
O[C@H](CNCCc1ccc2[nH]ccc2c1)c1ccccc1C(F)(F)F	ZINC000819290793	EI	On-Demand	Anodyne	ADRB1	40	36
O[C@H](CNCCc1ccc2[nH]ccc2c1)c1ccccc1C(F)(F)F	ZINC000819290793	EI	On-Demand	Anodyne	ADRB3	51	37
O[C@@H](CNCCc1ccc2[nH]ccc2c1)c1ccccc1C(F)(F)F	ZINC000819290794	EI	On-Demand	Anodyne	ADRB2	44	36
O[C@@H](CNCCc1ccc2[nH]ccc2c1)c1ccccc1C(F)(F)F	ZINC000819290794	EI	On-Demand	Anodyne	ADRB1	40	36
O[C@@H](CNCCc1ccc2[nH]ccc2c1)c1ccccc1C(F)(F)F	ZINC000819290794	EI	On-Demand	Anodyne	ADRB3	51	37
O[C@H](CNCCc1ccc2[nH]ccc2c1)c1ccc(OC(F)(F)F)cc1	ZINC000819290795	FH	On-Demand	Anodyne	ADRB2	47	42
O[C@H](CNCCc1ccc2[nH]ccc2c1)c1ccc(OC(F)(F)F)cc1	ZINC000819290795	FH	On-Demand	Anodyne	ADRB1	45	37
O[C@H](CNCCc1ccc2[nH]ccc2c1)c1ccc(OC(F)(F)F)cc1	ZINC000819290795	FH	On-Demand	Anodyne	ADRB3	60	46
O[C@@H](CNCCc1ccc2[nH]ccc2c1)c1ccc(OC(F)(F)F)cc1	ZINC000819290796	FH	On-Demand	Anodyne	ADRB2	47	42
O[C@@H](CNCCc1ccc2[nH]ccc2c1)c1ccc(OC(F)(F)F)cc1	ZINC000819290796	FH	On-Demand	Anodyne	ADRB1	45	37
O[C@@H](CNCCc1ccc2[nH]ccc2c1)c1ccc(OC(F)(F)F)cc1	ZINC000819290796	FH	On-Demand	Anodyne	ADRB3	60	46
Cc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290833	DF	On-Demand	Anodyne	ADRB2	39	50
Cc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290833	DF	On-Demand	Anodyne	ADRB1	50	41
Cc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290833	DF	On-Demand	Anodyne	GRIN1	21	40
Cc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290833	DF	On-Demand	Anodyne	ADRB3	29	41
Cc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290834	DF	On-Demand	Anodyne	ADRB2	39	50
Cc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290834	DF	On-Demand	Anodyne	ADRB1	50	41
Cc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290834	DF	On-Demand	Anodyne	GRIN1	21	40
Cc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290834	DF	On-Demand	Anodyne	ADRB3	29	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cc(S(N)(=O)=O)ccc1F)C2	ZINC000819290864	GC	On-Demand	Anodyne	CA5A	40	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cc(S(N)(=O)=O)ccc1F)C2	ZINC000819290865	GC	On-Demand	Anodyne	CA5A	40	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCc2ccc(S(N)(=O)=O)cc21	ZINC000819290866	GD	On-Demand	Anodyne	CA7	33	42
CC[C@H](O)CNCCS(=O)(=O)CCc1ccccc1	ZINC000819290873	CD	On-Demand	Anodyne	ADRB2	41	45
CC[C@H](O)CNCCS(=O)(=O)CCc1ccccc1	ZINC000819290873	CD	On-Demand	Anodyne	ADRB1	47	45
CC[C@H](O)CNCCS(=O)(=O)CCc1ccccc1	ZINC000819290873	CD	On-Demand	Anodyne	ADRB3	55	45
CC[C@H](O)CNCCS(=O)(=O)CCc1ccccc1	ZINC000819290873	CD	On-Demand	Anodyne	ABCB1	15	45
CC[C@@H](O)CNCCS(=O)(=O)CCc1ccccc1	ZINC000819290874	CD	On-Demand	Anodyne	ADRB2	41	45
CC[C@@H](O)CNCCS(=O)(=O)CCc1ccccc1	ZINC000819290874	CD	On-Demand	Anodyne	ADRB1	47	45
CC[C@@H](O)CNCCS(=O)(=O)CCc1ccccc1	ZINC000819290874	CD	On-Demand	Anodyne	ADRB3	55	45
CC[C@@H](O)CNCCS(=O)(=O)CCc1ccccc1	ZINC000819290874	CD	On-Demand	Anodyne	ABCB1	15	45
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N(C)C)cc2C)c1	ZINC000819290885	EF	On-Demand	Clean	KCNK3	50	42
COC[C@@H](O)CNCCS(=O)(=O)CCc1ccccc1	ZINC000819290886	DC	On-Demand	Anodyne	ADRB2	64	48
COC[C@@H](O)CNCCS(=O)(=O)CCc1ccccc1	ZINC000819290886	DC	On-Demand	Anodyne	ADRB1	80	48
COC[C@@H](O)CNCCS(=O)(=O)CCc1ccccc1	ZINC000819290886	DC	On-Demand	Anodyne	ADRB3	66	48
COC[C@@H](O)CNCCS(=O)(=O)CCc1ccccc1	ZINC000819290886	DC	On-Demand	Anodyne	ABCB1	27	47
O=S(=O)(CCNC[C@H](O)CC1CCCC1)CCc1ccccc1	ZINC000819290900	EE	On-Demand	Anodyne	ADRB2	36	42
O=S(=O)(CCNC[C@H](O)CC1CCCC1)CCc1ccccc1	ZINC000819290900	EE	On-Demand	Anodyne	ADRB1	55	46
O=S(=O)(CCNC[C@H](O)CC1CCCC1)CCc1ccccc1	ZINC000819290900	EE	On-Demand	Anodyne	ADRB3	50	42
O=S(=O)(CCNC[C@@H](O)CC1CCCC1)CCc1ccccc1	ZINC000819290901	EE	On-Demand	Anodyne	ADRB2	36	42
O=S(=O)(CCNC[C@@H](O)CC1CCCC1)CCc1ccccc1	ZINC000819290901	EE	On-Demand	Anodyne	ADRB1	55	46
O=S(=O)(CCNC[C@@H](O)CC1CCCC1)CCc1ccccc1	ZINC000819290901	EE	On-Demand	Anodyne	ADRB3	50	42
O=S(=O)(CCNC[C@H](O)c1ccc(Cl)cc1)CCc1ccccc1	ZINC000819290902	FF	On-Demand	Anodyne	ADRB2	56	46
O=S(=O)(CCNC[C@H](O)c1ccc(Cl)cc1)CCc1ccccc1	ZINC000819290902	FF	On-Demand	Anodyne	ADRB1	66	44
O=S(=O)(CCNC[C@H](O)c1ccc(Cl)cc1)CCc1ccccc1	ZINC000819290902	FF	On-Demand	Anodyne	ADRB3	110	44
CC(C)(C)OC(=O)N1CC(NC(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819290907	FF	On-Demand	Anodyne	GPR119	21	40
O=S(=O)(CCNC[C@H](O)c1c(F)cccc1F)CCc1ccccc1	ZINC000819290918	FE	On-Demand	Anodyne	ADRB3	48	37
O=S(=O)(CCNC[C@@H](O)c1c(F)cccc1F)CCc1ccccc1	ZINC000819290919	FE	On-Demand	Anodyne	ADRB3	48	37
O[C@@H](CNCCOc1ccc(I)cc1)c1ccccc1	ZINC000819290925	GF	On-Demand	Anodyne	ADRB2	41	53
O[C@@H](CNCCOc1ccc(I)cc1)c1ccccc1	ZINC000819290925	GF	On-Demand	Anodyne	ADRB1	66	55
O[C@@H](CNCCOc1ccc(I)cc1)c1ccccc1	ZINC000819290925	GF	On-Demand	Anodyne	DRD4	19	43
O[C@@H](CNCCOc1ccc(I)cc1)c1ccccc1	ZINC000819290925	GF	On-Demand	Anodyne	ADRB3	75	55
O[C@@H](CNCCOc1ccc(I)cc1)c1ccccc1	ZINC000819290925	GF	On-Demand	Anodyne	AOC3	15	43
O[C@H](CNCCOc1ccc(I)cc1)c1ccccc1	ZINC000819290926	GF	On-Demand	Anodyne	ADRB2	41	53
O[C@H](CNCCOc1ccc(I)cc1)c1ccccc1	ZINC000819290926	GF	On-Demand	Anodyne	ADRB1	66	55
O[C@H](CNCCOc1ccc(I)cc1)c1ccccc1	ZINC000819290926	GF	On-Demand	Anodyne	DRD4	19	43
O[C@H](CNCCOc1ccc(I)cc1)c1ccccc1	ZINC000819290926	GF	On-Demand	Anodyne	ADRB3	75	55
O[C@H](CNCCOc1ccc(I)cc1)c1ccccc1	ZINC000819290926	GF	On-Demand	Anodyne	AOC3	15	43
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)c1c(F)cccc1F	ZINC000819290927	FF	On-Demand	Anodyne	HDAC9	28	40
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)c1c(F)cccc1F	ZINC000819290927	FF	On-Demand	Anodyne	HDAC7	33	40
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1c(F)cccc1F	ZINC000819290928	FF	On-Demand	Anodyne	HDAC9	28	40
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1c(F)cccc1F	ZINC000819290928	FF	On-Demand	Anodyne	HDAC7	33	40
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)c1c(F)cccc1F	ZINC000819290929	FF	On-Demand	Anodyne	HDAC9	28	40
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)c1c(F)cccc1F	ZINC000819290929	FF	On-Demand	Anodyne	HDAC7	33	40
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1c(F)cccc1F	ZINC000819290930	FF	On-Demand	Anodyne	HDAC9	28	40
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1c(F)cccc1F	ZINC000819290930	FF	On-Demand	Anodyne	HDAC7	33	40
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)c1	ZINC000819290931	FF	On-Demand	Anodyne	LUCI_PHOPY	70	46
COc1ccc(OC)c([C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)c1	ZINC000819290934	FF	On-Demand	Anodyne	LUCI_PHOPY	70	46
O=C(CCNCCS(=O)(=O)CCc1ccccc1)Nc1ccccc1	ZINC000819290935	FE	On-Demand	Anodyne	CA2	15	43
O=C(CCNCCS(=O)(=O)CCc1ccccc1)Nc1ccccc1	ZINC000819290935	FE	On-Demand	Anodyne	HDAC8	15	42
O=C(CCNCCS(=O)(=O)CCc1ccccc1)Nc1ccccc1	ZINC000819290935	FE	On-Demand	Anodyne	HDAC10	15	42
O=C(CCNCCS(=O)(=O)CCc1ccccc1)Nc1ccccc1	ZINC000819290935	FE	On-Demand	Anodyne	CA5B	39	42
O=C(CCNCCS(=O)(=O)CCc1ccccc1)Nc1ccccc1	ZINC000819290935	FE	On-Demand	Anodyne	CA5A	45	42
O=C(CCNCCS(=O)(=O)CCc1ccccc1)Nc1ccccc1	ZINC000819290935	FE	On-Demand	Anodyne	HDAC2	15	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819290936	GE	On-Demand	Anodyne	ADRB2	39	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819290936	GE	On-Demand	Anodyne	ADRB1	61	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819290936	GE	On-Demand	Anodyne	ADRB3	38	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819290936	GE	On-Demand	Anodyne	LUCI_PHOPY	56	41
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819290937	GE	On-Demand	Anodyne	ADRB2	39	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819290937	GE	On-Demand	Anodyne	ADRB1	61	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819290937	GE	On-Demand	Anodyne	ADRB3	38	42
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819290937	GE	On-Demand	Anodyne	LUCI_PHOPY	56	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819290938	GE	On-Demand	Anodyne	ADRB2	39	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819290938	GE	On-Demand	Anodyne	ADRB1	61	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819290938	GE	On-Demand	Anodyne	ADRB3	38	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819290938	GE	On-Demand	Anodyne	LUCI_PHOPY	56	41
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819290939	GE	On-Demand	Anodyne	ADRB2	39	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819290939	GE	On-Demand	Anodyne	ADRB1	61	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819290939	GE	On-Demand	Anodyne	ADRB3	38	42
COC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819290939	GE	On-Demand	Anodyne	LUCI_PHOPY	56	41
O=S(=O)(CCNC[C@@H](O)c1cc(F)ccc1F)CCc1ccccc1	ZINC000819290948	FE	On-Demand	Anodyne	ADRB2	46	40
O=S(=O)(CCNC[C@@H](O)c1cc(F)ccc1F)CCc1ccccc1	ZINC000819290948	FE	On-Demand	Anodyne	ADRB1	46	40
O=S(=O)(CCNC[C@@H](O)c1cc(F)ccc1F)CCc1ccccc1	ZINC000819290948	FE	On-Demand	Anodyne	ADRB3	54	39
O=S(=O)(CCNC[C@H](O)c1cc(F)ccc1F)CCc1ccccc1	ZINC000819290949	FE	On-Demand	Anodyne	ADRB2	46	40
O=S(=O)(CCNC[C@H](O)c1cc(F)ccc1F)CCc1ccccc1	ZINC000819290949	FE	On-Demand	Anodyne	ADRB1	46	40
O=S(=O)(CCNC[C@H](O)c1cc(F)ccc1F)CCc1ccccc1	ZINC000819290949	FE	On-Demand	Anodyne	ADRB3	54	39
COCc1csc(NC(=O)C[S@@](=O)c2cccc(OC)c2)n1	ZINC000819290954	EE	On-Demand	Anodyne	CSNK1D	19	40
COCc1csc(NC(=O)C[S@](=O)c2cccc(OC)c2)n1	ZINC000819290955	EE	On-Demand	Anodyne	CSNK1D	19	40
Cc1cc(Cl)nc(CNC[C@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819290965	EG	On-Demand	Anodyne	ADRB2	20	56
Cc1cc(Cl)nc(CNC[C@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819290965	EG	On-Demand	Anodyne	ADRB1	23	56
Cc1cc(Cl)nc(CNC[C@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819290965	EG	On-Demand	Anodyne	SLC6A4	16	41
Cc1cc(Cl)nc(CNC[C@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819290965	EG	On-Demand	Anodyne	CYP2D6	17	40
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819290966	EG	On-Demand	Anodyne	ADRB2	20	56
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819290966	EG	On-Demand	Anodyne	ADRB1	23	56
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819290966	EG	On-Demand	Anodyne	SLC6A4	16	41
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819290966	EG	On-Demand	Anodyne	CYP2D6	17	40
CCOc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290985	FF	On-Demand	Anodyne	ADRB2	36	44
CCOc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290985	FF	On-Demand	Anodyne	ADRB1	44	41
CCOc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290985	FF	On-Demand	Anodyne	GRIN1	19	40
CCOc1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290985	FF	On-Demand	Anodyne	ADRB3	26	40
CCOc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290986	FF	On-Demand	Anodyne	ADRB2	36	44
CCOc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290986	FF	On-Demand	Anodyne	ADRB1	44	41
CCOc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290986	FF	On-Demand	Anodyne	GRIN1	19	40
CCOc1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819290986	FF	On-Demand	Anodyne	ADRB3	26	40
CCSCCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819291013	CE	On-Demand	Bother	ADRB1	42	40
CCSCCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819291013	CE	On-Demand	Bother	ADRB3	50	40
CCSCCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819291014	CE	On-Demand	Bother	ADRB1	42	40
CCSCCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819291014	CE	On-Demand	Bother	ADRB3	50	40
O[C@H](CNCCc1ccc2[nH]ccc2c1)c1cccc(C(F)(F)F)c1	ZINC000819291028	EI	On-Demand	Anodyne	ADRB2	41	42
O[C@H](CNCCc1ccc2[nH]ccc2c1)c1cccc(C(F)(F)F)c1	ZINC000819291028	EI	On-Demand	Anodyne	ADRB1	42	42
O[C@H](CNCCc1ccc2[nH]ccc2c1)c1cccc(C(F)(F)F)c1	ZINC000819291028	EI	On-Demand	Anodyne	ADRB3	80	42
O[C@@H](CNCCc1ccc2[nH]ccc2c1)c1cccc(C(F)(F)F)c1	ZINC000819291029	EI	On-Demand	Anodyne	ADRB2	41	42
O[C@@H](CNCCc1ccc2[nH]ccc2c1)c1cccc(C(F)(F)F)c1	ZINC000819291029	EI	On-Demand	Anodyne	ADRB1	42	42
O[C@@H](CNCCc1ccc2[nH]ccc2c1)c1cccc(C(F)(F)F)c1	ZINC000819291029	EI	On-Demand	Anodyne	ADRB3	80	42
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1nc2ccccc2s1	ZINC000819291044	DG	On-Demand	Anodyne	UL26	81	34
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1nc2ccccc2s1	ZINC000819291044	DG	On-Demand	Anodyne	SCAF_EBVB9	77	33
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1nc2ccccc2s1	ZINC000819291045	DG	On-Demand	Anodyne	UL26	81	34
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1nc2ccccc2s1	ZINC000819291045	DG	On-Demand	Anodyne	SCAF_EBVB9	77	33
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1nc2ccccc2s1	ZINC000819291046	DG	On-Demand	Anodyne	UL26	81	34
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1nc2ccccc2s1	ZINC000819291046	DG	On-Demand	Anodyne	SCAF_EBVB9	77	33
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1nc2ccccc2s1	ZINC000819291047	DG	On-Demand	Anodyne	UL26	81	34
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1nc2ccccc2s1	ZINC000819291047	DG	On-Demand	Anodyne	SCAF_EBVB9	77	33
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000819291052	EE	On-Demand	Mild	ADRB2	29	42
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000819291053	EE	On-Demand	Mild	ADRB2	29	42
O=S(=O)(CCNC[C@@H](O)c1ccc(F)cc1Cl)CCc1ccccc1	ZINC000819291066	GF	On-Demand	Anodyne	ADRB2	51	43
O=S(=O)(CCNC[C@@H](O)c1ccc(F)cc1Cl)CCc1ccccc1	ZINC000819291066	GF	On-Demand	Anodyne	ADRB1	48	43
O=S(=O)(CCNC[C@@H](O)c1ccc(F)cc1Cl)CCc1ccccc1	ZINC000819291066	GF	On-Demand	Anodyne	ADRB3	47	38
O=S(=O)(CCNC[C@H](O)c1ccc(F)cc1Cl)CCc1ccccc1	ZINC000819291067	GF	On-Demand	Anodyne	ADRB2	51	43
O=S(=O)(CCNC[C@H](O)c1ccc(F)cc1Cl)CCc1ccccc1	ZINC000819291067	GF	On-Demand	Anodyne	ADRB1	48	43
O=S(=O)(CCNC[C@H](O)c1ccc(F)cc1Cl)CCc1ccccc1	ZINC000819291067	GF	On-Demand	Anodyne	ADRB3	47	38
COc1cccc([S@@](=O)CC(=O)NC2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000819291078	FD	On-Demand	Anodyne	MTNR1A	21	41
COc1cccc([S@@](=O)CC(=O)NC2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000819291078	FD	On-Demand	Anodyne	MTNR1B	24	41
NS(=O)(=O)c1ccc(F)c(CNC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819291079	EC	On-Demand	Anodyne	CA2	24	41
NS(=O)(=O)c1ccc(F)c(CNC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819291079	EC	On-Demand	Anodyne	CA5A	40	34
NS(=O)(=O)c1ccc(F)c(CNC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819291080	EC	On-Demand	Anodyne	CA2	24	41
NS(=O)(=O)c1ccc(F)c(CNC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819291080	EC	On-Demand	Anodyne	CA5A	40	34
NS(=O)(=O)c1ccc(F)c(CNC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819291081	EC	On-Demand	Anodyne	CA2	24	41
NS(=O)(=O)c1ccc(F)c(CNC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819291081	EC	On-Demand	Anodyne	CA5A	40	34
NS(=O)(=O)c1ccc(F)c(CNC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819291082	EC	On-Demand	Anodyne	CA2	24	41
NS(=O)(=O)c1ccc(F)c(CNC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819291082	EC	On-Demand	Anodyne	CA5A	40	34
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819291089	FG	On-Demand	Anodyne	HDAC1	18	41
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819291089	FG	On-Demand	Anodyne	HDAC2	16	41
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819291089	FG	On-Demand	Anodyne	HDAC6	21	41
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819291089	FG	On-Demand	Anodyne	HDAC9	35	41
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819291089	FG	On-Demand	Anodyne	HDAC7	43	41
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819291089	FG	On-Demand	Anodyne	NPFFR1	15	40
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819291090	FG	On-Demand	Anodyne	HDAC1	18	41
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819291090	FG	On-Demand	Anodyne	HDAC2	16	41
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819291090	FG	On-Demand	Anodyne	HDAC6	21	41
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819291090	FG	On-Demand	Anodyne	HDAC9	35	41
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819291090	FG	On-Demand	Anodyne	HDAC7	43	41
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819291090	FG	On-Demand	Anodyne	NPFFR1	15	40
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819291091	FG	On-Demand	Anodyne	HDAC1	18	41
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819291091	FG	On-Demand	Anodyne	HDAC2	16	41
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819291091	FG	On-Demand	Anodyne	HDAC6	21	41
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819291091	FG	On-Demand	Anodyne	HDAC9	35	41
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819291091	FG	On-Demand	Anodyne	HDAC7	43	41
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819291091	FG	On-Demand	Anodyne	NPFFR1	15	40
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819291092	FG	On-Demand	Anodyne	HDAC1	18	41
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819291092	FG	On-Demand	Anodyne	HDAC2	16	41
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819291092	FG	On-Demand	Anodyne	HDAC6	21	41
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819291092	FG	On-Demand	Anodyne	HDAC9	35	41
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819291092	FG	On-Demand	Anodyne	HDAC7	43	41
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819291092	FG	On-Demand	Anodyne	NPFFR1	15	40
Cc1ccccc1[C@@H](O)CNCCS(=O)(=O)CCc1ccccc1	ZINC000819291113	EE	On-Demand	Anodyne	ADRB2	61	40
Cc1ccccc1[C@@H](O)CNCCS(=O)(=O)CCc1ccccc1	ZINC000819291113	EE	On-Demand	Anodyne	ADRB1	58	40
Cc1ccccc1[C@@H](O)CNCCS(=O)(=O)CCc1ccccc1	ZINC000819291113	EE	On-Demand	Anodyne	ADRB3	63	38
O=[N+]([O-])c1ccc([C@H](O)CNCCS(=O)(=O)CCc2ccccc2)cc1	ZINC000819291117	GD	On-Demand	Bother	ADRB2	38	43
O=[N+]([O-])c1ccc([C@H](O)CNCCS(=O)(=O)CCc2ccccc2)cc1	ZINC000819291117	GD	On-Demand	Bother	ADRB1	41	42
O=[N+]([O-])c1ccc([C@H](O)CNCCS(=O)(=O)CCc2ccccc2)cc1	ZINC000819291117	GD	On-Demand	Bother	ADRB3	78	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCS(=O)(=O)CCc2ccccc2)cc1	ZINC000819291118	GD	On-Demand	Bother	ADRB2	38	43
O=[N+]([O-])c1ccc([C@@H](O)CNCCS(=O)(=O)CCc2ccccc2)cc1	ZINC000819291118	GD	On-Demand	Bother	ADRB1	41	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCS(=O)(=O)CCc2ccccc2)cc1	ZINC000819291118	GD	On-Demand	Bother	ADRB3	78	42
O[C@H](CNCCOc1ccc(I)cc1)C1CC1	ZINC000819291120	EE	On-Demand	Anodyne	ADRB1	28	40
O[C@@H](CNCCOc1ccc(I)cc1)C1CC1	ZINC000819291121	EE	On-Demand	Anodyne	ADRB1	28	40
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291122	GE	On-Demand	Anodyne	ADRB2	41	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291122	GE	On-Demand	Anodyne	ADRB1	75	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291122	GE	On-Demand	Anodyne	ADRB3	48	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291122	GE	On-Demand	Anodyne	LUCI_PHOPY	54	36
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291123	GE	On-Demand	Anodyne	ADRB2	41	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291123	GE	On-Demand	Anodyne	ADRB1	75	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291123	GE	On-Demand	Anodyne	ADRB3	48	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291123	GE	On-Demand	Anodyne	LUCI_PHOPY	54	36
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291124	GE	On-Demand	Anodyne	ADRB2	41	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291124	GE	On-Demand	Anodyne	ADRB1	75	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291124	GE	On-Demand	Anodyne	ADRB3	48	50
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291124	GE	On-Demand	Anodyne	LUCI_PHOPY	54	36
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291125	GE	On-Demand	Anodyne	ADRB2	41	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291125	GE	On-Demand	Anodyne	ADRB1	75	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291125	GE	On-Demand	Anodyne	ADRB3	48	50
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291125	GE	On-Demand	Anodyne	LUCI_PHOPY	54	36
O=S(=O)(CCNCCS(=O)(=O)c1ccc(F)cc1)CCc1ccccc1	ZINC000819291126	GD	On-Demand	Anodyne	CA13	17	40
O=S(=O)(CCNC[C@@H](O)c1ccccc1)CCc1ccccc1	ZINC000819291153	ED	On-Demand	Anodyne	ADRB2	76	55
O=S(=O)(CCNC[C@@H](O)c1ccccc1)CCc1ccccc1	ZINC000819291153	ED	On-Demand	Anodyne	ADRB1	80	44
O=S(=O)(CCNC[C@@H](O)c1ccccc1)CCc1ccccc1	ZINC000819291153	ED	On-Demand	Anodyne	ADRB3	155	49
O=S(=O)(CCNC[C@H](O)c1ccccc1)CCc1ccccc1	ZINC000819291154	ED	On-Demand	Anodyne	ADRB2	76	55
O=S(=O)(CCNC[C@H](O)c1ccccc1)CCc1ccccc1	ZINC000819291154	ED	On-Demand	Anodyne	ADRB1	80	44
O=S(=O)(CCNC[C@H](O)c1ccccc1)CCc1ccccc1	ZINC000819291154	ED	On-Demand	Anodyne	ADRB3	155	49
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)c1	ZINC000819291159	GF	On-Demand	Anodyne	ADRB2	21	41
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)c1	ZINC000819291159	GF	On-Demand	Anodyne	ABCB1	24	48
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)c1	ZINC000819291159	GF	On-Demand	Anodyne	LUCI_PHOPY	60	39
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc2[nH]ccc2c1	ZINC000819291176	DG	On-Demand	Anodyne	ADRB2	41	38
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc2[nH]ccc2c1	ZINC000819291176	DG	On-Demand	Anodyne	ADRB1	27	42
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc(F)cc2)c1	ZINC000819291185	DF	On-Demand	Anodyne	ADRB2	38	43
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc(F)cc2)c1	ZINC000819291185	DF	On-Demand	Anodyne	ADRB1	48	40
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc(F)cc2)c1	ZINC000819291185	DF	On-Demand	Anodyne	GRIN1	21	42
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc(F)cc2)c1	ZINC000819291185	DF	On-Demand	Anodyne	ADRB3	28	40
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000819291186	DF	On-Demand	Anodyne	ADRB2	38	43
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000819291186	DF	On-Demand	Anodyne	ADRB1	48	40
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000819291186	DF	On-Demand	Anodyne	GRIN1	21	42
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000819291186	DF	On-Demand	Anodyne	ADRB3	28	40
CC[C@@H](O)CNCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1	ZINC000819291192	DG	On-Demand	Clean	DPP7	15	41
CC[C@H](O)CNCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1	ZINC000819291193	DG	On-Demand	Clean	DPP7	15	41
CC[C@@H](O)CNCc1ccc(N2CCC[C@@H](C)C2)c(Cl)c1	ZINC000819291194	DG	On-Demand	Clean	DPP7	15	41
CC[C@H](O)CNCc1ccc(N2CCC[C@H](C)C2)c(Cl)c1	ZINC000819291195	DG	On-Demand	Clean	DPP7	15	41
O[C@@H](CNC[C@H]1CCCC(F)(F)C1)c1cccnc1	ZINC000819291243	CF	On-Demand	Anodyne	ADRB1	22	43
O[C@@H](CNC[C@H]1CCCC(F)(F)C1)c1cccnc1	ZINC000819291243	CF	On-Demand	Anodyne	ADRB3	87	43
O[C@H](CNC[C@@H]1CCCC(F)(F)C1)c1cccnc1	ZINC000819291244	CF	On-Demand	Anodyne	ADRB1	22	43
O[C@H](CNC[C@@H]1CCCC(F)(F)C1)c1cccnc1	ZINC000819291244	CF	On-Demand	Anodyne	ADRB3	87	43
O[C@H](CNC[C@H]1CCCC(F)(F)C1)c1cccnc1	ZINC000819291245	CF	On-Demand	Anodyne	ADRB1	22	43
O[C@H](CNC[C@H]1CCCC(F)(F)C1)c1cccnc1	ZINC000819291245	CF	On-Demand	Anodyne	ADRB3	87	43
O[C@@H](CNC[C@@H]1CCCC(F)(F)C1)c1cccnc1	ZINC000819291246	CF	On-Demand	Anodyne	ADRB1	22	43
O[C@@H](CNC[C@@H]1CCCC(F)(F)C1)c1cccnc1	ZINC000819291246	CF	On-Demand	Anodyne	ADRB3	87	43
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)c1	ZINC000819291247	FH	On-Demand	Anodyne	ADRB2	22	41
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)c1	ZINC000819291247	FH	On-Demand	Anodyne	ADRB1	53	32
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccccc2C(F)(F)F)c1	ZINC000819291248	FH	On-Demand	Anodyne	ADRB2	22	41
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccccc2C(F)(F)F)c1	ZINC000819291248	FH	On-Demand	Anodyne	ADRB1	53	32
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)c1	ZINC000819291260	GF	On-Demand	Anodyne	ADRB2	21	41
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)c1	ZINC000819291260	GF	On-Demand	Anodyne	ABCB1	24	48
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)c1	ZINC000819291260	GF	On-Demand	Anodyne	LUCI_PHOPY	60	39
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)c1	ZINC000819291261	GF	On-Demand	Anodyne	ADRB2	21	41
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)c1	ZINC000819291261	GF	On-Demand	Anodyne	ABCB1	24	48
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)c1	ZINC000819291261	GF	On-Demand	Anodyne	LUCI_PHOPY	60	39
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)c1	ZINC000819291262	GF	On-Demand	Anodyne	ADRB2	21	41
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)c1	ZINC000819291262	GF	On-Demand	Anodyne	ABCB1	24	48
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)c1	ZINC000819291262	GF	On-Demand	Anodyne	LUCI_PHOPY	60	39
N#Cc1ccc([C@@H](O)CNCCS(=O)(=O)CCc2ccccc2)cc1	ZINC000819291265	FD	On-Demand	Mild	ADRB2	44	43
N#Cc1ccc([C@@H](O)CNCCS(=O)(=O)CCc2ccccc2)cc1	ZINC000819291265	FD	On-Demand	Mild	ADRB1	48	39
N#Cc1ccc([C@@H](O)CNCCS(=O)(=O)CCc2ccccc2)cc1	ZINC000819291265	FD	On-Demand	Mild	ADRB3	78	45
N#Cc1ccc([C@H](O)CNCCS(=O)(=O)CCc2ccccc2)cc1	ZINC000819291266	FD	On-Demand	Mild	ADRB2	44	43
N#Cc1ccc([C@H](O)CNCCS(=O)(=O)CCc2ccccc2)cc1	ZINC000819291266	FD	On-Demand	Mild	ADRB1	48	39
N#Cc1ccc([C@H](O)CNCCS(=O)(=O)CCc2ccccc2)cc1	ZINC000819291266	FD	On-Demand	Mild	ADRB3	78	45
O=S(=O)(CCNC[C@@H](O)Cc1cccc(Cl)c1)CCc1ccccc1	ZINC000819291274	GE	On-Demand	Anodyne	ADRB2	39	47
O=S(=O)(CCNC[C@@H](O)Cc1cccc(Cl)c1)CCc1ccccc1	ZINC000819291274	GE	On-Demand	Anodyne	ADRB1	60	47
O=S(=O)(CCNC[C@@H](O)Cc1cccc(Cl)c1)CCc1ccccc1	ZINC000819291274	GE	On-Demand	Anodyne	ADRB3	61	41
O=S(=O)(CCNC[C@H](O)Cc1cccc(Cl)c1)CCc1ccccc1	ZINC000819291275	GE	On-Demand	Anodyne	ADRB2	39	47
O=S(=O)(CCNC[C@H](O)Cc1cccc(Cl)c1)CCc1ccccc1	ZINC000819291275	GE	On-Demand	Anodyne	ADRB1	60	47
O=S(=O)(CCNC[C@H](O)Cc1cccc(Cl)c1)CCc1ccccc1	ZINC000819291275	GE	On-Demand	Anodyne	ADRB3	61	41
CC(C)(C)OC(=O)N1CC(NC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819291284	FD	On-Demand	Anodyne	GPR119	40	46
CON(C)C(=O)CCNCCOc1ccc(I)cc1	ZINC000819291310	GD	On-Demand	Anodyne	LTA4H	15	47
O=S(=O)(CCNC[C@@H](O)c1ccccc1F)CCc1ccccc1	ZINC000819291318	FE	On-Demand	Anodyne	ADRB2	46	40
O=S(=O)(CCNC[C@@H](O)c1ccccc1F)CCc1ccccc1	ZINC000819291318	FE	On-Demand	Anodyne	ADRB1	42	40
O=S(=O)(CCNC[C@@H](O)c1ccccc1F)CCc1ccccc1	ZINC000819291318	FE	On-Demand	Anodyne	ADRB3	50	37
O=S(=O)(CCNC[C@H](O)c1ccccc1F)CCc1ccccc1	ZINC000819291320	FE	On-Demand	Anodyne	ADRB2	46	40
O=S(=O)(CCNC[C@H](O)c1ccccc1F)CCc1ccccc1	ZINC000819291320	FE	On-Demand	Anodyne	ADRB1	42	40
O=S(=O)(CCNC[C@H](O)c1ccccc1F)CCc1ccccc1	ZINC000819291320	FE	On-Demand	Anodyne	ADRB3	50	37
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2CCCC(F)(F)C2)CC1	ZINC000819291323	GG	On-Demand	Anodyne	GPR119	27	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2CCCC(F)(F)C2)CC1	ZINC000819291325	GG	On-Demand	Anodyne	GPR119	27	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H]2CCCC(F)(F)C2)CC1	ZINC000819291327	GG	On-Demand	Anodyne	GPR119	27	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H]2CCCC(F)(F)C2)CC1	ZINC000819291329	GG	On-Demand	Anodyne	GPR119	27	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(C)(C)C(F)(F)F)CC1	ZINC000819291356	FG	On-Demand	Anodyne	GPR119	30	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(C)(C)C(F)(F)F)CC1	ZINC000819291358	FG	On-Demand	Anodyne	GPR119	30	44
Cc1cc(Cl)nc(CNC[C@H](O)COc2cc(C)ccc2Cl)c1	ZINC000819291381	FH	On-Demand	Anodyne	ADRB2	16	44
O=S(=O)(CCNC[C@H](O)c1cccc2ccccc12)CCc1ccccc1	ZINC000819291383	GG	On-Demand	Anodyne	ADRB2	71	40
O=S(=O)(CCNC[C@H](O)c1cccc2ccccc12)CCc1ccccc1	ZINC000819291383	GG	On-Demand	Anodyne	ADRB1	56	40
O=S(=O)(CCNC[C@H](O)c1cccc2ccccc12)CCc1ccccc1	ZINC000819291383	GG	On-Demand	Anodyne	ADRB3	62	40
Cc1cc(Cl)nc(CNC[C@@H](O)COc2cc(C)ccc2Cl)c1	ZINC000819291384	FH	On-Demand	Anodyne	ADRB2	16	44
CON(C)C(=O)CCNC[C@@H]1CC(=O)N(C)[C@H]1c1cnn(Cc2ccccc2)c1	ZINC000819291401	GD	On-Demand	Anodyne	PANC	47	37
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc(Br)cc2)c1	ZINC000819291436	GG	On-Demand	Anodyne	ADRB2	33	42
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc(Br)cc2)c1	ZINC000819291436	GG	On-Demand	Anodyne	ADRB1	42	40
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc(Br)cc2)c1	ZINC000819291436	GG	On-Demand	Anodyne	ADRB3	25	40
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc(Br)cc2)c1	ZINC000819291437	GG	On-Demand	Anodyne	ADRB2	33	42
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc(Br)cc2)c1	ZINC000819291437	GG	On-Demand	Anodyne	ADRB1	42	40
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc(Br)cc2)c1	ZINC000819291437	GG	On-Demand	Anodyne	ADRB3	25	40
COC(=O)CCCOc1ccc(CNC(=O)C(F)=C2CCC2)cc1	ZINC000819291450	EG	On-Demand	Anodyne	LTA4H	17	42
CCSCCCNC[C@H](O)c1cccc2ccccc12	ZINC000819291451	CH	On-Demand	Anodyne	ADRB2	23	42
CCSCCCNC[C@H](O)c1cccc2ccccc12	ZINC000819291451	CH	On-Demand	Anodyne	ADRB1	21	42
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccc(F)cc1F	ZINC000819291467	FF	On-Demand	Anodyne	LUCI_PHOPY	47	37
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccc(F)cc1F	ZINC000819291468	FF	On-Demand	Anodyne	LUCI_PHOPY	47	37
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccc(F)cc1F	ZINC000819291469	FF	On-Demand	Anodyne	LUCI_PHOPY	47	37
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccc(F)cc1F	ZINC000819291470	FF	On-Demand	Anodyne	LUCI_PHOPY	47	37
C=C(C)C(C)(C)C(=O)Oc1ccc(C(=O)NCC)cc1	ZINC000819291475	CF	On-Demand	Mild	PRTN3	45	32
O=S(=O)(CCNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccccc1	ZINC000819291476	GE	On-Demand	Anodyne	LUCI_PHOPY	76	38
O=S(=O)(CCNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccccc1	ZINC000819291477	GE	On-Demand	Anodyne	LUCI_PHOPY	76	38
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)Cc1ccccc1	ZINC000819291478	FE	On-Demand	Anodyne	LUCI_PHOPY	90	44
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)Cc1ccccc1	ZINC000819291479	FE	On-Demand	Anodyne	LUCI_PHOPY	90	44
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)Cc1ccccc1	ZINC000819291480	FE	On-Demand	Anodyne	LUCI_PHOPY	90	44
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)Cc1ccccc1	ZINC000819291481	FE	On-Demand	Anodyne	LUCI_PHOPY	90	44
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)COc1ccccc1F	ZINC000819291482	GE	On-Demand	Anodyne	LUCI_PHOPY	71	36
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)COc1ccccc1F	ZINC000819291483	GE	On-Demand	Anodyne	LUCI_PHOPY	71	36
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)COc1ccccc1F	ZINC000819291484	GE	On-Demand	Anodyne	LUCI_PHOPY	71	36
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)COc1ccccc1F	ZINC000819291485	GE	On-Demand	Anodyne	LUCI_PHOPY	71	36
CC[C@H](O)CNC[C@@H]1CC(c2ccc(OC)c(C)c2)=NO1	ZINC000819291486	CD	On-Demand	Anodyne	MIF	17	42
CC[C@H](O)CNC[C@@H]1CC(c2ccc(OC)c(C)c2)=NO1	ZINC000819291486	CD	On-Demand	Anodyne	LUCI_PHOPY	72	40
CC[C@@H](O)CNC[C@@H]1CC(c2ccc(OC)c(C)c2)=NO1	ZINC000819291487	CD	On-Demand	Anodyne	MIF	17	42
CC[C@@H](O)CNC[C@@H]1CC(c2ccc(OC)c(C)c2)=NO1	ZINC000819291487	CD	On-Demand	Anodyne	LUCI_PHOPY	72	40
CC[C@H](O)CNC[C@H]1CC(c2ccc(OC)c(C)c2)=NO1	ZINC000819291488	CD	On-Demand	Anodyne	MIF	17	42
CC[C@H](O)CNC[C@H]1CC(c2ccc(OC)c(C)c2)=NO1	ZINC000819291488	CD	On-Demand	Anodyne	LUCI_PHOPY	72	40
CC[C@@H](O)CNC[C@H]1CC(c2ccc(OC)c(C)c2)=NO1	ZINC000819291489	CD	On-Demand	Anodyne	MIF	17	42
CC[C@@H](O)CNC[C@H]1CC(c2ccc(OC)c(C)c2)=NO1	ZINC000819291489	CD	On-Demand	Anodyne	LUCI_PHOPY	72	40
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)C1CCCCC1	ZINC000819291492	EF	On-Demand	Anodyne	LUCI_PHOPY	46	33
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)C1CCCCC1	ZINC000819291493	EF	On-Demand	Anodyne	LUCI_PHOPY	46	33
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)C1CCCCC1	ZINC000819291494	EF	On-Demand	Anodyne	LUCI_PHOPY	46	33
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)C1CCCCC1	ZINC000819291495	EF	On-Demand	Anodyne	LUCI_PHOPY	46	33
CC[C@H](O)CNC[C@H]1CC(c2ccc(OC)cc2)=NO1	ZINC000819291498	CD	On-Demand	Anodyne	LUCI_PHOPY	95	55
CC[C@H](O)CNC[C@@H]1CC(c2ccc(OC)cc2)=NO1	ZINC000819291499	CD	On-Demand	Anodyne	LUCI_PHOPY	95	55
CC[C@@H](O)CNC[C@@H]1CC(c2ccc(OC)cc2)=NO1	ZINC000819291500	CD	On-Demand	Anodyne	LUCI_PHOPY	95	55
CC[C@@H](O)CNC[C@H]1CC(c2ccc(OC)cc2)=NO1	ZINC000819291501	CD	On-Demand	Anodyne	LUCI_PHOPY	95	55
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)C(F)(F)F	ZINC000819291518	ED	On-Demand	Anodyne	LUCI_PHOPY	62	34
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)C(F)(F)F	ZINC000819291519	ED	On-Demand	Anodyne	LUCI_PHOPY	62	34
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)C(F)(F)F	ZINC000819291520	ED	On-Demand	Anodyne	LUCI_PHOPY	62	34
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)C(F)(F)F	ZINC000819291521	ED	On-Demand	Anodyne	LUCI_PHOPY	62	34
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)Cn1cccn1	ZINC000819291556	EC	On-Demand	Anodyne	LUCI_PHOPY	44	33
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)Cn1cccn1	ZINC000819291557	EC	On-Demand	Anodyne	LUCI_PHOPY	44	33
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)Cn1cccn1	ZINC000819291558	EC	On-Demand	Anodyne	LUCI_PHOPY	44	33
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)Cn1cccn1	ZINC000819291559	EC	On-Demand	Anodyne	LUCI_PHOPY	44	33
CC(=O)c1cccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)c1	ZINC000819291562	EF	On-Demand	Anodyne	ADRB2	27	45
CC(=O)c1cccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)c1	ZINC000819291562	EF	On-Demand	Anodyne	ADRB1	40	42
CC(=O)c1cccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)c1	ZINC000819291562	EF	On-Demand	Anodyne	ADRB3	24	42
CC(=O)c1cccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)c1	ZINC000819291562	EF	On-Demand	Anodyne	ABCB1	16	45
CC(=O)c1cccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)c1	ZINC000819291562	EF	On-Demand	Anodyne	PDS	67	36
CC(=O)c1cccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)c1	ZINC000819291563	EF	On-Demand	Anodyne	ADRB2	27	45
CC(=O)c1cccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)c1	ZINC000819291563	EF	On-Demand	Anodyne	ADRB1	40	42
CC(=O)c1cccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)c1	ZINC000819291563	EF	On-Demand	Anodyne	ADRB3	24	42
CC(=O)c1cccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)c1	ZINC000819291563	EF	On-Demand	Anodyne	ABCB1	16	45
CC(=O)c1cccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)c1	ZINC000819291563	EF	On-Demand	Anodyne	PDS	67	36
Cc1ccccc1[C@@H](O)CNCCc1ccc2[nH]ccc2c1	ZINC000819291629	CG	On-Demand	Anodyne	ADRB2	60	37
Cc1ccccc1[C@@H](O)CNCCc1ccc2[nH]ccc2c1	ZINC000819291629	CG	On-Demand	Anodyne	ADRB1	49	42
Cc1ccccc1[C@@H](O)CNCCc1ccc2[nH]ccc2c1	ZINC000819291629	CG	On-Demand	Anodyne	ADRB3	49	36
O[C@H](CNC[C@@H]1CCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819291673	DH	On-Demand	Anodyne	ADRB1	30	40
O[C@H](CNC[C@@H]1CCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819291673	DH	On-Demand	Anodyne	ADRB3	43	41
O[C@@H](CNC[C@H]1CCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819291674	DH	On-Demand	Anodyne	ADRB1	30	40
O[C@@H](CNC[C@H]1CCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819291674	DH	On-Demand	Anodyne	ADRB3	43	41
O[C@@H](CNC[C@@H]1CCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819291677	DH	On-Demand	Anodyne	ADRB1	30	40
O[C@@H](CNC[C@@H]1CCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819291677	DH	On-Demand	Anodyne	ADRB3	43	41
O[C@H](CNC[C@H]1CCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819291679	DH	On-Demand	Anodyne	ADRB1	30	40
O[C@H](CNC[C@H]1CCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819291679	DH	On-Demand	Anodyne	ADRB3	43	41
Cc1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291682	FF	On-Demand	Anodyne	ADRB2	41	48
Cc1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291682	FF	On-Demand	Anodyne	ADRB1	58	41
Cc1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291682	FF	On-Demand	Anodyne	ADRB3	37	41
Cc1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291682	FF	On-Demand	Anodyne	LUCI_PHOPY	76	42
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291686	FF	On-Demand	Anodyne	ADRB2	41	48
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291686	FF	On-Demand	Anodyne	ADRB1	58	41
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291686	FF	On-Demand	Anodyne	ADRB3	37	41
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291686	FF	On-Demand	Anodyne	LUCI_PHOPY	76	42
Cc1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291688	FF	On-Demand	Anodyne	ADRB2	41	48
Cc1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291688	FF	On-Demand	Anodyne	ADRB1	58	41
Cc1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291688	FF	On-Demand	Anodyne	ADRB3	37	41
Cc1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291688	FF	On-Demand	Anodyne	LUCI_PHOPY	76	42
Cc1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291690	FF	On-Demand	Anodyne	ADRB2	41	48
Cc1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291690	FF	On-Demand	Anodyne	ADRB1	58	41
Cc1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291690	FF	On-Demand	Anodyne	ADRB3	37	41
Cc1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291690	FF	On-Demand	Anodyne	LUCI_PHOPY	76	42
O=S(=O)(CCNC[C@@H](O)c1cccc(F)c1)CCc1ccccc1	ZINC000819291692	FE	On-Demand	Anodyne	ADRB2	62	43
O=S(=O)(CCNC[C@@H](O)c1cccc(F)c1)CCc1ccccc1	ZINC000819291692	FE	On-Demand	Anodyne	ADRB1	66	48
O=S(=O)(CCNC[C@@H](O)c1cccc(F)c1)CCc1ccccc1	ZINC000819291692	FE	On-Demand	Anodyne	ADRB3	131	48
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccccc1	ZINC000819291694	EE	On-Demand	Anodyne	LUCI_PHOPY	81	40
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccccc1	ZINC000819291696	EE	On-Demand	Anodyne	LUCI_PHOPY	81	40
Cc1cc(Cl)nc(CNC[C@H](O)COc2c(C)cccc2C)c1	ZINC000819291697	EG	On-Demand	Anodyne	ADRB2	17	40
O=S(=O)(CCNC[C@H](O)c1cccc(F)c1)CCc1ccccc1	ZINC000819291698	FE	On-Demand	Anodyne	ADRB2	62	43
O=S(=O)(CCNC[C@H](O)c1cccc(F)c1)CCc1ccccc1	ZINC000819291698	FE	On-Demand	Anodyne	ADRB1	66	48
O=S(=O)(CCNC[C@H](O)c1cccc(F)c1)CCc1ccccc1	ZINC000819291698	FE	On-Demand	Anodyne	ADRB3	131	48
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccccc1	ZINC000819291699	EE	On-Demand	Anodyne	LUCI_PHOPY	81	40
Cc1cc(Cl)nc(CNC[C@@H](O)COc2c(C)cccc2C)c1	ZINC000819291700	EG	On-Demand	Anodyne	ADRB2	17	40
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccccc1	ZINC000819291702	EE	On-Demand	Anodyne	LUCI_PHOPY	81	40
Cc1cc(Cl)nc(CNCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)c1	ZINC000819291708	GH	On-Demand	Anodyne	CYNT	30	44
O=S(=O)(CCNC[C@@H](O)Cc1ccc(F)cc1)CCc1ccccc1	ZINC000819291724	FD	On-Demand	Anodyne	ADRB2	36	43
O=S(=O)(CCNC[C@@H](O)Cc1ccc(F)cc1)CCc1ccccc1	ZINC000819291724	FD	On-Demand	Anodyne	ADRB1	48	43
O=S(=O)(CCNC[C@@H](O)Cc1ccc(F)cc1)CCc1ccccc1	ZINC000819291724	FD	On-Demand	Anodyne	ADRB3	57	43
O=S(=O)(CCNC[C@H](O)Cc1ccc(F)cc1)CCc1ccccc1	ZINC000819291730	FD	On-Demand	Anodyne	ADRB2	36	43
O=S(=O)(CCNC[C@H](O)Cc1ccc(F)cc1)CCc1ccccc1	ZINC000819291730	FD	On-Demand	Anodyne	ADRB1	48	43
O=S(=O)(CCNC[C@H](O)Cc1ccc(F)cc1)CCc1ccccc1	ZINC000819291730	FD	On-Demand	Anodyne	ADRB3	57	43
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	ZINC000819291767	GE	On-Demand	Bother	LUCI_PHOPY	17	44
O=[N+]([O-])c1ccc([C@H](O)CNC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	ZINC000819291768	GE	On-Demand	Bother	LUCI_PHOPY	17	44
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	ZINC000819291770	GE	On-Demand	Bother	LUCI_PHOPY	17	44
O=[N+]([O-])c1ccc([C@H](O)CNC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	ZINC000819291772	GE	On-Demand	Bother	LUCI_PHOPY	17	44
O=C(CCNCCS(=O)(=O)CCc1ccccc1)Nc1ccc(Cl)cc1	ZINC000819291779	GF	On-Demand	Anodyne	CA5B	24	40
O=C(CCNCCS(=O)(=O)CCc1ccccc1)Nc1ccc(Cl)cc1	ZINC000819291779	GF	On-Demand	Anodyne	CA5A	27	40
NC(=O)NCCNC(=O)C1(c2ccc(Cl)cc2Cl)CCCCC1	ZINC000819291780	FF	On-Demand	Anodyne	UGCG	36	41
NC(=O)NCCNC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819291823	FD	On-Demand	Anodyne	CNR1	55	34
O[C@@H](CNCCOc1ccc(I)cc1)c1cccnc1	ZINC000819291841	GE	On-Demand	Anodyne	ADRB2	39	71
O[C@@H](CNCCOc1ccc(I)cc1)c1cccnc1	ZINC000819291841	GE	On-Demand	Anodyne	ADRB1	51	71
O[C@@H](CNCCOc1ccc(I)cc1)c1cccnc1	ZINC000819291841	GE	On-Demand	Anodyne	ADRB3	123	71
O[C@H](CNCCOc1ccc(I)cc1)c1cccnc1	ZINC000819291842	GE	On-Demand	Anodyne	ADRB2	39	71
O[C@H](CNCCOc1ccc(I)cc1)c1cccnc1	ZINC000819291842	GE	On-Demand	Anodyne	ADRB1	51	71
O[C@H](CNCCOc1ccc(I)cc1)c1cccnc1	ZINC000819291842	GE	On-Demand	Anodyne	ADRB3	123	71
CCOc1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291843	GF	On-Demand	Anodyne	ADRB2	33	44
CCOc1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291843	GF	On-Demand	Anodyne	ADRB1	48	38
CCOc1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291843	GF	On-Demand	Anodyne	LUCI_PHOPY	60	41
CCOc1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291844	GF	On-Demand	Anodyne	ADRB2	33	44
CCOc1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291844	GF	On-Demand	Anodyne	ADRB1	48	38
CCOc1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291844	GF	On-Demand	Anodyne	LUCI_PHOPY	60	41
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291845	GF	On-Demand	Anodyne	ADRB2	33	44
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291845	GF	On-Demand	Anodyne	ADRB1	48	38
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291845	GF	On-Demand	Anodyne	LUCI_PHOPY	60	41
CCOc1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291846	GF	On-Demand	Anodyne	ADRB2	33	44
CCOc1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291846	GF	On-Demand	Anodyne	ADRB1	48	38
CCOc1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819291846	GF	On-Demand	Anodyne	LUCI_PHOPY	60	41
Cc1cc(Cl)nc(CNCCC(=O)Nc2cccc(Cl)c2)c1	ZINC000819291877	EH	On-Demand	Anodyne	IMDH_CRYPV	16	43
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819291883	GH	On-Demand	Anodyne	ADRB2	31	40
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819291883	GH	On-Demand	Anodyne	ADRB1	31	40
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819291883	GH	On-Demand	Anodyne	GRIN1	28	46
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819291884	GH	On-Demand	Anodyne	ADRB2	31	40
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819291884	GH	On-Demand	Anodyne	ADRB1	31	40
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819291884	GH	On-Demand	Anodyne	GRIN1	28	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819291896	FE	On-Demand	Anodyne	ADRB2	43	44
COC(=O)c1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819291896	FE	On-Demand	Anodyne	ADRB1	63	44
COC(=O)c1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819291896	FE	On-Demand	Anodyne	GRIN1	21	41
COC(=O)c1ccc(OC[C@@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819291896	FE	On-Demand	Anodyne	ADRB3	40	44
COC(=O)c1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819291897	FE	On-Demand	Anodyne	ADRB2	43	44
COC(=O)c1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819291897	FE	On-Demand	Anodyne	ADRB1	63	44
COC(=O)c1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819291897	FE	On-Demand	Anodyne	GRIN1	21	41
COC(=O)c1ccc(OC[C@H](O)CNCc2cc(C)cc(Cl)n2)cc1	ZINC000819291897	FE	On-Demand	Anodyne	ADRB3	40	44
O=C(C(F)=C1CCC1)N1CCN(Cc2cnn(-c3ccccc3)c2)CC1	ZINC000819291904	FF	On-Demand	Anodyne	DRD4	17	57
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccccc2)c1	ZINC000819291905	DF	On-Demand	Anodyne	ADRB2	51	52
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccccc2)c1	ZINC000819291905	DF	On-Demand	Anodyne	ADRB1	60	49
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccccc2)c1	ZINC000819291905	DF	On-Demand	Anodyne	ADRB3	39	49
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccccc2)c1	ZINC000819291905	DF	On-Demand	Anodyne	PDS	69	36
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccccc2)c1	ZINC000819291906	DF	On-Demand	Anodyne	ADRB2	51	52
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccccc2)c1	ZINC000819291906	DF	On-Demand	Anodyne	ADRB1	60	49
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccccc2)c1	ZINC000819291906	DF	On-Demand	Anodyne	ADRB3	39	49
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccccc2)c1	ZINC000819291906	DF	On-Demand	Anodyne	PDS	69	36
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2ccc3[nH]ccc3c2)CC1	ZINC000819291921	GG	On-Demand	Anodyne	GPR119	40	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2ccc3[nH]ccc3c2)CC1	ZINC000819291922	GG	On-Demand	Anodyne	GPR119	40	43
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819291926	EG	On-Demand	Anodyne	ADRB2	37	43
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819291926	EG	On-Demand	Anodyne	ADRB1	48	41
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819291926	EG	On-Demand	Anodyne	GRIN1	22	44
Cc1cc(Cl)nc(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819291926	EG	On-Demand	Anodyne	ADRB3	29	41
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819291927	EG	On-Demand	Anodyne	ADRB2	37	43
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819291927	EG	On-Demand	Anodyne	ADRB1	48	41
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819291927	EG	On-Demand	Anodyne	GRIN1	22	44
Cc1cc(Cl)nc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819291927	EG	On-Demand	Anodyne	ADRB3	29	41
Cc1cc(Cl)nc(CNCCC(=O)Nc2cccc(Br)c2)c1	ZINC000819291935	GH	On-Demand	Anodyne	EGFR	26	40
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccc(Cl)c1	ZINC000819291961	FG	On-Demand	Anodyne	ADRB3	35	40
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccc(Cl)c1	ZINC000819291961	FG	On-Demand	Anodyne	LUCI_PHOPY	58	42
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccc(Cl)c1	ZINC000819291962	FG	On-Demand	Anodyne	ADRB3	35	40
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccc(Cl)c1	ZINC000819291962	FG	On-Demand	Anodyne	LUCI_PHOPY	58	42
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccc(Cl)c1	ZINC000819291963	FG	On-Demand	Anodyne	ADRB3	35	40
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccc(Cl)c1	ZINC000819291963	FG	On-Demand	Anodyne	LUCI_PHOPY	58	42
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccc(Cl)c1	ZINC000819291964	FG	On-Demand	Anodyne	ADRB3	35	40
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccc(Cl)c1	ZINC000819291964	FG	On-Demand	Anodyne	LUCI_PHOPY	58	42
O=C(CCNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)Nc1ccccc1F	ZINC000819291975	GF	On-Demand	Anodyne	LUCI_PHOPY	64	35
O=C(CCNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)Nc1ccccc1F	ZINC000819291976	GF	On-Demand	Anodyne	LUCI_PHOPY	64	35
COC[C@@H](O)CNC[C@H]1CC(c2ccc(OC)cc2)=NO1	ZINC000819291978	CC	On-Demand	Anodyne	LUCI_PHOPY	90	53
COC[C@@H](O)CNC[C@@H]1CC(c2ccc(OC)cc2)=NO1	ZINC000819291979	CC	On-Demand	Anodyne	LUCI_PHOPY	90	53
CN(C[C@@H](O)CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)C1CC1	ZINC000819291994	ED	On-Demand	Anodyne	LUCI_PHOPY	57	34
CN(C[C@H](O)CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)C1CC1	ZINC000819291995	ED	On-Demand	Anodyne	LUCI_PHOPY	57	34
CN(C[C@@H](O)CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)C1CC1	ZINC000819291996	ED	On-Demand	Anodyne	LUCI_PHOPY	57	34
CN(C[C@H](O)CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)C1CC1	ZINC000819291997	ED	On-Demand	Anodyne	LUCI_PHOPY	57	34
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccc(F)c(F)c1	ZINC000819291998	FF	On-Demand	Anodyne	LUCI_PHOPY	46	35
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccc(F)c(F)c1	ZINC000819291999	FF	On-Demand	Anodyne	LUCI_PHOPY	46	35
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccc(F)c(F)c1	ZINC000819292000	FF	On-Demand	Anodyne	LUCI_PHOPY	46	35
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccc(F)c(F)c1	ZINC000819292001	FF	On-Demand	Anodyne	LUCI_PHOPY	46	35
OC1(CNC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)CCC1	ZINC000819292006	DD	On-Demand	Anodyne	LUCI_PHOPY	64	35
OC1(CNC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)CCC1	ZINC000819292007	DD	On-Demand	Anodyne	LUCI_PHOPY	64	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cc(S(N)(=O)=O)ccc1F	ZINC000819292035	GD	On-Demand	Anodyne	CA2	23	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cc(S(N)(=O)=O)ccc1F	ZINC000819292035	GD	On-Demand	Anodyne	CA1	20	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cc(S(N)(=O)=O)ccc1F	ZINC000819292035	GD	On-Demand	Anodyne	CA12	20	42
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1cccnc1	ZINC000819292040	ED	On-Demand	Anodyne	ADRB2	27	50
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1cccnc1	ZINC000819292040	ED	On-Demand	Anodyne	ADRB1	33	44
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1cccnc1	ZINC000819292040	ED	On-Demand	Anodyne	ADRB3	105	50
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1cccnc1	ZINC000819292040	ED	On-Demand	Anodyne	PTAFR	19	42
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)c1cccnc1	ZINC000819292042	ED	On-Demand	Anodyne	ADRB2	27	50
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)c1cccnc1	ZINC000819292042	ED	On-Demand	Anodyne	ADRB1	33	44
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)c1cccnc1	ZINC000819292042	ED	On-Demand	Anodyne	ADRB3	105	50
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)c1cccnc1	ZINC000819292042	ED	On-Demand	Anodyne	PTAFR	19	42
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1cccnc1	ZINC000819292043	ED	On-Demand	Anodyne	ADRB2	27	50
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1cccnc1	ZINC000819292043	ED	On-Demand	Anodyne	ADRB1	33	44
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1cccnc1	ZINC000819292043	ED	On-Demand	Anodyne	ADRB3	105	50
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1cccnc1	ZINC000819292043	ED	On-Demand	Anodyne	PTAFR	19	42
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)c1cccnc1	ZINC000819292044	ED	On-Demand	Anodyne	ADRB2	27	50
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)c1cccnc1	ZINC000819292044	ED	On-Demand	Anodyne	ADRB1	33	44
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)c1cccnc1	ZINC000819292044	ED	On-Demand	Anodyne	ADRB3	105	50
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)c1cccnc1	ZINC000819292044	ED	On-Demand	Anodyne	PTAFR	19	42
O=S(=O)(CCNC[C@@H](O)C(F)(F)F)CCc1ccccc1	ZINC000819292067	ED	On-Demand	Anodyne	ADRB2	24	40
O=S(=O)(CCNC[C@@H](O)C(F)(F)F)CCc1ccccc1	ZINC000819292067	ED	On-Demand	Anodyne	ADRB1	26	40
O=S(=O)(CCNC[C@@H](O)C(F)(F)F)CCc1ccccc1	ZINC000819292067	ED	On-Demand	Anodyne	ADRB3	45	40
O=S(=O)(CCNC[C@H](O)C(F)(F)F)CCc1ccccc1	ZINC000819292068	ED	On-Demand	Anodyne	ADRB2	24	40
O=S(=O)(CCNC[C@H](O)C(F)(F)F)CCc1ccccc1	ZINC000819292068	ED	On-Demand	Anodyne	ADRB1	26	40
O=S(=O)(CCNC[C@H](O)C(F)(F)F)CCc1ccccc1	ZINC000819292068	ED	On-Demand	Anodyne	ADRB3	45	40
O=S(=O)(CCNC[C@H](O)CC(F)(F)F)CCc1ccccc1	ZINC000819292073	ED	On-Demand	Anodyne	ADRB2	25	41
O=S(=O)(CCNC[C@H](O)CC(F)(F)F)CCc1ccccc1	ZINC000819292073	ED	On-Demand	Anodyne	ADRB1	32	41
O=S(=O)(CCNC[C@H](O)CC(F)(F)F)CCc1ccccc1	ZINC000819292073	ED	On-Demand	Anodyne	ADRB3	33	41
O=S(=O)(CCNC[C@@H](O)CC(F)(F)F)CCc1ccccc1	ZINC000819292074	ED	On-Demand	Anodyne	ADRB2	25	41
O=S(=O)(CCNC[C@@H](O)CC(F)(F)F)CCc1ccccc1	ZINC000819292074	ED	On-Demand	Anodyne	ADRB1	32	41
O=S(=O)(CCNC[C@@H](O)CC(F)(F)F)CCc1ccccc1	ZINC000819292074	ED	On-Demand	Anodyne	ADRB3	33	41
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1ccccc1Cl	ZINC000819292083	FG	On-Demand	Anodyne	HDAC9	29	42
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1ccccc1Cl	ZINC000819292083	FG	On-Demand	Anodyne	HDAC7	34	42
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1ccccc1Cl	ZINC000819292084	FG	On-Demand	Anodyne	HDAC9	29	42
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1ccccc1Cl	ZINC000819292084	FG	On-Demand	Anodyne	HDAC7	34	42
O=S(=O)(CCNC[C@@H](O)c1ccc(F)cc1F)CCc1ccccc1	ZINC000819292101	FE	On-Demand	Anodyne	ADRB2	65	40
O=S(=O)(CCNC[C@@H](O)c1ccc(F)cc1F)CCc1ccccc1	ZINC000819292101	FE	On-Demand	Anodyne	ADRB1	56	40
O=S(=O)(CCNC[C@@H](O)c1ccc(F)cc1F)CCc1ccccc1	ZINC000819292101	FE	On-Demand	Anodyne	ADRB3	59	39
O=S(=O)(CCNC[C@H](O)c1ccc(F)cc1F)CCc1ccccc1	ZINC000819292102	FE	On-Demand	Anodyne	ADRB2	65	40
O=S(=O)(CCNC[C@H](O)c1ccc(F)cc1F)CCc1ccccc1	ZINC000819292102	FE	On-Demand	Anodyne	ADRB1	56	40
O=S(=O)(CCNC[C@H](O)c1ccc(F)cc1F)CCc1ccccc1	ZINC000819292102	FE	On-Demand	Anodyne	ADRB3	59	39
NS(=O)(=O)c1ccc(F)c(CNC(=O)C(F)=C2CCC2)c1	ZINC000819292111	DD	On-Demand	Anodyne	CA2	56	44
NS(=O)(=O)c1ccc(F)c(CNC(=O)C(F)=C2CCC2)c1	ZINC000819292111	DD	On-Demand	Anodyne	CA1	45	42
NS(=O)(=O)c1ccc(F)c(CNC(=O)C(F)=C2CCC2)c1	ZINC000819292111	DD	On-Demand	Anodyne	CA7	47	39
NS(=O)(=O)c1ccc(F)c(CNC(=O)C(F)=C2CCC2)c1	ZINC000819292111	DD	On-Demand	Anodyne	CA5B	57	39
NS(=O)(=O)c1ccc(F)c(CNC(=O)C(F)=C2CCC2)c1	ZINC000819292111	DD	On-Demand	Anodyne	CA4	55	40
NS(=O)(=O)c1ccc(F)c(CNC(=O)C(F)=C2CCC2)c1	ZINC000819292111	DD	On-Demand	Anodyne	CA5A	61	39
NS(=O)(=O)c1ccc(F)c(CNC(=O)C(F)=C2CCC2)c1	ZINC000819292111	DD	On-Demand	Anodyne	CA12	30	42
NS(=O)(=O)c1ccc(F)c(CNC(=O)C(F)=C2CCC2)c1	ZINC000819292111	DD	On-Demand	Anodyne	CA9	34	40
O=S(=O)(CCNC[C@@H](O)c1ccc(F)cc1)CCc1ccccc1	ZINC000819292121	FE	On-Demand	Anodyne	ADRB2	67	43
O=S(=O)(CCNC[C@@H](O)c1ccc(F)cc1)CCc1ccccc1	ZINC000819292121	FE	On-Demand	Anodyne	ADRB1	64	40
O=S(=O)(CCNC[C@@H](O)c1ccc(F)cc1)CCc1ccccc1	ZINC000819292121	FE	On-Demand	Anodyne	SLC6A3	15	43
O=S(=O)(CCNC[C@@H](O)c1ccc(F)cc1)CCc1ccccc1	ZINC000819292121	FE	On-Demand	Anodyne	ADRB3	113	45
O=S(=O)(CCNC[C@H](O)c1ccc(F)cc1)CCc1ccccc1	ZINC000819292122	FE	On-Demand	Anodyne	ADRB2	67	43
O=S(=O)(CCNC[C@H](O)c1ccc(F)cc1)CCc1ccccc1	ZINC000819292122	FE	On-Demand	Anodyne	ADRB1	64	40
O=S(=O)(CCNC[C@H](O)c1ccc(F)cc1)CCc1ccccc1	ZINC000819292122	FE	On-Demand	Anodyne	SLC6A3	15	43
O=S(=O)(CCNC[C@H](O)c1ccc(F)cc1)CCc1ccccc1	ZINC000819292122	FE	On-Demand	Anodyne	ADRB3	113	45
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)c1ccc(F)cc1F	ZINC000819292131	FF	On-Demand	Anodyne	HDAC9	28	40
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)c1ccc(F)cc1F	ZINC000819292131	FF	On-Demand	Anodyne	HDAC7	34	40
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1ccc(F)cc1F	ZINC000819292132	FF	On-Demand	Anodyne	HDAC9	28	40
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1ccc(F)cc1F	ZINC000819292132	FF	On-Demand	Anodyne	HDAC7	34	40
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)c1ccc(F)cc1F	ZINC000819292133	FF	On-Demand	Anodyne	HDAC9	28	40
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)c1ccc(F)cc1F	ZINC000819292133	FF	On-Demand	Anodyne	HDAC7	34	40
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1ccc(F)cc1F	ZINC000819292134	FF	On-Demand	Anodyne	HDAC9	28	40
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1ccc(F)cc1F	ZINC000819292134	FF	On-Demand	Anodyne	HDAC7	34	40
O=C(O)[C@H]1CCN(Cn2nc(CN3CCCC3)n(-c3ccccc3)c2=S)C1	ZINC000819292161	GE	On-Demand	Anodyne	SLC6A1	157	40
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)COCc1ccccc1	ZINC000819292164	GE	On-Demand	Anodyne	LUCI_PHOPY	84	42
O=C(O)[C@@H]1CCN(Cn2nc(CN3CCCC3)n(-c3ccccc3)c2=S)C1	ZINC000819292165	GE	On-Demand	Anodyne	SLC6A1	157	40
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)COCc1ccccc1	ZINC000819292166	GE	On-Demand	Anodyne	LUCI_PHOPY	84	42
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)COCc1ccccc1	ZINC000819292167	GE	On-Demand	Anodyne	LUCI_PHOPY	84	42
O=C(O)[C@@H]1CCN(Cn2nc(Nc3cccc(F)c3)sc2=S)C1	ZINC000819292168	FF	On-Demand	Anodyne	SLC6A1	93	38
O=C(O)[C@@H]1CCN(Cn2nc(Nc3cccc(F)c3)sc2=S)C1	ZINC000819292168	FF	On-Demand	Anodyne	CCR5	43	32
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)COCc1ccccc1	ZINC000819292169	GE	On-Demand	Anodyne	LUCI_PHOPY	84	42
O=C(O)[C@H]1CCN(Cn2nc(Nc3cccc(F)c3)sc2=S)C1	ZINC000819292172	FF	On-Demand	Anodyne	SLC6A1	93	38
O=C(O)[C@H]1CCN(Cn2nc(Nc3cccc(F)c3)sc2=S)C1	ZINC000819292172	FF	On-Demand	Anodyne	CCR5	43	32
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccncc3)n(C3CC3)c2=S)C1	ZINC000819292174	EE	On-Demand	Anodyne	SLC6A1	77	34
O=C(O)[C@H]1CCN(Cn2nc(-c3ccncc3)n(C3CC3)c2=S)C1	ZINC000819292177	EE	On-Demand	Anodyne	SLC6A1	77	34
O=S1(=O)CCC(O)(CNC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)CC1	ZINC000819292180	GC	On-Demand	Anodyne	LUCI_PHOPY	45	32
O=S1(=O)CCC(O)(CNC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)CC1	ZINC000819292182	GC	On-Demand	Anodyne	LUCI_PHOPY	45	32
O=C(O)[C@H]1CCN(c2cc3ccccc3c(Cl)n2)C1	ZINC000819292186	CF	On-Demand	Anodyne	SLC6A1	56	35
O=C(O)[C@@H]1CCN(c2cc3ccccc3c(Cl)n2)C1	ZINC000819292191	CF	On-Demand	Anodyne	SLC6A1	56	35
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3F)oc2=S)C1	ZINC000819292193	DE	On-Demand	Anodyne	SLC6A1	142	46
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3F)oc2=S)C1	ZINC000819292193	DE	On-Demand	Anodyne	S1PR3	15	40
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3F)oc2=S)C1	ZINC000819292193	DE	On-Demand	Anodyne	S1PR1	26	40
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3F)oc2=S)C1	ZINC000819292195	DE	On-Demand	Anodyne	SLC6A1	142	46
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3F)oc2=S)C1	ZINC000819292195	DE	On-Demand	Anodyne	S1PR3	15	40
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3F)oc2=S)C1	ZINC000819292195	DE	On-Demand	Anodyne	S1PR1	26	40
O=C(O)[C@H]1CCN(Cn2ncn(-c3ccccc3F)c2=S)C1	ZINC000819292197	DD	On-Demand	Anodyne	SLC6A1	142	42
O=C(O)[C@@H]1CCN(Cn2ncn(-c3ccccc3F)c2=S)C1	ZINC000819292199	DD	On-Demand	Anodyne	SLC6A1	142	42
O=C(O)[C@@H]1CCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000819292205	EC	On-Demand	Bother	L3MBTL3	58	47
O=C(O)[C@H]1CCN(c2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])C1	ZINC000819292207	EC	On-Demand	Bother	L3MBTL3	58	47
O=C(O)[C@@H]1CCN(Cn2nc(Nc3ccccc3F)sc2=S)C1	ZINC000819292208	FF	On-Demand	Anodyne	SLC6A1	135	39
O=C(O)[C@H]1CCN(Cn2nc(Nc3ccccc3F)sc2=S)C1	ZINC000819292209	FF	On-Demand	Anodyne	SLC6A1	135	39
O=C(O)[C@H]1CCN(Cn2nc(-c3cccs3)n(C3CC3)c2=S)C1	ZINC000819292214	FF	On-Demand	Anodyne	SLC6A1	93	39
O=C(O)[C@@H]1CCN(Cn2nc(-c3cccs3)n(C3CC3)c2=S)C1	ZINC000819292216	FF	On-Demand	Anodyne	SLC6A1	93	39
CCOC[C@H](O)CNC[C@@H]1CC(c2ccc(OC)c(C)c2)=NO1	ZINC000819292219	DD	On-Demand	Anodyne	LUCI_PHOPY	55	38
O=C(O)[C@H]1CCN(Cn2nc(-c3cccnc3)n(-c3ccccc3)c2=S)C1	ZINC000819292220	GF	On-Demand	Anodyne	SLC6A1	110	37
CCOC[C@H](O)CNC[C@H]1CC(c2ccc(OC)c(C)c2)=NO1	ZINC000819292222	DD	On-Demand	Anodyne	LUCI_PHOPY	55	38
O=C(O)[C@@H]1CCN(Cn2nc(-c3cccnc3)n(-c3ccccc3)c2=S)C1	ZINC000819292224	GF	On-Demand	Anodyne	SLC6A1	110	37
O=C(O)[C@@H]1CCN(Cn2nnn(Cc3cccs3)c2=S)C1	ZINC000819292227	ED	On-Demand	Anodyne	SLC6A1	107	36
OC1(CNC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)CCCCC1	ZINC000819292228	EE	On-Demand	Anodyne	LUCI_PHOPY	57	34
O=C(O)[C@H]1CCN(Cn2nnn(Cc3cccs3)c2=S)C1	ZINC000819292229	ED	On-Demand	Anodyne	SLC6A1	107	36
OC1(CNC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)CCCCC1	ZINC000819292230	EE	On-Demand	Anodyne	LUCI_PHOPY	57	34
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3)oc2=S)C1	ZINC000819292231	DE	On-Demand	Anodyne	SLC6A1	143	41
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3)oc2=S)C1	ZINC000819292231	DE	On-Demand	Anodyne	S1PR4	18	40
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3)oc2=S)C1	ZINC000819292231	DE	On-Demand	Anodyne	S1PR1	26	40
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3)oc2=S)C1	ZINC000819292231	DE	On-Demand	Anodyne	S1PR5	37	40
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3)oc2=S)C1	ZINC000819292231	DE	On-Demand	Anodyne	PDE8B	57	34
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3)oc2=S)C1	ZINC000819292235	DE	On-Demand	Anodyne	SLC6A1	143	41
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3)oc2=S)C1	ZINC000819292235	DE	On-Demand	Anodyne	S1PR4	18	40
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3)oc2=S)C1	ZINC000819292235	DE	On-Demand	Anodyne	S1PR1	26	40
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3)oc2=S)C1	ZINC000819292235	DE	On-Demand	Anodyne	S1PR5	37	40
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3)oc2=S)C1	ZINC000819292235	DE	On-Demand	Anodyne	PDE8B	57	34
O=C(O)[C@H]1CCN(Cn2ncc(Cl)c(Cl)c2=O)C1	ZINC000819292239	CC	On-Demand	Anodyne	SLC6A1	64	37
O=C(O)[C@@H]1CCN(Cn2ncc(Cl)c(Cl)c2=O)C1	ZINC000819292240	CC	On-Demand	Anodyne	SLC6A1	64	37
O=C(O)[C@H]1CCN(Cn2nnn(-c3ccccc3)c2=S)C1	ZINC000819292241	DD	On-Demand	Anodyne	SLC6A1	153	40
O=C(O)[C@@H]1CCN(Cn2nnn(-c3ccccc3)c2=S)C1	ZINC000819292242	DD	On-Demand	Anodyne	SLC6A1	153	40
O=C(O)[C@H]1CCN(Cn2nnn(-c3ccccc3)c2=O)C1	ZINC000819292245	CB	On-Demand	Anodyne	SLC6A1	142	40
O=C(O)[C@@H]1CCN(Cn2nnn(-c3ccccc3)c2=O)C1	ZINC000819292247	CB	On-Demand	Anodyne	SLC6A1	142	40
O=C(O)[C@@H]1CCN(Cn2ncc3cn(-c4ccccc4)nc3c2=O)C1	ZINC000819292248	EC	On-Demand	Anodyne	SLC6A1	97	38
O=C(O)[C@H]1CCN(Cn2ncc3cn(-c4ccccc4)nc3c2=O)C1	ZINC000819292250	EC	On-Demand	Anodyne	SLC6A1	97	38
O=C(O)[C@@H]1CCN(Cn2nc(-c3cccs3)c3ccccc3c2=O)C1	ZINC000819292252	FE	On-Demand	Anodyne	SLC6A1	89	40
O=C(O)[C@H]1CCN(Cn2nc(-c3cccs3)c3ccccc3c2=O)C1	ZINC000819292254	FE	On-Demand	Anodyne	SLC6A1	89	40
O=C(O)[C@H]1CCN(Cn2nc(N3CCOCC3)n(-c3ccccc3)c2=S)C1	ZINC000819292255	GD	On-Demand	Anodyne	SLC6A1	96	36
O=C(O)[C@@H]1CCN(Cn2nc(N3CCOCC3)n(-c3ccccc3)c2=S)C1	ZINC000819292259	GD	On-Demand	Anodyne	SLC6A1	96	36
O=C(O)[C@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000819292261	ED	On-Demand	Anodyne	MPL	26	41
O=C(O)[C@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000819292261	ED	On-Demand	Anodyne	CXCR3	29	45
O=C(O)[C@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000819292261	ED	On-Demand	Anodyne	LRRK2	19	40
O=C(O)[C@@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000819292262	ED	On-Demand	Anodyne	MPL	26	41
O=C(O)[C@@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000819292262	ED	On-Demand	Anodyne	CXCR3	29	45
O=C(O)[C@@H]1CCN(c2ncc(C(=O)N3CCOCC3)cc2Cl)C1	ZINC000819292262	ED	On-Demand	Anodyne	LRRK2	19	40
O=C(O)[C@@H]1CCN(Cn2nc3c(cc2=O)CCCC3)C1	ZINC000819292272	CC	On-Demand	Anodyne	SLC6A1	126	38
O=C(O)[C@H]1CCN(Cn2nc3c(cc2=O)CCCC3)C1	ZINC000819292275	CC	On-Demand	Anodyne	SLC6A1	126	38
N#Cc1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	ZINC000819292276	GE	On-Demand	Mild	LUCI_PHOPY	31	41
O=C(O)[C@@H]1CCN(Cn2nc(-c3cccs3)oc2=O)C1	ZINC000819292277	CC	On-Demand	Anodyne	SLC6A1	69	41
N#Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	ZINC000819292278	GE	On-Demand	Mild	LUCI_PHOPY	31	41
O=C(O)[C@H]1CCN(Cn2nc(-c3cccs3)oc2=O)C1	ZINC000819292279	CC	On-Demand	Anodyne	SLC6A1	69	41
O=C(O)C1CCN(Cn2nc(CCCc3ccccc3)oc2=S)CC1	ZINC000819292280	FG	On-Demand	Anodyne	SIGMAR1	20	42
O=C(O)C1CCN(Cn2nc(CCCc3ccccc3)oc2=S)CC1	ZINC000819292280	FG	On-Demand	Anodyne	CES1	46	32
N#Cc1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	ZINC000819292281	GE	On-Demand	Mild	LUCI_PHOPY	31	41
N#Cc1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	ZINC000819292282	GE	On-Demand	Mild	LUCI_PHOPY	31	41
O=C(O)[C@@H]1CCN(Cn2nc(SCc3ccc(F)cc3)sc2=S)C1	ZINC000819292283	GG	On-Demand	Anodyne	SLC6A1	103	37
O=C(O)[C@H]1CCN(Cn2nc(SCc3ccc(F)cc3)sc2=S)C1	ZINC000819292285	GG	On-Demand	Anodyne	SLC6A1	103	37
O=C(O)[C@H]1CCN(c2ccc(C(F)(F)F)c(Cl)n2)C1	ZINC000819292287	CF	On-Demand	Anodyne	LIPG	44	34
O=C(O)[C@@H]1CCN(c2ccc(C(F)(F)F)c(Cl)n2)C1	ZINC000819292291	CF	On-Demand	Anodyne	LIPG	44	34
O=C(O)[C@H]1CCN(Cn2ncc(Br)c(Br)c2=O)C1	ZINC000819292293	GD	On-Demand	Anodyne	SLC6A1	44	36
O=C(O)[C@@H]1CCN(Cn2ncc(Br)c(Br)c2=O)C1	ZINC000819292295	GD	On-Demand	Anodyne	SLC6A1	44	36
O=C(O)[C@@H]1CCN(Cn2ncn(CC(F)(F)F)c2=S)C1	ZINC000819292300	DD	On-Demand	Anodyne	SLC6A1	112	36
O=C(O)[C@H]1CCN(Cn2ncn(CC(F)(F)F)c2=S)C1	ZINC000819292302	DD	On-Demand	Anodyne	SLC6A1	112	36
O=C(O)[C@@H]1CCN(Cn2nc(-c3cccnc3)n(C3CC3)c2=S)C1	ZINC000819292310	EE	On-Demand	Anodyne	SLC6A1	73	34
O=C(O)[C@H]1CCN(Cn2nc(-c3cccnc3)n(C3CC3)c2=S)C1	ZINC000819292312	EE	On-Demand	Anodyne	SLC6A1	73	34
O=C(O)[C@@H]1CCN(Cn2nc3ccccn3c2=S)C1	ZINC000819292314	CD	On-Demand	Anodyne	SLC6A1	146	40
O=C(O)[C@H]1CCN(Cn2nc3ccccn3c2=S)C1	ZINC000819292317	CD	On-Demand	Anodyne	SLC6A1	146	40
O=C(O)[C@@H]1CCN(Cn2ncn(C3CC3)c2=S)C1	ZINC000819292318	CD	On-Demand	Anodyne	SLC6A1	81	34
O=C(O)[C@H]1CCN(Cn2ncn(C3CC3)c2=S)C1	ZINC000819292319	CD	On-Demand	Anodyne	SLC6A1	81	34
O=C(O)[C@@H]1CCN(Cn2ncn(CCc3cccs3)c2=S)C1	ZINC000819292320	EE	On-Demand	Anodyne	SLC6A1	123	38
O=C(O)[C@H]1CCN(Cn2ncn(CCc3cccs3)c2=S)C1	ZINC000819292321	EE	On-Demand	Anodyne	SLC6A1	123	38
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccco3)n(-c3ccccc3)c2=S)C1	ZINC000819292322	FG	On-Demand	Anodyne	SLC6A1	138	37
O=C(O)[C@H]1CCN(Cn2nc(-c3ccco3)n(-c3ccccc3)c2=S)C1	ZINC000819292323	FG	On-Demand	Anodyne	SLC6A1	138	37
O=C(O)[C@@H]1CCN(Cn2nc3ccccn3c2=O)C1	ZINC000819292324	CB	On-Demand	Anodyne	SLC6A1	123	38
O=C(O)[C@H]1CCN(Cn2nc3ccccn3c2=O)C1	ZINC000819292325	CB	On-Demand	Anodyne	SLC6A1	123	38
O=C(O)[C@H]1CCN(Cn2nc(-c3ccncc3)n(C3CCCCC3)c2=S)C1	ZINC000819292326	GG	On-Demand	Anodyne	SLC6A1	92	35
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccncc3)n(C3CCCCC3)c2=S)C1	ZINC000819292327	GG	On-Demand	Anodyne	SLC6A1	92	35
O=C(O)[C@@H]1CCN(Cn2nc(CCc3ccccc3)oc2=S)C1	ZINC000819292328	EE	On-Demand	Anodyne	SLC6A1	123	39
O=C(O)[C@@H]1CCN(Cn2nc(CCc3ccccc3)oc2=S)C1	ZINC000819292328	EE	On-Demand	Anodyne	S1PR5	17	43
O=C(O)[C@H]1CCN(Cn2nc(CCc3ccccc3)oc2=S)C1	ZINC000819292329	EE	On-Demand	Anodyne	SLC6A1	123	39
O=C(O)[C@H]1CCN(Cn2nc(CCc3ccccc3)oc2=S)C1	ZINC000819292329	EE	On-Demand	Anodyne	S1PR5	17	43
O=C(O)[C@@H]1CCN(Cn2nc(-c3cccs3)oc2=S)C1	ZINC000819292330	DE	On-Demand	Anodyne	SLC6A1	90	41
O=C(O)[C@H]1CCN(Cn2nc(-c3cccs3)oc2=S)C1	ZINC000819292331	DE	On-Demand	Anodyne	SLC6A1	90	41
O=C(O)[C@@H]1CCN(Cn2ncc3ccccc3c2=O)C1	ZINC000819292332	CC	On-Demand	Anodyne	SLC6A1	132	41
O=C(O)[C@H]1CCN(Cn2ncc3ccccc3c2=O)C1	ZINC000819292333	CC	On-Demand	Anodyne	SLC6A1	132	41
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccncc3)n(CC(F)(F)F)c2=S)C1	ZINC000819292336	GE	On-Demand	Anodyne	SLC6A1	82	33
O=C(O)[C@H]1CCN(Cn2nc(-c3ccncc3)n(CC(F)(F)F)c2=S)C1	ZINC000819292346	GE	On-Demand	Anodyne	SLC6A1	82	33
O=C(O)[C@@H]1CCN(c2nc(-c3ccncc3)nc3ccccc23)C1	ZINC000819292348	DF	On-Demand	Anodyne	SLC6A1	41	33
O=C(O)[C@@H]1CCN(c2nc(-c3ccncc3)nc3ccccc23)C1	ZINC000819292348	DF	On-Demand	Anodyne	PIK3CA	23	42
O=C(O)[C@@H]1CCN(c2nc(-c3ccncc3)nc3ccccc23)C1	ZINC000819292348	DF	On-Demand	Anodyne	PRKD1	30	42
O=C(O)[C@@H]1CCN(c2nc(-c3ccncc3)nc3ccccc23)C1	ZINC000819292348	DF	On-Demand	Anodyne	SMO	39	43
O=C(O)[C@H]1CCN(c2nc(-c3ccncc3)nc3ccccc23)C1	ZINC000819292350	DF	On-Demand	Anodyne	SLC6A1	41	33
O=C(O)[C@H]1CCN(c2nc(-c3ccncc3)nc3ccccc23)C1	ZINC000819292350	DF	On-Demand	Anodyne	PIK3CA	23	42
O=C(O)[C@H]1CCN(c2nc(-c3ccncc3)nc3ccccc23)C1	ZINC000819292350	DF	On-Demand	Anodyne	PRKD1	30	42
O=C(O)[C@H]1CCN(c2nc(-c3ccncc3)nc3ccccc23)C1	ZINC000819292350	DF	On-Demand	Anodyne	SMO	39	43
Cc1c(F)cccc1NC(=O)CCNCCCNC(=O)/C=C\c1ccccc1	ZINC000819292373	GG	On-Demand	Anodyne	HDAC2	20	43
Cc1c(F)cccc1NC(=O)CCNCCCNC(=O)/C=C\c1ccccc1	ZINC000819292373	GG	On-Demand	Anodyne	HDAC6	18	43
Cc1c(F)cccc1NC(=O)CCNCCCNC(=O)/C=C\c1ccccc1	ZINC000819292373	GG	On-Demand	Anodyne	HDAC9	34	43
Cc1c(F)cccc1NC(=O)CCNCCCNC(=O)/C=C\c1ccccc1	ZINC000819292373	GG	On-Demand	Anodyne	HDAC7	43	43
Cc1c(F)cccc1NC(=O)CCNCCCNC(=O)/C=C/c1ccccc1	ZINC000819292374	GG	On-Demand	Anodyne	HDAC2	20	43
Cc1c(F)cccc1NC(=O)CCNCCCNC(=O)/C=C/c1ccccc1	ZINC000819292374	GG	On-Demand	Anodyne	HDAC6	18	43
Cc1c(F)cccc1NC(=O)CCNCCCNC(=O)/C=C/c1ccccc1	ZINC000819292374	GG	On-Demand	Anodyne	HDAC9	34	43
Cc1c(F)cccc1NC(=O)CCNCCCNC(=O)/C=C/c1ccccc1	ZINC000819292374	GG	On-Demand	Anodyne	HDAC7	43	43
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819292375	GF	On-Demand	Anodyne	ADRB2	29	41
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819292375	GF	On-Demand	Anodyne	ADRB1	51	39
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819292375	GF	On-Demand	Anodyne	ABCB1	18	47
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819292375	GF	On-Demand	Anodyne	LUCI_PHOPY	55	38
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819292376	GF	On-Demand	Anodyne	ADRB2	29	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819292376	GF	On-Demand	Anodyne	ADRB1	51	39
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819292376	GF	On-Demand	Anodyne	ABCB1	18	47
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819292376	GF	On-Demand	Anodyne	LUCI_PHOPY	55	38
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819292377	GF	On-Demand	Anodyne	ADRB2	29	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819292377	GF	On-Demand	Anodyne	ADRB1	51	39
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819292377	GF	On-Demand	Anodyne	ABCB1	18	47
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819292377	GF	On-Demand	Anodyne	LUCI_PHOPY	55	38
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819292378	GF	On-Demand	Anodyne	ADRB2	29	41
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819292378	GF	On-Demand	Anodyne	ADRB1	51	39
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819292378	GF	On-Demand	Anodyne	ABCB1	18	47
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)cc3)=NO2)cc1	ZINC000819292378	GF	On-Demand	Anodyne	LUCI_PHOPY	55	38
O=S(=O)(CCNC[C@H](O)CN1CCOCC1)CCc1ccccc1	ZINC000819292379	FB	On-Demand	Anodyne	ABCB1	46	38
O=S(=O)(CCNC[C@@H](O)CN1CCOCC1)CCc1ccccc1	ZINC000819292380	FB	On-Demand	Anodyne	ABCB1	46	38
CON(C)C(=O)CCNC[C@@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819292381	DD	On-Demand	Anodyne	MIF	16	40
CON(C)C(=O)CCNC[C@@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819292381	DD	On-Demand	Anodyne	LUCI_PHOPY	63	38
CON(C)C(=O)CCNC[C@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819292382	DD	On-Demand	Anodyne	MIF	16	40
CON(C)C(=O)CCNC[C@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819292382	DD	On-Demand	Anodyne	LUCI_PHOPY	63	38
C[S@@](=O)Cc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292383	GG	On-Demand	Mild	PAPA1_CARPA	47	47
C[S@@](=O)Cc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292383	GG	On-Demand	Mild	CCKAR	40	38
C[S@@](=O)Cc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292383	GG	On-Demand	Mild	CTSL	17	49
C[S@@](=O)Cc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292383	GG	On-Demand	Mild	CTSS	15	49
C[S@@](=O)Cc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292383	GG	On-Demand	Mild	FPR1	46	39
C[S@](=O)Cc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292384	GG	On-Demand	Mild	PAPA1_CARPA	47	47
C[S@](=O)Cc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292384	GG	On-Demand	Mild	CCKAR	40	38
C[S@](=O)Cc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292384	GG	On-Demand	Mild	CTSL	17	49
C[S@](=O)Cc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292384	GG	On-Demand	Mild	CTSS	15	49
C[S@](=O)Cc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292384	GG	On-Demand	Mild	FPR1	46	39
C[S@](=O)Cc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292385	GG	On-Demand	Mild	PAPA1_CARPA	47	47
C[S@](=O)Cc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292385	GG	On-Demand	Mild	CCKAR	40	38
C[S@](=O)Cc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292385	GG	On-Demand	Mild	CTSL	17	49
C[S@](=O)Cc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292385	GG	On-Demand	Mild	CTSS	15	49
C[S@](=O)Cc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292385	GG	On-Demand	Mild	FPR1	46	39
C[S@@](=O)Cc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292386	GG	On-Demand	Mild	PAPA1_CARPA	47	47
C[S@@](=O)Cc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292386	GG	On-Demand	Mild	CCKAR	40	38
C[S@@](=O)Cc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292386	GG	On-Demand	Mild	CTSL	17	49
C[S@@](=O)Cc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292386	GG	On-Demand	Mild	CTSS	15	49
C[S@@](=O)Cc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819292386	GG	On-Demand	Mild	FPR1	46	39
COc1cccc([S@@](=O)CC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C)c1	ZINC000819292389	GE	On-Demand	Anodyne	MTNR1A	22	40
COc1cccc([S@@](=O)CC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C)c1	ZINC000819292389	GE	On-Demand	Anodyne	MTNR1B	26	40
O=S(=O)(CCNC[C@H](O)c1ccccc1Cl)CCc1ccccc1	ZINC000819292393	FF	On-Demand	Anodyne	ADRB2	51	42
O=S(=O)(CCNC[C@H](O)c1ccccc1Cl)CCc1ccccc1	ZINC000819292393	FF	On-Demand	Anodyne	ADRB1	51	42
O=S(=O)(CCNC[C@H](O)c1ccccc1Cl)CCc1ccccc1	ZINC000819292393	FF	On-Demand	Anodyne	ADRB3	53	38
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)CCc1ccccc1	ZINC000819292394	FF	On-Demand	Anodyne	ADRB2	86	46
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)CCc1ccccc1	ZINC000819292394	FF	On-Demand	Anodyne	ADRB1	98	58
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)CCc1ccccc1	ZINC000819292394	FF	On-Demand	Anodyne	ADRB3	156	58
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)CCc1ccccc1	ZINC000819292395	FF	On-Demand	Anodyne	ADRB2	86	46
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)CCc1ccccc1	ZINC000819292395	FF	On-Demand	Anodyne	ADRB1	98	58
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)CCc1ccccc1	ZINC000819292395	FF	On-Demand	Anodyne	ADRB3	156	58
COCc1csc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819292413	FF	On-Demand	Mild	PAPA1_CARPA	43	45
COCc1csc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819292414	FF	On-Demand	Mild	PAPA1_CARPA	43	45
COC[C@@H](O)CNC[C@@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819292417	CD	On-Demand	Anodyne	LUCI_PHOPY	77	41
COC[C@@H](O)CNC[C@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819292419	CD	On-Demand	Anodyne	LUCI_PHOPY	77	41
O=S(=O)(CCNC[C@@H](O)c1ccc(F)c(F)c1)CCc1ccccc1	ZINC000819292421	FE	On-Demand	Anodyne	ADRB2	59	44
O=S(=O)(CCNC[C@@H](O)c1ccc(F)c(F)c1)CCc1ccccc1	ZINC000819292421	FE	On-Demand	Anodyne	ADRB1	58	44
O=S(=O)(CCNC[C@@H](O)c1ccc(F)c(F)c1)CCc1ccccc1	ZINC000819292421	FE	On-Demand	Anodyne	ADRB3	115	44
O=S(=O)(CCNC[C@H](O)c1ccc(F)c(F)c1)CCc1ccccc1	ZINC000819292422	FE	On-Demand	Anodyne	ADRB2	59	44
O=S(=O)(CCNC[C@H](O)c1ccc(F)c(F)c1)CCc1ccccc1	ZINC000819292422	FE	On-Demand	Anodyne	ADRB1	58	44
O=S(=O)(CCNC[C@H](O)c1ccc(F)c(F)c1)CCc1ccccc1	ZINC000819292422	FE	On-Demand	Anodyne	ADRB3	115	44
N#CCCNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819292466	CD	On-Demand	Mild	LUCI_PHOPY	66	37
N#CCCNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819292467	CD	On-Demand	Mild	LUCI_PHOPY	66	37
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccc(F)cc1Cl	ZINC000819292476	GG	On-Demand	Anodyne	LUCI_PHOPY	40	38
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccc(F)cc1Cl	ZINC000819292477	GG	On-Demand	Anodyne	LUCI_PHOPY	40	38
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccc(F)cc1Cl	ZINC000819292478	GG	On-Demand	Anodyne	LUCI_PHOPY	40	38
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccc(F)cc1Cl	ZINC000819292479	GG	On-Demand	Anodyne	LUCI_PHOPY	40	38
CCOC[C@H](O)CNC[C@H]1CC(c2ccc(OC)c(F)c2)=NO1	ZINC000819292481	ED	On-Demand	Anodyne	MIF	18	43
CCOC[C@H](O)CNC[C@H]1CC(c2ccc(OC)c(F)c2)=NO1	ZINC000819292481	ED	On-Demand	Anodyne	LUCI_PHOPY	64	39
CCOC[C@H](O)CNC[C@@H]1CC(c2ccc(OC)c(F)c2)=NO1	ZINC000819292482	ED	On-Demand	Anodyne	MIF	18	43
CCOC[C@H](O)CNC[C@@H]1CC(c2ccc(OC)c(F)c2)=NO1	ZINC000819292482	ED	On-Demand	Anodyne	LUCI_PHOPY	64	39
NC(=O)CCNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819292494	CC	On-Demand	Anodyne	LUCI_PHOPY	64	35
NC(=O)CCNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819292495	CC	On-Demand	Anodyne	LUCI_PHOPY	64	35
O=C(O)[C@@H]1CCN(c2cnn(-c3nc4ccccc4[nH]3)c(=O)c2Cl)C1	ZINC000819292497	FD	On-Demand	Anodyne	KCNN3	22	40
O=C(O)[C@H]1CCN(c2cnn(-c3nc4ccccc4[nH]3)c(=O)c2Cl)C1	ZINC000819292500	FD	On-Demand	Anodyne	KCNN3	22	40
O[C@H](CNCc1ccsc1Br)c1cccnc1	ZINC000819292504	DF	On-Demand	Anodyne	ADRB2	22	44
O[C@H](CNCc1ccsc1Br)c1cccnc1	ZINC000819292504	DF	On-Demand	Anodyne	ADRB1	24	44
O[C@H](CNCc1ccsc1Br)c1cccnc1	ZINC000819292504	DF	On-Demand	Anodyne	ADRB3	91	45
O=C(O)[C@@H]1CCN(S(=O)(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)C1	ZINC000819292505	EB	On-Demand	Anodyne	EPHX2	24	40
O=C(O)[C@@H]1CCN(S(=O)(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)C1	ZINC000819292505	EB	On-Demand	Anodyne	AKR1C3	30	53
O[C@@H](CNCc1ccsc1Br)c1cccnc1	ZINC000819292506	DF	On-Demand	Anodyne	ADRB2	22	44
O[C@@H](CNCc1ccsc1Br)c1cccnc1	ZINC000819292506	DF	On-Demand	Anodyne	ADRB1	24	44
O[C@@H](CNCc1ccsc1Br)c1cccnc1	ZINC000819292506	DF	On-Demand	Anodyne	ADRB3	91	45
O=C(O)[C@H]1CCN(S(=O)(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)C1	ZINC000819292508	EB	On-Demand	Anodyne	EPHX2	24	40
O=C(O)[C@H]1CCN(S(=O)(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)C1	ZINC000819292508	EB	On-Demand	Anodyne	AKR1C3	30	53
O=C(O)[C@@H]1CCN(Cn2nc(C3CC3)cc(C(F)(F)F)c2=O)C1	ZINC000819292510	ED	On-Demand	Anodyne	SLC6A1	34	40
O=C(O)[C@H]1CCN(Cn2nc(C3CC3)cc(C(F)(F)F)c2=O)C1	ZINC000819292512	ED	On-Demand	Anodyne	SLC6A1	34	40
O=C(O)[C@H]1CCN(Cn2nc(-c3ccncc3)n(-c3ccccc3)c2=S)C1	ZINC000819292514	GF	On-Demand	Anodyne	SLC6A1	128	36
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccncc3)n(-c3ccccc3)c2=S)C1	ZINC000819292516	GF	On-Demand	Anodyne	SLC6A1	128	36
O=C(O)[C@H]1CCN(c2nccc(N3CCOCC3)n2)C1	ZINC000819292518	CC	On-Demand	Anodyne	PIK3CA	20	43
O=C(O)[C@H]1CCN(c2nccc(N3CCOCC3)n2)C1	ZINC000819292518	CC	On-Demand	Anodyne	MTOR	20	42
O=C(O)[C@H]1CCN(c2nccc(N3CCOCC3)n2)C1	ZINC000819292518	CC	On-Demand	Anodyne	SORD	64	36
O=C(O)[C@@H]1CCN(c2nccc(N3CCOCC3)n2)C1	ZINC000819292522	CC	On-Demand	Anodyne	PIK3CA	20	43
O=C(O)[C@@H]1CCN(c2nccc(N3CCOCC3)n2)C1	ZINC000819292522	CC	On-Demand	Anodyne	MTOR	20	42
O=C(O)[C@@H]1CCN(c2nccc(N3CCOCC3)n2)C1	ZINC000819292522	CC	On-Demand	Anodyne	SORD	64	36
O=C(O)[C@@H]1CCN(S(=O)(=O)c2ccc3nc(Cl)cnc3c2)C1	ZINC000819292524	ED	On-Demand	Anodyne	AKR1C3	19	51
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)CC(F)(F)F	ZINC000819292525	EE	On-Demand	Anodyne	LUCI_PHOPY	58	34
O=C(O)[C@H]1CCN(S(=O)(=O)c2ccc3nc(Cl)cnc3c2)C1	ZINC000819292526	ED	On-Demand	Anodyne	AKR1C3	19	51
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)CC(F)(F)F	ZINC000819292527	EE	On-Demand	Anodyne	LUCI_PHOPY	58	34
O=C(O)[C@@H]1CCN(Cn2[nH]c(/C=C\c3ccccc3)nc2=S)C1	ZINC000819292528	EE	On-Demand	Anodyne	SLC6A1	134	38
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)CC(F)(F)F	ZINC000819292529	EE	On-Demand	Anodyne	LUCI_PHOPY	58	34
O=C(O)[C@H]1CCN(Cn2[nH]c(/C=C\c3ccccc3)nc2=S)C1	ZINC000819292530	EE	On-Demand	Anodyne	SLC6A1	134	38
O=C(O)[C@@H]1CCN(Cn2[nH]c(/C=C/c3ccccc3)nc2=S)C1	ZINC000819292531	EE	On-Demand	Anodyne	SLC6A1	134	38
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)CC(F)(F)F	ZINC000819292532	EE	On-Demand	Anodyne	LUCI_PHOPY	58	34
O=C(O)[C@H]1CCN(Cn2[nH]c(/C=C/c3ccccc3)nc2=S)C1	ZINC000819292533	EE	On-Demand	Anodyne	SLC6A1	134	38
O=C(O)C1CCN(Cn2ncc3cc(OCc4ccccc4)ccc32)CC1	ZINC000819292535	FG	On-Demand	Anodyne	ERBB2	15	43
O=C(O)C1CCN(Cn2ncc3cc(OCc4ccccc4)ccc32)CC1	ZINC000819292535	FG	On-Demand	Anodyne	LTA4H	27	46
O=C(O)C1CCN(Cn2ncc3cc(OCc4ccccc4)ccc32)CC1	ZINC000819292535	FG	On-Demand	Anodyne	S1PR1	16	40
O=C(O)C1CCN(Cn2ncc3cc(OCc4ccccc4)ccc32)CC1	ZINC000819292535	FG	On-Demand	Anodyne	MCHR1	23	54
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccc3F)n(C3CC3)c2=S)C1	ZINC000819292542	FF	On-Demand	Anodyne	SLC6A1	149	44
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccc3F)n(C3CC3)c2=S)C1	ZINC000819292545	FF	On-Demand	Anodyne	SLC6A1	149	44
O=C(O)[C@H]1CCN(Cn2nc(-c3ccco3)n(Cc3ccccc3)c2=S)C1	ZINC000819292547	GG	On-Demand	Anodyne	SLC6A1	135	36
O=C(O)[C@H]1CCN(Cn2nc(-c3ccco3)n(Cc3ccccc3)c2=S)C1	ZINC000819292547	GG	On-Demand	Anodyne	S1PR5	20	42
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccco3)n(Cc3ccccc3)c2=S)C1	ZINC000819292549	GG	On-Demand	Anodyne	SLC6A1	135	36
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccco3)n(Cc3ccccc3)c2=S)C1	ZINC000819292549	GG	On-Demand	Anodyne	S1PR5	20	42
O=C(O)[C@@H]1CCN(Cn2nc(C3CC3)n(-c3ccccc3)c2=S)C1	ZINC000819292552	EF	On-Demand	Anodyne	SLC6A1	134	39
O=C(O)[C@H]1CCN(Cn2nc(C3CC3)n(-c3ccccc3)c2=S)C1	ZINC000819292554	EF	On-Demand	Anodyne	SLC6A1	134	39
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1NC(=O)C1CCCCC1	ZINC000819292555	FH	On-Demand	Anodyne	STK17B	45	44
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1NC(=O)C1CCCCC1	ZINC000819292555	FH	On-Demand	Anodyne	STK17A	16	42
O=C(O)[C@@H]1CCN(Cn2nccc2[N+](=O)[O-])C1	ZINC000819292556	BC	On-Demand	Bother	SLC6A1	82	34
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1NC(=O)C1CCCCC1	ZINC000819292557	FH	On-Demand	Anodyne	STK17B	45	44
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1NC(=O)C1CCCCC1	ZINC000819292557	FH	On-Demand	Anodyne	STK17A	16	42
O=C(O)[C@H]1CCN(Cn2nccc2[N+](=O)[O-])C1	ZINC000819292558	BC	On-Demand	Bother	SLC6A1	82	34
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1NC(=O)C1CCCCC1	ZINC000819292559	FH	On-Demand	Anodyne	STK17B	45	44
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1NC(=O)C1CCCCC1	ZINC000819292559	FH	On-Demand	Anodyne	STK17A	16	42
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccn3)n(Cc3ccco3)c2=S)C1	ZINC000819292560	GE	On-Demand	Anodyne	SLC6A1	62	32
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1NC(=O)C1CCCCC1	ZINC000819292561	FH	On-Demand	Anodyne	STK17B	45	44
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1NC(=O)C1CCCCC1	ZINC000819292561	FH	On-Demand	Anodyne	STK17A	16	42
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccn3)n(Cc3ccco3)c2=S)C1	ZINC000819292562	GE	On-Demand	Anodyne	SLC6A1	62	32
O=C(O)[C@H]1CCN(Cn2nc3n(c2=S)CCCCC3)C1	ZINC000819292564	CD	On-Demand	Anodyne	SLC6A1	76	34
O=C(O)[C@@H]1CCN(Cn2nc3n(c2=S)CCCCC3)C1	ZINC000819292567	CD	On-Demand	Anodyne	SLC6A1	76	34
O=C(O)[C@H]1CCN(Cn2ncsc2=S)C1	ZINC000819292574	BD	On-Demand	Anodyne	SLC6A1	114	35
O=C(O)[C@@H]1CCN(Cn2ncsc2=S)C1	ZINC000819292575	BD	On-Demand	Anodyne	SLC6A1	114	35
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccco3)n(Cc3ccco3)c2=S)C1	ZINC000819292578	FF	On-Demand	Anodyne	SLC6A1	101	34
O=C(O)[C@H]1CCN(Cn2nc(-c3ccco3)n(Cc3ccco3)c2=S)C1	ZINC000819292579	FF	On-Demand	Anodyne	SLC6A1	101	34
O=C(O)[C@@H]1CCN(Cn2[nH]c(-c3ccccc3Br)nc2=S)C1	ZINC000819292583	GF	On-Demand	Anodyne	SLC6A1	119	39
O=C(O)[C@H]1CCN(Cn2[nH]c(-c3ccccc3Br)nc2=S)C1	ZINC000819292584	GF	On-Demand	Anodyne	SLC6A1	119	39
O=C(O)[C@H]1CCN(c2nccc(N3CCCC3)n2)C1	ZINC000819292587	CC	On-Demand	Anodyne	SORD	102	39
O=C(O)[C@H]1CCN(c2nccc(N3CCCC3)n2)C1	ZINC000819292587	CC	On-Demand	Anodyne	GPBAR1	18	42
O=C(O)[C@@H]1CCN(c2nccc(N3CCCC3)n2)C1	ZINC000819292588	CC	On-Demand	Anodyne	SORD	102	39
O=C(O)[C@@H]1CCN(c2nccc(N3CCCC3)n2)C1	ZINC000819292588	CC	On-Demand	Anodyne	GPBAR1	18	42
O=C(O)[C@H]1CCN(Cn2nc(-c3ccccn3)n(-c3ccccc3)c2=S)C1	ZINC000819292589	GF	On-Demand	Anodyne	SLC6A1	126	37
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccccn3)n(-c3ccccc3)c2=S)C1	ZINC000819292590	GF	On-Demand	Anodyne	SLC6A1	126	37
O=C(O)[C@H]1CCN(Cn2nc(N3CCCCC3)n(-c3ccccc3)c2=S)C1	ZINC000819292591	GF	On-Demand	Anodyne	SLC6A1	149	40
O=C(O)[C@@H]1CCN(Cn2nc(N3CCCCC3)n(-c3ccccc3)c2=S)C1	ZINC000819292592	GF	On-Demand	Anodyne	SLC6A1	149	40
O=C(O)[C@H]1CCN(Cn2nc(NC3CCCCC3)sc2=S)C1	ZINC000819292593	EF	On-Demand	Anodyne	SLC6A1	40	32
O=C(O)[C@@H]1CCN(Cn2nc(NC3CCCCC3)sc2=S)C1	ZINC000819292594	EF	On-Demand	Anodyne	SLC6A1	40	32
O=C(O)[C@@H]1CCN(Cn2nc(N3CCCC3)sc2=S)C1	ZINC000819292597	DD	On-Demand	Anodyne	SLC6A1	87	34
O=C(O)[C@H]1CCN(Cn2nc(N3CCCC3)sc2=S)C1	ZINC000819292598	DD	On-Demand	Anodyne	SLC6A1	87	34
O=C(O)[C@@H]1CCN(Cn2nc3sc4ccccc4n3c2=S)C1	ZINC000819292599	EE	On-Demand	Anodyne	SLC6A1	126	36
O=C(O)[C@H]1CCN(Cn2nc3sc4ccccc4n3c2=S)C1	ZINC000819292600	EE	On-Demand	Anodyne	SLC6A1	126	36
O=C(O)[C@H]1CCN(Cn2ncn(-c3cccc(Cl)c3)c2=S)C1	ZINC000819292601	EE	On-Demand	Anodyne	SLC6A1	109	42
O=C(O)[C@@H]1CCN(Cn2ncn(-c3cccc(Cl)c3)c2=S)C1	ZINC000819292602	EE	On-Demand	Anodyne	SLC6A1	109	42
O=C(O)[C@@H]1CCN(Cn2nnn(-c3ccc(Cl)cc3)c2=S)C1	ZINC000819292603	ED	On-Demand	Anodyne	SLC6A1	128	39
O=C(O)[C@H]1CCN(Cn2nnn(-c3ccc(Cl)cc3)c2=S)C1	ZINC000819292604	ED	On-Demand	Anodyne	SLC6A1	128	39
O=C(O)[C@H]1CCN(Cn2nc(-c3ccncc3)oc2=S)C1	ZINC000819292605	DD	On-Demand	Anodyne	SLC6A1	67	33
O=C(O)[C@@H]1CCN(Cn2nc(-c3ccncc3)oc2=S)C1	ZINC000819292606	DD	On-Demand	Anodyne	SLC6A1	67	33
O=C(O)[C@@H]1CCN(S(=O)(=O)c2ccc(CCCl)cc2)C1	ZINC000819292607	DD	On-Demand	Reactive	EPHX2	20	41
O=C(O)[C@@H]1CCN(S(=O)(=O)c2ccc(CCCl)cc2)C1	ZINC000819292607	DD	On-Demand	Reactive	TGM2	49	39
O=C(O)[C@@H]1CCN(S(=O)(=O)c2ccc(CCCl)cc2)C1	ZINC000819292607	DD	On-Demand	Reactive	F13A1	40	36
O=C(O)[C@H]1CCN(S(=O)(=O)c2ccc(CCCl)cc2)C1	ZINC000819292608	DD	On-Demand	Reactive	EPHX2	20	41
O=C(O)[C@H]1CCN(S(=O)(=O)c2ccc(CCCl)cc2)C1	ZINC000819292608	DD	On-Demand	Reactive	TGM2	49	39
O=C(O)[C@H]1CCN(S(=O)(=O)c2ccc(CCCl)cc2)C1	ZINC000819292608	DD	On-Demand	Reactive	F13A1	40	36
O=C(O)[C@H]1CCN(Cn2nc(C3CC3)n(Cc3ccccc3)c2=S)C1	ZINC000819292609	FF	On-Demand	Anodyne	SLC6A1	123	37
O=C(O)[C@H]1CCN(Cn2nc(C3CC3)n(Cc3ccccc3)c2=S)C1	ZINC000819292609	FF	On-Demand	Anodyne	S1PR5	23	43
O=C(O)[C@@H]1CCN(Cn2nc(C3CC3)n(Cc3ccccc3)c2=S)C1	ZINC000819292610	FF	On-Demand	Anodyne	SLC6A1	123	37
O=C(O)[C@@H]1CCN(Cn2nc(C3CC3)n(Cc3ccccc3)c2=S)C1	ZINC000819292610	FF	On-Demand	Anodyne	S1PR5	23	43
O=C(O)[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCOCC2)C1	ZINC000819292611	GC	On-Demand	Bother	EPHX2	16	46
O=C(O)[C@H]1CCN(c2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCOCC2)C1	ZINC000819292612	GC	On-Demand	Bother	EPHX2	16	46
O=C(O)[C@@H]1CCN(Cn2sc3ccccc3c2=O)C1	ZINC000819292613	CD	On-Demand	Anodyne	SLC6A1	144	40
O=C(O)[C@@H]1CCN(Cn2sc3ccccc3c2=O)C1	ZINC000819292613	CD	On-Demand	Anodyne	CASP3	28	40
O=C(O)[C@@H]1CCN(Cn2sc3ccccc3c2=O)C1	ZINC000819292613	CD	On-Demand	Anodyne	CASP7	37	40
O=C(O)[C@H]1CCN(Cn2sc3ccccc3c2=O)C1	ZINC000819292614	CD	On-Demand	Anodyne	SLC6A1	144	40
O=C(O)[C@H]1CCN(Cn2sc3ccccc3c2=O)C1	ZINC000819292614	CD	On-Demand	Anodyne	CASP3	28	40
O=C(O)[C@H]1CCN(Cn2sc3ccccc3c2=O)C1	ZINC000819292614	CD	On-Demand	Anodyne	CASP7	37	40
O=C(O)[C@@H]1CCN(Cn2nc(N3CCCCC3)n(C3CC3)c2=S)C1	ZINC000819292615	FE	On-Demand	Anodyne	SLC6A1	60	35
O=C(O)[C@H]1CCN(Cn2nc(N3CCCCC3)n(C3CC3)c2=S)C1	ZINC000819292616	FE	On-Demand	Anodyne	SLC6A1	60	35
O=C(O)[C@@H]1CCN(c2nc(C(F)(F)F)nc3ccccc23)C1	ZINC000819292617	DF	On-Demand	Anodyne	SLC6A1	53	36
O=C(O)[C@@H]1CCN(c2nc(C(F)(F)F)nc3ccccc23)C1	ZINC000819292617	DF	On-Demand	Anodyne	LIPG	42	33
O=C(O)[C@H]1CCN(c2nc(C(F)(F)F)nc3ccccc23)C1	ZINC000819292618	DF	On-Demand	Anodyne	SLC6A1	53	36
O=C(O)[C@H]1CCN(c2nc(C(F)(F)F)nc3ccccc23)C1	ZINC000819292618	DF	On-Demand	Anodyne	LIPG	42	33
O=C(O)[C@@H]1CCN(Cn2nc(Br)nc2Br)C1	ZINC000819292619	FD	On-Demand	Anodyne	SLC6A1	53	35
O=C(O)[C@H]1CCN(Cn2nc(Br)nc2Br)C1	ZINC000819292620	FD	On-Demand	Anodyne	SLC6A1	53	35
O=C(O)[C@@H]1CCN(Cn2ncn(-c3ccccc3)c2=S)C1	ZINC000819292621	DD	On-Demand	Anodyne	SLC6A1	145	39
O=C(O)[C@H]1CCN(Cn2ncn(-c3ccccc3)c2=S)C1	ZINC000819292622	DD	On-Demand	Anodyne	SLC6A1	145	39
O=C(O)[C@@H]1CCN(Cn2nc(C3CC3)n(Cc3ccco3)c2=S)C1	ZINC000819292623	EE	On-Demand	Anodyne	SLC6A1	46	32
O=C(O)[C@H]1CCN(Cn2nc(C3CC3)n(Cc3ccco3)c2=S)C1	ZINC000819292624	EE	On-Demand	Anodyne	SLC6A1	46	32
O=C(O)[C@@H]1CCN(Cn2nnc3ccccc3c2=S)C1	ZINC000819292627	CD	On-Demand	Anodyne	SLC6A1	157	41
O=C(O)[C@H]1CCN(Cn2nnc3ccccc3c2=S)C1	ZINC000819292628	CD	On-Demand	Anodyne	SLC6A1	157	41
O=C(O)[C@@H]1CCN(c2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000819292629	DF	On-Demand	Anodyne	PIK3CA	19	41
O=C(O)[C@@H]1CCN(c2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000819292629	DF	On-Demand	Anodyne	PRKD1	27	40
O=C(O)[C@@H]1CCN(c2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000819292629	DF	On-Demand	Anodyne	SMO	29	43
O=C(O)[C@H]1CCN(c2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000819292630	DF	On-Demand	Anodyne	PIK3CA	19	41
O=C(O)[C@H]1CCN(c2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000819292630	DF	On-Demand	Anodyne	PRKD1	27	40
O=C(O)[C@H]1CCN(c2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000819292630	DF	On-Demand	Anodyne	SMO	29	43
O=C(/C=C/c1ccccc1)NCCCNCCS(=O)(=O)c1ccccc1	ZINC000819292657	FE	On-Demand	Anodyne	HDAC8	27	42
O=C(/C=C/c1ccccc1)NCCCNCCS(=O)(=O)c1ccccc1	ZINC000819292657	FE	On-Demand	Anodyne	HDAC1	20	43
O=C(/C=C/c1ccccc1)NCCCNCCS(=O)(=O)c1ccccc1	ZINC000819292657	FE	On-Demand	Anodyne	HDAC2	20	43
O=C(/C=C/c1ccccc1)NCCCNCCS(=O)(=O)c1ccccc1	ZINC000819292657	FE	On-Demand	Anodyne	HDAC9	35	43
O=C(/C=C/c1ccccc1)NCCCNCCS(=O)(=O)c1ccccc1	ZINC000819292657	FE	On-Demand	Anodyne	HDAC7	43	43
O=C(/C=C\c1ccccc1)NCCCNCCS(=O)(=O)c1ccccc1	ZINC000819292658	FE	On-Demand	Anodyne	HDAC8	27	42
O=C(/C=C\c1ccccc1)NCCCNCCS(=O)(=O)c1ccccc1	ZINC000819292658	FE	On-Demand	Anodyne	HDAC1	20	43
O=C(/C=C\c1ccccc1)NCCCNCCS(=O)(=O)c1ccccc1	ZINC000819292658	FE	On-Demand	Anodyne	HDAC2	20	43
O=C(/C=C\c1ccccc1)NCCCNCCS(=O)(=O)c1ccccc1	ZINC000819292658	FE	On-Demand	Anodyne	HDAC9	35	43
O=C(/C=C\c1ccccc1)NCCCNCCS(=O)(=O)c1ccccc1	ZINC000819292658	FE	On-Demand	Anodyne	HDAC7	43	43
O=C(/C=C\c1ccccc1)NCCCNCCS(=O)(=O)c1ccc(F)cc1	ZINC000819292687	GE	On-Demand	Anodyne	HDAC7	41	39
O=C(/C=C/c1ccccc1)NCCCNCCS(=O)(=O)c1ccc(F)cc1	ZINC000819292688	GE	On-Demand	Anodyne	HDAC7	41	39
O=S(=O)(CCNC[C@@H](O)C1CCCCC1)CCc1ccccc1	ZINC000819292699	EE	On-Demand	Anodyne	ADRB1	21	40
O=S(=O)(CCNC[C@H](O)C1CCCCC1)CCc1ccccc1	ZINC000819292700	EE	On-Demand	Anodyne	ADRB1	21	40
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819292707	FG	On-Demand	Anodyne	ADRB2	49	38
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819292707	FG	On-Demand	Anodyne	ADRB1	54	52
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819292707	FG	On-Demand	Anodyne	ADRB3	68	52
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819292707	FG	On-Demand	Anodyne	HDAC6	15	41
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819292707	FG	On-Demand	Anodyne	HDAC9	29	41
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819292707	FG	On-Demand	Anodyne	HDAC7	35	41
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819292708	FG	On-Demand	Anodyne	ADRB2	49	38
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819292708	FG	On-Demand	Anodyne	ADRB1	54	52
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819292708	FG	On-Demand	Anodyne	ADRB3	68	52
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819292708	FG	On-Demand	Anodyne	HDAC6	15	41
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819292708	FG	On-Demand	Anodyne	HDAC9	29	41
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819292708	FG	On-Demand	Anodyne	HDAC7	35	41
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819292709	FG	On-Demand	Anodyne	ADRB2	49	38
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819292709	FG	On-Demand	Anodyne	ADRB1	54	52
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819292709	FG	On-Demand	Anodyne	ADRB3	68	52
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819292709	FG	On-Demand	Anodyne	HDAC6	15	41
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819292709	FG	On-Demand	Anodyne	HDAC9	29	41
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819292709	FG	On-Demand	Anodyne	HDAC7	35	41
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819292710	FG	On-Demand	Anodyne	ADRB2	49	38
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819292710	FG	On-Demand	Anodyne	ADRB1	54	52
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819292710	FG	On-Demand	Anodyne	ADRB3	68	52
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819292710	FG	On-Demand	Anodyne	HDAC6	15	41
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819292710	FG	On-Demand	Anodyne	HDAC9	29	41
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819292710	FG	On-Demand	Anodyne	HDAC7	35	41
Cc1cc(F)ccc1[C@@H](O)CNCCCNC(=O)/C=C\c1ccccc1	ZINC000819292713	FF	On-Demand	Anodyne	HDAC6	15	41
Cc1cc(F)ccc1[C@@H](O)CNCCCNC(=O)/C=C\c1ccccc1	ZINC000819292713	FF	On-Demand	Anodyne	HDAC9	33	41
Cc1cc(F)ccc1[C@@H](O)CNCCCNC(=O)/C=C\c1ccccc1	ZINC000819292713	FF	On-Demand	Anodyne	HDAC7	41	41
Cc1cc(F)ccc1[C@@H](O)CNCCCNC(=O)/C=C\c1ccccc1	ZINC000819292713	FF	On-Demand	Anodyne	LEF	51	32
Cc1cc(F)ccc1[C@@H](O)CNCCCNC(=O)/C=C/c1ccccc1	ZINC000819292714	FF	On-Demand	Anodyne	HDAC6	15	41
Cc1cc(F)ccc1[C@@H](O)CNCCCNC(=O)/C=C/c1ccccc1	ZINC000819292714	FF	On-Demand	Anodyne	HDAC9	33	41
Cc1cc(F)ccc1[C@@H](O)CNCCCNC(=O)/C=C/c1ccccc1	ZINC000819292714	FF	On-Demand	Anodyne	HDAC7	41	41
Cc1cc(F)ccc1[C@@H](O)CNCCCNC(=O)/C=C/c1ccccc1	ZINC000819292714	FF	On-Demand	Anodyne	LEF	51	32
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)C1CC1	ZINC000819292725	CD	On-Demand	Anodyne	HDAC2	15	41
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)C1CC1	ZINC000819292725	CD	On-Demand	Anodyne	HDAC9	33	41
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)C1CC1	ZINC000819292725	CD	On-Demand	Anodyne	HDAC7	40	41
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)C1CC1	ZINC000819292726	CD	On-Demand	Anodyne	HDAC2	15	41
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)C1CC1	ZINC000819292726	CD	On-Demand	Anodyne	HDAC9	33	41
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)C1CC1	ZINC000819292726	CD	On-Demand	Anodyne	HDAC7	40	41
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)C1CC1	ZINC000819292727	CD	On-Demand	Anodyne	HDAC2	15	41
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)C1CC1	ZINC000819292727	CD	On-Demand	Anodyne	HDAC9	33	41
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)C1CC1	ZINC000819292727	CD	On-Demand	Anodyne	HDAC7	40	41
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)C1CC1	ZINC000819292728	CD	On-Demand	Anodyne	HDAC2	15	41
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)C1CC1	ZINC000819292728	CD	On-Demand	Anodyne	HDAC9	33	41
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)C1CC1	ZINC000819292728	CD	On-Demand	Anodyne	HDAC7	40	41
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)Cc1ccc(F)cc1	ZINC000819292776	FE	On-Demand	Anodyne	LUCI_PHOPY	69	43
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)Cc1ccc(F)cc1	ZINC000819292777	FE	On-Demand	Anodyne	LUCI_PHOPY	69	43
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)Cc1ccc(F)cc1	ZINC000819292778	FE	On-Demand	Anodyne	LUCI_PHOPY	69	43
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)Cc1ccc(F)cc1	ZINC000819292779	FE	On-Demand	Anodyne	LUCI_PHOPY	69	43
COC[C@@H](O)CNC[C@@H]1CC(c2ccc(OC)c(C)c2)=NO1	ZINC000819292788	DD	On-Demand	Anodyne	LUCI_PHOPY	67	40
COC[C@@H](O)CNC[C@H]1CC(c2ccc(OC)c(C)c2)=NO1	ZINC000819292790	DD	On-Demand	Anodyne	LUCI_PHOPY	67	40
CC[C@@H](O)CNC[C@@H]1CC(c2ccc(OC)c(F)c2)=NO1	ZINC000819292806	CD	On-Demand	Anodyne	MIF	19	45
CC[C@@H](O)CNC[C@@H]1CC(c2ccc(OC)c(F)c2)=NO1	ZINC000819292806	CD	On-Demand	Anodyne	LUCI_PHOPY	73	41
CC[C@H](O)CNC[C@H]1CC(c2ccc(OC)c(F)c2)=NO1	ZINC000819292807	CD	On-Demand	Anodyne	MIF	19	45
CC[C@H](O)CNC[C@H]1CC(c2ccc(OC)c(F)c2)=NO1	ZINC000819292807	CD	On-Demand	Anodyne	LUCI_PHOPY	73	41
CC[C@H](O)CNC[C@@H]1CC(c2ccc(OC)c(F)c2)=NO1	ZINC000819292808	CD	On-Demand	Anodyne	MIF	19	45
CC[C@H](O)CNC[C@@H]1CC(c2ccc(OC)c(F)c2)=NO1	ZINC000819292808	CD	On-Demand	Anodyne	LUCI_PHOPY	73	41
CC[C@@H](O)CNC[C@H]1CC(c2ccc(OC)c(F)c2)=NO1	ZINC000819292809	CD	On-Demand	Anodyne	MIF	19	45
CC[C@@H](O)CNC[C@H]1CC(c2ccc(OC)c(F)c2)=NO1	ZINC000819292809	CD	On-Demand	Anodyne	LUCI_PHOPY	73	41
N#Cc1ccc([C@H](O)CNC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	ZINC000819292811	FE	On-Demand	Mild	LUCI_PHOPY	35	42
N#Cc1ccc([C@@H](O)CNC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	ZINC000819292812	FE	On-Demand	Mild	LUCI_PHOPY	35	42
N#Cc1ccc([C@@H](O)CNC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	ZINC000819292813	FE	On-Demand	Mild	LUCI_PHOPY	35	42
N#Cc1ccc([C@H](O)CNC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	ZINC000819292814	FE	On-Demand	Mild	LUCI_PHOPY	35	42
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)COc1ccccc1	ZINC000819292815	FE	On-Demand	Anodyne	LUCI_PHOPY	75	39
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)COc1ccccc1	ZINC000819292816	FE	On-Demand	Anodyne	LUCI_PHOPY	75	39
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)COc1ccccc1	ZINC000819292817	FE	On-Demand	Anodyne	LUCI_PHOPY	75	39
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)COc1ccccc1	ZINC000819292818	FE	On-Demand	Anodyne	LUCI_PHOPY	75	39
NS(=O)(=O)c1ccc2c(c1)N(C(=O)C(F)=C1CCC1)CC2	ZINC000819292837	DD	On-Demand	Anodyne	CA2	17	51
NS(=O)(=O)c1ccc2c(c1)N(C(=O)C(F)=C1CCC1)CC2	ZINC000819292837	DD	On-Demand	Anodyne	CA7	35	51
NS(=O)(=O)c1ccc2c(c1)N(C(=O)C(F)=C1CCC1)CC2	ZINC000819292837	DD	On-Demand	Anodyne	CA14	18	45
O=C(/C=C\c1ccccc1)NCCCNCCC(=O)Nc1cccnc1	ZINC000819292840	FE	On-Demand	Anodyne	HDAC8	17	53
O=C(/C=C\c1ccccc1)NCCCNCCC(=O)Nc1cccnc1	ZINC000819292840	FE	On-Demand	Anodyne	HDAC1	17	53
O=C(/C=C\c1ccccc1)NCCCNCCC(=O)Nc1cccnc1	ZINC000819292840	FE	On-Demand	Anodyne	HDAC2	19	42
O=C(/C=C\c1ccccc1)NCCCNCCC(=O)Nc1cccnc1	ZINC000819292840	FE	On-Demand	Anodyne	HDAC3	28	53
O=C(/C=C\c1ccccc1)NCCCNCCC(=O)Nc1cccnc1	ZINC000819292840	FE	On-Demand	Anodyne	HDAC6	24	53
O=C(/C=C\c1ccccc1)NCCCNCCC(=O)Nc1cccnc1	ZINC000819292840	FE	On-Demand	Anodyne	HDAC9	29	42
O=C(/C=C\c1ccccc1)NCCCNCCC(=O)Nc1cccnc1	ZINC000819292840	FE	On-Demand	Anodyne	HDAC7	34	42
O=C(/C=C\c1ccccc1)NCCCNCCC(=O)Nc1cccnc1	ZINC000819292840	FE	On-Demand	Anodyne	NAMPT	17	46
O=C(/C=C/c1ccccc1)NCCCNCCC(=O)Nc1cccnc1	ZINC000819292841	FE	On-Demand	Anodyne	HDAC8	17	53
O=C(/C=C/c1ccccc1)NCCCNCCC(=O)Nc1cccnc1	ZINC000819292841	FE	On-Demand	Anodyne	HDAC1	17	53
O=C(/C=C/c1ccccc1)NCCCNCCC(=O)Nc1cccnc1	ZINC000819292841	FE	On-Demand	Anodyne	HDAC2	19	42
O=C(/C=C/c1ccccc1)NCCCNCCC(=O)Nc1cccnc1	ZINC000819292841	FE	On-Demand	Anodyne	HDAC3	28	53
O=C(/C=C/c1ccccc1)NCCCNCCC(=O)Nc1cccnc1	ZINC000819292841	FE	On-Demand	Anodyne	HDAC6	24	53
O=C(/C=C/c1ccccc1)NCCCNCCC(=O)Nc1cccnc1	ZINC000819292841	FE	On-Demand	Anodyne	HDAC9	29	42
O=C(/C=C/c1ccccc1)NCCCNCCC(=O)Nc1cccnc1	ZINC000819292841	FE	On-Demand	Anodyne	HDAC7	34	42
O=C(/C=C/c1ccccc1)NCCCNCCC(=O)Nc1cccnc1	ZINC000819292841	FE	On-Demand	Anodyne	NAMPT	17	46
O=S(=O)(CCNC[C@H](O)Cc1ccc2ccccc2c1)CCc1ccccc1	ZINC000819292848	GF	On-Demand	Anodyne	ADRB2	46	44
O=S(=O)(CCNC[C@H](O)Cc1ccc2ccccc2c1)CCc1ccccc1	ZINC000819292848	GF	On-Demand	Anodyne	ADRB1	55	44
O=S(=O)(CCNC[C@H](O)Cc1ccc2ccccc2c1)CCc1ccccc1	ZINC000819292848	GF	On-Demand	Anodyne	ADRB3	69	44
O=S(=O)(CCNC[C@@H](O)Cc1ccc2ccccc2c1)CCc1ccccc1	ZINC000819292849	GF	On-Demand	Anodyne	ADRB2	46	44
O=S(=O)(CCNC[C@@H](O)Cc1ccc2ccccc2c1)CCc1ccccc1	ZINC000819292849	GF	On-Demand	Anodyne	ADRB1	55	44
O=S(=O)(CCNC[C@@H](O)Cc1ccc2ccccc2c1)CCc1ccccc1	ZINC000819292849	GF	On-Demand	Anodyne	ADRB3	69	44
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cc2ccccc2o1	ZINC000819292856	GG	On-Demand	Anodyne	LUCI_PHOPY	60	39
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cc2ccccc2o1	ZINC000819292859	GG	On-Demand	Anodyne	LUCI_PHOPY	60	39
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)c1	ZINC000819292870	GE	On-Demand	Anodyne	LUCI_PHOPY	42	40
COc1ccc(OC)c([C@H](O)CNC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)c1	ZINC000819292876	GE	On-Demand	Anodyne	LUCI_PHOPY	42	40
O=S(=O)(CCNC[C@@H](O)c1cc2ccccc2o1)CCc1ccccc1	ZINC000819292883	FF	On-Demand	Anodyne	ADRB3	45	42
CCOC(=O)CC[C@@H](O)CNC[C@@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819292906	ED	On-Demand	Anodyne	LUCI_PHOPY	60	34
CON(C)C(=O)CCNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819292907	ED	On-Demand	Anodyne	LUCI_PHOPY	65	34
CCOC(=O)CC[C@H](O)CNC[C@@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819292908	ED	On-Demand	Anodyne	LUCI_PHOPY	60	34
CON(C)C(=O)CCNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819292909	ED	On-Demand	Anodyne	LUCI_PHOPY	65	34
CCOC(=O)CC[C@@H](O)CNC[C@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819292910	ED	On-Demand	Anodyne	LUCI_PHOPY	60	34
CCOC(=O)CC[C@H](O)CNC[C@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819292912	ED	On-Demand	Anodyne	LUCI_PHOPY	60	34
O=S(=O)(CCNC[C@H](O)c1ccc(F)cn1)CCc1ccccc1	ZINC000819292925	FD	On-Demand	Anodyne	ADRB3	72	39
O=S(=O)(CCNC[C@@H](O)c1ccc(F)cn1)CCc1ccccc1	ZINC000819292927	FD	On-Demand	Anodyne	ADRB3	72	39
COc1ccccc1COC[C@@H](O)CNC[C@@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819292929	GF	On-Demand	Anodyne	LUCI_PHOPY	80	52
COc1ccccc1COC[C@H](O)CNC[C@@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819292931	GF	On-Demand	Anodyne	LUCI_PHOPY	80	52
COc1ccccc1COC[C@@H](O)CNC[C@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819292933	GF	On-Demand	Anodyne	LUCI_PHOPY	80	52
COc1ccccc1COC[C@H](O)CNC[C@H]1CC(c2ccc(C)cc2)=NO1	ZINC000819292935	GF	On-Demand	Anodyne	LUCI_PHOPY	80	52
O=C(/C=C/c1ccccc1)NCCCNC[C@@H](O)CC1CCCC1	ZINC000819292963	EF	On-Demand	Anodyne	MMP2	15	47
O=C(/C=C\c1ccccc1)NCCCNC[C@@H](O)CC1CCCC1	ZINC000819292965	EF	On-Demand	Anodyne	MMP2	15	47
O=C(/C=C/c1ccccc1)NCCCNC[C@H](O)CC1CCCC1	ZINC000819292967	EF	On-Demand	Anodyne	MMP2	15	47
O=C(/C=C\c1ccccc1)NCCCNC[C@H](O)CC1CCCC1	ZINC000819292968	EF	On-Demand	Anodyne	MMP2	15	47
N#CCC[C@@H](C#N)CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819292969	DE	On-Demand	Mild	LUCI_PHOPY	46	33
N#CCC[C@H](C#N)CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819292974	DE	On-Demand	Mild	LUCI_PHOPY	46	33
N#CCC[C@H](C#N)CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819292976	DE	On-Demand	Mild	LUCI_PHOPY	46	33
N#CCC[C@@H](C#N)CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819292978	DE	On-Demand	Mild	LUCI_PHOPY	46	33
COc1cccc([S@@](=O)CC(=O)NCCNC(N)=O)c1	ZINC000819292988	CB	On-Demand	Anodyne	DRD4	42	32
COc1cccc([S@@](=O)CC(=O)NCCNC(N)=O)c1	ZINC000819292988	CB	On-Demand	Anodyne	MTNR1A	80	48
COc1cccc([S@@](=O)CC(=O)NCCNC(N)=O)c1	ZINC000819292988	CB	On-Demand	Anodyne	MTNR1B	72	44
O=S(=O)(CCNC[C@@H](O)Cc1ccccc1)CCc1ccccc1	ZINC000819293010	ED	On-Demand	Anodyne	ADRB2	41	45
O=S(=O)(CCNC[C@@H](O)Cc1ccccc1)CCc1ccccc1	ZINC000819293010	ED	On-Demand	Anodyne	ADRB1	47	45
O=S(=O)(CCNC[C@@H](O)Cc1ccccc1)CCc1ccccc1	ZINC000819293010	ED	On-Demand	Anodyne	ADRB3	61	45
O=S(=O)(CCNC[C@@H](O)Cc1ccccc1)CCc1ccccc1	ZINC000819293010	ED	On-Demand	Anodyne	ABCB1	15	41
O=S(=O)(CCNC[C@H](O)Cc1ccccc1)CCc1ccccc1	ZINC000819293017	ED	On-Demand	Anodyne	ADRB2	41	45
O=S(=O)(CCNC[C@H](O)Cc1ccccc1)CCc1ccccc1	ZINC000819293017	ED	On-Demand	Anodyne	ADRB1	47	45
O=S(=O)(CCNC[C@H](O)Cc1ccccc1)CCc1ccccc1	ZINC000819293017	ED	On-Demand	Anodyne	ADRB3	61	45
O=S(=O)(CCNC[C@H](O)Cc1ccccc1)CCc1ccccc1	ZINC000819293017	ED	On-Demand	Anodyne	ABCB1	15	41
C[C@@](O)(CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)C(F)(F)F	ZINC000819293018	EE	On-Demand	Anodyne	LUCI_PHOPY	63	33
C[C@@](O)(CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)C(F)(F)F	ZINC000819293019	EE	On-Demand	Anodyne	LUCI_PHOPY	63	33
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccccc1F	ZINC000819293049	FF	On-Demand	Anodyne	LUCI_PHOPY	72	37
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccccc1F	ZINC000819293050	FF	On-Demand	Anodyne	LUCI_PHOPY	72	37
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccccc1F	ZINC000819293051	FF	On-Demand	Anodyne	LUCI_PHOPY	72	37
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccccc1F	ZINC000819293052	FF	On-Demand	Anodyne	LUCI_PHOPY	72	37
Cc1c(F)cccc1NC(=O)CCNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819293076	GG	On-Demand	Anodyne	LUCI_PHOPY	44	33
Cc1c(F)cccc1NC(=O)CCNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819293077	GG	On-Demand	Anodyne	LUCI_PHOPY	44	33
CCOC[C@H](O)CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819293099	DD	On-Demand	Anodyne	LUCI_PHOPY	59	32
CCOC[C@H](O)CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819293101	DD	On-Demand	Anodyne	LUCI_PHOPY	59	32
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccc2ccccc12	ZINC000819293119	GH	On-Demand	Anodyne	LUCI_PHOPY	61	39
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccc2ccccc12	ZINC000819293120	GH	On-Demand	Anodyne	LUCI_PHOPY	61	39
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccccc1Cl	ZINC000819293125	FG	On-Demand	Anodyne	LUCI_PHOPY	69	39
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccccc1Cl	ZINC000819293126	FG	On-Demand	Anodyne	LUCI_PHOPY	69	39
O[C@@H](CCc1ccccc1)CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819293132	FF	On-Demand	Anodyne	LUCI_PHOPY	89	44
O[C@H](CCc1ccccc1)CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819293133	FF	On-Demand	Anodyne	LUCI_PHOPY	89	44
O[C@@H](CCc1ccccc1)CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819293134	FF	On-Demand	Anodyne	LUCI_PHOPY	89	44
O[C@H](CCc1ccccc1)CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819293135	FF	On-Demand	Anodyne	LUCI_PHOPY	89	44
CC(C)(C)[C@@H](O)CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819293173	DE	On-Demand	Anodyne	LUCI_PHOPY	63	34
CC(C)(C)[C@@H](O)CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819293176	DE	On-Demand	Anodyne	LUCI_PHOPY	63	34
CCOC[C@H](O)CNC[C@@H]1CC(c2ccc(OC)cc2)=NO1	ZINC000819293178	DD	On-Demand	Anodyne	LUCI_PHOPY	76	50
CCOC[C@H](O)CNC[C@H]1CC(c2ccc(OC)cc2)=NO1	ZINC000819293179	DD	On-Demand	Anodyne	LUCI_PHOPY	76	50
CC(C)(O)CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819293201	CD	On-Demand	Anodyne	LUCI_PHOPY	68	35
CC(C)(O)CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819293202	CD	On-Demand	Anodyne	LUCI_PHOPY	68	35
NC(=O)NCCNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819293211	DD	On-Demand	Anodyne	CRTM	44	40
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1c(F)cccc1F	ZINC000819293224	FF	On-Demand	Anodyne	LUCI_PHOPY	69	37
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1c(F)cccc1F	ZINC000819293225	FF	On-Demand	Anodyne	LUCI_PHOPY	69	37
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1c(F)cccc1F	ZINC000819293226	FF	On-Demand	Anodyne	LUCI_PHOPY	69	37
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1c(F)cccc1F	ZINC000819293227	FF	On-Demand	Anodyne	LUCI_PHOPY	69	37
CS(=O)(=O)NC1CC(NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293240	FD	On-Demand	Anodyne	ADRB3	17	46
CS(=O)(=O)NC1CC(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293241	FD	On-Demand	Anodyne	ADRB3	17	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCOC(F)F)CC1	ZINC000819293242	FE	On-Demand	Anodyne	GPR119	27	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCOC(F)F)CC1	ZINC000819293243	FE	On-Demand	Anodyne	GPR119	27	42
CS(=O)(=O)NC1CC(NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819293258	DD	On-Demand	Anodyne	ADRB3	28	43
O=C(CCNC[C@H](O)c1cccc(Br)c1)OC1CCCCC1	ZINC000819293280	FG	On-Demand	Anodyne	ADRB1	54	45
O=C(CCNC[C@H](O)c1cccc(Br)c1)OC1CCCCC1	ZINC000819293280	FG	On-Demand	Anodyne	ADRB3	56	45
O=C(CCNC[C@@H](O)c1cccc(Br)c1)OC1CCCCC1	ZINC000819293282	FG	On-Demand	Anodyne	ADRB1	54	45
O=C(CCNC[C@@H](O)c1cccc(Br)c1)OC1CCCCC1	ZINC000819293282	FG	On-Demand	Anodyne	ADRB3	56	45
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293288	FF	On-Demand	Anodyne	SLC6A3	27	46
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293288	FF	On-Demand	Anodyne	SIGMAR1	18	43
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293288	FF	On-Demand	Anodyne	CCR5	19	40
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293288	FF	On-Demand	Anodyne	MLNR	31	40
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293288	FF	On-Demand	Anodyne	BIRC2	23	48
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293289	FF	On-Demand	Anodyne	SLC6A3	27	46
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293289	FF	On-Demand	Anodyne	SIGMAR1	18	43
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293289	FF	On-Demand	Anodyne	CCR5	19	40
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293289	FF	On-Demand	Anodyne	MLNR	31	40
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293289	FF	On-Demand	Anodyne	BIRC2	23	48
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293291	FF	On-Demand	Anodyne	SLC6A3	27	46
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293291	FF	On-Demand	Anodyne	SIGMAR1	18	43
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293291	FF	On-Demand	Anodyne	CCR5	19	40
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293291	FF	On-Demand	Anodyne	MLNR	31	40
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293291	FF	On-Demand	Anodyne	BIRC2	23	48
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293293	FF	On-Demand	Anodyne	SLC6A3	27	46
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293293	FF	On-Demand	Anodyne	SIGMAR1	18	43
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293293	FF	On-Demand	Anodyne	CCR5	19	40
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293293	FF	On-Demand	Anodyne	MLNR	31	40
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293293	FF	On-Demand	Anodyne	BIRC2	23	48
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819293320	GH	On-Demand	Anodyne	DRD4	15	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819293320	GH	On-Demand	Anodyne	CCR8	66	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819293322	GH	On-Demand	Anodyne	DRD4	15	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819293322	GH	On-Demand	Anodyne	CCR8	66	40
CCc1nc2cc(CNCCC(=O)N(C)OC)ccc2n1C1CC1	ZINC000819293324	EE	On-Demand	Anodyne	FPR2	21	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)c(C)c3)=NO2)c1	ZINC000819293328	GG	On-Demand	Anodyne	ADRB2	21	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)c(C)c3)=NO2)c1	ZINC000819293328	GG	On-Demand	Anodyne	ABCB1	20	47
CC(=O)c1cccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)c(C)c3)=NO2)c1	ZINC000819293328	GG	On-Demand	Anodyne	LUCI_PHOPY	41	36
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)c(C)c3)=NO2)c1	ZINC000819293330	GG	On-Demand	Anodyne	ADRB2	21	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)c(C)c3)=NO2)c1	ZINC000819293330	GG	On-Demand	Anodyne	ABCB1	20	47
CC(=O)c1cccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)c(C)c3)=NO2)c1	ZINC000819293330	GG	On-Demand	Anodyne	LUCI_PHOPY	41	36
CCc1nc2cc(CNC[C@H](O)c3cc(OC)ccc3OC)ccc2n1C1CC1	ZINC000819293331	GH	On-Demand	Anodyne	FPR2	18	42
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)c(C)c3)=NO2)c1	ZINC000819293332	GG	On-Demand	Anodyne	ADRB2	21	40
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)c(C)c3)=NO2)c1	ZINC000819293332	GG	On-Demand	Anodyne	ABCB1	20	47
CC(=O)c1cccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)c(C)c3)=NO2)c1	ZINC000819293332	GG	On-Demand	Anodyne	LUCI_PHOPY	41	36
CCc1nc2cc(CNC[C@@H](O)c3cc(OC)ccc3OC)ccc2n1C1CC1	ZINC000819293333	GH	On-Demand	Anodyne	FPR2	18	42
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)c(C)c3)=NO2)c1	ZINC000819293334	GG	On-Demand	Anodyne	ADRB2	21	40
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)c(C)c3)=NO2)c1	ZINC000819293334	GG	On-Demand	Anodyne	ABCB1	20	47
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)c(C)c3)=NO2)c1	ZINC000819293334	GG	On-Demand	Anodyne	LUCI_PHOPY	41	36
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2CC(NS(C)(=O)=O)C2)CC1	ZINC000819293336	GC	On-Demand	Anodyne	GPR119	38	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2CC(NS(C)(=O)=O)C2)CC1	ZINC000819293337	GC	On-Demand	Anodyne	GPR119	38	45
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293367	GH	On-Demand	Anodyne	ADRB3	22	49
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293367	GH	On-Demand	Anodyne	NPY2R	17	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293367	GH	On-Demand	Anodyne	CCR2	37	44
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293367	GH	On-Demand	Anodyne	EPHX2	50	45
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293367	GH	On-Demand	Anodyne	RBP4	73	35
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293367	GH	On-Demand	Anodyne	MCHR1	22	43
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293367	GH	On-Demand	Anodyne	SFRP1	92	38
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293367	GH	On-Demand	Anodyne	TRPM8	62	43
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293367	GH	On-Demand	Anodyne	WNT3	62	38
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293368	GH	On-Demand	Anodyne	ADRB3	22	49
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293368	GH	On-Demand	Anodyne	NPY2R	17	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293368	GH	On-Demand	Anodyne	CCR2	37	44
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293368	GH	On-Demand	Anodyne	EPHX2	50	45
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293368	GH	On-Demand	Anodyne	RBP4	73	35
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293368	GH	On-Demand	Anodyne	MCHR1	22	43
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293368	GH	On-Demand	Anodyne	SFRP1	92	38
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293368	GH	On-Demand	Anodyne	TRPM8	62	43
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293368	GH	On-Demand	Anodyne	WNT3	62	38
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293369	GH	On-Demand	Anodyne	ADRB3	22	49
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293369	GH	On-Demand	Anodyne	NPY2R	17	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293369	GH	On-Demand	Anodyne	CCR2	37	44
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293369	GH	On-Demand	Anodyne	EPHX2	50	45
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293369	GH	On-Demand	Anodyne	RBP4	73	35
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293369	GH	On-Demand	Anodyne	MCHR1	22	43
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293369	GH	On-Demand	Anodyne	SFRP1	92	38
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293369	GH	On-Demand	Anodyne	TRPM8	62	43
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293369	GH	On-Demand	Anodyne	WNT3	62	38
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293370	GH	On-Demand	Anodyne	ADRB3	22	49
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293370	GH	On-Demand	Anodyne	NPY2R	17	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293370	GH	On-Demand	Anodyne	CCR2	37	44
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293370	GH	On-Demand	Anodyne	EPHX2	50	45
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293370	GH	On-Demand	Anodyne	RBP4	73	35
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293370	GH	On-Demand	Anodyne	MCHR1	22	43
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293370	GH	On-Demand	Anodyne	SFRP1	92	38
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293370	GH	On-Demand	Anodyne	TRPM8	62	43
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819293370	GH	On-Demand	Anodyne	WNT3	62	38
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819293378	FF	On-Demand	Anodyne	SIGMAR1	16	43
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819293378	FF	On-Demand	Anodyne	BIRC2	23	48
CCOC(=O)CC[C@H](O)CNC[C@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293379	EE	On-Demand	Anodyne	MIF	17	41
CCOC(=O)CC[C@H](O)CNC[C@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293379	EE	On-Demand	Anodyne	LUCI_PHOPY	57	33
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819293380	FF	On-Demand	Anodyne	SIGMAR1	16	43
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819293380	FF	On-Demand	Anodyne	BIRC2	23	48
CCOC(=O)CC[C@@H](O)CNC[C@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293381	EE	On-Demand	Anodyne	MIF	17	41
CCOC(=O)CC[C@@H](O)CNC[C@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293381	EE	On-Demand	Anodyne	LUCI_PHOPY	57	33
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819293382	FF	On-Demand	Anodyne	SIGMAR1	16	43
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819293382	FF	On-Demand	Anodyne	BIRC2	23	48
CCOC(=O)CC[C@H](O)CNC[C@@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293383	EE	On-Demand	Anodyne	MIF	17	41
CCOC(=O)CC[C@H](O)CNC[C@@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293383	EE	On-Demand	Anodyne	LUCI_PHOPY	57	33
CCOC(=O)CC[C@@H](O)CNC[C@@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293384	EE	On-Demand	Anodyne	MIF	17	41
CCOC(=O)CC[C@@H](O)CNC[C@@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293384	EE	On-Demand	Anodyne	LUCI_PHOPY	57	33
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819293385	FF	On-Demand	Anodyne	SIGMAR1	16	43
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819293385	FF	On-Demand	Anodyne	BIRC2	23	48
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819293409	FG	On-Demand	Anodyne	SIGMAR1	20	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819293409	FG	On-Demand	Anodyne	BIRC2	20	48
CCOC(=O)C1CCC(O)(CNC[C@@H]2CC(c3ccc(OC)cc3)=NO2)CC1	ZINC000819293410	GE	On-Demand	Anodyne	LUCI_PHOPY	54	43
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819293411	FG	On-Demand	Anodyne	SIGMAR1	20	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819293411	FG	On-Demand	Anodyne	BIRC2	20	48
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819293412	FF	On-Demand	Anodyne	ADRB1	38	48
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819293412	FF	On-Demand	Anodyne	ADRB3	53	48
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819293412	FF	On-Demand	Anodyne	CPT1A	95	49
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819293412	FF	On-Demand	Anodyne	CPT2	44	40
CCOC(=O)C1CCC(O)(CNC[C@H]2CC(c3ccc(OC)cc3)=NO2)CC1	ZINC000819293413	GE	On-Demand	Anodyne	LUCI_PHOPY	54	43
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819293415	FF	On-Demand	Anodyne	ADRB1	38	48
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819293415	FF	On-Demand	Anodyne	ADRB3	53	48
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819293415	FF	On-Demand	Anodyne	CPT1A	95	49
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819293415	FF	On-Demand	Anodyne	CPT2	44	40
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819293441	FF	On-Demand	Anodyne	SIGMAR1	15	43
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819293441	FF	On-Demand	Anodyne	CCR3	35	42
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819293441	FF	On-Demand	Anodyne	BIRC2	21	45
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cc(F)ccc1F	ZINC000819293442	FF	On-Demand	Anodyne	LUCI_PHOPY	48	39
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819293443	FF	On-Demand	Anodyne	SIGMAR1	15	43
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819293443	FF	On-Demand	Anodyne	CCR3	35	42
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819293443	FF	On-Demand	Anodyne	BIRC2	21	45
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cc(F)ccc1F	ZINC000819293444	FF	On-Demand	Anodyne	LUCI_PHOPY	48	39
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819293445	FF	On-Demand	Anodyne	SIGMAR1	15	43
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819293445	FF	On-Demand	Anodyne	CCR3	35	42
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819293445	FF	On-Demand	Anodyne	BIRC2	21	45
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cc(F)ccc1F	ZINC000819293446	FF	On-Demand	Anodyne	LUCI_PHOPY	48	39
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819293447	FF	On-Demand	Anodyne	SIGMAR1	15	43
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819293447	FF	On-Demand	Anodyne	CCR3	35	42
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819293447	FF	On-Demand	Anodyne	BIRC2	21	45
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cc(F)ccc1F	ZINC000819293448	FF	On-Demand	Anodyne	LUCI_PHOPY	48	39
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819293449	ED	On-Demand	Anodyne	ADRB2	27	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819293449	ED	On-Demand	Anodyne	ADRB1	45	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819293449	ED	On-Demand	Anodyne	ADRB3	97	49
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819293449	ED	On-Demand	Anodyne	PTAFR	21	50
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819293449	ED	On-Demand	Anodyne	CPT1A	104	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819293449	ED	On-Demand	Anodyne	CPT2	45	35
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819293449	ED	On-Demand	Anodyne	C3AR1	44	43
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819293450	ED	On-Demand	Anodyne	ADRB2	27	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819293450	ED	On-Demand	Anodyne	ADRB1	45	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819293450	ED	On-Demand	Anodyne	ADRB3	97	49
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819293450	ED	On-Demand	Anodyne	PTAFR	21	50
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819293450	ED	On-Demand	Anodyne	CPT1A	104	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819293450	ED	On-Demand	Anodyne	CPT2	45	35
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819293450	ED	On-Demand	Anodyne	C3AR1	44	43
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819293452	ED	On-Demand	Anodyne	ADRB2	27	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819293452	ED	On-Demand	Anodyne	ADRB1	45	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819293452	ED	On-Demand	Anodyne	ADRB3	97	49
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819293452	ED	On-Demand	Anodyne	PTAFR	21	50
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819293452	ED	On-Demand	Anodyne	CPT1A	104	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819293452	ED	On-Demand	Anodyne	CPT2	45	35
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819293452	ED	On-Demand	Anodyne	C3AR1	44	43
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819293454	ED	On-Demand	Anodyne	ADRB2	27	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819293454	ED	On-Demand	Anodyne	ADRB1	45	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819293454	ED	On-Demand	Anodyne	ADRB3	97	49
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819293454	ED	On-Demand	Anodyne	PTAFR	21	50
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819293454	ED	On-Demand	Anodyne	CPT1A	104	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819293454	ED	On-Demand	Anodyne	CPT2	45	35
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819293454	ED	On-Demand	Anodyne	C3AR1	44	43
C[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)S(C)(=O)=O	ZINC000819293494	ED	On-Demand	Anodyne	LUCI_PHOPY	62	33
C[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)S(C)(=O)=O	ZINC000819293495	ED	On-Demand	Anodyne	LUCI_PHOPY	62	33
C[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)S(C)(=O)=O	ZINC000819293496	ED	On-Demand	Anodyne	LUCI_PHOPY	62	33
C[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)S(C)(=O)=O	ZINC000819293497	ED	On-Demand	Anodyne	LUCI_PHOPY	62	33
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccc(F)c1	ZINC000819293514	FF	On-Demand	Anodyne	LUCI_PHOPY	58	42
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccc(F)c1	ZINC000819293515	FF	On-Demand	Anodyne	LUCI_PHOPY	58	42
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccc(F)c1	ZINC000819293516	FF	On-Demand	Anodyne	LUCI_PHOPY	58	42
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccc(F)c1	ZINC000819293517	FF	On-Demand	Anodyne	LUCI_PHOPY	58	42
COC[C@@H](O)CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819293519	DC	On-Demand	Anodyne	LUCI_PHOPY	67	35
COC[C@@H](O)CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819293521	DC	On-Demand	Anodyne	LUCI_PHOPY	67	35
O=C(CCNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)Nc1ccccc1	ZINC000819293525	FF	On-Demand	Anodyne	LUCI_PHOPY	67	37
O=C(CCNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)Nc1ccccc1	ZINC000819293526	FF	On-Demand	Anodyne	LUCI_PHOPY	67	37
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1ccc(F)cc1Cl	ZINC000819293535	FD	On-Demand	Anodyne	ADRB2	27	44
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1ccc(F)cc1Cl	ZINC000819293535	FD	On-Demand	Anodyne	ADRB1	35	42
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1ccc(F)cc1Cl	ZINC000819293535	FD	On-Demand	Anodyne	ADRB3	113	49
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1ccc(F)cc1Cl	ZINC000819293536	FD	On-Demand	Anodyne	ADRB2	27	44
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1ccc(F)cc1Cl	ZINC000819293536	FD	On-Demand	Anodyne	ADRB1	35	42
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1ccc(F)cc1Cl	ZINC000819293536	FD	On-Demand	Anodyne	ADRB3	113	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCc3ccccc3OC2)CC1	ZINC000819293543	GF	On-Demand	Anodyne	GPR119	34	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCc3ccccc3OC2)CC1	ZINC000819293544	GF	On-Demand	Anodyne	GPR119	34	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCc3ccccc3OC2)CC1	ZINC000819293545	GF	On-Demand	Anodyne	GPR119	34	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCc3ccccc3OC2)CC1	ZINC000819293546	GF	On-Demand	Anodyne	GPR119	34	44
CC[C@@H](O)CNC[C@@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293547	CE	On-Demand	Anodyne	MIF	17	41
CC[C@@H](O)CNC[C@@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293547	CE	On-Demand	Anodyne	LUCI_PHOPY	77	37
CC[C@H](O)CNC[C@@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293548	CE	On-Demand	Anodyne	MIF	17	41
CC[C@H](O)CNC[C@@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293548	CE	On-Demand	Anodyne	LUCI_PHOPY	77	37
CC[C@@H](O)CNC[C@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293549	CE	On-Demand	Anodyne	MIF	17	41
CC[C@@H](O)CNC[C@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293549	CE	On-Demand	Anodyne	LUCI_PHOPY	77	37
CC[C@H](O)CNC[C@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293550	CE	On-Demand	Anodyne	MIF	17	41
CC[C@H](O)CNC[C@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293550	CE	On-Demand	Anodyne	LUCI_PHOPY	77	37
CS(=O)(=O)NC1CC(NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293556	DC	On-Demand	Anodyne	ADRB3	34	40
CS(=O)(=O)NC1CC(NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293557	DC	On-Demand	Anodyne	ADRB3	34	40
COc1ccccc1COC[C@@H](O)CNC[C@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293568	GF	On-Demand	Anodyne	LUCI_PHOPY	72	48
COc1ccccc1COC[C@H](O)CNC[C@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293569	GF	On-Demand	Anodyne	LUCI_PHOPY	72	48
COc1ccccc1COC[C@H](O)CNC[C@@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293570	GF	On-Demand	Anodyne	LUCI_PHOPY	72	48
COc1ccccc1COC[C@@H](O)CNC[C@@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293571	GF	On-Demand	Anodyne	LUCI_PHOPY	72	48
CSc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)nc1	ZINC000819293615	FG	On-Demand	Mild	PAPA1_CARPA	43	46
CSc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nc1	ZINC000819293616	FG	On-Demand	Mild	PAPA1_CARPA	43	46
CS(=O)(=O)NC1CC(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819293633	FD	On-Demand	Anodyne	ADRB3	32	43
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293640	FE	On-Demand	Anodyne	ADRB2	20	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293640	FE	On-Demand	Anodyne	ADRB1	30	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293640	FE	On-Demand	Anodyne	SLC6A3	26	45
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293640	FE	On-Demand	Anodyne	ADRB3	43	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293640	FE	On-Demand	Anodyne	CPT1A	98	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293640	FE	On-Demand	Anodyne	CPT2	45	34
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293641	FE	On-Demand	Anodyne	ADRB2	20	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293641	FE	On-Demand	Anodyne	ADRB1	30	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293641	FE	On-Demand	Anodyne	SLC6A3	26	45
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293641	FE	On-Demand	Anodyne	ADRB3	43	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293641	FE	On-Demand	Anodyne	CPT1A	98	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293641	FE	On-Demand	Anodyne	CPT2	45	34
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293642	FE	On-Demand	Anodyne	ADRB2	20	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293642	FE	On-Demand	Anodyne	ADRB1	30	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293642	FE	On-Demand	Anodyne	SLC6A3	26	45
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293642	FE	On-Demand	Anodyne	ADRB3	43	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293642	FE	On-Demand	Anodyne	CPT1A	98	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819293642	FE	On-Demand	Anodyne	CPT2	45	34
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293643	FE	On-Demand	Anodyne	ADRB2	20	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293643	FE	On-Demand	Anodyne	ADRB1	30	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293643	FE	On-Demand	Anodyne	SLC6A3	26	45
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293643	FE	On-Demand	Anodyne	ADRB3	43	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293643	FE	On-Demand	Anodyne	CPT1A	98	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819293643	FE	On-Demand	Anodyne	CPT2	45	34
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293644	GG	On-Demand	Anodyne	ADRB1	20	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293644	GG	On-Demand	Anodyne	ADRB3	31	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293645	GG	On-Demand	Anodyne	ADRB1	20	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293645	GG	On-Demand	Anodyne	ADRB3	31	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293646	GG	On-Demand	Anodyne	ADRB1	20	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293646	GG	On-Demand	Anodyne	ADRB3	31	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293647	GG	On-Demand	Anodyne	ADRB1	20	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293647	GG	On-Demand	Anodyne	ADRB3	31	41
CN(C[C@H](O)CN[C@H]1CCN(C(=O)Nc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819293653	GE	On-Demand	Anodyne	SFRP1	43	34
CN(C[C@H](O)CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819293654	GE	On-Demand	Anodyne	SFRP1	43	34
CN(C[C@@H](O)CN[C@H]1CCN(C(=O)Nc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819293655	GE	On-Demand	Anodyne	SFRP1	43	34
CN(C[C@@H](O)CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819293656	GE	On-Demand	Anodyne	SFRP1	43	34
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819293661	FF	On-Demand	Anodyne	CCR3	47	46
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819293662	FF	On-Demand	Anodyne	CCR3	47	46
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819293663	FF	On-Demand	Anodyne	CCR3	47	46
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819293664	FF	On-Demand	Anodyne	CCR3	47	46
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)C2CC2)C1	ZINC000819293665	DD	On-Demand	Anodyne	CPT1A	110	44
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)C2CC2)C1	ZINC000819293665	DD	On-Demand	Anodyne	CPT2	46	36
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)C2CC2)C1	ZINC000819293666	DD	On-Demand	Anodyne	CPT1A	110	44
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)C2CC2)C1	ZINC000819293666	DD	On-Demand	Anodyne	CPT2	46	36
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)C2CC2)C1	ZINC000819293667	DD	On-Demand	Anodyne	CPT1A	110	44
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)C2CC2)C1	ZINC000819293667	DD	On-Demand	Anodyne	CPT2	46	36
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)C2CC2)C1	ZINC000819293668	DD	On-Demand	Anodyne	CPT1A	110	44
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)C2CC2)C1	ZINC000819293668	DD	On-Demand	Anodyne	CPT2	46	36
O=C(CCNC[C@H](O)COc1ccccc1Cl)OC1CCCCC1	ZINC000819293669	FF	On-Demand	Anodyne	ADRB2	55	67
O=C(CCNC[C@H](O)COc1ccccc1Cl)OC1CCCCC1	ZINC000819293669	FF	On-Demand	Anodyne	ADRB1	93	54
O=C(CCNC[C@H](O)COc1ccccc1Cl)OC1CCCCC1	ZINC000819293669	FF	On-Demand	Anodyne	ADRB3	53	42
O=C(CCNC[C@H](O)COc1ccccc1Cl)OC1CCCCC1	ZINC000819293669	FF	On-Demand	Anodyne	ABCB1	34	47
O=C(CCNC[C@@H](O)COc1ccccc1Cl)OC1CCCCC1	ZINC000819293670	FF	On-Demand	Anodyne	ADRB2	55	67
O=C(CCNC[C@@H](O)COc1ccccc1Cl)OC1CCCCC1	ZINC000819293670	FF	On-Demand	Anodyne	ADRB1	93	54
O=C(CCNC[C@@H](O)COc1ccccc1Cl)OC1CCCCC1	ZINC000819293670	FF	On-Demand	Anodyne	ADRB3	53	42
O=C(CCNC[C@@H](O)COc1ccccc1Cl)OC1CCCCC1	ZINC000819293670	FF	On-Demand	Anodyne	ABCB1	34	47
O=C(CCNCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)OC1CCCCC1	ZINC000819293671	GE	On-Demand	Bother	SLC27A4	30	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293680	GF	On-Demand	Anodyne	ADRB1	32	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293680	GF	On-Demand	Anodyne	ADRB3	48	44
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293680	GF	On-Demand	Anodyne	CPT1A	77	45
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293680	GF	On-Demand	Anodyne	CPT2	42	37
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293681	GF	On-Demand	Anodyne	ADRB1	32	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293681	GF	On-Demand	Anodyne	ADRB3	48	44
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293681	GF	On-Demand	Anodyne	CPT1A	77	45
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293681	GF	On-Demand	Anodyne	CPT2	42	37
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293682	GF	On-Demand	Anodyne	ADRB1	32	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293682	GF	On-Demand	Anodyne	ADRB3	48	44
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293682	GF	On-Demand	Anodyne	CPT1A	77	45
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293682	GF	On-Demand	Anodyne	CPT2	42	37
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293683	GF	On-Demand	Anodyne	ADRB1	32	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293683	GF	On-Demand	Anodyne	ADRB3	48	44
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293683	GF	On-Demand	Anodyne	CPT1A	77	45
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293683	GF	On-Demand	Anodyne	CPT2	42	37
CN(C)CCOc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1Cl	ZINC000819293707	EF	On-Demand	Anodyne	EGFR	17	41
CN(C)CCOc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1Cl	ZINC000819293708	EF	On-Demand	Anodyne	EGFR	17	41
CN(C)CCOc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1Cl	ZINC000819293709	EF	On-Demand	Anodyne	EGFR	17	41
CN(C)CCOc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1Cl	ZINC000819293710	EF	On-Demand	Anodyne	EGFR	17	41
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(C(=O)Nc3ccccc3)C2)cc1	ZINC000819293713	FE	On-Demand	Mild	ADRB3	22	49
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(C(=O)Nc3ccccc3)C2)cc1	ZINC000819293714	FE	On-Demand	Mild	ADRB3	22	49
N#Cc1ccc([C@H](O)CN[C@H]2CCN(C(=O)Nc3ccccc3)C2)cc1	ZINC000819293715	FE	On-Demand	Mild	ADRB3	22	49
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(C(=O)Nc3ccccc3)C2)cc1	ZINC000819293716	FE	On-Demand	Mild	ADRB3	22	49
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293720	GG	On-Demand	Anodyne	ADRB1	16	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293720	GG	On-Demand	Anodyne	ADRB3	29	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293721	GG	On-Demand	Anodyne	ADRB1	16	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293721	GG	On-Demand	Anodyne	ADRB3	29	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293722	GG	On-Demand	Anodyne	ADRB1	16	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293722	GG	On-Demand	Anodyne	ADRB3	29	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293723	GG	On-Demand	Anodyne	ADRB1	16	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819293723	GG	On-Demand	Anodyne	ADRB3	29	41
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccc(Cl)cc1	ZINC000819293746	FG	On-Demand	Anodyne	LUCI_PHOPY	55	40
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccc(Cl)cc1	ZINC000819293749	FG	On-Demand	Anodyne	LUCI_PHOPY	55	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293752	FF	On-Demand	Anodyne	ADRB1	19	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293752	FF	On-Demand	Anodyne	ADRB3	33	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293752	FF	On-Demand	Anodyne	CCR3	17	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293752	FF	On-Demand	Anodyne	EPHX2	30	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293752	FF	On-Demand	Anodyne	WNT3	43	38
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293754	FF	On-Demand	Anodyne	ADRB1	19	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293754	FF	On-Demand	Anodyne	ADRB3	33	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293754	FF	On-Demand	Anodyne	CCR3	17	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293754	FF	On-Demand	Anodyne	EPHX2	30	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293754	FF	On-Demand	Anodyne	WNT3	43	38
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293756	FF	On-Demand	Anodyne	ADRB1	19	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293756	FF	On-Demand	Anodyne	ADRB3	33	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293756	FF	On-Demand	Anodyne	CCR3	17	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293756	FF	On-Demand	Anodyne	EPHX2	30	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293756	FF	On-Demand	Anodyne	WNT3	43	38
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293758	FF	On-Demand	Anodyne	ADRB1	19	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293758	FF	On-Demand	Anodyne	ADRB3	33	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293758	FF	On-Demand	Anodyne	CCR3	17	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293758	FF	On-Demand	Anodyne	EPHX2	30	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819293758	FF	On-Demand	Anodyne	WNT3	43	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(-c3nccc(C)n3)cc1)C2	ZINC000819293762	GG	On-Demand	Anodyne	MTOR	41	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(-c3nccc(C)n3)cc1)C2	ZINC000819293763	GG	On-Demand	Anodyne	MTOR	41	33
O=C(CCNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)Nc1cccc(F)c1	ZINC000819293792	GF	On-Demand	Anodyne	LUCI_PHOPY	48	40
O=C(CCNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)Nc1cccc(F)c1	ZINC000819293793	GF	On-Demand	Anodyne	LUCI_PHOPY	48	40
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)C1CC1	ZINC000819293802	DD	On-Demand	Anodyne	LUCI_PHOPY	60	34
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)C1CC1	ZINC000819293803	DD	On-Demand	Anodyne	LUCI_PHOPY	60	34
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)C1CC1	ZINC000819293804	DD	On-Demand	Anodyne	LUCI_PHOPY	60	34
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)C1CC1	ZINC000819293805	DD	On-Demand	Anodyne	LUCI_PHOPY	60	34
NC(=O)NC(=O)CCNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819293810	EC	On-Demand	Anodyne	LUCI_PHOPY	49	33
NC(=O)NC(=O)CCNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819293811	EC	On-Demand	Anodyne	LUCI_PHOPY	49	33
Cc1ccccc1[C@@H](O)CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819293817	FF	On-Demand	Anodyne	LUCI_PHOPY	71	36
Cc1ccccc1[C@@H](O)CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819293818	FF	On-Demand	Anodyne	LUCI_PHOPY	71	36
OC1(CNC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)CCCC1	ZINC000819293826	DE	On-Demand	Anodyne	LUCI_PHOPY	61	34
OC1(CNC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)CCCC1	ZINC000819293827	DE	On-Demand	Anodyne	LUCI_PHOPY	61	34
CS(=O)(=O)NC1CC(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819293834	FD	On-Demand	Anodyne	ADRB3	32	43
CON(C)C(=O)CCNC[C@@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293893	DD	On-Demand	Anodyne	MIF	17	43
CON(C)C(=O)CCNC[C@@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293893	DD	On-Demand	Anodyne	LUCI_PHOPY	68	35
CON(C)C(=O)CCNC[C@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293894	DD	On-Demand	Anodyne	MIF	17	43
CON(C)C(=O)CCNC[C@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819293894	DD	On-Demand	Anodyne	LUCI_PHOPY	68	35
O[C@H](CNCCCOC(F)F)c1ccc(Cl)cc1Cl	ZINC000819293913	DG	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNCCCOC(F)F)c1ccc(Cl)cc1Cl	ZINC000819293913	DG	On-Demand	Anodyne	ADRB1	25	40
O[C@H](CNCCCOC(F)F)c1ccc(Cl)cc1Cl	ZINC000819293913	DG	On-Demand	Anodyne	ADRB3	16	40
O[C@@H](CNCCCOC(F)F)c1ccc(Cl)cc1Cl	ZINC000819293914	DG	On-Demand	Anodyne	ADRB2	20	40
O[C@@H](CNCCCOC(F)F)c1ccc(Cl)cc1Cl	ZINC000819293914	DG	On-Demand	Anodyne	ADRB1	25	40
O[C@@H](CNCCCOC(F)F)c1ccc(Cl)cc1Cl	ZINC000819293914	DG	On-Demand	Anodyne	ADRB3	16	40
OC1(CNC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)CCOCC1	ZINC000819293935	ED	On-Demand	Anodyne	LUCI_PHOPY	58	35
OC1(CNC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)CCOCC1	ZINC000819293936	ED	On-Demand	Anodyne	LUCI_PHOPY	58	35
COC[C@@H](O)CNC[C@H]1CC(c2ccc(OC)c(F)c2)=NO1	ZINC000819293938	DC	On-Demand	Anodyne	MIF	19	45
COC[C@@H](O)CNC[C@H]1CC(c2ccc(OC)c(F)c2)=NO1	ZINC000819293938	DC	On-Demand	Anodyne	LUCI_PHOPY	72	41
COC[C@@H](O)CNC[C@@H]1CC(c2ccc(OC)c(F)c2)=NO1	ZINC000819293939	DC	On-Demand	Anodyne	MIF	19	45
COC[C@@H](O)CNC[C@@H]1CC(c2ccc(OC)c(F)c2)=NO1	ZINC000819293939	DC	On-Demand	Anodyne	LUCI_PHOPY	72	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819293946	FG	On-Demand	Anodyne	OPRL1	34	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819293946	FG	On-Demand	Anodyne	ADRB3	18	49
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819293949	FG	On-Demand	Anodyne	OPRL1	34	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819293949	FG	On-Demand	Anodyne	ADRB3	18	49
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819293951	FG	On-Demand	Anodyne	ADRB1	21	44
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819293951	FG	On-Demand	Anodyne	ADRB3	35	44
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819293951	FG	On-Demand	Anodyne	SIGMAR1	17	43
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819293951	FG	On-Demand	Anodyne	DPP7	51	36
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819293951	FG	On-Demand	Anodyne	BIRC2	19	48
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819293952	FG	On-Demand	Anodyne	ADRB1	21	44
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819293952	FG	On-Demand	Anodyne	ADRB3	35	44
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819293952	FG	On-Demand	Anodyne	SIGMAR1	17	43
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819293952	FG	On-Demand	Anodyne	DPP7	51	36
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819293952	FG	On-Demand	Anodyne	BIRC2	19	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000819293962	FF	On-Demand	Anodyne	HTR1A	20	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000819293962	FF	On-Demand	Anodyne	HTR1D	26	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000819293962	FF	On-Demand	Anodyne	HTR1B	22	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000819293962	FF	On-Demand	Anodyne	SLC6A4	24	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000819293962	FF	On-Demand	Anodyne	CCKAR	45	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000819293962	FF	On-Demand	Anodyne	MPO	100	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000819293962	FF	On-Demand	Anodyne	MTNR1A	18	45
O=C(CCNC[C@H](O)c1ccccc1)OC1CCCCC1	ZINC000819293981	CF	On-Demand	Anodyne	ADRB2	46	43
O=C(CCNC[C@H](O)c1ccccc1)OC1CCCCC1	ZINC000819293981	CF	On-Demand	Anodyne	ADRB1	62	52
O=C(CCNC[C@H](O)c1ccccc1)OC1CCCCC1	ZINC000819293981	CF	On-Demand	Anodyne	ADRB3	78	52
O=C(CCNC[C@H](O)c1ccccc1)OC1CCCCC1	ZINC000819293981	CF	On-Demand	Anodyne	AMY2	42	29
O=C(CCNC[C@H](O)c1ccccc1)OC1CCCCC1	ZINC000819293981	CF	On-Demand	Anodyne	ACHP_LYMST	18	41
O=C(CCNC[C@H](O)c1ccccc1)OC1CCCCC1	ZINC000819293981	CF	On-Demand	Anodyne	Q8WSF8_APLCA	33	41
O=C(CCNC[C@@H](O)c1ccccc1)OC1CCCCC1	ZINC000819293982	CF	On-Demand	Anodyne	ADRB2	46	43
O=C(CCNC[C@@H](O)c1ccccc1)OC1CCCCC1	ZINC000819293982	CF	On-Demand	Anodyne	ADRB1	62	52
O=C(CCNC[C@@H](O)c1ccccc1)OC1CCCCC1	ZINC000819293982	CF	On-Demand	Anodyne	ADRB3	78	52
O=C(CCNC[C@@H](O)c1ccccc1)OC1CCCCC1	ZINC000819293982	CF	On-Demand	Anodyne	AMY2	42	29
O=C(CCNC[C@@H](O)c1ccccc1)OC1CCCCC1	ZINC000819293982	CF	On-Demand	Anodyne	ACHP_LYMST	18	41
O=C(CCNC[C@@H](O)c1ccccc1)OC1CCCCC1	ZINC000819293982	CF	On-Demand	Anodyne	Q8WSF8_APLCA	33	41
COCC[S@@](=O)Cc1cccc(NC(=O)Cc2ccc(-n3cnnc3)cc2)c1	ZINC000819294002	GE	On-Demand	Anodyne	HTR1D	28	45
COCC[S@@](=O)Cc1cccc(NC(=O)Cc2ccc(-n3cnnc3)cc2)c1	ZINC000819294002	GE	On-Demand	Anodyne	HTR1B	22	45
COCC[S@](=O)Cc1cccc(NC(=O)Cc2ccc(-n3cnnc3)cc2)c1	ZINC000819294004	GE	On-Demand	Anodyne	HTR1D	28	45
COCC[S@](=O)Cc1cccc(NC(=O)Cc2ccc(-n3cnnc3)cc2)c1	ZINC000819294004	GE	On-Demand	Anodyne	HTR1B	22	45
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)COC1CCOCC1	ZINC000819294063	GD	On-Demand	Anodyne	LUCI_PHOPY	52	34
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)COC1CCOCC1	ZINC000819294065	GD	On-Demand	Anodyne	LUCI_PHOPY	52	34
O=C(CCNCCC(=O)OC1CCCCC1)Nc1cccnc1	ZINC000819294066	DE	On-Demand	Anodyne	CHRNA7	21	41
O=C(CCNCCC(=O)OC1CCCCC1)Nc1cccnc1	ZINC000819294066	DE	On-Demand	Anodyne	NAMPT	24	46
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)COC1CCOCC1	ZINC000819294068	GD	On-Demand	Anodyne	LUCI_PHOPY	52	34
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)COC1CCOCC1	ZINC000819294070	GD	On-Demand	Anodyne	LUCI_PHOPY	52	34
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819294226	EF	On-Demand	Anodyne	CCR3	35	45
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819294226	EF	On-Demand	Anodyne	MLNR	32	43
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819294226	EF	On-Demand	Anodyne	EPHX2	26	46
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819294226	EF	On-Demand	Anodyne	SCD1	16	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819294227	EF	On-Demand	Anodyne	CCR3	35	45
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819294227	EF	On-Demand	Anodyne	MLNR	32	43
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819294227	EF	On-Demand	Anodyne	EPHX2	26	46
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819294227	EF	On-Demand	Anodyne	SCD1	16	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819294228	EF	On-Demand	Anodyne	CCR3	35	45
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819294228	EF	On-Demand	Anodyne	MLNR	32	43
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819294228	EF	On-Demand	Anodyne	EPHX2	26	46
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819294228	EF	On-Demand	Anodyne	SCD1	16	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819294229	EF	On-Demand	Anodyne	CCR3	35	45
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819294229	EF	On-Demand	Anodyne	MLNR	32	43
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819294229	EF	On-Demand	Anodyne	EPHX2	26	46
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819294229	EF	On-Demand	Anodyne	SCD1	16	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819294230	GH	On-Demand	Anodyne	ADRB1	16	42
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819294230	GH	On-Demand	Anodyne	CCR2	16	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819294230	GH	On-Demand	Anodyne	EPHX2	33	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819294231	GH	On-Demand	Anodyne	ADRB1	16	42
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819294231	GH	On-Demand	Anodyne	CCR2	16	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819294231	GH	On-Demand	Anodyne	EPHX2	33	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819294232	GH	On-Demand	Anodyne	ADRB1	16	42
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819294232	GH	On-Demand	Anodyne	CCR2	16	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819294232	GH	On-Demand	Anodyne	EPHX2	33	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819294233	GH	On-Demand	Anodyne	ADRB1	16	42
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819294233	GH	On-Demand	Anodyne	CCR2	16	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1	ZINC000819294233	GH	On-Demand	Anodyne	EPHX2	33	41
O=C(CCNC[C@H](O)c1ccc([N+](=O)[O-])cc1)OC1CCCCC1	ZINC000819294235	EE	On-Demand	Bother	ADRB1	20	42
O=C(CCNC[C@H](O)c1ccc([N+](=O)[O-])cc1)OC1CCCCC1	ZINC000819294235	EE	On-Demand	Bother	ADRB3	29	42
O=C(CCNC[C@H](O)c1ccc([N+](=O)[O-])cc1)OC1CCCCC1	ZINC000819294235	EE	On-Demand	Bother	SLC27A4	30	40
O=C(CCNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)OC1CCCCC1	ZINC000819294236	EE	On-Demand	Bother	ADRB1	20	42
O=C(CCNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)OC1CCCCC1	ZINC000819294236	EE	On-Demand	Bother	ADRB3	29	42
O=C(CCNC[C@@H](O)c1ccc([N+](=O)[O-])cc1)OC1CCCCC1	ZINC000819294236	EE	On-Demand	Bother	SLC27A4	30	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819294253	FF	On-Demand	Anodyne	ADRB1	24	46
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819294253	FF	On-Demand	Anodyne	ADRB3	33	46
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819294253	FF	On-Demand	Anodyne	CPT1A	115	45
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819294253	FF	On-Demand	Anodyne	CPT2	48	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819294254	FF	On-Demand	Anodyne	ADRB1	24	46
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819294254	FF	On-Demand	Anodyne	ADRB3	33	46
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819294254	FF	On-Demand	Anodyne	CPT1A	115	45
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819294254	FF	On-Demand	Anodyne	CPT2	48	40
O=C(CCNC[C@H](O)c1cccc(C(F)(F)F)c1)OC1CCCCC1	ZINC000819294266	FH	On-Demand	Anodyne	ADRB1	49	45
O=C(CCNC[C@H](O)c1cccc(C(F)(F)F)c1)OC1CCCCC1	ZINC000819294266	FH	On-Demand	Anodyne	ADRB3	50	43
O=C(CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)OC1CCCCC1	ZINC000819294267	FH	On-Demand	Anodyne	ADRB1	49	45
O=C(CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)OC1CCCCC1	ZINC000819294267	FH	On-Demand	Anodyne	ADRB3	50	43
COCC[S@@](=O)Cc1cccc(NC(=O)c2coc3c(C)cccc23)c1	ZINC000819294270	FH	On-Demand	Anodyne	KCNK3	57	38
COCC[S@@](=O)Cc1cccc(NC(=O)c2coc3c(C)cccc23)c1	ZINC000819294270	FH	On-Demand	Anodyne	KCNK9	57	34
COCC[S@](=O)Cc1cccc(NC(=O)c2coc3c(C)cccc23)c1	ZINC000819294271	FH	On-Demand	Anodyne	KCNK3	57	38
COCC[S@](=O)Cc1cccc(NC(=O)c2coc3c(C)cccc23)c1	ZINC000819294271	FH	On-Demand	Anodyne	KCNK9	57	34
Cc1nonc1CNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819294293	DE	On-Demand	Anodyne	MTNR1A	17	40
Cc1nonc1CNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819294293	DE	On-Demand	Anodyne	MTNR1B	16	40
Cc1nonc1CNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819294293	DE	On-Demand	Anodyne	CRTM	45	35
O=C(Cc1ccccc1)N1CCC[C@@H](NCC2(O)CCCCC2)C1	ZINC000819294302	EF	On-Demand	Anodyne	PREP	43	35
O=C(Cc1ccccc1)N1CCC[C@@H](NCC2(O)CCCCC2)C1	ZINC000819294302	EF	On-Demand	Anodyne	BIRC2	19	51
O=C(Cc1ccccc1)N1CCC[C@H](NCC2(O)CCCCC2)C1	ZINC000819294304	EF	On-Demand	Anodyne	PREP	43	35
O=C(Cc1ccccc1)N1CCC[C@H](NCC2(O)CCCCC2)C1	ZINC000819294304	EF	On-Demand	Anodyne	BIRC2	19	51
O=C(CCNC[C@H](O)COc1cccc2[nH]ccc12)OC1CCCCC1	ZINC000819294311	FF	On-Demand	Anodyne	ADRB2	39	69
O=C(CCNC[C@H](O)COc1cccc2[nH]ccc12)OC1CCCCC1	ZINC000819294311	FF	On-Demand	Anodyne	ADRB1	77	61
O=C(CCNC[C@H](O)COc1cccc2[nH]ccc12)OC1CCCCC1	ZINC000819294311	FF	On-Demand	Anodyne	HTR1A	16	69
O=C(CCNC[C@H](O)COc1cccc2[nH]ccc12)OC1CCCCC1	ZINC000819294311	FF	On-Demand	Anodyne	SLC6A4	19	43
O=C(CCNC[C@H](O)COc1cccc2[nH]ccc12)OC1CCCCC1	ZINC000819294311	FF	On-Demand	Anodyne	ADRB3	37	61
O=C(CCNC[C@@H](O)COc1cccc2[nH]ccc12)OC1CCCCC1	ZINC000819294313	FF	On-Demand	Anodyne	ADRB2	39	69
O=C(CCNC[C@@H](O)COc1cccc2[nH]ccc12)OC1CCCCC1	ZINC000819294313	FF	On-Demand	Anodyne	ADRB1	77	61
O=C(CCNC[C@@H](O)COc1cccc2[nH]ccc12)OC1CCCCC1	ZINC000819294313	FF	On-Demand	Anodyne	HTR1A	16	69
O=C(CCNC[C@@H](O)COc1cccc2[nH]ccc12)OC1CCCCC1	ZINC000819294313	FF	On-Demand	Anodyne	SLC6A4	19	43
O=C(CCNC[C@@H](O)COc1cccc2[nH]ccc12)OC1CCCCC1	ZINC000819294313	FF	On-Demand	Anodyne	ADRB3	37	61
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccnc1	ZINC000819294316	ED	On-Demand	Anodyne	ADRB3	51	41
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccnc1	ZINC000819294316	ED	On-Demand	Anodyne	LUCI_PHOPY	45	33
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccnc1	ZINC000819294319	ED	On-Demand	Anodyne	ADRB3	51	41
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccnc1	ZINC000819294319	ED	On-Demand	Anodyne	LUCI_PHOPY	45	33
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccnc1	ZINC000819294322	ED	On-Demand	Anodyne	ADRB3	51	41
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccnc1	ZINC000819294322	ED	On-Demand	Anodyne	LUCI_PHOPY	45	33
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccnc1	ZINC000819294325	ED	On-Demand	Anodyne	ADRB3	51	41
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1cccnc1	ZINC000819294325	ED	On-Demand	Anodyne	LUCI_PHOPY	45	33
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)CC1CCCC1	ZINC000819294366	EF	On-Demand	Anodyne	LUCI_PHOPY	46	33
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)CC1CCCC1	ZINC000819294367	EF	On-Demand	Anodyne	LUCI_PHOPY	46	33
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)CC1CCCC1	ZINC000819294368	EF	On-Demand	Anodyne	LUCI_PHOPY	46	33
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)CC1CCCC1	ZINC000819294369	EF	On-Demand	Anodyne	LUCI_PHOPY	46	33
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819294407	FF	On-Demand	Anodyne	LUCI_PHOPY	41	36
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819294408	FF	On-Demand	Anodyne	LUCI_PHOPY	41	36
COC[C@@H](O)CNCCC(=O)OC1CCCCC1	ZINC000819294428	CC	On-Demand	Anodyne	ADRB1	24	44
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccc(F)cc1	ZINC000819294437	FF	On-Demand	Anodyne	LUCI_PHOPY	58	40
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccc(F)cc1	ZINC000819294439	FF	On-Demand	Anodyne	LUCI_PHOPY	58	40
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccc(F)cc1	ZINC000819294442	FF	On-Demand	Anodyne	LUCI_PHOPY	58	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ncc(C)s3)CC1)C2	ZINC000819294443	GD	On-Demand	Anodyne	NPBWR1	41	36
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)c1ccc(F)cc1	ZINC000819294444	FF	On-Demand	Anodyne	LUCI_PHOPY	58	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ncc(C)s3)CC1)C2	ZINC000819294445	GD	On-Demand	Anodyne	NPBWR1	41	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(CCc1ccc(F)cc1)C1CC1)C2	ZINC000819294475	FG	On-Demand	Anodyne	MBTPS1	49	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(CCc1ccc(F)cc1)C1CC1)C2	ZINC000819294476	FG	On-Demand	Anodyne	MBTPS1	49	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccc(F)cc13)C2	ZINC000819294478	FF	On-Demand	Anodyne	HTR1A	20	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccc(F)cc13)C2	ZINC000819294478	FF	On-Demand	Anodyne	HTR1D	36	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccc(F)cc13)C2	ZINC000819294478	FF	On-Demand	Anodyne	HTR1B	32	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccc(F)cc13)C2	ZINC000819294478	FF	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccc(F)cc13)C2	ZINC000819294478	FF	On-Demand	Anodyne	MPO	94	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccc(F)cc13)C2	ZINC000819294478	FF	On-Demand	Anodyne	MTNR1A	23	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccc(F)cc13)C2	ZINC000819294478	FF	On-Demand	Anodyne	MTNR1B	16	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccc(F)cc13)C2	ZINC000819294481	FF	On-Demand	Anodyne	HTR1A	20	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccc(F)cc13)C2	ZINC000819294481	FF	On-Demand	Anodyne	HTR1D	36	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccc(F)cc13)C2	ZINC000819294481	FF	On-Demand	Anodyne	HTR1B	32	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccc(F)cc13)C2	ZINC000819294481	FF	On-Demand	Anodyne	SLC6A4	22	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccc(F)cc13)C2	ZINC000819294481	FF	On-Demand	Anodyne	MPO	94	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccc(F)cc13)C2	ZINC000819294481	FF	On-Demand	Anodyne	MTNR1A	23	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccc(F)cc13)C2	ZINC000819294481	FF	On-Demand	Anodyne	MTNR1B	16	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294487	GE	On-Demand	Anodyne	EPHX2	29	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294487	GE	On-Demand	Anodyne	CCR8	52	37
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294487	GE	On-Demand	Anodyne	SFRP1	51	35
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294487	GE	On-Demand	Anodyne	WNT3	47	35
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294489	GE	On-Demand	Anodyne	EPHX2	29	40
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294489	GE	On-Demand	Anodyne	CCR8	52	37
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294489	GE	On-Demand	Anodyne	SFRP1	51	35
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294489	GE	On-Demand	Anodyne	WNT3	47	35
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294491	GE	On-Demand	Anodyne	EPHX2	29	40
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294491	GE	On-Demand	Anodyne	CCR8	52	37
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294491	GE	On-Demand	Anodyne	SFRP1	51	35
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294491	GE	On-Demand	Anodyne	WNT3	47	35
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294493	GE	On-Demand	Anodyne	EPHX2	29	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294493	GE	On-Demand	Anodyne	CCR8	52	37
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294493	GE	On-Demand	Anodyne	SFRP1	51	35
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294493	GE	On-Demand	Anodyne	WNT3	47	35
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)COc1ccc(F)cc1	ZINC000819294500	GE	On-Demand	Anodyne	LUCI_PHOPY	53	41
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)COc1ccc(F)cc1	ZINC000819294503	GE	On-Demand	Anodyne	LUCI_PHOPY	53	41
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)COc1ccc(F)cc1	ZINC000819294510	GE	On-Demand	Anodyne	LUCI_PHOPY	53	41
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)COc1ccc(F)cc1	ZINC000819294513	GE	On-Demand	Anodyne	LUCI_PHOPY	53	41
O=C(/C=C\[C@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294514	DF	On-Demand	Anodyne	HTR1A	19	42
O=C(/C=C\[C@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294514	DF	On-Demand	Anodyne	HTR1D	28	41
O=C(/C=C\[C@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294514	DF	On-Demand	Anodyne	HTR1B	23	41
O=C(/C=C\[C@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294514	DF	On-Demand	Anodyne	SLC6A4	26	47
O=C(/C=C\[C@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294514	DF	On-Demand	Anodyne	MPO	100	47
O=C(/C=C\[C@@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294516	DF	On-Demand	Anodyne	HTR1A	19	42
O=C(/C=C\[C@@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294516	DF	On-Demand	Anodyne	HTR1D	28	41
O=C(/C=C\[C@@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294516	DF	On-Demand	Anodyne	HTR1B	23	41
O=C(/C=C\[C@@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294516	DF	On-Demand	Anodyne	SLC6A4	26	47
O=C(/C=C\[C@@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294516	DF	On-Demand	Anodyne	MPO	100	47
O=C(/C=C/[C@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294518	DF	On-Demand	Anodyne	HTR1A	19	42
O=C(/C=C/[C@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294518	DF	On-Demand	Anodyne	HTR1D	28	41
O=C(/C=C/[C@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294518	DF	On-Demand	Anodyne	HTR1B	23	41
O=C(/C=C/[C@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294518	DF	On-Demand	Anodyne	SLC6A4	26	47
O=C(/C=C/[C@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294518	DF	On-Demand	Anodyne	MPO	100	47
O[C@@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)Cc1cccc(Cl)c1	ZINC000819294519	GF	On-Demand	Anodyne	LUCI_PHOPY	74	47
O=C(/C=C/[C@@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294520	DF	On-Demand	Anodyne	HTR1A	19	42
O=C(/C=C/[C@@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294520	DF	On-Demand	Anodyne	HTR1D	28	41
O=C(/C=C/[C@@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294520	DF	On-Demand	Anodyne	HTR1B	23	41
O=C(/C=C/[C@@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294520	DF	On-Demand	Anodyne	SLC6A4	26	47
O=C(/C=C/[C@@H]1CCCO1)NCCc1c[nH]c2ccc(F)cc12	ZINC000819294520	DF	On-Demand	Anodyne	MPO	100	47
O[C@H](CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1)Cc1cccc(Cl)c1	ZINC000819294522	GF	On-Demand	Anodyne	LUCI_PHOPY	74	47
O[C@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)Cc1cccc(Cl)c1	ZINC000819294523	GF	On-Demand	Anodyne	LUCI_PHOPY	74	47
O[C@@H](CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1)Cc1cccc(Cl)c1	ZINC000819294524	GF	On-Demand	Anodyne	LUCI_PHOPY	74	47
O=C(CCNC[C@H](O)c1ccccc1Br)OC1CCCCC1	ZINC000819294525	FG	On-Demand	Anodyne	ADRB2	20	41
O=C(CCNC[C@H](O)c1ccccc1Br)OC1CCCCC1	ZINC000819294525	FG	On-Demand	Anodyne	ADRB1	22	41
O=C(CCNC[C@H](O)c1ccccc1Br)OC1CCCCC1	ZINC000819294525	FG	On-Demand	Anodyne	ADRB3	21	41
O=C(CCNC[C@@H](O)c1ccccc1Br)OC1CCCCC1	ZINC000819294526	FG	On-Demand	Anodyne	ADRB2	20	41
O=C(CCNC[C@@H](O)c1ccccc1Br)OC1CCCCC1	ZINC000819294526	FG	On-Demand	Anodyne	ADRB1	22	41
O=C(CCNC[C@@H](O)c1ccccc1Br)OC1CCCCC1	ZINC000819294526	FG	On-Demand	Anodyne	ADRB3	21	41
CC[C@H](O)CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819294527	CD	On-Demand	Anodyne	LUCI_PHOPY	68	35
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294528	ED	On-Demand	Anodyne	ADRB2	23	40
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294528	ED	On-Demand	Anodyne	ADRB1	30	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294528	ED	On-Demand	Anodyne	ADRB3	103	48
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294528	ED	On-Demand	Anodyne	PTAFR	24	45
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294528	ED	On-Demand	Anodyne	C3AR1	45	45
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294528	ED	On-Demand	Anodyne	BIRC2	19	46
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294528	ED	On-Demand	Anodyne	SCD	22	40
CC[C@@H](O)CNC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819294529	CD	On-Demand	Anodyne	LUCI_PHOPY	68	35
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294530	ED	On-Demand	Anodyne	ADRB2	23	40
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294530	ED	On-Demand	Anodyne	ADRB1	30	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294530	ED	On-Demand	Anodyne	ADRB3	103	48
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294530	ED	On-Demand	Anodyne	PTAFR	24	45
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294530	ED	On-Demand	Anodyne	C3AR1	45	45
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294530	ED	On-Demand	Anodyne	BIRC2	19	46
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294530	ED	On-Demand	Anodyne	SCD	22	40
CC[C@H](O)CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819294531	CD	On-Demand	Anodyne	LUCI_PHOPY	68	35
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294532	ED	On-Demand	Anodyne	ADRB2	23	40
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294532	ED	On-Demand	Anodyne	ADRB1	30	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294532	ED	On-Demand	Anodyne	ADRB3	103	48
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294532	ED	On-Demand	Anodyne	PTAFR	24	45
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294532	ED	On-Demand	Anodyne	C3AR1	45	45
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294532	ED	On-Demand	Anodyne	BIRC2	19	46
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294532	ED	On-Demand	Anodyne	SCD	22	40
CC[C@@H](O)CNC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000819294533	CD	On-Demand	Anodyne	LUCI_PHOPY	68	35
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294534	ED	On-Demand	Anodyne	ADRB2	23	40
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294534	ED	On-Demand	Anodyne	ADRB1	30	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294534	ED	On-Demand	Anodyne	ADRB3	103	48
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294534	ED	On-Demand	Anodyne	PTAFR	24	45
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294534	ED	On-Demand	Anodyne	C3AR1	45	45
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294534	ED	On-Demand	Anodyne	BIRC2	19	46
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294534	ED	On-Demand	Anodyne	SCD	22	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819294536	GE	On-Demand	Anodyne	ADRB1	35	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819294536	GE	On-Demand	Anodyne	ADRB3	51	44
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819294536	GE	On-Demand	Anodyne	CPT1A	90	45
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819294536	GE	On-Demand	Anodyne	CPT2	47	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819294537	GE	On-Demand	Anodyne	ADRB1	35	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819294537	GE	On-Demand	Anodyne	ADRB3	51	44
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819294537	GE	On-Demand	Anodyne	CPT1A	90	45
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819294537	GE	On-Demand	Anodyne	CPT2	47	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819294538	GE	On-Demand	Anodyne	ADRB1	35	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819294538	GE	On-Demand	Anodyne	ADRB3	51	44
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819294538	GE	On-Demand	Anodyne	CPT1A	90	45
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819294538	GE	On-Demand	Anodyne	CPT2	47	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819294540	GE	On-Demand	Anodyne	ADRB1	35	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819294540	GE	On-Demand	Anodyne	ADRB3	51	44
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819294540	GE	On-Demand	Anodyne	CPT1A	90	45
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819294540	GE	On-Demand	Anodyne	CPT2	47	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(Oc3ccc(C)cc3)CC1)C2	ZINC000819294549	GG	On-Demand	Anodyne	EPHX2	17	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(Oc3ccc(C)cc3)CC1)C2	ZINC000819294552	GG	On-Demand	Anodyne	EPHX2	17	46
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819294562	EF	On-Demand	Anodyne	SLC6A3	23	48
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819294562	EF	On-Demand	Anodyne	CCR3	38	42
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819294562	EF	On-Demand	Anodyne	MLNR	36	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819294564	EF	On-Demand	Anodyne	SLC6A3	23	48
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819294564	EF	On-Demand	Anodyne	CCR3	38	42
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819294564	EF	On-Demand	Anodyne	MLNR	36	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819294566	EF	On-Demand	Anodyne	SLC6A3	23	48
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819294566	EF	On-Demand	Anodyne	CCR3	38	42
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819294566	EF	On-Demand	Anodyne	MLNR	36	41
Cc1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	ZINC000819294567	GE	On-Demand	Anodyne	LUCI_PHOPY	54	35
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819294568	EF	On-Demand	Anodyne	SLC6A3	23	48
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819294568	EF	On-Demand	Anodyne	CCR3	38	42
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819294568	EF	On-Demand	Anodyne	MLNR	36	41
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	ZINC000819294569	GE	On-Demand	Anodyne	LUCI_PHOPY	54	35
O=C(CCNC[C@H](O)c1ccccc1Cl)OC1CCCCC1	ZINC000819294570	EG	On-Demand	Anodyne	ADRB2	25	43
O=C(CCNC[C@H](O)c1ccccc1Cl)OC1CCCCC1	ZINC000819294570	EG	On-Demand	Anodyne	ADRB1	29	41
O=C(CCNC[C@H](O)c1ccccc1Cl)OC1CCCCC1	ZINC000819294570	EG	On-Demand	Anodyne	ADRB3	27	41
Cc1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	ZINC000819294571	GE	On-Demand	Anodyne	LUCI_PHOPY	54	35
Cc1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)cc1	ZINC000819294573	GE	On-Demand	Anodyne	LUCI_PHOPY	54	35
O=C(CCNC[C@H](O)c1ccc(F)cc1)OC1CCCCC1	ZINC000819294574	DF	On-Demand	Anodyne	ADRB1	35	43
O=C(CCNC[C@H](O)c1ccc(F)cc1)OC1CCCCC1	ZINC000819294574	DF	On-Demand	Anodyne	ADRB3	31	43
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)c1	ZINC000819294575	GE	On-Demand	Bother	LUCI_PHOPY	30	40
O=C(CCNC[C@@H](O)c1ccc(F)cc1)OC1CCCCC1	ZINC000819294576	DF	On-Demand	Anodyne	ADRB1	35	43
O=C(CCNC[C@@H](O)c1ccc(F)cc1)OC1CCCCC1	ZINC000819294576	DF	On-Demand	Anodyne	ADRB3	31	43
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294577	EE	On-Demand	Anodyne	ADRB2	21	44
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294577	EE	On-Demand	Anodyne	ADRB1	31	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294577	EE	On-Demand	Anodyne	ADRB3	94	50
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294577	EE	On-Demand	Anodyne	PTAFR	19	55
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294577	EE	On-Demand	Anodyne	CHRNA7	34	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294577	EE	On-Demand	Anodyne	C3AR1	43	43
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294577	EE	On-Demand	Anodyne	EPHX2	23	42
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294577	EE	On-Demand	Anodyne	ACHP_LYMST	27	41
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)c1	ZINC000819294578	GE	On-Demand	Bother	LUCI_PHOPY	30	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294579	EE	On-Demand	Anodyne	ADRB2	21	44
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294579	EE	On-Demand	Anodyne	ADRB1	31	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294579	EE	On-Demand	Anodyne	ADRB3	94	50
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294579	EE	On-Demand	Anodyne	PTAFR	19	55
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294579	EE	On-Demand	Anodyne	CHRNA7	34	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294579	EE	On-Demand	Anodyne	C3AR1	43	43
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294579	EE	On-Demand	Anodyne	EPHX2	23	42
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819294579	EE	On-Demand	Anodyne	ACHP_LYMST	27	41
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)c1	ZINC000819294580	GE	On-Demand	Bother	LUCI_PHOPY	30	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294581	EE	On-Demand	Anodyne	ADRB2	21	44
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294581	EE	On-Demand	Anodyne	ADRB1	31	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294581	EE	On-Demand	Anodyne	ADRB3	94	50
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294581	EE	On-Demand	Anodyne	PTAFR	19	55
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294581	EE	On-Demand	Anodyne	CHRNA7	34	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294581	EE	On-Demand	Anodyne	C3AR1	43	43
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294581	EE	On-Demand	Anodyne	EPHX2	23	42
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294581	EE	On-Demand	Anodyne	ACHP_LYMST	27	41
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)c1	ZINC000819294582	GE	On-Demand	Bother	LUCI_PHOPY	30	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294583	EE	On-Demand	Anodyne	ADRB2	21	44
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294583	EE	On-Demand	Anodyne	ADRB1	31	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294583	EE	On-Demand	Anodyne	ADRB3	94	50
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294583	EE	On-Demand	Anodyne	PTAFR	19	55
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294583	EE	On-Demand	Anodyne	CHRNA7	34	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294583	EE	On-Demand	Anodyne	C3AR1	43	43
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294583	EE	On-Demand	Anodyne	EPHX2	23	42
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819294583	EE	On-Demand	Anodyne	ACHP_LYMST	27	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819294598	GE	On-Demand	Bother	CCR5	15	42
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819294598	GE	On-Demand	Bother	C3AR1	18	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819294598	GE	On-Demand	Bother	BIRC2	17	45
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819294600	GE	On-Demand	Bother	CCR5	15	42
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819294600	GE	On-Demand	Bother	C3AR1	18	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819294600	GE	On-Demand	Bother	BIRC2	17	45
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819294602	GE	On-Demand	Bother	CCR5	15	42
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819294602	GE	On-Demand	Bother	C3AR1	18	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819294602	GE	On-Demand	Bother	BIRC2	17	45
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819294604	GE	On-Demand	Bother	CCR5	15	42
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819294604	GE	On-Demand	Bother	C3AR1	18	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819294604	GE	On-Demand	Bother	BIRC2	17	45
CC(=O)Nc1cccc(CC(=O)Nc2ccc(CNC(=O)OC(C)C)cc2)c1	ZINC000819294606	GG	On-Demand	Anodyne	PDS	75	39
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCc2ccc(C#N)c(Cl)c2)CC1	ZINC000819294623	GG	On-Demand	Mild	TRPV4	44	35
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCc2ccc(C#N)c(Cl)c2)CC1	ZINC000819294624	GG	On-Demand	Mild	TRPV4	44	35
C=C(C)C(C)(C)C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819294633	FE	On-Demand	Reactive	EPHX2	19	40
CS(=O)(=O)NC1CC(NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819294642	FD	On-Demand	Anodyne	SFRP1	42	33
CS(=O)(=O)NC1CC(NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819294643	FD	On-Demand	Anodyne	SFRP1	42	33
COc1ccc(OC)c([C@H](O)CNCc2ccc(C#N)c(Cl)c2)c1	ZINC000819294685	EG	On-Demand	Mild	ADRB2	16	42
O=C(Cc1nsc2ccccc12)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819294701	GG	On-Demand	Anodyne	HTR1A	18	41
O=C(Cc1nsc2ccccc12)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819294701	GG	On-Demand	Anodyne	DRD2	22	41
N#Cc1ccc(OC[C@@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294709	EE	On-Demand	Mild	ADRB2	57	46
N#Cc1ccc(OC[C@@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294709	EE	On-Demand	Mild	ADRB1	91	49
N#Cc1ccc(OC[C@@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294709	EE	On-Demand	Mild	ADRB3	54	43
N#Cc1ccc(OC[C@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294710	EE	On-Demand	Mild	ADRB2	57	46
N#Cc1ccc(OC[C@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294710	EE	On-Demand	Mild	ADRB1	91	49
N#Cc1ccc(OC[C@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294710	EE	On-Demand	Mild	ADRB3	54	43
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819294712	FG	On-Demand	Anodyne	ADRB1	20	46
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819294712	FG	On-Demand	Anodyne	ADRB3	32	46
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819294712	FG	On-Demand	Anodyne	CCR1	36	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819294712	FG	On-Demand	Anodyne	EPHX2	35	42
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819294713	FG	On-Demand	Anodyne	ADRB1	20	46
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819294713	FG	On-Demand	Anodyne	ADRB3	32	46
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819294713	FG	On-Demand	Anodyne	CCR1	36	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819294713	FG	On-Demand	Anodyne	EPHX2	35	42
Cc1ccc(OC[C@@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294714	EF	On-Demand	Anodyne	ADRB2	69	53
Cc1ccc(OC[C@@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294714	EF	On-Demand	Anodyne	ADRB1	101	60
Cc1ccc(OC[C@@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294714	EF	On-Demand	Anodyne	ADRB3	68	45
Cc1ccc(OC[C@@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294714	EF	On-Demand	Anodyne	ACOX1	40	31
Cc1ccc(OC[C@@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294714	EF	On-Demand	Anodyne	ABCB1	18	45
Cc1ccc(OC[C@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294715	EF	On-Demand	Anodyne	ADRB2	69	53
Cc1ccc(OC[C@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294715	EF	On-Demand	Anodyne	ADRB1	101	60
Cc1ccc(OC[C@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294715	EF	On-Demand	Anodyne	ADRB3	68	45
Cc1ccc(OC[C@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294715	EF	On-Demand	Anodyne	ACOX1	40	31
Cc1ccc(OC[C@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294715	EF	On-Demand	Anodyne	ABCB1	18	45
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294718	GE	On-Demand	Anodyne	SFRP1	50	35
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294718	GE	On-Demand	Anodyne	WNT3	50	31
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294719	GE	On-Demand	Anodyne	SFRP1	50	35
CC(C)(C)OC(=O)NCC[C@@H](O)CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294719	GE	On-Demand	Anodyne	WNT3	50	31
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294720	GE	On-Demand	Anodyne	SFRP1	50	35
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294720	GE	On-Demand	Anodyne	WNT3	50	31
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294721	GE	On-Demand	Anodyne	SFRP1	50	35
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819294721	GE	On-Demand	Anodyne	WNT3	50	31
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294738	FG	On-Demand	Anodyne	ADRB2	25	42
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294738	FG	On-Demand	Anodyne	ADRB1	53	49
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294738	FG	On-Demand	Anodyne	ADRB3	68	50
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294738	FG	On-Demand	Anodyne	SIGMAR1	15	42
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294738	FG	On-Demand	Anodyne	CCR5	26	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294738	FG	On-Demand	Anodyne	CYP3A4	46	34
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294738	FG	On-Demand	Anodyne	BIRC2	18	46
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294739	FG	On-Demand	Anodyne	ADRB2	25	42
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294739	FG	On-Demand	Anodyne	ADRB1	53	49
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294739	FG	On-Demand	Anodyne	ADRB3	68	50
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294739	FG	On-Demand	Anodyne	SIGMAR1	15	42
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294739	FG	On-Demand	Anodyne	CCR5	26	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294739	FG	On-Demand	Anodyne	CYP3A4	46	34
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294739	FG	On-Demand	Anodyne	BIRC2	18	46
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294740	FG	On-Demand	Anodyne	ADRB2	25	42
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294740	FG	On-Demand	Anodyne	ADRB1	53	49
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294740	FG	On-Demand	Anodyne	ADRB3	68	50
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294740	FG	On-Demand	Anodyne	SIGMAR1	15	42
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294740	FG	On-Demand	Anodyne	CCR5	26	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294740	FG	On-Demand	Anodyne	CYP3A4	46	34
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294740	FG	On-Demand	Anodyne	BIRC2	18	46
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294741	FG	On-Demand	Anodyne	ADRB2	25	42
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294741	FG	On-Demand	Anodyne	ADRB1	53	49
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294741	FG	On-Demand	Anodyne	ADRB3	68	50
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294741	FG	On-Demand	Anodyne	SIGMAR1	15	42
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294741	FG	On-Demand	Anodyne	CCR5	26	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294741	FG	On-Demand	Anodyne	CYP3A4	46	34
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294741	FG	On-Demand	Anodyne	BIRC2	18	46
O=C(CCNC[C@@H](O)CCc1ccccc1)OC1CCCCC1	ZINC000819294745	DF	On-Demand	Anodyne	ADRB2	38	42
O=C(CCNC[C@@H](O)CCc1ccccc1)OC1CCCCC1	ZINC000819294745	DF	On-Demand	Anodyne	ADRB1	67	42
O=C(CCNC[C@@H](O)CCc1ccccc1)OC1CCCCC1	ZINC000819294745	DF	On-Demand	Anodyne	ADRB3	47	42
O=C(CCNC[C@@H](O)CCc1ccccc1)OC1CCCCC1	ZINC000819294745	DF	On-Demand	Anodyne	ABCB1	37	47
O=C(CCNC[C@H](O)CCc1ccccc1)OC1CCCCC1	ZINC000819294746	DF	On-Demand	Anodyne	ADRB2	38	42
O=C(CCNC[C@H](O)CCc1ccccc1)OC1CCCCC1	ZINC000819294746	DF	On-Demand	Anodyne	ADRB1	67	42
O=C(CCNC[C@H](O)CCc1ccccc1)OC1CCCCC1	ZINC000819294746	DF	On-Demand	Anodyne	ADRB3	47	42
O=C(CCNC[C@H](O)CCc1ccccc1)OC1CCCCC1	ZINC000819294746	DF	On-Demand	Anodyne	ABCB1	37	47
CON(C)C(=O)CCN[C@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000819294753	EC	On-Demand	Anodyne	CPT1A	92	45
CON(C)C(=O)CCN[C@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000819294753	EC	On-Demand	Anodyne	CPT2	45	36
CON(C)C(=O)CCN[C@@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000819294754	EC	On-Demand	Anodyne	CPT1A	92	45
CON(C)C(=O)CCN[C@@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000819294754	EC	On-Demand	Anodyne	CPT2	45	36
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294755	FF	On-Demand	Anodyne	ADRB2	23	47
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294755	FF	On-Demand	Anodyne	ADRB1	55	53
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294755	FF	On-Demand	Anodyne	ADRB3	80	58
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294755	FF	On-Demand	Anodyne	CPT1A	113	49
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294755	FF	On-Demand	Anodyne	CPT2	48	44
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294755	FF	On-Demand	Anodyne	EPHX2	15	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294755	FF	On-Demand	Anodyne	CYP3A4	49	38
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294756	FF	On-Demand	Anodyne	ADRB2	23	47
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294756	FF	On-Demand	Anodyne	ADRB1	55	53
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294756	FF	On-Demand	Anodyne	ADRB3	80	58
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294756	FF	On-Demand	Anodyne	CPT1A	113	49
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294756	FF	On-Demand	Anodyne	CPT2	48	44
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294756	FF	On-Demand	Anodyne	EPHX2	15	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294756	FF	On-Demand	Anodyne	CYP3A4	49	38
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294757	FF	On-Demand	Anodyne	ADRB2	23	47
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294757	FF	On-Demand	Anodyne	ADRB1	55	53
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294757	FF	On-Demand	Anodyne	ADRB3	80	58
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294757	FF	On-Demand	Anodyne	CPT1A	113	49
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294757	FF	On-Demand	Anodyne	CPT2	48	44
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294757	FF	On-Demand	Anodyne	EPHX2	15	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819294757	FF	On-Demand	Anodyne	CYP3A4	49	38
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294758	FF	On-Demand	Anodyne	ADRB2	23	47
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294758	FF	On-Demand	Anodyne	ADRB1	55	53
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294758	FF	On-Demand	Anodyne	ADRB3	80	58
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294758	FF	On-Demand	Anodyne	CPT1A	113	49
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294758	FF	On-Demand	Anodyne	CPT2	48	44
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294758	FF	On-Demand	Anodyne	EPHX2	15	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819294758	FF	On-Demand	Anodyne	CYP3A4	49	38
O=C(CCNC[C@@H](O)Cc1ccccc1)OC1CCCCC1	ZINC000819294759	DE	On-Demand	Anodyne	ADRB2	31	43
O=C(CCNC[C@@H](O)Cc1ccccc1)OC1CCCCC1	ZINC000819294759	DE	On-Demand	Anodyne	ADRB1	52	43
O=C(CCNC[C@@H](O)Cc1ccccc1)OC1CCCCC1	ZINC000819294759	DE	On-Demand	Anodyne	ADRB3	35	40
O=C(CCNC[C@@H](O)Cc1ccccc1)OC1CCCCC1	ZINC000819294759	DE	On-Demand	Anodyne	MME	43	34
O=C(CCNC[C@@H](O)Cc1ccccc1)OC1CCCCC1	ZINC000819294759	DE	On-Demand	Anodyne	ABCB1	20	44
O=C(CCNC[C@H](O)Cc1ccccc1)OC1CCCCC1	ZINC000819294760	DE	On-Demand	Anodyne	ADRB2	31	43
O=C(CCNC[C@H](O)Cc1ccccc1)OC1CCCCC1	ZINC000819294760	DE	On-Demand	Anodyne	ADRB1	52	43
O=C(CCNC[C@H](O)Cc1ccccc1)OC1CCCCC1	ZINC000819294760	DE	On-Demand	Anodyne	ADRB3	35	40
O=C(CCNC[C@H](O)Cc1ccccc1)OC1CCCCC1	ZINC000819294760	DE	On-Demand	Anodyne	MME	43	34
O=C(CCNC[C@H](O)Cc1ccccc1)OC1CCCCC1	ZINC000819294760	DE	On-Demand	Anodyne	ABCB1	20	44
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819294769	FF	On-Demand	Anodyne	SIGMAR1	15	43
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819294769	FF	On-Demand	Anodyne	CCR3	37	42
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819294769	FF	On-Demand	Anodyne	BIRC2	21	45
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819294770	FF	On-Demand	Anodyne	SIGMAR1	15	43
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819294770	FF	On-Demand	Anodyne	CCR3	37	42
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819294770	FF	On-Demand	Anodyne	BIRC2	21	45
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819294771	FF	On-Demand	Anodyne	SIGMAR1	15	43
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819294771	FF	On-Demand	Anodyne	CCR3	37	42
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819294771	FF	On-Demand	Anodyne	BIRC2	21	45
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819294772	FF	On-Demand	Anodyne	SIGMAR1	15	43
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819294772	FF	On-Demand	Anodyne	CCR3	37	42
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819294772	FF	On-Demand	Anodyne	BIRC2	21	45
O=C(CCNC[C@@H](O)Cc1ccc(F)cc1)OC1CCCCC1	ZINC000819294775	DF	On-Demand	Anodyne	ADRB1	32	45
O=C(CCNC[C@H](O)Cc1ccc(F)cc1)OC1CCCCC1	ZINC000819294776	DF	On-Demand	Anodyne	ADRB1	32	45
N#Cc1ccc([C@@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294794	DE	On-Demand	Mild	ADRB1	21	41
N#Cc1ccc([C@@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294794	DE	On-Demand	Mild	ADRB3	23	41
N#Cc1ccc([C@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294795	DE	On-Demand	Mild	ADRB1	21	41
N#Cc1ccc([C@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819294795	DE	On-Demand	Mild	ADRB3	23	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819294800	GE	On-Demand	Anodyne	CPT1A	91	43
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819294800	GE	On-Demand	Anodyne	CPT2	43	36
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819294801	GE	On-Demand	Anodyne	CPT1A	91	43
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819294801	GE	On-Demand	Anodyne	CPT2	43	36
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819294802	GE	On-Demand	Anodyne	CPT1A	91	43
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819294802	GE	On-Demand	Anodyne	CPT2	43	36
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819294803	GE	On-Demand	Anodyne	CPT1A	91	43
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819294803	GE	On-Demand	Anodyne	CPT2	43	36
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819294805	GE	On-Demand	Anodyne	CPT1A	99	43
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819294805	GE	On-Demand	Anodyne	CPT2	42	35
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819294806	GE	On-Demand	Anodyne	CPT1A	99	43
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819294806	GE	On-Demand	Anodyne	CPT2	42	35
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819294807	GE	On-Demand	Anodyne	CPT1A	99	43
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819294807	GE	On-Demand	Anodyne	CPT2	42	35
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819294808	GE	On-Demand	Anodyne	CPT1A	99	43
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819294808	GE	On-Demand	Anodyne	CPT2	42	35
O=[N+]([O-])c1cccc([C@H](O)CNCCCOC(F)F)c1	ZINC000819294842	CD	On-Demand	Bother	ADRB1	40	36
O=[N+]([O-])c1cccc([C@H](O)CNCCCOC(F)F)c1	ZINC000819294842	CD	On-Demand	Bother	ADRB3	44	36
O=[N+]([O-])c1cccc([C@@H](O)CNCCCOC(F)F)c1	ZINC000819294843	CD	On-Demand	Bother	ADRB1	40	36
O=[N+]([O-])c1cccc([C@@H](O)CNCCCOC(F)F)c1	ZINC000819294843	CD	On-Demand	Bother	ADRB3	44	36
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819294866	GE	On-Demand	Anodyne	HTR1D	18	40
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819294866	GE	On-Demand	Anodyne	KCNJ1	68	44
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819294866	GE	On-Demand	Anodyne	NACHRBETA2	40	37
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccsc1	ZINC000819294883	FG	On-Demand	Anodyne	GPR119	49	47
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccsc1	ZINC000819294885	FG	On-Demand	Anodyne	GPR119	49	47
O=C(CCNC[C@H](O)COc1ccc2c(c1)OCO2)OC1CCCCC1	ZINC000819294924	FE	On-Demand	Anodyne	ADRB2	46	44
O=C(CCNC[C@H](O)COc1ccc2c(c1)OCO2)OC1CCCCC1	ZINC000819294924	FE	On-Demand	Anodyne	ADRB1	76	45
O=C(CCNC[C@H](O)COc1ccc2c(c1)OCO2)OC1CCCCC1	ZINC000819294924	FE	On-Demand	Anodyne	ADRB3	49	41
O=C(CCNC[C@@H](O)COc1ccc2c(c1)OCO2)OC1CCCCC1	ZINC000819294926	FE	On-Demand	Anodyne	ADRB2	46	44
O=C(CCNC[C@@H](O)COc1ccc2c(c1)OCO2)OC1CCCCC1	ZINC000819294926	FE	On-Demand	Anodyne	ADRB1	76	45
O=C(CCNC[C@@H](O)COc1ccc2c(c1)OCO2)OC1CCCCC1	ZINC000819294926	FE	On-Demand	Anodyne	ADRB3	49	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819294937	EF	On-Demand	Anodyne	ADRB3	40	37
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819294937	EF	On-Demand	Anodyne	EPHX2	34	44
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819294937	EF	On-Demand	Anodyne	SCD1	19	45
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819294937	EF	On-Demand	Anodyne	Q8WSF8_APLCA	24	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819294939	EF	On-Demand	Anodyne	ADRB3	40	37
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819294939	EF	On-Demand	Anodyne	EPHX2	34	44
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819294939	EF	On-Demand	Anodyne	SCD1	19	45
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819294939	EF	On-Demand	Anodyne	Q8WSF8_APLCA	24	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819294941	EF	On-Demand	Anodyne	ADRB3	40	37
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819294941	EF	On-Demand	Anodyne	EPHX2	34	44
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819294941	EF	On-Demand	Anodyne	SCD1	19	45
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819294941	EF	On-Demand	Anodyne	Q8WSF8_APLCA	24	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819294943	EF	On-Demand	Anodyne	ADRB3	40	37
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819294943	EF	On-Demand	Anodyne	EPHX2	34	44
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819294943	EF	On-Demand	Anodyne	SCD1	19	45
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819294943	EF	On-Demand	Anodyne	Q8WSF8_APLCA	24	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819294944	EF	On-Demand	Anodyne	CCR3	21	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819294947	EF	On-Demand	Anodyne	CCR3	21	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819294949	EF	On-Demand	Anodyne	CCR3	21	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819294951	EF	On-Demand	Anodyne	CCR3	21	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819294955	GF	On-Demand	Anodyne	CPT1A	120	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819294955	GF	On-Demand	Anodyne	CPT2	46	37
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819294956	GF	On-Demand	Anodyne	CPT1A	120	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819294956	GF	On-Demand	Anodyne	CPT2	46	37
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819294959	FF	On-Demand	Anodyne	MLNR	27	40
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819294959	FF	On-Demand	Anodyne	BIRC2	21	46
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819294960	FF	On-Demand	Anodyne	MLNR	27	40
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819294960	FF	On-Demand	Anodyne	BIRC2	21	46
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819294961	FF	On-Demand	Anodyne	MLNR	27	40
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819294961	FF	On-Demand	Anodyne	BIRC2	21	46
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819294963	FF	On-Demand	Anodyne	MLNR	27	40
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819294963	FF	On-Demand	Anodyne	BIRC2	21	46
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819294972	FE	On-Demand	Anodyne	BIRC2	23	47
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819294974	FE	On-Demand	Anodyne	BIRC2	23	47
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819294976	FE	On-Demand	Anodyne	BIRC2	23	47
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819294977	FE	On-Demand	Anodyne	BIRC2	23	47
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)C2CC2)C1	ZINC000819294989	CD	On-Demand	Anodyne	EPHX2	27	44
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)C2CC2)C1	ZINC000819294991	CD	On-Demand	Anodyne	EPHX2	27	44
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)C2CC2)C1	ZINC000819294993	CD	On-Demand	Anodyne	EPHX2	27	44
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)C2CC2)C1	ZINC000819294995	CD	On-Demand	Anodyne	EPHX2	27	44
O=C1CCc2cc(OC[C@@H](O)CNCCC(=O)OC3CCCCC3)ccc2N1	ZINC000819295006	GE	On-Demand	Anodyne	ADRB2	34	41
O=C1CCc2cc(OC[C@@H](O)CNCCC(=O)OC3CCCCC3)ccc2N1	ZINC000819295006	GE	On-Demand	Anodyne	ADRB1	62	44
O=C1CCc2cc(OC[C@@H](O)CNCCC(=O)OC3CCCCC3)ccc2N1	ZINC000819295006	GE	On-Demand	Anodyne	ADRB3	39	40
O=C1CCc2cc(OC[C@H](O)CNCCC(=O)OC3CCCCC3)ccc2N1	ZINC000819295009	GE	On-Demand	Anodyne	ADRB2	34	41
O=C1CCc2cc(OC[C@H](O)CNCCC(=O)OC3CCCCC3)ccc2N1	ZINC000819295009	GE	On-Demand	Anodyne	ADRB1	62	44
O=C1CCc2cc(OC[C@H](O)CNCCC(=O)OC3CCCCC3)ccc2N1	ZINC000819295009	GE	On-Demand	Anodyne	ADRB3	39	40
CN(C)CCOc1ccc(NC(=O)C(F)=C2CCC2)cc1Cl	ZINC000819295011	EH	On-Demand	Anodyne	HTR2A	18	42
CN(C)CCOc1ccc(NC(=O)C(F)=C2CCC2)cc1Cl	ZINC000819295011	EH	On-Demand	Anodyne	MCHR2	19	42
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295024	GF	On-Demand	Anodyne	ADRB1	23	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295024	GF	On-Demand	Anodyne	ADRB3	31	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295024	GF	On-Demand	Anodyne	CCR3	44	37
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295024	GF	On-Demand	Anodyne	CPT1A	78	43
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295024	GF	On-Demand	Anodyne	CPT2	42	37
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295026	GF	On-Demand	Anodyne	ADRB1	23	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295026	GF	On-Demand	Anodyne	ADRB3	31	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295026	GF	On-Demand	Anodyne	CCR3	44	37
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295026	GF	On-Demand	Anodyne	CPT1A	78	43
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295026	GF	On-Demand	Anodyne	CPT2	42	37
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295028	GF	On-Demand	Anodyne	ADRB1	23	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295028	GF	On-Demand	Anodyne	ADRB3	31	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295028	GF	On-Demand	Anodyne	CCR3	44	37
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295028	GF	On-Demand	Anodyne	CPT1A	78	43
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295028	GF	On-Demand	Anodyne	CPT2	42	37
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295031	GF	On-Demand	Anodyne	ADRB1	23	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295031	GF	On-Demand	Anodyne	ADRB3	31	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295031	GF	On-Demand	Anodyne	CCR3	44	37
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295031	GF	On-Demand	Anodyne	CPT1A	78	43
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295031	GF	On-Demand	Anodyne	CPT2	42	37
O=C(CCNC[C@H](O)c1ccc(Br)cc1)OC1CCCCC1	ZINC000819295061	FG	On-Demand	Anodyne	ADRB2	25	45
O=C(CCNC[C@H](O)c1ccc(Br)cc1)OC1CCCCC1	ZINC000819295061	FG	On-Demand	Anodyne	ADRB1	27	42
O=C(CCNC[C@H](O)c1ccc(Br)cc1)OC1CCCCC1	ZINC000819295061	FG	On-Demand	Anodyne	ADRB3	31	42
O=C(CCNC[C@@H](O)c1ccc(Br)cc1)OC1CCCCC1	ZINC000819295062	FG	On-Demand	Anodyne	ADRB2	25	45
O=C(CCNC[C@@H](O)c1ccc(Br)cc1)OC1CCCCC1	ZINC000819295062	FG	On-Demand	Anodyne	ADRB1	27	42
O=C(CCNC[C@@H](O)c1ccc(Br)cc1)OC1CCCCC1	ZINC000819295062	FG	On-Demand	Anodyne	ADRB3	31	42
C[C@@H]1CCC[C@](C#N)(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819295070	FG	On-Demand	Mild	PAPA1_CARPA	32	43
C[C@@H]1CCC[C@](C#N)(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819295073	FG	On-Demand	Mild	PAPA1_CARPA	32	43
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819295079	FE	On-Demand	Anodyne	ADRB1	39	42
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819295079	FE	On-Demand	Anodyne	ADRB3	57	46
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819295079	FE	On-Demand	Anodyne	CPT1A	99	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819295079	FE	On-Demand	Anodyne	CPT2	42	35
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819295080	FE	On-Demand	Anodyne	ADRB1	39	42
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819295080	FE	On-Demand	Anodyne	ADRB3	57	46
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819295080	FE	On-Demand	Anodyne	CPT1A	99	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819295080	FE	On-Demand	Anodyne	CPT2	42	35
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819295082	FE	On-Demand	Anodyne	ADRB1	39	42
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819295082	FE	On-Demand	Anodyne	ADRB3	57	46
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819295082	FE	On-Demand	Anodyne	CPT1A	99	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819295082	FE	On-Demand	Anodyne	CPT2	42	35
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819295083	FE	On-Demand	Anodyne	ADRB1	39	42
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819295083	FE	On-Demand	Anodyne	ADRB3	57	46
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819295083	FE	On-Demand	Anodyne	CPT1A	99	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819295083	FE	On-Demand	Anodyne	CPT2	42	35
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819295087	FG	On-Demand	Anodyne	ADRB2	18	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819295087	FG	On-Demand	Anodyne	ADRB1	40	47
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819295087	FG	On-Demand	Anodyne	ADRB3	64	51
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819295087	FG	On-Demand	Anodyne	EPHX2	35	46
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819295087	FG	On-Demand	Anodyne	CYP3A4	47	37
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819295088	FG	On-Demand	Anodyne	ADRB2	18	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819295088	FG	On-Demand	Anodyne	ADRB1	40	47
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819295088	FG	On-Demand	Anodyne	ADRB3	64	51
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819295088	FG	On-Demand	Anodyne	EPHX2	35	46
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819295088	FG	On-Demand	Anodyne	CYP3A4	47	37
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819295090	FG	On-Demand	Anodyne	ADRB2	18	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819295090	FG	On-Demand	Anodyne	ADRB1	40	47
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819295090	FG	On-Demand	Anodyne	ADRB3	64	51
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819295090	FG	On-Demand	Anodyne	EPHX2	35	46
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819295090	FG	On-Demand	Anodyne	CYP3A4	47	37
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819295091	FG	On-Demand	Anodyne	ADRB2	18	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819295091	FG	On-Demand	Anodyne	ADRB1	40	47
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819295091	FG	On-Demand	Anodyne	ADRB3	64	51
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819295091	FG	On-Demand	Anodyne	EPHX2	35	46
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819295091	FG	On-Demand	Anodyne	CYP3A4	47	37
O=C(CCNC[C@H](O)c1cccc(Cl)c1)OC1CCCCC1	ZINC000819295092	EG	On-Demand	Anodyne	ADRB2	54	42
O=C(CCNC[C@H](O)c1cccc(Cl)c1)OC1CCCCC1	ZINC000819295092	EG	On-Demand	Anodyne	ADRB1	74	57
O=C(CCNC[C@H](O)c1cccc(Cl)c1)OC1CCCCC1	ZINC000819295092	EG	On-Demand	Anodyne	ADRB3	82	57
O=C(CCNC[C@H](O)c1cccc(Cl)c1)OC1CCCCC1	ZINC000819295092	EG	On-Demand	Anodyne	CYP3A4	48	36
O=C(CCNC[C@@H](O)c1cccc(Cl)c1)OC1CCCCC1	ZINC000819295094	EG	On-Demand	Anodyne	ADRB2	54	42
O=C(CCNC[C@@H](O)c1cccc(Cl)c1)OC1CCCCC1	ZINC000819295094	EG	On-Demand	Anodyne	ADRB1	74	57
O=C(CCNC[C@@H](O)c1cccc(Cl)c1)OC1CCCCC1	ZINC000819295094	EG	On-Demand	Anodyne	ADRB3	82	57
O=C(CCNC[C@@H](O)c1cccc(Cl)c1)OC1CCCCC1	ZINC000819295094	EG	On-Demand	Anodyne	CYP3A4	48	36
Cc1ccccc1[C@@H](O)CN[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000819295095	FF	On-Demand	Anodyne	SIGMAR1	15	41
Cc1ccccc1[C@@H](O)CN[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000819295095	FF	On-Demand	Anodyne	BIRC2	25	50
Cc1ccccc1[C@@H](O)CN[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000819295097	FF	On-Demand	Anodyne	SIGMAR1	15	41
Cc1ccccc1[C@@H](O)CN[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000819295097	FF	On-Demand	Anodyne	BIRC2	25	50
C[C@@H]1CCCC[C@H]1C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819295106	EG	On-Demand	Anodyne	HRH3	16	42
C[C@@H]1CCCC[C@H]1C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819295106	EG	On-Demand	Anodyne	CXCR3	27	42
C[C@@H]1CCCC[C@H]1C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819295106	EG	On-Demand	Anodyne	Q8WSF8_APLCA	41	38
C[C@@H]1CCCC[C@H]1C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819295106	EG	On-Demand	Anodyne	NACHRBETA2	48	35
C[C@@H]1CCCC[C@@H]1C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819295109	EG	On-Demand	Anodyne	HRH3	16	42
C[C@@H]1CCCC[C@@H]1C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819295109	EG	On-Demand	Anodyne	CXCR3	27	42
C[C@@H]1CCCC[C@@H]1C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819295109	EG	On-Demand	Anodyne	Q8WSF8_APLCA	41	38
C[C@@H]1CCCC[C@@H]1C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819295109	EG	On-Demand	Anodyne	NACHRBETA2	48	35
CS(=O)(=O)NC1CC(NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819295110	DD	On-Demand	Anodyne	ADRB2	20	40
CS(=O)(=O)NC1CC(NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819295110	DD	On-Demand	Anodyne	ADRB1	39	46
CS(=O)(=O)NC1CC(NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819295110	DD	On-Demand	Anodyne	ADRB3	70	49
CS(=O)(=O)NC1CC(NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819295110	DD	On-Demand	Anodyne	CYP3A4	41	35
CS(=O)(=O)NC1CC(NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819295111	DD	On-Demand	Anodyne	ADRB2	20	40
CS(=O)(=O)NC1CC(NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819295111	DD	On-Demand	Anodyne	ADRB1	39	46
CS(=O)(=O)NC1CC(NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819295111	DD	On-Demand	Anodyne	ADRB3	70	49
CS(=O)(=O)NC1CC(NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819295111	DD	On-Demand	Anodyne	CYP3A4	41	35
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(C#N)c(Cl)c2)CC1	ZINC000819295113	GG	On-Demand	Mild	PGR	17	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(C#N)c(Cl)c2)CC1	ZINC000819295113	GG	On-Demand	Mild	GPR119	44	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(C#N)c(Cl)c2)CC1	ZINC000819295114	GG	On-Demand	Mild	PGR	17	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(C#N)c(Cl)c2)CC1	ZINC000819295114	GG	On-Demand	Mild	GPR119	44	45
O=C(CCNC[C@H](O)COc1ccccc1)OC1CCCCC1	ZINC000819295195	DE	On-Demand	Anodyne	ADRB2	81	56
O=C(CCNC[C@H](O)COc1ccccc1)OC1CCCCC1	ZINC000819295195	DE	On-Demand	Anodyne	ADRB1	119	56
O=C(CCNC[C@H](O)COc1ccccc1)OC1CCCCC1	ZINC000819295195	DE	On-Demand	Anodyne	PTGFR	27	41
O=C(CCNC[C@H](O)COc1ccccc1)OC1CCCCC1	ZINC000819295195	DE	On-Demand	Anodyne	ADRB3	83	53
O=C(CCNC[C@H](O)COc1ccccc1)OC1CCCCC1	ZINC000819295195	DE	On-Demand	Anodyne	ABCB1	38	49
O=C(CCNC[C@@H](O)COc1ccccc1)OC1CCCCC1	ZINC000819295196	DE	On-Demand	Anodyne	ADRB2	81	56
O=C(CCNC[C@@H](O)COc1ccccc1)OC1CCCCC1	ZINC000819295196	DE	On-Demand	Anodyne	ADRB1	119	56
O=C(CCNC[C@@H](O)COc1ccccc1)OC1CCCCC1	ZINC000819295196	DE	On-Demand	Anodyne	PTGFR	27	41
O=C(CCNC[C@@H](O)COc1ccccc1)OC1CCCCC1	ZINC000819295196	DE	On-Demand	Anodyne	ADRB3	83	53
O=C(CCNC[C@@H](O)COc1ccccc1)OC1CCCCC1	ZINC000819295196	DE	On-Demand	Anodyne	ABCB1	38	49
O=C(CCNC[C@H](O)c1ccc(F)c(F)c1)OC1CCCCC1	ZINC000819295199	EF	On-Demand	Anodyne	ADRB1	45	41
O=C(CCNC[C@H](O)c1ccc(F)c(F)c1)OC1CCCCC1	ZINC000819295199	EF	On-Demand	Anodyne	ADRB3	43	41
O=C(CCNC[C@@H](O)c1ccc(F)c(F)c1)OC1CCCCC1	ZINC000819295200	EF	On-Demand	Anodyne	ADRB1	45	41
O=C(CCNC[C@@H](O)c1ccc(F)c(F)c1)OC1CCCCC1	ZINC000819295200	EF	On-Demand	Anodyne	ADRB3	43	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295201	GH	On-Demand	Anodyne	EPHX2	41	37
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295201	GH	On-Demand	Anodyne	RBP4	90	42
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295201	GH	On-Demand	Anodyne	SCD1	22	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295201	GH	On-Demand	Anodyne	SFRP1	124	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295201	GH	On-Demand	Anodyne	WNT3	85	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295202	GH	On-Demand	Anodyne	EPHX2	41	37
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295202	GH	On-Demand	Anodyne	RBP4	90	42
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295202	GH	On-Demand	Anodyne	SCD1	22	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295202	GH	On-Demand	Anodyne	SFRP1	124	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295202	GH	On-Demand	Anodyne	WNT3	85	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295203	GH	On-Demand	Anodyne	EPHX2	41	37
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295203	GH	On-Demand	Anodyne	RBP4	90	42
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295203	GH	On-Demand	Anodyne	SCD1	22	40
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295203	GH	On-Demand	Anodyne	SFRP1	124	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295203	GH	On-Demand	Anodyne	WNT3	85	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295204	GH	On-Demand	Anodyne	EPHX2	41	37
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295204	GH	On-Demand	Anodyne	RBP4	90	42
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295204	GH	On-Demand	Anodyne	SCD1	22	40
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295204	GH	On-Demand	Anodyne	SFRP1	124	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819295204	GH	On-Demand	Anodyne	WNT3	85	41
N#Cc1ccc([C@H](O)CN[C@H]2CCN(C(=O)COc3ccccc3)C2)cc1	ZINC000819295209	FD	On-Demand	Mild	ADRB3	35	46
N#Cc1ccc([C@H](O)CN[C@H]2CCN(C(=O)COc3ccccc3)C2)cc1	ZINC000819295209	FD	On-Demand	Mild	CPT1A	73	48
N#Cc1ccc([C@H](O)CN[C@H]2CCN(C(=O)COc3ccccc3)C2)cc1	ZINC000819295209	FD	On-Demand	Mild	CPT2	41	34
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(C(=O)COc3ccccc3)C2)cc1	ZINC000819295210	FD	On-Demand	Mild	ADRB3	35	46
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(C(=O)COc3ccccc3)C2)cc1	ZINC000819295210	FD	On-Demand	Mild	CPT1A	73	48
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(C(=O)COc3ccccc3)C2)cc1	ZINC000819295210	FD	On-Demand	Mild	CPT2	41	34
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(C(=O)COc3ccccc3)C2)cc1	ZINC000819295211	FD	On-Demand	Mild	ADRB3	35	46
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(C(=O)COc3ccccc3)C2)cc1	ZINC000819295211	FD	On-Demand	Mild	CPT1A	73	48
N#Cc1ccc([C@@H](O)CN[C@@H]2CCN(C(=O)COc3ccccc3)C2)cc1	ZINC000819295211	FD	On-Demand	Mild	CPT2	41	34
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(C(=O)COc3ccccc3)C2)cc1	ZINC000819295212	FD	On-Demand	Mild	ADRB3	35	46
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(C(=O)COc3ccccc3)C2)cc1	ZINC000819295212	FD	On-Demand	Mild	CPT1A	73	48
N#Cc1ccc([C@H](O)CN[C@@H]2CCN(C(=O)COc3ccccc3)C2)cc1	ZINC000819295212	FD	On-Demand	Mild	CPT2	41	34
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295213	ED	On-Demand	Anodyne	ADRB1	40	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295213	ED	On-Demand	Anodyne	ADRB3	58	45
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295213	ED	On-Demand	Anodyne	CPT1A	111	44
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295213	ED	On-Demand	Anodyne	CPT2	47	36
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295213	ED	On-Demand	Anodyne	ACHP_LYMST	15	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295213	ED	On-Demand	Anodyne	Q8WSF8_APLCA	32	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295214	ED	On-Demand	Anodyne	ADRB1	40	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295214	ED	On-Demand	Anodyne	ADRB3	58	45
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295214	ED	On-Demand	Anodyne	CPT1A	111	44
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295214	ED	On-Demand	Anodyne	CPT2	47	36
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295214	ED	On-Demand	Anodyne	ACHP_LYMST	15	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295214	ED	On-Demand	Anodyne	Q8WSF8_APLCA	32	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295215	ED	On-Demand	Anodyne	ADRB1	40	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295215	ED	On-Demand	Anodyne	ADRB3	58	45
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295215	ED	On-Demand	Anodyne	CPT1A	111	44
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295215	ED	On-Demand	Anodyne	CPT2	47	36
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295215	ED	On-Demand	Anodyne	ACHP_LYMST	15	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295215	ED	On-Demand	Anodyne	Q8WSF8_APLCA	32	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295216	ED	On-Demand	Anodyne	ADRB1	40	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295216	ED	On-Demand	Anodyne	ADRB3	58	45
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295216	ED	On-Demand	Anodyne	CPT1A	111	44
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295216	ED	On-Demand	Anodyne	CPT2	47	36
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295216	ED	On-Demand	Anodyne	ACHP_LYMST	15	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295216	ED	On-Demand	Anodyne	Q8WSF8_APLCA	32	40
O=C(CCNC[C@H](O)c1ccc(C(F)(F)F)cc1)OC1CCCCC1	ZINC000819295217	FH	On-Demand	Anodyne	ADRB1	20	44
O=C(CCNC[C@H](O)c1ccc(C(F)(F)F)cc1)OC1CCCCC1	ZINC000819295217	FH	On-Demand	Anodyne	ADRB3	23	40
O=C(CCNC[C@@H](O)c1ccc(C(F)(F)F)cc1)OC1CCCCC1	ZINC000819295218	FH	On-Demand	Anodyne	ADRB1	20	44
O=C(CCNC[C@@H](O)c1ccc(C(F)(F)F)cc1)OC1CCCCC1	ZINC000819295218	FH	On-Demand	Anodyne	ADRB3	23	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819295221	GG	On-Demand	Anodyne	CPT1A	112	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819295221	GG	On-Demand	Anodyne	CPT2	44	36
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819295222	GG	On-Demand	Anodyne	CPT1A	112	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819295222	GG	On-Demand	Anodyne	CPT2	44	36
O=C(CCNC[C@H](O)c1cccnc1)OC1CCCCC1	ZINC000819295223	CD	On-Demand	Anodyne	ADRB2	40	45
O=C(CCNC[C@H](O)c1cccnc1)OC1CCCCC1	ZINC000819295223	CD	On-Demand	Anodyne	ADRB1	53	55
O=C(CCNC[C@H](O)c1cccnc1)OC1CCCCC1	ZINC000819295223	CD	On-Demand	Anodyne	ADRB3	125	55
O=C(CCNC[C@@H](O)c1cccnc1)OC1CCCCC1	ZINC000819295224	CD	On-Demand	Anodyne	ADRB2	40	45
O=C(CCNC[C@@H](O)c1cccnc1)OC1CCCCC1	ZINC000819295224	CD	On-Demand	Anodyne	ADRB1	53	55
O=C(CCNC[C@@H](O)c1cccnc1)OC1CCCCC1	ZINC000819295224	CD	On-Demand	Anodyne	ADRB3	125	55
COCC[S@@](=O)Cc1cccc(NC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819295239	FI	On-Demand	Anodyne	KCNK3	85	38
COCC[S@@](=O)Cc1cccc(NC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819295239	FI	On-Demand	Anodyne	KCNK9	76	38
COCC[S@](=O)Cc1cccc(NC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819295244	FI	On-Demand	Anodyne	KCNK3	85	38
COCC[S@](=O)Cc1cccc(NC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819295244	FI	On-Demand	Anodyne	KCNK9	76	38
O=C(CCNC[C@H](O)c1cccc(F)c1)OC1CCCCC1	ZINC000819295255	DF	On-Demand	Anodyne	ADRB2	37	42
O=C(CCNC[C@H](O)c1cccc(F)c1)OC1CCCCC1	ZINC000819295255	DF	On-Demand	Anodyne	ADRB1	54	45
O=C(CCNC[C@H](O)c1cccc(F)c1)OC1CCCCC1	ZINC000819295255	DF	On-Demand	Anodyne	ADRB3	58	45
C[C@H](CC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)n1cccn1	ZINC000819295256	GD	On-Demand	Reactive	GPR119	33	40
O=C(CCNC[C@@H](O)c1cccc(F)c1)OC1CCCCC1	ZINC000819295257	DF	On-Demand	Anodyne	ADRB2	37	42
O=C(CCNC[C@@H](O)c1cccc(F)c1)OC1CCCCC1	ZINC000819295257	DF	On-Demand	Anodyne	ADRB1	54	45
O=C(CCNC[C@@H](O)c1cccc(F)c1)OC1CCCCC1	ZINC000819295257	DF	On-Demand	Anodyne	ADRB3	58	45
C[C@@H](CC(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1)n1cccn1	ZINC000819295258	GD	On-Demand	Reactive	GPR119	33	40
C=C(C)C(C)(C)C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819295260	DF	On-Demand	Mild	Q8WSF8_APLCA	43	39
C=C(C)C(C)(C)C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819295260	DF	On-Demand	Mild	NACHRBETA2	54	39
CCc1nc2cc(CNC[C@H](O)c3cccnc3)ccc2n1C1CC1	ZINC000819295272	EG	On-Demand	Anodyne	ADRB3	88	42
CCc1nc2cc(CNC[C@@H](O)c3cccnc3)ccc2n1C1CC1	ZINC000819295275	EG	On-Demand	Anodyne	ADRB3	88	42
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295286	GG	On-Demand	Anodyne	ADRB3	19	43
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295286	GG	On-Demand	Anodyne	CCR3	44	45
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295288	GG	On-Demand	Anodyne	ADRB3	19	43
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295288	GG	On-Demand	Anodyne	CCR3	44	45
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295290	GG	On-Demand	Anodyne	ADRB3	19	43
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295290	GG	On-Demand	Anodyne	CCR3	44	45
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295292	GG	On-Demand	Anodyne	ADRB3	19	43
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295292	GG	On-Demand	Anodyne	CCR3	44	45
O=C(CCNC[C@H](O)COC1CCOCC1)OC1CCCCC1	ZINC000819295321	ED	On-Demand	Anodyne	ADRB1	17	40
O=C(CCNC[C@@H](O)COC1CCOCC1)OC1CCCCC1	ZINC000819295323	ED	On-Demand	Anodyne	ADRB1	17	40
O[C@@H](CNCCCOC(F)F)c1cccc2ccccc12	ZINC000819295355	CG	On-Demand	Anodyne	ADRB2	33	42
O[C@@H](CNCCCOC(F)F)c1cccc2ccccc12	ZINC000819295355	CG	On-Demand	Anodyne	ADRB1	24	42
CS(=O)(=O)NC1CC(NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819295371	FD	On-Demand	Anodyne	CACNA1B	45	32
CS(=O)(=O)NC1CC(NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819295372	FD	On-Demand	Anodyne	CACNA1B	45	32
O=C(C(F)=C1CCC1)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819295374	DF	On-Demand	Anodyne	NACHRBETA2	44	38
O=S(=O)(NCCNC[C@H](O)c1cccc(F)c1)c1ccc(F)cc1Cl	ZINC000819295381	GE	On-Demand	Anodyne	ADRB3	48	40
O=S(=O)(NCCNC[C@@H](O)c1cccc(F)c1)c1ccc(F)cc1Cl	ZINC000819295382	GE	On-Demand	Anodyne	ADRB3	48	40
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1ccc(F)cc1Cl	ZINC000819295383	FE	On-Demand	Anodyne	ADRB2	15	42
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1ccc(F)cc1Cl	ZINC000819295383	FE	On-Demand	Anodyne	ADRB1	30	40
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1ccc(F)cc1Cl	ZINC000819295383	FE	On-Demand	Anodyne	ADRB3	66	39
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(C(F)(F)F)cnc1Cl	ZINC000819295395	GJ	On-Demand	Anodyne	JUN	22	41
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(C(F)(F)F)cnc1Cl	ZINC000819295395	GJ	On-Demand	Anodyne	ATF1	58	38
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(C(F)(F)F)cnc1Cl	ZINC000819295395	GJ	On-Demand	Anodyne	NFKB1	53	38
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819295399	GF	On-Demand	Anodyne	VHL	57	33
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819295418	II	On-Demand	Anodyne	GRIN2B	20	44
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819295418	II	On-Demand	Anodyne	PREP	36	43
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819295418	II	On-Demand	Anodyne	LGMN	55	37
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819295419	II	On-Demand	Anodyne	GRIN2B	20	44
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819295419	II	On-Demand	Anodyne	PREP	36	43
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000819295419	II	On-Demand	Anodyne	LGMN	55	37
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819295421	GI	On-Demand	Anodyne	CTSD	22	44
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819295421	GI	On-Demand	Anodyne	ECE1	39	44
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819295421	GI	On-Demand	Anodyne	REN	25	40
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819295422	GI	On-Demand	Anodyne	CTSD	22	44
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819295422	GI	On-Demand	Anodyne	ECE1	39	44
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819295422	GI	On-Demand	Anodyne	REN	25	40
O=C(Nc1nc(CC(F)(F)F)cs1)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819295425	II	On-Demand	Anodyne	GRIN2B	27	49
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819295436	IJ	On-Demand	Anodyne	FFAR1	30	42
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819295437	IJ	On-Demand	Anodyne	FFAR1	30	42
COc1ccc2c(C)c(CCC(=O)Nc3nc(CC(F)(F)F)cs3)c(=O)oc2c1	ZINC000819295449	II	On-Demand	Anodyne	MAOB	31	41
CC(C)(C)OC(=O)N1CCC(CCC(=O)Nc2nc(CC(F)(F)F)cs2)CC1	ZINC000819295458	HJ	On-Demand	Anodyne	GPR119	39	41
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(-c2cccnc2)nc2ccccc12	ZINC000819295465	HK	On-Demand	Anodyne	TACR3	23	48
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(-n2cccc2)nc1	ZINC000819295466	FH	On-Demand	Anodyne	MPL	66	43
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccnc(Cl)c1	ZINC000819295476	DH	On-Demand	Anodyne	MPL	71	38
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)Nc1nc(CC(F)(F)F)cs1	ZINC000819295479	IG	On-Demand	Anodyne	GRIN2B	18	43
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)Nc1nc(CC(F)(F)F)cs1	ZINC000819295479	IG	On-Demand	Anodyne	TGM2	33	40
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1ccc(F)cc1Cl	ZINC000819295484	FE	On-Demand	Anodyne	ADRB2	15	42
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1ccc(F)cc1Cl	ZINC000819295484	FE	On-Demand	Anodyne	ADRB1	30	40
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1ccc(F)cc1Cl	ZINC000819295484	FE	On-Demand	Anodyne	ADRB3	66	39
Cc1nonc1CNC(=O)C[C@@H](C)n1cccn1	ZINC000819295498	BC	On-Demand	Anodyne	CASP3	50	35
Cc1nonc1CNC(=O)C[C@@H](C)n1cccn1	ZINC000819295498	BC	On-Demand	Anodyne	CASP1	43	34
Cc1nonc1CNC(=O)C[C@@H](C)n1cccn1	ZINC000819295498	BC	On-Demand	Anodyne	CASP7	58	35
Cc1nonc1CNC(=O)C[C@H](C)n1cccn1	ZINC000819295499	BC	On-Demand	Anodyne	CASP3	50	35
Cc1nonc1CNC(=O)C[C@H](C)n1cccn1	ZINC000819295499	BC	On-Demand	Anodyne	CASP1	43	34
Cc1nonc1CNC(=O)C[C@H](C)n1cccn1	ZINC000819295499	BC	On-Demand	Anodyne	CASP7	58	35
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295502	GG	On-Demand	Anodyne	SIGMAR1	17	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295502	GG	On-Demand	Anodyne	CCR3	38	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295502	GG	On-Demand	Anodyne	BIRC2	16	44
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295503	GG	On-Demand	Anodyne	SIGMAR1	17	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295503	GG	On-Demand	Anodyne	CCR3	38	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295503	GG	On-Demand	Anodyne	BIRC2	16	44
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295504	GG	On-Demand	Anodyne	SIGMAR1	17	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295504	GG	On-Demand	Anodyne	CCR3	38	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295504	GG	On-Demand	Anodyne	BIRC2	16	44
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295505	GG	On-Demand	Anodyne	SIGMAR1	17	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295505	GG	On-Demand	Anodyne	CCR3	38	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819295505	GG	On-Demand	Anodyne	BIRC2	16	44
CON(C)C(=O)CCN[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000819295506	ED	On-Demand	Anodyne	PREP	40	36
CON(C)C(=O)CCN[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000819295506	ED	On-Demand	Anodyne	BIRC2	17	47
CON(C)C(=O)CCN[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000819295507	ED	On-Demand	Anodyne	PREP	40	36
CON(C)C(=O)CCN[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000819295507	ED	On-Demand	Anodyne	BIRC2	17	47
COc1ccc(OC)c([C@H](O)CNCCC(=O)OC2CCCCC2)c1	ZINC000819295509	FF	On-Demand	Anodyne	ADRB2	31	43
COc1ccc(OC)c([C@H](O)CNCCC(=O)OC2CCCCC2)c1	ZINC000819295509	FF	On-Demand	Anodyne	ADRB1	34	43
COc1ccc(OC)c([C@H](O)CNCCC(=O)OC2CCCCC2)c1	ZINC000819295509	FF	On-Demand	Anodyne	ADRB3	28	42
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819295510	FF	On-Demand	Anodyne	BIRC2	19	48
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819295511	FF	On-Demand	Anodyne	BIRC2	19	48
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819295512	FF	On-Demand	Anodyne	BIRC2	19	48
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819295513	FF	On-Demand	Anodyne	BIRC2	19	48
CS(=O)(=O)c1ccc([C@@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819295514	FD	On-Demand	Anodyne	ADRB2	36	42
CS(=O)(=O)c1ccc([C@@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819295514	FD	On-Demand	Anodyne	ADRB1	34	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819295514	FD	On-Demand	Anodyne	ADRB3	55	41
O[C@@H](CNCCCOC(F)F)c1cccnc1	ZINC000819295518	BD	On-Demand	Anodyne	ADRB2	36	53
O[C@@H](CNCCCOC(F)F)c1cccnc1	ZINC000819295518	BD	On-Demand	Anodyne	ADRB1	43	53
O[C@@H](CNCCCOC(F)F)c1cccnc1	ZINC000819295518	BD	On-Demand	Anodyne	ADRB3	114	55
O[C@H](CNCCCOC(F)F)c1cccnc1	ZINC000819295519	BD	On-Demand	Anodyne	ADRB2	36	53
O[C@H](CNCCCOC(F)F)c1cccnc1	ZINC000819295519	BD	On-Demand	Anodyne	ADRB1	43	53
O[C@H](CNCCCOC(F)F)c1cccnc1	ZINC000819295519	BD	On-Demand	Anodyne	ADRB3	114	55
CS(=O)(=O)c1ccc([C@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819295521	FD	On-Demand	Anodyne	ADRB2	36	42
CS(=O)(=O)c1ccc([C@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819295521	FD	On-Demand	Anodyne	ADRB1	34	41
CS(=O)(=O)c1ccc([C@H](O)CNCCC(=O)OC2CCCCC2)cc1	ZINC000819295521	FD	On-Demand	Anodyne	ADRB3	55	41
O=C(CCNC[C@H](O)COc1ccc(F)cc1)OC1CCCCC1	ZINC000819295522	EE	On-Demand	Anodyne	ADRB2	66	52
O=C(CCNC[C@H](O)COc1ccc(F)cc1)OC1CCCCC1	ZINC000819295522	EE	On-Demand	Anodyne	ADRB1	102	61
O=C(CCNC[C@H](O)COc1ccc(F)cc1)OC1CCCCC1	ZINC000819295522	EE	On-Demand	Anodyne	ADRB3	66	47
O=C(CCNC[C@H](O)COc1ccc(F)cc1)OC1CCCCC1	ZINC000819295522	EE	On-Demand	Anodyne	ABCB1	17	43
O=C(CCNC[C@@H](O)COc1ccc(F)cc1)OC1CCCCC1	ZINC000819295523	EE	On-Demand	Anodyne	ADRB2	66	52
O=C(CCNC[C@@H](O)COc1ccc(F)cc1)OC1CCCCC1	ZINC000819295523	EE	On-Demand	Anodyne	ADRB1	102	61
O=C(CCNC[C@@H](O)COc1ccc(F)cc1)OC1CCCCC1	ZINC000819295523	EE	On-Demand	Anodyne	ADRB3	66	47
O=C(CCNC[C@@H](O)COc1ccc(F)cc1)OC1CCCCC1	ZINC000819295523	EE	On-Demand	Anodyne	ABCB1	17	43
CON(C)C(=O)CCN[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819295526	DD	On-Demand	Anodyne	EPHX2	26	42
CON(C)C(=O)CCN[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819295527	DD	On-Demand	Anodyne	EPHX2	26	42
O=C(CCNC[C@H](O)c1ccccc1F)OC1CCCCC1	ZINC000819295540	DF	On-Demand	Anodyne	ADRB1	26	41
O=C(CCNC[C@H](O)c1ccccc1F)OC1CCCCC1	ZINC000819295540	DF	On-Demand	Anodyne	ADRB3	22	41
O=C(CCNC[C@@H](O)c1ccccc1F)OC1CCCCC1	ZINC000819295541	DF	On-Demand	Anodyne	ADRB1	26	41
O=C(CCNC[C@@H](O)c1ccccc1F)OC1CCCCC1	ZINC000819295541	DF	On-Demand	Anodyne	ADRB3	22	41
Cc1nonc1CNC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819295542	GH	On-Demand	Anodyne	REN	49	41
Cc1nonc1CNC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819295543	GH	On-Demand	Anodyne	REN	49	41
Cc1nonc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819295559	ED	On-Demand	Mild	PAPA1_CARPA	44	50
Cc1nonc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819295559	ED	On-Demand	Mild	CASP7	53	33
Cc1nonc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819295560	ED	On-Demand	Mild	PAPA1_CARPA	44	50
Cc1nonc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819295560	ED	On-Demand	Mild	CASP7	53	33
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819295561	GD	On-Demand	Bother	ADRB1	29	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819295561	GD	On-Demand	Bother	ADRB3	45	46
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819295561	GD	On-Demand	Bother	CPT1A	72	44
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819295561	GD	On-Demand	Bother	CPT2	40	33
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819295562	GD	On-Demand	Bother	ADRB1	29	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819295562	GD	On-Demand	Bother	ADRB3	45	46
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819295562	GD	On-Demand	Bother	CPT1A	72	44
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819295562	GD	On-Demand	Bother	CPT2	40	33
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819295563	GD	On-Demand	Bother	ADRB1	29	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819295563	GD	On-Demand	Bother	ADRB3	45	46
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819295563	GD	On-Demand	Bother	CPT1A	72	44
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819295563	GD	On-Demand	Bother	CPT2	40	33
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819295564	GD	On-Demand	Bother	ADRB1	29	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819295564	GD	On-Demand	Bother	ADRB3	45	46
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819295564	GD	On-Demand	Bother	CPT1A	72	44
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819295564	GD	On-Demand	Bother	CPT2	40	33
N#Cc1ccc([C@H](O)CN[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	ZINC000819295574	FE	On-Demand	Mild	ADRB3	18	46
N#Cc1ccc([C@H](O)CN[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	ZINC000819295574	FE	On-Demand	Mild	MLNR	16	41
N#Cc1ccc([C@H](O)CN[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	ZINC000819295574	FE	On-Demand	Mild	CTRB_BOVIN	44	31
N#Cc1ccc([C@H](O)CN[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	ZINC000819295574	FE	On-Demand	Mild	BIRC2	15	46
N#Cc1ccc([C@H](O)CN[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	ZINC000819295576	FE	On-Demand	Mild	ADRB3	18	46
N#Cc1ccc([C@H](O)CN[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	ZINC000819295576	FE	On-Demand	Mild	MLNR	16	41
N#Cc1ccc([C@H](O)CN[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	ZINC000819295576	FE	On-Demand	Mild	CTRB_BOVIN	44	31
N#Cc1ccc([C@H](O)CN[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	ZINC000819295576	FE	On-Demand	Mild	BIRC2	15	46
N#Cc1ccc([C@@H](O)CN[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	ZINC000819295578	FE	On-Demand	Mild	ADRB3	18	46
N#Cc1ccc([C@@H](O)CN[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	ZINC000819295578	FE	On-Demand	Mild	MLNR	16	41
N#Cc1ccc([C@@H](O)CN[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	ZINC000819295578	FE	On-Demand	Mild	CTRB_BOVIN	44	31
N#Cc1ccc([C@@H](O)CN[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	ZINC000819295578	FE	On-Demand	Mild	BIRC2	15	46
N#Cc1ccc([C@@H](O)CN[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	ZINC000819295580	FE	On-Demand	Mild	ADRB3	18	46
N#Cc1ccc([C@@H](O)CN[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	ZINC000819295580	FE	On-Demand	Mild	MLNR	16	41
N#Cc1ccc([C@@H](O)CN[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	ZINC000819295580	FE	On-Demand	Mild	CTRB_BOVIN	44	31
N#Cc1ccc([C@@H](O)CN[C@H]2CCCN(C(=O)Cc3ccccc3)C2)cc1	ZINC000819295580	FE	On-Demand	Mild	BIRC2	15	46
CC(=O)Nc1cccc(CC(=O)NCc2nonc2C)c1	ZINC000819295582	CD	On-Demand	Anodyne	KCNK3	42	34
O=C(CCNC[C@H](O)c1ccccc1C(F)(F)F)OC1CCCCC1	ZINC000819295583	FH	On-Demand	Anodyne	ADRB1	20	41
O=C(CCNC[C@H](O)c1ccccc1C(F)(F)F)OC1CCCCC1	ZINC000819295583	FH	On-Demand	Anodyne	ADRB3	24	41
O=C(CCNC[C@@H](O)c1ccccc1C(F)(F)F)OC1CCCCC1	ZINC000819295585	FH	On-Demand	Anodyne	ADRB1	20	41
O=C(CCNC[C@@H](O)c1ccccc1C(F)(F)F)OC1CCCCC1	ZINC000819295585	FH	On-Demand	Anodyne	ADRB3	24	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819295593	FF	On-Demand	Anodyne	CCR3	47	46
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819295593	FF	On-Demand	Anodyne	SCD1	15	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819295595	FF	On-Demand	Anodyne	CCR3	47	46
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819295595	FF	On-Demand	Anodyne	SCD1	15	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819295597	FF	On-Demand	Anodyne	CCR3	47	46
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819295597	FF	On-Demand	Anodyne	SCD1	15	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819295599	FF	On-Demand	Anodyne	CCR3	47	46
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819295599	FF	On-Demand	Anodyne	SCD1	15	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819295629	GH	On-Demand	Anodyne	SIGMAR1	15	45
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819295629	GH	On-Demand	Anodyne	BIRC2	19	47
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819295630	GH	On-Demand	Anodyne	SIGMAR1	15	45
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819295630	GH	On-Demand	Anodyne	BIRC2	19	47
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)C2CC2)C1	ZINC000819295631	DD	On-Demand	Anodyne	BIRC2	25	54
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)C2CC2)C1	ZINC000819295632	DD	On-Demand	Anodyne	BIRC2	25	54
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)C2CC2)C1	ZINC000819295633	DD	On-Demand	Anodyne	BIRC2	25	54
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)C2CC2)C1	ZINC000819295634	DD	On-Demand	Anodyne	BIRC2	25	54
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819295639	GE	On-Demand	Anodyne	NACHRBETA2	40	34
CC(=O)Nc1cccc(CC(=O)N2CCN(Cc3ccc(Cl)nc3)CC2)c1	ZINC000819295652	GF	On-Demand	Anodyne	HTR1D	22	44
CC(=O)Nc1cccc(CC(=O)N2CCN(Cc3ccc(Cl)nc3)CC2)c1	ZINC000819295652	GF	On-Demand	Anodyne	HTR1B	18	41
CC(=O)Nc1cccc(CC(=O)N2CCN(Cc3ccc(Cl)nc3)CC2)c1	ZINC000819295652	GF	On-Demand	Anodyne	OPRK1	16	41
CC(=O)Nc1cccc(CC(=O)N2CCN(Cc3ccc(Cl)nc3)CC2)c1	ZINC000819295652	GF	On-Demand	Anodyne	SIGMAR1	23	46
CC(=O)Nc1cccc(CC(=O)N2CCN(Cc3ccc(Cl)nc3)CC2)c1	ZINC000819295652	GF	On-Demand	Anodyne	FAAH	32	45
CC(=O)Nc1cccc(CC(=O)N2CCN(Cc3ccc(Cl)nc3)CC2)c1	ZINC000819295652	GF	On-Demand	Anodyne	MCHR1	32	40
CC(=O)Nc1cccc(CC(=O)N2CCN(Cc3ccc(Cl)nc3)CC2)c1	ZINC000819295652	GF	On-Demand	Anodyne	KCNJ1	44	33
CC(=O)Nc1cccc(CC(=O)N2CCN(Cc3ccc(Cl)nc3)CC2)c1	ZINC000819295652	GF	On-Demand	Anodyne	NACHRBETA2	45	32
CS(=O)(=O)NC1CC(NC[C@@H](O)c2cccnc2)C1	ZINC000819295677	CB	On-Demand	Anodyne	ADRB1	26	40
CS(=O)(=O)NC1CC(NC[C@@H](O)c2cccnc2)C1	ZINC000819295677	CB	On-Demand	Anodyne	ADRB3	103	47
CS(=O)(=O)NC1CC(NC[C@H](O)c2cccnc2)C1	ZINC000819295678	CB	On-Demand	Anodyne	ADRB1	26	40
CS(=O)(=O)NC1CC(NC[C@H](O)c2cccnc2)C1	ZINC000819295678	CB	On-Demand	Anodyne	ADRB3	103	47
C=CCNS(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1F	ZINC000819295696	HG	On-Demand	Mild	MPL	48	34
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(S(F)(F)(F)(F)F)cc1	ZINC000819295697	HK	On-Demand	Reactive	MPL	63	37
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc2nnc(S)n2c1	ZINC000819295703	FF	On-Demand	Anodyne	MPL	40	33
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(OCc2ccccc2)ccn1	ZINC000819295711	GI	On-Demand	Anodyne	PTGER1	21	40
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(SC(F)(F)F)cc1	ZINC000819295713	GK	On-Demand	Anodyne	MPL	61	37
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccnc(Br)c1	ZINC000819295720	FH	On-Demand	Anodyne	MPL	65	36
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2nc(CC(F)(F)F)cs2)cc1	ZINC000819295725	HE	On-Demand	Mild	MPL	54	35
Nc1ccc(C(=O)Nc2nc(CC(F)(F)F)cs2)cc1[N+](=O)[O-]	ZINC000819295734	EF	On-Demand	Bother	MPL	57	36
O=C(CN1C(=O)COc2ccc(Cl)cc21)Nc1nc(CC(F)(F)F)cs1	ZINC000819295736	HG	On-Demand	Anodyne	CPT1A	24	51
C#Cc1ccc(C(=O)Nc2nc(CC(F)(F)F)cs2)cn1	ZINC000819295742	DF	On-Demand	Mild	MPL	69	39
COc1cccc(C2=NO[C@@H](C(=O)Nc3nc(CC(F)(F)F)cs3)C2)c1	ZINC000819295746	GG	On-Demand	Anodyne	LUCI_PHOPY	29	42
COc1cccc(C2=NO[C@H](C(=O)Nc3nc(CC(F)(F)F)cs3)C2)c1	ZINC000819295747	GG	On-Demand	Anodyne	LUCI_PHOPY	29	42
O=C(Nc1nc(CC(F)(F)F)cs1)c1c(O)cccc1Cl	ZINC000819295748	EH	On-Demand	Anodyne	MPL	45	35
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(SC(F)F)cc1	ZINC000819295753	FJ	On-Demand	Anodyne	MPL	54	36
C#Cc1cncc(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819295754	DF	On-Demand	Mild	MPL	58	36
N#Cc1ccc([C@@H](O)C(=O)Nc2nc(CC(F)(F)F)cs2)cc1	ZINC000819295767	EF	On-Demand	Mild	CTSF	42	33
N#Cc1ccc([C@H](O)C(=O)Nc2nc(CC(F)(F)F)cs2)cc1	ZINC000819295768	EF	On-Demand	Mild	CTSF	42	33
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc2ccccc2oc1=O	ZINC000819295773	FH	On-Demand	Anodyne	KCNJ11	42	34
CC(=O)c1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)c(C)c3)=NO2)cc1	ZINC000819295786	GG	On-Demand	Anodyne	ADRB1	46	36
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)c(C)c3)=NO2)cc1	ZINC000819295787	GG	On-Demand	Anodyne	ADRB1	46	36
CC(=O)c1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)c(C)c3)=NO2)cc1	ZINC000819295788	GG	On-Demand	Anodyne	ADRB1	46	36
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)c(C)c3)=NO2)cc1	ZINC000819295789	GG	On-Demand	Anodyne	ADRB1	46	36
CS(=O)(=O)NC1CC(NC[C@H](O)c2ccccc2)C1	ZINC000819295799	CC	On-Demand	Anodyne	ADRB3	52	38
CS(=O)(=O)NC1CC(NC[C@@H](O)c2ccccc2)C1	ZINC000819295800	CC	On-Demand	Anodyne	ADRB3	52	38
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295818	EF	On-Demand	Anodyne	XIAP	18	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295818	EF	On-Demand	Anodyne	BIRC3	15	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295818	EF	On-Demand	Anodyne	BIRC2	28	52
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295818	EF	On-Demand	Anodyne	BIRC8	33	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295819	EF	On-Demand	Anodyne	XIAP	18	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295819	EF	On-Demand	Anodyne	BIRC3	15	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295819	EF	On-Demand	Anodyne	BIRC2	28	52
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819295819	EF	On-Demand	Anodyne	BIRC8	33	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295820	EF	On-Demand	Anodyne	XIAP	18	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295820	EF	On-Demand	Anodyne	BIRC3	15	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295820	EF	On-Demand	Anodyne	BIRC2	28	52
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295820	EF	On-Demand	Anodyne	BIRC8	33	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295821	EF	On-Demand	Anodyne	XIAP	18	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295821	EF	On-Demand	Anodyne	BIRC3	15	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295821	EF	On-Demand	Anodyne	BIRC2	28	52
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819295821	EF	On-Demand	Anodyne	BIRC8	33	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819295822	GE	On-Demand	Anodyne	CPT1A	84	44
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819295822	GE	On-Demand	Anodyne	CPT2	43	36
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819295823	GE	On-Demand	Anodyne	CPT1A	84	44
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819295823	GE	On-Demand	Anodyne	CPT2	43	36
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819295824	GE	On-Demand	Anodyne	CPT1A	84	44
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819295824	GE	On-Demand	Anodyne	CPT2	43	36
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819295825	GE	On-Demand	Anodyne	CPT1A	84	44
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819295825	GE	On-Demand	Anodyne	CPT2	43	36
O=C(CCNC[C@H](O)c1ccc(Cl)cc1)OC1CCCCC1	ZINC000819295830	EG	On-Demand	Anodyne	ADRB1	42	43
O=C(CCNC[C@H](O)c1ccc(Cl)cc1)OC1CCCCC1	ZINC000819295830	EG	On-Demand	Anodyne	ADRB3	47	43
Cc1nonc1CNC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819295848	GF	On-Demand	Anodyne	CNR1	52	33
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819295850	FE	On-Demand	Anodyne	CPT1A	88	43
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819295850	FE	On-Demand	Anodyne	CPT2	42	35
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819295852	FE	On-Demand	Anodyne	CPT1A	88	43
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819295852	FE	On-Demand	Anodyne	CPT2	42	35
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819295854	FE	On-Demand	Anodyne	CPT1A	88	43
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819295854	FE	On-Demand	Anodyne	CPT2	42	35
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819295856	FE	On-Demand	Anodyne	CPT1A	88	43
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819295856	FE	On-Demand	Anodyne	CPT2	42	35
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819295862	EF	On-Demand	Anodyne	EPHX2	23	43
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819295862	EF	On-Demand	Anodyne	CCR8	76	36
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819295865	EF	On-Demand	Anodyne	EPHX2	23	43
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000819295865	EF	On-Demand	Anodyne	CCR8	76	36
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819295892	FD	On-Demand	Anodyne	ADRB1	18	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819295892	FD	On-Demand	Anodyne	ADRB3	24	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819295892	FD	On-Demand	Anodyne	CPT1A	95	39
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819295892	FD	On-Demand	Anodyne	CPT2	42	35
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819295893	FD	On-Demand	Anodyne	ADRB1	18	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819295893	FD	On-Demand	Anodyne	ADRB3	24	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819295893	FD	On-Demand	Anodyne	CPT1A	95	39
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819295893	FD	On-Demand	Anodyne	CPT2	42	35
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819295895	FD	On-Demand	Anodyne	ADRB1	18	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819295895	FD	On-Demand	Anodyne	ADRB3	24	40
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819295895	FD	On-Demand	Anodyne	CPT1A	95	39
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819295895	FD	On-Demand	Anodyne	CPT2	42	35
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819295896	FD	On-Demand	Anodyne	ADRB1	18	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819295896	FD	On-Demand	Anodyne	ADRB3	24	40
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819295896	FD	On-Demand	Anodyne	CPT1A	95	39
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819295896	FD	On-Demand	Anodyne	CPT2	42	35
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000819295907	FE	On-Demand	Anodyne	CPT1A	96	43
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000819295907	FE	On-Demand	Anodyne	CPT2	42	36
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000819295907	FE	On-Demand	Anodyne	CCR8	57	34
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000819295908	FE	On-Demand	Anodyne	CPT1A	96	43
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000819295908	FE	On-Demand	Anodyne	CPT2	42	36
Cc1ccccc1[C@@H](O)CN[C@@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000819295908	FE	On-Demand	Anodyne	CCR8	57	34
O[C@H](CNCCCOC(F)F)c1ccc(Cl)c(F)c1	ZINC000819295917	CF	On-Demand	Anodyne	ADRB2	39	44
O[C@H](CNCCCOC(F)F)c1ccc(Cl)c(F)c1	ZINC000819295917	CF	On-Demand	Anodyne	ADRB1	33	44
O[C@H](CNCCCOC(F)F)c1ccc(Cl)c(F)c1	ZINC000819295917	CF	On-Demand	Anodyne	ADRB3	30	44
O[C@@H](CNCCCOC(F)F)c1ccc(Cl)c(F)c1	ZINC000819295918	CF	On-Demand	Anodyne	ADRB2	39	44
O[C@@H](CNCCCOC(F)F)c1ccc(Cl)c(F)c1	ZINC000819295918	CF	On-Demand	Anodyne	ADRB1	33	44
O[C@@H](CNCCCOC(F)F)c1ccc(Cl)c(F)c1	ZINC000819295918	CF	On-Demand	Anodyne	ADRB3	30	44
O=C(CCNC[C@H](O)COc1ccccc1F)OC1CCCCC1	ZINC000819295924	EE	On-Demand	Anodyne	ADRB2	55	54
O=C(CCNC[C@H](O)COc1ccccc1F)OC1CCCCC1	ZINC000819295924	EE	On-Demand	Anodyne	ADRB1	94	51
O=C(CCNC[C@H](O)COc1ccccc1F)OC1CCCCC1	ZINC000819295924	EE	On-Demand	Anodyne	ADRB3	53	42
O=C(CCNC[C@H](O)COc1ccccc1F)OC1CCCCC1	ZINC000819295924	EE	On-Demand	Anodyne	ABCB1	32	47
O=C(CCNC[C@@H](O)COc1ccccc1F)OC1CCCCC1	ZINC000819295925	EE	On-Demand	Anodyne	ADRB2	55	54
O=C(CCNC[C@@H](O)COc1ccccc1F)OC1CCCCC1	ZINC000819295925	EE	On-Demand	Anodyne	ADRB1	94	51
O=C(CCNC[C@@H](O)COc1ccccc1F)OC1CCCCC1	ZINC000819295925	EE	On-Demand	Anodyne	ADRB3	53	42
O=C(CCNC[C@@H](O)COc1ccccc1F)OC1CCCCC1	ZINC000819295925	EE	On-Demand	Anodyne	ABCB1	32	47
Cc1ccccc1[C@@H](O)CNCCC(=O)OC1CCCCC1	ZINC000819295928	DF	On-Demand	Anodyne	ADRB2	33	46
Cc1ccccc1[C@@H](O)CNCCC(=O)OC1CCCCC1	ZINC000819295928	DF	On-Demand	Anodyne	ADRB1	29	41
Cc1ccccc1[C@@H](O)CNCCC(=O)OC1CCCCC1	ZINC000819295928	DF	On-Demand	Anodyne	ADRB3	25	41
O[C@H](CNCCCOC(F)F)c1ccc(OC(F)(F)F)cc1	ZINC000819295931	EF	On-Demand	Anodyne	ADRB3	26	42
O[C@@H](CNCCCOC(F)F)c1ccc(OC(F)(F)F)cc1	ZINC000819295933	EF	On-Demand	Anodyne	ADRB3	26	42
O=C(CCNCCC(=O)OC1CCCCC1)Nc1ccccc1	ZINC000819295936	DF	On-Demand	Anodyne	HDAC8	15	43
O=C(CCNCCC(=O)OC1CCCCC1)Nc1ccccc1	ZINC000819295936	DF	On-Demand	Anodyne	HDAC10	32	43
O=C(CCNCCC(=O)OC1CCCCC1)Nc1ccccc1	ZINC000819295936	DF	On-Demand	Anodyne	HDAC2	22	43
O=C(CCNCCC(=O)OC1CCCCC1)Nc1ccccc1	ZINC000819295936	DF	On-Demand	Anodyne	HDAC3	22	43
O=C(CCNCCC(=O)OC1CCCCC1)Nc1ccccc1	ZINC000819295936	DF	On-Demand	Anodyne	HDAC6	23	43
O=C(CCNCCC(=O)OC1CCCCC1)Nc1ccccc1	ZINC000819295936	DF	On-Demand	Anodyne	HDAC11	31	43
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819295962	GF	On-Demand	Reactive	EPHX2	20	46
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819295964	GF	On-Demand	Reactive	EPHX2	20	46
O=C(NCCc1c[nH]c2ccc(F)cc12)C(F)=C1CCC1	ZINC000819295969	CG	On-Demand	Anodyne	HTR1A	23	46
O=C(NCCc1c[nH]c2ccc(F)cc12)C(F)=C1CCC1	ZINC000819295969	CG	On-Demand	Anodyne	HTR1D	46	40
O=C(NCCc1c[nH]c2ccc(F)cc12)C(F)=C1CCC1	ZINC000819295969	CG	On-Demand	Anodyne	HTR1B	37	46
O=C(NCCc1c[nH]c2ccc(F)cc12)C(F)=C1CCC1	ZINC000819295969	CG	On-Demand	Anodyne	SLC6A4	28	54
O=C(NCCc1c[nH]c2ccc(F)cc12)C(F)=C1CCC1	ZINC000819295969	CG	On-Demand	Anodyne	MPO	114	54
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819295980	GD	On-Demand	Bother	ADRB3	33	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819295980	GD	On-Demand	Bother	CPT1A	60	42
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819295980	GD	On-Demand	Bother	CPT2	40	32
O=C(COc1ccccc1)N1CC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819295980	GD	On-Demand	Bother	C3AR1	23	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819295981	GD	On-Demand	Bother	ADRB3	33	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819295981	GD	On-Demand	Bother	CPT1A	60	42
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819295981	GD	On-Demand	Bother	CPT2	40	32
O=C(COc1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819295981	GD	On-Demand	Bother	C3AR1	23	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819295982	GD	On-Demand	Bother	ADRB3	33	41
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819295982	GD	On-Demand	Bother	CPT1A	60	42
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819295982	GD	On-Demand	Bother	CPT2	40	32
O=C(COc1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819295982	GD	On-Demand	Bother	C3AR1	23	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819295983	GD	On-Demand	Bother	ADRB3	33	41
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819295983	GD	On-Demand	Bother	CPT1A	60	42
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819295983	GD	On-Demand	Bother	CPT2	40	32
O=C(COc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819295983	GD	On-Demand	Bother	C3AR1	23	41
O=C(Nc1ccccc1C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1	ZINC000819295984	HJ	On-Demand	Anodyne	MPL	57	35
O=C(Nc1ccccc1C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1	ZINC000819295984	HJ	On-Demand	Anodyne	NR1H4	15	42
O=C(Nc1ccccc1C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1	ZINC000819295984	HJ	On-Demand	Anodyne	GCK	16	43
CCCCCCCC(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296009	DJ	On-Demand	Mild	HDAC9	19	45
CCCCCCCC(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296009	DJ	On-Demand	Mild	LASR	40	37
O=C(Nc1nc(CC(F)(F)F)cs1)C1CCN(C(=O)/C=C\c2ccccc2)CC1	ZINC000819296013	HI	On-Demand	Anodyne	ITGAL	65	38
O=C(Nc1nc(CC(F)(F)F)cs1)C1CCN(C(=O)/C=C\c2ccccc2)CC1	ZINC000819296013	HI	On-Demand	Anodyne	ETHR	42	34
O=C(Nc1nc(CC(F)(F)F)cs1)C1CCN(C(=O)/C=C/c2ccccc2)CC1	ZINC000819296014	HI	On-Demand	Anodyne	ITGAL	65	38
O=C(Nc1nc(CC(F)(F)F)cs1)C1CCN(C(=O)/C=C/c2ccccc2)CC1	ZINC000819296014	HI	On-Demand	Anodyne	ETHR	42	34
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(-n2ccnc2)nc1	ZINC000819296015	FG	On-Demand	Anodyne	MPL	65	39
COC(=O)N[C@H](CC(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296024	FF	On-Demand	Anodyne	CAPNS1	54	33
COC(=O)N[C@H](CC(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296024	FF	On-Demand	Anodyne	CAPN1	52	42
COC(=O)N[C@H](CC(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296024	FF	On-Demand	Anodyne	CAPN2	64	34
COC(=O)N[C@H](CC(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296024	FF	On-Demand	Anodyne	FPR1	50	35
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296025	FF	On-Demand	Anodyne	CAPNS1	54	33
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296025	FF	On-Demand	Anodyne	CAPN1	52	42
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296025	FF	On-Demand	Anodyne	CAPN2	64	34
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296025	FF	On-Demand	Anodyne	FPR1	50	35
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(C2SCCCS2)cc1	ZINC000819296034	HK	On-Demand	Anodyne	MPL	57	34
O=C(Nc1nc(CC(F)(F)F)cs1)c1cccnc1F	ZINC000819296050	DG	On-Demand	Anodyne	MPL	54	34
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296079	GH	On-Demand	Anodyne	PAPA1_CARPA	36	46
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296079	GH	On-Demand	Anodyne	CTSK	15	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296087	FF	On-Demand	Anodyne	ADRB1	19	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296087	FF	On-Demand	Anodyne	ADRB3	31	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296087	FF	On-Demand	Anodyne	BIRC2	19	46
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296087	FF	On-Demand	Anodyne	SFRP1	49	31
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296087	FF	On-Demand	Anodyne	WNT3	56	33
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296088	FF	On-Demand	Anodyne	ADRB1	19	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296088	FF	On-Demand	Anodyne	ADRB3	31	41
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296088	FF	On-Demand	Anodyne	BIRC2	19	46
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296088	FF	On-Demand	Anodyne	SFRP1	49	31
O=C(Cc1ccccc1)N1CCC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296088	FF	On-Demand	Anodyne	WNT3	56	33
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296089	FF	On-Demand	Anodyne	ADRB1	19	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296089	FF	On-Demand	Anodyne	ADRB3	31	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296089	FF	On-Demand	Anodyne	BIRC2	19	46
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296089	FF	On-Demand	Anodyne	SFRP1	49	31
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296089	FF	On-Demand	Anodyne	WNT3	56	33
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296090	FF	On-Demand	Anodyne	ADRB1	19	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296090	FF	On-Demand	Anodyne	ADRB3	31	41
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296090	FF	On-Demand	Anodyne	BIRC2	19	46
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296090	FF	On-Demand	Anodyne	SFRP1	49	31
O=C(Cc1ccccc1)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819296090	FF	On-Demand	Anodyne	WNT3	56	33
Cc1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)c(C)c3)=NO2)cc1	ZINC000819296122	FG	On-Demand	Anodyne	ADRB2	32	44
Cc1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)c(C)c3)=NO2)cc1	ZINC000819296122	FG	On-Demand	Anodyne	ADRB1	49	39
Cc1ccc(OC[C@H](O)CNC[C@@H]2CC(c3ccc(C)c(C)c3)=NO2)cc1	ZINC000819296122	FG	On-Demand	Anodyne	LUCI_PHOPY	65	37
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)c(C)c3)=NO2)cc1	ZINC000819296123	FG	On-Demand	Anodyne	ADRB2	32	44
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)c(C)c3)=NO2)cc1	ZINC000819296123	FG	On-Demand	Anodyne	ADRB1	49	39
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CC(c3ccc(C)c(C)c3)=NO2)cc1	ZINC000819296123	FG	On-Demand	Anodyne	LUCI_PHOPY	65	37
Cc1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)c(C)c3)=NO2)cc1	ZINC000819296125	FG	On-Demand	Anodyne	ADRB2	32	44
Cc1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)c(C)c3)=NO2)cc1	ZINC000819296125	FG	On-Demand	Anodyne	ADRB1	49	39
Cc1ccc(OC[C@@H](O)CNC[C@H]2CC(c3ccc(C)c(C)c3)=NO2)cc1	ZINC000819296125	FG	On-Demand	Anodyne	LUCI_PHOPY	65	37
Cc1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)c(C)c3)=NO2)cc1	ZINC000819296127	FG	On-Demand	Anodyne	ADRB2	32	44
Cc1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)c(C)c3)=NO2)cc1	ZINC000819296127	FG	On-Demand	Anodyne	ADRB1	49	39
Cc1ccc(OC[C@H](O)CNC[C@H]2CC(c3ccc(C)c(C)c3)=NO2)cc1	ZINC000819296127	FG	On-Demand	Anodyne	LUCI_PHOPY	65	37
O=C(CCNC[C@H](O)CN1C(=O)c2ccccc2C1=O)OC1CCCCC1	ZINC000819296166	FD	On-Demand	Anodyne	ADRB2	17	42
O=C(CCNC[C@@H](O)CN1C(=O)c2ccccc2C1=O)OC1CCCCC1	ZINC000819296168	FD	On-Demand	Anodyne	ADRB2	17	42
O=C(CCNC[C@H](O)c1ccc(Cl)c(F)c1)OC1CCCCC1	ZINC000819296170	EG	On-Demand	Anodyne	ADRB1	42	42
O=C(CCNC[C@H](O)c1ccc(Cl)c(F)c1)OC1CCCCC1	ZINC000819296170	EG	On-Demand	Anodyne	ADRB3	40	42
O=C(CCNC[C@@H](O)c1ccc(Cl)c(F)c1)OC1CCCCC1	ZINC000819296172	EG	On-Demand	Anodyne	ADRB1	42	42
O=C(CCNC[C@@H](O)c1ccc(Cl)c(F)c1)OC1CCCCC1	ZINC000819296172	EG	On-Demand	Anodyne	ADRB3	40	42
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296183	GH	On-Demand	Anodyne	ADRB1	15	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296183	GH	On-Demand	Anodyne	ADRB3	28	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296183	GH	On-Demand	Anodyne	MLNR	15	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296183	GH	On-Demand	Anodyne	CCR2	78	46
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296183	GH	On-Demand	Anodyne	EPHX2	42	49
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296183	GH	On-Demand	Anodyne	RBP4	64	34
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296183	GH	On-Demand	Anodyne	LIPG	44	33
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296183	GH	On-Demand	Anodyne	SFRP1	105	38
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296183	GH	On-Demand	Anodyne	TRPM8	55	39
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296183	GH	On-Demand	Anodyne	WNT3	70	38
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296185	GH	On-Demand	Anodyne	ADRB1	15	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296185	GH	On-Demand	Anodyne	ADRB3	28	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296185	GH	On-Demand	Anodyne	MLNR	15	41
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296185	GH	On-Demand	Anodyne	CCR2	78	46
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296185	GH	On-Demand	Anodyne	EPHX2	42	49
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296185	GH	On-Demand	Anodyne	RBP4	64	34
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296185	GH	On-Demand	Anodyne	LIPG	44	33
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296185	GH	On-Demand	Anodyne	SFRP1	105	38
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296185	GH	On-Demand	Anodyne	TRPM8	55	39
O=C(Nc1ccccc1)N1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296185	GH	On-Demand	Anodyne	WNT3	70	38
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296187	GH	On-Demand	Anodyne	ADRB1	15	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296187	GH	On-Demand	Anodyne	ADRB3	28	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296187	GH	On-Demand	Anodyne	MLNR	15	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296187	GH	On-Demand	Anodyne	CCR2	78	46
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296187	GH	On-Demand	Anodyne	EPHX2	42	49
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296187	GH	On-Demand	Anodyne	RBP4	64	34
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296187	GH	On-Demand	Anodyne	LIPG	44	33
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296187	GH	On-Demand	Anodyne	SFRP1	105	38
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296187	GH	On-Demand	Anodyne	TRPM8	55	39
O=C(Nc1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296187	GH	On-Demand	Anodyne	WNT3	70	38
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296188	GH	On-Demand	Anodyne	ADRB1	15	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296188	GH	On-Demand	Anodyne	ADRB3	28	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296188	GH	On-Demand	Anodyne	MLNR	15	41
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296188	GH	On-Demand	Anodyne	CCR2	78	46
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296188	GH	On-Demand	Anodyne	EPHX2	42	49
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296188	GH	On-Demand	Anodyne	RBP4	64	34
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296188	GH	On-Demand	Anodyne	LIPG	44	33
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296188	GH	On-Demand	Anodyne	SFRP1	105	38
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296188	GH	On-Demand	Anodyne	TRPM8	55	39
O=C(Nc1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819296188	GH	On-Demand	Anodyne	WNT3	70	38
O=C(CCNC[C@H](O)c1cccc([N+](=O)[O-])c1)OC1CCCCC1	ZINC000819296189	EE	On-Demand	Bother	ADRB1	43	44
O=C(CCNC[C@H](O)c1cccc([N+](=O)[O-])c1)OC1CCCCC1	ZINC000819296189	EE	On-Demand	Bother	ADRB3	50	44
O=C(CCNC[C@H](O)c1cccc([N+](=O)[O-])c1)OC1CCCCC1	ZINC000819296189	EE	On-Demand	Bother	CACNA1D	46	33
O=C(CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1)OC1CCCCC1	ZINC000819296191	EE	On-Demand	Bother	ADRB1	43	44
O=C(CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1)OC1CCCCC1	ZINC000819296191	EE	On-Demand	Bother	ADRB3	50	44
O=C(CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1)OC1CCCCC1	ZINC000819296191	EE	On-Demand	Bother	CACNA1D	46	33
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CC(c3ccc(C)c(C)c3)=NO2)c1	ZINC000819296220	GG	On-Demand	Anodyne	LUCI_PHOPY	50	43
COc1ccc(OC)c([C@H](O)CNC[C@H]2CC(c3ccc(C)c(C)c3)=NO2)c1	ZINC000819296223	GG	On-Demand	Anodyne	LUCI_PHOPY	50	43
O=C(Nc1cccc(CSC2CCOCC2)c1)C(F)=C1CCC1	ZINC000819296230	EI	On-Demand	Anodyne	QRFPR	21	48
CS(=O)(=O)NC1CC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819296243	EC	On-Demand	Bother	CACNA1C	43	35
CS(=O)(=O)NC1CC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819296243	EC	On-Demand	Bother	CACNA1D	67	34
CS(=O)(=O)NC1CC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819296244	EC	On-Demand	Bother	CACNA1C	43	35
CS(=O)(=O)NC1CC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819296244	EC	On-Demand	Bother	CACNA1D	67	34
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCc3nc(C)ncc32)c1	ZINC000819296249	EE	On-Demand	Anodyne	P2RY14	41	30
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCc3nc(C)ncc32)c1	ZINC000819296250	EE	On-Demand	Anodyne	P2RY14	41	30
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819296256	GH	On-Demand	Anodyne	ELANE	48	38
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819296256	GH	On-Demand	Anodyne	TRY1_BOVIN	54	33
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819296256	GH	On-Demand	Anodyne	CPT1A	43	38
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819296256	GH	On-Demand	Anodyne	PREP	53	44
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819296256	GH	On-Demand	Anodyne	SFRP1	43	38
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819296256	GH	On-Demand	Anodyne	WNT3	44	38
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819296257	GH	On-Demand	Anodyne	ELANE	48	38
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819296257	GH	On-Demand	Anodyne	TRY1_BOVIN	54	33
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819296257	GH	On-Demand	Anodyne	CPT1A	43	38
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819296257	GH	On-Demand	Anodyne	PREP	53	44
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819296257	GH	On-Demand	Anodyne	SFRP1	43	38
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819296257	GH	On-Demand	Anodyne	WNT3	44	38
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296274	GF	On-Demand	Anodyne	PAPA1_CARPA	37	40
COC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296275	GF	On-Demand	Anodyne	PAPA1_CARPA	37	40
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc[n+]([O-])c1	ZINC000819296277	DE	On-Demand	Anodyne	MPL	40	33
O=C(Nc1nc(CC(F)(F)F)cs1)/C(=C/c1ccco1)NC(=O)c1ccccc1	ZINC000819296284	HI	On-Demand	Anodyne	ADAM12	35	41
O=C(Nc1nc(CC(F)(F)F)cs1)/C(=C\c1ccco1)NC(=O)c1ccccc1	ZINC000819296285	HI	On-Demand	Anodyne	ADAM12	35	41
CC(C)(C)OC(=O)N[C@H](CC(=O)Nc1nc(CC(F)(F)F)cs1)Cc1ccccc1	ZINC000819296297	IJ	On-Demand	Anodyne	PGC	45	37
CC(C)(C)OC(=O)N[C@H](CC(=O)Nc1nc(CC(F)(F)F)cs1)Cc1ccccc1	ZINC000819296297	IJ	On-Demand	Anodyne	PAPA1_CARPA	32	42
CC(C)(C)OC(=O)N[C@H](CC(=O)Nc1nc(CC(F)(F)F)cs1)Cc1ccccc1	ZINC000819296297	IJ	On-Demand	Anodyne	REN	65	38
CC(C)(C)OC(=O)N[C@H](CC(=O)Nc1nc(CC(F)(F)F)cs1)Cc1ccccc1	ZINC000819296297	IJ	On-Demand	Anodyne	FPR1	47	38
CC(C)(C)OC(=O)N[C@@H](CC(=O)Nc1nc(CC(F)(F)F)cs1)Cc1ccccc1	ZINC000819296298	IJ	On-Demand	Anodyne	PGC	45	37
CC(C)(C)OC(=O)N[C@@H](CC(=O)Nc1nc(CC(F)(F)F)cs1)Cc1ccccc1	ZINC000819296298	IJ	On-Demand	Anodyne	PAPA1_CARPA	32	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)Nc1nc(CC(F)(F)F)cs1)Cc1ccccc1	ZINC000819296298	IJ	On-Demand	Anodyne	REN	65	38
CC(C)(C)OC(=O)N[C@@H](CC(=O)Nc1nc(CC(F)(F)F)cs1)Cc1ccccc1	ZINC000819296298	IJ	On-Demand	Anodyne	FPR1	47	38
O=CNc1ccc(C(=O)Nc2nc(CC(F)(F)F)cs2)cc1	ZINC000819296305	EG	On-Demand	Anodyne	MPL	74	40
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccnc(Cl)c1F	ZINC000819296319	EH	On-Demand	Anodyne	MPL	58	35
O=C(Nc1nc(CC(F)(F)F)cs1)c1cccc(C2OCCO2)c1	ZINC000819296322	FH	On-Demand	Anodyne	MPL	54	36
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819296324	IF	On-Demand	Anodyne	CA5B	44	36
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819296324	IF	On-Demand	Anodyne	CA4	43	37
NS(=O)(=O)c1ccc(Br)c(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819296324	IF	On-Demand	Anodyne	CA5A	46	36
Cc1nn(-c2ccccc2)c2ncc(C(=O)Nc3nc(CC(F)(F)F)cs3)cc12	ZINC000819296325	HJ	On-Demand	Anodyne	MPL	42	36
O=C(Nc1nc(CC(F)(F)F)cs1)c1c(C(F)(F)F)ccnc1Cl	ZINC000819296327	GJ	On-Demand	Anodyne	MPL	53	34
O=C(/C=C/c1ccccc1Cl)Nc1nc(CC(F)(F)F)cs1	ZINC000819296336	EJ	On-Demand	Anodyne	UL26	42	43
O=C(/C=C/c1ccccc1Cl)Nc1nc(CC(F)(F)F)cs1	ZINC000819296336	EJ	On-Demand	Anodyne	SCAF_EBVB9	38	43
O=C(/C=C\c1ccccc1Cl)Nc1nc(CC(F)(F)F)cs1	ZINC000819296337	EJ	On-Demand	Anodyne	UL26	42	43
O=C(/C=C\c1ccccc1Cl)Nc1nc(CC(F)(F)F)cs1	ZINC000819296337	EJ	On-Demand	Anodyne	SCAF_EBVB9	38	43
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(N2CCCS2(=O)=O)cc1Cl	ZINC000819296346	IH	On-Demand	Anodyne	CDK1	16	41
O[C@H](CNCCCOC(F)F)c1cccc(Cl)c1	ZINC000819296379	CF	On-Demand	Anodyne	ADRB2	57	45
O[C@H](CNCCCOC(F)F)c1cccc(Cl)c1	ZINC000819296379	CF	On-Demand	Anodyne	ADRB1	66	51
O[C@H](CNCCCOC(F)F)c1cccc(Cl)c1	ZINC000819296379	CF	On-Demand	Anodyne	ADRB3	72	51
O[C@@H](CNCCCOC(F)F)c1cccc(Cl)c1	ZINC000819296380	CF	On-Demand	Anodyne	ADRB2	57	45
O[C@@H](CNCCCOC(F)F)c1cccc(Cl)c1	ZINC000819296380	CF	On-Demand	Anodyne	ADRB1	66	51
O[C@@H](CNCCCOC(F)F)c1cccc(Cl)c1	ZINC000819296380	CF	On-Demand	Anodyne	ADRB3	72	51
CS(=O)(=O)NC1CC(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819296399	FB	On-Demand	Anodyne	ADRB3	17	42
CS(=O)(=O)NC1CC(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819296400	FB	On-Demand	Anodyne	ADRB3	17	42
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819296419	EE	On-Demand	Anodyne	NACHRBETA2	42	35
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819296420	EE	On-Demand	Anodyne	NACHRBETA2	42	35
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819296421	EE	On-Demand	Anodyne	NACHRBETA2	42	35
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819296422	EE	On-Demand	Anodyne	NACHRBETA2	42	35
CS(=O)(=O)NC1CC(NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819296443	ED	On-Demand	Anodyne	ADRB3	31	43
CS(=O)(=O)NC1CC(NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819296444	ED	On-Demand	Anodyne	ADRB3	31	43
CCOC[C@H](O)CNC[C@@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819296451	DD	On-Demand	Anodyne	LUCI_PHOPY	67	34
CCOC[C@H](O)CNC[C@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819296453	DD	On-Demand	Anodyne	LUCI_PHOPY	67	34
O=C(CSc1nc2ccccc2s1)Nc1nc(CC(F)(F)F)cs1	ZINC000819296456	GJ	On-Demand	Anodyne	CSNK1D	31	41
C#Cc1ccc(C(=O)Nc2nc(CC(F)(F)F)cs2)nc1	ZINC000819296457	DF	On-Demand	Mild	MPL	47	32
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc[n+]([O-])cc1	ZINC000819296490	DE	On-Demand	Anodyne	MPL	53	35
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	MME	23	43
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	CASP3	19	47
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	KLK3	79	43
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	CTSB	64	47
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	PAPA1_CARPA	74	40
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	CYSP_TRYCR	59	41
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	CTSK	35	44
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	CTSL	47	42
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	CAPNS1	68	38
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	REN	23	40
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	MMP11	70	36
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	CTSS	18	43
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	CAPN1	82	41
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	CASP1	21	42
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	CAPN2	126	45
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	CASP6	19	41
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	CASP9	36	41
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	CYP3A4	24	42
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	NPR	69	33
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296495	IE	On-Demand	Anodyne	GPR142	48	35
CCCCSCC(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296511	DH	On-Demand	Anodyne	CES1	17	40
CCCCSCC(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296511	DH	On-Demand	Anodyne	EST1_PIG	47	40
CCOC(=O)N[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)C(C)C	ZINC000819296513	FF	On-Demand	Anodyne	HLA-DRB1	45	36
CCOC(=O)N[C@H](C(=O)Nc1nc(CC(F)(F)F)cs1)C(C)C	ZINC000819296514	FF	On-Demand	Anodyne	HLA-DRB1	45	36
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCC(F)(F)F	ZINC000819296525	HG	On-Demand	Anodyne	LGMN	72	38
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCC(F)(F)F	ZINC000819296530	HG	On-Demand	Anodyne	LGMN	72	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	MME	68	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	ANPEP	55	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	CTSD	20	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	PGC	64	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	CMA1	46	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	CTRA_BOVIN	20	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	FCER2	85	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	CTSB	45	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	PAPA1_CARPA	82	56
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	CYSP_TRYCR	69	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	CCKAR	57	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	CTSK	25	56
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	CTSL	51	56
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	PGA	39	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	TIMP3	75	35
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	TACR3	18	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	CAPNS1	55	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	HLA-DRB1	38	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	REN	106	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	REN1	47	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	CCKBR	21	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	CTSS	23	56
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	CAPN1	48	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	CAPN2	53	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	ACE2	40	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	SCN10A	20	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	FPR1	77	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	CTRB_BOVIN	21	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	CYP3A4	15	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296535	II	On-Demand	Anodyne	GPR142	84	37
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2nc(CC(F)(F)F)cs2)cc1	ZINC000819296539	HJ	On-Demand	Anodyne	MPL	46	35
COC[C@@H](O)CNC[C@@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819296550	CD	On-Demand	Anodyne	LUCI_PHOPY	71	37
NS(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1Cl	ZINC000819296553	GF	On-Demand	Anodyne	CA2	21	55
NS(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1Cl	ZINC000819296553	GF	On-Demand	Anodyne	MPL	51	35
NS(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1Cl	ZINC000819296553	GF	On-Demand	Anodyne	CA6	19	40
NS(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1Cl	ZINC000819296553	GF	On-Demand	Anodyne	CA1	22	55
NS(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1Cl	ZINC000819296553	GF	On-Demand	Anodyne	CA7	19	41
NS(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1Cl	ZINC000819296553	GF	On-Demand	Anodyne	CPT1A	29	41
NS(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1Cl	ZINC000819296553	GF	On-Demand	Anodyne	CA13	36	41
NS(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1Cl	ZINC000819296553	GF	On-Demand	Anodyne	CA4	24	55
NS(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1Cl	ZINC000819296553	GF	On-Demand	Anodyne	CPT1B	40	41
COC[C@@H](O)CNC[C@H]1CC(c2ccc(C)c(C)c2)=NO1	ZINC000819296554	CD	On-Demand	Anodyne	LUCI_PHOPY	71	37
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296555	HH	On-Demand	Anodyne	PAPA1_CARPA	33	48
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296555	HH	On-Demand	Anodyne	FPR1	44	46
O=C(c1coc(=O)c2ccccc12)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819296559	GF	On-Demand	Anodyne	FAAH	20	40
O=C(c1coc(=O)c2ccccc12)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819296559	GF	On-Demand	Anodyne	NACHRBETA2	41	35
CC(C)(C)OC(=O)N1CCc2cc(C(=O)Nc3nc(CC(F)(F)F)cs3)ccc21	ZINC000819296563	IJ	On-Demand	Anodyne	CPT1A	29	47
CC(C)(C)OC(=O)N1CCc2cc(C(=O)Nc3nc(CC(F)(F)F)cs3)ccc21	ZINC000819296563	IJ	On-Demand	Anodyne	CPT1B	42	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	CELA1	15	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	ELANE	34	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	MME	39	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	ANPEP	51	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	CASP3	17	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	BMP1	21	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	KLK3	78	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	CTSB	71	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	PAPA1_CARPA	81	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	CYSP_TRYCR	60	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	CTSK	40	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	CTSL	47	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	PGA	36	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	CAPNS1	70	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	HLA-DRB1	51	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	REN	34	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	MMP11	71	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	CTSS	20	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	CAPN1	91	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	CASP1	24	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	CTRC	17	49
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	CAPN2	136	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	CASP9	30	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	TPSAB1	19	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	NPR	82	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296584	GH	On-Demand	Anodyne	PSMB5	45	40
O=C(Nc1nc(CC(F)(F)F)cs1)c1cccnc1-n1cccn1	ZINC000819296585	FG	On-Demand	Anodyne	MPL	58	35
C[C@]1(C(=O)Nc2nc(CC(F)(F)F)cs2)CCN(C(=O)OCc2ccccc2)C1	ZINC000819296588	II	On-Demand	Anodyne	SLC12A5	52	35
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccnc(C(F)(F)F)c1	ZINC000819296590	FH	On-Demand	Anodyne	MPL	77	41
C[C@H](CC(=O)Nc1nc(CC(F)(F)F)cs1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819296595	IJ	On-Demand	Anodyne	GPR119	35	44
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296610	HH	On-Demand	Anodyne	PGC	42	33
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296610	HH	On-Demand	Anodyne	REN	58	39
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296610	HH	On-Demand	Anodyne	POLG_HCV1	25	43
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296610	HH	On-Demand	Anodyne	FPR1	46	36
COC(=O)c1cn(CCNC[C@@H](O)c2cccc(F)c2)nn1	ZINC000819296638	DC	On-Demand	Anodyne	ADRB1	30	46
COC(=O)c1cn(CCNC[C@@H](O)c2cccc(F)c2)nn1	ZINC000819296638	DC	On-Demand	Anodyne	ADRB3	62	46
COC(=O)c1cn(CCNC[C@H](O)c2cccc(F)c2)nn1	ZINC000819296639	DC	On-Demand	Anodyne	ADRB1	30	46
COC(=O)c1cn(CCNC[C@H](O)c2cccc(F)c2)nn1	ZINC000819296639	DC	On-Demand	Anodyne	ADRB3	62	46
COC(=O)c1cn(CCNC[C@@H](O)c2ccccc2)nn1	ZINC000819296662	CC	On-Demand	Anodyne	ADRB2	31	43
COC(=O)c1cn(CCNC[C@@H](O)c2ccccc2)nn1	ZINC000819296662	CC	On-Demand	Anodyne	ADRB1	47	39
COC(=O)c1cn(CCNC[C@@H](O)c2ccccc2)nn1	ZINC000819296662	CC	On-Demand	Anodyne	ADRB3	88	47
COC(=O)c1cn(CCNC[C@H](O)c2ccccc2)nn1	ZINC000819296663	CC	On-Demand	Anodyne	ADRB2	31	43
COC(=O)c1cn(CCNC[C@H](O)c2ccccc2)nn1	ZINC000819296663	CC	On-Demand	Anodyne	ADRB1	47	39
COC(=O)c1cn(CCNC[C@H](O)c2ccccc2)nn1	ZINC000819296663	CC	On-Demand	Anodyne	ADRB3	88	47
O=C(Cc1ccc(-n2cnnc2)cc1)NC(C1CCCC1)C1CCCC1	ZINC000819296676	FH	On-Demand	Anodyne	AVPR1A	16	40
COC(=O)c1cn(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)nn1	ZINC000819296700	FB	On-Demand	Anodyne	ADRB3	53	35
COC(=O)c1cn(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)nn1	ZINC000819296701	FB	On-Demand	Anodyne	ADRB3	53	35
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296712	HH	On-Demand	Anodyne	PGC	42	33
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296712	HH	On-Demand	Anodyne	REN	58	39
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296712	HH	On-Demand	Anodyne	POLG_HCV1	25	43
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296712	HH	On-Demand	Anodyne	FPR1	46	36
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(C2SCCS2)cc1	ZINC000819296720	GJ	On-Demand	Anodyne	MPL	61	35
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819296726	IF	On-Demand	Anodyne	Q9NAW4_PLAFA	44	53
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000819296726	IF	On-Demand	Anodyne	VHL	61	35
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(-n2ccnc2S)cc1	ZINC000819296731	GH	On-Demand	Anodyne	MPL	56	38
NS(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1F	ZINC000819296737	GE	On-Demand	Anodyne	MPL	71	37
NS(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1F	ZINC000819296737	GE	On-Demand	Anodyne	CPT1A	29	40
NS(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1F	ZINC000819296737	GE	On-Demand	Anodyne	CA4	15	41
NS(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1F	ZINC000819296737	GE	On-Demand	Anodyne	CPT1B	41	40
Cn1cc(-c2cccc(C(=O)Nc3nc(CC(F)(F)F)cs3)c2)cn1	ZINC000819296739	FH	On-Demand	Anodyne	MPL	54	36
Cn1cc(-c2cccc(C(=O)Nc3nc(CC(F)(F)F)cs3)c2)cn1	ZINC000819296739	FH	On-Demand	Anodyne	CPT1A	27	40
Cn1cc(-c2cccc(C(=O)Nc3nc(CC(F)(F)F)cs3)c2)cn1	ZINC000819296739	FH	On-Demand	Anodyne	CPT1B	34	40
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296753	GH	On-Demand	Anodyne	LGMN	50	33
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	F2	61	42
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	ACE	29	46
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	FKBP1A	46	40
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	OPRM1	30	42
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	OPRD1	16	40
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	CELA1	30	48
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	GRIN2B	15	40
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	ELANE	65	45
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	CMA1	41	38
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	CTRA_BOVIN	66	36
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	TRY1_BOVIN	98	39
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	CTSG	46	36
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	PREP	75	49
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	CELA2A	55	36
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	REN1	53	31
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	LGMN	90	51
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	KLK5	28	49
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	XIAP	40	38
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	BRCA1	61	32
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	SLC12A5	58	35
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819296754	HH	On-Demand	Anodyne	TMPRSS11D	57	35
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H](O)c1cccnc1	ZINC000819296755	DE	On-Demand	Anodyne	ADRB3	25	42
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H](O)c1cccnc1	ZINC000819296756	DE	On-Demand	Anodyne	ADRB3	25	42
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccnc(-n2ccnc2)c1	ZINC000819296758	FG	On-Demand	Anodyne	MPL	59	36
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O	ZINC000819296761	IJ	On-Demand	Anodyne	MPL	48	36
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O	ZINC000819296762	IJ	On-Demand	Anodyne	MPL	48	36
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc2cccc(Cl)c2o1	ZINC000819296763	FJ	On-Demand	Anodyne	MPL	40	35
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(-c2nnc(S)o2)cc1	ZINC000819296764	GH	On-Demand	Anodyne	MPL	53	36
O=C(Nc1nc(CC(F)(F)F)cs1)c1cnc(Cl)c(Cl)c1	ZINC000819296767	FI	On-Demand	Anodyne	MPL	78	42
Cc1cccc(C(=O)Nc2nc(CC(F)(F)F)cs2)c1NC(=O)c1ccncc1	ZINC000819296772	HI	On-Demand	Anodyne	MPL	58	41
Cc1cccc(C(=O)Nc2nc(CC(F)(F)F)cs2)c1NC(=O)c1ccncc1	ZINC000819296772	HI	On-Demand	Anodyne	GCK	17	41
Cc1cccc(C(=O)Nc2nc(CC(F)(F)F)cs2)c1NC(=O)c1ccncc1	ZINC000819296772	HI	On-Demand	Anodyne	SHH	51	39
C[C@@H](Cc1ccc(F)cc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296776	EI	On-Demand	Anodyne	MME	30	47
C[C@@H](Cc1ccc(F)cc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819296776	EI	On-Demand	Anodyne	ACE2	41	36
O=C(Nc1nc(CC(F)(F)F)cs1)c1cccc(NS(=O)(=O)C(F)(F)F)c1	ZINC000819296782	IH	On-Demand	Anodyne	MPL	66	36
O=C(Nc1nc(CC(F)(F)F)cs1)c1cccc(NS(=O)(=O)C(F)(F)F)c1	ZINC000819296782	IH	On-Demand	Anodyne	CPT1A	27	40
O=C(Nc1nc(CC(F)(F)F)cs1)c1cccc(NS(=O)(=O)C(F)(F)F)c1	ZINC000819296782	IH	On-Demand	Anodyne	CPT1B	41	38
O=C(Nc1nc(CC(F)(F)F)cs1)c1cccc(NS(=O)(=O)C(F)(F)F)c1	ZINC000819296782	IH	On-Demand	Anodyne	KCNK3	55	36
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(Cl)c2c(c1)OCCO2	ZINC000819296808	GH	On-Demand	Anodyne	CPT1A	28	47
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc2c[nH]nc2c1	ZINC000819296841	DF	On-Demand	Anodyne	ADRB2	53	38
Cc1cc(F)ccc1[C@@H](O)CNCCc1ccc2c[nH]nc2c1	ZINC000819296841	DF	On-Demand	Anodyne	ADRB1	39	43
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1F	ZINC000819296867	IH	On-Demand	Anodyne	MPL	56	37
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1F	ZINC000819296867	IH	On-Demand	Anodyne	CPT1A	31	42
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1F	ZINC000819296867	IH	On-Demand	Anodyne	CPT1B	43	40
NC(=S)c1ccc(C(=O)Nc2nc(CC(F)(F)F)cs2)cc1	ZINC000819296876	EG	On-Demand	Anodyne	MPL	59	37
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(F)c(C(F)(F)F)cc1F	ZINC000819296882	GJ	On-Demand	Mild	MPL	61	36
O=C(N[C@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296886	IJ	On-Demand	Anodyne	KLK3	51	33
O=C(N[C@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296886	IJ	On-Demand	Anodyne	CTSB	56	41
O=C(N[C@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296886	IJ	On-Demand	Anodyne	PAPA1_CARPA	51	37
O=C(N[C@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296886	IJ	On-Demand	Anodyne	CYSP_TRYCR	55	37
O=C(N[C@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296886	IJ	On-Demand	Anodyne	CTSK	32	41
O=C(N[C@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296886	IJ	On-Demand	Anodyne	CTSL	42	38
O=C(N[C@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296886	IJ	On-Demand	Anodyne	CAPNS1	58	35
O=C(N[C@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296886	IJ	On-Demand	Anodyne	MMP11	60	35
O=C(N[C@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296886	IJ	On-Demand	Anodyne	CAPN1	70	38
O=C(N[C@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296886	IJ	On-Demand	Anodyne	CAPN2	112	41
O=C(N[C@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296886	IJ	On-Demand	Anodyne	NPR	66	34
O=C(N[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296887	IJ	On-Demand	Anodyne	KLK3	51	33
O=C(N[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296887	IJ	On-Demand	Anodyne	CTSB	56	41
O=C(N[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296887	IJ	On-Demand	Anodyne	PAPA1_CARPA	51	37
O=C(N[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296887	IJ	On-Demand	Anodyne	CYSP_TRYCR	55	37
O=C(N[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296887	IJ	On-Demand	Anodyne	CTSK	32	41
O=C(N[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296887	IJ	On-Demand	Anodyne	CTSL	42	38
O=C(N[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296887	IJ	On-Demand	Anodyne	CAPNS1	58	35
O=C(N[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296887	IJ	On-Demand	Anodyne	MMP11	60	35
O=C(N[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296887	IJ	On-Demand	Anodyne	CAPN1	70	38
O=C(N[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296887	IJ	On-Demand	Anodyne	CAPN2	112	41
O=C(N[C@@H](C(=O)Nc1nc(CC(F)(F)F)cs1)c1ccccc1)OCc1ccccc1	ZINC000819296887	IJ	On-Demand	Anodyne	NPR	66	34
COC(=O)c1cn(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)nn1	ZINC000819296939	EC	On-Demand	Bother	CACNA1C	57	38
COC(=O)c1cn(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)nn1	ZINC000819296939	EC	On-Demand	Bother	ADRB3	47	38
COC(=O)c1cn(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)nn1	ZINC000819296939	EC	On-Demand	Bother	CACNA1D	84	35
COC(=O)c1cn(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)nn1	ZINC000819296940	EC	On-Demand	Bother	CACNA1C	57	38
COC(=O)c1cn(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)nn1	ZINC000819296940	EC	On-Demand	Bother	ADRB3	47	38
COC(=O)c1cn(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)nn1	ZINC000819296940	EC	On-Demand	Bother	CACNA1D	84	35
COC(=O)c1cn(CCNC[C@@H](O)c2cccnc2)nn1	ZINC000819296949	CB	On-Demand	Anodyne	ADRB2	32	46
COC(=O)c1cn(CCNC[C@@H](O)c2cccnc2)nn1	ZINC000819296949	CB	On-Demand	Anodyne	ADRB1	46	45
COC(=O)c1cn(CCNC[C@@H](O)c2cccnc2)nn1	ZINC000819296949	CB	On-Demand	Anodyne	ADRB3	128	48
COC(=O)c1cn(CCNC[C@H](O)c2cccnc2)nn1	ZINC000819296950	CB	On-Demand	Anodyne	ADRB2	32	46
COC(=O)c1cn(CCNC[C@H](O)c2cccnc2)nn1	ZINC000819296950	CB	On-Demand	Anodyne	ADRB1	46	45
COC(=O)c1cn(CCNC[C@H](O)c2cccnc2)nn1	ZINC000819296950	CB	On-Demand	Anodyne	ADRB3	128	48
CC(=O)Nc1cccc(CC(=O)NC(C2CCCC2)C2CCCC2)c1	ZINC000819296975	EI	On-Demand	Anodyne	TIMP3	60	32
CC(=O)Nc1cccc(CC(=O)NC(C2CCCC2)C2CCCC2)c1	ZINC000819296975	EI	On-Demand	Anodyne	KCNK3	47	37
Cc1cc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n(C)n1	ZINC000819296988	FD	On-Demand	Anodyne	GPR119	49	46
Cc1cc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n(C)n1	ZINC000819296989	FD	On-Demand	Anodyne	GPR119	49	46
O=C(C(F)=C1CCC1)N1CCCN(Cc2noc(C3CC3)n2)CC1	ZINC000819296994	EE	On-Demand	Anodyne	ETHR	40	34
Cc1ccccc1[C@@H](O)CNCc1cccc(N2C(=O)N[C@](C)(C3CC3)C2=O)c1	ZINC000819297051	GG	On-Demand	Anodyne	ADRB2	30	42
Cc1ccccc1[C@@H](O)CNCc1cccc(N2C(=O)N[C@@](C)(C3CC3)C2=O)c1	ZINC000819297053	GG	On-Demand	Anodyne	ADRB2	30	42
COC(=O)c1cn(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)nn1	ZINC000819297061	FD	On-Demand	Anodyne	ADRB3	21	44
COC(=O)c1cn(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)nn1	ZINC000819297062	FD	On-Demand	Anodyne	ADRB3	21	44
O[C@@H](CNCCc1ccc2c[nH]nc2c1)c1ccc(F)cn1	ZINC000819297068	DD	On-Demand	Anodyne	ADRB3	45	36
O[C@H](CNCCc1ccc2c[nH]nc2c1)c1ccc(F)cn1	ZINC000819297069	DD	On-Demand	Anodyne	ADRB3	45	36
Cc1ccccc1[C@@H](O)CNCCc1ccc2c[nH]nc2c1	ZINC000819297099	CF	On-Demand	Anodyne	ADRB2	70	39
Cc1ccccc1[C@@H](O)CNCCc1ccc2c[nH]nc2c1	ZINC000819297099	CF	On-Demand	Anodyne	ADRB1	65	43
Cc1ccccc1[C@@H](O)CNCCc1ccc2c[nH]nc2c1	ZINC000819297099	CF	On-Demand	Anodyne	ADRB3	72	39
O[C@@H](CNCCCCc1ccc(Cl)s1)c1cccnc1	ZINC000819297116	DG	On-Demand	Anodyne	ADRB2	31	46
O[C@@H](CNCCCCc1ccc(Cl)s1)c1cccnc1	ZINC000819297116	DG	On-Demand	Anodyne	ADRB1	44	44
O[C@@H](CNCCCCc1ccc(Cl)s1)c1cccnc1	ZINC000819297116	DG	On-Demand	Anodyne	ADRB3	116	47
O[C@H](CNCCCCc1ccc(Cl)s1)c1cccnc1	ZINC000819297117	DG	On-Demand	Anodyne	ADRB2	31	46
O[C@H](CNCCCCc1ccc(Cl)s1)c1cccnc1	ZINC000819297117	DG	On-Demand	Anodyne	ADRB1	44	44
O[C@H](CNCCCCc1ccc(Cl)s1)c1cccnc1	ZINC000819297117	DG	On-Demand	Anodyne	ADRB3	116	47
O[C@@H](CNCCc1ccc2c[nH]nc2c1)c1ccc(C(F)(F)F)cc1	ZINC000819297128	EG	On-Demand	Anodyne	ADRB2	37	44
O[C@@H](CNCCc1ccc2c[nH]nc2c1)c1ccc(C(F)(F)F)cc1	ZINC000819297128	EG	On-Demand	Anodyne	ADRB3	65	44
O[C@H](CNCCc1ccc2c[nH]nc2c1)c1ccc(C(F)(F)F)cc1	ZINC000819297129	EG	On-Demand	Anodyne	ADRB2	37	44
O[C@H](CNCCc1ccc2c[nH]nc2c1)c1ccc(C(F)(F)F)cc1	ZINC000819297129	EG	On-Demand	Anodyne	ADRB3	65	44
O[C@@H](CNCCc1ccc2c[nH]nc2c1)c1ccccc1C(F)(F)F	ZINC000819297150	EG	On-Demand	Anodyne	ADRB2	50	35
O[C@@H](CNCCc1ccc2c[nH]nc2c1)c1ccccc1C(F)(F)F	ZINC000819297150	EG	On-Demand	Anodyne	ADRB1	48	37
O[C@@H](CNCCc1ccc2c[nH]nc2c1)c1ccccc1C(F)(F)F	ZINC000819297150	EG	On-Demand	Anodyne	ADRB3	66	37
O[C@H](CNCCc1ccc2c[nH]nc2c1)c1ccccc1C(F)(F)F	ZINC000819297151	EG	On-Demand	Anodyne	ADRB2	50	35
O[C@H](CNCCc1ccc2c[nH]nc2c1)c1ccccc1C(F)(F)F	ZINC000819297151	EG	On-Demand	Anodyne	ADRB1	48	37
O[C@H](CNCCc1ccc2c[nH]nc2c1)c1ccccc1C(F)(F)F	ZINC000819297151	EG	On-Demand	Anodyne	ADRB3	66	37
C[C@H]1C[C@H](CCNC[C@H](O)c2cccc(F)c2)C[C@@H](C)O1	ZINC000819297162	CG	On-Demand	Anodyne	ADRB3	21	40
C[C@@H]1CC(CCNC[C@@H](O)c2cccc(F)c2)C[C@@H](C)O1	ZINC000819297163	CG	On-Demand	Anodyne	ADRB3	21	40
C[C@H]1C[C@H](CCNC[C@@H](O)c2cccc(F)c2)C[C@@H](C)O1	ZINC000819297164	CG	On-Demand	Anodyne	ADRB3	21	40
C[C@@H]1CC(CCNC[C@H](O)c2cccc(F)c2)C[C@@H](C)O1	ZINC000819297165	CG	On-Demand	Anodyne	ADRB3	21	40
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)C(=O)OC(C)(C)C	ZINC000819297182	EG	On-Demand	Anodyne	ADRB1	40	46
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)C(=O)OC(C)(C)C	ZINC000819297182	EG	On-Demand	Anodyne	ADRB3	61	45
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)C(=O)OC(C)(C)C	ZINC000819297183	EG	On-Demand	Anodyne	ADRB1	40	46
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)C(=O)OC(C)(C)C	ZINC000819297183	EG	On-Demand	Anodyne	ADRB3	61	45
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)C(=O)OC(C)(C)C	ZINC000819297184	EG	On-Demand	Anodyne	ADRB1	40	46
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)C(=O)OC(C)(C)C	ZINC000819297184	EG	On-Demand	Anodyne	ADRB3	61	45
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)C(=O)OC(C)(C)C	ZINC000819297185	EG	On-Demand	Anodyne	ADRB1	40	46
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)C(=O)OC(C)(C)C	ZINC000819297185	EG	On-Demand	Anodyne	ADRB3	61	45
C[C@H](CNC[C@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297186	EE	On-Demand	Anodyne	ADRB2	60	57
C[C@H](CNC[C@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297186	EE	On-Demand	Anodyne	ADRB1	79	46
C[C@H](CNC[C@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297186	EE	On-Demand	Anodyne	ADRB3	46	46
C[C@H](CNC[C@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297186	EE	On-Demand	Anodyne	ABCB1	25	43
C[C@H](CNC[C@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297186	EE	On-Demand	Anodyne	PDS	56	36
C[C@@H](CNC[C@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297187	EE	On-Demand	Anodyne	ADRB2	60	57
C[C@@H](CNC[C@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297187	EE	On-Demand	Anodyne	ADRB1	79	46
C[C@@H](CNC[C@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297187	EE	On-Demand	Anodyne	ADRB3	46	46
C[C@@H](CNC[C@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297187	EE	On-Demand	Anodyne	ABCB1	25	43
C[C@@H](CNC[C@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297187	EE	On-Demand	Anodyne	PDS	56	36
C[C@H](CNC[C@@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297188	EE	On-Demand	Anodyne	ADRB2	60	57
C[C@H](CNC[C@@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297188	EE	On-Demand	Anodyne	ADRB1	79	46
C[C@H](CNC[C@@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297188	EE	On-Demand	Anodyne	ADRB3	46	46
C[C@H](CNC[C@@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297188	EE	On-Demand	Anodyne	ABCB1	25	43
C[C@H](CNC[C@@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297188	EE	On-Demand	Anodyne	PDS	56	36
C[C@@H](CNC[C@@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297189	EE	On-Demand	Anodyne	ADRB2	60	57
C[C@@H](CNC[C@@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297189	EE	On-Demand	Anodyne	ADRB1	79	46
C[C@@H](CNC[C@@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297189	EE	On-Demand	Anodyne	ADRB3	46	46
C[C@@H](CNC[C@@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297189	EE	On-Demand	Anodyne	ABCB1	25	43
C[C@@H](CNC[C@@H](O)COc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297189	EE	On-Demand	Anodyne	PDS	56	36
O=[N+]([O-])c1cccc([C@H](O)CNCC2CC(c3ccccc3)C2)c1	ZINC000819297228	EG	On-Demand	Bother	CACNA1C	57	38
O=[N+]([O-])c1cccc([C@H](O)CNCC2CC(c3ccccc3)C2)c1	ZINC000819297228	EG	On-Demand	Bother	CACNA1D	83	38
O=[N+]([O-])c1cccc([C@@H](O)CNCC2CC(c3ccccc3)C2)c1	ZINC000819297229	EG	On-Demand	Bother	CACNA1C	57	38
O=[N+]([O-])c1cccc([C@@H](O)CNCC2CC(c3ccccc3)C2)c1	ZINC000819297229	EG	On-Demand	Bother	CACNA1D	83	38
Cc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)n(C)n1	ZINC000819297276	CD	On-Demand	Bother	CACNA1C	43	35
Cc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)n(C)n1	ZINC000819297276	CD	On-Demand	Bother	CACNA1D	64	35
Cc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)n(C)n1	ZINC000819297277	CD	On-Demand	Bother	CACNA1C	43	35
Cc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)n(C)n1	ZINC000819297277	CD	On-Demand	Bother	CACNA1D	64	35
COc1ccc(OC)c([C@H](O)CNCCc2ccc3c[nH]nc3c2)c1	ZINC000819297284	EE	On-Demand	Anodyne	ADRB2	53	51
COc1ccc(OC)c([C@H](O)CNCCc2ccc3c[nH]nc3c2)c1	ZINC000819297284	EE	On-Demand	Anodyne	ADRB1	45	45
COc1ccc(OC)c([C@H](O)CNCCc2ccc3c[nH]nc3c2)c1	ZINC000819297284	EE	On-Demand	Anodyne	ADRB3	34	41
COC(=O)c1cn(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)nn1	ZINC000819297302	FD	On-Demand	Anodyne	ADRB3	49	37
COC(=O)c1cn(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)nn1	ZINC000819297303	FD	On-Demand	Anodyne	ADRB3	49	37
O[C@@H](CNCCc1ccc2c[nH]nc2c1)c1ccc(OC(F)(F)F)cc1	ZINC000819297354	FG	On-Demand	Anodyne	ADRB2	49	44
O[C@@H](CNCCc1ccc2c[nH]nc2c1)c1ccc(OC(F)(F)F)cc1	ZINC000819297354	FG	On-Demand	Anodyne	ADRB1	47	37
O[C@@H](CNCCc1ccc2c[nH]nc2c1)c1ccc(OC(F)(F)F)cc1	ZINC000819297354	FG	On-Demand	Anodyne	ADRB3	73	45
O[C@H](CNCCc1ccc2c[nH]nc2c1)c1ccc(OC(F)(F)F)cc1	ZINC000819297355	FG	On-Demand	Anodyne	ADRB2	49	44
O[C@H](CNCCc1ccc2c[nH]nc2c1)c1ccc(OC(F)(F)F)cc1	ZINC000819297355	FG	On-Demand	Anodyne	ADRB1	47	37
O[C@H](CNCCc1ccc2c[nH]nc2c1)c1ccc(OC(F)(F)F)cc1	ZINC000819297355	FG	On-Demand	Anodyne	ADRB3	73	45
O=C(NC[C@@H]1CCc2ccccc2C1)C(F)=C1CCC1	ZINC000819297372	CG	On-Demand	Anodyne	PREP	26	40
O=C(NC[C@H]1CCc2ccccc2C1)C(F)=C1CCC1	ZINC000819297373	CG	On-Demand	Anodyne	PREP	26	40
C[C@H](CNC[C@H](O)c1cccc(F)c1)N(C)C(=O)OC(C)(C)C	ZINC000819297389	EF	On-Demand	Anodyne	ADRB1	21	42
C[C@H](CNC[C@H](O)c1cccc(F)c1)N(C)C(=O)OC(C)(C)C	ZINC000819297389	EF	On-Demand	Anodyne	ADRB3	29	42
C[C@H](CNC[C@@H](O)c1cccc(F)c1)N(C)C(=O)OC(C)(C)C	ZINC000819297390	EF	On-Demand	Anodyne	ADRB1	21	42
C[C@H](CNC[C@@H](O)c1cccc(F)c1)N(C)C(=O)OC(C)(C)C	ZINC000819297390	EF	On-Demand	Anodyne	ADRB3	29	42
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)N(C)C(=O)OC(C)(C)C	ZINC000819297391	EF	On-Demand	Anodyne	ADRB1	21	42
C[C@@H](CNC[C@@H](O)c1cccc(F)c1)N(C)C(=O)OC(C)(C)C	ZINC000819297391	EF	On-Demand	Anodyne	ADRB3	29	42
C[C@@H](CNC[C@H](O)c1cccc(F)c1)N(C)C(=O)OC(C)(C)C	ZINC000819297392	EF	On-Demand	Anodyne	ADRB1	21	42
C[C@@H](CNC[C@H](O)c1cccc(F)c1)N(C)C(=O)OC(C)(C)C	ZINC000819297392	EF	On-Demand	Anodyne	ADRB3	29	42
C[C@@H](CNCCC(=O)Nc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297393	EF	On-Demand	Anodyne	LTA4H	29	43
C[C@H](CNCCC(=O)Nc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297394	EF	On-Demand	Anodyne	LTA4H	29	43
C[C@H](CNC[C@@H](O)COc1ccc(C#N)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297399	FE	On-Demand	Mild	ADRB2	37	42
C[C@H](CNC[C@@H](O)COc1ccc(C#N)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297399	FE	On-Demand	Mild	ADRB1	56	36
C[C@@H](CNC[C@@H](O)COc1ccc(C#N)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297400	FE	On-Demand	Mild	ADRB2	37	42
C[C@@H](CNC[C@@H](O)COc1ccc(C#N)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297400	FE	On-Demand	Mild	ADRB1	56	36
C[C@@H](CNC[C@H](O)COc1ccc(C#N)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297401	FE	On-Demand	Mild	ADRB2	37	42
C[C@@H](CNC[C@H](O)COc1ccc(C#N)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297401	FE	On-Demand	Mild	ADRB1	56	36
C[C@H](CNC[C@H](O)COc1ccc(C#N)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297402	FE	On-Demand	Mild	ADRB2	37	42
C[C@H](CNC[C@H](O)COc1ccc(C#N)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297402	FE	On-Demand	Mild	ADRB1	56	36
C[C@@H](CNC[C@@H](O)c1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297407	DF	On-Demand	Anodyne	ADRB3	41	39
C[C@H](CNC[C@H](O)c1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297408	DF	On-Demand	Anodyne	ADRB3	41	39
C[C@H](CNC[C@@H](O)c1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297409	DF	On-Demand	Anodyne	ADRB3	41	39
C[C@@H](CNC[C@H](O)c1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297410	DF	On-Demand	Anodyne	ADRB3	41	39
COC(=O)N(C)Cc1ccc(NC(=O)C[S@@](=O)c2cccc(OC)c2)cc1	ZINC000819297415	GF	On-Demand	Anodyne	LTA4H	28	41
COC(=O)N(C)Cc1ccc(NC(=O)C[S@@](=O)c2cccc(OC)c2)cc1	ZINC000819297415	GF	On-Demand	Anodyne	MTNR1A	23	47
COC(=O)N(C)Cc1ccc(NC(=O)C[S@@](=O)c2cccc(OC)c2)cc1	ZINC000819297415	GF	On-Demand	Anodyne	MTNR1B	30	47
COC(=O)N(C)Cc1ccc(NC(=O)C[S@@](=O)c2cccc(OC)c2)cc1	ZINC000819297415	GF	On-Demand	Anodyne	ROCK2	20	43
COC(=O)N(C)Cc1ccc(NC(=O)C[S@](=O)c2cccc(OC)c2)cc1	ZINC000819297416	GF	On-Demand	Anodyne	LTA4H	28	41
COC(=O)N(C)Cc1ccc(NC(=O)C[S@](=O)c2cccc(OC)c2)cc1	ZINC000819297416	GF	On-Demand	Anodyne	MTNR1A	23	47
COC(=O)N(C)Cc1ccc(NC(=O)C[S@](=O)c2cccc(OC)c2)cc1	ZINC000819297416	GF	On-Demand	Anodyne	MTNR1B	30	47
COC(=O)N(C)Cc1ccc(NC(=O)C[S@](=O)c2cccc(OC)c2)cc1	ZINC000819297416	GF	On-Demand	Anodyne	ROCK2	20	43
C[C@@H](CNC[C@H](O)c1ccc(C#N)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297425	EE	On-Demand	Mild	CTRB_BOVIN	45	32
C[C@H](CNC[C@H](O)c1ccc(C#N)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297426	EE	On-Demand	Mild	CTRB_BOVIN	45	32
C[C@H](CNC[C@@H](O)c1ccc(C#N)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297427	EE	On-Demand	Mild	CTRB_BOVIN	45	32
C[C@@H](CNC[C@@H](O)c1ccc(C#N)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297428	EE	On-Demand	Mild	CTRB_BOVIN	45	32
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2CC(c3ccccc3)C2)CC1	ZINC000819297441	GH	On-Demand	Anodyne	GRIN2B	19	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2CC(c3ccccc3)C2)CC1	ZINC000819297441	GH	On-Demand	Anodyne	CCR8	19	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2CC(c3ccccc3)C2)CC1	ZINC000819297441	GH	On-Demand	Anodyne	GPR119	49	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2CC(c3ccccc3)C2)CC1	ZINC000819297441	GH	On-Demand	Anodyne	SFRP1	19	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2CC(c3ccccc3)C2)CC1	ZINC000819297442	GH	On-Demand	Anodyne	GRIN2B	19	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2CC(c3ccccc3)C2)CC1	ZINC000819297442	GH	On-Demand	Anodyne	CCR8	19	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2CC(c3ccccc3)C2)CC1	ZINC000819297442	GH	On-Demand	Anodyne	GPR119	49	51
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2CC(c3ccccc3)C2)CC1	ZINC000819297442	GH	On-Demand	Anodyne	SFRP1	19	41
O[C@@H](CNCCc1ccc2c[nH]nc2c1)c1cccnc1	ZINC000819297460	CD	On-Demand	Anodyne	ADRB2	64	53
O[C@@H](CNCCc1ccc2c[nH]nc2c1)c1cccnc1	ZINC000819297460	CD	On-Demand	Anodyne	ADRB1	72	51
O[C@@H](CNCCc1ccc2c[nH]nc2c1)c1cccnc1	ZINC000819297460	CD	On-Demand	Anodyne	ADRB3	164	53
O[C@@H](CNCCc1ccc2c[nH]nc2c1)c1cccnc1	ZINC000819297460	CD	On-Demand	Anodyne	CYP51A1	16	41
O[C@H](CNCCc1ccc2c[nH]nc2c1)c1cccnc1	ZINC000819297461	CD	On-Demand	Anodyne	ADRB2	64	53
O[C@H](CNCCc1ccc2c[nH]nc2c1)c1cccnc1	ZINC000819297461	CD	On-Demand	Anodyne	ADRB1	72	51
O[C@H](CNCCc1ccc2c[nH]nc2c1)c1cccnc1	ZINC000819297461	CD	On-Demand	Anodyne	ADRB3	164	53
O[C@H](CNCCc1ccc2c[nH]nc2c1)c1cccnc1	ZINC000819297461	CD	On-Demand	Anodyne	CYP51A1	16	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCc2ccc3c[nH]nc3c2)CC1	ZINC000819297493	GF	On-Demand	Anodyne	GPR119	41	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCc2ccc3c[nH]nc3c2)CC1	ZINC000819297494	GF	On-Demand	Anodyne	GPR119	41	42
Cc1cc(CNC[C@H](O)c2ccc(F)cc2Cl)n(C)n1	ZINC000819297534	CE	On-Demand	Anodyne	P2RX7	25	51
C[C@@H](CNC[C@H](O)COc1ccccc1Cl)N(C)C(=O)OC(C)(C)C	ZINC000819297535	FF	On-Demand	Anodyne	ADRB2	32	54
C[C@@H](CNC[C@H](O)COc1ccccc1Cl)N(C)C(=O)OC(C)(C)C	ZINC000819297535	FF	On-Demand	Anodyne	ADRB1	57	35
Cc1cc(CNC[C@@H](O)c2ccc(F)cc2Cl)n(C)n1	ZINC000819297536	CE	On-Demand	Anodyne	P2RX7	25	51
C[C@H](CNC[C@H](O)COc1ccccc1Cl)N(C)C(=O)OC(C)(C)C	ZINC000819297537	FF	On-Demand	Anodyne	ADRB2	32	54
C[C@H](CNC[C@H](O)COc1ccccc1Cl)N(C)C(=O)OC(C)(C)C	ZINC000819297537	FF	On-Demand	Anodyne	ADRB1	57	35
C[C@@H](CNC[C@@H](O)COc1ccccc1Cl)N(C)C(=O)OC(C)(C)C	ZINC000819297539	FF	On-Demand	Anodyne	ADRB2	32	54
C[C@@H](CNC[C@@H](O)COc1ccccc1Cl)N(C)C(=O)OC(C)(C)C	ZINC000819297539	FF	On-Demand	Anodyne	ADRB1	57	35
C[C@H](CNC[C@@H](O)COc1ccccc1Cl)N(C)C(=O)OC(C)(C)C	ZINC000819297541	FF	On-Demand	Anodyne	ADRB2	32	54
C[C@H](CNC[C@@H](O)COc1ccccc1Cl)N(C)C(=O)OC(C)(C)C	ZINC000819297541	FF	On-Demand	Anodyne	ADRB1	57	35
O=C(NC1CCN(S(=O)(=O)Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819297555	FF	On-Demand	Anodyne	PTPN2	43	38
O=C(NC1CCN(S(=O)(=O)Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819297555	FF	On-Demand	Anodyne	SIGMAR1	19	49
O=C(NC1CCN(S(=O)(=O)Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819297555	FF	On-Demand	Anodyne	EPHX2	25	41
COC(=O)c1cn(CCNC[C@H](O)c2ccc(Cl)cc2)nn1	ZINC000819297562	DD	On-Demand	Anodyne	ADRB1	21	42
COC(=O)c1cn(CCNC[C@H](O)c2ccc(Cl)cc2)nn1	ZINC000819297562	DD	On-Demand	Anodyne	ADRB3	33	42
C[C@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297582	DE	On-Demand	Anodyne	MME	77	38
C[C@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297582	DE	On-Demand	Anodyne	PAPA1_CARPA	67	44
C[C@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297582	DE	On-Demand	Anodyne	CTSK	18	49
C[C@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297582	DE	On-Demand	Anodyne	CTSL	25	44
C[C@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297582	DE	On-Demand	Anodyne	CAPNS1	61	34
C[C@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297582	DE	On-Demand	Anodyne	REN	56	40
C[C@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297582	DE	On-Demand	Anodyne	CAPN1	70	40
C[C@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297582	DE	On-Demand	Anodyne	CAPN2	58	34
C[C@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297582	DE	On-Demand	Anodyne	ACE2	53	38
C[C@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297582	DE	On-Demand	Anodyne	FPR1	62	41
C[C@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297582	DE	On-Demand	Anodyne	NPR	45	35
C[C@@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297584	DE	On-Demand	Anodyne	MME	77	38
C[C@@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297584	DE	On-Demand	Anodyne	PAPA1_CARPA	67	44
C[C@@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297584	DE	On-Demand	Anodyne	CTSK	18	49
C[C@@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297584	DE	On-Demand	Anodyne	CTSL	25	44
C[C@@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297584	DE	On-Demand	Anodyne	CAPNS1	61	34
C[C@@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297584	DE	On-Demand	Anodyne	REN	56	40
C[C@@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297584	DE	On-Demand	Anodyne	CAPN1	70	40
C[C@@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297584	DE	On-Demand	Anodyne	CAPN2	58	34
C[C@@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297584	DE	On-Demand	Anodyne	ACE2	53	38
C[C@@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297584	DE	On-Demand	Anodyne	FPR1	62	41
C[C@@H](CNC[C@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297584	DE	On-Demand	Anodyne	NPR	45	35
C[C@@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297585	DE	On-Demand	Anodyne	MME	77	38
C[C@@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297585	DE	On-Demand	Anodyne	PAPA1_CARPA	67	44
C[C@@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297585	DE	On-Demand	Anodyne	CTSK	18	49
C[C@@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297585	DE	On-Demand	Anodyne	CTSL	25	44
C[C@@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297585	DE	On-Demand	Anodyne	CAPNS1	61	34
C[C@@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297585	DE	On-Demand	Anodyne	REN	56	40
C[C@@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297585	DE	On-Demand	Anodyne	CAPN1	70	40
C[C@@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297585	DE	On-Demand	Anodyne	CAPN2	58	34
C[C@@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297585	DE	On-Demand	Anodyne	ACE2	53	38
C[C@@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297585	DE	On-Demand	Anodyne	FPR1	62	41
C[C@@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297585	DE	On-Demand	Anodyne	NPR	45	35
C[C@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297587	DE	On-Demand	Anodyne	MME	77	38
C[C@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297587	DE	On-Demand	Anodyne	PAPA1_CARPA	67	44
C[C@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297587	DE	On-Demand	Anodyne	CTSK	18	49
C[C@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297587	DE	On-Demand	Anodyne	CTSL	25	44
C[C@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297587	DE	On-Demand	Anodyne	CAPNS1	61	34
C[C@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297587	DE	On-Demand	Anodyne	REN	56	40
C[C@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297587	DE	On-Demand	Anodyne	CAPN1	70	40
C[C@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297587	DE	On-Demand	Anodyne	CAPN2	58	34
C[C@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297587	DE	On-Demand	Anodyne	ACE2	53	38
C[C@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297587	DE	On-Demand	Anodyne	FPR1	62	41
C[C@H](CNC[C@@H](O)Cc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297587	DE	On-Demand	Anodyne	NPR	45	35
C[C@@H](CNC[C@@H](O)Cc1ccc(F)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297645	EF	On-Demand	Anodyne	PAPA1_CARPA	19	43
C[C@@H](CNC[C@@H](O)Cc1ccc(F)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297645	EF	On-Demand	Anodyne	NPY5R	15	41
C[C@H](CNC[C@@H](O)Cc1ccc(F)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297646	EF	On-Demand	Anodyne	PAPA1_CARPA	19	43
C[C@H](CNC[C@@H](O)Cc1ccc(F)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297646	EF	On-Demand	Anodyne	NPY5R	15	41
C[C@H](CNC[C@H](O)Cc1ccc(F)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297647	EF	On-Demand	Anodyne	PAPA1_CARPA	19	43
C[C@H](CNC[C@H](O)Cc1ccc(F)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297647	EF	On-Demand	Anodyne	NPY5R	15	41
C[C@@H](CNC[C@H](O)Cc1ccc(F)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297648	EF	On-Demand	Anodyne	PAPA1_CARPA	19	43
C[C@@H](CNC[C@H](O)Cc1ccc(F)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819297648	EF	On-Demand	Anodyne	NPY5R	15	41
COc1cccc([S@@](=O)CC(=O)Oc2ccc(OC(C)C)cc2)c1	ZINC000819297649	EG	On-Demand	Anodyne	MTNR1A	29	42
COc1cccc([S@@](=O)CC(=O)Oc2ccc(OC(C)C)cc2)c1	ZINC000819297649	EG	On-Demand	Anodyne	MTNR1B	29	42
COC(=O)c1cn(CCNC[C@H](O)c2cc(OC)ccc2OC)nn1	ZINC000819297705	FC	On-Demand	Anodyne	ADRB2	17	45
COC(=O)c1cn(CCNC[C@@H](O)c2cc(OC)ccc2OC)nn1	ZINC000819297706	FC	On-Demand	Anodyne	ADRB2	17	45
O=C(/C=C\[C@H]1CCCO1)N1CCCN(Cc2noc(C3CC3)n2)CC1	ZINC000819297721	ED	On-Demand	Anodyne	ETHR	46	33
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(Cc2noc(C3CC3)n2)CC1	ZINC000819297722	ED	On-Demand	Anodyne	ETHR	46	33
O=C(/C=C/[C@H]1CCCO1)N1CCCN(Cc2noc(C3CC3)n2)CC1	ZINC000819297723	ED	On-Demand	Anodyne	ETHR	46	33
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(Cc2noc(C3CC3)n2)CC1	ZINC000819297724	ED	On-Demand	Anodyne	ETHR	46	33
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819297729	GD	On-Demand	Anodyne	SIGMAR1	15	45
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819297729	GD	On-Demand	Anodyne	TGM2	37	43
O=C(/C=C\[C@H]1CCCO1)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819297730	GD	On-Demand	Anodyne	SIGMAR1	15	45
O=C(/C=C\[C@H]1CCCO1)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819297730	GD	On-Demand	Anodyne	TGM2	37	43
O=C(/C=C/[C@H]1CCCO1)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819297731	GD	On-Demand	Anodyne	SIGMAR1	15	45
O=C(/C=C/[C@H]1CCCO1)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819297731	GD	On-Demand	Anodyne	TGM2	37	43
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819297732	GD	On-Demand	Anodyne	SIGMAR1	15	45
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819297732	GD	On-Demand	Anodyne	TGM2	37	43
Cc1cc(CNC[C@@H](O)c2cccnc2)n(C)n1	ZINC000819297740	BC	On-Demand	Anodyne	ADRB2	22	41
Cc1cc(CNC[C@@H](O)c2cccnc2)n(C)n1	ZINC000819297740	BC	On-Demand	Anodyne	ADRB1	23	41
Cc1cc(CNC[C@@H](O)c2cccnc2)n(C)n1	ZINC000819297740	BC	On-Demand	Anodyne	ADRB3	90	48
Cc1cc(CNC[C@H](O)c2cccnc2)n(C)n1	ZINC000819297741	BC	On-Demand	Anodyne	ADRB2	22	41
Cc1cc(CNC[C@H](O)c2cccnc2)n(C)n1	ZINC000819297741	BC	On-Demand	Anodyne	ADRB1	23	41
Cc1cc(CNC[C@H](O)c2cccnc2)n(C)n1	ZINC000819297741	BC	On-Demand	Anodyne	ADRB3	90	48
C[C@@H](CNC[C@H](O)CCc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297763	EF	On-Demand	Anodyne	CTSK	19	48
C[C@@H](CNC[C@H](O)CCc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297763	EF	On-Demand	Anodyne	FPR1	43	36
C[C@H](CNC[C@H](O)CCc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297764	EF	On-Demand	Anodyne	CTSK	19	48
C[C@H](CNC[C@H](O)CCc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297764	EF	On-Demand	Anodyne	FPR1	43	36
C[C@@H](CNC[C@@H](O)CCc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297765	EF	On-Demand	Anodyne	CTSK	19	48
C[C@@H](CNC[C@@H](O)CCc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297765	EF	On-Demand	Anodyne	FPR1	43	36
C[C@H](CNC[C@@H](O)CCc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297767	EF	On-Demand	Anodyne	CTSK	19	48
C[C@H](CNC[C@@H](O)CCc1ccccc1)N(C)C(=O)OC(C)(C)C	ZINC000819297767	EF	On-Demand	Anodyne	FPR1	43	36
C[C@H](CNCCC(=O)Nc1ccccc1[N+](=O)[O-])N(C)C(=O)OC(C)(C)C	ZINC000819297802	GF	On-Demand	Bother	COLA	111	39
C[C@@H](CNCCC(=O)Nc1ccccc1[N+](=O)[O-])N(C)C(=O)OC(C)(C)C	ZINC000819297803	GF	On-Demand	Bother	COLA	111	39
C[C@@H](CNC[C@H](O)CC1CCCC1)N(C)C(=O)OC(C)(C)C	ZINC000819297816	DF	On-Demand	Anodyne	ECE1	25	42
C[C@@H](CNC[C@H](O)CC1CCCC1)N(C)C(=O)OC(C)(C)C	ZINC000819297816	DF	On-Demand	Anodyne	REN	27	42
C[C@H](CNC[C@@H](O)CC1CCCC1)N(C)C(=O)OC(C)(C)C	ZINC000819297817	DF	On-Demand	Anodyne	ECE1	25	42
C[C@H](CNC[C@@H](O)CC1CCCC1)N(C)C(=O)OC(C)(C)C	ZINC000819297817	DF	On-Demand	Anodyne	REN	27	42
C[C@H](CNC[C@H](O)CC1CCCC1)N(C)C(=O)OC(C)(C)C	ZINC000819297818	DF	On-Demand	Anodyne	ECE1	25	42
C[C@H](CNC[C@H](O)CC1CCCC1)N(C)C(=O)OC(C)(C)C	ZINC000819297818	DF	On-Demand	Anodyne	REN	27	42
C[C@@H](CNC[C@@H](O)CC1CCCC1)N(C)C(=O)OC(C)(C)C	ZINC000819297819	DF	On-Demand	Anodyne	ECE1	25	42
C[C@@H](CNC[C@@H](O)CC1CCCC1)N(C)C(=O)OC(C)(C)C	ZINC000819297819	DF	On-Demand	Anodyne	REN	27	42
O[C@H](CNCC1CC(c2ccccc2)C1)c1c(F)cccc1F	ZINC000819297828	DH	On-Demand	Anodyne	SLC18A3	19	42
O[C@@H](CNCC1CC(c2ccccc2)C1)c1c(F)cccc1F	ZINC000819297829	DH	On-Demand	Anodyne	SLC18A3	19	42
O[C@@H](CNCCCCc1ccc(Cl)s1)c1ccccc1	ZINC000819297832	DI	On-Demand	Anodyne	ADRB2	46	42
O[C@@H](CNCCCCc1ccc(Cl)s1)c1ccccc1	ZINC000819297832	DI	On-Demand	Anodyne	ADRB1	48	42
O[C@@H](CNCCCCc1ccc(Cl)s1)c1ccccc1	ZINC000819297832	DI	On-Demand	Anodyne	ADRB3	51	42
O[C@H](CNCCCCc1ccc(Cl)s1)c1ccccc1	ZINC000819297833	DI	On-Demand	Anodyne	ADRB2	46	42
O[C@H](CNCCCCc1ccc(Cl)s1)c1ccccc1	ZINC000819297833	DI	On-Demand	Anodyne	ADRB1	48	42
O[C@H](CNCCCCc1ccc(Cl)s1)c1ccccc1	ZINC000819297833	DI	On-Demand	Anodyne	ADRB3	51	42
COC(=O)c1cn(CCNC[C@@H](O)c2cccc(Br)c2)nn1	ZINC000819297836	FD	On-Demand	Anodyne	ADRB3	58	38
COC(=O)c1cn(CCNC[C@H](O)c2cccc(Br)c2)nn1	ZINC000819297837	FD	On-Demand	Anodyne	ADRB3	58	38
O[C@@H](CNCCc1ccc2c[nH]nc2c1)c1cccc(C(F)(F)F)c1	ZINC000819297838	EG	On-Demand	Anodyne	ADRB2	50	42
O[C@@H](CNCCc1ccc2c[nH]nc2c1)c1cccc(C(F)(F)F)c1	ZINC000819297838	EG	On-Demand	Anodyne	ADRB1	48	40
O[C@@H](CNCCc1ccc2c[nH]nc2c1)c1cccc(C(F)(F)F)c1	ZINC000819297838	EG	On-Demand	Anodyne	ADRB3	97	42
O[C@H](CNCCc1ccc2c[nH]nc2c1)c1cccc(C(F)(F)F)c1	ZINC000819297839	EG	On-Demand	Anodyne	ADRB2	50	42
O[C@H](CNCCc1ccc2c[nH]nc2c1)c1cccc(C(F)(F)F)c1	ZINC000819297839	EG	On-Demand	Anodyne	ADRB1	48	40
O[C@H](CNCCc1ccc2c[nH]nc2c1)c1cccc(C(F)(F)F)c1	ZINC000819297839	EG	On-Demand	Anodyne	ADRB3	97	42
C[C@H](CNC[C@H](O)CN1CCc2ccccc2C1)N(C)C(=O)OC(C)(C)C	ZINC000819297869	GE	On-Demand	Anodyne	NOD2	41	36
C[C@@H](CNC[C@H](O)CN1CCc2ccccc2C1)N(C)C(=O)OC(C)(C)C	ZINC000819297870	GE	On-Demand	Anodyne	NOD2	41	36
C[C@@H](CNC[C@@H](O)CN1CCc2ccccc2C1)N(C)C(=O)OC(C)(C)C	ZINC000819297871	GE	On-Demand	Anodyne	NOD2	41	36
C[C@H](CNC[C@@H](O)CN1CCc2ccccc2C1)N(C)C(=O)OC(C)(C)C	ZINC000819297872	GE	On-Demand	Anodyne	NOD2	41	36
C[C@H](CNC[C@H](O)COc1cccc2[nH]ccc12)N(C)C(=O)OC(C)(C)C	ZINC000819297893	GF	On-Demand	Anodyne	ADRB2	25	60
C[C@H](CNC[C@H](O)COc1cccc2[nH]ccc12)N(C)C(=O)OC(C)(C)C	ZINC000819297893	GF	On-Demand	Anodyne	ADRB1	41	60
C[C@@H](CNC[C@H](O)COc1cccc2[nH]ccc12)N(C)C(=O)OC(C)(C)C	ZINC000819297894	GF	On-Demand	Anodyne	ADRB2	25	60
C[C@@H](CNC[C@H](O)COc1cccc2[nH]ccc12)N(C)C(=O)OC(C)(C)C	ZINC000819297894	GF	On-Demand	Anodyne	ADRB1	41	60
C[C@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)N(C)C(=O)OC(C)(C)C	ZINC000819297895	GF	On-Demand	Anodyne	ADRB2	25	60
C[C@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)N(C)C(=O)OC(C)(C)C	ZINC000819297895	GF	On-Demand	Anodyne	ADRB1	41	60
COC(=O)c1cn(CCNC[C@@H](O)c2cccc(Cl)c2)nn1	ZINC000819297921	DD	On-Demand	Anodyne	ADRB2	44	39
COC(=O)c1cn(CCNC[C@@H](O)c2cccc(Cl)c2)nn1	ZINC000819297921	DD	On-Demand	Anodyne	ADRB1	58	50
COC(=O)c1cn(CCNC[C@@H](O)c2cccc(Cl)c2)nn1	ZINC000819297921	DD	On-Demand	Anodyne	ADRB3	91	50
COC(=O)c1cn(CCNC[C@H](O)c2cccc(Cl)c2)nn1	ZINC000819297922	DD	On-Demand	Anodyne	ADRB2	44	39
COC(=O)c1cn(CCNC[C@H](O)c2cccc(Cl)c2)nn1	ZINC000819297922	DD	On-Demand	Anodyne	ADRB1	58	50
COC(=O)c1cn(CCNC[C@H](O)c2cccc(Cl)c2)nn1	ZINC000819297922	DD	On-Demand	Anodyne	ADRB3	91	50
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCc2ccc(Cl)s2)c1	ZINC000819297957	FH	On-Demand	Bother	ADRB1	43	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCc2ccc(Cl)s2)c1	ZINC000819297957	FH	On-Demand	Bother	ADRB3	44	41
O=[N+]([O-])c1cccc([C@H](O)CNCCCCc2ccc(Cl)s2)c1	ZINC000819297958	FH	On-Demand	Bother	ADRB1	43	41
O=[N+]([O-])c1cccc([C@H](O)CNCCCCc2ccc(Cl)s2)c1	ZINC000819297958	FH	On-Demand	Bother	ADRB3	44	41
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc3c[nH]nc3c2)cc1	ZINC000819297959	FD	On-Demand	Anodyne	ADRB2	76	44
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc3c[nH]nc3c2)cc1	ZINC000819297959	FD	On-Demand	Anodyne	ADRB1	70	40
CS(=O)(=O)c1ccc([C@H](O)CNCCc2ccc3c[nH]nc3c2)cc1	ZINC000819297959	FD	On-Demand	Anodyne	ADRB3	143	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc3c[nH]nc3c2)cc1	ZINC000819297960	FD	On-Demand	Anodyne	ADRB2	76	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc3c[nH]nc3c2)cc1	ZINC000819297960	FD	On-Demand	Anodyne	ADRB1	70	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2ccc3c[nH]nc3c2)cc1	ZINC000819297960	FD	On-Demand	Anodyne	ADRB3	143	41
COC(=O)c1cn(CCNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)nn1	ZINC000819297975	GC	On-Demand	Anodyne	GPR119	29	41
COC(=O)c1cn(CCNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)nn1	ZINC000819297976	GC	On-Demand	Anodyne	GPR119	29	41
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n(C)n1	ZINC000819297996	GE	On-Demand	Anodyne	CTSD	79	41
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n(C)n1	ZINC000819297996	GE	On-Demand	Anodyne	PGC	55	37
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n(C)n1	ZINC000819297996	GE	On-Demand	Anodyne	PAPA1_CARPA	29	42
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n(C)n1	ZINC000819297996	GE	On-Demand	Anodyne	BACE2	52	39
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n(C)n1	ZINC000819297996	GE	On-Demand	Anodyne	REN	74	46
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n(C)n1	ZINC000819297996	GE	On-Demand	Anodyne	REN1	17	43
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n(C)n1	ZINC000819297996	GE	On-Demand	Anodyne	BACE1	84	42
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n(C)n1	ZINC000819297996	GE	On-Demand	Anodyne	FPR1	46	39
O[C@H](CNCCC1(O)CCC1)c1cccnc1	ZINC000819298003	BD	On-Demand	Anodyne	ADRB2	28	46
O[C@H](CNCCC1(O)CCC1)c1cccnc1	ZINC000819298003	BD	On-Demand	Anodyne	ADRB1	30	46
O[C@H](CNCCC1(O)CCC1)c1cccnc1	ZINC000819298003	BD	On-Demand	Anodyne	ADRB3	107	48
O[C@@H](CNCCC1(O)CCC1)c1cccnc1	ZINC000819298004	BD	On-Demand	Anodyne	ADRB2	28	46
O[C@@H](CNCCC1(O)CCC1)c1cccnc1	ZINC000819298004	BD	On-Demand	Anodyne	ADRB1	30	46
O[C@@H](CNCCC1(O)CCC1)c1cccnc1	ZINC000819298004	BD	On-Demand	Anodyne	ADRB3	107	48
C[C@@H]1C[C@H]1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819298040	EE	On-Demand	Anodyne	CTSD	129	46
C[C@@H]1C[C@H]1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819298040	EE	On-Demand	Anodyne	PGC	65	43
C[C@@H]1C[C@H]1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819298040	EE	On-Demand	Anodyne	CMA1	31	40
C[C@@H]1C[C@H]1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819298040	EE	On-Demand	Anodyne	CTRA_BOVIN	19	40
C[C@@H]1C[C@H]1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819298040	EE	On-Demand	Anodyne	PAPA1_CARPA	46	47
C[C@@H]1C[C@H]1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819298040	EE	On-Demand	Anodyne	CCKAR	62	41
C[C@@H]1C[C@H]1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819298040	EE	On-Demand	Anodyne	CTSK	22	51
C[C@@H]1C[C@H]1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819298040	EE	On-Demand	Anodyne	CTSL	23	47
C[C@@H]1C[C@H]1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819298040	EE	On-Demand	Anodyne	PGA	58	44
C[C@@H]1C[C@H]1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819298040	EE	On-Demand	Anodyne	BACE2	60	46
C[C@@H]1C[C@H]1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819298040	EE	On-Demand	Anodyne	TACR3	17	42
C[C@@H]1C[C@H]1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819298040	EE	On-Demand	Anodyne	CAPNS1	50	30
C[C@@H]1C[C@H]1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819298040	EE	On-Demand	Anodyne	REN	101	51
C[C@@H]1C[C@H]1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819298040	EE	On-Demand	Anodyne	REN1	38	51
C[C@@H]1C[C@H]1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819298040	EE	On-Demand	Anodyne	CAPN1	37	42
C[C@@H]1C[C@H]1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819298040	EE	On-Demand	Anodyne	BACE1	101	46
C[C@@H]1C[C@H]1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819298040	EE	On-Demand	Anodyne	FPR1	64	45
C[C@@H]1C[C@H]1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819298040	EE	On-Demand	Anodyne	PLM1_PLAFA	36	44
C[C@@H]1C[C@H]1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819298040	EE	On-Demand	Anodyne	PLM2_PLAFA	51	34
C[C@@H]1C[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819298047	AD	On-Demand	Anodyne	ADRB1	21	43
C[C@@H]1C[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819298047	AD	On-Demand	Anodyne	ADRB3	80	44
C[C@@H]1C[C@H]1NC[C@H](O)c1cccnc1	ZINC000819298048	AD	On-Demand	Anodyne	ADRB1	21	43
C[C@@H]1C[C@H]1NC[C@H](O)c1cccnc1	ZINC000819298048	AD	On-Demand	Anodyne	ADRB3	80	44
COC[C@@H](NC(=O)C(F)=C1CCC1)c1cccc(C(F)(F)F)c1	ZINC000819298059	EH	On-Demand	Anodyne	PDS	41	35
COC[C@H](NC(=O)C(F)=C1CCC1)c1cccc(C(F)(F)F)c1	ZINC000819298060	EH	On-Demand	Anodyne	PDS	41	35
C[C@@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)N(C)C(=O)OC(C)(C)C	ZINC000819298071	GF	On-Demand	Anodyne	ADRB2	25	60
C[C@@H](CNC[C@@H](O)COc1cccc2[nH]ccc12)N(C)C(=O)OC(C)(C)C	ZINC000819298071	GF	On-Demand	Anodyne	ADRB1	41	60
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccccc1	ZINC000819298073	EE	On-Demand	Anodyne	ADRB2	37	45
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccccc1	ZINC000819298073	EE	On-Demand	Anodyne	ADRB1	32	48
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccccc1	ZINC000819298073	EE	On-Demand	Anodyne	ADRB3	72	48
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccccc1	ZINC000819298074	EE	On-Demand	Anodyne	ADRB2	37	45
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccccc1	ZINC000819298074	EE	On-Demand	Anodyne	ADRB1	32	48
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccccc1	ZINC000819298074	EE	On-Demand	Anodyne	ADRB3	72	48
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccccc1	ZINC000819298076	EE	On-Demand	Anodyne	ADRB2	37	45
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccccc1	ZINC000819298076	EE	On-Demand	Anodyne	ADRB1	32	48
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccccc1	ZINC000819298076	EE	On-Demand	Anodyne	ADRB3	72	48
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccccc1	ZINC000819298077	EE	On-Demand	Anodyne	ADRB2	37	45
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccccc1	ZINC000819298077	EE	On-Demand	Anodyne	ADRB1	32	48
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccccc1	ZINC000819298077	EE	On-Demand	Anodyne	ADRB3	72	48
CON(C)C(=O)CCNCc1ccn(Cc2ccccc2)n1	ZINC000819298090	DD	On-Demand	Anodyne	HDAC7	18	42
CCN1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819298094	CD	On-Demand	Anodyne	ADRB1	34	42
CCN1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819298094	CD	On-Demand	Anodyne	ADRB3	51	45
CCN1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819298094	CD	On-Demand	Anodyne	IGF1R	30	40
CCN1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819298094	CD	On-Demand	Anodyne	CYP3A4	52	39
CCN1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819298095	CD	On-Demand	Anodyne	ADRB1	34	42
CCN1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819298095	CD	On-Demand	Anodyne	ADRB3	51	45
CCN1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819298095	CD	On-Demand	Anodyne	IGF1R	30	40
CCN1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819298095	CD	On-Demand	Anodyne	CYP3A4	52	39
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819298097	GD	On-Demand	Bother	ADRB2	31	41
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819298097	GD	On-Demand	Bother	ADRB1	29	41
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819298097	GD	On-Demand	Bother	ADRB3	66	41
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819298100	GD	On-Demand	Bother	ADRB2	31	41
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819298100	GD	On-Demand	Bother	ADRB1	29	41
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819298100	GD	On-Demand	Bother	ADRB3	66	41
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819298102	GD	On-Demand	Bother	ADRB2	31	41
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819298102	GD	On-Demand	Bother	ADRB1	29	41
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819298102	GD	On-Demand	Bother	ADRB3	66	41
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819298103	GD	On-Demand	Bother	ADRB2	31	41
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819298103	GD	On-Demand	Bother	ADRB1	29	41
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819298103	GD	On-Demand	Bother	ADRB3	66	41
O[C@@H](CNCc1cnc2n1CCCC2)c1cccc(Cl)c1	ZINC000819298110	DF	On-Demand	Anodyne	ADRB1	28	43
O[C@@H](CNCc1cnc2n1CCCC2)c1cccc(Cl)c1	ZINC000819298110	DF	On-Demand	Anodyne	ADRB3	44	43
O[C@H](CNCc1cnc2n1CCCC2)c1cccc(Cl)c1	ZINC000819298113	DF	On-Demand	Anodyne	ADRB1	28	43
O[C@H](CNCc1cnc2n1CCCC2)c1cccc(Cl)c1	ZINC000819298113	DF	On-Demand	Anodyne	ADRB3	44	43
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819298120	GF	On-Demand	Anodyne	ADRB1	25	41
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819298120	GF	On-Demand	Anodyne	ADRB3	49	41
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819298120	GF	On-Demand	Anodyne	TBXA2R	50	42
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819298120	GF	On-Demand	Anodyne	TBXAS1	35	42
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819298121	GF	On-Demand	Anodyne	ADRB1	25	41
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819298121	GF	On-Demand	Anodyne	ADRB3	49	41
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819298121	GF	On-Demand	Anodyne	TBXA2R	50	42
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819298121	GF	On-Demand	Anodyne	TBXAS1	35	42
COC(=O)N(C)Cc1ccc(NC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819298129	GI	On-Demand	Anodyne	MTNR1A	16	47
COC(=O)N(C)Cc1ccc(NC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819298129	GI	On-Demand	Anodyne	MTNR1B	22	47
COC(=O)N(C)Cc1ccc(NC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819298129	GI	On-Demand	Anodyne	ROCK2	17	40
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819298130	GD	On-Demand	Bother	ADRB3	32	40
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819298132	GD	On-Demand	Bother	ADRB3	32	40
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819298134	GD	On-Demand	Bother	ADRB3	32	40
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819298135	GD	On-Demand	Bother	ADRB3	32	40
O[C@H](CNCC1CC(c2ccccc2)C1)c1cc(F)ccc1F	ZINC000819298157	DH	On-Demand	Anodyne	SLC18A3	17	40
O[C@@H](CNCC1CC(c2ccccc2)C1)c1cc(F)ccc1F	ZINC000819298158	DH	On-Demand	Anodyne	SLC18A3	17	40
C[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)N(C)C(=O)OC(C)(C)C	ZINC000819298184	FE	On-Demand	Bother	CACNA1D	56	33
C[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)N(C)C(=O)OC(C)(C)C	ZINC000819298185	FE	On-Demand	Bother	CACNA1D	56	33
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)N(C)C(=O)OC(C)(C)C	ZINC000819298186	FE	On-Demand	Bother	CACNA1D	56	33
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)N(C)C(=O)OC(C)(C)C	ZINC000819298187	FE	On-Demand	Bother	CACNA1D	56	33
O[C@H](CNCC1CC(c2ccccc2)C1)c1ccc(F)c(F)c1	ZINC000819298188	DH	On-Demand	Anodyne	SLC18A3	15	40
O[C@@H](CNCC1CC(c2ccccc2)C1)c1ccc(F)c(F)c1	ZINC000819298189	DH	On-Demand	Anodyne	SLC18A3	15	40
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000819298198	FD	On-Demand	Anodyne	ADRB2	15	40
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000819298198	FD	On-Demand	Anodyne	ACOX1	55	35
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000819298198	FD	On-Demand	Anodyne	ABCB1	77	46
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000819298199	FD	On-Demand	Anodyne	ADRB2	15	40
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000819298199	FD	On-Demand	Anodyne	ACOX1	55	35
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000819298199	FD	On-Demand	Anodyne	ABCB1	77	46
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2ccccc2C(F)(F)F)cs1	ZINC000819298255	FJ	On-Demand	Anodyne	MPL	69	41
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2ccccc2C(F)(F)F)cs1	ZINC000819298256	FJ	On-Demand	Anodyne	MPL	69	41
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2ccccc2C(F)(F)F)cs1	ZINC000819298257	FJ	On-Demand	Anodyne	MPL	69	41
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2ccccc2C(F)(F)F)cs1	ZINC000819298258	FJ	On-Demand	Anodyne	MPL	69	41
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000819298265	FD	On-Demand	Anodyne	ADRB2	15	40
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000819298265	FD	On-Demand	Anodyne	ACOX1	55	35
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000819298265	FD	On-Demand	Anodyne	ABCB1	77	46
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000819298267	FD	On-Demand	Anodyne	ADRB2	15	40
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000819298267	FD	On-Demand	Anodyne	ACOX1	55	35
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000819298267	FD	On-Demand	Anodyne	ABCB1	77	46
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc2ccccc12	ZINC000819298292	GG	On-Demand	Anodyne	ADRB2	23	40
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc2ccccc12	ZINC000819298295	GG	On-Demand	Anodyne	ADRB2	23	40
O[C@H](CNCC1CC(c2ccccc2)C1)c1ccc(F)cc1F	ZINC000819298355	DH	On-Demand	Anodyne	SLC18A3	18	40
O[C@@H](CNCC1CC(c2ccccc2)C1)c1ccc(F)cc1F	ZINC000819298356	DH	On-Demand	Anodyne	SLC18A3	18	40
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819298357	ED	On-Demand	Anodyne	ADRB2	46	46
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819298357	ED	On-Demand	Anodyne	ADRB1	41	53
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819298357	ED	On-Demand	Anodyne	ADRB3	134	56
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819298357	ED	On-Demand	Anodyne	TBXA2R	24	45
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819298357	ED	On-Demand	Anodyne	TBXAS1	50	48
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819298357	ED	On-Demand	Anodyne	KCNA5	23	40
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819298357	ED	On-Demand	Anodyne	NAMPT	16	43
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819298358	ED	On-Demand	Anodyne	ADRB2	46	46
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819298358	ED	On-Demand	Anodyne	ADRB1	41	53
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819298358	ED	On-Demand	Anodyne	ADRB3	134	56
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819298358	ED	On-Demand	Anodyne	TBXA2R	24	45
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819298358	ED	On-Demand	Anodyne	TBXAS1	50	48
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819298358	ED	On-Demand	Anodyne	KCNA5	23	40
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819298358	ED	On-Demand	Anodyne	NAMPT	16	43
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819298359	ED	On-Demand	Anodyne	ADRB2	46	46
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819298359	ED	On-Demand	Anodyne	ADRB1	41	53
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819298359	ED	On-Demand	Anodyne	ADRB3	134	56
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819298359	ED	On-Demand	Anodyne	TBXA2R	24	45
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819298359	ED	On-Demand	Anodyne	TBXAS1	50	48
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819298359	ED	On-Demand	Anodyne	KCNA5	23	40
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819298359	ED	On-Demand	Anodyne	NAMPT	16	43
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819298360	ED	On-Demand	Anodyne	ADRB2	46	46
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819298360	ED	On-Demand	Anodyne	ADRB1	41	53
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819298360	ED	On-Demand	Anodyne	ADRB3	134	56
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819298360	ED	On-Demand	Anodyne	TBXA2R	24	45
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819298360	ED	On-Demand	Anodyne	TBXAS1	50	48
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819298360	ED	On-Demand	Anodyne	KCNA5	23	40
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819298360	ED	On-Demand	Anodyne	NAMPT	16	43
C[C@@H](CNC[C@@H](O)c1cccnc1)N(C)C(=O)OC(C)(C)C	ZINC000819298361	DD	On-Demand	Anodyne	ADRB2	21	41
C[C@@H](CNC[C@@H](O)c1cccnc1)N(C)C(=O)OC(C)(C)C	ZINC000819298361	DD	On-Demand	Anodyne	ADRB1	25	44
C[C@@H](CNC[C@@H](O)c1cccnc1)N(C)C(=O)OC(C)(C)C	ZINC000819298361	DD	On-Demand	Anodyne	ADRB3	91	45
C[C@@H](CNC[C@@H](O)c1cccnc1)N(C)C(=O)OC(C)(C)C	ZINC000819298361	DD	On-Demand	Anodyne	KCNA5	22	44
C[C@@H](CNC[C@H](O)c1cccnc1)N(C)C(=O)OC(C)(C)C	ZINC000819298362	DD	On-Demand	Anodyne	ADRB2	21	41
C[C@@H](CNC[C@H](O)c1cccnc1)N(C)C(=O)OC(C)(C)C	ZINC000819298362	DD	On-Demand	Anodyne	ADRB1	25	44
C[C@@H](CNC[C@H](O)c1cccnc1)N(C)C(=O)OC(C)(C)C	ZINC000819298362	DD	On-Demand	Anodyne	ADRB3	91	45
C[C@@H](CNC[C@H](O)c1cccnc1)N(C)C(=O)OC(C)(C)C	ZINC000819298362	DD	On-Demand	Anodyne	KCNA5	22	44
C[C@H](CNC[C@H](O)c1cccnc1)N(C)C(=O)OC(C)(C)C	ZINC000819298363	DD	On-Demand	Anodyne	ADRB2	21	41
C[C@H](CNC[C@H](O)c1cccnc1)N(C)C(=O)OC(C)(C)C	ZINC000819298363	DD	On-Demand	Anodyne	ADRB1	25	44
C[C@H](CNC[C@H](O)c1cccnc1)N(C)C(=O)OC(C)(C)C	ZINC000819298363	DD	On-Demand	Anodyne	ADRB3	91	45
C[C@H](CNC[C@H](O)c1cccnc1)N(C)C(=O)OC(C)(C)C	ZINC000819298363	DD	On-Demand	Anodyne	KCNA5	22	44
C[C@H](CNC[C@@H](O)c1cccnc1)N(C)C(=O)OC(C)(C)C	ZINC000819298364	DD	On-Demand	Anodyne	ADRB2	21	41
C[C@H](CNC[C@@H](O)c1cccnc1)N(C)C(=O)OC(C)(C)C	ZINC000819298364	DD	On-Demand	Anodyne	ADRB1	25	44
C[C@H](CNC[C@@H](O)c1cccnc1)N(C)C(=O)OC(C)(C)C	ZINC000819298364	DD	On-Demand	Anodyne	ADRB3	91	45
C[C@H](CNC[C@@H](O)c1cccnc1)N(C)C(=O)OC(C)(C)C	ZINC000819298364	DD	On-Demand	Anodyne	KCNA5	22	44
O[C@H](CNCC1CC(c2ccccc2)C1)c1cccnc1	ZINC000819298369	CF	On-Demand	Anodyne	ADRB2	20	44
O[C@H](CNCC1CC(c2ccccc2)C1)c1cccnc1	ZINC000819298369	CF	On-Demand	Anodyne	ADRB1	21	42
O[C@H](CNCC1CC(c2ccccc2)C1)c1cccnc1	ZINC000819298369	CF	On-Demand	Anodyne	ADRB3	86	50
O[C@@H](CNCC1CC(c2ccccc2)C1)c1cccnc1	ZINC000819298370	CF	On-Demand	Anodyne	ADRB2	20	44
O[C@@H](CNCC1CC(c2ccccc2)C1)c1cccnc1	ZINC000819298370	CF	On-Demand	Anodyne	ADRB1	21	42
O[C@@H](CNCC1CC(c2ccccc2)C1)c1cccnc1	ZINC000819298370	CF	On-Demand	Anodyne	ADRB3	86	50
O[C@H](CNCCC1(O)CCC1)c1cccc(Cl)c1	ZINC000819298407	CE	On-Demand	Anodyne	ADRB1	50	49
O[C@H](CNCCC1(O)CCC1)c1cccc(Cl)c1	ZINC000819298407	CE	On-Demand	Anodyne	ADRB3	62	49
O[C@@H](CNCCC1(O)CCC1)c1cccc(Cl)c1	ZINC000819298408	CE	On-Demand	Anodyne	ADRB1	50	49
O[C@@H](CNCCC1(O)CCC1)c1cccc(Cl)c1	ZINC000819298408	CE	On-Demand	Anodyne	ADRB3	62	49
O[C@H](CNCc1ccnc(OC(F)F)c1)c1cccc(F)c1	ZINC000819298436	DF	On-Demand	Anodyne	ADRB3	18	41
O[C@@H](CNCc1ccnc(OC(F)F)c1)c1cccc(F)c1	ZINC000819298437	DF	On-Demand	Anodyne	ADRB3	18	41
C[C@@H]1C[C@H]1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819298450	BD	On-Demand	Bother	CACNA1C	53	37
C[C@@H]1C[C@H]1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819298450	BD	On-Demand	Bother	CACNA1D	83	37
C[C@@H]1C[C@H]1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819298451	BD	On-Demand	Bother	CACNA1C	53	37
C[C@@H]1C[C@H]1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819298451	BD	On-Demand	Bother	CACNA1D	83	37
COC(=O)N(C)Cc1ccc(NC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819298474	FG	On-Demand	Anodyne	MTNR1B	17	41
COC(=O)N(C)Cc1ccc(NC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819298474	FG	On-Demand	Anodyne	RORC	31	42
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819298476	GF	On-Demand	Anodyne	ADRB2	45	51
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819298476	GF	On-Demand	Anodyne	ADRB1	58	53
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819298476	GF	On-Demand	Anodyne	ADRB3	94	53
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819298476	GF	On-Demand	Anodyne	TBXA2R	43	36
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819298478	GF	On-Demand	Anodyne	ADRB2	45	51
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819298478	GF	On-Demand	Anodyne	ADRB1	58	53
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819298478	GF	On-Demand	Anodyne	ADRB3	94	53
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819298478	GF	On-Demand	Anodyne	TBXA2R	43	36
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819298480	GF	On-Demand	Anodyne	ADRB2	45	51
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819298480	GF	On-Demand	Anodyne	ADRB1	58	53
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819298480	GF	On-Demand	Anodyne	ADRB3	94	53
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819298480	GF	On-Demand	Anodyne	TBXA2R	43	36
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819298482	GF	On-Demand	Anodyne	ADRB2	45	51
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819298482	GF	On-Demand	Anodyne	ADRB1	58	53
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819298482	GF	On-Demand	Anodyne	ADRB3	94	53
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819298482	GF	On-Demand	Anodyne	TBXA2R	43	36
O[C@@H](CNCC1CC(c2ccccc2)C1)C1CC1	ZINC000819298505	BF	On-Demand	Anodyne	SLC18A3	28	41
O[C@H](CNCC1CC(c2ccccc2)C1)C1CC1	ZINC000819298507	BF	On-Demand	Anodyne	SLC18A3	28	41
Cc1ccc(OC[C@@H](O)CNC[C@@H](C)N(C)C(=O)OC(C)(C)C)cc1	ZINC000819298513	FF	On-Demand	Anodyne	ADRB2	46	53
Cc1ccc(OC[C@@H](O)CNC[C@@H](C)N(C)C(=O)OC(C)(C)C)cc1	ZINC000819298513	FF	On-Demand	Anodyne	ADRB1	57	44
Cc1ccc(OC[C@@H](O)CNC[C@H](C)N(C)C(=O)OC(C)(C)C)cc1	ZINC000819298515	FF	On-Demand	Anodyne	ADRB2	46	53
Cc1ccc(OC[C@@H](O)CNC[C@H](C)N(C)C(=O)OC(C)(C)C)cc1	ZINC000819298515	FF	On-Demand	Anodyne	ADRB1	57	44
Cc1ccc(OC[C@H](O)CNC[C@@H](C)N(C)C(=O)OC(C)(C)C)cc1	ZINC000819298516	FF	On-Demand	Anodyne	ADRB2	46	53
Cc1ccc(OC[C@H](O)CNC[C@@H](C)N(C)C(=O)OC(C)(C)C)cc1	ZINC000819298516	FF	On-Demand	Anodyne	ADRB1	57	44
Cc1ccc(OC[C@H](O)CNC[C@H](C)N(C)C(=O)OC(C)(C)C)cc1	ZINC000819298517	FF	On-Demand	Anodyne	ADRB2	46	53
Cc1ccc(OC[C@H](O)CNC[C@H](C)N(C)C(=O)OC(C)(C)C)cc1	ZINC000819298517	FF	On-Demand	Anodyne	ADRB1	57	44
O=C(Nc1cc(C2CCCC2)[nH]n1)C(F)=C1CCC1	ZINC000819298536	CG	On-Demand	Anodyne	CDK2	15	53
O=C(Nc1cc(C2CCCC2)[nH]n1)C(F)=C1CCC1	ZINC000819298536	CG	On-Demand	Anodyne	PKNB	48	38
C[C@@H](CNC[C@H](O)COc1ccc2c(c1)OCO2)N(C)C(=O)OC(C)(C)C	ZINC000819298544	GD	On-Demand	Anodyne	EDNRB	46	33
C[C@@H](CNC[C@H](O)COc1ccc2c(c1)OCO2)N(C)C(=O)OC(C)(C)C	ZINC000819298544	GD	On-Demand	Anodyne	EDNRA	45	36
C[C@H](CNC[C@H](O)COc1ccc2c(c1)OCO2)N(C)C(=O)OC(C)(C)C	ZINC000819298545	GD	On-Demand	Anodyne	EDNRB	46	33
C[C@H](CNC[C@H](O)COc1ccc2c(c1)OCO2)N(C)C(=O)OC(C)(C)C	ZINC000819298545	GD	On-Demand	Anodyne	EDNRA	45	36
C[C@@H](CNC[C@@H](O)COc1ccc2c(c1)OCO2)N(C)C(=O)OC(C)(C)C	ZINC000819298546	GD	On-Demand	Anodyne	EDNRB	46	33
C[C@@H](CNC[C@@H](O)COc1ccc2c(c1)OCO2)N(C)C(=O)OC(C)(C)C	ZINC000819298546	GD	On-Demand	Anodyne	EDNRA	45	36
C[C@H](CNC[C@@H](O)COc1ccc2c(c1)OCO2)N(C)C(=O)OC(C)(C)C	ZINC000819298547	GD	On-Demand	Anodyne	EDNRB	46	33
C[C@H](CNC[C@@H](O)COc1ccc2c(c1)OCO2)N(C)C(=O)OC(C)(C)C	ZINC000819298547	GD	On-Demand	Anodyne	EDNRA	45	36
O=C(/C=C/[C@@H]1CCCO1)Nc1cnn(CC(F)(F)F)c1	ZINC000819298603	CE	On-Demand	Anodyne	PANC	45	32
COC(=O)NCc1ccc(NC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819298606	GH	On-Demand	Anodyne	MTNR1A	19	48
COC(=O)NCc1ccc(NC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819298606	GH	On-Demand	Anodyne	MTNR1B	24	48
COC(=O)NCc1ccc(NC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819298606	GH	On-Demand	Anodyne	ROCK2	25	41
COC(=O)NCc1ccc(NC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819298606	GH	On-Demand	Anodyne	PDS	73	38
O=C(/C=C/[C@H]1CCCO1)Nc1cnn(CC(F)(F)F)c1	ZINC000819298611	CE	On-Demand	Anodyne	PANC	45	32
O=C(/C=C\[C@H]1CCCO1)Nc1cnn(CC(F)(F)F)c1	ZINC000819298612	CE	On-Demand	Anodyne	PANC	45	32
O=C(/C=C\[C@@H]1CCCO1)Nc1cnn(CC(F)(F)F)c1	ZINC000819298613	CE	On-Demand	Anodyne	PANC	45	32
CCN1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1=O	ZINC000819298666	DD	On-Demand	Anodyne	RBP4	47	33
CCN1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1=O	ZINC000819298669	DD	On-Demand	Anodyne	RBP4	47	33
CON(C)C(=O)CCNCc1ccc(OC2CCN(C)CC2)cc1	ZINC000819298697	ED	On-Demand	Anodyne	PRSS2	44	34
O=C(C(F)=C1CCC1)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000819298743	ED	On-Demand	Anodyne	ACOX1	60	40
O=C(C(F)=C1CCC1)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000819298743	ED	On-Demand	Anodyne	ABCB1	83	49
O=C(C(F)=C1CCC1)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000819298745	ED	On-Demand	Anodyne	ACOX1	60	40
O=C(C(F)=C1CCC1)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000819298745	ED	On-Demand	Anodyne	ABCB1	83	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCC(=O)NC2(C)C)CC1	ZINC000819298771	FD	On-Demand	Anodyne	GPR119	30	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCC(=O)NC2(C)C)CC1	ZINC000819298772	FD	On-Demand	Anodyne	GPR119	30	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCC(=O)NC2(C)C)CC1	ZINC000819298773	FD	On-Demand	Anodyne	GPR119	30	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCC(=O)NC2(C)C)CC1	ZINC000819298774	FD	On-Demand	Anodyne	GPR119	30	43
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819298793	GD	On-Demand	Anodyne	CTSD	110	46
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819298793	GD	On-Demand	Anodyne	PGC	64	40
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819298793	GD	On-Demand	Anodyne	CMA1	31	40
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819298793	GD	On-Demand	Anodyne	PAPA1_CARPA	35	42
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819298793	GD	On-Demand	Anodyne	CCKAR	21	41
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819298793	GD	On-Demand	Anodyne	CTSK	15	43
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819298793	GD	On-Demand	Anodyne	CTSL	22	42
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819298793	GD	On-Demand	Anodyne	PGA	35	40
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819298793	GD	On-Demand	Anodyne	BACE2	57	46
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819298793	GD	On-Demand	Anodyne	REN	96	45
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819298793	GD	On-Demand	Anodyne	REN1	26	42
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819298793	GD	On-Demand	Anodyne	BACE1	94	46
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819298793	GD	On-Demand	Anodyne	FPR1	48	38
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819298793	GD	On-Demand	Anodyne	PLM1_PLAFA	23	40
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1=O	ZINC000819298793	GD	On-Demand	Anodyne	PLM2_PLAFA	43	35
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CSC1(C)C	ZINC000819298795	GF	On-Demand	Anodyne	CTSD	103	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CSC1(C)C	ZINC000819298795	GF	On-Demand	Anodyne	PGC	61	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CSC1(C)C	ZINC000819298795	GF	On-Demand	Anodyne	PAPA1_CARPA	32	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CSC1(C)C	ZINC000819298795	GF	On-Demand	Anodyne	BACE2	49	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CSC1(C)C	ZINC000819298795	GF	On-Demand	Anodyne	TACR3	15	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CSC1(C)C	ZINC000819298795	GF	On-Demand	Anodyne	REN	84	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CSC1(C)C	ZINC000819298795	GF	On-Demand	Anodyne	REN1	28	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CSC1(C)C	ZINC000819298795	GF	On-Demand	Anodyne	BACE1	84	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CSC1(C)C	ZINC000819298795	GF	On-Demand	Anodyne	FPR1	52	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CSC1(C)C	ZINC000819298795	GF	On-Demand	Anodyne	PLM2_PLAFA	74	35
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CSC1(C)C	ZINC000819298795	GF	On-Demand	Anodyne	GAG-PRO	91	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CSC1(C)C	ZINC000819298795	GF	On-Demand	Anodyne	Q82323_9DELA	84	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CSC1(C)C	ZINC000819298796	GF	On-Demand	Anodyne	CTSD	103	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CSC1(C)C	ZINC000819298796	GF	On-Demand	Anodyne	PGC	61	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CSC1(C)C	ZINC000819298796	GF	On-Demand	Anodyne	PAPA1_CARPA	32	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CSC1(C)C	ZINC000819298796	GF	On-Demand	Anodyne	BACE2	49	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CSC1(C)C	ZINC000819298796	GF	On-Demand	Anodyne	TACR3	15	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CSC1(C)C	ZINC000819298796	GF	On-Demand	Anodyne	REN	84	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CSC1(C)C	ZINC000819298796	GF	On-Demand	Anodyne	REN1	28	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CSC1(C)C	ZINC000819298796	GF	On-Demand	Anodyne	BACE1	84	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CSC1(C)C	ZINC000819298796	GF	On-Demand	Anodyne	FPR1	52	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CSC1(C)C	ZINC000819298796	GF	On-Demand	Anodyne	PLM2_PLAFA	74	35
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CSC1(C)C	ZINC000819298796	GF	On-Demand	Anodyne	GAG-PRO	91	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CSC1(C)C	ZINC000819298796	GF	On-Demand	Anodyne	Q82323_9DELA	84	36
CC[C@@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819298828	FH	On-Demand	Mild	PAPA1_CARPA	33	45
CC[C@@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819298828	FH	On-Demand	Mild	CTSK	15	42
CC[C@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819298830	FH	On-Demand	Mild	PAPA1_CARPA	33	45
CC[C@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819298830	FH	On-Demand	Mild	CTSK	15	42
CC[C@@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819298832	FH	On-Demand	Mild	PAPA1_CARPA	33	45
CC[C@@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819298832	FH	On-Demand	Mild	CTSK	15	42
CC[C@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819298833	FH	On-Demand	Mild	PAPA1_CARPA	33	45
CC[C@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819298833	FH	On-Demand	Mild	CTSK	15	42
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cc2ccccc2o1	ZINC000819298837	GF	On-Demand	Anodyne	ALOX15	21	42
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cc2ccccc2o1	ZINC000819298839	GF	On-Demand	Anodyne	ALOX15	21	42
CC(=O)Nc1cccc(CC(=O)Oc2ccc(OC(C)C)cc2)c1	ZINC000819298846	EH	On-Demand	Anodyne	KCNK3	75	37
CC(=O)Nc1cccc(CC(=O)Oc2ccc(OC(C)C)cc2)c1	ZINC000819298846	EH	On-Demand	Anodyne	KCNK9	62	36
CCN1CC[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1=O	ZINC000819298854	FD	On-Demand	Anodyne	GPR119	36	43
CCN1CC[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1=O	ZINC000819298856	FD	On-Demand	Anodyne	GPR119	36	43
C[C@@H](CNC[C@H](O)COc1ccccc1F)N(C)C(=O)OC(C)(C)C	ZINC000819298859	FE	On-Demand	Anodyne	ADRB2	31	45
C[C@@H](CNC[C@H](O)COc1ccccc1F)N(C)C(=O)OC(C)(C)C	ZINC000819298859	FE	On-Demand	Anodyne	ADRB1	60	41
C[C@H](CNC[C@H](O)COc1ccccc1F)N(C)C(=O)OC(C)(C)C	ZINC000819298860	FE	On-Demand	Anodyne	ADRB2	31	45
C[C@H](CNC[C@H](O)COc1ccccc1F)N(C)C(=O)OC(C)(C)C	ZINC000819298860	FE	On-Demand	Anodyne	ADRB1	60	41
C[C@@H](CNC[C@@H](O)COc1ccccc1F)N(C)C(=O)OC(C)(C)C	ZINC000819298862	FE	On-Demand	Anodyne	ADRB2	31	45
C[C@@H](CNC[C@@H](O)COc1ccccc1F)N(C)C(=O)OC(C)(C)C	ZINC000819298862	FE	On-Demand	Anodyne	ADRB1	60	41
C[C@H](CNC[C@@H](O)COc1ccccc1F)N(C)C(=O)OC(C)(C)C	ZINC000819298864	FE	On-Demand	Anodyne	ADRB2	31	45
C[C@H](CNC[C@@H](O)COc1ccccc1F)N(C)C(=O)OC(C)(C)C	ZINC000819298864	FE	On-Demand	Anodyne	ADRB1	60	41
Cc1ccccc1[C@@H](O)CNCC1CC(c2ccccc2)C1	ZINC000819298877	CH	On-Demand	Anodyne	SLC18A3	19	40
C[C@H]1C[C@H](CCNC[C@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819298879	CE	On-Demand	Anodyne	ADRB2	24	44
C[C@H]1C[C@H](CCNC[C@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819298879	CE	On-Demand	Anodyne	ADRB1	25	45
C[C@H]1C[C@H](CCNC[C@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819298879	CE	On-Demand	Anodyne	ADRB3	97	48
C[C@H]1C[C@H](CCNC[C@@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819298880	CE	On-Demand	Anodyne	ADRB2	24	44
C[C@H]1C[C@H](CCNC[C@@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819298880	CE	On-Demand	Anodyne	ADRB1	25	45
C[C@H]1C[C@H](CCNC[C@@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819298880	CE	On-Demand	Anodyne	ADRB3	97	48
C[C@@H]1CC(CCNC[C@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819298881	CE	On-Demand	Anodyne	ADRB2	24	44
C[C@@H]1CC(CCNC[C@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819298881	CE	On-Demand	Anodyne	ADRB1	25	45
C[C@@H]1CC(CCNC[C@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819298881	CE	On-Demand	Anodyne	ADRB3	97	48
C[C@@H]1CC(CCNC[C@@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819298882	CE	On-Demand	Anodyne	ADRB2	24	44
C[C@@H]1CC(CCNC[C@@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819298882	CE	On-Demand	Anodyne	ADRB1	25	45
C[C@@H]1CC(CCNC[C@@H](O)c2cccnc2)C[C@@H](C)O1	ZINC000819298882	CE	On-Demand	Anodyne	ADRB3	97	48
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819298902	FE	On-Demand	Anodyne	ADRB2	33	44
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819298902	FE	On-Demand	Anodyne	ADRB1	27	44
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819298902	FE	On-Demand	Anodyne	ADRB3	52	44
O[C@@H](CNCc1cnc2n1CCCC2)c1cccnc1	ZINC000819298903	CD	On-Demand	Anodyne	ADRB2	23	40
O[C@@H](CNCc1cnc2n1CCCC2)c1cccnc1	ZINC000819298903	CD	On-Demand	Anodyne	ADRB1	24	40
O[C@@H](CNCc1cnc2n1CCCC2)c1cccnc1	ZINC000819298903	CD	On-Demand	Anodyne	ADRB3	91	46
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(F)cc1	ZINC000819298904	FE	On-Demand	Anodyne	ADRB2	33	44
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(F)cc1	ZINC000819298904	FE	On-Demand	Anodyne	ADRB1	27	44
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(F)cc1	ZINC000819298904	FE	On-Demand	Anodyne	ADRB3	52	44
O[C@H](CNCc1cnc2n1CCCC2)c1cccnc1	ZINC000819298905	CD	On-Demand	Anodyne	ADRB2	23	40
O[C@H](CNCc1cnc2n1CCCC2)c1cccnc1	ZINC000819298905	CD	On-Demand	Anodyne	ADRB1	24	40
O[C@H](CNCc1cnc2n1CCCC2)c1cccnc1	ZINC000819298905	CD	On-Demand	Anodyne	ADRB3	91	46
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(F)cc1	ZINC000819298906	FE	On-Demand	Anodyne	ADRB2	33	44
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(F)cc1	ZINC000819298906	FE	On-Demand	Anodyne	ADRB1	27	44
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(F)cc1	ZINC000819298906	FE	On-Demand	Anodyne	ADRB3	52	44
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819298908	FE	On-Demand	Anodyne	ADRB2	33	44
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819298908	FE	On-Demand	Anodyne	ADRB1	27	44
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819298908	FE	On-Demand	Anodyne	ADRB3	52	44
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819298910	GE	On-Demand	Anodyne	ADRB1	26	44
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819298910	GE	On-Demand	Anodyne	ADRB3	52	40
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819298912	GE	On-Demand	Anodyne	ADRB1	26	44
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819298912	GE	On-Demand	Anodyne	ADRB3	52	40
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819298914	GE	On-Demand	Anodyne	ADRB1	26	44
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819298914	GE	On-Demand	Anodyne	ADRB3	52	40
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819298916	GE	On-Demand	Anodyne	ADRB1	26	44
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819298916	GE	On-Demand	Anodyne	ADRB3	52	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2COC[C@H]2n2ccnn2)CC1	ZINC000819298966	GC	On-Demand	Anodyne	GPR119	28	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2COC[C@H]2n2ccnn2)CC1	ZINC000819298967	GC	On-Demand	Anodyne	GPR119	28	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cc(C2CCCC2)[nH]n1	ZINC000819299033	EF	On-Demand	Anodyne	PKNB	69	37
COc1ccc(C(=O)N2CCC(NC(=O)/C=C\[C@H]3CCCO3)CC2)cc1OC	ZINC000819299036	GE	On-Demand	Anodyne	L3MBTL3	52	34
COc1ccc(C(=O)N2CCC(NC(=O)/C=C/[C@H]3CCCO3)CC2)cc1OC	ZINC000819299037	GE	On-Demand	Anodyne	L3MBTL3	52	34
COc1ccc(C(=O)N2CCC(NC(=O)/C=C/[C@@H]3CCCO3)CC2)cc1OC	ZINC000819299038	GE	On-Demand	Anodyne	L3MBTL3	52	34
COc1ccc(C(=O)N2CCC(NC(=O)/C=C\[C@@H]3CCCO3)CC2)cc1OC	ZINC000819299039	GE	On-Demand	Anodyne	L3MBTL3	52	34
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cnc3n2CCCC3)CC1	ZINC000819299065	GE	On-Demand	Anodyne	GPR119	47	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cnc3n2CCCC3)CC1	ZINC000819299067	GE	On-Demand	Anodyne	GPR119	47	43
O[C@H](CNCC1CC(c2ccccc2)C1)c1cccc(F)c1	ZINC000819299085	CH	On-Demand	Anodyne	SLC18A3	15	43
O[C@@H](CNCC1CC(c2ccccc2)C1)c1cccc(F)c1	ZINC000819299086	CH	On-Demand	Anodyne	SLC18A3	15	43
COc1ccc(OC)c([C@H](O)CNCCCCc2ccc(Cl)s2)c1	ZINC000819299099	FI	On-Demand	Anodyne	ADRB2	22	45
C[C@H]1C[C@H](CCNC[C@H](O)c2cccc(Cl)c2)C[C@@H](C)O1	ZINC000819299148	DH	On-Demand	Anodyne	ADRB1	40	47
C[C@H]1C[C@H](CCNC[C@H](O)c2cccc(Cl)c2)C[C@@H](C)O1	ZINC000819299148	DH	On-Demand	Anodyne	ADRB3	57	45
C[C@@H]1CC(CCNC[C@@H](O)c2cccc(Cl)c2)C[C@@H](C)O1	ZINC000819299150	DH	On-Demand	Anodyne	ADRB1	40	47
C[C@@H]1CC(CCNC[C@@H](O)c2cccc(Cl)c2)C[C@@H](C)O1	ZINC000819299150	DH	On-Demand	Anodyne	ADRB3	57	45
C[C@H]1C[C@H](CCNC[C@@H](O)c2cccc(Cl)c2)C[C@@H](C)O1	ZINC000819299152	DH	On-Demand	Anodyne	ADRB1	40	47
C[C@H]1C[C@H](CCNC[C@@H](O)c2cccc(Cl)c2)C[C@@H](C)O1	ZINC000819299152	DH	On-Demand	Anodyne	ADRB3	57	45
C[C@@H]1CC(CCNC[C@H](O)c2cccc(Cl)c2)C[C@@H](C)O1	ZINC000819299154	DH	On-Demand	Anodyne	ADRB1	40	47
C[C@@H]1CC(CCNC[C@H](O)c2cccc(Cl)c2)C[C@@H](C)O1	ZINC000819299154	DH	On-Demand	Anodyne	ADRB3	57	45
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCc2ccc(Cl)s2)cc1	ZINC000819299170	GG	On-Demand	Anodyne	ADRB3	47	36
CS(=O)(=O)c1ccc([C@H](O)CNCCCCc2ccc(Cl)s2)cc1	ZINC000819299171	GG	On-Demand	Anodyne	ADRB3	47	36
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc(F)c1	ZINC000819299192	FE	On-Demand	Anodyne	ADRB2	37	43
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc(F)c1	ZINC000819299192	FE	On-Demand	Anodyne	ADRB1	33	43
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc(F)c1	ZINC000819299192	FE	On-Demand	Anodyne	ADRB3	68	43
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc(F)c1	ZINC000819299193	FE	On-Demand	Anodyne	ADRB2	37	43
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc(F)c1	ZINC000819299193	FE	On-Demand	Anodyne	ADRB1	33	43
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc(F)c1	ZINC000819299193	FE	On-Demand	Anodyne	ADRB3	68	43
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc(F)c1	ZINC000819299194	FE	On-Demand	Anodyne	ADRB2	37	43
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc(F)c1	ZINC000819299194	FE	On-Demand	Anodyne	ADRB1	33	43
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1cccc(F)c1	ZINC000819299194	FE	On-Demand	Anodyne	ADRB3	68	43
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc(F)c1	ZINC000819299195	FE	On-Demand	Anodyne	ADRB2	37	43
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc(F)c1	ZINC000819299195	FE	On-Demand	Anodyne	ADRB1	33	43
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1cccc(F)c1	ZINC000819299195	FE	On-Demand	Anodyne	ADRB3	68	43
O[C@H](CN[C@H]1COC[C@H]1n1ccnn1)c1cccc(Cl)c1	ZINC000819299201	DD	On-Demand	Anodyne	CYP3A4	43	36
O[C@@H](CN[C@H]1COC[C@H]1n1ccnn1)c1cccc(Cl)c1	ZINC000819299202	DD	On-Demand	Anodyne	CYP3A4	43	36
C[C@@H]1C[C@H]1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819299209	CD	On-Demand	Anodyne	GPR119	37	44
C[C@@H]1C[C@H]1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819299210	CD	On-Demand	Anodyne	GPR119	37	44
O[C@H](CNCc1ccnc(OC(F)F)c1)c1ccccc1	ZINC000819299218	CF	On-Demand	Anodyne	ADRB3	46	36
O[C@@H](CNCc1ccnc(OC(F)F)c1)c1ccccc1	ZINC000819299219	CF	On-Demand	Anodyne	ADRB3	46	36
C[C@@H]1C[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819299222	BE	On-Demand	Anodyne	ADRB1	34	47
C[C@@H]1C[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819299222	BE	On-Demand	Anodyne	ADRB3	51	47
C[C@@H]1C[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819299222	BE	On-Demand	Anodyne	CYP3A4	46	35
C[C@@H]1C[C@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819299223	BE	On-Demand	Anodyne	ADRB1	34	47
C[C@@H]1C[C@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819299223	BE	On-Demand	Anodyne	ADRB3	51	47
C[C@@H]1C[C@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819299223	BE	On-Demand	Anodyne	CYP3A4	46	35
O[C@H](CNCc1ccnc(OC(F)F)c1)c1cccc(Cl)c1	ZINC000819299226	EG	On-Demand	Anodyne	ADRB1	32	42
O[C@H](CNCc1ccnc(OC(F)F)c1)c1cccc(Cl)c1	ZINC000819299226	EG	On-Demand	Anodyne	ADRB3	48	42
O[C@@H](CNCc1ccnc(OC(F)F)c1)c1cccc(Cl)c1	ZINC000819299228	EG	On-Demand	Anodyne	ADRB1	32	42
O[C@@H](CNCc1ccnc(OC(F)F)c1)c1cccc(Cl)c1	ZINC000819299228	EG	On-Demand	Anodyne	ADRB3	48	42
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819299258	ED	On-Demand	Anodyne	DRD4	25	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819299258	ED	On-Demand	Anodyne	P2RX3	23	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819299258	ED	On-Demand	Anodyne	PLD1	41	34
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819299260	ED	On-Demand	Anodyne	DRD4	25	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819299260	ED	On-Demand	Anodyne	P2RX3	23	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819299260	ED	On-Demand	Anodyne	PLD1	41	34
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819299261	ED	On-Demand	Anodyne	DRD4	25	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819299261	ED	On-Demand	Anodyne	P2RX3	23	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819299261	ED	On-Demand	Anodyne	PLD1	41	34
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819299262	ED	On-Demand	Anodyne	DRD4	25	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819299262	ED	On-Demand	Anodyne	P2RX3	23	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819299262	ED	On-Demand	Anodyne	PLD1	41	34
CCOc1ccc([C@@H](COC)NC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819299274	GH	On-Demand	Anodyne	ADRB2	19	41
CCOc1ccc([C@@H](COC)NC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819299274	GH	On-Demand	Anodyne	ADRB3	27	41
CCOc1ccc([C@@H](COC)NC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819299279	GH	On-Demand	Anodyne	ADRB2	19	41
CCOc1ccc([C@@H](COC)NC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819299279	GH	On-Demand	Anodyne	ADRB3	27	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cnn(CC(F)(F)F)c1)C2	ZINC000819299280	FE	On-Demand	Anodyne	PANC	45	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cnn(CC(F)(F)F)c1)C2	ZINC000819299282	FE	On-Demand	Anodyne	PANC	45	32
CCOc1ccc([C@@H](COC)NC[C@H](O)c2ccc(C)cc2)cc1	ZINC000819299357	EG	On-Demand	Anodyne	ADRB2	22	49
CCOc1ccc([C@@H](COC)NC[C@@H](O)c2ccc(C)cc2)cc1	ZINC000819299360	EG	On-Demand	Anodyne	ADRB2	22	49
COC(=O)N(C)Cc1ccc(NC(=O)c2cc(C)ccc2C2CC2)cc1	ZINC000819299416	FI	On-Demand	Anodyne	KCNK3	50	35
COC(=O)N(C)Cc1ccc(NC(=O)c2cc(C)ccc2C2CC2)cc1	ZINC000819299416	FI	On-Demand	Anodyne	KCNK9	48	35
C[C@@H](CNC[C@@H](O)COc1ccc(F)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299437	FE	On-Demand	Anodyne	ADRB2	46	43
C[C@@H](CNC[C@@H](O)COc1ccc(F)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299437	FE	On-Demand	Anodyne	ADRB1	65	42
C[C@H](CNC[C@H](O)COc1ccc(F)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299438	FE	On-Demand	Anodyne	ADRB2	46	43
C[C@H](CNC[C@H](O)COc1ccc(F)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299438	FE	On-Demand	Anodyne	ADRB1	65	42
C[C@H](CNC[C@@H](O)COc1ccc(F)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299439	FE	On-Demand	Anodyne	ADRB2	46	43
C[C@H](CNC[C@@H](O)COc1ccc(F)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299439	FE	On-Demand	Anodyne	ADRB1	65	42
C[C@@H](CNC[C@H](O)COc1ccc(F)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299440	FE	On-Demand	Anodyne	ADRB2	46	43
C[C@@H](CNC[C@H](O)COc1ccc(F)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299440	FE	On-Demand	Anodyne	ADRB1	65	42
O[C@@H](CNCC1CC(c2ccccc2)C1)c1ccccc1	ZINC000819299452	CH	On-Demand	Anodyne	SLC18A3	21	52
O[C@H](CNCC1CC(c2ccccc2)C1)c1ccccc1	ZINC000819299453	CH	On-Demand	Anodyne	SLC18A3	21	52
O[C@H](CNCC1CC(c2ccccc2)C1)c1ccccc1F	ZINC000819299463	CH	On-Demand	Anodyne	SLC18A3	23	40
O[C@@H](CNCC1CC(c2ccccc2)C1)c1ccccc1F	ZINC000819299464	CH	On-Demand	Anodyne	SLC18A3	23	40
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)C(F)=C1CCC1	ZINC000819299517	EE	On-Demand	Anodyne	HTR1A	15	45
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)C(F)=C1CCC1	ZINC000819299517	EE	On-Demand	Anodyne	DRD4	28	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)C(F)=C1CCC1	ZINC000819299517	EE	On-Demand	Anodyne	P2RX3	32	46
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)C(F)=C1CCC1	ZINC000819299517	EE	On-Demand	Anodyne	SLC27A1	35	42
O[C@H](CNCc1ccnc(OC(F)F)c1)c1cccnc1	ZINC000819299527	CD	On-Demand	Anodyne	ADRB2	21	41
O[C@H](CNCc1ccnc(OC(F)F)c1)c1cccnc1	ZINC000819299527	CD	On-Demand	Anodyne	ADRB1	25	43
O[C@H](CNCc1ccnc(OC(F)F)c1)c1cccnc1	ZINC000819299527	CD	On-Demand	Anodyne	ADRB3	90	44
O[C@@H](CNCc1ccnc(OC(F)F)c1)c1cccnc1	ZINC000819299528	CD	On-Demand	Anodyne	ADRB2	21	41
O[C@@H](CNCc1ccnc(OC(F)F)c1)c1cccnc1	ZINC000819299528	CD	On-Demand	Anodyne	ADRB1	25	43
O[C@@H](CNCc1ccnc(OC(F)F)c1)c1cccnc1	ZINC000819299528	CD	On-Demand	Anodyne	ADRB3	90	44
COc1ccc(C(=O)N2CCC(NC(=O)C(F)=C3CCC3)CC2)cc1OC	ZINC000819299547	GF	On-Demand	Anodyne	EPHX2	19	41
COc1ccc(C(=O)N2CCC(NC(=O)C(F)=C3CCC3)CC2)cc1OC	ZINC000819299547	GF	On-Demand	Anodyne	L3MBTL3	70	37
CCN1CC[C@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000819299569	BC	On-Demand	Anodyne	ADRB1	20	41
CCN1CC[C@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000819299569	BC	On-Demand	Anodyne	ADRB3	69	45
CCN1CC[C@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000819299570	BC	On-Demand	Anodyne	ADRB1	20	41
CCN1CC[C@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000819299570	BC	On-Demand	Anodyne	ADRB3	69	45
O[C@H](CNCC1CC(c2ccccc2)C1)c1ccc(F)cc1	ZINC000819299588	CH	On-Demand	Anodyne	SLC6A3	19	54
O[C@H](CNCC1CC(c2ccccc2)C1)c1ccc(F)cc1	ZINC000819299588	CH	On-Demand	Anodyne	SLC18A3	24	54
O[C@@H](CNCC1CC(c2ccccc2)C1)c1ccc(F)cc1	ZINC000819299589	CH	On-Demand	Anodyne	SLC6A3	19	54
O[C@@H](CNCC1CC(c2ccccc2)C1)c1ccc(F)cc1	ZINC000819299589	CH	On-Demand	Anodyne	SLC18A3	24	54
CC(=O)c1cnc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819299605	FF	On-Demand	Mild	PAPA1_CARPA	37	43
CC(=O)c1cnc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819299606	FF	On-Demand	Mild	PAPA1_CARPA	37	43
C[C@@H](CNC[C@@H](O)COc1ccc(Cl)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299643	FF	On-Demand	Anodyne	ADRB2	43	43
C[C@@H](CNC[C@@H](O)COc1ccc(Cl)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299643	FF	On-Demand	Anodyne	ADRB1	61	42
C[C@@H](CNC[C@@H](O)COc1ccc(Cl)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299643	FF	On-Demand	Anodyne	GRIN1	19	44
C[C@H](CNC[C@H](O)COc1ccc(Cl)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299644	FF	On-Demand	Anodyne	ADRB2	43	43
C[C@H](CNC[C@H](O)COc1ccc(Cl)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299644	FF	On-Demand	Anodyne	ADRB1	61	42
C[C@H](CNC[C@H](O)COc1ccc(Cl)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299644	FF	On-Demand	Anodyne	GRIN1	19	44
C[C@H](CNC[C@@H](O)COc1ccc(Cl)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299645	FF	On-Demand	Anodyne	ADRB2	43	43
C[C@H](CNC[C@@H](O)COc1ccc(Cl)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299645	FF	On-Demand	Anodyne	ADRB1	61	42
C[C@H](CNC[C@@H](O)COc1ccc(Cl)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299645	FF	On-Demand	Anodyne	GRIN1	19	44
C[C@@H](CNC[C@H](O)COc1ccc(Cl)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299646	FF	On-Demand	Anodyne	ADRB2	43	43
C[C@@H](CNC[C@H](O)COc1ccc(Cl)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299646	FF	On-Demand	Anodyne	ADRB1	61	42
C[C@@H](CNC[C@H](O)COc1ccc(Cl)cc1)N(C)C(=O)OC(C)(C)C	ZINC000819299646	FF	On-Demand	Anodyne	GRIN1	19	44
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819299651	FD	On-Demand	Mild	ADRB3	29	47
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819299651	FD	On-Demand	Mild	CTRB_BOVIN	45	32
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819299652	FD	On-Demand	Mild	ADRB3	29	47
C[C@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819299652	FD	On-Demand	Mild	CTRB_BOVIN	45	32
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819299653	FD	On-Demand	Mild	ADRB3	29	47
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819299653	FD	On-Demand	Mild	CTRB_BOVIN	45	32
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819299654	FD	On-Demand	Mild	ADRB3	29	47
C[C@@H](CCNS(=O)(=O)c1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819299654	FD	On-Demand	Mild	CTRB_BOVIN	45	32
O=C(O)[C@@H]1CN(C(=O)CCCOc2ccc3c(c2)CCC3)CCO1	ZINC000819299716	ED	On-Demand	Anodyne	HRH3	16	41
O=C(O)[C@H]1CN(C(=O)CCCOc2ccc3c(c2)CCC3)CCO1	ZINC000819299717	ED	On-Demand	Anodyne	HRH3	16	41
O=C(O)[C@@H]1CN(C(=O)CCCOc2ccc3c(c2)OCO3)CCO1	ZINC000819299732	EC	On-Demand	Anodyne	EDNRB	72	42
O=C(O)[C@@H]1CN(C(=O)CCCOc2ccc3c(c2)OCO3)CCO1	ZINC000819299732	EC	On-Demand	Anodyne	EDNRA	72	42
O=C(O)[C@@H]1CN(C(=O)CCCOc2ccc3c(c2)OCO3)CCO1	ZINC000819299732	EC	On-Demand	Anodyne	CYSLTR2	45	35
O=C(O)[C@H]1CN(C(=O)CCCOc2ccc3c(c2)OCO3)CCO1	ZINC000819299733	EC	On-Demand	Anodyne	EDNRB	72	42
O=C(O)[C@H]1CN(C(=O)CCCOc2ccc3c(c2)OCO3)CCO1	ZINC000819299733	EC	On-Demand	Anodyne	EDNRA	72	42
O=C(O)[C@H]1CN(C(=O)CCCOc2ccc3c(c2)OCO3)CCO1	ZINC000819299733	EC	On-Demand	Anodyne	CYSLTR2	45	35
O=C(O)[C@@H]1CN(C(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)CCO1	ZINC000819299740	EC	On-Demand	Anodyne	DRD4	30	54
O=C(O)[C@@H]1CN(C(=O)C[C@H]2CN(Cc3ccccc3)CCO2)CCO1	ZINC000819299741	EC	On-Demand	Anodyne	DRD4	30	54
O=C(O)[C@H]1CN(C(=O)C[C@@H]2CN(Cc3ccccc3)CCO2)CCO1	ZINC000819299742	EC	On-Demand	Anodyne	DRD4	30	54
O=C(O)[C@H]1CN(C(=O)C[C@H]2CN(Cc3ccccc3)CCO2)CCO1	ZINC000819299743	EC	On-Demand	Anodyne	DRD4	30	54
O=C(O)[C@@H]1CN(C(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)CCO1	ZINC000819299750	FB	On-Demand	Anodyne	PREP	49	41
O=C(O)[C@H]1CN(C(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)CCO1	ZINC000819299751	FB	On-Demand	Anodyne	PREP	49	41
O=C(O)[C@@H]1CN(C(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)CCO1	ZINC000819299752	FB	On-Demand	Anodyne	PREP	49	41
O=C(O)[C@H]1CN(C(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)CCO1	ZINC000819299753	FB	On-Demand	Anodyne	PREP	49	41
O=C(O)[C@H]1CN(C(=O)[C@]2(O)CCN(Cc3ccccc3)C2)CCO1	ZINC000819299768	EB	On-Demand	Anodyne	SIGMAR1	48	37
O=C(O)[C@H]1CN(C(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)CCO1	ZINC000819299769	EB	On-Demand	Anodyne	SIGMAR1	48	37
O=C(O)[C@@H]1CN(C(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)CCO1	ZINC000819299770	EB	On-Demand	Anodyne	SIGMAR1	48	37
O=C(O)[C@@H]1CN(C(=O)[C@]2(O)CCN(Cc3ccccc3)C2)CCO1	ZINC000819299771	EB	On-Demand	Anodyne	SIGMAR1	48	37
O=C(O)[C@@H]1CN(C(=O)CCN2CCN(c3ccccn3)CC2)CCO1	ZINC000819299774	EB	On-Demand	Anodyne	HTR1A	27	57
O=C(O)[C@@H]1CN(C(=O)CCN2CCN(c3ccccn3)CC2)CCO1	ZINC000819299774	EB	On-Demand	Anodyne	DRD2	18	51
O=C(O)[C@@H]1CN(C(=O)CCN2CCN(c3ccccn3)CC2)CCO1	ZINC000819299774	EB	On-Demand	Anodyne	DRD4	41	50
O=C(O)[C@@H]1CN(C(=O)CCN2CCN(c3ccccn3)CC2)CCO1	ZINC000819299774	EB	On-Demand	Anodyne	HTR7	18	48
O=C(O)[C@H]1CN(C(=O)CCN2CCN(c3ccccn3)CC2)CCO1	ZINC000819299775	EB	On-Demand	Anodyne	HTR1A	27	57
O=C(O)[C@H]1CN(C(=O)CCN2CCN(c3ccccn3)CC2)CCO1	ZINC000819299775	EB	On-Demand	Anodyne	DRD2	18	51
O=C(O)[C@H]1CN(C(=O)CCN2CCN(c3ccccn3)CC2)CCO1	ZINC000819299775	EB	On-Demand	Anodyne	DRD4	41	50
O=C(O)[C@H]1CN(C(=O)CCN2CCN(c3ccccn3)CC2)CCO1	ZINC000819299775	EB	On-Demand	Anodyne	HTR7	18	48
C=C(Cl)CSc1nc(C)c(CC(=O)N2CCCC[C@@H]2c2ncon2)s1	ZINC000819299783	GH	On-Demand	Mild	CPT1A	83	37
C=C(Cl)CSc1nc(C)c(CC(=O)N2CCCC[C@H]2c2ncon2)s1	ZINC000819299784	GH	On-Demand	Mild	CPT1A	83	37
O=C(C(F)=C1CCC1)N1CCCC[C@H]1c1ncon1	ZINC000819299817	CF	On-Demand	Anodyne	CPT1A	51	36
O=C(C(F)=C1CCC1)N1CCCC[C@@H]1c1ncon1	ZINC000819299818	CF	On-Demand	Anodyne	CPT1A	51	36
Cc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1C(N)=O	ZINC000819299821	FF	On-Demand	Mild	PAPA1_CARPA	44	44
Cc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1C(N)=O	ZINC000819299822	FF	On-Demand	Mild	PAPA1_CARPA	44	44
CCc1nc([C@H]2CCCCN2C(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)no1	ZINC000819299837	GF	On-Demand	Anodyne	CPT1A	42	40
CCc1nc([C@H]2CCCCN2C(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)no1	ZINC000819299838	GF	On-Demand	Anodyne	CPT1A	42	40
Cn1nccc1[C@H]1[C@H](NC[C@@H](O)c2cccnc2)CC(=O)N1C1CC1	ZINC000819299851	EC	On-Demand	Anodyne	ADRB3	53	41
Cn1nccc1[C@H]1[C@H](NC[C@H](O)c2cccnc2)CC(=O)N1C1CC1	ZINC000819299852	EC	On-Demand	Anodyne	ADRB3	53	41
Cn1nccc1[C@@H]1NC(=O)CC[C@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819299921	ED	On-Demand	Anodyne	ADRB1	25	40
Cn1nccc1[C@@H]1NC(=O)CC[C@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819299921	ED	On-Demand	Anodyne	ADRB3	42	42
Cn1nccc1[C@@H]1NC(=O)CC[C@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819299921	ED	On-Demand	Anodyne	CYP3A4	49	37
Cn1nccc1[C@@H]1NC(=O)CC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819299922	ED	On-Demand	Anodyne	ADRB1	25	40
Cn1nccc1[C@@H]1NC(=O)CC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819299922	ED	On-Demand	Anodyne	ADRB3	42	42
Cn1nccc1[C@@H]1NC(=O)CC[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819299922	ED	On-Demand	Anodyne	CYP3A4	49	37
Cc1nc(C(C)(C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)sc1C	ZINC000819300003	GH	On-Demand	Mild	PAPA1_CARPA	40	47
Cc1nc(C(C)(C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)sc1C	ZINC000819300004	GH	On-Demand	Mild	PAPA1_CARPA	40	47
COc1cccc([S@@](=O)CC(=O)N[C@@H](c2ccccn2)C(C)C)c1	ZINC000819300024	EF	On-Demand	Anodyne	MTNR1A	25	40
COc1cccc([S@@](=O)CC(=O)N[C@@H](c2ccccn2)C(C)C)c1	ZINC000819300024	EF	On-Demand	Anodyne	MTNR1B	28	40
COc1cccc([S@@](=O)CC(=O)N[C@H](c2ccccn2)C(C)C)c1	ZINC000819300026	EF	On-Demand	Anodyne	MTNR1A	25	40
COc1cccc([S@@](=O)CC(=O)N[C@H](c2ccccn2)C(C)C)c1	ZINC000819300026	EF	On-Demand	Anodyne	MTNR1B	28	40
CSCC[C@H](C)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819300082	DE	On-Demand	Anodyne	CTSK	17	50
CSCC[C@@H](C)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819300083	DE	On-Demand	Anodyne	CTSK	17	50
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](Cc2ccc(F)cc2)C1	ZINC000819300176	DF	On-Demand	Anodyne	GRIN2B	33	40
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](Cc2ccc(F)cc2)C1	ZINC000819300176	DF	On-Demand	Anodyne	CCR3	117	37
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](Cc2ccc(F)cc2)C1	ZINC000819300177	DF	On-Demand	Anodyne	GRIN2B	33	40
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](Cc2ccc(F)cc2)C1	ZINC000819300177	DF	On-Demand	Anodyne	CCR3	117	37
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](Cc2ccc(F)cc2)C1	ZINC000819300178	DF	On-Demand	Anodyne	GRIN2B	33	40
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](Cc2ccc(F)cc2)C1	ZINC000819300178	DF	On-Demand	Anodyne	CCR3	117	37
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](Cc2ccc(F)cc2)C1	ZINC000819300179	DF	On-Demand	Anodyne	GRIN2B	33	40
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](Cc2ccc(F)cc2)C1	ZINC000819300179	DF	On-Demand	Anodyne	CCR3	117	37
CCc1nc([C@H]2CCCCN2C(=O)C(F)=C2CCC2)no1	ZINC000819300235	CG	On-Demand	Anodyne	CPT1A	40	38
O=C(/C=C/c1ccc2c(c1)OCO2)Nc1nc(CC(F)(F)F)cs1	ZINC000819300282	FH	On-Demand	Anodyne	DYRK2	51	32
O=C(/C=C\c1ccc2c(c1)OCO2)Nc1nc(CC(F)(F)F)cs1	ZINC000819300283	FH	On-Demand	Anodyne	DYRK2	51	32
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)Nc3nc(CC(F)(F)F)cs3)cc2C1	ZINC000819300284	IJ	On-Demand	Anodyne	MPL	42	33
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)Nc3nc(CC(F)(F)F)cs3)cc2C1	ZINC000819300284	IJ	On-Demand	Anodyne	CPT1A	28	42
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)Nc3nc(CC(F)(F)F)cs3)cc2C1	ZINC000819300284	IJ	On-Demand	Anodyne	CPT1B	38	42
CC(C)(C)OC(=O)N1CCC(CC(=O)Nc2nc(CC(F)(F)F)cs2)CC1	ZINC000819300297	HI	On-Demand	Anodyne	GPR119	42	39
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(-n2cccn2)nc1	ZINC000819300309	FG	On-Demand	Anodyne	MPL	70	41
Cc1ccc(N2CCCC2)c(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819300331	FI	On-Demand	Anodyne	CPT1A	19	40
Cc1ccc(N2CCCC2)c(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819300331	FI	On-Demand	Anodyne	CPT1B	28	40
COc1cccc(C(=O)Nc2nc(CC(F)(F)F)cs2)n1	ZINC000819300343	DF	On-Demand	Anodyne	MPL	31	40
CCC(=O)Nc1ccccc1C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819300345	FH	On-Demand	Anodyne	MAP1	20	42
COc1ccc(C(=O)Nc2nc(CC(F)(F)F)cs2)nc1Cl	ZINC000819300349	FH	On-Demand	Anodyne	CPT1A	27	42
COc1ccc(C(=O)Nc2nc(CC(F)(F)F)cs2)nc1Cl	ZINC000819300349	FH	On-Demand	Anodyne	CPT1B	36	41
C[C@@H](O)C1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819300354	FE	On-Demand	Mild	PAPA1_CARPA	34	44
C[C@@H](O)C1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819300354	FE	On-Demand	Mild	CTSK	18	41
C[C@@H](O)C1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819300355	FE	On-Demand	Mild	PAPA1_CARPA	34	44
C[C@@H](O)C1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819300355	FE	On-Demand	Mild	CTSK	18	41
CCOc1cc(CCCNC(=O)C(F)=C2CCC2)ccc1OC	ZINC000819300362	DH	On-Demand	Anodyne	INHA	40	35
CCOc1cc(CCCNC(=O)C(F)=C2CCC2)ccc1OC	ZINC000819300362	DH	On-Demand	Anodyne	MTNR1B	15	46
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(Cl)nc(Cl)c1	ZINC000819300373	FI	On-Demand	Anodyne	MPL	54	35
COCCN1C(=O)c2ccc(C(=O)Nc3nc(CC(F)(F)F)cs3)cc2S1(=O)=O	ZINC000819300374	IE	On-Demand	Anodyne	MPL	57	36
O=C(/C=C\c1ccccc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819300405	DH	On-Demand	Anodyne	MMP2	15	46
O=C(/C=C\c1ccccc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819300405	DH	On-Demand	Anodyne	HDAC6	26	42
O=C(/C=C/c1ccccc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819300407	DH	On-Demand	Anodyne	MMP2	15	46
O=C(/C=C/c1ccccc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819300407	DH	On-Demand	Anodyne	HDAC6	26	42
O=C(CCCNC(=O)OCc1ccccc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819300408	HH	On-Demand	Anodyne	CAPNS1	42	31
O=C(CCCNC(=O)OCc1ccccc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819300408	HH	On-Demand	Anodyne	HDAC6	18	42
O=C(CCCNC(=O)OCc1ccccc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819300408	HH	On-Demand	Anodyne	CAPN1	44	42
O=C(CCCNC(=O)OCc1ccccc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819300408	HH	On-Demand	Anodyne	CAPN2	65	42
O=C(CCCNC(=O)OCc1ccccc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819300408	HH	On-Demand	Anodyne	NPR	55	33
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000819300417	HK	On-Demand	Anodyne	MPL	50	35
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000819300417	HK	On-Demand	Anodyne	METAP1	42	38
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000819300417	HK	On-Demand	Anodyne	TACR3	17	43
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000819300419	HH	On-Demand	Anodyne	GRIN2B	27	48
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000819300420	HH	On-Demand	Anodyne	GRIN2B	27	48
CCCCCCC(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819300430	CI	On-Demand	Anodyne	HDAC9	19	45
CCCCCCC(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819300430	CI	On-Demand	Anodyne	LASR	40	37
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc2ccccc2c(Cl)n1	ZINC000819300434	FJ	On-Demand	Anodyne	KCNJ11	63	35
CC(C)(C)OC(=O)N1CCC(OCC(=O)Nc2nc(CC(F)(F)F)cs2)CC1	ZINC000819300461	HH	On-Demand	Anodyne	GPR119	37	40
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc2c(F)cccc2s1	ZINC000819300465	FJ	On-Demand	Anodyne	MPL	53	36
C#CCNS(=O)(=O)c1cccc(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819300474	HE	On-Demand	Mild	MPL	40	34
C#CCNS(=O)(=O)c1cccc(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819300474	HE	On-Demand	Mild	CPT1A	27	40
C#CCNS(=O)(=O)c1cccc(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819300474	HE	On-Demand	Mild	CPT1B	39	40
CSCC[C@@H](C)NC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819300486	CE	On-Demand	Anodyne	FPR1	40	38
CSCC[C@H](C)NC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819300487	CE	On-Demand	Anodyne	FPR1	40	38
O=C(C(F)=C1CCC1)N1CCC[C@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000819300495	EI	On-Demand	Anodyne	PRCP	22	50
O=C(C(F)=C1CCC1)N1CCC[C@@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000819300496	EI	On-Demand	Anodyne	PRCP	22	50
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCCC[C@@H]1c1noc(C2CC2)n1	ZINC000819300575	GF	On-Demand	Anodyne	CPT1A	54	49
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819300624	IG	On-Demand	Anodyne	MPL	81	38
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819300624	IG	On-Demand	Anodyne	CPT1A	46	44
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819300624	IG	On-Demand	Anodyne	CPT1B	50	44
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC([C@H](O)c2ccc(F)cc2)CC1	ZINC000819300647	GF	On-Demand	Anodyne	MLNR	28	41
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC([C@H](O)c2ccc(F)cc2)CC1	ZINC000819300647	GF	On-Demand	Anodyne	KCNJ1	48	37
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC([C@@H](O)c2ccc(F)cc2)CC1	ZINC000819300648	GF	On-Demand	Anodyne	MLNR	28	41
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC([C@@H](O)c2ccc(F)cc2)CC1	ZINC000819300648	GF	On-Demand	Anodyne	KCNJ1	48	37
O=Cc1cccc(OCc2ccccc2C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819300650	HJ	On-Demand	Anodyne	OPRL1	15	41
C[C@@H]1SCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H]1C	ZINC000819300657	FF	On-Demand	Mild	PAPA1_CARPA	31	40
C[C@@H]1SCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H]1C	ZINC000819300658	FF	On-Demand	Mild	PAPA1_CARPA	31	40
C[C@@H]1SCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H]1C	ZINC000819300659	FF	On-Demand	Mild	PAPA1_CARPA	31	40
C[C@@H]1SCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H]1C	ZINC000819300660	FF	On-Demand	Mild	PAPA1_CARPA	31	40
O=C(Nc1nc(CC(F)(F)F)cs1)c1cnc(Cl)c2ccccc12	ZINC000819300705	FJ	On-Demand	Anodyne	ATF1	40	35
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819300706	IH	On-Demand	Anodyne	CPT1A	28	43
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819300706	IH	On-Demand	Anodyne	CPT1B	40	43
CN(C)S(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1F	ZINC000819300709	HF	On-Demand	Anodyne	MPL	65	36
CN(C)S(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1F	ZINC000819300709	HF	On-Demand	Anodyne	CPT1A	31	45
CN(C)S(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1F	ZINC000819300709	HF	On-Demand	Anodyne	CPT1B	42	42
CS(=O)(=O)Nc1cccc(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819300719	GF	On-Demand	Anodyne	MPL	61	37
CS(=O)(=O)Nc1cccc(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819300719	GF	On-Demand	Anodyne	CPT1A	29	41
CS(=O)(=O)Nc1cccc(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819300719	GF	On-Demand	Anodyne	CPT1B	42	41
CS(=O)(=O)Nc1cccc(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819300719	GF	On-Demand	Anodyne	GCK	18	43
CS(=O)(=O)Nc1cccc(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819300719	GF	On-Demand	Anodyne	KCNK3	70	35
CS(=O)(=O)Nc1cccc(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819300719	GF	On-Demand	Anodyne	KCNK9	41	34
O=C(Nc1ccccc1C(=O)Nc1nc(CC(F)(F)F)cs1)OCc1ccccc1	ZINC000819300743	IK	On-Demand	Anodyne	CAPNS1	46	31
O=C(Nc1ccccc1C(=O)Nc1nc(CC(F)(F)F)cs1)OCc1ccccc1	ZINC000819300743	IK	On-Demand	Anodyne	CASP9	15	40
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(S(=O)(=O)N2CCCC2)o1	ZINC000819300744	HF	On-Demand	Anodyne	LPL	46	36
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(S(=O)(=O)N2CCCC2)o1	ZINC000819300744	HF	On-Demand	Anodyne	NAMPT	19	40
O=C(Nc1nc(CC(F)(F)F)cs1)c1csc(-c2ccccn2)n1	ZINC000819300756	FI	On-Demand	Anodyne	MPL	46	36
CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819300765	GG	On-Demand	Anodyne	CACNA1B	16	41
CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819300766	GG	On-Demand	Anodyne	CACNA1B	16	41
O=C(Cn1c(S)nnc1-c1ccc(Cl)cc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819300771	II	On-Demand	Anodyne	IMDH_CRYPV	20	42
O=C(Nc1nc(CC(F)(F)F)cs1)c1cccc(Cl)c1O	ZINC000819300774	EH	On-Demand	Anodyne	MPL	43	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCCC[C@H]1c1noc(C2CC2)n1	ZINC000819300776	GF	On-Demand	Anodyne	CPT1A	54	49
O=C(N[C@@H](Cc1ccccc1)C1CC1)C(F)=C1CCC1	ZINC000819300783	CH	On-Demand	Anodyne	ACE	45	36
O=C(N[C@@H](Cc1ccccc1)C1CC1)C(F)=C1CCC1	ZINC000819300783	CH	On-Demand	Anodyne	MME	68	36
O=C(N[C@H](Cc1ccccc1)C1CC1)C(F)=C1CCC1	ZINC000819300784	CH	On-Demand	Anodyne	ACE	45	36
O=C(N[C@H](Cc1ccccc1)C1CC1)C(F)=C1CCC1	ZINC000819300784	CH	On-Demand	Anodyne	MME	68	36
COc1cccc([S@@](=O)CC(=O)N[C@H](C)CCSC)c1	ZINC000819300806	DE	On-Demand	Anodyne	MTNR1A	26	42
COc1cccc([S@@](=O)CC(=O)N[C@H](C)CCSC)c1	ZINC000819300806	DE	On-Demand	Anodyne	MTNR1B	29	42
COc1cccc([S@@](=O)CC(=O)N[C@@H](C)CCSC)c1	ZINC000819300808	DE	On-Demand	Anodyne	MTNR1A	26	42
COc1cccc([S@@](=O)CC(=O)N[C@@H](C)CCSC)c1	ZINC000819300808	DE	On-Demand	Anodyne	MTNR1B	29	42
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000819300813	FH	On-Demand	Anodyne	PRCP	24	49
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000819300814	FH	On-Demand	Anodyne	PRCP	24	49
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000819300815	FH	On-Demand	Anodyne	PRCP	24	49
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000819300816	FH	On-Demand	Anodyne	PRCP	24	49
Cn1nccc1[C@@H]1NC(=O)CC[C@H]1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819300831	FC	On-Demand	Bother	CACNA1D	42	33
Cn1nccc1[C@@H]1NC(=O)CC[C@H]1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819300832	FC	On-Demand	Bother	CACNA1D	42	33
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2ccccc2F)CC1	ZINC000819300941	DG	On-Demand	Anodyne	RBP4	40	39
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2ccccc2F)CC1	ZINC000819300942	DG	On-Demand	Anodyne	RBP4	40	39
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2ccccc2F)CC1	ZINC000819300944	DG	On-Demand	Anodyne	RBP4	40	39
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2ccccc2F)CC1	ZINC000819300946	DG	On-Demand	Anodyne	RBP4	40	39
CC(C)(C)OC(=O)N1CCCc2cc(C(=O)Nc3nc(CC(F)(F)F)cs3)ccc21	ZINC000819300982	IK	On-Demand	Anodyne	MPL	41	36
CC(C)(C)OC(=O)N1CCCc2cc(C(=O)Nc3nc(CC(F)(F)F)cs3)ccc21	ZINC000819300982	IK	On-Demand	Anodyne	CPT1A	33	44
CC(C)(C)OC(=O)N1CCCc2cc(C(=O)Nc3nc(CC(F)(F)F)cs3)ccc21	ZINC000819300982	IK	On-Demand	Anodyne	CPT1B	43	44
O=C(NCCCc1ccc(O)cc1)C(F)=C1CCC1	ZINC000819300983	CF	On-Demand	Anodyne	GRIA1	45	33
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(S[C@@H]2CCOC2=O)cc1	ZINC000819300985	HH	On-Demand	Anodyne	MPL	45	33
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(S[C@H]2CCOC2=O)cc1	ZINC000819300991	HH	On-Demand	Anodyne	MPL	45	33
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccnc(F)c1	ZINC000819300996	DG	On-Demand	Anodyne	MPL	80	39
CCC(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1F	ZINC000819300999	FI	On-Demand	Anodyne	MPL	74	38
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(-c2ccco2)nc2ccccc12	ZINC000819301007	HK	On-Demand	Anodyne	TACR3	15	51
CC(=O)CCCCCCC(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301008	EI	On-Demand	Anodyne	HDAC9	17	45
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819301013	FH	On-Demand	Bother	UL26	15	44
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819301014	FH	On-Demand	Bother	UL26	15	44
O=C(Nc1nc(CC(F)(F)F)cs1)c1cccc(Cl)n1	ZINC000819301019	DH	On-Demand	Anodyne	MPL	43	34
O=C(CCC(=O)N1CCOc2ccccc21)Nc1nc(CC(F)(F)F)cs1	ZINC000819301025	GG	On-Demand	Anodyne	CPT1B	16	43
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(Cl)nc1	ZINC000819301026	DH	On-Demand	Anodyne	MPL	78	36
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819301030	EE	On-Demand	Anodyne	MAPK11	21	49
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819301030	EE	On-Demand	Anodyne	L3MBTL3	49	33
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819301031	EE	On-Demand	Anodyne	MAPK11	21	49
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819301031	EE	On-Demand	Anodyne	L3MBTL3	49	33
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819301033	EE	On-Demand	Anodyne	MAPK11	21	49
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819301033	EE	On-Demand	Anodyne	L3MBTL3	49	33
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819301035	EE	On-Demand	Anodyne	MAPK11	21	49
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819301035	EE	On-Demand	Anodyne	L3MBTL3	49	33
O=C(Nc1ccc(C(=O)Nc2nc(CC(F)(F)F)cs2)cc1)OCC(F)(F)F	ZINC000819301039	IJ	On-Demand	Anodyne	MPL	77	41
O=C(Cc1cccs1)Nc1nc(CC(=O)Nc2nc(CC(F)(F)F)cs2)cs1	ZINC000819301040	II	On-Demand	Anodyne	CA5B	34	46
O=C(Cc1cccs1)Nc1nc(CC(=O)Nc2nc(CC(F)(F)F)cs2)cs1	ZINC000819301040	II	On-Demand	Anodyne	CA5A	34	46
CCc1nc([C@H]2CCCCN2C(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)no1	ZINC000819301047	FF	On-Demand	Anodyne	CPT1A	51	39
O=C(Nc1nc(CC(F)(F)F)cs1)c1ncccn1	ZINC000819301090	CE	On-Demand	Anodyne	MPL	50	35
O=C(Cn1c(SC(F)F)nc2ccccc21)Nc1nc(CC(F)(F)F)cs1	ZINC000819301122	HJ	On-Demand	Anodyne	IMDH_CRYPV	33	41
O=C(Nc1cc(C(F)(F)F)cnc1O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000819301136	JH	On-Demand	Anodyne	GCK	50	35
O=C(Nc1cc(C(F)(F)F)cnc1O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl	ZINC000819301136	JH	On-Demand	Anodyne	TRPM8	43	36
O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819301150	FG	On-Demand	Anodyne	ESR1	54	40
O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819301150	FG	On-Demand	Anodyne	DRD2	15	47
O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819301150	FG	On-Demand	Anodyne	HRH2	21	42
O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819301150	FG	On-Demand	Anodyne	HTR2A	17	48
O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819301150	FG	On-Demand	Anodyne	KCNH2	18	41
O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819301150	FG	On-Demand	Anodyne	ESR2	37	40
O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819301150	FG	On-Demand	Anodyne	LTA4H	65	51
O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819301150	FG	On-Demand	Anodyne	HTR7	18	45
O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819301150	FG	On-Demand	Anodyne	HRH3	43	42
O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819301150	FG	On-Demand	Anodyne	SIGMAR1	23	40
O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819301150	FG	On-Demand	Anodyne	CCR3	34	41
O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819301150	FG	On-Demand	Anodyne	EPHX2	23	41
O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819301150	FG	On-Demand	Anodyne	MCHR1	15	44
O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819301150	FG	On-Demand	Anodyne	CACNA1G	33	45
O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819301150	FG	On-Demand	Anodyne	PSMB1	44	42
O=C(NC1CCN(CCOc2ccc(F)cc2)CC1)C(F)=C1CCC1	ZINC000819301150	FG	On-Demand	Anodyne	MEN1	42	36
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@H]1c1noc(C2CC2)n1	ZINC000819301161	DF	On-Demand	Anodyne	CPT1A	47	48
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@H]1c1noc(C2CC2)n1	ZINC000819301161	DF	On-Demand	Anodyne	ETHR	47	41
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@H]1c1noc(C2CC2)n1	ZINC000819301162	DF	On-Demand	Anodyne	CPT1A	47	48
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@H]1c1noc(C2CC2)n1	ZINC000819301162	DF	On-Demand	Anodyne	ETHR	47	41
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@@H]1c1noc(C2CC2)n1	ZINC000819301163	DF	On-Demand	Anodyne	CPT1A	47	48
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@@H]1c1noc(C2CC2)n1	ZINC000819301163	DF	On-Demand	Anodyne	ETHR	47	41
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@@H]1c1noc(C2CC2)n1	ZINC000819301164	DF	On-Demand	Anodyne	CPT1A	47	48
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@@H]1c1noc(C2CC2)n1	ZINC000819301164	DF	On-Demand	Anodyne	ETHR	47	41
N#CCOc1cccc(CC(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819301179	FG	On-Demand	Mild	CSNK1D	33	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](Cc3ccc(F)cc3)C1)C2	ZINC000819301194	FG	On-Demand	Anodyne	CCR3	111	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](Cc3ccc(F)cc3)C1)C2	ZINC000819301196	FG	On-Demand	Anodyne	CCR3	111	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](Cc3ccc(F)cc3)C1)C2	ZINC000819301201	FG	On-Demand	Anodyne	CCR3	111	38
CC(C)(C)NS(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1F	ZINC000819301204	IH	On-Demand	Anodyne	MPL	66	37
CC(C)(C)NS(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1F	ZINC000819301204	IH	On-Demand	Anodyne	CPT1A	30	42
CC(C)(C)NS(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1F	ZINC000819301204	IH	On-Demand	Anodyne	CPT1B	42	41
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819301205	HK	On-Demand	Anodyne	MPL	40	37
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819301205	HK	On-Demand	Anodyne	PRS	30	40
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819301205	HK	On-Demand	Anodyne	ROCK1	24	44
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819301205	HK	On-Demand	Anodyne	TACR3	21	50
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819301205	HK	On-Demand	Anodyne	ROCK2	17	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](Cc3ccc(F)cc3)C1)C2	ZINC000819301207	FG	On-Demand	Anodyne	CCR3	111	38
C[C@@H](Sc1nc2ccccc2s1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301218	HJ	On-Demand	Anodyne	TMPRSS6	44	32
C[C@H](Sc1nc2ccccc2s1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301223	HJ	On-Demand	Anodyne	TMPRSS6	44	32
C=C(Cl)CNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819301233	CD	On-Demand	Mild	DRD4	41	31
C=C(Cl)CNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819301233	CD	On-Demand	Mild	MTNR1A	42	38
C=C(Cl)CNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819301233	CD	On-Demand	Mild	MTNR1B	40	38
C=C(Cl)CNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819301238	CD	On-Demand	Mild	DRD4	41	31
C=C(Cl)CNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819301238	CD	On-Demand	Mild	MTNR1A	42	38
C=C(Cl)CNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819301238	CD	On-Demand	Mild	MTNR1B	40	38
C=CC(=O)NCc1ccc(C(=O)Nc2nc(CC(F)(F)F)cs2)cc1	ZINC000819301241	FG	On-Demand	Anodyne	MPL	48	36
CON=Cc1ccc(C(=O)Nc2nc(CC(F)(F)F)cs2)cc1	ZINC000819301259	EG	On-Demand	Mild	MPL	49	35
O=C(Nc1nc(CC(F)(F)F)cs1)c1cccnc1Cl	ZINC000819301287	DH	On-Demand	Anodyne	MPL	49	34
O=C(Nc1nc(CC(F)(F)F)cs1)c1cccnc1Cl	ZINC000819301287	DH	On-Demand	Anodyne	G2YM83_BOTF4	80	40
O=C(/C=C/[C@@H]1CCCO1)Nc1ccccc1OCc1cccc(Cl)c1	ZINC000819301298	FJ	On-Demand	Anodyne	PTGER1	47	36
O=C(/C=C\[C@@H]1CCCO1)Nc1ccccc1OCc1cccc(Cl)c1	ZINC000819301300	FJ	On-Demand	Anodyne	PTGER1	47	36
O=C(/C=C\[C@H]1CCCO1)Nc1ccccc1OCc1cccc(Cl)c1	ZINC000819301302	FJ	On-Demand	Anodyne	PTGER1	47	36
Cc1cccc(C(=O)Nc2nc(CC(F)(F)F)cs2)c1NC(=O)c1ccccc1F	ZINC000819301303	IK	On-Demand	Anodyne	GCK	17	41
O=C(/C=C/[C@H]1CCCO1)Nc1ccccc1OCc1cccc(Cl)c1	ZINC000819301305	FJ	On-Demand	Anodyne	PTGER1	47	36
O=C1C[C@@H](NC[C@H](O)c2cccnc2)[C@H](c2cccnc2)N1C1CC1	ZINC000819301313	ED	On-Demand	Anodyne	ADRB3	62	45
O=C1C[C@@H](NC[C@@H](O)c2cccnc2)[C@H](c2cccnc2)N1C1CC1	ZINC000819301316	ED	On-Demand	Anodyne	ADRB3	62	45
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cc(C(F)(F)F)cnc2O)ccc1Cl	ZINC000819301317	JH	On-Demand	Anodyne	TRPM8	49	43
O=C(C(F)=C1CCC1)N1CCCC[C@@H]1c1noc(C2CC2)n1	ZINC000819301321	DG	On-Demand	Anodyne	CPT1A	49	50
O=C(C(F)=C1CCC1)N1CCCC[C@@H]1c1noc(C2CC2)n1	ZINC000819301321	DG	On-Demand	Anodyne	ETHR	27	43
O=C(C(F)=C1CCC1)N1CCCC[C@H]1c1noc(C2CC2)n1	ZINC000819301323	DG	On-Demand	Anodyne	CPT1A	49	50
O=C(C(F)=C1CCC1)N1CCCC[C@H]1c1noc(C2CC2)n1	ZINC000819301323	DG	On-Demand	Anodyne	ETHR	27	43
C#CCOc1ccc(C(=O)Nc2nc(CC(F)(F)F)cs2)cc1	ZINC000819301356	EH	On-Demand	Mild	MPL	74	38
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CCCN1C(=O)C(F)(F)F	ZINC000819301363	GF	On-Demand	Anodyne	ELANE	40	34
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)C(F)(F)F	ZINC000819301365	GF	On-Demand	Anodyne	ELANE	40	34
CC(C)(C)OC(=O)NCc1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccn1	ZINC000819301373	HH	On-Demand	Anodyne	MPL	41	34
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301434	FF	On-Demand	Anodyne	HRH2	19	41
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301434	FF	On-Demand	Anodyne	LTA4H	49	45
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301434	FF	On-Demand	Anodyne	HRH3	32	41
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301434	FF	On-Demand	Anodyne	PSMB1	41	38
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301434	FF	On-Demand	Anodyne	WNT3A	44	33
O=C(/C=C\[C@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301436	FF	On-Demand	Anodyne	HRH2	19	41
O=C(/C=C\[C@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301436	FF	On-Demand	Anodyne	LTA4H	49	45
O=C(/C=C\[C@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301436	FF	On-Demand	Anodyne	HRH3	32	41
O=C(/C=C\[C@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301436	FF	On-Demand	Anodyne	PSMB1	41	38
O=C(/C=C\[C@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301436	FF	On-Demand	Anodyne	WNT3A	44	33
O=C(/C=C/[C@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301441	FF	On-Demand	Anodyne	HRH2	19	41
O=C(/C=C/[C@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301441	FF	On-Demand	Anodyne	LTA4H	49	45
O=C(/C=C/[C@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301441	FF	On-Demand	Anodyne	HRH3	32	41
O=C(/C=C/[C@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301441	FF	On-Demand	Anodyne	PSMB1	41	38
O=C(/C=C/[C@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301441	FF	On-Demand	Anodyne	WNT3A	44	33
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301443	FF	On-Demand	Anodyne	HRH2	19	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301443	FF	On-Demand	Anodyne	LTA4H	49	45
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301443	FF	On-Demand	Anodyne	HRH3	32	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301443	FF	On-Demand	Anodyne	PSMB1	41	38
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000819301443	FF	On-Demand	Anodyne	WNT3A	44	33
Cc1ccc(C(=O)N2CCOCC2)cc1NC(=O)C(F)=C1CCC1	ZINC000819301453	EF	On-Demand	Anodyne	LRRK2	16	40
COc1ncccc1N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819301488	FF	On-Demand	Mild	PAPA1_CARPA	50	43
COc1ncccc1N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819301491	FF	On-Demand	Mild	PAPA1_CARPA	50	43
Cc1cccc(C(C)(C)NC(=O)C(F)=C2CCC2)c1	ZINC000819301496	CH	On-Demand	Anodyne	IMDH_CRYPV	43	32
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C/[C@H]1CCCO1	ZINC000819301518	EE	On-Demand	Anodyne	HTR1A	49	49
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C/[C@H]1CCCO1	ZINC000819301518	EE	On-Demand	Anodyne	DRD2	29	49
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C/[C@H]1CCCO1	ZINC000819301518	EE	On-Demand	Anodyne	DRD4	21	42
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C/[C@H]1CCCO1	ZINC000819301518	EE	On-Demand	Anodyne	HTR2A	32	42
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C/[C@H]1CCCO1	ZINC000819301518	EE	On-Demand	Anodyne	DRD3	33	42
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C/[C@H]1CCCO1	ZINC000819301518	EE	On-Demand	Anodyne	HTR7	55	43
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C\[C@@H]1CCCO1	ZINC000819301521	EE	On-Demand	Anodyne	HTR1A	49	49
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C\[C@@H]1CCCO1	ZINC000819301521	EE	On-Demand	Anodyne	DRD2	29	49
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C\[C@@H]1CCCO1	ZINC000819301521	EE	On-Demand	Anodyne	DRD4	21	42
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C\[C@@H]1CCCO1	ZINC000819301521	EE	On-Demand	Anodyne	HTR2A	32	42
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C\[C@@H]1CCCO1	ZINC000819301521	EE	On-Demand	Anodyne	DRD3	33	42
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C\[C@@H]1CCCO1	ZINC000819301521	EE	On-Demand	Anodyne	HTR7	55	43
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C/[C@@H]1CCCO1	ZINC000819301524	EE	On-Demand	Anodyne	HTR1A	49	49
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C/[C@@H]1CCCO1	ZINC000819301524	EE	On-Demand	Anodyne	DRD2	29	49
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C/[C@@H]1CCCO1	ZINC000819301524	EE	On-Demand	Anodyne	DRD4	21	42
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C/[C@@H]1CCCO1	ZINC000819301524	EE	On-Demand	Anodyne	HTR2A	32	42
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C/[C@@H]1CCCO1	ZINC000819301524	EE	On-Demand	Anodyne	DRD3	33	42
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C/[C@@H]1CCCO1	ZINC000819301524	EE	On-Demand	Anodyne	HTR7	55	43
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C\[C@H]1CCCO1	ZINC000819301527	EE	On-Demand	Anodyne	HTR1A	49	49
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C\[C@H]1CCCO1	ZINC000819301527	EE	On-Demand	Anodyne	DRD2	29	49
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C\[C@H]1CCCO1	ZINC000819301527	EE	On-Demand	Anodyne	DRD4	21	42
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C\[C@H]1CCCO1	ZINC000819301527	EE	On-Demand	Anodyne	HTR2A	32	42
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C\[C@H]1CCCO1	ZINC000819301527	EE	On-Demand	Anodyne	DRD3	33	42
CN(CCN1CCN(c2ccccc2)CC1)C(=O)/C=C\[C@H]1CCCO1	ZINC000819301527	EE	On-Demand	Anodyne	HTR7	55	43
C[C@@H]1CCCC[C@@H]1C(=O)NCCNc1ccccc1	ZINC000819301534	CG	On-Demand	Anodyne	CTSK	26	43
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@@H]1c1ncon1	ZINC000819301535	CD	On-Demand	Anodyne	CPT1A	52	36
C[C@@H]1CCCC[C@H]1C(=O)NCCNc1ccccc1	ZINC000819301537	CG	On-Demand	Anodyne	CTSK	26	43
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@H]1c1ncon1	ZINC000819301538	CD	On-Demand	Anodyne	CPT1A	52	36
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@H]1c1ncon1	ZINC000819301540	CD	On-Demand	Anodyne	CPT1A	52	36
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@@H]1c1ncon1	ZINC000819301543	CD	On-Demand	Anodyne	CPT1A	52	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccccc1OC1CCC1)C2	ZINC000819301554	FG	On-Demand	Anodyne	P2RX7	26	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccccc1OC1CCC1)C2	ZINC000819301556	FG	On-Demand	Anodyne	P2RX7	26	42
O=C(Nc1nc(CC(F)(F)F)cs1)c1cccc(N2CCOC2=O)c1	ZINC000819301562	FG	On-Demand	Anodyne	MPL	42	34
O=C(Nc1nc(CC(F)(F)F)cs1)c1cccc(N2CCOC2=O)c1	ZINC000819301562	FG	On-Demand	Anodyne	CPT1A	26	42
O=C(Nc1nc(CC(F)(F)F)cs1)c1cccc(N2CCOC2=O)c1	ZINC000819301562	FG	On-Demand	Anodyne	CPT1B	35	41
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(F)nc1	ZINC000819301569	DG	On-Demand	Anodyne	MPL	81	39
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(Br)nc1	ZINC000819301582	FH	On-Demand	Anodyne	MPL	69	38
CC[C@H](C)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819301615	FI	On-Demand	Mild	CELA1	23	40
CC[C@H](C)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819301615	FI	On-Demand	Mild	HLA-DRB3	53	36
CC[C@H](C)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819301615	FI	On-Demand	Mild	PAPA1_CARPA	32	40
CC[C@H](C)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819301615	FI	On-Demand	Mild	NTSR1	42	41
CC[C@H](C)[C@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819301617	FI	On-Demand	Mild	CELA1	23	40
CC[C@H](C)[C@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819301617	FI	On-Demand	Mild	HLA-DRB3	53	36
CC[C@H](C)[C@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819301617	FI	On-Demand	Mild	PAPA1_CARPA	32	40
CC[C@H](C)[C@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819301617	FI	On-Demand	Mild	NTSR1	42	41
CC[C@H](C)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819301621	FI	On-Demand	Mild	CELA1	23	40
CC[C@H](C)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819301621	FI	On-Demand	Mild	HLA-DRB3	53	36
CC[C@H](C)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819301621	FI	On-Demand	Mild	PAPA1_CARPA	32	40
CC[C@H](C)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819301621	FI	On-Demand	Mild	NTSR1	42	41
CC[C@H](C)[C@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819301626	FI	On-Demand	Mild	CELA1	23	40
CC[C@H](C)[C@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819301626	FI	On-Demand	Mild	HLA-DRB3	53	36
CC[C@H](C)[C@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819301626	FI	On-Demand	Mild	PAPA1_CARPA	32	40
CC[C@H](C)[C@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819301626	FI	On-Demand	Mild	NTSR1	42	41
CCc1nc([C@H]2CCCCN2C(=O)[C@@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)no1	ZINC000819301634	FE	On-Demand	Anodyne	CPT1A	40	39
CCc1nc([C@H]2CCCCN2C(=O)[C@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)no1	ZINC000819301637	FE	On-Demand	Anodyne	CPT1A	40	39
CCCC[C@H](COC)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819301670	DE	On-Demand	Anodyne	CTSK	21	44
CCCC[C@H](COC)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819301670	DE	On-Demand	Anodyne	PGA5	22	42
CCCC[C@@H](COC)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819301674	DE	On-Demand	Anodyne	CTSK	21	44
CCCC[C@@H](COC)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819301674	DE	On-Demand	Anodyne	PGA5	22	42
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O	ZINC000819301720	IF	On-Demand	Anodyne	MPL	47	35
CCN(C(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)C1CCC1	ZINC000819301722	GF	On-Demand	Anodyne	GPR119	19	40
CCN(C(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)C1CCC1	ZINC000819301725	GF	On-Demand	Anodyne	GPR119	19	40
O=C(/C=C/c1ccc(Cl)s1)Nc1nc(CC(F)(F)F)cs1	ZINC000819301742	FJ	On-Demand	Anodyne	SCAF_EBVB9	20	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC[C@@H]1c1noc(C3CC3)n1)C2	ZINC000819301745	GF	On-Demand	Anodyne	CPT1A	43	47
O=C(/C=C\c1ccc(Cl)s1)Nc1nc(CC(F)(F)F)cs1	ZINC000819301748	FJ	On-Demand	Anodyne	SCAF_EBVB9	20	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCC[C@@H]1c1noc(C3CC3)n1)C2	ZINC000819301750	GF	On-Demand	Anodyne	CPT1A	43	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCC[C@H]1c1noc(C3CC3)n1)C2	ZINC000819301754	GF	On-Demand	Anodyne	CPT1A	43	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC[C@H]1c1noc(C3CC3)n1)C2	ZINC000819301757	GF	On-Demand	Anodyne	CPT1A	43	47
C[C@H]1[C@H](C(=O)Nc2nc(CC(F)(F)F)cs2)CCCN1C(=O)OC(C)(C)C	ZINC000819301758	HI	On-Demand	Anodyne	TRPC6	46	36
C[C@@H]1[C@@H](C(=O)Nc2nc(CC(F)(F)F)cs2)CCCN1C(=O)OC(C)(C)C	ZINC000819301763	HI	On-Demand	Anodyne	TRPC6	46	36
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(Cl)nc(N2CCCC2)c1	ZINC000819301765	GI	On-Demand	Anodyne	MPL	44	38
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CC(c2ccccc2)=NO1	ZINC000819301785	FG	On-Demand	Anodyne	LUCI_PHOPY	42	34
Cn1cncc1[C@H]1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCC(=O)N1C1CC1	ZINC000819301786	GF	On-Demand	Anodyne	ADRB1	21	40
Cn1cncc1[C@H]1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCC(=O)N1C1CC1	ZINC000819301786	GF	On-Demand	Anodyne	ADRB3	36	40
Cn1cncc1[C@H]1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCC(=O)N1C1CC1	ZINC000819301786	GF	On-Demand	Anodyne	CYP3A4	46	34
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CC(c2ccccc2)=NO1	ZINC000819301788	FG	On-Demand	Anodyne	LUCI_PHOPY	42	34
Cn1cncc1[C@H]1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCC(=O)N1C1CC1	ZINC000819301790	GF	On-Demand	Anodyne	ADRB1	21	40
Cn1cncc1[C@H]1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCC(=O)N1C1CC1	ZINC000819301790	GF	On-Demand	Anodyne	ADRB3	36	40
Cn1cncc1[C@H]1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCC(=O)N1C1CC1	ZINC000819301790	GF	On-Demand	Anodyne	CYP3A4	46	34
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1c(F)cccc1N1CCCC1	ZINC000819301796	GF	On-Demand	Anodyne	DRD2	15	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1c(F)cccc1N1CCCC1	ZINC000819301796	GF	On-Demand	Anodyne	KCNQ2	63	37
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1c(F)cccc1N1CCCC1	ZINC000819301797	GF	On-Demand	Anodyne	DRD2	15	42
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1c(F)cccc1N1CCCC1	ZINC000819301797	GF	On-Demand	Anodyne	KCNQ2	63	37
O=C(C(F)=C1CCC1)N1CCC[C@H](N2CCCC2)CC1	ZINC000819301799	CF	On-Demand	Anodyne	L3MBTL3	98	52
O=C(C(F)=C1CCC1)N1CCC[C@@H](N2CCCC2)CC1	ZINC000819301801	CF	On-Demand	Anodyne	L3MBTL3	98	52
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819301816	GG	On-Demand	Anodyne	LTA4H	51	45
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819301816	GG	On-Demand	Anodyne	HRH3	29	46
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819301816	GG	On-Demand	Anodyne	PSMB1	41	38
O=C(/C=C\[C@H]1CCCO1)NC1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819301819	GG	On-Demand	Anodyne	LTA4H	51	45
O=C(/C=C\[C@H]1CCCO1)NC1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819301819	GG	On-Demand	Anodyne	HRH3	29	46
O=C(/C=C\[C@H]1CCCO1)NC1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819301819	GG	On-Demand	Anodyne	PSMB1	41	38
O=C(/C=C/[C@H]1CCCO1)NC1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819301822	GG	On-Demand	Anodyne	LTA4H	51	45
O=C(/C=C/[C@H]1CCCO1)NC1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819301822	GG	On-Demand	Anodyne	HRH3	29	46
O=C(/C=C/[C@H]1CCCO1)NC1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819301822	GG	On-Demand	Anodyne	PSMB1	41	38
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819301826	GG	On-Demand	Anodyne	LTA4H	51	45
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819301826	GG	On-Demand	Anodyne	HRH3	29	46
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000819301826	GG	On-Demand	Anodyne	PSMB1	41	38
CCOC(=O)Nc1ccc(C(=O)Nc2nc(CC(F)(F)F)cs2)cc1	ZINC000819301832	FI	On-Demand	Anodyne	MPL	70	40
CCOC(=O)Nc1ccc(C(=O)Nc2nc(CC(F)(F)F)cs2)cc1	ZINC000819301832	FI	On-Demand	Anodyne	GCK	17	40
COc1ccc(C(=O)Nc2nc(CC(F)(F)F)cs2)nc1I	ZINC000819301844	IH	On-Demand	Anodyne	CPT1A	26	40
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(-n2cnc3ccccc32)nc1	ZINC000819301845	HI	On-Demand	Anodyne	MPL	50	39
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301851	GH	On-Demand	Anodyne	CELA1	40	39
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301851	GH	On-Demand	Anodyne	ELANE	43	37
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301851	GH	On-Demand	Anodyne	LGMN	59	33
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301852	GH	On-Demand	Anodyne	CELA1	40	39
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301852	GH	On-Demand	Anodyne	ELANE	43	37
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301852	GH	On-Demand	Anodyne	LGMN	59	33
CN(C)S(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1Cl	ZINC000819301853	IG	On-Demand	Anodyne	MPL	50	34
CN(C)S(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1Cl	ZINC000819301853	IG	On-Demand	Anodyne	CPT1A	30	44
CN(C)S(=O)(=O)c1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)ccc1Cl	ZINC000819301853	IG	On-Demand	Anodyne	CPT1B	41	41
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccnc(F)c1F	ZINC000819301854	DG	On-Demand	Anodyne	MPL	51	36
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H](F)CC1CCCCC1	ZINC000819301857	EI	On-Demand	Anodyne	GCK	18	40
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H](F)CC1CCCCC1	ZINC000819301858	EI	On-Demand	Anodyne	GCK	18	40
O=C(Nc1nc(CC(F)(F)F)cs1)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819301863	GG	On-Demand	Anodyne	SFRP1	17	42
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(-n2ccc(C(F)(F)F)n2)cc1	ZINC000819301866	HJ	On-Demand	Anodyne	MPL	51	41
O=C(CNC(=O)OCc1ccccc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819301872	FG	On-Demand	Anodyne	CTSB	31	41
O=C(CNC(=O)OCc1ccccc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819301872	FG	On-Demand	Anodyne	CTSK	17	41
O=C(CNC(=O)OCc1ccccc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819301872	FG	On-Demand	Anodyne	CAPNS1	56	32
O=C(CNC(=O)OCc1ccccc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819301872	FG	On-Demand	Anodyne	CAPN1	42	35
O=C(CNC(=O)OCc1ccccc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819301872	FG	On-Demand	Anodyne	CAPN2	71	36
O=C(CNC(=O)OCc1ccccc1)Nc1nc(CC(F)(F)F)cs1	ZINC000819301872	FG	On-Demand	Anodyne	NPR	59	33
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2C(=O)Nc2nc(CC(F)(F)F)cs2)CC1	ZINC000819301875	II	On-Demand	Anodyne	GPR119	36	40
C[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCS1(=O)=O	ZINC000819301877	FD	On-Demand	Mild	PAPA1_CARPA	33	40
CN1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819301897	GG	On-Demand	Mild	PAPA1_CARPA	39	43
CN1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819301897	GG	On-Demand	Mild	FPR1	41	35
CN1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819301898	GG	On-Demand	Mild	PAPA1_CARPA	39	43
CN1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819301898	GG	On-Demand	Mild	FPR1	41	35
CSCC[C@H](C)NC(=O)[C@@H]1C[C@H]1c1ccc(C)cc1	ZINC000819301907	CG	On-Demand	Anodyne	SLC6A3	20	40
CSCC[C@H](C)NC(=O)[C@H]1C[C@@H]1c1ccc(C)cc1	ZINC000819301908	CG	On-Demand	Anodyne	SLC6A3	20	40
CSCC[C@H](C)NC(=O)[C@@H]1C[C@@H]1c1ccc(C)cc1	ZINC000819301909	CG	On-Demand	Anodyne	SLC6A3	20	40
CSCC[C@H](C)NC(=O)[C@H]1C[C@H]1c1ccc(C)cc1	ZINC000819301910	CG	On-Demand	Anodyne	SLC6A3	20	40
COCCC[C@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819301934	EH	On-Demand	Anodyne	ADRB2	18	43
COCCC[C@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819301934	EH	On-Demand	Anodyne	ADRB1	25	43
COCCC[C@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819301934	EH	On-Demand	Anodyne	ADRB3	76	44
COCCC[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819301935	EH	On-Demand	Anodyne	ADRB2	18	43
COCCC[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819301935	EH	On-Demand	Anodyne	ADRB1	25	43
COCCC[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819301935	EH	On-Demand	Anodyne	ADRB3	76	44
COCCC[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819301936	EH	On-Demand	Anodyne	ADRB2	18	43
COCCC[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819301936	EH	On-Demand	Anodyne	ADRB1	25	43
COCCC[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819301936	EH	On-Demand	Anodyne	ADRB3	76	44
COCCC[C@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819301937	EH	On-Demand	Anodyne	ADRB2	18	43
COCCC[C@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819301937	EH	On-Demand	Anodyne	ADRB1	25	43
COCCC[C@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819301937	EH	On-Demand	Anodyne	ADRB3	76	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	MME	34	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	CTSD	17	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	CASP3	18	52
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	BMP1	33	54
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	KLK3	75	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	CTSB	77	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	PAPA1_CARPA	85	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	CYSP_TRYCR	58	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	CTSK	40	50
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	CTSL	56	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	PGA	25	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	CAPNS1	68	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	REN	33	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	MMP11	62	33
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	CTSS	20	50
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	CAPN1	91	50
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	CASP1	22	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	CTRC	15	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	CAPN2	139	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	ACE2	42	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	CASP6	15	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	CASP9	39	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	NPR	81	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	CASP10	34	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	PSMB5	48	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301940	IJ	On-Demand	Anodyne	Q6PRC7_IXORI	16	40
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)Nc1nc(CC(F)(F)F)cs1	ZINC000819301956	GH	On-Demand	Anodyne	LGMN	50	33
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	F2	61	42
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	ACE	29	46
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	FKBP1A	46	40
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	OPRM1	30	42
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	OPRD1	16	40
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	CELA1	30	48
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	GRIN2B	15	40
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	ELANE	65	45
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	CMA1	41	38
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	CTRA_BOVIN	66	36
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	TRY1_BOVIN	98	39
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	CTSG	46	36
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	PREP	75	49
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	CELA2A	55	36
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	REN1	53	31
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	LGMN	90	51
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	KLK5	28	49
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	XIAP	40	38
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	BRCA1	61	32
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	SLC12A5	58	35
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819301957	HH	On-Demand	Anodyne	TMPRSS11D	57	35
O=C(Nc1ccccc1C(=O)Nc1nc(CC(F)(F)F)cs1)c1cccs1	ZINC000819301959	HJ	On-Demand	Anodyne	STK33	33	44
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000819301990	HH	On-Demand	Anodyne	MPL	62	39
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000819301990	HH	On-Demand	Anodyne	CPT1A	26	41
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000819301990	HH	On-Demand	Anodyne	CPT1B	37	41
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000819301990	HH	On-Demand	Anodyne	GCK	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H](N3CCCC3)CC1)C2	ZINC000819302002	FE	On-Demand	Anodyne	L3MBTL3	58	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H](N3CCCC3)CC1)C2	ZINC000819302003	FE	On-Demand	Anodyne	L3MBTL3	58	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H](N3CCCC3)CC1)C2	ZINC000819302004	FE	On-Demand	Anodyne	L3MBTL3	58	39
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H](F)Cc1ccccc1	ZINC000819302005	EH	On-Demand	Anodyne	MME	56	48
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H](F)Cc1ccccc1	ZINC000819302005	EH	On-Demand	Anodyne	ANPEP	59	32
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H](F)Cc1ccccc1	ZINC000819302005	EH	On-Demand	Anodyne	GPR142	61	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H](N3CCCC3)CC1)C2	ZINC000819302006	FE	On-Demand	Anodyne	L3MBTL3	58	39
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H](F)Cc1ccccc1	ZINC000819302008	EH	On-Demand	Anodyne	MME	56	48
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H](F)Cc1ccccc1	ZINC000819302008	EH	On-Demand	Anodyne	ANPEP	59	32
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H](F)Cc1ccccc1	ZINC000819302008	EH	On-Demand	Anodyne	GPR142	61	38
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819302010	IG	On-Demand	Anodyne	CPT1A	26	40
O=C(Cc1cccs1)Nc1nc(CC(F)(F)F)cs1	ZINC000819302024	DG	On-Demand	Anodyne	CA5B	39	47
O=C(Cc1cccs1)Nc1nc(CC(F)(F)F)cs1	ZINC000819302024	DG	On-Demand	Anodyne	CA5A	39	47
O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819302043	FH	On-Demand	Anodyne	ESR1	58	36
O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819302043	FH	On-Demand	Anodyne	HRH2	17	42
O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819302043	FH	On-Demand	Anodyne	ESR2	37	40
O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819302043	FH	On-Demand	Anodyne	LTA4H	67	50
O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819302043	FH	On-Demand	Anodyne	HRH3	43	50
O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819302043	FH	On-Demand	Anodyne	SIGMAR1	22	51
O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819302043	FH	On-Demand	Anodyne	EBP	18	51
O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819302043	FH	On-Demand	Anodyne	EPHX2	18	41
O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819302043	FH	On-Demand	Anodyne	MCHR1	19	40
O=C(NC1CCN(CCOc2ccc(Cl)cc2)CC1)C(F)=C1CCC1	ZINC000819302043	FH	On-Demand	Anodyne	PSMB1	43	41
O=C(Nc1nc(CC(F)(F)F)cs1)c1cccnc1S	ZINC000819302046	DG	On-Demand	Anodyne	MPL	47	34
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(=O)c2ccccc2o1	ZINC000819302054	FH	On-Demand	Anodyne	GPR35	48	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCOc1cccc(OC)c1)C2	ZINC000819302055	GE	On-Demand	Anodyne	DRD4	40	30
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCOc1cccc(OC)c1)C2	ZINC000819302055	GE	On-Demand	Anodyne	HRH2	27	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCOc1cccc(OC)c1)C2	ZINC000819302055	GE	On-Demand	Anodyne	MTNR1A	57	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCOc1cccc(OC)c1)C2	ZINC000819302055	GE	On-Demand	Anodyne	MTNR1B	56	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCOc1cccc(OC)c1)C2	ZINC000819302058	GE	On-Demand	Anodyne	DRD4	40	30
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCOc1cccc(OC)c1)C2	ZINC000819302058	GE	On-Demand	Anodyne	HRH2	27	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCOc1cccc(OC)c1)C2	ZINC000819302058	GE	On-Demand	Anodyne	MTNR1A	57	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCOc1cccc(OC)c1)C2	ZINC000819302058	GE	On-Demand	Anodyne	MTNR1B	56	47
CC(C)(C)OC(=O)N1CCC(C(=O)Nc2nc(CC(F)(F)F)cs2)CC1	ZINC000819302072	GH	On-Demand	Anodyne	GPR119	41	39
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000819302092	GI	On-Demand	Mild	PAPA1_CARPA	42	48
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000819302095	GI	On-Demand	Mild	PAPA1_CARPA	42	48
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000819302098	GI	On-Demand	Mild	PAPA1_CARPA	42	48
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000819302099	GI	On-Demand	Mild	PAPA1_CARPA	42	48
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819302103	GE	On-Demand	Anodyne	CA2	42	39
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819302103	GE	On-Demand	Anodyne	CA5B	44	38
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819302103	GE	On-Demand	Anodyne	CA4	44	38
NS(=O)(=O)c1ccc(F)c(C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819302103	GE	On-Demand	Anodyne	CA5A	46	38
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc([N+](=O)[O-])c(Cl)c1	ZINC000819302123	FI	On-Demand	Bother	MPL	62	37
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(N2CCOC2=O)cc1	ZINC000819302125	FG	On-Demand	Anodyne	MPL	48	33
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(N2CCOC2=O)cc1	ZINC000819302125	FG	On-Demand	Anodyne	CPT1A	24	42
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(N2CCOC2=O)cc1	ZINC000819302125	FG	On-Demand	Anodyne	CPT1B	35	42
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1	ZINC000819302140	GF	On-Demand	Clean	HTR1D	24	41
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCC(CO)CC3)cc2)c1	ZINC000819302140	GF	On-Demand	Clean	CCR3	54	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3ccccc3F)CC1)C2	ZINC000819302157	FG	On-Demand	Anodyne	RBP4	62	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3ccccc3F)CC1)C2	ZINC000819302158	FG	On-Demand	Anodyne	RBP4	62	39
CON(C)C(=O)CCNCc1c(F)cccc1N1CCCC1	ZINC000819302219	DD	On-Demand	Anodyne	KCNQ2	60	36
O=C(c1ccc(F)cc1)[C@H]1CCCN(C(=O)C(F)=C2CCC2)C1	ZINC000819302244	DH	On-Demand	Anodyne	SLC18A3	25	42
O=C(c1ccc(F)cc1)[C@H]1CCCN(C(=O)C(F)=C2CCC2)C1	ZINC000819302244	DH	On-Demand	Anodyne	WNT3A	46	32
O=C(c1ccc(F)cc1)[C@@H]1CCCN(C(=O)C(F)=C2CCC2)C1	ZINC000819302245	DH	On-Demand	Anodyne	SLC18A3	25	42
O=C(c1ccc(F)cc1)[C@@H]1CCCN(C(=O)C(F)=C2CCC2)C1	ZINC000819302245	DH	On-Demand	Anodyne	WNT3A	46	32
O=C(C(F)=C1CCC1)N1CCCN(C2CCCC2)CC1	ZINC000819302250	CF	On-Demand	Anodyne	HRH3	21	41
O=C(C(F)=C1CCC1)N1CCCN(C2CCCC2)CC1	ZINC000819302250	CF	On-Demand	Anodyne	L3MBTL3	62	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCN(C3CCCC3)CC1)C2	ZINC000819302255	FE	On-Demand	Anodyne	HRH3	16	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCN(C3CCCC3)CC1)C2	ZINC000819302256	FE	On-Demand	Anodyne	HRH3	16	48
COc1cccc(OCCCNC(=O)C(F)=C2CCC2)c1	ZINC000819302257	CF	On-Demand	Anodyne	DRD4	45	34
COc1cccc(OCCCNC(=O)C(F)=C2CCC2)c1	ZINC000819302257	CF	On-Demand	Anodyne	HRH2	32	46
COc1cccc(OCCCNC(=O)C(F)=C2CCC2)c1	ZINC000819302257	CF	On-Demand	Anodyne	MTNR1A	77	56
COc1cccc(OCCCNC(=O)C(F)=C2CCC2)c1	ZINC000819302257	CF	On-Demand	Anodyne	MTNR1B	74	56
CC(=O)Nc1cccc(CC(=O)N2CCC([C@H](O)c3ccc(F)cc3)CC2)c1	ZINC000819302380	GG	On-Demand	Anodyne	CCR3	74	41
CC(=O)Nc1cccc(CC(=O)N2CCC([C@H](O)c3ccc(F)cc3)CC2)c1	ZINC000819302380	GG	On-Demand	Anodyne	MLNR	35	41
CC(=O)Nc1cccc(CC(=O)N2CCC([C@H](O)c3ccc(F)cc3)CC2)c1	ZINC000819302380	GG	On-Demand	Anodyne	ST14	42	33
CC(=O)Nc1cccc(CC(=O)N2CCC([C@H](O)c3ccc(F)cc3)CC2)c1	ZINC000819302380	GG	On-Demand	Anodyne	MCHR1	19	41
CC(=O)Nc1cccc(CC(=O)N2CCC([C@@H](O)c3ccc(F)cc3)CC2)c1	ZINC000819302381	GG	On-Demand	Anodyne	CCR3	74	41
CC(=O)Nc1cccc(CC(=O)N2CCC([C@@H](O)c3ccc(F)cc3)CC2)c1	ZINC000819302381	GG	On-Demand	Anodyne	MLNR	35	41
CC(=O)Nc1cccc(CC(=O)N2CCC([C@@H](O)c3ccc(F)cc3)CC2)c1	ZINC000819302381	GG	On-Demand	Anodyne	ST14	42	33
CC(=O)Nc1cccc(CC(=O)N2CCC([C@@H](O)c3ccc(F)cc3)CC2)c1	ZINC000819302381	GG	On-Demand	Anodyne	MCHR1	19	41
CN(CCN1CCN(c2ccccc2)CC1)C(=O)C(F)=C1CCC1	ZINC000819302407	EF	On-Demand	Anodyne	HTR1A	73	50
CN(CCN1CCN(c2ccccc2)CC1)C(=O)C(F)=C1CCC1	ZINC000819302407	EF	On-Demand	Anodyne	DRD2	39	50
CN(CCN1CCN(c2ccccc2)CC1)C(=O)C(F)=C1CCC1	ZINC000819302407	EF	On-Demand	Anodyne	DRD4	34	42
CN(CCN1CCN(c2ccccc2)CC1)C(=O)C(F)=C1CCC1	ZINC000819302407	EF	On-Demand	Anodyne	HTR2A	43	46
CN(CCN1CCN(c2ccccc2)CC1)C(=O)C(F)=C1CCC1	ZINC000819302407	EF	On-Demand	Anodyne	ADRA1A	15	42
CN(CCN1CCN(c2ccccc2)CC1)C(=O)C(F)=C1CCC1	ZINC000819302407	EF	On-Demand	Anodyne	DRD3	41	43
CN(CCN1CCN(c2ccccc2)CC1)C(=O)C(F)=C1CCC1	ZINC000819302407	EF	On-Demand	Anodyne	HTR7	85	48
CS(=O)(=O)c1cccc(Oc2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cc2)c1	ZINC000819302413	GH	On-Demand	Anodyne	PFKFB3	47	32
CS(=O)(=O)c1cccc(Oc2ccc(NC(=O)/C=C/[C@H]3CCCO3)cc2)c1	ZINC000819302414	GH	On-Demand	Anodyne	PFKFB3	47	32
CS(=O)(=O)c1cccc(Oc2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cc2)c1	ZINC000819302415	GH	On-Demand	Anodyne	PFKFB3	47	32
CS(=O)(=O)c1cccc(Oc2ccc(NC(=O)/C=C\[C@H]3CCCO3)cc2)c1	ZINC000819302416	GH	On-Demand	Anodyne	PFKFB3	47	32
CN(Cc1nc[nH]n1)C(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819302425	GG	On-Demand	Anodyne	REN	60	40
CN(Cc1nc[nH]n1)C(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819302426	GG	On-Demand	Anodyne	REN	60	40
O[C@@H](CNCc1c(F)cccc1N1CCCC1)c1ccccc1	ZINC000819302454	DG	On-Demand	Anodyne	KCNQ2	73	40
O[C@H](CNCc1c(F)cccc1N1CCCC1)c1ccccc1	ZINC000819302455	DG	On-Demand	Anodyne	KCNQ2	73	40
O=C(CCc1cccc(OC(F)F)c1)NNC(=O)COCc1ccccc1	ZINC000819302464	GF	On-Demand	Reactive	PLA2G4A	27	45
O=C(CCc1cccc(OC(F)F)c1)NNC(=O)COCc1ccccc1	ZINC000819302464	GF	On-Demand	Reactive	FFAR1	34	43
O=C(CCc1cccc(OC(F)F)c1)NNC(=O)COCc1ccccc1	ZINC000819302464	GF	On-Demand	Reactive	CRTM	51	37
CCCN(C)[C@@H](CNCCC(=O)N(C)OC)c1ccc(Cl)cc1	ZINC000819302476	EF	On-Demand	Anodyne	UTS2	41	33
CCCN(C)[C@H](CNCCC(=O)N(C)OC)c1ccc(Cl)cc1	ZINC000819302477	EF	On-Demand	Anodyne	UTS2	41	33
COC(=O)CN(C(=O)[C@H]1CCCC[C@H]1C)c1ccccc1	ZINC000819302517	CG	On-Demand	Anodyne	AMY2	46	31
COC(=O)CN(C(=O)[C@H]1CCCC[C@@H]1C)c1ccccc1	ZINC000819302520	CG	On-Demand	Anodyne	AMY2	46	31
C[C@H]1c2ccc(F)cc2CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819302541	GH	On-Demand	Mild	PAPA1_CARPA	34	43
C[C@H]1c2ccc(F)cc2CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819302546	GH	On-Demand	Mild	PAPA1_CARPA	34	43
Cc1cc(NC(=O)/C=C\[C@@H]2CCCO2)ccc1OCCN1CCCC1	ZINC000819302604	EG	On-Demand	Anodyne	HTR2A	26	42
Cc1cc(NC(=O)/C=C/[C@@H]2CCCO2)ccc1OCCN1CCCC1	ZINC000819302606	EG	On-Demand	Anodyne	HTR2A	26	42
Cc1cc(NC(=O)/C=C/[C@H]2CCCO2)ccc1OCCN1CCCC1	ZINC000819302608	EG	On-Demand	Anodyne	HTR2A	26	42
Cc1cc(NC(=O)/C=C\[C@H]2CCCO2)ccc1OCCN1CCCC1	ZINC000819302610	EG	On-Demand	Anodyne	HTR2A	26	42
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	ACE	57	41
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	OPRM1	40	44
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	OPRD1	30	40
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	MME	130	47
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	ANPEP	62	34
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	TACR1	19	40
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	FCER2	91	49
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	CTSB	49	44
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	PAPA1_CARPA	69	45
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	CYSP_TRYCR	47	36
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	CTSL	54	44
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	F2R	41	33
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	NPFFR2	48	34
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	TIMP3	81	45
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	TACR3	20	42
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	CAPNS1	60	35
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	MMP3	23	47
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	MMP8	22	44
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	GRIA1	45	37
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	HLA-DRB1	50	33
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	FURIN	56	41
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	CTSS	24	44
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	CAPN1	65	48
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	MMP9	23	45
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	CAPN2	58	40
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	ACE2	63	37
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	PROC	55	45
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	MMP1	27	50
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	FPR1	73	40
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	AMP1_PLAFQ	53	46
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	BLA1_STEMA	50	33
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	PSMB8	40	32
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	NPFFR1	65	34
O=C(N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302628	FG	On-Demand	Anodyne	PDS	41	33
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	ACE	57	41
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	OPRM1	40	44
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	OPRD1	30	40
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	MME	130	47
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	ANPEP	62	34
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	TACR1	19	40
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	FCER2	91	49
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	CTSB	49	44
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	PAPA1_CARPA	69	45
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	CYSP_TRYCR	47	36
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	CTSL	54	44
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	F2R	41	33
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	NPFFR2	48	34
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	TIMP3	81	45
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	TACR3	20	42
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	CAPNS1	60	35
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	MMP3	23	47
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	MMP8	22	44
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	GRIA1	45	37
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	HLA-DRB1	50	33
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	FURIN	56	41
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	CTSS	24	44
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	CAPN1	65	48
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	MMP9	23	45
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	CAPN2	58	40
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	ACE2	63	37
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	PROC	55	45
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	MMP1	27	50
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	FPR1	73	40
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	AMP1_PLAFQ	53	46
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	BLA1_STEMA	50	33
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	PSMB8	40	32
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	NPFFR1	65	34
O=C(N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1)C(F)=C1CCC1	ZINC000819302631	FG	On-Demand	Anodyne	PDS	41	33
C=C(Cl)CNC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819302643	FE	On-Demand	Mild	PREP	24	44
C=C(Cl)CNC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819302645	FE	On-Demand	Mild	PREP	24	44
O=C(c1ccc(F)cc1)[C@@H]1CCCN(C(=O)/C=C/[C@@H]2CCCO2)C1	ZINC000819302679	EF	On-Demand	Anodyne	WNT3A	50	36
O=C(c1ccc(F)cc1)[C@@H]1CCCN(C(=O)/C=C/[C@H]2CCCO2)C1	ZINC000819302681	EF	On-Demand	Anodyne	WNT3A	50	36
O=C(c1ccc(F)cc1)[C@@H]1CCCN(C(=O)/C=C\[C@@H]2CCCO2)C1	ZINC000819302683	EF	On-Demand	Anodyne	WNT3A	50	36
O=C(c1ccc(F)cc1)[C@@H]1CCCN(C(=O)/C=C\[C@H]2CCCO2)C1	ZINC000819302685	EF	On-Demand	Anodyne	WNT3A	50	36
COc1cccc([S@](=O)CC(=O)N2CCN(C3=NCC(C)(C)S3)CC2)c1	ZINC000819302743	GD	On-Demand	Anodyne	DRD4	41	31
COc1cccc([S@@](=O)CC(=O)N2CCN(C3=NCC(C)(C)S3)CC2)c1	ZINC000819302744	GD	On-Demand	Anodyne	DRD4	41	31
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(C2CCCC2)CC1	ZINC000819302745	CE	On-Demand	Anodyne	HRH3	20	44
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(C2CCCC2)CC1	ZINC000819302745	CE	On-Demand	Anodyne	L3MBTL3	55	38
O=C(/C=C\[C@H]1CCCO1)N1CCCN(C2CCCC2)CC1	ZINC000819302746	CE	On-Demand	Anodyne	HRH3	20	44
O=C(/C=C\[C@H]1CCCO1)N1CCCN(C2CCCC2)CC1	ZINC000819302746	CE	On-Demand	Anodyne	L3MBTL3	55	38
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(C2CCCC2)CC1	ZINC000819302747	CE	On-Demand	Anodyne	HRH3	20	44
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(C2CCCC2)CC1	ZINC000819302747	CE	On-Demand	Anodyne	L3MBTL3	55	38
O=C(/C=C/[C@H]1CCCO1)N1CCCN(C2CCCC2)CC1	ZINC000819302748	CE	On-Demand	Anodyne	HRH3	20	44
O=C(/C=C/[C@H]1CCCO1)N1CCCN(C2CCCC2)CC1	ZINC000819302748	CE	On-Demand	Anodyne	L3MBTL3	55	38
Cn1nccc1C1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819302749	GF	On-Demand	Mild	TGM2	15	40
Cn1nccc1C1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819302750	GF	On-Demand	Mild	TGM2	15	40
Cc1ccc(C[C@@H](C)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819302752	GH	On-Demand	Mild	PAPA1_CARPA	60	49
Cc1ccc(C[C@@H](C)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819302752	GH	On-Demand	Mild	CTSK	25	41
Cc1ccc(C[C@@H](C)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819302752	GH	On-Demand	Mild	CTSL	17	49
Cc1ccc(C[C@@H](C)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819302752	GH	On-Demand	Mild	CTSS	15	49
Cc1ccc(C[C@@H](C)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819302752	GH	On-Demand	Mild	FPR1	48	39
Cc1ccc(C[C@@H](C)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819302753	GH	On-Demand	Mild	PAPA1_CARPA	60	49
Cc1ccc(C[C@@H](C)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819302753	GH	On-Demand	Mild	CTSK	25	41
Cc1ccc(C[C@@H](C)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819302753	GH	On-Demand	Mild	CTSL	17	49
Cc1ccc(C[C@@H](C)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819302753	GH	On-Demand	Mild	CTSS	15	49
Cc1ccc(C[C@@H](C)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819302753	GH	On-Demand	Mild	FPR1	48	39
Cc1ccc(C[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819302769	GH	On-Demand	Mild	PAPA1_CARPA	45	45
Cc1ccc(C[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819302769	GH	On-Demand	Mild	FPR1	47	41
COc1cccc(OCCCNC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819302771	DE	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCCNC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819302771	DE	On-Demand	Anodyne	HRH2	28	42
COc1cccc(OCCCNC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819302771	DE	On-Demand	Anodyne	MTNR1A	57	49
COc1cccc(OCCCNC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819302771	DE	On-Demand	Anodyne	MTNR1B	52	49
COc1cccc(OCCCNC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819302772	DE	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCCNC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819302772	DE	On-Demand	Anodyne	HRH2	28	42
COc1cccc(OCCCNC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819302772	DE	On-Demand	Anodyne	MTNR1A	57	49
COc1cccc(OCCCNC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819302772	DE	On-Demand	Anodyne	MTNR1B	52	49
COc1cccc(OCCCNC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819302773	DE	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCCNC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819302773	DE	On-Demand	Anodyne	HRH2	28	42
COc1cccc(OCCCNC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819302773	DE	On-Demand	Anodyne	MTNR1A	57	49
COc1cccc(OCCCNC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819302773	DE	On-Demand	Anodyne	MTNR1B	52	49
COc1cccc(OCCCNC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819302774	DE	On-Demand	Anodyne	DRD4	41	31
COc1cccc(OCCCNC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819302774	DE	On-Demand	Anodyne	HRH2	28	42
COc1cccc(OCCCNC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819302774	DE	On-Demand	Anodyne	MTNR1A	57	49
COc1cccc(OCCCNC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819302774	DE	On-Demand	Anodyne	MTNR1B	52	49
O=C(CCc1cccc(OC(F)F)c1)NCCNc1ccccc1	ZINC000819302802	EG	On-Demand	Anodyne	PLA2G4A	27	42
O=C(CCc1cccc(OC(F)F)c1)NCCNc1ccccc1	ZINC000819302802	EG	On-Demand	Anodyne	MTNR1A	16	42
O=C(CCc1cccc(OC(F)F)c1)NCCNc1ccccc1	ZINC000819302802	EG	On-Demand	Anodyne	MTNR1B	17	42
O=C(CCc1cccc(OC(F)F)c1)NCCNc1ccccc1	ZINC000819302802	EG	On-Demand	Anodyne	FFAR1	24	45
O=C(CCc1cccc(OC(F)F)c1)NCCNc1ccccc1	ZINC000819302802	EG	On-Demand	Anodyne	CRTM	60	43
O=C(CCc1cccc(OC(F)F)c1)NCCNc1ccccc1	ZINC000819302802	EG	On-Demand	Anodyne	PDS	51	33
C=C(Cl)CNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819302875	CG	On-Demand	Mild	CRTM	46	35
CCc1nnnn1-c1ccccc1NC(=O)C(F)=C1CCC1	ZINC000819302879	DF	On-Demand	Anodyne	KCNQ2	65	35
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302926	GF	On-Demand	Anodyne	OPRM1	29	45
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302926	GF	On-Demand	Anodyne	OPRD1	16	42
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302926	GF	On-Demand	Anodyne	MME	58	41
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302926	GF	On-Demand	Anodyne	FCER2	49	50
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302926	GF	On-Demand	Anodyne	PAPA1_CARPA	44	40
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302926	GF	On-Demand	Anodyne	CTSL	36	40
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302926	GF	On-Demand	Anodyne	NPFFR2	41	36
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302926	GF	On-Demand	Anodyne	TIMP3	80	44
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302926	GF	On-Demand	Anodyne	MMP3	17	42
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302926	GF	On-Demand	Anodyne	REN	69	40
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302926	GF	On-Demand	Anodyne	FURIN	47	38
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302926	GF	On-Demand	Anodyne	CTSS	20	40
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302926	GF	On-Demand	Anodyne	CAPN1	45	42
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302926	GF	On-Demand	Anodyne	MMP9	15	44
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302926	GF	On-Demand	Anodyne	PROC	60	46
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302926	GF	On-Demand	Anodyne	MMP1	18	50
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302926	GF	On-Demand	Anodyne	NPFFR1	53	36
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302927	GF	On-Demand	Anodyne	OPRM1	29	45
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302927	GF	On-Demand	Anodyne	OPRD1	16	42
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302927	GF	On-Demand	Anodyne	MME	58	41
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302927	GF	On-Demand	Anodyne	FCER2	49	50
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302927	GF	On-Demand	Anodyne	PAPA1_CARPA	44	40
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302927	GF	On-Demand	Anodyne	CTSL	36	40
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302927	GF	On-Demand	Anodyne	NPFFR2	41	36
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302927	GF	On-Demand	Anodyne	TIMP3	80	44
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302927	GF	On-Demand	Anodyne	MMP3	17	42
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302927	GF	On-Demand	Anodyne	REN	69	40
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302927	GF	On-Demand	Anodyne	FURIN	47	38
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302927	GF	On-Demand	Anodyne	CTSS	20	40
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302927	GF	On-Demand	Anodyne	CAPN1	45	42
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302927	GF	On-Demand	Anodyne	MMP9	15	44
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302927	GF	On-Demand	Anodyne	PROC	60	46
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302927	GF	On-Demand	Anodyne	MMP1	18	50
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302927	GF	On-Demand	Anodyne	NPFFR1	53	36
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302928	GF	On-Demand	Anodyne	OPRM1	29	45
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302928	GF	On-Demand	Anodyne	OPRD1	16	42
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302928	GF	On-Demand	Anodyne	MME	58	41
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302928	GF	On-Demand	Anodyne	FCER2	49	50
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302928	GF	On-Demand	Anodyne	PAPA1_CARPA	44	40
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302928	GF	On-Demand	Anodyne	CTSL	36	40
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302928	GF	On-Demand	Anodyne	NPFFR2	41	36
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302928	GF	On-Demand	Anodyne	TIMP3	80	44
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302928	GF	On-Demand	Anodyne	MMP3	17	42
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302928	GF	On-Demand	Anodyne	REN	69	40
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302928	GF	On-Demand	Anodyne	FURIN	47	38
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302928	GF	On-Demand	Anodyne	CTSS	20	40
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302928	GF	On-Demand	Anodyne	CAPN1	45	42
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302928	GF	On-Demand	Anodyne	MMP9	15	44
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302928	GF	On-Demand	Anodyne	PROC	60	46
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302928	GF	On-Demand	Anodyne	MMP1	18	50
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302928	GF	On-Demand	Anodyne	NPFFR1	53	36
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302929	GF	On-Demand	Anodyne	OPRM1	29	45
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302929	GF	On-Demand	Anodyne	OPRD1	16	42
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302929	GF	On-Demand	Anodyne	MME	58	41
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302929	GF	On-Demand	Anodyne	FCER2	49	50
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302929	GF	On-Demand	Anodyne	PAPA1_CARPA	44	40
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302929	GF	On-Demand	Anodyne	CTSL	36	40
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302929	GF	On-Demand	Anodyne	NPFFR2	41	36
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302929	GF	On-Demand	Anodyne	TIMP3	80	44
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302929	GF	On-Demand	Anodyne	MMP3	17	42
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302929	GF	On-Demand	Anodyne	REN	69	40
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302929	GF	On-Demand	Anodyne	FURIN	47	38
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302929	GF	On-Demand	Anodyne	CTSS	20	40
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302929	GF	On-Demand	Anodyne	CAPN1	45	42
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302929	GF	On-Demand	Anodyne	MMP9	15	44
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302929	GF	On-Demand	Anodyne	PROC	60	46
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302929	GF	On-Demand	Anodyne	MMP1	18	50
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)NCc1ccccc1	ZINC000819302929	GF	On-Demand	Anodyne	NPFFR1	53	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3nc4ccccc4o3)CC1)C2	ZINC000819302939	GE	On-Demand	Anodyne	SSTR1	65	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3nc4ccccc4o3)CC1)C2	ZINC000819302939	GE	On-Demand	Anodyne	NPBWR1	68	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3nc4ccccc4o3)CC1)C2	ZINC000819302940	GE	On-Demand	Anodyne	SSTR1	65	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3nc4ccccc4o3)CC1)C2	ZINC000819302940	GE	On-Demand	Anodyne	NPBWR1	68	49
CN(C[C@@H](O)CNCc1c(F)cccc1N1CCCC1)C(=O)OC(C)(C)C	ZINC000819302946	GF	On-Demand	Anodyne	KCNQ2	60	37
CN(C[C@H](O)CNCc1c(F)cccc1N1CCCC1)C(=O)OC(C)(C)C	ZINC000819302947	GF	On-Demand	Anodyne	KCNQ2	60	37
CC(C)n1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819302970	FF	On-Demand	Mild	PAPA1_CARPA	49	48
CC(C)n1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819302970	FF	On-Demand	Mild	CTSK	20	48
CC(C)n1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819302970	FF	On-Demand	Mild	FPR1	41	37
CC(C)n1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819302971	FF	On-Demand	Mild	PAPA1_CARPA	49	48
CC(C)n1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819302971	FF	On-Demand	Mild	CTSK	20	48
CC(C)n1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819302971	FF	On-Demand	Mild	FPR1	41	37
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1c(F)cccc1N1CCCC1	ZINC000819302983	GF	On-Demand	Anodyne	KCNQ2	56	36
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1c(F)cccc1N1CCCC1	ZINC000819302984	GF	On-Demand	Anodyne	KCNQ2	56	36
C[C@H]1c2c(F)cccc2CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819302989	GH	On-Demand	Mild	PAPA1_CARPA	35	43
C[C@H]1c2c(F)cccc2CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819302990	GH	On-Demand	Mild	PAPA1_CARPA	35	43
Cc1cccc(C(C)(C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819303020	FH	On-Demand	Mild	PAPA1_CARPA	45	45
Cc1cccc(C(C)(C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819303020	FH	On-Demand	Mild	CTSL	20	45
Cc1cccc(C(C)(C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819303020	FH	On-Demand	Mild	CTSS	15	47
Cc1cccc(C(C)(C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819303020	FH	On-Demand	Mild	FPR1	41	38
Cc1cccc(C(C)(C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819303021	FH	On-Demand	Mild	PAPA1_CARPA	45	45
Cc1cccc(C(C)(C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819303021	FH	On-Demand	Mild	CTSL	20	45
Cc1cccc(C(C)(C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819303021	FH	On-Demand	Mild	CTSS	15	47
Cc1cccc(C(C)(C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819303021	FH	On-Demand	Mild	FPR1	41	38
CC(=O)N(C)c1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819303024	GG	On-Demand	Mild	PAPA1_CARPA	56	46
CC(=O)N(C)c1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819303024	GG	On-Demand	Mild	CTSK	15	41
CC(=O)N(C)c1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819303024	GG	On-Demand	Mild	FPR1	44	39
CC(=O)N(C)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819303025	GG	On-Demand	Mild	PAPA1_CARPA	56	46
CC(=O)N(C)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819303025	GG	On-Demand	Mild	CTSK	15	41
CC(=O)N(C)c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819303025	GG	On-Demand	Mild	FPR1	44	39
C[C@H](CC(=O)NNC(=O)COCc1ccccc1)n1cccn1	ZINC000819303050	DD	On-Demand	Reactive	CAPN2	45	32
C[C@@H](CC(=O)NNC(=O)COCc1ccccc1)n1cccn1	ZINC000819303052	DD	On-Demand	Reactive	CAPN2	45	32
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1nccs1	ZINC000819303077	FG	On-Demand	Mild	PAPA1_CARPA	41	45
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nccs1	ZINC000819303080	FG	On-Demand	Mild	PAPA1_CARPA	41	45
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1nccs1	ZINC000819303081	FG	On-Demand	Mild	PAPA1_CARPA	41	45
COCCCOc1ccc(CNC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819303082	GH	On-Demand	Anodyne	ADRB2	27	43
COCCCOc1ccc(CNC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819303082	GH	On-Demand	Anodyne	ADRB3	39	43
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nccs1	ZINC000819303083	FG	On-Demand	Mild	PAPA1_CARPA	41	45
COCCCOc1ccc(CNC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819303084	GH	On-Demand	Anodyne	ADRB2	27	43
COCCCOc1ccc(CNC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819303084	GH	On-Demand	Anodyne	ADRB3	39	43
COc1ccccc1[C@@H]1CCN(C(=O)C(F)=C2CCC2)C1	ZINC000819303100	CG	On-Demand	Anodyne	RBP4	49	38
COc1ccccc1[C@H]1CCN(C(=O)C(F)=C2CCC2)C1	ZINC000819303102	CG	On-Demand	Anodyne	RBP4	49	38
COCCCOc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819303133	EH	On-Demand	Anodyne	ADRB2	49	52
COCCCOc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819303133	EH	On-Demand	Anodyne	ADRB1	65	52
COCCCOc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819303133	EH	On-Demand	Anodyne	ADRB3	72	58
COCCCOc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819303136	EH	On-Demand	Anodyne	ADRB2	49	52
COCCCOc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819303136	EH	On-Demand	Anodyne	ADRB1	65	52
COCCCOc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819303136	EH	On-Demand	Anodyne	ADRB3	72	58
C=C(Cl)CNC(=O)c1nn(-c2cc(C)cc(F)c2)c2c1CCC2	ZINC000819303156	EG	On-Demand	Mild	CNR1	40	32
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](N2CCCC2)CC1	ZINC000819303184	CE	On-Demand	Anodyne	L3MBTL3	93	50
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H](N2CCCC2)CC1	ZINC000819303186	CE	On-Demand	Anodyne	L3MBTL3	93	50
COCCCOc1ccc(CNC[C@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819303187	EH	On-Demand	Anodyne	ADRB2	26	42
CCOc1cc(CCCNC(=O)/C=C\[C@H]2CCCO2)ccc1OC	ZINC000819303188	EF	On-Demand	Anodyne	SSTR5	55	36
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](N2CCCC2)CC1	ZINC000819303189	CE	On-Demand	Anodyne	L3MBTL3	93	50
COCCCOc1ccc(CNC[C@@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819303190	EH	On-Demand	Anodyne	ADRB2	26	42
CCOc1cc(CCCNC(=O)/C=C/[C@H]2CCCO2)ccc1OC	ZINC000819303191	EF	On-Demand	Anodyne	SSTR5	55	36
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](N2CCCC2)CC1	ZINC000819303192	CE	On-Demand	Anodyne	L3MBTL3	93	50
CCOc1cc(CCCNC(=O)/C=C\[C@@H]2CCCO2)ccc1OC	ZINC000819303194	EF	On-Demand	Anodyne	SSTR5	55	36
CCOc1cc(CCCNC(=O)/C=C/[C@@H]2CCCO2)ccc1OC	ZINC000819303196	EF	On-Demand	Anodyne	SSTR5	55	36
COCCCOc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819303212	DE	On-Demand	Anodyne	ADRB2	43	54
COCCCOc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819303212	DE	On-Demand	Anodyne	ADRB1	45	55
COCCCOc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819303212	DE	On-Demand	Anodyne	ADRB3	113	55
COCCCOc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819303215	DE	On-Demand	Anodyne	ADRB2	43	54
COCCCOc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819303215	DE	On-Demand	Anodyne	ADRB1	45	55
COCCCOc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819303215	DE	On-Demand	Anodyne	ADRB3	113	55
O[C@H](CNC[C@H](OCC1CC1)c1ccc(Cl)cc1)c1cccnc1	ZINC000819303218	EH	On-Demand	Anodyne	ADRB3	75	44
O[C@@H](CNC[C@H](OCC1CC1)c1ccc(Cl)cc1)c1cccnc1	ZINC000819303220	EH	On-Demand	Anodyne	ADRB3	75	44
O[C@@H](CNC[C@@H](OCC1CC1)c1ccc(Cl)cc1)c1cccnc1	ZINC000819303222	EH	On-Demand	Anodyne	ADRB3	75	44
O[C@H](CNC[C@@H](OCC1CC1)c1ccc(Cl)cc1)c1cccnc1	ZINC000819303225	EH	On-Demand	Anodyne	ADRB3	75	44
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1cccc(Cl)c1Cl	ZINC000819303250	GD	On-Demand	Anodyne	ADRB2	28	46
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1cccc(Cl)c1Cl	ZINC000819303250	GD	On-Demand	Anodyne	ADRB1	42	43
O=S(=O)(NCCNC[C@@H](O)c1cccnc1)c1cccc(Cl)c1Cl	ZINC000819303250	GD	On-Demand	Anodyne	ADRB3	126	52
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1cccc(Cl)c1Cl	ZINC000819303252	GD	On-Demand	Anodyne	ADRB2	28	46
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1cccc(Cl)c1Cl	ZINC000819303252	GD	On-Demand	Anodyne	ADRB1	42	43
O=S(=O)(NCCNC[C@H](O)c1cccnc1)c1cccc(Cl)c1Cl	ZINC000819303252	GD	On-Demand	Anodyne	ADRB3	126	52
CN(C)CCOc1ccccc1N1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819303267	FE	On-Demand	Anodyne	HTR1A	40	37
CN(C)CCOc1ccccc1N1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819303269	FE	On-Demand	Anodyne	HTR1A	40	37
CN(C)CCOc1ccccc1N1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819303271	FE	On-Demand	Anodyne	HTR1A	40	37
CN(C)CCOc1ccccc1N1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819303273	FE	On-Demand	Anodyne	HTR1A	40	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H](N2CCCC2)CC1	ZINC000819303307	FE	On-Demand	Anodyne	L3MBTL3	82	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H](N2CCCC2)CC1	ZINC000819303308	FE	On-Demand	Anodyne	L3MBTL3	82	43
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)COCc1ccccc1	ZINC000819303324	DE	On-Demand	Reactive	SLC12A5	60	38
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)COCc1ccccc1	ZINC000819303325	DE	On-Demand	Reactive	SLC12A5	60	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(C)cc1OCCN(C)C)C2	ZINC000819303328	GF	On-Demand	Anodyne	ROCK2	16	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(C)cc1OCCN(C)C)C2	ZINC000819303336	GF	On-Demand	Anodyne	ROCK2	16	43
COCCCOc1ccc(CNC[C@H](O)c2ccccc2Cl)cc1	ZINC000819303380	EH	On-Demand	Anodyne	ADRB2	25	45
Cc1cc(F)ccc1[C@@H](O)CNCc1c(F)cccc1N1CCCC1	ZINC000819303434	EH	On-Demand	Anodyne	KCNQ2	41	37
CCCN(C)[C@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819303556	EG	On-Demand	Anodyne	ADRB3	76	45
CCCN(C)[C@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819303556	EG	On-Demand	Anodyne	CYP51A1	18	45
CCCN(C)[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819303557	EG	On-Demand	Anodyne	ADRB3	76	45
CCCN(C)[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819303557	EG	On-Demand	Anodyne	CYP51A1	18	45
CCCN(C)[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819303558	EG	On-Demand	Anodyne	ADRB3	76	45
CCCN(C)[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819303558	EG	On-Demand	Anodyne	CYP51A1	18	45
CCCN(C)[C@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819303559	EG	On-Demand	Anodyne	ADRB3	76	45
CCCN(C)[C@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819303559	EG	On-Demand	Anodyne	CYP51A1	18	45
CN1C[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819303560	FD	On-Demand	Mild	PAPA1_CARPA	36	44
CN1C[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819303561	FD	On-Demand	Mild	PAPA1_CARPA	36	44
CN1C[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819303562	FD	On-Demand	Mild	PAPA1_CARPA	36	44
CN1C[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCC1=O	ZINC000819303563	FD	On-Demand	Mild	PAPA1_CARPA	36	44
O=S(=O)(c1cccs1)N1CC[C@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819303594	FE	On-Demand	Anodyne	GCKR	35	40
O=S(=O)(c1cccs1)N1CC[C@@H](CNC[C@@H](O)c2ccccc2)C1	ZINC000819303595	FE	On-Demand	Anodyne	GCKR	35	40
O=S(=O)(c1cccs1)N1CC[C@@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819303596	FE	On-Demand	Anodyne	GCKR	35	40
O=S(=O)(c1cccs1)N1CC[C@H](CNC[C@H](O)c2ccccc2)C1	ZINC000819303597	FE	On-Demand	Anodyne	GCKR	35	40
O=C(/C=C\[C@H]1CCCO1)NCCCCc1ccc([N+](=O)[O-])cc1	ZINC000819303617	DF	On-Demand	Bother	LUXR	16	40
O=C(/C=C/[C@@H]1CCCO1)NCCCCc1ccc([N+](=O)[O-])cc1	ZINC000819303618	DF	On-Demand	Bother	LUXR	16	40
O=C(/C=C/[C@H]1CCCO1)NCCCCc1ccc([N+](=O)[O-])cc1	ZINC000819303619	DF	On-Demand	Bother	LUXR	16	40
O=C(/C=C\[C@@H]1CCCO1)NCCCCc1ccc([N+](=O)[O-])cc1	ZINC000819303620	DF	On-Demand	Bother	LUXR	16	40
COCCCOc1ccc(CNC[C@H](O)c2ccc(Br)cc2)cc1	ZINC000819303656	GH	On-Demand	Anodyne	ADRB2	25	43
COCCCOc1ccc(CNC[C@@H](O)c2ccc(Br)cc2)cc1	ZINC000819303657	GH	On-Demand	Anodyne	ADRB2	25	43
COCCCOc1ccc(CNC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819303670	FH	On-Demand	Anodyne	LEF	46	35
COCCCOc1ccc(CNC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819303671	FH	On-Demand	Anodyne	LEF	46	35
CS(=O)(=O)c1ccc([C@@H](O)CNCCn2ccc3cc(Cl)ccc32)cc1	ZINC000819303680	GG	On-Demand	Anodyne	RORC	30	45
CS(=O)(=O)c1ccc([C@H](O)CNCCn2ccc3cc(Cl)ccc32)cc1	ZINC000819303681	GG	On-Demand	Anodyne	RORC	30	45
COc1ccc(OC)c([C@H](O)CNCCCc2cccc(C)n2)c1	ZINC000819303693	EF	On-Demand	Anodyne	ADRB2	24	44
COc1ccc(OC)c([C@H](O)CNCCCc2cccc(C)n2)c1	ZINC000819303693	EF	On-Demand	Anodyne	MTNR1A	22	43
CC[C@@H]1CCCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819303710	FH	On-Demand	Mild	PAPA1_CARPA	30	42
CC[C@H]1CCCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819303711	FH	On-Demand	Mild	PAPA1_CARPA	30	42
CC[C@@H]1CCCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819303712	FH	On-Demand	Mild	PAPA1_CARPA	30	42
CC[C@H]1CCCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819303713	FH	On-Demand	Mild	PAPA1_CARPA	30	42
C[C@@H]1CS(=O)(=O)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819303725	FD	On-Demand	Mild	PAPA1_CARPA	34	42
C[C@@H]1CS(=O)(=O)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819303726	FD	On-Demand	Mild	PAPA1_CARPA	34	42
COCCCOc1ccc(CNCCS(C)(=O)=O)cc1	ZINC000819303742	DD	On-Demand	Anodyne	LPAR2	33	47
COCCCOc1ccc(CNCCS(C)(=O)=O)cc1	ZINC000819303742	DD	On-Demand	Anodyne	S1PR3	16	47
COCCCOc1ccc(CNCCS(C)(=O)=O)cc1	ZINC000819303742	DD	On-Demand	Anodyne	S1PR2	33	47
O[C@H](CNCC1(c2ccc(Br)s2)CCC1)c1cccnc1	ZINC000819303748	FH	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNCC1(c2ccc(Br)s2)CCC1)c1cccnc1	ZINC000819303748	FH	On-Demand	Anodyne	ADRB1	21	40
O[C@H](CNCC1(c2ccc(Br)s2)CCC1)c1cccnc1	ZINC000819303748	FH	On-Demand	Anodyne	ADRB3	87	43
O[C@@H](CNCC1(c2ccc(Br)s2)CCC1)c1cccnc1	ZINC000819303749	FH	On-Demand	Anodyne	ADRB2	20	40
O[C@@H](CNCC1(c2ccc(Br)s2)CCC1)c1cccnc1	ZINC000819303749	FH	On-Demand	Anodyne	ADRB1	21	40
O[C@@H](CNCC1(c2ccc(Br)s2)CCC1)c1cccnc1	ZINC000819303749	FH	On-Demand	Anodyne	ADRB3	87	43
C=CCOc1ccc(CNC[C@H](O)c2ccc(F)cc2C)cc1	ZINC000819303812	DH	On-Demand	Mild	LEF	59	37
C=CCOc1ccc(CNC[C@@H](O)c2ccc(F)cc2C)cc1	ZINC000819303813	DH	On-Demand	Mild	LEF	59	37
CS(=O)(=O)c1ccc([C@@H](O)CNCc2c(F)cccc2N2CCCC2)cc1	ZINC000819303834	GF	On-Demand	Anodyne	KCNQ2	58	36
CS(=O)(=O)c1ccc([C@H](O)CNCc2c(F)cccc2N2CCCC2)cc1	ZINC000819303835	GF	On-Demand	Anodyne	KCNQ2	58	36
COCCCOc1ccc(CNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819303865	EH	On-Demand	Anodyne	ADRB2	26	41
COCCCOc1ccc(CNC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819303865	EH	On-Demand	Anodyne	ADRB3	28	41
CCOC(=O)C1CCN(C(=O)c2ccc(NC(=O)C(F)=C3CCC3)cc2)CC1	ZINC000819303873	GG	On-Demand	Anodyne	EPHX2	21	40
CCOC(=O)C1CCN(C(=O)c2ccc(NC(=O)C(F)=C3CCC3)cc2)CC1	ZINC000819303873	GG	On-Demand	Anodyne	PTR1	53	40
CCOC(=O)C1CCN(C(=O)c2ccc(NC(=O)C(F)=C3CCC3)cc2)CC1	ZINC000819303873	GG	On-Demand	Anodyne	L3MBTL3	84	39
COCCCOc1ccc(CNC[C@H](O)c2ccc(F)cc2C)cc1	ZINC000819303874	EG	On-Demand	Anodyne	LEF	63	39
COCCCOc1ccc(CNC[C@@H](O)c2ccc(F)cc2C)cc1	ZINC000819303875	EG	On-Demand	Anodyne	LEF	63	39
C=CCOc1ccc(CNCCC(=O)Nc2ccc(N(C)C)cc2)cc1	ZINC000819303889	FG	On-Demand	Mild	LTA4H	32	41
COCCCOc1ccc(CNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819303921	FG	On-Demand	Anodyne	LEF	47	37
COCCCOc1ccc(CNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819303923	FG	On-Demand	Anodyne	LEF	47	37
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819303933	EG	On-Demand	Anodyne	GRIN2B	54	35
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819303933	EG	On-Demand	Anodyne	CACNA1I	58	33
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819303933	EG	On-Demand	Anodyne	L3MBTL3	87	38
O[C@@H](CNCc1c(F)cccc1N1CCCC1)c1ccc(Br)cc1	ZINC000819303944	GI	On-Demand	Anodyne	KCNQ2	53	34
O[C@H](CNCc1c(F)cccc1N1CCCC1)c1ccc(Br)cc1	ZINC000819303945	GI	On-Demand	Anodyne	KCNQ2	53	34
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2(C(F)(F)F)CC2)CC1	ZINC000819303946	FF	On-Demand	Anodyne	GPR119	29	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2(C(F)(F)F)CC2)CC1	ZINC000819303950	FF	On-Demand	Anodyne	GPR119	29	42
C#CC[C@H](Cc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819303952	CE	On-Demand	Mild	ADRB2	19	42
C#CC[C@H](Cc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819303952	CE	On-Demand	Mild	ADRB1	23	50
C#CC[C@H](Cc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819303952	CE	On-Demand	Mild	ADRB3	72	50
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819303954	CE	On-Demand	Mild	ADRB2	19	42
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819303954	CE	On-Demand	Mild	ADRB1	23	50
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819303954	CE	On-Demand	Mild	ADRB3	72	50
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819303956	CE	On-Demand	Mild	ADRB2	19	42
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819303956	CE	On-Demand	Mild	ADRB1	23	50
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819303956	CE	On-Demand	Mild	ADRB3	72	50
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819303957	CE	On-Demand	Mild	ADRB2	19	42
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819303957	CE	On-Demand	Mild	ADRB1	23	50
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819303957	CE	On-Demand	Mild	ADRB3	72	50
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1Cl	ZINC000819303958	EG	On-Demand	Mild	ADRB2	28	48
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1Cl	ZINC000819303959	EG	On-Demand	Mild	ADRB2	28	48
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1Cl	ZINC000819303960	EG	On-Demand	Mild	ADRB2	28	48
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1Cl	ZINC000819303962	EG	On-Demand	Mild	ADRB2	28	48
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ncc(-c2ccccc2)o1	ZINC000819303968	DG	On-Demand	Anodyne	UL26	95	36
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ncc(-c2ccccc2)o1	ZINC000819303968	DG	On-Demand	Anodyne	SCAF_EBVB9	82	36
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ncc(-c2ccccc2)o1	ZINC000819303969	DG	On-Demand	Anodyne	UL26	95	36
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ncc(-c2ccccc2)o1	ZINC000819303969	DG	On-Demand	Anodyne	SCAF_EBVB9	82	36
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ncc(-c2ccccc2)o1	ZINC000819303970	DG	On-Demand	Anodyne	UL26	95	36
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ncc(-c2ccccc2)o1	ZINC000819303970	DG	On-Demand	Anodyne	SCAF_EBVB9	82	36
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ncc(-c2ccccc2)o1	ZINC000819303971	DG	On-Demand	Anodyne	UL26	95	36
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ncc(-c2ccccc2)o1	ZINC000819303971	DG	On-Demand	Anodyne	SCAF_EBVB9	82	36
C#CCCN1CCC(NC(=O)c2coc3c(C)cccc23)CC1	ZINC000819303975	DF	On-Demand	Mild	DRD4	17	49
C#CCCN1CCC(NC(=O)c2coc3c(C)cccc23)CC1	ZINC000819303975	DF	On-Demand	Mild	HTR4	28	41
C#CCCN1CCC(NC(=O)c2coc3c(C)cccc23)CC1	ZINC000819303975	DF	On-Demand	Mild	CCR8	49	33
CN(C)CCOc1ccccc1N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819303986	FF	On-Demand	Anodyne	HTR1A	49	38
CN(C)CCOc1ccccc1N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819303986	FF	On-Demand	Anodyne	ADRA1D	25	40
CN(C)CCOc1ccccc1N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819303986	FF	On-Demand	Anodyne	ADRA1A	23	40
CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1CNC[C@H](O)C(F)(F)F	ZINC000819303987	FG	On-Demand	Anodyne	TRPM8	28	41
CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1CNC[C@H](O)C(F)(F)F	ZINC000819303988	FG	On-Demand	Anodyne	TRPM8	28	41
CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1CNC[C@@H](O)C(F)(F)F	ZINC000819303989	FG	On-Demand	Anodyne	TRPM8	28	41
CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1CNC[C@@H](O)C(F)(F)F	ZINC000819303990	FG	On-Demand	Anodyne	TRPM8	28	41
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C1(S(C)(=O)=O)CC1	ZINC000819304008	GD	On-Demand	Anodyne	GPR119	41	47
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C1(S(C)(=O)=O)CC1	ZINC000819304010	GD	On-Demand	Anodyne	GPR119	41	47
C=CCOc1ccc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819304021	GG	On-Demand	Mild	MMP13	16	47
C=CCOc1ccc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819304021	GG	On-Demand	Mild	GPR119	51	45
C=CCOc1ccc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819304022	GG	On-Demand	Mild	MMP13	16	47
C=CCOc1ccc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819304022	GG	On-Demand	Mild	GPR119	51	45
Cc1ccccc1[C@@H](O)CN[C@@H]1CCCN(C(=O)N2CCCC2)C1	ZINC000819304032	EE	On-Demand	Anodyne	CCR8	43	38
Cc1ccccc1[C@@H](O)CN[C@H]1CCCN(C(=O)N2CCCC2)C1	ZINC000819304039	EE	On-Demand	Anodyne	CCR8	43	38
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819304040	FF	On-Demand	Mild	ADRB2	46	48
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819304040	FF	On-Demand	Mild	ADRB1	59	52
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819304040	FF	On-Demand	Mild	ADRB3	40	52
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819304040	FF	On-Demand	Mild	ABCB1	24	53
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819304041	FF	On-Demand	Mild	ADRB2	46	48
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819304041	FF	On-Demand	Mild	ADRB1	59	52
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819304041	FF	On-Demand	Mild	ADRB3	40	52
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819304041	FF	On-Demand	Mild	ABCB1	24	53
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819304042	FF	On-Demand	Mild	ADRB2	46	48
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819304042	FF	On-Demand	Mild	ADRB1	59	52
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819304042	FF	On-Demand	Mild	ADRB3	40	52
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819304042	FF	On-Demand	Mild	ABCB1	24	53
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819304043	FF	On-Demand	Mild	ADRB2	46	48
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819304043	FF	On-Demand	Mild	ADRB1	59	52
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819304043	FF	On-Demand	Mild	ADRB3	40	52
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819304043	FF	On-Demand	Mild	ABCB1	24	53
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819304052	FE	On-Demand	Mild	ADRB2	18	42
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819304052	FE	On-Demand	Mild	ADRB1	25	42
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819304053	FE	On-Demand	Mild	ADRB2	18	42
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819304053	FE	On-Demand	Mild	ADRB1	25	42
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819304054	FE	On-Demand	Mild	ADRB2	18	42
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819304054	FE	On-Demand	Mild	ADRB1	25	42
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819304055	FE	On-Demand	Mild	ADRB2	18	42
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819304055	FE	On-Demand	Mild	ADRB1	25	42
C#CCCN1CCC(NC(=O)c2c(C)ccc(Br)c2OC)CC1	ZINC000819304067	GF	On-Demand	Mild	DRD2	22	50
C#CCCN1CCC(NC(=O)c2c(C)ccc(Br)c2OC)CC1	ZINC000819304067	GF	On-Demand	Mild	DRD3	26	44
C[C@H](NC[C@H](O)c1ccccc1)C1(S(C)(=O)=O)CC1	ZINC000819304068	CD	On-Demand	Anodyne	ADRB2	24	46
C[C@H](NC[C@H](O)c1ccccc1)C1(S(C)(=O)=O)CC1	ZINC000819304068	CD	On-Demand	Anodyne	ADRB1	22	46
C[C@H](NC[C@H](O)c1ccccc1)C1(S(C)(=O)=O)CC1	ZINC000819304068	CD	On-Demand	Anodyne	ADRB3	56	43
C[C@@H](NC[C@@H](O)c1ccccc1)C1(S(C)(=O)=O)CC1	ZINC000819304069	CD	On-Demand	Anodyne	ADRB2	24	46
C[C@@H](NC[C@@H](O)c1ccccc1)C1(S(C)(=O)=O)CC1	ZINC000819304069	CD	On-Demand	Anodyne	ADRB1	22	46
C[C@@H](NC[C@@H](O)c1ccccc1)C1(S(C)(=O)=O)CC1	ZINC000819304069	CD	On-Demand	Anodyne	ADRB3	56	43
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819304073	DD	On-Demand	Anodyne	ADRB3	44	38
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819304074	DD	On-Demand	Anodyne	ADRB3	44	38
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819304075	DD	On-Demand	Anodyne	ADRB3	44	38
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819304076	DD	On-Demand	Anodyne	ADRB3	44	38
O=S(=O)(c1cccs1)N1CC[C@@H](CNC[C@H](O)c2ccccc2F)C1	ZINC000819304101	GE	On-Demand	Anodyne	GCKR	36	40
O=S(=O)(c1cccs1)N1CC[C@H](CNC[C@H](O)c2ccccc2F)C1	ZINC000819304102	GE	On-Demand	Anodyne	GCKR	36	40
O=S(=O)(c1cccs1)N1CC[C@H](CNC[C@@H](O)c2ccccc2F)C1	ZINC000819304103	GE	On-Demand	Anodyne	GCKR	36	40
O=S(=O)(c1cccs1)N1CC[C@@H](CNC[C@@H](O)c2ccccc2F)C1	ZINC000819304104	GE	On-Demand	Anodyne	GCKR	36	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1(c3cccc(F)c3)CC1)C2	ZINC000819304109	FF	On-Demand	Anodyne	KCNA3	42	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1(c3cccc(F)c3)CC1)C2	ZINC000819304110	FF	On-Demand	Anodyne	KCNA3	42	36
O[C@@H](CNCCC1(O)CCOCC1)c1cccc(Cl)c1	ZINC000819304117	CD	On-Demand	Anodyne	ADRB1	42	46
O[C@@H](CNCCC1(O)CCOCC1)c1cccc(Cl)c1	ZINC000819304117	CD	On-Demand	Anodyne	ADRB3	51	46
O[C@H](CNCCC1(O)CCOCC1)c1cccc(Cl)c1	ZINC000819304118	CD	On-Demand	Anodyne	ADRB1	42	46
O[C@H](CNCCC1(O)CCOCC1)c1cccc(Cl)c1	ZINC000819304118	CD	On-Demand	Anodyne	ADRB3	51	46
CC(C)[C@H]1CN(C)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819304126	FE	On-Demand	Mild	PAPA1_CARPA	33	40
CC(C)[C@H]1CN(C)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819304127	FE	On-Demand	Mild	PAPA1_CARPA	33	40
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1cccc(Cl)c1Cl	ZINC000819304132	GF	On-Demand	Anodyne	ADRB2	21	43
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1cccc(Cl)c1Cl	ZINC000819304132	GF	On-Demand	Anodyne	ADRB1	39	40
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1cccc(Cl)c1Cl	ZINC000819304132	GF	On-Demand	Anodyne	ADRB3	63	40
O=S(=O)(NCCNC[C@H](O)c1ccccc1)c1cccc(Cl)c1Cl	ZINC000819304132	GF	On-Demand	Anodyne	ITGAV	16	45
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1cccc(Cl)c1Cl	ZINC000819304133	GF	On-Demand	Anodyne	ADRB2	21	43
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1cccc(Cl)c1Cl	ZINC000819304133	GF	On-Demand	Anodyne	ADRB1	39	40
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1cccc(Cl)c1Cl	ZINC000819304133	GF	On-Demand	Anodyne	ADRB3	63	40
O=S(=O)(NCCNC[C@@H](O)c1ccccc1)c1cccc(Cl)c1Cl	ZINC000819304133	GF	On-Demand	Anodyne	ITGAV	16	45
COCCCOc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819304145	DF	On-Demand	Anodyne	ADRB2	42	42
COCCCOc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819304145	DF	On-Demand	Anodyne	ADRB1	56	44
COCCCOc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819304145	DF	On-Demand	Anodyne	ADRB3	57	48
COCCCOc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819304145	DF	On-Demand	Anodyne	LTA4H	35	40
COCCCOc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819304146	DF	On-Demand	Anodyne	ADRB2	42	42
COCCCOc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819304146	DF	On-Demand	Anodyne	ADRB1	56	44
COCCCOc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819304146	DF	On-Demand	Anodyne	ADRB3	57	48
COCCCOc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819304146	DF	On-Demand	Anodyne	LTA4H	35	40
CN(Cc1ccon1)C(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819304179	GI	On-Demand	Anodyne	REN	56	38
CN(Cc1ccon1)C(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819304181	GI	On-Demand	Anodyne	REN	56	38
C[C@H](NC[C@H](O)c1ccc(OC(F)(F)F)cc1)C1(S(C)(=O)=O)CC1	ZINC000819304182	FE	On-Demand	Anodyne	ADRB3	17	46
C[C@@H](NC[C@@H](O)c1ccc(OC(F)(F)F)cc1)C1(S(C)(=O)=O)CC1	ZINC000819304187	FE	On-Demand	Anodyne	ADRB3	17	46
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819304241	EG	On-Demand	Mild	ADRB2	21	64
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819304241	EG	On-Demand	Mild	ADRB1	35	64
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819304242	EG	On-Demand	Mild	ADRB2	21	64
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819304242	EG	On-Demand	Mild	ADRB1	35	64
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819304243	EG	On-Demand	Mild	ADRB2	21	64
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819304243	EG	On-Demand	Mild	ADRB1	35	64
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819304244	EG	On-Demand	Mild	ADRB2	21	64
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819304244	EG	On-Demand	Mild	ADRB1	35	64
COc1cccc([S@@](=O)CC(=O)NC[C@H](C)CC2(C)OCCO2)c1	ZINC000819304264	FD	On-Demand	Anodyne	MTNR1A	23	40
COc1cccc([S@@](=O)CC(=O)NC[C@H](C)CC2(C)OCCO2)c1	ZINC000819304264	FD	On-Demand	Anodyne	MTNR1B	26	40
COc1cccc([S@@](=O)CC(=O)NC[C@@H](C)CC2(C)OCCO2)c1	ZINC000819304266	FD	On-Demand	Anodyne	MTNR1A	23	40
COc1cccc([S@@](=O)CC(=O)NC[C@@H](C)CC2(C)OCCO2)c1	ZINC000819304266	FD	On-Demand	Anodyne	MTNR1B	26	40
C#CC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(F)cc1	ZINC000819304268	CG	On-Demand	Mild	ADRB3	15	44
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(F)cc1	ZINC000819304269	CG	On-Demand	Mild	ADRB3	15	44
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819304270	CG	On-Demand	Mild	ADRB3	15	44
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819304271	CG	On-Demand	Mild	ADRB3	15	44
C#CC[C@@H](Cc1ccccc1)NCCC(=O)N(C)OC	ZINC000819304299	CD	On-Demand	Mild	MME	41	35
C#CC[C@H](Cc1ccccc1)NCCC(=O)N(C)OC	ZINC000819304301	CD	On-Demand	Mild	MME	41	35
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COCC(C)C	ZINC000819304310	CE	On-Demand	Mild	ADRB2	22	50
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COCC(C)C	ZINC000819304310	CE	On-Demand	Mild	ADRB1	20	41
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COCC(C)C	ZINC000819304312	CE	On-Demand	Mild	ADRB2	22	50
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COCC(C)C	ZINC000819304312	CE	On-Demand	Mild	ADRB1	20	41
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COCC(C)C	ZINC000819304314	CE	On-Demand	Mild	ADRB2	22	50
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COCC(C)C	ZINC000819304314	CE	On-Demand	Mild	ADRB1	20	41
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COCC(C)C	ZINC000819304315	CE	On-Demand	Mild	ADRB2	22	50
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COCC(C)C	ZINC000819304315	CE	On-Demand	Mild	ADRB1	20	41
C[C@H](NC[C@H](O)c1cccc(F)c1)C1(S(C)(=O)=O)CC1	ZINC000819304333	DD	On-Demand	Anodyne	ADRB2	23	43
C[C@@H](NC[C@@H](O)c1cccc(F)c1)C1(S(C)(=O)=O)CC1	ZINC000819304339	DD	On-Demand	Anodyne	ADRB2	23	43
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819304343	FE	On-Demand	Mild	ADRB3	32	52
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819304343	FE	On-Demand	Mild	CTSF	41	39
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819304345	FE	On-Demand	Mild	ADRB3	32	52
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819304345	FE	On-Demand	Mild	CTSF	41	39
C#CC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819304347	FE	On-Demand	Mild	ADRB3	32	52
C#CC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819304347	FE	On-Demand	Mild	CTSF	41	39
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819304349	FE	On-Demand	Mild	ADRB3	32	52
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819304349	FE	On-Demand	Mild	CTSF	41	39
C[C@H](CNC(=O)C(F)=C1CCC1)Cn1ccnc1	ZINC000819304353	CE	On-Demand	Anodyne	TBXAS1	27	48
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COC	ZINC000819304369	BD	On-Demand	Mild	ADRB2	24	46
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COC	ZINC000819304369	BD	On-Demand	Mild	ADRB1	22	43
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COC	ZINC000819304371	BD	On-Demand	Mild	ADRB2	24	46
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COC	ZINC000819304371	BD	On-Demand	Mild	ADRB1	22	43
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COC	ZINC000819304372	BD	On-Demand	Mild	ADRB2	24	46
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COC	ZINC000819304372	BD	On-Demand	Mild	ADRB1	22	43
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COC	ZINC000819304374	BD	On-Demand	Mild	ADRB2	24	46
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COC	ZINC000819304374	BD	On-Demand	Mild	ADRB1	22	43
O[C@H](CNCC1(C(F)(F)F)CC1)c1cccc(Cl)c1	ZINC000819304377	CG	On-Demand	Anodyne	ADRB1	30	46
O[C@H](CNCC1(C(F)(F)F)CC1)c1cccc(Cl)c1	ZINC000819304377	CG	On-Demand	Anodyne	ADRB3	44	46
O[C@@H](CNCC1(C(F)(F)F)CC1)c1cccc(Cl)c1	ZINC000819304379	CG	On-Demand	Anodyne	ADRB1	30	46
O[C@@H](CNCC1(C(F)(F)F)CC1)c1cccc(Cl)c1	ZINC000819304379	CG	On-Demand	Anodyne	ADRB3	44	46
CN1CC[C@H](NC(=O)CC[C@@H](CC2CCCCC2)NC(=O)OC(C)(C)C)C1=O	ZINC000819304386	GF	On-Demand	Anodyne	PGC	38	41
CN1CC[C@H](NC(=O)CC[C@@H](CC2CCCCC2)NC(=O)OC(C)(C)C)C1=O	ZINC000819304386	GF	On-Demand	Anodyne	PGA	16	41
CN1CC[C@H](NC(=O)CC[C@@H](CC2CCCCC2)NC(=O)OC(C)(C)C)C1=O	ZINC000819304386	GF	On-Demand	Anodyne	REN	57	41
CN1CC[C@H](NC(=O)CC[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)C1=O	ZINC000819304388	GF	On-Demand	Anodyne	PGC	38	41
CN1CC[C@H](NC(=O)CC[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)C1=O	ZINC000819304388	GF	On-Demand	Anodyne	PGA	16	41
CN1CC[C@H](NC(=O)CC[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)C1=O	ZINC000819304388	GF	On-Demand	Anodyne	REN	57	41
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C1(S(C)(=O)=O)CC1	ZINC000819304396	DD	On-Demand	Anodyne	ADRB1	43	48
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C1(S(C)(=O)=O)CC1	ZINC000819304396	DD	On-Demand	Anodyne	ADRB3	72	48
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C1(S(C)(=O)=O)CC1	ZINC000819304401	DD	On-Demand	Anodyne	ADRB1	43	48
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C1(S(C)(=O)=O)CC1	ZINC000819304401	DD	On-Demand	Anodyne	ADRB3	72	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(CCN1CCCC1)c1ccccc1)C2	ZINC000819304412	GF	On-Demand	Anodyne	SLC6A1	79	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(CCN1CCCC1)c1ccccc1)C2	ZINC000819304414	GF	On-Demand	Anodyne	SLC6A1	79	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3ccccc3OC)C1)C2	ZINC000819304436	FF	On-Demand	Anodyne	ADAM10	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](c3ccccc3OC)C1)C2	ZINC000819304437	FF	On-Demand	Anodyne	ADAM10	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](c3ccccc3OC)C1)C2	ZINC000819304439	FF	On-Demand	Anodyne	ADAM10	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3ccccc3OC)C1)C2	ZINC000819304441	FF	On-Demand	Anodyne	ADAM10	18	40
COCCCOc1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819304455	EG	On-Demand	Anodyne	ADRB2	32	44
COCCCOc1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819304455	EG	On-Demand	Anodyne	ADRB1	42	41
COCCCOc1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819304455	EG	On-Demand	Anodyne	ADRB3	43	44
COCCCOc1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819304458	EG	On-Demand	Anodyne	ADRB2	32	44
COCCCOc1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819304458	EG	On-Demand	Anodyne	ADRB1	42	41
COCCCOc1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819304458	EG	On-Demand	Anodyne	ADRB3	43	44
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819304461	FF	On-Demand	Mild	ADRB2	23	46
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819304461	FF	On-Demand	Mild	ADRB1	33	60
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819304461	FF	On-Demand	Mild	ADRB3	20	60
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819304461	FF	On-Demand	Mild	PDS	37	47
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819304463	FF	On-Demand	Mild	ADRB2	23	46
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819304463	FF	On-Demand	Mild	ADRB1	33	60
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819304463	FF	On-Demand	Mild	ADRB3	20	60
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819304463	FF	On-Demand	Mild	PDS	37	47
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819304464	FF	On-Demand	Mild	ADRB2	23	46
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819304464	FF	On-Demand	Mild	ADRB1	33	60
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819304464	FF	On-Demand	Mild	ADRB3	20	60
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819304464	FF	On-Demand	Mild	PDS	37	47
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819304465	FF	On-Demand	Mild	ADRB2	23	46
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819304465	FF	On-Demand	Mild	ADRB1	33	60
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819304465	FF	On-Demand	Mild	ADRB3	20	60
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819304465	FF	On-Demand	Mild	PDS	37	47
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1F	ZINC000819304471	EF	On-Demand	Mild	ADRB2	26	47
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1F	ZINC000819304471	EF	On-Demand	Mild	ADRB1	45	36
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1F	ZINC000819304473	EF	On-Demand	Mild	ADRB2	26	47
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1F	ZINC000819304473	EF	On-Demand	Mild	ADRB1	45	36
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1F	ZINC000819304475	EF	On-Demand	Mild	ADRB2	26	47
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1F	ZINC000819304475	EF	On-Demand	Mild	ADRB1	45	36
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1F	ZINC000819304476	EF	On-Demand	Mild	ADRB2	26	47
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1F	ZINC000819304476	EF	On-Demand	Mild	ADRB1	45	36
COCCCOc1ccc(CNC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819304488	EG	On-Demand	Anodyne	LEF	39	40
COCCCOc1ccc(CNC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819304489	EG	On-Demand	Anodyne	LEF	39	40
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000819304490	EE	On-Demand	Anodyne	GRIN2B	43	35
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000819304490	EE	On-Demand	Anodyne	L3MBTL3	70	36
O=C(/C=C\[C@H]1CCCO1)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000819304491	EE	On-Demand	Anodyne	GRIN2B	43	35
O=C(/C=C\[C@H]1CCCO1)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000819304491	EE	On-Demand	Anodyne	L3MBTL3	70	36
O=C(/C=C/[C@H]1CCCO1)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000819304492	EE	On-Demand	Anodyne	GRIN2B	43	35
O=C(/C=C/[C@H]1CCCO1)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000819304492	EE	On-Demand	Anodyne	L3MBTL3	70	36
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000819304493	EE	On-Demand	Anodyne	GRIN2B	43	35
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000819304493	EE	On-Demand	Anodyne	L3MBTL3	70	36
C#CCNC(=O)CCNCc1cccc(Oc2cc(OC)cc(OC)c2)c1	ZINC000819304508	FF	On-Demand	Mild	MTNR1A	36	41
C#CCNC(=O)CCNCc1cccc(Oc2cc(OC)cc(OC)c2)c1	ZINC000819304508	FF	On-Demand	Mild	MTNR1B	34	50
C#CCNC(=O)CCNCc1cccc(Oc2cc(OC)cc(OC)c2)c1	ZINC000819304508	FF	On-Demand	Mild	CRTM	43	38
O=[N+]([O-])c1cccc([C@@H](O)CNCc2c(F)cccc2N2CCCC2)c1	ZINC000819304516	FG	On-Demand	Bother	KCNQ2	49	37
O=[N+]([O-])c1cccc([C@H](O)CNCc2c(F)cccc2N2CCCC2)c1	ZINC000819304517	FG	On-Demand	Bother	KCNQ2	49	37
COCCCOc1ccc(CNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819304539	FG	On-Demand	Anodyne	LEF	61	39
COCCCOc1ccc(CNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819304541	FG	On-Demand	Anodyne	LEF	61	39
COCCCOc1ccc(CNC[C@H](O)c2ccc(C)cc2)cc1	ZINC000819304573	EG	On-Demand	Anodyne	ADRB2	27	41
COCCCOc1ccc(CNC[C@@H](O)c2ccc(C)cc2)cc1	ZINC000819304574	EG	On-Demand	Anodyne	ADRB2	27	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(NC[C@@H]2CCCO2)c(F)c1	ZINC000819304596	EG	On-Demand	Anodyne	TNK2	26	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(NC[C@H]2CCCO2)c(F)c1	ZINC000819304597	EG	On-Demand	Anodyne	TNK2	26	41
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(NC[C@@H]2CCCO2)c(F)c1	ZINC000819304598	EG	On-Demand	Anodyne	TNK2	26	41
CC[C@@](C)(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1nccs1	ZINC000819304599	GG	On-Demand	Mild	PAPA1_CARPA	43	47
CC[C@@](C)(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1nccs1	ZINC000819304599	GG	On-Demand	Mild	CTSK	15	42
CC[C@@](C)(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nccs1	ZINC000819304600	GG	On-Demand	Mild	PAPA1_CARPA	43	47
CC[C@@](C)(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nccs1	ZINC000819304600	GG	On-Demand	Mild	CTSK	15	42
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(NC[C@H]2CCCO2)c(F)c1	ZINC000819304601	EG	On-Demand	Anodyne	TNK2	26	41
CC(C)(C)OC(=O)NC1CCC(NC(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819304603	GG	On-Demand	Anodyne	INHA	46	33
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cnn3ccccc23)CC1	ZINC000819304604	FE	On-Demand	Anodyne	GPR119	46	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cnn3ccccc23)CC1	ZINC000819304605	FE	On-Demand	Anodyne	GPR119	46	49
C#CCCN1CCC(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819304606	GE	On-Demand	Mild	PAPA1_CARPA	36	44
C#CCCN1CCC(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819304607	GE	On-Demand	Mild	PAPA1_CARPA	36	44
C[C@H](NC[C@H](O)c1ccccc1Cl)C1(S(C)(=O)=O)CC1	ZINC000819304611	DD	On-Demand	Anodyne	OPRL1	20	40
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819304621	FD	On-Demand	Bother	L3MBTL3	64	39
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819304624	FD	On-Demand	Bother	L3MBTL3	64	39
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819304626	FD	On-Demand	Bother	L3MBTL3	64	39
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819304627	FD	On-Demand	Bother	L3MBTL3	64	39
CCO[C@@H]1C[C@@H](N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1(C)C	ZINC000819304630	GG	On-Demand	Mild	PAPA1_CARPA	32	40
CCO[C@@H]1C[C@@H](N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1(C)C	ZINC000819304633	GG	On-Demand	Mild	PAPA1_CARPA	32	40
CCO[C@@H]1C[C@H](N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1(C)C	ZINC000819304635	GG	On-Demand	Mild	PAPA1_CARPA	32	40
CCO[C@@H]1C[C@H](N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1(C)C	ZINC000819304639	GG	On-Demand	Mild	PAPA1_CARPA	32	40
C#CCCN1CCC(NC(=O)c2cc(Br)oc2C)CC1	ZINC000819304643	EF	On-Demand	Mild	HTR4	32	41
C#CCCN1CCC(NC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819304654	ED	On-Demand	Mild	HTR1D	74	44
C#CCCN1CCC(NC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819304654	ED	On-Demand	Mild	HTR1B	62	44
C#CCCN1CCC(NC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819304654	ED	On-Demand	Mild	SIGMAR1	17	45
C#CCCN1CCC(NC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819304654	ED	On-Demand	Mild	MCHR1	18	40
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2ccccc2F)CC1	ZINC000819304656	FF	On-Demand	Anodyne	CYP51A1	22	40
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2ccccc2F)CC1	ZINC000819304658	FF	On-Demand	Anodyne	CYP51A1	22	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCn2cnc(C#N)n2)CC1	ZINC000819304663	FC	On-Demand	Mild	GPR119	42	44
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819304664	FF	On-Demand	Mild	ADRB2	39	48
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819304664	FF	On-Demand	Mild	ADRB1	44	53
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819304664	FF	On-Demand	Mild	ADRB3	35	53
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819304664	FF	On-Demand	Mild	ABCB1	28	44
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819304664	FF	On-Demand	Mild	PDS	69	38
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819304665	FF	On-Demand	Mild	ADRB2	39	48
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819304665	FF	On-Demand	Mild	ADRB1	44	53
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819304665	FF	On-Demand	Mild	ADRB3	35	53
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819304665	FF	On-Demand	Mild	ABCB1	28	44
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819304665	FF	On-Demand	Mild	PDS	69	38
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819304666	FF	On-Demand	Mild	ADRB2	39	48
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819304666	FF	On-Demand	Mild	ADRB1	44	53
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819304666	FF	On-Demand	Mild	ADRB3	35	53
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819304666	FF	On-Demand	Mild	ABCB1	28	44
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819304666	FF	On-Demand	Mild	PDS	69	38
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819304667	FF	On-Demand	Mild	ADRB2	39	48
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819304667	FF	On-Demand	Mild	ADRB1	44	53
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819304667	FF	On-Demand	Mild	ADRB3	35	53
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819304667	FF	On-Demand	Mild	ABCB1	28	44
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819304667	FF	On-Demand	Mild	PDS	69	38
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCn2cnc(C#N)n2)CC1	ZINC000819304668	FC	On-Demand	Mild	GPR119	42	44
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(F)cc1	ZINC000819304669	EF	On-Demand	Mild	ADRB2	39	49
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(F)cc1	ZINC000819304669	EF	On-Demand	Mild	ADRB1	50	49
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(F)cc1	ZINC000819304669	EF	On-Demand	Mild	ADRB3	32	49
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(F)cc1	ZINC000819304671	EF	On-Demand	Mild	ADRB2	39	49
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(F)cc1	ZINC000819304671	EF	On-Demand	Mild	ADRB1	50	49
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(F)cc1	ZINC000819304671	EF	On-Demand	Mild	ADRB3	32	49
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(F)cc1	ZINC000819304673	EF	On-Demand	Mild	ADRB2	39	49
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(F)cc1	ZINC000819304673	EF	On-Demand	Mild	ADRB1	50	49
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(F)cc1	ZINC000819304673	EF	On-Demand	Mild	ADRB3	32	49
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(F)cc1	ZINC000819304675	EF	On-Demand	Mild	ADRB2	39	49
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(F)cc1	ZINC000819304675	EF	On-Demand	Mild	ADRB1	50	49
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(F)cc1	ZINC000819304675	EF	On-Demand	Mild	ADRB3	32	49
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(SC)cc1	ZINC000819304677	FG	On-Demand	Mild	ADRB2	35	49
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(SC)cc1	ZINC000819304677	FG	On-Demand	Mild	ADRB1	39	48
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(SC)cc1	ZINC000819304677	FG	On-Demand	Mild	ADRB3	27	48
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(SC)cc1	ZINC000819304679	FG	On-Demand	Mild	ADRB2	35	49
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(SC)cc1	ZINC000819304679	FG	On-Demand	Mild	ADRB1	39	48
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(SC)cc1	ZINC000819304679	FG	On-Demand	Mild	ADRB3	27	48
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819304680	FG	On-Demand	Mild	ADRB2	35	49
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819304680	FG	On-Demand	Mild	ADRB1	39	48
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819304680	FG	On-Demand	Mild	ADRB3	27	48
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819304683	FG	On-Demand	Mild	ADRB2	35	49
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819304683	FG	On-Demand	Mild	ADRB1	39	48
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819304683	FG	On-Demand	Mild	ADRB3	27	48
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819304697	EF	On-Demand	Mild	ADRB2	34	46
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819304697	EF	On-Demand	Mild	ADRB1	45	49
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819304697	EF	On-Demand	Mild	ADRB3	30	49
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819304699	EF	On-Demand	Mild	ADRB2	34	46
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819304699	EF	On-Demand	Mild	ADRB1	45	49
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819304699	EF	On-Demand	Mild	ADRB3	30	49
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819304701	EF	On-Demand	Mild	ADRB2	34	46
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819304701	EF	On-Demand	Mild	ADRB1	45	49
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819304701	EF	On-Demand	Mild	ADRB3	30	49
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819304703	EF	On-Demand	Mild	ADRB2	34	46
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819304703	EF	On-Demand	Mild	ADRB1	45	49
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819304703	EF	On-Demand	Mild	ADRB3	30	49
COC(=O)Nc1cccc(CNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819304715	FH	On-Demand	Anodyne	KCNK3	43	41
COC(=O)Nc1cccc(CNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819304715	FH	On-Demand	Anodyne	KCNK9	42	41
COC(=O)Nc1cccc(CNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819304717	FH	On-Demand	Anodyne	KCNK3	43	41
COC(=O)Nc1cccc(CNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819304717	FH	On-Demand	Anodyne	KCNK9	42	41
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819304730	FG	On-Demand	Anodyne	ADRB2	51	46
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819304730	FG	On-Demand	Anodyne	ADRB1	94	48
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819304730	FG	On-Demand	Anodyne	GRIN1	29	48
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819304730	FG	On-Demand	Anodyne	ADRB3	62	48
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819304730	FG	On-Demand	Anodyne	PDS	86	39
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819304732	FG	On-Demand	Anodyne	ADRB2	51	46
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819304732	FG	On-Demand	Anodyne	ADRB1	94	48
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819304732	FG	On-Demand	Anodyne	GRIN1	29	48
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819304732	FG	On-Demand	Anodyne	ADRB3	62	48
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819304732	FG	On-Demand	Anodyne	PDS	86	39
O=C1c2ccccc2C(=O)N1CCCNC[C@H](O)c1cccc(F)c1	ZINC000819304770	EE	On-Demand	Anodyne	ADRB1	35	42
O=C1c2ccccc2C(=O)N1CCCNC[C@H](O)c1cccc(F)c1	ZINC000819304770	EE	On-Demand	Anodyne	ADRB3	58	42
O=C1c2ccccc2C(=O)N1CCCNC[C@@H](O)c1cccc(F)c1	ZINC000819304771	EE	On-Demand	Anodyne	ADRB1	35	42
O=C1c2ccccc2C(=O)N1CCCNC[C@@H](O)c1cccc(F)c1	ZINC000819304771	EE	On-Demand	Anodyne	ADRB3	58	42
O[C@@H](CNCc1c(F)cccc1N1CCCC1)c1cc(F)ccc1F	ZINC000819304802	FH	On-Demand	Anodyne	KCNQ2	45	38
O[C@H](CNCc1c(F)cccc1N1CCCC1)c1cc(F)ccc1F	ZINC000819304803	FH	On-Demand	Anodyne	KCNQ2	45	38
O=C(/C=C/[C@H]1CCCO1)N(CCN1CCCC1)c1ccccc1	ZINC000819304859	DF	On-Demand	Anodyne	SLC6A1	87	39
O=C(/C=C/[C@H]1CCCO1)N(CCN1CCCC1)c1ccccc1	ZINC000819304859	DF	On-Demand	Anodyne	CYP2J2	45	31
O=C(/C=C\[C@@H]1CCCO1)N(CCN1CCCC1)c1ccccc1	ZINC000819304860	DF	On-Demand	Anodyne	SLC6A1	87	39
O=C(/C=C\[C@@H]1CCCO1)N(CCN1CCCC1)c1ccccc1	ZINC000819304860	DF	On-Demand	Anodyne	CYP2J2	45	31
O=C(/C=C\[C@H]1CCCO1)N(CCN1CCCC1)c1ccccc1	ZINC000819304861	DF	On-Demand	Anodyne	SLC6A1	87	39
O=C(/C=C\[C@H]1CCCO1)N(CCN1CCCC1)c1ccccc1	ZINC000819304861	DF	On-Demand	Anodyne	CYP2J2	45	31
O=C(/C=C/[C@@H]1CCCO1)N(CCN1CCCC1)c1ccccc1	ZINC000819304862	DF	On-Demand	Anodyne	SLC6A1	87	39
O=C(/C=C/[C@@H]1CCCO1)N(CCN1CCCC1)c1ccccc1	ZINC000819304862	DF	On-Demand	Anodyne	CYP2J2	45	31
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819304888	EF	On-Demand	Mild	ADRB2	20	47
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819304888	EF	On-Demand	Mild	ADRB3	21	42
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)c1cc(OC)ccc1OC	ZINC000819304889	EF	On-Demand	Mild	ADRB2	20	47
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)c1cc(OC)ccc1OC	ZINC000819304889	EF	On-Demand	Mild	ADRB3	21	42
C#CC[C@H](Cc1ccccc1)NC[C@H](O)c1cc(OC)ccc1OC	ZINC000819304890	EF	On-Demand	Mild	ADRB2	20	47
C#CC[C@H](Cc1ccccc1)NC[C@H](O)c1cc(OC)ccc1OC	ZINC000819304890	EF	On-Demand	Mild	ADRB3	21	42
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819304891	EF	On-Demand	Mild	ADRB2	20	47
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819304891	EF	On-Demand	Mild	ADRB3	21	42
C#CCCN1CCC(NC(=O)[C@H](CC)Cc2ccccc2C)CC1	ZINC000819304906	EG	On-Demand	Mild	SIGMAR1	16	41
C#CCCN1CCC(NC(=O)[C@@H](CC)Cc2ccccc2C)CC1	ZINC000819304908	EG	On-Demand	Mild	SIGMAR1	16	41
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819304914	ED	On-Demand	Anodyne	ADRB1	21	40
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819304914	ED	On-Demand	Anodyne	ADRB3	64	49
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819304914	ED	On-Demand	Anodyne	C3AR1	41	40
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819304916	ED	On-Demand	Anodyne	ADRB1	21	40
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819304916	ED	On-Demand	Anodyne	ADRB3	64	49
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819304916	ED	On-Demand	Anodyne	C3AR1	41	40
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819304918	FG	On-Demand	Anodyne	ADRB2	46	45
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819304918	FG	On-Demand	Anodyne	ADRB1	72	42
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819304918	FG	On-Demand	Anodyne	ADRB3	46	42
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819304918	FG	On-Demand	Anodyne	PDS	50	38
COC(=O)Nc1cccc(CNC[C@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819304923	FG	On-Demand	Anodyne	ADRB2	46	45
COC(=O)Nc1cccc(CNC[C@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819304923	FG	On-Demand	Anodyne	ADRB1	72	42
COC(=O)Nc1cccc(CNC[C@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819304923	FG	On-Demand	Anodyne	ADRB3	46	42
COC(=O)Nc1cccc(CNC[C@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819304923	FG	On-Demand	Anodyne	PDS	50	38
C#CCCN1CCC(NC(=O)c2cn(-c3ccccc3)nc2C(C)C)CC1	ZINC000819304925	FG	On-Demand	Mild	DRD4	19	43
C#CC[C@H](Cc1ccccc1)NC[C@H](O)c1ccccc1	ZINC000819304926	CF	On-Demand	Mild	ADRB2	15	41
C#CC[C@H](Cc1ccccc1)NC[C@H](O)c1ccccc1	ZINC000819304926	CF	On-Demand	Mild	ADRB3	23	44
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccccc1	ZINC000819304928	CF	On-Demand	Mild	ADRB2	15	41
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccccc1	ZINC000819304928	CF	On-Demand	Mild	ADRB3	23	44
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccccc1	ZINC000819304930	CF	On-Demand	Mild	ADRB2	15	41
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccccc1	ZINC000819304930	CF	On-Demand	Mild	ADRB3	23	44
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccccc1	ZINC000819304931	CF	On-Demand	Mild	ADRB2	15	41
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccccc1	ZINC000819304931	CF	On-Demand	Mild	ADRB3	23	44
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819304946	GF	On-Demand	Anodyne	ADRB3	26	43
C#CC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc(Br)c1	ZINC000819304948	FH	On-Demand	Mild	ADRB3	23	44
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819304949	GF	On-Demand	Anodyne	ADRB3	26	43
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc(Br)c1	ZINC000819304950	FH	On-Demand	Mild	ADRB3	23	44
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccc(Br)c1	ZINC000819304952	FH	On-Demand	Mild	ADRB3	23	44
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccc(Br)c1	ZINC000819304953	FH	On-Demand	Mild	ADRB3	23	44
C#CC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819304967	DH	On-Demand	Mild	ADRB1	35	50
C#CC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819304967	DH	On-Demand	Mild	ADRB3	55	60
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819304968	DH	On-Demand	Mild	ADRB1	35	50
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819304968	DH	On-Demand	Mild	ADRB3	55	60
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)c1	ZINC000819304980	GE	On-Demand	Anodyne	ADRB1	56	39
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)c1	ZINC000819304980	GE	On-Demand	Anodyne	ADRB3	41	39
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)c1	ZINC000819304981	GE	On-Demand	Anodyne	ADRB1	56	39
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)c1	ZINC000819304981	GE	On-Demand	Anodyne	ADRB3	41	39
O=C1c2ccccc2C(=O)N1CCCNC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819304982	GG	On-Demand	Anodyne	ADRB2	17	41
O=C1c2ccccc2C(=O)N1CCCNC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819304982	GG	On-Demand	Anodyne	ADRB3	21	41
O=C1c2ccccc2C(=O)N1CCCNC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819304983	GG	On-Demand	Anodyne	ADRB2	17	41
O=C1c2ccccc2C(=O)N1CCCNC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819304983	GG	On-Demand	Anodyne	ADRB3	21	41
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819304988	FE	On-Demand	Anodyne	ADRB2	33	40
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819304988	FE	On-Demand	Anodyne	ADRB1	63	42
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819304988	FE	On-Demand	Anodyne	ADRB3	41	42
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819304988	FE	On-Demand	Anodyne	EDNRB	60	36
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819304988	FE	On-Demand	Anodyne	EDNRA	58	36
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819304988	FE	On-Demand	Anodyne	BMP1	46	40
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819304988	FE	On-Demand	Anodyne	PDS	50	33
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819304989	FE	On-Demand	Anodyne	ADRB2	33	40
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819304989	FE	On-Demand	Anodyne	ADRB1	63	42
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819304989	FE	On-Demand	Anodyne	ADRB3	41	42
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819304989	FE	On-Demand	Anodyne	EDNRB	60	36
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819304989	FE	On-Demand	Anodyne	EDNRA	58	36
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819304989	FE	On-Demand	Anodyne	BMP1	46	40
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819304989	FE	On-Demand	Anodyne	PDS	50	33
COC(=O)Nc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819304998	DE	On-Demand	Anodyne	ADRB2	38	49
COC(=O)Nc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819304998	DE	On-Demand	Anodyne	ADRB1	50	49
COC(=O)Nc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819304998	DE	On-Demand	Anodyne	ADRB3	125	49
COC(=O)Nc1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819304998	DE	On-Demand	Anodyne	KCNA5	19	40
COC(=O)Nc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819304999	DE	On-Demand	Anodyne	ADRB2	38	49
COC(=O)Nc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819304999	DE	On-Demand	Anodyne	ADRB1	50	49
COC(=O)Nc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819304999	DE	On-Demand	Anodyne	ADRB3	125	49
COC(=O)Nc1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819304999	DE	On-Demand	Anodyne	KCNA5	19	40
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819305000	EF	On-Demand	Anodyne	ADRB1	26	43
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819305000	EF	On-Demand	Anodyne	GRIN2B	34	45
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819305000	EF	On-Demand	Anodyne	ADRB3	45	43
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2ccccc2)CC1	ZINC000819305000	EF	On-Demand	Anodyne	CYP3A4	42	34
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819305001	EF	On-Demand	Anodyne	ADRB1	26	43
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819305001	EF	On-Demand	Anodyne	GRIN2B	34	45
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819305001	EF	On-Demand	Anodyne	ADRB3	45	43
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2ccccc2)CC1	ZINC000819305001	EF	On-Demand	Anodyne	CYP3A4	42	34
O=C1c2ccccc2C(=O)N1CCCNC[C@H](O)c1cccnc1	ZINC000819305002	ED	On-Demand	Anodyne	ADRB2	39	49
O=C1c2ccccc2C(=O)N1CCCNC[C@H](O)c1cccnc1	ZINC000819305002	ED	On-Demand	Anodyne	ADRB1	38	46
O=C1c2ccccc2C(=O)N1CCCNC[C@H](O)c1cccnc1	ZINC000819305002	ED	On-Demand	Anodyne	ADRB3	124	49
O=C1c2ccccc2C(=O)N1CCCNC[C@@H](O)c1cccnc1	ZINC000819305003	ED	On-Demand	Anodyne	ADRB2	39	49
O=C1c2ccccc2C(=O)N1CCCNC[C@@H](O)c1cccnc1	ZINC000819305003	ED	On-Demand	Anodyne	ADRB1	38	46
O=C1c2ccccc2C(=O)N1CCCNC[C@@H](O)c1cccnc1	ZINC000819305003	ED	On-Demand	Anodyne	ADRB3	124	49
COC(=O)Nc1cccc(CNC[C@H](O)COCc2cccs2)c1	ZINC000819305031	FF	On-Demand	Anodyne	ADRB1	22	41
COC(=O)Nc1cccc(CNC[C@@H](O)COCc2cccs2)c1	ZINC000819305032	FF	On-Demand	Anodyne	ADRB1	22	41
C[C@@H]1COCC[C@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819305033	GF	On-Demand	Anodyne	CTSD	95	41
C[C@@H]1COCC[C@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819305033	GF	On-Demand	Anodyne	PGC	61	36
C[C@@H]1COCC[C@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819305033	GF	On-Demand	Anodyne	PAPA1_CARPA	28	41
C[C@@H]1COCC[C@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819305033	GF	On-Demand	Anodyne	BACE2	50	41
C[C@@H]1COCC[C@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819305033	GF	On-Demand	Anodyne	REN	82	45
C[C@@H]1COCC[C@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819305033	GF	On-Demand	Anodyne	REN1	15	42
C[C@@H]1COCC[C@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819305033	GF	On-Demand	Anodyne	BACE1	78	41
C[C@@H]1COCC[C@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819305033	GF	On-Demand	Anodyne	FPR1	48	38
C[C@@H]1COCC[C@@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819305035	GF	On-Demand	Anodyne	CTSD	95	41
C[C@@H]1COCC[C@@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819305035	GF	On-Demand	Anodyne	PGC	61	36
C[C@@H]1COCC[C@@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819305035	GF	On-Demand	Anodyne	PAPA1_CARPA	28	41
C[C@@H]1COCC[C@@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819305035	GF	On-Demand	Anodyne	BACE2	50	41
C[C@@H]1COCC[C@@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819305035	GF	On-Demand	Anodyne	REN	82	45
C[C@@H]1COCC[C@@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819305035	GF	On-Demand	Anodyne	REN1	15	42
C[C@@H]1COCC[C@@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819305035	GF	On-Demand	Anodyne	BACE1	78	41
C[C@@H]1COCC[C@@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819305035	GF	On-Demand	Anodyne	FPR1	48	38
COC(=O)Nc1cccc(CNC[C@H](O)COc2cc(Cl)ccc2Cl)c1	ZINC000819305037	GH	On-Demand	Anodyne	ADRB2	27	40
COC(=O)Nc1cccc(CNC[C@H](O)COc2cc(Cl)ccc2Cl)c1	ZINC000819305037	GH	On-Demand	Anodyne	ADRB1	54	40
COC(=O)Nc1cccc(CNC[C@H](O)COc2cc(Cl)ccc2Cl)c1	ZINC000819305037	GH	On-Demand	Anodyne	ADRB3	30	40
COC(=O)Nc1cccc(CNC[C@H](O)COc2cc(Cl)ccc2Cl)c1	ZINC000819305037	GH	On-Demand	Anodyne	PDS	43	37
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cc(Cl)ccc2Cl)c1	ZINC000819305038	GH	On-Demand	Anodyne	ADRB2	27	40
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cc(Cl)ccc2Cl)c1	ZINC000819305038	GH	On-Demand	Anodyne	ADRB1	54	40
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cc(Cl)ccc2Cl)c1	ZINC000819305038	GH	On-Demand	Anodyne	ADRB3	30	40
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cc(Cl)ccc2Cl)c1	ZINC000819305038	GH	On-Demand	Anodyne	PDS	43	37
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819305041	DH	On-Demand	Mild	ADRB1	35	50
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819305041	DH	On-Demand	Mild	ADRB3	55	60
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819305042	DH	On-Demand	Mild	ADRB1	35	50
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819305042	DH	On-Demand	Mild	ADRB3	55	60
C[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C1(S(C)(=O)=O)CC1	ZINC000819305043	FE	On-Demand	Anodyne	ADRB2	19	40
C[C@@H](NC[C@@H](O)c1cccc(C(F)(F)F)c1)C1(S(C)(=O)=O)CC1	ZINC000819305046	FE	On-Demand	Anodyne	ADRB2	19	40
C#CC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819305085	DH	On-Demand	Mild	ADRB3	20	44
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(Cl)cc1	ZINC000819305086	DH	On-Demand	Mild	ADRB3	20	44
C#CC[C@H](Cc1ccccc1)NCC1(O)CCC(C(=O)OCC)CC1	ZINC000819305094	EF	On-Demand	Mild	TIMP3	83	37
C#CC[C@@H](Cc1ccccc1)NCC1(O)CCC(C(=O)OCC)CC1	ZINC000819305095	EF	On-Demand	Mild	TIMP3	83	37
C#CCCN1CCC(NC(=O)Cc2cccc(NC(C)=O)c2)CC1	ZINC000819305096	ED	On-Demand	Mild	CHRM1	16	44
C#CCCN1CCC(NC(=O)Cc2cccc(NC(C)=O)c2)CC1	ZINC000819305096	ED	On-Demand	Mild	DRD4	28	43
C#CCCN1CCC(NC(=O)Cc2cccc(NC(C)=O)c2)CC1	ZINC000819305096	ED	On-Demand	Mild	HTR1D	31	42
C#CCCN1CCC(NC(=O)Cc2cccc(NC(C)=O)c2)CC1	ZINC000819305096	ED	On-Demand	Mild	HTR1B	29	41
C#CCCN1CCC(NC(=O)Cc2cccc(NC(C)=O)c2)CC1	ZINC000819305096	ED	On-Demand	Mild	DRD3	16	43
C#CCCN1CCC(NC(=O)Cc2cccc(NC(C)=O)c2)CC1	ZINC000819305096	ED	On-Demand	Mild	SIGMAR1	24	50
C#CCCN1CCC(NC(=O)Cc2cccc(NC(C)=O)c2)CC1	ZINC000819305096	ED	On-Demand	Mild	CCR3	62	41
C#CCCN1CCC(NC(=O)Cc2cccc(NC(C)=O)c2)CC1	ZINC000819305096	ED	On-Demand	Mild	EPHX2	26	40
C#CCCN1CCC(NC(=O)Cc2cccc(NC(C)=O)c2)CC1	ZINC000819305096	ED	On-Demand	Mild	MCHR1	50	46
C#CCCN1CCC(NC(=O)Cc2nsc3ccccc23)CC1	ZINC000819305099	EE	On-Demand	Mild	SIGMAR1	15	42
C[C@H]1C[C@@H](C)C[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819305134	FH	On-Demand	Mild	PAPA1_CARPA	40	50
C[C@H]1C[C@@H](C)C[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819305134	FH	On-Demand	Mild	CTSK	16	47
C[C@H]1C[C@@H](C)C[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819305136	FH	On-Demand	Mild	PAPA1_CARPA	40	50
C[C@H]1C[C@@H](C)C[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819305136	FH	On-Demand	Mild	CTSK	16	47
COC(=O)Nc1cccc(CNC[C@H](O)COCc2ccccc2Cl)c1	ZINC000819305151	GG	On-Demand	Anodyne	ADRB1	28	42
COC(=O)Nc1cccc(CNC[C@H](O)COCc2ccccc2Cl)c1	ZINC000819305151	GG	On-Demand	Anodyne	ADRB3	16	42
COC(=O)Nc1cccc(CNC[C@@H](O)COCc2ccccc2Cl)c1	ZINC000819305152	GG	On-Demand	Anodyne	ADRB1	28	42
COC(=O)Nc1cccc(CNC[C@@H](O)COCc2ccccc2Cl)c1	ZINC000819305152	GG	On-Demand	Anodyne	ADRB3	16	42
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(C(C)(C)C)cc2)c1	ZINC000819305158	GH	On-Demand	Anodyne	ADRB2	51	44
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(C(C)(C)C)cc2)c1	ZINC000819305158	GH	On-Demand	Anodyne	ADRB1	81	44
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(C(C)(C)C)cc2)c1	ZINC000819305158	GH	On-Demand	Anodyne	GRIN1	15	43
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(C(C)(C)C)cc2)c1	ZINC000819305158	GH	On-Demand	Anodyne	ADRB3	58	44
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(C(C)(C)C)cc2)c1	ZINC000819305158	GH	On-Demand	Anodyne	PDS	64	36
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)c1	ZINC000819305159	GH	On-Demand	Anodyne	ADRB2	51	44
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)c1	ZINC000819305159	GH	On-Demand	Anodyne	ADRB1	81	44
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)c1	ZINC000819305159	GH	On-Demand	Anodyne	GRIN1	15	43
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)c1	ZINC000819305159	GH	On-Demand	Anodyne	ADRB3	58	44
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)c1	ZINC000819305159	GH	On-Demand	Anodyne	PDS	64	36
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819305172	GH	On-Demand	Anodyne	ADRB2	49	42
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819305172	GH	On-Demand	Anodyne	ADRB1	83	43
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819305172	GH	On-Demand	Anodyne	GRIN1	31	51
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819305172	GH	On-Demand	Anodyne	ADRB3	54	43
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819305172	GH	On-Demand	Anodyne	PDS	82	48
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819305173	GH	On-Demand	Anodyne	ADRB2	49	42
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819305173	GH	On-Demand	Anodyne	ADRB1	83	43
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819305173	GH	On-Demand	Anodyne	GRIN1	31	51
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819305173	GH	On-Demand	Anodyne	ADRB3	54	43
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819305173	GH	On-Demand	Anodyne	PDS	82	48
COC(=O)Nc1cccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819305176	FH	On-Demand	Anodyne	CCR2	29	41
COC(=O)Nc1cccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819305176	FH	On-Demand	Anodyne	PDS	44	40
COC(=O)Nc1cccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819305177	FH	On-Demand	Anodyne	CCR2	29	41
COC(=O)Nc1cccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819305177	FH	On-Demand	Anodyne	PDS	44	40
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000819305207	FE	On-Demand	Mild	ADRB2	47	44
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000819305207	FE	On-Demand	Mild	ADRB1	82	44
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000819305207	FE	On-Demand	Mild	ADRB3	47	44
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000819305207	FE	On-Demand	Mild	PDS	46	41
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000819305208	FE	On-Demand	Mild	ADRB2	47	44
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000819305208	FE	On-Demand	Mild	ADRB1	82	44
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000819305208	FE	On-Demand	Mild	ADRB3	47	44
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000819305208	FE	On-Demand	Mild	PDS	46	41
Cc1ccccc1[C@@H](O)CNC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1	ZINC000819305228	FF	On-Demand	Anodyne	CYP3A4	42	34
Cc1ccccc1[C@@H](O)CNC1CCN(C(=O)c2cc(Cl)c[nH]2)CC1	ZINC000819305228	FF	On-Demand	Anodyne	AKR1C3	16	40
C#CC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819305259	EH	On-Demand	Mild	ADRB3	19	42
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819305260	EH	On-Demand	Mild	ADRB3	19	42
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819305261	EH	On-Demand	Mild	ADRB3	19	42
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819305262	EH	On-Demand	Mild	ADRB3	19	42
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCCN(C(=O)N3CCCC3)C2)cc1	ZINC000819305293	GD	On-Demand	Anodyne	ADRB3	24	43
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCCN(C(=O)N3CCCC3)C2)cc1	ZINC000819305294	GD	On-Demand	Anodyne	ADRB3	24	43
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCCN(C(=O)N3CCCC3)C2)cc1	ZINC000819305295	GD	On-Demand	Anodyne	ADRB3	24	43
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCCN(C(=O)N3CCCC3)C2)cc1	ZINC000819305296	GD	On-Demand	Anodyne	ADRB3	24	43
CC(C)(C)OC(=O)NC1CCC(NC(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819305301	GF	On-Demand	Anodyne	GPR119	25	43
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819305302	FF	On-Demand	Anodyne	OPRL1	44	38
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819305303	FF	On-Demand	Anodyne	OPRL1	44	38
C#CC[C@H](Cc1ccccc1)NCCC(N)=O	ZINC000819305326	BD	On-Demand	Mild	MME	64	38
C#CC[C@H](Cc1ccccc1)NCCC(N)=O	ZINC000819305326	BD	On-Demand	Mild	ANPEP	63	34
C#CC[C@H](Cc1ccccc1)NCCC(N)=O	ZINC000819305326	BD	On-Demand	Mild	CPA1	45	35
C#CC[C@@H](Cc1ccccc1)NCCC(N)=O	ZINC000819305327	BD	On-Demand	Mild	MME	64	38
C#CC[C@@H](Cc1ccccc1)NCCC(N)=O	ZINC000819305327	BD	On-Demand	Mild	ANPEP	63	34
C#CC[C@@H](Cc1ccccc1)NCCC(N)=O	ZINC000819305327	BD	On-Demand	Mild	CPA1	45	35
C#CCSCCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819305337	DD	On-Demand	Mild	MTNR1A	38	41
C#CCSCCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819305337	DD	On-Demand	Mild	MTNR1B	36	41
C#CCSCCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819305338	DD	On-Demand	Mild	MTNR1A	38	41
C#CCSCCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819305338	DD	On-Demand	Mild	MTNR1B	36	41
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COCC	ZINC000819305339	CD	On-Demand	Mild	ADRB2	19	47
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COCC	ZINC000819305339	CD	On-Demand	Mild	ADRB1	17	40
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COCC	ZINC000819305340	CD	On-Demand	Mild	ADRB2	19	47
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COCC	ZINC000819305340	CD	On-Demand	Mild	ADRB1	17	40
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819305376	FF	On-Demand	Anodyne	ADRB3	25	44
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819305377	FF	On-Demand	Anodyne	ADRB3	25	44
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2Cl)c1	ZINC000819305380	GH	On-Demand	Anodyne	ADRB2	28	40
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2Cl)c1	ZINC000819305380	GH	On-Demand	Anodyne	ADRB1	54	40
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2Cl)c1	ZINC000819305380	GH	On-Demand	Anodyne	ADRB3	31	40
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(Cl)cc2Cl)c1	ZINC000819305380	GH	On-Demand	Anodyne	PDS	43	37
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2Cl)c1	ZINC000819305381	GH	On-Demand	Anodyne	ADRB2	28	40
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2Cl)c1	ZINC000819305381	GH	On-Demand	Anodyne	ADRB1	54	40
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2Cl)c1	ZINC000819305381	GH	On-Demand	Anodyne	ADRB3	31	40
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(Cl)cc2Cl)c1	ZINC000819305381	GH	On-Demand	Anodyne	PDS	43	37
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819305402	GG	On-Demand	Anodyne	ADRB3	26	48
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(SC)cc2)c1	ZINC000819305403	GG	On-Demand	Anodyne	ADRB2	45	44
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(SC)cc2)c1	ZINC000819305403	GG	On-Demand	Anodyne	ADRB1	77	44
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(SC)cc2)c1	ZINC000819305403	GG	On-Demand	Anodyne	ADRB3	48	44
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(SC)cc2)c1	ZINC000819305403	GG	On-Demand	Anodyne	PDS	56	36
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(SC)cc2)c1	ZINC000819305404	GG	On-Demand	Anodyne	ADRB2	45	44
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(SC)cc2)c1	ZINC000819305404	GG	On-Demand	Anodyne	ADRB1	77	44
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(SC)cc2)c1	ZINC000819305404	GG	On-Demand	Anodyne	ADRB3	48	44
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(SC)cc2)c1	ZINC000819305404	GG	On-Demand	Anodyne	PDS	56	36
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819305415	EE	On-Demand	Bother	L3MBTL3	44	36
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819305423	GG	On-Demand	Anodyne	ADRB1	35	48
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819305423	GG	On-Demand	Anodyne	ADRB3	58	51
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819305423	GG	On-Demand	Anodyne	IGF1R	30	41
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819305423	GG	On-Demand	Anodyne	CYP3A4	53	41
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819305424	GG	On-Demand	Anodyne	ADRB1	35	48
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819305424	GG	On-Demand	Anodyne	ADRB3	58	51
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819305424	GG	On-Demand	Anodyne	IGF1R	30	41
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819305424	GG	On-Demand	Anodyne	CYP3A4	53	41
O=C1c2ccccc2C(=O)N1CCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819305425	FD	On-Demand	Bother	ADRB3	42	34
O=C1c2ccccc2C(=O)N1CCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819305426	FD	On-Demand	Bother	ADRB3	42	34
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COCC	ZINC000819305441	CD	On-Demand	Mild	ADRB2	19	47
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COCC	ZINC000819305441	CD	On-Demand	Mild	ADRB1	17	40
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COCC	ZINC000819305442	CD	On-Demand	Mild	ADRB2	19	47
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COCC	ZINC000819305442	CD	On-Demand	Mild	ADRB1	17	40
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C)cc1	ZINC000819305456	DF	On-Demand	Mild	ADRB2	46	57
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C)cc1	ZINC000819305456	DF	On-Demand	Mild	ADRB1	49	50
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C)cc1	ZINC000819305456	DF	On-Demand	Mild	ADRB3	33	50
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C)cc1	ZINC000819305457	DF	On-Demand	Mild	ADRB2	46	57
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C)cc1	ZINC000819305457	DF	On-Demand	Mild	ADRB1	49	50
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C)cc1	ZINC000819305457	DF	On-Demand	Mild	ADRB3	33	50
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C)cc1	ZINC000819305458	DF	On-Demand	Mild	ADRB2	46	57
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C)cc1	ZINC000819305458	DF	On-Demand	Mild	ADRB1	49	50
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C)cc1	ZINC000819305458	DF	On-Demand	Mild	ADRB3	33	50
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C)cc1	ZINC000819305459	DF	On-Demand	Mild	ADRB2	46	57
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C)cc1	ZINC000819305459	DF	On-Demand	Mild	ADRB1	49	50
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C)cc1	ZINC000819305459	DF	On-Demand	Mild	ADRB3	33	50
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COC(C)C	ZINC000819305464	CD	On-Demand	Mild	ADRB2	23	48
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COC(C)C	ZINC000819305464	CD	On-Demand	Mild	ADRB1	22	41
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COC(C)C	ZINC000819305464	CD	On-Demand	Mild	CASR	25	42
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COC(C)C	ZINC000819305465	CD	On-Demand	Mild	ADRB2	23	48
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COC(C)C	ZINC000819305465	CD	On-Demand	Mild	ADRB1	22	41
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COC(C)C	ZINC000819305465	CD	On-Demand	Mild	CASR	25	42
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COC(C)C	ZINC000819305466	CD	On-Demand	Mild	ADRB2	23	48
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COC(C)C	ZINC000819305466	CD	On-Demand	Mild	ADRB1	22	41
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COC(C)C	ZINC000819305466	CD	On-Demand	Mild	CASR	25	42
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COC(C)C	ZINC000819305467	CD	On-Demand	Mild	ADRB2	23	48
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COC(C)C	ZINC000819305467	CD	On-Demand	Mild	ADRB1	22	41
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COC(C)C	ZINC000819305467	CD	On-Demand	Mild	CASR	25	42
C[C@H](NC[C@H](O)c1ccc(F)cc1)C1(S(C)(=O)=O)CC1	ZINC000819305486	DD	On-Demand	Anodyne	ADRB3	15	40
C[C@@H](NC[C@@H](O)c1ccc(F)cc1)C1(S(C)(=O)=O)CC1	ZINC000819305489	DD	On-Demand	Anodyne	ADRB3	15	40
C#CC[C@H](Cc1ccccc1)NCCC(=O)NC(N)=O	ZINC000819305490	CC	On-Demand	Mild	MME	41	37
C#CC[C@@H](Cc1ccccc1)NCCC(=O)NC(N)=O	ZINC000819305491	CC	On-Demand	Mild	MME	41	37
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819305492	FE	On-Demand	Anodyne	ADRB3	25	40
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819305493	FE	On-Demand	Anodyne	ADRB3	25	40
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819305494	FE	On-Demand	Anodyne	ADRB3	25	40
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819305495	FE	On-Demand	Anodyne	ADRB3	25	40
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305505	GG	On-Demand	Anodyne	ADRB3	21	40
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305505	GG	On-Demand	Anodyne	CACNA1B	40	35
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305505	GG	On-Demand	Anodyne	CCR2	71	39
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305505	GG	On-Demand	Anodyne	SFRP1	75	32
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305505	GG	On-Demand	Anodyne	WNT3	50	32
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305506	GG	On-Demand	Anodyne	ADRB3	21	40
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305506	GG	On-Demand	Anodyne	CACNA1B	40	35
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305506	GG	On-Demand	Anodyne	CCR2	71	39
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305506	GG	On-Demand	Anodyne	SFRP1	75	32
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305506	GG	On-Demand	Anodyne	WNT3	50	32
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305507	GG	On-Demand	Anodyne	ADRB3	21	40
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305507	GG	On-Demand	Anodyne	CACNA1B	40	35
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305507	GG	On-Demand	Anodyne	CCR2	71	39
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305507	GG	On-Demand	Anodyne	SFRP1	75	32
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305507	GG	On-Demand	Anodyne	WNT3	50	32
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305508	GG	On-Demand	Anodyne	ADRB3	21	40
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305508	GG	On-Demand	Anodyne	CACNA1B	40	35
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305508	GG	On-Demand	Anodyne	CCR2	71	39
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305508	GG	On-Demand	Anodyne	SFRP1	75	32
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819305508	GG	On-Demand	Anodyne	WNT3	50	32
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819305524	DD	On-Demand	Anodyne	ADRB1	28	40
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819305524	DD	On-Demand	Anodyne	ADRB3	88	49
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819305524	DD	On-Demand	Anodyne	PTAFR	15	42
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819305524	DD	On-Demand	Anodyne	C3AR1	42	40
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819305525	DD	On-Demand	Anodyne	ADRB1	28	40
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819305525	DD	On-Demand	Anodyne	ADRB3	88	49
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819305525	DD	On-Demand	Anodyne	PTAFR	15	42
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819305525	DD	On-Demand	Anodyne	C3AR1	42	40
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819305526	DD	On-Demand	Anodyne	ADRB1	28	40
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819305526	DD	On-Demand	Anodyne	ADRB3	88	49
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819305526	DD	On-Demand	Anodyne	PTAFR	15	42
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819305526	DD	On-Demand	Anodyne	C3AR1	42	40
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819305527	DD	On-Demand	Anodyne	ADRB1	28	40
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819305527	DD	On-Demand	Anodyne	ADRB3	88	49
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819305527	DD	On-Demand	Anodyne	PTAFR	15	42
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819305527	DD	On-Demand	Anodyne	C3AR1	42	40
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819305532	GG	On-Demand	Anodyne	RBP4	72	37
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819305532	GG	On-Demand	Anodyne	SFRP1	126	36
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819305532	GG	On-Demand	Anodyne	WNT3	87	36
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819305533	GG	On-Demand	Anodyne	RBP4	72	37
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819305533	GG	On-Demand	Anodyne	SFRP1	126	36
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819305533	GG	On-Demand	Anodyne	WNT3	87	36
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819305534	GG	On-Demand	Anodyne	RBP4	72	37
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819305534	GG	On-Demand	Anodyne	SFRP1	126	36
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819305534	GG	On-Demand	Anodyne	WNT3	87	36
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819305535	GG	On-Demand	Anodyne	RBP4	72	37
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819305535	GG	On-Demand	Anodyne	SFRP1	126	36
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819305535	GG	On-Demand	Anodyne	WNT3	87	36
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819305571	GG	On-Demand	Anodyne	MCHR1	19	44
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819305572	GG	On-Demand	Anodyne	MCHR1	19	44
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819305573	GG	On-Demand	Anodyne	MCHR1	19	44
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819305574	GG	On-Demand	Anodyne	MCHR1	19	44
COC(=O)Nc1cccc(CNC[C@@H](O)C2CC2)c1	ZINC000819305601	CD	On-Demand	Anodyne	KCNK3	46	33
COC(=O)Nc1cccc(CNC[C@@H](O)C2CC2)c1	ZINC000819305601	CD	On-Demand	Anodyne	KCNK9	43	33
COC(=O)Nc1cccc(CNC[C@H](O)C2CC2)c1	ZINC000819305603	CD	On-Demand	Anodyne	KCNK3	46	33
COC(=O)Nc1cccc(CNC[C@H](O)C2CC2)c1	ZINC000819305603	CD	On-Demand	Anodyne	KCNK9	43	33
C#CC[C@@H](Cc1ccccc1)NCCC(=O)Nc1cccnc1	ZINC000819305609	DF	On-Demand	Mild	NAMPT	23	44
C#CC[C@H](Cc1ccccc1)NCCC(=O)Nc1cccnc1	ZINC000819305611	DF	On-Demand	Mild	NAMPT	23	44
O=C1c2ccccc2C(=O)N1CCCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819305620	GG	On-Demand	Anodyne	ADRB3	47	38
O=C1c2ccccc2C(=O)N1CCCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819305620	GG	On-Demand	Anodyne	GALR3	54	34
O=C1c2ccccc2C(=O)N1CCCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819305622	GG	On-Demand	Anodyne	ADRB3	47	38
O=C1c2ccccc2C(=O)N1CCCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819305622	GG	On-Demand	Anodyne	GALR3	54	34
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819305633	FF	On-Demand	Anodyne	ADRB2	48	44
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819305633	FF	On-Demand	Anodyne	ADRB1	83	44
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819305633	FF	On-Demand	Anodyne	GRIN1	15	43
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819305633	FF	On-Demand	Anodyne	ADRB3	53	44
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819305633	FF	On-Demand	Anodyne	ABCB1	19	52
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819305633	FF	On-Demand	Anodyne	PDS	46	33
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819305634	FF	On-Demand	Anodyne	ADRB2	48	44
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819305634	FF	On-Demand	Anodyne	ADRB1	83	44
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819305634	FF	On-Demand	Anodyne	GRIN1	15	43
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819305634	FF	On-Demand	Anodyne	ADRB3	53	44
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819305634	FF	On-Demand	Anodyne	ABCB1	19	52
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819305634	FF	On-Demand	Anodyne	PDS	46	33
COC(=O)Nc1cccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819305636	GE	On-Demand	Bother	ADRB2	33	54
COC(=O)Nc1cccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819305636	GE	On-Demand	Bother	ADRB1	54	54
COC(=O)Nc1cccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819305636	GE	On-Demand	Bother	CACNA1C	43	35
COC(=O)Nc1cccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819305636	GE	On-Demand	Bother	ADRB3	37	54
COC(=O)Nc1cccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819305636	GE	On-Demand	Bother	CACNA1D	69	35
COC(=O)Nc1cccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819305636	GE	On-Demand	Bother	PDS	65	51
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819305638	GE	On-Demand	Bother	ADRB2	33	54
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819305638	GE	On-Demand	Bother	ADRB1	54	54
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819305638	GE	On-Demand	Bother	CACNA1C	43	35
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819305638	GE	On-Demand	Bother	ADRB3	37	54
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819305638	GE	On-Demand	Bother	CACNA1D	69	35
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819305638	GE	On-Demand	Bother	PDS	65	51
C[C@H](NC[C@H](O)c1cccc(Br)c1)C1(S(C)(=O)=O)CC1	ZINC000819305641	FE	On-Demand	Anodyne	ADRB3	42	38
C[C@@H](NC[C@@H](O)c1cccc(Br)c1)C1(S(C)(=O)=O)CC1	ZINC000819305647	FE	On-Demand	Anodyne	ADRB3	42	38
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1	ZINC000819305654	DF	On-Demand	Mild	ADRB2	43	58
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1	ZINC000819305654	DF	On-Demand	Mild	ADRB1	50	57
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1	ZINC000819305654	DF	On-Demand	Mild	ADRB3	36	57
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1	ZINC000819305655	DF	On-Demand	Mild	ADRB2	43	58
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1	ZINC000819305655	DF	On-Demand	Mild	ADRB1	50	57
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1	ZINC000819305655	DF	On-Demand	Mild	ADRB3	36	57
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1	ZINC000819305657	DF	On-Demand	Mild	ADRB2	43	58
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1	ZINC000819305657	DF	On-Demand	Mild	ADRB1	50	57
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1	ZINC000819305657	DF	On-Demand	Mild	ADRB3	36	57
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1	ZINC000819305659	DF	On-Demand	Mild	ADRB2	43	58
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1	ZINC000819305659	DF	On-Demand	Mild	ADRB1	50	57
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1	ZINC000819305659	DF	On-Demand	Mild	ADRB3	36	57
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819305661	GG	On-Demand	Mild	REN	54	38
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819305661	GG	On-Demand	Mild	GPR119	37	46
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819305661	GG	On-Demand	Mild	WNT3	42	34
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819305663	GG	On-Demand	Mild	REN	54	38
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819305663	GG	On-Demand	Mild	GPR119	37	46
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819305663	GG	On-Demand	Mild	WNT3	42	34
C#CC[C@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819305665	GG	On-Demand	Mild	REN	54	38
C#CC[C@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819305665	GG	On-Demand	Mild	GPR119	37	46
C#CC[C@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819305665	GG	On-Demand	Mild	WNT3	42	34
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819305667	GG	On-Demand	Mild	REN	54	38
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819305667	GG	On-Demand	Mild	GPR119	37	46
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819305667	GG	On-Demand	Mild	WNT3	42	34
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819305668	FF	On-Demand	Mild	ADRB2	21	43
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819305668	FF	On-Demand	Mild	ADRB1	46	43
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819305670	FF	On-Demand	Mild	ADRB2	21	43
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819305670	FF	On-Demand	Mild	ADRB1	46	43
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819305672	FF	On-Demand	Mild	ADRB2	21	43
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819305672	FF	On-Demand	Mild	ADRB1	46	43
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819305673	FF	On-Demand	Mild	ADRB2	21	43
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819305673	FF	On-Demand	Mild	ADRB1	46	43
O=C(Nc1ccc(NC[C@H]2CCCO2)c(F)c1)C(F)=C1CCC1	ZINC000819305681	DH	On-Demand	Anodyne	TNK2	27	42
O=C(Nc1ccc(NC[C@@H]2CCCO2)c(F)c1)C(F)=C1CCC1	ZINC000819305683	DH	On-Demand	Anodyne	TNK2	27	42
C#CCCN1CCC(NC(=O)c2cc(C)ccc2C2CC2)CC1	ZINC000819305685	DG	On-Demand	Mild	DRD4	26	45
C#CCCN1CCC(NC(=O)c2cc(C)ccc2C2CC2)CC1	ZINC000819305685	DG	On-Demand	Mild	HTR4	37	42
C#CCCN1CCC(NC(=O)c2cc(C)ccc2C2CC2)CC1	ZINC000819305685	DG	On-Demand	Mild	SSTR5	42	37
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819305686	GF	On-Demand	Mild	ADRB1	25	41
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819305686	GF	On-Demand	Mild	ADRB3	17	41
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819305689	GF	On-Demand	Mild	ADRB1	25	41
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819305689	GF	On-Demand	Mild	ADRB3	17	41
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819305691	GF	On-Demand	Mild	ADRB1	25	41
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819305691	GF	On-Demand	Mild	ADRB3	17	41
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819305693	GF	On-Demand	Mild	ADRB1	25	41
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819305693	GF	On-Demand	Mild	ADRB3	17	41
COC(=O)Nc1cccc(CNC[C@@H](C)O)c1	ZINC000819305704	BD	On-Demand	Anodyne	KCNK3	45	35
COC(=O)Nc1cccc(CNC[C@@H](C)O)c1	ZINC000819305704	BD	On-Demand	Anodyne	KCNK9	44	35
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819305705	GE	On-Demand	Anodyne	ADRB2	52	54
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819305705	GE	On-Demand	Anodyne	ADRB1	90	54
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819305705	GE	On-Demand	Anodyne	TSHR	50	33
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819305705	GE	On-Demand	Anodyne	GRIN1	28	46
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819305705	GE	On-Demand	Anodyne	ADRB3	57	54
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819305705	GE	On-Demand	Anodyne	PDS	47	35
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819305706	GE	On-Demand	Anodyne	ADRB2	52	54
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819305706	GE	On-Demand	Anodyne	ADRB1	90	54
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819305706	GE	On-Demand	Anodyne	TSHR	50	33
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819305706	GE	On-Demand	Anodyne	GRIN1	28	46
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819305706	GE	On-Demand	Anodyne	ADRB3	57	54
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819305706	GE	On-Demand	Anodyne	PDS	47	35
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2C(F)(F)F)c1	ZINC000819305714	GG	On-Demand	Anodyne	ADRB2	34	42
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2C(F)(F)F)c1	ZINC000819305714	GG	On-Demand	Anodyne	ADRB1	72	40
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2C(F)(F)F)c1	ZINC000819305714	GG	On-Demand	Anodyne	ADRB3	29	41
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2C(F)(F)F)c1	ZINC000819305714	GG	On-Demand	Anodyne	ABCB1	27	41
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2C(F)(F)F)c1	ZINC000819305714	GG	On-Demand	Anodyne	KCNK3	50	43
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2C(F)(F)F)c1	ZINC000819305714	GG	On-Demand	Anodyne	KCNK9	47	43
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2C(F)(F)F)c1	ZINC000819305714	GG	On-Demand	Anodyne	PDS	54	37
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)c1	ZINC000819305715	GG	On-Demand	Anodyne	ADRB2	34	42
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)c1	ZINC000819305715	GG	On-Demand	Anodyne	ADRB1	72	40
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)c1	ZINC000819305715	GG	On-Demand	Anodyne	ADRB3	29	41
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)c1	ZINC000819305715	GG	On-Demand	Anodyne	ABCB1	27	41
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)c1	ZINC000819305715	GG	On-Demand	Anodyne	KCNK3	50	43
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)c1	ZINC000819305715	GG	On-Demand	Anodyne	KCNK9	47	43
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)c1	ZINC000819305715	GG	On-Demand	Anodyne	PDS	54	37
COC(=O)Nc1cccc(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819305718	FH	On-Demand	Anodyne	MTTP	46	36
COC(=O)Nc1cccc(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819305718	FH	On-Demand	Anodyne	SLC1A2	30	44
COC(=O)Nc1cccc(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819305718	FH	On-Demand	Anodyne	PDS	43	37
COC(=O)Nc1cccc(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819305719	FH	On-Demand	Anodyne	MTTP	46	36
COC(=O)Nc1cccc(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819305719	FH	On-Demand	Anodyne	SLC1A2	30	44
COC(=O)Nc1cccc(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819305719	FH	On-Demand	Anodyne	PDS	43	37
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2cccc(F)c2)CC1	ZINC000819305737	FF	On-Demand	Anodyne	ADRB1	21	41
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2cccc(F)c2)CC1	ZINC000819305737	FF	On-Demand	Anodyne	ADRB3	40	43
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2cccc(F)c2)CC1	ZINC000819305737	FF	On-Demand	Anodyne	CYP3A4	45	35
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819305738	FF	On-Demand	Anodyne	ADRB1	21	41
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819305738	FF	On-Demand	Anodyne	ADRB3	40	43
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819305738	FF	On-Demand	Anodyne	CYP3A4	45	35
N#Cc1ncn(CCNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819305739	CD	On-Demand	Mild	ADRB1	34	48
N#Cc1ncn(CCNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819305739	CD	On-Demand	Mild	ADRB3	49	48
N#Cc1ncn(CCNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819305740	CD	On-Demand	Mild	ADRB1	34	48
N#Cc1ncn(CCNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819305740	CD	On-Demand	Mild	ADRB3	49	48
C[C@@H]1CSC[C@@H]1NC[C@@H](O)c1cccnc1	ZINC000819305742	BD	On-Demand	Anodyne	ADRB1	20	40
C[C@@H]1CSC[C@@H]1NC[C@@H](O)c1cccnc1	ZINC000819305742	BD	On-Demand	Anodyne	ADRB3	75	45
C[C@@H]1CSC[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819305743	BD	On-Demand	Anodyne	ADRB1	20	40
C[C@@H]1CSC[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819305743	BD	On-Demand	Anodyne	ADRB3	75	45
CS(=O)(=O)c1ccc([C@H](O)CNCC2(C(F)(F)F)CC2)cc1	ZINC000819305754	EE	On-Demand	Anodyne	CTSF	43	37
CS(=O)(=O)c1ccc([C@@H](O)CNCC2(C(F)(F)F)CC2)cc1	ZINC000819305755	EE	On-Demand	Anodyne	CTSF	43	37
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305757	FF	On-Demand	Mild	ADRB2	53	62
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305757	FF	On-Demand	Mild	ADRB1	80	62
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305757	FF	On-Demand	Mild	TSHR	41	31
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305757	FF	On-Demand	Mild	ADRB3	51	61
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305757	FF	On-Demand	Mild	ABCB1	17	40
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305758	FF	On-Demand	Mild	ADRB2	53	62
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305758	FF	On-Demand	Mild	ADRB1	80	62
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305758	FF	On-Demand	Mild	TSHR	41	31
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305758	FF	On-Demand	Mild	ADRB3	51	61
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305758	FF	On-Demand	Mild	ABCB1	17	40
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305759	FF	On-Demand	Mild	ADRB2	53	62
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305759	FF	On-Demand	Mild	ADRB1	80	62
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305759	FF	On-Demand	Mild	TSHR	41	31
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305759	FF	On-Demand	Mild	ADRB3	51	61
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305759	FF	On-Demand	Mild	ABCB1	17	40
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305760	FF	On-Demand	Mild	ADRB2	53	62
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305760	FF	On-Demand	Mild	ADRB1	80	62
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305760	FF	On-Demand	Mild	TSHR	41	31
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305760	FF	On-Demand	Mild	ADRB3	51	61
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819305760	FF	On-Demand	Mild	ABCB1	17	40
CC(=O)Nc1cccc(CC(=O)NC2CCC(NC(=O)OC(C)(C)C)CC2)c1	ZINC000819305779	GG	On-Demand	Anodyne	SIGMAR1	17	41
CC(=O)Nc1cccc(CC(=O)NC2CCC(NC(=O)OC(C)(C)C)CC2)c1	ZINC000819305779	GG	On-Demand	Anodyne	REN	21	43
CC(=O)Nc1cccc(CC(=O)NC2CCC(NC(=O)OC(C)(C)C)CC2)c1	ZINC000819305779	GG	On-Demand	Anodyne	FAAH	16	44
CC(=O)Nc1cccc(CC(=O)NC2CCC(NC(=O)OC(C)(C)C)CC2)c1	ZINC000819305779	GG	On-Demand	Anodyne	EPHX2	15	43
CC(=O)Nc1cccc(CC(=O)NC2CCC(NC(=O)OC(C)(C)C)CC2)c1	ZINC000819305779	GG	On-Demand	Anodyne	FPR1	46	35
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819305782	GF	On-Demand	Anodyne	ADRB3	25	41
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819305783	GF	On-Demand	Anodyne	ADRB3	25	41
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819305784	GF	On-Demand	Anodyne	ADRB3	25	41
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819305785	GF	On-Demand	Anodyne	ADRB3	25	41
C#CC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819305787	EH	On-Demand	Mild	ADRB3	20	42
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819305788	EH	On-Demand	Mild	ADRB3	20	42
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819305789	EH	On-Demand	Mild	ADRB3	20	42
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819305790	EH	On-Demand	Mild	ADRB3	20	42
C#CCCN1CCC(NC(=O)c2cnc(OC)c(Br)c2)CC1	ZINC000819305792	FE	On-Demand	Mild	DRD2	15	40
C#CCCN1CCC(NC(=O)c2cnc(OC)c(Br)c2)CC1	ZINC000819305792	FE	On-Demand	Mild	DRD4	40	32
C#CCCN1CCC(NC(=O)c2cnc(OC)c(Br)c2)CC1	ZINC000819305792	FE	On-Demand	Mild	SSTR5	49	41
C#CCCN1CCC(NC(=O)c2cnc(OC)c(Br)c2)CC1	ZINC000819305792	FE	On-Demand	Mild	UTS2R	19	41
C#CCCN1CCC(NC(=O)c2cnc(OC)c(Br)c2)CC1	ZINC000819305792	FE	On-Demand	Mild	MCHR1	19	42
C#CCCN1CCC(NC(=O)c2cnc(OC)c(Br)c2)CC1	ZINC000819305792	FE	On-Demand	Mild	HPGDS	36	43
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819305805	FF	On-Demand	Anodyne	ADRB3	24	40
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819305806	FF	On-Demand	Anodyne	ADRB3	24	40
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819305807	FF	On-Demand	Anodyne	ADRB3	24	40
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819305808	FF	On-Demand	Anodyne	ADRB3	24	40
O[C@@H](CNCC1(C(F)(F)F)CC1)c1cccnc1	ZINC000819305821	CE	On-Demand	Anodyne	ADRB2	21	42
O[C@@H](CNCC1(C(F)(F)F)CC1)c1cccnc1	ZINC000819305821	CE	On-Demand	Anodyne	ADRB1	23	43
O[C@@H](CNCC1(C(F)(F)F)CC1)c1cccnc1	ZINC000819305821	CE	On-Demand	Anodyne	ADRB3	89	43
O[C@H](CNCC1(C(F)(F)F)CC1)c1cccnc1	ZINC000819305822	CE	On-Demand	Anodyne	ADRB2	21	42
O[C@H](CNCC1(C(F)(F)F)CC1)c1cccnc1	ZINC000819305822	CE	On-Demand	Anodyne	ADRB1	23	43
O[C@H](CNCC1(C(F)(F)F)CC1)c1cccnc1	ZINC000819305822	CE	On-Demand	Anodyne	ADRB3	89	43
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1cccc(C)c1	ZINC000819305833	DF	On-Demand	Mild	ADRB2	41	62
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1cccc(C)c1	ZINC000819305833	DF	On-Demand	Mild	ADRB1	40	62
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1cccc(C)c1	ZINC000819305833	DF	On-Demand	Mild	ADRB3	30	47
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1cccc(C)c1	ZINC000819305833	DF	On-Demand	Mild	PDS	57	43
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1cccc(C)c1	ZINC000819305834	DF	On-Demand	Mild	ADRB2	41	62
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1cccc(C)c1	ZINC000819305834	DF	On-Demand	Mild	ADRB1	40	62
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1cccc(C)c1	ZINC000819305834	DF	On-Demand	Mild	ADRB3	30	47
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1cccc(C)c1	ZINC000819305834	DF	On-Demand	Mild	PDS	57	43
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1cccc(C)c1	ZINC000819305835	DF	On-Demand	Mild	ADRB2	41	62
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1cccc(C)c1	ZINC000819305835	DF	On-Demand	Mild	ADRB1	40	62
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1cccc(C)c1	ZINC000819305835	DF	On-Demand	Mild	ADRB3	30	47
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1cccc(C)c1	ZINC000819305835	DF	On-Demand	Mild	PDS	57	43
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1cccc(C)c1	ZINC000819305836	DF	On-Demand	Mild	ADRB2	41	62
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1cccc(C)c1	ZINC000819305836	DF	On-Demand	Mild	ADRB1	40	62
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1cccc(C)c1	ZINC000819305836	DF	On-Demand	Mild	ADRB3	30	47
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1cccc(C)c1	ZINC000819305836	DF	On-Demand	Mild	PDS	57	43
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)CCc1ccccc1	ZINC000819305837	DG	On-Demand	Mild	MME	26	40
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)CCc1ccccc1	ZINC000819305837	DG	On-Demand	Mild	ANPEP	45	32
C#CC[C@H](Cc1ccccc1)NC[C@H](O)CCc1ccccc1	ZINC000819305838	DG	On-Demand	Mild	MME	26	40
C#CC[C@H](Cc1ccccc1)NC[C@H](O)CCc1ccccc1	ZINC000819305838	DG	On-Demand	Mild	ANPEP	45	32
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)CCc1ccccc1	ZINC000819305839	DG	On-Demand	Mild	MME	26	40
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)CCc1ccccc1	ZINC000819305839	DG	On-Demand	Mild	ANPEP	45	32
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)CCc1ccccc1	ZINC000819305840	DG	On-Demand	Mild	MME	26	40
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)CCc1ccccc1	ZINC000819305840	DG	On-Demand	Mild	ANPEP	45	32
C#CC[C@@H](Cc1ccccc1)NCCC(=O)Nc1ccccc1	ZINC000819305887	DG	On-Demand	Mild	MME	51	38
C#CC[C@H](Cc1ccccc1)NCCC(=O)Nc1ccccc1	ZINC000819305888	DG	On-Demand	Mild	MME	51	38
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819305919	DF	On-Demand	Mild	CTRB_BOVIN	45	32
C#CC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819305920	DF	On-Demand	Mild	CTRB_BOVIN	45	32
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819305921	DF	On-Demand	Mild	CTRB_BOVIN	45	32
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819305922	DF	On-Demand	Mild	CTRB_BOVIN	45	32
O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N1CCOC[C@@H]1CC1CCC1	ZINC000819306004	GG	On-Demand	Anodyne	SFRP1	62	35
O=C(c1ccc(S(=O)(=O)C(F)(F)F)cc1)N1CCOC[C@H]1CC1CCC1	ZINC000819306006	GG	On-Demand	Anodyne	SFRP1	62	35
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1C	ZINC000819306012	DF	On-Demand	Mild	ADRB2	35	62
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1C	ZINC000819306012	DF	On-Demand	Mild	ADRB1	42	38
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1C	ZINC000819306014	DF	On-Demand	Mild	ADRB2	35	62
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccccc1C	ZINC000819306014	DF	On-Demand	Mild	ADRB1	42	38
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1C	ZINC000819306016	DF	On-Demand	Mild	ADRB2	35	62
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1C	ZINC000819306016	DF	On-Demand	Mild	ADRB1	42	38
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1C	ZINC000819306018	DF	On-Demand	Mild	ADRB2	35	62
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccccc1C	ZINC000819306018	DF	On-Demand	Mild	ADRB1	42	38
C#CCCN1CCC(NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819306032	FF	On-Demand	Mild	DRD4	15	40
C#CCCN1CCC(NC(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819306032	FF	On-Demand	Mild	SIGMAR1	20	41
CN(CC(=O)N1CCOC[C@@H]1CC1CCC1)C1=NS(=O)(=O)c2ccccc21	ZINC000819306038	GD	On-Demand	Anodyne	KCNA3	19	42
CN(CC(=O)N1CCOC[C@H]1CC1CCC1)C1=NS(=O)(=O)c2ccccc21	ZINC000819306039	GD	On-Demand	Anodyne	KCNA3	19	42
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819306055	FF	On-Demand	Anodyne	ADRB3	23	46
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819306056	FF	On-Demand	Anodyne	ADRB3	23	46
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(CN2CCCCC2=O)cc1	ZINC000819306096	GI	On-Demand	Anodyne	MPL	64	36
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819306104	EF	On-Demand	Mild	ADRB2	32	48
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819306104	EF	On-Demand	Mild	ADRB1	45	48
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819306104	EF	On-Demand	Mild	ADRB3	27	48
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819306104	EF	On-Demand	Mild	CTRB_BOVIN	43	30
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819306105	EF	On-Demand	Mild	ADRB2	32	48
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819306105	EF	On-Demand	Mild	ADRB1	45	48
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819306105	EF	On-Demand	Mild	ADRB3	27	48
C#CC[C@H](Cc1ccccc1)NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819306105	EF	On-Demand	Mild	CTRB_BOVIN	43	30
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819306106	EF	On-Demand	Mild	ADRB2	32	48
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819306106	EF	On-Demand	Mild	ADRB1	45	48
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819306106	EF	On-Demand	Mild	ADRB3	27	48
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819306106	EF	On-Demand	Mild	CTRB_BOVIN	43	30
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819306107	EF	On-Demand	Mild	ADRB2	32	48
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819306107	EF	On-Demand	Mild	ADRB1	45	48
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819306107	EF	On-Demand	Mild	ADRB3	27	48
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819306107	EF	On-Demand	Mild	CTRB_BOVIN	43	30
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819306108	FF	On-Demand	Anodyne	ADRB1	40	50
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819306108	FF	On-Demand	Anodyne	ADRB3	59	52
O=C(N1CCCC1)N1CCC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819306108	FF	On-Demand	Anodyne	CYP3A4	48	37
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819306109	FF	On-Demand	Anodyne	ADRB1	40	50
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819306109	FF	On-Demand	Anodyne	ADRB3	59	52
O=C(N1CCCC1)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819306109	FF	On-Demand	Anodyne	CYP3A4	48	37
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819306110	FF	On-Demand	Anodyne	ADRB1	40	50
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819306110	FF	On-Demand	Anodyne	ADRB3	59	52
O=C(N1CCCC1)N1CCC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819306110	FF	On-Demand	Anodyne	CYP3A4	48	37
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819306111	FF	On-Demand	Anodyne	ADRB1	40	50
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819306111	FF	On-Demand	Anodyne	ADRB3	59	52
O=C(N1CCCC1)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819306111	FF	On-Demand	Anodyne	CYP3A4	48	37
C#CC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc(F)c1	ZINC000819306116	CG	On-Demand	Mild	ADRB3	23	44
C#CC[C@@H](Cc1ccccc1)NC[C@H](O)c1cccc(F)c1	ZINC000819306117	CG	On-Demand	Mild	ADRB3	23	44
C#CC[C@@H](Cc1ccccc1)NC[C@@H](O)c1cccc(F)c1	ZINC000819306118	CG	On-Demand	Mild	ADRB3	23	44
C#CC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccc(F)c1	ZINC000819306119	CG	On-Demand	Mild	ADRB3	23	44
C#CCCN1CCC(NC(=O)c2nn(-c3cc(C)cc(F)c3)c3c2CCC3)CC1	ZINC000819306122	GG	On-Demand	Mild	SSTR5	40	40
COC(=O)Nc1cccc(CNC[C@H](O)CN2CCCC2=O)c1	ZINC000819306134	DC	On-Demand	Anodyne	BACE1	18	40
COC(=O)Nc1cccc(CNC[C@@H](O)CN2CCCC2=O)c1	ZINC000819306135	DC	On-Demand	Anodyne	BACE1	18	40
COC(=O)Nc1cccc(CNC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819306145	FF	On-Demand	Anodyne	ADRB2	34	41
COC(=O)Nc1cccc(CNC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819306145	FF	On-Demand	Anodyne	ADRB1	27	41
COC(=O)Nc1cccc(CNC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819306145	FF	On-Demand	Anodyne	MTNR1A	28	45
COC(=O)Nc1cccc(CNC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819306146	FF	On-Demand	Anodyne	ADRB2	34	41
COC(=O)Nc1cccc(CNC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819306146	FF	On-Demand	Anodyne	ADRB1	27	41
COC(=O)Nc1cccc(CNC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819306146	FF	On-Demand	Anodyne	MTNR1A	28	45
COC(=O)Nc1cccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819306183	GH	On-Demand	Anodyne	ADRB2	40	37
COC(=O)Nc1cccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819306183	GH	On-Demand	Anodyne	GRIN2B	15	40
COC(=O)Nc1cccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819306183	GH	On-Demand	Anodyne	ADRB3	46	42
COC(=O)Nc1cccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819306183	GH	On-Demand	Anodyne	SCN10A	24	42
COC(=O)Nc1cccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819306184	GH	On-Demand	Anodyne	ADRB2	40	37
COC(=O)Nc1cccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819306184	GH	On-Demand	Anodyne	GRIN2B	15	40
COC(=O)Nc1cccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819306184	GH	On-Demand	Anodyne	ADRB3	46	42
COC(=O)Nc1cccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819306184	GH	On-Demand	Anodyne	SCN10A	24	42
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819306185	GE	On-Demand	Bother	ADRB2	32	42
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819306185	GE	On-Demand	Bother	ADRB1	58	39
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819306185	GE	On-Demand	Bother	ADRB3	26	42
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819306185	GE	On-Demand	Bother	TAAR1	19	41
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819306186	GE	On-Demand	Bother	ADRB2	32	42
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819306186	GE	On-Demand	Bother	ADRB1	58	39
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819306186	GE	On-Demand	Bother	ADRB3	26	42
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])c1	ZINC000819306186	GE	On-Demand	Bother	TAAR1	19	41
C#CCCN1CCC(NC(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819306193	ED	On-Demand	Mild	DRD4	45	35
C#CCCN1CCC(NC(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819306193	ED	On-Demand	Mild	DRD3	16	42
C#CCCN1CCC(NC(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819306193	ED	On-Demand	Mild	MTNR1B	16	43
C#CCCN1CCC(NC(=O)C[S@](=O)c2cccc(OC)c2)CC1	ZINC000819306193	ED	On-Demand	Mild	MCHR1	18	42
C#CCCN1CCC(NC(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819306194	ED	On-Demand	Mild	DRD4	45	35
C#CCCN1CCC(NC(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819306194	ED	On-Demand	Mild	DRD3	16	42
C#CCCN1CCC(NC(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819306194	ED	On-Demand	Mild	MTNR1B	16	43
C#CCCN1CCC(NC(=O)C[S@@](=O)c2cccc(OC)c2)CC1	ZINC000819306194	ED	On-Demand	Mild	MCHR1	18	42
CCn1cc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	ZINC000819306195	FE	On-Demand	Anodyne	GPR119	47	46
CCn1cc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	ZINC000819306196	FE	On-Demand	Anodyne	GPR119	47	46
C#CCCN1CCC(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819306197	FG	On-Demand	Mild	DRD4	28	48
C#CCCN1CCC(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819306197	FG	On-Demand	Mild	MCHR1	19	45
C#CCCN1CCC(NC(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819306197	FG	On-Demand	Mild	HPGDS	40	35
COC(=O)Nc1cccc(CNC[C@H](O)COc2c(Cl)cccc2Cl)c1	ZINC000819306204	GH	On-Demand	Anodyne	ADRB1	53	39
COC(=O)Nc1cccc(CNC[C@@H](O)COc2c(Cl)cccc2Cl)c1	ZINC000819306205	GH	On-Demand	Anodyne	ADRB1	53	39
C[C@@H]1COCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819306213	CF	On-Demand	Anodyne	ADRB3	42	39
C[C@@H]1COCC[C@@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819306213	CF	On-Demand	Anodyne	CYP3A4	46	36
C[C@@H]1COCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819306215	CF	On-Demand	Anodyne	ADRB3	42	39
C[C@@H]1COCC[C@@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819306215	CF	On-Demand	Anodyne	CYP3A4	46	36
C[C@@H]1COCC[C@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819306216	CF	On-Demand	Anodyne	ADRB3	42	39
C[C@@H]1COCC[C@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819306216	CF	On-Demand	Anodyne	CYP3A4	46	36
O=C(c1cc(-c2ccccn2)nc2ccccc12)N1CCOC[C@H]1CC1CCC1	ZINC000819306233	GI	On-Demand	Anodyne	METAP1	50	41
O=C(c1cc(-c2ccccn2)nc2ccccc12)N1CCOC[C@@H]1CC1CCC1	ZINC000819306234	GI	On-Demand	Anodyne	METAP1	50	41
O=C(NCCCCC(=O)N1CCOC[C@@H]1CC1CCC1)OCc1ccccc1	ZINC000819306265	GH	On-Demand	Anodyne	PREP	51	36
O=C(NCCCCC(=O)N1CCOC[C@@H]1CC1CCC1)OCc1ccccc1	ZINC000819306265	GH	On-Demand	Anodyne	TGM2	23	41
O=C(NCCCCC(=O)N1CCOC[C@@H]1CC1CCC1)OCc1ccccc1	ZINC000819306265	GH	On-Demand	Anodyne	NPR	47	35
O=C(NCCCCC(=O)N1CCOC[C@H]1CC1CCC1)OCc1ccccc1	ZINC000819306266	GH	On-Demand	Anodyne	PREP	51	36
O=C(NCCCCC(=O)N1CCOC[C@H]1CC1CCC1)OCc1ccccc1	ZINC000819306266	GH	On-Demand	Anodyne	TGM2	23	41
O=C(NCCCCC(=O)N1CCOC[C@H]1CC1CCC1)OCc1ccccc1	ZINC000819306266	GH	On-Demand	Anodyne	NPR	47	35
O=C(c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)N1CCOC[C@@H]1CC1CCC1	ZINC000819306267	ID	On-Demand	Anodyne	CNR2	15	46
O=C(c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)N1CCOC[C@H]1CC1CCC1	ZINC000819306268	ID	On-Demand	Anodyne	CNR2	15	46
O=C(/C=C/c1ccccc1)N1CCC(C(=O)N2CCOC[C@@H]2CC2CCC2)CC1	ZINC000819306298	GG	On-Demand	Anodyne	ITGAL	88	36
O=C(/C=C/c1ccccc1)N1CCC(C(=O)N2CCOC[C@H]2CC2CCC2)CC1	ZINC000819306299	GG	On-Demand	Anodyne	ITGAL	88	36
O=C(/C=C\c1ccccc1)N1CCC(C(=O)N2CCOC[C@@H]2CC2CCC2)CC1	ZINC000819306300	GG	On-Demand	Anodyne	ITGAL	88	36
O=C(/C=C\c1ccccc1)N1CCC(C(=O)N2CCOC[C@H]2CC2CCC2)CC1	ZINC000819306301	GG	On-Demand	Anodyne	ITGAL	88	36
CCN1CC[C@H](N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@H]1C	ZINC000819306338	GF	On-Demand	Mild	PAPA1_CARPA	29	40
CCN1CC[C@H](N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@H]1C	ZINC000819306339	GF	On-Demand	Mild	PAPA1_CARPA	29	40
CCN1CC[C@H](N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@@H]1C	ZINC000819306340	GF	On-Demand	Mild	PAPA1_CARPA	29	40
CCN1CC[C@H](N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@@H]1C	ZINC000819306341	GF	On-Demand	Mild	PAPA1_CARPA	29	40
COC(=O)Nc1cccc(CNC[C@@H](O)Cc2ccccc2C(F)(F)F)c1	ZINC000819306349	GH	On-Demand	Anodyne	CTSD	15	41
COC(=O)Nc1cccc(CNC[C@@H](O)Cc2ccccc2C(F)(F)F)c1	ZINC000819306349	GH	On-Demand	Anodyne	PDS	42	35
COC(=O)Nc1cccc(CNC[C@H](O)Cc2ccccc2C(F)(F)F)c1	ZINC000819306350	GH	On-Demand	Anodyne	CTSD	15	41
COC(=O)Nc1cccc(CNC[C@H](O)Cc2ccccc2C(F)(F)F)c1	ZINC000819306350	GH	On-Demand	Anodyne	PDS	42	35
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819306351	FE	On-Demand	Mild	ADRB2	48	45
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819306351	FE	On-Demand	Mild	ADRB1	84	45
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819306351	FE	On-Demand	Mild	GRIN1	18	42
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819306351	FE	On-Demand	Mild	ADRB3	51	45
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819306351	FE	On-Demand	Mild	PDS	45	36
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819306352	FE	On-Demand	Mild	ADRB2	48	45
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819306352	FE	On-Demand	Mild	ADRB1	84	45
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819306352	FE	On-Demand	Mild	GRIN1	18	42
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819306352	FE	On-Demand	Mild	ADRB3	51	45
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819306352	FE	On-Demand	Mild	PDS	45	36
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cc(C)ccc2C)c1	ZINC000819306357	FG	On-Demand	Anodyne	ADRB2	40	46
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cc(C)ccc2C)c1	ZINC000819306357	FG	On-Demand	Anodyne	ADRB1	62	40
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cc(C)ccc2C)c1	ZINC000819306357	FG	On-Demand	Anodyne	ADRB3	32	40
COC(=O)Nc1cccc(CNC[C@H](O)COc2cc(C)ccc2C)c1	ZINC000819306358	FG	On-Demand	Anodyne	ADRB2	40	46
COC(=O)Nc1cccc(CNC[C@H](O)COc2cc(C)ccc2C)c1	ZINC000819306358	FG	On-Demand	Anodyne	ADRB1	62	40
COC(=O)Nc1cccc(CNC[C@H](O)COc2cc(C)ccc2C)c1	ZINC000819306358	FG	On-Demand	Anodyne	ADRB3	32	40
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819306376	GF	On-Demand	Bother	ADRB3	29	43
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819306376	GF	On-Demand	Bother	CYP3A4	42	34
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819306377	GF	On-Demand	Bother	ADRB3	29	43
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819306377	GF	On-Demand	Bother	CYP3A4	42	34
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2C(C)C)c1	ZINC000819306382	FH	On-Demand	Anodyne	ADRB2	46	44
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2C(C)C)c1	ZINC000819306382	FH	On-Demand	Anodyne	ADRB1	64	44
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2C(C)C)c1	ZINC000819306382	FH	On-Demand	Anodyne	ADRB3	32	40
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2C(C)C)c1	ZINC000819306382	FH	On-Demand	Anodyne	SOAT1	27	43
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2C(C)C)c1	ZINC000819306382	FH	On-Demand	Anodyne	ABCB1	32	45
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2C(C)C)c1	ZINC000819306382	FH	On-Demand	Anodyne	KCNK3	50	43
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2C(C)C)c1	ZINC000819306382	FH	On-Demand	Anodyne	KCNK9	44	43
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2C(C)C)c1	ZINC000819306383	FH	On-Demand	Anodyne	ADRB2	46	44
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2C(C)C)c1	ZINC000819306383	FH	On-Demand	Anodyne	ADRB1	64	44
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2C(C)C)c1	ZINC000819306383	FH	On-Demand	Anodyne	ADRB3	32	40
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2C(C)C)c1	ZINC000819306383	FH	On-Demand	Anodyne	SOAT1	27	43
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2C(C)C)c1	ZINC000819306383	FH	On-Demand	Anodyne	ABCB1	32	45
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2C(C)C)c1	ZINC000819306383	FH	On-Demand	Anodyne	KCNK3	50	43
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2C(C)C)c1	ZINC000819306383	FH	On-Demand	Anodyne	KCNK9	44	43
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819306392	GF	On-Demand	Bother	ADRB3	22	41
O=C(c1cc(Cl)c[nH]1)N1CCC(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819306393	GF	On-Demand	Bother	ADRB3	22	41
COC(=O)Nc1cccc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)c1	ZINC000819306394	GI	On-Demand	Anodyne	RAF1	15	41
COC(=O)Nc1cccc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)c1	ZINC000819306394	GI	On-Demand	Anodyne	KDR	19	42
COC(=O)Nc1cccc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)c1	ZINC000819306394	GI	On-Demand	Anodyne	TEK	37	42
COC(=O)Nc1cccc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)c1	ZINC000819306394	GI	On-Demand	Anodyne	PDS	43	39
N#Cc1ccc([C@H](O)CNC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)cc1	ZINC000819306399	FE	On-Demand	Mild	ADRB3	22	40
N#Cc1ccc([C@@H](O)CNC2CCN(C(=O)c3cc(Cl)c[nH]3)CC2)cc1	ZINC000819306400	FE	On-Demand	Mild	ADRB3	22	40
COC(=O)Nc1cccc(CNC[C@H](O)COc2c(C)ccc(C)c2C)c1	ZINC000819306405	FG	On-Demand	Anodyne	ADRB2	33	40
COC(=O)Nc1cccc(CNC[C@H](O)COc2c(C)ccc(C)c2C)c1	ZINC000819306405	FG	On-Demand	Anodyne	ADRB1	52	39
COC(=O)Nc1cccc(CNC[C@@H](O)COc2c(C)ccc(C)c2C)c1	ZINC000819306406	FG	On-Demand	Anodyne	ADRB2	33	40
COC(=O)Nc1cccc(CNC[C@@H](O)COc2c(C)ccc(C)c2C)c1	ZINC000819306406	FG	On-Demand	Anodyne	ADRB1	52	39
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc(O)c2ccsc2c1	ZINC000819306424	FI	On-Demand	Anodyne	MPL	42	35
COC(=O)Nc1cccc(CNCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819306446	FG	On-Demand	Anodyne	MTNR1B	16	43
CN(CC(=O)N1CCOC[C@H]1CC1CCC1)C(=O)OCc1ccccc1	ZINC000819306470	FF	On-Demand	Anodyne	PREP	35	41
CN(CC(=O)N1CCOC[C@H]1CC1CCC1)C(=O)OCc1ccccc1	ZINC000819306470	FF	On-Demand	Anodyne	SLC12A5	66	38
CN(CC(=O)N1CCOC[C@@H]1CC1CCC1)C(=O)OCc1ccccc1	ZINC000819306471	FF	On-Demand	Anodyne	PREP	35	41
CN(CC(=O)N1CCOC[C@@H]1CC1CCC1)C(=O)OCc1ccccc1	ZINC000819306471	FF	On-Demand	Anodyne	SLC12A5	66	38
COc1ccc(C(=O)Nc2nc(CC(F)(F)F)cs2)nc1Br	ZINC000819306504	GH	On-Demand	Anodyne	CPT1A	25	42
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CCOC[C@H]1CC1CCC1	ZINC000819306532	IH	On-Demand	Anodyne	CNR2	15	53
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CCOC[C@@H]1CC1CCC1	ZINC000819306535	IH	On-Demand	Anodyne	CNR2	15	53
COC(=O)Nc1cccc(CNC[C@H](O)COc2cc(C)ccc2Cl)c1	ZINC000819306536	GG	On-Demand	Anodyne	ADRB2	26	42
COC(=O)Nc1cccc(CNC[C@H](O)COc2cc(C)ccc2Cl)c1	ZINC000819306536	GG	On-Demand	Anodyne	ADRB1	48	34
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(N2CCOCC2)nc1	ZINC000819306539	FF	On-Demand	Anodyne	MPL	64	48
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(N2CCOCC2)nc1	ZINC000819306539	FF	On-Demand	Anodyne	HDAC1	17	40
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(N2CCOCC2)nc1	ZINC000819306539	FF	On-Demand	Anodyne	DGAT1	29	41
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(N2CCOCC2)nc1	ZINC000819306539	FF	On-Demand	Anodyne	HPGDS	34	53
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cc(C)ccc2Cl)c1	ZINC000819306541	GG	On-Demand	Anodyne	ADRB2	26	42
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cc(C)ccc2Cl)c1	ZINC000819306541	GG	On-Demand	Anodyne	ADRB1	48	34
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819306544	HK	On-Demand	Anodyne	MPL	40	35
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819306544	HK	On-Demand	Anodyne	KCNJ11	28	42
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819306544	HK	On-Demand	Anodyne	CPT1A	22	40
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819306544	HK	On-Demand	Anodyne	GCK	19	45
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819306544	HK	On-Demand	Anodyne	KCNK3	91	46
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2nc(CC(F)(F)F)cs2)c1	ZINC000819306544	HK	On-Demand	Anodyne	KCNK9	72	46
CC(=O)Nc1ccc2c(COc3ncnc4ccc(Br)cc34)cc(=O)oc2c1	ZINC000819306554	II	On-Demand	Anodyne	EGFR	42	43
COC(=O)Nc1cccc(CNC[C@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819306557	FF	On-Demand	Anodyne	ADRB2	28	55
COC(=O)Nc1cccc(CNC[C@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819306557	FF	On-Demand	Anodyne	ADRB1	64	55
COC(=O)Nc1cccc(CNC[C@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819306557	FF	On-Demand	Anodyne	ADRB3	24	55
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819306559	FF	On-Demand	Anodyne	ADRB2	28	55
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819306559	FF	On-Demand	Anodyne	ADRB1	64	55
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819306559	FF	On-Demand	Anodyne	ADRB3	24	55
CCn1cc(CNC[C@H](O)c2ccc(F)cc2Cl)cn1	ZINC000819306607	CF	On-Demand	Anodyne	P2RX7	27	41
CCn1cc(CNC[C@@H](O)c2ccc(F)cc2Cl)cn1	ZINC000819306609	CF	On-Demand	Anodyne	P2RX7	27	41
C#CCCN1CCC(NC(=O)c2cnc3cc(OC)ccn23)CC1	ZINC000819306617	ED	On-Demand	Mild	DRD4	43	34
C#CCCN1CCC(NC(=O)c2cnc3cc(OC)ccn23)CC1	ZINC000819306617	ED	On-Demand	Mild	SSTR5	41	36
C#CCCN1CCC(NC(=O)c2cnc3cc(OC)ccn23)CC1	ZINC000819306617	ED	On-Demand	Mild	PDK1	40	33
C#CCCN1CCC(NC(=O)c2cnc3cc(OC)ccn23)CC1	ZINC000819306617	ED	On-Demand	Mild	MCHR1	21	43
C#CCCN1CCC(NC(=O)c2cnc3cc(OC)ccn23)CC1	ZINC000819306617	ED	On-Demand	Mild	HPGDS	32	41
O=C1c2ccccc2C(=O)N1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819306618	FF	On-Demand	Anodyne	ADRB2	62	38
O=C1c2ccccc2C(=O)N1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819306618	FF	On-Demand	Anodyne	ADRB1	64	50
O=C1c2ccccc2C(=O)N1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819306618	FF	On-Demand	Anodyne	ADRB3	82	50
O=C1c2ccccc2C(=O)N1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819306620	FF	On-Demand	Anodyne	ADRB2	62	38
O=C1c2ccccc2C(=O)N1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819306620	FF	On-Demand	Anodyne	ADRB1	64	50
O=C1c2ccccc2C(=O)N1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819306620	FF	On-Demand	Anodyne	ADRB3	82	50
COC(=O)Nc1cccc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819306647	GE	On-Demand	Anodyne	ADRB2	42	32
COC(=O)Nc1cccc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819306647	GE	On-Demand	Anodyne	ADRB3	63	39
COC(=O)Nc1cccc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819306649	GE	On-Demand	Anodyne	ADRB2	42	32
COC(=O)Nc1cccc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819306649	GE	On-Demand	Anodyne	ADRB3	63	39
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(C)cc2C)c1	ZINC000819306664	FG	On-Demand	Anodyne	ADRB2	28	44
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccc(C)cc2C)c1	ZINC000819306664	FG	On-Demand	Anodyne	ADRB1	55	35
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(C)cc2C)c1	ZINC000819306666	FG	On-Demand	Anodyne	ADRB2	28	44
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccc(C)cc2C)c1	ZINC000819306666	FG	On-Demand	Anodyne	ADRB1	55	35
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc([N+](=O)[O-])ccc1N1CCCC1	ZINC000819306675	HI	On-Demand	Bother	WDR5	34	40
C[C@@H]1COCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819306680	CD	On-Demand	Anodyne	ADRB2	17	41
C[C@@H]1COCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819306680	CD	On-Demand	Anodyne	ADRB1	21	45
C[C@@H]1COCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819306680	CD	On-Demand	Anodyne	ADRB3	80	45
C[C@@H]1COCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819306681	CD	On-Demand	Anodyne	ADRB2	17	41
C[C@@H]1COCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819306681	CD	On-Demand	Anodyne	ADRB1	21	45
C[C@@H]1COCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819306681	CD	On-Demand	Anodyne	ADRB3	80	45
C[C@@H]1COCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819306683	CD	On-Demand	Anodyne	ADRB2	17	41
C[C@@H]1COCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819306683	CD	On-Demand	Anodyne	ADRB1	21	45
C[C@@H]1COCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819306683	CD	On-Demand	Anodyne	ADRB3	80	45
C[C@@H]1COCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819306685	CD	On-Demand	Anodyne	ADRB2	17	41
C[C@@H]1COCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819306685	CD	On-Demand	Anodyne	ADRB1	21	45
C[C@@H]1COCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819306685	CD	On-Demand	Anodyne	ADRB3	80	45
O=C(/C=C/c1ccnc2ccccc12)N1CCOC[C@@H]1CC1CCC1	ZINC000819306720	EH	On-Demand	Anodyne	ITGAL	67	35
O=C(/C=C\c1ccnc2ccccc12)N1CCOC[C@H]1CC1CCC1	ZINC000819306721	EH	On-Demand	Anodyne	ITGAL	67	35
O=C(/C=C/c1ccnc2ccccc12)N1CCOC[C@H]1CC1CCC1	ZINC000819306722	EH	On-Demand	Anodyne	ITGAL	67	35
O=C(/C=C\c1ccnc2ccccc12)N1CCOC[C@@H]1CC1CCC1	ZINC000819306723	EH	On-Demand	Anodyne	ITGAL	67	35
CN(CCCC(=O)N1CCOC[C@@H]1CC1CCC1)C1=NS(=O)(=O)c2ccccc21	ZINC000819306760	HE	On-Demand	Anodyne	KCNA3	20	40
CN(CCCC(=O)N1CCOC[C@H]1CC1CCC1)C1=NS(=O)(=O)c2ccccc21	ZINC000819306761	HE	On-Demand	Anodyne	KCNA3	20	40
O=C(Nc1nc(CC(F)(F)F)cs1)c1cccnc1Br	ZINC000819306779	FH	On-Demand	Anodyne	MPL	48	34
CN(C)c1ccc(NC(=O)CCNCCCN2C(=O)c3ccccc3C2=O)cc1	ZINC000819306815	GE	On-Demand	Anodyne	HDAC10	15	43
COC(=O)Nc1cccc(CNC[C@@H](O)COc2c(C)cccc2C)c1	ZINC000819306833	FG	On-Demand	Anodyne	ADRB2	35	42
COC(=O)Nc1cccc(CNC[C@@H](O)COc2c(C)cccc2C)c1	ZINC000819306833	FG	On-Demand	Anodyne	ADRB1	50	39
COC(=O)Nc1cccc(CNC[C@H](O)COc2c(C)cccc2C)c1	ZINC000819306834	FG	On-Demand	Anodyne	ADRB2	35	42
COC(=O)Nc1cccc(CNC[C@H](O)COc2c(C)cccc2C)c1	ZINC000819306834	FG	On-Demand	Anodyne	ADRB1	50	39
C[C@H]1C[C@@H](C)CN1C(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819306854	GF	On-Demand	Anodyne	PREP	18	40
C[C@H]1C[C@@H](C)CN1C(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819306859	GF	On-Demand	Anodyne	PREP	18	40
CC[C@@H](O)CNCc1cccc(NC(=O)OC)c1	ZINC000819306863	CD	On-Demand	Anodyne	KCNK3	50	34
CC[C@@H](O)CNCc1cccc(NC(=O)OC)c1	ZINC000819306863	CD	On-Demand	Anodyne	KCNK9	53	34
CC[C@@H](O)CNCc1cccc(NC(=O)OC)c1	ZINC000819306863	CD	On-Demand	Anodyne	PDS	61	37
COC(=O)Nc1cccc(CNC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)c1	ZINC000819306872	GH	On-Demand	Anodyne	CTSD	18	41
COC(=O)Nc1cccc(CNC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)c1	ZINC000819306872	GH	On-Demand	Anodyne	SLC1A2	30	44
COC(=O)Nc1cccc(CNC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)c1	ZINC000819306872	GH	On-Demand	Anodyne	PDS	46	39
COC(=O)Nc1cccc(CNC[C@H](O)Cc2ccc(C(F)(F)F)cc2)c1	ZINC000819306874	GH	On-Demand	Anodyne	CTSD	18	41
COC(=O)Nc1cccc(CNC[C@H](O)Cc2ccc(C(F)(F)F)cc2)c1	ZINC000819306874	GH	On-Demand	Anodyne	SLC1A2	30	44
COC(=O)Nc1cccc(CNC[C@H](O)Cc2ccc(C(F)(F)F)cc2)c1	ZINC000819306874	GH	On-Demand	Anodyne	PDS	46	39
N#Cc1ncn(CCNC[C@@H](O)c2ccccc2)n1	ZINC000819306882	CC	On-Demand	Mild	ADRB2	15	43
N#Cc1ncn(CCNC[C@@H](O)c2ccccc2)n1	ZINC000819306882	CC	On-Demand	Mild	ADRB3	40	40
N#Cc1ncn(CCNC[C@H](O)c2ccccc2)n1	ZINC000819306884	CC	On-Demand	Mild	ADRB2	15	43
N#Cc1ncn(CCNC[C@H](O)c2ccccc2)n1	ZINC000819306884	CC	On-Demand	Mild	ADRB3	40	40
COC(=O)Nc1cccc(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819306903	GG	On-Demand	Anodyne	ADRB2	37	41
COC(=O)Nc1cccc(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819306903	GG	On-Demand	Anodyne	ADRB1	59	47
COC(=O)Nc1cccc(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819306903	GG	On-Demand	Anodyne	ADRB3	38	43
COC(=O)Nc1cccc(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819306903	GG	On-Demand	Anodyne	PDS	93	53
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819306904	GG	On-Demand	Anodyne	ADRB2	37	41
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819306904	GG	On-Demand	Anodyne	ADRB1	59	47
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819306904	GG	On-Demand	Anodyne	ADRB3	38	43
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819306904	GG	On-Demand	Anodyne	PDS	93	53
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819306907	FF	On-Demand	Anodyne	ADRB2	42	43
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819306907	FF	On-Demand	Anodyne	ADRB1	70	43
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819306907	FF	On-Demand	Anodyne	ADRB3	43	43
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819306907	FF	On-Demand	Anodyne	ABCB1	20	46
COC(=O)Nc1cccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819306907	FF	On-Demand	Anodyne	PDS	82	39
COC(=O)Nc1cccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819306908	FF	On-Demand	Anodyne	ADRB2	42	43
COC(=O)Nc1cccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819306908	FF	On-Demand	Anodyne	ADRB1	70	43
COC(=O)Nc1cccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819306908	FF	On-Demand	Anodyne	ADRB3	43	43
COC(=O)Nc1cccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819306908	FF	On-Demand	Anodyne	ABCB1	20	46
COC(=O)Nc1cccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819306908	FF	On-Demand	Anodyne	PDS	82	39
O[C@@H](CNCC(F)(F)c1ccc(Cl)cc1)c1cccnc1	ZINC000819306909	DG	On-Demand	Anodyne	ADRB2	20	43
O[C@@H](CNCC(F)(F)c1ccc(Cl)cc1)c1cccnc1	ZINC000819306909	DG	On-Demand	Anodyne	ADRB1	27	44
O[C@@H](CNCC(F)(F)c1ccc(Cl)cc1)c1cccnc1	ZINC000819306909	DG	On-Demand	Anodyne	ADRB3	91	48
O[C@H](CNCC(F)(F)c1ccc(Cl)cc1)c1cccnc1	ZINC000819306910	DG	On-Demand	Anodyne	ADRB2	20	43
O[C@H](CNCC(F)(F)c1ccc(Cl)cc1)c1cccnc1	ZINC000819306910	DG	On-Demand	Anodyne	ADRB1	27	44
O[C@H](CNCC(F)(F)c1ccc(Cl)cc1)c1cccnc1	ZINC000819306910	DG	On-Demand	Anodyne	ADRB3	91	48
CCOC(=O)C1CCC(O)(CNCc2cccc(NC(=O)OC)c2)CC1	ZINC000819306913	FE	On-Demand	Anodyne	TIMP3	40	31
N#Cc1ncn(CCNC[C@@H](O)c2cccc(F)c2)n1	ZINC000819306915	CC	On-Demand	Mild	ADRB3	21	42
N#Cc1ncn(CCNC[C@H](O)c2cccc(F)c2)n1	ZINC000819306916	CC	On-Demand	Mild	ADRB3	21	42
COC(=O)Nc1cccc(CNC[C@@H](O)CO[C@H](C)c2ccc(Cl)cc2)c1	ZINC000819306922	GH	On-Demand	Anodyne	PDS	42	32
COC(=O)Nc1cccc(CNC[C@@H](O)CO[C@@H](C)c2ccc(Cl)cc2)c1	ZINC000819306923	GH	On-Demand	Anodyne	PDS	42	32
COC(=O)Nc1cccc(CNC[C@H](O)CO[C@H](C)c2ccc(Cl)cc2)c1	ZINC000819306924	GH	On-Demand	Anodyne	PDS	42	32
COC(=O)Nc1cccc(CNC[C@H](O)CO[C@@H](C)c2ccc(Cl)cc2)c1	ZINC000819306925	GH	On-Demand	Anodyne	PDS	42	32
CS(=O)(=O)c1ccc([C@@H](O)CNCC(F)(F)c2ccc(Cl)cc2)cc1	ZINC000819306929	GG	On-Demand	Anodyne	PTGS2	19	40
CS(=O)(=O)c1ccc([C@@H](O)CNCC(F)(F)c2ccc(Cl)cc2)cc1	ZINC000819306929	GG	On-Demand	Anodyne	CTSF	47	32
CS(=O)(=O)c1ccc([C@H](O)CNCC(F)(F)c2ccc(Cl)cc2)cc1	ZINC000819306930	GG	On-Demand	Anodyne	PTGS2	19	40
CS(=O)(=O)c1ccc([C@H](O)CNCC(F)(F)c2ccc(Cl)cc2)cc1	ZINC000819306930	GG	On-Demand	Anodyne	CTSF	47	32
COC(=O)Nc1cccc(CNCCS(C)(=O)=O)c1	ZINC000819306935	CC	On-Demand	Anodyne	NQO2	21	41
COC(=O)Nc1cccc(CNCCS(C)(=O)=O)c1	ZINC000819306935	CC	On-Demand	Anodyne	NOS1	22	42
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819306936	FG	On-Demand	Anodyne	ADRB2	43	51
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819306936	FG	On-Demand	Anodyne	ADRB1	72	41
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819306936	FG	On-Demand	Anodyne	ADRB3	39	41
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819306936	FG	On-Demand	Anodyne	ABCB1	32	40
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819306936	FG	On-Demand	Anodyne	KCNK3	47	34
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819306936	FG	On-Demand	Anodyne	KCNK9	40	34
COC(=O)Nc1cccc(CNC[C@H](O)COc2ccccc2Cl)c1	ZINC000819306936	FG	On-Demand	Anodyne	PDS	50	45
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819306937	FG	On-Demand	Anodyne	ADRB2	43	51
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819306937	FG	On-Demand	Anodyne	ADRB1	72	41
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819306937	FG	On-Demand	Anodyne	ADRB3	39	41
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819306937	FG	On-Demand	Anodyne	ABCB1	32	40
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819306937	FG	On-Demand	Anodyne	KCNK3	47	34
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819306937	FG	On-Demand	Anodyne	KCNK9	40	34
COC(=O)Nc1cccc(CNC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819306937	FG	On-Demand	Anodyne	PDS	50	45
COC(=O)Nc1cccc(CNC[C@H](O)CN2CCc3ccccc3C2)c1	ZINC000819306939	FE	On-Demand	Anodyne	NOD1	17	40
COC(=O)Nc1cccc(CNC[C@H](O)CN2CCc3ccccc3C2)c1	ZINC000819306939	FE	On-Demand	Anodyne	NOD2	46	40
COC(=O)Nc1cccc(CNC[C@@H](O)CN2CCc3ccccc3C2)c1	ZINC000819306940	FE	On-Demand	Anodyne	NOD1	17	40
COC(=O)Nc1cccc(CNC[C@@H](O)CN2CCc3ccccc3C2)c1	ZINC000819306940	FE	On-Demand	Anodyne	NOD2	46	40
O=C(c1ccnc(-n2ccnc2)c1)N1CCOC[C@@H]1CC1CCC1	ZINC000819306963	EE	On-Demand	Anodyne	NOS2	70	39
O=C(c1ccnc(-n2ccnc2)c1)N1CCOC[C@H]1CC1CCC1	ZINC000819306964	EE	On-Demand	Anodyne	NOS2	70	39
O=C(Nc1cc(C(F)(F)F)cnc1O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819306977	IG	On-Demand	Anodyne	TRPM8	40	37
O=C(OCc1ccccc1)N1CCC(C(=O)N2CCOC[C@@H]2CC2CCC2)CC1	ZINC000819307011	HG	On-Demand	Anodyne	GRIN2B	22	45
O=C(OCc1ccccc1)N1CCC(C(=O)N2CCOC[C@@H]2CC2CCC2)CC1	ZINC000819307011	HG	On-Demand	Anodyne	PREP	43	47
O=C(OCc1ccccc1)N1CCC(C(=O)N2CCOC[C@@H]2CC2CCC2)CC1	ZINC000819307011	HG	On-Demand	Anodyne	TGM2	23	40
O=C(OCc1ccccc1)N1CCC(C(=O)N2CCOC[C@@H]2CC2CCC2)CC1	ZINC000819307011	HG	On-Demand	Anodyne	F13A1	29	40
O=C(OCc1ccccc1)N1CCC(C(=O)N2CCOC[C@@H]2CC2CCC2)CC1	ZINC000819307011	HG	On-Demand	Anodyne	SLC12A5	44	40
O=C(OCc1ccccc1)N1CCC(C(=O)N2CCOC[C@H]2CC2CCC2)CC1	ZINC000819307012	HG	On-Demand	Anodyne	GRIN2B	22	45
O=C(OCc1ccccc1)N1CCC(C(=O)N2CCOC[C@H]2CC2CCC2)CC1	ZINC000819307012	HG	On-Demand	Anodyne	PREP	43	47
O=C(OCc1ccccc1)N1CCC(C(=O)N2CCOC[C@H]2CC2CCC2)CC1	ZINC000819307012	HG	On-Demand	Anodyne	TGM2	23	40
O=C(OCc1ccccc1)N1CCC(C(=O)N2CCOC[C@H]2CC2CCC2)CC1	ZINC000819307012	HG	On-Demand	Anodyne	F13A1	29	40
O=C(OCc1ccccc1)N1CCC(C(=O)N2CCOC[C@H]2CC2CCC2)CC1	ZINC000819307012	HG	On-Demand	Anodyne	SLC12A5	44	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	F2	24	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	PLG	24	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	ACE	33	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	P2RY12	50	33
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	ELANE	23	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	CTRA_BOVIN	72	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	KLK3	70	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	CTSB	50	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	PAPA1_CARPA	41	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	TRY1_BOVIN	46	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	CYSP_TRYCR	52	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	CTSG	49	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	CTSK	40	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	CTSL	50	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	PREP	22	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	CAPNS1	59	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	CELA2A	59	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	REN	61	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	CTSS	41	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	CAPN1	70	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	CAPN2	116	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	PLAU	15	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	TGM2	27	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	TPSAB1	43	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	KLK1	21	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307065	HF	On-Demand	Anodyne	NPR	61	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	F2	24	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	PLG	24	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	ACE	33	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	P2RY12	50	33
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	ELANE	23	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	CTRA_BOVIN	72	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	KLK3	70	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	CTSB	50	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	PAPA1_CARPA	41	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	TRY1_BOVIN	46	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	CYSP_TRYCR	52	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	CTSG	49	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	CTSK	40	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	CTSL	50	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	PREP	22	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	CAPNS1	59	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	CELA2A	59	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	REN	61	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	CTSS	41	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	CAPN1	70	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	CAPN2	116	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	PLAU	15	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	TGM2	27	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	TPSAB1	43	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	KLK1	21	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307066	HF	On-Demand	Anodyne	NPR	61	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	F2	24	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	PLG	24	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	ACE	33	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	P2RY12	50	33
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	ELANE	23	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	CTRA_BOVIN	72	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	KLK3	70	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	CTSB	50	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	PAPA1_CARPA	41	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	TRY1_BOVIN	46	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	CYSP_TRYCR	52	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	CTSG	49	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	CTSK	40	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	CTSL	50	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	PREP	22	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	CAPNS1	59	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	CELA2A	59	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	REN	61	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	CTSS	41	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	CAPN1	70	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	CAPN2	116	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	PLAU	15	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	TGM2	27	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	TPSAB1	43	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	KLK1	21	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307067	HF	On-Demand	Anodyne	NPR	61	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	F2	24	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	PLG	24	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	ACE	33	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	P2RY12	50	33
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	ELANE	23	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	CTRA_BOVIN	72	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	KLK3	70	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	CTSB	50	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	PAPA1_CARPA	41	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	TRY1_BOVIN	46	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	CYSP_TRYCR	52	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	CTSG	49	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	CTSK	40	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	CTSL	50	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	PREP	22	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	CAPNS1	59	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	CELA2A	59	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	REN	61	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	CTSS	41	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	CAPN1	70	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	CAPN2	116	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	PLAU	15	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	TGM2	27	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	TPSAB1	43	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	KLK1	21	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307068	HF	On-Demand	Anodyne	NPR	61	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	ACE	55	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	CELA1	32	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	ELANE	39	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	MME	28	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	PGC	46	32
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	CTRA_BOVIN	67	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	KLK3	56	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	CTSB	56	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	PAPA1_CARPA	62	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	TRY1_BOVIN	40	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	CYSP_TRYCR	50	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	CTSG	47	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	CTSK	39	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	CTSL	46	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	PREP	29	57
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	CAPNS1	73	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	CELA2A	55	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	REN	68	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	LGMN	55	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	CTSS	42	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	CAPN1	76	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	CASP1	25	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	CTRC	16	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	CAPN2	124	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	PLAU	15	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	TGM2	26	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	KLK5	40	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	NPR	62	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307108	FF	On-Demand	Anodyne	SLC12A5	59	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	ACE	55	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	CELA1	32	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	ELANE	39	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	MME	28	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	PGC	46	32
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	CTRA_BOVIN	67	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	KLK3	56	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	CTSB	56	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	PAPA1_CARPA	62	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	TRY1_BOVIN	40	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	CYSP_TRYCR	50	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	CTSG	47	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	CTSK	39	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	CTSL	46	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	PREP	29	57
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	CAPNS1	73	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	CELA2A	55	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	REN	68	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	LGMN	55	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	CTSS	42	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	CAPN1	76	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	CASP1	25	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	CTRC	16	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	CAPN2	124	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	PLAU	15	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	TGM2	26	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	KLK5	40	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	NPR	62	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307109	FF	On-Demand	Anodyne	SLC12A5	59	38
O=C(/C=C\c1ccco1)N1CCOC[C@@H]1CC1CCC1	ZINC000819307121	CF	On-Demand	Anodyne	ITGAL	40	33
O=C(/C=C\c1ccco1)N1CCOC[C@H]1CC1CCC1	ZINC000819307122	CF	On-Demand	Anodyne	ITGAL	40	33
O=C(/C=C/c1ccco1)N1CCOC[C@H]1CC1CCC1	ZINC000819307123	CF	On-Demand	Anodyne	ITGAL	40	33
O=C(/C=C/c1ccco1)N1CCOC[C@@H]1CC1CCC1	ZINC000819307124	CF	On-Demand	Anodyne	ITGAL	40	33
O=C(Nc1nc(CC(F)(F)F)cs1)[C@@H]1CC(=O)N(C2CCCC2)C1	ZINC000819307129	FF	On-Demand	Anodyne	INHA	23	49
O=C(Nc1nc(CC(F)(F)F)cs1)[C@H]1CC(=O)N(C2CCCC2)C1	ZINC000819307130	FF	On-Demand	Anodyne	INHA	23	49
O=C(O)[C@H]1CN(C(=O)CCc2nc(-c3ncccn3)no2)CCO1	ZINC000819307182	EB	On-Demand	Anodyne	ETHR	43	34
O=C(O)[C@@H]1CN(C(=O)CCc2nc(-c3ncccn3)no2)CCO1	ZINC000819307183	EB	On-Demand	Anodyne	ETHR	43	34
O=C(O)[C@@H]1CN(C(=O)CCSc2ccnc3cc(Cl)ccc23)CCO1	ZINC000819307188	GF	On-Demand	Anodyne	HRP1_PLAFA	78	34
O=C(O)[C@H]1CN(C(=O)CCSc2ccnc3cc(Cl)ccc23)CCO1	ZINC000819307189	GF	On-Demand	Anodyne	HRP1_PLAFA	78	34
O=C(O)[C@H]1CN(C(=O)CN2CCN(c3ccccn3)CC2)CCO1	ZINC000819307199	EB	On-Demand	Anodyne	DRD4	33	43
O=C(O)[C@H]1CN(C(=O)CN2CCN(c3ccccn3)CC2)CCO1	ZINC000819307199	EB	On-Demand	Anodyne	SLC27A1	30	42
O=C(O)[C@@H]1CN(C(=O)CN2CCN(c3ccccn3)CC2)CCO1	ZINC000819307200	EB	On-Demand	Anodyne	DRD4	33	43
O=C(O)[C@@H]1CN(C(=O)CN2CCN(c3ccccn3)CC2)CCO1	ZINC000819307200	EB	On-Demand	Anodyne	SLC27A1	30	42
O=C(O)[C@@H]1CN(C(=O)N[C@H]2C[C@H]2c2ccccc2C(F)(F)F)CCO1	ZINC000819307231	FE	On-Demand	Anodyne	EPHX2	22	48
O=C(O)[C@@H]1CN(C(=O)N[C@H]2C[C@H]2c2ccccc2C(F)(F)F)CCO1	ZINC000819307231	FE	On-Demand	Anodyne	RBP4	101	44
O=C(O)[C@@H]1CN(C(=O)N[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)CCO1	ZINC000819307233	FE	On-Demand	Anodyne	EPHX2	22	48
O=C(O)[C@@H]1CN(C(=O)N[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)CCO1	ZINC000819307233	FE	On-Demand	Anodyne	RBP4	101	44
O=C(O)[C@@H]1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCO1	ZINC000819307235	FE	On-Demand	Anodyne	EPHX2	22	48
O=C(O)[C@@H]1CN(C(=O)N[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)CCO1	ZINC000819307235	FE	On-Demand	Anodyne	RBP4	101	44
O=C(O)[C@@H]1CN(C(=O)N[C@H]2C[C@@H]2c2ccccc2C(F)(F)F)CCO1	ZINC000819307237	FE	On-Demand	Anodyne	EPHX2	22	48
O=C(O)[C@@H]1CN(C(=O)N[C@H]2C[C@@H]2c2ccccc2C(F)(F)F)CCO1	ZINC000819307237	FE	On-Demand	Anodyne	RBP4	101	44
O=Cc1cccc(OCC(=O)N2CCOC[C@@H]2CC2CCC2)c1	ZINC000819307246	DE	On-Demand	Anodyne	CPT1A	117	38
O=Cc1cccc(OCC(=O)N2CCOC[C@@H]2CC2CCC2)c1	ZINC000819307246	DE	On-Demand	Anodyne	CPT2	49	38
O=Cc1cccc(OCC(=O)N2CCOC[C@H]2CC2CCC2)c1	ZINC000819307248	DE	On-Demand	Anodyne	CPT1A	117	38
O=Cc1cccc(OCC(=O)N2CCOC[C@H]2CC2CCC2)c1	ZINC000819307248	DE	On-Demand	Anodyne	CPT2	49	38
O=C(O)[C@@H]1CN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)CCO1	ZINC000819307256	GC	On-Demand	Anodyne	GRIN2B	23	42
O=C(O)[C@@H]1CN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)CCO1	ZINC000819307256	GC	On-Demand	Anodyne	SLC12A5	56	35
O=C(O)[C@H]1CN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)CCO1	ZINC000819307258	GC	On-Demand	Anodyne	GRIN2B	23	42
O=C(O)[C@H]1CN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)CCO1	ZINC000819307258	GC	On-Demand	Anodyne	SLC12A5	56	35
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	F2	27	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	ACE	28	48
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	ELANE	21	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	CTRA_BOVIN	71	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	KLK3	59	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	CTSB	44	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	PAPA1_CARPA	55	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	TRY1_BOVIN	46	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	CYSP_TRYCR	50	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	CTSG	50	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	CTSK	35	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	CTSL	48	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	NPFFR2	40	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	PREP	23	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	CAPNS1	57	32
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	CELA2A	59	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	REN	39	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	LGMN	68	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	TGM1	24	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	CTSS	31	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	CAPN1	57	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	CTRC	22	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	CAPN2	93	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	TGM2	28	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307288	HD	On-Demand	Anodyne	TPSAB1	40	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	F2	27	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	ACE	28	48
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	ELANE	21	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	CTRA_BOVIN	71	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	KLK3	59	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	CTSB	44	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	PAPA1_CARPA	55	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	TRY1_BOVIN	46	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	CYSP_TRYCR	50	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	CTSG	50	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	CTSK	35	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	CTSL	48	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	NPFFR2	40	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	PREP	23	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	CAPNS1	57	32
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	CELA2A	59	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	REN	39	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	LGMN	68	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	TGM1	24	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	CTSS	31	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	CAPN1	57	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	CTRC	22	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	CAPN2	93	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	TGM2	28	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307289	HD	On-Demand	Anodyne	TPSAB1	40	33
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(OC(F)(F)Cl)cc1	ZINC000819307336	GJ	On-Demand	Anodyne	MPL	63	38
O=C(Nc1nc(CC(F)(F)F)cs1)c1ccc(OC(F)(F)Cl)cc1	ZINC000819307336	GJ	On-Demand	Anodyne	SHH	44	35
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cc(C(F)(F)F)cnc2O)c1	ZINC000819307337	HF	On-Demand	Anodyne	ATF1	54	34
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cc(C(F)(F)F)cnc2O)c1	ZINC000819307337	HF	On-Demand	Anodyne	NFKB1	50	34
CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cc(C(F)(F)F)cnc2O)c1	ZINC000819307337	HF	On-Demand	Anodyne	TRPM8	48	41
C#CCNS(=O)(=O)c1ccc(C(=O)N2CCOC[C@@H]2CC2CCC2)cc1	ZINC000819307342	GD	On-Demand	Mild	SFRP1	40	32
C#CCNS(=O)(=O)c1ccc(C(=O)N2CCOC[C@H]2CC2CCC2)cc1	ZINC000819307343	GD	On-Demand	Mild	SFRP1	40	32
O=C(c1cc2ccccc2c(Cl)n1)N1CCOC[C@@H]1CC1CCC1	ZINC000819307354	EH	On-Demand	Anodyne	CCKAR	44	32
O=C(c1cc2ccccc2c(Cl)n1)N1CCOC[C@H]1CC1CCC1	ZINC000819307355	EH	On-Demand	Anodyne	CCKAR	44	32
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCOC[C@@H]1CC1CCC1	ZINC000819307399	HF	On-Demand	Anodyne	ITGAL	40	30
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCOC[C@H]1CC1CCC1	ZINC000819307400	HF	On-Demand	Anodyne	ITGAL	40	30
O=Cc1cc(C(=O)Nc2nc(CC(F)(F)F)cs2)cs1	ZINC000819307405	DG	On-Demand	Anodyne	MPL	54	33
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307406	EG	On-Demand	Bother	SLC27A4	47	30
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307407	EG	On-Demand	Bother	SLC27A4	47	30
C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819307408	EG	On-Demand	Bother	SLC27A4	47	30
C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819307409	EG	On-Demand	Bother	SLC27A4	47	30
C[C@@](O)(CC(=O)N1CCOC[C@H]1CC1CCC1)c1ccccc1	ZINC000819307426	DF	On-Demand	Anodyne	AMY2	43	29
C[C@@](O)(CC(=O)N1CCOC[C@@H]1CC1CCC1)c1ccccc1	ZINC000819307428	DF	On-Demand	Anodyne	AMY2	43	29
O=C(Nc1nc(CC(F)(F)F)cs1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000819307433	GG	On-Demand	Bother	MPL	42	34
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCOC[C@@H]1CC1CCC1	ZINC000819307434	GE	On-Demand	Anodyne	SFRP1	122	40
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCOC[C@@H]1CC1CCC1	ZINC000819307434	GE	On-Demand	Anodyne	WNT3	82	37
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCOC[C@H]1CC1CCC1	ZINC000819307435	GE	On-Demand	Anodyne	SFRP1	122	40
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCOC[C@H]1CC1CCC1	ZINC000819307435	GE	On-Demand	Anodyne	WNT3	82	37
COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCOC[C@@H]3CC3CCC3)CC2)cc1	ZINC000819307494	IE	On-Demand	Clean	ITGAL	52	33
COc1ccc(N2CCN(C(=O)/C=C/C(=O)N3CCOC[C@H]3CC3CCC3)CC2)cc1	ZINC000819307495	IE	On-Demand	Clean	ITGAL	52	33
COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCOC[C@H]3CC3CCC3)CC2)cc1	ZINC000819307496	IE	On-Demand	Clean	ITGAL	52	33
COc1ccc(N2CCN(C(=O)/C=C\C(=O)N3CCOC[C@@H]3CC3CCC3)CC2)cc1	ZINC000819307497	IE	On-Demand	Clean	ITGAL	52	33
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CCOC[C@@H]1CC1CCC1	ZINC000819307522	IG	On-Demand	Anodyne	CNR2	15	54
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CCOC[C@H]1CC1CCC1	ZINC000819307523	IG	On-Demand	Anodyne	CNR2	15	54
COc1ccc2c(C)c(CCC(=O)N3CCOC[C@@H]3CC3CCC3)c(=O)oc2c1	ZINC000819307531	GG	On-Demand	Anodyne	MAOB	27	41
COc1ccc2c(C)c(CCC(=O)N3CCOC[C@H]3CC3CCC3)c(=O)oc2c1	ZINC000819307532	GG	On-Demand	Anodyne	MAOB	27	41
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(CC#N)cc2)CC1	ZINC000819307561	FD	On-Demand	Mild	ADRB2	44	41
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(CC#N)cc2)CC1	ZINC000819307561	FD	On-Demand	Mild	ADRB1	80	45
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(CC#N)cc2)CC1	ZINC000819307561	FD	On-Demand	Mild	GRIN2B	19	41
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(CC#N)cc2)CC1	ZINC000819307561	FD	On-Demand	Mild	ADRB3	55	45
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(CC#N)cc2)CC1	ZINC000819307562	FD	On-Demand	Mild	ADRB2	44	41
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(CC#N)cc2)CC1	ZINC000819307562	FD	On-Demand	Mild	ADRB1	80	45
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(CC#N)cc2)CC1	ZINC000819307562	FD	On-Demand	Mild	GRIN2B	19	41
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(CC#N)cc2)CC1	ZINC000819307562	FD	On-Demand	Mild	ADRB3	55	45
COC(=O)N1CCC(CNC[C@H](O)c2ccc(Cl)cc2Cl)CC1	ZINC000819307563	FG	On-Demand	Anodyne	CACNA1I	62	40
COC(=O)N1CCC(CNC[C@@H](O)c2ccc(Cl)cc2Cl)CC1	ZINC000819307564	FG	On-Demand	Anodyne	CACNA1I	62	40
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](COCc1ccccc1)c1ccccc1	ZINC000819307575	FH	On-Demand	Anodyne	MAN1B1	18	40
O=C(/C=C\[C@@H]1CCCO1)N[C@H](COCc1ccccc1)c1ccccc1	ZINC000819307576	FH	On-Demand	Anodyne	MAN1B1	18	40
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](COCc1ccccc1)c1ccccc1	ZINC000819307577	FH	On-Demand	Anodyne	MAN1B1	18	40
O=C(/C=C/[C@@H]1CCCO1)N[C@H](COCc1ccccc1)c1ccccc1	ZINC000819307578	FH	On-Demand	Anodyne	MAN1B1	18	40
COC(=O)N1CCC(CNC[C@@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819307591	FF	On-Demand	Anodyne	F2	29	42
COC(=O)N1CCC(CNC[C@@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819307591	FF	On-Demand	Anodyne	GRIN2B	49	43
COC(=O)N1CCC(CNC[C@@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819307591	FF	On-Demand	Anodyne	ADRB3	26	40
COC(=O)N1CCC(CNC[C@@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819307591	FF	On-Demand	Anodyne	TRY2_BOVIN	71	42
COC(=O)N1CCC(CNC[C@@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819307591	FF	On-Demand	Anodyne	NMT1	18	40
COC(=O)N1CCC(CNC[C@@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819307591	FF	On-Demand	Anodyne	CCR3	42	36
COC(=O)N1CCC(CNC[C@@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819307591	FF	On-Demand	Anodyne	DPP7	17	41
COC(=O)N1CCC(CNC[C@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819307592	FF	On-Demand	Anodyne	F2	29	42
COC(=O)N1CCC(CNC[C@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819307592	FF	On-Demand	Anodyne	GRIN2B	49	43
COC(=O)N1CCC(CNC[C@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819307592	FF	On-Demand	Anodyne	ADRB3	26	40
COC(=O)N1CCC(CNC[C@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819307592	FF	On-Demand	Anodyne	TRY2_BOVIN	71	42
COC(=O)N1CCC(CNC[C@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819307592	FF	On-Demand	Anodyne	NMT1	18	40
COC(=O)N1CCC(CNC[C@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819307592	FF	On-Demand	Anodyne	CCR3	42	36
COC(=O)N1CCC(CNC[C@H](O)Cc2ccc3ccccc3c2)CC1	ZINC000819307592	FF	On-Demand	Anodyne	DPP7	17	41
O=[N+]([O-])c1cccc([C@@H](O)CNCC2(c3ccccn3)CCC2)c1	ZINC000819307605	EF	On-Demand	Bother	NMBR	30	42
O=[N+]([O-])c1cccc([C@H](O)CNCC2(c3ccccn3)CCC2)c1	ZINC000819307606	EF	On-Demand	Bother	NMBR	30	42
O=[N+]([O-])c1ccc([C@@H](O)CNCC2(c3ccccn3)CCC2)cc1	ZINC000819307610	EF	On-Demand	Bother	NMBR	50	41
O=[N+]([O-])c1ccc([C@@H](O)CNCC2(c3ccccn3)CCC2)cc1	ZINC000819307610	EF	On-Demand	Bother	GRPR	28	41
O=[N+]([O-])c1ccc([C@H](O)CNCC2(c3ccccn3)CCC2)cc1	ZINC000819307611	EF	On-Demand	Bother	NMBR	50	41
O=[N+]([O-])c1ccc([C@H](O)CNCC2(c3ccccn3)CCC2)cc1	ZINC000819307611	EF	On-Demand	Bother	GRPR	28	41
COC(=O)N1CCC(CNC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819307626	FF	On-Demand	Anodyne	GRIN2B	20	42
COC(=O)N1CCC(CNC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819307626	FF	On-Demand	Anodyne	LIPG	23	40
COC(=O)N1CCC(CNC[C@H](O)Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819307627	FF	On-Demand	Anodyne	GRIN2B	20	42
COC(=O)N1CCC(CNC[C@H](O)Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819307627	FF	On-Demand	Anodyne	LIPG	23	40
CC[C@@H]1CCC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819307638	FH	On-Demand	Mild	PAPA1_CARPA	37	47
CC[C@@H]1CCC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819307639	FH	On-Demand	Mild	PAPA1_CARPA	37	47
CC[C@@H]1CCC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819307640	FH	On-Demand	Mild	PAPA1_CARPA	37	47
CC[C@@H]1CCC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819307641	FH	On-Demand	Mild	PAPA1_CARPA	37	47
COC(=O)N1CCC(CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819307649	EE	On-Demand	Anodyne	SLC6A3	32	42
COC(=O)N1CCC(CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819307649	EE	On-Demand	Anodyne	HTR4	19	41
COC(=O)N1CCC(CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819307649	EE	On-Demand	Anodyne	GRIN2B	20	41
COC(=O)N1CCC(CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819307649	EE	On-Demand	Anodyne	ADRB3	38	41
COC(=O)N1CCC(CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819307649	EE	On-Demand	Anodyne	CCR1	41	41
COC(=O)N1CCC(CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819307649	EE	On-Demand	Anodyne	AKT2	18	41
COC(=O)N1CCC(CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819307649	EE	On-Demand	Anodyne	AKT3	40	41
COC(=O)N1CCC(CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819307649	EE	On-Demand	Anodyne	CACNA1I	55	35
CS(=O)(=O)C1(CNC[C@H](O)c2ccccc2)CCCC1	ZINC000819307671	CD	On-Demand	Anodyne	ADRB3	56	39
CS(=O)(=O)C1(CNC[C@@H](O)c2ccccc2)CCCC1	ZINC000819307672	CD	On-Demand	Anodyne	ADRB3	56	39
O=C(Cc1nsc2ccccc12)Nc1ccc(Cl)cc1C(=O)NCC1CC1	ZINC000819307688	GI	On-Demand	Anodyne	F10	28	41
COC(=O)N1CCC(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000819307717	GF	On-Demand	Anodyne	ADRB2	29	41
COC(=O)N1CCC(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000819307717	GF	On-Demand	Anodyne	ADRB1	50	45
COC(=O)N1CCC(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000819307717	GF	On-Demand	Anodyne	ADRB3	36	42
COC(=O)N1CCC(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000819307717	GF	On-Demand	Anodyne	CACNA1B	42	35
COC(=O)N1CCC(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000819307717	GF	On-Demand	Anodyne	CCR2	83	38
COC(=O)N1CCC(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000819307717	GF	On-Demand	Anodyne	PDS	48	42
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000819307718	GF	On-Demand	Anodyne	ADRB2	29	41
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000819307718	GF	On-Demand	Anodyne	ADRB1	50	45
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000819307718	GF	On-Demand	Anodyne	ADRB3	36	42
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000819307718	GF	On-Demand	Anodyne	CACNA1B	42	35
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000819307718	GF	On-Demand	Anodyne	CCR2	83	38
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000819307718	GF	On-Demand	Anodyne	PDS	48	42
COC(=O)N1CCC(CNC[C@H](O)COCc2ccccc2OC)CC1	ZINC000819307721	FD	On-Demand	Anodyne	ADRB1	24	41
COC(=O)N1CCC(CNC[C@H](O)COCc2ccccc2OC)CC1	ZINC000819307721	FD	On-Demand	Anodyne	GRIN2B	29	41
COC(=O)N1CCC(CNC[C@H](O)COCc2ccccc2OC)CC1	ZINC000819307721	FD	On-Demand	Anodyne	ADRB3	15	41
COC(=O)N1CCC(CNC[C@H](O)COCc2ccccc2OC)CC1	ZINC000819307721	FD	On-Demand	Anodyne	MBTPS1	51	34
COC(=O)N1CCC(CNC[C@H](O)COc2cc(Cl)ccc2Cl)CC1	ZINC000819307727	GF	On-Demand	Anodyne	ADRB3	22	41
COC(=O)N1CCC(CNC[C@H](O)COc2cc(Cl)ccc2Cl)CC1	ZINC000819307727	GF	On-Demand	Anodyne	CCR1	42	37
COC(=O)N1CCC(CNC[C@H](O)COc2cc(Cl)ccc2Cl)CC1	ZINC000819307727	GF	On-Demand	Anodyne	CACNA1I	47	34
COC(=O)N1CCC(CNC[C@@H](O)COc2cc(Cl)ccc2Cl)CC1	ZINC000819307728	GF	On-Demand	Anodyne	ADRB3	22	41
COC(=O)N1CCC(CNC[C@@H](O)COc2cc(Cl)ccc2Cl)CC1	ZINC000819307728	GF	On-Demand	Anodyne	CCR1	42	37
COC(=O)N1CCC(CNC[C@@H](O)COc2cc(Cl)ccc2Cl)CC1	ZINC000819307728	GF	On-Demand	Anodyne	CACNA1I	47	34
COC(=O)N1CCC(CNC[C@@H](O)COc2c(C)ccc(C)c2C)CC1	ZINC000819307729	FE	On-Demand	Anodyne	ADRB3	20	40
COC(=O)N1CCC(CNC[C@H](O)COc2c(C)ccc(C)c2C)CC1	ZINC000819307730	FE	On-Demand	Anodyne	ADRB3	20	40
CS(=O)(=O)C1(CNC[C@@H](O)c2cccnc2)CCCC1	ZINC000819307737	CD	On-Demand	Anodyne	ADRB2	26	43
CS(=O)(=O)C1(CNC[C@@H](O)c2cccnc2)CCCC1	ZINC000819307737	CD	On-Demand	Anodyne	ADRB1	29	43
CS(=O)(=O)C1(CNC[C@@H](O)c2cccnc2)CCCC1	ZINC000819307737	CD	On-Demand	Anodyne	ADRB3	108	48
CS(=O)(=O)C1(CNC[C@H](O)c2cccnc2)CCCC1	ZINC000819307738	CD	On-Demand	Anodyne	ADRB2	26	43
CS(=O)(=O)C1(CNC[C@H](O)c2cccnc2)CCCC1	ZINC000819307738	CD	On-Demand	Anodyne	ADRB1	29	43
CS(=O)(=O)C1(CNC[C@H](O)c2cccnc2)CCCC1	ZINC000819307738	CD	On-Demand	Anodyne	ADRB3	108	48
COC(=O)N1CCC(CNC[C@H](O)COc2cccc(C(C)=O)c2)CC1	ZINC000819307755	FD	On-Demand	Anodyne	ADRB2	38	42
COC(=O)N1CCC(CNC[C@H](O)COc2cccc(C(C)=O)c2)CC1	ZINC000819307755	FD	On-Demand	Anodyne	ADRB1	69	41
COC(=O)N1CCC(CNC[C@H](O)COc2cccc(C(C)=O)c2)CC1	ZINC000819307755	FD	On-Demand	Anodyne	ADRB3	47	46
COC(=O)N1CCC(CNC[C@H](O)COc2cccc(C(C)=O)c2)CC1	ZINC000819307755	FD	On-Demand	Anodyne	ACOX1	44	33
COC(=O)N1CCC(CNC[C@H](O)COc2cccc(C(C)=O)c2)CC1	ZINC000819307755	FD	On-Demand	Anodyne	ABCB1	31	50
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc(C(C)=O)c2)CC1	ZINC000819307756	FD	On-Demand	Anodyne	ADRB2	38	42
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc(C(C)=O)c2)CC1	ZINC000819307756	FD	On-Demand	Anodyne	ADRB1	69	41
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc(C(C)=O)c2)CC1	ZINC000819307756	FD	On-Demand	Anodyne	ADRB3	47	46
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc(C(C)=O)c2)CC1	ZINC000819307756	FD	On-Demand	Anodyne	ACOX1	44	33
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc(C(C)=O)c2)CC1	ZINC000819307756	FD	On-Demand	Anodyne	ABCB1	31	50
COC(=O)N1CCC(CNC[C@H](O)COc2ccc3ccccc3c2)CC1	ZINC000819307757	FF	On-Demand	Anodyne	ADRB2	60	52
COC(=O)N1CCC(CNC[C@H](O)COc2ccc3ccccc3c2)CC1	ZINC000819307757	FF	On-Demand	Anodyne	ADRB1	85	46
COC(=O)N1CCC(CNC[C@H](O)COc2ccc3ccccc3c2)CC1	ZINC000819307757	FF	On-Demand	Anodyne	GRIN2B	28	42
COC(=O)N1CCC(CNC[C@H](O)COc2ccc3ccccc3c2)CC1	ZINC000819307757	FF	On-Demand	Anodyne	ADRB3	63	47
COC(=O)N1CCC(CNC[C@H](O)COc2ccc3ccccc3c2)CC1	ZINC000819307757	FF	On-Demand	Anodyne	ACOX1	54	39
COC(=O)N1CCC(CNC[C@H](O)COc2ccc3ccccc3c2)CC1	ZINC000819307757	FF	On-Demand	Anodyne	ABCB1	40	38
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc3ccccc3c2)CC1	ZINC000819307758	FF	On-Demand	Anodyne	ADRB2	60	52
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc3ccccc3c2)CC1	ZINC000819307758	FF	On-Demand	Anodyne	ADRB1	85	46
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc3ccccc3c2)CC1	ZINC000819307758	FF	On-Demand	Anodyne	GRIN2B	28	42
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc3ccccc3c2)CC1	ZINC000819307758	FF	On-Demand	Anodyne	ADRB3	63	47
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc3ccccc3c2)CC1	ZINC000819307758	FF	On-Demand	Anodyne	ACOX1	54	39
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc3ccccc3c2)CC1	ZINC000819307758	FF	On-Demand	Anodyne	ABCB1	40	38
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(Cl)cc1C(=O)NCC1CC1	ZINC000819307759	EG	On-Demand	Anodyne	CACNA1I	50	36
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(Cl)cc1C(=O)NCC1CC1	ZINC000819307760	EG	On-Demand	Anodyne	CACNA1I	50	36
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(Cl)cc1C(=O)NCC1CC1	ZINC000819307761	EG	On-Demand	Anodyne	CACNA1I	50	36
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(Cl)cc1C(=O)NCC1CC1	ZINC000819307762	EG	On-Demand	Anodyne	CACNA1I	50	36
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307763	GF	On-Demand	Anodyne	ADRB2	45	42
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307763	GF	On-Demand	Anodyne	ADRB1	69	45
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307763	GF	On-Demand	Anodyne	HRH1	35	41
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307763	GF	On-Demand	Anodyne	GRIN1	28	46
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307763	GF	On-Demand	Anodyne	GRIN2B	22	40
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307763	GF	On-Demand	Anodyne	ADRB3	52	45
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307763	GF	On-Demand	Anodyne	ACOX1	58	33
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307763	GF	On-Demand	Anodyne	CCR1	16	41
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307763	GF	On-Demand	Anodyne	CCR3	50	43
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307763	GF	On-Demand	Anodyne	CACNA1I	46	39
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307764	GF	On-Demand	Anodyne	ADRB2	45	42
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307764	GF	On-Demand	Anodyne	ADRB1	69	45
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307764	GF	On-Demand	Anodyne	HRH1	35	41
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307764	GF	On-Demand	Anodyne	GRIN1	28	46
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307764	GF	On-Demand	Anodyne	GRIN2B	22	40
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307764	GF	On-Demand	Anodyne	ADRB3	52	45
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307764	GF	On-Demand	Anodyne	ACOX1	58	33
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307764	GF	On-Demand	Anodyne	CCR1	16	41
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307764	GF	On-Demand	Anodyne	CCR3	50	43
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000819307764	GF	On-Demand	Anodyne	CACNA1I	46	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCN(Cc3ccccc3)C[C@H]1C)C2	ZINC000819307770	GF	On-Demand	Anodyne	ACHE	33	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCN(Cc3ccccc3)C[C@H]1C)C2	ZINC000819307770	GF	On-Demand	Anodyne	SIGMAR1	39	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCN(Cc3ccccc3)C[C@H]1C)C2	ZINC000819307771	GF	On-Demand	Anodyne	ACHE	33	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCN(Cc3ccccc3)C[C@H]1C)C2	ZINC000819307771	GF	On-Demand	Anodyne	SIGMAR1	39	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCN(Cc3ccccc3)C[C@@H]1C)C2	ZINC000819307772	GF	On-Demand	Anodyne	ACHE	33	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCN(Cc3ccccc3)C[C@@H]1C)C2	ZINC000819307772	GF	On-Demand	Anodyne	SIGMAR1	39	40
COC(=O)N1CCC(CNC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819307784	EE	On-Demand	Anodyne	ADRB2	18	43
COC(=O)N1CCC(CNC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819307784	EE	On-Demand	Anodyne	ADRB1	20	41
COC(=O)N1CCC(CNC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819307784	EE	On-Demand	Anodyne	ADRB3	28	43
COC(=O)N1CCC(CNC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819307784	EE	On-Demand	Anodyne	CACNA1I	44	31
COC(=O)N1CCC(CNC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819307785	EE	On-Demand	Anodyne	ADRB2	18	43
COC(=O)N1CCC(CNC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819307785	EE	On-Demand	Anodyne	ADRB1	20	41
COC(=O)N1CCC(CNC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819307785	EE	On-Demand	Anodyne	ADRB3	28	43
COC(=O)N1CCC(CNC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819307785	EE	On-Demand	Anodyne	CACNA1I	44	31
COC(=O)N1CCC(CNC[C@H](O)COCc2ccccc2Cl)CC1	ZINC000819307798	FE	On-Demand	Anodyne	ADRB1	16	40
COC(=O)N1CCC(CNC[C@H](O)COCc2ccccc2Cl)CC1	ZINC000819307798	FE	On-Demand	Anodyne	GRIN2B	23	40
CS(=O)(=O)C1(CNC[C@H](O)c2cccc(Cl)c2)CCCC1	ZINC000819307809	EE	On-Demand	Anodyne	ADRB2	41	38
CS(=O)(=O)C1(CNC[C@H](O)c2cccc(Cl)c2)CCCC1	ZINC000819307809	EE	On-Demand	Anodyne	ADRB1	50	43
CS(=O)(=O)C1(CNC[C@H](O)c2cccc(Cl)c2)CCCC1	ZINC000819307809	EE	On-Demand	Anodyne	ADRB3	80	48
CS(=O)(=O)C1(CNC[C@@H](O)c2cccc(Cl)c2)CCCC1	ZINC000819307810	EE	On-Demand	Anodyne	ADRB2	41	38
CS(=O)(=O)C1(CNC[C@@H](O)c2cccc(Cl)c2)CCCC1	ZINC000819307810	EE	On-Demand	Anodyne	ADRB1	50	43
CS(=O)(=O)C1(CNC[C@@H](O)c2cccc(Cl)c2)CCCC1	ZINC000819307810	EE	On-Demand	Anodyne	ADRB3	80	48
CS(=O)(=O)C1(CNC[C@H](O)c2ccc(Cl)c(F)c2)CCCC1	ZINC000819307824	EE	On-Demand	Anodyne	ADRB2	15	40
CS(=O)(=O)C1(CNC[C@@H](O)c2ccc(Cl)c(F)c2)CCCC1	ZINC000819307825	EE	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CNCC1(c2ccccn2)CCC1)c1ccc(Cl)cc1Cl	ZINC000819307838	FI	On-Demand	Anodyne	SLC6A9	31	44
O[C@H](CNCC1(c2ccccn2)CCC1)c1ccc(Cl)cc1Cl	ZINC000819307839	FI	On-Demand	Anodyne	SLC6A9	31	44
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(CSC2CCCC2)c1	ZINC000819307841	EJ	On-Demand	Anodyne	QRFPR	40	35
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(CSC2CCCC2)c1	ZINC000819307842	EJ	On-Demand	Anodyne	QRFPR	40	35
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(CSC2CCCC2)c1	ZINC000819307843	EJ	On-Demand	Anodyne	QRFPR	40	35
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(CSC2CCCC2)c1	ZINC000819307844	EJ	On-Demand	Anodyne	QRFPR	40	35
COC(=O)N1CCC(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819307845	FD	On-Demand	Anodyne	ADRB2	16	46
COC(=O)N1CCC(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819307845	FD	On-Demand	Anodyne	HTR4	15	40
COC(=O)N1CCC(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819307845	FD	On-Demand	Anodyne	ADRB3	28	46
COC(=O)N1CCC(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819307845	FD	On-Demand	Anodyne	MMP13	15	40
COC(=O)N1CCC(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819307845	FD	On-Demand	Anodyne	GPR119	73	46
COC(=O)N1CCC(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819307846	FD	On-Demand	Anodyne	ADRB2	16	46
COC(=O)N1CCC(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819307846	FD	On-Demand	Anodyne	HTR4	15	40
COC(=O)N1CCC(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819307846	FD	On-Demand	Anodyne	ADRB3	28	46
COC(=O)N1CCC(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819307846	FD	On-Demand	Anodyne	MMP13	15	40
COC(=O)N1CCC(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819307846	FD	On-Demand	Anodyne	GPR119	73	46
CS(=O)(=O)C1(CNC[C@H](O)c2cccc(F)c2)CCCC1	ZINC000819307849	DD	On-Demand	Anodyne	ADRB3	43	42
CS(=O)(=O)C1(CNC[C@@H](O)c2cccc(F)c2)CCCC1	ZINC000819307850	DD	On-Demand	Anodyne	ADRB3	43	42
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)CC1	ZINC000819307855	GF	On-Demand	Anodyne	ADRB2	45	43
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)CC1	ZINC000819307855	GF	On-Demand	Anodyne	ADRB1	71	46
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)CC1	ZINC000819307855	GF	On-Demand	Anodyne	GRIN2B	21	46
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)CC1	ZINC000819307855	GF	On-Demand	Anodyne	ADRB3	49	46
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)CC1	ZINC000819307855	GF	On-Demand	Anodyne	CACNA1I	36	40
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(C(C)(C)C)cc2)CC1	ZINC000819307856	GF	On-Demand	Anodyne	ADRB2	45	43
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(C(C)(C)C)cc2)CC1	ZINC000819307856	GF	On-Demand	Anodyne	ADRB1	71	46
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(C(C)(C)C)cc2)CC1	ZINC000819307856	GF	On-Demand	Anodyne	GRIN2B	21	46
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(C(C)(C)C)cc2)CC1	ZINC000819307856	GF	On-Demand	Anodyne	ADRB3	49	46
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(C(C)(C)C)cc2)CC1	ZINC000819307856	GF	On-Demand	Anodyne	CACNA1I	36	40
COC(=O)N1CCC(CNC[C@@H](O)Cc2ccccc2C(F)(F)F)CC1	ZINC000819307967	FF	On-Demand	Anodyne	RBP4	86	40
COC(=O)N1CCC(CNC[C@@H](O)Cc2ccccc2C(F)(F)F)CC1	ZINC000819307967	FF	On-Demand	Anodyne	SFRP1	90	40
COC(=O)N1CCC(CNC[C@@H](O)Cc2ccccc2C(F)(F)F)CC1	ZINC000819307967	FF	On-Demand	Anodyne	WNT3	64	34
COC(=O)N1CCC(CNC[C@H](O)Cc2ccccc2C(F)(F)F)CC1	ZINC000819307968	FF	On-Demand	Anodyne	RBP4	86	40
COC(=O)N1CCC(CNC[C@H](O)Cc2ccccc2C(F)(F)F)CC1	ZINC000819307968	FF	On-Demand	Anodyne	SFRP1	90	40
COC(=O)N1CCC(CNC[C@H](O)Cc2ccccc2C(F)(F)F)CC1	ZINC000819307968	FF	On-Demand	Anodyne	WNT3	64	34
COC(=O)N1CCC(CNC[C@H](O)c2cccc(Br)c2)CC1	ZINC000819307978	FF	On-Demand	Anodyne	GRIN2B	21	41
COC(=O)N1CCC(CNC[C@H](O)c2cccc(Br)c2)CC1	ZINC000819307978	FF	On-Demand	Anodyne	ADRB3	49	39
COC(=O)N1CCC(CNC[C@@H](O)c2cccc(Br)c2)CC1	ZINC000819307979	FF	On-Demand	Anodyne	GRIN2B	21	41
COC(=O)N1CCC(CNC[C@@H](O)c2cccc(Br)c2)CC1	ZINC000819307979	FF	On-Demand	Anodyne	ADRB3	49	39
O[C@@H](CNCC1(c2ccccn2)CCC1)c1cccnc1	ZINC000819307980	CE	On-Demand	Anodyne	ADRB2	20	41
O[C@@H](CNCC1(c2ccccn2)CCC1)c1cccnc1	ZINC000819307980	CE	On-Demand	Anodyne	ADRB1	22	41
O[C@@H](CNCC1(c2ccccn2)CCC1)c1cccnc1	ZINC000819307980	CE	On-Demand	Anodyne	ADRB3	88	43
O[C@H](CNCC1(c2ccccn2)CCC1)c1cccnc1	ZINC000819307981	CE	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNCC1(c2ccccn2)CCC1)c1cccnc1	ZINC000819307981	CE	On-Demand	Anodyne	ADRB1	22	41
O[C@H](CNCC1(c2ccccn2)CCC1)c1cccnc1	ZINC000819307981	CE	On-Demand	Anodyne	ADRB3	88	43
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819307984	FE	On-Demand	Anodyne	ADRB2	43	53
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819307984	FE	On-Demand	Anodyne	ADRB1	69	44
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819307984	FE	On-Demand	Anodyne	ADRB3	36	48
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819307984	FE	On-Demand	Anodyne	ABCB1	58	40
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2Cl)CC1	ZINC000819307984	FE	On-Demand	Anodyne	SCD	17	43
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819307985	FE	On-Demand	Anodyne	ADRB2	43	53
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819307985	FE	On-Demand	Anodyne	ADRB1	69	44
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819307985	FE	On-Demand	Anodyne	ADRB3	36	48
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819307985	FE	On-Demand	Anodyne	ABCB1	58	40
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2Cl)CC1	ZINC000819307985	FE	On-Demand	Anodyne	SCD	17	43
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2C(C)C)CC1	ZINC000819307987	FF	On-Demand	Anodyne	ADRB2	43	58
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2C(C)C)CC1	ZINC000819307987	FF	On-Demand	Anodyne	ADRB1	64	35
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2C(C)C)CC1	ZINC000819307987	FF	On-Demand	Anodyne	GRIN2B	25	41
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2C(C)C)CC1	ZINC000819307987	FF	On-Demand	Anodyne	ADRB3	32	50
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2C(C)C)CC1	ZINC000819307987	FF	On-Demand	Anodyne	ABCB1	56	42
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2C(C)C)CC1	ZINC000819307988	FF	On-Demand	Anodyne	ADRB2	43	58
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2C(C)C)CC1	ZINC000819307988	FF	On-Demand	Anodyne	ADRB1	64	35
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2C(C)C)CC1	ZINC000819307988	FF	On-Demand	Anodyne	GRIN2B	25	41
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2C(C)C)CC1	ZINC000819307988	FF	On-Demand	Anodyne	ADRB3	32	50
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2C(C)C)CC1	ZINC000819307988	FF	On-Demand	Anodyne	ABCB1	56	42
C=CCCn1cc(C(=O)Nc2ccc(Cl)cc2C(=O)NCC2CC2)nn1	ZINC000819307989	FF	On-Demand	Mild	CACNA1I	49	36
COC(=O)N1CCC(CNC[C@H](O)COCc2ccc(Cl)cc2)CC1	ZINC000819307992	FE	On-Demand	Anodyne	GRIN2B	22	42
COC(=O)N1CCC(CNC[C@H](O)COCc2ccc(Cl)cc2)CC1	ZINC000819307992	FE	On-Demand	Anodyne	CACNA1I	49	34
COC(=O)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819308010	CD	On-Demand	Anodyne	ADRB2	26	40
COC(=O)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819308010	CD	On-Demand	Anodyne	ADRB1	33	44
COC(=O)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819308010	CD	On-Demand	Anodyne	HTR4	18	43
COC(=O)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819308010	CD	On-Demand	Anodyne	GRIN2B	22	48
COC(=O)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819308010	CD	On-Demand	Anodyne	ADRB3	107	46
COC(=O)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819308010	CD	On-Demand	Anodyne	PTAFR	16	41
COC(=O)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819308010	CD	On-Demand	Anodyne	KCNA5	22	40
COC(=O)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819308010	CD	On-Demand	Anodyne	C3AR1	40	38
COC(=O)N1CCC(CNC[C@H](O)c2cccnc2)CC1	ZINC000819308010	CD	On-Demand	Anodyne	SCD	21	41
COC(=O)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819308011	CD	On-Demand	Anodyne	ADRB2	26	40
COC(=O)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819308011	CD	On-Demand	Anodyne	ADRB1	33	44
COC(=O)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819308011	CD	On-Demand	Anodyne	HTR4	18	43
COC(=O)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819308011	CD	On-Demand	Anodyne	GRIN2B	22	48
COC(=O)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819308011	CD	On-Demand	Anodyne	ADRB3	107	46
COC(=O)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819308011	CD	On-Demand	Anodyne	PTAFR	16	41
COC(=O)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819308011	CD	On-Demand	Anodyne	KCNA5	22	40
COC(=O)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819308011	CD	On-Demand	Anodyne	C3AR1	40	38
COC(=O)N1CCC(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819308011	CD	On-Demand	Anodyne	SCD	21	41
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000819308014	GF	On-Demand	Anodyne	ADRB2	35	42
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000819308014	GF	On-Demand	Anodyne	ADRB1	62	36
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000819308014	GF	On-Demand	Anodyne	ADRB3	29	49
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000819308014	GF	On-Demand	Anodyne	ABCB1	49	39
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000819308014	GF	On-Demand	Anodyne	RBP4	89	39
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000819308014	GF	On-Demand	Anodyne	SFRP1	80	39
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000819308014	GF	On-Demand	Anodyne	SCD	37	43
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000819308014	GF	On-Demand	Anodyne	WNT3	56	34
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000819308015	GF	On-Demand	Anodyne	ADRB2	35	42
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000819308015	GF	On-Demand	Anodyne	ADRB1	62	36
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000819308015	GF	On-Demand	Anodyne	ADRB3	29	49
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000819308015	GF	On-Demand	Anodyne	ABCB1	49	39
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000819308015	GF	On-Demand	Anodyne	RBP4	89	39
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000819308015	GF	On-Demand	Anodyne	SFRP1	80	39
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000819308015	GF	On-Demand	Anodyne	SCD	37	43
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000819308015	GF	On-Demand	Anodyne	WNT3	56	34
COC(=O)N1CCC(CNC[C@H](O)CN(C)Cc2ccccc2)CC1	ZINC000819308024	ED	On-Demand	Anodyne	GRIN2B	53	41
COC(=O)N1CCC(CNC[C@H](O)CN(C)Cc2ccccc2)CC1	ZINC000819308024	ED	On-Demand	Anodyne	SIGMAR1	18	43
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)CC1	ZINC000819308025	GD	On-Demand	Anodyne	ADRB2	50	55
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)CC1	ZINC000819308025	GD	On-Demand	Anodyne	ADRB1	89	55
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)CC1	ZINC000819308025	GD	On-Demand	Anodyne	ADRB3	62	54
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)CC1	ZINC000819308025	GD	On-Demand	Anodyne	ACOX1	40	34
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)CC1	ZINC000819308025	GD	On-Demand	Anodyne	EPHX2	21	41
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)CC1	ZINC000819308026	GD	On-Demand	Anodyne	ADRB2	50	55
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)CC1	ZINC000819308026	GD	On-Demand	Anodyne	ADRB1	89	55
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)CC1	ZINC000819308026	GD	On-Demand	Anodyne	ADRB3	62	54
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)CC1	ZINC000819308026	GD	On-Demand	Anodyne	ACOX1	40	34
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)CC1	ZINC000819308026	GD	On-Demand	Anodyne	EPHX2	21	41
COC(=O)N1CCC(CNC[C@H](O)COc2cc(C)ccc2C)CC1	ZINC000819308027	FE	On-Demand	Anodyne	ADRB2	27	45
COC(=O)N1CCC(CNC[C@H](O)COc2cc(C)ccc2C)CC1	ZINC000819308027	FE	On-Demand	Anodyne	ADRB1	44	38
COC(=O)N1CCC(CNC[C@H](O)COc2cc(C)ccc2C)CC1	ZINC000819308027	FE	On-Demand	Anodyne	ADRB3	23	42
COC(=O)N1CCC(CNC[C@H](O)COc2cc(C)ccc2C)CC1	ZINC000819308027	FE	On-Demand	Anodyne	ABCB1	32	40
COC(=O)N1CCC(CNC[C@@H](O)COc2cc(C)ccc2C)CC1	ZINC000819308028	FE	On-Demand	Anodyne	ADRB2	27	45
COC(=O)N1CCC(CNC[C@@H](O)COc2cc(C)ccc2C)CC1	ZINC000819308028	FE	On-Demand	Anodyne	ADRB1	44	38
COC(=O)N1CCC(CNC[C@@H](O)COc2cc(C)ccc2C)CC1	ZINC000819308028	FE	On-Demand	Anodyne	ADRB3	23	42
COC(=O)N1CCC(CNC[C@@H](O)COc2cc(C)ccc2C)CC1	ZINC000819308028	FE	On-Demand	Anodyne	ABCB1	32	40
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(C(C)=O)cc2)CC1	ZINC000819308033	FD	On-Demand	Anodyne	ADRB2	42	43
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(C(C)=O)cc2)CC1	ZINC000819308033	FD	On-Demand	Anodyne	ADRB1	73	46
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(C(C)=O)cc2)CC1	ZINC000819308033	FD	On-Demand	Anodyne	ADRB3	49	46
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(C(C)=O)cc2)CC1	ZINC000819308033	FD	On-Demand	Anodyne	ABCB1	20	52
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)CC1	ZINC000819308034	FD	On-Demand	Anodyne	ADRB2	42	43
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)CC1	ZINC000819308034	FD	On-Demand	Anodyne	ADRB1	73	46
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)CC1	ZINC000819308034	FD	On-Demand	Anodyne	ADRB3	49	46
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)CC1	ZINC000819308034	FD	On-Demand	Anodyne	ABCB1	20	52
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1cc(F)ccc1F	ZINC000819308035	GI	On-Demand	Mild	PAPA1_CARPA	41	48
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1cc(F)ccc1F	ZINC000819308036	GI	On-Demand	Mild	PAPA1_CARPA	41	48
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cc(F)ccc1F	ZINC000819308037	GI	On-Demand	Mild	PAPA1_CARPA	41	48
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cc(F)ccc1F	ZINC000819308038	GI	On-Demand	Mild	PAPA1_CARPA	41	48
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2(c3ccccn3)CCC2)CC1	ZINC000819308046	GG	On-Demand	Anodyne	GPR119	48	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2(c3ccccn3)CCC2)CC1	ZINC000819308047	GG	On-Demand	Anodyne	GPR119	48	48
CCOc1ccc(OC[C@@H](O)CNCC2CCN(C(=O)OC)CC2)cc1	ZINC000819308049	FD	On-Demand	Anodyne	ADRB2	53	46
CCOc1ccc(OC[C@@H](O)CNCC2CCN(C(=O)OC)CC2)cc1	ZINC000819308049	FD	On-Demand	Anodyne	ADRB1	81	47
CCOc1ccc(OC[C@@H](O)CNCC2CCN(C(=O)OC)CC2)cc1	ZINC000819308049	FD	On-Demand	Anodyne	GRIN2B	19	41
CCOc1ccc(OC[C@@H](O)CNCC2CCN(C(=O)OC)CC2)cc1	ZINC000819308049	FD	On-Demand	Anodyne	ADRB3	56	47
CCOc1ccc(OC[C@@H](O)CNCC2CCN(C(=O)OC)CC2)cc1	ZINC000819308049	FD	On-Demand	Anodyne	MMP13	16	45
CCOc1ccc(OC[C@H](O)CNCC2CCN(C(=O)OC)CC2)cc1	ZINC000819308050	FD	On-Demand	Anodyne	ADRB2	53	46
CCOc1ccc(OC[C@H](O)CNCC2CCN(C(=O)OC)CC2)cc1	ZINC000819308050	FD	On-Demand	Anodyne	ADRB1	81	47
CCOc1ccc(OC[C@H](O)CNCC2CCN(C(=O)OC)CC2)cc1	ZINC000819308050	FD	On-Demand	Anodyne	GRIN2B	19	41
CCOc1ccc(OC[C@H](O)CNCC2CCN(C(=O)OC)CC2)cc1	ZINC000819308050	FD	On-Demand	Anodyne	ADRB3	56	47
CCOc1ccc(OC[C@H](O)CNCC2CCN(C(=O)OC)CC2)cc1	ZINC000819308050	FD	On-Demand	Anodyne	MMP13	16	45
C[S@@](=O)CCN1CCN(C(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819308061	GE	On-Demand	Anodyne	CCKAR	28	40
CON(C)C(=O)CCNC[C@H](c1ccc(Cl)cc1)C(C)C	ZINC000819308099	DG	On-Demand	Anodyne	UTS2	44	35
CON(C)C(=O)CCNC[C@@H](c1ccc(Cl)cc1)C(C)C	ZINC000819308100	DG	On-Demand	Anodyne	UTS2	44	35
Cc1nn(C)cc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819308117	EE	On-Demand	Mild	PAPA1_CARPA	39	44
Cc1nn(C)cc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819308118	EE	On-Demand	Mild	PAPA1_CARPA	39	44
COC(=O)N1CCC(CNC[C@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000819308162	FD	On-Demand	Anodyne	ADRB2	25	41
COC(=O)N1CCC(CNC[C@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000819308162	FD	On-Demand	Anodyne	ADRB1	48	41
COC(=O)N1CCC(CNC[C@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000819308162	FD	On-Demand	Anodyne	ADRB3	33	41
COC(=O)N1CCC(CNC[C@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000819308162	FD	On-Demand	Anodyne	EDNRB	74	36
COC(=O)N1CCC(CNC[C@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000819308162	FD	On-Demand	Anodyne	EDNRA	68	37
COC(=O)N1CCC(CNC[C@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000819308162	FD	On-Demand	Anodyne	BMP1	40	38
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000819308163	FD	On-Demand	Anodyne	ADRB2	25	41
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000819308163	FD	On-Demand	Anodyne	ADRB1	48	41
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000819308163	FD	On-Demand	Anodyne	ADRB3	33	41
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000819308163	FD	On-Demand	Anodyne	EDNRB	74	36
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000819308163	FD	On-Demand	Anodyne	EDNRA	68	37
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc3c(c2)OCO3)CC1	ZINC000819308163	FD	On-Demand	Anodyne	BMP1	40	38
COC(=O)N1CCC(CNC[C@@H](O)Cn2c3ccccc3c3ccccc32)CC1	ZINC000819308165	GG	On-Demand	Anodyne	HTR4	44	35
COC(=O)N1CCC(CNC[C@@H](O)Cn2c3ccccc3c3ccccc32)CC1	ZINC000819308165	GG	On-Demand	Anodyne	CCR8	52	34
COC(=O)N1CCC(CNC[C@H](O)Cn2c3ccccc3c3ccccc32)CC1	ZINC000819308166	GG	On-Demand	Anodyne	HTR4	44	35
COC(=O)N1CCC(CNC[C@H](O)Cn2c3ccccc3c3ccccc32)CC1	ZINC000819308166	GG	On-Demand	Anodyne	CCR8	52	34
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819308180	EF	On-Demand	Anodyne	SLC6A1	56	34
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819308180	EF	On-Demand	Anodyne	SIGMAR1	36	43
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819308180	EF	On-Demand	Anodyne	CCR1	19	41
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819308181	EF	On-Demand	Anodyne	SLC6A1	56	34
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819308181	EF	On-Demand	Anodyne	SIGMAR1	36	43
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819308181	EF	On-Demand	Anodyne	CCR1	19	41
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819308182	EF	On-Demand	Anodyne	SLC6A1	56	34
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819308182	EF	On-Demand	Anodyne	SIGMAR1	36	43
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819308182	EF	On-Demand	Anodyne	CCR1	19	41
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819308183	EF	On-Demand	Anodyne	SLC6A1	56	34
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819308183	EF	On-Demand	Anodyne	SIGMAR1	36	43
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819308183	EF	On-Demand	Anodyne	CCR1	19	41
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819308190	FE	On-Demand	Anodyne	ADRB2	48	43
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819308190	FE	On-Demand	Anodyne	ADRB1	79	46
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819308190	FE	On-Demand	Anodyne	ADRB3	56	46
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819308190	FE	On-Demand	Anodyne	CCR1	47	38
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819308190	FE	On-Demand	Anodyne	EBP	18	41
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819308190	FE	On-Demand	Anodyne	CACNA1I	49	33
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819308191	FE	On-Demand	Anodyne	ADRB2	48	43
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819308191	FE	On-Demand	Anodyne	ADRB1	79	46
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819308191	FE	On-Demand	Anodyne	ADRB3	56	46
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819308191	FE	On-Demand	Anodyne	CCR1	47	38
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819308191	FE	On-Demand	Anodyne	EBP	18	41
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)cc2)CC1	ZINC000819308191	FE	On-Demand	Anodyne	CACNA1I	49	33
COC(=O)N1CCC(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000819308194	FD	On-Demand	Bother	ADRB2	26	43
COC(=O)N1CCC(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000819308194	FD	On-Demand	Bother	ADRB1	50	43
COC(=O)N1CCC(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000819308194	FD	On-Demand	Bother	CACNA1C	49	36
COC(=O)N1CCC(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000819308194	FD	On-Demand	Bother	ADRB3	35	43
COC(=O)N1CCC(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000819308194	FD	On-Demand	Bother	CACNA1D	74	36
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000819308195	FD	On-Demand	Bother	ADRB2	26	43
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000819308195	FD	On-Demand	Bother	ADRB1	50	43
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000819308195	FD	On-Demand	Bother	CACNA1C	49	36
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000819308195	FD	On-Demand	Bother	ADRB3	35	43
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1	ZINC000819308195	FD	On-Demand	Bother	CACNA1D	74	36
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCC2(c3ccccn3)CCC2)CC1	ZINC000819308196	GG	On-Demand	Anodyne	GPR119	27	43
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCC2(c3ccccn3)CCC2)CC1	ZINC000819308197	GG	On-Demand	Anodyne	GPR119	27	43
COC(=O)N1CCC(CNC[C@H](O)COc2c(OC)cccc2OC)CC1	ZINC000819308203	GD	On-Demand	Anodyne	ADRB2	37	43
COC(=O)N1CCC(CNC[C@H](O)COc2c(OC)cccc2OC)CC1	ZINC000819308203	GD	On-Demand	Anodyne	ADRB1	58	41
COC(=O)N1CCC(CNC[C@H](O)COc2c(OC)cccc2OC)CC1	ZINC000819308203	GD	On-Demand	Anodyne	ADRB3	31	48
COC(=O)N1CCC(CNC[C@@H](O)COc2c(OC)cccc2OC)CC1	ZINC000819308204	GD	On-Demand	Anodyne	ADRB2	37	43
COC(=O)N1CCC(CNC[C@@H](O)COc2c(OC)cccc2OC)CC1	ZINC000819308204	GD	On-Demand	Anodyne	ADRB1	58	41
COC(=O)N1CCC(CNC[C@@H](O)COc2c(OC)cccc2OC)CC1	ZINC000819308204	GD	On-Demand	Anodyne	ADRB3	31	48
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)cc2Cl)CC1	ZINC000819308215	GF	On-Demand	Anodyne	ADRB1	31	40
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)cc2Cl)CC1	ZINC000819308215	GF	On-Demand	Anodyne	ADRB3	22	41
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)cc2Cl)CC1	ZINC000819308215	GF	On-Demand	Anodyne	CCR1	50	36
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(Cl)cc2Cl)CC1	ZINC000819308215	GF	On-Demand	Anodyne	CACNA1I	47	34
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)cc2Cl)CC1	ZINC000819308216	GF	On-Demand	Anodyne	ADRB1	31	40
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)cc2Cl)CC1	ZINC000819308216	GF	On-Demand	Anodyne	ADRB3	22	41
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)cc2Cl)CC1	ZINC000819308216	GF	On-Demand	Anodyne	CCR1	50	36
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(Cl)cc2Cl)CC1	ZINC000819308216	GF	On-Demand	Anodyne	CACNA1I	47	34
COC(=O)N1CCC(CNC[C@H](O)CN2CCc3ccccc3C2)CC1	ZINC000819308227	FD	On-Demand	Anodyne	NOD2	42	37
COC(=O)N1CCC(CNC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)CC1	ZINC000819308241	GD	On-Demand	Anodyne	ADRB1	36	40
COC(=O)N1CCC(CNC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)CC1	ZINC000819308241	GD	On-Demand	Anodyne	GRIN2B	18	41
COC(=O)N1CCC(CNC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)CC1	ZINC000819308241	GD	On-Demand	Anodyne	ADRB3	22	40
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)CC1	ZINC000819308242	GD	On-Demand	Anodyne	ADRB1	36	40
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)CC1	ZINC000819308242	GD	On-Demand	Anodyne	GRIN2B	18	41
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)CC1	ZINC000819308242	GD	On-Demand	Anodyne	ADRB3	22	40
C/C=C\c1ccc(OC[C@H](O)CNCC2CCN(C(=O)OC)CC2)c(OC)c1	ZINC000819308245	GF	On-Demand	Anodyne	ADRB1	18	58
C/C=C\c1ccc(OC[C@H](O)CNCC2CCN(C(=O)OC)CC2)c(OC)c1	ZINC000819308245	GF	On-Demand	Anodyne	ACKR3	43	32
C/C=C/c1ccc(OC[C@H](O)CNCC2CCN(C(=O)OC)CC2)c(OC)c1	ZINC000819308246	GF	On-Demand	Anodyne	ADRB1	18	58
C/C=C/c1ccc(OC[C@H](O)CNCC2CCN(C(=O)OC)CC2)c(OC)c1	ZINC000819308246	GF	On-Demand	Anodyne	ACKR3	43	32
C/C=C/c1ccc(OC[C@@H](O)CNCC2CCN(C(=O)OC)CC2)c(OC)c1	ZINC000819308247	GF	On-Demand	Anodyne	ADRB1	18	58
C/C=C/c1ccc(OC[C@@H](O)CNCC2CCN(C(=O)OC)CC2)c(OC)c1	ZINC000819308247	GF	On-Demand	Anodyne	ACKR3	43	32
C/C=C\c1ccc(OC[C@@H](O)CNCC2CCN(C(=O)OC)CC2)c(OC)c1	ZINC000819308248	GF	On-Demand	Anodyne	ADRB1	18	58
C/C=C\c1ccc(OC[C@@H](O)CNCC2CCN(C(=O)OC)CC2)c(OC)c1	ZINC000819308248	GF	On-Demand	Anodyne	ACKR3	43	32
CN(C)c1ccc(NC(=O)CCNCC2(c3ccccn3)CCC2)cc1	ZINC000819308250	FG	On-Demand	Anodyne	NMBR	42	37
COC(=O)N1CCC(CNC[C@H](O)COc2cc(C)cc(C)c2)CC1	ZINC000819308326	FE	On-Demand	Anodyne	ADRB2	28	48
COC(=O)N1CCC(CNC[C@H](O)COc2cc(C)cc(C)c2)CC1	ZINC000819308326	FE	On-Demand	Anodyne	ADRB1	44	41
COC(=O)N1CCC(CNC[C@H](O)COc2cc(C)cc(C)c2)CC1	ZINC000819308326	FE	On-Demand	Anodyne	ADRB3	30	41
COC(=O)N1CCC(CNC[C@@H](O)COc2cc(C)cc(C)c2)CC1	ZINC000819308327	FE	On-Demand	Anodyne	ADRB2	28	48
COC(=O)N1CCC(CNC[C@@H](O)COc2cc(C)cc(C)c2)CC1	ZINC000819308327	FE	On-Demand	Anodyne	ADRB1	44	41
COC(=O)N1CCC(CNC[C@@H](O)COc2cc(C)cc(C)c2)CC1	ZINC000819308327	FE	On-Demand	Anodyne	ADRB3	30	41
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000819308335	FD	On-Demand	Bother	ADRB2	31	41
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000819308335	FD	On-Demand	Bother	ADRB1	58	35
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000819308335	FD	On-Demand	Bother	ADRB3	26	45
COC(=O)N1CCC(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000819308335	FD	On-Demand	Bother	ABCB1	41	38
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000819308336	FD	On-Demand	Bother	ADRB2	31	41
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000819308336	FD	On-Demand	Bother	ADRB1	58	35
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000819308336	FD	On-Demand	Bother	ADRB3	26	45
COC(=O)N1CCC(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1	ZINC000819308336	FD	On-Demand	Bother	ABCB1	41	38
COC(=O)N1CCC(CNC[C@H](O)COc2cc(C)ccc2Cl)CC1	ZINC000819308341	FE	On-Demand	Anodyne	ADRB2	20	41
COC(=O)N1CCC(CNC[C@H](O)COc2cc(C)ccc2Cl)CC1	ZINC000819308341	FE	On-Demand	Anodyne	ADRB3	17	41
COC(=O)N1CCC(CNC[C@@H](O)COc2cc(C)ccc2Cl)CC1	ZINC000819308342	FE	On-Demand	Anodyne	ADRB2	20	41
COC(=O)N1CCC(CNC[C@@H](O)COc2cc(C)ccc2Cl)CC1	ZINC000819308342	FE	On-Demand	Anodyne	ADRB3	17	41
COC(=O)N1CCC(CNC[C@@H](O)COc2c(Cl)cccc2Cl)CC1	ZINC000819308344	GF	On-Demand	Anodyne	ADRB1	42	42
COC(=O)N1CCC(CNC[C@@H](O)COc2c(Cl)cccc2Cl)CC1	ZINC000819308344	GF	On-Demand	Anodyne	ADRB3	26	44
COC(=O)N1CCC(CNC[C@H](O)COc2c(Cl)cccc2Cl)CC1	ZINC000819308345	GF	On-Demand	Anodyne	ADRB1	42	42
COC(=O)N1CCC(CNC[C@H](O)COc2c(Cl)cccc2Cl)CC1	ZINC000819308345	GF	On-Demand	Anodyne	ADRB3	26	44
COC(=O)N1CCC(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819308351	GF	On-Demand	Anodyne	ADRB3	24	40
COC(=O)N1CCC(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819308351	GF	On-Demand	Anodyne	CTSS	17	40
COC(=O)N1CCC(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819308351	GF	On-Demand	Anodyne	EPHX2	46	42
COC(=O)N1CCC(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819308352	GF	On-Demand	Anodyne	ADRB3	24	40
COC(=O)N1CCC(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819308352	GF	On-Demand	Anodyne	CTSS	17	40
COC(=O)N1CCC(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819308352	GF	On-Demand	Anodyne	EPHX2	46	42
COC(=O)N1CCC(CNC[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819308353	FD	On-Demand	Anodyne	ADRB2	32	58
COC(=O)N1CCC(CNC[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819308353	FD	On-Demand	Anodyne	ADRB1	45	58
COC(=O)N1CCC(CNC[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819308353	FD	On-Demand	Anodyne	HTR1A	19	58
COC(=O)N1CCC(CNC[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819308353	FD	On-Demand	Anodyne	SLC6A4	20	44
COC(=O)N1CCC(CNC[C@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819308353	FD	On-Demand	Anodyne	ADRB3	28	56
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819308354	FD	On-Demand	Anodyne	ADRB2	32	58
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819308354	FD	On-Demand	Anodyne	ADRB1	45	58
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819308354	FD	On-Demand	Anodyne	HTR1A	19	58
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819308354	FD	On-Demand	Anodyne	SLC6A4	20	44
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc3[nH]ccc23)CC1	ZINC000819308354	FD	On-Demand	Anodyne	ADRB3	28	56
COC(=O)N1CCC(CNC[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000819308365	FD	On-Demand	Anodyne	GRIN2B	18	41
COC(=O)N1CCC(CNC[C@H](O)c2cc(OC)ccc2OC)CC1	ZINC000819308365	FD	On-Demand	Anodyne	CCR3	16	40
COC(=O)N1CCC(CNC[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000819308366	FD	On-Demand	Anodyne	GRIN2B	18	41
COC(=O)N1CCC(CNC[C@@H](O)c2cc(OC)ccc2OC)CC1	ZINC000819308366	FD	On-Demand	Anodyne	CCR3	16	40
COC(=O)N1CCC(CNC[C@H](O)COCc2ccccc2F)CC1	ZINC000819308383	FD	On-Demand	Anodyne	ADRB1	15	41
COC(=O)N1CCC(CNC[C@H](O)COCc2ccccc2F)CC1	ZINC000819308383	FD	On-Demand	Anodyne	GRIN2B	25	51
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(C)cc2C)CC1	ZINC000819308390	FE	On-Demand	Anodyne	ADRB2	24	43
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(C)cc2C)CC1	ZINC000819308390	FE	On-Demand	Anodyne	ADRB3	19	42
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(C)cc2C)CC1	ZINC000819308390	FE	On-Demand	Anodyne	ABCB1	31	40
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(C)cc2C)CC1	ZINC000819308391	FE	On-Demand	Anodyne	ADRB2	24	43
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(C)cc2C)CC1	ZINC000819308391	FE	On-Demand	Anodyne	ADRB3	19	42
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(C)cc2C)CC1	ZINC000819308391	FE	On-Demand	Anodyne	ABCB1	31	40
O[C@@H](CNCC1(c2ccccn2)CCC1)c1cccc(Cl)c1	ZINC000819308398	DG	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNCC1(c2ccccn2)CCC1)c1cccc(Cl)c1	ZINC000819308398	DG	On-Demand	Anodyne	ADRB3	40	42
O[C@H](CNCC1(c2ccccn2)CCC1)c1cccc(Cl)c1	ZINC000819308399	DG	On-Demand	Anodyne	ADRB1	27	40
O[C@H](CNCC1(c2ccccn2)CCC1)c1cccc(Cl)c1	ZINC000819308399	DG	On-Demand	Anodyne	ADRB3	40	42
COC(=O)N1CCC(CNC[C@@H](O)CO[C@@H](C)c2ccc(Cl)cc2)CC1	ZINC000819308409	GF	On-Demand	Anodyne	GRIN2B	17	41
COC(=O)N1CCC(CNC[C@H](O)CO[C@H](C)c2ccc(Cl)cc2)CC1	ZINC000819308410	GF	On-Demand	Anodyne	GRIN2B	17	41
COC(=O)N1CCC(CNC[C@H](O)CO[C@@H](C)c2ccc(Cl)cc2)CC1	ZINC000819308411	GF	On-Demand	Anodyne	GRIN2B	17	41
COC(=O)N1CCC(CNC[C@@H](O)CO[C@H](C)c2ccc(Cl)cc2)CC1	ZINC000819308412	GF	On-Demand	Anodyne	GRIN2B	17	41
COC(=O)N1CCC(CNC[C@H](O)COc2c(C)cccc2C)CC1	ZINC000819308420	FE	On-Demand	Anodyne	ADRB2	27	42
COC(=O)N1CCC(CNC[C@H](O)COc2c(C)cccc2C)CC1	ZINC000819308420	FE	On-Demand	Anodyne	ADRB1	42	42
COC(=O)N1CCC(CNC[C@H](O)COc2c(C)cccc2C)CC1	ZINC000819308420	FE	On-Demand	Anodyne	GRIN2B	22	42
COC(=O)N1CCC(CNC[C@H](O)COc2c(C)cccc2C)CC1	ZINC000819308420	FE	On-Demand	Anodyne	ADRB3	26	45
COC(=O)N1CCC(CNC[C@H](O)COc2c(C)cccc2C)CC1	ZINC000819308420	FE	On-Demand	Anodyne	CCR8	61	37
COC(=O)N1CCC(CNC[C@@H](O)COc2c(C)cccc2C)CC1	ZINC000819308421	FE	On-Demand	Anodyne	ADRB2	27	42
COC(=O)N1CCC(CNC[C@@H](O)COc2c(C)cccc2C)CC1	ZINC000819308421	FE	On-Demand	Anodyne	ADRB1	42	42
COC(=O)N1CCC(CNC[C@@H](O)COc2c(C)cccc2C)CC1	ZINC000819308421	FE	On-Demand	Anodyne	GRIN2B	22	42
COC(=O)N1CCC(CNC[C@@H](O)COc2c(C)cccc2C)CC1	ZINC000819308421	FE	On-Demand	Anodyne	ADRB3	26	45
COC(=O)N1CCC(CNC[C@@H](O)COc2c(C)cccc2C)CC1	ZINC000819308421	FE	On-Demand	Anodyne	CCR8	61	37
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)CC1	ZINC000819308428	GG	On-Demand	Anodyne	ADRB2	67	45
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)CC1	ZINC000819308428	GG	On-Demand	Anodyne	ADRB1	101	51
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)CC1	ZINC000819308428	GG	On-Demand	Anodyne	P2RY12	50	34
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)CC1	ZINC000819308428	GG	On-Demand	Anodyne	GRIN2B	33	42
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)CC1	ZINC000819308428	GG	On-Demand	Anodyne	ADRB3	76	51
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)CC1	ZINC000819308428	GG	On-Demand	Anodyne	MMP13	26	42
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)CC1	ZINC000819308428	GG	On-Demand	Anodyne	ACOX1	43	39
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)CC1	ZINC000819308428	GG	On-Demand	Anodyne	ABCB1	40	44
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)CC1	ZINC000819308429	GG	On-Demand	Anodyne	ADRB2	67	45
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)CC1	ZINC000819308429	GG	On-Demand	Anodyne	ADRB1	101	51
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)CC1	ZINC000819308429	GG	On-Demand	Anodyne	P2RY12	50	34
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)CC1	ZINC000819308429	GG	On-Demand	Anodyne	GRIN2B	33	42
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)CC1	ZINC000819308429	GG	On-Demand	Anodyne	ADRB3	76	51
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)CC1	ZINC000819308429	GG	On-Demand	Anodyne	MMP13	26	42
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)CC1	ZINC000819308429	GG	On-Demand	Anodyne	ACOX1	43	39
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)CC1	ZINC000819308429	GG	On-Demand	Anodyne	ABCB1	40	44
CC(C)(C)OC(=O)CS(=O)(=O)CCNCC1(c2ccccn2)CCC1	ZINC000819308434	FD	On-Demand	Anodyne	SLC6A9	16	41
COC(=O)N1CCC(CNC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819308435	FF	On-Demand	Anodyne	GRIN2B	20	40
COC(=O)N1CCC(CNC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819308435	FF	On-Demand	Anodyne	RBP4	87	41
COC(=O)N1CCC(CNC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819308435	FF	On-Demand	Anodyne	SFRP1	101	41
COC(=O)N1CCC(CNC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819308435	FF	On-Demand	Anodyne	WNT3	70	35
COC(=O)N1CCC(CNC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819308436	FF	On-Demand	Anodyne	GRIN2B	20	40
COC(=O)N1CCC(CNC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819308436	FF	On-Demand	Anodyne	RBP4	87	41
COC(=O)N1CCC(CNC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819308436	FF	On-Demand	Anodyne	SFRP1	101	41
COC(=O)N1CCC(CNC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819308436	FF	On-Demand	Anodyne	WNT3	70	35
COC(=O)N1CCC(CNC[C@H](O)c2ccc(F)c(Br)c2)CC1	ZINC000819308462	GF	On-Demand	Anodyne	ADRB3	18	42
COC(=O)N1CCC(CNC[C@@H](O)c2ccc(F)c(Br)c2)CC1	ZINC000819308463	GF	On-Demand	Anodyne	ADRB3	18	42
O[C@H](CNCCn1cc(Br)cn1)c1cccc(Cl)c1	ZINC000819308464	EF	On-Demand	Anodyne	ADRB1	37	47
O[C@H](CNCCn1cc(Br)cn1)c1cccc(Cl)c1	ZINC000819308464	EF	On-Demand	Anodyne	ADRB3	60	47
O[C@@H](CNCCn1cc(Br)cn1)c1cccc(Cl)c1	ZINC000819308465	EF	On-Demand	Anodyne	ADRB1	37	47
O[C@@H](CNCCn1cc(Br)cn1)c1cccc(Cl)c1	ZINC000819308465	EF	On-Demand	Anodyne	ADRB3	60	47
N#Cc1ccc([C@@H](O)CNCC2(c3ccccn3)CCC2)cc1	ZINC000819308468	DF	On-Demand	Mild	NMBR	17	40
N#Cc1ccc([C@H](O)CNCC2(c3ccccn3)CCC2)cc1	ZINC000819308469	DF	On-Demand	Mild	NMBR	17	40
COC(=O)c1ccc(OC[C@@H](O)CNCC2CCN(C(=O)OC)CC2)cc1	ZINC000819308470	GD	On-Demand	Anodyne	ADRB2	51	45
COC(=O)c1ccc(OC[C@@H](O)CNCC2CCN(C(=O)OC)CC2)cc1	ZINC000819308470	GD	On-Demand	Anodyne	ADRB1	81	46
COC(=O)c1ccc(OC[C@@H](O)CNCC2CCN(C(=O)OC)CC2)cc1	ZINC000819308470	GD	On-Demand	Anodyne	ADRB3	58	46
COC(=O)c1ccc(OC[C@@H](O)CNCC2CCN(C(=O)OC)CC2)cc1	ZINC000819308470	GD	On-Demand	Anodyne	ABCB1	18	43
COC(=O)c1ccc(OC[C@H](O)CNCC2CCN(C(=O)OC)CC2)cc1	ZINC000819308471	GD	On-Demand	Anodyne	ADRB2	51	45
COC(=O)c1ccc(OC[C@H](O)CNCC2CCN(C(=O)OC)CC2)cc1	ZINC000819308471	GD	On-Demand	Anodyne	ADRB1	81	46
COC(=O)c1ccc(OC[C@H](O)CNCC2CCN(C(=O)OC)CC2)cc1	ZINC000819308471	GD	On-Demand	Anodyne	ADRB3	58	46
COC(=O)c1ccc(OC[C@H](O)CNCC2CCN(C(=O)OC)CC2)cc1	ZINC000819308471	GD	On-Demand	Anodyne	ABCB1	18	43
COC(=O)N1CCC(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819308494	FF	On-Demand	Anodyne	LIPG	20	40
COC(=O)N1CCC(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819308495	FF	On-Demand	Anodyne	LIPG	20	40
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc3ccccc23)CC1	ZINC000819308508	FF	On-Demand	Anodyne	ADRB2	48	59
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc3ccccc23)CC1	ZINC000819308508	FF	On-Demand	Anodyne	ADRB1	67	52
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc3ccccc23)CC1	ZINC000819308508	FF	On-Demand	Anodyne	HTR1A	18	52
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc3ccccc23)CC1	ZINC000819308508	FF	On-Demand	Anodyne	ADRB3	39	54
COC(=O)N1CCC(CNC[C@@H](O)COc2cccc3ccccc23)CC1	ZINC000819308508	FF	On-Demand	Anodyne	ABCB1	65	40
COC(=O)N1CCC(CNC[C@H](O)COc2cccc3ccccc23)CC1	ZINC000819308509	FF	On-Demand	Anodyne	ADRB2	48	59
COC(=O)N1CCC(CNC[C@H](O)COc2cccc3ccccc23)CC1	ZINC000819308509	FF	On-Demand	Anodyne	ADRB1	67	52
COC(=O)N1CCC(CNC[C@H](O)COc2cccc3ccccc23)CC1	ZINC000819308509	FF	On-Demand	Anodyne	HTR1A	18	52
COC(=O)N1CCC(CNC[C@H](O)COc2cccc3ccccc23)CC1	ZINC000819308509	FF	On-Demand	Anodyne	ADRB3	39	54
COC(=O)N1CCC(CNC[C@H](O)COc2cccc3ccccc23)CC1	ZINC000819308509	FF	On-Demand	Anodyne	ABCB1	65	40
CC(=O)Nc1cccc(CC(=O)Nc2ccc(Cl)cc2C(=O)NCC2CC2)c1	ZINC000819308519	GH	On-Demand	Anodyne	CACNA1I	60	39
CS(=O)(=O)C1(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)CCCC1	ZINC000819308520	GF	On-Demand	Anodyne	ADRB3	23	43
CS(=O)(=O)C1(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)CCCC1	ZINC000819308521	GF	On-Demand	Anodyne	ADRB3	23	43
COCCCONC[C@@H](O)COc1ccccc1C	ZINC000819308529	CD	On-Demand	Anodyne	ADRB2	30	58
COCCCONC[C@H](O)COc1ccccc1C	ZINC000819308530	CD	On-Demand	Anodyne	ADRB2	30	58
Cn1ncc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)n1	ZINC000819308533	ED	On-Demand	Anodyne	KIT	16	42
Cn1ncc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)n1	ZINC000819308533	ED	On-Demand	Anodyne	LCK	26	40
Cn1ncc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)n1	ZINC000819308533	ED	On-Demand	Anodyne	FLT1	20	48
Cn1ncc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)n1	ZINC000819308533	ED	On-Demand	Anodyne	KDR	22	47
Cn1ncc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)n1	ZINC000819308533	ED	On-Demand	Anodyne	BTK	20	40
Cn1ncc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)n1	ZINC000819308533	ED	On-Demand	Anodyne	BRAF	38	41
Cn1ncc(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)n1	ZINC000819308533	ED	On-Demand	Anodyne	RIPK1	40	38
Cn1ncc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])n1	ZINC000819308536	DC	On-Demand	Bother	ADRB1	50	36
Cn1ncc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])n1	ZINC000819308537	DC	On-Demand	Bother	ADRB1	50	36
CCN1CC[C@H](N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H](C)C1	ZINC000819308559	GF	On-Demand	Mild	PAPA1_CARPA	30	41
CCN1CC[C@H](N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H](C)C1	ZINC000819308560	GF	On-Demand	Mild	PAPA1_CARPA	30	41
CCN1CC[C@H](N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H](C)C1	ZINC000819308561	GF	On-Demand	Mild	PAPA1_CARPA	30	41
CCN1CC[C@H](N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H](C)C1	ZINC000819308562	GF	On-Demand	Mild	PAPA1_CARPA	30	41
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](Cc2ccccc2)C1	ZINC000819308574	CF	On-Demand	Anodyne	GRIN2B	65	51
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](Cc2ccccc2)C1	ZINC000819308575	CF	On-Demand	Anodyne	GRIN2B	65	51
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](Cc2ccccc2)C1	ZINC000819308576	CF	On-Demand	Anodyne	GRIN2B	65	51
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](Cc2ccccc2)C1	ZINC000819308577	CF	On-Demand	Anodyne	GRIN2B	65	51
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819308580	GG	On-Demand	Anodyne	ETHR	50	37
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819308581	GF	On-Demand	Anodyne	ETHR	46	38
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819308582	GF	On-Demand	Anodyne	ETHR	46	38
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819308587	GF	On-Demand	Bother	ETHR	42	35
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819308588	GF	On-Demand	Bother	ETHR	42	35
COC(=O)N1CCC(CNC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819308661	FF	On-Demand	Anodyne	ADRB3	42	39
COC(=O)N1CCC(CNC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819308661	FF	On-Demand	Anodyne	TACR1	45	35
COC(=O)N1CCC(CNC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819308661	FF	On-Demand	Anodyne	CACNA1B	51	36
COC(=O)N1CCC(CNC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819308661	FF	On-Demand	Anodyne	CCR2	105	40
COC(=O)N1CCC(CNC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819308661	FF	On-Demand	Anodyne	EPHX2	15	43
COC(=O)N1CCC(CNC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819308661	FF	On-Demand	Anodyne	CACNA1I	29	40
COC(=O)N1CCC(CNC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819308661	FF	On-Demand	Anodyne	LIPG	27	40
COC(=O)N1CCC(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819308662	FF	On-Demand	Anodyne	ADRB3	42	39
COC(=O)N1CCC(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819308662	FF	On-Demand	Anodyne	TACR1	45	35
COC(=O)N1CCC(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819308662	FF	On-Demand	Anodyne	CACNA1B	51	36
COC(=O)N1CCC(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819308662	FF	On-Demand	Anodyne	CCR2	105	40
COC(=O)N1CCC(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819308662	FF	On-Demand	Anodyne	EPHX2	15	43
COC(=O)N1CCC(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819308662	FF	On-Demand	Anodyne	CACNA1I	29	40
COC(=O)N1CCC(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819308662	FF	On-Demand	Anodyne	LIPG	27	40
O=C(Nc1ccc(Cl)cc1C(=O)NCC1CC1)c1cc2c(cn1)OCCO2	ZINC000819308679	GF	On-Demand	Anodyne	F10	44	41
O=C(Nc1ccc(Cl)cc1C(=O)NCC1CC1)c1cc2c(cn1)OCCO2	ZINC000819308679	GF	On-Demand	Anodyne	CACNA1I	49	35
COC(=O)N1CCC(CNC[C@H](O)COCc2ccc(OC)cc2)CC1	ZINC000819308696	FD	On-Demand	Anodyne	ADRB2	21	40
COC(=O)N1CCC(CNC[C@H](O)COCc2ccc(OC)cc2)CC1	ZINC000819308696	FD	On-Demand	Anodyne	ADRB1	43	42
COC(=O)N1CCC(CNC[C@H](O)COCc2ccc(OC)cc2)CC1	ZINC000819308696	FD	On-Demand	Anodyne	GRIN2B	27	52
COC(=O)N1CCC(CNC[C@H](O)COCc2ccc(OC)cc2)CC1	ZINC000819308696	FD	On-Demand	Anodyne	ADRB3	31	42
COC(=O)N1CCC(CNC[C@H](O)COCc2ccc(OC)cc2)CC1	ZINC000819308696	FD	On-Demand	Anodyne	MMP13	27	40
COC(=O)N1CCC(CNC[C@H](O)COCc2ccc(OC)cc2)CC1	ZINC000819308696	FD	On-Demand	Anodyne	MMP3	26	40
COC(=O)N1CCC(CNC[C@H](O)COCc2ccc(OC)cc2)CC1	ZINC000819308696	FD	On-Demand	Anodyne	MMP8	16	40
COC(=O)N1CCC(CNC[C@H](O)COCc2ccc(OC)cc2)CC1	ZINC000819308696	FD	On-Demand	Anodyne	MMP9	22	40
COC(=O)N1CCC(CNC[C@H](O)COCc2ccc(OC)cc2)CC1	ZINC000819308696	FD	On-Demand	Anodyne	MMP7	23	40
COC(=O)N1CCC(CNC[C@H](O)COCc2ccc(OC)cc2)CC1	ZINC000819308696	FD	On-Demand	Anodyne	MMP1	27	40
COC(=O)N1CCC(CNC[C@H](O)c2ccccc2Br)CC1	ZINC000819308698	FF	On-Demand	Anodyne	HTR4	30	40
COC(=O)N1CCC(CNC[C@H](O)c2ccccc2Br)CC1	ZINC000819308698	FF	On-Demand	Anodyne	GRIN2B	24	40
COC(=O)N1CCC(CNC[C@@H](O)c2ccccc2Br)CC1	ZINC000819308699	FF	On-Demand	Anodyne	HTR4	30	40
COC(=O)N1CCC(CNC[C@@H](O)c2ccccc2Br)CC1	ZINC000819308699	FF	On-Demand	Anodyne	GRIN2B	24	40
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(SC)cc2)CC1	ZINC000819308708	FE	On-Demand	Anodyne	ADRB2	40	42
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(SC)cc2)CC1	ZINC000819308708	FE	On-Demand	Anodyne	ADRB1	67	45
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(SC)cc2)CC1	ZINC000819308708	FE	On-Demand	Anodyne	ADRB3	48	45
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(SC)cc2)CC1	ZINC000819308708	FE	On-Demand	Anodyne	GPR119	19	40
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(SC)cc2)CC1	ZINC000819308709	FE	On-Demand	Anodyne	ADRB2	40	42
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(SC)cc2)CC1	ZINC000819308709	FE	On-Demand	Anodyne	ADRB1	67	45
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(SC)cc2)CC1	ZINC000819308709	FE	On-Demand	Anodyne	ADRB3	48	45
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(SC)cc2)CC1	ZINC000819308709	FE	On-Demand	Anodyne	GPR119	19	40
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(C(C)(C)C)cc2C)CC1	ZINC000819308710	GG	On-Demand	Anodyne	ADRB2	19	41
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(C(C)(C)C)cc2C)CC1	ZINC000819308710	GG	On-Demand	Anodyne	VDR	21	41
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(C(C)(C)C)cc2C)CC1	ZINC000819308710	GG	On-Demand	Anodyne	GRIN2B	18	41
COC(=O)N1CCC(CNC[C@H](O)COc2ccc(C(C)(C)C)cc2C)CC1	ZINC000819308710	GG	On-Demand	Anodyne	ADRB3	16	43
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(C(C)(C)C)cc2C)CC1	ZINC000819308713	GG	On-Demand	Anodyne	ADRB2	19	41
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(C(C)(C)C)cc2C)CC1	ZINC000819308713	GG	On-Demand	Anodyne	VDR	21	41
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(C(C)(C)C)cc2C)CC1	ZINC000819308713	GG	On-Demand	Anodyne	GRIN2B	18	41
COC(=O)N1CCC(CNC[C@@H](O)COc2ccc(C(C)(C)C)cc2C)CC1	ZINC000819308713	GG	On-Demand	Anodyne	ADRB3	16	43
O[C@@H](CNCC1(c2ccccn2)CCC1)c1ccccc1Cl	ZINC000819308714	DG	On-Demand	Anodyne	OPRL1	23	53
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819308719	GG	On-Demand	Anodyne	ADRB1	32	47
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819308719	GG	On-Demand	Anodyne	ADRB3	50	47
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819308719	GG	On-Demand	Anodyne	CYP3A4	47	35
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819308719	GG	On-Demand	Anodyne	ETHR	49	36
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819308722	GG	On-Demand	Anodyne	ADRB1	32	47
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819308722	GG	On-Demand	Anodyne	ADRB3	50	47
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819308722	GG	On-Demand	Anodyne	CYP3A4	47	35
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819308722	GG	On-Demand	Anodyne	ETHR	49	36
COC(=O)N1CCC(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819308724	GE	On-Demand	Anodyne	GPR119	37	44
Cn1ncc(CNC[C@H](O)COc2ccc(C(C)(C)c3ccccc3)cc2)n1	ZINC000819308741	GF	On-Demand	Anodyne	ADRB2	42	44
Cn1ncc(CNC[C@H](O)COc2ccc(C(C)(C)c3ccccc3)cc2)n1	ZINC000819308741	GF	On-Demand	Anodyne	ADRB1	53	42
Cn1ncc(CNC[C@@H](O)COc2ccc(C(C)(C)c3ccccc3)cc2)n1	ZINC000819308742	GF	On-Demand	Anodyne	ADRB2	42	44
Cn1ncc(CNC[C@@H](O)COc2ccc(C(C)(C)c3ccccc3)cc2)n1	ZINC000819308742	GF	On-Demand	Anodyne	ADRB1	53	42
Cn1ncc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)n1	ZINC000819308778	DC	On-Demand	Bother	ADRB2	19	45
Cn1ncc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)n1	ZINC000819308778	DC	On-Demand	Bother	ADRB1	23	45
Cn1ncc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)n1	ZINC000819308778	DC	On-Demand	Bother	ADRB3	18	45
Cn1ncc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)n1	ZINC000819308779	DC	On-Demand	Bother	ADRB2	19	45
Cn1ncc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)n1	ZINC000819308779	DC	On-Demand	Bother	ADRB1	23	45
Cn1ncc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)n1	ZINC000819308779	DC	On-Demand	Bother	ADRB3	18	45
COCCCONCCC(=O)Nc1cccc(Br)c1	ZINC000819308780	EE	On-Demand	Anodyne	EGFR	24	41
COCCCONCCC(=O)Nc1cccc(Br)c1	ZINC000819308780	EE	On-Demand	Anodyne	HDAC2	19	44
COCCCONCCC(=O)Nc1cccc(Br)c1	ZINC000819308780	EE	On-Demand	Anodyne	KCNK3	40	34
COCCCONC[C@H](O)COc1cc(C)ccc1C	ZINC000819308787	CD	On-Demand	Anodyne	ADRB2	21	48
COCCCONC[C@@H](O)COc1cc(C)ccc1C	ZINC000819308788	CD	On-Demand	Anodyne	ADRB2	21	48
Cn1ncc(CNC[C@H](O)COc2ccc3ccccc3c2)n1	ZINC000819308798	DD	On-Demand	Anodyne	ADRB2	43	55
Cn1ncc(CNC[C@H](O)COc2ccc3ccccc3c2)n1	ZINC000819308798	DD	On-Demand	Anodyne	ADRB1	47	40
Cn1ncc(CNC[C@H](O)COc2ccc3ccccc3c2)n1	ZINC000819308798	DD	On-Demand	Anodyne	ACOX1	40	35
Cn1ncc(CNC[C@@H](O)COc2ccc3ccccc3c2)n1	ZINC000819308799	DD	On-Demand	Anodyne	ADRB2	43	55
Cn1ncc(CNC[C@@H](O)COc2ccc3ccccc3c2)n1	ZINC000819308799	DD	On-Demand	Anodyne	ADRB1	47	40
Cn1ncc(CNC[C@@H](O)COc2ccc3ccccc3c2)n1	ZINC000819308799	DD	On-Demand	Anodyne	ACOX1	40	35
O[C@@H](CNCC1(c2ccccn2)CCC1)c1ccc(C(F)(F)F)cc1	ZINC000819308805	FH	On-Demand	Anodyne	NMBR	29	40
O[C@@H](CNCC1(c2ccccn2)CCC1)c1ccc(C(F)(F)F)cc1	ZINC000819308805	FH	On-Demand	Anodyne	GRPR	15	40
O[C@H](CNCC1(c2ccccn2)CCC1)c1ccc(C(F)(F)F)cc1	ZINC000819308806	FH	On-Demand	Anodyne	NMBR	29	40
O[C@H](CNCC1(c2ccccn2)CCC1)c1ccc(C(F)(F)F)cc1	ZINC000819308806	FH	On-Demand	Anodyne	GRPR	15	40
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819308813	FF	On-Demand	Anodyne	ETHR	50	37
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819308815	FF	On-Demand	Anodyne	ETHR	50	37
CC(=O)c1cccc(OC[C@@H](O)CNCc2cnn(C)n2)c1	ZINC000819308817	DC	On-Demand	Anodyne	ADRB2	29	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2cnn(C)n2)c1	ZINC000819308817	DC	On-Demand	Anodyne	ADRB1	49	38
CC(=O)c1cccc(OC[C@@H](O)CNCc2cnn(C)n2)c1	ZINC000819308817	DC	On-Demand	Anodyne	ABCB1	17	46
CC(=O)c1cccc(OC[C@H](O)CNCc2cnn(C)n2)c1	ZINC000819308819	DC	On-Demand	Anodyne	ADRB2	29	43
CC(=O)c1cccc(OC[C@H](O)CNCc2cnn(C)n2)c1	ZINC000819308819	DC	On-Demand	Anodyne	ADRB1	49	38
CC(=O)c1cccc(OC[C@H](O)CNCc2cnn(C)n2)c1	ZINC000819308819	DC	On-Demand	Anodyne	ABCB1	17	46
O=C(/C=C\[C@H]1CCCO1)N1CCN(c2ncnc3ccsc23)CC1	ZINC000819308825	EE	On-Demand	Anodyne	SIRT3	81	34
O=C(/C=C\[C@H]1CCCO1)N1CCN(c2ncnc3ccsc23)CC1	ZINC000819308825	EE	On-Demand	Anodyne	SIRT2	68	34
O=C(/C=C\[C@H]1CCCO1)N1CCN(c2ncnc3ccsc23)CC1	ZINC000819308825	EE	On-Demand	Anodyne	SIRT1	59	34
O=C(/C=C/[C@H]1CCCO1)N1CCN(c2ncnc3ccsc23)CC1	ZINC000819308826	EE	On-Demand	Anodyne	SIRT3	81	34
O=C(/C=C/[C@H]1CCCO1)N1CCN(c2ncnc3ccsc23)CC1	ZINC000819308826	EE	On-Demand	Anodyne	SIRT2	68	34
O=C(/C=C/[C@H]1CCCO1)N1CCN(c2ncnc3ccsc23)CC1	ZINC000819308826	EE	On-Demand	Anodyne	SIRT1	59	34
O=C(/C=C/[C@@H]1CCCO1)N1CCN(c2ncnc3ccsc23)CC1	ZINC000819308828	EE	On-Demand	Anodyne	SIRT3	81	34
O=C(/C=C/[C@@H]1CCCO1)N1CCN(c2ncnc3ccsc23)CC1	ZINC000819308828	EE	On-Demand	Anodyne	SIRT2	68	34
O=C(/C=C/[C@@H]1CCCO1)N1CCN(c2ncnc3ccsc23)CC1	ZINC000819308828	EE	On-Demand	Anodyne	SIRT1	59	34
O=C(/C=C\[C@@H]1CCCO1)N1CCN(c2ncnc3ccsc23)CC1	ZINC000819308829	EE	On-Demand	Anodyne	SIRT3	81	34
O=C(/C=C\[C@@H]1CCCO1)N1CCN(c2ncnc3ccsc23)CC1	ZINC000819308829	EE	On-Demand	Anodyne	SIRT2	68	34
O=C(/C=C\[C@@H]1CCCO1)N1CCN(c2ncnc3ccsc23)CC1	ZINC000819308829	EE	On-Demand	Anodyne	SIRT1	59	34
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819308831	GG	On-Demand	Anodyne	ETHR	41	34
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819308833	GG	On-Demand	Anodyne	ETHR	41	34
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819308834	GG	On-Demand	Anodyne	ETHR	57	38
Cn1ncc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819308837	GD	On-Demand	Anodyne	CTSD	79	43
Cn1ncc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819308837	GD	On-Demand	Anodyne	PGC	58	38
Cn1ncc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819308837	GD	On-Demand	Anodyne	PAPA1_CARPA	32	44
Cn1ncc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819308837	GD	On-Demand	Anodyne	BACE2	49	41
Cn1ncc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819308837	GD	On-Demand	Anodyne	TACR3	15	40
Cn1ncc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819308837	GD	On-Demand	Anodyne	REN	85	47
Cn1ncc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819308837	GD	On-Demand	Anodyne	REN1	29	45
Cn1ncc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819308837	GD	On-Demand	Anodyne	BACE1	81	46
Cn1ncc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)n1	ZINC000819308837	GD	On-Demand	Anodyne	FPR1	48	39
N#CCNC(=O)CNC[C@H](O)c1ccccc1Cl	ZINC000819308887	CC	On-Demand	Mild	CTSL	20	40
N#CCNC(=O)CNC[C@H](O)c1ccccc1Cl	ZINC000819308887	CC	On-Demand	Mild	CTSS	15	40
C[S@@](=O)CCN1CCN(C(=O)Cc2nsc3ccccc23)CC1	ZINC000819308909	FD	On-Demand	Anodyne	HTR1A	22	42
C[S@@](=O)CCN1CCN(C(=O)Cc2nsc3ccccc23)CC1	ZINC000819308909	FD	On-Demand	Anodyne	DRD2	26	42
C[S@@](=O)CCN1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819308917	FC	On-Demand	Anodyne	HTR1D	58	43
C[S@@](=O)CCN1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819308917	FC	On-Demand	Anodyne	HTR1B	48	43
C[S@@](=O)CCN1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819308917	FC	On-Demand	Anodyne	KCNJ1	85	52
COCCCONC[C@@H](O)COc1ccccc1F	ZINC000819308939	CD	On-Demand	Anodyne	ADRB2	25	45
COCCCONC[C@@H](O)COc1ccccc1F	ZINC000819308939	CD	On-Demand	Anodyne	ADRB1	50	36
COCCCONC[C@H](O)COc1ccccc1F	ZINC000819308940	CD	On-Demand	Anodyne	ADRB2	25	45
COCCCONC[C@H](O)COc1ccccc1F	ZINC000819308940	CD	On-Demand	Anodyne	ADRB1	50	36
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819308951	FE	On-Demand	Anodyne	ETHR	54	36
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819308952	FE	On-Demand	Anodyne	ETHR	54	36
COCCCONC[C@@H](O)COc1cccc(C)c1	ZINC000819308966	CD	On-Demand	Anodyne	ADRB2	29	60
COCCCONC[C@@H](O)COc1cccc(C)c1	ZINC000819308966	CD	On-Demand	Anodyne	ADRB1	26	60
COCCCONC[C@H](O)COc1cccc(C)c1	ZINC000819308967	CD	On-Demand	Anodyne	ADRB2	29	60
COCCCONC[C@H](O)COc1cccc(C)c1	ZINC000819308967	CD	On-Demand	Anodyne	ADRB1	26	60
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819308969	EC	On-Demand	Anodyne	ADRB2	43	46
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819308969	EC	On-Demand	Anodyne	ADRB1	73	47
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819308969	EC	On-Demand	Anodyne	GRIN1	20	40
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819308969	EC	On-Demand	Anodyne	ADRB3	52	46
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819308969	EC	On-Demand	Anodyne	ABCB1	20	43
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819308970	EC	On-Demand	Anodyne	ADRB2	43	46
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819308970	EC	On-Demand	Anodyne	ADRB1	73	47
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819308970	EC	On-Demand	Anodyne	GRIN1	20	40
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819308970	EC	On-Demand	Anodyne	ADRB3	52	46
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819308970	EC	On-Demand	Anodyne	ABCB1	20	43
COC(=O)c1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819308975	DC	On-Demand	Anodyne	ADRB2	44	45
COC(=O)c1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819308975	DC	On-Demand	Anodyne	ADRB1	71	45
COC(=O)c1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819308975	DC	On-Demand	Anodyne	ADRB3	45	45
COC(=O)c1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819308976	DC	On-Demand	Anodyne	ADRB2	44	45
COC(=O)c1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819308976	DC	On-Demand	Anodyne	ADRB1	71	45
COC(=O)c1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819308976	DC	On-Demand	Anodyne	ADRB3	45	45
COCCCONC[C@H](O)COc1cccc2ccccc12	ZINC000819308989	DE	On-Demand	Anodyne	ADRB2	32	60
COCCCONC[C@H](O)COc1cccc2ccccc12	ZINC000819308989	DE	On-Demand	Anodyne	ADRB1	36	60
COCCCONC[C@H](O)COc1cccc2ccccc12	ZINC000819308989	DE	On-Demand	Anodyne	CYP2D6	20	46
COCCCONC[C@@H](O)COc1cccc2ccccc12	ZINC000819308990	DE	On-Demand	Anodyne	ADRB2	32	60
COCCCONC[C@@H](O)COc1cccc2ccccc12	ZINC000819308990	DE	On-Demand	Anodyne	ADRB1	36	60
COCCCONC[C@@H](O)COc1cccc2ccccc12	ZINC000819308990	DE	On-Demand	Anodyne	CYP2D6	20	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](Cc3ccccc3)C1)C2	ZINC000819308992	FF	On-Demand	Anodyne	GRIN2B	59	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](Cc3ccccc3)C1)C2	ZINC000819308993	FF	On-Demand	Anodyne	GRIN2B	59	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](Cc3ccccc3)C1)C2	ZINC000819308994	FF	On-Demand	Anodyne	GRIN2B	59	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](Cc3ccccc3)C1)C2	ZINC000819308995	FF	On-Demand	Anodyne	GRIN2B	59	36
CC(C)c1ccc(O[C@@H](C)CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819309008	GG	On-Demand	Anodyne	ADRB3	21	40
CC(C)c1ccc(O[C@H](C)CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819309009	GG	On-Demand	Anodyne	ADRB3	21	40
CC(C)c1ccc(O[C@H](C)CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819309010	GG	On-Demand	Anodyne	ADRB3	21	40
CC(C)c1ccc(O[C@@H](C)CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819309011	GG	On-Demand	Anodyne	ADRB3	21	40
COCCCONC[C@@H](O)COc1ccc(F)cc1	ZINC000819309012	CD	On-Demand	Anodyne	ADRB2	36	48
COCCCONC[C@@H](O)COc1ccc(F)cc1	ZINC000819309012	CD	On-Demand	Anodyne	ADRB1	43	48
COCCCONC[C@@H](O)COc1ccc(F)cc1	ZINC000819309012	CD	On-Demand	Anodyne	GRIN1	19	45
COCCCONC[C@H](O)COc1ccc(F)cc1	ZINC000819309013	CD	On-Demand	Anodyne	ADRB2	36	48
COCCCONC[C@H](O)COc1ccc(F)cc1	ZINC000819309013	CD	On-Demand	Anodyne	ADRB1	43	48
COCCCONC[C@H](O)COc1ccc(F)cc1	ZINC000819309013	CD	On-Demand	Anodyne	GRIN1	19	45
COCCCONC[C@@H](O)c1ccccc1	ZINC000819309021	BD	On-Demand	Anodyne	AOC3	16	46
COCCCONC[C@H](O)c1ccccc1	ZINC000819309022	BD	On-Demand	Anodyne	AOC3	16	46
C=CCCCCCCNC[C@H](O)c1cccnc1	ZINC000819309023	BF	On-Demand	Mild	ADRB2	30	48
C=CCCCCCCNC[C@H](O)c1cccnc1	ZINC000819309023	BF	On-Demand	Mild	ADRB1	37	45
C=CCCCCCCNC[C@H](O)c1cccnc1	ZINC000819309023	BF	On-Demand	Mild	ADRB3	111	48
C=CCCCCCCNC[C@@H](O)c1cccnc1	ZINC000819309024	BF	On-Demand	Mild	ADRB2	30	48
C=CCCCCCCNC[C@@H](O)c1cccnc1	ZINC000819309024	BF	On-Demand	Mild	ADRB1	37	45
C=CCCCCCCNC[C@@H](O)c1cccnc1	ZINC000819309024	BF	On-Demand	Mild	ADRB3	111	48
Cn1ncc(CNC[C@H](O)COc2ccc(Oc3ccccc3)cc2)n1	ZINC000819309027	FE	On-Demand	Anodyne	ADRB2	53	51
Cn1ncc(CNC[C@H](O)COc2ccc(Oc3ccccc3)cc2)n1	ZINC000819309027	FE	On-Demand	Anodyne	ADRB1	71	48
Cn1ncc(CNC[C@H](O)COc2ccc(Oc3ccccc3)cc2)n1	ZINC000819309027	FE	On-Demand	Anodyne	ADRB3	50	44
Cn1ncc(CNC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)n1	ZINC000819309028	FE	On-Demand	Anodyne	ADRB2	53	51
Cn1ncc(CNC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)n1	ZINC000819309028	FE	On-Demand	Anodyne	ADRB1	71	48
Cn1ncc(CNC[C@@H](O)COc2ccc(Oc3ccccc3)cc2)n1	ZINC000819309028	FE	On-Demand	Anodyne	ADRB3	50	44
Cc1nn(C)cc1NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819309042	DF	On-Demand	Anodyne	FAS	16	42
O=C(C(F)=C1CCC1)N1CCN(c2ncnc3ccsc23)CC1	ZINC000819309113	EF	On-Demand	Anodyne	SIRT3	74	36
O=C(C(F)=C1CCC1)N1CCN(c2ncnc3ccsc23)CC1	ZINC000819309113	EF	On-Demand	Anodyne	SIRT2	63	36
O=C(C(F)=C1CCC1)N1CCN(c2ncnc3ccsc23)CC1	ZINC000819309113	EF	On-Demand	Anodyne	SIRT1	54	36
O[C@H](CNC[C@@H](N1CCOCC1)C(F)(F)F)c1cccnc1	ZINC000819309139	DC	On-Demand	Anodyne	ADRB2	22	45
O[C@H](CNC[C@@H](N1CCOCC1)C(F)(F)F)c1cccnc1	ZINC000819309139	DC	On-Demand	Anodyne	ADRB1	23	45
O[C@H](CNC[C@@H](N1CCOCC1)C(F)(F)F)c1cccnc1	ZINC000819309139	DC	On-Demand	Anodyne	ADRB3	89	45
O[C@H](CNC[C@H](N1CCOCC1)C(F)(F)F)c1cccnc1	ZINC000819309140	DC	On-Demand	Anodyne	ADRB2	22	45
O[C@H](CNC[C@H](N1CCOCC1)C(F)(F)F)c1cccnc1	ZINC000819309140	DC	On-Demand	Anodyne	ADRB1	23	45
O[C@H](CNC[C@H](N1CCOCC1)C(F)(F)F)c1cccnc1	ZINC000819309140	DC	On-Demand	Anodyne	ADRB3	89	45
O[C@@H](CNC[C@@H](N1CCOCC1)C(F)(F)F)c1cccnc1	ZINC000819309141	DC	On-Demand	Anodyne	ADRB2	22	45
O[C@@H](CNC[C@@H](N1CCOCC1)C(F)(F)F)c1cccnc1	ZINC000819309141	DC	On-Demand	Anodyne	ADRB1	23	45
O[C@@H](CNC[C@@H](N1CCOCC1)C(F)(F)F)c1cccnc1	ZINC000819309141	DC	On-Demand	Anodyne	ADRB3	89	45
O[C@@H](CNC[C@H](N1CCOCC1)C(F)(F)F)c1cccnc1	ZINC000819309142	DC	On-Demand	Anodyne	ADRB2	22	45
O[C@@H](CNC[C@H](N1CCOCC1)C(F)(F)F)c1cccnc1	ZINC000819309142	DC	On-Demand	Anodyne	ADRB1	23	45
O[C@@H](CNC[C@H](N1CCOCC1)C(F)(F)F)c1cccnc1	ZINC000819309142	DC	On-Demand	Anodyne	ADRB3	89	45
N#Cc1ccc([C@@H](O)CN[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)cc1	ZINC000819309171	FF	On-Demand	Mild	ETHR	42	35
N#Cc1ccc([C@H](O)CN[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)cc1	ZINC000819309172	FF	On-Demand	Mild	ETHR	42	35
Cn1ncc(CNC[C@H](O)COc2ccc(C(C)(C)C)cc2)n1	ZINC000819309174	DD	On-Demand	Anodyne	ADRB2	34	40
Cn1ncc(CNC[C@H](O)COc2ccc(C(C)(C)C)cc2)n1	ZINC000819309174	DD	On-Demand	Anodyne	ADRB1	46	39
Cn1ncc(CNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)n1	ZINC000819309175	DD	On-Demand	Anodyne	ADRB2	34	40
Cn1ncc(CNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)n1	ZINC000819309175	DD	On-Demand	Anodyne	ADRB1	46	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	CTSD	125	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	PGC	64	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	CMA1	29	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	CTRA_BOVIN	17	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	PAPA1_CARPA	34	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	CCKAR	43	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	CTSK	15	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	CTSL	17	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	PGA	47	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	BACE2	54	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	TIMP3	68	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	TACR3	15	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	REN	92	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	REN1	31	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	BACE1	95	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	FPR1	53	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	PLM1_PLAFA	31	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	PLM2_PLAFA	63	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	GAG-PRO	48	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCC1(C)C	ZINC000819309176	FG	On-Demand	Anodyne	Q82323_9DELA	73	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	CTSD	125	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	PGC	64	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	CMA1	29	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	CTRA_BOVIN	17	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	PAPA1_CARPA	34	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	CCKAR	43	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	CTSK	15	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	CTSL	17	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	PGA	47	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	BACE2	54	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	TIMP3	68	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	TACR3	15	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	REN	92	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	REN1	31	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	BACE1	95	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	FPR1	53	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	PLM1_PLAFA	31	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	PLM2_PLAFA	63	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	GAG-PRO	48	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCC1(C)C	ZINC000819309177	FG	On-Demand	Anodyne	Q82323_9DELA	73	32
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309200	DC	On-Demand	Anodyne	ADRB2	45	56
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309200	DC	On-Demand	Anodyne	ADRB1	82	56
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309200	DC	On-Demand	Anodyne	GRIN1	22	40
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309200	DC	On-Demand	Anodyne	ADRB3	51	53
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309201	DC	On-Demand	Anodyne	ADRB2	45	56
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309201	DC	On-Demand	Anodyne	ADRB1	82	56
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309201	DC	On-Demand	Anodyne	GRIN1	22	40
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309201	DC	On-Demand	Anodyne	ADRB3	51	53
COCCCONC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819309202	DE	On-Demand	Anodyne	ADRB2	25	43
COCCCONC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819309202	DE	On-Demand	Anodyne	ADRB1	25	43
COCCCONC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819309202	DE	On-Demand	Anodyne	GRIN1	30	44
COCCCONC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819309203	DE	On-Demand	Anodyne	ADRB2	25	43
COCCCONC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819309203	DE	On-Demand	Anodyne	ADRB1	25	43
COCCCONC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819309203	DE	On-Demand	Anodyne	GRIN1	30	44
COCCCONC[C@H](O)COc1c(C)cccc1C	ZINC000819309212	CD	On-Demand	Anodyne	ADRB2	20	40
COCCCONC[C@@H](O)COc1c(C)cccc1C	ZINC000819309213	CD	On-Demand	Anodyne	ADRB2	20	40
COCCc1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309236	DC	On-Demand	Anodyne	ADRB2	43	57
COCCc1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309236	DC	On-Demand	Anodyne	ADRB1	67	58
COCCc1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309236	DC	On-Demand	Anodyne	ADRB3	47	47
COCCc1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309238	DC	On-Demand	Anodyne	ADRB2	43	57
COCCc1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309238	DC	On-Demand	Anodyne	ADRB1	67	58
COCCc1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309238	DC	On-Demand	Anodyne	ADRB3	47	47
CC(=O)c1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309259	DC	On-Demand	Anodyne	ADRB2	39	41
CC(=O)c1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309259	DC	On-Demand	Anodyne	ADRB1	67	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309259	DC	On-Demand	Anodyne	ADRB3	40	40
CC(=O)c1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309260	DC	On-Demand	Anodyne	ADRB2	39	41
CC(=O)c1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309260	DC	On-Demand	Anodyne	ADRB1	67	40
CC(=O)c1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309260	DC	On-Demand	Anodyne	ADRB3	40	40
COCCCONC[C@H](O)COc1ccc2ccccc2c1	ZINC000819309268	DE	On-Demand	Anodyne	ADRB2	38	60
COCCCONC[C@H](O)COc1ccc2ccccc2c1	ZINC000819309268	DE	On-Demand	Anodyne	ADRB1	35	43
COCCCONC[C@H](O)COc1ccc2ccccc2c1	ZINC000819309268	DE	On-Demand	Anodyne	CYP2D6	16	40
COCCCONC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819309269	DE	On-Demand	Anodyne	ADRB2	38	60
COCCCONC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819309269	DE	On-Demand	Anodyne	ADRB1	35	43
COCCCONC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819309269	DE	On-Demand	Anodyne	CYP2D6	16	40
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819309271	FF	On-Demand	Anodyne	ETHR	50	36
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819309272	FF	On-Demand	Anodyne	ETHR	50	36
COCCCONCCC(=O)Nc1cccc(F)c1	ZINC000819309280	CD	On-Demand	Anodyne	KCNK3	48	39
COCCCONCCC(=O)Nc1cccc(F)c1	ZINC000819309280	CD	On-Demand	Anodyne	KCNK9	53	39
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819309299	GF	On-Demand	Anodyne	ETHR	48	36
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819309301	GF	On-Demand	Anodyne	ETHR	48	36
O[C@@H](CNC[C@H](N1CCOCC1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819309328	FE	On-Demand	Anodyne	ADRB1	29	46
O[C@@H](CNC[C@H](N1CCOCC1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819309328	FE	On-Demand	Anodyne	ADRB3	44	46
O[C@@H](CNC[C@H](N1CCOCC1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819309328	FE	On-Demand	Anodyne	IGF1R	26	40
O[C@@H](CNC[C@H](N1CCOCC1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819309328	FE	On-Demand	Anodyne	CYP3A4	46	36
O[C@H](CNC[C@H](N1CCOCC1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819309329	FE	On-Demand	Anodyne	ADRB1	29	46
O[C@H](CNC[C@H](N1CCOCC1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819309329	FE	On-Demand	Anodyne	ADRB3	44	46
O[C@H](CNC[C@H](N1CCOCC1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819309329	FE	On-Demand	Anodyne	IGF1R	26	40
O[C@H](CNC[C@H](N1CCOCC1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819309329	FE	On-Demand	Anodyne	CYP3A4	46	36
O[C@@H](CNC[C@@H](N1CCOCC1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819309331	FE	On-Demand	Anodyne	ADRB1	29	46
O[C@@H](CNC[C@@H](N1CCOCC1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819309331	FE	On-Demand	Anodyne	ADRB3	44	46
O[C@@H](CNC[C@@H](N1CCOCC1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819309331	FE	On-Demand	Anodyne	IGF1R	26	40
O[C@@H](CNC[C@@H](N1CCOCC1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819309331	FE	On-Demand	Anodyne	CYP3A4	46	36
O[C@H](CNC[C@@H](N1CCOCC1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819309333	FE	On-Demand	Anodyne	ADRB1	29	46
O[C@H](CNC[C@@H](N1CCOCC1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819309333	FE	On-Demand	Anodyne	ADRB3	44	46
O[C@H](CNC[C@@H](N1CCOCC1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819309333	FE	On-Demand	Anodyne	IGF1R	26	40
O[C@H](CNC[C@@H](N1CCOCC1)C(F)(F)F)c1cccc(Cl)c1	ZINC000819309333	FE	On-Demand	Anodyne	CYP3A4	46	36
COCCCONC[C@@H](O)COc1ccc(C)cc1	ZINC000819309345	CD	On-Demand	Anodyne	ADRB2	35	56
COCCCONC[C@@H](O)COc1ccc(C)cc1	ZINC000819309345	CD	On-Demand	Anodyne	ADRB1	39	49
COCCCONC[C@@H](O)COc1ccc(C)cc1	ZINC000819309345	CD	On-Demand	Anodyne	ADRB3	19	40
COCCCONC[C@H](O)COc1ccc(C)cc1	ZINC000819309347	CD	On-Demand	Anodyne	ADRB2	35	56
COCCCONC[C@H](O)COc1ccc(C)cc1	ZINC000819309347	CD	On-Demand	Anodyne	ADRB1	39	49
COCCCONC[C@H](O)COc1ccc(C)cc1	ZINC000819309347	CD	On-Demand	Anodyne	ADRB3	19	40
CCOC(=O)[C@@H]1CN(C(=O)Cc2cccc(NC(C)=O)c2)CCO1	ZINC000819309352	EC	On-Demand	Anodyne	P2RY14	42	33
CC(C)c1ccc(O[C@H](C)CNC[C@H](O)c2cccnc2)cc1	ZINC000819309360	DG	On-Demand	Anodyne	ADRB2	29	51
CC(C)c1ccc(O[C@H](C)CNC[C@H](O)c2cccnc2)cc1	ZINC000819309360	DG	On-Demand	Anodyne	ADRB1	36	51
CC(C)c1ccc(O[C@H](C)CNC[C@H](O)c2cccnc2)cc1	ZINC000819309360	DG	On-Demand	Anodyne	ADRB3	102	51
CC(C)c1ccc(O[C@H](C)CNC[C@@H](O)c2cccnc2)cc1	ZINC000819309362	DG	On-Demand	Anodyne	ADRB2	29	51
CC(C)c1ccc(O[C@H](C)CNC[C@@H](O)c2cccnc2)cc1	ZINC000819309362	DG	On-Demand	Anodyne	ADRB1	36	51
CC(C)c1ccc(O[C@H](C)CNC[C@@H](O)c2cccnc2)cc1	ZINC000819309362	DG	On-Demand	Anodyne	ADRB3	102	51
CC(C)c1ccc(O[C@@H](C)CNC[C@@H](O)c2cccnc2)cc1	ZINC000819309364	DG	On-Demand	Anodyne	ADRB2	29	51
CC(C)c1ccc(O[C@@H](C)CNC[C@@H](O)c2cccnc2)cc1	ZINC000819309364	DG	On-Demand	Anodyne	ADRB1	36	51
CC(C)c1ccc(O[C@@H](C)CNC[C@@H](O)c2cccnc2)cc1	ZINC000819309364	DG	On-Demand	Anodyne	ADRB3	102	51
CC(C)c1ccc(O[C@@H](C)CNC[C@H](O)c2cccnc2)cc1	ZINC000819309366	DG	On-Demand	Anodyne	ADRB2	29	51
CC(C)c1ccc(O[C@@H](C)CNC[C@H](O)c2cccnc2)cc1	ZINC000819309366	DG	On-Demand	Anodyne	ADRB1	36	51
CC(C)c1ccc(O[C@@H](C)CNC[C@H](O)c2cccnc2)cc1	ZINC000819309366	DG	On-Demand	Anodyne	ADRB3	102	51
COCCCONC[C@@H](O)COc1cccc(Br)c1	ZINC000819309400	ED	On-Demand	Anodyne	ADRB2	20	43
COCCCONC[C@@H](O)COc1cccc(Br)c1	ZINC000819309400	ED	On-Demand	Anodyne	ADRB1	24	43
COCCCONC[C@H](O)COc1cccc(Br)c1	ZINC000819309401	ED	On-Demand	Anodyne	ADRB2	20	43
COCCCONC[C@H](O)COc1cccc(Br)c1	ZINC000819309401	ED	On-Demand	Anodyne	ADRB1	24	43
CCOc1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309404	DC	On-Demand	Anodyne	ADRB2	40	43
CCOc1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309404	DC	On-Demand	Anodyne	ADRB1	55	43
CCOc1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309404	DC	On-Demand	Anodyne	ADRB3	37	40
CCOc1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309407	DC	On-Demand	Anodyne	ADRB2	40	43
CCOc1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309407	DC	On-Demand	Anodyne	ADRB1	55	43
CCOc1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309407	DC	On-Demand	Anodyne	ADRB3	37	40
C[S@@](=O)Cc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819309454	DE	On-Demand	Anodyne	ADRB2	25	45
C[S@@](=O)Cc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819309454	DE	On-Demand	Anodyne	ADRB1	31	43
C[S@@](=O)Cc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819309454	DE	On-Demand	Anodyne	ADRB3	49	43
C[C@H]1[C@H](C)CCCN1C(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819309455	GG	On-Demand	Anodyne	TRPC6	47	38
C[C@H]1[C@H](C)CCCN1C(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819309456	GG	On-Demand	Anodyne	TRPC6	47	38
COCCCONC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819309457	CD	On-Demand	Anodyne	ADRB2	32	48
COCCCONC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819309457	CD	On-Demand	Anodyne	ADRB1	37	48
COCCCONC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819309457	CD	On-Demand	Anodyne	GRIN1	25	45
COCCCONC[C@H](O)COc1ccc(Cl)cc1	ZINC000819309458	CD	On-Demand	Anodyne	ADRB2	32	48
COCCCONC[C@H](O)COc1ccc(Cl)cc1	ZINC000819309458	CD	On-Demand	Anodyne	ADRB1	37	48
COCCCONC[C@H](O)COc1ccc(Cl)cc1	ZINC000819309458	CD	On-Demand	Anodyne	GRIN1	25	45
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819309459	GF	On-Demand	Anodyne	ETHR	48	35
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819309460	GF	On-Demand	Anodyne	ETHR	48	35
Cn1ncc(CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000819309461	EE	On-Demand	Anodyne	ADRB2	56	48
Cn1ncc(CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000819309461	EE	On-Demand	Anodyne	ADRB1	76	45
Cn1ncc(CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000819309461	EE	On-Demand	Anodyne	ADRB3	56	41
Cn1ncc(CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000819309462	EE	On-Demand	Anodyne	ADRB2	56	48
Cn1ncc(CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000819309462	EE	On-Demand	Anodyne	ADRB1	76	45
Cn1ncc(CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000819309462	EE	On-Demand	Anodyne	ADRB3	56	41
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819309464	GF	On-Demand	Bother	ETHR	47	34
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819309465	GF	On-Demand	Bother	ETHR	47	34
C[S@@](=O)Cc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819309469	DE	On-Demand	Anodyne	ADRB2	25	45
C[S@@](=O)Cc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819309469	DE	On-Demand	Anodyne	ADRB1	31	43
C[S@@](=O)Cc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819309469	DE	On-Demand	Anodyne	ADRB3	49	43
C[S@](=O)Cc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819309471	DE	On-Demand	Anodyne	ADRB2	25	45
C[S@](=O)Cc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819309471	DE	On-Demand	Anodyne	ADRB1	31	43
C[S@](=O)Cc1ccc(CNC[C@@H](O)c2ccccc2)cc1	ZINC000819309471	DE	On-Demand	Anodyne	ADRB3	49	43
C[S@](=O)Cc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819309473	DE	On-Demand	Anodyne	ADRB2	25	45
C[S@](=O)Cc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819309473	DE	On-Demand	Anodyne	ADRB1	31	43
C[S@](=O)Cc1ccc(CNC[C@H](O)c2ccccc2)cc1	ZINC000819309473	DE	On-Demand	Anodyne	ADRB3	49	43
Cn1ncc(CNC[C@H](O)COc2ccc(CC#N)cc2)n1	ZINC000819309486	DC	On-Demand	Mild	ADRB2	36	41
Cn1ncc(CNC[C@H](O)COc2ccc(CC#N)cc2)n1	ZINC000819309486	DC	On-Demand	Mild	ADRB1	57	41
Cn1ncc(CNC[C@H](O)COc2ccc(CC#N)cc2)n1	ZINC000819309486	DC	On-Demand	Mild	ADRB3	39	40
Cn1ncc(CNC[C@@H](O)COc2ccc(CC#N)cc2)n1	ZINC000819309490	DC	On-Demand	Mild	ADRB2	36	41
Cn1ncc(CNC[C@@H](O)COc2ccc(CC#N)cc2)n1	ZINC000819309490	DC	On-Demand	Mild	ADRB1	57	41
Cn1ncc(CNC[C@@H](O)COc2ccc(CC#N)cc2)n1	ZINC000819309490	DC	On-Demand	Mild	ADRB3	39	40
Cn1ncc(CNCCC(=O)Nc2cccc(Br)c2)n1	ZINC000819309504	ED	On-Demand	Anodyne	EGFR	46	42
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819309505	FF	On-Demand	Anodyne	ETHR	51	42
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819309506	FF	On-Demand	Anodyne	ETHR	51	42
CSc1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309509	DD	On-Demand	Anodyne	ADRB2	30	40
CSc1ccc(OC[C@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309509	DD	On-Demand	Anodyne	ADRB1	44	38
CSc1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309511	DD	On-Demand	Anodyne	ADRB2	30	40
CSc1ccc(OC[C@@H](O)CNCc2cnn(C)n2)cc1	ZINC000819309511	DD	On-Demand	Anodyne	ADRB1	44	38
C[S@@](=O)Cc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819309518	EG	On-Demand	Anodyne	ADRB2	43	46
C[S@@](=O)Cc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819309518	EG	On-Demand	Anodyne	ADRB1	52	49
C[S@@](=O)Cc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819309518	EG	On-Demand	Anodyne	ADRB3	62	49
C[S@](=O)Cc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819309519	EG	On-Demand	Anodyne	ADRB2	43	46
C[S@](=O)Cc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819309519	EG	On-Demand	Anodyne	ADRB1	52	49
C[S@](=O)Cc1ccc(CNC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819309519	EG	On-Demand	Anodyne	ADRB3	62	49
C[S@@](=O)Cc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819309520	EG	On-Demand	Anodyne	ADRB2	43	46
C[S@@](=O)Cc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819309520	EG	On-Demand	Anodyne	ADRB1	52	49
C[S@@](=O)Cc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819309520	EG	On-Demand	Anodyne	ADRB3	62	49
C[S@](=O)Cc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819309521	EG	On-Demand	Anodyne	ADRB2	43	46
C[S@](=O)Cc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819309521	EG	On-Demand	Anodyne	ADRB1	52	49
C[S@](=O)Cc1ccc(CNC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819309521	EG	On-Demand	Anodyne	ADRB3	62	49
O=C(Cc1nsc2ccccc12)Nc1ccc(N2CCSCC2)cc1	ZINC000819309522	FI	On-Demand	Anodyne	DRD2	19	40
N#CCNC(=O)CNC[C@H](O)c1cccc2ccccc12	ZINC000819309523	CD	On-Demand	Mild	CTSL	19	40
Cc1ccccc1[C@@H](O)CN[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	ZINC000819309526	FF	On-Demand	Anodyne	ETHR	50	37
COCCCONC[C@@H](O)COc1ccc(Br)cc1	ZINC000819309533	ED	On-Demand	Anodyne	ADRB2	31	48
COCCCONC[C@@H](O)COc1ccc(Br)cc1	ZINC000819309533	ED	On-Demand	Anodyne	ADRB1	35	48
COCCCONC[C@H](O)COc1ccc(Br)cc1	ZINC000819309534	ED	On-Demand	Anodyne	ADRB2	31	48
COCCCONC[C@H](O)COc1ccc(Br)cc1	ZINC000819309534	ED	On-Demand	Anodyne	ADRB1	35	48
C[C@@H]1CCCN(C(=O)C(F)=C2CCC2)[C@@H]1C	ZINC000819309559	BG	On-Demand	Anodyne	TRPC6	47	34
C[C@H]1[C@H](C)CCCN1C(=O)C(F)=C1CCC1	ZINC000819309563	BG	On-Demand	Anodyne	TRPC6	47	34
COCCCONC[C@H](O)COc1ccc(C)cc1C	ZINC000819309564	CD	On-Demand	Anodyne	ADRB2	18	48
COCCCONC[C@@H](O)COc1ccc(C)cc1C	ZINC000819309565	CD	On-Demand	Anodyne	ADRB2	18	48
C[S@@](=O)Cc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819309566	DD	On-Demand	Anodyne	ADRB2	27	45
C[S@@](=O)Cc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819309566	DD	On-Demand	Anodyne	ADRB1	32	48
C[S@@](=O)Cc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819309566	DD	On-Demand	Anodyne	ADRB3	106	48
C[S@](=O)Cc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819309568	DD	On-Demand	Anodyne	ADRB2	27	45
C[S@](=O)Cc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819309568	DD	On-Demand	Anodyne	ADRB1	32	48
C[S@](=O)Cc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819309568	DD	On-Demand	Anodyne	ADRB3	106	48
C[S@@](=O)Cc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819309569	DD	On-Demand	Anodyne	ADRB2	27	45
C[S@@](=O)Cc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819309569	DD	On-Demand	Anodyne	ADRB1	32	48
C[S@@](=O)Cc1ccc(CNC[C@@H](O)c2cccnc2)cc1	ZINC000819309569	DD	On-Demand	Anodyne	ADRB3	106	48
C[S@](=O)Cc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819309570	DD	On-Demand	Anodyne	ADRB2	27	45
C[S@](=O)Cc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819309570	DD	On-Demand	Anodyne	ADRB1	32	48
C[S@](=O)Cc1ccc(CNC[C@H](O)c2cccnc2)cc1	ZINC000819309570	DD	On-Demand	Anodyne	ADRB3	106	48
Cn1ncc(CNCCC(=O)Nc2ccc(Cl)cc2)n1	ZINC000819309588	CD	On-Demand	Anodyne	IMDH_CRYPV	32	41
C[S@@](=O)Cc1ccc(CNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819309592	EF	On-Demand	Anodyne	LEF	58	37
C[S@](=O)Cc1ccc(CNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819309593	EF	On-Demand	Anodyne	LEF	58	37
C[S@](=O)Cc1ccc(CNC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819309595	EF	On-Demand	Anodyne	LEF	58	37
C[S@@](=O)Cc1ccc(CNC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819309597	EF	On-Demand	Anodyne	LEF	58	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](Cn1cccn1)c1ccccc1	ZINC000819309669	FF	On-Demand	Anodyne	REN	15	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](Cn1cccn1)c1ccccc1	ZINC000819309670	FF	On-Demand	Anodyne	REN	15	41
Cc1nn(C)cc1NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819309724	GI	On-Demand	Anodyne	REN	57	42
Cc1nn(C)cc1NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819309725	GI	On-Demand	Anodyne	REN	57	42
CC(=O)Nc1cccc(CC(=O)N2CCN(CC[S@](C)=O)CC2)c1	ZINC000819309727	FC	On-Demand	Anodyne	HTR1D	25	43
CC(=O)Nc1cccc(CC(=O)N2CCN(CC[S@](C)=O)CC2)c1	ZINC000819309727	FC	On-Demand	Anodyne	HTR1B	22	43
CC(=O)Nc1cccc(CC(=O)N2CCN(CC[S@](C)=O)CC2)c1	ZINC000819309727	FC	On-Demand	Anodyne	MCHR1	21	40
CC(=O)Nc1cccc(CC(=O)N2CCN(CC[S@](C)=O)CC2)c1	ZINC000819309727	FC	On-Demand	Anodyne	KCNJ1	50	36
CC(=O)Nc1cccc(CC(=O)N2CCN(CC[S@@](C)=O)CC2)c1	ZINC000819309728	FC	On-Demand	Anodyne	HTR1D	25	43
CC(=O)Nc1cccc(CC(=O)N2CCN(CC[S@@](C)=O)CC2)c1	ZINC000819309728	FC	On-Demand	Anodyne	HTR1B	22	43
CC(=O)Nc1cccc(CC(=O)N2CCN(CC[S@@](C)=O)CC2)c1	ZINC000819309728	FC	On-Demand	Anodyne	MCHR1	21	40
CC(=O)Nc1cccc(CC(=O)N2CCN(CC[S@@](C)=O)CC2)c1	ZINC000819309728	FC	On-Demand	Anodyne	KCNJ1	50	36
O=C(CCC(F)(F)F)N1CCC[C@@H](NCC2(O)CCCCC2)C1	ZINC000819309751	EF	On-Demand	Anodyne	ETHR	41	34
Cn1ncc(CNC[C@@H](O)COc2cccc3[nH]ccc23)n1	ZINC000819309754	DC	On-Demand	Anodyne	ADRB2	18	59
Cn1ncc(CNC[C@@H](O)COc2cccc3[nH]ccc23)n1	ZINC000819309754	DC	On-Demand	Anodyne	ADRB1	39	59
Cn1ncc(CNC[C@H](O)COc2cccc3[nH]ccc23)n1	ZINC000819309755	DC	On-Demand	Anodyne	ADRB2	18	59
Cn1ncc(CNC[C@H](O)COc2cccc3[nH]ccc23)n1	ZINC000819309755	DC	On-Demand	Anodyne	ADRB1	39	59
CS(=O)(=O)c1cccc(Oc2ncccc2CNC(=O)C(F)=C2CCC2)c1	ZINC000819309770	GG	On-Demand	Anodyne	NR1H3	51	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cnn(CC(=O)N2CCOCC2)c1	ZINC000819309772	GC	On-Demand	Anodyne	PANC	52	34
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819309780	GF	On-Demand	Anodyne	ETHR	48	36
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819309781	GF	On-Demand	Anodyne	ETHR	48	36
COCCCONC[C@H](O)COc1cc(C)cc(C)c1	ZINC000819309784	CD	On-Demand	Anodyne	ADRB2	15	56
COCCCONC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000819309785	CD	On-Demand	Anodyne	ADRB2	15	56
COCCCONC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819309797	CC	On-Demand	Mild	ADRB2	24	46
COCCCONC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819309797	CC	On-Demand	Mild	ADRB1	30	46
COCCCONC[C@H](O)COc1ccc(C#N)cc1	ZINC000819309798	CC	On-Demand	Mild	ADRB2	24	46
COCCCONC[C@H](O)COc1ccc(C#N)cc1	ZINC000819309798	CC	On-Demand	Mild	ADRB1	30	46
O=C(C(F)=C1CCC1)N1CC[C@@H](Cc2ccccc2)C1	ZINC000819309807	CG	On-Demand	Anodyne	GRIN2B	77	45
O=C(C(F)=C1CCC1)N1CC[C@@H](Cc2ccccc2)C1	ZINC000819309807	CG	On-Demand	Anodyne	SIGMAR1	25	42
O=C(C(F)=C1CCC1)N1CC[C@H](Cc2ccccc2)C1	ZINC000819309808	CG	On-Demand	Anodyne	GRIN2B	77	45
O=C(C(F)=C1CCC1)N1CC[C@H](Cc2ccccc2)C1	ZINC000819309808	CG	On-Demand	Anodyne	SIGMAR1	25	42
Cn1ncc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)n1	ZINC000819309814	ED	On-Demand	Anodyne	ADRB2	21	41
Cn1ncc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)n1	ZINC000819309814	ED	On-Demand	Anodyne	ADRB1	55	33
Cn1ncc(CNC[C@H](O)COc2ccccc2C(F)(F)F)n1	ZINC000819309815	ED	On-Demand	Anodyne	ADRB2	21	41
Cn1ncc(CNC[C@H](O)COc2ccccc2C(F)(F)F)n1	ZINC000819309815	ED	On-Demand	Anodyne	ADRB1	55	33
COCCCONC[C@@H](O)COc1ccccc1Cl	ZINC000819309816	CD	On-Demand	Anodyne	ADRB2	26	48
COCCCONC[C@H](O)COc1ccccc1Cl	ZINC000819309817	CD	On-Demand	Anodyne	ADRB2	26	48
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819309820	GG	On-Demand	Anodyne	ADRB3	18	43
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819309820	GG	On-Demand	Anodyne	ETHR	44	36
Cn1ncc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000819309828	EC	On-Demand	Anodyne	GPR119	51	45
Cn1ncc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000819309829	EC	On-Demand	Anodyne	GPR119	51	45
O=C(/C=C\[C@H]1CCCO1)N1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000819309843	GG	On-Demand	Anodyne	CCR5	16	47
O=C(/C=C/[C@H]1CCCO1)N1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000819309844	GG	On-Demand	Anodyne	CCR5	16	47
O=C(/C=C\[C@@H]1CCCO1)N1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000819309845	GG	On-Demand	Anodyne	CCR5	16	47
O=C(/C=C/[C@@H]1CCCO1)N1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000819309846	GG	On-Demand	Anodyne	CCR5	16	47
COc1cccc([S@@](=O)CC(=O)NCCn2c(C)nnc2S)c1	ZINC000819309872	FC	On-Demand	Anodyne	DRD4	43	34
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(N2CCSCC2)cc1	ZINC000819309898	DF	On-Demand	Anodyne	PIK3CA	17	42
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(N2CCSCC2)cc1	ZINC000819309898	DF	On-Demand	Anodyne	MTOR	40	42
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(N2CCSCC2)cc1	ZINC000819309899	DF	On-Demand	Anodyne	PIK3CA	17	42
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(N2CCSCC2)cc1	ZINC000819309899	DF	On-Demand	Anodyne	MTOR	40	42
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(N2CCSCC2)cc1	ZINC000819309900	DF	On-Demand	Anodyne	PIK3CA	17	42
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(N2CCSCC2)cc1	ZINC000819309900	DF	On-Demand	Anodyne	MTOR	40	42
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(N2CCSCC2)cc1	ZINC000819309901	DF	On-Demand	Anodyne	PIK3CA	17	42
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(N2CCSCC2)cc1	ZINC000819309901	DF	On-Demand	Anodyne	MTOR	40	42
COc1cccc(Oc2ncccc2CNC(=O)C(F)=C2CCC2)c1	ZINC000819309903	EH	On-Demand	Anodyne	P2RY1	17	41
N#CCNC(=O)CNC[C@@H](O)c1ccccc1Br	ZINC000819309904	DC	On-Demand	Mild	PAPA1_CARPA	32	41
N#CCNC(=O)CNC[C@@H](O)c1ccccc1Br	ZINC000819309904	DC	On-Demand	Mild	CTSL	16	40
N#CCNC(=O)CNC[C@H](O)c1ccccc1Br	ZINC000819309905	DC	On-Demand	Mild	PAPA1_CARPA	32	41
N#CCNC(=O)CNC[C@H](O)c1ccccc1Br	ZINC000819309905	DC	On-Demand	Mild	CTSL	16	40
C[S@@](=O)Cc1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819309920	DF	On-Demand	Anodyne	ADRB1	24	44
C[S@@](=O)Cc1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819309920	DF	On-Demand	Anodyne	ADRB3	34	44
C[S@](=O)Cc1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819309921	DF	On-Demand	Anodyne	ADRB1	24	44
C[S@](=O)Cc1ccc(CNC[C@H](O)c2cccc(F)c2)cc1	ZINC000819309921	DF	On-Demand	Anodyne	ADRB3	34	44
C[S@@](=O)Cc1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819309922	DF	On-Demand	Anodyne	ADRB1	24	44
C[S@@](=O)Cc1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819309922	DF	On-Demand	Anodyne	ADRB3	34	44
C[S@](=O)Cc1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819309923	DF	On-Demand	Anodyne	ADRB1	24	44
C[S@](=O)Cc1ccc(CNC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819309923	DF	On-Demand	Anodyne	ADRB3	34	44
N#CCNC(=O)CNC[C@@H](O)c1ccccc1F	ZINC000819309924	CC	On-Demand	Mild	PAPA1_CARPA	32	41
N#CCNC(=O)CNC[C@@H](O)c1ccccc1F	ZINC000819309924	CC	On-Demand	Mild	CTSL	18	41
N#CCNC(=O)CNC[C@@H](O)c1ccccc1F	ZINC000819309924	CC	On-Demand	Mild	CTSS	15	41
N#CCNC(=O)CNC[C@H](O)c1ccccc1F	ZINC000819309925	CC	On-Demand	Mild	PAPA1_CARPA	32	41
N#CCNC(=O)CNC[C@H](O)c1ccccc1F	ZINC000819309925	CC	On-Demand	Mild	CTSL	18	41
N#CCNC(=O)CNC[C@H](O)c1ccccc1F	ZINC000819309925	CC	On-Demand	Mild	CTSS	15	41
Cc1nn(C)cc1NC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819309956	FG	On-Demand	Anodyne	CNR1	57	35
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC(C2CCC2)C2CCC2)CC1	ZINC000819309982	FH	On-Demand	Anodyne	GPR119	35	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC(C2CCC2)C2CCC2)CC1	ZINC000819309983	FH	On-Demand	Anodyne	GPR119	35	44
COC[C@]1(CNC[C@H](O)c2cccnc2)CCCN1C(=O)OC(C)(C)C	ZINC000819310014	FE	On-Demand	Anodyne	ADRB3	75	40
COC[C@]1(CNC[C@@H](O)c2cccnc2)CCCN1C(=O)OC(C)(C)C	ZINC000819310015	FE	On-Demand	Anodyne	ADRB3	75	40
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819310037	GH	On-Demand	Anodyne	ETHR	57	38
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819310038	EF	On-Demand	Anodyne	SFRP1	50	36
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819310038	EF	On-Demand	Anodyne	ETHR	57	40
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819310039	EF	On-Demand	Anodyne	SFRP1	50	36
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819310039	EF	On-Demand	Anodyne	ETHR	57	40
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819310040	EE	On-Demand	Anodyne	ADRB3	67	47
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819310040	EE	On-Demand	Anodyne	PTAFR	15	40
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819310040	EE	On-Demand	Anodyne	C3AR1	43	40
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819310040	EE	On-Demand	Anodyne	ETHR	56	38
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819310041	EE	On-Demand	Anodyne	ADRB3	67	47
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819310041	EE	On-Demand	Anodyne	PTAFR	15	40
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819310041	EE	On-Demand	Anodyne	C3AR1	43	40
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819310041	EE	On-Demand	Anodyne	ETHR	56	38
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)C2CC2)C1	ZINC000819310079	DD	On-Demand	Anodyne	ETHR	42	35
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)C2CC2)C1	ZINC000819310080	DD	On-Demand	Anodyne	ETHR	42	35
COCCCONC[C@@H](O)COc1ccccc1	ZINC000819310081	CC	On-Demand	Anodyne	ADRB2	54	55
COCCCONC[C@@H](O)COc1ccccc1	ZINC000819310081	CC	On-Demand	Anodyne	ADRB1	61	47
COCCCONC[C@@H](O)COc1ccccc1	ZINC000819310081	CC	On-Demand	Anodyne	ADRB3	37	45
COCCCONC[C@H](O)COc1ccccc1	ZINC000819310082	CC	On-Demand	Anodyne	ADRB2	54	55
COCCCONC[C@H](O)COc1ccccc1	ZINC000819310082	CC	On-Demand	Anodyne	ADRB1	61	47
COCCCONC[C@H](O)COc1ccccc1	ZINC000819310082	CC	On-Demand	Anodyne	ADRB3	37	45
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819310107	GG	On-Demand	Anodyne	ETHR	47	35
O=C(CCC(F)(F)F)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819310108	GG	On-Demand	Anodyne	ETHR	47	35
N#CCNC(=O)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819310152	CC	On-Demand	Mild	ADRB1	38	47
N#CCNC(=O)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819310152	CC	On-Demand	Mild	ADRB3	56	47
N#CCNC(=O)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819310152	CC	On-Demand	Mild	CTSK	18	40
N#CCNC(=O)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819310152	CC	On-Demand	Mild	CTSL	25	42
N#CCNC(=O)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819310152	CC	On-Demand	Mild	CTSS	16	42
N#CCNC(=O)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819310152	CC	On-Demand	Mild	CTSV	41	42
N#CCNC(=O)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819310153	CC	On-Demand	Mild	ADRB1	38	47
N#CCNC(=O)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819310153	CC	On-Demand	Mild	ADRB3	56	47
N#CCNC(=O)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819310153	CC	On-Demand	Mild	CTSK	18	40
N#CCNC(=O)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819310153	CC	On-Demand	Mild	CTSL	25	42
N#CCNC(=O)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819310153	CC	On-Demand	Mild	CTSS	16	42
N#CCNC(=O)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819310153	CC	On-Demand	Mild	CTSV	41	42
COc1ccc(OC)c([C@H](O)CNCC(=O)NCC#N)c1	ZINC000819310183	CB	On-Demand	Mild	MTNR1A	38	44
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCSCC2)cc1	ZINC000819310192	DH	On-Demand	Mild	MTOR	18	40
N#CCNC(=O)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819310207	CB	On-Demand	Mild	CACNA1C	43	37
N#CCNC(=O)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819310207	CB	On-Demand	Mild	CACNA1D	66	37
N#CCNC(=O)CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819310208	CB	On-Demand	Mild	CACNA1C	43	37
N#CCNC(=O)CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819310208	CB	On-Demand	Mild	CACNA1D	66	37
CCOC(=O)[C@@H]1CN(C(=O)Cc2ccc(-n3cnnc3)cc2)CCO1	ZINC000819310256	EC	On-Demand	Anodyne	KCNJ1	44	36
COc1cccc([S@](=O)CC(=O)N2CCN(CC[S@](C)=O)CC2)c1	ZINC000819310360	FC	On-Demand	Anodyne	DRD4	49	37
COc1cccc([S@](=O)CC(=O)N2CCN(CC[S@@](C)=O)CC2)c1	ZINC000819310361	FC	On-Demand	Anodyne	DRD4	49	37
COc1cccc([S@@](=O)CC(=O)N2CCN(CC[S@@](C)=O)CC2)c1	ZINC000819310362	FC	On-Demand	Anodyne	DRD4	49	37
COc1cccc([S@@](=O)CC(=O)N2CCN(CC[S@](C)=O)CC2)c1	ZINC000819310363	FC	On-Demand	Anodyne	DRD4	49	37
COc1cccc([S@@](=O)CC(=O)Nc2cn(C)nc2C)c1	ZINC000819310417	DD	On-Demand	Anodyne	PDGFRB	15	46
O=C(NCc1coc(-c2ccccc2)n1)C(F)=C1CCC1	ZINC000819310428	CG	On-Demand	Anodyne	PDE8B	49	32
N#Cc1ccc(CNC[C@H](O)COc2ccc(Cl)cc2Br)nc1	ZINC000819310431	GF	On-Demand	Mild	ADRB1	42	37
N#Cc1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2Br)nc1	ZINC000819310432	GF	On-Demand	Mild	ADRB1	42	37
COCC(C)(C)CCCNC[C@H](O)c1ccc(C)cc1	ZINC000819310443	CG	On-Demand	Anodyne	ADRB2	19	40
COCC(C)(C)CCCNC[C@@H](O)c1ccc(C)cc1	ZINC000819310444	CG	On-Demand	Anodyne	ADRB2	19	40
O[C@H](CNCCC1(F)CCC1)c1cccnc1	ZINC000819310487	BD	On-Demand	Anodyne	ADRB2	31	45
O[C@H](CNCCC1(F)CCC1)c1cccnc1	ZINC000819310487	BD	On-Demand	Anodyne	ADRB1	30	45
O[C@H](CNCCC1(F)CCC1)c1cccnc1	ZINC000819310487	BD	On-Demand	Anodyne	ADRB3	105	47
O[C@@H](CNCCC1(F)CCC1)c1cccnc1	ZINC000819310488	BD	On-Demand	Anodyne	ADRB2	31	45
O[C@@H](CNCCC1(F)CCC1)c1cccnc1	ZINC000819310488	BD	On-Demand	Anodyne	ADRB1	30	45
O[C@@H](CNCCC1(F)CCC1)c1cccnc1	ZINC000819310488	BD	On-Demand	Anodyne	ADRB3	105	47
COc1ccc(OC)c([C@H](O)CNCCC2(F)CCC2)c1	ZINC000819310534	CF	On-Demand	Anodyne	ADRB2	17	49
O=C(O)[C@@H]1CN(C(=O)NC2CCC(N3CCCCC3)CC2)CCO1	ZINC000819310632	ED	On-Demand	Anodyne	L3MBTL3	76	37
O=C(O)[C@H]1CN(C(=O)NC2CCC(N3CCCCC3)CC2)CCO1	ZINC000819310633	ED	On-Demand	Anodyne	L3MBTL3	76	37
COC[C@]1(CNC[C@H](O)c2cccc(Cl)c2)CCCN1C(=O)OC(C)(C)C	ZINC000819310640	GG	On-Demand	Anodyne	ADRB1	30	41
COC[C@]1(CNC[C@H](O)c2cccc(Cl)c2)CCCN1C(=O)OC(C)(C)C	ZINC000819310640	GG	On-Demand	Anodyne	ADRB3	47	41
COC[C@]1(CNC[C@H](O)c2cccc(Cl)c2)CCCN1C(=O)OC(C)(C)C	ZINC000819310640	GG	On-Demand	Anodyne	CYP3A4	45	34
COC[C@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCCN1C(=O)OC(C)(C)C	ZINC000819310643	GG	On-Demand	Anodyne	ADRB1	30	41
COC[C@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCCN1C(=O)OC(C)(C)C	ZINC000819310643	GG	On-Demand	Anodyne	ADRB3	47	41
COC[C@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCCN1C(=O)OC(C)(C)C	ZINC000819310643	GG	On-Demand	Anodyne	CYP3A4	45	34
COC[C@]1(CNC[C@@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819310662	GF	On-Demand	Anodyne	PGC	42	31
COC[C@]1(CNC[C@@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819310662	GF	On-Demand	Anodyne	SLC12A5	63	39
COC[C@]1(CNC[C@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819310665	GF	On-Demand	Anodyne	PGC	42	31
COC[C@]1(CNC[C@H](O)Cc2ccccc2)CCCN1C(=O)OC(C)(C)C	ZINC000819310665	GF	On-Demand	Anodyne	SLC12A5	63	39
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819310700	GD	On-Demand	Anodyne	ADRB3	15	44
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819310702	GD	On-Demand	Anodyne	ADRB3	15	44
O=C(O)[C@@H]1CN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CCO1	ZINC000819310716	GC	On-Demand	Anodyne	HTR4	51	37
O=C(O)[C@H]1CN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CCO1	ZINC000819310718	GC	On-Demand	Anodyne	HTR4	51	37
O=C(O)[C@@H]1CN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CCO1	ZINC000819310719	GC	On-Demand	Anodyne	HTR4	51	37
O=C(O)[C@H]1CN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CCO1	ZINC000819310720	GC	On-Demand	Anodyne	HTR4	51	37
O=C(O)[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)CCO1	ZINC000819310733	FD	On-Demand	Anodyne	HTR1D	69	38
O=C(O)[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)CCO1	ZINC000819310733	FD	On-Demand	Anodyne	HTR1B	53	38
O=C(O)[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)CCO1	ZINC000819310733	FD	On-Demand	Anodyne	MPO	53	34
O=C(O)[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)CCO1	ZINC000819310733	FD	On-Demand	Anodyne	MAPT	15	43
O=C(O)[C@H]1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)CCO1	ZINC000819310734	FD	On-Demand	Anodyne	HTR1D	69	38
O=C(O)[C@H]1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)CCO1	ZINC000819310734	FD	On-Demand	Anodyne	HTR1B	53	38
O=C(O)[C@H]1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)CCO1	ZINC000819310734	FD	On-Demand	Anodyne	MPO	53	34
O=C(O)[C@H]1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)CCO1	ZINC000819310734	FD	On-Demand	Anodyne	MAPT	15	43
C=C(CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819310735	FG	On-Demand	Mild	AMY2	43	30
C=C(CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819310735	FG	On-Demand	Mild	CCR8	22	44
C=C(CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819310735	FG	On-Demand	Mild	GPR119	47	51
O=C(O)[C@@H]1CN(C(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)CCO1	ZINC000819310736	FC	On-Demand	Anodyne	SLC18A3	38	41
C=C(CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819310739	FG	On-Demand	Mild	AMY2	43	30
C=C(CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819310739	FG	On-Demand	Mild	CCR8	22	44
C=C(CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819310739	FG	On-Demand	Mild	GPR119	47	51
O=C(O)[C@@H]1CN(C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)CCO1	ZINC000819310745	FC	On-Demand	Anodyne	SLC18A3	38	41
O=C(O)[C@@H]1CN(C(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)CCO1	ZINC000819310747	FC	On-Demand	Anodyne	SLC18A3	38	41
O=C(O)[C@@H]1CN(C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)CCO1	ZINC000819310748	FC	On-Demand	Anodyne	SLC18A3	38	41
Cc1c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)sc2c1CCCC2	ZINC000819310754	GI	On-Demand	Mild	PAPA1_CARPA	37	42
Cc1c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)sc2c1CCCC2	ZINC000819310760	GI	On-Demand	Mild	PAPA1_CARPA	37	42
COCCc1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819310777	ED	On-Demand	Mild	ADRB2	38	55
COCCc1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819310777	ED	On-Demand	Mild	ADRB1	65	55
COCCc1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819310777	ED	On-Demand	Mild	ADRB3	42	45
COCCc1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819310779	ED	On-Demand	Mild	ADRB2	38	55
COCCc1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819310779	ED	On-Demand	Mild	ADRB1	65	55
COCCc1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819310779	ED	On-Demand	Mild	ADRB3	42	45
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819310790	GD	On-Demand	Anodyne	ADRB3	24	40
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819310792	GD	On-Demand	Anodyne	ADRB3	24	40
COCC(C)(C)CCCNC[C@H](O)c1cccc(F)c1	ZINC000819310794	CF	On-Demand	Anodyne	ADRB1	33	42
COCC(C)(C)CCCNC[C@H](O)c1cccc(F)c1	ZINC000819310794	CF	On-Demand	Anodyne	ADRB3	39	42
COCC(C)(C)CCCNC[C@@H](O)c1cccc(F)c1	ZINC000819310795	CF	On-Demand	Anodyne	ADRB1	33	42
COCC(C)(C)CCCNC[C@@H](O)c1cccc(F)c1	ZINC000819310795	CF	On-Demand	Anodyne	ADRB3	39	42
COCC(C)(C)CCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819310868	DF	On-Demand	Bother	CACNA1C	43	35
COCC(C)(C)CCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819310868	DF	On-Demand	Bother	ADRB3	40	38
COCC(C)(C)CCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819310868	DF	On-Demand	Bother	CACNA1D	67	35
COCC(C)(C)CCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819310869	DF	On-Demand	Bother	CACNA1C	43	35
COCC(C)(C)CCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819310869	DF	On-Demand	Bother	ADRB3	40	38
COCC(C)(C)CCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819310869	DF	On-Demand	Bother	CACNA1D	67	35
N#Cc1ccc(CNC[C@H](O)COc2ccccc2C(F)(F)F)nc1	ZINC000819310882	FF	On-Demand	Mild	ADRB2	17	40
N#Cc1ccc(CNC[C@H](O)COc2ccccc2C(F)(F)F)nc1	ZINC000819310882	FF	On-Demand	Mild	ADRB1	59	40
COCCCONCCC(=O)Nc1cccc(Cl)c1	ZINC000819310903	CE	On-Demand	Anodyne	CPT1A	45	32
COCCCONCCC(=O)Nc1cccc(Cl)c1	ZINC000819310903	CE	On-Demand	Anodyne	TAAR1	15	40
COCCCONCCC(=O)Nc1cccc(Cl)c1	ZINC000819310903	CE	On-Demand	Anodyne	KCNK3	47	39
COCCCONCCC(=O)Nc1cccc(Cl)c1	ZINC000819310903	CE	On-Demand	Anodyne	KCNK9	44	39
C[S@@](=O)Cc1ccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819310906	FG	On-Demand	Anodyne	CCR2	21	42
C[S@](=O)Cc1ccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819310907	FG	On-Demand	Anodyne	CCR2	21	42
C[S@](=O)Cc1ccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819310908	FG	On-Demand	Anodyne	CCR2	21	42
C[S@@](=O)Cc1ccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819310909	FG	On-Demand	Anodyne	CCR2	21	42
N#CCNC(=O)CNC[C@@H](O)c1ccc(F)cc1	ZINC000819310910	CC	On-Demand	Mild	CTSK	18	42
N#CCNC(=O)CNC[C@@H](O)c1ccc(F)cc1	ZINC000819310910	CC	On-Demand	Mild	CTSL	15	42
N#CCNC(=O)CNC[C@H](O)c1ccc(F)cc1	ZINC000819310911	CC	On-Demand	Mild	CTSK	18	42
N#CCNC(=O)CNC[C@H](O)c1ccc(F)cc1	ZINC000819310911	CC	On-Demand	Mild	CTSL	15	42
N#Cc1ccc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)nc1	ZINC000819310949	FF	On-Demand	Mild	ADRB2	17	40
N#Cc1ccc(CNC[C@@H](O)COc2ccccc2C(F)(F)F)nc1	ZINC000819310949	FF	On-Demand	Mild	ADRB1	59	40
O[C@@H](CNCc1cc(F)c(C(F)(F)F)cc1F)c1cccnc1	ZINC000819311027	EG	On-Demand	Anodyne	ADRB1	22	42
O[C@@H](CNCc1cc(F)c(C(F)(F)F)cc1F)c1cccnc1	ZINC000819311027	EG	On-Demand	Anodyne	ADRB3	87	42
O[C@H](CNCc1cc(F)c(C(F)(F)F)cc1F)c1cccnc1	ZINC000819311028	EG	On-Demand	Anodyne	ADRB1	22	42
O[C@H](CNCc1cc(F)c(C(F)(F)F)cc1F)c1cccnc1	ZINC000819311028	EG	On-Demand	Anodyne	ADRB3	87	42
C[C@@H](NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1nccn1-c1ccccc1	ZINC000819311042	GF	On-Demand	Anodyne	ADRB3	15	40
C[C@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1nccn1-c1ccccc1	ZINC000819311044	GF	On-Demand	Anodyne	ADRB3	15	40
N#CCNC(=O)CNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819311052	DC	On-Demand	Mild	CCR2	65	41
N#CCNC(=O)CNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819311052	DC	On-Demand	Mild	PDS	41	32
N#CCNC(=O)CNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819311054	DC	On-Demand	Mild	CCR2	65	41
N#CCNC(=O)CNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819311054	DC	On-Demand	Mild	PDS	41	32
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCN(S(=O)(=O)c3ccccc3)C2)c1	ZINC000819311064	GD	On-Demand	Bother	ADRB3	33	49
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCN(S(=O)(=O)c3ccccc3)C2)c1	ZINC000819311067	GD	On-Demand	Bother	ADRB3	33	49
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)C2CC2)C1	ZINC000819311121	DC	On-Demand	Anodyne	TGM2	43	41
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)C2CC2)C1	ZINC000819311121	DC	On-Demand	Anodyne	F13A1	27	41
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)C2CC2)C1	ZINC000819311121	DC	On-Demand	Anodyne	SFRP1	51	40
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)C2CC2)C1	ZINC000819311124	DC	On-Demand	Anodyne	TGM2	43	41
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)C2CC2)C1	ZINC000819311124	DC	On-Demand	Anodyne	F13A1	27	41
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)C2CC2)C1	ZINC000819311124	DC	On-Demand	Anodyne	SFRP1	51	40
N#CCNC(=O)CNC[C@@H](O)c1cccc(F)c1	ZINC000819311126	CC	On-Demand	Mild	ADRB1	19	41
N#CCNC(=O)CNC[C@@H](O)c1cccc(F)c1	ZINC000819311126	CC	On-Demand	Mild	ADRB3	25	41
N#CCNC(=O)CNC[C@@H](O)c1cccc(F)c1	ZINC000819311126	CC	On-Demand	Mild	PAPA1_CARPA	18	40
N#CCNC(=O)CNC[C@@H](O)c1cccc(F)c1	ZINC000819311126	CC	On-Demand	Mild	CTSK	21	41
N#CCNC(=O)CNC[C@@H](O)c1cccc(F)c1	ZINC000819311126	CC	On-Demand	Mild	CTSL	21	40
N#CCNC(=O)CNC[C@@H](O)c1cccc(F)c1	ZINC000819311126	CC	On-Demand	Mild	CTSS	15	41
N#CCNC(=O)CNC[C@H](O)c1cccc(F)c1	ZINC000819311135	CC	On-Demand	Mild	ADRB1	19	41
N#CCNC(=O)CNC[C@H](O)c1cccc(F)c1	ZINC000819311135	CC	On-Demand	Mild	ADRB3	25	41
N#CCNC(=O)CNC[C@H](O)c1cccc(F)c1	ZINC000819311135	CC	On-Demand	Mild	PAPA1_CARPA	18	40
N#CCNC(=O)CNC[C@H](O)c1cccc(F)c1	ZINC000819311135	CC	On-Demand	Mild	CTSK	21	41
N#CCNC(=O)CNC[C@H](O)c1cccc(F)c1	ZINC000819311135	CC	On-Demand	Mild	CTSL	21	40
N#CCNC(=O)CNC[C@H](O)c1cccc(F)c1	ZINC000819311135	CC	On-Demand	Mild	CTSS	15	41
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCSCC3)cc2)c1	ZINC000819311153	GF	On-Demand	Anodyne	DRD4	48	40
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCSCC3)cc2)c1	ZINC000819311153	GF	On-Demand	Anodyne	PRNP	40	33
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCSCC3)cc2)c1	ZINC000819311153	GF	On-Demand	Anodyne	MTNR1A	23	44
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCSCC3)cc2)c1	ZINC000819311153	GF	On-Demand	Anodyne	MTNR1B	29	44
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCSCC3)cc2)c1	ZINC000819311153	GF	On-Demand	Anodyne	ACR	27	42
C[S@@](=O)Cc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819311165	EE	On-Demand	Bother	CACNA1D	51	32
C[S@@](=O)Cc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819311168	EE	On-Demand	Bother	CACNA1D	51	32
C[S@](=O)Cc1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819311170	EE	On-Demand	Bother	CACNA1D	51	32
C[S@](=O)Cc1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819311172	EE	On-Demand	Bother	CACNA1D	51	32
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1c(F)cncc1F	ZINC000819311217	GG	On-Demand	Anodyne	GPR119	59	50
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1c(F)cncc1F	ZINC000819311220	GG	On-Demand	Anodyne	GPR119	59	50
CC(C)(C)OC(=O)N1CCCc2c(CNC[C@H](O)c3ccccc3)cccc21	ZINC000819311246	GI	On-Demand	Anodyne	KCNQ2	52	34
CC(C)(C)OC(=O)N1CCCc2c(CNC[C@@H](O)c3ccccc3)cccc21	ZINC000819311249	GI	On-Demand	Anodyne	KCNQ2	52	34
N#Cc1ccc(CNC[C@H](O)COc2cccc(Br)c2)nc1	ZINC000819311300	FE	On-Demand	Mild	ADRB1	49	36
N#Cc1ccc(CNC[C@@H](O)COc2cccc(Br)c2)nc1	ZINC000819311303	FE	On-Demand	Mild	ADRB1	49	36
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCCC2(F)F)CC1	ZINC000819311306	EF	On-Demand	Anodyne	GPR119	27	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCCC2(F)F)CC1	ZINC000819311308	EF	On-Demand	Anodyne	GPR119	27	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCCC2(F)F)CC1	ZINC000819311310	EF	On-Demand	Anodyne	GPR119	27	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCCC2(F)F)CC1	ZINC000819311312	EF	On-Demand	Anodyne	GPR119	27	42
CCOc1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819311318	ED	On-Demand	Mild	ADRB2	35	42
CCOc1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819311318	ED	On-Demand	Mild	ADRB1	49	42
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819311321	GD	On-Demand	Anodyne	SFRP1	111	36
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819311321	GD	On-Demand	Anodyne	WNT3	74	36
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819311322	GD	On-Demand	Anodyne	SFRP1	111	36
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819311322	GD	On-Demand	Anodyne	WNT3	74	36
CCOc1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819311324	ED	On-Demand	Mild	ADRB2	35	42
CCOc1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819311324	ED	On-Demand	Mild	ADRB1	49	42
N#CCNC(=O)CNC[C@@H](O)c1cccc(Br)c1	ZINC000819311353	DC	On-Demand	Mild	PAPA1_CARPA	18	40
N#CCNC(=O)CNC[C@@H](O)c1cccc(Br)c1	ZINC000819311353	DC	On-Demand	Mild	CTSK	21	45
N#CCNC(=O)CNC[C@@H](O)c1cccc(Br)c1	ZINC000819311353	DC	On-Demand	Mild	CTSL	19	40
N#CCNC(=O)CNC[C@H](O)c1cccc(Br)c1	ZINC000819311355	DC	On-Demand	Mild	PAPA1_CARPA	18	40
N#CCNC(=O)CNC[C@H](O)c1cccc(Br)c1	ZINC000819311355	DC	On-Demand	Mild	CTSK	21	45
N#CCNC(=O)CNC[C@H](O)c1cccc(Br)c1	ZINC000819311355	DC	On-Demand	Mild	CTSL	19	40
COCC(C)(C)CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819311371	CG	On-Demand	Anodyne	ADRB2	55	41
COCC(C)(C)CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819311371	CG	On-Demand	Anodyne	ADRB1	60	50
COCC(C)(C)CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819311371	CG	On-Demand	Anodyne	ADRB3	73	50
COCC(C)(C)CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819311374	CG	On-Demand	Anodyne	ADRB2	55	41
COCC(C)(C)CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819311374	CG	On-Demand	Anodyne	ADRB1	60	50
COCC(C)(C)CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819311374	CG	On-Demand	Anodyne	ADRB3	73	50
COCCCONCCC(=O)Nc1cccnc1	ZINC000819311401	CC	On-Demand	Anodyne	NAMPT	24	41
O[C@H](CNCCC1(F)CCC1)c1cccc(Cl)c1	ZINC000819311460	CG	On-Demand	Anodyne	ADRB2	44	39
O[C@H](CNCCC1(F)CCC1)c1cccc(Cl)c1	ZINC000819311460	CG	On-Demand	Anodyne	ADRB1	53	49
O[C@H](CNCCC1(F)CCC1)c1cccc(Cl)c1	ZINC000819311460	CG	On-Demand	Anodyne	ADRB3	62	49
O[C@@H](CNCCC1(F)CCC1)c1cccc(Cl)c1	ZINC000819311461	CG	On-Demand	Anodyne	ADRB2	44	39
O[C@@H](CNCCC1(F)CCC1)c1cccc(Cl)c1	ZINC000819311461	CG	On-Demand	Anodyne	ADRB1	53	49
O[C@@H](CNCCC1(F)CCC1)c1cccc(Cl)c1	ZINC000819311461	CG	On-Demand	Anodyne	ADRB3	62	49
C=C(CNC[C@H](O)c1cc(C)cc(C)c1)c1ccccc1	ZINC000819311509	CH	On-Demand	Mild	AOC3	38	43
COCCCONCCC(=O)Nc1ccccc1	ZINC000819311510	CD	On-Demand	Anodyne	CPT1A	44	31
COCCCONCCC(=O)Nc1ccccc1	ZINC000819311510	CD	On-Demand	Anodyne	HDAC8	16	47
COCCCONCCC(=O)Nc1ccccc1	ZINC000819311510	CD	On-Demand	Anodyne	HDAC10	24	47
COCCCONCCC(=O)Nc1ccccc1	ZINC000819311510	CD	On-Demand	Anodyne	HDAC1	16	47
COCCCONCCC(=O)Nc1ccccc1	ZINC000819311510	CD	On-Demand	Anodyne	HDAC2	21	47
COCCCONCCC(=O)Nc1ccccc1	ZINC000819311510	CD	On-Demand	Anodyne	HDAC3	19	47
COCCCONCCC(=O)Nc1ccccc1	ZINC000819311510	CD	On-Demand	Anodyne	HDAC6	20	47
COCCCONCCC(=O)Nc1ccccc1	ZINC000819311510	CD	On-Demand	Anodyne	HDAC11	17	47
C=C(CNC[C@@H](O)c1cc(C)cc(C)c1)c1ccccc1	ZINC000819311512	CH	On-Demand	Mild	AOC3	38	43
O=C(/C=C\[C@@H]1CCCO1)NCc1coc(-c2ccccc2)n1	ZINC000819311550	CF	On-Demand	Anodyne	PDE8B	47	34
O=C(/C=C/[C@@H]1CCCO1)NCc1coc(-c2ccccc2)n1	ZINC000819311553	CF	On-Demand	Anodyne	PDE8B	47	34
O=C(/C=C\[C@H]1CCCO1)NCc1coc(-c2ccccc2)n1	ZINC000819311556	CF	On-Demand	Anodyne	PDE8B	47	34
O=C(/C=C/[C@H]1CCCO1)NCc1coc(-c2ccccc2)n1	ZINC000819311558	CF	On-Demand	Anodyne	PDE8B	47	34
N#CCNC(=O)CNC[C@@H](O)c1ccc(Br)cc1	ZINC000819311605	DC	On-Demand	Mild	CTSK	15	43
N#CCNC(=O)CNC[C@H](O)c1ccc(Br)cc1	ZINC000819311606	DC	On-Demand	Mild	CTSK	15	43
Cc1cccc([C@@H](C)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819311611	FH	On-Demand	Mild	CTSB	26	43
Cc1cccc([C@@H](C)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819311611	FH	On-Demand	Mild	PAPA1_CARPA	54	48
Cc1cccc([C@@H](C)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819311611	FH	On-Demand	Mild	CTSK	34	47
Cc1cccc([C@@H](C)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819311611	FH	On-Demand	Mild	CTSL	42	48
Cc1cccc([C@@H](C)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819311611	FH	On-Demand	Mild	CTSS	33	51
Cc1cccc([C@@H](C)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819311611	FH	On-Demand	Mild	FPR1	45	39
Cc1cccc([C@@H](C)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819311613	FH	On-Demand	Mild	CTSB	26	43
Cc1cccc([C@@H](C)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819311613	FH	On-Demand	Mild	PAPA1_CARPA	54	48
Cc1cccc([C@@H](C)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819311613	FH	On-Demand	Mild	CTSK	34	47
Cc1cccc([C@@H](C)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819311613	FH	On-Demand	Mild	CTSL	42	48
Cc1cccc([C@@H](C)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819311613	FH	On-Demand	Mild	CTSS	33	51
Cc1cccc([C@@H](C)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819311613	FH	On-Demand	Mild	FPR1	45	39
COCCCONC[C@H](O)CN1CCc2ccccc2C1	ZINC000819311614	CC	On-Demand	Anodyne	NOD2	42	37
COCCCONC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819311615	CC	On-Demand	Anodyne	NOD2	42	37
C=CCC1(C(=O)Nc2ccc(N3CCSCC3)cc2)CCOCC1	ZINC000819311624	EH	On-Demand	Mild	STAT6	50	31
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](O)CC1	ZINC000819311635	FG	On-Demand	Anodyne	KCNH2	16	41
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](O)CC1	ZINC000819311635	FG	On-Demand	Anodyne	ADAM17	27	43
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](O)CC1	ZINC000819311635	FG	On-Demand	Anodyne	PREP	50	38
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](O)CC1	ZINC000819311635	FG	On-Demand	Anodyne	DPP7	20	43
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](O)CC1	ZINC000819311635	FG	On-Demand	Anodyne	FFAR1	34	41
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](O)CC1	ZINC000819311635	FG	On-Demand	Anodyne	SLC12A5	42	36
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](O)CC1	ZINC000819311636	FG	On-Demand	Anodyne	KCNH2	16	41
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](O)CC1	ZINC000819311636	FG	On-Demand	Anodyne	ADAM17	27	43
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](O)CC1	ZINC000819311636	FG	On-Demand	Anodyne	PREP	50	38
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](O)CC1	ZINC000819311636	FG	On-Demand	Anodyne	DPP7	20	43
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](O)CC1	ZINC000819311636	FG	On-Demand	Anodyne	FFAR1	34	41
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](O)CC1	ZINC000819311636	FG	On-Demand	Anodyne	SLC12A5	42	36
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](O)CC1	ZINC000819311637	FG	On-Demand	Anodyne	KCNH2	16	41
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](O)CC1	ZINC000819311637	FG	On-Demand	Anodyne	ADAM17	27	43
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](O)CC1	ZINC000819311637	FG	On-Demand	Anodyne	PREP	50	38
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](O)CC1	ZINC000819311637	FG	On-Demand	Anodyne	DPP7	20	43
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](O)CC1	ZINC000819311637	FG	On-Demand	Anodyne	FFAR1	34	41
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@H](O)CC1	ZINC000819311637	FG	On-Demand	Anodyne	SLC12A5	42	36
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](O)CC1	ZINC000819311639	FG	On-Demand	Anodyne	KCNH2	16	41
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](O)CC1	ZINC000819311639	FG	On-Demand	Anodyne	ADAM17	27	43
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](O)CC1	ZINC000819311639	FG	On-Demand	Anodyne	PREP	50	38
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](O)CC1	ZINC000819311639	FG	On-Demand	Anodyne	DPP7	20	43
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](O)CC1	ZINC000819311639	FG	On-Demand	Anodyne	FFAR1	34	41
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H](O)CC1	ZINC000819311639	FG	On-Demand	Anodyne	SLC12A5	42	36
O=C(COc1ccc2ccc(=O)oc2c1)N1CCOC[C@@H]1CC1CCC1	ZINC000819311666	FF	On-Demand	Anodyne	CPT1A	56	35
O=C(COc1ccc2ccc(=O)oc2c1)N1CCOC[C@H]1CC1CCC1	ZINC000819311668	FF	On-Demand	Anodyne	CPT1A	56	35
O=C(c1ccc(CS(=O)(=O)C(F)F)cc1)N1CCC[C@@H](O)CC1	ZINC000819311674	ED	On-Demand	Anodyne	L3MBTL3	92	45
O=C(c1ccc(CS(=O)(=O)C(F)F)cc1)N1CCC[C@H](O)CC1	ZINC000819311676	ED	On-Demand	Anodyne	L3MBTL3	92	45
N#Cc1cccc(OCC(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819311692	CD	On-Demand	Mild	HTR1D	15	41
N#Cc1cccc(OCC(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819311692	CD	On-Demand	Mild	HTR1B	17	41
N#Cc1cccc(OCC(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819311692	CD	On-Demand	Mild	CPT1A	113	48
N#Cc1cccc(OCC(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819311692	CD	On-Demand	Mild	CPT2	47	38
N#Cc1cccc(OCC(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819311692	CD	On-Demand	Mild	CHRNA10	71	52
N#Cc1cccc(OCC(=O)N2CCC[C@H](O)CC2)c1	ZINC000819311694	CD	On-Demand	Mild	HTR1D	15	41
N#Cc1cccc(OCC(=O)N2CCC[C@H](O)CC2)c1	ZINC000819311694	CD	On-Demand	Mild	HTR1B	17	41
N#Cc1cccc(OCC(=O)N2CCC[C@H](O)CC2)c1	ZINC000819311694	CD	On-Demand	Mild	CPT1A	113	48
N#Cc1cccc(OCC(=O)N2CCC[C@H](O)CC2)c1	ZINC000819311694	CD	On-Demand	Mild	CPT2	47	38
N#Cc1cccc(OCC(=O)N2CCC[C@H](O)CC2)c1	ZINC000819311694	CD	On-Demand	Mild	CHRNA10	71	52
O=C(c1ccc(-n2cnc3ccccc32)nc1)N1CCOC[C@H]1CC1CCC1	ZINC000819311773	GG	On-Demand	Anodyne	HPGD	42	35
O=C(c1ccc(-n2cnc3ccccc32)nc1)N1CCOC[C@@H]1CC1CCC1	ZINC000819311775	GG	On-Demand	Anodyne	HPGD	42	35
O=C(c1cc(-c2ccc(Br)cc2)nc2ccccc12)N1CCC[C@H](O)CC1	ZINC000819311790	IJ	On-Demand	Anodyne	PRS	98	62
O=C(c1cc(-c2ccc(Br)cc2)nc2ccccc12)N1CCC[C@H](O)CC1	ZINC000819311790	IJ	On-Demand	Anodyne	MT-CO2	52	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(C#N)cn1	ZINC000819311793	GF	On-Demand	Mild	CTSD	55	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(C#N)cn1	ZINC000819311793	GF	On-Demand	Mild	PGC	54	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(C#N)cn1	ZINC000819311793	GF	On-Demand	Mild	PAPA1_CARPA	50	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(C#N)cn1	ZINC000819311793	GF	On-Demand	Mild	REN	74	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(C#N)cn1	ZINC000819311793	GF	On-Demand	Mild	REN1	18	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(C#N)cn1	ZINC000819311793	GF	On-Demand	Mild	BACE1	55	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(C#N)cn1	ZINC000819311793	GF	On-Demand	Mild	FPR1	45	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(C#N)cn1	ZINC000819311793	GF	On-Demand	Mild	CTRB_BOVIN	59	35
O=C(c1cc(-c2ccc(Br)cc2)nc2ccccc12)N1CCC[C@@H](O)CC1	ZINC000819311794	IJ	On-Demand	Anodyne	PRS	98	62
O=C(c1cc(-c2ccc(Br)cc2)nc2ccccc12)N1CCC[C@@H](O)CC1	ZINC000819311794	IJ	On-Demand	Anodyne	MT-CO2	52	44
C=C(CNC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccccc1	ZINC000819311796	GE	On-Demand	Mild	HTR1A	20	41
C=C(CNC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccccc1	ZINC000819311796	GE	On-Demand	Mild	DRD4	45	38
C=C(CNC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccccc1	ZINC000819311796	GE	On-Demand	Mild	HTR2A	16	45
C=C(CNC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccccc1	ZINC000819311796	GE	On-Demand	Mild	DRD3	15	41
C=C(CNC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccccc1	ZINC000819311796	GE	On-Demand	Mild	ABCB1	56	46
C=C(CNC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccccc1	ZINC000819311801	GE	On-Demand	Mild	HTR1A	20	41
C=C(CNC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccccc1	ZINC000819311801	GE	On-Demand	Mild	DRD4	45	38
C=C(CNC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccccc1	ZINC000819311801	GE	On-Demand	Mild	HTR2A	16	45
C=C(CNC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccccc1	ZINC000819311801	GE	On-Demand	Mild	DRD3	15	41
C=C(CNC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1)c1ccccc1	ZINC000819311801	GE	On-Demand	Mild	ABCB1	56	46
N#Cc1ccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])nc1	ZINC000819311815	ED	On-Demand	Mild	ADRB1	59	42
N#Cc1ccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])nc1	ZINC000819311819	ED	On-Demand	Mild	ADRB1	59	42
C[C@@H](NC[C@@H](O)c1cccnc1)c1c(F)cncc1F	ZINC000819311829	CE	On-Demand	Anodyne	ADRB1	21	48
C[C@@H](NC[C@@H](O)c1cccnc1)c1c(F)cncc1F	ZINC000819311829	CE	On-Demand	Anodyne	ADRB3	73	48
C[C@H](NC[C@H](O)c1cccnc1)c1c(F)cncc1F	ZINC000819311833	CE	On-Demand	Anodyne	ADRB1	21	48
C[C@H](NC[C@H](O)c1cccnc1)c1c(F)cncc1F	ZINC000819311833	CE	On-Demand	Anodyne	ADRB3	73	48
O=S1(=O)CCC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819311839	DD	On-Demand	Anodyne	ADRB1	41	43
O=S1(=O)CCC[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819311839	DD	On-Demand	Anodyne	ADRB3	49	43
O=S1(=O)CCC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819311842	DD	On-Demand	Anodyne	ADRB1	41	43
O=S1(=O)CCC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819311842	DD	On-Demand	Anodyne	ADRB3	49	43
O=S1(=O)CCC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819311844	DD	On-Demand	Anodyne	ADRB1	41	43
O=S1(=O)CCC[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819311844	DD	On-Demand	Anodyne	ADRB3	49	43
O=S1(=O)CCC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819311847	DD	On-Demand	Anodyne	ADRB1	41	43
O=S1(=O)CCC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819311847	DD	On-Demand	Anodyne	ADRB3	49	43
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819311865	FD	On-Demand	Anodyne	ADRB3	25	43
Cc1ccccc1[C@@H](O)CNCC(=O)NCC#N	ZINC000819311867	BC	On-Demand	Mild	CTSL	20	40
Cc1ccccc1[C@@H](O)CNCC(=O)NCC#N	ZINC000819311867	BC	On-Demand	Mild	CTSS	15	40
C[C@H]1CC[C@H]1NC[C@H](O)c1ccccc1Cl	ZINC000819311885	BF	On-Demand	Anodyne	OPRL1	42	42
C[C@H]1CC[C@@H]1NC[C@H](O)c1ccccc1Cl	ZINC000819311887	BF	On-Demand	Anodyne	OPRL1	42	42
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCSCC2)cc1	ZINC000819311891	DI	On-Demand	Anodyne	MTOR	33	41
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCSCC2)cc1	ZINC000819311892	DI	On-Demand	Anodyne	MTOR	33	41
COCCCONCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819311910	DF	On-Demand	Anodyne	HDAC10	15	56
COCCCONCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819311910	DF	On-Demand	Anodyne	KCNK3	44	42
COCCCONCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819311910	DF	On-Demand	Anodyne	KCNK9	40	36
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819311915	EC	On-Demand	Anodyne	ADRB3	18	43
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819311917	EC	On-Demand	Anodyne	ADRB3	18	43
O[C@H](CNCCC1(F)CCC1)c1cccc(C(F)(F)F)c1	ZINC000819311976	DH	On-Demand	Anodyne	ADRB2	18	46
O[C@@H](CNCCC1(F)CCC1)c1cccc(C(F)(F)F)c1	ZINC000819311977	DH	On-Demand	Anodyne	ADRB2	18	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1coc(-c2ccccc2)n1	ZINC000819311983	FF	On-Demand	Anodyne	PDE8B	65	38
CS(=O)(=O)c1ccc([C@@H](O)CNCCC2(F)CCC2)cc1	ZINC000819311996	DD	On-Demand	Anodyne	ADRB2	19	42
CS(=O)(=O)c1ccc([C@H](O)CNCCC2(F)CCC2)cc1	ZINC000819311997	DD	On-Demand	Anodyne	ADRB2	19	42
CC(C)(C)OC(=O)NC[C@@H](C(=O)N1CCC[C@H](O)CC1)c1ccc(F)cc1	ZINC000819312006	GF	On-Demand	Anodyne	GPR119	18	41
CC(C)(C)OC(=O)NC[C@@H](C(=O)N1CCC[C@@H](O)CC1)c1ccc(F)cc1	ZINC000819312007	GF	On-Demand	Anodyne	GPR119	18	41
CC(C)(C)OC(=O)NC[C@H](C(=O)N1CCC[C@H](O)CC1)c1ccc(F)cc1	ZINC000819312008	GF	On-Demand	Anodyne	GPR119	18	41
CC(C)(C)OC(=O)NC[C@H](C(=O)N1CCC[C@@H](O)CC1)c1ccc(F)cc1	ZINC000819312009	GF	On-Demand	Anodyne	GPR119	18	41
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl)N1CCC[C@H](O)CC1	ZINC000819312016	HF	On-Demand	Anodyne	EPHX2	17	40
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl)N1CCC[C@H](O)CC1	ZINC000819312016	HF	On-Demand	Anodyne	L3MBTL3	70	45
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl)N1CCC[C@@H](O)CC1	ZINC000819312017	HF	On-Demand	Anodyne	EPHX2	17	40
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl)N1CCC[C@@H](O)CC1	ZINC000819312017	HF	On-Demand	Anodyne	L3MBTL3	70	45
CC(C)(C)OC(=O)NCc1cccc(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819312018	EF	On-Demand	Anodyne	PREP	36	43
CC(C)(C)OC(=O)NCc1cccc(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819312018	EF	On-Demand	Anodyne	ST14	50	35
CC(C)(C)OC(=O)NCc1cccc(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819312018	EF	On-Demand	Anodyne	L3MBTL3	55	40
CC(C)(C)OC(=O)NCc1cccc(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819312019	EF	On-Demand	Anodyne	PREP	36	43
CC(C)(C)OC(=O)NCc1cccc(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819312019	EF	On-Demand	Anodyne	ST14	50	35
CC(C)(C)OC(=O)NCc1cccc(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819312019	EF	On-Demand	Anodyne	L3MBTL3	55	40
CN(CC(=O)N1CCC[C@@H](O)CC1)C1=NS(=O)(=O)c2ccccc21	ZINC000819312030	FC	On-Demand	Anodyne	KCNA3	32	41
CN(CC(=O)N1CCC[C@H](O)CC1)C1=NS(=O)(=O)c2ccccc21	ZINC000819312031	FC	On-Demand	Anodyne	KCNA3	32	41
C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819312055	IF	On-Demand	Anodyne	SFRP1	43	33
C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc(F)c(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819312057	IF	On-Demand	Anodyne	SFRP1	43	33
CCn1c(S)nc2cc(C(=O)N3CCC[C@@H](O)CC3)ccc2c1=O	ZINC000819312074	ED	On-Demand	Anodyne	L3MBTL3	66	37
CCn1c(S)nc2cc(C(=O)N3CCC[C@@H](O)CC3)ccc2c1=O	ZINC000819312074	ED	On-Demand	Anodyne	HPGD	45	36
CCn1c(S)nc2cc(C(=O)N3CCC[C@H](O)CC3)ccc2c1=O	ZINC000819312075	ED	On-Demand	Anodyne	L3MBTL3	66	37
CCn1c(S)nc2cc(C(=O)N3CCC[C@H](O)CC3)ccc2c1=O	ZINC000819312075	ED	On-Demand	Anodyne	HPGD	45	36
Cc1nn(-c2ccccc2)c2ncc(C(=O)N3CCC[C@H](O)CC3)cc12	ZINC000819312082	FF	On-Demand	Anodyne	L3MBTL3	46	34
Cc1nn(-c2ccccc2)c2ncc(C(=O)N3CCC[C@H](O)CC3)cc12	ZINC000819312082	FF	On-Demand	Anodyne	HPGD	46	38
Cc1nn(-c2ccccc2)c2ncc(C(=O)N3CCC[C@@H](O)CC3)cc12	ZINC000819312083	FF	On-Demand	Anodyne	L3MBTL3	46	34
Cc1nn(-c2ccccc2)c2ncc(C(=O)N3CCC[C@@H](O)CC3)cc12	ZINC000819312083	FF	On-Demand	Anodyne	HPGD	46	38
COCC(C)(C)CCCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819312103	EE	On-Demand	Anodyne	ADRB2	21	44
COCC(C)(C)CCCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819312104	EE	On-Demand	Anodyne	ADRB2	21	44
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCc2ccc(C#N)cn2)CC1	ZINC000819312154	FE	On-Demand	Mild	GPR119	32	42
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCc2ccc(C#N)cn2)CC1	ZINC000819312157	FE	On-Demand	Mild	GPR119	32	42
N#Cc1ccc(CNC[C@H](O)COc2cc(F)cc(Br)c2)nc1	ZINC000819312166	GE	On-Demand	Mild	ADRB1	41	33
N#Cc1ccc(CNC[C@@H](O)COc2cc(F)cc(Br)c2)nc1	ZINC000819312168	GE	On-Demand	Mild	ADRB1	41	33
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819312179	FD	On-Demand	Anodyne	ADRB1	38	49
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819312179	FD	On-Demand	Anodyne	ADRB3	60	51
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819312179	FD	On-Demand	Anodyne	CYP3A4	49	38
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819312181	FD	On-Demand	Anodyne	ADRB1	38	49
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819312181	FD	On-Demand	Anodyne	ADRB3	60	51
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819312181	FD	On-Demand	Anodyne	CYP3A4	49	38
COCC(C)(C)CCCNC[C@H](O)c1ccccc1	ZINC000819312185	CF	On-Demand	Anodyne	ADRB2	27	46
COCC(C)(C)CCCNC[C@H](O)c1ccccc1	ZINC000819312185	CF	On-Demand	Anodyne	ADRB3	45	46
COCC(C)(C)CCCNC[C@@H](O)c1ccccc1	ZINC000819312186	CF	On-Demand	Anodyne	ADRB2	27	46
COCC(C)(C)CCCNC[C@@H](O)c1ccccc1	ZINC000819312186	CF	On-Demand	Anodyne	ADRB3	45	46
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819312234	ED	On-Demand	Mild	ADRB2	43	54
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819312234	ED	On-Demand	Mild	ADRB1	82	54
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819312234	ED	On-Demand	Mild	ADRB3	48	52
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819312240	ED	On-Demand	Mild	ADRB2	43	54
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819312240	ED	On-Demand	Mild	ADRB1	82	54
CC(=O)Nc1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819312240	ED	On-Demand	Mild	ADRB3	48	52
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819312247	ED	On-Demand	Mild	ADRB2	42	43
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819312247	ED	On-Demand	Mild	ADRB1	70	43
COC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819312247	ED	On-Demand	Mild	ADRB3	40	43
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819312253	ED	On-Demand	Mild	ADRB2	42	43
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819312253	ED	On-Demand	Mild	ADRB1	70	43
COC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819312253	ED	On-Demand	Mild	ADRB3	40	43
CSc1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819312277	EE	On-Demand	Mild	ADRB1	45	32
O=C(COc1ccc(C2SCCCS2)cc1)N1CCOC[C@H]1CC1CCC1	ZINC000819312281	HI	On-Demand	Anodyne	CPT1A	69	37
O=C(COc1ccc(C2SCCCS2)cc1)N1CCOC[C@H]1CC1CCC1	ZINC000819312281	HI	On-Demand	Anodyne	CPT2	42	37
Cc1nnc(S)n1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819312282	GD	On-Demand	Mild	PAPA1_CARPA	42	47
CSc1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819312283	EE	On-Demand	Mild	ADRB1	45	32
Cc1nnc(S)n1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819312284	GD	On-Demand	Mild	PAPA1_CARPA	42	47
O=C(COc1ccc(C2SCCCS2)cc1)N1CCOC[C@@H]1CC1CCC1	ZINC000819312290	HI	On-Demand	Anodyne	CPT1A	69	37
O=C(COc1ccc(C2SCCCS2)cc1)N1CCOC[C@@H]1CC1CCC1	ZINC000819312290	HI	On-Demand	Anodyne	CPT2	42	37
O=C(C1=CCCCO1)N1CCC[C@H](O)CC1	ZINC000819312301	BD	On-Demand	Anodyne	L3MBTL3	43	35
O=C(C1=CCCCO1)N1CCC[C@@H](O)CC1	ZINC000819312303	BD	On-Demand	Anodyne	L3MBTL3	43	35
C#CCCCCCC(=O)N1CCC[C@@H](O)CC1	ZINC000819312336	BD	On-Demand	Mild	PREP	20	43
C#CCCCCCC(=O)N1CCC[C@H](O)CC1	ZINC000819312337	BD	On-Demand	Mild	PREP	20	43
CCN(CC)S(=O)(=O)c1cc(C(=O)N2CCC[C@H](O)CC2)ccc1F	ZINC000819312350	FD	On-Demand	Anodyne	L3MBTL3	75	37
CCN(CC)S(=O)(=O)c1cc(C(=O)N2CCC[C@@H](O)CC2)ccc1F	ZINC000819312351	FD	On-Demand	Anodyne	L3MBTL3	75	37
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Br)N1CCC[C@H](O)CC1	ZINC000819312368	IF	On-Demand	Anodyne	L3MBTL3	60	44
O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1Br)N1CCC[C@@H](O)CC1	ZINC000819312369	IF	On-Demand	Anodyne	L3MBTL3	60	44
O=C(c1ccc(-n2cccc2)nc1)N1CCC[C@H](O)CC1	ZINC000819312372	CD	On-Demand	Anodyne	L3MBTL3	87	46
O=C(c1ccc(-n2cccc2)nc1)N1CCC[C@H](O)CC1	ZINC000819312372	CD	On-Demand	Anodyne	HPGD	41	33
O=C(c1ccc(-n2cccc2)nc1)N1CCC[C@@H](O)CC1	ZINC000819312373	CD	On-Demand	Anodyne	L3MBTL3	87	46
O=C(c1ccc(-n2cccc2)nc1)N1CCC[C@@H](O)CC1	ZINC000819312373	CD	On-Demand	Anodyne	HPGD	41	33
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2CCOC[C@@H]2CC2CCC2)C1	ZINC000819312376	GG	On-Demand	Anodyne	GRIN2B	21	42
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2CCOC[C@@H]2CC2CCC2)C1	ZINC000819312376	GG	On-Demand	Anodyne	PREP	41	46
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2CCOC[C@@H]2CC2CCC2)C1	ZINC000819312376	GG	On-Demand	Anodyne	SLC12A5	43	38
O=C(OCc1ccccc1)N1CC[C@@H](C(=O)N2CCOC[C@@H]2CC2CCC2)C1	ZINC000819312377	GG	On-Demand	Anodyne	GRIN2B	21	42
O=C(OCc1ccccc1)N1CC[C@@H](C(=O)N2CCOC[C@@H]2CC2CCC2)C1	ZINC000819312377	GG	On-Demand	Anodyne	PREP	41	46
O=C(OCc1ccccc1)N1CC[C@@H](C(=O)N2CCOC[C@@H]2CC2CCC2)C1	ZINC000819312377	GG	On-Demand	Anodyne	SLC12A5	43	38
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2CCOC[C@H]2CC2CCC2)C1	ZINC000819312378	GG	On-Demand	Anodyne	GRIN2B	21	42
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2CCOC[C@H]2CC2CCC2)C1	ZINC000819312378	GG	On-Demand	Anodyne	PREP	41	46
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2CCOC[C@H]2CC2CCC2)C1	ZINC000819312378	GG	On-Demand	Anodyne	SLC12A5	43	38
O=C(OCc1ccccc1)N1CC[C@@H](C(=O)N2CCOC[C@H]2CC2CCC2)C1	ZINC000819312379	GG	On-Demand	Anodyne	GRIN2B	21	42
O=C(OCc1ccccc1)N1CC[C@@H](C(=O)N2CCOC[C@H]2CC2CCC2)C1	ZINC000819312379	GG	On-Demand	Anodyne	PREP	41	46
O=C(OCc1ccccc1)N1CC[C@@H](C(=O)N2CCOC[C@H]2CC2CCC2)C1	ZINC000819312379	GG	On-Demand	Anodyne	SLC12A5	43	38
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819312409	FC	On-Demand	Anodyne	ADRB3	24	41
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819312410	FC	On-Demand	Anodyne	ADRB3	24	41
COCC(C)(C)CCCNC[C@H](O)c1cccc(Br)c1	ZINC000819312439	EH	On-Demand	Anodyne	ADRB3	40	39
COCC(C)(C)CCCNC[C@@H](O)c1cccc(Br)c1	ZINC000819312440	EH	On-Demand	Anodyne	ADRB3	40	39
COCC(C)(C)CCCNC[C@H](O)c1cccnc1	ZINC000819312455	CE	On-Demand	Anodyne	ADRB2	29	46
COCC(C)(C)CCCNC[C@H](O)c1cccnc1	ZINC000819312455	CE	On-Demand	Anodyne	ADRB1	35	48
COCC(C)(C)CCCNC[C@H](O)c1cccnc1	ZINC000819312455	CE	On-Demand	Anodyne	ADRB3	106	48
COCC(C)(C)CCCNC[C@@H](O)c1cccnc1	ZINC000819312456	CE	On-Demand	Anodyne	ADRB2	29	46
COCC(C)(C)CCCNC[C@@H](O)c1cccnc1	ZINC000819312456	CE	On-Demand	Anodyne	ADRB1	35	48
COCC(C)(C)CCCNC[C@@H](O)c1cccnc1	ZINC000819312456	CE	On-Demand	Anodyne	ADRB3	106	48
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCC[C@@H](O)CC1	ZINC000819312461	FD	On-Demand	Anodyne	CCR8	82	38
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCC[C@@H](O)CC1	ZINC000819312461	FD	On-Demand	Anodyne	SFRP1	142	49
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCC[C@@H](O)CC1	ZINC000819312461	FD	On-Demand	Anodyne	WNT3	93	39
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCC[C@@H](O)CC1	ZINC000819312461	FD	On-Demand	Anodyne	L3MBTL3	77	39
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCC[C@H](O)CC1	ZINC000819312464	FD	On-Demand	Anodyne	CCR8	82	38
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCC[C@H](O)CC1	ZINC000819312464	FD	On-Demand	Anodyne	SFRP1	142	49
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCC[C@H](O)CC1	ZINC000819312464	FD	On-Demand	Anodyne	WNT3	93	39
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CCC[C@H](O)CC1	ZINC000819312464	FD	On-Demand	Anodyne	L3MBTL3	77	39
C[C@H](O)CN(Cc1ccccc1)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819312469	EE	On-Demand	Anodyne	PGC	43	35
C[C@H](O)CN(Cc1ccccc1)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819312469	EE	On-Demand	Anodyne	CTSB	28	44
C[C@H](O)CN(Cc1ccccc1)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819312469	EE	On-Demand	Anodyne	REN	50	38
C[C@H](O)CN(Cc1ccccc1)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819312469	EE	On-Demand	Anodyne	FPR1	48	37
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819312483	FG	On-Demand	Mild	PAPA1_CARPA	44	47
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819312483	FG	On-Demand	Mild	CTSK	20	43
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819312483	FG	On-Demand	Mild	FPR1	43	38
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819312487	FG	On-Demand	Mild	PAPA1_CARPA	44	47
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819312487	FG	On-Demand	Mild	CTSK	20	43
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819312487	FG	On-Demand	Mild	FPR1	43	38
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819312490	FG	On-Demand	Mild	PAPA1_CARPA	44	47
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819312490	FG	On-Demand	Mild	CTSK	20	43
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819312490	FG	On-Demand	Mild	FPR1	43	38
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819312493	FG	On-Demand	Mild	PAPA1_CARPA	44	47
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819312493	FG	On-Demand	Mild	CTSK	20	43
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819312493	FG	On-Demand	Mild	FPR1	43	38
O=C([C@@H]1C[C@@H]1Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819312495	CE	On-Demand	Anodyne	GRIN2B	46	36
O=C([C@@H]1C[C@@H]1Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819312495	CE	On-Demand	Anodyne	CYP51A1	21	40
O=C([C@@H]1C[C@@H]1Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819312495	CE	On-Demand	Anodyne	PREP	90	42
O=C([C@@H]1C[C@H]1Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819312498	CE	On-Demand	Anodyne	GRIN2B	46	36
O=C([C@@H]1C[C@H]1Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819312498	CE	On-Demand	Anodyne	CYP51A1	21	40
O=C([C@@H]1C[C@H]1Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819312498	CE	On-Demand	Anodyne	PREP	90	42
O=C([C@@H]1C[C@@H]1Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819312500	CE	On-Demand	Anodyne	GRIN2B	46	36
O=C([C@@H]1C[C@@H]1Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819312500	CE	On-Demand	Anodyne	CYP51A1	21	40
O=C([C@@H]1C[C@@H]1Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819312500	CE	On-Demand	Anodyne	PREP	90	42
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819312502	EB	On-Demand	Anodyne	ADRB3	97	45
O=C([C@@H]1C[C@H]1Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819312503	CE	On-Demand	Anodyne	GRIN2B	46	36
O=C([C@@H]1C[C@H]1Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819312503	CE	On-Demand	Anodyne	CYP51A1	21	40
O=C([C@@H]1C[C@H]1Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819312503	CE	On-Demand	Anodyne	PREP	90	42
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819312509	EB	On-Demand	Anodyne	ADRB3	97	45
COCCCONC[C@@H](O)c1cccc(Cl)c1	ZINC000819312524	CD	On-Demand	Anodyne	ADRB2	24	43
COCCCONC[C@@H](O)c1cccc(Cl)c1	ZINC000819312524	CD	On-Demand	Anodyne	ADRB1	38	43
COCCCONC[C@@H](O)c1cccc(Cl)c1	ZINC000819312524	CD	On-Demand	Anodyne	ADRB3	47	46
COCCCONC[C@H](O)c1cccc(Cl)c1	ZINC000819312526	CD	On-Demand	Anodyne	ADRB2	24	43
COCCCONC[C@H](O)c1cccc(Cl)c1	ZINC000819312526	CD	On-Demand	Anodyne	ADRB1	38	43
COCCCONC[C@H](O)c1cccc(Cl)c1	ZINC000819312526	CD	On-Demand	Anodyne	ADRB3	47	46
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819312539	EC	On-Demand	Anodyne	ADRB3	39	42
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819312543	EC	On-Demand	Anodyne	ADRB3	39	42
O=Cc1ccccc1OCC(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819312554	DE	On-Demand	Anodyne	CPT1A	42	33
O=Cc1ccccc1OCC(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819312556	DE	On-Demand	Anodyne	CPT1A	42	33
O[C@H](CNCCC1(F)CCC1)c1ccc(Cl)c(F)c1	ZINC000819312586	CG	On-Demand	Anodyne	ADRB2	18	41
O[C@@H](CNCCC1(F)CCC1)c1ccc(Cl)c(F)c1	ZINC000819312589	CG	On-Demand	Anodyne	ADRB2	18	41
O=C(c1cccnc1Cl)N1CCOC[C@H]1CC1CCC1	ZINC000819312622	CF	On-Demand	Anodyne	G2YM83_BOTF4	64	33
O=C(c1cccnc1Cl)N1CCOC[C@@H]1CC1CCC1	ZINC000819312625	CF	On-Demand	Anodyne	G2YM83_BOTF4	64	33
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819312643	EE	On-Demand	Anodyne	SIGMAR1	24	40
O=C(NCC(=O)N1CCOC[C@H]1CC1CCC1)c1ccc(-c2ccccc2)cc1	ZINC000819312644	GH	On-Demand	Anodyne	PREP	17	46
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819312645	EE	On-Demand	Anodyne	SIGMAR1	24	40
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819312646	EE	On-Demand	Anodyne	SIGMAR1	24	40
O=C(NCC(=O)N1CCOC[C@@H]1CC1CCC1)c1ccc(-c2ccccc2)cc1	ZINC000819312647	GH	On-Demand	Anodyne	PREP	17	46
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819312648	EE	On-Demand	Anodyne	SIGMAR1	24	40
N#Cc1ccccc1/C=C/C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819312679	DF	On-Demand	Mild	ITGAL	47	34
N#Cc1ccccc1/C=C\C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819312681	DF	On-Demand	Mild	ITGAL	47	34
N#Cc1ccccc1/C=C/C(=O)N1CCOC[C@H]1CC1CCC1	ZINC000819312683	DF	On-Demand	Mild	ITGAL	47	34
N#Cc1ccccc1/C=C\C(=O)N1CCOC[C@@H]1CC1CCC1	ZINC000819312686	DF	On-Demand	Mild	ITGAL	47	34
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](O)CC1)c1ccccc1	ZINC000819312696	EF	On-Demand	Anodyne	F2	20	49
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](O)CC1)c1ccccc1	ZINC000819312696	EF	On-Demand	Anodyne	PLG	20	49
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](O)CC1)c1ccccc1	ZINC000819312696	EF	On-Demand	Anodyne	PRSS1	15	49
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](O)CC1)c1ccccc1	ZINC000819312696	EF	On-Demand	Anodyne	CELA1	18	40
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](O)CC1)c1ccccc1	ZINC000819312696	EF	On-Demand	Anodyne	CMA1	31	40
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](O)CC1)c1ccccc1	ZINC000819312696	EF	On-Demand	Anodyne	TRY1_BOVIN	18	49
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](O)CC1)c1ccccc1	ZINC000819312696	EF	On-Demand	Anodyne	CCKAR	19	43
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](O)CC1)c1ccccc1	ZINC000819312696	EF	On-Demand	Anodyne	REN	52	37
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](O)CC1)c1ccccc1	ZINC000819312696	EF	On-Demand	Anodyne	MTTP	31	43
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](O)CC1)c1ccccc1	ZINC000819312696	EF	On-Demand	Anodyne	FPR1	44	38
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](O)CC1)c1ccccc1	ZINC000819312696	EF	On-Demand	Anodyne	AMP1_PLAFQ	19	44
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](O)CC1)c1ccccc1	ZINC000819312696	EF	On-Demand	Anodyne	WNT3	41	33
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](O)CC1)c1ccccc1	ZINC000819312697	EF	On-Demand	Anodyne	F2	20	49
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](O)CC1)c1ccccc1	ZINC000819312697	EF	On-Demand	Anodyne	PLG	20	49
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](O)CC1)c1ccccc1	ZINC000819312697	EF	On-Demand	Anodyne	PRSS1	15	49
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](O)CC1)c1ccccc1	ZINC000819312697	EF	On-Demand	Anodyne	CELA1	18	40
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](O)CC1)c1ccccc1	ZINC000819312697	EF	On-Demand	Anodyne	CMA1	31	40
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](O)CC1)c1ccccc1	ZINC000819312697	EF	On-Demand	Anodyne	TRY1_BOVIN	18	49
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](O)CC1)c1ccccc1	ZINC000819312697	EF	On-Demand	Anodyne	CCKAR	19	43
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](O)CC1)c1ccccc1	ZINC000819312697	EF	On-Demand	Anodyne	REN	52	37
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](O)CC1)c1ccccc1	ZINC000819312697	EF	On-Demand	Anodyne	MTTP	31	43
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](O)CC1)c1ccccc1	ZINC000819312697	EF	On-Demand	Anodyne	FPR1	44	38
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](O)CC1)c1ccccc1	ZINC000819312697	EF	On-Demand	Anodyne	AMP1_PLAFQ	19	44
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](O)CC1)c1ccccc1	ZINC000819312697	EF	On-Demand	Anodyne	WNT3	41	33
O=C(/C=C/c1cccc(F)c1)N1CCOC[C@H]1CC1CCC1	ZINC000819312747	DG	On-Demand	Anodyne	ITGAL	55	30
O=C(/C=C/c1cccc(F)c1)N1CCOC[C@@H]1CC1CCC1	ZINC000819312749	DG	On-Demand	Anodyne	ITGAL	55	30
O=C(/C=C\c1cccc(F)c1)N1CCOC[C@@H]1CC1CCC1	ZINC000819312750	DG	On-Demand	Anodyne	ITGAL	55	30
O=C(/C=C\c1cccc(F)c1)N1CCOC[C@H]1CC1CCC1	ZINC000819312752	DG	On-Demand	Anodyne	ITGAL	55	30
Cn1c(C(=O)N2CCC[C@H](O)CC2)ccc1-c1ccccc1	ZINC000819312761	CF	On-Demand	Anodyne	L3MBTL3	58	37
Cn1c(C(=O)N2CCC[C@@H](O)CC2)ccc1-c1ccccc1	ZINC000819312762	CF	On-Demand	Anodyne	L3MBTL3	58	37
C/C(=C/C(=O)N1CCOC[C@H]1CC1CCC1)c1ccc([N+](=O)[O-])cc1	ZINC000819312805	EG	On-Demand	Bother	SLC27A4	47	30
C/C(=C/C(=O)N1CCOC[C@@H]1CC1CCC1)c1ccc([N+](=O)[O-])cc1	ZINC000819312808	EG	On-Demand	Bother	SLC27A4	47	30
O=C(c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12)N1CCC[C@H](O)CC1	ZINC000819312851	HH	On-Demand	Anodyne	CCKAR	21	44
O=C(c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12)N1CCC[C@H](O)CC1	ZINC000819312851	HH	On-Demand	Anodyne	PRS	31	42
O=C(c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12)N1CCC[C@@H](O)CC1	ZINC000819312854	HH	On-Demand	Anodyne	CCKAR	21	44
O=C(c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12)N1CCC[C@@H](O)CC1	ZINC000819312854	HH	On-Demand	Anodyne	PRS	31	42
COC(=O)N[C@H](CC(C)C)C(=O)N1CCC[C@H](O)CC1	ZINC000819312856	CD	On-Demand	Anodyne	RIR1_HHV11	67	32
COC(=O)N[C@H](CC(C)C)C(=O)N1CCC[C@@H](O)CC1	ZINC000819312859	CD	On-Demand	Anodyne	RIR1_HHV11	67	32
CN(C)S(=O)(=O)c1cc(C(=O)N2CCC[C@@H](O)CC2)ccc1Br	ZINC000819312861	HD	On-Demand	Anodyne	L3MBTL3	83	42
CN(C)S(=O)(=O)c1cc(C(=O)N2CCC[C@H](O)CC2)ccc1Br	ZINC000819312862	HD	On-Demand	Anodyne	L3MBTL3	83	42
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC[C@@H](O)CC3)c2c1	ZINC000819312879	FI	On-Demand	Anodyne	DHODH	22	44
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC[C@@H](O)CC3)c2c1	ZINC000819312879	FI	On-Demand	Anodyne	PRS	60	39
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC[C@@H](O)CC3)c2c1	ZINC000819312879	FI	On-Demand	Anodyne	MT-CO2	53	38
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC[C@@H](O)CC3)c2c1	ZINC000819312879	FI	On-Demand	Anodyne	MAP3K12	29	40
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC[C@H](O)CC3)c2c1	ZINC000819312882	FI	On-Demand	Anodyne	DHODH	22	44
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC[C@H](O)CC3)c2c1	ZINC000819312882	FI	On-Demand	Anodyne	PRS	60	39
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC[C@H](O)CC3)c2c1	ZINC000819312882	FI	On-Demand	Anodyne	MT-CO2	53	38
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CCC[C@H](O)CC3)c2c1	ZINC000819312882	FI	On-Demand	Anodyne	MAP3K12	29	40
COCCCONCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819312901	EE	On-Demand	Anodyne	CYNT	45	50
O=C(C(F)=C1CCC1)N1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000819312905	FH	On-Demand	Anodyne	CCR5	20	52
COCCCONC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819312906	CD	On-Demand	Anodyne	ADRB2	21	63
COCCCONC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819312906	CD	On-Demand	Anodyne	ADRB1	27	63
COCCCONC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819312907	CD	On-Demand	Anodyne	ADRB2	21	63
COCCCONC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819312907	CD	On-Demand	Anodyne	ADRB1	27	63
C[S@@](=O)Cc1ccc(CNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819312919	EF	On-Demand	Anodyne	LEF	46	34
C[S@](=O)Cc1ccc(CNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819312920	EF	On-Demand	Anodyne	LEF	46	34
C[S@](=O)Cc1ccc(CNC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819312921	EF	On-Demand	Anodyne	LEF	46	34
C[S@@](=O)Cc1ccc(CNC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819312922	EF	On-Demand	Anodyne	LEF	46	34
O=C(C(F)=C1CCC1)N1CCN(c2ccc3ccccc3n2)CC1	ZINC000819312935	EG	On-Demand	Anodyne	HTR3A	27	52
O=C(C(F)=C1CCC1)N1CCN(c2ccc3ccccc3n2)CC1	ZINC000819312935	EG	On-Demand	Anodyne	SORD	24	46
COCCCONC[C@@H](O)c1cccnc1	ZINC000819312948	BC	On-Demand	Anodyne	ADRB2	20	43
COCCCONC[C@@H](O)c1cccnc1	ZINC000819312948	BC	On-Demand	Anodyne	ADRB1	22	45
COCCCONC[C@@H](O)c1cccnc1	ZINC000819312948	BC	On-Demand	Anodyne	ADRB3	84	48
COCCCONC[C@H](O)c1cccnc1	ZINC000819312949	BC	On-Demand	Anodyne	ADRB2	20	43
COCCCONC[C@H](O)c1cccnc1	ZINC000819312949	BC	On-Demand	Anodyne	ADRB1	22	45
COCCCONC[C@H](O)c1cccnc1	ZINC000819312949	BC	On-Demand	Anodyne	ADRB3	84	48
O=C(/C=C\[C@@H]1CCCO1)N1CCN(c2ccc3ccccc3n2)CC1	ZINC000819312958	EF	On-Demand	Anodyne	HTR3A	23	47
O=C(/C=C\[C@@H]1CCCO1)N1CCN(c2ccc3ccccc3n2)CC1	ZINC000819312958	EF	On-Demand	Anodyne	SMO	40	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(c2ccc3ccccc3n2)CC1	ZINC000819312959	EF	On-Demand	Anodyne	HTR3A	23	47
O=C(/C=C\[C@H]1CCCO1)N1CCN(c2ccc3ccccc3n2)CC1	ZINC000819312959	EF	On-Demand	Anodyne	SMO	40	42
O=C(/C=C/[C@H]1CCCO1)N1CCN(c2ccc3ccccc3n2)CC1	ZINC000819312960	EF	On-Demand	Anodyne	HTR3A	23	47
O=C(/C=C/[C@H]1CCCO1)N1CCN(c2ccc3ccccc3n2)CC1	ZINC000819312960	EF	On-Demand	Anodyne	SMO	40	42
O=C(/C=C/[C@@H]1CCCO1)N1CCN(c2ccc3ccccc3n2)CC1	ZINC000819312961	EF	On-Demand	Anodyne	HTR3A	23	47
O=C(/C=C/[C@@H]1CCCO1)N1CCN(c2ccc3ccccc3n2)CC1	ZINC000819312961	EF	On-Demand	Anodyne	SMO	40	42
O=C(C1=NO[C@@H](c2ccccc2)C1)N1CCC[C@H](O)CC1	ZINC000819313004	CD	On-Demand	Anodyne	L3MBTL3	57	37
O=C(C1=NO[C@H](c2ccccc2)C1)N1CCC[C@@H](O)CC1	ZINC000819313005	CD	On-Demand	Anodyne	L3MBTL3	57	37
O=C(C1=NO[C@@H](c2ccccc2)C1)N1CCC[C@@H](O)CC1	ZINC000819313006	CD	On-Demand	Anodyne	L3MBTL3	57	37
O=C(C1=NO[C@H](c2ccccc2)C1)N1CCC[C@H](O)CC1	ZINC000819313007	CD	On-Demand	Anodyne	L3MBTL3	57	37
O=C(c1ccc(S(F)(F)(F)(F)F)cc1)N1CCC[C@@H](O)CC1	ZINC000819313008	EI	On-Demand	Reactive	MLYCD	20	44
O=C(c1ccc(S(F)(F)(F)(F)F)cc1)N1CCC[C@@H](O)CC1	ZINC000819313008	EI	On-Demand	Reactive	L3MBTL3	101	51
O=C(c1ccc(S(F)(F)(F)(F)F)cc1)N1CCC[C@H](O)CC1	ZINC000819313009	EI	On-Demand	Reactive	MLYCD	20	44
O=C(c1ccc(S(F)(F)(F)(F)F)cc1)N1CCC[C@H](O)CC1	ZINC000819313009	EI	On-Demand	Reactive	L3MBTL3	101	51
O=C(CCCn1ccccc1=O)N1CCC[C@@H](O)CC1	ZINC000819313014	CD	On-Demand	Anodyne	PREP	56	40
O=C(CCCn1ccccc1=O)N1CCC[C@@H](O)CC1	ZINC000819313014	CD	On-Demand	Anodyne	DUT	23	43
O=C(CCCn1ccccc1=O)N1CCC[C@H](O)CC1	ZINC000819313015	CD	On-Demand	Anodyne	PREP	56	40
O=C(CCCn1ccccc1=O)N1CCC[C@H](O)CC1	ZINC000819313015	CD	On-Demand	Anodyne	DUT	23	43
C#CCNS(=O)(=O)c1cccc(C(=O)N2CCOC[C@@H]2CC2CCC2)c1	ZINC000819313022	GD	On-Demand	Mild	SFRP1	76	36
C#CCNS(=O)(=O)c1cccc(C(=O)N2CCOC[C@@H]2CC2CCC2)c1	ZINC000819313022	GD	On-Demand	Mild	WNT3	53	32
C#CCNS(=O)(=O)c1cccc(C(=O)N2CCOC[C@H]2CC2CCC2)c1	ZINC000819313023	GD	On-Demand	Mild	SFRP1	76	36
C#CCNS(=O)(=O)c1cccc(C(=O)N2CCOC[C@H]2CC2CCC2)c1	ZINC000819313023	GD	On-Demand	Mild	WNT3	53	32
COc1cccc(OC)c1OC[C@@H](O)CNCc1ccc(C#N)cn1	ZINC000819313056	ED	On-Demand	Mild	ADRB1	59	37
COc1cccc(OC)c1OC[C@H](O)CNCc1ccc(C#N)cn1	ZINC000819313062	ED	On-Demand	Mild	ADRB1	59	37
COCCCONCCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000819313086	CD	On-Demand	Bother	COLA	48	33
COCC(C)(C)CCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819313125	CG	On-Demand	Anodyne	ADRB2	15	40
COCCCONC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819313163	CD	On-Demand	Bother	CACNA1C	57	39
COCCCONC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819313163	CD	On-Demand	Bother	CACNA1D	85	39
COCCCONC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819313166	CD	On-Demand	Bother	CACNA1C	57	39
COCCCONC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819313166	CD	On-Demand	Bother	CACNA1D	85	39
C[C@@H]1CC[C@H]1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819313193	CE	On-Demand	Bother	CACNA1C	44	38
C[C@@H]1CC[C@H]1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819313193	CE	On-Demand	Bother	CACNA1D	67	34
C[C@@H]1CC[C@H]1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819313196	CE	On-Demand	Bother	CACNA1C	44	38
C[C@@H]1CC[C@H]1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819313196	CE	On-Demand	Bother	CACNA1D	67	34
CC(C)(C)OC(=O)NCC[C@H](O)CNCC(=O)NCC#N	ZINC000819313199	DB	On-Demand	Mild	PAPA1_CARPA	34	45
CC(C)(C)OC(=O)NCC[C@@H](O)CNCC(=O)NCC#N	ZINC000819313203	DB	On-Demand	Mild	PAPA1_CARPA	34	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1coc(-c3ccccc3)n1)C2	ZINC000819313219	FF	On-Demand	Anodyne	PDE8B	66	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1coc(-c3ccccc3)n1)C2	ZINC000819313220	FF	On-Demand	Anodyne	PDE8B	66	38
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(C#N)cn2)CC1	ZINC000819313221	FE	On-Demand	Mild	GPR119	65	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(C#N)cn2)CC1	ZINC000819313222	FE	On-Demand	Mild	GPR119	65	45
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819313238	GD	On-Demand	Anodyne	CACNA1B	49	36
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819313238	GD	On-Demand	Anodyne	CCR2	45	35
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819313239	GD	On-Demand	Anodyne	CACNA1B	49	36
CN(C)S(=O)(=O)N1CCC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819313239	GD	On-Demand	Anodyne	CCR2	45	35
N#Cc1ccc(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)nc1	ZINC000819313254	FF	On-Demand	Mild	ADRB1	49	35
N#Cc1ccc(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)nc1	ZINC000819313254	FF	On-Demand	Mild	PDS	48	39
N#Cc1ccc(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)nc1	ZINC000819313255	FF	On-Demand	Mild	ADRB1	49	35
N#Cc1ccc(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)nc1	ZINC000819313255	FF	On-Demand	Mild	PDS	48	39
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819313267	GF	On-Demand	Anodyne	ADRB3	15	45
C[C@@H](CCOCc1ccccc1)NC[C@@H](O)c1cc2ccccc2o1	ZINC000819313280	EI	On-Demand	Anodyne	ADRB2	19	41
C[C@H](CCOCc1ccccc1)NC[C@@H](O)c1cc2ccccc2o1	ZINC000819313281	EI	On-Demand	Anodyne	ADRB2	19	41
CON(C)C(=O)CCN[C@H]1CCN(S(=O)(=O)c2ccccc2)C1	ZINC000819313287	EC	On-Demand	Anodyne	CCR5	18	40
CON(C)C(=O)CCN[C@H]1CCN(S(=O)(=O)c2ccccc2)C1	ZINC000819313287	EC	On-Demand	Anodyne	TGM2	45	41
CON(C)C(=O)CCN[C@H]1CCN(S(=O)(=O)c2ccccc2)C1	ZINC000819313287	EC	On-Demand	Anodyne	F13A1	29	41
CON(C)C(=O)CCN[C@H]1CCN(S(=O)(=O)c2ccccc2)C1	ZINC000819313287	EC	On-Demand	Anodyne	SFRP1	63	38
N#Cc1ccc(CNC[C@H](O)COc2ccccc2F)nc1	ZINC000819313292	DD	On-Demand	Mild	ADRB2	18	41
N#Cc1ccc(CNC[C@H](O)COc2ccccc2F)nc1	ZINC000819313292	DD	On-Demand	Mild	ADRB1	61	41
N#Cc1ccc(CNC[C@@H](O)COc2ccccc2F)nc1	ZINC000819313293	DD	On-Demand	Mild	ADRB2	18	41
N#Cc1ccc(CNC[C@@H](O)COc2ccccc2F)nc1	ZINC000819313293	DD	On-Demand	Mild	ADRB1	61	41
CC[C@@H](O)CNCc1cccc2c1CCCN2C(=O)OC(C)(C)C	ZINC000819313298	EG	On-Demand	Anodyne	KCNQ2	50	34
CC[C@@H](O)CNCc1cccc2c1CCCN2C(=O)OC(C)(C)C	ZINC000819313298	EG	On-Demand	Anodyne	GPR119	17	43
N#Cc1ccc(CNC[C@H](O)COc2cc(Cl)ccc2Cl)nc1	ZINC000819313299	FF	On-Demand	Mild	ADRB1	49	34
N#Cc1ccc(CNC[C@@H](O)COc2cc(Cl)ccc2Cl)nc1	ZINC000819313300	FF	On-Demand	Mild	ADRB1	49	34
CON(C)C(=O)CCN[C@@H](C)CCOCc1ccccc1	ZINC000819313327	CD	On-Demand	Anodyne	NPR	40	32
CON(C)C(=O)CCN[C@H](C)CCOCc1ccccc1	ZINC000819313328	CD	On-Demand	Anodyne	NPR	40	32
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819313346	ED	On-Demand	Anodyne	ADRB1	21	40
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819313346	ED	On-Demand	Anodyne	ADRB3	42	51
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819313346	ED	On-Demand	Anodyne	TGM2	43	41
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819313346	ED	On-Demand	Anodyne	F13A1	27	41
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819313346	ED	On-Demand	Anodyne	SFRP1	53	40
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819313347	ED	On-Demand	Anodyne	ADRB1	21	40
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819313347	ED	On-Demand	Anodyne	ADRB3	42	51
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819313347	ED	On-Demand	Anodyne	TGM2	43	41
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819313347	ED	On-Demand	Anodyne	F13A1	27	41
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819313347	ED	On-Demand	Anodyne	SFRP1	53	40
O=C(C(F)=C1CCC1)N1CCn2c(CCc3ccccc3)nnc2C1	ZINC000819313349	EF	On-Demand	Anodyne	P2RX7	16	40
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccccc2S(N)(=O)=O)cc1	ZINC000819313350	GC	On-Demand	Anodyne	CA2	23	44
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccccc2S(N)(=O)=O)cc1	ZINC000819313350	GC	On-Demand	Anodyne	ADRB1	15	45
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccccc2S(N)(=O)=O)cc1	ZINC000819313350	GC	On-Demand	Anodyne	ADRB3	32	45
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccccc2S(N)(=O)=O)cc1	ZINC000819313350	GC	On-Demand	Anodyne	CTSF	48	33
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccccc2S(N)(=O)=O)cc1	ZINC000819313351	GC	On-Demand	Anodyne	CA2	23	44
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccccc2S(N)(=O)=O)cc1	ZINC000819313351	GC	On-Demand	Anodyne	ADRB1	15	45
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccccc2S(N)(=O)=O)cc1	ZINC000819313351	GC	On-Demand	Anodyne	ADRB3	32	45
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccccc2S(N)(=O)=O)cc1	ZINC000819313351	GC	On-Demand	Anodyne	CTSF	48	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC1(F)F	ZINC000819313359	GG	On-Demand	Anodyne	CTSD	118	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC1(F)F	ZINC000819313359	GG	On-Demand	Anodyne	PGC	62	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC1(F)F	ZINC000819313359	GG	On-Demand	Anodyne	CMA1	30	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC1(F)F	ZINC000819313359	GG	On-Demand	Anodyne	CTRA_BOVIN	15	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC1(F)F	ZINC000819313359	GG	On-Demand	Anodyne	PAPA1_CARPA	29	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC1(F)F	ZINC000819313359	GG	On-Demand	Anodyne	BACE2	50	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC1(F)F	ZINC000819313359	GG	On-Demand	Anodyne	TIMP3	44	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC1(F)F	ZINC000819313359	GG	On-Demand	Anodyne	REN	93	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC1(F)F	ZINC000819313359	GG	On-Demand	Anodyne	REN1	28	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC1(F)F	ZINC000819313359	GG	On-Demand	Anodyne	BACE1	93	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC1(F)F	ZINC000819313359	GG	On-Demand	Anodyne	FPR1	50	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC1(F)F	ZINC000819313359	GG	On-Demand	Anodyne	PLM1_PLAFA	31	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCCC1(F)F	ZINC000819313359	GG	On-Demand	Anodyne	PLM2_PLAFA	51	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC1(F)F	ZINC000819313362	GG	On-Demand	Anodyne	CTSD	118	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC1(F)F	ZINC000819313362	GG	On-Demand	Anodyne	PGC	62	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC1(F)F	ZINC000819313362	GG	On-Demand	Anodyne	CMA1	30	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC1(F)F	ZINC000819313362	GG	On-Demand	Anodyne	CTRA_BOVIN	15	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC1(F)F	ZINC000819313362	GG	On-Demand	Anodyne	PAPA1_CARPA	29	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC1(F)F	ZINC000819313362	GG	On-Demand	Anodyne	BACE2	50	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC1(F)F	ZINC000819313362	GG	On-Demand	Anodyne	TIMP3	44	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC1(F)F	ZINC000819313362	GG	On-Demand	Anodyne	REN	93	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC1(F)F	ZINC000819313362	GG	On-Demand	Anodyne	REN1	28	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC1(F)F	ZINC000819313362	GG	On-Demand	Anodyne	BACE1	93	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC1(F)F	ZINC000819313362	GG	On-Demand	Anodyne	FPR1	50	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC1(F)F	ZINC000819313362	GG	On-Demand	Anodyne	PLM1_PLAFA	31	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC1(F)F	ZINC000819313362	GG	On-Demand	Anodyne	PLM2_PLAFA	51	34
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](O)CC2)ccc1Br	ZINC000819313363	IF	On-Demand	Anodyne	SFRP1	44	36
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](O)CC2)ccc1Br	ZINC000819313363	IF	On-Demand	Anodyne	L3MBTL3	76	40
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](O)CC2)ccc1Br	ZINC000819313364	IF	On-Demand	Anodyne	SFRP1	44	36
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](O)CC2)ccc1Br	ZINC000819313364	IF	On-Demand	Anodyne	L3MBTL3	76	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1ccccc1S(N)(=O)=O	ZINC000819313365	FC	On-Demand	Anodyne	CA2	15	44
O=C(c1cc(S(=O)(=O)N2CCOCC2)ccc1F)N1CCC[C@@H](O)CC1	ZINC000819313366	GC	On-Demand	Anodyne	SLC6A9	32	40
O=C(c1cc(S(=O)(=O)N2CCOCC2)ccc1F)N1CCC[C@H](O)CC1	ZINC000819313367	GC	On-Demand	Anodyne	SLC6A9	32	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1ccccc1S(N)(=O)=O	ZINC000819313368	FC	On-Demand	Anodyne	CA2	15	44
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@@H](O)CC1)c1cccc(Cl)c1	ZINC000819313374	GG	On-Demand	Anodyne	REN	23	41
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCC[C@H](O)CC1)c1cccc(Cl)c1	ZINC000819313375	GG	On-Demand	Anodyne	REN	23	41
O=C(Nc1ccc(C(=O)N2CCOC[C@@H]2CC2CCC2)cc1)OCC(F)(F)F	ZINC000819313376	HH	On-Demand	Anodyne	EPHX2	25	44
O=C(Nc1ccc(C(=O)N2CCOC[C@H]2CC2CCC2)cc1)OCC(F)(F)F	ZINC000819313377	HH	On-Demand	Anodyne	EPHX2	25	44
O=C1C[C@@H](C(=O)N2CCC[C@H](O)CC2)CN1Cc1ccccc1Cl	ZINC000819313392	FE	On-Demand	Anodyne	P2RX7	17	42
O=C1C[C@H](C(=O)N2CCC[C@H](O)CC2)CN1Cc1ccccc1Cl	ZINC000819313393	FE	On-Demand	Anodyne	P2RX7	17	42
O=C1C[C@@H](C(=O)N2CCC[C@@H](O)CC2)CN1Cc1ccccc1Cl	ZINC000819313394	FE	On-Demand	Anodyne	P2RX7	17	42
O=C1C[C@H](C(=O)N2CCC[C@@H](O)CC2)CN1Cc1ccccc1Cl	ZINC000819313395	FE	On-Demand	Anodyne	P2RX7	17	42
Cn1c(C(=O)N2CCC[C@@H](O)CC2)ccc1-c1ccccc1Br	ZINC000819313406	GG	On-Demand	Anodyne	L3MBTL3	40	34
Cn1c(C(=O)N2CCC[C@H](O)CC2)ccc1-c1ccccc1Br	ZINC000819313407	GG	On-Demand	Anodyne	L3MBTL3	40	34
C#Cc1ccc(C(=O)N2CCC[C@@H](O)CC2)cn1	ZINC000819313430	BD	On-Demand	Mild	PREP	18	41
C#Cc1ccc(C(=O)N2CCC[C@@H](O)CC2)cn1	ZINC000819313430	BD	On-Demand	Mild	L3MBTL3	95	50
C#Cc1ccc(C(=O)N2CCC[C@@H](O)CC2)cn1	ZINC000819313430	BD	On-Demand	Mild	HPGD	43	36
C#Cc1ccc(C(=O)N2CCC[C@H](O)CC2)cn1	ZINC000819313431	BD	On-Demand	Mild	PREP	18	41
C#Cc1ccc(C(=O)N2CCC[C@H](O)CC2)cn1	ZINC000819313431	BD	On-Demand	Mild	L3MBTL3	95	50
C#Cc1ccc(C(=O)N2CCC[C@H](O)CC2)cn1	ZINC000819313431	BD	On-Demand	Mild	HPGD	43	36
COc1ccc2c(C)c(CCC(=O)N3CCC[C@H](O)CC3)c(=O)oc2c1	ZINC000819313444	FE	On-Demand	Anodyne	MAOB	33	46
COc1ccc2c(C)c(CCC(=O)N3CCC[C@H](O)CC3)c(=O)oc2c1	ZINC000819313444	FE	On-Demand	Anodyne	NQO1	29	44
COc1ccc2c(C)c(CCC(=O)N3CCC[C@@H](O)CC3)c(=O)oc2c1	ZINC000819313445	FE	On-Demand	Anodyne	MAOB	33	46
COc1ccc2c(C)c(CCC(=O)N3CCC[C@@H](O)CC3)c(=O)oc2c1	ZINC000819313445	FE	On-Demand	Anodyne	NQO1	29	44
O=C([C@H](F)Cc1ccccc1)N1CCOC[C@@H]1CC1CCC1	ZINC000819313448	DF	On-Demand	Anodyne	PGA5	41	31
O=C([C@H](F)Cc1ccccc1)N1CCOC[C@H]1CC1CCC1	ZINC000819313449	DF	On-Demand	Anodyne	PGA5	41	31
O=C([C@@H](F)Cc1ccccc1)N1CCOC[C@@H]1CC1CCC1	ZINC000819313450	DF	On-Demand	Anodyne	PGA5	41	31
O=C([C@@H](F)Cc1ccccc1)N1CCOC[C@H]1CC1CCC1	ZINC000819313451	DF	On-Demand	Anodyne	PGA5	41	31
C[C@@](O)(C(=O)N1CCC[C@@H](O)CC1)c1cccc(C(F)(F)F)c1	ZINC000819313455	EE	On-Demand	Anodyne	CACNA1B	58	41
C[C@@](O)(C(=O)N1CCC[C@@H](O)CC1)c1cccc(C(F)(F)F)c1	ZINC000819313455	EE	On-Demand	Anodyne	CCR2	41	38
C[C@@](O)(C(=O)N1CCC[C@@H](O)CC1)c1cccc(C(F)(F)F)c1	ZINC000819313455	EE	On-Demand	Anodyne	SFRP1	52	33
C[C@@](O)(C(=O)N1CCC[C@@H](O)CC1)c1cccc(C(F)(F)F)c1	ZINC000819313455	EE	On-Demand	Anodyne	WNT3	50	31
C[C@@](O)(C(=O)N1CCC[C@H](O)CC1)c1cccc(C(F)(F)F)c1	ZINC000819313457	EE	On-Demand	Anodyne	CACNA1B	58	41
C[C@@](O)(C(=O)N1CCC[C@H](O)CC1)c1cccc(C(F)(F)F)c1	ZINC000819313457	EE	On-Demand	Anodyne	CCR2	41	38
C[C@@](O)(C(=O)N1CCC[C@H](O)CC1)c1cccc(C(F)(F)F)c1	ZINC000819313457	EE	On-Demand	Anodyne	SFRP1	52	33
C[C@@](O)(C(=O)N1CCC[C@H](O)CC1)c1cccc(C(F)(F)F)c1	ZINC000819313457	EE	On-Demand	Anodyne	WNT3	50	31
C[C@H](CCOCc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819313472	DF	On-Demand	Anodyne	ADRB2	39	42
C[C@H](CCOCc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819313472	DF	On-Demand	Anodyne	ADRB1	39	54
C[C@H](CCOCc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819313472	DF	On-Demand	Anodyne	ADRB3	93	54
C[C@@H](CCOCc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819313473	DF	On-Demand	Anodyne	ADRB2	39	42
C[C@@H](CCOCc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819313473	DF	On-Demand	Anodyne	ADRB1	39	54
C[C@@H](CCOCc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819313473	DF	On-Demand	Anodyne	ADRB3	93	54
C[C@H](CCOCc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819313474	DF	On-Demand	Anodyne	ADRB2	39	42
C[C@H](CCOCc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819313474	DF	On-Demand	Anodyne	ADRB1	39	54
C[C@H](CCOCc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819313474	DF	On-Demand	Anodyne	ADRB3	93	54
C[C@@H](CCOCc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819313475	DF	On-Demand	Anodyne	ADRB2	39	42
C[C@@H](CCOCc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819313475	DF	On-Demand	Anodyne	ADRB1	39	54
C[C@@H](CCOCc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819313475	DF	On-Demand	Anodyne	ADRB3	93	54
O[C@H](CN[C@@H]1CCCC1(F)F)c1cccnc1	ZINC000819313509	BD	On-Demand	Anodyne	ADRB3	77	42
O[C@H](CN[C@H]1CCCC1(F)F)c1cccnc1	ZINC000819313510	BD	On-Demand	Anodyne	ADRB3	77	42
O[C@@H](CN[C@H]1CCCC1(F)F)c1cccnc1	ZINC000819313512	BD	On-Demand	Anodyne	ADRB3	77	42
O[C@@H](CN[C@@H]1CCCC1(F)F)c1cccnc1	ZINC000819313514	BD	On-Demand	Anodyne	ADRB3	77	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1=CCCOC1	ZINC000819313516	GE	On-Demand	Anodyne	CTSD	83	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1=CCCOC1	ZINC000819313516	GE	On-Demand	Anodyne	PGC	62	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1=CCCOC1	ZINC000819313516	GE	On-Demand	Anodyne	PAPA1_CARPA	33	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1=CCCOC1	ZINC000819313516	GE	On-Demand	Anodyne	CTSK	15	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1=CCCOC1	ZINC000819313516	GE	On-Demand	Anodyne	BACE2	56	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1=CCCOC1	ZINC000819313516	GE	On-Demand	Anodyne	TACR3	15	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1=CCCOC1	ZINC000819313516	GE	On-Demand	Anodyne	REN	85	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1=CCCOC1	ZINC000819313516	GE	On-Demand	Anodyne	REN1	20	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1=CCCOC1	ZINC000819313516	GE	On-Demand	Anodyne	BACE1	89	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1=CCCOC1	ZINC000819313516	GE	On-Demand	Anodyne	FPR1	50	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1=CCCOC1	ZINC000819313516	GE	On-Demand	Anodyne	PLM1_PLAFA	21	40
O=Cc1ccc(OCC(=O)N2CCOC[C@@H]2CC2CCC2)cc1	ZINC000819313540	DE	On-Demand	Anodyne	CPT1A	99	38
O=Cc1ccc(OCC(=O)N2CCOC[C@@H]2CC2CCC2)cc1	ZINC000819313540	DE	On-Demand	Anodyne	CPT2	47	38
O=Cc1ccc(OCC(=O)N2CCOC[C@H]2CC2CCC2)cc1	ZINC000819313542	DE	On-Demand	Anodyne	CPT1A	99	38
O=Cc1ccc(OCC(=O)N2CCOC[C@H]2CC2CCC2)cc1	ZINC000819313542	DE	On-Demand	Anodyne	CPT2	47	38
O=C(/C=C/[C@@H]1CCCO1)NCc1cc(O)nc2ccccc12	ZINC000819313556	CE	On-Demand	Anodyne	BCHE	40	34
O=C(/C=C\[C@H]1CCCO1)NCc1cc(O)nc2ccccc12	ZINC000819313562	CE	On-Demand	Anodyne	BCHE	40	34
O=C(c1cc(-c2ccccc2)nc2cc(Br)ccc12)N1CCC[C@H](O)CC1	ZINC000819313563	IJ	On-Demand	Anodyne	PRS	74	49
O=C(/C=C/[C@H]1CCCO1)NCc1cc(O)nc2ccccc12	ZINC000819313564	CE	On-Demand	Anodyne	BCHE	40	34
O=C(/C=C\[C@@H]1CCCO1)NCc1cc(O)nc2ccccc12	ZINC000819313565	CE	On-Demand	Anodyne	BCHE	40	34
O=C(c1cc(-c2ccccc2)nc2cc(Br)ccc12)N1CCC[C@@H](O)CC1	ZINC000819313566	IJ	On-Demand	Anodyne	PRS	74	49
C=C(C)C(C)(C)C(=O)N1CCn2c(CCc3ccccc3)nnc2C1	ZINC000819313585	EG	On-Demand	Mild	P2RX7	15	42
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819313589	ED	On-Demand	Anodyne	ADRB2	26	41
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819313589	ED	On-Demand	Anodyne	ADRB3	109	48
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819313589	ED	On-Demand	Anodyne	NAMPT	47	39
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819313590	ED	On-Demand	Anodyne	ADRB2	26	41
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819313590	ED	On-Demand	Anodyne	ADRB3	109	48
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819313590	ED	On-Demand	Anodyne	NAMPT	47	39
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819313597	GF	On-Demand	Anodyne	ADRB3	20	45
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819313597	GF	On-Demand	Anodyne	TGM2	32	42
CC(C)(C)OC(=O)N1CCCc2c(CNC[C@H](O)C(F)(F)F)cccc21	ZINC000819313598	FG	On-Demand	Anodyne	GPR119	15	40
CC(C)(C)OC(=O)N1CCCc2c(CNC[C@@H](O)C(F)(F)F)cccc21	ZINC000819313600	FG	On-Demand	Anodyne	GPR119	15	40
O=C(C[C@@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)N2CCC[C@@H](O)CC2)cc1	ZINC000819313620	IE	On-Demand	Anodyne	L3MBTL3	58	37
O=C(C[C@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)N2CCC[C@@H](O)CC2)cc1	ZINC000819313621	IE	On-Demand	Anodyne	L3MBTL3	58	37
O=C(C[C@@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)N2CCC[C@H](O)CC2)cc1	ZINC000819313622	IE	On-Demand	Anodyne	L3MBTL3	58	37
O=C(C[C@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)N2CCC[C@H](O)CC2)cc1	ZINC000819313623	IE	On-Demand	Anodyne	L3MBTL3	58	37
O=C([C@@H]1CC(c2ccc(Cl)cc2Cl)=NO1)N1CCC[C@@H](O)CC1	ZINC000819313624	FF	On-Demand	Anodyne	CNR1	17	46
O=C([C@H]1CC(c2ccc(Cl)cc2Cl)=NO1)N1CCC[C@@H](O)CC1	ZINC000819313625	FF	On-Demand	Anodyne	CNR1	17	46
O=C([C@@H]1CC(c2ccc(Cl)cc2Cl)=NO1)N1CCC[C@H](O)CC1	ZINC000819313626	FF	On-Demand	Anodyne	CNR1	17	46
O=C([C@H]1CC(c2ccc(Cl)cc2Cl)=NO1)N1CCC[C@H](O)CC1	ZINC000819313627	FF	On-Demand	Anodyne	CNR1	17	46
COc1ccc2c(C)c(CCC(=O)Nc3cc(C(F)(F)F)cnc3O)c(=O)oc2c1	ZINC000819313638	HH	On-Demand	Anodyne	MAOB	33	43
COc1ccc2c(C)c(CCC(=O)Nc3cc(C(F)(F)F)cnc3O)c(=O)oc2c1	ZINC000819313638	HH	On-Demand	Anodyne	NQO1	35	44
O=C(c1ccc2c(=O)n(Cc3ccccc3Cl)c(S)nc2c1)N1CCC[C@H](O)CC1	ZINC000819313649	IG	On-Demand	Anodyne	DPP4	15	43
O=C(c1ccc2c(=O)n(Cc3ccccc3Cl)c(S)nc2c1)N1CCC[C@H](O)CC1	ZINC000819313649	IG	On-Demand	Anodyne	L3MBTL3	46	34
O=C(c1ccc2c(=O)n(Cc3ccccc3Cl)c(S)nc2c1)N1CCC[C@H](O)CC1	ZINC000819313649	IG	On-Demand	Anodyne	HPGD	41	35
O=C(c1ccc2c(=O)n(Cc3ccccc3Cl)c(S)nc2c1)N1CCC[C@@H](O)CC1	ZINC000819313650	IG	On-Demand	Anodyne	DPP4	15	43
O=C(c1ccc2c(=O)n(Cc3ccccc3Cl)c(S)nc2c1)N1CCC[C@@H](O)CC1	ZINC000819313650	IG	On-Demand	Anodyne	L3MBTL3	46	34
O=C(c1ccc2c(=O)n(Cc3ccccc3Cl)c(S)nc2c1)N1CCC[C@@H](O)CC1	ZINC000819313650	IG	On-Demand	Anodyne	HPGD	41	35
O=C(/C=C\c1ccccc1)N1CCOC[C@H]1CC1CCC1	ZINC000819313651	CG	On-Demand	Anodyne	ITGAL	40	34
O=C(/C=C/c1ccccc1)N1CCOC[C@@H]1CC1CCC1	ZINC000819313652	CG	On-Demand	Anodyne	ITGAL	40	34
O=C(/C=C\c1ccccc1)N1CCOC[C@@H]1CC1CCC1	ZINC000819313653	CG	On-Demand	Anodyne	ITGAL	40	34
O=C(/C=C/c1ccccc1)N1CCOC[C@H]1CC1CCC1	ZINC000819313654	CG	On-Demand	Anodyne	ITGAL	40	34
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819313679	GF	On-Demand	Anodyne	ADRB3	25	42
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819313679	GF	On-Demand	Anodyne	CCR3	16	41
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1	ZINC000819313679	GF	On-Demand	Anodyne	SFRP1	44	39
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819313680	GF	On-Demand	Anodyne	ADRB3	25	42
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819313680	GF	On-Demand	Anodyne	CCR3	16	41
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1	ZINC000819313680	GF	On-Demand	Anodyne	SFRP1	44	39
COc1ccccc1COC[C@@H](O)CNCc1ccc(C#N)cn1	ZINC000819313689	ED	On-Demand	Mild	ADRB1	49	35
COc1ccccc1COC[C@H](O)CNCc1ccc(C#N)cn1	ZINC000819313690	ED	On-Demand	Mild	ADRB1	49	35
N#Cc1ccc(CNC[C@H](O)COc2ccccc2Cl)nc1	ZINC000819313691	DE	On-Demand	Mild	ADRB2	19	46
N#Cc1ccc(CNC[C@H](O)COc2ccccc2Cl)nc1	ZINC000819313691	DE	On-Demand	Mild	ADRB1	58	41
N#Cc1ccc(CNC[C@@H](O)COc2ccccc2Cl)nc1	ZINC000819313692	DE	On-Demand	Mild	ADRB2	19	46
N#Cc1ccc(CNC[C@@H](O)COc2ccccc2Cl)nc1	ZINC000819313692	DE	On-Demand	Mild	ADRB1	58	41
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819313708	FE	On-Demand	Mild	ADRB2	42	45
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819313708	FE	On-Demand	Mild	ADRB1	74	45
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819313708	FE	On-Demand	Mild	ADRB3	45	45
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819313714	FE	On-Demand	Mild	ADRB2	42	45
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819313714	FE	On-Demand	Mild	ADRB1	74	45
CC(=O)CCc1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819313714	FE	On-Demand	Mild	ADRB3	45	45
N#Cc1ccc(CNC[C@H](O)COc2ccc(F)cc2)nc1	ZINC000819313716	DD	On-Demand	Mild	ADRB1	62	39
N#Cc1ccc(CNC[C@@H](O)COc2ccc(F)cc2)nc1	ZINC000819313718	DD	On-Demand	Mild	ADRB1	62	39
O[C@H](CNC[C@H]1CCCSC1)c1cccc(Cl)c1	ZINC000819313720	CG	On-Demand	Anodyne	ADRB1	35	43
O[C@H](CNC[C@H]1CCCSC1)c1cccc(Cl)c1	ZINC000819313720	CG	On-Demand	Anodyne	ADRB3	46	43
O[C@@H](CNC[C@@H]1CCCSC1)c1cccc(Cl)c1	ZINC000819313722	CG	On-Demand	Anodyne	ADRB1	35	43
O[C@@H](CNC[C@@H]1CCCSC1)c1cccc(Cl)c1	ZINC000819313722	CG	On-Demand	Anodyne	ADRB3	46	43
O[C@@H](CNC[C@H]1CCCSC1)c1cccc(Cl)c1	ZINC000819313728	CG	On-Demand	Anodyne	ADRB1	35	43
O[C@@H](CNC[C@H]1CCCSC1)c1cccc(Cl)c1	ZINC000819313728	CG	On-Demand	Anodyne	ADRB3	46	43
O[C@H](CNC[C@@H]1CCCSC1)c1cccc(Cl)c1	ZINC000819313730	CG	On-Demand	Anodyne	ADRB1	35	43
O[C@H](CNC[C@@H]1CCCSC1)c1cccc(Cl)c1	ZINC000819313730	CG	On-Demand	Anodyne	ADRB3	46	43
O=C(c1cnn(-c2ccccc2)c1Br)N1CCC[C@@H](O)CC1	ZINC000819313731	FF	On-Demand	Anodyne	L3MBTL3	43	38
O=C(c1cnn(-c2ccccc2)c1Br)N1CCC[C@H](O)CC1	ZINC000819313733	FF	On-Demand	Anodyne	L3MBTL3	43	38
CC(C)(C)OC(=O)NCCCCCC(=O)N1CCC[C@H](O)CC1	ZINC000819313747	EE	On-Demand	Anodyne	PREP	20	55
CC(C)(C)OC(=O)NCCCCCC(=O)N1CCC[C@@H](O)CC1	ZINC000819313749	EE	On-Demand	Anodyne	PREP	20	55
C=C(Cl)CSc1nc(C)c(CC(=O)NCC2CCN(CC#N)CC2)s1	ZINC000819313753	GG	On-Demand	Mild	CACNA1I	45	33
N#Cc1ccc(CNC[C@H](O)COc2ccc(Br)cc2)nc1	ZINC000819313759	FE	On-Demand	Mild	ADRB1	46	37
N#Cc1ccc(CNC[C@@H](O)COc2ccc(Br)cc2)nc1	ZINC000819313760	FE	On-Demand	Mild	ADRB1	46	37
Cn1cc(-c2cccc(C(=O)N3CCC[C@H](O)CC3)c2)cn1	ZINC000819313770	CE	On-Demand	Anodyne	PREP	29	42
Cn1cc(-c2cccc(C(=O)N3CCC[C@H](O)CC3)c2)cn1	ZINC000819313770	CE	On-Demand	Anodyne	GRM5	15	40
Cn1cc(-c2cccc(C(=O)N3CCC[C@H](O)CC3)c2)cn1	ZINC000819313770	CE	On-Demand	Anodyne	L3MBTL3	73	44
Cn1cc(-c2cccc(C(=O)N3CCC[C@H](O)CC3)c2)cn1	ZINC000819313770	CE	On-Demand	Anodyne	HPGD	44	34
Cn1cc(-c2cccc(C(=O)N3CCC[C@@H](O)CC3)c2)cn1	ZINC000819313772	CE	On-Demand	Anodyne	PREP	29	42
Cn1cc(-c2cccc(C(=O)N3CCC[C@@H](O)CC3)c2)cn1	ZINC000819313772	CE	On-Demand	Anodyne	GRM5	15	40
Cn1cc(-c2cccc(C(=O)N3CCC[C@@H](O)CC3)c2)cn1	ZINC000819313772	CE	On-Demand	Anodyne	L3MBTL3	73	44
Cn1cc(-c2cccc(C(=O)N3CCC[C@@H](O)CC3)c2)cn1	ZINC000819313772	CE	On-Demand	Anodyne	HPGD	44	34
COC(=O)N[C@@H](C(=O)N1CCC[C@@H](O)CC1)C(C)C	ZINC000819313777	CC	On-Demand	Anodyne	ELANE	47	40
COC(=O)N[C@@H](C(=O)N1CCC[C@@H](O)CC1)C(C)C	ZINC000819313777	CC	On-Demand	Anodyne	CCR1	43	41
COC(=O)N[C@@H](C(=O)N1CCC[C@H](O)CC1)C(C)C	ZINC000819313779	CC	On-Demand	Anodyne	ELANE	47	40
COC(=O)N[C@@H](C(=O)N1CCC[C@H](O)CC1)C(C)C	ZINC000819313779	CC	On-Demand	Anodyne	CCR1	43	41
O=C([C@H](O)[C@H](O)c1nc2ccccc2[nH]1)N1CCC[C@@H](O)CC1	ZINC000819313788	DC	On-Demand	Anodyne	CYP51A1	23	40
O=C([C@H](O)[C@@H](O)c1nc2ccccc2[nH]1)N1CCC[C@@H](O)CC1	ZINC000819313790	DC	On-Demand	Anodyne	CYP51A1	23	40
O=C([C@H](O)[C@H](O)c1nc2ccccc2[nH]1)N1CCC[C@H](O)CC1	ZINC000819313793	DC	On-Demand	Anodyne	CYP51A1	23	40
O=C([C@H](O)[C@@H](O)c1nc2ccccc2[nH]1)N1CCC[C@H](O)CC1	ZINC000819313795	DC	On-Demand	Anodyne	CYP51A1	23	40
N#Cc1ccc(CNC[C@H](O)COc2ccc(Cl)cc2Cl)nc1	ZINC000819313800	FF	On-Demand	Mild	ADRB1	49	34
N#Cc1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2Cl)nc1	ZINC000819313802	FF	On-Demand	Mild	ADRB1	49	34
C[C@@](O)(C(=O)N1CCC[C@@H](O)CC1)c1ccccc1C(F)(F)F	ZINC000819313803	EE	On-Demand	Anodyne	HSD11B1	18	40
C[C@@](O)(C(=O)N1CCC[C@@H](O)CC1)c1ccccc1C(F)(F)F	ZINC000819313803	EE	On-Demand	Anodyne	RBP4	84	46
C[C@@](O)(C(=O)N1CCC[C@@H](O)CC1)c1ccccc1C(F)(F)F	ZINC000819313803	EE	On-Demand	Anodyne	SFRP1	132	40
C[C@@](O)(C(=O)N1CCC[C@@H](O)CC1)c1ccccc1C(F)(F)F	ZINC000819313803	EE	On-Demand	Anodyne	WNT3	96	40
C[C@@](O)(C(=O)N1CCC[C@H](O)CC1)c1ccccc1C(F)(F)F	ZINC000819313808	EE	On-Demand	Anodyne	HSD11B1	18	40
C[C@@](O)(C(=O)N1CCC[C@H](O)CC1)c1ccccc1C(F)(F)F	ZINC000819313808	EE	On-Demand	Anodyne	RBP4	84	46
C[C@@](O)(C(=O)N1CCC[C@H](O)CC1)c1ccccc1C(F)(F)F	ZINC000819313808	EE	On-Demand	Anodyne	SFRP1	132	40
C[C@@](O)(C(=O)N1CCC[C@H](O)CC1)c1ccccc1C(F)(F)F	ZINC000819313808	EE	On-Demand	Anodyne	WNT3	96	40
C[C@H](CCOCc1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819313811	EH	On-Demand	Anodyne	ADRB2	56	54
C[C@H](CCOCc1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819313811	EH	On-Demand	Anodyne	ADRB1	60	54
C[C@H](CCOCc1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819313811	EH	On-Demand	Anodyne	ADRB3	83	54
C[C@H](CCOCc1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819313813	EH	On-Demand	Anodyne	ADRB2	56	54
C[C@H](CCOCc1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819313813	EH	On-Demand	Anodyne	ADRB1	60	54
C[C@H](CCOCc1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819313813	EH	On-Demand	Anodyne	ADRB3	83	54
C[C@@H](CCOCc1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819313815	EH	On-Demand	Anodyne	ADRB2	56	54
C[C@@H](CCOCc1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819313815	EH	On-Demand	Anodyne	ADRB1	60	54
C[C@@H](CCOCc1ccccc1)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819313815	EH	On-Demand	Anodyne	ADRB3	83	54
C[C@@H](CCOCc1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819313816	EH	On-Demand	Anodyne	ADRB2	56	54
C[C@@H](CCOCc1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819313816	EH	On-Demand	Anodyne	ADRB1	60	54
C[C@@H](CCOCc1ccccc1)NC[C@H](O)c1cccc(Cl)c1	ZINC000819313816	EH	On-Demand	Anodyne	ADRB3	83	54
CC(C)(C)OC(=O)N1CC(C)(C)[C@H]1C(=O)N1CCC[C@@H](O)CC1	ZINC000819313823	EE	On-Demand	Anodyne	PREP	15	52
CC(C)(C)OC(=O)N1CC(C)(C)[C@@H]1C(=O)N1CCC[C@@H](O)CC1	ZINC000819313824	EE	On-Demand	Anodyne	PREP	15	52
CC(C)(C)OC(=O)N1CC(C)(C)[C@H]1C(=O)N1CCC[C@H](O)CC1	ZINC000819313825	EE	On-Demand	Anodyne	PREP	15	52
CC(C)(C)OC(=O)N1CC(C)(C)[C@@H]1C(=O)N1CCC[C@H](O)CC1	ZINC000819313826	EE	On-Demand	Anodyne	PREP	15	52
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)N3CCC[C@H](O)CC3)ccc2Cl)C[C@@H](C)O1	ZINC000819313833	IE	On-Demand	Anodyne	L3MBTL3	69	38
C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)N3CCC[C@@H](O)CC3)ccc2Cl)C[C@@H](C)O1	ZINC000819313834	IE	On-Demand	Anodyne	L3MBTL3	69	38
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)N3CCC[C@@H](O)CC3)ccc2Cl)C[C@@H](C)O1	ZINC000819313835	IE	On-Demand	Anodyne	L3MBTL3	69	38
C[C@H]1CN(S(=O)(=O)c2cc(C(=O)N3CCC[C@H](O)CC3)ccc2Cl)C[C@@H](C)O1	ZINC000819313836	IE	On-Demand	Anodyne	L3MBTL3	69	38
CC(C)(C)OC(=O)NCCCCCCC(=O)N1CCC[C@H](O)CC1	ZINC000819313837	EF	On-Demand	Anodyne	PREP	20	55
CC(C)(C)OC(=O)NCCCCCCC(=O)N1CCC[C@@H](O)CC1	ZINC000819313838	EF	On-Demand	Anodyne	PREP	20	55
CN(CCC(=O)N1CCOC[C@@H]1CC1CCC1)C(=O)OCc1ccccc1	ZINC000819313841	FG	On-Demand	Anodyne	PREP	42	35
CN(CCC(=O)N1CCOC[C@@H]1CC1CCC1)C(=O)OCc1ccccc1	ZINC000819313841	FG	On-Demand	Anodyne	SLC12A5	58	38
CN(CCC(=O)N1CCOC[C@H]1CC1CCC1)C(=O)OCc1ccccc1	ZINC000819313842	FG	On-Demand	Anodyne	PREP	42	35
CN(CCC(=O)N1CCOC[C@H]1CC1CCC1)C(=O)OCc1ccccc1	ZINC000819313842	FG	On-Demand	Anodyne	SLC12A5	58	38
O=C(CSc1ccccc1C(=O)N1CCC[C@H](O)CC1)NC1CCCCCCC1	ZINC000819313845	HH	On-Demand	Anodyne	EPHX2	20	50
O=C(CSc1ccccc1C(=O)N1CCC[C@@H](O)CC1)NC1CCCCCCC1	ZINC000819313846	HH	On-Demand	Anodyne	EPHX2	20	50
O=C(C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1)N1CCC[C@@H](O)CC1	ZINC000819313851	GE	On-Demand	Anodyne	SFRP1	64	34
O=C(C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1)N1CCC[C@@H](O)CC1	ZINC000819313851	GE	On-Demand	Anodyne	WNT3	67	33
O=C(C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1)N1CCC[C@@H](O)CC1	ZINC000819313852	GE	On-Demand	Anodyne	SFRP1	64	34
O=C(C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1)N1CCC[C@@H](O)CC1	ZINC000819313852	GE	On-Demand	Anodyne	WNT3	67	33
O=C(C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1)N1CCC[C@H](O)CC1	ZINC000819313853	GE	On-Demand	Anodyne	SFRP1	64	34
O=C(C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1)N1CCC[C@H](O)CC1	ZINC000819313853	GE	On-Demand	Anodyne	WNT3	67	33
O=C(C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1)N1CCC[C@H](O)CC1	ZINC000819313854	GE	On-Demand	Anodyne	SFRP1	64	34
O=C(C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1)N1CCC[C@H](O)CC1	ZINC000819313854	GE	On-Demand	Anodyne	WNT3	67	33
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	F2	25	43
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	PLG	25	43
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	PRSS1	15	42
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	GHRHR	53	32
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	P2RY12	52	36
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	CELA1	24	46
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	TRHR	53	39
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	PGC	58	40
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	MC4R	37	40
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	CMA1	34	42
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	CTRA_BOVIN	40	32
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	CPB2	45	47
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	TRY1_BOVIN	36	43
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	CCKAR	35	45
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	CACNA1B	38	41
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	PGA	28	40
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	CYP51A1	23	41
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	REN	93	42
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	CCKBR	15	41
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	CTSE	17	40
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819313857	IF	On-Demand	Anodyne	FPR1	49	39
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	F2	25	43
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	PLG	25	43
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	PRSS1	15	42
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	GHRHR	53	32
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	P2RY12	52	36
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	CELA1	24	46
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	TRHR	53	39
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	PGC	58	40
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	MC4R	37	40
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	CMA1	34	42
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	CTRA_BOVIN	40	32
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	CPB2	45	47
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	TRY1_BOVIN	36	43
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	CCKAR	35	45
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	CACNA1B	38	41
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	PGA	28	40
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	CYP51A1	23	41
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	REN	93	42
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	CCKBR	15	41
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	CTSE	17	40
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CCC[C@H](O)CC1	ZINC000819313858	IF	On-Demand	Anodyne	FPR1	49	39
CON(C)C(=O)CCNCc1ccccc1S(N)(=O)=O	ZINC000819313903	DB	On-Demand	Anodyne	CA2	16	43
N#Cc1ccc(CNC[C@H](O)COc2ccc(Cl)cc2)nc1	ZINC000819313937	DE	On-Demand	Mild	ADRB1	46	33
N#Cc1ccc(CNC[C@@H](O)COc2ccc(Cl)cc2)nc1	ZINC000819313938	DE	On-Demand	Mild	ADRB1	46	33
Cc1cc(OC[C@@H](O)CNCc2ccc(C#N)cn2)c(C(C)C)cc1Cl	ZINC000819313939	FH	On-Demand	Mild	ADRB1	40	32
Cc1cc(OC[C@H](O)CNCc2ccc(C#N)cn2)c(C(C)C)cc1Cl	ZINC000819313940	FH	On-Demand	Mild	ADRB1	40	32
NS(=O)(=O)c1ccccc1CNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819313959	FE	On-Demand	Anodyne	ADRB2	31	44
NS(=O)(=O)c1ccccc1CNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819313959	FE	On-Demand	Anodyne	ADRB1	18	44
NS(=O)(=O)c1ccccc1CNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819313959	FE	On-Demand	Anodyne	ADRB3	25	44
NS(=O)(=O)c1ccccc1CNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819313959	FE	On-Demand	Anodyne	CCR2	37	45
NS(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819313960	FE	On-Demand	Anodyne	ADRB2	31	44
NS(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819313960	FE	On-Demand	Anodyne	ADRB1	18	44
NS(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819313960	FE	On-Demand	Anodyne	ADRB3	25	44
NS(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819313960	FE	On-Demand	Anodyne	CCR2	37	45
Cc1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819313961	CD	On-Demand	Mild	ADRB2	36	49
Cc1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819313961	CD	On-Demand	Mild	ADRB1	50	35
Cc1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819313962	CD	On-Demand	Mild	ADRB2	36	49
Cc1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819313962	CD	On-Demand	Mild	ADRB1	50	35
CC(=O)Nc1cccc(CC(=O)N2CCOc3cc(C)ccc32)c1	ZINC000819313974	DF	On-Demand	Anodyne	KDR	15	42
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819313986	GE	On-Demand	Anodyne	ADRB2	19	41
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819313986	GE	On-Demand	Anodyne	ADRB1	44	49
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819313986	GE	On-Demand	Anodyne	ADRB3	71	49
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819313986	GE	On-Demand	Anodyne	TGM2	21	41
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819313986	GE	On-Demand	Anodyne	CYP3A4	48	38
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819313986	GE	On-Demand	Anodyne	SFRP1	42	37
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819313987	GE	On-Demand	Anodyne	ADRB2	19	41
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819313987	GE	On-Demand	Anodyne	ADRB1	44	49
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819313987	GE	On-Demand	Anodyne	ADRB3	71	49
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819313987	GE	On-Demand	Anodyne	TGM2	21	41
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819313987	GE	On-Demand	Anodyne	CYP3A4	48	38
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819313987	GE	On-Demand	Anodyne	SFRP1	42	37
C[C@@H](CNCc1cccc2c1CCCN2C(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000819313996	GF	On-Demand	Anodyne	GPR119	25	40
C[C@H](CNCc1cccc2c1CCCN2C(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000819313997	GF	On-Demand	Anodyne	GPR119	25	40
Cc1ccccc1[C@@H](O)CNCc1ccccc1S(N)(=O)=O	ZINC000819314000	DD	On-Demand	Anodyne	ADRB2	16	44
O[C@H](CN[C@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819314046	CG	On-Demand	Anodyne	ADRB1	31	42
O[C@H](CN[C@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819314046	CG	On-Demand	Anodyne	ADRB3	47	48
O[C@H](CN[C@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819314046	CG	On-Demand	Anodyne	CYP3A4	40	33
O[C@@H](CN[C@@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819314047	CG	On-Demand	Anodyne	ADRB1	31	42
O[C@@H](CN[C@@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819314047	CG	On-Demand	Anodyne	ADRB3	47	48
O[C@@H](CN[C@@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819314047	CG	On-Demand	Anodyne	CYP3A4	40	33
O[C@@H](CN[C@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819314048	CG	On-Demand	Anodyne	ADRB1	31	42
O[C@@H](CN[C@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819314048	CG	On-Demand	Anodyne	ADRB3	47	48
O[C@@H](CN[C@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819314048	CG	On-Demand	Anodyne	CYP3A4	40	33
O[C@H](CN[C@@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819314049	CG	On-Demand	Anodyne	ADRB1	31	42
O[C@H](CN[C@@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819314049	CG	On-Demand	Anodyne	ADRB3	47	48
O[C@H](CN[C@@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819314049	CG	On-Demand	Anodyne	CYP3A4	40	33
O=C(NCc1cc(O)nc2ccccc12)C(F)=C1CCC1	ZINC000819314064	CF	On-Demand	Anodyne	BCHE	55	36
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819314073	GE	On-Demand	Anodyne	OPRL1	27	40
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819314073	GE	On-Demand	Anodyne	ADRB3	24	47
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819314073	GE	On-Demand	Anodyne	TGM2	41	38
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819314073	GE	On-Demand	Anodyne	SFRP1	57	41
CC(C)(C)OC(=O)N1CCCc2c(CNC[C@H](O)c3cccnc3)cccc21	ZINC000819314077	GH	On-Demand	Anodyne	ADRB1	26	40
CC(C)(C)OC(=O)N1CCCc2c(CNC[C@H](O)c3cccnc3)cccc21	ZINC000819314077	GH	On-Demand	Anodyne	ADRB3	96	44
CC(C)(C)OC(=O)N1CCCc2c(CNC[C@@H](O)c3cccnc3)cccc21	ZINC000819314078	GH	On-Demand	Anodyne	ADRB1	26	40
CC(C)(C)OC(=O)N1CCCc2c(CNC[C@@H](O)c3cccnc3)cccc21	ZINC000819314078	GH	On-Demand	Anodyne	ADRB3	96	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCSC1	ZINC000819314094	GG	On-Demand	Anodyne	CTSD	101	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCSC1	ZINC000819314094	GG	On-Demand	Anodyne	PGC	67	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCSC1	ZINC000819314094	GG	On-Demand	Anodyne	PAPA1_CARPA	29	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCSC1	ZINC000819314094	GG	On-Demand	Anodyne	BACE2	53	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCSC1	ZINC000819314094	GG	On-Demand	Anodyne	REN	123	51
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCSC1	ZINC000819314094	GG	On-Demand	Anodyne	REN1	23	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCSC1	ZINC000819314094	GG	On-Demand	Anodyne	BACE1	79	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCSC1	ZINC000819314094	GG	On-Demand	Anodyne	FPR1	50	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCSC1	ZINC000819314094	GG	On-Demand	Anodyne	PLM1_PLAFA	21	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCSC1	ZINC000819314095	GG	On-Demand	Anodyne	CTSD	101	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCSC1	ZINC000819314095	GG	On-Demand	Anodyne	PGC	67	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCSC1	ZINC000819314095	GG	On-Demand	Anodyne	PAPA1_CARPA	29	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCSC1	ZINC000819314095	GG	On-Demand	Anodyne	BACE2	53	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCSC1	ZINC000819314095	GG	On-Demand	Anodyne	REN	123	51
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCSC1	ZINC000819314095	GG	On-Demand	Anodyne	REN1	23	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCSC1	ZINC000819314095	GG	On-Demand	Anodyne	BACE1	79	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCSC1	ZINC000819314095	GG	On-Demand	Anodyne	FPR1	50	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCSC1	ZINC000819314095	GG	On-Demand	Anodyne	PLM1_PLAFA	21	44
N#Cc1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)nc1	ZINC000819314108	ED	On-Demand	Mild	ADRB2	18	45
N#Cc1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)nc1	ZINC000819314108	ED	On-Demand	Mild	ADRB1	48	41
N#Cc1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)nc1	ZINC000819314108	ED	On-Demand	Mild	ADRB3	19	45
N#Cc1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)nc1	ZINC000819314109	ED	On-Demand	Mild	ADRB2	18	45
N#Cc1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)nc1	ZINC000819314109	ED	On-Demand	Mild	ADRB1	48	41
N#Cc1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)nc1	ZINC000819314109	ED	On-Demand	Mild	ADRB3	19	45
O[C@@H](CNC[C@@H]1CCCSC1)c1cccnc1	ZINC000819314114	CD	On-Demand	Anodyne	ADRB2	21	41
O[C@@H](CNC[C@@H]1CCCSC1)c1cccnc1	ZINC000819314114	CD	On-Demand	Anodyne	ADRB1	23	43
O[C@@H](CNC[C@@H]1CCCSC1)c1cccnc1	ZINC000819314114	CD	On-Demand	Anodyne	ADRB3	92	45
O[C@H](CNC[C@H]1CCCSC1)c1cccnc1	ZINC000819314115	CD	On-Demand	Anodyne	ADRB2	21	41
O[C@H](CNC[C@H]1CCCSC1)c1cccnc1	ZINC000819314115	CD	On-Demand	Anodyne	ADRB1	23	43
O[C@H](CNC[C@H]1CCCSC1)c1cccnc1	ZINC000819314115	CD	On-Demand	Anodyne	ADRB3	92	45
O[C@H](CNC[C@@H]1CCCSC1)c1cccnc1	ZINC000819314116	CD	On-Demand	Anodyne	ADRB2	21	41
O[C@H](CNC[C@@H]1CCCSC1)c1cccnc1	ZINC000819314116	CD	On-Demand	Anodyne	ADRB1	23	43
O[C@H](CNC[C@@H]1CCCSC1)c1cccnc1	ZINC000819314116	CD	On-Demand	Anodyne	ADRB3	92	45
O[C@@H](CNC[C@H]1CCCSC1)c1cccnc1	ZINC000819314117	CD	On-Demand	Anodyne	ADRB2	21	41
O[C@@H](CNC[C@H]1CCCSC1)c1cccnc1	ZINC000819314117	CD	On-Demand	Anodyne	ADRB1	23	43
O[C@@H](CNC[C@H]1CCCSC1)c1cccnc1	ZINC000819314117	CD	On-Demand	Anodyne	ADRB3	92	45
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)/C=C/[C@H]3CCCO3)cc2)C1	ZINC000819314120	FF	On-Demand	Anodyne	MCHR1	17	41
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cc2)C1	ZINC000819314121	FF	On-Demand	Anodyne	MCHR1	17	41
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cc2)C1	ZINC000819314122	FF	On-Demand	Anodyne	MCHR1	17	41
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)/C=C\[C@H]3CCCO3)cc2)C1	ZINC000819314123	FF	On-Demand	Anodyne	MCHR1	17	41
CC(C)(C)OC(=O)N1CCCc2c(CNC[C@@H](O)C3CC3)cccc21	ZINC000819314156	EG	On-Demand	Anodyne	GPR119	22	44
CC(C)(C)OC(=O)N1CCCc2c(CNC[C@H](O)C3CC3)cccc21	ZINC000819314157	EG	On-Demand	Anodyne	GPR119	22	44
Cc1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)c(C)c1	ZINC000819314160	DE	On-Demand	Mild	ADRB1	49	34
Cc1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)c(C)c1	ZINC000819314161	DE	On-Demand	Mild	ADRB1	49	34
COc1cccc([S@@](=O)CC(=O)NCCOCCS(C)(=O)=O)c1	ZINC000819314204	FB	On-Demand	Anodyne	MTNR1A	39	41
COc1cccc([S@@](=O)CC(=O)NCCOCCS(C)(=O)=O)c1	ZINC000819314204	FB	On-Demand	Anodyne	MTNR1B	35	41
NS(=O)(=O)c1ccccc1CNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819314205	GE	On-Demand	Anodyne	ADRB2	35	46
NS(=O)(=O)c1ccccc1CNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819314205	GE	On-Demand	Anodyne	ADRB1	17	46
NS(=O)(=O)c1ccccc1CNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819314205	GE	On-Demand	Anodyne	ADRB3	26	46
NS(=O)(=O)c1ccccc1CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819314206	GE	On-Demand	Anodyne	ADRB2	35	46
NS(=O)(=O)c1ccccc1CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819314206	GE	On-Demand	Anodyne	ADRB1	17	46
NS(=O)(=O)c1ccccc1CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819314206	GE	On-Demand	Anodyne	ADRB3	26	46
CN1CCC[C@H](N(C)C(=O)c2ccc(NC(=O)C(F)=C3CCC3)cc2)C1	ZINC000819314213	FG	On-Demand	Anodyne	MCHR1	20	44
CC[C@@](C)(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc(C)cs1	ZINC000819314226	GH	On-Demand	Mild	PAPA1_CARPA	44	46
CC[C@@](C)(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc(C)cs1	ZINC000819314227	GH	On-Demand	Mild	PAPA1_CARPA	44	46
N#Cc1ccc(CNC[C@H](O)COc2ccccc2)nc1	ZINC000819314236	CD	On-Demand	Mild	ADRB2	47	51
N#Cc1ccc(CNC[C@H](O)COc2ccccc2)nc1	ZINC000819314236	CD	On-Demand	Mild	ADRB1	66	44
N#Cc1ccc(CNC[C@H](O)COc2ccccc2)nc1	ZINC000819314236	CD	On-Demand	Mild	ADRB3	42	44
N#Cc1ccc(CNC[C@@H](O)COc2ccccc2)nc1	ZINC000819314237	CD	On-Demand	Mild	ADRB2	47	51
N#Cc1ccc(CNC[C@@H](O)COc2ccccc2)nc1	ZINC000819314237	CD	On-Demand	Mild	ADRB1	66	44
N#Cc1ccc(CNC[C@@H](O)COc2ccccc2)nc1	ZINC000819314237	CD	On-Demand	Mild	ADRB3	42	44
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)c1	ZINC000819314257	ED	On-Demand	Mild	ADRB2	34	42
CC(=O)c1cccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)c1	ZINC000819314257	ED	On-Demand	Mild	ADRB1	57	40
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(C#N)cn2)c1	ZINC000819314258	ED	On-Demand	Mild	ADRB2	34	42
CC(=O)c1cccc(OC[C@H](O)CNCc2ccc(C#N)cn2)c1	ZINC000819314258	ED	On-Demand	Mild	ADRB1	57	40
C[C@@H]1C[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCN1C	ZINC000819314264	FE	On-Demand	Mild	PAPA1_CARPA	36	45
C[C@@H]1C[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCN1C	ZINC000819314266	FE	On-Demand	Mild	PAPA1_CARPA	36	45
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cn2)C1	ZINC000819314267	FD	On-Demand	Anodyne	SFRP1	42	36
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cn2)C1	ZINC000819314268	FD	On-Demand	Anodyne	SFRP1	42	36
C[C@H](CCOCc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314279	EG	On-Demand	Bother	ADRB2	36	45
C[C@H](CCOCc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314279	EG	On-Demand	Bother	ADRB1	36	45
C[C@H](CCOCc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314279	EG	On-Demand	Bother	CACNA1C	33	44
C[C@H](CCOCc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314279	EG	On-Demand	Bother	ADRB3	70	42
C[C@H](CCOCc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314279	EG	On-Demand	Bother	CACNA1D	51	44
C[C@H](CCOCc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314280	EG	On-Demand	Bother	ADRB2	36	45
C[C@H](CCOCc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314280	EG	On-Demand	Bother	ADRB1	36	45
C[C@H](CCOCc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314280	EG	On-Demand	Bother	CACNA1C	33	44
C[C@H](CCOCc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314280	EG	On-Demand	Bother	ADRB3	70	42
C[C@H](CCOCc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314280	EG	On-Demand	Bother	CACNA1D	51	44
C[C@@H](CCOCc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314281	EG	On-Demand	Bother	ADRB2	36	45
C[C@@H](CCOCc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314281	EG	On-Demand	Bother	ADRB1	36	45
C[C@@H](CCOCc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314281	EG	On-Demand	Bother	CACNA1C	33	44
C[C@@H](CCOCc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314281	EG	On-Demand	Bother	ADRB3	70	42
C[C@@H](CCOCc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314281	EG	On-Demand	Bother	CACNA1D	51	44
C[C@@H](CCOCc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314282	EG	On-Demand	Bother	ADRB2	36	45
C[C@@H](CCOCc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314282	EG	On-Demand	Bother	ADRB1	36	45
C[C@@H](CCOCc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314282	EG	On-Demand	Bother	CACNA1C	33	44
C[C@@H](CCOCc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314282	EG	On-Demand	Bother	ADRB3	70	42
C[C@@H](CCOCc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819314282	EG	On-Demand	Bother	CACNA1D	51	44
N#Cc1ccc([C@@H](O)CN[C@H]2CCN(S(=O)(=O)c3ccccc3)C2)cc1	ZINC000819314292	FD	On-Demand	Mild	ADRB3	27	49
N#Cc1ccc([C@H](O)CN[C@H]2CCN(S(=O)(=O)c3ccccc3)C2)cc1	ZINC000819314293	FD	On-Demand	Mild	ADRB3	27	49
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCN(c3ccc(C)cc3)C2=O)c1	ZINC000819314308	FE	On-Demand	Anodyne	CCKBR	40	36
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCN(c3ccc(C)cc3)C2=O)c1	ZINC000819314308	FE	On-Demand	Anodyne	MCHR1	25	43
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCN(c3ccc(C)cc3)C2=O)c1	ZINC000819314309	FE	On-Demand	Anodyne	CCKBR	40	36
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCN(c3ccc(C)cc3)C2=O)c1	ZINC000819314309	FE	On-Demand	Anodyne	MCHR1	25	43
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819314310	ED	On-Demand	Mild	ADRB2	34	40
CC(=O)c1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819314310	ED	On-Demand	Mild	ADRB1	61	39
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819314311	ED	On-Demand	Mild	ADRB2	34	40
CC(=O)c1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819314311	ED	On-Demand	Mild	ADRB1	61	39
CCO[C@@H]1C[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C12CCC2	ZINC000819314312	GG	On-Demand	Mild	PAPA1_CARPA	35	44
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C12CCC2	ZINC000819314313	GG	On-Demand	Mild	PAPA1_CARPA	35	44
CCO[C@@H]1C[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C12CCC2	ZINC000819314314	GG	On-Demand	Mild	PAPA1_CARPA	35	44
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C12CCC2	ZINC000819314315	GG	On-Demand	Mild	PAPA1_CARPA	35	44
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819314320	DD	On-Demand	Mild	ADRB2	34	42
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819314320	DD	On-Demand	Mild	ADRB1	57	42
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819314320	DD	On-Demand	Mild	ADRB3	38	42
N#CCc1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819314321	DD	On-Demand	Mild	ADRB2	34	42
N#CCc1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819314321	DD	On-Demand	Mild	ADRB1	57	42
N#CCc1ccc(OC[C@H](O)CNCc2ccc(C#N)cn2)cc1	ZINC000819314321	DD	On-Demand	Mild	ADRB3	38	42
N#Cc1ccc(CNC[C@@H](O)COc2c(Cl)cccc2Cl)nc1	ZINC000819314328	FF	On-Demand	Mild	ADRB1	49	34
N#Cc1ccc(CNC[C@H](O)COc2c(Cl)cccc2Cl)nc1	ZINC000819314329	FF	On-Demand	Mild	ADRB1	49	34
N#CCN1CCC(CNC(=O)C(F)=C2CCC2)CC1	ZINC000819314337	CD	On-Demand	Mild	CACNA1I	52	32
NS(=O)(=O)c1ccccc1CNC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819314378	FE	On-Demand	Anodyne	ADRB2	15	44
NS(=O)(=O)c1ccccc1CNC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819314379	FE	On-Demand	Anodyne	ADRB2	15	44
COC[C@@H](O)CNCc1cccc2c1CCCN2C(=O)OC(C)(C)C	ZINC000819314384	FE	On-Demand	Anodyne	GPR119	19	40
Cc1ccccc1[C@@H](O)CN[C@@H](C)CCOCc1ccccc1	ZINC000819314387	DH	On-Demand	Anodyne	ADRB2	24	42
Cc1ccccc1[C@@H](O)CN[C@@H](C)CCOCc1ccccc1	ZINC000819314387	DH	On-Demand	Anodyne	ADRB1	19	42
Cc1ccccc1[C@@H](O)CN[C@H](C)CCOCc1ccccc1	ZINC000819314388	DH	On-Demand	Anodyne	ADRB2	24	42
Cc1ccccc1[C@@H](O)CN[C@H](C)CCOCc1ccccc1	ZINC000819314388	DH	On-Demand	Anodyne	ADRB1	19	42
N#Cc1ccc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)nc1	ZINC000819314398	FF	On-Demand	Mild	ADRB1	45	32
N#Cc1ccc(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)nc1	ZINC000819314398	FF	On-Demand	Mild	GRIN1	27	42
N#Cc1ccc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)nc1	ZINC000819314399	FF	On-Demand	Mild	ADRB1	45	32
N#Cc1ccc(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)nc1	ZINC000819314399	FF	On-Demand	Mild	GRIN1	27	42
CN(C[C@H](O)CNCc1cccc2c1CCCN2C(=O)OC(C)(C)C)C1CC1	ZINC000819314407	GF	On-Demand	Anodyne	GPR119	19	41
CN(C[C@@H](O)CNCc1cccc2c1CCCN2C(=O)OC(C)(C)C)C1CC1	ZINC000819314408	GF	On-Demand	Anodyne	GPR119	19	41
Cn1nncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819314413	GD	On-Demand	Anodyne	CTSD	71	42
Cn1nncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819314413	GD	On-Demand	Anodyne	PGC	56	39
Cn1nncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819314413	GD	On-Demand	Anodyne	PAPA1_CARPA	29	42
Cn1nncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819314413	GD	On-Demand	Anodyne	BACE2	46	38
Cn1nncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819314413	GD	On-Demand	Anodyne	REN	80	45
Cn1nncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819314413	GD	On-Demand	Anodyne	REN1	26	45
Cn1nncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819314413	GD	On-Demand	Anodyne	BACE1	72	43
Cn1nncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819314413	GD	On-Demand	Anodyne	FPR1	51	40
Cn1nncc1CNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819314414	FE	On-Demand	Anodyne	ADRB2	48	50
Cn1nncc1CNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819314414	FE	On-Demand	Anodyne	ADRB1	64	43
Cn1nncc1CNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819314414	FE	On-Demand	Anodyne	ADRB3	47	43
Cn1nncc1CNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819314415	FE	On-Demand	Anodyne	ADRB2	48	50
Cn1nncc1CNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819314415	FE	On-Demand	Anodyne	ADRB1	64	43
Cn1nncc1CNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000819314415	FE	On-Demand	Anodyne	ADRB3	47	43
O=C(/C=C\[C@@H]1CCCO1)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000819314428	EF	On-Demand	Bother	SLC27A4	50	33
O=C(/C=C\[C@@H]1CCCO1)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000819314429	EF	On-Demand	Bother	SLC27A4	50	33
O=C(/C=C/[C@@H]1CCCO1)N1CCS[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000819314430	EF	On-Demand	Bother	SLC27A4	50	33
O=C(/C=C/[C@@H]1CCCO1)N1CCS[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000819314431	EF	On-Demand	Bother	SLC27A4	50	33
Cn1nncc1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819314456	EC	On-Demand	Anodyne	GPR119	46	44
Cn1nncc1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819314457	EC	On-Demand	Anodyne	GPR119	46	44
Cn1nncc1CNC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819314466	DC	On-Demand	Bother	ADRB1	56	35
Cn1nncc1CNC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819314467	DC	On-Demand	Bother	ADRB1	56	35
Cn1nncc1CNC[C@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819314474	GF	On-Demand	Anodyne	ADRB2	36	44
Cn1nncc1CNC[C@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819314474	GF	On-Demand	Anodyne	ADRB1	45	38
Cn1nncc1CNC[C@@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819314475	GF	On-Demand	Anodyne	ADRB2	36	44
Cn1nncc1CNC[C@@H](O)COc1ccc(C(C)(C)c2ccccc2)cc1	ZINC000819314475	GF	On-Demand	Anodyne	ADRB1	45	38
CCc1nnc(S)n1CCNC(=O)c1coc(=O)c2ccccc12	ZINC000819314490	ED	On-Demand	Anodyne	INHA	67	34
CCc1nnc(S)n1CCNC(=O)c1cnc2cc(OC)ccn12	ZINC000819314496	ED	On-Demand	Anodyne	DRD4	40	31
Cn1nncc1CNC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819314499	DD	On-Demand	Anodyne	ADRB2	29	40
Cn1nncc1CNC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819314500	DD	On-Demand	Anodyne	ADRB2	29	40
Cn1nncc1CNCCC(=O)Nc1cccc(Br)c1	ZINC000819314587	ED	On-Demand	Anodyne	EGFR	33	41
Cn1nncc1CNCCC(=O)Nc1cccc(Br)c1	ZINC000819314587	ED	On-Demand	Anodyne	HDAC10	33	41
Cn1nncc1CNCCC(=O)Nc1cccc(Br)c1	ZINC000819314587	ED	On-Demand	Anodyne	HDAC3	33	41
Cn1nncc1CNCCC(=O)Nc1cccc(Br)c1	ZINC000819314587	ED	On-Demand	Anodyne	HDAC6	28	41
COc1cccc(OC)c1OC[C@H](O)CNCc1cnnn1C	ZINC000819314588	DC	On-Demand	Anodyne	ADRB2	23	40
COc1cccc(OC)c1OC[C@@H](O)CNCc1cnnn1C	ZINC000819314589	DC	On-Demand	Anodyne	ADRB2	23	40
Cc1ccc2c(c1)[C@@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)CCC2	ZINC000819314604	FG	On-Demand	Anodyne	ADRB3	17	41
Cc1ccc2c(c1)[C@@H](NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)CCC2	ZINC000819314605	FG	On-Demand	Anodyne	ADRB3	17	41
O[C@H](CNCCCn1cc(Br)cn1)c1cccnc1	ZINC000819314622	ED	On-Demand	Anodyne	ADRB2	24	44
O[C@H](CNCCCn1cc(Br)cn1)c1cccnc1	ZINC000819314622	ED	On-Demand	Anodyne	ADRB1	24	44
O[C@H](CNCCCn1cc(Br)cn1)c1cccnc1	ZINC000819314622	ED	On-Demand	Anodyne	ADRB3	96	48
O[C@@H](CNCCCn1cc(Br)cn1)c1cccnc1	ZINC000819314623	ED	On-Demand	Anodyne	ADRB2	24	44
O[C@@H](CNCCCn1cc(Br)cn1)c1cccnc1	ZINC000819314623	ED	On-Demand	Anodyne	ADRB1	24	44
O[C@@H](CNCCCn1cc(Br)cn1)c1cccnc1	ZINC000819314623	ED	On-Demand	Anodyne	ADRB3	96	48
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819314624	FD	On-Demand	Anodyne	ADRB3	18	43
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819314624	FD	On-Demand	Anodyne	SFRP1	56	39
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819314625	FD	On-Demand	Anodyne	ADRB3	18	43
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819314625	FD	On-Demand	Anodyne	SFRP1	56	39
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2nccc(C(F)F)n2)CC1	ZINC000819314646	GF	On-Demand	Anodyne	GPR119	51	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2nccc(C(F)F)n2)CC1	ZINC000819314647	GF	On-Demand	Anodyne	GPR119	51	47
O[C@@H](CNCc1ccncc1OC[C@@H]1CCOC1)c1cccnc1	ZINC000819314650	ED	On-Demand	Anodyne	ADRB3	54	39
O[C@H](CNCc1ccncc1OC[C@@H]1CCOC1)c1cccnc1	ZINC000819314651	ED	On-Demand	Anodyne	ADRB3	54	39
O[C@H](CNCc1ccncc1OC[C@H]1CCOC1)c1cccnc1	ZINC000819314652	ED	On-Demand	Anodyne	ADRB3	54	39
O[C@@H](CNCc1ccncc1OC[C@H]1CCOC1)c1cccnc1	ZINC000819314653	ED	On-Demand	Anodyne	ADRB3	54	39
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819314656	GF	On-Demand	Anodyne	ADRB1	16	42
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819314656	GF	On-Demand	Anodyne	ADRB3	34	49
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819314656	GF	On-Demand	Anodyne	SFRP1	47	39
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819314657	GF	On-Demand	Anodyne	ADRB1	16	42
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819314657	GF	On-Demand	Anodyne	ADRB3	34	49
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819314657	GF	On-Demand	Anodyne	SFRP1	47	39
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819314666	GE	On-Demand	Anodyne	ADRB3	24	43
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819314666	GE	On-Demand	Anodyne	CCR3	17	42
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819314666	GE	On-Demand	Anodyne	SFRP1	61	39
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819314667	GE	On-Demand	Anodyne	ADRB3	24	43
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819314667	GE	On-Demand	Anodyne	CCR3	17	42
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819314667	GE	On-Demand	Anodyne	SFRP1	61	39
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819314691	GE	On-Demand	Anodyne	ADRB1	16	44
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819314691	GE	On-Demand	Anodyne	ADRB3	36	49
CCc1nnc(S)n1CCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819314694	FD	On-Demand	Anodyne	DRD4	42	32
CCc1nnc(S)n1CCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819314695	FD	On-Demand	Anodyne	DRD4	42	32
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819314708	GE	On-Demand	Anodyne	ADRB1	18	41
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819314708	GE	On-Demand	Anodyne	ADRB3	37	51
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819314708	GE	On-Demand	Anodyne	SFRP1	96	39
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819314708	GE	On-Demand	Anodyne	WNT3	65	32
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819314709	GE	On-Demand	Anodyne	ADRB1	18	41
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819314709	GE	On-Demand	Anodyne	ADRB3	37	51
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819314709	GE	On-Demand	Anodyne	SFRP1	96	39
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819314709	GE	On-Demand	Anodyne	WNT3	65	32
O[C@@H](CN[C@H]1CCCOC1)c1ccc(Cl)c(F)c1	ZINC000819314716	CE	On-Demand	Anodyne	MAPK1	36	40
O[C@H](CN[C@H]1CCCOC1)c1ccc(Cl)c(F)c1	ZINC000819314717	CE	On-Demand	Anodyne	MAPK1	36	40
O[C@H](CNCc1ccncc1OC[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819314727	FF	On-Demand	Anodyne	CYP3A4	47	34
O[C@@H](CNCc1ccncc1OC[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819314728	FF	On-Demand	Anodyne	CYP3A4	47	34
O[C@@H](CNCc1ccncc1OC[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819314729	FF	On-Demand	Anodyne	CYP3A4	47	34
O[C@H](CNCc1ccncc1OC[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819314730	FF	On-Demand	Anodyne	CYP3A4	47	34
Cn1nncc1CNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819314760	ED	On-Demand	Anodyne	ADRB2	21	40
Cn1nncc1CNC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819314760	ED	On-Demand	Anodyne	ADRB1	61	35
Cn1nncc1CNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819314761	ED	On-Demand	Anodyne	ADRB2	21	40
Cn1nncc1CNC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819314761	ED	On-Demand	Anodyne	ADRB1	61	35
CC(C)(C)Cc1cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n[nH]1	ZINC000819314765	GH	On-Demand	Mild	PAPA1_CARPA	37	43
CC(C)(C)Cc1cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n[nH]1	ZINC000819314766	GH	On-Demand	Mild	PAPA1_CARPA	37	43
C#CCOc1ccc(F)cc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314772	GG	On-Demand	Mild	PAPA1_CARPA	39	46
C#CCOc1ccc(F)cc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314773	GG	On-Demand	Mild	PAPA1_CARPA	39	46
Cn1nncc1CNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819314774	DD	On-Demand	Anodyne	ADRB2	41	54
Cn1nncc1CNC[C@H](O)COc1ccc2ccccc2c1	ZINC000819314774	DD	On-Demand	Anodyne	ADRB1	40	38
Cn1nncc1CNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819314775	DD	On-Demand	Anodyne	ADRB2	41	54
Cn1nncc1CNC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819314775	DD	On-Demand	Anodyne	ADRB1	40	38
Cn1nncc1CNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819314805	DC	On-Demand	Mild	ADRB2	33	40
Cn1nncc1CNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819314805	DC	On-Demand	Mild	ADRB1	53	40
Cn1nncc1CNC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819314805	DC	On-Demand	Mild	ADRB3	36	40
Cn1nncc1CNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819314806	DC	On-Demand	Mild	ADRB2	33	40
Cn1nncc1CNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819314806	DC	On-Demand	Mild	ADRB1	53	40
Cn1nncc1CNC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819314806	DC	On-Demand	Mild	ADRB3	36	40
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314819	FH	On-Demand	Mild	ACE	19	41
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314819	FH	On-Demand	Mild	OPRM1	21	43
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314819	FH	On-Demand	Mild	OPRD1	68	39
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314819	FH	On-Demand	Mild	PAPA1_CARPA	48	45
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314819	FH	On-Demand	Mild	CTSK	19	41
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314819	FH	On-Demand	Mild	PREP	16	46
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314819	FH	On-Demand	Mild	CFTR	58	35
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314819	FH	On-Demand	Mild	ADAM9	44	32
C[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314819	FH	On-Demand	Mild	FPR1	43	36
C[C@H]1Cc2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314820	FH	On-Demand	Mild	ACE	19	41
C[C@H]1Cc2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314820	FH	On-Demand	Mild	OPRM1	21	43
C[C@H]1Cc2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314820	FH	On-Demand	Mild	OPRD1	68	39
C[C@H]1Cc2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314820	FH	On-Demand	Mild	PAPA1_CARPA	48	45
C[C@H]1Cc2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314820	FH	On-Demand	Mild	CTSK	19	41
C[C@H]1Cc2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314820	FH	On-Demand	Mild	PREP	16	46
C[C@H]1Cc2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314820	FH	On-Demand	Mild	CFTR	58	35
C[C@H]1Cc2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314820	FH	On-Demand	Mild	ADAM9	44	32
C[C@H]1Cc2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314820	FH	On-Demand	Mild	FPR1	43	36
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314821	FH	On-Demand	Mild	ACE	19	41
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314821	FH	On-Demand	Mild	OPRM1	21	43
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314821	FH	On-Demand	Mild	OPRD1	68	39
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314821	FH	On-Demand	Mild	PAPA1_CARPA	48	45
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314821	FH	On-Demand	Mild	CTSK	19	41
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314821	FH	On-Demand	Mild	PREP	16	46
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314821	FH	On-Demand	Mild	CFTR	58	35
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314821	FH	On-Demand	Mild	ADAM9	44	32
C[C@@H]1Cc2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314821	FH	On-Demand	Mild	FPR1	43	36
C[C@H]1Cc2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314822	FH	On-Demand	Mild	ACE	19	41
C[C@H]1Cc2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314822	FH	On-Demand	Mild	OPRM1	21	43
C[C@H]1Cc2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314822	FH	On-Demand	Mild	OPRD1	68	39
C[C@H]1Cc2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314822	FH	On-Demand	Mild	PAPA1_CARPA	48	45
C[C@H]1Cc2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314822	FH	On-Demand	Mild	CTSK	19	41
C[C@H]1Cc2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314822	FH	On-Demand	Mild	PREP	16	46
C[C@H]1Cc2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314822	FH	On-Demand	Mild	CFTR	58	35
C[C@H]1Cc2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314822	FH	On-Demand	Mild	ADAM9	44	32
C[C@H]1Cc2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819314822	FH	On-Demand	Mild	FPR1	43	36
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819314843	FD	On-Demand	Anodyne	ADRB1	17	40
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819314843	FD	On-Demand	Anodyne	SLC6A3	21	48
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819314843	FD	On-Demand	Anodyne	ADRB3	35	49
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819314843	FD	On-Demand	Anodyne	SFRP1	63	39
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819314844	FD	On-Demand	Anodyne	ADRB1	17	40
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819314844	FD	On-Demand	Anodyne	SLC6A3	21	48
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819314844	FD	On-Demand	Anodyne	ADRB3	35	49
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819314844	FD	On-Demand	Anodyne	SFRP1	63	39
Cn1nncc1CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819314859	DC	On-Demand	Bother	ADRB2	17	44
Cn1nncc1CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819314859	DC	On-Demand	Bother	ADRB1	18	44
Cn1nncc1CNC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819314859	DC	On-Demand	Bother	PDS	25	45
Cn1nncc1CNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819314860	DC	On-Demand	Bother	ADRB2	17	44
Cn1nncc1CNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819314860	DC	On-Demand	Bother	ADRB1	18	44
Cn1nncc1CNC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819314860	DC	On-Demand	Bother	PDS	25	45
O[C@@H](CNCCCn1cc(Br)cn1)c1cccc(Cl)c1	ZINC000819314861	FG	On-Demand	Anodyne	ADRB1	43	43
O[C@@H](CNCCCn1cc(Br)cn1)c1cccc(Cl)c1	ZINC000819314861	FG	On-Demand	Anodyne	ADRB3	55	45
O[C@H](CNCCCn1cc(Br)cn1)c1cccc(Cl)c1	ZINC000819314862	FG	On-Demand	Anodyne	ADRB1	43	43
O[C@H](CNCCCn1cc(Br)cn1)c1cccc(Cl)c1	ZINC000819314862	FG	On-Demand	Anodyne	ADRB3	55	45
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)CCO1	ZINC000819314884	GF	On-Demand	Anodyne	PDGFRB	31	42
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)CCO1	ZINC000819314884	GF	On-Demand	Anodyne	LIPE	19	40
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)CCO1	ZINC000819314884	GF	On-Demand	Anodyne	FAAH	19	41
O=C(O)[C@H]1CN(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)CCO1	ZINC000819314885	GF	On-Demand	Anodyne	PDGFRB	31	42
O=C(O)[C@H]1CN(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)CCO1	ZINC000819314885	GF	On-Demand	Anodyne	LIPE	19	40
O=C(O)[C@H]1CN(C(=O)Nc2ccc(Oc3ccc(Cl)cn3)cc2)CCO1	ZINC000819314885	GF	On-Demand	Anodyne	FAAH	19	41
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(N3CCSCC3)cc2)CCO1	ZINC000819314888	FD	On-Demand	Anodyne	MTOR	40	39
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(N3CCSCC3)cc2)CCO1	ZINC000819314888	FD	On-Demand	Anodyne	EPHX2	16	42
O=C(O)[C@H]1CN(C(=O)Nc2ccc(N3CCSCC3)cc2)CCO1	ZINC000819314889	FD	On-Demand	Anodyne	MTOR	40	39
O=C(O)[C@H]1CN(C(=O)Nc2ccc(N3CCSCC3)cc2)CCO1	ZINC000819314889	FD	On-Demand	Anodyne	EPHX2	16	42
O=C(O)[C@H]1CN(C(=O)Nc2ccc(CC(F)(F)F)cc2)CCO1	ZINC000819314890	EE	On-Demand	Anodyne	EPHX2	45	37
O=C(O)[C@H]1CN(C(=O)Nc2ccc(CC(F)(F)F)cc2)CCO1	ZINC000819314890	EE	On-Demand	Anodyne	RBP4	44	31
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(CC(F)(F)F)cc2)CCO1	ZINC000819314891	EE	On-Demand	Anodyne	EPHX2	45	37
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(CC(F)(F)F)cc2)CCO1	ZINC000819314891	EE	On-Demand	Anodyne	RBP4	44	31
O=C(O)[C@H]1CN(C(=O)Nc2ccc(COCc3ccccc3)cc2)CCO1	ZINC000819314904	FF	On-Demand	Anodyne	SLC12A5	42	33
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(COCc3ccccc3)cc2)CCO1	ZINC000819314905	FF	On-Demand	Anodyne	SLC12A5	42	33
O=C(O)[C@@H]1CN(C(=O)NNC(=O)C(F)(F)Oc2ccccc2)CCO1	ZINC000819314906	FC	On-Demand	Reactive	RBP4	41	32
O=C(O)[C@H]1CN(C(=O)NNC(=O)C(F)(F)Oc2ccccc2)CCO1	ZINC000819314907	FC	On-Demand	Reactive	RBP4	41	32
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)CCO1	ZINC000819314908	GD	On-Demand	Anodyne	SMO	29	41
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)CCO1	ZINC000819314908	GD	On-Demand	Anodyne	ETHR	50	32
O=C(O)[C@H]1CN(C(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)CCO1	ZINC000819314909	GD	On-Demand	Anodyne	SMO	29	41
O=C(O)[C@H]1CN(C(=O)Nc2ccc(OCc3noc(C4CC4)n3)cc2)CCO1	ZINC000819314909	GD	On-Demand	Anodyne	ETHR	50	32
O=C(O)[C@H]1CN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)CCO1	ZINC000819314916	FC	On-Demand	Anodyne	TGM2	21	43
O=C(O)[C@H]1CN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)CCO1	ZINC000819314916	FC	On-Demand	Anodyne	F13A1	38	43
O=C(O)[C@H]1CN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)CCO1	ZINC000819314916	FC	On-Demand	Anodyne	SFRP1	93	36
O=C(O)[C@H]1CN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)CCO1	ZINC000819314916	FC	On-Demand	Anodyne	WNT3	51	36
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)CCO1	ZINC000819314917	FC	On-Demand	Anodyne	TGM2	21	43
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)CCO1	ZINC000819314917	FC	On-Demand	Anodyne	F13A1	38	43
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)CCO1	ZINC000819314917	FC	On-Demand	Anodyne	SFRP1	93	36
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(S(=O)(=O)NC3CC3)cc2)CCO1	ZINC000819314917	FC	On-Demand	Anodyne	WNT3	51	36
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314918	GD	On-Demand	Anodyne	ESR1	97	38
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314918	GD	On-Demand	Anodyne	HTR2A	20	41
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314918	GD	On-Demand	Anodyne	SLC6A1	55	34
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314918	GD	On-Demand	Anodyne	ESR2	67	43
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314918	GD	On-Demand	Anodyne	PDGFRB	46	43
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314918	GD	On-Demand	Anodyne	LTA4H	72	45
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314918	GD	On-Demand	Anodyne	CYSLTR2	44	33
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314918	GD	On-Demand	Anodyne	HRH3	70	55
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314918	GD	On-Demand	Anodyne	EPHX2	41	47
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314918	GD	On-Demand	Anodyne	FLT3	19	43
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314918	GD	On-Demand	Anodyne	MCHR1	15	42
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314918	GD	On-Demand	Anodyne	PSMB2	47	44
O=C(O)[C@@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314918	GD	On-Demand	Anodyne	PSMB1	52	45
O=C(O)[C@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314919	GD	On-Demand	Anodyne	ESR1	97	38
O=C(O)[C@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314919	GD	On-Demand	Anodyne	HTR2A	20	41
O=C(O)[C@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314919	GD	On-Demand	Anodyne	SLC6A1	55	34
O=C(O)[C@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314919	GD	On-Demand	Anodyne	ESR2	67	43
O=C(O)[C@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314919	GD	On-Demand	Anodyne	PDGFRB	46	43
O=C(O)[C@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314919	GD	On-Demand	Anodyne	LTA4H	72	45
O=C(O)[C@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314919	GD	On-Demand	Anodyne	CYSLTR2	44	33
O=C(O)[C@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314919	GD	On-Demand	Anodyne	HRH3	70	55
O=C(O)[C@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314919	GD	On-Demand	Anodyne	EPHX2	41	47
O=C(O)[C@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314919	GD	On-Demand	Anodyne	FLT3	19	43
O=C(O)[C@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314919	GD	On-Demand	Anodyne	MCHR1	15	42
O=C(O)[C@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314919	GD	On-Demand	Anodyne	PSMB2	47	44
O=C(O)[C@H]1CN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCO1	ZINC000819314919	GD	On-Demand	Anodyne	PSMB1	52	45
O=C(O)[C@H]1CN(C(=O)NCc2ccn3ccnc3c2)CCO1	ZINC000819314924	DC	On-Demand	Anodyne	NOS2	50	34
O=C(O)[C@@H]1CN(C(=O)NCc2ccn3ccnc3c2)CCO1	ZINC000819314925	DC	On-Demand	Anodyne	NOS2	50	34
CC(=O)c1ccc(OC[C@@H](O)CNCc2cnnn2C)cc1	ZINC000819314935	DC	On-Demand	Anodyne	ADRB2	35	43
CC(=O)c1ccc(OC[C@@H](O)CNCc2cnnn2C)cc1	ZINC000819314935	DC	On-Demand	Anodyne	ADRB1	60	40
CC(=O)c1ccc(OC[C@H](O)CNCc2cnnn2C)cc1	ZINC000819314936	DC	On-Demand	Anodyne	ADRB2	35	43
CC(=O)c1ccc(OC[C@H](O)CNCc2cnnn2C)cc1	ZINC000819314936	DC	On-Demand	Anodyne	ADRB1	60	40
O[C@H](CNCc1nccc(C(F)F)n1)c1cccc(Cl)c1	ZINC000819314982	DF	On-Demand	Anodyne	ADRB1	27	40
O[C@H](CNCc1nccc(C(F)F)n1)c1cccc(Cl)c1	ZINC000819314982	DF	On-Demand	Anodyne	ADRB3	40	40
O[C@@H](CNCc1nccc(C(F)F)n1)c1cccc(Cl)c1	ZINC000819314983	DF	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNCc1nccc(C(F)F)n1)c1cccc(Cl)c1	ZINC000819314983	DF	On-Demand	Anodyne	ADRB3	40	40
Cn1nncc1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819314986	DC	On-Demand	Anodyne	ADRB2	20	59
Cn1nncc1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819314986	DC	On-Demand	Anodyne	ADRB1	40	59
Cn1nncc1CNC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819314986	DC	On-Demand	Anodyne	HTR1A	15	59
Cn1nncc1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819314987	DC	On-Demand	Anodyne	ADRB2	20	59
Cn1nncc1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819314987	DC	On-Demand	Anodyne	ADRB1	40	59
Cn1nncc1CNC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819314987	DC	On-Demand	Anodyne	HTR1A	15	59
CC(C)(C)CCOc1cnccc1CNC[C@H](O)c1cccnc1	ZINC000819314996	EG	On-Demand	Anodyne	ADRB2	17	42
CC(C)(C)CCOc1cnccc1CNC[C@H](O)c1cccnc1	ZINC000819314996	EG	On-Demand	Anodyne	ADRB1	21	42
CC(C)(C)CCOc1cnccc1CNC[C@H](O)c1cccnc1	ZINC000819314996	EG	On-Demand	Anodyne	ADRB3	75	43
CC(C)(C)CCOc1cnccc1CNC[C@@H](O)c1cccnc1	ZINC000819314997	EG	On-Demand	Anodyne	ADRB2	17	42
CC(C)(C)CCOc1cnccc1CNC[C@@H](O)c1cccnc1	ZINC000819314997	EG	On-Demand	Anodyne	ADRB1	21	42
CC(C)(C)CCOc1cnccc1CNC[C@@H](O)c1cccnc1	ZINC000819314997	EG	On-Demand	Anodyne	ADRB3	75	43
C#CCOc1cc(F)ccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819315000	GG	On-Demand	Mild	PAPA1_CARPA	37	46
C#CCOc1cc(F)ccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819315001	GG	On-Demand	Mild	PAPA1_CARPA	37	46
Cn1nncc1CNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819315002	EE	On-Demand	Anodyne	ADRB2	52	47
Cn1nncc1CNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819315002	EE	On-Demand	Anodyne	ADRB1	68	41
Cn1nncc1CNC[C@@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819315002	EE	On-Demand	Anodyne	ADRB3	51	41
Cn1nncc1CNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819315003	EE	On-Demand	Anodyne	ADRB2	52	47
Cn1nncc1CNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819315003	EE	On-Demand	Anodyne	ADRB1	68	41
Cn1nncc1CNC[C@H](O)COc1ccc(-c2ccccc2)cc1	ZINC000819315003	EE	On-Demand	Anodyne	ADRB3	51	41
O[C@@H](CNCc1noc2c1CCCC2)c1cccnc1	ZINC000819315010	CD	On-Demand	Anodyne	ADRB2	24	41
O[C@@H](CNCc1noc2c1CCCC2)c1cccnc1	ZINC000819315010	CD	On-Demand	Anodyne	ADRB3	97	44
O[C@H](CNCc1noc2c1CCCC2)c1cccnc1	ZINC000819315011	CD	On-Demand	Anodyne	ADRB2	24	41
O[C@H](CNCc1noc2c1CCCC2)c1cccnc1	ZINC000819315011	CD	On-Demand	Anodyne	ADRB3	97	44
COC(=O)c1ccc(OC[C@H](O)CNCc2cnnn2C)cc1	ZINC000819315012	DC	On-Demand	Anodyne	ADRB2	43	46
COC(=O)c1ccc(OC[C@H](O)CNCc2cnnn2C)cc1	ZINC000819315012	DC	On-Demand	Anodyne	ADRB1	68	44
COC(=O)c1ccc(OC[C@H](O)CNCc2cnnn2C)cc1	ZINC000819315012	DC	On-Demand	Anodyne	ADRB3	45	44
COC(=O)c1ccc(OC[C@@H](O)CNCc2cnnn2C)cc1	ZINC000819315013	DC	On-Demand	Anodyne	ADRB2	43	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2cnnn2C)cc1	ZINC000819315013	DC	On-Demand	Anodyne	ADRB1	68	44
COC(=O)c1ccc(OC[C@@H](O)CNCc2cnnn2C)cc1	ZINC000819315013	DC	On-Demand	Anodyne	ADRB3	45	44
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(S(=O)(=O)c2ccccc2)C1	ZINC000819315024	FE	On-Demand	Anodyne	ADRB3	20	45
Cc1ccccc1[C@@H](O)CN[C@H]1CCN(S(=O)(=O)c2ccccc2)C1	ZINC000819315024	FE	On-Demand	Anodyne	CCR8	43	31
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2noc3c2CCCC3)CC1	ZINC000819315047	GF	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2noc3c2CCCC3)CC1	ZINC000819315047	GF	On-Demand	Anodyne	PANC	50	35
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2noc3c2CCCC3)CC1	ZINC000819315048	GF	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2noc3c2CCCC3)CC1	ZINC000819315048	GF	On-Demand	Anodyne	PANC	50	35
CCOc1ccc(OC[C@H](O)CNCc2cnnn2C)cc1	ZINC000819315049	DC	On-Demand	Anodyne	ADRB2	37	42
CCOc1ccc(OC[C@H](O)CNCc2cnnn2C)cc1	ZINC000819315049	DC	On-Demand	Anodyne	ADRB1	46	42
CCOc1ccc(OC[C@@H](O)CNCc2cnnn2C)cc1	ZINC000819315050	DC	On-Demand	Anodyne	ADRB2	37	42
CCOc1ccc(OC[C@@H](O)CNCc2cnnn2C)cc1	ZINC000819315050	DC	On-Demand	Anodyne	ADRB1	46	42
CCc1nnc(S)n1CCNC(=O)c1cnc(OC)c(Br)c1	ZINC000819315051	GD	On-Demand	Anodyne	DRD4	40	31
Cn1nncc1CNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819315078	ED	On-Demand	Anodyne	KIT	15	40
Cn1nncc1CNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819315078	ED	On-Demand	Anodyne	HDAC6	22	49
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cnnn2C)cc1	ZINC000819315111	DC	On-Demand	Anodyne	ADRB2	44	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cnnn2C)cc1	ZINC000819315111	DC	On-Demand	Anodyne	ADRB1	78	55
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cnnn2C)cc1	ZINC000819315111	DC	On-Demand	Anodyne	ADRB3	51	53
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cnnn2C)cc1	ZINC000819315112	DC	On-Demand	Anodyne	ADRB2	44	55
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cnnn2C)cc1	ZINC000819315112	DC	On-Demand	Anodyne	ADRB1	78	55
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cnnn2C)cc1	ZINC000819315112	DC	On-Demand	Anodyne	ADRB3	51	53
CC(=O)Nc1ccccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819315115	GF	On-Demand	Mild	PAPA1_CARPA	57	53
CC(=O)Nc1ccccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819315115	GF	On-Demand	Mild	CCKAR	43	38
CC(=O)Nc1ccccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819315115	GF	On-Demand	Mild	CTSK	17	47
CC(=O)Nc1ccccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819315115	GF	On-Demand	Mild	CTSL	18	53
CC(=O)Nc1ccccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819315115	GF	On-Demand	Mild	CTSS	15	53
CC(=O)Nc1ccccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819315115	GF	On-Demand	Mild	FPR1	45	40
CC(=O)Nc1ccccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819315116	GF	On-Demand	Mild	PAPA1_CARPA	57	53
CC(=O)Nc1ccccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819315116	GF	On-Demand	Mild	CCKAR	43	38
CC(=O)Nc1ccccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819315116	GF	On-Demand	Mild	CTSK	17	47
CC(=O)Nc1ccccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819315116	GF	On-Demand	Mild	CTSL	18	53
CC(=O)Nc1ccccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819315116	GF	On-Demand	Mild	CTSS	15	53
CC(=O)Nc1ccccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819315116	GF	On-Demand	Mild	FPR1	45	40
C[C@@H]1Oc2ccccc2[C@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819315132	DG	On-Demand	Anodyne	ADRB1	25	41
C[C@@H]1Oc2ccccc2[C@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819315132	DG	On-Demand	Anodyne	ADRB3	38	43
C[C@@H]1Oc2ccccc2[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819315133	DG	On-Demand	Anodyne	ADRB1	25	41
C[C@@H]1Oc2ccccc2[C@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819315133	DG	On-Demand	Anodyne	ADRB3	38	43
C[C@@H]1Oc2ccccc2[C@@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819315134	DG	On-Demand	Anodyne	ADRB1	25	41
C[C@@H]1Oc2ccccc2[C@@H]1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819315134	DG	On-Demand	Anodyne	ADRB3	38	43
C[C@@H]1Oc2ccccc2[C@@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819315135	DG	On-Demand	Anodyne	ADRB1	25	41
C[C@@H]1Oc2ccccc2[C@@H]1NC[C@H](O)c1cccc(Cl)c1	ZINC000819315135	DG	On-Demand	Anodyne	ADRB3	38	43
O[C@@H](CNCc1noc2c1CCCC2)c1cccc(Cl)c1	ZINC000819315206	DG	On-Demand	Anodyne	ADRB1	26	43
O[C@@H](CNCc1noc2c1CCCC2)c1cccc(Cl)c1	ZINC000819315206	DG	On-Demand	Anodyne	ADRB3	48	43
O[C@H](CNCc1noc2c1CCCC2)c1cccc(Cl)c1	ZINC000819315207	DG	On-Demand	Anodyne	ADRB1	26	43
O[C@H](CNCc1noc2c1CCCC2)c1cccc(Cl)c1	ZINC000819315207	DG	On-Demand	Anodyne	ADRB3	48	43
C[C@@H]1Oc2ccccc2[C@@H]1NC[C@H](O)c1cccnc1	ZINC000819315208	CE	On-Demand	Anodyne	ADRB3	60	38
C[C@@H]1Oc2ccccc2[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819315209	CE	On-Demand	Anodyne	ADRB3	60	38
C[C@@H]1Oc2ccccc2[C@H]1NC[C@H](O)c1cccnc1	ZINC000819315210	CE	On-Demand	Anodyne	ADRB3	60	38
C[C@@H]1Oc2ccccc2[C@@H]1NC[C@@H](O)c1cccnc1	ZINC000819315211	CE	On-Demand	Anodyne	ADRB3	60	38
C[C@@H]1[C@@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)CCN1Cc1ccccc1	ZINC000819315224	GF	On-Demand	Anodyne	PGC	42	35
C[C@@H]1[C@@H](NC[C@@H](O)CCNC(=O)OC(C)(C)C)CCN1Cc1ccccc1	ZINC000819315224	GF	On-Demand	Anodyne	FPR1	42	35
C[C@@H]1[C@@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)CCN1Cc1ccccc1	ZINC000819315226	GF	On-Demand	Anodyne	PGC	42	35
C[C@@H]1[C@@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)CCN1Cc1ccccc1	ZINC000819315226	GF	On-Demand	Anodyne	FPR1	42	35
Cn1nncc1CNCCC(=O)Nc1ccc(Cl)cc1	ZINC000819315257	CD	On-Demand	Anodyne	IMDH_CRYPV	25	41
C[C@H](CNC(=O)C(F)=C1CCC1)Cc1cccs1	ZINC000819315321	CG	On-Demand	Anodyne	CTSC	36	42
C[C@@H]1[C@@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)CCN1Cc1ccccc1	ZINC000819315342	GF	On-Demand	Anodyne	DRD4	19	44
C[C@@H]1[C@@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)CCN1Cc1ccccc1	ZINC000819315342	GF	On-Demand	Anodyne	SIGMAR1	19	42
C[C@@H]1[C@@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)CCN1Cc1ccccc1	ZINC000819315343	GF	On-Demand	Anodyne	DRD4	19	44
C[C@@H]1[C@@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)CCN1Cc1ccccc1	ZINC000819315343	GF	On-Demand	Anodyne	SIGMAR1	19	42
C=CCCn1cc(C(=O)Oc2ccc(NC(=O)OC(C)(C)C)cc2)nn1	ZINC000819315383	FG	On-Demand	Mild	ACR	42	36
CC(=O)c1cccc(OC[C@@H](O)CNCc2cnnn2C)c1	ZINC000819315445	DC	On-Demand	Anodyne	ADRB2	27	42
CC(=O)c1cccc(OC[C@@H](O)CNCc2cnnn2C)c1	ZINC000819315445	DC	On-Demand	Anodyne	ADRB1	48	38
CC(=O)c1cccc(OC[C@@H](O)CNCc2cnnn2C)c1	ZINC000819315445	DC	On-Demand	Anodyne	ABCB1	17	46
CC(=O)c1cccc(OC[C@@H](O)CNCc2cnnn2C)c1	ZINC000819315445	DC	On-Demand	Anodyne	PDS	45	36
CC(=O)c1cccc(OC[C@H](O)CNCc2cnnn2C)c1	ZINC000819315446	DC	On-Demand	Anodyne	ADRB2	27	42
CC(=O)c1cccc(OC[C@H](O)CNCc2cnnn2C)c1	ZINC000819315446	DC	On-Demand	Anodyne	ADRB1	48	38
CC(=O)c1cccc(OC[C@H](O)CNCc2cnnn2C)c1	ZINC000819315446	DC	On-Demand	Anodyne	ABCB1	17	46
CC(=O)c1cccc(OC[C@H](O)CNCc2cnnn2C)c1	ZINC000819315446	DC	On-Demand	Anodyne	PDS	45	36
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819315452	GE	On-Demand	Anodyne	ADRB3	18	43
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819315452	GE	On-Demand	Anodyne	SFRP1	54	39
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819315453	GE	On-Demand	Anodyne	ADRB3	18	43
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819315453	GE	On-Demand	Anodyne	SFRP1	54	39
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cnnn2C)cc1	ZINC000819315469	EC	On-Demand	Anodyne	ADRB2	42	45
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cnnn2C)cc1	ZINC000819315469	EC	On-Demand	Anodyne	ADRB1	70	46
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cnnn2C)cc1	ZINC000819315469	EC	On-Demand	Anodyne	ADRB3	50	45
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cnnn2C)cc1	ZINC000819315469	EC	On-Demand	Anodyne	ABCB1	18	43
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cnnn2C)cc1	ZINC000819315470	EC	On-Demand	Anodyne	ADRB2	42	45
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cnnn2C)cc1	ZINC000819315470	EC	On-Demand	Anodyne	ADRB1	70	46
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cnnn2C)cc1	ZINC000819315470	EC	On-Demand	Anodyne	ADRB3	50	45
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cnnn2C)cc1	ZINC000819315470	EC	On-Demand	Anodyne	ABCB1	18	43
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCN(S(=O)(=O)c3ccccc3)C2)cc1	ZINC000819315476	GD	On-Demand	Bother	ADRB3	26	49
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCN(S(=O)(=O)c3ccccc3)C2)cc1	ZINC000819315477	GD	On-Demand	Bother	ADRB3	26	49
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819315480	FD	On-Demand	Anodyne	ADRB1	20	40
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819315480	FD	On-Demand	Anodyne	ADRB3	41	49
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819315480	FD	On-Demand	Anodyne	SFRP1	64	39
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819315481	FD	On-Demand	Anodyne	ADRB1	20	40
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819315481	FD	On-Demand	Anodyne	ADRB3	41	49
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819315481	FD	On-Demand	Anodyne	SFRP1	64	39
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819315482	GE	On-Demand	Anodyne	ADRB3	24	43
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819315482	GE	On-Demand	Anodyne	CCR3	16	42
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819315482	GE	On-Demand	Anodyne	SFRP1	60	39
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819315483	GE	On-Demand	Anodyne	ADRB3	24	43
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819315483	GE	On-Demand	Anodyne	CCR3	16	42
O=S(=O)(c1ccccc1)N1CC[C@H](NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819315483	GE	On-Demand	Anodyne	SFRP1	60	39
Cc1ccc2c(c1)[C@@H](NC[C@H](O)c1cccnc1)CCC2	ZINC000819315490	CG	On-Demand	Anodyne	ADRB3	61	46
Cc1ccc2c(c1)[C@@H](NC[C@H](O)c1cccnc1)CCC2	ZINC000819315490	CG	On-Demand	Anodyne	KCNN3	15	44
Cc1ccc2c(c1)[C@@H](NC[C@@H](O)c1cccnc1)CCC2	ZINC000819315491	CG	On-Demand	Anodyne	ADRB3	61	46
Cc1ccc2c(c1)[C@@H](NC[C@@H](O)c1cccnc1)CCC2	ZINC000819315491	CG	On-Demand	Anodyne	KCNN3	15	44
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(C(=O)Nc2cccnc2)cc1	ZINC000819315492	FF	On-Demand	Anodyne	NAMPT	62	52
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(C(=O)Nc2cccnc2)cc1	ZINC000819315493	FF	On-Demand	Anodyne	NAMPT	62	52
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(C(=O)Nc2cccnc2)cc1	ZINC000819315494	FF	On-Demand	Anodyne	NAMPT	62	52
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(C(=O)Nc2cccnc2)cc1	ZINC000819315495	FF	On-Demand	Anodyne	NAMPT	62	52
CN(C)CCCOc1cnccc1CNC[C@@H](O)c1ccccc1	ZINC000819315532	EE	On-Demand	Anodyne	ADRB3	31	40
CN(C)CCCOc1cnccc1CNC[C@H](O)c1ccccc1	ZINC000819315533	EE	On-Demand	Anodyne	ADRB3	31	40
O[C@@H](CN[C@@H]1CCCOC1)c1ccc(Cl)c(F)c1	ZINC000819315585	CE	On-Demand	Anodyne	MAPK1	36	40
O[C@H](CN[C@@H]1CCCOC1)c1ccc(Cl)c(F)c1	ZINC000819315586	CE	On-Demand	Anodyne	MAPK1	36	40
O=C(C(F)=C1CCC1)N1CCc2ccc(S(=O)(=O)N3CCCC3)cc21	ZINC000819315587	FF	On-Demand	Anodyne	AKR1C3	52	35
C[C@H]1[C@@H](NC[C@@H](O)c2cc3ccccc3o2)CCN1Cc1ccccc1	ZINC000819315599	FH	On-Demand	Anodyne	SIGMAR1	23	43
C[C@@H]1[C@@H](NC[C@@H](O)c2cc3ccccc3o2)CCN1Cc1ccccc1	ZINC000819315600	FH	On-Demand	Anodyne	SIGMAR1	23	43
C[C@H]1[C@H](NC[C@@H](O)c2cc3ccccc3o2)CCN1Cc1ccccc1	ZINC000819315602	FH	On-Demand	Anodyne	SIGMAR1	23	43
O=C(/C=C/[C@@H]1CCCO1)N1CCc2ccc(S(=O)(=O)N3CCCC3)cc21	ZINC000819315662	GE	On-Demand	Anodyne	AKR1C3	49	35
O=C(/C=C\[C@@H]1CCCO1)N1CCc2ccc(S(=O)(=O)N3CCCC3)cc21	ZINC000819315663	GE	On-Demand	Anodyne	AKR1C3	49	35
O=C(/C=C/[C@H]1CCCO1)N1CCc2ccc(S(=O)(=O)N3CCCC3)cc21	ZINC000819315664	GE	On-Demand	Anodyne	AKR1C3	49	35
O=C(/C=C\[C@H]1CCCO1)N1CCc2ccc(S(=O)(=O)N3CCCC3)cc21	ZINC000819315665	GE	On-Demand	Anodyne	AKR1C3	49	35
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc3sccc3c2)CC1	ZINC000819315679	GH	On-Demand	Anodyne	GPR119	39	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc3sccc3c2)CC1	ZINC000819315683	GH	On-Demand	Anodyne	GPR119	39	45
O=C(/C=C/[C@@H]1CCCO1)NCCc1ccccc1[N+](=O)[O-]	ZINC000819315700	CD	On-Demand	Bother	COLA	72	32
O=C(/C=C\[C@H]1CCCO1)NCCc1ccccc1[N+](=O)[O-]	ZINC000819315701	CD	On-Demand	Bother	COLA	72	32
O=C(/C=C/[C@H]1CCCO1)NCCc1ccccc1[N+](=O)[O-]	ZINC000819315703	CD	On-Demand	Bother	COLA	72	32
O=C(/C=C\[C@@H]1CCCO1)NCCc1ccccc1[N+](=O)[O-]	ZINC000819315704	CD	On-Demand	Bother	COLA	72	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H]1c1ccc(Cl)cc1)C2	ZINC000819315711	FG	On-Demand	Anodyne	SLC6A4	15	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H]1c1ccc(Cl)cc1)C2	ZINC000819315711	FG	On-Demand	Anodyne	SLC6A3	31	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H]1c1ccc(Cl)cc1)C2	ZINC000819315713	FG	On-Demand	Anodyne	SLC6A4	15	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H]1c1ccc(Cl)cc1)C2	ZINC000819315713	FG	On-Demand	Anodyne	SLC6A3	31	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H]1c1ccc(Cl)cc1)C2	ZINC000819315715	FG	On-Demand	Anodyne	SLC6A4	15	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H]1c1ccc(Cl)cc1)C2	ZINC000819315715	FG	On-Demand	Anodyne	SLC6A3	31	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H]1c1ccc(Cl)cc1)C2	ZINC000819315717	FG	On-Demand	Anodyne	SLC6A4	15	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H]1c1ccc(Cl)cc1)C2	ZINC000819315717	FG	On-Demand	Anodyne	SLC6A3	31	42
O=C1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@@H]([C@@H]2CCCO2)N1	ZINC000819315751	ED	On-Demand	Anodyne	ADRB1	28	43
O=C1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@@H]([C@@H]2CCCO2)N1	ZINC000819315751	ED	On-Demand	Anodyne	ADRB3	42	46
O=C1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@@H]([C@@H]2CCCO2)N1	ZINC000819315751	ED	On-Demand	Anodyne	CYP3A4	47	35
O=C1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@H]([C@H]2CCCO2)N1	ZINC000819315752	ED	On-Demand	Anodyne	ADRB1	28	43
O=C1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@H]([C@H]2CCCO2)N1	ZINC000819315752	ED	On-Demand	Anodyne	ADRB3	42	46
O=C1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@H]([C@H]2CCCO2)N1	ZINC000819315752	ED	On-Demand	Anodyne	CYP3A4	47	35
O=C1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@@H]([C@H]2CCCO2)N1	ZINC000819315753	ED	On-Demand	Anodyne	ADRB1	28	43
O=C1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@@H]([C@H]2CCCO2)N1	ZINC000819315753	ED	On-Demand	Anodyne	ADRB3	42	46
O=C1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@@H]([C@H]2CCCO2)N1	ZINC000819315753	ED	On-Demand	Anodyne	CYP3A4	47	35
O=C1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@H]([C@@H]2CCCO2)N1	ZINC000819315755	ED	On-Demand	Anodyne	ADRB1	28	43
O=C1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@H]([C@@H]2CCCO2)N1	ZINC000819315755	ED	On-Demand	Anodyne	ADRB3	42	46
O=C1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@H]([C@@H]2CCCO2)N1	ZINC000819315755	ED	On-Demand	Anodyne	CYP3A4	47	35
COc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nc1	ZINC000819315767	EF	On-Demand	Mild	PAPA1_CARPA	45	47
CN1CCC(CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)(N2CCCCC2)CC1	ZINC000819315818	GD	On-Demand	Anodyne	HCN1	58	37
CN1CCC(CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)(N2CCCCC2)CC1	ZINC000819315818	GD	On-Demand	Anodyne	HCN4	48	30
COc1cccc([S@@](=O)CC(=O)N2CCN(C3=NC[C@H](C)S3)CC2)c1	ZINC000819315820	GD	On-Demand	Anodyne	DRD4	40	31
COc1cccc([S@@](=O)CC(=O)N2CCN(C3=NC[C@@H](C)S3)CC2)c1	ZINC000819315823	GD	On-Demand	Anodyne	DRD4	40	31
COc1cccc([S@](=O)CC(=O)N2CCN(C3=NC[C@@H](C)S3)CC2)c1	ZINC000819315824	GD	On-Demand	Anodyne	DRD4	40	31
COc1cccc([S@](=O)CC(=O)N2CCN(C3=NC[C@H](C)S3)CC2)c1	ZINC000819315825	GD	On-Demand	Anodyne	DRD4	40	31
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2ccccc2)CC1	ZINC000819315869	FH	On-Demand	Anodyne	ADRB3	67	46
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2ccccc2)CC1	ZINC000819315869	FH	On-Demand	Anodyne	ACACB	19	52
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2ccccc2)CC1	ZINC000819315869	FH	On-Demand	Anodyne	REN	43	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccccc2)CC1	ZINC000819315870	FH	On-Demand	Anodyne	ADRB3	67	46
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccccc2)CC1	ZINC000819315870	FH	On-Demand	Anodyne	ACACB	19	52
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccccc2)CC1	ZINC000819315870	FH	On-Demand	Anodyne	REN	43	40
CN(C)c1ccc(NC(=O)CCNCCc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1	ZINC000819315919	GG	On-Demand	Bother	HTR1D	30	40
CN(C)c1ccc(NC(=O)CCNCCc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1	ZINC000819315919	GG	On-Demand	Bother	HTR1B	24	40
CN(C)c1ccc(NC(=O)CCNCCc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1	ZINC000819315919	GG	On-Demand	Bother	MPO	45	38
CN(C)c1ccc(NC(=O)CCNCCc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1	ZINC000819315919	GG	On-Demand	Bother	NMBR	64	41
CN(C)c1ccc(NC(=O)CCNCCc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1	ZINC000819315919	GG	On-Demand	Bother	GRPR	31	41
CC(C)(C)OC(=O)N[C@@H](CNC(=O)C(F)=C1CCC1)c1ccccc1	ZINC000819315930	EH	On-Demand	Anodyne	PAPA1_CARPA	36	41
CC(C)(C)OC(=O)N[C@@H](CNC(=O)C(F)=C1CCC1)c1ccccc1	ZINC000819315930	EH	On-Demand	Anodyne	CTSK	18	44
CC(C)(C)OC(=O)N[C@@H](CNC(=O)C(F)=C1CCC1)c1ccccc1	ZINC000819315930	EH	On-Demand	Anodyne	FPR1	44	36
CSc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819315931	ED	On-Demand	Anodyne	ADRB2	51	52
CSc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819315931	ED	On-Demand	Anodyne	ADRB1	77	52
CSc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819315931	ED	On-Demand	Anodyne	GRIN1	20	47
CSc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819315931	ED	On-Demand	Anodyne	ADRB3	49	52
CSc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819315933	ED	On-Demand	Anodyne	ADRB2	51	52
CSc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819315933	ED	On-Demand	Anodyne	ADRB1	77	52
CSc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819315933	ED	On-Demand	Anodyne	GRIN1	20	47
CSc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819315933	ED	On-Demand	Anodyne	ADRB3	49	52
O=C(NCC1CCN(C(=O)C(F)(F)F)CC1)c1cc2c(cn1)OCCO2	ZINC000819315934	FD	On-Demand	Anodyne	CACNA1I	59	37
O=C(C(F)=C1CCC1)N1CC[C@@H](N2CCOCC2)C1	ZINC000819315936	CD	On-Demand	Anodyne	L3MBTL3	51	39
O=C(C(F)=C1CCC1)N1CC[C@H](N2CCOCC2)C1	ZINC000819315937	CD	On-Demand	Anodyne	L3MBTL3	51	39
COc1cccc([S@@](=O)CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819315941	GE	On-Demand	Mild	HTR1A	24	42
COc1cccc([S@@](=O)CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819315941	GE	On-Demand	Mild	DRD2	20	42
COc1cccc([S@@](=O)CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819315941	GE	On-Demand	Mild	DRD4	47	39
COc1cccc([S@@](=O)CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819315941	GE	On-Demand	Mild	DRD3	22	41
COc1cccc([S@@](=O)CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819315941	GE	On-Demand	Mild	HTR7	15	42
COc1cccc([S@@](=O)CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819315941	GE	On-Demand	Mild	NPY1R	18	40
COc1cccc([S@@](=O)CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819315941	GE	On-Demand	Mild	MTNR1A	18	46
COc1cccc([S@@](=O)CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819315941	GE	On-Demand	Mild	MTNR1B	20	46
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cc(C(=O)OC)ccc2N2CCCC2)ccc1F	ZINC000819315950	JG	On-Demand	Anodyne	KCNQ2	62	36
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cc(C(=O)OC)ccc2N2CCCC2)ccc1F	ZINC000819315950	JG	On-Demand	Anodyne	CPT1A	42	33
CCN(CC)S(=O)(=O)c1cc(C(=O)Nc2cc(C(=O)OC)ccc2N2CCCC2)ccc1F	ZINC000819315950	JG	On-Demand	Anodyne	WDR5	34	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](C)Oc1cccc(OC)c1)C2	ZINC000819315972	GE	On-Demand	Anodyne	MTNR1A	38	60
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](C)Oc1cccc(OC)c1)C2	ZINC000819315972	GE	On-Demand	Anodyne	MTNR1B	37	60
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](C)Oc1cccc(OC)c1)C2	ZINC000819315974	GE	On-Demand	Anodyne	MTNR1A	38	60
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](C)Oc1cccc(OC)c1)C2	ZINC000819315974	GE	On-Demand	Anodyne	MTNR1B	37	60
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](C)Oc1cccc(OC)c1)C2	ZINC000819315976	GE	On-Demand	Anodyne	MTNR1A	38	60
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](C)Oc1cccc(OC)c1)C2	ZINC000819315976	GE	On-Demand	Anodyne	MTNR1B	37	60
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](C)Oc1cccc(OC)c1)C2	ZINC000819315978	GE	On-Demand	Anodyne	MTNR1A	38	60
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](C)Oc1cccc(OC)c1)C2	ZINC000819315978	GE	On-Demand	Anodyne	MTNR1B	37	60
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2ccc(F)cc2F)CC1	ZINC000819315995	GH	On-Demand	Anodyne	CACNA1I	45	33
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccc(F)cc2F)CC1	ZINC000819315997	GH	On-Demand	Anodyne	CACNA1I	45	33
CC(=O)Nc1cccc(CC(=O)N2CCC(O)(c3cccc(C)c3C)CC2)c1	ZINC000819316013	GG	On-Demand	Anodyne	P2RY14	40	33
C=C(C)C(C)(C)C(=O)NCC1CCN(C(=O)C(F)(F)F)CC1	ZINC000819316015	DF	On-Demand	Mild	CACNA1I	50	35
Cn1cncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819316019	FE	On-Demand	Anodyne	CTSD	68	43
Cn1cncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819316019	FE	On-Demand	Anodyne	PGC	55	37
Cn1cncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819316019	FE	On-Demand	Anodyne	PAPA1_CARPA	29	42
Cn1cncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819316019	FE	On-Demand	Anodyne	BACE2	47	40
Cn1cncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819316019	FE	On-Demand	Anodyne	REN	75	48
Cn1cncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819316019	FE	On-Demand	Anodyne	REN1	20	43
Cn1cncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819316019	FE	On-Demand	Anodyne	BACE1	72	44
Cn1cncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819316019	FE	On-Demand	Anodyne	FPR1	47	38
Cc1cc(C)cc(C[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316028	GH	On-Demand	Mild	PAPA1_CARPA	57	47
Cc1cc(C)cc(C[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316028	GH	On-Demand	Mild	CTSK	18	44
Cc1cc(C)cc(C[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316028	GH	On-Demand	Mild	CTSL	20	47
Cc1cc(C)cc(C[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316028	GH	On-Demand	Mild	REN	40	40
Cc1cc(C)cc(C[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316028	GH	On-Demand	Mild	FPR1	51	43
Cc1cc(C)cc(C[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316030	GH	On-Demand	Mild	PAPA1_CARPA	57	47
Cc1cc(C)cc(C[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316030	GH	On-Demand	Mild	CTSK	18	44
Cc1cc(C)cc(C[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316030	GH	On-Demand	Mild	CTSL	20	47
Cc1cc(C)cc(C[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316030	GH	On-Demand	Mild	REN	40	40
Cc1cc(C)cc(C[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316030	GH	On-Demand	Mild	FPR1	51	43
Cc1cc(C)cc(C[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316031	GH	On-Demand	Mild	PAPA1_CARPA	57	47
Cc1cc(C)cc(C[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316031	GH	On-Demand	Mild	CTSK	18	44
Cc1cc(C)cc(C[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316031	GH	On-Demand	Mild	CTSL	20	47
Cc1cc(C)cc(C[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316031	GH	On-Demand	Mild	REN	40	40
Cc1cc(C)cc(C[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316031	GH	On-Demand	Mild	FPR1	51	43
Cc1cc(C)cc(C[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316032	GH	On-Demand	Mild	PAPA1_CARPA	57	47
Cc1cc(C)cc(C[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316032	GH	On-Demand	Mild	CTSK	18	44
Cc1cc(C)cc(C[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316032	GH	On-Demand	Mild	CTSL	20	47
Cc1cc(C)cc(C[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316032	GH	On-Demand	Mild	REN	40	40
Cc1cc(C)cc(C[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819316032	GH	On-Demand	Mild	FPR1	51	43
O=C(Cc1nsc2ccccc12)NCC1CCN(C(=O)C(F)(F)F)CC1	ZINC000819316039	GF	On-Demand	Anodyne	CACNA1I	43	36
O=C(Cc1ccc(-n2cnnc2)cc1)NCC1CCN(C(=O)C(F)(F)F)CC1	ZINC000819316044	GD	On-Demand	Anodyne	CACNA1I	62	45
C[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccc(F)cc2O1	ZINC000819316150	GH	On-Demand	Mild	PAPA1_CARPA	34	42
COc1cccc(O[C@H](C)CNC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819316169	DE	On-Demand	Anodyne	MTNR1A	46	57
COc1cccc(O[C@H](C)CNC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819316169	DE	On-Demand	Anodyne	MTNR1B	41	57
COc1cccc(O[C@H](C)CNC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819316170	DE	On-Demand	Anodyne	MTNR1A	46	57
COc1cccc(O[C@H](C)CNC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819316170	DE	On-Demand	Anodyne	MTNR1B	41	57
COc1cccc(O[C@H](C)CNC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819316171	DE	On-Demand	Anodyne	MTNR1A	46	57
COc1cccc(O[C@H](C)CNC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819316171	DE	On-Demand	Anodyne	MTNR1B	41	57
COc1cccc(O[C@H](C)CNC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819316172	DE	On-Demand	Anodyne	MTNR1A	46	57
COc1cccc(O[C@H](C)CNC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819316172	DE	On-Demand	Anodyne	MTNR1B	41	57
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNCCC(=O)Nc2cccnc2)CC1	ZINC000819316256	GG	On-Demand	Anodyne	NAMPT	26	50
CC(=O)c1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819316266	ED	On-Demand	Anodyne	ADRB2	53	52
CC(=O)c1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819316266	ED	On-Demand	Anodyne	ADRB1	87	52
CC(=O)c1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819316266	ED	On-Demand	Anodyne	GRIN1	18	44
CC(=O)c1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819316266	ED	On-Demand	Anodyne	ADRB3	52	52
CC(=O)c1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819316266	ED	On-Demand	Anodyne	ABCB1	17	62
CC(=O)c1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819316268	ED	On-Demand	Anodyne	ADRB2	53	52
CC(=O)c1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819316268	ED	On-Demand	Anodyne	ADRB1	87	52
CC(=O)c1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819316268	ED	On-Demand	Anodyne	GRIN1	18	44
CC(=O)c1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819316268	ED	On-Demand	Anodyne	ADRB3	52	52
CC(=O)c1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819316268	ED	On-Demand	Anodyne	ABCB1	17	62
O[C@H](CNC[C@H]1COc2ccccc21)c1cccnc1	ZINC000819316288	CD	On-Demand	Anodyne	ADRB3	78	42
O[C@@H](CNC[C@@H]1COc2ccccc21)c1cccnc1	ZINC000819316289	CD	On-Demand	Anodyne	ADRB3	78	42
O[C@H](CNC[C@@H]1COc2ccccc21)c1cccnc1	ZINC000819316290	CD	On-Demand	Anodyne	ADRB3	78	42
O[C@@H](CNC[C@H]1COc2ccccc21)c1cccnc1	ZINC000819316291	CD	On-Demand	Anodyne	ADRB3	78	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3ccccc3)[C@@H](C)C1)C2	ZINC000819316311	FH	On-Demand	Anodyne	SLC6A3	22	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3ccccc3)[C@@H](C)C1)C2	ZINC000819316311	FH	On-Demand	Anodyne	ADAM10	24	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3ccccc3)[C@H](C)C1)C2	ZINC000819316312	FH	On-Demand	Anodyne	SLC6A3	22	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3ccccc3)[C@H](C)C1)C2	ZINC000819316312	FH	On-Demand	Anodyne	ADAM10	24	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3ccccc3)[C@H](C)C1)C2	ZINC000819316313	FH	On-Demand	Anodyne	SLC6A3	22	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3ccccc3)[C@H](C)C1)C2	ZINC000819316313	FH	On-Demand	Anodyne	ADAM10	24	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3ccccc3)[C@@H](C)C1)C2	ZINC000819316314	FH	On-Demand	Anodyne	SLC6A3	22	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3ccccc3)[C@@H](C)C1)C2	ZINC000819316314	FH	On-Demand	Anodyne	ADAM10	24	42
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)c1	ZINC000819316372	GF	On-Demand	Anodyne	GPR119	29	40
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)c1	ZINC000819316373	GF	On-Demand	Anodyne	GPR119	29	40
CCCCN(C)C[C@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819316415	CG	On-Demand	Anodyne	ADRB2	24	48
CCCCN(C)C[C@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819316415	CG	On-Demand	Anodyne	ADRB1	38	49
CCCCN(C)C[C@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819316415	CG	On-Demand	Anodyne	ADRB3	59	49
CCCCN(C)C[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819316416	CG	On-Demand	Anodyne	ADRB2	24	48
CCCCN(C)C[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819316416	CG	On-Demand	Anodyne	ADRB1	38	49
CCCCN(C)C[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819316416	CG	On-Demand	Anodyne	ADRB3	59	49
CCCCN(C)C[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819316418	CG	On-Demand	Anodyne	ADRB2	24	48
CCCCN(C)C[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819316418	CG	On-Demand	Anodyne	ADRB1	38	49
CCCCN(C)C[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819316418	CG	On-Demand	Anodyne	ADRB3	59	49
CCCCN(C)C[C@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819316420	CG	On-Demand	Anodyne	ADRB2	24	48
CCCCN(C)C[C@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819316420	CG	On-Demand	Anodyne	ADRB1	38	49
CCCCN(C)C[C@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819316420	CG	On-Demand	Anodyne	ADRB3	59	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(C3=NC[C@H](C)S3)CC1)C2	ZINC000819316452	GD	On-Demand	Anodyne	NPBWR1	48	30
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(C3=NC[C@@H](C)S3)CC1)C2	ZINC000819316454	GD	On-Demand	Anodyne	NPBWR1	48	30
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(C3=NC[C@@H](C)S3)CC1)C2	ZINC000819316456	GD	On-Demand	Anodyne	NPBWR1	48	30
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(C3=NC[C@H](C)S3)CC1)C2	ZINC000819316459	GD	On-Demand	Anodyne	NPBWR1	48	30
CCC1(O)CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819316509	FE	On-Demand	Mild	GHRHR	42	35
CCC1(O)CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819316509	FE	On-Demand	Mild	PAPA1_CARPA	34	45
CCC1(O)CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819316509	FE	On-Demand	Mild	CTSK	15	40
CCC1(O)CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819316510	FE	On-Demand	Mild	GHRHR	42	35
CCC1(O)CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819316510	FE	On-Demand	Mild	PAPA1_CARPA	34	45
CCC1(O)CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819316510	FE	On-Demand	Mild	CTSK	15	40
CC(C)(C)OC(=O)N1CCN(C(=O)c2cc3c(cn2)OCCO3)C(C)(C)C1	ZINC000819316547	GE	On-Demand	Anodyne	GPR119	19	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2cccnc2)CC1	ZINC000819316569	FG	On-Demand	Anodyne	ADRB2	24	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2cccnc2)CC1	ZINC000819316569	FG	On-Demand	Anodyne	ADRB1	33	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2cccnc2)CC1	ZINC000819316569	FG	On-Demand	Anodyne	ADRB3	105	46
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2cccnc2)CC1	ZINC000819316569	FG	On-Demand	Anodyne	ACACB	15	46
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccnc2)CC1	ZINC000819316570	FG	On-Demand	Anodyne	ADRB2	24	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccnc2)CC1	ZINC000819316570	FG	On-Demand	Anodyne	ADRB1	33	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccnc2)CC1	ZINC000819316570	FG	On-Demand	Anodyne	ADRB3	105	46
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccnc2)CC1	ZINC000819316570	FG	On-Demand	Anodyne	ACACB	15	46
CC(=O)c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)C)c1	ZINC000819316575	ED	On-Demand	Anodyne	ADRB2	53	48
CC(=O)c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)C)c1	ZINC000819316575	ED	On-Demand	Anodyne	ADRB1	81	44
CC(=O)c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)C)c1	ZINC000819316575	ED	On-Demand	Anodyne	ADRB3	51	44
CC(=O)c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)C)c1	ZINC000819316575	ED	On-Demand	Anodyne	ABCB1	24	49
CC(=O)c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)C)c1	ZINC000819316575	ED	On-Demand	Anodyne	PDS	44	35
CC(=O)c1cccc(OC[C@H](O)CNCCS(=O)(=O)C(C)C)c1	ZINC000819316576	ED	On-Demand	Anodyne	ADRB2	53	48
CC(=O)c1cccc(OC[C@H](O)CNCCS(=O)(=O)C(C)C)c1	ZINC000819316576	ED	On-Demand	Anodyne	ADRB1	81	44
CC(=O)c1cccc(OC[C@H](O)CNCCS(=O)(=O)C(C)C)c1	ZINC000819316576	ED	On-Demand	Anodyne	ADRB3	51	44
CC(=O)c1cccc(OC[C@H](O)CNCCS(=O)(=O)C(C)C)c1	ZINC000819316576	ED	On-Demand	Anodyne	ABCB1	24	49
CC(=O)c1cccc(OC[C@H](O)CNCCS(=O)(=O)C(C)C)c1	ZINC000819316576	ED	On-Demand	Anodyne	PDS	44	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1	ZINC000819316581	GG	On-Demand	Anodyne	LUCI_LUCLA	36	43
CON(C)C(=O)CCNCCc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000819316590	DD	On-Demand	Bother	HTR1D	35	40
CON(C)C(=O)CCNCCc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000819316590	DD	On-Demand	Bother	CACNA1D	61	32
CON(C)C(=O)CCNCCc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000819316590	DD	On-Demand	Bother	MPO	53	41
CON(C)C(=O)CCNCCc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000819316590	DD	On-Demand	Bother	NMBR	46	30
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CC[C@H](c3ccccc3)O2)c1	ZINC000819316591	EG	On-Demand	Bother	CACNA1C	46	37
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CC[C@H](c3ccccc3)O2)c1	ZINC000819316591	EG	On-Demand	Bother	CACNA1D	67	37
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CC[C@H](c3ccccc3)O2)c1	ZINC000819316592	EG	On-Demand	Bother	CACNA1C	46	37
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CC[C@H](c3ccccc3)O2)c1	ZINC000819316592	EG	On-Demand	Bother	CACNA1D	67	37
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819316606	GH	On-Demand	Anodyne	ADRB1	32	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819316606	GH	On-Demand	Anodyne	ADRB3	50	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819316606	GH	On-Demand	Anodyne	PAPA1_CARPA	18	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819316606	GH	On-Demand	Anodyne	ACACB	15	45
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819316607	GH	On-Demand	Anodyne	ADRB1	32	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819316607	GH	On-Demand	Anodyne	ADRB3	50	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819316607	GH	On-Demand	Anodyne	PAPA1_CARPA	18	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819316607	GH	On-Demand	Anodyne	ACACB	15	45
CN(C)CCCOc1cnccc1CNC[C@H](O)c1cccnc1	ZINC000819316687	ED	On-Demand	Anodyne	ADRB2	19	43
CN(C)CCCOc1cnccc1CNC[C@H](O)c1cccnc1	ZINC000819316687	ED	On-Demand	Anodyne	ADRB1	23	43
CN(C)CCCOc1cnccc1CNC[C@H](O)c1cccnc1	ZINC000819316687	ED	On-Demand	Anodyne	ADRB3	77	48
CN(C)CCCOc1cnccc1CNC[C@@H](O)c1cccnc1	ZINC000819316689	ED	On-Demand	Anodyne	ADRB2	19	43
CN(C)CCCOc1cnccc1CNC[C@@H](O)c1cccnc1	ZINC000819316689	ED	On-Demand	Anodyne	ADRB1	23	43
CN(C)CCCOc1cnccc1CNC[C@@H](O)c1cccnc1	ZINC000819316689	ED	On-Demand	Anodyne	ADRB3	77	48
CCCCN(C)C[C@H](C)NC[C@@H](O)c1cccnc1	ZINC000819316741	CD	On-Demand	Anodyne	ADRB1	24	49
CCCCN(C)C[C@H](C)NC[C@@H](O)c1cccnc1	ZINC000819316741	CD	On-Demand	Anodyne	ADRB3	59	49
CCCCN(C)C[C@H](C)NC[C@@H](O)c1cccnc1	ZINC000819316741	CD	On-Demand	Anodyne	CYP51A1	17	42
CCCCN(C)C[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819316743	CD	On-Demand	Anodyne	ADRB1	24	49
CCCCN(C)C[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819316743	CD	On-Demand	Anodyne	ADRB3	59	49
CCCCN(C)C[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819316743	CD	On-Demand	Anodyne	CYP51A1	17	42
CCCCN(C)C[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819316744	CD	On-Demand	Anodyne	ADRB1	24	49
CCCCN(C)C[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819316744	CD	On-Demand	Anodyne	ADRB3	59	49
CCCCN(C)C[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819316744	CD	On-Demand	Anodyne	CYP51A1	17	42
CCCCN(C)C[C@H](C)NC[C@H](O)c1cccnc1	ZINC000819316746	CD	On-Demand	Anodyne	ADRB1	24	49
CCCCN(C)C[C@H](C)NC[C@H](O)c1cccnc1	ZINC000819316746	CD	On-Demand	Anodyne	ADRB3	59	49
CCCCN(C)C[C@H](C)NC[C@H](O)c1cccnc1	ZINC000819316746	CD	On-Demand	Anodyne	CYP51A1	17	42
Cc1csc([C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C2CC2)n1	ZINC000819316786	GH	On-Demand	Mild	PAPA1_CARPA	37	40
Cc1csc([C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C2CC2)n1	ZINC000819316790	GH	On-Demand	Mild	PAPA1_CARPA	37	40
C[C@@H]1CC(=O)NCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819316792	FD	On-Demand	Mild	PAPA1_CARPA	35	41
C[C@@H]1CC(=O)NCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819316794	FD	On-Demand	Mild	PAPA1_CARPA	35	41
C[C@H]1CC(=O)NCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819316797	FD	On-Demand	Mild	PAPA1_CARPA	35	41
C[C@H]1CC(=O)NCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819316799	FD	On-Demand	Mild	PAPA1_CARPA	35	41
Cc1cc(OC[C@@H](O)CNCCS(=O)(=O)C(C)C)c(C(C)C)cc1Cl	ZINC000819316808	GF	On-Demand	Anodyne	ADRB2	24	41
Cc1cc(OC[C@H](O)CNCCS(=O)(=O)C(C)C)c(C(C)C)cc1Cl	ZINC000819316814	GF	On-Demand	Anodyne	ADRB2	24	41
CC(=O)Nc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819316835	FC	On-Demand	Anodyne	ADRB2	59	63
CC(=O)Nc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819316835	FC	On-Demand	Anodyne	ADRB1	100	63
CC(=O)Nc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819316835	FC	On-Demand	Anodyne	GRIN1	31	48
CC(=O)Nc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819316835	FC	On-Demand	Anodyne	ADRB3	65	62
CC(=O)Nc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819316836	FC	On-Demand	Anodyne	ADRB2	59	63
CC(=O)Nc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819316836	FC	On-Demand	Anodyne	ADRB1	100	63
CC(=O)Nc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819316836	FC	On-Demand	Anodyne	GRIN1	31	48
CC(=O)Nc1ccc(OC[C@H](O)CNCCS(=O)(=O)C(C)C)cc1	ZINC000819316836	FC	On-Demand	Anodyne	ADRB3	65	62
CC(C)(C)OC(=O)NC[C@H]1CCC[C@H]1NC(=O)c1coc(=O)c2ccccc12	ZINC000819316838	GG	On-Demand	Anodyne	ACACB	16	45
CC(C)(C)OC(=O)NC[C@H]1CCC[C@@H]1NC(=O)c1coc(=O)c2ccccc12	ZINC000819316840	GG	On-Demand	Anodyne	ACACB	16	45
CC(C)(C)OC(=O)NC[C@@H]1CCC[C@@H]1NC(=O)c1coc(=O)c2ccccc12	ZINC000819316843	GG	On-Demand	Anodyne	ACACB	16	45
CC(C)(C)OC(=O)NC[C@@H]1CCC[C@H]1NC(=O)c1coc(=O)c2ccccc12	ZINC000819316845	GG	On-Demand	Anodyne	ACACB	16	45
CN(C)CCCOc1cnccc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819316847	FF	On-Demand	Anodyne	ADRB1	42	42
CN(C)CCCOc1cnccc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819316847	FF	On-Demand	Anodyne	ADRB3	53	42
CN(C)CCCOc1cnccc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819316849	FF	On-Demand	Anodyne	ADRB1	42	42
CN(C)CCCOc1cnccc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819316849	FF	On-Demand	Anodyne	ADRB3	53	42
CS(=O)(=O)c1ccc([C@@H](O)CNCc2noc3c2CCCC3)cc1	ZINC000819316864	FD	On-Demand	Anodyne	ADRB3	48	37
CS(=O)(=O)c1ccc([C@H](O)CNCc2noc3c2CCCC3)cc1	ZINC000819316866	FD	On-Demand	Anodyne	ADRB3	48	37
O[C@@H](CNC[C@H]1CC[C@H](c2ccccc2)O1)c1cccnc1	ZINC000819316890	CF	On-Demand	Anodyne	ADRB2	17	40
O[C@@H](CNC[C@H]1CC[C@H](c2ccccc2)O1)c1cccnc1	ZINC000819316890	CF	On-Demand	Anodyne	ADRB3	75	46
O[C@H](CNC[C@H]1CC[C@H](c2ccccc2)O1)c1cccnc1	ZINC000819316891	CF	On-Demand	Anodyne	ADRB2	17	40
O[C@H](CNC[C@H]1CC[C@H](c2ccccc2)O1)c1cccnc1	ZINC000819316891	CF	On-Demand	Anodyne	ADRB3	75	46
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819316905	GH	On-Demand	Anodyne	ADRB2	15	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819316905	GH	On-Demand	Anodyne	ADRB3	30	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819316905	GH	On-Demand	Anodyne	ACACB	15	43
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819316909	GH	On-Demand	Anodyne	ADRB2	15	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819316909	GH	On-Demand	Anodyne	ADRB3	30	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819316909	GH	On-Demand	Anodyne	ACACB	15	43
Cc1cnc([C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C2CC2)s1	ZINC000819316913	GH	On-Demand	Mild	PAPA1_CARPA	36	40
O=C(NCCc1ccccc1[N+](=O)[O-])C(F)=C1CCC1	ZINC000819316915	CF	On-Demand	Bother	COLA	106	35
O[C@@H](CNC[C@H]1COc2ccccc21)c1cccc(Cl)c1	ZINC000819316932	DG	On-Demand	Anodyne	ADRB1	26	40
O[C@@H](CNC[C@H]1COc2ccccc21)c1cccc(Cl)c1	ZINC000819316932	DG	On-Demand	Anodyne	ADRB3	39	41
O[C@@H](CNC[C@@H]1COc2ccccc21)c1cccc(Cl)c1	ZINC000819316933	DG	On-Demand	Anodyne	ADRB1	26	40
O[C@@H](CNC[C@@H]1COc2ccccc21)c1cccc(Cl)c1	ZINC000819316933	DG	On-Demand	Anodyne	ADRB3	39	41
O[C@H](CNC[C@@H]1COc2ccccc21)c1cccc(Cl)c1	ZINC000819316934	DG	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CNC[C@@H]1COc2ccccc21)c1cccc(Cl)c1	ZINC000819316934	DG	On-Demand	Anodyne	ADRB3	39	41
O[C@H](CNC[C@H]1COc2ccccc21)c1cccc(Cl)c1	ZINC000819316935	DG	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CNC[C@H]1COc2ccccc21)c1cccc(Cl)c1	ZINC000819316935	DG	On-Demand	Anodyne	ADRB3	39	41
Cc1ccc(N2CCC[C@@H](NC(=O)Cc3ccc(-n4cnnc4)cc3)C2)cc1	ZINC000819317027	GF	On-Demand	Anodyne	BIRC2	35	42
CN1CCC(CNC(=O)C(F)=C2CCC2)(N2CCCCC2)CC1	ZINC000819317049	DE	On-Demand	Anodyne	HCN1	61	39
CN1CCC(CNC(=O)C(F)=C2CCC2)(N2CCCCC2)CC1	ZINC000819317049	DE	On-Demand	Anodyne	HCN4	50	32
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OC(C)(C)C)CC2(C)C)c1	ZINC000819317057	GG	On-Demand	Anodyne	GPR119	22	40
Cc1ccc(N2CCC[C@@H](NC(=O)c3coc(=O)c4ccccc34)C2)cc1	ZINC000819317061	FH	On-Demand	Anodyne	INHA	60	35
Cc1ccc(N2CCC[C@@H](NC(=O)c3coc(=O)c4ccccc34)C2)cc1	ZINC000819317061	FH	On-Demand	Anodyne	CCR8	47	37
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2c(F)cccc2F)CC1	ZINC000819317116	GH	On-Demand	Anodyne	ACACB	16	45
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2c(F)cccc2F)CC1	ZINC000819317117	GH	On-Demand	Anodyne	ACACB	16	45
CN(C[C@@H](O)CNCCc1c[nH]c2ccc([N+](=O)[O-])cc12)C(=O)OC(C)(C)C	ZINC000819317141	GE	On-Demand	Bother	NMBR	47	31
CN(C[C@H](O)CNCCc1c[nH]c2ccc([N+](=O)[O-])cc12)C(=O)OC(C)(C)C	ZINC000819317142	GE	On-Demand	Bother	NMBR	47	31
O[C@@H](CNC[C@H]1CC[C@H](c2ccccc2)O1)c1cccc(Cl)c1	ZINC000819317158	EH	On-Demand	Anodyne	ADRB1	29	41
O[C@@H](CNC[C@H]1CC[C@H](c2ccccc2)O1)c1cccc(Cl)c1	ZINC000819317158	EH	On-Demand	Anodyne	ADRB3	43	42
O[C@H](CNC[C@H]1CC[C@H](c2ccccc2)O1)c1cccc(Cl)c1	ZINC000819317159	EH	On-Demand	Anodyne	ADRB1	29	41
O[C@H](CNC[C@H]1CC[C@H](c2ccccc2)O1)c1cccc(Cl)c1	ZINC000819317159	EH	On-Demand	Anodyne	ADRB3	43	42
Cc1cnc([C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C2CC2)s1	ZINC000819317165	GH	On-Demand	Mild	PAPA1_CARPA	36	40
C[C@@H]1Oc2ccccc2[C@H]1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819317178	GG	On-Demand	Anodyne	GPR119	43	46
C[C@@H]1Oc2ccccc2[C@@H]1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819317180	GG	On-Demand	Anodyne	GPR119	43	46
C[C@@H]1Oc2ccccc2[C@@H]1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819317183	GG	On-Demand	Anodyne	GPR119	43	46
C[C@@H]1Oc2ccccc2[C@H]1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819317185	GG	On-Demand	Anodyne	GPR119	43	46
N#Cc1ccccc1N1CCC(NC(=O)Cc2nsc3ccccc23)CC1	ZINC000819317200	GG	On-Demand	Mild	HTR1A	19	40
C[C@@H]1[C@@H](NC[C@@H](O)c2cccnc2)CCN1Cc1ccccc1	ZINC000819317209	DE	On-Demand	Anodyne	ADRB1	22	42
C[C@@H]1[C@@H](NC[C@@H](O)c2cccnc2)CCN1Cc1ccccc1	ZINC000819317209	DE	On-Demand	Anodyne	ADRB3	70	44
C[C@@H]1[C@@H](NC[C@@H](O)c2cccnc2)CCN1Cc1ccccc1	ZINC000819317209	DE	On-Demand	Anodyne	CHRNA7	21	41
C[C@@H]1[C@@H](NC[C@H](O)c2cccnc2)CCN1Cc1ccccc1	ZINC000819317213	DE	On-Demand	Anodyne	ADRB1	22	42
C[C@@H]1[C@@H](NC[C@H](O)c2cccnc2)CCN1Cc1ccccc1	ZINC000819317213	DE	On-Demand	Anodyne	ADRB3	70	44
C[C@@H]1[C@@H](NC[C@H](O)c2cccnc2)CCN1Cc1ccccc1	ZINC000819317213	DE	On-Demand	Anodyne	CHRNA7	21	41
C[C@H]1CN(C(=O)c2cc3c(cn2)OCCO3)CCN1C(=O)OC(C)(C)C	ZINC000819317277	FD	On-Demand	Anodyne	GPR119	21	41
CON(C)C(=O)CCN[C@@H]1CCN(Cc2ccccc2)[C@@H]1C	ZINC000819317280	DD	On-Demand	Anodyne	DRD4	15	49
CON(C)C(=O)CCN[C@@H]1CCN(Cc2ccccc2)[C@@H]1C	ZINC000819317280	DD	On-Demand	Anodyne	DRD3	15	49
CON(C)C(=O)CCN[C@@H]1CCN(Cc2ccccc2)[C@H]1C	ZINC000819317281	DD	On-Demand	Anodyne	DRD4	15	49
CON(C)C(=O)CCN[C@@H]1CCN(Cc2ccccc2)[C@H]1C	ZINC000819317281	DD	On-Demand	Anodyne	DRD3	15	49
CON(C)C(=O)CCN[C@H]1CCN(Cc2ccccc2)[C@H]1C	ZINC000819317282	DD	On-Demand	Anodyne	DRD4	15	49
CON(C)C(=O)CCN[C@H]1CCN(Cc2ccccc2)[C@H]1C	ZINC000819317282	DD	On-Demand	Anodyne	DRD3	15	49
CON(C)C(=O)CCN[C@H]1CCN(Cc2ccccc2)[C@@H]1C	ZINC000819317283	DD	On-Demand	Anodyne	DRD4	15	49
CON(C)C(=O)CCN[C@H]1CCN(Cc2ccccc2)[C@@H]1C	ZINC000819317283	DD	On-Demand	Anodyne	DRD3	15	49
O=C(c1cc([N+](=O)[O-])ccc1N1CCOCC1)N1CCC[C@H](O)CC1	ZINC000819317303	ED	On-Demand	Bother	SLC6A9	24	66
O=C(c1cc([N+](=O)[O-])ccc1N1CCOCC1)N1CCC[C@@H](O)CC1	ZINC000819317304	ED	On-Demand	Bother	SLC6A9	24	66
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CCC[C@@H](O)CC1	ZINC000819317305	IH	On-Demand	Anodyne	CPT2	42	37
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CCC[C@@H](O)CC1	ZINC000819317305	IH	On-Demand	Anodyne	PREP	129	58
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CCC[C@@H](O)CC1	ZINC000819317305	IH	On-Demand	Anodyne	LGMN	64	36
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CCC[C@@H](O)CC1	ZINC000819317305	IH	On-Demand	Anodyne	WNT3	46	36
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CCC[C@H](O)CC1	ZINC000819317306	IH	On-Demand	Anodyne	CPT2	42	37
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CCC[C@H](O)CC1	ZINC000819317306	IH	On-Demand	Anodyne	PREP	129	58
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CCC[C@H](O)CC1	ZINC000819317306	IH	On-Demand	Anodyne	LGMN	64	36
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CCC[C@H](O)CC1	ZINC000819317306	IH	On-Demand	Anodyne	WNT3	46	36
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819317315	HG	On-Demand	Anodyne	SFRP1	47	39
CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819317316	HG	On-Demand	Anodyne	SFRP1	47	39
NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](O)CC2)ccc1F	ZINC000819317317	DC	On-Demand	Anodyne	L3MBTL3	88	41
NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](O)CC2)ccc1F	ZINC000819317318	DC	On-Demand	Anodyne	L3MBTL3	88	41
O=C(N[C@@]1(C(=O)N2CCC[C@@H](O)CC2)CCOC1)OCc1ccccc1	ZINC000819317323	FD	On-Demand	Anodyne	GRIN2B	19	40
O=C(N[C@@]1(C(=O)N2CCC[C@@H](O)CC2)CCOC1)OCc1ccccc1	ZINC000819317323	FD	On-Demand	Anodyne	CTSK	17	42
O=C(N[C@@]1(C(=O)N2CCC[C@@H](O)CC2)CCOC1)OCc1ccccc1	ZINC000819317323	FD	On-Demand	Anodyne	PREP	26	40
O=C(N[C@@]1(C(=O)N2CCC[C@@H](O)CC2)CCOC1)OCc1ccccc1	ZINC000819317323	FD	On-Demand	Anodyne	SLC12A5	68	40
O=C(N[C@@]1(C(=O)N2CCC[C@H](O)CC2)CCOC1)OCc1ccccc1	ZINC000819317324	FD	On-Demand	Anodyne	GRIN2B	19	40
O=C(N[C@@]1(C(=O)N2CCC[C@H](O)CC2)CCOC1)OCc1ccccc1	ZINC000819317324	FD	On-Demand	Anodyne	CTSK	17	42
O=C(N[C@@]1(C(=O)N2CCC[C@H](O)CC2)CCOC1)OCc1ccccc1	ZINC000819317324	FD	On-Demand	Anodyne	PREP	26	40
O=C(N[C@@]1(C(=O)N2CCC[C@H](O)CC2)CCOC1)OCc1ccccc1	ZINC000819317324	FD	On-Demand	Anodyne	SLC12A5	68	40
O=C(N[C@]1(C(=O)N2CCC[C@H](O)CC2)CCOC1)OCc1ccccc1	ZINC000819317325	FD	On-Demand	Anodyne	GRIN2B	19	40
O=C(N[C@]1(C(=O)N2CCC[C@H](O)CC2)CCOC1)OCc1ccccc1	ZINC000819317325	FD	On-Demand	Anodyne	CTSK	17	42
O=C(N[C@]1(C(=O)N2CCC[C@H](O)CC2)CCOC1)OCc1ccccc1	ZINC000819317325	FD	On-Demand	Anodyne	PREP	26	40
O=C(N[C@]1(C(=O)N2CCC[C@H](O)CC2)CCOC1)OCc1ccccc1	ZINC000819317325	FD	On-Demand	Anodyne	SLC12A5	68	40
O=C(N[C@]1(C(=O)N2CCC[C@@H](O)CC2)CCOC1)OCc1ccccc1	ZINC000819317326	FD	On-Demand	Anodyne	GRIN2B	19	40
O=C(N[C@]1(C(=O)N2CCC[C@@H](O)CC2)CCOC1)OCc1ccccc1	ZINC000819317326	FD	On-Demand	Anodyne	CTSK	17	42
O=C(N[C@]1(C(=O)N2CCC[C@@H](O)CC2)CCOC1)OCc1ccccc1	ZINC000819317326	FD	On-Demand	Anodyne	PREP	26	40
O=C(N[C@]1(C(=O)N2CCC[C@@H](O)CC2)CCOC1)OCc1ccccc1	ZINC000819317326	FD	On-Demand	Anodyne	SLC12A5	68	40
O=C(c1ccc(NS(=O)(=O)/C=C\c2ccccc2)cc1)N1CCC[C@H](O)CC1	ZINC000819317331	HG	On-Demand	Anodyne	SFRP1	50	38
O=C(c1ccc(NS(=O)(=O)/C=C\c2ccccc2)cc1)N1CCC[C@H](O)CC1	ZINC000819317331	HG	On-Demand	Anodyne	L3MBTL3	82	39
O=C(c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1)N1CCC[C@@H](O)CC1	ZINC000819317332	HG	On-Demand	Anodyne	SFRP1	50	38
O=C(c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1)N1CCC[C@@H](O)CC1	ZINC000819317332	HG	On-Demand	Anodyne	L3MBTL3	82	39
O=C(c1ccc(NS(=O)(=O)/C=C\c2ccccc2)cc1)N1CCC[C@@H](O)CC1	ZINC000819317333	HG	On-Demand	Anodyne	SFRP1	50	38
O=C(c1ccc(NS(=O)(=O)/C=C\c2ccccc2)cc1)N1CCC[C@@H](O)CC1	ZINC000819317333	HG	On-Demand	Anodyne	L3MBTL3	82	39
O=C(c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1)N1CCC[C@H](O)CC1	ZINC000819317334	HG	On-Demand	Anodyne	SFRP1	50	38
O=C(c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1)N1CCC[C@H](O)CC1	ZINC000819317334	HG	On-Demand	Anodyne	L3MBTL3	82	39
O=C(c1cnn(-c2cccc(Cl)c2)n1)N1CCC[C@@H](O)CC1	ZINC000819317341	DD	On-Demand	Anodyne	GRM5	15	43
O=C(c1cnn(-c2cccc(Cl)c2)n1)N1CCC[C@@H](O)CC1	ZINC000819317341	DD	On-Demand	Anodyne	HPGD	29	41
O=C(c1cnn(-c2cccc(Cl)c2)n1)N1CCC[C@H](O)CC1	ZINC000819317342	DD	On-Demand	Anodyne	GRM5	15	43
O=C(c1cnn(-c2cccc(Cl)c2)n1)N1CCC[C@H](O)CC1	ZINC000819317342	DD	On-Demand	Anodyne	HPGD	29	41
O=C(CN1C(=O)COc2ccc(Cl)cc21)N1CCC[C@@H](O)CC1	ZINC000819317343	ED	On-Demand	Anodyne	UTS2R	19	44
O=C(CN1C(=O)COc2ccc(Cl)cc21)N1CCC[C@H](O)CC1	ZINC000819317344	ED	On-Demand	Anodyne	UTS2R	19	44
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)N1CCC[C@H](O)CC1	ZINC000819317349	FE	On-Demand	Anodyne	L3MBTL3	47	37
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)N1CCC[C@@H](O)CC1	ZINC000819317350	FE	On-Demand	Anodyne	L3MBTL3	47	37
NS(=O)(=O)c1ccc(F)c(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819317351	DC	On-Demand	Anodyne	PARP1	41	38
NS(=O)(=O)c1ccc(F)c(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819317351	DC	On-Demand	Anodyne	L3MBTL3	53	34
NS(=O)(=O)c1ccc(F)c(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819317352	DC	On-Demand	Anodyne	PARP1	41	38
NS(=O)(=O)c1ccc(F)c(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819317352	DC	On-Demand	Anodyne	L3MBTL3	53	34
O=C(c1c[nH]c2cccc(F)c12)N1CCC[C@H](O)CC1	ZINC000819317355	CE	On-Demand	Anodyne	L3MBTL3	49	37
O=C(c1c[nH]c2cccc(F)c12)N1CCC[C@@H](O)CC1	ZINC000819317356	CE	On-Demand	Anodyne	L3MBTL3	49	37
C#Cc1cncc(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819317357	BD	On-Demand	Mild	L3MBTL3	82	40
C#Cc1cncc(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819317358	BD	On-Demand	Mild	L3MBTL3	82	40
CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)N3CCC[C@H](O)CC3)ccc2F)CC1	ZINC000819317363	IC	On-Demand	Anodyne	CNR2	17	48
CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)N3CCC[C@H](O)CC3)ccc2F)CC1	ZINC000819317363	IC	On-Demand	Anodyne	L3MBTL3	75	39
CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)N3CCC[C@@H](O)CC3)ccc2F)CC1	ZINC000819317365	IC	On-Demand	Anodyne	CNR2	17	48
CC(=O)N1CCN(S(=O)(=O)c2cc(C(=O)N3CCC[C@@H](O)CC3)ccc2F)CC1	ZINC000819317365	IC	On-Demand	Anodyne	L3MBTL3	75	39
CC(C)(C)OC(=O)N1CCC(Cc2ccccc2C(=O)N2CCC[C@H](O)CC2)CC1	ZINC000819317368	HH	On-Demand	Anodyne	CHRM2	17	40
CC(C)(C)OC(=O)N1CCC(Cc2ccccc2C(=O)N2CCC[C@H](O)CC2)CC1	ZINC000819317368	HH	On-Demand	Anodyne	GRIN2B	48	38
CC(C)(C)OC(=O)N1CCC(Cc2ccccc2C(=O)N2CCC[C@H](O)CC2)CC1	ZINC000819317368	HH	On-Demand	Anodyne	GPR119	42	43
CC(C)(C)OC(=O)N1CCC(Cc2ccccc2C(=O)N2CCC[C@@H](O)CC2)CC1	ZINC000819317371	HH	On-Demand	Anodyne	CHRM2	17	40
CC(C)(C)OC(=O)N1CCC(Cc2ccccc2C(=O)N2CCC[C@@H](O)CC2)CC1	ZINC000819317371	HH	On-Demand	Anodyne	GRIN2B	48	38
CC(C)(C)OC(=O)N1CCC(Cc2ccccc2C(=O)N2CCC[C@@H](O)CC2)CC1	ZINC000819317371	HH	On-Demand	Anodyne	GPR119	42	43
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1CCC[C@@H](O)CC1	ZINC000819317373	FD	On-Demand	Anodyne	CCR8	87	36
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1CCC[C@@H](O)CC1	ZINC000819317373	FD	On-Demand	Anodyne	SFRP1	128	40
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1CCC[C@@H](O)CC1	ZINC000819317373	FD	On-Demand	Anodyne	WNT3	87	37
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1CCC[C@H](O)CC1	ZINC000819317374	FD	On-Demand	Anodyne	CCR8	87	36
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1CCC[C@H](O)CC1	ZINC000819317374	FD	On-Demand	Anodyne	SFRP1	128	40
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1CCC[C@H](O)CC1	ZINC000819317374	FD	On-Demand	Anodyne	WNT3	87	37
O=C(c1ccnc(-n2ccnc2)c1)N1CCC[C@@H](O)CC1	ZINC000819317376	CD	On-Demand	Anodyne	NOS2	57	35
O=C(c1ccnc(-n2ccnc2)c1)N1CCC[C@@H](O)CC1	ZINC000819317376	CD	On-Demand	Anodyne	L3MBTL3	76	38
O=C(c1ccnc(-n2ccnc2)c1)N1CCC[C@@H](O)CC1	ZINC000819317376	CD	On-Demand	Anodyne	HPGD	43	36
O=C(c1ccnc(-n2ccnc2)c1)N1CCC[C@H](O)CC1	ZINC000819317378	CD	On-Demand	Anodyne	NOS2	57	35
O=C(c1ccnc(-n2ccnc2)c1)N1CCC[C@H](O)CC1	ZINC000819317378	CD	On-Demand	Anodyne	L3MBTL3	76	38
O=C(c1ccnc(-n2ccnc2)c1)N1CCC[C@H](O)CC1	ZINC000819317378	CD	On-Demand	Anodyne	HPGD	43	36
O=C(c1cc(OCc2ccccc2)ccn1)N1CCC[C@H](O)CC1	ZINC000819317380	EF	On-Demand	Anodyne	KCNH2	17	41
O=C(c1cc(OCc2ccccc2)ccn1)N1CCC[C@H](O)CC1	ZINC000819317380	EF	On-Demand	Anodyne	GRIN2B	49	39
O=C(c1cc(OCc2ccccc2)ccn1)N1CCC[C@H](O)CC1	ZINC000819317380	EF	On-Demand	Anodyne	PREP	53	39
O=C(c1cc(OCc2ccccc2)ccn1)N1CCC[C@H](O)CC1	ZINC000819317380	EF	On-Demand	Anodyne	SLC12A5	48	36
O=C(c1cc(OCc2ccccc2)ccn1)N1CCC[C@@H](O)CC1	ZINC000819317382	EF	On-Demand	Anodyne	KCNH2	17	41
O=C(c1cc(OCc2ccccc2)ccn1)N1CCC[C@@H](O)CC1	ZINC000819317382	EF	On-Demand	Anodyne	GRIN2B	49	39
O=C(c1cc(OCc2ccccc2)ccn1)N1CCC[C@@H](O)CC1	ZINC000819317382	EF	On-Demand	Anodyne	PREP	53	39
O=C(c1cc(OCc2ccccc2)ccn1)N1CCC[C@@H](O)CC1	ZINC000819317382	EF	On-Demand	Anodyne	SLC12A5	48	36
NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](O)CC2)ccc1Cl	ZINC000819317388	EC	On-Demand	Anodyne	CA2	15	44
NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](O)CC2)ccc1Cl	ZINC000819317388	EC	On-Demand	Anodyne	CA6	22	43
NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](O)CC2)ccc1Cl	ZINC000819317388	EC	On-Demand	Anodyne	CA7	22	43
NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](O)CC2)ccc1Cl	ZINC000819317388	EC	On-Demand	Anodyne	CA13	38	43
NS(=O)(=O)c1cc(C(=O)N2CCC[C@H](O)CC2)ccc1Cl	ZINC000819317388	EC	On-Demand	Anodyne	L3MBTL3	86	41
NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](O)CC2)ccc1Cl	ZINC000819317395	EC	On-Demand	Anodyne	CA2	15	44
NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](O)CC2)ccc1Cl	ZINC000819317395	EC	On-Demand	Anodyne	CA6	22	43
NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](O)CC2)ccc1Cl	ZINC000819317395	EC	On-Demand	Anodyne	CA7	22	43
NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](O)CC2)ccc1Cl	ZINC000819317395	EC	On-Demand	Anodyne	CA13	38	43
NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H](O)CC2)ccc1Cl	ZINC000819317395	EC	On-Demand	Anodyne	L3MBTL3	86	41
O=C(c1ccn(-c2ccccc2Cl)n1)N1CCC[C@@H](O)CC1	ZINC000819317422	DF	On-Demand	Anodyne	L3MBTL3	52	36
O=C(c1ccn(-c2ccccc2Cl)n1)N1CCC[C@H](O)CC1	ZINC000819317424	DF	On-Demand	Anodyne	L3MBTL3	52	36
O=C(c1ccnc(C(F)(F)F)c1)N1CCC[C@H](O)CC1	ZINC000819317449	CE	On-Demand	Anodyne	RBP4	24	41
O=C(c1ccnc(C(F)(F)F)c1)N1CCC[C@H](O)CC1	ZINC000819317449	CE	On-Demand	Anodyne	MLYCD	18	40
O=C(c1ccnc(C(F)(F)F)c1)N1CCC[C@H](O)CC1	ZINC000819317449	CE	On-Demand	Anodyne	L3MBTL3	86	40
O=C(c1ccnc(C(F)(F)F)c1)N1CCC[C@H](O)CC1	ZINC000819317449	CE	On-Demand	Anodyne	HPGD	44	45
O=C(c1ccnc(C(F)(F)F)c1)N1CCC[C@@H](O)CC1	ZINC000819317452	CE	On-Demand	Anodyne	RBP4	24	41
O=C(c1ccnc(C(F)(F)F)c1)N1CCC[C@@H](O)CC1	ZINC000819317452	CE	On-Demand	Anodyne	MLYCD	18	40
O=C(c1ccnc(C(F)(F)F)c1)N1CCC[C@@H](O)CC1	ZINC000819317452	CE	On-Demand	Anodyne	L3MBTL3	86	40
O=C(c1ccnc(C(F)(F)F)c1)N1CCC[C@@H](O)CC1	ZINC000819317452	CE	On-Demand	Anodyne	HPGD	44	45
O=C(c1cnn(Cc2ccccc2)c1Cl)N1CCC[C@H](O)CC1	ZINC000819317454	EF	On-Demand	Anodyne	PREP	56	35
O=C(c1cnn(Cc2ccccc2)c1Cl)N1CCC[C@H](O)CC1	ZINC000819317454	EF	On-Demand	Anodyne	L3MBTL3	41	38
O=C(c1cnn(Cc2ccccc2)c1Cl)N1CCC[C@@H](O)CC1	ZINC000819317458	EF	On-Demand	Anodyne	PREP	56	35
O=C(c1cnn(Cc2ccccc2)c1Cl)N1CCC[C@@H](O)CC1	ZINC000819317458	EF	On-Demand	Anodyne	L3MBTL3	41	38
CCCCN(C)C[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819317464	CE	On-Demand	Anodyne	ADRB1	16	44
CCCCN(C)C[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819317464	CE	On-Demand	Anodyne	AOC3	22	42
CCCCN(C)C[C@H](C)NC[C@@H](O)c1ccccc1	ZINC000819317465	CE	On-Demand	Anodyne	ADRB1	16	44
CCCCN(C)C[C@H](C)NC[C@@H](O)c1ccccc1	ZINC000819317465	CE	On-Demand	Anodyne	AOC3	22	42
CCCCN(C)C[C@H](C)NC[C@H](O)c1ccccc1	ZINC000819317466	CE	On-Demand	Anodyne	ADRB1	16	44
CCCCN(C)C[C@H](C)NC[C@H](O)c1ccccc1	ZINC000819317466	CE	On-Demand	Anodyne	AOC3	22	42
CCCCN(C)C[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819317467	CE	On-Demand	Anodyne	ADRB1	16	44
CCCCN(C)C[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819317467	CE	On-Demand	Anodyne	AOC3	22	42
CC(=O)Nc1cccc(CC(=O)NC2CCN(c3ccc(N(C)C)cc3)CC2)c1	ZINC000819317512	GG	On-Demand	Anodyne	SIGMAR1	18	43
CC(=O)Nc1cccc(CC(=O)NC2CCN(c3ccc(N(C)C)cc3)CC2)c1	ZINC000819317512	GG	On-Demand	Anodyne	EPHX2	15	40
CC(=O)Nc1cccc(CC(=O)NC2CCN(c3ccc(N(C)C)cc3)CC2)c1	ZINC000819317512	GG	On-Demand	Anodyne	MCHR1	26	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2ccccc2F)CC1	ZINC000819317538	GH	On-Demand	Anodyne	PAPA1_CARPA	27	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2ccccc2F)CC1	ZINC000819317538	GH	On-Demand	Anodyne	ACACB	16	46
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccccc2F)CC1	ZINC000819317539	GH	On-Demand	Anodyne	PAPA1_CARPA	27	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccccc2F)CC1	ZINC000819317539	GH	On-Demand	Anodyne	ACACB	16	46
O=[N+]([O-])c1ccc2[nH]cc(CCNC[C@@H](O)c3ccc(C(F)(F)F)cc3)c2c1	ZINC000819317561	GH	On-Demand	Bother	MPO	54	40
O=[N+]([O-])c1ccc2[nH]cc(CCNC[C@H](O)c3ccc(C(F)(F)F)cc3)c2c1	ZINC000819317562	GH	On-Demand	Bother	MPO	54	40
O=[N+]([O-])c1ccc2[nH]cc(CCNC[C@H](O)C3CC3)c2c1	ZINC000819317575	CD	On-Demand	Bother	HTR1B	29	40
O=[N+]([O-])c1ccc2[nH]cc(CCNC[C@H](O)C3CC3)c2c1	ZINC000819317575	CD	On-Demand	Bother	MPO	61	41
O=[N+]([O-])c1ccc2[nH]cc(CCNC[C@@H](O)C3CC3)c2c1	ZINC000819317576	CD	On-Demand	Bother	HTR1B	29	40
O=[N+]([O-])c1ccc2[nH]cc(CCNC[C@@H](O)C3CC3)c2c1	ZINC000819317576	CD	On-Demand	Bother	MPO	61	41
CN(C)CCCOc1cnccc1CNC[C@H](O)c1ccc(Cl)cc1	ZINC000819317633	FF	On-Demand	Anodyne	UTS2	40	31
O=C(c1ccccc1Nc1ccc(SC(F)F)cc1)N1CCC[C@H](O)CC1	ZINC000819317709	GJ	On-Demand	Anodyne	L3MBTL3	45	42
O=C(c1ccccc1Nc1ccc(SC(F)F)cc1)N1CCC[C@@H](O)CC1	ZINC000819317712	GJ	On-Demand	Anodyne	L3MBTL3	45	42
COc1cc(CNC(=O)C(F)=C2CCC2)c2ccccc2n1	ZINC000819317728	DG	On-Demand	Anodyne	BCHE	65	37
COc1cc(CNC(=O)C(F)=C2CCC2)c2ccccc2n1	ZINC000819317728	DG	On-Demand	Anodyne	ALS	63	34
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCN(c3ccc(C)cc3)C2=O)c1	ZINC000819317731	GF	On-Demand	Anodyne	MCHR1	24	41
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCN(c3ccc(C)cc3)C2=O)c1	ZINC000819317734	GF	On-Demand	Anodyne	MCHR1	24	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1ccccc1[N+](=O)[O-])C2	ZINC000819317762	FE	On-Demand	Bother	COLA	54	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1ccccc1[N+](=O)[O-])C2	ZINC000819317763	FE	On-Demand	Bother	COLA	54	31
CC(=O)Nc1cccc(CC(=O)Oc2ccc(NC(=O)OC(C)(C)C)cc2)c1	ZINC000819317774	GI	On-Demand	Anodyne	TSHR	54	33
CC(=O)Nc1cccc(CC(=O)Oc2ccc(NC(=O)OC(C)(C)C)cc2)c1	ZINC000819317774	GI	On-Demand	Anodyne	ACR	40	33
O=C(c1ccc(CS(=O)(=O)c2ccccc2)o1)N1CCC[C@H](O)CC1	ZINC000819317808	FE	On-Demand	Anodyne	L3MBTL3	23	41
O=C(c1ccc(CS(=O)(=O)c2ccccc2)o1)N1CCC[C@@H](O)CC1	ZINC000819317810	FE	On-Demand	Anodyne	L3MBTL3	23	41
CC(=O)Nc1cccc(CC(=O)NCC2CCN(C(=O)C(F)(F)F)CC2)c1	ZINC000819317819	GE	On-Demand	Anodyne	HTR1D	20	41
CC(=O)Nc1cccc(CC(=O)NCC2CCN(C(=O)C(F)(F)F)CC2)c1	ZINC000819317819	GE	On-Demand	Anodyne	CCR3	60	38
CC(=O)Nc1cccc(CC(=O)NCC2CCN(C(=O)C(F)(F)F)CC2)c1	ZINC000819317819	GE	On-Demand	Anodyne	CCR2	15	40
CC(=O)Nc1cccc(CC(=O)NCC2CCN(C(=O)C(F)(F)F)CC2)c1	ZINC000819317819	GE	On-Demand	Anodyne	EPHX2	32	42
CC(=O)Nc1cccc(CC(=O)NCC2CCN(C(=O)C(F)(F)F)CC2)c1	ZINC000819317819	GE	On-Demand	Anodyne	CACNA1I	70	41
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CCC[C@H](O)CC1	ZINC000819317820	GE	On-Demand	Anodyne	CNR2	17	70
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CCC[C@H](O)CC1	ZINC000819317820	GE	On-Demand	Anodyne	L3MBTL3	95	45
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CCC[C@H](O)CC1	ZINC000819317820	GE	On-Demand	Anodyne	HPGD	43	39
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CCC[C@@H](O)CC1	ZINC000819317821	GE	On-Demand	Anodyne	CNR2	17	70
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CCC[C@@H](O)CC1	ZINC000819317821	GE	On-Demand	Anodyne	L3MBTL3	95	45
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N1CCC[C@@H](O)CC1	ZINC000819317821	GE	On-Demand	Anodyne	HPGD	43	39
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)N3CCC[C@H](O)CC3)nn2)CC1	ZINC000819317823	GD	On-Demand	Anodyne	GPR119	41	40
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)N3CCC[C@@H](O)CC3)nn2)CC1	ZINC000819317824	GD	On-Demand	Anodyne	GPR119	41	40
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	ACE	44	44
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	FKBP1A	70	45
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	CELA1	28	64
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	GRIN2B	28	43
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	ELANE	27	41
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	CTRA_BOVIN	60	33
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	TRY1_BOVIN	52	33
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	CTSG	41	33
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	CPT1A	40	43
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	CPT2	49	42
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	DPP4	17	43
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	PREP	175	87
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	CELA2A	49	33
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	LGMN	85	51
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	KLK5	28	52
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	SFRP1	54	39
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	WNT3	62	39
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	SLC12A5	72	47
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	Q9NAW4_PLAFA	35	40
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317827	FF	On-Demand	Anodyne	TMPRSS11D	57	37
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	ACE	44	44
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	FKBP1A	70	45
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	CELA1	28	64
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	GRIN2B	28	43
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	ELANE	27	41
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	CTRA_BOVIN	60	33
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	TRY1_BOVIN	52	33
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	CTSG	41	33
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	CPT1A	40	43
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	CPT2	49	42
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	DPP4	17	43
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	PREP	175	87
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	CELA2A	49	33
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	LGMN	85	51
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	KLK5	28	52
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	SFRP1	54	39
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	WNT3	62	39
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	SLC12A5	72	47
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	Q9NAW4_PLAFA	35	40
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819317831	FF	On-Demand	Anodyne	TMPRSS11D	57	37
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	ACE	44	44
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	FKBP1A	70	45
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	CELA1	28	64
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	GRIN2B	28	43
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	ELANE	27	41
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	CTRA_BOVIN	60	33
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	TRY1_BOVIN	52	33
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	CTSG	41	33
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	CPT1A	40	43
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	CPT2	49	42
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	DPP4	17	43
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	PREP	175	87
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	CELA2A	49	33
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	LGMN	85	51
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	KLK5	28	52
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	SFRP1	54	39
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	WNT3	62	39
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	SLC12A5	72	47
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	Q9NAW4_PLAFA	35	40
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317833	FF	On-Demand	Anodyne	TMPRSS11D	57	37
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	ACE	44	44
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	FKBP1A	70	45
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	CELA1	28	64
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	GRIN2B	28	43
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	ELANE	27	41
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	CTRA_BOVIN	60	33
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	TRY1_BOVIN	52	33
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	CTSG	41	33
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	CPT1A	40	43
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	CPT2	49	42
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	DPP4	17	43
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	PREP	175	87
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	CELA2A	49	33
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	LGMN	85	51
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	KLK5	28	52
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	SFRP1	54	39
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	WNT3	62	39
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	SLC12A5	72	47
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	Q9NAW4_PLAFA	35	40
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819317834	FF	On-Demand	Anodyne	TMPRSS11D	57	37
CC(C)(C)OC(=O)N1CCC(n2cccc2C(=O)N2CCC[C@H](O)CC2)CC1	ZINC000819317851	GG	On-Demand	Anodyne	PREP	15	47
CC(C)(C)OC(=O)N1CCC(n2cccc2C(=O)N2CCC[C@H](O)CC2)CC1	ZINC000819317851	GG	On-Demand	Anodyne	GPR119	38	44
CC(C)(C)OC(=O)N1CCC(n2cccc2C(=O)N2CCC[C@H](O)CC2)CC1	ZINC000819317851	GG	On-Demand	Anodyne	L3MBTL3	59	36
CC(C)(C)OC(=O)N1CCC(n2cccc2C(=O)N2CCC[C@@H](O)CC2)CC1	ZINC000819317853	GG	On-Demand	Anodyne	PREP	15	47
CC(C)(C)OC(=O)N1CCC(n2cccc2C(=O)N2CCC[C@@H](O)CC2)CC1	ZINC000819317853	GG	On-Demand	Anodyne	GPR119	38	44
CC(C)(C)OC(=O)N1CCC(n2cccc2C(=O)N2CCC[C@@H](O)CC2)CC1	ZINC000819317853	GG	On-Demand	Anodyne	L3MBTL3	59	36
O=C(c1csc(-c2ccc(O)cc2)n1)N1CCC[C@@H](O)CC1	ZINC000819317863	DF	On-Demand	Anodyne	TRPC6	44	41
O=C(c1csc(-c2ccc(O)cc2)n1)N1CCC[C@@H](O)CC1	ZINC000819317863	DF	On-Demand	Anodyne	TRPC3	42	41
O=C(c1csc(-c2ccc(O)cc2)n1)N1CCC[C@H](O)CC1	ZINC000819317864	DF	On-Demand	Anodyne	TRPC6	44	41
O=C(c1csc(-c2ccc(O)cc2)n1)N1CCC[C@H](O)CC1	ZINC000819317864	DF	On-Demand	Anodyne	TRPC3	42	41
N#CCc1ccccc1CC(=O)N1CCC[C@H](O)CC1	ZINC000819317867	CD	On-Demand	Mild	DPP4	16	40
N#CCc1ccccc1CC(=O)N1CCC[C@@H](O)CC1	ZINC000819317868	CD	On-Demand	Mild	DPP4	16	40
C=CCN(c1ccccc1)S(=O)(=O)c1cc(C(=O)N2CCC[C@H](O)CC2)ccc1Cl	ZINC000819317871	IH	On-Demand	Mild	L3MBTL3	46	35
C=CCN(c1ccccc1)S(=O)(=O)c1cc(C(=O)N2CCC[C@@H](O)CC2)ccc1Cl	ZINC000819317872	IH	On-Demand	Mild	L3MBTL3	46	35
O=C(c1cc(S(=O)(=O)NC2CC2)ccc1Br)N1CCC[C@@H](O)CC1	ZINC000819317873	HD	On-Demand	Anodyne	SFRP1	127	41
O=C(c1cc(S(=O)(=O)NC2CC2)ccc1Br)N1CCC[C@@H](O)CC1	ZINC000819317873	HD	On-Demand	Anodyne	WNT3	88	39
O=C(c1cc(S(=O)(=O)NC2CC2)ccc1Br)N1CCC[C@H](O)CC1	ZINC000819317874	HD	On-Demand	Anodyne	SFRP1	127	41
O=C(c1cc(S(=O)(=O)NC2CC2)ccc1Br)N1CCC[C@H](O)CC1	ZINC000819317874	HD	On-Demand	Anodyne	WNT3	88	39
O=C(c1cccnc1-n1cccn1)N1CCC[C@@H](O)CC1	ZINC000819317881	CD	On-Demand	Anodyne	L3MBTL3	65	42
O=C(c1cccnc1-n1cccn1)N1CCC[C@H](O)CC1	ZINC000819317882	CD	On-Demand	Anodyne	L3MBTL3	65	42
O=C(c1ccc(-n2ccc(C(F)(F)F)n2)cc1)N1CCC[C@H](O)CC1	ZINC000819317887	FF	On-Demand	Anodyne	SLC9A1	32	40
O=C(c1ccc(-n2ccc(C(F)(F)F)n2)cc1)N1CCC[C@H](O)CC1	ZINC000819317887	FF	On-Demand	Anodyne	MLYCD	19	43
O=C(c1ccc(-n2ccc(C(F)(F)F)n2)cc1)N1CCC[C@H](O)CC1	ZINC000819317887	FF	On-Demand	Anodyne	L3MBTL3	79	43
O=C(c1ccc(-n2ccc(C(F)(F)F)n2)cc1)N1CCC[C@H](O)CC1	ZINC000819317887	FF	On-Demand	Anodyne	HPGD	42	43
O=C(c1ccc(-n2ccc(C(F)(F)F)n2)cc1)N1CCC[C@@H](O)CC1	ZINC000819317888	FF	On-Demand	Anodyne	SLC9A1	32	40
O=C(c1ccc(-n2ccc(C(F)(F)F)n2)cc1)N1CCC[C@@H](O)CC1	ZINC000819317888	FF	On-Demand	Anodyne	MLYCD	19	43
O=C(c1ccc(-n2ccc(C(F)(F)F)n2)cc1)N1CCC[C@@H](O)CC1	ZINC000819317888	FF	On-Demand	Anodyne	L3MBTL3	79	43
O=C(c1ccc(-n2ccc(C(F)(F)F)n2)cc1)N1CCC[C@@H](O)CC1	ZINC000819317888	FF	On-Demand	Anodyne	HPGD	42	43
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@H](O)CC1	ZINC000819317891	HF	On-Demand	Anodyne	CNR2	19	69
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@H](O)CC1	ZINC000819317891	HF	On-Demand	Anodyne	L3MBTL3	94	45
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@H](O)CC1	ZINC000819317891	HF	On-Demand	Anodyne	HPGD	45	41
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@@H](O)CC1	ZINC000819317892	HF	On-Demand	Anodyne	CNR2	19	69
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@@H](O)CC1	ZINC000819317892	HF	On-Demand	Anodyne	L3MBTL3	94	45
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@@H](O)CC1	ZINC000819317892	HF	On-Demand	Anodyne	HPGD	45	41
O=C(N1CCC[C@@H](O)CC1)C(F)(F)Cc1ccccc1	ZINC000819317893	CE	On-Demand	Anodyne	PREP	57	38
O=C(N1CCC[C@H](O)CC1)C(F)(F)Cc1ccccc1	ZINC000819317894	CE	On-Demand	Anodyne	PREP	57	38
CO/C(=C/c1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819317895	CE	On-Demand	Anodyne	TLR4	19	40
CO/C(=C\c1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819317896	CE	On-Demand	Anodyne	TLR4	19	40
CO/C(=C\c1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819317897	CE	On-Demand	Anodyne	TLR4	19	40
CO/C(=C/c1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819317898	CE	On-Demand	Anodyne	TLR4	19	40
O=C(c1c(O)cccc1Cl)N1CCC[C@@H](O)CC1	ZINC000819317905	CE	On-Demand	Anodyne	CCR5	15	40
O=C(c1c(O)cccc1Cl)N1CCC[C@@H](O)CC1	ZINC000819317905	CE	On-Demand	Anodyne	L3MBTL3	91	43
O=C(c1c(O)cccc1Cl)N1CCC[C@H](O)CC1	ZINC000819317906	CE	On-Demand	Anodyne	CCR5	15	40
O=C(c1c(O)cccc1Cl)N1CCC[C@H](O)CC1	ZINC000819317906	CE	On-Demand	Anodyne	L3MBTL3	91	43
O=C(/C=C/[C@H]1CCCO1)NCC1(c2cccc(C(F)(F)F)c2)CCC1	ZINC000819317912	FH	On-Demand	Anodyne	CCR2	47	38
O=C(/C=C\[C@@H]1CCCO1)NCC1(c2cccc(C(F)(F)F)c2)CCC1	ZINC000819317913	FH	On-Demand	Anodyne	CCR2	47	38
O=C(/C=C/[C@@H]1CCCO1)NCC1(c2cccc(C(F)(F)F)c2)CCC1	ZINC000819317914	FH	On-Demand	Anodyne	CCR2	47	38
O=C(/C=C\[C@H]1CCCO1)NCC1(c2cccc(C(F)(F)F)c2)CCC1	ZINC000819317915	FH	On-Demand	Anodyne	CCR2	47	38
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H]2COc3ccccc32)CC1	ZINC000819317923	GF	On-Demand	Anodyne	GPR119	33	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2COc3ccccc32)CC1	ZINC000819317924	GF	On-Demand	Anodyne	GPR119	33	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2COc3ccccc32)CC1	ZINC000819317925	GF	On-Demand	Anodyne	GPR119	33	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H]2COc3ccccc32)CC1	ZINC000819317926	GF	On-Demand	Anodyne	GPR119	33	45
CSC1(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCOCC1	ZINC000819317946	GF	On-Demand	Mild	PAPA1_CARPA	38	51
CSC1(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCOCC1	ZINC000819317947	GF	On-Demand	Mild	PAPA1_CARPA	38	51
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819317983	GH	On-Demand	Anodyne	ACACB	16	43
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819317984	GH	On-Demand	Anodyne	ACACB	16	43
Cc1cc(F)ccc1[C@@H](O)CNCCc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000819317986	FG	On-Demand	Bother	MPO	94	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNCCC(=O)Nc2ccccc2)CC1	ZINC000819317992	GH	On-Demand	Anodyne	LTA4H	25	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNCCC(=O)Nc2ccccc2)CC1	ZINC000819317992	GH	On-Demand	Anodyne	ACACB	17	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)c2cc(F)ccc2F)CC1	ZINC000819318000	GH	On-Demand	Anodyne	CACNA1I	54	34
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)c2cc(F)ccc2F)CC1	ZINC000819318001	GH	On-Demand	Anodyne	CACNA1I	54	34
C[C@@H](CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1)n1cccn1	ZINC000819318036	FG	On-Demand	Anodyne	SOAT1	15	54
C[C@@H](CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1)n1cccn1	ZINC000819318036	FG	On-Demand	Anodyne	FPR1	41	34
C[C@@H](CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1)n1cccn1	ZINC000819318036	FG	On-Demand	Anodyne	AMP1_PLAFQ	18	40
C[C@H](CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1)n1cccn1	ZINC000819318037	FG	On-Demand	Anodyne	SOAT1	15	54
C[C@H](CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1)n1cccn1	ZINC000819318037	FG	On-Demand	Anodyne	FPR1	41	34
C[C@H](CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1)n1cccn1	ZINC000819318037	FG	On-Demand	Anodyne	AMP1_PLAFQ	18	40
C[C@@H](CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1)n1cccn1	ZINC000819318038	FG	On-Demand	Anodyne	SOAT1	15	54
C[C@@H](CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1)n1cccn1	ZINC000819318038	FG	On-Demand	Anodyne	FPR1	41	34
C[C@@H](CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1)n1cccn1	ZINC000819318038	FG	On-Demand	Anodyne	AMP1_PLAFQ	18	40
C[C@H](CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1)n1cccn1	ZINC000819318039	FG	On-Demand	Anodyne	SOAT1	15	54
C[C@H](CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1)n1cccn1	ZINC000819318039	FG	On-Demand	Anodyne	FPR1	41	34
C[C@H](CC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1)n1cccn1	ZINC000819318039	FG	On-Demand	Anodyne	AMP1_PLAFQ	18	40
O=C(C(F)=C1CCC1)N1CC[C@H](COCc2ccccc2)C1	ZINC000819318040	DG	On-Demand	Anodyne	GRIN2B	44	38
O=C(C(F)=C1CCC1)N1CC[C@H](COCc2ccccc2)C1	ZINC000819318040	DG	On-Demand	Anodyne	SIGMAR1	16	46
O=C(C(F)=C1CCC1)N1CC[C@@H](COCc2ccccc2)C1	ZINC000819318041	DG	On-Demand	Anodyne	GRIN2B	44	38
O=C(C(F)=C1CCC1)N1CC[C@@H](COCc2ccccc2)C1	ZINC000819318041	DG	On-Demand	Anodyne	SIGMAR1	16	46
CC[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc2O1	ZINC000819318045	GH	On-Demand	Mild	PAPA1_CARPA	40	41
CC[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc2O1	ZINC000819318045	GH	On-Demand	Mild	FPR1	42	35
CC[C@H]1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc2O1	ZINC000819318047	GH	On-Demand	Mild	PAPA1_CARPA	40	41
CC[C@H]1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc2O1	ZINC000819318047	GH	On-Demand	Mild	FPR1	42	35
COc1cccc(O[C@H](C)CNC(=O)C(F)=C2CCC2)c1	ZINC000819318061	CF	On-Demand	Anodyne	DRD4	42	32
COc1cccc(O[C@H](C)CNC(=O)C(F)=C2CCC2)c1	ZINC000819318061	CF	On-Demand	Anodyne	MTNR1A	59	62
COc1cccc(O[C@H](C)CNC(=O)C(F)=C2CCC2)c1	ZINC000819318061	CF	On-Demand	Anodyne	MTNR1B	57	62
COc1cccc(O[C@@H](C)CNC(=O)C(F)=C2CCC2)c1	ZINC000819318062	CF	On-Demand	Anodyne	DRD4	42	32
COc1cccc(O[C@@H](C)CNC(=O)C(F)=C2CCC2)c1	ZINC000819318062	CF	On-Demand	Anodyne	MTNR1A	59	62
COc1cccc(O[C@@H](C)CNC(=O)C(F)=C2CCC2)c1	ZINC000819318062	CF	On-Demand	Anodyne	MTNR1B	57	62
CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819318076	EC	On-Demand	Clean	L3MBTL3	51	34
CS(=O)(=O)Nc1ccc(O)c(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819318078	EC	On-Demand	Clean	L3MBTL3	51	34
CC(C)(C)OC(=O)N1CCC(CCC(=O)N2CCC[C@H](O)CC2)CC1	ZINC000819318089	FF	On-Demand	Anodyne	PREP	17	42
CC(C)(C)OC(=O)N1CCC(CCC(=O)N2CCC[C@H](O)CC2)CC1	ZINC000819318089	FF	On-Demand	Anodyne	GPR119	33	41
CC(C)(C)OC(=O)N1CCC(CCC(=O)N2CCC[C@@H](O)CC2)CC1	ZINC000819318091	FF	On-Demand	Anodyne	PREP	17	42
CC(C)(C)OC(=O)N1CCC(CCC(=O)N2CCC[C@@H](O)CC2)CC1	ZINC000819318091	FF	On-Demand	Anodyne	GPR119	33	41
C#Cc1ccc(C(=O)N2CCC[C@@H](O)CC2)nc1	ZINC000819318094	BD	On-Demand	Mild	L3MBTL3	58	49
C#Cc1ccc(C(=O)N2CCC[C@H](O)CC2)nc1	ZINC000819318096	BD	On-Demand	Mild	L3MBTL3	58	49
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819318097	FG	On-Demand	Anodyne	DRD4	17	42
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819318097	FG	On-Demand	Anodyne	MCHR1	29	40
CN(C)c1cc(C(=O)N2CCC[C@@H](O)CC2)cc(Cl)n1	ZINC000819318098	CD	On-Demand	Anodyne	L3MBTL3	46	38
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819318100	FG	On-Demand	Anodyne	DRD4	17	42
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819318100	FG	On-Demand	Anodyne	MCHR1	29	40
O=C(CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])N1CCC[C@@H](O)CC1	ZINC000819318120	ED	On-Demand	Bother	C3AR1	28	40
O=C(CCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])N1CCC[C@H](O)CC1	ZINC000819318122	ED	On-Demand	Bother	C3AR1	28	40
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@@H](O)CC1	ZINC000819318124	GD	On-Demand	Anodyne	CELA1	19	43
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@@H](O)CC1	ZINC000819318124	GD	On-Demand	Anodyne	GRIN2B	40	47
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@@H](O)CC1	ZINC000819318124	GD	On-Demand	Anodyne	PREP	62	50
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@@H](O)CC1	ZINC000819318124	GD	On-Demand	Anodyne	TGM2	39	41
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@@H](O)CC1	ZINC000819318124	GD	On-Demand	Anodyne	F13A1	36	41
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@@H](O)CC1	ZINC000819318124	GD	On-Demand	Anodyne	SLC12A5	68	40
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@H](O)CC1	ZINC000819318126	GD	On-Demand	Anodyne	CELA1	19	43
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@H](O)CC1	ZINC000819318126	GD	On-Demand	Anodyne	GRIN2B	40	47
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@H](O)CC1	ZINC000819318126	GD	On-Demand	Anodyne	PREP	62	50
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@H](O)CC1	ZINC000819318126	GD	On-Demand	Anodyne	TGM2	39	41
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@H](O)CC1	ZINC000819318126	GD	On-Demand	Anodyne	F13A1	36	41
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CCC[C@H](O)CC1	ZINC000819318126	GD	On-Demand	Anodyne	SLC12A5	68	40
O=C(c1cccc(I)c1O)N1CCC[C@@H](O)CC1	ZINC000819318153	FD	On-Demand	Anodyne	L3MBTL3	74	44
O=C(c1cccc(I)c1O)N1CCC[C@H](O)CC1	ZINC000819318154	FD	On-Demand	Anodyne	L3MBTL3	74	44
CC(C)(C)OC(=O)N1CCN(C(C)(C)C(=O)N2CCC[C@H](O)CC2)CC1	ZINC000819318157	FD	On-Demand	Anodyne	GPR119	32	43
CC(C)(C)OC(=O)N1CCN(C(C)(C)C(=O)N2CCC[C@@H](O)CC2)CC1	ZINC000819318158	FD	On-Demand	Anodyne	GPR119	32	43
O=C(c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1)N1CCC[C@H](O)CC1	ZINC000819318163	IG	On-Demand	Anodyne	NPY2R	15	41
O=C(c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1)N1CCC[C@H](O)CC1	ZINC000819318163	IG	On-Demand	Anodyne	SGK1	47	36
O=C(c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1)N1CCC[C@H](O)CC1	ZINC000819318163	IG	On-Demand	Anodyne	L3MBTL3	65	36
O=C(c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1)N1CCC[C@@H](O)CC1	ZINC000819318164	IG	On-Demand	Anodyne	NPY2R	15	41
O=C(c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1)N1CCC[C@@H](O)CC1	ZINC000819318164	IG	On-Demand	Anodyne	SGK1	47	36
O=C(c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1)N1CCC[C@@H](O)CC1	ZINC000819318164	IG	On-Demand	Anodyne	L3MBTL3	65	36
O=C(c1cc2cccc(Cl)c2o1)N1CCC[C@@H](O)CC1	ZINC000819318183	CG	On-Demand	Anodyne	L3MBTL3	53	40
O=C(c1cc2cccc(Cl)c2o1)N1CCC[C@H](O)CC1	ZINC000819318184	CG	On-Demand	Anodyne	L3MBTL3	53	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	F2	43	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	PLG	47	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	PRSS1	23	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	ACE	50	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	SSTR2	56	35
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	OPRM1	25	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	OPRD1	19	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	GHRHR	83	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	P2RY12	58	38
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	CELA1	37	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	ELANE	32	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	PGC	58	37
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	CMA1	36	49
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	CTRA_BOVIN	63	35
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	KLK3	60	32
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	CTSB	42	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	PAPA1_CARPA	54	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	TRY1_BOVIN	44	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	CYSP_TRYCR	52	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	CCKAR	69	48
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	CTSG	44	35
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	CTSK	48	47
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	CTSL	49	47
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	CACNA1B	53	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	CYP51A1	22	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	PREP	47	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	CAPNS1	67	35
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	CELA2A	52	35
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	REN	93	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	LGMN	54	37
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	CCKBR	31	49
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	CTSS	35	47
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	GHSR	25	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	CAPN1	70	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	CAPN2	96	37
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	TGM2	36	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	KLK5	47	53
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	FPR1	51	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	NPR	48	31
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	SLC12A5	67	36
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318187	HE	On-Demand	Anodyne	TMPRSS11D	51	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	F2	43	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	PLG	47	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	PRSS1	23	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	ACE	50	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	SSTR2	56	35
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	OPRM1	25	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	OPRD1	19	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	GHRHR	83	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	P2RY12	58	38
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	CELA1	37	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	ELANE	32	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	PGC	58	37
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	CMA1	36	49
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	CTRA_BOVIN	63	35
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	KLK3	60	32
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	CTSB	42	45
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	PAPA1_CARPA	54	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	TRY1_BOVIN	44	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	CYSP_TRYCR	52	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	CCKAR	69	48
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	CTSG	44	35
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	CTSK	48	47
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	CTSL	49	47
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	CACNA1B	53	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	CYP51A1	22	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	PREP	47	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	CAPNS1	67	35
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	CELA2A	52	35
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	REN	93	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	LGMN	54	37
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	CCKBR	31	49
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	CTSS	35	47
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	GHSR	25	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	CAPN1	70	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	CAPN2	96	37
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	TGM2	36	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	KLK5	47	53
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	FPR1	51	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	NPR	48	31
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	SLC12A5	67	36
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318188	HE	On-Demand	Anodyne	TMPRSS11D	51	41
CC(C)(C)OC(=O)N1CCCc2c(C(=O)N3CCC[C@H](O)CC3)cccc21	ZINC000819318201	FG	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CCCc2c(C(=O)N3CCC[C@H](O)CC3)cccc21	ZINC000819318201	FG	On-Demand	Anodyne	L3MBTL3	43	35
CC(C)(C)OC(=O)N1CCCc2c(C(=O)N3CCC[C@@H](O)CC3)cccc21	ZINC000819318202	FG	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CCCc2c(C(=O)N3CCC[C@@H](O)CC3)cccc21	ZINC000819318202	FG	On-Demand	Anodyne	L3MBTL3	43	35
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000819318219	GE	On-Demand	Bother	HTR1D	21	43
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000819318219	GE	On-Demand	Bother	MPO	43	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000819318219	GE	On-Demand	Bother	NMBR	63	33
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000819318220	GE	On-Demand	Bother	HTR1D	21	43
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000819318220	GE	On-Demand	Bother	MPO	43	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000819318220	GE	On-Demand	Bother	NMBR	63	33
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)CC1	ZINC000819318226	GH	On-Demand	Anodyne	MME	51	38
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)CC1	ZINC000819318226	GH	On-Demand	Anodyne	CTSD	32	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)CC1	ZINC000819318226	GH	On-Demand	Anodyne	PGC	60	39
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)CC1	ZINC000819318226	GH	On-Demand	Anodyne	PAPA1_CARPA	44	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)CC1	ZINC000819318226	GH	On-Demand	Anodyne	CTSK	24	51
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)CC1	ZINC000819318226	GH	On-Demand	Anodyne	CTSL	23	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)CC1	ZINC000819318226	GH	On-Demand	Anodyne	ACACB	17	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)CC1	ZINC000819318226	GH	On-Demand	Anodyne	TACR3	19	45
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)CC1	ZINC000819318226	GH	On-Demand	Anodyne	REN	90	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)CC1	ZINC000819318226	GH	On-Demand	Anodyne	FPR1	54	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)CC1	ZINC000819318226	GH	On-Demand	Anodyne	AMP1_PLAFQ	48	37
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)CC1	ZINC000819318226	GH	On-Demand	Anodyne	VCP	48	35
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)Cc2ccccc2)CC1	ZINC000819318227	GH	On-Demand	Anodyne	MME	51	38
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)Cc2ccccc2)CC1	ZINC000819318227	GH	On-Demand	Anodyne	CTSD	32	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)Cc2ccccc2)CC1	ZINC000819318227	GH	On-Demand	Anodyne	PGC	60	39
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)Cc2ccccc2)CC1	ZINC000819318227	GH	On-Demand	Anodyne	PAPA1_CARPA	44	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)Cc2ccccc2)CC1	ZINC000819318227	GH	On-Demand	Anodyne	CTSK	24	51
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)Cc2ccccc2)CC1	ZINC000819318227	GH	On-Demand	Anodyne	CTSL	23	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)Cc2ccccc2)CC1	ZINC000819318227	GH	On-Demand	Anodyne	ACACB	17	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)Cc2ccccc2)CC1	ZINC000819318227	GH	On-Demand	Anodyne	TACR3	19	45
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)Cc2ccccc2)CC1	ZINC000819318227	GH	On-Demand	Anodyne	REN	90	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)Cc2ccccc2)CC1	ZINC000819318227	GH	On-Demand	Anodyne	FPR1	54	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)Cc2ccccc2)CC1	ZINC000819318227	GH	On-Demand	Anodyne	AMP1_PLAFQ	48	37
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNC[C@H](O)Cc2ccccc2)CC1	ZINC000819318227	GH	On-Demand	Anodyne	VCP	48	35
CC(=O)Nc1cccc(CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819318248	GF	On-Demand	Mild	HTR1A	19	44
CC(=O)Nc1cccc(CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819318248	GF	On-Demand	Mild	DRD2	20	44
CC(=O)Nc1cccc(CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819318248	GF	On-Demand	Mild	DRD4	29	53
CC(=O)Nc1cccc(CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819318248	GF	On-Demand	Mild	HTR1D	29	44
CC(=O)Nc1cccc(CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819318248	GF	On-Demand	Mild	HTR1B	24	44
CC(=O)Nc1cccc(CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819318248	GF	On-Demand	Mild	DRD3	15	44
CC(=O)Nc1cccc(CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819318248	GF	On-Demand	Mild	CSNK2A1	45	40
CC(=O)Nc1cccc(CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819318248	GF	On-Demand	Mild	SIGMAR1	19	44
CC(=O)Nc1cccc(CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819318248	GF	On-Demand	Mild	NPY1R	42	44
CC(=O)Nc1cccc(CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819318248	GF	On-Demand	Mild	NPY2R	42	37
CC(=O)Nc1cccc(CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819318248	GF	On-Demand	Mild	CCR3	37	42
CC(=O)Nc1cccc(CC(=O)NC2CCN(c3ccccc3C#N)CC2)c1	ZINC000819318248	GF	On-Demand	Mild	MCHR1	36	41
C[C@@H](CC(=O)NC1CCN(c2ccccc2C#N)CC1)n1cccn1	ZINC000819318258	EE	On-Demand	Mild	DRD4	15	40
C[C@H](CC(=O)NC1CCN(c2ccccc2C#N)CC1)n1cccn1	ZINC000819318259	EE	On-Demand	Mild	DRD4	15	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC[C@@H](COCc2ccccc2)C1	ZINC000819318317	FF	On-Demand	Anodyne	CTSK	15	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC[C@@H](COCc2ccccc2)C1	ZINC000819318317	FF	On-Demand	Anodyne	CTSL	15	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC[C@H](COCc2ccccc2)C1	ZINC000819318318	FF	On-Demand	Anodyne	CTSK	15	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC[C@H](COCc2ccccc2)C1	ZINC000819318318	FF	On-Demand	Anodyne	CTSL	15	45
O=C(NCC1CCN(C(=O)C(F)(F)F)CC1)c1coc(=O)c2ccccc12	ZINC000819318321	GE	On-Demand	Anodyne	HTR4	59	39
O=C(NCC1CCN(C(=O)C(F)(F)F)CC1)c1coc(=O)c2ccccc12	ZINC000819318321	GE	On-Demand	Anodyne	CACNA1I	53	34
C=C(Cl)CSc1nc(C)c(CC(=O)Nc2ccc(OC)cn2)s1	ZINC000819318359	FH	On-Demand	Mild	F10	47	32
C=C(C)C(C)(C)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819318375	EH	On-Demand	Mild	PAPA1_CARPA	35	41
C=C(C)C(C)(C)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819318375	EH	On-Demand	Mild	SOAT1	21	59
C=C(C)C(C)(C)C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819318375	EH	On-Demand	Mild	FPR1	46	38
C=C(C)C(C)(C)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819318376	EH	On-Demand	Mild	PAPA1_CARPA	35	41
C=C(C)C(C)(C)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819318376	EH	On-Demand	Mild	SOAT1	21	59
C=C(C)C(C)(C)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819318376	EH	On-Demand	Mild	FPR1	46	38
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](N2CCOCC2)C1	ZINC000819318379	CC	On-Demand	Anodyne	L3MBTL3	47	39
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](N2CCOCC2)C1	ZINC000819318380	CC	On-Demand	Anodyne	L3MBTL3	47	39
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](N2CCOCC2)C1	ZINC000819318381	CC	On-Demand	Anodyne	L3MBTL3	47	39
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](N2CCOCC2)C1	ZINC000819318382	CC	On-Demand	Anodyne	L3MBTL3	47	39
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](COCc2ccccc2)C1	ZINC000819318384	DF	On-Demand	Anodyne	GRIN2B	33	42
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](COCc2ccccc2)C1	ZINC000819318386	DF	On-Demand	Anodyne	GRIN2B	33	42
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](COCc2ccccc2)C1	ZINC000819318388	DF	On-Demand	Anodyne	GRIN2B	33	42
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](COCc2ccccc2)C1	ZINC000819318389	DF	On-Demand	Anodyne	GRIN2B	33	42
O=C(c1cc(S(=O)(=O)C2CCCC2)ccc1F)N1CCC[C@@H](O)CC1	ZINC000819318392	FF	On-Demand	Anodyne	SLC6A9	28	40
O=C(c1cc(S(=O)(=O)C2CCCC2)ccc1F)N1CCC[C@@H](O)CC1	ZINC000819318392	FF	On-Demand	Anodyne	L3MBTL3	40	33
O=C(c1cc(S(=O)(=O)C2CCCC2)ccc1F)N1CCC[C@H](O)CC1	ZINC000819318397	FF	On-Demand	Anodyne	SLC6A9	28	40
O=C(c1cc(S(=O)(=O)C2CCCC2)ccc1F)N1CCC[C@H](O)CC1	ZINC000819318397	FF	On-Demand	Anodyne	L3MBTL3	40	33
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@@H](O)CC1	ZINC000819318409	FD	On-Demand	Anodyne	PREP	25	41
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@@H](O)CC1	ZINC000819318409	FD	On-Demand	Anodyne	EPHX2	17	44
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@@H](O)CC1	ZINC000819318409	FD	On-Demand	Anodyne	ST14	46	33
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@@H](O)CC1	ZINC000819318409	FD	On-Demand	Anodyne	SFRP1	95	40
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@@H](O)CC1	ZINC000819318409	FD	On-Demand	Anodyne	WNT3	70	36
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@@H](O)CC1	ZINC000819318409	FD	On-Demand	Anodyne	L3MBTL3	71	43
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@H](O)CC1	ZINC000819318410	FD	On-Demand	Anodyne	PREP	25	41
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@H](O)CC1	ZINC000819318410	FD	On-Demand	Anodyne	EPHX2	17	44
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@H](O)CC1	ZINC000819318410	FD	On-Demand	Anodyne	ST14	46	33
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@H](O)CC1	ZINC000819318410	FD	On-Demand	Anodyne	SFRP1	95	40
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@H](O)CC1	ZINC000819318410	FD	On-Demand	Anodyne	WNT3	70	36
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CCC[C@H](O)CC1	ZINC000819318410	FD	On-Demand	Anodyne	L3MBTL3	71	43
O=C(c1ccc(N2CCCS2(=O)=O)cc1Cl)N1CCC[C@@H](O)CC1	ZINC000819318427	FD	On-Demand	Anodyne	L3MBTL3	40	34
O=C(c1ccc(N2CCCS2(=O)=O)cc1Cl)N1CCC[C@H](O)CC1	ZINC000819318428	FD	On-Demand	Anodyne	L3MBTL3	40	34
O=C(c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl)N1CCC[C@@H](O)CC1	ZINC000819318431	HD	On-Demand	Anodyne	MERTK	27	40
O=C(c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl)N1CCC[C@@H](O)CC1	ZINC000819318431	HD	On-Demand	Anodyne	L3MBTL3	32	41
O=C(c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl)N1CCC[C@H](O)CC1	ZINC000819318432	HD	On-Demand	Anodyne	MERTK	27	40
O=C(c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl)N1CCC[C@H](O)CC1	ZINC000819318432	HD	On-Demand	Anodyne	L3MBTL3	32	41
Cc1ccc(C(=O)N2CCC[C@H](O)CC2)cc1NC(=O)OC(C)(C)C	ZINC000819318441	EG	On-Demand	Anodyne	MAPK11	22	42
Cc1ccc(C(=O)N2CCC[C@H](O)CC2)cc1NC(=O)OC(C)(C)C	ZINC000819318441	EG	On-Demand	Anodyne	L3MBTL3	73	37
CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc(C)cs1	ZINC000819318443	FG	On-Demand	Mild	PAPA1_CARPA	36	40
Cc1ccc(C(=O)N2CCC[C@@H](O)CC2)cc1NC(=O)OC(C)(C)C	ZINC000819318444	EG	On-Demand	Anodyne	MAPK11	22	42
Cc1ccc(C(=O)N2CCC[C@@H](O)CC2)cc1NC(=O)OC(C)(C)C	ZINC000819318444	EG	On-Demand	Anodyne	L3MBTL3	73	37
O=C(c1nc(Br)ccc1F)N1CCC[C@@H](O)CC1	ZINC000819318453	DD	On-Demand	Anodyne	L3MBTL3	44	35
O=C(c1nc(Br)ccc1F)N1CCC[C@H](O)CC1	ZINC000819318455	DD	On-Demand	Anodyne	L3MBTL3	44	35
C=CCCn1cc(C(=O)NCC2CCN(C(=O)C(F)(F)F)CC2)nn1	ZINC000819318459	FD	On-Demand	Mild	CACNA1I	52	34
CC(C)(C)OC(=O)N1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)C(C)(C)C1	ZINC000819318463	GF	On-Demand	Anodyne	GPR119	21	42
COc1cccc([S@@](=O)CC(=O)N[C@@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819318471	GF	On-Demand	Anodyne	DRD4	44	42
COc1cccc([S@@](=O)CC(=O)N[C@@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819318471	GF	On-Demand	Anodyne	MTNR1A	16	52
COc1cccc([S@@](=O)CC(=O)N[C@@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819318471	GF	On-Demand	Anodyne	MTNR1B	18	52
COc1cccc([S@@](=O)CC(=O)N[C@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819318473	GF	On-Demand	Anodyne	DRD4	44	42
COc1cccc([S@@](=O)CC(=O)N[C@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819318473	GF	On-Demand	Anodyne	MTNR1A	16	52
COc1cccc([S@@](=O)CC(=O)N[C@H]2CCCN(c3ccc(C)cc3)C2)c1	ZINC000819318473	GF	On-Demand	Anodyne	MTNR1B	18	52
O=C(CCc1cc(C(F)(F)F)ccc1Br)N1CCC[C@@H](O)CC1	ZINC000819318482	GH	On-Demand	Anodyne	LIPG	47	34
C[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCN1C	ZINC000819318484	ED	On-Demand	Mild	PAPA1_CARPA	34	43
O=C(CCc1cc(C(F)(F)F)ccc1Br)N1CCC[C@H](O)CC1	ZINC000819318485	GH	On-Demand	Anodyne	LIPG	47	34
O=C(c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1)N1CCC[C@@H](O)CC1	ZINC000819318486	HD	On-Demand	Anodyne	L3MBTL3	48	33
O=C(c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1)N1CCC[C@H](O)CC1	ZINC000819318488	HD	On-Demand	Anodyne	L3MBTL3	48	33
O=C(c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1)N1CCC[C@@H](O)CC1	ZINC000819318489	HD	On-Demand	Anodyne	L3MBTL3	48	33
O=C(c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1)N1CCC[C@H](O)CC1	ZINC000819318491	HD	On-Demand	Anodyne	L3MBTL3	48	33
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](O)CC1	ZINC000819318493	EE	On-Demand	Anodyne	ACE	28	43
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](O)CC1	ZINC000819318493	EE	On-Demand	Anodyne	CPT1A	23	42
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](O)CC1	ZINC000819318493	EE	On-Demand	Anodyne	CPT2	48	41
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](O)CC1	ZINC000819318493	EE	On-Demand	Anodyne	PREP	163	83
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](O)CC1	ZINC000819318493	EE	On-Demand	Anodyne	SFRP1	72	51
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](O)CC1	ZINC000819318493	EE	On-Demand	Anodyne	WNT3	74	51
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](O)CC1	ZINC000819318493	EE	On-Demand	Anodyne	L3MBTL3	79	40
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819318494	EE	On-Demand	Anodyne	ACE	28	43
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819318494	EE	On-Demand	Anodyne	CPT1A	23	42
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819318494	EE	On-Demand	Anodyne	CPT2	48	41
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819318494	EE	On-Demand	Anodyne	PREP	163	83
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819318494	EE	On-Demand	Anodyne	SFRP1	72	51
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819318494	EE	On-Demand	Anodyne	WNT3	74	51
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819318494	EE	On-Demand	Anodyne	L3MBTL3	79	40
C[S@](=O)C[C@@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819318495	FE	On-Demand	Anodyne	FPR1	44	34
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](O)CC1	ZINC000819318496	EE	On-Demand	Anodyne	ACE	28	43
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](O)CC1	ZINC000819318496	EE	On-Demand	Anodyne	CPT1A	23	42
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](O)CC1	ZINC000819318496	EE	On-Demand	Anodyne	CPT2	48	41
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](O)CC1	ZINC000819318496	EE	On-Demand	Anodyne	PREP	163	83
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](O)CC1	ZINC000819318496	EE	On-Demand	Anodyne	SFRP1	72	51
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](O)CC1	ZINC000819318496	EE	On-Demand	Anodyne	WNT3	74	51
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@H](O)CC1	ZINC000819318496	EE	On-Demand	Anodyne	L3MBTL3	79	40
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819318497	EE	On-Demand	Anodyne	ACE	28	43
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819318497	EE	On-Demand	Anodyne	CPT1A	23	42
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819318497	EE	On-Demand	Anodyne	CPT2	48	41
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819318497	EE	On-Demand	Anodyne	PREP	163	83
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819318497	EE	On-Demand	Anodyne	SFRP1	72	51
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819318497	EE	On-Demand	Anodyne	WNT3	74	51
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819318497	EE	On-Demand	Anodyne	L3MBTL3	79	40
C[S@@](=O)C[C@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819318498	FE	On-Demand	Anodyne	FPR1	44	34
C[S@@](=O)C[C@@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819318501	FE	On-Demand	Anodyne	FPR1	44	34
Cn1c(C(=O)N2CCC[C@H](O)CC2)ccc1-c1ccc(Br)cc1	ZINC000819318502	GG	On-Demand	Anodyne	L3MBTL3	42	35
C[S@](=O)C[C@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819318503	FE	On-Demand	Anodyne	FPR1	44	34
Cn1c(C(=O)N2CCC[C@@H](O)CC2)ccc1-c1ccc(Br)cc1	ZINC000819318504	GG	On-Demand	Anodyne	L3MBTL3	42	35
C#CCN1CCC[C@H]1C(=O)N1CCC[C@@H](O)CC1	ZINC000819318516	CC	On-Demand	Mild	PREP	38	44
C#CCN1CCC[C@H]1C(=O)N1CCC[C@H](O)CC1	ZINC000819318519	CC	On-Demand	Mild	PREP	38	44
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCC[C@@H](O)CC1	ZINC000819318520	EC	On-Demand	Anodyne	PREP	31	60
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCC[C@H](O)CC1	ZINC000819318521	EC	On-Demand	Anodyne	PREP	31	60
O=C(c1cc(S(=O)(=O)N2CCc3ccccc3C2)ccc1Cl)N1CCC[C@@H](O)CC1	ZINC000819318523	IG	On-Demand	Anodyne	AKR1C3	73	49
O=C(c1cc(S(=O)(=O)N2CCc3ccccc3C2)ccc1Cl)N1CCC[C@H](O)CC1	ZINC000819318524	IG	On-Demand	Anodyne	AKR1C3	73	49
COc1cccc(C2(CNC[C@H](O)c3ccc(F)cc3C)CC2)c1	ZINC000819318552	EG	On-Demand	Anodyne	SOAT1	15	41
COc1cccc(C2(CNC[C@H](O)c3ccc(F)cc3C)CC2)c1	ZINC000819318552	EG	On-Demand	Anodyne	ICMT	26	41
COc1cccc(C2(CNC[C@@H](O)c3ccc(F)cc3C)CC2)c1	ZINC000819318553	EG	On-Demand	Anodyne	SOAT1	15	41
COc1cccc(C2(CNC[C@@H](O)c3ccc(F)cc3C)CC2)c1	ZINC000819318553	EG	On-Demand	Anodyne	ICMT	26	41
COc1cccc(C2(CNC[C@@H](O)c3ccc(F)cc3)CC2)c1	ZINC000819318593	DG	On-Demand	Anodyne	SOAT1	15	41
COc1cccc(C2(CNC[C@@H](O)c3ccc(F)cc3)CC2)c1	ZINC000819318593	DG	On-Demand	Anodyne	ICMT	31	42
COc1cccc(C2(CNC[C@H](O)c3ccc(F)cc3)CC2)c1	ZINC000819318594	DG	On-Demand	Anodyne	SOAT1	15	41
COc1cccc(C2(CNC[C@H](O)c3ccc(F)cc3)CC2)c1	ZINC000819318594	DG	On-Demand	Anodyne	ICMT	31	42
C#CCCCC(=O)N1CCC[C@@H](O)CC1	ZINC000819318614	BD	On-Demand	Mild	PREP	22	44
C#CCCCC(=O)N1CCC[C@H](O)CC1	ZINC000819318615	BD	On-Demand	Mild	PREP	22	44
Cc1ccc(C(=O)N2CCC[C@H](O)CC2)cc1-n1cccc1	ZINC000819318616	CF	On-Demand	Anodyne	L3MBTL3	93	42
Cc1ccc(C(=O)N2CCC[C@H](O)CC2)cc1-n1cccc1	ZINC000819318616	CF	On-Demand	Anodyne	HPGD	46	36
Cc1ccc(C(=O)N2CCC[C@@H](O)CC2)cc1-n1cccc1	ZINC000819318617	CF	On-Demand	Anodyne	L3MBTL3	93	42
Cc1ccc(C(=O)N2CCC[C@@H](O)CC2)cc1-n1cccc1	ZINC000819318617	CF	On-Demand	Anodyne	HPGD	46	36
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)N1CCC[C@H](O)CC1)=NO2	ZINC000819318622	GD	On-Demand	Anodyne	GPR119	25	47
CC(C)(C)OC(=O)N1CCC2(CC1)CC(C(=O)N1CCC[C@@H](O)CC1)=NO2	ZINC000819318623	GD	On-Demand	Anodyne	GPR119	25	47
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCC[C@H](O)CC2)C[C@@H]2CCCC[C@H]21	ZINC000819318642	FF	On-Demand	Anodyne	PREP	32	82
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCC[C@H](O)CC2)C[C@@H]2CCCC[C@@H]21	ZINC000819318643	FF	On-Demand	Anodyne	PREP	32	82
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCC[C@H](O)CC2)C[C@H]2CCCC[C@@H]21	ZINC000819318644	FF	On-Demand	Anodyne	PREP	32	82
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCC[C@H](O)CC2)C[C@H]2CCCC[C@H]21	ZINC000819318645	FF	On-Demand	Anodyne	PREP	32	82
Cc1nc(NCC(=O)N2CCC[C@H](O)CC2)c2cc(-c3ccccc3)sc2n1	ZINC000819318666	GG	On-Demand	Anodyne	P2RY12	40	35
Cc1nc(NCC(=O)N2CCC[C@@H](O)CC2)c2cc(-c3ccccc3)sc2n1	ZINC000819318667	GG	On-Demand	Anodyne	P2RY12	40	35
O=C(/C(=C\c1ccc(Cl)cc1)c1ccc(F)cc1)N1CCC[C@@H](O)CC1	ZINC000819318678	FI	On-Demand	Anodyne	HDAC6	34	41
O=C(/C(=C\c1ccc(Cl)cc1)c1ccc(F)cc1)N1CCC[C@H](O)CC1	ZINC000819318679	FI	On-Demand	Anodyne	HDAC6	34	41
O=C(/C(=C/c1ccc(Cl)cc1)c1ccc(F)cc1)N1CCC[C@H](O)CC1	ZINC000819318680	FI	On-Demand	Anodyne	HDAC6	34	41
O=C(/C(=C/c1ccc(Cl)cc1)c1ccc(F)cc1)N1CCC[C@@H](O)CC1	ZINC000819318681	FI	On-Demand	Anodyne	HDAC6	34	41
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1)N1CCC[C@H](O)CC1	ZINC000819318692	HF	On-Demand	Anodyne	CNR2	19	69
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1)N1CCC[C@H](O)CC1	ZINC000819318692	HF	On-Demand	Anodyne	L3MBTL3	94	45
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1)N1CCC[C@H](O)CC1	ZINC000819318692	HF	On-Demand	Anodyne	HPGD	45	41
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1)N1CCC[C@@H](O)CC1	ZINC000819318693	HF	On-Demand	Anodyne	CNR2	19	69
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1)N1CCC[C@@H](O)CC1	ZINC000819318693	HF	On-Demand	Anodyne	L3MBTL3	94	45
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1)N1CCC[C@@H](O)CC1	ZINC000819318693	HF	On-Demand	Anodyne	HPGD	45	41
CN(CC(=O)N1CCC[C@H](O)CC1)c1ccc(C(F)(F)F)cc1C=O	ZINC000819318696	FE	On-Demand	Anodyne	LIPG	50	35
CN(CC(=O)N1CCC[C@@H](O)CC1)c1ccc(C(F)(F)F)cc1C=O	ZINC000819318697	FE	On-Demand	Anodyne	LIPG	50	35
O[C@@H](CN[C@H]1COc2ccc(F)cc2C1)c1ccc(Cl)cc1	ZINC000819318711	DG	On-Demand	Anodyne	ADRB3	19	47
O[C@@H](CN[C@@H]1COc2ccc(F)cc2C1)c1ccc(Cl)cc1	ZINC000819318712	DG	On-Demand	Anodyne	ADRB3	19	47
COc1cccc(C2(CNCCC(=O)N(C)OC)CC2)c1	ZINC000819318715	CD	On-Demand	Anodyne	DRD4	41	31
O=[N+]([O-])c1ccc2[nH]cc(CCNC[C@@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819318738	GH	On-Demand	Bother	ADRB3	36	52
O=[N+]([O-])c1ccc2[nH]cc(CCNC[C@H](O)c3cccc(C(F)(F)F)c3)c2c1	ZINC000819318739	GH	On-Demand	Bother	ADRB3	36	52
COC[C@H](NC[C@@H](O)c1cc(F)ccc1F)c1cccc(Cl)c1	ZINC000819318740	EH	On-Demand	Anodyne	ADRB1	23	40
COC[C@H](NC[C@@H](O)c1cc(F)ccc1F)c1cccc(Cl)c1	ZINC000819318740	EH	On-Demand	Anodyne	ADRB3	33	40
COC[C@@H](NC[C@@H](O)c1cc(F)ccc1F)c1cccc(Cl)c1	ZINC000819318741	EH	On-Demand	Anodyne	ADRB1	23	40
COC[C@@H](NC[C@@H](O)c1cc(F)ccc1F)c1cccc(Cl)c1	ZINC000819318741	EH	On-Demand	Anodyne	ADRB3	33	40
COC[C@H](NC[C@H](O)c1cc(F)ccc1F)c1cccc(Cl)c1	ZINC000819318742	EH	On-Demand	Anodyne	ADRB1	23	40
COC[C@H](NC[C@H](O)c1cc(F)ccc1F)c1cccc(Cl)c1	ZINC000819318742	EH	On-Demand	Anodyne	ADRB3	33	40
COC[C@@H](NC[C@H](O)c1cc(F)ccc1F)c1cccc(Cl)c1	ZINC000819318743	EH	On-Demand	Anodyne	ADRB1	23	40
COC[C@@H](NC[C@H](O)c1cc(F)ccc1F)c1cccc(Cl)c1	ZINC000819318743	EH	On-Demand	Anodyne	ADRB3	33	40
Cc1cc(F)ccc1[C@@H](O)CNCc1ccc(CC(N)=O)cc1	ZINC000819318744	DD	On-Demand	Anodyne	LEF	85	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ncc(Cl)s1	ZINC000819318752	DF	On-Demand	Anodyne	FFAR2	17	44
Cc1nnc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)s1	ZINC000819318766	DF	On-Demand	Anodyne	ADRB2	15	40
Cc1nnc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)s1	ZINC000819318766	DF	On-Demand	Anodyne	ADRB1	17	40
Cc1nnc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)s1	ZINC000819318767	DF	On-Demand	Anodyne	ADRB2	15	40
Cc1nnc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)s1	ZINC000819318767	DF	On-Demand	Anodyne	ADRB1	17	40
COc1cccc(C2(CNC[C@](C)(O)CNC(=O)OC(C)(C)C)CC2)c1	ZINC000819318769	FF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C2(CNC[C@](C)(O)CNC(=O)OC(C)(C)C)CC2)c1	ZINC000819318769	FF	On-Demand	Anodyne	SOAT1	15	41
COc1cccc(C2(CNC[C@@](C)(O)CNC(=O)OC(C)(C)C)CC2)c1	ZINC000819318770	FF	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C2(CNC[C@@](C)(O)CNC(=O)OC(C)(C)C)CC2)c1	ZINC000819318770	FF	On-Demand	Anodyne	SOAT1	15	41
Cc1cnc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819318771	FF	On-Demand	Mild	PAPA1_CARPA	45	48
Cc1cnc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819318772	FF	On-Demand	Mild	PAPA1_CARPA	45	48
CCCOc1nc2ccccc2cc1/C=C/C(=O)N1CCC[C@H](O)CC1	ZINC000819318792	FG	On-Demand	Anodyne	ITGAL	42	35
CCCOc1nc2ccccc2cc1/C=C\C(=O)N1CCC[C@@H](O)CC1	ZINC000819318794	FG	On-Demand	Anodyne	ITGAL	42	35
CCCOc1nc2ccccc2cc1/C=C\C(=O)N1CCC[C@H](O)CC1	ZINC000819318796	FG	On-Demand	Anodyne	ITGAL	42	35
CCCOc1nc2ccccc2cc1/C=C/C(=O)N1CCC[C@@H](O)CC1	ZINC000819318797	FG	On-Demand	Anodyne	ITGAL	42	35
N#CCOc1ccccc1C(=O)N1CCC[C@@H](O)CC1	ZINC000819318799	CD	On-Demand	Mild	HCN1	41	32
N#CCOc1ccccc1C(=O)N1CCC[C@@H](O)CC1	ZINC000819318799	CD	On-Demand	Mild	HCN4	42	32
N#CCOc1ccccc1C(=O)N1CCC[C@@H](O)CC1	ZINC000819318799	CD	On-Demand	Mild	L3MBTL3	67	44
N#CCOc1ccccc1C(=O)N1CCC[C@H](O)CC1	ZINC000819318800	CD	On-Demand	Mild	HCN1	41	32
N#CCOc1ccccc1C(=O)N1CCC[C@H](O)CC1	ZINC000819318800	CD	On-Demand	Mild	HCN4	42	32
N#CCOc1ccccc1C(=O)N1CCC[C@H](O)CC1	ZINC000819318800	CD	On-Demand	Mild	L3MBTL3	67	44
O=C(c1cc(S(=O)(=O)N2CCCC2)ccc1Br)N1CCC[C@@H](O)CC1	ZINC000819318805	IE	On-Demand	Anodyne	L3MBTL3	63	45
O=C(c1cc(S(=O)(=O)N2CCCC2)ccc1Br)N1CCC[C@H](O)CC1	ZINC000819318806	IE	On-Demand	Anodyne	L3MBTL3	63	45
O=C(c1cccc(C2OCCO2)c1)N1CCC[C@H](O)CC1	ZINC000819318813	CD	On-Demand	Anodyne	PREP	27	42
O=C(c1cccc(C2OCCO2)c1)N1CCC[C@H](O)CC1	ZINC000819318813	CD	On-Demand	Anodyne	L3MBTL3	92	51
O=C(c1cccc(C2OCCO2)c1)N1CCC[C@H](O)CC1	ZINC000819318813	CD	On-Demand	Anodyne	HPGD	45	34
O=C(c1cccc(C2OCCO2)c1)N1CCC[C@@H](O)CC1	ZINC000819318815	CD	On-Demand	Anodyne	PREP	27	42
O=C(c1cccc(C2OCCO2)c1)N1CCC[C@@H](O)CC1	ZINC000819318815	CD	On-Demand	Anodyne	L3MBTL3	92	51
O=C(c1cccc(C2OCCO2)c1)N1CCC[C@@H](O)CC1	ZINC000819318815	CD	On-Demand	Anodyne	HPGD	45	34
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	F2	20	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	PLG	20	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	ACE	39	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	GHRHR	40	32
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	CELA1	24	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	MME	29	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	PGC	56	37
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	CMA1	39	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	CTRA_BOVIN	20	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	PAPA1_CARPA	31	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	TRY1_BOVIN	16	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	CCKAR	69	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	CTSK	23	46
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	CTSL	32	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	CYP51A1	22	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	REN	94	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	CCKBR	34	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	CTSS	18	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	FPR1	52	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	SFRP1	47	35
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@H](O)CC1)Cc1ccccc1	ZINC000819318833	GF	On-Demand	Anodyne	WNT3	47	35
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	F2	20	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	PLG	20	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	ACE	39	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	GHRHR	40	32
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	CELA1	24	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	MME	29	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	PGC	56	37
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	CMA1	39	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	CTRA_BOVIN	20	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	PAPA1_CARPA	31	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	TRY1_BOVIN	16	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	CCKAR	69	44
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	CTSK	23	46
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	CTSL	32	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	CYP51A1	22	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	REN	94	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	CCKBR	34	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	CTSS	18	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	FPR1	52	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	SFRP1	47	35
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCC[C@@H](O)CC1)Cc1ccccc1	ZINC000819318834	GF	On-Demand	Anodyne	WNT3	47	35
CC(C)(C)OC(=O)N1CCC(Nc2ccccc2)(C(=O)N2CCC[C@H](O)CC2)CC1	ZINC000819318844	HG	On-Demand	Anodyne	GPR119	39	44
CC(C)(C)OC(=O)N1CCC(Nc2ccccc2)(C(=O)N2CCC[C@@H](O)CC2)CC1	ZINC000819318845	HG	On-Demand	Anodyne	GPR119	39	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	F2	70	47
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	PLG	54	48
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	PRSS1	31	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	ACE	62	55
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	GHRHR	63	35
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	P2RY12	188	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	ELANE	26	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	TACR1	19	47
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	CMA1	25	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	CTRA_BOVIN	70	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	CASP3	15	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	KLK3	93	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	CTSB	64	49
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	TRY2_BOVIN	54	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	PAPA1_CARPA	61	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	TRY1_BOVIN	73	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	CYSP_TRYCR	59	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	CCKAR	17	47
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	CTSG	49	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	CTSK	53	52
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	CTSL	52	52
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	CCR1	16	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	NPFFR2	52	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	CYP51A1	24	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	PREP	66	47
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	CAPNS1	69	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	CELA2A	58	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	HDAC2	20	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	LGMN	81	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	MMP11	65	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	TGM1	26	47
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	CCKBR	25	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	CTSS	30	52
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	CAPN1	90	49
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	CASP1	25	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	CAPN2	131	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	PLAU	21	48
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	TGM2	47	56
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	DPP7	67	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	KLK5	40	35
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	TPSAB1	54	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	ST14	72	36
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	NPR	56	32
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	XIAP	26	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	BIRC2	18	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	SLC12A5	64	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	Q9NAW4_PLAFA	39	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318846	GC	On-Demand	Anodyne	TMPRSS11D	56	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	F2	70	47
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	PLG	54	48
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	PRSS1	31	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	ACE	62	55
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	GHRHR	63	35
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	P2RY12	188	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	ELANE	26	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	TACR1	19	47
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	CMA1	25	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	CTRA_BOVIN	70	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	CASP3	15	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	KLK3	93	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	CTSB	64	49
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	TRY2_BOVIN	54	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	PAPA1_CARPA	61	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	TRY1_BOVIN	73	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	CYSP_TRYCR	59	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	CCKAR	17	47
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	CTSG	49	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	CTSK	53	52
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	CTSL	52	52
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	CCR1	16	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	NPFFR2	52	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	CYP51A1	24	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	PREP	66	47
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	CAPNS1	69	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	CELA2A	58	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	HDAC2	20	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	LGMN	81	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	MMP11	65	33
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	TGM1	26	47
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	CCKBR	25	46
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	CTSS	30	52
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	CAPN1	90	49
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	CASP1	25	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	CAPN2	131	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	PLAU	21	48
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	TGM2	47	56
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	DPP7	67	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	KLK5	40	35
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	TPSAB1	54	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	ST14	72	36
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	NPR	56	32
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	XIAP	26	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	BIRC2	18	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	SLC12A5	64	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	Q9NAW4_PLAFA	39	42
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318847	GC	On-Demand	Anodyne	TMPRSS11D	56	38
O=C([C@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@@H](O)CC1	ZINC000819318858	DE	On-Demand	Anodyne	CACNA1B	48	37
O=C([C@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@@H](O)CC1	ZINC000819318858	DE	On-Demand	Anodyne	RBP4	22	42
O=C([C@@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@@H](O)CC1	ZINC000819318859	DE	On-Demand	Anodyne	CACNA1B	48	37
O=C([C@@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@@H](O)CC1	ZINC000819318859	DE	On-Demand	Anodyne	RBP4	22	42
O=C([C@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@H](O)CC1	ZINC000819318860	DE	On-Demand	Anodyne	CACNA1B	48	37
O=C([C@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@H](O)CC1	ZINC000819318860	DE	On-Demand	Anodyne	RBP4	22	42
O=C([C@@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@H](O)CC1	ZINC000819318861	DE	On-Demand	Anodyne	CACNA1B	48	37
O=C([C@@H](O)c1cccc(C(F)(F)F)c1)N1CCC[C@H](O)CC1	ZINC000819318861	DE	On-Demand	Anodyne	RBP4	22	42
O=C(N/C(=C\c1cccnc1)C(=O)N1CCC[C@@H](O)CC1)c1ccccc1	ZINC000819318862	FE	On-Demand	Anodyne	C3AR1	33	42
O=C(N/C(=C/c1cccnc1)C(=O)N1CCC[C@H](O)CC1)c1ccccc1	ZINC000819318863	FE	On-Demand	Anodyne	C3AR1	33	42
O=C(N/C(=C\c1cccnc1)C(=O)N1CCC[C@H](O)CC1)c1ccccc1	ZINC000819318864	FE	On-Demand	Anodyne	C3AR1	33	42
O=C(N/C(=C/c1cccnc1)C(=O)N1CCC[C@@H](O)CC1)c1ccccc1	ZINC000819318865	FE	On-Demand	Anodyne	C3AR1	33	42
O=C([C@H](F)c1ccc(C(F)(F)F)cc1)N1CCC[C@@H](O)CC1	ZINC000819318878	DG	On-Demand	Anodyne	EPHX2	19	42
O=C([C@@H](F)c1ccc(C(F)(F)F)cc1)N1CCC[C@@H](O)CC1	ZINC000819318879	DG	On-Demand	Anodyne	EPHX2	19	42
O=C([C@H](F)c1ccc(C(F)(F)F)cc1)N1CCC[C@H](O)CC1	ZINC000819318880	DG	On-Demand	Anodyne	EPHX2	19	42
O=C([C@@H](F)c1ccc(C(F)(F)F)cc1)N1CCC[C@H](O)CC1	ZINC000819318881	DG	On-Demand	Anodyne	EPHX2	19	42
O=C(Cn1cccc(C(F)(F)F)c1=O)N1CCC[C@H](O)CC1	ZINC000819318888	DD	On-Demand	Anodyne	RBP4	43	41
O=C(Cn1cccc(C(F)(F)F)c1=O)N1CCC[C@H](O)CC1	ZINC000819318888	DD	On-Demand	Anodyne	SFRP1	57	39
O=C(Cn1cccc(C(F)(F)F)c1=O)N1CCC[C@H](O)CC1	ZINC000819318888	DD	On-Demand	Anodyne	WNT3	52	39
O=C(Cn1cccc(C(F)(F)F)c1=O)N1CCC[C@@H](O)CC1	ZINC000819318889	DD	On-Demand	Anodyne	RBP4	43	41
O=C(Cn1cccc(C(F)(F)F)c1=O)N1CCC[C@@H](O)CC1	ZINC000819318889	DD	On-Demand	Anodyne	SFRP1	57	39
O=C(Cn1cccc(C(F)(F)F)c1=O)N1CCC[C@@H](O)CC1	ZINC000819318889	DD	On-Demand	Anodyne	WNT3	52	39
COc1cccc(C2=NO[C@H](C(=O)N3CCC[C@H](O)CC3)C2)c1	ZINC000819318890	DD	On-Demand	Anodyne	LUCI_PHOPY	27	44
COc1cccc(C2=NO[C@H](C(=O)N3CCC[C@@H](O)CC3)C2)c1	ZINC000819318891	DD	On-Demand	Anodyne	LUCI_PHOPY	27	44
COc1cccc(C2=NO[C@@H](C(=O)N3CCC[C@@H](O)CC3)C2)c1	ZINC000819318892	DD	On-Demand	Anodyne	LUCI_PHOPY	27	44
COc1cccc(C2=NO[C@@H](C(=O)N3CCC[C@H](O)CC3)C2)c1	ZINC000819318893	DD	On-Demand	Anodyne	LUCI_PHOPY	27	44
CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CCC[C@@H](O)CC1	ZINC000819318898	EC	On-Demand	Anodyne	PREP	23	61
CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CCC[C@H](O)CC1	ZINC000819318899	EC	On-Demand	Anodyne	PREP	23	61
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819318912	HF	On-Demand	Anodyne	HCN1	50	35
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819318912	HF	On-Demand	Anodyne	HCN4	44	35
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819318912	HF	On-Demand	Anodyne	L3MBTL3	68	40
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819318913	HF	On-Demand	Anodyne	HCN1	50	35
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819318913	HF	On-Demand	Anodyne	HCN4	44	35
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819318913	HF	On-Demand	Anodyne	L3MBTL3	68	40
O=C(Cc1ccccc1CO)N1CCC[C@H](O)CC1	ZINC000819318922	CD	On-Demand	Anodyne	PREP	46	35
O=C(Cc1ccccc1CO)N1CCC[C@@H](O)CC1	ZINC000819318923	CD	On-Demand	Anodyne	PREP	46	35
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)N2CCC[C@@H](O)CC2)cc1	ZINC000819318936	GD	On-Demand	Anodyne	PREP	67	48
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)N2CCC[C@@H](O)CC2)cc1	ZINC000819318937	GD	On-Demand	Anodyne	PREP	67	48
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)N2CCC[C@H](O)CC2)cc1	ZINC000819318938	GD	On-Demand	Anodyne	PREP	67	48
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)N2CCC[C@H](O)CC2)cc1	ZINC000819318939	GD	On-Demand	Anodyne	PREP	67	48
O=C(c1csc(COc2ccc(F)cc2)n1)N1CCC[C@@H](O)CC1	ZINC000819318940	FF	On-Demand	Anodyne	TRPC6	36	40
O=C(c1csc(COc2ccc(F)cc2)n1)N1CCC[C@@H](O)CC1	ZINC000819318940	FF	On-Demand	Anodyne	TRPC3	28	40
O=C(c1csc(COc2ccc(F)cc2)n1)N1CCC[C@H](O)CC1	ZINC000819318941	FF	On-Demand	Anodyne	TRPC6	36	40
O=C(c1csc(COc2ccc(F)cc2)n1)N1CCC[C@H](O)CC1	ZINC000819318941	FF	On-Demand	Anodyne	TRPC3	28	40
O=C(C1=COCC1)N1CCC[C@H](O)CC1	ZINC000819318942	BC	On-Demand	Anodyne	L3MBTL3	41	36
O=C(C1=COCC1)N1CCC[C@@H](O)CC1	ZINC000819318943	BC	On-Demand	Anodyne	L3MBTL3	41	36
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318946	CE	On-Demand	Anodyne	MC4R	49	44
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318946	CE	On-Demand	Anodyne	CCR1	18	40
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318946	CE	On-Demand	Anodyne	CYP51A1	24	42
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318946	CE	On-Demand	Anodyne	DPP4	28	46
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318946	CE	On-Demand	Anodyne	MLNR	22	42
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318946	CE	On-Demand	Anodyne	DPP7	41	40
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819318946	CE	On-Demand	Anodyne	DPP8	16	40
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318947	CE	On-Demand	Anodyne	MC4R	49	44
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318947	CE	On-Demand	Anodyne	CCR1	18	40
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318947	CE	On-Demand	Anodyne	CYP51A1	24	42
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318947	CE	On-Demand	Anodyne	DPP4	28	46
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318947	CE	On-Demand	Anodyne	MLNR	22	42
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318947	CE	On-Demand	Anodyne	DPP7	41	40
C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819318947	CE	On-Demand	Anodyne	DPP8	16	40
C[C@@H](CC(=O)N1CCC[C@@H](O)CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819318984	FG	On-Demand	Anodyne	GPR119	30	44
C[C@@H](CC(=O)N1CCC[C@H](O)CC1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819318987	FG	On-Demand	Anodyne	GPR119	30	44
O=C([C@@H](O)c1cccnc1)N1CCC[C@@H](O)CC1	ZINC000819318996	CC	On-Demand	Anodyne	PTAFR	15	49
O=C([C@@H](O)c1cccnc1)N1CCC[C@@H](O)CC1	ZINC000819318996	CC	On-Demand	Anodyne	C3AR1	41	38
O=C([C@H](O)c1cccnc1)N1CCC[C@H](O)CC1	ZINC000819318997	CC	On-Demand	Anodyne	PTAFR	15	49
O=C([C@H](O)c1cccnc1)N1CCC[C@H](O)CC1	ZINC000819318997	CC	On-Demand	Anodyne	C3AR1	41	38
O=C([C@@H](O)c1cccnc1)N1CCC[C@H](O)CC1	ZINC000819318999	CC	On-Demand	Anodyne	PTAFR	15	49
O=C([C@@H](O)c1cccnc1)N1CCC[C@H](O)CC1	ZINC000819318999	CC	On-Demand	Anodyne	C3AR1	41	38
O=C([C@H](O)c1cccnc1)N1CCC[C@@H](O)CC1	ZINC000819319000	CC	On-Demand	Anodyne	PTAFR	15	49
O=C([C@H](O)c1cccnc1)N1CCC[C@@H](O)CC1	ZINC000819319000	CC	On-Demand	Anodyne	C3AR1	41	38
O=C(c1ccc2cccnn12)N1CCC[C@@H](O)CC1	ZINC000819319001	CD	On-Demand	Anodyne	L3MBTL3	47	36
O=C(c1ccc2cccnn12)N1CCC[C@H](O)CC1	ZINC000819319003	CD	On-Demand	Anodyne	L3MBTL3	47	36
COc1cccc(C2(CNC[C@@H](O)c3ccc(F)cc3Cl)CC2)c1	ZINC000819319021	EH	On-Demand	Anodyne	SOAT1	15	41
COc1cccc(C2(CNC[C@@H](O)c3ccc(F)cc3Cl)CC2)c1	ZINC000819319021	EH	On-Demand	Anodyne	ICMT	26	41
COc1cccc(C2(CNC[C@H](O)c3ccc(F)cc3Cl)CC2)c1	ZINC000819319022	EH	On-Demand	Anodyne	SOAT1	15	41
COc1cccc(C2(CNC[C@H](O)c3ccc(F)cc3Cl)CC2)c1	ZINC000819319022	EH	On-Demand	Anodyne	ICMT	26	41
COc1cccc(C2(CNC[C@@H](O)c3ccccc3F)CC2)c1	ZINC000819319032	DG	On-Demand	Anodyne	SOAT1	17	47
COc1cccc(C2(CNC[C@H](O)c3ccccc3F)CC2)c1	ZINC000819319033	DG	On-Demand	Anodyne	SOAT1	17	47
COc1cccc(C2(CNC[C@H](O)c3ccc(S(C)(=O)=O)cc3)CC2)c1	ZINC000819319034	GE	On-Demand	Anodyne	ADRB3	28	41
COc1cccc(C2(CNC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)CC2)c1	ZINC000819319035	GE	On-Demand	Anodyne	ADRB3	28	41
O[C@@H](CN[C@H]1COc2ccc(F)cc2C1)c1cccc(Br)c1	ZINC000819319067	FG	On-Demand	Anodyne	ADRB3	16	40
O[C@@H](CN[C@@H]1COc2ccc(F)cc2C1)c1cccc(Br)c1	ZINC000819319068	FG	On-Demand	Anodyne	ADRB3	16	40
O[C@H](CN[C@H]1COc2ccc(F)cc2C1)c1cccc(Br)c1	ZINC000819319069	FG	On-Demand	Anodyne	ADRB3	16	40
O[C@H](CN[C@@H]1COc2ccc(F)cc2C1)c1cccc(Br)c1	ZINC000819319070	FG	On-Demand	Anodyne	ADRB3	16	40
Cc1nnc(CCNC[C@@H](O)c2cccc(Cl)c2)s1	ZINC000819319079	CE	On-Demand	Anodyne	ADRB2	48	37
Cc1nnc(CCNC[C@@H](O)c2cccc(Cl)c2)s1	ZINC000819319079	CE	On-Demand	Anodyne	ADRB1	61	51
Cc1nnc(CCNC[C@@H](O)c2cccc(Cl)c2)s1	ZINC000819319079	CE	On-Demand	Anodyne	ADRB3	88	51
Cc1nnc(CCNC[C@H](O)c2cccc(Cl)c2)s1	ZINC000819319080	CE	On-Demand	Anodyne	ADRB2	48	37
Cc1nnc(CCNC[C@H](O)c2cccc(Cl)c2)s1	ZINC000819319080	CE	On-Demand	Anodyne	ADRB1	61	51
Cc1nnc(CCNC[C@H](O)c2cccc(Cl)c2)s1	ZINC000819319080	CE	On-Demand	Anodyne	ADRB3	88	51
COc1cccc(C2(CNC[C@@H](O)c3cccc(Cl)c3)CC2)c1	ZINC000819319082	EH	On-Demand	Anodyne	ADRB1	32	44
COc1cccc(C2(CNC[C@@H](O)c3cccc(Cl)c3)CC2)c1	ZINC000819319082	EH	On-Demand	Anodyne	ADRB3	50	48
COc1cccc(C2(CNC[C@H](O)c3cccc(Cl)c3)CC2)c1	ZINC000819319083	EH	On-Demand	Anodyne	ADRB1	32	44
COc1cccc(C2(CNC[C@H](O)c3cccc(Cl)c3)CC2)c1	ZINC000819319083	EH	On-Demand	Anodyne	ADRB3	50	48
CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1CC(NC(=O)c1coc(=O)c3ccccc13)C2	ZINC000819319102	GG	On-Demand	Anodyne	INHA	65	34
COc1cccc(C2(CNCCC(=O)Nc3ccc(N(C)C)cc3)CC2)c1	ZINC000819319107	FG	On-Demand	Anodyne	MTNR1A	31	52
COc1cccc(C2(CNCCC(=O)Nc3ccc(N(C)C)cc3)CC2)c1	ZINC000819319107	FG	On-Demand	Anodyne	MTNR1B	37	52
COc1cccc(C2(CNCCC(=O)Nc3ccc(N(C)C)cc3)CC2)c1	ZINC000819319107	FG	On-Demand	Anodyne	SOAT1	15	40
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(CC(N)=O)cc2)cc1	ZINC000819319141	FC	On-Demand	Anodyne	ADRB2	16	42
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(CC(N)=O)cc2)cc1	ZINC000819319141	FC	On-Demand	Anodyne	ADRB3	27	42
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(CC(N)=O)cc2)cc1	ZINC000819319142	FC	On-Demand	Anodyne	ADRB2	16	42
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(CC(N)=O)cc2)cc1	ZINC000819319142	FC	On-Demand	Anodyne	ADRB3	27	42
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc([N+](=O)[O-])cc23)c1	ZINC000819319242	GF	On-Demand	Bother	HTR1D	22	42
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc([N+](=O)[O-])cc23)c1	ZINC000819319242	GF	On-Demand	Bother	NQO2	26	43
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc([N+](=O)[O-])cc23)c1	ZINC000819319242	GF	On-Demand	Bother	MTNR1A	24	49
COc1ccc(OC)c([C@H](O)CNCCc2c[nH]c3ccc([N+](=O)[O-])cc23)c1	ZINC000819319242	GF	On-Demand	Bother	MTNR1B	18	48
O=C(Nc1ccc(S(=O)(=O)NCC2CC2)cc1)C(F)=C1CCC1	ZINC000819319243	EF	On-Demand	Anodyne	F13A1	17	42
Cc1nnc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)s1	ZINC000819319244	EF	On-Demand	Anodyne	ADRB3	22	44
Cc1nnc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)s1	ZINC000819319245	EF	On-Demand	Anodyne	ADRB3	22	44
O[C@@H](CN[C@H]1COc2ccc(F)cc2C1)c1cccc(Cl)c1	ZINC000819319254	DG	On-Demand	Anodyne	ADRB1	27	44
O[C@@H](CN[C@H]1COc2ccc(F)cc2C1)c1cccc(Cl)c1	ZINC000819319254	DG	On-Demand	Anodyne	ADRB3	44	51
O[C@@H](CN[C@@H]1COc2ccc(F)cc2C1)c1cccc(Cl)c1	ZINC000819319255	DG	On-Demand	Anodyne	ADRB1	27	44
O[C@@H](CN[C@@H]1COc2ccc(F)cc2C1)c1cccc(Cl)c1	ZINC000819319255	DG	On-Demand	Anodyne	ADRB3	44	51
O[C@H](CN[C@H]1COc2ccc(F)cc2C1)c1cccc(Cl)c1	ZINC000819319256	DG	On-Demand	Anodyne	ADRB1	27	44
O[C@H](CN[C@H]1COc2ccc(F)cc2C1)c1cccc(Cl)c1	ZINC000819319256	DG	On-Demand	Anodyne	ADRB3	44	51
O[C@H](CN[C@@H]1COc2ccc(F)cc2C1)c1cccc(Cl)c1	ZINC000819319257	DG	On-Demand	Anodyne	ADRB1	27	44
O[C@H](CN[C@@H]1COc2ccc(F)cc2C1)c1cccc(Cl)c1	ZINC000819319257	DG	On-Demand	Anodyne	ADRB3	44	51
COc1cccc(C2(CNC[C@H](O)c3ccccc3C)CC2)c1	ZINC000819319292	DG	On-Demand	Anodyne	SOAT1	17	48
COc1cccc(C2(CNC[C@@H](O)c3ccccc3C)CC2)c1	ZINC000819319293	DG	On-Demand	Anodyne	SOAT1	17	48
COC[C@]1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)OCCc2ccccc21	ZINC000819319310	FE	On-Demand	Bother	CACNA1D	44	33
COC[C@]1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)OCCc2ccccc21	ZINC000819319311	FE	On-Demand	Bother	CACNA1D	44	33
COc1cccc(C2(CNC[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)c1	ZINC000819319423	EF	On-Demand	Bother	CACNA1D	61	34
COc1cccc(C2(CNC[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)c1	ZINC000819319424	EF	On-Demand	Bother	CACNA1D	61	34
Cc1nnc(-c2cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2)o1	ZINC000819319445	GH	On-Demand	Mild	PAPA1_CARPA	39	41
Cc1nnc(-c2cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2)o1	ZINC000819319445	GH	On-Demand	Mild	CTSV	29	42
Cc1nnc(-c2cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2)o1	ZINC000819319446	GH	On-Demand	Mild	PAPA1_CARPA	39	41
Cc1nnc(-c2cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2)o1	ZINC000819319446	GH	On-Demand	Mild	CTSV	29	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2COc3ccc(F)cc3C2)CC1	ZINC000819319455	GF	On-Demand	Anodyne	GPR119	36	50
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2COc3ccc(F)cc3C2)CC1	ZINC000819319456	GF	On-Demand	Anodyne	GPR119	36	50
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2COc3ccc(F)cc3C2)CC1	ZINC000819319457	GF	On-Demand	Anodyne	GPR119	36	50
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2COc3ccc(F)cc3C2)CC1	ZINC000819319458	GF	On-Demand	Anodyne	GPR119	36	50
COc1cccc(C2(CNC[C@@H](O)c3ccccc3)CC2)c1	ZINC000819319491	CG	On-Demand	Anodyne	KCNA3	42	35
COc1cccc(C2(CNC[C@@H](O)c3ccccc3)CC2)c1	ZINC000819319491	CG	On-Demand	Anodyne	SOAT1	19	48
COc1cccc(C2(CNC[C@H](O)c3ccccc3)CC2)c1	ZINC000819319492	CG	On-Demand	Anodyne	KCNA3	42	35
COc1cccc(C2(CNC[C@H](O)c3ccccc3)CC2)c1	ZINC000819319492	CG	On-Demand	Anodyne	SOAT1	19	48
Cc1nnc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819319503	DD	On-Demand	Bother	CACNA1C	41	34
Cc1nnc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819319503	DD	On-Demand	Bother	ADRB3	61	39
Cc1nnc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819319503	DD	On-Demand	Bother	CACNA1D	63	33
Cc1nnc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819319504	DD	On-Demand	Bother	CACNA1C	41	34
Cc1nnc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819319504	DD	On-Demand	Bother	ADRB3	61	39
Cc1nnc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819319504	DD	On-Demand	Bother	CACNA1D	63	33
COc1cccc(C2(CNC[C@@H](O)c3cccc(F)c3)CC2)c1	ZINC000819319518	DG	On-Demand	Anodyne	ICMT	30	43
COc1cccc(C2(CNC[C@H](O)c3cccc(F)c3)CC2)c1	ZINC000819319519	DG	On-Demand	Anodyne	ICMT	30	43
Cc1ccc(NC(=O)N2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819319553	EG	On-Demand	Anodyne	PDGFRB	25	40
Cc1ccc(NC(=O)N2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819319553	EG	On-Demand	Anodyne	EPHX2	19	41
Cc1ccc(NC(=O)N2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819319553	EG	On-Demand	Anodyne	TRPM8	17	43
COc1cccc(C2(CNC[C@@H](O)c3ccccc3C(F)(F)F)CC2)c1	ZINC000819319562	FI	On-Demand	Anodyne	SOAT1	17	45
COc1cccc(C2(CNC[C@H](O)c3ccccc3C(F)(F)F)CC2)c1	ZINC000819319563	FI	On-Demand	Anodyne	SOAT1	17	45
COC(=O)[C@@H](CNC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819319568	FD	On-Demand	Anodyne	FPR1	42	34
COC(=O)[C@H](CNC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819319569	FD	On-Demand	Anodyne	FPR1	42	34
COc1cccc(C2(CNC[C@@H](O)c3ccc(F)cc3F)CC2)c1	ZINC000819319591	EG	On-Demand	Anodyne	SOAT1	15	42
COc1cccc(C2(CNC[C@@H](O)c3ccc(F)cc3F)CC2)c1	ZINC000819319591	EG	On-Demand	Anodyne	ICMT	26	42
COc1cccc(C2(CNC[C@H](O)c3ccc(F)cc3F)CC2)c1	ZINC000819319592	EG	On-Demand	Anodyne	SOAT1	15	42
COc1cccc(C2(CNC[C@H](O)c3ccc(F)cc3F)CC2)c1	ZINC000819319592	EG	On-Demand	Anodyne	ICMT	26	42
O[C@@H](CN[C@H]1COc2ccc(F)cc2C1)c1cccnc1	ZINC000819319622	CD	On-Demand	Anodyne	ADRB3	49	48
O[C@@H](CN[C@@H]1COc2ccc(F)cc2C1)c1cccnc1	ZINC000819319623	CD	On-Demand	Anodyne	ADRB3	49	48
O[C@H](CN[C@H]1COc2ccc(F)cc2C1)c1cccnc1	ZINC000819319624	CD	On-Demand	Anodyne	ADRB3	49	48
O[C@H](CN[C@@H]1COc2ccc(F)cc2C1)c1cccnc1	ZINC000819319625	CD	On-Demand	Anodyne	ADRB3	49	48
O=[N+]([O-])c1ccc2[nH]cc(CCNC[C@@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819319667	GH	On-Demand	Bother	MPO	51	39
O=[N+]([O-])c1ccc2[nH]cc(CCNC[C@H](O)c3ccccc3C(F)(F)F)c2c1	ZINC000819319668	GH	On-Demand	Bother	MPO	51	39
O=C(O)[C@@H]1CN(C(=O)Nc2ccccc2-c2cc(F)c(F)c(F)c2)CCO1	ZINC000819319707	GG	On-Demand	Anodyne	RBP4	54	34
O=C(O)[C@@H]1CN(C(=O)Nc2ccccc2-c2cc(F)c(F)c(F)c2)CCO1	ZINC000819319707	GG	On-Demand	Anodyne	SMO	18	42
O=C(O)[C@H]1CN(C(=O)Nc2ccccc2-c2cc(F)c(F)c(F)c2)CCO1	ZINC000819319708	GG	On-Demand	Anodyne	RBP4	54	34
O=C(O)[C@H]1CN(C(=O)Nc2ccccc2-c2cc(F)c(F)c(F)c2)CCO1	ZINC000819319708	GG	On-Demand	Anodyne	SMO	18	42
O=C(O)[C@@H]1CN(C(=O)Nc2ccnc(Oc3ccccc3Cl)c2)CCO1	ZINC000819319723	GF	On-Demand	Anodyne	TYK2	51	34
O=C(O)[C@H]1CN(C(=O)Nc2ccnc(Oc3ccccc3Cl)c2)CCO1	ZINC000819319724	GF	On-Demand	Anodyne	TYK2	51	34
O=C(O)[C@@H]1CN(C(=O)Nc2cccc(Oc3ccccn3)c2)CCO1	ZINC000819319735	EE	On-Demand	Anodyne	PDGFRB	32	41
O=C(O)[C@@H]1CN(C(=O)Nc2cccc(Oc3ccccn3)c2)CCO1	ZINC000819319735	EE	On-Demand	Anodyne	FAAH	24	40
O=C(O)[C@@H]1CN(C(=O)Nc2cccc(Oc3ccccn3)c2)CCO1	ZINC000819319735	EE	On-Demand	Anodyne	LIMK2	46	41
O=C(O)[C@H]1CN(C(=O)Nc2cccc(Oc3ccccn3)c2)CCO1	ZINC000819319736	EE	On-Demand	Anodyne	PDGFRB	32	41
O=C(O)[C@H]1CN(C(=O)Nc2cccc(Oc3ccccn3)c2)CCO1	ZINC000819319736	EE	On-Demand	Anodyne	FAAH	24	40
O=C(O)[C@H]1CN(C(=O)Nc2cccc(Oc3ccccn3)c2)CCO1	ZINC000819319736	EE	On-Demand	Anodyne	LIMK2	46	41
O=C(O)[C@@H]1CN(C(=O)c2cc(-c3ccccc3)cc(Cl)c2O)CCO1	ZINC000819319737	FF	On-Demand	Anodyne	AKR1C2	75	53
O=C(O)[C@@H]1CN(C(=O)c2cc(-c3ccccc3)cc(Cl)c2O)CCO1	ZINC000819319737	FF	On-Demand	Anodyne	AKR1C1	72	53
O=C(O)[C@H]1CN(C(=O)c2cc(-c3ccccc3)cc(Cl)c2O)CCO1	ZINC000819319738	FF	On-Demand	Anodyne	AKR1C2	75	53
O=C(O)[C@H]1CN(C(=O)c2cc(-c3ccccc3)cc(Cl)c2O)CCO1	ZINC000819319738	FF	On-Demand	Anodyne	AKR1C1	72	53
O=C(O)[C@H]1CN(C(=O)Nc2cnn(Cc3ccccn3)c2)CCO1	ZINC000819319739	EC	On-Demand	Anodyne	RPS6KA3	17	44
O=C(O)[C@H]1CN(C(=O)Nc2cnn(Cc3ccccn3)c2)CCO1	ZINC000819319739	EC	On-Demand	Anodyne	PANC	42	34
O=C(O)[C@@H]1CN(C(=O)Nc2cnn(Cc3ccccn3)c2)CCO1	ZINC000819319740	EC	On-Demand	Anodyne	RPS6KA3	17	44
O=C(O)[C@@H]1CN(C(=O)Nc2cnn(Cc3ccccn3)c2)CCO1	ZINC000819319740	EC	On-Demand	Anodyne	PANC	42	34
O=C(O)[C@H]1CN(C(=O)Nc2ccn(CCN3CCOCC3)n2)CCO1	ZINC000819319741	FB	On-Demand	Anodyne	CASR	47	39
O=C(O)[C@@H]1CN(C(=O)Nc2ccn(CCN3CCOCC3)n2)CCO1	ZINC000819319742	FB	On-Demand	Anodyne	CASR	47	39
O=C(O)[C@H]1CN(C(=O)Nc2cccn(CC(F)(F)F)c2=O)CCO1	ZINC000819319743	EC	On-Demand	Anodyne	RBP4	55	38
O=C(O)[C@@H]1CN(C(=O)Nc2cccn(CC(F)(F)F)c2=O)CCO1	ZINC000819319744	EC	On-Demand	Anodyne	RBP4	55	38
O=C(O)[C@H]1CN(C(=O)Nc2cccnn2)CCO1	ZINC000819319751	CB	On-Demand	Anodyne	FAAH	24	44
O=C(O)[C@@H]1CN(C(=O)Nc2cccnn2)CCO1	ZINC000819319752	CB	On-Demand	Anodyne	FAAH	24	44
O=C(O)[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319755	FD	On-Demand	Anodyne	ACE	48	46
O=C(O)[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319755	FD	On-Demand	Anodyne	FKBP1A	61	40
O=C(O)[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319755	FD	On-Demand	Anodyne	CELA1	27	60
O=C(O)[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319755	FD	On-Demand	Anodyne	GRIN2B	16	40
O=C(O)[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319755	FD	On-Demand	Anodyne	ELANE	28	42
O=C(O)[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319755	FD	On-Demand	Anodyne	CTRA_BOVIN	61	33
O=C(O)[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319755	FD	On-Demand	Anodyne	TRY1_BOVIN	52	33
O=C(O)[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319755	FD	On-Demand	Anodyne	CTSG	42	33
O=C(O)[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319755	FD	On-Demand	Anodyne	CPT2	46	38
O=C(O)[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319755	FD	On-Demand	Anodyne	PREP	131	69
O=C(O)[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319755	FD	On-Demand	Anodyne	CELA2A	50	33
O=C(O)[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319755	FD	On-Demand	Anodyne	LGMN	81	48
O=C(O)[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319755	FD	On-Demand	Anodyne	KLK5	29	53
O=C(O)[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319755	FD	On-Demand	Anodyne	SLC12A5	68	40
O=C(O)[C@@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319755	FD	On-Demand	Anodyne	TMPRSS11D	49	36
O=C(O)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319756	FD	On-Demand	Anodyne	ACE	48	46
O=C(O)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319756	FD	On-Demand	Anodyne	FKBP1A	61	40
O=C(O)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319756	FD	On-Demand	Anodyne	CELA1	27	60
O=C(O)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319756	FD	On-Demand	Anodyne	GRIN2B	16	40
O=C(O)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319756	FD	On-Demand	Anodyne	ELANE	28	42
O=C(O)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319756	FD	On-Demand	Anodyne	CTRA_BOVIN	61	33
O=C(O)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319756	FD	On-Demand	Anodyne	TRY1_BOVIN	52	33
O=C(O)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319756	FD	On-Demand	Anodyne	CTSG	42	33
O=C(O)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319756	FD	On-Demand	Anodyne	CPT2	46	38
O=C(O)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319756	FD	On-Demand	Anodyne	PREP	131	69
O=C(O)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319756	FD	On-Demand	Anodyne	CELA2A	50	33
O=C(O)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319756	FD	On-Demand	Anodyne	LGMN	81	48
O=C(O)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319756	FD	On-Demand	Anodyne	KLK5	29	53
O=C(O)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319756	FD	On-Demand	Anodyne	SLC12A5	68	40
O=C(O)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCO1	ZINC000819319756	FD	On-Demand	Anodyne	TMPRSS11D	49	36
O=C(O)[C@@H]1CN(C(=O)Nc2ccccc2Oc2cc(F)cc(F)c2)CCO1	ZINC000819319757	GG	On-Demand	Anodyne	CCR3	17	40
O=C(O)[C@@H]1CN(C(=O)Nc2ccccc2Oc2cc(F)cc(F)c2)CCO1	ZINC000819319757	GG	On-Demand	Anodyne	RBP4	46	35
O=C(O)[C@H]1CN(C(=O)Nc2ccccc2Oc2cc(F)cc(F)c2)CCO1	ZINC000819319758	GG	On-Demand	Anodyne	CCR3	17	40
O=C(O)[C@H]1CN(C(=O)Nc2ccccc2Oc2cc(F)cc(F)c2)CCO1	ZINC000819319758	GG	On-Demand	Anodyne	RBP4	46	35
O=C(O)[C@@H]1CN(C(=O)Nc2ccnc(Oc3ccccc3)c2)CCO1	ZINC000819319759	EE	On-Demand	Anodyne	PDGFRB	26	43
O=C(O)[C@@H]1CN(C(=O)Nc2ccnc(Oc3ccccc3)c2)CCO1	ZINC000819319759	EE	On-Demand	Anodyne	FAAH	26	40
O=C(O)[C@H]1CN(C(=O)Nc2ccnc(Oc3ccccc3)c2)CCO1	ZINC000819319760	EE	On-Demand	Anodyne	PDGFRB	26	43
O=C(O)[C@H]1CN(C(=O)Nc2ccnc(Oc3ccccc3)c2)CCO1	ZINC000819319760	EE	On-Demand	Anodyne	FAAH	26	40
O=C(O)[C@@H]1CN(C(=O)Nc2cnn(C[C@H]3CCCO3)c2)CCO1	ZINC000819319767	DC	On-Demand	Anodyne	PANC	48	33
O=C(O)[C@H]1CN(C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)CCO1	ZINC000819319768	DC	On-Demand	Anodyne	PANC	48	33
O=C(O)[C@@H]1CN(C(=O)Nc2cnn(C[C@@H]3CCCO3)c2)CCO1	ZINC000819319769	DC	On-Demand	Anodyne	PANC	48	33
O=C(O)[C@H]1CN(C(=O)Nc2cnn(C[C@H]3CCCO3)c2)CCO1	ZINC000819319770	DC	On-Demand	Anodyne	PANC	48	33
Cc1ccc(NC(=O)N2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1	ZINC000819319792	EE	On-Demand	Anodyne	EPHX2	25	40
Cc1ccc(NC(=O)N2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1	ZINC000819319793	EE	On-Demand	Anodyne	EPHX2	25	40
Cc1ccc(NC(=O)N2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1	ZINC000819319794	EE	On-Demand	Anodyne	EPHX2	25	40
Cc1ccc(NC(=O)N2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1	ZINC000819319795	EE	On-Demand	Anodyne	EPHX2	25	40
COc1cccc(C2(CNC[C@@H](O)c3cc(F)ccc3F)CC2)c1	ZINC000819319802	EG	On-Demand	Anodyne	SOAT1	15	42
COc1cccc(C2(CNC[C@@H](O)c3cc(F)ccc3F)CC2)c1	ZINC000819319802	EG	On-Demand	Anodyne	ICMT	26	42
COc1cccc(C2(CNC[C@H](O)c3cc(F)ccc3F)CC2)c1	ZINC000819319803	EG	On-Demand	Anodyne	SOAT1	15	42
COc1cccc(C2(CNC[C@H](O)c3cc(F)ccc3F)CC2)c1	ZINC000819319803	EG	On-Demand	Anodyne	ICMT	26	42
COc1cccc(C2(CNC[C@H](O)c3ccccc3Cl)CC2)c1	ZINC000819319827	EH	On-Demand	Anodyne	SOAT1	17	47
COc1cccc(C2(CNC[C@@H](O)c3ccccc3Br)CC2)c1	ZINC000819319843	GH	On-Demand	Anodyne	SOAT1	16	47
COc1cccc(C2(CNC[C@H](O)c3ccccc3Br)CC2)c1	ZINC000819319844	GH	On-Demand	Anodyne	SOAT1	16	47
COc1cccc([S@@](=O)CC(=O)N2CCN(C)[C@H](C)C2)c1	ZINC000819319872	DC	On-Demand	Anodyne	DRD4	43	33
COc1cccc([S@](=O)CC(=O)N2CCN(C)[C@@H](C)C2)c1	ZINC000819319873	DC	On-Demand	Anodyne	DRD4	43	33
COc1cccc([S@@](=O)CC(=O)N2CCN(C)[C@@H](C)C2)c1	ZINC000819319874	DC	On-Demand	Anodyne	DRD4	43	33
COc1cccc([S@](=O)CC(=O)N2CCN(C)[C@H](C)C2)c1	ZINC000819319875	DC	On-Demand	Anodyne	DRD4	43	33
COC[C@@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819319878	FF	On-Demand	Anodyne	PDS	48	37
COC[C@H](NC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819319879	FF	On-Demand	Anodyne	PDS	48	37
COC[C@@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819319880	FF	On-Demand	Anodyne	PDS	48	37
COC[C@H](NC[C@](C)(O)CNC(=O)OC(C)(C)C)c1cccc(Cl)c1	ZINC000819319881	FF	On-Demand	Anodyne	PDS	48	37
COc1cccc(C2(CNC[C@H](O)c3cc(OC)ccc3OC)CC2)c1	ZINC000819319934	FG	On-Demand	Anodyne	MTNR1A	18	40
COc1cccc(C2(CNC[C@H](O)c3cc(OC)ccc3OC)CC2)c1	ZINC000819319934	FG	On-Demand	Anodyne	SOAT1	17	47
COc1cccc(C2(CNC[C@@H](O)c3cc(OC)ccc3OC)CC2)c1	ZINC000819319935	FG	On-Demand	Anodyne	MTNR1A	18	40
COc1cccc(C2(CNC[C@@H](O)c3cc(OC)ccc3OC)CC2)c1	ZINC000819319935	FG	On-Demand	Anodyne	SOAT1	17	47
O[C@@H](CNCc1cccc(-c2nc(CC(F)(F)F)no2)c1)c1cccnc1	ZINC000819319962	GG	On-Demand	Anodyne	ADRB2	19	41
O[C@@H](CNCc1cccc(-c2nc(CC(F)(F)F)no2)c1)c1cccnc1	ZINC000819319962	GG	On-Demand	Anodyne	ADRB1	21	40
O[C@@H](CNCc1cccc(-c2nc(CC(F)(F)F)no2)c1)c1cccnc1	ZINC000819319962	GG	On-Demand	Anodyne	ADRB3	82	46
O[C@H](CNCc1cccc(-c2nc(CC(F)(F)F)no2)c1)c1cccnc1	ZINC000819319963	GG	On-Demand	Anodyne	ADRB2	19	41
O[C@H](CNCc1cccc(-c2nc(CC(F)(F)F)no2)c1)c1cccnc1	ZINC000819319963	GG	On-Demand	Anodyne	ADRB1	21	40
O[C@H](CNCc1cccc(-c2nc(CC(F)(F)F)no2)c1)c1cccnc1	ZINC000819319963	GG	On-Demand	Anodyne	ADRB3	82	46
Cc1ccccc1[C@@H](O)CNCCc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000819319985	EG	On-Demand	Bother	MPO	48	39
Cc1ccccc1[C@@H](O)CNCCc1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000819319985	EG	On-Demand	Bother	NMBR	40	30
COc1cccc(C2(CNC[C@H](O)c3cccnc3)CC2)c1	ZINC000819319987	CE	On-Demand	Anodyne	ADRB2	23	40
COc1cccc(C2(CNC[C@H](O)c3cccnc3)CC2)c1	ZINC000819319987	CE	On-Demand	Anodyne	ADRB1	25	44
COc1cccc(C2(CNC[C@H](O)c3cccnc3)CC2)c1	ZINC000819319987	CE	On-Demand	Anodyne	ADRB3	81	44
COc1cccc(C2(CNC[C@@H](O)c3cccnc3)CC2)c1	ZINC000819319988	CE	On-Demand	Anodyne	ADRB2	23	40
COc1cccc(C2(CNC[C@@H](O)c3cccnc3)CC2)c1	ZINC000819319988	CE	On-Demand	Anodyne	ADRB1	25	44
COc1cccc(C2(CNC[C@@H](O)c3cccnc3)CC2)c1	ZINC000819319988	CE	On-Demand	Anodyne	ADRB3	81	44
COC[C@]1(CNC[C@@H](O)c2cccnc2)OCCc2ccccc21	ZINC000819319989	ED	On-Demand	Anodyne	ADRB1	18	40
COC[C@]1(CNC[C@@H](O)c2cccnc2)OCCc2ccccc21	ZINC000819319989	ED	On-Demand	Anodyne	ADRB3	56	40
COC[C@]1(CNC[C@H](O)c2cccnc2)OCCc2ccccc21	ZINC000819319990	ED	On-Demand	Anodyne	ADRB1	18	40
COC[C@]1(CNC[C@H](O)c2cccnc2)OCCc2ccccc21	ZINC000819319990	ED	On-Demand	Anodyne	ADRB3	56	40
COc1cccc(C2(CNC[C@@H](O)c3cc4ccccc4o3)CC2)c1	ZINC000819319998	EH	On-Demand	Anodyne	SOAT1	15	41
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	ZINC000819320001	FE	On-Demand	Anodyne	TGM2	25	45
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	ZINC000819320001	FE	On-Demand	Anodyne	F13A1	44	45
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	ZINC000819320002	FE	On-Demand	Anodyne	TGM2	25	45
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	ZINC000819320002	FE	On-Demand	Anodyne	F13A1	44	45
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	ZINC000819320003	FE	On-Demand	Anodyne	TGM2	25	45
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	ZINC000819320003	FE	On-Demand	Anodyne	F13A1	44	45
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	ZINC000819320004	FE	On-Demand	Anodyne	TGM2	25	45
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(S(=O)(=O)NCC2CC2)cc1	ZINC000819320004	FE	On-Demand	Anodyne	F13A1	44	45
Cc1nnc(CCNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000819320007	FD	On-Demand	Anodyne	GPR119	34	41
Cc1nnc(CCNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000819320008	FD	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(CC(N)=O)cc2)CC1	ZINC000819320079	GD	On-Demand	Anodyne	GPR119	51	52
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(CC(N)=O)cc2)CC1	ZINC000819320080	GD	On-Demand	Anodyne	GPR119	51	52
O[C@@H](CN[C@H]1COc2ccc(F)cc2C1)c1cccc(F)c1	ZINC000819320107	DF	On-Demand	Anodyne	ADRB3	16	41
O[C@@H](CN[C@@H]1COc2ccc(F)cc2C1)c1cccc(F)c1	ZINC000819320108	DF	On-Demand	Anodyne	ADRB3	16	41
O[C@H](CN[C@H]1COc2ccc(F)cc2C1)c1cccc(F)c1	ZINC000819320109	DF	On-Demand	Anodyne	ADRB3	16	41
O[C@H](CN[C@@H]1COc2ccc(F)cc2C1)c1cccc(F)c1	ZINC000819320110	DF	On-Demand	Anodyne	ADRB3	16	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccc(Cl)cc13)C2	ZINC000819320181	GG	On-Demand	Anodyne	MTNR1A	21	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3ccc(Cl)cc13)C2	ZINC000819320181	GG	On-Demand	Anodyne	CCKBR	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccc(Cl)cc13)C2	ZINC000819320182	GG	On-Demand	Anodyne	MTNR1A	21	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3ccc(Cl)cc13)C2	ZINC000819320182	GG	On-Demand	Anodyne	CCKBR	20	40
Cn1nc(-c2ccncc2)cc1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819320214	FE	On-Demand	Anodyne	GPR142	25	40
Cn1nc(-c2ccncc2)cc1NC(=O)C(F)=C1CCC1	ZINC000819320231	CF	On-Demand	Anodyne	GPR142	27	44
Cc1cc(CNC[C@H](O)c2cccnc2)cc(N2CCCC2)n1	ZINC000819320236	DE	On-Demand	Anodyne	ADRB2	23	41
Cc1cc(CNC[C@H](O)c2cccnc2)cc(N2CCCC2)n1	ZINC000819320236	DE	On-Demand	Anodyne	ADRB3	94	48
Cc1cc(CNC[C@@H](O)c2cccnc2)cc(N2CCCC2)n1	ZINC000819320237	DE	On-Demand	Anodyne	ADRB2	23	41
Cc1cc(CNC[C@@H](O)c2cccnc2)cc(N2CCCC2)n1	ZINC000819320237	DE	On-Demand	Anodyne	ADRB3	94	48
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2nccs2)cc1	ZINC000819320244	ED	On-Demand	Anodyne	ADRB2	23	44
CS(=O)(=O)c1ccc([C@@H](O)CNCCCc2nccs2)cc1	ZINC000819320244	ED	On-Demand	Anodyne	ADRB3	69	38
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2nccs2)cc1	ZINC000819320245	ED	On-Demand	Anodyne	ADRB2	23	44
CS(=O)(=O)c1ccc([C@H](O)CNCCCc2nccs2)cc1	ZINC000819320245	ED	On-Demand	Anodyne	ADRB3	69	38
COc1ccc(O[C@H](C)CNC(=O)C(F)=C2CCC2)cc1	ZINC000819320310	CF	On-Demand	Anodyne	MTNR1A	20	47
COc1ccc(O[C@H](C)CNC(=O)C(F)=C2CCC2)cc1	ZINC000819320310	CF	On-Demand	Anodyne	MTNR1B	15	47
COc1ccc(O[C@@H](C)CNC(=O)C(F)=C2CCC2)cc1	ZINC000819320311	CF	On-Demand	Anodyne	MTNR1A	20	47
COc1ccc(O[C@@H](C)CNC(=O)C(F)=C2CCC2)cc1	ZINC000819320311	CF	On-Demand	Anodyne	MTNR1B	15	47
CC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320320	DF	On-Demand	Anodyne	KLK3	59	35
CC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320320	DF	On-Demand	Anodyne	CTSB	55	38
CC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320320	DF	On-Demand	Anodyne	PAPA1_CARPA	44	33
CC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320320	DF	On-Demand	Anodyne	CTSK	25	40
CC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320320	DF	On-Demand	Anodyne	CAPNS1	57	34
CC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320320	DF	On-Demand	Anodyne	CAPN1	72	40
CC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320320	DF	On-Demand	Anodyne	CAPN2	109	39
CC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320320	DF	On-Demand	Anodyne	NPR	59	37
CC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320320	DF	On-Demand	Anodyne	TMPRSS11D	42	34
CC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320320	DF	On-Demand	Anodyne	PDS	62	38
CC[C@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320321	DF	On-Demand	Anodyne	KLK3	59	35
CC[C@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320321	DF	On-Demand	Anodyne	CTSB	55	38
CC[C@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320321	DF	On-Demand	Anodyne	PAPA1_CARPA	44	33
CC[C@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320321	DF	On-Demand	Anodyne	CTSK	25	40
CC[C@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320321	DF	On-Demand	Anodyne	CAPNS1	57	34
CC[C@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320321	DF	On-Demand	Anodyne	CAPN1	72	40
CC[C@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320321	DF	On-Demand	Anodyne	CAPN2	109	39
CC[C@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320321	DF	On-Demand	Anodyne	NPR	59	37
CC[C@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320321	DF	On-Demand	Anodyne	TMPRSS11D	42	34
CC[C@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320321	DF	On-Demand	Anodyne	PDS	62	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)C(F)=C1CCC1	ZINC000819320337	DH	On-Demand	Anodyne	HTR1A	15	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)C(F)=C1CCC1	ZINC000819320337	DH	On-Demand	Anodyne	ACHE	32	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)C(F)=C1CCC1	ZINC000819320337	DH	On-Demand	Anodyne	HTR1D	44	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)C(F)=C1CCC1	ZINC000819320337	DH	On-Demand	Anodyne	HTR1B	33	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)C(F)=C1CCC1	ZINC000819320337	DH	On-Demand	Anodyne	MPO	83	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)C(F)=C1CCC1	ZINC000819320337	DH	On-Demand	Anodyne	MAPT	16	48
Cc1cc(CNC[C@@H](O)c2cccc(Cl)c2)cc(N2CCCC2)n1	ZINC000819320381	EG	On-Demand	Anodyne	ADRB1	27	43
Cc1cc(CNC[C@@H](O)c2cccc(Cl)c2)cc(N2CCCC2)n1	ZINC000819320381	EG	On-Demand	Anodyne	ADRB3	42	43
Cc1cc(CNC[C@@H](O)c2cccc(Cl)c2)cc(N2CCCC2)n1	ZINC000819320381	EG	On-Demand	Anodyne	CYP3A4	47	37
Cc1cc(CNC[C@H](O)c2cccc(Cl)c2)cc(N2CCCC2)n1	ZINC000819320382	EG	On-Demand	Anodyne	ADRB1	27	43
Cc1cc(CNC[C@H](O)c2cccc(Cl)c2)cc(N2CCCC2)n1	ZINC000819320382	EG	On-Demand	Anodyne	ADRB3	42	43
Cc1cc(CNC[C@H](O)c2cccc(Cl)c2)cc(N2CCCC2)n1	ZINC000819320382	EG	On-Demand	Anodyne	CYP3A4	47	37
O[C@@H](CN[C@@H]1CCc2nc[nH]c2C1)c1ccc(Cl)cc1Cl	ZINC000819320429	EF	On-Demand	Anodyne	ADRB3	19	41
O[C@@H](CN[C@H]1CCc2nc[nH]c2C1)c1ccc(Cl)cc1Cl	ZINC000819320430	EF	On-Demand	Anodyne	ADRB3	19	41
O[C@H](CN[C@@H]1CCc2nc[nH]c2C1)c1ccc(Cl)cc1Cl	ZINC000819320431	EF	On-Demand	Anodyne	ADRB3	19	41
O[C@H](CN[C@H]1CCc2nc[nH]c2C1)c1ccc(Cl)cc1Cl	ZINC000819320432	EF	On-Demand	Anodyne	ADRB3	19	41
O[C@@H](CN[C@@H]1CCc2nc[nH]c2C1)c1cccc(C(F)(F)F)c1	ZINC000819320496	EF	On-Demand	Anodyne	ADRB3	19	44
O[C@H](CN[C@@H]1CCc2nc[nH]c2C1)c1cccc(C(F)(F)F)c1	ZINC000819320497	EF	On-Demand	Anodyne	ADRB3	19	44
O[C@H](CN[C@H]1CCc2nc[nH]c2C1)c1cccc(C(F)(F)F)c1	ZINC000819320498	EF	On-Demand	Anodyne	ADRB3	19	44
O[C@@H](CN[C@H]1CCc2nc[nH]c2C1)c1cccc(C(F)(F)F)c1	ZINC000819320499	EF	On-Demand	Anodyne	ADRB3	19	44
NC(=O)COc1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819320548	CD	On-Demand	Anodyne	PDS	57	38
O=C(/C=C\[C@H]1CCCO1)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000819320585	DG	On-Demand	Anodyne	MPO	42	34
O=C(/C=C\[C@H]1CCCO1)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000819320585	DG	On-Demand	Anodyne	MAPT	15	45
O=C(/C=C\[C@@H]1CCCO1)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000819320586	DG	On-Demand	Anodyne	MPO	42	34
O=C(/C=C\[C@@H]1CCCO1)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000819320586	DG	On-Demand	Anodyne	MAPT	15	45
O=C(/C=C/[C@H]1CCCO1)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000819320587	DG	On-Demand	Anodyne	MPO	42	34
O=C(/C=C/[C@H]1CCCO1)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000819320587	DG	On-Demand	Anodyne	MAPT	15	45
O=C(/C=C/[C@@H]1CCCO1)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000819320588	DG	On-Demand	Anodyne	MPO	42	34
O=C(/C=C/[C@@H]1CCCO1)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000819320588	DG	On-Demand	Anodyne	MAPT	15	45
O=C(OCc1ccccc1)c1ccc(CNC[C@H](O)CN2CCOCC2)cc1	ZINC000819320589	GD	On-Demand	Anodyne	CASR	30	45
O=C(OCc1ccccc1)c1ccc(CNC[C@H](O)CN2CCOCC2)cc1	ZINC000819320589	GD	On-Demand	Anodyne	ABCB1	51	38
O=C(OCc1ccccc1)c1ccc(CNC[C@@H](O)CN2CCOCC2)cc1	ZINC000819320590	GD	On-Demand	Anodyne	CASR	30	45
O=C(OCc1ccccc1)c1ccc(CNC[C@@H](O)CN2CCOCC2)cc1	ZINC000819320590	GD	On-Demand	Anodyne	ABCB1	51	38
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(F)=C1CCC1)C2	ZINC000819320614	CF	On-Demand	Anodyne	HTR3A	34	42
CN1[C@H]2CCC[C@H]1CC(NC(=O)C(F)=C1CCC1)C2	ZINC000819320614	CF	On-Demand	Anodyne	GLRA1	42	31
Cc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc(N2CCCC2)n1	ZINC000819320639	FF	On-Demand	Bother	CACNA1D	59	32
Cc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc(N2CCCC2)n1	ZINC000819320640	FF	On-Demand	Bother	CACNA1D	59	32
O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819320698	GE	On-Demand	Anodyne	ADRB2	23	41
O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819320698	GE	On-Demand	Anodyne	ADRB1	24	41
O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819320698	GE	On-Demand	Anodyne	ADRB3	89	41
O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819320699	GE	On-Demand	Anodyne	ADRB2	23	41
O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819320699	GE	On-Demand	Anodyne	ADRB1	24	41
O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819320699	GE	On-Demand	Anodyne	ADRB3	89	41
CC(=O)Nc1cccc(CC(=O)N2CCc3c(cccc3N3CCOC3=O)C2)c1	ZINC000819320717	GF	On-Demand	Anodyne	P2RY14	42	34
CSC1(CNC[C@H](O)c2cccc(Cl)c2)CCN(C)CC1	ZINC000819320722	EF	On-Demand	Anodyne	ADRB1	32	41
CSC1(CNC[C@H](O)c2cccc(Cl)c2)CCN(C)CC1	ZINC000819320722	EF	On-Demand	Anodyne	ADRB3	47	41
CSC1(CNC[C@@H](O)c2cccc(Cl)c2)CCN(C)CC1	ZINC000819320723	EF	On-Demand	Anodyne	ADRB1	32	41
CSC1(CNC[C@@H](O)c2cccc(Cl)c2)CCN(C)CC1	ZINC000819320723	EF	On-Demand	Anodyne	ADRB3	47	41
O[C@@H](CNCCCc1nccs1)c1ccc(Cl)cc1	ZINC000819320810	CG	On-Demand	Anodyne	FFAR2	22	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccc(OCC(N)=O)c1	ZINC000819320830	FD	On-Demand	Anodyne	PDS	50	35
O[C@H](CNCCCc1nccs1)c1cccc(Cl)c1	ZINC000819320842	CG	On-Demand	Anodyne	ADRB2	49	41
O[C@H](CNCCCc1nccs1)c1cccc(Cl)c1	ZINC000819320842	CG	On-Demand	Anodyne	ADRB1	63	48
O[C@H](CNCCCc1nccs1)c1cccc(Cl)c1	ZINC000819320842	CG	On-Demand	Anodyne	ADRB3	85	48
O[C@@H](CNCCCc1nccs1)c1cccc(Cl)c1	ZINC000819320843	CG	On-Demand	Anodyne	ADRB2	49	41
O[C@@H](CNCCCc1nccs1)c1cccc(Cl)c1	ZINC000819320843	CG	On-Demand	Anodyne	ADRB1	63	48
O[C@@H](CNCCCc1nccs1)c1cccc(Cl)c1	ZINC000819320843	CG	On-Demand	Anodyne	ADRB3	85	48
C[C@]1(CNC[C@@H](O)c2cccnc2)OCCc2sccc21	ZINC000819320858	DE	On-Demand	Anodyne	ADRB1	22	40
C[C@]1(CNC[C@@H](O)c2cccnc2)OCCc2sccc21	ZINC000819320858	DE	On-Demand	Anodyne	ADRB3	85	42
C[C@]1(CNC[C@H](O)c2cccnc2)OCCc2sccc21	ZINC000819320859	DE	On-Demand	Anodyne	ADRB1	22	40
C[C@]1(CNC[C@H](O)c2cccnc2)OCCc2sccc21	ZINC000819320859	DE	On-Demand	Anodyne	ADRB3	85	42
C[C@@]1(CNC[C@H](O)c2cccnc2)OCCc2sccc21	ZINC000819320861	DE	On-Demand	Anodyne	ADRB1	22	40
C[C@@]1(CNC[C@H](O)c2cccnc2)OCCc2sccc21	ZINC000819320861	DE	On-Demand	Anodyne	ADRB3	85	42
C[C@@]1(CNC[C@@H](O)c2cccnc2)OCCc2sccc21	ZINC000819320862	DE	On-Demand	Anodyne	ADRB1	22	40
C[C@@]1(CNC[C@@H](O)c2cccnc2)OCCc2sccc21	ZINC000819320862	DE	On-Demand	Anodyne	ADRB3	85	42
COC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320893	EE	On-Demand	Anodyne	ADRB2	37	43
COC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320893	EE	On-Demand	Anodyne	ADRB1	55	43
COC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320893	EE	On-Demand	Anodyne	ADRB3	39	43
COC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320893	EE	On-Demand	Anodyne	KLK3	52	34
COC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320893	EE	On-Demand	Anodyne	CAPNS1	56	33
COC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320893	EE	On-Demand	Anodyne	ABCB1	15	41
COC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320893	EE	On-Demand	Anodyne	CAPN1	56	37
COC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320893	EE	On-Demand	Anodyne	CAPN2	79	35
COC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320893	EE	On-Demand	Anodyne	NPR	46	32
COC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320893	EE	On-Demand	Anodyne	TMPRSS11D	42	32
COC[C@@H](O)CNCc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000819320893	EE	On-Demand	Anodyne	PDS	42	35
O[C@@H](CN[C@@H]1CCc2nc[nH]c2C1)c1cccc(Cl)c1	ZINC000819320926	CE	On-Demand	Anodyne	ADRB1	29	56
O[C@@H](CN[C@@H]1CCc2nc[nH]c2C1)c1cccc(Cl)c1	ZINC000819320926	CE	On-Demand	Anodyne	ADRB3	49	56
O[C@@H](CN[C@@H]1CCc2nc[nH]c2C1)c1cccc(Cl)c1	ZINC000819320926	CE	On-Demand	Anodyne	CYP3A4	46	36
O[C@H](CN[C@@H]1CCc2nc[nH]c2C1)c1cccc(Cl)c1	ZINC000819320928	CE	On-Demand	Anodyne	ADRB1	29	56
O[C@H](CN[C@@H]1CCc2nc[nH]c2C1)c1cccc(Cl)c1	ZINC000819320928	CE	On-Demand	Anodyne	ADRB3	49	56
O[C@H](CN[C@@H]1CCc2nc[nH]c2C1)c1cccc(Cl)c1	ZINC000819320928	CE	On-Demand	Anodyne	CYP3A4	46	36
O[C@H](CN[C@H]1CCc2nc[nH]c2C1)c1cccc(Cl)c1	ZINC000819320929	CE	On-Demand	Anodyne	ADRB1	29	56
O[C@H](CN[C@H]1CCc2nc[nH]c2C1)c1cccc(Cl)c1	ZINC000819320929	CE	On-Demand	Anodyne	ADRB3	49	56
O[C@H](CN[C@H]1CCc2nc[nH]c2C1)c1cccc(Cl)c1	ZINC000819320929	CE	On-Demand	Anodyne	CYP3A4	46	36
O[C@@H](CN[C@H]1CCc2nc[nH]c2C1)c1cccc(Cl)c1	ZINC000819320930	CE	On-Demand	Anodyne	ADRB1	29	56
O[C@@H](CN[C@H]1CCc2nc[nH]c2C1)c1cccc(Cl)c1	ZINC000819320930	CE	On-Demand	Anodyne	ADRB3	49	56
O[C@@H](CN[C@H]1CCc2nc[nH]c2C1)c1cccc(Cl)c1	ZINC000819320930	CE	On-Demand	Anodyne	CYP3A4	46	36
O[C@@H](CN[C@@H]1CCc2nc[nH]c2C1)c1ccccc1	ZINC000819320950	CD	On-Demand	Anodyne	ADRB3	21	43
O[C@H](CN[C@@H]1CCc2nc[nH]c2C1)c1ccccc1	ZINC000819320952	CD	On-Demand	Anodyne	ADRB3	21	43
O[C@H](CN[C@H]1CCc2nc[nH]c2C1)c1ccccc1	ZINC000819320953	CD	On-Demand	Anodyne	ADRB3	21	43
O[C@@H](CN[C@H]1CCc2nc[nH]c2C1)c1ccccc1	ZINC000819320954	CD	On-Demand	Anodyne	ADRB3	21	43
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CC[C@@H](c3ccccc3)O2)c1	ZINC000819320958	EG	On-Demand	Bother	CACNA1C	46	37
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CC[C@@H](c3ccccc3)O2)c1	ZINC000819320958	EG	On-Demand	Bother	CACNA1D	67	37
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CC[C@@H](c3ccccc3)O2)c1	ZINC000819320960	EG	On-Demand	Bother	CACNA1C	46	37
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CC[C@@H](c3ccccc3)O2)c1	ZINC000819320960	EG	On-Demand	Bother	CACNA1D	67	37
O[C@H](CNCCCc1nccs1)c1cccc(Br)c1	ZINC000819320983	EG	On-Demand	Anodyne	ADRB3	51	35
O[C@@H](CNCCCc1nccs1)c1cccc(Br)c1	ZINC000819320986	EG	On-Demand	Anodyne	ADRB3	51	35
O[C@H](CNCCCc1nccs1)c1ccccc1	ZINC000819321000	CE	On-Demand	Anodyne	ADRB2	30	47
O[C@H](CNCCCc1nccs1)c1ccccc1	ZINC000819321000	CE	On-Demand	Anodyne	ADRB1	42	38
O[C@H](CNCCCc1nccs1)c1ccccc1	ZINC000819321000	CE	On-Demand	Anodyne	ADRB3	76	43
CC(=O)Nc1cccc(CC(=O)N2CCC(N(C)CC(F)F)CC2)c1	ZINC000819321012	FE	On-Demand	Anodyne	CCR3	43	36
CC(=O)Nc1cccc(CC(=O)N2CCC(N(C)CC(F)F)CC2)c1	ZINC000819321012	FE	On-Demand	Anodyne	EPHX2	21	43
CC(=O)Nc1cccc(CC(=O)N2CCC(N(C)CC(F)F)CC2)c1	ZINC000819321012	FE	On-Demand	Anodyne	MCHR1	31	40
Cc1ccccc1[C@@H](O)CNCc1cccc(N2C(=O)NC3(CCCC3)C2=O)c1	ZINC000819321020	GG	On-Demand	Anodyne	ADRB2	30	43
COCC[C@@H](COC)NC[C@H](O)c1cccc(Cl)c1	ZINC000819321036	CE	On-Demand	Anodyne	ADRB2	23	50
COCC[C@@H](COC)NC[C@H](O)c1cccc(Cl)c1	ZINC000819321036	CE	On-Demand	Anodyne	ADRB1	37	48
COCC[C@@H](COC)NC[C@H](O)c1cccc(Cl)c1	ZINC000819321036	CE	On-Demand	Anodyne	ADRB3	54	48
COCC[C@H](COC)NC[C@H](O)c1cccc(Cl)c1	ZINC000819321037	CE	On-Demand	Anodyne	ADRB2	23	50
COCC[C@H](COC)NC[C@H](O)c1cccc(Cl)c1	ZINC000819321037	CE	On-Demand	Anodyne	ADRB1	37	48
COCC[C@H](COC)NC[C@H](O)c1cccc(Cl)c1	ZINC000819321037	CE	On-Demand	Anodyne	ADRB3	54	48
COCC[C@@H](COC)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819321038	CE	On-Demand	Anodyne	ADRB2	23	50
COCC[C@@H](COC)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819321038	CE	On-Demand	Anodyne	ADRB1	37	48
COCC[C@@H](COC)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819321038	CE	On-Demand	Anodyne	ADRB3	54	48
COCC[C@H](COC)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819321039	CE	On-Demand	Anodyne	ADRB2	23	50
COCC[C@H](COC)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819321039	CE	On-Demand	Anodyne	ADRB1	37	48
COCC[C@H](COC)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819321039	CE	On-Demand	Anodyne	ADRB3	54	48
CO[C@@H](C)[C@@H](C)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819321040	CF	On-Demand	Anodyne	ADRB2	16	52
CO[C@@H](C)[C@@H](C)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819321041	CF	On-Demand	Anodyne	ADRB2	16	52
O[C@@H](CNCCCc1nccs1)c1ccccc1	ZINC000819321101	CE	On-Demand	Anodyne	ADRB2	30	47
O[C@@H](CNCCCc1nccs1)c1ccccc1	ZINC000819321101	CE	On-Demand	Anodyne	ADRB1	42	38
O[C@@H](CNCCCc1nccs1)c1ccccc1	ZINC000819321101	CE	On-Demand	Anodyne	ADRB3	76	43
C#CCCCNC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819321152	FD	On-Demand	Mild	PREP	15	40
C#CCCCNC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819321154	FD	On-Demand	Mild	PREP	15	40
O[C@@H](CN[C@@H]1CCc2nc[nH]c2C1)c1ccc(F)c(F)c1	ZINC000819321156	CD	On-Demand	Anodyne	ADRB3	20	43
O[C@@H](CN[C@H]1CCc2nc[nH]c2C1)c1ccc(F)c(F)c1	ZINC000819321158	CD	On-Demand	Anodyne	ADRB3	20	43
O[C@H](CN[C@@H]1CCc2nc[nH]c2C1)c1ccc(F)c(F)c1	ZINC000819321161	CD	On-Demand	Anodyne	ADRB3	20	43
O[C@H](CN[C@H]1CCc2nc[nH]c2C1)c1ccc(F)c(F)c1	ZINC000819321164	CD	On-Demand	Anodyne	ADRB3	20	43
CO[C@@H](C)[C@@H](C)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819321189	DD	On-Demand	Anodyne	ADRB2	15	48
CO[C@@H](C)[C@@H](C)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819321189	DD	On-Demand	Anodyne	ADRB3	24	43
CO[C@@H](C)[C@@H](C)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819321190	DD	On-Demand	Anodyne	ADRB2	15	48
CO[C@@H](C)[C@@H](C)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819321190	DD	On-Demand	Anodyne	ADRB3	24	43
COC[C@@H](O)CN[C@@H]1CC(C)(C)Oc2ccc(NC(=O)OC(C)(C)C)cc21	ZINC000819321198	GG	On-Demand	Anodyne	CTSD	20	42
COC[C@@H](O)CN[C@H]1CC(C)(C)Oc2ccc(NC(=O)OC(C)(C)C)cc21	ZINC000819321202	GG	On-Demand	Anodyne	CTSD	20	42
CCCn1cc(NC(=O)Cc2ccc(-n3cnnc3)cc2)cn1	ZINC000819321226	DE	On-Demand	Anodyne	PDGFRB	17	41
CCCn1cc(NC(=O)Cc2ccc(-n3cnnc3)cc2)cn1	ZINC000819321226	DE	On-Demand	Anodyne	PANC	50	32
C#CCCCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819321238	CD	On-Demand	Mild	DRD4	41	31
C#CCCCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819321238	CD	On-Demand	Mild	MTNR1A	53	45
C#CCCCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819321238	CD	On-Demand	Mild	MTNR1B	50	45
C#CCCCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819321241	CD	On-Demand	Mild	DRD4	41	31
C#CCCCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819321241	CD	On-Demand	Mild	MTNR1A	53	45
C#CCCCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819321241	CD	On-Demand	Mild	MTNR1B	50	45
C#CCCCNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819321264	CD	On-Demand	Mild	KCNK3	47	32
O=[N+]([O-])c1cccc([C@H](O)CNCCCc2nccs2)c1	ZINC000819321267	DE	On-Demand	Bother	ADRB3	61	39
O=[N+]([O-])c1cccc([C@@H](O)CNCCCc2nccs2)c1	ZINC000819321270	DE	On-Demand	Bother	ADRB3	61	39
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCc2nccs2)CC1	ZINC000819321285	FF	On-Demand	Anodyne	GPR119	43	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCc2nccs2)CC1	ZINC000819321287	FF	On-Demand	Anodyne	GPR119	43	41
CCCn1cc(NC(=O)/C=C/[C@H]2CCCO2)cn1	ZINC000819321289	BD	On-Demand	Anodyne	PANC	45	31
CCCn1cc(NC(=O)/C=C\[C@@H]2CCCO2)cn1	ZINC000819321292	BD	On-Demand	Anodyne	PANC	45	31
CCCn1cc(NC(=O)/C=C\[C@H]2CCCO2)cn1	ZINC000819321295	BD	On-Demand	Anodyne	PANC	45	31
CCCn1cc(NC(=O)/C=C/[C@@H]2CCCO2)cn1	ZINC000819321296	BD	On-Demand	Anodyne	PANC	45	31
O=C(OCc1ccccc1)c1ccc(CNC[C@H](O)C(F)(F)F)cc1	ZINC000819321342	FG	On-Demand	Anodyne	CAPN2	54	34
O=C(OCc1ccccc1)c1ccc(CNC[C@@H](O)C(F)(F)F)cc1	ZINC000819321345	FG	On-Demand	Anodyne	CAPN2	54	34
CC[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819321405	CD	On-Demand	Bother	CACNA1C	52	37
CC[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819321405	CD	On-Demand	Bother	CACNA1D	80	36
CC[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819321406	CD	On-Demand	Bother	CACNA1C	52	37
CC[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819321406	CD	On-Demand	Bother	CACNA1D	80	36
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819321429	GH	On-Demand	Anodyne	DRD2	25	47
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819321429	GH	On-Demand	Anodyne	DRD4	41	51
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819321429	GH	On-Demand	Anodyne	ACHE	37	42
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819321429	GH	On-Demand	Anodyne	DRD3	19	47
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819321429	GH	On-Demand	Anodyne	SIGMAR1	44	50
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819321429	GH	On-Demand	Anodyne	BCHE	15	42
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819321429	GH	On-Demand	Anodyne	CCR3	31	40
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819321429	GH	On-Demand	Anodyne	SLC18A3	18	42
COc1ccc(OC)c([C@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819321429	GH	On-Demand	Anodyne	MCHR1	18	40
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819321430	GH	On-Demand	Anodyne	DRD2	25	47
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819321430	GH	On-Demand	Anodyne	DRD4	41	51
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819321430	GH	On-Demand	Anodyne	ACHE	37	42
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819321430	GH	On-Demand	Anodyne	DRD3	19	47
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819321430	GH	On-Demand	Anodyne	SIGMAR1	44	50
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819321430	GH	On-Demand	Anodyne	BCHE	15	42
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819321430	GH	On-Demand	Anodyne	CCR3	31	40
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819321430	GH	On-Demand	Anodyne	SLC18A3	18	42
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819321430	GH	On-Demand	Anodyne	MCHR1	18	40
CCc1nnc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819321437	DD	On-Demand	Bother	CACNA1D	46	32
CCc1nnc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819321438	DD	On-Demand	Bother	CACNA1D	46	32
CS(=O)(=O)c1ccc([C@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819321490	HG	On-Demand	Anodyne	ACHE	17	42
CS(=O)(=O)c1ccc([C@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819321490	HG	On-Demand	Anodyne	ADRB3	40	39
CS(=O)(=O)c1ccc([C@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819321490	HG	On-Demand	Anodyne	SIGMAR1	25	49
CS(=O)(=O)c1ccc([C@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819321490	HG	On-Demand	Anodyne	CCR5	33	42
CS(=O)(=O)c1ccc([C@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819321492	HG	On-Demand	Anodyne	ACHE	17	42
CS(=O)(=O)c1ccc([C@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819321492	HG	On-Demand	Anodyne	ADRB3	40	39
CS(=O)(=O)c1ccc([C@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819321492	HG	On-Demand	Anodyne	SIGMAR1	25	49
CS(=O)(=O)c1ccc([C@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819321492	HG	On-Demand	Anodyne	CCR5	33	42
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819321495	HG	On-Demand	Anodyne	ACHE	17	42
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819321495	HG	On-Demand	Anodyne	ADRB3	40	39
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819321495	HG	On-Demand	Anodyne	SIGMAR1	25	49
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819321495	HG	On-Demand	Anodyne	CCR5	33	42
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819321497	HG	On-Demand	Anodyne	ACHE	17	42
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819321497	HG	On-Demand	Anodyne	ADRB3	40	39
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819321497	HG	On-Demand	Anodyne	SIGMAR1	25	49
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819321497	HG	On-Demand	Anodyne	CCR5	33	42
CC[C@@H](CNC[C@@H](O)c1cccnc1)OC	ZINC000819321501	BD	On-Demand	Anodyne	ADRB2	25	47
CC[C@@H](CNC[C@@H](O)c1cccnc1)OC	ZINC000819321501	BD	On-Demand	Anodyne	ADRB1	26	47
CC[C@@H](CNC[C@@H](O)c1cccnc1)OC	ZINC000819321501	BD	On-Demand	Anodyne	ADRB3	93	47
CC[C@@H](CNC[C@H](O)c1cccnc1)OC	ZINC000819321504	BD	On-Demand	Anodyne	ADRB2	25	47
CC[C@@H](CNC[C@H](O)c1cccnc1)OC	ZINC000819321504	BD	On-Demand	Anodyne	ADRB1	26	47
CC[C@@H](CNC[C@H](O)c1cccnc1)OC	ZINC000819321504	BD	On-Demand	Anodyne	ADRB3	93	47
COC(=O)c1ccc(OC[C@H](O)CNOC/C=C/Cl)cc1	ZINC000819321517	DD	On-Demand	Anodyne	ADRB2	31	46
COC(=O)c1ccc(OC[C@H](O)CNOC/C=C/Cl)cc1	ZINC000819321517	DD	On-Demand	Anodyne	ADRB1	47	42
COC(=O)c1ccc(OC[C@H](O)CNOC/C=C/Cl)cc1	ZINC000819321517	DD	On-Demand	Anodyne	ADRB3	28	42
COC(=O)c1ccc(OC[C@@H](O)CNOC/C=C\Cl)cc1	ZINC000819321522	DD	On-Demand	Anodyne	ADRB2	31	46
COC(=O)c1ccc(OC[C@@H](O)CNOC/C=C\Cl)cc1	ZINC000819321522	DD	On-Demand	Anodyne	ADRB1	47	42
COC(=O)c1ccc(OC[C@@H](O)CNOC/C=C\Cl)cc1	ZINC000819321522	DD	On-Demand	Anodyne	ADRB3	28	42
COC(=O)c1ccc(OC[C@H](O)CNOC/C=C\Cl)cc1	ZINC000819321524	DD	On-Demand	Anodyne	ADRB2	31	46
COC(=O)c1ccc(OC[C@H](O)CNOC/C=C\Cl)cc1	ZINC000819321524	DD	On-Demand	Anodyne	ADRB1	47	42
COC(=O)c1ccc(OC[C@H](O)CNOC/C=C\Cl)cc1	ZINC000819321524	DD	On-Demand	Anodyne	ADRB3	28	42
COC(=O)c1ccc(OC[C@@H](O)CNOC/C=C/Cl)cc1	ZINC000819321527	DD	On-Demand	Anodyne	ADRB2	31	46
COC(=O)c1ccc(OC[C@@H](O)CNOC/C=C/Cl)cc1	ZINC000819321527	DD	On-Demand	Anodyne	ADRB1	47	42
COC(=O)c1ccc(OC[C@@H](O)CNOC/C=C/Cl)cc1	ZINC000819321527	DD	On-Demand	Anodyne	ADRB3	28	42
CN(C)S(=O)(=O)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819321619	DC	On-Demand	Anodyne	ADRB2	47	40
CN(C)S(=O)(=O)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819321619	DC	On-Demand	Anodyne	ADRB1	60	50
CN(C)S(=O)(=O)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819321619	DC	On-Demand	Anodyne	ADRB3	88	63
CN(C)S(=O)(=O)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819321621	DC	On-Demand	Anodyne	ADRB2	47	40
CN(C)S(=O)(=O)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819321621	DC	On-Demand	Anodyne	ADRB1	60	50
CN(C)S(=O)(=O)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819321621	DC	On-Demand	Anodyne	ADRB3	88	63
C=Cc1ccc(CCNC[C@H](O)c2ccc(F)cc2C)cc1	ZINC000819321632	CH	On-Demand	Anodyne	ADRB2	45	41
C=Cc1ccc(CCNC[C@H](O)c2ccc(F)cc2C)cc1	ZINC000819321632	CH	On-Demand	Anodyne	ADRB1	37	41
C=Cc1ccc(CCNC[C@@H](O)c2ccc(F)cc2C)cc1	ZINC000819321634	CH	On-Demand	Anodyne	ADRB2	45	41
C=Cc1ccc(CCNC[C@@H](O)c2ccc(F)cc2C)cc1	ZINC000819321634	CH	On-Demand	Anodyne	ADRB1	37	41
C=Cc1ccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819321635	EF	On-Demand	Anodyne	ADRB2	72	48
C=Cc1ccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819321635	EF	On-Demand	Anodyne	ADRB1	69	42
C=Cc1ccc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819321635	EF	On-Demand	Anodyne	ADRB3	148	47
C=Cc1ccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819321637	EF	On-Demand	Anodyne	ADRB2	72	48
C=Cc1ccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819321637	EF	On-Demand	Anodyne	ADRB1	69	42
C=Cc1ccc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819321637	EF	On-Demand	Anodyne	ADRB3	148	47
CS[C@H]1CC[C@@H](NC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819321642	DF	On-Demand	Anodyne	INHA	73	35
CS[C@H]1CC[C@H](NC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819321643	DF	On-Demand	Anodyne	INHA	73	35
CS[C@@H]1CC[C@H](NC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819321646	DF	On-Demand	Anodyne	INHA	73	35
C#CCCCNC(=O)c1cnc2cc(OC)ccn12	ZINC000819321673	CD	On-Demand	Mild	DRD4	41	32
O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819321678	GF	On-Demand	Anodyne	ADRB2	27	44
O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819321678	GF	On-Demand	Anodyne	ADRB1	19	44
O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819321678	GF	On-Demand	Anodyne	ADRB3	18	44
O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819321680	GF	On-Demand	Anodyne	ADRB2	27	44
O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819321680	GF	On-Demand	Anodyne	ADRB1	19	44
O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819321680	GF	On-Demand	Anodyne	ADRB3	18	44
O[C@H](CNC[C@H]1CC[C@@H](c2ccccc2)O1)c1cccnc1	ZINC000819321728	CF	On-Demand	Anodyne	ADRB2	17	40
O[C@H](CNC[C@H]1CC[C@@H](c2ccccc2)O1)c1cccnc1	ZINC000819321728	CF	On-Demand	Anodyne	ADRB3	75	46
CN1[C@H]2CCC[C@H]1CC(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C2	ZINC000819321729	GF	On-Demand	Mild	PAPA1_CARPA	37	46
O[C@@H](CNC[C@H]1CC[C@@H](c2ccccc2)O1)c1cccnc1	ZINC000819321730	CF	On-Demand	Anodyne	ADRB2	17	40
O[C@@H](CNC[C@H]1CC[C@@H](c2ccccc2)O1)c1cccnc1	ZINC000819321730	CF	On-Demand	Anodyne	ADRB3	75	46
CN1[C@H]2CCC[C@H]1CC(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C2	ZINC000819321735	GF	On-Demand	Mild	PAPA1_CARPA	37	46
C[C@H]1C[C@H](NC[C@H](O)c2ccc(F)cc2Cl)c2ccsc2S1(=O)=O	ZINC000819321743	GG	On-Demand	Anodyne	CA2	28	40
C[C@H]1C[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)c2ccsc2S1(=O)=O	ZINC000819321745	GG	On-Demand	Anodyne	CA2	28	40
CCOC(=O)N1CCC(C(=O)Nc2cc(C(=O)OC)ccc2N2CCCC2)CC1	ZINC000819321761	HF	On-Demand	Anodyne	KCNQ2	68	35
COc1ccc(OC)c([C@H](O)CNCc2cc(C)nc(N3CCCC3)c2)c1	ZINC000819321789	FF	On-Demand	Anodyne	GALR2	44	37
O[C@@H](CN[C@@H]1CCc2nc[nH]c2C1)c1ccc(C(F)(F)F)cc1	ZINC000819321791	EF	On-Demand	Anodyne	ADRB3	18	53
O[C@H](CN[C@@H]1CCc2nc[nH]c2C1)c1ccc(C(F)(F)F)cc1	ZINC000819321793	EF	On-Demand	Anodyne	ADRB3	18	53
O[C@H](CN[C@H]1CCc2nc[nH]c2C1)c1ccc(C(F)(F)F)cc1	ZINC000819321794	EF	On-Demand	Anodyne	ADRB3	18	53
O[C@@H](CN[C@H]1CCc2nc[nH]c2C1)c1ccc(C(F)(F)F)cc1	ZINC000819321796	EF	On-Demand	Anodyne	ADRB3	18	53
O=[N+]([O-])c1ccc([C@@H](O)CN[C@@H]2CCc3nc[nH]c3C2)cc1	ZINC000819321830	DD	On-Demand	Bother	ADRB3	17	41
O=[N+]([O-])c1ccc([C@H](O)CN[C@@H]2CCc3nc[nH]c3C2)cc1	ZINC000819321832	DD	On-Demand	Bother	ADRB3	17	41
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321873	EG	On-Demand	Anodyne	ADRB2	23	42
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321873	EG	On-Demand	Anodyne	ADRB1	24	42
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321873	EG	On-Demand	Anodyne	DRD4	15	42
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321873	EG	On-Demand	Anodyne	SLC6A3	16	43
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321873	EG	On-Demand	Anodyne	ADRB3	90	46
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321873	EG	On-Demand	Anodyne	SIGMAR1	24	42
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321874	EG	On-Demand	Anodyne	ADRB2	23	42
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321874	EG	On-Demand	Anodyne	ADRB1	24	42
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321874	EG	On-Demand	Anodyne	DRD4	15	42
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321874	EG	On-Demand	Anodyne	SLC6A3	16	43
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321874	EG	On-Demand	Anodyne	ADRB3	90	46
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321874	EG	On-Demand	Anodyne	SIGMAR1	24	42
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321875	EG	On-Demand	Anodyne	ADRB2	23	42
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321875	EG	On-Demand	Anodyne	ADRB1	24	42
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321875	EG	On-Demand	Anodyne	DRD4	15	42
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321875	EG	On-Demand	Anodyne	SLC6A3	16	43
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321875	EG	On-Demand	Anodyne	ADRB3	90	46
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321875	EG	On-Demand	Anodyne	SIGMAR1	24	42
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321876	EG	On-Demand	Anodyne	ADRB2	23	42
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321876	EG	On-Demand	Anodyne	ADRB1	24	42
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321876	EG	On-Demand	Anodyne	DRD4	15	42
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321876	EG	On-Demand	Anodyne	SLC6A3	16	43
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321876	EG	On-Demand	Anodyne	ADRB3	90	46
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccnc1	ZINC000819321876	EG	On-Demand	Anodyne	SIGMAR1	24	42
CON(C)C(=O)CCNC[C@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321877	EE	On-Demand	Anodyne	DRD2	20	46
CON(C)C(=O)CCNC[C@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321877	EE	On-Demand	Anodyne	DRD4	36	44
CON(C)C(=O)CCNC[C@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321877	EE	On-Demand	Anodyne	ACHE	44	40
CON(C)C(=O)CCNC[C@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321877	EE	On-Demand	Anodyne	SLC6A1	88	32
CON(C)C(=O)CCNC[C@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321877	EE	On-Demand	Anodyne	DRD3	18	44
CON(C)C(=O)CCNC[C@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321877	EE	On-Demand	Anodyne	OPRK1	23	41
CON(C)C(=O)CCNC[C@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321877	EE	On-Demand	Anodyne	CHRM3	18	40
CON(C)C(=O)CCNC[C@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321877	EE	On-Demand	Anodyne	SIGMAR1	50	46
CON(C)C(=O)CCNC[C@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321877	EE	On-Demand	Anodyne	CCR3	24	42
CON(C)C(=O)CCNC[C@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321877	EE	On-Demand	Anodyne	CCR5	26	42
CON(C)C(=O)CCNC[C@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321877	EE	On-Demand	Anodyne	BIRC2	15	40
CON(C)C(=O)CCNC[C@@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321878	EE	On-Demand	Anodyne	DRD2	20	46
CON(C)C(=O)CCNC[C@@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321878	EE	On-Demand	Anodyne	DRD4	36	44
CON(C)C(=O)CCNC[C@@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321878	EE	On-Demand	Anodyne	ACHE	44	40
CON(C)C(=O)CCNC[C@@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321878	EE	On-Demand	Anodyne	SLC6A1	88	32
CON(C)C(=O)CCNC[C@@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321878	EE	On-Demand	Anodyne	DRD3	18	44
CON(C)C(=O)CCNC[C@@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321878	EE	On-Demand	Anodyne	OPRK1	23	41
CON(C)C(=O)CCNC[C@@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321878	EE	On-Demand	Anodyne	CHRM3	18	40
CON(C)C(=O)CCNC[C@@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321878	EE	On-Demand	Anodyne	SIGMAR1	50	46
CON(C)C(=O)CCNC[C@@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321878	EE	On-Demand	Anodyne	CCR3	24	42
CON(C)C(=O)CCNC[C@@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321878	EE	On-Demand	Anodyne	CCR5	26	42
CON(C)C(=O)CCNC[C@@H]1CCCCN(Cc2ccccc2)C1	ZINC000819321878	EE	On-Demand	Anodyne	BIRC2	15	40
CCc1nnc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000819321897	FE	On-Demand	Anodyne	GPR119	38	43
CCc1nnc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000819321898	FE	On-Demand	Anodyne	GPR119	38	43
COCC[C@@H](COC)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819321905	CD	On-Demand	Bother	CACNA1C	55	41
COCC[C@@H](COC)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819321905	CD	On-Demand	Bother	CACNA1D	83	41
COCC[C@@H](COC)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819321906	CD	On-Demand	Bother	CACNA1C	55	41
COCC[C@@H](COC)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819321906	CD	On-Demand	Bother	CACNA1D	83	41
COCC[C@H](COC)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819321907	CD	On-Demand	Bother	CACNA1C	55	41
COCC[C@H](COC)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819321907	CD	On-Demand	Bother	CACNA1D	83	41
COCC[C@H](COC)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819321908	CD	On-Demand	Bother	CACNA1C	55	41
COCC[C@H](COC)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819321908	CD	On-Demand	Bother	CACNA1D	83	41
CCc1nnc(CNC[C@@H](O)c2cccc(Cl)c2)s1	ZINC000819321915	CF	On-Demand	Anodyne	ADRB1	35	44
CCc1nnc(CNC[C@@H](O)c2cccc(Cl)c2)s1	ZINC000819321915	CF	On-Demand	Anodyne	ADRB3	50	44
CCc1nnc(CNC[C@H](O)c2cccc(Cl)c2)s1	ZINC000819321916	CF	On-Demand	Anodyne	ADRB1	35	44
CCc1nnc(CNC[C@H](O)c2cccc(Cl)c2)s1	ZINC000819321916	CF	On-Demand	Anodyne	ADRB3	50	44
CC[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819321921	CE	On-Demand	Anodyne	ADRB2	25	43
CC[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819321921	CE	On-Demand	Anodyne	ADRB1	41	46
CC[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819321921	CE	On-Demand	Anodyne	ADRB3	57	46
CC[C@@H](CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819321922	CE	On-Demand	Anodyne	ADRB2	25	43
CC[C@@H](CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819321922	CE	On-Demand	Anodyne	ADRB1	41	46
CC[C@@H](CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819321922	CE	On-Demand	Anodyne	ADRB3	57	46
COCC[C@H](COC)NC[C@@H](O)c1cccnc1	ZINC000819321934	CC	On-Demand	Anodyne	ADRB2	21	42
COCC[C@H](COC)NC[C@@H](O)c1cccnc1	ZINC000819321934	CC	On-Demand	Anodyne	ADRB1	21	45
COCC[C@H](COC)NC[C@@H](O)c1cccnc1	ZINC000819321934	CC	On-Demand	Anodyne	ADRB3	67	45
COCC[C@H](COC)NC[C@H](O)c1cccnc1	ZINC000819321935	CC	On-Demand	Anodyne	ADRB2	21	42
COCC[C@H](COC)NC[C@H](O)c1cccnc1	ZINC000819321935	CC	On-Demand	Anodyne	ADRB1	21	45
COCC[C@H](COC)NC[C@H](O)c1cccnc1	ZINC000819321935	CC	On-Demand	Anodyne	ADRB3	67	45
COCC[C@@H](COC)NC[C@@H](O)c1cccnc1	ZINC000819321936	CC	On-Demand	Anodyne	ADRB2	21	42
COCC[C@@H](COC)NC[C@@H](O)c1cccnc1	ZINC000819321936	CC	On-Demand	Anodyne	ADRB1	21	45
COCC[C@@H](COC)NC[C@@H](O)c1cccnc1	ZINC000819321936	CC	On-Demand	Anodyne	ADRB3	67	45
COCC[C@@H](COC)NC[C@H](O)c1cccnc1	ZINC000819321937	CC	On-Demand	Anodyne	ADRB2	21	42
COCC[C@@H](COC)NC[C@H](O)c1cccnc1	ZINC000819321937	CC	On-Demand	Anodyne	ADRB1	21	45
COCC[C@@H](COC)NC[C@H](O)c1cccnc1	ZINC000819321937	CC	On-Demand	Anodyne	ADRB3	67	45
O=[N+]([O-])c1ccc([C@@H](O)CN[C@H]2CCc3nc[nH]c3C2)cc1	ZINC000819321971	DD	On-Demand	Bother	ADRB3	17	41
O=[N+]([O-])c1ccc([C@H](O)CN[C@H]2CCc3nc[nH]c3C2)cc1	ZINC000819321972	DD	On-Demand	Bother	ADRB3	17	41
O[C@@H](CN[C@@H]1CCc2nc[nH]c2C1)c1ccc(F)c(Br)c1	ZINC000819321993	FE	On-Demand	Anodyne	ADRB3	19	42
O[C@@H](CN[C@H]1CCc2nc[nH]c2C1)c1ccc(F)c(Br)c1	ZINC000819321994	FE	On-Demand	Anodyne	ADRB3	19	42
O[C@H](CN[C@@H]1CCc2nc[nH]c2C1)c1ccc(F)c(Br)c1	ZINC000819321995	FE	On-Demand	Anodyne	ADRB3	19	42
O[C@H](CN[C@H]1CCc2nc[nH]c2C1)c1ccc(F)c(Br)c1	ZINC000819321996	FE	On-Demand	Anodyne	ADRB3	19	42
O[C@H](CNC[C@H]1CC[C@@H](c2ccccc2)O1)c1cccc(Cl)c1	ZINC000819322001	EH	On-Demand	Anodyne	ADRB1	29	41
O[C@H](CNC[C@H]1CC[C@@H](c2ccccc2)O1)c1cccc(Cl)c1	ZINC000819322001	EH	On-Demand	Anodyne	ADRB3	43	42
O[C@@H](CNC[C@H]1CC[C@@H](c2ccccc2)O1)c1cccc(Cl)c1	ZINC000819322002	EH	On-Demand	Anodyne	ADRB1	29	41
O[C@@H](CNC[C@H]1CC[C@@H](c2ccccc2)O1)c1cccc(Cl)c1	ZINC000819322002	EH	On-Demand	Anodyne	ADRB3	43	42
C#CCCCNC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819322036	EG	On-Demand	Mild	CNR1	53	33
Cn1nc(-c2ccncc2)cc1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819322054	CE	On-Demand	Anodyne	GPR142	20	40
Cn1nc(-c2ccncc2)cc1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819322057	CE	On-Demand	Anodyne	GPR142	20	40
Cn1nc(-c2ccncc2)cc1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819322059	CE	On-Demand	Anodyne	GPR142	20	40
Cn1nc(-c2ccncc2)cc1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819322062	CE	On-Demand	Anodyne	GPR142	20	40
C=Cc1ccc(CCNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819322080	FG	On-Demand	Anodyne	GPR119	45	46
C=Cc1ccc(CCNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819322083	FG	On-Demand	Anodyne	GPR119	45	46
CC(=O)c1cccc(OC[C@H](O)CNOC/C=C\Cl)c1	ZINC000819322098	CD	On-Demand	Anodyne	ADRB2	18	48
CC(=O)c1cccc(OC[C@H](O)CNOC/C=C\Cl)c1	ZINC000819322098	CD	On-Demand	Anodyne	ADRB1	23	40
CC(=O)c1cccc(OC[C@H](O)CNOC/C=C\Cl)c1	ZINC000819322098	CD	On-Demand	Anodyne	ABCB1	16	44
CC(=O)c1cccc(OC[C@@H](O)CNOC/C=C\Cl)c1	ZINC000819322100	CD	On-Demand	Anodyne	ADRB2	18	48
CC(=O)c1cccc(OC[C@@H](O)CNOC/C=C\Cl)c1	ZINC000819322100	CD	On-Demand	Anodyne	ADRB1	23	40
CC(=O)c1cccc(OC[C@@H](O)CNOC/C=C\Cl)c1	ZINC000819322100	CD	On-Demand	Anodyne	ABCB1	16	44
CC(=O)c1cccc(OC[C@H](O)CNOC/C=C/Cl)c1	ZINC000819322102	CD	On-Demand	Anodyne	ADRB2	18	48
CC(=O)c1cccc(OC[C@H](O)CNOC/C=C/Cl)c1	ZINC000819322102	CD	On-Demand	Anodyne	ADRB1	23	40
CC(=O)c1cccc(OC[C@H](O)CNOC/C=C/Cl)c1	ZINC000819322102	CD	On-Demand	Anodyne	ABCB1	16	44
CC(=O)c1cccc(OC[C@@H](O)CNOC/C=C/Cl)c1	ZINC000819322105	CD	On-Demand	Anodyne	ADRB2	18	48
CC(=O)c1cccc(OC[C@@H](O)CNOC/C=C/Cl)c1	ZINC000819322105	CD	On-Demand	Anodyne	ADRB1	23	40
CC(=O)c1cccc(OC[C@@H](O)CNOC/C=C/Cl)c1	ZINC000819322105	CD	On-Demand	Anodyne	ABCB1	16	44
O[C@@H](CNOC/C=C\Cl)COc1ccc(Cl)cc1	ZINC000819322141	CE	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNOC/C=C\Cl)COc1ccc(Cl)cc1	ZINC000819322141	CE	On-Demand	Anodyne	GRIN1	15	41
O[C@H](CNOC/C=C/Cl)COc1ccc(Cl)cc1	ZINC000819322143	CE	On-Demand	Anodyne	ADRB2	19	40
O[C@H](CNOC/C=C/Cl)COc1ccc(Cl)cc1	ZINC000819322143	CE	On-Demand	Anodyne	GRIN1	15	41
O[C@@H](CNOC/C=C/Cl)COc1ccc(Cl)cc1	ZINC000819322144	CE	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNOC/C=C/Cl)COc1ccc(Cl)cc1	ZINC000819322144	CE	On-Demand	Anodyne	GRIN1	15	41
O[C@H](CNOC/C=C\Cl)COc1ccc(Cl)cc1	ZINC000819322146	CE	On-Demand	Anodyne	ADRB2	19	40
O[C@H](CNOC/C=C\Cl)COc1ccc(Cl)cc1	ZINC000819322146	CE	On-Demand	Anodyne	GRIN1	15	41
COc1ccc(OC)c([C@H](O)CNCCc2ccc(Cl)c(C)c2)c1	ZINC000819322172	EH	On-Demand	Anodyne	ADRB2	50	54
COc1ccc(OC)c([C@H](O)CNCCc2ccc(Cl)c(C)c2)c1	ZINC000819322172	EH	On-Demand	Anodyne	ADRB1	53	46
COc1ccc(OC)c([C@H](O)CNCCc2ccc(Cl)c(C)c2)c1	ZINC000819322172	EH	On-Demand	Anodyne	ADRB3	46	46
O[C@H](CNCCCc1nccs1)c1ccc(OC(F)(F)F)cc1	ZINC000819322217	EG	On-Demand	Anodyne	ADRB3	23	41
O[C@@H](CNCCCc1nccs1)c1ccc(OC(F)(F)F)cc1	ZINC000819322218	EG	On-Demand	Anodyne	ADRB3	23	41
CCCN(CC)C[C@H](C)NC[C@@H](O)c1cccnc1	ZINC000819322240	CD	On-Demand	Anodyne	ADRB1	25	50
CCCN(CC)C[C@H](C)NC[C@@H](O)c1cccnc1	ZINC000819322240	CD	On-Demand	Anodyne	ADRB3	63	50
CCCN(CC)C[C@H](C)NC[C@@H](O)c1cccnc1	ZINC000819322240	CD	On-Demand	Anodyne	CYP51A1	21	50
CCCN(CC)C[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819322241	CD	On-Demand	Anodyne	ADRB1	25	50
CCCN(CC)C[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819322241	CD	On-Demand	Anodyne	ADRB3	63	50
CCCN(CC)C[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819322241	CD	On-Demand	Anodyne	CYP51A1	21	50
CCCN(CC)C[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819322242	CD	On-Demand	Anodyne	ADRB1	25	50
CCCN(CC)C[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819322242	CD	On-Demand	Anodyne	ADRB3	63	50
CCCN(CC)C[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819322242	CD	On-Demand	Anodyne	CYP51A1	21	50
CCCN(CC)C[C@H](C)NC[C@H](O)c1cccnc1	ZINC000819322243	CD	On-Demand	Anodyne	ADRB1	25	50
CCCN(CC)C[C@H](C)NC[C@H](O)c1cccnc1	ZINC000819322243	CD	On-Demand	Anodyne	ADRB3	63	50
CCCN(CC)C[C@H](C)NC[C@H](O)c1cccnc1	ZINC000819322243	CD	On-Demand	Anodyne	CYP51A1	21	50
C#CCCCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819322362	DE	On-Demand	Mild	PAPA1_CARPA	49	60
C#CCCCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819322362	DE	On-Demand	Mild	CTSK	18	56
C#CCCCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819322363	DE	On-Demand	Mild	PAPA1_CARPA	49	60
C#CCCCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819322363	DE	On-Demand	Mild	CTSK	18	56
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cc(C2CCOCC2)[nH]n1	ZINC000819322366	FE	On-Demand	Anodyne	PKNB	61	34
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](c1ccc2c(c1)OCCO2)c1ccccc1Cl	ZINC000819322377	GI	On-Demand	Anodyne	KCNQ2	22	45
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](c1ccc2c(c1)OCCO2)c1ccccc1Cl	ZINC000819322378	GI	On-Demand	Anodyne	KCNQ2	22	45
O=C(/C=C\[C@@H]1CCCO1)N[C@H](c1ccc2c(c1)OCCO2)c1ccccc1Cl	ZINC000819322379	GI	On-Demand	Anodyne	KCNQ2	22	45
O=C(/C=C/[C@@H]1CCCO1)N[C@H](c1ccc2c(c1)OCCO2)c1ccccc1Cl	ZINC000819322380	GI	On-Demand	Anodyne	KCNQ2	22	45
C[C@@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322404	FF	On-Demand	Anodyne	CA2	19	43
C[C@@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322404	FF	On-Demand	Anodyne	CA1	15	45
C[C@@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322404	FF	On-Demand	Anodyne	KLK3	62	36
C[C@@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322404	FF	On-Demand	Anodyne	CTSB	46	37
C[C@@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322404	FF	On-Demand	Anodyne	CAPNS1	63	35
C[C@@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322404	FF	On-Demand	Anodyne	FURIN	40	33
C[C@@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322404	FF	On-Demand	Anodyne	CAPN1	78	38
C[C@@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322404	FF	On-Demand	Anodyne	CAPN2	103	37
C[C@@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322404	FF	On-Demand	Anodyne	NPR	61	34
C[C@@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322404	FF	On-Demand	Anodyne	TMPRSS11D	62	36
C[C@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322406	FF	On-Demand	Anodyne	CA2	19	43
C[C@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322406	FF	On-Demand	Anodyne	CA1	15	45
C[C@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322406	FF	On-Demand	Anodyne	KLK3	62	36
C[C@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322406	FF	On-Demand	Anodyne	CTSB	46	37
C[C@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322406	FF	On-Demand	Anodyne	CAPNS1	63	35
C[C@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322406	FF	On-Demand	Anodyne	FURIN	40	33
C[C@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322406	FF	On-Demand	Anodyne	CAPN1	78	38
C[C@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322406	FF	On-Demand	Anodyne	CAPN2	103	37
C[C@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322406	FF	On-Demand	Anodyne	NPR	61	34
C[C@H](CNCc1ccc(C(=O)OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819322406	FF	On-Demand	Anodyne	TMPRSS11D	62	36
CN(Cc1nccn1Cc1ccccc1)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819322417	GF	On-Demand	Anodyne	FPR1	41	34
CCCN(CC)C[C@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819322440	CG	On-Demand	Anodyne	ADRB2	23	49
CCCN(CC)C[C@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819322440	CG	On-Demand	Anodyne	ADRB1	36	50
CCCN(CC)C[C@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819322440	CG	On-Demand	Anodyne	ADRB3	58	50
CCCN(CC)C[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819322441	CG	On-Demand	Anodyne	ADRB2	23	49
CCCN(CC)C[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819322441	CG	On-Demand	Anodyne	ADRB1	36	50
CCCN(CC)C[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819322441	CG	On-Demand	Anodyne	ADRB3	58	50
CCCN(CC)C[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819322443	CG	On-Demand	Anodyne	ADRB2	23	49
CCCN(CC)C[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819322443	CG	On-Demand	Anodyne	ADRB1	36	50
CCCN(CC)C[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819322443	CG	On-Demand	Anodyne	ADRB3	58	50
CCCN(CC)C[C@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819322444	CG	On-Demand	Anodyne	ADRB2	23	49
CCCN(CC)C[C@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819322444	CG	On-Demand	Anodyne	ADRB1	36	50
CCCN(CC)C[C@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819322444	CG	On-Demand	Anodyne	ADRB3	58	50
CSC1(CNC[C@H](O)c2cccnc2)CCN(C)CC1	ZINC000819322458	CD	On-Demand	Anodyne	ADRB3	80	42
CSC1(CNC[C@@H](O)c2cccnc2)CCN(C)CC1	ZINC000819322460	CD	On-Demand	Anodyne	ADRB3	80	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCc3nc[nH]c3C2)CC1	ZINC000819322476	FD	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCc3nc[nH]c3C2)CC1	ZINC000819322478	FD	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCc3nc[nH]c3C2)CC1	ZINC000819322480	FD	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCc3nc[nH]c3C2)CC1	ZINC000819322483	FD	On-Demand	Anodyne	GPR119	38	41
CC(=O)c1ccc(OC[C@H](O)CNOC/C=C/Cl)cc1	ZINC000819322526	CD	On-Demand	Anodyne	ADRB2	21	44
CC(=O)c1ccc(OC[C@H](O)CNOC/C=C/Cl)cc1	ZINC000819322526	CD	On-Demand	Anodyne	ADRB1	36	43
CC(=O)c1ccc(OC[C@@H](O)CNOC/C=C\Cl)cc1	ZINC000819322527	CD	On-Demand	Anodyne	ADRB2	21	44
CC(=O)c1ccc(OC[C@@H](O)CNOC/C=C\Cl)cc1	ZINC000819322527	CD	On-Demand	Anodyne	ADRB1	36	43
CC(=O)c1ccc(OC[C@@H](O)CNOC/C=C/Cl)cc1	ZINC000819322528	CD	On-Demand	Anodyne	ADRB2	21	44
CC(=O)c1ccc(OC[C@@H](O)CNOC/C=C/Cl)cc1	ZINC000819322528	CD	On-Demand	Anodyne	ADRB1	36	43
CC(=O)c1ccc(OC[C@H](O)CNOC/C=C\Cl)cc1	ZINC000819322529	CD	On-Demand	Anodyne	ADRB2	21	44
CC(=O)c1ccc(OC[C@H](O)CNOC/C=C\Cl)cc1	ZINC000819322529	CD	On-Demand	Anodyne	ADRB1	36	43
CO[C@@](C)(CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C1CC1	ZINC000819322530	FE	On-Demand	Anodyne	GPR119	27	41
CO[C@@](C)(CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C1CC1	ZINC000819322531	FE	On-Demand	Anodyne	GPR119	27	41
CN(C)S(=O)(=O)CCNC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819322545	ED	On-Demand	Anodyne	ADRB3	16	44
CN(C)S(=O)(=O)CCNC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819322546	ED	On-Demand	Anodyne	ADRB3	16	44
CCCn1cc(NC(=O)CCc2cccc(OC(F)F)c2)cn1	ZINC000819322560	DG	On-Demand	Anodyne	MTNR1B	15	41
O=C(OCc1ccccc1)c1ccc(CNC[C@H](O)CN2CCCC2=O)cc1	ZINC000819322565	GE	On-Demand	Anodyne	SLC12A5	52	35
O=C(OCc1ccccc1)c1ccc(CNC[C@@H](O)CN2CCCC2=O)cc1	ZINC000819322566	GE	On-Demand	Anodyne	SLC12A5	52	35
CS[C@@H]1CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819322567	FF	On-Demand	Mild	PAPA1_CARPA	38	49
CS[C@@H]1CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819322570	FF	On-Demand	Mild	PAPA1_CARPA	38	49
CCCn1cc(NC(=O)C[S@@](=O)c2cccc(OC)c2)cn1	ZINC000819322596	DE	On-Demand	Anodyne	PDGFRB	33	45
CCCn1cc(NC(=O)C[S@@](=O)c2cccc(OC)c2)cn1	ZINC000819322596	DE	On-Demand	Anodyne	MTNR1A	44	43
CCCn1cc(NC(=O)C[S@@](=O)c2cccc(OC)c2)cn1	ZINC000819322596	DE	On-Demand	Anodyne	MTNR1B	43	43
CCCn1cc(NC(=O)C[S@@](=O)c2cccc(OC)c2)cn1	ZINC000819322596	DE	On-Demand	Anodyne	FLT4	29	45
CCCn1cc(NC(=O)C[S@](=O)c2cccc(OC)c2)cn1	ZINC000819322597	DE	On-Demand	Anodyne	PDGFRB	33	45
CCCn1cc(NC(=O)C[S@](=O)c2cccc(OC)c2)cn1	ZINC000819322597	DE	On-Demand	Anodyne	MTNR1A	44	43
CCCn1cc(NC(=O)C[S@](=O)c2cccc(OC)c2)cn1	ZINC000819322597	DE	On-Demand	Anodyne	MTNR1B	43	43
CCCn1cc(NC(=O)C[S@](=O)c2cccc(OC)c2)cn1	ZINC000819322597	DE	On-Demand	Anodyne	FLT4	29	45
Cc1cc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc(N2CCCC2)n1	ZINC000819322607	GH	On-Demand	Anodyne	GALR2	38	42
Cc1cc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc(N2CCCC2)n1	ZINC000819322608	GH	On-Demand	Anodyne	GALR2	38	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cc(-c3ccncc3)nn1C)C2	ZINC000819322622	FE	On-Demand	Anodyne	GPR142	25	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cc(-c3ccncc3)nn1C)C2	ZINC000819322623	FE	On-Demand	Anodyne	GPR142	25	40
O[C@@H](CN[C@@H]1CCc2nc[nH]c2C1)c1ccc(F)cc1	ZINC000819322667	CD	On-Demand	Anodyne	ADRB3	18	42
O[C@H](CN[C@@H]1CCc2nc[nH]c2C1)c1ccc(F)cc1	ZINC000819322668	CD	On-Demand	Anodyne	ADRB3	18	42
O[C@H](CN[C@H]1CCc2nc[nH]c2C1)c1ccc(F)cc1	ZINC000819322669	CD	On-Demand	Anodyne	ADRB3	18	42
O[C@@H](CN[C@H]1CCc2nc[nH]c2C1)c1ccc(F)cc1	ZINC000819322670	CD	On-Demand	Anodyne	ADRB3	18	42
C[C@]1(CNC[C@H](O)c2cccc(Cl)c2)OCCc2sccc21	ZINC000819322694	EH	On-Demand	Anodyne	ADRB1	32	41
C[C@]1(CNC[C@H](O)c2cccc(Cl)c2)OCCc2sccc21	ZINC000819322694	EH	On-Demand	Anodyne	ADRB3	47	41
C[C@]1(CNC[C@@H](O)c2cccc(Cl)c2)OCCc2sccc21	ZINC000819322695	EH	On-Demand	Anodyne	ADRB1	32	41
C[C@]1(CNC[C@@H](O)c2cccc(Cl)c2)OCCc2sccc21	ZINC000819322695	EH	On-Demand	Anodyne	ADRB3	47	41
C[C@@]1(CNC[C@H](O)c2cccc(Cl)c2)OCCc2sccc21	ZINC000819322696	EH	On-Demand	Anodyne	ADRB1	32	41
C[C@@]1(CNC[C@H](O)c2cccc(Cl)c2)OCCc2sccc21	ZINC000819322696	EH	On-Demand	Anodyne	ADRB3	47	41
C[C@@]1(CNC[C@@H](O)c2cccc(Cl)c2)OCCc2sccc21	ZINC000819322697	EH	On-Demand	Anodyne	ADRB1	32	41
C[C@@]1(CNC[C@@H](O)c2cccc(Cl)c2)OCCc2sccc21	ZINC000819322697	EH	On-Demand	Anodyne	ADRB3	47	41
O[C@@H](CN[C@@H]1CCc2nc[nH]c2C1)c1cccc(F)c1	ZINC000819322707	CD	On-Demand	Anodyne	ADRB3	20	43
O[C@H](CN[C@@H]1CCc2nc[nH]c2C1)c1cccc(F)c1	ZINC000819322708	CD	On-Demand	Anodyne	ADRB3	20	43
O[C@H](CN[C@H]1CCc2nc[nH]c2C1)c1cccc(F)c1	ZINC000819322709	CD	On-Demand	Anodyne	ADRB3	20	43
O[C@@H](CN[C@H]1CCc2nc[nH]c2C1)c1cccc(F)c1	ZINC000819322710	CD	On-Demand	Anodyne	ADRB3	20	43
O[C@@H](CN[C@@H]1CCc2nc[nH]c2C1)c1ccc(Cl)cc1	ZINC000819322711	CE	On-Demand	Anodyne	ADRB3	21	50
O[C@@H](CN[C@H]1CCc2nc[nH]c2C1)c1ccc(Cl)cc1	ZINC000819322712	CE	On-Demand	Anodyne	ADRB3	21	50
C[C@H]1C[C@H](NCCS(C)(=O)=O)c2ccsc2S1(=O)=O	ZINC000819322729	DC	On-Demand	Anodyne	CA2	31	44
O[C@@H](CNOC/C=C\Cl)COc1ccccc1F	ZINC000819322759	CD	On-Demand	Anodyne	ADRB1	41	36
O[C@H](CNOC/C=C/Cl)COc1ccccc1F	ZINC000819322760	CD	On-Demand	Anodyne	ADRB1	41	36
O[C@H](CNOC/C=C\Cl)COc1ccccc1F	ZINC000819322761	CD	On-Demand	Anodyne	ADRB1	41	36
O[C@@H](CNOC/C=C/Cl)COc1ccccc1F	ZINC000819322762	CD	On-Demand	Anodyne	ADRB1	41	36
O[C@@H](CNOC/C=C/Cl)COc1ccc2ccccc2c1	ZINC000819322763	DF	On-Demand	Anodyne	ADRB2	22	56
O[C@H](CNOC/C=C\Cl)COc1ccc2ccccc2c1	ZINC000819322764	DF	On-Demand	Anodyne	ADRB2	22	56
O[C@@H](CNOC/C=C\Cl)COc1ccc2ccccc2c1	ZINC000819322765	DF	On-Demand	Anodyne	ADRB2	22	56
O[C@H](CNOC/C=C/Cl)COc1ccc2ccccc2c1	ZINC000819322766	DF	On-Demand	Anodyne	ADRB2	22	56
O=C(CCNOC/C=C\Cl)Nc1cccc(Br)c1	ZINC000819322767	EG	On-Demand	Anodyne	EGFR	31	41
O=C(CCNOC/C=C\Cl)Nc1cccc(Br)c1	ZINC000819322767	EG	On-Demand	Anodyne	HDAC2	15	42
O=C(CCNOC/C=C/Cl)Nc1cccc(Br)c1	ZINC000819322768	EG	On-Demand	Anodyne	EGFR	31	41
O=C(CCNOC/C=C/Cl)Nc1cccc(Br)c1	ZINC000819322768	EG	On-Demand	Anodyne	HDAC2	15	42
CN(C)S(=O)(=O)CCNC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819322815	FD	On-Demand	Anodyne	ADRB3	22	41
CN(C)S(=O)(=O)CCNC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819322816	FD	On-Demand	Anodyne	ADRB3	22	41
O[C@H](CNCCCc1nccs1)c1cccc(F)c1	ZINC000819322849	CF	On-Demand	Anodyne	ADRB1	34	41
O[C@H](CNCCCc1nccs1)c1cccc(F)c1	ZINC000819322849	CF	On-Demand	Anodyne	ADRB3	58	41
O[C@@H](CNCCCc1nccs1)c1cccc(F)c1	ZINC000819322850	CF	On-Demand	Anodyne	ADRB1	34	41
O[C@@H](CNCCCc1nccs1)c1cccc(F)c1	ZINC000819322850	CF	On-Demand	Anodyne	ADRB3	58	41
O=C(OCc1ccccc1)c1ccc(CNC[C@H](O)C2CC2)cc1	ZINC000819322897	EF	On-Demand	Anodyne	KLK3	52	34
O=C(OCc1ccccc1)c1ccc(CNC[C@H](O)C2CC2)cc1	ZINC000819322897	EF	On-Demand	Anodyne	PROC	49	35
O=C(OCc1ccccc1)c1ccc(CNC[C@H](O)C2CC2)cc1	ZINC000819322897	EF	On-Demand	Anodyne	TMPRSS11D	53	33
O=C(OCc1ccccc1)c1ccc(CNC[C@@H](O)C2CC2)cc1	ZINC000819322898	EF	On-Demand	Anodyne	KLK3	52	34
O=C(OCc1ccccc1)c1ccc(CNC[C@@H](O)C2CC2)cc1	ZINC000819322898	EF	On-Demand	Anodyne	PROC	49	35
O=C(OCc1ccccc1)c1ccc(CNC[C@@H](O)C2CC2)cc1	ZINC000819322898	EF	On-Demand	Anodyne	TMPRSS11D	53	33
CCc1cnc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819322942	FF	On-Demand	Mild	PAPA1_CARPA	44	49
CCc1cnc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819322943	FF	On-Demand	Mild	PAPA1_CARPA	44	49
O[C@@H](CN[C@@H]1CCc2nc[nH]c2C1)c1ccc(OC(F)(F)F)cc1	ZINC000819322973	EE	On-Demand	Anodyne	ADRB3	19	40
O[C@H](CN[C@@H]1CCc2nc[nH]c2C1)c1ccc(OC(F)(F)F)cc1	ZINC000819322974	EE	On-Demand	Anodyne	ADRB3	19	40
O[C@@H](CN[C@H]1CCc2nc[nH]c2C1)c1ccc(OC(F)(F)F)cc1	ZINC000819322975	EE	On-Demand	Anodyne	ADRB3	19	40
O[C@H](CN[C@H]1CCc2nc[nH]c2C1)c1ccc(OC(F)(F)F)cc1	ZINC000819322976	EE	On-Demand	Anodyne	ADRB3	19	40
C#CCCCNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819322977	CF	On-Demand	Mild	MTNR1A	15	45
C#CCCCNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819322977	CF	On-Demand	Mild	CRTM	51	42
O[C@@H](CN[C@@H]1CCc2nc[nH]c2C1)c1cccc(Br)c1	ZINC000819323006	EE	On-Demand	Anodyne	ADRB3	20	44
O[C@H](CN[C@@H]1CCc2nc[nH]c2C1)c1cccc(Br)c1	ZINC000819323007	EE	On-Demand	Anodyne	ADRB3	20	44
O[C@H](CN[C@H]1CCc2nc[nH]c2C1)c1cccc(Br)c1	ZINC000819323008	EE	On-Demand	Anodyne	ADRB3	20	44
O[C@@H](CN[C@H]1CCc2nc[nH]c2C1)c1cccc(Br)c1	ZINC000819323009	EE	On-Demand	Anodyne	ADRB3	20	44
Cc1ccc(OC[C@H](O)CNOC/C=C/Cl)cc1	ZINC000819323032	CE	On-Demand	Anodyne	ADRB2	25	55
Cc1ccc(OC[C@H](O)CNOC/C=C/Cl)cc1	ZINC000819323032	CE	On-Demand	Anodyne	ADRB1	27	40
Cc1ccc(OC[C@@H](O)CNOC/C=C\Cl)cc1	ZINC000819323033	CE	On-Demand	Anodyne	ADRB2	25	55
Cc1ccc(OC[C@@H](O)CNOC/C=C\Cl)cc1	ZINC000819323033	CE	On-Demand	Anodyne	ADRB1	27	40
Cc1ccc(OC[C@H](O)CNOC/C=C\Cl)cc1	ZINC000819323034	CE	On-Demand	Anodyne	ADRB2	25	55
Cc1ccc(OC[C@H](O)CNOC/C=C\Cl)cc1	ZINC000819323034	CE	On-Demand	Anodyne	ADRB1	27	40
Cc1ccc(OC[C@@H](O)CNOC/C=C/Cl)cc1	ZINC000819323035	CE	On-Demand	Anodyne	ADRB2	25	55
Cc1ccc(OC[C@@H](O)CNOC/C=C/Cl)cc1	ZINC000819323035	CE	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNOC/C=C/Cl)COc1cccc(C(F)(F)F)c1	ZINC000819323040	EF	On-Demand	Anodyne	PDS	47	41
O[C@H](CNOC/C=C\Cl)COc1cccc(C(F)(F)F)c1	ZINC000819323041	EF	On-Demand	Anodyne	PDS	47	41
O[C@@H](CNOC/C=C\Cl)COc1cccc(C(F)(F)F)c1	ZINC000819323042	EF	On-Demand	Anodyne	PDS	47	41
O[C@H](CNOC/C=C/Cl)COc1cccc(C(F)(F)F)c1	ZINC000819323043	EF	On-Demand	Anodyne	PDS	47	41
C=Cc1ccc(CCNC[C@H](O)CN(C)C(=O)OC(C)(C)C)cc1	ZINC000819323063	EF	On-Demand	Anodyne	ADRB3	38	40
C=Cc1ccc(CCNC[C@@H](O)CN(C)C(=O)OC(C)(C)C)cc1	ZINC000819323064	EF	On-Demand	Anodyne	ADRB3	38	40
CO[C@@](C)(CNC[C@@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819323099	CF	On-Demand	Anodyne	ADRB1	38	45
CO[C@@](C)(CNC[C@@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819323099	CF	On-Demand	Anodyne	ADRB3	52	45
CO[C@@](C)(CNC[C@@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819323099	CF	On-Demand	Anodyne	CYP3A4	48	37
CO[C@@](C)(CNC[C@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819323100	CF	On-Demand	Anodyne	ADRB1	38	45
CO[C@@](C)(CNC[C@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819323100	CF	On-Demand	Anodyne	ADRB3	52	45
CO[C@@](C)(CNC[C@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819323100	CF	On-Demand	Anodyne	CYP3A4	48	37
C=Cc1ccc(CCNC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1	ZINC000819323103	GF	On-Demand	Clean	ADRB2	28	53
C=Cc1ccc(CCNC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1	ZINC000819323103	GF	On-Demand	Clean	ADRB1	40	41
C=Cc1ccc(CCNC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1	ZINC000819323103	GF	On-Demand	Clean	ADRB3	36	47
C=Cc1ccc(CCNC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1	ZINC000819323103	GF	On-Demand	Clean	ABCB1	43	41
C=Cc1ccc(CCNC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1	ZINC000819323104	GF	On-Demand	Clean	ADRB2	28	53
C=Cc1ccc(CCNC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1	ZINC000819323104	GF	On-Demand	Clean	ADRB1	40	41
C=Cc1ccc(CCNC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1	ZINC000819323104	GF	On-Demand	Clean	ADRB3	36	47
C=Cc1ccc(CCNC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)cc1	ZINC000819323104	GF	On-Demand	Clean	ABCB1	43	41
C=Cc1ccc(CCNC[C@H](O)c2ccccc2C)cc1	ZINC000819323111	CH	On-Demand	Anodyne	ADRB2	60	45
C=Cc1ccc(CCNC[C@H](O)c2ccccc2C)cc1	ZINC000819323111	CH	On-Demand	Anodyne	ADRB1	63	40
C=Cc1ccc(CCNC[C@H](O)c2ccccc2C)cc1	ZINC000819323111	CH	On-Demand	Anodyne	ADRB3	75	41
C=Cc1ccc(CCNC[C@@H](O)c2ccccc2C)cc1	ZINC000819323112	CH	On-Demand	Anodyne	ADRB2	60	45
C=Cc1ccc(CCNC[C@@H](O)c2ccccc2C)cc1	ZINC000819323112	CH	On-Demand	Anodyne	ADRB1	63	40
C=Cc1ccc(CCNC[C@@H](O)c2ccccc2C)cc1	ZINC000819323112	CH	On-Demand	Anodyne	ADRB3	75	41
C[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@@H](C)S1	ZINC000819323142	FF	On-Demand	Mild	PAPA1_CARPA	37	44
C[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@@H](C)S1	ZINC000819323142	FF	On-Demand	Mild	CTSK	15	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cc(C#N)ccc1F	ZINC000819323145	EE	On-Demand	Mild	PAPA1_CARPA	27	41
COc1ccc(OC)c([C@H](O)CNCCCc2nccs2)c1	ZINC000819323159	DE	On-Demand	Anodyne	ADRB2	18	45
O=C(OCc1ccccc1)c1ccc(CNCC2(O)CCOCC2)cc1	ZINC000819323163	FF	On-Demand	Anodyne	SLC12A5	54	33
CC[C@@H]1CO[C@H](C)CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819323168	FF	On-Demand	Mild	PAPA1_CARPA	30	41
CC[C@@H]1CO[C@H](C)CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819323169	FF	On-Demand	Mild	PAPA1_CARPA	30	41
CC[C@@H]1CO[C@@H](C)CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819323170	FF	On-Demand	Mild	PAPA1_CARPA	30	41
CC[C@@H]1CO[C@@H](C)CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819323171	FF	On-Demand	Mild	PAPA1_CARPA	30	41
O=C(OCc1ccccc1)c1ccc(CNCC2(O)CCC2)cc1	ZINC000819323191	EG	On-Demand	Anodyne	SLC12A5	70	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1c(C)cccc1F)C2	ZINC000819323202	EF	On-Demand	Anodyne	P2RX7	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1c(C)cccc1F)C2	ZINC000819323203	EF	On-Demand	Anodyne	P2RX7	21	40
O[C@H](CNCCCc1nccs1)c1cccnc1	ZINC000819323240	CD	On-Demand	Anodyne	ADRB2	32	48
O[C@H](CNCCCc1nccs1)c1cccnc1	ZINC000819323240	CD	On-Demand	Anodyne	ADRB1	35	48
O[C@H](CNCCCc1nccs1)c1cccnc1	ZINC000819323240	CD	On-Demand	Anodyne	ADRB3	114	48
O[C@@H](CNCCCc1nccs1)c1cccnc1	ZINC000819323241	CD	On-Demand	Anodyne	ADRB2	32	48
O[C@@H](CNCCCc1nccs1)c1cccnc1	ZINC000819323241	CD	On-Demand	Anodyne	ADRB1	35	48
O[C@@H](CNCCCc1nccs1)c1cccnc1	ZINC000819323241	CD	On-Demand	Anodyne	ADRB3	114	48
Cn1nc(-c2ccncc2)cc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819323242	GG	On-Demand	Mild	PAPA1_CARPA	37	41
Cn1nc(-c2ccncc2)cc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819323242	GG	On-Demand	Mild	GPR142	31	51
Cn1nc(-c2ccncc2)cc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819323243	GG	On-Demand	Mild	PAPA1_CARPA	37	41
Cn1nc(-c2ccncc2)cc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819323243	GG	On-Demand	Mild	GPR142	31	51
CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2cc(F)ccc21	ZINC000819323256	GG	On-Demand	Mild	PAPA1_CARPA	35	43
CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2cc(F)ccc21	ZINC000819323257	GG	On-Demand	Mild	PAPA1_CARPA	35	43
O[C@@H](CN[C@@H]1CCc2nc[nH]c2C1)c1ccc(Cl)c(F)c1	ZINC000819323293	DE	On-Demand	Anodyne	ADRB3	20	44
O[C@@H](CN[C@H]1CCc2nc[nH]c2C1)c1ccc(Cl)c(F)c1	ZINC000819323294	DE	On-Demand	Anodyne	ADRB3	20	44
O[C@H](CN[C@@H]1CCc2nc[nH]c2C1)c1ccc(Cl)c(F)c1	ZINC000819323295	DE	On-Demand	Anodyne	ADRB3	20	44
O[C@H](CN[C@H]1CCc2nc[nH]c2C1)c1ccc(Cl)c(F)c1	ZINC000819323296	DE	On-Demand	Anodyne	ADRB3	20	44
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCc3nc[nH]c3C2)c1	ZINC000819323309	DD	On-Demand	Bother	ADRB3	19	43
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCc3nc[nH]c3C2)c1	ZINC000819323310	DD	On-Demand	Bother	ADRB3	19	43
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCc3nc[nH]c3C2)c1	ZINC000819323311	DD	On-Demand	Bother	ADRB3	19	43
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCc3nc[nH]c3C2)c1	ZINC000819323312	DD	On-Demand	Bother	ADRB3	19	43
CC[C@H](O)CN[C@@H]1CC(C)(C)Oc2ccc(NC(=O)OC(C)(C)C)cc21	ZINC000819323352	FH	On-Demand	Anodyne	CTSD	31	45
CC[C@H](O)CN[C@@H]1CC(C)(C)Oc2ccc(NC(=O)OC(C)(C)C)cc21	ZINC000819323352	FH	On-Demand	Anodyne	BACE1	17	47
CC[C@H](O)CN[C@H]1CC(C)(C)Oc2ccc(NC(=O)OC(C)(C)C)cc21	ZINC000819323353	FH	On-Demand	Anodyne	CTSD	31	45
CC[C@H](O)CN[C@H]1CC(C)(C)Oc2ccc(NC(=O)OC(C)(C)C)cc21	ZINC000819323353	FH	On-Demand	Anodyne	BACE1	17	47
CO[C@@H](C)[C@@H](C)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819323369	CF	On-Demand	Anodyne	ADRB2	18	45
CO[C@@H](C)[C@@H](C)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819323370	CF	On-Demand	Anodyne	ADRB2	18	45
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819323380	HJ	On-Demand	Anodyne	DRD4	15	45
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819323380	HJ	On-Demand	Anodyne	ACHE	18	41
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819323380	HJ	On-Demand	Anodyne	SLC6A3	18	43
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819323380	HJ	On-Demand	Anodyne	SIGMAR1	26	60
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819323381	HJ	On-Demand	Anodyne	DRD4	15	45
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819323381	HJ	On-Demand	Anodyne	ACHE	18	41
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819323381	HJ	On-Demand	Anodyne	SLC6A3	18	43
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819323381	HJ	On-Demand	Anodyne	SIGMAR1	26	60
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819323382	HJ	On-Demand	Anodyne	DRD4	15	45
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819323382	HJ	On-Demand	Anodyne	ACHE	18	41
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819323382	HJ	On-Demand	Anodyne	SLC6A3	18	43
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819323382	HJ	On-Demand	Anodyne	SIGMAR1	26	60
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819323383	HJ	On-Demand	Anodyne	DRD4	15	45
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819323383	HJ	On-Demand	Anodyne	ACHE	18	41
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819323383	HJ	On-Demand	Anodyne	SLC6A3	18	43
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819323383	HJ	On-Demand	Anodyne	SIGMAR1	26	60
O=C(CCNOC/C=C/Cl)Nc1ccccc1	ZINC000819323404	CE	On-Demand	Anodyne	HDAC10	22	47
O=C(CCNOC/C=C/Cl)Nc1ccccc1	ZINC000819323404	CE	On-Demand	Anodyne	HDAC2	19	47
O=C(CCNOC/C=C/Cl)Nc1ccccc1	ZINC000819323404	CE	On-Demand	Anodyne	HDAC3	19	47
O=C(CCNOC/C=C/Cl)Nc1ccccc1	ZINC000819323404	CE	On-Demand	Anodyne	HDAC6	18	47
O=C(CCNOC/C=C\Cl)Nc1ccccc1	ZINC000819323406	CE	On-Demand	Anodyne	HDAC10	22	47
O=C(CCNOC/C=C\Cl)Nc1ccccc1	ZINC000819323406	CE	On-Demand	Anodyne	HDAC2	19	47
O=C(CCNOC/C=C\Cl)Nc1ccccc1	ZINC000819323406	CE	On-Demand	Anodyne	HDAC3	19	47
O=C(CCNOC/C=C\Cl)Nc1ccccc1	ZINC000819323406	CE	On-Demand	Anodyne	HDAC6	18	47
CO[C@@](C)(CNC[C@H](O)c1cccnc1)C1CC1	ZINC000819323449	CD	On-Demand	Anodyne	ADRB2	20	40
CO[C@@](C)(CNC[C@H](O)c1cccnc1)C1CC1	ZINC000819323449	CD	On-Demand	Anodyne	ADRB1	22	41
CO[C@@](C)(CNC[C@H](O)c1cccnc1)C1CC1	ZINC000819323449	CD	On-Demand	Anodyne	ADRB3	86	43
CO[C@@](C)(CNC[C@@H](O)c1cccnc1)C1CC1	ZINC000819323451	CD	On-Demand	Anodyne	ADRB2	20	40
CO[C@@](C)(CNC[C@@H](O)c1cccnc1)C1CC1	ZINC000819323451	CD	On-Demand	Anodyne	ADRB1	22	41
CO[C@@](C)(CNC[C@@H](O)c1cccnc1)C1CC1	ZINC000819323451	CD	On-Demand	Anodyne	ADRB3	86	43
CC(=O)Nc1ccc(OC[C@H](O)CNOC/C=C/Cl)cc1	ZINC000819323455	DD	On-Demand	Anodyne	ADRB2	39	59
CC(=O)Nc1ccc(OC[C@H](O)CNOC/C=C/Cl)cc1	ZINC000819323455	DD	On-Demand	Anodyne	ADRB1	70	59
CC(=O)Nc1ccc(OC[C@H](O)CNOC/C=C/Cl)cc1	ZINC000819323455	DD	On-Demand	Anodyne	ADRB3	42	51
CC(=O)Nc1ccc(OC[C@@H](O)CNOC/C=C\Cl)cc1	ZINC000819323456	DD	On-Demand	Anodyne	ADRB2	39	59
CC(=O)Nc1ccc(OC[C@@H](O)CNOC/C=C\Cl)cc1	ZINC000819323456	DD	On-Demand	Anodyne	ADRB1	70	59
CC(=O)Nc1ccc(OC[C@@H](O)CNOC/C=C\Cl)cc1	ZINC000819323456	DD	On-Demand	Anodyne	ADRB3	42	51
CC(=O)Nc1ccc(OC[C@@H](O)CNOC/C=C/Cl)cc1	ZINC000819323457	DD	On-Demand	Anodyne	ADRB2	39	59
CC(=O)Nc1ccc(OC[C@@H](O)CNOC/C=C/Cl)cc1	ZINC000819323457	DD	On-Demand	Anodyne	ADRB1	70	59
CC(=O)Nc1ccc(OC[C@@H](O)CNOC/C=C/Cl)cc1	ZINC000819323457	DD	On-Demand	Anodyne	ADRB3	42	51
CC(=O)Nc1ccc(OC[C@H](O)CNOC/C=C\Cl)cc1	ZINC000819323459	DD	On-Demand	Anodyne	ADRB2	39	59
CC(=O)Nc1ccc(OC[C@H](O)CNOC/C=C\Cl)cc1	ZINC000819323459	DD	On-Demand	Anodyne	ADRB1	70	59
CC(=O)Nc1ccc(OC[C@H](O)CNOC/C=C\Cl)cc1	ZINC000819323459	DD	On-Demand	Anodyne	ADRB3	42	51
O=C(c1cc(-c2ccncc2)nc2ccc(Br)cc12)N1CCC[C@H](O)CC1	ZINC000819323487	II	On-Demand	Anodyne	PRS	75	52
O=C(c1cc(-c2ccncc2)nc2ccc(Br)cc12)N1CCC[C@@H](O)CC1	ZINC000819323491	II	On-Demand	Anodyne	PRS	75	52
CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1C(=O)N1CCC[C@@H](O)CC1	ZINC000819323492	FF	On-Demand	Anodyne	PREP	42	45
CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1C(=O)N1CCC[C@@H](O)CC1	ZINC000819323492	FF	On-Demand	Anodyne	WNT3	43	38
O=C(CCNOC/C=C\Cl)Nc1cccc(C(F)(F)F)c1	ZINC000819323493	DG	On-Demand	Anodyne	HDAC10	18	56
O=C(CCNOC/C=C\Cl)Nc1cccc(C(F)(F)F)c1	ZINC000819323493	DG	On-Demand	Anodyne	HDAC6	15	56
O=C(CCNOC/C=C\Cl)Nc1cccc(C(F)(F)F)c1	ZINC000819323493	DG	On-Demand	Anodyne	BTK	19	40
O=C(CCNOC/C=C\Cl)Nc1cccc(C(F)(F)F)c1	ZINC000819323493	DG	On-Demand	Anodyne	KCNK3	31	40
CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1C(=O)N1CCC[C@H](O)CC1	ZINC000819323495	FF	On-Demand	Anodyne	PREP	42	45
CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1C(=O)N1CCC[C@H](O)CC1	ZINC000819323495	FF	On-Demand	Anodyne	WNT3	43	38
O=C(CCNOC/C=C/Cl)Nc1cccc(C(F)(F)F)c1	ZINC000819323496	DG	On-Demand	Anodyne	HDAC10	18	56
O=C(CCNOC/C=C/Cl)Nc1cccc(C(F)(F)F)c1	ZINC000819323496	DG	On-Demand	Anodyne	HDAC6	15	56
O=C(CCNOC/C=C/Cl)Nc1cccc(C(F)(F)F)c1	ZINC000819323496	DG	On-Demand	Anodyne	BTK	19	40
O=C(CCNOC/C=C/Cl)Nc1cccc(C(F)(F)F)c1	ZINC000819323496	DG	On-Demand	Anodyne	KCNK3	31	40
CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1C(=O)N1CCC[C@@H](O)CC1	ZINC000819323497	FF	On-Demand	Anodyne	PREP	42	45
CC(C)(C)OC(=O)N1CCc2ccccc2[C@@H]1C(=O)N1CCC[C@@H](O)CC1	ZINC000819323497	FF	On-Demand	Anodyne	WNT3	43	38
CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1C(=O)N1CCC[C@H](O)CC1	ZINC000819323498	FF	On-Demand	Anodyne	PREP	42	45
CC(C)(C)OC(=O)N1CCc2ccccc2[C@H]1C(=O)N1CCC[C@H](O)CC1	ZINC000819323498	FF	On-Demand	Anodyne	WNT3	43	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	F2	51	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	PLG	40	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	PRSS1	24	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	ACE	68	51
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	GHRHR	64	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	P2RY12	211	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	CELA1	31	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	ELANE	32	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	TACR1	18	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	CMA1	27	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	CTRA_BOVIN	71	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	KLK3	83	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	CTSB	71	50
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	PAPA1_CARPA	70	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	TRY1_BOVIN	61	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	CYSP_TRYCR	58	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	CCKAR	16	46
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	CTSG	47	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	CTSK	64	53
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	CTSL	56	53
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	CACNA1B	34	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	CCR1	22	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	CYP51A1	24	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	PREP	62	48
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	AMY2	44	31
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	CAPNS1	75	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	CELA2A	58	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	HDAC2	19	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	REN	59	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	LGMN	53	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	MMP11	60	32
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	TGM1	24	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	CCKBR	23	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	CTSS	38	53
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	CAPN1	93	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	CASP1	28	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	CAPN2	138	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	PLAU	20	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	TGM2	44	55
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	DPP7	64	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	KLK5	40	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	TPSAB1	55	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	KLK1	25	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	NPR	71	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	BIRC2	20	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	SLC12A5	66	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323511	FD	On-Demand	Anodyne	Q9NAW4_PLAFA	38	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	F2	51	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	PLG	40	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	PRSS1	24	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	ACE	68	51
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	GHRHR	64	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	P2RY12	211	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	CELA1	31	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	ELANE	32	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	TACR1	18	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	CMA1	27	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	CTRA_BOVIN	71	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	KLK3	83	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	CTSB	71	50
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	PAPA1_CARPA	70	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	TRY1_BOVIN	61	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	CYSP_TRYCR	58	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	CCKAR	16	46
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	CTSG	47	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	CTSK	64	53
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	CTSL	56	53
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	CACNA1B	34	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	CCR1	22	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	CYP51A1	24	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	PREP	62	48
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	AMY2	44	31
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	CAPNS1	75	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	CELA2A	58	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	HDAC2	19	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	REN	59	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	LGMN	53	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	MMP11	60	32
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	TGM1	24	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	CCKBR	23	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	CTSS	38	53
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	CAPN1	93	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	CASP1	28	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	CAPN2	138	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	PLAU	20	45
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	TGM2	44	55
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	DPP7	64	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	KLK5	40	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	TPSAB1	55	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	KLK1	25	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	NPR	71	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	BIRC2	20	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	SLC12A5	66	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323512	FD	On-Demand	Anodyne	Q9NAW4_PLAFA	38	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	F2	51	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	PLG	40	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	PRSS1	24	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	ACE	68	51
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	GHRHR	64	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	P2RY12	211	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	CELA1	31	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	ELANE	32	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	TACR1	18	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	CMA1	27	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	CTRA_BOVIN	71	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	KLK3	83	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	CTSB	71	50
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	PAPA1_CARPA	70	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	TRY1_BOVIN	61	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	CYSP_TRYCR	58	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	CCKAR	16	46
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	CTSG	47	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	CTSK	64	53
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	CTSL	56	53
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	CACNA1B	34	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	CCR1	22	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	CYP51A1	24	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	PREP	62	48
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	AMY2	44	31
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	CAPNS1	75	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	CELA2A	58	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	HDAC2	19	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	REN	59	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	LGMN	53	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	MMP11	60	32
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	TGM1	24	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	CCKBR	23	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	CTSS	38	53
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	CAPN1	93	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	CASP1	28	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	CAPN2	138	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	PLAU	20	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	TGM2	44	55
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	DPP7	64	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	KLK5	40	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	TPSAB1	55	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	KLK1	25	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	NPR	71	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	BIRC2	20	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	SLC12A5	66	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@H](O)CC1	ZINC000819323513	FD	On-Demand	Anodyne	Q9NAW4_PLAFA	38	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	F2	51	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	PLG	40	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	PRSS1	24	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	ACE	68	51
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	GHRHR	64	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	P2RY12	211	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	CELA1	31	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	ELANE	32	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	TACR1	18	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	CMA1	27	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	CTRA_BOVIN	71	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	KLK3	83	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	CTSB	71	50
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	PAPA1_CARPA	70	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	TRY1_BOVIN	61	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	CYSP_TRYCR	58	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	CCKAR	16	46
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	CTSG	47	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	CTSK	64	53
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	CTSL	56	53
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	CACNA1B	34	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	CCR1	22	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	CYP51A1	24	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	PREP	62	48
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	AMY2	44	31
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	CAPNS1	75	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	CELA2A	58	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	HDAC2	19	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	REN	59	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	LGMN	53	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	MMP11	60	32
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	TGM1	24	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	CCKBR	23	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	CTSS	38	53
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	CAPN1	93	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	CASP1	28	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	CAPN2	138	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	PLAU	20	45
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	TGM2	44	55
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	DPP7	64	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	KLK5	40	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	TPSAB1	55	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	KLK1	25	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	NPR	71	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	BIRC2	20	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	SLC12A5	66	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCC[C@@H](O)CC1	ZINC000819323514	FD	On-Demand	Anodyne	Q9NAW4_PLAFA	38	41
CN(C)S(=O)(=O)CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819323523	DC	On-Demand	Anodyne	ADRB3	29	43
CN(C)S(=O)(=O)CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819323524	DC	On-Demand	Anodyne	ADRB3	29	43
O[C@@H](CNOC/C=C\Cl)COc1ccccc1	ZINC000819323532	CD	On-Demand	Anodyne	ADRB2	40	51
O[C@@H](CNOC/C=C\Cl)COc1ccccc1	ZINC000819323532	CD	On-Demand	Anodyne	ADRB1	48	42
O[C@@H](CNOC/C=C\Cl)COc1ccccc1	ZINC000819323532	CD	On-Demand	Anodyne	ADRB3	33	42
O[C@H](CNOC/C=C\Cl)COc1ccccc1	ZINC000819323536	CD	On-Demand	Anodyne	ADRB2	40	51
O[C@H](CNOC/C=C\Cl)COc1ccccc1	ZINC000819323536	CD	On-Demand	Anodyne	ADRB1	48	42
O[C@H](CNOC/C=C\Cl)COc1ccccc1	ZINC000819323536	CD	On-Demand	Anodyne	ADRB3	33	42
O[C@H](CNOC/C=C/Cl)COc1ccccc1	ZINC000819323539	CD	On-Demand	Anodyne	ADRB2	40	51
O[C@H](CNOC/C=C/Cl)COc1ccccc1	ZINC000819323539	CD	On-Demand	Anodyne	ADRB1	48	42
O[C@H](CNOC/C=C/Cl)COc1ccccc1	ZINC000819323539	CD	On-Demand	Anodyne	ADRB3	33	42
O[C@@H](CNOC/C=C/Cl)COc1ccccc1	ZINC000819323540	CD	On-Demand	Anodyne	ADRB2	40	51
O[C@@H](CNOC/C=C/Cl)COc1ccccc1	ZINC000819323540	CD	On-Demand	Anodyne	ADRB1	48	42
O[C@@H](CNOC/C=C/Cl)COc1ccccc1	ZINC000819323540	CD	On-Demand	Anodyne	ADRB3	33	42
CCCCCCCC[C@H](O)CCC(=O)N1CCC[C@@H](O)CC1	ZINC000819323549	DG	On-Demand	Mild	CQSS	41	32
CCCCCCCC[C@@H](O)CCC(=O)N1CCC[C@@H](O)CC1	ZINC000819323553	DG	On-Demand	Mild	CQSS	41	32
CCCCCCCC[C@H](O)CCC(=O)N1CCC[C@H](O)CC1	ZINC000819323555	DG	On-Demand	Mild	CQSS	41	32
CCCCCCCC[C@@H](O)CCC(=O)N1CCC[C@H](O)CC1	ZINC000819323558	DG	On-Demand	Mild	CQSS	41	32
O=C(c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1)N1CCC[C@H](O)CC1	ZINC000819323560	ID	On-Demand	Anodyne	TRY2_BOVIN	52	35
O=C(c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1)N1CCC[C@H](O)CC1	ZINC000819323560	ID	On-Demand	Anodyne	NOS2	84	36
O=C(c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1)N1CCC[C@H](O)CC1	ZINC000819323560	ID	On-Demand	Anodyne	ST14	87	35
O=C(c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1)N1CCC[C@H](O)CC1	ZINC000819323560	ID	On-Demand	Anodyne	SFRP1	71	37
O=C(c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1)N1CCC[C@H](O)CC1	ZINC000819323560	ID	On-Demand	Anodyne	WNT3	48	32
O=C(c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1)N1CCC[C@@H](O)CC1	ZINC000819323562	ID	On-Demand	Anodyne	TRY2_BOVIN	52	35
O=C(c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1)N1CCC[C@@H](O)CC1	ZINC000819323562	ID	On-Demand	Anodyne	NOS2	84	36
O=C(c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1)N1CCC[C@@H](O)CC1	ZINC000819323562	ID	On-Demand	Anodyne	ST14	87	35
O=C(c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1)N1CCC[C@@H](O)CC1	ZINC000819323562	ID	On-Demand	Anodyne	SFRP1	71	37
O=C(c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1)N1CCC[C@@H](O)CC1	ZINC000819323562	ID	On-Demand	Anodyne	WNT3	48	32
CCCCCCCCCCC(=O)N1CCC[C@H](O)CC1	ZINC000819323573	CH	On-Demand	Mild	PREP	18	42
CCCCCCCCCCC(=O)N1CCC[C@H](O)CC1	ZINC000819323573	CH	On-Demand	Mild	CQSS	53	33
CCCCCCCCCCC(=O)N1CCC[C@@H](O)CC1	ZINC000819323574	CH	On-Demand	Mild	PREP	18	42
CCCCCCCCCCC(=O)N1CCC[C@@H](O)CC1	ZINC000819323574	CH	On-Demand	Mild	CQSS	53	33
O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819323577	GG	On-Demand	Anodyne	ADRB2	18	44
O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819323580	GG	On-Demand	Anodyne	ADRB2	18	44
CCOCc1nc([C@H](C)NC[C@H](O)c2cccc(Cl)c2)no1	ZINC000819323596	EF	On-Demand	Anodyne	ADRB1	23	41
CCOCc1nc([C@H](C)NC[C@H](O)c2cccc(Cl)c2)no1	ZINC000819323596	EF	On-Demand	Anodyne	ADRB3	35	42
C[C@@H]1[C@@H](C(=O)N2CCC[C@H](O)CC2)CCCN1C(=O)OC(C)(C)C	ZINC000819323597	EE	On-Demand	Anodyne	PREP	17	57
C[C@@H]1[C@@H](C(=O)N2CCC[C@@H](O)CC2)CCCN1C(=O)OC(C)(C)C	ZINC000819323598	EE	On-Demand	Anodyne	PREP	17	57
CCOCc1nc([C@H](C)NC[C@@H](O)c2cccc(Cl)c2)no1	ZINC000819323599	EF	On-Demand	Anodyne	ADRB1	23	41
CCOCc1nc([C@H](C)NC[C@@H](O)c2cccc(Cl)c2)no1	ZINC000819323599	EF	On-Demand	Anodyne	ADRB3	35	42
COCCN1C(=O)c2ccc(C(=O)N3CCC[C@@H](O)CC3)cc2S1(=O)=O	ZINC000819323600	GC	On-Demand	Anodyne	L3MBTL3	62	34
CCOCc1nc([C@@H](C)NC[C@H](O)c2cccc(Cl)c2)no1	ZINC000819323601	EF	On-Demand	Anodyne	ADRB1	23	41
CCOCc1nc([C@@H](C)NC[C@H](O)c2cccc(Cl)c2)no1	ZINC000819323601	EF	On-Demand	Anodyne	ADRB3	35	42
COCCN1C(=O)c2ccc(C(=O)N3CCC[C@H](O)CC3)cc2S1(=O)=O	ZINC000819323602	GC	On-Demand	Anodyne	L3MBTL3	62	34
CCOCc1nc([C@@H](C)NC[C@@H](O)c2cccc(Cl)c2)no1	ZINC000819323604	EF	On-Demand	Anodyne	ADRB1	23	41
CCOCc1nc([C@@H](C)NC[C@@H](O)c2cccc(Cl)c2)no1	ZINC000819323604	EF	On-Demand	Anodyne	ADRB3	35	42
CC(C)(C)OC(=O)N1CCCc2cc(C(=O)N3CCC[C@H](O)CC3)ccc21	ZINC000819323606	FG	On-Demand	Anodyne	GPR119	28	44
CC(C)(C)OC(=O)N1CCCc2cc(C(=O)N3CCC[C@H](O)CC3)ccc21	ZINC000819323606	FG	On-Demand	Anodyne	L3MBTL3	70	36
O=[N+]([O-])c1ccc([C@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819323607	GH	On-Demand	Bother	DRD4	15	41
O=[N+]([O-])c1ccc([C@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819323607	GH	On-Demand	Bother	SIGMAR1	25	47
CC(C)(C)OC(=O)N1CCCc2cc(C(=O)N3CCC[C@@H](O)CC3)ccc21	ZINC000819323608	FG	On-Demand	Anodyne	GPR119	28	44
CC(C)(C)OC(=O)N1CCCc2cc(C(=O)N3CCC[C@@H](O)CC3)ccc21	ZINC000819323608	FG	On-Demand	Anodyne	L3MBTL3	70	36
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819323609	GH	On-Demand	Bother	DRD4	15	41
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819323609	GH	On-Demand	Bother	SIGMAR1	25	47
O=[N+]([O-])c1ccc([C@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819323612	GH	On-Demand	Bother	DRD4	15	41
O=[N+]([O-])c1ccc([C@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819323612	GH	On-Demand	Bother	SIGMAR1	25	47
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819323614	GH	On-Demand	Bother	DRD4	15	41
O=[N+]([O-])c1ccc([C@@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC000819323614	GH	On-Demand	Bother	SIGMAR1	25	47
O=C(c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)N1CCC[C@H](O)CC1	ZINC000819323622	GC	On-Demand	Anodyne	CNR2	18	55
O=C(c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)N1CCC[C@H](O)CC1	ZINC000819323622	GC	On-Demand	Anodyne	L3MBTL3	69	39
O=C(c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)N1CCC[C@@H](O)CC1	ZINC000819323623	GC	On-Demand	Anodyne	CNR2	18	55
O=C(c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)N1CCC[C@@H](O)CC1	ZINC000819323623	GC	On-Demand	Anodyne	L3MBTL3	69	39
O=C(Cc1cccs1)Nc1nc(CC(=O)N2CCC[C@@H](O)CC2)cs1	ZINC000819323624	GE	On-Demand	Anodyne	ETHR	35	46
O=C(Cc1cccs1)Nc1nc(CC(=O)N2CCC[C@H](O)CC2)cs1	ZINC000819323625	GE	On-Demand	Anodyne	ETHR	35	46
CO[C@@H](C)[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819323710	CE	On-Demand	Anodyne	ADRB2	29	53
CO[C@@H](C)[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819323710	CE	On-Demand	Anodyne	ADRB1	44	52
CO[C@@H](C)[C@@H](C)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819323710	CE	On-Demand	Anodyne	ADRB3	67	51
CO[C@@H](C)[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819323711	CE	On-Demand	Anodyne	ADRB2	29	53
CO[C@@H](C)[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819323711	CE	On-Demand	Anodyne	ADRB1	44	52
CO[C@@H](C)[C@@H](C)NC[C@H](O)c1cccc(Cl)c1	ZINC000819323711	CE	On-Demand	Anodyne	ADRB3	67	51
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819323713	GH	On-Demand	Bother	SIGMAR1	23	48
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819323714	GH	On-Demand	Bother	SIGMAR1	23	48
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819323715	GH	On-Demand	Bother	SIGMAR1	23	48
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2CCCCN(Cc3ccccc3)C2)c1	ZINC000819323716	GH	On-Demand	Bother	SIGMAR1	23	48
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCC[C@H](O)CC2)C[C@H]2C[C@H]21	ZINC000819323748	DD	On-Demand	Anodyne	PREP	25	68
CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCC[C@@H](O)CC2)C[C@H]2C[C@H]21	ZINC000819323749	DD	On-Demand	Anodyne	PREP	25	68
CC(C)(C)OC(=O)N1CCC(C(F)(F)C(=O)N2CCC[C@H](O)CC2)CC1	ZINC000819323751	GF	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CCC(C(F)(F)C(=O)N2CCC[C@@H](O)CC2)CC1	ZINC000819323752	GF	On-Demand	Anodyne	GPR119	29	41
CO[C@@H](C)[C@@H](C)NC[C@@H](O)c1cccc(F)c1	ZINC000819323754	BD	On-Demand	Anodyne	ADRB2	23	48
CO[C@@H](C)[C@@H](C)NC[C@H](O)c1cccc(F)c1	ZINC000819323755	BD	On-Demand	Anodyne	ADRB2	23	48
CC(C)(C)OC(=O)N1CCC(SCC(=O)N2CCC[C@H](O)CC2)CC1	ZINC000819323766	FE	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CCC(SCC(=O)N2CCC[C@@H](O)CC2)CC1	ZINC000819323767	FE	On-Demand	Anodyne	GPR119	32	42
CN(CCC(=O)N1CCC[C@@H](O)CC1)C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000819323768	HH	On-Demand	Anodyne	SSTR1	50	46
CN(CCC(=O)N1CCC[C@H](O)CC1)C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000819323769	HH	On-Demand	Anodyne	SSTR1	50	46
CCCCCCCCOCC(=O)N1CCC[C@H](O)CC1	ZINC000819323782	CF	On-Demand	Mild	UGCG	18	42
CCCCCCCCOCC(=O)N1CCC[C@H](O)CC1	ZINC000819323782	CF	On-Demand	Mild	GBA	18	42
CCCCCCCCOCC(=O)N1CCC[C@H](O)CC1	ZINC000819323782	CF	On-Demand	Mild	GBA2	41	42
CCCCCCCCOCC(=O)N1CCC[C@@H](O)CC1	ZINC000819323783	CF	On-Demand	Mild	UGCG	18	42
CCCCCCCCOCC(=O)N1CCC[C@@H](O)CC1	ZINC000819323783	CF	On-Demand	Mild	GBA	18	42
CCCCCCCCOCC(=O)N1CCC[C@@H](O)CC1	ZINC000819323783	CF	On-Demand	Mild	GBA2	41	42
CC(C)(C)OC(=O)N1CCC[C@@H]1CCC(=O)N1CCC[C@H](O)CC1	ZINC000819323784	EF	On-Demand	Anodyne	PREP	18	48
CC(C)(C)OC(=O)N1CCC[C@H]1CCC(=O)N1CCC[C@H](O)CC1	ZINC000819323785	EF	On-Demand	Anodyne	PREP	18	48
CC(C)(C)OC(=O)N1CCC[C@@H]1CCC(=O)N1CCC[C@@H](O)CC1	ZINC000819323786	EF	On-Demand	Anodyne	PREP	18	48
CC(C)(C)OC(=O)N1CCC[C@H]1CCC(=O)N1CCC[C@@H](O)CC1	ZINC000819323787	EF	On-Demand	Anodyne	PREP	18	48
Cc1ccc2nc(-c3cccnc3)cc(C(=O)N3CCC[C@H](O)CC3)c2c1	ZINC000819323790	FH	On-Demand	Anodyne	PRS	40	33
Cc1ccc2nc(-c3cccnc3)cc(C(=O)N3CCC[C@@H](O)CC3)c2c1	ZINC000819323791	FH	On-Demand	Anodyne	PRS	40	33
O=C(c1cccnc1S)N1CCC[C@@H](O)CC1	ZINC000819323792	CD	On-Demand	Anodyne	L3MBTL3	67	43
O=C(c1cccnc1S)N1CCC[C@H](O)CC1	ZINC000819323793	CD	On-Demand	Anodyne	L3MBTL3	67	43
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1CCC[C@H](O)CC1	ZINC000819323796	FC	On-Demand	Anodyne	PREP	28	54
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1CCC[C@@H](O)CC1	ZINC000819323797	FC	On-Demand	Anodyne	PREP	28	54
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1CCC[C@H](O)CC1	ZINC000819323798	FC	On-Demand	Anodyne	PREP	28	54
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1CCC[C@@H](O)CC1	ZINC000819323799	FC	On-Demand	Anodyne	PREP	28	54
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819323800	CD	On-Demand	Anodyne	F2	28	41
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819323800	CD	On-Demand	Anodyne	ACE	74	40
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819323800	CD	On-Demand	Anodyne	MME	53	44
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819323800	CD	On-Demand	Anodyne	CYP51A1	26	51
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819323800	CD	On-Demand	Anodyne	DPP4	18	43
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819323800	CD	On-Demand	Anodyne	PREP	60	44
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819323800	CD	On-Demand	Anodyne	DPP7	53	39
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819323800	CD	On-Demand	Anodyne	AMP1_PLAFQ	16	46
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819323800	CD	On-Demand	Anodyne	DPP8	15	43
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819323801	CD	On-Demand	Anodyne	F2	28	41
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819323801	CD	On-Demand	Anodyne	ACE	74	40
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819323801	CD	On-Demand	Anodyne	MME	53	44
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819323801	CD	On-Demand	Anodyne	CYP51A1	26	51
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819323801	CD	On-Demand	Anodyne	DPP4	18	43
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819323801	CD	On-Demand	Anodyne	PREP	60	44
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819323801	CD	On-Demand	Anodyne	DPP7	53	39
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819323801	CD	On-Demand	Anodyne	AMP1_PLAFQ	16	46
O=C([C@@H](F)Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819323801	CD	On-Demand	Anodyne	DPP8	15	43
O=C([C@H](F)Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819323802	CD	On-Demand	Anodyne	F2	28	41
O=C([C@H](F)Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819323802	CD	On-Demand	Anodyne	ACE	74	40
O=C([C@H](F)Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819323802	CD	On-Demand	Anodyne	MME	53	44
O=C([C@H](F)Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819323802	CD	On-Demand	Anodyne	CYP51A1	26	51
O=C([C@H](F)Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819323802	CD	On-Demand	Anodyne	DPP4	18	43
O=C([C@H](F)Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819323802	CD	On-Demand	Anodyne	PREP	60	44
O=C([C@H](F)Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819323802	CD	On-Demand	Anodyne	DPP7	53	39
O=C([C@H](F)Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819323802	CD	On-Demand	Anodyne	AMP1_PLAFQ	16	46
O=C([C@H](F)Cc1ccccc1)N1CCC[C@H](O)CC1	ZINC000819323802	CD	On-Demand	Anodyne	DPP8	15	43
O=C([C@H](F)Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819323803	CD	On-Demand	Anodyne	F2	28	41
O=C([C@H](F)Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819323803	CD	On-Demand	Anodyne	ACE	74	40
O=C([C@H](F)Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819323803	CD	On-Demand	Anodyne	MME	53	44
O=C([C@H](F)Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819323803	CD	On-Demand	Anodyne	CYP51A1	26	51
O=C([C@H](F)Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819323803	CD	On-Demand	Anodyne	DPP4	18	43
O=C([C@H](F)Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819323803	CD	On-Demand	Anodyne	PREP	60	44
O=C([C@H](F)Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819323803	CD	On-Demand	Anodyne	DPP7	53	39
O=C([C@H](F)Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819323803	CD	On-Demand	Anodyne	AMP1_PLAFQ	16	46
O=C([C@H](F)Cc1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819323803	CD	On-Demand	Anodyne	DPP8	15	43
Cc1nc(CCC(=O)N2CCC[C@@H](O)CC2)cs1	ZINC000819323804	CD	On-Demand	Anodyne	ETHR	41	32
Cc1nc(CCC(=O)N2CCC[C@H](O)CC2)cs1	ZINC000819323805	CD	On-Demand	Anodyne	ETHR	41	32
CC(C)(C)OC(=O)NCCCn1ccc2cc(C(=O)N3CCC[C@H](O)CC3)ccc21	ZINC000819323810	HH	On-Demand	Anodyne	L3MBTL3	42	39
CC(C)(C)OC(=O)NCCCn1ccc2cc(C(=O)N3CCC[C@@H](O)CC3)ccc21	ZINC000819323811	HH	On-Demand	Anodyne	L3MBTL3	42	39
O=C(NCCCC(=O)N1CCC[C@H](O)CC1)OCc1ccccc1	ZINC000819323812	EE	On-Demand	Anodyne	F2	23	43
O=C(NCCCC(=O)N1CCC[C@H](O)CC1)OCc1ccccc1	ZINC000819323812	EE	On-Demand	Anodyne	ACE	27	49
O=C(NCCCC(=O)N1CCC[C@H](O)CC1)OCc1ccccc1	ZINC000819323812	EE	On-Demand	Anodyne	FKBP1A	33	40
O=C(NCCCC(=O)N1CCC[C@H](O)CC1)OCc1ccccc1	ZINC000819323812	EE	On-Demand	Anodyne	GRIN2B	25	40
O=C(NCCCC(=O)N1CCC[C@H](O)CC1)OCc1ccccc1	ZINC000819323812	EE	On-Demand	Anodyne	ELANE	21	41
O=C(NCCCC(=O)N1CCC[C@H](O)CC1)OCc1ccccc1	ZINC000819323812	EE	On-Demand	Anodyne	CTSB	31	41
O=C(NCCCC(=O)N1CCC[C@H](O)CC1)OCc1ccccc1	ZINC000819323812	EE	On-Demand	Anodyne	CTSK	28	41
O=C(NCCCC(=O)N1CCC[C@H](O)CC1)OCc1ccccc1	ZINC000819323812	EE	On-Demand	Anodyne	CTSL	35	41
O=C(NCCCC(=O)N1CCC[C@H](O)CC1)OCc1ccccc1	ZINC000819323812	EE	On-Demand	Anodyne	C3AR1	41	37
O=C(NCCCC(=O)N1CCC[C@H](O)CC1)OCc1ccccc1	ZINC000819323812	EE	On-Demand	Anodyne	PREP	95	60
O=C(NCCCC(=O)N1CCC[C@H](O)CC1)OCc1ccccc1	ZINC000819323812	EE	On-Demand	Anodyne	CTSS	17	40
O=C(NCCCC(=O)N1CCC[C@H](O)CC1)OCc1ccccc1	ZINC000819323812	EE	On-Demand	Anodyne	CAPN2	71	39
O=C(NCCCC(=O)N1CCC[C@H](O)CC1)OCc1ccccc1	ZINC000819323812	EE	On-Demand	Anodyne	TGM2	43	47
O=C(NCCCC(=O)N1CCC[C@H](O)CC1)OCc1ccccc1	ZINC000819323812	EE	On-Demand	Anodyne	NPR	57	36
O=C(NCCCC(=O)N1CCC[C@H](O)CC1)OCc1ccccc1	ZINC000819323812	EE	On-Demand	Anodyne	CACNA1G	20	41
O=C(NCCCC(=O)N1CCC[C@H](O)CC1)OCc1ccccc1	ZINC000819323812	EE	On-Demand	Anodyne	SLC12A5	67	39
O=C(NCCCC(=O)N1CCC[C@H](O)CC1)OCc1ccccc1	ZINC000819323812	EE	On-Demand	Anodyne	TMPRSS11D	31	41
O=C(NCCCC(=O)N1CCC[C@@H](O)CC1)OCc1ccccc1	ZINC000819323813	EE	On-Demand	Anodyne	F2	23	43
O=C(NCCCC(=O)N1CCC[C@@H](O)CC1)OCc1ccccc1	ZINC000819323813	EE	On-Demand	Anodyne	ACE	27	49
O=C(NCCCC(=O)N1CCC[C@@H](O)CC1)OCc1ccccc1	ZINC000819323813	EE	On-Demand	Anodyne	FKBP1A	33	40
O=C(NCCCC(=O)N1CCC[C@@H](O)CC1)OCc1ccccc1	ZINC000819323813	EE	On-Demand	Anodyne	GRIN2B	25	40
O=C(NCCCC(=O)N1CCC[C@@H](O)CC1)OCc1ccccc1	ZINC000819323813	EE	On-Demand	Anodyne	ELANE	21	41
O=C(NCCCC(=O)N1CCC[C@@H](O)CC1)OCc1ccccc1	ZINC000819323813	EE	On-Demand	Anodyne	CTSB	31	41
O=C(NCCCC(=O)N1CCC[C@@H](O)CC1)OCc1ccccc1	ZINC000819323813	EE	On-Demand	Anodyne	CTSK	28	41
O=C(NCCCC(=O)N1CCC[C@@H](O)CC1)OCc1ccccc1	ZINC000819323813	EE	On-Demand	Anodyne	CTSL	35	41
O=C(NCCCC(=O)N1CCC[C@@H](O)CC1)OCc1ccccc1	ZINC000819323813	EE	On-Demand	Anodyne	C3AR1	41	37
O=C(NCCCC(=O)N1CCC[C@@H](O)CC1)OCc1ccccc1	ZINC000819323813	EE	On-Demand	Anodyne	PREP	95	60
O=C(NCCCC(=O)N1CCC[C@@H](O)CC1)OCc1ccccc1	ZINC000819323813	EE	On-Demand	Anodyne	CTSS	17	40
O=C(NCCCC(=O)N1CCC[C@@H](O)CC1)OCc1ccccc1	ZINC000819323813	EE	On-Demand	Anodyne	CAPN2	71	39
O=C(NCCCC(=O)N1CCC[C@@H](O)CC1)OCc1ccccc1	ZINC000819323813	EE	On-Demand	Anodyne	TGM2	43	47
O=C(NCCCC(=O)N1CCC[C@@H](O)CC1)OCc1ccccc1	ZINC000819323813	EE	On-Demand	Anodyne	NPR	57	36
O=C(NCCCC(=O)N1CCC[C@@H](O)CC1)OCc1ccccc1	ZINC000819323813	EE	On-Demand	Anodyne	CACNA1G	20	41
O=C(NCCCC(=O)N1CCC[C@@H](O)CC1)OCc1ccccc1	ZINC000819323813	EE	On-Demand	Anodyne	SLC12A5	67	39
O=C(NCCCC(=O)N1CCC[C@@H](O)CC1)OCc1ccccc1	ZINC000819323813	EE	On-Demand	Anodyne	TMPRSS11D	31	41
O=C(NCC1(CC(=O)N2CCC[C@H](O)CC2)CCCCC1)OCc1ccccc1	ZINC000819323814	HH	On-Demand	Anodyne	CTSK	23	42
O=C(NCC1(CC(=O)N2CCC[C@H](O)CC2)CCCCC1)OCc1ccccc1	ZINC000819323814	HH	On-Demand	Anodyne	PREP	49	48
O=C(NCC1(CC(=O)N2CCC[C@H](O)CC2)CCCCC1)OCc1ccccc1	ZINC000819323814	HH	On-Demand	Anodyne	TGM2	32	40
O=C(NCC1(CC(=O)N2CCC[C@H](O)CC2)CCCCC1)OCc1ccccc1	ZINC000819323814	HH	On-Demand	Anodyne	NPR	42	31
O=C(NCC1(CC(=O)N2CCC[C@H](O)CC2)CCCCC1)OCc1ccccc1	ZINC000819323814	HH	On-Demand	Anodyne	SLC12A5	71	41
O=C(NCC1(CC(=O)N2CCC[C@@H](O)CC2)CCCCC1)OCc1ccccc1	ZINC000819323815	HH	On-Demand	Anodyne	CTSK	23	42
O=C(NCC1(CC(=O)N2CCC[C@@H](O)CC2)CCCCC1)OCc1ccccc1	ZINC000819323815	HH	On-Demand	Anodyne	PREP	49	48
O=C(NCC1(CC(=O)N2CCC[C@@H](O)CC2)CCCCC1)OCc1ccccc1	ZINC000819323815	HH	On-Demand	Anodyne	TGM2	32	40
O=C(NCC1(CC(=O)N2CCC[C@@H](O)CC2)CCCCC1)OCc1ccccc1	ZINC000819323815	HH	On-Demand	Anodyne	NPR	42	31
O=C(NCC1(CC(=O)N2CCC[C@@H](O)CC2)CCCCC1)OCc1ccccc1	ZINC000819323815	HH	On-Demand	Anodyne	SLC12A5	71	41
O=C(c1ccccc1NS(=O)(=O)C(F)(F)F)N1CCC[C@H](O)CC1	ZINC000819323825	FD	On-Demand	Anodyne	RBP4	45	37
O=C(c1ccccc1NS(=O)(=O)C(F)(F)F)N1CCC[C@H](O)CC1	ZINC000819323825	FD	On-Demand	Anodyne	SFRP1	92	39
O=C(c1ccccc1NS(=O)(=O)C(F)(F)F)N1CCC[C@H](O)CC1	ZINC000819323825	FD	On-Demand	Anodyne	WNT3	71	33
O=C(c1ccccc1NS(=O)(=O)C(F)(F)F)N1CCC[C@H](O)CC1	ZINC000819323825	FD	On-Demand	Anodyne	L3MBTL3	50	41
O=C(c1ccccc1NS(=O)(=O)C(F)(F)F)N1CCC[C@@H](O)CC1	ZINC000819323827	FD	On-Demand	Anodyne	RBP4	45	37
O=C(c1ccccc1NS(=O)(=O)C(F)(F)F)N1CCC[C@@H](O)CC1	ZINC000819323827	FD	On-Demand	Anodyne	SFRP1	92	39
O=C(c1ccccc1NS(=O)(=O)C(F)(F)F)N1CCC[C@@H](O)CC1	ZINC000819323827	FD	On-Demand	Anodyne	WNT3	71	33
O=C(c1ccccc1NS(=O)(=O)C(F)(F)F)N1CCC[C@@H](O)CC1	ZINC000819323827	FD	On-Demand	Anodyne	L3MBTL3	50	41
CCOC[C@H](O)CN[C@@H]1CC(C)(C)Oc2ccc(NC(=O)OC(C)(C)C)cc21	ZINC000819323914	GH	On-Demand	Anodyne	CTSD	16	41
CCOC[C@H](O)CN[C@H]1CC(C)(C)Oc2ccc(NC(=O)OC(C)(C)C)cc21	ZINC000819323916	GH	On-Demand	Anodyne	CTSD	16	41
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)C1CC1	ZINC000819323923	DF	On-Demand	Anodyne	DRD4	25	45
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)C1CC1	ZINC000819323923	DF	On-Demand	Anodyne	SIGMAR1	45	49
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)C1CC1	ZINC000819323923	DF	On-Demand	Anodyne	BIRC2	18	43
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)C1CC1	ZINC000819323924	DF	On-Demand	Anodyne	DRD4	25	45
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)C1CC1	ZINC000819323924	DF	On-Demand	Anodyne	SIGMAR1	45	49
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)C1CC1	ZINC000819323924	DF	On-Demand	Anodyne	BIRC2	18	43
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)C1CC1	ZINC000819323925	DF	On-Demand	Anodyne	DRD4	25	45
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)C1CC1	ZINC000819323925	DF	On-Demand	Anodyne	SIGMAR1	45	49
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)C1CC1	ZINC000819323925	DF	On-Demand	Anodyne	BIRC2	18	43
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)C1CC1	ZINC000819323926	DF	On-Demand	Anodyne	DRD4	25	45
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)C1CC1	ZINC000819323926	DF	On-Demand	Anodyne	SIGMAR1	45	49
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)C1CC1	ZINC000819323926	DF	On-Demand	Anodyne	BIRC2	18	43
O=C(c1cc(Cl)cs1)N1CCC[C@@H](O)CC1	ZINC000819323990	CE	On-Demand	Anodyne	L3MBTL3	42	38
O=C(c1cc(Cl)cs1)N1CCC[C@H](O)CC1	ZINC000819323999	CE	On-Demand	Anodyne	L3MBTL3	42	38
O=C(c1cc(S(=O)(=O)N2CCC2)ccc1Cl)N1CCC[C@@H](O)CC1	ZINC000819324001	FD	On-Demand	Anodyne	L3MBTL3	55	44
O=C(c1cc(S(=O)(=O)N2CCC2)ccc1Cl)N1CCC[C@H](O)CC1	ZINC000819324002	FD	On-Demand	Anodyne	L3MBTL3	55	44
Cc1ccc(C(=O)N2CCC[C@@H](O)CC2)nc1	ZINC000819324003	BD	On-Demand	Anodyne	L3MBTL3	53	49
Cc1ccc(C(=O)N2CCC[C@H](O)CC2)nc1	ZINC000819324007	BD	On-Demand	Anodyne	L3MBTL3	53	49
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324008	HJ	On-Demand	Anodyne	DRD4	15	40
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324008	HJ	On-Demand	Anodyne	ACHE	18	43
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324008	HJ	On-Demand	Anodyne	SLC6A3	17	43
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324008	HJ	On-Demand	Anodyne	SIGMAR1	20	47
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324008	HJ	On-Demand	Anodyne	CCR3	15	40
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324008	HJ	On-Demand	Anodyne	CCR2	39	43
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)N3CCC[C@H](O)CC3)cc2C1	ZINC000819324009	FF	On-Demand	Anodyne	GPR119	32	44
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)N3CCC[C@H](O)CC3)cc2C1	ZINC000819324009	FF	On-Demand	Anodyne	L3MBTL3	82	39
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324010	HJ	On-Demand	Anodyne	DRD4	15	40
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324010	HJ	On-Demand	Anodyne	ACHE	18	43
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324010	HJ	On-Demand	Anodyne	SLC6A3	17	43
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324010	HJ	On-Demand	Anodyne	SIGMAR1	20	47
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324010	HJ	On-Demand	Anodyne	CCR3	15	40
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324010	HJ	On-Demand	Anodyne	CCR2	39	43
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)N3CCC[C@@H](O)CC3)cc2C1	ZINC000819324011	FF	On-Demand	Anodyne	GPR119	32	44
CC(C)(C)OC(=O)N1Cc2ccc(C(=O)N3CCC[C@@H](O)CC3)cc2C1	ZINC000819324011	FF	On-Demand	Anodyne	L3MBTL3	82	39
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324012	HJ	On-Demand	Anodyne	DRD4	15	40
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324012	HJ	On-Demand	Anodyne	ACHE	18	43
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324012	HJ	On-Demand	Anodyne	SLC6A3	17	43
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324012	HJ	On-Demand	Anodyne	SIGMAR1	20	47
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324012	HJ	On-Demand	Anodyne	CCR3	15	40
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324012	HJ	On-Demand	Anodyne	CCR2	39	43
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCc3ccccc32)c1)N1CCC[C@H](O)CC1	ZINC000819324023	IG	On-Demand	Anodyne	L3MBTL3	58	34
O=C(c1ccc(Cl)c(S(=O)(=O)N2CCc3ccccc32)c1)N1CCC[C@@H](O)CC1	ZINC000819324024	IG	On-Demand	Anodyne	L3MBTL3	58	34
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	ACE	30	47
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	SSTR2	93	49
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	OPRM1	17	48
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	GHRHR	41	53
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	CELA1	17	41
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	MME	31	47
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	EDNRB	37	42
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	EDNRA	44	53
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	TACR1	43	59
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	MC4R	87	44
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	CCKAR	157	68
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	NTSR1	39	40
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	CTSL	25	58
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	PGA	19	48
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	BRS3	26	42
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	CYP51A1	27	44
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	NMBR	55	45
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	MC3R	80	36
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	MC5R	75	40
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	MMP2	27	53
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	MMP8	35	53
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	GRPR	75	32
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	ECE1	68	49
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	REN	66	48
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	REN1	28	48
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	SSTR3	27	51
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	MMP11	92	36
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	CCKBR	124	66
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	GHSR	70	54
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	MMP9	26	53
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	MC1R	96	36
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	C5AR1	38	40
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	FPR1	51	54
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	NPR	27	40
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	CALCRL	21	51
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	KISS1R	71	34
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	ERAP2	40	35
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324039	HF	On-Demand	Anodyne	Q9N6S8_PLAFA	16	47
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	ACE	30	47
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	SSTR2	93	49
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	OPRM1	17	48
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	GHRHR	41	53
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	CELA1	17	41
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	MME	31	47
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	EDNRB	37	42
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	EDNRA	44	53
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	TACR1	43	59
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	MC4R	87	44
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	CCKAR	157	68
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	NTSR1	39	40
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	CTSL	25	58
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	PGA	19	48
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	BRS3	26	42
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	CYP51A1	27	44
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	NMBR	55	45
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	MC3R	80	36
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	MC5R	75	40
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	MMP2	27	53
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	MMP8	35	53
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	GRPR	75	32
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	ECE1	68	49
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	REN	66	48
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	REN1	28	48
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	SSTR3	27	51
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	MMP11	92	36
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	CCKBR	124	66
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	GHSR	70	54
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	MMP9	26	53
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	MC1R	96	36
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	C5AR1	38	40
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	FPR1	51	54
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	NPR	27	40
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	CALCRL	21	51
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	KISS1R	71	34
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	ERAP2	40	35
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CCC[C@H](O)CC1	ZINC000819324040	HF	On-Demand	Anodyne	Q9N6S8_PLAFA	16	47
O=C(c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O)N1CCC[C@@H](O)CC1	ZINC000819324041	FC	On-Demand	Anodyne	L3MBTL3	84	41
O=C(c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O)N1CCC[C@H](O)CC1	ZINC000819324042	FC	On-Demand	Anodyne	L3MBTL3	84	41
O=C(c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl)N1CCC[C@@H](O)CC1	ZINC000819324049	HE	On-Demand	Anodyne	CCR8	71	34
O=C(c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl)N1CCC[C@@H](O)CC1	ZINC000819324049	HE	On-Demand	Anodyne	SFRP1	122	46
O=C(c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl)N1CCC[C@@H](O)CC1	ZINC000819324049	HE	On-Demand	Anodyne	WNT3	82	36
O=C(c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl)N1CCC[C@H](O)CC1	ZINC000819324050	HE	On-Demand	Anodyne	CCR8	71	34
O=C(c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl)N1CCC[C@H](O)CC1	ZINC000819324050	HE	On-Demand	Anodyne	SFRP1	122	46
O=C(c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl)N1CCC[C@H](O)CC1	ZINC000819324050	HE	On-Demand	Anodyne	WNT3	82	36
O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCC[C@H](O)CC1	ZINC000819324057	EF	On-Demand	Bother	SLC6A9	24	58
O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCC[C@H](O)CC1	ZINC000819324057	EF	On-Demand	Bother	L3MBTL3	51	41
O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCC[C@@H](O)CC1	ZINC000819324058	EF	On-Demand	Bother	SLC6A9	24	58
O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCC[C@@H](O)CC1	ZINC000819324058	EF	On-Demand	Bother	L3MBTL3	51	41
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CCC[C@H](O)CC1	ZINC000819324059	IF	On-Demand	Anodyne	CELA1	21	52
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CCC[C@H](O)CC1	ZINC000819324059	IF	On-Demand	Anodyne	PREP	110	67
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CCC[C@H](O)CC1	ZINC000819324059	IF	On-Demand	Anodyne	LGMN	86	53
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CCC[C@H](O)CC1	ZINC000819324059	IF	On-Demand	Anodyne	KLK5	23	42
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CCC[C@@H](O)CC1	ZINC000819324060	IF	On-Demand	Anodyne	CELA1	21	52
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CCC[C@@H](O)CC1	ZINC000819324060	IF	On-Demand	Anodyne	PREP	110	67
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CCC[C@@H](O)CC1	ZINC000819324060	IF	On-Demand	Anodyne	LGMN	86	53
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CCC[C@@H](O)CC1	ZINC000819324060	IF	On-Demand	Anodyne	KLK5	23	42
O=C(CCc1cncc2ccccc12)N1CCC[C@H](O)CC1	ZINC000819324063	CF	On-Demand	Anodyne	PREP	47	42
O=C(CCc1cncc2ccccc12)N1CCC[C@@H](O)CC1	ZINC000819324064	CF	On-Demand	Anodyne	PREP	47	42
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324066	HJ	On-Demand	Anodyne	DRD4	15	40
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324066	HJ	On-Demand	Anodyne	ACHE	18	43
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324066	HJ	On-Demand	Anodyne	SLC6A3	17	43
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324066	HJ	On-Demand	Anodyne	SIGMAR1	20	47
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324066	HJ	On-Demand	Anodyne	CCR3	15	40
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819324066	HJ	On-Demand	Anodyne	CCR2	39	43
CO[C@@H](C)[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819324068	CD	On-Demand	Bother	ADRB2	20	43
CO[C@@H](C)[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819324068	CD	On-Demand	Bother	CACNA1C	53	39
CO[C@@H](C)[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819324068	CD	On-Demand	Bother	ADRB3	46	35
CO[C@@H](C)[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819324068	CD	On-Demand	Bother	CACNA1D	84	39
CO[C@@H](C)[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819324070	CD	On-Demand	Bother	ADRB2	20	43
CO[C@@H](C)[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819324070	CD	On-Demand	Bother	CACNA1C	53	39
CO[C@@H](C)[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819324070	CD	On-Demand	Bother	ADRB3	46	35
CO[C@@H](C)[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819324070	CD	On-Demand	Bother	CACNA1D	84	39
CO[C@@H](C)[C@@H](C)NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819324075	CE	On-Demand	Anodyne	ADRB2	15	42
CO[C@@H](C)[C@@H](C)NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819324076	CE	On-Demand	Anodyne	ADRB2	15	42
CC[C@H](C)c1ccc(C(=O)N2CCC[C@H](O)CC2)cc1	ZINC000819324107	CG	On-Demand	Anodyne	SCN2A	20	42
CC[C@H](C)c1ccc(C(=O)N2CCC[C@H](O)CC2)cc1	ZINC000819324107	CG	On-Demand	Anodyne	L3MBTL3	98	47
CC[C@@H](C)c1ccc(C(=O)N2CCC[C@H](O)CC2)cc1	ZINC000819324122	CG	On-Demand	Anodyne	SCN2A	20	42
CC[C@@H](C)c1ccc(C(=O)N2CCC[C@H](O)CC2)cc1	ZINC000819324122	CG	On-Demand	Anodyne	L3MBTL3	98	47
CC[C@@H](C)c1ccc(C(=O)N2CCC[C@@H](O)CC2)cc1	ZINC000819324123	CG	On-Demand	Anodyne	SCN2A	20	42
CC[C@@H](C)c1ccc(C(=O)N2CCC[C@@H](O)CC2)cc1	ZINC000819324123	CG	On-Demand	Anodyne	L3MBTL3	98	47
CC[C@H](C)c1ccc(C(=O)N2CCC[C@@H](O)CC2)cc1	ZINC000819324124	CG	On-Demand	Anodyne	SCN2A	20	42
CC[C@H](C)c1ccc(C(=O)N2CCC[C@@H](O)CC2)cc1	ZINC000819324124	CG	On-Demand	Anodyne	L3MBTL3	98	47
O=C(c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1)N1CCC[C@H](O)CC1	ZINC000819324125	GE	On-Demand	Anodyne	L3MBTL3	63	38
O=C(c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1)N1CCC[C@H](O)CC1	ZINC000819324125	GE	On-Demand	Anodyne	HPGD	49	43
O=C(c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1)N1CCC[C@@H](O)CC1	ZINC000819324126	GE	On-Demand	Anodyne	L3MBTL3	63	38
O=C(c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1)N1CCC[C@@H](O)CC1	ZINC000819324126	GE	On-Demand	Anodyne	HPGD	49	43
O=C(c1cc(=O)c2ccc(F)cc2o1)N1CCC[C@@H](O)CC1	ZINC000819324129	DD	On-Demand	Anodyne	KCNH2	15	48
O=C(c1cc(=O)c2ccc(F)cc2o1)N1CCC[C@H](O)CC1	ZINC000819324130	DD	On-Demand	Anodyne	KCNH2	15	48
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@@H](O)CC1	ZINC000819324135	DC	On-Demand	Anodyne	PREP	49	49
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@@H](O)CC1	ZINC000819324135	DC	On-Demand	Anodyne	WNT3	46	37
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@H](O)CC1	ZINC000819324136	DC	On-Demand	Anodyne	PREP	49	49
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@H](O)CC1	ZINC000819324136	DC	On-Demand	Anodyne	WNT3	46	37
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@H](O)CC1	ZINC000819324137	DC	On-Demand	Anodyne	PREP	49	49
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@H](O)CC1	ZINC000819324137	DC	On-Demand	Anodyne	WNT3	46	37
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@@H](O)CC1	ZINC000819324138	DC	On-Demand	Anodyne	PREP	49	49
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1CCC[C@@H](O)CC1	ZINC000819324138	DC	On-Demand	Anodyne	WNT3	46	37
O=C(c1cc(O)c2ccsc2c1)N1CCC[C@@H](O)CC1	ZINC000819324139	CF	On-Demand	Anodyne	L3MBTL3	82	39
O=C(c1cc(O)c2ccsc2c1)N1CCC[C@H](O)CC1	ZINC000819324140	CF	On-Demand	Anodyne	L3MBTL3	82	39
CN(CCCC(=O)N1CCC[C@H](O)CC1)C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000819324141	II	On-Demand	Anodyne	SSTR1	46	44
CN(CCCC(=O)N1CCC[C@@H](O)CC1)C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000819324142	II	On-Demand	Anodyne	SSTR1	46	44
CO[C@@H](C)[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819324220	BD	On-Demand	Anodyne	ADRB2	27	42
CO[C@@H](C)[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819324220	BD	On-Demand	Anodyne	ADRB1	28	50
CO[C@@H](C)[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819324220	BD	On-Demand	Anodyne	ADRB3	81	50
CO[C@@H](C)[C@@H](C)NC[C@@H](O)c1cccnc1	ZINC000819324220	BD	On-Demand	Anodyne	KCNA5	21	40
CO[C@@H](C)[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819324221	BD	On-Demand	Anodyne	ADRB2	27	42
CO[C@@H](C)[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819324221	BD	On-Demand	Anodyne	ADRB1	28	50
CO[C@@H](C)[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819324221	BD	On-Demand	Anodyne	ADRB3	81	50
CO[C@@H](C)[C@@H](C)NC[C@H](O)c1cccnc1	ZINC000819324221	BD	On-Demand	Anodyne	KCNA5	21	40
CCc1nnc(CNC[C@H](O)c2cccnc2)s1	ZINC000819324256	CD	On-Demand	Anodyne	ADRB2	22	47
CCc1nnc(CNC[C@H](O)c2cccnc2)s1	ZINC000819324256	CD	On-Demand	Anodyne	ADRB1	25	52
CCc1nnc(CNC[C@H](O)c2cccnc2)s1	ZINC000819324256	CD	On-Demand	Anodyne	ADRB3	94	52
CCc1nnc(CNC[C@@H](O)c2cccnc2)s1	ZINC000819324257	CD	On-Demand	Anodyne	ADRB2	22	47
CCc1nnc(CNC[C@@H](O)c2cccnc2)s1	ZINC000819324257	CD	On-Demand	Anodyne	ADRB1	25	52
CCc1nnc(CNC[C@@H](O)c2cccnc2)s1	ZINC000819324257	CD	On-Demand	Anodyne	ADRB3	94	52
CC(=O)CCCCCCC(=O)N1CCC[C@H](O)CC1	ZINC000819324285	CE	On-Demand	Anodyne	PAOX	41	41
CC(=O)CCCCCCC(=O)N1CCC[C@H](O)CC1	ZINC000819324285	CE	On-Demand	Anodyne	PREP	23	43
CC(=O)CCCCCCC(=O)N1CCC[C@@H](O)CC1	ZINC000819324288	CE	On-Demand	Anodyne	PAOX	41	41
CC(=O)CCCCCCC(=O)N1CCC[C@@H](O)CC1	ZINC000819324288	CE	On-Demand	Anodyne	PREP	23	43
O=C(c1ccc2c(=O)n(CCc3ccccc3)c(S)nc2c1)N1CCC[C@@H](O)CC1	ZINC000819324304	HF	On-Demand	Anodyne	L3MBTL3	40	37
O=C(c1ccc2c(=O)n(CCc3ccccc3)c(S)nc2c1)N1CCC[C@@H](O)CC1	ZINC000819324304	HF	On-Demand	Anodyne	HPGD	40	35
O=C(c1ccc2c(=O)n(CCc3ccccc3)c(S)nc2c1)N1CCC[C@H](O)CC1	ZINC000819324307	HF	On-Demand	Anodyne	L3MBTL3	40	37
O=C(c1ccc2c(=O)n(CCc3ccccc3)c(S)nc2c1)N1CCC[C@H](O)CC1	ZINC000819324307	HF	On-Demand	Anodyne	HPGD	40	35
O=C(c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O)N1CCC[C@@H](O)CC1	ZINC000819324308	HC	On-Demand	Anodyne	L3MBTL3	42	33
O=C(c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O)N1CCC[C@H](O)CC1	ZINC000819324310	HC	On-Demand	Anodyne	L3MBTL3	42	33
O=C(c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O)N1CCC[C@@H](O)CC1	ZINC000819324315	HC	On-Demand	Anodyne	L3MBTL3	42	33
COCC[C@H](COC)NC[C@H](O)c1cccc2ccccc12	ZINC000819324317	DF	On-Demand	Anodyne	ADRB2	15	46
O=C(c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O)N1CCC[C@H](O)CC1	ZINC000819324318	HC	On-Demand	Anodyne	L3MBTL3	42	33
COCC[C@@H](COC)NC[C@H](O)c1cccc2ccccc12	ZINC000819324319	DF	On-Demand	Anodyne	ADRB2	15	46
O=C(c1cc(-c2ccccc2Cl)nc2ccccc12)N1CCC[C@H](O)CC1	ZINC000819324341	GJ	On-Demand	Anodyne	SMO	20	40
O=C(c1cc(-c2ccccc2Cl)nc2ccccc12)N1CCC[C@H](O)CC1	ZINC000819324341	GJ	On-Demand	Anodyne	L3MBTL3	42	40
O=C(c1cc(-c2ccccc2Cl)nc2ccccc12)N1CCC[C@@H](O)CC1	ZINC000819324342	GJ	On-Demand	Anodyne	SMO	20	40
O=C(c1cc(-c2ccccc2Cl)nc2ccccc12)N1CCC[C@@H](O)CC1	ZINC000819324342	GJ	On-Demand	Anodyne	L3MBTL3	42	40
CC(C)(C)NS(=O)(=O)c1ccc(Br)c(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819324345	IF	On-Demand	Anodyne	SFRP1	91	36
CC(C)(C)NS(=O)(=O)c1ccc(Br)c(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819324345	IF	On-Demand	Anodyne	WNT3	67	35
CC(C)(C)NS(=O)(=O)c1ccc(Br)c(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819324346	IF	On-Demand	Anodyne	SFRP1	91	36
CC(C)(C)NS(=O)(=O)c1ccc(Br)c(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819324346	IF	On-Demand	Anodyne	WNT3	67	35
O=C(c1cc(-c2ccccc2)nn1-c1ccccc1)N1CCC[C@H](O)CC1	ZINC000819324357	FH	On-Demand	Anodyne	P2RY12	48	38
O=C(c1cc(-c2ccccc2)nn1-c1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819324358	FH	On-Demand	Anodyne	P2RY12	48	38
CS(=O)(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819324373	DD	On-Demand	Anodyne	PREP	29	43
CS(=O)(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819324373	DD	On-Demand	Anodyne	ST14	41	33
CS(=O)(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819324373	DD	On-Demand	Anodyne	L3MBTL3	89	45
CS(=O)(=O)Nc1cccc(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819324373	DD	On-Demand	Anodyne	HPGD	40	32
CS(=O)(=O)Nc1cccc(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819324374	DD	On-Demand	Anodyne	PREP	29	43
CS(=O)(=O)Nc1cccc(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819324374	DD	On-Demand	Anodyne	ST14	41	33
CS(=O)(=O)Nc1cccc(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819324374	DD	On-Demand	Anodyne	L3MBTL3	89	45
CS(=O)(=O)Nc1cccc(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819324374	DD	On-Demand	Anodyne	HPGD	40	32
O=C(c1ccc2c(c1)-c1ccccc1C2)N1CCC[C@H](O)CC1	ZINC000819324387	DG	On-Demand	Anodyne	PREP	48	40
O=C(c1ccc2c(c1)-c1ccccc1C2)N1CCC[C@H](O)CC1	ZINC000819324387	DG	On-Demand	Anodyne	L3MBTL3	100	47
O=C(c1ccc2c(c1)-c1ccccc1C2)N1CCC[C@H](O)CC1	ZINC000819324387	DG	On-Demand	Anodyne	HPGD	42	36
O=C(c1ccc2c(c1)-c1ccccc1C2)N1CCC[C@@H](O)CC1	ZINC000819324388	DG	On-Demand	Anodyne	PREP	48	40
O=C(c1ccc2c(c1)-c1ccccc1C2)N1CCC[C@@H](O)CC1	ZINC000819324388	DG	On-Demand	Anodyne	L3MBTL3	100	47
O=C(c1ccc2c(c1)-c1ccccc1C2)N1CCC[C@@H](O)CC1	ZINC000819324388	DG	On-Demand	Anodyne	HPGD	42	36
O=C(c1csc(-c2ccccn2)n1)N1CCC[C@@H](O)CC1	ZINC000819324391	DE	On-Demand	Anodyne	TRPC6	50	37
O=C(c1csc(-c2ccccn2)n1)N1CCC[C@@H](O)CC1	ZINC000819324391	DE	On-Demand	Anodyne	TRPC3	44	37
O=C(c1csc(-c2ccccn2)n1)N1CCC[C@H](O)CC1	ZINC000819324392	DE	On-Demand	Anodyne	TRPC6	50	37
O=C(c1csc(-c2ccccn2)n1)N1CCC[C@H](O)CC1	ZINC000819324392	DE	On-Demand	Anodyne	TRPC3	44	37
O=C(c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1)N1CCC[C@@H](O)CC1	ZINC000819324399	II	On-Demand	Bother	GRIN2B	57	47
O=C(c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1)N1CCC[C@@H](O)CC1	ZINC000819324399	II	On-Demand	Bother	SLC6A9	17	46
O=C(c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1)N1CCC[C@H](O)CC1	ZINC000819324400	II	On-Demand	Bother	GRIN2B	57	47
O=C(c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1)N1CCC[C@H](O)CC1	ZINC000819324400	II	On-Demand	Bother	SLC6A9	17	46
O=C(c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@H](O)CC1	ZINC000819324401	GD	On-Demand	Anodyne	CNR2	17	53
O=C(c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@H](O)CC1	ZINC000819324401	GD	On-Demand	Anodyne	EPHX2	19	40
O=C(c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@H](O)CC1	ZINC000819324401	GD	On-Demand	Anodyne	L3MBTL3	92	44
O=C(c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@@H](O)CC1	ZINC000819324402	GD	On-Demand	Anodyne	CNR2	17	53
O=C(c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@@H](O)CC1	ZINC000819324402	GD	On-Demand	Anodyne	EPHX2	19	40
O=C(c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)N1CCC[C@@H](O)CC1	ZINC000819324402	GD	On-Demand	Anodyne	L3MBTL3	92	44
O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC[C@H](O)c2ccccc2F)c1	ZINC000819324411	GG	On-Demand	Anodyne	ADRB2	19	40
O=C1NC2(CCCC2)C(=O)N1c1cccc(CNC[C@@H](O)c2ccccc2F)c1	ZINC000819324412	GG	On-Demand	Anodyne	ADRB2	19	40
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819324429	FG	On-Demand	Anodyne	DRD4	15	41
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819324429	FG	On-Demand	Anodyne	SIGMAR1	25	49
O[C@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819324429	FG	On-Demand	Anodyne	CCR3	26	41
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819324430	FG	On-Demand	Anodyne	DRD4	15	41
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819324430	FG	On-Demand	Anodyne	SIGMAR1	25	49
O[C@@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819324430	FG	On-Demand	Anodyne	CCR3	26	41
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819324431	FG	On-Demand	Anodyne	DRD4	15	41
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819324431	FG	On-Demand	Anodyne	SIGMAR1	25	49
O[C@@H](CNC[C@@H]1CCCCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819324431	FG	On-Demand	Anodyne	CCR3	26	41
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819324432	FG	On-Demand	Anodyne	DRD4	15	41
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819324432	FG	On-Demand	Anodyne	SIGMAR1	25	49
O[C@H](CNC[C@H]1CCCCN(Cc2ccccc2)C1)c1ccc(F)cn1	ZINC000819324432	FG	On-Demand	Anodyne	CCR3	26	41
Cn1ncc2ccc(CNC[C@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)cc21	ZINC000819324482	GF	On-Demand	Anodyne	GPR119	50	45
Cn1ncc2ccc(CNC[C@@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)cc21	ZINC000819324483	GF	On-Demand	Anodyne	GPR119	50	45
CCCN(CC)C[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819324509	CE	On-Demand	Anodyne	ADRB1	15	45
CCCN(CC)C[C@@H](C)NC[C@@H](O)c1ccccc1	ZINC000819324509	CE	On-Demand	Anodyne	AOC3	18	41
CCCN(CC)C[C@H](C)NC[C@@H](O)c1ccccc1	ZINC000819324510	CE	On-Demand	Anodyne	ADRB1	15	45
CCCN(CC)C[C@H](C)NC[C@@H](O)c1ccccc1	ZINC000819324510	CE	On-Demand	Anodyne	AOC3	18	41
CCCN(CC)C[C@H](C)NC[C@H](O)c1ccccc1	ZINC000819324511	CE	On-Demand	Anodyne	ADRB1	15	45
CCCN(CC)C[C@H](C)NC[C@H](O)c1ccccc1	ZINC000819324511	CE	On-Demand	Anodyne	AOC3	18	41
CCCN(CC)C[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819324512	CE	On-Demand	Anodyne	ADRB1	15	45
CCCN(CC)C[C@@H](C)NC[C@H](O)c1ccccc1	ZINC000819324512	CE	On-Demand	Anodyne	AOC3	18	41
O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCC[C@H](O)CC1	ZINC000819324513	IE	On-Demand	Clean	HSD17B1	17	43
O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCC[C@H](O)CC1	ZINC000819324513	IE	On-Demand	Clean	SFRP1	41	33
O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCC[C@@H](O)CC1	ZINC000819324514	IE	On-Demand	Clean	HSD17B1	17	43
O=C(c1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)ccc1O)N1CCC[C@@H](O)CC1	ZINC000819324514	IE	On-Demand	Clean	SFRP1	41	33
O[C@@H](CNOC/C=C/Cl)c1cccc(Cl)c1	ZINC000819324520	CF	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNOC/C=C/Cl)c1cccc(Cl)c1	ZINC000819324520	CF	On-Demand	Anodyne	ADRB3	42	40
O[C@H](CNOC/C=C\Cl)c1cccc(Cl)c1	ZINC000819324521	CF	On-Demand	Anodyne	ADRB1	27	40
O[C@H](CNOC/C=C\Cl)c1cccc(Cl)c1	ZINC000819324521	CF	On-Demand	Anodyne	ADRB3	42	40
O[C@@H](CNOC/C=C\Cl)c1cccc(Cl)c1	ZINC000819324524	CF	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNOC/C=C\Cl)c1cccc(Cl)c1	ZINC000819324524	CF	On-Demand	Anodyne	ADRB3	42	40
O=Cc1cc(C(=O)N2CCC[C@H](O)CC2)cs1	ZINC000819324528	CD	On-Demand	Anodyne	L3MBTL3	82	40
O=Cc1cc(C(=O)N2CCC[C@@H](O)CC2)cs1	ZINC000819324529	CD	On-Demand	Anodyne	L3MBTL3	82	40
O[C@H](CNOC/C=C/Cl)c1cccc(Cl)c1	ZINC000819324530	CF	On-Demand	Anodyne	ADRB1	27	40
O[C@H](CNOC/C=C/Cl)c1cccc(Cl)c1	ZINC000819324530	CF	On-Demand	Anodyne	ADRB3	42	40
O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC[C@H](O)CC1	ZINC000819324531	GI	On-Demand	Anodyne	ITGAL	42	36
O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC[C@H](O)CC1	ZINC000819324531	GI	On-Demand	Anodyne	CCR2	18	40
O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC[C@@H](O)CC1	ZINC000819324532	GI	On-Demand	Anodyne	ITGAL	42	36
O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC[C@@H](O)CC1	ZINC000819324532	GI	On-Demand	Anodyne	CCR2	18	40
O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC[C@@H](O)CC1	ZINC000819324534	GI	On-Demand	Anodyne	ITGAL	42	36
O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC[C@@H](O)CC1	ZINC000819324534	GI	On-Demand	Anodyne	CCR2	18	40
O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC[C@H](O)CC1	ZINC000819324535	GI	On-Demand	Anodyne	ITGAL	42	36
O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CCC[C@H](O)CC1	ZINC000819324535	GI	On-Demand	Anodyne	CCR2	18	40
O=C(c1ccc(Br)c(S(=O)(=O)N2CCOCC2)c1)N1CCC[C@H](O)CC1	ZINC000819324539	ID	On-Demand	Anodyne	CNR2	18	55
O=C(c1ccc(Br)c(S(=O)(=O)N2CCOCC2)c1)N1CCC[C@H](O)CC1	ZINC000819324539	ID	On-Demand	Anodyne	L3MBTL3	69	39
O=C(c1ccc(Br)c(S(=O)(=O)N2CCOCC2)c1)N1CCC[C@@H](O)CC1	ZINC000819324541	ID	On-Demand	Anodyne	CNR2	18	55
O=C(c1ccc(Br)c(S(=O)(=O)N2CCOCC2)c1)N1CCC[C@@H](O)CC1	ZINC000819324541	ID	On-Demand	Anodyne	L3MBTL3	69	39
O=C(c1ccc2c(=O)n(-c3ccccc3F)c(S)nc2c1)N1CCC[C@H](O)CC1	ZINC000819324542	HF	On-Demand	Anodyne	L3MBTL3	42	35
O=C(c1ccc2c(=O)n(-c3ccccc3F)c(S)nc2c1)N1CCC[C@H](O)CC1	ZINC000819324542	HF	On-Demand	Anodyne	HPGD	41	34
O=C(c1ccc2c(=O)n(-c3ccccc3F)c(S)nc2c1)N1CCC[C@@H](O)CC1	ZINC000819324544	HF	On-Demand	Anodyne	L3MBTL3	42	35
O=C(c1ccc2c(=O)n(-c3ccccc3F)c(S)nc2c1)N1CCC[C@@H](O)CC1	ZINC000819324544	HF	On-Demand	Anodyne	HPGD	41	34
CC(C)(C)OC(=O)N1CCC(OCC(=O)N2CCC[C@H](O)CC2)CC1	ZINC000819324546	FD	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1CCC(OCC(=O)N2CCC[C@@H](O)CC2)CC1	ZINC000819324548	FD	On-Demand	Anodyne	GPR119	34	40
O=C(c1ccc(S(=O)(=O)N2CCCC2)o1)N1CCC[C@@H](O)CC1	ZINC000819324561	ED	On-Demand	Anodyne	L3MBTL3	58	48
O=C(c1ccc(S(=O)(=O)N2CCCC2)o1)N1CCC[C@H](O)CC1	ZINC000819324563	ED	On-Demand	Anodyne	L3MBTL3	58	48
O=C(c1cccc(Cl)c1O)N1CCC[C@@H](O)CC1	ZINC000819324569	CE	On-Demand	Anodyne	L3MBTL3	81	47
O=C(c1cccc(Cl)c1O)N1CCC[C@H](O)CC1	ZINC000819324570	CE	On-Demand	Anodyne	L3MBTL3	81	47
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCC[C@H](O)CC2)(c2ccccc2)CC1	ZINC000819324581	HG	On-Demand	Anodyne	GPR119	36	42
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCC[C@@H](O)CC2)(c2ccccc2)CC1	ZINC000819324582	HG	On-Demand	Anodyne	GPR119	36	42
O=C(c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1Cl)N1CCC[C@H](O)CC1	ZINC000819324583	IG	On-Demand	Anodyne	AKR1C3	15	52
O=C(c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1Cl)N1CCC[C@H](O)CC1	ZINC000819324583	IG	On-Demand	Anodyne	SFRP1	43	39
O=C(c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1Cl)N1CCC[C@@H](O)CC1	ZINC000819324584	IG	On-Demand	Anodyne	AKR1C3	15	52
O=C(c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1Cl)N1CCC[C@@H](O)CC1	ZINC000819324584	IG	On-Demand	Anodyne	SFRP1	43	39
O=C1OCC[C@H]1Sc1ccc(C(=O)N2CCC[C@H](O)CC2)cc1	ZINC000819324600	EE	On-Demand	Anodyne	L3MBTL3	89	45
O=C1OCC[C@@H]1Sc1ccc(C(=O)N2CCC[C@@H](O)CC2)cc1	ZINC000819324601	EE	On-Demand	Anodyne	L3MBTL3	89	45
O=C1OCC[C@H]1Sc1ccc(C(=O)N2CCC[C@@H](O)CC2)cc1	ZINC000819324602	EE	On-Demand	Anodyne	L3MBTL3	89	45
O=C1OCC[C@@H]1Sc1ccc(C(=O)N2CCC[C@H](O)CC2)cc1	ZINC000819324603	EE	On-Demand	Anodyne	L3MBTL3	89	45
O=C(c1scnc1Cl)N1CCC[C@@H](O)CC1	ZINC000819324610	CD	On-Demand	Anodyne	L3MBTL3	40	35
O=C(c1scnc1Cl)N1CCC[C@H](O)CC1	ZINC000819324611	CD	On-Demand	Anodyne	L3MBTL3	40	35
CCC(=O)c1cc(C(=O)N2CCC[C@@H](O)CC2)ccc1F	ZINC000819324618	CE	On-Demand	Anodyne	L3MBTL3	97	43
CCC(=O)c1cc(C(=O)N2CCC[C@@H](O)CC2)ccc1F	ZINC000819324618	CE	On-Demand	Anodyne	HPGD	41	35
CCC(=O)c1cc(C(=O)N2CCC[C@H](O)CC2)ccc1F	ZINC000819324619	CE	On-Demand	Anodyne	L3MBTL3	97	43
CCC(=O)c1cc(C(=O)N2CCC[C@H](O)CC2)ccc1F	ZINC000819324619	CE	On-Demand	Anodyne	HPGD	41	35
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1CCC[C@@H](O)CC1	ZINC000819324630	FH	On-Demand	Anodyne	KCNH2	17	40
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1CCC[C@@H](O)CC1	ZINC000819324630	FH	On-Demand	Anodyne	GRIN2B	59	61
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1CCC[C@@H](O)CC1	ZINC000819324630	FH	On-Demand	Anodyne	HRH4	21	43
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1CCC[C@@H](O)CC1	ZINC000819324630	FH	On-Demand	Anodyne	CYP51A1	25	49
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1CCC[C@@H](O)CC1	ZINC000819324630	FH	On-Demand	Anodyne	AKR1C3	19	46
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1CCC[C@H](O)CC1	ZINC000819324631	FH	On-Demand	Anodyne	KCNH2	17	40
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1CCC[C@H](O)CC1	ZINC000819324631	FH	On-Demand	Anodyne	GRIN2B	59	61
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1CCC[C@H](O)CC1	ZINC000819324631	FH	On-Demand	Anodyne	HRH4	21	43
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1CCC[C@H](O)CC1	ZINC000819324631	FH	On-Demand	Anodyne	CYP51A1	25	49
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1CCC[C@H](O)CC1	ZINC000819324631	FH	On-Demand	Anodyne	AKR1C3	19	46
O=C(c1cc2occc2[nH]1)N1CCC[C@@H](O)CC1	ZINC000819324638	BD	On-Demand	Anodyne	GRIN2B	32	42
O=C(c1cc2occc2[nH]1)N1CCC[C@@H](O)CC1	ZINC000819324638	BD	On-Demand	Anodyne	AKR1C3	19	43
O=C(c1cc2occc2[nH]1)N1CCC[C@@H](O)CC1	ZINC000819324638	BD	On-Demand	Anodyne	L3MBTL3	46	35
O=C(c1cc2occc2[nH]1)N1CCC[C@H](O)CC1	ZINC000819324639	BD	On-Demand	Anodyne	GRIN2B	32	42
O=C(c1cc2occc2[nH]1)N1CCC[C@H](O)CC1	ZINC000819324639	BD	On-Demand	Anodyne	AKR1C3	19	43
O=C(c1cc2occc2[nH]1)N1CCC[C@H](O)CC1	ZINC000819324639	BD	On-Demand	Anodyne	L3MBTL3	46	35
COc1ccc(C(=O)N2CCC[C@@H](O)CC2)nc1Cl	ZINC000819324640	CD	On-Demand	Anodyne	L3MBTL3	41	34
COc1ccc(C(=O)N2CCC[C@H](O)CC2)nc1Cl	ZINC000819324641	CD	On-Demand	Anodyne	L3MBTL3	41	34
CC(C)c1ccc2cc(C(=O)N3CCC[C@H](O)CC3)[nH]c2c1	ZINC000819324644	DG	On-Demand	Anodyne	GRIN2B	31	49
CC(C)c1ccc2cc(C(=O)N3CCC[C@H](O)CC3)[nH]c2c1	ZINC000819324644	DG	On-Demand	Anodyne	HRH4	33	47
CC(C)c1ccc2cc(C(=O)N3CCC[C@H](O)CC3)[nH]c2c1	ZINC000819324644	DG	On-Demand	Anodyne	CYP51A1	24	42
CC(C)c1ccc2cc(C(=O)N3CCC[C@H](O)CC3)[nH]c2c1	ZINC000819324644	DG	On-Demand	Anodyne	AKR1C3	20	44
CC(C)c1ccc2cc(C(=O)N3CCC[C@@H](O)CC3)[nH]c2c1	ZINC000819324645	DG	On-Demand	Anodyne	GRIN2B	31	49
CC(C)c1ccc2cc(C(=O)N3CCC[C@@H](O)CC3)[nH]c2c1	ZINC000819324645	DG	On-Demand	Anodyne	HRH4	33	47
CC(C)c1ccc2cc(C(=O)N3CCC[C@@H](O)CC3)[nH]c2c1	ZINC000819324645	DG	On-Demand	Anodyne	CYP51A1	24	42
CC(C)c1ccc2cc(C(=O)N3CCC[C@@H](O)CC3)[nH]c2c1	ZINC000819324645	DG	On-Demand	Anodyne	AKR1C3	20	44
CC(C)(C)OC(=O)N1CCC[C@@H](CC(=O)N2CCC[C@H](O)CC2)CC1	ZINC000819324656	FF	On-Demand	Anodyne	PREP	15	42
CC(C)(C)OC(=O)N1CCC[C@@H](CC(=O)N2CCC[C@H](O)CC2)CC1	ZINC000819324656	FF	On-Demand	Anodyne	GPR119	36	41
CC(C)(C)OC(=O)N1CCC[C@H](CC(=O)N2CCC[C@H](O)CC2)CC1	ZINC000819324657	FF	On-Demand	Anodyne	PREP	15	42
CC(C)(C)OC(=O)N1CCC[C@H](CC(=O)N2CCC[C@H](O)CC2)CC1	ZINC000819324657	FF	On-Demand	Anodyne	GPR119	36	41
CC(C)(C)OC(=O)N1CCC[C@@H](CC(=O)N2CCC[C@@H](O)CC2)CC1	ZINC000819324658	FF	On-Demand	Anodyne	PREP	15	42
CC(C)(C)OC(=O)N1CCC[C@@H](CC(=O)N2CCC[C@@H](O)CC2)CC1	ZINC000819324658	FF	On-Demand	Anodyne	GPR119	36	41
CC(C)(C)OC(=O)N1CCC[C@H](CC(=O)N2CCC[C@@H](O)CC2)CC1	ZINC000819324659	FF	On-Demand	Anodyne	PREP	15	42
CC(C)(C)OC(=O)N1CCC[C@H](CC(=O)N2CCC[C@@H](O)CC2)CC1	ZINC000819324659	FF	On-Demand	Anodyne	GPR119	36	41
O=C([C@H](F)c1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819324660	CE	On-Demand	Anodyne	CYP51A1	22	41
O=C([C@H](F)c1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819324660	CE	On-Demand	Anodyne	DPP4	15	40
O=C([C@@H](F)c1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819324661	CE	On-Demand	Anodyne	CYP51A1	22	41
O=C([C@@H](F)c1ccccc1)N1CCC[C@@H](O)CC1	ZINC000819324661	CE	On-Demand	Anodyne	DPP4	15	40
O=C([C@H](F)c1ccccc1)N1CCC[C@H](O)CC1	ZINC000819324662	CE	On-Demand	Anodyne	CYP51A1	22	41
O=C([C@H](F)c1ccccc1)N1CCC[C@H](O)CC1	ZINC000819324662	CE	On-Demand	Anodyne	DPP4	15	40
O=C([C@@H](F)c1ccccc1)N1CCC[C@H](O)CC1	ZINC000819324663	CE	On-Demand	Anodyne	CYP51A1	22	41
O=C([C@@H](F)c1ccccc1)N1CCC[C@H](O)CC1	ZINC000819324663	CE	On-Demand	Anodyne	DPP4	15	40
O=C1CCCCN1Cc1ccc(C(=O)N2CCC[C@H](O)CC2)cc1	ZINC000819324666	EE	On-Demand	Anodyne	L3MBTL3	98	50
O=C1CCCCN1Cc1ccc(C(=O)N2CCC[C@@H](O)CC2)cc1	ZINC000819324667	EE	On-Demand	Anodyne	L3MBTL3	98	50
Cc1ccc(C(=O)N2CCC[C@H](O)CC2)cc1C#N	ZINC000819324682	CD	On-Demand	Mild	PREP	23	40
Cc1ccc(C(=O)N2CCC[C@H](O)CC2)cc1C#N	ZINC000819324682	CD	On-Demand	Mild	FASN	41	40
Cc1ccc(C(=O)N2CCC[C@H](O)CC2)cc1C#N	ZINC000819324682	CD	On-Demand	Mild	L3MBTL3	93	43
Cc1ccc(C(=O)N2CCC[C@H](O)CC2)cc1C#N	ZINC000819324682	CD	On-Demand	Mild	HPGD	42	37
Cc1ccc(C(=O)N2CCC[C@@H](O)CC2)cc1C#N	ZINC000819324683	CD	On-Demand	Mild	PREP	23	40
Cc1ccc(C(=O)N2CCC[C@@H](O)CC2)cc1C#N	ZINC000819324683	CD	On-Demand	Mild	FASN	41	40
Cc1ccc(C(=O)N2CCC[C@@H](O)CC2)cc1C#N	ZINC000819324683	CD	On-Demand	Mild	L3MBTL3	93	43
Cc1ccc(C(=O)N2CCC[C@@H](O)CC2)cc1C#N	ZINC000819324683	CD	On-Demand	Mild	HPGD	42	37
O=C(CCCc1ccsc1)N1CCC[C@@H](O)CC1	ZINC000819324688	CE	On-Demand	Anodyne	PREP	54	42
O=C(CCCc1ccsc1)N1CCC[C@H](O)CC1	ZINC000819324689	CE	On-Demand	Anodyne	PREP	54	42
CC(C)(C)OC(=O)N1CCN(CCC(=O)N2CCC[C@H](O)CC2)CC1	ZINC000819324729	FD	On-Demand	Anodyne	PREP	15	40
CC(C)(C)OC(=O)N1CCN(CCC(=O)N2CCC[C@@H](O)CC2)CC1	ZINC000819324731	FD	On-Demand	Anodyne	PREP	15	40
O=C(CCCCCCCCC(=O)N1CCC[C@@H](O)CC1)N1CCC[C@H](O)CC1	ZINC000819324734	GF	On-Demand	Anodyne	PREP	28	48
O=C(CCCCCCCCC(=O)N1CCC[C@H](O)CC1)N1CCC[C@H](O)CC1	ZINC000819324738	GF	On-Demand	Anodyne	PREP	28	48
O=C(CCCCCCCCC(=O)N1CCC[C@@H](O)CC1)N1CCC[C@@H](O)CC1	ZINC000819324740	GF	On-Demand	Anodyne	PREP	28	48
O=C(c1ccc(N2CCOCC2)nc1)N1CCC[C@H](O)CC1	ZINC000819324744	DC	On-Demand	Anodyne	HPGDS	15	46
O=C(c1ccc(N2CCOCC2)nc1)N1CCC[C@H](O)CC1	ZINC000819324744	DC	On-Demand	Anodyne	L3MBTL3	75	44
O=C(c1ccc(N2CCOCC2)nc1)N1CCC[C@@H](O)CC1	ZINC000819324746	DC	On-Demand	Anodyne	HPGDS	15	46
O=C(c1ccc(N2CCOCC2)nc1)N1CCC[C@@H](O)CC1	ZINC000819324746	DC	On-Demand	Anodyne	L3MBTL3	75	44
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCC[C@H](O)CC2)(S(C)(=O)=O)CC1	ZINC000819324747	HD	On-Demand	Anodyne	GPR119	34	42
CC(C)(C)OC(=O)N1CCC(C(=O)N2CCC[C@@H](O)CC2)(S(C)(=O)=O)CC1	ZINC000819324755	HD	On-Demand	Anodyne	GPR119	34	42
C=CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819324770	IH	On-Demand	Mild	CACNA1B	21	42
C=CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@@H](O)CC2)c1	ZINC000819324770	IH	On-Demand	Mild	SFRP1	46	38
C=CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819324772	IH	On-Demand	Mild	CACNA1B	21	42
C=CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)N2CCC[C@H](O)CC2)c1	ZINC000819324772	IH	On-Demand	Mild	SFRP1	46	38
O=C(O)[C@@H]1CN(C(=O)c2ccccc2NCc2cccnc2)CCO1	ZINC000819324813	ED	On-Demand	Anodyne	TBXAS1	15	40
O=C(O)[C@@H]1CN(C(=O)c2ccccc2NCc2cccnc2)CCO1	ZINC000819324813	ED	On-Demand	Anodyne	CHRNA7	43	36
O=C(O)[C@@H]1CN(C(=O)c2ccccc2NCc2cccnc2)CCO1	ZINC000819324813	ED	On-Demand	Anodyne	NAMPT	41	39
O=C(O)[C@H]1CN(C(=O)c2ccccc2NCc2cccnc2)CCO1	ZINC000819324816	ED	On-Demand	Anodyne	TBXAS1	15	40
O=C(O)[C@H]1CN(C(=O)c2ccccc2NCc2cccnc2)CCO1	ZINC000819324816	ED	On-Demand	Anodyne	CHRNA7	43	36
O=C(O)[C@H]1CN(C(=O)c2ccccc2NCc2cccnc2)CCO1	ZINC000819324816	ED	On-Demand	Anodyne	NAMPT	41	39
CN(C)S(=O)(=O)CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819324828	FD	On-Demand	Anodyne	ADRB3	36	45
CN(C)S(=O)(=O)CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819324828	FD	On-Demand	Anodyne	MMP2	16	44
CN(C)S(=O)(=O)CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819324829	FD	On-Demand	Anodyne	ADRB3	36	45
CN(C)S(=O)(=O)CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819324829	FD	On-Demand	Anodyne	MMP2	16	44
O=C(O)[C@H]1CN(C(=O)c2csc(NC3CC3)n2)CCO1	ZINC000819324833	CC	On-Demand	Anodyne	TRPC6	61	40
O=C(O)[C@H]1CN(C(=O)c2csc(NC3CC3)n2)CCO1	ZINC000819324833	CC	On-Demand	Anodyne	TRPC3	55	40
O=C(O)[C@@H]1CN(C(=O)c2csc(NC3CC3)n2)CCO1	ZINC000819324835	CC	On-Demand	Anodyne	TRPC6	61	40
O=C(O)[C@@H]1CN(C(=O)c2csc(NC3CC3)n2)CCO1	ZINC000819324835	CC	On-Demand	Anodyne	TRPC3	55	40
Cn1c(C(=O)N2CCC[C@H](O)CC2)ccc1-c1ccc(F)cc1	ZINC000819324861	DF	On-Demand	Anodyne	L3MBTL3	44	35
Cn1c(C(=O)N2CCC[C@@H](O)CC2)ccc1-c1ccc(F)cc1	ZINC000819324862	DF	On-Demand	Anodyne	L3MBTL3	44	35
C[C@@H](C(=O)N1CCC[C@@H](O)CC1)N1CCc2ccccc21	ZINC000819324871	CD	On-Demand	Anodyne	ACE	22	40
C[C@H](C(=O)N1CCC[C@H](O)CC1)N1CCc2ccccc21	ZINC000819324872	CD	On-Demand	Anodyne	ACE	22	40
C[C@H](C(=O)N1CCC[C@@H](O)CC1)N1CCc2ccccc21	ZINC000819324873	CD	On-Demand	Anodyne	ACE	22	40
C[C@@H](C(=O)N1CCC[C@H](O)CC1)N1CCc2ccccc21	ZINC000819324874	CD	On-Demand	Anodyne	ACE	22	40
O=C(c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1)N1CCC[C@H](O)CC1	ZINC000819324897	GE	On-Demand	Anodyne	L3MBTL3	86	40
O=C(c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1)N1CCC[C@@H](O)CC1	ZINC000819324898	GE	On-Demand	Anodyne	L3MBTL3	86	40
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CCC[C@H](O)CC1	ZINC000819324911	DD	On-Demand	Anodyne	GPR119	23	42
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CCC[C@@H](O)CC1	ZINC000819324912	DD	On-Demand	Anodyne	GPR119	23	42
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2C(=O)N2CCC[C@@H](O)CC2)CC1	ZINC000819324913	FF	On-Demand	Anodyne	GPR119	31	47
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2C(=O)N2CCC[C@H](O)CC2)CC1	ZINC000819324914	FF	On-Demand	Anodyne	GPR119	31	47
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@@H](O)CC1	ZINC000819324930	GF	On-Demand	Anodyne	CCKAR	17	41
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC[C@H](O)CC1	ZINC000819324931	GF	On-Demand	Anodyne	CCKAR	17	41
O=C(c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1)N1CCC[C@H](O)CC1	ZINC000819324933	HE	On-Demand	Bother	L3MBTL3	66	39
O=C(c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1)N1CCC[C@@H](O)CC1	ZINC000819324934	HE	On-Demand	Bother	L3MBTL3	66	39
O[C@H](CNOC/C=C/Cl)COc1cccc2ccccc12	ZINC000819324944	DF	On-Demand	Anodyne	ADRB2	24	56
O[C@H](CNOC/C=C/Cl)COc1cccc2ccccc12	ZINC000819324944	DF	On-Demand	Anodyne	ADRB1	40	38
O[C@@H](CNOC/C=C\Cl)COc1cccc2ccccc12	ZINC000819324945	DF	On-Demand	Anodyne	ADRB2	24	56
O[C@@H](CNOC/C=C\Cl)COc1cccc2ccccc12	ZINC000819324945	DF	On-Demand	Anodyne	ADRB1	40	38
O[C@@H](CNOC/C=C/Cl)COc1cccc2ccccc12	ZINC000819324946	DF	On-Demand	Anodyne	ADRB2	24	56
O[C@@H](CNOC/C=C/Cl)COc1cccc2ccccc12	ZINC000819324946	DF	On-Demand	Anodyne	ADRB1	40	38
O[C@H](CNOC/C=C\Cl)COc1cccc2ccccc12	ZINC000819324947	DF	On-Demand	Anodyne	ADRB2	24	56
O[C@H](CNOC/C=C\Cl)COc1cccc2ccccc12	ZINC000819324947	DF	On-Demand	Anodyne	ADRB1	40	38
CN(C)S(=O)(=O)CCNC[C@@H](O)c1cccnc1	ZINC000819324949	CB	On-Demand	Anodyne	ADRB2	31	47
CN(C)S(=O)(=O)CCNC[C@@H](O)c1cccnc1	ZINC000819324949	CB	On-Demand	Anodyne	ADRB1	39	46
CN(C)S(=O)(=O)CCNC[C@@H](O)c1cccnc1	ZINC000819324949	CB	On-Demand	Anodyne	ADRB3	128	63
CN(C)S(=O)(=O)CCNC[C@H](O)c1cccnc1	ZINC000819324950	CB	On-Demand	Anodyne	ADRB2	31	47
CN(C)S(=O)(=O)CCNC[C@H](O)c1cccnc1	ZINC000819324950	CB	On-Demand	Anodyne	ADRB1	39	46
CN(C)S(=O)(=O)CCNC[C@H](O)c1cccnc1	ZINC000819324950	CB	On-Demand	Anodyne	ADRB3	128	63
C[C@H]1C[C@H](NC[C@H](O)c2cccnc2)c2ccsc2S1(=O)=O	ZINC000819324951	EE	On-Demand	Anodyne	ADRB3	63	40
C[C@H]1C[C@H](NC[C@@H](O)c2cccnc2)c2ccsc2S1(=O)=O	ZINC000819324952	EE	On-Demand	Anodyne	ADRB3	63	40
CN(C)S(=O)(=O)CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819324982	DC	On-Demand	Bother	ADRB3	45	33
CN(C)S(=O)(=O)CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819324983	DC	On-Demand	Bother	ADRB3	45	33
O[C@H](CNOC/C=C/Cl)COc1ccc(Cl)c(Cl)c1	ZINC000819325000	EG	On-Demand	Anodyne	GRIN1	25	40
O[C@@H](CNOC/C=C\Cl)COc1ccc(Cl)c(Cl)c1	ZINC000819325001	EG	On-Demand	Anodyne	GRIN1	25	40
O[C@@H](CNOC/C=C/Cl)COc1ccc(Cl)c(Cl)c1	ZINC000819325002	EG	On-Demand	Anodyne	GRIN1	25	40
O[C@H](CNOC/C=C\Cl)COc1ccc(Cl)c(Cl)c1	ZINC000819325003	EG	On-Demand	Anodyne	GRIN1	25	40
O[C@@H](CNOC/C=C/Cl)COc1cccc2[nH]ccc12	ZINC000819325024	CE	On-Demand	Anodyne	ADRB1	21	60
O[C@H](CNOC/C=C/Cl)COc1cccc2[nH]ccc12	ZINC000819325025	CE	On-Demand	Anodyne	ADRB1	21	60
O[C@H](CNOC/C=C\Cl)COc1cccc2[nH]ccc12	ZINC000819325026	CE	On-Demand	Anodyne	ADRB1	21	60
O[C@@H](CNOC/C=C\Cl)COc1cccc2[nH]ccc12	ZINC000819325027	CE	On-Demand	Anodyne	ADRB1	21	60
C[C@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)c2ccsc2S1(=O)=O	ZINC000819325037	FG	On-Demand	Anodyne	ADRB3	40	38
C[C@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)c2ccsc2S1(=O)=O	ZINC000819325038	FG	On-Demand	Anodyne	ADRB3	40	38
O[C@@H](CNOC/C=C\Cl)CN1CCc2ccccc2C1	ZINC000819325039	CD	On-Demand	Anodyne	NOD2	40	34
O[C@@H](CNOC/C=C/Cl)CN1CCc2ccccc2C1	ZINC000819325040	CD	On-Demand	Anodyne	NOD2	40	34
O[C@H](CNOC/C=C/Cl)CN1CCc2ccccc2C1	ZINC000819325041	CD	On-Demand	Anodyne	NOD2	40	34
O[C@H](CNOC/C=C\Cl)CN1CCc2ccccc2C1	ZINC000819325042	CD	On-Demand	Anodyne	NOD2	40	34
O[C@@H](CNOC/C=C\Cl)c1cccnc1	ZINC000819325051	BD	On-Demand	Anodyne	ADRB3	66	41
O[C@H](CNOC/C=C\Cl)c1cccnc1	ZINC000819325052	BD	On-Demand	Anodyne	ADRB3	66	41
O[C@H](CNOC/C=C/Cl)c1cccnc1	ZINC000819325053	BD	On-Demand	Anodyne	ADRB3	66	41
O[C@@H](CNOC/C=C/Cl)c1cccnc1	ZINC000819325054	BD	On-Demand	Anodyne	ADRB3	66	41
O[C@@H](CNOC/C=C\Cl)c1ccccc1	ZINC000819325091	BD	On-Demand	Anodyne	AOC3	15	46
O[C@H](CNOC/C=C\Cl)c1ccccc1	ZINC000819325092	BD	On-Demand	Anodyne	AOC3	15	46
O[C@H](CNOC/C=C/Cl)c1ccccc1	ZINC000819325093	BD	On-Demand	Anodyne	AOC3	15	46
O[C@@H](CNOC/C=C/Cl)c1ccccc1	ZINC000819325094	BD	On-Demand	Anodyne	AOC3	15	46
CCOc1ccc(OC[C@H](O)CNOC/C=C\Cl)cc1	ZINC000819325105	DE	On-Demand	Anodyne	ADRB2	25	43
CCOc1ccc(OC[C@H](O)CNOC/C=C\Cl)cc1	ZINC000819325105	DE	On-Demand	Anodyne	ADRB1	26	43
CCOc1ccc(OC[C@@H](O)CNOC/C=C/Cl)cc1	ZINC000819325106	DE	On-Demand	Anodyne	ADRB2	25	43
CCOc1ccc(OC[C@@H](O)CNOC/C=C/Cl)cc1	ZINC000819325106	DE	On-Demand	Anodyne	ADRB1	26	43
CCOc1ccc(OC[C@@H](O)CNOC/C=C\Cl)cc1	ZINC000819325107	DE	On-Demand	Anodyne	ADRB2	25	43
CCOc1ccc(OC[C@@H](O)CNOC/C=C\Cl)cc1	ZINC000819325107	DE	On-Demand	Anodyne	ADRB1	26	43
CCOc1ccc(OC[C@H](O)CNOC/C=C/Cl)cc1	ZINC000819325108	DE	On-Demand	Anodyne	ADRB2	25	43
CCOc1ccc(OC[C@H](O)CNOC/C=C/Cl)cc1	ZINC000819325108	DE	On-Demand	Anodyne	ADRB1	26	43
Cn1ncc2ccc(CNC[C@H](O)c3cccnc3)cc21	ZINC000819325119	CD	On-Demand	Anodyne	ADRB2	25	44
Cn1ncc2ccc(CNC[C@H](O)c3cccnc3)cc21	ZINC000819325119	CD	On-Demand	Anodyne	ADRB1	25	41
Cn1ncc2ccc(CNC[C@H](O)c3cccnc3)cc21	ZINC000819325119	CD	On-Demand	Anodyne	ADRB3	97	48
Cn1ncc2ccc(CNC[C@H](O)c3cccnc3)cc21	ZINC000819325119	CD	On-Demand	Anodyne	CYP51A1	16	40
Cn1ncc2ccc(CNC[C@@H](O)c3cccnc3)cc21	ZINC000819325120	CD	On-Demand	Anodyne	ADRB2	25	44
Cn1ncc2ccc(CNC[C@@H](O)c3cccnc3)cc21	ZINC000819325120	CD	On-Demand	Anodyne	ADRB1	25	41
Cn1ncc2ccc(CNC[C@@H](O)c3cccnc3)cc21	ZINC000819325120	CD	On-Demand	Anodyne	ADRB3	97	48
Cn1ncc2ccc(CNC[C@@H](O)c3cccnc3)cc21	ZINC000819325120	CD	On-Demand	Anodyne	CYP51A1	16	40
CO[C@@](C)(CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000819325134	CE	On-Demand	Bother	CACNA1C	56	38
CO[C@@](C)(CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000819325134	CE	On-Demand	Bother	CACNA1D	85	37
CO[C@@](C)(CNC[C@H](O)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000819325135	CE	On-Demand	Bother	CACNA1C	56	38
CO[C@@](C)(CNC[C@H](O)c1cccc([N+](=O)[O-])c1)C1CC1	ZINC000819325135	CE	On-Demand	Bother	CACNA1D	85	37
C=Cc1ccc(CCNC[C@H](O)c2ccc(C)cc2)cc1	ZINC000819325146	CH	On-Demand	Anodyne	ADRB2	52	54
C=Cc1ccc(CCNC[C@H](O)c2ccc(C)cc2)cc1	ZINC000819325146	CH	On-Demand	Anodyne	ADRB1	55	42
C=Cc1ccc(CCNC[C@H](O)c2ccc(C)cc2)cc1	ZINC000819325146	CH	On-Demand	Anodyne	ADRB3	104	45
C=Cc1ccc(CCNC[C@@H](O)c2ccc(C)cc2)cc1	ZINC000819325147	CH	On-Demand	Anodyne	ADRB2	52	54
C=Cc1ccc(CCNC[C@@H](O)c2ccc(C)cc2)cc1	ZINC000819325147	CH	On-Demand	Anodyne	ADRB1	55	42
C=Cc1ccc(CCNC[C@@H](O)c2ccc(C)cc2)cc1	ZINC000819325147	CH	On-Demand	Anodyne	ADRB3	104	45
CN(C)S(=O)(=O)CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819325158	GC	On-Demand	Anodyne	GPR119	37	45
CN(C)S(=O)(=O)CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819325159	GC	On-Demand	Anodyne	GPR119	37	45
C=Cc1ccc(CCNC[C@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819325160	EG	On-Demand	Anodyne	ADRB2	58	58
C=Cc1ccc(CCNC[C@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819325160	EG	On-Demand	Anodyne	ADRB1	67	43
C=Cc1ccc(CCNC[C@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819325160	EG	On-Demand	Anodyne	ADRB3	57	44
C=Cc1ccc(CCNC[C@@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819325161	EG	On-Demand	Anodyne	ADRB2	58	58
C=Cc1ccc(CCNC[C@@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819325161	EG	On-Demand	Anodyne	ADRB1	67	43
C=Cc1ccc(CCNC[C@@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819325161	EG	On-Demand	Anodyne	ADRB3	57	44
O=C(CCNOC/C=C\Cl)Nc1cccnc1	ZINC000819325192	CD	On-Demand	Anodyne	NAMPT	17	40
O=C(CCNOC/C=C/Cl)Nc1cccnc1	ZINC000819325193	CD	On-Demand	Anodyne	NAMPT	17	40
CCn1c(=O)c2ccccc2n(CC(=O)Nc2cc(C(=O)OC)ccc2N2CCCC2)c1=O	ZINC000819325262	JE	On-Demand	Anodyne	KCNQ2	72	38
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2CCCCC(F)(F)C2)CC1	ZINC000819325300	GH	On-Demand	Anodyne	GPR119	27	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2CCCCC(F)(F)C2)CC1	ZINC000819325301	GH	On-Demand	Anodyne	GPR119	27	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H]2CCCCC(F)(F)C2)CC1	ZINC000819325302	GH	On-Demand	Anodyne	GPR119	27	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H]2CCCCC(F)(F)C2)CC1	ZINC000819325303	GH	On-Demand	Anodyne	GPR119	27	43
Cn1nc2c(c1CNC[C@H](O)c1cccc(Cl)c1)CCCC2	ZINC000819325310	DF	On-Demand	Anodyne	ADRB1	26	42
Cn1nc2c(c1CNC[C@H](O)c1cccc(Cl)c1)CCCC2	ZINC000819325310	DF	On-Demand	Anodyne	ADRB3	40	42
Cn1nc2c(c1CNC[C@@H](O)c1cccc(Cl)c1)CCCC2	ZINC000819325311	DF	On-Demand	Anodyne	ADRB1	26	42
Cn1nc2c(c1CNC[C@@H](O)c1cccc(Cl)c1)CCCC2	ZINC000819325311	DF	On-Demand	Anodyne	ADRB3	40	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)c1ccc(F)cc1F	ZINC000819325400	GG	On-Demand	Anodyne	GPR119	33	46
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)c1ccc(F)cc1F	ZINC000819325401	GG	On-Demand	Anodyne	GPR119	33	46
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)c1ccc(F)cc1F	ZINC000819325402	GG	On-Demand	Anodyne	GPR119	33	46
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)c1ccc(F)cc1F	ZINC000819325403	GG	On-Demand	Anodyne	GPR119	33	46
O=S1(=O)CCC(O)(CNC2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000819325415	GE	On-Demand	Anodyne	DRD2	18	43
O=S1(=O)CCC(O)(CNC2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)CC1	ZINC000819325415	GE	On-Demand	Anodyne	LTA4H	16	48
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)c1cccnc1	ZINC000819325424	EE	On-Demand	Anodyne	ADRB3	49	43
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)c1cccnc1	ZINC000819325425	EE	On-Demand	Anodyne	ADRB3	49	43
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)c1cccnc1	ZINC000819325426	EE	On-Demand	Anodyne	ADRB3	49	43
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)c1cccnc1	ZINC000819325427	EE	On-Demand	Anodyne	ADRB3	49	43
O=C1C[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)CN1c1ccccc1F	ZINC000819325451	FG	On-Demand	Anodyne	P2RX7	27	43
O=C1C[C@H](NC[C@H](O)c2ccc(F)cc2Cl)CN1c1ccccc1F	ZINC000819325452	FG	On-Demand	Anodyne	P2RX7	27	43
O=C1C[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)CN1c1ccccc1F	ZINC000819325453	FG	On-Demand	Anodyne	P2RX7	27	43
O=C1C[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)CN1c1ccccc1F	ZINC000819325454	FG	On-Demand	Anodyne	P2RX7	27	43
O[C@H](CNCCCCF)c1ccc(Cl)c(F)c1	ZINC000819325465	CF	On-Demand	Anodyne	ADRB2	35	44
O[C@H](CNCCCCF)c1ccc(Cl)c(F)c1	ZINC000819325465	CF	On-Demand	Anodyne	ADRB1	30	44
O[C@H](CNCCCCF)c1ccc(Cl)c(F)c1	ZINC000819325465	CF	On-Demand	Anodyne	ADRB3	28	44
O[C@@H](CNCCCCF)c1ccc(Cl)c(F)c1	ZINC000819325466	CF	On-Demand	Anodyne	ADRB2	35	44
O[C@@H](CNCCCCF)c1ccc(Cl)c(F)c1	ZINC000819325466	CF	On-Demand	Anodyne	ADRB1	30	44
O[C@@H](CNCCCCF)c1ccc(Cl)c(F)c1	ZINC000819325466	CF	On-Demand	Anodyne	ADRB3	28	44
O[C@H](CNC[C@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819325474	EH	On-Demand	Anodyne	ADRB1	32	42
O[C@H](CNC[C@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819325474	EH	On-Demand	Anodyne	ADRB3	44	42
O[C@H](CNC[C@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819325474	EH	On-Demand	Anodyne	CYP3A4	45	34
O[C@H](CNC[C@@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819325475	EH	On-Demand	Anodyne	ADRB1	32	42
O[C@H](CNC[C@@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819325475	EH	On-Demand	Anodyne	ADRB3	44	42
O[C@H](CNC[C@@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819325475	EH	On-Demand	Anodyne	CYP3A4	45	34
O[C@@H](CNC[C@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819325476	EH	On-Demand	Anodyne	ADRB1	32	42
O[C@@H](CNC[C@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819325476	EH	On-Demand	Anodyne	ADRB3	44	42
O[C@@H](CNC[C@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819325476	EH	On-Demand	Anodyne	CYP3A4	45	34
O[C@@H](CNC[C@@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819325477	EH	On-Demand	Anodyne	ADRB1	32	42
O[C@@H](CNC[C@@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819325477	EH	On-Demand	Anodyne	ADRB3	44	42
O[C@@H](CNC[C@@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819325477	EH	On-Demand	Anodyne	CYP3A4	45	34
O[C@H](CNC[C@H]1CCCCC(F)(F)C1)c1cccnc1	ZINC000819325487	CF	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNC[C@H]1CCCCC(F)(F)C1)c1cccnc1	ZINC000819325487	CF	On-Demand	Anodyne	ADRB1	22	44
O[C@H](CNC[C@H]1CCCCC(F)(F)C1)c1cccnc1	ZINC000819325487	CF	On-Demand	Anodyne	ADRB3	87	44
O[C@@H](CNC[C@H]1CCCCC(F)(F)C1)c1cccnc1	ZINC000819325488	CF	On-Demand	Anodyne	ADRB2	20	40
O[C@@H](CNC[C@H]1CCCCC(F)(F)C1)c1cccnc1	ZINC000819325488	CF	On-Demand	Anodyne	ADRB1	22	44
O[C@@H](CNC[C@H]1CCCCC(F)(F)C1)c1cccnc1	ZINC000819325488	CF	On-Demand	Anodyne	ADRB3	87	44
O[C@@H](CNC[C@@H]1CCCCC(F)(F)C1)c1cccnc1	ZINC000819325489	CF	On-Demand	Anodyne	ADRB2	20	40
O[C@@H](CNC[C@@H]1CCCCC(F)(F)C1)c1cccnc1	ZINC000819325489	CF	On-Demand	Anodyne	ADRB1	22	44
O[C@@H](CNC[C@@H]1CCCCC(F)(F)C1)c1cccnc1	ZINC000819325489	CF	On-Demand	Anodyne	ADRB3	87	44
O[C@H](CNC[C@@H]1CCCCC(F)(F)C1)c1cccnc1	ZINC000819325490	CF	On-Demand	Anodyne	ADRB2	20	40
O[C@H](CNC[C@@H]1CCCCC(F)(F)C1)c1cccnc1	ZINC000819325490	CF	On-Demand	Anodyne	ADRB1	22	44
O[C@H](CNC[C@@H]1CCCCC(F)(F)C1)c1cccnc1	ZINC000819325490	CF	On-Demand	Anodyne	ADRB3	87	44
Cc1ccc(OC[C@@H](O)CNOCCOC(C)C)c(C)c1	ZINC000819325491	CD	On-Demand	Anodyne	ADRB2	23	51
Cc1ccc(OC[C@H](O)CNOCCOC(C)C)c(C)c1	ZINC000819325492	CD	On-Demand	Anodyne	ADRB2	23	51
O=C1C[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CN1c1ccccc1F	ZINC000819325505	EF	On-Demand	Anodyne	ADRB3	16	42
O=C1C[C@H](NC[C@H](O)c2ccc(Cl)cc2)CN1c1ccccc1F	ZINC000819325506	EF	On-Demand	Anodyne	ADRB3	16	42
CC(C)(C)OC(=O)N1CCN(C2CCC(NCCS(C)(=O)=O)CC2)CC1	ZINC000819325522	GD	On-Demand	Anodyne	GPR119	44	39
Cc1cc(F)ccc1[C@@H](O)CNCCCCF	ZINC000819325526	BF	On-Demand	Anodyne	LEF	49	33
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2COCCOC2)CC1	ZINC000819325530	EC	On-Demand	Anodyne	GPR119	28	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2COCCOC2)CC1	ZINC000819325531	EC	On-Demand	Anodyne	GPR119	28	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(C3CC3)cc2F)CC1	ZINC000819325576	GH	On-Demand	Anodyne	GPR119	52	56
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(C3CC3)cc2F)CC1	ZINC000819325577	GH	On-Demand	Anodyne	GPR119	52	56
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COCCOC1	ZINC000819325611	GD	On-Demand	Anodyne	CTSD	115	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COCCOC1	ZINC000819325611	GD	On-Demand	Anodyne	PGC	64	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COCCOC1	ZINC000819325611	GD	On-Demand	Anodyne	PAPA1_CARPA	34	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COCCOC1	ZINC000819325611	GD	On-Demand	Anodyne	CTSL	17	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COCCOC1	ZINC000819325611	GD	On-Demand	Anodyne	BACE2	56	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COCCOC1	ZINC000819325611	GD	On-Demand	Anodyne	TACR3	15	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COCCOC1	ZINC000819325611	GD	On-Demand	Anodyne	REN	91	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COCCOC1	ZINC000819325611	GD	On-Demand	Anodyne	REN1	21	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COCCOC1	ZINC000819325611	GD	On-Demand	Anodyne	BACE1	88	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COCCOC1	ZINC000819325611	GD	On-Demand	Anodyne	CYP3A5	21	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COCCOC1	ZINC000819325611	GD	On-Demand	Anodyne	FPR1	52	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COCCOC1	ZINC000819325611	GD	On-Demand	Anodyne	PLM1_PLAFA	31	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1COCCOC1	ZINC000819325611	GD	On-Demand	Anodyne	Q82323_9DELA	53	30
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@@H](O)COc1ccc(F)cc1	ZINC000819325614	GF	On-Demand	Anodyne	ADRB1	41	38
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@H](O)COc1ccc(F)cc1	ZINC000819325615	GF	On-Demand	Anodyne	ADRB1	41	38
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)Cc1ccccc1	ZINC000819325627	FH	On-Demand	Anodyne	DRD2	16	45
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)Cc1ccccc1	ZINC000819325627	FH	On-Demand	Anodyne	LTA4H	16	46
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)Cc1ccccc1	ZINC000819325628	FH	On-Demand	Anodyne	DRD2	16	45
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)Cc1ccccc1	ZINC000819325628	FH	On-Demand	Anodyne	LTA4H	16	46
Cc1ccc(OC[C@@H](O)CNOCCOC(C)C)cc1	ZINC000819325654	CD	On-Demand	Anodyne	ADRB2	44	60
Cc1ccc(OC[C@@H](O)CNOCCOC(C)C)cc1	ZINC000819325654	CD	On-Demand	Anodyne	ADRB1	54	44
Cc1ccc(OC[C@@H](O)CNOCCOC(C)C)cc1	ZINC000819325654	CD	On-Demand	Anodyne	ADRB3	28	42
Cc1ccc(OC[C@H](O)CNOCCOC(C)C)cc1	ZINC000819325655	CD	On-Demand	Anodyne	ADRB2	44	60
Cc1ccc(OC[C@H](O)CNOCCOC(C)C)cc1	ZINC000819325655	CD	On-Demand	Anodyne	ADRB1	54	44
Cc1ccc(OC[C@H](O)CNOCCOC(C)C)cc1	ZINC000819325655	CD	On-Demand	Anodyne	ADRB3	28	42
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@@H](c3ccc(Br)cc3)C2)c1	ZINC000819325679	GH	On-Demand	Bother	CACNA1C	40	34
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@@H](c3ccc(Br)cc3)C2)c1	ZINC000819325679	GH	On-Demand	Bother	CACNA1D	60	32
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@@H](c3ccc(Br)cc3)C2)c1	ZINC000819325680	GH	On-Demand	Bother	CACNA1C	40	34
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@@H](c3ccc(Br)cc3)C2)c1	ZINC000819325680	GH	On-Demand	Bother	CACNA1D	60	32
O[C@H](CNC[C@H]1CCN(c2ccccc2F)C1)c1ccc(F)cc1	ZINC000819325722	EG	On-Demand	Anodyne	SLC6A3	18	45
O[C@H](CNC[C@@H]1CCN(c2ccccc2F)C1)c1ccc(F)cc1	ZINC000819325723	EG	On-Demand	Anodyne	SLC6A3	18	45
O[C@@H](CNC[C@H]1CCN(c2ccccc2F)C1)c1ccc(F)cc1	ZINC000819325724	EG	On-Demand	Anodyne	SLC6A3	18	45
O[C@@H](CNC[C@@H]1CCN(c2ccccc2F)C1)c1ccc(F)cc1	ZINC000819325725	EG	On-Demand	Anodyne	SLC6A3	18	45
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)COc1ccccc1F	ZINC000819325748	GF	On-Demand	Anodyne	ABCB1	30	49
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)COc1ccccc1F	ZINC000819325748	GF	On-Demand	Anodyne	GPR119	36	47
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)COc1ccccc1F	ZINC000819325749	GF	On-Demand	Anodyne	ABCB1	30	49
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)COc1ccccc1F	ZINC000819325749	GF	On-Demand	Anodyne	GPR119	36	47
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)COc1ccccc1F	ZINC000819325750	GF	On-Demand	Anodyne	ABCB1	30	49
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)COc1ccccc1F	ZINC000819325750	GF	On-Demand	Anodyne	GPR119	36	47
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)COc1ccccc1F	ZINC000819325751	GF	On-Demand	Anodyne	ABCB1	30	49
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)COc1ccccc1F	ZINC000819325751	GF	On-Demand	Anodyne	GPR119	36	47
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@H](O)c1ccc(C#N)cc1	ZINC000819325768	FF	On-Demand	Mild	DPP4	18	43
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@@H](O)c1ccc(C#N)cc1	ZINC000819325769	FF	On-Demand	Mild	DPP4	18	43
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(C3CC3)cc2F)cc1	ZINC000819325770	FF	On-Demand	Anodyne	TRPV1	86	37
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(C3CC3)cc2F)cc1	ZINC000819325771	FF	On-Demand	Anodyne	TRPV1	86	37
C[C@@H](CN[C@@H]1CC12CCN(C(=O)OC(C)(C)C)CC2)S(C)(=O)=O	ZINC000819325782	ED	On-Demand	Anodyne	GPR119	30	40
C[C@@H](CN[C@H]1CC12CCN(C(=O)OC(C)(C)C)CC2)S(C)(=O)=O	ZINC000819325783	ED	On-Demand	Anodyne	GPR119	30	40
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@@H](O)Cc1ccccc1	ZINC000819325793	FF	On-Demand	Anodyne	PGC	49	32
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@@H](O)Cc1ccccc1	ZINC000819325793	FF	On-Demand	Anodyne	FPR1	40	32
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@H](O)Cc1ccccc1	ZINC000819325794	FF	On-Demand	Anodyne	PGC	49	32
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@H](O)Cc1ccccc1	ZINC000819325794	FF	On-Demand	Anodyne	FPR1	40	32
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819325807	GH	On-Demand	Anodyne	ADRB1	30	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819325807	GH	On-Demand	Anodyne	ADRB3	48	43
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819325807	GH	On-Demand	Anodyne	CYP3A4	48	37
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819325808	GH	On-Demand	Anodyne	ADRB1	30	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819325808	GH	On-Demand	Anodyne	ADRB3	48	43
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819325808	GH	On-Demand	Anodyne	CYP3A4	48	37
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819325809	GH	On-Demand	Anodyne	ADRB1	30	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819325809	GH	On-Demand	Anodyne	ADRB3	48	43
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)c1cccc(Cl)c1	ZINC000819325809	GH	On-Demand	Anodyne	CYP3A4	48	37
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819325810	GH	On-Demand	Anodyne	ADRB1	30	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819325810	GH	On-Demand	Anodyne	ADRB3	48	43
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819325810	GH	On-Demand	Anodyne	CYP3A4	48	37
O=[N+]([O-])c1cccc([C@H](O)CNCCCCF)c1	ZINC000819325837	CD	On-Demand	Bother	ADRB1	42	39
O=[N+]([O-])c1cccc([C@H](O)CNCCCCF)c1	ZINC000819325837	CD	On-Demand	Bother	ADRB3	52	39
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCF)c1	ZINC000819325838	CD	On-Demand	Bother	ADRB1	42	39
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCF)c1	ZINC000819325838	CD	On-Demand	Bother	ADRB3	52	39
O[C@@H](CNCCCCF)c1cccc2ccccc12	ZINC000819325859	CG	On-Demand	Anodyne	ADRB2	21	40
O=C1C[C@@H](NC[C@H](O)c2cccc(F)c2)CN1c1ccccc1F	ZINC000819325917	EE	On-Demand	Anodyne	SLC6A2	15	40
O=C1C[C@@H](NC[C@@H](O)c2cccc(F)c2)CN1c1ccccc1F	ZINC000819325918	EE	On-Demand	Anodyne	SLC6A2	15	40
O=C1C[C@H](NC[C@@H](O)c2cccc(F)c2)CN1c1ccccc1F	ZINC000819325919	EE	On-Demand	Anodyne	SLC6A2	15	40
O=C1C[C@H](NC[C@H](O)c2cccc(F)c2)CN1c1ccccc1F	ZINC000819325920	EE	On-Demand	Anodyne	SLC6A2	15	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccccc2)CC12CCC2	ZINC000819325943	FH	On-Demand	Anodyne	GHRHR	43	30
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccccc2)CC12CCC2	ZINC000819325943	FH	On-Demand	Anodyne	PGC	43	34
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)Cc2ccccc2)CC12CCC2	ZINC000819325943	FH	On-Demand	Anodyne	REN	40	37
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)CC12CCC2	ZINC000819325944	FH	On-Demand	Anodyne	GHRHR	43	30
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)CC12CCC2	ZINC000819325944	FH	On-Demand	Anodyne	PGC	43	34
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)Cc2ccccc2)CC12CCC2	ZINC000819325944	FH	On-Demand	Anodyne	REN	40	37
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)CC12CCC2	ZINC000819325945	FH	On-Demand	Anodyne	GHRHR	43	30
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)CC12CCC2	ZINC000819325945	FH	On-Demand	Anodyne	PGC	43	34
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)Cc2ccccc2)CC12CCC2	ZINC000819325945	FH	On-Demand	Anodyne	REN	40	37
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccccc2)CC12CCC2	ZINC000819325946	FH	On-Demand	Anodyne	GHRHR	43	30
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccccc2)CC12CCC2	ZINC000819325946	FH	On-Demand	Anodyne	PGC	43	34
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)Cc2ccccc2)CC12CCC2	ZINC000819325946	FH	On-Demand	Anodyne	REN	40	37
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819325977	FF	On-Demand	Mild	GPR119	23	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819325978	FF	On-Demand	Mild	GPR119	23	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)c1ccc(C#N)cc1	ZINC000819325979	FF	On-Demand	Mild	GPR119	23	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)c1ccc(C#N)cc1	ZINC000819325980	FF	On-Demand	Mild	GPR119	23	41
C[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)S(C)(=O)=O	ZINC000819325990	FF	On-Demand	Anodyne	DRD2	17	45
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)c1ccccc1	ZINC000819325991	EG	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)c1ccccc1	ZINC000819325992	EG	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)c1ccccc1	ZINC000819325993	EG	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)c1ccccc1	ZINC000819325994	EG	On-Demand	Anodyne	GPR119	34	41
O[C@H](CNC1COCCOC1)c1cccc(Cl)c1	ZINC000819326003	CD	On-Demand	Anodyne	ADRB1	31	46
O[C@H](CNC1COCCOC1)c1cccc(Cl)c1	ZINC000819326003	CD	On-Demand	Anodyne	ADRB3	50	50
O[C@H](CNC1COCCOC1)c1cccc(Cl)c1	ZINC000819326003	CD	On-Demand	Anodyne	CYP3A4	48	37
O[C@@H](CNC1COCCOC1)c1cccc(Cl)c1	ZINC000819326004	CD	On-Demand	Anodyne	ADRB1	31	46
O[C@@H](CNC1COCCOC1)c1cccc(Cl)c1	ZINC000819326004	CD	On-Demand	Anodyne	ADRB3	50	50
O[C@@H](CNC1COCCOC1)c1cccc(Cl)c1	ZINC000819326004	CD	On-Demand	Anodyne	CYP3A4	48	37
O[C@@H](CNCC[C@]1(O)C[C@H]2CC[C@H]1C2)c1cccc(Cl)c1	ZINC000819326019	DF	On-Demand	Anodyne	ADRB1	36	43
O[C@@H](CNCC[C@]1(O)C[C@H]2CC[C@H]1C2)c1cccc(Cl)c1	ZINC000819326019	DF	On-Demand	Anodyne	ADRB3	46	43
O[C@H](CNCC[C@@]1(O)C[C@H]2CC[C@H]1C2)c1cccc(Cl)c1	ZINC000819326020	DF	On-Demand	Anodyne	ADRB1	36	43
O[C@H](CNCC[C@@]1(O)C[C@H]2CC[C@H]1C2)c1cccc(Cl)c1	ZINC000819326020	DF	On-Demand	Anodyne	ADRB3	46	43
O[C@H](CNCC[C@]1(O)C[C@H]2CC[C@H]1C2)c1cccc(Cl)c1	ZINC000819326021	DF	On-Demand	Anodyne	ADRB1	36	43
O[C@H](CNCC[C@]1(O)C[C@H]2CC[C@H]1C2)c1cccc(Cl)c1	ZINC000819326021	DF	On-Demand	Anodyne	ADRB3	46	43
O[C@@H](CNCC[C@@]1(O)C[C@H]2CC[C@H]1C2)c1cccc(Cl)c1	ZINC000819326022	DF	On-Demand	Anodyne	ADRB1	36	43
O[C@@H](CNCC[C@@]1(O)C[C@H]2CC[C@H]1C2)c1cccc(Cl)c1	ZINC000819326022	DF	On-Demand	Anodyne	ADRB3	46	43
CC(C)(C)[C@@H](O)CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1	ZINC000819326023	EH	On-Demand	Anodyne	DRD2	20	48
CC(C)(C)[C@@H](O)CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1	ZINC000819326023	EH	On-Demand	Anodyne	LTA4H	15	47
CC(C)(C)[C@@H](O)CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1	ZINC000819326023	EH	On-Demand	Anodyne	SIGMAR1	16	46
CC[C@H](O)CNC1CCC(N2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819326059	FE	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)CCc2ccccc2)CC12CCC2	ZINC000819326060	GH	On-Demand	Anodyne	GHRHR	42	33
CC[C@@H](O)CNC1CCC(N2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819326061	FE	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)CCc2ccccc2)CC12CCC2	ZINC000819326062	GH	On-Demand	Anodyne	GHRHR	42	33
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)CCc2ccccc2)CC12CCC2	ZINC000819326064	GH	On-Demand	Anodyne	GHRHR	42	33
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)CCc2ccccc2)CC12CCC2	ZINC000819326067	GH	On-Demand	Anodyne	GHRHR	42	33
O[C@H](CNC[C@@H]1CCN(c2ccccc2F)C1)c1cccnc1	ZINC000819326098	DE	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CNC[C@@H]1CCN(c2ccccc2F)C1)c1cccnc1	ZINC000819326098	DE	On-Demand	Anodyne	ADRB3	78	44
O[C@@H](CNC[C@H]1CCN(c2ccccc2F)C1)c1cccnc1	ZINC000819326099	DE	On-Demand	Anodyne	ADRB1	22	40
O[C@@H](CNC[C@H]1CCN(c2ccccc2F)C1)c1cccnc1	ZINC000819326099	DE	On-Demand	Anodyne	ADRB3	78	44
O[C@@H](CNC[C@@H]1CCN(c2ccccc2F)C1)c1cccnc1	ZINC000819326100	DE	On-Demand	Anodyne	ADRB1	22	40
O[C@@H](CNC[C@@H]1CCN(c2ccccc2F)C1)c1cccnc1	ZINC000819326100	DE	On-Demand	Anodyne	ADRB3	78	44
O[C@H](CNC[C@H]1CCN(c2ccccc2F)C1)c1cccnc1	ZINC000819326101	DE	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CNC[C@H]1CCN(c2ccccc2F)C1)c1cccnc1	ZINC000819326101	DE	On-Demand	Anodyne	ADRB3	78	44
O[C@H](CNCC1CC(F)(F)C1)c1cccc(Cl)c1	ZINC000819326112	CG	On-Demand	Anodyne	ADRB1	31	44
O[C@H](CNCC1CC(F)(F)C1)c1cccc(Cl)c1	ZINC000819326112	CG	On-Demand	Anodyne	ADRB3	46	44
O[C@@H](CNCC1CC(F)(F)C1)c1cccc(Cl)c1	ZINC000819326114	CG	On-Demand	Anodyne	ADRB1	31	44
O[C@@H](CNCC1CC(F)(F)C1)c1cccc(Cl)c1	ZINC000819326114	CG	On-Demand	Anodyne	ADRB3	46	44
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)COCc1ccccc1	ZINC000819326125	GF	On-Demand	Anodyne	GHRHR	60	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)COCc1ccccc1	ZINC000819326125	GF	On-Demand	Anodyne	GHSR	33	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)COCc1ccccc1	ZINC000819326126	GF	On-Demand	Anodyne	GHRHR	60	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)COCc1ccccc1	ZINC000819326126	GF	On-Demand	Anodyne	GHSR	33	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)COCc1ccccc1	ZINC000819326128	GF	On-Demand	Anodyne	GHRHR	60	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)COCc1ccccc1	ZINC000819326128	GF	On-Demand	Anodyne	GHSR	33	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)COCc1ccccc1	ZINC000819326131	GF	On-Demand	Anodyne	GHRHR	60	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)COCc1ccccc1	ZINC000819326131	GF	On-Demand	Anodyne	GHSR	33	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NCCC(=O)Nc1cccc(F)c1	ZINC000819326146	GH	On-Demand	Anodyne	CACNA1H	46	33
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NCCC(=O)Nc1cccc(F)c1	ZINC000819326146	GH	On-Demand	Anodyne	GPR119	25	45
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NCCC(=O)Nc1cccc(F)c1	ZINC000819326149	GH	On-Demand	Anodyne	CACNA1H	46	33
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NCCC(=O)Nc1cccc(F)c1	ZINC000819326149	GH	On-Demand	Anodyne	GPR119	25	45
O[C@H](CNC[C@H]1CCN(c2ccccc2F)C1)c1cccc(F)c1	ZINC000819326154	EG	On-Demand	Anodyne	SLC6A2	17	45
O[C@H](CNC[C@@H]1CCN(c2ccccc2F)C1)c1cccc(F)c1	ZINC000819326156	EG	On-Demand	Anodyne	SLC6A2	17	45
O[C@@H](CNC[C@H]1CCN(c2ccccc2F)C1)c1cccc(F)c1	ZINC000819326158	EG	On-Demand	Anodyne	SLC6A2	17	45
O[C@@H](CNC[C@@H]1CCN(c2ccccc2F)C1)c1cccc(F)c1	ZINC000819326160	EG	On-Demand	Anodyne	SLC6A2	17	45
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2CCCCC(F)(F)C2)c1	ZINC000819326162	EG	On-Demand	Bother	CACNA1D	43	35
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CCCCC(F)(F)C2)c1	ZINC000819326164	EG	On-Demand	Bother	CACNA1D	43	35
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CCCCC(F)(F)C2)c1	ZINC000819326166	EG	On-Demand	Bother	CACNA1D	43	35
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CCCCC(F)(F)C2)c1	ZINC000819326167	EG	On-Demand	Bother	CACNA1D	43	35
Cn1nc2c(c1CNC[C@H](O)c1cccnc1)CCCC2	ZINC000819326195	CD	On-Demand	Anodyne	ADRB3	90	41
Cn1nc2c(c1CNC[C@@H](O)c1cccnc1)CCCC2	ZINC000819326197	CD	On-Demand	Anodyne	ADRB3	90	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)COc1ccc(F)cc1	ZINC000819326240	GF	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)COc1ccc(F)cc1	ZINC000819326241	GF	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)COc1ccc(F)cc1	ZINC000819326242	GF	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)COc1ccc(F)cc1	ZINC000819326243	GF	On-Demand	Anodyne	GPR119	38	41
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)C(F)(F)F	ZINC000819326263	EG	On-Demand	Anodyne	DRD2	18	44
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)C(F)(F)F	ZINC000819326263	EG	On-Demand	Anodyne	LTA4H	15	47
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)C(F)(F)F	ZINC000819326264	EG	On-Demand	Anodyne	DRD2	18	44
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)C(F)(F)F	ZINC000819326264	EG	On-Demand	Anodyne	LTA4H	15	47
Cc1ccc(OC[C@@H](O)CN[C@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)cc1	ZINC000819326265	GG	On-Demand	Anodyne	ADRB2	21	45
Cc1ccc(OC[C@@H](O)CN[C@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)cc1	ZINC000819326265	GG	On-Demand	Anodyne	GPR119	37	42
Cc1ccc(OC[C@H](O)CN[C@@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)cc1	ZINC000819326266	GG	On-Demand	Anodyne	ADRB2	21	45
Cc1ccc(OC[C@H](O)CN[C@@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)cc1	ZINC000819326266	GG	On-Demand	Anodyne	GPR119	37	42
Cc1ccc(OC[C@H](O)CN[C@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)cc1	ZINC000819326267	GG	On-Demand	Anodyne	ADRB2	21	45
Cc1ccc(OC[C@H](O)CN[C@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)cc1	ZINC000819326267	GG	On-Demand	Anodyne	GPR119	37	42
Cc1ccc(OC[C@@H](O)CN[C@@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)cc1	ZINC000819326268	GG	On-Demand	Anodyne	ADRB2	21	45
Cc1ccc(OC[C@@H](O)CN[C@@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)cc1	ZINC000819326268	GG	On-Demand	Anodyne	GPR119	37	42
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819326274	EE	On-Demand	Anodyne	ADRB3	77	42
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819326275	EE	On-Demand	Anodyne	ADRB3	77	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2)CC12CCC2	ZINC000819326294	GG	On-Demand	Anodyne	ADRB2	41	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2)CC12CCC2	ZINC000819326294	GG	On-Demand	Anodyne	ADRB1	61	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)COc2ccccc2)CC12CCC2	ZINC000819326294	GG	On-Demand	Anodyne	ADRB3	46	43
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2)CC12CCC2	ZINC000819326295	GG	On-Demand	Anodyne	ADRB2	41	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2)CC12CCC2	ZINC000819326295	GG	On-Demand	Anodyne	ADRB1	61	42
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)COc2ccccc2)CC12CCC2	ZINC000819326295	GG	On-Demand	Anodyne	ADRB3	46	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2)CC12CCC2	ZINC000819326296	GG	On-Demand	Anodyne	ADRB2	41	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2)CC12CCC2	ZINC000819326296	GG	On-Demand	Anodyne	ADRB1	61	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)COc2ccccc2)CC12CCC2	ZINC000819326296	GG	On-Demand	Anodyne	ADRB3	46	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2)CC12CCC2	ZINC000819326297	GG	On-Demand	Anodyne	ADRB2	41	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2)CC12CCC2	ZINC000819326297	GG	On-Demand	Anodyne	ADRB1	61	42
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)COc2ccccc2)CC12CCC2	ZINC000819326297	GG	On-Demand	Anodyne	ADRB3	46	43
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819326302	GG	On-Demand	Anodyne	GPR119	33	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819326303	GG	On-Demand	Anodyne	GPR119	33	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819326304	GG	On-Demand	Anodyne	GPR119	33	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819326305	GG	On-Demand	Anodyne	GPR119	33	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)c1cccc(F)c1	ZINC000819326306	FG	On-Demand	Anodyne	GPR119	27	48
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)c1cccc(F)c1	ZINC000819326307	FG	On-Demand	Anodyne	GPR119	27	48
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)c1cccc(F)c1	ZINC000819326308	FG	On-Demand	Anodyne	GPR119	27	48
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)c1cccc(F)c1	ZINC000819326309	FG	On-Demand	Anodyne	GPR119	27	48
O[C@@H](CNCC[C@]1(O)C[C@H]2CC[C@H]1C2)c1ccccc1	ZINC000819326314	CE	On-Demand	Anodyne	SI	15	45
O[C@H](CNCC[C@]1(O)C[C@H]2CC[C@H]1C2)c1ccccc1	ZINC000819326315	CE	On-Demand	Anodyne	SI	15	45
O[C@H](CNCC[C@@]1(O)C[C@H]2CC[C@H]1C2)c1ccccc1	ZINC000819326316	CE	On-Demand	Anodyne	SI	15	45
O[C@@H](CNCC[C@@]1(O)C[C@H]2CC[C@H]1C2)c1ccccc1	ZINC000819326317	CE	On-Demand	Anodyne	SI	15	45
O[C@H](CNC[C@H]1CCN(c2ccccc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819326337	GH	On-Demand	Anodyne	LIPG	51	39
O[C@H](CNC[C@@H]1CCN(c2ccccc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819326338	GH	On-Demand	Anodyne	LIPG	51	39
O[C@@H](CNC[C@H]1CCN(c2ccccc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819326339	GH	On-Demand	Anodyne	LIPG	51	39
O[C@@H](CNC[C@@H]1CCN(c2ccccc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819326340	GH	On-Demand	Anodyne	LIPG	51	39
O[C@H](CN[C@@H]1C[C@@H](c2ccc(Br)cc2)C1)c1cccnc1	ZINC000819326358	EG	On-Demand	Anodyne	ADRB3	49	44
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(Br)cc2)C1)c1cccnc1	ZINC000819326359	EG	On-Demand	Anodyne	ADRB3	49	44
O[C@H](CNCCCCF)c1ccc(OC(F)(F)F)cc1	ZINC000819326395	CF	On-Demand	Anodyne	ADRB2	41	37
O[C@H](CNCCCCF)c1ccc(OC(F)(F)F)cc1	ZINC000819326395	CF	On-Demand	Anodyne	ADRB3	36	44
O[C@@H](CNCCCCF)c1ccc(OC(F)(F)F)cc1	ZINC000819326396	CF	On-Demand	Anodyne	ADRB2	41	37
O[C@@H](CNCCCCF)c1ccc(OC(F)(F)F)cc1	ZINC000819326396	CF	On-Demand	Anodyne	ADRB3	36	44
Cn1nc2c(c1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CCCC2	ZINC000819326425	GE	On-Demand	Anodyne	GPR119	27	41
Cn1nc2c(c1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CCCC2	ZINC000819326426	GE	On-Demand	Anodyne	GPR119	27	41
O=[N+]([O-])c1cccc([C@H](O)CNCC2CC(F)(F)C2)c1	ZINC000819326437	CE	On-Demand	Bother	CACNA1D	56	34
O=[N+]([O-])c1cccc([C@@H](O)CNCC2CC(F)(F)C2)c1	ZINC000819326438	CE	On-Demand	Bother	CACNA1D	56	34
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@@H](O)COc1ccccc1	ZINC000819326442	FE	On-Demand	Anodyne	ADRB2	37	43
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@@H](O)COc1ccccc1	ZINC000819326442	FE	On-Demand	Anodyne	ADRB1	61	40
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@@H](O)COc1ccccc1	ZINC000819326442	FE	On-Demand	Anodyne	ADRB3	39	40
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@@H](O)COc1ccccc1	ZINC000819326442	FE	On-Demand	Anodyne	ITGA4	42	37
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@@H](O)COc1ccccc1	ZINC000819326442	FE	On-Demand	Anodyne	ABCB1	19	40
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@H](O)COc1ccccc1	ZINC000819326443	FE	On-Demand	Anodyne	ADRB2	37	43
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@H](O)COc1ccccc1	ZINC000819326443	FE	On-Demand	Anodyne	ADRB1	61	40
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@H](O)COc1ccccc1	ZINC000819326443	FE	On-Demand	Anodyne	ADRB3	39	40
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@H](O)COc1ccccc1	ZINC000819326443	FE	On-Demand	Anodyne	ITGA4	42	37
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@H](O)COc1ccccc1	ZINC000819326443	FE	On-Demand	Anodyne	ABCB1	19	40
Cc1ccc(OC[C@@H](O)CNC[C@@H]2C[C@H](F)CN2C(=O)OC(C)(C)C)cc1	ZINC000819326444	GF	On-Demand	Anodyne	ADRB2	23	43
Cc1ccc(OC[C@@H](O)CNC[C@@H]2C[C@H](F)CN2C(=O)OC(C)(C)C)cc1	ZINC000819326444	GF	On-Demand	Anodyne	ADRB1	41	39
Cc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H](F)CN2C(=O)OC(C)(C)C)cc1	ZINC000819326445	GF	On-Demand	Anodyne	ADRB2	23	43
Cc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H](F)CN2C(=O)OC(C)(C)C)cc1	ZINC000819326445	GF	On-Demand	Anodyne	ADRB1	41	39
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819326461	GG	On-Demand	Bother	CACNA1D	49	32
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819326462	GG	On-Demand	Bother	CACNA1D	49	32
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819326463	GG	On-Demand	Bother	CACNA1D	49	32
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819326464	GG	On-Demand	Bother	CACNA1D	49	32
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)CCc1ccccc1	ZINC000819326466	FG	On-Demand	Anodyne	GHRHR	63	36
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)CCc1ccccc1	ZINC000819326466	FG	On-Demand	Anodyne	ABCB1	27	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)CCc1ccccc1	ZINC000819326466	FG	On-Demand	Anodyne	GPR119	32	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)CCc1ccccc1	ZINC000819326467	FG	On-Demand	Anodyne	GHRHR	63	36
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)CCc1ccccc1	ZINC000819326467	FG	On-Demand	Anodyne	ABCB1	27	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)CCc1ccccc1	ZINC000819326467	FG	On-Demand	Anodyne	GPR119	32	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)CCc1ccccc1	ZINC000819326468	FG	On-Demand	Anodyne	GHRHR	63	36
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)CCc1ccccc1	ZINC000819326468	FG	On-Demand	Anodyne	ABCB1	27	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)CCc1ccccc1	ZINC000819326468	FG	On-Demand	Anodyne	GPR119	32	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)CCc1ccccc1	ZINC000819326469	FG	On-Demand	Anodyne	GHRHR	63	36
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)CCc1ccccc1	ZINC000819326469	FG	On-Demand	Anodyne	ABCB1	27	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)CCc1ccccc1	ZINC000819326469	FG	On-Demand	Anodyne	GPR119	32	41
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@H](O)COc1ccc(C#N)cc1	ZINC000819326474	GE	On-Demand	Mild	DPP4	15	42
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819326475	GE	On-Demand	Mild	DPP4	15	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)COc1ccccc1	ZINC000819326482	GF	On-Demand	Anodyne	ADRB2	40	44
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)COc1ccccc1	ZINC000819326482	GF	On-Demand	Anodyne	ADRB1	53	39
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)COc1ccccc1	ZINC000819326482	GF	On-Demand	Anodyne	ABCB1	30	48
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)COc1ccccc1	ZINC000819326483	GF	On-Demand	Anodyne	ADRB2	40	44
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)COc1ccccc1	ZINC000819326483	GF	On-Demand	Anodyne	ADRB1	53	39
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)COc1ccccc1	ZINC000819326483	GF	On-Demand	Anodyne	ABCB1	30	48
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)COc1ccccc1	ZINC000819326484	GF	On-Demand	Anodyne	ADRB2	40	44
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)COc1ccccc1	ZINC000819326484	GF	On-Demand	Anodyne	ADRB1	53	39
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)COc1ccccc1	ZINC000819326484	GF	On-Demand	Anodyne	ABCB1	30	48
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)COc1ccccc1	ZINC000819326485	GF	On-Demand	Anodyne	ADRB2	40	44
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)COc1ccccc1	ZINC000819326485	GF	On-Demand	Anodyne	ADRB1	53	39
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)COc1ccccc1	ZINC000819326485	GF	On-Demand	Anodyne	ABCB1	30	48
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NCCC(=O)Nc1ccccc1F	ZINC000819326486	GH	On-Demand	Anodyne	GPR119	26	44
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NCCC(=O)Nc1ccccc1F	ZINC000819326487	GH	On-Demand	Anodyne	GPR119	26	44
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819326492	GH	On-Demand	Anodyne	GPR119	20	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819326493	GH	On-Demand	Anodyne	GPR119	20	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819326494	GH	On-Demand	Anodyne	GPR119	20	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819326495	GH	On-Demand	Anodyne	GPR119	20	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NCCS(=O)(=O)c1ccccc1	ZINC000819326502	GF	On-Demand	Anodyne	GPR119	44	40
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NCCS(=O)(=O)c1ccccc1	ZINC000819326502	GF	On-Demand	Anodyne	SFRP1	34	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NCCS(=O)(=O)c1ccccc1	ZINC000819326503	GF	On-Demand	Anodyne	GPR119	44	40
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NCCS(=O)(=O)c1ccccc1	ZINC000819326503	GF	On-Demand	Anodyne	SFRP1	34	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)c1cc(F)ccc1F	ZINC000819326529	GG	On-Demand	Anodyne	CACNA1H	41	33
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)c1cc(F)ccc1F	ZINC000819326529	GG	On-Demand	Anodyne	GPR119	33	48
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)c1cc(F)ccc1F	ZINC000819326530	GG	On-Demand	Anodyne	CACNA1H	41	33
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)c1cc(F)ccc1F	ZINC000819326530	GG	On-Demand	Anodyne	GPR119	33	48
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)c1cc(F)ccc1F	ZINC000819326531	GG	On-Demand	Anodyne	CACNA1H	41	33
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)c1cc(F)ccc1F	ZINC000819326531	GG	On-Demand	Anodyne	GPR119	33	48
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)c1cc(F)ccc1F	ZINC000819326532	GG	On-Demand	Anodyne	CACNA1H	41	33
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)c1cc(F)ccc1F	ZINC000819326532	GG	On-Demand	Anodyne	GPR119	33	48
O[C@H](CNC1COCCOC1)c1cccnc1	ZINC000819326537	BC	On-Demand	Anodyne	ADRB3	77	48
O[C@@H](CNC1COCCOC1)c1cccnc1	ZINC000819326538	BC	On-Demand	Anodyne	ADRB3	77	48
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)c1c(F)cccc1F	ZINC000819326542	GG	On-Demand	Anodyne	GPR119	35	47
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)c1c(F)cccc1F	ZINC000819326543	GG	On-Demand	Anodyne	GPR119	35	47
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)c1c(F)cccc1F	ZINC000819326544	GG	On-Demand	Anodyne	GPR119	35	47
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)c1c(F)cccc1F	ZINC000819326545	GG	On-Demand	Anodyne	GPR119	35	47
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cccnc2)CC12CCC2	ZINC000819326565	FG	On-Demand	Anodyne	ADRB3	72	47
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2cccnc2)CC12CCC2	ZINC000819326566	FG	On-Demand	Anodyne	ADRB3	72	47
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cccnc2)CC12CCC2	ZINC000819326567	FG	On-Demand	Anodyne	ADRB3	72	47
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2cccnc2)CC12CCC2	ZINC000819326568	FG	On-Demand	Anodyne	ADRB3	72	47
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNCCC(=O)Nc1ccccc1F	ZINC000819326585	GG	On-Demand	Anodyne	ITGA4	40	35
O[C@@H](CNCc1ccc(C2CC2)cc1F)c1cccnc1	ZINC000819326586	CF	On-Demand	Anodyne	ADRB1	21	41
O[C@@H](CNCc1ccc(C2CC2)cc1F)c1cccnc1	ZINC000819326586	CF	On-Demand	Anodyne	ADRB3	87	44
O[C@H](CNCc1ccc(C2CC2)cc1F)c1cccnc1	ZINC000819326587	CF	On-Demand	Anodyne	ADRB1	21	41
O[C@H](CNCc1ccc(C2CC2)cc1F)c1cccnc1	ZINC000819326587	CF	On-Demand	Anodyne	ADRB3	87	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CC(F)(F)C1	ZINC000819326588	GG	On-Demand	Anodyne	CTSD	122	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CC(F)(F)C1	ZINC000819326588	GG	On-Demand	Anodyne	PGC	63	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CC(F)(F)C1	ZINC000819326588	GG	On-Demand	Anodyne	CMA1	32	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CC(F)(F)C1	ZINC000819326588	GG	On-Demand	Anodyne	CTRA_BOVIN	17	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CC(F)(F)C1	ZINC000819326588	GG	On-Demand	Anodyne	PAPA1_CARPA	32	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CC(F)(F)C1	ZINC000819326588	GG	On-Demand	Anodyne	CTSK	19	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CC(F)(F)C1	ZINC000819326588	GG	On-Demand	Anodyne	CTSL	17	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CC(F)(F)C1	ZINC000819326588	GG	On-Demand	Anodyne	PGA	49	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CC(F)(F)C1	ZINC000819326588	GG	On-Demand	Anodyne	BACE2	57	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CC(F)(F)C1	ZINC000819326588	GG	On-Demand	Anodyne	TIMP3	40	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CC(F)(F)C1	ZINC000819326588	GG	On-Demand	Anodyne	REN	105	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CC(F)(F)C1	ZINC000819326588	GG	On-Demand	Anodyne	REN1	34	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CC(F)(F)C1	ZINC000819326588	GG	On-Demand	Anodyne	BACE1	108	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CC(F)(F)C1	ZINC000819326588	GG	On-Demand	Anodyne	FPR1	56	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CC(F)(F)C1	ZINC000819326588	GG	On-Demand	Anodyne	PLM1_PLAFA	34	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CC(F)(F)C1	ZINC000819326588	GG	On-Demand	Anodyne	PLM2_PLAFA	67	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CC(F)(F)C1	ZINC000819326588	GG	On-Demand	Anodyne	GAG-PRO	51	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1CC(F)(F)C1	ZINC000819326588	GG	On-Demand	Anodyne	Q82323_9DELA	75	34
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)c1ccc(F)cc1Cl	ZINC000819326623	GH	On-Demand	Anodyne	GPR119	24	43
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819326624	GH	On-Demand	Anodyne	GPR119	24	43
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)c1ccc(F)cc1Cl	ZINC000819326625	GH	On-Demand	Anodyne	GPR119	24	43
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819326626	GH	On-Demand	Anodyne	GPR119	24	43
C[C@@](O)(CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)C(F)(F)F	ZINC000819326628	FG	On-Demand	Anodyne	DRD2	21	45
C[C@@](O)(CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)C(F)(F)F	ZINC000819326628	FG	On-Demand	Anodyne	LTA4H	15	46
C[C@@](O)(CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)C(F)(F)F	ZINC000819326628	FG	On-Demand	Anodyne	SIGMAR1	17	45
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)c1ccc(F)cn1	ZINC000819326635	FF	On-Demand	Anodyne	GPR119	42	39
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)c1ccc(F)cn1	ZINC000819326636	FF	On-Demand	Anodyne	GPR119	42	39
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)c1ccc(F)cn1	ZINC000819326637	FF	On-Demand	Anodyne	GPR119	42	39
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)c1ccc(F)cn1	ZINC000819326638	FF	On-Demand	Anodyne	GPR119	42	39
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)Cc1ccccc1	ZINC000819326645	FF	On-Demand	Anodyne	GHRHR	64	34
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)Cc1ccccc1	ZINC000819326645	FF	On-Demand	Anodyne	PGC	42	32
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)Cc1ccccc1	ZINC000819326645	FF	On-Demand	Anodyne	FPR1	43	34
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)Cc1ccccc1	ZINC000819326645	FF	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)Cc1ccccc1	ZINC000819326646	FF	On-Demand	Anodyne	GHRHR	64	34
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)Cc1ccccc1	ZINC000819326646	FF	On-Demand	Anodyne	PGC	42	32
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)Cc1ccccc1	ZINC000819326646	FF	On-Demand	Anodyne	FPR1	43	34
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)Cc1ccccc1	ZINC000819326646	FF	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)Cc1ccccc1	ZINC000819326647	FF	On-Demand	Anodyne	GHRHR	64	34
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)Cc1ccccc1	ZINC000819326647	FF	On-Demand	Anodyne	PGC	42	32
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)Cc1ccccc1	ZINC000819326647	FF	On-Demand	Anodyne	FPR1	43	34
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)Cc1ccccc1	ZINC000819326647	FF	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)Cc1ccccc1	ZINC000819326648	FF	On-Demand	Anodyne	GHRHR	64	34
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)Cc1ccccc1	ZINC000819326648	FF	On-Demand	Anodyne	PGC	42	32
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)Cc1ccccc1	ZINC000819326648	FF	On-Demand	Anodyne	FPR1	43	34
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)Cc1ccccc1	ZINC000819326648	FF	On-Demand	Anodyne	GPR119	30	41
OC1(CNC2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)CCC1	ZINC000819326656	DG	On-Demand	Anodyne	DRD2	19	45
OC1(CNC2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)CCC1	ZINC000819326656	DG	On-Demand	Anodyne	LTA4H	15	48
OC1(CNC2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)CCC1	ZINC000819326656	DG	On-Demand	Anodyne	SIGMAR1	15	43
Cc1ccccc1[C@@H](O)CN[C@@H]1CC(=O)N(c2ccccc2F)C1	ZINC000819326666	EF	On-Demand	Anodyne	CTSA	46	37
Cc1ccccc1[C@@H](O)CN[C@H]1CC(=O)N(c2ccccc2F)C1	ZINC000819326668	EF	On-Demand	Anodyne	CTSA	46	37
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@H](O)COc1ccccc1F	ZINC000819326683	GF	On-Demand	Anodyne	ADRB2	15	40
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@H](O)COc1ccccc1F	ZINC000819326683	GF	On-Demand	Anodyne	ADRB1	40	35
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@@H](O)COc1ccccc1F	ZINC000819326684	GF	On-Demand	Anodyne	ADRB2	15	40
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@@H](O)COc1ccccc1F	ZINC000819326684	GF	On-Demand	Anodyne	ADRB1	40	35
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)Cc1ccc(F)cc1	ZINC000819326689	GH	On-Demand	Anodyne	DRD2	19	46
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)Cc1ccc(F)cc1	ZINC000819326689	GH	On-Demand	Anodyne	SLC6A3	24	47
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)Cc1ccc(F)cc1	ZINC000819326689	GH	On-Demand	Anodyne	LTA4H	15	44
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)Cc1ccc(F)cc1	ZINC000819326689	GH	On-Demand	Anodyne	CCR3	22	40
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)Cc1ccc(F)cc1	ZINC000819326690	GH	On-Demand	Anodyne	DRD2	19	46
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)Cc1ccc(F)cc1	ZINC000819326690	GH	On-Demand	Anodyne	SLC6A3	24	47
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)Cc1ccc(F)cc1	ZINC000819326690	GH	On-Demand	Anodyne	LTA4H	15	44
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)Cc1ccc(F)cc1	ZINC000819326690	GH	On-Demand	Anodyne	CCR3	22	40
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)c1ccc(F)cc1	ZINC000819326716	FG	On-Demand	Anodyne	GPR119	33	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)c1ccc(F)cc1	ZINC000819326717	FG	On-Demand	Anodyne	GPR119	33	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)c1ccc(F)cc1	ZINC000819326718	FG	On-Demand	Anodyne	GPR119	33	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)c1ccc(F)cc1	ZINC000819326719	FG	On-Demand	Anodyne	GPR119	33	42
C[C@H](NC[C@H](O)c1cccnc1)c1ccc(N2CCCNC2=O)cc1	ZINC000819326727	EE	On-Demand	Anodyne	ADRB2	18	40
C[C@H](NC[C@H](O)c1cccnc1)c1ccc(N2CCCNC2=O)cc1	ZINC000819326727	EE	On-Demand	Anodyne	ADRB1	22	47
C[C@H](NC[C@H](O)c1cccnc1)c1ccc(N2CCCNC2=O)cc1	ZINC000819326727	EE	On-Demand	Anodyne	ADRB3	72	47
C[C@@H](NC[C@@H](O)c1cccnc1)c1ccc(N2CCCNC2=O)cc1	ZINC000819326729	EE	On-Demand	Anodyne	ADRB2	18	40
C[C@@H](NC[C@@H](O)c1cccnc1)c1ccc(N2CCCNC2=O)cc1	ZINC000819326729	EE	On-Demand	Anodyne	ADRB1	22	47
C[C@@H](NC[C@@H](O)c1cccnc1)c1ccc(N2CCCNC2=O)cc1	ZINC000819326729	EE	On-Demand	Anodyne	ADRB3	72	47
O[C@@H](CNC[C@@H]1CCCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819326739	DI	On-Demand	Anodyne	ADRB1	31	41
O[C@@H](CNC[C@@H]1CCCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819326739	DI	On-Demand	Anodyne	ADRB3	44	41
O[C@H](CNC[C@@H]1CCCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819326740	DI	On-Demand	Anodyne	ADRB1	31	41
O[C@H](CNC[C@@H]1CCCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819326740	DI	On-Demand	Anodyne	ADRB3	44	41
O[C@H](CNC[C@H]1CCCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819326742	DI	On-Demand	Anodyne	ADRB1	31	41
O[C@H](CNC[C@H]1CCCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819326742	DI	On-Demand	Anodyne	ADRB3	44	41
O[C@@H](CNC[C@H]1CCCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819326744	DI	On-Demand	Anodyne	ADRB1	31	41
O[C@@H](CNC[C@H]1CCCCC(F)(F)C1)c1cccc(Cl)c1	ZINC000819326744	DI	On-Demand	Anodyne	ADRB3	44	41
O[C@H](CNCC1CC(F)(F)C1)c1cccnc1	ZINC000819326758	BD	On-Demand	Anodyne	ADRB2	22	43
O[C@H](CNCC1CC(F)(F)C1)c1cccnc1	ZINC000819326758	BD	On-Demand	Anodyne	ADRB1	23	43
O[C@H](CNCC1CC(F)(F)C1)c1cccnc1	ZINC000819326758	BD	On-Demand	Anodyne	ADRB3	90	43
O[C@@H](CNCC1CC(F)(F)C1)c1cccnc1	ZINC000819326759	BD	On-Demand	Anodyne	ADRB2	22	43
O[C@@H](CNCC1CC(F)(F)C1)c1cccnc1	ZINC000819326759	BD	On-Demand	Anodyne	ADRB1	23	43
O[C@@H](CNCC1CC(F)(F)C1)c1cccnc1	ZINC000819326759	BD	On-Demand	Anodyne	ADRB3	90	43
O=C1C[C@H](NC[C@H](O)c2cccnc2)CN1c1ccccc1F	ZINC000819326763	DD	On-Demand	Anodyne	ADRB3	64	45
O=C1C[C@@H](NC[C@H](O)c2cccnc2)CN1c1ccccc1F	ZINC000819326764	DD	On-Demand	Anodyne	ADRB3	64	45
O=C1C[C@@H](NC[C@@H](O)c2cccnc2)CN1c1ccccc1F	ZINC000819326766	DD	On-Demand	Anodyne	ADRB3	64	45
O=C1C[C@H](NC[C@@H](O)c2cccnc2)CN1c1ccccc1F	ZINC000819326768	DD	On-Demand	Anodyne	ADRB3	64	45
O[C@H](CNCCCCF)c1cccc(Cl)c1	ZINC000819326781	BF	On-Demand	Anodyne	ADRB2	59	44
O[C@H](CNCCCCF)c1cccc(Cl)c1	ZINC000819326781	BF	On-Demand	Anodyne	ADRB1	66	53
O[C@H](CNCCCCF)c1cccc(Cl)c1	ZINC000819326781	BF	On-Demand	Anodyne	ADRB3	82	53
O[C@@H](CNCCCCF)c1cccc(Cl)c1	ZINC000819326783	BF	On-Demand	Anodyne	ADRB2	59	44
O[C@@H](CNCCCCF)c1cccc(Cl)c1	ZINC000819326783	BF	On-Demand	Anodyne	ADRB1	66	53
O[C@@H](CNCCCCF)c1cccc(Cl)c1	ZINC000819326783	BF	On-Demand	Anodyne	ADRB3	82	53
O[C@H](CNC[C@H]1CCN(c2ccccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819326784	GH	On-Demand	Anodyne	LIPG	45	38
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)c1ccccc1F	ZINC000819326785	FG	On-Demand	Anodyne	GPR119	33	46
O[C@H](CNC[C@@H]1CCN(c2ccccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819326786	GH	On-Demand	Anodyne	LIPG	45	38
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)c1ccccc1F	ZINC000819326787	FG	On-Demand	Anodyne	GPR119	33	46
O[C@@H](CNC[C@H]1CCN(c2ccccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819326788	GH	On-Demand	Anodyne	LIPG	45	38
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)c1ccccc1F	ZINC000819326789	FG	On-Demand	Anodyne	GPR119	33	46
O[C@@H](CNC[C@@H]1CCN(c2ccccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819326790	GH	On-Demand	Anodyne	LIPG	45	38
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)c1ccccc1F	ZINC000819326791	FG	On-Demand	Anodyne	GPR119	33	46
O[C@H](CNCC[C@@]1(O)C[C@H]2CC[C@H]1C2)c1cccnc1	ZINC000819326795	CD	On-Demand	Anodyne	ADRB2	21	40
O[C@H](CNCC[C@@]1(O)C[C@H]2CC[C@H]1C2)c1cccnc1	ZINC000819326795	CD	On-Demand	Anodyne	ADRB1	23	41
O[C@H](CNCC[C@@]1(O)C[C@H]2CC[C@H]1C2)c1cccnc1	ZINC000819326795	CD	On-Demand	Anodyne	ADRB3	88	46
O[C@H](CNCC[C@]1(O)C[C@H]2CC[C@H]1C2)c1cccnc1	ZINC000819326796	CD	On-Demand	Anodyne	ADRB2	21	40
O[C@H](CNCC[C@]1(O)C[C@H]2CC[C@H]1C2)c1cccnc1	ZINC000819326796	CD	On-Demand	Anodyne	ADRB1	23	41
O[C@H](CNCC[C@]1(O)C[C@H]2CC[C@H]1C2)c1cccnc1	ZINC000819326796	CD	On-Demand	Anodyne	ADRB3	88	46
O[C@@H](CNCC[C@@]1(O)C[C@H]2CC[C@H]1C2)c1cccnc1	ZINC000819326798	CD	On-Demand	Anodyne	ADRB2	21	40
O[C@@H](CNCC[C@@]1(O)C[C@H]2CC[C@H]1C2)c1cccnc1	ZINC000819326798	CD	On-Demand	Anodyne	ADRB1	23	41
O[C@@H](CNCC[C@@]1(O)C[C@H]2CC[C@H]1C2)c1cccnc1	ZINC000819326798	CD	On-Demand	Anodyne	ADRB3	88	46
O[C@@H](CNCC[C@]1(O)C[C@H]2CC[C@H]1C2)c1cccnc1	ZINC000819326800	CD	On-Demand	Anodyne	ADRB2	21	40
O[C@@H](CNCC[C@]1(O)C[C@H]2CC[C@H]1C2)c1cccnc1	ZINC000819326800	CD	On-Demand	Anodyne	ADRB1	23	41
O[C@@H](CNCC[C@]1(O)C[C@H]2CC[C@H]1C2)c1cccnc1	ZINC000819326800	CD	On-Demand	Anodyne	ADRB3	88	46
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@H]1CCN(c2ccccc2F)C1	ZINC000819326819	GF	On-Demand	Anodyne	GPR119	19	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNC[C@@H]1CCN(c2ccccc2F)C1	ZINC000819326820	GF	On-Demand	Anodyne	GPR119	19	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@H]1CCN(c2ccccc2F)C1	ZINC000819326821	GF	On-Demand	Anodyne	GPR119	19	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC[C@@H]1CCN(c2ccccc2F)C1	ZINC000819326822	GF	On-Demand	Anodyne	GPR119	19	40
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)CC12CCC2	ZINC000819326855	GI	On-Demand	Anodyne	ADRB1	35	47
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)CC12CCC2	ZINC000819326855	GI	On-Demand	Anodyne	ADRB3	56	47
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)CC12CCC2	ZINC000819326855	GI	On-Demand	Anodyne	CYP3A4	49	38
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CC12CCC2	ZINC000819326856	GI	On-Demand	Anodyne	ADRB1	35	47
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CC12CCC2	ZINC000819326856	GI	On-Demand	Anodyne	ADRB3	56	47
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CC12CCC2	ZINC000819326856	GI	On-Demand	Anodyne	CYP3A4	49	38
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)CC12CCC2	ZINC000819326857	GI	On-Demand	Anodyne	ADRB1	35	47
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)CC12CCC2	ZINC000819326857	GI	On-Demand	Anodyne	ADRB3	56	47
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)CC12CCC2	ZINC000819326857	GI	On-Demand	Anodyne	CYP3A4	49	38
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)CC12CCC2	ZINC000819326858	GI	On-Demand	Anodyne	ADRB1	35	47
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)CC12CCC2	ZINC000819326858	GI	On-Demand	Anodyne	ADRB3	56	47
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)CC12CCC2	ZINC000819326858	GI	On-Demand	Anodyne	CYP3A4	49	38
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@H](O)Cc1ccc(F)cc1	ZINC000819326908	GG	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@H](O)Cc1ccc(F)cc1	ZINC000819326909	GG	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2NC[C@@H](O)Cc1ccc(F)cc1	ZINC000819326910	GG	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2NC[C@@H](O)Cc1ccc(F)cc1	ZINC000819326911	GG	On-Demand	Anodyne	GPR119	32	42
CCOC(=O)Nc1ccc(C(=O)Nc2cc(C(=O)OC)ccc2N2CCCC2)cc1	ZINC000819326947	HH	On-Demand	Anodyne	KCNQ2	70	35
CCOC(=O)Nc1ccc(C(=O)Nc2cc(C(=O)OC)ccc2N2CCCC2)cc1	ZINC000819326947	HH	On-Demand	Anodyne	PRNP	51	35
CCOC(=O)Nc1ccc(C(=O)Nc2cc(C(=O)OC)ccc2N2CCCC2)cc1	ZINC000819326947	HH	On-Demand	Anodyne	TAAR1	30	41
CCOC(=O)Nc1ccc(C(=O)Nc2cc(C(=O)OC)ccc2N2CCCC2)cc1	ZINC000819326947	HH	On-Demand	Anodyne	NOD2	40	39
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819326970	FG	On-Demand	Anodyne	ADRB1	31	42
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819326970	FG	On-Demand	Anodyne	ADRB3	47	40
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819326970	FG	On-Demand	Anodyne	CYP3A4	43	31
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819326972	FG	On-Demand	Anodyne	ADRB1	31	42
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819326972	FG	On-Demand	Anodyne	ADRB3	47	40
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819326972	FG	On-Demand	Anodyne	CYP3A4	43	31
O[C@H](CN[C@@H]1C[C@@H](c2ccc(Br)cc2)C1)c1ccccc1	ZINC000819327004	EI	On-Demand	Anodyne	SLC18A3	15	52
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(Br)cc2)C1)c1ccccc1	ZINC000819327006	EI	On-Demand	Anodyne	SLC18A3	15	52
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CC12CCC2	ZINC000819327033	GI	On-Demand	Anodyne	ADRB3	21	43
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)CC12CCC2	ZINC000819327036	GI	On-Demand	Anodyne	ADRB3	21	43
C[C@H](NC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)[C@@H](C)O	ZINC000819327063	DF	On-Demand	Anodyne	DRD2	22	48
C[C@H](NC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)[C@@H](C)O	ZINC000819327063	DF	On-Demand	Anodyne	SLC6A3	18	43
C[C@H](NC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)[C@@H](C)O	ZINC000819327063	DF	On-Demand	Anodyne	SLC18A2	42	35
C[C@H](NC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)[C@@H](C)O	ZINC000819327063	DF	On-Demand	Anodyne	LTA4H	15	46
C[C@H](NC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)[C@@H](C)O	ZINC000819327063	DF	On-Demand	Anodyne	SIGMAR1	18	46
O=C1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CN1c1ccccc1F	ZINC000819327208	EF	On-Demand	Anodyne	ADRB1	27	41
O=C1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CN1c1ccccc1F	ZINC000819327208	EF	On-Demand	Anodyne	ADRB3	44	44
O=C1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CN1c1ccccc1F	ZINC000819327208	EF	On-Demand	Anodyne	CYP3A4	45	35
O=C1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CN1c1ccccc1F	ZINC000819327209	EF	On-Demand	Anodyne	ADRB1	27	41
O=C1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CN1c1ccccc1F	ZINC000819327209	EF	On-Demand	Anodyne	ADRB3	44	44
O=C1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CN1c1ccccc1F	ZINC000819327209	EF	On-Demand	Anodyne	CYP3A4	45	35
O=C1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CN1c1ccccc1F	ZINC000819327210	EF	On-Demand	Anodyne	ADRB1	27	41
O=C1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CN1c1ccccc1F	ZINC000819327210	EF	On-Demand	Anodyne	ADRB3	44	44
O=C1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CN1c1ccccc1F	ZINC000819327210	EF	On-Demand	Anodyne	CYP3A4	45	35
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1c1ccccc1F	ZINC000819327211	EF	On-Demand	Anodyne	ADRB1	27	41
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1c1ccccc1F	ZINC000819327211	EF	On-Demand	Anodyne	ADRB3	44	44
O=C1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CN1c1ccccc1F	ZINC000819327211	EF	On-Demand	Anodyne	CYP3A4	45	35
O[C@H](CNCCCCF)c1cccnc1	ZINC000819327218	BD	On-Demand	Anodyne	ADRB2	37	51
O[C@H](CNCCCCF)c1cccnc1	ZINC000819327218	BD	On-Demand	Anodyne	ADRB1	49	49
O[C@H](CNCCCCF)c1cccnc1	ZINC000819327218	BD	On-Demand	Anodyne	ADRB3	126	51
O[C@@H](CNCCCCF)c1cccnc1	ZINC000819327219	BD	On-Demand	Anodyne	ADRB2	37	51
O[C@@H](CNCCCCF)c1cccnc1	ZINC000819327219	BD	On-Demand	Anodyne	ADRB1	49	49
O[C@@H](CNCCCCF)c1cccnc1	ZINC000819327219	BD	On-Demand	Anodyne	ADRB3	126	51
CC[C@@H](C)CONC[C@H](O)COc1cc(C)ccc1C	ZINC000819327251	CF	On-Demand	Anodyne	ADRB2	26	52
CC[C@@H](C)CONC[C@H](O)COc1cc(C)ccc1C	ZINC000819327251	CF	On-Demand	Anodyne	ADRB1	15	40
CC[C@@H](C)CONC[C@@H](O)COc1cc(C)ccc1C	ZINC000819327252	CF	On-Demand	Anodyne	ADRB2	26	52
CC[C@@H](C)CONC[C@@H](O)COc1cc(C)ccc1C	ZINC000819327252	CF	On-Demand	Anodyne	ADRB1	15	40
CC[C@H](C)CONC[C@@H](O)COc1cc(C)ccc1C	ZINC000819327253	CF	On-Demand	Anodyne	ADRB2	26	52
CC[C@H](C)CONC[C@@H](O)COc1cc(C)ccc1C	ZINC000819327253	CF	On-Demand	Anodyne	ADRB1	15	40
CC[C@H](C)CONC[C@H](O)COc1cc(C)ccc1C	ZINC000819327254	CF	On-Demand	Anodyne	ADRB2	26	52
CC[C@H](C)CONC[C@H](O)COc1cc(C)ccc1C	ZINC000819327254	CF	On-Demand	Anodyne	ADRB1	15	40
CC[C@H](C)CONC[C@@H](O)COc1ccc(C)cc1	ZINC000819327259	CE	On-Demand	Anodyne	ADRB2	37	61
CC[C@H](C)CONC[C@@H](O)COc1ccc(C)cc1	ZINC000819327259	CE	On-Demand	Anodyne	ADRB1	39	48
CC[C@H](C)CONC[C@@H](O)COc1ccc(C)cc1	ZINC000819327259	CE	On-Demand	Anodyne	ADRB3	19	45
CC[C@H](C)CONC[C@H](O)COc1ccc(C)cc1	ZINC000819327260	CE	On-Demand	Anodyne	ADRB2	37	61
CC[C@H](C)CONC[C@H](O)COc1ccc(C)cc1	ZINC000819327260	CE	On-Demand	Anodyne	ADRB1	39	48
CC[C@H](C)CONC[C@H](O)COc1ccc(C)cc1	ZINC000819327260	CE	On-Demand	Anodyne	ADRB3	19	45
CC[C@@H](C)CONC[C@H](O)COc1ccc(C)cc1	ZINC000819327261	CE	On-Demand	Anodyne	ADRB2	37	61
CC[C@@H](C)CONC[C@H](O)COc1ccc(C)cc1	ZINC000819327261	CE	On-Demand	Anodyne	ADRB1	39	48
CC[C@@H](C)CONC[C@H](O)COc1ccc(C)cc1	ZINC000819327261	CE	On-Demand	Anodyne	ADRB3	19	45
CC[C@@H](C)CONC[C@@H](O)COc1ccc(C)cc1	ZINC000819327262	CE	On-Demand	Anodyne	ADRB2	37	61
CC[C@@H](C)CONC[C@@H](O)COc1ccc(C)cc1	ZINC000819327262	CE	On-Demand	Anodyne	ADRB1	39	48
CC[C@@H](C)CONC[C@@H](O)COc1ccc(C)cc1	ZINC000819327262	CE	On-Demand	Anodyne	ADRB3	19	45
CC[C@@H](C)CONC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819327266	CE	On-Demand	Anodyne	ADRB2	35	51
CC[C@@H](C)CONC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819327266	CE	On-Demand	Anodyne	ADRB1	45	47
CC[C@@H](C)CONC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819327266	CE	On-Demand	Anodyne	ADRB3	23	42
CC[C@@H](C)CONC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819327267	CE	On-Demand	Anodyne	ADRB2	35	51
CC[C@@H](C)CONC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819327267	CE	On-Demand	Anodyne	ADRB1	45	47
CC[C@@H](C)CONC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819327267	CE	On-Demand	Anodyne	ADRB3	23	42
CC[C@H](C)CONC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819327268	CE	On-Demand	Anodyne	ADRB2	35	51
CC[C@H](C)CONC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819327268	CE	On-Demand	Anodyne	ADRB1	45	47
CC[C@H](C)CONC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819327268	CE	On-Demand	Anodyne	ADRB3	23	42
CC[C@H](C)CONC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819327269	CE	On-Demand	Anodyne	ADRB2	35	51
CC[C@H](C)CONC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819327269	CE	On-Demand	Anodyne	ADRB1	45	47
CC[C@H](C)CONC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819327269	CE	On-Demand	Anodyne	ADRB3	23	42
O=S(=O)(CCNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1	ZINC000819327274	GH	On-Demand	Anodyne	DRD2	17	48
O=S(=O)(CCNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1	ZINC000819327274	GH	On-Demand	Anodyne	LTA4H	15	44
CC[C@@H](C)CONC[C@H](O)COc1ccccc1F	ZINC000819327282	CE	On-Demand	Anodyne	ADRB2	30	49
CC[C@@H](C)CONC[C@H](O)COc1ccccc1F	ZINC000819327282	CE	On-Demand	Anodyne	ADRB1	42	37
CC[C@H](C)CONC[C@@H](O)COc1ccccc1F	ZINC000819327283	CE	On-Demand	Anodyne	ADRB2	30	49
CC[C@H](C)CONC[C@@H](O)COc1ccccc1F	ZINC000819327283	CE	On-Demand	Anodyne	ADRB1	42	37
CC[C@H](C)CONC[C@H](O)COc1ccccc1F	ZINC000819327284	CE	On-Demand	Anodyne	ADRB2	30	49
CC[C@H](C)CONC[C@H](O)COc1ccccc1F	ZINC000819327284	CE	On-Demand	Anodyne	ADRB1	42	37
CC[C@@H](C)CONC[C@@H](O)COc1ccccc1F	ZINC000819327285	CE	On-Demand	Anodyne	ADRB2	30	49
CC[C@@H](C)CONC[C@@H](O)COc1ccccc1F	ZINC000819327285	CE	On-Demand	Anodyne	ADRB1	42	37
CC[C@H](C)CONC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819327292	CD	On-Demand	Mild	ADRB2	25	45
CC[C@H](C)CONC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819327292	CD	On-Demand	Mild	ADRB1	27	45
CC[C@H](C)CONC[C@H](O)COc1ccc(C#N)cc1	ZINC000819327293	CD	On-Demand	Mild	ADRB2	25	45
CC[C@H](C)CONC[C@H](O)COc1ccc(C#N)cc1	ZINC000819327293	CD	On-Demand	Mild	ADRB1	27	45
CC[C@@H](C)CONC[C@H](O)COc1ccc(C#N)cc1	ZINC000819327294	CD	On-Demand	Mild	ADRB2	25	45
CC[C@@H](C)CONC[C@H](O)COc1ccc(C#N)cc1	ZINC000819327294	CD	On-Demand	Mild	ADRB1	27	45
CC[C@@H](C)CONC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819327295	CD	On-Demand	Mild	ADRB2	25	45
CC[C@@H](C)CONC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819327295	CD	On-Demand	Mild	ADRB1	27	45
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccccc3F)C2)cc1	ZINC000819327314	GE	On-Demand	Anodyne	ADRA1D	18	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccccc3F)C2)cc1	ZINC000819327314	GE	On-Demand	Anodyne	ADRB3	22	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3ccccc3F)C2)cc1	ZINC000819327315	GE	On-Demand	Anodyne	ADRA1D	18	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3ccccc3F)C2)cc1	ZINC000819327315	GE	On-Demand	Anodyne	ADRB3	22	41
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3ccccc3F)C2)cc1	ZINC000819327316	GE	On-Demand	Anodyne	ADRA1D	18	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3ccccc3F)C2)cc1	ZINC000819327316	GE	On-Demand	Anodyne	ADRB3	22	41
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3ccccc3F)C2)cc1	ZINC000819327317	GE	On-Demand	Anodyne	ADRA1D	18	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3ccccc3F)C2)cc1	ZINC000819327317	GE	On-Demand	Anodyne	ADRB3	22	41
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1F	ZINC000819327322	FI	On-Demand	Anodyne	DRD2	18	42
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1F	ZINC000819327322	FI	On-Demand	Anodyne	SLC6A3	15	45
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1F	ZINC000819327322	FI	On-Demand	Anodyne	LTA4H	15	44
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1F	ZINC000819327322	FI	On-Demand	Anodyne	SIGMAR1	15	44
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1F	ZINC000819327323	FI	On-Demand	Anodyne	DRD2	18	42
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1F	ZINC000819327323	FI	On-Demand	Anodyne	SLC6A3	15	45
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1F	ZINC000819327323	FI	On-Demand	Anodyne	LTA4H	15	44
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1F	ZINC000819327323	FI	On-Demand	Anodyne	SIGMAR1	15	44
CC[C@H](C)CONC[C@@H](O)COc1ccccc1C	ZINC000819327328	CE	On-Demand	Anodyne	ADRB2	34	63
CC[C@H](C)CONC[C@H](O)COc1ccccc1C	ZINC000819327329	CE	On-Demand	Anodyne	ADRB2	34	63
CC[C@@H](C)CONC[C@H](O)COc1ccccc1C	ZINC000819327330	CE	On-Demand	Anodyne	ADRB2	34	63
CC[C@@H](C)CONC[C@@H](O)COc1ccccc1C	ZINC000819327331	CE	On-Demand	Anodyne	ADRB2	34	63
Cc1ccoc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819327336	FG	On-Demand	Anodyne	CTSD	62	43
Cc1ccoc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819327336	FG	On-Demand	Anodyne	PGC	49	38
Cc1ccoc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819327336	FG	On-Demand	Anodyne	PAPA1_CARPA	32	44
Cc1ccoc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819327336	FG	On-Demand	Anodyne	TACR3	15	40
Cc1ccoc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819327336	FG	On-Demand	Anodyne	REN	71	46
Cc1ccoc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819327336	FG	On-Demand	Anodyne	REN1	17	45
Cc1ccoc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819327336	FG	On-Demand	Anodyne	BACE1	74	44
Cc1ccoc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819327336	FG	On-Demand	Anodyne	FPR1	48	41
CC(=O)Nc1cccc(CC(=O)NCCOC2CCC2)c1	ZINC000819327341	CD	On-Demand	Anodyne	ADRB1	15	40
CC(=O)Nc1cccc(CC(=O)NCCOC2CCC2)c1	ZINC000819327341	CD	On-Demand	Anodyne	TIMP3	56	32
CC(=O)Nc1cccc(CC(=O)NCCOC2CCC2)c1	ZINC000819327341	CD	On-Demand	Anodyne	MTNR1A	28	40
CON(C)C(=O)CCNC[C@H](OCc1ccccc1)c1ccc(Cl)cc1	ZINC000819327347	GH	On-Demand	Anodyne	UTS2	40	32
CON(C)C(=O)CCNC[C@@H](OCc1ccccc1)c1ccc(Cl)cc1	ZINC000819327348	GH	On-Demand	Anodyne	UTS2	40	32
CC[C@H](C)CONC[C@H](O)Cc1ccccc1	ZINC000819327349	BE	On-Demand	Anodyne	ADRB2	20	44
CC[C@H](C)CONC[C@H](O)Cc1ccccc1	ZINC000819327349	BE	On-Demand	Anodyne	PDS	46	32
CC[C@H](C)CONC[C@@H](O)Cc1ccccc1	ZINC000819327350	BE	On-Demand	Anodyne	ADRB2	20	44
CC[C@H](C)CONC[C@@H](O)Cc1ccccc1	ZINC000819327350	BE	On-Demand	Anodyne	PDS	46	32
CC[C@@H](C)CONC[C@@H](O)Cc1ccccc1	ZINC000819327351	BE	On-Demand	Anodyne	ADRB2	20	44
CC[C@@H](C)CONC[C@@H](O)Cc1ccccc1	ZINC000819327351	BE	On-Demand	Anodyne	PDS	46	32
CC[C@@H](C)CONC[C@H](O)Cc1ccccc1	ZINC000819327352	BE	On-Demand	Anodyne	ADRB2	20	44
CC[C@@H](C)CONC[C@H](O)Cc1ccccc1	ZINC000819327352	BE	On-Demand	Anodyne	PDS	46	32
CC[C@@H](C)CONC[C@H](O)COc1ccc(C)cc1C	ZINC000819327361	CF	On-Demand	Anodyne	ADRB2	23	52
CC[C@@H](C)CONC[C@@H](O)COc1ccc(C)cc1C	ZINC000819327362	CF	On-Demand	Anodyne	ADRB2	23	52
CC[C@H](C)CONC[C@@H](O)COc1ccc(C)cc1C	ZINC000819327363	CF	On-Demand	Anodyne	ADRB2	23	52
CC[C@H](C)CONC[C@H](O)COc1ccc(C)cc1C	ZINC000819327364	CF	On-Demand	Anodyne	ADRB2	23	52
O[C@@H](CNCC1(c2ccccc2Br)CCC1)c1cccnc1	ZINC000819327367	FH	On-Demand	Anodyne	ADRB3	81	42
O[C@H](CNCC1(c2ccccc2Br)CCC1)c1cccnc1	ZINC000819327368	FH	On-Demand	Anodyne	ADRB3	81	42
O[C@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1cccc(F)c1	ZINC000819327374	DF	On-Demand	Anodyne	SLC6A2	17	44
O[C@H](CN[C@H]1CCN(c2ccccc2F)C1)c1cccc(F)c1	ZINC000819327375	DF	On-Demand	Anodyne	SLC6A2	17	44
O[C@@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1cccc(F)c1	ZINC000819327376	DF	On-Demand	Anodyne	SLC6A2	17	44
O[C@@H](CN[C@H]1CCN(c2ccccc2F)C1)c1cccc(F)c1	ZINC000819327377	DF	On-Demand	Anodyne	SLC6A2	17	44
CC[C@@H](C)CONC[C@H](O)CN1CCc2ccccc2C1	ZINC000819327378	CD	On-Demand	Anodyne	NOD2	40	36
CC[C@@H](C)CONC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819327379	CD	On-Demand	Anodyne	NOD2	40	36
CC[C@H](C)CONC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819327380	CD	On-Demand	Anodyne	NOD2	40	36
CC[C@H](C)CONC[C@H](O)CN1CCc2ccccc2C1	ZINC000819327381	CD	On-Demand	Anodyne	NOD2	40	36
CC[C@@H](C)CONC[C@H](O)Cc1cccc(Cl)c1	ZINC000819327398	CF	On-Demand	Anodyne	PDS	53	38
CC[C@H](C)CONC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819327399	CF	On-Demand	Anodyne	PDS	53	38
CC[C@@H](C)CONC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819327400	CF	On-Demand	Anodyne	PDS	53	38
CC[C@H](C)CONC[C@H](O)Cc1cccc(Cl)c1	ZINC000819327401	CF	On-Demand	Anodyne	PDS	53	38
CC[C@@H](C)CONCCC(=O)Nc1ccccc1	ZINC000819327405	CF	On-Demand	Anodyne	LTA4H	27	44
CC[C@H](C)CONCCC(=O)Nc1ccccc1	ZINC000819327406	CF	On-Demand	Anodyne	LTA4H	27	44
CC[C@H](C)CONC[C@H](O)COc1ccc(Br)cc1	ZINC000819327416	EF	On-Demand	Anodyne	ADRB2	32	47
CC[C@H](C)CONC[C@H](O)COc1ccc(Br)cc1	ZINC000819327416	EF	On-Demand	Anodyne	ADRB1	35	47
CC[C@H](C)CONC[C@H](O)COc1ccc(Br)cc1	ZINC000819327416	EF	On-Demand	Anodyne	ADRB3	16	44
CC[C@@H](C)CONC[C@@H](O)COc1ccc(Br)cc1	ZINC000819327417	EF	On-Demand	Anodyne	ADRB2	32	47
CC[C@@H](C)CONC[C@@H](O)COc1ccc(Br)cc1	ZINC000819327417	EF	On-Demand	Anodyne	ADRB1	35	47
CC[C@@H](C)CONC[C@@H](O)COc1ccc(Br)cc1	ZINC000819327417	EF	On-Demand	Anodyne	ADRB3	16	44
CC[C@H](C)CONC[C@@H](O)COc1ccc(Br)cc1	ZINC000819327418	EF	On-Demand	Anodyne	ADRB2	32	47
CC[C@H](C)CONC[C@@H](O)COc1ccc(Br)cc1	ZINC000819327418	EF	On-Demand	Anodyne	ADRB1	35	47
CC[C@H](C)CONC[C@@H](O)COc1ccc(Br)cc1	ZINC000819327418	EF	On-Demand	Anodyne	ADRB3	16	44
CC[C@@H](C)CONC[C@H](O)COc1ccc(Br)cc1	ZINC000819327419	EF	On-Demand	Anodyne	ADRB2	32	47
CC[C@@H](C)CONC[C@H](O)COc1ccc(Br)cc1	ZINC000819327419	EF	On-Demand	Anodyne	ADRB1	35	47
CC[C@@H](C)CONC[C@H](O)COc1ccc(Br)cc1	ZINC000819327419	EF	On-Demand	Anodyne	ADRB3	16	44
O=C(/C=C\c1ccccc1Cl)NC(C1CC1)C1CC1	ZINC000819327420	CH	On-Demand	Anodyne	KCNQ2	43	50
O=C(/C=C\c1ccccc1Cl)NC(C1CC1)C1CC1	ZINC000819327420	CH	On-Demand	Anodyne	BOTA	27	40
O=C(/C=C/c1ccccc1Cl)NC(C1CC1)C1CC1	ZINC000819327421	CH	On-Demand	Anodyne	KCNQ2	43	50
O=C(/C=C/c1ccccc1Cl)NC(C1CC1)C1CC1	ZINC000819327421	CH	On-Demand	Anodyne	BOTA	27	40
O=C(O)[C@H]1CN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CCO1	ZINC000819327423	DD	On-Demand	Bother	DRD4	19	41
CC[C@@H](C)CONC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819327426	CD	On-Demand	Bother	ADRB2	23	44
CC[C@@H](C)CONC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819327426	CD	On-Demand	Bother	ADRB1	46	34
CC[C@@H](C)CONC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819327426	CD	On-Demand	Bother	COLA	42	31
CC[C@H](C)CONC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819327427	CD	On-Demand	Bother	ADRB2	23	44
CC[C@H](C)CONC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819327427	CD	On-Demand	Bother	ADRB1	46	34
CC[C@H](C)CONC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819327427	CD	On-Demand	Bother	COLA	42	31
O=C(O)[C@@H]1CN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CCO1	ZINC000819327428	DD	On-Demand	Bother	DRD4	19	41
CC[C@H](C)CONC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819327429	CD	On-Demand	Bother	ADRB2	23	44
CC[C@H](C)CONC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819327429	CD	On-Demand	Bother	ADRB1	46	34
CC[C@H](C)CONC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819327429	CD	On-Demand	Bother	COLA	42	31
O=C(O)[C@@H]1CN(C[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819327430	CD	On-Demand	Anodyne	CASR	41	37
O=C(O)[C@@H]1CN(C[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819327430	CD	On-Demand	Anodyne	CYP3A4	45	33
CC[C@@H](C)CONC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819327431	CD	On-Demand	Bother	ADRB2	23	44
CC[C@@H](C)CONC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819327431	CD	On-Demand	Bother	ADRB1	46	34
CC[C@@H](C)CONC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819327431	CD	On-Demand	Bother	COLA	42	31
O=C(O)[C@H]1CN(C[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819327432	CD	On-Demand	Anodyne	CASR	41	37
O=C(O)[C@H]1CN(C[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819327432	CD	On-Demand	Anodyne	CYP3A4	45	33
O=C(O)[C@@H]1CN(C[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819327434	CD	On-Demand	Anodyne	CASR	41	37
O=C(O)[C@@H]1CN(C[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819327434	CD	On-Demand	Anodyne	CYP3A4	45	33
O=C(O)[C@H]1CN(C[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819327437	CD	On-Demand	Anodyne	CASR	41	37
O=C(O)[C@H]1CN(C[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819327437	CD	On-Demand	Anodyne	CYP3A4	45	33
CCSc1cccc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819327444	GH	On-Demand	Anodyne	GPR119	39	52
CCSc1cccc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819327445	GH	On-Demand	Anodyne	GPR119	39	52
O=C(O)[C@H]1CN(Cc2ccc(-n3ccnc3)nc2)CCO1	ZINC000819327471	CC	On-Demand	Anodyne	NOS2	93	37
O=C(O)[C@@H]1CN(Cc2ccc(-n3ccnc3)nc2)CCO1	ZINC000819327472	CC	On-Demand	Anodyne	NOS2	93	37
O=C(O)[C@H]1CN(CC#Cc2ccc(C(F)(F)F)cc2)CCO1	ZINC000819327491	DD	On-Demand	Mild	LIPG	49	38
O=C(O)[C@@H]1CN(CC#Cc2ccc(C(F)(F)F)cc2)CCO1	ZINC000819327492	DD	On-Demand	Mild	LIPG	49	38
O=C(O)[C@H]1CN(CCc2ccc(F)c(F)c2)CCO1	ZINC000819327497	CD	On-Demand	Anodyne	ABCC1	107	39
O=C(O)[C@H]1CN(CCc2ccc(F)c(F)c2)CCO1	ZINC000819327497	CD	On-Demand	Anodyne	ABCB1A	55	39
O=C(O)[C@@H]1CN(CCc2ccc(F)c(F)c2)CCO1	ZINC000819327498	CD	On-Demand	Anodyne	ABCC1	107	39
O=C(O)[C@@H]1CN(CCc2ccc(F)c(F)c2)CCO1	ZINC000819327498	CD	On-Demand	Anodyne	ABCB1A	55	39
O=C(O)[C@@H]1CN(C[C@@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327517	DC	On-Demand	Anodyne	ADRB2	16	52
O=C(O)[C@@H]1CN(C[C@@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327517	DC	On-Demand	Anodyne	ADRB1	18	47
O=C(O)[C@@H]1CN(C[C@@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327517	DC	On-Demand	Anodyne	HTR1A	18	54
O=C(O)[C@@H]1CN(C[C@@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327517	DC	On-Demand	Anodyne	SLC6A4	21	47
O=C(O)[C@@H]1CN(C[C@@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327517	DC	On-Demand	Anodyne	ABCB1	77	43
O=C(O)[C@H]1CN(C[C@@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327518	DC	On-Demand	Anodyne	ADRB2	16	52
O=C(O)[C@H]1CN(C[C@@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327518	DC	On-Demand	Anodyne	ADRB1	18	47
O=C(O)[C@H]1CN(C[C@@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327518	DC	On-Demand	Anodyne	HTR1A	18	54
O=C(O)[C@H]1CN(C[C@@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327518	DC	On-Demand	Anodyne	SLC6A4	21	47
O=C(O)[C@H]1CN(C[C@@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327518	DC	On-Demand	Anodyne	ABCB1	77	43
O=C(O)[C@@H]1CN(C[C@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327519	DC	On-Demand	Anodyne	ADRB2	16	52
O=C(O)[C@@H]1CN(C[C@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327519	DC	On-Demand	Anodyne	ADRB1	18	47
O=C(O)[C@@H]1CN(C[C@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327519	DC	On-Demand	Anodyne	HTR1A	18	54
O=C(O)[C@@H]1CN(C[C@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327519	DC	On-Demand	Anodyne	SLC6A4	21	47
O=C(O)[C@@H]1CN(C[C@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327519	DC	On-Demand	Anodyne	ABCB1	77	43
O=C(O)[C@H]1CN(C[C@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327520	DC	On-Demand	Anodyne	ADRB2	16	52
O=C(O)[C@H]1CN(C[C@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327520	DC	On-Demand	Anodyne	ADRB1	18	47
O=C(O)[C@H]1CN(C[C@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327520	DC	On-Demand	Anodyne	HTR1A	18	54
O=C(O)[C@H]1CN(C[C@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327520	DC	On-Demand	Anodyne	SLC6A4	21	47
O=C(O)[C@H]1CN(C[C@H](O)COc2cccc3[nH]ccc23)CCO1	ZINC000819327520	DC	On-Demand	Anodyne	ABCB1	77	43
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1cccc(F)c1	ZINC000819327523	FI	On-Demand	Anodyne	DRD2	19	42
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1cccc(F)c1	ZINC000819327523	FI	On-Demand	Anodyne	SLC6A3	28	47
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1cccc(F)c1	ZINC000819327523	FI	On-Demand	Anodyne	CCR3	20	42
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1cccc(F)c1	ZINC000819327524	FI	On-Demand	Anodyne	DRD2	19	42
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1cccc(F)c1	ZINC000819327524	FI	On-Demand	Anodyne	SLC6A3	28	47
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1cccc(F)c1	ZINC000819327524	FI	On-Demand	Anodyne	CCR3	20	42
Cc1ccc2c(c1)[C@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)CCC2	ZINC000819327548	FG	On-Demand	Anodyne	ADRB3	17	41
Cc1ccc2c(c1)[C@H](NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)CCC2	ZINC000819327549	FG	On-Demand	Anodyne	ADRB3	17	41
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccccc1	ZINC000819327554	GH	On-Demand	Anodyne	ADRB2	46	45
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccccc1	ZINC000819327554	GH	On-Demand	Anodyne	ADRB1	65	46
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccccc1	ZINC000819327554	GH	On-Demand	Anodyne	DRD2	16	44
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccccc1	ZINC000819327554	GH	On-Demand	Anodyne	ADRB3	48	46
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccccc1	ZINC000819327554	GH	On-Demand	Anodyne	LTA4H	25	45
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccccc1	ZINC000819327554	GH	On-Demand	Anodyne	ABCB1	17	44
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccccc1	ZINC000819327555	GH	On-Demand	Anodyne	ADRB2	46	45
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccccc1	ZINC000819327555	GH	On-Demand	Anodyne	ADRB1	65	46
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccccc1	ZINC000819327555	GH	On-Demand	Anodyne	DRD2	16	44
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccccc1	ZINC000819327555	GH	On-Demand	Anodyne	ADRB3	48	46
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccccc1	ZINC000819327555	GH	On-Demand	Anodyne	LTA4H	25	45
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccccc1	ZINC000819327555	GH	On-Demand	Anodyne	ABCB1	17	44
CC[C@H](C)CONC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819327556	CD	On-Demand	Bother	ADRB2	18	45
CC[C@H](C)CONC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819327556	CD	On-Demand	Bother	ADRB1	20	44
CC[C@H](C)CONC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819327556	CD	On-Demand	Bother	CACNA1D	47	34
CC[C@H](C)CONC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819327556	CD	On-Demand	Bother	PDS	51	49
CC[C@@H](C)CONC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819327557	CD	On-Demand	Bother	ADRB2	18	45
CC[C@@H](C)CONC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819327557	CD	On-Demand	Bother	ADRB1	20	44
CC[C@@H](C)CONC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819327557	CD	On-Demand	Bother	CACNA1D	47	34
CC[C@@H](C)CONC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819327557	CD	On-Demand	Bother	PDS	51	49
CC[C@H](C)CONC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819327558	CD	On-Demand	Bother	ADRB2	18	45
CC[C@H](C)CONC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819327558	CD	On-Demand	Bother	ADRB1	20	44
CC[C@H](C)CONC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819327558	CD	On-Demand	Bother	CACNA1D	47	34
CC[C@H](C)CONC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819327558	CD	On-Demand	Bother	PDS	51	49
CC[C@@H](C)CONC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819327559	CD	On-Demand	Bother	ADRB2	18	45
CC[C@@H](C)CONC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819327559	CD	On-Demand	Bother	ADRB1	20	44
CC[C@@H](C)CONC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819327559	CD	On-Demand	Bother	CACNA1D	47	34
CC[C@@H](C)CONC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819327559	CD	On-Demand	Bother	PDS	51	49
CC[C@@H](C)CONC[C@H](O)COc1c(C)cccc1C	ZINC000819327566	CF	On-Demand	Anodyne	ADRB2	24	44
CC[C@@H](C)CONC[C@@H](O)COc1c(C)cccc1C	ZINC000819327567	CF	On-Demand	Anodyne	ADRB2	24	44
CC[C@H](C)CONC[C@@H](O)COc1c(C)cccc1C	ZINC000819327568	CF	On-Demand	Anodyne	ADRB2	24	44
CC[C@H](C)CONC[C@H](O)COc1c(C)cccc1C	ZINC000819327569	CF	On-Demand	Anodyne	ADRB2	24	44
CC[C@H](C)CONC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819327580	DD	On-Demand	Anodyne	ADRB1	16	40
CC[C@H](C)CONC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819327581	DD	On-Demand	Anodyne	ADRB1	16	40
CC[C@@H](C)CONC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819327582	DD	On-Demand	Anodyne	ADRB1	16	40
CC[C@@H](C)CONC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819327583	DD	On-Demand	Anodyne	ADRB1	16	40
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1	ZINC000819327622	FI	On-Demand	Anodyne	CHRM1	18	58
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1	ZINC000819327622	FI	On-Demand	Anodyne	DRD2	19	45
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1	ZINC000819327622	FI	On-Demand	Anodyne	SLC6A3	50	58
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1	ZINC000819327622	FI	On-Demand	Anodyne	LTA4H	15	44
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1	ZINC000819327622	FI	On-Demand	Anodyne	SIGMAR1	15	48
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1	ZINC000819327622	FI	On-Demand	Anodyne	CCR3	21	42
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1	ZINC000819327622	FI	On-Demand	Anodyne	SLC18A3	19	47
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819327633	ID	On-Demand	Anodyne	CA2	81	45
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819327633	ID	On-Demand	Anodyne	CA1	63	45
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819327633	ID	On-Demand	Anodyne	CA7	43	41
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819327633	ID	On-Demand	Anodyne	CA5B	48	36
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819327633	ID	On-Demand	Anodyne	CA4	65	43
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819327633	ID	On-Demand	Anodyne	CA5A	51	36
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819327633	ID	On-Demand	Anodyne	CA14	32	41
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819327633	ID	On-Demand	Anodyne	CA12	47	45
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819327633	ID	On-Demand	Anodyne	CA9	45	45
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819327633	ID	On-Demand	Anodyne	MTCA1	41	43
NS(=O)(=O)c1ccc(F)c(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819327633	ID	On-Demand	Anodyne	P96878_MYCTU	44	43
O=C(C#Cc1ccccc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327638	FF	On-Demand	Mild	TBXA2R	43	37
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)N1CCC[C@@H](O)CC1	ZINC000819327643	GD	On-Demand	Anodyne	PREP	23	52
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCC(=O)N1CCC[C@H](O)CC1	ZINC000819327644	GD	On-Demand	Anodyne	PREP	23	52
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)N1CCC[C@@H](O)CC1	ZINC000819327645	GD	On-Demand	Anodyne	PREP	23	52
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCC(=O)N1CCC[C@H](O)CC1	ZINC000819327646	GD	On-Demand	Anodyne	PREP	23	52
O=CNc1ccc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000819327647	GF	On-Demand	Anodyne	CA2	15	42
O=C(/C=C/c1cccc(F)c1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327660	GG	On-Demand	Anodyne	HDAC9	21	41
O=C(/C=C/c1cccc(F)c1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327660	GG	On-Demand	Anodyne	HDAC7	32	41
O=C(/C=C\c1cccc(F)c1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327661	GG	On-Demand	Anodyne	HDAC9	21	41
O=C(/C=C\c1cccc(F)c1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327661	GG	On-Demand	Anodyne	HDAC7	32	41
C=CC(=O)NCc1ccc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000819327671	HF	On-Demand	Anodyne	TGM2	29	49
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819327673	IG	On-Demand	Anodyne	APP	49	36
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819327673	IG	On-Demand	Anodyne	CACNA1I	56	33
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819327673	IG	On-Demand	Anodyne	GPR119	52	44
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819327673	IG	On-Demand	Anodyne	SFRP1	26	40
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819327674	IG	On-Demand	Anodyne	APP	49	36
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819327674	IG	On-Demand	Anodyne	CACNA1I	56	33
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819327674	IG	On-Demand	Anodyne	GPR119	52	44
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819327674	IG	On-Demand	Anodyne	SFRP1	26	40
O=C(/C=C/c1cncc(F)c1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327689	GF	On-Demand	Anodyne	HDAC7	21	40
O=C(/C=C\c1cncc(F)c1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327690	GF	On-Demand	Anodyne	HDAC7	21	40
CC(C)(C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1)C1CCCCC1	ZINC000819327691	GI	On-Demand	Anodyne	MMP2	48	34
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H]1C[C@H]1c1ccccc1	ZINC000819327692	GG	On-Demand	Anodyne	NAMPT	24	49
C[C@@H](Cc1ccc(F)cc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327708	GH	On-Demand	Anodyne	AVPR1A	28	41
C[C@@H](Cc1ccc(F)cc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327708	GH	On-Demand	Anodyne	MME	21	44
C[C@@H](Cc1ccc(F)cc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327708	GH	On-Demand	Anodyne	TBXA2R	39	41
C[C@@H](Cc1ccc(F)cc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327708	GH	On-Demand	Anodyne	TRPV1	49	35
C[C@@H](Cc1ccc(F)cc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327708	GH	On-Demand	Anodyne	GRIA1	46	35
C[C@@H](Cc1ccc(F)cc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327708	GH	On-Demand	Anodyne	LEF	86	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccc(-n2ccnc2)nc1	ZINC000819327712	HF	On-Demand	Anodyne	TBXAS1	39	49
CC(C)(C)OC(=O)N1CC[C@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819327716	IF	On-Demand	Anodyne	APP	54	38
CC(C)(C)OC(=O)N1CC[C@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819327716	IF	On-Demand	Anodyne	EPHX2	28	45
CC(C)(C)OC(=O)N1CC[C@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819327716	IF	On-Demand	Anodyne	GPR119	52	45
CC(C)(C)OC(=O)N1CC[C@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819327716	IF	On-Demand	Anodyne	SFRP1	45	42
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819327717	IF	On-Demand	Anodyne	APP	54	38
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819327717	IF	On-Demand	Anodyne	EPHX2	28	45
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819327717	IF	On-Demand	Anodyne	GPR119	52	45
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819327717	IF	On-Demand	Anodyne	SFRP1	45	42
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1	ZINC000819327723	FI	On-Demand	Anodyne	CHRM1	18	58
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1	ZINC000819327723	FI	On-Demand	Anodyne	DRD2	19	45
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1	ZINC000819327723	FI	On-Demand	Anodyne	SLC6A3	50	58
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1	ZINC000819327723	FI	On-Demand	Anodyne	LTA4H	15	44
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1	ZINC000819327723	FI	On-Demand	Anodyne	SIGMAR1	15	48
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1	ZINC000819327723	FI	On-Demand	Anodyne	CCR3	21	42
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccc(F)cc1	ZINC000819327723	FI	On-Demand	Anodyne	SLC18A3	19	47
CC[C@H](C)CONC[C@@H](O)COCc1ccccc1	ZINC000819327756	CE	On-Demand	Anodyne	ADRB2	17	48
CC[C@@H](C)CONC[C@H](O)COCc1ccccc1	ZINC000819327757	CE	On-Demand	Anodyne	ADRB2	17	48
CC[C@@H](C)CONC[C@@H](O)COCc1ccccc1	ZINC000819327758	CE	On-Demand	Anodyne	ADRB2	17	48
CC[C@H](C)CONC[C@H](O)COCc1ccccc1	ZINC000819327759	CE	On-Demand	Anodyne	ADRB2	17	48
COC[C@@H](O)CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1	ZINC000819327789	DE	On-Demand	Anodyne	DRD2	23	49
COC[C@@H](O)CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1	ZINC000819327789	DE	On-Demand	Anodyne	SLC6A3	23	46
COC[C@@H](O)CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1	ZINC000819327789	DE	On-Demand	Anodyne	LTA4H	15	43
CC[C@@H](C)CONCCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000819327805	CE	On-Demand	Bother	COLA	85	36
CC[C@H](C)CONCCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000819327806	CE	On-Demand	Bother	COLA	85	36
O[C@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1ccc(F)cc1	ZINC000819327809	DF	On-Demand	Anodyne	SLC6A3	18	48
O[C@H](CN[C@H]1CCN(c2ccccc2F)C1)c1ccc(F)cc1	ZINC000819327810	DF	On-Demand	Anodyne	SLC6A3	18	48
O[C@@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1ccc(F)cc1	ZINC000819327811	DF	On-Demand	Anodyne	SLC6A3	18	48
O[C@@H](CN[C@H]1CCN(c2ccccc2F)C1)c1ccc(F)cc1	ZINC000819327812	DF	On-Demand	Anodyne	SLC6A3	18	48
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819327825	IG	On-Demand	Anodyne	F2	54	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819327825	IG	On-Demand	Anodyne	FKBP1A	45	50
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819327825	IG	On-Demand	Anodyne	TRY1_BOVIN	51	35
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819327825	IG	On-Demand	Anodyne	PREP	50	45
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819327825	IG	On-Demand	Anodyne	SFRP1	55	39
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819327825	IG	On-Demand	Anodyne	WNT3	56	39
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000819327825	IG	On-Demand	Anodyne	TMPRSS11D	67	38
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819327826	IG	On-Demand	Anodyne	F2	54	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819327826	IG	On-Demand	Anodyne	FKBP1A	45	50
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819327826	IG	On-Demand	Anodyne	TRY1_BOVIN	51	35
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819327826	IG	On-Demand	Anodyne	PREP	50	45
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819327826	IG	On-Demand	Anodyne	SFRP1	55	39
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819327826	IG	On-Demand	Anodyne	WNT3	56	39
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000819327826	IG	On-Demand	Anodyne	TMPRSS11D	67	38
O=C(Cc1cccnc1Br)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327832	IG	On-Demand	Anodyne	NAMPT	18	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000819327838	IF	On-Demand	Anodyne	P2RX7	15	42
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000819327839	IF	On-Demand	Anodyne	P2RX7	15	42
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H](F)c1ccccc1	ZINC000819327840	FG	On-Demand	Anodyne	LEF	32	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H](F)c1ccccc1	ZINC000819327841	FG	On-Demand	Anodyne	LEF	32	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)C1(O)CCOCC1	ZINC000819327842	FD	On-Demand	Anodyne	MMP13	23	49
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)C1(O)CCOCC1	ZINC000819327842	FD	On-Demand	Anodyne	MMP2	21	49
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)C1(O)CCOCC1	ZINC000819327842	FD	On-Demand	Anodyne	MMP14	17	49
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)C1(O)CCOCC1	ZINC000819327842	FD	On-Demand	Anodyne	MMP10	16	49
O=C(/C=C/c1ccc2ccccc2n1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327844	HH	On-Demand	Anodyne	UL80	22	40
O=C(/C=C\c1ccc2ccccc2n1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327845	HH	On-Demand	Anodyne	UL80	22	40
Cn1cc(-c2cccc(C(=O)NCCCS(=O)(=O)c3ccc(Cl)cc3)c2)cn1	ZINC000819327848	HG	On-Demand	Anodyne	DRD4	46	38
Cn1cc(-c2cccc(C(=O)NCCCS(=O)(=O)c3ccc(Cl)cc3)c2)cn1	ZINC000819327848	HG	On-Demand	Anodyne	DRD3	21	41
Cn1cc(-c2cccc(C(=O)NCCCS(=O)(=O)c3ccc(Cl)cc3)c2)cn1	ZINC000819327848	HG	On-Demand	Anodyne	MAPK10	17	40
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327852	ID	On-Demand	Anodyne	VHL	48	33
O=C(CCCn1cncn1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327856	FD	On-Demand	Anodyne	HIS3	45	36
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccc(-n2ccnc2S)cc1	ZINC000819327859	IG	On-Demand	Anodyne	TBXAS1	19	47
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cccc(Cl)c1[N+](=O)[O-]	ZINC000819327866	HG	On-Demand	Bother	SLC6A5	18	41
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cnc(Cl)c(Cl)c1	ZINC000819327869	HH	On-Demand	Anodyne	CXCR3	19	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cnc(Cl)c(Cl)c1	ZINC000819327869	HH	On-Demand	Anodyne	NAMPT	19	41
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)C1CCCCCCC1	ZINC000819327870	FH	On-Demand	Anodyne	EPHX2	20	41
CC(C)(C)OC(=O)N1CC([C@H](F)C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819327878	IF	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CC([C@@H](F)C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819327879	IF	On-Demand	Anodyne	GPR119	34	41
O=C(C[C@H]1CCCOC1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327885	FE	On-Demand	Anodyne	MMP2	41	34
O=C(C[C@@H]1CCCOC1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327886	FE	On-Demand	Anodyne	MMP2	41	34
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc(Cl)c(Cl)[nH]1	ZINC000819327889	GH	On-Demand	Anodyne	ALPL	50	40
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@H]1CCN(c2ccccc2F)C1	ZINC000819327895	GD	On-Demand	Anodyne	SFRP1	91	35
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@H]1CCN(c2ccccc2F)C1	ZINC000819327895	GD	On-Demand	Anodyne	WNT3	62	34
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@@H]1CCN(c2ccccc2F)C1	ZINC000819327896	GD	On-Demand	Anodyne	SFRP1	91	35
CC(C)(C)OC(=O)CS(=O)(=O)CCN[C@@H]1CCN(c2ccccc2F)C1	ZINC000819327896	GD	On-Demand	Anodyne	WNT3	62	34
CC[C@H](C)CONC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819327908	CE	On-Demand	Mild	ADRB2	33	48
CC[C@H](C)CONC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819327908	CE	On-Demand	Mild	ADRB1	40	48
CC[C@H](C)CONC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819327908	CE	On-Demand	Mild	ADRB3	24	45
CC[C@@H](C)CONC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819327910	CE	On-Demand	Mild	ADRB2	33	48
CC[C@@H](C)CONC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819327910	CE	On-Demand	Mild	ADRB1	40	48
CC[C@@H](C)CONC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819327910	CE	On-Demand	Mild	ADRB3	24	45
CC[C@@H](C)CONC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819327912	CE	On-Demand	Mild	ADRB2	33	48
CC[C@@H](C)CONC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819327912	CE	On-Demand	Mild	ADRB1	40	48
CC[C@@H](C)CONC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819327912	CE	On-Demand	Mild	ADRB3	24	45
CC[C@H](C)CONC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819327914	CE	On-Demand	Mild	ADRB2	33	48
CC[C@H](C)CONC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819327914	CE	On-Demand	Mild	ADRB1	40	48
CC[C@H](C)CONC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819327914	CE	On-Demand	Mild	ADRB3	24	45
COc1cccc([S@@](=O)CC(=O)NCCOC2CCC2)c1	ZINC000819327916	DD	On-Demand	Anodyne	DRD4	40	31
COc1cccc([S@@](=O)CC(=O)NCCOC2CCC2)c1	ZINC000819327916	DD	On-Demand	Anodyne	MTNR1A	60	41
COc1cccc([S@@](=O)CC(=O)NCCOC2CCC2)c1	ZINC000819327916	DD	On-Demand	Anodyne	MTNR1B	55	41
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H](F)CC1CCCCC1	ZINC000819327927	GH	On-Demand	Anodyne	MMP2	73	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H](F)CC1CCCCC1	ZINC000819327927	GH	On-Demand	Anodyne	MMP3	23	45
C[C@@H]1CCCC[C@H]1C(=O)Nc1cccc(Cl)c1C(N)=O	ZINC000819327932	CG	On-Demand	Anodyne	TYK2	29	41
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H](F)CC1CCCCC1	ZINC000819327936	GH	On-Demand	Anodyne	MMP2	73	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H](F)CC1CCCCC1	ZINC000819327936	GH	On-Demand	Anodyne	MMP3	23	45
O=C(/C=C/c1ccc2ccc(Cl)cc2n1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327940	IJ	On-Demand	Anodyne	UL80	20	44
O=C(/C=C/c1ccc2ccc(Cl)cc2n1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327940	IJ	On-Demand	Anodyne	HDAC9	15	41
O=C(/C=C/c1ccc2ccc(Cl)cc2n1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327940	IJ	On-Demand	Anodyne	HDAC7	22	41
C[C@@H]1CCCC[C@@H]1C(=O)Nc1cccc(Cl)c1C(N)=O	ZINC000819327942	CG	On-Demand	Anodyne	TYK2	29	41
O=C(/C=C\c1ccc2ccc(Cl)cc2n1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327945	IJ	On-Demand	Anodyne	UL80	20	44
O=C(/C=C\c1ccc2ccc(Cl)cc2n1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327945	IJ	On-Demand	Anodyne	HDAC9	15	41
O=C(/C=C\c1ccc2ccc(Cl)cc2n1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327945	IJ	On-Demand	Anodyne	HDAC7	22	41
Cc1cc(CNC[C@H](O)c2ccccc2)nc(N2CCCC2)n1	ZINC000819327946	DE	On-Demand	Anodyne	SORD	30	42
Cc1cc(CNC[C@@H](O)c2ccccc2)nc(N2CCCC2)n1	ZINC000819327948	DE	On-Demand	Anodyne	SORD	30	42
CN(C[C@@H](O)CNCc1cc2ccccc2n(C)c1=O)C(=O)OC(C)(C)C	ZINC000819327958	GD	On-Demand	Anodyne	NPSR1	30	41
CN(C[C@H](O)CNCc1cc2ccccc2n(C)c1=O)C(=O)OC(C)(C)C	ZINC000819327961	GD	On-Demand	Anodyne	NPSR1	30	41
O=C(CCNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)Nc1ccccc1	ZINC000819327963	GI	On-Demand	Anodyne	DRD2	22	49
O=C(CCNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)Nc1ccccc1	ZINC000819327963	GI	On-Demand	Anodyne	KCNH2	21	40
O=C(CCNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)Nc1ccccc1	ZINC000819327963	GI	On-Demand	Anodyne	LTA4H	36	50
O=C(CCNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)Nc1ccccc1	ZINC000819327963	GI	On-Demand	Anodyne	SIGMAR1	17	47
O=C(CCNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)Nc1ccccc1	ZINC000819327963	GI	On-Demand	Anodyne	CCR3	25	41
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327979	HF	On-Demand	Anodyne	PAPA1_CARPA	39	40
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327979	HF	On-Demand	Anodyne	CTSK	19	40
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819327979	HF	On-Demand	Anodyne	FPR1	36	42
CC[C@@H](C)CONC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819327984	DD	On-Demand	Anodyne	ADRB2	48	65
CC[C@@H](C)CONC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819327984	DD	On-Demand	Anodyne	ADRB1	74	65
CC[C@@H](C)CONC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819327984	DD	On-Demand	Anodyne	ADRB3	46	53
CC[C@@H](C)CONC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819327989	DD	On-Demand	Anodyne	ADRB2	48	65
CC[C@@H](C)CONC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819327989	DD	On-Demand	Anodyne	ADRB1	74	65
CC[C@@H](C)CONC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819327989	DD	On-Demand	Anodyne	ADRB3	46	53
CC[C@H](C)CONC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819327990	DD	On-Demand	Anodyne	ADRB2	48	65
CC[C@H](C)CONC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819327990	DD	On-Demand	Anodyne	ADRB1	74	65
CC[C@H](C)CONC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819327990	DD	On-Demand	Anodyne	ADRB3	46	53
CC[C@H](C)CONC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819327992	DD	On-Demand	Anodyne	ADRB2	48	65
CC[C@H](C)CONC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819327992	DD	On-Demand	Anodyne	ADRB1	74	65
CC[C@H](C)CONC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819327992	DD	On-Demand	Anodyne	ADRB3	46	53
O=C(CCCCN1CCCC1)N1CCC[C@H](O)CC1	ZINC000819328000	CD	On-Demand	Anodyne	PREP	24	45
O=C(CCCCN1CCCC1)N1CCC[C@@H](O)CC1	ZINC000819328004	CD	On-Demand	Anodyne	PREP	24	45
O=C(/C=C/c1cccs1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328012	FG	On-Demand	Anodyne	HDAC9	25	40
O=C(/C=C/c1cccs1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328012	FG	On-Demand	Anodyne	HDAC7	29	40
CCSc1cccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819328015	EH	On-Demand	Bother	CACNA1D	49	32
O=C(/C=C\c1cccs1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328017	FG	On-Demand	Anodyne	HDAC9	25	40
O=C(/C=C\c1cccs1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328017	FG	On-Demand	Anodyne	HDAC7	29	40
CCSc1cccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819328019	EH	On-Demand	Bother	CACNA1D	49	32
CC[C@H](C)CONC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819328025	CE	On-Demand	Bother	CACNA1D	62	35
CC[C@H](C)CONC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819328027	CE	On-Demand	Bother	CACNA1D	62	35
CC[C@@H](C)CONC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819328028	CE	On-Demand	Bother	CACNA1D	62	35
CC[C@@H](C)CONC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819328030	CE	On-Demand	Bother	CACNA1D	62	35
C=CCN(c1ccc(OC)cc1)S(=O)(=O)c1ccc(Cl)c(C(=O)NC(C2CC2)C2CC2)c1	ZINC000819328050	JJ	On-Demand	Mild	BMP1	51	36
CS(=O)(=O)[C@@H]1CCCC[C@H]1NC[C@H](O)c1cccnc1	ZINC000819328067	CD	On-Demand	Anodyne	ADRB2	26	40
CS(=O)(=O)[C@@H]1CCCC[C@H]1NC[C@H](O)c1cccnc1	ZINC000819328067	CD	On-Demand	Anodyne	ADRB1	32	44
CS(=O)(=O)[C@@H]1CCCC[C@H]1NC[C@H](O)c1cccnc1	ZINC000819328067	CD	On-Demand	Anodyne	ADRB3	103	48
CS(=O)(=O)[C@@H]1CCCC[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819328068	CD	On-Demand	Anodyne	ADRB2	26	40
CS(=O)(=O)[C@@H]1CCCC[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819328068	CD	On-Demand	Anodyne	ADRB1	32	44
CS(=O)(=O)[C@@H]1CCCC[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819328068	CD	On-Demand	Anodyne	ADRB3	103	48
CC[C@@H](C)CONC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819328089	CE	On-Demand	Anodyne	ADRB2	26	68
CC[C@@H](C)CONC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819328089	CE	On-Demand	Anodyne	ADRB1	29	68
CC[C@@H](C)CONC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819328090	CE	On-Demand	Anodyne	ADRB2	26	68
CC[C@@H](C)CONC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819328090	CE	On-Demand	Anodyne	ADRB1	29	68
CC[C@H](C)CONC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819328092	CE	On-Demand	Anodyne	ADRB2	26	68
CC[C@H](C)CONC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819328092	CE	On-Demand	Anodyne	ADRB1	29	68
CC[C@H](C)CONC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819328094	CE	On-Demand	Anodyne	ADRB2	26	68
CC[C@H](C)CONC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819328094	CE	On-Demand	Anodyne	ADRB1	29	68
O[C@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819328096	FH	On-Demand	Anodyne	LIPG	51	37
O[C@H](CN[C@H]1CCN(c2ccccc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819328098	FH	On-Demand	Anodyne	LIPG	51	37
O[C@@H](CNCc1ccc(C2CCCCC2)cc1)c1cccnc1	ZINC000819328119	DH	On-Demand	Anodyne	ADRB2	25	42
O[C@@H](CNCc1ccc(C2CCCCC2)cc1)c1cccnc1	ZINC000819328119	DH	On-Demand	Anodyne	ADRB1	29	48
O[C@@H](CNCc1ccc(C2CCCCC2)cc1)c1cccnc1	ZINC000819328119	DH	On-Demand	Anodyne	ADRB3	105	54
O[C@H](CNCc1ccc(C2CCCCC2)cc1)c1cccnc1	ZINC000819328120	DH	On-Demand	Anodyne	ADRB2	25	42
O[C@H](CNCc1ccc(C2CCCCC2)cc1)c1cccnc1	ZINC000819328120	DH	On-Demand	Anodyne	ADRB1	29	48
O[C@H](CNCc1ccc(C2CCCCC2)cc1)c1cccnc1	ZINC000819328120	DH	On-Demand	Anodyne	ADRB3	105	54
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cccc(N2CCOC2=O)c1	ZINC000819328127	HF	On-Demand	Anodyne	DRD4	43	38
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cccc(N2CCOC2=O)c1	ZINC000819328127	HF	On-Demand	Anodyne	DRD3	16	41
O=C(CSc1nc2ccccc2s1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328130	II	On-Demand	Anodyne	ST14	46	33
O=C(CSc1nc2ccccc2s1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328130	II	On-Demand	Anodyne	TMPRSS6	63	33
CCOC(=O)N1CCC[C@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819328132	HE	On-Demand	Anodyne	APP	65	40
CCOC(=O)N1CCC[C@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819328132	HE	On-Demand	Anodyne	DPP7	45	38
CCOC(=O)N1CCC[C@@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819328133	HE	On-Demand	Anodyne	APP	65	40
CCOC(=O)N1CCC[C@@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819328133	HE	On-Demand	Anodyne	DPP7	45	38
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccnc(Br)c1	ZINC000819328135	HG	On-Demand	Anodyne	KDM4E	22	40
CCC(=O)Nc1ccccc1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328138	HG	On-Demand	Anodyne	SLC6A5	21	42
O=C(/C=C/c1ccccc1F)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328144	GG	On-Demand	Anodyne	HDAC9	27	48
O=C(/C=C/c1ccccc1F)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328144	GG	On-Demand	Anodyne	HDAC7	31	48
O=C(/C=C\c1ccccc1F)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328145	GG	On-Demand	Anodyne	HDAC9	27	48
O=C(/C=C\c1ccccc1F)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328145	GG	On-Demand	Anodyne	HDAC7	31	48
O=C(/C=C/c1ccc(O)cc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328148	GG	On-Demand	Anodyne	HDAC2	15	42
O=C(/C=C/c1ccc(O)cc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328148	GG	On-Demand	Anodyne	HDAC9	33	42
O=C(/C=C/c1ccc(O)cc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328148	GG	On-Demand	Anodyne	HDAC7	41	42
O=C(/C=C\c1ccc(O)cc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328149	GG	On-Demand	Anodyne	HDAC2	15	42
O=C(/C=C\c1ccc(O)cc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328149	GG	On-Demand	Anodyne	HDAC9	33	42
O=C(/C=C\c1ccc(O)cc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328149	GG	On-Demand	Anodyne	HDAC7	41	42
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)C(F)F	ZINC000819328155	DD	On-Demand	Anodyne	LEF	40	34
C[C@H](NC(=O)OC(C)(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328168	HF	On-Demand	Anodyne	FPR1	35	41
N#CCc1ccccc1CC(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328182	GF	On-Demand	Mild	CA9	20	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cccc(Cl)c1O	ZINC000819328187	GG	On-Demand	Anodyne	SLC6A5	21	44
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328196	IG	On-Demand	Anodyne	F2	34	41
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328196	IG	On-Demand	Anodyne	FKBP1A	45	42
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328196	IG	On-Demand	Anodyne	SFRP1	35	40
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328196	IG	On-Demand	Anodyne	WNT3	54	40
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328197	IG	On-Demand	Anodyne	F2	34	41
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328197	IG	On-Demand	Anodyne	FKBP1A	45	42
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328197	IG	On-Demand	Anodyne	SFRP1	35	40
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328197	IG	On-Demand	Anodyne	WNT3	54	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	CA2	17	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	OPRM1	24	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	OPRD1	26	49
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	CELA1	15	52
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	MME	27	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	CASP3	18	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	BMP1	31	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	CA1	15	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	KLK3	89	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	CTSB	81	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	PAPA1_CARPA	81	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	CYSP_TRYCR	57	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	CTSK	41	52
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	CTSL	52	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	PGA	23	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	CAPNS1	74	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	MMP3	30	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	MMP8	22	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	HLA-DRB1	66	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	MMP11	44	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	CTSS	22	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	CAPN1	103	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	MMP9	16	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	CASP1	34	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	CAPN2	150	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	TPSAB1	37	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	NPR	87	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328200	IF	On-Demand	Anodyne	PSMB5	59	41
N#C/C(=C\c1ccc(O)cc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328213	HF	On-Demand	Reactive	CA12	18	50
N#C/C(=C/c1ccc(O)cc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328214	HF	On-Demand	Reactive	CA12	18	50
O[C@H](CN[C@@H]1C[C@@H](c2ccc(F)cc2)C1)c1cccnc1	ZINC000819328225	CF	On-Demand	Anodyne	ADRB3	62	45
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(F)cc2)C1)c1cccnc1	ZINC000819328226	CF	On-Demand	Anodyne	ADRB3	62	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCc3cnc(C(C)C)nc3C1)C2	ZINC000819328246	FE	On-Demand	Anodyne	MAPK1	43	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCc3cnc(C(C)C)nc3C1)C2	ZINC000819328247	FE	On-Demand	Anodyne	MAPK1	43	34
O[C@@H](CNOCC1CC1)COc1ccc2ccccc2c1	ZINC000819328248	CF	On-Demand	Anodyne	ADRB2	40	57
O[C@@H](CNOCC1CC1)COc1ccc2ccccc2c1	ZINC000819328248	CF	On-Demand	Anodyne	ADRB1	44	47
O[C@@H](CNOCC1CC1)COc1ccc2ccccc2c1	ZINC000819328248	CF	On-Demand	Anodyne	CASR	40	37
O[C@H](CNOCC1CC1)COc1ccc2ccccc2c1	ZINC000819328250	CF	On-Demand	Anodyne	ADRB2	40	57
O[C@H](CNOCC1CC1)COc1ccc2ccccc2c1	ZINC000819328250	CF	On-Demand	Anodyne	ADRB1	44	47
O[C@H](CNOCC1CC1)COc1ccc2ccccc2c1	ZINC000819328250	CF	On-Demand	Anodyne	CASR	40	37
O[C@@H](CNOCC1CC1)COC(c1ccccc1)c1ccccc1	ZINC000819328252	EG	On-Demand	Anodyne	SLC6A3	30	42
O[C@H](CNOCC1CC1)COC(c1ccccc1)c1ccccc1	ZINC000819328254	EG	On-Demand	Anodyne	SLC6A3	30	42
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(C(F)(F)F)cc1	ZINC000819328259	GH	On-Demand	Anodyne	ADRB2	23	44
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(C(F)(F)F)cc1	ZINC000819328259	GH	On-Demand	Anodyne	ADRB3	39	44
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(C(F)(F)F)cc1	ZINC000819328260	GH	On-Demand	Anodyne	ADRB2	23	44
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(C(F)(F)F)cc1	ZINC000819328260	GH	On-Demand	Anodyne	ADRB3	39	44
O[C@H](CNOCC1CC1)COc1ccccc1C(F)(F)F	ZINC000819328261	DE	On-Demand	Anodyne	ADRB2	23	42
O[C@H](CNOCC1CC1)COc1ccccc1C(F)(F)F	ZINC000819328261	DE	On-Demand	Anodyne	ADRB1	57	35
O[C@@H](CNOCC1CC1)COc1ccccc1C(F)(F)F	ZINC000819328262	DE	On-Demand	Anodyne	ADRB2	23	42
O[C@@H](CNOCC1CC1)COc1ccccc1C(F)(F)F	ZINC000819328262	DE	On-Demand	Anodyne	ADRB1	57	35
Cc1cc(CNC[C@H](O)c2cccnc2)nc(N2CCCC2)n1	ZINC000819328266	DD	On-Demand	Anodyne	ADRB3	86	48
Cc1cc(CNC[C@@H](O)c2cccnc2)nc(N2CCCC2)n1	ZINC000819328269	DD	On-Demand	Anodyne	ADRB3	86	48
CC(C)(C)OC(=O)NCC[C@@H](O)CNCC(C)(C)C(C)(C)C	ZINC000819328298	DF	On-Demand	Anodyne	CTSK	15	41
CC(C)(C)OC(=O)NCC[C@H](O)CNCC(C)(C)C(C)(C)C	ZINC000819328301	DF	On-Demand	Anodyne	CTSK	15	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cccc(C(F)(F)F)n2)c1	ZINC000819328309	FF	On-Demand	Bother	ADRB3	73	38
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cccc(C(F)(F)F)n2)c1	ZINC000819328311	FF	On-Demand	Bother	ADRB3	73	38
O[C@@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819328348	FH	On-Demand	Anodyne	LIPG	51	37
O[C@@H](CN[C@H]1CCN(c2ccccc2F)C1)c1cccc(C(F)(F)F)c1	ZINC000819328351	FH	On-Demand	Anodyne	LIPG	51	37
COC(=O)c1ccc(OC[C@H](O)CNOCC2CC2)cc1	ZINC000819328352	CD	On-Demand	Anodyne	ADRB2	39	50
COC(=O)c1ccc(OC[C@H](O)CNOCC2CC2)cc1	ZINC000819328352	CD	On-Demand	Anodyne	ADRB1	61	52
COC(=O)c1ccc(OC[C@H](O)CNOCC2CC2)cc1	ZINC000819328352	CD	On-Demand	Anodyne	ADRB3	39	43
COC(=O)c1ccc(OC[C@@H](O)CNOCC2CC2)cc1	ZINC000819328358	CD	On-Demand	Anodyne	ADRB2	39	50
COC(=O)c1ccc(OC[C@@H](O)CNOCC2CC2)cc1	ZINC000819328358	CD	On-Demand	Anodyne	ADRB1	61	52
COC(=O)c1ccc(OC[C@@H](O)CNOCC2CC2)cc1	ZINC000819328358	CD	On-Demand	Anodyne	ADRB3	39	43
CCSc1cccc(CNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819328384	FG	On-Demand	Anodyne	ADRB3	33	40
N#CCc1ccc(OC[C@@H](O)CNOCC2CC2)cc1	ZINC000819328386	CD	On-Demand	Mild	ADRB2	29	52
N#CCc1ccc(OC[C@@H](O)CNOCC2CC2)cc1	ZINC000819328386	CD	On-Demand	Mild	ADRB1	51	54
CC(=O)Nc1ccc(OC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(F)c1	ZINC000819328387	GG	On-Demand	Mild	PAPA1_CARPA	41	43
CCSc1cccc(CNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819328388	FG	On-Demand	Anodyne	ADRB3	33	40
CC[C@@H](C)CONC[C@H](O)COc1ccccc1C(C)C	ZINC000819328389	CG	On-Demand	Anodyne	ADRB2	32	53
CC[C@@H](C)CONC[C@H](O)COc1ccccc1C(C)C	ZINC000819328389	CG	On-Demand	Anodyne	ABCB1	26	41
CC[C@H](C)CONC[C@H](O)COc1ccccc1C(C)C	ZINC000819328390	CG	On-Demand	Anodyne	ADRB2	32	53
CC[C@H](C)CONC[C@H](O)COc1ccccc1C(C)C	ZINC000819328390	CG	On-Demand	Anodyne	ABCB1	26	41
CC(=O)Nc1ccc(OC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c(F)c1	ZINC000819328391	GG	On-Demand	Mild	PAPA1_CARPA	41	43
CC[C@@H](C)CONC[C@@H](O)COc1ccccc1C(C)C	ZINC000819328392	CG	On-Demand	Anodyne	ADRB2	32	53
CC[C@@H](C)CONC[C@@H](O)COc1ccccc1C(C)C	ZINC000819328392	CG	On-Demand	Anodyne	ABCB1	26	41
CC[C@H](C)CONC[C@@H](O)COc1ccccc1C(C)C	ZINC000819328393	CG	On-Demand	Anodyne	ADRB2	32	53
CC[C@H](C)CONC[C@@H](O)COc1ccccc1C(C)C	ZINC000819328393	CG	On-Demand	Anodyne	ABCB1	26	41
N#CCc1ccc(OC[C@H](O)CNOCC2CC2)cc1	ZINC000819328404	CD	On-Demand	Mild	ADRB2	29	52
N#CCc1ccc(OC[C@H](O)CNOCC2CC2)cc1	ZINC000819328404	CD	On-Demand	Mild	ADRB1	51	54
COc1cccc([S@@](=O)CC(=O)NCC[C@@H](O)c2ccccc2)c1	ZINC000819328405	EE	On-Demand	Anodyne	MTNR1A	48	47
COc1cccc([S@@](=O)CC(=O)NCC[C@@H](O)c2ccccc2)c1	ZINC000819328405	EE	On-Demand	Anodyne	MTNR1B	47	47
COc1cccc([S@@](=O)CC(=O)NCC[C@H](O)c2ccccc2)c1	ZINC000819328407	EE	On-Demand	Anodyne	MTNR1A	48	47
COc1cccc([S@@](=O)CC(=O)NCC[C@H](O)c2ccccc2)c1	ZINC000819328407	EE	On-Demand	Anodyne	MTNR1B	47	47
CC[C@H](C)CONC[C@H](O)c1cccc(Cl)c1	ZINC000819328411	CF	On-Demand	Anodyne	ADRB2	26	46
CC[C@H](C)CONC[C@H](O)c1cccc(Cl)c1	ZINC000819328411	CF	On-Demand	Anodyne	ADRB1	39	46
CC[C@H](C)CONC[C@H](O)c1cccc(Cl)c1	ZINC000819328411	CF	On-Demand	Anodyne	ADRB3	51	46
CC[C@H](C)CONC[C@@H](O)c1cccc(Cl)c1	ZINC000819328413	CF	On-Demand	Anodyne	ADRB2	26	46
CC[C@H](C)CONC[C@@H](O)c1cccc(Cl)c1	ZINC000819328413	CF	On-Demand	Anodyne	ADRB1	39	46
CC[C@H](C)CONC[C@@H](O)c1cccc(Cl)c1	ZINC000819328413	CF	On-Demand	Anodyne	ADRB3	51	46
CC[C@@H](C)CONC[C@H](O)c1cccc(Cl)c1	ZINC000819328414	CF	On-Demand	Anodyne	ADRB2	26	46
CC[C@@H](C)CONC[C@H](O)c1cccc(Cl)c1	ZINC000819328414	CF	On-Demand	Anodyne	ADRB1	39	46
CC[C@@H](C)CONC[C@H](O)c1cccc(Cl)c1	ZINC000819328414	CF	On-Demand	Anodyne	ADRB3	51	46
CC[C@@H](C)CONC[C@@H](O)c1cccc(Cl)c1	ZINC000819328416	CF	On-Demand	Anodyne	ADRB2	26	46
CC[C@@H](C)CONC[C@@H](O)c1cccc(Cl)c1	ZINC000819328416	CF	On-Demand	Anodyne	ADRB1	39	46
CC[C@@H](C)CONC[C@@H](O)c1cccc(Cl)c1	ZINC000819328416	CF	On-Demand	Anodyne	ADRB3	51	46
O[C@@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1ccccc1C(F)(F)F	ZINC000819328418	FH	On-Demand	Anodyne	SFRP1	44	33
O[C@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1ccccc1C(F)(F)F	ZINC000819328420	FH	On-Demand	Anodyne	SFRP1	44	33
O[C@H](CN[C@H]1CCN(c2ccccc2F)C1)c1ccccc1C(F)(F)F	ZINC000819328424	FH	On-Demand	Anodyne	SFRP1	44	33
O[C@@H](CN[C@H]1CCN(c2ccccc2F)C1)c1ccccc1C(F)(F)F	ZINC000819328428	FH	On-Demand	Anodyne	SFRP1	44	33
CC[C@H](C)CONC[C@@H](O)c1cccnc1	ZINC000819328431	BD	On-Demand	Anodyne	ADRB2	16	41
CC[C@H](C)CONC[C@@H](O)c1cccnc1	ZINC000819328431	BD	On-Demand	Anodyne	ADRB1	21	46
CC[C@H](C)CONC[C@@H](O)c1cccnc1	ZINC000819328431	BD	On-Demand	Anodyne	ADRB3	64	46
CC[C@H](C)CONC[C@@H](O)c1cccnc1	ZINC000819328431	BD	On-Demand	Anodyne	CYP51A1	17	41
CC[C@H](C)CONC[C@H](O)c1cccnc1	ZINC000819328434	BD	On-Demand	Anodyne	ADRB2	16	41
CC[C@H](C)CONC[C@H](O)c1cccnc1	ZINC000819328434	BD	On-Demand	Anodyne	ADRB1	21	46
CC[C@H](C)CONC[C@H](O)c1cccnc1	ZINC000819328434	BD	On-Demand	Anodyne	ADRB3	64	46
CC[C@H](C)CONC[C@H](O)c1cccnc1	ZINC000819328434	BD	On-Demand	Anodyne	CYP51A1	17	41
CC[C@@H](C)CONC[C@H](O)c1cccnc1	ZINC000819328435	BD	On-Demand	Anodyne	ADRB2	16	41
CC[C@@H](C)CONC[C@H](O)c1cccnc1	ZINC000819328435	BD	On-Demand	Anodyne	ADRB1	21	46
CC[C@@H](C)CONC[C@H](O)c1cccnc1	ZINC000819328435	BD	On-Demand	Anodyne	ADRB3	64	46
CC[C@@H](C)CONC[C@H](O)c1cccnc1	ZINC000819328435	BD	On-Demand	Anodyne	CYP51A1	17	41
CC[C@@H](C)CONC[C@@H](O)c1cccnc1	ZINC000819328437	BD	On-Demand	Anodyne	ADRB2	16	41
CC[C@@H](C)CONC[C@@H](O)c1cccnc1	ZINC000819328437	BD	On-Demand	Anodyne	ADRB1	21	46
CC[C@@H](C)CONC[C@@H](O)c1cccnc1	ZINC000819328437	BD	On-Demand	Anodyne	ADRB3	64	46
CC[C@@H](C)CONC[C@@H](O)c1cccnc1	ZINC000819328437	BD	On-Demand	Anodyne	CYP51A1	17	41
Cc1ccccc1[C@@H](O)CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1	ZINC000819328438	FI	On-Demand	Anodyne	DRD2	16	44
Cc1ccccc1[C@@H](O)CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1	ZINC000819328438	FI	On-Demand	Anodyne	LTA4H	15	47
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1c(C)nn(C)c1C	ZINC000819328466	GG	On-Demand	Mild	PAPA1_CARPA	36	44
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1c(C)nn(C)c1C	ZINC000819328472	GG	On-Demand	Mild	PAPA1_CARPA	36	44
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1c(C)nn(C)c1C	ZINC000819328474	GG	On-Demand	Mild	PAPA1_CARPA	36	44
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1c(C)nn(C)c1C	ZINC000819328476	GG	On-Demand	Mild	PAPA1_CARPA	36	44
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccc(C3CCCCC3)cc2)cc1	ZINC000819328480	GH	On-Demand	Anodyne	ADRB3	33	42
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccc(C3CCCCC3)cc2)cc1	ZINC000819328485	GH	On-Demand	Anodyne	ADRB3	33	42
CC[C@@H](C)CONC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819328501	CD	On-Demand	Anodyne	ADRB2	16	40
CC[C@H](C)CONC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819328502	CD	On-Demand	Anodyne	ADRB2	16	40
CC[C@H](C)CONC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819328503	CD	On-Demand	Anodyne	ADRB2	16	40
CC[C@@H](C)CONC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819328504	CD	On-Demand	Anodyne	ADRB2	16	40
N#C/C(=C\c1ccc(F)cc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328524	HG	On-Demand	Reactive	CA12	16	40
N#C/C(=C/c1ccc(F)cc1)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328525	HG	On-Demand	Reactive	CA12	16	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819328528	IG	On-Demand	Anodyne	PDS	43	38
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819328529	IG	On-Demand	Anodyne	PDS	43	38
N#Cc1cccc(OCC(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819328531	GF	On-Demand	Mild	TRPV4	41	33
N#Cc1cccc(OCC(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819328531	GF	On-Demand	Mild	CRTM	29	42
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H](F)c1ccc(C(F)(F)F)cc1	ZINC000819328532	II	On-Demand	Anodyne	TRPV1	72	39
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H](F)c1ccc(C(F)(F)F)cc1	ZINC000819328533	II	On-Demand	Anodyne	TRPV1	72	39
Cc1nc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)nn1-c1ccccc1	ZINC000819328534	HF	On-Demand	Anodyne	HTR2A	21	40
Cc1nc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)nn1-c1ccccc1	ZINC000819328534	HF	On-Demand	Anodyne	HTR2C	21	40
CC(C)(C)C(=O)Nc1ccccc1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328546	IH	On-Demand	Anodyne	PRTN3	50	42
CC(C)(C)C(=O)Nc1ccccc1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328546	IH	On-Demand	Anodyne	SLC6A5	20	42
O=C(C#Cc1ccc2c(c1)OCO2)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328547	HE	On-Demand	Mild	BMP1	41	38
Cc1cc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc(Cl)n1	ZINC000819328551	GG	On-Demand	Anodyne	CA2	18	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc(C(F)(F)F)cnc1Cl	ZINC000819328572	II	On-Demand	Anodyne	ATF1	43	30
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc(C(F)(F)F)cnc1Cl	ZINC000819328572	II	On-Demand	Anodyne	NFKB1	40	30
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc(C(F)(F)F)cnc1Cl	ZINC000819328572	II	On-Demand	Anodyne	TRPM8	42	36
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H]1CC(c2ccccc2)=NO1	ZINC000819328576	HF	On-Demand	Anodyne	LUCI_PHOPY	40	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H]1CC(c2ccccc2)=NO1	ZINC000819328577	HF	On-Demand	Anodyne	LUCI_PHOPY	40	40
CC(C)(C(=O)N1CCC[C@@H](O)CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328589	GH	On-Demand	Anodyne	KCNH2	17	41
CC(C)(C(=O)N1CCC[C@@H](O)CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328589	GH	On-Demand	Anodyne	CACNA1B	32	40
CC(C)(C(=O)N1CCC[C@@H](O)CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328589	GH	On-Demand	Anodyne	ADAM17	26	41
CC(C)(C(=O)N1CCC[C@@H](O)CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328589	GH	On-Demand	Anodyne	DPP7	19	42
CC(C)(C(=O)N1CCC[C@@H](O)CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328589	GH	On-Demand	Anodyne	FFAR1	32	40
CC(C)(C(=O)N1CCC[C@@H](O)CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328589	GH	On-Demand	Anodyne	SLC12A5	52	35
CC(C)(C(=O)N1CCC[C@@H](O)CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328590	GH	On-Demand	Anodyne	KCNH2	17	41
CC(C)(C(=O)N1CCC[C@@H](O)CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328590	GH	On-Demand	Anodyne	CACNA1B	32	40
CC(C)(C(=O)N1CCC[C@@H](O)CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328590	GH	On-Demand	Anodyne	ADAM17	26	41
CC(C)(C(=O)N1CCC[C@@H](O)CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328590	GH	On-Demand	Anodyne	DPP7	19	42
CC(C)(C(=O)N1CCC[C@@H](O)CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328590	GH	On-Demand	Anodyne	FFAR1	32	40
CC(C)(C(=O)N1CCC[C@@H](O)CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328590	GH	On-Demand	Anodyne	SLC12A5	52	35
CC(C)(C(=O)N1CCC[C@H](O)CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328591	GH	On-Demand	Anodyne	KCNH2	17	41
CC(C)(C(=O)N1CCC[C@H](O)CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328591	GH	On-Demand	Anodyne	CACNA1B	32	40
CC(C)(C(=O)N1CCC[C@H](O)CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328591	GH	On-Demand	Anodyne	ADAM17	26	41
CC(C)(C(=O)N1CCC[C@H](O)CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328591	GH	On-Demand	Anodyne	DPP7	19	42
CC(C)(C(=O)N1CCC[C@H](O)CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328591	GH	On-Demand	Anodyne	FFAR1	32	40
CC(C)(C(=O)N1CCC[C@H](O)CC1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328591	GH	On-Demand	Anodyne	SLC12A5	52	35
CC(C)(C(=O)N1CCC[C@H](O)CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328592	GH	On-Demand	Anodyne	KCNH2	17	41
CC(C)(C(=O)N1CCC[C@H](O)CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328592	GH	On-Demand	Anodyne	CACNA1B	32	40
CC(C)(C(=O)N1CCC[C@H](O)CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328592	GH	On-Demand	Anodyne	ADAM17	26	41
CC(C)(C(=O)N1CCC[C@H](O)CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328592	GH	On-Demand	Anodyne	DPP7	19	42
CC(C)(C(=O)N1CCC[C@H](O)CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328592	GH	On-Demand	Anodyne	FFAR1	32	40
CC(C)(C(=O)N1CCC[C@H](O)CC1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819328592	GH	On-Demand	Anodyne	SLC12A5	52	35
Cc1cc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c(C)n1Cc1ccccc1	ZINC000819328595	II	On-Demand	Anodyne	HTR2C	18	48
Cc1cc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c(C)n1Cc1ccccc1	ZINC000819328595	II	On-Demand	Anodyne	PTGES2	45	33
CC#CC(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328597	CD	On-Demand	Mild	TBXA2R	41	32
CCOC(=O)N1CCC(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819328601	HE	On-Demand	Anodyne	CHRM2	22	41
CCOC(=O)N1CCC(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819328601	HE	On-Demand	Anodyne	APP	61	42
CCOC(=O)N1CCC(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819328601	HE	On-Demand	Anodyne	EPHX2	24	48
C#Cc1ccccc1CC(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328602	GF	On-Demand	Mild	CA9	21	40
Nc1cc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc(Cl)n1	ZINC000819328613	GF	On-Demand	Anodyne	CA2	25	41
Nc1cc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc(Cl)n1	ZINC000819328613	GF	On-Demand	Anodyne	CA1	16	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H](c2ccccc2)C2CC2)CC1	ZINC000819328646	GH	On-Demand	Anodyne	GRIN2B	15	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H](c2ccccc2)C2CC2)CC1	ZINC000819328646	GH	On-Demand	Anodyne	AMY2	45	31
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H](c2ccccc2)C2CC2)CC1	ZINC000819328646	GH	On-Demand	Anodyne	CCR8	21	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H](c2ccccc2)C2CC2)CC1	ZINC000819328646	GH	On-Demand	Anodyne	GPR119	47	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H](c2ccccc2)C2CC2)CC1	ZINC000819328646	GH	On-Demand	Anodyne	SFRP1	18	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H](c2ccccc2)C2CC2)CC1	ZINC000819328647	GH	On-Demand	Anodyne	GRIN2B	15	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H](c2ccccc2)C2CC2)CC1	ZINC000819328647	GH	On-Demand	Anodyne	AMY2	45	31
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H](c2ccccc2)C2CC2)CC1	ZINC000819328647	GH	On-Demand	Anodyne	CCR8	21	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H](c2ccccc2)C2CC2)CC1	ZINC000819328647	GH	On-Demand	Anodyne	GPR119	47	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H](c2ccccc2)C2CC2)CC1	ZINC000819328647	GH	On-Demand	Anodyne	SFRP1	18	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H](c2ccccc2)C2CC2)CC1	ZINC000819328648	GH	On-Demand	Anodyne	GRIN2B	15	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H](c2ccccc2)C2CC2)CC1	ZINC000819328648	GH	On-Demand	Anodyne	AMY2	45	31
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H](c2ccccc2)C2CC2)CC1	ZINC000819328648	GH	On-Demand	Anodyne	CCR8	21	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H](c2ccccc2)C2CC2)CC1	ZINC000819328648	GH	On-Demand	Anodyne	GPR119	47	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H](c2ccccc2)C2CC2)CC1	ZINC000819328648	GH	On-Demand	Anodyne	SFRP1	18	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H](c2ccccc2)C2CC2)CC1	ZINC000819328649	GH	On-Demand	Anodyne	GRIN2B	15	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H](c2ccccc2)C2CC2)CC1	ZINC000819328649	GH	On-Demand	Anodyne	AMY2	45	31
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H](c2ccccc2)C2CC2)CC1	ZINC000819328649	GH	On-Demand	Anodyne	CCR8	21	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H](c2ccccc2)C2CC2)CC1	ZINC000819328649	GH	On-Demand	Anodyne	GPR119	47	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H](c2ccccc2)C2CC2)CC1	ZINC000819328649	GH	On-Demand	Anodyne	SFRP1	18	40
CN(C[C@H](O)CNC[C@@H](c1ccccc1)C1CC1)C(=O)OC(C)(C)C	ZINC000819328661	EF	On-Demand	Anodyne	AMY2	45	31
CN(C[C@H](O)CNC[C@H](c1ccccc1)C1CC1)C(=O)OC(C)(C)C	ZINC000819328662	EF	On-Demand	Anodyne	AMY2	45	31
CN(C[C@@H](O)CNC[C@@H](c1ccccc1)C1CC1)C(=O)OC(C)(C)C	ZINC000819328664	EF	On-Demand	Anodyne	AMY2	45	31
O[C@H](CNOCC1CC1)c1cccnc1	ZINC000819328665	BD	On-Demand	Anodyne	ADRB1	19	40
O[C@H](CNOCC1CC1)c1cccnc1	ZINC000819328665	BD	On-Demand	Anodyne	ADRB3	63	42
CN(C[C@@H](O)CNC[C@H](c1ccccc1)C1CC1)C(=O)OC(C)(C)C	ZINC000819328666	EF	On-Demand	Anodyne	AMY2	45	31
O[C@@H](CNOCC1CC1)c1cccnc1	ZINC000819328667	BD	On-Demand	Anodyne	ADRB1	19	40
O[C@@H](CNOCC1CC1)c1cccnc1	ZINC000819328667	BD	On-Demand	Anodyne	ADRB3	63	42
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(F)cc2)C1)c1ccc(F)cc1	ZINC000819328676	DH	On-Demand	Anodyne	SLC6A3	18	49
O[C@H](CN[C@@H]1C[C@@H](c2ccc(F)cc2)C1)c1ccc(F)cc1	ZINC000819328678	DH	On-Demand	Anodyne	SLC6A3	18	49
CCC(CC)(CNC[C@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819328695	CE	On-Demand	Bother	CACNA1C	48	35
CCC(CC)(CNC[C@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819328695	CE	On-Demand	Bother	CACNA1D	73	35
CCC(CC)(CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819328697	CE	On-Demand	Bother	CACNA1C	48	35
CCC(CC)(CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819328697	CE	On-Demand	Bother	CACNA1D	73	35
O=C(CCNOCC1CC1)Nc1cccc(Br)c1	ZINC000819328709	DF	On-Demand	Anodyne	EGFR	23	40
O=C(CN1C(=O)S/C(=C/c2cccs2)C1=O)NC(C1CC1)C1CC1	ZINC000819328710	FG	On-Demand	Anodyne	AKR1B1	45	40
C[C@@H](NC[C@@H](O)c1cccnc1)c1ncc(Br)cn1	ZINC000819328712	DE	On-Demand	Anodyne	ADRB2	21	43
C[C@@H](NC[C@@H](O)c1cccnc1)c1ncc(Br)cn1	ZINC000819328712	DE	On-Demand	Anodyne	ADRB1	22	48
C[C@@H](NC[C@@H](O)c1cccnc1)c1ncc(Br)cn1	ZINC000819328712	DE	On-Demand	Anodyne	ADRB3	64	48
C[C@H](NC[C@H](O)c1cccnc1)c1ncc(Br)cn1	ZINC000819328713	DE	On-Demand	Anodyne	ADRB2	21	43
C[C@H](NC[C@H](O)c1cccnc1)c1ncc(Br)cn1	ZINC000819328713	DE	On-Demand	Anodyne	ADRB1	22	48
C[C@H](NC[C@H](O)c1cccnc1)c1ncc(Br)cn1	ZINC000819328713	DE	On-Demand	Anodyne	ADRB3	64	48
CC(=O)c1cccc(OC[C@@H](O)CNOCC2CC2)c1	ZINC000819328728	CD	On-Demand	Anodyne	ADRB2	28	46
CC(=O)c1cccc(OC[C@@H](O)CNOCC2CC2)c1	ZINC000819328728	CD	On-Demand	Anodyne	ADRB1	51	43
CC(=O)c1cccc(OC[C@@H](O)CNOCC2CC2)c1	ZINC000819328728	CD	On-Demand	Anodyne	ABCB1	18	47
CC(=O)c1cccc(OC[C@H](O)CNOCC2CC2)c1	ZINC000819328732	CD	On-Demand	Anodyne	ADRB2	28	46
CC(=O)c1cccc(OC[C@H](O)CNOCC2CC2)c1	ZINC000819328732	CD	On-Demand	Anodyne	ADRB1	51	43
CC(=O)c1cccc(OC[C@H](O)CNOCC2CC2)c1	ZINC000819328732	CD	On-Demand	Anodyne	ABCB1	18	47
O[C@@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1cccnc1	ZINC000819328770	DE	On-Demand	Anodyne	ADRB3	66	52
O[C@@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1cccnc1	ZINC000819328770	DE	On-Demand	Anodyne	SCD	19	40
O[C@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1cccnc1	ZINC000819328773	DE	On-Demand	Anodyne	ADRB3	66	52
O[C@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1cccnc1	ZINC000819328773	DE	On-Demand	Anodyne	SCD	19	40
O[C@H](CN[C@H]1CCN(c2ccccc2F)C1)c1cccnc1	ZINC000819328776	DE	On-Demand	Anodyne	ADRB3	66	52
O[C@H](CN[C@H]1CCN(c2ccccc2F)C1)c1cccnc1	ZINC000819328776	DE	On-Demand	Anodyne	SCD	19	40
O=C(/C=C/[C@H]1CCCO1)Nc1cnn(Cc2ccc(Cl)cc2)c1	ZINC000819328777	EG	On-Demand	Anodyne	PANC	60	47
O[C@@H](CN[C@H]1CCN(c2ccccc2F)C1)c1cccnc1	ZINC000819328778	DE	On-Demand	Anodyne	ADRB3	66	52
O[C@@H](CN[C@H]1CCN(c2ccccc2F)C1)c1cccnc1	ZINC000819328778	DE	On-Demand	Anodyne	SCD	19	40
O=C(/C=C\[C@@H]1CCCO1)Nc1cnn(Cc2ccc(Cl)cc2)c1	ZINC000819328779	EG	On-Demand	Anodyne	PANC	60	47
O=C(/C=C/[C@@H]1CCCO1)Nc1cnn(Cc2ccc(Cl)cc2)c1	ZINC000819328781	EG	On-Demand	Anodyne	PANC	60	47
O=C(/C=C\[C@H]1CCCO1)Nc1cnn(Cc2ccc(Cl)cc2)c1	ZINC000819328784	EG	On-Demand	Anodyne	PANC	60	47
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@@H](c2ccccc2)C2CC2)cc1	ZINC000819328790	FF	On-Demand	Anodyne	ADRB3	46	40
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@@H](c2ccccc2)C2CC2)cc1	ZINC000819328790	FF	On-Demand	Anodyne	CCR5	19	41
CC[C@H](C)CONC[C@H](O)c1ccccc1	ZINC000819328791	BE	On-Demand	Anodyne	ADRB3	30	40
CC[C@H](C)CONC[C@H](O)c1ccccc1	ZINC000819328791	BE	On-Demand	Anodyne	AOC3	16	46
CC[C@@H](C)CONC[C@@H](O)c1ccccc1	ZINC000819328793	BE	On-Demand	Anodyne	ADRB3	30	40
CC[C@@H](C)CONC[C@@H](O)c1ccccc1	ZINC000819328793	BE	On-Demand	Anodyne	AOC3	16	46
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@H](c2ccccc2)C2CC2)cc1	ZINC000819328794	FF	On-Demand	Anodyne	ADRB3	46	40
CS(=O)(=O)c1ccc([C@@H](O)CNC[C@H](c2ccccc2)C2CC2)cc1	ZINC000819328794	FF	On-Demand	Anodyne	CCR5	19	41
CC[C@H](C)CONC[C@@H](O)c1ccccc1	ZINC000819328796	BE	On-Demand	Anodyne	ADRB3	30	40
CC[C@H](C)CONC[C@@H](O)c1ccccc1	ZINC000819328796	BE	On-Demand	Anodyne	AOC3	16	46
CC[C@@H](C)CONC[C@H](O)c1ccccc1	ZINC000819328797	BE	On-Demand	Anodyne	ADRB3	30	40
CC[C@@H](C)CONC[C@H](O)c1ccccc1	ZINC000819328797	BE	On-Demand	Anodyne	AOC3	16	46
CS(=O)(=O)c1ccc([C@H](O)CNC[C@@H](c2ccccc2)C2CC2)cc1	ZINC000819328798	FF	On-Demand	Anodyne	ADRB3	46	40
CS(=O)(=O)c1ccc([C@H](O)CNC[C@@H](c2ccccc2)C2CC2)cc1	ZINC000819328798	FF	On-Demand	Anodyne	CCR5	19	41
CS(=O)(=O)c1ccc([C@H](O)CNC[C@H](c2ccccc2)C2CC2)cc1	ZINC000819328801	FF	On-Demand	Anodyne	ADRB3	46	40
CS(=O)(=O)c1ccc([C@H](O)CNC[C@H](c2ccccc2)C2CC2)cc1	ZINC000819328801	FF	On-Demand	Anodyne	CCR5	19	41
O[C@@H](CNC[C@H](c1ccccc1)C1CC1)c1ccc(F)cc1	ZINC000819328818	CH	On-Demand	Anodyne	SLC6A3	27	53
O[C@@H](CNC[C@@H](c1ccccc1)C1CC1)c1ccc(F)cc1	ZINC000819328820	CH	On-Demand	Anodyne	SLC6A3	27	53
O[C@H](CNC[C@@H](c1ccccc1)C1CC1)c1ccc(F)cc1	ZINC000819328821	CH	On-Demand	Anodyne	SLC6A3	27	53
O[C@H](CNC[C@H](c1ccccc1)C1CC1)c1ccc(F)cc1	ZINC000819328827	CH	On-Demand	Anodyne	SLC6A3	27	53
COc1cccc(OC)c1OC[C@H](O)CNOCC1CC1	ZINC000819328835	CD	On-Demand	Anodyne	ADRB2	29	41
COc1cccc(OC)c1OC[C@H](O)CNOCC1CC1	ZINC000819328835	CD	On-Demand	Anodyne	ADRB1	35	42
COc1cccc(OC)c1OC[C@@H](O)CNOCC1CC1	ZINC000819328837	CD	On-Demand	Anodyne	ADRB2	29	41
COc1cccc(OC)c1OC[C@@H](O)CNOCC1CC1	ZINC000819328837	CD	On-Demand	Anodyne	ADRB1	35	42
CSc1ccc(OC[C@H](O)CNOCC2CC2)cc1	ZINC000819328838	CE	On-Demand	Anodyne	ADRB2	28	51
CSc1ccc(OC[C@H](O)CNOCC2CC2)cc1	ZINC000819328838	CE	On-Demand	Anodyne	ADRB1	40	53
CSc1ccc(OC[C@@H](O)CNOCC2CC2)cc1	ZINC000819328839	CE	On-Demand	Anodyne	ADRB2	28	51
CSc1ccc(OC[C@@H](O)CNOCC2CC2)cc1	ZINC000819328839	CE	On-Demand	Anodyne	ADRB1	40	53
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(F)cc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819328864	FI	On-Demand	Anodyne	TACR1	64	37
CC[C@H](C)CONC[C@H](O)COc1ccc(Cl)cc1	ZINC000819328902	CF	On-Demand	Anodyne	ADRB2	34	47
CC[C@H](C)CONC[C@H](O)COc1ccc(Cl)cc1	ZINC000819328902	CF	On-Demand	Anodyne	ADRB1	37	47
CC[C@H](C)CONC[C@H](O)COc1ccc(Cl)cc1	ZINC000819328902	CF	On-Demand	Anodyne	GRIN1	21	43
CC[C@H](C)CONC[C@H](O)COc1ccc(Cl)cc1	ZINC000819328902	CF	On-Demand	Anodyne	ADRB3	20	44
CC[C@@H](C)CONC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819328903	CF	On-Demand	Anodyne	ADRB2	34	47
CC[C@@H](C)CONC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819328903	CF	On-Demand	Anodyne	ADRB1	37	47
CC[C@@H](C)CONC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819328903	CF	On-Demand	Anodyne	GRIN1	21	43
CC[C@@H](C)CONC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819328903	CF	On-Demand	Anodyne	ADRB3	20	44
CC[C@H](C)CONC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819328904	CF	On-Demand	Anodyne	ADRB2	34	47
CC[C@H](C)CONC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819328904	CF	On-Demand	Anodyne	ADRB1	37	47
CC[C@H](C)CONC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819328904	CF	On-Demand	Anodyne	GRIN1	21	43
CC[C@H](C)CONC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819328904	CF	On-Demand	Anodyne	ADRB3	20	44
CC[C@@H](C)CONC[C@H](O)COc1ccc(Cl)cc1	ZINC000819328905	CF	On-Demand	Anodyne	ADRB2	34	47
CC[C@@H](C)CONC[C@H](O)COc1ccc(Cl)cc1	ZINC000819328905	CF	On-Demand	Anodyne	ADRB1	37	47
CC[C@@H](C)CONC[C@H](O)COc1ccc(Cl)cc1	ZINC000819328905	CF	On-Demand	Anodyne	GRIN1	21	43
CC[C@@H](C)CONC[C@H](O)COc1ccc(Cl)cc1	ZINC000819328905	CF	On-Demand	Anodyne	ADRB3	20	44
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cccc(O)c1O	ZINC000819328930	FE	On-Demand	Clean	SLC6A5	22	45
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328932	IG	On-Demand	Anodyne	F2	44	41
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328932	IG	On-Demand	Anodyne	FKBP1A	28	44
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328932	IG	On-Demand	Anodyne	ELANE	29	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328932	IG	On-Demand	Anodyne	PREP	15	42
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328932	IG	On-Demand	Anodyne	LGMN	46	37
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328932	IG	On-Demand	Anodyne	SFRP1	40	41
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328932	IG	On-Demand	Anodyne	WNT3	54	41
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328933	IG	On-Demand	Anodyne	F2	44	41
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328933	IG	On-Demand	Anodyne	FKBP1A	28	44
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328933	IG	On-Demand	Anodyne	ELANE	29	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328933	IG	On-Demand	Anodyne	PREP	15	42
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328933	IG	On-Demand	Anodyne	LGMN	46	37
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328933	IG	On-Demand	Anodyne	SFRP1	40	41
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328933	IG	On-Demand	Anodyne	WNT3	54	41
O=C(CCN1CCOCC1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328945	FD	On-Demand	Anodyne	CCR4	18	44
O=C(CCN1CCOCC1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328945	FD	On-Demand	Anodyne	MMP2	34	43
O=C(CCN1CCOCC1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328945	FD	On-Demand	Anodyne	EPHX2	24	54
COc1cccc([C@H](O)C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819328950	GE	On-Demand	Anodyne	DRD4	43	37
COc1cccc([C@H](O)C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819328950	GE	On-Demand	Anodyne	BMP1	42	37
COc1cccc([C@H](O)C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819328950	GE	On-Demand	Anodyne	MTNR1A	47	44
COc1cccc([C@H](O)C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819328950	GE	On-Demand	Anodyne	MTNR1B	47	44
O=C(/C=C/c1ccc(Cl)cc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328952	GH	On-Demand	Anodyne	HDAC1	15	51
O=C(/C=C/c1ccc(Cl)cc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328952	GH	On-Demand	Anodyne	HDAC2	18	43
O=C(/C=C/c1ccc(Cl)cc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328952	GH	On-Demand	Anodyne	HDAC9	35	43
O=C(/C=C/c1ccc(Cl)cc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328952	GH	On-Demand	Anodyne	HDAC7	43	43
O=C(/C=C\c1ccc(Cl)cc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328953	GH	On-Demand	Anodyne	HDAC1	15	51
O=C(/C=C\c1ccc(Cl)cc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328953	GH	On-Demand	Anodyne	HDAC2	18	43
O=C(/C=C\c1ccc(Cl)cc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328953	GH	On-Demand	Anodyne	HDAC9	35	43
O=C(/C=C\c1ccc(Cl)cc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328953	GH	On-Demand	Anodyne	HDAC7	43	43
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc(Cl)nc(Cl)c1	ZINC000819328960	HH	On-Demand	Anodyne	CA2	27	42
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc(Cl)nc(Cl)c1	ZINC000819328960	HH	On-Demand	Anodyne	TBXAS1	22	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc(Cl)nc(Cl)c1	ZINC000819328960	HH	On-Demand	Anodyne	CA1	17	42
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc(Cl)nc(Cl)c1	ZINC000819328960	HH	On-Demand	Anodyne	CA9	17	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccnc(-n2ccnc2)c1	ZINC000819328968	HF	On-Demand	Anodyne	TBXAS1	30	47
C#Cc1cncc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819328969	FE	On-Demand	Mild	SCN10A	38	42
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccnc(C(F)(F)F)c1	ZINC000819328970	HG	On-Demand	Anodyne	KDM4E	23	41
CC[C@H]1OCC[C@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328973	FE	On-Demand	Anodyne	PSEN2	50	32
CC[C@H]1OCC[C@H]1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328973	FE	On-Demand	Anodyne	PSEN1	40	32
O=C(N[C@@H](C(=O)N1CCC[C@H](O)CC1)c1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000819328978	IE	On-Demand	Bother	MTTP	31	40
O=C(N[C@@H](C(=O)N1CCC[C@@H](O)CC1)c1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000819328979	IE	On-Demand	Bother	MTTP	31	40
O=C(Cc1ccccc1CO)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328985	GE	On-Demand	Anodyne	CA2	16	47
O=C(Cc1ccccc1CO)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328985	GE	On-Demand	Anodyne	CA1	15	47
O=C(Cc1ccccc1CO)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328985	GE	On-Demand	Anodyne	CA5B	33	40
O=C(Cc1ccccc1CO)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328985	GE	On-Demand	Anodyne	CA5A	33	40
O=C(Cc1ccccc1CO)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328985	GE	On-Demand	Anodyne	SLC6A5	19	44
O=C(Cc1ccccc1CO)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819328985	GE	On-Demand	Anodyne	CA9	23	46
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccnc(F)c1	ZINC000819328994	FE	On-Demand	Anodyne	KDM4E	22	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccc(-n2cccc2)nc1	ZINC000819328998	HG	On-Demand	Anodyne	TBXAS1	27	40
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329003	IG	On-Demand	Anodyne	FPR1	29	40
Cn1nc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c2ccccc2c1=O	ZINC000819329010	HE	On-Demand	Anodyne	IMDH_CRYPV	25	46
O=C(/C=C/c1ccnc2ccccc12)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329016	HH	On-Demand	Anodyne	HDAC9	20	41
O=C(/C=C/c1ccnc2ccccc12)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329016	HH	On-Demand	Anodyne	HDAC7	22	41
O=C(/C=C\c1ccnc2ccccc12)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329017	HH	On-Demand	Anodyne	HDAC9	20	41
O=C(/C=C\c1ccnc2ccccc12)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329017	HH	On-Demand	Anodyne	HDAC7	22	41
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc(Cl)nc2ccccc12	ZINC000819329018	HI	On-Demand	Anodyne	HRP1_PLAFA	17	42
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc(Cl)nc2ccccc12	ZINC000819329018	HI	On-Demand	Anodyne	TACR3	15	41
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc(Cl)nc2ccccc12	ZINC000819329018	HI	On-Demand	Anodyne	SLC6A5	20	40
O[C@H](CN[C@@H]1C[C@@H](c2ccc(F)cc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819329069	FI	On-Demand	Anodyne	TACR1	64	37
O[C@H](CNOCC1CC1)c1cccc(Cl)c1	ZINC000819329095	BE	On-Demand	Anodyne	ADRB1	36	40
O[C@H](CNOCC1CC1)c1cccc(Cl)c1	ZINC000819329095	BE	On-Demand	Anodyne	ADRB3	47	44
O[C@H](CNOCC1CC1)c1cccc(Cl)c1	ZINC000819329095	BE	On-Demand	Anodyne	CYP3A4	46	35
O[C@@H](CNOCC1CC1)c1cccc(Cl)c1	ZINC000819329097	BE	On-Demand	Anodyne	ADRB1	36	40
O[C@@H](CNOCC1CC1)c1cccc(Cl)c1	ZINC000819329097	BE	On-Demand	Anodyne	ADRB3	47	44
O[C@@H](CNOCC1CC1)c1cccc(Cl)c1	ZINC000819329097	BE	On-Demand	Anodyne	CYP3A4	46	35
CC(=O)c1ccc(OC[C@@H](O)CNOCC2CC2)cc1	ZINC000819329099	CD	On-Demand	Anodyne	ADRB2	32	50
CC(=O)c1ccc(OC[C@@H](O)CNOCC2CC2)cc1	ZINC000819329099	CD	On-Demand	Anodyne	ADRB1	56	52
CC(=O)c1ccc(OC[C@H](O)CNOCC2CC2)cc1	ZINC000819329101	CD	On-Demand	Anodyne	ADRB2	32	50
CC(=O)c1ccc(OC[C@H](O)CNOCC2CC2)cc1	ZINC000819329101	CD	On-Demand	Anodyne	ADRB1	56	52
Cc1cc(CNC[C@H](O)c2cccc(Cl)c2)nc(N2CCCC2)n1	ZINC000819329106	EF	On-Demand	Anodyne	ADRB1	26	41
Cc1cc(CNC[C@H](O)c2cccc(Cl)c2)nc(N2CCCC2)n1	ZINC000819329106	EF	On-Demand	Anodyne	ADRB3	39	41
Cc1cc(CNC[C@H](O)c2cccc(Cl)c2)nc(N2CCCC2)n1	ZINC000819329106	EF	On-Demand	Anodyne	CYP3A4	47	37
Cc1cc(CNC[C@@H](O)c2cccc(Cl)c2)nc(N2CCCC2)n1	ZINC000819329108	EF	On-Demand	Anodyne	ADRB1	26	41
Cc1cc(CNC[C@@H](O)c2cccc(Cl)c2)nc(N2CCCC2)n1	ZINC000819329108	EF	On-Demand	Anodyne	ADRB3	39	41
Cc1cc(CNC[C@@H](O)c2cccc(Cl)c2)nc(N2CCCC2)n1	ZINC000819329108	EF	On-Demand	Anodyne	CYP3A4	47	37
CC(C)(C)C(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000819329150	CF	On-Demand	Anodyne	ADRB2	26	44
CC(C)(C)C(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000819329150	CF	On-Demand	Anodyne	ADRB1	27	46
CC(C)(C)C(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000819329150	CF	On-Demand	Anodyne	ADRB3	97	46
CC(C)(C)C(C)(C)CNC[C@H](O)c1cccnc1	ZINC000819329152	CF	On-Demand	Anodyne	ADRB2	26	44
CC(C)(C)C(C)(C)CNC[C@H](O)c1cccnc1	ZINC000819329152	CF	On-Demand	Anodyne	ADRB1	27	46
CC(C)(C)C(C)(C)CNC[C@H](O)c1cccnc1	ZINC000819329152	CF	On-Demand	Anodyne	ADRB3	97	46
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1cccnc1	ZINC000819329169	DE	On-Demand	Anodyne	ADRB2	39	46
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1cccnc1	ZINC000819329169	DE	On-Demand	Anodyne	ADRB1	44	48
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1cccnc1	ZINC000819329169	DE	On-Demand	Anodyne	ADRB3	132	47
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1cccnc1	ZINC000819329170	DE	On-Demand	Anodyne	ADRB2	39	46
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1cccnc1	ZINC000819329170	DE	On-Demand	Anodyne	ADRB1	44	48
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1cccnc1	ZINC000819329170	DE	On-Demand	Anodyne	ADRB3	132	47
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(Cl)cc1	ZINC000819329189	EH	On-Demand	Anodyne	ADRB2	23	41
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(Cl)cc1	ZINC000819329189	EH	On-Demand	Anodyne	ADRB1	26	41
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(Cl)cc1	ZINC000819329189	EH	On-Demand	Anodyne	ADRB3	45	41
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1c(F)cccc1F	ZINC000819329195	GI	On-Demand	Anodyne	DRD2	18	44
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1c(F)cccc1F	ZINC000819329195	GI	On-Demand	Anodyne	LTA4H	15	44
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1c(F)cccc1F	ZINC000819329195	GI	On-Demand	Anodyne	ACHP_LYMST	18	41
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1c(F)cccc1F	ZINC000819329199	GI	On-Demand	Anodyne	DRD2	18	44
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1c(F)cccc1F	ZINC000819329199	GI	On-Demand	Anodyne	LTA4H	15	44
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1c(F)cccc1F	ZINC000819329199	GI	On-Demand	Anodyne	ACHP_LYMST	18	41
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CCN(c2ccccc2F)C1	ZINC000819329226	FE	On-Demand	Anodyne	GPR119	15	41
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CCN(c2ccccc2F)C1	ZINC000819329227	FE	On-Demand	Anodyne	GPR119	15	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1CCN(c2ccccc2F)C1	ZINC000819329228	FE	On-Demand	Anodyne	GPR119	15	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H]1CCN(c2ccccc2F)C1	ZINC000819329231	FE	On-Demand	Anodyne	GPR119	15	41
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819329238	EH	On-Demand	Anodyne	ADRB2	42	36
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819329238	EH	On-Demand	Anodyne	ADRB1	52	53
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819329238	EH	On-Demand	Anodyne	ADRB3	92	53
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819329239	EH	On-Demand	Anodyne	ADRB2	42	36
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819329239	EH	On-Demand	Anodyne	ADRB1	52	53
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819329239	EH	On-Demand	Anodyne	ADRB3	92	53
CC[C@@H](C)CONC[C@@H](O)COc1ccccc1	ZINC000819329242	CD	On-Demand	Anodyne	ADRB2	55	60
CC[C@@H](C)CONC[C@@H](O)COc1ccccc1	ZINC000819329242	CD	On-Demand	Anodyne	ADRB1	60	46
CC[C@@H](C)CONC[C@@H](O)COc1ccccc1	ZINC000819329242	CD	On-Demand	Anodyne	ADRB3	37	43
CC[C@@H](C)CONC[C@@H](O)COc1ccccc1	ZINC000819329242	CD	On-Demand	Anodyne	CASR	15	43
CC[C@@H](C)CONC[C@@H](O)COc1ccccc1	ZINC000819329242	CD	On-Demand	Anodyne	ABCB1	20	41
CC[C@@H](C)CONC[C@@H](O)COc1ccccc1	ZINC000819329242	CD	On-Demand	Anodyne	PDS	64	39
CC[C@]1(C)CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819329243	FH	On-Demand	Mild	PAPA1_CARPA	30	42
CC[C@@H](C)CONC[C@H](O)COc1ccccc1	ZINC000819329244	CD	On-Demand	Anodyne	ADRB2	55	60
CC[C@@H](C)CONC[C@H](O)COc1ccccc1	ZINC000819329244	CD	On-Demand	Anodyne	ADRB1	60	46
CC[C@@H](C)CONC[C@H](O)COc1ccccc1	ZINC000819329244	CD	On-Demand	Anodyne	ADRB3	37	43
CC[C@@H](C)CONC[C@H](O)COc1ccccc1	ZINC000819329244	CD	On-Demand	Anodyne	CASR	15	43
CC[C@@H](C)CONC[C@H](O)COc1ccccc1	ZINC000819329244	CD	On-Demand	Anodyne	ABCB1	20	41
CC[C@@H](C)CONC[C@H](O)COc1ccccc1	ZINC000819329244	CD	On-Demand	Anodyne	PDS	64	39
CC[C@H](C)CONC[C@@H](O)COc1ccccc1	ZINC000819329245	CD	On-Demand	Anodyne	ADRB2	55	60
CC[C@H](C)CONC[C@@H](O)COc1ccccc1	ZINC000819329245	CD	On-Demand	Anodyne	ADRB1	60	46
CC[C@H](C)CONC[C@@H](O)COc1ccccc1	ZINC000819329245	CD	On-Demand	Anodyne	ADRB3	37	43
CC[C@H](C)CONC[C@@H](O)COc1ccccc1	ZINC000819329245	CD	On-Demand	Anodyne	CASR	15	43
CC[C@H](C)CONC[C@@H](O)COc1ccccc1	ZINC000819329245	CD	On-Demand	Anodyne	ABCB1	20	41
CC[C@H](C)CONC[C@@H](O)COc1ccccc1	ZINC000819329245	CD	On-Demand	Anodyne	PDS	64	39
CC[C@]1(C)CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819329246	FH	On-Demand	Mild	PAPA1_CARPA	30	42
CC[C@H](C)CONC[C@H](O)COc1ccccc1	ZINC000819329247	CD	On-Demand	Anodyne	ADRB2	55	60
CC[C@H](C)CONC[C@H](O)COc1ccccc1	ZINC000819329247	CD	On-Demand	Anodyne	ADRB1	60	46
CC[C@H](C)CONC[C@H](O)COc1ccccc1	ZINC000819329247	CD	On-Demand	Anodyne	ADRB3	37	43
CC[C@H](C)CONC[C@H](O)COc1ccccc1	ZINC000819329247	CD	On-Demand	Anodyne	CASR	15	43
CC[C@H](C)CONC[C@H](O)COc1ccccc1	ZINC000819329247	CD	On-Demand	Anodyne	ABCB1	20	41
CC[C@H](C)CONC[C@H](O)COc1ccccc1	ZINC000819329247	CD	On-Demand	Anodyne	PDS	64	39
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cccnc1S	ZINC000819329272	FF	On-Demand	Anodyne	SLC6A5	19	40
CC[C@@H](C)CONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819329274	CE	On-Demand	Anodyne	ADRB2	30	49
CC[C@@H](C)CONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819329274	CE	On-Demand	Anodyne	ADRB1	36	44
CC[C@@H](C)CONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819329274	CE	On-Demand	Anodyne	ABCB1	21	48
CC[C@@H](C)CONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819329274	CE	On-Demand	Anodyne	PDS	75	41
CC[C@@H](C)CONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819329275	CE	On-Demand	Anodyne	ADRB2	30	49
CC[C@@H](C)CONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819329275	CE	On-Demand	Anodyne	ADRB1	36	44
CC[C@@H](C)CONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819329275	CE	On-Demand	Anodyne	ABCB1	21	48
CC[C@@H](C)CONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819329275	CE	On-Demand	Anodyne	PDS	75	41
CC[C@H](C)CONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819329276	CE	On-Demand	Anodyne	ADRB2	30	49
CC[C@H](C)CONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819329276	CE	On-Demand	Anodyne	ADRB1	36	44
CC[C@H](C)CONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819329276	CE	On-Demand	Anodyne	ABCB1	21	48
CC[C@H](C)CONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819329276	CE	On-Demand	Anodyne	PDS	75	41
CC[C@H](C)CONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819329277	CE	On-Demand	Anodyne	ADRB2	30	49
CC[C@H](C)CONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819329277	CE	On-Demand	Anodyne	ADRB1	36	44
CC[C@H](C)CONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819329277	CE	On-Demand	Anodyne	ABCB1	21	48
CC[C@H](C)CONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819329277	CE	On-Demand	Anodyne	PDS	75	41
O=C(CNC(=O)OCc1ccccc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329286	HF	On-Demand	Anodyne	CA2	25	44
O=C(CNC(=O)OCc1ccccc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329286	HF	On-Demand	Anodyne	CA1	21	42
O=C(CNC(=O)OCc1ccccc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329286	HF	On-Demand	Anodyne	CTSB	23	40
O=C(CNC(=O)OCc1ccccc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329286	HF	On-Demand	Anodyne	CAPN2	75	37
O=C(CNC(=O)OCc1ccccc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329286	HF	On-Demand	Anodyne	NPR	58	36
O[C@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819329287	FH	On-Demand	Anodyne	LIPG	50	36
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc2cccc(Cl)c2o1	ZINC000819329288	HI	On-Demand	Anodyne	DRD3	16	45
O[C@H](CN[C@H]1CCN(c2ccccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819329289	FH	On-Demand	Anodyne	LIPG	50	36
O[C@@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819329290	FH	On-Demand	Anodyne	LIPG	50	36
O[C@@H](CN[C@H]1CCN(c2ccccc2F)C1)c1ccc(C(F)(F)F)cc1	ZINC000819329291	FH	On-Demand	Anodyne	LIPG	50	36
O=C(/C=C/c1ccccc1Cl)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329294	GH	On-Demand	Anodyne	HDAC9	26	42
O=C(/C=C/c1ccccc1Cl)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329294	GH	On-Demand	Anodyne	HDAC7	30	42
O=C(/C=C\c1ccccc1Cl)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329296	GH	On-Demand	Anodyne	HDAC9	26	42
O=C(/C=C\c1ccccc1Cl)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329296	GH	On-Demand	Anodyne	HDAC7	30	42
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329311	HF	On-Demand	Anodyne	FPR1	27	40
CC(C)(C)OC(=O)N1CCC(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819329313	IG	On-Demand	Anodyne	APP	53	37
CC(C)(C)OC(=O)N1CCC(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819329313	IG	On-Demand	Anodyne	EPHX2	26	47
CC(C)(C)OC(=O)N1CCC(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819329313	IG	On-Demand	Anodyne	GPR119	58	47
CC(C)(C)OC(=O)N1CCC(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819329313	IG	On-Demand	Anodyne	SFRP1	36	41
CC[C@H](C)CONC[C@H](O)COc1ccc(F)cc1	ZINC000819329323	CE	On-Demand	Anodyne	ADRB2	39	47
CC[C@H](C)CONC[C@H](O)COc1ccc(F)cc1	ZINC000819329323	CE	On-Demand	Anodyne	ADRB1	40	47
CC[C@H](C)CONC[C@H](O)COc1ccc(F)cc1	ZINC000819329323	CE	On-Demand	Anodyne	ADRB3	21	44
CC[C@@H](C)CONC[C@@H](O)COc1ccc(F)cc1	ZINC000819329325	CE	On-Demand	Anodyne	ADRB2	39	47
CC[C@@H](C)CONC[C@@H](O)COc1ccc(F)cc1	ZINC000819329325	CE	On-Demand	Anodyne	ADRB1	40	47
CC[C@@H](C)CONC[C@@H](O)COc1ccc(F)cc1	ZINC000819329325	CE	On-Demand	Anodyne	ADRB3	21	44
C#CCN1CCC(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819329326	GD	On-Demand	Mild	EPHX2	16	43
CC[C@H](C)CONC[C@@H](O)COc1ccc(F)cc1	ZINC000819329327	CE	On-Demand	Anodyne	ADRB2	39	47
CC[C@H](C)CONC[C@@H](O)COc1ccc(F)cc1	ZINC000819329327	CE	On-Demand	Anodyne	ADRB1	40	47
CC[C@H](C)CONC[C@@H](O)COc1ccc(F)cc1	ZINC000819329327	CE	On-Demand	Anodyne	ADRB3	21	44
CC[C@@H](C)CONC[C@H](O)COc1ccc(F)cc1	ZINC000819329329	CE	On-Demand	Anodyne	ADRB2	39	47
CC[C@@H](C)CONC[C@H](O)COc1ccc(F)cc1	ZINC000819329329	CE	On-Demand	Anodyne	ADRB1	40	47
CC[C@@H](C)CONC[C@H](O)COc1ccc(F)cc1	ZINC000819329329	CE	On-Demand	Anodyne	ADRB3	21	44
COCC(C)(C)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819329341	CD	On-Demand	Bother	CACNA1C	53	37
COCC(C)(C)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819329341	CD	On-Demand	Bother	CACNA1D	84	37
COCC(C)(C)CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819329342	CD	On-Demand	Bother	CACNA1C	53	37
COCC(C)(C)CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819329342	CD	On-Demand	Bother	CACNA1D	84	37
O[C@H](CN[C@@H]1CCCc2sc(Cl)cc21)c1cccnc1	ZINC000819329356	DG	On-Demand	Anodyne	ADRB3	74	44
O[C@@H](CN[C@@H]1CCCc2sc(Cl)cc21)c1cccnc1	ZINC000819329357	DG	On-Demand	Anodyne	ADRB3	74	44
O[C@H](CN[C@H]1CCCc2sc(Cl)cc21)c1cccnc1	ZINC000819329358	DG	On-Demand	Anodyne	ADRB3	74	44
O[C@@H](CN[C@H]1CCCc2sc(Cl)cc21)c1cccnc1	ZINC000819329360	DG	On-Demand	Anodyne	ADRB3	74	44
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc(=O)c2ccccc2o1	ZINC000819329361	HG	On-Demand	Anodyne	BCHE	43	50
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc(=O)c2ccccc2o1	ZINC000819329361	HG	On-Demand	Anodyne	TNKS	22	42
C[C@H](CC(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1)C1CC1	ZINC000819329368	EG	On-Demand	Anodyne	MMP2	49	35
C[C@@H](CC(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1)C1CC1	ZINC000819329369	EG	On-Demand	Anodyne	MMP2	49	35
O=C(/C=C/c1ccnc(Cl)c1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329380	GG	On-Demand	Anodyne	HDAC9	21	40
O=C(/C=C/c1ccnc(Cl)c1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329380	GG	On-Demand	Anodyne	HDAC7	32	40
O=C(/C=C\c1ccnc(Cl)c1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329381	GG	On-Demand	Anodyne	HDAC9	21	40
O=C(/C=C\c1ccnc(Cl)c1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329381	GG	On-Demand	Anodyne	HDAC7	32	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc2nn[nH]c2cc1F	ZINC000819329382	GE	On-Demand	Anodyne	ALPL	41	35
COC(=O)N[C@@H](CC(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329383	HE	On-Demand	Anodyne	CTSB	35	40
COC(=O)N[C@@H](CC(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329383	HE	On-Demand	Anodyne	CTSK	38	47
COC(=O)N[C@@H](CC(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329383	HE	On-Demand	Anodyne	CTSL	34	40
COC(=O)N[C@@H](CC(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329383	HE	On-Demand	Anodyne	CAPNS1	57	33
COC(=O)N[C@@H](CC(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329383	HE	On-Demand	Anodyne	CTSS	24	41
COC(=O)N[C@@H](CC(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329383	HE	On-Demand	Anodyne	CAPN1	86	42
COC(=O)N[C@@H](CC(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329383	HE	On-Demand	Anodyne	CAPN2	115	41
COC(=O)N[C@@H](CC(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329383	HE	On-Demand	Anodyne	FPR1	45	42
COC(=O)N[C@@H](CC(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329383	HE	On-Demand	Anodyne	NPR	56	35
COC(=O)N[C@H](CC(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329384	HE	On-Demand	Anodyne	CTSB	35	40
COC(=O)N[C@H](CC(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329384	HE	On-Demand	Anodyne	CTSK	38	47
COC(=O)N[C@H](CC(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329384	HE	On-Demand	Anodyne	CTSL	34	40
COC(=O)N[C@H](CC(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329384	HE	On-Demand	Anodyne	CAPNS1	57	33
COC(=O)N[C@H](CC(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329384	HE	On-Demand	Anodyne	CTSS	24	41
COC(=O)N[C@H](CC(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329384	HE	On-Demand	Anodyne	CAPN1	86	42
COC(=O)N[C@H](CC(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329384	HE	On-Demand	Anodyne	CAPN2	115	41
COC(=O)N[C@H](CC(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329384	HE	On-Demand	Anodyne	FPR1	45	42
COC(=O)N[C@H](CC(C)C)C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329384	HE	On-Demand	Anodyne	NPR	56	35
NS(=O)(=O)c1cc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)ccc1F	ZINC000819329385	ID	On-Demand	Anodyne	CA2	64	54
NS(=O)(=O)c1cc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)ccc1F	ZINC000819329385	ID	On-Demand	Anodyne	CA1	45	54
NS(=O)(=O)c1cc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)ccc1F	ZINC000819329385	ID	On-Demand	Anodyne	CA7	27	40
NS(=O)(=O)c1cc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)ccc1F	ZINC000819329385	ID	On-Demand	Anodyne	CA4	45	54
NS(=O)(=O)c1cc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)ccc1F	ZINC000819329385	ID	On-Demand	Anodyne	CA14	18	40
NS(=O)(=O)c1cc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)ccc1F	ZINC000819329385	ID	On-Demand	Anodyne	CA12	27	42
NS(=O)(=O)c1cc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)ccc1F	ZINC000819329385	ID	On-Demand	Anodyne	CA9	31	41
NS(=O)(=O)c1cc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)ccc1F	ZINC000819329385	ID	On-Demand	Anodyne	CYNT	30	40
NC(=S)c1ccc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000819329393	GF	On-Demand	Anodyne	CA2	32	47
NC(=S)c1ccc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000819329393	GF	On-Demand	Anodyne	CA1	19	47
NC(=S)c1ccc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000819329393	GF	On-Demand	Anodyne	CA9	18	40
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819329403	IG	On-Demand	Anodyne	SSTR2	43	35
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819329403	IG	On-Demand	Anodyne	APP	54	37
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819329403	IG	On-Demand	Anodyne	EPHX2	21	42
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819329403	IG	On-Demand	Anodyne	MMP1	15	44
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819329403	IG	On-Demand	Anodyne	GPR119	44	42
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819329403	IG	On-Demand	Anodyne	SFRP1	52	40
CC(C)(C)OC(=O)N1CCC[C@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819329403	IG	On-Demand	Anodyne	WNT3	41	35
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819329404	IG	On-Demand	Anodyne	SSTR2	43	35
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819329404	IG	On-Demand	Anodyne	APP	54	37
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819329404	IG	On-Demand	Anodyne	EPHX2	21	42
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819329404	IG	On-Demand	Anodyne	MMP1	15	44
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819329404	IG	On-Demand	Anodyne	GPR119	44	42
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819329404	IG	On-Demand	Anodyne	SFRP1	52	40
CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000819329404	IG	On-Demand	Anodyne	WNT3	41	35
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc2ccccc2oc1=O	ZINC000819329412	HG	On-Demand	Anodyne	MAOB	16	52
COc1cccc(C2=NO[C@H](C(=O)NCCCS(=O)(=O)c3ccc(Cl)cc3)C2)c1	ZINC000819329413	IF	On-Demand	Anodyne	LUCI_PHOPY	30	44
COc1cccc(C2=NO[C@@H](C(=O)NCCCS(=O)(=O)c3ccc(Cl)cc3)C2)c1	ZINC000819329414	IF	On-Demand	Anodyne	LUCI_PHOPY	30	44
CCCCCCC(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329415	EH	On-Demand	Anodyne	CNR1	16	47
CCCCCCC(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329415	EH	On-Demand	Anodyne	ASAH1	75	35
CCC(CC)(CNC[C@@H](O)c1cccnc1)OC	ZINC000819329474	CD	On-Demand	Anodyne	ADRB2	23	45
CCC(CC)(CNC[C@@H](O)c1cccnc1)OC	ZINC000819329474	CD	On-Demand	Anodyne	ADRB1	25	45
CCC(CC)(CNC[C@@H](O)c1cccnc1)OC	ZINC000819329474	CD	On-Demand	Anodyne	ADRB3	92	45
CCC(CC)(CNC[C@H](O)c1cccnc1)OC	ZINC000819329475	CD	On-Demand	Anodyne	ADRB2	23	45
CCC(CC)(CNC[C@H](O)c1cccnc1)OC	ZINC000819329475	CD	On-Demand	Anodyne	ADRB1	25	45
CCC(CC)(CNC[C@H](O)c1cccnc1)OC	ZINC000819329475	CD	On-Demand	Anodyne	ADRB3	92	45
O[C@@H](CNC[C@H](c1ccccc1)C1CC1)c1ccccc1	ZINC000819329478	CH	On-Demand	Anodyne	AOC3	15	49
O[C@@H](CNC[C@@H](c1ccccc1)C1CC1)c1ccccc1	ZINC000819329479	CH	On-Demand	Anodyne	AOC3	15	49
O[C@H](CNC[C@@H](c1ccccc1)C1CC1)c1ccccc1	ZINC000819329480	CH	On-Demand	Anodyne	AOC3	15	49
O[C@H](CNC[C@H](c1ccccc1)C1CC1)c1ccccc1	ZINC000819329481	CH	On-Demand	Anodyne	AOC3	15	49
O=C(CCc1cccc(OC(F)F)c1)NCC[C@H](O)c1ccccc1	ZINC000819329533	EG	On-Demand	Anodyne	PLA2G4A	27	42
O=C(CCc1cccc(OC(F)F)c1)NCC[C@H](O)c1ccccc1	ZINC000819329533	EG	On-Demand	Anodyne	CRTM	53	41
O=C(CCc1cccc(OC(F)F)c1)NCC[C@@H](O)c1ccccc1	ZINC000819329535	EG	On-Demand	Anodyne	PLA2G4A	27	42
O=C(CCc1cccc(OC(F)F)c1)NCC[C@@H](O)c1ccccc1	ZINC000819329535	EG	On-Demand	Anodyne	CRTM	53	41
O[C@H](CN[C@@H]1C[C@@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819329544	CG	On-Demand	Anodyne	SLC6A3	23	56
O[C@H](CN[C@@H]1C[C@@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819329544	CG	On-Demand	Anodyne	SLC18A3	20	49
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819329545	CG	On-Demand	Anodyne	SLC6A3	23	56
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(F)cc2)C1)c1ccccc1	ZINC000819329545	CG	On-Demand	Anodyne	SLC18A3	20	49
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(F)cc1	ZINC000819329547	EG	On-Demand	Anodyne	ADRB2	27	42
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(F)cc1	ZINC000819329547	EG	On-Demand	Anodyne	ADRB3	48	40
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(F)cc1	ZINC000819329549	EG	On-Demand	Anodyne	ADRB2	27	42
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(F)cc1	ZINC000819329549	EG	On-Demand	Anodyne	ADRB3	48	40
Cc1cc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c(C)n1-c1ccccn1	ZINC000819329583	IH	On-Demand	Clean	HTR2C	16	41
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329584	IG	On-Demand	Anodyne	APP	45	36
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819329586	IG	On-Demand	Anodyne	APP	45	36
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NC(C1CC1)C1CC1	ZINC000819329590	HG	On-Demand	Anodyne	CAPN2	45	33
CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NC(C1CC1)C1CC1	ZINC000819329590	HG	On-Demand	Anodyne	FPR1	38	40
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NC(C1CC1)C1CC1	ZINC000819329592	HG	On-Demand	Anodyne	CAPN2	45	33
CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NC(C1CC1)C1CC1	ZINC000819329592	HG	On-Demand	Anodyne	FPR1	38	40
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NC(C1CC1)C1CC1	ZINC000819329594	HG	On-Demand	Anodyne	CAPN2	45	33
CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NC(C1CC1)C1CC1	ZINC000819329594	HG	On-Demand	Anodyne	FPR1	38	40
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NC(C1CC1)C1CC1	ZINC000819329595	HG	On-Demand	Anodyne	CAPN2	45	33
CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NC(C1CC1)C1CC1	ZINC000819329595	HG	On-Demand	Anodyne	FPR1	38	40
O=[N+]([O-])c1cccc(OC[C@H](O)CNOCC2CC2)c1	ZINC000819329596	CD	On-Demand	Bother	ADRB1	25	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNOCC2CC2)c1	ZINC000819329596	CD	On-Demand	Bother	CACNA1C	19	40
O=[N+]([O-])c1cccc(OC[C@H](O)CNOCC2CC2)c1	ZINC000819329596	CD	On-Demand	Bother	CACNA1D	24	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOCC2CC2)c1	ZINC000819329598	CD	On-Demand	Bother	ADRB1	25	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOCC2CC2)c1	ZINC000819329598	CD	On-Demand	Bother	CACNA1C	19	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOCC2CC2)c1	ZINC000819329598	CD	On-Demand	Bother	CACNA1D	24	40
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(Cl)c(F)c1	ZINC000819329623	FH	On-Demand	Anodyne	ADRB1	23	41
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(Cl)c(F)c1	ZINC000819329623	FH	On-Demand	Anodyne	ADRB3	36	41
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(Cl)c(F)c1	ZINC000819329626	FH	On-Demand	Anodyne	ADRB1	23	41
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(Cl)c(F)c1	ZINC000819329626	FH	On-Demand	Anodyne	ADRB3	36	41
O[C@@H](CNOCC1CC1)COc1cccc2ccccc12	ZINC000819329636	CF	On-Demand	Anodyne	ADRB2	35	57
O[C@@H](CNOCC1CC1)COc1cccc2ccccc12	ZINC000819329636	CF	On-Demand	Anodyne	ADRB1	59	39
O[C@@H](CNOCC1CC1)COc1cccc2ccccc12	ZINC000819329636	CF	On-Demand	Anodyne	ADRB3	15	57
O[C@@H](CNOCC1CC1)COc1cccc2ccccc12	ZINC000819329636	CF	On-Demand	Anodyne	CYP2D6	17	44
O[C@H](CNOCC1CC1)COc1cccc2ccccc12	ZINC000819329637	CF	On-Demand	Anodyne	ADRB2	35	57
O[C@H](CNOCC1CC1)COc1cccc2ccccc12	ZINC000819329637	CF	On-Demand	Anodyne	ADRB1	59	39
O[C@H](CNOCC1CC1)COc1cccc2ccccc12	ZINC000819329637	CF	On-Demand	Anodyne	ADRB3	15	57
O[C@H](CNOCC1CC1)COc1cccc2ccccc12	ZINC000819329637	CF	On-Demand	Anodyne	CYP2D6	17	44
COc1ccc(OC)c([C@H](O)CNC[C@@H](c2ccccc2)C2CC2)c1	ZINC000819329641	EH	On-Demand	Anodyne	ADRB2	15	42
COc1ccc(OC)c([C@H](O)CNC[C@H](c2ccccc2)C2CC2)c1	ZINC000819329642	EH	On-Demand	Anodyne	ADRB2	15	42
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1ccccc1	ZINC000819329645	DF	On-Demand	Anodyne	ADRB2	35	47
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1ccccc1	ZINC000819329645	DF	On-Demand	Anodyne	ADRB1	41	41
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1ccccc1	ZINC000819329645	DF	On-Demand	Anodyne	ADRB3	92	43
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1ccccc1	ZINC000819329646	DF	On-Demand	Anodyne	ADRB2	35	47
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1ccccc1	ZINC000819329646	DF	On-Demand	Anodyne	ADRB1	41	41
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1ccccc1	ZINC000819329646	DF	On-Demand	Anodyne	ADRB3	92	43
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccnc(Cl)c1	ZINC000819329655	FF	On-Demand	Anodyne	TBXAS1	22	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccnc(Cl)c1	ZINC000819329655	FF	On-Demand	Anodyne	KDM4E	23	42
O=Cc1cccc(OCC(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819329658	GF	On-Demand	Anodyne	CRTM	30	42
O=C(c1nc(Cl)ccc1F)N1CCC[C@@H](O)CC1	ZINC000819329660	CD	On-Demand	Anodyne	L3MBTL3	42	35
O=C(c1nc(Cl)ccc1F)N1CCC[C@H](O)CC1	ZINC000819329661	CD	On-Demand	Anodyne	L3MBTL3	42	35
CCOC(=O)N[C@H](C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1)C(C)C	ZINC000819329664	HE	On-Demand	Anodyne	HLA-DRB1	79	45
CCOC(=O)N[C@H](C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1)C(C)C	ZINC000819329664	HE	On-Demand	Anodyne	CAPN1	15	40
CCOC(=O)N[C@@H](C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1)C(C)C	ZINC000819329665	HE	On-Demand	Anodyne	HLA-DRB1	79	45
CCOC(=O)N[C@@H](C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1)C(C)C	ZINC000819329665	HE	On-Demand	Anodyne	CAPN1	15	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1sccc1-c1ccc(F)cc1	ZINC000819329668	IJ	On-Demand	Anodyne	ALPL	40	34
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccccc1SC(F)(F)F	ZINC000819329676	IJ	On-Demand	Anodyne	SLC6A5	17	40
O=C(NCCOC1CCC1)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819329680	GG	On-Demand	Anodyne	CNR1	53	32
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccccc1NC(=O)C1CC1	ZINC000819329692	HG	On-Demand	Anodyne	SLC6A5	24	41
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1	ZINC000819329705	FH	On-Demand	Anodyne	CHRM1	15	46
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1	ZINC000819329705	FH	On-Demand	Anodyne	DRD2	16	45
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1	ZINC000819329705	FH	On-Demand	Anodyne	SLC6A3	33	50
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1	ZINC000819329705	FH	On-Demand	Anodyne	KCNH2	17	40
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1	ZINC000819329705	FH	On-Demand	Anodyne	LTA4H	17	48
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1	ZINC000819329705	FH	On-Demand	Anodyne	SIGMAR1	15	44
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1	ZINC000819329705	FH	On-Demand	Anodyne	ACHP_LYMST	24	44
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1	ZINC000819329705	FH	On-Demand	Anodyne	Q8WSF8_APLCA	39	44
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1	ZINC000819329706	FH	On-Demand	Anodyne	CHRM1	15	46
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1	ZINC000819329706	FH	On-Demand	Anodyne	DRD2	16	45
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1	ZINC000819329706	FH	On-Demand	Anodyne	SLC6A3	33	50
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1	ZINC000819329706	FH	On-Demand	Anodyne	KCNH2	17	40
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1	ZINC000819329706	FH	On-Demand	Anodyne	LTA4H	17	48
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1	ZINC000819329706	FH	On-Demand	Anodyne	SIGMAR1	15	44
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1	ZINC000819329706	FH	On-Demand	Anodyne	ACHP_LYMST	24	44
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)c1ccccc1	ZINC000819329706	FH	On-Demand	Anodyne	Q8WSF8_APLCA	39	44
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccc(F)cc1	ZINC000819329722	GH	On-Demand	Anodyne	ADRB2	43	45
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccc(F)cc1	ZINC000819329722	GH	On-Demand	Anodyne	ADRB1	59	45
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccc(F)cc1	ZINC000819329722	GH	On-Demand	Anodyne	DRD2	19	44
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccc(F)cc1	ZINC000819329722	GH	On-Demand	Anodyne	SLC6A3	23	48
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccc(F)cc1	ZINC000819329722	GH	On-Demand	Anodyne	ADRB3	44	45
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccc(F)cc1	ZINC000819329722	GH	On-Demand	Anodyne	LTA4H	23	44
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccc(F)cc1	ZINC000819329722	GH	On-Demand	Anodyne	CCR3	21	41
O[C@@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccc(F)cc1	ZINC000819329722	GH	On-Demand	Anodyne	ABCB1	23	43
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccc(F)cc1	ZINC000819329723	GH	On-Demand	Anodyne	ADRB2	43	45
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccc(F)cc1	ZINC000819329723	GH	On-Demand	Anodyne	ADRB1	59	45
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccc(F)cc1	ZINC000819329723	GH	On-Demand	Anodyne	DRD2	19	44
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccc(F)cc1	ZINC000819329723	GH	On-Demand	Anodyne	SLC6A3	23	48
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccc(F)cc1	ZINC000819329723	GH	On-Demand	Anodyne	ADRB3	44	45
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccc(F)cc1	ZINC000819329723	GH	On-Demand	Anodyne	LTA4H	23	44
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccc(F)cc1	ZINC000819329723	GH	On-Demand	Anodyne	CCR3	21	41
O[C@H](CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1)COc1ccc(F)cc1	ZINC000819329723	GH	On-Demand	Anodyne	ABCB1	23	43
O[C@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819329734	EG	On-Demand	Anodyne	ADRB1	34	44
O[C@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819329734	EG	On-Demand	Anodyne	ADRB3	53	46
O[C@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819329734	EG	On-Demand	Anodyne	CYP3A4	48	39
O[C@H](CN[C@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819329735	EG	On-Demand	Anodyne	ADRB1	34	44
O[C@H](CN[C@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819329735	EG	On-Demand	Anodyne	ADRB3	53	46
O[C@H](CN[C@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819329735	EG	On-Demand	Anodyne	CYP3A4	48	39
O[C@@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819329736	EG	On-Demand	Anodyne	ADRB1	34	44
O[C@@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819329736	EG	On-Demand	Anodyne	ADRB3	53	46
O[C@@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819329736	EG	On-Demand	Anodyne	CYP3A4	48	39
O[C@@H](CN[C@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819329737	EG	On-Demand	Anodyne	ADRB1	34	44
O[C@@H](CN[C@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819329737	EG	On-Demand	Anodyne	ADRB3	53	46
O[C@@H](CN[C@H]1CCN(c2ccccc2F)C1)c1cccc(Cl)c1	ZINC000819329737	EG	On-Demand	Anodyne	CYP3A4	48	39
O[C@H](CCc1ccccc1)CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1	ZINC000819329744	GI	On-Demand	Anodyne	DRD2	16	44
O[C@H](CCc1ccccc1)CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1	ZINC000819329744	GI	On-Demand	Anodyne	SLC6A3	15	40
O[C@H](CCc1ccccc1)CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1	ZINC000819329744	GI	On-Demand	Anodyne	SLC18A2	48	40
O[C@H](CCc1ccccc1)CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1	ZINC000819329744	GI	On-Demand	Anodyne	LTA4H	15	44
O[C@@H](CCc1ccccc1)CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1	ZINC000819329745	GI	On-Demand	Anodyne	DRD2	16	44
O[C@@H](CCc1ccccc1)CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1	ZINC000819329745	GI	On-Demand	Anodyne	SLC6A3	15	40
O[C@@H](CCc1ccccc1)CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1	ZINC000819329745	GI	On-Demand	Anodyne	SLC18A2	48	40
O[C@@H](CCc1ccccc1)CNC1C[C@@H]2CCC[C@H](C1)N2Cc1ccccc1	ZINC000819329745	GI	On-Demand	Anodyne	LTA4H	15	44
O[C@@H](CN[C@@H]1CCN(c2ccccc2F)C1)c1ccc(Cl)cc1	ZINC000819329753	EG	On-Demand	Anodyne	ADRB3	22	43
O[C@@H](CN[C@H]1CCN(c2ccccc2F)C1)c1ccc(Cl)cc1	ZINC000819329754	EG	On-Demand	Anodyne	ADRB3	22	43
CC[C@H](C)CONC[C@@H](O)COc1cccc(C)c1	ZINC000819329755	CE	On-Demand	Anodyne	ADRB2	34	64
CC[C@H](C)CONC[C@@H](O)COc1cccc(C)c1	ZINC000819329755	CE	On-Demand	Anodyne	ADRB1	33	64
CC[C@H](C)CONC[C@@H](O)COc1cccc(C)c1	ZINC000819329755	CE	On-Demand	Anodyne	PDS	68	43
CC[C@H](C)CONC[C@H](O)COc1cccc(C)c1	ZINC000819329756	CE	On-Demand	Anodyne	ADRB2	34	64
CC[C@H](C)CONC[C@H](O)COc1cccc(C)c1	ZINC000819329756	CE	On-Demand	Anodyne	ADRB1	33	64
CC[C@H](C)CONC[C@H](O)COc1cccc(C)c1	ZINC000819329756	CE	On-Demand	Anodyne	PDS	68	43
CC[C@@H](C)CONC[C@H](O)COc1cccc(C)c1	ZINC000819329757	CE	On-Demand	Anodyne	ADRB2	34	64
CC[C@@H](C)CONC[C@H](O)COc1cccc(C)c1	ZINC000819329757	CE	On-Demand	Anodyne	ADRB1	33	64
CC[C@@H](C)CONC[C@H](O)COc1cccc(C)c1	ZINC000819329757	CE	On-Demand	Anodyne	PDS	68	43
CC[C@@H](C)CONC[C@@H](O)COc1cccc(C)c1	ZINC000819329758	CE	On-Demand	Anodyne	ADRB2	34	64
CC[C@@H](C)CONC[C@@H](O)COc1cccc(C)c1	ZINC000819329758	CE	On-Demand	Anodyne	ADRB1	33	64
CC[C@@H](C)CONC[C@@H](O)COc1cccc(C)c1	ZINC000819329758	CE	On-Demand	Anodyne	PDS	68	43
CC[C@@H](C)CONC[C@H](O)COc1ccccc1Cl	ZINC000819329761	CF	On-Demand	Anodyne	ADRB2	30	52
CC[C@H](C)CONC[C@@H](O)COc1ccccc1Cl	ZINC000819329762	CF	On-Demand	Anodyne	ADRB2	30	52
CC[C@H](C)CONC[C@H](O)COc1ccccc1Cl	ZINC000819329763	CF	On-Demand	Anodyne	ADRB2	30	52
CC[C@@H](C)CONC[C@@H](O)COc1ccccc1Cl	ZINC000819329764	CF	On-Demand	Anodyne	ADRB2	30	52
CC(=O)Nc1ccc(OC(=O)C[C@H](C)n2cccn2)c(F)c1	ZINC000819329790	DF	On-Demand	Anodyne	MET	68	36
CC(=O)Nc1ccc(OC(=O)C[C@@H](C)n2cccn2)c(F)c1	ZINC000819329791	DF	On-Demand	Anodyne	MET	68	36
CC(=O)Nc1cccc(CC(=O)NCC[C@@H](O)c2ccccc2)c1	ZINC000819329796	EE	On-Demand	Anodyne	ADRB2	50	39
CC(=O)Nc1cccc(CC(=O)NCC[C@@H](O)c2ccccc2)c1	ZINC000819329796	EE	On-Demand	Anodyne	KCNK3	68	35
CC(=O)Nc1cccc(CC(=O)NCC[C@H](O)c2ccccc2)c1	ZINC000819329797	EE	On-Demand	Anodyne	ADRB2	50	39
CC(=O)Nc1cccc(CC(=O)NCC[C@H](O)c2ccccc2)c1	ZINC000819329797	EE	On-Demand	Anodyne	KCNK3	68	35
CCC(CC)(CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819329809	CG	On-Demand	Anodyne	ADRB2	19	44
CCC(CC)(CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819329809	CG	On-Demand	Anodyne	ADRB1	38	46
CCC(CC)(CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819329809	CG	On-Demand	Anodyne	ADRB3	57	46
CCC(CC)(CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819329810	CG	On-Demand	Anodyne	ADRB2	19	44
CCC(CC)(CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819329810	CG	On-Demand	Anodyne	ADRB1	38	46
CCC(CC)(CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819329810	CG	On-Demand	Anodyne	ADRB3	57	46
CC(C)(C)C(C)(C)CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819329842	CG	On-Demand	Bother	CACNA1D	42	33
CC(C)(C)C(C)(C)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819329843	CG	On-Demand	Bother	CACNA1D	42	33
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(Cl)cc1Cl	ZINC000819329886	GI	On-Demand	Anodyne	ADRB1	27	42
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(Cl)cc1Cl	ZINC000819329886	GI	On-Demand	Anodyne	ADRB3	21	42
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(Cl)cc1Cl	ZINC000819329887	GI	On-Demand	Anodyne	ADRB1	27	42
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(Cl)cc1Cl	ZINC000819329887	GI	On-Demand	Anodyne	ADRB3	21	42
O[C@H](CNOCC1CC1)COc1ccc2c(c1)OCO2	ZINC000819329900	CD	On-Demand	Anodyne	ADRB1	15	45
O[C@@H](CNOCC1CC1)COc1ccc2c(c1)OCO2	ZINC000819329901	CD	On-Demand	Anodyne	ADRB1	15	45
CC(=O)Nc1ccc(OC[C@@H](O)CNOCC2CC2)cc1	ZINC000819329933	CD	On-Demand	Anodyne	ADRB2	43	60
CC(=O)Nc1ccc(OC[C@@H](O)CNOCC2CC2)cc1	ZINC000819329933	CD	On-Demand	Anodyne	ADRB1	79	60
CC(=O)Nc1ccc(OC[C@@H](O)CNOCC2CC2)cc1	ZINC000819329933	CD	On-Demand	Anodyne	ADRB3	48	52
CC(=O)Nc1ccc(OC[C@H](O)CNOCC2CC2)cc1	ZINC000819329934	CD	On-Demand	Anodyne	ADRB2	43	60
CC(=O)Nc1ccc(OC[C@H](O)CNOCC2CC2)cc1	ZINC000819329934	CD	On-Demand	Anodyne	ADRB1	79	60
CC(=O)Nc1ccc(OC[C@H](O)CNOCC2CC2)cc1	ZINC000819329934	CD	On-Demand	Anodyne	ADRB3	48	52
O=C(CCNOCC1CC1)Nc1cccnc1	ZINC000819329936	BD	On-Demand	Anodyne	NAMPT	37	41
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819329940	DI	On-Demand	Anodyne	ADRB1	29	42
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819329940	DI	On-Demand	Anodyne	ADRB3	46	45
O[C@H](CN[C@@H]1C[C@@H](c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819329941	DI	On-Demand	Anodyne	ADRB1	29	42
O[C@H](CN[C@@H]1C[C@@H](c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819329941	DI	On-Demand	Anodyne	ADRB3	46	45
O[C@H](CNOCC1CC1)COc1cccc2[nH]ccc12	ZINC000819329962	CD	On-Demand	Anodyne	ADRB2	21	67
O[C@H](CNOCC1CC1)COc1cccc2[nH]ccc12	ZINC000819329962	CD	On-Demand	Anodyne	ADRB1	38	62
O[C@H](CNOCC1CC1)COc1cccc2[nH]ccc12	ZINC000819329962	CD	On-Demand	Anodyne	HTR1A	17	67
O[C@H](CNOCC1CC1)COc1cccc2[nH]ccc12	ZINC000819329962	CD	On-Demand	Anodyne	SLC6A4	19	44
O[C@@H](CNOCC1CC1)COc1cccc2[nH]ccc12	ZINC000819329963	CD	On-Demand	Anodyne	ADRB2	21	67
O[C@@H](CNOCC1CC1)COc1cccc2[nH]ccc12	ZINC000819329963	CD	On-Demand	Anodyne	ADRB1	38	62
O[C@@H](CNOCC1CC1)COc1cccc2[nH]ccc12	ZINC000819329963	CD	On-Demand	Anodyne	HTR1A	17	67
O[C@@H](CNOCC1CC1)COc1cccc2[nH]ccc12	ZINC000819329963	CD	On-Demand	Anodyne	SLC6A4	19	44
CCOc1ccc(OC[C@H](O)CNOCC2CC2)cc1	ZINC000819329971	CD	On-Demand	Anodyne	ADRB2	39	54
CCOc1ccc(OC[C@H](O)CNOCC2CC2)cc1	ZINC000819329971	CD	On-Demand	Anodyne	ADRB1	49	56
CCOc1ccc(OC[C@@H](O)CNOCC2CC2)cc1	ZINC000819329972	CD	On-Demand	Anodyne	ADRB2	39	54
CCOc1ccc(OC[C@@H](O)CNOCC2CC2)cc1	ZINC000819329972	CD	On-Demand	Anodyne	ADRB1	49	56
CC[C@@H](C)CONC[C@@H](O)COc1ccc(SC)cc1	ZINC000819329991	CF	On-Demand	Anodyne	ADRB2	24	45
CC[C@@H](C)CONC[C@@H](O)COc1ccc(SC)cc1	ZINC000819329991	CF	On-Demand	Anodyne	ADRB1	23	45
CC[C@@H](C)CONC[C@H](O)COc1ccc(SC)cc1	ZINC000819329992	CF	On-Demand	Anodyne	ADRB2	24	45
CC[C@@H](C)CONC[C@H](O)COc1ccc(SC)cc1	ZINC000819329992	CF	On-Demand	Anodyne	ADRB1	23	45
CC[C@H](C)CONC[C@@H](O)COc1ccc(SC)cc1	ZINC000819329993	CF	On-Demand	Anodyne	ADRB2	24	45
CC[C@H](C)CONC[C@@H](O)COc1ccc(SC)cc1	ZINC000819329993	CF	On-Demand	Anodyne	ADRB1	23	45
CC[C@H](C)CONC[C@H](O)COc1ccc(SC)cc1	ZINC000819329994	CF	On-Demand	Anodyne	ADRB2	24	45
CC[C@H](C)CONC[C@H](O)COc1ccc(SC)cc1	ZINC000819329994	CF	On-Demand	Anodyne	ADRB1	23	45
Cc1ccoc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819330010	CE	On-Demand	Bother	CACNA1C	48	36
Cc1ccoc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819330010	CE	On-Demand	Bother	CACNA1D	74	36
Cc1ccoc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819330011	CE	On-Demand	Bother	CACNA1C	48	36
Cc1ccoc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819330011	CE	On-Demand	Bother	CACNA1D	74	36
CCC(CC)(CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)OC	ZINC000819330044	FF	On-Demand	Anodyne	GPR119	27	42
CCC(CC)(CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)OC	ZINC000819330045	FF	On-Demand	Anodyne	GPR119	27	42
O=C(/C=C\c1ccc(Cl)cc1)NC(C1CC1)C1CC1	ZINC000819330129	CH	On-Demand	Anodyne	BOTA	23	41
Cn1c(=O)c(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc2ccccc21	ZINC000819330131	GG	On-Demand	Anodyne	CCR2	28	40
Cn1c(=O)c(CNC[C@H](O)c2cccc(C(F)(F)F)c2)cc2ccccc21	ZINC000819330133	GG	On-Demand	Anodyne	CCR2	28	40
Cc1ccc2c(c1)[C@H](NC[C@H](O)c1cccnc1)CCC2	ZINC000819330135	CG	On-Demand	Anodyne	ADRB3	61	46
Cc1ccc2c(c1)[C@H](NC[C@H](O)c1cccnc1)CCC2	ZINC000819330135	CG	On-Demand	Anodyne	KCNN3	15	44
Cc1ccc2c(c1)[C@H](NC[C@@H](O)c1cccnc1)CCC2	ZINC000819330137	CG	On-Demand	Anodyne	ADRB3	61	46
Cc1ccc2c(c1)[C@H](NC[C@@H](O)c1cccnc1)CCC2	ZINC000819330137	CG	On-Demand	Anodyne	KCNN3	15	44
CC[C@H](C)CONC[C@H](O)CCc1ccccc1	ZINC000819330139	CF	On-Demand	Anodyne	ADRB2	18	48
CC[C@@H](C)CONC[C@@H](O)CCc1ccccc1	ZINC000819330140	CF	On-Demand	Anodyne	ADRB2	18	48
CC[C@@H](C)CONC[C@H](O)CCc1ccccc1	ZINC000819330142	CF	On-Demand	Anodyne	ADRB2	18	48
CCC(CC)(CNC(=O)Cc1cccc(NC(C)=O)c1)SC	ZINC000819330143	DG	On-Demand	Anodyne	KCNK3	48	32
CC[C@H](C)CONC[C@@H](O)CCc1ccccc1	ZINC000819330144	CF	On-Demand	Anodyne	ADRB2	18	48
CC[C@H](C)CONC[C@H](O)COc1cccc(Br)c1	ZINC000819330149	EF	On-Demand	Anodyne	ADRB2	24	49
CC[C@H](C)CONC[C@H](O)COc1cccc(Br)c1	ZINC000819330149	EF	On-Demand	Anodyne	ADRB1	24	47
CC[C@H](C)CONC[C@H](O)COc1cccc(Br)c1	ZINC000819330149	EF	On-Demand	Anodyne	PDS	65	45
CC[C@@H](C)CONC[C@@H](O)COc1cccc(Br)c1	ZINC000819330150	EF	On-Demand	Anodyne	ADRB2	24	49
CC[C@@H](C)CONC[C@@H](O)COc1cccc(Br)c1	ZINC000819330150	EF	On-Demand	Anodyne	ADRB1	24	47
CC[C@@H](C)CONC[C@@H](O)COc1cccc(Br)c1	ZINC000819330150	EF	On-Demand	Anodyne	PDS	65	45
CC[C@H](C)CONC[C@@H](O)COc1cccc(Br)c1	ZINC000819330152	EF	On-Demand	Anodyne	ADRB2	24	49
CC[C@H](C)CONC[C@@H](O)COc1cccc(Br)c1	ZINC000819330152	EF	On-Demand	Anodyne	ADRB1	24	47
CC[C@H](C)CONC[C@@H](O)COc1cccc(Br)c1	ZINC000819330152	EF	On-Demand	Anodyne	PDS	65	45
CC[C@@H](C)CONC[C@H](O)COc1cccc(Br)c1	ZINC000819330154	EF	On-Demand	Anodyne	ADRB2	24	49
CC[C@@H](C)CONC[C@H](O)COc1cccc(Br)c1	ZINC000819330154	EF	On-Demand	Anodyne	ADRB1	24	47
CC[C@@H](C)CONC[C@H](O)COc1cccc(Br)c1	ZINC000819330154	EF	On-Demand	Anodyne	PDS	65	45
CC[C@@H](C)CONC[C@H](O)COc1cc(C)cc(C)c1	ZINC000819330177	CF	On-Demand	Anodyne	ADRB2	18	61
CC[C@@H](C)CONC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000819330178	CF	On-Demand	Anodyne	ADRB2	18	61
CC[C@H](C)CONC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000819330179	CF	On-Demand	Anodyne	ADRB2	18	61
CC[C@H](C)CONC[C@H](O)COc1cc(C)cc(C)c1	ZINC000819330180	CF	On-Demand	Anodyne	ADRB2	18	61
OC1(CNC2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)CCCC1	ZINC000819330189	EG	On-Demand	Anodyne	DRD2	19	45
OC1(CNC2C[C@@H]3CCC[C@H](C2)N3Cc2ccccc2)CCCC1	ZINC000819330189	EG	On-Demand	Anodyne	LTA4H	15	48
O[C@@H](CNC[C@H](c1ccccc1)C1CC1)c1cccnc1	ZINC000819330202	CF	On-Demand	Anodyne	ADRB2	22	47
O[C@@H](CNC[C@H](c1ccccc1)C1CC1)c1cccnc1	ZINC000819330202	CF	On-Demand	Anodyne	ADRB1	24	43
O[C@@H](CNC[C@H](c1ccccc1)C1CC1)c1cccnc1	ZINC000819330202	CF	On-Demand	Anodyne	ADRB3	94	47
O[C@H](CNC[C@H](c1ccccc1)C1CC1)c1cccnc1	ZINC000819330204	CF	On-Demand	Anodyne	ADRB2	22	47
O[C@H](CNC[C@H](c1ccccc1)C1CC1)c1cccnc1	ZINC000819330204	CF	On-Demand	Anodyne	ADRB1	24	43
O[C@H](CNC[C@H](c1ccccc1)C1CC1)c1cccnc1	ZINC000819330204	CF	On-Demand	Anodyne	ADRB3	94	47
O[C@@H](CNC[C@@H](c1ccccc1)C1CC1)c1cccnc1	ZINC000819330206	CF	On-Demand	Anodyne	ADRB2	22	47
O[C@@H](CNC[C@@H](c1ccccc1)C1CC1)c1cccnc1	ZINC000819330206	CF	On-Demand	Anodyne	ADRB1	24	43
O[C@@H](CNC[C@@H](c1ccccc1)C1CC1)c1cccnc1	ZINC000819330206	CF	On-Demand	Anodyne	ADRB3	94	47
O[C@H](CNC[C@@H](c1ccccc1)C1CC1)c1cccnc1	ZINC000819330208	CF	On-Demand	Anodyne	ADRB2	22	47
O[C@H](CNC[C@@H](c1ccccc1)C1CC1)c1cccnc1	ZINC000819330208	CF	On-Demand	Anodyne	ADRB1	24	43
O[C@H](CNC[C@@H](c1ccccc1)C1CC1)c1cccnc1	ZINC000819330208	CF	On-Demand	Anodyne	ADRB3	94	47
O[C@@H](CNC[C@H](c1ccccc1)C1CC1)c1cccc(F)c1	ZINC000819330315	CH	On-Demand	Anodyne	ADRB1	16	41
O[C@@H](CNC[C@H](c1ccccc1)C1CC1)c1cccc(F)c1	ZINC000819330315	CH	On-Demand	Anodyne	ADRB3	26	41
O[C@@H](CNC[C@@H](c1ccccc1)C1CC1)c1cccc(F)c1	ZINC000819330316	CH	On-Demand	Anodyne	ADRB1	16	41
O[C@@H](CNC[C@@H](c1ccccc1)C1CC1)c1cccc(F)c1	ZINC000819330316	CH	On-Demand	Anodyne	ADRB3	26	41
O[C@H](CNC[C@@H](c1ccccc1)C1CC1)c1cccc(F)c1	ZINC000819330317	CH	On-Demand	Anodyne	ADRB1	16	41
O[C@H](CNC[C@@H](c1ccccc1)C1CC1)c1cccc(F)c1	ZINC000819330317	CH	On-Demand	Anodyne	ADRB3	26	41
O[C@H](CNC[C@H](c1ccccc1)C1CC1)c1cccc(F)c1	ZINC000819330318	CH	On-Demand	Anodyne	ADRB1	16	41
O[C@H](CNC[C@H](c1ccccc1)C1CC1)c1cccc(F)c1	ZINC000819330318	CH	On-Demand	Anodyne	ADRB3	26	41
O[C@@H](CNOCC1CC1)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819330327	FG	On-Demand	Anodyne	SLC6A4	17	42
O[C@@H](CNOCC1CC1)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819330327	FG	On-Demand	Anodyne	SLC6A3	47	44
O[C@H](CNOCC1CC1)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819330328	FG	On-Demand	Anodyne	SLC6A4	17	42
O[C@H](CNOCC1CC1)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819330328	FG	On-Demand	Anodyne	SLC6A3	47	44
O=[N+]([O-])c1cccc([C@H](O)CNOCC2CC2)c1	ZINC000819330369	CD	On-Demand	Bother	CACNA1C	39	42
O=[N+]([O-])c1cccc([C@H](O)CNOCC2CC2)c1	ZINC000819330369	CD	On-Demand	Bother	CACNA1D	61	42
O=[N+]([O-])c1cccc([C@@H](O)CNOCC2CC2)c1	ZINC000819330370	CD	On-Demand	Bother	CACNA1C	39	42
O=[N+]([O-])c1cccc([C@@H](O)CNOCC2CC2)c1	ZINC000819330370	CD	On-Demand	Bother	CACNA1D	61	42
O=[N+]([O-])c1ccccc1OC[C@H](O)CNOCC1CC1	ZINC000819330371	CD	On-Demand	Bother	ADRB2	19	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNOCC1CC1	ZINC000819330371	CD	On-Demand	Bother	ADRB1	57	34
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNOCC1CC1	ZINC000819330372	CD	On-Demand	Bother	ADRB2	19	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNOCC1CC1	ZINC000819330372	CD	On-Demand	Bother	ADRB1	57	34
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(F)cc2)C1)c1ccccc1Cl	ZINC000819330377	DI	On-Demand	Anodyne	OPRL1	17	41
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cccc(C(F)(F)F)n2)cc1	ZINC000819330378	FF	On-Demand	Bother	ADRB3	44	37
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cccc(C(F)(F)F)n2)cc1	ZINC000819330379	FF	On-Demand	Bother	ADRB3	44	37
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1cccc(Br)c1	ZINC000819330405	GH	On-Demand	Anodyne	ADRB3	59	38
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1cccc(Br)c1	ZINC000819330406	GH	On-Demand	Anodyne	ADRB3	59	38
O[C@@H](CNOCC1CC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819330424	EG	On-Demand	Anodyne	ADRB2	44	49
O[C@@H](CNOCC1CC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819330424	EG	On-Demand	Anodyne	ADRB1	64	51
O[C@@H](CNOCC1CC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819330424	EG	On-Demand	Anodyne	ADRB3	42	43
O[C@H](CNOCC1CC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819330425	EG	On-Demand	Anodyne	ADRB2	44	49
O[C@H](CNOCC1CC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819330425	EG	On-Demand	Anodyne	ADRB1	64	51
O[C@H](CNOCC1CC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819330425	EG	On-Demand	Anodyne	ADRB3	42	43
O[C@H](CNOCC1CC1)COc1ccc(-c2ccccc2)cc1	ZINC000819330448	DG	On-Demand	Anodyne	ADRB2	47	49
O[C@H](CNOCC1CC1)COc1ccc(-c2ccccc2)cc1	ZINC000819330448	DG	On-Demand	Anodyne	ADRB1	65	51
O[C@H](CNOCC1CC1)COc1ccc(-c2ccccc2)cc1	ZINC000819330448	DG	On-Demand	Anodyne	ADRB3	44	40
O[C@@H](CNOCC1CC1)COc1ccc(-c2ccccc2)cc1	ZINC000819330449	DG	On-Demand	Anodyne	ADRB2	47	49
O[C@@H](CNOCC1CC1)COc1ccc(-c2ccccc2)cc1	ZINC000819330449	DG	On-Demand	Anodyne	ADRB1	65	51
O[C@@H](CNOCC1CC1)COc1ccc(-c2ccccc2)cc1	ZINC000819330449	DG	On-Demand	Anodyne	ADRB3	44	40
O=C1CCc2cc(OC[C@H](O)CNOCC3CC3)ccc2N1	ZINC000819330451	DD	On-Demand	Anodyne	ADRB1	17	42
O=C1CCc2cc(OC[C@@H](O)CNOCC3CC3)ccc2N1	ZINC000819330452	DD	On-Demand	Anodyne	ADRB1	17	42
O=C(CCNOCC1CC1)Nc1cccc(C(F)(F)F)c1	ZINC000819330453	DF	On-Demand	Anodyne	CCR2	26	41
O=C(CCNOCC1CC1)Nc1cccc(C(F)(F)F)c1	ZINC000819330453	DF	On-Demand	Anodyne	EPHX2	15	47
O[C@H](CNOCC1CC1)COc1cccc(C(F)(F)F)c1	ZINC000819330523	DE	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CNOCC1CC1)COc1cccc(C(F)(F)F)c1	ZINC000819330523	DE	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CNOCC1CC1)COc1cccc(C(F)(F)F)c1	ZINC000819330523	DE	On-Demand	Anodyne	PDS	47	41
O[C@@H](CNOCC1CC1)COc1cccc(C(F)(F)F)c1	ZINC000819330524	DE	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CNOCC1CC1)COc1cccc(C(F)(F)F)c1	ZINC000819330524	DE	On-Demand	Anodyne	ADRB1	25	42
O[C@@H](CNOCC1CC1)COc1cccc(C(F)(F)F)c1	ZINC000819330524	DE	On-Demand	Anodyne	PDS	47	41
O[C@@H](CN[C@@H]1C[C@@H](c2ccc(F)cc2)C1)c1ccc(Cl)cc1	ZINC000819330550	DI	On-Demand	Anodyne	SLC6A3	15	45
O=C(CCNOCC1CC1)Nc1ccccc1	ZINC000819330573	BD	On-Demand	Anodyne	LTA4H	28	40
O=C(CCNOCC1CC1)Nc1ccccc1	ZINC000819330573	BD	On-Demand	Anodyne	HDAC10	21	44
O=C(CCNOCC1CC1)Nc1ccccc1	ZINC000819330573	BD	On-Demand	Anodyne	HDAC2	15	44
O=C(CCNOCC1CC1)Nc1ccccc1	ZINC000819330573	BD	On-Demand	Anodyne	HDAC6	15	44
O=C(CCNOCC1CC1)Nc1ccccc1	ZINC000819330573	BD	On-Demand	Anodyne	HDAC11	21	44
O=C(CCNOCC1CC1)Nc1cccc(Cl)c1	ZINC000819330621	CF	On-Demand	Anodyne	MCHR1	15	41
Cn1ccnc1C[C@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819330624	GF	On-Demand	Anodyne	REN	46	39
Cn1ccnc1C[C@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819330624	GF	On-Demand	Anodyne	FPR1	41	34
Cn1ccnc1C[C@@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819330625	GF	On-Demand	Anodyne	REN	46	39
Cn1ccnc1C[C@@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819330625	GF	On-Demand	Anodyne	FPR1	41	34
CC[C@@](C)(CCCNC(=O)C[S@@](=O)c1cccc(OC)c1)C1OCCO1	ZINC000819330651	GE	On-Demand	Anodyne	MTNR1A	26	40
CC[C@@](C)(CCCNC(=O)C[S@@](=O)c1cccc(OC)c1)C1OCCO1	ZINC000819330651	GE	On-Demand	Anodyne	MTNR1B	26	40
CC[C@](C)(CCCNC(=O)C[S@](=O)c1cccc(OC)c1)C1OCCO1	ZINC000819330652	GE	On-Demand	Anodyne	MTNR1A	26	40
CC[C@](C)(CCCNC(=O)C[S@](=O)c1cccc(OC)c1)C1OCCO1	ZINC000819330652	GE	On-Demand	Anodyne	MTNR1B	26	40
CC[C@](C)(CCCNC(=O)C[S@@](=O)c1cccc(OC)c1)C1OCCO1	ZINC000819330653	GE	On-Demand	Anodyne	MTNR1A	26	40
CC[C@](C)(CCCNC(=O)C[S@@](=O)c1cccc(OC)c1)C1OCCO1	ZINC000819330653	GE	On-Demand	Anodyne	MTNR1B	26	40
CC[C@@](C)(CCCNC(=O)C[S@](=O)c1cccc(OC)c1)C1OCCO1	ZINC000819330654	GE	On-Demand	Anodyne	MTNR1A	26	40
CC[C@@](C)(CCCNC(=O)C[S@](=O)c1cccc(OC)c1)C1OCCO1	ZINC000819330654	GE	On-Demand	Anodyne	MTNR1B	26	40
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@@H](c3ccc(F)cc3)C2)c1	ZINC000819330657	EG	On-Demand	Bother	CACNA1C	54	38
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2C[C@@H](c3ccc(F)cc3)C2)c1	ZINC000819330657	EG	On-Demand	Bother	CACNA1D	85	35
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@@H](c3ccc(F)cc3)C2)c1	ZINC000819330658	EG	On-Demand	Bother	CACNA1C	54	38
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2C[C@@H](c3ccc(F)cc3)C2)c1	ZINC000819330658	EG	On-Demand	Bother	CACNA1D	85	35
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@@H](c3ccc(F)cc3)C2)CC1	ZINC000819330696	GH	On-Demand	Anodyne	GPR119	45	52
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@@H](c3ccc(F)cc3)C2)CC1	ZINC000819330697	GH	On-Demand	Anodyne	GPR119	45	52
Cn1ncc(CCCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)n1	ZINC000819330713	ED	On-Demand	Anodyne	ADRB2	18	45
Cn1ncc(CCCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)n1	ZINC000819330713	ED	On-Demand	Anodyne	ADRB3	29	45
Cn1ncc(CCCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)n1	ZINC000819330714	ED	On-Demand	Anodyne	ADRB2	18	45
Cn1ncc(CCCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)n1	ZINC000819330714	ED	On-Demand	Anodyne	ADRB3	29	45
Cn1ncc(CCCNCCC(=O)Nc2ccccc2)n1	ZINC000819330740	CD	On-Demand	Anodyne	HDAC10	22	40
Cn1ncc(CCCNCCC(=O)Nc2ccccc2)n1	ZINC000819330740	CD	On-Demand	Anodyne	HDAC2	15	40
Cn1ncc(CCCNCCC(=O)Nc2ccccc2)n1	ZINC000819330740	CD	On-Demand	Anodyne	HDAC3	19	40
O[C@@H](CNCc1cccc(N2CCOCC2)c1)c1cc(F)ccc1F	ZINC000819330743	EF	On-Demand	Anodyne	STAT6	44	38
O[C@H](CNCc1cccc(N2CCOCC2)c1)c1cc(F)ccc1F	ZINC000819330744	EF	On-Demand	Anodyne	STAT6	44	38
Cn1ncc(CCCNC[C@H](O)c2cccc(C(F)(F)F)c2)n1	ZINC000819330746	EE	On-Demand	Anodyne	ADRB3	52	40
Cn1ncc(CCCNC[C@@H](O)c2cccc(C(F)(F)F)c2)n1	ZINC000819330747	EE	On-Demand	Anodyne	ADRB3	52	40
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2CN(C)C(=O)OC(C)(C)C)c1	ZINC000819330764	GG	On-Demand	Anodyne	OPRK1	17	46
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2CN(C)C(=O)OC(C)(C)C)c1	ZINC000819330765	GG	On-Demand	Anodyne	OPRK1	17	46
CC(=O)c1cccc(OC[C@@H](O)CNCCCc2cnn(C)n2)c1	ZINC000819330779	EC	On-Demand	Anodyne	ADRB2	39	45
CC(=O)c1cccc(OC[C@@H](O)CNCCCc2cnn(C)n2)c1	ZINC000819330779	EC	On-Demand	Anodyne	ADRB1	66	45
CC(=O)c1cccc(OC[C@@H](O)CNCCCc2cnn(C)n2)c1	ZINC000819330779	EC	On-Demand	Anodyne	ADRB3	44	42
CC(=O)c1cccc(OC[C@@H](O)CNCCCc2cnn(C)n2)c1	ZINC000819330779	EC	On-Demand	Anodyne	ABCB1	19	46
CC(=O)c1cccc(OC[C@H](O)CNCCCc2cnn(C)n2)c1	ZINC000819330780	EC	On-Demand	Anodyne	ADRB2	39	45
CC(=O)c1cccc(OC[C@H](O)CNCCCc2cnn(C)n2)c1	ZINC000819330780	EC	On-Demand	Anodyne	ADRB1	66	45
CC(=O)c1cccc(OC[C@H](O)CNCCCc2cnn(C)n2)c1	ZINC000819330780	EC	On-Demand	Anodyne	ADRB3	44	42
CC(=O)c1cccc(OC[C@H](O)CNCCCc2cnn(C)n2)c1	ZINC000819330780	EC	On-Demand	Anodyne	ABCB1	19	46
Cn1ncc(CCCNC[C@H](O)c2ccccc2)n1	ZINC000819330803	CD	On-Demand	Anodyne	ADRB2	30	43
Cn1ncc(CCCNC[C@H](O)c2ccccc2)n1	ZINC000819330803	CD	On-Demand	Anodyne	ADRB3	92	40
Cn1ncc(CCCNC[C@@H](O)c2ccccc2)n1	ZINC000819330804	CD	On-Demand	Anodyne	ADRB2	30	43
Cn1ncc(CCCNC[C@@H](O)c2ccccc2)n1	ZINC000819330804	CD	On-Demand	Anodyne	ADRB3	92	40
Cn1ncc(CCCNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819330822	CD	On-Demand	Anodyne	ADRB2	50	38
Cn1ncc(CCCNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819330822	CD	On-Demand	Anodyne	ADRB1	62	45
Cn1ncc(CCCNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819330822	CD	On-Demand	Anodyne	ADRB3	100	45
Cn1ncc(CCCNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819330823	CD	On-Demand	Anodyne	ADRB2	50	38
Cn1ncc(CCCNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819330823	CD	On-Demand	Anodyne	ADRB1	62	45
Cn1ncc(CCCNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819330823	CD	On-Demand	Anodyne	ADRB3	100	45
Cn1ncc(CCCNC[C@H](O)COc2ccc(C#N)cc2)n1	ZINC000819330824	DC	On-Demand	Mild	ADRB2	38	46
Cn1ncc(CCCNC[C@H](O)COc2ccc(C#N)cc2)n1	ZINC000819330824	DC	On-Demand	Mild	ADRB1	67	46
Cn1ncc(CCCNC[C@H](O)COc2ccc(C#N)cc2)n1	ZINC000819330824	DC	On-Demand	Mild	ADRB3	39	46
Cn1ncc(CCCNC[C@@H](O)COc2ccc(C#N)cc2)n1	ZINC000819330825	DC	On-Demand	Mild	ADRB2	38	46
Cn1ncc(CCCNC[C@@H](O)COc2ccc(C#N)cc2)n1	ZINC000819330825	DC	On-Demand	Mild	ADRB1	67	46
Cn1ncc(CCCNC[C@@H](O)COc2ccc(C#N)cc2)n1	ZINC000819330825	DC	On-Demand	Mild	ADRB3	39	46
Cn1ncc(CCCNC[C@H](O)COc2ccccc2)n1	ZINC000819330826	CC	On-Demand	Anodyne	ADRB2	62	54
Cn1ncc(CCCNC[C@H](O)COc2ccccc2)n1	ZINC000819330826	CC	On-Demand	Anodyne	ADRB1	92	54
Cn1ncc(CCCNC[C@H](O)COc2ccccc2)n1	ZINC000819330826	CC	On-Demand	Anodyne	ADRB3	63	48
Cn1ncc(CCCNC[C@@H](O)COc2ccccc2)n1	ZINC000819330827	CC	On-Demand	Anodyne	ADRB2	62	54
Cn1ncc(CCCNC[C@@H](O)COc2ccccc2)n1	ZINC000819330827	CC	On-Demand	Anodyne	ADRB1	92	54
Cn1ncc(CCCNC[C@@H](O)COc2ccccc2)n1	ZINC000819330827	CC	On-Demand	Anodyne	ADRB3	63	48
Cn1ncc(CCCNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)n1	ZINC000819330832	FE	On-Demand	Anodyne	ADRB2	37	44
Cn1ncc(CCCNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)n1	ZINC000819330832	FE	On-Demand	Anodyne	ADRB1	56	44
Cn1ncc(CCCNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)n1	ZINC000819330832	FE	On-Demand	Anodyne	GRIN1	29	47
Cn1ncc(CCCNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)n1	ZINC000819330832	FE	On-Demand	Anodyne	ADRB3	38	44
Cn1ncc(CCCNC[C@H](O)COc2ccc(Cl)c(Cl)c2)n1	ZINC000819330833	FE	On-Demand	Anodyne	ADRB2	37	44
Cn1ncc(CCCNC[C@H](O)COc2ccc(Cl)c(Cl)c2)n1	ZINC000819330833	FE	On-Demand	Anodyne	ADRB1	56	44
Cn1ncc(CCCNC[C@H](O)COc2ccc(Cl)c(Cl)c2)n1	ZINC000819330833	FE	On-Demand	Anodyne	GRIN1	29	47
Cn1ncc(CCCNC[C@H](O)COc2ccc(Cl)c(Cl)c2)n1	ZINC000819330833	FE	On-Demand	Anodyne	ADRB3	38	44
Cn1ncc(CCCNC[C@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819330836	DC	On-Demand	Bother	ADRB3	72	37
Cn1ncc(CCCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819330837	DC	On-Demand	Bother	ADRB3	72	37
Cn1ncc(CCCNC[C@@H](O)COc2ccccc2Cl)n1	ZINC000819330838	DD	On-Demand	Anodyne	ADRB2	34	51
Cn1ncc(CCCNC[C@@H](O)COc2ccccc2Cl)n1	ZINC000819330838	DD	On-Demand	Anodyne	ADRB1	51	36
Cn1ncc(CCCNC[C@H](O)COc2ccccc2Cl)n1	ZINC000819330839	DD	On-Demand	Anodyne	ADRB2	34	51
Cn1ncc(CCCNC[C@H](O)COc2ccccc2Cl)n1	ZINC000819330839	DD	On-Demand	Anodyne	ADRB1	51	36
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1cccc(C(F)(F)F)c1	ZINC000819330849	GH	On-Demand	Anodyne	ADRB2	29	41
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1cccc(C(F)(F)F)c1	ZINC000819330849	GH	On-Demand	Anodyne	ADRB3	65	41
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1cccc(C(F)(F)F)c1	ZINC000819330850	GH	On-Demand	Anodyne	ADRB2	29	41
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1cccc(C(F)(F)F)c1	ZINC000819330850	GH	On-Demand	Anodyne	ADRB3	65	41
CCc1noc(C)c1CNC[C@H](O)c1ccc(F)cc1Cl	ZINC000819330851	DG	On-Demand	Anodyne	P2RX7	18	46
CCc1noc(C)c1CNC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819330852	DG	On-Demand	Anodyne	P2RX7	18	46
CC(C)(C)OC(=O)NC[C@@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819330873	GE	On-Demand	Anodyne	HTR1D	17	42
CC(C)(C)OC(=O)NC[C@@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819330873	GE	On-Demand	Anodyne	HTR1B	15	42
CC(C)(C)OC(=O)NC[C@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819330874	GE	On-Demand	Anodyne	HTR1D	17	42
CC(C)(C)OC(=O)NC[C@H]1CCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819330874	GE	On-Demand	Anodyne	HTR1B	15	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H]1c1cccc(F)c1)C2	ZINC000819330876	EF	On-Demand	Anodyne	CCR5	65	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H]1c1cccc(F)c1)C2	ZINC000819330877	EF	On-Demand	Anodyne	CCR5	65	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H]1c1cccc(F)c1)C2	ZINC000819330878	EF	On-Demand	Anodyne	CCR5	65	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H]1c1cccc(F)c1)C2	ZINC000819330879	EF	On-Demand	Anodyne	CCR5	65	33
Cn1ncc(CCCNC[C@H](O)c2ccc(C(F)(F)F)cc2)n1	ZINC000819330998	EE	On-Demand	Anodyne	ADRB3	15	42
Cn1ncc(CCCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)n1	ZINC000819330999	EE	On-Demand	Anodyne	ADRB3	15	42
Cn1ncc(CCCNC[C@@H](O)COc2ccccc2C(F)(F)F)n1	ZINC000819331009	FD	On-Demand	Anodyne	ADRB2	29	40
Cn1ncc(CCCNC[C@@H](O)COc2ccccc2C(F)(F)F)n1	ZINC000819331009	FD	On-Demand	Anodyne	ADRB1	54	36
Cn1ncc(CCCNC[C@H](O)COc2ccccc2C(F)(F)F)n1	ZINC000819331010	FD	On-Demand	Anodyne	ADRB2	29	40
Cn1ncc(CCCNC[C@H](O)COc2ccccc2C(F)(F)F)n1	ZINC000819331010	FD	On-Demand	Anodyne	ADRB1	54	36
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1cccc(F)c1	ZINC000819331011	EG	On-Demand	Anodyne	ADRB1	27	43
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1cccc(F)c1	ZINC000819331011	EG	On-Demand	Anodyne	ADRB3	72	43
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1cccc(F)c1	ZINC000819331012	EG	On-Demand	Anodyne	ADRB1	27	43
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1cccc(F)c1	ZINC000819331012	EG	On-Demand	Anodyne	ADRB3	72	43
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(OC(F)(F)F)cc1	ZINC000819331013	GH	On-Demand	Anodyne	ADRB3	48	43
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(OC(F)(F)F)cc1	ZINC000819331014	GH	On-Demand	Anodyne	ADRB3	48	43
O[C@H](CNCc1cccc(N2CCOCC2)c1)c1ccc(F)cn1	ZINC000819331015	ED	On-Demand	Anodyne	STAT6	47	42
O[C@@H](CNCc1cccc(N2CCOCC2)c1)c1ccc(F)cn1	ZINC000819331016	ED	On-Demand	Anodyne	STAT6	47	42
CC(=O)c1ccc(OC[C@@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331023	EC	On-Demand	Anodyne	ADRB2	39	45
CC(=O)c1ccc(OC[C@@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331023	EC	On-Demand	Anodyne	ADRB1	75	45
CC(=O)c1ccc(OC[C@@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331023	EC	On-Demand	Anodyne	ADRB3	46	45
CC(=O)c1ccc(OC[C@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331024	EC	On-Demand	Anodyne	ADRB2	39	45
CC(=O)c1ccc(OC[C@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331024	EC	On-Demand	Anodyne	ADRB1	75	45
CC(=O)c1ccc(OC[C@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331024	EC	On-Demand	Anodyne	ADRB3	46	45
Cn1ncc(CCCNC[C@H](O)COc2cccc([N+](=O)[O-])c2)n1	ZINC000819331027	EC	On-Demand	Bother	ADRB2	31	47
Cn1ncc(CCCNC[C@H](O)COc2cccc([N+](=O)[O-])c2)n1	ZINC000819331027	EC	On-Demand	Bother	ADRB1	47	47
Cn1ncc(CCCNC[C@H](O)COc2cccc([N+](=O)[O-])c2)n1	ZINC000819331027	EC	On-Demand	Bother	ADRB3	34	47
Cn1ncc(CCCNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)n1	ZINC000819331028	EC	On-Demand	Bother	ADRB2	31	47
Cn1ncc(CCCNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)n1	ZINC000819331028	EC	On-Demand	Bother	ADRB1	47	47
Cn1ncc(CCCNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)n1	ZINC000819331028	EC	On-Demand	Bother	ADRB3	34	47
COc1ccc(OC)c([C@H](O)CNCCc2cccc(C(F)(F)F)n2)c1	ZINC000819331035	FF	On-Demand	Anodyne	ADRB2	22	47
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(Br)cc1	ZINC000819331066	GH	On-Demand	Anodyne	ADRB2	22	44
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(Br)cc1	ZINC000819331067	GH	On-Demand	Anodyne	ADRB2	22	44
O=C(Cc1nsc2ccccc12)N1CCC2(CCCC2)C1	ZINC000819331068	DH	On-Demand	Anodyne	DRD2	16	42
O=C(Cc1nsc2ccccc12)N1CCC2(CCCC2)C1	ZINC000819331068	DH	On-Demand	Anodyne	HTR2A	18	42
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(F)c(F)c1	ZINC000819331070	EG	On-Demand	Anodyne	ADRB1	25	40
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(F)c(F)c1	ZINC000819331070	EG	On-Demand	Anodyne	ADRB3	47	40
O[C@@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(F)c(F)c1	ZINC000819331070	EG	On-Demand	Anodyne	TRPV1	40	32
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(F)c(F)c1	ZINC000819331071	EG	On-Demand	Anodyne	ADRB1	25	40
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(F)c(F)c1	ZINC000819331071	EG	On-Demand	Anodyne	ADRB3	47	40
O[C@H](CNCCc1cccc(C(F)(F)F)n1)c1ccc(F)c(F)c1	ZINC000819331071	EG	On-Demand	Anodyne	TRPV1	40	32
CCc1noc(C)c1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819331074	DE	On-Demand	Bother	CACNA1D	55	33
CCc1noc(C)c1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819331075	DE	On-Demand	Bother	CACNA1D	55	33
Cn1ncc(CCCNC[C@H](O)COc2cccc(Br)c2)n1	ZINC000819331077	FD	On-Demand	Anodyne	ADRB2	33	46
Cn1ncc(CCCNC[C@H](O)COc2cccc(Br)c2)n1	ZINC000819331077	FD	On-Demand	Anodyne	ADRB1	48	46
Cn1ncc(CCCNC[C@H](O)COc2cccc(Br)c2)n1	ZINC000819331077	FD	On-Demand	Anodyne	ADRB3	33	40
Cn1ncc(CCCNC[C@@H](O)COc2cccc(Br)c2)n1	ZINC000819331078	FD	On-Demand	Anodyne	ADRB2	33	46
Cn1ncc(CCCNC[C@@H](O)COc2cccc(Br)c2)n1	ZINC000819331078	FD	On-Demand	Anodyne	ADRB1	48	46
Cn1ncc(CCCNC[C@@H](O)COc2cccc(Br)c2)n1	ZINC000819331078	FD	On-Demand	Anodyne	ADRB3	33	40
CC(=O)Nc1cccc(CC(=O)N2CCC3(CCCC3)C2)c1	ZINC000819331081	DF	On-Demand	Anodyne	CCKBR	20	44
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC2(CCCC2)C1	ZINC000819331093	DF	On-Demand	Anodyne	KCNJ1	46	38
O[C@@H](CNCc1cccc(N2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819331118	EF	On-Demand	Anodyne	ADRB1	33	43
O[C@@H](CNCc1cccc(N2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819331118	EF	On-Demand	Anodyne	ADRB3	43	43
O[C@@H](CNCc1cccc(N2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819331118	EF	On-Demand	Anodyne	IGF1R	27	44
O[C@@H](CNCc1cccc(N2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819331118	EF	On-Demand	Anodyne	CYP3A4	49	39
O[C@@H](CNCc1cccc(N2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819331118	EF	On-Demand	Anodyne	STAT6	16	40
O[C@H](CNCc1cccc(N2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819331119	EF	On-Demand	Anodyne	ADRB1	33	43
O[C@H](CNCc1cccc(N2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819331119	EF	On-Demand	Anodyne	ADRB3	43	43
O[C@H](CNCc1cccc(N2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819331119	EF	On-Demand	Anodyne	IGF1R	27	44
O[C@H](CNCc1cccc(N2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819331119	EF	On-Demand	Anodyne	CYP3A4	49	39
O[C@H](CNCc1cccc(N2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819331119	EF	On-Demand	Anodyne	STAT6	16	40
Cn1ncc(CCCNCCC(=O)Nc2cccc(Br)c2)n1	ZINC000819331120	FE	On-Demand	Anodyne	EGFR	44	39
Cn1ncc(CCCNC[C@H](O)c2ccc(F)cc2)n1	ZINC000819331121	CD	On-Demand	Anodyne	ADRB3	27	40
Cn1ncc(CCCNC[C@@H](O)c2ccc(F)cc2)n1	ZINC000819331122	CD	On-Demand	Anodyne	ADRB3	27	40
Cn1ncc(CCCNC[C@H](O)COc2ccc(CC#N)cc2)n1	ZINC000819331126	EC	On-Demand	Mild	ADRB2	39	48
Cn1ncc(CCCNC[C@H](O)COc2ccc(CC#N)cc2)n1	ZINC000819331126	EC	On-Demand	Mild	ADRB1	68	48
Cn1ncc(CCCNC[C@H](O)COc2ccc(CC#N)cc2)n1	ZINC000819331126	EC	On-Demand	Mild	ADRB3	45	48
Cn1ncc(CCCNC[C@@H](O)COc2ccc(CC#N)cc2)n1	ZINC000819331127	EC	On-Demand	Mild	ADRB2	39	48
Cn1ncc(CCCNC[C@@H](O)COc2ccc(CC#N)cc2)n1	ZINC000819331127	EC	On-Demand	Mild	ADRB1	68	48
Cn1ncc(CCCNC[C@@H](O)COc2ccc(CC#N)cc2)n1	ZINC000819331127	EC	On-Demand	Mild	ADRB3	45	48
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc(C(F)(F)F)n2)cc1	ZINC000819331144	GE	On-Demand	Anodyne	ADRB2	37	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc(C(F)(F)F)n2)cc1	ZINC000819331144	GE	On-Demand	Anodyne	ADRB3	106	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cccc(C(F)(F)F)n2)cc1	ZINC000819331144	GE	On-Demand	Anodyne	TRPV1	77	33
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc(C(F)(F)F)n2)cc1	ZINC000819331145	GE	On-Demand	Anodyne	ADRB2	37	41
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc(C(F)(F)F)n2)cc1	ZINC000819331145	GE	On-Demand	Anodyne	ADRB3	106	41
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cccc(C(F)(F)F)n2)cc1	ZINC000819331145	GE	On-Demand	Anodyne	TRPV1	77	33
C=CCC(C)(C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819331148	CH	On-Demand	Mild	ADRB1	34	47
C=CCC(C)(C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819331148	CH	On-Demand	Mild	ADRB3	53	47
C=CCC(C)(C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819331149	CH	On-Demand	Mild	ADRB1	34	47
C=CCC(C)(C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819331149	CH	On-Demand	Mild	ADRB3	53	47
CC(C)(C)OC(=O)NC[C@@H]1CCCN1C(=O)CCc1cccc(OC(F)F)c1	ZINC000819331152	GH	On-Demand	Anodyne	FKBP1A	24	40
CC(C)(C)OC(=O)NC[C@@H]1CCCN1C(=O)CCc1cccc(OC(F)F)c1	ZINC000819331152	GH	On-Demand	Anodyne	HRH2	18	42
CC(C)(C)OC(=O)NC[C@@H]1CCCN1C(=O)CCc1cccc(OC(F)F)c1	ZINC000819331152	GH	On-Demand	Anodyne	DPP4	19	40
CC(C)(C)OC(=O)NC[C@H]1CCCN1C(=O)CCc1cccc(OC(F)F)c1	ZINC000819331153	GH	On-Demand	Anodyne	FKBP1A	24	40
CC(C)(C)OC(=O)NC[C@H]1CCCN1C(=O)CCc1cccc(OC(F)F)c1	ZINC000819331153	GH	On-Demand	Anodyne	HRH2	18	42
CC(C)(C)OC(=O)NC[C@H]1CCCN1C(=O)CCc1cccc(OC(F)F)c1	ZINC000819331153	GH	On-Demand	Anodyne	DPP4	19	40
Cn1ncc(CCCNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000819331162	FD	On-Demand	Anodyne	GPR119	44	39
Cn1ncc(CCCNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000819331163	FD	On-Demand	Anodyne	GPR119	44	39
CC(C)(C)OC(=O)NC[C@H]1CCCN1C(=O)Cc1nsc2ccccc12	ZINC000819331168	GG	On-Demand	Anodyne	DRD2	21	41
CC(C)(C)OC(=O)NC[C@@H]1CCCN1C(=O)Cc1nsc2ccccc12	ZINC000819331169	GG	On-Demand	Anodyne	DRD2	21	41
Cc1cc(F)ccc1[C@@H](O)CNCc1ccc(C(C)(F)F)cc1	ZINC000819331172	DI	On-Demand	Anodyne	LEF	65	39
COc1cccc([S@@](=O)CC(=O)N2CCC[C@@H]2CNC(=O)OC(C)(C)C)c1	ZINC000819331187	GE	On-Demand	Anodyne	DRD4	41	32
COc1cccc([S@](=O)CC(=O)N2CCC[C@@H]2CNC(=O)OC(C)(C)C)c1	ZINC000819331188	GE	On-Demand	Anodyne	DRD4	41	32
COc1cccc([S@](=O)CC(=O)N2CCC[C@H]2CNC(=O)OC(C)(C)C)c1	ZINC000819331189	GE	On-Demand	Anodyne	DRD4	41	32
COc1cccc([S@@](=O)CC(=O)N2CCC[C@H]2CNC(=O)OC(C)(C)C)c1	ZINC000819331190	GE	On-Demand	Anodyne	DRD4	41	32
O[C@H](CNCc1cccc(N2CCOCC2)c1)c1c(F)cccc1F	ZINC000819331191	EF	On-Demand	Anodyne	STAT6	40	37
O[C@@H](CNCc1cccc(N2CCOCC2)c1)c1c(F)cccc1F	ZINC000819331192	EF	On-Demand	Anodyne	STAT6	40	37
CSc1ccc(OC[C@@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331206	ED	On-Demand	Anodyne	ADRB2	38	46
CSc1ccc(OC[C@@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331206	ED	On-Demand	Anodyne	ADRB1	61	46
CSc1ccc(OC[C@@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331206	ED	On-Demand	Anodyne	ADRB3	41	46
CSc1ccc(OC[C@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331207	ED	On-Demand	Anodyne	ADRB2	38	46
CSc1ccc(OC[C@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331207	ED	On-Demand	Anodyne	ADRB1	61	46
CSc1ccc(OC[C@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331207	ED	On-Demand	Anodyne	ADRB3	41	46
O=C(CCc1cccc(OC(F)F)c1)N1CCC2(CCCC2)C1	ZINC000819331214	DI	On-Demand	Anodyne	EPHX2	16	49
O[C@@H](CNCc1cccc(N2CCOCC2)c1)c1cccc(F)c1	ZINC000819331219	EE	On-Demand	Anodyne	STAT6	35	41
O[C@H](CNCc1cccc(N2CCOCC2)c1)c1cccc(F)c1	ZINC000819331220	EE	On-Demand	Anodyne	STAT6	35	41
Cn1ncc(CCCNC[C@@H](O)COc2ccccc2F)n1	ZINC000819331235	DC	On-Demand	Anodyne	ADRB2	32	42
Cn1ncc(CCCNC[C@@H](O)COc2ccccc2F)n1	ZINC000819331235	DC	On-Demand	Anodyne	ADRB1	56	39
Cn1ncc(CCCNC[C@H](O)COc2ccccc2F)n1	ZINC000819331236	DC	On-Demand	Anodyne	ADRB2	32	42
Cn1ncc(CCCNC[C@H](O)COc2ccccc2F)n1	ZINC000819331236	DC	On-Demand	Anodyne	ADRB1	56	39
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1cccc(N2CCOCC2)c1	ZINC000819331250	GD	On-Demand	Anodyne	STAT6	40	36
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1cccc(N2CCOCC2)c1	ZINC000819331251	GD	On-Demand	Anodyne	STAT6	40	36
COc1ccc(OC)c([C@H](O)CNCCc2ccc(OC)c(OC)c2Cl)c1	ZINC000819331253	GG	On-Demand	Anodyne	ADRB2	30	50
COc1ccc(OC)c([C@H](O)CNCCc2ccc(OC)c(OC)c2Cl)c1	ZINC000819331253	GG	On-Demand	Anodyne	ADRB1	28	40
COc1ccc(OC)c([C@H](O)CNCCc2ccc(OC)c(OC)c2Cl)c1	ZINC000819331253	GG	On-Demand	Anodyne	ADRB3	22	40
CCc1noc(C)c1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819331254	CG	On-Demand	Anodyne	ADRB1	25	40
CCc1noc(C)c1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819331254	CG	On-Demand	Anodyne	ADRB3	38	40
CCc1noc(C)c1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819331255	CG	On-Demand	Anodyne	ADRB1	25	40
CCc1noc(C)c1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819331255	CG	On-Demand	Anodyne	ADRB3	38	40
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1ccc(C(C)(F)F)cc1	ZINC000819331272	FG	On-Demand	Anodyne	LEF	45	37
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1ccc(C(C)(F)F)cc1	ZINC000819331273	FG	On-Demand	Anodyne	LEF	45	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC[C@@H]1c1cccc(F)c1	ZINC000819331275	EG	On-Demand	Anodyne	CCR5	61	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC[C@H]1c1cccc(F)c1	ZINC000819331276	EG	On-Demand	Anodyne	CCR5	61	33
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(C(C)(F)F)cc2)CC1	ZINC000819331280	GH	On-Demand	Anodyne	GPR119	52	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(C(C)(F)F)cc2)CC1	ZINC000819331281	GH	On-Demand	Anodyne	GPR119	52	49
Cn1ncc(CCCNC[C@H](O)COc2ccc(Cl)cc2)n1	ZINC000819331286	DD	On-Demand	Anodyne	ADRB2	42	47
Cn1ncc(CCCNC[C@H](O)COc2ccc(Cl)cc2)n1	ZINC000819331286	DD	On-Demand	Anodyne	ADRB1	68	47
Cn1ncc(CCCNC[C@H](O)COc2ccc(Cl)cc2)n1	ZINC000819331286	DD	On-Demand	Anodyne	GRIN1	19	48
Cn1ncc(CCCNC[C@H](O)COc2ccc(Cl)cc2)n1	ZINC000819331286	DD	On-Demand	Anodyne	ADRB3	44	47
Cn1ncc(CCCNC[C@@H](O)COc2ccc(Cl)cc2)n1	ZINC000819331287	DD	On-Demand	Anodyne	ADRB2	42	47
Cn1ncc(CCCNC[C@@H](O)COc2ccc(Cl)cc2)n1	ZINC000819331287	DD	On-Demand	Anodyne	ADRB1	68	47
Cn1ncc(CCCNC[C@@H](O)COc2ccc(Cl)cc2)n1	ZINC000819331287	DD	On-Demand	Anodyne	GRIN1	19	48
Cn1ncc(CCCNC[C@@H](O)COc2ccc(Cl)cc2)n1	ZINC000819331287	DD	On-Demand	Anodyne	ADRB3	44	47
Cn1ncc(CCCNC[C@H](O)c2cccc(F)c2)n1	ZINC000819331296	CD	On-Demand	Anodyne	ADRB2	26	41
Cn1ncc(CCCNC[C@H](O)c2cccc(F)c2)n1	ZINC000819331296	CD	On-Demand	Anodyne	ADRB1	34	42
Cn1ncc(CCCNC[C@H](O)c2cccc(F)c2)n1	ZINC000819331296	CD	On-Demand	Anodyne	ADRB3	72	42
Cn1ncc(CCCNC[C@@H](O)c2cccc(F)c2)n1	ZINC000819331297	CD	On-Demand	Anodyne	ADRB2	26	41
Cn1ncc(CCCNC[C@@H](O)c2cccc(F)c2)n1	ZINC000819331297	CD	On-Demand	Anodyne	ADRB1	34	42
Cn1ncc(CCCNC[C@@H](O)c2cccc(F)c2)n1	ZINC000819331297	CD	On-Demand	Anodyne	ADRB3	72	42
CON(C)C(=O)CCNCc1cccc(N2CCOCC2)c1	ZINC000819331316	DD	On-Demand	Anodyne	EPHB4	70	37
CC(C)(C)OC(=O)NC[C@H]1CCCN1C(=O)c1coc(=O)c2ccccc12	ZINC000819331317	FF	On-Demand	Anodyne	INHA	67	35
CC(C)(C)OC(=O)NC[C@H]1CCCN1C(=O)c1coc(=O)c2ccccc12	ZINC000819331317	FF	On-Demand	Anodyne	HCRTR1	34	41
CC(C)(C)OC(=O)NC[C@H]1CCCN1C(=O)c1coc(=O)c2ccccc12	ZINC000819331317	FF	On-Demand	Anodyne	ACACB	15	40
CC(C)(C)OC(=O)NC[C@H]1CCCN1C(=O)c1coc(=O)c2ccccc12	ZINC000819331317	FF	On-Demand	Anodyne	HCRTR2	16	41
CC(C)(C)OC(=O)NC[C@@H]1CCCN1C(=O)c1coc(=O)c2ccccc12	ZINC000819331318	FF	On-Demand	Anodyne	INHA	67	35
CC(C)(C)OC(=O)NC[C@@H]1CCCN1C(=O)c1coc(=O)c2ccccc12	ZINC000819331318	FF	On-Demand	Anodyne	HCRTR1	34	41
CC(C)(C)OC(=O)NC[C@@H]1CCCN1C(=O)c1coc(=O)c2ccccc12	ZINC000819331318	FF	On-Demand	Anodyne	ACACB	15	40
CC(C)(C)OC(=O)NC[C@@H]1CCCN1C(=O)c1coc(=O)c2ccccc12	ZINC000819331318	FF	On-Demand	Anodyne	HCRTR2	16	41
Cn1ncc(CCCNC[C@H](O)COc2ccc(C(C)(C)C)cc2)n1	ZINC000819331321	EE	On-Demand	Anodyne	ADRB2	40	47
Cn1ncc(CCCNC[C@H](O)COc2ccc(C(C)(C)C)cc2)n1	ZINC000819331321	EE	On-Demand	Anodyne	ADRB1	63	47
Cn1ncc(CCCNC[C@H](O)COc2ccc(C(C)(C)C)cc2)n1	ZINC000819331321	EE	On-Demand	Anodyne	ADRB3	41	47
Cn1ncc(CCCNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)n1	ZINC000819331322	EE	On-Demand	Anodyne	ADRB2	40	47
Cn1ncc(CCCNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)n1	ZINC000819331322	EE	On-Demand	Anodyne	ADRB1	63	47
Cn1ncc(CCCNC[C@@H](O)COc2ccc(C(C)(C)C)cc2)n1	ZINC000819331322	EE	On-Demand	Anodyne	ADRB3	41	47
CCc1noc(C)c1CNC[C@H](O)c1cccnc1	ZINC000819331326	CD	On-Demand	Anodyne	ADRB2	18	42
CCc1noc(C)c1CNC[C@H](O)c1cccnc1	ZINC000819331326	CD	On-Demand	Anodyne	ADRB1	21	44
CCc1noc(C)c1CNC[C@H](O)c1cccnc1	ZINC000819331326	CD	On-Demand	Anodyne	ADRB3	81	44
CCc1noc(C)c1CNC[C@@H](O)c1cccnc1	ZINC000819331327	CD	On-Demand	Anodyne	ADRB2	18	42
CCc1noc(C)c1CNC[C@@H](O)c1cccnc1	ZINC000819331327	CD	On-Demand	Anodyne	ADRB1	21	44
CCc1noc(C)c1CNC[C@@H](O)c1cccnc1	ZINC000819331327	CD	On-Demand	Anodyne	ADRB3	81	44
Cn1ncc(CCCNC[C@H](O)COc2ccc(Br)cc2)n1	ZINC000819331350	FD	On-Demand	Anodyne	ADRB2	41	47
Cn1ncc(CCCNC[C@H](O)COc2ccc(Br)cc2)n1	ZINC000819331350	FD	On-Demand	Anodyne	ADRB1	66	47
Cn1ncc(CCCNC[C@H](O)COc2ccc(Br)cc2)n1	ZINC000819331350	FD	On-Demand	Anodyne	ADRB3	42	47
Cn1ncc(CCCNC[C@@H](O)COc2ccc(Br)cc2)n1	ZINC000819331351	FD	On-Demand	Anodyne	ADRB2	41	47
Cn1ncc(CCCNC[C@@H](O)COc2ccc(Br)cc2)n1	ZINC000819331351	FD	On-Demand	Anodyne	ADRB1	66	47
Cn1ncc(CCCNC[C@@H](O)COc2ccc(Br)cc2)n1	ZINC000819331351	FD	On-Demand	Anodyne	ADRB3	42	47
Cc1ccc(OC[C@@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331356	DD	On-Demand	Anodyne	ADRB2	48	48
Cc1ccc(OC[C@@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331356	DD	On-Demand	Anodyne	ADRB1	71	48
Cc1ccc(OC[C@@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331356	DD	On-Demand	Anodyne	ADRB3	47	48
Cc1ccc(OC[C@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331357	DD	On-Demand	Anodyne	ADRB2	48	48
Cc1ccc(OC[C@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331357	DD	On-Demand	Anodyne	ADRB1	71	48
Cc1ccc(OC[C@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331357	DD	On-Demand	Anodyne	ADRB3	47	48
Cn1ncc(CCCNC[C@H](O)COc2cccc3ccccc23)n1	ZINC000819331366	ED	On-Demand	Anodyne	ADRB2	39	55
Cn1ncc(CCCNC[C@H](O)COc2cccc3ccccc23)n1	ZINC000819331366	ED	On-Demand	Anodyne	ADRB1	60	35
Cn1ncc(CCCNC[C@H](O)COc2cccc3ccccc23)n1	ZINC000819331366	ED	On-Demand	Anodyne	ADRB3	28	50
Cn1ncc(CCCNC[C@H](O)COc2cccc3ccccc23)n1	ZINC000819331366	ED	On-Demand	Anodyne	CYP2D6	16	42
Cn1ncc(CCCNC[C@H](O)COc2cccc3ccccc23)n1	ZINC000819331366	ED	On-Demand	Anodyne	ABCB1	15	43
Cn1ncc(CCCNC[C@@H](O)COc2cccc3ccccc23)n1	ZINC000819331367	ED	On-Demand	Anodyne	ADRB2	39	55
Cn1ncc(CCCNC[C@@H](O)COc2cccc3ccccc23)n1	ZINC000819331367	ED	On-Demand	Anodyne	ADRB1	60	35
Cn1ncc(CCCNC[C@@H](O)COc2cccc3ccccc23)n1	ZINC000819331367	ED	On-Demand	Anodyne	ADRB3	28	50
Cn1ncc(CCCNC[C@@H](O)COc2cccc3ccccc23)n1	ZINC000819331367	ED	On-Demand	Anodyne	CYP2D6	16	42
Cn1ncc(CCCNC[C@@H](O)COc2cccc3ccccc23)n1	ZINC000819331367	ED	On-Demand	Anodyne	ABCB1	15	43
CON(C)C(=O)CCNCc1ccc(C(C)(F)F)cc1	ZINC000819331391	CE	On-Demand	Anodyne	LEF	50	37
Cn1ncc(CCCNC[C@@H](O)c2cccnc2)n1	ZINC000819331402	CC	On-Demand	Anodyne	ADRB2	28	46
Cn1ncc(CCCNC[C@@H](O)c2cccnc2)n1	ZINC000819331402	CC	On-Demand	Anodyne	ADRB1	31	44
Cn1ncc(CCCNC[C@@H](O)c2cccnc2)n1	ZINC000819331402	CC	On-Demand	Anodyne	ADRB3	107	47
Cn1ncc(CCCNC[C@H](O)c2cccnc2)n1	ZINC000819331403	CC	On-Demand	Anodyne	ADRB2	28	46
Cn1ncc(CCCNC[C@H](O)c2cccnc2)n1	ZINC000819331403	CC	On-Demand	Anodyne	ADRB1	31	44
Cn1ncc(CCCNC[C@H](O)c2cccnc2)n1	ZINC000819331403	CC	On-Demand	Anodyne	ADRB3	107	47
O[C@H](CNCc1cccc(N2CCOCC2)c1)c1cccnc1	ZINC000819331408	DD	On-Demand	Anodyne	ADRB2	24	40
O[C@H](CNCc1cccc(N2CCOCC2)c1)c1cccnc1	ZINC000819331408	DD	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CNCc1cccc(N2CCOCC2)c1)c1cccnc1	ZINC000819331408	DD	On-Demand	Anodyne	ADRB3	90	42
O[C@H](CNCc1cccc(N2CCOCC2)c1)c1cccnc1	ZINC000819331408	DD	On-Demand	Anodyne	STAT6	42	37
O[C@@H](CNCc1cccc(N2CCOCC2)c1)c1cccnc1	ZINC000819331409	DD	On-Demand	Anodyne	ADRB2	24	40
O[C@@H](CNCc1cccc(N2CCOCC2)c1)c1cccnc1	ZINC000819331409	DD	On-Demand	Anodyne	ADRB1	25	42
O[C@@H](CNCc1cccc(N2CCOCC2)c1)c1cccnc1	ZINC000819331409	DD	On-Demand	Anodyne	ADRB3	90	42
O[C@@H](CNCc1cccc(N2CCOCC2)c1)c1cccnc1	ZINC000819331409	DD	On-Demand	Anodyne	STAT6	42	37
O[C@@H](CNCc1cccc(N2CCOCC2)c1)c1ccc(F)cc1F	ZINC000819331418	EF	On-Demand	Anodyne	STAT6	44	38
O[C@H](CNCc1cccc(N2CCOCC2)c1)c1ccc(F)cc1F	ZINC000819331419	EF	On-Demand	Anodyne	STAT6	44	38
Cn1ncc(CCCNC[C@@H](O)COc2ccc3c(c2)OCO3)n1	ZINC000819331427	EC	On-Demand	Anodyne	ADRB2	26	41
Cn1ncc(CCCNC[C@@H](O)COc2ccc3c(c2)OCO3)n1	ZINC000819331427	EC	On-Demand	Anodyne	ADRB1	42	41
Cn1ncc(CCCNC[C@@H](O)COc2ccc3c(c2)OCO3)n1	ZINC000819331427	EC	On-Demand	Anodyne	ADRB3	33	40
Cn1ncc(CCCNC[C@H](O)COc2ccc3c(c2)OCO3)n1	ZINC000819331428	EC	On-Demand	Anodyne	ADRB2	26	41
Cn1ncc(CCCNC[C@H](O)COc2ccc3c(c2)OCO3)n1	ZINC000819331428	EC	On-Demand	Anodyne	ADRB1	42	41
Cn1ncc(CCCNC[C@H](O)COc2ccc3c(c2)OCO3)n1	ZINC000819331428	EC	On-Demand	Anodyne	ADRB3	33	40
COc1ccc(OC)c([C@H](O)CNCc2ccc(C(C)(F)F)cc2)c1	ZINC000819331451	FH	On-Demand	Anodyne	ADRB2	16	47
COc1ccc(OC)c([C@H](O)CNCc2ccc(C(C)(F)F)cc2)c1	ZINC000819331451	FH	On-Demand	Anodyne	MT-ND1	26	50
CC(=O)Nc1ccc(OC[C@@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331463	EC	On-Demand	Anodyne	ADRB2	47	57
CC(=O)Nc1ccc(OC[C@@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331463	EC	On-Demand	Anodyne	ADRB1	89	57
CC(=O)Nc1ccc(OC[C@@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331463	EC	On-Demand	Anodyne	GRIN1	23	43
CC(=O)Nc1ccc(OC[C@@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331463	EC	On-Demand	Anodyne	ADRB3	67	57
CC(=O)Nc1ccc(OC[C@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331464	EC	On-Demand	Anodyne	ADRB2	47	57
CC(=O)Nc1ccc(OC[C@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331464	EC	On-Demand	Anodyne	ADRB1	89	57
CC(=O)Nc1ccc(OC[C@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331464	EC	On-Demand	Anodyne	GRIN1	23	43
CC(=O)Nc1ccc(OC[C@H](O)CNCCCc2cnn(C)n2)cc1	ZINC000819331464	EC	On-Demand	Anodyne	ADRB3	67	57
Cn1ncc(CCCNC[C@@H](O)COc2ccccc2[N+](=O)[O-])n1	ZINC000819331486	EC	On-Demand	Bother	ADRB2	30	41
Cn1ncc(CCCNC[C@@H](O)COc2ccccc2[N+](=O)[O-])n1	ZINC000819331486	EC	On-Demand	Bother	ADRB1	46	37
Cn1ncc(CCCNC[C@@H](O)COc2ccccc2[N+](=O)[O-])n1	ZINC000819331486	EC	On-Demand	Bother	ADRB3	24	40
Cn1ncc(CCCNC[C@H](O)COc2ccccc2[N+](=O)[O-])n1	ZINC000819331487	EC	On-Demand	Bother	ADRB2	30	41
Cn1ncc(CCCNC[C@H](O)COc2ccccc2[N+](=O)[O-])n1	ZINC000819331487	EC	On-Demand	Bother	ADRB1	46	37
Cn1ncc(CCCNC[C@H](O)COc2ccccc2[N+](=O)[O-])n1	ZINC000819331487	EC	On-Demand	Bother	ADRB3	24	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)C[C@@H](C)n2cccn2)cc1	ZINC000819331492	FI	On-Demand	Anodyne	AMP1_PLAFQ	26	43
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC(=O)C[C@H](C)n2cccn2)cc1	ZINC000819331493	FI	On-Demand	Anodyne	AMP1_PLAFQ	26	43
O[C@@H](CNCc1cccc(N2CCOCC2)c1)c1ccccc1F	ZINC000819331496	EE	On-Demand	Anodyne	STAT6	40	36
O[C@H](CNCc1cccc(N2CCOCC2)c1)c1ccccc1F	ZINC000819331497	EE	On-Demand	Anodyne	STAT6	40	36
Cn1ncc(CCCNCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)n1	ZINC000819331499	FE	On-Demand	Anodyne	CYNT	29	43
Cn1ncc(CCCNC[C@H](O)COc2ccc(F)cc2)n1	ZINC000819331506	DC	On-Demand	Anodyne	ADRB2	46	47
Cn1ncc(CCCNC[C@H](O)COc2ccc(F)cc2)n1	ZINC000819331506	DC	On-Demand	Anodyne	ADRB1	76	47
Cn1ncc(CCCNC[C@H](O)COc2ccc(F)cc2)n1	ZINC000819331506	DC	On-Demand	Anodyne	ADRB3	46	47
Cn1ncc(CCCNC[C@@H](O)COc2ccc(F)cc2)n1	ZINC000819331507	DC	On-Demand	Anodyne	ADRB2	46	47
Cn1ncc(CCCNC[C@@H](O)COc2ccc(F)cc2)n1	ZINC000819331507	DC	On-Demand	Anodyne	ADRB1	76	47
Cn1ncc(CCCNC[C@@H](O)COc2ccc(F)cc2)n1	ZINC000819331507	DC	On-Demand	Anodyne	ADRB3	46	47
Cc1ccc(OC[C@@H](O)CNCCCc2cnn(C)n2)c(C)c1	ZINC000819331512	DD	On-Demand	Anodyne	ADRB2	17	41
Cc1ccc(OC[C@H](O)CNCCCc2cnn(C)n2)c(C)c1	ZINC000819331513	DD	On-Demand	Anodyne	ADRB2	17	41
Cn1ncc(CCCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)n1	ZINC000819331523	EC	On-Demand	Anodyne	ADRB2	22	42
Cn1ncc(CCCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)n1	ZINC000819331523	EC	On-Demand	Anodyne	ADRB3	75	38
Cn1ncc(CCCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)n1	ZINC000819331524	EC	On-Demand	Anodyne	ADRB2	22	42
Cn1ncc(CCCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)n1	ZINC000819331524	EC	On-Demand	Anodyne	ADRB3	75	38
O=[N+]([O-])c1cccc([C@@H](O)CNCc2cccc(N3CCOCC3)c2)c1	ZINC000819331540	FE	On-Demand	Bother	MET	15	44
O=[N+]([O-])c1cccc([C@H](O)CNCc2cccc(N3CCOCC3)c2)c1	ZINC000819331541	FE	On-Demand	Bother	MET	15	44
C=CCC(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000819331542	BE	On-Demand	Mild	ADRB2	20	42
C=CCC(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000819331542	BE	On-Demand	Mild	ADRB1	22	44
C=CCC(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000819331542	BE	On-Demand	Mild	ADRB3	87	44
C=CCC(C)(C)CNC[C@H](O)c1cccnc1	ZINC000819331543	BE	On-Demand	Mild	ADRB2	20	42
C=CCC(C)(C)CNC[C@H](O)c1cccnc1	ZINC000819331543	BE	On-Demand	Mild	ADRB1	22	44
C=CCC(C)(C)CNC[C@H](O)c1cccnc1	ZINC000819331543	BE	On-Demand	Mild	ADRB3	87	44
Cn1ncc(CCCNCCC(=O)Nc2cccc(C(F)(F)F)c2)n1	ZINC000819331544	FE	On-Demand	Anodyne	KIT	15	43
Cn1ncc(CCCNCCC(=O)Nc2cccc(C(F)(F)F)c2)n1	ZINC000819331544	FE	On-Demand	Anodyne	LCK	28	40
Cn1ncc(CCCNCCC(=O)Nc2cccc(C(F)(F)F)c2)n1	ZINC000819331544	FE	On-Demand	Anodyne	FLT1	15	43
Cn1ncc(CCCNCCC(=O)Nc2cccc(C(F)(F)F)c2)n1	ZINC000819331544	FE	On-Demand	Anodyne	KDR	19	43
Cn1ncc(CCCNCCC(=O)Nc2cccc(C(F)(F)F)c2)n1	ZINC000819331544	FE	On-Demand	Anodyne	HDAC6	15	49
Cn1ncc(CCCNCCC(=O)Nc2cccc(C(F)(F)F)c2)n1	ZINC000819331544	FE	On-Demand	Anodyne	BTK	20	40
CCc1noc(C)c1CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819331552	FF	On-Demand	Anodyne	GPR119	39	42
CCc1noc(C)c1CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819331553	FF	On-Demand	Anodyne	GPR119	39	42
Cn1ncc(CCCNC[C@H](O)COc2cccc(C(F)(F)F)c2)n1	ZINC000819331558	FD	On-Demand	Anodyne	ADRB2	30	45
Cn1ncc(CCCNC[C@H](O)COc2cccc(C(F)(F)F)c2)n1	ZINC000819331558	FD	On-Demand	Anodyne	ADRB1	40	45
Cn1ncc(CCCNC[C@H](O)COc2cccc(C(F)(F)F)c2)n1	ZINC000819331558	FD	On-Demand	Anodyne	PDS	44	41
Cn1ncc(CCCNC[C@@H](O)COc2cccc(C(F)(F)F)c2)n1	ZINC000819331559	FD	On-Demand	Anodyne	ADRB2	30	45
Cn1ncc(CCCNC[C@@H](O)COc2cccc(C(F)(F)F)c2)n1	ZINC000819331559	FD	On-Demand	Anodyne	ADRB1	40	45
Cn1ncc(CCCNC[C@@H](O)COc2cccc(C(F)(F)F)c2)n1	ZINC000819331559	FD	On-Demand	Anodyne	PDS	44	41
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2CNC(=O)OC(C)(C)C)c1	ZINC000819331562	GF	On-Demand	Anodyne	OPRK1	18	42
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2CNC(=O)OC(C)(C)C)c1	ZINC000819331562	GF	On-Demand	Anodyne	CMA1	35	42
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2CNC(=O)OC(C)(C)C)c1	ZINC000819331563	GF	On-Demand	Anodyne	OPRK1	18	42
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2CNC(=O)OC(C)(C)C)c1	ZINC000819331563	GF	On-Demand	Anodyne	CMA1	35	42
Cn1ncc(CCCNC[C@@H](O)COc2ccc3ccccc3c2)n1	ZINC000819331570	ED	On-Demand	Anodyne	ADRB2	49	50
Cn1ncc(CCCNC[C@@H](O)COc2ccc3ccccc3c2)n1	ZINC000819331570	ED	On-Demand	Anodyne	ADRB1	66	45
Cn1ncc(CCCNC[C@@H](O)COc2ccc3ccccc3c2)n1	ZINC000819331570	ED	On-Demand	Anodyne	ADRB3	47	45
Cn1ncc(CCCNC[C@H](O)COc2ccc3ccccc3c2)n1	ZINC000819331571	ED	On-Demand	Anodyne	ADRB2	49	50
Cn1ncc(CCCNC[C@H](O)COc2ccc3ccccc3c2)n1	ZINC000819331571	ED	On-Demand	Anodyne	ADRB1	66	45
Cn1ncc(CCCNC[C@H](O)COc2ccc3ccccc3c2)n1	ZINC000819331571	ED	On-Demand	Anodyne	ADRB3	47	45
Cn1ncc(CCCNC[C@H](O)c2cccc(Br)c2)n1	ZINC000819331576	ED	On-Demand	Anodyne	ADRB3	66	35
Cn1ncc(CCCNC[C@@H](O)c2cccc(Br)c2)n1	ZINC000819331577	ED	On-Demand	Anodyne	ADRB3	66	35
Cn1ncc(CCCNCCC(=O)Nc2ccc(Oc3ccccc3)cc2)n1	ZINC000819331602	GG	On-Demand	Anodyne	LTA4H	52	45
Cn1ncc(CCCNC[C@H](O)COc2cccc3[nH]ccc23)n1	ZINC000819331616	ED	On-Demand	Anodyne	ADRB2	19	54
Cn1ncc(CCCNC[C@H](O)COc2cccc3[nH]ccc23)n1	ZINC000819331616	ED	On-Demand	Anodyne	ADRB1	47	54
Cn1ncc(CCCNC[C@@H](O)COc2cccc3[nH]ccc23)n1	ZINC000819331617	ED	On-Demand	Anodyne	ADRB2	19	54
Cn1ncc(CCCNC[C@@H](O)COc2cccc3[nH]ccc23)n1	ZINC000819331617	ED	On-Demand	Anodyne	ADRB1	47	54
Cn1ncc(CCCNC[C@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000819331624	FE	On-Demand	Anodyne	ADRB2	59	51
Cn1ncc(CCCNC[C@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000819331624	FE	On-Demand	Anodyne	ADRB1	90	51
Cn1ncc(CCCNC[C@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000819331624	FE	On-Demand	Anodyne	ADRB3	68	46
Cn1ncc(CCCNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000819331625	FE	On-Demand	Anodyne	ADRB2	59	51
Cn1ncc(CCCNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000819331625	FE	On-Demand	Anodyne	ADRB1	90	51
Cn1ncc(CCCNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)n1	ZINC000819331625	FE	On-Demand	Anodyne	ADRB3	68	46
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(-n2ccnc2)c1	ZINC000819331724	DF	On-Demand	Anodyne	KCNQ2	49	34
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(-n2ccnc2)c1	ZINC000819331725	DF	On-Demand	Anodyne	KCNQ2	49	34
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(-n2ccnc2)c1	ZINC000819331726	DF	On-Demand	Anodyne	KCNQ2	49	34
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(-n2ccnc2)c1	ZINC000819331727	DF	On-Demand	Anodyne	KCNQ2	49	34
COC1(CCNC[C@@H](O)c2cccnc2)CCC1	ZINC000819331731	CD	On-Demand	Anodyne	ADRB2	29	46
COC1(CCNC[C@@H](O)c2cccnc2)CCC1	ZINC000819331731	CD	On-Demand	Anodyne	ADRB1	33	46
COC1(CCNC[C@@H](O)c2cccnc2)CCC1	ZINC000819331731	CD	On-Demand	Anodyne	ADRB3	108	47
Cc1cc(F)ccc1[C@@H](O)CNCCCCS(N)(=O)=O	ZINC000819331774	DC	On-Demand	Anodyne	LEF	85	35
C[C@@H](NC[C@@H](O)c1ccccc1)c1ccnc(O)c1	ZINC000819331775	CE	On-Demand	Anodyne	ADRB2	23	44
C[C@H](NC[C@H](O)c1ccccc1)c1ccnc(O)c1	ZINC000819331776	CE	On-Demand	Anodyne	ADRB2	23	44
NS(=O)(=O)CCCCNC[C@H](O)c1cccc2ccccc12	ZINC000819331835	DD	On-Demand	Anodyne	ADRB2	46	39
O=C(O)[C@H]1CN(Cc2nc3cc(C(F)(F)F)ccc3o2)CCO1	ZINC000819331841	EE	On-Demand	Anodyne	LIPG	53	40
O=C(O)[C@@H]1CN(Cc2nc3cc(C(F)(F)F)ccc3o2)CCO1	ZINC000819331842	EE	On-Demand	Anodyne	LIPG	53	40
NS(=O)(=O)CCCCNC[C@@H](O)c1cccc(Br)c1	ZINC000819331858	FD	On-Demand	Anodyne	ADRB2	52	43
NS(=O)(=O)CCCCNC[C@@H](O)c1cccc(Br)c1	ZINC000819331858	FD	On-Demand	Anodyne	ADRB1	52	43
NS(=O)(=O)CCCCNC[C@@H](O)c1cccc(Br)c1	ZINC000819331858	FD	On-Demand	Anodyne	ADRB3	71	42
NS(=O)(=O)CCCCNC[C@H](O)c1cccc(Br)c1	ZINC000819331860	FD	On-Demand	Anodyne	ADRB2	52	43
NS(=O)(=O)CCCCNC[C@H](O)c1cccc(Br)c1	ZINC000819331860	FD	On-Demand	Anodyne	ADRB1	52	43
NS(=O)(=O)CCCCNC[C@H](O)c1cccc(Br)c1	ZINC000819331860	FD	On-Demand	Anodyne	ADRB3	71	42
CCc1ccc(N2CCN(C(=O)c3cc4c(cn3)OCCO4)CC2)cc1	ZINC000819331878	FE	On-Demand	Anodyne	CCKAR	40	46
O=C(/C=C\c1ccccc1F)NC(C1CC1)C1CC1	ZINC000819331899	CG	On-Demand	Anodyne	KCNQ2	60	45
CCc1ccc(N2CCN(C(=O)c3coc(=O)c4ccccc34)CC2)cc1	ZINC000819331919	FG	On-Demand	Anodyne	PARP1	20	43
C=C(Cl)CSc1nc(C)c(CC(=O)NCc2c(C)nn(C)c2C)s1	ZINC000819331949	GH	On-Demand	Mild	P2RX7	17	42
Cc1ccccc1[C@@H](O)CNCCCCS(N)(=O)=O	ZINC000819331955	CC	On-Demand	Anodyne	ADRB2	41	38
NS(=O)(=O)CCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819331991	DD	On-Demand	Anodyne	ADRB2	46	42
NS(=O)(=O)CCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819331991	DD	On-Demand	Anodyne	ADRB1	37	42
NS(=O)(=O)CCCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819331991	DD	On-Demand	Anodyne	ADRB3	41	42
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819331992	DD	On-Demand	Anodyne	ADRB2	46	42
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819331992	DD	On-Demand	Anodyne	ADRB1	37	42
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819331992	DD	On-Demand	Anodyne	ADRB3	41	42
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C12CCCC2	ZINC000819332005	GG	On-Demand	Mild	PAPA1_CARPA	35	44
CCO[C@@H]1C[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C12CCCC2	ZINC000819332006	GG	On-Demand	Mild	PAPA1_CARPA	35	44
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C12CCCC2	ZINC000819332007	GG	On-Demand	Mild	PAPA1_CARPA	35	44
CCO[C@@H]1C[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C12CCCC2	ZINC000819332008	GG	On-Demand	Mild	PAPA1_CARPA	35	44
CC(C)(C)C1CC(NC[C@H](O)c2ccccc2)C1	ZINC000819332009	BG	On-Demand	Anodyne	AOC3	18	45
CC(C)(C)C1CC(NC[C@@H](O)c2ccccc2)C1	ZINC000819332010	BG	On-Demand	Anodyne	AOC3	18	45
NS(=O)(=O)CCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819332014	DD	On-Demand	Anodyne	ADRB2	69	45
NS(=O)(=O)CCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819332014	DD	On-Demand	Anodyne	ADRB1	72	51
NS(=O)(=O)CCCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819332014	DD	On-Demand	Anodyne	ADRB3	94	53
NS(=O)(=O)CCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819332015	DD	On-Demand	Anodyne	ADRB2	69	45
NS(=O)(=O)CCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819332015	DD	On-Demand	Anodyne	ADRB1	72	51
NS(=O)(=O)CCCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819332015	DD	On-Demand	Anodyne	ADRB3	94	53
CCc1ccc(N2CCN(C(=O)Cc3ccc(-n4cnnc4)cc3)CC2)cc1	ZINC000819332016	GF	On-Demand	Anodyne	KCNJ1	65	44
C=C(Cl)CSc1nc(C)c(CC(=O)Nc2c(C)cccc2Cl)s1	ZINC000819332027	GK	On-Demand	Mild	LCK	38	41
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cc3ccccc3s2)cc1	ZINC000819332029	GG	On-Demand	Anodyne	ADRB2	47	41
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cc3ccccc3s2)cc1	ZINC000819332029	GG	On-Demand	Anodyne	ADRB1	41	38
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cc3ccccc3s2)cc1	ZINC000819332029	GG	On-Demand	Anodyne	ADRB3	95	45
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cc3ccccc3s2)cc1	ZINC000819332030	GG	On-Demand	Anodyne	ADRB2	47	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cc3ccccc3s2)cc1	ZINC000819332030	GG	On-Demand	Anodyne	ADRB1	41	38
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cc3ccccc3s2)cc1	ZINC000819332030	GG	On-Demand	Anodyne	ADRB3	95	45
CN(C)c1ccc(NC(=O)CCNCCCCS(N)(=O)=O)cc1	ZINC000819332045	EC	On-Demand	Anodyne	CA2	15	44
COc1ccc(OC)c([C@H](O)CNCCCCS(N)(=O)=O)c1	ZINC000819332046	EC	On-Demand	Anodyne	ADRB2	41	47
COc1ccc(OC)c([C@H](O)CNCCCCS(N)(=O)=O)c1	ZINC000819332046	EC	On-Demand	Anodyne	ADRB3	30	41
CC(C)(C)C1CC(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819332050	EF	On-Demand	Anodyne	ADRB3	16	41
CC(C)(C)C1CC(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819332051	EF	On-Demand	Anodyne	ADRB3	16	41
CCc1ccc(N2CCN(C(=O)[C@@H]3C[C@H]4C=C[C@H]3N(C(=O)OC)C4)CC2)cc1	ZINC000819332053	GF	On-Demand	Anodyne	ADAM10	30	40
CCc1ccc(N2CCN(C(=O)[C@H]3C[C@H]4C=C[C@H]3N(C(=O)OC)C4)CC2)cc1	ZINC000819332054	GF	On-Demand	Anodyne	ADAM10	30	40
NS(=O)(=O)CCCCNC[C@@H](O)c1cc(F)ccc1F	ZINC000819332076	DC	On-Demand	Anodyne	LEF	48	33
NS(=O)(=O)CCCCNC[C@H](O)c1cc(F)ccc1F	ZINC000819332077	DC	On-Demand	Anodyne	LEF	48	33
COC1(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)CCC1	ZINC000819332094	EG	On-Demand	Anodyne	ADRB3	21	44
NS(=O)(=O)CCCCNC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819332095	FD	On-Demand	Anodyne	ADRB2	49	42
NS(=O)(=O)CCCCNC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819332095	FD	On-Demand	Anodyne	ADRB1	33	42
NS(=O)(=O)CCCCNC[C@@H](O)c1ccc(F)c(Br)c1	ZINC000819332095	FD	On-Demand	Anodyne	ADRB3	39	42
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819332096	FD	On-Demand	Anodyne	ADRB2	49	42
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819332096	FD	On-Demand	Anodyne	ADRB1	33	42
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(F)c(Br)c1	ZINC000819332096	FD	On-Demand	Anodyne	ADRB3	39	42
C[C@@H]1C[C@@H]1N1C[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1=O	ZINC000819332121	GD	On-Demand	Mild	PAPA1_CARPA	36	44
C[C@@H]1C[C@@H]1N1C[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1=O	ZINC000819332122	GD	On-Demand	Mild	PAPA1_CARPA	36	44
C[C@@H]1C[C@@H]1N1C[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1=O	ZINC000819332123	GD	On-Demand	Mild	PAPA1_CARPA	36	44
C[C@@H]1C[C@@H]1N1C[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1=O	ZINC000819332124	GD	On-Demand	Mild	PAPA1_CARPA	36	44
CCc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819332130	FG	On-Demand	Anodyne	HTR1B	24	40
CCc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1	ZINC000819332130	FG	On-Demand	Anodyne	P2RY14	45	34
CC(C)(C)C1CC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819332133	CG	On-Demand	Bother	CACNA1C	60	40
CC(C)(C)C1CC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819332133	CG	On-Demand	Bother	CACNA1D	90	37
CC(C)(C)C1CC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819332134	CG	On-Demand	Bother	CACNA1C	60	40
CC(C)(C)C1CC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819332134	CG	On-Demand	Bother	CACNA1D	90	37
CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccc(F)cc21	ZINC000819332135	GG	On-Demand	Mild	PAPA1_CARPA	35	43
CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccc(F)cc21	ZINC000819332136	GG	On-Demand	Mild	PAPA1_CARPA	35	43
C[C@H](NC[C@H](O)c1cccc(Cl)c1)c1ccnc(O)c1	ZINC000819332143	CF	On-Demand	Anodyne	ADRB2	17	48
C[C@H](NC[C@H](O)c1cccc(Cl)c1)c1ccnc(O)c1	ZINC000819332143	CF	On-Demand	Anodyne	ADRB1	32	46
C[C@H](NC[C@H](O)c1cccc(Cl)c1)c1ccnc(O)c1	ZINC000819332143	CF	On-Demand	Anodyne	ADRB3	45	47
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1ccnc(O)c1	ZINC000819332145	CF	On-Demand	Anodyne	ADRB2	17	48
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1ccnc(O)c1	ZINC000819332145	CF	On-Demand	Anodyne	ADRB1	32	46
C[C@@H](NC[C@@H](O)c1cccc(Cl)c1)c1ccnc(O)c1	ZINC000819332145	CF	On-Demand	Anodyne	ADRB3	45	47
C[C@H](NC[C@H](O)c1cccnc1)c1ccnc(O)c1	ZINC000819332173	CD	On-Demand	Anodyne	ADRB2	24	41
C[C@H](NC[C@H](O)c1cccnc1)c1ccnc(O)c1	ZINC000819332173	CD	On-Demand	Anodyne	ADRB1	25	47
C[C@H](NC[C@H](O)c1cccnc1)c1ccnc(O)c1	ZINC000819332173	CD	On-Demand	Anodyne	ADRB3	64	47
C[C@@H](NC[C@@H](O)c1cccnc1)c1ccnc(O)c1	ZINC000819332176	CD	On-Demand	Anodyne	ADRB2	24	41
C[C@@H](NC[C@@H](O)c1cccnc1)c1ccnc(O)c1	ZINC000819332176	CD	On-Demand	Anodyne	ADRB1	25	47
C[C@@H](NC[C@@H](O)c1cccnc1)c1ccnc(O)c1	ZINC000819332176	CD	On-Demand	Anodyne	ADRB3	64	47
NS(=O)(=O)CCCCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819332191	DC	On-Demand	Anodyne	ADRB2	50	41
NS(=O)(=O)CCCCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819332191	DC	On-Demand	Anodyne	ADRB1	35	41
NS(=O)(=O)CCCCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819332191	DC	On-Demand	Anodyne	ADRB3	49	41
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819332192	DC	On-Demand	Anodyne	ADRB2	50	41
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819332192	DC	On-Demand	Anodyne	ADRB1	35	41
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819332192	DC	On-Demand	Anodyne	ADRB3	49	41
O[C@@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccnc1	ZINC000819332197	DE	On-Demand	Anodyne	ADRB2	35	47
O[C@@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccnc1	ZINC000819332197	DE	On-Demand	Anodyne	ADRB1	47	48
O[C@@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccnc1	ZINC000819332197	DE	On-Demand	Anodyne	ADRB3	129	47
O[C@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccnc1	ZINC000819332198	DE	On-Demand	Anodyne	ADRB2	35	47
O[C@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccnc1	ZINC000819332198	DE	On-Demand	Anodyne	ADRB1	47	48
O[C@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccnc1	ZINC000819332198	DE	On-Demand	Anodyne	ADRB3	129	47
O=C(NC(C1CC1)C1CC1)C1CCN(S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1	ZINC000819332199	IF	On-Demand	Bother	EPHX2	34	48
NS(=O)(=O)CCCCNC[C@@H](O)c1ccc(Br)cc1	ZINC000819332241	FD	On-Demand	Anodyne	ADRB2	45	41
NS(=O)(=O)CCCCNC[C@@H](O)c1ccc(Br)cc1	ZINC000819332241	FD	On-Demand	Anodyne	ADRB1	27	41
NS(=O)(=O)CCCCNC[C@@H](O)c1ccc(Br)cc1	ZINC000819332241	FD	On-Demand	Anodyne	ADRB3	27	41
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(Br)cc1	ZINC000819332242	FD	On-Demand	Anodyne	ADRB2	45	41
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(Br)cc1	ZINC000819332242	FD	On-Demand	Anodyne	ADRB1	27	41
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(Br)cc1	ZINC000819332242	FD	On-Demand	Anodyne	ADRB3	27	41
NS(=O)(=O)CCCCNC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819332276	ED	On-Demand	Anodyne	ADRB2	28	41
NS(=O)(=O)CCCCNC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819332276	ED	On-Demand	Anodyne	ADRB1	29	41
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819332277	ED	On-Demand	Anodyne	ADRB2	28	41
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819332277	ED	On-Demand	Anodyne	ADRB1	29	41
C[C@@H]1CCCC[C@H]1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819332288	FG	On-Demand	Anodyne	F2	23	40
C[C@@H]1CCCC[C@H]1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819332288	FG	On-Demand	Anodyne	OPRK1	28	41
C[C@@H]1CCCC[C@H]1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819332288	FG	On-Demand	Anodyne	SLC6A3	23	41
C[C@@H]1CCCC[C@H]1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819332288	FG	On-Demand	Anodyne	HTR4	70	39
C[C@@H]1CCCC[C@H]1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819332288	FG	On-Demand	Anodyne	GRIN2B	22	46
C[C@@H]1CCCC[C@H]1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819332288	FG	On-Demand	Anodyne	CACNA1I	63	38
C[C@@H]1CCCC[C@@H]1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819332289	FG	On-Demand	Anodyne	F2	23	40
C[C@@H]1CCCC[C@@H]1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819332289	FG	On-Demand	Anodyne	OPRK1	28	41
C[C@@H]1CCCC[C@@H]1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819332289	FG	On-Demand	Anodyne	SLC6A3	23	41
C[C@@H]1CCCC[C@@H]1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819332289	FG	On-Demand	Anodyne	HTR4	70	39
C[C@@H]1CCCC[C@@H]1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819332289	FG	On-Demand	Anodyne	GRIN2B	22	46
C[C@@H]1CCCC[C@@H]1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819332289	FG	On-Demand	Anodyne	CACNA1I	63	38
C[C@@H]1CCCC[C@@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819332290	FG	On-Demand	Anodyne	F2	23	40
C[C@@H]1CCCC[C@@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819332290	FG	On-Demand	Anodyne	OPRK1	28	41
C[C@@H]1CCCC[C@@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819332290	FG	On-Demand	Anodyne	SLC6A3	23	41
C[C@@H]1CCCC[C@@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819332290	FG	On-Demand	Anodyne	HTR4	70	39
C[C@@H]1CCCC[C@@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819332290	FG	On-Demand	Anodyne	GRIN2B	22	46
C[C@@H]1CCCC[C@@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819332290	FG	On-Demand	Anodyne	CACNA1I	63	38
C[C@@H]1CCCC[C@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819332291	FG	On-Demand	Anodyne	F2	23	40
C[C@@H]1CCCC[C@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819332291	FG	On-Demand	Anodyne	OPRK1	28	41
C[C@@H]1CCCC[C@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819332291	FG	On-Demand	Anodyne	SLC6A3	23	41
C[C@@H]1CCCC[C@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819332291	FG	On-Demand	Anodyne	HTR4	70	39
C[C@@H]1CCCC[C@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819332291	FG	On-Demand	Anodyne	GRIN2B	22	46
C[C@@H]1CCCC[C@H]1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819332291	FG	On-Demand	Anodyne	CACNA1I	63	38
O=C(NC(C1CC1)C1CC1)c1cc(S(=O)(=O)Nc2ccccc2F)ccc1Cl	ZINC000819332303	HI	On-Demand	Anodyne	GRM4	22	47
O=S(=O)(CCCNC[C@H](O)c1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000819332310	GG	On-Demand	Anodyne	ADRB3	45	39
O=S(=O)(CCCNC[C@@H](O)c1ccc(F)c(F)c1)c1ccc(Cl)cc1	ZINC000819332311	GG	On-Demand	Anodyne	ADRB3	45	39
C[C@@H](CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)n1cccn1	ZINC000819332312	FE	On-Demand	Clean	NPY2R	63	34
C[C@H](CC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1)n1cccn1	ZINC000819332313	FE	On-Demand	Clean	NPY2R	63	34
C=CCCn1cc(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)nn1	ZINC000819332333	GE	On-Demand	Mild	HTR4	51	37
C=CCCn1cc(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)nn1	ZINC000819332333	GE	On-Demand	Mild	CACNA1I	51	35
C=CCCn1cc(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)nn1	ZINC000819332334	GE	On-Demand	Mild	HTR4	51	37
C=CCCn1cc(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)nn1	ZINC000819332334	GE	On-Demand	Mild	CACNA1I	51	35
O=S(=O)(CCCNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819332344	FE	On-Demand	Anodyne	ADRB2	37	48
O=S(=O)(CCCNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819332344	FE	On-Demand	Anodyne	ADRB1	45	47
O=S(=O)(CCCNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819332344	FE	On-Demand	Anodyne	ADRB3	131	63
O=S(=O)(CCCNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819332344	FE	On-Demand	Anodyne	TBXA2R	15	44
O=S(=O)(CCCNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819332344	FE	On-Demand	Anodyne	TBXAS1	45	48
O=S(=O)(CCCNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819332344	FE	On-Demand	Anodyne	NAMPT	18	42
O=S(=O)(CCCNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819332345	FE	On-Demand	Anodyne	ADRB2	37	48
O=S(=O)(CCCNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819332345	FE	On-Demand	Anodyne	ADRB1	45	47
O=S(=O)(CCCNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819332345	FE	On-Demand	Anodyne	ADRB3	131	63
O=S(=O)(CCCNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819332345	FE	On-Demand	Anodyne	TBXA2R	15	44
O=S(=O)(CCCNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819332345	FE	On-Demand	Anodyne	TBXAS1	45	48
O=S(=O)(CCCNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819332345	FE	On-Demand	Anodyne	NAMPT	18	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2CC(C(C)(C)C)C2)CC1	ZINC000819332379	FG	On-Demand	Anodyne	GPR119	29	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2CC(C(C)(C)C)C2)CC1	ZINC000819332380	FG	On-Demand	Anodyne	GPR119	29	44
COC1(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCC1	ZINC000819332424	CE	On-Demand	Bother	CACNA1C	50	36
COC1(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCC1	ZINC000819332424	CE	On-Demand	Bother	ADRB3	44	33
COC1(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCC1	ZINC000819332424	CE	On-Demand	Bother	CACNA1D	75	36
C[C@@H](NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccnc(O)c1	ZINC000819332448	ED	On-Demand	Anodyne	ADRB3	15	44
C[C@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccnc(O)c1	ZINC000819332449	ED	On-Demand	Anodyne	ADRB3	15	44
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819332511	FE	On-Demand	Anodyne	HTR4	52	37
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819332511	FE	On-Demand	Anodyne	CACNA1I	53	35
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819332512	FE	On-Demand	Anodyne	HTR4	52	37
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819332512	FE	On-Demand	Anodyne	CACNA1I	53	35
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819332513	FE	On-Demand	Anodyne	HTR4	52	37
O=C(/C=C/[C@@H]1CCCO1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819332513	FE	On-Demand	Anodyne	CACNA1I	53	35
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819332514	FE	On-Demand	Anodyne	HTR4	52	37
O=C(/C=C\[C@@H]1CCCO1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819332514	FE	On-Demand	Anodyne	CACNA1I	53	35
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1cc2c(cn1)OCCO2	ZINC000819332562	GE	On-Demand	Anodyne	HTR4	69	39
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1cc2c(cn1)OCCO2	ZINC000819332562	GE	On-Demand	Anodyne	GRIN2B	21	41
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1cc2c(cn1)OCCO2	ZINC000819332562	GE	On-Demand	Anodyne	CACNA1I	62	39
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1cc2c(cn1)OCCO2	ZINC000819332565	GE	On-Demand	Anodyne	HTR4	69	39
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1cc2c(cn1)OCCO2	ZINC000819332565	GE	On-Demand	Anodyne	GRIN2B	21	41
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1cc2c(cn1)OCCO2	ZINC000819332565	GE	On-Demand	Anodyne	CACNA1I	62	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(Oc3ccccn3)c1)C2	ZINC000819332592	GH	On-Demand	Anodyne	CFTR	31	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(Oc3ccccn3)c1)C2	ZINC000819332592	GH	On-Demand	Anodyne	LIMK2	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(Oc3ccccn3)c1)C2	ZINC000819332594	GH	On-Demand	Anodyne	CFTR	31	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(Oc3ccccn3)c1)C2	ZINC000819332594	GH	On-Demand	Anodyne	LIMK2	20	40
CCSCC[C@H](C)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819332597	DF	On-Demand	Anodyne	CTSK	17	42
CCSCC[C@@H](C)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819332598	DF	On-Demand	Anodyne	CTSK	17	42
CC(=O)c1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819332639	FF	On-Demand	Anodyne	ADRB2	41	43
CC(=O)c1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819332639	FF	On-Demand	Anodyne	ADRB1	69	43
CC(=O)c1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819332639	FF	On-Demand	Anodyne	GRIN1	15	43
CC(=O)c1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819332639	FF	On-Demand	Anodyne	ADRB3	38	43
CC(=O)c1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819332639	FF	On-Demand	Anodyne	ABCB1	19	55
CC(=O)c1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819332640	FF	On-Demand	Anodyne	ADRB2	41	43
CC(=O)c1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819332640	FF	On-Demand	Anodyne	ADRB1	69	43
CC(=O)c1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819332640	FF	On-Demand	Anodyne	GRIN1	15	43
CC(=O)c1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819332640	FF	On-Demand	Anodyne	ADRB3	38	43
CC(=O)c1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819332640	FF	On-Demand	Anodyne	ABCB1	19	55
O[C@@H](CNCCCCCN1CCCC1)c1ccc(F)cn1	ZINC000819332642	CE	On-Demand	Anodyne	HNMT	49	37
O[C@H](CNCCCCCN1CCCC1)c1ccc(F)cn1	ZINC000819332643	CE	On-Demand	Anodyne	HNMT	49	37
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1c(F)cc(F)cc1F	ZINC000819332644	FF	On-Demand	Bother	ADRB1	59	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1c(F)cc(F)cc1F	ZINC000819332646	FF	On-Demand	Bother	ADRB1	59	40
NS(=O)(=O)CCCCNC[C@@H](O)c1ccccc1	ZINC000819332647	CC	On-Demand	Anodyne	ADRB2	67	42
NS(=O)(=O)CCCCNC[C@@H](O)c1ccccc1	ZINC000819332647	CC	On-Demand	Anodyne	ADRB1	66	42
NS(=O)(=O)CCCCNC[C@@H](O)c1ccccc1	ZINC000819332647	CC	On-Demand	Anodyne	ADRB3	93	42
NS(=O)(=O)CCCCNC[C@@H](O)c1ccccc1	ZINC000819332647	CC	On-Demand	Anodyne	AOC3	15	47
NS(=O)(=O)CCCCNC[C@H](O)c1ccccc1	ZINC000819332649	CC	On-Demand	Anodyne	ADRB2	67	42
NS(=O)(=O)CCCCNC[C@H](O)c1ccccc1	ZINC000819332649	CC	On-Demand	Anodyne	ADRB1	66	42
NS(=O)(=O)CCCCNC[C@H](O)c1ccccc1	ZINC000819332649	CC	On-Demand	Anodyne	ADRB3	93	42
NS(=O)(=O)CCCCNC[C@H](O)c1ccccc1	ZINC000819332649	CC	On-Demand	Anodyne	AOC3	15	47
CCc1ccc(N2CCN(C(=O)C[S@@](=O)c3cccc(OC)c3)CC2)cc1	ZINC000819332654	GF	On-Demand	Anodyne	DRD4	47	40
CCc1ccc(N2CCN(C(=O)C[S@](=O)c3cccc(OC)c3)CC2)cc1	ZINC000819332656	GF	On-Demand	Anodyne	DRD4	47	40
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1F	ZINC000819332719	CF	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1F	ZINC000819332719	CF	On-Demand	Anodyne	DRD3	42	36
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1F	ZINC000819332719	CF	On-Demand	Anodyne	CHRM3	17	42
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1F	ZINC000819332719	CF	On-Demand	Anodyne	SIGMAR1	15	41
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1F	ZINC000819332719	CF	On-Demand	Anodyne	CHRNA7	21	45
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1F	ZINC000819332719	CF	On-Demand	Anodyne	HNMT	59	39
O[C@H](CNCCCCCN1CCCC1)c1ccccc1F	ZINC000819332721	CF	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CNCCCCCN1CCCC1)c1ccccc1F	ZINC000819332721	CF	On-Demand	Anodyne	DRD3	42	36
O[C@H](CNCCCCCN1CCCC1)c1ccccc1F	ZINC000819332721	CF	On-Demand	Anodyne	CHRM3	17	42
O[C@H](CNCCCCCN1CCCC1)c1ccccc1F	ZINC000819332721	CF	On-Demand	Anodyne	SIGMAR1	15	41
O[C@H](CNCCCCCN1CCCC1)c1ccccc1F	ZINC000819332721	CF	On-Demand	Anodyne	CHRNA7	21	45
O[C@H](CNCCCCCN1CCCC1)c1ccccc1F	ZINC000819332721	CF	On-Demand	Anodyne	HNMT	59	39
NS(=O)(=O)CCCCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819332726	ED	On-Demand	Anodyne	ADRB2	43	41
NS(=O)(=O)CCCCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819332726	ED	On-Demand	Anodyne	ADRB1	43	41
NS(=O)(=O)CCCCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819332726	ED	On-Demand	Anodyne	ADRB3	58	39
NS(=O)(=O)CCCCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819332727	ED	On-Demand	Anodyne	ADRB2	43	41
NS(=O)(=O)CCCCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819332727	ED	On-Demand	Anodyne	ADRB1	43	41
NS(=O)(=O)CCCCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819332727	ED	On-Demand	Anodyne	ADRB3	58	39
COc1ccccc1-c1noc([C@H](C)NC(=O)/C=C/[C@H]2CCCO2)n1	ZINC000819332745	EF	On-Demand	Anodyne	UL26	76	35
COc1ccccc1-c1noc([C@H](C)NC(=O)/C=C/[C@H]2CCCO2)n1	ZINC000819332745	EF	On-Demand	Anodyne	SCAF_EBVB9	68	35
COc1ccccc1-c1noc([C@H](C)NC(=O)/C=C\[C@@H]2CCCO2)n1	ZINC000819332747	EF	On-Demand	Anodyne	UL26	76	35
COc1ccccc1-c1noc([C@H](C)NC(=O)/C=C\[C@@H]2CCCO2)n1	ZINC000819332747	EF	On-Demand	Anodyne	SCAF_EBVB9	68	35
COc1ccccc1-c1noc([C@H](C)NC(=O)/C=C\[C@H]2CCCO2)n1	ZINC000819332749	EF	On-Demand	Anodyne	UL26	76	35
COc1ccccc1-c1noc([C@H](C)NC(=O)/C=C\[C@H]2CCCO2)n1	ZINC000819332749	EF	On-Demand	Anodyne	SCAF_EBVB9	68	35
COc1ccccc1-c1noc([C@H](C)NC(=O)/C=C/[C@@H]2CCCO2)n1	ZINC000819332750	EF	On-Demand	Anodyne	UL26	76	35
COc1ccccc1-c1noc([C@H](C)NC(=O)/C=C/[C@@H]2CCCO2)n1	ZINC000819332750	EF	On-Demand	Anodyne	SCAF_EBVB9	68	35
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1nc(-c2cccc(F)c2)no1	ZINC000819332761	EF	On-Demand	Anodyne	GRM5	15	42
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1nc(-c2cccc(F)c2)no1	ZINC000819332762	EF	On-Demand	Anodyne	GRM5	15	42
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1nc(-c2cccc(F)c2)no1	ZINC000819332763	EF	On-Demand	Anodyne	GRM5	15	42
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1nc(-c2cccc(F)c2)no1	ZINC000819332764	EF	On-Demand	Anodyne	GRM5	15	42
O[C@H](CNCc1c(F)cc(F)cc1F)COc1ccc(Cl)cc1	ZINC000819332766	EG	On-Demand	Anodyne	ADRB2	37	45
O[C@H](CNCc1c(F)cc(F)cc1F)COc1ccc(Cl)cc1	ZINC000819332766	EG	On-Demand	Anodyne	ADRB1	62	45
O[C@H](CNCc1c(F)cc(F)cc1F)COc1ccc(Cl)cc1	ZINC000819332766	EG	On-Demand	Anodyne	GRIN1	21	45
O[C@H](CNCc1c(F)cc(F)cc1F)COc1ccc(Cl)cc1	ZINC000819332766	EG	On-Demand	Anodyne	ADRB3	36	45
O[C@@H](CNCc1c(F)cc(F)cc1F)COc1ccc(Cl)cc1	ZINC000819332767	EG	On-Demand	Anodyne	ADRB2	37	45
O[C@@H](CNCc1c(F)cc(F)cc1F)COc1ccc(Cl)cc1	ZINC000819332767	EG	On-Demand	Anodyne	ADRB1	62	45
O[C@@H](CNCc1c(F)cc(F)cc1F)COc1ccc(Cl)cc1	ZINC000819332767	EG	On-Demand	Anodyne	GRIN1	21	45
O[C@@H](CNCc1c(F)cc(F)cc1F)COc1ccc(Cl)cc1	ZINC000819332767	EG	On-Demand	Anodyne	ADRB3	36	45
O[C@@H](CNC[C@@H]1C[C@H]1C1CCCCC1)c1cccnc1	ZINC000819332777	CF	On-Demand	Anodyne	ADRB1	23	44
O[C@@H](CNC[C@@H]1C[C@H]1C1CCCCC1)c1cccnc1	ZINC000819332777	CF	On-Demand	Anodyne	ADRB3	87	46
O[C@H](CNC[C@@H]1C[C@H]1C1CCCCC1)c1cccnc1	ZINC000819332778	CF	On-Demand	Anodyne	ADRB1	23	44
O[C@H](CNC[C@@H]1C[C@H]1C1CCCCC1)c1cccnc1	ZINC000819332778	CF	On-Demand	Anodyne	ADRB3	87	46
C[C@@H](F)CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819332785	CF	On-Demand	Anodyne	ADRB2	25	40
C[C@@H](F)CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819332785	CF	On-Demand	Anodyne	ADRB3	28	46
COc1ccc(OC)c([C@H](O)CNCCc2cc3ccccc3s2)c1	ZINC000819332794	FH	On-Demand	Anodyne	ADRB2	39	46
COc1ccc(OC)c([C@H](O)CNCCc2cc3ccccc3s2)c1	ZINC000819332794	FH	On-Demand	Anodyne	ADRB1	32	41
NS(=O)(=O)CCCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819332798	FD	On-Demand	Anodyne	ADRB2	52	39
NS(=O)(=O)CCCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819332798	FD	On-Demand	Anodyne	ADRB1	40	39
NS(=O)(=O)CCCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819332798	FD	On-Demand	Anodyne	ADRB3	50	42
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819332799	FD	On-Demand	Anodyne	ADRB2	52	39
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819332799	FD	On-Demand	Anodyne	ADRB1	40	39
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819332799	FD	On-Demand	Anodyne	ADRB3	50	42
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccnc(O)c1	ZINC000819332826	FE	On-Demand	Anodyne	GPR119	56	44
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccnc(O)c1	ZINC000819332829	FE	On-Demand	Anodyne	GPR119	56	44
O[C@H](CN[C@H]1CCCc2c(F)cccc21)c1cccnc1	ZINC000819332851	CF	On-Demand	Anodyne	ADRB3	64	43
O[C@H](CN[C@@H]1CCCc2c(F)cccc21)c1cccnc1	ZINC000819332854	CF	On-Demand	Anodyne	ADRB3	64	43
O[C@@H](CN[C@H]1CCCc2c(F)cccc21)c1cccnc1	ZINC000819332856	CF	On-Demand	Anodyne	ADRB3	64	43
O[C@@H](CN[C@@H]1CCCc2c(F)cccc21)c1cccnc1	ZINC000819332858	CF	On-Demand	Anodyne	ADRB3	64	43
O[C@@H](CNCCc1cc(C(F)(F)F)ccn1)c1ccccc1	ZINC000819332862	DF	On-Demand	Anodyne	ADRB2	30	45
O[C@@H](CNCCc1cc(C(F)(F)F)ccn1)c1ccccc1	ZINC000819332862	DF	On-Demand	Anodyne	ADRB1	43	39
O[C@@H](CNCCc1cc(C(F)(F)F)ccn1)c1ccccc1	ZINC000819332862	DF	On-Demand	Anodyne	ADRB3	89	43
CCc1ccc(N2CCN(C(=O)c3cnc4cc(OC)ccn34)CC2)cc1	ZINC000819332873	FF	On-Demand	Anodyne	IGF1R	22	44
NS(=O)(=O)CCCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819332880	DC	On-Demand	Bother	ADRB2	38	40
NS(=O)(=O)CCCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819332880	DC	On-Demand	Bother	ADRB1	42	40
NS(=O)(=O)CCCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819332880	DC	On-Demand	Bother	ADRB3	54	39
NS(=O)(=O)CCCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819332882	DC	On-Demand	Bother	ADRB2	38	40
NS(=O)(=O)CCCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819332882	DC	On-Demand	Bother	ADRB1	42	40
NS(=O)(=O)CCCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819332882	DC	On-Demand	Bother	ADRB3	54	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000819332889	FH	On-Demand	Anodyne	CFTR	30	43
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(Br)cc2Cl)c1	ZINC000819332890	GH	On-Demand	Bother	ADRB2	19	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(Br)cc2Cl)c1	ZINC000819332890	GH	On-Demand	Bother	ADRB1	33	44
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2ccc(Br)cc2Cl)c1	ZINC000819332890	GH	On-Demand	Bother	ADRB3	52	42
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(Br)cc2Cl)c1	ZINC000819332891	GH	On-Demand	Bother	ADRB2	19	40
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(Br)cc2Cl)c1	ZINC000819332891	GH	On-Demand	Bother	ADRB1	33	44
O=[N+]([O-])c1cccc([C@H](O)CNCCc2ccc(Br)cc2Cl)c1	ZINC000819332891	GH	On-Demand	Bother	ADRB3	52	42
NS(=O)(=O)CCCCNC[C@@H](O)c1cccc(F)c1	ZINC000819332904	CC	On-Demand	Anodyne	ADRB2	52	43
NS(=O)(=O)CCCCNC[C@@H](O)c1cccc(F)c1	ZINC000819332904	CC	On-Demand	Anodyne	ADRB1	51	44
NS(=O)(=O)CCCCNC[C@@H](O)c1cccc(F)c1	ZINC000819332904	CC	On-Demand	Anodyne	ADRB3	71	44
NS(=O)(=O)CCCCNC[C@H](O)c1cccc(F)c1	ZINC000819332906	CC	On-Demand	Anodyne	ADRB2	52	43
NS(=O)(=O)CCCCNC[C@H](O)c1cccc(F)c1	ZINC000819332906	CC	On-Demand	Anodyne	ADRB1	51	44
NS(=O)(=O)CCCCNC[C@H](O)c1cccc(F)c1	ZINC000819332906	CC	On-Demand	Anodyne	ADRB3	71	44
COC1(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)CCC1	ZINC000819332917	DG	On-Demand	Anodyne	ADRB1	17	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCCS(N)(=O)=O)CC1	ZINC000819332923	GC	On-Demand	Anodyne	GPR119	37	45
C[C@@H](CC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)n1cccn1	ZINC000819332925	FE	On-Demand	Anodyne	HTR4	57	40
C[C@@H](CC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)n1cccn1	ZINC000819332925	FE	On-Demand	Anodyne	GRIN2B	22	44
C[C@@H](CC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)n1cccn1	ZINC000819332925	FE	On-Demand	Anodyne	CACNA1I	61	36
C[C@@H](CC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)n1cccn1	ZINC000819332926	FE	On-Demand	Anodyne	HTR4	57	40
C[C@@H](CC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)n1cccn1	ZINC000819332926	FE	On-Demand	Anodyne	GRIN2B	22	44
C[C@@H](CC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)n1cccn1	ZINC000819332926	FE	On-Demand	Anodyne	CACNA1I	61	36
C[C@H](CC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)n1cccn1	ZINC000819332927	FE	On-Demand	Anodyne	HTR4	57	40
C[C@H](CC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)n1cccn1	ZINC000819332927	FE	On-Demand	Anodyne	GRIN2B	22	44
C[C@H](CC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)n1cccn1	ZINC000819332927	FE	On-Demand	Anodyne	CACNA1I	61	36
C[C@H](CC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)n1cccn1	ZINC000819332928	FE	On-Demand	Anodyne	HTR4	57	40
C[C@H](CC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)n1cccn1	ZINC000819332928	FE	On-Demand	Anodyne	GRIN2B	22	44
C[C@H](CC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)n1cccn1	ZINC000819332928	FE	On-Demand	Anodyne	CACNA1I	61	36
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCCS(N)(=O)=O)CC1	ZINC000819332945	GC	On-Demand	Anodyne	GPR119	37	45
O=C(NCc1nc2ccc(F)cc2[nH]1)C(F)=C1CCC1	ZINC000819332968	CF	On-Demand	Anodyne	PIN1	17	42
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819332970	DD	On-Demand	Anodyne	ADRB2	46	43
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819332970	DD	On-Demand	Anodyne	ADRB1	42	40
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819332970	DD	On-Demand	Anodyne	ADRB3	42	40
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000819332976	GH	On-Demand	Mild	PAPA1_CARPA	53	54
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000819332976	GH	On-Demand	Mild	CTSL	17	54
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000819332976	GH	On-Demand	Mild	CTSS	16	54
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000819332976	GH	On-Demand	Mild	FPR1	43	39
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000819332978	GH	On-Demand	Mild	PAPA1_CARPA	53	54
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000819332978	GH	On-Demand	Mild	CTSL	17	54
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000819332978	GH	On-Demand	Mild	CTSS	16	54
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000819332978	GH	On-Demand	Mild	FPR1	43	39
C[C@@H](F)CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819332988	CF	On-Demand	Anodyne	ADRB2	25	40
C[C@@H](F)CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819332988	CF	On-Demand	Anodyne	ADRB3	28	46
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)c1	ZINC000819332991	FF	On-Demand	Bother	ADRB2	24	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)c1	ZINC000819332991	FF	On-Demand	Bother	ADRB1	38	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)c1	ZINC000819332991	FF	On-Demand	Bother	ADRB3	25	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)c1	ZINC000819332992	FF	On-Demand	Bother	ADRB2	24	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)c1	ZINC000819332992	FF	On-Demand	Bother	ADRB1	38	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)c1	ZINC000819332992	FF	On-Demand	Bother	ADRB3	25	47
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cc(C(F)(F)F)ccn2)cc1	ZINC000819332993	GE	On-Demand	Anodyne	ADRB2	26	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cc(C(F)(F)F)ccn2)cc1	ZINC000819332993	GE	On-Demand	Anodyne	ADRB3	89	40
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cc(C(F)(F)F)ccn2)cc1	ZINC000819332994	GE	On-Demand	Anodyne	ADRB2	26	40
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cc(C(F)(F)F)ccn2)cc1	ZINC000819332994	GE	On-Demand	Anodyne	ADRB3	89	40
O[C@@H](CNCCCCCN1CCCC1)c1ccc(F)c(Br)c1	ZINC000819332998	FG	On-Demand	Anodyne	ADRB2	37	41
O[C@@H](CNCCCCCN1CCCC1)c1ccc(F)c(Br)c1	ZINC000819332998	FG	On-Demand	Anodyne	HNMT	47	38
O[C@H](CNCCCCCN1CCCC1)c1ccc(F)c(Br)c1	ZINC000819332999	FG	On-Demand	Anodyne	ADRB2	37	41
O[C@H](CNCCCCCN1CCCC1)c1ccc(F)c(Br)c1	ZINC000819332999	FG	On-Demand	Anodyne	HNMT	47	38
N#Cc1ccc([C@H](O)CNCCCCCN2CCCC2)cc1	ZINC000819333010	DE	On-Demand	Mild	ADRB2	23	40
N#Cc1ccc([C@H](O)CNCCCCCN2CCCC2)cc1	ZINC000819333010	DE	On-Demand	Mild	HRH3	15	52
N#Cc1ccc([C@@H](O)CNCCCCCN2CCCC2)cc1	ZINC000819333011	DE	On-Demand	Mild	ADRB2	23	40
N#Cc1ccc([C@@H](O)CNCCCCCN2CCCC2)cc1	ZINC000819333011	DE	On-Demand	Mild	HRH3	15	52
O[C@@H](CNCCc1cc(C(F)(F)F)ccn1)c1ccc(Cl)cc1	ZINC000819333016	EH	On-Demand	Anodyne	ADRB2	15	41
O[C@@H](CNCCc1cc(C(F)(F)F)ccn1)c1ccc(Cl)cc1	ZINC000819333016	EH	On-Demand	Anodyne	ADRB1	22	40
O[C@@H](CNCCc1cc(C(F)(F)F)ccn1)c1ccc(Cl)cc1	ZINC000819333016	EH	On-Demand	Anodyne	ADRB3	33	40
NS(=O)(=O)CCCCNC[C@@H](O)c1ccc(F)cc1	ZINC000819333040	CC	On-Demand	Anodyne	ADRB2	52	41
NS(=O)(=O)CCCCNC[C@@H](O)c1ccc(F)cc1	ZINC000819333040	CC	On-Demand	Anodyne	LEF	56	37
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(F)cc1	ZINC000819333042	CC	On-Demand	Anodyne	ADRB2	52	41
NS(=O)(=O)CCCCNC[C@H](O)c1ccc(F)cc1	ZINC000819333042	CC	On-Demand	Anodyne	LEF	56	37
COC1(CCNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819333049	CF	On-Demand	Anodyne	ADRB2	46	41
COC1(CCNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819333049	CF	On-Demand	Anodyne	ADRB1	57	48
COC1(CCNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819333049	CF	On-Demand	Anodyne	ADRB3	70	48
O[C@@H](CNC[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819333061	EH	On-Demand	Anodyne	ADRB1	29	40
O[C@@H](CNC[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819333061	EH	On-Demand	Anodyne	ADRB3	81	41
O[C@H](CNC[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819333062	EH	On-Demand	Anodyne	ADRB1	29	40
O[C@H](CNC[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)c1cccnc1	ZINC000819333062	EH	On-Demand	Anodyne	ADRB3	81	41
O=[N+]([O-])c1ccc([C@@H](O)CNCCCCCN2CCCC2)cc1	ZINC000819333081	DE	On-Demand	Bother	KCNJ1	27	40
O=[N+]([O-])c1ccc([C@H](O)CNCCCCCN2CCCC2)cc1	ZINC000819333082	DE	On-Demand	Bother	KCNJ1	27	40
O[C@@H](CNCCCCCN1CCCC1)c1ccc(Cl)cc1Cl	ZINC000819333098	EH	On-Demand	Anodyne	DRD3	22	40
O[C@@H](CNCCCCCN1CCCC1)c1ccc(Cl)cc1Cl	ZINC000819333098	EH	On-Demand	Anodyne	HRP1_PLAFA	49	34
O[C@@H](CNCCCCCN1CCCC1)c1ccc(Cl)cc1Cl	ZINC000819333098	EH	On-Demand	Anodyne	HNMT	55	44
O[C@H](CNCCCCCN1CCCC1)c1ccc(Cl)cc1Cl	ZINC000819333099	EH	On-Demand	Anodyne	DRD3	22	40
O[C@H](CNCCCCCN1CCCC1)c1ccc(Cl)cc1Cl	ZINC000819333099	EH	On-Demand	Anodyne	HRP1_PLAFA	49	34
O[C@H](CNCCCCCN1CCCC1)c1ccc(Cl)cc1Cl	ZINC000819333099	EH	On-Demand	Anodyne	HNMT	55	44
O=C(/C=C\[C@@H]1CCCO1)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000819333116	ED	On-Demand	Anodyne	NPFFR1	48	44
O=C(/C=C\[C@@H]1CCCO1)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000819333117	ED	On-Demand	Anodyne	NPFFR1	48	44
O=C(/C=C/[C@@H]1CCCO1)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000819333118	ED	On-Demand	Anodyne	NPFFR1	48	44
O=C(/C=C/[C@@H]1CCCO1)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000819333119	ED	On-Demand	Anodyne	NPFFR1	48	44
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000819333144	GG	On-Demand	Bother	GPR119	44	46
O=S(=O)(CCCNC[C@H](O)c1ccccc1)c1ccc(Cl)cc1	ZINC000819333147	FF	On-Demand	Anodyne	ADRB2	38	41
O=S(=O)(CCCNC[C@H](O)c1ccccc1)c1ccc(Cl)cc1	ZINC000819333147	FF	On-Demand	Anodyne	ADRB1	50	38
O=S(=O)(CCCNC[C@H](O)c1ccccc1)c1ccc(Cl)cc1	ZINC000819333147	FF	On-Demand	Anodyne	ADRB3	85	45
O=S(=O)(CCCNC[C@@H](O)c1ccccc1)c1ccc(Cl)cc1	ZINC000819333148	FF	On-Demand	Anodyne	ADRB2	38	41
O=S(=O)(CCCNC[C@@H](O)c1ccccc1)c1ccc(Cl)cc1	ZINC000819333148	FF	On-Demand	Anodyne	ADRB1	50	38
O=S(=O)(CCCNC[C@@H](O)c1ccccc1)c1ccc(Cl)cc1	ZINC000819333148	FF	On-Demand	Anodyne	ADRB3	85	45
CCC[C@]1(C)CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819333158	FI	On-Demand	Mild	PAPA1_CARPA	30	43
CCC[C@]1(C)CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819333159	FI	On-Demand	Mild	PAPA1_CARPA	30	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000819333175	GD	On-Demand	Anodyne	NPFFR2	39	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000819333175	GD	On-Demand	Anodyne	NPFFR1	48	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000819333176	GD	On-Demand	Anodyne	NPFFR2	39	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000819333176	GD	On-Demand	Anodyne	NPFFR1	48	38
O=C(/C=C/[C@@H]1CCCO1)NCc1ccc(-c2cccnc2)cc1	ZINC000819333187	DG	On-Demand	Anodyne	NAMPT	45	37
O=C(/C=C\[C@H]1CCCO1)NCc1ccc(-c2cccnc2)cc1	ZINC000819333188	DG	On-Demand	Anodyne	NAMPT	45	37
O=C(/C=C\[C@@H]1CCCO1)NCc1ccc(-c2cccnc2)cc1	ZINC000819333189	DG	On-Demand	Anodyne	NAMPT	45	37
O=C(/C=C/[C@H]1CCCO1)NCc1ccc(-c2cccnc2)cc1	ZINC000819333190	DG	On-Demand	Anodyne	NAMPT	45	37
O=C(NC(C1CC1)C1CC1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Br	ZINC000819333206	IH	On-Demand	Anodyne	EPHX2	15	42
O[C@@H](CNCC1(c2ccc(Br)cc2Cl)CC1)c1cccnc1	ZINC000819333207	GH	On-Demand	Anodyne	ADRB3	54	41
O[C@H](CNCC1(c2ccc(Br)cc2Cl)CC1)c1cccnc1	ZINC000819333208	GH	On-Demand	Anodyne	ADRB3	54	41
Cc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333209	EF	On-Demand	Anodyne	ADRB2	43	53
Cc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333209	EF	On-Demand	Anodyne	ADRB1	63	44
Cc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333209	EF	On-Demand	Anodyne	GRIN1	15	44
Cc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333209	EF	On-Demand	Anodyne	ADRB3	35	44
Cc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333210	EF	On-Demand	Anodyne	ADRB2	43	53
Cc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333210	EF	On-Demand	Anodyne	ADRB1	63	44
Cc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333210	EF	On-Demand	Anodyne	GRIN1	15	44
Cc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333210	EF	On-Demand	Anodyne	ADRB3	35	44
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1C(F)(F)F	ZINC000819333228	EH	On-Demand	Anodyne	DRD2	18	41
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1C(F)(F)F	ZINC000819333228	EH	On-Demand	Anodyne	HNMT	49	37
O[C@H](CNCCCCCN1CCCC1)c1ccccc1C(F)(F)F	ZINC000819333229	EH	On-Demand	Anodyne	DRD2	18	41
O[C@H](CNCCCCCN1CCCC1)c1ccccc1C(F)(F)F	ZINC000819333229	EH	On-Demand	Anodyne	HNMT	49	37
O[C@@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccc(F)c1	ZINC000819333231	EG	On-Demand	Anodyne	ADRB1	29	43
O[C@@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccc(F)c1	ZINC000819333231	EG	On-Demand	Anodyne	ADRB3	62	43
O[C@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccc(F)c1	ZINC000819333232	EG	On-Demand	Anodyne	ADRB1	29	43
O[C@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccc(F)c1	ZINC000819333232	EG	On-Demand	Anodyne	ADRB3	62	43
O[C@@H](CNCCCCCN1CCCC1)c1cccnc1	ZINC000819333235	CD	On-Demand	Anodyne	ADRB2	44	47
O[C@@H](CNCCCCCN1CCCC1)c1cccnc1	ZINC000819333235	CD	On-Demand	Anodyne	ADRB1	47	47
O[C@@H](CNCCCCCN1CCCC1)c1cccnc1	ZINC000819333235	CD	On-Demand	Anodyne	ADRB3	126	52
O[C@@H](CNCCCCCN1CCCC1)c1cccnc1	ZINC000819333235	CD	On-Demand	Anodyne	HNMT	65	39
O[C@H](CNCCCCCN1CCCC1)c1cccnc1	ZINC000819333236	CD	On-Demand	Anodyne	ADRB2	44	47
O[C@H](CNCCCCCN1CCCC1)c1cccnc1	ZINC000819333236	CD	On-Demand	Anodyne	ADRB1	47	47
O[C@H](CNCCCCCN1CCCC1)c1cccnc1	ZINC000819333236	CD	On-Demand	Anodyne	ADRB3	126	52
O[C@H](CNCCCCCN1CCCC1)c1cccnc1	ZINC000819333236	CD	On-Demand	Anodyne	HNMT	65	39
O[C@@H](CNCCCCCN1CCCC1)c1ccc(Cl)cc1	ZINC000819333241	DG	On-Demand	Anodyne	ADRB2	33	42
O[C@@H](CNCCCCCN1CCCC1)c1ccc(Cl)cc1	ZINC000819333241	DG	On-Demand	Anodyne	ADRB1	35	41
O[C@@H](CNCCCCCN1CCCC1)c1ccc(Cl)cc1	ZINC000819333241	DG	On-Demand	Anodyne	DRD3	21	44
O[C@@H](CNCCCCCN1CCCC1)c1ccc(Cl)cc1	ZINC000819333241	DG	On-Demand	Anodyne	ADRB3	37	41
O[C@@H](CNCCCCCN1CCCC1)c1ccc(Cl)cc1	ZINC000819333241	DG	On-Demand	Anodyne	HRH3	15	46
O[C@@H](CNCCCCCN1CCCC1)c1ccc(Cl)cc1	ZINC000819333241	DG	On-Demand	Anodyne	HNMT	56	41
O[C@@H](CNCCCCCN1CCCC1)c1cccc(Br)c1	ZINC000819333242	FG	On-Demand	Anodyne	ADRB2	40	41
O[C@@H](CNCCCCCN1CCCC1)c1cccc(Br)c1	ZINC000819333242	FG	On-Demand	Anodyne	ADRB1	44	39
O[C@@H](CNCCCCCN1CCCC1)c1cccc(Br)c1	ZINC000819333242	FG	On-Demand	Anodyne	ADRB3	56	40
O[C@@H](CNCCCCCN1CCCC1)c1cccc(Br)c1	ZINC000819333242	FG	On-Demand	Anodyne	HNMT	44	34
O[C@H](CNCCCCCN1CCCC1)c1cccc(Br)c1	ZINC000819333243	FG	On-Demand	Anodyne	ADRB2	40	41
O[C@H](CNCCCCCN1CCCC1)c1cccc(Br)c1	ZINC000819333243	FG	On-Demand	Anodyne	ADRB1	44	39
O[C@H](CNCCCCCN1CCCC1)c1cccc(Br)c1	ZINC000819333243	FG	On-Demand	Anodyne	ADRB3	56	40
O[C@H](CNCCCCCN1CCCC1)c1cccc(Br)c1	ZINC000819333243	FG	On-Demand	Anodyne	HNMT	44	34
CON(C)C(=O)CCNCc1ccc(OC(F)F)c(F)c1	ZINC000819333254	DD	On-Demand	Anodyne	LEF	63	36
O[C@@H](CNCCCCCN1CCCC1)c1ccc(Cl)c(F)c1	ZINC000819333259	EG	On-Demand	Anodyne	ADRB2	40	43
O[C@@H](CNCCCCCN1CCCC1)c1ccc(Cl)c(F)c1	ZINC000819333259	EG	On-Demand	Anodyne	ADRB1	36	41
O[C@@H](CNCCCCCN1CCCC1)c1ccc(Cl)c(F)c1	ZINC000819333259	EG	On-Demand	Anodyne	ADRB3	34	41
O[C@@H](CNCCCCCN1CCCC1)c1ccc(Cl)c(F)c1	ZINC000819333259	EG	On-Demand	Anodyne	HNMT	43	38
O[C@H](CNCCCCCN1CCCC1)c1ccc(Cl)c(F)c1	ZINC000819333260	EG	On-Demand	Anodyne	ADRB2	40	43
O[C@H](CNCCCCCN1CCCC1)c1ccc(Cl)c(F)c1	ZINC000819333260	EG	On-Demand	Anodyne	ADRB1	36	41
O[C@H](CNCCCCCN1CCCC1)c1ccc(Cl)c(F)c1	ZINC000819333260	EG	On-Demand	Anodyne	ADRB3	34	41
O[C@H](CNCCCCCN1CCCC1)c1ccc(Cl)c(F)c1	ZINC000819333260	EG	On-Demand	Anodyne	HNMT	43	38
O=C(NC(C1CC1)C1CC1)c1cc(S(=O)(=O)NCCOc2ccccc2)ccc1Cl	ZINC000819333263	IH	On-Demand	Anodyne	TBXA2R	47	38
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2C[C@H]2c2ccccc2)c1	ZINC000819333270	DG	On-Demand	Bother	CACNA1C	51	38
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2C[C@H]2c2ccccc2)c1	ZINC000819333270	DG	On-Demand	Bother	CACNA1D	75	38
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2C[C@H]2c2ccccc2)c1	ZINC000819333271	DG	On-Demand	Bother	CACNA1C	51	38
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2C[C@H]2c2ccccc2)c1	ZINC000819333271	DG	On-Demand	Bother	CACNA1D	75	38
COCCc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333278	FF	On-Demand	Anodyne	ADRB2	45	59
COCCc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333278	FF	On-Demand	Anodyne	ADRB1	75	59
COCCc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333278	FF	On-Demand	Anodyne	GRIN1	23	47
COCCc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333278	FF	On-Demand	Anodyne	ADRB3	48	51
COCCc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333279	FF	On-Demand	Anodyne	ADRB2	45	59
COCCc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333279	FF	On-Demand	Anodyne	ADRB1	75	59
COCCc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333279	FF	On-Demand	Anodyne	GRIN1	23	47
COCCc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333279	FF	On-Demand	Anodyne	ADRB3	48	51
C[C@@H](F)CCNC[C@H](O)c1cccnc1	ZINC000819333285	BD	On-Demand	Anodyne	ADRB2	31	49
C[C@@H](F)CCNC[C@H](O)c1cccnc1	ZINC000819333285	BD	On-Demand	Anodyne	ADRB1	39	49
C[C@@H](F)CCNC[C@H](O)c1cccnc1	ZINC000819333285	BD	On-Demand	Anodyne	ADRB3	118	50
C[C@@H](F)CCNC[C@@H](O)c1cccnc1	ZINC000819333286	BD	On-Demand	Anodyne	ADRB2	31	49
C[C@@H](F)CCNC[C@@H](O)c1cccnc1	ZINC000819333286	BD	On-Demand	Anodyne	ADRB1	39	49
C[C@@H](F)CCNC[C@@H](O)c1cccnc1	ZINC000819333286	BD	On-Demand	Anodyne	ADRB3	118	50
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cnn(CC3CC3)c1)C2	ZINC000819333311	EE	On-Demand	Anodyne	PANC	45	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cnn(CC3CC3)c1)C2	ZINC000819333312	EE	On-Demand	Anodyne	PANC	45	32
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819333314	EF	On-Demand	Anodyne	SLC6A3	22	40
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819333314	EF	On-Demand	Anodyne	HTR4	46	35
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819333314	EF	On-Demand	Anodyne	CACNA1I	53	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819333315	EF	On-Demand	Anodyne	SLC6A3	22	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819333315	EF	On-Demand	Anodyne	HTR4	46	35
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)C(F)=C1CCC1	ZINC000819333315	EF	On-Demand	Anodyne	CACNA1I	53	36
CSc1ccc([C@@H](CNC[C@H](O)c2cccc(Cl)c2)N(C)C)cc1	ZINC000819333322	FH	On-Demand	Anodyne	ADRB1	31	42
CSc1ccc([C@@H](CNC[C@H](O)c2cccc(Cl)c2)N(C)C)cc1	ZINC000819333322	FH	On-Demand	Anodyne	ADRB3	42	42
CSc1ccc([C@H](CNC[C@H](O)c2cccc(Cl)c2)N(C)C)cc1	ZINC000819333323	FH	On-Demand	Anodyne	ADRB1	31	42
CSc1ccc([C@H](CNC[C@H](O)c2cccc(Cl)c2)N(C)C)cc1	ZINC000819333323	FH	On-Demand	Anodyne	ADRB3	42	42
CSc1ccc([C@H](CNC[C@@H](O)c2cccc(Cl)c2)N(C)C)cc1	ZINC000819333324	FH	On-Demand	Anodyne	ADRB1	31	42
CSc1ccc([C@H](CNC[C@@H](O)c2cccc(Cl)c2)N(C)C)cc1	ZINC000819333324	FH	On-Demand	Anodyne	ADRB3	42	42
CSc1ccc([C@@H](CNC[C@@H](O)c2cccc(Cl)c2)N(C)C)cc1	ZINC000819333325	FH	On-Demand	Anodyne	ADRB1	31	42
CSc1ccc([C@@H](CNC[C@@H](O)c2cccc(Cl)c2)N(C)C)cc1	ZINC000819333325	FH	On-Demand	Anodyne	ADRB3	42	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(-c3cccnc3)cc1)C2	ZINC000819333332	GG	On-Demand	Anodyne	VHL	59	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(-c3cccnc3)cc1)C2	ZINC000819333333	GG	On-Demand	Anodyne	VHL	59	33
O=S(=O)(CCCNC[C@H](O)c1ccc(Cl)cc1)c1ccc(Cl)cc1	ZINC000819333348	GG	On-Demand	Anodyne	ADRB3	43	43
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@](O)(c1ccccc1)C(F)(F)F	ZINC000819333357	EG	On-Demand	Anodyne	KCNJ11	27	41
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@](O)(c1ccccc1)C(F)(F)F	ZINC000819333357	EG	On-Demand	Anodyne	AMY2	45	31
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@@](O)(c1ccccc1)C(F)(F)F	ZINC000819333358	EG	On-Demand	Anodyne	KCNJ11	27	41
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@@](O)(c1ccccc1)C(F)(F)F	ZINC000819333358	EG	On-Demand	Anodyne	AMY2	45	31
C[C@@H]1CCCC[C@H]1C(=O)NC[C@@](O)(c1ccccc1)C(F)(F)F	ZINC000819333359	EG	On-Demand	Anodyne	KCNJ11	27	41
C[C@@H]1CCCC[C@H]1C(=O)NC[C@@](O)(c1ccccc1)C(F)(F)F	ZINC000819333359	EG	On-Demand	Anodyne	AMY2	45	31
C[C@@H]1CCCC[C@H]1C(=O)NC[C@](O)(c1ccccc1)C(F)(F)F	ZINC000819333360	EG	On-Demand	Anodyne	KCNJ11	27	41
C[C@@H]1CCCC[C@H]1C(=O)NC[C@](O)(c1ccccc1)C(F)(F)F	ZINC000819333360	EG	On-Demand	Anodyne	AMY2	45	31
CCO[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)[C@@H]1n1cccn1	ZINC000819333361	EF	On-Demand	Anodyne	CYP3A4	44	34
CCO[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@H]1n1cccn1	ZINC000819333362	EF	On-Demand	Anodyne	CYP3A4	44	34
CCO[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)[C@@H]1n1cccn1	ZINC000819333363	EF	On-Demand	Anodyne	CYP3A4	44	34
CCO[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)[C@H]1n1cccn1	ZINC000819333364	EF	On-Demand	Anodyne	CYP3A4	44	34
O=C(NC[C@]1(O)CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819333369	DE	On-Demand	Anodyne	NPFFR2	43	45
O=C(NC[C@]1(O)CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819333369	DE	On-Demand	Anodyne	NPFFR1	55	46
O=C(NC[C@@]1(O)CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819333370	DE	On-Demand	Anodyne	NPFFR2	43	45
O=C(NC[C@@]1(O)CCN(Cc2ccccc2)C1)C(F)=C1CCC1	ZINC000819333370	DE	On-Demand	Anodyne	NPFFR1	55	46
O[C@H](CN[C@H]1CCCc2c(F)cc(F)cc21)c1cccnc1	ZINC000819333383	DG	On-Demand	Anodyne	ADRB3	56	44
O[C@H](CN[C@@H]1CCCc2c(F)cc(F)cc21)c1cccnc1	ZINC000819333384	DG	On-Demand	Anodyne	ADRB3	56	44
O[C@@H](CN[C@H]1CCCc2c(F)cc(F)cc21)c1cccnc1	ZINC000819333385	DG	On-Demand	Anodyne	ADRB3	56	44
O[C@@H](CN[C@@H]1CCCc2c(F)cc(F)cc21)c1cccnc1	ZINC000819333386	DG	On-Demand	Anodyne	ADRB3	56	44
O[C@H](CN[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1cccnc1	ZINC000819333405	DG	On-Demand	Anodyne	ADRB3	56	43
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cc(C(F)(F)F)ccn2)c1	ZINC000819333407	FF	On-Demand	Bother	ADRB3	62	38
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cc(C(F)(F)F)ccn2)c1	ZINC000819333408	FF	On-Demand	Bother	ADRB3	62	38
COc1ccccc1-c1noc([C@H](C)NC(=O)C(F)=C2CCC2)n1	ZINC000819333417	EG	On-Demand	Anodyne	LUCI_PHOPE	31	43
COc1ccccc1-c1noc([C@@H](C)NC(=O)C(F)=C2CCC2)n1	ZINC000819333418	EG	On-Demand	Anodyne	LUCI_PHOPE	31	43
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333420	FF	On-Demand	Anodyne	ADRB2	48	58
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333420	FF	On-Demand	Anodyne	ADRB1	85	58
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333420	FF	On-Demand	Anodyne	GRIN1	28	47
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333420	FF	On-Demand	Anodyne	ADRB3	52	58
CC(=O)Nc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333421	FF	On-Demand	Anodyne	ADRB2	48	58
CC(=O)Nc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333421	FF	On-Demand	Anodyne	ADRB1	85	58
CC(=O)Nc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333421	FF	On-Demand	Anodyne	GRIN1	28	47
CC(=O)Nc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333421	FF	On-Demand	Anodyne	ADRB3	52	58
C[C@@H](F)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819333422	BF	On-Demand	Anodyne	ADRB2	47	42
C[C@@H](F)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819333422	BF	On-Demand	Anodyne	ADRB1	58	51
C[C@@H](F)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819333422	BF	On-Demand	Anodyne	ADRB3	73	51
C[C@@H](F)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819333425	BF	On-Demand	Anodyne	ADRB2	47	42
C[C@@H](F)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819333425	BF	On-Demand	Anodyne	ADRB1	58	51
C[C@@H](F)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819333425	BF	On-Demand	Anodyne	ADRB3	73	51
CC[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCS1	ZINC000819333426	FF	On-Demand	Mild	PAPA1_CARPA	30	42
CC[C@H]1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCS1	ZINC000819333428	FF	On-Demand	Mild	PAPA1_CARPA	30	42
O[C@@H](CNCCCCCN1CCCC1)c1ccc(F)cc1F	ZINC000819333440	DF	On-Demand	Anodyne	ADRB2	18	40
O[C@@H](CNCCCCCN1CCCC1)c1ccc(F)cc1F	ZINC000819333440	DF	On-Demand	Anodyne	CHRM3	15	43
O[C@@H](CNCCCCCN1CCCC1)c1ccc(F)cc1F	ZINC000819333440	DF	On-Demand	Anodyne	HNMT	42	35
O[C@H](CNCCCCCN1CCCC1)c1ccc(F)cc1F	ZINC000819333441	DF	On-Demand	Anodyne	ADRB2	18	40
O[C@H](CNCCCCCN1CCCC1)c1ccc(F)cc1F	ZINC000819333441	DF	On-Demand	Anodyne	CHRM3	15	43
O[C@H](CNCCCCCN1CCCC1)c1ccc(F)cc1F	ZINC000819333441	DF	On-Demand	Anodyne	HNMT	42	35
O[C@@H](CNCCCCCN1CCCC1)c1cccc2ccccc12	ZINC000819333453	EH	On-Demand	Anodyne	ADRB2	30	40
O[C@@H](CNCCCCCN1CCCC1)c1cccc2ccccc12	ZINC000819333453	EH	On-Demand	Anodyne	HTR1A	34	42
O[C@@H](CNCCCCCN1CCCC1)c1cccc2ccccc12	ZINC000819333453	EH	On-Demand	Anodyne	DRD2	33	41
O[C@@H](CNCCCCCN1CCCC1)c1cccc2ccccc12	ZINC000819333453	EH	On-Demand	Anodyne	DRD4	19	40
O[C@@H](CNCCCCCN1CCCC1)c1cccc2ccccc12	ZINC000819333453	EH	On-Demand	Anodyne	HTR2A	25	41
O[C@@H](CNCCCCCN1CCCC1)c1cccc2ccccc12	ZINC000819333453	EH	On-Demand	Anodyne	DRD3	46	42
O[C@@H](CNCCCCCN1CCCC1)c1cccc2ccccc12	ZINC000819333453	EH	On-Demand	Anodyne	HTR4	36	41
O[C@@H](CNCCCCCN1CCCC1)c1cccc2ccccc12	ZINC000819333453	EH	On-Demand	Anodyne	CHRM3	20	40
O[C@@H](CNCCCCCN1CCCC1)c1cccc2ccccc12	ZINC000819333453	EH	On-Demand	Anodyne	HRH3	21	43
O[C@@H](CNCCCCCN1CCCC1)c1cccc2ccccc12	ZINC000819333453	EH	On-Demand	Anodyne	SIGMAR1	17	40
O[C@@H](CNCCCCCN1CCCC1)c1cccc2ccccc12	ZINC000819333453	EH	On-Demand	Anodyne	HNMT	98	43
N#CCc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333493	FF	On-Demand	Mild	ADRB2	35	45
N#CCc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333493	FF	On-Demand	Mild	ADRB1	62	45
N#CCc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333493	FF	On-Demand	Mild	GRIN1	15	41
N#CCc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333493	FF	On-Demand	Mild	ADRB3	38	45
N#CCc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333494	FF	On-Demand	Mild	ADRB2	35	45
N#CCc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333494	FF	On-Demand	Mild	ADRB1	62	45
N#CCc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333494	FF	On-Demand	Mild	GRIN1	15	41
N#CCc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333494	FF	On-Demand	Mild	ADRB3	38	45
CC(=O)c1cccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)c1	ZINC000819333497	FF	On-Demand	Anodyne	ADRB2	36	45
CC(=O)c1cccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)c1	ZINC000819333497	FF	On-Demand	Anodyne	ADRB1	63	40
CC(=O)c1cccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)c1	ZINC000819333497	FF	On-Demand	Anodyne	ABCB1	23	48
CC(=O)c1cccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)c1	ZINC000819333497	FF	On-Demand	Anodyne	PDS	57	38
CC(=O)c1cccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)c1	ZINC000819333498	FF	On-Demand	Anodyne	ADRB2	36	45
CC(=O)c1cccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)c1	ZINC000819333498	FF	On-Demand	Anodyne	ADRB1	63	40
CC(=O)c1cccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)c1	ZINC000819333498	FF	On-Demand	Anodyne	ABCB1	23	48
CC(=O)c1cccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)c1	ZINC000819333498	FF	On-Demand	Anodyne	PDS	57	38
CON(C)C(=O)CCNCCCCCN1CCCC1	ZINC000819333499	CD	On-Demand	Anodyne	PAOX	42	44
O[C@@H](CNCCCCCN1CCCC1)c1ccc(F)c(F)c1	ZINC000819333501	DF	On-Demand	Anodyne	ADRB2	42	43
O[C@@H](CNCCCCCN1CCCC1)c1ccc(F)c(F)c1	ZINC000819333501	DF	On-Demand	Anodyne	HNMT	44	37
O[C@H](CNCCCCCN1CCCC1)c1ccc(F)c(F)c1	ZINC000819333502	DF	On-Demand	Anodyne	ADRB2	42	43
O[C@H](CNCCCCCN1CCCC1)c1ccc(F)c(F)c1	ZINC000819333502	DF	On-Demand	Anodyne	HNMT	44	37
O[C@H](CNCc1c(F)cc(F)cc1F)COc1ccc(F)cc1	ZINC000819333505	EF	On-Demand	Anodyne	ADRB2	47	47
O[C@H](CNCc1c(F)cc(F)cc1F)COc1ccc(F)cc1	ZINC000819333505	EF	On-Demand	Anodyne	ADRB1	70	47
O[C@H](CNCc1c(F)cc(F)cc1F)COc1ccc(F)cc1	ZINC000819333505	EF	On-Demand	Anodyne	ADRB3	41	47
O[C@@H](CN[C@@H]1C[C@@H](c2ccccc2Cl)C1)c1cccnc1	ZINC000819333506	DG	On-Demand	Anodyne	ADRB3	56	43
Cc1cc(F)ccc1[C@@H](O)CNCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819333508	GG	On-Demand	Anodyne	LEF	69	37
O=S(=O)(CCCNC[C@H](O)c1cccc(F)c1)c1ccc(Cl)cc1	ZINC000819333548	FF	On-Demand	Anodyne	ADRB1	42	42
O=S(=O)(CCCNC[C@H](O)c1cccc(F)c1)c1ccc(Cl)cc1	ZINC000819333548	FF	On-Demand	Anodyne	ADRB3	69	42
O=S(=O)(CCCNC[C@@H](O)c1cccc(F)c1)c1ccc(Cl)cc1	ZINC000819333549	FF	On-Demand	Anodyne	ADRB1	42	42
O=S(=O)(CCCNC[C@@H](O)c1cccc(F)c1)c1ccc(Cl)cc1	ZINC000819333549	FF	On-Demand	Anodyne	ADRB3	69	42
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1	ZINC000819333587	GF	On-Demand	Clean	HTR1D	24	41
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1	ZINC000819333587	GF	On-Demand	Clean	HTR1B	20	41
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1	ZINC000819333587	GF	On-Demand	Clean	NPY2R	84	39
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCC(O)CC3)c(F)c2)c1	ZINC000819333587	GF	On-Demand	Clean	CCR3	48	35
CC(=O)Nc1cccc(CC(=O)NC[C@@](O)(c2ccccc2)C(F)(F)F)c1	ZINC000819333593	GF	On-Demand	Anodyne	KCNJ11	81	36
CC(=O)Nc1cccc(CC(=O)NC[C@@](O)(c2ccccc2)C(F)(F)F)c1	ZINC000819333593	GF	On-Demand	Anodyne	KCNK3	77	42
CC(=O)Nc1cccc(CC(=O)NC[C@@](O)(c2ccccc2)C(F)(F)F)c1	ZINC000819333593	GF	On-Demand	Anodyne	KCNK9	53	33
CC(=O)Nc1cccc(CC(=O)NC[C@](O)(c2ccccc2)C(F)(F)F)c1	ZINC000819333594	GF	On-Demand	Anodyne	KCNJ11	81	36
CC(=O)Nc1cccc(CC(=O)NC[C@](O)(c2ccccc2)C(F)(F)F)c1	ZINC000819333594	GF	On-Demand	Anodyne	KCNK3	77	42
CC(=O)Nc1cccc(CC(=O)NC[C@](O)(c2ccccc2)C(F)(F)F)c1	ZINC000819333594	GF	On-Demand	Anodyne	KCNK9	53	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cnn(CC2CC2)c1	ZINC000819333596	DE	On-Demand	Anodyne	PANC	56	37
O[C@@H](CNCc1c(F)cc(F)cc1F)COc1ccc(F)cc1	ZINC000819333606	EF	On-Demand	Anodyne	ADRB2	47	47
O[C@@H](CNCc1c(F)cc(F)cc1F)COc1ccc(F)cc1	ZINC000819333606	EF	On-Demand	Anodyne	ADRB1	70	47
O[C@@H](CNCc1c(F)cc(F)cc1F)COc1ccc(F)cc1	ZINC000819333606	EF	On-Demand	Anodyne	ADRB3	41	47
O[C@H](CNC[C@@H]1CN(Cc2ccccc2)CC12CCOCC2)c1ccc(F)cc1	ZINC000819333623	GG	On-Demand	Anodyne	SLC6A3	15	45
O[C@@H](CNC[C@@H]1CN(Cc2ccccc2)CC12CCOCC2)c1ccc(F)cc1	ZINC000819333624	GG	On-Demand	Anodyne	SLC6A3	15	45
O[C@@H](CNC[C@H]1CN(Cc2ccccc2)CC12CCOCC2)c1ccc(F)cc1	ZINC000819333625	GG	On-Demand	Anodyne	SLC6A3	15	45
O[C@H](CNC[C@H]1CN(Cc2ccccc2)CC12CCOCC2)c1ccc(F)cc1	ZINC000819333626	GG	On-Demand	Anodyne	SLC6A3	15	45
O[C@@H](CNCCc1cc(C(F)(F)F)ccn1)c1ccc(OC(F)(F)F)cc1	ZINC000819333629	GH	On-Demand	Anodyne	ADRB3	32	40
O[C@H](CNCCc1cc(C(F)(F)F)ccn1)c1ccc(OC(F)(F)F)cc1	ZINC000819333630	GH	On-Demand	Anodyne	ADRB3	32	40
Cc1ccccc1[C@@H](O)CNCCCCCN1CCCC1	ZINC000819333632	CF	On-Demand	Anodyne	ADRB2	26	41
Cc1ccccc1[C@@H](O)CNCCCCCN1CCCC1	ZINC000819333632	CF	On-Demand	Anodyne	SLC6A1	32	42
Cc1ccccc1[C@@H](O)CNCCCCCN1CCCC1	ZINC000819333632	CF	On-Demand	Anodyne	CHRM3	19	41
Cc1ccccc1[C@@H](O)CNCCCCCN1CCCC1	ZINC000819333632	CF	On-Demand	Anodyne	HRH3	24	44
Cc1ccccc1[C@@H](O)CNCCCCCN1CCCC1	ZINC000819333632	CF	On-Demand	Anodyne	SIGMAR1	15	41
Cc1ccccc1[C@@H](O)CNCCCCCN1CCCC1	ZINC000819333632	CF	On-Demand	Anodyne	HNMT	88	44
O[C@H](CNCc1c(F)cc(F)cc1F)COc1ccccc1	ZINC000819333633	DF	On-Demand	Anodyne	ADRB2	52	56
O[C@H](CNCc1c(F)cc(F)cc1F)COc1ccccc1	ZINC000819333633	DF	On-Demand	Anodyne	ADRB1	82	48
O[C@H](CNCc1c(F)cc(F)cc1F)COc1ccccc1	ZINC000819333633	DF	On-Demand	Anodyne	ADRB3	49	48
O[C@H](CNCc1c(F)cc(F)cc1F)COc1ccccc1	ZINC000819333633	DF	On-Demand	Anodyne	ABCB1	18	41
O[C@@H](CNCc1c(F)cc(F)cc1F)COc1ccccc1	ZINC000819333634	DF	On-Demand	Anodyne	ADRB2	52	56
O[C@@H](CNCc1c(F)cc(F)cc1F)COc1ccccc1	ZINC000819333634	DF	On-Demand	Anodyne	ADRB1	82	48
O[C@@H](CNCc1c(F)cc(F)cc1F)COc1ccccc1	ZINC000819333634	DF	On-Demand	Anodyne	ADRB3	49	48
O[C@@H](CNCc1c(F)cc(F)cc1F)COc1ccccc1	ZINC000819333634	DF	On-Demand	Anodyne	ABCB1	18	41
O[C@H](CNCCCCCN1CCCC1)c1cc2ccccc2o1	ZINC000819333638	DG	On-Demand	Anodyne	HTR1A	15	45
O[C@H](CNCCCCCN1CCCC1)c1cc2ccccc2o1	ZINC000819333638	DG	On-Demand	Anodyne	DRD2	18	43
O[C@H](CNCCCCCN1CCCC1)c1cc2ccccc2o1	ZINC000819333638	DG	On-Demand	Anodyne	DRD3	36	45
O[C@H](CNCCCCCN1CCCC1)c1cc2ccccc2o1	ZINC000819333638	DG	On-Demand	Anodyne	SIGMAR1	18	41
O[C@H](CNCCCCCN1CCCC1)c1cc2ccccc2o1	ZINC000819333638	DG	On-Demand	Anodyne	CHRNA7	18	40
O[C@H](CNCCCCCN1CCCC1)c1cc2ccccc2o1	ZINC000819333638	DG	On-Demand	Anodyne	HNMT	47	35
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333639	CF	On-Demand	Anodyne	ADRB2	50	44
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333639	CF	On-Demand	Anodyne	ADRB1	50	43
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333639	CF	On-Demand	Anodyne	HTR1A	25	43
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333639	CF	On-Demand	Anodyne	DRD2	27	45
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333639	CF	On-Demand	Anodyne	HTR2A	18	44
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333639	CF	On-Demand	Anodyne	DRD3	38	45
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333639	CF	On-Demand	Anodyne	SLC6A3	23	41
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333639	CF	On-Demand	Anodyne	CHRM3	21	44
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333639	CF	On-Demand	Anodyne	ADRB3	79	43
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333639	CF	On-Demand	Anodyne	HRH3	28	43
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333639	CF	On-Demand	Anodyne	SIGMAR1	26	48
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333639	CF	On-Demand	Anodyne	BCHE	17	43
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333639	CF	On-Demand	Anodyne	CHRNA7	16	46
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333639	CF	On-Demand	Anodyne	HNMT	86	41
O[C@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333640	CF	On-Demand	Anodyne	ADRB2	50	44
O[C@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333640	CF	On-Demand	Anodyne	ADRB1	50	43
O[C@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333640	CF	On-Demand	Anodyne	HTR1A	25	43
O[C@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333640	CF	On-Demand	Anodyne	DRD2	27	45
O[C@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333640	CF	On-Demand	Anodyne	HTR2A	18	44
O[C@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333640	CF	On-Demand	Anodyne	DRD3	38	45
O[C@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333640	CF	On-Demand	Anodyne	SLC6A3	23	41
O[C@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333640	CF	On-Demand	Anodyne	CHRM3	21	44
O[C@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333640	CF	On-Demand	Anodyne	ADRB3	79	43
O[C@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333640	CF	On-Demand	Anodyne	HRH3	28	43
O[C@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333640	CF	On-Demand	Anodyne	SIGMAR1	26	48
O[C@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333640	CF	On-Demand	Anodyne	BCHE	17	43
O[C@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333640	CF	On-Demand	Anodyne	CHRNA7	16	46
O[C@H](CNCCCCCN1CCCC1)c1ccccc1	ZINC000819333640	CF	On-Demand	Anodyne	HNMT	86	41
C[C@@H](F)CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819333648	CF	On-Demand	Anodyne	ADRB2	19	47
C[C@@H](F)CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819333648	CF	On-Demand	Anodyne	ADRB1	19	47
C[C@@H](F)CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819333649	CF	On-Demand	Anodyne	ADRB2	19	47
C[C@@H](F)CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819333649	CF	On-Demand	Anodyne	ADRB1	19	47
C[C@@](O)(CNCCCCCN1CCCC1)c1ccc(Br)cc1F	ZINC000819333653	GH	On-Demand	Anodyne	HNMT	50	37
O[C@@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccc(Cl)c1	ZINC000819333661	EH	On-Demand	Anodyne	ADRB1	50	50
O[C@@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccc(Cl)c1	ZINC000819333661	EH	On-Demand	Anodyne	ADRB3	80	50
O[C@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccc(Cl)c1	ZINC000819333662	EH	On-Demand	Anodyne	ADRB1	50	50
O[C@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccc(Cl)c1	ZINC000819333662	EH	On-Demand	Anodyne	ADRB3	80	50
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1Br	ZINC000819333663	FG	On-Demand	Anodyne	HNMT	55	39
O[C@H](CNCCCCCN1CCCC1)c1ccccc1Br	ZINC000819333664	FG	On-Demand	Anodyne	HNMT	55	39
O[C@@H](CNCCCCCN1CCCC1)c1c(F)cccc1F	ZINC000819333676	DF	On-Demand	Anodyne	CHRNA7	19	42
O[C@@H](CNCCCCCN1CCCC1)c1c(F)cccc1F	ZINC000819333676	DF	On-Demand	Anodyne	HNMT	51	36
O[C@H](CNCCCCCN1CCCC1)c1c(F)cccc1F	ZINC000819333677	DF	On-Demand	Anodyne	CHRNA7	19	42
O[C@H](CNCCCCCN1CCCC1)c1c(F)cccc1F	ZINC000819333677	DF	On-Demand	Anodyne	HNMT	51	36
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1Cl	ZINC000819333687	DG	On-Demand	Anodyne	ADRB2	24	41
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1Cl	ZINC000819333687	DG	On-Demand	Anodyne	DRD3	42	39
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1Cl	ZINC000819333687	DG	On-Demand	Anodyne	CHRM3	20	41
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1Cl	ZINC000819333687	DG	On-Demand	Anodyne	SIGMAR1	21	42
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1Cl	ZINC000819333687	DG	On-Demand	Anodyne	CHRNA7	15	42
O[C@@H](CNCCCCCN1CCCC1)c1ccccc1Cl	ZINC000819333687	DG	On-Demand	Anodyne	HNMT	62	39
O[C@H](CNC[C@H]1CN(Cc2ccccc2)CC12CCOCC2)c1cccnc1	ZINC000819333696	GF	On-Demand	Anodyne	ADRB3	62	39
O[C@H](CNC[C@@H]1CN(Cc2ccccc2)CC12CCOCC2)c1cccnc1	ZINC000819333697	GF	On-Demand	Anodyne	ADRB3	62	39
O[C@@H](CNC[C@H]1CN(Cc2ccccc2)CC12CCOCC2)c1cccnc1	ZINC000819333698	GF	On-Demand	Anodyne	ADRB3	62	39
O[C@@H](CNC[C@@H]1CN(Cc2ccccc2)CC12CCOCC2)c1cccnc1	ZINC000819333699	GF	On-Demand	Anodyne	ADRB3	62	39
CSc1ccc([C@@H](CNC[C@H](O)c2ccccc2)N(C)C)cc1	ZINC000819333772	EG	On-Demand	Anodyne	AOC3	23	41
CSc1ccc([C@H](CNC[C@H](O)c2ccccc2)N(C)C)cc1	ZINC000819333773	EG	On-Demand	Anodyne	AOC3	23	41
CSc1ccc([C@H](CNC[C@@H](O)c2ccccc2)N(C)C)cc1	ZINC000819333774	EG	On-Demand	Anodyne	AOC3	23	41
CSc1ccc([C@@H](CNC[C@@H](O)c2ccccc2)N(C)C)cc1	ZINC000819333775	EG	On-Demand	Anodyne	AOC3	23	41
O=S(=O)(CCCNC[C@H](O)c1cccc(Cl)c1)c1ccc(Cl)cc1	ZINC000819333797	GG	On-Demand	Anodyne	ADRB2	53	42
O=S(=O)(CCCNC[C@H](O)c1cccc(Cl)c1)c1ccc(Cl)cc1	ZINC000819333797	GG	On-Demand	Anodyne	ADRB1	64	48
O=S(=O)(CCCNC[C@H](O)c1cccc(Cl)c1)c1ccc(Cl)cc1	ZINC000819333797	GG	On-Demand	Anodyne	ADRB3	102	48
O=S(=O)(CCCNC[C@@H](O)c1cccc(Cl)c1)c1ccc(Cl)cc1	ZINC000819333798	GG	On-Demand	Anodyne	ADRB2	53	42
O=S(=O)(CCCNC[C@@H](O)c1cccc(Cl)c1)c1ccc(Cl)cc1	ZINC000819333798	GG	On-Demand	Anodyne	ADRB1	64	48
O=S(=O)(CCCNC[C@@H](O)c1cccc(Cl)c1)c1ccc(Cl)cc1	ZINC000819333798	GG	On-Demand	Anodyne	ADRB3	102	48
O[C@@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333825	DG	On-Demand	Anodyne	ADRB2	54	44
O[C@@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333825	DG	On-Demand	Anodyne	ADRB1	61	52
O[C@@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333825	DG	On-Demand	Anodyne	HTR1A	23	45
O[C@@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333825	DG	On-Demand	Anodyne	DRD2	20	45
O[C@@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333825	DG	On-Demand	Anodyne	HTR2A	25	45
O[C@@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333825	DG	On-Demand	Anodyne	DRD3	33	42
O[C@@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333825	DG	On-Demand	Anodyne	ADRB3	79	52
O[C@@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333825	DG	On-Demand	Anodyne	HRH3	15	42
O[C@@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333825	DG	On-Demand	Anodyne	HNMT	60	42
O[C@@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333825	DG	On-Demand	Anodyne	CYP3A4	40	34
O[C@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333826	DG	On-Demand	Anodyne	ADRB2	54	44
O[C@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333826	DG	On-Demand	Anodyne	ADRB1	61	52
O[C@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333826	DG	On-Demand	Anodyne	HTR1A	23	45
O[C@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333826	DG	On-Demand	Anodyne	DRD2	20	45
O[C@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333826	DG	On-Demand	Anodyne	HTR2A	25	45
O[C@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333826	DG	On-Demand	Anodyne	DRD3	33	42
O[C@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333826	DG	On-Demand	Anodyne	ADRB3	79	52
O[C@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333826	DG	On-Demand	Anodyne	HRH3	15	42
O[C@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333826	DG	On-Demand	Anodyne	HNMT	60	42
O[C@H](CNCCCCCN1CCCC1)c1cccc(Cl)c1	ZINC000819333826	DG	On-Demand	Anodyne	CYP3A4	40	34
O[C@@H](CNCCCCCN1CCCC1)c1cccc(C(F)(F)F)c1	ZINC000819333831	EH	On-Demand	Anodyne	ADRB1	40	39
O[C@@H](CNCCCCCN1CCCC1)c1cccc(C(F)(F)F)c1	ZINC000819333831	EH	On-Demand	Anodyne	DRD3	19	43
O[C@@H](CNCCCCCN1CCCC1)c1cccc(C(F)(F)F)c1	ZINC000819333831	EH	On-Demand	Anodyne	ADRB3	48	39
O[C@@H](CNCCCCCN1CCCC1)c1cccc(C(F)(F)F)c1	ZINC000819333831	EH	On-Demand	Anodyne	CCR2	19	42
O[C@H](CNCCCCCN1CCCC1)c1cccc(C(F)(F)F)c1	ZINC000819333832	EH	On-Demand	Anodyne	ADRB1	40	39
O[C@H](CNCCCCCN1CCCC1)c1cccc(C(F)(F)F)c1	ZINC000819333832	EH	On-Demand	Anodyne	DRD3	19	43
O[C@H](CNCCCCCN1CCCC1)c1cccc(C(F)(F)F)c1	ZINC000819333832	EH	On-Demand	Anodyne	ADRB3	48	39
O[C@H](CNCCCCCN1CCCC1)c1cccc(C(F)(F)F)c1	ZINC000819333832	EH	On-Demand	Anodyne	CCR2	19	42
O[C@@H](CNCCc1cc(C(F)(F)F)ccn1)c1ccc(F)cc1	ZINC000819333833	EG	On-Demand	Anodyne	ADRB2	18	41
O[C@H](CNCCc1cc(C(F)(F)F)ccn1)c1ccc(F)cc1	ZINC000819333834	EG	On-Demand	Anodyne	ADRB2	18	41
Cc1cc(F)ccc1[C@@H](O)CNCCCCCN1CCCC1	ZINC000819333836	DG	On-Demand	Anodyne	ADRB2	19	40
Cc1cc(F)ccc1[C@@H](O)CNCCCCCN1CCCC1	ZINC000819333836	DG	On-Demand	Anodyne	HNMT	40	37
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCCN2CCCC2)c1	ZINC000819333846	DE	On-Demand	Bother	ADRB2	36	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCCN2CCCC2)c1	ZINC000819333846	DE	On-Demand	Bother	ADRB1	45	38
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCCN2CCCC2)c1	ZINC000819333846	DE	On-Demand	Bother	DRD3	15	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCCCCN2CCCC2)c1	ZINC000819333846	DE	On-Demand	Bother	ADRB3	60	39
O=[N+]([O-])c1cccc([C@H](O)CNCCCCCN2CCCC2)c1	ZINC000819333847	DE	On-Demand	Bother	ADRB2	36	40
O=[N+]([O-])c1cccc([C@H](O)CNCCCCCN2CCCC2)c1	ZINC000819333847	DE	On-Demand	Bother	ADRB1	45	38
O=[N+]([O-])c1cccc([C@H](O)CNCCCCCN2CCCC2)c1	ZINC000819333847	DE	On-Demand	Bother	DRD3	15	42
O=[N+]([O-])c1cccc([C@H](O)CNCCCCCN2CCCC2)c1	ZINC000819333847	DE	On-Demand	Bother	ADRB3	60	39
COc1ccc(OC)c([C@H](O)CNCCc2cc(C(F)(F)F)ccn2)c1	ZINC000819333866	FF	On-Demand	Anodyne	ADRB2	15	45
O[C@H](CNCc1c(F)cc(F)cc1F)COc1ccccc1Cl	ZINC000819333867	EG	On-Demand	Anodyne	ADRB2	28	50
O[C@H](CNCc1c(F)cc(F)cc1F)COc1ccccc1Cl	ZINC000819333867	EG	On-Demand	Anodyne	ADRB1	58	38
O[C@@H](CNCc1c(F)cc(F)cc1F)COc1ccccc1Cl	ZINC000819333868	EG	On-Demand	Anodyne	ADRB2	28	50
O[C@@H](CNCc1c(F)cc(F)cc1F)COc1ccccc1Cl	ZINC000819333868	EG	On-Demand	Anodyne	ADRB1	58	38
O[C@@H](CNCCCCCN1CCCC1)c1ccc(F)cc1Cl	ZINC000819333894	EG	On-Demand	Anodyne	ADRB2	17	44
O[C@@H](CNCCCCCN1CCCC1)c1ccc(F)cc1Cl	ZINC000819333894	EG	On-Demand	Anodyne	HNMT	42	36
O[C@H](CNCCCCCN1CCCC1)c1ccc(F)cc1Cl	ZINC000819333895	EG	On-Demand	Anodyne	ADRB2	17	44
O[C@H](CNCCCCCN1CCCC1)c1ccc(F)cc1Cl	ZINC000819333895	EG	On-Demand	Anodyne	HNMT	42	36
O=C(Nc1n[nH]cc1-c1ccc2c(c1)OCO2)C(F)=C1CCC1	ZINC000819333902	DG	On-Demand	Anodyne	CLK4	40	33
O[C@@H](CNCCc1ccc(Br)cc1Cl)c1cccnc1	ZINC000819333943	FG	On-Demand	Anodyne	ADRB2	40	49
O[C@@H](CNCCc1ccc(Br)cc1Cl)c1cccnc1	ZINC000819333943	FG	On-Demand	Anodyne	ADRB1	52	49
O[C@@H](CNCCc1ccc(Br)cc1Cl)c1cccnc1	ZINC000819333943	FG	On-Demand	Anodyne	ADRB3	136	53
O[C@H](CNCCc1ccc(Br)cc1Cl)c1cccnc1	ZINC000819333944	FG	On-Demand	Anodyne	ADRB2	40	49
O[C@H](CNCCc1ccc(Br)cc1Cl)c1cccnc1	ZINC000819333944	FG	On-Demand	Anodyne	ADRB1	52	49
O[C@H](CNCCc1ccc(Br)cc1Cl)c1cccnc1	ZINC000819333944	FG	On-Demand	Anodyne	ADRB3	136	53
CC[C@@](C)(O)CNC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819333974	GD	On-Demand	Anodyne	PREP	18	40
CC[C@@](C)(O)CNC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819333976	GD	On-Demand	Anodyne	PREP	18	40
CSc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333980	FG	On-Demand	Anodyne	ADRB2	35	42
CSc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333980	FG	On-Demand	Anodyne	ADRB1	55	42
CSc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333980	FG	On-Demand	Anodyne	ADRB3	32	42
CSc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333983	FG	On-Demand	Anodyne	ADRB2	35	42
CSc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333983	FG	On-Demand	Anodyne	ADRB1	55	42
CSc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819333983	FG	On-Demand	Anodyne	ADRB3	32	42
O[C@H](CNCc1c(F)cc(F)cc1F)COc1ccccc1F	ZINC000819333985	EF	On-Demand	Anodyne	ADRB2	33	45
O[C@H](CNCc1c(F)cc(F)cc1F)COc1ccccc1F	ZINC000819333985	EF	On-Demand	Anodyne	ADRB1	63	41
N#Cc1ccc([C@@H](O)CNCCc2cnc(SC3CCCC3)nc2)cc1	ZINC000819333987	FG	On-Demand	Mild	ADRB3	28	42
O[C@@H](CNCc1c(F)cc(F)cc1F)COc1ccccc1F	ZINC000819333988	EF	On-Demand	Anodyne	ADRB2	33	45
O[C@@H](CNCc1c(F)cc(F)cc1F)COc1ccccc1F	ZINC000819333988	EF	On-Demand	Anodyne	ADRB1	63	41
N#Cc1ccc([C@H](O)CNCCc2cnc(SC3CCCC3)nc2)cc1	ZINC000819333991	FG	On-Demand	Mild	ADRB3	28	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2c(F)cc(F)cc2F)CC1	ZINC000819334001	GG	On-Demand	Anodyne	GPR119	52	58
COC(=O)c1ccc(CCNC[C@H](O)c2cc(C)cc(C)c2)c(OC)c1	ZINC000819334003	FF	On-Demand	Anodyne	ADRB2	37	45
COC(=O)c1ccc(CCNC[C@H](O)c2cc(C)cc(C)c2)c(OC)c1	ZINC000819334003	FF	On-Demand	Anodyne	ADRB1	34	44
COC(=O)c1ccc(CCNC[C@H](O)c2cc(C)cc(C)c2)c(OC)c1	ZINC000819334003	FF	On-Demand	Anodyne	ADRB3	45	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2c(F)cc(F)cc2F)CC1	ZINC000819334004	GG	On-Demand	Anodyne	GPR119	52	58
COC(=O)c1ccc(CCNC[C@@H](O)c2cc(C)cc(C)c2)c(OC)c1	ZINC000819334005	FF	On-Demand	Anodyne	ADRB2	37	45
COC(=O)c1ccc(CCNC[C@@H](O)c2cc(C)cc(C)c2)c(OC)c1	ZINC000819334005	FF	On-Demand	Anodyne	ADRB1	34	44
COC(=O)c1ccc(CCNC[C@@H](O)c2cc(C)cc(C)c2)c(OC)c1	ZINC000819334005	FF	On-Demand	Anodyne	ADRB3	45	44
C#CCN(C)CCCNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819334044	EF	On-Demand	Mild	LCK	25	42
C#CCN(C)CCCNCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819334044	EF	On-Demand	Mild	BTK	18	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2C[C@H]2c2ccccc2)CC1	ZINC000819334051	FG	On-Demand	Anodyne	GPR119	39	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H]2C[C@H]2c2ccccc2)CC1	ZINC000819334055	FG	On-Demand	Anodyne	GPR119	39	49
COC(=O)c1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334058	FE	On-Demand	Anodyne	ADRB2	47	46
COC(=O)c1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334058	FE	On-Demand	Anodyne	ADRB1	76	46
COC(=O)c1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334058	FE	On-Demand	Anodyne	GRIN1	16	45
COC(=O)c1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334058	FE	On-Demand	Anodyne	ADRB3	46	46
COC(=O)c1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334058	FE	On-Demand	Anodyne	ABCB1	16	44
COC(=O)c1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334061	FE	On-Demand	Anodyne	ADRB2	47	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334061	FE	On-Demand	Anodyne	ADRB1	76	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334061	FE	On-Demand	Anodyne	GRIN1	16	45
COC(=O)c1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334061	FE	On-Demand	Anodyne	ADRB3	46	46
COC(=O)c1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334061	FE	On-Demand	Anodyne	ABCB1	16	44
O[C@@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccc(Br)c1	ZINC000819334062	GH	On-Demand	Anodyne	ADRB3	49	37
O[C@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccc(Br)c1	ZINC000819334065	GH	On-Demand	Anodyne	ADRB3	49	37
COc1cccc(OC)c1OC[C@H](O)CNCc1c(F)cc(F)cc1F	ZINC000819334089	FF	On-Demand	Anodyne	ADRB2	29	43
COc1cccc(OC)c1OC[C@H](O)CNCc1c(F)cc(F)cc1F	ZINC000819334089	FF	On-Demand	Anodyne	ADRB1	42	35
C=CCC1(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CCOCC1	ZINC000819334092	GF	On-Demand	Mild	HTR4	53	37
C=CCC1(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CCOCC1	ZINC000819334092	GF	On-Demand	Mild	PGA5	41	31
COc1cccc(OC)c1OC[C@@H](O)CNCc1c(F)cc(F)cc1F	ZINC000819334094	FF	On-Demand	Anodyne	ADRB2	29	43
COc1cccc(OC)c1OC[C@@H](O)CNCc1c(F)cc(F)cc1F	ZINC000819334094	FF	On-Demand	Anodyne	ADRB1	42	35
C=CCC1(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CCOCC1	ZINC000819334096	GF	On-Demand	Mild	HTR4	53	37
C=CCC1(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CCOCC1	ZINC000819334096	GF	On-Demand	Mild	PGA5	41	31
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccc(Cl)c1	ZINC000819334104	GI	On-Demand	Anodyne	ADRB2	53	39
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccc(Cl)c1	ZINC000819334104	GI	On-Demand	Anodyne	ADRB1	68	51
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccc(Cl)c1	ZINC000819334104	GI	On-Demand	Anodyne	ADRB3	115	56
CCOc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334105	FG	On-Demand	Anodyne	ADRB2	43	45
CCOc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334105	FG	On-Demand	Anodyne	ADRB1	63	45
CCOc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334105	FG	On-Demand	Anodyne	GRIN1	16	44
CCOc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334105	FG	On-Demand	Anodyne	ADRB3	36	44
CCOc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334107	FG	On-Demand	Anodyne	ADRB2	43	45
CCOc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334107	FG	On-Demand	Anodyne	ADRB1	63	45
CCOc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334107	FG	On-Demand	Anodyne	GRIN1	16	44
CCOc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334107	FG	On-Demand	Anodyne	ADRB3	36	44
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccc(Cl)c1	ZINC000819334108	GI	On-Demand	Anodyne	ADRB2	53	39
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccc(Cl)c1	ZINC000819334108	GI	On-Demand	Anodyne	ADRB1	68	51
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccc(Cl)c1	ZINC000819334108	GI	On-Demand	Anodyne	ADRB3	115	56
O[C@@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccc(C(F)(F)F)c1	ZINC000819334114	GH	On-Demand	Anodyne	ADRB2	27	40
O[C@@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccc(C(F)(F)F)c1	ZINC000819334114	GH	On-Demand	Anodyne	ADRB3	74	40
O[C@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccc(C(F)(F)F)c1	ZINC000819334116	GH	On-Demand	Anodyne	ADRB2	27	40
O[C@H](CNCCc1cc(C(F)(F)F)ccn1)c1cccc(C(F)(F)F)c1	ZINC000819334116	GH	On-Demand	Anodyne	ADRB3	74	40
O[C@@H](CNCCCCCN1CCCC1)c1cccc(F)c1	ZINC000819334118	CF	On-Demand	Anodyne	ADRB2	41	42
O[C@@H](CNCCCCCN1CCCC1)c1cccc(F)c1	ZINC000819334118	CF	On-Demand	Anodyne	ADRB1	43	45
O[C@@H](CNCCCCCN1CCCC1)c1cccc(F)c1	ZINC000819334118	CF	On-Demand	Anodyne	SLC6A1	20	40
O[C@@H](CNCCCCCN1CCCC1)c1cccc(F)c1	ZINC000819334118	CF	On-Demand	Anodyne	ADRB3	56	45
O[C@@H](CNCCCCCN1CCCC1)c1cccc(F)c1	ZINC000819334118	CF	On-Demand	Anodyne	CHRNA7	15	41
O[C@@H](CNCCCCCN1CCCC1)c1cccc(F)c1	ZINC000819334118	CF	On-Demand	Anodyne	HNMT	41	34
O[C@H](CNCCCCCN1CCCC1)c1cccc(F)c1	ZINC000819334119	CF	On-Demand	Anodyne	ADRB2	41	42
O[C@H](CNCCCCCN1CCCC1)c1cccc(F)c1	ZINC000819334119	CF	On-Demand	Anodyne	ADRB1	43	45
O[C@H](CNCCCCCN1CCCC1)c1cccc(F)c1	ZINC000819334119	CF	On-Demand	Anodyne	SLC6A1	20	40
O[C@H](CNCCCCCN1CCCC1)c1cccc(F)c1	ZINC000819334119	CF	On-Demand	Anodyne	ADRB3	56	45
O[C@H](CNCCCCCN1CCCC1)c1cccc(F)c1	ZINC000819334119	CF	On-Demand	Anodyne	CHRNA7	15	41
O[C@H](CNCCCCCN1CCCC1)c1cccc(F)c1	ZINC000819334119	CF	On-Demand	Anodyne	HNMT	41	34
COC(=O)c1ccc(CCNC[C@H](O)c2ccccc2)c(OC)c1	ZINC000819334122	EE	On-Demand	Anodyne	ADRB2	75	46
COC(=O)c1ccc(CCNC[C@H](O)c2ccccc2)c(OC)c1	ZINC000819334122	EE	On-Demand	Anodyne	ADRB1	88	52
COC(=O)c1ccc(CCNC[C@H](O)c2ccccc2)c(OC)c1	ZINC000819334122	EE	On-Demand	Anodyne	ADRB3	123	52
COC(=O)c1ccc(CCNC[C@@H](O)c2ccccc2)c(OC)c1	ZINC000819334124	EE	On-Demand	Anodyne	ADRB2	75	46
COC(=O)c1ccc(CCNC[C@@H](O)c2ccccc2)c(OC)c1	ZINC000819334124	EE	On-Demand	Anodyne	ADRB1	88	52
COC(=O)c1ccc(CCNC[C@@H](O)c2ccccc2)c(OC)c1	ZINC000819334124	EE	On-Demand	Anodyne	ADRB3	123	52
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccc(Cl)cc1	ZINC000819334138	GI	On-Demand	Anodyne	ADRB2	24	43
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccc(Cl)cc1	ZINC000819334138	GI	On-Demand	Anodyne	ADRB1	27	43
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccc(Cl)cc1	ZINC000819334138	GI	On-Demand	Anodyne	ADRB3	52	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819334140	FG	On-Demand	Anodyne	TSHR	43	31
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819334140	FG	On-Demand	Anodyne	OPRK1	28	41
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819334140	FG	On-Demand	Anodyne	SLC18A2	19	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819334140	FG	On-Demand	Anodyne	PREP	44	34
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819334140	FG	On-Demand	Anodyne	BRCA1	52	33
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819334140	FG	On-Demand	Anodyne	Q8WSF8_APLCA	21	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819334142	FG	On-Demand	Anodyne	TSHR	43	31
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819334142	FG	On-Demand	Anodyne	OPRK1	28	41
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819334142	FG	On-Demand	Anodyne	SLC18A2	19	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819334142	FG	On-Demand	Anodyne	PREP	44	34
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819334142	FG	On-Demand	Anodyne	BRCA1	52	33
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819334142	FG	On-Demand	Anodyne	Q8WSF8_APLCA	21	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000819334145	FG	On-Demand	Anodyne	TSHR	43	31
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000819334145	FG	On-Demand	Anodyne	OPRK1	28	41
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000819334145	FG	On-Demand	Anodyne	SLC18A2	19	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000819334145	FG	On-Demand	Anodyne	PREP	44	34
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000819334145	FG	On-Demand	Anodyne	BRCA1	52	33
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000819334145	FG	On-Demand	Anodyne	Q8WSF8_APLCA	21	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000819334147	FG	On-Demand	Anodyne	TSHR	43	31
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000819334147	FG	On-Demand	Anodyne	OPRK1	28	41
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000819334147	FG	On-Demand	Anodyne	SLC18A2	19	43
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000819334147	FG	On-Demand	Anodyne	PREP	44	34
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000819334147	FG	On-Demand	Anodyne	BRCA1	52	33
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000819334147	FG	On-Demand	Anodyne	Q8WSF8_APLCA	21	43
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819334153	DF	On-Demand	Anodyne	Q8WSF8_APLCA	23	47
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819334155	DF	On-Demand	Anodyne	Q8WSF8_APLCA	23	47
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819334157	DF	On-Demand	Anodyne	Q8WSF8_APLCA	23	47
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819334159	DF	On-Demand	Anodyne	Q8WSF8_APLCA	23	47
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819334165	GF	On-Demand	Anodyne	HTR1D	47	40
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819334165	GF	On-Demand	Anodyne	HTR1B	37	40
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819334165	GF	On-Demand	Anodyne	OPRK1	17	40
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819334165	GF	On-Demand	Anodyne	SLC18A2	15	42
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819334165	GF	On-Demand	Anodyne	PREP	47	33
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819334165	GF	On-Demand	Anodyne	Q8WSF8_APLCA	17	42
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819334168	GF	On-Demand	Anodyne	HTR1D	47	40
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819334168	GF	On-Demand	Anodyne	HTR1B	37	40
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819334168	GF	On-Demand	Anodyne	OPRK1	17	40
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819334168	GF	On-Demand	Anodyne	SLC18A2	15	42
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819334168	GF	On-Demand	Anodyne	PREP	47	33
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819334168	GF	On-Demand	Anodyne	Q8WSF8_APLCA	17	42
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819334170	GF	On-Demand	Anodyne	HTR1D	47	40
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819334170	GF	On-Demand	Anodyne	HTR1B	37	40
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819334170	GF	On-Demand	Anodyne	OPRK1	17	40
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819334170	GF	On-Demand	Anodyne	SLC18A2	15	42
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819334170	GF	On-Demand	Anodyne	PREP	47	33
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819334170	GF	On-Demand	Anodyne	Q8WSF8_APLCA	17	42
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819334172	GF	On-Demand	Anodyne	HTR1D	47	40
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819334172	GF	On-Demand	Anodyne	HTR1B	37	40
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819334172	GF	On-Demand	Anodyne	OPRK1	17	40
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819334172	GF	On-Demand	Anodyne	SLC18A2	15	42
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819334172	GF	On-Demand	Anodyne	PREP	47	33
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819334172	GF	On-Demand	Anodyne	Q8WSF8_APLCA	17	42
COC(=O)c1ccc(CCNC[C@@H](O)c2cc3ccccc3o2)c(OC)c1	ZINC000819334182	FG	On-Demand	Anodyne	ADRB2	22	43
O[C@@H](CNCCCCCN1CCCC1)c1ccc(Br)cc1	ZINC000819334195	FG	On-Demand	Anodyne	HNMT	41	34
O[C@H](CNCCCCCN1CCCC1)c1ccc(Br)cc1	ZINC000819334196	FG	On-Demand	Anodyne	HNMT	41	34
COC(=O)c1ccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c(OC)c1	ZINC000819334212	GG	On-Demand	Anodyne	ADRB1	36	44
COC(=O)c1ccc(CCNC[C@H](O)c2ccccc2C(F)(F)F)c(OC)c1	ZINC000819334212	GG	On-Demand	Anodyne	ADRB3	39	44
COC(=O)c1ccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c(OC)c1	ZINC000819334213	GG	On-Demand	Anodyne	ADRB1	36	44
COC(=O)c1ccc(CCNC[C@@H](O)c2ccccc2C(F)(F)F)c(OC)c1	ZINC000819334213	GG	On-Demand	Anodyne	ADRB3	39	44
C#CCN(C)CCCNC[C@H](O)c1cccnc1	ZINC000819334222	BC	On-Demand	Mild	ADRB2	25	44
C#CCN(C)CCCNC[C@H](O)c1cccnc1	ZINC000819334222	BC	On-Demand	Mild	ADRB1	26	44
C#CCN(C)CCCNC[C@H](O)c1cccnc1	ZINC000819334222	BC	On-Demand	Mild	ADRB3	95	49
C#CCN(C)CCCNC[C@@H](O)c1cccnc1	ZINC000819334224	BC	On-Demand	Mild	ADRB2	25	44
C#CCN(C)CCCNC[C@@H](O)c1cccnc1	ZINC000819334224	BC	On-Demand	Mild	ADRB1	26	44
C#CCN(C)CCCNC[C@@H](O)c1cccnc1	ZINC000819334224	BC	On-Demand	Mild	ADRB3	95	49
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)C[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819334231	GF	On-Demand	Anodyne	DRD4	24	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)C[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819334231	GF	On-Demand	Anodyne	ACHE	44	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)C[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819334231	GF	On-Demand	Anodyne	SIGMAR1	36	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)C[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819334231	GF	On-Demand	Anodyne	SLC18A3	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)C[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819334233	GF	On-Demand	Anodyne	DRD4	24	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)C[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819334233	GF	On-Demand	Anodyne	ACHE	44	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)C[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819334233	GF	On-Demand	Anodyne	SIGMAR1	36	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)C[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819334233	GF	On-Demand	Anodyne	SLC18A3	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)C[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819334236	GF	On-Demand	Anodyne	DRD4	24	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)C[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819334236	GF	On-Demand	Anodyne	ACHE	44	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)C[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819334236	GF	On-Demand	Anodyne	SIGMAR1	36	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)C[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819334236	GF	On-Demand	Anodyne	SLC18A3	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)C[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819334238	GF	On-Demand	Anodyne	DRD4	24	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)C[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819334238	GF	On-Demand	Anodyne	ACHE	44	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)C[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819334238	GF	On-Demand	Anodyne	SIGMAR1	36	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)C[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819334238	GF	On-Demand	Anodyne	SLC18A3	15	40
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(F)cc2Cl)c(OC)c1	ZINC000819334254	GG	On-Demand	Anodyne	ADRB1	33	42
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(F)cc2Cl)c(OC)c1	ZINC000819334254	GG	On-Demand	Anodyne	ADRB3	27	42
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)c(OC)c1	ZINC000819334256	GG	On-Demand	Anodyne	ADRB1	33	42
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(F)cc2Cl)c(OC)c1	ZINC000819334256	GG	On-Demand	Anodyne	ADRB3	27	42
COC(=O)c1ccc(CCNC[C@H](O)c2cccnc2)c(OC)c1	ZINC000819334271	ED	On-Demand	Anodyne	ADRB2	55	51
COC(=O)c1ccc(CCNC[C@H](O)c2cccnc2)c(OC)c1	ZINC000819334271	ED	On-Demand	Anodyne	ADRB1	70	56
COC(=O)c1ccc(CCNC[C@H](O)c2cccnc2)c(OC)c1	ZINC000819334271	ED	On-Demand	Anodyne	ADRB3	154	56
COC(=O)c1ccc(CCNC[C@@H](O)c2cccnc2)c(OC)c1	ZINC000819334273	ED	On-Demand	Anodyne	ADRB2	55	51
COC(=O)c1ccc(CCNC[C@@H](O)c2cccnc2)c(OC)c1	ZINC000819334273	ED	On-Demand	Anodyne	ADRB1	70	56
COC(=O)c1ccc(CCNC[C@@H](O)c2cccnc2)c(OC)c1	ZINC000819334273	ED	On-Demand	Anodyne	ADRB3	154	56
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819334305	FG	On-Demand	Anodyne	PLG	19	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819334305	FG	On-Demand	Anodyne	TRY1_BOVIN	21	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819334305	FG	On-Demand	Anodyne	REN	46	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819334305	FG	On-Demand	Anodyne	WNT3	40	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819334305	FG	On-Demand	Anodyne	Q8WSF8_APLCA	18	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819334307	FG	On-Demand	Anodyne	PLG	19	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819334307	FG	On-Demand	Anodyne	TRY1_BOVIN	21	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819334307	FG	On-Demand	Anodyne	REN	46	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819334307	FG	On-Demand	Anodyne	WNT3	40	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819334307	FG	On-Demand	Anodyne	Q8WSF8_APLCA	18	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819334309	FG	On-Demand	Anodyne	PLG	19	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819334309	FG	On-Demand	Anodyne	TRY1_BOVIN	21	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819334309	FG	On-Demand	Anodyne	REN	46	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819334309	FG	On-Demand	Anodyne	WNT3	40	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819334309	FG	On-Demand	Anodyne	Q8WSF8_APLCA	18	42
O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)c1cc2c(cn1)OCCO2	ZINC000819334310	GD	On-Demand	Clean	NOS2	62	31
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819334311	FG	On-Demand	Anodyne	PLG	19	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819334311	FG	On-Demand	Anodyne	TRY1_BOVIN	21	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819334311	FG	On-Demand	Anodyne	REN	46	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819334311	FG	On-Demand	Anodyne	WNT3	40	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819334311	FG	On-Demand	Anodyne	Q8WSF8_APLCA	18	42
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cnc(SC3CCCC3)nc2)c1	ZINC000819334312	GG	On-Demand	Bother	ADRB1	38	46
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cnc(SC3CCCC3)nc2)c1	ZINC000819334312	GG	On-Demand	Bother	ADRB3	102	46
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cnc(SC3CCCC3)nc2)c1	ZINC000819334315	GG	On-Demand	Bother	ADRB1	38	46
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cnc(SC3CCCC3)nc2)c1	ZINC000819334315	GG	On-Demand	Bother	ADRB3	102	46
O=C(Nc1cnn(CC2CC2)c1)C(F)=C1CCC1	ZINC000819334327	BF	On-Demand	Anodyne	PANC	41	32
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccc(F)cc1	ZINC000819334343	FH	On-Demand	Anodyne	ADRB2	24	43
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccc(F)cc1	ZINC000819334343	FH	On-Demand	Anodyne	ADRB1	19	43
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccc(F)cc1	ZINC000819334343	FH	On-Demand	Anodyne	ADRB3	52	43
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccc(F)cc1	ZINC000819334346	FH	On-Demand	Anodyne	ADRB2	24	43
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccc(F)cc1	ZINC000819334346	FH	On-Demand	Anodyne	ADRB1	19	43
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccc(F)cc1	ZINC000819334346	FH	On-Demand	Anodyne	ADRB3	52	43
COC(=O)c1ccc(CCNC[C@H](O)c2ccccc2Cl)c(OC)c1	ZINC000819334369	FG	On-Demand	Anodyne	ADRB2	45	41
COC(=O)c1ccc(CCNC[C@H](O)c2ccccc2Cl)c(OC)c1	ZINC000819334369	FG	On-Demand	Anodyne	ADRB1	51	46
COC(=O)c1ccc(CCNC[C@H](O)c2ccccc2Cl)c(OC)c1	ZINC000819334369	FG	On-Demand	Anodyne	ADRB3	44	46
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(F)cc2C)c(OC)c1	ZINC000819334375	FF	On-Demand	Anodyne	ADRB2	26	40
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(F)cc2C)c(OC)c1	ZINC000819334382	FF	On-Demand	Anodyne	ADRB2	26	40
O=C(C(F)=C1CCC1)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819334389	DH	On-Demand	Anodyne	Q8WSF8_APLCA	23	46
O=C(C(F)=C1CCC1)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819334393	DH	On-Demand	Anodyne	Q8WSF8_APLCA	23	46
O=C(C(F)=C1CCC1)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819334395	DH	On-Demand	Anodyne	Q8WSF8_APLCA	23	46
O=C(C(F)=C1CCC1)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819334398	DH	On-Demand	Anodyne	Q8WSF8_APLCA	23	46
COc1ccc(OC)c([C@H](O)CNCCc2ccc(Cl)c(OC)c2)c1	ZINC000819334406	FG	On-Demand	Anodyne	ADRB2	57	55
COc1ccc(OC)c([C@H](O)CNCCc2ccc(Cl)c(OC)c2)c1	ZINC000819334406	FG	On-Demand	Anodyne	ADRB1	63	47
COc1ccc(OC)c([C@H](O)CNCCc2ccc(Cl)c(OC)c2)c1	ZINC000819334406	FG	On-Demand	Anodyne	ADRB3	57	47
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cnc(SC3CCCC3)nc2)cc1	ZINC000819334409	GG	On-Demand	Bother	ADRB1	20	45
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cnc(SC3CCCC3)nc2)cc1	ZINC000819334409	GG	On-Demand	Bother	ADRB3	56	45
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cnc(SC3CCCC3)nc2)cc1	ZINC000819334411	GG	On-Demand	Bother	ADRB1	20	45
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cnc(SC3CCCC3)nc2)cc1	ZINC000819334411	GG	On-Demand	Bother	ADRB3	56	45
CS(=O)(=O)c1ccc([C@H](O)CNCCCCCN2CCCC2)cc1	ZINC000819334413	FD	On-Demand	Anodyne	ADRB2	45	46
CS(=O)(=O)c1ccc([C@H](O)CNCCCCCN2CCCC2)cc1	ZINC000819334413	FD	On-Demand	Anodyne	ADRB3	74	39
CS(=O)(=O)c1ccc([C@H](O)CNCCCCCN2CCCC2)cc1	ZINC000819334413	FD	On-Demand	Anodyne	HNMT	41	32
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(Cl)cc2)c(OC)c1	ZINC000819334414	FG	On-Demand	Anodyne	ADRB2	50	47
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(Cl)cc2)c(OC)c1	ZINC000819334414	FG	On-Demand	Anodyne	ADRB1	54	50
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(Cl)cc2)c(OC)c1	ZINC000819334414	FG	On-Demand	Anodyne	ADRB3	68	50
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCCN2CCCC2)cc1	ZINC000819334417	FD	On-Demand	Anodyne	ADRB2	45	46
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCCN2CCCC2)cc1	ZINC000819334417	FD	On-Demand	Anodyne	ADRB3	74	39
CS(=O)(=O)c1ccc([C@@H](O)CNCCCCCN2CCCC2)cc1	ZINC000819334417	FD	On-Demand	Anodyne	HNMT	41	32
O[C@@H](CNC[C@@H]1C[C@H]1c1ccccc1)c1ccccc1Cl	ZINC000819334462	DH	On-Demand	Anodyne	OPRL1	19	40
O[C@H](CNCCc1cc(C(F)(F)F)ccn1)c1ccccc1	ZINC000819334469	DF	On-Demand	Anodyne	ADRB2	30	45
O[C@H](CNCCc1cc(C(F)(F)F)ccn1)c1ccccc1	ZINC000819334469	DF	On-Demand	Anodyne	ADRB1	43	39
O[C@H](CNCCc1cc(C(F)(F)F)ccn1)c1ccccc1	ZINC000819334469	DF	On-Demand	Anodyne	ADRB3	89	43
COc1cccc([C@H](O)C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)c1	ZINC000819334480	FF	On-Demand	Anodyne	MTNR1A	27	40
COc1cccc([C@H](O)C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)c1	ZINC000819334480	FF	On-Demand	Anodyne	MTNR1B	27	40
COc1cccc([C@H](O)C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)c1	ZINC000819334483	FF	On-Demand	Anodyne	MTNR1A	27	40
COc1cccc([C@H](O)C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)c1	ZINC000819334483	FF	On-Demand	Anodyne	MTNR1B	27	40
CSc1ccc([C@@H](CNC(=O)[C@H]2C[C@@H](O)CN2C(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819334492	HE	On-Demand	Anodyne	VHL	49	34
CSc1ccc([C@H](CNC(=O)[C@H]2C[C@@H](O)CN2C(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819334493	HE	On-Demand	Anodyne	VHL	49	34
CSc1ccc([C@@H](CNC(=O)[C@@H]2C[C@H](O)CN2C(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819334495	HE	On-Demand	Anodyne	VHL	49	34
CSc1ccc([C@H](CNC(=O)[C@@H]2C[C@H](O)CN2C(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819334496	HE	On-Demand	Anodyne	VHL	49	34
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334498	GG	On-Demand	Anodyne	ADRB2	48	50
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334498	GG	On-Demand	Anodyne	ADRB1	83	50
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334498	GG	On-Demand	Anodyne	GRIN1	25	48
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334498	GG	On-Demand	Anodyne	ADRB3	55	50
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334498	GG	On-Demand	Anodyne	ABCB1	34	42
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cccnc1Cl	ZINC000819334501	FF	On-Demand	Anodyne	SLC6A5	15	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cccnc1Cl	ZINC000819334501	FF	On-Demand	Anodyne	G2YM83_BOTF4	72	36
CC(=O)CCc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334502	GG	On-Demand	Anodyne	ADRB2	48	50
CC(=O)CCc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334502	GG	On-Demand	Anodyne	ADRB1	83	50
CC(=O)CCc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334502	GG	On-Demand	Anodyne	GRIN1	25	48
CC(=O)CCc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334502	GG	On-Demand	Anodyne	ADRB3	55	50
CC(=O)CCc1ccc(OC[C@H](O)CNCc2c(F)cc(F)cc2F)cc1	ZINC000819334502	GG	On-Demand	Anodyne	ABCB1	34	42
O[C@@H](CNCCCCCN1CCCC1)c1cc(F)ccc1F	ZINC000819334580	DF	On-Demand	Anodyne	HNMT	44	37
O[C@H](CNCCCCCN1CCCC1)c1cc(F)ccc1F	ZINC000819334583	DF	On-Demand	Anodyne	HNMT	44	37
O[C@@H](CNCCCCCN1CCCC1)c1ccc(F)cc1	ZINC000819334587	CF	On-Demand	Anodyne	ADRB2	34	41
O[C@@H](CNCCCCCN1CCCC1)c1ccc(F)cc1	ZINC000819334587	CF	On-Demand	Anodyne	DRD2	17	43
O[C@@H](CNCCCCCN1CCCC1)c1ccc(F)cc1	ZINC000819334587	CF	On-Demand	Anodyne	HTR2A	15	45
O[C@@H](CNCCCCCN1CCCC1)c1ccc(F)cc1	ZINC000819334587	CF	On-Demand	Anodyne	DRD3	17	43
O[C@@H](CNCCCCCN1CCCC1)c1ccc(F)cc1	ZINC000819334587	CF	On-Demand	Anodyne	SLC6A3	32	41
O[C@@H](CNCCCCCN1CCCC1)c1ccc(F)cc1	ZINC000819334587	CF	On-Demand	Anodyne	SIGMAR1	17	45
O[C@@H](CNCCCCCN1CCCC1)c1ccc(F)cc1	ZINC000819334587	CF	On-Demand	Anodyne	HNMT	41	34
O[C@@H](CNCCCCCN1CCCC1)c1ccc(F)cc1	ZINC000819334587	CF	On-Demand	Anodyne	LEF	26	46
O[C@H](CNCCCCCN1CCCC1)c1ccc(F)cc1	ZINC000819334589	CF	On-Demand	Anodyne	ADRB2	34	41
O[C@H](CNCCCCCN1CCCC1)c1ccc(F)cc1	ZINC000819334589	CF	On-Demand	Anodyne	DRD2	17	43
O[C@H](CNCCCCCN1CCCC1)c1ccc(F)cc1	ZINC000819334589	CF	On-Demand	Anodyne	HTR2A	15	45
O[C@H](CNCCCCCN1CCCC1)c1ccc(F)cc1	ZINC000819334589	CF	On-Demand	Anodyne	DRD3	17	43
O[C@H](CNCCCCCN1CCCC1)c1ccc(F)cc1	ZINC000819334589	CF	On-Demand	Anodyne	SLC6A3	32	41
O[C@H](CNCCCCCN1CCCC1)c1ccc(F)cc1	ZINC000819334589	CF	On-Demand	Anodyne	SIGMAR1	17	45
O[C@H](CNCCCCCN1CCCC1)c1ccc(F)cc1	ZINC000819334589	CF	On-Demand	Anodyne	HNMT	41	34
O[C@H](CNCCCCCN1CCCC1)c1ccc(F)cc1	ZINC000819334589	CF	On-Demand	Anodyne	LEF	26	46
C[C@@H](F)CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819334592	CD	On-Demand	Bother	ADRB3	46	36
C[C@@H](F)CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819334600	CD	On-Demand	Bother	ADRB3	46	36
CSc1ccc([C@H](CNC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)N(C)C)cc1	ZINC000819334633	IF	On-Demand	Anodyne	CA2	19	42
CSc1ccc([C@@H](CNC(=O)c2cc(S(N)(=O)=O)cc(Cl)c2F)N(C)C)cc1	ZINC000819334637	IF	On-Demand	Anodyne	CA2	19	42
CSc1ccc([C@@H](CNC[C@H](O)c2cccnc2)N(C)C)cc1	ZINC000819334644	EF	On-Demand	Anodyne	ADRB2	18	40
CSc1ccc([C@@H](CNC[C@H](O)c2cccnc2)N(C)C)cc1	ZINC000819334644	EF	On-Demand	Anodyne	ADRB1	20	40
CSc1ccc([C@@H](CNC[C@H](O)c2cccnc2)N(C)C)cc1	ZINC000819334644	EF	On-Demand	Anodyne	ADRB3	81	45
CSc1ccc([C@@H](CNC[C@@H](O)c2cccnc2)N(C)C)cc1	ZINC000819334652	EF	On-Demand	Anodyne	ADRB2	18	40
CSc1ccc([C@@H](CNC[C@@H](O)c2cccnc2)N(C)C)cc1	ZINC000819334652	EF	On-Demand	Anodyne	ADRB1	20	40
CSc1ccc([C@@H](CNC[C@@H](O)c2cccnc2)N(C)C)cc1	ZINC000819334652	EF	On-Demand	Anodyne	ADRB3	81	45
CSc1ccc([C@H](CNC[C@H](O)c2cccnc2)N(C)C)cc1	ZINC000819334656	EF	On-Demand	Anodyne	ADRB2	18	40
CSc1ccc([C@H](CNC[C@H](O)c2cccnc2)N(C)C)cc1	ZINC000819334656	EF	On-Demand	Anodyne	ADRB1	20	40
CSc1ccc([C@H](CNC[C@H](O)c2cccnc2)N(C)C)cc1	ZINC000819334656	EF	On-Demand	Anodyne	ADRB3	81	45
CSc1ccc([C@H](CNC[C@@H](O)c2cccnc2)N(C)C)cc1	ZINC000819334658	EF	On-Demand	Anodyne	ADRB2	18	40
CSc1ccc([C@H](CNC[C@@H](O)c2cccnc2)N(C)C)cc1	ZINC000819334658	EF	On-Demand	Anodyne	ADRB1	20	40
CSc1ccc([C@H](CNC[C@@H](O)c2cccnc2)N(C)C)cc1	ZINC000819334658	EF	On-Demand	Anodyne	ADRB3	81	45
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)C(F)=C1CCC1	ZINC000819334673	DG	On-Demand	Anodyne	ACHE	46	49
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)C(F)=C1CCC1	ZINC000819334673	DG	On-Demand	Anodyne	SIGMAR1	55	45
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)C(F)=C1CCC1	ZINC000819334673	DG	On-Demand	Anodyne	SLC18A3	25	41
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)C(F)=C1CCC1	ZINC000819334673	DG	On-Demand	Anodyne	CACNA1G	29	42
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccccc1F	ZINC000819334684	FH	On-Demand	Anodyne	ADRB3	24	40
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccccc1F	ZINC000819334686	FH	On-Demand	Anodyne	ADRB3	24	40
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(C)cc2)c(OC)c1	ZINC000819334706	EF	On-Demand	Anodyne	ADRB2	55	48
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(C)cc2)c(OC)c1	ZINC000819334706	EF	On-Demand	Anodyne	ADRB1	52	46
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(C)cc2)c(OC)c1	ZINC000819334706	EF	On-Demand	Anodyne	ADRB3	65	46
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(C)cc2)c(OC)c1	ZINC000819334708	EF	On-Demand	Anodyne	ADRB2	55	48
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(C)cc2)c(OC)c1	ZINC000819334708	EF	On-Demand	Anodyne	ADRB1	52	46
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(C)cc2)c(OC)c1	ZINC000819334708	EF	On-Demand	Anodyne	ADRB3	65	46
O=C(/C=C\[C@H]1CCCO1)Nc1cnn(CC2CC2)c1	ZINC000819334709	CD	On-Demand	Anodyne	PANC	40	30
O=C(/C=C/[C@@H]1CCCO1)Nc1cnn(CC2CC2)c1	ZINC000819334710	CD	On-Demand	Anodyne	PANC	40	30
O=C(/C=C\[C@@H]1CCCO1)Nc1cnn(CC2CC2)c1	ZINC000819334712	CD	On-Demand	Anodyne	PANC	40	30
O=C(/C=C/[C@H]1CCCO1)Nc1cnn(CC2CC2)c1	ZINC000819334714	CD	On-Demand	Anodyne	PANC	40	30
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccc(F)c1	ZINC000819334719	FH	On-Demand	Anodyne	ADRB2	32	42
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccc(F)c1	ZINC000819334719	FH	On-Demand	Anodyne	ADRB1	35	45
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccc(F)c1	ZINC000819334719	FH	On-Demand	Anodyne	ADRB3	91	45
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccc(F)c1	ZINC000819334721	FH	On-Demand	Anodyne	ADRB2	32	42
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccc(F)c1	ZINC000819334721	FH	On-Demand	Anodyne	ADRB1	35	45
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccc(F)c1	ZINC000819334721	FH	On-Demand	Anodyne	ADRB3	91	45
O=[N+]([O-])c1cccc([C@@H](O)CNCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819334724	GF	On-Demand	Bother	ADRB3	48	39
O=[N+]([O-])c1cccc([C@H](O)CNCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819334725	GF	On-Demand	Bother	ADRB3	48	39
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccnc1	ZINC000819334726	EF	On-Demand	Anodyne	ADRB2	40	47
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccnc1	ZINC000819334726	EF	On-Demand	Anodyne	ADRB1	48	49
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccnc1	ZINC000819334726	EF	On-Demand	Anodyne	ADRB3	138	51
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccnc1	ZINC000819334726	EF	On-Demand	Anodyne	VCP	43	32
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccnc1	ZINC000819334728	EF	On-Demand	Anodyne	ADRB2	40	47
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccnc1	ZINC000819334728	EF	On-Demand	Anodyne	ADRB1	48	49
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccnc1	ZINC000819334728	EF	On-Demand	Anodyne	ADRB3	138	51
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1cccnc1	ZINC000819334728	EF	On-Demand	Anodyne	VCP	43	32
COC(=O)c1ccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c(OC)c1	ZINC000819334730	FE	On-Demand	Bother	ADRB2	31	44
COC(=O)c1ccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c(OC)c1	ZINC000819334730	FE	On-Demand	Bother	ADRB1	32	41
COC(=O)c1ccc(CCNC[C@H](O)c2ccc([N+](=O)[O-])cc2)c(OC)c1	ZINC000819334730	FE	On-Demand	Bother	ADRB3	48	41
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c(OC)c1	ZINC000819334732	FE	On-Demand	Bother	ADRB2	31	44
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c(OC)c1	ZINC000819334732	FE	On-Demand	Bother	ADRB1	32	41
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c(OC)c1	ZINC000819334732	FE	On-Demand	Bother	ADRB3	48	41
C=C(C)C(C)(C)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819334735	EG	On-Demand	Mild	ACHE	17	40
C=C(C)C(C)(C)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819334735	EG	On-Demand	Mild	OPRK1	25	46
C=C(C)C(C)(C)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819334735	EG	On-Demand	Mild	SLC6A3	21	41
C=C(C)C(C)(C)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819334735	EG	On-Demand	Mild	HTR4	60	37
C=C(C)C(C)(C)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819334735	EG	On-Demand	Mild	GRIN2B	28	46
C=C(C)C(C)(C)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819334735	EG	On-Demand	Mild	CACNA1I	69	43
C=C(C)C(C)(C)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819334736	EG	On-Demand	Mild	ACHE	17	40
C=C(C)C(C)(C)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819334736	EG	On-Demand	Mild	OPRK1	25	46
C=C(C)C(C)(C)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819334736	EG	On-Demand	Mild	SLC6A3	21	41
C=C(C)C(C)(C)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819334736	EG	On-Demand	Mild	HTR4	60	37
C=C(C)C(C)(C)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819334736	EG	On-Demand	Mild	GRIN2B	28	46
C=C(C)C(C)(C)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819334736	EG	On-Demand	Mild	CACNA1I	69	43
COc1ccc(NC(=O)c2cc(Br)oc2C)cc1N1CCOC1=O	ZINC000819334742	GH	On-Demand	Anodyne	HTR1D	15	46
COc1ccc(NC(=O)c2cc(Br)oc2C)cc1N1CCOC1=O	ZINC000819334742	GH	On-Demand	Anodyne	HTR1B	20	46
COc1ccc(NC(=O)c2cc(Br)oc2C)cc1N1CCOC1=O	ZINC000819334742	GH	On-Demand	Anodyne	CPT1A	46	40
COc1ccc(NC(=O)c2cc(Br)oc2C)cc1N1CCOC1=O	ZINC000819334742	GH	On-Demand	Anodyne	CPT2	40	37
CC1(C)CCC[C@H]1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819334759	CG	On-Demand	Bother	CACNA1C	40	34
CC1(C)CCC[C@H]1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819334759	CG	On-Demand	Bother	CACNA1D	60	33
CC1(C)CCC[C@H]1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819334763	CG	On-Demand	Bother	CACNA1C	40	34
CC1(C)CCC[C@H]1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819334763	CG	On-Demand	Bother	CACNA1D	60	33
CC(C)(O)CNC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819334770	FD	On-Demand	Anodyne	PREP	19	40
CC(C)(O)CNC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819334773	FD	On-Demand	Anodyne	PREP	19	40
COC(=O)c1ccc(CCNC[C@H](O)c2c(F)cccc2F)c(OC)c1	ZINC000819334777	FF	On-Demand	Anodyne	ADRB2	23	40
COC(=O)c1ccc(CCNC[C@H](O)c2c(F)cccc2F)c(OC)c1	ZINC000819334777	FF	On-Demand	Anodyne	ADRB1	34	43
COC(=O)c1ccc(CCNC[C@H](O)c2c(F)cccc2F)c(OC)c1	ZINC000819334777	FF	On-Demand	Anodyne	ADRB3	33	43
COC(=O)c1ccc(CCNC[C@H](O)c2c(F)cccc2F)c(OC)c1	ZINC000819334777	FF	On-Demand	Anodyne	BDKRB1	27	41
COC(=O)c1ccc(CCNC[C@@H](O)c2c(F)cccc2F)c(OC)c1	ZINC000819334778	FF	On-Demand	Anodyne	ADRB2	23	40
COC(=O)c1ccc(CCNC[C@@H](O)c2c(F)cccc2F)c(OC)c1	ZINC000819334778	FF	On-Demand	Anodyne	ADRB1	34	43
COC(=O)c1ccc(CCNC[C@@H](O)c2c(F)cccc2F)c(OC)c1	ZINC000819334778	FF	On-Demand	Anodyne	ADRB3	33	43
COC(=O)c1ccc(CCNC[C@@H](O)c2c(F)cccc2F)c(OC)c1	ZINC000819334778	FF	On-Demand	Anodyne	BDKRB1	27	41
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819334801	DH	On-Demand	Mild	AMY2	43	30
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819334801	DH	On-Demand	Mild	Q8WSF8_APLCA	23	48
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819334802	DH	On-Demand	Mild	AMY2	43	30
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819334802	DH	On-Demand	Mild	Q8WSF8_APLCA	23	48
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819334803	DH	On-Demand	Mild	AMY2	43	30
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819334803	DH	On-Demand	Mild	Q8WSF8_APLCA	23	48
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819334805	DH	On-Demand	Mild	AMY2	43	30
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819334805	DH	On-Demand	Mild	Q8WSF8_APLCA	23	48
CC1(C)CCC[C@H]1CNC[C@@H](O)C1CC1	ZINC000819334843	BE	On-Demand	Anodyne	UGT2B7	48	34
CC1(C)CCC[C@H]1CNC[C@H](O)C1CC1	ZINC000819334844	BE	On-Demand	Anodyne	UGT2B7	48	34
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(F)c(F)c2)c(OC)c1	ZINC000819334850	FF	On-Demand	Anodyne	ADRB2	52	48
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(F)c(F)c2)c(OC)c1	ZINC000819334850	FF	On-Demand	Anodyne	ADRB1	43	46
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(F)c(F)c2)c(OC)c1	ZINC000819334850	FF	On-Demand	Anodyne	ADRB3	61	46
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c(OC)c1	ZINC000819334851	FF	On-Demand	Anodyne	ADRB2	52	48
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c(OC)c1	ZINC000819334851	FF	On-Demand	Anodyne	ADRB1	43	46
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(F)c(F)c2)c(OC)c1	ZINC000819334851	FF	On-Demand	Anodyne	ADRB3	61	46
O=C(Cc1nsc2ccccc12)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819334862	FH	On-Demand	Anodyne	Q8WSF8_APLCA	18	41
O=C(Cc1nsc2ccccc12)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819334863	FH	On-Demand	Anodyne	Q8WSF8_APLCA	18	41
O=C(Cc1nsc2ccccc12)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819334864	FH	On-Demand	Anodyne	Q8WSF8_APLCA	18	41
O=C(Cc1nsc2ccccc12)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819334865	FH	On-Demand	Anodyne	Q8WSF8_APLCA	18	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1)C2	ZINC000819334872	GF	On-Demand	Anodyne	Q8WSF8_APLCA	18	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1C[C@@H](O)c1ccccc1)C2	ZINC000819334873	GF	On-Demand	Anodyne	Q8WSF8_APLCA	18	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1C[C@H](O)c1ccccc1)C2	ZINC000819334874	GF	On-Demand	Anodyne	Q8WSF8_APLCA	18	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1C[C@H](O)c1ccccc1)C2	ZINC000819334875	GF	On-Demand	Anodyne	Q8WSF8_APLCA	18	44
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccc(Cl)c(F)c1	ZINC000819334881	GI	On-Demand	Anodyne	ADRB1	23	40
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccc(Cl)c(F)c1	ZINC000819334881	GI	On-Demand	Anodyne	ADRB3	42	40
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccc(Cl)c(F)c1	ZINC000819334883	GI	On-Demand	Anodyne	ADRB1	23	40
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccc(Cl)c(F)c1	ZINC000819334883	GI	On-Demand	Anodyne	ADRB3	42	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccc(N2CCOCC2)nc1	ZINC000819334884	HE	On-Demand	Anodyne	SCN10A	18	41
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccc(N2CCOCC2)nc1	ZINC000819334884	HE	On-Demand	Anodyne	HPGDS	30	46
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccc(N2CCOCC2)nc1	ZINC000819334884	HE	On-Demand	Anodyne	NAMPT	19	47
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H]1CC(=O)N(C2CCCC2)C1	ZINC000819334886	HE	On-Demand	Anodyne	INHA	22	52
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H]1CC(=O)N(C2CCCC2)C1	ZINC000819334887	HE	On-Demand	Anodyne	INHA	22	52
COC(=O)c1ccc(CCNC[C@H](O)c2cccc3ccccc23)c(OC)c1	ZINC000819334892	GH	On-Demand	Anodyne	ADRB2	77	42
COC(=O)c1ccc(CCNC[C@H](O)c2cccc3ccccc23)c(OC)c1	ZINC000819334892	GH	On-Demand	Anodyne	ADRB1	64	44
COC(=O)c1ccc(CCNC[C@H](O)c2cccc3ccccc23)c(OC)c1	ZINC000819334892	GH	On-Demand	Anodyne	ADRB3	55	44
COC(=O)c1ccc(CCNC[C@H](O)c2cccc3ccccc23)c(OC)c1	ZINC000819334892	GH	On-Demand	Anodyne	MTNR1A	35	43
COC(=O)c1ccc(CCNC[C@H](O)c2cccc3ccccc23)c(OC)c1	ZINC000819334892	GH	On-Demand	Anodyne	MTNR1B	23	41
COC(=O)c1ccc(CCNC[C@H](O)c2cccc(Cl)c2)c(OC)c1	ZINC000819334893	FG	On-Demand	Anodyne	ADRB2	82	47
COC(=O)c1ccc(CCNC[C@H](O)c2cccc(Cl)c2)c(OC)c1	ZINC000819334893	FG	On-Demand	Anodyne	ADRB1	86	65
COC(=O)c1ccc(CCNC[C@H](O)c2cccc(Cl)c2)c(OC)c1	ZINC000819334893	FG	On-Demand	Anodyne	ADRB3	106	65
COC(=O)c1ccc(CCNC[C@@H](O)c2cccc(Cl)c2)c(OC)c1	ZINC000819334895	FG	On-Demand	Anodyne	ADRB2	82	47
COC(=O)c1ccc(CCNC[C@@H](O)c2cccc(Cl)c2)c(OC)c1	ZINC000819334895	FG	On-Demand	Anodyne	ADRB1	86	65
COC(=O)c1ccc(CCNC[C@@H](O)c2cccc(Cl)c2)c(OC)c1	ZINC000819334895	FG	On-Demand	Anodyne	ADRB3	106	65
N#CCOc1ccc(CC(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000819334896	HF	On-Demand	Mild	CA9	24	43
COc1ccc(NC(=O)c2cc(C)ccc2C2CC2)cc1N1CCOC1=O	ZINC000819334904	FI	On-Demand	Anodyne	CPT1A	46	42
COc1ccc(NC(=O)c2cc(C)ccc2C2CC2)cc1N1CCOC1=O	ZINC000819334904	FI	On-Demand	Anodyne	CPT2	41	36
COc1ccc(NC(=O)c2cc(C)ccc2C2CC2)cc1N1CCOC1=O	ZINC000819334904	FI	On-Demand	Anodyne	KCNK3	51	41
COc1ccc(NC(=O)c2cc(C)ccc2C2CC2)cc1N1CCOC1=O	ZINC000819334904	FI	On-Demand	Anodyne	KCNK9	52	40
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1cc2ccccc2o1	ZINC000819334909	GI	On-Demand	Anodyne	ADRB3	21	40
C[C@@H](c1ccc(F)cc1)N1CCC[C@H](NC[C@H](O)c2ccccc2Cl)C1=O	ZINC000819334911	GH	On-Demand	Anodyne	OPRL1	28	40
C[C@@H](c1ccc(F)cc1)N1CCC[C@@H](NC[C@H](O)c2ccccc2Cl)C1=O	ZINC000819334913	GH	On-Demand	Anodyne	OPRL1	28	40
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccccc1Cl	ZINC000819334925	GI	On-Demand	Anodyne	ADRB1	25	40
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccccc1Cl	ZINC000819334925	GI	On-Demand	Anodyne	ADRB3	28	40
O=C([C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819334931	GJ	On-Demand	Anodyne	Q8WSF8_APLCA	15	44
O=C([C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819334935	GJ	On-Demand	Anodyne	Q8WSF8_APLCA	15	44
O=C([C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819334937	GJ	On-Demand	Anodyne	Q8WSF8_APLCA	15	44
O=C([C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819334939	GJ	On-Demand	Anodyne	Q8WSF8_APLCA	15	44
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000819334950	EG	On-Demand	Anodyne	UL26	57	33
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000819334950	EG	On-Demand	Anodyne	SCAF_EBVB9	53	33
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000819334952	EG	On-Demand	Anodyne	UL26	57	33
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000819334952	EG	On-Demand	Anodyne	SCAF_EBVB9	53	33
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000819334954	EG	On-Demand	Anodyne	UL26	57	33
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000819334954	EG	On-Demand	Anodyne	SCAF_EBVB9	53	33
O=C(/C=C/c1cccnc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819334955	FF	On-Demand	Anodyne	TBXA2R	18	41
O=C(/C=C/c1cccnc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819334955	FF	On-Demand	Anodyne	TBXAS1	53	46
O=C(/C=C/c1cccnc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819334955	FF	On-Demand	Anodyne	PTAFR	15	51
O=C(/C=C/c1cccnc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819334955	FF	On-Demand	Anodyne	NAMPT	39	49
O=C(/C=C\c1cccnc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819334956	FF	On-Demand	Anodyne	TBXA2R	18	41
O=C(/C=C\c1cccnc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819334956	FF	On-Demand	Anodyne	TBXAS1	53	46
O=C(/C=C\c1cccnc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819334956	FF	On-Demand	Anodyne	PTAFR	15	51
O=C(/C=C\c1cccnc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819334956	FF	On-Demand	Anodyne	NAMPT	39	49
CCOC(=O)Nc1ccc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000819334991	HH	On-Demand	Anodyne	CA2	35	45
CCOC(=O)Nc1ccc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000819334991	HH	On-Demand	Anodyne	CA1	27	46
CCOC(=O)Nc1ccc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000819334991	HH	On-Demand	Anodyne	CA12	27	42
CCOC(=O)Nc1ccc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000819334991	HH	On-Demand	Anodyne	CA9	31	44
CCOC(=O)Nc1ccc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000819334991	HH	On-Demand	Anodyne	MTCA1	25	42
CCOC(=O)Nc1ccc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000819334991	HH	On-Demand	Anodyne	P96878_MYCTU	36	42
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000819335017	EG	On-Demand	Anodyne	UL26	57	33
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000819335017	EG	On-Demand	Anodyne	SCAF_EBVB9	53	33
C[C@@H]1CCCC[C@@H]1C(=O)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819335018	DH	On-Demand	Anodyne	PREP	61	42
C[C@@H]1CCCC[C@@H]1C(=O)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819335018	DH	On-Demand	Anodyne	Q8WSF8_APLCA	19	49
C[C@@H]1CCCC[C@@H]1C(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819335019	DH	On-Demand	Anodyne	PREP	61	42
C[C@@H]1CCCC[C@@H]1C(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819335019	DH	On-Demand	Anodyne	Q8WSF8_APLCA	19	49
C[C@@H]1CCCC[C@@H]1C(=O)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819335020	DH	On-Demand	Anodyne	PREP	61	42
C[C@@H]1CCCC[C@@H]1C(=O)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819335020	DH	On-Demand	Anodyne	Q8WSF8_APLCA	19	49
C[C@@H]1CCCC[C@@H]1C(=O)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819335021	DH	On-Demand	Anodyne	PREP	61	42
C[C@@H]1CCCC[C@@H]1C(=O)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819335021	DH	On-Demand	Anodyne	Q8WSF8_APLCA	19	49
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c(OC)c1	ZINC000819335029	GG	On-Demand	Anodyne	ADRB2	36	45
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c(OC)c1	ZINC000819335029	GG	On-Demand	Anodyne	ADRB1	34	44
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c(OC)c1	ZINC000819335029	GG	On-Demand	Anodyne	ADRB3	49	44
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(C(F)(F)F)cc2)c(OC)c1	ZINC000819335029	GG	On-Demand	Anodyne	PPARD	30	41
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c(OC)c1	ZINC000819335030	GG	On-Demand	Anodyne	ADRB2	36	45
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c(OC)c1	ZINC000819335030	GG	On-Demand	Anodyne	ADRB1	34	44
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c(OC)c1	ZINC000819335030	GG	On-Demand	Anodyne	ADRB3	49	44
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c(OC)c1	ZINC000819335030	GG	On-Demand	Anodyne	PPARD	30	41
C[C@@H](c1ccc(F)cc1)N1CCC[C@@H](NC[C@H](O)c2ccccc2)C1=O	ZINC000819335035	FG	On-Demand	Anodyne	SLC6A3	32	47
C[C@@H](c1ccc(F)cc1)N1CCC[C@@H](NC[C@H](O)c2ccccc2)C1=O	ZINC000819335035	FG	On-Demand	Anodyne	BIRC8	45	32
C[C@@H](c1ccc(F)cc1)N1CCC[C@@H](NC[C@@H](O)c2ccccc2)C1=O	ZINC000819335037	FG	On-Demand	Anodyne	SLC6A3	32	47
C[C@@H](c1ccc(F)cc1)N1CCC[C@@H](NC[C@@H](O)c2ccccc2)C1=O	ZINC000819335037	FG	On-Demand	Anodyne	BIRC8	45	32
C[C@@H](c1ccc(F)cc1)N1CCC[C@H](NC[C@@H](O)c2ccccc2)C1=O	ZINC000819335038	FG	On-Demand	Anodyne	SLC6A3	32	47
C[C@@H](c1ccc(F)cc1)N1CCC[C@H](NC[C@@H](O)c2ccccc2)C1=O	ZINC000819335038	FG	On-Demand	Anodyne	BIRC8	45	32
C[C@@H](c1ccc(F)cc1)N1CCC[C@H](NC[C@H](O)c2ccccc2)C1=O	ZINC000819335042	FG	On-Demand	Anodyne	SLC6A3	32	47
C[C@@H](c1ccc(F)cc1)N1CCC[C@H](NC[C@H](O)c2ccccc2)C1=O	ZINC000819335042	FG	On-Demand	Anodyne	BIRC8	45	32
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(C#N)cc2)c(OC)c1	ZINC000819335048	FE	On-Demand	Mild	ADRB2	36	45
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(C#N)cc2)c(OC)c1	ZINC000819335048	FE	On-Demand	Mild	ADRB1	36	42
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(C#N)cc2)c(OC)c1	ZINC000819335048	FE	On-Demand	Mild	ADRB3	41	42
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(C#N)cc2)c(OC)c1	ZINC000819335049	FE	On-Demand	Mild	ADRB2	36	45
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(C#N)cc2)c(OC)c1	ZINC000819335049	FE	On-Demand	Mild	ADRB1	36	42
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(C#N)cc2)c(OC)c1	ZINC000819335049	FE	On-Demand	Mild	ADRB3	41	42
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(F)cc2)c(OC)c1	ZINC000819335050	EE	On-Demand	Anodyne	ADRB2	57	47
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(F)cc2)c(OC)c1	ZINC000819335050	EE	On-Demand	Anodyne	ADRB1	53	43
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(F)cc2)c(OC)c1	ZINC000819335050	EE	On-Demand	Anodyne	ADRB3	62	43
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(F)cc2)c(OC)c1	ZINC000819335051	EE	On-Demand	Anodyne	ADRB2	57	47
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(F)cc2)c(OC)c1	ZINC000819335051	EE	On-Demand	Anodyne	ADRB1	53	43
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(F)cc2)c(OC)c1	ZINC000819335051	EE	On-Demand	Anodyne	ADRB3	62	43
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819335054	GF	On-Demand	Anodyne	DRD4	35	41
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819335054	GF	On-Demand	Anodyne	ACHE	45	46
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819335054	GF	On-Demand	Anodyne	SIGMAR1	38	40
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819335054	GF	On-Demand	Anodyne	CACNA1I	42	33
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)/C=C\[C@H]1CCCO1	ZINC000819335073	EF	On-Demand	Anodyne	ACHE	38	46
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)/C=C\[C@H]1CCCO1	ZINC000819335073	EF	On-Demand	Anodyne	SIGMAR1	40	44
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)/C=C/[C@@H]1CCCO1	ZINC000819335074	EF	On-Demand	Anodyne	ACHE	38	46
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)/C=C/[C@@H]1CCCO1	ZINC000819335074	EF	On-Demand	Anodyne	SIGMAR1	40	44
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)/C=C/[C@H]1CCCO1	ZINC000819335075	EF	On-Demand	Anodyne	ACHE	38	46
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)/C=C/[C@H]1CCCO1	ZINC000819335075	EF	On-Demand	Anodyne	SIGMAR1	40	44
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)/C=C\[C@@H]1CCCO1	ZINC000819335076	EF	On-Demand	Anodyne	ACHE	38	46
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)/C=C\[C@@H]1CCCO1	ZINC000819335076	EF	On-Demand	Anodyne	SIGMAR1	40	44
COc1ccc(NC(=O)c2cc3c(cn2)OCCO3)cc1N1CCOC1=O	ZINC000819335115	FE	On-Demand	Anodyne	CPT1A	53	46
COc1ccc(NC(=O)c2cc3c(cn2)OCCO3)cc1N1CCOC1=O	ZINC000819335115	FE	On-Demand	Anodyne	CPT2	42	36
COc1ccc(NC(=O)c2cc3c(cn2)OCCO3)cc1N1CCOC1=O	ZINC000819335115	FE	On-Demand	Anodyne	CPT1B	42	38
COc1ccc(NC(=O)c2cc3c(cn2)OCCO3)cc1N1CCOC1=O	ZINC000819335115	FE	On-Demand	Anodyne	ENPP1	50	32
COC(=O)c1ccc(CCNC[C@H](O)c2cc(F)ccc2F)c(OC)c1	ZINC000819335116	FF	On-Demand	Anodyne	ADRB1	29	42
COC(=O)c1ccc(CCNC[C@H](O)c2cc(F)ccc2F)c(OC)c1	ZINC000819335116	FF	On-Demand	Anodyne	ADRB3	29	42
CSc1ccc([C@H](CNC(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819335127	HG	On-Demand	Anodyne	GPR119	38	48
CSc1ccc([C@@H](CNC(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819335128	HG	On-Demand	Anodyne	GPR119	38	48
CSc1ccc([C@@H](CNC(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819335129	HG	On-Demand	Anodyne	GPR119	38	48
CSc1ccc([C@H](CNC(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819335130	HG	On-Demand	Anodyne	GPR119	38	48
CSc1ccc([C@H](CNC(=O)CCN2CCOCC2)N(C)C)cc1	ZINC000819335140	FD	On-Demand	Anodyne	CASR	35	41
CSc1ccc([C@@H](CNC(=O)CCN2CCOCC2)N(C)C)cc1	ZINC000819335141	FD	On-Demand	Anodyne	CASR	35	41
CSc1ccc([C@H](CNC(=O)C[C@H]2CCN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819335148	HH	On-Demand	Anodyne	GPR119	38	48
CSc1ccc([C@H](CNC(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819335149	HH	On-Demand	Anodyne	GPR119	38	48
CSc1ccc([C@@H](CNC(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819335150	HH	On-Demand	Anodyne	GPR119	38	48
CSc1ccc([C@@H](CNC(=O)C[C@H]2CCN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819335151	HH	On-Demand	Anodyne	GPR119	38	48
CSc1ccc([C@@H](CNC(=O)c2cccnc2-n2cccn2)N(C)C)cc1	ZINC000819335177	GG	On-Demand	Anodyne	AMP1_PLAFQ	52	35
CSc1ccc([C@H](CNC(=O)c2cccnc2-n2cccn2)N(C)C)cc1	ZINC000819335178	GG	On-Demand	Anodyne	AMP1_PLAFQ	52	35
CSc1ccc([C@H](CNC(=O)COc2ccc3c(C)cc(=O)oc3c2)N(C)C)cc1	ZINC000819335186	IH	On-Demand	Anodyne	MAOA	67	57
CSc1ccc([C@H](CNC(=O)COc2ccc3c(C)cc(=O)oc3c2)N(C)C)cc1	ZINC000819335186	IH	On-Demand	Anodyne	MAOB	41	57
CSc1ccc([C@@H](CNC(=O)COc2ccc3c(C)cc(=O)oc3c2)N(C)C)cc1	ZINC000819335187	IH	On-Demand	Anodyne	MAOA	67	57
CSc1ccc([C@@H](CNC(=O)COc2ccc3c(C)cc(=O)oc3c2)N(C)C)cc1	ZINC000819335187	IH	On-Demand	Anodyne	MAOB	41	57
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819335188	GF	On-Demand	Anodyne	FCER2	46	35
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819335188	GF	On-Demand	Anodyne	CTSK	36	47
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819335188	GF	On-Demand	Anodyne	CTSL	31	47
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819335188	GF	On-Demand	Anodyne	CAPNS1	54	34
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819335188	GF	On-Demand	Anodyne	CTSS	23	47
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819335188	GF	On-Demand	Anodyne	CAPN1	65	42
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819335188	GF	On-Demand	Anodyne	CAPN2	98	38
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819335188	GF	On-Demand	Anodyne	FPR1	69	38
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819335188	GF	On-Demand	Anodyne	NPR	71	37
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819335189	GF	On-Demand	Anodyne	FCER2	46	35
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819335189	GF	On-Demand	Anodyne	CTSK	36	47
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819335189	GF	On-Demand	Anodyne	CTSL	31	47
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819335189	GF	On-Demand	Anodyne	CAPNS1	54	34
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819335189	GF	On-Demand	Anodyne	CTSS	23	47
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819335189	GF	On-Demand	Anodyne	CAPN1	65	42
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819335189	GF	On-Demand	Anodyne	CAPN2	98	38
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819335189	GF	On-Demand	Anodyne	FPR1	69	38
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819335189	GF	On-Demand	Anodyne	NPR	71	37
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819335190	GF	On-Demand	Anodyne	FCER2	46	35
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819335190	GF	On-Demand	Anodyne	CTSK	36	47
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819335190	GF	On-Demand	Anodyne	CTSL	31	47
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819335190	GF	On-Demand	Anodyne	CAPNS1	54	34
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819335190	GF	On-Demand	Anodyne	CTSS	23	47
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819335190	GF	On-Demand	Anodyne	CAPN1	65	42
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819335190	GF	On-Demand	Anodyne	CAPN2	98	38
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819335190	GF	On-Demand	Anodyne	FPR1	69	38
COC(=O)N[C@@H](CC(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819335190	GF	On-Demand	Anodyne	NPR	71	37
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819335191	GF	On-Demand	Anodyne	FCER2	46	35
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819335191	GF	On-Demand	Anodyne	CTSK	36	47
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819335191	GF	On-Demand	Anodyne	CTSL	31	47
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819335191	GF	On-Demand	Anodyne	CAPNS1	54	34
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819335191	GF	On-Demand	Anodyne	CTSS	23	47
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819335191	GF	On-Demand	Anodyne	CAPN1	65	42
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819335191	GF	On-Demand	Anodyne	CAPN2	98	38
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819335191	GF	On-Demand	Anodyne	FPR1	69	38
COC(=O)N[C@H](CC(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819335191	GF	On-Demand	Anodyne	NPR	71	37
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc(=O)c2ccc(F)cc2o1	ZINC000819335198	HG	On-Demand	Anodyne	KCNH2	15	46
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc(=O)c2ccc(F)cc2o1	ZINC000819335198	HG	On-Demand	Anodyne	BCHE	33	41
COC(=O)c1ccc(CCNC[C@@H](O)c2cc(F)ccc2F)c(OC)c1	ZINC000819335217	FF	On-Demand	Anodyne	ADRB1	29	42
COC(=O)c1ccc(CCNC[C@@H](O)c2cc(F)ccc2F)c(OC)c1	ZINC000819335217	FF	On-Demand	Anodyne	ADRB3	29	42
COc1cccc([S@](=O)CC(=O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000819335218	GF	On-Demand	Anodyne	SLC18A2	21	41
COc1cccc([S@](=O)CC(=O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000819335218	GF	On-Demand	Anodyne	MTNR1B	15	41
COc1cccc([S@](=O)CC(=O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000819335218	GF	On-Demand	Anodyne	Q8WSF8_APLCA	21	41
COc1cccc([S@](=O)CC(=O)N2CCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000819335218	GF	On-Demand	Anodyne	ACKR3	40	33
COc1cccc([S@](=O)CC(=O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819335219	GF	On-Demand	Anodyne	SLC18A2	21	41
COc1cccc([S@](=O)CC(=O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819335219	GF	On-Demand	Anodyne	MTNR1B	15	41
COc1cccc([S@](=O)CC(=O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819335219	GF	On-Demand	Anodyne	Q8WSF8_APLCA	21	41
COc1cccc([S@](=O)CC(=O)N2CCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819335219	GF	On-Demand	Anodyne	ACKR3	40	33
COc1cccc([S@](=O)CC(=O)N2CCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000819335220	GF	On-Demand	Anodyne	SLC18A2	21	41
COc1cccc([S@](=O)CC(=O)N2CCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000819335220	GF	On-Demand	Anodyne	MTNR1B	15	41
COc1cccc([S@](=O)CC(=O)N2CCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000819335220	GF	On-Demand	Anodyne	Q8WSF8_APLCA	21	41
COc1cccc([S@](=O)CC(=O)N2CCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000819335220	GF	On-Demand	Anodyne	ACKR3	40	33
COc1cccc([S@](=O)CC(=O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819335221	GF	On-Demand	Anodyne	SLC18A2	21	41
COc1cccc([S@](=O)CC(=O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819335221	GF	On-Demand	Anodyne	MTNR1B	15	41
COc1cccc([S@](=O)CC(=O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819335221	GF	On-Demand	Anodyne	Q8WSF8_APLCA	21	41
COc1cccc([S@](=O)CC(=O)N2CCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819335221	GF	On-Demand	Anodyne	ACKR3	40	33
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccc(F)c(F)c1	ZINC000819335222	GH	On-Demand	Anodyne	ADRB1	23	42
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccc(F)c(F)c1	ZINC000819335222	GH	On-Demand	Anodyne	ADRB3	50	42
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccc(F)c(F)c1	ZINC000819335223	GH	On-Demand	Anodyne	ADRB1	23	42
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccc(F)c(F)c1	ZINC000819335223	GH	On-Demand	Anodyne	ADRB3	50	42
COC(=O)c1ccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c(OC)c1	ZINC000819335224	GG	On-Demand	Anodyne	ADRB2	47	43
COC(=O)c1ccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c(OC)c1	ZINC000819335224	GG	On-Demand	Anodyne	ADRB1	50	50
COC(=O)c1ccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c(OC)c1	ZINC000819335224	GG	On-Demand	Anodyne	ADRB3	70	50
COC(=O)c1ccc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)c(OC)c1	ZINC000819335224	GG	On-Demand	Anodyne	CCR2	29	41
COC(=O)c1ccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c(OC)c1	ZINC000819335225	GG	On-Demand	Anodyne	ADRB2	47	43
COC(=O)c1ccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c(OC)c1	ZINC000819335225	GG	On-Demand	Anodyne	ADRB1	50	50
COC(=O)c1ccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c(OC)c1	ZINC000819335225	GG	On-Demand	Anodyne	ADRB3	70	50
COC(=O)c1ccc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)c(OC)c1	ZINC000819335225	GG	On-Demand	Anodyne	CCR2	29	41
COC(=O)c1ccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c(OC)c1	ZINC000819335228	FE	On-Demand	Bother	ADRB2	42	42
COC(=O)c1ccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c(OC)c1	ZINC000819335228	FE	On-Demand	Bother	ADRB1	47	47
COC(=O)c1ccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c(OC)c1	ZINC000819335228	FE	On-Demand	Bother	CACNA1C	53	36
COC(=O)c1ccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c(OC)c1	ZINC000819335228	FE	On-Demand	Bother	ADRB3	63	47
COC(=O)c1ccc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c(OC)c1	ZINC000819335228	FE	On-Demand	Bother	CACNA1D	79	36
COC(=O)c1ccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(OC)c1	ZINC000819335229	FE	On-Demand	Bother	ADRB2	42	42
COC(=O)c1ccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(OC)c1	ZINC000819335229	FE	On-Demand	Bother	ADRB1	47	47
COC(=O)c1ccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(OC)c1	ZINC000819335229	FE	On-Demand	Bother	CACNA1C	53	36
COC(=O)c1ccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(OC)c1	ZINC000819335229	FE	On-Demand	Bother	ADRB3	63	47
COC(=O)c1ccc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(OC)c1	ZINC000819335229	FE	On-Demand	Bother	CACNA1D	79	36
O=C(CCNC[C@H](O)c1cccnc1)Nc1cc(Cl)cc(Cl)c1	ZINC000819335265	FG	On-Demand	Anodyne	ADRB2	32	52
O=C(CCNC[C@H](O)c1cccnc1)Nc1cc(Cl)cc(Cl)c1	ZINC000819335265	FG	On-Demand	Anodyne	ADRB1	52	52
O=C(CCNC[C@H](O)c1cccnc1)Nc1cc(Cl)cc(Cl)c1	ZINC000819335265	FG	On-Demand	Anodyne	ADRB3	131	58
O=C(CCNC[C@@H](O)c1cccnc1)Nc1cc(Cl)cc(Cl)c1	ZINC000819335266	FG	On-Demand	Anodyne	ADRB2	32	52
O=C(CCNC[C@@H](O)c1cccnc1)Nc1cc(Cl)cc(Cl)c1	ZINC000819335266	FG	On-Demand	Anodyne	ADRB1	52	52
O=C(CCNC[C@@H](O)c1cccnc1)Nc1cc(Cl)cc(Cl)c1	ZINC000819335266	FG	On-Demand	Anodyne	ADRB3	131	58
C#CCN(C)CCCNCCC(=O)Nc1cccc(Br)c1	ZINC000819335272	FE	On-Demand	Mild	EGFR	23	43
C#CCN(C)CCCNCCC(=O)Nc1cccc(Br)c1	ZINC000819335272	FE	On-Demand	Mild	HDAC10	17	40
COC(=O)c1ccc(CCNC[C@@H](O)c2ccccc2C)c(OC)c1	ZINC000819335273	EF	On-Demand	Anodyne	ADRB2	56	42
COC(=O)c1ccc(CCNC[C@@H](O)c2ccccc2C)c(OC)c1	ZINC000819335273	EF	On-Demand	Anodyne	ADRB1	51	43
COC(=O)c1ccc(CCNC[C@@H](O)c2ccccc2C)c(OC)c1	ZINC000819335273	EF	On-Demand	Anodyne	ADRB3	43	43
COC(=O)c1ccc(CCNC[C@H](O)c2ccccc2C)c(OC)c1	ZINC000819335274	EF	On-Demand	Anodyne	ADRB2	56	42
COC(=O)c1ccc(CCNC[C@H](O)c2ccccc2C)c(OC)c1	ZINC000819335274	EF	On-Demand	Anodyne	ADRB1	51	43
COC(=O)c1ccc(CCNC[C@H](O)c2ccccc2C)c(OC)c1	ZINC000819335274	EF	On-Demand	Anodyne	ADRB3	43	43
COC(=O)c1ccc(CCNC[C@H](O)c2ccccc2F)c(OC)c1	ZINC000819335279	EE	On-Demand	Anodyne	ADRB2	34	40
COC(=O)c1ccc(CCNC[C@H](O)c2ccccc2F)c(OC)c1	ZINC000819335279	EE	On-Demand	Anodyne	ADRB1	44	42
COC(=O)c1ccc(CCNC[C@H](O)c2ccccc2F)c(OC)c1	ZINC000819335279	EE	On-Demand	Anodyne	ADRB3	39	42
COC(=O)c1ccc(CCNC[C@@H](O)c2ccccc2F)c(OC)c1	ZINC000819335280	EE	On-Demand	Anodyne	ADRB2	34	40
COC(=O)c1ccc(CCNC[C@@H](O)c2ccccc2F)c(OC)c1	ZINC000819335280	EE	On-Demand	Anodyne	ADRB1	44	42
COC(=O)c1ccc(CCNC[C@@H](O)c2ccccc2F)c(OC)c1	ZINC000819335280	EE	On-Demand	Anodyne	ADRB3	39	42
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccccc1	ZINC000819335281	EG	On-Demand	Anodyne	ADRB2	44	51
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccccc1	ZINC000819335281	EG	On-Demand	Anodyne	ADRB1	52	53
O[C@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccccc1	ZINC000819335281	EG	On-Demand	Anodyne	ADRB3	117	53
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccccc1	ZINC000819335282	EG	On-Demand	Anodyne	ADRB2	44	51
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccccc1	ZINC000819335282	EG	On-Demand	Anodyne	ADRB1	52	53
O[C@@H](CNCCc1cnc(SC2CCCC2)nc1)c1ccccc1	ZINC000819335282	EG	On-Demand	Anodyne	ADRB3	117	53
CC1(C)CCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819335295	BF	On-Demand	Anodyne	ADRB1	21	41
CC1(C)CCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819335295	BF	On-Demand	Anodyne	ADRB3	87	48
CC1(C)CCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819335297	BF	On-Demand	Anodyne	ADRB1	21	41
CC1(C)CCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819335297	BF	On-Demand	Anodyne	ADRB3	87	48
Cc1ccccc1[C@@H](O)CNCCc1cnc(SC2CCCC2)nc1	ZINC000819335315	FH	On-Demand	Anodyne	ADRB1	17	42
Cc1ccccc1[C@@H](O)CNCCc1cnc(SC2CCCC2)nc1	ZINC000819335315	FH	On-Demand	Anodyne	ADRB3	32	42
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccc(C(F)(F)F)nc1Cl	ZINC000819335324	II	On-Demand	Anodyne	TRPV1	57	39
Cc1ccc(N2CCCC2)c(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819335366	HH	On-Demand	Anodyne	DRD2	15	46
Cc1ccc(N2CCCC2)c(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819335366	HH	On-Demand	Anodyne	CNR1	40	35
Cc1ccc(N2CCCC2)c(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819335366	HH	On-Demand	Anodyne	HTR2A	24	45
Cc1ccc(N2CCCC2)c(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819335366	HH	On-Demand	Anodyne	HTR2C	26	45
Cc1ccc(N2CCCC2)c(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819335366	HH	On-Demand	Anodyne	SLC6A4	15	45
Cc1ccc(N2CCCC2)c(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819335366	HH	On-Demand	Anodyne	DRD3	31	41
O=C(CCCCN1CCCC1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335372	GF	On-Demand	Anodyne	DRD2	18	46
O=C(CCCCN1CCCC1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335372	GF	On-Demand	Anodyne	DRD3	26	41
O=C(CCCCN1CCCC1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335372	GF	On-Demand	Anodyne	HRP1_PLAFA	31	42
O=C(CCCCN1CCCC1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335372	GF	On-Demand	Anodyne	AHCY	25	41
O=C(CCCCN1CCCC1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335372	GF	On-Demand	Anodyne	CCR1	23	42
O=C(CCCCN1CCCC1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335372	GF	On-Demand	Anodyne	CHRNA7	18	51
O=C(CCCCN1CCCC1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335372	GF	On-Demand	Anodyne	CACNA1G	18	43
O=C(COC1CCCCC1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335379	FF	On-Demand	Anodyne	MMP2	47	33
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccc(Cl)nc1	ZINC000819335405	FF	On-Demand	Anodyne	TBXAS1	24	40
CSc1ccc([C@H](CNC(=O)C=C2CCN(C(=O)OC(C)(C)C)CC2)N(C)C)cc1	ZINC000819335414	II	On-Demand	Anodyne	GPR119	22	42
CSc1ccc([C@@H](CNC(=O)C=C2CCN(C(=O)OC(C)(C)C)CC2)N(C)C)cc1	ZINC000819335415	II	On-Demand	Anodyne	GPR119	22	42
COC(=O)c1ccc(CCNC[C@H](O)c2cccc(F)c2)c(OC)c1	ZINC000819335432	EE	On-Demand	Anodyne	ADRB2	59	45
COC(=O)c1ccc(CCNC[C@H](O)c2cccc(F)c2)c(OC)c1	ZINC000819335432	EE	On-Demand	Anodyne	ADRB1	61	50
COC(=O)c1ccc(CCNC[C@H](O)c2cccc(F)c2)c(OC)c1	ZINC000819335432	EE	On-Demand	Anodyne	ADRB3	79	50
COC(=O)c1ccc(CCNC[C@@H](O)c2cccc(F)c2)c(OC)c1	ZINC000819335433	EE	On-Demand	Anodyne	ADRB2	59	45
COC(=O)c1ccc(CCNC[C@@H](O)c2cccc(F)c2)c(OC)c1	ZINC000819335433	EE	On-Demand	Anodyne	ADRB1	61	50
COC(=O)c1ccc(CCNC[C@@H](O)c2cccc(F)c2)c(OC)c1	ZINC000819335433	EE	On-Demand	Anodyne	ADRB3	79	50
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)c(OC)c1	ZINC000819335435	GG	On-Demand	Anodyne	ADRB2	43	46
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)c(OC)c1	ZINC000819335435	GG	On-Demand	Anodyne	ADRB1	39	46
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)c(OC)c1	ZINC000819335435	GG	On-Demand	Anodyne	ADRB3	51	46
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)c(OC)c1	ZINC000819335436	GG	On-Demand	Anodyne	ADRB2	43	46
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)c(OC)c1	ZINC000819335436	GG	On-Demand	Anodyne	ADRB1	39	46
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)c(OC)c1	ZINC000819335436	GG	On-Demand	Anodyne	ADRB3	51	46
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(F)cc2F)c(OC)c1	ZINC000819335456	FF	On-Demand	Anodyne	ADRB2	29	41
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(F)cc2F)c(OC)c1	ZINC000819335456	FF	On-Demand	Anodyne	ADRB1	34	42
COC(=O)c1ccc(CCNC[C@H](O)c2ccc(F)cc2F)c(OC)c1	ZINC000819335456	FF	On-Demand	Anodyne	ADRB3	30	42
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(F)cc2F)c(OC)c1	ZINC000819335457	FF	On-Demand	Anodyne	ADRB2	29	41
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(F)cc2F)c(OC)c1	ZINC000819335457	FF	On-Demand	Anodyne	ADRB1	34	42
COC(=O)c1ccc(CCNC[C@@H](O)c2ccc(F)cc2F)c(OC)c1	ZINC000819335457	FF	On-Demand	Anodyne	ADRB3	30	42
C#CCN(C)CCCNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819335470	FE	On-Demand	Mild	CYNT	35	44
COc1ccc(OC)c([C@H](O)CNCCc2nccnc2C)c1	ZINC000819335480	DD	On-Demand	Anodyne	ADRB2	25	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCC(C)(C)C2CC2)CC1	ZINC000819335489	FG	On-Demand	Anodyne	GPR119	30	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCC(C)(C)C2CC2)CC1	ZINC000819335490	FG	On-Demand	Anodyne	GPR119	30	42
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819335493	GI	On-Demand	Anodyne	FKBP1A	41	35
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819335493	GI	On-Demand	Anodyne	SLC18A2	28	40
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819335493	GI	On-Demand	Anodyne	PREP	61	42
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819335493	GI	On-Demand	Anodyne	Q8WSF8_APLCA	21	40
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819335494	GI	On-Demand	Anodyne	FKBP1A	41	35
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819335494	GI	On-Demand	Anodyne	SLC18A2	28	40
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819335494	GI	On-Demand	Anodyne	PREP	61	42
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000819335494	GI	On-Demand	Anodyne	Q8WSF8_APLCA	21	40
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819335495	GI	On-Demand	Anodyne	FKBP1A	41	35
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819335495	GI	On-Demand	Anodyne	SLC18A2	28	40
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819335495	GI	On-Demand	Anodyne	PREP	61	42
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819335495	GI	On-Demand	Anodyne	Q8WSF8_APLCA	21	40
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819335496	GI	On-Demand	Anodyne	FKBP1A	41	35
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819335496	GI	On-Demand	Anodyne	SLC18A2	28	40
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819335496	GI	On-Demand	Anodyne	PREP	61	42
O=C(CCc1cccc(OC(F)F)c1)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819335496	GI	On-Demand	Anodyne	Q8WSF8_APLCA	21	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H](F)Cc1ccccc1	ZINC000819335532	GG	On-Demand	Anodyne	AVPR1A	16	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H](F)Cc1ccccc1	ZINC000819335532	GG	On-Demand	Anodyne	MME	55	47
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H](F)Cc1ccccc1	ZINC000819335532	GG	On-Demand	Anodyne	TBXA2R	45	39
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H](F)Cc1ccccc1	ZINC000819335532	GG	On-Demand	Anodyne	MMP8	22	43
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H](F)Cc1ccccc1	ZINC000819335532	GG	On-Demand	Anodyne	CAPN1	32	44
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H](F)Cc1ccccc1	ZINC000819335532	GG	On-Demand	Anodyne	AMP1_PLAFQ	47	43
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H](F)Cc1ccccc1	ZINC000819335532	GG	On-Demand	Anodyne	NPFFR1	60	33
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H](F)Cc1ccccc1	ZINC000819335533	GG	On-Demand	Anodyne	AVPR1A	16	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H](F)Cc1ccccc1	ZINC000819335533	GG	On-Demand	Anodyne	MME	55	47
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H](F)Cc1ccccc1	ZINC000819335533	GG	On-Demand	Anodyne	TBXA2R	45	39
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H](F)Cc1ccccc1	ZINC000819335533	GG	On-Demand	Anodyne	MMP8	22	43
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H](F)Cc1ccccc1	ZINC000819335533	GG	On-Demand	Anodyne	CAPN1	32	44
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H](F)Cc1ccccc1	ZINC000819335533	GG	On-Demand	Anodyne	AMP1_PLAFQ	47	43
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H](F)Cc1ccccc1	ZINC000819335533	GG	On-Demand	Anodyne	NPFFR1	60	33
CCOC(=O)N1CCC(C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)CC1	ZINC000819335545	GF	On-Demand	Anodyne	GPR119	16	40
CCOC(=O)N1CCC(C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)CC1	ZINC000819335546	GF	On-Demand	Anodyne	GPR119	16	40
CSc1ccc([C@@H](CNC(=O)CC2CN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819335567	HG	On-Demand	Anodyne	GPR119	22	42
CSc1ccc([C@H](CNC(=O)CC2CN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819335568	HG	On-Demand	Anodyne	GPR119	22	42
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	ACE	24	41
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	CELA1	15	49
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	ELANE	28	41
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	FCER2	42	33
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	CASP3	17	47
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	BMP1	18	45
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	KLK3	85	38
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	CTSB	69	48
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	PAPA1_CARPA	81	41
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	CYSP_TRYCR	56	41
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	CTSK	40	48
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	CTSL	47	43
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	PGA	22	41
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	CAPNS1	70	41
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	HLA-DRB1	41	37
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	MMP11	41	32
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	CTSS	20	48
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	CAPN1	90	46
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	CASP1	25	45
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	CAPN2	145	43
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	NPR	86	42
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	PSMB5	46	41
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335574	HG	On-Demand	Anodyne	Q6PRC7_IXORI	43	39
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	ACE	24	41
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	CELA1	15	49
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	ELANE	28	41
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	FCER2	42	33
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	CASP3	17	47
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	BMP1	18	45
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	KLK3	85	38
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	CTSB	69	48
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	PAPA1_CARPA	81	41
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	CYSP_TRYCR	56	41
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	CTSK	40	48
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	CTSL	47	43
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	PGA	22	41
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	CAPNS1	70	41
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	HLA-DRB1	41	37
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	MMP11	41	32
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	CTSS	20	48
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	CAPN1	90	46
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	CASP1	25	45
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	CAPN2	145	43
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	NPR	86	42
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	PSMB5	46	41
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819335575	HG	On-Demand	Anodyne	Q6PRC7_IXORI	43	39
CSc1ccc([C@H](CNC(=O)[C@H](C)NC(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819335587	GG	On-Demand	Anodyne	FPR1	43	41
CSc1ccc([C@H](CNC(=O)[C@@H](C)NC(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819335588	GG	On-Demand	Anodyne	FPR1	43	41
CSc1ccc([C@@H](CNC(=O)[C@@H](C)NC(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819335589	GG	On-Demand	Anodyne	FPR1	43	41
CSc1ccc([C@@H](CNC(=O)[C@H](C)NC(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819335590	GG	On-Demand	Anodyne	FPR1	43	41
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000819335601	IF	On-Demand	Bother	HRP1_PLAFA	17	43
O=C(/C=C\c1ccccc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335603	FG	On-Demand	Anodyne	HDAC8	20	45
O=C(/C=C\c1ccccc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335603	FG	On-Demand	Anodyne	MMP2	19	51
O=C(/C=C\c1ccccc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335603	FG	On-Demand	Anodyne	HDAC1	19	45
O=C(/C=C\c1ccccc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335603	FG	On-Demand	Anodyne	HDAC2	20	42
O=C(/C=C\c1ccccc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335603	FG	On-Demand	Anodyne	HDAC9	36	42
O=C(/C=C\c1ccccc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335603	FG	On-Demand	Anodyne	HDAC7	44	42
O=C(/C=C/c1ccccc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335604	FG	On-Demand	Anodyne	HDAC8	20	45
O=C(/C=C/c1ccccc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335604	FG	On-Demand	Anodyne	MMP2	19	51
O=C(/C=C/c1ccccc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335604	FG	On-Demand	Anodyne	HDAC1	19	45
O=C(/C=C/c1ccccc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335604	FG	On-Demand	Anodyne	HDAC2	20	42
O=C(/C=C/c1ccccc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335604	FG	On-Demand	Anodyne	HDAC9	36	42
O=C(/C=C/c1ccccc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819335604	FG	On-Demand	Anodyne	HDAC7	44	42
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H]1CCCN1C(=O)C(F)(F)F	ZINC000819335640	IE	On-Demand	Anodyne	F2	37	41
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H]1CCCN1C(=O)C(F)(F)F	ZINC000819335640	IE	On-Demand	Anodyne	ELANE	49	46
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H]1CCCN1C(=O)C(F)(F)F	ZINC000819335640	IE	On-Demand	Anodyne	P2RX7	17	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H]1CCCN1C(=O)C(F)(F)F	ZINC000819335640	IE	On-Demand	Anodyne	WNT3	41	33
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H]1CCCN1C(=O)C(F)(F)F	ZINC000819335641	IE	On-Demand	Anodyne	F2	37	41
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H]1CCCN1C(=O)C(F)(F)F	ZINC000819335641	IE	On-Demand	Anodyne	ELANE	49	46
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H]1CCCN1C(=O)C(F)(F)F	ZINC000819335641	IE	On-Demand	Anodyne	P2RX7	17	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H]1CCCN1C(=O)C(F)(F)F	ZINC000819335641	IE	On-Demand	Anodyne	WNT3	41	33
CSc1ccc([C@H](CNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)N(C)C)cc1	ZINC000819335668	IF	On-Demand	Anodyne	CA2	29	53
CSc1ccc([C@H](CNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)N(C)C)cc1	ZINC000819335668	IF	On-Demand	Anodyne	CA6	20	44
CSc1ccc([C@H](CNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)N(C)C)cc1	ZINC000819335668	IF	On-Demand	Anodyne	CA1	20	53
CSc1ccc([C@H](CNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)N(C)C)cc1	ZINC000819335668	IF	On-Demand	Anodyne	CA7	23	45
CSc1ccc([C@H](CNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)N(C)C)cc1	ZINC000819335668	IF	On-Demand	Anodyne	CA13	41	45
CSc1ccc([C@H](CNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)N(C)C)cc1	ZINC000819335668	IF	On-Demand	Anodyne	CA4	21	53
CSc1ccc([C@@H](CNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)N(C)C)cc1	ZINC000819335669	IF	On-Demand	Anodyne	CA2	29	53
CSc1ccc([C@@H](CNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)N(C)C)cc1	ZINC000819335669	IF	On-Demand	Anodyne	CA6	20	44
CSc1ccc([C@@H](CNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)N(C)C)cc1	ZINC000819335669	IF	On-Demand	Anodyne	CA1	20	53
CSc1ccc([C@@H](CNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)N(C)C)cc1	ZINC000819335669	IF	On-Demand	Anodyne	CA7	23	45
CSc1ccc([C@@H](CNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)N(C)C)cc1	ZINC000819335669	IF	On-Demand	Anodyne	CA13	41	45
CSc1ccc([C@@H](CNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)N(C)C)cc1	ZINC000819335669	IF	On-Demand	Anodyne	CA4	21	53
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H]1CC(c2cccnc2)=NO1	ZINC000819335670	HE	On-Demand	Anodyne	NAMPT	32	40
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H]1CC(c2cccnc2)=NO1	ZINC000819335671	HE	On-Demand	Anodyne	NAMPT	32	40
CCOC(=O)N[C@@H](C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C)C(C)C	ZINC000819335672	GF	On-Demand	Anodyne	HLA-DRB1	48	38
CCOC(=O)N[C@@H](C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C)C(C)C	ZINC000819335673	GF	On-Demand	Anodyne	HLA-DRB1	48	38
CCOC(=O)N[C@H](C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C)C(C)C	ZINC000819335674	GF	On-Demand	Anodyne	HLA-DRB1	48	38
CCOC(=O)N[C@H](C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C)C(C)C	ZINC000819335675	GF	On-Demand	Anodyne	HLA-DRB1	48	38
C=CCc1cc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc(OC)c1OC	ZINC000819335705	IH	On-Demand	Mild	PTGDR	18	41
C=CCc1cc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc(OC)c1OC	ZINC000819335705	IH	On-Demand	Mild	PTGDR2	22	41
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1cc(Cl)cc(Cl)n1	ZINC000819335710	HH	On-Demand	Anodyne	ALPL	49	39
CSc1ccc([C@@H](CNC(=O)[C@@H](NC(=O)C(F)(F)F)C(C)C)N(C)C)cc1	ZINC000819335718	HF	On-Demand	Anodyne	ELANE	18	40
CSc1ccc([C@H](CNC(=O)[C@@H](NC(=O)C(F)(F)F)C(C)C)N(C)C)cc1	ZINC000819335719	HF	On-Demand	Anodyne	ELANE	18	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCCC2CCOCC2)cc1	ZINC000819335729	ED	On-Demand	Anodyne	ADRB2	22	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCCC2CCOCC2)cc1	ZINC000819335729	ED	On-Demand	Anodyne	GCK	15	44
CS(=O)(=O)c1ccc([C@H](O)CNCCCC2CCOCC2)cc1	ZINC000819335730	ED	On-Demand	Anodyne	ADRB2	22	43
CS(=O)(=O)c1ccc([C@H](O)CNCCCC2CCOCC2)cc1	ZINC000819335730	ED	On-Demand	Anodyne	GCK	15	44
O[C@H](CNC[C@H]1CSc2ccccc21)c1cccnc1	ZINC000819335751	CF	On-Demand	Anodyne	ADRB2	21	41
O[C@H](CNC[C@H]1CSc2ccccc21)c1cccnc1	ZINC000819335751	CF	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CNC[C@H]1CSc2ccccc21)c1cccnc1	ZINC000819335751	CF	On-Demand	Anodyne	ADRB3	89	46
O[C@@H](CNC[C@@H]1CSc2ccccc21)c1cccnc1	ZINC000819335753	CF	On-Demand	Anodyne	ADRB2	21	41
O[C@@H](CNC[C@@H]1CSc2ccccc21)c1cccnc1	ZINC000819335753	CF	On-Demand	Anodyne	ADRB1	22	40
O[C@@H](CNC[C@@H]1CSc2ccccc21)c1cccnc1	ZINC000819335753	CF	On-Demand	Anodyne	ADRB3	89	46
O[C@H](CNC[C@@H]1CSc2ccccc21)c1cccnc1	ZINC000819335755	CF	On-Demand	Anodyne	ADRB2	21	41
O[C@H](CNC[C@@H]1CSc2ccccc21)c1cccnc1	ZINC000819335755	CF	On-Demand	Anodyne	ADRB1	22	40
O[C@H](CNC[C@@H]1CSc2ccccc21)c1cccnc1	ZINC000819335755	CF	On-Demand	Anodyne	ADRB3	89	46
O[C@@H](CNC[C@H]1CSc2ccccc21)c1cccnc1	ZINC000819335757	CF	On-Demand	Anodyne	ADRB2	21	41
O[C@@H](CNC[C@H]1CSc2ccccc21)c1cccnc1	ZINC000819335757	CF	On-Demand	Anodyne	ADRB1	22	40
O[C@@H](CNC[C@H]1CSc2ccccc21)c1cccnc1	ZINC000819335757	CF	On-Demand	Anodyne	ADRB3	89	46
O[C@@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccc(C(F)(F)F)c1	ZINC000819335759	GG	On-Demand	Anodyne	ADRB1	23	42
O[C@@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccc(C(F)(F)F)c1	ZINC000819335759	GG	On-Demand	Anodyne	ADRB3	53	42
O[C@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccc(C(F)(F)F)c1	ZINC000819335761	GG	On-Demand	Anodyne	ADRB1	23	42
O[C@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccc(C(F)(F)F)c1	ZINC000819335761	GG	On-Demand	Anodyne	ADRB3	53	42
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)Cc3ccc(F)cc3)[C@H]2C1	ZINC000819335791	FE	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)Cc3ccc(F)cc3)[C@H]2C1	ZINC000819335792	FE	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)c3cccnc3)[C@H]2C1	ZINC000819335800	DD	On-Demand	Anodyne	ADRB1	18	40
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)c3cccnc3)[C@H]2C1	ZINC000819335800	DD	On-Demand	Anodyne	ADRB3	61	44
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)c3cccnc3)[C@H]2C1	ZINC000819335802	DD	On-Demand	Anodyne	ADRB1	18	40
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)c3cccnc3)[C@H]2C1	ZINC000819335802	DD	On-Demand	Anodyne	ADRB3	61	44
Cc1cc(F)ccc1[C@@H](O)CNCCCC(C)(F)F	ZINC000819335806	CG	On-Demand	Anodyne	LEF	77	35
CSc1ccc([C@H](CNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819335809	HH	On-Demand	Anodyne	GPR119	27	44
CSc1ccc([C@@H](CNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819335811	HH	On-Demand	Anodyne	GPR119	27	44
CSc1ccc([C@H](CNC(=O)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819335813	HH	On-Demand	Anodyne	GPR119	27	44
CSc1ccc([C@@H](CNC(=O)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819335816	HH	On-Demand	Anodyne	GPR119	27	44
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)c3c(F)cccc3F)[C@H]2C1	ZINC000819335858	FE	On-Demand	Anodyne	GPR119	27	46
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)c3c(F)cccc3F)[C@H]2C1	ZINC000819335859	FE	On-Demand	Anodyne	GPR119	27	46
CSc1ccc([C@@H](CNC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)N(C)C)cc1	ZINC000819335902	IE	On-Demand	Anodyne	KCNA3	36	40
CSc1ccc([C@H](CNC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)N(C)C)cc1	ZINC000819335903	IE	On-Demand	Anodyne	KCNA3	36	40
CSc1ccc([C@H](CNC(=O)c2c(-c3ccc(F)cc3)noc2C)N(C)C)cc1	ZINC000819335916	HJ	On-Demand	Anodyne	GPBAR1	20	48
CSc1ccc([C@@H](CNC(=O)c2c(-c3ccc(F)cc3)noc2C)N(C)C)cc1	ZINC000819335917	HJ	On-Demand	Anodyne	GPBAR1	20	48
CCOc1ccc(OC[C@H](O)CN[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)cc1	ZINC000819335964	GE	On-Demand	Anodyne	ADRB2	24	42
CCOc1ccc(OC[C@@H](O)CN[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)cc1	ZINC000819335965	GE	On-Demand	Anodyne	ADRB2	24	42
CS(=O)(=O)CC1CCC(NC[C@@H](O)c2ccc(C#N)cc2)CC1	ZINC000819335974	ED	On-Demand	Mild	ADRB3	15	46
CS(=O)(=O)CC1CCC(NC[C@H](O)c2ccc(C#N)cc2)CC1	ZINC000819335975	ED	On-Demand	Mild	ADRB3	15	46
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819335990	ED	On-Demand	Anodyne	ADRB1	69	43
CC(=O)CCc1ccc(OC[C@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819335990	ED	On-Demand	Anodyne	ADRB3	51	39
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819335991	ED	On-Demand	Anodyne	ADRB1	69	43
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819335991	ED	On-Demand	Anodyne	ADRB3	51	39
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819335992	ED	On-Demand	Anodyne	ADRB1	69	43
CC(=O)CCc1ccc(OC[C@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819335992	ED	On-Demand	Anodyne	ADRB3	51	39
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819335993	ED	On-Demand	Anodyne	ADRB1	69	43
CC(=O)CCc1ccc(OC[C@@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819335993	ED	On-Demand	Anodyne	ADRB3	51	39
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccccc1C(F)(F)F	ZINC000819336018	EE	On-Demand	Anodyne	ADRB2	21	42
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccccc1C(F)(F)F	ZINC000819336018	EE	On-Demand	Anodyne	ADRB1	16	42
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1C(F)(F)F	ZINC000819336019	EE	On-Demand	Anodyne	ADRB2	21	42
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1C(F)(F)F	ZINC000819336019	EE	On-Demand	Anodyne	ADRB1	16	42
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1C(F)(F)F	ZINC000819336020	EE	On-Demand	Anodyne	ADRB2	21	42
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1C(F)(F)F	ZINC000819336020	EE	On-Demand	Anodyne	ADRB1	16	42
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccccc1C(F)(F)F	ZINC000819336021	EE	On-Demand	Anodyne	ADRB2	21	42
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccccc1C(F)(F)F	ZINC000819336021	EE	On-Demand	Anodyne	ADRB1	16	42
CSc1ccc([C@H](CNC(=O)CCC2CCN(C(=O)OC(C)(C)C)CC2)N(C)C)cc1	ZINC000819336140	IJ	On-Demand	Anodyne	GPR119	51	50
CSc1ccc([C@@H](CNC(=O)CCC2CCN(C(=O)OC(C)(C)C)CC2)N(C)C)cc1	ZINC000819336141	IJ	On-Demand	Anodyne	GPR119	51	50
CSc1ccc([C@@H](CNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)N(C)C)cc1	ZINC000819336142	HH	On-Demand	Anodyne	FPR1	40	35
CSc1ccc([C@@H](CNC(=O)[C@H](NC(=O)OC(C)(C)C)C(C)C)N(C)C)cc1	ZINC000819336143	HH	On-Demand	Anodyne	FPR1	40	35
CSc1ccc([C@H](CNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)N(C)C)cc1	ZINC000819336144	HH	On-Demand	Anodyne	FPR1	40	35
CSc1ccc([C@H](CNC(=O)[C@H](NC(=O)OC(C)(C)C)C(C)C)N(C)C)cc1	ZINC000819336145	HH	On-Demand	Anodyne	FPR1	40	35
C#CCOc1ccc(C(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000819336146	GF	On-Demand	Mild	ADAM17	17	42
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccc(CN2CCCCC2=O)cc1	ZINC000819336161	IG	On-Demand	Anodyne	TGM2	18	42
O=C(COc1ccc2ccc(=O)oc2c1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819336182	IF	On-Demand	Anodyne	MAOA	35	42
O=C(COc1ccc2ccc(=O)oc2c1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819336182	IF	On-Demand	Anodyne	MAOB	28	44
O=C(COc1ccc2ccc(=O)oc2c1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819336182	IF	On-Demand	Anodyne	CRTM	19	40
CSc1ccc([C@H](CNC(=O)CN(C)C(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819336183	HG	On-Demand	Anodyne	CAPN2	41	33
CSc1ccc([C@H](CNC(=O)CN(C)C(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819336183	HG	On-Demand	Anodyne	NPR	58	37
CSc1ccc([C@@H](CNC(=O)CN(C)C(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819336184	HG	On-Demand	Anodyne	CAPN2	41	33
CSc1ccc([C@@H](CNC(=O)CN(C)C(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819336184	HG	On-Demand	Anodyne	NPR	58	37
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@@H](O)c1ccc(Cl)cc1F	ZINC000819336203	HG	On-Demand	Anodyne	LEF	53	35
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)[C@H](O)c1ccc(Cl)cc1F	ZINC000819336204	HG	On-Demand	Anodyne	LEF	53	35
CSc1ccc([C@@H](CNC(=O)[C@@H](O)c2ccc(Cl)cc2)N(C)C)cc1	ZINC000819336218	GH	On-Demand	Anodyne	UTS2	43	34
CSc1ccc([C@@H](CNC(=O)[C@H](O)c2ccc(Cl)cc2)N(C)C)cc1	ZINC000819336219	GH	On-Demand	Anodyne	UTS2	43	34
CSc1ccc([C@H](CNC(=O)[C@@H](O)c2ccc(Cl)cc2)N(C)C)cc1	ZINC000819336220	GH	On-Demand	Anodyne	UTS2	43	34
CSc1ccc([C@H](CNC(=O)[C@H](O)c2ccc(Cl)cc2)N(C)C)cc1	ZINC000819336221	GH	On-Demand	Anodyne	UTS2	43	34
CSc1ccc([C@H](CNC(=O)/C(=C/c2ccco2)NC(=O)c2ccccc2)N(C)C)cc1	ZINC000819336222	II	On-Demand	Anodyne	ADAM12	37	43
CSc1ccc([C@H](CNC(=O)/C(=C\c2ccco2)NC(=O)c2ccccc2)N(C)C)cc1	ZINC000819336223	II	On-Demand	Anodyne	ADAM12	37	43
CSc1ccc([C@@H](CNC(=O)/C(=C\c2ccco2)NC(=O)c2ccccc2)N(C)C)cc1	ZINC000819336224	II	On-Demand	Anodyne	ADAM12	37	43
O=C(CCN[C@@H]1CCn2ccnc21)Nc1cccnc1	ZINC000819336235	CD	On-Demand	Anodyne	CHRNA7	55	42
O=C(CCN[C@H]1CCn2ccnc21)Nc1cccnc1	ZINC000819336236	CD	On-Demand	Anodyne	CHRNA7	55	42
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccccc1F	ZINC000819336267	CD	On-Demand	Anodyne	ADRB2	26	45
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccccc1F	ZINC000819336267	CD	On-Demand	Anodyne	ADRB3	19	45
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1F	ZINC000819336268	CD	On-Demand	Anodyne	ADRB2	26	45
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1F	ZINC000819336268	CD	On-Demand	Anodyne	ADRB3	19	45
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1F	ZINC000819336269	CD	On-Demand	Anodyne	ADRB2	26	45
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1F	ZINC000819336269	CD	On-Demand	Anodyne	ADRB3	19	45
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccccc1F	ZINC000819336270	CD	On-Demand	Anodyne	ADRB2	26	45
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccccc1F	ZINC000819336270	CD	On-Demand	Anodyne	ADRB3	19	45
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COCc3ccccc3F)[C@H]2C1	ZINC000819336305	GE	On-Demand	Anodyne	GPR119	15	48
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COCc3ccccc3F)[C@H]2C1	ZINC000819336306	GE	On-Demand	Anodyne	GPR119	15	48
Cc1nc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)sc1C	ZINC000819336307	FF	On-Demand	Mild	PAPA1_CARPA	45	50
Cc1nc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)sc1C	ZINC000819336308	FF	On-Demand	Mild	PAPA1_CARPA	45	50
Cn1cnc2cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc21	ZINC000819336317	FG	On-Demand	Mild	PAPA1_CARPA	36	40
Cn1cnc2cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc21	ZINC000819336318	FG	On-Demand	Mild	PAPA1_CARPA	36	40
CSc1ccc(OC[C@@H](O)CN[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)cc1	ZINC000819336335	GF	On-Demand	Anodyne	GPR119	21	41
CSc1ccc(OC[C@H](O)CN[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)cc1	ZINC000819336336	GF	On-Demand	Anodyne	GPR119	21	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCCc3c(F)cccc32)CC1	ZINC000819336337	GH	On-Demand	Anodyne	GPR119	39	52
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCCc3c(F)cccc32)CC1	ZINC000819336338	GH	On-Demand	Anodyne	GPR119	39	52
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCCc3c(F)cccc32)CC1	ZINC000819336339	GH	On-Demand	Anodyne	GPR119	39	52
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCCc3c(F)cccc32)CC1	ZINC000819336340	GH	On-Demand	Anodyne	GPR119	39	52
Cc1cc(Br)ncc1NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819336343	GI	On-Demand	Anodyne	FFAR1	42	35
O[C@@H](CNCCc1cnc2c(Cl)cnn2c1)c1ccc(Cl)cc1	ZINC000819336367	FF	On-Demand	Anodyne	ADRB2	18	42
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)c3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC000819336381	FE	On-Demand	Bother	CACNA1D	53	34
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)c3cccc([N+](=O)[O-])c3)[C@H]2C1	ZINC000819336382	FE	On-Demand	Bother	CACNA1D	53	34
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCC2CCOCC2)CC1	ZINC000819336383	FF	On-Demand	Anodyne	GPR119	27	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCC2CCOCC2)CC1	ZINC000819336384	FF	On-Demand	Anodyne	GPR119	27	44
CSc1ccc([C@@H](CNC(=O)/C(=C/c2ccco2)NC(=O)c2ccccc2)N(C)C)cc1	ZINC000819336425	II	On-Demand	Anodyne	ADAM12	37	43
CSc1ccc([C@@H](CNC(=O)[C@@H](F)C2CN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819336440	IG	On-Demand	Anodyne	GPR119	15	40
CSc1ccc([C@@H](CNC(=O)[C@H](F)C2CN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819336442	IG	On-Demand	Anodyne	GPR119	15	40
CSc1ccc([C@H](CNC(=O)[C@@H](F)C2CN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819336444	IG	On-Demand	Anodyne	GPR119	15	40
CSc1ccc([C@H](CNC(=O)[C@H](F)C2CN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819336445	IG	On-Demand	Anodyne	GPR119	15	40
N#CCSc1ccccc1C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819336447	HH	On-Demand	Mild	SLC6A5	20	41
CSc1ccc([C@@H](CNC(=O)[C@H](C)Cc2ccc(F)cc2)N(C)C)cc1	ZINC000819336500	FI	On-Demand	Anodyne	ACE	17	45
CSc1ccc([C@@H](CNC(=O)[C@H](C)Cc2ccc(F)cc2)N(C)C)cc1	ZINC000819336500	FI	On-Demand	Anodyne	MME	33	45
CSc1ccc([C@@H](CNC(=O)[C@H](C)Cc2ccc(F)cc2)N(C)C)cc1	ZINC000819336500	FI	On-Demand	Anodyne	ACE2	46	38
CSc1ccc([C@@H](CNC(=O)[C@@H](C)Cc2ccc(F)cc2)N(C)C)cc1	ZINC000819336501	FI	On-Demand	Anodyne	ACE	17	45
CSc1ccc([C@@H](CNC(=O)[C@@H](C)Cc2ccc(F)cc2)N(C)C)cc1	ZINC000819336501	FI	On-Demand	Anodyne	MME	33	45
CSc1ccc([C@@H](CNC(=O)[C@@H](C)Cc2ccc(F)cc2)N(C)C)cc1	ZINC000819336501	FI	On-Demand	Anodyne	ACE2	46	38
CSc1ccc([C@H](CNC(=O)[C@H](C)Cc2ccc(F)cc2)N(C)C)cc1	ZINC000819336503	FI	On-Demand	Anodyne	ACE	17	45
CSc1ccc([C@H](CNC(=O)[C@H](C)Cc2ccc(F)cc2)N(C)C)cc1	ZINC000819336503	FI	On-Demand	Anodyne	MME	33	45
CSc1ccc([C@H](CNC(=O)[C@H](C)Cc2ccc(F)cc2)N(C)C)cc1	ZINC000819336503	FI	On-Demand	Anodyne	ACE2	46	38
CSc1ccc([C@H](CNC(=O)[C@@H](C)Cc2ccc(F)cc2)N(C)C)cc1	ZINC000819336505	FI	On-Demand	Anodyne	ACE	17	45
CSc1ccc([C@H](CNC(=O)[C@@H](C)Cc2ccc(F)cc2)N(C)C)cc1	ZINC000819336505	FI	On-Demand	Anodyne	MME	33	45
CSc1ccc([C@H](CNC(=O)[C@@H](C)Cc2ccc(F)cc2)N(C)C)cc1	ZINC000819336505	FI	On-Demand	Anodyne	ACE2	46	38
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819336549	ED	On-Demand	Anodyne	ADRB2	31	40
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819336549	ED	On-Demand	Anodyne	ADRB1	52	39
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819336549	ED	On-Demand	Anodyne	ADRB3	36	41
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819336552	ED	On-Demand	Anodyne	ADRB2	31	40
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819336552	ED	On-Demand	Anodyne	ADRB1	52	39
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819336552	ED	On-Demand	Anodyne	ADRB3	36	41
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819336554	ED	On-Demand	Anodyne	ADRB2	31	40
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819336554	ED	On-Demand	Anodyne	ADRB1	52	39
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819336554	ED	On-Demand	Anodyne	ADRB3	36	41
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819336556	ED	On-Demand	Anodyne	ADRB2	31	40
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819336556	ED	On-Demand	Anodyne	ADRB1	52	39
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819336556	ED	On-Demand	Anodyne	ADRB3	36	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCn3ccnc32)CC1	ZINC000819336558	FD	On-Demand	Anodyne	GPR119	46	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCn3ccnc32)CC1	ZINC000819336560	FD	On-Demand	Anodyne	GPR119	46	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCn3ccnc32)CC1	ZINC000819336562	FD	On-Demand	Anodyne	GPR119	46	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCn3ccnc32)CC1	ZINC000819336564	FD	On-Demand	Anodyne	GPR119	46	42
O=S1(=O)C[C@H](CNC[C@H](O)c2cccc(Cl)c2)c2ccccc21	ZINC000819336566	FF	On-Demand	Anodyne	ADRB1	25	41
O=S1(=O)C[C@H](CNC[C@H](O)c2cccc(Cl)c2)c2ccccc21	ZINC000819336566	FF	On-Demand	Anodyne	ADRB3	39	41
O=S1(=O)C[C@@H](CNC[C@H](O)c2cccc(Cl)c2)c2ccccc21	ZINC000819336570	FF	On-Demand	Anodyne	ADRB1	25	41
O=S1(=O)C[C@@H](CNC[C@H](O)c2cccc(Cl)c2)c2ccccc21	ZINC000819336570	FF	On-Demand	Anodyne	ADRB3	39	41
O=S1(=O)C[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)c2ccccc21	ZINC000819336572	FF	On-Demand	Anodyne	ADRB1	25	41
O=S1(=O)C[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)c2ccccc21	ZINC000819336572	FF	On-Demand	Anodyne	ADRB3	39	41
O=S1(=O)C[C@H](CNC[C@@H](O)c2cccc(Cl)c2)c2ccccc21	ZINC000819336574	FF	On-Demand	Anodyne	ADRB1	25	41
O=S1(=O)C[C@H](CNC[C@@H](O)c2cccc(Cl)c2)c2ccccc21	ZINC000819336574	FF	On-Demand	Anodyne	ADRB3	39	41
O[C@@H](CNCC1=CCCCC1)c1cccc(Cl)c1	ZINC000819336584	CG	On-Demand	Anodyne	ADRB1	33	45
O[C@@H](CNCC1=CCCCC1)c1cccc(Cl)c1	ZINC000819336584	CG	On-Demand	Anodyne	ADRB3	52	45
O[C@H](CNCC1=CCCCC1)c1cccc(Cl)c1	ZINC000819336585	CG	On-Demand	Anodyne	ADRB1	33	45
O[C@H](CNCC1=CCCCC1)c1cccc(Cl)c1	ZINC000819336585	CG	On-Demand	Anodyne	ADRB3	52	45
CSc1ccc([C@H](CNC(=O)[C@H]2CSCN2C(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819336592	IG	On-Demand	Anodyne	CACNA1B	20	42
COc1cccc(OC)c1OC[C@H](O)CN[C@@H]1CCn2ccnc21	ZINC000819336594	ED	On-Demand	Anodyne	ADRB2	21	40
COc1cccc(OC)c1OC[C@H](O)CN[C@H]1CCn2ccnc21	ZINC000819336595	ED	On-Demand	Anodyne	ADRB2	21	40
CSc1ccc([C@@H](CNC(=O)[C@H]2CSCN2C(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819336596	IG	On-Demand	Anodyne	CACNA1B	20	42
COc1cccc(OC)c1OC[C@@H](O)CN[C@@H]1CCn2ccnc21	ZINC000819336597	ED	On-Demand	Anodyne	ADRB2	21	40
CSc1ccc([C@H](CNC(=O)[C@@H]2CSCN2C(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819336598	IG	On-Demand	Anodyne	CACNA1B	20	42
CSc1ccc([C@@H](CNC(=O)[C@@H]2CSCN2C(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819336599	IG	On-Demand	Anodyne	CACNA1B	20	42
COc1cccc(OC)c1OC[C@@H](O)CN[C@H]1CCn2ccnc21	ZINC000819336600	ED	On-Demand	Anodyne	ADRB2	21	40
COc1ccccc1/C(C)=C/C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819336601	HH	On-Demand	Anodyne	DRD3	15	40
COc1ccccc1/C(C)=C/C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819336601	HH	On-Demand	Anodyne	KCNA3	41	37
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3ccc4ccccc4c3)[C@H]2C1	ZINC000819336602	GG	On-Demand	Anodyne	ADRB2	35	52
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3ccc4ccccc4c3)[C@H]2C1	ZINC000819336602	GG	On-Demand	Anodyne	CASR	40	42
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3ccc4ccccc4c3)[C@H]2C1	ZINC000819336602	GG	On-Demand	Anodyne	ACOX1	49	36
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3ccc4ccccc4c3)[C@H]2C1	ZINC000819336602	GG	On-Demand	Anodyne	NR1H2	21	40
COc1ccccc1/C(C)=C\C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819336603	HH	On-Demand	Anodyne	DRD3	15	40
COc1ccccc1/C(C)=C\C(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819336603	HH	On-Demand	Anodyne	KCNA3	41	37
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3ccc4ccccc4c3)[C@H]2C1	ZINC000819336604	GG	On-Demand	Anodyne	ADRB2	35	52
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3ccc4ccccc4c3)[C@H]2C1	ZINC000819336604	GG	On-Demand	Anodyne	CASR	40	42
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3ccc4ccccc4c3)[C@H]2C1	ZINC000819336604	GG	On-Demand	Anodyne	ACOX1	49	36
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3ccc4ccccc4c3)[C@H]2C1	ZINC000819336604	GG	On-Demand	Anodyne	NR1H2	21	40
CSc1ccc([C@H](CNC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)N(C)C)cc1	ZINC000819336605	IG	On-Demand	Anodyne	ELANE	44	43
CSc1ccc([C@H](CNC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)N(C)C)cc1	ZINC000819336605	IG	On-Demand	Anodyne	LGMN	74	37
CSc1ccc([C@H](CNC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)N(C)C)cc1	ZINC000819336606	IG	On-Demand	Anodyne	ELANE	44	43
CSc1ccc([C@H](CNC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)N(C)C)cc1	ZINC000819336606	IG	On-Demand	Anodyne	LGMN	74	37
O[C@H](CN[C@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336607	DD	On-Demand	Anodyne	ADRB2	17	63
O[C@H](CN[C@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336607	DD	On-Demand	Anodyne	ADRB1	23	63
O[C@H](CN[C@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336607	DD	On-Demand	Anodyne	HTR1A	17	63
O[C@H](CN[C@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336607	DD	On-Demand	Anodyne	SLC6A4	21	44
O[C@H](CN[C@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336607	DD	On-Demand	Anodyne	ADRB3	15	52
CSc1ccc([C@@H](CNC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)N(C)C)cc1	ZINC000819336608	IG	On-Demand	Anodyne	ELANE	44	43
CSc1ccc([C@@H](CNC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)N(C)C)cc1	ZINC000819336608	IG	On-Demand	Anodyne	LGMN	74	37
O[C@H](CN[C@@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336609	DD	On-Demand	Anodyne	ADRB2	17	63
O[C@H](CN[C@@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336609	DD	On-Demand	Anodyne	ADRB1	23	63
O[C@H](CN[C@@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336609	DD	On-Demand	Anodyne	HTR1A	17	63
O[C@H](CN[C@@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336609	DD	On-Demand	Anodyne	SLC6A4	21	44
O[C@H](CN[C@@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336609	DD	On-Demand	Anodyne	ADRB3	15	52
CSc1ccc([C@@H](CNC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)N(C)C)cc1	ZINC000819336610	IG	On-Demand	Anodyne	ELANE	44	43
CSc1ccc([C@@H](CNC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)N(C)C)cc1	ZINC000819336610	IG	On-Demand	Anodyne	LGMN	74	37
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336611	DD	On-Demand	Anodyne	ADRB2	17	63
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336611	DD	On-Demand	Anodyne	ADRB1	23	63
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336611	DD	On-Demand	Anodyne	HTR1A	17	63
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336611	DD	On-Demand	Anodyne	SLC6A4	21	44
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336611	DD	On-Demand	Anodyne	ADRB3	15	52
O[C@@H](CN[C@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336613	DD	On-Demand	Anodyne	ADRB2	17	63
O[C@@H](CN[C@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336613	DD	On-Demand	Anodyne	ADRB1	23	63
O[C@@H](CN[C@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336613	DD	On-Demand	Anodyne	HTR1A	17	63
O[C@@H](CN[C@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336613	DD	On-Demand	Anodyne	SLC6A4	21	44
O[C@@H](CN[C@H]1CCn2ccnc21)COc1cccc2[nH]ccc12	ZINC000819336613	DD	On-Demand	Anodyne	ADRB3	15	52
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H]2CSc3ccccc32)CC1	ZINC000819336632	GG	On-Demand	Anodyne	GPR119	33	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2CSc3ccccc32)CC1	ZINC000819336633	GG	On-Demand	Anodyne	GPR119	33	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2CSc3ccccc32)CC1	ZINC000819336634	GG	On-Demand	Anodyne	GPR119	33	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H]2CSc3ccccc32)CC1	ZINC000819336635	GG	On-Demand	Anodyne	GPR119	33	45
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cnc3c(Cl)cnn3c2)c1	ZINC000819336638	FE	On-Demand	Bother	ADRB1	31	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cnc3c(Cl)cnn3c2)c1	ZINC000819336638	FE	On-Demand	Bother	ADRB3	70	41
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cnc3c(Cl)cnn3c2)c1	ZINC000819336639	FE	On-Demand	Bother	ADRB1	31	41
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cnc3c(Cl)cnn3c2)c1	ZINC000819336639	FE	On-Demand	Bother	ADRB3	70	41
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NCCS(=O)(=O)c3ccc(C#N)cn3)[C@H]2C1	ZINC000819336668	GD	On-Demand	Mild	GPR119	32	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1)C2	ZINC000819336733	GG	On-Demand	Mild	LGMN	46	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1)C2	ZINC000819336734	GG	On-Demand	Mild	LGMN	46	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1)C2	ZINC000819336735	GG	On-Demand	Mild	LGMN	46	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1)C2	ZINC000819336736	GG	On-Demand	Mild	LGMN	46	35
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3ccccc3Cl)[C@H]2C1	ZINC000819336775	GF	On-Demand	Anodyne	ADRB2	21	45
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3ccccc3Cl)[C@H]2C1	ZINC000819336775	GF	On-Demand	Anodyne	ABCB1	34	45
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3ccccc3Cl)[C@H]2C1	ZINC000819336776	GF	On-Demand	Anodyne	ADRB2	21	45
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3ccccc3Cl)[C@H]2C1	ZINC000819336776	GF	On-Demand	Anodyne	ABCB1	34	45
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccc(Cl)c(Cl)c1	ZINC000819336789	EF	On-Demand	Anodyne	HRH1	15	44
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccc(Cl)c(Cl)c1	ZINC000819336789	EF	On-Demand	Anodyne	CCR3	16	47
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccc(Cl)c(Cl)c1	ZINC000819336790	EF	On-Demand	Anodyne	HRH1	15	44
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccc(Cl)c(Cl)c1	ZINC000819336790	EF	On-Demand	Anodyne	CCR3	16	47
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccc(Cl)c(Cl)c1	ZINC000819336791	EF	On-Demand	Anodyne	HRH1	15	44
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccc(Cl)c(Cl)c1	ZINC000819336791	EF	On-Demand	Anodyne	CCR3	16	47
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccc(Cl)c(Cl)c1	ZINC000819336792	EF	On-Demand	Anodyne	HRH1	15	44
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccc(Cl)c(Cl)c1	ZINC000819336792	EF	On-Demand	Anodyne	CCR3	16	47
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)NC(C2CC2)C2CC2)c1	ZINC000819336812	HH	On-Demand	Anodyne	HCN1	48	33
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)NC(C2CC2)C2CC2)c1	ZINC000819336812	HH	On-Demand	Anodyne	HCN4	42	33
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)NC(C2CC2)C2CC2)c1	ZINC000819336812	HH	On-Demand	Anodyne	KCNK3	39	42
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)NC(C2CC2)C2CC2)c1	ZINC000819336812	HH	On-Demand	Anodyne	KCNK9	38	42
CSc1ccc([C@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2F)N(C)C)cc1	ZINC000819336826	HE	On-Demand	Anodyne	CA2	44	47
CSc1ccc([C@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2F)N(C)C)cc1	ZINC000819336826	HE	On-Demand	Anodyne	CA4	36	46
CSc1ccc([C@@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2F)N(C)C)cc1	ZINC000819336827	HE	On-Demand	Anodyne	CA2	44	47
CSc1ccc([C@@H](CNC(=O)c2cc(S(N)(=O)=O)ccc2F)N(C)C)cc1	ZINC000819336827	HE	On-Demand	Anodyne	CA4	36	46
CSc1ccc([C@H](CNC(=O)[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819336828	HH	On-Demand	Anodyne	FPR1	40	35
CSc1ccc([C@H](CNC(=O)[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819336829	HH	On-Demand	Anodyne	FPR1	40	35
CSc1ccc([C@H](CNC(=O)[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819336830	HH	On-Demand	Anodyne	FPR1	40	35
CSc1ccc([C@H](CNC(=O)[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819336831	HH	On-Demand	Anodyne	FPR1	40	35
CSc1ccc([C@H](CNC(=O)[C@H](C)C2CN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819336848	HH	On-Demand	Anodyne	GPR119	16	41
CSc1ccc([C@@H](CNC(=O)[C@H](C)C2CN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819336849	HH	On-Demand	Anodyne	GPR119	16	41
CSc1ccc([C@@H](CNC(=O)[C@@H](C)C2CN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819336850	HH	On-Demand	Anodyne	GPR119	16	41
CSc1ccc([C@H](CNC(=O)[C@@H](C)C2CN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819336851	HH	On-Demand	Anodyne	GPR119	16	41
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)c1ccc(-n2cccn2)nc1	ZINC000819336875	HF	On-Demand	Anodyne	TBXAS1	32	41
N#CCOc1cccc(CC(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819336896	HF	On-Demand	Mild	HRH2	25	40
N#CCOc1cccc(CC(=O)NCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819336896	HF	On-Demand	Mild	CRTM	41	45
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819336897	IF	On-Demand	Anodyne	TBXAS1	45	39
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819336897	IF	On-Demand	Anodyne	EPHX2	19	42
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819336897	IF	On-Demand	Anodyne	SFRP1	24	43
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819336897	IF	On-Demand	Anodyne	NAMPT	70	45
CSc1ccc([C@H](CNC(=O)c2cccc(CNC(=O)OC(C)(C)C)c2)N(C)C)cc1	ZINC000819336912	II	On-Demand	Anodyne	PDS	41	32
CSc1ccc([C@@H](CNC(=O)c2cccc(CNC(=O)OC(C)(C)C)c2)N(C)C)cc1	ZINC000819336913	II	On-Demand	Anodyne	PDS	41	32
CCCCCCC(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819336915	DI	On-Demand	Anodyne	ENPP2	28	40
CCCCCCC(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819336915	DI	On-Demand	Anodyne	NOD1	44	35
CCCCCCC(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819336915	DI	On-Demand	Anodyne	CQSS	49	30
CCCCCCC(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819336916	DI	On-Demand	Anodyne	ENPP2	28	40
CCCCCCC(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819336916	DI	On-Demand	Anodyne	NOD1	44	35
CCCCCCC(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819336916	DI	On-Demand	Anodyne	CQSS	49	30
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)c3cc(F)ccc3F)[C@H]2C1	ZINC000819336932	FE	On-Demand	Anodyne	GPR119	28	47
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)c3cc(F)ccc3F)[C@H]2C1	ZINC000819336933	FE	On-Demand	Anodyne	GPR119	28	47
CS(=O)(=O)c1ccc([C@@H](O)CNCCc2cnc3c(Cl)cnn3c2)cc1	ZINC000819336962	GD	On-Demand	Anodyne	ADRB3	105	41
CS(=O)(=O)c1ccc([C@H](O)CNCCc2cnc3c(Cl)cnn3c2)cc1	ZINC000819336963	GD	On-Demand	Anodyne	ADRB3	105	41
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)[C@H]2C1	ZINC000819336992	GD	On-Demand	Anodyne	GPR119	53	49
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)c3ccc(S(C)(=O)=O)cc3)[C@H]2C1	ZINC000819336993	GD	On-Demand	Anodyne	GPR119	53	49
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)c3ccc(Cl)cc3)[C@H]2C1	ZINC000819337012	FF	On-Demand	Anodyne	ADRB3	17	40
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCCCC2CCOCC2)CC1	ZINC000819337014	FF	On-Demand	Anodyne	GPR119	17	42
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCCCC2CCOCC2)CC1	ZINC000819337015	FF	On-Demand	Anodyne	GPR119	17	42
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1	ZINC000819337018	CD	On-Demand	Anodyne	ADRB2	38	47
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1	ZINC000819337018	CD	On-Demand	Anodyne	ADRB1	55	47
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1	ZINC000819337018	CD	On-Demand	Anodyne	ADRB3	43	47
O[C@@H](CNCCc1cnc2c(Cl)cnn2c1)c1ccc(F)cc1	ZINC000819337019	EE	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccccc1	ZINC000819337020	CD	On-Demand	Anodyne	ADRB2	38	47
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccccc1	ZINC000819337020	CD	On-Demand	Anodyne	ADRB1	55	47
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccccc1	ZINC000819337020	CD	On-Demand	Anodyne	ADRB3	43	47
O[C@H](CNCCc1cnc2c(Cl)cnn2c1)c1ccc(F)cc1	ZINC000819337021	EE	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccccc1	ZINC000819337022	CD	On-Demand	Anodyne	ADRB2	38	47
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccccc1	ZINC000819337022	CD	On-Demand	Anodyne	ADRB1	55	47
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccccc1	ZINC000819337022	CD	On-Demand	Anodyne	ADRB3	43	47
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1	ZINC000819337024	CD	On-Demand	Anodyne	ADRB2	38	47
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1	ZINC000819337024	CD	On-Demand	Anodyne	ADRB1	55	47
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1	ZINC000819337024	CD	On-Demand	Anodyne	ADRB3	43	47
C[C@@H](NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)c1nc[nH]n1	ZINC000819337077	GH	On-Demand	Anodyne	REN	67	41
COc1ccc(OC)c([C@H](O)CNCCc2cnc3c(Cl)cnn3c2)c1	ZINC000819337080	GE	On-Demand	Anodyne	ADRB2	19	45
C[C@@H](NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C)c1nc[nH]n1	ZINC000819337083	GH	On-Demand	Anodyne	REN	67	41
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccccc1Cl	ZINC000819337099	DE	On-Demand	Anodyne	ADRB2	27	43
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccccc1Cl	ZINC000819337099	DE	On-Demand	Anodyne	ADRB1	21	43
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccccc1Cl	ZINC000819337099	DE	On-Demand	Anodyne	ADRB3	18	40
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1Cl	ZINC000819337101	DE	On-Demand	Anodyne	ADRB2	27	43
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1Cl	ZINC000819337101	DE	On-Demand	Anodyne	ADRB1	21	43
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1Cl	ZINC000819337101	DE	On-Demand	Anodyne	ADRB3	18	40
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1Cl	ZINC000819337102	DE	On-Demand	Anodyne	ADRB2	27	43
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1Cl	ZINC000819337102	DE	On-Demand	Anodyne	ADRB1	21	43
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccccc1Cl	ZINC000819337102	DE	On-Demand	Anodyne	ADRB3	18	40
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccccc1Cl	ZINC000819337104	DE	On-Demand	Anodyne	ADRB2	27	43
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccccc1Cl	ZINC000819337104	DE	On-Demand	Anodyne	ADRB1	21	43
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccccc1Cl	ZINC000819337104	DE	On-Demand	Anodyne	ADRB3	18	40
Cc1c(Br)cccc1CC(=O)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819337126	IH	On-Demand	Anodyne	CA9	26	43
O=C(NCCCS(=O)(=O)c1ccc(Cl)cc1)C(O)(c1ccccc1)c1ccccc1	ZINC000819337131	IH	On-Demand	Anodyne	TBXA2R	41	36
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819337132	HG	On-Demand	Bother	MMP8	19	41
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819337132	HG	On-Demand	Bother	MMP1	15	41
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819337133	HG	On-Demand	Bother	MMP8	19	41
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)NCCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819337133	HG	On-Demand	Bother	MMP1	15	41
CSc1ccc([C@H](CNC(=O)C2CCN(C(=O)OCC(C)C)CC2)N(C)C)cc1	ZINC000819337134	HH	On-Demand	Anodyne	GPR119	18	40
CSc1ccc([C@@H](CNC(=O)C2CCN(C(=O)OCC(C)C)CC2)N(C)C)cc1	ZINC000819337136	HH	On-Demand	Anodyne	GPR119	18	40
CSc1ccc([C@@H](CNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337177	IH	On-Demand	Anodyne	F2	46	38
CSc1ccc([C@@H](CNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337177	IH	On-Demand	Anodyne	FKBP1A	31	42
CSc1ccc([C@@H](CNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337177	IH	On-Demand	Anodyne	PREP	42	44
CSc1ccc([C@@H](CNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337177	IH	On-Demand	Anodyne	XIAP	36	41
CSc1ccc([C@@H](CNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337177	IH	On-Demand	Anodyne	TMPRSS11D	63	34
CSc1ccc([C@@H](CNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337178	IH	On-Demand	Anodyne	F2	46	38
CSc1ccc([C@@H](CNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337178	IH	On-Demand	Anodyne	FKBP1A	31	42
CSc1ccc([C@@H](CNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337178	IH	On-Demand	Anodyne	PREP	42	44
CSc1ccc([C@@H](CNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337178	IH	On-Demand	Anodyne	XIAP	36	41
CSc1ccc([C@@H](CNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337178	IH	On-Demand	Anodyne	TMPRSS11D	63	34
CSc1ccc([C@H](CNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337179	IH	On-Demand	Anodyne	F2	46	38
CSc1ccc([C@H](CNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337179	IH	On-Demand	Anodyne	FKBP1A	31	42
CSc1ccc([C@H](CNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337179	IH	On-Demand	Anodyne	PREP	42	44
CSc1ccc([C@H](CNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337179	IH	On-Demand	Anodyne	XIAP	36	41
CSc1ccc([C@H](CNC(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337179	IH	On-Demand	Anodyne	TMPRSS11D	63	34
CSc1ccc([C@H](CNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337180	IH	On-Demand	Anodyne	F2	46	38
CSc1ccc([C@H](CNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337180	IH	On-Demand	Anodyne	FKBP1A	31	42
CSc1ccc([C@H](CNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337180	IH	On-Demand	Anodyne	PREP	42	44
CSc1ccc([C@H](CNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337180	IH	On-Demand	Anodyne	XIAP	36	41
CSc1ccc([C@H](CNC(=O)[C@H]2CCCCN2C(=O)c2ccccc2)N(C)C)cc1	ZINC000819337180	IH	On-Demand	Anodyne	TMPRSS11D	63	34
CSc1ccc([C@H](CNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)N(C)C)cc1	ZINC000819337189	HH	On-Demand	Anodyne	GPR119	47	52
CSc1ccc([C@@H](CNC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)N(C)C)cc1	ZINC000819337190	HH	On-Demand	Anodyne	GPR119	47	52
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819337196	GG	On-Demand	Anodyne	PAPA1_CARPA	40	41
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000819337196	GG	On-Demand	Anodyne	FPR1	45	37
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819337198	GG	On-Demand	Anodyne	PAPA1_CARPA	40	41
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000819337198	GG	On-Demand	Anodyne	FPR1	45	37
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NCCS(=O)(=O)c3cccc(C#N)c3)[C@H]2C1	ZINC000819337223	GD	On-Demand	Mild	NR1H2	17	44
C[C@@](O)(CNC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F)c1cccs1	ZINC000819337228	FH	On-Demand	Anodyne	CHRM1	23	41
CC(C)(C)OC(=O)N1CCC[C@](O)(CNC[C@H]2CSc3ccccc32)CC1	ZINC000819337257	GH	On-Demand	Anodyne	GHRHR	48	31
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNC[C@@H]2CSc3ccccc32)CC1	ZINC000819337258	GH	On-Demand	Anodyne	GHRHR	48	31
CC(C)(C)OC(=O)N1CCC[C@](O)(CNC[C@@H]2CSc3ccccc32)CC1	ZINC000819337259	GH	On-Demand	Anodyne	GHRHR	48	31
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNC[C@H]2CSc3ccccc32)CC1	ZINC000819337260	GH	On-Demand	Anodyne	GHRHR	48	31
O[C@@H](CNCCc1cnc2c(Cl)cnn2c1)c1ccccc1	ZINC000819337265	DE	On-Demand	Anodyne	ADRB2	36	47
O[C@@H](CNCCc1cnc2c(Cl)cnn2c1)c1ccccc1	ZINC000819337265	DE	On-Demand	Anodyne	ADRB1	48	41
O[C@@H](CNCCc1cnc2c(Cl)cnn2c1)c1ccccc1	ZINC000819337265	DE	On-Demand	Anodyne	ADRB3	95	43
O[C@H](CNCCc1cnc2c(Cl)cnn2c1)c1ccccc1	ZINC000819337266	DE	On-Demand	Anodyne	ADRB2	36	47
O[C@H](CNCCc1cnc2c(Cl)cnn2c1)c1ccccc1	ZINC000819337266	DE	On-Demand	Anodyne	ADRB1	48	41
O[C@H](CNCCc1cnc2c(Cl)cnn2c1)c1ccccc1	ZINC000819337266	DE	On-Demand	Anodyne	ADRB3	95	43
O[C@@H](CNC[C@H]1CSc2ccccc21)c1cccc(Cl)c1	ZINC000819337277	DH	On-Demand	Anodyne	ADRB1	29	42
O[C@@H](CNC[C@H]1CSc2ccccc21)c1cccc(Cl)c1	ZINC000819337277	DH	On-Demand	Anodyne	ADRB3	43	44
O[C@@H](CNC[C@@H]1CSc2ccccc21)c1cccc(Cl)c1	ZINC000819337278	DH	On-Demand	Anodyne	ADRB1	29	42
O[C@@H](CNC[C@@H]1CSc2ccccc21)c1cccc(Cl)c1	ZINC000819337278	DH	On-Demand	Anodyne	ADRB3	43	44
O[C@H](CNC[C@@H]1CSc2ccccc21)c1cccc(Cl)c1	ZINC000819337279	DH	On-Demand	Anodyne	ADRB1	29	42
O[C@H](CNC[C@@H]1CSc2ccccc21)c1cccc(Cl)c1	ZINC000819337279	DH	On-Demand	Anodyne	ADRB3	43	44
O[C@H](CNC[C@H]1CSc2ccccc21)c1cccc(Cl)c1	ZINC000819337280	DH	On-Demand	Anodyne	ADRB1	29	42
O[C@H](CNC[C@H]1CSc2ccccc21)c1cccc(Cl)c1	ZINC000819337280	DH	On-Demand	Anodyne	ADRB3	43	44
O[C@@H](CNCCCC1CCOCC1)c1ccccc1	ZINC000819337292	CF	On-Demand	Anodyne	ADRB3	33	45
O[C@H](CNCCCC1CCOCC1)c1ccccc1	ZINC000819337293	CF	On-Demand	Anodyne	ADRB3	33	45
O=C(CCN[C@@H]1CCn2ccnc21)Nc1cccc(C(F)(F)F)c1	ZINC000819337294	EF	On-Demand	Anodyne	KDR	18	41
O=C(CCN[C@@H]1CCn2ccnc21)Nc1cccc(C(F)(F)F)c1	ZINC000819337294	EF	On-Demand	Anodyne	CCR2	52	38
O=C(CCN[C@@H]1CCn2ccnc21)Nc1cccc(C(F)(F)F)c1	ZINC000819337294	EF	On-Demand	Anodyne	EPHX2	20	46
O[C@@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccnc1	ZINC000819337295	DD	On-Demand	Anodyne	ADRB2	35	47
O[C@@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccnc1	ZINC000819337295	DD	On-Demand	Anodyne	ADRB1	44	47
O[C@@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccnc1	ZINC000819337295	DD	On-Demand	Anodyne	ADRB3	126	49
O[C@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccnc1	ZINC000819337296	DD	On-Demand	Anodyne	ADRB2	35	47
O[C@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccnc1	ZINC000819337296	DD	On-Demand	Anodyne	ADRB1	44	47
O[C@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccnc1	ZINC000819337296	DD	On-Demand	Anodyne	ADRB3	126	49
O=C(CCN[C@H]1CCn2ccnc21)Nc1cccc(C(F)(F)F)c1	ZINC000819337298	EF	On-Demand	Anodyne	KDR	18	41
O=C(CCN[C@H]1CCn2ccnc21)Nc1cccc(C(F)(F)F)c1	ZINC000819337298	EF	On-Demand	Anodyne	CCR2	52	38
O=C(CCN[C@H]1CCn2ccnc21)Nc1cccc(C(F)(F)F)c1	ZINC000819337298	EF	On-Demand	Anodyne	EPHX2	20	46
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3ccc(C#N)cc3)[C@H]2C1	ZINC000819337314	FD	On-Demand	Mild	GPR119	20	46
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3ccc(C#N)cc3)[C@H]2C1	ZINC000819337315	FD	On-Demand	Mild	GPR119	20	46
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819337341	ED	On-Demand	Anodyne	ADRB2	36	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819337341	ED	On-Demand	Anodyne	ADRB1	71	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819337341	ED	On-Demand	Anodyne	ADRB3	49	45
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819337342	ED	On-Demand	Anodyne	ADRB2	36	51
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819337342	ED	On-Demand	Anodyne	ADRB1	71	51
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819337342	ED	On-Demand	Anodyne	ADRB3	49	45
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819337343	ED	On-Demand	Anodyne	ADRB2	36	51
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819337343	ED	On-Demand	Anodyne	ADRB1	71	51
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819337343	ED	On-Demand	Anodyne	ADRB3	49	45
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819337344	ED	On-Demand	Anodyne	ADRB2	36	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819337344	ED	On-Demand	Anodyne	ADRB1	71	51
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819337344	ED	On-Demand	Anodyne	ADRB3	49	45
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccc(Oc2ccccc2)cc1	ZINC000819337364	FG	On-Demand	Anodyne	ADRB2	36	44
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccc(Oc2ccccc2)cc1	ZINC000819337364	FG	On-Demand	Anodyne	ADRB1	53	44
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccc(Oc2ccccc2)cc1	ZINC000819337364	FG	On-Demand	Anodyne	ADRB3	41	44
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccc(Oc2ccccc2)cc1	ZINC000819337365	FG	On-Demand	Anodyne	ADRB2	36	44
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccc(Oc2ccccc2)cc1	ZINC000819337365	FG	On-Demand	Anodyne	ADRB1	53	44
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccc(Oc2ccccc2)cc1	ZINC000819337365	FG	On-Demand	Anodyne	ADRB3	41	44
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccc(Oc2ccccc2)cc1	ZINC000819337366	FG	On-Demand	Anodyne	ADRB2	36	44
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccc(Oc2ccccc2)cc1	ZINC000819337366	FG	On-Demand	Anodyne	ADRB1	53	44
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccc(Oc2ccccc2)cc1	ZINC000819337366	FG	On-Demand	Anodyne	ADRB3	41	44
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccc(Oc2ccccc2)cc1	ZINC000819337367	FG	On-Demand	Anodyne	ADRB2	36	44
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccc(Oc2ccccc2)cc1	ZINC000819337367	FG	On-Demand	Anodyne	ADRB1	53	44
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccc(Oc2ccccc2)cc1	ZINC000819337367	FG	On-Demand	Anodyne	ADRB3	41	44
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)c3ccc(F)cc3F)[C@H]2C1	ZINC000819337405	FE	On-Demand	Anodyne	GPR119	27	45
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)c3ccc(F)cc3F)[C@H]2C1	ZINC000819337406	FE	On-Demand	Anodyne	GPR119	27	45
O[C@@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccc(Cl)c1	ZINC000819337443	FF	On-Demand	Anodyne	ADRB2	43	39
O[C@@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccc(Cl)c1	ZINC000819337443	FF	On-Demand	Anodyne	ADRB1	55	52
O[C@@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccc(Cl)c1	ZINC000819337443	FF	On-Demand	Anodyne	ADRB3	92	52
O[C@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccc(Cl)c1	ZINC000819337444	FF	On-Demand	Anodyne	ADRB2	43	39
O[C@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccc(Cl)c1	ZINC000819337444	FF	On-Demand	Anodyne	ADRB1	55	52
O[C@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccc(Cl)c1	ZINC000819337444	FF	On-Demand	Anodyne	ADRB3	92	52
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NCCS(=O)(=O)c3ccc(F)cc3)[C@H]2C1	ZINC000819337470	GE	On-Demand	Anodyne	GPR119	44	39
O[C@@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccc(Br)c1	ZINC000819337597	GG	On-Demand	Anodyne	ADRB1	29	42
O[C@@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccc(Br)c1	ZINC000819337597	GG	On-Demand	Anodyne	ADRB3	58	42
O[C@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccc(Br)c1	ZINC000819337598	GG	On-Demand	Anodyne	ADRB1	29	42
O[C@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccc(Br)c1	ZINC000819337598	GG	On-Demand	Anodyne	ADRB3	58	42
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)Cc3cccc(Cl)c3)[C@H]2C1	ZINC000819337599	FF	On-Demand	Anodyne	GPR119	15	40
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)Cc3cccc(Cl)c3)[C@H]2C1	ZINC000819337600	FF	On-Demand	Anodyne	GPR119	15	40
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NCCS(=O)(=O)c3ccc(C#N)cc3)[C@H]2C1	ZINC000819337609	GD	On-Demand	Mild	GPR119	37	41
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)c3ccc(F)cc3Cl)[C@H]2C1	ZINC000819337612	FF	On-Demand	Anodyne	GPR119	20	42
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)c3ccc(F)cc3Cl)[C@H]2C1	ZINC000819337613	FF	On-Demand	Anodyne	GPR119	20	42
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3cccc4[nH]ccc34)[C@H]2C1	ZINC000819337631	GE	On-Demand	Anodyne	ADRB2	20	57
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3cccc4[nH]ccc34)[C@H]2C1	ZINC000819337631	GE	On-Demand	Anodyne	ADRB1	25	57
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3cccc4[nH]ccc34)[C@H]2C1	ZINC000819337631	GE	On-Demand	Anodyne	HTR1A	15	58
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3cccc4[nH]ccc34)[C@H]2C1	ZINC000819337631	GE	On-Demand	Anodyne	SSTR2	40	34
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3cccc4[nH]ccc34)[C@H]2C1	ZINC000819337631	GE	On-Demand	Anodyne	SLC6A4	18	40
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3cccc4[nH]ccc34)[C@H]2C1	ZINC000819337632	GE	On-Demand	Anodyne	ADRB2	20	57
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3cccc4[nH]ccc34)[C@H]2C1	ZINC000819337632	GE	On-Demand	Anodyne	ADRB1	25	57
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3cccc4[nH]ccc34)[C@H]2C1	ZINC000819337632	GE	On-Demand	Anodyne	HTR1A	15	58
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3cccc4[nH]ccc34)[C@H]2C1	ZINC000819337632	GE	On-Demand	Anodyne	SSTR2	40	34
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3cccc4[nH]ccc34)[C@H]2C1	ZINC000819337632	GE	On-Demand	Anodyne	SLC6A4	18	40
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)c3cccc4ccccc34)[C@H]2C1	ZINC000819337664	FG	On-Demand	Anodyne	SSTR2	42	34
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)NC(C1CC1)C1CC1	ZINC000819337671	FD	On-Demand	Anodyne	SMO	15	40
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)NC(C1CC1)C1CC1	ZINC000819337672	FD	On-Demand	Anodyne	SMO	15	40
O[C@@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccc(F)c1	ZINC000819337697	EE	On-Demand	Anodyne	ADRB1	30	42
O[C@@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccc(F)c1	ZINC000819337697	EE	On-Demand	Anodyne	ADRB3	71	42
O[C@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccc(F)c1	ZINC000819337698	EE	On-Demand	Anodyne	ADRB1	30	42
O[C@H](CNCCc1cnc2c(Cl)cnn2c1)c1cccc(F)c1	ZINC000819337698	EE	On-Demand	Anodyne	ADRB3	71	42
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)c3cccc(C(F)(F)F)c3)[C@H]2C1	ZINC000819337722	GG	On-Demand	Anodyne	CCR2	54	36
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)c3cccc(C(F)(F)F)c3)[C@H]2C1	ZINC000819337723	GG	On-Demand	Anodyne	CCR2	54	36
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)c3cccc(Cl)c3)[C@H]2C1	ZINC000819337730	FF	On-Demand	Anodyne	ADRB1	31	43
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)c3cccc(Cl)c3)[C@H]2C1	ZINC000819337730	FF	On-Demand	Anodyne	ADRB3	51	44
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)c3cccc(Cl)c3)[C@H]2C1	ZINC000819337730	FF	On-Demand	Anodyne	CYP3A4	48	36
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)c3cccc(Cl)c3)[C@H]2C1	ZINC000819337731	FF	On-Demand	Anodyne	ADRB1	31	43
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)c3cccc(Cl)c3)[C@H]2C1	ZINC000819337731	FF	On-Demand	Anodyne	ADRB3	51	44
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)c3cccc(Cl)c3)[C@H]2C1	ZINC000819337731	FF	On-Demand	Anodyne	CYP3A4	48	36
Cc1cc([C@@](C)(O)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)o1	ZINC000819337745	GF	On-Demand	Mild	PAPA1_CARPA	45	47
Cc1cc([C@@](C)(O)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)o1	ZINC000819337748	GF	On-Demand	Mild	PAPA1_CARPA	45	47
O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@H]1CCn2ccnc21	ZINC000819337785	DD	On-Demand	Bother	ADRB2	18	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@@H]1CCn2ccnc21	ZINC000819337786	DD	On-Demand	Bother	ADRB2	18	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CN[C@H]1CCn2ccnc21	ZINC000819337787	DD	On-Demand	Bother	ADRB2	18	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CN[C@@H]1CCn2ccnc21	ZINC000819337788	DD	On-Demand	Bother	ADRB2	18	40
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3ccccc3F)[C@H]2C1	ZINC000819337803	FE	On-Demand	Anodyne	ADRB2	23	40
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3ccccc3F)[C@H]2C1	ZINC000819337803	FE	On-Demand	Anodyne	ABCB1	33	46
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3ccccc3F)[C@H]2C1	ZINC000819337803	FE	On-Demand	Anodyne	GPR119	27	46
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3ccccc3F)[C@H]2C1	ZINC000819337804	FE	On-Demand	Anodyne	ADRB2	23	40
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3ccccc3F)[C@H]2C1	ZINC000819337804	FE	On-Demand	Anodyne	ABCB1	33	46
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3ccccc3F)[C@H]2C1	ZINC000819337804	FE	On-Demand	Anodyne	GPR119	27	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)nn1	ZINC000819337829	GD	On-Demand	Anodyne	CTSD	65	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)nn1	ZINC000819337829	GD	On-Demand	Anodyne	PGC	55	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)nn1	ZINC000819337829	GD	On-Demand	Anodyne	PAPA1_CARPA	32	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)nn1	ZINC000819337829	GD	On-Demand	Anodyne	TACR3	15	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)nn1	ZINC000819337829	GD	On-Demand	Anodyne	REN	77	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)nn1	ZINC000819337829	GD	On-Demand	Anodyne	REN1	21	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)nn1	ZINC000819337829	GD	On-Demand	Anodyne	BACE1	66	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccc(O)nn1	ZINC000819337829	GD	On-Demand	Anodyne	FPR1	48	39
O[C@@H](CNCC1=CCCCC1)c1cccnc1	ZINC000819337832	BE	On-Demand	Anodyne	ADRB2	23	41
O[C@@H](CNCC1=CCCCC1)c1cccnc1	ZINC000819337832	BE	On-Demand	Anodyne	ADRB1	24	42
O[C@@H](CNCC1=CCCCC1)c1cccnc1	ZINC000819337832	BE	On-Demand	Anodyne	ADRB3	95	44
O[C@H](CNCC1=CCCCC1)c1cccnc1	ZINC000819337833	BE	On-Demand	Anodyne	ADRB2	23	41
O[C@H](CNCC1=CCCCC1)c1cccnc1	ZINC000819337833	BE	On-Demand	Anodyne	ADRB1	24	42
O[C@H](CNCC1=CCCCC1)c1cccnc1	ZINC000819337833	BE	On-Demand	Anodyne	ADRB3	95	44
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819337853	CD	On-Demand	Anodyne	ADRB2	30	46
Cc1ccc(OC[C@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819337854	CD	On-Demand	Anodyne	ADRB2	30	46
Cc1ccc(OC[C@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819337855	CD	On-Demand	Anodyne	ADRB2	30	46
Cc1ccc(OC[C@@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819337856	CD	On-Demand	Anodyne	ADRB2	30	46
CC(=O)Nc1cccc(CC(=O)NC[C@](C)(O)c2ccco2)c1	ZINC000819337867	DD	On-Demand	Anodyne	KCNK3	20	40
CC(=O)Nc1cccc(CC(=O)NC[C@@](C)(O)c2ccco2)c1	ZINC000819337868	DD	On-Demand	Anodyne	KCNK3	20	40
CC(=O)c1ccc(OC[C@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819337879	DD	On-Demand	Anodyne	ADRB1	43	37
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2CCn3ccnc32)cc1	ZINC000819337880	DD	On-Demand	Anodyne	ADRB1	43	37
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819337881	DD	On-Demand	Anodyne	ADRB1	43	37
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2CCn3ccnc32)cc1	ZINC000819337882	DD	On-Demand	Anodyne	ADRB1	43	37
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)c1	ZINC000819337924	GE	On-Demand	Anodyne	ADRB2	16	42
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)c1	ZINC000819337924	GE	On-Demand	Anodyne	ABCB1	18	46
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)c1	ZINC000819337925	GE	On-Demand	Anodyne	ADRB2	16	42
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)c1	ZINC000819337925	GE	On-Demand	Anodyne	ABCB1	18	46
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3cccc4ccccc34)[C@H]2C1	ZINC000819337953	GG	On-Demand	Anodyne	ADRB2	32	51
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3cccc4ccccc34)[C@H]2C1	ZINC000819337953	GG	On-Demand	Anodyne	ADRB1	30	51
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3cccc4ccccc34)[C@H]2C1	ZINC000819337953	GG	On-Demand	Anodyne	ADRB3	17	51
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3cccc4ccccc34)[C@H]2C1	ZINC000819337953	GG	On-Demand	Anodyne	CYP2D6	16	43
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3cccc4ccccc34)[C@H]2C1	ZINC000819337953	GG	On-Demand	Anodyne	ABCB1	37	44
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3cccc4ccccc34)[C@H]2C1	ZINC000819337954	GG	On-Demand	Anodyne	ADRB2	32	51
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3cccc4ccccc34)[C@H]2C1	ZINC000819337954	GG	On-Demand	Anodyne	ADRB1	30	51
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3cccc4ccccc34)[C@H]2C1	ZINC000819337954	GG	On-Demand	Anodyne	ADRB3	17	51
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3cccc4ccccc34)[C@H]2C1	ZINC000819337954	GG	On-Demand	Anodyne	CYP2D6	16	43
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3cccc4ccccc34)[C@H]2C1	ZINC000819337954	GG	On-Demand	Anodyne	ABCB1	37	44
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NCCC(=O)Nc3ccccc3F)[C@H]2C1	ZINC000819337991	FF	On-Demand	Anodyne	GPR119	22	41
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3ccc4c(c3)OCO4)[C@H]2C1	ZINC000819337994	GD	On-Demand	Anodyne	BMP1	16	40
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3ccc4c(c3)OCO4)[C@H]2C1	ZINC000819337995	GD	On-Demand	Anodyne	BMP1	16	40
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)c3ccccc3C(F)(F)F)[C@H]2C1	ZINC000819338023	GG	On-Demand	Anodyne	RBP4	48	34
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)c3ccccc3C(F)(F)F)[C@H]2C1	ZINC000819338024	GG	On-Demand	Anodyne	RBP4	48	34
Cc1ccc(OC[C@H](O)CN[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)cc1	ZINC000819338035	FE	On-Demand	Anodyne	ADRB2	25	47
Cc1ccc(OC[C@@H](O)CN[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)cc1	ZINC000819338036	FE	On-Demand	Anodyne	ADRB2	25	47
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)cc1	ZINC000819338075	GE	On-Demand	Anodyne	ADRB2	18	40
CC(=O)c1ccc(OC[C@@H](O)CN[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)cc1	ZINC000819338075	GE	On-Demand	Anodyne	GPR119	17	41
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)cc1	ZINC000819338076	GE	On-Demand	Anodyne	ADRB2	18	40
CC(=O)c1ccc(OC[C@H](O)CN[C@H]2[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)cc1	ZINC000819338076	GE	On-Demand	Anodyne	GPR119	17	41
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(C#N)c1	ZINC000819338083	CE	On-Demand	Mild	KCNQ2	48	35
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(C#N)c1	ZINC000819338084	CE	On-Demand	Mild	KCNQ2	48	35
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(C#N)c1	ZINC000819338085	CE	On-Demand	Mild	KCNQ2	48	35
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(C#N)c1	ZINC000819338086	CE	On-Demand	Mild	KCNQ2	48	35
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCn2ccnc21	ZINC000819338091	GE	On-Demand	Anodyne	CTSD	105	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCn2ccnc21	ZINC000819338091	GE	On-Demand	Anodyne	PGC	66	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCn2ccnc21	ZINC000819338091	GE	On-Demand	Anodyne	CCKAR	17	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCn2ccnc21	ZINC000819338091	GE	On-Demand	Anodyne	BACE2	55	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCn2ccnc21	ZINC000819338091	GE	On-Demand	Anodyne	REN	99	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCn2ccnc21	ZINC000819338091	GE	On-Demand	Anodyne	REN1	36	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCn2ccnc21	ZINC000819338091	GE	On-Demand	Anodyne	BACE1	87	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCn2ccnc21	ZINC000819338091	GE	On-Demand	Anodyne	FPR1	49	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCn2ccnc21	ZINC000819338091	GE	On-Demand	Anodyne	PLM2_PLAFA	70	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CCn2ccnc21	ZINC000819338091	GE	On-Demand	Anodyne	Q82323_9DELA	58	30
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCn2ccnc21	ZINC000819338092	GE	On-Demand	Anodyne	CTSD	105	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCn2ccnc21	ZINC000819338092	GE	On-Demand	Anodyne	PGC	66	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCn2ccnc21	ZINC000819338092	GE	On-Demand	Anodyne	CCKAR	17	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCn2ccnc21	ZINC000819338092	GE	On-Demand	Anodyne	BACE2	55	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCn2ccnc21	ZINC000819338092	GE	On-Demand	Anodyne	REN	99	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCn2ccnc21	ZINC000819338092	GE	On-Demand	Anodyne	REN1	36	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCn2ccnc21	ZINC000819338092	GE	On-Demand	Anodyne	BACE1	87	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCn2ccnc21	ZINC000819338092	GE	On-Demand	Anodyne	FPR1	49	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCn2ccnc21	ZINC000819338092	GE	On-Demand	Anodyne	PLM2_PLAFA	70	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCn2ccnc21	ZINC000819338092	GE	On-Demand	Anodyne	Q82323_9DELA	58	30
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCn3ccnc32)c1	ZINC000819338109	DD	On-Demand	Anodyne	ADRB2	23	41
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCn3ccnc32)c1	ZINC000819338109	DD	On-Demand	Anodyne	ADRB3	26	41
CC(=O)c1cccc(OC[C@H](O)CN[C@@H]2CCn3ccnc32)c1	ZINC000819338109	DD	On-Demand	Anodyne	ABCB1	15	45
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCn3ccnc32)c1	ZINC000819338110	DD	On-Demand	Anodyne	ADRB2	23	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCn3ccnc32)c1	ZINC000819338110	DD	On-Demand	Anodyne	ADRB3	26	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H]2CCn3ccnc32)c1	ZINC000819338110	DD	On-Demand	Anodyne	ABCB1	15	45
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCn3ccnc32)c1	ZINC000819338111	DD	On-Demand	Anodyne	ADRB2	23	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCn3ccnc32)c1	ZINC000819338111	DD	On-Demand	Anodyne	ADRB3	26	41
CC(=O)c1cccc(OC[C@@H](O)CN[C@H]2CCn3ccnc32)c1	ZINC000819338111	DD	On-Demand	Anodyne	ABCB1	15	45
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCn3ccnc32)c1	ZINC000819338112	DD	On-Demand	Anodyne	ADRB2	23	41
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCn3ccnc32)c1	ZINC000819338112	DD	On-Demand	Anodyne	ADRB3	26	41
CC(=O)c1cccc(OC[C@H](O)CN[C@H]2CCn3ccnc32)c1	ZINC000819338112	DD	On-Demand	Anodyne	ABCB1	15	45
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccc(-c2ccccc2)cc1	ZINC000819338121	EG	On-Demand	Anodyne	ADRB2	37	43
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccc(-c2ccccc2)cc1	ZINC000819338121	EG	On-Demand	Anodyne	ADRB1	53	43
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccc(-c2ccccc2)cc1	ZINC000819338121	EG	On-Demand	Anodyne	ADRB3	40	43
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccc(-c2ccccc2)cc1	ZINC000819338122	EG	On-Demand	Anodyne	ADRB2	37	43
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccc(-c2ccccc2)cc1	ZINC000819338122	EG	On-Demand	Anodyne	ADRB1	53	43
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccc(-c2ccccc2)cc1	ZINC000819338122	EG	On-Demand	Anodyne	ADRB3	40	43
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccc(-c2ccccc2)cc1	ZINC000819338123	EG	On-Demand	Anodyne	ADRB2	37	43
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccc(-c2ccccc2)cc1	ZINC000819338123	EG	On-Demand	Anodyne	ADRB1	53	43
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccc(-c2ccccc2)cc1	ZINC000819338123	EG	On-Demand	Anodyne	ADRB3	40	43
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccc(-c2ccccc2)cc1	ZINC000819338124	EG	On-Demand	Anodyne	ADRB2	37	43
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccc(-c2ccccc2)cc1	ZINC000819338124	EG	On-Demand	Anodyne	ADRB1	53	43
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccc(-c2ccccc2)cc1	ZINC000819338124	EG	On-Demand	Anodyne	ADRB3	40	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(O)nn2)CC1	ZINC000819338131	FD	On-Demand	Anodyne	GPR119	51	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(O)nn2)CC1	ZINC000819338132	FD	On-Demand	Anodyne	GPR119	51	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2CCn3ccnc32)c1	ZINC000819338133	DD	On-Demand	Bother	ADRB2	18	42
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2CCn3ccnc32)c1	ZINC000819338133	DD	On-Demand	Bother	ADRB1	17	42
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@@H]2CCn3ccnc32)c1	ZINC000819338133	DD	On-Demand	Bother	ADRB3	17	42
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@H]2CCn3ccnc32)c1	ZINC000819338134	DD	On-Demand	Bother	ADRB2	18	42
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@H]2CCn3ccnc32)c1	ZINC000819338134	DD	On-Demand	Bother	ADRB1	17	42
O=[N+]([O-])c1cccc(OC[C@@H](O)CN[C@H]2CCn3ccnc32)c1	ZINC000819338134	DD	On-Demand	Bother	ADRB3	17	42
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@H]2CCn3ccnc32)c1	ZINC000819338135	DD	On-Demand	Bother	ADRB2	18	42
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@H]2CCn3ccnc32)c1	ZINC000819338135	DD	On-Demand	Bother	ADRB1	17	42
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@H]2CCn3ccnc32)c1	ZINC000819338135	DD	On-Demand	Bother	ADRB3	17	42
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2CCn3ccnc32)c1	ZINC000819338136	DD	On-Demand	Bother	ADRB2	18	42
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2CCn3ccnc32)c1	ZINC000819338136	DD	On-Demand	Bother	ADRB1	17	42
O=[N+]([O-])c1cccc(OC[C@H](O)CN[C@@H]2CCn3ccnc32)c1	ZINC000819338136	DD	On-Demand	Bother	ADRB3	17	42
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccc2ccccc2c1	ZINC000819338137	DF	On-Demand	Anodyne	ADRB2	28	48
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccc2ccccc2c1	ZINC000819338137	DF	On-Demand	Anodyne	ADRB1	31	40
O[C@H](CN[C@H]1CCn2ccnc21)COc1ccc2ccccc2c1	ZINC000819338137	DF	On-Demand	Anodyne	ADRB3	25	40
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccc2ccccc2c1	ZINC000819338138	DF	On-Demand	Anodyne	ADRB2	28	48
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccc2ccccc2c1	ZINC000819338138	DF	On-Demand	Anodyne	ADRB1	31	40
O[C@@H](CN[C@@H]1CCn2ccnc21)COc1ccc2ccccc2c1	ZINC000819338138	DF	On-Demand	Anodyne	ADRB3	25	40
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccc2ccccc2c1	ZINC000819338139	DF	On-Demand	Anodyne	ADRB2	28	48
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccc2ccccc2c1	ZINC000819338139	DF	On-Demand	Anodyne	ADRB1	31	40
O[C@H](CN[C@@H]1CCn2ccnc21)COc1ccc2ccccc2c1	ZINC000819338139	DF	On-Demand	Anodyne	ADRB3	25	40
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccc2ccccc2c1	ZINC000819338140	DF	On-Demand	Anodyne	ADRB2	28	48
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccc2ccccc2c1	ZINC000819338140	DF	On-Demand	Anodyne	ADRB1	31	40
O[C@@H](CN[C@H]1CCn2ccnc21)COc1ccc2ccccc2c1	ZINC000819338140	DF	On-Demand	Anodyne	ADRB3	25	40
O=S1(=O)C[C@H](CNC[C@@H](O)c2cccnc2)c2ccccc21	ZINC000819338153	DD	On-Demand	Anodyne	ADRB2	18	40
O=S1(=O)C[C@H](CNC[C@@H](O)c2cccnc2)c2ccccc21	ZINC000819338153	DD	On-Demand	Anodyne	ADRB3	81	42
O=S1(=O)C[C@@H](CNC[C@H](O)c2cccnc2)c2ccccc21	ZINC000819338154	DD	On-Demand	Anodyne	ADRB2	18	40
O=S1(=O)C[C@@H](CNC[C@H](O)c2cccnc2)c2ccccc21	ZINC000819338154	DD	On-Demand	Anodyne	ADRB3	81	42
O=S1(=O)C[C@@H](CNC[C@@H](O)c2cccnc2)c2ccccc21	ZINC000819338155	DD	On-Demand	Anodyne	ADRB2	18	40
O=S1(=O)C[C@@H](CNC[C@@H](O)c2cccnc2)c2ccccc21	ZINC000819338155	DD	On-Demand	Anodyne	ADRB3	81	42
O=S1(=O)C[C@H](CNC[C@H](O)c2cccnc2)c2ccccc21	ZINC000819338156	DD	On-Demand	Anodyne	ADRB2	18	40
O=S1(=O)C[C@H](CNC[C@H](O)c2cccnc2)c2ccccc21	ZINC000819338156	DD	On-Demand	Anodyne	ADRB3	81	42
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NCCC(=O)Nc3cccc(F)c3)[C@H]2C1	ZINC000819338171	FF	On-Demand	Anodyne	GPR119	20	42
O=C(NCc1ccccc1CN1CCC(O)CC1)C(F)=C1CCC1	ZINC000819338172	EF	On-Demand	Anodyne	SIGMAR1	21	40
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)c2ccc(F)cc2)C1	ZINC000819338175	CD	On-Demand	Anodyne	CCR3	41	35
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@H](O)COc3ccc(CC#N)cc3)[C@H]2C1	ZINC000819338176	GD	On-Demand	Mild	GPR119	19	41
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NC[C@@H](O)COc3ccc(CC#N)cc3)[C@H]2C1	ZINC000819338177	GD	On-Demand	Mild	GPR119	19	41
O=C(O)C[C@H]1CCCN(C(=O)C(=O)c2ccc(F)cc2)C1	ZINC000819338178	CD	On-Demand	Anodyne	CCR3	41	35
CC(C)(C)OC(=O)N1C[C@H]2[C@H](NCCS(=O)(=O)c3ccccc3)[C@H]2C1	ZINC000819338179	FD	On-Demand	Anodyne	GPR119	40	38
O=C(O)C[C@H]1CCCN(C(=O)C(=O)Nc2ccc(-n3ccnc3)nc2)C1	ZINC000819338180	FC	On-Demand	Anodyne	NOS2	54	33
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)Nc2ccc(-n3ccnc3)nc2)C1	ZINC000819338182	FC	On-Demand	Anodyne	NOS2	54	33
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)Nc2ncn(Cc3ccccc3)n2)C1	ZINC000819338214	FC	On-Demand	Anodyne	SIGMAR1	18	41
O=C(O)C[C@H]1CCCN(C(=O)C(=O)Nc2ncn(Cc3ccccc3)n2)C1	ZINC000819338216	FC	On-Demand	Anodyne	SIGMAR1	18	41
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)Nc2ccc(CCN3CCCC3)cc2)C1	ZINC000819338238	GD	On-Demand	Anodyne	HRH3	15	40
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)Nc2ccc(CCN3CCCC3)cc2)C1	ZINC000819338238	GD	On-Demand	Anodyne	CCR3	64	38
O=C(O)C[C@H]1CCCN(C(=O)C(=O)Nc2ccc(CCN3CCCC3)cc2)C1	ZINC000819338239	GD	On-Demand	Anodyne	HRH3	15	40
O=C(O)C[C@H]1CCCN(C(=O)C(=O)Nc2ccc(CCN3CCCC3)cc2)C1	ZINC000819338239	GD	On-Demand	Anodyne	CCR3	64	38
O=C(O)C[C@H]1CCCN(C(=O)C(=O)Nc2ccc(N3CCOC3=O)cc2)C1	ZINC000819338240	GD	On-Demand	Anodyne	DGAT1	15	40
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)Nc2ccc(N3CCOC3=O)cc2)C1	ZINC000819338242	GD	On-Demand	Anodyne	DGAT1	15	40
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)Nc2cccc(COCC3CC3)c2)C1	ZINC000819338248	FE	On-Demand	Anodyne	CCR3	27	43
O=C(O)C[C@H]1CCCN(C(=O)C(=O)Nc2cccc(COCC3CC3)c2)C1	ZINC000819338250	FE	On-Demand	Anodyne	CCR3	27	43
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819338268	GD	On-Demand	Anodyne	L3MBTL3	84	42
O=C(O)C[C@H]1CCCN(C(=O)C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819338269	GD	On-Demand	Anodyne	L3MBTL3	84	42
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)Nc2cccc(F)c2)C1	ZINC000819338282	DD	On-Demand	Anodyne	CCR3	71	44
O=C(O)C[C@H]1CCCN(C(=O)C(=O)Nc2cccc(F)c2)C1	ZINC000819338285	DD	On-Demand	Anodyne	CCR3	71	44
O=C(CCN[C@@H]1CCn2ccnc21)Nc1cccc(Br)c1	ZINC000819338304	EF	On-Demand	Anodyne	EGFR	32	42
O=C(CCN[C@H]1CCn2ccnc21)Nc1cccc(Br)c1	ZINC000819338305	EF	On-Demand	Anodyne	EGFR	32	42
O=C(O)C[C@H]1CCCN(C(=O)C(=O)Nc2ccc(N3CCCC3)nc2)C1	ZINC000819338313	FD	On-Demand	Anodyne	DGAT1	41	42
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)Nc2ccc(N3CCCC3)nc2)C1	ZINC000819338317	FD	On-Demand	Anodyne	DGAT1	41	42
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)Nc2cccc(CN3CCCCC3)c2)C1	ZINC000819338334	GE	On-Demand	Anodyne	HRH2	40	41
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)Nc2cccc(CN3CCCCC3)c2)C1	ZINC000819338334	GE	On-Demand	Anodyne	SIGMAR1	22	42
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)Nc2cccc(CN3CCCCC3)c2)C1	ZINC000819338334	GE	On-Demand	Anodyne	CCR3	67	44
O=C(O)C[C@H]1CCCN(C(=O)C(=O)Nc2cccc(CN3CCCCC3)c2)C1	ZINC000819338335	GE	On-Demand	Anodyne	HRH2	40	41
O=C(O)C[C@H]1CCCN(C(=O)C(=O)Nc2cccc(CN3CCCCC3)c2)C1	ZINC000819338335	GE	On-Demand	Anodyne	SIGMAR1	22	42
O=C(O)C[C@H]1CCCN(C(=O)C(=O)Nc2cccc(CN3CCCCC3)c2)C1	ZINC000819338335	GE	On-Demand	Anodyne	CCR3	67	44
O=C(O)C[C@H]1CCCN(C(=O)[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000819338363	ED	On-Demand	Anodyne	SIGMAR1	51	37
O=C(O)C[C@@H]1CCCN(C(=O)[C@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000819338364	ED	On-Demand	Anodyne	SIGMAR1	51	37
O=C(O)C[C@@H]1CCCN(C(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000819338365	ED	On-Demand	Anodyne	SIGMAR1	51	37
O=c1ccc(Br)cn1CCNC[C@H](O)c1ccccc1	ZINC000819338370	ED	On-Demand	Anodyne	ADRB2	16	44
O=c1ccc(Br)cn1CCNC[C@H](O)c1ccccc1	ZINC000819338370	ED	On-Demand	Anodyne	ADRB3	47	40
O=c1ccc(Br)cn1CCNC[C@@H](O)c1ccccc1	ZINC000819338371	ED	On-Demand	Anodyne	ADRB2	16	44
O=c1ccc(Br)cn1CCNC[C@@H](O)c1ccccc1	ZINC000819338371	ED	On-Demand	Anodyne	ADRB3	47	40
O=C(O)C[C@H]1CCCN(C(=O)[C@@]2(O)CCN(Cc3ccccc3)C2)C1	ZINC000819338393	ED	On-Demand	Anodyne	SIGMAR1	51	37
O=C(O)C[C@H]1CCCN(C(=O)C(=O)Nc2ccc(-n3cncn3)c(F)c2)C1	ZINC000819338420	GD	On-Demand	Anodyne	NPY2R	51	34
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)Nc2ccc(-n3cncn3)c(F)c2)C1	ZINC000819338421	GD	On-Demand	Anodyne	NPY2R	51	34
O=C(O)[C@@H]1CN(c2nccc(N3CCCC3)n2)CCO1	ZINC000819338422	CC	On-Demand	Anodyne	SORD	67	36
O=C(O)[C@H]1CN(c2nccc(N3CCCC3)n2)CCO1	ZINC000819338433	CC	On-Demand	Anodyne	SORD	67	36
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)Nc2cccc(CN3CCCC3=O)c2)C1	ZINC000819338446	GD	On-Demand	Anodyne	CCR3	24	40
O=C(O)C[C@H]1CCCN(C(=O)C(=O)Nc2cccc(CN3CCCC3=O)c2)C1	ZINC000819338448	GD	On-Demand	Anodyne	CCR3	24	40
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)Nc2ccccc2C(=O)N2CCCC2)C1	ZINC000819338466	GD	On-Demand	Anodyne	NPSR1	15	46
O=C(O)C[C@H]1CCCN(C(=O)C(=O)Nc2ccccc2C(=O)N2CCCC2)C1	ZINC000819338468	GD	On-Demand	Anodyne	NPSR1	15	46
CC(=O)c1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338473	FF	On-Demand	Anodyne	ADRB1	65	39
O=C(O)C[C@@H]1CCCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819338474	FF	On-Demand	Anodyne	CHRM2	26	43
O=C(O)C[C@@H]1CCCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819338474	FF	On-Demand	Anodyne	CHRM1	24	43
O=C(O)C[C@@H]1CCCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819338474	FF	On-Demand	Anodyne	CHRM3	42	43
O=C(O)C[C@@H]1CCCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819338474	FF	On-Demand	Anodyne	AMY2	42	29
CC(=O)c1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338475	FF	On-Demand	Anodyne	ADRB1	65	39
O=C(O)C[C@H]1CCCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819338476	FF	On-Demand	Anodyne	CHRM2	26	43
O=C(O)C[C@H]1CCCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819338476	FF	On-Demand	Anodyne	CHRM1	24	43
O=C(O)C[C@H]1CCCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819338476	FF	On-Demand	Anodyne	CHRM3	42	43
O=C(O)C[C@H]1CCCN(C(=O)C(O)(c2ccccc2)c2ccccc2)C1	ZINC000819338476	FF	On-Demand	Anodyne	AMY2	42	29
O=C(O)C[C@H]1CCCN(C(=O)C(=O)Nc2ccc(-n3cnnn3)cc2)C1	ZINC000819338493	FC	On-Demand	Anodyne	KCNJ1	40	33
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)Nc2ccc(-n3cnnn3)cc2)C1	ZINC000819338495	FC	On-Demand	Anodyne	KCNJ1	40	33
O=C(O)[C@H]1CN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CCO1	ZINC000819338497	FC	On-Demand	Anodyne	CXCR3	25	42
O=C(O)[C@@H]1CN(c2ncc(C(=O)N3CCOCC3)cc2Cl)CCO1	ZINC000819338500	FC	On-Demand	Anodyne	CXCR3	25	42
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H](O)c2cccnc2)C1	ZINC000819338502	CC	On-Demand	Anodyne	PTAFR	15	42
O=C(O)C[C@@H]1CCCN(C(=O)[C@H](O)c2cccnc2)C1	ZINC000819338504	CC	On-Demand	Anodyne	PTAFR	15	42
O=C(O)C[C@H]1CCCN(C(=O)[C@@H](O)c2cccnc2)C1	ZINC000819338505	CC	On-Demand	Anodyne	PTAFR	15	42
O=C(O)C[C@H]1CCCN(C(=O)[C@H](O)c2cccnc2)C1	ZINC000819338506	CC	On-Demand	Anodyne	PTAFR	15	42
O=C(O)C[C@@H]1CCCN(C(=O)C(=O)Nc2cccnc2)C1	ZINC000819338507	CC	On-Demand	Anodyne	NAMPT	31	40
O=C(O)C[C@H]1CCCN(C(=O)C(=O)Nc2cccnc2)C1	ZINC000819338508	CC	On-Demand	Anodyne	NAMPT	31	40
O=C(O)CC1(CC(=O)NCc2ccc(C(=O)O)cc2)CCCCC1	ZINC000819338510	EF	On-Demand	Anodyne	PROC	42	31
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338537	GF	On-Demand	Anodyne	ADRB2	40	43
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338537	GF	On-Demand	Anodyne	ADRB1	76	44
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338537	GF	On-Demand	Anodyne	GRIN1	30	43
CC(=O)CCc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338537	GF	On-Demand	Anodyne	ADRB3	51	43
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338540	GF	On-Demand	Anodyne	ADRB2	40	43
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338540	GF	On-Demand	Anodyne	ADRB1	76	44
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338540	GF	On-Demand	Anodyne	GRIN1	30	43
CC(=O)CCc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338540	GF	On-Demand	Anodyne	ADRB3	51	43
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CCCCC2(F)F)c1	ZINC000819338548	DG	On-Demand	Bother	CACNA1D	49	34
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2CCCCC2(F)F)c1	ZINC000819338549	DG	On-Demand	Bother	CACNA1D	49	34
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CCCCC2(F)F)c1	ZINC000819338550	DG	On-Demand	Bother	CACNA1D	49	34
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CCCCC2(F)F)c1	ZINC000819338552	DG	On-Demand	Bother	CACNA1D	49	34
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)c1	ZINC000819338576	FE	On-Demand	Bother	ADRB1	27	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)c1	ZINC000819338576	FE	On-Demand	Bother	ADRB3	18	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)c1	ZINC000819338576	FE	On-Demand	Bother	PDS	23	42
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)c1	ZINC000819338577	FE	On-Demand	Bother	ADRB1	27	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)c1	ZINC000819338577	FE	On-Demand	Bother	ADRB3	18	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)c1	ZINC000819338577	FE	On-Demand	Bother	PDS	23	42
CCC[C@H](CNC[C@@H](O)c1cccnc1)OC	ZINC000819338584	BD	On-Demand	Anodyne	ADRB2	23	45
CCC[C@H](CNC[C@@H](O)c1cccnc1)OC	ZINC000819338584	BD	On-Demand	Anodyne	ADRB1	25	45
CCC[C@H](CNC[C@@H](O)c1cccnc1)OC	ZINC000819338584	BD	On-Demand	Anodyne	ADRB3	92	45
CCC[C@H](CNC[C@H](O)c1cccnc1)OC	ZINC000819338585	BD	On-Demand	Anodyne	ADRB2	23	45
CCC[C@H](CNC[C@H](O)c1cccnc1)OC	ZINC000819338585	BD	On-Demand	Anodyne	ADRB1	25	45
CCC[C@H](CNC[C@H](O)c1cccnc1)OC	ZINC000819338585	BD	On-Demand	Anodyne	ADRB3	92	45
CCC[C@@H](CNC[C@@H](O)c1cccnc1)OC	ZINC000819338586	BD	On-Demand	Anodyne	ADRB2	23	45
CCC[C@@H](CNC[C@@H](O)c1cccnc1)OC	ZINC000819338586	BD	On-Demand	Anodyne	ADRB1	25	45
CCC[C@@H](CNC[C@@H](O)c1cccnc1)OC	ZINC000819338586	BD	On-Demand	Anodyne	ADRB3	92	45
CCC[C@@H](CNC[C@H](O)c1cccnc1)OC	ZINC000819338587	BD	On-Demand	Anodyne	ADRB2	23	45
CCC[C@@H](CNC[C@H](O)c1cccnc1)OC	ZINC000819338587	BD	On-Demand	Anodyne	ADRB1	25	45
CCC[C@@H](CNC[C@H](O)c1cccnc1)OC	ZINC000819338587	BD	On-Demand	Anodyne	ADRB3	92	45
O[C@H](CNCC[C@H]1CCc2ccccc21)c1cccnc1	ZINC000819338597	CF	On-Demand	Anodyne	ADRB2	24	42
O[C@H](CNCC[C@H]1CCc2ccccc21)c1cccnc1	ZINC000819338597	CF	On-Demand	Anodyne	ADRB1	29	42
O[C@H](CNCC[C@H]1CCc2ccccc21)c1cccnc1	ZINC000819338597	CF	On-Demand	Anodyne	ADRB3	100	47
O[C@H](CNCC[C@@H]1CCc2ccccc21)c1cccnc1	ZINC000819338598	CF	On-Demand	Anodyne	ADRB2	24	42
O[C@H](CNCC[C@@H]1CCc2ccccc21)c1cccnc1	ZINC000819338598	CF	On-Demand	Anodyne	ADRB1	29	42
O[C@H](CNCC[C@@H]1CCc2ccccc21)c1cccnc1	ZINC000819338598	CF	On-Demand	Anodyne	ADRB3	100	47
O[C@@H](CNCC[C@H]1CCc2ccccc21)c1cccnc1	ZINC000819338599	CF	On-Demand	Anodyne	ADRB2	24	42
O[C@@H](CNCC[C@H]1CCc2ccccc21)c1cccnc1	ZINC000819338599	CF	On-Demand	Anodyne	ADRB1	29	42
O[C@@H](CNCC[C@H]1CCc2ccccc21)c1cccnc1	ZINC000819338599	CF	On-Demand	Anodyne	ADRB3	100	47
O[C@@H](CNCC[C@@H]1CCc2ccccc21)c1cccnc1	ZINC000819338600	CF	On-Demand	Anodyne	ADRB2	24	42
O[C@@H](CNCC[C@@H]1CCc2ccccc21)c1cccnc1	ZINC000819338600	CF	On-Demand	Anodyne	ADRB1	29	42
O[C@@H](CNCC[C@@H]1CCc2ccccc21)c1cccnc1	ZINC000819338600	CF	On-Demand	Anodyne	ADRB3	100	47
COC(=O)c1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338617	FE	On-Demand	Anodyne	ADRB2	41	42
COC(=O)c1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338617	FE	On-Demand	Anodyne	ADRB1	71	42
COC(=O)c1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338617	FE	On-Demand	Anodyne	GRIN1	28	41
COC(=O)c1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338617	FE	On-Demand	Anodyne	ADRB3	44	42
COC(=O)c1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338618	FE	On-Demand	Anodyne	ADRB2	41	42
COC(=O)c1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338618	FE	On-Demand	Anodyne	ADRB1	71	42
COC(=O)c1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338618	FE	On-Demand	Anodyne	GRIN1	28	41
COC(=O)c1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338618	FE	On-Demand	Anodyne	ADRB3	44	42
O[C@H](CNCc1cc(F)cnc1Cl)COc1ccccc1Cl	ZINC000819338625	EG	On-Demand	Anodyne	ADRB2	22	47
O[C@H](CNCc1cc(F)cnc1Cl)COc1ccccc1Cl	ZINC000819338625	EG	On-Demand	Anodyne	ADRB1	50	38
O[C@@H](CNCc1cc(F)cnc1Cl)COc1ccccc1Cl	ZINC000819338626	EG	On-Demand	Anodyne	ADRB2	22	47
O[C@@H](CNCc1cc(F)cnc1Cl)COc1ccccc1Cl	ZINC000819338626	EG	On-Demand	Anodyne	ADRB1	50	38
O[C@@H](CNCC[C@H]1CCc2ccccc21)c1ccccc1	ZINC000819338647	CG	On-Demand	Anodyne	ADRB3	41	38
O[C@@H](CNCC[C@@H]1CCc2ccccc21)c1ccccc1	ZINC000819338648	CG	On-Demand	Anodyne	ADRB3	41	38
O[C@H](CNCC[C@@H]1CCc2ccccc21)c1ccccc1	ZINC000819338649	CG	On-Demand	Anodyne	ADRB3	41	38
O[C@H](CNCC[C@H]1CCc2ccccc21)c1ccccc1	ZINC000819338650	CG	On-Demand	Anodyne	ADRB3	41	38
O[C@H](CNC[C@@H]1CCCCC1(F)F)c1cccc(Cl)c1	ZINC000819338655	DH	On-Demand	Anodyne	ADRB1	33	44
O[C@H](CNC[C@@H]1CCCCC1(F)F)c1cccc(Cl)c1	ZINC000819338655	DH	On-Demand	Anodyne	ADRB3	47	44
O[C@@H](CNC[C@@H]1CCCCC1(F)F)c1cccc(Cl)c1	ZINC000819338656	DH	On-Demand	Anodyne	ADRB1	33	44
O[C@@H](CNC[C@@H]1CCCCC1(F)F)c1cccc(Cl)c1	ZINC000819338656	DH	On-Demand	Anodyne	ADRB3	47	44
O[C@@H](CNC[C@H]1CCCCC1(F)F)c1cccc(Cl)c1	ZINC000819338657	DH	On-Demand	Anodyne	ADRB1	33	44
O[C@@H](CNC[C@H]1CCCCC1(F)F)c1cccc(Cl)c1	ZINC000819338657	DH	On-Demand	Anodyne	ADRB3	47	44
O[C@H](CNC[C@H]1CCCCC1(F)F)c1cccc(Cl)c1	ZINC000819338658	DH	On-Demand	Anodyne	ADRB1	33	44
O[C@H](CNC[C@H]1CCCCC1(F)F)c1cccc(Cl)c1	ZINC000819338658	DH	On-Demand	Anodyne	ADRB3	47	44
O=c1ccc(Br)cn1CCNC[C@@H](O)c1cccnc1	ZINC000819338663	ED	On-Demand	Anodyne	ADRB2	27	45
O=c1ccc(Br)cn1CCNC[C@@H](O)c1cccnc1	ZINC000819338663	ED	On-Demand	Anodyne	ADRB1	29	45
O=c1ccc(Br)cn1CCNC[C@@H](O)c1cccnc1	ZINC000819338663	ED	On-Demand	Anodyne	ADRB3	105	52
O=c1ccc(Br)cn1CCNC[C@H](O)c1cccnc1	ZINC000819338664	ED	On-Demand	Anodyne	ADRB2	27	45
O=c1ccc(Br)cn1CCNC[C@H](O)c1cccnc1	ZINC000819338664	ED	On-Demand	Anodyne	ADRB1	29	45
O=c1ccc(Br)cn1CCNC[C@H](O)c1cccnc1	ZINC000819338664	ED	On-Demand	Anodyne	ADRB3	105	52
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(-n2cccn2)cc1	ZINC000819338667	DF	On-Demand	Anodyne	KCNQ2	20	44
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(-n2cccn2)cc1	ZINC000819338667	DF	On-Demand	Anodyne	ADAM17	15	46
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(-n2cccn2)cc1	ZINC000819338667	DF	On-Demand	Anodyne	AMP1_PLAFQ	63	45
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(-n2cccn2)cc1	ZINC000819338668	DF	On-Demand	Anodyne	KCNQ2	20	44
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(-n2cccn2)cc1	ZINC000819338668	DF	On-Demand	Anodyne	ADAM17	15	46
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(-n2cccn2)cc1	ZINC000819338668	DF	On-Demand	Anodyne	AMP1_PLAFQ	63	45
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(-n2cccn2)cc1	ZINC000819338669	DF	On-Demand	Anodyne	KCNQ2	20	44
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(-n2cccn2)cc1	ZINC000819338669	DF	On-Demand	Anodyne	ADAM17	15	46
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(-n2cccn2)cc1	ZINC000819338669	DF	On-Demand	Anodyne	AMP1_PLAFQ	63	45
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(-n2cccn2)cc1	ZINC000819338670	DF	On-Demand	Anodyne	KCNQ2	20	44
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(-n2cccn2)cc1	ZINC000819338670	DF	On-Demand	Anodyne	ADAM17	15	46
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(-n2cccn2)cc1	ZINC000819338670	DF	On-Demand	Anodyne	AMP1_PLAFQ	63	45
O=c1ccc(Br)cn1CCNC[C@H](O)c1cccc(F)c1	ZINC000819338682	FE	On-Demand	Anodyne	ADRB3	25	41
O=c1ccc(Br)cn1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819338683	FE	On-Demand	Anodyne	ADRB3	25	41
CC(=O)Nc1cccc(CC(=O)Nc2cccc(N3CCOC3=O)c2C)c1	ZINC000819338689	FG	On-Demand	Anodyne	KCNQ2	26	43
O[C@H](CNCc1cc(F)cnc1Cl)COc1ccc(Cl)c(Cl)c1	ZINC000819338699	GH	On-Demand	Anodyne	GRIN1	29	45
O[C@@H](CNCc1cc(F)cnc1Cl)COc1ccc(Cl)c(Cl)c1	ZINC000819338700	GH	On-Demand	Anodyne	GRIN1	29	45
COc1ccc(OC)c([C@H](O)CNCC[C@@H]2CCc3ccccc32)c1	ZINC000819338713	EG	On-Demand	Anodyne	NQO2	26	48
COc1ccc(OC)c([C@H](O)CNCC[C@H]2CCc3ccccc32)c1	ZINC000819338718	EG	On-Demand	Anodyne	NQO2	26	48
O[C@H](CNCc1cc(F)cnc1Cl)COc1ccc(F)cc1	ZINC000819338722	EF	On-Demand	Anodyne	ADRB2	36	41
O[C@H](CNCc1cc(F)cnc1Cl)COc1ccc(F)cc1	ZINC000819338722	EF	On-Demand	Anodyne	ADRB1	60	40
O[C@H](CNCc1cc(F)cnc1Cl)COc1ccc(F)cc1	ZINC000819338722	EF	On-Demand	Anodyne	GRIN1	25	42
O[C@H](CNCc1cc(F)cnc1Cl)COc1ccc(F)cc1	ZINC000819338722	EF	On-Demand	Anodyne	ADRB3	35	40
O[C@@H](CNCc1cc(F)cnc1Cl)COc1ccc(F)cc1	ZINC000819338724	EF	On-Demand	Anodyne	ADRB2	36	41
O[C@@H](CNCc1cc(F)cnc1Cl)COc1ccc(F)cc1	ZINC000819338724	EF	On-Demand	Anodyne	ADRB1	60	40
O[C@@H](CNCc1cc(F)cnc1Cl)COc1ccc(F)cc1	ZINC000819338724	EF	On-Demand	Anodyne	GRIN1	25	42
O[C@@H](CNCc1cc(F)cnc1Cl)COc1ccc(F)cc1	ZINC000819338724	EF	On-Demand	Anodyne	ADRB3	35	40
O=C(C(F)=C1CCC1)N1CCn2c(nnc2-c2ccccc2)C1	ZINC000819338734	DF	On-Demand	Anodyne	P2RX7	33	52
C#Cc1ccc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819338752	FF	On-Demand	Mild	GPR119	48	47
C#Cc1ccc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819338754	FF	On-Demand	Mild	GPR119	48	47
C#Cc1ccc(CNC[C@H](O)COCc2ccccc2OC)cc1	ZINC000819338766	EE	On-Demand	Mild	ADRB1	19	44
C#Cc1ccc(CNC[C@@H](O)COCc2ccccc2OC)cc1	ZINC000819338767	EE	On-Demand	Mild	ADRB1	19	44
C#Cc1ccc(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819338791	EE	On-Demand	Mild	ADRB2	52	61
C#Cc1ccc(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819338791	EE	On-Demand	Mild	ADRB1	90	61
C#Cc1ccc(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819338791	EE	On-Demand	Mild	GRIN1	29	43
C#Cc1ccc(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819338791	EE	On-Demand	Mild	ADRB3	57	61
C#Cc1ccc(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819338792	EE	On-Demand	Mild	ADRB2	52	61
C#Cc1ccc(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819338792	EE	On-Demand	Mild	ADRB1	90	61
C#Cc1ccc(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819338792	EE	On-Demand	Mild	GRIN1	29	43
C#Cc1ccc(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819338792	EE	On-Demand	Mild	ADRB3	57	61
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H]2CCCCC2(F)F)CC1	ZINC000819338812	GG	On-Demand	Anodyne	GPR119	25	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H]2CCCCC2(F)F)CC1	ZINC000819338814	GG	On-Demand	Anodyne	GPR119	25	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2CCCCC2(F)F)CC1	ZINC000819338816	GG	On-Demand	Anodyne	GPR119	25	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2CCCCC2(F)F)CC1	ZINC000819338817	GG	On-Demand	Anodyne	GPR119	25	41
O[C@H](CNCc1cc(F)cnc1Cl)COc1ccc(Br)cc1	ZINC000819338818	GG	On-Demand	Anodyne	ADRB1	42	38
O[C@@H](CNCc1cc(F)cnc1Cl)COc1ccc(Br)cc1	ZINC000819338819	GG	On-Demand	Anodyne	ADRB1	42	38
C#Cc1ccc(CNC[C@H](O)COc2ccc(C)cc2C)cc1	ZINC000819338828	DF	On-Demand	Mild	ADRB2	28	45
C#Cc1ccc(CNC[C@H](O)COc2ccc(C)cc2C)cc1	ZINC000819338828	DF	On-Demand	Mild	ADRB1	23	45
C#Cc1ccc(CNC[C@@H](O)COc2ccc(C)cc2C)cc1	ZINC000819338829	DF	On-Demand	Mild	ADRB2	28	45
C#Cc1ccc(CNC[C@@H](O)COc2ccc(C)cc2C)cc1	ZINC000819338829	DF	On-Demand	Mild	ADRB1	23	45
C#Cc1ccc(CNC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819338834	DE	On-Demand	Mild	ADRB2	37	45
C#Cc1ccc(CNC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819338834	DE	On-Demand	Mild	ADRB1	58	45
C#Cc1ccc(CNC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819338834	DE	On-Demand	Mild	ADRB3	37	45
C#Cc1ccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819338835	DE	On-Demand	Mild	ADRB2	37	45
C#Cc1ccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819338835	DE	On-Demand	Mild	ADRB1	58	45
C#Cc1ccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819338835	DE	On-Demand	Mild	ADRB3	37	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cc(C3CC3)ccc2F)CC1	ZINC000819338916	GH	On-Demand	Anodyne	GPR119	56	62
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cc(C3CC3)ccc2F)CC1	ZINC000819338918	GH	On-Demand	Anodyne	GPR119	56	62
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cc(F)cnc2Cl)CC1	ZINC000819338955	GF	On-Demand	Anodyne	GPR119	52	54
C#Cc1ccc(CNC[C@@H](O)COc2ccc(C(=O)OC)cc2)cc1	ZINC000819338956	ED	On-Demand	Mild	ADRB2	53	51
C#Cc1ccc(CNC[C@@H](O)COc2ccc(C(=O)OC)cc2)cc1	ZINC000819338956	ED	On-Demand	Mild	ADRB1	80	51
C#Cc1ccc(CNC[C@@H](O)COc2ccc(C(=O)OC)cc2)cc1	ZINC000819338956	ED	On-Demand	Mild	ADRB3	52	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cc(F)cnc2Cl)CC1	ZINC000819338957	GF	On-Demand	Anodyne	GPR119	52	54
C#Cc1ccc(CNC[C@H](O)COc2ccc(C(=O)OC)cc2)cc1	ZINC000819338958	ED	On-Demand	Mild	ADRB2	53	51
C#Cc1ccc(CNC[C@H](O)COc2ccc(C(=O)OC)cc2)cc1	ZINC000819338958	ED	On-Demand	Mild	ADRB1	80	51
C#Cc1ccc(CNC[C@H](O)COc2ccc(C(=O)OC)cc2)cc1	ZINC000819338958	ED	On-Demand	Mild	ADRB3	52	51
C#Cc1ccc(CNC[C@H](O)COc2cc(C)ccc2C)cc1	ZINC000819338960	DF	On-Demand	Mild	ADRB2	36	45
C#Cc1ccc(CNC[C@H](O)COc2cc(C)ccc2C)cc1	ZINC000819338960	DF	On-Demand	Mild	ADRB1	46	35
C#Cc1ccc(CNC[C@@H](O)COc2cc(C)ccc2C)cc1	ZINC000819338962	DF	On-Demand	Mild	ADRB2	36	45
C#Cc1ccc(CNC[C@@H](O)COc2cc(C)ccc2C)cc1	ZINC000819338962	DF	On-Demand	Mild	ADRB1	46	35
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CCC[C@@H]2c2ccccc2)c1	ZINC000819338974	EH	On-Demand	Bother	CACNA1D	49	36
CSc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338976	FG	On-Demand	Anodyne	ADRB1	43	36
CSc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819338977	FG	On-Demand	Anodyne	ADRB1	43	36
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CCC[C@@H]2c2ccccc2)c1	ZINC000819338984	EH	On-Demand	Bother	CACNA1D	49	36
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CCC[C@H]2c2ccccc2)c1	ZINC000819338987	EH	On-Demand	Bother	CACNA1D	49	36
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CCC[C@H]2c2ccccc2)c1	ZINC000819338989	EH	On-Demand	Bother	CACNA1D	49	36
C#Cc1ccc(CNC[C@H](O)COc2ccc(CCC(C)=O)cc2)cc1	ZINC000819339002	FF	On-Demand	Mild	ADRB2	50	49
C#Cc1ccc(CNC[C@H](O)COc2ccc(CCC(C)=O)cc2)cc1	ZINC000819339002	FF	On-Demand	Mild	ADRB1	78	50
C#Cc1ccc(CNC[C@H](O)COc2ccc(CCC(C)=O)cc2)cc1	ZINC000819339002	FF	On-Demand	Mild	GRIN1	19	42
C#Cc1ccc(CNC[C@H](O)COc2ccc(CCC(C)=O)cc2)cc1	ZINC000819339002	FF	On-Demand	Mild	ADRB3	52	49
C#Cc1ccc(CNC[C@H](O)COc2ccc(CCC(C)=O)cc2)cc1	ZINC000819339002	FF	On-Demand	Mild	ABCB1	24	44
C#Cc1ccc(CNC[C@@H](O)COc2ccc(CCC(C)=O)cc2)cc1	ZINC000819339004	FF	On-Demand	Mild	ADRB2	50	49
C#Cc1ccc(CNC[C@@H](O)COc2ccc(CCC(C)=O)cc2)cc1	ZINC000819339004	FF	On-Demand	Mild	ADRB1	78	50
C#Cc1ccc(CNC[C@@H](O)COc2ccc(CCC(C)=O)cc2)cc1	ZINC000819339004	FF	On-Demand	Mild	GRIN1	19	42
C#Cc1ccc(CNC[C@@H](O)COc2ccc(CCC(C)=O)cc2)cc1	ZINC000819339004	FF	On-Demand	Mild	ADRB3	52	49
C#Cc1ccc(CNC[C@@H](O)COc2ccc(CCC(C)=O)cc2)cc1	ZINC000819339004	FF	On-Demand	Mild	ABCB1	24	44
C=C(C)C(C)(C)C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000819339010	FD	On-Demand	Reactive	LPL	33	41
O[C@H](CNCc1cc(F)cnc1Cl)COc1ccccc1C(F)(F)F	ZINC000819339056	GG	On-Demand	Anodyne	ADRB1	45	37
O[C@@H](CNCc1cc(F)cnc1Cl)COc1ccccc1C(F)(F)F	ZINC000819339057	GG	On-Demand	Anodyne	ADRB1	45	37
O[C@H](CNC[C@H]1CCCCC1(F)F)c1cccnc1	ZINC000819339059	CF	On-Demand	Anodyne	ADRB1	22	42
O[C@H](CNC[C@H]1CCCCC1(F)F)c1cccnc1	ZINC000819339059	CF	On-Demand	Anodyne	ADRB3	89	46
O[C@@H](CNC[C@H]1CCCCC1(F)F)c1cccnc1	ZINC000819339060	CF	On-Demand	Anodyne	ADRB1	22	42
O[C@@H](CNC[C@H]1CCCCC1(F)F)c1cccnc1	ZINC000819339060	CF	On-Demand	Anodyne	ADRB3	89	46
O[C@H](CNC[C@@H]1CCCCC1(F)F)c1cccnc1	ZINC000819339061	CF	On-Demand	Anodyne	ADRB1	22	42
O[C@H](CNC[C@@H]1CCCCC1(F)F)c1cccnc1	ZINC000819339061	CF	On-Demand	Anodyne	ADRB3	89	46
O[C@@H](CNC[C@@H]1CCCCC1(F)F)c1cccnc1	ZINC000819339062	CF	On-Demand	Anodyne	ADRB1	22	42
O[C@@H](CNC[C@@H]1CCCCC1(F)F)c1cccnc1	ZINC000819339062	CF	On-Demand	Anodyne	ADRB3	89	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3ccc(OC)cc3)CC1)C2	ZINC000819339080	GG	On-Demand	Anodyne	ADAM10	15	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3ccc(OC)cc3)CC1)C2	ZINC000819339080	GG	On-Demand	Anodyne	NPBWR1	63	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3ccc(OC)cc3)CC1)C2	ZINC000819339081	GG	On-Demand	Anodyne	ADAM10	15	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3ccc(OC)cc3)CC1)C2	ZINC000819339081	GG	On-Demand	Anodyne	NPBWR1	63	33
C#Cc1ccc(CNC[C@H](O)COc2cccc(CC)c2)cc1	ZINC000819339149	DF	On-Demand	Mild	ADRB2	49	48
C#Cc1ccc(CNC[C@H](O)COc2cccc(CC)c2)cc1	ZINC000819339149	DF	On-Demand	Mild	ADRB1	66	48
C#Cc1ccc(CNC[C@H](O)COc2cccc(CC)c2)cc1	ZINC000819339149	DF	On-Demand	Mild	ADRB3	45	44
C#Cc1ccc(CNC[C@H](O)COc2cccc(CC)c2)cc1	ZINC000819339149	DF	On-Demand	Mild	PDS	64	37
C#Cc1ccc(CNC[C@@H](O)COc2cccc(CC)c2)cc1	ZINC000819339150	DF	On-Demand	Mild	ADRB2	49	48
C#Cc1ccc(CNC[C@@H](O)COc2cccc(CC)c2)cc1	ZINC000819339150	DF	On-Demand	Mild	ADRB1	66	48
C#Cc1ccc(CNC[C@@H](O)COc2cccc(CC)c2)cc1	ZINC000819339150	DF	On-Demand	Mild	ADRB3	45	44
C#Cc1ccc(CNC[C@@H](O)COc2cccc(CC)c2)cc1	ZINC000819339150	DF	On-Demand	Mild	PDS	64	37
O=C(/C=C\[C@@H]1CCCO1)N1CCn2c(nnc2-c2ccccc2)C1	ZINC000819339231	DE	On-Demand	Anodyne	P2RX7	27	45
O=C(/C=C/[C@@H]1CCCO1)N1CCn2c(nnc2-c2ccccc2)C1	ZINC000819339232	DE	On-Demand	Anodyne	P2RX7	27	45
O=C(/C=C\[C@H]1CCCO1)N1CCn2c(nnc2-c2ccccc2)C1	ZINC000819339233	DE	On-Demand	Anodyne	P2RX7	27	45
O=C(/C=C/[C@H]1CCCO1)N1CCn2c(nnc2-c2ccccc2)C1	ZINC000819339234	DE	On-Demand	Anodyne	P2RX7	27	45
O[C@H](CNCc1cc(F)cnc1Cl)COc1ccccc1	ZINC000819339237	DE	On-Demand	Anodyne	ADRB2	45	49
O[C@H](CNCc1cc(F)cnc1Cl)COc1ccccc1	ZINC000819339237	DE	On-Demand	Anodyne	ADRB1	69	44
O[C@H](CNCc1cc(F)cnc1Cl)COc1ccccc1	ZINC000819339237	DE	On-Demand	Anodyne	ADRB3	44	44
O[C@H](CNCc1cc(F)cnc1Cl)COc1ccccc1	ZINC000819339237	DE	On-Demand	Anodyne	PDS	45	36
O[C@@H](CNCc1cc(F)cnc1Cl)COc1ccccc1	ZINC000819339238	DE	On-Demand	Anodyne	ADRB2	45	49
O[C@@H](CNCc1cc(F)cnc1Cl)COc1ccccc1	ZINC000819339238	DE	On-Demand	Anodyne	ADRB1	69	44
O[C@@H](CNCc1cc(F)cnc1Cl)COc1ccccc1	ZINC000819339238	DE	On-Demand	Anodyne	ADRB3	44	44
O[C@@H](CNCc1cc(F)cnc1Cl)COc1ccccc1	ZINC000819339238	DE	On-Demand	Anodyne	PDS	45	36
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCc1cc(F)cnc1Cl	ZINC000819339251	FE	On-Demand	Bother	ADRB1	48	38
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCc1cc(F)cnc1Cl	ZINC000819339252	FE	On-Demand	Bother	ADRB1	48	38
O=C(CCNCc1cc(F)cnc1Cl)Nc1cccc(C(F)(F)F)c1	ZINC000819339257	GI	On-Demand	Anodyne	LCK	25	41
O=C(CCNCc1cc(F)cnc1Cl)Nc1cccc(C(F)(F)F)c1	ZINC000819339257	GI	On-Demand	Anodyne	RAF1	16	41
O=C(CCNCc1cc(F)cnc1Cl)Nc1cccc(C(F)(F)F)c1	ZINC000819339257	GI	On-Demand	Anodyne	KDR	17	40
O=C(CCNCc1cc(F)cnc1Cl)Nc1cccc(C(F)(F)F)c1	ZINC000819339257	GI	On-Demand	Anodyne	TEK	26	40
O=C(CCNCc1cc(F)cnc1Cl)Nc1cccc(C(F)(F)F)c1	ZINC000819339257	GI	On-Demand	Anodyne	BTK	20	41
O=C(CCNCc1cc(F)cnc1Cl)Nc1cccc(C(F)(F)F)c1	ZINC000819339257	GI	On-Demand	Anodyne	RIPK1	49	38
O=c1ccc(Br)cn1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819339258	FF	On-Demand	Anodyne	ADRB1	42	48
O=c1ccc(Br)cn1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819339258	FF	On-Demand	Anodyne	ADRB3	56	48
O=c1ccc(Br)cn1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819339259	FF	On-Demand	Anodyne	ADRB1	42	48
O=c1ccc(Br)cn1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819339259	FF	On-Demand	Anodyne	ADRB3	56	48
COc1ccc(OC)c([C@H](O)CNC[C@@H](Cc2ccccc2)OC)c1	ZINC000819339292	EF	On-Demand	Anodyne	ADRB2	22	43
COc1ccc(OC)c([C@H](O)CNC[C@@H](Cc2ccccc2)OC)c1	ZINC000819339292	EF	On-Demand	Anodyne	ADRB3	24	42
COc1ccc(OC)c([C@H](O)CNC[C@H](Cc2ccccc2)OC)c1	ZINC000819339294	EF	On-Demand	Anodyne	ADRB2	22	43
COc1ccc(OC)c([C@H](O)CNC[C@H](Cc2ccccc2)OC)c1	ZINC000819339294	EF	On-Demand	Anodyne	ADRB3	24	42
C#Cc1ccc(CNC[C@@H](O)COc2ccc(C)cc2)cc1	ZINC000819339322	CF	On-Demand	Mild	ADRB2	49	53
C#Cc1ccc(CNC[C@@H](O)COc2ccc(C)cc2)cc1	ZINC000819339322	CF	On-Demand	Mild	ADRB1	69	48
C#Cc1ccc(CNC[C@@H](O)COc2ccc(C)cc2)cc1	ZINC000819339322	CF	On-Demand	Mild	ADRB3	43	47
C#Cc1ccc(CNC[C@H](O)COc2ccc(C)cc2)cc1	ZINC000819339323	CF	On-Demand	Mild	ADRB2	49	53
C#Cc1ccc(CNC[C@H](O)COc2ccc(C)cc2)cc1	ZINC000819339323	CF	On-Demand	Mild	ADRB1	69	48
C#Cc1ccc(CNC[C@H](O)COc2ccc(C)cc2)cc1	ZINC000819339323	CF	On-Demand	Mild	ADRB3	43	47
C#Cc1ccc(CNC[C@H](O)COCCCC)cc1	ZINC000819339337	CD	On-Demand	Mild	S1PR2	36	43
C#Cc1ccc(CNC[C@@H](O)COCCCC)cc1	ZINC000819339338	CD	On-Demand	Mild	S1PR2	36	43
C#Cc1ccc(CNC[C@H](O)COc2ccccc2C(C)C)cc1	ZINC000819339363	DG	On-Demand	Mild	ADRB2	44	48
C#Cc1ccc(CNC[C@H](O)COc2ccccc2C(C)C)cc1	ZINC000819339363	DG	On-Demand	Mild	ADRB1	62	37
C#Cc1ccc(CNC[C@H](O)COc2ccccc2C(C)C)cc1	ZINC000819339363	DG	On-Demand	Mild	ABCB1	22	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCn2c(nnc2-c2ccccc2)C1	ZINC000819339366	GE	On-Demand	Anodyne	P2RX7	29	44
CC(=O)c1cccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)c1	ZINC000819339371	FF	On-Demand	Anodyne	ADRB2	24	43
CC(=O)c1cccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)c1	ZINC000819339371	FF	On-Demand	Anodyne	ADRB1	54	38
CC(=O)c1cccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)c1	ZINC000819339371	FF	On-Demand	Anodyne	ABCB1	15	42
CC(=O)c1cccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)c1	ZINC000819339371	FF	On-Demand	Anodyne	PDS	67	38
CC(=O)c1cccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)c1	ZINC000819339372	FF	On-Demand	Anodyne	ADRB2	24	43
CC(=O)c1cccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)c1	ZINC000819339372	FF	On-Demand	Anodyne	ADRB1	54	38
CC(=O)c1cccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)c1	ZINC000819339372	FF	On-Demand	Anodyne	ABCB1	15	42
CC(=O)c1cccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)c1	ZINC000819339372	FF	On-Demand	Anodyne	PDS	67	38
CC(C)(C)OC(=O)CS(=O)(=O)CCNCC[C@@H]1CCc2ccccc21	ZINC000819339373	FE	On-Demand	Anodyne	NQO2	20	40
CC(C)(C)OC(=O)CS(=O)(=O)CCNCC[C@H]1CCc2ccccc21	ZINC000819339374	FE	On-Demand	Anodyne	NQO2	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)c1ccc(-n3cccn3)cc1)C2	ZINC000819339403	GF	On-Demand	Anodyne	ADAM17	15	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)c1ccc(-n3cccn3)cc1)C2	ZINC000819339403	GF	On-Demand	Anodyne	AMP1_PLAFQ	59	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)c1ccc(-n3cccn3)cc1)C2	ZINC000819339404	GF	On-Demand	Anodyne	ADAM17	15	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)c1ccc(-n3cccn3)cc1)C2	ZINC000819339404	GF	On-Demand	Anodyne	AMP1_PLAFQ	59	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)c1ccc(-n3cccn3)cc1)C2	ZINC000819339405	GF	On-Demand	Anodyne	ADAM17	15	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)c1ccc(-n3cccn3)cc1)C2	ZINC000819339405	GF	On-Demand	Anodyne	AMP1_PLAFQ	59	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)c1ccc(-n3cccn3)cc1)C2	ZINC000819339406	GF	On-Demand	Anodyne	ADAM17	15	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)c1ccc(-n3cccn3)cc1)C2	ZINC000819339406	GF	On-Demand	Anodyne	AMP1_PLAFQ	59	42
COc1cccc([S@@](=O)CC(=O)NCC(C)(C)SC)c1	ZINC000819339413	DE	On-Demand	Anodyne	DRD4	40	30
CCC[C@H](CNC[C@H](O)c1ccc(CC)cc1)OC	ZINC000819339431	CF	On-Demand	Anodyne	ADRB2	19	40
CCC[C@@H](CNC[C@H](O)c1ccc(CC)cc1)OC	ZINC000819339432	CF	On-Demand	Anodyne	ADRB2	19	40
CCC[C@H](CNC[C@@H](O)c1ccc(CC)cc1)OC	ZINC000819339433	CF	On-Demand	Anodyne	ADRB2	19	40
CCC[C@@H](CNC[C@@H](O)c1ccc(CC)cc1)OC	ZINC000819339434	CF	On-Demand	Anodyne	ADRB2	19	40
N#Cc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339440	EE	On-Demand	Mild	ADRB1	53	35
N#Cc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339441	EE	On-Demand	Mild	ADRB1	53	35
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC[C@@H]2CCc3ccccc32)CC1	ZINC000819339445	GH	On-Demand	Anodyne	GPR119	38	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC[C@H]2CCc3ccccc32)CC1	ZINC000819339446	GH	On-Demand	Anodyne	GPR119	38	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC[C@@H]2CCc3ccccc32)CC1	ZINC000819339447	GH	On-Demand	Anodyne	GPR119	38	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC[C@H]2CCc3ccccc32)CC1	ZINC000819339448	GH	On-Demand	Anodyne	GPR119	38	45
C#Cc1ccc(CNC[C@@H](O)COc2ccccc2C(C)C)cc1	ZINC000819339464	DG	On-Demand	Mild	ADRB2	44	48
C#Cc1ccc(CNC[C@@H](O)COc2ccccc2C(C)C)cc1	ZINC000819339464	DG	On-Demand	Mild	ADRB1	62	37
C#Cc1ccc(CNC[C@@H](O)COc2ccccc2C(C)C)cc1	ZINC000819339464	DG	On-Demand	Mild	ABCB1	22	44
C#Cc1ccc(CNC[C@@H](O)COc2ccccc2C)cc1	ZINC000819339484	CF	On-Demand	Mild	ADRB2	45	60
C#Cc1ccc(CNC[C@@H](O)COc2ccccc2C)cc1	ZINC000819339484	CF	On-Demand	Mild	ADRB1	63	38
C#Cc1ccc(CNC[C@@H](O)COc2ccccc2C)cc1	ZINC000819339484	CF	On-Demand	Mild	CYP2D6	15	42
C#Cc1ccc(CNC[C@H](O)COc2ccccc2C)cc1	ZINC000819339485	CF	On-Demand	Mild	ADRB2	45	60
C#Cc1ccc(CNC[C@H](O)COc2ccccc2C)cc1	ZINC000819339485	CF	On-Demand	Mild	ADRB1	63	38
C#Cc1ccc(CNC[C@H](O)COc2ccccc2C)cc1	ZINC000819339485	CF	On-Demand	Mild	CYP2D6	15	42
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCC(C)(C)c2ccccn2)CC1	ZINC000819339505	GG	On-Demand	Anodyne	GPR119	31	42
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCC(C)(C)c2ccccn2)CC1	ZINC000819339506	GG	On-Demand	Anodyne	GPR119	31	42
C[C@@H]1CCCC[C@@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000819339517	GD	On-Demand	Reactive	LPL	47	43
C[C@@H]1CCCC[C@@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000819339517	GD	On-Demand	Reactive	CNR2	16	61
C[C@@H]1CCCC[C@@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000819339517	GD	On-Demand	Reactive	EPHX2	25	42
C[C@@H]1CCCC[C@@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000819339517	GD	On-Demand	Reactive	LIPG	19	43
C[C@@H]1CCCC[C@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000819339519	GD	On-Demand	Reactive	LPL	47	43
C[C@@H]1CCCC[C@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000819339519	GD	On-Demand	Reactive	CNR2	16	61
C[C@@H]1CCCC[C@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000819339519	GD	On-Demand	Reactive	EPHX2	25	42
C[C@@H]1CCCC[C@H]1C(=O)NNc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000819339519	GD	On-Demand	Reactive	LIPG	19	43
C#Cc1ccc(CNC[C@H](O)COc2cccc(C(=O)OCC)c2)cc1	ZINC000819339531	FE	On-Demand	Mild	ADRB2	49	48
C#Cc1ccc(CNC[C@H](O)COc2cccc(C(=O)OCC)c2)cc1	ZINC000819339531	FE	On-Demand	Mild	ADRB1	70	43
C#Cc1ccc(CNC[C@H](O)COc2cccc(C(=O)OCC)c2)cc1	ZINC000819339531	FE	On-Demand	Mild	ADRB3	46	43
C#Cc1ccc(CNC[C@H](O)COc2cccc(C(=O)OCC)c2)cc1	ZINC000819339531	FE	On-Demand	Mild	ABCB1	17	42
C#Cc1ccc(CNC[C@H](O)COc2cccc(C(=O)OCC)c2)cc1	ZINC000819339531	FE	On-Demand	Mild	PDS	73	52
C#Cc1ccc(CNC[C@@H](O)COc2cccc(C(=O)OCC)c2)cc1	ZINC000819339532	FE	On-Demand	Mild	ADRB2	49	48
C#Cc1ccc(CNC[C@@H](O)COc2cccc(C(=O)OCC)c2)cc1	ZINC000819339532	FE	On-Demand	Mild	ADRB1	70	43
C#Cc1ccc(CNC[C@@H](O)COc2cccc(C(=O)OCC)c2)cc1	ZINC000819339532	FE	On-Demand	Mild	ADRB3	46	43
C#Cc1ccc(CNC[C@@H](O)COc2cccc(C(=O)OCC)c2)cc1	ZINC000819339532	FE	On-Demand	Mild	ABCB1	17	42
C#Cc1ccc(CNC[C@@H](O)COc2cccc(C(=O)OCC)c2)cc1	ZINC000819339532	FE	On-Demand	Mild	PDS	73	52
CS(=O)(=O)c1ccc([C@@H](O)CNCC[C@@H]2CCc3ccccc32)cc1	ZINC000819339582	FF	On-Demand	Anodyne	ADRB3	40	39
CS(=O)(=O)c1ccc([C@H](O)CNCC[C@@H]2CCc3ccccc32)cc1	ZINC000819339583	FF	On-Demand	Anodyne	ADRB3	40	39
CS(=O)(=O)c1ccc([C@H](O)CNCC[C@H]2CCc3ccccc32)cc1	ZINC000819339584	FF	On-Demand	Anodyne	ADRB3	40	39
CS(=O)(=O)c1ccc([C@@H](O)CNCC[C@H]2CCc3ccccc32)cc1	ZINC000819339585	FF	On-Demand	Anodyne	ADRB3	40	39
COc1cccc(OC)c1OC[C@H](O)CNCc1cc(F)cnc1Cl	ZINC000819339588	FE	On-Demand	Anodyne	ADRB1	46	33
COc1cccc(OC)c1OC[C@@H](O)CNCc1cc(F)cnc1Cl	ZINC000819339589	FE	On-Demand	Anodyne	ADRB1	46	33
O[C@H](CNCc1cc(F)cnc1Cl)COc1ccc(Cl)cc1	ZINC000819339590	EG	On-Demand	Anodyne	ADRB1	51	42
O[C@H](CNCc1cc(F)cnc1Cl)COc1ccc(Cl)cc1	ZINC000819339590	EG	On-Demand	Anodyne	GRIN1	25	42
O[C@H](CNCc1cc(F)cnc1Cl)COc1ccc(Cl)cc1	ZINC000819339590	EG	On-Demand	Anodyne	ADRB3	31	41
O[C@@H](CNCc1cc(F)cnc1Cl)COc1ccc(Cl)cc1	ZINC000819339591	EG	On-Demand	Anodyne	ADRB1	51	42
O[C@@H](CNCc1cc(F)cnc1Cl)COc1ccc(Cl)cc1	ZINC000819339591	EG	On-Demand	Anodyne	GRIN1	25	42
O[C@@H](CNCc1cc(F)cnc1Cl)COc1ccc(Cl)cc1	ZINC000819339591	EG	On-Demand	Anodyne	ADRB3	31	41
O[C@H](CNCc1cc(F)cnc1Cl)COc1cccc(C(F)(F)F)c1	ZINC000819339601	GG	On-Demand	Anodyne	PDS	57	46
O[C@@H](CNCc1cc(F)cnc1Cl)COc1cccc(C(F)(F)F)c1	ZINC000819339602	GG	On-Demand	Anodyne	PDS	57	46
CSC(C)(C)CNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819339657	DG	On-Demand	Anodyne	PDS	44	32
N#CCc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339664	EE	On-Demand	Mild	ADRB2	29	40
N#CCc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339664	EE	On-Demand	Mild	ADRB1	55	38
N#CCc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339665	EE	On-Demand	Mild	ADRB2	29	40
N#CCc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339665	EE	On-Demand	Mild	ADRB1	55	38
O=C(/C=C/[C@@H]1CCCO1)N(C[C@@H]1CCN(Cc2ccccc2)C1)CC(F)(F)F	ZINC000819339681	GH	On-Demand	Anodyne	ACHE	31	41
O=C(/C=C/[C@@H]1CCCO1)N(C[C@@H]1CCN(Cc2ccccc2)C1)CC(F)(F)F	ZINC000819339681	GH	On-Demand	Anodyne	SIGMAR1	27	43
O=C(/C=C\[C@@H]1CCCO1)N(C[C@H]1CCN(Cc2ccccc2)C1)CC(F)(F)F	ZINC000819339682	GH	On-Demand	Anodyne	ACHE	31	41
O=C(/C=C\[C@@H]1CCCO1)N(C[C@H]1CCN(Cc2ccccc2)C1)CC(F)(F)F	ZINC000819339682	GH	On-Demand	Anodyne	SIGMAR1	27	43
O=C(/C=C\[C@@H]1CCCO1)N(C[C@@H]1CCN(Cc2ccccc2)C1)CC(F)(F)F	ZINC000819339683	GH	On-Demand	Anodyne	ACHE	31	41
O=C(/C=C\[C@@H]1CCCO1)N(C[C@@H]1CCN(Cc2ccccc2)C1)CC(F)(F)F	ZINC000819339683	GH	On-Demand	Anodyne	SIGMAR1	27	43
O=C(/C=C/[C@@H]1CCCO1)N(C[C@H]1CCN(Cc2ccccc2)C1)CC(F)(F)F	ZINC000819339684	GH	On-Demand	Anodyne	ACHE	31	41
O=C(/C=C/[C@@H]1CCCO1)N(C[C@H]1CCN(Cc2ccccc2)C1)CC(F)(F)F	ZINC000819339684	GH	On-Demand	Anodyne	SIGMAR1	27	43
C#Cc1ccc(CNC[C@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819339703	DF	On-Demand	Mild	ADRB2	45	51
C#Cc1ccc(CNC[C@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819339703	DF	On-Demand	Mild	ADRB1	59	43
C#Cc1ccc(CNC[C@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819339703	DF	On-Demand	Mild	ADRB3	39	42
C#Cc1ccc(CNC[C@@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819339704	DF	On-Demand	Mild	ADRB2	45	51
C#Cc1ccc(CNC[C@@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819339704	DF	On-Demand	Mild	ADRB1	59	43
C#Cc1ccc(CNC[C@@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819339704	DF	On-Demand	Mild	ADRB3	39	42
O[C@H](CNCc1cccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819339766	EH	On-Demand	Anodyne	ADRB1	29	44
O[C@H](CNCc1cccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819339766	EH	On-Demand	Anodyne	ADRB3	42	44
O[C@@H](CNCc1cccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819339767	EH	On-Demand	Anodyne	ADRB1	29	44
O[C@@H](CNCc1cccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819339767	EH	On-Demand	Anodyne	ADRB3	42	44
C#Cc1ccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819339768	DE	On-Demand	Mild	ADRB2	45	44
C#Cc1ccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819339768	DE	On-Demand	Mild	ADRB1	75	44
C#Cc1ccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819339768	DE	On-Demand	Mild	ADRB3	45	44
C#Cc1ccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819339768	DE	On-Demand	Mild	ABCB1	21	45
C#Cc1ccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819339768	DE	On-Demand	Mild	PDS	63	38
C#Cc1ccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819339769	DE	On-Demand	Mild	ADRB2	45	44
C#Cc1ccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819339769	DE	On-Demand	Mild	ADRB1	75	44
C#Cc1ccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819339769	DE	On-Demand	Mild	ADRB3	45	44
C#Cc1ccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819339769	DE	On-Demand	Mild	ABCB1	21	45
C#Cc1ccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819339769	DE	On-Demand	Mild	PDS	63	38
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(C)(C)c2ccccn2)CC1	ZINC000819339777	GF	On-Demand	Anodyne	GRIN2B	19	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(C)(C)c2ccccn2)CC1	ZINC000819339777	GF	On-Demand	Anodyne	GPR119	57	50
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(C)(C)c2ccccn2)CC1	ZINC000819339777	GF	On-Demand	Anodyne	SFRP1	37	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(C)(C)c2ccccn2)CC1	ZINC000819339778	GF	On-Demand	Anodyne	GRIN2B	19	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(C)(C)c2ccccn2)CC1	ZINC000819339778	GF	On-Demand	Anodyne	GPR119	57	50
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(C)(C)c2ccccn2)CC1	ZINC000819339778	GF	On-Demand	Anodyne	SFRP1	37	41
CCC[C@@H](CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819339795	CF	On-Demand	Anodyne	ADRB2	20	42
CCC[C@@H](CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819339795	CF	On-Demand	Anodyne	ADRB1	37	45
CCC[C@@H](CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819339795	CF	On-Demand	Anodyne	ADRB3	54	45
CCC[C@H](CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819339796	CF	On-Demand	Anodyne	ADRB2	20	42
CCC[C@H](CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819339796	CF	On-Demand	Anodyne	ADRB1	37	45
CCC[C@H](CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819339796	CF	On-Demand	Anodyne	ADRB3	54	45
CCC[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819339797	CF	On-Demand	Anodyne	ADRB2	20	42
CCC[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819339797	CF	On-Demand	Anodyne	ADRB1	37	45
CCC[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819339797	CF	On-Demand	Anodyne	ADRB3	54	45
CCC[C@H](CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819339798	CF	On-Demand	Anodyne	ADRB2	20	42
CCC[C@H](CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819339798	CF	On-Demand	Anodyne	ADRB1	37	45
CCC[C@H](CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819339798	CF	On-Demand	Anodyne	ADRB3	54	45
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339802	FE	On-Demand	Anodyne	ADRB2	42	52
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339802	FE	On-Demand	Anodyne	ADRB1	78	52
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339802	FE	On-Demand	Anodyne	TSHR	47	31
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339802	FE	On-Demand	Anodyne	GRIN1	31	43
CC(=O)Nc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339802	FE	On-Demand	Anodyne	ADRB3	49	50
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339803	FE	On-Demand	Anodyne	ADRB2	42	52
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339803	FE	On-Demand	Anodyne	ADRB1	78	52
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339803	FE	On-Demand	Anodyne	TSHR	47	31
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339803	FE	On-Demand	Anodyne	GRIN1	31	43
CC(=O)Nc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339803	FE	On-Demand	Anodyne	ADRB3	49	50
CCC[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819339843	CE	On-Demand	Bother	CACNA1C	47	37
CCC[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819339843	CE	On-Demand	Bother	CACNA1D	74	37
CCC[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819339844	CE	On-Demand	Bother	CACNA1C	47	37
CCC[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819339844	CE	On-Demand	Bother	CACNA1D	74	37
CCC[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819339845	CE	On-Demand	Bother	CACNA1C	47	37
CCC[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819339845	CE	On-Demand	Bother	CACNA1D	74	37
CCC[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819339846	CE	On-Demand	Bother	CACNA1C	47	37
CCC[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819339846	CE	On-Demand	Bother	CACNA1D	74	37
CSC(C)(C)CNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819339851	CE	On-Demand	Anodyne	KCNK3	61	33
CSC(C)(C)CNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819339851	CE	On-Demand	Anodyne	KCNK9	42	33
O[C@H](CNC[C@H]1CCC[C@@H]1c1ccccc1)c1cccnc1	ZINC000819339891	CG	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNC[C@H]1CCC[C@@H]1c1ccccc1)c1cccnc1	ZINC000819339891	CG	On-Demand	Anodyne	ADRB1	24	44
O[C@H](CNC[C@H]1CCC[C@@H]1c1ccccc1)c1cccnc1	ZINC000819339891	CG	On-Demand	Anodyne	ADRB3	88	45
O[C@H](CNC[C@H]1CCC[C@H]1c1ccccc1)c1cccnc1	ZINC000819339892	CG	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNC[C@H]1CCC[C@H]1c1ccccc1)c1cccnc1	ZINC000819339892	CG	On-Demand	Anodyne	ADRB1	24	44
O[C@H](CNC[C@H]1CCC[C@H]1c1ccccc1)c1cccnc1	ZINC000819339892	CG	On-Demand	Anodyne	ADRB3	88	45
O[C@H](CNC[C@@H]1CCC[C@@H]1c1ccccc1)c1cccnc1	ZINC000819339893	CG	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNC[C@@H]1CCC[C@@H]1c1ccccc1)c1cccnc1	ZINC000819339893	CG	On-Demand	Anodyne	ADRB1	24	44
O[C@H](CNC[C@@H]1CCC[C@@H]1c1ccccc1)c1cccnc1	ZINC000819339893	CG	On-Demand	Anodyne	ADRB3	88	45
O[C@H](CNC[C@@H]1CCC[C@H]1c1ccccc1)c1cccnc1	ZINC000819339894	CG	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNC[C@@H]1CCC[C@H]1c1ccccc1)c1cccnc1	ZINC000819339894	CG	On-Demand	Anodyne	ADRB1	24	44
O[C@H](CNC[C@@H]1CCC[C@H]1c1ccccc1)c1cccnc1	ZINC000819339894	CG	On-Demand	Anodyne	ADRB3	88	45
C#Cc1ccc(CNC[C@H](O)COc2ccc(/C=C\C)cc2OC)cc1	ZINC000819339934	FG	On-Demand	Mild	ADRB2	15	61
C#Cc1ccc(CNC[C@H](O)COc2ccc(/C=C\C)cc2OC)cc1	ZINC000819339934	FG	On-Demand	Mild	ADRB1	15	61
C#Cc1ccc(CNC[C@@H](O)COc2ccc(/C=C/C)cc2OC)cc1	ZINC000819339935	FG	On-Demand	Mild	ADRB2	15	61
C#Cc1ccc(CNC[C@@H](O)COc2ccc(/C=C/C)cc2OC)cc1	ZINC000819339935	FG	On-Demand	Mild	ADRB1	15	61
C#Cc1ccc(CNC[C@@H](O)COc2ccc(/C=C\C)cc2OC)cc1	ZINC000819339936	FG	On-Demand	Mild	ADRB2	15	61
C#Cc1ccc(CNC[C@@H](O)COc2ccc(/C=C\C)cc2OC)cc1	ZINC000819339936	FG	On-Demand	Mild	ADRB1	15	61
C#Cc1ccc(CNC[C@H](O)COc2ccc(/C=C/C)cc2OC)cc1	ZINC000819339937	FG	On-Demand	Mild	ADRB2	15	61
C#Cc1ccc(CNC[C@H](O)COc2ccc(/C=C/C)cc2OC)cc1	ZINC000819339937	FG	On-Demand	Mild	ADRB1	15	61
Cc1cnc(CNC(=O)CC[C@@H](CC2CCCCC2)NC(=O)OC(C)(C)C)o1	ZINC000819339966	GI	On-Demand	Anodyne	CACNA1B	15	40
Cc1cnc(CNC(=O)CC[C@@H](CC2CCCCC2)NC(=O)OC(C)(C)C)o1	ZINC000819339966	GI	On-Demand	Anodyne	REN	58	42
Cc1cnc(CNC(=O)CC[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)o1	ZINC000819339967	GI	On-Demand	Anodyne	CACNA1B	15	40
Cc1cnc(CNC(=O)CC[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)o1	ZINC000819339967	GI	On-Demand	Anodyne	REN	58	42
COCCc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339988	FF	On-Demand	Anodyne	ADRB2	39	53
COCCc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339988	FF	On-Demand	Anodyne	ADRB1	70	53
COCCc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339988	FF	On-Demand	Anodyne	GRIN1	29	43
COCCc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339988	FF	On-Demand	Anodyne	ADRB3	44	44
COCCc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339989	FF	On-Demand	Anodyne	ADRB2	39	53
COCCc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339989	FF	On-Demand	Anodyne	ADRB1	70	53
COCCc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339989	FF	On-Demand	Anodyne	GRIN1	29	43
COCCc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819339989	FF	On-Demand	Anodyne	ADRB3	44	44
O[C@H](CNCc1cc(F)cnc1Cl)COc1ccccc1F	ZINC000819339998	EF	On-Demand	Anodyne	ADRB2	21	41
O[C@H](CNCc1cc(F)cnc1Cl)COc1ccccc1F	ZINC000819339998	EF	On-Demand	Anodyne	ADRB1	51	38
O[C@@H](CNCc1cc(F)cnc1Cl)COc1ccccc1F	ZINC000819339999	EF	On-Demand	Anodyne	ADRB2	21	41
O[C@@H](CNCc1cc(F)cnc1Cl)COc1ccccc1F	ZINC000819339999	EF	On-Demand	Anodyne	ADRB1	51	38
CON(C)C(=O)CCNCC[C@@H]1CCc2ccccc21	ZINC000819340057	CE	On-Demand	Anodyne	NQO2	22	43
CON(C)C(=O)CCNCC[C@H]1CCc2ccccc21	ZINC000819340058	CE	On-Demand	Anodyne	NQO2	22	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCn3c(nnc3-c3ccccc3)C1)C2	ZINC000819340072	GE	On-Demand	Anodyne	P2RX7	24	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCn3c(nnc3-c3ccccc3)C1)C2	ZINC000819340073	GE	On-Demand	Anodyne	P2RX7	24	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCc1cc(C2CC2)ccc1F	ZINC000819340078	FG	On-Demand	Anodyne	GPR119	15	45
CC(C)(C)OC(=O)NC[C@](C)(O)CNCc1cc(C2CC2)ccc1F	ZINC000819340079	FG	On-Demand	Anodyne	GPR119	15	45
O[C@@H](CNCc1cc(C2CC2)ccc1F)c1cccnc1	ZINC000819340086	CF	On-Demand	Anodyne	ADRB1	22	44
O[C@@H](CNCc1cc(C2CC2)ccc1F)c1cccnc1	ZINC000819340086	CF	On-Demand	Anodyne	ADRB3	83	44
O[C@H](CNCc1cc(C2CC2)ccc1F)c1cccnc1	ZINC000819340090	CF	On-Demand	Anodyne	ADRB1	22	44
O[C@H](CNCc1cc(C2CC2)ccc1F)c1cccnc1	ZINC000819340090	CF	On-Demand	Anodyne	ADRB3	83	44
Cc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819340117	DF	On-Demand	Anodyne	ADRB2	36	47
Cc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819340117	DF	On-Demand	Anodyne	ADRB1	54	39
Cc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819340117	DF	On-Demand	Anodyne	GRIN1	26	40
Cc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819340118	DF	On-Demand	Anodyne	ADRB2	36	47
Cc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819340118	DF	On-Demand	Anodyne	ADRB1	54	39
Cc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819340118	DF	On-Demand	Anodyne	GRIN1	26	40
CCOc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819340127	FF	On-Demand	Anodyne	ADRB2	35	41
CCOc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819340127	FF	On-Demand	Anodyne	ADRB1	53	40
CCOc1ccc(OC[C@@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819340127	FF	On-Demand	Anodyne	GRIN1	26	41
CCOc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819340128	FF	On-Demand	Anodyne	ADRB2	35	41
CCOc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819340128	FF	On-Demand	Anodyne	ADRB1	53	40
CCOc1ccc(OC[C@H](O)CNCc2cc(F)cnc2Cl)cc1	ZINC000819340128	FF	On-Demand	Anodyne	GRIN1	26	41
C#Cc1ccc(CNC[C@@H](O)COCc2ccccc2Cl)cc1	ZINC000819340184	EF	On-Demand	Mild	ADRB1	16	43
C#Cc1ccc(CNC[C@H](O)COCc2ccccc2Cl)cc1	ZINC000819340185	EF	On-Demand	Mild	ADRB1	16	43
C#Cc1ccc(CNC[C@H](O)CC)cc1	ZINC000819340231	BD	On-Demand	Mild	S1PR2	15	42
C#Cc1ccc(CNC[C@@H](O)CC)cc1	ZINC000819340232	BD	On-Demand	Mild	S1PR2	15	42
C#Cc1ccc(CNC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819340263	DE	On-Demand	Mild	ADRB2	47	46
C#Cc1ccc(CNC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819340263	DE	On-Demand	Mild	ADRB1	79	46
C#Cc1ccc(CNC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819340263	DE	On-Demand	Mild	ADRB3	48	46
C#Cc1ccc(CNC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819340263	DE	On-Demand	Mild	ABCB1	15	55
C#Cc1ccc(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819340264	DE	On-Demand	Mild	ADRB2	47	46
C#Cc1ccc(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819340264	DE	On-Demand	Mild	ADRB1	79	46
C#Cc1ccc(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819340264	DE	On-Demand	Mild	ADRB3	48	46
C#Cc1ccc(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819340264	DE	On-Demand	Mild	ABCB1	15	55
C#Cc1ccc(CNC[C@H](O)COc2ccc(CC=C)cc2OC)cc1	ZINC000819340285	FF	On-Demand	Mild	ADRB2	15	43
C#Cc1ccc(CNC[C@@H](O)COc2ccc(CC=C)cc2OC)cc1	ZINC000819340286	FF	On-Demand	Mild	ADRB2	15	43
O[C@H](CNCc1cccc(C(F)(F)F)n1)c1cccnc1	ZINC000819340357	CE	On-Demand	Anodyne	ADRB2	22	40
O[C@H](CNCc1cccc(C(F)(F)F)n1)c1cccnc1	ZINC000819340357	CE	On-Demand	Anodyne	ADRB1	24	45
O[C@H](CNCc1cccc(C(F)(F)F)n1)c1cccnc1	ZINC000819340357	CE	On-Demand	Anodyne	ADRB3	91	45
O[C@@H](CNCc1cccc(C(F)(F)F)n1)c1cccnc1	ZINC000819340358	CE	On-Demand	Anodyne	ADRB2	22	40
O[C@@H](CNCc1cccc(C(F)(F)F)n1)c1cccnc1	ZINC000819340358	CE	On-Demand	Anodyne	ADRB1	24	45
O[C@@H](CNCc1cccc(C(F)(F)F)n1)c1cccnc1	ZINC000819340358	CE	On-Demand	Anodyne	ADRB3	91	45
C#Cc1ccc(CNC[C@H](O)COc2ccc(CCOC)cc2)cc1	ZINC000819340381	EE	On-Demand	Mild	ADRB2	46	61
C#Cc1ccc(CNC[C@H](O)COc2ccc(CCOC)cc2)cc1	ZINC000819340381	EE	On-Demand	Mild	ADRB1	73	61
C#Cc1ccc(CNC[C@H](O)COc2ccc(CCOC)cc2)cc1	ZINC000819340381	EE	On-Demand	Mild	ADRB3	46	50
C#Cc1ccc(CNC[C@@H](O)COc2ccc(CCOC)cc2)cc1	ZINC000819340382	EE	On-Demand	Mild	ADRB2	46	61
C#Cc1ccc(CNC[C@@H](O)COc2ccc(CCOC)cc2)cc1	ZINC000819340382	EE	On-Demand	Mild	ADRB1	73	61
C#Cc1ccc(CNC[C@@H](O)COc2ccc(CCOC)cc2)cc1	ZINC000819340382	EE	On-Demand	Mild	ADRB3	46	50
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)NCC(F)F)nn2)C1	ZINC000819340415	FD	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)NCC(F)F)nn2)C1	ZINC000819340416	FD	On-Demand	Anodyne	GPR119	23	40
C#Cc1ccc(CNC[C@@H](O)COc2ccc(OCC)cc2)cc1	ZINC000819340444	EF	On-Demand	Mild	ADRB2	49	51
C#Cc1ccc(CNC[C@@H](O)COc2ccc(OCC)cc2)cc1	ZINC000819340444	EF	On-Demand	Mild	ADRB1	68	51
C#Cc1ccc(CNC[C@@H](O)COc2ccc(OCC)cc2)cc1	ZINC000819340444	EF	On-Demand	Mild	ADRB3	43	47
C#Cc1ccc(CNC[C@H](O)COc2ccc(OCC)cc2)cc1	ZINC000819340445	EF	On-Demand	Mild	ADRB2	49	51
C#Cc1ccc(CNC[C@H](O)COc2ccc(OCC)cc2)cc1	ZINC000819340445	EF	On-Demand	Mild	ADRB1	68	51
C#Cc1ccc(CNC[C@H](O)COc2ccc(OCC)cc2)cc1	ZINC000819340445	EF	On-Demand	Mild	ADRB3	43	47
C#Cc1ccc(CNC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819340490	EF	On-Demand	Mild	ADRB2	39	45
C#Cc1ccc(CNC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819340490	EF	On-Demand	Mild	ADRB1	58	45
C#Cc1ccc(CNC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819340490	EF	On-Demand	Mild	ADRB3	38	44
C#Cc1ccc(CNC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819340491	EF	On-Demand	Mild	ADRB2	39	45
C#Cc1ccc(CNC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819340491	EF	On-Demand	Mild	ADRB1	58	45
C#Cc1ccc(CNC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819340491	EF	On-Demand	Mild	ADRB3	38	44
CN(C(=O)c1cc2c(cn1)OCCO2)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819340506	FD	On-Demand	Anodyne	GPR119	44	41
CN(C(=O)c1cc2c(cn1)OCCO2)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819340507	FD	On-Demand	Anodyne	GPR119	44	41
CC[C@H](C)[C@H](CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819340508	CG	On-Demand	Anodyne	ADRB2	26	45
CC[C@H](C)[C@H](CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819340508	CG	On-Demand	Anodyne	ADRB1	41	45
CC[C@H](C)[C@H](CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819340508	CG	On-Demand	Anodyne	ADRB3	59	45
CC[C@H](C)[C@H](CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819340509	CG	On-Demand	Anodyne	ADRB2	26	45
CC[C@H](C)[C@H](CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819340509	CG	On-Demand	Anodyne	ADRB1	41	45
CC[C@H](C)[C@H](CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819340509	CG	On-Demand	Anodyne	ADRB3	59	45
O[C@H](CNCCOc1ccc(Cl)c(Cl)c1)C1CC1	ZINC000819340514	CF	On-Demand	Anodyne	DRD4	15	41
O[C@@H](CNCCOc1ccc(Cl)c(Cl)c1)C1CC1	ZINC000819340515	CF	On-Demand	Anodyne	DRD4	15	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ccc(Cl)c(Cl)c2)c1	ZINC000819340516	FH	On-Demand	Bother	ADRB2	21	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ccc(Cl)c(Cl)c2)c1	ZINC000819340516	FH	On-Demand	Bother	ADRB1	44	47
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ccc(Cl)c(Cl)c2)c1	ZINC000819340516	FH	On-Demand	Bother	ADRB3	49	47
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ccc(Cl)c(Cl)c2)c1	ZINC000819340517	FH	On-Demand	Bother	ADRB2	21	41
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ccc(Cl)c(Cl)c2)c1	ZINC000819340517	FH	On-Demand	Bother	ADRB1	44	47
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ccc(Cl)c(Cl)c2)c1	ZINC000819340517	FH	On-Demand	Bother	ADRB3	49	47
COC[C@@H](O)CNCc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C	ZINC000819340519	FE	On-Demand	Anodyne	GPR119	18	41
CN(C(=O)c1coc(=O)c2ccccc12)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819340530	FF	On-Demand	Anodyne	CCR8	31	40
CN(C(=O)c1coc(=O)c2ccccc12)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819340531	FF	On-Demand	Anodyne	CCR8	31	40
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1cccc(F)c1	ZINC000819340537	EG	On-Demand	Anodyne	ADRB2	25	41
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1cccc(F)c1	ZINC000819340537	EG	On-Demand	Anodyne	ADRB1	50	48
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1cccc(F)c1	ZINC000819340537	EG	On-Demand	Anodyne	DRD4	15	43
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1cccc(F)c1	ZINC000819340537	EG	On-Demand	Anodyne	ADRB3	53	48
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1cccc(F)c1	ZINC000819340538	EG	On-Demand	Anodyne	ADRB2	25	41
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1cccc(F)c1	ZINC000819340538	EG	On-Demand	Anodyne	ADRB1	50	48
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1cccc(F)c1	ZINC000819340538	EG	On-Demand	Anodyne	DRD4	15	43
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1cccc(F)c1	ZINC000819340538	EG	On-Demand	Anodyne	ADRB3	53	48
O[C@H](CNCC1=CCOCC1)c1cccnc1	ZINC000819340539	BD	On-Demand	Anodyne	ADRB2	19	40
O[C@H](CNCC1=CCOCC1)c1cccnc1	ZINC000819340539	BD	On-Demand	Anodyne	ADRB1	21	40
O[C@H](CNCC1=CCOCC1)c1cccnc1	ZINC000819340539	BD	On-Demand	Anodyne	ADRB3	84	42
O[C@@H](CNCC1=CCOCC1)c1cccnc1	ZINC000819340540	BD	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNCC1=CCOCC1)c1cccnc1	ZINC000819340540	BD	On-Demand	Anodyne	ADRB1	21	40
O[C@@H](CNCC1=CCOCC1)c1cccnc1	ZINC000819340540	BD	On-Demand	Anodyne	ADRB3	84	42
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1ccccc1	ZINC000819340549	DG	On-Demand	Anodyne	ADRB2	33	43
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1ccccc1	ZINC000819340549	DG	On-Demand	Anodyne	ADRB1	63	49
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1ccccc1	ZINC000819340549	DG	On-Demand	Anodyne	DRD4	20	47
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1ccccc1	ZINC000819340549	DG	On-Demand	Anodyne	ADRB3	65	49
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1ccccc1	ZINC000819340550	DG	On-Demand	Anodyne	ADRB2	33	43
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1ccccc1	ZINC000819340550	DG	On-Demand	Anodyne	ADRB1	63	49
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1ccccc1	ZINC000819340550	DG	On-Demand	Anodyne	DRD4	20	47
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1ccccc1	ZINC000819340550	DG	On-Demand	Anodyne	ADRB3	65	49
CC[C@H](C)[C@H](CNC[C@H](O)c1cccnc1)OC	ZINC000819340574	CD	On-Demand	Anodyne	ADRB2	26	46
CC[C@H](C)[C@H](CNC[C@H](O)c1cccnc1)OC	ZINC000819340574	CD	On-Demand	Anodyne	ADRB1	26	46
CC[C@H](C)[C@H](CNC[C@H](O)c1cccnc1)OC	ZINC000819340574	CD	On-Demand	Anodyne	ADRB3	94	46
CC[C@H](C)[C@H](CNC[C@H](O)c1cccnc1)OC	ZINC000819340574	CD	On-Demand	Anodyne	KCNA5	21	40
CC[C@H](C)[C@H](CNC[C@@H](O)c1cccnc1)OC	ZINC000819340575	CD	On-Demand	Anodyne	ADRB2	26	46
CC[C@H](C)[C@H](CNC[C@@H](O)c1cccnc1)OC	ZINC000819340575	CD	On-Demand	Anodyne	ADRB1	26	46
CC[C@H](C)[C@H](CNC[C@@H](O)c1cccnc1)OC	ZINC000819340575	CD	On-Demand	Anodyne	ADRB3	94	46
CC[C@H](C)[C@H](CNC[C@@H](O)c1cccnc1)OC	ZINC000819340575	CD	On-Demand	Anodyne	KCNA5	21	40
CSc1ccc([C@H](CNC(=O)c2ccc(N3CCOCC3)nc2)N(C)C)cc1	ZINC000819340601	HF	On-Demand	Anodyne	HPGDS	22	44
CSc1ccc([C@@H](CNC(=O)c2ccc(N3CCOCC3)nc2)N(C)C)cc1	ZINC000819340602	HF	On-Demand	Anodyne	HPGDS	22	44
CC(C)(C)OC(=O)N1CCCc2cc(CNC[C@@H](O)C3CC3)ccc21	ZINC000819340609	EG	On-Demand	Anodyne	GPR119	23	43
CC(C)(C)OC(=O)N1CCCc2cc(CNC[C@H](O)C3CC3)ccc21	ZINC000819340610	EG	On-Demand	Anodyne	GPR119	23	43
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1c(F)cccc1F	ZINC000819340627	EG	On-Demand	Anodyne	ADRB1	37	41
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1c(F)cccc1F	ZINC000819340627	EG	On-Demand	Anodyne	DRD4	16	43
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1c(F)cccc1F	ZINC000819340627	EG	On-Demand	Anodyne	ADRB3	27	41
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1c(F)cccc1F	ZINC000819340628	EG	On-Demand	Anodyne	ADRB1	37	41
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1c(F)cccc1F	ZINC000819340628	EG	On-Demand	Anodyne	DRD4	16	43
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1c(F)cccc1F	ZINC000819340628	EG	On-Demand	Anodyne	ADRB3	27	41
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(-n2cccn2)c1	ZINC000819340642	DF	On-Demand	Anodyne	KCNQ2	48	33
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(-n2cccn2)c1	ZINC000819340642	DF	On-Demand	Anodyne	AMP1_PLAFQ	52	37
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(-n2cccn2)c1	ZINC000819340643	DF	On-Demand	Anodyne	KCNQ2	48	33
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(-n2cccn2)c1	ZINC000819340643	DF	On-Demand	Anodyne	AMP1_PLAFQ	52	37
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(-n2cccn2)c1	ZINC000819340644	DF	On-Demand	Anodyne	KCNQ2	48	33
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(-n2cccn2)c1	ZINC000819340644	DF	On-Demand	Anodyne	AMP1_PLAFQ	52	37
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(-n2cccn2)c1	ZINC000819340645	DF	On-Demand	Anodyne	KCNQ2	48	33
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(-n2cccn2)c1	ZINC000819340645	DF	On-Demand	Anodyne	AMP1_PLAFQ	52	37
C[C@@H](NCCS(=O)(=O)c1ccc(F)cc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819340662	FE	On-Demand	Anodyne	PAPA1_CARPA	29	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1=CCOCC1	ZINC000819340684	GE	On-Demand	Anodyne	CTSD	89	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1=CCOCC1	ZINC000819340684	GE	On-Demand	Anodyne	PGC	58	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1=CCOCC1	ZINC000819340684	GE	On-Demand	Anodyne	PAPA1_CARPA	33	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1=CCOCC1	ZINC000819340684	GE	On-Demand	Anodyne	BACE2	55	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1=CCOCC1	ZINC000819340684	GE	On-Demand	Anodyne	REN	83	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1=CCOCC1	ZINC000819340684	GE	On-Demand	Anodyne	REN1	25	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1=CCOCC1	ZINC000819340684	GE	On-Demand	Anodyne	BACE1	90	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1=CCOCC1	ZINC000819340684	GE	On-Demand	Anodyne	FPR1	50	39
CN(C(=O)Cc1nsc2ccccc12)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819340693	GG	On-Demand	Anodyne	GPR119	42	39
CN(C(=O)Cc1nsc2ccccc12)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819340695	GG	On-Demand	Anodyne	GPR119	42	39
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)ccn1	ZINC000819340703	GF	On-Demand	Anodyne	CTSD	90	43
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)ccn1	ZINC000819340703	GF	On-Demand	Anodyne	PGC	55	38
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)ccn1	ZINC000819340703	GF	On-Demand	Anodyne	PAPA1_CARPA	32	43
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)ccn1	ZINC000819340703	GF	On-Demand	Anodyne	BACE2	49	42
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)ccn1	ZINC000819340703	GF	On-Demand	Anodyne	REN	78	46
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)ccn1	ZINC000819340703	GF	On-Demand	Anodyne	REN1	23	44
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)ccn1	ZINC000819340703	GF	On-Demand	Anodyne	BACE1	97	47
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)ccn1	ZINC000819340703	GF	On-Demand	Anodyne	FPR1	48	41
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)ccn1	ZINC000819340703	GF	On-Demand	Anodyne	PLM2_PLAFA	45	37
CC(C)(C)OC(=O)N1CCCc2cc(CNC[C@H](O)c3cccnc3)ccc21	ZINC000819340707	GH	On-Demand	Anodyne	ADRB1	33	41
CC(C)(C)OC(=O)N1CCCc2cc(CNC[C@H](O)c3cccnc3)ccc21	ZINC000819340707	GH	On-Demand	Anodyne	ADRB3	108	48
CC(C)(C)OC(=O)N1CCCc2cc(CNC[C@@H](O)c3cccnc3)ccc21	ZINC000819340709	GH	On-Demand	Anodyne	ADRB1	33	41
CC(C)(C)OC(=O)N1CCCc2cc(CNC[C@@H](O)c3cccnc3)ccc21	ZINC000819340709	GH	On-Demand	Anodyne	ADRB3	108	48
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1ccc(F)cc1F	ZINC000819340731	EG	On-Demand	Anodyne	ADRB1	34	41
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1ccc(F)cc1F	ZINC000819340731	EG	On-Demand	Anodyne	ADRB3	27	41
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1ccc(F)cc1F	ZINC000819340733	EG	On-Demand	Anodyne	ADRB1	34	41
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1ccc(F)cc1F	ZINC000819340733	EG	On-Demand	Anodyne	ADRB3	27	41
CSc1ccc([C@H](CNC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)N(C)C)cc1	ZINC000819340786	IJ	On-Demand	Anodyne	KCNK3	57	33
CSc1ccc([C@@H](CNC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)N(C)C)cc1	ZINC000819340787	IJ	On-Demand	Anodyne	KCNK3	57	33
Cc1cc(CNC[C@H](O)c2cccc(Cl)c2)ccn1	ZINC000819340797	CF	On-Demand	Anodyne	ADRB2	17	43
Cc1cc(CNC[C@H](O)c2cccc(Cl)c2)ccn1	ZINC000819340797	CF	On-Demand	Anodyne	ADRB1	38	44
Cc1cc(CNC[C@H](O)c2cccc(Cl)c2)ccn1	ZINC000819340797	CF	On-Demand	Anodyne	ADRB3	52	44
Cc1cc(CNC[C@@H](O)c2cccc(Cl)c2)ccn1	ZINC000819340798	CF	On-Demand	Anodyne	ADRB2	17	43
Cc1cc(CNC[C@@H](O)c2cccc(Cl)c2)ccn1	ZINC000819340798	CF	On-Demand	Anodyne	ADRB1	38	44
Cc1cc(CNC[C@@H](O)c2cccc(Cl)c2)ccn1	ZINC000819340798	CF	On-Demand	Anodyne	ADRB3	52	44
CC(C)(C)OC(=O)NCC[C@@H](NC[C@@H](O)c1cccnc1)C(F)F	ZINC000819340816	EE	On-Demand	Anodyne	ADRB1	20	45
CC(C)(C)OC(=O)NCC[C@@H](NC[C@@H](O)c1cccnc1)C(F)F	ZINC000819340816	EE	On-Demand	Anodyne	ADRB3	71	45
CC(C)(C)OC(=O)NCC[C@@H](NC[C@H](O)c1cccnc1)C(F)F	ZINC000819340819	EE	On-Demand	Anodyne	ADRB1	20	45
CC(C)(C)OC(=O)NCC[C@@H](NC[C@H](O)c1cccnc1)C(F)F	ZINC000819340819	EE	On-Demand	Anodyne	ADRB3	71	45
CC(C)(C)OC(=O)NCC[C@H](NC[C@@H](O)c1cccnc1)C(F)F	ZINC000819340821	EE	On-Demand	Anodyne	ADRB1	20	45
CC(C)(C)OC(=O)NCC[C@H](NC[C@@H](O)c1cccnc1)C(F)F	ZINC000819340821	EE	On-Demand	Anodyne	ADRB3	71	45
CC(C)(C)OC(=O)NCC[C@H](NC[C@H](O)c1cccnc1)C(F)F	ZINC000819340822	EE	On-Demand	Anodyne	ADRB1	20	45
CC(C)(C)OC(=O)NCC[C@H](NC[C@H](O)c1cccnc1)C(F)F	ZINC000819340822	EE	On-Demand	Anodyne	ADRB3	71	45
Cc1ccc(OC[C@H](O)CN[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819340839	FF	On-Demand	Anodyne	ADRB2	39	62
Cc1ccc(OC[C@H](O)CN[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819340839	FF	On-Demand	Anodyne	ADRB1	42	51
Cc1ccc(OC[C@H](O)CN[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819340839	FF	On-Demand	Anodyne	ADRB3	19	42
CON(C)C(=O)CCNCCOc1ccc(Cl)c(Cl)c1	ZINC000819340841	DE	On-Demand	Anodyne	DRD4	17	44
CON(C)C(=O)CCNCCOc1ccc(F)c(Cl)c1	ZINC000819340849	DD	On-Demand	Anodyne	DRD4	16	43
Cc1ccc(OC[C@H](O)CN[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819340860	FF	On-Demand	Anodyne	ADRB2	39	62
Cc1ccc(OC[C@H](O)CN[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819340860	FF	On-Demand	Anodyne	ADRB1	42	51
Cc1ccc(OC[C@H](O)CN[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819340860	FF	On-Demand	Anodyne	ADRB3	19	42
Cc1ccc(OC[C@H](O)CN[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819340864	FF	On-Demand	Anodyne	ADRB2	39	62
Cc1ccc(OC[C@H](O)CN[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819340864	FF	On-Demand	Anodyne	ADRB1	42	51
Cc1ccc(OC[C@H](O)CN[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819340864	FF	On-Demand	Anodyne	ADRB3	19	42
Cc1ccc(OC[C@H](O)CN[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819340867	FF	On-Demand	Anodyne	ADRB2	39	62
Cc1ccc(OC[C@H](O)CN[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819340867	FF	On-Demand	Anodyne	ADRB1	42	51
Cc1ccc(OC[C@H](O)CN[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819340867	FF	On-Demand	Anodyne	ADRB3	19	42
C[C@H](NC[C@H](O)c1ccc(F)cc1Cl)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819340868	FG	On-Demand	Anodyne	PAPA1_CARPA	28	41
C[C@H](NC[C@H](O)c1ccc(F)cc1Cl)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819340869	FG	On-Demand	Anodyne	PAPA1_CARPA	28	41
CC[C@H](O)CNCc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C	ZINC000819340874	EG	On-Demand	Anodyne	GPR119	15	40
CC[C@@H](O)CNCc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C	ZINC000819340876	EG	On-Demand	Anodyne	GPR119	15	40
CC[C@@H](CNC[C@@H](C)O)NC(=O)OC(C)(C)C	ZINC000819340909	BD	On-Demand	Anodyne	CTSK	19	53
CC[C@@H](CNC[C@@H](C)O)NC(=O)OC(C)(C)C	ZINC000819340909	BD	On-Demand	Anodyne	ECE1	30	43
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1cccnc1	ZINC000819340910	DF	On-Demand	Anodyne	ADRB2	39	58
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1cccnc1	ZINC000819340910	DF	On-Demand	Anodyne	ADRB1	57	58
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1cccnc1	ZINC000819340910	DF	On-Demand	Anodyne	DRD4	15	40
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1cccnc1	ZINC000819340910	DF	On-Demand	Anodyne	ADRB3	122	60
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1cccnc1	ZINC000819340912	DF	On-Demand	Anodyne	ADRB2	39	58
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1cccnc1	ZINC000819340912	DF	On-Demand	Anodyne	ADRB1	57	58
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1cccnc1	ZINC000819340912	DF	On-Demand	Anodyne	DRD4	15	40
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1cccnc1	ZINC000819340912	DF	On-Demand	Anodyne	ADRB3	122	60
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1ccccc1F	ZINC000819340914	EG	On-Demand	Anodyne	ADRB2	19	42
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1ccccc1F	ZINC000819340914	EG	On-Demand	Anodyne	ADRB1	41	42
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1ccccc1F	ZINC000819340914	EG	On-Demand	Anodyne	DRD4	18	46
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1ccccc1F	ZINC000819340914	EG	On-Demand	Anodyne	ADRB3	30	41
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1ccccc1F	ZINC000819340916	EG	On-Demand	Anodyne	ADRB2	19	42
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1ccccc1F	ZINC000819340916	EG	On-Demand	Anodyne	ADRB1	41	42
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1ccccc1F	ZINC000819340916	EG	On-Demand	Anodyne	DRD4	18	46
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1ccccc1F	ZINC000819340916	EG	On-Demand	Anodyne	ADRB3	30	41
CC[C@@H](CNC[C@H](O)c1cccc(Br)c1)NC(=O)OC(C)(C)C	ZINC000819340917	GG	On-Demand	Anodyne	PAPA1_CARPA	29	43
CC[C@@H](CNC[C@@H](O)c1cccc(Br)c1)NC(=O)OC(C)(C)C	ZINC000819340920	GG	On-Demand	Anodyne	PAPA1_CARPA	29	43
CC[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C	ZINC000819340922	FF	On-Demand	Bother	CACNA1D	51	32
CC[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C	ZINC000819340927	FF	On-Demand	Bother	CACNA1D	51	32
CC(=O)Nc1cccc(CC(=O)N(C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819340929	GF	On-Demand	Anodyne	CCR3	23	40
CC(=O)Nc1cccc(CC(=O)N(C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819340929	GF	On-Demand	Anodyne	CCR5	18	46
CC(=O)Nc1cccc(CC(=O)N(C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819340929	GF	On-Demand	Anodyne	GPR119	43	49
CC(=O)Nc1cccc(CC(=O)N(C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819340931	GF	On-Demand	Anodyne	CCR3	23	40
CC(=O)Nc1cccc(CC(=O)N(C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819340931	GF	On-Demand	Anodyne	CCR5	18	46
CC(=O)Nc1cccc(CC(=O)N(C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819340931	GF	On-Demand	Anodyne	GPR119	43	49
O=[N+]([O-])c1ccc([C@@H](O)CNCCOc2ccc(F)c(Cl)c2)cc1	ZINC000819340941	FG	On-Demand	Bother	ADRB1	30	41
O=[N+]([O-])c1ccc([C@@H](O)CNCCOc2ccc(F)c(Cl)c2)cc1	ZINC000819340941	FG	On-Demand	Bother	ADRB3	30	41
O=[N+]([O-])c1ccc([C@H](O)CNCCOc2ccc(F)c(Cl)c2)cc1	ZINC000819340943	FG	On-Demand	Bother	ADRB1	30	41
O=[N+]([O-])c1ccc([C@H](O)CNCCOc2ccc(F)c(Cl)c2)cc1	ZINC000819340943	FG	On-Demand	Bother	ADRB3	30	41
CC[C@@H](CNC[C@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819340971	DE	On-Demand	Anodyne	ADRB2	20	41
CC[C@@H](CNC[C@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819340971	DE	On-Demand	Anodyne	ADRB1	23	42
CC[C@@H](CNC[C@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819340971	DE	On-Demand	Anodyne	ADRB3	89	42
CC[C@@H](CNC[C@@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819340973	DE	On-Demand	Anodyne	ADRB2	20	41
CC[C@@H](CNC[C@@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819340973	DE	On-Demand	Anodyne	ADRB1	23	42
CC[C@@H](CNC[C@@H](O)c1cccnc1)NC(=O)OC(C)(C)C	ZINC000819340973	DE	On-Demand	Anodyne	ADRB3	89	42
O[C@H](CNCc1ccnc(C(F)(F)F)c1)c1cccnc1	ZINC000819340984	CE	On-Demand	Anodyne	ADRB2	24	42
O[C@H](CNCc1ccnc(C(F)(F)F)c1)c1cccnc1	ZINC000819340984	CE	On-Demand	Anodyne	ADRB1	26	45
O[C@H](CNCc1ccnc(C(F)(F)F)c1)c1cccnc1	ZINC000819340984	CE	On-Demand	Anodyne	ADRB3	96	45
O[C@@H](CNCc1ccnc(C(F)(F)F)c1)c1cccnc1	ZINC000819340985	CE	On-Demand	Anodyne	ADRB2	24	42
O[C@@H](CNCc1ccnc(C(F)(F)F)c1)c1cccnc1	ZINC000819340985	CE	On-Demand	Anodyne	ADRB1	26	45
O[C@@H](CNCc1ccnc(C(F)(F)F)c1)c1cccnc1	ZINC000819340985	CE	On-Demand	Anodyne	ADRB3	96	45
CSc1ccc([C@@H](CNC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)N(C)C)cc1	ZINC000819341040	HF	On-Demand	Anodyne	GPR119	15	41
CSc1ccc([C@@H](CNC(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCO2)N(C)C)cc1	ZINC000819341041	HF	On-Demand	Anodyne	GPR119	15	41
CSc1ccc([C@H](CNC(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)N(C)C)cc1	ZINC000819341042	HF	On-Demand	Anodyne	GPR119	15	41
CSc1ccc([C@H](CNC(=O)[C@H]2CN(C(=O)OC(C)(C)C)CCO2)N(C)C)cc1	ZINC000819341043	HF	On-Demand	Anodyne	GPR119	15	41
C[C@@H](CNCc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000819341115	GF	On-Demand	Anodyne	GPR119	26	45
C[C@H](CNCc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000819341116	GF	On-Demand	Anodyne	GPR119	26	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2nc(C3CC3)n[nH]2)CC1	ZINC000819341117	FD	On-Demand	Anodyne	GPR119	25	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2nc(C3CC3)n[nH]2)CC1	ZINC000819341118	FD	On-Demand	Anodyne	GPR119	25	41
C[C@@H](NCCC(=O)Nc1ccc(Cl)cc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341138	FH	On-Demand	Anodyne	LTA4H	16	41
C[C@@H](NCCC(=O)Nc1ccc(Cl)cc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341138	FH	On-Demand	Anodyne	FPR1	26	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1coc(-c3ccc(C)cc3)n1)C2	ZINC000819341142	GG	On-Demand	Anodyne	PDE8B	57	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1coc(-c3ccc(C)cc3)n1)C2	ZINC000819341143	GG	On-Demand	Anodyne	PDE8B	57	34
O[C@H](CNCc1nc(C2CC2)n[nH]1)c1cccc(Cl)c1	ZINC000819341144	CE	On-Demand	Anodyne	ADRB3	41	39
O[C@H](CNCc1nc(C2CC2)n[nH]1)c1cccc(Cl)c1	ZINC000819341144	CE	On-Demand	Anodyne	CYP3A4	45	34
O[C@@H](CNCc1nc(C2CC2)n[nH]1)c1cccc(Cl)c1	ZINC000819341145	CE	On-Demand	Anodyne	ADRB3	41	39
O[C@@H](CNCc1nc(C2CC2)n[nH]1)c1cccc(Cl)c1	ZINC000819341145	CE	On-Demand	Anodyne	CYP3A4	45	34
COc1ccc(OC)c([C@H](O)CNCCOc2ccc(F)c(Cl)c2)c1	ZINC000819341179	FG	On-Demand	Anodyne	ADRB2	18	42
COc1ccc(OC)c([C@H](O)CNCCOc2ccc(F)c(Cl)c2)c1	ZINC000819341179	FG	On-Demand	Anodyne	ADRB1	27	40
COc1ccc(OC)c([C@H](O)CNCCOc2ccc(F)c(Cl)c2)c1	ZINC000819341179	FG	On-Demand	Anodyne	ADRB3	21	40
CC[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819341204	FG	On-Demand	Anodyne	PGC	43	33
CC[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819341204	FG	On-Demand	Anodyne	PAPA1_CARPA	33	42
CC[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819341204	FG	On-Demand	Anodyne	CTSL	19	43
CC[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819341204	FG	On-Demand	Anodyne	REN	50	41
CC[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819341204	FG	On-Demand	Anodyne	FPR1	46	42
CC[C@@H](CNC[C@@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819341204	FG	On-Demand	Anodyne	PDS	70	39
CC[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819341206	FG	On-Demand	Anodyne	PGC	43	33
CC[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819341206	FG	On-Demand	Anodyne	PAPA1_CARPA	33	42
CC[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819341206	FG	On-Demand	Anodyne	CTSL	19	43
CC[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819341206	FG	On-Demand	Anodyne	REN	50	41
CC[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819341206	FG	On-Demand	Anodyne	FPR1	46	42
CC[C@@H](CNC[C@H](O)Cc1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819341206	FG	On-Demand	Anodyne	PDS	70	39
O[C@H](CNCc1ccnc(C(F)(F)F)c1)c1cccc(Cl)c1	ZINC000819341215	EH	On-Demand	Anodyne	ADRB1	32	45
O[C@H](CNCc1ccnc(C(F)(F)F)c1)c1cccc(Cl)c1	ZINC000819341215	EH	On-Demand	Anodyne	ADRB3	44	45
O[C@@H](CNCc1ccnc(C(F)(F)F)c1)c1cccc(Cl)c1	ZINC000819341216	EH	On-Demand	Anodyne	ADRB1	32	45
O[C@@H](CNCc1ccnc(C(F)(F)F)c1)c1cccc(Cl)c1	ZINC000819341216	EH	On-Demand	Anodyne	ADRB3	44	45
C[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341222	GH	On-Demand	Anodyne	PDS	40	36
C[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341225	GH	On-Demand	Anodyne	PDS	40	36
C[C@H](NC[C@H](O)COc1ccccc1Cl)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341228	FF	On-Demand	Anodyne	ADRB2	33	51
C[C@H](NC[C@H](O)COc1ccccc1Cl)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341228	FF	On-Demand	Anodyne	ADRB1	65	39
C[C@H](NC[C@H](O)COc1ccccc1Cl)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341228	FF	On-Demand	Anodyne	ABCB1	21	40
C[C@H](NC[C@H](O)COc1ccccc1Cl)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341230	FF	On-Demand	Anodyne	ADRB2	33	51
C[C@H](NC[C@H](O)COc1ccccc1Cl)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341230	FF	On-Demand	Anodyne	ADRB1	65	39
C[C@H](NC[C@H](O)COc1ccccc1Cl)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341230	FF	On-Demand	Anodyne	ABCB1	21	40
C[C@H](NC[C@H](O)COc1cccc2[nH]ccc12)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341255	GF	On-Demand	Anodyne	ADRB2	27	69
C[C@H](NC[C@H](O)COc1cccc2[nH]ccc12)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341255	GF	On-Demand	Anodyne	ADRB1	37	69
C[C@H](NC[C@H](O)COc1cccc2[nH]ccc12)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341258	GF	On-Demand	Anodyne	ADRB2	27	69
C[C@H](NC[C@H](O)COc1cccc2[nH]ccc12)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341258	GF	On-Demand	Anodyne	ADRB1	37	69
CC[C@@H](CNC[C@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819341266	EG	On-Demand	Anodyne	ADRB1	36	45
CC[C@@H](CNC[C@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819341266	EG	On-Demand	Anodyne	ADRB3	57	45
CC[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819341268	EG	On-Demand	Anodyne	ADRB1	36	45
CC[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)NC(=O)OC(C)(C)C	ZINC000819341268	EG	On-Demand	Anodyne	ADRB3	57	45
C[C@@H](NCCC(=O)Nc1cccc(Cl)c1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341272	FH	On-Demand	Anodyne	FPR1	40	38
CSc1ccc([C@H](CNC(=O)[C@](C)(O)c2ccc(Cl)cc2)N(C)C)cc1	ZINC000819341331	GH	On-Demand	Anodyne	UTS2	40	32
CSc1ccc([C@H](CNC(=O)[C@@](C)(O)c2ccc(Cl)cc2)N(C)C)cc1	ZINC000819341332	GH	On-Demand	Anodyne	UTS2	40	32
CSc1ccc([C@@H](CNC(=O)[C@@](C)(O)c2ccc(Cl)cc2)N(C)C)cc1	ZINC000819341333	GH	On-Demand	Anodyne	UTS2	40	32
CSc1ccc([C@@H](CNC(=O)[C@](C)(O)c2ccc(Cl)cc2)N(C)C)cc1	ZINC000819341334	GH	On-Demand	Anodyne	UTS2	40	32
O[C@@H](CNCC1=CCOCC1)c1cccc(Cl)c1	ZINC000819341376	CE	On-Demand	Anodyne	ADRB1	27	42
O[C@@H](CNCC1=CCOCC1)c1cccc(Cl)c1	ZINC000819341376	CE	On-Demand	Anodyne	ADRB3	41	42
O[C@H](CNCC1=CCOCC1)c1cccc(Cl)c1	ZINC000819341377	CE	On-Demand	Anodyne	ADRB1	27	42
O[C@H](CNCC1=CCOCC1)c1cccc(Cl)c1	ZINC000819341377	CE	On-Demand	Anodyne	ADRB3	41	42
C[C@@H]1CCN(CCOc2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cc2)C1	ZINC000819341385	EG	On-Demand	Anodyne	ESR1	26	42
C[C@@H]1CCN(CCOc2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cc2)C1	ZINC000819341385	EG	On-Demand	Anodyne	ESR2	15	42
C[C@@H]1CCN(CCOc2ccc(NC(=O)/C=C\[C@H]3CCCO3)cc2)C1	ZINC000819341386	EG	On-Demand	Anodyne	ESR1	26	42
C[C@@H]1CCN(CCOc2ccc(NC(=O)/C=C\[C@H]3CCCO3)cc2)C1	ZINC000819341386	EG	On-Demand	Anodyne	ESR2	15	42
C[C@@H]1CCN(CCOc2ccc(NC(=O)/C=C/[C@H]3CCCO3)cc2)C1	ZINC000819341387	EG	On-Demand	Anodyne	ESR1	26	42
C[C@@H]1CCN(CCOc2ccc(NC(=O)/C=C/[C@H]3CCCO3)cc2)C1	ZINC000819341387	EG	On-Demand	Anodyne	ESR2	15	42
C[C@@H]1CCN(CCOc2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cc2)C1	ZINC000819341388	EG	On-Demand	Anodyne	ESR1	26	42
C[C@@H]1CCN(CCOc2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cc2)C1	ZINC000819341388	EG	On-Demand	Anodyne	ESR2	15	42
CSc1ccc([C@H](CNC(=O)/C=C/c2ccc3c(c2)OCO3)N(C)C)cc1	ZINC000819341404	GH	On-Demand	Anodyne	KCNQ2	20	40
CSc1ccc([C@H](CNC(=O)/C=C/c2ccc3c(c2)OCO3)N(C)C)cc1	ZINC000819341404	GH	On-Demand	Anodyne	DYRK2	62	33
CSc1ccc([C@@H](CNC(=O)/C=C/c2ccc3c(c2)OCO3)N(C)C)cc1	ZINC000819341406	GH	On-Demand	Anodyne	KCNQ2	20	40
CSc1ccc([C@@H](CNC(=O)/C=C/c2ccc3c(c2)OCO3)N(C)C)cc1	ZINC000819341406	GH	On-Demand	Anodyne	DYRK2	62	33
Cc1cc(CNC[C@H](O)c2cccnc2)ccn1	ZINC000819341407	BD	On-Demand	Anodyne	ADRB2	23	44
Cc1cc(CNC[C@H](O)c2cccnc2)ccn1	ZINC000819341407	BD	On-Demand	Anodyne	ADRB1	27	44
Cc1cc(CNC[C@H](O)c2cccnc2)ccn1	ZINC000819341407	BD	On-Demand	Anodyne	ADRB3	96	46
CSc1ccc([C@@H](CNC(=O)/C=C\c2ccc3c(c2)OCO3)N(C)C)cc1	ZINC000819341408	GH	On-Demand	Anodyne	KCNQ2	20	40
CSc1ccc([C@@H](CNC(=O)/C=C\c2ccc3c(c2)OCO3)N(C)C)cc1	ZINC000819341408	GH	On-Demand	Anodyne	DYRK2	62	33
Cc1cc(CNC[C@@H](O)c2cccnc2)ccn1	ZINC000819341409	BD	On-Demand	Anodyne	ADRB2	23	44
Cc1cc(CNC[C@@H](O)c2cccnc2)ccn1	ZINC000819341409	BD	On-Demand	Anodyne	ADRB1	27	44
Cc1cc(CNC[C@@H](O)c2cccnc2)ccn1	ZINC000819341409	BD	On-Demand	Anodyne	ADRB3	96	46
CSc1ccc([C@H](CNC(=O)/C=C\c2ccc3c(c2)OCO3)N(C)C)cc1	ZINC000819341410	GH	On-Demand	Anodyne	KCNQ2	20	40
CSc1ccc([C@H](CNC(=O)/C=C\c2ccc3c(c2)OCO3)N(C)C)cc1	ZINC000819341410	GH	On-Demand	Anodyne	DYRK2	62	33
CC(C)(C)OC(=O)N1CCCc2cc(CNC[C@H](O)c3ccccc3)ccc21	ZINC000819341438	GI	On-Demand	Anodyne	ADRB3	62	40
CC(C)(C)OC(=O)N1CCCc2cc(CNC[C@@H](O)c3ccccc3)ccc21	ZINC000819341439	GI	On-Demand	Anodyne	ADRB3	62	40
CS(=O)(=O)c1ccc([C@@H](O)CNCc2cccc(C(F)(F)F)n2)cc1	ZINC000819341478	FE	On-Demand	Anodyne	PTGS2	33	40
CS(=O)(=O)c1ccc([C@@H](O)CNCc2cccc(C(F)(F)F)n2)cc1	ZINC000819341478	FE	On-Demand	Anodyne	TRPV1	81	35
CS(=O)(=O)c1ccc([C@H](O)CNCc2cccc(C(F)(F)F)n2)cc1	ZINC000819341479	FE	On-Demand	Anodyne	PTGS2	33	40
CS(=O)(=O)c1ccc([C@H](O)CNCc2cccc(C(F)(F)F)n2)cc1	ZINC000819341479	FE	On-Demand	Anodyne	TRPV1	81	35
CC[C@H](C)[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819341483	CE	On-Demand	Bother	CACNA1C	52	36
CC[C@H](C)[C@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819341483	CE	On-Demand	Bother	CACNA1D	82	36
CC[C@H](C)[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819341484	CE	On-Demand	Bother	CACNA1C	52	36
CC[C@H](C)[C@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819341484	CE	On-Demand	Bother	CACNA1D	82	36
CC(=O)N(C)c1cccc(NC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819341497	DI	On-Demand	Anodyne	KCNK3	101	40
CC(=O)N(C)c1cccc(NC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819341497	DI	On-Demand	Anodyne	KCNK9	79	39
CC[C@@H](CNCCS(=O)(=O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819341498	FE	On-Demand	Anodyne	CTSK	23	46
CC[C@@H](CNCCS(=O)(=O)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819341498	FE	On-Demand	Anodyne	FPR1	44	35
CC[C@@H](CNC[C@H](O)c1cccc(C(F)(F)F)c1)NC(=O)OC(C)(C)C	ZINC000819341501	GH	On-Demand	Anodyne	PDS	41	37
CC[C@@H](CNC[C@@H](O)c1cccc(C(F)(F)F)c1)NC(=O)OC(C)(C)C	ZINC000819341503	GH	On-Demand	Anodyne	PDS	41	37
C[C@H](NC[C@H](O)c1ccc(Br)cc1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341508	GG	On-Demand	Anodyne	PAPA1_CARPA	32	43
C[C@H](NC[C@H](O)c1ccc(Br)cc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341511	GG	On-Demand	Anodyne	PAPA1_CARPA	32	43
C[C@H](NC[C@H](O)COc1cccc2ccccc12)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341512	GG	On-Demand	Anodyne	ADRB2	39	65
C[C@H](NC[C@H](O)COc1cccc2ccccc12)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341512	GG	On-Demand	Anodyne	ADRB1	66	46
C[C@H](NC[C@H](O)COc1cccc2ccccc12)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341512	GG	On-Demand	Anodyne	ADRB3	15	65
C[C@H](NC[C@H](O)COc1cccc2ccccc12)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341512	GG	On-Demand	Anodyne	CYP2D6	23	46
C[C@H](NC[C@H](O)COc1cccc2ccccc12)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341513	GG	On-Demand	Anodyne	ADRB2	39	65
C[C@H](NC[C@H](O)COc1cccc2ccccc12)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341513	GG	On-Demand	Anodyne	ADRB1	66	46
C[C@H](NC[C@H](O)COc1cccc2ccccc12)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341513	GG	On-Demand	Anodyne	ADRB3	15	65
C[C@H](NC[C@H](O)COc1cccc2ccccc12)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341513	GG	On-Demand	Anodyne	CYP2D6	23	46
CC[C@@H](CNC[C@@H](O)c1ccccc1Br)NC(=O)OC(C)(C)C	ZINC000819341529	GG	On-Demand	Anodyne	PAPA1_CARPA	33	44
CC[C@@H](CNC[C@@H](O)c1ccccc1Br)NC(=O)OC(C)(C)C	ZINC000819341529	GG	On-Demand	Anodyne	FPR1	41	35
CC[C@@H](CNC[C@H](O)c1ccccc1Br)NC(=O)OC(C)(C)C	ZINC000819341530	GG	On-Demand	Anodyne	PAPA1_CARPA	33	44
CC[C@@H](CNC[C@H](O)c1ccccc1Br)NC(=O)OC(C)(C)C	ZINC000819341530	GG	On-Demand	Anodyne	FPR1	41	35
CC[C@@H](CNCCC(=O)Nc1cccc(F)c1)NC(=O)OC(C)(C)C	ZINC000819341533	FG	On-Demand	Anodyne	PAPA1_CARPA	22	41
CC[C@@H](CNCC1(O)CCCCC1)NC(=O)OC(C)(C)C	ZINC000819341540	DF	On-Demand	Anodyne	CTSK	16	45
CC(=O)N(C)c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819341546	GG	On-Demand	Mild	PAPA1_CARPA	40	42
CC(=O)N(C)c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819341547	GG	On-Demand	Mild	PAPA1_CARPA	40	42
C[C@H](NC[C@H](O)c1ccccc1C(F)(F)F)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341558	GH	On-Demand	Anodyne	FPR1	45	37
C[C@H](NC[C@H](O)c1ccccc1C(F)(F)F)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341561	GH	On-Demand	Anodyne	FPR1	45	37
C[C@@H](NCCC(=O)Nc1cccc(F)c1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341566	FG	On-Demand	Anodyne	PAPA1_CARPA	27	45
CC[C@@H](CNC[C@H](O)c1ccccc1Cl)NC(=O)OC(C)(C)C	ZINC000819341579	EG	On-Demand	Anodyne	PAPA1_CARPA	33	40
CC[C@@H](CNC[C@H](O)c1ccccc1Cl)NC(=O)OC(C)(C)C	ZINC000819341579	EG	On-Demand	Anodyne	CTSK	15	42
CC[C@@H](CNC[C@H](O)c1ccccc1Cl)NC(=O)OC(C)(C)C	ZINC000819341579	EG	On-Demand	Anodyne	FPR1	43	38
CC[C@@H](CNC[C@@H](O)c1cc(C)cc(C)c1)NC(=O)OC(C)(C)C	ZINC000819341580	EG	On-Demand	Anodyne	CTSK	15	42
CC[C@@H](CNC[C@H](O)c1cc(C)cc(C)c1)NC(=O)OC(C)(C)C	ZINC000819341582	EG	On-Demand	Anodyne	CTSK	15	42
CSc1ccc([C@@H](CNC(=O)C[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)N(C)C)cc1	ZINC000819341609	IJ	On-Demand	Anodyne	GPR119	42	48
CSc1ccc([C@H](CNC(=O)C[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)N(C)C)cc1	ZINC000819341610	IJ	On-Demand	Anodyne	GPR119	42	48
CSc1ccc([C@H](CNC(=O)C[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)N(C)C)cc1	ZINC000819341611	IJ	On-Demand	Anodyne	GPR119	42	48
CSc1ccc([C@@H](CNC(=O)C[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)N(C)C)cc1	ZINC000819341612	IJ	On-Demand	Anodyne	GPR119	42	48
CC(=O)Nc1cccc(CC(=O)NCC(C)(C)NC(=O)OC(C)(C)C)c1	ZINC000819341698	FF	On-Demand	Anodyne	KCNK3	46	33
CC(=O)Nc1cccc(CC(=O)NCC(C)(C)NC(=O)OC(C)(C)C)c1	ZINC000819341698	FF	On-Demand	Anodyne	KCNK9	52	33
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1ccc(F)c(F)c1	ZINC000819341720	EG	On-Demand	Anodyne	ADRB1	37	43
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1ccc(F)c(F)c1	ZINC000819341720	EG	On-Demand	Anodyne	ADRB3	38	43
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1ccc(F)c(F)c1	ZINC000819341721	EG	On-Demand	Anodyne	ADRB1	37	43
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1ccc(F)c(F)c1	ZINC000819341721	EG	On-Demand	Anodyne	ADRB3	38	43
CSc1ccc([C@@H](CNC(=O)CC[C@H]2CCN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819341723	II	On-Demand	Anodyne	GPR119	37	46
CSc1ccc([C@H](CNC(=O)CC[C@H]2CCN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819341727	II	On-Demand	Anodyne	GPR119	37	46
CSc1ccc([C@H](CNC(=O)CC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819341728	II	On-Demand	Anodyne	GPR119	37	46
CSc1ccc([C@@H](CNC(=O)CC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819341730	II	On-Demand	Anodyne	GPR119	37	46
Cc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccn1	ZINC000819341738	CE	On-Demand	Bother	CACNA1C	45	35
Cc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccn1	ZINC000819341738	CE	On-Demand	Bother	CACNA1D	70	33
Cc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccn1	ZINC000819341740	CE	On-Demand	Bother	CACNA1C	45	35
Cc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccn1	ZINC000819341740	CE	On-Demand	Bother	CACNA1D	70	33
CSc1ccc(F)cc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819341746	GH	On-Demand	Mild	PAPA1_CARPA	48	52
CSc1ccc(F)cc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819341748	GH	On-Demand	Mild	PAPA1_CARPA	48	52
O[C@@H](CNC[C@H]1CCCO1)c1ccc(F)cn1	ZINC000819341802	BD	On-Demand	Anodyne	TNK2	40	36
O[C@H](CNC[C@H]1CCCO1)c1ccc(F)cn1	ZINC000819341803	BD	On-Demand	Anodyne	TNK2	40	36
CC[C@@H]1CCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819341810	BF	On-Demand	Anodyne	ADRB2	22	42
CC[C@@H]1CCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819341810	BF	On-Demand	Anodyne	ADRB1	26	44
CC[C@@H]1CCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819341810	BF	On-Demand	Anodyne	ADRB3	95	48
CC[C@@H]1CCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819341811	BF	On-Demand	Anodyne	ADRB2	22	42
CC[C@@H]1CCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819341811	BF	On-Demand	Anodyne	ADRB1	26	44
CC[C@@H]1CCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819341811	BF	On-Demand	Anodyne	ADRB3	95	48
CC[C@@H]1CCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819341812	BF	On-Demand	Anodyne	ADRB2	22	42
CC[C@@H]1CCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819341812	BF	On-Demand	Anodyne	ADRB1	26	44
CC[C@@H]1CCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819341812	BF	On-Demand	Anodyne	ADRB3	95	48
CC[C@@H]1CCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819341813	BF	On-Demand	Anodyne	ADRB2	22	42
CC[C@@H]1CCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819341813	BF	On-Demand	Anodyne	ADRB1	26	44
CC[C@@H]1CCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819341813	BF	On-Demand	Anodyne	ADRB3	95	48
CC[C@@H]1CCC[C@H]1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819341833	CG	On-Demand	Bother	CACNA1D	40	32
CC[C@@H]1CCC[C@H]1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819341834	CG	On-Demand	Bother	CACNA1D	40	32
CC[C@@H]1CCC[C@@H]1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819341835	CG	On-Demand	Bother	CACNA1D	40	32
CC[C@@H]1CCC[C@@H]1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819341836	CG	On-Demand	Bother	CACNA1D	40	32
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccnc(C(F)(F)F)c2)cc1	ZINC000819341837	FE	On-Demand	Anodyne	PTGS2	28	42
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccnc(C(F)(F)F)c2)cc1	ZINC000819341837	FE	On-Demand	Anodyne	TRPV1	65	34
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccnc(C(F)(F)F)c2)cc1	ZINC000819341837	FE	On-Demand	Anodyne	CTSF	42	33
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccnc(C(F)(F)F)c2)cc1	ZINC000819341838	FE	On-Demand	Anodyne	PTGS2	28	42
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccnc(C(F)(F)F)c2)cc1	ZINC000819341838	FE	On-Demand	Anodyne	TRPV1	65	34
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccnc(C(F)(F)F)c2)cc1	ZINC000819341838	FE	On-Demand	Anodyne	CTSF	42	33
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341860	FE	On-Demand	Mild	ADRB2	30	47
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341860	FE	On-Demand	Mild	ADRB1	53	38
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341861	FE	On-Demand	Mild	ADRB2	30	47
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341861	FE	On-Demand	Mild	ADRB1	53	38
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341864	EG	On-Demand	Anodyne	FPR1	34	42
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341867	EG	On-Demand	Anodyne	FPR1	34	42
CC[C@@H](CNC[C@H](O)CN1CCc2ccccc2C1)NC(=O)OC(C)(C)C	ZINC000819341869	GE	On-Demand	Anodyne	NOD2	41	36
CC[C@@H](CNC[C@@H](O)CN1CCc2ccccc2C1)NC(=O)OC(C)(C)C	ZINC000819341870	GE	On-Demand	Anodyne	NOD2	41	36
C[C@H](NC[C@H](O)Cc1ccccc1C(F)(F)F)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341877	GH	On-Demand	Anodyne	PAPA1_CARPA	34	41
C[C@H](NC[C@H](O)Cc1ccccc1C(F)(F)F)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341877	GH	On-Demand	Anodyne	SCN10A	15	42
C[C@H](NC[C@H](O)Cc1ccccc1C(F)(F)F)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341877	GH	On-Demand	Anodyne	FPR1	51	40
C[C@H](NC[C@H](O)Cc1ccccc1C(F)(F)F)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341878	GH	On-Demand	Anodyne	PAPA1_CARPA	34	41
C[C@H](NC[C@H](O)Cc1ccccc1C(F)(F)F)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341878	GH	On-Demand	Anodyne	SCN10A	15	42
C[C@H](NC[C@H](O)Cc1ccccc1C(F)(F)F)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341878	GH	On-Demand	Anodyne	FPR1	51	40
C[C@H](NC[C@H](O)c1cccnc1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341884	DE	On-Demand	Anodyne	ADRB1	25	51
C[C@H](NC[C@H](O)c1cccnc1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819341884	DE	On-Demand	Anodyne	ADRB3	70	51
C[C@H](NC[C@H](O)c1cccnc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341886	DE	On-Demand	Anodyne	ADRB1	25	51
C[C@H](NC[C@H](O)c1cccnc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819341886	DE	On-Demand	Anodyne	ADRB3	70	51
CSc1ccc([C@H](CNC(=O)[C@H]2CCCN2C(=O)C(F)(F)F)N(C)C)cc1	ZINC000819341902	HF	On-Demand	Anodyne	ELANE	49	48
CSc1ccc([C@H](CNC(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)N(C)C)cc1	ZINC000819341903	HF	On-Demand	Anodyne	ELANE	49	48
CSc1ccc([C@@H](CNC(=O)[C@H]2CCCN2C(=O)C(F)(F)F)N(C)C)cc1	ZINC000819341904	HF	On-Demand	Anodyne	ELANE	49	48
CSc1ccc([C@@H](CNC(=O)[C@@H]2CCCN2C(=O)C(F)(F)F)N(C)C)cc1	ZINC000819341905	HF	On-Demand	Anodyne	ELANE	49	48
CSc1ccc([C@H](CNC(=O)CNC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819341937	HG	On-Demand	Anodyne	CTSB	39	47
CSc1ccc([C@H](CNC(=O)CNC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819341937	HG	On-Demand	Anodyne	CTSK	21	47
CSc1ccc([C@H](CNC(=O)CNC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819341937	HG	On-Demand	Anodyne	CAPNS1	59	34
CSc1ccc([C@H](CNC(=O)CNC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819341937	HG	On-Demand	Anodyne	CAPN1	58	38
CSc1ccc([C@H](CNC(=O)CNC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819341937	HG	On-Demand	Anodyne	CAPN2	103	37
CSc1ccc([C@H](CNC(=O)CNC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819341937	HG	On-Demand	Anodyne	NPR	71	39
CSc1ccc([C@@H](CNC(=O)CNC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819341939	HG	On-Demand	Anodyne	CTSB	39	47
CSc1ccc([C@@H](CNC(=O)CNC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819341939	HG	On-Demand	Anodyne	CTSK	21	47
CSc1ccc([C@@H](CNC(=O)CNC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819341939	HG	On-Demand	Anodyne	CAPNS1	59	34
CSc1ccc([C@@H](CNC(=O)CNC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819341939	HG	On-Demand	Anodyne	CAPN1	58	38
CSc1ccc([C@@H](CNC(=O)CNC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819341939	HG	On-Demand	Anodyne	CAPN2	103	37
CSc1ccc([C@@H](CNC(=O)CNC(=O)OCc2ccccc2)N(C)C)cc1	ZINC000819341939	HG	On-Demand	Anodyne	NPR	71	39
CSc1ccc([C@H](CNC(=O)CCCCN2CCCC2)N(C)C)cc1	ZINC000819341943	FG	On-Demand	Anodyne	HTR7	35	44
CSc1ccc([C@@H](CNC(=O)CCCCN2CCCC2)N(C)C)cc1	ZINC000819341947	FG	On-Demand	Anodyne	HTR7	35	44
O=[N+]([O-])c1cccc([C@H](O)CNCc2nc(C3CC3)n[nH]2)c1	ZINC000819341952	DD	On-Demand	Bother	CACNA1D	44	33
O=[N+]([O-])c1cccc([C@@H](O)CNCc2nc(C3CC3)n[nH]2)c1	ZINC000819341953	DD	On-Demand	Bother	CACNA1D	44	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cc(F)ccc1SC)C2	ZINC000819341965	FG	On-Demand	Anodyne	P2RX7	40	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cc(F)ccc1SC)C2	ZINC000819341966	FG	On-Demand	Anodyne	P2RX7	40	38
CSc1ccc([C@H](CNC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)N(C)C)cc1	ZINC000819341996	II	On-Demand	Anodyne	GPR119	47	51
CSc1ccc([C@@H](CNC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)N(C)C)cc1	ZINC000819341999	II	On-Demand	Anodyne	GPR119	47	51
CN(C(=O)Cc1ccc(-n2cnnc2)cc1)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819342001	GE	On-Demand	Anodyne	CCR5	28	41
CN(C(=O)Cc1ccc(-n2cnnc2)cc1)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819342001	GE	On-Demand	Anodyne	GPR119	56	49
CN(C(=O)Cc1ccc(-n2cnnc2)cc1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819342003	GE	On-Demand	Anodyne	CCR5	28	41
CN(C(=O)Cc1ccc(-n2cnnc2)cc1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819342003	GE	On-Demand	Anodyne	GPR119	56	49
CSc1ccc([C@@H](CNC(=O)c2ccc(-n3cccn3)nc2)N(C)C)cc1	ZINC000819342011	GG	On-Demand	Anodyne	AMP1_PLAFQ	52	36
CSc1ccc([C@H](CNC(=O)c2ccc(-n3cccn3)nc2)N(C)C)cc1	ZINC000819342013	GG	On-Demand	Anodyne	AMP1_PLAFQ	52	36
CC[C@H](C)[C@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)OC	ZINC000819342022	FF	On-Demand	Anodyne	GPR119	33	44
CC[C@H](C)[C@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)OC	ZINC000819342026	FF	On-Demand	Anodyne	GPR119	33	44
O[C@H](CNCc1nc(C2CC2)n[nH]1)c1cccnc1	ZINC000819342081	CC	On-Demand	Anodyne	ADRB2	17	41
O[C@H](CNCc1nc(C2CC2)n[nH]1)c1cccnc1	ZINC000819342081	CC	On-Demand	Anodyne	ADRB1	20	44
O[C@H](CNCc1nc(C2CC2)n[nH]1)c1cccnc1	ZINC000819342081	CC	On-Demand	Anodyne	ADRB3	79	44
O[C@@H](CNCc1nc(C2CC2)n[nH]1)c1cccnc1	ZINC000819342086	CC	On-Demand	Anodyne	ADRB2	17	41
O[C@@H](CNCc1nc(C2CC2)n[nH]1)c1cccnc1	ZINC000819342086	CC	On-Demand	Anodyne	ADRB1	20	44
O[C@@H](CNCc1nc(C2CC2)n[nH]1)c1cccnc1	ZINC000819342086	CC	On-Demand	Anodyne	ADRB3	79	44
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1ccc(F)cc1	ZINC000819342097	EG	On-Demand	Anodyne	ADRB1	42	41
O[C@@H](CNCCOc1ccc(F)c(Cl)c1)c1ccc(F)cc1	ZINC000819342097	EG	On-Demand	Anodyne	ADRB3	37	41
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1ccc(F)cc1	ZINC000819342098	EG	On-Demand	Anodyne	ADRB1	42	41
O[C@H](CNCCOc1ccc(F)c(Cl)c1)c1ccc(F)cc1	ZINC000819342098	EG	On-Demand	Anodyne	ADRB3	37	41
C[C@@H](NCCC(=O)Nc1ccccc1F)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342099	FG	On-Demand	Anodyne	PAPA1_CARPA	28	41
C[C@@H](NCCC(=O)Nc1ccccc1F)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342099	FG	On-Demand	Anodyne	FPR1	42	35
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ccc(F)c(Cl)c2)c1	ZINC000819342101	FG	On-Demand	Bother	ADRB1	40	47
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ccc(F)c(Cl)c2)c1	ZINC000819342101	FG	On-Demand	Bother	ADRB3	44	47
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ccc(F)c(Cl)c2)c1	ZINC000819342104	FG	On-Demand	Bother	ADRB1	40	47
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ccc(F)c(Cl)c2)c1	ZINC000819342104	FG	On-Demand	Bother	ADRB3	44	47
CC[C@@H](CNC[C@H](O)c1ccc(Br)cc1)NC(=O)OC(C)(C)C	ZINC000819342126	GG	On-Demand	Anodyne	PAPA1_CARPA	31	42
CC[C@@H](CNC[C@@H](O)c1ccc(Br)cc1)NC(=O)OC(C)(C)C	ZINC000819342128	GG	On-Demand	Anodyne	PAPA1_CARPA	31	42
CC[C@@H](CNCCS(=O)(=O)c1ccc(F)cc1)NC(=O)OC(C)(C)C	ZINC000819342135	FE	On-Demand	Anodyne	CTSK	17	40
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342137	FG	On-Demand	Anodyne	ADRB1	23	41
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342137	FG	On-Demand	Anodyne	ADRB3	27	41
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342137	FG	On-Demand	Anodyne	PGC	40	36
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342137	FG	On-Demand	Anodyne	PAPA1_CARPA	32	44
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342137	FG	On-Demand	Anodyne	CTSL	20	44
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342137	FG	On-Demand	Anodyne	REN	45	40
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342137	FG	On-Demand	Anodyne	FPR1	51	45
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342138	FG	On-Demand	Anodyne	ADRB1	23	41
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342138	FG	On-Demand	Anodyne	ADRB3	27	41
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342138	FG	On-Demand	Anodyne	PGC	40	36
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342138	FG	On-Demand	Anodyne	PAPA1_CARPA	32	44
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342138	FG	On-Demand	Anodyne	CTSL	20	44
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342138	FG	On-Demand	Anodyne	REN	45	40
C[C@H](NC[C@H](O)Cc1cccc(Cl)c1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342138	FG	On-Demand	Anodyne	FPR1	51	45
CC[C@@H](O)CNC[C@@H](CC)NC(=O)OC(C)(C)C	ZINC000819342141	CD	On-Demand	Anodyne	CTSK	18	51
CC[C@@H](CNC[C@H](O)CC)NC(=O)OC(C)(C)C	ZINC000819342142	CD	On-Demand	Anodyne	CTSK	18	51
C[C@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342157	GE	On-Demand	Anodyne	CTSF	46	32
C[C@H](NC[C@H](O)c1ccc(S(C)(=O)=O)cc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342158	GE	On-Demand	Anodyne	CTSF	46	32
CC[C@@H](CNCCS(=O)(=O)CC)NC(=O)OC(C)(C)C	ZINC000819342160	DD	On-Demand	Anodyne	CTSK	17	48
C[C@@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342169	GF	On-Demand	Bother	COLA	64	40
C[C@@H]1CCN(CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819342185	FE	On-Demand	Mild	PAPA1_CARPA	38	49
C[C@H]1CCN(CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819342186	FE	On-Demand	Mild	PAPA1_CARPA	38	49
C[C@@H]1CCN(CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819342187	FE	On-Demand	Mild	PAPA1_CARPA	38	49
C[C@H]1CCN(CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819342188	FE	On-Demand	Mild	PAPA1_CARPA	38	49
CC(C)(C)OC(=O)N1CCCc2cc(CNCCS(C)(=O)=O)ccc21	ZINC000819342235	FF	On-Demand	Anodyne	GPR119	27	44
O=[N+]([O-])c1ccc([C@@H](O)CNCCOc2ccc(Cl)c(Cl)c2)cc1	ZINC000819342236	FH	On-Demand	Bother	ADRB1	30	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCOc2ccc(Cl)c(Cl)c2)cc1	ZINC000819342236	FH	On-Demand	Bother	ADRB3	30	42
O=[N+]([O-])c1ccc([C@@H](O)CNCCOc2ccc(Cl)c(Cl)c2)cc1	ZINC000819342236	FH	On-Demand	Bother	ACR	15	40
O=[N+]([O-])c1ccc([C@H](O)CNCCOc2ccc(Cl)c(Cl)c2)cc1	ZINC000819342237	FH	On-Demand	Bother	ADRB1	30	42
O=[N+]([O-])c1ccc([C@H](O)CNCCOc2ccc(Cl)c(Cl)c2)cc1	ZINC000819342237	FH	On-Demand	Bother	ADRB3	30	42
O=[N+]([O-])c1ccc([C@H](O)CNCCOc2ccc(Cl)c(Cl)c2)cc1	ZINC000819342237	FH	On-Demand	Bother	ACR	15	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(F)c(Cl)c2)cc1	ZINC000819342285	GF	On-Demand	Anodyne	ADRB2	37	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(F)c(Cl)c2)cc1	ZINC000819342285	GF	On-Demand	Anodyne	ADRB1	50	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(F)c(Cl)c2)cc1	ZINC000819342285	GF	On-Demand	Anodyne	PTGS2	22	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(F)c(Cl)c2)cc1	ZINC000819342285	GF	On-Demand	Anodyne	GRIN1	15	47
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(F)c(Cl)c2)cc1	ZINC000819342285	GF	On-Demand	Anodyne	ADRB3	70	41
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(F)c(Cl)c2)cc1	ZINC000819342288	GF	On-Demand	Anodyne	ADRB2	37	41
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(F)c(Cl)c2)cc1	ZINC000819342288	GF	On-Demand	Anodyne	ADRB1	50	41
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(F)c(Cl)c2)cc1	ZINC000819342288	GF	On-Demand	Anodyne	PTGS2	22	43
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(F)c(Cl)c2)cc1	ZINC000819342288	GF	On-Demand	Anodyne	GRIN1	15	47
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(F)c(Cl)c2)cc1	ZINC000819342288	GF	On-Demand	Anodyne	ADRB3	70	41
CN(C[C@@H](O)CNCc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C)C1CC1	ZINC000819342307	GF	On-Demand	Anodyne	GPR119	17	40
CN(C[C@H](O)CNCc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C)C1CC1	ZINC000819342309	GF	On-Demand	Anodyne	GPR119	17	40
CC[C@@H](CNC[C@@H](O)C1CC1)NC(=O)OC(C)(C)C	ZINC000819342342	CD	On-Demand	Anodyne	CTSK	16	45
CC[C@@H](CNC[C@H](O)C1CC1)NC(=O)OC(C)(C)C	ZINC000819342344	CD	On-Demand	Anodyne	CTSK	16	45
CC[C@@H](CNC[C@@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819342356	DF	On-Demand	Anodyne	CTSD	16	46
CC[C@@H](CNC[C@@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819342356	DF	On-Demand	Anodyne	CTSK	19	56
CC[C@@H](CNC[C@@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819342356	DF	On-Demand	Anodyne	ECE1	29	46
CC[C@@H](CNC[C@@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819342356	DF	On-Demand	Anodyne	REN	50	46
CC[C@@H](CNC[C@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819342359	DF	On-Demand	Anodyne	CTSD	16	46
CC[C@@H](CNC[C@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819342359	DF	On-Demand	Anodyne	CTSK	19	56
CC[C@@H](CNC[C@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819342359	DF	On-Demand	Anodyne	ECE1	29	46
CC[C@@H](CNC[C@H](O)CC1CCCC1)NC(=O)OC(C)(C)C	ZINC000819342359	DF	On-Demand	Anodyne	REN	50	46
CC[C@@H]1CCC[C@@H]1CNC[C@H](O)c1ccccc1	ZINC000819342360	BG	On-Demand	Anodyne	Q8WSF8_APLCA	18	40
CC[C@H]1CCC[C@H]1CNC[C@H](O)c1ccccc1	ZINC000819342362	BG	On-Demand	Anodyne	Q8WSF8_APLCA	18	40
CC[C@H]1CCC[C@H]1CNC[C@@H](O)c1ccccc1	ZINC000819342363	BG	On-Demand	Anodyne	Q8WSF8_APLCA	18	40
CC[C@@H]1CCC[C@@H]1CNC[C@@H](O)c1ccccc1	ZINC000819342365	BG	On-Demand	Anodyne	Q8WSF8_APLCA	18	40
CC[C@H]1CCC[C@@H]1CNC[C@H](O)c1ccccc1	ZINC000819342366	BG	On-Demand	Anodyne	Q8WSF8_APLCA	18	40
CC[C@@H]1CCC[C@H]1CNC[C@H](O)c1ccccc1	ZINC000819342367	BG	On-Demand	Anodyne	Q8WSF8_APLCA	18	40
CC[C@H]1CCC[C@@H]1CNC[C@@H](O)c1ccccc1	ZINC000819342368	BG	On-Demand	Anodyne	Q8WSF8_APLCA	18	40
CC[C@@H]1CCC[C@H]1CNC[C@@H](O)c1ccccc1	ZINC000819342369	BG	On-Demand	Anodyne	Q8WSF8_APLCA	18	40
Cc1ccc(OC[C@H](O)CN[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819342382	FF	On-Demand	Anodyne	ADRB2	25	54
Cc1ccc(OC[C@H](O)CN[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819342382	FF	On-Demand	Anodyne	ADRB1	18	42
CSc1ccc([C@H](CNC(=O)C2CN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819342383	GF	On-Demand	Anodyne	GPR119	17	43
Cc1ccc(OC[C@H](O)CN[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819342384	FF	On-Demand	Anodyne	ADRB2	25	54
Cc1ccc(OC[C@H](O)CN[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819342384	FF	On-Demand	Anodyne	ADRB1	18	42
Cc1ccc(OC[C@H](O)CN[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819342385	FF	On-Demand	Anodyne	ADRB2	25	54
Cc1ccc(OC[C@H](O)CN[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819342385	FF	On-Demand	Anodyne	ADRB1	18	42
CSc1ccc([C@@H](CNC(=O)C2CN(C(=O)OC(C)(C)C)C2)N(C)C)cc1	ZINC000819342386	GF	On-Demand	Anodyne	GPR119	17	43
Cc1ccc(OC[C@H](O)CN[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819342387	FF	On-Demand	Anodyne	ADRB2	25	54
Cc1ccc(OC[C@H](O)CN[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819342387	FF	On-Demand	Anodyne	ADRB1	18	42
C[C@H](NC[C@H](O)Cc1ccc(C(F)(F)F)cc1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342435	GH	On-Demand	Anodyne	PAPA1_CARPA	32	40
C[C@H](NC[C@H](O)Cc1ccc(C(F)(F)F)cc1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342435	GH	On-Demand	Anodyne	FPR1	47	39
C[C@H](NC[C@H](O)Cc1ccc(C(F)(F)F)cc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342437	GH	On-Demand	Anodyne	PAPA1_CARPA	32	40
C[C@H](NC[C@H](O)Cc1ccc(C(F)(F)F)cc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342437	GH	On-Demand	Anodyne	FPR1	47	39
O[C@@H](CNCCOc1ccc(Cl)c(Cl)c1)c1cccnc1	ZINC000819342442	EG	On-Demand	Anodyne	ADRB2	43	63
O[C@@H](CNCCOc1ccc(Cl)c(Cl)c1)c1cccnc1	ZINC000819342442	EG	On-Demand	Anodyne	ADRB1	60	63
O[C@@H](CNCCOc1ccc(Cl)c(Cl)c1)c1cccnc1	ZINC000819342442	EG	On-Demand	Anodyne	ADRB3	129	65
O[C@@H](CNCCOc1ccc(Cl)c(Cl)c1)c1cccnc1	ZINC000819342442	EG	On-Demand	Anodyne	CYP51A1	15	42
O[C@H](CNCCOc1ccc(Cl)c(Cl)c1)c1cccnc1	ZINC000819342444	EG	On-Demand	Anodyne	ADRB2	43	63
O[C@H](CNCCOc1ccc(Cl)c(Cl)c1)c1cccnc1	ZINC000819342444	EG	On-Demand	Anodyne	ADRB1	60	63
O[C@H](CNCCOc1ccc(Cl)c(Cl)c1)c1cccnc1	ZINC000819342444	EG	On-Demand	Anodyne	ADRB3	129	65
O[C@H](CNCCOc1ccc(Cl)c(Cl)c1)c1cccnc1	ZINC000819342444	EG	On-Demand	Anodyne	CYP51A1	15	42
CC[C@@H]1CCCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819342446	CF	On-Demand	Anodyne	ADRB2	22	42
CC[C@@H]1CCCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819342446	CF	On-Demand	Anodyne	ADRB1	26	44
CC[C@@H]1CCCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819342446	CF	On-Demand	Anodyne	ADRB3	96	48
CC[C@@H]1CCCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819342448	CF	On-Demand	Anodyne	ADRB2	22	42
CC[C@@H]1CCCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819342448	CF	On-Demand	Anodyne	ADRB1	26	44
CC[C@@H]1CCCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819342448	CF	On-Demand	Anodyne	ADRB3	96	48
CC[C@@H]1CCCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819342450	CF	On-Demand	Anodyne	ADRB2	22	42
CC[C@@H]1CCCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819342450	CF	On-Demand	Anodyne	ADRB1	26	44
CC[C@@H]1CCCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819342450	CF	On-Demand	Anodyne	ADRB3	96	48
CC[C@@H]1CCCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819342451	CF	On-Demand	Anodyne	ADRB2	22	42
CC[C@@H]1CCCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819342451	CF	On-Demand	Anodyne	ADRB1	26	44
CC[C@@H]1CCCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819342451	CF	On-Demand	Anodyne	ADRB3	96	48
C[C@H](NC[C@H](O)COc1ccc(F)cc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342452	FE	On-Demand	Anodyne	ADRB2	39	49
C[C@H](NC[C@H](O)COc1ccc(F)cc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342452	FE	On-Demand	Anodyne	ADRB1	49	47
C[C@H](NC[C@H](O)COc1ccc(F)cc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342452	FE	On-Demand	Anodyne	ADRB3	21	41
C[C@H](NC[C@H](O)COc1ccc(F)cc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342452	FE	On-Demand	Anodyne	PAPA1_CARPA	28	40
C[C@H](NC[C@H](O)COc1ccc(F)cc1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342457	FE	On-Demand	Anodyne	ADRB2	39	49
C[C@H](NC[C@H](O)COc1ccc(F)cc1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342457	FE	On-Demand	Anodyne	ADRB1	49	47
C[C@H](NC[C@H](O)COc1ccc(F)cc1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342457	FE	On-Demand	Anodyne	ADRB3	21	41
C[C@H](NC[C@H](O)COc1ccc(F)cc1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342457	FE	On-Demand	Anodyne	PAPA1_CARPA	28	40
C[C@H](NC[C@H](O)COc1ccccc1F)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342512	FE	On-Demand	Anodyne	ADRB2	33	51
C[C@H](NC[C@H](O)COc1ccccc1F)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342512	FE	On-Demand	Anodyne	ADRB1	68	39
C[C@H](NC[C@H](O)COc1ccccc1F)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342512	FE	On-Demand	Anodyne	PAPA1_CARPA	27	41
C[C@H](NC[C@H](O)COc1ccccc1F)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342512	FE	On-Demand	Anodyne	ABCB1	17	40
C[C@H](NC[C@H](O)COc1ccccc1F)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342514	FE	On-Demand	Anodyne	ADRB2	33	51
C[C@H](NC[C@H](O)COc1ccccc1F)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342514	FE	On-Demand	Anodyne	ADRB1	68	39
C[C@H](NC[C@H](O)COc1ccccc1F)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342514	FE	On-Demand	Anodyne	PAPA1_CARPA	27	41
C[C@H](NC[C@H](O)COc1ccccc1F)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342514	FE	On-Demand	Anodyne	ABCB1	17	40
CC[C@@H](CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)NC(=O)OC(C)(C)C	ZINC000819342526	GE	On-Demand	Anodyne	CTSF	52	35
CC[C@@H](CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)NC(=O)OC(C)(C)C	ZINC000819342527	GE	On-Demand	Anodyne	CTSF	52	35
Cc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1Cl	ZINC000819342538	FI	On-Demand	Mild	PAPA1_CARPA	45	45
Cc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1Cl	ZINC000819342538	FI	On-Demand	Mild	CTSL	15	45
Cc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1Cl	ZINC000819342538	FI	On-Demand	Mild	FPR1	40	38
Cc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1Cl	ZINC000819342539	FI	On-Demand	Mild	PAPA1_CARPA	45	45
Cc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1Cl	ZINC000819342539	FI	On-Demand	Mild	CTSL	15	45
Cc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1Cl	ZINC000819342539	FI	On-Demand	Mild	FPR1	40	38
CC[C@@H](CNC[C@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819342582	DF	On-Demand	Anodyne	CTSD	18	42
CC[C@@H](CNC[C@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819342582	DF	On-Demand	Anodyne	CTSK	16	53
CC[C@@H](CNC[C@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819342582	DF	On-Demand	Anodyne	ECE1	30	42
CC[C@@H](CNC[C@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819342582	DF	On-Demand	Anodyne	REN	38	42
CC[C@@H](CNC[C@@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819342584	DF	On-Demand	Anodyne	CTSD	18	42
CC[C@@H](CNC[C@@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819342584	DF	On-Demand	Anodyne	CTSK	16	53
CC[C@@H](CNC[C@@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819342584	DF	On-Demand	Anodyne	ECE1	30	42
CC[C@@H](CNC[C@@H](O)C1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819342584	DF	On-Demand	Anodyne	REN	38	42
CC[C@@H](CNCCS(C)(=O)=O)NC(=O)OC(C)(C)C	ZINC000819342599	CC	On-Demand	Anodyne	CTSK	16	47
C[C@H](NC[C@H](O)CN1CCc2ccccc2C1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342601	GE	On-Demand	Anodyne	NOD2	41	35
C[C@H](NC[C@H](O)CN1CCc2ccccc2C1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342603	GE	On-Demand	Anodyne	NOD2	41	35
C[C@H](NC[C@H](O)c1ccccc1Br)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342609	GG	On-Demand	Anodyne	PAPA1_CARPA	35	46
C[C@H](NC[C@H](O)c1ccccc1Br)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342609	GG	On-Demand	Anodyne	FPR1	46	38
C[C@H](NC[C@H](O)c1ccccc1Br)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342615	GG	On-Demand	Anodyne	PAPA1_CARPA	35	46
C[C@H](NC[C@H](O)c1ccccc1Br)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342615	GG	On-Demand	Anodyne	FPR1	46	38
CC(C)(C)OC(=O)NCC[C@@H](NC[C@H](O)c1ccc(C#N)cc1)C(F)F	ZINC000819342617	FF	On-Demand	Mild	CTRB_BOVIN	44	31
CC(C)(C)OC(=O)NCC[C@H](NC[C@H](O)c1ccc(C#N)cc1)C(F)F	ZINC000819342622	FF	On-Demand	Mild	CTRB_BOVIN	44	31
CC(C)(C)OC(=O)NCC[C@@H](NC[C@@H](O)c1ccc(C#N)cc1)C(F)F	ZINC000819342624	FF	On-Demand	Mild	CTRB_BOVIN	44	31
CC(C)(C)OC(=O)NCC[C@H](NC[C@@H](O)c1ccc(C#N)cc1)C(F)F	ZINC000819342626	FF	On-Demand	Mild	CTRB_BOVIN	44	31
O=C1CCc2cc(OC[C@H](O)CNOC3CCC3)ccc2N1	ZINC000819342700	DD	On-Demand	Anodyne	ADRB1	29	41
O=C1CCc2cc(OC[C@@H](O)CNOC3CCC3)ccc2N1	ZINC000819342703	DD	On-Demand	Anodyne	ADRB1	29	41
O[C@H](CNOC1CCC1)COc1cccc(Br)c1	ZINC000819342706	DE	On-Demand	Anodyne	ADRB2	31	44
O[C@H](CNOC1CCC1)COc1cccc(Br)c1	ZINC000819342706	DE	On-Demand	Anodyne	ADRB1	41	46
O[C@@H](CNOC1CCC1)COc1cccc(Br)c1	ZINC000819342709	DE	On-Demand	Anodyne	ADRB2	31	44
O[C@@H](CNOC1CCC1)COc1cccc(Br)c1	ZINC000819342709	DE	On-Demand	Anodyne	ADRB1	41	46
CS(=O)(=O)c1ccc([C@H](O)CNOC2CCC2)cc1	ZINC000819342728	CD	On-Demand	Anodyne	ADRB1	15	40
CS(=O)(=O)c1ccc([C@@H](O)CNOC2CCC2)cc1	ZINC000819342729	CD	On-Demand	Anodyne	ADRB1	15	40
O=[N+]([O-])c1ccc([C@H](O)CNOC2CCC2)cc1	ZINC000819342735	CD	On-Demand	Bother	SLC27A4	51	37
O=[N+]([O-])c1ccc([C@@H](O)CNOC2CCC2)cc1	ZINC000819342737	CD	On-Demand	Bother	SLC27A4	51	37
O[C@@H](CNOC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819342767	DF	On-Demand	Anodyne	ADRB2	29	44
O[C@@H](CNOC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819342767	DF	On-Demand	Anodyne	ADRB1	42	43
O[C@@H](CNOC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819342767	DF	On-Demand	Anodyne	ABCB1	21	42
O[C@H](CNOC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819342768	DF	On-Demand	Anodyne	ADRB2	29	44
O[C@H](CNOC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819342768	DF	On-Demand	Anodyne	ADRB1	42	43
O[C@H](CNOC1CCC1)COc1ccccc1C(F)(F)F	ZINC000819342768	DF	On-Demand	Anodyne	ABCB1	21	42
COc1cccc(OC)c1OC[C@H](O)CNOC1CCC1	ZINC000819342793	CD	On-Demand	Anodyne	ADRB2	35	46
COc1cccc(OC)c1OC[C@H](O)CNOC1CCC1	ZINC000819342793	CD	On-Demand	Anodyne	ADRB1	43	46
COc1cccc(OC)c1OC[C@@H](O)CNOC1CCC1	ZINC000819342795	CD	On-Demand	Anodyne	ADRB2	35	46
COc1cccc(OC)c1OC[C@@H](O)CNOC1CCC1	ZINC000819342795	CD	On-Demand	Anodyne	ADRB1	43	46
CSc1ccc([C@H](CNC(=O)[C@H](F)Cc2ccccc2)N(C)C)cc1	ZINC000819342808	FH	On-Demand	Anodyne	MME	69	38
CSc1ccc([C@H](CNC(=O)[C@H](F)Cc2ccccc2)N(C)C)cc1	ZINC000819342808	FH	On-Demand	Anodyne	FCER2	60	34
CSc1ccc([C@H](CNC(=O)[C@@H](F)Cc2ccccc2)N(C)C)cc1	ZINC000819342809	FH	On-Demand	Anodyne	MME	69	38
CSc1ccc([C@H](CNC(=O)[C@@H](F)Cc2ccccc2)N(C)C)cc1	ZINC000819342809	FH	On-Demand	Anodyne	FCER2	60	34
CSc1ccc([C@@H](CNC(=O)[C@@H](F)Cc2ccccc2)N(C)C)cc1	ZINC000819342810	FH	On-Demand	Anodyne	MME	69	38
CSc1ccc([C@@H](CNC(=O)[C@@H](F)Cc2ccccc2)N(C)C)cc1	ZINC000819342810	FH	On-Demand	Anodyne	FCER2	60	34
CSc1ccc([C@@H](CNC(=O)[C@H](F)Cc2ccccc2)N(C)C)cc1	ZINC000819342811	FH	On-Demand	Anodyne	MME	69	38
CSc1ccc([C@@H](CNC(=O)[C@H](F)Cc2ccccc2)N(C)C)cc1	ZINC000819342811	FH	On-Demand	Anodyne	FCER2	60	34
Cc1ccccc1[C@@H](OC[C@H](O)CNOC1CCC1)c1ccccc1	ZINC000819342868	EH	On-Demand	Anodyne	CASR	20	40
Cc1ccccc1[C@@H](OC[C@@H](O)CNOC1CCC1)c1ccccc1	ZINC000819342869	EH	On-Demand	Anodyne	CASR	20	40
C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342876	FF	On-Demand	Bother	CACNA1D	52	34
C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342883	FF	On-Demand	Bother	CACNA1D	52	34
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342922	FF	On-Demand	Anodyne	ADRB2	36	49
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342922	FF	On-Demand	Anodyne	ADRB1	44	49
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342922	FF	On-Demand	Anodyne	GRIN1	17	41
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342922	FF	On-Demand	Anodyne	ADRB3	22	41
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342928	FF	On-Demand	Anodyne	ADRB2	36	49
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342928	FF	On-Demand	Anodyne	ADRB1	44	49
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342928	FF	On-Demand	Anodyne	GRIN1	17	41
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342928	FF	On-Demand	Anodyne	ADRB3	22	41
C[C@H](NC[C@H](O)c1cccc2ccccc12)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342955	FH	On-Demand	Anodyne	PAPA1_CARPA	32	41
C[C@H](NC[C@H](O)c1cccc2ccccc12)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342955	FH	On-Demand	Anodyne	REN	38	40
C[C@H](NC[C@H](O)c1cccc2ccccc12)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342955	FH	On-Demand	Anodyne	FPR1	48	38
C[C@H](NC[C@H](O)c1cccc2ccccc12)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342958	FH	On-Demand	Anodyne	PAPA1_CARPA	32	41
C[C@H](NC[C@H](O)c1cccc2ccccc12)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342958	FH	On-Demand	Anodyne	REN	38	40
C[C@H](NC[C@H](O)c1cccc2ccccc12)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342958	FH	On-Demand	Anodyne	FPR1	48	38
C[C@H](NC[C@H](O)CN1C(=O)c2ccccc2C1=O)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342967	GD	On-Demand	Anodyne	FPR1	41	35
C[C@H](NC[C@H](O)CN1C(=O)c2ccccc2C1=O)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342975	GD	On-Demand	Anodyne	FPR1	41	35
C[C@H](NC[C@H](O)c1cccc(Br)c1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819342977	GG	On-Demand	Anodyne	PAPA1_CARPA	30	47
CC[C@@H](CNS(C)(=O)=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819342983	DD	On-Demand	Anodyne	ADRB1	34	46
CC[C@@H](CNS(C)(=O)=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819342983	DD	On-Demand	Anodyne	ADRB3	65	48
CC[C@@H](CNS(C)(=O)=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000819342985	DD	On-Demand	Anodyne	ADRB1	34	46
CC[C@@H](CNS(C)(=O)=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000819342985	DD	On-Demand	Anodyne	ADRB3	65	48
C[C@H](NC[C@H](O)c1cccc(Br)c1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342990	GG	On-Demand	Anodyne	PAPA1_CARPA	30	47
C[C@@H](NCCS(=O)(=O)c1ccccc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342998	FE	On-Demand	Anodyne	PAPA1_CARPA	36	40
C[C@@H](NCCS(=O)(=O)c1ccccc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342998	FE	On-Demand	Anodyne	CTSK	21	46
C[C@@H](NCCS(=O)(=O)c1ccccc1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819342998	FE	On-Demand	Anodyne	FPR1	49	39
C[C@H](NC[C@H](O)COc1ccc2c(c1)OCO2)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819343016	GE	On-Demand	Anodyne	ADRB2	18	44
C[C@H](NC[C@H](O)COc1ccc2c(c1)OCO2)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819343016	GE	On-Demand	Anodyne	ADRB1	21	42
C[C@H](NC[C@H](O)COc1ccc2c(c1)OCO2)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819343020	GE	On-Demand	Anodyne	ADRB2	18	44
C[C@H](NC[C@H](O)COc1ccc2c(c1)OCO2)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819343020	GE	On-Demand	Anodyne	ADRB1	21	42
O[C@H](CNOC1CCC1)COc1ccccc1	ZINC000819343026	BD	On-Demand	Anodyne	ADRB2	64	56
O[C@H](CNOC1CCC1)COc1ccccc1	ZINC000819343026	BD	On-Demand	Anodyne	ADRB1	82	49
O[C@H](CNOC1CCC1)COc1ccccc1	ZINC000819343026	BD	On-Demand	Anodyne	ADRB3	57	44
O[C@H](CNOC1CCC1)COc1ccccc1	ZINC000819343026	BD	On-Demand	Anodyne	CASR	17	43
O[C@@H](CNOC1CCC1)COc1ccccc1	ZINC000819343028	BD	On-Demand	Anodyne	ADRB2	64	56
O[C@@H](CNOC1CCC1)COc1ccccc1	ZINC000819343028	BD	On-Demand	Anodyne	ADRB1	82	49
O[C@@H](CNOC1CCC1)COc1ccccc1	ZINC000819343028	BD	On-Demand	Anodyne	ADRB3	57	44
O[C@@H](CNOC1CCC1)COc1ccccc1	ZINC000819343028	BD	On-Demand	Anodyne	CASR	17	43
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819343035	GG	On-Demand	Anodyne	ADRB2	44	67
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819343035	GG	On-Demand	Anodyne	ADRB1	44	45
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819343035	GG	On-Demand	Anodyne	ADRB3	23	43
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819343035	GG	On-Demand	Anodyne	CASR	43	38
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819343035	GG	On-Demand	Anodyne	PAPA1_CARPA	27	45
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819343035	GG	On-Demand	Anodyne	REN	17	40
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)[C@H](C)NC(=O)OC(C)(C)C	ZINC000819343035	GG	On-Demand	Anodyne	CYP2D6	17	45
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819343036	GG	On-Demand	Anodyne	ADRB2	44	67
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819343036	GG	On-Demand	Anodyne	ADRB1	44	45
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819343036	GG	On-Demand	Anodyne	ADRB3	23	43
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819343036	GG	On-Demand	Anodyne	CASR	43	38
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819343036	GG	On-Demand	Anodyne	PAPA1_CARPA	27	45
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819343036	GG	On-Demand	Anodyne	REN	17	40
C[C@H](NC[C@H](O)COc1ccc2ccccc2c1)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000819343036	GG	On-Demand	Anodyne	CYP2D6	17	45
CC[C@@H](CNS(C)(=O)=O)NC[C@H](O)c1cc(OC)ccc1OC	ZINC000819343048	EC	On-Demand	Anodyne	ADRB3	19	40
CC[C@@H](CNS(C)(=O)=O)NC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819343050	EC	On-Demand	Anodyne	ADRB3	19	40
COc1cccc(C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)n1	ZINC000819343052	EF	On-Demand	Anodyne	ALS	46	34
COc1cccc(C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)n1	ZINC000819343053	EF	On-Demand	Anodyne	ALS	46	34
CSc1ccc([C@H](CNC(=O)CCCn2cncn2)N(C)C)cc1	ZINC000819343061	EE	On-Demand	Anodyne	HIS3	54	34
CSc1ccc([C@@H](CNC(=O)CCCn2cncn2)N(C)C)cc1	ZINC000819343062	EE	On-Demand	Anodyne	HIS3	54	34
CSc1ccc([C@@H](CNC(=O)[C@@H]2[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)N(C)C)cc1	ZINC000819343085	HG	On-Demand	Anodyne	GPR119	15	44
CSc1ccc([C@H](CNC(=O)[C@@H]2[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)N(C)C)cc1	ZINC000819343086	HG	On-Demand	Anodyne	GPR119	15	44
CCC1(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCOCC1	ZINC000819343129	FF	On-Demand	Mild	PAPA1_CARPA	40	55
CCC1(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCOCC1	ZINC000819343129	FF	On-Demand	Mild	CTSK	15	47
CCC1(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCOCC1	ZINC000819343130	FF	On-Demand	Mild	PAPA1_CARPA	40	55
CCC1(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCOCC1	ZINC000819343130	FF	On-Demand	Mild	CTSK	15	47
O[C@H](CNOC1CCC1)COc1ccc(Cl)cc1	ZINC000819343161	CE	On-Demand	Anodyne	ADRB2	37	43
O[C@H](CNOC1CCC1)COc1ccc(Cl)cc1	ZINC000819343161	CE	On-Demand	Anodyne	ADRB1	54	50
O[C@H](CNOC1CCC1)COc1ccc(Cl)cc1	ZINC000819343161	CE	On-Demand	Anodyne	ADRB3	31	40
O[C@@H](CNOC1CCC1)COc1ccc(Cl)cc1	ZINC000819343162	CE	On-Demand	Anodyne	ADRB2	37	43
O[C@@H](CNOC1CCC1)COc1ccc(Cl)cc1	ZINC000819343162	CE	On-Demand	Anodyne	ADRB1	54	50
O[C@@H](CNOC1CCC1)COc1ccc(Cl)cc1	ZINC000819343162	CE	On-Demand	Anodyne	ADRB3	31	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC[C@@H](CC#N)C1	ZINC000819343221	GG	On-Demand	Mild	CTSD	90	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC[C@@H](CC#N)C1	ZINC000819343221	GG	On-Demand	Mild	PGC	60	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC[C@@H](CC#N)C1	ZINC000819343221	GG	On-Demand	Mild	PAPA1_CARPA	54	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC[C@@H](CC#N)C1	ZINC000819343221	GG	On-Demand	Mild	CTSL	19	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC[C@@H](CC#N)C1	ZINC000819343221	GG	On-Demand	Mild	BACE2	50	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC[C@@H](CC#N)C1	ZINC000819343221	GG	On-Demand	Mild	REN	83	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC[C@@H](CC#N)C1	ZINC000819343221	GG	On-Demand	Mild	REN1	15	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC[C@@H](CC#N)C1	ZINC000819343221	GG	On-Demand	Mild	BACE1	70	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC[C@@H](CC#N)C1	ZINC000819343221	GG	On-Demand	Mild	FPR1	49	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC[C@@H](CC#N)C1	ZINC000819343221	GG	On-Demand	Mild	PLM1_PLAFA	29	40
O[C@@H](CNOC1CCC1)COc1cccc2ccccc12	ZINC000819343231	CF	On-Demand	Anodyne	ADRB2	41	61
O[C@@H](CNOC1CCC1)COc1cccc2ccccc12	ZINC000819343231	CF	On-Demand	Anodyne	ADRB1	55	61
O[C@@H](CNOC1CCC1)COc1cccc2ccccc12	ZINC000819343231	CF	On-Demand	Anodyne	ADRB3	18	61
O[C@@H](CNOC1CCC1)COc1cccc2ccccc12	ZINC000819343231	CF	On-Demand	Anodyne	CYP2D6	21	49
O[C@@H](CNOC1CCC1)COc1cccc2ccccc12	ZINC000819343231	CF	On-Demand	Anodyne	ABCB1	24	40
O[C@H](CNOC1CCC1)COc1cccc2ccccc12	ZINC000819343232	CF	On-Demand	Anodyne	ADRB2	41	61
O[C@H](CNOC1CCC1)COc1cccc2ccccc12	ZINC000819343232	CF	On-Demand	Anodyne	ADRB1	55	61
O[C@H](CNOC1CCC1)COc1cccc2ccccc12	ZINC000819343232	CF	On-Demand	Anodyne	ADRB3	18	61
O[C@H](CNOC1CCC1)COc1cccc2ccccc12	ZINC000819343232	CF	On-Demand	Anodyne	CYP2D6	21	49
O[C@H](CNOC1CCC1)COc1cccc2ccccc12	ZINC000819343232	CF	On-Demand	Anodyne	ABCB1	24	40
O=[N+]([O-])c1cccc([C@H](O)CNOC2CCC2)c1	ZINC000819343234	CD	On-Demand	Bother	CACNA1C	50	37
O=[N+]([O-])c1cccc([C@H](O)CNOC2CCC2)c1	ZINC000819343234	CD	On-Demand	Bother	CACNA1D	76	37
O=[N+]([O-])c1cccc([C@@H](O)CNOC2CCC2)c1	ZINC000819343235	CD	On-Demand	Bother	CACNA1C	50	37
O=[N+]([O-])c1cccc([C@@H](O)CNOC2CCC2)c1	ZINC000819343235	CD	On-Demand	Bother	CACNA1D	76	37
CSc1ccc([C@H](CNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819343252	HH	On-Demand	Anodyne	ELANE	42	41
CSc1ccc([C@H](CNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819343252	HH	On-Demand	Anodyne	LGMN	65	35
CSc1ccc([C@@H](CNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819343253	HH	On-Demand	Anodyne	ELANE	42	41
CSc1ccc([C@@H](CNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819343253	HH	On-Demand	Anodyne	LGMN	65	35
CSc1ccc([C@H](CNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819343254	HH	On-Demand	Anodyne	ELANE	42	41
CSc1ccc([C@H](CNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819343254	HH	On-Demand	Anodyne	LGMN	65	35
CSc1ccc([C@@H](CNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819343255	HH	On-Demand	Anodyne	ELANE	42	41
CSc1ccc([C@@H](CNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)N(C)C)cc1	ZINC000819343255	HH	On-Demand	Anodyne	LGMN	65	35
CSc1ccc([C@@H](CNC(=O)c2ccc(CN3CCCCC3=O)cc2)N(C)C)cc1	ZINC000819343256	IH	On-Demand	Anodyne	NOD2	31	42
CSc1ccc([C@H](CNC(=O)c2ccc(CN3CCCCC3=O)cc2)N(C)C)cc1	ZINC000819343257	IH	On-Demand	Anodyne	NOD2	31	42
CC(C)(C)OC(=O)NCC[C@H](NC[C@H](O)c1cccc(Cl)c1)C(F)F	ZINC000819343343	GH	On-Demand	Anodyne	ADRB1	34	46
CC(C)(C)OC(=O)NCC[C@H](NC[C@H](O)c1cccc(Cl)c1)C(F)F	ZINC000819343343	GH	On-Demand	Anodyne	ADRB3	49	45
CC(C)(C)OC(=O)NCC[C@@H](NC[C@H](O)c1cccc(Cl)c1)C(F)F	ZINC000819343344	GH	On-Demand	Anodyne	ADRB1	34	46
CC(C)(C)OC(=O)NCC[C@@H](NC[C@H](O)c1cccc(Cl)c1)C(F)F	ZINC000819343344	GH	On-Demand	Anodyne	ADRB3	49	45
CC(C)(C)OC(=O)NCC[C@H](NC[C@@H](O)c1cccc(Cl)c1)C(F)F	ZINC000819343345	GH	On-Demand	Anodyne	ADRB1	34	46
CC(C)(C)OC(=O)NCC[C@H](NC[C@@H](O)c1cccc(Cl)c1)C(F)F	ZINC000819343345	GH	On-Demand	Anodyne	ADRB3	49	45
CC(C)(C)OC(=O)NCC[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C(F)F	ZINC000819343346	GH	On-Demand	Anodyne	ADRB1	34	46
CC(C)(C)OC(=O)NCC[C@@H](NC[C@@H](O)c1cccc(Cl)c1)C(F)F	ZINC000819343346	GH	On-Demand	Anodyne	ADRB3	49	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CC[C@@H](CC#N)C2)CC1	ZINC000819343349	FF	On-Demand	Mild	GPR119	27	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CC[C@@H](CC#N)C2)CC1	ZINC000819343350	FF	On-Demand	Mild	GPR119	27	40
O[C@H](CNOC1CCC1)COc1c(Cl)cccc1Cl	ZINC000819343378	DF	On-Demand	Anodyne	ADRB2	20	43
O[C@H](CNOC1CCC1)COc1c(Cl)cccc1Cl	ZINC000819343378	DF	On-Demand	Anodyne	ADRB1	33	43
O[C@@H](CNOC1CCC1)COc1c(Cl)cccc1Cl	ZINC000819343379	DF	On-Demand	Anodyne	ADRB2	20	43
O[C@@H](CNOC1CCC1)COc1c(Cl)cccc1Cl	ZINC000819343379	DF	On-Demand	Anodyne	ADRB1	33	43
O[C@@H](CNOC1CCC1)COc1ccc(-c2ccccc2)cc1	ZINC000819343388	DG	On-Demand	Anodyne	ADRB2	56	48
O[C@@H](CNOC1CCC1)COc1ccc(-c2ccccc2)cc1	ZINC000819343388	DG	On-Demand	Anodyne	ADRB1	75	48
O[C@@H](CNOC1CCC1)COc1ccc(-c2ccccc2)cc1	ZINC000819343388	DG	On-Demand	Anodyne	ADRB3	55	40
O[C@H](CNOC1CCC1)COc1ccc(-c2ccccc2)cc1	ZINC000819343390	DG	On-Demand	Anodyne	ADRB2	56	48
O[C@H](CNOC1CCC1)COc1ccc(-c2ccccc2)cc1	ZINC000819343390	DG	On-Demand	Anodyne	ADRB1	75	48
O[C@H](CNOC1CCC1)COc1ccc(-c2ccccc2)cc1	ZINC000819343390	DG	On-Demand	Anodyne	ADRB3	55	40
N#CC[C@@H]1CC[C@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819343391	CG	On-Demand	Mild	OPRL1	21	40
CSc1ccc([C@H](CNC(=O)c2ccc(C(F)(F)F)nc2Cl)N(C)C)cc1	ZINC000819343392	HJ	On-Demand	Anodyne	TRPV1	57	41
CSc1ccc([C@@H](CNC(=O)c2ccc(C(F)(F)F)nc2Cl)N(C)C)cc1	ZINC000819343393	HJ	On-Demand	Anodyne	TRPV1	57	41
CSc1ccc([C@H](CNC(=O)[C@@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)N(C)C)cc1	ZINC000819343394	II	On-Demand	Anodyne	GPR119	23	42
CSc1ccc([C@H](CNC(=O)[C@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)N(C)C)cc1	ZINC000819343398	II	On-Demand	Anodyne	GPR119	23	42
CSc1ccc([C@@H](CNC(=O)[C@@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)N(C)C)cc1	ZINC000819343400	II	On-Demand	Anodyne	GPR119	23	42
CSc1ccc([C@@H](CNC(=O)[C@H]2CC23CCN(C(=O)OC(C)(C)C)CC3)N(C)C)cc1	ZINC000819343402	II	On-Demand	Anodyne	GPR119	23	42
O[C@@H](CNOC1CCC1)COc1ccccc1F	ZINC000819343415	CD	On-Demand	Anodyne	ADRB2	33	46
O[C@@H](CNOC1CCC1)COc1ccccc1F	ZINC000819343415	CD	On-Demand	Anodyne	ADRB1	49	45
O[C@@H](CNOC1CCC1)COc1ccccc1F	ZINC000819343415	CD	On-Demand	Anodyne	ABCB1	21	41
O[C@H](CNOC1CCC1)COc1ccccc1F	ZINC000819343417	CD	On-Demand	Anodyne	ADRB2	33	46
O[C@H](CNOC1CCC1)COc1ccccc1F	ZINC000819343417	CD	On-Demand	Anodyne	ADRB1	49	45
O[C@H](CNOC1CCC1)COc1ccccc1F	ZINC000819343417	CD	On-Demand	Anodyne	ABCB1	21	41
CSc1ccc([C@H](CNC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)N(C)C)cc1	ZINC000819343434	GF	On-Demand	Anodyne	INHA	23	43
CSc1ccc([C@H](CNC(=O)[C@H]2CC(=O)N(C3CCCC3)C2)N(C)C)cc1	ZINC000819343436	GF	On-Demand	Anodyne	INHA	23	43
CSc1ccc([C@@H](CNC(=O)[C@H]2CC(=O)N(C3CCCC3)C2)N(C)C)cc1	ZINC000819343437	GF	On-Demand	Anodyne	INHA	23	43
CSc1ccc([C@@H](CNC(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)N(C)C)cc1	ZINC000819343439	GF	On-Demand	Anodyne	INHA	23	43
C=CCc1ccc(OC[C@@H](O)CNOC2CCC2)c(OC)c1	ZINC000819343450	DE	On-Demand	Mild	ADRB2	15	43
C=CCc1ccc(OC[C@@H](O)CNOC2CCC2)c(OC)c1	ZINC000819343450	DE	On-Demand	Mild	ADRB1	20	46
C=CCc1ccc(OC[C@H](O)CNOC2CCC2)c(OC)c1	ZINC000819343452	DE	On-Demand	Mild	ADRB2	15	43
C=CCc1ccc(OC[C@H](O)CNOC2CCC2)c(OC)c1	ZINC000819343452	DE	On-Demand	Mild	ADRB1	20	46
CSc1ccc([C@H](CNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)N(C)C)cc1	ZINC000819343465	GI	On-Demand	Bother	GSTM2	40	39
CSc1ccc([C@@H](CNC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)N(C)C)cc1	ZINC000819343467	GI	On-Demand	Bother	GSTM2	40	39
CC[C@@H](CNS(C)(=O)=O)NC[C@@H](O)c1ccccc1	ZINC000819343473	CC	On-Demand	Anodyne	ADRB3	39	40
CC[C@@H](CNS(C)(=O)=O)NC[C@H](O)c1ccccc1	ZINC000819343474	CC	On-Demand	Anodyne	ADRB3	39	40
O=C(CCNOC1CCC1)Nc1cccc(C(F)(F)F)c1	ZINC000819343476	DG	On-Demand	Anodyne	HDAC10	18	57
O=C(CCNOC1CCC1)Nc1cccc(C(F)(F)F)c1	ZINC000819343476	DG	On-Demand	Anodyne	HDAC3	18	41
O=C(CCNOC1CCC1)Nc1cccc(C(F)(F)F)c1	ZINC000819343476	DG	On-Demand	Anodyne	HDAC6	16	57
O=C(CCNOC1CCC1)Nc1cccc(C(F)(F)F)c1	ZINC000819343476	DG	On-Demand	Anodyne	CCR2	35	43
O=C(CCNOC1CCC1)Nc1cccc(C(F)(F)F)c1	ZINC000819343476	DG	On-Demand	Anodyne	EPHX2	20	50
O=C(CCNOC1CCC1)Nc1cccc(Cl)c1	ZINC000819343496	CF	On-Demand	Anodyne	MCHR1	19	40
O[C@@H](CNOC1CCC1)COc1ccc2ccccc2c1	ZINC000819343500	CF	On-Demand	Anodyne	ADRB2	48	61
O[C@@H](CNOC1CCC1)COc1ccc2ccccc2c1	ZINC000819343500	CF	On-Demand	Anodyne	ADRB1	53	45
O[C@@H](CNOC1CCC1)COc1ccc2ccccc2c1	ZINC000819343500	CF	On-Demand	Anodyne	CASR	40	37
O[C@@H](CNOC1CCC1)COc1ccc2ccccc2c1	ZINC000819343500	CF	On-Demand	Anodyne	CYP2D6	15	41
O[C@H](CNOC1CCC1)COc1ccc2ccccc2c1	ZINC000819343501	CF	On-Demand	Anodyne	ADRB2	48	61
O[C@H](CNOC1CCC1)COc1ccc2ccccc2c1	ZINC000819343501	CF	On-Demand	Anodyne	ADRB1	53	45
O[C@H](CNOC1CCC1)COc1ccc2ccccc2c1	ZINC000819343501	CF	On-Demand	Anodyne	CASR	40	37
O[C@H](CNOC1CCC1)COc1ccc2ccccc2c1	ZINC000819343501	CF	On-Demand	Anodyne	CYP2D6	15	41
N#CCc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819343516	CD	On-Demand	Mild	ADRB2	37	44
N#CCc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819343516	CD	On-Demand	Mild	ADRB1	57	54
N#CCc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819343517	CD	On-Demand	Mild	ADRB2	37	44
N#CCc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819343517	CD	On-Demand	Mild	ADRB1	57	54
O[C@H](CNOC1CCC1)c1ccccc1	ZINC000819343551	BD	On-Demand	Anodyne	ADRB1	16	42
O[C@H](CNOC1CCC1)c1ccccc1	ZINC000819343551	BD	On-Demand	Anodyne	SLC6A3	15	48
O[C@H](CNOC1CCC1)c1ccccc1	ZINC000819343551	BD	On-Demand	Anodyne	ADRB3	35	42
O[C@H](CNOC1CCC1)c1ccccc1	ZINC000819343551	BD	On-Demand	Anodyne	AOC3	15	47
O[C@H](CNOC1CCC1)c1ccccc1	ZINC000819343551	BD	On-Demand	Anodyne	Q8WSF8_APLCA	26	43
O[C@@H](CNOC1CCC1)c1ccccc1	ZINC000819343552	BD	On-Demand	Anodyne	ADRB1	16	42
O[C@@H](CNOC1CCC1)c1ccccc1	ZINC000819343552	BD	On-Demand	Anodyne	SLC6A3	15	48
O[C@@H](CNOC1CCC1)c1ccccc1	ZINC000819343552	BD	On-Demand	Anodyne	ADRB3	35	42
O[C@@H](CNOC1CCC1)c1ccccc1	ZINC000819343552	BD	On-Demand	Anodyne	AOC3	15	47
O[C@@H](CNOC1CCC1)c1ccccc1	ZINC000819343552	BD	On-Demand	Anodyne	Q8WSF8_APLCA	26	43
CCOc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819343555	CD	On-Demand	Anodyne	ADRB2	49	47
CCOc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819343555	CD	On-Demand	Anodyne	ADRB1	59	52
CCOc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819343556	CD	On-Demand	Anodyne	ADRB2	49	47
CCOc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819343556	CD	On-Demand	Anodyne	ADRB1	59	52
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNOC1CCC1	ZINC000819343557	CD	On-Demand	Bother	ADRB2	25	42
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNOC1CCC1	ZINC000819343557	CD	On-Demand	Bother	ADRB1	49	34
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNOC1CCC1	ZINC000819343557	CD	On-Demand	Bother	ABCB1	17	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNOC1CCC1	ZINC000819343558	CD	On-Demand	Bother	ADRB2	25	42
O=[N+]([O-])c1ccccc1OC[C@H](O)CNOC1CCC1	ZINC000819343558	CD	On-Demand	Bother	ADRB1	49	34
O=[N+]([O-])c1ccccc1OC[C@H](O)CNOC1CCC1	ZINC000819343558	CD	On-Demand	Bother	ABCB1	17	40
O[C@H](CNOC1CCC1)c1cccc(Cl)c1	ZINC000819343564	BE	On-Demand	Anodyne	ADRB1	47	48
O[C@H](CNOC1CCC1)c1cccc(Cl)c1	ZINC000819343564	BE	On-Demand	Anodyne	ADRB3	57	48
O[C@H](CNOC1CCC1)c1cccc(Cl)c1	ZINC000819343564	BE	On-Demand	Anodyne	CYP3A4	46	35
O[C@@H](CNOC1CCC1)c1cccc(Cl)c1	ZINC000819343565	BE	On-Demand	Anodyne	ADRB1	47	48
O[C@@H](CNOC1CCC1)c1cccc(Cl)c1	ZINC000819343565	BE	On-Demand	Anodyne	ADRB3	57	48
O[C@@H](CNOC1CCC1)c1cccc(Cl)c1	ZINC000819343565	BE	On-Demand	Anodyne	CYP3A4	46	35
Cc1ccc(OC[C@H](O)CNOC2CCC2)c(C)c1	ZINC000819343570	CE	On-Demand	Anodyne	ADRB2	24	51
Cc1ccc(OC[C@@H](O)CNOC2CCC2)c(C)c1	ZINC000819343571	CE	On-Demand	Anodyne	ADRB2	24	51
CC(C)(C)OC(=O)NCC[C@H](NC[C@H](O)c1cccc(F)c1)C(F)F	ZINC000819343585	FF	On-Demand	Anodyne	PAPA1_CARPA	15	40
CC(C)(C)OC(=O)NCC[C@@H](NC[C@H](O)c1cccc(F)c1)C(F)F	ZINC000819343586	FF	On-Demand	Anodyne	PAPA1_CARPA	15	40
CC(C)(C)OC(=O)NCC[C@H](NC[C@@H](O)c1cccc(F)c1)C(F)F	ZINC000819343587	FF	On-Demand	Anodyne	PAPA1_CARPA	15	40
CC(C)(C)OC(=O)NCC[C@@H](NC[C@@H](O)c1cccc(F)c1)C(F)F	ZINC000819343588	FF	On-Demand	Anodyne	PAPA1_CARPA	15	40
C=C(Cl)CSc1nc(C)c(CC(=O)N(c2nc(C)cs2)C2CC2)s1	ZINC000819343589	GJ	On-Demand	Mild	SLC12A5	20	47
O[C@H](CCc1ccccc1)CNOC1CCC1	ZINC000819343590	BE	On-Demand	Anodyne	SLC18A2	63	40
O[C@@H](CCc1ccccc1)CNOC1CCC1	ZINC000819343591	BE	On-Demand	Anodyne	SLC18A2	63	40
O[C@H](CNOC1CCC1)COc1ccc(Br)cc1	ZINC000819343620	DE	On-Demand	Anodyne	ADRB2	35	43
O[C@H](CNOC1CCC1)COc1ccc(Br)cc1	ZINC000819343620	DE	On-Demand	Anodyne	ADRB1	50	50
O[C@H](CNOC1CCC1)COc1ccc(Br)cc1	ZINC000819343620	DE	On-Demand	Anodyne	ADRB3	27	40
O[C@@H](CNOC1CCC1)COc1ccc(Br)cc1	ZINC000819343621	DE	On-Demand	Anodyne	ADRB2	35	43
O[C@@H](CNOC1CCC1)COc1ccc(Br)cc1	ZINC000819343621	DE	On-Demand	Anodyne	ADRB1	50	50
O[C@@H](CNOC1CCC1)COc1ccc(Br)cc1	ZINC000819343621	DE	On-Demand	Anodyne	ADRB3	27	40
COCCc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819343630	CD	On-Demand	Anodyne	ADRB2	52	65
COCCc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819343630	CD	On-Demand	Anodyne	ADRB1	79	65
COCCc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819343630	CD	On-Demand	Anodyne	ADRB3	53	45
COCCc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819343631	CD	On-Demand	Anodyne	ADRB2	52	65
COCCc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819343631	CD	On-Demand	Anodyne	ADRB1	79	65
COCCc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819343631	CD	On-Demand	Anodyne	ADRB3	53	45
O[C@H](CNOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819343644	DF	On-Demand	Anodyne	ADRB2	35	41
O[C@H](CNOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819343644	DF	On-Demand	Anodyne	ADRB1	44	46
O[C@H](CNOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819343644	DF	On-Demand	Anodyne	HRH1	26	46
O[C@H](CNOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819343644	DF	On-Demand	Anodyne	GRIN1	24	40
O[C@H](CNOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819343644	DF	On-Demand	Anodyne	CCR3	28	46
O[C@@H](CNOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819343645	DF	On-Demand	Anodyne	ADRB2	35	41
O[C@@H](CNOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819343645	DF	On-Demand	Anodyne	ADRB1	44	46
O[C@@H](CNOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819343645	DF	On-Demand	Anodyne	HRH1	26	46
O[C@@H](CNOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819343645	DF	On-Demand	Anodyne	GRIN1	24	40
O[C@@H](CNOC1CCC1)COc1ccc(Cl)c(Cl)c1	ZINC000819343645	DF	On-Demand	Anodyne	CCR3	28	46
O=C(CCNOC1CCC1)Nc1cccc(Br)c1	ZINC000819343646	DF	On-Demand	Anodyne	EGFR	23	40
O=C(CCNOC1CCC1)Nc1cccc(Br)c1	ZINC000819343646	DF	On-Demand	Anodyne	HDAC2	19	42
CC(=O)c1cccc(OC[C@H](O)CNOC2CCC2)c1	ZINC000819343666	CD	On-Demand	Anodyne	ADRB2	40	48
CC(=O)c1cccc(OC[C@H](O)CNOC2CCC2)c1	ZINC000819343666	CD	On-Demand	Anodyne	ADRB1	56	44
CC(=O)c1cccc(OC[C@H](O)CNOC2CCC2)c1	ZINC000819343666	CD	On-Demand	Anodyne	ABCB1	26	49
CC(=O)c1cccc(OC[C@H](O)CNOC2CCC2)c1	ZINC000819343666	CD	On-Demand	Anodyne	PDS	41	35
CC(=O)c1cccc(OC[C@@H](O)CNOC2CCC2)c1	ZINC000819343667	CD	On-Demand	Anodyne	ADRB2	40	48
CC(=O)c1cccc(OC[C@@H](O)CNOC2CCC2)c1	ZINC000819343667	CD	On-Demand	Anodyne	ADRB1	56	44
CC(=O)c1cccc(OC[C@@H](O)CNOC2CCC2)c1	ZINC000819343667	CD	On-Demand	Anodyne	ABCB1	26	49
CC(=O)c1cccc(OC[C@@H](O)CNOC2CCC2)c1	ZINC000819343667	CD	On-Demand	Anodyne	PDS	41	35
O[C@H](CNOC1CCC1)COCc1ccccc1	ZINC000819343691	CD	On-Demand	Anodyne	ADRB1	23	44
O[C@@H](CNOC1CCC1)COCc1ccccc1	ZINC000819343692	CD	On-Demand	Anodyne	ADRB1	23	44
O[C@@H](CNOC1CCC1)COc1ccccc1Cl	ZINC000819343693	CE	On-Demand	Anodyne	ADRB2	32	46
O[C@@H](CNOC1CCC1)COc1ccccc1Cl	ZINC000819343693	CE	On-Demand	Anodyne	ADRB1	49	45
O[C@@H](CNOC1CCC1)COc1ccccc1Cl	ZINC000819343693	CE	On-Demand	Anodyne	ABCB1	25	41
O[C@H](CNOC1CCC1)COc1ccccc1Cl	ZINC000819343694	CE	On-Demand	Anodyne	ADRB2	32	46
O[C@H](CNOC1CCC1)COc1ccccc1Cl	ZINC000819343694	CE	On-Demand	Anodyne	ADRB1	49	45
O[C@H](CNOC1CCC1)COc1ccccc1Cl	ZINC000819343694	CE	On-Demand	Anodyne	ABCB1	25	41
CCOC(=O)COCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819343784	DD	On-Demand	Anodyne	ADRB1	36	41
CCOC(=O)COCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819343784	DD	On-Demand	Anodyne	ADRB3	36	41
CC(=O)CCc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819343870	DE	On-Demand	Anodyne	ADRB2	51	49
CC(=O)CCc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819343870	DE	On-Demand	Anodyne	ADRB1	83	54
CC(=O)CCc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819343870	DE	On-Demand	Anodyne	ADRB3	59	46
CC(=O)CCc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819343870	DE	On-Demand	Anodyne	ABCB1	38	42
CC(=O)CCc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819343871	DE	On-Demand	Anodyne	ADRB2	51	49
CC(=O)CCc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819343871	DE	On-Demand	Anodyne	ADRB1	83	54
CC(=O)CCc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819343871	DE	On-Demand	Anodyne	ADRB3	59	46
CC(=O)CCc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819343871	DE	On-Demand	Anodyne	ABCB1	38	42
CC[C@@H](CNS(C)(=O)=O)NC[C@@H](O)c1cccc(F)c1	ZINC000819343876	DC	On-Demand	Anodyne	ADRB3	31	40
CC[C@@H](CNS(C)(=O)=O)NC[C@H](O)c1cccc(F)c1	ZINC000819343877	DC	On-Demand	Anodyne	ADRB3	31	40
CSc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819343890	CE	On-Demand	Anodyne	ADRB2	36	43
CSc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819343890	CE	On-Demand	Anodyne	ADRB1	48	49
CSc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819343891	CE	On-Demand	Anodyne	ADRB2	36	43
CSc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819343891	CE	On-Demand	Anodyne	ADRB1	48	49
CC[C@@H](CNS(C)(=O)=O)NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819343892	FD	On-Demand	Anodyne	ADRB3	23	48
CC[C@@H](CNS(C)(=O)=O)NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819343894	FD	On-Demand	Anodyne	ADRB3	23	48
Cc1ncsc1CCNC[C@@H](O)c1cccnc1	ZINC000819343928	CD	On-Demand	Anodyne	ADRB2	35	52
Cc1ncsc1CCNC[C@@H](O)c1cccnc1	ZINC000819343928	CD	On-Demand	Anodyne	ADRB1	47	52
Cc1ncsc1CCNC[C@@H](O)c1cccnc1	ZINC000819343928	CD	On-Demand	Anodyne	ADRB3	130	53
Cc1ncsc1CCNC[C@H](O)c1cccnc1	ZINC000819343929	CD	On-Demand	Anodyne	ADRB2	35	52
Cc1ncsc1CCNC[C@H](O)c1cccnc1	ZINC000819343929	CD	On-Demand	Anodyne	ADRB1	47	52
Cc1ncsc1CCNC[C@H](O)c1cccnc1	ZINC000819343929	CD	On-Demand	Anodyne	ADRB3	130	53
CC[C@@](C)(CNC[C@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819343942	CE	On-Demand	Bother	CACNA1C	48	35
CC[C@@](C)(CNC[C@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819343942	CE	On-Demand	Bother	CACNA1D	74	35
CC[C@@](C)(CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819343943	CE	On-Demand	Bother	CACNA1C	48	35
CC[C@@](C)(CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)OC	ZINC000819343943	CE	On-Demand	Bother	CACNA1D	74	35
Cc1ncsc1CCNC[C@@H](O)c1cccc(Br)c1	ZINC000819343955	EG	On-Demand	Anodyne	ADRB3	57	38
Cc1ncsc1CCNC[C@H](O)c1cccc(Br)c1	ZINC000819343956	EG	On-Demand	Anodyne	ADRB3	57	38
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)c1ccc(Cl)cc1	ZINC000819343975	GI	On-Demand	Anodyne	ADRB3	20	43
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)c1ccc(Cl)cc1	ZINC000819343976	GI	On-Demand	Anodyne	ADRB3	20	43
CC/C=C\CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819343977	BF	On-Demand	Anodyne	ADRB2	32	45
CC/C=C\CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819343977	BF	On-Demand	Anodyne	ADRB1	45	49
CC/C=C\CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819343977	BF	On-Demand	Anodyne	ADRB3	59	49
CC/C=C/CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819343978	BF	On-Demand	Anodyne	ADRB2	32	45
CC/C=C/CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819343978	BF	On-Demand	Anodyne	ADRB1	45	49
CC/C=C/CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819343978	BF	On-Demand	Anodyne	ADRB3	59	49
CC/C=C/CNC[C@H](O)c1cccc(Cl)c1	ZINC000819343979	BF	On-Demand	Anodyne	ADRB2	32	45
CC/C=C/CNC[C@H](O)c1cccc(Cl)c1	ZINC000819343979	BF	On-Demand	Anodyne	ADRB1	45	49
CC/C=C/CNC[C@H](O)c1cccc(Cl)c1	ZINC000819343979	BF	On-Demand	Anodyne	ADRB3	59	49
CC/C=C\CNC[C@H](O)c1cccc(Cl)c1	ZINC000819343980	BF	On-Demand	Anodyne	ADRB2	32	45
CC/C=C\CNC[C@H](O)c1cccc(Cl)c1	ZINC000819343980	BF	On-Demand	Anodyne	ADRB1	45	49
CC/C=C\CNC[C@H](O)c1cccc(Cl)c1	ZINC000819343980	BF	On-Demand	Anodyne	ADRB3	59	49
O=C(CCNOC1CCC1)Nc1cccnc1	ZINC000819343993	BD	On-Demand	Anodyne	CHRNA7	26	41
O=C(CCNOC1CCC1)Nc1cccnc1	ZINC000819343993	BD	On-Demand	Anodyne	NAMPT	34	44
O[C@@H](CNOC1CCC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819344029	EG	On-Demand	Anodyne	ADRB2	55	51
O[C@@H](CNOC1CCC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819344029	EG	On-Demand	Anodyne	ADRB1	75	48
O[C@@H](CNOC1CCC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819344029	EG	On-Demand	Anodyne	ADRB3	53	43
O[C@H](CNOC1CCC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819344030	EG	On-Demand	Anodyne	ADRB2	55	51
O[C@H](CNOC1CCC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819344030	EG	On-Demand	Anodyne	ADRB1	75	48
O[C@H](CNOC1CCC1)COc1ccc(Oc2ccccc2)cc1	ZINC000819344030	EG	On-Demand	Anodyne	ADRB3	53	43
O[C@H](CNOC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819344059	DF	On-Demand	Anodyne	ADRB2	27	42
O[C@H](CNOC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819344059	DF	On-Demand	Anodyne	ADRB1	36	48
O[C@H](CNOC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819344059	DF	On-Demand	Anodyne	PDS	47	41
O[C@@H](CNOC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819344060	DF	On-Demand	Anodyne	ADRB2	27	42
O[C@@H](CNOC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819344060	DF	On-Demand	Anodyne	ADRB1	36	48
O[C@@H](CNOC1CCC1)COc1cccc(C(F)(F)F)c1	ZINC000819344060	DF	On-Demand	Anodyne	PDS	47	41
O[C@H](CNOC1CCC1)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819344063	FH	On-Demand	Anodyne	SLC6A4	16	41
O[C@H](CNOC1CCC1)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819344063	FH	On-Demand	Anodyne	SLC6A3	49	42
O[C@@H](CNOC1CCC1)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819344064	FH	On-Demand	Anodyne	SLC6A4	16	41
O[C@@H](CNOC1CCC1)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819344064	FH	On-Demand	Anodyne	SLC6A3	49	42
CC(=O)Nc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819344071	CD	On-Demand	Anodyne	ADRB2	55	64
CC(=O)Nc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819344071	CD	On-Demand	Anodyne	ADRB1	89	64
CC(=O)Nc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819344071	CD	On-Demand	Anodyne	TSHR	40	30
CC(=O)Nc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819344071	CD	On-Demand	Anodyne	ADRB3	58	52
CC(=O)Nc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819344072	CD	On-Demand	Anodyne	ADRB2	55	64
CC(=O)Nc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819344072	CD	On-Demand	Anodyne	ADRB1	89	64
CC(=O)Nc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819344072	CD	On-Demand	Anodyne	TSHR	40	30
CC(=O)Nc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819344072	CD	On-Demand	Anodyne	ADRB3	58	52
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1cn[nH]c1	ZINC000819344076	DD	On-Demand	Mild	PAPA1_CARPA	41	40
O[C@H](CNOC1CCC1)COc1cccc2[nH]ccc12	ZINC000819344077	CD	On-Demand	Anodyne	ADRB2	26	76
O[C@H](CNOC1CCC1)COc1cccc2[nH]ccc12	ZINC000819344077	CD	On-Demand	Anodyne	ADRB1	40	76
O[C@H](CNOC1CCC1)COc1cccc2[nH]ccc12	ZINC000819344077	CD	On-Demand	Anodyne	HTR1A	18	76
O[C@H](CNOC1CCC1)COc1cccc2[nH]ccc12	ZINC000819344077	CD	On-Demand	Anodyne	SLC6A4	20	47
O[C@@H](CNOC1CCC1)COc1cccc2[nH]ccc12	ZINC000819344078	CD	On-Demand	Anodyne	ADRB2	26	76
O[C@@H](CNOC1CCC1)COc1cccc2[nH]ccc12	ZINC000819344078	CD	On-Demand	Anodyne	ADRB1	40	76
O[C@@H](CNOC1CCC1)COc1cccc2[nH]ccc12	ZINC000819344078	CD	On-Demand	Anodyne	HTR1A	18	76
O[C@@H](CNOC1CCC1)COc1cccc2[nH]ccc12	ZINC000819344078	CD	On-Demand	Anodyne	SLC6A4	20	47
O[C@H](CNOC1CCC1)c1ccc(F)cc1	ZINC000819344083	BD	On-Demand	Anodyne	SLC6A3	22	46
O[C@@H](CNOC1CCC1)c1ccc(F)cc1	ZINC000819344084	BD	On-Demand	Anodyne	SLC6A3	22	46
COc1ccc(OCC(F)(F)C(F)F)c(C(=O)N(C)c2cn[nH]c2)c1	ZINC000819344085	FF	On-Demand	Anodyne	ROCK2	49	33
CC/C=C/CNC[C@@H](O)c1cccnc1	ZINC000819344086	BD	On-Demand	Anodyne	ADRB2	27	47
CC/C=C/CNC[C@@H](O)c1cccnc1	ZINC000819344086	BD	On-Demand	Anodyne	ADRB1	28	45
CC/C=C/CNC[C@@H](O)c1cccnc1	ZINC000819344086	BD	On-Demand	Anodyne	ADRB3	103	48
CC/C=C/CNC[C@@H](O)c1cccnc1	ZINC000819344086	BD	On-Demand	Anodyne	CYP51A1	16	40
CC/C=C\CNC[C@H](O)c1cccnc1	ZINC000819344087	BD	On-Demand	Anodyne	ADRB2	27	47
CC/C=C\CNC[C@H](O)c1cccnc1	ZINC000819344087	BD	On-Demand	Anodyne	ADRB1	28	45
CC/C=C\CNC[C@H](O)c1cccnc1	ZINC000819344087	BD	On-Demand	Anodyne	ADRB3	103	48
CC/C=C\CNC[C@H](O)c1cccnc1	ZINC000819344087	BD	On-Demand	Anodyne	CYP51A1	16	40
CC/C=C/CNC[C@H](O)c1cccnc1	ZINC000819344088	BD	On-Demand	Anodyne	ADRB2	27	47
CC/C=C/CNC[C@H](O)c1cccnc1	ZINC000819344088	BD	On-Demand	Anodyne	ADRB1	28	45
CC/C=C/CNC[C@H](O)c1cccnc1	ZINC000819344088	BD	On-Demand	Anodyne	ADRB3	103	48
CC/C=C/CNC[C@H](O)c1cccnc1	ZINC000819344088	BD	On-Demand	Anodyne	CYP51A1	16	40
CC/C=C\CNC[C@@H](O)c1cccnc1	ZINC000819344089	BD	On-Demand	Anodyne	ADRB2	27	47
CC/C=C\CNC[C@@H](O)c1cccnc1	ZINC000819344089	BD	On-Demand	Anodyne	ADRB1	28	45
CC/C=C\CNC[C@@H](O)c1cccnc1	ZINC000819344089	BD	On-Demand	Anodyne	ADRB3	103	48
CC/C=C\CNC[C@@H](O)c1cccnc1	ZINC000819344089	BD	On-Demand	Anodyne	CYP51A1	16	40
CC[C@@H](CNS(C)(=O)=O)NC[C@@H](O)c1cccnc1	ZINC000819344096	CC	On-Demand	Anodyne	ADRB1	23	46
CC[C@@H](CNS(C)(=O)=O)NC[C@@H](O)c1cccnc1	ZINC000819344096	CC	On-Demand	Anodyne	ADRB3	98	46
CC[C@@H](CNS(C)(=O)=O)NC[C@H](O)c1cccnc1	ZINC000819344097	CC	On-Demand	Anodyne	ADRB1	23	46
CC[C@@H](CNS(C)(=O)=O)NC[C@H](O)c1cccnc1	ZINC000819344097	CC	On-Demand	Anodyne	ADRB3	98	46
COC(=O)c1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819344099	CD	On-Demand	Anodyne	ADRB2	51	50
COC(=O)c1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819344099	CD	On-Demand	Anodyne	ADRB1	72	48
COC(=O)c1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819344099	CD	On-Demand	Anodyne	ADRB3	48	43
COC(=O)c1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819344100	CD	On-Demand	Anodyne	ADRB2	51	50
COC(=O)c1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819344100	CD	On-Demand	Anodyne	ADRB1	72	48
COC(=O)c1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819344100	CD	On-Demand	Anodyne	ADRB3	48	43
Cc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819344105	CD	On-Demand	Anodyne	ADRB2	47	60
Cc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819344105	CD	On-Demand	Anodyne	ADRB1	58	52
Cc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819344105	CD	On-Demand	Anodyne	ADRB3	33	40
Cc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819344106	CD	On-Demand	Anodyne	ADRB2	47	60
Cc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819344106	CD	On-Demand	Anodyne	ADRB1	58	52
Cc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819344106	CD	On-Demand	Anodyne	ADRB3	33	40
CC[C@@H](CNS(C)(=O)=O)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819344119	ED	On-Demand	Anodyne	ADRB3	19	40
CC[C@@H](CNS(C)(=O)=O)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819344121	ED	On-Demand	Anodyne	ADRB3	19	40
CC(=O)c1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819344127	CD	On-Demand	Anodyne	ADRB2	43	47
CC(=O)c1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819344127	CD	On-Demand	Anodyne	ADRB1	64	48
CC(=O)c1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819344127	CD	On-Demand	Anodyne	ADRB3	39	41
CC(=O)c1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819344127	CD	On-Demand	Anodyne	ABCB1	17	51
CC(=O)c1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819344128	CD	On-Demand	Anodyne	ADRB2	43	47
CC(=O)c1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819344128	CD	On-Demand	Anodyne	ADRB1	64	48
CC(=O)c1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819344128	CD	On-Demand	Anodyne	ADRB3	39	41
CC(=O)c1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819344128	CD	On-Demand	Anodyne	ABCB1	17	51
N#CC[C@@H]1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819344130	CG	On-Demand	Mild	ADRB3	16	42
O[C@H](CNOC1CCC1)COC(c1ccccc1)c1ccccc1	ZINC000819344138	EG	On-Demand	Anodyne	CASR	17	45
O[C@@H](CNOC1CCC1)COC(c1ccccc1)c1ccccc1	ZINC000819344140	EG	On-Demand	Anodyne	CASR	17	45
CCOC(=O)COCCNC[C@@H](O)c1cccc(Br)c1	ZINC000819344159	ED	On-Demand	Anodyne	ADRB1	46	39
CCOC(=O)COCCNC[C@@H](O)c1cccc(Br)c1	ZINC000819344159	ED	On-Demand	Anodyne	ADRB3	53	41
CCOC(=O)COCCNC[C@H](O)c1cccc(Br)c1	ZINC000819344161	ED	On-Demand	Anodyne	ADRB1	46	39
CCOC(=O)COCCNC[C@H](O)c1cccc(Br)c1	ZINC000819344161	ED	On-Demand	Anodyne	ADRB3	53	41
O=C(O)C[C@@H]1CCCN(C(=O)C2CC(OCc3ccccc3)C2)C1	ZINC000819344186	EF	On-Demand	Anodyne	PREP	90	45
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)COc1ccccc1	ZINC000819344188	GG	On-Demand	Anodyne	ADRB2	44	44
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)COc1ccccc1	ZINC000819344188	GG	On-Demand	Anodyne	ADRB1	59	40
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)COc1ccccc1	ZINC000819344188	GG	On-Demand	Anodyne	ADRB3	39	40
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)COc1ccccc1	ZINC000819344188	GG	On-Demand	Anodyne	FPR1	41	34
O=C(O)C[C@H]1CCCN(C(=O)C2CC(OCc3ccccc3)C2)C1	ZINC000819344190	EF	On-Demand	Anodyne	PREP	90	45
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)COc1ccccc1	ZINC000819344192	GG	On-Demand	Anodyne	ADRB2	44	44
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)COc1ccccc1	ZINC000819344192	GG	On-Demand	Anodyne	ADRB1	59	40
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)COc1ccccc1	ZINC000819344192	GG	On-Demand	Anodyne	ADRB3	39	40
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)COc1ccccc1	ZINC000819344192	GG	On-Demand	Anodyne	FPR1	41	34
O=[N+]([O-])c1cccc(OC[C@H](O)CNOC2CCC2)c1	ZINC000819344196	CD	On-Demand	Bother	ADRB2	23	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNOC2CCC2)c1	ZINC000819344196	CD	On-Demand	Bother	ADRB1	40	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNOC2CCC2)c1	ZINC000819344196	CD	On-Demand	Bother	ADRB3	18	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNOC2CCC2)c1	ZINC000819344196	CD	On-Demand	Bother	CACNA1D	61	35
O=[N+]([O-])c1cccc(OC[C@H](O)CNOC2CCC2)c1	ZINC000819344196	CD	On-Demand	Bother	ACR	15	42
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOC2CCC2)c1	ZINC000819344198	CD	On-Demand	Bother	ADRB2	23	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOC2CCC2)c1	ZINC000819344198	CD	On-Demand	Bother	ADRB1	40	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOC2CCC2)c1	ZINC000819344198	CD	On-Demand	Bother	ADRB3	18	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOC2CCC2)c1	ZINC000819344198	CD	On-Demand	Bother	CACNA1D	61	35
O=[N+]([O-])c1cccc(OC[C@@H](O)CNOC2CCC2)c1	ZINC000819344198	CD	On-Demand	Bother	ACR	15	42
O=C(O)C[C@H]1CCCN(C(=O)CCCOc2ccc3c(c2)OCO3)C1	ZINC000819344200	EE	On-Demand	Anodyne	EDNRB	54	40
O=C(O)C[C@H]1CCCN(C(=O)CCCOc2ccc3c(c2)OCO3)C1	ZINC000819344200	EE	On-Demand	Anodyne	EDNRA	57	41
O=C(O)C[C@H]1CCCN(C(=O)CCCOc2ccc3c(c2)OCO3)C1	ZINC000819344200	EE	On-Demand	Anodyne	NOS2	53	33
O=C(O)C[C@@H]1CCCN(C(=O)CCCOc2ccc3c(c2)OCO3)C1	ZINC000819344203	EE	On-Demand	Anodyne	EDNRB	54	40
O=C(O)C[C@@H]1CCCN(C(=O)CCCOc2ccc3c(c2)OCO3)C1	ZINC000819344203	EE	On-Demand	Anodyne	EDNRA	57	41
O=C(O)C[C@@H]1CCCN(C(=O)CCCOc2ccc3c(c2)OCO3)C1	ZINC000819344203	EE	On-Demand	Anodyne	NOS2	53	33
O=C(O)C[C@H]1CCCN(C(=O)CCc2nc(-c3ncccn3)no2)C1	ZINC000819344206	ED	On-Demand	Anodyne	ETHR	42	34
O=C(O)C[C@@H]1CCCN(C(=O)CCc2nc(-c3ncccn3)no2)C1	ZINC000819344211	ED	On-Demand	Anodyne	ETHR	42	34
O=C(O)C[C@@H]1CCCN(C(=O)CCCOc2ccc3c(c2)CCC3)C1	ZINC000819344214	EG	On-Demand	Anodyne	PPARG	42	41
O=C(O)C[C@@H]1CCCN(C(=O)CCCOc2ccc3c(c2)CCC3)C1	ZINC000819344214	EG	On-Demand	Anodyne	HRH3	19	42
O=C(O)C[C@@H]1CCCN(C(=O)CCCOc2ccc3c(c2)CCC3)C1	ZINC000819344214	EG	On-Demand	Anodyne	PPARD	54	41
O=C(O)C[C@H]1CCCN(C(=O)CCCOc2ccc3c(c2)CCC3)C1	ZINC000819344218	EG	On-Demand	Anodyne	PPARG	42	41
O=C(O)C[C@H]1CCCN(C(=O)CCCOc2ccc3c(c2)CCC3)C1	ZINC000819344218	EG	On-Demand	Anodyne	HRH3	19	42
O=C(O)C[C@H]1CCCN(C(=O)CCCOc2ccc3c(c2)CCC3)C1	ZINC000819344218	EG	On-Demand	Anodyne	PPARD	54	41
N#CC[C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819344229	CG	On-Demand	Mild	ADRB1	29	44
N#CC[C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819344229	CG	On-Demand	Mild	ADRB3	47	46
N#CC[C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819344229	CG	On-Demand	Mild	CYP3A4	41	35
N#CC[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819344232	CG	On-Demand	Mild	ADRB1	29	44
N#CC[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819344232	CG	On-Demand	Mild	ADRB3	47	46
N#CC[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819344232	CG	On-Demand	Mild	CYP3A4	41	35
O=C(CCNOC1CCC1)Nc1ccccc1	ZINC000819344235	BE	On-Demand	Anodyne	LTA4H	32	40
O=C(CCNOC1CCC1)Nc1ccccc1	ZINC000819344235	BE	On-Demand	Anodyne	HDAC8	24	48
O=C(CCNOC1CCC1)Nc1ccccc1	ZINC000819344235	BE	On-Demand	Anodyne	HDAC10	46	48
O=C(CCNOC1CCC1)Nc1ccccc1	ZINC000819344235	BE	On-Demand	Anodyne	HDAC1	17	48
O=C(CCNOC1CCC1)Nc1ccccc1	ZINC000819344235	BE	On-Demand	Anodyne	HDAC2	29	48
O=C(CCNOC1CCC1)Nc1ccccc1	ZINC000819344235	BE	On-Demand	Anodyne	HDAC3	31	48
O=C(CCNOC1CCC1)Nc1ccccc1	ZINC000819344235	BE	On-Demand	Anodyne	HDAC6	34	48
O=C(CCNOC1CCC1)Nc1ccccc1	ZINC000819344235	BE	On-Demand	Anodyne	HDAC11	38	48
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819344247	GF	On-Demand	Anodyne	CELA1	20	47
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819344247	GF	On-Demand	Anodyne	GRIN2B	39	49
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819344247	GF	On-Demand	Anodyne	CCR5	16	41
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819344247	GF	On-Demand	Anodyne	PREP	84	55
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819344247	GF	On-Demand	Anodyne	TGM2	40	43
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819344247	GF	On-Demand	Anodyne	DPP7	51	38
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819344247	GF	On-Demand	Anodyne	F13A1	39	43
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819344247	GF	On-Demand	Anodyne	SLC12A5	47	41
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819344250	GF	On-Demand	Anodyne	CELA1	20	47
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819344250	GF	On-Demand	Anodyne	GRIN2B	39	49
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819344250	GF	On-Demand	Anodyne	CCR5	16	41
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819344250	GF	On-Demand	Anodyne	PREP	84	55
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819344250	GF	On-Demand	Anodyne	TGM2	40	43
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819344250	GF	On-Demand	Anodyne	DPP7	51	38
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819344250	GF	On-Demand	Anodyne	F13A1	39	43
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)C1	ZINC000819344250	GF	On-Demand	Anodyne	SLC12A5	47	41
O=C(O)C[C@@H]1CCCN(C(=O)[C@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000819344286	FG	On-Demand	Anodyne	PRCP	17	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCC1	ZINC000819344287	FF	On-Demand	Anodyne	CTSD	131	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCC1	ZINC000819344287	FF	On-Demand	Anodyne	PGC	70	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCC1	ZINC000819344287	FF	On-Demand	Anodyne	CMA1	32	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCC1	ZINC000819344287	FF	On-Demand	Anodyne	CTRA_BOVIN	16	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCC1	ZINC000819344287	FF	On-Demand	Anodyne	PAPA1_CARPA	38	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCC1	ZINC000819344287	FF	On-Demand	Anodyne	CCKAR	43	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCC1	ZINC000819344287	FF	On-Demand	Anodyne	CTSK	16	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCC1	ZINC000819344287	FF	On-Demand	Anodyne	CTSL	20	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCC1	ZINC000819344287	FF	On-Demand	Anodyne	CACNA1B	40	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCC1	ZINC000819344287	FF	On-Demand	Anodyne	PGA	45	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCC1	ZINC000819344287	FF	On-Demand	Anodyne	BACE2	57	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCC1	ZINC000819344287	FF	On-Demand	Anodyne	TIMP3	50	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCC1	ZINC000819344287	FF	On-Demand	Anodyne	TACR3	17	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCC1	ZINC000819344287	FF	On-Demand	Anodyne	REN	134	53
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCC1	ZINC000819344287	FF	On-Demand	Anodyne	REN1	29	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCC1	ZINC000819344287	FF	On-Demand	Anodyne	BACE1	90	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCC1	ZINC000819344287	FF	On-Demand	Anodyne	FPR1	56	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCC1	ZINC000819344287	FF	On-Demand	Anodyne	PLM1_PLAFA	35	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNOC1CCC1	ZINC000819344287	FF	On-Demand	Anodyne	PLM2_PLAFA	43	36
O=C(O)C[C@@H]1CCCN(C(=O)[C@H]2C[C@@H]2c2ccc(Br)cc2)C1	ZINC000819344289	FG	On-Demand	Anodyne	PRCP	17	40
CC(C)(C)OC(=O)NCC[C@H](NC[C@H](O)c1ccccc1F)C(F)F	ZINC000819344290	FF	On-Demand	Anodyne	PAPA1_CARPA	27	41
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H]2c2ccc(Br)cc2)C1	ZINC000819344292	FG	On-Demand	Anodyne	PRCP	17	40
CC(C)(C)OC(=O)NCC[C@@H](NC[C@H](O)c1ccccc1F)C(F)F	ZINC000819344293	FF	On-Demand	Anodyne	PAPA1_CARPA	27	41
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccc(Br)cc2)C1	ZINC000819344295	FG	On-Demand	Anodyne	PRCP	17	40
CC(C)(C)OC(=O)NCC[C@H](NC[C@@H](O)c1ccccc1F)C(F)F	ZINC000819344296	FF	On-Demand	Anodyne	PAPA1_CARPA	27	41
CC(C)(C)OC(=O)NCC[C@@H](NC[C@@H](O)c1ccccc1F)C(F)F	ZINC000819344298	FF	On-Demand	Anodyne	PAPA1_CARPA	27	41
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819344300	GI	On-Demand	Anodyne	ADRB1	33	46
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819344300	GI	On-Demand	Anodyne	ADRB3	52	47
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819344300	GI	On-Demand	Anodyne	IGF1R	28	42
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)c1cccc(Cl)c1	ZINC000819344300	GI	On-Demand	Anodyne	CYP3A4	49	42
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)c1cccc(Cl)c1	ZINC000819344304	GI	On-Demand	Anodyne	ADRB1	33	46
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)c1cccc(Cl)c1	ZINC000819344304	GI	On-Demand	Anodyne	ADRB3	52	47
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)c1cccc(Cl)c1	ZINC000819344304	GI	On-Demand	Anodyne	IGF1R	28	42
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)c1cccc(Cl)c1	ZINC000819344304	GI	On-Demand	Anodyne	CYP3A4	49	42
Cc1ncsc1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819344310	DE	On-Demand	Bother	ADRB2	15	41
Cc1ncsc1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819344310	DE	On-Demand	Bother	ADRB1	33	41
Cc1ncsc1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819344310	DE	On-Demand	Bother	ADRB3	64	41
Cc1ncsc1CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819344310	DE	On-Demand	Bother	CACNA1D	57	32
Cc1ncsc1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819344312	DE	On-Demand	Bother	ADRB2	15	41
Cc1ncsc1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819344312	DE	On-Demand	Bother	ADRB1	33	41
Cc1ncsc1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819344312	DE	On-Demand	Bother	ADRB3	64	41
Cc1ncsc1CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819344312	DE	On-Demand	Bother	CACNA1D	57	32
CC(C)(C)OC(=O)NC[C@](C)(O)CNC/C=C/c1ccc(Br)cc1	ZINC000819344339	GG	On-Demand	Anodyne	PAPA1_CARPA	24	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNC/C=C\c1ccc(Br)cc1	ZINC000819344341	GG	On-Demand	Anodyne	PAPA1_CARPA	24	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC/C=C/c1ccc(Br)cc1	ZINC000819344342	GG	On-Demand	Anodyne	PAPA1_CARPA	24	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC/C=C\c1ccc(Br)cc1	ZINC000819344344	GG	On-Demand	Anodyne	PAPA1_CARPA	24	40
CCOC(=O)COCCNC[C@@H](O)c1ccc(Br)cc1	ZINC000819344350	ED	On-Demand	Anodyne	ADRB2	23	43
CCOC(=O)COCCNC[C@H](O)c1ccc(Br)cc1	ZINC000819344351	ED	On-Demand	Anodyne	ADRB2	23	43
O=C(O)C[C@H]1CCCN(C(=O)[C@H]2CCCN2Cc2ccccn2)C1	ZINC000819344356	ED	On-Demand	Anodyne	PREP	60	41
O=C(O)C[C@@H]1CCCN(C(=O)[C@H]2CCCN2Cc2ccccn2)C1	ZINC000819344357	ED	On-Demand	Anodyne	PREP	60	41
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2Cc2ccccn2)C1	ZINC000819344358	ED	On-Demand	Anodyne	PREP	60	41
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN2Cc2ccccn2)C1	ZINC000819344359	ED	On-Demand	Anodyne	PREP	60	41
O=C(O)C[C@H]1CCCN(C(=O)CCc2nc(-c3ccncc3)no2)C1	ZINC000819344362	ED	On-Demand	Anodyne	ETHR	43	38
O=C(O)C[C@@H]1CCCN(C(=O)CCc2nc(-c3ccncc3)no2)C1	ZINC000819344363	ED	On-Demand	Anodyne	ETHR	43	38
O=C(O)C[C@H]1CCCN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819344364	GD	On-Demand	Anodyne	HTR7	15	40
O=C(O)C[C@@H]1CCCN(C(=O)CCCNS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819344365	GD	On-Demand	Anodyne	HTR7	15	40
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CC(c3cccc(F)c3)=NO2)C1	ZINC000819344368	EE	On-Demand	Anodyne	LUCI_PHOPY	24	43
O=C(O)C[C@H]1CCCN(C(=O)[C@H]2CC(c3cccc(F)c3)=NO2)C1	ZINC000819344369	EE	On-Demand	Anodyne	LUCI_PHOPY	24	43
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CC(c3cccc(F)c3)=NO2)C1	ZINC000819344370	EE	On-Demand	Anodyne	LUCI_PHOPY	24	43
O=C(O)C[C@@H]1CCCN(C(=O)[C@H]2CC(c3cccc(F)c3)=NO2)C1	ZINC000819344371	EE	On-Demand	Anodyne	LUCI_PHOPY	24	43
O=C(O)C[C@H]1CCCN(C(=O)CCCc2ccccc2Br)C1	ZINC000819344372	FG	On-Demand	Anodyne	PREP	71	42
O=C(O)C[C@@H]1CCCN(C(=O)CCCc2ccccc2Br)C1	ZINC000819344373	FG	On-Demand	Anodyne	PREP	71	42
O=C(O)C[C@H]1CCCN(C(=O)CCCN2C(=O)c3ccccc3C2=O)C1	ZINC000819344390	FD	On-Demand	Anodyne	SLC6A1	69	34
O=C(O)C[C@H]1CCCN(C(=O)CCCN2C(=O)c3ccccc3C2=O)C1	ZINC000819344390	FD	On-Demand	Anodyne	PREP	57	38
O=C(O)C[C@@H]1CCCN(C(=O)CCCN2C(=O)c3ccccc3C2=O)C1	ZINC000819344391	FD	On-Demand	Anodyne	SLC6A1	69	34
O=C(O)C[C@@H]1CCCN(C(=O)CCCN2C(=O)c3ccccc3C2=O)C1	ZINC000819344391	FD	On-Demand	Anodyne	PREP	57	38
O=C(O)C[C@@H]1CCCN(C(=O)CCc2ccc(-c3ccccc3)[nH]2)C1	ZINC000819344392	EG	On-Demand	Anodyne	PREP	61	37
O=C(O)C[C@H]1CCCN(C(=O)CCc2ccc(-c3ccccc3)[nH]2)C1	ZINC000819344393	EG	On-Demand	Anodyne	PREP	61	37
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819344394	EE	On-Demand	Anodyne	SLC6A1	100	36
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819344395	EE	On-Demand	Anodyne	SLC6A1	100	36
N#Cc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819344398	CD	On-Demand	Mild	ADRB2	31	44
N#Cc1ccc(OC[C@H](O)CNOC2CCC2)cc1	ZINC000819344398	CD	On-Demand	Mild	ADRB1	46	51
N#Cc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819344399	CD	On-Demand	Mild	ADRB2	31	44
N#Cc1ccc(OC[C@@H](O)CNOC2CCC2)cc1	ZINC000819344399	CD	On-Demand	Mild	ADRB1	46	51
N#CC[C@@H]1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819344410	BD	On-Demand	Mild	ADRB3	53	45
N#CC[C@@H]1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819344411	BD	On-Demand	Mild	ADRB3	53	45
CC[C@@H](CNS(C)(=O)=O)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819344435	GC	On-Demand	Anodyne	GPR119	39	45
CC[C@@H](CNS(C)(=O)=O)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819344437	GC	On-Demand	Anodyne	GPR119	39	45
O[C@H](CNOC1CCC1)COc1ccc(F)cc1	ZINC000819344447	CD	On-Demand	Anodyne	ADRB2	42	43
O[C@H](CNOC1CCC1)COc1ccc(F)cc1	ZINC000819344447	CD	On-Demand	Anodyne	ADRB1	57	50
O[C@H](CNOC1CCC1)COc1ccc(F)cc1	ZINC000819344447	CD	On-Demand	Anodyne	ADRB3	33	41
O[C@@H](CNOC1CCC1)COc1ccc(F)cc1	ZINC000819344448	CD	On-Demand	Anodyne	ADRB2	42	43
O[C@@H](CNOC1CCC1)COc1ccc(F)cc1	ZINC000819344448	CD	On-Demand	Anodyne	ADRB1	57	50
O[C@@H](CNOC1CCC1)COc1ccc(F)cc1	ZINC000819344448	CD	On-Demand	Anodyne	ADRB3	33	41
O=C(O)C[C@@H]1CCCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819344449	EE	On-Demand	Anodyne	SLC6A1	100	36
O=C(O)C[C@H]1CCCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000819344450	EE	On-Demand	Anodyne	SLC6A1	100	36
O=C(O)C[C@@H]1CCCN(C(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)C1	ZINC000819344455	GC	On-Demand	Anodyne	PREP	88	46
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)C1	ZINC000819344458	GC	On-Demand	Anodyne	PREP	88	46
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccc(O)nn2)C1	ZINC000819344460	GC	On-Demand	Anodyne	PREP	88	46
O=C(O)C[C@H]1CCCN(C(=O)[C@H]2CCCCN2C(=O)c2ccc(O)nn2)C1	ZINC000819344462	GC	On-Demand	Anodyne	PREP	88	46
O=C(O)C[C@@H]1CCCN(C(=O)CCCCN2CCOCC2)C1	ZINC000819344464	DD	On-Demand	Anodyne	PAOX	18	43
O=C(O)C[C@H]1CCCN(C(=O)CCCCN2CCOCC2)C1	ZINC000819344465	DD	On-Demand	Anodyne	PAOX	18	43
CNC(=O)CC1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819344471	GD	On-Demand	Mild	PAPA1_CARPA	32	42
CNC(=O)CC1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819344473	GD	On-Demand	Mild	PAPA1_CARPA	32	42
O=C(O)C[C@@H]1CCCN(C(=O)CCCCCc2ccc(O)cc2)C1	ZINC000819344492	EG	On-Demand	Anodyne	PREP	56	42
O=C(O)C[C@H]1CCCN(C(=O)CCCCCc2ccc(O)cc2)C1	ZINC000819344493	EG	On-Demand	Anodyne	PREP	56	42
O=C(O)C[C@@H]1CCCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819344499	FD	On-Demand	Anodyne	HTR1A	38	56
O=C(O)C[C@@H]1CCCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819344499	FD	On-Demand	Anodyne	DRD2	26	50
O=C(O)C[C@@H]1CCCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819344499	FD	On-Demand	Anodyne	DRD4	40	49
O=C(O)C[C@@H]1CCCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819344499	FD	On-Demand	Anodyne	DRD3	16	46
O=C(O)C[C@@H]1CCCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819344499	FD	On-Demand	Anodyne	HTR7	24	47
O=C(O)C[C@H]1CCCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819344501	FD	On-Demand	Anodyne	HTR1A	38	56
O=C(O)C[C@H]1CCCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819344501	FD	On-Demand	Anodyne	DRD2	26	50
O=C(O)C[C@H]1CCCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819344501	FD	On-Demand	Anodyne	DRD4	40	49
O=C(O)C[C@H]1CCCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819344501	FD	On-Demand	Anodyne	DRD3	16	46
O=C(O)C[C@H]1CCCN(C(=O)CCN2CCN(c3ccccn3)CC2)C1	ZINC000819344501	FD	On-Demand	Anodyne	HTR7	24	47
CCOC(=O)COCCNC[C@@H](O)c1cccnc1	ZINC000819344507	CC	On-Demand	Anodyne	ADRB2	37	55
CCOC(=O)COCCNC[C@@H](O)c1cccnc1	ZINC000819344507	CC	On-Demand	Anodyne	ADRB1	49	55
CCOC(=O)COCCNC[C@@H](O)c1cccnc1	ZINC000819344507	CC	On-Demand	Anodyne	ADRB3	123	55
CCOC(=O)COCCNC[C@H](O)c1cccnc1	ZINC000819344509	CC	On-Demand	Anodyne	ADRB2	37	55
CCOC(=O)COCCNC[C@H](O)c1cccnc1	ZINC000819344509	CC	On-Demand	Anodyne	ADRB1	49	55
CCOC(=O)COCCNC[C@H](O)c1cccnc1	ZINC000819344509	CC	On-Demand	Anodyne	ADRB3	123	55
CC[C@@](C)(CNC[C@@H](O)c1cccnc1)OC	ZINC000819344512	BD	On-Demand	Anodyne	ADRB2	23	44
CC[C@@](C)(CNC[C@@H](O)c1cccnc1)OC	ZINC000819344512	BD	On-Demand	Anodyne	ADRB1	25	44
CC[C@@](C)(CNC[C@@H](O)c1cccnc1)OC	ZINC000819344512	BD	On-Demand	Anodyne	ADRB3	92	44
O=C(O)C[C@@H]1CCCN(C(=O)CCCc2nnc(-c3ccccc3)o2)C1	ZINC000819344514	FF	On-Demand	Anodyne	PREP	50	38
CC[C@@](C)(CNC[C@H](O)c1cccnc1)OC	ZINC000819344515	BD	On-Demand	Anodyne	ADRB2	23	44
CC[C@@](C)(CNC[C@H](O)c1cccnc1)OC	ZINC000819344515	BD	On-Demand	Anodyne	ADRB1	25	44
CC[C@@](C)(CNC[C@H](O)c1cccnc1)OC	ZINC000819344515	BD	On-Demand	Anodyne	ADRB3	92	44
O=C(O)C[C@H]1CCCN(C(=O)CCCc2nnc(-c3ccccc3)o2)C1	ZINC000819344516	FF	On-Demand	Anodyne	PREP	50	38
Cc1ncsc1CCNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819344524	EG	On-Demand	Anodyne	ADRB3	48	38
Cc1ncsc1CCNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819344526	EG	On-Demand	Anodyne	ADRB3	48	38
Cc1ncsc1CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819344529	ED	On-Demand	Anodyne	ADRB2	28	40
Cc1ncsc1CCNC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819344529	ED	On-Demand	Anodyne	ADRB3	79	38
Cc1ncsc1CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819344531	ED	On-Demand	Anodyne	ADRB2	28	40
Cc1ncsc1CCNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819344531	ED	On-Demand	Anodyne	ADRB3	79	38
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)CCc1ccccc1	ZINC000819344544	GH	On-Demand	Anodyne	PGC	52	34
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)CCc1ccccc1	ZINC000819344544	GH	On-Demand	Anodyne	CTSK	19	48
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)CCc1ccccc1	ZINC000819344544	GH	On-Demand	Anodyne	REN	61	40
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)CCc1ccccc1	ZINC000819344544	GH	On-Demand	Anodyne	FPR1	50	40
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)CCc1ccccc1	ZINC000819344544	GH	On-Demand	Anodyne	NAAA	42	37
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)CCc1ccccc1	ZINC000819344546	GH	On-Demand	Anodyne	PGC	52	34
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)CCc1ccccc1	ZINC000819344546	GH	On-Demand	Anodyne	CTSK	19	48
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)CCc1ccccc1	ZINC000819344546	GH	On-Demand	Anodyne	REN	61	40
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)CCc1ccccc1	ZINC000819344546	GH	On-Demand	Anodyne	FPR1	50	40
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)CCc1ccccc1	ZINC000819344546	GH	On-Demand	Anodyne	NAAA	42	37
Cc1ncsc1CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819344550	EG	On-Demand	Anodyne	ADRB3	29	43
Cc1ncsc1CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819344552	EG	On-Demand	Anodyne	ADRB3	29	43
CN(Cc1nccs1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819344560	FF	On-Demand	Mild	PAPA1_CARPA	45	42
CN(Cc1nccs1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819344561	FF	On-Demand	Mild	PAPA1_CARPA	45	42
O=C(O)C[C@H]1CCCN(C(=O)CCCNC(=O)c2cccnc2)C1	ZINC000819344568	ED	On-Demand	Anodyne	TBXA2R	26	41
O=C(O)C[C@H]1CCCN(C(=O)CCCNC(=O)c2cccnc2)C1	ZINC000819344568	ED	On-Demand	Anodyne	TBXAS1	54	40
O=C(O)C[C@H]1CCCN(C(=O)CCCNC(=O)c2cccnc2)C1	ZINC000819344568	ED	On-Demand	Anodyne	PREP	42	47
O=C(O)C[C@H]1CCCN(C(=O)CCCNC(=O)c2cccnc2)C1	ZINC000819344568	ED	On-Demand	Anodyne	NAMPT	16	41
O=C(O)C[C@@H]1CCCN(C(=O)CCCNC(=O)c2cccnc2)C1	ZINC000819344571	ED	On-Demand	Anodyne	TBXA2R	26	41
O=C(O)C[C@@H]1CCCN(C(=O)CCCNC(=O)c2cccnc2)C1	ZINC000819344571	ED	On-Demand	Anodyne	TBXAS1	54	40
O=C(O)C[C@@H]1CCCN(C(=O)CCCNC(=O)c2cccnc2)C1	ZINC000819344571	ED	On-Demand	Anodyne	PREP	42	47
O=C(O)C[C@@H]1CCCN(C(=O)CCCNC(=O)c2cccnc2)C1	ZINC000819344571	ED	On-Demand	Anodyne	NAMPT	16	41
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(C(=O)c3cccnc3)CC2)C1	ZINC000819344625	FD	On-Demand	Anodyne	SLC18A3	15	45
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(C(=O)c3cccnc3)CC2)C1	ZINC000819344625	FD	On-Demand	Anodyne	L3MBTL3	70	38
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(C(=O)c3cccnc3)CC2)C1	ZINC000819344627	FD	On-Demand	Anodyne	SLC18A3	15	45
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(C(=O)c3cccnc3)CC2)C1	ZINC000819344627	FD	On-Demand	Anodyne	L3MBTL3	70	38
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344633	EF	On-Demand	Anodyne	CHRM2	17	42
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344633	EF	On-Demand	Anodyne	DRD2	23	50
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344633	EF	On-Demand	Anodyne	DRD4	48	47
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344633	EF	On-Demand	Anodyne	ACHE	51	46
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344633	EF	On-Demand	Anodyne	SLC6A1	55	33
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344633	EF	On-Demand	Anodyne	DRD3	15	47
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344633	EF	On-Demand	Anodyne	LTA4H	22	40
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344633	EF	On-Demand	Anodyne	HRH3	24	57
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344633	EF	On-Demand	Anodyne	SIGMAR1	72	56
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344633	EF	On-Demand	Anodyne	SLC18A3	21	40
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344633	EF	On-Demand	Anodyne	PREP	78	40
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344633	EF	On-Demand	Anodyne	FAAH	15	40
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344633	EF	On-Demand	Anodyne	CACNA1G	30	45
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344633	EF	On-Demand	Anodyne	SAP2	24	40
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344635	EF	On-Demand	Anodyne	CHRM2	17	42
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344635	EF	On-Demand	Anodyne	DRD2	23	50
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344635	EF	On-Demand	Anodyne	DRD4	48	47
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344635	EF	On-Demand	Anodyne	ACHE	51	46
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344635	EF	On-Demand	Anodyne	SLC6A1	55	33
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344635	EF	On-Demand	Anodyne	DRD3	15	47
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344635	EF	On-Demand	Anodyne	LTA4H	22	40
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344635	EF	On-Demand	Anodyne	HRH3	24	57
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344635	EF	On-Demand	Anodyne	SIGMAR1	72	56
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344635	EF	On-Demand	Anodyne	SLC18A3	21	40
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344635	EF	On-Demand	Anodyne	PREP	78	40
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344635	EF	On-Demand	Anodyne	FAAH	15	40
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344635	EF	On-Demand	Anodyne	CACNA1G	30	45
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000819344635	EF	On-Demand	Anodyne	SAP2	24	40
O=C(O)C[C@H]1CCCN(C(=O)CCCn2ccnc2)C1	ZINC000819344641	CD	On-Demand	Anodyne	TBXAS1	38	48
O=C(O)C[C@@H]1CCCN(C(=O)CCCn2ccnc2)C1	ZINC000819344642	CD	On-Demand	Anodyne	TBXAS1	38	48
O=C(O)C[C@H]1CCCN(C(=O)[C@H]2Cc3ccccc3C(=O)O2)C1	ZINC000819344655	DD	On-Demand	Anodyne	PREP	54	43
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2Cc3ccccc3C(=O)O2)C1	ZINC000819344656	DD	On-Demand	Anodyne	PREP	54	43
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2Cc3ccccc3C(=O)O2)C1	ZINC000819344657	DD	On-Demand	Anodyne	PREP	54	43
O=C(O)C[C@@H]1CCCN(C(=O)[C@H]2Cc3ccccc3C(=O)O2)C1	ZINC000819344658	DD	On-Demand	Anodyne	PREP	54	43
O=C(O)C[C@H]1CCCN(C(=O)C2CCN(C(=O)c3ccoc3)CC2)C1	ZINC000819344661	ED	On-Demand	Anodyne	L3MBTL3	74	39
O=C(O)C[C@@H]1CCCN(C(=O)C2CCN(C(=O)c3ccoc3)CC2)C1	ZINC000819344662	ED	On-Demand	Anodyne	L3MBTL3	74	39
O=C(O)C[C@@H]1CCCN(C(=O)CCCCN2CCCC2)C1	ZINC000819344663	CD	On-Demand	Anodyne	PREP	24	41
O=C(O)C[C@H]1CCCN(C(=O)CCCCN2CCCC2)C1	ZINC000819344664	CD	On-Demand	Anodyne	PREP	24	41
CC/C=C\CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819344783	CE	On-Demand	Bother	CACNA1D	57	32
CC/C=C/CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819344784	CE	On-Demand	Bother	CACNA1D	57	32
CC/C=C/CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819344785	CE	On-Demand	Bother	CACNA1D	57	32
CC/C=C\CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819344786	CE	On-Demand	Bother	CACNA1D	57	32
CC[C@@](C)(CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819344840	CF	On-Demand	Anodyne	ADRB2	19	44
CC[C@@](C)(CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819344840	CF	On-Demand	Anodyne	ADRB1	39	45
CC[C@@](C)(CNC[C@H](O)c1cccc(Cl)c1)OC	ZINC000819344840	CF	On-Demand	Anodyne	ADRB3	57	45
CC[C@@](C)(CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819344841	CF	On-Demand	Anodyne	ADRB2	19	44
CC[C@@](C)(CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819344841	CF	On-Demand	Anodyne	ADRB1	39	45
CC[C@@](C)(CNC[C@@H](O)c1cccc(Cl)c1)OC	ZINC000819344841	CF	On-Demand	Anodyne	ADRB3	57	45
COC(=O)[C@@]1(F)CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819344845	EC	On-Demand	Anodyne	KCNJ1	44	37
CC/C=C\CNC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819344855	CD	On-Demand	Anodyne	CTSK	15	41
CC/C=C/CNC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819344856	CD	On-Demand	Anodyne	CTSK	15	41
CC/C=C/CNC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819344857	CD	On-Demand	Anodyne	CTSK	15	41
CC/C=C\CNC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819344858	CD	On-Demand	Anodyne	CTSK	15	41
Cc1ncsc1CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819344863	CF	On-Demand	Anodyne	ADRB2	15	41
Cc1ncsc1CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819344863	CF	On-Demand	Anodyne	ADRB1	24	40
Cc1ncsc1CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819344863	CF	On-Demand	Anodyne	ADRB3	32	40
C=C(C)CCNC[C@@H](O)c1cccnc1	ZINC000819344867	BD	On-Demand	Mild	ADRB2	29	47
C=C(C)CCNC[C@@H](O)c1cccnc1	ZINC000819344867	BD	On-Demand	Mild	ADRB1	34	47
C=C(C)CCNC[C@@H](O)c1cccnc1	ZINC000819344867	BD	On-Demand	Mild	ADRB3	110	50
C=C(C)CCNC[C@H](O)c1cccnc1	ZINC000819344868	BD	On-Demand	Mild	ADRB2	29	47
C=C(C)CCNC[C@H](O)c1cccnc1	ZINC000819344868	BD	On-Demand	Mild	ADRB1	34	47
C=C(C)CCNC[C@H](O)c1cccnc1	ZINC000819344868	BD	On-Demand	Mild	ADRB3	110	50
Cc1ncsc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819344869	CF	On-Demand	Anodyne	ADRB2	44	42
Cc1ncsc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819344869	CF	On-Demand	Anodyne	ADRB1	63	51
Cc1ncsc1CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819344869	CF	On-Demand	Anodyne	ADRB3	92	52
Cc1ncsc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819344870	CF	On-Demand	Anodyne	ADRB2	44	42
Cc1ncsc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819344870	CF	On-Demand	Anodyne	ADRB1	63	51
Cc1ncsc1CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819344870	CF	On-Demand	Anodyne	ADRB3	92	52
Cc1ncsc1CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819344873	DG	On-Demand	Anodyne	ADRB1	18	40
Cc1ncsc1CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819344873	DG	On-Demand	Anodyne	ADRB3	23	41
Cc1ncsc1CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819344874	DG	On-Demand	Anodyne	ADRB1	18	40
Cc1ncsc1CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819344874	DG	On-Demand	Anodyne	ADRB3	23	41
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(-c2ccncc2)cc1	ZINC000819344882	DH	On-Demand	Anodyne	KCNQ2	46	33
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(-c2ccncc2)cc1	ZINC000819344883	DH	On-Demand	Anodyne	KCNQ2	46	33
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(-c2ccncc2)cc1	ZINC000819344884	DH	On-Demand	Anodyne	KCNQ2	46	33
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(-c2ccncc2)cc1	ZINC000819344885	DH	On-Demand	Anodyne	KCNQ2	46	33
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)c1ccccc1	ZINC000819344901	FG	On-Demand	Anodyne	FPR1	45	36
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)c1ccccc1	ZINC000819344902	FG	On-Demand	Anodyne	FPR1	45	36
CCOC(=O)COCCNC[C@@H](O)c1cccc(F)c1	ZINC000819344917	CD	On-Demand	Anodyne	ADRB2	34	40
CCOC(=O)COCCNC[C@@H](O)c1cccc(F)c1	ZINC000819344917	CD	On-Demand	Anodyne	ADRB1	45	45
CCOC(=O)COCCNC[C@@H](O)c1cccc(F)c1	ZINC000819344917	CD	On-Demand	Anodyne	ADRB3	54	45
CCOC(=O)COCCNC[C@H](O)c1cccc(F)c1	ZINC000819344918	CD	On-Demand	Anodyne	ADRB2	34	40
CCOC(=O)COCCNC[C@H](O)c1cccc(F)c1	ZINC000819344918	CD	On-Demand	Anodyne	ADRB1	45	45
CCOC(=O)COCCNC[C@H](O)c1cccc(F)c1	ZINC000819344918	CD	On-Demand	Anodyne	ADRB3	54	45
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)c1ccccc1Cl	ZINC000819344939	GI	On-Demand	Anodyne	REN	18	41
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)c1ccccc1Cl	ZINC000819344940	GI	On-Demand	Anodyne	REN	18	41
Cc1ncsc1CCNC[C@@H](O)c1ccc(F)cc1	ZINC000819344941	CE	On-Demand	Anodyne	ADRB2	15	41
Cc1ncsc1CCNC[C@H](O)c1ccc(F)cc1	ZINC000819344942	CE	On-Demand	Anodyne	ADRB2	15	41
CCOC(=O)COCCNC[C@H](O)c1ccc(C)cc1	ZINC000819344944	CD	On-Demand	Anodyne	ADRB2	25	42
CCOC(=O)COCCNC[C@@H](O)c1ccc(C)cc1	ZINC000819344945	CD	On-Demand	Anodyne	ADRB2	25	42
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)Cc1ccc(F)cc1	ZINC000819344993	GG	On-Demand	Anodyne	PAPA1_CARPA	21	44
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)Cc1ccc(F)cc1	ZINC000819344994	GG	On-Demand	Anodyne	PAPA1_CARPA	21	44
COc1ccc(OC)c([C@H](O)CNCCc2scnc2C)c1	ZINC000819344996	DE	On-Demand	Anodyne	ADRB2	23	47
C=C(C)CCNC[C@H](O)CCCCCC	ZINC000819345003	BF	On-Demand	Mild	CQSS	41	33
C=C(C)CCNC[C@@H](O)CCCCCC	ZINC000819345004	BF	On-Demand	Mild	CQSS	41	33
CC(C)(C)OC(=O)NCC[C@H](O)CNC/C=C/c1ccc(Br)cc1	ZINC000819345011	GG	On-Demand	Anodyne	PAPA1_CARPA	24	40
CC(C)(C)OC(=O)NCC[C@H](O)CNC/C=C\c1ccc(Br)cc1	ZINC000819345012	GG	On-Demand	Anodyne	PAPA1_CARPA	24	40
CC(C)(C)OC(=O)NCC[C@@H](O)CNC/C=C/c1ccc(Br)cc1	ZINC000819345013	GG	On-Demand	Anodyne	PAPA1_CARPA	24	40
CC(C)(C)OC(=O)NCC[C@@H](O)CNC/C=C\c1ccc(Br)cc1	ZINC000819345014	GG	On-Demand	Anodyne	PAPA1_CARPA	24	40
COC(=O)[C@@]1(F)CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819345023	FD	On-Demand	Mild	PAPA1_CARPA	32	41
COC(=O)[C@@]1(F)CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819345024	FD	On-Demand	Mild	PAPA1_CARPA	32	41
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCOCC1	ZINC000819345025	FF	On-Demand	Mild	PAPA1_CARPA	37	47
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCOCC1	ZINC000819345026	FF	On-Demand	Mild	PAPA1_CARPA	37	47
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCOCC1	ZINC000819345027	FF	On-Demand	Mild	PAPA1_CARPA	37	47
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCOCC1	ZINC000819345028	FF	On-Demand	Mild	PAPA1_CARPA	37	47
CCOC(=O)COCCNC[C@H](O)c1ccccc1C	ZINC000819345041	CD	On-Demand	Anodyne	ADRB2	24	40
CCOC(=O)COCCNC[C@@H](O)c1ccccc1C	ZINC000819345042	CD	On-Demand	Anodyne	ADRB2	24	40
CCOC(=O)COCCNC[C@H](O)c1ccccc1Cl	ZINC000819345069	DD	On-Demand	Anodyne	ADRB2	15	48
Cc1ncsc1CCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819345103	FF	On-Demand	Anodyne	GPR119	47	40
Cc1ncsc1CCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819345104	FF	On-Demand	Anodyne	GPR119	47	40
C=C(C)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819345105	BF	On-Demand	Mild	ADRB2	50	40
C=C(C)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819345105	BF	On-Demand	Mild	ADRB1	58	51
C=C(C)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819345105	BF	On-Demand	Mild	ADRB3	71	51
C=C(C)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819345106	BF	On-Demand	Mild	ADRB2	50	40
C=C(C)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819345106	BF	On-Demand	Mild	ADRB1	58	51
C=C(C)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819345106	BF	On-Demand	Mild	ADRB3	71	51
CCOC(=O)COCCNC[C@@H](O)c1ccccc1Br	ZINC000819345114	ED	On-Demand	Anodyne	ADRB2	15	40
CCOC(=O)COCCNC[C@H](O)c1ccccc1Br	ZINC000819345115	ED	On-Demand	Anodyne	ADRB2	15	40
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)Cc1ccccc1	ZINC000819345156	FG	On-Demand	Anodyne	PGC	59	35
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)Cc1ccccc1	ZINC000819345156	FG	On-Demand	Anodyne	PAPA1_CARPA	33	43
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)Cc1ccccc1	ZINC000819345156	FG	On-Demand	Anodyne	CCKAR	20	40
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)Cc1ccccc1	ZINC000819345156	FG	On-Demand	Anodyne	REN	72	43
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@@H](O)Cc1ccccc1	ZINC000819345156	FG	On-Demand	Anodyne	FPR1	55	43
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)Cc1ccccc1	ZINC000819345157	FG	On-Demand	Anodyne	PGC	59	35
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)Cc1ccccc1	ZINC000819345157	FG	On-Demand	Anodyne	PAPA1_CARPA	33	43
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)Cc1ccccc1	ZINC000819345157	FG	On-Demand	Anodyne	CCKAR	20	40
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)Cc1ccccc1	ZINC000819345157	FG	On-Demand	Anodyne	REN	72	43
CC(C)(C)OC(=O)NC1C[C@@H]2CC[C@H](C1)C2NC[C@H](O)Cc1ccccc1	ZINC000819345157	FG	On-Demand	Anodyne	FPR1	55	43
CCOC(=O)COCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819345158	DD	On-Demand	Anodyne	ADRB2	53	45
CCOC(=O)COCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819345158	DD	On-Demand	Anodyne	ADRB1	69	52
CCOC(=O)COCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819345158	DD	On-Demand	Anodyne	ADRB3	83	52
CCOC(=O)COCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819345159	DD	On-Demand	Anodyne	ADRB2	53	45
CCOC(=O)COCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819345159	DD	On-Demand	Anodyne	ADRB1	69	52
CCOC(=O)COCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819345159	DD	On-Demand	Anodyne	ADRB3	83	52
Cc1ncsc1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819345241	CE	On-Demand	Anodyne	ADRB1	34	44
Cc1ncsc1CCNC[C@@H](O)c1cccc(F)c1	ZINC000819345241	CE	On-Demand	Anodyne	ADRB3	63	44
Cc1ncsc1CCNC[C@H](O)c1cccc(F)c1	ZINC000819345242	CE	On-Demand	Anodyne	ADRB1	34	44
Cc1ncsc1CCNC[C@H](O)c1cccc(F)c1	ZINC000819345242	CE	On-Demand	Anodyne	ADRB3	63	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3ccccc3)CC[C@H]1C)C2	ZINC000819345243	GF	On-Demand	Anodyne	DRD4	46	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3ccccc3)CC[C@H]1C)C2	ZINC000819345243	GF	On-Demand	Anodyne	ACHE	42	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3ccccc3)CC[C@H]1C)C2	ZINC000819345243	GF	On-Demand	Anodyne	SIGMAR1	50	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3ccccc3)CC[C@H]1C)C2	ZINC000819345243	GF	On-Demand	Anodyne	MCHR1	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3ccccc3)CC[C@H]1C)C2	ZINC000819345244	GF	On-Demand	Anodyne	DRD4	46	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3ccccc3)CC[C@H]1C)C2	ZINC000819345244	GF	On-Demand	Anodyne	ACHE	42	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3ccccc3)CC[C@H]1C)C2	ZINC000819345244	GF	On-Demand	Anodyne	SIGMAR1	50	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3ccccc3)CC[C@H]1C)C2	ZINC000819345244	GF	On-Demand	Anodyne	MCHR1	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3ccccc3)CC[C@@H]1C)C2	ZINC000819345245	GF	On-Demand	Anodyne	DRD4	46	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3ccccc3)CC[C@@H]1C)C2	ZINC000819345245	GF	On-Demand	Anodyne	ACHE	42	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3ccccc3)CC[C@@H]1C)C2	ZINC000819345245	GF	On-Demand	Anodyne	SIGMAR1	50	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3ccccc3)CC[C@@H]1C)C2	ZINC000819345245	GF	On-Demand	Anodyne	MCHR1	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3ccccc3)CC[C@@H]1C)C2	ZINC000819345246	GF	On-Demand	Anodyne	DRD4	46	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3ccccc3)CC[C@@H]1C)C2	ZINC000819345246	GF	On-Demand	Anodyne	ACHE	42	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3ccccc3)CC[C@@H]1C)C2	ZINC000819345246	GF	On-Demand	Anodyne	SIGMAR1	50	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3ccccc3)CC[C@@H]1C)C2	ZINC000819345246	GF	On-Demand	Anodyne	MCHR1	17	40
CO[C@@](C)(CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819345295	CE	On-Demand	Anodyne	ADRB2	22	43
CO[C@@](C)(CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819345295	CE	On-Demand	Anodyne	ADRB1	25	43
CO[C@@](C)(CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819345295	CE	On-Demand	Anodyne	ADRB3	93	44
CO[C@@](C)(CNC[C@H](O)c1cccnc1)c1ccccc1	ZINC000819345295	CE	On-Demand	Anodyne	KCNA5	25	41
CO[C@@](C)(CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819345296	CE	On-Demand	Anodyne	ADRB2	22	43
CO[C@@](C)(CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819345296	CE	On-Demand	Anodyne	ADRB1	25	43
CO[C@@](C)(CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819345296	CE	On-Demand	Anodyne	ADRB3	93	44
CO[C@@](C)(CNC[C@@H](O)c1cccnc1)c1ccccc1	ZINC000819345296	CE	On-Demand	Anodyne	KCNA5	25	41
CO[C@@](C)(CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)c1ccccc1	ZINC000819345311	FH	On-Demand	Anodyne	ADRB3	16	47
CO[C@@](C)(CNC[C@H](O)c1ccc(OC(F)(F)F)cc1)c1ccccc1	ZINC000819345313	FH	On-Demand	Anodyne	ADRB3	16	47
COC(=O)[C@H]1COCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819345318	FC	On-Demand	Mild	PAPA1_CARPA	32	41
COC(=O)[C@@H]1COCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819345319	FC	On-Demand	Mild	PAPA1_CARPA	32	41
COC(=O)[C@H]1COCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819345320	FC	On-Demand	Mild	PAPA1_CARPA	32	41
COC(=O)[C@@H]1COCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819345321	FC	On-Demand	Mild	PAPA1_CARPA	32	41
O[C@@H](CNCCOc1ccc(Cl)c(F)c1)c1ccccc1	ZINC000819345327	DG	On-Demand	Anodyne	ADRB2	29	43
O[C@@H](CNCCOc1ccc(Cl)c(F)c1)c1ccccc1	ZINC000819345327	DG	On-Demand	Anodyne	ADRB1	50	49
O[C@@H](CNCCOc1ccc(Cl)c(F)c1)c1ccccc1	ZINC000819345327	DG	On-Demand	Anodyne	DRD4	19	44
O[C@@H](CNCCOc1ccc(Cl)c(F)c1)c1ccccc1	ZINC000819345327	DG	On-Demand	Anodyne	ADRB3	55	49
O[C@H](CNCCOc1ccc(Cl)c(F)c1)c1ccccc1	ZINC000819345328	DG	On-Demand	Anodyne	ADRB2	29	43
O[C@H](CNCCOc1ccc(Cl)c(F)c1)c1ccccc1	ZINC000819345328	DG	On-Demand	Anodyne	ADRB1	50	49
O[C@H](CNCCOc1ccc(Cl)c(F)c1)c1ccccc1	ZINC000819345328	DG	On-Demand	Anodyne	DRD4	19	44
O[C@H](CNCCOc1ccc(Cl)c(F)c1)c1ccccc1	ZINC000819345328	DG	On-Demand	Anodyne	ADRB3	55	49
CO[C@@](C)(CNC[C@@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819345329	DF	On-Demand	Mild	CTRB_BOVIN	46	33
CO[C@@](C)(CNC[C@H](O)c1ccc(C#N)cc1)c1ccccc1	ZINC000819345330	DF	On-Demand	Mild	CTRB_BOVIN	46	33
CO[C@@](C)(CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819345361	GG	On-Demand	Anodyne	AMY2	45	31
CO[C@@](C)(CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819345361	GG	On-Demand	Anodyne	GPR119	45	48
CO[C@@](C)(CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819345361	GG	On-Demand	Anodyne	SFRP1	25	41
CO[C@@](C)(CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819345363	GG	On-Demand	Anodyne	AMY2	45	31
CO[C@@](C)(CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819345363	GG	On-Demand	Anodyne	GPR119	45	48
CO[C@@](C)(CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1	ZINC000819345363	GG	On-Demand	Anodyne	SFRP1	25	41
Cn1cc(Br)c(CNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819345427	EF	On-Demand	Anodyne	ADRB1	25	40
Cn1cc(Br)c(CNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819345427	EF	On-Demand	Anodyne	ADRB3	39	40
Cn1cc(Br)c(CNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819345428	EF	On-Demand	Anodyne	ADRB1	25	40
Cn1cc(Br)c(CNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819345428	EF	On-Demand	Anodyne	ADRB3	39	40
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)c1	ZINC000819345429	EF	On-Demand	Anodyne	ADRB2	31	44
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)c1	ZINC000819345429	EF	On-Demand	Anodyne	ADRB1	53	40
CC(=O)c1cccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)c1	ZINC000819345429	EF	On-Demand	Anodyne	ABCB1	24	48
CC(=O)c1cccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)c1	ZINC000819345430	EF	On-Demand	Anodyne	ADRB2	31	44
CC(=O)c1cccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)c1	ZINC000819345430	EF	On-Demand	Anodyne	ADRB1	53	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)c1	ZINC000819345430	EF	On-Demand	Anodyne	ABCB1	24	48
CC(=O)c1cccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)c1	ZINC000819345431	EF	On-Demand	Anodyne	ADRB2	31	44
CC(=O)c1cccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)c1	ZINC000819345431	EF	On-Demand	Anodyne	ADRB1	53	40
CC(=O)c1cccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)c1	ZINC000819345431	EF	On-Demand	Anodyne	ABCB1	24	48
CC(=O)c1cccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)c1	ZINC000819345432	EF	On-Demand	Anodyne	ADRB2	31	44
CC(=O)c1cccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)c1	ZINC000819345432	EF	On-Demand	Anodyne	ADRB1	53	40
CC(=O)c1cccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)c1	ZINC000819345432	EF	On-Demand	Anodyne	ABCB1	24	48
CON(C)C(=O)CCNCCOc1ccc(Cl)c(F)c1	ZINC000819345441	DD	On-Demand	Anodyne	DRD4	15	40
CO[C@@](C)(CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000819345469	EF	On-Demand	Bother	CACNA1D	52	36
CO[C@@](C)(CNC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000819345471	EF	On-Demand	Bother	CACNA1D	52	36
CO[C@@](C)(CNC[C@@H](O)c1cccc(Cl)c1)c1ccccc1	ZINC000819345594	DH	On-Demand	Anodyne	ADRB2	23	42
CO[C@@](C)(CNC[C@@H](O)c1cccc(Cl)c1)c1ccccc1	ZINC000819345594	DH	On-Demand	Anodyne	ADRB1	42	46
CO[C@@](C)(CNC[C@@H](O)c1cccc(Cl)c1)c1ccccc1	ZINC000819345594	DH	On-Demand	Anodyne	ADRB3	61	46
CO[C@@](C)(CNC[C@H](O)c1cccc(Cl)c1)c1ccccc1	ZINC000819345596	DH	On-Demand	Anodyne	ADRB2	23	42
CO[C@@](C)(CNC[C@H](O)c1cccc(Cl)c1)c1ccccc1	ZINC000819345596	DH	On-Demand	Anodyne	ADRB1	42	46
CO[C@@](C)(CNC[C@H](O)c1cccc(Cl)c1)c1ccccc1	ZINC000819345596	DH	On-Demand	Anodyne	ADRB3	61	46
C[C@@]1(CNC[C@H](O)COc2ccc(Cl)cc2)CC1(Cl)Cl	ZINC000819345598	EG	On-Demand	Anodyne	ADRB2	39	44
C[C@@]1(CNC[C@H](O)COc2ccc(Cl)cc2)CC1(Cl)Cl	ZINC000819345598	EG	On-Demand	Anodyne	ADRB1	58	42
C[C@@]1(CNC[C@H](O)COc2ccc(Cl)cc2)CC1(Cl)Cl	ZINC000819345598	EG	On-Demand	Anodyne	GRIN1	15	47
C[C@@]1(CNC[C@H](O)COc2ccc(Cl)cc2)CC1(Cl)Cl	ZINC000819345598	EG	On-Demand	Anodyne	ADRB3	33	42
C[C@]1(CNC[C@@H](O)COc2ccc(Cl)cc2)CC1(Cl)Cl	ZINC000819345599	EG	On-Demand	Anodyne	ADRB2	39	44
C[C@]1(CNC[C@@H](O)COc2ccc(Cl)cc2)CC1(Cl)Cl	ZINC000819345599	EG	On-Demand	Anodyne	ADRB1	58	42
C[C@]1(CNC[C@@H](O)COc2ccc(Cl)cc2)CC1(Cl)Cl	ZINC000819345599	EG	On-Demand	Anodyne	GRIN1	15	47
C[C@]1(CNC[C@@H](O)COc2ccc(Cl)cc2)CC1(Cl)Cl	ZINC000819345599	EG	On-Demand	Anodyne	ADRB3	33	42
C[C@]1(CNC[C@H](O)COc2ccc(Cl)cc2)CC1(Cl)Cl	ZINC000819345600	EG	On-Demand	Anodyne	ADRB2	39	44
C[C@]1(CNC[C@H](O)COc2ccc(Cl)cc2)CC1(Cl)Cl	ZINC000819345600	EG	On-Demand	Anodyne	ADRB1	58	42
C[C@]1(CNC[C@H](O)COc2ccc(Cl)cc2)CC1(Cl)Cl	ZINC000819345600	EG	On-Demand	Anodyne	GRIN1	15	47
C[C@]1(CNC[C@H](O)COc2ccc(Cl)cc2)CC1(Cl)Cl	ZINC000819345600	EG	On-Demand	Anodyne	ADRB3	33	42
C[C@@]1(CNC[C@@H](O)COc2ccc(Cl)cc2)CC1(Cl)Cl	ZINC000819345601	EG	On-Demand	Anodyne	ADRB2	39	44
C[C@@]1(CNC[C@@H](O)COc2ccc(Cl)cc2)CC1(Cl)Cl	ZINC000819345601	EG	On-Demand	Anodyne	ADRB1	58	42
C[C@@]1(CNC[C@@H](O)COc2ccc(Cl)cc2)CC1(Cl)Cl	ZINC000819345601	EG	On-Demand	Anodyne	GRIN1	15	47
C[C@@]1(CNC[C@@H](O)COc2ccc(Cl)cc2)CC1(Cl)Cl	ZINC000819345601	EG	On-Demand	Anodyne	ADRB3	33	42
Cc1ccccc1[C@@H](O)CNCCCc1ncccc1C	ZINC000819345603	CF	On-Demand	Anodyne	ADRB1	17	40
Cc1ccccc1[C@@H](O)CNCCCc1ncccc1C	ZINC000819345603	CF	On-Demand	Anodyne	ADRB3	31	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(C)(C)C2CCC2)CC1	ZINC000819345634	FG	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(C)(C)C2CCC2)CC1	ZINC000819345635	FG	On-Demand	Anodyne	GPR119	32	42
O=C(NC[C@H]1CCCCN1C(=O)C(F)=C1CCC1)c1ccccc1	ZINC000819345767	EG	On-Demand	Anodyne	HCRTR1	29	58
O=C(NC[C@H]1CCCCN1C(=O)C(F)=C1CCC1)c1ccccc1	ZINC000819345767	EG	On-Demand	Anodyne	PREP	39	47
Cn1cc(Br)c(CNC[C@@H](O)c2cccnc2)n1	ZINC000819345778	DD	On-Demand	Anodyne	ADRB2	20	40
Cn1cc(Br)c(CNC[C@@H](O)c2cccnc2)n1	ZINC000819345778	DD	On-Demand	Anodyne	ADRB1	21	40
Cn1cc(Br)c(CNC[C@@H](O)c2cccnc2)n1	ZINC000819345778	DD	On-Demand	Anodyne	ADRB3	85	41
Cn1cc(Br)c(CNC[C@H](O)c2cccnc2)n1	ZINC000819345779	DD	On-Demand	Anodyne	ADRB2	20	40
Cn1cc(Br)c(CNC[C@H](O)c2cccnc2)n1	ZINC000819345779	DD	On-Demand	Anodyne	ADRB1	21	40
Cn1cc(Br)c(CNC[C@H](O)c2cccnc2)n1	ZINC000819345779	DD	On-Demand	Anodyne	ADRB3	85	41
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](c2noc(C3CC3)n2)C1	ZINC000819345780	DE	On-Demand	Anodyne	ETHR	49	44
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](c2noc(C3CC3)n2)C1	ZINC000819345781	DE	On-Demand	Anodyne	ETHR	49	44
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](c2noc(C3CC3)n2)C1	ZINC000819345783	DE	On-Demand	Anodyne	ETHR	49	44
COC(=O)c1cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1C	ZINC000819345791	GG	On-Demand	Mild	PAPA1_CARPA	44	45
COC(=O)c1cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1C	ZINC000819345792	GG	On-Demand	Mild	PAPA1_CARPA	44	45
C=CC(C)(C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819345824	CG	On-Demand	Mild	ADRB2	17	43
C=CC(C)(C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819345824	CG	On-Demand	Mild	ADRB1	34	47
C=CC(C)(C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819345824	CG	On-Demand	Mild	ADRB3	51	47
C=CC(C)(C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819345825	CG	On-Demand	Mild	ADRB2	17	43
C=CC(C)(C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819345825	CG	On-Demand	Mild	ADRB1	34	47
C=CC(C)(C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819345825	CG	On-Demand	Mild	ADRB3	51	47
COC[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819345829	CF	On-Demand	Anodyne	MME	78	42
COC[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819345829	CF	On-Demand	Anodyne	PAPA1_CARPA	47	37
COC[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819345829	CF	On-Demand	Anodyne	CAPNS1	48	34
COC[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819345829	CF	On-Demand	Anodyne	CAPN1	48	36
COC[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819345830	CF	On-Demand	Anodyne	MME	78	42
COC[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819345830	CF	On-Demand	Anodyne	PAPA1_CARPA	47	37
COC[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819345830	CF	On-Demand	Anodyne	CAPNS1	48	34
COC[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819345830	CF	On-Demand	Anodyne	CAPN1	48	36
C[C@@]1(CNC[C@H](O)COc2ccc(F)cc2)CC1(Cl)Cl	ZINC000819345836	DF	On-Demand	Anodyne	ADRB2	45	43
C[C@@]1(CNC[C@H](O)COc2ccc(F)cc2)CC1(Cl)Cl	ZINC000819345836	DF	On-Demand	Anodyne	ADRB1	65	41
C[C@@]1(CNC[C@H](O)COc2ccc(F)cc2)CC1(Cl)Cl	ZINC000819345836	DF	On-Demand	Anodyne	ADRB3	36	41
C[C@]1(CNC[C@@H](O)COc2ccc(F)cc2)CC1(Cl)Cl	ZINC000819345837	DF	On-Demand	Anodyne	ADRB2	45	43
C[C@]1(CNC[C@@H](O)COc2ccc(F)cc2)CC1(Cl)Cl	ZINC000819345837	DF	On-Demand	Anodyne	ADRB1	65	41
C[C@]1(CNC[C@@H](O)COc2ccc(F)cc2)CC1(Cl)Cl	ZINC000819345837	DF	On-Demand	Anodyne	ADRB3	36	41
C[C@]1(CNC[C@H](O)COc2ccc(F)cc2)CC1(Cl)Cl	ZINC000819345838	DF	On-Demand	Anodyne	ADRB2	45	43
C[C@]1(CNC[C@H](O)COc2ccc(F)cc2)CC1(Cl)Cl	ZINC000819345838	DF	On-Demand	Anodyne	ADRB1	65	41
C[C@]1(CNC[C@H](O)COc2ccc(F)cc2)CC1(Cl)Cl	ZINC000819345838	DF	On-Demand	Anodyne	ADRB3	36	41
C[C@@]1(CNC[C@@H](O)COc2ccc(F)cc2)CC1(Cl)Cl	ZINC000819345839	DF	On-Demand	Anodyne	ADRB2	45	43
C[C@@]1(CNC[C@@H](O)COc2ccc(F)cc2)CC1(Cl)Cl	ZINC000819345839	DF	On-Demand	Anodyne	ADRB1	65	41
C[C@@]1(CNC[C@@H](O)COc2ccc(F)cc2)CC1(Cl)Cl	ZINC000819345839	DF	On-Demand	Anodyne	ADRB3	36	41
CC(=O)Nc1cccc(CC(=O)NC[C@@H](C)c2nc3ccccc3o2)c1	ZINC000819345860	FG	On-Demand	Anodyne	PTGIR	15	40
CC(=O)Nc1cccc(CC(=O)NC[C@H](C)c2nc3ccccc3o2)c1	ZINC000819345862	FG	On-Demand	Anodyne	PTGIR	15	40
C[C@]1(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)CC1(Cl)Cl	ZINC000819345878	FH	On-Demand	Anodyne	ADRB1	45	38
C[C@]1(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)CC1(Cl)Cl	ZINC000819345878	FH	On-Demand	Anodyne	GRIN1	29	45
C[C@]1(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)CC1(Cl)Cl	ZINC000819345878	FH	On-Demand	Anodyne	ADRB3	25	40
COC[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1	ZINC000819345885	FG	On-Demand	Bother	CACNA1C	45	40
COC[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1	ZINC000819345885	FG	On-Demand	Bother	CACNA1D	74	40
C[C@@]1(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)CC1(Cl)Cl	ZINC000819345886	FH	On-Demand	Anodyne	ADRB1	45	38
C[C@@]1(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)CC1(Cl)Cl	ZINC000819345886	FH	On-Demand	Anodyne	GRIN1	29	45
C[C@@]1(CNC[C@@H](O)COc2ccc(Cl)c(Cl)c2)CC1(Cl)Cl	ZINC000819345886	FH	On-Demand	Anodyne	ADRB3	25	40
C[C@]1(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)CC1(Cl)Cl	ZINC000819345888	FH	On-Demand	Anodyne	ADRB1	45	38
C[C@]1(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)CC1(Cl)Cl	ZINC000819345888	FH	On-Demand	Anodyne	GRIN1	29	45
C[C@]1(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)CC1(Cl)Cl	ZINC000819345888	FH	On-Demand	Anodyne	ADRB3	25	40
COC[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1	ZINC000819345889	FG	On-Demand	Bother	CACNA1C	45	40
COC[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1	ZINC000819345889	FG	On-Demand	Bother	CACNA1D	74	40
C[C@@]1(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)CC1(Cl)Cl	ZINC000819345890	FH	On-Demand	Anodyne	ADRB1	45	38
C[C@@]1(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)CC1(Cl)Cl	ZINC000819345890	FH	On-Demand	Anodyne	GRIN1	29	45
C[C@@]1(CNC[C@H](O)COc2ccc(Cl)c(Cl)c2)CC1(Cl)Cl	ZINC000819345890	FH	On-Demand	Anodyne	ADRB3	25	40
C=CC(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000819345952	BD	On-Demand	Mild	ADRB2	22	41
C=CC(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000819345952	BD	On-Demand	Mild	ADRB1	24	43
C=CC(C)(C)CNC[C@@H](O)c1cccnc1	ZINC000819345952	BD	On-Demand	Mild	ADRB3	91	43
C=CC(C)(C)CNC[C@H](O)c1cccnc1	ZINC000819345954	BD	On-Demand	Mild	ADRB2	22	41
C=CC(C)(C)CNC[C@H](O)c1cccnc1	ZINC000819345954	BD	On-Demand	Mild	ADRB1	24	43
C=CC(C)(C)CNC[C@H](O)c1cccnc1	ZINC000819345954	BD	On-Demand	Mild	ADRB3	91	43
C[C@@]1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819345961	DF	On-Demand	Bother	CACNA1C	53	35
C[C@@]1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819345961	DF	On-Demand	Bother	CACNA1D	85	35
COC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819345962	EE	On-Demand	Anodyne	PGC	54	35
COC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819345962	EE	On-Demand	Anodyne	PAPA1_CARPA	51	47
COC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819345962	EE	On-Demand	Anodyne	CCKAR	53	40
COC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819345962	EE	On-Demand	Anodyne	CTSK	18	49
COC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819345962	EE	On-Demand	Anodyne	CTSL	26	47
COC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819345962	EE	On-Demand	Anodyne	TACR3	16	43
COC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819345962	EE	On-Demand	Anodyne	REN	68	41
COC[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819345962	EE	On-Demand	Anodyne	FPR1	55	42
C[C@]1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819345963	DF	On-Demand	Bother	CACNA1C	53	35
C[C@]1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819345963	DF	On-Demand	Bother	CACNA1D	85	35
COC[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819345964	EE	On-Demand	Anodyne	PGC	54	35
COC[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819345964	EE	On-Demand	Anodyne	PAPA1_CARPA	51	47
COC[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819345964	EE	On-Demand	Anodyne	CCKAR	53	40
COC[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819345964	EE	On-Demand	Anodyne	CTSK	18	49
COC[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819345964	EE	On-Demand	Anodyne	CTSL	26	47
COC[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819345964	EE	On-Demand	Anodyne	TACR3	16	43
COC[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819345964	EE	On-Demand	Anodyne	REN	68	41
COC[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819345964	EE	On-Demand	Anodyne	FPR1	55	42
C[C@@]1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819345965	DF	On-Demand	Bother	CACNA1C	53	35
C[C@@]1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819345965	DF	On-Demand	Bother	CACNA1D	85	35
O=C(/C=C/[C@H]1CCCO1)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819345966	FE	On-Demand	Anodyne	GRIN2B	57	48
O=C(/C=C/[C@H]1CCCO1)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819345966	FE	On-Demand	Anodyne	CCR3	37	41
C[C@]1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819345967	DF	On-Demand	Bother	CACNA1C	53	35
C[C@]1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819345967	DF	On-Demand	Bother	CACNA1D	85	35
O=C(/C=C\[C@H]1CCCO1)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819345968	FE	On-Demand	Anodyne	GRIN2B	57	48
O=C(/C=C\[C@H]1CCCO1)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819345968	FE	On-Demand	Anodyne	CCR3	37	41
O=C(/C=C\[C@@H]1CCCO1)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819345970	FE	On-Demand	Anodyne	GRIN2B	57	48
O=C(/C=C\[C@@H]1CCCO1)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819345970	FE	On-Demand	Anodyne	CCR3	37	41
O=C(/C=C/[C@@H]1CCCO1)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819345972	FE	On-Demand	Anodyne	GRIN2B	57	48
O=C(/C=C/[C@@H]1CCCO1)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000819345972	FE	On-Demand	Anodyne	CCR3	37	41
C[C@@]1(CNC[C@H](O)COc2ccc(Br)cc2)CC1(Cl)Cl	ZINC000819345998	GG	On-Demand	Anodyne	ADRB2	36	43
C[C@@]1(CNC[C@H](O)COc2ccc(Br)cc2)CC1(Cl)Cl	ZINC000819345998	GG	On-Demand	Anodyne	ADRB1	52	41
C[C@@]1(CNC[C@H](O)COc2ccc(Br)cc2)CC1(Cl)Cl	ZINC000819345998	GG	On-Demand	Anodyne	ADRB3	28	41
C[C@]1(CNC[C@@H](O)COc2ccc(Br)cc2)CC1(Cl)Cl	ZINC000819346003	GG	On-Demand	Anodyne	ADRB2	36	43
C[C@]1(CNC[C@@H](O)COc2ccc(Br)cc2)CC1(Cl)Cl	ZINC000819346003	GG	On-Demand	Anodyne	ADRB1	52	41
C[C@]1(CNC[C@@H](O)COc2ccc(Br)cc2)CC1(Cl)Cl	ZINC000819346003	GG	On-Demand	Anodyne	ADRB3	28	41
C[C@]1(CNC[C@H](O)COc2ccc(Br)cc2)CC1(Cl)Cl	ZINC000819346004	GG	On-Demand	Anodyne	ADRB2	36	43
C[C@]1(CNC[C@H](O)COc2ccc(Br)cc2)CC1(Cl)Cl	ZINC000819346004	GG	On-Demand	Anodyne	ADRB1	52	41
C[C@]1(CNC[C@H](O)COc2ccc(Br)cc2)CC1(Cl)Cl	ZINC000819346004	GG	On-Demand	Anodyne	ADRB3	28	41
C[C@@]1(CNC[C@@H](O)COc2ccc(Br)cc2)CC1(Cl)Cl	ZINC000819346005	GG	On-Demand	Anodyne	ADRB2	36	43
C[C@@]1(CNC[C@@H](O)COc2ccc(Br)cc2)CC1(Cl)Cl	ZINC000819346005	GG	On-Demand	Anodyne	ADRB1	52	41
C[C@@]1(CNC[C@@H](O)COc2ccc(Br)cc2)CC1(Cl)Cl	ZINC000819346005	GG	On-Demand	Anodyne	ADRB3	28	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)CC1	ZINC000819346008	GG	On-Demand	Anodyne	GPR119	27	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@]2(C)CC2(Cl)Cl)CC1	ZINC000819346009	GG	On-Demand	Anodyne	GPR119	27	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)CC1	ZINC000819346010	GG	On-Demand	Anodyne	GPR119	27	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)CC1	ZINC000819346011	GG	On-Demand	Anodyne	GPR119	27	40
C[C@@]1(CNC[C@@H](O)COc2cccc3ccccc23)CC1(Cl)Cl	ZINC000819346037	FH	On-Demand	Anodyne	ADRB2	34	63
C[C@@]1(CNC[C@@H](O)COc2cccc3ccccc23)CC1(Cl)Cl	ZINC000819346037	FH	On-Demand	Anodyne	ADRB1	53	39
C[C@@]1(CNC[C@@H](O)COc2cccc3ccccc23)CC1(Cl)Cl	ZINC000819346037	FH	On-Demand	Anodyne	ADRB3	18	57
C[C@@]1(CNC[C@@H](O)COc2cccc3ccccc23)CC1(Cl)Cl	ZINC000819346037	FH	On-Demand	Anodyne	ABCB1	22	41
C[C@]1(CNC[C@@H](O)COc2cccc3ccccc23)CC1(Cl)Cl	ZINC000819346038	FH	On-Demand	Anodyne	ADRB2	34	63
C[C@]1(CNC[C@@H](O)COc2cccc3ccccc23)CC1(Cl)Cl	ZINC000819346038	FH	On-Demand	Anodyne	ADRB1	53	39
C[C@]1(CNC[C@@H](O)COc2cccc3ccccc23)CC1(Cl)Cl	ZINC000819346038	FH	On-Demand	Anodyne	ADRB3	18	57
C[C@]1(CNC[C@@H](O)COc2cccc3ccccc23)CC1(Cl)Cl	ZINC000819346038	FH	On-Demand	Anodyne	ABCB1	22	41
C[C@]1(CNC[C@H](O)COc2cccc3ccccc23)CC1(Cl)Cl	ZINC000819346039	FH	On-Demand	Anodyne	ADRB2	34	63
C[C@]1(CNC[C@H](O)COc2cccc3ccccc23)CC1(Cl)Cl	ZINC000819346039	FH	On-Demand	Anodyne	ADRB1	53	39
C[C@]1(CNC[C@H](O)COc2cccc3ccccc23)CC1(Cl)Cl	ZINC000819346039	FH	On-Demand	Anodyne	ADRB3	18	57
C[C@]1(CNC[C@H](O)COc2cccc3ccccc23)CC1(Cl)Cl	ZINC000819346039	FH	On-Demand	Anodyne	ABCB1	22	41
C[C@@]1(CNC[C@H](O)COc2cccc3ccccc23)CC1(Cl)Cl	ZINC000819346040	FH	On-Demand	Anodyne	ADRB2	34	63
C[C@@]1(CNC[C@H](O)COc2cccc3ccccc23)CC1(Cl)Cl	ZINC000819346040	FH	On-Demand	Anodyne	ADRB1	53	39
C[C@@]1(CNC[C@H](O)COc2cccc3ccccc23)CC1(Cl)Cl	ZINC000819346040	FH	On-Demand	Anodyne	ADRB3	18	57
C[C@@]1(CNC[C@H](O)COc2cccc3ccccc23)CC1(Cl)Cl	ZINC000819346040	FH	On-Demand	Anodyne	ABCB1	22	41
C[C@]1(CNC[C@H](O)COc2ccc(C#N)cc2)CC1(Cl)Cl	ZINC000819346043	EE	On-Demand	Mild	ADRB2	32	41
C[C@]1(CNC[C@H](O)COc2ccc(C#N)cc2)CC1(Cl)Cl	ZINC000819346043	EE	On-Demand	Mild	ADRB1	52	39
C[C@@]1(CNC[C@H](O)COc2ccc(C#N)cc2)CC1(Cl)Cl	ZINC000819346044	EE	On-Demand	Mild	ADRB2	32	41
C[C@@]1(CNC[C@H](O)COc2ccc(C#N)cc2)CC1(Cl)Cl	ZINC000819346044	EE	On-Demand	Mild	ADRB1	52	39
C[C@@]1(CNC[C@@H](O)COc2ccc(C#N)cc2)CC1(Cl)Cl	ZINC000819346045	EE	On-Demand	Mild	ADRB2	32	41
C[C@@]1(CNC[C@@H](O)COc2ccc(C#N)cc2)CC1(Cl)Cl	ZINC000819346045	EE	On-Demand	Mild	ADRB1	52	39
C[C@]1(CNC[C@@H](O)COc2ccc(C#N)cc2)CC1(Cl)Cl	ZINC000819346046	EE	On-Demand	Mild	ADRB2	32	41
C[C@]1(CNC[C@@H](O)COc2ccc(C#N)cc2)CC1(Cl)Cl	ZINC000819346046	EE	On-Demand	Mild	ADRB1	52	39
C[C@@]1(CNC[C@H](O)COc2cccc(Br)c2)CC1(Cl)Cl	ZINC000819346051	GG	On-Demand	Anodyne	ADRB2	29	42
C[C@@]1(CNC[C@H](O)COc2cccc(Br)c2)CC1(Cl)Cl	ZINC000819346051	GG	On-Demand	Anodyne	ADRB1	35	42
C[C@]1(CNC[C@@H](O)COc2cccc(Br)c2)CC1(Cl)Cl	ZINC000819346052	GG	On-Demand	Anodyne	ADRB2	29	42
C[C@]1(CNC[C@@H](O)COc2cccc(Br)c2)CC1(Cl)Cl	ZINC000819346052	GG	On-Demand	Anodyne	ADRB1	35	42
C[C@]1(CNC[C@H](O)COc2cccc(Br)c2)CC1(Cl)Cl	ZINC000819346053	GG	On-Demand	Anodyne	ADRB2	29	42
C[C@]1(CNC[C@H](O)COc2cccc(Br)c2)CC1(Cl)Cl	ZINC000819346053	GG	On-Demand	Anodyne	ADRB1	35	42
C[C@@]1(CNC[C@@H](O)COc2cccc(Br)c2)CC1(Cl)Cl	ZINC000819346054	GG	On-Demand	Anodyne	ADRB2	29	42
C[C@@]1(CNC[C@@H](O)COc2cccc(Br)c2)CC1(Cl)Cl	ZINC000819346054	GG	On-Demand	Anodyne	ADRB1	35	42
C[C@@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346085	EF	On-Demand	Bother	ADRB2	25	49
C[C@@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346085	EF	On-Demand	Bother	ADRB1	32	49
C[C@@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346085	EF	On-Demand	Bother	CACNA1C	52	35
C[C@@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346085	EF	On-Demand	Bother	ADRB3	18	49
C[C@@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346085	EF	On-Demand	Bother	CACNA1D	84	35
C[C@@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346085	EF	On-Demand	Bother	ACR	15	43
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819346086	EF	On-Demand	Anodyne	ACE	44	36
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819346086	EF	On-Demand	Anodyne	GRIN2B	76	44
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819346086	EF	On-Demand	Anodyne	SIGMAR1	16	42
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819346086	EF	On-Demand	Anodyne	CCR3	45	42
C[C@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346087	EF	On-Demand	Bother	ADRB2	25	49
C[C@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346087	EF	On-Demand	Bother	ADRB1	32	49
C[C@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346087	EF	On-Demand	Bother	CACNA1C	52	35
C[C@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346087	EF	On-Demand	Bother	ADRB3	18	49
C[C@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346087	EF	On-Demand	Bother	CACNA1D	84	35
C[C@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346087	EF	On-Demand	Bother	ACR	15	43
C[C@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346089	EF	On-Demand	Bother	ADRB2	25	49
C[C@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346089	EF	On-Demand	Bother	ADRB1	32	49
C[C@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346089	EF	On-Demand	Bother	CACNA1C	52	35
C[C@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346089	EF	On-Demand	Bother	ADRB3	18	49
C[C@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346089	EF	On-Demand	Bother	CACNA1D	84	35
C[C@]1(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346089	EF	On-Demand	Bother	ACR	15	43
C[C@@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346091	EF	On-Demand	Bother	ADRB2	25	49
C[C@@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346091	EF	On-Demand	Bother	ADRB1	32	49
C[C@@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346091	EF	On-Demand	Bother	CACNA1C	52	35
C[C@@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346091	EF	On-Demand	Bother	ADRB3	18	49
C[C@@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346091	EF	On-Demand	Bother	CACNA1D	84	35
C[C@@]1(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1(Cl)Cl	ZINC000819346091	EF	On-Demand	Bother	ACR	15	43
C[C@@]1(CNC[C@H](O)COc2ccccc2)CC1(Cl)Cl	ZINC000819346112	DF	On-Demand	Anodyne	ADRB2	59	58
C[C@@]1(CNC[C@H](O)COc2ccccc2)CC1(Cl)Cl	ZINC000819346112	DF	On-Demand	Anodyne	ADRB1	77	49
C[C@@]1(CNC[C@H](O)COc2ccccc2)CC1(Cl)Cl	ZINC000819346112	DF	On-Demand	Anodyne	ADRB3	47	49
C[C@@]1(CNC[C@H](O)COc2ccccc2)CC1(Cl)Cl	ZINC000819346112	DF	On-Demand	Anodyne	ABCB1	19	45
C[C@]1(CNC[C@@H](O)COc2ccccc2)CC1(Cl)Cl	ZINC000819346113	DF	On-Demand	Anodyne	ADRB2	59	58
C[C@]1(CNC[C@@H](O)COc2ccccc2)CC1(Cl)Cl	ZINC000819346113	DF	On-Demand	Anodyne	ADRB1	77	49
C[C@]1(CNC[C@@H](O)COc2ccccc2)CC1(Cl)Cl	ZINC000819346113	DF	On-Demand	Anodyne	ADRB3	47	49
C[C@]1(CNC[C@@H](O)COc2ccccc2)CC1(Cl)Cl	ZINC000819346113	DF	On-Demand	Anodyne	ABCB1	19	45
C[C@]1(CNC[C@H](O)COc2ccccc2)CC1(Cl)Cl	ZINC000819346114	DF	On-Demand	Anodyne	ADRB2	59	58
C[C@]1(CNC[C@H](O)COc2ccccc2)CC1(Cl)Cl	ZINC000819346114	DF	On-Demand	Anodyne	ADRB1	77	49
C[C@]1(CNC[C@H](O)COc2ccccc2)CC1(Cl)Cl	ZINC000819346114	DF	On-Demand	Anodyne	ADRB3	47	49
C[C@]1(CNC[C@H](O)COc2ccccc2)CC1(Cl)Cl	ZINC000819346114	DF	On-Demand	Anodyne	ABCB1	19	45
C[C@@]1(CNC[C@@H](O)COc2ccccc2)CC1(Cl)Cl	ZINC000819346115	DF	On-Demand	Anodyne	ADRB2	59	58
C[C@@]1(CNC[C@@H](O)COc2ccccc2)CC1(Cl)Cl	ZINC000819346115	DF	On-Demand	Anodyne	ADRB1	77	49
C[C@@]1(CNC[C@@H](O)COc2ccccc2)CC1(Cl)Cl	ZINC000819346115	DF	On-Demand	Anodyne	ADRB3	47	49
C[C@@]1(CNC[C@@H](O)COc2ccccc2)CC1(Cl)Cl	ZINC000819346115	DF	On-Demand	Anodyne	ABCB1	19	45
O=C(/C=C/[C@@H]1CCCO1)Nc1ncccc1OCc1cccc(Cl)c1	ZINC000819346132	FH	On-Demand	Anodyne	PPIA	44	51
O=C(/C=C/[C@@H]1CCCO1)Nc1ncccc1OCc1cccc(Cl)c1	ZINC000819346132	FH	On-Demand	Anodyne	PTGER1	41	35
O=C(/C=C\[C@H]1CCCO1)Nc1ncccc1OCc1cccc(Cl)c1	ZINC000819346133	FH	On-Demand	Anodyne	PPIA	44	51
O=C(/C=C\[C@H]1CCCO1)Nc1ncccc1OCc1cccc(Cl)c1	ZINC000819346133	FH	On-Demand	Anodyne	PTGER1	41	35
O=C(/C=C\[C@@H]1CCCO1)Nc1ncccc1OCc1cccc(Cl)c1	ZINC000819346135	FH	On-Demand	Anodyne	PPIA	44	51
O=C(/C=C\[C@@H]1CCCO1)Nc1ncccc1OCc1cccc(Cl)c1	ZINC000819346135	FH	On-Demand	Anodyne	PTGER1	41	35
O=C(/C=C/[C@H]1CCCO1)Nc1ncccc1OCc1cccc(Cl)c1	ZINC000819346137	FH	On-Demand	Anodyne	PPIA	44	51
O=C(/C=C/[C@H]1CCCO1)Nc1ncccc1OCc1cccc(Cl)c1	ZINC000819346137	FH	On-Demand	Anodyne	PTGER1	41	35
C[C@@]1(CNC[C@H](O)COc2ccccc2Cl)CC1(Cl)Cl	ZINC000819346160	EG	On-Demand	Anodyne	ADRB2	30	53
C[C@@]1(CNC[C@H](O)COc2ccccc2Cl)CC1(Cl)Cl	ZINC000819346160	EG	On-Demand	Anodyne	ADRB1	58	35
C[C@]1(CNC[C@H](O)COc2ccccc2Cl)CC1(Cl)Cl	ZINC000819346162	EG	On-Demand	Anodyne	ADRB2	30	53
C[C@]1(CNC[C@H](O)COc2ccccc2Cl)CC1(Cl)Cl	ZINC000819346162	EG	On-Demand	Anodyne	ADRB1	58	35
C[C@@]1(CNC[C@@H](O)COc2ccccc2Cl)CC1(Cl)Cl	ZINC000819346163	EG	On-Demand	Anodyne	ADRB2	30	53
C[C@@]1(CNC[C@@H](O)COc2ccccc2Cl)CC1(Cl)Cl	ZINC000819346163	EG	On-Demand	Anodyne	ADRB1	58	35
C[C@]1(CNC[C@@H](O)COc2ccccc2Cl)CC1(Cl)Cl	ZINC000819346165	EG	On-Demand	Anodyne	ADRB2	30	53
C[C@]1(CNC[C@@H](O)COc2ccccc2Cl)CC1(Cl)Cl	ZINC000819346165	EG	On-Demand	Anodyne	ADRB1	58	35
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819346205	EF	On-Demand	Anodyne	DRD2	20	41
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819346205	EF	On-Demand	Anodyne	DRD4	56	41
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819346205	EF	On-Demand	Anodyne	ACHE	41	44
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819346205	EF	On-Demand	Anodyne	SIGMAR1	61	43
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819346205	EF	On-Demand	Anodyne	CYP2J2	44	31
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819346206	EF	On-Demand	Anodyne	DRD2	20	41
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819346206	EF	On-Demand	Anodyne	DRD4	56	41
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819346206	EF	On-Demand	Anodyne	ACHE	41	44
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819346206	EF	On-Demand	Anodyne	SIGMAR1	61	43
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819346206	EF	On-Demand	Anodyne	CYP2J2	44	31
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819346207	EF	On-Demand	Anodyne	DRD2	20	41
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819346207	EF	On-Demand	Anodyne	DRD4	56	41
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819346207	EF	On-Demand	Anodyne	ACHE	41	44
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819346207	EF	On-Demand	Anodyne	SIGMAR1	61	43
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819346207	EF	On-Demand	Anodyne	CYP2J2	44	31
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819346208	EF	On-Demand	Anodyne	DRD2	20	41
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819346208	EF	On-Demand	Anodyne	DRD4	56	41
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819346208	EF	On-Demand	Anodyne	ACHE	41	44
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819346208	EF	On-Demand	Anodyne	SIGMAR1	61	43
C[C@@H]1CCN(Cc2ccccc2)CCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819346208	EF	On-Demand	Anodyne	CYP2J2	44	31
O[C@@H](CNCCOc1ccc(Cl)c(F)c1)c1cccnc1	ZINC000819346211	DF	On-Demand	Anodyne	ADRB2	36	58
O[C@@H](CNCCOc1ccc(Cl)c(F)c1)c1cccnc1	ZINC000819346211	DF	On-Demand	Anodyne	ADRB1	50	58
O[C@@H](CNCCOc1ccc(Cl)c(F)c1)c1cccnc1	ZINC000819346211	DF	On-Demand	Anodyne	ADRB3	118	60
O[C@H](CNCCOc1ccc(Cl)c(F)c1)c1cccnc1	ZINC000819346212	DF	On-Demand	Anodyne	ADRB2	36	58
O[C@H](CNCCOc1ccc(Cl)c(F)c1)c1cccnc1	ZINC000819346212	DF	On-Demand	Anodyne	ADRB1	50	58
O[C@H](CNCCOc1ccc(Cl)c(F)c1)c1cccnc1	ZINC000819346212	DF	On-Demand	Anodyne	ADRB3	118	60
CO[C@@](C)(CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccccc1	ZINC000819346242	FE	On-Demand	Anodyne	ADRB3	41	39
CO[C@@](C)(CNC[C@@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccccc1	ZINC000819346242	FE	On-Demand	Anodyne	CTSF	40	36
CO[C@@](C)(CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccccc1	ZINC000819346247	FE	On-Demand	Anodyne	ADRB3	41	39
CO[C@@](C)(CNC[C@H](O)c1ccc(S(C)(=O)=O)cc1)c1ccccc1	ZINC000819346247	FE	On-Demand	Anodyne	CTSF	40	36
COc1ccc(OC)c([C@H](O)CNCCCc2ncccc2C)c1	ZINC000819346262	EF	On-Demand	Anodyne	ADRB2	24	43
CO[C@@](C)(CNC[C@@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819346287	DG	On-Demand	Anodyne	ADRB1	22	41
CO[C@@](C)(CNC[C@@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819346287	DG	On-Demand	Anodyne	ADRB3	29	41
CO[C@@](C)(CNC[C@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819346290	DG	On-Demand	Anodyne	ADRB1	22	41
CO[C@@](C)(CNC[C@H](O)c1cccc(F)c1)c1ccccc1	ZINC000819346290	DG	On-Demand	Anodyne	ADRB3	29	41
Cc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)c(C)c1	ZINC000819346291	EG	On-Demand	Anodyne	ADRB2	18	46
Cc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)c(C)c1	ZINC000819346293	EG	On-Demand	Anodyne	ADRB2	18	46
Cc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)c(C)c1	ZINC000819346295	EG	On-Demand	Anodyne	ADRB2	18	46
Cc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)c(C)c1	ZINC000819346296	EG	On-Demand	Anodyne	ADRB2	18	46
C[C@]1(CNCCC(=O)Nc2cccc(Br)c2)CC1(Cl)Cl	ZINC000819346313	GH	On-Demand	Anodyne	EGFR	27	41
C[C@]1(CNCCC(=O)Nc2cccc(Br)c2)CC1(Cl)Cl	ZINC000819346313	GH	On-Demand	Anodyne	HDAC10	26	42
C[C@@]1(CNCCC(=O)Nc2cccc(Br)c2)CC1(Cl)Cl	ZINC000819346315	GH	On-Demand	Anodyne	EGFR	27	41
C[C@@]1(CNCCC(=O)Nc2cccc(Br)c2)CC1(Cl)Cl	ZINC000819346315	GH	On-Demand	Anodyne	HDAC10	26	42
O=[N+]([O-])c1cccc([C@@H](O)CNCC2CCCCCC2)c1	ZINC000819346316	CG	On-Demand	Bother	CACNA1C	56	38
O=[N+]([O-])c1cccc([C@@H](O)CNCC2CCCCCC2)c1	ZINC000819346316	CG	On-Demand	Bother	ADRB3	40	39
O=[N+]([O-])c1cccc([C@@H](O)CNCC2CCCCCC2)c1	ZINC000819346316	CG	On-Demand	Bother	CACNA1D	86	38
O=[N+]([O-])c1cccc([C@H](O)CNCC2CCCCCC2)c1	ZINC000819346318	CG	On-Demand	Bother	CACNA1C	56	38
O=[N+]([O-])c1cccc([C@H](O)CNCC2CCCCCC2)c1	ZINC000819346318	CG	On-Demand	Bother	ADRB3	40	39
O=[N+]([O-])c1cccc([C@H](O)CNCC2CCCCCC2)c1	ZINC000819346318	CG	On-Demand	Bother	CACNA1D	86	38
C[C@@]1(CNC[C@H](O)COc2ccccc2F)CC1(Cl)Cl	ZINC000819346327	DF	On-Demand	Anodyne	ADRB2	28	44
C[C@@]1(CNC[C@H](O)COc2ccccc2F)CC1(Cl)Cl	ZINC000819346327	DF	On-Demand	Anodyne	ADRB1	58	39
C[C@]1(CNC[C@H](O)COc2ccccc2F)CC1(Cl)Cl	ZINC000819346329	DF	On-Demand	Anodyne	ADRB2	28	44
C[C@]1(CNC[C@H](O)COc2ccccc2F)CC1(Cl)Cl	ZINC000819346329	DF	On-Demand	Anodyne	ADRB1	58	39
C[C@@]1(CNC[C@@H](O)COc2ccccc2F)CC1(Cl)Cl	ZINC000819346331	DF	On-Demand	Anodyne	ADRB2	28	44
C[C@@]1(CNC[C@@H](O)COc2ccccc2F)CC1(Cl)Cl	ZINC000819346331	DF	On-Demand	Anodyne	ADRB1	58	39
C[C@]1(CNC[C@@H](O)COc2ccccc2F)CC1(Cl)Cl	ZINC000819346334	DF	On-Demand	Anodyne	ADRB2	28	44
C[C@]1(CNC[C@@H](O)COc2ccccc2F)CC1(Cl)Cl	ZINC000819346334	DF	On-Demand	Anodyne	ADRB1	58	39
O=C(C(F)=C1CCC1)N1CCC[C@@H](c2noc(C3CC3)n2)C1	ZINC000819346340	DG	On-Demand	Anodyne	ETHR	52	46
O=C(C(F)=C1CCC1)N1CCC[C@H](c2noc(C3CC3)n2)C1	ZINC000819346344	DG	On-Demand	Anodyne	ETHR	52	46
C[C@H](CNC(=O)CCc1cccc(OC(F)F)c1)c1nc2ccccc2o1	ZINC000819346356	FI	On-Demand	Anodyne	PPARA	17	44
COC[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819346366	DF	On-Demand	Anodyne	ADRB2	22	44
COC[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819346366	DF	On-Demand	Anodyne	ADRB1	37	44
COC[C@@H](CNC[C@@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819346366	DF	On-Demand	Anodyne	ADRB3	98	47
COC[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819346369	DF	On-Demand	Anodyne	ADRB2	22	44
COC[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819346369	DF	On-Demand	Anodyne	ADRB1	37	44
COC[C@@H](CNC[C@H](O)c1cccnc1)c1ccc(Cl)cc1	ZINC000819346369	DF	On-Demand	Anodyne	ADRB3	98	47
O=C(Cc1csc(-c2nc[nH]n2)n1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819346408	IH	On-Demand	Anodyne	CPT1A	101	40
O=C(Cc1csc(-c2nc[nH]n2)n1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819346410	IH	On-Demand	Anodyne	CPT1A	101	40
CCOC(=O)c1cc(NC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)ccc1O	ZINC000819346463	HF	On-Demand	Anodyne	CA2	29	45
CCOC(=O)c1cc(NC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)ccc1O	ZINC000819346463	HF	On-Demand	Anodyne	CA1	27	45
CCOC(=O)c1cc(NC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)ccc1O	ZINC000819346463	HF	On-Demand	Anodyne	CA7	23	44
CCOC(=O)c1cc(NC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)ccc1O	ZINC000819346463	HF	On-Demand	Anodyne	CA5B	47	42
CCOC(=O)c1cc(NC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)ccc1O	ZINC000819346463	HF	On-Demand	Anodyne	CA5A	53	42
CCOC(=O)c1cc(NC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)ccc1O	ZINC000819346463	HF	On-Demand	Anodyne	CA14	18	44
CCOC(=O)c1cc(NC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)ccc1O	ZINC000819346463	HF	On-Demand	Anodyne	CA12	20	45
CCOC(=O)c1cc(NC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)ccc1O	ZINC000819346463	HF	On-Demand	Anodyne	CA9	34	45
CCOC(=O)c1cc(NC(=O)Cc2ccc(S(=O)(=O)C(F)F)cc2)ccc1O	ZINC000819346463	HF	On-Demand	Anodyne	RORC	55	40
CCOC(=O)c1cc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc([N+](=O)[O-])c1	ZINC000819346469	HF	On-Demand	Bother	CACNA1D	45	36
O=C(c1ccnc(-n2ccnc2)c1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819346471	II	On-Demand	Anodyne	NOS2	65	37
O=C(c1ccnc(-n2ccnc2)c1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819346472	II	On-Demand	Anodyne	NOS2	65	37
C#CCCCC(=O)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819346479	EI	On-Demand	Mild	PREP	47	38
C#CCCCC(=O)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819346480	EI	On-Demand	Mild	PREP	47	38
COC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819346535	GG	On-Demand	Anodyne	ACE	42	45
COC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819346535	GG	On-Demand	Anodyne	CELA1	53	40
COC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819346535	GG	On-Demand	Anodyne	ELANE	24	40
COC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819346535	GG	On-Demand	Anodyne	MME	15	45
COC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819346535	GG	On-Demand	Anodyne	PREP	20	45
COC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819346535	GG	On-Demand	Anodyne	LGMN	35	42
COC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819346535	GG	On-Demand	Anodyne	XIAP	40	36
COC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819346536	GG	On-Demand	Anodyne	ACE	42	45
COC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819346536	GG	On-Demand	Anodyne	CELA1	53	40
COC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819346536	GG	On-Demand	Anodyne	ELANE	24	40
COC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819346536	GG	On-Demand	Anodyne	MME	15	45
COC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819346536	GG	On-Demand	Anodyne	PREP	20	45
COC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819346536	GG	On-Demand	Anodyne	LGMN	35	42
COC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819346536	GG	On-Demand	Anodyne	XIAP	40	36
C#CC(=O)Nc1ccc(O)c(C(=O)OCC)c1	ZINC000819346553	BD	On-Demand	Mild	CA1	21	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccccc2)C(F)(F)C1	ZINC000819346584	GG	On-Demand	Anodyne	GPR119	44	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccccc2)C(F)(F)C1	ZINC000819346584	GG	On-Demand	Anodyne	SFRP1	53	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)Cc2ccccc2)C(F)(F)C1	ZINC000819346584	GG	On-Demand	Anodyne	WNT3	41	35
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccccc2)C(F)(F)C1	ZINC000819346585	GG	On-Demand	Anodyne	GPR119	44	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccccc2)C(F)(F)C1	ZINC000819346585	GG	On-Demand	Anodyne	SFRP1	53	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)Cc2ccccc2)C(F)(F)C1	ZINC000819346585	GG	On-Demand	Anodyne	WNT3	41	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)C(F)(F)C1	ZINC000819346586	GG	On-Demand	Anodyne	GPR119	44	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)C(F)(F)C1	ZINC000819346586	GG	On-Demand	Anodyne	SFRP1	53	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)Cc2ccccc2)C(F)(F)C1	ZINC000819346586	GG	On-Demand	Anodyne	WNT3	41	35
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccccc2)C(F)(F)C1	ZINC000819346587	GG	On-Demand	Anodyne	GPR119	44	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccccc2)C(F)(F)C1	ZINC000819346587	GG	On-Demand	Anodyne	SFRP1	53	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)Cc2ccccc2)C(F)(F)C1	ZINC000819346587	GG	On-Demand	Anodyne	WNT3	41	35
C[C@]1(CNC[C@H](O)COc2ccc(CC#N)cc2)CC1(Cl)Cl	ZINC000819346600	EF	On-Demand	Mild	ADRB2	37	42
C[C@]1(CNC[C@H](O)COc2ccc(CC#N)cc2)CC1(Cl)Cl	ZINC000819346600	EF	On-Demand	Mild	ADRB1	60	42
C[C@]1(CNC[C@H](O)COc2ccc(CC#N)cc2)CC1(Cl)Cl	ZINC000819346600	EF	On-Demand	Mild	ADRB3	36	42
C[C@@]1(CNC[C@@H](O)COc2ccc(CC#N)cc2)CC1(Cl)Cl	ZINC000819346603	EF	On-Demand	Mild	ADRB2	37	42
C[C@@]1(CNC[C@@H](O)COc2ccc(CC#N)cc2)CC1(Cl)Cl	ZINC000819346603	EF	On-Demand	Mild	ADRB1	60	42
C[C@@]1(CNC[C@@H](O)COc2ccc(CC#N)cc2)CC1(Cl)Cl	ZINC000819346603	EF	On-Demand	Mild	ADRB3	36	42
C[C@]1(CNC[C@@H](O)COc2ccc(CC#N)cc2)CC1(Cl)Cl	ZINC000819346604	EF	On-Demand	Mild	ADRB2	37	42
C[C@]1(CNC[C@@H](O)COc2ccc(CC#N)cc2)CC1(Cl)Cl	ZINC000819346604	EF	On-Demand	Mild	ADRB1	60	42
C[C@]1(CNC[C@@H](O)COc2ccc(CC#N)cc2)CC1(Cl)Cl	ZINC000819346604	EF	On-Demand	Mild	ADRB3	36	42
C[C@@]1(CNC[C@H](O)COc2ccc(CC#N)cc2)CC1(Cl)Cl	ZINC000819346605	EF	On-Demand	Mild	ADRB2	37	42
C[C@@]1(CNC[C@H](O)COc2ccc(CC#N)cc2)CC1(Cl)Cl	ZINC000819346605	EF	On-Demand	Mild	ADRB1	60	42
C[C@@]1(CNC[C@H](O)COc2ccc(CC#N)cc2)CC1(Cl)Cl	ZINC000819346605	EF	On-Demand	Mild	ADRB3	36	42
CS(=O)(=O)c1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819346615	DD	On-Demand	Anodyne	ADRB2	49	38
CS(=O)(=O)c1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819346615	DD	On-Demand	Anodyne	ADRB1	53	40
CS(=O)(=O)c1cccc(CNC[C@H](O)c2ccccc2)c1	ZINC000819346615	DD	On-Demand	Anodyne	ADRB3	90	42
CS(=O)(=O)c1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819346619	DD	On-Demand	Anodyne	ADRB2	49	38
CS(=O)(=O)c1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819346619	DD	On-Demand	Anodyne	ADRB1	53	40
CS(=O)(=O)c1cccc(CNC[C@@H](O)c2ccccc2)c1	ZINC000819346619	DD	On-Demand	Anodyne	ADRB3	90	42
Cc1ccc(CNC(=O)C2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc1	ZINC000819346682	FF	On-Demand	Anodyne	EPHX2	30	46
Cc1ccc(CNC(=O)C2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc1	ZINC000819346684	FF	On-Demand	Anodyne	EPHX2	30	46
Cc1ccc(CNC(=O)C2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc1	ZINC000819346686	FF	On-Demand	Anodyne	EPHX2	30	46
Cc1ccc(CNC(=O)C2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc1	ZINC000819346687	FF	On-Demand	Anodyne	EPHX2	30	46
Cc1ccc(CNC(=O)C2CCN(C(=O)C(F)=C3CCC3)CC2)cc1	ZINC000819346739	EG	On-Demand	Anodyne	EPHX2	34	46
COc1cc(C)nc(NNC(=O)Cc2cccc(NC(C)=O)c2)n1	ZINC000819346740	ED	On-Demand	Reactive	ALS	65	32
O=C(COCc1ccccn1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819346751	HH	On-Demand	Anodyne	CPT1A	101	38
O=C(COCc1ccccn1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819346752	HH	On-Demand	Anodyne	CPT1A	101	38
CCOC(=O)c1cc(NC(=O)C[C@@H](C)OC)ccc1O	ZINC000819346753	CD	On-Demand	Anodyne	SLC1A2	64	34
CCOC(=O)c1cc(NC(=O)C[C@H](C)OC)ccc1O	ZINC000819346754	CD	On-Demand	Anodyne	SLC1A2	64	34
CCOC(=O)c1cc(NC(=O)COc2cc([N+](=O)[O-])c(C=O)cc2OC)ccc1O	ZINC000819346764	HE	On-Demand	Bother	ENPP1	44	30
O=C1C[C@H](CC(=O)N2CCCC[C@@H]2Cc2ccccc2Br)CO1	ZINC000819346772	GG	On-Demand	Anodyne	PREP	40	38
O=C1C[C@@H](CC(=O)N2CCCC[C@H]2Cc2ccccc2Br)CO1	ZINC000819346773	GG	On-Demand	Anodyne	PREP	40	38
O=C1C[C@@H](CC(=O)N2CCCC[C@@H]2Cc2ccccc2Br)CO1	ZINC000819346774	GG	On-Demand	Anodyne	PREP	40	38
O=C1C[C@H](CC(=O)N2CCCC[C@H]2Cc2ccccc2Br)CO1	ZINC000819346775	GG	On-Demand	Anodyne	PREP	40	38
C=CCNS(=O)(=O)c1cccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)c1	ZINC000819346781	HE	On-Demand	Mild	KCNK3	77	37
C=CCNS(=O)(=O)c1cccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)c1	ZINC000819346781	HE	On-Demand	Mild	KCNK9	47	37
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc3ccccc3n2)ccc1O	ZINC000819346805	FH	On-Demand	Anodyne	CYSLTR1	19	40
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc3ccccc3n2)ccc1O	ZINC000819346806	FH	On-Demand	Anodyne	CYSLTR1	19	40
C#Cc1ccc(C(=O)N2CCCC[C@@H]2Cc2ccccc2Br)cn1	ZINC000819346809	GI	On-Demand	Mild	CPT1A	42	35
C#Cc1ccc(C(=O)N2CCCC[C@H]2Cc2ccccc2Br)cn1	ZINC000819346810	GI	On-Demand	Mild	CPT1A	42	35
CCOC(=O)c1cc(NC(=O)CCn2c(S)nnc2-c2ccc(OC)cc2)ccc1O	ZINC000819346813	IG	On-Demand	Anodyne	ENPP1	67	33
CCOC(=O)c1cc(NC(=O)Cc2c[nH]c3cc(C)ccc23)ccc1O	ZINC000819346815	FH	On-Demand	Anodyne	CFTR	19	44
CCOC(=O)c1cc(NC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)ccc1O	ZINC000819346834	HD	On-Demand	Anodyne	KCNA3	21	41
C#Cc1cncc(C(=O)N2CCCC[C@@H]2Cc2ccccc2Br)c1	ZINC000819346839	GI	On-Demand	Mild	PREP	40	34
C#Cc1cncc(C(=O)N2CCCC[C@H]2Cc2ccccc2Br)c1	ZINC000819346840	GI	On-Demand	Mild	PREP	40	34
Cn1ncc(C(=O)N2CCCC[C@@H]2Cc2ccccc2Br)c1Br	ZINC000819346842	II	On-Demand	Anodyne	HCRTR1	22	40
Cn1ncc(C(=O)N2CCCC[C@@H]2Cc2ccccc2Br)c1Br	ZINC000819346842	II	On-Demand	Anodyne	CPT1A	49	33
Cn1ncc(C(=O)N2CCCC[C@H]2Cc2ccccc2Br)c1Br	ZINC000819346843	II	On-Demand	Anodyne	HCRTR1	22	40
Cn1ncc(C(=O)N2CCCC[C@H]2Cc2ccccc2Br)c1Br	ZINC000819346843	II	On-Demand	Anodyne	CPT1A	49	33
CC(C)(C)OC(=O)N1CC[C@H](c2ccc(F)cc2)[C@H](CNC[C@@H](O)C2CC2)C1	ZINC000819346894	GH	On-Demand	Anodyne	GPR119	37	46
CC(C)(C)OC(=O)N1CC[C@H](c2ccc(F)cc2)[C@H](CNC[C@H](O)C2CC2)C1	ZINC000819346895	GH	On-Demand	Anodyne	GPR119	37	46
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819346913	GG	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819346914	GG	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819346915	GG	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819346916	GG	On-Demand	Anodyne	GPR119	30	41
O[C@@H](CNCCOc1ccc(Cl)c(F)c1)c1ccc(F)c(F)c1	ZINC000819346919	EG	On-Demand	Anodyne	ADRB2	21	40
O[C@@H](CNCCOc1ccc(Cl)c(F)c1)c1ccc(F)c(F)c1	ZINC000819346919	EG	On-Demand	Anodyne	ADRB1	32	43
O[C@@H](CNCCOc1ccc(Cl)c(F)c1)c1ccc(F)c(F)c1	ZINC000819346919	EG	On-Demand	Anodyne	ADRB3	34	43
O[C@H](CNCCOc1ccc(Cl)c(F)c1)c1ccc(F)c(F)c1	ZINC000819346920	EG	On-Demand	Anodyne	ADRB2	21	40
O[C@H](CNCCOc1ccc(Cl)c(F)c1)c1ccc(F)c(F)c1	ZINC000819346920	EG	On-Demand	Anodyne	ADRB1	32	43
O[C@H](CNCCOc1ccc(Cl)c(F)c1)c1ccc(F)c(F)c1	ZINC000819346920	EG	On-Demand	Anodyne	ADRB3	34	43
CC(C)(C)OC(=O)N1CC[C@H](c2ccc(F)cc2)[C@H](CNCC2(O)CCC2)C1	ZINC000819346944	GH	On-Demand	Anodyne	GPR119	37	42
CC(C)(C)OC(=O)N1CC[C@@H](CNCCC(=O)Nc2ccccc2)C(F)(F)C1	ZINC000819346967	GG	On-Demand	Anodyne	SFRP1	28	40
CC(C)(C)OC(=O)N1CC[C@H](CNCCC(=O)Nc2ccccc2)C(F)(F)C1	ZINC000819346968	GG	On-Demand	Anodyne	SFRP1	28	40
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819346972	EF	On-Demand	Anodyne	ADRB2	40	43
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819346972	EF	On-Demand	Anodyne	ADRB1	69	42
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819346972	EF	On-Demand	Anodyne	ADRB3	40	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819346972	EF	On-Demand	Anodyne	ABCB1	17	57
CC(=O)c1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819346973	EF	On-Demand	Anodyne	ADRB2	40	43
CC(=O)c1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819346973	EF	On-Demand	Anodyne	ADRB1	69	42
CC(=O)c1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819346973	EF	On-Demand	Anodyne	ADRB3	40	41
CC(=O)c1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819346973	EF	On-Demand	Anodyne	ABCB1	17	57
CC(=O)c1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819346974	EF	On-Demand	Anodyne	ADRB2	40	43
CC(=O)c1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819346974	EF	On-Demand	Anodyne	ADRB1	69	42
CC(=O)c1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819346974	EF	On-Demand	Anodyne	ADRB3	40	41
CC(=O)c1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819346974	EF	On-Demand	Anodyne	ABCB1	17	57
CC(=O)c1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819346975	EF	On-Demand	Anodyne	ADRB2	40	43
CC(=O)c1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819346975	EF	On-Demand	Anodyne	ADRB1	69	42
CC(=O)c1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819346975	EF	On-Demand	Anodyne	ADRB3	40	41
CC(=O)c1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819346975	EF	On-Demand	Anodyne	ABCB1	17	57
COC[C@@H](CNC[C@@H](O)c1cccc(F)c1)c1ccc(Cl)cc1	ZINC000819346978	EH	On-Demand	Anodyne	ADRB1	29	42
COC[C@@H](CNC[C@@H](O)c1cccc(F)c1)c1ccc(Cl)cc1	ZINC000819346978	EH	On-Demand	Anodyne	ADRB3	39	42
COC[C@@H](CNC[C@H](O)c1cccc(F)c1)c1ccc(Cl)cc1	ZINC000819346980	EH	On-Demand	Anodyne	ADRB1	29	42
COC[C@@H](CNC[C@H](O)c1cccc(F)c1)c1ccc(Cl)cc1	ZINC000819346980	EH	On-Demand	Anodyne	ADRB3	39	42
C=C(C)CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819346989	CG	On-Demand	Mild	ADRB3	20	45
C=C(C)CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819346990	CG	On-Demand	Mild	ADRB3	20	45
CCOc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819346997	EF	On-Demand	Anodyne	ADRB2	41	44
CCOc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819346997	EF	On-Demand	Anodyne	ADRB1	56	42
CCOc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819346997	EF	On-Demand	Anodyne	ADRB3	31	41
CCOc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819346998	EF	On-Demand	Anodyne	ADRB2	41	44
CCOc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819346998	EF	On-Demand	Anodyne	ADRB1	56	42
CCOc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819346998	EF	On-Demand	Anodyne	ADRB3	31	41
CCOc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819346999	EF	On-Demand	Anodyne	ADRB2	41	44
CCOc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819346999	EF	On-Demand	Anodyne	ADRB1	56	42
CCOc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819346999	EF	On-Demand	Anodyne	ADRB3	31	41
CCOc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819347000	EF	On-Demand	Anodyne	ADRB2	41	44
CCOc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819347000	EF	On-Demand	Anodyne	ADRB1	56	42
CCOc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819347000	EF	On-Demand	Anodyne	ADRB3	31	41
CCOc1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819347101	FG	On-Demand	Anodyne	ADRB2	49	46
CCOc1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819347101	FG	On-Demand	Anodyne	ADRB1	70	45
CCOc1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819347101	FG	On-Demand	Anodyne	ADRB3	44	45
CCOc1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819347103	FG	On-Demand	Anodyne	ADRB2	49	46
CCOc1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819347103	FG	On-Demand	Anodyne	ADRB1	70	45
CCOc1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819347103	FG	On-Demand	Anodyne	ADRB3	44	45
CCOc1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819347105	FG	On-Demand	Anodyne	ADRB2	49	46
CCOc1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819347105	FG	On-Demand	Anodyne	ADRB1	70	45
CCOc1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819347105	FG	On-Demand	Anodyne	ADRB3	44	45
CCOc1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819347106	FG	On-Demand	Anodyne	ADRB2	49	46
CCOc1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819347106	FG	On-Demand	Anodyne	ADRB1	70	45
CCOc1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819347106	FG	On-Demand	Anodyne	ADRB3	44	45
O=C(CCCn1ccccc1=O)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347118	HI	On-Demand	Anodyne	DUT	18	42
O=C(CCCn1ccccc1=O)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347119	HI	On-Demand	Anodyne	DUT	18	42
CC(=O)Nc1ccc(S(=O)(=O)NCCCCCCC(C)C)cc1	ZINC000819347120	EH	On-Demand	Anodyne	CA2	27	54
CC(=O)Nc1ccc(S(=O)(=O)NCCCCCCC(C)C)cc1	ZINC000819347120	EH	On-Demand	Anodyne	CA1	29	43
CC(=O)Nc1ccc(S(=O)(=O)NCCCCCCC(C)C)cc1	ZINC000819347120	EH	On-Demand	Anodyne	CA4	23	54
CC(=O)Nc1ccc(S(=O)(=O)NCCCCCCC(C)C)cc1	ZINC000819347120	EH	On-Demand	Anodyne	CA12	20	45
CC(=O)Nc1ccc(S(=O)(=O)NCCCCCCC(C)C)cc1	ZINC000819347120	EH	On-Demand	Anodyne	CA9	23	43
CC(=O)Nc1ccc(S(=O)(=O)NCCCCCCC(C)C)cc1	ZINC000819347120	EH	On-Demand	Anodyne	IDO1	38	45
CCOC(=O)c1cc(NC(=O)/C(C#N)=C\c2ccc(F)cc2)ccc1O	ZINC000819347140	FG	On-Demand	Reactive	DHODH	29	44
CCOC(=O)c1cc(NC(=O)/C(C#N)=C\c2ccc(F)cc2)ccc1O	ZINC000819347140	FG	On-Demand	Reactive	CA12	17	48
CCOC(=O)c1cc(NC(=O)/C(C#N)=C/c2ccc(F)cc2)ccc1O	ZINC000819347142	FG	On-Demand	Reactive	DHODH	29	44
CCOC(=O)c1cc(NC(=O)/C(C#N)=C/c2ccc(F)cc2)ccc1O	ZINC000819347142	FG	On-Demand	Reactive	CA12	17	48
O[C@@H](CN[C@@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1)c1cccnc1	ZINC000819347183	FF	On-Demand	Anodyne	ADRB3	34	42
COC(=O)N(C)CC(=O)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347184	GG	On-Demand	Anodyne	PREP	18	40
COC(=O)N(C)CC(=O)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347185	GG	On-Demand	Anodyne	PREP	18	40
O=C(CC1OCCCO1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347193	GH	On-Demand	Anodyne	PREP	46	34
O=C(CC1OCCCO1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347194	GH	On-Demand	Anodyne	PREP	46	34
O=C(c1cc(=O)c2ccc(F)cc2o1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347213	IJ	On-Demand	Anodyne	KCNH2	15	47
O=C(c1cc(=O)c2ccc(F)cc2o1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347214	IJ	On-Demand	Anodyne	KCNH2	15	47
CCOC(=O)c1cc(NC(=O)CSc2nnc(S)s2)ccc1O	ZINC000819347224	FE	On-Demand	Anodyne	ENPP1	74	36
O=CNc1ccc(C(=O)N2CCCC[C@@H]2Cc2ccccc2Br)cc1	ZINC000819347226	HI	On-Demand	Anodyne	L3MBTL3	47	33
O=CNc1ccc(C(=O)N2CCCC[C@H]2Cc2ccccc2Br)cc1	ZINC000819347230	HI	On-Demand	Anodyne	L3MBTL3	47	33
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ccc(Cl)c(F)c2)c1	ZINC000819347236	FG	On-Demand	Bother	ADRB1	34	45
O=[N+]([O-])c1cccc([C@@H](O)CNCCOc2ccc(Cl)c(F)c2)c1	ZINC000819347236	FG	On-Demand	Bother	ADRB3	38	45
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ccc(Cl)c(F)c2)c1	ZINC000819347237	FG	On-Demand	Bother	ADRB1	34	45
O=[N+]([O-])c1cccc([C@H](O)CNCCOc2ccc(Cl)c(F)c2)c1	ZINC000819347237	FG	On-Demand	Bother	ADRB3	38	45
O[C@@H](CNCCOc1ccc(Cl)c(F)c1)c1cccc(F)c1	ZINC000819347239	EG	On-Demand	Anodyne	ADRB1	39	46
O[C@@H](CNCCOc1ccc(Cl)c(F)c1)c1cccc(F)c1	ZINC000819347239	EG	On-Demand	Anodyne	DRD4	15	40
O[C@@H](CNCCOc1ccc(Cl)c(F)c1)c1cccc(F)c1	ZINC000819347239	EG	On-Demand	Anodyne	ADRB3	43	46
O[C@H](CNCCOc1ccc(Cl)c(F)c1)c1cccc(F)c1	ZINC000819347240	EG	On-Demand	Anodyne	ADRB1	39	46
O[C@H](CNCCOc1ccc(Cl)c(F)c1)c1cccc(F)c1	ZINC000819347240	EG	On-Demand	Anodyne	DRD4	15	40
O[C@H](CNCCOc1ccc(Cl)c(F)c1)c1cccc(F)c1	ZINC000819347240	EG	On-Demand	Anodyne	ADRB3	43	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2F)C(F)(F)C1	ZINC000819347243	GG	On-Demand	Anodyne	GPR119	42	47
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2F)C(F)(F)C1	ZINC000819347244	GG	On-Demand	Anodyne	GPR119	42	47
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2F)C(F)(F)C1	ZINC000819347245	GG	On-Demand	Anodyne	GPR119	42	47
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2F)C(F)(F)C1	ZINC000819347246	GG	On-Demand	Anodyne	GPR119	42	47
CCOC(=O)c1cc(NC(=O)[C@@H](C)NC(=O)OC(C)(C)C)ccc1O	ZINC000819347255	FE	On-Demand	Anodyne	PAPA1_CARPA	31	40
CCOC(=O)c1cc(NC(=O)[C@@H](C)NC(=O)OC(C)(C)C)ccc1O	ZINC000819347255	FE	On-Demand	Anodyne	FPR1	41	41
C#Cc1cncc(C(=O)N(CCCC)C2CCCCC2)c1	ZINC000819347264	CH	On-Demand	Mild	ACE	46	33
O[C@@H](CNCCOc1ccc(Cl)c(F)c1)c1ccccc1F	ZINC000819347295	EG	On-Demand	Anodyne	ADRB2	16	42
O[C@@H](CNCCOc1ccc(Cl)c(F)c1)c1ccccc1F	ZINC000819347295	EG	On-Demand	Anodyne	ADRB1	30	42
O[C@@H](CNCCOc1ccc(Cl)c(F)c1)c1ccccc1F	ZINC000819347295	EG	On-Demand	Anodyne	DRD4	18	43
O[C@H](CNCCOc1ccc(Cl)c(F)c1)c1ccccc1F	ZINC000819347296	EG	On-Demand	Anodyne	ADRB2	16	42
O[C@H](CNCCOc1ccc(Cl)c(F)c1)c1ccccc1F	ZINC000819347296	EG	On-Demand	Anodyne	ADRB1	30	42
O[C@H](CNCCOc1ccc(Cl)c(F)c1)c1ccccc1F	ZINC000819347296	EG	On-Demand	Anodyne	DRD4	18	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(C#N)cc2)C(F)(F)C1	ZINC000819347364	GG	On-Demand	Mild	GPR119	35	41
C[C@@]1(CNC[C@@H](O)c2cccc(Cl)c2)CC1(Cl)Cl	ZINC000819347366	DH	On-Demand	Anodyne	ADRB1	35	44
C[C@@]1(CNC[C@@H](O)c2cccc(Cl)c2)CC1(Cl)Cl	ZINC000819347366	DH	On-Demand	Anodyne	ADRB3	49	44
C[C@]1(CNC[C@H](O)c2cccc(Cl)c2)CC1(Cl)Cl	ZINC000819347367	DH	On-Demand	Anodyne	ADRB1	35	44
C[C@]1(CNC[C@H](O)c2cccc(Cl)c2)CC1(Cl)Cl	ZINC000819347367	DH	On-Demand	Anodyne	ADRB3	49	44
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(C#N)cc2)C(F)(F)C1	ZINC000819347368	GG	On-Demand	Mild	GPR119	35	41
C[C@@]1(CNC[C@H](O)c2cccc(Cl)c2)CC1(Cl)Cl	ZINC000819347369	DH	On-Demand	Anodyne	ADRB1	35	44
C[C@@]1(CNC[C@H](O)c2cccc(Cl)c2)CC1(Cl)Cl	ZINC000819347369	DH	On-Demand	Anodyne	ADRB3	49	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(C#N)cc2)C(F)(F)C1	ZINC000819347370	GG	On-Demand	Mild	GPR119	35	41
C[C@]1(CNC[C@@H](O)c2cccc(Cl)c2)CC1(Cl)Cl	ZINC000819347371	DH	On-Demand	Anodyne	ADRB1	35	44
C[C@]1(CNC[C@@H](O)c2cccc(Cl)c2)CC1(Cl)Cl	ZINC000819347371	DH	On-Demand	Anodyne	ADRB3	49	44
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(C#N)cc2)C(F)(F)C1	ZINC000819347373	GG	On-Demand	Mild	GPR119	35	41
C=C(C)CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819347395	CG	On-Demand	Mild	ADRB2	17	43
C=C(C)CCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819347395	CG	On-Demand	Mild	ADRB1	16	43
C=C(C)CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819347396	CG	On-Demand	Mild	ADRB2	17	43
C=C(C)CCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819347396	CG	On-Demand	Mild	ADRB1	16	43
O[C@H](CN[C@@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1)c1cccnc1	ZINC000819347446	FF	On-Demand	Anodyne	ADRB3	34	42
O[C@H](CN[C@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1)c1cccnc1	ZINC000819347447	FF	On-Demand	Anodyne	ADRB3	34	42
O[C@@H](CN[C@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1)c1cccnc1	ZINC000819347448	FF	On-Demand	Anodyne	ADRB3	34	42
O[C@H](CNCC1(N2CCN(c3ccccc3)CC2)CCOCC1)c1cccnc1	ZINC000819347457	GE	On-Demand	Anodyne	ADRB3	65	40
O[C@@H](CNCC1(N2CCN(c3ccccc3)CC2)CCOCC1)c1cccnc1	ZINC000819347458	GE	On-Demand	Anodyne	ADRB3	65	40
C[C@H](NC(=O)Cc1ccc(-n2cnnc2)cc1)C(=O)OC1CCCC1	ZINC000819347497	ED	On-Demand	Anodyne	LGMN	40	31
O=C(c1c[nH]nc1C1CC1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347549	GI	On-Demand	Anodyne	HCRTR1	18	41
O=C(c1c[nH]nc1C1CC1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347550	GI	On-Demand	Anodyne	HCRTR1	18	41
O=C(c1csc(-c2ccccn2)n1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347564	IK	On-Demand	Anodyne	CPT1A	41	49
O=C(c1csc(-c2ccccn2)n1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347565	IK	On-Demand	Anodyne	CPT1A	41	49
O=C(CC1OCCO1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347566	FG	On-Demand	Anodyne	PREP	45	35
O=C(CC1OCCO1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347567	FG	On-Demand	Anodyne	PREP	45	35
CC[C@@H](O)CNC[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1c1ccc(F)cc1	ZINC000819347580	GH	On-Demand	Anodyne	GPR119	40	47
CC[C@H](O)CNC[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1c1ccc(F)cc1	ZINC000819347581	GH	On-Demand	Anodyne	GPR119	40	47
CCOC(=O)c1cc(NC(=O)[C@@H](COC)NC(=O)OC(C)(C)C)ccc1O	ZINC000819347588	GE	On-Demand	Anodyne	PAPA1_CARPA	37	40
CCOC(=O)c1cc(NC(=O)[C@@H](COC)NC(=O)OC(C)(C)C)ccc1O	ZINC000819347588	GE	On-Demand	Anodyne	FPR1	41	37
O=C(CCCCN1CCCC1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347601	HJ	On-Demand	Anodyne	HTR1A	19	45
O=C(CCCCN1CCCC1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347601	HJ	On-Demand	Anodyne	SLC6A1	47	36
O=C(CCCCN1CCCC1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347601	HJ	On-Demand	Anodyne	HTR7	36	42
O=C(CCCCN1CCCC1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347601	HJ	On-Demand	Anodyne	HRH3	31	41
O=C(CCCCN1CCCC1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347601	HJ	On-Demand	Anodyne	PREP	55	39
O=C(CCCCN1CCCC1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347601	HJ	On-Demand	Anodyne	CYP2J2	43	30
O=C(CCCCN1CCCC1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347606	HJ	On-Demand	Anodyne	HTR1A	19	45
O=C(CCCCN1CCCC1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347606	HJ	On-Demand	Anodyne	SLC6A1	47	36
O=C(CCCCN1CCCC1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347606	HJ	On-Demand	Anodyne	HTR7	36	42
O=C(CCCCN1CCCC1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347606	HJ	On-Demand	Anodyne	HRH3	31	41
O=C(CCCCN1CCCC1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347606	HJ	On-Demand	Anodyne	PREP	55	39
O=C(CCCCN1CCCC1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347606	HJ	On-Demand	Anodyne	CYP2J2	43	30
N#CCOc1cccc(CC(=O)N2CCCC[C@H]2Cc2ccccc2Br)c1	ZINC000819347608	IJ	On-Demand	Mild	OPRK1	16	45
N#CCOc1cccc(CC(=O)N2CCCC[C@H]2Cc2ccccc2Br)c1	ZINC000819347608	IJ	On-Demand	Mild	CPT1A	81	36
N#CCOc1cccc(CC(=O)N2CCCC[C@H]2Cc2ccccc2Br)c1	ZINC000819347608	IJ	On-Demand	Mild	CPT2	42	32
N#CCOc1cccc(CC(=O)N2CCCC[C@@H]2Cc2ccccc2Br)c1	ZINC000819347620	IJ	On-Demand	Mild	OPRK1	16	45
N#CCOc1cccc(CC(=O)N2CCCC[C@@H]2Cc2ccccc2Br)c1	ZINC000819347620	IJ	On-Demand	Mild	CPT1A	81	36
N#CCOc1cccc(CC(=O)N2CCCC[C@@H]2Cc2ccccc2Br)c1	ZINC000819347620	IJ	On-Demand	Mild	CPT2	42	32
C[C@H](CNC[C@@H]1CCN(C(=O)OC(C)(C)C)CC1(F)F)S(C)(=O)=O	ZINC000819347629	FD	On-Demand	Anodyne	GPR119	38	41
C[C@@H](CNC[C@H]1CCN(C(=O)OC(C)(C)C)CC1(F)F)S(C)(=O)=O	ZINC000819347630	FD	On-Demand	Anodyne	GPR119	38	41
C[C@@H](CNC[C@@H]1CCN(C(=O)OC(C)(C)C)CC1(F)F)S(C)(=O)=O	ZINC000819347631	FD	On-Demand	Anodyne	GPR119	38	41
C[C@H](CNC[C@H]1CCN(C(=O)OC(C)(C)C)CC1(F)F)S(C)(=O)=O	ZINC000819347632	FD	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCC1(F)F	ZINC000819347633	GH	On-Demand	Anodyne	CTSD	115	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCC1(F)F	ZINC000819347633	GH	On-Demand	Anodyne	PGC	62	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCC1(F)F	ZINC000819347633	GH	On-Demand	Anodyne	CMA1	30	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCC1(F)F	ZINC000819347633	GH	On-Demand	Anodyne	PAPA1_CARPA	29	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCC1(F)F	ZINC000819347633	GH	On-Demand	Anodyne	BACE2	53	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCC1(F)F	ZINC000819347633	GH	On-Demand	Anodyne	TIMP3	62	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCC1(F)F	ZINC000819347633	GH	On-Demand	Anodyne	REN	94	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCC1(F)F	ZINC000819347633	GH	On-Demand	Anodyne	REN1	27	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCC1(F)F	ZINC000819347633	GH	On-Demand	Anodyne	BACE1	100	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCC1(F)F	ZINC000819347633	GH	On-Demand	Anodyne	FPR1	49	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCC1(F)F	ZINC000819347633	GH	On-Demand	Anodyne	PLM1_PLAFA	29	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CCCC1(F)F	ZINC000819347633	GH	On-Demand	Anodyne	PLM2_PLAFA	45	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCC1(F)F	ZINC000819347636	GH	On-Demand	Anodyne	CTSD	115	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCC1(F)F	ZINC000819347636	GH	On-Demand	Anodyne	PGC	62	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCC1(F)F	ZINC000819347636	GH	On-Demand	Anodyne	CMA1	30	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCC1(F)F	ZINC000819347636	GH	On-Demand	Anodyne	PAPA1_CARPA	29	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCC1(F)F	ZINC000819347636	GH	On-Demand	Anodyne	BACE2	53	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCC1(F)F	ZINC000819347636	GH	On-Demand	Anodyne	TIMP3	62	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCC1(F)F	ZINC000819347636	GH	On-Demand	Anodyne	REN	94	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCC1(F)F	ZINC000819347636	GH	On-Demand	Anodyne	REN1	27	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCC1(F)F	ZINC000819347636	GH	On-Demand	Anodyne	BACE1	100	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCC1(F)F	ZINC000819347636	GH	On-Demand	Anodyne	FPR1	49	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCC1(F)F	ZINC000819347636	GH	On-Demand	Anodyne	PLM1_PLAFA	29	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CCCC1(F)F	ZINC000819347636	GH	On-Demand	Anodyne	PLM2_PLAFA	45	33
O=C(/C=C/c1cccnc1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347641	GI	On-Demand	Anodyne	CHRNA7	22	40
O=C(/C=C/c1cccnc1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347641	GI	On-Demand	Anodyne	C3AR1	34	48
O=C(/C=C\c1cccnc1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347643	GI	On-Demand	Anodyne	CHRNA7	22	40
O=C(/C=C\c1cccnc1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347643	GI	On-Demand	Anodyne	C3AR1	34	48
O=C(/C=C\c1cccnc1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347645	GI	On-Demand	Anodyne	CHRNA7	22	40
O=C(/C=C\c1cccnc1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347645	GI	On-Demand	Anodyne	C3AR1	34	48
O=C(/C=C/c1cccnc1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347647	GI	On-Demand	Anodyne	CHRNA7	22	40
O=C(/C=C/c1cccnc1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347647	GI	On-Demand	Anodyne	C3AR1	34	48
COC[C@@H](O)CNC[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1c1ccc(F)cc1	ZINC000819347667	GF	On-Demand	Anodyne	GPR119	37	44
O=C(c1cccc(O)c1O)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347686	GI	On-Demand	Clean	HCRTR1	21	44
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819347687	FG	On-Demand	Anodyne	GPR119	24	46
O=C(c1cccc(O)c1O)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347688	GI	On-Demand	Clean	HCRTR1	21	44
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819347689	FG	On-Demand	Anodyne	GPR119	24	46
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819347691	FG	On-Demand	Anodyne	GPR119	24	46
O=C(c1ccnc(F)c1F)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347692	GI	On-Demand	Anodyne	HCRTR1	28	40
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819347693	FG	On-Demand	Anodyne	GPR119	24	46
O=C(c1ccnc(F)c1F)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347702	GI	On-Demand	Anodyne	HCRTR1	28	40
C#CCCCCC(=O)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347705	FJ	On-Demand	Mild	PREP	44	37
C#CCCCCC(=O)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347709	FJ	On-Demand	Mild	PREP	44	37
CCOC(=O)c1cc(NC(=O)[C@@H](O)c2cccc(OC)c2)ccc1O	ZINC000819347720	EE	On-Demand	Anodyne	CA1	15	40
CCOC(=O)c1cc(NC(=O)[C@@H](O)c2cccc(OC)c2)ccc1O	ZINC000819347720	EE	On-Demand	Anodyne	MTNR1A	28	42
CCOC(=O)c1cc(NC(=O)[C@@H](O)c2cccc(OC)c2)ccc1O	ZINC000819347720	EE	On-Demand	Anodyne	MTNR1B	29	44
CC(=O)N1CCc2cc(S(=O)(=O)NCCCCCCC(C)C)ccc21	ZINC000819347723	FG	On-Demand	Anodyne	HTR7	18	42
COc1cc(C)nc(NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819347731	GD	On-Demand	Reactive	PAPA1_CARPA	42	44
COc1cc(C)nc(NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819347732	GD	On-Demand	Reactive	PAPA1_CARPA	42	44
CCOC(=O)NCCCC(=O)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819347740	HH	On-Demand	Anodyne	PREP	35	41
CCOC(=O)NCCCC(=O)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819347753	HH	On-Demand	Anodyne	PREP	35	41
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819347811	FG	On-Demand	Anodyne	ADRB2	47	48
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819347811	FG	On-Demand	Anodyne	ADRB1	78	48
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819347811	FG	On-Demand	Anodyne	GRIN1	22	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819347811	FG	On-Demand	Anodyne	ADRB3	55	48
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819347811	FG	On-Demand	Anodyne	ABCB1	30	45
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819347812	FG	On-Demand	Anodyne	ADRB2	47	48
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819347812	FG	On-Demand	Anodyne	ADRB1	78	48
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819347812	FG	On-Demand	Anodyne	GRIN1	22	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819347812	FG	On-Demand	Anodyne	ADRB3	55	48
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819347812	FG	On-Demand	Anodyne	ABCB1	30	45
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819347813	FG	On-Demand	Anodyne	ADRB2	47	48
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819347813	FG	On-Demand	Anodyne	ADRB1	78	48
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819347813	FG	On-Demand	Anodyne	GRIN1	22	43
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819347813	FG	On-Demand	Anodyne	ADRB3	55	48
CC(=O)CCc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819347813	FG	On-Demand	Anodyne	ABCB1	30	45
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819347814	FG	On-Demand	Anodyne	ADRB2	47	48
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819347814	FG	On-Demand	Anodyne	ADRB1	78	48
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819347814	FG	On-Demand	Anodyne	GRIN1	22	43
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819347814	FG	On-Demand	Anodyne	ADRB3	55	48
CC(=O)CCc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819347814	FG	On-Demand	Anodyne	ABCB1	30	45
C[C@@]1(CNC[C@H](O)COc2ccccc2C(F)(F)F)CC1(Cl)Cl	ZINC000819347828	FH	On-Demand	Anodyne	ADRB2	24	43
C[C@@]1(CNC[C@H](O)COc2ccccc2C(F)(F)F)CC1(Cl)Cl	ZINC000819347828	FH	On-Demand	Anodyne	ADRB1	55	34
C[C@@]1(CNC[C@H](O)COc2ccccc2C(F)(F)F)CC1(Cl)Cl	ZINC000819347828	FH	On-Demand	Anodyne	ABCB1	17	40
C[C@]1(CNC[C@H](O)COc2ccccc2C(F)(F)F)CC1(Cl)Cl	ZINC000819347829	FH	On-Demand	Anodyne	ADRB2	24	43
C[C@]1(CNC[C@H](O)COc2ccccc2C(F)(F)F)CC1(Cl)Cl	ZINC000819347829	FH	On-Demand	Anodyne	ADRB1	55	34
C[C@]1(CNC[C@H](O)COc2ccccc2C(F)(F)F)CC1(Cl)Cl	ZINC000819347829	FH	On-Demand	Anodyne	ABCB1	17	40
C[C@@]1(CNC[C@@H](O)COc2ccccc2C(F)(F)F)CC1(Cl)Cl	ZINC000819347830	FH	On-Demand	Anodyne	ADRB2	24	43
C[C@@]1(CNC[C@@H](O)COc2ccccc2C(F)(F)F)CC1(Cl)Cl	ZINC000819347830	FH	On-Demand	Anodyne	ADRB1	55	34
C[C@@]1(CNC[C@@H](O)COc2ccccc2C(F)(F)F)CC1(Cl)Cl	ZINC000819347830	FH	On-Demand	Anodyne	ABCB1	17	40
C[C@]1(CNC[C@@H](O)COc2ccccc2C(F)(F)F)CC1(Cl)Cl	ZINC000819347831	FH	On-Demand	Anodyne	ADRB2	24	43
C[C@]1(CNC[C@@H](O)COc2ccccc2C(F)(F)F)CC1(Cl)Cl	ZINC000819347831	FH	On-Demand	Anodyne	ADRB1	55	34
C[C@]1(CNC[C@@H](O)COc2ccccc2C(F)(F)F)CC1(Cl)Cl	ZINC000819347831	FH	On-Demand	Anodyne	ABCB1	17	40
C[C@@]1(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])CC1(Cl)Cl	ZINC000819347834	EF	On-Demand	Bother	ADRB2	22	40
C[C@@]1(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])CC1(Cl)Cl	ZINC000819347834	EF	On-Demand	Bother	ADRB1	53	36
C[C@]1(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])CC1(Cl)Cl	ZINC000819347835	EF	On-Demand	Bother	ADRB2	22	40
C[C@]1(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])CC1(Cl)Cl	ZINC000819347835	EF	On-Demand	Bother	ADRB1	53	36
C[C@@]1(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1(Cl)Cl	ZINC000819347836	EF	On-Demand	Bother	ADRB2	22	40
C[C@@]1(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1(Cl)Cl	ZINC000819347836	EF	On-Demand	Bother	ADRB1	53	36
C[C@]1(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1(Cl)Cl	ZINC000819347837	EF	On-Demand	Bother	ADRB2	22	40
C[C@]1(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1(Cl)Cl	ZINC000819347837	EF	On-Demand	Bother	ADRB1	53	36
CON(C)C(=O)CCNC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000819347855	FD	On-Demand	Anodyne	DRD4	24	41
CON(C)C(=O)CCNC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000819347855	FD	On-Demand	Anodyne	LTA4H	19	42
CON(C)C(=O)CCNC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000819347855	FD	On-Demand	Anodyne	SIGMAR1	26	42
CON(C)C(=O)CCNC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000819347855	FD	On-Demand	Anodyne	SSTR5	62	43
CON(C)C(=O)CCNC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000819347855	FD	On-Demand	Anodyne	UTS2R	16	40
CON(C)C(=O)CCNC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000819347855	FD	On-Demand	Anodyne	MCHR1	45	42
CON(C)C(=O)CCNC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000819347855	FD	On-Demand	Anodyne	NOD2	42	37
C#CCOc1ccc(CNC[C@H](O)COC2CCOCC2)cc1	ZINC000819347857	DD	On-Demand	Mild	ADRB1	32	44
C#CCOc1ccc(CNC[C@@H](O)COC2CCOCC2)cc1	ZINC000819347858	DD	On-Demand	Mild	ADRB1	32	44
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cn3)CC2)cc1	ZINC000819347859	GE	On-Demand	Anodyne	SIGMAR1	24	43
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cn3)CC2)cc1	ZINC000819347859	GE	On-Demand	Anodyne	SSTR5	57	40
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cn3)CC2)cc1	ZINC000819347859	GE	On-Demand	Anodyne	CCR3	61	40
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cn3)CC2)cc1	ZINC000819347859	GE	On-Demand	Anodyne	MLNR	56	42
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cn3)CC2)cc1	ZINC000819347859	GE	On-Demand	Anodyne	MCHR1	41	40
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cn3)CC2)cc1	ZINC000819347860	GE	On-Demand	Anodyne	SIGMAR1	24	43
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cn3)CC2)cc1	ZINC000819347860	GE	On-Demand	Anodyne	SSTR5	57	40
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cn3)CC2)cc1	ZINC000819347860	GE	On-Demand	Anodyne	CCR3	61	40
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cn3)CC2)cc1	ZINC000819347860	GE	On-Demand	Anodyne	MLNR	56	42
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cn3)CC2)cc1	ZINC000819347860	GE	On-Demand	Anodyne	MCHR1	41	40
C#CCOc1ccc(CNC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819347901	FE	On-Demand	Mild	ADRB2	36	45
C#CCOc1ccc(CNC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819347901	FE	On-Demand	Mild	ADRB1	54	45
C#CCOc1ccc(CNC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819347901	FE	On-Demand	Mild	ADRB3	36	44
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819347902	FE	On-Demand	Mild	ADRB2	36	45
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819347902	FE	On-Demand	Mild	ADRB1	54	45
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819347902	FE	On-Demand	Mild	ADRB3	36	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)c1	ZINC000819347905	GC	On-Demand	Bother	ADRB2	31	46
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)c1	ZINC000819347905	GC	On-Demand	Bother	ADRB1	50	46
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)c1	ZINC000819347905	GC	On-Demand	Bother	ADRB3	34	46
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)c1	ZINC000819347906	GC	On-Demand	Bother	ADRB2	31	46
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)c1	ZINC000819347906	GC	On-Demand	Bother	ADRB1	50	46
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)c1	ZINC000819347906	GC	On-Demand	Bother	ADRB3	34	46
C#CCOc1ccc(CNC[C@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819347918	FG	On-Demand	Mild	ADRB2	18	40
C#CCOc1ccc(CNC[C@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819347918	FG	On-Demand	Mild	ADRB1	35	41
C#CCOc1ccc(CNC[C@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819347918	FG	On-Demand	Mild	ADRB3	21	40
C#CCOc1ccc(CNC[C@@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819347919	FG	On-Demand	Mild	ADRB2	18	40
C#CCOc1ccc(CNC[C@@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819347919	FG	On-Demand	Mild	ADRB1	35	41
C#CCOc1ccc(CNC[C@@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819347919	FG	On-Demand	Mild	ADRB3	21	40
O=S(=O)(CCNC[C@@H](O)COc1ccc2c(c1)OCO2)C1CCOCC1	ZINC000819347949	GC	On-Demand	Anodyne	ADRB2	24	44
O=S(=O)(CCNC[C@@H](O)COc1ccc2c(c1)OCO2)C1CCOCC1	ZINC000819347949	GC	On-Demand	Anodyne	ADRB1	48	44
O=S(=O)(CCNC[C@H](O)COc1ccc2c(c1)OCO2)C1CCOCC1	ZINC000819347952	GC	On-Demand	Anodyne	ADRB2	24	44
O=S(=O)(CCNC[C@H](O)COc1ccc2c(c1)OCO2)C1CCOCC1	ZINC000819347952	GC	On-Demand	Anodyne	ADRB1	48	44
O=C(C(F)=C1CCC1)N1CC[C@H]1Cc1ccccc1	ZINC000819347953	CG	On-Demand	Anodyne	PREP	47	34
O=C(C(F)=C1CCC1)N1CC[C@@H]1Cc1ccccc1	ZINC000819347954	CG	On-Demand	Anodyne	PREP	47	34
O=S(=O)(CCNC[C@H](O)COc1cccc2ccccc12)C1CCOCC1	ZINC000819347956	GD	On-Demand	Anodyne	ADRB2	41	54
O=S(=O)(CCNC[C@H](O)COc1cccc2ccccc12)C1CCOCC1	ZINC000819347956	GD	On-Demand	Anodyne	ADRB1	65	49
O=S(=O)(CCNC[C@H](O)COc1cccc2ccccc12)C1CCOCC1	ZINC000819347956	GD	On-Demand	Anodyne	ADRB3	33	47
O=S(=O)(CCNC[C@H](O)COc1cccc2ccccc12)C1CCOCC1	ZINC000819347956	GD	On-Demand	Anodyne	ABCB1	16	41
O=S(=O)(CCNC[C@@H](O)COc1cccc2ccccc12)C1CCOCC1	ZINC000819347958	GD	On-Demand	Anodyne	ADRB2	41	54
O=S(=O)(CCNC[C@@H](O)COc1cccc2ccccc12)C1CCOCC1	ZINC000819347958	GD	On-Demand	Anodyne	ADRB1	65	49
O=S(=O)(CCNC[C@@H](O)COc1cccc2ccccc12)C1CCOCC1	ZINC000819347958	GD	On-Demand	Anodyne	ADRB3	33	47
O=S(=O)(CCNC[C@@H](O)COc1cccc2ccccc12)C1CCOCC1	ZINC000819347958	GD	On-Demand	Anodyne	ABCB1	16	41
C#CCOc1ccc(CNC[C@H](O)COCc2ccccc2)cc1	ZINC000819347959	EE	On-Demand	Mild	ADRB2	32	41
C#CCOc1ccc(CNC[C@H](O)COCc2ccccc2)cc1	ZINC000819347959	EE	On-Demand	Mild	ADRB1	51	41
C#CCOc1ccc(CNC[C@H](O)COCc2ccccc2)cc1	ZINC000819347959	EE	On-Demand	Mild	ADRB3	33	41
C#CCOc1ccc(CNC[C@@H](O)COCc2ccccc2)cc1	ZINC000819347961	EE	On-Demand	Mild	ADRB2	32	41
C#CCOc1ccc(CNC[C@@H](O)COCc2ccccc2)cc1	ZINC000819347961	EE	On-Demand	Mild	ADRB1	51	41
C#CCOc1ccc(CNC[C@@H](O)COCc2ccccc2)cc1	ZINC000819347961	EE	On-Demand	Mild	ADRB3	33	41
Cc1ccc(F)c(CCNC[C@H](O)c2ccccc2)c1	ZINC000819347995	CF	On-Demand	Anodyne	ADRB2	47	48
Cc1ccc(F)c(CCNC[C@H](O)c2ccccc2)c1	ZINC000819347995	CF	On-Demand	Anodyne	ADRB1	50	43
Cc1ccc(F)c(CCNC[C@H](O)c2ccccc2)c1	ZINC000819347995	CF	On-Demand	Anodyne	ADRB3	87	44
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819348082	GG	On-Demand	Anodyne	GPR119	29	44
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819348083	GG	On-Demand	Anodyne	GPR119	29	44
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819348084	GG	On-Demand	Anodyne	GPR119	29	44
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819348085	GG	On-Demand	Anodyne	GPR119	29	44
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819348090	FF	On-Demand	Anodyne	GHRHR	56	32
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819348090	FF	On-Demand	Anodyne	GPR119	28	41
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819348091	FF	On-Demand	Anodyne	GHRHR	56	32
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819348091	FF	On-Demand	Anodyne	GPR119	28	41
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819348092	FF	On-Demand	Anodyne	GHRHR	56	32
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819348092	FF	On-Demand	Anodyne	GPR119	28	41
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819348093	FF	On-Demand	Anodyne	GHRHR	56	32
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819348093	FF	On-Demand	Anodyne	GPR119	28	41
CN(C[C@@H](O)COc1ccc(C(F)(F)F)cc1)C(=O)C(F)=C1CCC1	ZINC000819348113	FG	On-Demand	Anodyne	PPARD	27	40
CN(C[C@H](O)COc1ccc(C(F)(F)F)cc1)C(=O)C(F)=C1CCC1	ZINC000819348114	FG	On-Demand	Anodyne	PPARD	27	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2(CF)CCOCC2)CC1	ZINC000819348115	FE	On-Demand	Anodyne	GPR119	24	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2(CF)CCOCC2)CC1	ZINC000819348116	FE	On-Demand	Anodyne	GPR119	24	40
N#CCOc1ccc(CC(=O)N2CCCC[C@H]2Cc2ccccc2Br)cc1	ZINC000819348144	IJ	On-Demand	Mild	CPT1A	67	38
N#CCOc1ccc(CC(=O)N2CCCC[C@@H]2Cc2ccccc2Br)cc1	ZINC000819348145	IJ	On-Demand	Mild	CPT1A	67	38
O=C(c1ccnc(Cl)c1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819348147	GJ	On-Demand	Anodyne	CPT1A	40	33
COc1ccc(OC)c([C@H](O)CNCCOc2ccc(Cl)c(F)c2)c1	ZINC000819348152	FG	On-Demand	Anodyne	ADRB2	16	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)CCc2ccccc2)C(F)(F)C1	ZINC000819348153	GG	On-Demand	Anodyne	GHRHR	49	31
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)CCc2ccccc2)C(F)(F)C1	ZINC000819348153	GG	On-Demand	Anodyne	GPR119	38	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)CCc2ccccc2)C(F)(F)C1	ZINC000819348153	GG	On-Demand	Anodyne	SFRP1	32	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)CCc2ccccc2)C(F)(F)C1	ZINC000819348154	GG	On-Demand	Anodyne	GHRHR	49	31
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)CCc2ccccc2)C(F)(F)C1	ZINC000819348154	GG	On-Demand	Anodyne	GPR119	38	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)CCc2ccccc2)C(F)(F)C1	ZINC000819348154	GG	On-Demand	Anodyne	SFRP1	32	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)CCc2ccccc2)C(F)(F)C1	ZINC000819348155	GG	On-Demand	Anodyne	GHRHR	49	31
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)CCc2ccccc2)C(F)(F)C1	ZINC000819348155	GG	On-Demand	Anodyne	GPR119	38	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)CCc2ccccc2)C(F)(F)C1	ZINC000819348155	GG	On-Demand	Anodyne	SFRP1	32	40
O=C(c1ccnc(Cl)c1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819348156	GJ	On-Demand	Anodyne	CPT1A	40	33
CC(C)n1ncc(C(=O)N2CCCC[C@H]2Cc2ccccc2Br)c1N	ZINC000819348162	HI	On-Demand	Anodyne	CPT1A	42	33
CC(C)n1ncc(C(=O)N2CCCC[C@@H]2Cc2ccccc2Br)c1N	ZINC000819348163	HI	On-Demand	Anodyne	CPT1A	42	33
C[C@@]1(CNC[C@@H](O)COc2cccc3[nH]ccc23)CC1(Cl)Cl	ZINC000819348174	EG	On-Demand	Anodyne	ADRB2	23	61
C[C@@]1(CNC[C@@H](O)COc2cccc3[nH]ccc23)CC1(Cl)Cl	ZINC000819348174	EG	On-Demand	Anodyne	ADRB1	33	61
C[C@]1(CNC[C@@H](O)COc2cccc3[nH]ccc23)CC1(Cl)Cl	ZINC000819348175	EG	On-Demand	Anodyne	ADRB2	23	61
C[C@]1(CNC[C@@H](O)COc2cccc3[nH]ccc23)CC1(Cl)Cl	ZINC000819348175	EG	On-Demand	Anodyne	ADRB1	33	61
C[C@@]1(CNC[C@H](O)COc2cccc3[nH]ccc23)CC1(Cl)Cl	ZINC000819348177	EG	On-Demand	Anodyne	ADRB2	23	61
C[C@@]1(CNC[C@H](O)COc2cccc3[nH]ccc23)CC1(Cl)Cl	ZINC000819348177	EG	On-Demand	Anodyne	ADRB1	33	61
C[C@]1(CNC[C@H](O)COc2cccc3[nH]ccc23)CC1(Cl)Cl	ZINC000819348179	EG	On-Demand	Anodyne	ADRB2	23	61
C[C@]1(CNC[C@H](O)COc2cccc3[nH]ccc23)CC1(Cl)Cl	ZINC000819348179	EG	On-Demand	Anodyne	ADRB1	33	61
CCOC(=O)NCC(=O)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819348205	GG	On-Demand	Anodyne	PREP	33	45
CCOC(=O)NCC(=O)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819348207	GG	On-Demand	Anodyne	PREP	33	45
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc(Cl)nc2)ccc1O	ZINC000819348235	EG	On-Demand	Anodyne	MCHR1	16	41
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc(Cl)nc2)ccc1O	ZINC000819348239	EG	On-Demand	Anodyne	MCHR1	16	41
CSc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348261	FG	On-Demand	Anodyne	ADRB2	30	41
CSc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348261	FG	On-Demand	Anodyne	ADRB1	48	39
CSc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348264	FG	On-Demand	Anodyne	ADRB2	30	41
CSc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348264	FG	On-Demand	Anodyne	ADRB1	48	39
CSc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348265	FG	On-Demand	Anodyne	ADRB2	30	41
CSc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348265	FG	On-Demand	Anodyne	ADRB1	48	39
CSc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348266	FG	On-Demand	Anodyne	ADRB2	30	41
CSc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348266	FG	On-Demand	Anodyne	ADRB1	48	39
C[C@@]1(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)CC1(Cl)Cl	ZINC000819348268	FH	On-Demand	Anodyne	ADRB2	23	40
C[C@@]1(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)CC1(Cl)Cl	ZINC000819348268	FH	On-Demand	Anodyne	ADRB1	28	42
C[C@@]1(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)CC1(Cl)Cl	ZINC000819348268	FH	On-Demand	Anodyne	PDS	48	43
C[C@]1(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)CC1(Cl)Cl	ZINC000819348270	FH	On-Demand	Anodyne	ADRB2	23	40
C[C@]1(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)CC1(Cl)Cl	ZINC000819348270	FH	On-Demand	Anodyne	ADRB1	28	42
C[C@]1(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)CC1(Cl)Cl	ZINC000819348270	FH	On-Demand	Anodyne	PDS	48	43
C[C@]1(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)CC1(Cl)Cl	ZINC000819348271	FH	On-Demand	Anodyne	ADRB2	23	40
C[C@]1(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)CC1(Cl)Cl	ZINC000819348271	FH	On-Demand	Anodyne	ADRB1	28	42
C[C@]1(CNC[C@H](O)COc2cccc(C(F)(F)F)c2)CC1(Cl)Cl	ZINC000819348271	FH	On-Demand	Anodyne	PDS	48	43
C[C@@]1(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)CC1(Cl)Cl	ZINC000819348273	FH	On-Demand	Anodyne	ADRB2	23	40
C[C@@]1(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)CC1(Cl)Cl	ZINC000819348273	FH	On-Demand	Anodyne	ADRB1	28	42
C[C@@]1(CNC[C@@H](O)COc2cccc(C(F)(F)F)c2)CC1(Cl)Cl	ZINC000819348273	FH	On-Demand	Anodyne	PDS	48	43
C[C@]1(CNC[C@@H](O)c2cccnc2)CC1(Cl)Cl	ZINC000819348298	CE	On-Demand	Anodyne	ADRB2	22	41
C[C@]1(CNC[C@@H](O)c2cccnc2)CC1(Cl)Cl	ZINC000819348298	CE	On-Demand	Anodyne	ADRB1	23	41
C[C@]1(CNC[C@@H](O)c2cccnc2)CC1(Cl)Cl	ZINC000819348298	CE	On-Demand	Anodyne	ADRB3	89	43
C[C@@]1(CNC[C@@H](O)c2cccnc2)CC1(Cl)Cl	ZINC000819348300	CE	On-Demand	Anodyne	ADRB2	22	41
C[C@@]1(CNC[C@@H](O)c2cccnc2)CC1(Cl)Cl	ZINC000819348300	CE	On-Demand	Anodyne	ADRB1	23	41
C[C@@]1(CNC[C@@H](O)c2cccnc2)CC1(Cl)Cl	ZINC000819348300	CE	On-Demand	Anodyne	ADRB3	89	43
C[C@@]1(CNC[C@H](O)c2cccnc2)CC1(Cl)Cl	ZINC000819348302	CE	On-Demand	Anodyne	ADRB2	22	41
C[C@@]1(CNC[C@H](O)c2cccnc2)CC1(Cl)Cl	ZINC000819348302	CE	On-Demand	Anodyne	ADRB1	23	41
C[C@@]1(CNC[C@H](O)c2cccnc2)CC1(Cl)Cl	ZINC000819348302	CE	On-Demand	Anodyne	ADRB3	89	43
C[C@]1(CNC[C@H](O)c2cccnc2)CC1(Cl)Cl	ZINC000819348303	CE	On-Demand	Anodyne	ADRB2	22	41
C[C@]1(CNC[C@H](O)c2cccnc2)CC1(Cl)Cl	ZINC000819348303	CE	On-Demand	Anodyne	ADRB1	23	41
C[C@]1(CNC[C@H](O)c2cccnc2)CC1(Cl)Cl	ZINC000819348303	CE	On-Demand	Anodyne	ADRB3	89	43
O=C(c1ccc(N2CCOCC2)nc1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819348322	IH	On-Demand	Anodyne	ADK	23	42
O=C(c1ccc(N2CCOCC2)nc1)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819348322	IH	On-Demand	Anodyne	HPGDS	15	41
O=C(c1ccc(N2CCOCC2)nc1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819348325	IH	On-Demand	Anodyne	ADK	23	42
O=C(c1ccc(N2CCOCC2)nc1)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819348325	IH	On-Demand	Anodyne	HPGDS	15	41
Cc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348326	DF	On-Demand	Anodyne	ADRB2	41	53
Cc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348326	DF	On-Demand	Anodyne	ADRB1	55	42
Cc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348326	DF	On-Demand	Anodyne	ADRB3	30	42
Cc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348327	DF	On-Demand	Anodyne	ADRB2	41	53
Cc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348327	DF	On-Demand	Anodyne	ADRB1	55	42
Cc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348327	DF	On-Demand	Anodyne	ADRB3	30	42
Cc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348328	DF	On-Demand	Anodyne	ADRB2	41	53
Cc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348328	DF	On-Demand	Anodyne	ADRB1	55	42
Cc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348328	DF	On-Demand	Anodyne	ADRB3	30	42
Cc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348329	DF	On-Demand	Anodyne	ADRB2	41	53
Cc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348329	DF	On-Demand	Anodyne	ADRB1	55	42
Cc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348329	DF	On-Demand	Anodyne	ADRB3	30	42
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3C)CC2)cc1	ZINC000819348359	GG	On-Demand	Anodyne	TSHR	41	31
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3C)CC2)cc1	ZINC000819348359	GG	On-Demand	Anodyne	DRD4	41	47
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3C)CC2)cc1	ZINC000819348359	GG	On-Demand	Anodyne	ACHE	23	43
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3C)CC2)cc1	ZINC000819348359	GG	On-Demand	Anodyne	CHRM3	19	44
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3C)CC2)cc1	ZINC000819348359	GG	On-Demand	Anodyne	LTA4H	27	44
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3C)CC2)cc1	ZINC000819348359	GG	On-Demand	Anodyne	SIGMAR1	34	53
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3C)CC2)cc1	ZINC000819348359	GG	On-Demand	Anodyne	SSTR5	44	39
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3C)CC2)cc1	ZINC000819348359	GG	On-Demand	Anodyne	CCR3	38	45
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3C)CC2)cc1	ZINC000819348359	GG	On-Demand	Anodyne	TIMP3	40	30
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3C)CC2)cc1	ZINC000819348359	GG	On-Demand	Anodyne	MCHR1	44	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3C)CC2)cc1	ZINC000819348359	GG	On-Demand	Anodyne	NOD2	42	37
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3C)CC2)cc1	ZINC000819348361	GG	On-Demand	Anodyne	TSHR	41	31
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3C)CC2)cc1	ZINC000819348361	GG	On-Demand	Anodyne	DRD4	41	47
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3C)CC2)cc1	ZINC000819348361	GG	On-Demand	Anodyne	ACHE	23	43
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3C)CC2)cc1	ZINC000819348361	GG	On-Demand	Anodyne	CHRM3	19	44
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3C)CC2)cc1	ZINC000819348361	GG	On-Demand	Anodyne	LTA4H	27	44
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3C)CC2)cc1	ZINC000819348361	GG	On-Demand	Anodyne	SIGMAR1	34	53
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3C)CC2)cc1	ZINC000819348361	GG	On-Demand	Anodyne	SSTR5	44	39
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3C)CC2)cc1	ZINC000819348361	GG	On-Demand	Anodyne	CCR3	38	45
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3C)CC2)cc1	ZINC000819348361	GG	On-Demand	Anodyne	TIMP3	40	30
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3C)CC2)cc1	ZINC000819348361	GG	On-Demand	Anodyne	MCHR1	44	41
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3C)CC2)cc1	ZINC000819348361	GG	On-Demand	Anodyne	NOD2	42	37
COCC(COC)NC[C@H](O)c1cccc2ccccc12	ZINC000819348373	CE	On-Demand	Anodyne	ADRB2	17	47
O=S(=O)(CCNC[C@H](O)COc1ccc(F)cc1)C1CCOCC1	ZINC000819348374	FC	On-Demand	Anodyne	ADRB2	44	48
O=S(=O)(CCNC[C@H](O)COc1ccc(F)cc1)C1CCOCC1	ZINC000819348374	FC	On-Demand	Anodyne	ADRB1	80	49
O=S(=O)(CCNC[C@H](O)COc1ccc(F)cc1)C1CCOCC1	ZINC000819348374	FC	On-Demand	Anodyne	GRIN1	15	50
O=S(=O)(CCNC[C@H](O)COc1ccc(F)cc1)C1CCOCC1	ZINC000819348374	FC	On-Demand	Anodyne	ADRB3	50	46
O=S(=O)(CCNC[C@@H](O)COc1ccc(F)cc1)C1CCOCC1	ZINC000819348375	FC	On-Demand	Anodyne	ADRB2	44	48
O=S(=O)(CCNC[C@@H](O)COc1ccc(F)cc1)C1CCOCC1	ZINC000819348375	FC	On-Demand	Anodyne	ADRB1	80	49
O=S(=O)(CCNC[C@@H](O)COc1ccc(F)cc1)C1CCOCC1	ZINC000819348375	FC	On-Demand	Anodyne	GRIN1	15	50
O=S(=O)(CCNC[C@@H](O)COc1ccc(F)cc1)C1CCOCC1	ZINC000819348375	FC	On-Demand	Anodyne	ADRB3	50	46
CCN1C[C@H](NC[C@H](O)c2cccnc2)CC1=O	ZINC000819348412	BC	On-Demand	Anodyne	ADRB3	72	47
CCN1C[C@H](NC[C@@H](O)c2cccnc2)CC1=O	ZINC000819348415	BC	On-Demand	Anodyne	ADRB3	72	47
C#CCOc1ccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819348416	FE	On-Demand	Mild	ADRB2	49	45
C#CCOc1ccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819348416	FE	On-Demand	Mild	ADRB1	81	42
C#CCOc1ccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819348416	FE	On-Demand	Mild	ADRB3	50	42
C#CCOc1ccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819348416	FE	On-Demand	Mild	CASR	46	32
C#CCOc1ccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819348416	FE	On-Demand	Mild	ABCB1	24	46
C#CCOc1ccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819348416	FE	On-Demand	Mild	PDS	53	37
C#CCOc1ccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819348417	FE	On-Demand	Mild	ADRB2	49	45
C#CCOc1ccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819348417	FE	On-Demand	Mild	ADRB1	81	42
C#CCOc1ccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819348417	FE	On-Demand	Mild	ADRB3	50	42
C#CCOc1ccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819348417	FE	On-Demand	Mild	CASR	46	32
C#CCOc1ccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819348417	FE	On-Demand	Mild	ABCB1	24	46
C#CCOc1ccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819348417	FE	On-Demand	Mild	PDS	53	37
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)C1CCOCC1	ZINC000819348434	ED	On-Demand	Anodyne	ADRB1	50	45
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)C1CCOCC1	ZINC000819348434	ED	On-Demand	Anodyne	ADRB3	67	50
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)C1CCOCC1	ZINC000819348434	ED	On-Demand	Anodyne	CYP3A4	43	34
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)C1CCOCC1	ZINC000819348435	ED	On-Demand	Anodyne	ADRB1	50	45
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)C1CCOCC1	ZINC000819348435	ED	On-Demand	Anodyne	ADRB3	67	50
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)C1CCOCC1	ZINC000819348435	ED	On-Demand	Anodyne	CYP3A4	43	34
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348436	GG	On-Demand	Anodyne	ADRB1	29	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348436	GG	On-Demand	Anodyne	DRD4	27	44
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348436	GG	On-Demand	Anodyne	KCNH2	17	51
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348436	GG	On-Demand	Anodyne	ADRB3	51	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348436	GG	On-Demand	Anodyne	SIGMAR1	30	50
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348436	GG	On-Demand	Anodyne	SSTR5	52	39
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348436	GG	On-Demand	Anodyne	NPY2R	24	42
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348436	GG	On-Demand	Anodyne	CCR3	90	45
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348436	GG	On-Demand	Anodyne	MLNR	62	47
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348436	GG	On-Demand	Anodyne	MCHR1	65	45
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348438	GG	On-Demand	Anodyne	ADRB1	29	41
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348438	GG	On-Demand	Anodyne	DRD4	27	44
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348438	GG	On-Demand	Anodyne	KCNH2	17	51
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348438	GG	On-Demand	Anodyne	ADRB3	51	41
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348438	GG	On-Demand	Anodyne	SIGMAR1	30	50
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348438	GG	On-Demand	Anodyne	SSTR5	52	39
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348438	GG	On-Demand	Anodyne	NPY2R	24	42
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348438	GG	On-Demand	Anodyne	CCR3	90	45
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348438	GG	On-Demand	Anodyne	MLNR	62	47
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccc(F)c3)CC2)cc1	ZINC000819348438	GG	On-Demand	Anodyne	MCHR1	65	45
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819348439	FC	On-Demand	Anodyne	ADRB2	50	48
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819348439	FC	On-Demand	Anodyne	ADRB1	75	49
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819348439	FC	On-Demand	Anodyne	GRIN1	17	42
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819348439	FC	On-Demand	Anodyne	ADRB3	50	46
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819348440	FC	On-Demand	Anodyne	ADRB2	50	48
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819348440	FC	On-Demand	Anodyne	ADRB1	75	49
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819348440	FC	On-Demand	Anodyne	GRIN1	17	42
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819348440	FC	On-Demand	Anodyne	ADRB3	50	46
C#CCOc1ccc(CNC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819348457	GF	On-Demand	Mild	ADAM17	21	45
C#CCOc1ccc(CNC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819348457	GF	On-Demand	Mild	GPR119	25	40
C#CCOc1ccc(CNC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819348458	GF	On-Demand	Mild	ADAM17	21	45
C#CCOc1ccc(CNC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819348458	GF	On-Demand	Mild	GPR119	25	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC[C@H]1Cc1ccccc1	ZINC000819348469	EF	On-Demand	Anodyne	REN	44	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC[C@H]1Cc1ccccc1	ZINC000819348469	EF	On-Demand	Anodyne	FPR1	47	38
COC(=O)c1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348474	GF	On-Demand	Anodyne	ADRB2	50	49
COC(=O)c1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348474	GF	On-Demand	Anodyne	ADRB1	88	49
COC(=O)c1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348474	GF	On-Demand	Anodyne	ADRB3	57	49
COC(=O)c1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348475	GF	On-Demand	Anodyne	ADRB2	50	49
COC(=O)c1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348475	GF	On-Demand	Anodyne	ADRB1	88	49
COC(=O)c1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348475	GF	On-Demand	Anodyne	ADRB3	57	49
COC(=O)c1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348476	GF	On-Demand	Anodyne	ADRB2	50	49
COC(=O)c1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348476	GF	On-Demand	Anodyne	ADRB1	88	49
COC(=O)c1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348476	GF	On-Demand	Anodyne	ADRB3	57	49
COC(=O)c1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348477	GF	On-Demand	Anodyne	ADRB2	50	49
COC(=O)c1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348477	GF	On-Demand	Anodyne	ADRB1	88	49
COC(=O)c1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348477	GF	On-Demand	Anodyne	ADRB3	57	49
O[C@H](CN[C@H]1CCO[C@H](c2cccnc2)C1)c1cccc(Cl)c1	ZINC000819348523	EG	On-Demand	Anodyne	ADRB1	21	41
O[C@H](CN[C@H]1CCO[C@H](c2cccnc2)C1)c1cccc(Cl)c1	ZINC000819348523	EG	On-Demand	Anodyne	ADRB3	37	42
O[C@H](CN[C@@H]1CCO[C@H](c2cccnc2)C1)c1cccc(Cl)c1	ZINC000819348524	EG	On-Demand	Anodyne	ADRB1	21	41
O[C@H](CN[C@@H]1CCO[C@H](c2cccnc2)C1)c1cccc(Cl)c1	ZINC000819348524	EG	On-Demand	Anodyne	ADRB3	37	42
O[C@H](CN[C@@H]1CCO[C@@H](c2cccnc2)C1)c1cccc(Cl)c1	ZINC000819348525	EG	On-Demand	Anodyne	ADRB1	21	41
O[C@H](CN[C@@H]1CCO[C@@H](c2cccnc2)C1)c1cccc(Cl)c1	ZINC000819348525	EG	On-Demand	Anodyne	ADRB3	37	42
O[C@H](CN[C@H]1CCO[C@@H](c2cccnc2)C1)c1cccc(Cl)c1	ZINC000819348526	EG	On-Demand	Anodyne	ADRB1	21	41
O[C@H](CN[C@H]1CCO[C@@H](c2cccnc2)C1)c1cccc(Cl)c1	ZINC000819348526	EG	On-Demand	Anodyne	ADRB3	37	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)CCc2ccccc2)C(F)(F)C1	ZINC000819348546	GG	On-Demand	Anodyne	GHRHR	49	31
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)CCc2ccccc2)C(F)(F)C1	ZINC000819348546	GG	On-Demand	Anodyne	GPR119	38	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)CCc2ccccc2)C(F)(F)C1	ZINC000819348546	GG	On-Demand	Anodyne	SFRP1	32	40
CC(C)(C)OC(=O)N1CC[C@H](c2ccc(F)cc2)[C@H](CNCCC#N)C1	ZINC000819348553	FH	On-Demand	Mild	GPR119	38	44
O[C@@H](CNCCOc1ccc(Cl)c(F)c1)c1c(F)cccc1F	ZINC000819348556	EG	On-Demand	Anodyne	DRD4	15	40
O[C@H](CNCCOc1ccc(Cl)c(F)c1)c1c(F)cccc1F	ZINC000819348557	EG	On-Demand	Anodyne	DRD4	15	40
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@@H]2CCCC2(F)F)c1	ZINC000819348558	DF	On-Demand	Bother	CACNA1D	48	33
O=[N+]([O-])c1cccc([C@H](O)CNC[C@H]2CCCC2(F)F)c1	ZINC000819348559	DF	On-Demand	Bother	CACNA1D	48	33
O=[N+]([O-])c1cccc([C@H](O)CNC[C@@H]2CCCC2(F)F)c1	ZINC000819348560	DF	On-Demand	Bother	CACNA1D	48	33
O=[N+]([O-])c1cccc([C@@H](O)CNC[C@H]2CCCC2(F)F)c1	ZINC000819348561	DF	On-Demand	Bother	CACNA1D	48	33
O=[N+]([O-])c1ccc([C@@H](O)CNCCOc2ccc(Cl)c(F)c2)cc1	ZINC000819348562	FG	On-Demand	Bother	ADRB1	20	40
O=[N+]([O-])c1ccc([C@@H](O)CNCCOc2ccc(Cl)c(F)c2)cc1	ZINC000819348562	FG	On-Demand	Bother	ADRB3	24	40
O=[N+]([O-])c1ccc([C@H](O)CNCCOc2ccc(Cl)c(F)c2)cc1	ZINC000819348563	FG	On-Demand	Bother	ADRB1	20	40
O=[N+]([O-])c1ccc([C@H](O)CNCCOc2ccc(Cl)c(F)c2)cc1	ZINC000819348563	FG	On-Demand	Bother	ADRB3	24	40
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819348596	GF	On-Demand	Anodyne	MC4R	16	42
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819348596	GF	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819348597	GF	On-Demand	Anodyne	MC4R	16	42
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819348597	GF	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819348598	GF	On-Demand	Anodyne	MC4R	16	42
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819348598	GF	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819348599	GF	On-Demand	Anodyne	MC4R	16	42
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819348599	GF	On-Demand	Anodyne	GPR119	29	40
O[C@@H](CNCCOc1ccc(Cl)c(F)c1)c1ccc(F)cc1	ZINC000819348614	EG	On-Demand	Anodyne	ADRB1	31	40
O[C@@H](CNCCOc1ccc(Cl)c(F)c1)c1ccc(F)cc1	ZINC000819348614	EG	On-Demand	Anodyne	ADRB3	29	40
O[C@H](CNCCOc1ccc(Cl)c(F)c1)c1ccc(F)cc1	ZINC000819348615	EG	On-Demand	Anodyne	ADRB1	31	40
O[C@H](CNCCOc1ccc(Cl)c(F)c1)c1ccc(F)cc1	ZINC000819348615	EG	On-Demand	Anodyne	ADRB3	29	40
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2cccc(F)c2)C(F)(F)C1	ZINC000819348628	GG	On-Demand	Anodyne	GPR119	37	49
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2cccc(F)c2)C(F)(F)C1	ZINC000819348629	GG	On-Demand	Anodyne	GPR119	37	49
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2cccc(F)c2)C(F)(F)C1	ZINC000819348630	GG	On-Demand	Anodyne	GPR119	37	49
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2cccc(F)c2)C(F)(F)C1	ZINC000819348631	GG	On-Demand	Anodyne	GPR119	37	49
CS(=O)(=O)c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819348637	DD	On-Demand	Anodyne	ADRB2	38	46
CS(=O)(=O)c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819348637	DD	On-Demand	Anodyne	ADRB1	44	46
CS(=O)(=O)c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819348637	DD	On-Demand	Anodyne	ADRB3	134	51
CS(=O)(=O)c1cccc(CNC[C@H](O)c2cccnc2)c1	ZINC000819348637	DD	On-Demand	Anodyne	KCNA5	20	41
CS(=O)(=O)c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819348638	DD	On-Demand	Anodyne	ADRB2	38	46
CS(=O)(=O)c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819348638	DD	On-Demand	Anodyne	ADRB1	44	46
CS(=O)(=O)c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819348638	DD	On-Demand	Anodyne	ADRB3	134	51
CS(=O)(=O)c1cccc(CNC[C@@H](O)c2cccnc2)c1	ZINC000819348638	DD	On-Demand	Anodyne	KCNA5	20	41
O=C(NCC(=O)N1CCCC[C@@H]1Cc1ccccc1Br)OCC(F)(F)F	ZINC000819348648	IH	On-Demand	Anodyne	PREP	24	43
O=C(NCC(=O)N1CCCC[C@H]1Cc1ccccc1Br)OCC(F)(F)F	ZINC000819348649	IH	On-Demand	Anodyne	PREP	24	43
CCOC(=O)c1cc(NC(=O)CC(OCC)OCC)ccc1O	ZINC000819348650	EE	On-Demand	Anodyne	SLC1A1	42	33
CCOC(=O)c1cc(NC(=O)CC(OCC)OCC)ccc1O	ZINC000819348650	EE	On-Demand	Anodyne	SLC1A3	44	33
CCOC(=O)c1cc(NC(=O)CC(OCC)OCC)ccc1O	ZINC000819348650	EE	On-Demand	Anodyne	SLC1A2	68	34
CCOC(=O)c1cc(NC(=O)CCCN(C)C2=NS(=O)(=O)c3ccccc32)ccc1O	ZINC000819348659	IE	On-Demand	Anodyne	KCNA3	17	50
CCOC(=O)c1cc(NC(=O)/C(C#N)=C\c2cc(C)n(CCOC)c2C)ccc1O	ZINC000819348665	HG	On-Demand	Reactive	CA12	15	42
CCOC(=O)c1cc(NC(=O)/C(C#N)=C/c2cc(C)n(CCOC)c2C)ccc1O	ZINC000819348666	HG	On-Demand	Reactive	CA12	15	42
O=C(c1cccnc1F)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819348673	GI	On-Demand	Anodyne	HCRTR1	40	43
O=C(c1cccnc1F)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819348673	GI	On-Demand	Anodyne	HCRTR2	22	43
O=C(c1cccnc1F)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819348674	GI	On-Demand	Anodyne	HCRTR1	40	43
O=C(c1cccnc1F)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819348674	GI	On-Demand	Anodyne	HCRTR2	22	43
C=CC(=O)NCc1ccc(C(=O)N2CCCC[C@H]2Cc2ccccc2Br)cc1	ZINC000819348677	II	On-Demand	Anodyne	TMPRSS11D	53	33
C=CC(=O)NCc1ccc(C(=O)N2CCCC[C@@H]2Cc2ccccc2Br)cc1	ZINC000819348678	II	On-Demand	Anodyne	TMPRSS11D	53	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC[C@@H]1Cc1ccccc1	ZINC000819348693	EF	On-Demand	Anodyne	REN	44	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC[C@@H]1Cc1ccccc1	ZINC000819348693	EF	On-Demand	Anodyne	FPR1	47	38
C#CCOc1ccc(CNC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819348705	FE	On-Demand	Mild	ADRB2	48	46
C#CCOc1ccc(CNC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819348705	FE	On-Demand	Mild	ADRB1	78	46
C#CCOc1ccc(CNC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819348705	FE	On-Demand	Mild	ADRB3	46	45
C#CCOc1ccc(CNC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819348705	FE	On-Demand	Mild	ABCB1	15	54
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819348713	FE	On-Demand	Mild	ADRB2	48	46
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819348713	FE	On-Demand	Mild	ADRB1	78	46
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819348713	FE	On-Demand	Mild	ADRB3	46	45
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819348713	FE	On-Demand	Mild	ABCB1	15	54
CCc1noc(CCCC(=O)N2CCCC[C@H]2Cc2ccccc2Br)n1	ZINC000819348752	HI	On-Demand	Anodyne	CPT1A	67	35
CC(=O)c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)c1	ZINC000819348755	GC	On-Demand	Anodyne	ADRB2	38	43
CC(=O)c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)c1	ZINC000819348755	GC	On-Demand	Anodyne	ADRB1	73	41
CC(=O)c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)c1	ZINC000819348755	GC	On-Demand	Anodyne	ADRB3	47	38
CC(=O)c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)c1	ZINC000819348755	GC	On-Demand	Anodyne	ABCB1	16	43
CCc1noc(CCCC(=O)N2CCCC[C@@H]2Cc2ccccc2Br)n1	ZINC000819348758	HI	On-Demand	Anodyne	CPT1A	67	35
CC(=O)c1cccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)c1	ZINC000819348761	GC	On-Demand	Anodyne	ADRB2	38	43
CC(=O)c1cccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)c1	ZINC000819348761	GC	On-Demand	Anodyne	ADRB1	73	41
CC(=O)c1cccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)c1	ZINC000819348761	GC	On-Demand	Anodyne	ADRB3	47	38
CC(=O)c1cccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)c1	ZINC000819348761	GC	On-Demand	Anodyne	ABCB1	16	43
C[C@]1(CNC[C@H](O)COc2ccc3ccccc3c2)CC1(Cl)Cl	ZINC000819348770	FH	On-Demand	Anodyne	ADRB2	43	57
C[C@]1(CNC[C@H](O)COc2ccc3ccccc3c2)CC1(Cl)Cl	ZINC000819348770	FH	On-Demand	Anodyne	ADRB1	49	40
C[C@]1(CNC[C@H](O)COc2ccc3ccccc3c2)CC1(Cl)Cl	ZINC000819348770	FH	On-Demand	Anodyne	ADRB3	28	40
C[C@]1(CNC[C@@H](O)COc2ccc3ccccc3c2)CC1(Cl)Cl	ZINC000819348773	FH	On-Demand	Anodyne	ADRB2	43	57
C[C@]1(CNC[C@@H](O)COc2ccc3ccccc3c2)CC1(Cl)Cl	ZINC000819348773	FH	On-Demand	Anodyne	ADRB1	49	40
C[C@]1(CNC[C@@H](O)COc2ccc3ccccc3c2)CC1(Cl)Cl	ZINC000819348773	FH	On-Demand	Anodyne	ADRB3	28	40
C[C@@]1(CNC[C@H](O)COc2ccc3ccccc3c2)CC1(Cl)Cl	ZINC000819348776	FH	On-Demand	Anodyne	ADRB2	43	57
C[C@@]1(CNC[C@H](O)COc2ccc3ccccc3c2)CC1(Cl)Cl	ZINC000819348776	FH	On-Demand	Anodyne	ADRB1	49	40
C[C@@]1(CNC[C@H](O)COc2ccc3ccccc3c2)CC1(Cl)Cl	ZINC000819348776	FH	On-Demand	Anodyne	ADRB3	28	40
CCOC(=O)c1cc(NC(=O)[C@@H](O)C(C)(C)C)ccc1O	ZINC000819348778	CD	On-Demand	Anodyne	CA1	15	41
CCOC(=O)c1cc(NC(=O)[C@@H](O)C(C)(C)C)ccc1O	ZINC000819348778	CD	On-Demand	Anodyne	CA7	16	53
CCOC(=O)c1cc(NC(=O)[C@@H](O)C(C)(C)C)ccc1O	ZINC000819348778	CD	On-Demand	Anodyne	CA14	18	53
C[C@@]1(CNC[C@@H](O)COc2ccc3ccccc3c2)CC1(Cl)Cl	ZINC000819348780	FH	On-Demand	Anodyne	ADRB2	43	57
C[C@@]1(CNC[C@@H](O)COc2ccc3ccccc3c2)CC1(Cl)Cl	ZINC000819348780	FH	On-Demand	Anodyne	ADRB1	49	40
C[C@@]1(CNC[C@@H](O)COc2ccc3ccccc3c2)CC1(Cl)Cl	ZINC000819348780	FH	On-Demand	Anodyne	ADRB3	28	40
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348796	FF	On-Demand	Anodyne	ADRB2	48	58
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348796	FF	On-Demand	Anodyne	ADRB1	82	58
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348796	FF	On-Demand	Anodyne	GRIN1	27	41
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348796	FF	On-Demand	Anodyne	ADRB3	50	55
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348798	FF	On-Demand	Anodyne	ADRB2	48	58
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348798	FF	On-Demand	Anodyne	ADRB1	82	58
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348798	FF	On-Demand	Anodyne	GRIN1	27	41
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348798	FF	On-Demand	Anodyne	ADRB3	50	55
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348801	FF	On-Demand	Anodyne	ADRB2	48	58
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348801	FF	On-Demand	Anodyne	ADRB1	82	58
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348801	FF	On-Demand	Anodyne	GRIN1	27	41
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819348801	FF	On-Demand	Anodyne	ADRB3	50	55
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348805	FF	On-Demand	Anodyne	ADRB2	48	58
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348805	FF	On-Demand	Anodyne	ADRB1	82	58
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348805	FF	On-Demand	Anodyne	GRIN1	27	41
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819348805	FF	On-Demand	Anodyne	ADRB3	50	55
C#CCNC(=O)CCNCC1(N2CCN(c3ccccc3)CC2)CCOCC1	ZINC000819348841	GD	On-Demand	Mild	HCN1	69	41
C#CCNC(=O)CCNCC1(N2CCN(c3ccccc3)CC2)CCOCC1	ZINC000819348841	GD	On-Demand	Mild	HCN4	50	32
O=S(=O)(CCNC[C@H](O)COc1cccc2[nH]ccc12)C1CCOCC1	ZINC000819348847	GD	On-Demand	Anodyne	ADRB2	19	56
O=S(=O)(CCNC[C@H](O)COc1cccc2[nH]ccc12)C1CCOCC1	ZINC000819348847	GD	On-Demand	Anodyne	ADRB1	55	52
O=S(=O)(CCNC[C@H](O)COc1cccc2[nH]ccc12)C1CCOCC1	ZINC000819348847	GD	On-Demand	Anodyne	ADRB3	15	52
CNC(=O)[C@@H](C)CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819348852	FD	On-Demand	Mild	PAPA1_CARPA	39	46
CNC(=O)[C@@H](C)CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819348852	FD	On-Demand	Mild	CTSK	15	46
O=S(=O)(CCNC[C@@H](O)COc1cccc2[nH]ccc12)C1CCOCC1	ZINC000819348855	GD	On-Demand	Anodyne	ADRB2	19	56
O=S(=O)(CCNC[C@@H](O)COc1cccc2[nH]ccc12)C1CCOCC1	ZINC000819348855	GD	On-Demand	Anodyne	ADRB1	55	52
O=S(=O)(CCNC[C@@H](O)COc1cccc2[nH]ccc12)C1CCOCC1	ZINC000819348855	GD	On-Demand	Anodyne	ADRB3	15	52
CNC(=O)[C@@H](C)CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819348856	FD	On-Demand	Mild	PAPA1_CARPA	39	46
CNC(=O)[C@@H](C)CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819348856	FD	On-Demand	Mild	CTSK	15	46
COC(=O)[C@@H](C)[C@@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819348874	GF	On-Demand	Anodyne	FPR1	42	34
COC(=O)[C@@H](C)[C@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819348890	GF	On-Demand	Anodyne	FPR1	42	34
C#CCOc1ccc(CNC[C@H](O)COCc2cccs2)cc1	ZINC000819348918	EE	On-Demand	Mild	ADRB2	21	40
C#CCOc1ccc(CNC[C@H](O)COCc2cccs2)cc1	ZINC000819348918	EE	On-Demand	Mild	ADRB1	37	44
C#CCOc1ccc(CNC[C@H](O)COCc2cccs2)cc1	ZINC000819348918	EE	On-Demand	Mild	ADRB3	23	44
C#CCOc1ccc(CNC[C@@H](O)COCc2cccs2)cc1	ZINC000819348925	EE	On-Demand	Mild	ADRB2	21	40
C#CCOc1ccc(CNC[C@@H](O)COCc2cccs2)cc1	ZINC000819348925	EE	On-Demand	Mild	ADRB1	37	44
C#CCOc1ccc(CNC[C@@H](O)COCc2cccs2)cc1	ZINC000819348925	EE	On-Demand	Mild	ADRB3	23	44
O[C@H](CNC[C@H]1CCOC2(CCC2)C1)c1cccnc1	ZINC000819348940	CE	On-Demand	Anodyne	ADRB1	20	40
O[C@H](CNC[C@H]1CCOC2(CCC2)C1)c1cccnc1	ZINC000819348940	CE	On-Demand	Anodyne	ADRB3	83	41
O[C@@H](CNC[C@@H]1CCOC2(CCC2)C1)c1cccnc1	ZINC000819348942	CE	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CNC[C@@H]1CCOC2(CCC2)C1)c1cccnc1	ZINC000819348942	CE	On-Demand	Anodyne	ADRB3	83	41
O[C@H](CNC[C@@H]1CCOC2(CCC2)C1)c1cccnc1	ZINC000819348944	CE	On-Demand	Anodyne	ADRB1	20	40
O[C@H](CNC[C@@H]1CCOC2(CCC2)C1)c1cccnc1	ZINC000819348944	CE	On-Demand	Anodyne	ADRB3	83	41
O[C@@H](CNC[C@H]1CCOC2(CCC2)C1)c1cccnc1	ZINC000819348949	CE	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CNC[C@H]1CCOC2(CCC2)C1)c1cccnc1	ZINC000819348949	CE	On-Demand	Anodyne	ADRB3	83	41
COC[C@@H](CNC[C@H](O)c1ccccc1)c1ccc(Cl)cc1	ZINC000819348962	DG	On-Demand	Anodyne	ADRB3	49	37
COC[C@@H](CNC[C@H](O)c1ccccc1)c1ccc(Cl)cc1	ZINC000819348962	DG	On-Demand	Anodyne	AOC3	15	40
COC[C@@H](CNC[C@@H](O)c1ccccc1)c1ccc(Cl)cc1	ZINC000819348968	DG	On-Demand	Anodyne	ADRB3	49	37
COC[C@@H](CNC[C@@H](O)c1ccccc1)c1ccc(Cl)cc1	ZINC000819348968	DG	On-Demand	Anodyne	AOC3	15	40
CCN1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819348983	CD	On-Demand	Anodyne	ADRB1	33	43
CCN1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819348983	CD	On-Demand	Anodyne	ADRB3	51	48
CCN1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819348983	CD	On-Demand	Anodyne	IGF1R	29	40
CCN1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819348983	CD	On-Demand	Anodyne	CYP3A4	50	39
CCN1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819348986	CD	On-Demand	Anodyne	ADRB1	33	43
CCN1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819348986	CD	On-Demand	Anodyne	ADRB3	51	48
CCN1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819348986	CD	On-Demand	Anodyne	IGF1R	29	40
CCN1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CC1=O	ZINC000819348986	CD	On-Demand	Anodyne	CYP3A4	50	39
O=S(=O)(CCNC[C@H](O)c1ccccc1)C1CCOCC1	ZINC000819348994	DC	On-Demand	Anodyne	ADRB2	15	40
O=S(=O)(CCNC[C@H](O)c1ccccc1)C1CCOCC1	ZINC000819348994	DC	On-Demand	Anodyne	ADRB3	47	45
CS(=O)(=O)c1ccc([C@@H](O)CNCc2cccc(S(C)(=O)=O)c2)cc1	ZINC000819348995	GD	On-Demand	Anodyne	ADRB2	44	38
CS(=O)(=O)c1ccc([C@@H](O)CNCc2cccc(S(C)(=O)=O)c2)cc1	ZINC000819348995	GD	On-Demand	Anodyne	ADRB3	57	44
O=S(=O)(CCNC[C@@H](O)c1ccccc1)C1CCOCC1	ZINC000819348996	DC	On-Demand	Anodyne	ADRB2	15	40
O=S(=O)(CCNC[C@@H](O)c1ccccc1)C1CCOCC1	ZINC000819348996	DC	On-Demand	Anodyne	ADRB3	47	45
CS(=O)(=O)c1ccc([C@H](O)CNCc2cccc(S(C)(=O)=O)c2)cc1	ZINC000819348999	GD	On-Demand	Anodyne	ADRB2	44	38
CS(=O)(=O)c1ccc([C@H](O)CNCc2cccc(S(C)(=O)=O)c2)cc1	ZINC000819348999	GD	On-Demand	Anodyne	ADRB3	57	44
O=S(=O)(CCNC[C@H](O)COc1ccccc1)C1CCOCC1	ZINC000819349000	EC	On-Demand	Anodyne	ADRB2	57	48
O=S(=O)(CCNC[C@H](O)COc1ccccc1)C1CCOCC1	ZINC000819349000	EC	On-Demand	Anodyne	ADRB1	96	48
O=S(=O)(CCNC[C@H](O)COc1ccccc1)C1CCOCC1	ZINC000819349000	EC	On-Demand	Anodyne	ADRB3	66	48
O=S(=O)(CCNC[C@H](O)COc1ccccc1)C1CCOCC1	ZINC000819349000	EC	On-Demand	Anodyne	ABCB1	15	43
C=C[C@@H]1OCC[C@H]1NC[C@H](O)c1cccnc1	ZINC000819349004	BD	On-Demand	Mild	ADRB3	53	43
C=C[C@@H]1OCC[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819349006	BD	On-Demand	Mild	ADRB3	53	43
CS(=O)(=O)c1cccc(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819349007	FF	On-Demand	Anodyne	CACNA1B	41	33
O=S(=O)(CCNC[C@@H](O)COc1ccccc1)C1CCOCC1	ZINC000819349008	EC	On-Demand	Anodyne	ADRB2	57	48
O=S(=O)(CCNC[C@@H](O)COc1ccccc1)C1CCOCC1	ZINC000819349008	EC	On-Demand	Anodyne	ADRB1	96	48
O=S(=O)(CCNC[C@@H](O)COc1ccccc1)C1CCOCC1	ZINC000819349008	EC	On-Demand	Anodyne	ADRB3	66	48
O=S(=O)(CCNC[C@@H](O)COc1ccccc1)C1CCOCC1	ZINC000819349008	EC	On-Demand	Anodyne	ABCB1	15	43
CS(=O)(=O)c1cccc(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819349010	FF	On-Demand	Anodyne	CACNA1B	41	33
O[C@@H](CN[C@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1)c1ccccc1	ZINC000819349018	FG	On-Demand	Anodyne	ADRB3	19	40
O[C@H](CN[C@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1)c1ccccc1	ZINC000819349019	FG	On-Demand	Anodyne	ADRB3	19	40
O[C@H](CN[C@@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1)c1ccccc1	ZINC000819349023	FG	On-Demand	Anodyne	ADRB3	19	40
O[C@@H](CN[C@@H]1CCc2nc(-c3ccc(F)cc3F)cn2C1)c1ccccc1	ZINC000819349025	FG	On-Demand	Anodyne	ADRB3	19	40
O[C@H](CNCC1(N2CCN(c3ccccc3)CC2)CCOCC1)c1ccccc1	ZINC000819349035	GF	On-Demand	Anodyne	HCN1	45	42
CCN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CC1=O	ZINC000819349038	GD	On-Demand	Anodyne	CTSD	118	46
CCN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CC1=O	ZINC000819349038	GD	On-Demand	Anodyne	PGC	62	38
CCN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CC1=O	ZINC000819349038	GD	On-Demand	Anodyne	PAPA1_CARPA	38	42
CCN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CC1=O	ZINC000819349038	GD	On-Demand	Anodyne	CCKAR	23	40
CCN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CC1=O	ZINC000819349038	GD	On-Demand	Anodyne	CTSK	17	44
CCN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CC1=O	ZINC000819349038	GD	On-Demand	Anodyne	CTSL	18	42
CCN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CC1=O	ZINC000819349038	GD	On-Demand	Anodyne	BACE2	60	44
CCN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CC1=O	ZINC000819349038	GD	On-Demand	Anodyne	REN	99	46
CCN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CC1=O	ZINC000819349038	GD	On-Demand	Anodyne	REN1	23	43
CCN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CC1=O	ZINC000819349038	GD	On-Demand	Anodyne	BACE1	100	46
CCN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CC1=O	ZINC000819349038	GD	On-Demand	Anodyne	FPR1	49	39
CCN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CC1=O	ZINC000819349038	GD	On-Demand	Anodyne	CTRB_BOVIN	55	41
CCN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CC1=O	ZINC000819349038	GD	On-Demand	Anodyne	PLM1_PLAFA	33	42
CCN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CC1=O	ZINC000819349038	GD	On-Demand	Anodyne	PLM2_PLAFA	46	35
CCN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CC1=O	ZINC000819349038	GD	On-Demand	Anodyne	GAG-PRO	65	31
CCN1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CC1=O	ZINC000819349038	GD	On-Demand	Anodyne	Q82323_9DELA	62	30
O[C@@H](CNC[C@@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819349051	CG	On-Demand	Anodyne	ADRB1	34	43
O[C@@H](CNC[C@@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819349051	CG	On-Demand	Anodyne	ADRB3	47	44
O[C@H](CNC[C@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819349053	CG	On-Demand	Anodyne	ADRB1	34	43
O[C@H](CNC[C@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819349053	CG	On-Demand	Anodyne	ADRB3	47	44
O[C@H](CNC[C@@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819349056	CG	On-Demand	Anodyne	ADRB1	34	43
O[C@H](CNC[C@@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819349056	CG	On-Demand	Anodyne	ADRB3	47	44
O[C@@H](CNC[C@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819349059	CG	On-Demand	Anodyne	ADRB1	34	43
O[C@@H](CNC[C@H]1CCCC1(F)F)c1cccc(Cl)c1	ZINC000819349059	CG	On-Demand	Anodyne	ADRB3	47	44
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819349072	EE	On-Demand	Mild	ADRB2	37	46
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819349072	EE	On-Demand	Mild	ADRB1	62	46
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819349072	EE	On-Demand	Mild	ADRB3	36	45
C#CCOc1ccc(CNC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819349077	EE	On-Demand	Mild	ADRB2	37	46
C#CCOc1ccc(CNC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819349077	EE	On-Demand	Mild	ADRB1	62	46
C#CCOc1ccc(CNC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819349077	EE	On-Demand	Mild	ADRB3	36	45
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cc(C)cc(C)c3)CC2)cc1	ZINC000819349080	GH	On-Demand	Anodyne	DRD4	24	42
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cc(C)cc(C)c3)CC2)cc1	ZINC000819349080	GH	On-Demand	Anodyne	ADRB3	30	40
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cc(C)cc(C)c3)CC2)cc1	ZINC000819349080	GH	On-Demand	Anodyne	SIGMAR1	23	44
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cc(C)cc(C)c3)CC2)cc1	ZINC000819349080	GH	On-Demand	Anodyne	SSTR5	51	41
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cc(C)cc(C)c3)CC2)cc1	ZINC000819349080	GH	On-Demand	Anodyne	CCR3	33	43
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cc(C)cc(C)c3)CC2)cc1	ZINC000819349080	GH	On-Demand	Anodyne	MCHR1	47	39
O[C@@H](CNCC1(CF)CCOCC1)c1cccc(Cl)c1	ZINC000819349084	DF	On-Demand	Anodyne	ADRB1	26	40
O[C@@H](CNCC1(CF)CCOCC1)c1cccc(Cl)c1	ZINC000819349084	DF	On-Demand	Anodyne	ADRB3	39	40
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cc(C)cc(C)c3)CC2)cc1	ZINC000819349085	GH	On-Demand	Anodyne	DRD4	24	42
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cc(C)cc(C)c3)CC2)cc1	ZINC000819349085	GH	On-Demand	Anodyne	ADRB3	30	40
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cc(C)cc(C)c3)CC2)cc1	ZINC000819349085	GH	On-Demand	Anodyne	SIGMAR1	23	44
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cc(C)cc(C)c3)CC2)cc1	ZINC000819349085	GH	On-Demand	Anodyne	SSTR5	51	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cc(C)cc(C)c3)CC2)cc1	ZINC000819349085	GH	On-Demand	Anodyne	CCR3	33	43
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cc(C)cc(C)c3)CC2)cc1	ZINC000819349085	GH	On-Demand	Anodyne	MCHR1	47	39
O[C@H](CNCC1(CF)CCOCC1)c1cccc(Cl)c1	ZINC000819349086	DF	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CNCC1(CF)CCOCC1)c1cccc(Cl)c1	ZINC000819349086	DF	On-Demand	Anodyne	ADRB3	39	40
Cc1ccccc1[C@@H](O)CNCCc1ncccc1C	ZINC000819349101	CF	On-Demand	Anodyne	ADRB1	28	44
Cc1ccccc1[C@@H](O)CNCCc1ncccc1C	ZINC000819349101	CF	On-Demand	Anodyne	ADRB3	42	44
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(C)cc2)cc1	ZINC000819349110	EF	On-Demand	Mild	ADRB2	50	56
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(C)cc2)cc1	ZINC000819349110	EF	On-Demand	Mild	ADRB1	66	50
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(C)cc2)cc1	ZINC000819349110	EF	On-Demand	Mild	ADRB3	41	46
C#CCOc1ccc(CNC[C@H](O)COc2ccc(C)cc2)cc1	ZINC000819349112	EF	On-Demand	Mild	ADRB2	50	56
C#CCOc1ccc(CNC[C@H](O)COc2ccc(C)cc2)cc1	ZINC000819349112	EF	On-Demand	Mild	ADRB1	66	50
C#CCOc1ccc(CNC[C@H](O)COc2ccc(C)cc2)cc1	ZINC000819349112	EF	On-Demand	Mild	ADRB3	41	46
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(C)cc3)CC2)cc1	ZINC000819349114	GG	On-Demand	Anodyne	ADRB1	16	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(C)cc3)CC2)cc1	ZINC000819349114	GG	On-Demand	Anodyne	DRD4	22	44
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(C)cc3)CC2)cc1	ZINC000819349114	GG	On-Demand	Anodyne	ADRB3	31	44
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(C)cc3)CC2)cc1	ZINC000819349114	GG	On-Demand	Anodyne	LTA4H	17	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(C)cc3)CC2)cc1	ZINC000819349114	GG	On-Demand	Anodyne	SIGMAR1	24	45
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(C)cc3)CC2)cc1	ZINC000819349114	GG	On-Demand	Anodyne	CCR3	21	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(C)cc3)CC2)cc1	ZINC000819349114	GG	On-Demand	Anodyne	MLNR	33	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(C)cc3)CC2)cc1	ZINC000819349114	GG	On-Demand	Anodyne	MCHR1	42	44
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(C)cc3)CC2)cc1	ZINC000819349116	GG	On-Demand	Anodyne	ADRB1	16	41
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(C)cc3)CC2)cc1	ZINC000819349116	GG	On-Demand	Anodyne	DRD4	22	44
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(C)cc3)CC2)cc1	ZINC000819349116	GG	On-Demand	Anodyne	ADRB3	31	44
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(C)cc3)CC2)cc1	ZINC000819349116	GG	On-Demand	Anodyne	LTA4H	17	41
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(C)cc3)CC2)cc1	ZINC000819349116	GG	On-Demand	Anodyne	SIGMAR1	24	45
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(C)cc3)CC2)cc1	ZINC000819349116	GG	On-Demand	Anodyne	CCR3	21	41
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(C)cc3)CC2)cc1	ZINC000819349116	GG	On-Demand	Anodyne	MLNR	33	41
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(C)cc3)CC2)cc1	ZINC000819349116	GG	On-Demand	Anodyne	MCHR1	42	44
C#CCOc1ccc(CNC[C@@H](O)COc2ccccc2C)cc1	ZINC000819349118	EF	On-Demand	Mild	ADRB2	52	56
C#CCOc1ccc(CNC[C@@H](O)COc2ccccc2C)cc1	ZINC000819349118	EF	On-Demand	Mild	ADRB1	71	57
C#CCOc1ccc(CNC[C@@H](O)COc2ccccc2C)cc1	ZINC000819349118	EF	On-Demand	Mild	CYP2D6	17	40
C#CCOc1ccc(CNC[C@H](O)COc2ccccc2C)cc1	ZINC000819349120	EF	On-Demand	Mild	ADRB2	52	56
C#CCOc1ccc(CNC[C@H](O)COc2ccccc2C)cc1	ZINC000819349120	EF	On-Demand	Mild	ADRB1	71	57
C#CCOc1ccc(CNC[C@H](O)COc2ccccc2C)cc1	ZINC000819349120	EF	On-Demand	Mild	CYP2D6	17	40
C[C@H](O)CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349121	DD	On-Demand	Mild	PAPA1_CARPA	44	48
C[C@H](O)CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349121	DD	On-Demand	Mild	CTSK	18	48
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccnc3)CC2)cc1	ZINC000819349122	FE	On-Demand	Anodyne	ADRB2	28	44
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccnc3)CC2)cc1	ZINC000819349122	FE	On-Demand	Anodyne	ADRB1	38	43
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccnc3)CC2)cc1	ZINC000819349122	FE	On-Demand	Anodyne	DRD4	17	42
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccnc3)CC2)cc1	ZINC000819349122	FE	On-Demand	Anodyne	ADRB3	122	51
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccnc3)CC2)cc1	ZINC000819349122	FE	On-Demand	Anodyne	LTA4H	22	42
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccnc3)CC2)cc1	ZINC000819349122	FE	On-Demand	Anodyne	SIGMAR1	24	43
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccnc3)CC2)cc1	ZINC000819349122	FE	On-Demand	Anodyne	SSTR5	54	39
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccnc3)CC2)cc1	ZINC000819349122	FE	On-Demand	Anodyne	CCR3	22	42
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccnc3)CC2)cc1	ZINC000819349122	FE	On-Demand	Anodyne	CHRNA7	42	37
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccnc3)CC2)cc1	ZINC000819349122	FE	On-Demand	Anodyne	MCHR1	36	41
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3cccnc3)CC2)cc1	ZINC000819349122	FE	On-Demand	Anodyne	NAMPT	41	36
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccnc3)CC2)cc1	ZINC000819349123	FE	On-Demand	Anodyne	ADRB2	28	44
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccnc3)CC2)cc1	ZINC000819349123	FE	On-Demand	Anodyne	ADRB1	38	43
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccnc3)CC2)cc1	ZINC000819349123	FE	On-Demand	Anodyne	DRD4	17	42
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccnc3)CC2)cc1	ZINC000819349123	FE	On-Demand	Anodyne	ADRB3	122	51
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccnc3)CC2)cc1	ZINC000819349123	FE	On-Demand	Anodyne	LTA4H	22	42
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccnc3)CC2)cc1	ZINC000819349123	FE	On-Demand	Anodyne	SIGMAR1	24	43
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccnc3)CC2)cc1	ZINC000819349123	FE	On-Demand	Anodyne	SSTR5	54	39
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccnc3)CC2)cc1	ZINC000819349123	FE	On-Demand	Anodyne	CCR3	22	42
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccnc3)CC2)cc1	ZINC000819349123	FE	On-Demand	Anodyne	CHRNA7	42	37
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccnc3)CC2)cc1	ZINC000819349123	FE	On-Demand	Anodyne	MCHR1	36	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3cccnc3)CC2)cc1	ZINC000819349123	FE	On-Demand	Anodyne	NAMPT	41	36
C[C@H](O)CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349124	DD	On-Demand	Mild	PAPA1_CARPA	44	48
C[C@H](O)CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349124	DD	On-Demand	Mild	CTSK	18	48
C#CCOc1ccc(CNC[C@@H](O)CC2CCCC2)cc1	ZINC000819349142	CF	On-Demand	Mild	ADRB2	16	40
C#CCOc1ccc(CNC[C@@H](O)CC2CCCC2)cc1	ZINC000819349142	CF	On-Demand	Mild	ADRB1	36	43
C#CCOc1ccc(CNC[C@H](O)CC2CCCC2)cc1	ZINC000819349143	CF	On-Demand	Mild	ADRB2	16	40
C#CCOc1ccc(CNC[C@H](O)CC2CCCC2)cc1	ZINC000819349143	CF	On-Demand	Mild	ADRB1	36	43
Cn1cccc1[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349167	GH	On-Demand	Mild	PLG	20	41
Cn1cccc1[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349167	GH	On-Demand	Mild	CELA1	18	40
Cn1cccc1[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349167	GH	On-Demand	Mild	LGMN	47	33
Cn1cccc1[C@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349168	GH	On-Demand	Mild	PLG	20	41
Cn1cccc1[C@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349168	GH	On-Demand	Mild	CELA1	18	40
Cn1cccc1[C@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349168	GH	On-Demand	Mild	LGMN	47	33
Cn1cccc1[C@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349169	GH	On-Demand	Mild	PLG	20	41
Cn1cccc1[C@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349169	GH	On-Demand	Mild	CELA1	18	40
Cn1cccc1[C@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349169	GH	On-Demand	Mild	LGMN	47	33
Cn1cccc1[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349171	GH	On-Demand	Mild	PLG	20	41
Cn1cccc1[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349171	GH	On-Demand	Mild	CELA1	18	40
Cn1cccc1[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349171	GH	On-Demand	Mild	LGMN	47	33
Cc1ccncc1CNC[C@H](O)c1ccc(F)cc1Cl	ZINC000819349183	CG	On-Demand	Anodyne	P2RX7	23	41
Cc1ccncc1CNC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819349184	CG	On-Demand	Anodyne	P2RX7	23	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000819349196	GF	On-Demand	Mild	ADRB3	20	45
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000819349196	GF	On-Demand	Mild	CCR3	23	53
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000819349196	GF	On-Demand	Mild	MLNR	35	46
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000819349196	GF	On-Demand	Mild	MCHR1	28	43
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000819349201	GF	On-Demand	Mild	ADRB3	20	45
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000819349201	GF	On-Demand	Mild	CCR3	23	53
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000819349201	GF	On-Demand	Mild	MLNR	35	46
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000819349201	GF	On-Demand	Mild	MCHR1	28	43
C#CCOc1ccc(CNC[C@H](O)COc2ccccc2F)cc1	ZINC000819349202	EE	On-Demand	Mild	ADRB2	43	40
C#CCOc1ccc(CNC[C@H](O)COc2ccccc2F)cc1	ZINC000819349202	EE	On-Demand	Mild	ADRB1	65	40
C#CCOc1ccc(CNC[C@H](O)COc2ccccc2F)cc1	ZINC000819349202	EE	On-Demand	Mild	ADRB3	35	40
C#CCOc1ccc(CNC[C@@H](O)COc2ccccc2F)cc1	ZINC000819349204	EE	On-Demand	Mild	ADRB2	43	40
C#CCOc1ccc(CNC[C@@H](O)COc2ccccc2F)cc1	ZINC000819349204	EE	On-Demand	Mild	ADRB1	65	40
C#CCOc1ccc(CNC[C@@H](O)COc2ccccc2F)cc1	ZINC000819349204	EE	On-Demand	Mild	ADRB3	35	40
C#CCOc1ccc(CNCCC(=O)Nc2ccc(N(C)C)cc2)cc1	ZINC000819349213	FF	On-Demand	Mild	LTA4H	31	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](Cc3ccccc3)[C@@H]1C)C2	ZINC000819349226	FG	On-Demand	Anodyne	SLC6A3	21	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](Cc3ccccc3)[C@H]1C)C2	ZINC000819349229	FG	On-Demand	Anodyne	SLC6A3	21	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](Cc3ccccc3)[C@@H]1C)C2	ZINC000819349231	FG	On-Demand	Anodyne	SLC6A3	21	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](Cc3ccccc3)[C@H]1C)C2	ZINC000819349235	FG	On-Demand	Anodyne	SLC6A3	21	43
COC(=O)c1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819349239	FE	On-Demand	Anodyne	ADRB2	47	46
COC(=O)c1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819349239	FE	On-Demand	Anodyne	ADRB1	73	46
COC(=O)c1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819349239	FE	On-Demand	Anodyne	ADRB3	48	46
COC(=O)c1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819349241	FE	On-Demand	Anodyne	ADRB2	47	46
COC(=O)c1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819349241	FE	On-Demand	Anodyne	ADRB1	73	46
COC(=O)c1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819349241	FE	On-Demand	Anodyne	ADRB3	48	46
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819349243	FE	On-Demand	Anodyne	ADRB2	47	46
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819349243	FE	On-Demand	Anodyne	ADRB1	73	46
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819349243	FE	On-Demand	Anodyne	ADRB3	48	46
COC(=O)c1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819349246	FE	On-Demand	Anodyne	ADRB2	47	46
COC(=O)c1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819349246	FE	On-Demand	Anodyne	ADRB1	73	46
COC(=O)c1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819349246	FE	On-Demand	Anodyne	ADRB3	48	46
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(-c2cccnc2)cc1	ZINC000819349256	DH	On-Demand	Anodyne	KCNQ2	49	36
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(-c2cccnc2)cc1	ZINC000819349257	DH	On-Demand	Anodyne	KCNQ2	49	36
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(-c2cccnc2)cc1	ZINC000819349258	DH	On-Demand	Anodyne	KCNQ2	49	36
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(-c2cccnc2)cc1	ZINC000819349259	DH	On-Demand	Anodyne	KCNQ2	49	36
O[C@@H](CNCC1(N2CCN(c3ccccc3)CC2)CCOCC1)c1ccccc1	ZINC000819349282	GF	On-Demand	Anodyne	HCN1	45	42
C[C@]1(CNCCC(=O)Nc2ccccc2)CC1(Cl)Cl	ZINC000819349297	DG	On-Demand	Anodyne	HDAC10	16	43
C[C@]1(CNCCC(=O)Nc2ccccc2)CC1(Cl)Cl	ZINC000819349297	DG	On-Demand	Anodyne	HDAC3	16	43
CSc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819349298	GD	On-Demand	Anodyne	ADRB2	40	45
CSc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819349298	GD	On-Demand	Anodyne	ADRB1	69	45
CSc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819349298	GD	On-Demand	Anodyne	ADRB3	46	41
C[C@@]1(CNCCC(=O)Nc2ccccc2)CC1(Cl)Cl	ZINC000819349299	DG	On-Demand	Anodyne	HDAC10	16	43
C[C@@]1(CNCCC(=O)Nc2ccccc2)CC1(Cl)Cl	ZINC000819349299	DG	On-Demand	Anodyne	HDAC3	16	43
CCOC(=O)c1cc(NC(=O)/C=C\c2cnn(C)c2)ccc1O	ZINC000819349300	DD	On-Demand	Anodyne	MCHR1	16	40
CSc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819349303	GD	On-Demand	Anodyne	ADRB2	40	45
CSc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819349303	GD	On-Demand	Anodyne	ADRB1	69	45
CSc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819349303	GD	On-Demand	Anodyne	ADRB3	46	41
CCOC(=O)c1cc(NC(=O)/C=C/c2cnn(C)c2)ccc1O	ZINC000819349304	DD	On-Demand	Anodyne	MCHR1	16	40
CC(=O)c1cccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)c1	ZINC000819349322	FG	On-Demand	Anodyne	ADRB2	40	49
CC(=O)c1cccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)c1	ZINC000819349322	FG	On-Demand	Anodyne	ADRB1	77	41
CC(=O)c1cccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)c1	ZINC000819349322	FG	On-Demand	Anodyne	ADRB3	48	41
CC(=O)c1cccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)c1	ZINC000819349322	FG	On-Demand	Anodyne	ABCB1	21	47
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)c1	ZINC000819349326	FG	On-Demand	Anodyne	ADRB2	40	49
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)c1	ZINC000819349326	FG	On-Demand	Anodyne	ADRB1	77	41
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)c1	ZINC000819349326	FG	On-Demand	Anodyne	ADRB3	48	41
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)c1	ZINC000819349326	FG	On-Demand	Anodyne	ABCB1	21	47
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)c1	ZINC000819349330	FG	On-Demand	Anodyne	ADRB2	40	49
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)c1	ZINC000819349330	FG	On-Demand	Anodyne	ADRB1	77	41
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)c1	ZINC000819349330	FG	On-Demand	Anodyne	ADRB3	48	41
CC(=O)c1cccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)c1	ZINC000819349330	FG	On-Demand	Anodyne	ABCB1	21	47
CC(=O)c1cccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)c1	ZINC000819349333	FG	On-Demand	Anodyne	ADRB2	40	49
CC(=O)c1cccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)c1	ZINC000819349333	FG	On-Demand	Anodyne	ADRB1	77	41
CC(=O)c1cccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)c1	ZINC000819349333	FG	On-Demand	Anodyne	ADRB3	48	41
CC(=O)c1cccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)c1	ZINC000819349333	FG	On-Demand	Anodyne	ABCB1	21	47
O[C@@H](CNC[C@H]1CCOC2(CCC2)C1)c1cccc(Cl)c1	ZINC000819349349	DG	On-Demand	Anodyne	ADRB3	39	42
O[C@@H](CNC[C@@H]1CCOC2(CCC2)C1)c1cccc(Cl)c1	ZINC000819349354	DG	On-Demand	Anodyne	ADRB3	39	42
O[C@H](CNC[C@@H]1CCOC2(CCC2)C1)c1cccc(Cl)c1	ZINC000819349358	DG	On-Demand	Anodyne	ADRB3	39	42
O[C@H](CNC[C@H]1CCOC2(CCC2)C1)c1cccc(Cl)c1	ZINC000819349365	DG	On-Demand	Anodyne	ADRB3	39	42
CCOC[C@H]1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819349410	FE	On-Demand	Mild	PAPA1_CARPA	34	46
O=C(CCNCCS(=O)(=O)C1CCOCC1)Nc1cccnc1	ZINC000819349411	EC	On-Demand	Anodyne	NAMPT	42	43
C#CCOc1ccc(CNC[C@@H](O)CCOC(C)C)cc1	ZINC000819349416	CD	On-Demand	Mild	ADRB1	15	40
CCOC[C@H]1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819349418	FE	On-Demand	Mild	PAPA1_CARPA	34	46
C#CCOc1ccc(CNC[C@H](O)CCOC(C)C)cc1	ZINC000819349419	CD	On-Demand	Mild	ADRB1	15	40
C#CCOc1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819349434	EF	On-Demand	Mild	ADRB2	47	47
C#CCOc1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819349434	EF	On-Demand	Mild	ADRB1	72	43
C#CCOc1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819349434	EF	On-Demand	Mild	ADRB3	38	43
C#CCOc1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819349434	EF	On-Demand	Mild	CASR	31	40
C#CCOc1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819349437	EF	On-Demand	Mild	ADRB2	47	47
C#CCOc1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819349437	EF	On-Demand	Mild	ADRB1	72	43
C#CCOc1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819349437	EF	On-Demand	Mild	ADRB3	38	43
C#CCOc1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819349437	EF	On-Demand	Mild	CASR	31	40
CC(=O)CCCCCCC(=O)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819349467	HK	On-Demand	Anodyne	CPT1A	40	33
CC(=O)CCCCCCC(=O)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819349467	HK	On-Demand	Anodyne	PREP	59	45
CC(=O)CCCCCCC(=O)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819349483	HK	On-Demand	Anodyne	CPT1A	40	33
CC(=O)CCCCCCC(=O)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819349483	HK	On-Demand	Anodyne	PREP	59	45
C=C(Cl)CSc1nc(C)c(CC(=O)Nc2nc(C)ccc2OC)s1	ZINC000819349537	GI	On-Demand	Mild	ENPP1	61	31
Cc1cc(OCC(=O)N2CCCC[C@H]2Cc2ccccc2Br)no1	ZINC000819349549	GH	On-Demand	Anodyne	CPT1A	130	47
Cc1cc(OCC(=O)N2CCCC[C@H]2Cc2ccccc2Br)no1	ZINC000819349549	GH	On-Demand	Anodyne	CPT2	47	38
Cc1cc(OCC(=O)N2CCCC[C@@H]2Cc2ccccc2Br)no1	ZINC000819349554	GH	On-Demand	Anodyne	CPT1A	130	47
Cc1cc(OCC(=O)N2CCCC[C@@H]2Cc2ccccc2Br)no1	ZINC000819349554	GH	On-Demand	Anodyne	CPT2	47	38
N#Cc1ccc(C(=O)N2CCCC[C@H]2Cc2ccccc2Br)o1	ZINC000819349611	FI	On-Demand	Mild	CSF1R	16	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@H]2CCCC2(F)F)CC1	ZINC000819349614	FG	On-Demand	Anodyne	GPR119	27	42
N#Cc1ccc(C(=O)N2CCCC[C@@H]2Cc2ccccc2Br)o1	ZINC000819349615	FI	On-Demand	Mild	CSF1R	16	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H]2CCCC2(F)F)CC1	ZINC000819349616	FG	On-Demand	Anodyne	GPR119	27	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2CCCC2(F)F)CC1	ZINC000819349618	FG	On-Demand	Anodyne	GPR119	27	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2CCCC2(F)F)CC1	ZINC000819349620	FG	On-Demand	Anodyne	GPR119	27	42
CCOC(=O)c1cc(NC(=O)/C(C#N)=C/c2cc(C)n([C@H](C)COC)c2C)ccc1O	ZINC000819349635	IH	On-Demand	Reactive	CA12	15	41
CCOC(=O)c1cc(NC(=O)/C(C#N)=C\c2cc(C)n([C@@H](C)COC)c2C)ccc1O	ZINC000819349636	IH	On-Demand	Reactive	CA12	15	41
CCOC(=O)c1cc(NC(=O)/C(C#N)=C\c2cc(C)n([C@H](C)COC)c2C)ccc1O	ZINC000819349637	IH	On-Demand	Reactive	CA12	15	41
CCOC(=O)c1cc(NC(=O)/C(C#N)=C/c2cc(C)n([C@@H](C)COC)c2C)ccc1O	ZINC000819349638	IH	On-Demand	Reactive	CA12	15	41
COc1cccc(OC)c1OC[C@H](O)CNC[C@]1(C)CC1(Cl)Cl	ZINC000819349660	FF	On-Demand	Anodyne	ADRB2	27	43
COc1cccc(OC)c1OC[C@H](O)CNC[C@]1(C)CC1(Cl)Cl	ZINC000819349660	FF	On-Demand	Anodyne	ADRB1	33	44
COc1cccc(OC)c1OC[C@H](O)CNC[C@@]1(C)CC1(Cl)Cl	ZINC000819349661	FF	On-Demand	Anodyne	ADRB2	27	43
COc1cccc(OC)c1OC[C@H](O)CNC[C@@]1(C)CC1(Cl)Cl	ZINC000819349661	FF	On-Demand	Anodyne	ADRB1	33	44
COc1cccc(OC)c1OC[C@@H](O)CNC[C@]1(C)CC1(Cl)Cl	ZINC000819349662	FF	On-Demand	Anodyne	ADRB2	27	43
COc1cccc(OC)c1OC[C@@H](O)CNC[C@]1(C)CC1(Cl)Cl	ZINC000819349662	FF	On-Demand	Anodyne	ADRB1	33	44
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@]1(C)CC1(Cl)Cl	ZINC000819349663	FF	On-Demand	Anodyne	ADRB2	27	43
COc1cccc(OC)c1OC[C@@H](O)CNC[C@@]1(C)CC1(Cl)Cl	ZINC000819349663	FF	On-Demand	Anodyne	ADRB1	33	44
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819349688	GG	On-Demand	Anodyne	GPR119	30	46
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819349691	GG	On-Demand	Anodyne	GPR119	30	46
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819349693	GG	On-Demand	Anodyne	GPR119	30	46
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819349695	GG	On-Demand	Anodyne	GPR119	30	46
COC[C@@H](CNC[C@H](O)c1cc(OC)ccc1OC)c1ccc(Cl)cc1	ZINC000819349696	GG	On-Demand	Anodyne	ADRB1	16	40
COC[C@@H](CNC[C@H](O)c1cc(OC)ccc1OC)c1ccc(Cl)cc1	ZINC000819349696	GG	On-Demand	Anodyne	ADRB3	20	40
COC[C@@H](CNC[C@@H](O)c1cc(OC)ccc1OC)c1ccc(Cl)cc1	ZINC000819349697	GG	On-Demand	Anodyne	ADRB1	16	40
COC[C@@H](CNC[C@@H](O)c1cc(OC)ccc1OC)c1ccc(Cl)cc1	ZINC000819349697	GG	On-Demand	Anodyne	ADRB3	20	40
CS(=O)(=O)c1cccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819349698	FD	On-Demand	Bother	ADRB3	42	37
CS(=O)(=O)c1cccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819349699	FD	On-Demand	Bother	ADRB3	42	37
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(Cl)c(F)c2)cc1	ZINC000819349733	GF	On-Demand	Anodyne	ADRB2	29	41
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(Cl)c(F)c2)cc1	ZINC000819349733	GF	On-Demand	Anodyne	ADRB1	36	40
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(Cl)c(F)c2)cc1	ZINC000819349733	GF	On-Demand	Anodyne	GRIN1	17	45
CS(=O)(=O)c1ccc([C@@H](O)CNCCOc2ccc(Cl)c(F)c2)cc1	ZINC000819349733	GF	On-Demand	Anodyne	ADRB3	59	40
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(Cl)c(F)c2)cc1	ZINC000819349736	GF	On-Demand	Anodyne	ADRB2	29	41
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(Cl)c(F)c2)cc1	ZINC000819349736	GF	On-Demand	Anodyne	ADRB1	36	40
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(Cl)c(F)c2)cc1	ZINC000819349736	GF	On-Demand	Anodyne	GRIN1	17	45
CS(=O)(=O)c1ccc([C@H](O)CNCCOc2ccc(Cl)c(F)c2)cc1	ZINC000819349736	GF	On-Demand	Anodyne	ADRB3	59	40
C[C@H]1c2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349761	FH	On-Demand	Mild	GHRHR	40	32
C[C@H]1c2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349761	FH	On-Demand	Mild	PAPA1_CARPA	40	44
C[C@H]1c2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349761	FH	On-Demand	Mild	FPR1	42	35
C[C@H]1c2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349762	FH	On-Demand	Mild	GHRHR	40	32
C[C@H]1c2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349762	FH	On-Demand	Mild	PAPA1_CARPA	40	44
C[C@H]1c2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819349762	FH	On-Demand	Mild	FPR1	42	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCOCc1ccccc1	ZINC000819349778	EE	On-Demand	Anodyne	FPR1	43	37
CC(C)(C)OC(=O)N1CC[C@H](c2ccc(F)cc2)[C@H](CNCCC(N)=O)C1	ZINC000819349788	GF	On-Demand	Anodyne	GPR119	38	42
C[C@]1(CNCCC(=O)Nc2cccnc2)CC1(Cl)Cl	ZINC000819349815	DF	On-Demand	Anodyne	NAMPT	28	40
O[C@H](CNCC1(CF)CCOCC1)c1cccnc1	ZINC000819349829	CD	On-Demand	Anodyne	ADRB2	19	42
O[C@H](CNCC1(CF)CCOCC1)c1cccnc1	ZINC000819349829	CD	On-Demand	Anodyne	ADRB1	21	42
O[C@H](CNCC1(CF)CCOCC1)c1cccnc1	ZINC000819349829	CD	On-Demand	Anodyne	ADRB3	82	44
O[C@@H](CNCC1(CF)CCOCC1)c1cccnc1	ZINC000819349830	CD	On-Demand	Anodyne	ADRB2	19	42
O[C@@H](CNCC1(CF)CCOCC1)c1cccnc1	ZINC000819349830	CD	On-Demand	Anodyne	ADRB1	21	42
O[C@@H](CNCC1(CF)CCOCC1)c1cccnc1	ZINC000819349830	CD	On-Demand	Anodyne	ADRB3	82	44
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819349871	FG	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819349873	FG	On-Demand	Anodyne	GPR119	29	41
Cc1ccc(F)c(CCNC[C@H](O)c2cccnc2)c1	ZINC000819349891	CE	On-Demand	Anodyne	ADRB2	44	46
Cc1ccc(F)c(CCNC[C@H](O)c2cccnc2)c1	ZINC000819349891	CE	On-Demand	Anodyne	ADRB1	50	56
Cc1ccc(F)c(CCNC[C@H](O)c2cccnc2)c1	ZINC000819349891	CE	On-Demand	Anodyne	ADRB3	138	56
Cc1ccc(F)c(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819349892	CE	On-Demand	Anodyne	ADRB2	44	46
Cc1ccc(F)c(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819349892	CE	On-Demand	Anodyne	ADRB1	50	56
Cc1ccc(F)c(CCNC[C@@H](O)c2cccnc2)c1	ZINC000819349892	CE	On-Demand	Anodyne	ADRB3	138	56
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)C(=O)OC2CCCC2)c1	ZINC000819349899	EE	On-Demand	Anodyne	TSHR	41	31
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)C(=O)OC2CCCC2)c1	ZINC000819349899	EE	On-Demand	Anodyne	TIMP3	70	34
CCOC(=O)c1cc(NC(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)C2)ccc1O	ZINC000819349920	GG	On-Demand	Anodyne	EPHX2	17	41
CCOC(=O)c1cc(NC(=O)C[C@@H]2CCN(C(=O)OC(C)(C)C)C2)ccc1O	ZINC000819349920	GG	On-Demand	Anodyne	GPR119	35	40
C#CCCCCCC(=O)Nc1ccc(O)c(C(=O)OCC)c1	ZINC000819349950	DG	On-Demand	Mild	HDAC10	17	40
C#CCCCCCC(=O)Nc1ccc(O)c(C(=O)OCC)c1	ZINC000819349950	DG	On-Demand	Mild	HDAC3	26	41
CCOC(=O)c1cc(NC(=O)CN2C(=O)CCOc3ccccc32)ccc1O	ZINC000819349971	GE	On-Demand	Anodyne	NR5A1	17	40
CCOC(=O)c1cc(NC(=O)COc2cccc(C#N)c2)ccc1O	ZINC000819350006	EE	On-Demand	Mild	DHODH	18	42
CCOC(=O)c1cc(NC(=O)COc2cccc(C#N)c2)ccc1O	ZINC000819350006	EE	On-Demand	Mild	ACR	15	44
O=C(c1cccnc1Cl)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819350033	GJ	On-Demand	Anodyne	HCRTR1	32	44
O=C(c1cccnc1Cl)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819350033	GJ	On-Demand	Anodyne	HCRTR2	16	44
O=C(c1cccnc1Cl)N1CCCC[C@H]1Cc1ccccc1Br	ZINC000819350033	GJ	On-Demand	Anodyne	G2YM83_BOTF4	45	32
O=C(c1cccnc1Cl)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819350034	GJ	On-Demand	Anodyne	HCRTR1	32	44
O=C(c1cccnc1Cl)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819350034	GJ	On-Demand	Anodyne	HCRTR2	16	44
O=C(c1cccnc1Cl)N1CCCC[C@@H]1Cc1ccccc1Br	ZINC000819350034	GJ	On-Demand	Anodyne	G2YM83_BOTF4	45	32
Cc1nc(CCC(=O)N2CCCC[C@H]2Cc2ccccc2Br)cs1	ZINC000819350036	HJ	On-Demand	Anodyne	CPT1A	46	36
Cc1nc(CCC(=O)N2CCCC[C@@H]2Cc2ccccc2Br)cs1	ZINC000819350037	HJ	On-Demand	Anodyne	CPT1A	46	36
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819350040	FG	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819350041	FG	On-Demand	Anodyne	GPR119	29	41
C[C@@]1(CNCCC(=O)Nc2cccnc2)CC1(Cl)Cl	ZINC000819350051	DF	On-Demand	Anodyne	NAMPT	28	40
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350053	GI	On-Demand	Mild	F2	25	50
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350053	GI	On-Demand	Mild	PRSS1	15	44
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350053	GI	On-Demand	Mild	ACE	46	36
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350053	GI	On-Demand	Mild	GHRHR	42	33
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350053	GI	On-Demand	Mild	CELA1	24	44
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350053	GI	On-Demand	Mild	PGC	55	36
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350053	GI	On-Demand	Mild	CMA1	33	41
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350053	GI	On-Demand	Mild	PAPA1_CARPA	55	47
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350053	GI	On-Demand	Mild	TRY1_BOVIN	45	50
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350053	GI	On-Demand	Mild	CCKAR	39	40
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350053	GI	On-Demand	Mild	CTSK	30	40
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350053	GI	On-Demand	Mild	CTSL	23	47
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350053	GI	On-Demand	Mild	REN	60	37
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350053	GI	On-Demand	Mild	CTSS	19	47
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350053	GI	On-Demand	Mild	FPR1	50	40
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350054	GI	On-Demand	Mild	F2	25	50
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350054	GI	On-Demand	Mild	PRSS1	15	44
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350054	GI	On-Demand	Mild	ACE	46	36
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350054	GI	On-Demand	Mild	GHRHR	42	33
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350054	GI	On-Demand	Mild	CELA1	24	44
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350054	GI	On-Demand	Mild	PGC	55	36
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350054	GI	On-Demand	Mild	CMA1	33	41
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350054	GI	On-Demand	Mild	PAPA1_CARPA	55	47
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350054	GI	On-Demand	Mild	TRY1_BOVIN	45	50
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350054	GI	On-Demand	Mild	CCKAR	39	40
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350054	GI	On-Demand	Mild	CTSK	30	40
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350054	GI	On-Demand	Mild	CTSL	23	47
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350054	GI	On-Demand	Mild	REN	60	37
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350054	GI	On-Demand	Mild	CTSS	19	47
C[C@@H]1[C@@H](Cc2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350054	GI	On-Demand	Mild	FPR1	50	40
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819350074	FG	On-Demand	Anodyne	GPR119	28	45
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819350077	FG	On-Demand	Anodyne	GPR119	28	45
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)c2ccccc2F)C1	ZINC000819350080	FG	On-Demand	Anodyne	GPR119	28	45
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)c2ccccc2F)C1	ZINC000819350084	FG	On-Demand	Anodyne	GPR119	28	45
CCN1CCC[C@@H]1CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350131	FF	On-Demand	Mild	PAPA1_CARPA	29	40
CCN1CCC[C@H]1CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350133	FF	On-Demand	Mild	PAPA1_CARPA	29	40
CCN1CCC[C@@H]1CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350134	FF	On-Demand	Mild	PAPA1_CARPA	29	40
CCN1CCC[C@H]1CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819350136	FF	On-Demand	Mild	PAPA1_CARPA	29	40
O[C@@H](CNC[C@H]1CCCC1(F)F)c1cccnc1	ZINC000819350138	CE	On-Demand	Anodyne	ADRB1	21	41
O[C@@H](CNC[C@H]1CCCC1(F)F)c1cccnc1	ZINC000819350138	CE	On-Demand	Anodyne	ADRB3	89	44
O[C@H](CNC[C@@H]1CCCC1(F)F)c1cccnc1	ZINC000819350140	CE	On-Demand	Anodyne	ADRB1	21	41
O[C@H](CNC[C@@H]1CCCC1(F)F)c1cccnc1	ZINC000819350140	CE	On-Demand	Anodyne	ADRB3	89	44
O[C@@H](CNC[C@@H]1CCCC1(F)F)c1cccnc1	ZINC000819350142	CE	On-Demand	Anodyne	ADRB1	21	41
O[C@@H](CNC[C@@H]1CCCC1(F)F)c1cccnc1	ZINC000819350142	CE	On-Demand	Anodyne	ADRB3	89	44
O[C@H](CNC[C@H]1CCCC1(F)F)c1cccnc1	ZINC000819350143	CE	On-Demand	Anodyne	ADRB1	21	41
O[C@H](CNC[C@H]1CCCC1(F)F)c1cccnc1	ZINC000819350143	CE	On-Demand	Anodyne	ADRB3	89	44
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819350145	FF	On-Demand	Anodyne	GHRHR	74	35
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819350145	FF	On-Demand	Anodyne	PGC	51	34
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819350145	FF	On-Demand	Anodyne	TIMP3	68	33
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819350145	FF	On-Demand	Anodyne	REN	48	35
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819350145	FF	On-Demand	Anodyne	FPR1	46	36
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819350145	FF	On-Demand	Anodyne	GPR119	27	41
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819350147	FF	On-Demand	Anodyne	GHRHR	74	35
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819350147	FF	On-Demand	Anodyne	PGC	51	34
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819350147	FF	On-Demand	Anodyne	TIMP3	68	33
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819350147	FF	On-Demand	Anodyne	REN	48	35
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819350147	FF	On-Demand	Anodyne	FPR1	46	36
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819350147	FF	On-Demand	Anodyne	GPR119	27	41
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819350149	FF	On-Demand	Anodyne	GHRHR	74	35
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819350149	FF	On-Demand	Anodyne	PGC	51	34
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819350149	FF	On-Demand	Anodyne	TIMP3	68	33
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819350149	FF	On-Demand	Anodyne	REN	48	35
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819350149	FF	On-Demand	Anodyne	FPR1	46	36
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)Cc2ccccc2)C1	ZINC000819350149	FF	On-Demand	Anodyne	GPR119	27	41
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819350151	FF	On-Demand	Anodyne	GHRHR	74	35
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819350151	FF	On-Demand	Anodyne	PGC	51	34
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819350151	FF	On-Demand	Anodyne	TIMP3	68	33
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819350151	FF	On-Demand	Anodyne	REN	48	35
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819350151	FF	On-Demand	Anodyne	FPR1	46	36
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)Cc2ccccc2)C1	ZINC000819350151	FF	On-Demand	Anodyne	GPR119	27	41
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2)C(F)(F)C1	ZINC000819350190	FG	On-Demand	Anodyne	GPR119	40	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2)C(F)(F)C1	ZINC000819350190	FG	On-Demand	Anodyne	SFRP1	64	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccccc2)C(F)(F)C1	ZINC000819350190	FG	On-Demand	Anodyne	WNT3	44	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2)C(F)(F)C1	ZINC000819350191	FG	On-Demand	Anodyne	GPR119	40	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2)C(F)(F)C1	ZINC000819350191	FG	On-Demand	Anodyne	SFRP1	64	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccccc2)C(F)(F)C1	ZINC000819350191	FG	On-Demand	Anodyne	WNT3	44	35
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2)C(F)(F)C1	ZINC000819350192	FG	On-Demand	Anodyne	GPR119	40	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2)C(F)(F)C1	ZINC000819350192	FG	On-Demand	Anodyne	SFRP1	64	42
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccccc2)C(F)(F)C1	ZINC000819350192	FG	On-Demand	Anodyne	WNT3	44	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2)C(F)(F)C1	ZINC000819350194	FG	On-Demand	Anodyne	GPR119	40	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2)C(F)(F)C1	ZINC000819350194	FG	On-Demand	Anodyne	SFRP1	64	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccccc2)C(F)(F)C1	ZINC000819350194	FG	On-Demand	Anodyne	WNT3	44	35
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819350223	GF	On-Demand	Mild	CTRB_BOVIN	43	29
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819350223	GF	On-Demand	Mild	GPR119	23	43
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819350226	GF	On-Demand	Mild	CTRB_BOVIN	43	29
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819350226	GF	On-Demand	Mild	GPR119	23	43
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819350228	GF	On-Demand	Mild	CTRB_BOVIN	43	29
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819350228	GF	On-Demand	Mild	GPR119	23	43
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819350230	GF	On-Demand	Mild	CTRB_BOVIN	43	29
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819350230	GF	On-Demand	Mild	GPR119	23	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@@H](O)c2ccc(F)cc2)C(F)(F)C1	ZINC000819350238	GG	On-Demand	Anodyne	GPR119	42	43
C[C@@]1(CNC[C@@H](O)c2ccccc2)CC1(Cl)Cl	ZINC000819350249	CF	On-Demand	Anodyne	AOC3	15	45
C[C@]1(CNC[C@H](O)c2ccccc2)CC1(Cl)Cl	ZINC000819350250	CF	On-Demand	Anodyne	AOC3	15	45
C[C@@]1(CNC[C@H](O)c2ccccc2)CC1(Cl)Cl	ZINC000819350251	CF	On-Demand	Anodyne	AOC3	15	45
C[C@]1(CNC[C@@H](O)c2ccccc2)CC1(Cl)Cl	ZINC000819350252	CF	On-Demand	Anodyne	AOC3	15	45
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@@H](O)c2ccc(F)cc2)C(F)(F)C1	ZINC000819350256	GG	On-Demand	Anodyne	GPR119	42	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC[C@H](O)c2ccc(F)cc2)C(F)(F)C1	ZINC000819350257	GG	On-Demand	Anodyne	GPR119	42	43
CC(C)(C)OC(=O)N1CC[C@H](CNC[C@H](O)c2ccc(F)cc2)C(F)(F)C1	ZINC000819350258	GG	On-Demand	Anodyne	GPR119	42	43
COCC(COC)NC[C@H](O)c1ccccc1C	ZINC000819350272	CD	On-Demand	Anodyne	ADRB2	15	49
COCC(COC)NC[C@@H](O)c1ccccc1C	ZINC000819350276	CD	On-Demand	Anodyne	ADRB2	15	49
CC(=O)c1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350341	FG	On-Demand	Anodyne	ADRB2	45	44
CC(=O)c1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350341	FG	On-Demand	Anodyne	ADRB1	82	44
CC(=O)c1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350341	FG	On-Demand	Anodyne	ADRB3	52	44
CC(=O)c1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350341	FG	On-Demand	Anodyne	ABCB1	15	58
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350342	FG	On-Demand	Anodyne	ADRB2	45	44
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350342	FG	On-Demand	Anodyne	ADRB1	82	44
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350342	FG	On-Demand	Anodyne	ADRB3	52	44
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350342	FG	On-Demand	Anodyne	ABCB1	15	58
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350343	FG	On-Demand	Anodyne	ADRB2	45	44
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350343	FG	On-Demand	Anodyne	ADRB1	82	44
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350343	FG	On-Demand	Anodyne	ADRB3	52	44
CC(=O)c1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350343	FG	On-Demand	Anodyne	ABCB1	15	58
O=C(/C=C/[C@@H]1CCCO1)N1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000819350344	FG	On-Demand	Anodyne	ITGAL	45	31
CC(=O)c1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350345	FG	On-Demand	Anodyne	ADRB2	45	44
CC(=O)c1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350345	FG	On-Demand	Anodyne	ADRB1	82	44
CC(=O)c1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350345	FG	On-Demand	Anodyne	ADRB3	52	44
CC(=O)c1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350345	FG	On-Demand	Anodyne	ABCB1	15	58
O=C(/C=C\[C@@H]1CCCO1)N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000819350347	FG	On-Demand	Anodyne	ITGAL	45	31
O=C(/C=C/[C@@H]1CCCO1)N1CCO[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000819350350	FG	On-Demand	Anodyne	ITGAL	45	31
O=C(/C=C\[C@@H]1CCCO1)N1CCO[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000819350355	FG	On-Demand	Anodyne	ITGAL	45	31
C=C(C)CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819350407	CE	On-Demand	Mild	CACNA1D	40	39
C=C(C)CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819350409	CE	On-Demand	Mild	CACNA1D	40	39
O=S(=O)(CCNC[C@@H](O)COc1ccc2ccccc2c1)C1CCOCC1	ZINC000819350446	GD	On-Demand	Anodyne	ADRB2	50	47
O=S(=O)(CCNC[C@@H](O)COc1ccc2ccccc2c1)C1CCOCC1	ZINC000819350446	GD	On-Demand	Anodyne	ADRB1	78	43
O=S(=O)(CCNC[C@@H](O)COc1ccc2ccccc2c1)C1CCOCC1	ZINC000819350446	GD	On-Demand	Anodyne	ADRB3	53	44
O=S(=O)(CCNC[C@H](O)COc1ccc2ccccc2c1)C1CCOCC1	ZINC000819350447	GD	On-Demand	Anodyne	ADRB2	50	47
O=S(=O)(CCNC[C@H](O)COc1ccc2ccccc2c1)C1CCOCC1	ZINC000819350447	GD	On-Demand	Anodyne	ADRB1	78	43
O=S(=O)(CCNC[C@H](O)COc1ccc2ccccc2c1)C1CCOCC1	ZINC000819350447	GD	On-Demand	Anodyne	ADRB3	53	44
COCCc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350461	FF	On-Demand	Anodyne	ADRB2	43	59
COCCc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350461	FF	On-Demand	Anodyne	ADRB1	72	59
COCCc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350461	FF	On-Demand	Anodyne	GRIN1	18	42
COCCc1ccc(OC[C@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350461	FF	On-Demand	Anodyne	ADRB3	46	48
COCCc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350462	FF	On-Demand	Anodyne	ADRB2	43	59
COCCc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350462	FF	On-Demand	Anodyne	ADRB1	72	59
COCCc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350462	FF	On-Demand	Anodyne	GRIN1	18	42
COCCc1ccc(OC[C@@H](O)CNC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350462	FF	On-Demand	Anodyne	ADRB3	46	48
COCCc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350463	FF	On-Demand	Anodyne	ADRB2	43	59
COCCc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350463	FF	On-Demand	Anodyne	ADRB1	72	59
COCCc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350463	FF	On-Demand	Anodyne	GRIN1	18	42
COCCc1ccc(OC[C@@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350463	FF	On-Demand	Anodyne	ADRB3	46	48
COCCc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350465	FF	On-Demand	Anodyne	ADRB2	43	59
COCCc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350465	FF	On-Demand	Anodyne	ADRB1	72	59
COCCc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350465	FF	On-Demand	Anodyne	GRIN1	18	42
COCCc1ccc(OC[C@H](O)CNC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350465	FF	On-Demand	Anodyne	ADRB3	46	48
Cc1ccncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819350475	GF	On-Demand	Anodyne	CTSD	66	42
Cc1ccncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819350475	GF	On-Demand	Anodyne	PGC	53	37
Cc1ccncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819350475	GF	On-Demand	Anodyne	PAPA1_CARPA	29	42
Cc1ccncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819350475	GF	On-Demand	Anodyne	BACE2	36	41
Cc1ccncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819350475	GF	On-Demand	Anodyne	REN	74	45
Cc1ccncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819350475	GF	On-Demand	Anodyne	REN1	17	43
Cc1ccncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819350475	GF	On-Demand	Anodyne	BACE1	76	48
Cc1ccncc1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819350475	GF	On-Demand	Anodyne	FPR1	47	40
CCN1C[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1=O	ZINC000819350477	FD	On-Demand	Anodyne	GPR119	29	44
CCN1C[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1=O	ZINC000819350479	FD	On-Demand	Anodyne	GPR119	29	44
C#CCOc1ccc(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819350493	FE	On-Demand	Mild	ADRB2	52	60
C#CCOc1ccc(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819350493	FE	On-Demand	Mild	ADRB1	88	60
C#CCOc1ccc(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819350493	FE	On-Demand	Mild	GRIN1	28	42
C#CCOc1ccc(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819350493	FE	On-Demand	Mild	ADRB3	56	60
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819350494	FE	On-Demand	Mild	ADRB2	52	60
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819350494	FE	On-Demand	Mild	ADRB1	88	60
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819350494	FE	On-Demand	Mild	GRIN1	28	42
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819350494	FE	On-Demand	Mild	ADRB3	56	60
Cc1ccncc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819350495	CE	On-Demand	Bother	CACNA1D	57	33
Cc1ccncc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819350496	CE	On-Demand	Bother	CACNA1D	57	33
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819350508	GF	On-Demand	Anodyne	ADRB2	37	43
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819350508	GF	On-Demand	Anodyne	ADRB1	53	39
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819350508	GF	On-Demand	Anodyne	GHRHR	55	30
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819350508	GF	On-Demand	Anodyne	ABCB1	25	45
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819350509	GF	On-Demand	Anodyne	ADRB2	37	43
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819350509	GF	On-Demand	Anodyne	ADRB1	53	39
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819350509	GF	On-Demand	Anodyne	GHRHR	55	30
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819350509	GF	On-Demand	Anodyne	ABCB1	25	45
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819350510	GF	On-Demand	Anodyne	ADRB2	37	43
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819350510	GF	On-Demand	Anodyne	ADRB1	53	39
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819350510	GF	On-Demand	Anodyne	GHRHR	55	30
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819350510	GF	On-Demand	Anodyne	ABCB1	25	45
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819350511	GF	On-Demand	Anodyne	ADRB2	37	43
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819350511	GF	On-Demand	Anodyne	ADRB1	53	39
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819350511	GF	On-Demand	Anodyne	GHRHR	55	30
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819350511	GF	On-Demand	Anodyne	ABCB1	25	45
C#CCOc1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819350522	FE	On-Demand	Mild	ADRB2	36	51
C#CCOc1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819350522	FE	On-Demand	Mild	ADRB1	59	51
C#CCOc1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819350522	FE	On-Demand	Mild	ADRB3	40	51
C#CCOc1ccc(CNC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819350522	FE	On-Demand	Mild	PDS	25	46
C#CCOc1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819350524	FE	On-Demand	Mild	ADRB2	36	51
C#CCOc1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819350524	FE	On-Demand	Mild	ADRB1	59	51
C#CCOc1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819350524	FE	On-Demand	Mild	ADRB3	40	51
C#CCOc1ccc(CNC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819350524	FE	On-Demand	Mild	PDS	25	46
COc1cc(CN2CCN(C(=O)C(F)=C3CCC3)CC2)cc(OC)c1	ZINC000819350525	EF	On-Demand	Anodyne	FAAH	15	41
C#CCOc1ccc(CNC[C@@H](O)CSC)cc1	ZINC000819350547	CD	On-Demand	Mild	ADRB1	18	40
C#CCOc1ccc(CNC[C@H](O)CSC)cc1	ZINC000819350548	CD	On-Demand	Mild	ADRB1	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CC(N)=O)C1CCCCC1)C2	ZINC000819350553	FD	On-Demand	Anodyne	LGMN	47	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CC(N)=O)C1CCCCC1)C2	ZINC000819350554	FD	On-Demand	Anodyne	LGMN	47	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CC(N)=O)C1CCCCC1)C2	ZINC000819350557	FD	On-Demand	Anodyne	LGMN	47	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CC(N)=O)C1CCCCC1)C2	ZINC000819350560	FD	On-Demand	Anodyne	LGMN	47	31
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3F)CC2)cc1	ZINC000819350567	GG	On-Demand	Anodyne	DRD4	39	47
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3F)CC2)cc1	ZINC000819350567	GG	On-Demand	Anodyne	ACHE	22	42
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3F)CC2)cc1	ZINC000819350567	GG	On-Demand	Anodyne	CHRM3	18	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3F)CC2)cc1	ZINC000819350567	GG	On-Demand	Anodyne	LTA4H	24	44
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3F)CC2)cc1	ZINC000819350567	GG	On-Demand	Anodyne	SIGMAR1	37	52
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3F)CC2)cc1	ZINC000819350567	GG	On-Demand	Anodyne	SSTR5	52	38
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3F)CC2)cc1	ZINC000819350567	GG	On-Demand	Anodyne	CCR3	61	44
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3F)CC2)cc1	ZINC000819350567	GG	On-Demand	Anodyne	TIMP3	40	33
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3F)CC2)cc1	ZINC000819350567	GG	On-Demand	Anodyne	MLNR	50	40
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3F)CC2)cc1	ZINC000819350567	GG	On-Demand	Anodyne	MCHR1	60	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3F)CC2)cc1	ZINC000819350567	GG	On-Demand	Anodyne	NOD2	42	36
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3F)CC2)cc1	ZINC000819350569	GG	On-Demand	Anodyne	DRD4	39	47
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3F)CC2)cc1	ZINC000819350569	GG	On-Demand	Anodyne	ACHE	22	42
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3F)CC2)cc1	ZINC000819350569	GG	On-Demand	Anodyne	CHRM3	18	41
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3F)CC2)cc1	ZINC000819350569	GG	On-Demand	Anodyne	LTA4H	24	44
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3F)CC2)cc1	ZINC000819350569	GG	On-Demand	Anodyne	SIGMAR1	37	52
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3F)CC2)cc1	ZINC000819350569	GG	On-Demand	Anodyne	SSTR5	52	38
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3F)CC2)cc1	ZINC000819350569	GG	On-Demand	Anodyne	CCR3	61	44
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3F)CC2)cc1	ZINC000819350569	GG	On-Demand	Anodyne	TIMP3	40	33
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3F)CC2)cc1	ZINC000819350569	GG	On-Demand	Anodyne	MLNR	50	40
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3F)CC2)cc1	ZINC000819350569	GG	On-Demand	Anodyne	MCHR1	60	41
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3F)CC2)cc1	ZINC000819350569	GG	On-Demand	Anodyne	NOD2	42	36
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cc3C)CC2)cc1	ZINC000819350572	GG	On-Demand	Anodyne	KCNH2	15	53
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cc3C)CC2)cc1	ZINC000819350572	GG	On-Demand	Anodyne	CHRM3	15	40
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cc3C)CC2)cc1	ZINC000819350572	GG	On-Demand	Anodyne	SIGMAR1	27	45
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cc3C)CC2)cc1	ZINC000819350572	GG	On-Demand	Anodyne	SSTR5	44	35
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cc3C)CC2)cc1	ZINC000819350572	GG	On-Demand	Anodyne	CCR3	85	43
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cc3C)CC2)cc1	ZINC000819350572	GG	On-Demand	Anodyne	MLNR	54	42
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cc3C)CC2)cc1	ZINC000819350572	GG	On-Demand	Anodyne	MCHR1	49	43
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cc3C)CC2)cc1	ZINC000819350581	GG	On-Demand	Anodyne	KCNH2	15	53
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cc3C)CC2)cc1	ZINC000819350581	GG	On-Demand	Anodyne	CHRM3	15	40
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cc3C)CC2)cc1	ZINC000819350581	GG	On-Demand	Anodyne	SIGMAR1	27	45
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cc3C)CC2)cc1	ZINC000819350581	GG	On-Demand	Anodyne	SSTR5	44	35
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cc3C)CC2)cc1	ZINC000819350581	GG	On-Demand	Anodyne	CCR3	85	43
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cc3C)CC2)cc1	ZINC000819350581	GG	On-Demand	Anodyne	MLNR	54	42
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cc3C)CC2)cc1	ZINC000819350581	GG	On-Demand	Anodyne	MCHR1	49	43
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)C3CC3)CC2)cc1	ZINC000819350583	ED	On-Demand	Anodyne	DRD4	21	46
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)C3CC3)CC2)cc1	ZINC000819350583	ED	On-Demand	Anodyne	LTA4H	19	41
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)C3CC3)CC2)cc1	ZINC000819350583	ED	On-Demand	Anodyne	SIGMAR1	28	45
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)C3CC3)CC2)cc1	ZINC000819350583	ED	On-Demand	Anodyne	CCR3	27	44
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)C3CC3)CC2)cc1	ZINC000819350583	ED	On-Demand	Anodyne	MCHR1	40	40
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)C3CC3)CC2)cc1	ZINC000819350583	ED	On-Demand	Anodyne	NOD2	42	36
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)C3CC3)CC2)cc1	ZINC000819350584	ED	On-Demand	Anodyne	DRD4	21	46
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)C3CC3)CC2)cc1	ZINC000819350584	ED	On-Demand	Anodyne	LTA4H	19	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)C3CC3)CC2)cc1	ZINC000819350584	ED	On-Demand	Anodyne	SIGMAR1	28	45
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)C3CC3)CC2)cc1	ZINC000819350584	ED	On-Demand	Anodyne	CCR3	27	44
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)C3CC3)CC2)cc1	ZINC000819350584	ED	On-Demand	Anodyne	MCHR1	40	40
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)C3CC3)CC2)cc1	ZINC000819350584	ED	On-Demand	Anodyne	NOD2	42	36
COCC(COC)NC[C@@H](O)c1cccnc1	ZINC000819350611	BC	On-Demand	Anodyne	ADRB2	28	45
COCC(COC)NC[C@@H](O)c1cccnc1	ZINC000819350611	BC	On-Demand	Anodyne	ADRB1	26	48
COCC(COC)NC[C@@H](O)c1cccnc1	ZINC000819350611	BC	On-Demand	Anodyne	ADRB3	85	48
COCC(COC)NC[C@@H](O)c1cccnc1	ZINC000819350611	BC	On-Demand	Anodyne	KCNA5	20	40
COCC(COC)NC[C@H](O)c1cccnc1	ZINC000819350613	BC	On-Demand	Anodyne	ADRB2	28	45
COCC(COC)NC[C@H](O)c1cccnc1	ZINC000819350613	BC	On-Demand	Anodyne	ADRB1	26	48
COCC(COC)NC[C@H](O)c1cccnc1	ZINC000819350613	BC	On-Demand	Anodyne	ADRB3	85	48
COCC(COC)NC[C@H](O)c1cccnc1	ZINC000819350613	BC	On-Demand	Anodyne	KCNA5	20	40
C#CCOc1ccc(CNC[C@H](O)c2ccc(F)cc2C)cc1	ZINC000819350618	DF	On-Demand	Mild	LEF	42	37
C#CCOc1ccc(CNC[C@@H](O)c2ccc(F)cc2C)cc1	ZINC000819350620	DF	On-Demand	Mild	LEF	42	37
CC(=O)Nc1cccc(CC(=O)NCC(=O)OC2CCCCC2)c1	ZINC000819350634	EE	On-Demand	Anodyne	CCKBR	16	40
O=S(=O)(CCNC[C@@H](O)Cc1ccc2ccccc2c1)C1CCOCC1	ZINC000819350660	GD	On-Demand	Anodyne	NMT1	28	43
O=S(=O)(CCNC[C@H](O)Cc1ccc2ccccc2c1)C1CCOCC1	ZINC000819350663	GD	On-Demand	Anodyne	NMT1	28	43
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350667	GG	On-Demand	Anodyne	ADRB1	15	40
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350667	GG	On-Demand	Anodyne	DRD4	19	42
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350667	GG	On-Demand	Anodyne	SLC6A3	29	44
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350667	GG	On-Demand	Anodyne	KCNH2	18	51
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350667	GG	On-Demand	Anodyne	CHRM3	18	40
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350667	GG	On-Demand	Anodyne	ADRB3	29	40
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350667	GG	On-Demand	Anodyne	LTA4H	17	40
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350667	GG	On-Demand	Anodyne	SIGMAR1	36	48
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350667	GG	On-Demand	Anodyne	CCR3	95	43
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350667	GG	On-Demand	Anodyne	MLNR	65	51
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350667	GG	On-Demand	Anodyne	MCHR1	53	45
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350667	GG	On-Demand	Anodyne	CACNA1G	40	41
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350669	GG	On-Demand	Anodyne	ADRB1	15	40
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350669	GG	On-Demand	Anodyne	DRD4	19	42
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350669	GG	On-Demand	Anodyne	SLC6A3	29	44
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350669	GG	On-Demand	Anodyne	KCNH2	18	51
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350669	GG	On-Demand	Anodyne	CHRM3	18	40
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350669	GG	On-Demand	Anodyne	ADRB3	29	40
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350669	GG	On-Demand	Anodyne	LTA4H	17	40
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350669	GG	On-Demand	Anodyne	SIGMAR1	36	48
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350669	GG	On-Demand	Anodyne	CCR3	95	43
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350669	GG	On-Demand	Anodyne	MLNR	65	51
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350669	GG	On-Demand	Anodyne	MCHR1	53	45
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccc(F)cc3)CC2)cc1	ZINC000819350669	GG	On-Demand	Anodyne	CACNA1G	40	41
N#Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819350677	FC	On-Demand	Mild	ADRB2	36	46
N#Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819350677	FC	On-Demand	Mild	ADRB1	71	46
N#Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819350677	FC	On-Demand	Mild	ADRB3	42	40
N#Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819350681	FC	On-Demand	Mild	ADRB2	36	46
N#Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819350681	FC	On-Demand	Mild	ADRB1	71	46
N#Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819350681	FC	On-Demand	Mild	ADRB3	42	40
C#CCOc1ccc(CNC[C@@H](O)CCC(C)C)cc1	ZINC000819350716	CF	On-Demand	Mild	ADRB2	16	42
C#CCOc1ccc(CNC[C@@H](O)CCC(C)C)cc1	ZINC000819350716	CF	On-Demand	Mild	ADRB1	17	42
C#CCOc1ccc(CNC[C@H](O)CCC(C)C)cc1	ZINC000819350717	CF	On-Demand	Mild	ADRB2	16	42
C#CCOc1ccc(CNC[C@H](O)CCC(C)C)cc1	ZINC000819350717	CF	On-Demand	Mild	ADRB1	17	42
CC(=O)Nc1ccc(CN2CCC(NCCS(C)(=O)=O)CC2)cc1	ZINC000819350718	FD	On-Demand	Anodyne	DRD4	26	46
CC(=O)Nc1ccc(CN2CCC(NCCS(C)(=O)=O)CC2)cc1	ZINC000819350718	FD	On-Demand	Anodyne	ACHE	18	42
CC(=O)Nc1ccc(CN2CCC(NCCS(C)(=O)=O)CC2)cc1	ZINC000819350718	FD	On-Demand	Anodyne	LTA4H	18	41
CC(=O)Nc1ccc(CN2CCC(NCCS(C)(=O)=O)CC2)cc1	ZINC000819350718	FD	On-Demand	Anodyne	SIGMAR1	28	45
CC(=O)Nc1ccc(CN2CCC(NCCS(C)(=O)=O)CC2)cc1	ZINC000819350718	FD	On-Demand	Anodyne	SSTR5	47	41
CC(=O)Nc1ccc(CN2CCC(NCCS(C)(=O)=O)CC2)cc1	ZINC000819350718	FD	On-Demand	Anodyne	CCR3	32	42
CC(=O)Nc1ccc(CN2CCC(NCCS(C)(=O)=O)CC2)cc1	ZINC000819350718	FD	On-Demand	Anodyne	MCHR1	49	42
COCC(COC)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819350724	CD	On-Demand	Anodyne	ADRB2	15	50
COCC(COC)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819350725	CD	On-Demand	Anodyne	ADRB2	15	50
O[C@@H](CN[C@H]1CCO[C@H](c2cccnc2)C1)c1ccccc1	ZINC000819350742	CF	On-Demand	Anodyne	ADRB3	22	41
O[C@@H](CN[C@@H]1CCO[C@@H](c2cccnc2)C1)c1ccccc1	ZINC000819350743	CF	On-Demand	Anodyne	ADRB3	22	41
O[C@H](CN[C@H]1CCO[C@H](c2cccnc2)C1)c1ccccc1	ZINC000819350744	CF	On-Demand	Anodyne	ADRB3	22	41
O[C@H](CN[C@@H]1CCO[C@H](c2cccnc2)C1)c1ccccc1	ZINC000819350745	CF	On-Demand	Anodyne	ADRB3	22	41
O[C@H](CN[C@@H]1CCO[C@@H](c2cccnc2)C1)c1ccccc1	ZINC000819350746	CF	On-Demand	Anodyne	ADRB3	22	41
O[C@@H](CN[C@H]1CCO[C@@H](c2cccnc2)C1)c1ccccc1	ZINC000819350747	CF	On-Demand	Anodyne	ADRB3	22	41
O[C@H](CN[C@H]1CCO[C@@H](c2cccnc2)C1)c1ccccc1	ZINC000819350748	CF	On-Demand	Anodyne	ADRB3	22	41
O[C@@H](CN[C@@H]1CCO[C@H](c2cccnc2)C1)c1ccccc1	ZINC000819350749	CF	On-Demand	Anodyne	ADRB3	22	41
C#CCNC(=O)CCNC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000819350751	FD	On-Demand	Mild	DRD4	20	42
C#CCNC(=O)CCNC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000819350751	FD	On-Demand	Mild	ACHE	15	41
C#CCNC(=O)CCNC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000819350751	FD	On-Demand	Mild	LTA4H	19	40
C#CCNC(=O)CCNC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000819350751	FD	On-Demand	Mild	SIGMAR1	23	42
C#CCNC(=O)CCNC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000819350751	FD	On-Demand	Mild	SSTR5	47	41
COCC(COC)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819350758	CC	On-Demand	Bother	CACNA1C	62	41
COCC(COC)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819350758	CC	On-Demand	Bother	CACNA1D	92	41
COCC(COC)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819350759	CC	On-Demand	Bother	CACNA1C	62	41
COCC(COC)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819350759	CC	On-Demand	Bother	CACNA1D	92	41
CCN1C[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1=O	ZINC000819350765	CC	On-Demand	Bother	CACNA1D	59	34
CCN1C[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1=O	ZINC000819350767	CC	On-Demand	Bother	CACNA1D	59	34
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)c(C)c1	ZINC000819350774	FD	On-Demand	Anodyne	ADRB2	20	41
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)c(C)c1	ZINC000819350775	FD	On-Demand	Anodyne	ADRB2	20	41
C#CCOc1ccc(CNC[C@@H](O)COCc2ccccc2Cl)cc1	ZINC000819350778	FG	On-Demand	Mild	ADRB1	39	47
C#CCOc1ccc(CNC[C@@H](O)COCc2ccccc2Cl)cc1	ZINC000819350778	FG	On-Demand	Mild	ADRB3	25	47
C#CCOc1ccc(CNC[C@H](O)COCc2ccccc2Cl)cc1	ZINC000819350779	FG	On-Demand	Mild	ADRB1	39	47
C#CCOc1ccc(CNC[C@H](O)COCc2ccccc2Cl)cc1	ZINC000819350779	FG	On-Demand	Mild	ADRB3	25	47
CSc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1Cl	ZINC000819350806	GJ	On-Demand	Mild	PAPA1_CARPA	43	45
CSc1ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1Cl	ZINC000819350807	GJ	On-Demand	Mild	PAPA1_CARPA	43	45
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350808	GF	On-Demand	Anodyne	ADRB2	50	59
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350808	GF	On-Demand	Anodyne	ADRB1	94	59
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350808	GF	On-Demand	Anodyne	GRIN1	23	44
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350808	GF	On-Demand	Anodyne	ADRB3	60	59
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350809	GF	On-Demand	Anodyne	ADRB2	50	59
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350809	GF	On-Demand	Anodyne	ADRB1	94	59
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350809	GF	On-Demand	Anodyne	GRIN1	23	44
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819350809	GF	On-Demand	Anodyne	ADRB3	60	59
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350810	GF	On-Demand	Anodyne	ADRB2	50	59
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350810	GF	On-Demand	Anodyne	ADRB1	94	59
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350810	GF	On-Demand	Anodyne	GRIN1	23	44
CC(=O)Nc1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350810	GF	On-Demand	Anodyne	ADRB3	60	59
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350811	GF	On-Demand	Anodyne	ADRB2	50	59
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350811	GF	On-Demand	Anodyne	ADRB1	94	59
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350811	GF	On-Demand	Anodyne	GRIN1	23	44
CC(=O)Nc1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819350811	GF	On-Demand	Anodyne	ADRB3	60	59
O[C@H](CN[C@H]1CCO[C@H](c2ccncc2)C1)c1cccc(Cl)c1	ZINC000819350812	EG	On-Demand	Anodyne	ADRB1	23	41
O[C@H](CN[C@H]1CCO[C@H](c2ccncc2)C1)c1cccc(Cl)c1	ZINC000819350812	EG	On-Demand	Anodyne	ADRB3	38	46
O[C@H](CN[C@H]1CCO[C@H](c2ccncc2)C1)c1cccc(Cl)c1	ZINC000819350812	EG	On-Demand	Anodyne	CYP3A4	43	34
O[C@H](CN[C@@H]1CCO[C@H](c2ccncc2)C1)c1cccc(Cl)c1	ZINC000819350813	EG	On-Demand	Anodyne	ADRB1	23	41
O[C@H](CN[C@@H]1CCO[C@H](c2ccncc2)C1)c1cccc(Cl)c1	ZINC000819350813	EG	On-Demand	Anodyne	ADRB3	38	46
O[C@H](CN[C@@H]1CCO[C@H](c2ccncc2)C1)c1cccc(Cl)c1	ZINC000819350813	EG	On-Demand	Anodyne	CYP3A4	43	34
O[C@H](CN[C@@H]1CCO[C@@H](c2ccncc2)C1)c1cccc(Cl)c1	ZINC000819350814	EG	On-Demand	Anodyne	ADRB1	23	41
O[C@H](CN[C@@H]1CCO[C@@H](c2ccncc2)C1)c1cccc(Cl)c1	ZINC000819350814	EG	On-Demand	Anodyne	ADRB3	38	46
O[C@H](CN[C@@H]1CCO[C@@H](c2ccncc2)C1)c1cccc(Cl)c1	ZINC000819350814	EG	On-Demand	Anodyne	CYP3A4	43	34
O[C@H](CN[C@H]1CCO[C@@H](c2ccncc2)C1)c1cccc(Cl)c1	ZINC000819350815	EG	On-Demand	Anodyne	ADRB1	23	41
O[C@H](CN[C@H]1CCO[C@@H](c2ccncc2)C1)c1cccc(Cl)c1	ZINC000819350815	EG	On-Demand	Anodyne	ADRB3	38	46
O[C@H](CN[C@H]1CCO[C@@H](c2ccncc2)C1)c1cccc(Cl)c1	ZINC000819350815	EG	On-Demand	Anodyne	CYP3A4	43	34
CON(C)C(=O)CCNCC1(N2CCN(c3ccccc3)CC2)CCOCC1	ZINC000819350849	GD	On-Demand	Anodyne	HCN1	70	41
CON(C)C(=O)CCNCC1(N2CCN(c3ccccc3)CC2)CCOCC1	ZINC000819350849	GD	On-Demand	Anodyne	HCN4	50	32
C#CCOc1ccc(CNC[C@H](O)COC(C)C)cc1	ZINC000819350921	CD	On-Demand	Mild	ADRB2	34	47
C#CCOc1ccc(CNC[C@H](O)COC(C)C)cc1	ZINC000819350921	CD	On-Demand	Mild	ADRB1	42	47
C#CCOc1ccc(CNC[C@H](O)COC(C)C)cc1	ZINC000819350921	CD	On-Demand	Mild	ADRB3	26	42
C#CCOc1ccc(CNC[C@@H](O)COC(C)C)cc1	ZINC000819350922	CD	On-Demand	Mild	ADRB2	34	47
C#CCOc1ccc(CNC[C@@H](O)COC(C)C)cc1	ZINC000819350922	CD	On-Demand	Mild	ADRB1	42	47
C#CCOc1ccc(CNC[C@@H](O)COC(C)C)cc1	ZINC000819350922	CD	On-Demand	Mild	ADRB3	26	42
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCS(=O)(=O)C1CCOCC1	ZINC000819350963	GC	On-Demand	Bother	ADRB2	27	41
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCS(=O)(=O)C1CCOCC1	ZINC000819350963	GC	On-Demand	Bother	ADRB1	46	38
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCS(=O)(=O)C1CCOCC1	ZINC000819350963	GC	On-Demand	Bother	ADRB3	21	41
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCS(=O)(=O)C1CCOCC1	ZINC000819350964	GC	On-Demand	Bother	ADRB2	27	41
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCS(=O)(=O)C1CCOCC1	ZINC000819350964	GC	On-Demand	Bother	ADRB1	46	38
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCS(=O)(=O)C1CCOCC1	ZINC000819350964	GC	On-Demand	Bother	ADRB3	21	41
O=S(=O)(CCNC[C@@H](O)COc1ccccc1Cl)C1CCOCC1	ZINC000819350966	GD	On-Demand	Anodyne	ADRB2	36	51
O=S(=O)(CCNC[C@@H](O)COc1ccccc1Cl)C1CCOCC1	ZINC000819350966	GD	On-Demand	Anodyne	ADRB1	58	44
O=S(=O)(CCNC[C@H](O)COc1ccccc1Cl)C1CCOCC1	ZINC000819350967	GD	On-Demand	Anodyne	ADRB2	36	51
O=S(=O)(CCNC[C@H](O)COc1ccccc1Cl)C1CCOCC1	ZINC000819350967	GD	On-Demand	Anodyne	ADRB1	58	44
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H]1Cc1ccccc1	ZINC000819350981	CF	On-Demand	Anodyne	CYP2J2	43	30
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H]1Cc1ccccc1	ZINC000819350982	CF	On-Demand	Anodyne	CYP2J2	43	30
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H]1Cc1ccccc1	ZINC000819350983	CF	On-Demand	Anodyne	CYP2J2	43	30
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H]1Cc1ccccc1	ZINC000819350984	CF	On-Demand	Anodyne	CYP2J2	43	30
O=S(=O)(CCNC[C@@H](O)COc1ccccc1F)C1CCOCC1	ZINC000819351004	FC	On-Demand	Anodyne	ADRB2	35	40
O=S(=O)(CCNC[C@@H](O)COc1ccccc1F)C1CCOCC1	ZINC000819351004	FC	On-Demand	Anodyne	ADRB1	58	46
O=S(=O)(CCNC[C@H](O)COc1ccccc1F)C1CCOCC1	ZINC000819351005	FC	On-Demand	Anodyne	ADRB2	35	40
O=S(=O)(CCNC[C@H](O)COc1ccccc1F)C1CCOCC1	ZINC000819351005	FC	On-Demand	Anodyne	ADRB1	58	46
CC(=O)c1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819351006	GC	On-Demand	Anodyne	ADRB2	41	48
CC(=O)c1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819351006	GC	On-Demand	Anodyne	ADRB1	77	48
CC(=O)c1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819351006	GC	On-Demand	Anodyne	ADRB3	46	41
CC(=O)c1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819351007	GC	On-Demand	Anodyne	ADRB2	41	48
CC(=O)c1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819351007	GC	On-Demand	Anodyne	ADRB1	77	48
CC(=O)c1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CCOCC2)cc1	ZINC000819351007	GC	On-Demand	Anodyne	ADRB3	46	41
C#CCOc1ccc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819351008	GF	On-Demand	Mild	MMP13	15	45
C#CCOc1ccc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819351008	GF	On-Demand	Mild	GPR119	52	45
C#CCOc1ccc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819351009	GF	On-Demand	Mild	MMP13	15	45
C#CCOc1ccc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819351009	GF	On-Demand	Mild	GPR119	52	45
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)cc1)C1CCOCC1	ZINC000819351017	GD	On-Demand	Anodyne	ADRB2	39	48
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)cc1)C1CCOCC1	ZINC000819351017	GD	On-Demand	Anodyne	ADRB1	75	49
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)cc1)C1CCOCC1	ZINC000819351017	GD	On-Demand	Anodyne	GRIN1	25	50
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)cc1)C1CCOCC1	ZINC000819351017	GD	On-Demand	Anodyne	ADRB3	48	46
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)cc1)C1CCOCC1	ZINC000819351018	GD	On-Demand	Anodyne	ADRB2	39	48
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)cc1)C1CCOCC1	ZINC000819351018	GD	On-Demand	Anodyne	ADRB1	75	49
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)cc1)C1CCOCC1	ZINC000819351018	GD	On-Demand	Anodyne	GRIN1	25	50
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)cc1)C1CCOCC1	ZINC000819351018	GD	On-Demand	Anodyne	ADRB3	48	46
C#CCOc1ccc(CNC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819351019	FF	On-Demand	Mild	ADRB2	40	47
C#CCOc1ccc(CNC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819351019	FF	On-Demand	Mild	ADRB1	56	47
C#CCOc1ccc(CNC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819351019	FF	On-Demand	Mild	ADRB3	36	43
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819351020	FF	On-Demand	Mild	ADRB2	40	47
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819351020	FF	On-Demand	Mild	ADRB1	56	47
C#CCOc1ccc(CNC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819351020	FF	On-Demand	Mild	ADRB3	36	43
C#CCOc1ccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819351041	FE	On-Demand	Mild	ADRB2	39	44
C#CCOc1ccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819351041	FE	On-Demand	Mild	ADRB1	61	38
C#CCOc1ccc(CNC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819351041	FE	On-Demand	Mild	ADRB3	35	44
C#CCOc1ccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819351042	FE	On-Demand	Mild	ADRB2	39	44
C#CCOc1ccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819351042	FE	On-Demand	Mild	ADRB1	61	38
C#CCOc1ccc(CNC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819351042	FE	On-Demand	Mild	ADRB3	35	44
COCC(COC)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819351045	CD	On-Demand	Anodyne	ADRB2	29	54
COCC(COC)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819351045	CD	On-Demand	Anodyne	ADRB1	43	50
COCC(COC)NC[C@@H](O)c1cccc(Cl)c1	ZINC000819351045	CD	On-Demand	Anodyne	ADRB3	58	49
COCC(COC)NC[C@H](O)c1cccc(Cl)c1	ZINC000819351046	CD	On-Demand	Anodyne	ADRB2	29	54
COCC(COC)NC[C@H](O)c1cccc(Cl)c1	ZINC000819351046	CD	On-Demand	Anodyne	ADRB1	43	50
COCC(COC)NC[C@H](O)c1cccc(Cl)c1	ZINC000819351046	CD	On-Demand	Anodyne	ADRB3	58	49
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	ADRB2	19	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	CHRM2	20	43
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	ADRB1	40	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	CHRM1	20	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	DRD2	19	52
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	TSHR	42	32
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	DRD4	49	52
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	ACHE	38	46
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	SLC6A3	25	47
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	CHRM3	34	43
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	ADRB3	80	41
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	LTA4H	40	48
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	TACR2	17	42
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	SIGMAR1	46	52
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	SSTR5	52	40
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	NPY2R	37	42
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	CCR3	49	46
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	CCR5	34	48
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	TIMP3	47	31
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	EPHX2	16	40
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	BACE1	15	43
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	CXCR3	27	42
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	MCHR1	58	42
CC(=O)Nc1ccc(CN2CCC(NC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000819351050	FF	On-Demand	Anodyne	NOD2	43	36
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	ADRB2	19	41
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	CHRM2	20	43
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	ADRB1	40	41
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	CHRM1	20	41
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	DRD2	19	52
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	TSHR	42	32
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	DRD4	49	52
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	ACHE	38	46
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	SLC6A3	25	47
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	CHRM3	34	43
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	ADRB3	80	41
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	LTA4H	40	48
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	TACR2	17	42
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	SIGMAR1	46	52
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	SSTR5	52	40
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	NPY2R	37	42
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	CCR3	49	46
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	CCR5	34	48
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	TIMP3	47	31
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	EPHX2	16	40
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	BACE1	15	43
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	CXCR3	27	42
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	MCHR1	58	42
CC(=O)Nc1ccc(CN2CCC(NC[C@H](O)c3ccccc3)CC2)cc1	ZINC000819351051	FF	On-Demand	Anodyne	NOD2	43	36
COCC(COC)NC[C@H](O)c1ccc(C)cc1	ZINC000819351067	CD	On-Demand	Anodyne	ADRB2	15	62
COCC(COC)NC[C@@H](O)c1ccc(C)cc1	ZINC000819351068	CD	On-Demand	Anodyne	ADRB2	15	62
Cc1ccc(F)c(CCNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819351104	GG	On-Demand	Anodyne	GPR119	49	54
Cc1ccc(F)c(CCNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819351105	GG	On-Demand	Anodyne	GPR119	49	54
COc1cccc(OC)c1OC[C@@H](O)CNCC[C@]1(C)CC1(Cl)Cl	ZINC000819351183	GG	On-Demand	Anodyne	ADRB2	35	44
COc1cccc(OC)c1OC[C@@H](O)CNCC[C@]1(C)CC1(Cl)Cl	ZINC000819351183	GG	On-Demand	Anodyne	ADRB1	49	35
COc1cccc(OC)c1OC[C@@H](O)CNCC[C@@]1(C)CC1(Cl)Cl	ZINC000819351184	GG	On-Demand	Anodyne	ADRB2	35	44
COc1cccc(OC)c1OC[C@@H](O)CNCC[C@@]1(C)CC1(Cl)Cl	ZINC000819351184	GG	On-Demand	Anodyne	ADRB1	49	35
COc1cccc(OC)c1OC[C@H](O)CNCC[C@]1(C)CC1(Cl)Cl	ZINC000819351185	GG	On-Demand	Anodyne	ADRB2	35	44
COc1cccc(OC)c1OC[C@H](O)CNCC[C@]1(C)CC1(Cl)Cl	ZINC000819351185	GG	On-Demand	Anodyne	ADRB1	49	35
COc1cccc(OC)c1OC[C@H](O)CNCC[C@@]1(C)CC1(Cl)Cl	ZINC000819351186	GG	On-Demand	Anodyne	ADRB2	35	44
COc1cccc(OC)c1OC[C@H](O)CNCC[C@@]1(C)CC1(Cl)Cl	ZINC000819351186	GG	On-Demand	Anodyne	ADRB1	49	35
CSc1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819351228	FH	On-Demand	Anodyne	ADRB2	41	43
CSc1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819351228	FH	On-Demand	Anodyne	ADRB1	63	43
CSc1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819351228	FH	On-Demand	Anodyne	ADRB3	39	43
CSc1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819351229	FH	On-Demand	Anodyne	ADRB2	41	43
CSc1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819351229	FH	On-Demand	Anodyne	ADRB1	63	43
CSc1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819351229	FH	On-Demand	Anodyne	ADRB3	39	43
CSc1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819351230	FH	On-Demand	Anodyne	ADRB2	41	43
CSc1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819351230	FH	On-Demand	Anodyne	ADRB1	63	43
CSc1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819351230	FH	On-Demand	Anodyne	ADRB3	39	43
CSc1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819351231	FH	On-Demand	Anodyne	ADRB2	41	43
CSc1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819351231	FH	On-Demand	Anodyne	ADRB1	63	43
CSc1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819351231	FH	On-Demand	Anodyne	ADRB3	39	43
CC(C)c1nn(-c2ccccc2)cc1C(=O)NCC(=O)OC1CCCCC1	ZINC000819351290	FH	On-Demand	Anodyne	HCN4	40	30
Cc1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819351297	EG	On-Demand	Anodyne	ADRB2	49	51
Cc1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819351297	EG	On-Demand	Anodyne	ADRB1	71	45
Cc1ccc(OC[C@@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819351297	EG	On-Demand	Anodyne	ADRB3	46	45
Cc1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819351298	EG	On-Demand	Anodyne	ADRB2	49	51
Cc1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819351298	EG	On-Demand	Anodyne	ADRB1	71	45
Cc1ccc(OC[C@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819351298	EG	On-Demand	Anodyne	ADRB3	46	45
Cc1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819351299	EG	On-Demand	Anodyne	ADRB2	49	51
Cc1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819351299	EG	On-Demand	Anodyne	ADRB1	71	45
Cc1ccc(OC[C@H](O)CNCC[C@]2(C)CC2(Cl)Cl)cc1	ZINC000819351299	EG	On-Demand	Anodyne	ADRB3	46	45
Cc1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819351300	EG	On-Demand	Anodyne	ADRB2	49	51
Cc1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819351300	EG	On-Demand	Anodyne	ADRB1	71	45
Cc1ccc(OC[C@@H](O)CNCC[C@@]2(C)CC2(Cl)Cl)cc1	ZINC000819351300	EG	On-Demand	Anodyne	ADRB3	46	45
C=C[C@@H]1OCCC[C@H]1NC[C@@H](O)c1cccnc1	ZINC000819351309	BD	On-Demand	Mild	ADRB3	60	43
C=C[C@@H]1OCCC[C@H]1NC[C@H](O)c1cccnc1	ZINC000819351310	BD	On-Demand	Mild	ADRB3	60	43
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2ccncc2)C1	ZINC000819351356	DC	On-Demand	Anodyne	PREP	27	55
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2ccncc2)C1	ZINC000819351357	DC	On-Demand	Anodyne	PREP	27	55
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000819351358	FD	On-Demand	Anodyne	DRD4	21	53
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000819351358	FD	On-Demand	Anodyne	SIGMAR1	20	43
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000819351358	FD	On-Demand	Anodyne	CCR3	22	42
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000819351358	FD	On-Demand	Anodyne	MCHR1	18	43
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000819351359	FD	On-Demand	Anodyne	DRD4	21	53
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000819351359	FD	On-Demand	Anodyne	SIGMAR1	20	43
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000819351359	FD	On-Demand	Anodyne	CCR3	22	42
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccccn3)CC2)C1	ZINC000819351359	FD	On-Demand	Anodyne	MCHR1	18	43
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351364	FF	On-Demand	Anodyne	HTR1A	17	41
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351364	FF	On-Demand	Anodyne	CHRM1	23	43
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351364	FF	On-Demand	Anodyne	DRD2	28	47
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351364	FF	On-Demand	Anodyne	DRD4	31	53
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351364	FF	On-Demand	Anodyne	ACHE	15	47
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351364	FF	On-Demand	Anodyne	HTR2A	24	53
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351364	FF	On-Demand	Anodyne	OPRM1	15	42
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351364	FF	On-Demand	Anodyne	DRD3	18	42
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351364	FF	On-Demand	Anodyne	CHRM3	22	41
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351364	FF	On-Demand	Anodyne	GRIN2B	42	35
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351364	FF	On-Demand	Anodyne	LTA4H	17	41
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351364	FF	On-Demand	Anodyne	SIGMAR1	61	61
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351364	FF	On-Demand	Anodyne	CCR3	50	45
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351364	FF	On-Demand	Anodyne	PREP	46	37
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351364	FF	On-Demand	Anodyne	MCHR1	20	48
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351364	FF	On-Demand	Anodyne	CACNA1G	24	41
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351364	FF	On-Demand	Anodyne	BIRC2	51	45
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351365	FF	On-Demand	Anodyne	HTR1A	17	41
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351365	FF	On-Demand	Anodyne	CHRM1	23	43
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351365	FF	On-Demand	Anodyne	DRD2	28	47
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351365	FF	On-Demand	Anodyne	DRD4	31	53
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351365	FF	On-Demand	Anodyne	ACHE	15	47
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351365	FF	On-Demand	Anodyne	HTR2A	24	53
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351365	FF	On-Demand	Anodyne	OPRM1	15	42
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351365	FF	On-Demand	Anodyne	DRD3	18	42
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351365	FF	On-Demand	Anodyne	CHRM3	22	41
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351365	FF	On-Demand	Anodyne	GRIN2B	42	35
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351365	FF	On-Demand	Anodyne	LTA4H	17	41
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351365	FF	On-Demand	Anodyne	SIGMAR1	61	61
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351365	FF	On-Demand	Anodyne	CCR3	50	45
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351365	FF	On-Demand	Anodyne	PREP	46	37
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351365	FF	On-Demand	Anodyne	MCHR1	20	48
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351365	FF	On-Demand	Anodyne	CACNA1G	24	41
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(CCc3ccccc3)CC2)C1	ZINC000819351365	FF	On-Demand	Anodyne	BIRC2	51	45
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2c(F)cccc2Cl)C1	ZINC000819351372	FD	On-Demand	Anodyne	PREP	28	48
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2c(F)cccc2Cl)C1	ZINC000819351373	FD	On-Demand	Anodyne	PREP	28	48
O=C(O)C[C@H]1CCCN(C(=O)CSCC(=O)Nc2ccc(F)cc2)C1	ZINC000819351374	FE	On-Demand	Anodyne	CCR3	60	38
O=C(O)C[C@@H]1CCCN(C(=O)CSCC(=O)Nc2ccc(F)cc2)C1	ZINC000819351375	FE	On-Demand	Anodyne	CCR3	60	38
O=C(O)C[C@@H]1CCCN(C(=O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819351376	FH	On-Demand	Anodyne	SLC6A3	39	42
O=C(O)C[C@H]1CCCN(C(=O)COC(c2ccccc2)c2ccccc2)C1	ZINC000819351377	FH	On-Demand	Anodyne	SLC6A3	39	42
O=C(O)C[C@@H]1CCCN(C(=O)NC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000819351382	GG	On-Demand	Anodyne	DRD2	19	45
O=C(O)C[C@@H]1CCCN(C(=O)NC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000819351382	GG	On-Demand	Anodyne	LTA4H	26	48
O=C(O)C[C@@H]1CCCN(C(=O)NC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000819351382	GG	On-Demand	Anodyne	SIGMAR1	23	43
O=C(O)C[C@@H]1CCCN(C(=O)NC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000819351382	GG	On-Demand	Anodyne	CCR3	29	48
O=C(O)C[C@H]1CCCN(C(=O)NC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000819351383	GG	On-Demand	Anodyne	DRD2	19	45
O=C(O)C[C@H]1CCCN(C(=O)NC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000819351383	GG	On-Demand	Anodyne	LTA4H	26	48
O=C(O)C[C@H]1CCCN(C(=O)NC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000819351383	GG	On-Demand	Anodyne	SIGMAR1	23	43
O=C(O)C[C@H]1CCCN(C(=O)NC2C[C@@H]3CC[C@H](C2)N3Cc2ccccc2)C1	ZINC000819351383	GG	On-Demand	Anodyne	CCR3	29	48
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN([C@H]3CCCC[C@H]3O)CC2)C1	ZINC000819351384	FD	On-Demand	Anodyne	SLC18A3	34	42
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN([C@@H]3CCCC[C@@H]3O)CC2)C1	ZINC000819351385	FD	On-Demand	Anodyne	SLC18A3	34	42
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN([C@@H]3CCCC[C@H]3O)CC2)C1	ZINC000819351386	FD	On-Demand	Anodyne	SLC18A3	34	42
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN([C@H]3CCCC[C@@H]3O)CC2)C1	ZINC000819351387	FD	On-Demand	Anodyne	SLC18A3	34	42
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(CC(F)(F)F)CC2)C1	ZINC000819351406	FD	On-Demand	Anodyne	HPGDS	37	41
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(CC(F)(F)F)CC2)C1	ZINC000819351407	FD	On-Demand	Anodyne	HPGDS	37	41
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2ccsc2)C1	ZINC000819351412	DD	On-Demand	Anodyne	PREP	19	43
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2ccsc2)C1	ZINC000819351413	DD	On-Demand	Anodyne	PREP	19	43
O=C(O)C[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000819351418	GD	On-Demand	Anodyne	TACR2	41	40
O=C(O)C[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000819351418	GD	On-Demand	Anodyne	REN	54	41
O=C(O)C[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000819351418	GD	On-Demand	Anodyne	CTSS	25	43
O=C(O)C[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000819351418	GD	On-Demand	Anodyne	PGA5	44	34
O=C(O)C[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000819351419	GD	On-Demand	Anodyne	TACR2	41	40
O=C(O)C[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000819351419	GD	On-Demand	Anodyne	REN	54	41
O=C(O)C[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000819351419	GD	On-Demand	Anodyne	CTSS	25	43
O=C(O)C[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000819351419	GD	On-Demand	Anodyne	PGA5	44	34
O=C(O)C[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000819351420	GD	On-Demand	Anodyne	TACR2	41	40
O=C(O)C[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000819351420	GD	On-Demand	Anodyne	REN	54	41
O=C(O)C[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000819351420	GD	On-Demand	Anodyne	CTSS	25	43
O=C(O)C[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000819351420	GD	On-Demand	Anodyne	PGA5	44	34
O=C(O)C[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000819351421	GD	On-Demand	Anodyne	TACR2	41	40
O=C(O)C[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000819351421	GD	On-Demand	Anodyne	REN	54	41
O=C(O)C[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000819351421	GD	On-Demand	Anodyne	CTSS	25	43
O=C(O)C[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)CN2CCOCC2)C1	ZINC000819351421	GD	On-Demand	Anodyne	PGA5	44	34
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)C1	ZINC000819351428	GF	On-Demand	Anodyne	P2RY12	58	36
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)C1	ZINC000819351428	GF	On-Demand	Anodyne	PREP	44	47
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)C1	ZINC000819351428	GF	On-Demand	Anodyne	DPP7	31	41
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)C1	ZINC000819351428	GF	On-Demand	Anodyne	PROC	41	35
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)C1	ZINC000819351429	GF	On-Demand	Anodyne	P2RY12	58	36
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)C1	ZINC000819351429	GF	On-Demand	Anodyne	PREP	44	47
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)C1	ZINC000819351429	GF	On-Demand	Anodyne	DPP7	31	41
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)C1	ZINC000819351429	GF	On-Demand	Anodyne	PROC	41	35
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2ccc(F)cc2)C1	ZINC000819351440	DD	On-Demand	Anodyne	CCR3	41	36
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2ccc(F)cc2)C1	ZINC000819351440	DD	On-Demand	Anodyne	PREP	24	44
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2ccc(F)cc2)C1	ZINC000819351441	DD	On-Demand	Anodyne	CCR3	41	36
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2ccc(F)cc2)C1	ZINC000819351441	DD	On-Demand	Anodyne	PREP	24	44
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819351442	FE	On-Demand	Anodyne	PREP	34	41
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819351442	FE	On-Demand	Anodyne	EPHX2	38	52
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819351442	FE	On-Demand	Anodyne	SFRP1	42	39
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819351442	FE	On-Demand	Anodyne	L3MBTL3	81	40
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819351443	FE	On-Demand	Anodyne	PREP	34	41
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819351443	FE	On-Demand	Anodyne	EPHX2	38	52
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819351443	FE	On-Demand	Anodyne	SFRP1	42	39
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)C1	ZINC000819351443	FE	On-Demand	Anodyne	L3MBTL3	81	40
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	F2	45	37
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	PRSS1	15	40
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	ACE	48	48
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	FKBP1A	25	40
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	CELA1	20	40
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	GRIN2B	27	40
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	ELANE	23	40
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	CTRA_BOVIN	52	31
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	KLK3	64	32
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	CTSB	38	43
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	TRY1_BOVIN	40	32
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	CYSP_TRYCR	36	41
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	CTSK	35	44
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	CTSL	41	44
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	PREP	79	60
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	CAPNS1	59	31
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	CELA2A	40	31
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	CTSS	33	40
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	CAPN1	59	42
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	CAPN2	78	39
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	TGM2	39	43
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	DPP7	55	38
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	NPR	67	39
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	BIRC2	17	40
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351460	ED	On-Demand	Anodyne	SLC12A5	46	38
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	F2	45	37
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	PRSS1	15	40
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	ACE	48	48
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	FKBP1A	25	40
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	CELA1	20	40
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	GRIN2B	27	40
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	ELANE	23	40
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	CTRA_BOVIN	52	31
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	KLK3	64	32
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	CTSB	38	43
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	TRY1_BOVIN	40	32
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	CYSP_TRYCR	36	41
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	CTSK	35	44
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	CTSL	41	44
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	PREP	79	60
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	CAPNS1	59	31
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	CELA2A	40	31
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	CTSS	33	40
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	CAPN1	59	42
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	CAPN2	78	39
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	TGM2	39	43
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	DPP7	55	38
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	NPR	67	39
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	BIRC2	17	40
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)OCc2ccccc2)C1	ZINC000819351461	ED	On-Demand	Anodyne	SLC12A5	46	38
O=C(O)C[C@H]1CCCN(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1	ZINC000819351476	GD	On-Demand	Anodyne	CASR	42	36
O=C(O)C[C@@H]1CCCN(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)C1	ZINC000819351477	GD	On-Demand	Anodyne	CASR	42	36
O=C(O)C[C@H]1CCCN(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)C1	ZINC000819351478	GD	On-Demand	Anodyne	CASR	42	36
O=C(O)C[C@@H]1CCCN(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)C1	ZINC000819351479	GD	On-Demand	Anodyne	CASR	42	36
O=C(O)C[C@@H]1CCCN(C(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2F)C1	ZINC000819351482	EF	On-Demand	Anodyne	EPHX2	21	41
O=C(O)C[C@@H]1CCCN(C(=O)N[C@H]2C[C@@H]2c2c(F)cccc2F)C1	ZINC000819351483	EF	On-Demand	Anodyne	EPHX2	21	41
O=C(O)C[C@@H]1CCCN(C(=O)N[C@H]2C[C@H]2c2c(F)cccc2F)C1	ZINC000819351484	EF	On-Demand	Anodyne	EPHX2	21	41
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2cc3ccccc3[nH]2)C1	ZINC000819351487	ED	On-Demand	Anodyne	CYP51A1	25	47
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2cc3ccccc3[nH]2)C1	ZINC000819351487	ED	On-Demand	Anodyne	PYGL	75	41
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2cc3ccccc3[nH]2)C1	ZINC000819351487	ED	On-Demand	Anodyne	PLD1	27	42
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2cc3ccccc3[nH]2)C1	ZINC000819351487	ED	On-Demand	Anodyne	PLD2	31	43
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2cc3ccccc3[nH]2)C1	ZINC000819351487	ED	On-Demand	Anodyne	AKR1C3	18	44
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2cc3ccccc3[nH]2)C1	ZINC000819351488	ED	On-Demand	Anodyne	CYP51A1	25	47
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2cc3ccccc3[nH]2)C1	ZINC000819351488	ED	On-Demand	Anodyne	PYGL	75	41
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2cc3ccccc3[nH]2)C1	ZINC000819351488	ED	On-Demand	Anodyne	PLD1	27	42
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2cc3ccccc3[nH]2)C1	ZINC000819351488	ED	On-Demand	Anodyne	PLD2	31	43
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2cc3ccccc3[nH]2)C1	ZINC000819351488	ED	On-Demand	Anodyne	AKR1C3	18	44
O=C(O)C[C@H]1CCCN(C(=O)Cc2c[nH]c3ccc(Cl)cc23)C1	ZINC000819351495	EG	On-Demand	Anodyne	HTR1D	54	40
O=C(O)C[C@H]1CCCN(C(=O)Cc2c[nH]c3ccc(Cl)cc23)C1	ZINC000819351495	EG	On-Demand	Anodyne	HTR1B	41	40
O=C(O)C[C@@H]1CCCN(C(=O)Cc2c[nH]c3ccc(Cl)cc23)C1	ZINC000819351496	EG	On-Demand	Anodyne	HTR1D	54	40
O=C(O)C[C@@H]1CCCN(C(=O)Cc2c[nH]c3ccc(Cl)cc23)C1	ZINC000819351496	EG	On-Demand	Anodyne	HTR1B	41	40
O=C(O)C[C@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C2CCOCC2)C1	ZINC000819351497	FG	On-Demand	Anodyne	REN	25	41
O=C(O)C[C@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C2CCOCC2)C1	ZINC000819351497	FG	On-Demand	Anodyne	CTSS	23	46
O=C(O)C[C@H]1CCCN(C(=O)N[C@H](c2ccccc2)C2CCOCC2)C1	ZINC000819351498	FG	On-Demand	Anodyne	REN	25	41
O=C(O)C[C@H]1CCCN(C(=O)N[C@H](c2ccccc2)C2CCOCC2)C1	ZINC000819351498	FG	On-Demand	Anodyne	CTSS	23	46
O=C(O)C[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)C2CCOCC2)C1	ZINC000819351499	FG	On-Demand	Anodyne	REN	25	41
O=C(O)C[C@@H]1CCCN(C(=O)N[C@H](c2ccccc2)C2CCOCC2)C1	ZINC000819351499	FG	On-Demand	Anodyne	CTSS	23	46
O=C(O)C[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C2CCOCC2)C1	ZINC000819351500	FG	On-Demand	Anodyne	REN	25	41
O=C(O)C[C@@H]1CCCN(C(=O)N[C@@H](c2ccccc2)C2CCOCC2)C1	ZINC000819351500	FG	On-Demand	Anodyne	CTSS	23	46
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccoc3)CC2)C1	ZINC000819351505	FD	On-Demand	Anodyne	L3MBTL3	46	35
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(C(=O)c3ccoc3)CC2)C1	ZINC000819351506	FD	On-Demand	Anodyne	L3MBTL3	46	35
O=C(O)C[C@H]1CCCN(C(=O)Cn2c(=O)cnc3ccccc32)C1	ZINC000819351507	ED	On-Demand	Anodyne	UTS2R	19	43
O=C(O)C[C@@H]1CCCN(C(=O)Cn2c(=O)cnc3ccccc32)C1	ZINC000819351508	ED	On-Demand	Anodyne	UTS2R	19	43
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2cc(F)cc(F)c2)C1	ZINC000819351515	ED	On-Demand	Anodyne	PREP	20	44
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2cc(F)cc(F)c2)C1	ZINC000819351515	ED	On-Demand	Anodyne	CACNA1I	59	35
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2cc(F)cc(F)c2)C1	ZINC000819351516	ED	On-Demand	Anodyne	PREP	20	44
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2cc(F)cc(F)c2)C1	ZINC000819351516	ED	On-Demand	Anodyne	CACNA1I	59	35
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819351525	FD	On-Demand	Anodyne	DRD4	26	44
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819351525	FD	On-Demand	Anodyne	ACHE	21	43
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819351525	FD	On-Demand	Anodyne	SIGMAR1	28	46
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819351525	FD	On-Demand	Anodyne	SSTR5	46	36
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819351525	FD	On-Demand	Anodyne	CCR3	32	46
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819351525	FD	On-Demand	Anodyne	MCHR1	36	51
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819351526	FD	On-Demand	Anodyne	DRD4	26	44
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819351526	FD	On-Demand	Anodyne	ACHE	21	43
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819351526	FD	On-Demand	Anodyne	SIGMAR1	28	46
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819351526	FD	On-Demand	Anodyne	SSTR5	46	36
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819351526	FD	On-Demand	Anodyne	CCR3	32	46
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccncc3)CC2)C1	ZINC000819351526	FD	On-Demand	Anodyne	MCHR1	36	51
O=C(O)C[C@@H]1CCCN(C(=O)CSc2ccc(C(F)(F)F)cn2)C1	ZINC000819351537	FF	On-Demand	Anodyne	LIPG	42	37
O=C(O)C[C@H]1CCCN(C(=O)CSc2ccc(C(F)(F)F)cn2)C1	ZINC000819351538	FF	On-Demand	Anodyne	LIPG	42	37
O=C(O)C[C@@H]1CCCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819351539	EC	On-Demand	Anodyne	HTR1A	19	47
O=C(O)C[C@@H]1CCCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819351539	EC	On-Demand	Anodyne	DRD2	15	46
O=C(O)C[C@@H]1CCCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819351539	EC	On-Demand	Anodyne	DRD4	33	42
O=C(O)C[C@@H]1CCCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819351539	EC	On-Demand	Anodyne	SLC27A1	35	43
O=C(O)C[C@H]1CCCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819351540	EC	On-Demand	Anodyne	HTR1A	19	47
O=C(O)C[C@H]1CCCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819351540	EC	On-Demand	Anodyne	DRD2	15	46
O=C(O)C[C@H]1CCCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819351540	EC	On-Demand	Anodyne	DRD4	33	42
O=C(O)C[C@H]1CCCN(C(=O)CN2CCN(c3ccccn3)CC2)C1	ZINC000819351540	EC	On-Demand	Anodyne	SLC27A1	35	43
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819351547	ED	On-Demand	Bother	PREP	27	51
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819351547	ED	On-Demand	Bother	CCR2	28	48
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819351548	ED	On-Demand	Bother	PREP	27	51
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819351548	ED	On-Demand	Bother	CCR2	28	48
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351551	GF	On-Demand	Anodyne	CHRM1	15	41
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351551	GF	On-Demand	Anodyne	DRD2	15	51
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351551	GF	On-Demand	Anodyne	DRD4	30	49
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351551	GF	On-Demand	Anodyne	ACHE	19	43
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351551	GF	On-Demand	Anodyne	KCNH2	20	43
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351551	GF	On-Demand	Anodyne	CHRM3	17	41
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351551	GF	On-Demand	Anodyne	SIGMAR1	43	57
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351551	GF	On-Demand	Anodyne	SSTR5	41	38
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351551	GF	On-Demand	Anodyne	CCR3	139	48
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351551	GF	On-Demand	Anodyne	MLNR	53	41
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351551	GF	On-Demand	Anodyne	CCR2	20	42
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351551	GF	On-Demand	Anodyne	MCHR1	49	51
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351551	GF	On-Demand	Anodyne	CACNA1G	43	53
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351552	GF	On-Demand	Anodyne	CHRM1	15	41
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351552	GF	On-Demand	Anodyne	DRD2	15	51
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351552	GF	On-Demand	Anodyne	DRD4	30	49
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351552	GF	On-Demand	Anodyne	ACHE	19	43
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351552	GF	On-Demand	Anodyne	KCNH2	20	43
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351552	GF	On-Demand	Anodyne	CHRM3	17	41
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351552	GF	On-Demand	Anodyne	SIGMAR1	43	57
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351552	GF	On-Demand	Anodyne	SSTR5	41	38
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351552	GF	On-Demand	Anodyne	CCR3	139	48
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351552	GF	On-Demand	Anodyne	MLNR	53	41
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351552	GF	On-Demand	Anodyne	CCR2	20	42
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351552	GF	On-Demand	Anodyne	MCHR1	49	51
O=C(O)C[C@H]1CCCN(C(=O)NC2CCN(Cc3ccc(F)cc3)CC2)C1	ZINC000819351552	GF	On-Demand	Anodyne	CACNA1G	43	53
O=C(O)C[C@H]1CCCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000819351559	FF	On-Demand	Anodyne	SLC6A1	79	41
O=C(O)C[C@H]1CCCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000819351559	FF	On-Demand	Anodyne	CCR5	28	40
O=C(O)C[C@H]1CCCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000819351559	FF	On-Demand	Anodyne	DPP7	43	36
O=C(O)C[C@@H]1CCCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000819351560	FF	On-Demand	Anodyne	SLC6A1	79	41
O=C(O)C[C@@H]1CCCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000819351560	FF	On-Demand	Anodyne	CCR5	28	40
O=C(O)C[C@@H]1CCCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000819351560	FF	On-Demand	Anodyne	DPP7	43	36
O=C(O)C[C@H]1CCCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000819351561	FF	On-Demand	Anodyne	SLC6A1	79	41
O=C(O)C[C@H]1CCCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000819351561	FF	On-Demand	Anodyne	CCR5	28	40
O=C(O)C[C@H]1CCCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000819351561	FF	On-Demand	Anodyne	DPP7	43	36
O=C(O)C[C@@H]1CCCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000819351562	FF	On-Demand	Anodyne	SLC6A1	79	41
O=C(O)C[C@@H]1CCCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000819351562	FF	On-Demand	Anodyne	CCR5	28	40
O=C(O)C[C@@H]1CCCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000819351562	FF	On-Demand	Anodyne	DPP7	43	36
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2ccc(O)cc2)C1	ZINC000819351563	DC	On-Demand	Anodyne	PREP	27	45
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2ccc(O)cc2)C1	ZINC000819351564	DC	On-Demand	Anodyne	PREP	27	45
O=C(O)C[C@H]1CCCN(C(=O)Cn2c(S)nc3ccccc3c2=O)C1	ZINC000819351569	FD	On-Demand	Anodyne	Q8MHZ5_SHEEP	61	32
O=C(O)C[C@@H]1CCCN(C(=O)Cn2c(S)nc3ccccc3c2=O)C1	ZINC000819351570	FD	On-Demand	Anodyne	Q8MHZ5_SHEEP	61	32
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2ccc3c(c2)OCO3)C1	ZINC000819351575	EC	On-Demand	Anodyne	PREP	15	45
O=C(O)C[C@H]1CCCN(C(=O)CNC(=O)c2ccc3c(c2)OCO3)C1	ZINC000819351575	EC	On-Demand	Anodyne	NOS2	63	33
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2ccc3c(c2)OCO3)C1	ZINC000819351576	EC	On-Demand	Anodyne	PREP	15	45
O=C(O)C[C@@H]1CCCN(C(=O)CNC(=O)c2ccc3c(c2)OCO3)C1	ZINC000819351576	EC	On-Demand	Anodyne	NOS2	63	33
O=C(O)C[C@H]1CCCN(C(=O)COCC(=O)NCc2cccnc2)C1	ZINC000819351577	EC	On-Demand	Anodyne	CHRNA7	45	37
O=C(O)C[C@H]1CCCN(C(=O)COCC(=O)NCc2cccnc2)C1	ZINC000819351577	EC	On-Demand	Anodyne	PREP	45	34
O=C(O)C[C@H]1CCCN(C(=O)COCC(=O)NCc2cccnc2)C1	ZINC000819351577	EC	On-Demand	Anodyne	NAMPT	54	41
O=C(O)C[C@@H]1CCCN(C(=O)COCC(=O)NCc2cccnc2)C1	ZINC000819351578	EC	On-Demand	Anodyne	CHRNA7	45	37
O=C(O)C[C@@H]1CCCN(C(=O)COCC(=O)NCc2cccnc2)C1	ZINC000819351578	EC	On-Demand	Anodyne	PREP	45	34
O=C(O)C[C@@H]1CCCN(C(=O)COCC(=O)NCc2cccnc2)C1	ZINC000819351578	EC	On-Demand	Anodyne	NAMPT	54	41
O=C(O)C[C@H]1CCCN(C(=O)Cc2cc3ccccc3o2)C1	ZINC000819351587	DF	On-Demand	Anodyne	PREP	24	60
O=C(O)C[C@@H]1CCCN(C(=O)Cc2cc3ccccc3o2)C1	ZINC000819351588	DF	On-Demand	Anodyne	PREP	24	60
O=C(O)C[C@@H]1CCCN(C(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2Cl)C1	ZINC000819351589	FG	On-Demand	Anodyne	EPHX2	24	42
O=C(O)C[C@@H]1CCCN(C(=O)N[C@H]2C[C@@H]2c2c(F)cccc2Cl)C1	ZINC000819351590	FG	On-Demand	Anodyne	EPHX2	24	42
O=C(O)C[C@@H]1CCCN(C(=O)N[C@H]2C[C@H]2c2c(F)cccc2Cl)C1	ZINC000819351591	FG	On-Demand	Anodyne	EPHX2	24	42
O=C(O)C[C@H]1CCCN(C(=O)CCn2c(S)nnc2-c2cccs2)C1	ZINC000819351592	GE	On-Demand	Anodyne	ETHR	48	42
O=C(O)C[C@@H]1CCCN(C(=O)CCn2c(S)nnc2-c2cccs2)C1	ZINC000819351593	GE	On-Demand	Anodyne	ETHR	48	42
O=C(O)C[C@@H]1CCCN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000819351594	FF	On-Demand	Anodyne	L3MBTL3	63	37
O=C(O)C[C@H]1CCCN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000819351595	FF	On-Demand	Anodyne	L3MBTL3	63	37
O=C(O)C[C@@H]1CCCN(C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000819351598	EG	On-Demand	Anodyne	REN	22	44
O=C(O)C[C@H]1CCCN(C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000819351599	EG	On-Demand	Anodyne	REN	22	44
O=C(O)C[C@@H]1CCCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000819351600	EG	On-Demand	Anodyne	REN	22	44
O=C(O)C[C@H]1CCCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000819351601	EG	On-Demand	Anodyne	REN	22	44
C[C@@H](NC[C@@H](O)c1cc2ccccc2o1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351603	FG	On-Demand	Anodyne	TPP2	60	37
C[C@H](NC[C@H](O)c1c(F)cccc1F)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351619	FF	On-Demand	Anodyne	ACE	20	40
C[C@H](NC[C@H](O)c1c(F)cccc1F)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351619	FF	On-Demand	Anodyne	DRD4	22	41
C[C@H](NC[C@H](O)c1c(F)cccc1F)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351619	FF	On-Demand	Anodyne	TPP2	66	37
C[C@H](NC[C@H](O)c1c(F)cccc1F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351620	FF	On-Demand	Anodyne	ACE	20	40
C[C@H](NC[C@H](O)c1c(F)cccc1F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351620	FF	On-Demand	Anodyne	DRD4	22	41
C[C@H](NC[C@H](O)c1c(F)cccc1F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351620	FF	On-Demand	Anodyne	TPP2	66	37
C[C@H](NC[C@H](O)C1CC1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351623	CD	On-Demand	Anodyne	ACE	31	43
C[C@H](NC[C@H](O)C1CC1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351623	CD	On-Demand	Anodyne	DRD4	23	41
C[C@H](NC[C@H](O)C1CC1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351623	CD	On-Demand	Anodyne	TPP2	70	40
C[C@H](NC[C@H](O)C1CC1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351625	CD	On-Demand	Anodyne	ACE	31	43
C[C@H](NC[C@H](O)C1CC1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351625	CD	On-Demand	Anodyne	DRD4	23	41
C[C@H](NC[C@H](O)C1CC1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351625	CD	On-Demand	Anodyne	TPP2	70	40
C[C@H](NC[C@H](O)c1ccc(C(F)(F)F)cc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351701	GH	On-Demand	Anodyne	DRD4	21	50
C[C@H](NC[C@H](O)c1ccc(C(F)(F)F)cc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351701	GH	On-Demand	Anodyne	TPP2	58	36
C[C@@H](NC[C@@H](O)c1ccc(C(F)(F)F)cc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351702	GH	On-Demand	Anodyne	DRD4	21	50
C[C@@H](NC[C@@H](O)c1ccc(C(F)(F)F)cc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351702	GH	On-Demand	Anodyne	TPP2	58	36
C[C@H](NC[C@H](O)c1ccc(C(F)(F)F)cc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351703	GH	On-Demand	Anodyne	DRD4	21	50
C[C@H](NC[C@H](O)c1ccc(C(F)(F)F)cc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351703	GH	On-Demand	Anodyne	TPP2	58	36
C[C@H](NC[C@H](O)c1ccc(F)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351709	EE	On-Demand	Anodyne	DRD4	20	42
C[C@H](NC[C@H](O)c1ccc(F)cn1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351709	EE	On-Demand	Anodyne	TPP2	64	36
C[C@H](NC[C@H](O)c1ccc(F)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351710	EE	On-Demand	Anodyne	DRD4	20	42
C[C@H](NC[C@H](O)c1ccc(F)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351710	EE	On-Demand	Anodyne	TPP2	64	36
C[C@H](NC[C@H](O)c1ccccc1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351751	FG	On-Demand	Anodyne	ACE	20	40
C[C@H](NC[C@H](O)c1ccccc1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351751	FG	On-Demand	Anodyne	DRD4	24	45
C[C@H](NC[C@H](O)c1ccccc1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351751	FG	On-Demand	Anodyne	TPP2	66	37
C[C@H](NC[C@H](O)c1ccccc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351752	FG	On-Demand	Anodyne	ACE	20	40
C[C@H](NC[C@H](O)c1ccccc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351752	FG	On-Demand	Anodyne	DRD4	24	45
C[C@H](NC[C@H](O)c1ccccc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351752	FG	On-Demand	Anodyne	TPP2	66	37
C[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351803	GE	On-Demand	Anodyne	ACE	16	40
C[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351803	GE	On-Demand	Anodyne	TPP2	54	34
C[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351805	GE	On-Demand	Anodyne	ACE	16	40
C[C@H](NC[C@H](O)CN(C)C(=O)OC(C)(C)C)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351805	GE	On-Demand	Anodyne	TPP2	54	34
C[C@@H]1CCCC[C@@H]1C(=O)NCc1ccnc2ccccc12	ZINC000819351833	CH	On-Demand	Anodyne	P2RX7	17	40
C[C@@H]1CCCC[C@@H]1C(=O)NCc1ccnc2ccccc12	ZINC000819351833	CH	On-Demand	Anodyne	ADAM17	34	46
C[C@@H]1CCCC[C@H]1C(=O)NCc1ccnc2ccccc12	ZINC000819351834	CH	On-Demand	Anodyne	P2RX7	17	40
C[C@@H]1CCCC[C@H]1C(=O)NCc1ccnc2ccccc12	ZINC000819351834	CH	On-Demand	Anodyne	ADAM17	34	46
C[C@H](NC[C@H](O)c1ccc(C#N)cc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351843	EF	On-Demand	Mild	TPP2	58	37
C[C@H](NC[C@H](O)c1ccc(C#N)cc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351845	EF	On-Demand	Mild	TPP2	58	37
O[C@@H](CN[C@@H]1CCO[C@@H](c2ccccn2)C1)c1ccccc1Cl	ZINC000819351869	EG	On-Demand	Anodyne	OPRL1	15	43
O=C(NCCCOC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819351870	FH	On-Demand	Anodyne	ACHE	42	42
O=C(NCCCOC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819351870	FH	On-Demand	Anodyne	HRH2	30	41
O=C(NCCCOC1CCN(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819351870	FH	On-Demand	Anodyne	SIGMAR1	50	54
C[C@H](NC[C@H](O)c1ccc(F)cc1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351875	GG	On-Demand	Anodyne	DRD4	22	44
C[C@H](NC[C@H](O)c1ccc(F)cc1Cl)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351875	GG	On-Demand	Anodyne	TPP2	61	34
C[C@H](NC[C@H](O)c1ccc(F)cc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351876	GG	On-Demand	Anodyne	DRD4	22	44
C[C@H](NC[C@H](O)c1ccc(F)cc1Cl)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351876	GG	On-Demand	Anodyne	TPP2	61	34
CC(C)c1nn(-c2ccccc2)cc1C(=O)Nc1ccc(CN(C)C)c(F)c1	ZINC000819351888	GI	On-Demand	Anodyne	NPY2R	53	36
C[C@H](NC[C@H](O)c1ccccc1C(F)(F)F)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351919	GH	On-Demand	Anodyne	DRD4	21	41
C[C@H](NC[C@H](O)c1ccccc1C(F)(F)F)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351919	GH	On-Demand	Anodyne	TPP2	58	36
C[C@H](NC[C@H](O)c1ccccc1C(F)(F)F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351920	GH	On-Demand	Anodyne	DRD4	21	41
C[C@H](NC[C@H](O)c1ccccc1C(F)(F)F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351920	GH	On-Demand	Anodyne	TPP2	58	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccnc2ccccc12	ZINC000819351936	EF	On-Demand	Anodyne	ACACB	15	42
C[C@H](NC[C@H](O)c1cc(F)ccc1F)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351941	FF	On-Demand	Anodyne	DRD4	23	43
C[C@H](NC[C@H](O)c1cc(F)ccc1F)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819351941	FF	On-Demand	Anodyne	TPP2	63	35
C[C@H](NC[C@H](O)c1cc(F)ccc1F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351943	FF	On-Demand	Anodyne	DRD4	23	43
C[C@H](NC[C@H](O)c1cc(F)ccc1F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351943	FF	On-Demand	Anodyne	TPP2	63	35
C[C@@H]1C[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c2nccn21	ZINC000819351955	FE	On-Demand	Anodyne	GPR119	44	40
C[C@@H]1C[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c2nccn21	ZINC000819351957	FE	On-Demand	Anodyne	GPR119	44	40
C[C@@H](NCCC(=O)Nc1ccc(N(C)C)cc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819351988	GG	On-Demand	Anodyne	TPP2	56	37
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352006	FG	On-Demand	Anodyne	ACE	20	40
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352006	FG	On-Demand	Anodyne	DRD4	28	48
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352006	FG	On-Demand	Anodyne	TPP2	67	37
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352009	FG	On-Demand	Anodyne	ACE	20	40
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352009	FG	On-Demand	Anodyne	DRD4	28	48
C[C@H](NC[C@H](O)c1ccc(Cl)cc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352009	FG	On-Demand	Anodyne	TPP2	67	37
COc1cccc([S@@](=O)CC(=O)Nc2ccc(CN(C)C)c(F)c2)c1	ZINC000819352051	FF	On-Demand	Anodyne	MTNR1A	24	43
COc1cccc([S@@](=O)CC(=O)Nc2ccc(CN(C)C)c(F)c2)c1	ZINC000819352051	FF	On-Demand	Anodyne	MTNR1B	29	43
O[C@H](CN[C@@H]1CCO[C@H](c2cccs2)C1)c1cccnc1	ZINC000819352145	DF	On-Demand	Anodyne	ADRB3	47	41
O[C@H](CN[C@@H]1CCO[C@@H](c2cccs2)C1)c1cccnc1	ZINC000819352146	DF	On-Demand	Anodyne	ADRB3	47	41
O[C@H](CN[C@H]1CCO[C@@H](c2cccs2)C1)c1cccnc1	ZINC000819352147	DF	On-Demand	Anodyne	ADRB3	47	41
O[C@H](CN[C@H]1CCO[C@H](c2cccs2)C1)c1cccnc1	ZINC000819352148	DF	On-Demand	Anodyne	ADRB3	47	41
O[C@H](CN[C@H]1CCO[C@@H](c2cccs2)C1)c1cccc(Cl)c1	ZINC000819352185	EH	On-Demand	Anodyne	ADRB3	39	43
O[C@H](CN[C@@H]1CCO[C@@H](c2cccs2)C1)c1cccc(Cl)c1	ZINC000819352186	EH	On-Demand	Anodyne	ADRB3	39	43
O[C@H](CN[C@@H]1CCO[C@H](c2cccs2)C1)c1cccc(Cl)c1	ZINC000819352187	EH	On-Demand	Anodyne	ADRB3	39	43
O[C@H](CN[C@H]1CCO[C@H](c2cccs2)C1)c1cccc(Cl)c1	ZINC000819352189	EH	On-Demand	Anodyne	ADRB3	39	43
Cc1cc(CNCCC(=O)Nc2cccnc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819352226	GH	On-Demand	Anodyne	NAMPT	18	52
Cc1ccc(F)c(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819352273	FE	On-Demand	Anodyne	ADRB2	40	43
Cc1ccc(F)c(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819352273	FE	On-Demand	Anodyne	ADRB3	80	40
Cc1ccc(F)c(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819352274	FE	On-Demand	Anodyne	ADRB2	40	43
Cc1ccc(F)c(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819352274	FE	On-Demand	Anodyne	ADRB3	80	40
C[C@@H](Cc1cnn(C)c1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819352289	FD	On-Demand	Anodyne	GPR119	44	44
C[C@@H](Cc1cnn(C)c1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819352290	FD	On-Demand	Anodyne	GPR119	44	44
CNC(=O)c1cc(Oc2cc(NC(=O)C(F)=C3CCC3)ccc2C)ccn1	ZINC000819352291	FH	On-Demand	Anodyne	RAF1	65	47
CNC(=O)c1cc(Oc2cc(NC(=O)C(F)=C3CCC3)ccc2C)ccn1	ZINC000819352291	FH	On-Demand	Anodyne	KDR	16	41
Cc1ccc(F)c(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819352292	CF	On-Demand	Anodyne	ADRB2	47	48
Cc1ccc(F)c(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819352292	CF	On-Demand	Anodyne	ADRB1	50	43
Cc1ccc(F)c(CCNC[C@@H](O)c2ccccc2)c1	ZINC000819352292	CF	On-Demand	Anodyne	ADRB3	87	44
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819352326	GF	On-Demand	Anodyne	TGM2	45	47
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819352326	GF	On-Demand	Anodyne	F13A1	70	47
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819352327	GF	On-Demand	Anodyne	TGM2	45	47
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819352327	GF	On-Demand	Anodyne	F13A1	70	47
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819352328	GF	On-Demand	Anodyne	TGM2	45	47
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819352328	GF	On-Demand	Anodyne	F13A1	70	47
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819352329	GF	On-Demand	Anodyne	TGM2	45	47
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819352329	GF	On-Demand	Anodyne	F13A1	70	47
C[C@@H](NCCS(C)(=O)=O)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352346	DC	On-Demand	Anodyne	ACE	25	44
C[C@@H](NCCS(C)(=O)=O)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352346	DC	On-Demand	Anodyne	DRD4	23	40
C[C@@H](NCCS(C)(=O)=O)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352346	DC	On-Demand	Anodyne	TPP2	69	44
O[C@@H](CN[C@@H]1CCO[C@@H](c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819352347	EG	On-Demand	Anodyne	ADRB1	23	44
O[C@@H](CN[C@@H]1CCO[C@@H](c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819352347	EG	On-Demand	Anodyne	ADRB3	39	45
O[C@@H](CN[C@@H]1CCO[C@@H](c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819352347	EG	On-Demand	Anodyne	CYP3A4	40	33
O[C@H](CN[C@@H]1CCO[C@@H](c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819352348	EG	On-Demand	Anodyne	ADRB1	23	44
O[C@H](CN[C@@H]1CCO[C@@H](c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819352348	EG	On-Demand	Anodyne	ADRB3	39	45
O[C@H](CN[C@@H]1CCO[C@@H](c2ccccn2)C1)c1cccc(Cl)c1	ZINC000819352348	EG	On-Demand	Anodyne	CYP3A4	40	33
C[C@H](NC[C@H](O)c1cccc(F)c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352351	EF	On-Demand	Anodyne	DRD4	21	48
C[C@H](NC[C@H](O)c1cccc(F)c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352351	EF	On-Demand	Anodyne	TPP2	68	37
C[C@H](NC[C@H](O)c1cccc(F)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352352	EF	On-Demand	Anodyne	DRD4	21	48
C[C@H](NC[C@H](O)c1cccc(F)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352352	EF	On-Demand	Anodyne	TPP2	68	37
C[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352374	GH	On-Demand	Anodyne	DRD4	20	44
C[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352374	GH	On-Demand	Anodyne	TPP2	54	34
C[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352375	GH	On-Demand	Anodyne	DRD4	20	44
C[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352375	GH	On-Demand	Anodyne	TPP2	54	34
Cc1cc(CNC[C@@H](O)c2cccnc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819352409	FH	On-Demand	Anodyne	ADRB2	23	42
Cc1cc(CNC[C@@H](O)c2cccnc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819352409	FH	On-Demand	Anodyne	ADRB1	30	42
Cc1cc(CNC[C@@H](O)c2cccnc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819352409	FH	On-Demand	Anodyne	ADRB3	99	48
Cc1cc(CNC[C@H](O)c2cccnc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819352410	FH	On-Demand	Anodyne	ADRB2	23	42
Cc1cc(CNC[C@H](O)c2cccnc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819352410	FH	On-Demand	Anodyne	ADRB1	30	42
Cc1cc(CNC[C@H](O)c2cccnc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819352410	FH	On-Demand	Anodyne	ADRB3	99	48
C[C@@H](Cc1cnn(C)c1)NC[C@@H](O)c1ccccc1	ZINC000819352433	CD	On-Demand	Anodyne	ADRB2	40	38
C[C@@H](Cc1cnn(C)c1)NC[C@@H](O)c1ccccc1	ZINC000819352433	CD	On-Demand	Anodyne	ADRB1	22	54
C[C@@H](Cc1cnn(C)c1)NC[C@@H](O)c1ccccc1	ZINC000819352433	CD	On-Demand	Anodyne	ADRB3	51	54
C[C@@H](Cc1cnn(C)c1)NC[C@H](O)c1ccccc1	ZINC000819352434	CD	On-Demand	Anodyne	ADRB2	40	38
C[C@@H](Cc1cnn(C)c1)NC[C@H](O)c1ccccc1	ZINC000819352434	CD	On-Demand	Anodyne	ADRB1	22	54
C[C@@H](Cc1cnn(C)c1)NC[C@H](O)c1ccccc1	ZINC000819352434	CD	On-Demand	Anodyne	ADRB3	51	54
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819352457	GI	On-Demand	Anodyne	ADRB1	57	46
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819352457	GI	On-Demand	Anodyne	ADRB3	71	46
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819352457	GI	On-Demand	Anodyne	CYP3A4	45	33
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819352458	GI	On-Demand	Anodyne	ADRB1	57	46
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819352458	GI	On-Demand	Anodyne	ADRB3	71	46
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819352458	GI	On-Demand	Anodyne	CYP3A4	45	33
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819352459	GI	On-Demand	Anodyne	ADRB1	57	46
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819352459	GI	On-Demand	Anodyne	ADRB3	71	46
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819352459	GI	On-Demand	Anodyne	CYP3A4	45	33
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819352460	GI	On-Demand	Anodyne	ADRB1	57	46
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819352460	GI	On-Demand	Anodyne	ADRB3	71	46
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819352460	GI	On-Demand	Anodyne	CYP3A4	45	33
Cc1ccc(F)c(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819352473	CG	On-Demand	Anodyne	ADRB2	38	40
Cc1ccc(F)c(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819352473	CG	On-Demand	Anodyne	ADRB1	38	45
Cc1ccc(F)c(CCNC[C@H](O)c2cccc(F)c2)c1	ZINC000819352473	CG	On-Demand	Anodyne	ADRB3	63	45
Cc1ccc(F)c(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819352474	CG	On-Demand	Anodyne	ADRB2	38	40
Cc1ccc(F)c(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819352474	CG	On-Demand	Anodyne	ADRB1	38	45
Cc1ccc(F)c(CCNC[C@@H](O)c2cccc(F)c2)c1	ZINC000819352474	CG	On-Demand	Anodyne	ADRB3	63	45
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819352481	GG	On-Demand	Anodyne	MC4R	15	42
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)Cc1ccc(F)cc1	ZINC000819352482	GG	On-Demand	Anodyne	MC4R	15	42
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)Cc1ccc(F)cc1	ZINC000819352483	GG	On-Demand	Anodyne	MC4R	15	42
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)Cc1ccc(F)cc1	ZINC000819352484	GG	On-Demand	Anodyne	MC4R	15	42
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNCCS(=O)(=O)c1ccccc1	ZINC000819352488	GG	On-Demand	Anodyne	SFRP1	87	41
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNCCS(=O)(=O)c1ccccc1	ZINC000819352488	GG	On-Demand	Anodyne	WNT3	73	41
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNCCS(=O)(=O)c1ccccc1	ZINC000819352489	GG	On-Demand	Anodyne	SFRP1	87	41
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNCCS(=O)(=O)c1ccccc1	ZINC000819352489	GG	On-Demand	Anodyne	WNT3	73	41
C[C@H](NC[C@H](O)c1ccccc1F)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352513	EF	On-Demand	Anodyne	ACE	21	40
C[C@H](NC[C@H](O)c1ccccc1F)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352513	EF	On-Demand	Anodyne	DRD4	23	43
C[C@H](NC[C@H](O)c1ccccc1F)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352513	EF	On-Demand	Anodyne	TPP2	67	38
C[C@H](NC[C@H](O)c1ccccc1F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352514	EF	On-Demand	Anodyne	ACE	21	40
C[C@H](NC[C@H](O)c1ccccc1F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352514	EF	On-Demand	Anodyne	DRD4	23	43
C[C@H](NC[C@H](O)c1ccccc1F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352514	EF	On-Demand	Anodyne	TPP2	67	38
Cc1cccc2c1N(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819352535	FG	On-Demand	Mild	PAPA1_CARPA	36	40
Cc1cccc2c1N(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC2	ZINC000819352536	FG	On-Demand	Mild	PAPA1_CARPA	36	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNCCC(=O)Nc1cccc(F)c1	ZINC000819352618	GH	On-Demand	Anodyne	CCR3	29	42
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNCCC(=O)Nc1cccc(F)c1	ZINC000819352619	GH	On-Demand	Anodyne	CCR3	29	42
Cc1ccc(F)c(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819352630	DF	On-Demand	Bother	ADRB1	34	43
Cc1ccc(F)c(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819352630	DF	On-Demand	Bother	ADRB3	59	43
Cc1ccc(F)c(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819352630	DF	On-Demand	Bother	CACNA1D	59	34
Cc1ccc(F)c(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819352631	DF	On-Demand	Bother	ADRB1	34	43
Cc1ccc(F)c(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819352631	DF	On-Demand	Bother	ADRB3	59	43
Cc1ccc(F)c(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819352631	DF	On-Demand	Bother	CACNA1D	59	34
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)c1c(F)cccc1F	ZINC000819352649	GH	On-Demand	Anodyne	GPR119	15	41
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)c1c(F)cccc1F	ZINC000819352650	GH	On-Demand	Anodyne	GPR119	15	41
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)c1c(F)cccc1F	ZINC000819352651	GH	On-Demand	Anodyne	GPR119	15	41
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)c1c(F)cccc1F	ZINC000819352652	GH	On-Demand	Anodyne	GPR119	15	41
COc1cccc([S@@](=O)CC(=O)NCc2ccc([C@@H](C)O)cc2)c1	ZINC000819352664	EE	On-Demand	Anodyne	MTNR1A	38	41
COc1cccc([S@@](=O)CC(=O)NCc2ccc([C@@H](C)O)cc2)c1	ZINC000819352664	EE	On-Demand	Anodyne	MTNR1B	38	41
COc1cccc([S@@](=O)CC(=O)NCc2ccc([C@@H](C)O)cc2)c1	ZINC000819352664	EE	On-Demand	Anodyne	PDS	46	39
COc1cccc([S@@](=O)CC(=O)NCc2ccc([C@H](C)O)cc2)c1	ZINC000819352666	EE	On-Demand	Anodyne	MTNR1A	38	41
COc1cccc([S@@](=O)CC(=O)NCc2ccc([C@H](C)O)cc2)c1	ZINC000819352666	EE	On-Demand	Anodyne	MTNR1B	38	41
COc1cccc([S@@](=O)CC(=O)NCc2ccc([C@H](C)O)cc2)c1	ZINC000819352666	EE	On-Demand	Anodyne	PDS	46	39
CC(=O)Nc1cccc(CC(=O)NCc2ccc([C@@H](C)O)cc2)c1	ZINC000819352672	EF	On-Demand	Anodyne	ADRB2	51	44
CC(=O)Nc1cccc(CC(=O)NCc2ccc([C@@H](C)O)cc2)c1	ZINC000819352672	EF	On-Demand	Anodyne	PTGIR	16	42
CC(=O)Nc1cccc(CC(=O)NCc2ccc([C@@H](C)O)cc2)c1	ZINC000819352672	EF	On-Demand	Anodyne	KCNK3	45	31
CC(=O)Nc1cccc(CC(=O)NCc2ccc([C@@H](C)O)cc2)c1	ZINC000819352672	EF	On-Demand	Anodyne	KCNK9	42	31
CC(=O)Nc1cccc(CC(=O)NCc2ccc([C@H](C)O)cc2)c1	ZINC000819352673	EF	On-Demand	Anodyne	ADRB2	51	44
CC(=O)Nc1cccc(CC(=O)NCc2ccc([C@H](C)O)cc2)c1	ZINC000819352673	EF	On-Demand	Anodyne	PTGIR	16	42
CC(=O)Nc1cccc(CC(=O)NCc2ccc([C@H](C)O)cc2)c1	ZINC000819352673	EF	On-Demand	Anodyne	KCNK3	45	31
CC(=O)Nc1cccc(CC(=O)NCc2ccc([C@H](C)O)cc2)c1	ZINC000819352673	EF	On-Demand	Anodyne	KCNK9	42	31
C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819352685	FH	On-Demand	Mild	PAPA1_CARPA	34	44
C[C@@H]1CC(C)(C)CC[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819352687	FH	On-Demand	Mild	PAPA1_CARPA	34	44
C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819352689	FH	On-Demand	Mild	PAPA1_CARPA	34	44
C[C@@H]1CC(C)(C)CC[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819352691	FH	On-Demand	Mild	PAPA1_CARPA	34	44
Cn1cc([C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)(C)C)cn1	ZINC000819352768	GG	On-Demand	Mild	PAPA1_CARPA	39	43
Cn1cc([C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)(C)C)cn1	ZINC000819352769	GG	On-Demand	Mild	PAPA1_CARPA	39	43
Cn1cc([C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)(C)C)cn1	ZINC000819352770	GG	On-Demand	Mild	PAPA1_CARPA	39	43
Cn1cc([C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)(C)C)cn1	ZINC000819352771	GG	On-Demand	Mild	PAPA1_CARPA	39	43
C[C@H](NC[C@H](O)c1ccc(Cl)c(F)c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352791	GG	On-Demand	Anodyne	DRD4	23	46
C[C@H](NC[C@H](O)c1ccc(Cl)c(F)c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352791	GG	On-Demand	Anodyne	TPP2	63	35
C[C@H](NC[C@H](O)c1ccc(Cl)c(F)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352792	GG	On-Demand	Anodyne	DRD4	23	46
C[C@H](NC[C@H](O)c1ccc(Cl)c(F)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352792	GG	On-Demand	Anodyne	TPP2	63	35
CON(C)C(=O)CCN[C@H](C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352799	DD	On-Demand	Anodyne	ACE	25	43
CON(C)C(=O)CCN[C@H](C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352799	DD	On-Demand	Anodyne	TPP2	64	39
CON(C)C(=O)CCN[C@@H](C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352800	DD	On-Demand	Anodyne	ACE	25	43
CON(C)C(=O)CCN[C@@H](C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352800	DD	On-Demand	Anodyne	TPP2	64	39
CON(C)C(=O)CCN[C@H](C)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352801	DD	On-Demand	Anodyne	ACE	25	43
CON(C)C(=O)CCN[C@H](C)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352801	DD	On-Demand	Anodyne	TPP2	64	39
CON(C)C(=O)CCN[C@@H](C)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352802	DD	On-Demand	Anodyne	ACE	25	43
CON(C)C(=O)CCN[C@@H](C)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352802	DD	On-Demand	Anodyne	TPP2	64	39
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352821	FG	On-Demand	Anodyne	ADRB1	29	43
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352821	FG	On-Demand	Anodyne	DRD4	23	48
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352821	FG	On-Demand	Anodyne	ADRB3	46	43
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819352821	FG	On-Demand	Anodyne	TPP2	65	36
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352822	FG	On-Demand	Anodyne	ADRB1	29	43
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352822	FG	On-Demand	Anodyne	DRD4	23	48
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352822	FG	On-Demand	Anodyne	ADRB3	46	43
C[C@H](NC[C@H](O)c1cccc(Cl)c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819352822	FG	On-Demand	Anodyne	TPP2	65	36
CN1[C@H]2CC[C@H]1CC(NC[C@@H](O)c1cc3ccccc3o1)C2	ZINC000819352855	DF	On-Demand	Anodyne	SLC6A3	17	40
CN1[C@H]2CC[C@H]1CC(NC[C@@H](O)c1cc3ccccc3o1)C2	ZINC000819352855	DF	On-Demand	Anodyne	GLRA1	46	38
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1c(F)cccc1Cl	ZINC000819352874	CG	On-Demand	Anodyne	KCNQ2	47	35
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1c(F)cccc1Cl	ZINC000819352876	CG	On-Demand	Anodyne	KCNQ2	47	35
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1c(F)cccc1Cl	ZINC000819352878	CG	On-Demand	Anodyne	KCNQ2	47	35
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1c(F)cccc1Cl	ZINC000819352880	CG	On-Demand	Anodyne	KCNQ2	47	35
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)c1cccc(F)c1	ZINC000819352894	FH	On-Demand	Anodyne	ADRB1	36	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)c1cccc(F)c1	ZINC000819352894	FH	On-Demand	Anodyne	ADRB3	45	40
O=C(/C=C\[C@H]1CCCO1)NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000819352895	FF	On-Demand	Anodyne	ACHE	33	41
O=C(/C=C\[C@H]1CCCO1)NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000819352895	FF	On-Demand	Anodyne	SIGMAR1	36	49
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)c1cccc(F)c1	ZINC000819352896	FH	On-Demand	Anodyne	ADRB1	36	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)c1cccc(F)c1	ZINC000819352896	FH	On-Demand	Anodyne	ADRB3	45	40
O=C(/C=C\[C@@H]1CCCO1)NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000819352897	FF	On-Demand	Anodyne	ACHE	33	41
O=C(/C=C\[C@@H]1CCCO1)NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000819352897	FF	On-Demand	Anodyne	SIGMAR1	36	49
O=C(/C=C/[C@H]1CCCO1)NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000819352898	FF	On-Demand	Anodyne	ACHE	33	41
O=C(/C=C/[C@H]1CCCO1)NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000819352898	FF	On-Demand	Anodyne	SIGMAR1	36	49
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)c1cccc(F)c1	ZINC000819352899	FH	On-Demand	Anodyne	ADRB1	36	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)c1cccc(F)c1	ZINC000819352899	FH	On-Demand	Anodyne	ADRB3	45	40
O=C(/C=C/[C@@H]1CCCO1)NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000819352900	FF	On-Demand	Anodyne	ACHE	33	41
O=C(/C=C/[C@@H]1CCCO1)NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000819352900	FF	On-Demand	Anodyne	SIGMAR1	36	49
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)c1cccc(F)c1	ZINC000819352901	FH	On-Demand	Anodyne	ADRB1	36	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)c1cccc(F)c1	ZINC000819352901	FH	On-Demand	Anodyne	ADRB3	45	40
CN(C)c1ccc(NC(=O)CCNC2C[C@@H]3CC[C@H](C2)N3C)cc1	ZINC000819352944	EE	On-Demand	Anodyne	SLC6A3	24	41
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)c1cc(F)ccc1F	ZINC000819352946	GH	On-Demand	Anodyne	GPR119	16	42
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)c1cc(F)ccc1F	ZINC000819352948	GH	On-Demand	Anodyne	GPR119	16	42
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)c1cc(F)ccc1F	ZINC000819352950	GH	On-Demand	Anodyne	GPR119	16	42
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)c1cc(F)ccc1F	ZINC000819352952	GH	On-Demand	Anodyne	GPR119	16	42
O=C(NC[C@H]1CCCN(C(=O)C(F)=C2CCC2)C1)c1ccccc1	ZINC000819353038	EG	On-Demand	Anodyne	PREP	28	44
O=C(NC[C@H]1CCCN(C(=O)C(F)=C2CCC2)C1)c1ccccc1	ZINC000819353038	EG	On-Demand	Anodyne	CACNA1I	61	33
C[C@H](NC[C@H](O)c1cccnc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819353062	EE	On-Demand	Anodyne	ADRB1	17	43
C[C@H](NC[C@H](O)c1cccnc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819353062	EE	On-Demand	Anodyne	ACE	15	41
C[C@H](NC[C@H](O)c1cccnc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819353062	EE	On-Demand	Anodyne	ADRB3	57	43
C[C@H](NC[C@H](O)c1cccnc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819353062	EE	On-Demand	Anodyne	TPP2	66	37
C[C@H](NC[C@H](O)c1cccnc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819353063	EE	On-Demand	Anodyne	ADRB1	17	43
C[C@H](NC[C@H](O)c1cccnc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819353063	EE	On-Demand	Anodyne	ACE	15	41
C[C@H](NC[C@H](O)c1cccnc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819353063	EE	On-Demand	Anodyne	ADRB3	57	43
C[C@H](NC[C@H](O)c1cccnc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819353063	EE	On-Demand	Anodyne	TPP2	66	37
C[C@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819353083	GE	On-Demand	Anodyne	ACE	19	41
C[C@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819353083	GE	On-Demand	Anodyne	TPP2	59	39
C[C@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819353088	GE	On-Demand	Anodyne	ACE	19	41
C[C@H](NC[C@H](O)CCNC(=O)OC(C)(C)C)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819353088	GE	On-Demand	Anodyne	TPP2	59	39
Cc1cc(CNC[C@H](O)COc2ccccc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819353117	GH	On-Demand	Anodyne	ADRB2	51	45
Cc1cc(CNC[C@H](O)COc2ccccc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819353117	GH	On-Demand	Anodyne	ADRB1	78	49
Cc1cc(CNC[C@H](O)COc2ccccc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819353117	GH	On-Demand	Anodyne	ADRB3	48	49
Cc1cc(CNC[C@H](O)COc2ccccc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819353117	GH	On-Demand	Anodyne	PDS	68	37
Cc1cc(CNC[C@@H](O)COc2ccccc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819353122	GH	On-Demand	Anodyne	ADRB2	51	45
Cc1cc(CNC[C@@H](O)COc2ccccc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819353122	GH	On-Demand	Anodyne	ADRB1	78	49
Cc1cc(CNC[C@@H](O)COc2ccccc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819353122	GH	On-Demand	Anodyne	ADRB3	48	49
Cc1cc(CNC[C@@H](O)COc2ccccc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819353122	GH	On-Demand	Anodyne	PDS	68	37
O[C@H](CN[C@@H]1CCO[C@@H](c2ccccn2)C1)c1ccc(Cl)c(F)c1	ZINC000819353131	FG	On-Demand	Anodyne	MAPK1	40	38
O[C@@H](CN[C@@H]1CCO[C@@H](c2ccccn2)C1)c1ccc(Cl)c(F)c1	ZINC000819353132	FG	On-Demand	Anodyne	MAPK1	40	38
C[C@@H](Cc1cnn(C)c1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819353141	DD	On-Demand	Bother	ADRB2	44	36
C[C@@H](Cc1cnn(C)c1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819353141	DD	On-Demand	Bother	ADRB1	24	42
C[C@@H](Cc1cnn(C)c1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819353141	DD	On-Demand	Bother	ADRB3	48	42
C[C@@H](Cc1cnn(C)c1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819353142	DD	On-Demand	Bother	ADRB2	44	36
C[C@@H](Cc1cnn(C)c1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819353142	DD	On-Demand	Bother	ADRB1	24	42
C[C@@H](Cc1cnn(C)c1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819353142	DD	On-Demand	Bother	ADRB3	48	42
Cc1ccc(F)c(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819353205	CG	On-Demand	Anodyne	ADRB2	28	42
Cc1ccc(F)c(CCNC[C@H](O)c2ccccc2F)c1	ZINC000819353205	CG	On-Demand	Anodyne	ADRB1	24	42
Cc1ccc(F)c(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819353206	CG	On-Demand	Anodyne	ADRB2	28	42
Cc1ccc(F)c(CCNC[C@@H](O)c2ccccc2F)c1	ZINC000819353206	CG	On-Demand	Anodyne	ADRB1	24	42
C=CCONC[C@@H](O)COc1ccc(SC)cc1	ZINC000819353241	CD	On-Demand	Mild	ADRB2	21	42
C=CCONC[C@@H](O)COc1ccc(SC)cc1	ZINC000819353241	CD	On-Demand	Mild	ADRB1	24	40
C=CCONC[C@H](O)COc1ccc(SC)cc1	ZINC000819353243	CD	On-Demand	Mild	ADRB2	21	42
C=CCONC[C@H](O)COc1ccc(SC)cc1	ZINC000819353243	CD	On-Demand	Mild	ADRB1	24	40
C=CCONC[C@@H](O)c1cccc(Cl)c1	ZINC000819353268	BE	On-Demand	Mild	ADRB1	31	44
C=CCONC[C@@H](O)c1cccc(Cl)c1	ZINC000819353268	BE	On-Demand	Mild	ADRB3	46	44
C=CCONC[C@H](O)c1cccc(Cl)c1	ZINC000819353269	BE	On-Demand	Mild	ADRB1	31	44
C=CCONC[C@H](O)c1cccc(Cl)c1	ZINC000819353269	BE	On-Demand	Mild	ADRB3	46	44
CC[C@@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000819353272	CG	On-Demand	Bother	CACNA1C	40	36
CC[C@@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000819353272	CG	On-Demand	Bother	CACNA1D	62	34
CC[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000819353275	CG	On-Demand	Bother	CACNA1C	40	36
CC[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000819353275	CG	On-Demand	Bother	CACNA1D	62	34
C=CCONCCC(=O)Nc1cccc(Br)c1	ZINC000819353303	CE	On-Demand	Mild	EGFR	49	44
C=CCONCCC(=O)Nc1cccc(Br)c1	ZINC000819353303	CE	On-Demand	Mild	HDAC10	29	44
C=CCONCCC(=O)Nc1cccc(Br)c1	ZINC000819353303	CE	On-Demand	Mild	HDAC2	18	44
C=CCONCCC(=O)Nc1cccc(Br)c1	ZINC000819353303	CE	On-Demand	Mild	HDAC6	28	43
O[C@@H](CNC1CCN(C2CCC2)CC1)c1cccc(C(F)(F)F)c1	ZINC000819353304	EG	On-Demand	Anodyne	TACR1	21	41
O[C@@H](CNC1CCN(C2CCC2)CC1)c1cccc(C(F)(F)F)c1	ZINC000819353304	EG	On-Demand	Anodyne	CCR2	53	43
O[C@H](CNC1CCN(C2CCC2)CC1)c1cccc(C(F)(F)F)c1	ZINC000819353306	EG	On-Demand	Anodyne	TACR1	21	41
O[C@H](CNC1CCN(C2CCC2)CC1)c1cccc(C(F)(F)F)c1	ZINC000819353306	EG	On-Demand	Anodyne	CCR2	53	43
C=CCONC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819353365	CE	On-Demand	Mild	ADRB2	29	43
C=CCONC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819353365	CE	On-Demand	Mild	ADRB1	32	41
C=CCONC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819353366	CE	On-Demand	Mild	ADRB2	29	43
C=CCONC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819353366	CE	On-Demand	Mild	ADRB1	32	41
C=CCONCCC(=O)Nc1ccc(Br)cc1	ZINC000819353409	CE	On-Demand	Mild	HDAC3	15	40
C=CCONC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819353437	CE	On-Demand	Mild	ADRB2	17	48
C=CCONC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819353438	CE	On-Demand	Mild	ADRB2	17	48
O[C@@H](CNC1CCN(C2CCC2)CC1)c1ccccc1Cl	ZINC000819353447	DF	On-Demand	Anodyne	OPRL1	52	41
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819353459	DF	On-Demand	Anodyne	ACE	34	46
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819353459	DF	On-Demand	Anodyne	DRD4	23	40
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819353459	DF	On-Demand	Anodyne	TPP2	64	40
C[C@@H](NC[C@@H](O)c1ccccc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819353462	DF	On-Demand	Anodyne	ACE	34	46
C[C@@H](NC[C@@H](O)c1ccccc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819353462	DF	On-Demand	Anodyne	DRD4	23	40
C[C@@H](NC[C@@H](O)c1ccccc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819353462	DF	On-Demand	Anodyne	TPP2	64	40
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819353463	DF	On-Demand	Anodyne	ACE	34	46
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819353463	DF	On-Demand	Anodyne	DRD4	23	40
C[C@H](NC[C@H](O)c1ccccc1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819353463	DF	On-Demand	Anodyne	TPP2	64	40
C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819353496	FF	On-Demand	Bother	DRD4	20	43
C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000819353496	FF	On-Demand	Bother	TPP2	53	34
C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819353497	FF	On-Demand	Bother	DRD4	20	43
C[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000819353497	FF	On-Demand	Bother	TPP2	53	34
Cc1cc(-c2csc(NC(=O)/C=C\[C@H]3CCCO3)n2)c(F)cc1F	ZINC000819353534	FI	On-Demand	Anodyne	MPL	49	36
Cc1cc(-c2csc(NC(=O)/C=C/[C@H]3CCCO3)n2)c(F)cc1F	ZINC000819353537	FI	On-Demand	Anodyne	MPL	49	36
Cc1cc(-c2csc(NC(=O)/C=C\[C@@H]3CCCO3)n2)c(F)cc1F	ZINC000819353539	FI	On-Demand	Anodyne	MPL	49	36
Cc1cc(-c2csc(NC(=O)/C=C/[C@@H]3CCCO3)n2)c(F)cc1F	ZINC000819353541	FI	On-Demand	Anodyne	MPL	49	36
CN(C)Cc1ccnc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819353580	GF	On-Demand	Mild	PAPA1_CARPA	44	42
CN(C)Cc1ccnc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819353583	GF	On-Demand	Mild	PAPA1_CARPA	44	42
C=CCONC[C@H](O)COc1ccc2ccccc2c1	ZINC000819353592	CE	On-Demand	Mild	ADRB2	31	60
C=CCONC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819353593	CE	On-Demand	Mild	ADRB2	31	60
O[C@@H](CNC1CCN(C2CCC2)CC1)c1ccc(F)cc1	ZINC000819353606	CE	On-Demand	Anodyne	SLC6A3	20	47
O[C@H](CNC1CCN(C2CCC2)CC1)c1ccc(F)cc1	ZINC000819353608	CE	On-Demand	Anodyne	SLC6A3	20	47
C=CCONCCC(=O)Nc1cccnc1	ZINC000819353638	BD	On-Demand	Mild	NAMPT	18	42
C=CCONC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819353642	CD	On-Demand	Mild	ADRB2	31	46
C=CCONC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819353642	CD	On-Demand	Mild	ADRB1	48	45
C=CCONC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819353642	CD	On-Demand	Mild	ADRB3	21	40
C=CCONC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819353643	CD	On-Demand	Mild	ADRB2	31	46
C=CCONC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819353643	CD	On-Demand	Mild	ADRB1	48	45
C=CCONC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819353643	CD	On-Demand	Mild	ADRB3	21	40
C=CCONC[C@@H](O)COCc1ccccc1OC	ZINC000819353650	CD	On-Demand	Mild	ADRB2	15	44
C=CCONC[C@H](O)COCc1ccccc1OC	ZINC000819353651	CD	On-Demand	Mild	ADRB2	15	44
CN1[C@H]2CC[C@H]1CC(NC[C@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819353669	DD	On-Demand	Bother	CHRM1	16	46
CN1[C@H]2CC[C@H]1CC(NC[C@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819353669	DD	On-Demand	Bother	SLC6A3	18	44
CN1[C@H]2CC[C@H]1CC(NC[C@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819353669	DD	On-Demand	Bother	CACNA1C	57	38
CN1[C@H]2CC[C@H]1CC(NC[C@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819353669	DD	On-Demand	Bother	CACNA1D	86	35
CN1[C@H]2CC[C@H]1CC(NC[C@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819353669	DD	On-Demand	Bother	GLRA1	44	32
CN1[C@H]2CC[C@H]1CC(NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819353671	DD	On-Demand	Bother	CHRM1	16	46
CN1[C@H]2CC[C@H]1CC(NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819353671	DD	On-Demand	Bother	SLC6A3	18	44
CN1[C@H]2CC[C@H]1CC(NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819353671	DD	On-Demand	Bother	CACNA1C	57	38
CN1[C@H]2CC[C@H]1CC(NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819353671	DD	On-Demand	Bother	CACNA1D	86	35
CN1[C@H]2CC[C@H]1CC(NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C2	ZINC000819353671	DD	On-Demand	Bother	GLRA1	44	32
CCOC(=O)c1cc(NC(=O)Cc2ccccc2CO)ccc1O	ZINC000819353716	EE	On-Demand	Anodyne	CA1	21	40
O[C@H](CNC1CCC(OC(F)F)CC1)c1cccc(Cl)c1	ZINC000819353719	DH	On-Demand	Anodyne	ADRB1	39	46
O[C@H](CNC1CCC(OC(F)F)CC1)c1cccc(Cl)c1	ZINC000819353719	DH	On-Demand	Anodyne	ADRB3	59	48
O[C@H](CNC1CCC(OC(F)F)CC1)c1cccc(Cl)c1	ZINC000819353719	DH	On-Demand	Anodyne	CYP3A4	46	35
O[C@@H](CNC1CCC(OC(F)F)CC1)c1cccc(Cl)c1	ZINC000819353720	DH	On-Demand	Anodyne	ADRB1	39	46
O[C@@H](CNC1CCC(OC(F)F)CC1)c1cccc(Cl)c1	ZINC000819353720	DH	On-Demand	Anodyne	ADRB3	59	48
O[C@@H](CNC1CCC(OC(F)F)CC1)c1cccc(Cl)c1	ZINC000819353720	DH	On-Demand	Anodyne	CYP3A4	46	35
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2CCC(OC(F)F)CC2)CC1	ZINC000819353722	GG	On-Demand	Anodyne	GPR119	29	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2CCC(OC(F)F)CC2)CC1	ZINC000819353723	GG	On-Demand	Anodyne	GPR119	29	45
CCOC(=O)c1cc(NC(=O)CCN2CCOCC2)ccc1O	ZINC000819353727	DD	On-Demand	Anodyne	EPHX2	25	40
CN1[C@H]2CC[C@H]1CC(NC[C@H](O)c1cccc3ccccc13)C2	ZINC000819353816	DG	On-Demand	Anodyne	CHRM1	17	41
CN1[C@H]2CC[C@H]1CC(NC[C@H](O)c1cccc3ccccc13)C2	ZINC000819353816	DG	On-Demand	Anodyne	HTR3A	27	40
CN1[C@H]2CC[C@H]1CC(NC[C@H](O)c1cccc3ccccc13)C2	ZINC000819353816	DG	On-Demand	Anodyne	SLC6A3	23	41
CN1[C@H]2CC[C@H]1CC(NC[C@H](O)c1cccc3ccccc13)C2	ZINC000819353816	DG	On-Demand	Anodyne	GLRA1	47	38
O[C@@H](CNCc1cnc(C2CC2)o1)c1cccc(Cl)c1	ZINC000819353823	CG	On-Demand	Anodyne	ADRB1	27	41
O[C@@H](CNCc1cnc(C2CC2)o1)c1cccc(Cl)c1	ZINC000819353823	CG	On-Demand	Anodyne	ADRB3	40	41
O[C@H](CNCc1cnc(C2CC2)o1)c1cccc(Cl)c1	ZINC000819353831	CG	On-Demand	Anodyne	ADRB1	27	41
O[C@H](CNCc1cnc(C2CC2)o1)c1cccc(Cl)c1	ZINC000819353831	CG	On-Demand	Anodyne	ADRB3	40	41
CC(C)(C)OC(=O)N1CCCO[C@@H](CNCCC(=O)Nc2cccc(F)c2)C1	ZINC000819353861	GF	On-Demand	Anodyne	GPR119	20	42
CC(C)(C)OC(=O)N1CCCO[C@H](CNCCC(=O)Nc2cccc(F)c2)C1	ZINC000819353865	GF	On-Demand	Anodyne	GPR119	20	42
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc(OC)c(O)c2)ccc1O	ZINC000819353895	FF	On-Demand	Anodyne	APP	41	36
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc(OC)c(O)c2)ccc1O	ZINC000819353895	FF	On-Demand	Anodyne	TUBB1	53	47
CNC(=O)c1cc(Oc2cc(NC(=O)/C=C/[C@H]3CCCO3)ccc2C)ccn1	ZINC000819353899	GG	On-Demand	Anodyne	RAF1	59	42
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc(OC)c(O)c2)ccc1O	ZINC000819353901	FF	On-Demand	Anodyne	APP	41	36
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc(OC)c(O)c2)ccc1O	ZINC000819353901	FF	On-Demand	Anodyne	TUBB1	53	47
CNC(=O)c1cc(Oc2cc(NC(=O)/C=C\[C@@H]3CCCO3)ccc2C)ccn1	ZINC000819353902	GG	On-Demand	Anodyne	RAF1	59	42
CCOC(=O)N[C@H](C(=O)Nc1ccc(O)c(C(=O)OCC)c1)C(C)C	ZINC000819353905	FE	On-Demand	Anodyne	CA14	15	49
CCOC(=O)N[C@H](C(=O)Nc1ccc(O)c(C(=O)OCC)c1)C(C)C	ZINC000819353905	FE	On-Demand	Anodyne	HLA-DRB1	63	38
CCOC(=O)N[C@H](C(=O)Nc1ccc(O)c(C(=O)OCC)c1)C(C)C	ZINC000819353905	FE	On-Demand	Anodyne	MMP12	25	43
CNC(=O)c1cc(Oc2cc(NC(=O)/C=C/[C@@H]3CCCO3)ccc2C)ccn1	ZINC000819353906	GG	On-Demand	Anodyne	RAF1	59	42
CCOC(=O)N[C@@H](C(=O)Nc1ccc(O)c(C(=O)OCC)c1)C(C)C	ZINC000819353908	FE	On-Demand	Anodyne	CA14	15	49
CCOC(=O)N[C@@H](C(=O)Nc1ccc(O)c(C(=O)OCC)c1)C(C)C	ZINC000819353908	FE	On-Demand	Anodyne	HLA-DRB1	63	38
CCOC(=O)N[C@@H](C(=O)Nc1ccc(O)c(C(=O)OCC)c1)C(C)C	ZINC000819353908	FE	On-Demand	Anodyne	MMP12	25	43
CNC(=O)c1cc(Oc2cc(NC(=O)/C=C\[C@H]3CCCO3)ccc2C)ccn1	ZINC000819353910	GG	On-Demand	Anodyne	RAF1	59	42
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819353918	FD	On-Demand	Anodyne	ADRB1	20	40
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819353918	FD	On-Demand	Anodyne	ADRB3	86	40
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819353918	FD	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819353923	FD	On-Demand	Anodyne	ADRB1	20	40
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819353923	FD	On-Demand	Anodyne	ADRB3	86	40
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819353923	FD	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819353927	FD	On-Demand	Anodyne	ADRB1	20	40
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819353927	FD	On-Demand	Anodyne	ADRB3	86	40
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819353927	FD	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819353932	FD	On-Demand	Anodyne	ADRB1	20	40
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819353932	FD	On-Demand	Anodyne	ADRB3	86	40
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819353932	FD	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819353976	GE	On-Demand	Anodyne	ADRB2	28	40
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819353976	GE	On-Demand	Anodyne	ADRB1	47	41
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819353976	GE	On-Demand	Anodyne	ADRB3	28	40
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819353980	GE	On-Demand	Anodyne	ADRB2	28	40
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819353980	GE	On-Demand	Anodyne	ADRB1	47	41
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819353980	GE	On-Demand	Anodyne	ADRB3	28	40
CCCCSCC(=O)Nc1ccc(O)c(C(=O)OCC)c1	ZINC000819353981	DG	On-Demand	Anodyne	ENPP1	60	31
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819353983	GE	On-Demand	Anodyne	ADRB2	28	40
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819353983	GE	On-Demand	Anodyne	ADRB1	47	41
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819353983	GE	On-Demand	Anodyne	ADRB3	28	40
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819353987	GE	On-Demand	Anodyne	ADRB2	28	40
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819353987	GE	On-Demand	Anodyne	ADRB1	47	41
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819353987	GE	On-Demand	Anodyne	ADRB3	28	40
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)COCc2ccccc2)C1	ZINC000819354002	GE	On-Demand	Anodyne	GHSR	31	40
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc(NS(C)(=O)=O)cc2)ccc1O	ZINC000819354108	HF	On-Demand	Anodyne	MCHR1	16	41
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)ccc1O	ZINC000819354110	HF	On-Demand	Anodyne	MCHR1	16	41
CCOC(=O)c1cc(NC(=O)Cc2ccccc2CC#N)ccc1O	ZINC000819354111	EF	On-Demand	Mild	DHODH	23	40
CCOC(=O)c1cc(NC(=O)[C@@H](O)c2cccnc2)ccc1O	ZINC000819354122	DD	On-Demand	Anodyne	DHODH	17	43
CCOC(=O)c1cc(NC(=O)[C@@H](O)c2cccnc2)ccc1O	ZINC000819354122	DD	On-Demand	Anodyne	ADRB3	39	40
C=CCONCCC(=O)Nc1cccc(Cl)c1	ZINC000819354128	CE	On-Demand	Mild	HDAC6	23	40
C=CCONC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819354150	CD	On-Demand	Mild	ACR	16	44
C=CCONC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819354151	CD	On-Demand	Mild	ACR	16	44
O[C@@H](CNC1CCN(C2CCC2)CC1)c1cccnc1	ZINC000819354164	CD	On-Demand	Anodyne	ADRB1	30	43
O[C@@H](CNC1CCN(C2CCC2)CC1)c1cccnc1	ZINC000819354164	CD	On-Demand	Anodyne	ADRB3	90	52
O[C@H](CNC1CCN(C2CCC2)CC1)c1cccnc1	ZINC000819354165	CD	On-Demand	Anodyne	ADRB1	30	43
O[C@H](CNC1CCN(C2CCC2)CC1)c1cccnc1	ZINC000819354165	CD	On-Demand	Anodyne	ADRB3	90	52
C=CCONC[C@H](O)COc1cccc2ccccc12	ZINC000819354171	CE	On-Demand	Mild	ADRB2	33	60
C=CCONC[C@H](O)COc1cccc2ccccc12	ZINC000819354171	CE	On-Demand	Mild	ADRB1	32	60
C=CCONC[C@H](O)COc1cccc2ccccc12	ZINC000819354171	CE	On-Demand	Mild	CYP2D6	18	46
C=CCONC[C@@H](O)COc1cccc2ccccc12	ZINC000819354172	CE	On-Demand	Mild	ADRB2	33	60
C=CCONC[C@@H](O)COc1cccc2ccccc12	ZINC000819354172	CE	On-Demand	Mild	ADRB1	32	60
C=CCONC[C@@H](O)COc1cccc2ccccc12	ZINC000819354172	CE	On-Demand	Mild	CYP2D6	18	46
CCn1cc([C@H](C)NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	ZINC000819354184	FF	On-Demand	Anodyne	GPR119	43	45
CCn1cc([C@H](C)NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	ZINC000819354185	FF	On-Demand	Anodyne	GPR119	43	45
O[C@H](CNC[C@@H]1CCCC[C@@H]1c1ccccc1)c1cccnc1	ZINC000819354199	DH	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNC[C@@H]1CCCC[C@@H]1c1ccccc1)c1cccnc1	ZINC000819354199	DH	On-Demand	Anodyne	ADRB1	25	44
O[C@H](CNC[C@@H]1CCCC[C@@H]1c1ccccc1)c1cccnc1	ZINC000819354199	DH	On-Demand	Anodyne	ADRB3	89	46
O[C@H](CNC[C@H]1CCCC[C@@H]1c1ccccc1)c1cccnc1	ZINC000819354200	DH	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNC[C@H]1CCCC[C@@H]1c1ccccc1)c1cccnc1	ZINC000819354200	DH	On-Demand	Anodyne	ADRB1	25	44
O[C@H](CNC[C@H]1CCCC[C@@H]1c1ccccc1)c1cccnc1	ZINC000819354200	DH	On-Demand	Anodyne	ADRB3	89	46
O[C@H](CNC[C@@H]1CCCC[C@H]1c1ccccc1)c1cccnc1	ZINC000819354201	DH	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNC[C@@H]1CCCC[C@H]1c1ccccc1)c1cccnc1	ZINC000819354201	DH	On-Demand	Anodyne	ADRB1	25	44
O[C@H](CNC[C@@H]1CCCC[C@H]1c1ccccc1)c1cccnc1	ZINC000819354201	DH	On-Demand	Anodyne	ADRB3	89	46
O[C@H](CNC[C@H]1CCCC[C@H]1c1ccccc1)c1cccnc1	ZINC000819354202	DH	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNC[C@H]1CCCC[C@H]1c1ccccc1)c1cccnc1	ZINC000819354202	DH	On-Demand	Anodyne	ADRB1	25	44
O[C@H](CNC[C@H]1CCCC[C@H]1c1ccccc1)c1cccnc1	ZINC000819354202	DH	On-Demand	Anodyne	ADRB3	89	46
C=CCONC[C@@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819354207	EG	On-Demand	Mild	SLC6A3	23	41
C=CCONC[C@H](O)COC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819354208	EG	On-Demand	Mild	SLC6A3	23	41
C=CCONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819354222	CD	On-Demand	Mild	ADRB2	25	55
C=CCONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819354222	CD	On-Demand	Mild	ADRB1	33	43
C=CCONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819354222	CD	On-Demand	Mild	ABCB1	17	46
C=CCONC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819354222	CD	On-Demand	Mild	PDS	44	37
C=CCONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819354223	CD	On-Demand	Mild	ADRB2	25	55
C=CCONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819354223	CD	On-Demand	Mild	ADRB1	33	43
C=CCONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819354223	CD	On-Demand	Mild	ABCB1	17	46
C=CCONC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819354223	CD	On-Demand	Mild	PDS	44	37
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)COCc2ccccc2)C1	ZINC000819354228	GE	On-Demand	Anodyne	GHSR	31	40
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)COCc2ccccc2)C1	ZINC000819354229	GE	On-Demand	Anodyne	GHSR	31	40
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)COCc2ccccc2)C1	ZINC000819354230	GE	On-Demand	Anodyne	GHSR	31	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(C)(C)C(C)(C)O)CC1	ZINC000819354248	FE	On-Demand	Anodyne	GPR119	34	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(C)(C)C(C)(C)O)CC1	ZINC000819354249	FE	On-Demand	Anodyne	GPR119	34	43
C[C@@H](CC(=O)N1CCC(c2cccc(F)c2)CC1)n1cccn1	ZINC000819354275	DG	On-Demand	Anodyne	PRCP	26	40
C[C@@H](CC(=O)N1CCC(c2cccc(F)c2)CC1)n1cccn1	ZINC000819354275	DG	On-Demand	Anodyne	CCR1	20	40
C[C@@H](CC(=O)N1CCC(c2cccc(F)c2)CC1)n1cccn1	ZINC000819354275	DG	On-Demand	Anodyne	CCR5	85	34
C[C@@H](CC(=O)N1CCC(c2cccc(F)c2)CC1)n1cccn1	ZINC000819354275	DG	On-Demand	Anodyne	LIPE	17	49
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819354283	GE	On-Demand	Anodyne	ADRB2	46	43
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819354283	GE	On-Demand	Anodyne	ADRB1	69	40
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819354283	GE	On-Demand	Anodyne	ADRB3	47	39
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819354283	GE	On-Demand	Anodyne	ABCB1	42	43
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819354284	GE	On-Demand	Anodyne	ADRB2	46	43
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819354284	GE	On-Demand	Anodyne	ADRB1	69	40
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819354284	GE	On-Demand	Anodyne	ADRB3	47	39
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819354284	GE	On-Demand	Anodyne	ABCB1	42	43
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819354285	GE	On-Demand	Anodyne	ADRB2	46	43
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819354285	GE	On-Demand	Anodyne	ADRB1	69	40
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819354285	GE	On-Demand	Anodyne	ADRB3	47	39
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819354285	GE	On-Demand	Anodyne	ABCB1	42	43
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819354286	GE	On-Demand	Anodyne	ADRB2	46	43
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819354286	GE	On-Demand	Anodyne	ADRB1	69	40
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819354286	GE	On-Demand	Anodyne	ADRB3	47	39
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819354286	GE	On-Demand	Anodyne	ABCB1	42	43
O[C@H](CNC1CCC(OC(F)F)CC1)c1ccc(F)cc1	ZINC000819354296	DF	On-Demand	Anodyne	SLC6A3	26	52
O[C@@H](CNC1CCC(OC(F)F)CC1)c1ccc(F)cc1	ZINC000819354297	DF	On-Demand	Anodyne	SLC6A3	26	52
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(c2cccc(F)c2)CC1	ZINC000819354300	FG	On-Demand	Anodyne	HTR1D	40	41
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(c2cccc(F)c2)CC1	ZINC000819354300	FG	On-Demand	Anodyne	HTR1B	32	41
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(c2cccc(F)c2)CC1	ZINC000819354300	FG	On-Demand	Anodyne	CCR5	81	34
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(c2cccc(F)c2)CC1	ZINC000819354300	FG	On-Demand	Anodyne	MLNR	28	41
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(c2cccc(F)c2)CC1	ZINC000819354300	FG	On-Demand	Anodyne	KCNJ1	62	40
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819354327	GE	On-Demand	Anodyne	ADRB1	52	36
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819354327	GE	On-Demand	Anodyne	ABCB1	40	45
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819354327	GE	On-Demand	Anodyne	GPR119	19	43
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819354329	GE	On-Demand	Anodyne	ADRB1	52	36
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819354329	GE	On-Demand	Anodyne	ABCB1	40	45
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819354329	GE	On-Demand	Anodyne	GPR119	19	43
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819354331	GE	On-Demand	Anodyne	ADRB1	52	36
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819354331	GE	On-Demand	Anodyne	ABCB1	40	45
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819354331	GE	On-Demand	Anodyne	GPR119	19	43
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819354333	GE	On-Demand	Anodyne	ADRB1	52	36
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819354333	GE	On-Demand	Anodyne	ABCB1	40	45
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819354333	GE	On-Demand	Anodyne	GPR119	19	43
C[C@H](O)c1ccc(CNC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819354349	EH	On-Demand	Anodyne	PLA2G4A	26	40
C[C@H](O)c1ccc(CNC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819354349	EH	On-Demand	Anodyne	PDS	61	38
Cn1nccc1[C@@H]1C[C@H](NC[C@@H](O)c2ccc(F)cc2)CCO1	ZINC000819354362	DE	On-Demand	Anodyne	SLC6A3	16	45
Cn1nccc1[C@@H]1C[C@H](NC[C@H](O)c2ccc(F)cc2)CCO1	ZINC000819354363	DE	On-Demand	Anodyne	SLC6A3	16	45
Cn1nccc1[C@@H]1C[C@@H](NC[C@@H](O)c2ccc(F)cc2)CCO1	ZINC000819354364	DE	On-Demand	Anodyne	SLC6A3	16	45
Cn1nccc1[C@@H]1C[C@@H](NC[C@H](O)c2ccc(F)cc2)CCO1	ZINC000819354365	DE	On-Demand	Anodyne	SLC6A3	16	45
C[C@H](O)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819354416	GF	On-Demand	Mild	PAPA1_CARPA	57	52
C[C@H](O)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819354416	GF	On-Demand	Mild	CTSK	28	50
C[C@H](O)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819354416	GF	On-Demand	Mild	CTSL	22	52
C[C@H](O)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819354416	GF	On-Demand	Mild	REN	38	43
C[C@H](O)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819354416	GF	On-Demand	Mild	FURIN	50	35
C[C@H](O)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819354416	GF	On-Demand	Mild	CTSS	21	54
C[C@H](O)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819354416	GF	On-Demand	Mild	FPR1	48	40
C[C@H](O)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819354417	GF	On-Demand	Mild	PAPA1_CARPA	57	52
C[C@H](O)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819354417	GF	On-Demand	Mild	CTSK	28	50
C[C@H](O)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819354417	GF	On-Demand	Mild	CTSL	22	52
C[C@H](O)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819354417	GF	On-Demand	Mild	REN	38	43
C[C@H](O)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819354417	GF	On-Demand	Mild	FURIN	50	35
C[C@H](O)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819354417	GF	On-Demand	Mild	CTSS	21	54
C[C@H](O)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819354417	GF	On-Demand	Mild	FPR1	48	40
CN1[C@H]2CC[C@H]1CC(NC[C@@H](O)c1ccc(F)cn1)C2	ZINC000819354422	CD	On-Demand	Anodyne	SLC6A3	18	45
CN1[C@H]2CC[C@H]1CC(NC[C@H](O)c1ccc(F)cn1)C2	ZINC000819354423	CD	On-Demand	Anodyne	SLC6A3	18	45
COc1ccc(OC)c([C@H](O)CNCCc2cc(C)ccc2F)c1	ZINC000819354424	EG	On-Demand	Anodyne	ADRB2	21	49
COc1ccc(OC)c([C@H](O)CNCCc2cc(C)ccc2F)c1	ZINC000819354424	EG	On-Demand	Anodyne	ADRB1	20	42
COc1ccc(OC)c([C@H](O)CNCCc2cc(C)ccc2F)c1	ZINC000819354424	EG	On-Demand	Anodyne	ADRB3	17	42
CCOC(=O)c1cc(NC(=O)[C@@H]2CC(c3cccc(OC)c3)=NO2)ccc1O	ZINC000819354444	GF	On-Demand	Anodyne	LUCI_PHOPY	23	42
O=C(NCCCNC(=O)C1CCC1)C(F)=C1CCC1	ZINC000819354451	CD	On-Demand	Anodyne	TBK1	68	35
C=CCONC[C@@H](O)COc1ccc(OCC)cc1	ZINC000819354465	CD	On-Demand	Mild	ADRB2	35	46
C=CCONC[C@@H](O)COc1ccc(OCC)cc1	ZINC000819354465	CD	On-Demand	Mild	ADRB1	38	46
C=CCONC[C@@H](O)COc1ccc(OCC)cc1	ZINC000819354465	CD	On-Demand	Mild	ADRB3	19	43
C=CCONC[C@H](O)COc1ccc(OCC)cc1	ZINC000819354467	CD	On-Demand	Mild	ADRB2	35	46
C=CCONC[C@H](O)COc1ccc(OCC)cc1	ZINC000819354467	CD	On-Demand	Mild	ADRB1	38	46
C=CCONC[C@H](O)COc1ccc(OCC)cc1	ZINC000819354467	CD	On-Demand	Mild	ADRB3	19	43
CCOC(=O)c1cc(NC(=O)C=C2CCN(C(=O)OC(C)(C)C)CC2)ccc1O	ZINC000819354483	HG	On-Demand	Anodyne	TGM2	17	44
CCOC(=O)c1cc(NC(=O)C=C2CCN(C(=O)OC(C)(C)C)CC2)ccc1O	ZINC000819354483	HG	On-Demand	Anodyne	F13A1	26	44
C=CCN1C(=O)c2ccc(C(=O)Nc3ccc(O)c(C(=O)OCC)c3)cc2C1=O	ZINC000819354513	GF	On-Demand	Mild	F3	49	33
CCOC(=O)c1cc(NC(=O)C[C@H](C)C2CC2)ccc1O	ZINC000819354517	CF	On-Demand	Anodyne	SLC1A3	40	31
CCOC(=O)c1cc(NC(=O)C[C@H](C)C2CC2)ccc1O	ZINC000819354517	CF	On-Demand	Anodyne	SLC1A2	59	32
CCOC(=O)c1cc(NC(=O)C[C@@H](C)C2CC2)ccc1O	ZINC000819354518	CF	On-Demand	Anodyne	SLC1A3	40	31
CCOC(=O)c1cc(NC(=O)C[C@@H](C)C2CC2)ccc1O	ZINC000819354518	CF	On-Demand	Anodyne	SLC1A2	59	32
COCCONC(=O)[C@@H]1C[C@@H]1c1ccc(C)cc1	ZINC000819354558	BD	On-Demand	Anodyne	SLC6A4	17	42
COCCONC(=O)[C@@H]1C[C@@H]1c1ccc(C)cc1	ZINC000819354558	BD	On-Demand	Anodyne	SLC6A3	31	42
COCCONC(=O)[C@H]1C[C@@H]1c1ccc(C)cc1	ZINC000819354560	BD	On-Demand	Anodyne	SLC6A4	17	42
COCCONC(=O)[C@H]1C[C@@H]1c1ccc(C)cc1	ZINC000819354560	BD	On-Demand	Anodyne	SLC6A3	31	42
CCOC(=O)c1cc(NC(=O)C(F)(F)c2ccccc2OCC(=O)N(C)C)ccc1O	ZINC000819354561	IF	On-Demand	Anodyne	KCNK3	32	40
CCOC(=O)c1cc(NC(=O)C(F)(F)c2ccccc2OCC(=O)N(C)C)ccc1O	ZINC000819354561	IF	On-Demand	Anodyne	KCNK9	34	40
COCCONC(=O)[C@@H]1C[C@H]1c1ccc(C)cc1	ZINC000819354562	BD	On-Demand	Anodyne	SLC6A4	17	42
COCCONC(=O)[C@@H]1C[C@H]1c1ccc(C)cc1	ZINC000819354562	BD	On-Demand	Anodyne	SLC6A3	31	42
COCCONC(=O)[C@H]1C[C@H]1c1ccc(C)cc1	ZINC000819354565	BD	On-Demand	Anodyne	SLC6A4	17	42
COCCONC(=O)[C@H]1C[C@H]1c1ccc(C)cc1	ZINC000819354565	BD	On-Demand	Anodyne	SLC6A3	31	42
C=CCONC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819354568	CE	On-Demand	Mild	PDS	48	42
C=CCONC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819354569	CE	On-Demand	Mild	PDS	48	42
CCOC(=O)c1cc(NC(=O)C2CCN(C(=O)OCC)CC2)ccc1O	ZINC000819354578	FE	On-Demand	Anodyne	P2RY12	43	39
C=CCNS(=O)(=O)c1cc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)ccc1F	ZINC000819354709	HE	On-Demand	Mild	CPT1A	40	32
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819354712	EF	On-Demand	Anodyne	DRD4	41	48
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819354712	EF	On-Demand	Anodyne	SIGMAR1	34	47
CCCCS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819354713	HG	On-Demand	Anodyne	CA2	26	46
CCCCS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819354713	HG	On-Demand	Anodyne	CA1	19	44
CCCCS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819354713	HG	On-Demand	Anodyne	CA7	26	44
CCCCS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819354713	HG	On-Demand	Anodyne	CA14	19	44
CCCCS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819354713	HG	On-Demand	Anodyne	CA9	16	46
CCCCS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819354713	HG	On-Demand	Anodyne	CYNT	28	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819354715	EF	On-Demand	Anodyne	DRD4	41	48
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819354715	EF	On-Demand	Anodyne	SIGMAR1	34	47
CCOC(=O)c1cc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)ccc1O	ZINC000819354716	II	On-Demand	Anodyne	KLK3	74	37
CCOC(=O)c1cc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)ccc1O	ZINC000819354716	II	On-Demand	Anodyne	CTSB	66	42
CCOC(=O)c1cc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)ccc1O	ZINC000819354716	II	On-Demand	Anodyne	PAPA1_CARPA	74	36
CCOC(=O)c1cc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)ccc1O	ZINC000819354716	II	On-Demand	Anodyne	CYSP_TRYCR	54	41
CCOC(=O)c1cc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)ccc1O	ZINC000819354716	II	On-Demand	Anodyne	CTSK	38	45
CCOC(=O)c1cc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)ccc1O	ZINC000819354716	II	On-Demand	Anodyne	CTSL	45	40
CCOC(=O)c1cc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)ccc1O	ZINC000819354716	II	On-Demand	Anodyne	CAPNS1	63	39
CCOC(=O)c1cc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)ccc1O	ZINC000819354716	II	On-Demand	Anodyne	MMP11	63	35
CCOC(=O)c1cc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)ccc1O	ZINC000819354716	II	On-Demand	Anodyne	CTSS	21	42
CCOC(=O)c1cc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)ccc1O	ZINC000819354716	II	On-Demand	Anodyne	CAPN1	85	42
CCOC(=O)c1cc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)ccc1O	ZINC000819354716	II	On-Demand	Anodyne	CAPN2	137	45
CCOC(=O)c1cc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)ccc1O	ZINC000819354716	II	On-Demand	Anodyne	CASP9	30	42
CCOC(=O)c1cc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)ccc1O	ZINC000819354716	II	On-Demand	Anodyne	NPR	71	37
CCOC(=O)c1cc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)ccc1O	ZINC000819354716	II	On-Demand	Anodyne	CASP10	23	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819354717	EF	On-Demand	Anodyne	DRD4	41	48
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819354717	EF	On-Demand	Anodyne	SIGMAR1	34	47
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819354719	EF	On-Demand	Anodyne	DRD4	41	48
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819354719	EF	On-Demand	Anodyne	SIGMAR1	34	47
CCOC(=O)c1cc(NC(=O)Cn2c(S)nnc2-c2cccs2)ccc1O	ZINC000819354782	HF	On-Demand	Anodyne	IMDH_CRYPV	19	42
CCOC(=O)c1cc(NC(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)ccc1O	ZINC000819354784	HG	On-Demand	Anodyne	PAPA1_CARPA	35	42
CCOC(=O)c1cc(NC(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)ccc1O	ZINC000819354784	HG	On-Demand	Anodyne	POLG_HCV1	30	42
CCOC(=O)c1cc(NC(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)ccc1O	ZINC000819354784	HG	On-Demand	Anodyne	FPR1	45	36
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819354785	GF	On-Demand	Anodyne	GPR119	23	45
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819354787	GF	On-Demand	Anodyne	GPR119	23	45
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819354789	GF	On-Demand	Anodyne	GPR119	23	45
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819354790	GF	On-Demand	Anodyne	GPR119	23	45
CC(=O)Nc1cccc(CC(=O)N2CCC(c3cccc(F)c3)CC2)c1	ZINC000819354797	FH	On-Demand	Anodyne	CCR1	19	47
CC(=O)Nc1cccc(CC(=O)N2CCC(c3cccc(F)c3)CC2)c1	ZINC000819354797	FH	On-Demand	Anodyne	CCR3	56	39
CC(=O)Nc1cccc(CC(=O)N2CCC(c3cccc(F)c3)CC2)c1	ZINC000819354797	FH	On-Demand	Anodyne	CCR5	69	36
CC(=O)Nc1cccc(CC(=O)N2CCC(c3cccc(F)c3)CC2)c1	ZINC000819354797	FH	On-Demand	Anodyne	MLNR	32	45
CC(=O)Nc1cccc(CC(=O)N2CCC(c3cccc(F)c3)CC2)c1	ZINC000819354797	FH	On-Demand	Anodyne	LIPE	16	45
CC(=O)Nc1cccc(CC(=O)N2CCC(c3cccc(F)c3)CC2)c1	ZINC000819354797	FH	On-Demand	Anodyne	EPHX2	15	50
CC(=O)Nc1cccc(CC(=O)N2CCC(c3cccc(F)c3)CC2)c1	ZINC000819354797	FH	On-Demand	Anodyne	MCHR1	37	47
O[C@@H](CNC1CCC(OC(F)F)CC1)c1ccc(Cl)cc1	ZINC000819354812	DH	On-Demand	Anodyne	ADRB3	22	44
O=[N+]([O-])c1cccc([C@@H](O)CNC2CCC(OC(F)F)CC2)c1	ZINC000819354825	EF	On-Demand	Bother	CACNA1D	45	32
O=[N+]([O-])c1cccc([C@H](O)CNC2CCC(OC(F)F)CC2)c1	ZINC000819354826	EF	On-Demand	Bother	CACNA1D	45	32
Cc1cc(CNC[C@@H](O)Cc2ccccc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819354828	FI	On-Demand	Anodyne	PAPA1_CARPA	33	43
Cc1cc(CNC[C@@H](O)Cc2ccccc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819354828	FI	On-Demand	Anodyne	REN	39	41
Cc1cc(CNC[C@@H](O)Cc2ccccc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819354828	FI	On-Demand	Anodyne	FPR1	51	40
Cc1cc(CNC[C@H](O)Cc2ccccc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819354829	FI	On-Demand	Anodyne	PAPA1_CARPA	33	43
Cc1cc(CNC[C@H](O)Cc2ccccc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819354829	FI	On-Demand	Anodyne	REN	39	41
Cc1cc(CNC[C@H](O)Cc2ccccc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819354829	FI	On-Demand	Anodyne	FPR1	51	40
C[C@@H]1C[C@H](NC[C@@H](O)c2cccnc2)c2nccn21	ZINC000819354830	CD	On-Demand	Anodyne	ADRB3	54	42
C[C@@H]1C[C@H](NC[C@H](O)c2cccnc2)c2nccn21	ZINC000819354833	CD	On-Demand	Anodyne	ADRB3	54	42
Cc1cccc(C(C)C)c1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819354838	EH	On-Demand	Anodyne	SOAT1	24	42
CN1[C@H]2CC[C@H]1CC(NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C2	ZINC000819354856	FE	On-Demand	Anodyne	GPR119	28	42
CN1[C@H]2CC[C@H]1CC(NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C2	ZINC000819354857	FE	On-Demand	Anodyne	GPR119	28	42
CN1[C@H]2CC[C@H]1CC(NC[C@@H](O)c1ccc(F)c(Br)c1)C2	ZINC000819354905	FF	On-Demand	Anodyne	CHRM1	16	44
CN1[C@H]2CC[C@H]1CC(NC[C@@H](O)c1ccc(F)c(Br)c1)C2	ZINC000819354905	FF	On-Demand	Anodyne	SLC6A3	26	44
CN1[C@H]2CC[C@H]1CC(NC[C@H](O)c1ccc(F)c(Br)c1)C2	ZINC000819354906	FF	On-Demand	Anodyne	CHRM1	16	44
CN1[C@H]2CC[C@H]1CC(NC[C@H](O)c1ccc(F)c(Br)c1)C2	ZINC000819354906	FF	On-Demand	Anodyne	SLC6A3	26	44
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354915	FG	On-Demand	Anodyne	F2	29	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354915	FG	On-Demand	Anodyne	PLG	21	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354915	FG	On-Demand	Anodyne	PRSS1	16	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354915	FG	On-Demand	Anodyne	ACE	40	39
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354915	FG	On-Demand	Anodyne	OPRM1	19	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354915	FG	On-Demand	Anodyne	CELA1	25	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354915	FG	On-Demand	Anodyne	PGC	52	34
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354915	FG	On-Demand	Anodyne	CMA1	35	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354915	FG	On-Demand	Anodyne	TRY1_BOVIN	44	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354915	FG	On-Demand	Anodyne	CACNA1B	25	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354915	FG	On-Demand	Anodyne	PREP	58	36
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354915	FG	On-Demand	Anodyne	AMY2	43	30
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354915	FG	On-Demand	Anodyne	REN	57	38
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354915	FG	On-Demand	Anodyne	BRCA1	44	31
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354916	FG	On-Demand	Anodyne	F2	29	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354916	FG	On-Demand	Anodyne	PLG	21	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354916	FG	On-Demand	Anodyne	PRSS1	16	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354916	FG	On-Demand	Anodyne	ACE	40	39
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354916	FG	On-Demand	Anodyne	OPRM1	19	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354916	FG	On-Demand	Anodyne	CELA1	25	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354916	FG	On-Demand	Anodyne	PGC	52	34
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354916	FG	On-Demand	Anodyne	CMA1	35	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354916	FG	On-Demand	Anodyne	TRY1_BOVIN	44	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354916	FG	On-Demand	Anodyne	CACNA1B	25	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354916	FG	On-Demand	Anodyne	PREP	58	36
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354916	FG	On-Demand	Anodyne	AMY2	43	30
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354916	FG	On-Demand	Anodyne	REN	57	38
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)Cc1ccccc1	ZINC000819354916	FG	On-Demand	Anodyne	BRCA1	44	31
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354917	FG	On-Demand	Anodyne	F2	29	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354917	FG	On-Demand	Anodyne	PLG	21	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354917	FG	On-Demand	Anodyne	PRSS1	16	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354917	FG	On-Demand	Anodyne	ACE	40	39
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354917	FG	On-Demand	Anodyne	OPRM1	19	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354917	FG	On-Demand	Anodyne	CELA1	25	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354917	FG	On-Demand	Anodyne	PGC	52	34
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354917	FG	On-Demand	Anodyne	CMA1	35	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354917	FG	On-Demand	Anodyne	TRY1_BOVIN	44	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354917	FG	On-Demand	Anodyne	CACNA1B	25	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354917	FG	On-Demand	Anodyne	PREP	58	36
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354917	FG	On-Demand	Anodyne	AMY2	43	30
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354917	FG	On-Demand	Anodyne	REN	57	38
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354917	FG	On-Demand	Anodyne	BRCA1	44	31
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354918	FG	On-Demand	Anodyne	F2	29	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354918	FG	On-Demand	Anodyne	PLG	21	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354918	FG	On-Demand	Anodyne	PRSS1	16	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354918	FG	On-Demand	Anodyne	ACE	40	39
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354918	FG	On-Demand	Anodyne	OPRM1	19	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354918	FG	On-Demand	Anodyne	CELA1	25	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354918	FG	On-Demand	Anodyne	PGC	52	34
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354918	FG	On-Demand	Anodyne	CMA1	35	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354918	FG	On-Demand	Anodyne	TRY1_BOVIN	44	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354918	FG	On-Demand	Anodyne	CACNA1B	25	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354918	FG	On-Demand	Anodyne	PREP	58	36
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354918	FG	On-Demand	Anodyne	AMY2	43	30
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354918	FG	On-Demand	Anodyne	REN	57	38
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)Cc1ccccc1	ZINC000819354918	FG	On-Demand	Anodyne	BRCA1	44	31
Cc1ccc(F)c(CCNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819354925	CF	On-Demand	Mild	ADRB2	21	41
Cc1ccc(F)c(CCNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819354926	CF	On-Demand	Mild	ADRB2	21	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCC[C@H]2CCOC2)CC1	ZINC000819354947	FE	On-Demand	Anodyne	GPR119	23	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCC[C@@H]2CCOC2)CC1	ZINC000819354948	FE	On-Demand	Anodyne	GPR119	23	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCC[C@H]2CCOC2)CC1	ZINC000819354949	FE	On-Demand	Anodyne	GPR119	23	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCC[C@@H]2CCOC2)CC1	ZINC000819354950	FE	On-Demand	Anodyne	GPR119	23	42
C=CCONCCC(=O)Nc1ccccc1	ZINC000819354952	BD	On-Demand	Mild	LTA4H	25	44
C=CCONCCC(=O)Nc1ccccc1	ZINC000819354952	BD	On-Demand	Mild	HDAC8	17	50
C=CCONCCC(=O)Nc1ccccc1	ZINC000819354952	BD	On-Demand	Mild	HDAC10	25	50
C=CCONCCC(=O)Nc1ccccc1	ZINC000819354952	BD	On-Demand	Mild	HDAC1	15	50
C=CCONCCC(=O)Nc1ccccc1	ZINC000819354952	BD	On-Demand	Mild	HDAC2	22	50
C=CCONCCC(=O)Nc1ccccc1	ZINC000819354952	BD	On-Demand	Mild	HDAC3	22	50
C=CCONCCC(=O)Nc1ccccc1	ZINC000819354952	BD	On-Demand	Mild	HDAC6	21	50
C=CCONCCC(=O)Nc1ccccc1	ZINC000819354952	BD	On-Demand	Mild	HDAC11	17	50
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(C2=NNC(=O)CC2)cc1	ZINC000819354953	FE	On-Demand	Anodyne	PDE3A	18	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(C2=NNC(=O)CC2)cc1	ZINC000819354953	FE	On-Demand	Anodyne	PDE3B	24	41
C=CCONC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819354956	CD	On-Demand	Mild	ADRB2	26	42
C=CCONC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819354956	CD	On-Demand	Mild	ADRB1	38	42
C=CCONC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819354956	CD	On-Demand	Mild	ADRB3	23	42
C=CCONC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819354957	CD	On-Demand	Mild	ADRB2	26	42
C=CCONC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819354957	CD	On-Demand	Mild	ADRB1	38	42
C=CCONC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819354957	CD	On-Demand	Mild	ADRB3	23	42
C=CCONC[C@H](O)c1cccnc1	ZINC000819354962	AC	On-Demand	Mild	ADRB2	15	41
C=CCONC[C@H](O)c1cccnc1	ZINC000819354962	AC	On-Demand	Mild	ADRB1	19	43
C=CCONC[C@H](O)c1cccnc1	ZINC000819354962	AC	On-Demand	Mild	ADRB3	69	43
C=CCONC[C@@H](O)c1cccnc1	ZINC000819354963	AC	On-Demand	Mild	ADRB2	15	41
C=CCONC[C@@H](O)c1cccnc1	ZINC000819354963	AC	On-Demand	Mild	ADRB1	19	43
C=CCONC[C@@H](O)c1cccnc1	ZINC000819354963	AC	On-Demand	Mild	ADRB3	69	43
CC[C@@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C1CCCC1	ZINC000819354969	FH	On-Demand	Anodyne	GPR119	27	42
CC[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)C1CCCC1	ZINC000819354970	FH	On-Demand	Anodyne	GPR119	27	42
C=CCONCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819354981	CF	On-Demand	Mild	HDAC10	18	59
C=CCONCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819354981	CF	On-Demand	Mild	HDAC6	17	59
C=CCONCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819354981	CF	On-Demand	Mild	SLC1A1	19	40
C=CCONCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819354981	CF	On-Demand	Mild	SLC1A3	17	40
C=CCONCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819354981	CF	On-Demand	Mild	SLC1A2	32	40
C=CCONC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819354994	BD	On-Demand	Mild	CACNA1C	29	40
C=CCONC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819354994	BD	On-Demand	Mild	CACNA1D	43	40
C=CCONC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819354995	BD	On-Demand	Mild	CACNA1C	29	40
C=CCONC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819354995	BD	On-Demand	Mild	CACNA1D	43	40
C=CCONC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819355023	CC	On-Demand	Mild	ADRB2	40	49
C=CCONC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819355023	CC	On-Demand	Mild	ADRB1	57	44
C=CCONC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819355023	CC	On-Demand	Mild	ADRB3	32	44
C=CCONC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819355024	CC	On-Demand	Mild	ADRB2	40	49
C=CCONC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819355024	CC	On-Demand	Mild	ADRB1	57	44
C=CCONC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819355024	CC	On-Demand	Mild	ADRB3	32	44
Cc1ccc(OC[C@@H](O)CNC[C@H]2CN(C(=O)OC(C)(C)C)CCCO2)cc1	ZINC000819355124	GE	On-Demand	Anodyne	ADRB2	25	44
Cc1ccc(OC[C@@H](O)CNC[C@H]2CN(C(=O)OC(C)(C)C)CCCO2)cc1	ZINC000819355124	GE	On-Demand	Anodyne	ADRB1	44	41
Cc1ccc(OC[C@@H](O)CNC[C@H]2CN(C(=O)OC(C)(C)C)CCCO2)cc1	ZINC000819355124	GE	On-Demand	Anodyne	ACOX1	47	30
Cc1ccc(OC[C@H](O)CNC[C@@H]2CN(C(=O)OC(C)(C)C)CCCO2)cc1	ZINC000819355126	GE	On-Demand	Anodyne	ADRB2	25	44
Cc1ccc(OC[C@H](O)CNC[C@@H]2CN(C(=O)OC(C)(C)C)CCCO2)cc1	ZINC000819355126	GE	On-Demand	Anodyne	ADRB1	44	41
Cc1ccc(OC[C@H](O)CNC[C@@H]2CN(C(=O)OC(C)(C)C)CCCO2)cc1	ZINC000819355126	GE	On-Demand	Anodyne	ACOX1	47	30
Cc1ccc(OC[C@H](O)CNC[C@H]2CN(C(=O)OC(C)(C)C)CCCO2)cc1	ZINC000819355128	GE	On-Demand	Anodyne	ADRB2	25	44
Cc1ccc(OC[C@H](O)CNC[C@H]2CN(C(=O)OC(C)(C)C)CCCO2)cc1	ZINC000819355128	GE	On-Demand	Anodyne	ADRB1	44	41
Cc1ccc(OC[C@H](O)CNC[C@H]2CN(C(=O)OC(C)(C)C)CCCO2)cc1	ZINC000819355128	GE	On-Demand	Anodyne	ACOX1	47	30
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CN(C(=O)OC(C)(C)C)CCCO2)cc1	ZINC000819355130	GE	On-Demand	Anodyne	ADRB2	25	44
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CN(C(=O)OC(C)(C)C)CCCO2)cc1	ZINC000819355130	GE	On-Demand	Anodyne	ADRB1	44	41
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CN(C(=O)OC(C)(C)C)CCCO2)cc1	ZINC000819355130	GE	On-Demand	Anodyne	ACOX1	47	30
CC(C)(C)OC(=O)N1CCCO[C@@H](CNCCS(=O)(=O)c2ccccc2)C1	ZINC000819355136	GE	On-Demand	Anodyne	SFRP1	74	39
CC(C)(C)OC(=O)N1CCCO[C@@H](CNCCS(=O)(=O)c2ccccc2)C1	ZINC000819355136	GE	On-Demand	Anodyne	WNT3	54	36
CC(C)(C)OC(=O)N1CCCO[C@H](CNCCS(=O)(=O)c2ccccc2)C1	ZINC000819355138	GE	On-Demand	Anodyne	SFRP1	74	39
CC(C)(C)OC(=O)N1CCCO[C@H](CNCCS(=O)(=O)c2ccccc2)C1	ZINC000819355138	GE	On-Demand	Anodyne	WNT3	54	36
CC(C)(C)OC(=O)N1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)[C@@H](C#N)C1	ZINC000819355210	GD	On-Demand	Mild	GPR119	36	43
CC(C)(C)OC(=O)N1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)[C@H](C#N)C1	ZINC000819355211	GD	On-Demand	Mild	GPR119	36	43
C=CCONC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819355233	CD	On-Demand	Mild	ADRB2	20	64
C=CCONC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819355233	CD	On-Demand	Mild	ADRB1	22	64
C=CCONC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819355234	CD	On-Demand	Mild	ADRB2	20	64
C=CCONC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819355234	CD	On-Demand	Mild	ADRB1	22	64
C=CCONC[C@@H](O)COCc1ccc(OC)cc1	ZINC000819355237	CD	On-Demand	Mild	ADRB2	16	42
C=CCONC[C@@H](O)COCc1ccc(OC)cc1	ZINC000819355237	CD	On-Demand	Mild	ADRB1	15	42
C=CCONC[C@H](O)COCc1ccc(OC)cc1	ZINC000819355238	CD	On-Demand	Mild	ADRB2	16	42
C=CCONC[C@H](O)COCc1ccc(OC)cc1	ZINC000819355238	CD	On-Demand	Mild	ADRB1	15	42
CCOC(=O)c1cc(NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)ccc1O	ZINC000819355301	GG	On-Demand	Anodyne	PAPA1_CARPA	40	48
O[C@@H](CNC1CCN(C2CCC2)CC1)c1cccc(Cl)c1	ZINC000819355324	DF	On-Demand	Anodyne	ADRB1	39	49
O[C@@H](CNC1CCN(C2CCC2)CC1)c1cccc(Cl)c1	ZINC000819355324	DF	On-Demand	Anodyne	ADRB3	59	49
O[C@@H](CNC1CCN(C2CCC2)CC1)c1cccc(Cl)c1	ZINC000819355324	DF	On-Demand	Anodyne	IGF1R	28	41
O[C@@H](CNC1CCN(C2CCC2)CC1)c1cccc(Cl)c1	ZINC000819355324	DF	On-Demand	Anodyne	CYP3A4	51	41
O[C@H](CNC1CCN(C2CCC2)CC1)c1cccc(Cl)c1	ZINC000819355326	DF	On-Demand	Anodyne	ADRB1	39	49
O[C@H](CNC1CCN(C2CCC2)CC1)c1cccc(Cl)c1	ZINC000819355326	DF	On-Demand	Anodyne	ADRB3	59	49
O[C@H](CNC1CCN(C2CCC2)CC1)c1cccc(Cl)c1	ZINC000819355326	DF	On-Demand	Anodyne	IGF1R	28	41
O[C@H](CNC1CCN(C2CCC2)CC1)c1cccc(Cl)c1	ZINC000819355326	DF	On-Demand	Anodyne	CYP3A4	51	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2CCN(C3CCC3)CC2)CC1	ZINC000819355328	GF	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2CCN(C3CCC3)CC2)CC1	ZINC000819355330	GF	On-Demand	Anodyne	GPR119	26	40
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(C3CCC3)CC2)cc1	ZINC000819355331	FD	On-Demand	Anodyne	ADRA1D	29	42
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(C3CCC3)CC2)cc1	ZINC000819355331	FD	On-Demand	Anodyne	ADRA1A	21	42
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(C3CCC3)CC2)cc1	ZINC000819355331	FD	On-Demand	Anodyne	ADRA1B	23	42
CS(=O)(=O)c1ccc([C@H](O)CNC2CCN(C3CCC3)CC2)cc1	ZINC000819355331	FD	On-Demand	Anodyne	ADRB3	27	43
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(C3CCC3)CC2)cc1	ZINC000819355332	FD	On-Demand	Anodyne	ADRA1D	29	42
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(C3CCC3)CC2)cc1	ZINC000819355332	FD	On-Demand	Anodyne	ADRA1A	21	42
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(C3CCC3)CC2)cc1	ZINC000819355332	FD	On-Demand	Anodyne	ADRA1B	23	42
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCN(C3CCC3)CC2)cc1	ZINC000819355332	FD	On-Demand	Anodyne	ADRB3	27	43
C=CCONC[C@@H](O)COc1ccccc1C(C)C	ZINC000819355334	CE	On-Demand	Mild	ADRB2	34	53
C=CCONC[C@@H](O)COc1ccccc1C(C)C	ZINC000819355334	CE	On-Demand	Mild	ABCB1	24	41
C=CCONC[C@H](O)COc1ccccc1C(C)C	ZINC000819355336	CE	On-Demand	Mild	ADRB2	34	53
C=CCONC[C@H](O)COc1ccccc1C(C)C	ZINC000819355336	CE	On-Demand	Mild	ABCB1	24	41
C=CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819355355	HE	On-Demand	Mild	CA2	27	46
C=CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819355355	HE	On-Demand	Mild	CA1	24	43
C=CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819355355	HE	On-Demand	Mild	CA7	29	42
C=CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819355355	HE	On-Demand	Mild	CA4	17	43
C=CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819355355	HE	On-Demand	Mild	CA14	18	42
C=CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819355355	HE	On-Demand	Mild	CA12	17	42
C=CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819355355	HE	On-Demand	Mild	CA9	22	46
CCOC(=O)c1cc(NC(=O)[C@@H](F)C(C)C)ccc1O	ZINC000819355361	CF	On-Demand	Anodyne	CA7	15	53
CCOC(=O)c1cc(NC(=O)[C@@H](F)C(C)C)ccc1O	ZINC000819355361	CF	On-Demand	Anodyne	CA14	17	53
CCOC(=O)c1cc(NC(=O)COc2ccc3c(C)cc(=O)oc3c2)ccc1O	ZINC000819355399	GG	On-Demand	Anodyne	MAOA	68	62
CCOC(=O)c1cc(NC(=O)COc2ccc3c(C)cc(=O)oc3c2)ccc1O	ZINC000819355399	GG	On-Demand	Anodyne	MAOB	48	62
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)c1cccnc1	ZINC000819355446	EF	On-Demand	Anodyne	ADRB2	25	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)c1cccnc1	ZINC000819355446	EF	On-Demand	Anodyne	ADRB1	30	42
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](O)c1cccnc1	ZINC000819355446	EF	On-Demand	Anodyne	ADRB3	103	43
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)c1cccnc1	ZINC000819355447	EF	On-Demand	Anodyne	ADRB2	25	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)c1cccnc1	ZINC000819355447	EF	On-Demand	Anodyne	ADRB1	30	42
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](O)c1cccnc1	ZINC000819355447	EF	On-Demand	Anodyne	ADRB3	103	43
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)c1cccnc1	ZINC000819355448	EF	On-Demand	Anodyne	ADRB2	25	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)c1cccnc1	ZINC000819355448	EF	On-Demand	Anodyne	ADRB1	30	42
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](O)c1cccnc1	ZINC000819355448	EF	On-Demand	Anodyne	ADRB3	103	43
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)c1cccnc1	ZINC000819355450	EF	On-Demand	Anodyne	ADRB2	25	40
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)c1cccnc1	ZINC000819355450	EF	On-Demand	Anodyne	ADRB1	30	42
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](O)c1cccnc1	ZINC000819355450	EF	On-Demand	Anodyne	ADRB3	103	43
Cc1ccc(F)c(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819355452	CG	On-Demand	Anodyne	ADRB2	34	47
Cc1ccc(F)c(CCNC[C@H](O)c2ccc(F)cc2)c1	ZINC000819355452	CG	On-Demand	Anodyne	ADRB3	41	39
Cc1ccc(F)c(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819355454	CG	On-Demand	Anodyne	ADRB2	34	47
Cc1ccc(F)c(CCNC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819355454	CG	On-Demand	Anodyne	ADRB3	41	39
C[C@@H](Cc1cnn(C)c1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819355464	ED	On-Demand	Anodyne	ADRB1	20	41
C[C@@H](Cc1cnn(C)c1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819355464	ED	On-Demand	Anodyne	ADRB3	30	41
C[C@@H](Cc1cnn(C)c1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819355465	ED	On-Demand	Anodyne	ADRB1	20	41
C[C@@H](Cc1cnn(C)c1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819355465	ED	On-Demand	Anodyne	ADRB3	30	41
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819355629	GF	On-Demand	Anodyne	GPR119	22	43
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819355630	GF	On-Demand	Anodyne	GPR119	22	43
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819355631	GF	On-Demand	Anodyne	GPR119	22	43
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819355633	GF	On-Demand	Anodyne	GPR119	22	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3cccc(F)c3)CC1)C2	ZINC000819355640	FG	On-Demand	Anodyne	PRCP	46	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3cccc(F)c3)CC1)C2	ZINC000819355640	FG	On-Demand	Anodyne	ADAM10	21	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3cccc(F)c3)CC1)C2	ZINC000819355643	FG	On-Demand	Anodyne	PRCP	46	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3cccc(F)c3)CC1)C2	ZINC000819355643	FG	On-Demand	Anodyne	ADAM10	21	41
C=C(C)C(C)(C)C(=O)N1CCC(c2cccc(F)c2)CC1	ZINC000819355649	CI	On-Demand	Mild	CCR5	62	34
CC(C)(C)OC(=O)N1CCCO[C@@H](CNCCC(=O)Nc2cccnc2)C1	ZINC000819355651	GE	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)N1CCCO[C@@H](CNCCC(=O)Nc2cccnc2)C1	ZINC000819355651	GE	On-Demand	Anodyne	NAMPT	17	41
CC(C)(C)OC(=O)N1CCCO[C@H](CNCCC(=O)Nc2cccnc2)C1	ZINC000819355653	GE	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)N1CCCO[C@H](CNCCC(=O)Nc2cccnc2)C1	ZINC000819355653	GE	On-Demand	Anodyne	NAMPT	17	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C[C@H]1C)C2	ZINC000819355673	GF	On-Demand	Anodyne	DRD4	30	51
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C[C@H]1C)C2	ZINC000819355673	GF	On-Demand	Anodyne	SIGMAR1	35	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C[C@@H]1C)C2	ZINC000819355674	GF	On-Demand	Anodyne	DRD4	30	51
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C[C@@H]1C)C2	ZINC000819355674	GF	On-Demand	Anodyne	SIGMAR1	35	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C[C@@H]1C)C2	ZINC000819355675	GF	On-Demand	Anodyne	DRD4	30	51
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)C[C@@H]1C)C2	ZINC000819355675	GF	On-Demand	Anodyne	SIGMAR1	35	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C[C@H]1C)C2	ZINC000819355676	GF	On-Demand	Anodyne	DRD4	30	51
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(Cc3ccccc3)C[C@H]1C)C2	ZINC000819355676	GF	On-Demand	Anodyne	SIGMAR1	35	42
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819355692	GF	On-Demand	Anodyne	GHRHR	42	32
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819355693	GF	On-Demand	Anodyne	GHRHR	42	32
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819355694	GF	On-Demand	Anodyne	GHRHR	42	32
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819355695	GF	On-Demand	Anodyne	GHRHR	42	32
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)c2ccccc2F)C1	ZINC000819355696	FE	On-Demand	Anodyne	GPR119	24	43
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)c2ccccc2F)C1	ZINC000819355697	FE	On-Demand	Anodyne	GPR119	24	43
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)c2ccccc2F)C1	ZINC000819355698	FE	On-Demand	Anodyne	GPR119	24	43
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)c2ccccc2F)C1	ZINC000819355699	FE	On-Demand	Anodyne	GPR119	24	43
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OC(C)(C)C)C[C@@H]2C#N)c1	ZINC000819355704	GE	On-Demand	Mild	DPP4	31	40
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OC(C)(C)C)C[C@@H]2C#N)c1	ZINC000819355704	GE	On-Demand	Mild	GPR119	33	42
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2C#N)c1	ZINC000819355705	GE	On-Demand	Mild	DPP4	31	40
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OC(C)(C)C)C[C@H]2C#N)c1	ZINC000819355705	GE	On-Demand	Mild	GPR119	33	42
O=C(CCc1cccc(OC(F)F)c1)N1CCC(c2cccc(F)c2)CC1	ZINC000819355722	GJ	On-Demand	Anodyne	CCR5	87	40
O[C@@H](CNC1CCN(C2CCC2)CC1)c1ccccc1	ZINC000819355726	CE	On-Demand	Anodyne	SLC6A3	15	49
O[C@@H](CNC1CCN(C2CCC2)CC1)c1ccccc1	ZINC000819355726	CE	On-Demand	Anodyne	SLC18A3	17	41
O[C@H](CNC1CCN(C2CCC2)CC1)c1ccccc1	ZINC000819355727	CE	On-Demand	Anodyne	SLC6A3	15	49
O[C@H](CNC1CCN(C2CCC2)CC1)c1ccccc1	ZINC000819355727	CE	On-Demand	Anodyne	SLC18A3	17	41
O[C@H](CNCCC[C@H]1CCOC1)c1cccnc1	ZINC000819355728	CD	On-Demand	Anodyne	ADRB2	23	43
O[C@H](CNCCC[C@H]1CCOC1)c1cccnc1	ZINC000819355728	CD	On-Demand	Anodyne	ADRB1	24	43
O[C@H](CNCCC[C@H]1CCOC1)c1cccnc1	ZINC000819355728	CD	On-Demand	Anodyne	ADRB3	93	44
O[C@@H](CNCCC[C@H]1CCOC1)c1cccnc1	ZINC000819355729	CD	On-Demand	Anodyne	ADRB2	23	43
O[C@@H](CNCCC[C@H]1CCOC1)c1cccnc1	ZINC000819355729	CD	On-Demand	Anodyne	ADRB1	24	43
O[C@@H](CNCCC[C@H]1CCOC1)c1cccnc1	ZINC000819355729	CD	On-Demand	Anodyne	ADRB3	93	44
O[C@@H](CNCCC[C@@H]1CCOC1)c1cccnc1	ZINC000819355731	CD	On-Demand	Anodyne	ADRB2	23	43
O[C@@H](CNCCC[C@@H]1CCOC1)c1cccnc1	ZINC000819355731	CD	On-Demand	Anodyne	ADRB1	24	43
O[C@@H](CNCCC[C@@H]1CCOC1)c1cccnc1	ZINC000819355731	CD	On-Demand	Anodyne	ADRB3	93	44
O[C@H](CNCCC[C@@H]1CCOC1)c1cccnc1	ZINC000819355732	CD	On-Demand	Anodyne	ADRB2	23	43
O[C@H](CNCCC[C@@H]1CCOC1)c1cccnc1	ZINC000819355732	CD	On-Demand	Anodyne	ADRB1	24	43
O[C@H](CNCCC[C@@H]1CCOC1)c1cccnc1	ZINC000819355732	CD	On-Demand	Anodyne	ADRB3	93	44
COc1ccc(OC)c([C@H](O)CNC2CCN(C3CCC3)CC2)c1	ZINC000819355744	EE	On-Demand	Anodyne	ADRA1D	21	42
COc1ccc(OC)c([C@H](O)CNC2CCN(C3CCC3)CC2)c1	ZINC000819355744	EE	On-Demand	Anodyne	ADRA1A	15	42
COc1ccc(OC)c([C@H](O)CNC2CCN(C3CCC3)CC2)c1	ZINC000819355744	EE	On-Demand	Anodyne	ADRA1B	17	42
O[C@@H](CNC1CCN(C2CCC2)CC1)c1ccccc1C(F)(F)F	ZINC000819355755	EG	On-Demand	Anodyne	SFRP1	43	33
O[C@H](CNC1CCN(C2CCC2)CC1)c1ccccc1C(F)(F)F	ZINC000819355756	EG	On-Demand	Anodyne	SFRP1	43	33
C=CCONC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819355780	CD	On-Demand	Mild	ADRB2	20	43
C=CCONC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819355780	CD	On-Demand	Mild	ADRB1	48	33
C=CCONC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819355781	CD	On-Demand	Mild	ADRB2	20	43
C=CCONC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819355781	CD	On-Demand	Mild	ADRB1	48	33
COCCONC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819355782	FE	On-Demand	Anodyne	CNR1	55	33
C=CCONCCC(=O)Nc1cccc(F)c1	ZINC000819355804	BD	On-Demand	Mild	HDAC6	21	40
COC[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819355813	EE	On-Demand	Mild	PLG	15	40
COC[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819355813	EE	On-Demand	Mild	PAPA1_CARPA	32	42
COC[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819355815	EE	On-Demand	Mild	PLG	15	40
COC[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819355815	EE	On-Demand	Mild	PAPA1_CARPA	32	42
CCOC(=O)c1cc(NC(=O)CCc2c(C)c3ccc(OC)cc3oc2=O)ccc1O	ZINC000819355842	IH	On-Demand	Anodyne	MAOB	35	43
CCOC(=O)c1cc(NC(=O)CCc2c(C)c3ccc(OC)cc3oc2=O)ccc1O	ZINC000819355842	IH	On-Demand	Anodyne	RAF1	16	40
CCOC(=O)c1cc(NC(=O)CCc2c(C)c3ccc(OC)cc3oc2=O)ccc1O	ZINC000819355842	IH	On-Demand	Anodyne	NQO1	33	44
O[C@@H](CNC1CCC(OC(F)F)CC1)c1cccnc1	ZINC000819355849	CE	On-Demand	Anodyne	ADRB1	25	44
O[C@@H](CNC1CCC(OC(F)F)CC1)c1cccnc1	ZINC000819355849	CE	On-Demand	Anodyne	ADRB3	87	47
O[C@H](CNC1CCC(OC(F)F)CC1)c1cccnc1	ZINC000819355850	CE	On-Demand	Anodyne	ADRB1	25	44
O[C@H](CNC1CCC(OC(F)F)CC1)c1cccnc1	ZINC000819355850	CE	On-Demand	Anodyne	ADRB3	87	47
CCOC(=O)c1cc(NC(=O)[C@@H](CC(C)C)NC(=O)OC)ccc1O	ZINC000819355862	FE	On-Demand	Anodyne	ANPEP	27	40
CCOC(=O)c1cc(NC(=O)[C@@H](CC(C)C)NC(=O)OC)ccc1O	ZINC000819355862	FE	On-Demand	Anodyne	CAPNS1	60	35
CCOC(=O)c1cc(NC(=O)[C@@H](CC(C)C)NC(=O)OC)ccc1O	ZINC000819355862	FE	On-Demand	Anodyne	MMP3	23	42
CCOC(=O)c1cc(NC(=O)[C@@H](CC(C)C)NC(=O)OC)ccc1O	ZINC000819355862	FE	On-Demand	Anodyne	HLA-DRB1	49	36
CCOC(=O)c1cc(NC(=O)[C@@H](CC(C)C)NC(=O)OC)ccc1O	ZINC000819355862	FE	On-Demand	Anodyne	CAPN1	72	42
CCOC(=O)c1cc(NC(=O)[C@@H](CC(C)C)NC(=O)OC)ccc1O	ZINC000819355862	FE	On-Demand	Anodyne	CAPN2	108	40
CCOC(=O)c1cc(NC(=O)[C@@H](CC(C)C)NC(=O)OC)ccc1O	ZINC000819355862	FE	On-Demand	Anodyne	FPR1	44	34
CCOC(=O)c1cc(NC(=O)[C@@H](CC(C)C)NC(=O)OC)ccc1O	ZINC000819355862	FE	On-Demand	Anodyne	NPR	52	32
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819355867	GF	On-Demand	Anodyne	DPP7	15	40
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819355868	GF	On-Demand	Anodyne	DPP7	15	40
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819355869	GF	On-Demand	Anodyne	DPP7	15	40
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819355870	GF	On-Demand	Anodyne	DPP7	15	40
C=CCOc1cc(OC)ccc1C(=O)Nc1ccc(O)c(C(=O)OCC)c1	ZINC000819355876	FG	On-Demand	Mild	KCNK3	45	40
C=CCOc1cc(OC)ccc1C(=O)Nc1ccc(O)c(C(=O)OCC)c1	ZINC000819355876	FG	On-Demand	Mild	KCNK9	34	40
CC(C)(C)OC(=O)N1CCCO[C@@H](CNCCC(=O)Nc2ccccc2F)C1	ZINC000819355890	GF	On-Demand	Anodyne	GPR119	21	40
CC(C)(C)OC(=O)N1CCCO[C@H](CNCCC(=O)Nc2ccccc2F)C1	ZINC000819355891	GF	On-Demand	Anodyne	GPR119	21	40
CNC(=O)c1cc(Oc2ccccc2NC(=O)/C=C\[C@@H]2CCCO2)ccn1	ZINC000819355897	FF	On-Demand	Anodyne	RAF1	52	40
CNC(=O)c1cc(Oc2ccccc2NC(=O)/C=C\[C@@H]2CCCO2)ccn1	ZINC000819355897	FF	On-Demand	Anodyne	PYGM	32	45
CNC(=O)c1cc(Oc2ccccc2NC(=O)/C=C/[C@H]2CCCO2)ccn1	ZINC000819355899	FF	On-Demand	Anodyne	RAF1	52	40
CNC(=O)c1cc(Oc2ccccc2NC(=O)/C=C/[C@H]2CCCO2)ccn1	ZINC000819355899	FF	On-Demand	Anodyne	PYGM	32	45
CNC(=O)c1cc(Oc2ccccc2NC(=O)/C=C\[C@H]2CCCO2)ccn1	ZINC000819355901	FF	On-Demand	Anodyne	RAF1	52	40
CNC(=O)c1cc(Oc2ccccc2NC(=O)/C=C\[C@H]2CCCO2)ccn1	ZINC000819355901	FF	On-Demand	Anodyne	PYGM	32	45
CNC(=O)c1cc(Oc2ccccc2NC(=O)/C=C/[C@@H]2CCCO2)ccn1	ZINC000819355902	FF	On-Demand	Anodyne	RAF1	52	40
CNC(=O)c1cc(Oc2ccccc2NC(=O)/C=C/[C@@H]2CCCO2)ccn1	ZINC000819355902	FF	On-Demand	Anodyne	PYGM	32	45
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819355904	FE	On-Demand	Anodyne	GPR119	19	45
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819355906	FE	On-Demand	Anodyne	GPR119	19	45
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819355907	FE	On-Demand	Anodyne	GPR119	19	45
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819355908	FE	On-Demand	Anodyne	GPR119	19	45
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCC(OC(F)F)CC2)cc1	ZINC000819355931	FE	On-Demand	Anodyne	ADRB3	29	42
CS(=O)(=O)c1ccc([C@H](O)CNC2CCC(OC(F)F)CC2)cc1	ZINC000819355932	FE	On-Demand	Anodyne	ADRB3	29	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(F)=C1CCC1	ZINC000819355951	DG	On-Demand	Anodyne	DRD2	16	50
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(F)=C1CCC1	ZINC000819355951	DG	On-Demand	Anodyne	DRD4	47	50
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(F)=C1CCC1	ZINC000819355951	DG	On-Demand	Anodyne	ACHE	32	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(F)=C1CCC1	ZINC000819355951	DG	On-Demand	Anodyne	SIGMAR1	48	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(F)=C1CCC1	ZINC000819355951	DG	On-Demand	Anodyne	CACNA1G	23	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(F)=C1CCC1	ZINC000819355951	DG	On-Demand	Anodyne	BIRC2	26	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(F)=C1CCC1	ZINC000819355953	DG	On-Demand	Anodyne	DRD2	16	50
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(F)=C1CCC1	ZINC000819355953	DG	On-Demand	Anodyne	DRD4	47	50
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(F)=C1CCC1	ZINC000819355953	DG	On-Demand	Anodyne	ACHE	32	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(F)=C1CCC1	ZINC000819355953	DG	On-Demand	Anodyne	SIGMAR1	48	44
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(F)=C1CCC1	ZINC000819355953	DG	On-Demand	Anodyne	CACNA1G	23	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(F)=C1CCC1	ZINC000819355953	DG	On-Demand	Anodyne	BIRC2	26	40
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(F)=C1CCC1	ZINC000819355954	DG	On-Demand	Anodyne	DRD2	16	50
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(F)=C1CCC1	ZINC000819355954	DG	On-Demand	Anodyne	DRD4	47	50
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(F)=C1CCC1	ZINC000819355954	DG	On-Demand	Anodyne	ACHE	32	41
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(F)=C1CCC1	ZINC000819355954	DG	On-Demand	Anodyne	SIGMAR1	48	44
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(F)=C1CCC1	ZINC000819355954	DG	On-Demand	Anodyne	CACNA1G	23	40
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C(F)=C1CCC1	ZINC000819355954	DG	On-Demand	Anodyne	BIRC2	26	40
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(F)=C1CCC1	ZINC000819355955	DG	On-Demand	Anodyne	DRD2	16	50
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(F)=C1CCC1	ZINC000819355955	DG	On-Demand	Anodyne	DRD4	47	50
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(F)=C1CCC1	ZINC000819355955	DG	On-Demand	Anodyne	ACHE	32	41
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(F)=C1CCC1	ZINC000819355955	DG	On-Demand	Anodyne	SIGMAR1	48	44
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(F)=C1CCC1	ZINC000819355955	DG	On-Demand	Anodyne	CACNA1G	23	40
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C(F)=C1CCC1	ZINC000819355955	DG	On-Demand	Anodyne	BIRC2	26	40
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CN(C(=O)OC(C)(C)C)CCCO1	ZINC000819355977	GF	On-Demand	Anodyne	GPR119	19	41
CCOC(=O)c1cc(NC(=O)CN2C(=O)N[C@](C)(c3ccccc3OC)C2=O)ccc1O	ZINC000819355985	ID	On-Demand	Anodyne	ENPP1	67	33
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CN(C(=O)OC(C)(C)C)CCCO1	ZINC000819355986	GF	On-Demand	Anodyne	GPR119	19	41
CCNC(=O)C1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819355987	FD	On-Demand	Mild	PAPA1_CARPA	37	46
CCOC(=O)c1cc(NC(=O)CN2C(=O)N[C@@](C)(c3ccccc3OC)C2=O)ccc1O	ZINC000819355988	ID	On-Demand	Anodyne	ENPP1	67	33
CCNC(=O)C1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819355990	FD	On-Demand	Mild	PAPA1_CARPA	37	46
Cc1cc(CNC[C@H](O)c2cc(F)ccc2F)cc(NC(=O)OC(C)(C)C)c1	ZINC000819356017	GI	On-Demand	Anodyne	LEF	58	33
Cc1cc(CNC[C@@H](O)c2cc(F)ccc2F)cc(NC(=O)OC(C)(C)C)c1	ZINC000819356019	GI	On-Demand	Anodyne	LEF	58	33
Cc1cc(CNC[C@H](O)c2cccc(F)c2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819356026	FI	On-Demand	Anodyne	ADRB1	19	40
Cc1cc(CNC[C@H](O)c2cccc(F)c2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819356026	FI	On-Demand	Anodyne	ADRB3	27	40
Cc1cc(CNC[C@@H](O)c2cccc(F)c2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819356028	FI	On-Demand	Anodyne	ADRB1	19	40
Cc1cc(CNC[C@@H](O)c2cccc(F)c2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819356028	FI	On-Demand	Anodyne	ADRB3	27	40
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(O)c(C(=O)OCC)c1	ZINC000819356045	GG	On-Demand	Anodyne	PAPA1_CARPA	36	45
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(O)c(C(=O)OCC)c1	ZINC000819356045	GG	On-Demand	Anodyne	CTSK	20	40
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ccc(O)c(C(=O)OCC)c1	ZINC000819356045	GG	On-Demand	Anodyne	FPR1	43	36
C=CCCn1cc(C(=O)N[C@H](CC2CC2)C(=O)OCC)nn1	ZINC000819356055	DD	On-Demand	Mild	P2RY12	70	34
C=CCCn1cc(C(=O)N[C@@H](CC2CC2)C(=O)OCC)nn1	ZINC000819356057	DD	On-Demand	Mild	P2RY12	70	34
CN1[C@H]2CC[C@H]1CC(NC[C@@H](O)c1ccc(Br)cc1)C2	ZINC000819356069	EF	On-Demand	Anodyne	CHRM1	19	53
CN1[C@H]2CC[C@H]1CC(NC[C@@H](O)c1ccc(Br)cc1)C2	ZINC000819356069	EF	On-Demand	Anodyne	SLC6A3	25	53
CN1[C@H]2CC[C@H]1CC(NC[C@@H](O)c1ccc(Br)cc1)C2	ZINC000819356069	EF	On-Demand	Anodyne	GLRA1	42	31
CN1[C@H]2CC[C@H]1CC(NC[C@H](O)c1ccc(Br)cc1)C2	ZINC000819356070	EF	On-Demand	Anodyne	CHRM1	19	53
CN1[C@H]2CC[C@H]1CC(NC[C@H](O)c1ccc(Br)cc1)C2	ZINC000819356070	EF	On-Demand	Anodyne	SLC6A3	25	53
CN1[C@H]2CC[C@H]1CC(NC[C@H](O)c1ccc(Br)cc1)C2	ZINC000819356070	EF	On-Demand	Anodyne	GLRA1	42	31
Cn1nccc1[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819356079	EF	On-Demand	Anodyne	ADRB3	37	42
Cn1nccc1[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819356079	EF	On-Demand	Anodyne	CYP3A4	47	36
Cn1nccc1[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819356080	EF	On-Demand	Anodyne	ADRB3	37	42
Cn1nccc1[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819356080	EF	On-Demand	Anodyne	CYP3A4	47	36
Cn1nccc1[C@@H]1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819356081	EF	On-Demand	Anodyne	ADRB3	37	42
Cn1nccc1[C@@H]1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819356081	EF	On-Demand	Anodyne	CYP3A4	47	36
Cn1nccc1[C@@H]1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819356082	EF	On-Demand	Anodyne	ADRB3	37	42
Cn1nccc1[C@@H]1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819356082	EF	On-Demand	Anodyne	CYP3A4	47	36
Cc1cccc(C(C)C)c1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819356087	FJ	On-Demand	Mild	PAPA1_CARPA	44	44
Cc1cccc(C(C)C)c1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819356087	FJ	On-Demand	Mild	SOAT1	27	42
Cc1cccc(C(C)C)c1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819356087	FJ	On-Demand	Mild	FPR1	46	39
Cc1cccc(C(C)C)c1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819356088	FJ	On-Demand	Mild	PAPA1_CARPA	44	44
Cc1cccc(C(C)C)c1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819356088	FJ	On-Demand	Mild	SOAT1	27	42
Cc1cccc(C(C)C)c1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819356088	FJ	On-Demand	Mild	FPR1	46	39
C#Cc1cccc(CNC[C@H](O)COc2ccc(CCOC)cc2)c1	ZINC000819356092	EE	On-Demand	Mild	ADRB2	49	56
C#Cc1cccc(CNC[C@H](O)COc2ccc(CCOC)cc2)c1	ZINC000819356092	EE	On-Demand	Mild	ADRB1	76	56
C#Cc1cccc(CNC[C@H](O)COc2ccc(CCOC)cc2)c1	ZINC000819356092	EE	On-Demand	Mild	GRIN1	17	42
C#Cc1cccc(CNC[C@H](O)COc2ccc(CCOC)cc2)c1	ZINC000819356092	EE	On-Demand	Mild	ADRB3	50	46
C#Cc1cccc(CNC[C@@H](O)COc2ccc(CCOC)cc2)c1	ZINC000819356094	EE	On-Demand	Mild	ADRB2	49	56
C#Cc1cccc(CNC[C@@H](O)COc2ccc(CCOC)cc2)c1	ZINC000819356094	EE	On-Demand	Mild	ADRB1	76	56
C#Cc1cccc(CNC[C@@H](O)COc2ccc(CCOC)cc2)c1	ZINC000819356094	EE	On-Demand	Mild	GRIN1	17	42
C#Cc1cccc(CNC[C@@H](O)COc2ccc(CCOC)cc2)c1	ZINC000819356094	EE	On-Demand	Mild	ADRB3	50	46
C#Cc1cccc(CNC[C@H](O)COCc2ccc(OC)cc2)c1	ZINC000819356121	EE	On-Demand	Mild	ADRB2	25	43
C#Cc1cccc(CNC[C@H](O)COCc2ccc(OC)cc2)c1	ZINC000819356121	EE	On-Demand	Mild	ADRB1	28	43
C#Cc1cccc(CNC[C@H](O)COCc2ccc(OC)cc2)c1	ZINC000819356121	EE	On-Demand	Mild	ADRB3	20	44
C#Cc1cccc(CNC[C@@H](O)COCc2ccc(OC)cc2)c1	ZINC000819356122	EE	On-Demand	Mild	ADRB2	25	43
C#Cc1cccc(CNC[C@@H](O)COCc2ccc(OC)cc2)c1	ZINC000819356122	EE	On-Demand	Mild	ADRB1	28	43
C#Cc1cccc(CNC[C@@H](O)COCc2ccc(OC)cc2)c1	ZINC000819356122	EE	On-Demand	Mild	ADRB3	20	44
C#Cc1cccc(CNC[C@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819356158	DF	On-Demand	Mild	ADRB2	40	48
C#Cc1cccc(CNC[C@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819356158	DF	On-Demand	Mild	ADRB1	53	44
C#Cc1cccc(CNC[C@@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819356159	DF	On-Demand	Mild	ADRB2	40	48
C#Cc1cccc(CNC[C@@H](O)COc2cc(C)cc(C)c2)c1	ZINC000819356159	DF	On-Demand	Mild	ADRB1	53	44
C#Cc1cccc(CNC[C@@H](O)COc2ccccc2C)c1	ZINC000819356164	CF	On-Demand	Mild	ADRB2	39	56
C#Cc1cccc(CNC[C@@H](O)COc2ccccc2C)c1	ZINC000819356164	CF	On-Demand	Mild	ADRB1	57	34
C#Cc1cccc(CNC[C@@H](O)COc2ccccc2C)c1	ZINC000819356164	CF	On-Demand	Mild	CYP2D6	15	45
C#Cc1cccc(CNC[C@@H](O)COc2ccccc2C)c1	ZINC000819356164	CF	On-Demand	Mild	ABCB1	42	38
C#Cc1cccc(CNC[C@H](O)COc2ccccc2C)c1	ZINC000819356165	CF	On-Demand	Mild	ADRB2	39	56
C#Cc1cccc(CNC[C@H](O)COc2ccccc2C)c1	ZINC000819356165	CF	On-Demand	Mild	ADRB1	57	34
C#Cc1cccc(CNC[C@H](O)COc2ccccc2C)c1	ZINC000819356165	CF	On-Demand	Mild	CYP2D6	15	45
C#Cc1cccc(CNC[C@H](O)COc2ccccc2C)c1	ZINC000819356165	CF	On-Demand	Mild	ABCB1	42	38
COc1cccc([S@@](=O)CC(=O)NC2CCC(C)(O)CC2)c1	ZINC000819356168	ED	On-Demand	Anodyne	MTNR1A	32	43
COc1cccc([S@@](=O)CC(=O)NC2CCC(C)(O)CC2)c1	ZINC000819356168	ED	On-Demand	Anodyne	MTNR1B	33	43
COC(=O)c1cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cn1C	ZINC000819356170	GE	On-Demand	Mild	PAPA1_CARPA	41	46
COC(=O)c1cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cn1C	ZINC000819356171	GE	On-Demand	Mild	PAPA1_CARPA	41	46
C=C(CC)CNC[C@@H](O)c1cccnc1	ZINC000819356178	BD	On-Demand	Mild	ADRB2	22	45
C=C(CC)CNC[C@@H](O)c1cccnc1	ZINC000819356178	BD	On-Demand	Mild	ADRB1	24	45
C=C(CC)CNC[C@@H](O)c1cccnc1	ZINC000819356178	BD	On-Demand	Mild	ADRB3	93	45
C=C(CC)CNC[C@H](O)c1cccnc1	ZINC000819356179	BD	On-Demand	Mild	ADRB2	22	45
C=C(CC)CNC[C@H](O)c1cccnc1	ZINC000819356179	BD	On-Demand	Mild	ADRB1	24	45
C=C(CC)CNC[C@H](O)c1cccnc1	ZINC000819356179	BD	On-Demand	Mild	ADRB3	93	45
O=C(Nc1cccc(CN2CCC(O)CC2)c1)C(F)=C1CCC1	ZINC000819356192	DF	On-Demand	Anodyne	ACHE	24	41
O=C(Nc1cccc(CN2CCC(O)CC2)c1)C(F)=C1CCC1	ZINC000819356192	DF	On-Demand	Anodyne	SIGMAR1	27	43
O=C(Nc1cccc(CN2CCC(O)CC2)c1)C(F)=C1CCC1	ZINC000819356192	DF	On-Demand	Anodyne	CCR3	57	44
O=C(Nc1cccc(CN2CCC(O)CC2)c1)C(F)=C1CCC1	ZINC000819356192	DF	On-Demand	Anodyne	FAAH	16	40
O=C(Nc1cccc(CN2CCC(O)CC2)c1)C(F)=C1CCC1	ZINC000819356192	DF	On-Demand	Anodyne	MCHR1	41	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(CN2CCC(O)CC2)c1	ZINC000819356204	GE	On-Demand	Anodyne	SIGMAR1	22	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(CN2CCC(O)CC2)c1	ZINC000819356204	GE	On-Demand	Anodyne	CCR3	39	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(CN2CCC(O)CC2)c1	ZINC000819356204	GE	On-Demand	Anodyne	MCHR1	34	41
CON(C)C(=O)CCNCc1ccc(C#N)c(F)c1	ZINC000819356223	CD	On-Demand	Mild	LEF	40	32
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)c2c(F)cccc2F)C1	ZINC000819356310	GF	On-Demand	Anodyne	GPR119	25	44
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)c2c(F)cccc2F)C1	ZINC000819356313	GF	On-Demand	Anodyne	GPR119	25	44
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819356315	GF	On-Demand	Anodyne	GPR119	25	44
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819356316	GF	On-Demand	Anodyne	GPR119	25	44
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819356318	GE	On-Demand	Mild	GPR119	18	43
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819356321	GE	On-Demand	Mild	GPR119	18	43
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819356322	GE	On-Demand	Mild	GPR119	18	43
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819356323	GE	On-Demand	Mild	GPR119	18	43
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819356331	GF	On-Demand	Anodyne	ADRB1	35	43
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819356331	GF	On-Demand	Anodyne	ADRB3	53	43
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819356331	GF	On-Demand	Anodyne	CYP3A4	49	36
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819356333	GF	On-Demand	Anodyne	ADRB1	35	43
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819356333	GF	On-Demand	Anodyne	ADRB3	53	43
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819356333	GF	On-Demand	Anodyne	CYP3A4	49	36
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819356334	GF	On-Demand	Anodyne	ADRB1	35	43
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819356334	GF	On-Demand	Anodyne	ADRB3	53	43
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819356334	GF	On-Demand	Anodyne	CYP3A4	49	36
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819356335	GF	On-Demand	Anodyne	ADRB1	35	43
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819356335	GF	On-Demand	Anodyne	ADRB3	53	43
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819356335	GF	On-Demand	Anodyne	CYP3A4	49	36
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356346	GF	On-Demand	Anodyne	DRD2	16	50
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356346	GF	On-Demand	Anodyne	DRD4	47	50
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356346	GF	On-Demand	Anodyne	ACHE	38	43
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356346	GF	On-Demand	Anodyne	SIGMAR1	40	41
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356346	GF	On-Demand	Anodyne	CACNA1G	23	40
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356347	GF	On-Demand	Anodyne	DRD2	16	50
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356347	GF	On-Demand	Anodyne	DRD4	47	50
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356347	GF	On-Demand	Anodyne	ACHE	38	43
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356347	GF	On-Demand	Anodyne	SIGMAR1	40	41
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356347	GF	On-Demand	Anodyne	CACNA1G	23	40
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356348	GF	On-Demand	Anodyne	DRD2	16	50
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356348	GF	On-Demand	Anodyne	DRD4	47	50
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356348	GF	On-Demand	Anodyne	ACHE	38	43
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356348	GF	On-Demand	Anodyne	SIGMAR1	40	41
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356348	GF	On-Demand	Anodyne	CACNA1G	23	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356350	GF	On-Demand	Anodyne	DRD2	16	50
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356350	GF	On-Demand	Anodyne	DRD4	47	50
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356350	GF	On-Demand	Anodyne	ACHE	38	43
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356350	GF	On-Demand	Anodyne	SIGMAR1	40	41
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819356350	GF	On-Demand	Anodyne	CACNA1G	23	40
O[C@H](CNC1CCC(OC(F)F)CC1)c1ccccc1	ZINC000819356355	CF	On-Demand	Anodyne	SLC6A3	20	54
O[C@@H](CNC1CCC(OC(F)F)CC1)c1ccccc1	ZINC000819356356	CF	On-Demand	Anodyne	SLC6A3	20	54
C=CCONC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819356375	CD	On-Demand	Mild	ADRB2	27	43
C=CCONC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819356375	CD	On-Demand	Mild	ADRB1	24	43
C=CCONC[C@H](O)COc1c(OC)cccc1OC	ZINC000819356380	CD	On-Demand	Mild	ADRB2	27	43
C=CCONC[C@H](O)COc1c(OC)cccc1OC	ZINC000819356380	CD	On-Demand	Mild	ADRB1	24	43
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819356384	FE	On-Demand	Anodyne	PGC	42	31
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819356384	FE	On-Demand	Anodyne	REN	54	35
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819356384	FE	On-Demand	Anodyne	FPR1	44	35
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819356385	FE	On-Demand	Anodyne	PGC	42	31
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819356385	FE	On-Demand	Anodyne	REN	54	35
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819356385	FE	On-Demand	Anodyne	FPR1	44	35
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819356386	FE	On-Demand	Anodyne	PGC	42	31
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819356386	FE	On-Demand	Anodyne	REN	54	35
CC(C)(C)OC(=O)N1CCCO[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819356386	FE	On-Demand	Anodyne	FPR1	44	35
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819356388	FE	On-Demand	Anodyne	PGC	42	31
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819356388	FE	On-Demand	Anodyne	REN	54	35
CC(C)(C)OC(=O)N1CCCO[C@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819356388	FE	On-Demand	Anodyne	FPR1	44	35
O[C@@H](CNC1CCN(C2CCC2)CC1)c1ccc(Cl)cc1	ZINC000819356410	DF	On-Demand	Anodyne	ADRB3	25	45
O=C(/C=C/[C@@H]1CCCO1)NCCCNC(=O)C1CCC1	ZINC000819356446	CD	On-Demand	Anodyne	TBK1	47	32
O=C(/C=C\[C@H]1CCCO1)NCCCNC(=O)C1CCC1	ZINC000819356447	CD	On-Demand	Anodyne	TBK1	47	32
O=C(/C=C/[C@H]1CCCO1)NCCCNC(=O)C1CCC1	ZINC000819356449	CD	On-Demand	Anodyne	TBK1	47	32
O=C(/C=C\[C@@H]1CCCO1)NCCCNC(=O)C1CCC1	ZINC000819356457	CD	On-Demand	Anodyne	TBK1	47	32
C=CCONC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819356460	CD	On-Demand	Mild	ADRB2	42	63
C=CCONC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819356460	CD	On-Demand	Mild	ADRB1	75	63
C=CCONC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819356460	CD	On-Demand	Mild	ADRB3	44	54
C=CCONC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819356461	CD	On-Demand	Mild	ADRB2	42	63
C=CCONC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819356461	CD	On-Demand	Mild	ADRB1	75	63
C=CCONC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819356461	CD	On-Demand	Mild	ADRB3	44	54
CCOC(=O)c1cc(NC(=O)CSc2cccc[n+]2[O-])ccc1O	ZINC000819356471	ED	On-Demand	Anodyne	ENPP1	61	33
C=CCONCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819356472	CE	On-Demand	Mild	CYNT	44	51
O[C@@H](CNCCC[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819356477	CF	On-Demand	Anodyne	ADRB1	48	44
O[C@@H](CNCCC[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819356477	CF	On-Demand	Anodyne	ADRB3	52	44
O[C@@H](CNCCC[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819356477	CF	On-Demand	Anodyne	CYP3A4	46	34
O[C@H](CNCCC[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819356483	CF	On-Demand	Anodyne	ADRB1	48	44
O[C@H](CNCCC[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819356483	CF	On-Demand	Anodyne	ADRB3	52	44
O[C@H](CNCCC[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819356483	CF	On-Demand	Anodyne	CYP3A4	46	34
O[C@H](CNCCC[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819356489	CF	On-Demand	Anodyne	ADRB1	48	44
O[C@H](CNCCC[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819356489	CF	On-Demand	Anodyne	ADRB3	52	44
O[C@H](CNCCC[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819356489	CF	On-Demand	Anodyne	CYP3A4	46	34
O[C@@H](CNCCC[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819356497	CF	On-Demand	Anodyne	ADRB1	48	44
O[C@@H](CNCCC[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819356497	CF	On-Demand	Anodyne	ADRB3	52	44
O[C@@H](CNCCC[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819356497	CF	On-Demand	Anodyne	CYP3A4	46	34
CCOC(=O)c1cc(NC(=O)/C(=C/c2ccccc2)OC)ccc1O	ZINC000819356519	EG	On-Demand	Anodyne	DHODH	30	40
CCOC(=O)c1cc(NC(=O)/C(=C/c2ccccc2)OC)ccc1O	ZINC000819356519	EG	On-Demand	Anodyne	KCNK3	41	34
CCOC(=O)c1cc(NC(=O)/C(=C\c2ccccc2)OC)ccc1O	ZINC000819356521	EG	On-Demand	Anodyne	DHODH	30	40
CCOC(=O)c1cc(NC(=O)/C(=C\c2ccccc2)OC)ccc1O	ZINC000819356521	EG	On-Demand	Anodyne	KCNK3	41	34
C#Cc1cccc(CNCCC(N)=O)c1	ZINC000819356528	BC	On-Demand	Mild	DPP7	16	44
C=C(CC)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819356534	CE	On-Demand	Mild	CACNA1D	45	34
C=C(CC)CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819356535	CE	On-Demand	Mild	CACNA1D	45	34
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1ccc(C#N)c(F)c1	ZINC000819356537	EE	On-Demand	Mild	ADRB1	41	38
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1ccc(C#N)c(F)c1	ZINC000819356539	EE	On-Demand	Mild	ADRB1	41	38
CCOC(=O)c1cc(NC(=O)C(F)(F)c2ccc(OC)cc2)ccc1O	ZINC000819356553	FG	On-Demand	Anodyne	CA1	15	41
C#Cc1cccc(CNC[C@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819356601	DE	On-Demand	Mild	ADRB2	46	41
C#Cc1cccc(CNC[C@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819356601	DE	On-Demand	Mild	ADRB1	80	41
C#Cc1cccc(CNC[C@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819356601	DE	On-Demand	Mild	ADRB3	48	41
C#Cc1cccc(CNC[C@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819356601	DE	On-Demand	Mild	ABCB1	22	53
C#Cc1cccc(CNC[C@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819356601	DE	On-Demand	Mild	PDS	44	34
CCOC(=O)c1cc(NC(=O)CC[C@@H](C)NC(=O)OC(C)(C)C)ccc1O	ZINC000819356602	GG	On-Demand	Anodyne	LTA4H	15	41
C#Cc1cccc(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819356603	DE	On-Demand	Mild	ADRB2	46	41
C#Cc1cccc(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819356603	DE	On-Demand	Mild	ADRB1	80	41
C#Cc1cccc(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819356603	DE	On-Demand	Mild	ADRB3	48	41
C#Cc1cccc(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819356603	DE	On-Demand	Mild	ABCB1	22	53
C#Cc1cccc(CNC[C@@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819356603	DE	On-Demand	Mild	PDS	44	34
CCOC(=O)c1cc(NC(=O)CC[C@H](C)NC(=O)OC(C)(C)C)ccc1O	ZINC000819356604	GG	On-Demand	Anodyne	LTA4H	15	41
C=C(CC)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819356605	BF	On-Demand	Mild	ADRB1	34	45
C=C(CC)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819356605	BF	On-Demand	Mild	ADRB3	50	45
C=C(CC)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819356607	BF	On-Demand	Mild	ADRB1	34	45
C=C(CC)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819356607	BF	On-Demand	Mild	ADRB3	50	45
C#Cc1cccc(CNC[C@H](O)COc2cccc(CC)c2)c1	ZINC000819356608	DF	On-Demand	Mild	ADRB2	45	45
C#Cc1cccc(CNC[C@H](O)COc2cccc(CC)c2)c1	ZINC000819356608	DF	On-Demand	Mild	ADRB1	60	45
C#Cc1cccc(CNC[C@H](O)COc2cccc(CC)c2)c1	ZINC000819356608	DF	On-Demand	Mild	ADRB3	39	41
C#Cc1cccc(CNC[C@H](O)COc2cccc(CC)c2)c1	ZINC000819356608	DF	On-Demand	Mild	PDS	58	37
C#Cc1cccc(CNC[C@@H](O)COc2cccc(CC)c2)c1	ZINC000819356609	DF	On-Demand	Mild	ADRB2	45	45
C#Cc1cccc(CNC[C@@H](O)COc2cccc(CC)c2)c1	ZINC000819356609	DF	On-Demand	Mild	ADRB1	60	45
C#Cc1cccc(CNC[C@@H](O)COc2cccc(CC)c2)c1	ZINC000819356609	DF	On-Demand	Mild	ADRB3	39	41
C#Cc1cccc(CNC[C@@H](O)COc2cccc(CC)c2)c1	ZINC000819356609	DF	On-Demand	Mild	PDS	58	37
C=CCONC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819356619	CE	On-Demand	Mild	ADRB2	23	45
COc1ccc(OCC(F)(F)C(F)F)c(C(=O)NC2CCC(C)(O)CC2)c1	ZINC000819356620	GG	On-Demand	Anodyne	HPGDS	26	40
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(CN2CCC(O)CC2)c1	ZINC000819356622	EE	On-Demand	Anodyne	CCR3	33	41
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(CN2CCC(O)CC2)c1	ZINC000819356624	EE	On-Demand	Anodyne	CCR3	33	41
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(CN2CCC(O)CC2)c1	ZINC000819356626	EE	On-Demand	Anodyne	CCR3	33	41
C=CCONC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819356627	CE	On-Demand	Mild	ADRB2	23	45
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(CN2CCC(O)CC2)c1	ZINC000819356629	EE	On-Demand	Anodyne	CCR3	33	41
CN1[C@H]2CC[C@H]1CC(NC[C@@H](O)c1ccc(F)cc1Cl)C2	ZINC000819356634	DF	On-Demand	Anodyne	SLC6A3	25	47
CN1[C@H]2CC[C@H]1CC(NC[C@H](O)c1ccc(F)cc1Cl)C2	ZINC000819356636	DF	On-Demand	Anodyne	SLC6A3	25	47
C=CCOc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819356663	EG	On-Demand	Mild	PRNP	33	43
C=CCOc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819356663	EG	On-Demand	Mild	PLAU	19	47
C=CCOc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819356663	EG	On-Demand	Mild	ACR	45	35
C=CCOc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819356663	EG	On-Demand	Mild	KCNK3	47	35
Cc1cc(CNC[C@H](O)c2ccccc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819356684	FI	On-Demand	Anodyne	ADRB3	43	42
Cc1cc(CNC[C@@H](O)c2ccccc2)cc(NC(=O)OC(C)(C)C)c1	ZINC000819356686	FI	On-Demand	Anodyne	ADRB3	43	42
CC(C)c1nn(-c2ccccc2)cc1C(=O)NCc1ccc([C@H](C)O)cc1	ZINC000819356688	FH	On-Demand	Anodyne	UL54	57	34
CC(C)c1nn(-c2ccccc2)cc1C(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000819356690	FH	On-Demand	Anodyne	UL54	57	34
CCOC(=O)c1cc(NC(=O)C[C@H]2CCN(C(=O)OC(C)(C)C)C2)ccc1O	ZINC000819356745	GG	On-Demand	Anodyne	EPHX2	17	41
CCOC(=O)c1cc(NC(=O)C[C@H]2CCN(C(=O)OC(C)(C)C)C2)ccc1O	ZINC000819356745	GG	On-Demand	Anodyne	GPR119	35	40
Cc1cc(F)ccc1[C@@H](O)CNC1C[C@@H]2CC[C@H](C1)N2C	ZINC000819356776	CE	On-Demand	Anodyne	CHRM1	17	45
Cc1cc(F)ccc1[C@@H](O)CNC1C[C@@H]2CC[C@H](C1)N2C	ZINC000819356776	CE	On-Demand	Anodyne	SLC6A3	21	45
Cc1ccc(F)c(CCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819356780	DG	On-Demand	Anodyne	ADRB2	35	44
Cc1ccc(F)c(CCNC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819356780	DG	On-Demand	Anodyne	ADRB3	42	39
Cc1ccc(F)c(CCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819356781	DG	On-Demand	Anodyne	ADRB2	35	44
Cc1ccc(F)c(CCNC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819356781	DG	On-Demand	Anodyne	ADRB3	42	39
CN1C(=O)CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819356818	GF	On-Demand	Mild	PAPA1_CARPA	49	44
CN1C(=O)CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819356818	GF	On-Demand	Mild	CTSL	15	44
CN1C(=O)CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819356818	GF	On-Demand	Mild	FPR1	42	35
CN1C(=O)CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819356819	GF	On-Demand	Mild	PAPA1_CARPA	49	44
CN1C(=O)CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819356819	GF	On-Demand	Mild	CTSL	15	44
CN1C(=O)CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819356819	GF	On-Demand	Mild	FPR1	42	35
CN1CCC(N(Cc2ccccc2)C(=O)C(F)=C2CCC2)CC1	ZINC000819356866	DH	On-Demand	Anodyne	CCR5	21	41
CN1CCC(N(Cc2ccccc2)C(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819356870	GG	On-Demand	Anodyne	CCKAR	17	40
CN1CCC(N(Cc2ccccc2)C(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819356870	GG	On-Demand	Anodyne	REN	36	44
CN1CCC(N(Cc2ccccc2)C(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819356870	GG	On-Demand	Anodyne	FPR1	43	35
C#Cc1cccc(CNC[C@@H](O)COc2ccc(OCC)cc2)c1	ZINC000819356883	EF	On-Demand	Mild	ADRB2	47	44
C#Cc1cccc(CNC[C@@H](O)COc2ccc(OCC)cc2)c1	ZINC000819356883	EF	On-Demand	Mild	ADRB1	64	44
C#Cc1cccc(CNC[C@@H](O)COc2ccc(OCC)cc2)c1	ZINC000819356883	EF	On-Demand	Mild	ADRB3	38	41
C#Cc1cccc(CNC[C@@H](O)COc2ccc(OCC)cc2)c1	ZINC000819356883	EF	On-Demand	Mild	PDS	56	36
C#Cc1cccc(CNC[C@H](O)COc2ccc(OCC)cc2)c1	ZINC000819356884	EF	On-Demand	Mild	ADRB2	47	44
C#Cc1cccc(CNC[C@H](O)COc2ccc(OCC)cc2)c1	ZINC000819356884	EF	On-Demand	Mild	ADRB1	64	44
C#Cc1cccc(CNC[C@H](O)COc2ccc(OCC)cc2)c1	ZINC000819356884	EF	On-Demand	Mild	ADRB3	38	41
C#Cc1cccc(CNC[C@H](O)COc2ccc(OCC)cc2)c1	ZINC000819356884	EF	On-Demand	Mild	PDS	56	36
CCC1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)COC1	ZINC000819356966	CD	On-Demand	Bother	CACNA1D	46	32
CCC1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)COC1	ZINC000819356969	CD	On-Demand	Bother	CACNA1D	46	32
C#Cc1cccc(CNC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819356983	DF	On-Demand	Mild	ADRB2	22	43
C#Cc1cccc(CNC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819356983	DF	On-Demand	Mild	ADRB1	18	40
C#Cc1cccc(CNC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819356985	DF	On-Demand	Mild	ADRB2	22	43
C#Cc1cccc(CNC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819356985	DF	On-Demand	Mild	ADRB1	18	40
CCOC(=O)c1cc(NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)ccc1O	ZINC000819356988	HH	On-Demand	Anodyne	CTSK	17	41
CCOC(=O)c1cc(NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)ccc1O	ZINC000819356988	HH	On-Demand	Anodyne	FPR1	48	37
CCOC(=O)c1cc(NC(=O)C#Cc2ccccc2)ccc1O	ZINC000819356999	DF	On-Demand	Mild	CA1	33	42
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819357015	HD	On-Demand	Mild	CA2	20	44
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819357015	HD	On-Demand	Mild	CA1	17	43
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819357015	HD	On-Demand	Mild	CA7	20	43
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819357015	HD	On-Demand	Mild	CA14	17	43
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819357015	HD	On-Demand	Mild	CA9	15	44
CCOC(=O)c1cc(NC(=O)CCn2cc[nH]c(=O)c2=O)ccc1O	ZINC000819357024	EC	On-Demand	Anodyne	ENPP1	55	33
CCOC(=O)c1cc(NC(=O)C[C@H](O)c2ccc(Cl)cc2)ccc1O	ZINC000819357036	FG	On-Demand	Anodyne	SLC1A1	41	41
CCOC(=O)c1cc(NC(=O)C[C@H](O)c2ccc(Cl)cc2)ccc1O	ZINC000819357036	FG	On-Demand	Anodyne	SLC1A3	42	38
CCOC(=O)c1cc(NC(=O)C[C@H](O)c2ccc(Cl)cc2)ccc1O	ZINC000819357036	FG	On-Demand	Anodyne	SLC1A2	57	42
CCOC(=O)c1cc(NC(=O)C[C@@H](O)c2ccc(Cl)cc2)ccc1O	ZINC000819357037	FG	On-Demand	Anodyne	SLC1A1	41	41
CCOC(=O)c1cc(NC(=O)C[C@@H](O)c2ccc(Cl)cc2)ccc1O	ZINC000819357037	FG	On-Demand	Anodyne	SLC1A3	42	38
CCOC(=O)c1cc(NC(=O)C[C@@H](O)c2ccc(Cl)cc2)ccc1O	ZINC000819357037	FG	On-Demand	Anodyne	SLC1A2	57	42
C#Cc1cccc(CNC[C@@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819357074	ED	On-Demand	Mild	ADRB2	57	48
C#Cc1cccc(CNC[C@@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819357074	ED	On-Demand	Mild	ADRB1	90	48
C#Cc1cccc(CNC[C@@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819357074	ED	On-Demand	Mild	GRIN1	15	45
C#Cc1cccc(CNC[C@@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819357074	ED	On-Demand	Mild	ADRB3	58	48
C#Cc1cccc(CNC[C@@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819357074	ED	On-Demand	Mild	ABCB1	21	44
C#Cc1cccc(CNC[C@@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819357074	ED	On-Demand	Mild	PDS	45	34
C#Cc1cccc(CNC[C@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819357075	ED	On-Demand	Mild	ADRB2	57	48
C#Cc1cccc(CNC[C@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819357075	ED	On-Demand	Mild	ADRB1	90	48
C#Cc1cccc(CNC[C@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819357075	ED	On-Demand	Mild	GRIN1	15	45
C#Cc1cccc(CNC[C@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819357075	ED	On-Demand	Mild	ADRB3	58	48
C#Cc1cccc(CNC[C@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819357075	ED	On-Demand	Mild	ABCB1	21	44
C#Cc1cccc(CNC[C@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819357075	ED	On-Demand	Mild	PDS	45	34
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCc2ccc(C#N)c(F)c2)CC1	ZINC000819357078	GF	On-Demand	Mild	GPR119	28	46
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCc2ccc(C#N)c(F)c2)CC1	ZINC000819357079	GF	On-Demand	Mild	GPR119	28	46
CN(C)[C@@H]1CCC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819357092	FF	On-Demand	Mild	PAPA1_CARPA	36	45
CN(C)[C@@H]1CCC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819357093	FF	On-Demand	Mild	PAPA1_CARPA	36	45
CN(C)[C@@H]1CCC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819357094	FF	On-Demand	Mild	PAPA1_CARPA	36	45
CN(C)[C@@H]1CCC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819357095	FF	On-Demand	Mild	PAPA1_CARPA	36	45
C#Cc1cccc(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819357102	EE	On-Demand	Mild	ADRB2	51	54
C#Cc1cccc(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819357102	EE	On-Demand	Mild	ADRB1	91	54
C#Cc1cccc(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819357102	EE	On-Demand	Mild	TSHR	42	31
C#Cc1cccc(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819357102	EE	On-Demand	Mild	GRIN1	28	46
C#Cc1cccc(CNC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819357102	EE	On-Demand	Mild	ADRB3	58	54
C#Cc1cccc(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819357103	EE	On-Demand	Mild	ADRB2	51	54
C#Cc1cccc(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819357103	EE	On-Demand	Mild	ADRB1	91	54
C#Cc1cccc(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819357103	EE	On-Demand	Mild	TSHR	42	31
C#Cc1cccc(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819357103	EE	On-Demand	Mild	GRIN1	28	46
C#Cc1cccc(CNC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819357103	EE	On-Demand	Mild	ADRB3	58	54
C#Cc1cccc(CNC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819357122	GD	On-Demand	Mild	DRD4	43	35
C#Cc1cccc(CNC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819357122	GD	On-Demand	Mild	ABCB1	44	40
C#Cc1cccc(CNC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819357123	GD	On-Demand	Mild	DRD4	43	35
C#Cc1cccc(CNC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819357123	GD	On-Demand	Mild	ABCB1	44	40
O=C(Nc1ccc(OCC(F)F)cc1)C(F)=C1CCC1	ZINC000819357130	CH	On-Demand	Anodyne	ADRB1	18	41
C=CCC1(CNC[C@H](O)c2cccnc2)CCCC1	ZINC000819357183	CF	On-Demand	Mild	ADRB3	85	42
C=CCC1(CNC[C@@H](O)c2cccnc2)CCCC1	ZINC000819357185	CF	On-Demand	Mild	ADRB3	85	42
CNC(=O)C[C@H](C)NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819357225	FC	On-Demand	Clean	ABCB1	37	40
CNC(=O)C[C@@H](C)NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819357226	FC	On-Demand	Clean	ABCB1	37	40
CNC(=O)C[C@H](C)NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819357227	FC	On-Demand	Clean	ABCB1	37	40
CNC(=O)C[C@@H](C)NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819357228	FC	On-Demand	Clean	ABCB1	37	40
C#Cc1cccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819357269	DE	On-Demand	Mild	ADRB2	41	43
C#Cc1cccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819357269	DE	On-Demand	Mild	ADRB1	67	41
C#Cc1cccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819357269	DE	On-Demand	Mild	ADRB3	40	41
C#Cc1cccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819357269	DE	On-Demand	Mild	ABCB1	21	46
C#Cc1cccc(CNC[C@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819357269	DE	On-Demand	Mild	PDS	67	39
C#Cc1cccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819357270	DE	On-Demand	Mild	ADRB2	41	43
C#Cc1cccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819357270	DE	On-Demand	Mild	ADRB1	67	41
C#Cc1cccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819357270	DE	On-Demand	Mild	ADRB3	40	41
C#Cc1cccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819357270	DE	On-Demand	Mild	ABCB1	21	46
C#Cc1cccc(CNC[C@@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819357270	DE	On-Demand	Mild	PDS	67	39
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc(C#N)c(F)c2)CC1	ZINC000819357282	GF	On-Demand	Mild	GPR119	53	51
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc(C#N)c(F)c2)CC1	ZINC000819357283	GF	On-Demand	Mild	GPR119	53	51
CCC[C@@H]1CCCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819357289	CG	On-Demand	Anodyne	ADRB2	21	40
CCC[C@@H]1CCCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819357289	CG	On-Demand	Anodyne	ADRB1	25	43
CCC[C@@H]1CCCC[C@@H]1CNC[C@@H](O)c1cccnc1	ZINC000819357289	CG	On-Demand	Anodyne	ADRB3	92	46
CCC[C@@H]1CCCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819357290	CG	On-Demand	Anodyne	ADRB2	21	40
CCC[C@@H]1CCCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819357290	CG	On-Demand	Anodyne	ADRB1	25	43
CCC[C@@H]1CCCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819357290	CG	On-Demand	Anodyne	ADRB3	92	46
CCC[C@@H]1CCCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819357291	CG	On-Demand	Anodyne	ADRB2	21	40
CCC[C@@H]1CCCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819357291	CG	On-Demand	Anodyne	ADRB1	25	43
CCC[C@@H]1CCCC[C@@H]1CNC[C@H](O)c1cccnc1	ZINC000819357291	CG	On-Demand	Anodyne	ADRB3	92	46
CCC[C@@H]1CCCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819357292	CG	On-Demand	Anodyne	ADRB2	21	40
CCC[C@@H]1CCCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819357292	CG	On-Demand	Anodyne	ADRB1	25	43
CCC[C@@H]1CCCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819357292	CG	On-Demand	Anodyne	ADRB3	92	46
CN1CCC(N(Cc2ccccc2)C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819357293	EF	On-Demand	Anodyne	CYP2J2	42	30
CN1CCC(N(Cc2ccccc2)C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819357294	EF	On-Demand	Anodyne	CYP2J2	42	30
CN1CCC(N(Cc2ccccc2)C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819357295	EF	On-Demand	Anodyne	CYP2J2	42	30
CN1CCC(N(Cc2ccccc2)C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819357296	EF	On-Demand	Anodyne	CYP2J2	42	30
C#Cc1cccc(CNC[C@@H](O)COc2ccc(/C=C\C)cc2OC)c1	ZINC000819357346	FG	On-Demand	Mild	ADRB2	16	58
C#Cc1cccc(CNC[C@H](O)COc2ccc(/C=C\C)cc2OC)c1	ZINC000819357348	FG	On-Demand	Mild	ADRB2	16	58
C#Cc1cccc(CNC[C@H](O)COc2ccc(/C=C/C)cc2OC)c1	ZINC000819357349	FG	On-Demand	Mild	ADRB2	16	58
C#Cc1cccc(CNC[C@@H](O)COc2ccc(/C=C/C)cc2OC)c1	ZINC000819357351	FG	On-Demand	Mild	ADRB2	16	58
O[C@H](CNC[C@@H]1C[C@H]1C1CC1)c1cccc(Cl)c1	ZINC000819357370	CG	On-Demand	Anodyne	ADRB1	31	42
O[C@H](CNC[C@@H]1C[C@H]1C1CC1)c1cccc(Cl)c1	ZINC000819357370	CG	On-Demand	Anodyne	ADRB3	44	42
O[C@@H](CNC[C@@H]1C[C@H]1C1CC1)c1cccc(Cl)c1	ZINC000819357372	CG	On-Demand	Anodyne	ADRB1	31	42
O[C@@H](CNC[C@@H]1C[C@H]1C1CC1)c1cccc(Cl)c1	ZINC000819357372	CG	On-Demand	Anodyne	ADRB3	44	42
C#Cc1cccc(CNC[C@@H](O)COc2ccc(C)cc2)c1	ZINC000819357374	CF	On-Demand	Mild	ADRB2	46	49
C#Cc1cccc(CNC[C@@H](O)COc2ccc(C)cc2)c1	ZINC000819357374	CF	On-Demand	Mild	ADRB1	63	44
C#Cc1cccc(CNC[C@@H](O)COc2ccc(C)cc2)c1	ZINC000819357374	CF	On-Demand	Mild	ADRB3	37	44
C#Cc1cccc(CNC[C@H](O)COc2ccc(C)cc2)c1	ZINC000819357375	CF	On-Demand	Mild	ADRB2	46	49
C#Cc1cccc(CNC[C@H](O)COc2ccc(C)cc2)c1	ZINC000819357375	CF	On-Demand	Mild	ADRB1	63	44
C#Cc1cccc(CNC[C@H](O)COc2ccc(C)cc2)c1	ZINC000819357375	CF	On-Demand	Mild	ADRB3	37	44
C#Cc1cccc(CNC[C@H](O)COc2cccc(C(=O)OCC)c2)c1	ZINC000819357392	FE	On-Demand	Mild	ADRB2	42	48
C#Cc1cccc(CNC[C@H](O)COc2cccc(C(=O)OCC)c2)c1	ZINC000819357392	FE	On-Demand	Mild	ADRB1	59	41
C#Cc1cccc(CNC[C@H](O)COc2cccc(C(=O)OCC)c2)c1	ZINC000819357392	FE	On-Demand	Mild	ADRB3	39	41
C#Cc1cccc(CNC[C@H](O)COc2cccc(C(=O)OCC)c2)c1	ZINC000819357392	FE	On-Demand	Mild	ABCB1	20	43
C#Cc1cccc(CNC[C@H](O)COc2cccc(C(=O)OCC)c2)c1	ZINC000819357392	FE	On-Demand	Mild	PDS	78	51
C#Cc1cccc(CNC[C@@H](O)COc2cccc(C(=O)OCC)c2)c1	ZINC000819357393	FE	On-Demand	Mild	ADRB2	42	48
C#Cc1cccc(CNC[C@@H](O)COc2cccc(C(=O)OCC)c2)c1	ZINC000819357393	FE	On-Demand	Mild	ADRB1	59	41
C#Cc1cccc(CNC[C@@H](O)COc2cccc(C(=O)OCC)c2)c1	ZINC000819357393	FE	On-Demand	Mild	ADRB3	39	41
C#Cc1cccc(CNC[C@@H](O)COc2cccc(C(=O)OCC)c2)c1	ZINC000819357393	FE	On-Demand	Mild	ABCB1	20	43
C#Cc1cccc(CNC[C@@H](O)COc2cccc(C(=O)OCC)c2)c1	ZINC000819357393	FE	On-Demand	Mild	PDS	78	51
C#Cc1cccc(CNC[C@H](O)COc2ccc(CC=C)cc2OC)c1	ZINC000819357471	FF	On-Demand	Mild	ADRB2	17	42
C#Cc1cccc(CNC[C@@H](O)COc2ccc(CC=C)cc2OC)c1	ZINC000819357472	FF	On-Demand	Mild	ADRB2	17	42
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819357486	GD	On-Demand	Anodyne	SIGMAR1	19	42
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819357486	GD	On-Demand	Anodyne	CCR3	15	41
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819357486	GD	On-Demand	Anodyne	DPP7	43	37
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819357486	GD	On-Demand	Anodyne	DPOL_VZVD	22	40
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819357487	GD	On-Demand	Anodyne	SIGMAR1	19	42
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819357487	GD	On-Demand	Anodyne	CCR3	15	41
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819357487	GD	On-Demand	Anodyne	DPP7	43	37
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCOCC3)cc2)C1	ZINC000819357487	GD	On-Demand	Anodyne	DPOL_VZVD	22	40
C#Cc1cccc(CNC[C@H](O)COc2cc(C)ccc2C)c1	ZINC000819357489	DF	On-Demand	Mild	ADRB2	33	43
C#Cc1cccc(CNC[C@H](O)COc2cc(C)ccc2C)c1	ZINC000819357489	DF	On-Demand	Mild	ADRB1	52	37
C#Cc1cccc(CNC[C@@H](O)COc2cc(C)ccc2C)c1	ZINC000819357492	DF	On-Demand	Mild	ADRB2	33	43
C#Cc1cccc(CNC[C@@H](O)COc2cc(C)ccc2C)c1	ZINC000819357492	DF	On-Demand	Mild	ADRB1	52	37
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000819357497	GF	On-Demand	Anodyne	ESR1	86	40
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000819357497	GF	On-Demand	Anodyne	SLC6A1	61	34
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000819357497	GF	On-Demand	Anodyne	ESR2	58	40
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000819357497	GF	On-Demand	Anodyne	LTA4H	78	51
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000819357497	GF	On-Demand	Anodyne	HRH3	80	47
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000819357497	GF	On-Demand	Anodyne	PSMB2	44	44
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000819357497	GF	On-Demand	Anodyne	PSMB1	48	44
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000819357498	GF	On-Demand	Anodyne	ESR1	86	40
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000819357498	GF	On-Demand	Anodyne	SLC6A1	61	34
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000819357498	GF	On-Demand	Anodyne	ESR2	58	40
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000819357498	GF	On-Demand	Anodyne	LTA4H	78	51
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000819357498	GF	On-Demand	Anodyne	HRH3	80	47
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000819357498	GF	On-Demand	Anodyne	PSMB2	44	44
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(OCCN3CCCC3)cc2)C1	ZINC000819357498	GF	On-Demand	Anodyne	PSMB1	48	44
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357500	GE	On-Demand	Anodyne	HTR1A	110	56
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357500	GE	On-Demand	Anodyne	DRD2	81	53
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357500	GE	On-Demand	Anodyne	DRD4	48	46
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357500	GE	On-Demand	Anodyne	ADRA1D	52	50
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357500	GE	On-Demand	Anodyne	HTR2A	76	56
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357500	GE	On-Demand	Anodyne	HTR2C	42	46
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357500	GE	On-Demand	Anodyne	SLC6A1	70	36
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357500	GE	On-Demand	Anodyne	SLC6A4	20	44
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357500	GE	On-Demand	Anodyne	ADRA1A	70	50
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357500	GE	On-Demand	Anodyne	HRH1	16	43
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357500	GE	On-Demand	Anodyne	ADRA1B	50	50
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357500	GE	On-Demand	Anodyne	DRD3	99	56
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357500	GE	On-Demand	Anodyne	HTR4	20	43
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357500	GE	On-Demand	Anodyne	DRD5	19	44
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357500	GE	On-Demand	Anodyne	HTR7	113	45
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357500	GE	On-Demand	Anodyne	SIGMAR1	24	45
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357500	GE	On-Demand	Anodyne	CCR3	32	42
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357500	GE	On-Demand	Anodyne	ADAM10	36	40
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357501	GE	On-Demand	Anodyne	HTR1A	110	56
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357501	GE	On-Demand	Anodyne	DRD2	81	53
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357501	GE	On-Demand	Anodyne	DRD4	48	46
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357501	GE	On-Demand	Anodyne	ADRA1D	52	50
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357501	GE	On-Demand	Anodyne	HTR2A	76	56
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357501	GE	On-Demand	Anodyne	HTR2C	42	46
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357501	GE	On-Demand	Anodyne	SLC6A1	70	36
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357501	GE	On-Demand	Anodyne	SLC6A4	20	44
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357501	GE	On-Demand	Anodyne	ADRA1A	70	50
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357501	GE	On-Demand	Anodyne	HRH1	16	43
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357501	GE	On-Demand	Anodyne	ADRA1B	50	50
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357501	GE	On-Demand	Anodyne	DRD3	99	56
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357501	GE	On-Demand	Anodyne	HTR4	20	43
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357501	GE	On-Demand	Anodyne	DRD5	19	44
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357501	GE	On-Demand	Anodyne	HTR7	113	45
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357501	GE	On-Demand	Anodyne	SIGMAR1	24	45
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357501	GE	On-Demand	Anodyne	CCR3	32	42
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccccc3)CC2)C1	ZINC000819357501	GE	On-Demand	Anodyne	ADAM10	36	40
O=C(O)C[C@H]1CCCN(C(=O)NCCc2ccc(Cl)nc2)C1	ZINC000819357502	EE	On-Demand	Anodyne	GPBAR1	20	40
O=C(O)C[C@@H]1CCCN(C(=O)NCCc2ccc(Cl)nc2)C1	ZINC000819357503	EE	On-Demand	Anodyne	GPBAR1	20	40
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819357518	ED	On-Demand	Anodyne	HTR1A	28	42
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819357518	ED	On-Demand	Anodyne	DRD2	17	40
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819357518	ED	On-Demand	Anodyne	SLC6A1	73	34
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819357518	ED	On-Demand	Anodyne	DRD3	17	42
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819357518	ED	On-Demand	Anodyne	HTR4	15	40
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819357518	ED	On-Demand	Anodyne	SIGMAR1	17	40
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819357518	ED	On-Demand	Anodyne	PREP	40	40
O=C(O)C[C@H]1CCCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819357519	ED	On-Demand	Anodyne	HTR1A	28	42
O=C(O)C[C@H]1CCCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819357519	ED	On-Demand	Anodyne	DRD2	17	40
O=C(O)C[C@H]1CCCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819357519	ED	On-Demand	Anodyne	SLC6A1	73	34
O=C(O)C[C@H]1CCCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819357519	ED	On-Demand	Anodyne	DRD3	17	42
O=C(O)C[C@H]1CCCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819357519	ED	On-Demand	Anodyne	HTR4	15	40
O=C(O)C[C@H]1CCCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819357519	ED	On-Demand	Anodyne	SIGMAR1	17	40
O=C(O)C[C@H]1CCCN(C(=O)NCCN2Cc3ccccc3C2)C1	ZINC000819357519	ED	On-Demand	Anodyne	PREP	40	40
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1	ZINC000819357521	EF	On-Demand	Clean	DPP7	46	35
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(N3CCCC3)cc2)C1	ZINC000819357522	EF	On-Demand	Clean	DPP7	46	35
O=C(O)C[C@H]1CCCN(C(=O)NCc2cccc(CN3CCOCC3)c2)C1	ZINC000819357528	GD	On-Demand	Anodyne	CHRM3	18	40
O[C@@H](CNC[C@@H]1C[C@H]1C1CC1)c1cccnc1	ZINC000819357529	BD	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNC[C@@H]1C[C@H]1C1CC1)c1cccnc1	ZINC000819357529	BD	On-Demand	Anodyne	ADRB1	20	41
O[C@@H](CNC[C@@H]1C[C@H]1C1CC1)c1cccnc1	ZINC000819357529	BD	On-Demand	Anodyne	ADRB3	84	43
O=C(O)C[C@@H]1CCCN(C(=O)NCc2cccc(CN3CCOCC3)c2)C1	ZINC000819357530	GD	On-Demand	Anodyne	CHRM3	18	40
O=C(O)C[C@@H]1CCCN(C(=O)NCC2CCN(Cc3cccs3)CC2)C1	ZINC000819357531	GF	On-Demand	Anodyne	CACNA1I	52	35
O=C(O)C[C@H]1CCCN(C(=O)NCC2CCN(Cc3cccs3)CC2)C1	ZINC000819357532	GF	On-Demand	Anodyne	CACNA1I	52	35
O[C@H](CNC[C@@H]1C[C@H]1C1CC1)c1cccnc1	ZINC000819357533	BD	On-Demand	Anodyne	ADRB2	19	40
O[C@H](CNC[C@@H]1C[C@H]1C1CC1)c1cccnc1	ZINC000819357533	BD	On-Demand	Anodyne	ADRB1	20	41
O[C@H](CNC[C@@H]1C[C@H]1C1CC1)c1cccnc1	ZINC000819357533	BD	On-Demand	Anodyne	ADRB3	84	43
C#Cc1cccc(CNC[C@@H](O)COc2cccc(C)c2)c1	ZINC000819357568	CF	On-Demand	Mild	ADRB2	43	55
C#Cc1cccc(CNC[C@@H](O)COc2cccc(C)c2)c1	ZINC000819357568	CF	On-Demand	Mild	ADRB1	56	55
C#Cc1cccc(CNC[C@@H](O)COc2cccc(C)c2)c1	ZINC000819357568	CF	On-Demand	Mild	ADRB3	35	40
C#Cc1cccc(CNC[C@@H](O)COc2cccc(C)c2)c1	ZINC000819357568	CF	On-Demand	Mild	PDS	43	42
C#Cc1cccc(CNC[C@H](O)COc2cccc(C)c2)c1	ZINC000819357572	CF	On-Demand	Mild	ADRB2	43	55
C#Cc1cccc(CNC[C@H](O)COc2cccc(C)c2)c1	ZINC000819357572	CF	On-Demand	Mild	ADRB1	56	55
C#Cc1cccc(CNC[C@H](O)COc2cccc(C)c2)c1	ZINC000819357572	CF	On-Demand	Mild	ADRB3	35	40
C#Cc1cccc(CNC[C@H](O)COc2cccc(C)c2)c1	ZINC000819357572	CF	On-Demand	Mild	PDS	43	42
C#Cc1cccc(CNC[C@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819357590	DE	On-Demand	Mild	ADRB2	39	41
C#Cc1cccc(CNC[C@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819357590	DE	On-Demand	Mild	ADRB1	58	41
C#Cc1cccc(CNC[C@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819357590	DE	On-Demand	Mild	ADRB3	37	41
C#Cc1cccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819357592	DE	On-Demand	Mild	ADRB2	39	41
C#Cc1cccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819357592	DE	On-Demand	Mild	ADRB1	58	41
C#Cc1cccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819357592	DE	On-Demand	Mild	ADRB3	37	41
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819357612	FE	On-Demand	Anodyne	PREP	26	40
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819357612	FE	On-Demand	Anodyne	DPP7	44	35
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819357612	FE	On-Demand	Anodyne	PROC	46	35
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819357612	FE	On-Demand	Anodyne	L3MBTL3	87	43
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819357612	FE	On-Demand	Anodyne	NAMPT	23	40
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819357612	FE	On-Demand	Anodyne	TMPRSS11D	53	33
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819357614	FE	On-Demand	Anodyne	PREP	26	40
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819357614	FE	On-Demand	Anodyne	DPP7	44	35
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819357614	FE	On-Demand	Anodyne	PROC	46	35
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819357614	FE	On-Demand	Anodyne	L3MBTL3	87	43
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819357614	FE	On-Demand	Anodyne	NAMPT	23	40
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819357614	FE	On-Demand	Anodyne	TMPRSS11D	53	33
CNC(=O)CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819357618	GC	On-Demand	Mild	PAPA1_CARPA	31	41
CNC(=O)CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819357620	GC	On-Demand	Mild	PAPA1_CARPA	31	41
C#Cc1cccc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819357631	FF	On-Demand	Mild	GPR119	40	52
C#Cc1cccc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819357632	FF	On-Demand	Mild	GPR119	40	52
C#Cc1cccc(CNC[C@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819357636	FF	On-Demand	Mild	ADRB2	52	45
C#Cc1cccc(CNC[C@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819357636	FF	On-Demand	Mild	ADRB1	82	46
C#Cc1cccc(CNC[C@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819357636	FF	On-Demand	Mild	GRIN1	23	43
C#Cc1cccc(CNC[C@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819357636	FF	On-Demand	Mild	ADRB3	56	45
C#Cc1cccc(CNC[C@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819357636	FF	On-Demand	Mild	ABCB1	34	45
C#Cc1cccc(CNC[C@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819357636	FF	On-Demand	Mild	FFAR1	42	42
C#Cc1cccc(CNC[C@@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819357637	FF	On-Demand	Mild	ADRB2	52	45
C#Cc1cccc(CNC[C@@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819357637	FF	On-Demand	Mild	ADRB1	82	46
C#Cc1cccc(CNC[C@@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819357637	FF	On-Demand	Mild	GRIN1	23	43
C#Cc1cccc(CNC[C@@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819357637	FF	On-Demand	Mild	ADRB3	56	45
C#Cc1cccc(CNC[C@@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819357637	FF	On-Demand	Mild	ABCB1	34	45
C#Cc1cccc(CNC[C@@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819357637	FF	On-Demand	Mild	FFAR1	42	42
C#Cc1cccc(CNC[C@H](O)COc2c(C)cccc2C)c1	ZINC000819357638	DF	On-Demand	Mild	ADRB2	26	41
C#Cc1cccc(CNC[C@@H](O)COc2c(C)cccc2C)c1	ZINC000819357639	DF	On-Demand	Mild	ADRB2	26	41
CC(=O)Nc1cccc(CC(=O)NC2CCC(C)(O)CC2)c1	ZINC000819357661	DD	On-Demand	Anodyne	SIGMAR1	20	44
CC(=O)Nc1cccc(CC(=O)NC2CCC(C)(O)CC2)c1	ZINC000819357661	DD	On-Demand	Anodyne	EPHX2	21	47
CC(=O)Nc1cccc(CC(=O)NC2CCC(C)(O)CC2)c1	ZINC000819357661	DD	On-Demand	Anodyne	MCHR1	16	43
CN1CCC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1=O	ZINC000819357668	FD	On-Demand	Mild	PAPA1_CARPA	37	45
CN1CCC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1=O	ZINC000819357670	FD	On-Demand	Mild	PAPA1_CARPA	37	45
CNC(=O)C[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819357738	CC	On-Demand	Bother	ADRB1	21	40
CNC(=O)C[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819357738	CC	On-Demand	Bother	ADRB3	45	40
CNC(=O)C[C@@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819357738	CC	On-Demand	Bother	CACNA1D	50	34
CNC(=O)C[C@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819357739	CC	On-Demand	Bother	ADRB1	21	40
CNC(=O)C[C@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819357739	CC	On-Demand	Bother	ADRB3	45	40
CNC(=O)C[C@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819357739	CC	On-Demand	Bother	CACNA1D	50	34
CNC(=O)C[C@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819357740	CC	On-Demand	Bother	ADRB1	21	40
CNC(=O)C[C@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819357740	CC	On-Demand	Bother	ADRB3	45	40
CNC(=O)C[C@H](C)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819357740	CC	On-Demand	Bother	CACNA1D	50	34
CNC(=O)C[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819357741	CC	On-Demand	Bother	ADRB1	21	40
CNC(=O)C[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819357741	CC	On-Demand	Bother	ADRB3	45	40
CNC(=O)C[C@@H](C)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819357741	CC	On-Demand	Bother	CACNA1D	50	34
C#Cc1cccc(CNC[C@H](O)COc2c(OC)cccc2OC)c1	ZINC000819357762	EE	On-Demand	Mild	ADRB2	33	40
C#Cc1cccc(CNC[C@@H](O)COc2c(OC)cccc2OC)c1	ZINC000819357763	EE	On-Demand	Mild	ADRB2	33	40
C#Cc1cccc(CNC[C@H](O)COc2ccc(C)cc2C)c1	ZINC000819357781	DF	On-Demand	Mild	ADRB2	24	43
C#Cc1cccc(CNC[C@@H](O)COc2ccc(C)cc2C)c1	ZINC000819357782	DF	On-Demand	Mild	ADRB2	24	43
C#Cc1cccc(CNC[C@H](O)COc2ccccc2C(C)C)c1	ZINC000819357816	DG	On-Demand	Mild	ADRB2	39	46
C#Cc1cccc(CNC[C@H](O)COc2ccccc2C(C)C)c1	ZINC000819357816	DG	On-Demand	Mild	ADRB1	56	34
C#Cc1cccc(CNC[C@H](O)COc2ccccc2C(C)C)c1	ZINC000819357816	DG	On-Demand	Mild	ADRB3	18	40
C#Cc1cccc(CNC[C@H](O)COc2ccccc2C(C)C)c1	ZINC000819357816	DG	On-Demand	Mild	ABCB1	24	45
C#Cc1cccc(CNC[C@@H](O)COc2ccccc2C(C)C)c1	ZINC000819357818	DG	On-Demand	Mild	ADRB2	39	46
C#Cc1cccc(CNC[C@@H](O)COc2ccccc2C(C)C)c1	ZINC000819357818	DG	On-Demand	Mild	ADRB1	56	34
C#Cc1cccc(CNC[C@@H](O)COc2ccccc2C(C)C)c1	ZINC000819357818	DG	On-Demand	Mild	ADRB3	18	40
C#Cc1cccc(CNC[C@@H](O)COc2ccccc2C(C)C)c1	ZINC000819357818	DG	On-Demand	Mild	ABCB1	24	45
C#Cc1cccc(CNC[C@H](O)COc2ccc(SC)cc2)c1	ZINC000819357823	EF	On-Demand	Mild	ADRB2	38	41
C#Cc1cccc(CNC[C@H](O)COc2ccc(SC)cc2)c1	ZINC000819357823	EF	On-Demand	Mild	ADRB1	55	39
C#Cc1cccc(CNC[C@@H](O)COc2ccc(SC)cc2)c1	ZINC000819357825	EF	On-Demand	Mild	ADRB2	38	41
C#Cc1cccc(CNC[C@@H](O)COc2ccc(SC)cc2)c1	ZINC000819357825	EF	On-Demand	Mild	ADRB1	55	39
O=C(O)C[C@@H]1CCCN(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000819357834	FF	On-Demand	Bother	EPHX2	15	52
O=C(O)C[C@H]1CCCN(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000819357836	FF	On-Demand	Bother	EPHX2	15	52
O=C(O)C[C@H]1CCCN(C(=O)NCCc2ccc(N3CCCCC3)cc2)C1	ZINC000819357845	FG	On-Demand	Anodyne	DPP7	40	39
O=C(O)C[C@H]1CCCN(C(=O)NCCc2ccc(N3CCCCC3)cc2)C1	ZINC000819357845	FG	On-Demand	Anodyne	GPBAR1	24	41
O=C(O)C[C@@H]1CCCN(C(=O)NCCc2ccc(N3CCCCC3)cc2)C1	ZINC000819357847	FG	On-Demand	Anodyne	DPP7	40	39
O=C(O)C[C@@H]1CCCN(C(=O)NCCc2ccc(N3CCCCC3)cc2)C1	ZINC000819357847	FG	On-Demand	Anodyne	GPBAR1	24	41
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819357855	FF	On-Demand	Anodyne	HRH3	26	47
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819357855	FF	On-Demand	Anodyne	SIGMAR1	28	48
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819357855	FF	On-Demand	Anodyne	CCR3	32	41
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819357855	FF	On-Demand	Anodyne	DPP7	54	37
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819357857	FF	On-Demand	Anodyne	HRH3	26	47
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819357857	FF	On-Demand	Anodyne	SIGMAR1	28	48
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819357857	FF	On-Demand	Anodyne	CCR3	32	41
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCC3)cc2)C1	ZINC000819357857	FF	On-Demand	Anodyne	DPP7	54	37
O=C(O)C[C@@H]1CCCN(C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000819357859	FE	On-Demand	Anodyne	HCN1	51	32
O=C(O)C[C@@H]1CCCN(C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000819357859	FE	On-Demand	Anodyne	HCN4	49	32
O=C(O)C[C@H]1CCCN(C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000819357861	FE	On-Demand	Anodyne	HCN1	51	32
O=C(O)C[C@H]1CCCN(C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000819357861	FE	On-Demand	Anodyne	HCN4	49	32
O=C(O)C[C@H]1CCCN(C(=O)NCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000819357863	FE	On-Demand	Anodyne	EPHX2	23	47
O=C(O)C[C@@H]1CCCN(C(=O)NCC(=O)Nc2ccc(Cl)cc2)C1	ZINC000819357865	FE	On-Demand	Anodyne	EPHX2	23	47
O=C(O)C[C@H]1CCCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819357875	FF	On-Demand	Anodyne	DRD2	16	44
O=C(O)C[C@H]1CCCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819357875	FF	On-Demand	Anodyne	HRH2	29	42
O=C(O)C[C@H]1CCCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819357875	FF	On-Demand	Anodyne	SIGMAR1	32	45
O=C(O)C[C@H]1CCCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819357875	FF	On-Demand	Anodyne	CCR3	46	40
O=C(O)C[C@H]1CCCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819357875	FF	On-Demand	Anodyne	PREP	27	40
O=C(O)C[C@@H]1CCCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819357877	FF	On-Demand	Anodyne	DRD2	16	44
O=C(O)C[C@@H]1CCCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819357877	FF	On-Demand	Anodyne	HRH2	29	42
O=C(O)C[C@@H]1CCCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819357877	FF	On-Demand	Anodyne	SIGMAR1	32	45
O=C(O)C[C@@H]1CCCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819357877	FF	On-Demand	Anodyne	CCR3	46	40
O=C(O)C[C@@H]1CCCN(C(=O)NCc2cccc(CN3CCCC3)c2)C1	ZINC000819357877	FF	On-Demand	Anodyne	PREP	27	40
O=C(O)C[C@H]1CCCN(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)C1	ZINC000819357894	FD	On-Demand	Anodyne	CACNA1I	41	31
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)C1	ZINC000819357895	FD	On-Demand	Anodyne	CACNA1I	41	31
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)C1	ZINC000819357896	FD	On-Demand	Anodyne	CACNA1I	41	31
O=C(O)C[C@H]1CCCN(C(=O)NC[C@H]2CCN(CC(F)(F)F)C2)C1	ZINC000819357897	FD	On-Demand	Anodyne	CACNA1I	41	31
O=C(O)C[C@@H]1CCCN(C(=O)NCC2(N3CCOCC3)CCCCC2)C1	ZINC000819357937	FD	On-Demand	Anodyne	HCN1	55	34
O=C(O)C[C@@H]1CCCN(C(=O)NCC2(N3CCOCC3)CCCCC2)C1	ZINC000819357937	FD	On-Demand	Anodyne	HCN4	51	33
O=C(O)C[C@H]1CCCN(C(=O)NCC2(N3CCOCC3)CCCCC2)C1	ZINC000819357939	FD	On-Demand	Anodyne	HCN1	55	34
O=C(O)C[C@H]1CCCN(C(=O)NCC2(N3CCOCC3)CCCCC2)C1	ZINC000819357939	FD	On-Demand	Anodyne	HCN4	51	33
O=C(O)C[C@@H]1CCCN(C(=O)NCc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819357944	GD	On-Demand	Anodyne	PREP	25	43
O=C(O)C[C@H]1CCCN(C(=O)NCc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819357945	GD	On-Demand	Anodyne	PREP	25	43
O=C(O)C[C@@H]1CCCN(C(=O)NCC#Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819357946	FF	On-Demand	Mild	CCR2	15	41
O=C(O)C[C@H]1CCCN(C(=O)NCC#Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819357947	FF	On-Demand	Mild	CCR2	15	41
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)C1	ZINC000819357950	GE	On-Demand	Anodyne	SIGMAR1	28	45
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)C1	ZINC000819357950	GE	On-Demand	Anodyne	CCR3	22	41
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)C1	ZINC000819357951	GE	On-Demand	Anodyne	SIGMAR1	28	45
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)C1	ZINC000819357951	GE	On-Demand	Anodyne	CCR3	22	41
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(Br)cc2F)C1	ZINC000819357952	FF	On-Demand	Anodyne	AKR1B1	20	40
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(Br)cc2F)C1	ZINC000819357953	FF	On-Demand	Anodyne	AKR1B1	20	40
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819357956	FE	On-Demand	Anodyne	HTR1A	28	51
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819357956	FE	On-Demand	Anodyne	DRD2	16	42
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819357956	FE	On-Demand	Anodyne	HTR2A	18	45
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819357956	FE	On-Demand	Anodyne	SLC6A1	44	33
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819357956	FE	On-Demand	Anodyne	DRD3	22	49
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819357956	FE	On-Demand	Anodyne	HTR7	47	48
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819357957	FE	On-Demand	Anodyne	HTR1A	28	51
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819357957	FE	On-Demand	Anodyne	DRD2	16	42
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819357957	FE	On-Demand	Anodyne	HTR2A	18	45
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819357957	FE	On-Demand	Anodyne	SLC6A1	44	33
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819357957	FE	On-Demand	Anodyne	DRD3	22	49
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCc3ccccc3C2)C1	ZINC000819357957	FE	On-Demand	Anodyne	HTR7	47	48
COc1cccc(C(NC(=O)C(F)=C2CCC2)c2cccc(OC)c2)c1	ZINC000819358060	FI	On-Demand	Anodyne	MTNR1A	28	40
COc1cccc(C(NC(=O)C(F)=C2CCC2)c2cccc(OC)c2)c1	ZINC000819358060	FI	On-Demand	Anodyne	MTNR1B	31	40
CCOc1ccc(OC[C@@H](O)CNCc2coc(CC)n2)cc1	ZINC000819358078	DE	On-Demand	Anodyne	ADRB2	32	44
CCOc1ccc(OC[C@@H](O)CNCc2coc(CC)n2)cc1	ZINC000819358078	DE	On-Demand	Anodyne	ADRB1	41	44
CCOc1ccc(OC[C@@H](O)CNCc2coc(CC)n2)cc1	ZINC000819358078	DE	On-Demand	Anodyne	ADRB3	25	40
CCOc1ccc(OC[C@H](O)CNCc2coc(CC)n2)cc1	ZINC000819358079	DE	On-Demand	Anodyne	ADRB2	32	44
CCOc1ccc(OC[C@H](O)CNCc2coc(CC)n2)cc1	ZINC000819358079	DE	On-Demand	Anodyne	ADRB1	41	44
CCOc1ccc(OC[C@H](O)CNCc2coc(CC)n2)cc1	ZINC000819358079	DE	On-Demand	Anodyne	ADRB3	25	40
O=C(O)C[C@@H]1CCCN(C(=O)NCc2cccnc2N2CCOCC2)C1	ZINC000819358111	FD	On-Demand	Anodyne	SCN10A	20	45
O=C(O)C[C@H]1CCCN(C(=O)NCc2cccnc2N2CCOCC2)C1	ZINC000819358112	FD	On-Demand	Anodyne	SCN10A	20	45
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(O)cc2)C1	ZINC000819358117	CD	On-Demand	Anodyne	LNPEP	40	34
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(O)cc2)C1	ZINC000819358117	CD	On-Demand	Anodyne	DPP7	45	36
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(O)cc2)C1	ZINC000819358118	CD	On-Demand	Anodyne	LNPEP	40	34
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(O)cc2)C1	ZINC000819358118	CD	On-Demand	Anodyne	DPP7	45	36
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358121	GD	On-Demand	Anodyne	HTR1A	40	53
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358121	GD	On-Demand	Anodyne	DRD2	43	47
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358121	GD	On-Demand	Anodyne	DRD4	58	41
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358121	GD	On-Demand	Anodyne	ACHE	51	45
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358121	GD	On-Demand	Anodyne	HTR2A	25	40
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358121	GD	On-Demand	Anodyne	SLC6A1	55	33
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358121	GD	On-Demand	Anodyne	DRD3	40	41
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358121	GD	On-Demand	Anodyne	SLC6A3	17	40
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358121	GD	On-Demand	Anodyne	HTR7	15	40
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358121	GD	On-Demand	Anodyne	SIGMAR1	74	50
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358121	GD	On-Demand	Anodyne	BCHE	19	41
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358121	GD	On-Demand	Anodyne	CCR3	43	41
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358121	GD	On-Demand	Anodyne	CACNA1G	31	40
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358122	GD	On-Demand	Anodyne	HTR1A	40	53
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358122	GD	On-Demand	Anodyne	DRD2	43	47
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358122	GD	On-Demand	Anodyne	DRD4	58	41
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358122	GD	On-Demand	Anodyne	ACHE	51	45
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358122	GD	On-Demand	Anodyne	HTR2A	25	40
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358122	GD	On-Demand	Anodyne	SLC6A1	55	33
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358122	GD	On-Demand	Anodyne	DRD3	40	41
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358122	GD	On-Demand	Anodyne	SLC6A3	17	40
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358122	GD	On-Demand	Anodyne	HTR7	15	40
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358122	GD	On-Demand	Anodyne	SIGMAR1	74	50
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358122	GD	On-Demand	Anodyne	BCHE	19	41
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358122	GD	On-Demand	Anodyne	CCR3	43	41
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(Cc3ccccc3)CC2)C1	ZINC000819358122	GD	On-Demand	Anodyne	CACNA1G	31	40
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)C1	ZINC000819358123	GE	On-Demand	Anodyne	SIGMAR1	22	40
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccccc2CN2CCC(O)CC2)C1	ZINC000819358124	GE	On-Demand	Anodyne	SIGMAR1	22	40
O=C(O)C[C@H]1CCCN(C(=O)NCCOc2cccnc2)C1	ZINC000819358129	DD	On-Demand	Anodyne	CHRNA7	24	40
O=C(O)C[C@@H]1CCCN(C(=O)NCCOc2cccnc2)C1	ZINC000819358130	DD	On-Demand	Anodyne	CHRNA7	24	40
O=C(O)C[C@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358131	FE	On-Demand	Anodyne	DRD2	15	45
O=C(O)C[C@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358131	FE	On-Demand	Anodyne	DRD4	17	41
O=C(O)C[C@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358131	FE	On-Demand	Anodyne	ACHE	24	42
O=C(O)C[C@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358131	FE	On-Demand	Anodyne	SLC6A1	55	35
O=C(O)C[C@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358131	FE	On-Demand	Anodyne	HTR4	45	46
O=C(O)C[C@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358131	FE	On-Demand	Anodyne	SIGMAR1	41	45
O=C(O)C[C@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358131	FE	On-Demand	Anodyne	CCR3	44	47
O=C(O)C[C@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358131	FE	On-Demand	Anodyne	PREP	45	36
O=C(O)C[C@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358131	FE	On-Demand	Anodyne	CACNA1I	52	33
O=C(O)C[C@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358131	FE	On-Demand	Anodyne	BIRC2	42	41
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358132	FE	On-Demand	Anodyne	DRD2	15	45
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358132	FE	On-Demand	Anodyne	DRD4	17	41
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358132	FE	On-Demand	Anodyne	ACHE	24	42
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358132	FE	On-Demand	Anodyne	SLC6A1	55	35
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358132	FE	On-Demand	Anodyne	HTR4	45	46
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358132	FE	On-Demand	Anodyne	SIGMAR1	41	45
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358132	FE	On-Demand	Anodyne	CCR3	44	47
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358132	FE	On-Demand	Anodyne	PREP	45	36
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358132	FE	On-Demand	Anodyne	CACNA1I	52	33
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358132	FE	On-Demand	Anodyne	BIRC2	42	41
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358133	FE	On-Demand	Anodyne	DRD2	15	45
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358133	FE	On-Demand	Anodyne	DRD4	17	41
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358133	FE	On-Demand	Anodyne	ACHE	24	42
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358133	FE	On-Demand	Anodyne	SLC6A1	55	35
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358133	FE	On-Demand	Anodyne	HTR4	45	46
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358133	FE	On-Demand	Anodyne	SIGMAR1	41	45
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358133	FE	On-Demand	Anodyne	CCR3	44	47
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358133	FE	On-Demand	Anodyne	PREP	45	36
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358133	FE	On-Demand	Anodyne	CACNA1I	52	33
O=C(O)C[C@@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358133	FE	On-Demand	Anodyne	BIRC2	42	41
O=C(O)C[C@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358134	FE	On-Demand	Anodyne	DRD2	15	45
O=C(O)C[C@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358134	FE	On-Demand	Anodyne	DRD4	17	41
O=C(O)C[C@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358134	FE	On-Demand	Anodyne	ACHE	24	42
O=C(O)C[C@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358134	FE	On-Demand	Anodyne	SLC6A1	55	35
O=C(O)C[C@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358134	FE	On-Demand	Anodyne	HTR4	45	46
O=C(O)C[C@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358134	FE	On-Demand	Anodyne	SIGMAR1	41	45
O=C(O)C[C@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358134	FE	On-Demand	Anodyne	CCR3	44	47
O=C(O)C[C@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358134	FE	On-Demand	Anodyne	PREP	45	36
O=C(O)C[C@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358134	FE	On-Demand	Anodyne	CACNA1I	52	33
O=C(O)C[C@H]1CCCN(C(=O)NC[C@H]2CCN(CCc3ccccc3)C2)C1	ZINC000819358134	FE	On-Demand	Anodyne	BIRC2	42	41
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819358141	GD	On-Demand	Anodyne	PROC	40	33
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819358141	GD	On-Demand	Anodyne	L3MBTL3	52	37
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819358142	GD	On-Demand	Anodyne	PROC	40	33
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819358142	GD	On-Demand	Anodyne	L3MBTL3	52	37
O=C(O)C[C@@H]1CCCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000819358143	GD	On-Demand	Anodyne	F2	32	43
O=C(O)C[C@@H]1CCCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000819358143	GD	On-Demand	Anodyne	PLG	24	42
O=C(O)C[C@@H]1CCCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000819358143	GD	On-Demand	Anodyne	PRSS1	24	42
O=C(O)C[C@@H]1CCCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000819358143	GD	On-Demand	Anodyne	TMPRSS11D	94	37
O=C(O)C[C@H]1CCCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000819358144	GD	On-Demand	Anodyne	F2	32	43
O=C(O)C[C@H]1CCCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000819358144	GD	On-Demand	Anodyne	PLG	24	42
O=C(O)C[C@H]1CCCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000819358144	GD	On-Demand	Anodyne	PRSS1	24	42
O=C(O)C[C@H]1CCCN(C(=O)NCCNS(=O)(=O)Cc2ccccc2)C1	ZINC000819358144	GD	On-Demand	Anodyne	TMPRSS11D	94	37
O=C(O)C[C@H]1CCCN(C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000819358147	ED	On-Demand	Anodyne	NOS2	101	39
O=C(O)C[C@@H]1CCCN(C(=O)NCc2cccnc2-n2ccnc2)C1	ZINC000819358148	ED	On-Demand	Anodyne	NOS2	101	39
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819358157	FG	On-Demand	Anodyne	HRH3	30	47
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819358157	FG	On-Demand	Anodyne	SIGMAR1	27	47
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819358157	FG	On-Demand	Anodyne	CCR3	30	43
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819358157	FG	On-Demand	Anodyne	DPP7	69	38
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819358158	FG	On-Demand	Anodyne	HRH3	30	47
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819358158	FG	On-Demand	Anodyne	SIGMAR1	27	47
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819358158	FG	On-Demand	Anodyne	CCR3	30	43
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(CN3CCCCC3)cc2)C1	ZINC000819358158	FG	On-Demand	Anodyne	DPP7	69	38
O=C(O)C[C@H]1CCCN(C(=O)N[C@H]2CCc3ccccc32)C1	ZINC000819358159	DF	On-Demand	Anodyne	HTR7	16	44
O=C(O)C[C@H]1CCCN(C(=O)N[C@H]2CCc3ccccc32)C1	ZINC000819358159	DF	On-Demand	Anodyne	PREP	47	42
O=C(O)C[C@H]1CCCN(C(=O)N[C@H]2CCc3ccccc32)C1	ZINC000819358159	DF	On-Demand	Anodyne	XIAP	23	41
O=C(O)C[C@@H]1CCCN(C(=O)N[C@H]2CCc3ccccc32)C1	ZINC000819358160	DF	On-Demand	Anodyne	HTR7	16	44
O=C(O)C[C@@H]1CCCN(C(=O)N[C@H]2CCc3ccccc32)C1	ZINC000819358160	DF	On-Demand	Anodyne	PREP	47	42
O=C(O)C[C@@H]1CCCN(C(=O)N[C@H]2CCc3ccccc32)C1	ZINC000819358160	DF	On-Demand	Anodyne	XIAP	23	41
O=C(O)C[C@H]1CCCN(C(=O)NCCCOc2ccccc2F)C1	ZINC000819358161	EE	On-Demand	Anodyne	HTR1A	15	42
O=C(O)C[C@H]1CCCN(C(=O)NCCCOc2ccccc2F)C1	ZINC000819358161	EE	On-Demand	Anodyne	SLC6A1	42	33
O=C(O)C[C@@H]1CCCN(C(=O)NCCCOc2ccccc2F)C1	ZINC000819358162	EE	On-Demand	Anodyne	HTR1A	15	42
O=C(O)C[C@@H]1CCCN(C(=O)NCCCOc2ccccc2F)C1	ZINC000819358162	EE	On-Demand	Anodyne	SLC6A1	42	33
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819358163	GD	On-Demand	Anodyne	HTR1A	40	53
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819358163	GD	On-Demand	Anodyne	DRD2	27	53
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819358163	GD	On-Demand	Anodyne	DRD4	24	51
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819358163	GD	On-Demand	Anodyne	HTR2A	30	45
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819358163	GD	On-Demand	Anodyne	SLC6A1	47	36
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819358163	GD	On-Demand	Anodyne	DRD3	28	45
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819358163	GD	On-Demand	Anodyne	HTR7	34	41
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819358163	GD	On-Demand	Anodyne	CCR3	99	39
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819358163	GD	On-Demand	Anodyne	PLD2	55	38
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819358164	GD	On-Demand	Anodyne	HTR1A	40	53
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819358164	GD	On-Demand	Anodyne	DRD2	27	53
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819358164	GD	On-Demand	Anodyne	DRD4	24	51
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819358164	GD	On-Demand	Anodyne	HTR2A	30	45
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819358164	GD	On-Demand	Anodyne	SLC6A1	47	36
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819358164	GD	On-Demand	Anodyne	DRD3	28	45
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819358164	GD	On-Demand	Anodyne	HTR7	34	41
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819358164	GD	On-Demand	Anodyne	CCR3	99	39
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccc(F)cc3)CC2)C1	ZINC000819358164	GD	On-Demand	Anodyne	PLD2	55	38
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819358165	GC	On-Demand	Anodyne	HTR1A	55	55
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819358165	GC	On-Demand	Anodyne	DRD2	42	53
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819358165	GC	On-Demand	Anodyne	DRD4	20	48
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819358165	GC	On-Demand	Anodyne	ADRA1D	24	46
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819358165	GC	On-Demand	Anodyne	HTR2A	36	46
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819358165	GC	On-Demand	Anodyne	HTR2C	25	46
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819358165	GC	On-Demand	Anodyne	ADRA1A	32	40
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819358165	GC	On-Demand	Anodyne	ADRA1B	15	40
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819358165	GC	On-Demand	Anodyne	DRD3	47	46
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819358166	GC	On-Demand	Anodyne	HTR1A	55	55
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819358166	GC	On-Demand	Anodyne	DRD2	42	53
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819358166	GC	On-Demand	Anodyne	DRD4	20	48
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819358166	GC	On-Demand	Anodyne	ADRA1D	24	46
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819358166	GC	On-Demand	Anodyne	HTR2A	36	46
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819358166	GC	On-Demand	Anodyne	HTR2C	25	46
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819358166	GC	On-Demand	Anodyne	ADRA1A	32	40
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819358166	GC	On-Demand	Anodyne	ADRA1B	15	40
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ncccn3)CC2)C1	ZINC000819358166	GC	On-Demand	Anodyne	DRD3	47	46
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccccc2CN2CCCC2)C1	ZINC000819358171	FF	On-Demand	Anodyne	SLC6A1	81	34
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccccc2CN2CCCC2)C1	ZINC000819358171	FF	On-Demand	Anodyne	SIGMAR1	21	41
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccccc2CN2CCCC2)C1	ZINC000819358171	FF	On-Demand	Anodyne	EPHX2	15	47
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccccc2CN2CCCC2)C1	ZINC000819358172	FF	On-Demand	Anodyne	SLC6A1	81	34
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccccc2CN2CCCC2)C1	ZINC000819358172	FF	On-Demand	Anodyne	SIGMAR1	21	41
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccccc2CN2CCCC2)C1	ZINC000819358172	FF	On-Demand	Anodyne	EPHX2	15	47
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000819358173	ED	On-Demand	Anodyne	NOS2	108	41
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000819358173	ED	On-Demand	Anodyne	NAMPT	25	48
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000819358174	ED	On-Demand	Anodyne	NOS2	108	41
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(-n3ccnc3)nc2)C1	ZINC000819358174	ED	On-Demand	Anodyne	NAMPT	25	48
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)nc2)C1	ZINC000819358177	FD	On-Demand	Anodyne	NAMPT	29	40
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(N3CCOCC3)nc2)C1	ZINC000819358178	FD	On-Demand	Anodyne	NAMPT	29	40
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCCC2=O)C1	ZINC000819358195	DC	On-Demand	Anodyne	TYRO3	19	40
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCCC2=O)C1	ZINC000819358196	DC	On-Demand	Anodyne	TYRO3	19	40
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000819358201	EE	On-Demand	Anodyne	NOS2	105	41
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000819358201	EE	On-Demand	Anodyne	NAMPT	28	41
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000819358202	EE	On-Demand	Anodyne	NOS2	105	41
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000819358202	EE	On-Demand	Anodyne	NAMPT	28	41
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819358203	ED	On-Demand	Anodyne	HTR1A	15	48
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819358203	ED	On-Demand	Anodyne	SLC6A1	58	34
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819358203	ED	On-Demand	Anodyne	HTR7	25	44
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819358203	ED	On-Demand	Anodyne	PREP	41	40
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819358204	ED	On-Demand	Anodyne	HTR1A	15	48
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819358204	ED	On-Demand	Anodyne	SLC6A1	58	34
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819358204	ED	On-Demand	Anodyne	HTR7	25	44
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCc3ccccc3C2)C1	ZINC000819358204	ED	On-Demand	Anodyne	PREP	41	40
O=C(O)C[C@H]1CCCN(C(=O)NCCCNC(=O)C2CCC2)C1	ZINC000819358207	ED	On-Demand	Anodyne	TBK1	61	34
O=C(O)C[C@@H]1CCCN(C(=O)NCCCNC(=O)C2CCC2)C1	ZINC000819358208	ED	On-Demand	Anodyne	TBK1	61	34
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358209	FD	On-Demand	Anodyne	HTR1A	80	52
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358209	FD	On-Demand	Anodyne	DRD2	51	50
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358209	FD	On-Demand	Anodyne	DRD4	46	37
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358209	FD	On-Demand	Anodyne	HTR2A	49	52
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358209	FD	On-Demand	Anodyne	HTR2C	20	43
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358209	FD	On-Demand	Anodyne	SLC6A1	87	35
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358209	FD	On-Demand	Anodyne	ADRA1A	23	42
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358209	FD	On-Demand	Anodyne	ADRA1B	15	42
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358209	FD	On-Demand	Anodyne	DRD3	63	52
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358209	FD	On-Demand	Anodyne	HTR4	21	41
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358209	FD	On-Demand	Anodyne	DRD5	15	41
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358209	FD	On-Demand	Anodyne	HTR7	72	42
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358209	FD	On-Demand	Anodyne	SIGMAR1	16	42
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358209	FD	On-Demand	Anodyne	PLD2	47	36
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358209	FD	On-Demand	Anodyne	ADAM10	34	41
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358210	FD	On-Demand	Anodyne	HTR1A	80	52
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358210	FD	On-Demand	Anodyne	DRD2	51	50
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358210	FD	On-Demand	Anodyne	DRD4	46	37
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358210	FD	On-Demand	Anodyne	HTR2A	49	52
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358210	FD	On-Demand	Anodyne	HTR2C	20	43
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358210	FD	On-Demand	Anodyne	SLC6A1	87	35
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358210	FD	On-Demand	Anodyne	ADRA1A	23	42
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358210	FD	On-Demand	Anodyne	ADRA1B	15	42
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358210	FD	On-Demand	Anodyne	DRD3	63	52
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358210	FD	On-Demand	Anodyne	HTR4	21	41
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358210	FD	On-Demand	Anodyne	DRD5	15	41
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358210	FD	On-Demand	Anodyne	HTR7	72	42
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358210	FD	On-Demand	Anodyne	SIGMAR1	16	42
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358210	FD	On-Demand	Anodyne	PLD2	47	36
O=C(O)C[C@H]1CCCN(C(=O)NCCN2CCN(c3ccccc3)CC2)C1	ZINC000819358210	FD	On-Demand	Anodyne	ADAM10	34	41
O=C(O)C[C@H]1CCCN(C(=O)NCCN2C(=O)Cc3ccccc32)C1	ZINC000819358213	ED	On-Demand	Anodyne	HTR7	22	49
O=C(O)C[C@@H]1CCCN(C(=O)NCCN2C(=O)Cc3ccccc32)C1	ZINC000819358214	ED	On-Demand	Anodyne	HTR7	22	49
O=C(O)C[C@@H]1CCCN(C(=O)NCCS(=O)(=O)Cc2ccccc2)C1	ZINC000819358215	FD	On-Demand	Anodyne	F2	25	40
O=C(O)C[C@@H]1CCCN(C(=O)NCCS(=O)(=O)Cc2ccccc2)C1	ZINC000819358215	FD	On-Demand	Anodyne	TMPRSS11D	61	34
O=C(O)C[C@H]1CCCN(C(=O)NCCS(=O)(=O)Cc2ccccc2)C1	ZINC000819358216	FD	On-Demand	Anodyne	F2	25	40
O=C(O)C[C@H]1CCCN(C(=O)NCCS(=O)(=O)Cc2ccccc2)C1	ZINC000819358216	FD	On-Demand	Anodyne	TMPRSS11D	61	34
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccccc2CN2CCCCC2)C1	ZINC000819358217	FG	On-Demand	Anodyne	SLC6A1	75	34
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccccc2CN2CCCCC2)C1	ZINC000819358217	FG	On-Demand	Anodyne	SIGMAR1	22	40
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccccc2CN2CCCCC2)C1	ZINC000819358217	FG	On-Demand	Anodyne	DPP7	40	37
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccccc2CN2CCCCC2)C1	ZINC000819358218	FG	On-Demand	Anodyne	SLC6A1	75	34
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccccc2CN2CCCCC2)C1	ZINC000819358218	FG	On-Demand	Anodyne	SIGMAR1	22	40
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccccc2CN2CCCCC2)C1	ZINC000819358218	FG	On-Demand	Anodyne	DPP7	40	37
O=C(O)C[C@H]1CCCN(C(=O)NCCNC(=O)c2cccnc2)C1	ZINC000819358219	EC	On-Demand	Anodyne	PREP	20	48
O=C(O)C[C@@H]1CCCN(C(=O)NCCNC(=O)c2cccnc2)C1	ZINC000819358220	EC	On-Demand	Anodyne	PREP	20	48
O=C(O)C[C@@H]1CCCN(C(=O)NCCCS(=O)(=O)Cc2ccccc2)C1	ZINC000819358221	GD	On-Demand	Anodyne	FKBP1A	16	41
O=C(O)C[C@@H]1CCCN(C(=O)NCCCS(=O)(=O)Cc2ccccc2)C1	ZINC000819358221	GD	On-Demand	Anodyne	CCR3	28	41
O=C(O)C[C@@H]1CCCN(C(=O)NCCCS(=O)(=O)Cc2ccccc2)C1	ZINC000819358221	GD	On-Demand	Anodyne	TMPRSS11D	82	36
O=C(O)C[C@H]1CCCN(C(=O)NCCCS(=O)(=O)Cc2ccccc2)C1	ZINC000819358222	GD	On-Demand	Anodyne	FKBP1A	16	41
O=C(O)C[C@H]1CCCN(C(=O)NCCCS(=O)(=O)Cc2ccccc2)C1	ZINC000819358222	GD	On-Demand	Anodyne	CCR3	28	41
O=C(O)C[C@H]1CCCN(C(=O)NCCCS(=O)(=O)Cc2ccccc2)C1	ZINC000819358222	GD	On-Demand	Anodyne	TMPRSS11D	82	36
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358223	GD	On-Demand	Anodyne	HTR1A	58	46
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358223	GD	On-Demand	Anodyne	DRD2	38	44
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358223	GD	On-Demand	Anodyne	ADRA1D	20	41
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358223	GD	On-Demand	Anodyne	HTR2A	44	46
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358223	GD	On-Demand	Anodyne	HTR2C	28	40
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358223	GD	On-Demand	Anodyne	ADRA1A	25	41
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358223	GD	On-Demand	Anodyne	ADRA1B	15	41
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358223	GD	On-Demand	Anodyne	DRD3	50	46
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358223	GD	On-Demand	Anodyne	HTR7	44	37
O=C(O)C[C@@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358223	GD	On-Demand	Anodyne	CCR3	25	40
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358224	GD	On-Demand	Anodyne	HTR1A	58	46
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358224	GD	On-Demand	Anodyne	DRD2	38	44
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358224	GD	On-Demand	Anodyne	ADRA1D	20	41
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358224	GD	On-Demand	Anodyne	HTR2A	44	46
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358224	GD	On-Demand	Anodyne	HTR2C	28	40
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358224	GD	On-Demand	Anodyne	ADRA1A	25	41
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358224	GD	On-Demand	Anodyne	ADRA1B	15	41
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358224	GD	On-Demand	Anodyne	DRD3	50	46
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358224	GD	On-Demand	Anodyne	HTR7	44	37
O=C(O)C[C@H]1CCCN(C(=O)NCCCN2CCN(c3ccncc3)CC2)C1	ZINC000819358224	GD	On-Demand	Anodyne	CCR3	25	40
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1nc(Cc2ccccc2)no1	ZINC000819358229	EF	On-Demand	Anodyne	UL26	60	34
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1nc(Cc2ccccc2)no1	ZINC000819358229	EF	On-Demand	Anodyne	SCAF_EBVB9	54	34
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1nc(Cc2ccccc2)no1	ZINC000819358230	EF	On-Demand	Anodyne	UL26	60	34
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1nc(Cc2ccccc2)no1	ZINC000819358230	EF	On-Demand	Anodyne	SCAF_EBVB9	54	34
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1nc(Cc2ccccc2)no1	ZINC000819358231	EF	On-Demand	Anodyne	UL26	60	34
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1nc(Cc2ccccc2)no1	ZINC000819358231	EF	On-Demand	Anodyne	SCAF_EBVB9	54	34
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1nc(Cc2ccccc2)no1	ZINC000819358232	EF	On-Demand	Anodyne	UL26	60	34
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1nc(Cc2ccccc2)no1	ZINC000819358232	EF	On-Demand	Anodyne	SCAF_EBVB9	54	34
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819358245	GD	On-Demand	Mild	ADRB1	34	41
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819358245	GD	On-Demand	Mild	GPR119	21	46
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819358246	GD	On-Demand	Mild	ADRB1	34	41
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819358246	GD	On-Demand	Mild	GPR119	21	46
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819358247	GD	On-Demand	Mild	ADRB1	34	41
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819358247	GD	On-Demand	Mild	GPR119	21	46
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819358248	GD	On-Demand	Mild	ADRB1	34	41
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819358248	GD	On-Demand	Mild	GPR119	21	46
Cc1ccc(OC[C@H](O)CNC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000819358314	GD	On-Demand	Anodyne	ADRB2	23	43
Cc1ccc(OC[C@H](O)CNC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000819358314	GD	On-Demand	Anodyne	ADRB1	41	43
Cc1ccc(OC[C@H](O)CNC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000819358314	GD	On-Demand	Anodyne	ACOX1	50	31
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000819358315	GD	On-Demand	Anodyne	ADRB2	23	43
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000819358315	GD	On-Demand	Anodyne	ADRB1	41	43
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000819358315	GD	On-Demand	Anodyne	ACOX1	50	31
Cc1ccc(OC[C@H](O)CNC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000819358316	GD	On-Demand	Anodyne	ADRB2	23	43
Cc1ccc(OC[C@H](O)CNC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000819358316	GD	On-Demand	Anodyne	ADRB1	41	43
Cc1ccc(OC[C@H](O)CNC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000819358316	GD	On-Demand	Anodyne	ACOX1	50	31
Cc1ccc(OC[C@@H](O)CNC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000819358317	GD	On-Demand	Anodyne	ADRB2	23	43
Cc1ccc(OC[C@@H](O)CNC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000819358317	GD	On-Demand	Anodyne	ADRB1	41	43
Cc1ccc(OC[C@@H](O)CNC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000819358317	GD	On-Demand	Anodyne	ACOX1	50	31
CC(C)(C)OC(=O)N1CCO[C@@H](CNCCC(=O)Nc2cccc(F)c2)C1	ZINC000819358348	GE	On-Demand	Anodyne	GPR119	19	42
CC(C)(C)OC(=O)N1CCO[C@H](CNCCC(=O)Nc2cccc(F)c2)C1	ZINC000819358349	GE	On-Demand	Anodyne	GPR119	19	42
CCC(C)(C)OCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819358429	DG	On-Demand	Anodyne	ADRB2	21	40
CCC(C)(C)OCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819358429	DG	On-Demand	Anodyne	ADRB1	22	40
CCC(C)(C)OCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819358429	DG	On-Demand	Anodyne	ADRB3	23	40
CCC(C)(C)OCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819358430	DG	On-Demand	Anodyne	ADRB2	21	40
CCC(C)(C)OCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819358430	DG	On-Demand	Anodyne	ADRB1	22	40
CCC(C)(C)OCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819358430	DG	On-Demand	Anodyne	ADRB3	23	40
C[C@H]1CC[C@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)O1	ZINC000819358456	GF	On-Demand	Anodyne	CTSD	98	42
C[C@H]1CC[C@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)O1	ZINC000819358456	GF	On-Demand	Anodyne	PGC	65	37
C[C@H]1CC[C@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)O1	ZINC000819358456	GF	On-Demand	Anodyne	PAPA1_CARPA	31	42
C[C@H]1CC[C@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)O1	ZINC000819358456	GF	On-Demand	Anodyne	BACE2	52	38
C[C@H]1CC[C@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)O1	ZINC000819358456	GF	On-Demand	Anodyne	REN	94	48
C[C@H]1CC[C@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)O1	ZINC000819358456	GF	On-Demand	Anodyne	REN1	19	43
C[C@H]1CC[C@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)O1	ZINC000819358456	GF	On-Demand	Anodyne	BACE1	80	41
C[C@H]1CC[C@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)O1	ZINC000819358456	GF	On-Demand	Anodyne	FPR1	50	41
C[C@H]1CC[C@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)O1	ZINC000819358456	GF	On-Demand	Anodyne	PLM1_PLAFA	23	41
C[C@H]1CC[C@@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)O1	ZINC000819358457	GF	On-Demand	Anodyne	CTSD	98	42
C[C@H]1CC[C@@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)O1	ZINC000819358457	GF	On-Demand	Anodyne	PGC	65	37
C[C@H]1CC[C@@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)O1	ZINC000819358457	GF	On-Demand	Anodyne	PAPA1_CARPA	31	42
C[C@H]1CC[C@@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)O1	ZINC000819358457	GF	On-Demand	Anodyne	BACE2	52	38
C[C@H]1CC[C@@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)O1	ZINC000819358457	GF	On-Demand	Anodyne	REN	94	48
C[C@H]1CC[C@@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)O1	ZINC000819358457	GF	On-Demand	Anodyne	REN1	19	43
C[C@H]1CC[C@@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)O1	ZINC000819358457	GF	On-Demand	Anodyne	BACE1	80	41
C[C@H]1CC[C@@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)O1	ZINC000819358457	GF	On-Demand	Anodyne	FPR1	50	41
C[C@H]1CC[C@@H](CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)O1	ZINC000819358457	GF	On-Demand	Anodyne	PLM1_PLAFA	23	41
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)c2c(F)cccc2F)C1	ZINC000819358463	FE	On-Demand	Anodyne	GPR119	25	44
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819358464	FE	On-Demand	Anodyne	GPR119	25	44
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819358465	FE	On-Demand	Anodyne	GPR119	25	44
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)c2c(F)cccc2F)C1	ZINC000819358466	FE	On-Demand	Anodyne	GPR119	25	44
O=C1[C@@H](NC[C@H](O)c2ccccc2Cl)C[C@@H]2CCCCN12	ZINC000819358488	DE	On-Demand	Anodyne	OPRL1	46	40
O=C1[C@H](NC[C@H](O)c2ccccc2Cl)C[C@H]2CCCCN12	ZINC000819358489	DE	On-Demand	Anodyne	OPRL1	46	40
O=C1[C@H](NC[C@H](O)c2ccccc2Cl)C[C@@H]2CCCCN12	ZINC000819358490	DE	On-Demand	Anodyne	OPRL1	46	40
O=C1[C@@H](NC[C@H](O)c2ccccc2Cl)C[C@H]2CCCCN12	ZINC000819358491	DE	On-Demand	Anodyne	OPRL1	46	40
CCC(C)(C)OCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819358518	CE	On-Demand	Bother	ADRB3	43	38
CCC(C)(C)OCCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819358518	CE	On-Demand	Bother	CACNA1D	54	34
CCC(C)(C)OCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819358519	CE	On-Demand	Bother	ADRB3	43	38
CCC(C)(C)OCCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819358519	CE	On-Demand	Bother	CACNA1D	54	34
CCC(C)(C)OCCNC[C@H](O)c1ccc(C)cc1	ZINC000819358532	CF	On-Demand	Anodyne	ADRB2	19	41
CCC(C)(C)OCCNC[C@@H](O)c1ccc(C)cc1	ZINC000819358533	CF	On-Demand	Anodyne	ADRB2	19	41
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819358538	GD	On-Demand	Anodyne	ABCB1	37	43
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)COc2ccccc2F)C1	ZINC000819358538	GD	On-Demand	Anodyne	GPR119	18	43
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819358539	GD	On-Demand	Anodyne	ABCB1	37	43
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819358539	GD	On-Demand	Anodyne	GPR119	18	43
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819358541	GD	On-Demand	Anodyne	ABCB1	37	43
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)COc2ccccc2F)C1	ZINC000819358541	GD	On-Demand	Anodyne	GPR119	18	43
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819358575	ED	On-Demand	Anodyne	ADRB3	79	40
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819358575	ED	On-Demand	Anodyne	GPR119	22	42
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819358576	ED	On-Demand	Anodyne	ADRB3	79	40
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)c2cccnc2)C1	ZINC000819358576	ED	On-Demand	Anodyne	GPR119	22	42
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819358577	ED	On-Demand	Anodyne	ADRB3	79	40
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819358577	ED	On-Demand	Anodyne	GPR119	22	42
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819358578	ED	On-Demand	Anodyne	ADRB3	79	40
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)c2cccnc2)C1	ZINC000819358578	ED	On-Demand	Anodyne	GPR119	22	42
CC(C)(C)OC(=O)N1CCO[C@@H](CNCCC(=O)Nc2ccccc2F)C1	ZINC000819358606	GE	On-Demand	Anodyne	GPR119	22	41
CC(C)(C)OC(=O)N1CCO[C@H](CNCCC(=O)Nc2ccccc2F)C1	ZINC000819358607	GE	On-Demand	Anodyne	GPR119	22	41
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(NC(=O)C2CCCCC2)c1	ZINC000819358610	EH	On-Demand	Anodyne	KCNK3	29	55
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(NC(=O)C2CCCCC2)c1	ZINC000819358611	EH	On-Demand	Anodyne	KCNK3	29	55
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(NC(=O)C2CCCCC2)c1	ZINC000819358612	EH	On-Demand	Anodyne	KCNK3	29	55
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(NC(=O)C2CCCCC2)c1	ZINC000819358613	EH	On-Demand	Anodyne	KCNK3	29	55
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819358639	GD	On-Demand	Anodyne	ADRB2	21	42
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819358639	GD	On-Demand	Anodyne	ADRB1	41	42
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819358639	GD	On-Demand	Anodyne	ADRB3	23	40
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819358640	GD	On-Demand	Anodyne	ADRB2	21	42
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819358640	GD	On-Demand	Anodyne	ADRB1	41	42
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819358640	GD	On-Demand	Anodyne	ADRB3	23	40
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819358641	GD	On-Demand	Anodyne	ADRB2	21	42
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819358641	GD	On-Demand	Anodyne	ADRB1	41	42
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819358641	GD	On-Demand	Anodyne	ADRB3	23	40
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819358642	GD	On-Demand	Anodyne	ADRB2	21	42
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819358642	GD	On-Demand	Anodyne	ADRB1	41	42
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819358642	GD	On-Demand	Anodyne	ADRB3	23	40
CCC(C)(C)OCCNC[C@@H](O)c1cccnc1	ZINC000819358643	CD	On-Demand	Anodyne	ADRB2	29	53
CCC(C)(C)OCCNC[C@@H](O)c1cccnc1	ZINC000819358643	CD	On-Demand	Anodyne	ADRB1	37	53
CCC(C)(C)OCCNC[C@@H](O)c1cccnc1	ZINC000819358643	CD	On-Demand	Anodyne	ADRB3	110	53
CCC(C)(C)OCCNC[C@H](O)c1cccnc1	ZINC000819358644	CD	On-Demand	Anodyne	ADRB2	29	53
CCC(C)(C)OCCNC[C@H](O)c1cccnc1	ZINC000819358644	CD	On-Demand	Anodyne	ADRB1	37	53
CCC(C)(C)OCCNC[C@H](O)c1cccnc1	ZINC000819358644	CD	On-Demand	Anodyne	ADRB3	110	53
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@H]3CCCCN3C2=O)CC1	ZINC000819358645	GD	On-Demand	Anodyne	GPR119	22	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@@H]3CCCCN3C2=O)CC1	ZINC000819358646	GD	On-Demand	Anodyne	GPR119	22	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2C[C@H]3CCCCN3C2=O)CC1	ZINC000819358647	GD	On-Demand	Anodyne	GPR119	22	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2C[C@@H]3CCCCN3C2=O)CC1	ZINC000819358648	GD	On-Demand	Anodyne	GPR119	22	40
O[C@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819358649	GG	On-Demand	Clean	ADRB1	28	45
O[C@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819358649	GG	On-Demand	Clean	ADRB3	41	45
O[C@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819358649	GG	On-Demand	Clean	IGF1R	23	40
O[C@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819358649	GG	On-Demand	Clean	CYP3A4	40	35
O[C@@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819358650	GG	On-Demand	Clean	ADRB1	28	45
O[C@@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819358650	GG	On-Demand	Clean	ADRB3	41	45
O[C@@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819358650	GG	On-Demand	Clean	IGF1R	23	40
O[C@@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819358650	GG	On-Demand	Clean	CYP3A4	40	35
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819358678	FD	On-Demand	Anodyne	ADRB2	41	43
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819358678	FD	On-Demand	Anodyne	ADRB1	64	41
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819358678	FD	On-Demand	Anodyne	ADRB3	43	40
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819358678	FD	On-Demand	Anodyne	ABCB1	42	42
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819358679	FD	On-Demand	Anodyne	ADRB2	41	43
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819358679	FD	On-Demand	Anodyne	ADRB1	64	41
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819358679	FD	On-Demand	Anodyne	ADRB3	43	40
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819358679	FD	On-Demand	Anodyne	ABCB1	42	42
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819358680	FD	On-Demand	Anodyne	ADRB2	41	43
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819358680	FD	On-Demand	Anodyne	ADRB1	64	41
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819358680	FD	On-Demand	Anodyne	ADRB3	43	40
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)COc2ccccc2)C1	ZINC000819358680	FD	On-Demand	Anodyne	ABCB1	42	42
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819358681	FD	On-Demand	Anodyne	ADRB2	41	43
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819358681	FD	On-Demand	Anodyne	ADRB1	64	41
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819358681	FD	On-Demand	Anodyne	ADRB3	43	40
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)COc2ccccc2)C1	ZINC000819358681	FD	On-Demand	Anodyne	ABCB1	42	42
CCC(C)(C)OCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819358686	CG	On-Demand	Anodyne	ADRB2	54	41
CCC(C)(C)OCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819358686	CG	On-Demand	Anodyne	ADRB1	65	50
CCC(C)(C)OCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819358686	CG	On-Demand	Anodyne	ADRB3	74	50
CCC(C)(C)OCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819358687	CG	On-Demand	Anodyne	ADRB2	54	41
CCC(C)(C)OCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819358687	CG	On-Demand	Anodyne	ADRB1	65	50
CCC(C)(C)OCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819358687	CG	On-Demand	Anodyne	ADRB3	74	50
COc1ccc(OC)c([C@H](O)CNCCc2ccc(C)cn2)c1	ZINC000819358693	DE	On-Demand	Anodyne	ADRB2	22	47
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819358698	FF	On-Demand	Anodyne	ADRB1	33	42
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819358698	FF	On-Demand	Anodyne	ADRB3	51	42
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819358698	FF	On-Demand	Anodyne	CYP3A4	49	36
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819358699	FF	On-Demand	Anodyne	ADRB1	33	42
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819358699	FF	On-Demand	Anodyne	ADRB3	51	42
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819358699	FF	On-Demand	Anodyne	CYP3A4	49	36
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819358700	FF	On-Demand	Anodyne	ADRB1	33	42
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819358700	FF	On-Demand	Anodyne	ADRB3	51	42
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819358700	FF	On-Demand	Anodyne	CYP3A4	49	36
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819358701	FF	On-Demand	Anodyne	ADRB1	33	42
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819358701	FF	On-Demand	Anodyne	ADRB3	51	42
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819358701	FF	On-Demand	Anodyne	CYP3A4	49	36
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)c2ccccc2F)C1	ZINC000819358715	FE	On-Demand	Anodyne	GPR119	26	44
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)c2ccccc2F)C1	ZINC000819358716	FE	On-Demand	Anodyne	GPR119	26	44
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)c2ccccc2F)C1	ZINC000819358717	FE	On-Demand	Anodyne	GPR119	26	44
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)c2ccccc2F)C1	ZINC000819358718	FE	On-Demand	Anodyne	GPR119	26	44
O=C1[C@H](NC[C@@H](O)c2cccnc2)C[C@@H]2CCCCN12	ZINC000819358737	CC	On-Demand	Anodyne	ADRB1	15	40
O=C1[C@H](NC[C@@H](O)c2cccnc2)C[C@@H]2CCCCN12	ZINC000819358737	CC	On-Demand	Anodyne	ADRB3	68	43
O=C1[C@H](NC[C@H](O)c2cccnc2)C[C@H]2CCCCN12	ZINC000819358738	CC	On-Demand	Anodyne	ADRB1	15	40
O=C1[C@H](NC[C@H](O)c2cccnc2)C[C@H]2CCCCN12	ZINC000819358738	CC	On-Demand	Anodyne	ADRB3	68	43
O=C1[C@H](NC[C@@H](O)c2cccnc2)C[C@H]2CCCCN12	ZINC000819358739	CC	On-Demand	Anodyne	ADRB1	15	40
O=C1[C@H](NC[C@@H](O)c2cccnc2)C[C@H]2CCCCN12	ZINC000819358739	CC	On-Demand	Anodyne	ADRB3	68	43
O=C1[C@H](NC[C@H](O)c2cccnc2)C[C@@H]2CCCCN12	ZINC000819358740	CC	On-Demand	Anodyne	ADRB1	15	40
O=C1[C@H](NC[C@H](O)c2cccnc2)C[C@@H]2CCCCN12	ZINC000819358740	CC	On-Demand	Anodyne	ADRB3	68	43
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)C[C@H]2CCCCN12	ZINC000819358751	DE	On-Demand	Anodyne	ADRB1	33	41
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)C[C@H]2CCCCN12	ZINC000819358751	DE	On-Demand	Anodyne	ADRB3	47	44
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)C[C@H]2CCCCN12	ZINC000819358751	DE	On-Demand	Anodyne	CYP3A4	49	39
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)C[C@H]2CCCCN12	ZINC000819358752	DE	On-Demand	Anodyne	ADRB1	33	41
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)C[C@H]2CCCCN12	ZINC000819358752	DE	On-Demand	Anodyne	ADRB3	47	44
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)C[C@H]2CCCCN12	ZINC000819358752	DE	On-Demand	Anodyne	CYP3A4	49	39
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)C[C@@H]2CCCCN12	ZINC000819358753	DE	On-Demand	Anodyne	ADRB1	33	41
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)C[C@@H]2CCCCN12	ZINC000819358753	DE	On-Demand	Anodyne	ADRB3	47	44
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)C[C@@H]2CCCCN12	ZINC000819358753	DE	On-Demand	Anodyne	CYP3A4	49	39
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)C[C@@H]2CCCCN12	ZINC000819358754	DE	On-Demand	Anodyne	ADRB1	33	41
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)C[C@@H]2CCCCN12	ZINC000819358754	DE	On-Demand	Anodyne	ADRB3	47	44
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)C[C@@H]2CCCCN12	ZINC000819358754	DE	On-Demand	Anodyne	CYP3A4	49	39
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819358755	FE	On-Demand	Anodyne	GPR119	24	40
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)c2ccc(F)cc2)C1	ZINC000819358756	FE	On-Demand	Anodyne	GPR119	24	40
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819358757	FE	On-Demand	Anodyne	GPR119	24	40
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819358758	FE	On-Demand	Anodyne	GPR119	24	40
O=C1[C@@H](NC[C@H](O)c2ccccc2)C[C@H]2CCCCN12	ZINC000819358765	CD	On-Demand	Anodyne	XIAP	41	40
O=C1[C@@H](NC[C@H](O)c2ccccc2)C[C@H]2CCCCN12	ZINC000819358765	CD	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C1[C@H](NC[C@H](O)c2ccccc2)C[C@H]2CCCCN12	ZINC000819358766	CD	On-Demand	Anodyne	XIAP	41	40
O=C1[C@H](NC[C@H](O)c2ccccc2)C[C@H]2CCCCN12	ZINC000819358766	CD	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C1[C@@H](NC[C@H](O)c2ccccc2)C[C@@H]2CCCCN12	ZINC000819358767	CD	On-Demand	Anodyne	XIAP	41	40
O=C1[C@@H](NC[C@H](O)c2ccccc2)C[C@@H]2CCCCN12	ZINC000819358767	CD	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C1[C@@H](NC[C@@H](O)c2ccccc2)C[C@H]2CCCCN12	ZINC000819358768	CD	On-Demand	Anodyne	XIAP	41	40
O=C1[C@@H](NC[C@@H](O)c2ccccc2)C[C@H]2CCCCN12	ZINC000819358768	CD	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C1[C@H](NC[C@@H](O)c2ccccc2)C[C@H]2CCCCN12	ZINC000819358769	CD	On-Demand	Anodyne	XIAP	41	40
O=C1[C@H](NC[C@@H](O)c2ccccc2)C[C@H]2CCCCN12	ZINC000819358769	CD	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C1[C@H](NC[C@@H](O)c2ccccc2)C[C@@H]2CCCCN12	ZINC000819358770	CD	On-Demand	Anodyne	XIAP	41	40
O=C1[C@H](NC[C@@H](O)c2ccccc2)C[C@@H]2CCCCN12	ZINC000819358770	CD	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C1[C@@H](NC[C@@H](O)c2ccccc2)C[C@@H]2CCCCN12	ZINC000819358771	CD	On-Demand	Anodyne	XIAP	41	40
O=C1[C@@H](NC[C@@H](O)c2ccccc2)C[C@@H]2CCCCN12	ZINC000819358771	CD	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
O=C1[C@H](NC[C@H](O)c2ccccc2)C[C@@H]2CCCCN12	ZINC000819358772	CD	On-Demand	Anodyne	XIAP	41	40
O=C1[C@H](NC[C@H](O)c2ccccc2)C[C@@H]2CCCCN12	ZINC000819358772	CD	On-Demand	Anodyne	Q8WSF8_APLCA	31	40
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819358774	FD	On-Demand	Mild	GPR119	20	44
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819358775	FD	On-Demand	Mild	GPR119	20	44
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819358776	FD	On-Demand	Mild	GPR119	20	44
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819358777	FD	On-Demand	Mild	GPR119	20	44
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819358784	FE	On-Demand	Anodyne	GPR119	21	45
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)c2cccc(F)c2)C1	ZINC000819358785	FE	On-Demand	Anodyne	GPR119	21	45
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819358786	FE	On-Demand	Anodyne	GPR119	21	45
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)c2cccc(F)c2)C1	ZINC000819358787	FE	On-Demand	Anodyne	GPR119	21	45
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819358789	FE	On-Demand	Anodyne	GHRHR	40	31
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)CCc2ccccc2)C1	ZINC000819358790	FE	On-Demand	Anodyne	GHRHR	40	31
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819358791	FE	On-Demand	Anodyne	GHRHR	40	31
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)CCc2ccccc2)C1	ZINC000819358792	FE	On-Demand	Anodyne	GHRHR	40	31
O=C(CCNCc1cc(F)c(N2CCOCC2)c(F)c1)Nc1cccnc1	ZINC000819358797	GE	On-Demand	Clean	PIK3CA	22	46
O=C(CCNCc1cc(F)c(N2CCOCC2)c(F)c1)Nc1cccnc1	ZINC000819358797	GE	On-Demand	Clean	CHRNA7	21	46
O=C(CCNCc1cc(F)c(N2CCOCC2)c(F)c1)Nc1cccnc1	ZINC000819358797	GE	On-Demand	Clean	MTOR	33	46
O=C(CCNCc1cc(F)c(N2CCOCC2)c(F)c1)Nc1cccnc1	ZINC000819358797	GE	On-Demand	Clean	EPHX2	18	40
O=C(CCNCc1cc(F)c(N2CCOCC2)c(F)c1)Nc1cccnc1	ZINC000819358797	GE	On-Demand	Clean	STAT6	50	35
O=C(CCNCc1cc(F)c(N2CCOCC2)c(F)c1)Nc1cccnc1	ZINC000819358797	GE	On-Demand	Clean	NAMPT	40	40
CCOC(=O)c1cc(NC(=O)C/N=C2/NS(=O)(=O)c3ccccc32)ccc1O	ZINC000819358863	HD	On-Demand	Mild	PTGES	15	40
CCOC(=O)c1cc(NC(=O)[C@@H](F)c2ccccc2)ccc1O	ZINC000819358867	DG	On-Demand	Anodyne	CA1	39	41
CCOC(=O)c1cc(NC(=O)[C@@H](F)c2ccccc2)ccc1O	ZINC000819358867	DG	On-Demand	Anodyne	CA7	15	49
CCOC(=O)c1cc(NC(=O)[C@@H](F)c2ccccc2)ccc1O	ZINC000819358867	DG	On-Demand	Anodyne	CA14	15	49
CCOC(=O)c1cc(NC(=O)[C@@H](F)c2ccccc2)ccc1O	ZINC000819358867	DG	On-Demand	Anodyne	CA9	15	44
CCOC(=O)c1cc(NC(=O)CCCn2ccnc2C)ccc1O	ZINC000819358885	EE	On-Demand	Anodyne	ENPP1	51	32
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc(OC)c(OC)c2)ccc1O	ZINC000819358898	FG	On-Demand	Anodyne	APP	42	40
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc(OC)c(OC)c2)ccc1O	ZINC000819358898	FG	On-Demand	Anodyne	TUBB1	45	39
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc(OC)c(OC)c2)ccc1O	ZINC000819358898	FG	On-Demand	Anodyne	ENPP1	67	32
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc(OC)c(OC)c2)ccc1O	ZINC000819358899	FG	On-Demand	Anodyne	APP	42	40
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc(OC)c(OC)c2)ccc1O	ZINC000819358899	FG	On-Demand	Anodyne	TUBB1	45	39
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc(OC)c(OC)c2)ccc1O	ZINC000819358899	FG	On-Demand	Anodyne	ENPP1	67	32
CCOC(=O)c1cc(NC(=O)/C(=C/c2ccco2)NC(=O)c2ccccc2)ccc1O	ZINC000819358913	HH	On-Demand	Anodyne	ADAM12	34	40
CCOC(=O)c1cc(NC(=O)/C(=C\c2ccco2)NC(=O)c2ccccc2)ccc1O	ZINC000819358914	HH	On-Demand	Anodyne	ADAM12	34	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cc(F)ccc3F)CC1)C2	ZINC000819358949	GE	On-Demand	Anodyne	MC4R	41	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cc(F)ccc3F)CC1)C2	ZINC000819358949	GE	On-Demand	Anodyne	SSTR1	42	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cc(F)ccc3F)CC1)C2	ZINC000819358951	GE	On-Demand	Anodyne	MC4R	41	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cc(F)ccc3F)CC1)C2	ZINC000819358951	GE	On-Demand	Anodyne	SSTR1	42	38
CC(C)(C)OC(=O)NC[C@@](C)(O)CNCCc1cccc(Br)c1	ZINC000819358973	GF	On-Demand	Anodyne	PAPA1_CARPA	21	48
CC(C)(C)OC(=O)NC[C@](C)(O)CNCCc1cccc(Br)c1	ZINC000819358975	GF	On-Demand	Anodyne	PAPA1_CARPA	21	48
CC[C@H](CNC(=O)/C=C\[C@@H]1CCCO1)Oc1cccc(C(F)(F)F)c1	ZINC000819359011	FH	On-Demand	Anodyne	PDS	50	41
CC[C@H](CNC(=O)/C=C/[C@@H]1CCCO1)Oc1cccc(C(F)(F)F)c1	ZINC000819359013	FH	On-Demand	Anodyne	PDS	50	41
CC[C@H](CNC(=O)/C=C\[C@H]1CCCO1)Oc1cccc(C(F)(F)F)c1	ZINC000819359015	FH	On-Demand	Anodyne	PDS	50	41
CC[C@H](CNC(=O)/C=C/[C@H]1CCCO1)Oc1cccc(C(F)(F)F)c1	ZINC000819359017	FH	On-Demand	Anodyne	PDS	50	41
CCO[C@H]1C[C@@H](NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819359046	CD	On-Demand	Bother	SLC27A4	43	34
CCO[C@H]1C[C@@H](NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819359048	CD	On-Demand	Bother	SLC27A4	43	34
CCO[C@H]1C[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819359055	BD	On-Demand	Anodyne	TIMP3	56	32
CCO[C@H]1C[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819359055	BD	On-Demand	Anodyne	AOC3	15	44
CCO[C@H]1C[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819359057	BD	On-Demand	Anodyne	TIMP3	56	32
CCO[C@H]1C[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819359057	BD	On-Demand	Anodyne	AOC3	15	44
O[C@@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819359073	EE	On-Demand	Clean	ADRB1	23	43
O[C@@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819359073	EE	On-Demand	Clean	ADRB3	87	43
O[C@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819359074	EE	On-Demand	Clean	ADRB1	23	43
O[C@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819359074	EE	On-Demand	Clean	ADRB3	87	43
C[C@@H](CCCc1cccnc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819359086	GG	On-Demand	Anodyne	FKBP1A	25	42
C[C@@H](CCCc1cccnc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819359086	GG	On-Demand	Anodyne	PTAFR	35	41
C[C@@H](CCCc1cccnc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819359086	GG	On-Demand	Anodyne	C3AR1	41	39
C[C@@H](CCCc1cccnc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819359086	GG	On-Demand	Anodyne	GPR119	43	45
C[C@@H](CCCc1cccnc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819359088	GG	On-Demand	Anodyne	FKBP1A	25	42
C[C@@H](CCCc1cccnc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819359088	GG	On-Demand	Anodyne	PTAFR	35	41
C[C@@H](CCCc1cccnc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819359088	GG	On-Demand	Anodyne	C3AR1	41	39
C[C@@H](CCCc1cccnc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819359088	GG	On-Demand	Anodyne	GPR119	43	45
C[C@@H](Cc1ccncc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359126	FF	On-Demand	Mild	PGC	44	37
C[C@@H](Cc1ccncc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359126	FF	On-Demand	Mild	KLK3	48	34
C[C@@H](Cc1ccncc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359126	FF	On-Demand	Mild	PAPA1_CARPA	71	51
C[C@@H](Cc1ccncc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359126	FF	On-Demand	Mild	CYSP_TRYCR	47	36
C[C@@H](Cc1ccncc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359126	FF	On-Demand	Mild	CCKAR	40	37
C[C@@H](Cc1ccncc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359126	FF	On-Demand	Mild	CTSK	22	45
C[C@@H](Cc1ccncc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359126	FF	On-Demand	Mild	CTSL	28	51
C[C@@H](Cc1ccncc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359126	FF	On-Demand	Mild	CAPNS1	51	31
C[C@@H](Cc1ccncc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359126	FF	On-Demand	Mild	REN	58	42
C[C@@H](Cc1ccncc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359126	FF	On-Demand	Mild	CTSS	15	51
C[C@@H](Cc1ccncc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359126	FF	On-Demand	Mild	CAPN1	23	43
C[C@@H](Cc1ccncc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359126	FF	On-Demand	Mild	FPR1	56	49
C[C@@H](Cc1ccncc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359127	FF	On-Demand	Mild	PGC	44	37
C[C@@H](Cc1ccncc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359127	FF	On-Demand	Mild	KLK3	48	34
C[C@@H](Cc1ccncc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359127	FF	On-Demand	Mild	PAPA1_CARPA	71	51
C[C@@H](Cc1ccncc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359127	FF	On-Demand	Mild	CYSP_TRYCR	47	36
C[C@@H](Cc1ccncc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359127	FF	On-Demand	Mild	CCKAR	40	37
C[C@@H](Cc1ccncc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359127	FF	On-Demand	Mild	CTSK	22	45
C[C@@H](Cc1ccncc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359127	FF	On-Demand	Mild	CTSL	28	51
C[C@@H](Cc1ccncc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359127	FF	On-Demand	Mild	CAPNS1	51	31
C[C@@H](Cc1ccncc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359127	FF	On-Demand	Mild	REN	58	42
C[C@@H](Cc1ccncc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359127	FF	On-Demand	Mild	CTSS	15	51
C[C@@H](Cc1ccncc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359127	FF	On-Demand	Mild	CAPN1	23	43
C[C@@H](Cc1ccncc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819359127	FF	On-Demand	Mild	FPR1	56	49
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819359139	GI	On-Demand	Anodyne	PAPA1_CARPA	22	46
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819359139	GI	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819359139	GI	On-Demand	Anodyne	ECE1	20	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819359140	GI	On-Demand	Anodyne	PAPA1_CARPA	22	46
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819359140	GI	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819359140	GI	On-Demand	Anodyne	ECE1	20	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819359141	GI	On-Demand	Anodyne	PAPA1_CARPA	22	46
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819359141	GI	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819359141	GI	On-Demand	Anodyne	ECE1	20	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819359142	GI	On-Demand	Anodyne	PAPA1_CARPA	22	46
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819359142	GI	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)Cc2ccc3ccccc3c2)C1	ZINC000819359142	GI	On-Demand	Anodyne	ECE1	20	40
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819359161	CD	On-Demand	Anodyne	ADRB3	26	50
O=C(CCNCc1cc(F)c(N2CCOCC2)c(F)c1)Nc1cccc(F)c1	ZINC000819359171	GG	On-Demand	Clean	EPHX2	23	44
O=C(CCNCc1cc(F)c(N2CCOCC2)c(F)c1)Nc1cccc(F)c1	ZINC000819359171	GG	On-Demand	Clean	PIK3CB	15	49
CC[C@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1	ZINC000819359245	FG	On-Demand	Bother	CACNA1C	44	34
CC[C@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1	ZINC000819359245	FG	On-Demand	Bother	CACNA1D	65	33
CC[C@@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1	ZINC000819359246	FG	On-Demand	Bother	CACNA1C	44	34
CC[C@@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1	ZINC000819359246	FG	On-Demand	Bother	CACNA1D	65	33
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CC[C@H](c3cccc(Cl)c3)C2)cc1	ZINC000819359255	GH	On-Demand	Anodyne	ADRB3	33	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CC[C@@H](c3cccc(Cl)c3)C2)cc1	ZINC000819359256	GH	On-Demand	Anodyne	ADRB3	33	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CC[C@H](c3cccc(Cl)c3)C2)cc1	ZINC000819359257	GH	On-Demand	Anodyne	ADRB3	33	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CC[C@@H](c3cccc(Cl)c3)C2)cc1	ZINC000819359258	GH	On-Demand	Anodyne	ADRB3	33	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819359265	GH	On-Demand	Anodyne	CACNA1I	43	39
CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819359266	GH	On-Demand	Anodyne	CACNA1I	43	39
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819359267	GH	On-Demand	Anodyne	CACNA1I	43	39
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NCCC(=O)Nc2cccc(Cl)c2)C1	ZINC000819359268	GH	On-Demand	Anodyne	CACNA1I	43	39
CC(C)(C)OC(=O)N1CCO[C@@H](CNCCC(=O)Nc2cccnc2)C1	ZINC000819359285	FD	On-Demand	Anodyne	GPR119	24	41
CC(C)(C)OC(=O)N1CCO[C@H](CNCCC(=O)Nc2cccnc2)C1	ZINC000819359288	FD	On-Demand	Anodyne	GPR119	24	41
CCCN(CCC)C(=O)c1cccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)c1	ZINC000819359301	HI	On-Demand	Anodyne	ROCK2	16	40
CCCN(CCC)C(=O)c1cccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)c1	ZINC000819359301	HI	On-Demand	Anodyne	KCNK3	104	41
CCCN(CCC)C(=O)c1cccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)c1	ZINC000819359301	HI	On-Demand	Anodyne	KCNK9	64	41
CCOC(=O)c1cc(NC(=O)COc2ccc(C3SCCCS3)cc2)ccc1O	ZINC000819359311	II	On-Demand	Anodyne	HIF1A	20	40
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819359346	FE	On-Demand	Anodyne	GPR119	21	43
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)c2ccc(F)cc2F)C1	ZINC000819359349	FE	On-Demand	Anodyne	GPR119	21	43
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819359351	FE	On-Demand	Anodyne	GPR119	21	43
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819359354	FE	On-Demand	Anodyne	GPR119	21	43
CCOC(=O)c1cc(NC(=O)CSC(C)(C)C)ccc1O	ZINC000819359362	DG	On-Demand	Anodyne	ENPP1	61	32
CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1NS(=O)(=O)c1cc([N+](=O)[O-])ccc1C	ZINC000819359490	JG	On-Demand	Bother	TBXA2R	26	40
CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1NS(=O)(=O)c1ccc(C(C)=O)cc1	ZINC000819359496	JG	On-Demand	Anodyne	PRTN3	54	37
CCOC(=O)c1cc(NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)ccc1O	ZINC000819359498	HH	On-Demand	Anodyne	EPHX2	20	44
CCOC(=O)c1cc(NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)ccc1O	ZINC000819359498	HH	On-Demand	Anodyne	GPR119	41	43
CC(=O)Nc1cccc(CC(=O)N2CC[C@H](N(C)C(=O)OC(C)(C)C)C2)c1	ZINC000819359532	GF	On-Demand	Anodyne	GPR119	18	41
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H](N(C)C(=O)OC(C)(C)C)C2)c1	ZINC000819359533	GF	On-Demand	Anodyne	GPR119	18	41
O[C@@H](CNCCOCC1CCCC1)c1ccc(Cl)c(F)c1	ZINC000819359534	DG	On-Demand	Anodyne	ADRB2	25	41
O[C@@H](CNCCOCC1CCCC1)c1ccc(Cl)c(F)c1	ZINC000819359534	DG	On-Demand	Anodyne	ADRB1	28	41
O[C@@H](CNCCOCC1CCCC1)c1ccc(Cl)c(F)c1	ZINC000819359534	DG	On-Demand	Anodyne	ADRB3	21	41
O[C@H](CNCCOCC1CCCC1)c1ccc(Cl)c(F)c1	ZINC000819359535	DG	On-Demand	Anodyne	ADRB2	25	41
O[C@H](CNCCOCC1CCCC1)c1ccc(Cl)c(F)c1	ZINC000819359535	DG	On-Demand	Anodyne	ADRB1	28	41
O[C@H](CNCCOCC1CCCC1)c1ccc(Cl)c(F)c1	ZINC000819359535	DG	On-Demand	Anodyne	ADRB3	21	41
CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819359538	FG	On-Demand	Anodyne	ACACB	15	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819359539	FG	On-Demand	Anodyne	ACACB	15	44
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819359540	FG	On-Demand	Anodyne	ACACB	15	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NCCC(=O)Nc2ccccc2)C1	ZINC000819359541	FG	On-Demand	Anodyne	ACACB	15	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819359554	FF	On-Demand	Anodyne	ADRB2	47	43
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819359554	FF	On-Demand	Anodyne	ADRB1	70	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819359554	FF	On-Demand	Anodyne	ADRB3	52	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819359554	FF	On-Demand	Anodyne	ACACB	15	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819359555	FF	On-Demand	Anodyne	ADRB2	47	43
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819359555	FF	On-Demand	Anodyne	ADRB1	70	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819359555	FF	On-Demand	Anodyne	ADRB3	52	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819359555	FF	On-Demand	Anodyne	ACACB	15	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819359556	FF	On-Demand	Anodyne	ADRB2	47	43
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819359556	FF	On-Demand	Anodyne	ADRB1	70	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819359556	FF	On-Demand	Anodyne	ADRB3	52	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)COc2ccccc2)C1	ZINC000819359556	FF	On-Demand	Anodyne	ACACB	15	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819359557	FF	On-Demand	Anodyne	ADRB2	47	43
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819359557	FF	On-Demand	Anodyne	ADRB1	70	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819359557	FF	On-Demand	Anodyne	ADRB3	52	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2)C1	ZINC000819359557	FF	On-Demand	Anodyne	ACACB	15	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819359568	GF	On-Demand	Anodyne	ADRB2	23	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819359568	GF	On-Demand	Anodyne	ADRB1	51	36
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819359569	GF	On-Demand	Anodyne	ADRB2	23	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819359569	GF	On-Demand	Anodyne	ADRB1	51	36
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819359570	GF	On-Demand	Anodyne	ADRB2	23	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)COc2ccccc2F)C1	ZINC000819359570	GF	On-Demand	Anodyne	ADRB1	51	36
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819359571	GF	On-Demand	Anodyne	ADRB2	23	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)COc2ccccc2F)C1	ZINC000819359571	GF	On-Demand	Anodyne	ADRB1	51	36
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819359572	FG	On-Demand	Anodyne	ADRB3	25	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819359573	FG	On-Demand	Anodyne	ADRB3	25	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819359574	FG	On-Demand	Anodyne	ADRB3	25	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819359575	FG	On-Demand	Anodyne	ADRB3	25	40
Cn1ccnc1[C@@H]1C[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)CCO1	ZINC000819359577	FF	On-Demand	Anodyne	MAPK1	48	41
Cn1ccnc1[C@@H]1C[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)CCO1	ZINC000819359578	FF	On-Demand	Anodyne	MAPK1	48	41
Cn1ccnc1[C@@H]1C[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)CCO1	ZINC000819359579	FF	On-Demand	Anodyne	MAPK1	48	41
Cn1ccnc1[C@@H]1C[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)CCO1	ZINC000819359580	FF	On-Demand	Anodyne	MAPK1	48	41
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819359581	CD	On-Demand	Anodyne	ADRB1	44	49
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819359581	CD	On-Demand	Anodyne	ADRB3	62	54
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819359581	CD	On-Demand	Anodyne	CYP3A4	46	37
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819359582	CD	On-Demand	Anodyne	ADRB1	44	49
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819359582	CD	On-Demand	Anodyne	ADRB3	62	54
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819359582	CD	On-Demand	Anodyne	CYP3A4	46	37
Cc1cccc([C@@H](C)NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819359592	FH	On-Demand	Anodyne	GPR119	44	51
Cc1cccc([C@@H](C)NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819359595	FH	On-Demand	Anodyne	GPR119	44	51
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819359642	FG	On-Demand	Anodyne	PGC	46	35
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819359642	FG	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819359642	FG	On-Demand	Anodyne	TACR3	16	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819359642	FG	On-Demand	Anodyne	REN	56	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819359642	FG	On-Demand	Anodyne	FPR1	40	37
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819359644	FG	On-Demand	Anodyne	PGC	46	35
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819359644	FG	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819359644	FG	On-Demand	Anodyne	TACR3	16	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819359644	FG	On-Demand	Anodyne	REN	56	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)CCc2ccccc2)C1	ZINC000819359644	FG	On-Demand	Anodyne	FPR1	40	37
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819359645	FG	On-Demand	Anodyne	PGC	46	35
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819359645	FG	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819359645	FG	On-Demand	Anodyne	TACR3	16	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819359645	FG	On-Demand	Anodyne	REN	56	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819359645	FG	On-Demand	Anodyne	FPR1	40	37
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819359646	FG	On-Demand	Anodyne	PGC	46	35
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819359646	FG	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819359646	FG	On-Demand	Anodyne	TACR3	16	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819359646	FG	On-Demand	Anodyne	REN	56	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)CCc2ccccc2)C1	ZINC000819359646	FG	On-Demand	Anodyne	FPR1	40	37
Cc1cc(F)ccc1[C@@H](O)CNC[C@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000819359650	FE	On-Demand	Anodyne	GPR119	20	41
Cc1cc(F)ccc1[C@@H](O)CNC[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000819359652	FE	On-Demand	Anodyne	GPR119	20	41
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819359665	FG	On-Demand	Anodyne	L3MBTL3	54	33
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819359668	FG	On-Demand	Anodyne	L3MBTL3	54	33
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819359670	FG	On-Demand	Anodyne	L3MBTL3	54	33
CCOc1ccc(C(=O)N2CCCCC2)cc1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819359672	FG	On-Demand	Anodyne	L3MBTL3	54	33
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819359721	FE	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819359723	FE	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819359725	FE	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819359728	FE	On-Demand	Anodyne	GPR119	25	40
O[C@@H](CNCC1(N2CCOCC2)CCOCC1)c1cccnc1	ZINC000819359758	DC	On-Demand	Anodyne	ADRB2	18	40
O[C@@H](CNCC1(N2CCOCC2)CCOCC1)c1cccnc1	ZINC000819359758	DC	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CNCC1(N2CCOCC2)CCOCC1)c1cccnc1	ZINC000819359758	DC	On-Demand	Anodyne	ADRB3	79	41
O[C@H](CNCC1(N2CCOCC2)CCOCC1)c1cccnc1	ZINC000819359760	DC	On-Demand	Anodyne	ADRB2	18	40
O[C@H](CNCC1(N2CCOCC2)CCOCC1)c1cccnc1	ZINC000819359760	DC	On-Demand	Anodyne	ADRB1	20	40
O[C@H](CNCC1(N2CCOCC2)CCOCC1)c1cccnc1	ZINC000819359760	DC	On-Demand	Anodyne	ADRB3	79	41
O[C@@H](CNCC1(N2CCOCC2)CCOCC1)c1cccc(Cl)c1	ZINC000819359773	FD	On-Demand	Anodyne	ADRB1	26	41
O[C@@H](CNCC1(N2CCOCC2)CCOCC1)c1cccc(Cl)c1	ZINC000819359773	FD	On-Demand	Anodyne	ADRB3	40	41
O[C@H](CNCC1(N2CCOCC2)CCOCC1)c1cccc(Cl)c1	ZINC000819359775	FD	On-Demand	Anodyne	ADRB1	26	41
O[C@H](CNCC1(N2CCOCC2)CCOCC1)c1cccc(Cl)c1	ZINC000819359775	FD	On-Demand	Anodyne	ADRB3	40	41
O[C@@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)COc1ccc(F)cc1	ZINC000819359780	GE	On-Demand	Clean	ADRB2	30	45
O[C@@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)COc1ccc(F)cc1	ZINC000819359780	GE	On-Demand	Clean	ADRB1	52	45
O[C@@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)COc1ccc(F)cc1	ZINC000819359780	GE	On-Demand	Clean	ADRB3	32	40
O[C@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)COc1ccc(F)cc1	ZINC000819359782	GE	On-Demand	Clean	ADRB2	30	45
O[C@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)COc1ccc(F)cc1	ZINC000819359782	GE	On-Demand	Clean	ADRB1	52	45
O[C@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)COc1ccc(F)cc1	ZINC000819359782	GE	On-Demand	Clean	ADRB3	32	40
COCCCOc1cccc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819359810	FF	On-Demand	Anodyne	EPHX2	22	44
O[C@@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)COc1ccccc1F	ZINC000819359816	GE	On-Demand	Clean	ADRB2	20	43
O[C@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)COc1ccccc1F	ZINC000819359817	GE	On-Demand	Clean	ADRB2	20	43
CCOC(=O)c1cc(NC(=O)Cn2c(=O)n(CC)c(=O)c3ccccc32)ccc1O	ZINC000819359836	HD	On-Demand	Anodyne	IMDH_CRYPV	54	36
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc3c(c2)OCO3)ccc1O	ZINC000819359845	FF	On-Demand	Anodyne	MCHR1	15	40
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc3c(c2)OCO3)ccc1O	ZINC000819359845	FF	On-Demand	Anodyne	DYRK2	70	34
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc3c(c2)OCO3)ccc1O	ZINC000819359846	FF	On-Demand	Anodyne	MCHR1	15	40
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc3c(c2)OCO3)ccc1O	ZINC000819359846	FF	On-Demand	Anodyne	DYRK2	70	34
C=CCOc1ccccc1C(=O)Nc1ccc(O)c(C(=O)OCC)c1	ZINC000819359858	EG	On-Demand	Mild	HCN1	47	33
C=CCOc1ccccc1C(=O)Nc1ccc(O)c(C(=O)OCC)c1	ZINC000819359858	EG	On-Demand	Mild	KCNK3	63	50
C=CCOc1ccccc1C(=O)Nc1ccc(O)c(C(=O)OCC)c1	ZINC000819359858	EG	On-Demand	Mild	KCNK9	67	50
CCOC(=O)c1cc(NC(=O)C[C@H](O)c2cc(Cl)cc(Cl)c2)ccc1O	ZINC000819359866	GH	On-Demand	Anodyne	SLC1A2	49	40
CCOC(=O)c1cc(NC(=O)C[C@@H](O)c2cc(Cl)cc(Cl)c2)ccc1O	ZINC000819359867	GH	On-Demand	Anodyne	SLC1A2	49	40
CCOC(=O)c1cc(NC(=O)CSC2CCN(C(=O)OC(C)(C)C)CC2)ccc1O	ZINC000819359875	IH	On-Demand	Anodyne	GPR119	38	41
CCOC(=O)c1cc(NC(=O)COC2CCN(C(=O)OC(C)(C)C)CC2)ccc1O	ZINC000819359892	HF	On-Demand	Anodyne	GPR119	40	40
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819359893	CD	On-Demand	Anodyne	SLC6A3	18	50
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819359893	CD	On-Demand	Anodyne	ADRB3	22	41
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819359895	CD	On-Demand	Anodyne	SLC6A3	18	50
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819359895	CD	On-Demand	Anodyne	ADRB3	22	41
COC(=O)C[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCO1	ZINC000819359920	GD	On-Demand	Mild	PAPA1_CARPA	31	41
COC(=O)C[C@@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCO1	ZINC000819359922	GD	On-Demand	Mild	PAPA1_CARPA	31	41
CCOC(=O)c1cc(NC(=O)/C(C#N)=C\c2cc(C#N)n(C)c2C)ccc1O	ZINC000819359923	GF	On-Demand	Reactive	CA12	16	42
COC(=O)C[C@H]1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCO1	ZINC000819359924	GD	On-Demand	Mild	PAPA1_CARPA	31	41
COC(=O)C[C@@H]1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCO1	ZINC000819359925	GD	On-Demand	Mild	PAPA1_CARPA	31	41
CCOC(=O)c1cc(NC(=O)/C(C#N)=C/c2cc(C#N)n(C)c2C)ccc1O	ZINC000819359926	GF	On-Demand	Reactive	CA12	16	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819359974	GH	On-Demand	Anodyne	CACNA1I	42	36
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)Cc2cccc(Cl)c2)C1	ZINC000819359975	GH	On-Demand	Anodyne	CACNA1I	42	36
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819359977	GH	On-Demand	Anodyne	CACNA1I	42	36
CCOC(=O)c1cc(NC(=O)[C@@H](CC)NC(=O)OC(C)(C)C)ccc1O	ZINC000819359978	FF	On-Demand	Anodyne	PAPA1_CARPA	36	41
CCOC(=O)c1cc(NC(=O)[C@@H](CC)NC(=O)OC(C)(C)C)ccc1O	ZINC000819359978	FF	On-Demand	Anodyne	FPR1	43	35
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)Cc2cccc(Cl)c2)C1	ZINC000819359979	GH	On-Demand	Anodyne	CACNA1I	42	36
CCC(C)(C)OCCNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819360066	FF	On-Demand	Anodyne	GPR119	27	43
CCC(C)(C)OCCNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819360067	FF	On-Demand	Anodyne	GPR119	27	43
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819360070	FE	On-Demand	Anodyne	GPR119	23	45
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819360071	FE	On-Demand	Anodyne	GPR119	23	45
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819360072	FE	On-Demand	Anodyne	GPR119	23	45
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819360073	FE	On-Demand	Anodyne	GPR119	23	45
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819360082	FD	On-Demand	Anodyne	REN	41	36
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819360082	FD	On-Demand	Anodyne	FPR1	42	33
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819360083	FD	On-Demand	Anodyne	REN	41	36
CC(C)(C)OC(=O)N1CCO[C@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819360083	FD	On-Demand	Anodyne	FPR1	42	33
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819360084	FD	On-Demand	Anodyne	REN	41	36
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@@H](O)Cc2ccccc2)C1	ZINC000819360084	FD	On-Demand	Anodyne	FPR1	42	33
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819360085	FD	On-Demand	Anodyne	REN	41	36
CC(C)(C)OC(=O)N1CCO[C@@H](CNC[C@H](O)Cc2ccccc2)C1	ZINC000819360085	FD	On-Demand	Anodyne	FPR1	42	33
CC(C)(C)OC(=O)N1CCO[C@@H](CNCCS(=O)(=O)c2ccccc2)C1	ZINC000819360090	GD	On-Demand	Anodyne	SFRP1	55	40
CC(C)(C)OC(=O)N1CCO[C@H](CNCCS(=O)(=O)c2ccccc2)C1	ZINC000819360091	GD	On-Demand	Anodyne	SFRP1	55	40
CCC(C)(C)OCCNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819360098	EG	On-Demand	Anodyne	ADRB3	20	46
CCC(C)(C)OCCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819360099	EG	On-Demand	Anodyne	ADRB3	20	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H](C2CCC2)C2CC2)CC1	ZINC000819360102	FG	On-Demand	Anodyne	GPR119	33	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H](C2CCC2)C2CC2)CC1	ZINC000819360103	FG	On-Demand	Anodyne	GPR119	33	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H](C2CCC2)C2CC2)CC1	ZINC000819360104	FG	On-Demand	Anodyne	GPR119	33	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H](C2CCC2)C2CC2)CC1	ZINC000819360105	FG	On-Demand	Anodyne	GPR119	33	43
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cccc(Br)c2)c1	ZINC000819360122	FG	On-Demand	Bother	ADRB2	58	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cccc(Br)c2)c1	ZINC000819360122	FG	On-Demand	Bother	ADRB1	61	42
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cccc(Br)c2)c1	ZINC000819360122	FG	On-Demand	Bother	ADRB3	94	43
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cccc(Br)c2)c1	ZINC000819360123	FG	On-Demand	Bother	ADRB2	58	41
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cccc(Br)c2)c1	ZINC000819360123	FG	On-Demand	Bother	ADRB1	61	42
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cccc(Br)c2)c1	ZINC000819360123	FG	On-Demand	Bother	ADRB3	94	43
COCCCOc1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819360126	CG	On-Demand	Anodyne	HRH2	24	41
COCCCOc1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819360126	CG	On-Demand	Anodyne	EPHX2	20	40
COCCCOc1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819360126	CG	On-Demand	Anodyne	KCNK3	48	35
COCCCOc1cccc(NC(=O)C(F)=C2CCC2)c1	ZINC000819360126	CG	On-Demand	Anodyne	KCNK9	49	35
Cn1cnc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819360129	CD	On-Demand	Bother	ADRB3	61	36
Cn1cnc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819360130	CD	On-Demand	Bother	ADRB3	61	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CC(N)=O)c1cccc(Cl)c1)C2	ZINC000819360139	GE	On-Demand	Anodyne	LGMN	63	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CC(N)=O)c1cccc(Cl)c1)C2	ZINC000819360140	GE	On-Demand	Anodyne	LGMN	63	37
O=C(CCNCc1cc(F)c(N2CCOCC2)c(F)c1)Nc1ccccc1F	ZINC000819360143	GG	On-Demand	Clean	PRKDC	51	40
O[C@@H](CNCC1(C2CCC2)CCC1)c1ccccc1	ZINC000819360144	CG	On-Demand	Anodyne	SLC18A2	23	46
O[C@@H](CNCC1(C2CCC2)CCC1)c1ccccc1	ZINC000819360144	CG	On-Demand	Anodyne	Q8WSF8_APLCA	24	46
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](OCCCc2ccccc2)C1	ZINC000819360145	EF	On-Demand	Anodyne	FKBP1A	42	38
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](OCCCc2ccccc2)C1	ZINC000819360146	EF	On-Demand	Anodyne	FKBP1A	42	38
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](OCCCc2ccccc2)C1	ZINC000819360147	EF	On-Demand	Anodyne	FKBP1A	42	38
O[C@H](CNCC1(C2CCC2)CCC1)c1ccccc1	ZINC000819360148	CG	On-Demand	Anodyne	SLC18A2	23	46
O[C@H](CNCC1(C2CCC2)CCC1)c1ccccc1	ZINC000819360148	CG	On-Demand	Anodyne	Q8WSF8_APLCA	24	46
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](OCCCc2ccccc2)C1	ZINC000819360149	EF	On-Demand	Anodyne	FKBP1A	42	38
O[C@@H](CNCC1(N2CCOCC2)CCOCC1)c1ccccc1Cl	ZINC000819360170	FD	On-Demand	Anodyne	HCN1	38	40
O[C@@H](CNCC1(N2CCOCC2)CCOCC1)c1ccccc1Br	ZINC000819360188	GD	On-Demand	Anodyne	HCN1	38	40
O[C@H](CNCC1(N2CCOCC2)CCOCC1)c1ccccc1Br	ZINC000819360190	GD	On-Demand	Anodyne	HCN1	38	40
COc1ccc(OC)c([C@H](O)CNCCc2cnc(C)cn2)c1	ZINC000819360203	DD	On-Demand	Anodyne	ADRB2	20	47
C[C@@H]1CCCC[C@@H]1C(=O)N(C)CC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819360213	FH	On-Demand	Anodyne	OPRK1	32	41
C[C@@H]1CCCC[C@@H]1C(=O)N(C)CC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819360214	FH	On-Demand	Anodyne	OPRK1	32	41
C[C@@H]1CCCC[C@H]1C(=O)N(C)CC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819360215	FH	On-Demand	Anodyne	OPRK1	32	41
C[C@@H]1CCCC[C@H]1C(=O)N(C)CC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819360216	FH	On-Demand	Anodyne	OPRK1	32	41
Cc1ccc(OC[C@@H](O)CNCc2cc(F)c(N3CCOCC3)c(F)c2)cc1	ZINC000819360218	GF	On-Demand	Clean	ADRB2	33	44
Cc1ccc(OC[C@@H](O)CNCc2cc(F)c(N3CCOCC3)c(F)c2)cc1	ZINC000819360218	GF	On-Demand	Clean	ADRB1	49	44
Cc1ccc(OC[C@H](O)CNCc2cc(F)c(N3CCOCC3)c(F)c2)cc1	ZINC000819360221	GF	On-Demand	Clean	ADRB2	33	44
Cc1ccc(OC[C@H](O)CNCc2cc(F)c(N3CCOCC3)c(F)c2)cc1	ZINC000819360221	GF	On-Demand	Clean	ADRB1	49	44
O[C@@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819360238	GE	On-Demand	Clean	ADRB2	42	45
O[C@@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819360238	GE	On-Demand	Clean	ADRB1	68	43
O[C@@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819360238	GE	On-Demand	Clean	ADRB3	48	42
O[C@@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819360238	GE	On-Demand	Clean	STAT6	43	32
O[C@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819360240	GE	On-Demand	Clean	ADRB2	42	45
O[C@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819360240	GE	On-Demand	Clean	ADRB1	68	43
O[C@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819360240	GE	On-Demand	Clean	ADRB3	48	42
O[C@H](CNCc1cc(F)c(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819360240	GE	On-Demand	Clean	STAT6	43	32
NC(=O)CCNCc1cc(F)c(N2CCOCC2)c(F)c1	ZINC000819360284	CC	On-Demand	Clean	STAT6	45	35
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCC2CC(F)(F)C2)CC1	ZINC000819360299	FG	On-Demand	Anodyne	GPR119	31	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCC2CC(F)(F)C2)CC1	ZINC000819360300	FG	On-Demand	Anodyne	GPR119	31	44
O[C@H](CNCCC1CC(F)(F)C1)c1cccnc1	ZINC000819360301	CE	On-Demand	Anodyne	ADRB2	24	44
O[C@H](CNCCC1CC(F)(F)C1)c1cccnc1	ZINC000819360301	CE	On-Demand	Anodyne	ADRB1	25	44
O[C@H](CNCCC1CC(F)(F)C1)c1cccnc1	ZINC000819360301	CE	On-Demand	Anodyne	ADRB3	97	45
O[C@@H](CNCCC1CC(F)(F)C1)c1cccnc1	ZINC000819360302	CE	On-Demand	Anodyne	ADRB2	24	44
O[C@@H](CNCCC1CC(F)(F)C1)c1cccnc1	ZINC000819360302	CE	On-Demand	Anodyne	ADRB1	25	44
O[C@@H](CNCCC1CC(F)(F)C1)c1cccnc1	ZINC000819360302	CE	On-Demand	Anodyne	ADRB3	97	45
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819360320	DD	On-Demand	Anodyne	ADRB3	25	43
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819360321	DD	On-Demand	Anodyne	ADRB3	25	43
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CC[C@@H](c3cccc(Cl)c3)C2)c1	ZINC000819360326	FI	On-Demand	Bother	ADRB3	35	43
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CC[C@@H](c3cccc(Cl)c3)C2)c1	ZINC000819360327	FI	On-Demand	Bother	ADRB3	35	43
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CC[C@H](c3cccc(Cl)c3)C2)c1	ZINC000819360328	FI	On-Demand	Bother	ADRB3	35	43
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CC[C@H](c3cccc(Cl)c3)C2)c1	ZINC000819360329	FI	On-Demand	Bother	ADRB3	35	43
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819360334	DD	On-Demand	Anodyne	ADRB3	18	53
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819360335	DD	On-Demand	Anodyne	ADRB3	18	53
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCC2CCCC2)c1	ZINC000819360336	DE	On-Demand	Bother	ADRB1	42	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCC2CCCC2)c1	ZINC000819360336	DE	On-Demand	Bother	ADRB3	45	40
O=[N+]([O-])c1cccc([C@@H](O)CNCCOCC2CCCC2)c1	ZINC000819360336	DE	On-Demand	Bother	CACNA1D	58	39
O=[N+]([O-])c1cccc([C@H](O)CNCCOCC2CCCC2)c1	ZINC000819360337	DE	On-Demand	Bother	ADRB1	42	40
O=[N+]([O-])c1cccc([C@H](O)CNCCOCC2CCCC2)c1	ZINC000819360337	DE	On-Demand	Bother	ADRB3	45	40
O=[N+]([O-])c1cccc([C@H](O)CNCCOCC2CCCC2)c1	ZINC000819360337	DE	On-Demand	Bother	CACNA1D	58	39
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819360356	CD	On-Demand	Anodyne	ADRB3	25	43
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819360357	CD	On-Demand	Anodyne	ADRB3	25	43
COc1cc(CN2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc(OC)c1OC	ZINC000819360383	GE	On-Demand	Anodyne	SSTR5	41	35
COc1cc(CN2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc(OC)c1OC	ZINC000819360384	GE	On-Demand	Anodyne	SSTR5	41	35
COc1cc(CN2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc(OC)c1OC	ZINC000819360385	GE	On-Demand	Anodyne	SSTR5	41	35
COc1cc(CN2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc(OC)c1OC	ZINC000819360386	GE	On-Demand	Anodyne	SSTR5	41	35
CCOC(=O)c1cc(NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2OC)ccc1O	ZINC000819360396	IH	On-Demand	Anodyne	KCNK3	49	37
CCOC(=O)c1cc(NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2OC)ccc1O	ZINC000819360396	IH	On-Demand	Anodyne	KCNK9	41	37
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819360415	EE	On-Demand	Anodyne	ADRB3	69	47
CCOC(=O)c1cc(NC(=O)Cc2cc(C(F)(F)F)cc(Cl)n2)ccc1O	ZINC000819360416	HH	On-Demand	Anodyne	ATF1	41	41
CCOC(=O)c1cc(NC(=O)Cc2cc(C(F)(F)F)cc(Cl)n2)ccc1O	ZINC000819360416	HH	On-Demand	Anodyne	NFKB1	38	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819360417	EE	On-Demand	Anodyne	ADRB3	69	47
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819360418	EE	On-Demand	Anodyne	ADRB3	69	47
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819360420	EE	On-Demand	Anodyne	ADRB3	69	47
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc(O)cc2)ccc1O	ZINC000819360421	EF	On-Demand	Anodyne	HDAC8	15	41
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc(O)cc2)ccc1O	ZINC000819360421	EF	On-Demand	Anodyne	MMP2	17	57
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc(O)cc2)ccc1O	ZINC000819360421	EF	On-Demand	Anodyne	MMP9	17	57
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc(O)cc2)ccc1O	ZINC000819360421	EF	On-Demand	Anodyne	MCHR1	17	44
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc(O)cc2)ccc1O	ZINC000819360423	EF	On-Demand	Anodyne	HDAC8	15	41
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc(O)cc2)ccc1O	ZINC000819360423	EF	On-Demand	Anodyne	MMP2	17	57
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc(O)cc2)ccc1O	ZINC000819360423	EF	On-Demand	Anodyne	MMP9	17	57
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc(O)cc2)ccc1O	ZINC000819360423	EF	On-Demand	Anodyne	MCHR1	17	44
CCOC(=O)c1cc(NC(=O)/C=C/c2cccc(O)c2)ccc1O	ZINC000819360470	EF	On-Demand	Anodyne	HDAC8	34	42
CCOC(=O)c1cc(NC(=O)/C=C/c2cccc(O)c2)ccc1O	ZINC000819360470	EF	On-Demand	Anodyne	MMP2	17	63
CCOC(=O)c1cc(NC(=O)/C=C/c2cccc(O)c2)ccc1O	ZINC000819360470	EF	On-Demand	Anodyne	HDAC6	17	42
CCOC(=O)c1cc(NC(=O)/C=C/c2cccc(O)c2)ccc1O	ZINC000819360470	EF	On-Demand	Anodyne	MMP9	17	63
CCOC(=O)c1cc(NC(=O)/C=C\c2cccc(O)c2)ccc1O	ZINC000819360471	EF	On-Demand	Anodyne	HDAC8	34	42
CCOC(=O)c1cc(NC(=O)/C=C\c2cccc(O)c2)ccc1O	ZINC000819360471	EF	On-Demand	Anodyne	MMP2	17	63
CCOC(=O)c1cc(NC(=O)/C=C\c2cccc(O)c2)ccc1O	ZINC000819360471	EF	On-Demand	Anodyne	HDAC6	17	42
CCOC(=O)c1cc(NC(=O)/C=C\c2cccc(O)c2)ccc1O	ZINC000819360471	EF	On-Demand	Anodyne	MMP9	17	63
CCOC(=O)c1cc(NC(=O)CCn2c(S)nc3ccccc3c2=O)ccc1O	ZINC000819360472	HF	On-Demand	Anodyne	CCKBR	17	43
CCOC(=O)c1cc(NC(=O)CCn2c(S)nc3ccccc3c2=O)ccc1O	ZINC000819360472	HF	On-Demand	Anodyne	IMDH_CRYPV	48	35
CCOC(=O)c1cc(NC(=O)Cn2c(S)nnc2-c2ccc(Cl)cc2)ccc1O	ZINC000819360474	IG	On-Demand	Anodyne	IMDH_CRYPV	25	44
O[C@H](CNCCC1CC(F)(F)C1)c1cccc(F)c1	ZINC000819360565	CF	On-Demand	Anodyne	ADRB1	20	42
O[C@H](CNCCC1CC(F)(F)C1)c1cccc(F)c1	ZINC000819360565	CF	On-Demand	Anodyne	ADRB3	28	42
O[C@@H](CNCCC1CC(F)(F)C1)c1cccc(F)c1	ZINC000819360568	CF	On-Demand	Anodyne	ADRB1	20	42
O[C@@H](CNCCC1CC(F)(F)C1)c1cccc(F)c1	ZINC000819360568	CF	On-Demand	Anodyne	ADRB3	28	42
CCOC(=O)c1cc(NC(=O)Cc2csc(NC(=O)Cc3cccs3)n2)ccc1O	ZINC000819360570	IG	On-Demand	Anodyne	CA5B	40	44
CCOC(=O)c1cc(NC(=O)Cc2csc(NC(=O)Cc3cccs3)n2)ccc1O	ZINC000819360570	IG	On-Demand	Anodyne	CA5A	41	44
C[C@]1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CCC(=O)N1	ZINC000819360584	CC	On-Demand	Bother	CACNA1D	52	33
C[C@@]1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CCC(=O)N1	ZINC000819360588	CC	On-Demand	Bother	CACNA1D	52	33
C[C@@]1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCC(=O)N1	ZINC000819360590	CC	On-Demand	Bother	CACNA1D	52	33
Cn1cnc(CCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819360593	CD	On-Demand	Anodyne	ADRB2	43	37
Cn1cnc(CCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819360593	CD	On-Demand	Anodyne	ADRB1	55	49
Cn1cnc(CCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819360593	CD	On-Demand	Anodyne	ADRB3	86	49
Cn1cnc(CCNC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819360593	CD	On-Demand	Anodyne	CYP3A4	40	33
C[C@]1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCC(=O)N1	ZINC000819360595	CC	On-Demand	Bother	CACNA1D	52	33
Cn1cnc(CCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819360600	CD	On-Demand	Anodyne	ADRB2	43	37
Cn1cnc(CCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819360600	CD	On-Demand	Anodyne	ADRB1	55	49
Cn1cnc(CCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819360600	CD	On-Demand	Anodyne	ADRB3	86	49
Cn1cnc(CCNC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819360600	CD	On-Demand	Anodyne	CYP3A4	40	33
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819360605	GF	On-Demand	Mild	ADRB1	39	41
O[C@@H](CNCC1(N2CCOCC2)CCOCC1)c1ccccc1	ZINC000819360606	DD	On-Demand	Anodyne	HCN1	40	40
O[C@H](CNCC1(N2CCOCC2)CCOCC1)c1ccccc1	ZINC000819360609	DD	On-Demand	Anodyne	HCN1	40	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819360620	GF	On-Demand	Mild	ADRB1	39	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)C1	ZINC000819360623	GF	On-Demand	Mild	ADRB1	39	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)COc2ccc(C#N)cc2)C1	ZINC000819360625	GF	On-Demand	Mild	ADRB1	39	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(C)(C)C2=CCCC2)CC1	ZINC000819360633	FH	On-Demand	Anodyne	GPR119	34	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(C)(C)C2=CCCC2)CC1	ZINC000819360634	FH	On-Demand	Anodyne	GPR119	34	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C(N)=O)C1	ZINC000819360642	GD	On-Demand	Anodyne	CTSD	105	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C(N)=O)C1	ZINC000819360642	GD	On-Demand	Anodyne	PGC	61	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C(N)=O)C1	ZINC000819360642	GD	On-Demand	Anodyne	PAPA1_CARPA	35	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C(N)=O)C1	ZINC000819360642	GD	On-Demand	Anodyne	CCKAR	43	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C(N)=O)C1	ZINC000819360642	GD	On-Demand	Anodyne	CTSL	18	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C(N)=O)C1	ZINC000819360642	GD	On-Demand	Anodyne	BACE2	55	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C(N)=O)C1	ZINC000819360642	GD	On-Demand	Anodyne	TACR3	15	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C(N)=O)C1	ZINC000819360642	GD	On-Demand	Anodyne	REN	89	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C(N)=O)C1	ZINC000819360642	GD	On-Demand	Anodyne	REN1	23	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C(N)=O)C1	ZINC000819360642	GD	On-Demand	Anodyne	BACE1	85	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C(N)=O)C1	ZINC000819360642	GD	On-Demand	Anodyne	FPR1	56	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C(N)=O)C1	ZINC000819360642	GD	On-Demand	Anodyne	PLM1_PLAFA	35	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819360645	GG	On-Demand	Anodyne	ADRB1	48	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819360648	GG	On-Demand	Anodyne	ADRB1	48	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819360650	GG	On-Demand	Anodyne	ADRB1	48	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819360652	GG	On-Demand	Anodyne	ADRB1	48	41
Cc1cnc(CCNC[C@H](O)c2ccccc2)cn1	ZINC000819360655	CD	On-Demand	Anodyne	ADRB2	39	49
Cc1cnc(CCNC[C@H](O)c2ccccc2)cn1	ZINC000819360655	CD	On-Demand	Anodyne	ADRB1	52	39
Cc1cnc(CCNC[C@H](O)c2ccccc2)cn1	ZINC000819360655	CD	On-Demand	Anodyne	ADRB3	101	50
Cc1cnc(CCNC[C@@H](O)c2ccccc2)cn1	ZINC000819360657	CD	On-Demand	Anodyne	ADRB2	39	49
Cc1cnc(CCNC[C@@H](O)c2ccccc2)cn1	ZINC000819360657	CD	On-Demand	Anodyne	ADRB1	52	39
Cc1cnc(CCNC[C@@H](O)c2ccccc2)cn1	ZINC000819360657	CD	On-Demand	Anodyne	ADRB3	101	50
O[C@H](CNCCC1CC(F)(F)C1)c1ccccc1	ZINC000819360711	CF	On-Demand	Anodyne	ADRB2	18	45
O[C@@H](CNCCC1CC(F)(F)C1)c1ccccc1	ZINC000819360714	CF	On-Demand	Anodyne	ADRB2	18	45
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CC[C@H](c2cccc(Cl)c2)C1	ZINC000819360748	GH	On-Demand	Anodyne	MDM2	50	35
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CC[C@@H](c2cccc(Cl)c2)C1	ZINC000819360749	GH	On-Demand	Anodyne	MDM2	50	35
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@@H]1CC[C@@H](c2cccc(Cl)c2)C1	ZINC000819360750	GH	On-Demand	Anodyne	MDM2	50	35
CC(C)(C)OC(=O)NCC[C@H](O)CN[C@H]1CC[C@H](c2cccc(Cl)c2)C1	ZINC000819360751	GH	On-Demand	Anodyne	MDM2	50	35
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819360766	FH	On-Demand	Anodyne	ACACB	15	43
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819360767	FH	On-Demand	Anodyne	ACACB	15	43
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819360768	FH	On-Demand	Anodyne	ACACB	15	43
CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819360769	FH	On-Demand	Anodyne	ACACB	15	43
C[S@@](=O)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819360793	GF	On-Demand	Mild	PAPA1_CARPA	56	51
C[S@@](=O)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819360793	GF	On-Demand	Mild	FURIN	56	34
C[S@@](=O)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819360793	GF	On-Demand	Mild	FPR1	44	38
C[S@](=O)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819360794	GF	On-Demand	Mild	PAPA1_CARPA	56	51
C[S@](=O)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819360794	GF	On-Demand	Mild	FURIN	56	34
C[S@](=O)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819360794	GF	On-Demand	Mild	FPR1	44	38
C[S@](=O)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819360795	GF	On-Demand	Mild	PAPA1_CARPA	56	51
C[S@](=O)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819360795	GF	On-Demand	Mild	FURIN	56	34
C[S@](=O)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819360795	GF	On-Demand	Mild	FPR1	44	38
C[S@@](=O)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819360796	GF	On-Demand	Mild	PAPA1_CARPA	56	51
C[S@@](=O)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819360796	GF	On-Demand	Mild	FURIN	56	34
C[S@@](=O)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819360796	GF	On-Demand	Mild	FPR1	44	38
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1cccc(Br)c1	ZINC000819360810	GF	On-Demand	Anodyne	ADRB1	40	37
CC(C)(C)OC(=O)NCC[C@H](O)CNCCc1cccc(Br)c1	ZINC000819360810	GF	On-Demand	Anodyne	PAPA1_CARPA	28	48
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1cccc(Br)c1	ZINC000819360811	GF	On-Demand	Anodyne	ADRB1	40	37
CC(C)(C)OC(=O)NCC[C@@H](O)CNCCc1cccc(Br)c1	ZINC000819360811	GF	On-Demand	Anodyne	PAPA1_CARPA	28	48
C[C@@H](CCCc1cccnc1)NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819360820	GH	On-Demand	Anodyne	GHRHR	40	32
C[C@@H](CCCc1cccnc1)NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819360820	GH	On-Demand	Anodyne	PTAFR	31	40
C[C@@H](CCCc1cccnc1)NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819360822	GH	On-Demand	Anodyne	GHRHR	40	32
C[C@@H](CCCc1cccnc1)NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819360822	GH	On-Demand	Anodyne	PTAFR	31	40
CCO[C@H]1C[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819360824	CE	On-Demand	Anodyne	SLC6A3	23	46
CCO[C@H]1C[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819360825	CE	On-Demand	Anodyne	SLC6A3	23	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2ccc3cncn3c2)CC1	ZINC000819360836	FE	On-Demand	Anodyne	GPR119	47	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2ccc3cncn3c2)CC1	ZINC000819360837	FE	On-Demand	Anodyne	GPR119	47	44
CCO[C@H]1C[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819360840	CF	On-Demand	Anodyne	ADRB3	17	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(Cc3ccccc3)[C@@H](C)C1)C2	ZINC000819360845	GG	On-Demand	Anodyne	SIGMAR1	22	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)[C@H](C)C1)C2	ZINC000819360846	GG	On-Demand	Anodyne	SIGMAR1	22	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(Cc3ccccc3)[C@H](C)C1)C2	ZINC000819360847	GG	On-Demand	Anodyne	SIGMAR1	22	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(Cc3ccccc3)[C@@H](C)C1)C2	ZINC000819360848	GG	On-Demand	Anodyne	SIGMAR1	22	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819360861	FH	On-Demand	Anodyne	ADRB1	43	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819360861	FH	On-Demand	Anodyne	ADRB3	59	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819360861	FH	On-Demand	Anodyne	CYP3A4	45	37
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819360862	FH	On-Demand	Anodyne	ADRB1	43	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819360862	FH	On-Demand	Anodyne	ADRB3	59	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819360862	FH	On-Demand	Anodyne	CYP3A4	45	37
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819360863	FH	On-Demand	Anodyne	ADRB1	43	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819360863	FH	On-Demand	Anodyne	ADRB3	59	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819360863	FH	On-Demand	Anodyne	CYP3A4	45	37
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819360864	FH	On-Demand	Anodyne	ADRB1	43	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819360864	FH	On-Demand	Anodyne	ADRB3	59	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819360864	FH	On-Demand	Anodyne	CYP3A4	45	37
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NCCC(=O)Nc2cccnc2)C1	ZINC000819360865	FF	On-Demand	Anodyne	NAMPT	17	48
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](NCCC(=O)Nc2cccnc2)C1	ZINC000819360866	FF	On-Demand	Anodyne	NAMPT	17	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NCCC(=O)Nc2cccnc2)C1	ZINC000819360867	FF	On-Demand	Anodyne	NAMPT	17	48
CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](NCCC(=O)Nc2cccnc2)C1	ZINC000819360868	FF	On-Demand	Anodyne	NAMPT	17	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(Cc2cccc(O)c2)CC1	ZINC000819360909	GD	On-Demand	Anodyne	HRH2	17	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CC[C@H](C(N)=O)C2)CC1	ZINC000819360914	FD	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CC[C@H](C(N)=O)C2)CC1	ZINC000819360915	FD	On-Demand	Anodyne	GPR119	26	41
C=CC(=O)Nc1cc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)ccc1F	ZINC000819360989	GF	On-Demand	Anodyne	TGM2	44	33
C=CC(=O)Nc1cc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)ccc1F	ZINC000819360989	GF	On-Demand	Anodyne	F13A1	75	41
C=CC(=O)Nc1cc(NC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)ccc1F	ZINC000819360990	GF	On-Demand	Anodyne	TGM2	44	33
C=CC(=O)Nc1cc(NC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)ccc1F	ZINC000819360990	GF	On-Demand	Anodyne	F13A1	75	41
CCOC(=O)c1cc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1O	ZINC000819361055	GG	On-Demand	Anodyne	EPHX2	31	44
CCOC(=O)c1cc(NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1O	ZINC000819361055	GG	On-Demand	Anodyne	GPR119	41	43
CC(=O)Nc1cccc(CC(=O)NC2CCC(N3CCCCC3)CC2)c1	ZINC000819361098	FG	On-Demand	Anodyne	CSNK2A1	16	41
CC(=O)Nc1cccc(CC(=O)NC2CCC(N3CCCCC3)CC2)c1	ZINC000819361098	FG	On-Demand	Anodyne	SIGMAR1	26	43
CC(=O)Nc1cccc(CC(=O)NC2CCC(N3CCCCC3)CC2)c1	ZINC000819361098	FG	On-Demand	Anodyne	CCR3	48	36
CC(=O)Nc1cccc(CC(=O)NC2CCC(N3CCCCC3)CC2)c1	ZINC000819361098	FG	On-Demand	Anodyne	EPHX2	29	48
CC(=O)Nc1cccc(CC(=O)NC2CCC(N3CCCCC3)CC2)c1	ZINC000819361098	FG	On-Demand	Anodyne	MCHR1	38	42
CC(=O)Nc1cccc(CC(=O)NC2CCC(N3CCCCC3)CC2)c1	ZINC000819361098	FG	On-Demand	Anodyne	L3MBTL3	93	39
CCOC(=O)c1cc(NC(=O)/C(C#N)=C\c2ccc(O)cc2)ccc1O	ZINC000819361099	FF	On-Demand	Reactive	CA12	18	57
CCOC(=O)c1cc(NC(=O)/C(C#N)=C\c2ccc(O)cc2)ccc1O	ZINC000819361099	FF	On-Demand	Reactive	CA9	15	57
CCOC(=O)c1cc(NC(=O)/C(C#N)=C/c2ccc(O)cc2)ccc1O	ZINC000819361102	FF	On-Demand	Reactive	CA12	18	57
CCOC(=O)c1cc(NC(=O)/C(C#N)=C/c2ccc(O)cc2)ccc1O	ZINC000819361102	FF	On-Demand	Reactive	CA9	15	57
CCOC(=O)c1cc(NC(=O)CCCn2cncn2)ccc1O	ZINC000819361114	DD	On-Demand	Anodyne	HIS3	58	35
CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1NS(=O)(=O)c1ccc(OCC)cc1	ZINC000819361120	JH	On-Demand	Anodyne	PRTN3	59	38
Cc1cnc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)cn1	ZINC000819361127	EF	On-Demand	Anodyne	ADRB3	29	43
Cc1cnc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cn1	ZINC000819361131	EF	On-Demand	Anodyne	ADRB3	29	43
CCOC(=O)c1cc(NC(=O)C[C@H](O)c2cccc(F)c2)ccc1O	ZINC000819361206	EF	On-Demand	Anodyne	SLC1A2	50	34
CCOC(=O)c1cc(NC(=O)C[C@@H](O)c2cccc(F)c2)ccc1O	ZINC000819361208	EF	On-Demand	Anodyne	SLC1A2	50	34
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc(C)nc2)ccc1O	ZINC000819361230	EF	On-Demand	Anodyne	MCHR1	17	41
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc(C)nc2)ccc1O	ZINC000819361231	EF	On-Demand	Anodyne	MCHR1	17	41
CCOC(=O)c1cc(NC(=O)Cn2c(S)nnc2-c2ccc(OC)cc2)ccc1O	ZINC000819361239	IF	On-Demand	Anodyne	ENPP1	60	33
CCOC(=O)c1cc(NC(=O)/C(C#N)=C\c2ccc(OCC)cc2)ccc1O	ZINC000819361289	GH	On-Demand	Reactive	DHODH	26	42
CCOC(=O)c1cc(NC(=O)/C(C#N)=C\c2ccc(OCC)cc2)ccc1O	ZINC000819361289	GH	On-Demand	Reactive	CA12	17	51
CCOC(=O)c1cc(NC(=O)/C(C#N)=C\c2ccc(OCC)cc2)ccc1O	ZINC000819361289	GH	On-Demand	Reactive	CA9	16	51
CCOC(=O)c1cc(NC(=O)/C(C#N)=C/c2ccc(OCC)cc2)ccc1O	ZINC000819361291	GH	On-Demand	Reactive	DHODH	26	42
CCOC(=O)c1cc(NC(=O)/C(C#N)=C/c2ccc(OCC)cc2)ccc1O	ZINC000819361291	GH	On-Demand	Reactive	CA12	17	51
CCOC(=O)c1cc(NC(=O)/C(C#N)=C/c2ccc(OCC)cc2)ccc1O	ZINC000819361291	GH	On-Demand	Reactive	CA9	16	51
Cn1ccnc1[C@@H]1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819361336	EF	On-Demand	Anodyne	ADRB1	22	40
Cn1ccnc1[C@@H]1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819361336	EF	On-Demand	Anodyne	ADRB3	38	43
Cn1ccnc1[C@@H]1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819361336	EF	On-Demand	Anodyne	CYP3A4	46	35
Cn1ccnc1[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819361337	EF	On-Demand	Anodyne	ADRB1	22	40
Cn1ccnc1[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819361337	EF	On-Demand	Anodyne	ADRB3	38	43
Cn1ccnc1[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819361337	EF	On-Demand	Anodyne	CYP3A4	46	35
Cn1ccnc1[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819361338	EF	On-Demand	Anodyne	ADRB1	22	40
Cn1ccnc1[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819361338	EF	On-Demand	Anodyne	ADRB3	38	43
Cn1ccnc1[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CCO1	ZINC000819361338	EF	On-Demand	Anodyne	CYP3A4	46	35
Cn1ccnc1[C@@H]1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819361339	EF	On-Demand	Anodyne	ADRB1	22	40
Cn1ccnc1[C@@H]1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819361339	EF	On-Demand	Anodyne	ADRB3	38	43
Cn1ccnc1[C@@H]1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCO1	ZINC000819361339	EF	On-Demand	Anodyne	CYP3A4	46	35
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819361385	FG	On-Demand	Anodyne	PAPA1_CARPA	21	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)Cc2ccc(F)cc2)C1	ZINC000819361386	FG	On-Demand	Anodyne	PAPA1_CARPA	21	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819361387	FG	On-Demand	Anodyne	PAPA1_CARPA	21	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)Cc2ccc(F)cc2)C1	ZINC000819361389	FG	On-Demand	Anodyne	PAPA1_CARPA	21	42
Cc1cccc([C@@H](C)NC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819361403	FH	On-Demand	Anodyne	GPR119	19	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819361408	GF	On-Demand	Anodyne	ACACB	16	46
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819361410	GF	On-Demand	Anodyne	ACACB	16	46
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819361412	GF	On-Demand	Anodyne	ACACB	16	46
CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](NCCS(=O)(=O)c2ccccc2)C1	ZINC000819361413	GF	On-Demand	Anodyne	ACACB	16	46
N#Cc1ccc([C@H](O)CN[C@H]2CC[C@@H](C(N)=O)C2)cc1	ZINC000819361423	CC	On-Demand	Mild	ADRB3	17	52
N#Cc1ccc([C@@H](O)CN[C@H]2CC[C@@H](C(N)=O)C2)cc1	ZINC000819361424	CC	On-Demand	Mild	ADRB3	17	52
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819361430	DD	On-Demand	Anodyne	ADRB3	25	43
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819361430	DD	On-Demand	Anodyne	CCR2	61	39
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819361432	DD	On-Demand	Anodyne	ADRB3	25	43
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819361432	DD	On-Demand	Anodyne	CCR2	61	39
CCOC(=O)c1cc(NC(=O)C2=NOC3(CCN(C(=O)OC(C)(C)C)CC3)C2)ccc1O	ZINC000819361452	IG	On-Demand	Anodyne	GPR119	21	53
CCOC(=O)c1cc(NC(=O)Cn2cccc(C(F)(F)F)c2=O)ccc1O	ZINC000819361460	GE	On-Demand	Anodyne	NR5A1	27	42
CCOC(=O)c1cc(NC(=O)CN2C(=O)N[C@](C)(c3ccc(OC)cc3)C2=O)ccc1O	ZINC000819361478	ID	On-Demand	Anodyne	ENPP1	55	31
CCOC(=O)c1cc(NC(=O)CN2C(=O)N[C@@](C)(c3ccc(OC)cc3)C2=O)ccc1O	ZINC000819361480	ID	On-Demand	Anodyne	ENPP1	55	31
CCOC(=O)c1cc(NC(=O)CCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])ccc1O	ZINC000819361493	HF	On-Demand	Bother	CACNA1D	50	35
C=C(C)C(C)(C)C(=O)N(C)CC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819361512	FG	On-Demand	Mild	OPRK1	30	40
C=C(C)C(C)(C)C(=O)N(C)CC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819361513	FG	On-Demand	Mild	OPRK1	30	40
O=C(Cc1nsc2ccccc12)N[C@H]1CCCc2[nH]ccc21	ZINC000819361588	DG	On-Demand	Anodyne	HTR2A	21	40
O=C(Cc1nsc2ccccc12)N[C@@H]1CCCc2[nH]ccc21	ZINC000819361589	DG	On-Demand	Anodyne	HTR2A	21	40
Cc1cnc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819361636	DD	On-Demand	Bother	ADRB3	78	38
Cc1cnc(CCNC[C@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819361636	DD	On-Demand	Bother	CACNA1D	54	32
Cc1cnc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819361637	DD	On-Demand	Bother	ADRB3	78	38
Cc1cnc(CCNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cn1	ZINC000819361637	DD	On-Demand	Bother	CACNA1D	54	32
Cc1cnc(CCNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	ZINC000819361648	FD	On-Demand	Anodyne	GPR119	50	42
Cc1cnc(CCNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	ZINC000819361649	FD	On-Demand	Anodyne	GPR119	50	42
O=[N+]([O-])c1cccc([C@@H](O)CNCC2(C3CCC3)CCC2)c1	ZINC000819361653	DG	On-Demand	Bother	CACNA1D	42	34
O=[N+]([O-])c1cccc([C@H](O)CNCC2(C3CCC3)CCC2)c1	ZINC000819361654	DG	On-Demand	Bother	CACNA1D	42	34
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819361696	BC	On-Demand	Anodyne	ADRB3	40	40
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819361696	BC	On-Demand	Anodyne	ACHP_LYMST	16	44
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccccc2)C1	ZINC000819361696	BC	On-Demand	Anodyne	Q8WSF8_APLCA	34	44
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819361697	BC	On-Demand	Anodyne	ADRB3	40	40
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819361697	BC	On-Demand	Anodyne	ACHP_LYMST	16	44
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819361697	BC	On-Demand	Anodyne	Q8WSF8_APLCA	34	44
CC[C@@H](NC(=O)C(F)=C1CCC1)c1cccc([N+](=O)[O-])c1	ZINC000819361708	CH	On-Demand	Bother	CACNA1D	48	32
O=C(C(F)=C1CCC1)N1CCN(Cc2cccc(O)c2)CC1	ZINC000819361718	DE	On-Demand	Anodyne	FAAH	22	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819361723	FH	On-Demand	Anodyne	ADRB3	22	44
CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000819361724	FH	On-Demand	Anodyne	ADRB3	22	44
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819361725	FH	On-Demand	Anodyne	ADRB3	22	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000819361726	FH	On-Demand	Anodyne	ADRB3	22	44
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000819361727	FH	On-Demand	Anodyne	ADRB3	22	44
CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819361728	FH	On-Demand	Anodyne	ADRB3	22	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000819361729	FH	On-Demand	Anodyne	ADRB3	22	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819361730	FH	On-Demand	Anodyne	ADRB3	22	44
COc1ccc([C@@H](NCCC(=O)Nc2ccc(N(C)C)cc2)c2ccco2)cc1	ZINC000819361743	GI	On-Demand	Anodyne	MTNR1B	16	43
CN(CC1CCN(C[C@H](O)c2ccccc2)CC1)C(=O)C(F)=C1CCC1	ZINC000819361771	FG	On-Demand	Anodyne	OPRK1	29	40
CN(CC1CCN(C[C@@H](O)c2ccccc2)CC1)C(=O)C(F)=C1CCC1	ZINC000819361772	FG	On-Demand	Anodyne	OPRK1	29	40
CCO[C@H]1C[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819361773	CD	On-Demand	Bother	CACNA1C	60	40
CCO[C@H]1C[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819361773	CD	On-Demand	Bother	CACNA1D	92	36
CCO[C@H]1C[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819361774	CD	On-Demand	Bother	CACNA1C	60	40
CCO[C@H]1C[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819361774	CD	On-Demand	Bother	CACNA1D	92	36
COCCCOc1cccc(NC(=O)[C@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)c1	ZINC000819361775	FF	On-Demand	Anodyne	EPHX2	19	40
COCCCOc1cccc(NC(=O)[C@@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)c1	ZINC000819361776	FF	On-Demand	Anodyne	EPHX2	19	40
CCO[C@H]1C[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819361801	DD	On-Demand	Anodyne	ADRB3	15	48
CCO[C@H]1C[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819361802	DD	On-Demand	Anodyne	ADRB3	15	48
CCO[C@H]1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819361835	CF	On-Demand	Anodyne	ADRB1	35	44
CCO[C@H]1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819361835	CF	On-Demand	Anodyne	ADRB3	54	46
CCO[C@H]1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819361835	CF	On-Demand	Anodyne	CYP3A4	45	34
CCO[C@H]1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819361836	CF	On-Demand	Anodyne	ADRB1	35	44
CCO[C@H]1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819361836	CF	On-Demand	Anodyne	ADRB3	54	46
CCO[C@H]1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819361836	CF	On-Demand	Anodyne	CYP3A4	45	34
COCCCOc1cccc(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819361849	DF	On-Demand	Anodyne	EPHX2	20	43
COCCCOc1cccc(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819361850	DF	On-Demand	Anodyne	EPHX2	20	43
COCCCOc1cccc(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819361851	DF	On-Demand	Anodyne	EPHX2	20	43
COCCCOc1cccc(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819361852	DF	On-Demand	Anodyne	EPHX2	20	43
O[C@@H](CNCCc1cccc(Br)c1)c1ccc(F)cn1	ZINC000819361866	EF	On-Demand	Anodyne	ADRB3	45	39
O[C@H](CNCCc1cccc(Br)c1)c1ccc(F)cn1	ZINC000819361867	EF	On-Demand	Anodyne	ADRB3	45	39
Cc1cnc(CCNC[C@H](O)c2cccc(F)c2)cn1	ZINC000819361876	CD	On-Demand	Anodyne	ADRB2	28	40
Cc1cnc(CCNC[C@H](O)c2cccc(F)c2)cn1	ZINC000819361876	CD	On-Demand	Anodyne	ADRB1	36	44
Cc1cnc(CCNC[C@H](O)c2cccc(F)c2)cn1	ZINC000819361876	CD	On-Demand	Anodyne	ADRB3	80	44
Cc1cnc(CCNC[C@@H](O)c2cccc(F)c2)cn1	ZINC000819361877	CD	On-Demand	Anodyne	ADRB2	28	40
Cc1cnc(CCNC[C@@H](O)c2cccc(F)c2)cn1	ZINC000819361877	CD	On-Demand	Anodyne	ADRB1	36	44
Cc1cnc(CCNC[C@@H](O)c2cccc(F)c2)cn1	ZINC000819361877	CD	On-Demand	Anodyne	ADRB3	80	44
Cc1cnc(CCNC[C@H](O)c2ccc(Cl)cc2)cn1	ZINC000819361979	CE	On-Demand	Anodyne	ADRB2	15	41
Cc1cnc(CCNC[C@H](O)c2ccc(Cl)cc2)cn1	ZINC000819361979	CE	On-Demand	Anodyne	ADRB1	22	40
Cc1cnc(CCNC[C@H](O)c2ccc(Cl)cc2)cn1	ZINC000819361979	CE	On-Demand	Anodyne	ADRB3	37	40
COc1ccc(OC)c([C@H](O)CNC[C@]2(C)CCC(=O)N2)c1	ZINC000819361993	DC	On-Demand	Anodyne	ADRB2	19	40
COc1ccc(OC)c([C@H](O)CNC[C@@]2(C)CCC(=O)N2)c1	ZINC000819361994	DC	On-Demand	Anodyne	ADRB2	19	40
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccc(F)c(Br)c2)C1	ZINC000819361998	ED	On-Demand	Anodyne	ADRB3	23	41
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccc(F)c(Br)c2)C1	ZINC000819361999	ED	On-Demand	Anodyne	ADRB3	23	41
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](NCCC(=O)Nc2cc(F)cc(F)c2)C1	ZINC000819362015	GH	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NCCC(=O)Nc2cc(F)cc(F)c2)C1	ZINC000819362016	GH	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NCCC(=O)Nc2cc(F)cc(F)c2)C1	ZINC000819362017	GH	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](NCCC(=O)Nc2cc(F)cc(F)c2)C1	ZINC000819362018	GH	On-Demand	Anodyne	CACNA1I	40	32
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819362021	CC	On-Demand	Bother	CACNA1C	42	36
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819362021	CC	On-Demand	Bother	ADRB3	25	40
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819362021	CC	On-Demand	Bother	CACNA1D	69	34
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819362022	CC	On-Demand	Bother	CACNA1C	42	36
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819362022	CC	On-Demand	Bother	ADRB3	25	40
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819362022	CC	On-Demand	Bother	CACNA1D	69	34
CC[C@@H](NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2)c1cccc([N+](=O)[O-])c1	ZINC000819362061	FF	On-Demand	Bother	CACNA1D	51	34
CC[C@H](NC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2)c1cccc([N+](=O)[O-])c1	ZINC000819362062	FF	On-Demand	Bother	CACNA1D	51	34
CC[C@H](NC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2)c1cccc([N+](=O)[O-])c1	ZINC000819362063	FF	On-Demand	Bother	CACNA1D	51	34
C[C@@H](CCCc1cccnc1)NCCS(C)(=O)=O	ZINC000819362096	CD	On-Demand	Anodyne	TBXAS1	45	48
C[C@@H](CCCc1cccnc1)NCCS(C)(=O)=O	ZINC000819362096	CD	On-Demand	Anodyne	PTAFR	37	47
Cn1cnc(CCNC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819362104	EE	On-Demand	Anodyne	ADRB3	19	43
Cn1cnc(CCNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819362105	EE	On-Demand	Anodyne	ADRB3	19	43
O=C(Nc1cnc2ccccc2c1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000819362114	GK	On-Demand	Anodyne	METAP1	46	39
O=C(Nc1cnc2ccccc2c1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000819362114	GK	On-Demand	Anodyne	PRNP	40	34
O=C(Nc1cnc2ccccc2c1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000819362114	GK	On-Demand	Anodyne	TACR3	17	45
O=C(Nc1cnc2ccccc2c1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000819362114	GK	On-Demand	Anodyne	CYP2C9	15	56
O=C(Nc1cnc2ccccc2c1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000819362114	GK	On-Demand	Anodyne	SHH	22	41
O=C(Nc1cnc2ccccc2c1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000819362114	GK	On-Demand	Anodyne	MT-CO2	40	37
O=C(Nc1cnc2ccccc2c1)c1cc(-c2ccccn2)nc2ccccc12	ZINC000819362114	GK	On-Demand	Anodyne	KCNK3	43	38
O=C(CCNCc1cc(F)c(N2CCOCC2)c(F)c1)Nc1ccccc1	ZINC000819362121	GF	On-Demand	Clean	PIK3CA	20	41
O=C(CCNCc1cc(F)c(N2CCOCC2)c(F)c1)Nc1ccccc1	ZINC000819362121	GF	On-Demand	Clean	MTOR	34	41
O=C(CCNCc1cc(F)c(N2CCOCC2)c(F)c1)Nc1ccccc1	ZINC000819362121	GF	On-Demand	Clean	EPHX2	25	44
O=C(CCNCc1cc(F)c(N2CCOCC2)c(F)c1)Nc1ccccc1	ZINC000819362121	GF	On-Demand	Clean	PIK3CG	17	41
O=C(CCNCc1cc(F)c(N2CCOCC2)c(F)c1)Nc1ccccc1	ZINC000819362121	GF	On-Demand	Clean	PIK3CB	16	43
O=C(CCNCc1cc(F)c(N2CCOCC2)c(F)c1)Nc1ccccc1	ZINC000819362121	GF	On-Demand	Clean	STAT6	47	32
Cc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1Br	ZINC000819362122	FG	On-Demand	Bother	CACNA1C	44	34
Cc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1Br	ZINC000819362122	FG	On-Demand	Bother	CACNA1D	67	34
Cc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1Br	ZINC000819362123	FG	On-Demand	Bother	CACNA1C	44	34
Cc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1Br	ZINC000819362123	FG	On-Demand	Bother	CACNA1D	67	34
Cc1cc(CNC[C@@H](O)CCNC(=O)OC(C)(C)C)ccc1Br	ZINC000819362134	GG	On-Demand	Anodyne	LEF	61	37
Cc1cc(CNC[C@H](O)CCNC(=O)OC(C)(C)C)ccc1Br	ZINC000819362135	GG	On-Demand	Anodyne	LEF	61	37
Cc1cc(CNC[C@H](O)c2ccc(F)cn2)ccc1Br	ZINC000819362139	EG	On-Demand	Anodyne	LEF	44	33
Cc1cc(CNC[C@@H](O)c2ccc(F)cn2)ccc1Br	ZINC000819362140	EG	On-Demand	Anodyne	LEF	44	33
CCO[C@H]1C[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819362156	BD	On-Demand	Anodyne	ADRB2	15	40
CCO[C@H]1C[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819362156	BD	On-Demand	Anodyne	ADRB1	22	40
CCO[C@H]1C[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819362156	BD	On-Demand	Anodyne	ADRB3	69	45
CCO[C@H]1C[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819362157	BD	On-Demand	Anodyne	ADRB2	15	40
CCO[C@H]1C[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819362157	BD	On-Demand	Anodyne	ADRB1	22	40
CCO[C@H]1C[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819362157	BD	On-Demand	Anodyne	ADRB3	69	45
COCCCOc1cccc(NC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)c1	ZINC000819362161	GF	On-Demand	Anodyne	EPHX2	21	42
COCCCOc1cccc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)c1	ZINC000819362162	GF	On-Demand	Anodyne	EPHX2	21	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819362181	GI	On-Demand	Anodyne	ACACB	17	46
CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819362183	GI	On-Demand	Anodyne	ACACB	17	46
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819362185	GI	On-Demand	Anodyne	ACACB	17	46
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)c2cccc3ccccc23)C1	ZINC000819362187	GI	On-Demand	Anodyne	ACACB	17	46
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819362192	FF	On-Demand	Mild	PAPA1_CARPA	52	49
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819362192	FF	On-Demand	Mild	CTSK	24	49
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819362192	FF	On-Demand	Mild	CTSL	20	48
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819362192	FF	On-Demand	Mild	CTSS	17	53
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819362192	FF	On-Demand	Mild	FPR1	41	38
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819362194	FF	On-Demand	Mild	PAPA1_CARPA	52	49
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819362194	FF	On-Demand	Mild	CTSK	24	49
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819362194	FF	On-Demand	Mild	CTSL	20	48
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819362194	FF	On-Demand	Mild	CTSS	17	53
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccncc1	ZINC000819362194	FF	On-Demand	Mild	FPR1	41	38
CCO[C@H]1C[C@@H](NCCC(=O)Nc2ccc(N(C)C)cc2)C1	ZINC000819362208	DE	On-Demand	Anodyne	TIMP3	50	41
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819362219	ED	On-Demand	Anodyne	ADRB3	24	40
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819362220	ED	On-Demand	Anodyne	ADRB3	24	40
CON(C)C(=O)CCNCc1ccc(Br)c(C)c1	ZINC000819362229	DE	On-Demand	Anodyne	LEF	62	37
Cn1cnc(CCNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819362250	FD	On-Demand	Anodyne	GPR119	44	41
Cn1cnc(CCNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819362253	FD	On-Demand	Anodyne	GPR119	44	41
Cc1cnc(CCNC[C@H](O)c2cccc(Cl)c2)cn1	ZINC000819362304	CE	On-Demand	Anodyne	ADRB2	49	40
Cc1cnc(CCNC[C@H](O)c2cccc(Cl)c2)cn1	ZINC000819362304	CE	On-Demand	Anodyne	ADRB1	69	52
Cc1cnc(CCNC[C@H](O)c2cccc(Cl)c2)cn1	ZINC000819362304	CE	On-Demand	Anodyne	ADRB3	105	52
Cc1cnc(CCNC[C@@H](O)c2cccc(Cl)c2)cn1	ZINC000819362305	CE	On-Demand	Anodyne	ADRB2	49	40
Cc1cnc(CCNC[C@@H](O)c2cccc(Cl)c2)cn1	ZINC000819362305	CE	On-Demand	Anodyne	ADRB1	69	52
Cc1cnc(CCNC[C@@H](O)c2cccc(Cl)c2)cn1	ZINC000819362305	CE	On-Demand	Anodyne	ADRB3	105	52
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819362318	ED	On-Demand	Anodyne	ADRB3	29	42
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819362320	ED	On-Demand	Anodyne	ADRB3	29	42
CNC(=O)c1cc(Oc2cc(C)ccc2NC(=O)/C=C\[C@H]2CCCO2)ccn1	ZINC000819362330	GG	On-Demand	Anodyne	RAF1	51	39
CNC(=O)c1cc(Oc2cc(C)ccc2NC(=O)/C=C\[C@@H]2CCCO2)ccn1	ZINC000819362334	GG	On-Demand	Anodyne	RAF1	51	39
CNC(=O)c1cc(Oc2cc(C)ccc2NC(=O)/C=C/[C@H]2CCCO2)ccn1	ZINC000819362336	GG	On-Demand	Anodyne	RAF1	51	39
CNC(=O)c1cc(Oc2cc(C)ccc2NC(=O)/C=C/[C@@H]2CCCO2)ccn1	ZINC000819362338	GG	On-Demand	Anodyne	RAF1	51	39
CC(C)c1nn(-c2ccccc2)cc1C(=O)NCc1cc(=O)c(O)cn1C	ZINC000819362339	FE	On-Demand	Anodyne	COMT	55	37
C[C@]1(CNC[C@H](O)c2cccc(Cl)c2)CCC(=O)N1	ZINC000819362346	CD	On-Demand	Anodyne	ADRB1	42	44
C[C@]1(CNC[C@H](O)c2cccc(Cl)c2)CCC(=O)N1	ZINC000819362346	CD	On-Demand	Anodyne	ADRB3	49	44
C[C@]1(CNC[C@H](O)c2cccc(Cl)c2)CCC(=O)N1	ZINC000819362346	CD	On-Demand	Anodyne	CYP3A4	44	34
C[C@@]1(CNC[C@H](O)c2cccc(Cl)c2)CCC(=O)N1	ZINC000819362348	CD	On-Demand	Anodyne	ADRB1	42	44
C[C@@]1(CNC[C@H](O)c2cccc(Cl)c2)CCC(=O)N1	ZINC000819362348	CD	On-Demand	Anodyne	ADRB3	49	44
C[C@@]1(CNC[C@H](O)c2cccc(Cl)c2)CCC(=O)N1	ZINC000819362348	CD	On-Demand	Anodyne	CYP3A4	44	34
C[C@@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCC(=O)N1	ZINC000819362350	CD	On-Demand	Anodyne	ADRB1	42	44
C[C@@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCC(=O)N1	ZINC000819362350	CD	On-Demand	Anodyne	ADRB3	49	44
C[C@@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCC(=O)N1	ZINC000819362350	CD	On-Demand	Anodyne	CYP3A4	44	34
C[C@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCC(=O)N1	ZINC000819362352	CD	On-Demand	Anodyne	ADRB1	42	44
C[C@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCC(=O)N1	ZINC000819362352	CD	On-Demand	Anodyne	ADRB3	49	44
C[C@]1(CNC[C@@H](O)c2cccc(Cl)c2)CCC(=O)N1	ZINC000819362352	CD	On-Demand	Anodyne	CYP3A4	44	34
NC(=O)[C@@H]1CC[C@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819362361	CD	On-Demand	Anodyne	ADRB3	29	40
NC(=O)[C@@H]1CC[C@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819362362	CD	On-Demand	Anodyne	ADRB3	29	40
CC[C@@H](NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2)c1cccc([N+](=O)[O-])c1	ZINC000819362365	GG	On-Demand	Bother	CACNA1D	53	34
CC[C@H](NC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2)c1cccc([N+](=O)[O-])c1	ZINC000819362368	GG	On-Demand	Bother	CACNA1D	53	34
CC[C@H](NC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2)c1cccc([N+](=O)[O-])c1	ZINC000819362371	GG	On-Demand	Bother	CACNA1D	53	34
C=CC(=O)Nc1cc(NC(=O)[C@H]2C[C@H]2NC(=O)OC(C)(C)C)ccc1F	ZINC000819362373	FF	On-Demand	Anodyne	TGM1	23	41
C=CC(=O)Nc1cc(NC(=O)[C@H]2C[C@H]2NC(=O)OC(C)(C)C)ccc1F	ZINC000819362373	FF	On-Demand	Anodyne	TGM2	35	47
C=CC(=O)Nc1cc(NC(=O)[C@H]2C[C@H]2NC(=O)OC(C)(C)C)ccc1F	ZINC000819362373	FF	On-Demand	Anodyne	F13A1	56	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCC(=O)N1	ZINC000819362378	GD	On-Demand	Anodyne	CTSD	93	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCC(=O)N1	ZINC000819362378	GD	On-Demand	Anodyne	PGC	57	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCC(=O)N1	ZINC000819362378	GD	On-Demand	Anodyne	PAPA1_CARPA	29	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCC(=O)N1	ZINC000819362378	GD	On-Demand	Anodyne	BACE2	37	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCC(=O)N1	ZINC000819362378	GD	On-Demand	Anodyne	TIMP3	40	31
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCC(=O)N1	ZINC000819362378	GD	On-Demand	Anodyne	REN	75	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCC(=O)N1	ZINC000819362378	GD	On-Demand	Anodyne	REN1	21	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCC(=O)N1	ZINC000819362378	GD	On-Demand	Anodyne	BACE1	80	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@]1(C)CCC(=O)N1	ZINC000819362378	GD	On-Demand	Anodyne	FPR1	49	39
O[C@@H](CN[C@@H]1C[C@H]1c1ccccc1F)c1ccccc1	ZINC000819362379	CG	On-Demand	Anodyne	MGAM	16	55
O[C@@H](CN[C@@H]1C[C@H]1c1ccccc1F)c1ccccc1	ZINC000819362379	CG	On-Demand	Anodyne	SI	16	55
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCC(=O)N1	ZINC000819362381	GD	On-Demand	Anodyne	CTSD	93	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCC(=O)N1	ZINC000819362381	GD	On-Demand	Anodyne	PGC	57	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCC(=O)N1	ZINC000819362381	GD	On-Demand	Anodyne	PAPA1_CARPA	29	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCC(=O)N1	ZINC000819362381	GD	On-Demand	Anodyne	BACE2	37	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCC(=O)N1	ZINC000819362381	GD	On-Demand	Anodyne	TIMP3	40	31
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCC(=O)N1	ZINC000819362381	GD	On-Demand	Anodyne	REN	75	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCC(=O)N1	ZINC000819362381	GD	On-Demand	Anodyne	REN1	21	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCC(=O)N1	ZINC000819362381	GD	On-Demand	Anodyne	BACE1	80	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@]1(C)CCC(=O)N1	ZINC000819362381	GD	On-Demand	Anodyne	FPR1	49	39
O[C@H](CN[C@@H]1C[C@H]1c1ccccc1F)c1ccccc1	ZINC000819362384	CG	On-Demand	Anodyne	MGAM	16	55
O[C@H](CN[C@@H]1C[C@H]1c1ccccc1F)c1ccccc1	ZINC000819362384	CG	On-Demand	Anodyne	SI	16	55
O[C@H](CNCC[C@@H]1C[C@H]2CC[C@H]1O2)c1cccnc1	ZINC000819362433	CD	On-Demand	Anodyne	ADRB2	21	42
O[C@H](CNCC[C@@H]1C[C@H]2CC[C@H]1O2)c1cccnc1	ZINC000819362433	CD	On-Demand	Anodyne	ADRB1	23	42
O[C@H](CNCC[C@@H]1C[C@H]2CC[C@H]1O2)c1cccnc1	ZINC000819362433	CD	On-Demand	Anodyne	ADRB3	91	46
O[C@@H](CNCC[C@H]1C[C@H]2CC[C@H]1O2)c1cccnc1	ZINC000819362434	CD	On-Demand	Anodyne	ADRB2	21	42
O[C@@H](CNCC[C@H]1C[C@H]2CC[C@H]1O2)c1cccnc1	ZINC000819362434	CD	On-Demand	Anodyne	ADRB1	23	42
O[C@@H](CNCC[C@H]1C[C@H]2CC[C@H]1O2)c1cccnc1	ZINC000819362434	CD	On-Demand	Anodyne	ADRB3	91	46
O[C@@H](CNCC[C@@H]1C[C@H]2CC[C@H]1O2)c1cccnc1	ZINC000819362435	CD	On-Demand	Anodyne	ADRB2	21	42
O[C@@H](CNCC[C@@H]1C[C@H]2CC[C@H]1O2)c1cccnc1	ZINC000819362435	CD	On-Demand	Anodyne	ADRB1	23	42
O[C@@H](CNCC[C@@H]1C[C@H]2CC[C@H]1O2)c1cccnc1	ZINC000819362435	CD	On-Demand	Anodyne	ADRB3	91	46
O[C@H](CNCC[C@H]1C[C@H]2CC[C@H]1O2)c1cccnc1	ZINC000819362436	CD	On-Demand	Anodyne	ADRB2	21	42
O[C@H](CNCC[C@H]1C[C@H]2CC[C@H]1O2)c1cccnc1	ZINC000819362436	CD	On-Demand	Anodyne	ADRB1	23	42
O[C@H](CNCC[C@H]1C[C@H]2CC[C@H]1O2)c1cccnc1	ZINC000819362436	CD	On-Demand	Anodyne	ADRB3	91	46
O=C(Cc1nsc2ccccc12)NC1CCC(N2CCCCC2)CC1	ZINC000819362452	FH	On-Demand	Anodyne	L3MBTL3	76	42
O[C@@H](CN[C@@H]1C[C@H]1c1ccccc1F)c1cccc(Cl)c1	ZINC000819362469	DH	On-Demand	Anodyne	ADRB1	26	41
O[C@@H](CN[C@@H]1C[C@H]1c1ccccc1F)c1cccc(Cl)c1	ZINC000819362469	DH	On-Demand	Anodyne	ADRB3	40	41
O[C@H](CN[C@@H]1C[C@H]1c1ccccc1F)c1cccc(Cl)c1	ZINC000819362470	DH	On-Demand	Anodyne	ADRB1	26	41
O[C@H](CN[C@@H]1C[C@H]1c1ccccc1F)c1cccc(Cl)c1	ZINC000819362470	DH	On-Demand	Anodyne	ADRB3	40	41
CS(=O)(=O)c1ccc([C@@H](O)CNCC2(Cc3cccc(Cl)c3)CC2)cc1	ZINC000819362492	GG	On-Demand	Anodyne	ADRB3	43	39
CS(=O)(=O)c1ccc([C@H](O)CNCC2(Cc3cccc(Cl)c3)CC2)cc1	ZINC000819362493	GG	On-Demand	Anodyne	ADRB3	43	39
Cc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)cc1	ZINC000819362538	GG	On-Demand	Anodyne	ADRB2	30	44
Cc1ccc(OC[C@H](O)CN[C@H]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)cc1	ZINC000819362538	GG	On-Demand	Anodyne	ADRB1	42	41
Cc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)cc1	ZINC000819362539	GG	On-Demand	Anodyne	ADRB2	30	44
Cc1ccc(OC[C@H](O)CN[C@@H]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)cc1	ZINC000819362539	GG	On-Demand	Anodyne	ADRB1	42	41
Cc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](CNC(=O)OC(C)(C)C)C2)cc1	ZINC000819362540	GG	On-Demand	Anodyne	ADRB2	30	44
Cc1ccc(OC[C@H](O)CN[C@H]2CC[C@H](CNC(=O)OC(C)(C)C)C2)cc1	ZINC000819362540	GG	On-Demand	Anodyne	ADRB1	42	41
Cc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](CNC(=O)OC(C)(C)C)C2)cc1	ZINC000819362541	GG	On-Demand	Anodyne	ADRB2	30	44
Cc1ccc(OC[C@H](O)CN[C@@H]2CC[C@H](CNC(=O)OC(C)(C)C)C2)cc1	ZINC000819362541	GG	On-Demand	Anodyne	ADRB1	42	41
O[C@@H](CNCCOCC1CCCC1)c1cccnc1	ZINC000819362542	CD	On-Demand	Anodyne	ADRB2	31	49
O[C@@H](CNCCOCC1CCCC1)c1cccnc1	ZINC000819362542	CD	On-Demand	Anodyne	ADRB1	43	54
O[C@@H](CNCCOCC1CCCC1)c1cccnc1	ZINC000819362542	CD	On-Demand	Anodyne	ADRB3	111	54
O[C@H](CNCCOCC1CCCC1)c1cccnc1	ZINC000819362543	CD	On-Demand	Anodyne	ADRB2	31	49
O[C@H](CNCCOCC1CCCC1)c1cccnc1	ZINC000819362543	CD	On-Demand	Anodyne	ADRB1	43	54
O[C@H](CNCCOCC1CCCC1)c1cccnc1	ZINC000819362543	CD	On-Demand	Anodyne	ADRB3	111	54
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819362563	GG	On-Demand	Anodyne	ADRB2	24	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819362565	GG	On-Demand	Anodyne	ADRB2	24	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)COc2ccccc2Cl)C1	ZINC000819362566	GG	On-Demand	Anodyne	ADRB2	24	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)COc2ccccc2Cl)C1	ZINC000819362567	GG	On-Demand	Anodyne	ADRB2	24	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819362577	GF	On-Demand	Anodyne	ADRB2	29	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819362577	GF	On-Demand	Anodyne	ADRB1	45	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819362579	GF	On-Demand	Anodyne	ADRB2	29	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819362579	GF	On-Demand	Anodyne	ADRB1	45	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819362581	GF	On-Demand	Anodyne	ADRB2	29	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819362581	GF	On-Demand	Anodyne	ADRB1	45	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819362583	GF	On-Demand	Anodyne	ADRB2	29	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NC[C@H](O)COc2ccc(F)cc2)C1	ZINC000819362583	GF	On-Demand	Anodyne	ADRB1	45	41
O=C(c1coc(=O)c2ccccc12)N1CCC(OC[C@@H]2CCCO2)CC1	ZINC000819362647	FF	On-Demand	Anodyne	L3MBTL3	34	40
O=C(c1coc(=O)c2ccccc12)N1CCC(OC[C@H]2CCCO2)CC1	ZINC000819362648	FF	On-Demand	Anodyne	L3MBTL3	34	40
COc1cccc([S@](=O)CC(=O)N2CCC(c3ccc(F)cc3)CC2)c1	ZINC000819362700	GG	On-Demand	Anodyne	CCR3	15	42
COc1cccc([S@@](=O)CC(=O)N2CCC(c3ccc(F)cc3)CC2)c1	ZINC000819362702	GG	On-Demand	Anodyne	CCR3	15	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC2CCC(C(F)F)CC2)CC1	ZINC000819362740	GG	On-Demand	Anodyne	GPR119	30	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC2CCC(C(F)F)CC2)CC1	ZINC000819362742	GG	On-Demand	Anodyne	GPR119	30	44
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000819362813	GJ	On-Demand	Anodyne	L3MBTL3	57	36
CNC(=O)c1cc(Oc2cc(C)ccc2NC(=O)C(F)=C2CCC2)ccn1	ZINC000819362827	FH	On-Demand	Anodyne	PYGL	25	42
CNC(=O)c1cc(Oc2cc(C)ccc2NC(=O)C(F)=C2CCC2)ccn1	ZINC000819362827	FH	On-Demand	Anodyne	RAF1	53	43
CNC(=O)c1cc(Oc2cc(C)ccc2NC(=O)C(F)=C2CCC2)ccn1	ZINC000819362827	FH	On-Demand	Anodyne	PYGM	29	42
O=C(CCc1cccc(OC(F)F)c1)NC1CCC(N2CCCCC2)CC1	ZINC000819362884	GI	On-Demand	Anodyne	HRH2	20	42
O=C(CCc1cccc(OC(F)F)c1)NC1CCC(N2CCCCC2)CC1	ZINC000819362884	GI	On-Demand	Anodyne	L3MBTL3	54	36
O=C(Nc1cnc2ccccc2c1)c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1Cl	ZINC000819362991	JK	On-Demand	Anodyne	AVPR2	36	42
O=C(Nc1cnc2ccccc2c1)c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1Cl	ZINC000819362991	JK	On-Demand	Anodyne	AVPR1A	15	40
O=C(Nc1cnc2ccccc2c1)c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1Cl	ZINC000819362991	JK	On-Demand	Anodyne	CYP11B2	21	43
O=C(Nc1cnc2ccccc2c1)c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1Cl	ZINC000819362991	JK	On-Demand	Anodyne	CPT1A	23	43
O=C(Nc1cnc2ccccc2c1)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1	ZINC000819362997	HI	On-Demand	Anodyne	OPRM1	20	41
O=C(Nc1cnc2ccccc2c1)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1	ZINC000819362997	HI	On-Demand	Anodyne	OPRD1	70	38
O=C(Nc1cnc2ccccc2c1)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1	ZINC000819362997	HI	On-Demand	Anodyne	HDAC8	16	53
O=C(Nc1cnc2ccccc2c1)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1	ZINC000819362997	HI	On-Demand	Anodyne	ABCB1B	17	40
O=C(Nc1cnc2ccccc2c1)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1	ZINC000819362997	HI	On-Demand	Anodyne	CFTR	95	58
O=C(Nc1cnc2ccccc2c1)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1	ZINC000819362997	HI	On-Demand	Anodyne	ADAM9	57	34
O[C@@H](CNCCOCC1CCCC1)c1cccc(Cl)c1	ZINC000819363022	CG	On-Demand	Anodyne	ADRB2	50	42
O[C@@H](CNCCOCC1CCCC1)c1cccc(Cl)c1	ZINC000819363022	CG	On-Demand	Anodyne	ADRB1	68	51
O[C@@H](CNCCOCC1CCCC1)c1cccc(Cl)c1	ZINC000819363022	CG	On-Demand	Anodyne	ADRB3	72	51
O[C@@H](CNCCOCC1CCCC1)c1cccc(Cl)c1	ZINC000819363022	CG	On-Demand	Anodyne	CYP3A4	40	33
O[C@H](CNCCOCC1CCCC1)c1cccc(Cl)c1	ZINC000819363025	CG	On-Demand	Anodyne	ADRB2	50	42
O[C@H](CNCCOCC1CCCC1)c1cccc(Cl)c1	ZINC000819363025	CG	On-Demand	Anodyne	ADRB1	68	51
O[C@H](CNCCOCC1CCCC1)c1cccc(Cl)c1	ZINC000819363025	CG	On-Demand	Anodyne	ADRB3	72	51
O[C@H](CNCCOCC1CCCC1)c1cccc(Cl)c1	ZINC000819363025	CG	On-Demand	Anodyne	CYP3A4	40	33
Cc1cnc(CCNC[C@H](O)c2cccnc2)cn1	ZINC000819363038	CD	On-Demand	Anodyne	ADRB2	35	48
Cc1cnc(CCNC[C@H](O)c2cccnc2)cn1	ZINC000819363038	CD	On-Demand	Anodyne	ADRB1	48	48
Cc1cnc(CCNC[C@H](O)c2cccnc2)cn1	ZINC000819363038	CD	On-Demand	Anodyne	ADRB3	134	50
Cc1cnc(CCNC[C@@H](O)c2cccnc2)cn1	ZINC000819363040	CD	On-Demand	Anodyne	ADRB2	35	48
Cc1cnc(CCNC[C@@H](O)c2cccnc2)cn1	ZINC000819363040	CD	On-Demand	Anodyne	ADRB1	48	48
Cc1cnc(CCNC[C@@H](O)c2cccnc2)cn1	ZINC000819363040	CD	On-Demand	Anodyne	ADRB3	134	50
C[C@@]1(CNC[C@H](O)c2cccnc2)CCC(=O)N1	ZINC000819363041	BC	On-Demand	Anodyne	ADRB2	23	40
C[C@@]1(CNC[C@H](O)c2cccnc2)CCC(=O)N1	ZINC000819363041	BC	On-Demand	Anodyne	ADRB1	24	41
C[C@@]1(CNC[C@H](O)c2cccnc2)CCC(=O)N1	ZINC000819363041	BC	On-Demand	Anodyne	ADRB3	94	43
C[C@]1(CNC[C@@H](O)c2cccnc2)CCC(=O)N1	ZINC000819363043	BC	On-Demand	Anodyne	ADRB2	23	40
C[C@]1(CNC[C@@H](O)c2cccnc2)CCC(=O)N1	ZINC000819363043	BC	On-Demand	Anodyne	ADRB1	24	41
C[C@]1(CNC[C@@H](O)c2cccnc2)CCC(=O)N1	ZINC000819363043	BC	On-Demand	Anodyne	ADRB3	94	43
C[C@]1(CNC[C@H](O)c2cccnc2)CCC(=O)N1	ZINC000819363044	BC	On-Demand	Anodyne	ADRB2	23	40
C[C@]1(CNC[C@H](O)c2cccnc2)CCC(=O)N1	ZINC000819363044	BC	On-Demand	Anodyne	ADRB1	24	41
C[C@]1(CNC[C@H](O)c2cccnc2)CCC(=O)N1	ZINC000819363044	BC	On-Demand	Anodyne	ADRB3	94	43
C[C@@]1(CNC[C@@H](O)c2cccnc2)CCC(=O)N1	ZINC000819363046	BC	On-Demand	Anodyne	ADRB2	23	40
C[C@@]1(CNC[C@@H](O)c2cccnc2)CCC(=O)N1	ZINC000819363046	BC	On-Demand	Anodyne	ADRB1	24	41
C[C@@]1(CNC[C@@H](O)c2cccnc2)CCC(=O)N1	ZINC000819363046	BC	On-Demand	Anodyne	ADRB3	94	43
O[C@H](CNCCC1CC(F)(F)C1)c1cccc(Cl)c1	ZINC000819363052	CG	On-Demand	Anodyne	ADRB1	48	47
O[C@H](CNCCC1CC(F)(F)C1)c1cccc(Cl)c1	ZINC000819363052	CG	On-Demand	Anodyne	ADRB3	60	49
O[C@@H](CNCCC1CC(F)(F)C1)c1cccc(Cl)c1	ZINC000819363053	CG	On-Demand	Anodyne	ADRB1	48	47
O[C@@H](CNCCC1CC(F)(F)C1)c1cccc(Cl)c1	ZINC000819363053	CG	On-Demand	Anodyne	ADRB3	60	49
C[C@]1(CNC[C@H](O)c2cccc(C(F)(F)F)c2)CCC(=O)N1	ZINC000819363058	DD	On-Demand	Anodyne	TACR1	15	42
C[C@@]1(CNC[C@H](O)c2cccc(C(F)(F)F)c2)CCC(=O)N1	ZINC000819363060	DD	On-Demand	Anodyne	TACR1	15	42
C[C@@]1(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)CCC(=O)N1	ZINC000819363062	DD	On-Demand	Anodyne	TACR1	15	42
C[C@]1(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)CCC(=O)N1	ZINC000819363064	DD	On-Demand	Anodyne	TACR1	15	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC2(C3CCC3)CCC2)CC1	ZINC000819363071	FH	On-Demand	Anodyne	GPR119	26	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC2(C3CCC3)CCC2)CC1	ZINC000819363073	FH	On-Demand	Anodyne	GPR119	26	42
Cc1cnc(CCNC[C@H](O)c2cccc(Br)c2)cn1	ZINC000819363075	EE	On-Demand	Anodyne	ADRB3	69	38
Cc1cnc(CCNC[C@@H](O)c2cccc(Br)c2)cn1	ZINC000819363077	EE	On-Demand	Anodyne	ADRB3	69	38
O=C(N[C@H]1CCN(CCCc2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819363115	EF	On-Demand	Anodyne	ACE	43	40
O=C(N[C@H]1CCN(CCCc2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819363115	EF	On-Demand	Anodyne	MME	21	40
O=C(N[C@H]1CCN(CCCc2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819363115	EF	On-Demand	Anodyne	BIRC2	41	37
O=C(N[C@@H]1CCN(CCCc2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819363116	EF	On-Demand	Anodyne	ACE	43	40
O=C(N[C@@H]1CCN(CCCc2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819363116	EF	On-Demand	Anodyne	MME	21	40
O=C(N[C@@H]1CCN(CCCc2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819363116	EF	On-Demand	Anodyne	BIRC2	41	37
Cc1cnc(CCNC[C@H](O)c2cccc(C(F)(F)F)c2)cn1	ZINC000819363146	EF	On-Demand	Anodyne	ADRB3	62	39
Cc1cnc(CCNC[C@@H](O)c2cccc(C(F)(F)F)c2)cn1	ZINC000819363148	EF	On-Demand	Anodyne	ADRB3	62	39
CC(=O)Nc1cccc(CC(=O)N2CCC(c3ccc(F)cc3)CC2)c1	ZINC000819363164	FH	On-Demand	Anodyne	TSHR	42	33
CC(=O)Nc1cccc(CC(=O)N2CCC(c3ccc(F)cc3)CC2)c1	ZINC000819363164	FH	On-Demand	Anodyne	SIGMAR1	15	50
CC(=O)Nc1cccc(CC(=O)N2CCC(c3ccc(F)cc3)CC2)c1	ZINC000819363164	FH	On-Demand	Anodyne	CCR1	36	48
CC(=O)Nc1cccc(CC(=O)N2CCC(c3ccc(F)cc3)CC2)c1	ZINC000819363164	FH	On-Demand	Anodyne	CCR3	82	43
CC(=O)Nc1cccc(CC(=O)N2CCC(c3ccc(F)cc3)CC2)c1	ZINC000819363164	FH	On-Demand	Anodyne	MLNR	41	44
CC(=O)Nc1cccc(CC(=O)N2CCC(c3ccc(F)cc3)CC2)c1	ZINC000819363164	FH	On-Demand	Anodyne	EPHX2	22	46
CC(=O)Nc1cccc(CC(=O)N2CCC(c3ccc(F)cc3)CC2)c1	ZINC000819363164	FH	On-Demand	Anodyne	MCHR1	38	46
O=C(CCc1cccc(OC(F)F)c1)N1CCC(c2ccc(F)cc2)CC1	ZINC000819363261	GJ	On-Demand	Anodyne	CCR1	27	43
O=C(CCc1cccc(OC(F)F)c1)N1CCC(c2ccc(F)cc2)CC1	ZINC000819363261	GJ	On-Demand	Anodyne	C3AR1	40	44
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000819363267	FG	On-Demand	Anodyne	HTR1D	42	40
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000819363267	FG	On-Demand	Anodyne	HTR1B	35	40
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000819363267	FG	On-Demand	Anodyne	CCR1	19	42
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000819363267	FG	On-Demand	Anodyne	MLNR	35	44
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000819363267	FG	On-Demand	Anodyne	KCNJ1	53	39
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(c2ccc(F)cc2)CC1	ZINC000819363267	FG	On-Demand	Anodyne	ETHR	45	32
C=C(C)C(C)(C)C(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000819363276	CI	On-Demand	Mild	CCR1	29	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@H]2c2ccccc2F)CC1	ZINC000819363304	GG	On-Demand	Anodyne	GPR119	43	55
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@H]2c2ccccc2F)CC1	ZINC000819363309	GG	On-Demand	Anodyne	GPR119	43	55
Cc1ccccc1[C@@H](O)CNCCOCC1CCCC1	ZINC000819363375	CF	On-Demand	Anodyne	ADRB1	24	40
O[C@@H](CNCC1(C2CCC2)CCC1)c1cccnc1	ZINC000819363404	CF	On-Demand	Anodyne	ADRB2	20	41
O[C@@H](CNCC1(C2CCC2)CCC1)c1cccnc1	ZINC000819363404	CF	On-Demand	Anodyne	ADRB1	22	42
O[C@@H](CNCC1(C2CCC2)CCC1)c1cccnc1	ZINC000819363404	CF	On-Demand	Anodyne	ADRB3	90	45
O[C@H](CNCC1(C2CCC2)CCC1)c1cccnc1	ZINC000819363406	CF	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNCC1(C2CCC2)CCC1)c1cccnc1	ZINC000819363406	CF	On-Demand	Anodyne	ADRB1	22	42
O[C@H](CNCC1(C2CCC2)CCC1)c1cccnc1	ZINC000819363406	CF	On-Demand	Anodyne	ADRB3	90	45
C[C@@H](CC(=O)N1CCC(c2ccc(F)cc2)CC1)n1cccn1	ZINC000819363425	DG	On-Demand	Anodyne	CCR1	31	46
Cc1cnc(CCNC[C@H](O)c2ccc(F)cc2)cn1	ZINC000819363440	CD	On-Demand	Anodyne	ADRB2	15	41
Cc1cnc(CCNC[C@@H](O)c2ccc(F)cc2)cn1	ZINC000819363443	CD	On-Demand	Anodyne	ADRB2	15	41
CC(=O)c1cccc(OC[C@@H](O)CNCC(C)(C)[C@@H]2COCC23OCCO3)c1	ZINC000819363445	GD	On-Demand	Anodyne	ADRB2	15	40
CC(=O)c1cccc(OC[C@H](O)CNCC(C)(C)[C@H]2COCC23OCCO3)c1	ZINC000819363452	GD	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CNCC1(Cc2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819363453	DG	On-Demand	Anodyne	ADRB2	22	42
O[C@@H](CNCC1(Cc2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819363453	DG	On-Demand	Anodyne	ADRB1	41	42
O[C@@H](CNCC1(Cc2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819363453	DG	On-Demand	Anodyne	ADRB3	105	42
O[C@H](CNCC1(Cc2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819363456	DG	On-Demand	Anodyne	ADRB2	22	42
O[C@H](CNCC1(Cc2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819363456	DG	On-Demand	Anodyne	ADRB1	41	42
O[C@H](CNCC1(Cc2cccc(Cl)c2)CC1)c1cccnc1	ZINC000819363456	DG	On-Demand	Anodyne	ADRB3	105	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@]2(C)CCC(=O)N2)CC1	ZINC000819363468	FD	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@]2(C)CCC(=O)N2)CC1	ZINC000819363470	FD	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@]2(C)CCC(=O)N2)CC1	ZINC000819363471	FD	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@]2(C)CCC(=O)N2)CC1	ZINC000819363473	FD	On-Demand	Anodyne	GPR119	26	40
Cc1cnc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)cn1	ZINC000819363474	DE	On-Demand	Anodyne	ADRB2	16	40
Cc1cnc(CCNC[C@H](O)c2ccc(Cl)c(F)c2)cn1	ZINC000819363474	DE	On-Demand	Anodyne	ADRB1	18	40
Cc1cnc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)cn1	ZINC000819363476	DE	On-Demand	Anodyne	ADRB2	16	40
Cc1cnc(CCNC[C@@H](O)c2ccc(Cl)c(F)c2)cn1	ZINC000819363476	DE	On-Demand	Anodyne	ADRB1	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1CCN(CCC(C)C)CC1)C2	ZINC000819363517	GF	On-Demand	Anodyne	CACNA1I	51	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1CCN(CCC(C)C)CC1)C2	ZINC000819363518	GF	On-Demand	Anodyne	CACNA1I	51	35
CC(=O)c1cccc(OC[C@H](O)CNCC(C)(C)[C@@H]2COCC23OCCO3)c1	ZINC000819363542	GD	On-Demand	Anodyne	ADRB2	15	40
CC(=O)c1cccc(OC[C@@H](O)CNCC(C)(C)[C@H]2COCC23OCCO3)c1	ZINC000819363543	GD	On-Demand	Anodyne	ADRB2	15	40
Cc1ncc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819363591	GF	On-Demand	Anodyne	CTSD	66	42
Cc1ncc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819363591	GF	On-Demand	Anodyne	PGC	54	37
Cc1ncc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819363591	GF	On-Demand	Anodyne	PAPA1_CARPA	29	42
Cc1ncc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819363591	GF	On-Demand	Anodyne	TACR3	15	41
Cc1ncc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819363591	GF	On-Demand	Anodyne	REN	76	45
Cc1ncc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819363591	GF	On-Demand	Anodyne	REN1	20	43
Cc1ncc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819363591	GF	On-Demand	Anodyne	BACE1	72	43
Cc1ncc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819363591	GF	On-Demand	Anodyne	FPR1	47	40
O=C(Cc1nsc2ccccc12)N1CCC(c2ccc(F)cc2)CC1	ZINC000819363592	FI	On-Demand	Anodyne	DRD2	18	41
O=C(Cc1nsc2ccccc12)N1CCC(c2ccc(F)cc2)CC1	ZINC000819363592	FI	On-Demand	Anodyne	CCR1	24	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC=C(c3ccc(Cl)cc3)CC1)C2	ZINC000819363619	GH	On-Demand	Anodyne	ADAM10	33	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC=C(c3ccc(Cl)cc3)CC1)C2	ZINC000819363620	GH	On-Demand	Anodyne	ADAM10	33	43
C[C@]1(CNC[C@H](O)c2ccccc2C(F)(F)F)CCC(=O)N1	ZINC000819363652	DD	On-Demand	Anodyne	ADRB2	20	41
C[C@@]1(CNC[C@H](O)c2ccccc2C(F)(F)F)CCC(=O)N1	ZINC000819363653	DD	On-Demand	Anodyne	ADRB2	20	41
C[C@@]1(CNC[C@@H](O)c2ccccc2C(F)(F)F)CCC(=O)N1	ZINC000819363654	DD	On-Demand	Anodyne	ADRB2	20	41
C[C@]1(CNC[C@@H](O)c2ccccc2C(F)(F)F)CCC(=O)N1	ZINC000819363655	DD	On-Demand	Anodyne	ADRB2	20	41
O[C@@H](CNCCOCC1CCCC1)c1ccc(OC(F)(F)F)cc1	ZINC000819363674	EG	On-Demand	Anodyne	ADRB1	23	40
O[C@H](CNCCOCC1CCCC1)c1ccc(OC(F)(F)F)cc1	ZINC000819363675	EG	On-Demand	Anodyne	ADRB1	23	40
C=CC(=O)Nc1cc(NC(=O)[C@@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)ccc1F	ZINC000819363744	FF	On-Demand	Anodyne	TGM2	43	33
C=CC(=O)Nc1cc(NC(=O)[C@@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)ccc1F	ZINC000819363744	FF	On-Demand	Anodyne	F13A1	70	41
C=CC(=O)Nc1cc(NC(=O)[C@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)ccc1F	ZINC000819363745	FF	On-Demand	Anodyne	TGM2	43	33
C=CC(=O)Nc1cc(NC(=O)[C@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)ccc1F	ZINC000819363745	FF	On-Demand	Anodyne	F13A1	70	41
O=C(NC1CCC(N2CCCCC2)CC1)C(F)=C1CCC1	ZINC000819363767	CG	On-Demand	Anodyne	L3MBTL3	63	38
Cc1cnc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cn1	ZINC000819363818	ED	On-Demand	Anodyne	ADRB2	33	40
Cc1cnc(CCNC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cn1	ZINC000819363818	ED	On-Demand	Anodyne	ADRB3	96	40
Cc1cnc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cn1	ZINC000819363819	ED	On-Demand	Anodyne	ADRB2	33	40
Cc1cnc(CCNC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cn1	ZINC000819363819	ED	On-Demand	Anodyne	ADRB3	96	40
COc1cccc([S@@](=O)CC(=O)NC2CCC(N3CCCCC3)CC2)c1	ZINC000819363825	GF	On-Demand	Anodyne	DRD4	40	31
COc1cccc([S@@](=O)CC(=O)NC2CCC(N3CCCCC3)CC2)c1	ZINC000819363825	GF	On-Demand	Anodyne	HRH3	18	41
COc1cccc([S@@](=O)CC(=O)NC2CCC(N3CCCCC3)CC2)c1	ZINC000819363825	GF	On-Demand	Anodyne	SIGMAR1	18	45
COc1cccc([S@@](=O)CC(=O)NC2CCC(N3CCCCC3)CC2)c1	ZINC000819363825	GF	On-Demand	Anodyne	MTNR1A	26	42
COc1cccc([S@@](=O)CC(=O)NC2CCC(N3CCCCC3)CC2)c1	ZINC000819363825	GF	On-Demand	Anodyne	MTNR1B	32	42
COc1cccc([S@@](=O)CC(=O)NC2CCC(N3CCCCC3)CC2)c1	ZINC000819363825	GF	On-Demand	Anodyne	L3MBTL3	49	35
O=C(CCc1ccccc1)N1CCCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819363838	EG	On-Demand	Anodyne	PREP	40	43
O=C(Cc1ccc(-n2cnnc2)cc1)NC1CCC(N2CCCCC2)CC1	ZINC000819363841	FF	On-Demand	Anodyne	SIGMAR1	17	43
O=C(Cc1ccc(-n2cnnc2)cc1)NC1CCC(N2CCCCC2)CC1	ZINC000819363841	FF	On-Demand	Anodyne	L3MBTL3	110	43
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(OC[C@@H]2CCCO2)CC1	ZINC000819363899	FD	On-Demand	Anodyne	KCNJ1	58	39
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(OC[C@H]2CCCO2)CC1	ZINC000819363900	FD	On-Demand	Anodyne	KCNJ1	58	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3ccccc3)[C@H]1C)C2	ZINC000819363930	FG	On-Demand	Anodyne	SLC6A3	37	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3ccccc3)[C@@H]1C)C2	ZINC000819363931	FG	On-Demand	Anodyne	SLC6A3	37	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3ccccc3)[C@@H]1C)C2	ZINC000819363932	FG	On-Demand	Anodyne	SLC6A3	37	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3ccccc3)[C@H]1C)C2	ZINC000819363933	FG	On-Demand	Anodyne	SLC6A3	37	44
O=C(NC1CCC(N2CCCCC2)CC1)c1coc(=O)c2ccccc12	ZINC000819364018	FG	On-Demand	Anodyne	CNR2	22	41
O=C(NC1CCC(N2CCCCC2)CC1)c1coc(=O)c2ccccc12	ZINC000819364018	FG	On-Demand	Anodyne	L3MBTL3	75	46
CC(C)(C)NC(=O)CN1CCC(CNC(=O)C(F)=C2CCC2)CC1	ZINC000819364044	EE	On-Demand	Anodyne	CACNA1H	17	40
CC(C)(C)NC(=O)CN1CCC(CNC(=O)C(F)=C2CCC2)CC1	ZINC000819364044	EE	On-Demand	Anodyne	CACNA1I	72	54
Cc1ccc(OC[C@H](O)CNCC(C)(C)[C@@H]2COCC23OCCO3)cc1	ZINC000819364053	FD	On-Demand	Anodyne	ADRB2	19	43
Cc1ccc(OC[C@@H](O)CNCC(C)(C)[C@H]2COCC23OCCO3)cc1	ZINC000819364054	FD	On-Demand	Anodyne	ADRB2	19	43
Cc1ccc(OC[C@H](O)CNCC(C)(C)[C@H]2COCC23OCCO3)cc1	ZINC000819364055	FD	On-Demand	Anodyne	ADRB2	19	43
Cc1ccc(OC[C@@H](O)CNCC(C)(C)[C@@H]2COCC23OCCO3)cc1	ZINC000819364056	FD	On-Demand	Anodyne	ADRB2	19	43
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364092	GH	On-Demand	Mild	F2	16	48
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364092	GH	On-Demand	Mild	PLG	20	48
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364092	GH	On-Demand	Mild	PRSS1	15	44
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364092	GH	On-Demand	Mild	GHRHR	40	33
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364092	GH	On-Demand	Mild	CELA1	23	43
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364092	GH	On-Demand	Mild	CMA1	31	40
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364092	GH	On-Demand	Mild	PAPA1_CARPA	44	45
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364092	GH	On-Demand	Mild	TRY1_BOVIN	25	48
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364092	GH	On-Demand	Mild	CTSL	15	45
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364092	GH	On-Demand	Mild	REN	45	35
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364092	GH	On-Demand	Mild	CTSS	15	45
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364092	GH	On-Demand	Mild	FPR1	46	36
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364093	GH	On-Demand	Mild	F2	16	48
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364093	GH	On-Demand	Mild	PLG	20	48
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364093	GH	On-Demand	Mild	PRSS1	15	44
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364093	GH	On-Demand	Mild	GHRHR	40	33
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364093	GH	On-Demand	Mild	CELA1	23	43
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364093	GH	On-Demand	Mild	CMA1	31	40
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364093	GH	On-Demand	Mild	PAPA1_CARPA	44	45
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364093	GH	On-Demand	Mild	TRY1_BOVIN	25	48
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364093	GH	On-Demand	Mild	CTSL	15	45
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364093	GH	On-Demand	Mild	REN	45	35
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364093	GH	On-Demand	Mild	CTSS	15	45
C[C@@H]1[C@@H](c2ccccc2)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819364093	GH	On-Demand	Mild	FPR1	46	36
Cc1ncc(CNC[C@@H](O)c2cccc(Cl)c2)o1	ZINC000819364124	CE	On-Demand	Anodyne	ADRB1	31	43
Cc1ncc(CNC[C@@H](O)c2cccc(Cl)c2)o1	ZINC000819364124	CE	On-Demand	Anodyne	ADRB3	44	43
Cc1ncc(CNC[C@H](O)c2cccc(Cl)c2)o1	ZINC000819364125	CE	On-Demand	Anodyne	ADRB1	31	43
Cc1ncc(CNC[C@H](O)c2cccc(Cl)c2)o1	ZINC000819364125	CE	On-Demand	Anodyne	ADRB3	44	43
Cc1ncc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)o1	ZINC000819364145	CD	On-Demand	Bother	CACNA1D	63	33
Cc1ncc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)o1	ZINC000819364146	CD	On-Demand	Bother	CACNA1D	63	33
Cc1ccccc1[C@@H](O)CNCC1(N2CCOCC2)CCOCC1	ZINC000819364189	ED	On-Demand	Anodyne	HCN1	58	42
Cc1ccccc1[C@@H](O)CNCC1(N2CCOCC2)CCOCC1	ZINC000819364189	ED	On-Demand	Anodyne	HCN4	48	31
CC(C)(C)OC(=O)N1CCC[C@@](O)(CN[C@@H]2C[C@H]2c2ccccc2F)CC1	ZINC000819364210	GG	On-Demand	Anodyne	GPR119	22	41
CC(C)(C)OC(=O)N1CCC[C@](O)(CN[C@@H]2C[C@H]2c2ccccc2F)CC1	ZINC000819364211	GG	On-Demand	Anodyne	GPR119	22	41
O=C(/C=C/[C@H]1CCCO1)N1CCCN(C(=O)CCc2ccccc2)CC1	ZINC000819364231	FE	On-Demand	Anodyne	PREP	52	39
O=C(/C=C\[C@H]1CCCO1)N1CCCN(C(=O)CCc2ccccc2)CC1	ZINC000819364232	FE	On-Demand	Anodyne	PREP	52	39
O=C(/C=C/[C@@H]1CCCO1)N1CCCN(C(=O)CCc2ccccc2)CC1	ZINC000819364233	FE	On-Demand	Anodyne	PREP	52	39
O=C(/C=C\[C@@H]1CCCO1)N1CCCN(C(=O)CCc2ccccc2)CC1	ZINC000819364234	FE	On-Demand	Anodyne	PREP	52	39
C=CC(=O)Nc1cc(NC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)ccc1F	ZINC000819364385	GJ	On-Demand	Anodyne	TGM2	43	35
C=CC(=O)Nc1cc(NC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)ccc1F	ZINC000819364385	GJ	On-Demand	Anodyne	F13A1	72	39
CC(C)[C@H](CNC(=O)C(F)=C1CCC1)c1cccnc1	ZINC000819364439	CG	On-Demand	Anodyne	KCNA5	24	47
O[C@@H](CNCC1(N2CCOCC2)CCOCC1)c1ccccc1F	ZINC000819364496	ED	On-Demand	Anodyne	HCN1	38	40
O[C@H](CNCC1(N2CCOCC2)CCOCC1)c1ccccc1F	ZINC000819364498	ED	On-Demand	Anodyne	HCN1	38	40
O[C@@H](CN[C@@H]1C[C@H]1c1ccccc1F)c1cccnc1	ZINC000819364520	CE	On-Demand	Anodyne	ADRB3	76	39
O[C@H](CN[C@@H]1C[C@H]1c1ccccc1F)c1cccnc1	ZINC000819364522	CE	On-Demand	Anodyne	ADRB3	76	39
O=C(NC1CCC(N2CCCCC2)CC1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819364524	GJ	On-Demand	Anodyne	L3MBTL3	43	34
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2nc(C(C)(C)C)n[nH]2)CC1	ZINC000819364542	GE	On-Demand	Anodyne	GPR119	28	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2nc(C(C)(C)C)n[nH]2)CC1	ZINC000819364544	GE	On-Demand	Anodyne	GPR119	28	42
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2ccc(F)cc2)CC1	ZINC000819364547	DG	On-Demand	Anodyne	CCR1	17	43
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2ccc(F)cc2)CC1	ZINC000819364549	DG	On-Demand	Anodyne	CCR1	17	43
O[C@@H](CNCC[C@@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819364558	CF	On-Demand	Anodyne	ADRB1	35	43
O[C@@H](CNCC[C@@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819364558	CF	On-Demand	Anodyne	ADRB3	45	43
O[C@@H](CNCC[C@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819364559	CF	On-Demand	Anodyne	ADRB1	35	43
O[C@@H](CNCC[C@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819364559	CF	On-Demand	Anodyne	ADRB3	45	43
O[C@H](CNCC[C@@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819364560	CF	On-Demand	Anodyne	ADRB1	35	43
O[C@H](CNCC[C@@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819364560	CF	On-Demand	Anodyne	ADRB3	45	43
O[C@H](CNCC[C@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819364561	CF	On-Demand	Anodyne	ADRB1	35	43
O[C@H](CNCC[C@H]1C[C@H]2CC[C@H]1O2)c1cccc(Cl)c1	ZINC000819364561	CF	On-Demand	Anodyne	ADRB3	45	43
CC(C)(C)NC(=O)CN1CCC(CNC(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819364575	FD	On-Demand	Anodyne	CACNA1I	58	52
CC(C)(C)NC(=O)CN1CCC(CNC(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819364576	FD	On-Demand	Anodyne	CACNA1I	58	52
CC(C)(C)NC(=O)CN1CCC(CNC(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819364577	FD	On-Demand	Anodyne	CACNA1I	58	52
CC(C)(C)NC(=O)CN1CCC(CNC(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819364578	FD	On-Demand	Anodyne	CACNA1I	58	52
C[C@@H]1CCCC[C@H]1C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000819364604	DH	On-Demand	Anodyne	L3MBTL3	65	38
C[C@@H]1CCCC[C@@H]1C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000819364606	DH	On-Demand	Anodyne	L3MBTL3	65	38
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2ccc(F)cc2)CC1	ZINC000819364612	DG	On-Demand	Anodyne	CCR1	17	43
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2ccc(F)cc2)CC1	ZINC000819364613	DG	On-Demand	Anodyne	CCR1	17	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1nccn1CCCc1ccccc1	ZINC000819364633	GG	On-Demand	Anodyne	REN	53	34
CC(C)[C@H](CNC(=O)/C=C\[C@@H]1CCCO1)c1cccnc1	ZINC000819364640	CF	On-Demand	Anodyne	KCNA5	21	41
CC(C)[C@H](CNC(=O)/C=C/[C@@H]1CCCO1)c1cccnc1	ZINC000819364641	CF	On-Demand	Anodyne	KCNA5	21	41
CC(C)[C@H](CNC(=O)/C=C/[C@H]1CCCO1)c1cccnc1	ZINC000819364642	CF	On-Demand	Anodyne	KCNA5	21	41
CC(C)[C@H](CNC(=O)/C=C\[C@H]1CCCO1)c1cccnc1	ZINC000819364643	CF	On-Demand	Anodyne	KCNA5	21	41
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccccc2CN2CCSCC2)C1	ZINC000819364726	GF	On-Demand	Anodyne	CCR3	26	48
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccccc2CN2CCSCC2)C1	ZINC000819364729	GF	On-Demand	Anodyne	CCR3	26	48
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819364732	GD	On-Demand	Anodyne	PIK3CA	18	41
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819364732	GD	On-Demand	Anodyne	MTOR	31	41
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819364732	GD	On-Demand	Anodyne	EPHX2	34	54
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819364732	GD	On-Demand	Anodyne	PIK3CG	18	41
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819364732	GD	On-Demand	Anodyne	L3MBTL3	61	38
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819364734	GD	On-Demand	Anodyne	PIK3CA	18	41
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819364734	GD	On-Demand	Anodyne	MTOR	31	41
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819364734	GD	On-Demand	Anodyne	EPHX2	34	54
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819364734	GD	On-Demand	Anodyne	PIK3CG	18	41
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(C(=O)N3CCOCC3)cc2)C1	ZINC000819364734	GD	On-Demand	Anodyne	L3MBTL3	61	38
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)C1	ZINC000819364741	GD	On-Demand	Anodyne	EPHX2	26	44
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(CC(=O)N3CCOCC3)cc2)C1	ZINC000819364744	GD	On-Demand	Anodyne	EPHX2	26	44
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccccn2)C1	ZINC000819364746	CD	On-Demand	Anodyne	GRIN2B	16	43
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccccn2)C1	ZINC000819364746	CD	On-Demand	Anodyne	MAP3K12	29	43
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccccn2)C1	ZINC000819364748	CD	On-Demand	Anodyne	GRIN2B	16	43
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccccn2)C1	ZINC000819364748	CD	On-Demand	Anodyne	MAP3K12	29	43
O=C(O)C[C@@H]1CCCN(C(=O)c2c[nH]c3cc(Cl)ccc23)C1	ZINC000819364750	DG	On-Demand	Anodyne	GRIN2B	15	41
O=C(O)C[C@H]1CCCN(C(=O)c2c[nH]c3cc(Cl)ccc23)C1	ZINC000819364752	DG	On-Demand	Anodyne	GRIN2B	15	41
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)CCCc2ccccc2)C1	ZINC000819364755	ED	On-Demand	Reactive	ACE	40	36
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)CCCc2ccccc2)C1	ZINC000819364755	ED	On-Demand	Reactive	FKBP1A	38	40
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)CCCc2ccccc2)C1	ZINC000819364755	ED	On-Demand	Reactive	GHRHR	40	34
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)CCCc2ccccc2)C1	ZINC000819364755	ED	On-Demand	Reactive	SIGMAR1	31	42
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)CCCc2ccccc2)C1	ZINC000819364755	ED	On-Demand	Reactive	PREP	91	47
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)CCCc2ccccc2)C1	ZINC000819364755	ED	On-Demand	Reactive	DPP7	25	42
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)CCCc2ccccc2)C1	ZINC000819364757	ED	On-Demand	Reactive	ACE	40	36
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)CCCc2ccccc2)C1	ZINC000819364757	ED	On-Demand	Reactive	FKBP1A	38	40
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)CCCc2ccccc2)C1	ZINC000819364757	ED	On-Demand	Reactive	GHRHR	40	34
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)CCCc2ccccc2)C1	ZINC000819364757	ED	On-Demand	Reactive	SIGMAR1	31	42
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)CCCc2ccccc2)C1	ZINC000819364757	ED	On-Demand	Reactive	PREP	91	47
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)CCCc2ccccc2)C1	ZINC000819364757	ED	On-Demand	Reactive	DPP7	25	42
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)C1	ZINC000819364764	GG	On-Demand	Anodyne	NPY2R	49	39
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)C1	ZINC000819364765	GG	On-Demand	Anodyne	NPY2R	49	39
O=C(O)C[C@@H]1CCCN(C(=O)NCc2noc(-c3cccs3)n2)C1	ZINC000819364766	FE	On-Demand	Anodyne	ETHR	36	41
O=C(O)C[C@H]1CCCN(C(=O)NCc2noc(-c3cccs3)n2)C1	ZINC000819364767	FE	On-Demand	Anodyne	ETHR	36	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1nccn1CCc1ccccc1	ZINC000819364768	GF	On-Demand	Anodyne	REN	59	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1nccn1CCc1ccccc1	ZINC000819364768	GF	On-Demand	Anodyne	FPR1	41	34
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(F)nc2)C1	ZINC000819364776	CD	On-Demand	Anodyne	CCR3	48	34
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(F)nc2)C1	ZINC000819364778	CD	On-Demand	Anodyne	CCR3	48	34
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819364792	GE	On-Demand	Anodyne	HRH3	16	40
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819364792	GE	On-Demand	Anodyne	CCR3	46	36
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819364792	GE	On-Demand	Anodyne	EPHX2	34	44
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819364792	GE	On-Demand	Anodyne	L3MBTL3	22	42
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819364793	GE	On-Demand	Anodyne	HRH3	16	40
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819364793	GE	On-Demand	Anodyne	CCR3	46	36
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819364793	GE	On-Demand	Anodyne	EPHX2	34	44
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(CCN3CCOCC3)cc2)C1	ZINC000819364793	GE	On-Demand	Anodyne	L3MBTL3	22	42
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(Cl)nn3)cc2)C1	ZINC000819364794	GH	On-Demand	Anodyne	EPHX2	16	48
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(Cl)nn3)cc2)C1	ZINC000819364798	GH	On-Demand	Anodyne	EPHX2	16	48
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(N3CCCNC3=O)c2)C1	ZINC000819364802	FE	On-Demand	Anodyne	CCR3	20	43
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(N3CCCNC3=O)c2)C1	ZINC000819364803	FE	On-Demand	Anodyne	CCR3	20	43
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)C1	ZINC000819364806	GF	On-Demand	Anodyne	EPHX2	22	47
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)C1	ZINC000819364811	GF	On-Demand	Anodyne	EPHX2	22	47
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(COCC3CC3)c2)C1	ZINC000819364813	EG	On-Demand	Anodyne	CCR3	33	51
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(COCC3CC3)c2)C1	ZINC000819364813	EG	On-Demand	Anodyne	P2RY14	42	33
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(COCC3CC3)c2)C1	ZINC000819364815	EG	On-Demand	Anodyne	CCR3	33	51
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(COCC3CC3)c2)C1	ZINC000819364815	EG	On-Demand	Anodyne	P2RY14	42	33
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc([C@H]3CNC(=O)C3)c2)C1	ZINC000819364817	EE	On-Demand	Anodyne	CCR3	18	43
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc([C@@H]3CNC(=O)C3)c2)C1	ZINC000819364819	EE	On-Demand	Anodyne	CCR3	18	43
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc([C@@H]3CNC(=O)C3)c2)C1	ZINC000819364821	EE	On-Demand	Anodyne	CCR3	18	43
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc([C@H]3CNC(=O)C3)c2)C1	ZINC000819364823	EE	On-Demand	Anodyne	CCR3	18	43
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364825	FF	On-Demand	Anodyne	F2	47	38
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364825	FF	On-Demand	Anodyne	ACE	41	45
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364825	FF	On-Demand	Anodyne	FKBP1A	64	42
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364825	FF	On-Demand	Anodyne	CELA1	28	65
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364825	FF	On-Demand	Anodyne	GRIN2B	22	42
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364825	FF	On-Demand	Anodyne	CTRA_BOVIN	54	32
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364825	FF	On-Demand	Anodyne	TRY1_BOVIN	56	34
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364825	FF	On-Demand	Anodyne	CTSG	41	32
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364825	FF	On-Demand	Anodyne	CPT1A	15	41
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364825	FF	On-Demand	Anodyne	CPT2	46	41
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364825	FF	On-Demand	Anodyne	PREP	160	76
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364825	FF	On-Demand	Anodyne	CELA2A	41	32
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364825	FF	On-Demand	Anodyne	LGMN	83	49
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364825	FF	On-Demand	Anodyne	KLK5	27	50
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364825	FF	On-Demand	Anodyne	WNT3	41	33
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364825	FF	On-Demand	Anodyne	SLC12A5	57	39
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364825	FF	On-Demand	Anodyne	TMPRSS11D	57	37
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364827	FF	On-Demand	Anodyne	F2	47	38
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364827	FF	On-Demand	Anodyne	ACE	41	45
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364827	FF	On-Demand	Anodyne	FKBP1A	64	42
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364827	FF	On-Demand	Anodyne	CELA1	28	65
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364827	FF	On-Demand	Anodyne	GRIN2B	22	42
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364827	FF	On-Demand	Anodyne	CTRA_BOVIN	54	32
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364827	FF	On-Demand	Anodyne	TRY1_BOVIN	56	34
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364827	FF	On-Demand	Anodyne	CTSG	41	32
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364827	FF	On-Demand	Anodyne	CPT1A	15	41
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364827	FF	On-Demand	Anodyne	CPT2	46	41
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364827	FF	On-Demand	Anodyne	PREP	160	76
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364827	FF	On-Demand	Anodyne	CELA2A	41	32
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364827	FF	On-Demand	Anodyne	LGMN	83	49
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364827	FF	On-Demand	Anodyne	KLK5	27	50
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364827	FF	On-Demand	Anodyne	WNT3	41	33
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364827	FF	On-Demand	Anodyne	SLC12A5	57	39
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)C1	ZINC000819364827	FF	On-Demand	Anodyne	TMPRSS11D	57	37
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)C1	ZINC000819364829	GE	On-Demand	Anodyne	EPHX2	34	44
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(C(=O)NC3CCOCC3)cc2)C1	ZINC000819364831	GE	On-Demand	Anodyne	EPHX2	34	44
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(N3CCOC3=O)cc2)C1	ZINC000819364833	EE	On-Demand	Anodyne	DGAT1	25	41
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(N3CCOC3=O)cc2)C1	ZINC000819364836	EE	On-Demand	Anodyne	DGAT1	25	41
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(N3CCOCC3)c(F)c2)C1	ZINC000819364860	FE	On-Demand	Anodyne	NPY2R	94	42
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(N3CCOCC3)c(F)c2)C1	ZINC000819364860	FE	On-Demand	Anodyne	EPHX2	21	42
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(N3CCOCC3)c(F)c2)C1	ZINC000819364860	FE	On-Demand	Anodyne	DGAT1	19	43
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(N3CCOCC3)c(F)c2)C1	ZINC000819364862	FE	On-Demand	Anodyne	NPY2R	94	42
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(N3CCOCC3)c(F)c2)C1	ZINC000819364862	FE	On-Demand	Anodyne	EPHX2	21	42
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(N3CCOCC3)c(F)c2)C1	ZINC000819364862	FE	On-Demand	Anodyne	DGAT1	19	43
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)C1	ZINC000819364869	FD	On-Demand	Anodyne	CCR3	37	47
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)C1	ZINC000819364871	FD	On-Demand	Anodyne	CCR3	37	47
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)c2ccccc2)C1	ZINC000819364882	DD	On-Demand	Reactive	SLC6A1	56	40
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)c2ccccc2)C1	ZINC000819364882	DD	On-Demand	Reactive	PREP	57	40
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)c2ccccc2)C1	ZINC000819364882	DD	On-Demand	Reactive	DPP7	40	42
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)c2ccccc2)C1	ZINC000819364884	DD	On-Demand	Reactive	SLC6A1	56	40
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)c2ccccc2)C1	ZINC000819364884	DD	On-Demand	Reactive	PREP	57	40
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)c2ccccc2)C1	ZINC000819364884	DD	On-Demand	Reactive	DPP7	40	42
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)C1	ZINC000819364900	FF	On-Demand	Anodyne	SIGMAR1	24	42
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)C1	ZINC000819364900	FF	On-Demand	Anodyne	CCR3	22	45
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)C1	ZINC000819364901	FF	On-Demand	Anodyne	SIGMAR1	24	42
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)C1	ZINC000819364901	FF	On-Demand	Anodyne	CCR3	22	45
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(N3CCCC3)nc2)C1	ZINC000819364902	EE	On-Demand	Anodyne	DGAT1	51	44
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(N3CCCC3)nc2)C1	ZINC000819364903	EE	On-Demand	Anodyne	DGAT1	51	44
O=C(O)C[C@@H]1CCCN(C(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC000819364904	DG	On-Demand	Anodyne	GRIN2D	55	32
O=C(O)C[C@H]1CCCN(C(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC000819364905	DG	On-Demand	Anodyne	GRIN2D	55	32
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(-n3cccc3)c2)C1	ZINC000819364908	EG	On-Demand	Anodyne	CCR3	24	47
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(-n3cccc3)c2)C1	ZINC000819364909	EG	On-Demand	Anodyne	CCR3	24	47
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCC(F)(F)F)nc2)C1	ZINC000819364910	FF	On-Demand	Anodyne	EPHX2	19	49
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCC(F)(F)F)nc2)C1	ZINC000819364911	FF	On-Demand	Anodyne	EPHX2	19	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3ccc(F)cc3)CC1)C2	ZINC000819364918	FG	On-Demand	Anodyne	PRCP	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3ccc(F)cc3)CC1)C2	ZINC000819364918	FG	On-Demand	Anodyne	ADAM10	23	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3ccc(F)cc3)CC1)C2	ZINC000819364919	FG	On-Demand	Anodyne	PRCP	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3ccc(F)cc3)CC1)C2	ZINC000819364919	FG	On-Demand	Anodyne	ADAM10	23	41
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)Cc2cccnc2)C1	ZINC000819364966	DC	On-Demand	Reactive	GRIN2B	17	44
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)Cc2cccnc2)C1	ZINC000819364966	DC	On-Demand	Reactive	CHRNA7	45	38
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)Cc2cccnc2)C1	ZINC000819364966	DC	On-Demand	Reactive	C3AR1	41	40
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)Cc2cccnc2)C1	ZINC000819364966	DC	On-Demand	Reactive	NAMPT	41	38
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)Cc2cccnc2)C1	ZINC000819364967	DC	On-Demand	Reactive	GRIN2B	17	44
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)Cc2cccnc2)C1	ZINC000819364967	DC	On-Demand	Reactive	CHRNA7	45	38
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)Cc2cccnc2)C1	ZINC000819364967	DC	On-Demand	Reactive	C3AR1	41	40
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)Cc2cccnc2)C1	ZINC000819364967	DC	On-Demand	Reactive	NAMPT	41	38
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccnc(N3CCOCC3)c2)C1	ZINC000819364968	FD	On-Demand	Anodyne	NOS2	60	34
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccnc(N3CCOCC3)c2)C1	ZINC000819364969	FD	On-Demand	Anodyne	NOS2	60	34
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364976	GG	On-Demand	Anodyne	ESR1	80	38
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364976	GG	On-Demand	Anodyne	SLC6A1	66	36
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364976	GG	On-Demand	Anodyne	ESR2	56	44
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364976	GG	On-Demand	Anodyne	PDGFRB	54	44
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364976	GG	On-Demand	Anodyne	LTA4H	77	49
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364976	GG	On-Demand	Anodyne	HRH3	79	54
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364976	GG	On-Demand	Anodyne	CCR3	15	43
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364976	GG	On-Demand	Anodyne	EPHX2	32	51
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364976	GG	On-Demand	Anodyne	PSMB2	47	43
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364976	GG	On-Demand	Anodyne	PSMB1	51	44
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364977	GG	On-Demand	Anodyne	ESR1	80	38
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364977	GG	On-Demand	Anodyne	SLC6A1	66	36
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364977	GG	On-Demand	Anodyne	ESR2	56	44
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364977	GG	On-Demand	Anodyne	PDGFRB	54	44
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364977	GG	On-Demand	Anodyne	LTA4H	77	49
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364977	GG	On-Demand	Anodyne	HRH3	79	54
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364977	GG	On-Demand	Anodyne	CCR3	15	43
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364977	GG	On-Demand	Anodyne	EPHX2	32	51
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364977	GG	On-Demand	Anodyne	PSMB2	47	43
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000819364977	GG	On-Demand	Anodyne	PSMB1	51	44
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccnc2Cl)C1	ZINC000819364982	CE	On-Demand	Anodyne	G2YM83_BOTF4	67	37
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccnc2Cl)C1	ZINC000819364983	CE	On-Demand	Anodyne	G2YM83_BOTF4	67	37
O=C(O)C[C@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000819364986	CE	On-Demand	Anodyne	ACE	42	40
O=C(O)C[C@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000819364986	CE	On-Demand	Anodyne	CELA1	20	43
O=C(O)C[C@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000819364986	CE	On-Demand	Anodyne	GRIN2B	40	41
O=C(O)C[C@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000819364986	CE	On-Demand	Anodyne	SIGMAR1	19	41
O=C(O)C[C@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000819364986	CE	On-Demand	Anodyne	PREP	70	45
O=C(O)C[C@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000819364986	CE	On-Demand	Anodyne	DPP7	55	39
O=C(O)C[C@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000819364986	CE	On-Demand	Anodyne	SLC12A5	50	39
O=C(O)C[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000819364987	CE	On-Demand	Anodyne	ACE	42	40
O=C(O)C[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000819364987	CE	On-Demand	Anodyne	CELA1	20	43
O=C(O)C[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000819364987	CE	On-Demand	Anodyne	GRIN2B	40	41
O=C(O)C[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000819364987	CE	On-Demand	Anodyne	SIGMAR1	19	41
O=C(O)C[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000819364987	CE	On-Demand	Anodyne	PREP	70	45
O=C(O)C[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000819364987	CE	On-Demand	Anodyne	DPP7	55	39
O=C(O)C[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000819364987	CE	On-Demand	Anodyne	SLC12A5	50	39
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819364988	FG	On-Demand	Anodyne	HRH3	28	44
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819364988	FG	On-Demand	Anodyne	CCR3	72	39
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819364988	FG	On-Demand	Anodyne	EPHX2	18	47
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819364989	FG	On-Demand	Anodyne	HRH3	28	44
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819364989	FG	On-Demand	Anodyne	CCR3	72	39
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(CCN3CCCCC3)cc2)C1	ZINC000819364989	FG	On-Demand	Anodyne	EPHX2	18	47
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)COCc2ccccc2)C1	ZINC000819364998	ED	On-Demand	Reactive	CELA1	19	40
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)COCc2ccccc2)C1	ZINC000819364998	ED	On-Demand	Reactive	GRIN2B	36	40
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)COCc2ccccc2)C1	ZINC000819364998	ED	On-Demand	Reactive	SIGMAR1	23	41
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)COCc2ccccc2)C1	ZINC000819364998	ED	On-Demand	Reactive	PREP	65	45
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)COCc2ccccc2)C1	ZINC000819364999	ED	On-Demand	Reactive	CELA1	19	40
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)COCc2ccccc2)C1	ZINC000819364999	ED	On-Demand	Reactive	GRIN2B	36	40
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)COCc2ccccc2)C1	ZINC000819364999	ED	On-Demand	Reactive	SIGMAR1	23	41
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)COCc2ccccc2)C1	ZINC000819364999	ED	On-Demand	Reactive	PREP	65	45
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)c2cc3ccccc3o2)C1	ZINC000819365002	ED	On-Demand	Reactive	PREP	25	41
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)c2cc3ccccc3o2)C1	ZINC000819365003	ED	On-Demand	Reactive	PREP	25	41
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(N3CCNC3=O)c2)C1	ZINC000819365008	ED	On-Demand	Anodyne	CCR3	32	45
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(N3CCNC3=O)c2)C1	ZINC000819365009	ED	On-Demand	Anodyne	CCR3	32	45
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccccc2C(=O)N2CCOCC2)C1	ZINC000819365012	GD	On-Demand	Anodyne	RBP4	49	41
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccccc2C(=O)N2CCOCC2)C1	ZINC000819365013	GD	On-Demand	Anodyne	RBP4	49	41
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(COCc3ccco3)c2)C1	ZINC000819365018	FH	On-Demand	Anodyne	CCR3	20	47
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(COCc3ccco3)c2)C1	ZINC000819365019	FH	On-Demand	Anodyne	CCR3	20	47
O=C(O)C[C@H]1CCCN(C(=O)NCc2nnc3n2CCCCC3)C1	ZINC000819365020	ED	On-Demand	Anodyne	DPP7	43	35
O=C(O)C[C@@H]1CCCN(C(=O)NCc2nnc3n2CCCCC3)C1	ZINC000819365021	ED	On-Demand	Anodyne	DPP7	43	35
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000819365022	GE	On-Demand	Anodyne	EPHX2	17	48
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000819365022	GE	On-Demand	Anodyne	F13A1	44	33
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000819365023	GE	On-Demand	Anodyne	EPHX2	17	48
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000819365023	GE	On-Demand	Anodyne	F13A1	44	33
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)C1	ZINC000819365030	GF	On-Demand	Anodyne	EPHX2	19	46
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2)C1	ZINC000819365031	GF	On-Demand	Anodyne	EPHX2	19	46
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)C1	ZINC000819365032	GF	On-Demand	Anodyne	EPHX2	19	46
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)C1	ZINC000819365033	GF	On-Demand	Anodyne	EPHX2	19	46
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCc3cccnc3)cc2)C1	ZINC000819365038	FG	On-Demand	Anodyne	PDGFRB	39	44
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCc3cccnc3)cc2)C1	ZINC000819365038	FG	On-Demand	Anodyne	GRIN2B	15	41
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCc3cccnc3)cc2)C1	ZINC000819365038	FG	On-Demand	Anodyne	CHRNA7	55	46
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCc3cccnc3)cc2)C1	ZINC000819365038	FG	On-Demand	Anodyne	ADAM17	22	42
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCc3cccnc3)cc2)C1	ZINC000819365038	FG	On-Demand	Anodyne	EPHX2	20	47
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCc3cccnc3)cc2)C1	ZINC000819365038	FG	On-Demand	Anodyne	ACHP_LYMST	23	42
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCc3cccnc3)cc2)C1	ZINC000819365038	FG	On-Demand	Anodyne	NAMPT	46	41
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCc3cccnc3)cc2)C1	ZINC000819365039	FG	On-Demand	Anodyne	PDGFRB	39	44
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCc3cccnc3)cc2)C1	ZINC000819365039	FG	On-Demand	Anodyne	GRIN2B	15	41
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCc3cccnc3)cc2)C1	ZINC000819365039	FG	On-Demand	Anodyne	CHRNA7	55	46
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCc3cccnc3)cc2)C1	ZINC000819365039	FG	On-Demand	Anodyne	ADAM17	22	42
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCc3cccnc3)cc2)C1	ZINC000819365039	FG	On-Demand	Anodyne	EPHX2	20	47
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCc3cccnc3)cc2)C1	ZINC000819365039	FG	On-Demand	Anodyne	ACHP_LYMST	23	42
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCc3cccnc3)cc2)C1	ZINC000819365039	FG	On-Demand	Anodyne	NAMPT	46	41
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)c2cccc3ccccc23)C1	ZINC000819365048	FE	On-Demand	Reactive	PREP	38	44
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)c2cccc3ccccc23)C1	ZINC000819365048	FE	On-Demand	Reactive	CASP1	16	40
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)c2cccc3ccccc23)C1	ZINC000819365048	FE	On-Demand	Reactive	DGAT1	15	43
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)c2cccc3ccccc23)C1	ZINC000819365049	FE	On-Demand	Reactive	PREP	38	44
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)c2cccc3ccccc23)C1	ZINC000819365049	FE	On-Demand	Reactive	CASP1	16	40
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)c2cccc3ccccc23)C1	ZINC000819365049	FE	On-Demand	Reactive	DGAT1	15	43
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819365056	GD	On-Demand	Anodyne	ITGAL	40	31
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819365056	GD	On-Demand	Anodyne	CCR3	26	44
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819365056	GD	On-Demand	Anodyne	EPHX2	32	52
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819365057	GD	On-Demand	Anodyne	ITGAL	40	31
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819365057	GD	On-Demand	Anodyne	CCR3	26	44
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)C1	ZINC000819365057	GD	On-Demand	Anodyne	EPHX2	32	52
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)C1	ZINC000819365064	GD	On-Demand	Anodyne	ACE	20	41
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)C1	ZINC000819365064	GD	On-Demand	Anodyne	CELA1	21	50
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)C1	ZINC000819365064	GD	On-Demand	Anodyne	PREP	112	58
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)C1	ZINC000819365064	GD	On-Demand	Anodyne	LGMN	68	40
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)C1	ZINC000819365064	GD	On-Demand	Anodyne	KLK5	23	41
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)C1	ZINC000819365064	GD	On-Demand	Anodyne	SLC12A5	46	37
O=C(O)C[C@@H]1CCCN(C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)C1	ZINC000819365064	GD	On-Demand	Anodyne	Q9NAW4_PLAFA	41	49
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)C1	ZINC000819365065	GD	On-Demand	Anodyne	ACE	20	41
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)C1	ZINC000819365065	GD	On-Demand	Anodyne	CELA1	21	50
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)C1	ZINC000819365065	GD	On-Demand	Anodyne	PREP	112	58
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)C1	ZINC000819365065	GD	On-Demand	Anodyne	LGMN	68	40
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)C1	ZINC000819365065	GD	On-Demand	Anodyne	KLK5	23	41
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)C1	ZINC000819365065	GD	On-Demand	Anodyne	SLC12A5	46	37
O=C(O)C[C@H]1CCCN(C(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)C1	ZINC000819365065	GD	On-Demand	Anodyne	Q9NAW4_PLAFA	41	49
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365066	FH	On-Demand	Anodyne	PDGFRB	22	43
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365066	FH	On-Demand	Anodyne	LTA4H	27	40
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365066	FH	On-Demand	Anodyne	CCR3	49	58
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365066	FH	On-Demand	Anodyne	ADAM17	22	40
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365066	FH	On-Demand	Anodyne	GYS1	41	36
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365066	FH	On-Demand	Anodyne	FAAH	26	44
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365066	FH	On-Demand	Anodyne	EPHX2	28	43
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365066	FH	On-Demand	Anodyne	DPP7	22	40
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365066	FH	On-Demand	Anodyne	FFAR1	47	38
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365066	FH	On-Demand	Anodyne	P2RY14	45	35
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365067	FH	On-Demand	Anodyne	PDGFRB	22	43
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365067	FH	On-Demand	Anodyne	LTA4H	27	40
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365067	FH	On-Demand	Anodyne	CCR3	49	58
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365067	FH	On-Demand	Anodyne	ADAM17	22	40
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365067	FH	On-Demand	Anodyne	GYS1	41	36
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365067	FH	On-Demand	Anodyne	FAAH	26	44
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365067	FH	On-Demand	Anodyne	EPHX2	28	43
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365067	FH	On-Demand	Anodyne	DPP7	22	40
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365067	FH	On-Demand	Anodyne	FFAR1	47	38
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(COc3ccccc3)c2)C1	ZINC000819365067	FH	On-Demand	Anodyne	P2RY14	45	35
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccn(CC(F)(F)F)c2=O)C1	ZINC000819365068	FE	On-Demand	Anodyne	RBP4	54	37
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccn(CC(F)(F)F)c2=O)C1	ZINC000819365068	FE	On-Demand	Anodyne	CALCRL	31	40
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccn(CC(F)(F)F)c2=O)C1	ZINC000819365069	FE	On-Demand	Anodyne	RBP4	54	37
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccn(CC(F)(F)F)c2=O)C1	ZINC000819365069	FE	On-Demand	Anodyne	CALCRL	31	40
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCc3ccccc3)nc2)C1	ZINC000819365074	FG	On-Demand	Anodyne	PDGFRB	26	40
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(OCc3ccccc3)nc2)C1	ZINC000819365074	FG	On-Demand	Anodyne	PREP	49	38
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCc3ccccc3)nc2)C1	ZINC000819365075	FG	On-Demand	Anodyne	PDGFRB	26	40
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(OCc3ccccc3)nc2)C1	ZINC000819365075	FG	On-Demand	Anodyne	PREP	49	38
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccnc2Oc2ccccc2)C1	ZINC000819365076	FH	On-Demand	Anodyne	P2RY1	43	39
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccnc2Oc2ccccc2)C1	ZINC000819365077	FH	On-Demand	Anodyne	P2RY1	43	39
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)c2cccc(OC(F)F)c2)C1	ZINC000819365078	FD	On-Demand	Reactive	DRD4	41	31
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)c2cccc(OC(F)F)c2)C1	ZINC000819365079	FD	On-Demand	Reactive	DRD4	41	31
O=C(O)C[C@H]1CCCN(C(=O)Nc2cnn(Cc3ccccn3)c2)C1	ZINC000819365080	EE	On-Demand	Anodyne	RPS6KA3	18	45
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cnn(Cc3ccccn3)c2)C1	ZINC000819365081	EE	On-Demand	Anodyne	RPS6KA3	18	45
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1	ZINC000819365084	GF	On-Demand	Anodyne	HRH3	17	45
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1	ZINC000819365084	GF	On-Demand	Anodyne	CCR3	74	38
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1	ZINC000819365085	GF	On-Demand	Anodyne	HRH3	17	45
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1	ZINC000819365085	GF	On-Demand	Anodyne	CCR3	74	38
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)c2c(Cl)cccc2Cl)C1	ZINC000819365088	FF	On-Demand	Reactive	PREP	33	43
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)c2c(Cl)cccc2Cl)C1	ZINC000819365088	FF	On-Demand	Reactive	L3MBTL3	42	34
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)c2c(Cl)cccc2Cl)C1	ZINC000819365089	FF	On-Demand	Reactive	PREP	33	43
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)c2c(Cl)cccc2Cl)C1	ZINC000819365089	FF	On-Demand	Reactive	L3MBTL3	42	34
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(COC3CCCC3)cc2)C1	ZINC000819365098	FH	On-Demand	Anodyne	EPHX2	19	48
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(COC3CCCC3)cc2)C1	ZINC000819365099	FH	On-Demand	Anodyne	EPHX2	19	48
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(N3CCCS3(=O)=O)c2)C1	ZINC000819365100	GD	On-Demand	Anodyne	CCR3	15	46
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(N3CCCS3(=O)=O)c2)C1	ZINC000819365101	GD	On-Demand	Anodyne	CCR3	15	46
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccccc2COc2ccccc2)C1	ZINC000819365104	FH	On-Demand	Anodyne	CCR3	17	44
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccccc2COc2ccccc2)C1	ZINC000819365105	FH	On-Demand	Anodyne	CCR3	17	44
O=C(O)C[C@H]1CCCN(C(=O)Nc2ncc(-c3ccccc3)s2)C1	ZINC000819365106	EH	On-Demand	Anodyne	CDK5	46	39
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ncc(-c3ccccc3)s2)C1	ZINC000819365107	EH	On-Demand	Anodyne	CDK5	46	39
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(C3SCCS3)c2)C1	ZINC000819365110	FH	On-Demand	Anodyne	CCR3	19	46
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(C3SCCS3)c2)C1	ZINC000819365111	FH	On-Demand	Anodyne	CCR3	19	46
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(CCC(F)(F)F)c2)C1	ZINC000819365122	FH	On-Demand	Anodyne	CCR3	42	49
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(CCC(F)(F)F)c2)C1	ZINC000819365122	FH	On-Demand	Anodyne	P2RY14	42	33
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(CCC(F)(F)F)c2)C1	ZINC000819365123	FH	On-Demand	Anodyne	CCR3	42	49
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(CCC(F)(F)F)c2)C1	ZINC000819365123	FH	On-Demand	Anodyne	P2RY14	42	33
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(CN3CCOC3=O)c2)C1	ZINC000819365124	FE	On-Demand	Anodyne	CCR3	34	46
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(CN3CCOC3=O)c2)C1	ZINC000819365125	FE	On-Demand	Anodyne	CCR3	34	46
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(N3CCCC3)c(Cl)c2)C1	ZINC000819365126	FH	On-Demand	Anodyne	KCNQ2	43	34
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(N3CCCC3)c(Cl)c2)C1	ZINC000819365126	FH	On-Demand	Anodyne	NPY2R	85	50
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(N3CCCC3)c(Cl)c2)C1	ZINC000819365126	FH	On-Demand	Anodyne	EPHX2	17	44
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(N3CCCC3)c(Cl)c2)C1	ZINC000819365127	FH	On-Demand	Anodyne	KCNQ2	43	34
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(N3CCCC3)c(Cl)c2)C1	ZINC000819365127	FH	On-Demand	Anodyne	NPY2R	85	50
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(N3CCCC3)c(Cl)c2)C1	ZINC000819365127	FH	On-Demand	Anodyne	EPHX2	17	44
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(CN3CCCCC3=O)c2)C1	ZINC000819365132	FF	On-Demand	Anodyne	CCR3	41	47
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(CN3CCCCC3=O)c2)C1	ZINC000819365132	FF	On-Demand	Anodyne	P2RY14	45	36
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(CN3CCCCC3=O)c2)C1	ZINC000819365133	FF	On-Demand	Anodyne	CCR3	41	47
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(CN3CCCCC3=O)c2)C1	ZINC000819365133	FF	On-Demand	Anodyne	P2RY14	45	36
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(N3CCCC3)c(F)c2)C1	ZINC000819365138	EG	On-Demand	Anodyne	NPY2R	108	44
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(N3CCCC3)c(F)c2)C1	ZINC000819365139	EG	On-Demand	Anodyne	NPY2R	108	44
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(N3CCCCC3)c2)C1	ZINC000819365140	EG	On-Demand	Anodyne	HTR1A	17	44
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(N3CCCCC3)c2)C1	ZINC000819365140	EG	On-Demand	Anodyne	CCR3	28	44
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(N3CCCCC3)c2)C1	ZINC000819365140	EG	On-Demand	Anodyne	ADAM10	27	40
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(N3CCCCC3)c2)C1	ZINC000819365141	EG	On-Demand	Anodyne	HTR1A	17	44
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(N3CCCCC3)c2)C1	ZINC000819365141	EG	On-Demand	Anodyne	CCR3	28	44
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(N3CCCCC3)c2)C1	ZINC000819365141	EG	On-Demand	Anodyne	ADAM10	27	40
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccccc2CN2CCOCC2)C1	ZINC000819365142	FE	On-Demand	Anodyne	CCR3	20	45
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccccc2CN2CCOCC2)C1	ZINC000819365143	FE	On-Demand	Anodyne	CCR3	20	45
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(-c3nnc4n3CCC4)c2)C1	ZINC000819365144	FF	On-Demand	Anodyne	CCR3	39	41
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(-c3nnc4n3CCC4)c2)C1	ZINC000819365144	FF	On-Demand	Anodyne	P2RY14	47	36
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(-c3nnc4n3CCC4)c2)C1	ZINC000819365144	FF	On-Demand	Anodyne	DGAT1	17	42
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(-c3nnc4n3CCC4)c2)C1	ZINC000819365145	FF	On-Demand	Anodyne	CCR3	39	41
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(-c3nnc4n3CCC4)c2)C1	ZINC000819365145	FF	On-Demand	Anodyne	P2RY14	47	36
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(-c3nnc4n3CCC4)c2)C1	ZINC000819365145	FF	On-Demand	Anodyne	DGAT1	17	42
O=C(O)C[C@H]1CCCN(C(=O)Nc2nnc(C3CC3)s2)C1	ZINC000819365148	DE	On-Demand	Anodyne	DGAT1	20	54
O=C(O)C[C@@H]1CCCN(C(=O)Nc2nnc(C3CC3)s2)C1	ZINC000819365149	DE	On-Demand	Anodyne	DGAT1	20	54
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccnc2OCc2ccccc2)C1	ZINC000819365154	FG	On-Demand	Anodyne	GRIN2B	24	42
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccnc2OCc2ccccc2)C1	ZINC000819365154	FG	On-Demand	Anodyne	PREP	43	33
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccnc2OCc2ccccc2)C1	ZINC000819365155	FG	On-Demand	Anodyne	GRIN2B	24	42
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccnc2OCc2ccccc2)C1	ZINC000819365155	FG	On-Demand	Anodyne	PREP	43	33
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(N3CCOCC3)c2)C1	ZINC000819365158	EE	On-Demand	Anodyne	CCR3	22	42
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(N3CCOCC3)c2)C1	ZINC000819365158	EE	On-Demand	Anodyne	EPHX2	22	41
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(N3CCOCC3)c2)C1	ZINC000819365159	EE	On-Demand	Anodyne	CCR3	22	42
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(N3CCOCC3)c2)C1	ZINC000819365159	EE	On-Demand	Anodyne	EPHX2	22	41
O=C(O)C[C@@H]1CCCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000819365162	ED	On-Demand	Anodyne	NOS2	116	44
O=C(O)C[C@H]1CCCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000819365163	ED	On-Demand	Anodyne	NOS2	116	44
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(Cn3cncn3)c2)C1	ZINC000819365168	EE	On-Demand	Anodyne	CCR3	36	46
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(Cn3cncn3)c2)C1	ZINC000819365168	EE	On-Demand	Anodyne	FAAH	16	40
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(Cn3cncn3)c2)C1	ZINC000819365168	EE	On-Demand	Anodyne	P2RY14	45	35
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(Cn3cncn3)c2)C1	ZINC000819365169	EE	On-Demand	Anodyne	CCR3	36	46
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(Cn3cncn3)c2)C1	ZINC000819365169	EE	On-Demand	Anodyne	FAAH	16	40
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(Cn3cncn3)c2)C1	ZINC000819365169	EE	On-Demand	Anodyne	P2RY14	45	35
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(N3CCCCC3)nc2)C1	ZINC000819365170	EF	On-Demand	Anodyne	DGAT1	51	45
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(N3CCCCC3)nc2)C1	ZINC000819365171	EF	On-Demand	Anodyne	DGAT1	51	45
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	ZINC000819365172	FC	On-Demand	Reactive	KCNJ1	47	36
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1	ZINC000819365173	FC	On-Demand	Reactive	KCNJ1	47	36
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(SC(F)F)c2)C1	ZINC000819365176	EH	On-Demand	Anodyne	CCR3	25	44
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(SC(F)F)c2)C1	ZINC000819365177	EH	On-Demand	Anodyne	CCR3	25	44
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(CN3CCCC3=O)c2)C1	ZINC000819365180	FF	On-Demand	Anodyne	CCR3	31	48
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccc(CN3CCCC3=O)c2)C1	ZINC000819365180	FF	On-Demand	Anodyne	P2RY14	45	36
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(CN3CCCC3=O)c2)C1	ZINC000819365181	FF	On-Demand	Anodyne	CCR3	31	48
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccc(CN3CCCC3=O)c2)C1	ZINC000819365181	FF	On-Demand	Anodyne	P2RY14	45	36
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(CC(F)(F)F)cc2)C1	ZINC000819365184	EH	On-Demand	Anodyne	CCR3	23	41
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(CC(F)(F)F)cc2)C1	ZINC000819365184	EH	On-Demand	Anodyne	EPHX2	40	42
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(CC(F)(F)F)cc2)C1	ZINC000819365185	EH	On-Demand	Anodyne	CCR3	23	41
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(CC(F)(F)F)cc2)C1	ZINC000819365185	EH	On-Demand	Anodyne	EPHX2	40	42
O=C(O)C[C@H]1CCCN(C(=O)Nc2cccnn2)C1	ZINC000819365188	CD	On-Demand	Anodyne	FAAH	23	42
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cccnn2)C1	ZINC000819365189	CD	On-Demand	Anodyne	FAAH	23	42
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000819365198	FE	On-Demand	Reactive	CACNA1B	42	34
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000819365198	FE	On-Demand	Reactive	CCR2	110	48
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000819365198	FE	On-Demand	Reactive	LIPG	48	35
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000819365198	FE	On-Demand	Reactive	SFRP1	66	34
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000819365199	FE	On-Demand	Reactive	CACNA1B	42	34
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000819365199	FE	On-Demand	Reactive	CCR2	110	48
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000819365199	FE	On-Demand	Reactive	LIPG	48	35
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000819365199	FE	On-Demand	Reactive	SFRP1	66	34
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)c2cccc3cccnc23)C1	ZINC000819365202	FD	On-Demand	Reactive	HCRTR1	19	44
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)c2cccc3cccnc23)C1	ZINC000819365203	FD	On-Demand	Reactive	HCRTR1	19	44
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(SC(F)F)cc2)C1	ZINC000819365206	EH	On-Demand	Anodyne	EPHX2	15	49
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(SC(F)F)cc2)C1	ZINC000819365207	EH	On-Demand	Anodyne	EPHX2	15	49
O=C(O)C[C@H]1CCCN(C(=O)Nc2nnc(Cc3ccccc3)s2)C1	ZINC000819365208	FF	On-Demand	Anodyne	DGAT1	21	57
O=C(O)C[C@@H]1CCCN(C(=O)Nc2nnc(Cc3ccccc3)s2)C1	ZINC000819365209	FF	On-Demand	Anodyne	DGAT1	21	57
O=C(O)C[C@H]1CCCN(C(=O)Nc2cc(C(F)(F)F)cnc2O)C1	ZINC000819365212	EF	On-Demand	Anodyne	RBP4	52	33
O=C(O)C[C@@H]1CCCN(C(=O)Nc2cc(C(F)(F)F)cnc2O)C1	ZINC000819365213	EF	On-Demand	Anodyne	RBP4	52	33
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(N3CCSCC3)cc2)C1	ZINC000819365218	FF	On-Demand	Anodyne	EPHX2	17	47
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(N3CCSCC3)cc2)C1	ZINC000819365219	FF	On-Demand	Anodyne	EPHX2	17	47
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)c2ccc3ccccc3c2)C1	ZINC000819365220	FE	On-Demand	Reactive	DRD4	15	46
O=C(O)C[C@H]1CCCN(C(=O)NNC(=O)c2ccc3ccccc3c2)C1	ZINC000819365220	FE	On-Demand	Reactive	CCR3	20	42
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)c2ccc3ccccc3c2)C1	ZINC000819365221	FE	On-Demand	Reactive	DRD4	15	46
O=C(O)C[C@@H]1CCCN(C(=O)NNC(=O)c2ccc3ccccc3c2)C1	ZINC000819365221	FE	On-Demand	Reactive	CCR3	20	42
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)C1	ZINC000819365230	FH	On-Demand	Anodyne	PDGFRB	36	43
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)C1	ZINC000819365230	FH	On-Demand	Anodyne	CCR3	55	35
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)C1	ZINC000819365230	FH	On-Demand	Anodyne	S1PR2	26	40
O=C(O)C[C@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)C1	ZINC000819365230	FH	On-Demand	Anodyne	EPHX2	19	48
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)C1	ZINC000819365231	FH	On-Demand	Anodyne	PDGFRB	36	43
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)C1	ZINC000819365231	FH	On-Demand	Anodyne	CCR3	55	35
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)C1	ZINC000819365231	FH	On-Demand	Anodyne	S1PR2	26	40
O=C(O)C[C@@H]1CCCN(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)C1	ZINC000819365231	FH	On-Demand	Anodyne	EPHX2	19	48
CC#CC(=O)Nc1ccc(O)c(C(=O)OCC)c1	ZINC000819365241	BD	On-Demand	Mild	CA1	19	42
C=CCSc1ccccc1C(=O)Nc1ccc(O)c(C(=O)OCC)c1	ZINC000819365256	FI	On-Demand	Mild	KCNK3	50	37
C=CCSc1ccccc1C(=O)Nc1ccc(O)c(C(=O)OCC)c1	ZINC000819365256	FI	On-Demand	Mild	KCNK9	51	37
CCOC(=O)c1cc(NC(=O)COc2ccc(C=O)cc2OC)ccc1O	ZINC000819365258	FE	On-Demand	Anodyne	ENPP1	71	35
C#CCOc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365263	EF	On-Demand	Mild	PRNP	27	42
C#CCOc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365263	EF	On-Demand	Mild	PLAU	16	44
C#CCOc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365263	EF	On-Demand	Mild	ACR	44	35
C#CCOc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365263	EF	On-Demand	Mild	KCNK3	49	35
CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365268	GE	On-Demand	Anodyne	CA2	38	47
CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365268	GE	On-Demand	Anodyne	CA1	29	46
CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365268	GE	On-Demand	Anodyne	KCNA5	15	41
CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365268	GE	On-Demand	Anodyne	CA7	28	46
CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365268	GE	On-Demand	Anodyne	CA4	24	44
CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365268	GE	On-Demand	Anodyne	CA14	21	46
CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365268	GE	On-Demand	Anodyne	CA12	20	46
CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365268	GE	On-Demand	Anodyne	CA9	25	47
CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365268	GE	On-Demand	Anodyne	CYNT	23	42
CCNS(=O)(=O)c1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365268	GE	On-Demand	Anodyne	KCNK3	42	33
C=CCOc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1OC	ZINC000819365281	FG	On-Demand	Mild	CPT1A	41	33
C=CCOc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1OC	ZINC000819365281	FG	On-Demand	Mild	ENPP1	68	33
C=CCOc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1OC	ZINC000819365281	FG	On-Demand	Mild	KCNK3	54	38
C=CCOc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1OC	ZINC000819365281	FG	On-Demand	Mild	KCNK9	50	38
CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1NS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819365289	JD	On-Demand	Anodyne	CA2	87	46
CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1NS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819365289	JD	On-Demand	Anodyne	CA1	76	44
CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1NS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819365289	JD	On-Demand	Anodyne	CA7	50	37
CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1NS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819365289	JD	On-Demand	Anodyne	CA4	81	46
CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1NS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819365289	JD	On-Demand	Anodyne	PRTN3	51	33
CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1NS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819365289	JD	On-Demand	Anodyne	CA12	45	38
CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1NS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819365289	JD	On-Demand	Anodyne	CA9	53	40
CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1NS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819365289	JD	On-Demand	Anodyne	CYNT	55	44
CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1NS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819365289	JD	On-Demand	Anodyne	P96878_MYCTU	43	38
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc(OC)cc2)ccc1O	ZINC000819365334	EG	On-Demand	Anodyne	DHODH	16	40
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc(OC)cc2)ccc1O	ZINC000819365334	EG	On-Demand	Anodyne	HDAC8	17	46
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc(OC)cc2)ccc1O	ZINC000819365334	EG	On-Demand	Anodyne	HPSE	26	42
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc(OC)cc2)ccc1O	ZINC000819365334	EG	On-Demand	Anodyne	MCHR1	19	45
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc(OC)cc2)ccc1O	ZINC000819365335	EG	On-Demand	Anodyne	DHODH	16	40
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc(OC)cc2)ccc1O	ZINC000819365335	EG	On-Demand	Anodyne	HDAC8	17	46
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc(OC)cc2)ccc1O	ZINC000819365335	EG	On-Demand	Anodyne	HPSE	26	42
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc(OC)cc2)ccc1O	ZINC000819365335	EG	On-Demand	Anodyne	MCHR1	19	45
CCOC(=O)c1cc(NC(=O)CNC(=O)OCc2ccccc2)ccc1O	ZINC000819365357	FE	On-Demand	Anodyne	CTSB	41	45
CCOC(=O)c1cc(NC(=O)CNC(=O)OCc2ccccc2)ccc1O	ZINC000819365357	FE	On-Demand	Anodyne	PAPA1_CARPA	44	32
CCOC(=O)c1cc(NC(=O)CNC(=O)OCc2ccccc2)ccc1O	ZINC000819365357	FE	On-Demand	Anodyne	CTSK	21	45
CCOC(=O)c1cc(NC(=O)CNC(=O)OCc2ccccc2)ccc1O	ZINC000819365357	FE	On-Demand	Anodyne	CAPNS1	55	35
CCOC(=O)c1cc(NC(=O)CNC(=O)OCc2ccccc2)ccc1O	ZINC000819365357	FE	On-Demand	Anodyne	CAPN1	61	37
CCOC(=O)c1cc(NC(=O)CNC(=O)OCc2ccccc2)ccc1O	ZINC000819365357	FE	On-Demand	Anodyne	CAPN2	104	38
CCOC(=O)c1cc(NC(=O)CNC(=O)OCc2ccccc2)ccc1O	ZINC000819365357	FE	On-Demand	Anodyne	NPR	70	38
O=Cc1cccc(OCC(=O)N2Cc3cnn(-c4ccccc4)c3C2)c1	ZINC000819365365	EF	On-Demand	Anodyne	FABP4	43	32
O=Cc1cccc(OCC(=O)N2Cc3cnn(-c4ccccc4)c3C2)c1	ZINC000819365365	EF	On-Demand	Anodyne	CPT2	44	36
CCOC(=O)c1cc(NC(=O)Cc2cc(-c3ccccc3)on2)ccc1O	ZINC000819365375	FG	On-Demand	Anodyne	PTPN11	43	32
C=CCc1cc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc(OC)c1OC	ZINC000819365398	GH	On-Demand	Mild	TUBB1	41	36
C=CCc1cc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc(OC)c1OC	ZINC000819365398	GH	On-Demand	Mild	SMO	19	40
C=CCc1cc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc(OC)c1OC	ZINC000819365398	GH	On-Demand	Mild	KCNK3	42	37
CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1NS(=O)(=O)c1ccc(C(=O)NC)cc1	ZINC000819365403	JF	On-Demand	Anodyne	PRTN3	52	33
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819365404	IF	On-Demand	Anodyne	SFRP1	127	41
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819365404	IF	On-Demand	Anodyne	WNT3	84	36
CCOC(=O)c1cc(NC(=O)CC[C@H]2CCN(C(=O)OC(C)(C)C)C2)ccc1O	ZINC000819365411	HH	On-Demand	Anodyne	GPR119	31	41
CCOC(=O)c1cc(NC(=O)CC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)ccc1O	ZINC000819365412	HH	On-Demand	Anodyne	GPR119	31	41
C=Cc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365414	DG	On-Demand	Anodyne	PRNP	45	36
C=Cc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365414	DG	On-Demand	Anodyne	PLAU	15	42
C=Cc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365414	DG	On-Demand	Anodyne	KCNK3	71	35
C=Cc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365414	DG	On-Demand	Anodyne	KCNK9	48	35
CCOC(=O)c1cc(NC(=O)CCNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)ccc1O	ZINC000819365421	IE	On-Demand	Anodyne	LGMN	55	33
CCOC(=O)c1cc(NC(=O)CCNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)ccc1O	ZINC000819365422	IE	On-Demand	Anodyne	LGMN	55	33
CCOC(=O)c1cc(NC(=O)C2CCN(C(=O)c3cccnc3)CC2)ccc1O	ZINC000819365436	GE	On-Demand	Anodyne	EPHX2	22	45
CCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)c1	ZINC000819365440	HE	On-Demand	Anodyne	CA7	15	44
CCNS(=O)(=O)c1ccc(C)c(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)c1	ZINC000819365440	HE	On-Demand	Anodyne	CA14	16	44
CCOC(=O)c1cc(NC(=O)Cc2cccc(OCC#N)c2)ccc1O	ZINC000819365448	FF	On-Demand	Mild	DHODH	18	42
CCOC(=O)c1cc(NC(=O)CN(CC)c2ccccc2)ccc1O	ZINC000819365459	EG	On-Demand	Anodyne	CA2	17	48
CCOC(=O)c1cc(NC(=O)CN(CC)c2ccccc2)ccc1O	ZINC000819365459	EG	On-Demand	Anodyne	CA1	37	43
CCOC(=O)c1cc(NC(=O)CN(CC)c2ccccc2)ccc1O	ZINC000819365459	EG	On-Demand	Anodyne	CA4	21	41
CCOC(=O)c1cc(NC(=O)CN(CC)c2ccccc2)ccc1O	ZINC000819365459	EG	On-Demand	Anodyne	CA12	16	43
CCOC(=O)c1cc(NC(=O)CN(CC)c2ccccc2)ccc1O	ZINC000819365459	EG	On-Demand	Anodyne	CA9	17	43
CCCNC(=O)c1cccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)c1	ZINC000819365465	FF	On-Demand	Anodyne	MAPK14	18	40
CCCNC(=O)c1cccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)c1	ZINC000819365465	FF	On-Demand	Anodyne	ROCK2	23	42
CCCNC(=O)c1cccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)c1	ZINC000819365465	FF	On-Demand	Anodyne	KCNK3	112	43
CCCNC(=O)c1cccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)c1	ZINC000819365465	FF	On-Demand	Anodyne	KCNK9	71	43
CCOC(=O)c1cc(NC(=O)[C@@H](F)Cc2ccccc2)ccc1O	ZINC000819365467	EG	On-Demand	Anodyne	MME	44	52
CCOC(=O)c1cc(NC(=O)[C@@H](F)Cc2ccccc2)ccc1O	ZINC000819365467	EG	On-Demand	Anodyne	ANPEP	47	32
CCOC(=O)c1cc(NC(=O)[C@@H](F)Cc2ccccc2)ccc1O	ZINC000819365467	EG	On-Demand	Anodyne	TIMP3	59	35
CCOC(=O)c1cc(NC(=O)[C@@H](F)Cc2ccccc2)ccc1O	ZINC000819365467	EG	On-Demand	Anodyne	CAPNS1	52	33
CCOC(=O)c1cc(NC(=O)[C@@H](F)Cc2ccccc2)ccc1O	ZINC000819365467	EG	On-Demand	Anodyne	CAPN1	40	33
CCOC(=O)c1cc(NC(=O)Cn2c(S)nc3ccccc3c2=O)ccc1O	ZINC000819365478	GE	On-Demand	Anodyne	CCKBR	17	44
CCOC(=O)c1cc(NC(=O)Cn2c(S)nc3ccccc3c2=O)ccc1O	ZINC000819365478	GE	On-Demand	Anodyne	IMDH_CRYPV	63	39
CCOC(=O)c1cc(NC(=O)CCCCN2CCCC2)ccc1O	ZINC000819365498	EF	On-Demand	Anodyne	CHRNA7	26	52
CCOC(=O)c1cc(NC(=O)CCCCN2CCCC2)ccc1O	ZINC000819365498	EF	On-Demand	Anodyne	HDAC3	23	40
CCOC(=O)c1cc(NC(=O)CCCCN2CCCC2)ccc1O	ZINC000819365498	EF	On-Demand	Anodyne	TERT	15	42
CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1NS(=O)(=O)c1cc(OC)ccc1OC	ZINC000819365504	JG	On-Demand	Anodyne	PRTN3	49	31
CCOC(=O)c1cc(NC(=O)COc2ccc3ccc(=O)oc3c2)ccc1O	ZINC000819365533	GF	On-Demand	Anodyne	MAOA	34	44
CCOC(=O)c1cc(NC(=O)COc2ccc3ccc(=O)oc3c2)ccc1O	ZINC000819365533	GF	On-Demand	Anodyne	MAOB	23	45
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819365654	II	On-Demand	Anodyne	PREP	19	44
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365674	FG	On-Demand	Anodyne	PRNP	53	40
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365674	FG	On-Demand	Anodyne	PLAU	21	45
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365674	FG	On-Demand	Anodyne	ACR	60	35
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365674	FG	On-Demand	Anodyne	NOD2	40	42
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365674	FG	On-Demand	Anodyne	KCNK3	96	37
CCOC(=O)Nc1ccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)cc1	ZINC000819365674	FG	On-Demand	Anodyne	KCNK9	58	37
CCOC(=O)c1cc(NC(=O)C(O)(c2ccccc2)c2ccccc2)ccc1O	ZINC000819365687	GG	On-Demand	Anodyne	DHODH	31	40
CCOC(=O)c1cc(NC(=O)C(O)(c2ccccc2)c2ccccc2)ccc1O	ZINC000819365687	GG	On-Demand	Anodyne	CA1	19	40
CCOC(=O)c1cc(NC(=O)C(O)(c2ccccc2)c2ccccc2)ccc1O	ZINC000819365687	GG	On-Demand	Anodyne	NPY2R	36	40
CCOC(=O)c1cc(NC(=O)C(F)(F)c2ccccc2)ccc1O	ZINC000819365688	EG	On-Demand	Anodyne	DHODH	33	40
CCOC(=O)c1cc(NC(=O)C(F)(F)c2ccccc2)ccc1O	ZINC000819365688	EG	On-Demand	Anodyne	CA1	18	41
CCOC(=O)c1cc(NC(=O)C(F)(F)c2ccccc2)ccc1O	ZINC000819365688	EG	On-Demand	Anodyne	KCNK3	43	35
CCOC(=O)c1cc(NC(=O)C(F)(F)c2ccccc2)ccc1O	ZINC000819365688	EG	On-Demand	Anodyne	KCNK9	41	35
CCOC(=O)c1cc(NC(=O)Cc2ccc(OCC#N)cc2)ccc1O	ZINC000819365694	FF	On-Demand	Mild	CA9	18	40
CCOC(=O)c1cc(NC(=O)CN2C(=O)c3ccccc3S2(=O)=O)ccc1O	ZINC000819365703	HD	On-Demand	Anodyne	ELANE	18	45
CCOC(=O)c1cc(NC(=O)[C@@H](CC)CO)ccc1O	ZINC000819365705	CD	On-Demand	Anodyne	CA7	15	52
CCOC(=O)c1cc(NC(=O)[C@@H](CC)CO)ccc1O	ZINC000819365705	CD	On-Demand	Anodyne	CA14	17	52
CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1NS(=O)(=O)c1ccc(C(N)=O)cc1	ZINC000819365706	JE	On-Demand	Anodyne	PRTN3	52	33
C#CCNS(=O)(=O)c1cccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)c1	ZINC000819365707	HD	On-Demand	Mild	KCNK3	85	38
C#CCNS(=O)(=O)c1cccc(C(=O)Nc2ccc(O)c(C(=O)OCC)c2)c1	ZINC000819365707	HD	On-Demand	Mild	KCNK9	56	38
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)ccc1O	ZINC000819365716	FG	On-Demand	Bother	CACNA1C	31	40
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)ccc1O	ZINC000819365716	FG	On-Demand	Bother	CACNA1D	53	40
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)ccc1O	ZINC000819365716	FG	On-Demand	Bother	MMP2	15	43
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)ccc1O	ZINC000819365716	FG	On-Demand	Bother	MMP9	15	43
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)ccc1O	ZINC000819365716	FG	On-Demand	Bother	MCHR1	16	54
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)ccc1O	ZINC000819365717	FG	On-Demand	Bother	CACNA1C	31	40
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)ccc1O	ZINC000819365717	FG	On-Demand	Bother	CACNA1D	53	40
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)ccc1O	ZINC000819365717	FG	On-Demand	Bother	MMP2	15	43
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)ccc1O	ZINC000819365717	FG	On-Demand	Bother	MMP9	15	43
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)ccc1O	ZINC000819365717	FG	On-Demand	Bother	MCHR1	16	54
CCOC(=O)c1cc(NC(=O)/C=C/c2ccc(O)c(O)c2)ccc1O	ZINC000819365747	EF	On-Demand	Clean	MCHR1	17	42
CCOC(=O)c1cc(NC(=O)/C=C\c2ccc(O)c(O)c2)ccc1O	ZINC000819365748	EF	On-Demand	Clean	MCHR1	17	42
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819365749	HG	On-Demand	Anodyne	P2RY12	40	35
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819365749	HG	On-Demand	Anodyne	PAPA1_CARPA	31	42
CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819365749	HG	On-Demand	Anodyne	FPR1	51	44
CCOC(=O)c1cc(NC(=O)CNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)ccc1O	ZINC000819365757	IE	On-Demand	Anodyne	F2	31	45
CCOC(=O)c1cc(NC(=O)CNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)ccc1O	ZINC000819365757	IE	On-Demand	Anodyne	LGMN	73	34
CCOC(=O)c1cc(NC(=O)CNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)ccc1O	ZINC000819365758	IE	On-Demand	Anodyne	F2	31	45
CCOC(=O)c1cc(NC(=O)CNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)ccc1O	ZINC000819365758	IE	On-Demand	Anodyne	LGMN	73	34
N#Cc1cccc(OCC(=O)N2Cc3cnn(-c4ccccc4)c3C2)c1	ZINC000819365764	EF	On-Demand	Mild	CPT1A	57	41
N#Cc1cccc(OCC(=O)N2Cc3cnn(-c4ccccc4)c3C2)c1	ZINC000819365764	EF	On-Demand	Mild	CPT2	45	38
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)CCc3ccccc3)C[C@H]2C1	ZINC000819365766	GH	On-Demand	Anodyne	ACE	44	35
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)CCc3ccccc3)C[C@H]2C1	ZINC000819365766	GH	On-Demand	Anodyne	PGC	41	32
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)CCc3ccccc3)C[C@H]2C1	ZINC000819365766	GH	On-Demand	Anodyne	REN	43	37
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)CCc3ccccc3)C[C@H]2C1	ZINC000819365766	GH	On-Demand	Anodyne	FPR1	41	34
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)CCc3ccccc3)CC[C@H]2C1	ZINC000819365767	GH	On-Demand	Anodyne	ACE	44	35
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)CCc3ccccc3)CC[C@H]2C1	ZINC000819365767	GH	On-Demand	Anodyne	PGC	41	32
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)CCc3ccccc3)CC[C@H]2C1	ZINC000819365767	GH	On-Demand	Anodyne	REN	43	37
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)CCc3ccccc3)CC[C@H]2C1	ZINC000819365767	GH	On-Demand	Anodyne	FPR1	41	34
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)CCc3ccccc3)C[C@H]2C1	ZINC000819365768	GH	On-Demand	Anodyne	ACE	44	35
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)CCc3ccccc3)C[C@H]2C1	ZINC000819365768	GH	On-Demand	Anodyne	PGC	41	32
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)CCc3ccccc3)C[C@H]2C1	ZINC000819365768	GH	On-Demand	Anodyne	REN	43	37
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)CCc3ccccc3)C[C@H]2C1	ZINC000819365768	GH	On-Demand	Anodyne	FPR1	41	34
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccn(C)n1	ZINC000819365773	FE	On-Demand	Anodyne	GPR119	48	45
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccn(C)n1	ZINC000819365775	FE	On-Demand	Anodyne	GPR119	48	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)c3cccc(F)c3)C[C@H]2C1	ZINC000819365837	GG	On-Demand	Anodyne	GPR119	24	46
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)c3cccc(F)c3)CC[C@H]2C1	ZINC000819365838	GG	On-Demand	Anodyne	GPR119	24	46
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)c3cccc(F)c3)CC[C@H]2C1	ZINC000819365839	GG	On-Demand	Anodyne	GPR119	24	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)c3cccc(F)c3)C[C@H]2C1	ZINC000819365840	GG	On-Demand	Anodyne	GPR119	24	46
O=C1C[C@H](CNC[C@@H](O)c2cccc(Cl)c2)CN1	ZINC000819365858	CD	On-Demand	Anodyne	ADRB1	34	43
O=C1C[C@H](CNC[C@@H](O)c2cccc(Cl)c2)CN1	ZINC000819365858	CD	On-Demand	Anodyne	ADRB3	45	43
O=C1C[C@H](CNC[C@@H](O)c2cccc(Cl)c2)CN1	ZINC000819365858	CD	On-Demand	Anodyne	CYP3A4	41	34
O=C1C[C@@H](CNC[C@H](O)c2cccc(Cl)c2)CN1	ZINC000819365859	CD	On-Demand	Anodyne	ADRB1	34	43
O=C1C[C@@H](CNC[C@H](O)c2cccc(Cl)c2)CN1	ZINC000819365859	CD	On-Demand	Anodyne	ADRB3	45	43
O=C1C[C@@H](CNC[C@H](O)c2cccc(Cl)c2)CN1	ZINC000819365859	CD	On-Demand	Anodyne	CYP3A4	41	34
O=C1C[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)CN1	ZINC000819365860	CD	On-Demand	Anodyne	ADRB1	34	43
O=C1C[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)CN1	ZINC000819365860	CD	On-Demand	Anodyne	ADRB3	45	43
O=C1C[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)CN1	ZINC000819365860	CD	On-Demand	Anodyne	CYP3A4	41	34
O=C1C[C@H](CNC[C@H](O)c2cccc(Cl)c2)CN1	ZINC000819365861	CD	On-Demand	Anodyne	ADRB1	34	43
O=C1C[C@H](CNC[C@H](O)c2cccc(Cl)c2)CN1	ZINC000819365861	CD	On-Demand	Anodyne	ADRB3	45	43
O=C1C[C@H](CNC[C@H](O)c2cccc(Cl)c2)CN1	ZINC000819365861	CD	On-Demand	Anodyne	CYP3A4	41	34
Cc1nc(O)nc(O)c1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819365882	FD	On-Demand	Mild	PAPA1_CARPA	38	45
Cc1nc(O)nc(O)c1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819365883	FD	On-Demand	Mild	PAPA1_CARPA	38	45
O[C@H](CNC[C@@H]1CCC[C@H]1C1CC1)c1cccnc1	ZINC000819365884	CF	On-Demand	Anodyne	ADRB1	22	43
O[C@H](CNC[C@@H]1CCC[C@H]1C1CC1)c1cccnc1	ZINC000819365884	CF	On-Demand	Anodyne	ADRB3	88	45
O[C@H](CNC[C@H]1CCC[C@@H]1C1CC1)c1cccnc1	ZINC000819365885	CF	On-Demand	Anodyne	ADRB1	22	43
O[C@H](CNC[C@H]1CCC[C@@H]1C1CC1)c1cccnc1	ZINC000819365885	CF	On-Demand	Anodyne	ADRB3	88	45
O[C@H](CNC[C@@H]1CCC[C@@H]1C1CC1)c1cccnc1	ZINC000819365886	CF	On-Demand	Anodyne	ADRB1	22	43
O[C@H](CNC[C@@H]1CCC[C@@H]1C1CC1)c1cccnc1	ZINC000819365886	CF	On-Demand	Anodyne	ADRB3	88	45
O[C@H](CNC[C@H]1CCC[C@H]1C1CC1)c1cccnc1	ZINC000819365887	CF	On-Demand	Anodyne	ADRB1	22	43
O[C@H](CNC[C@H]1CCC[C@H]1C1CC1)c1cccnc1	ZINC000819365887	CF	On-Demand	Anodyne	ADRB3	88	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)c3ccc(C#N)cc3)C[C@H]2C1	ZINC000819365898	GG	On-Demand	Mild	CTRB_BOVIN	45	32
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)c3ccc(C#N)cc3)C[C@H]2C1	ZINC000819365898	GG	On-Demand	Mild	GPR119	21	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)c3ccc(C#N)cc3)C[C@H]2C1	ZINC000819365899	GG	On-Demand	Mild	CTRB_BOVIN	45	32
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)c3ccc(C#N)cc3)C[C@H]2C1	ZINC000819365899	GG	On-Demand	Mild	GPR119	21	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)c3ccc(C#N)cc3)CC[C@H]2C1	ZINC000819365900	GG	On-Demand	Mild	CTRB_BOVIN	45	32
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)c3ccc(C#N)cc3)CC[C@H]2C1	ZINC000819365900	GG	On-Demand	Mild	GPR119	21	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)c3ccc(C#N)cc3)CC[C@H]2C1	ZINC000819365901	GG	On-Demand	Mild	CTRB_BOVIN	45	32
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)c3ccc(C#N)cc3)CC[C@H]2C1	ZINC000819365901	GG	On-Demand	Mild	GPR119	21	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)c3ccc(F)cc3)C[C@H]2C1	ZINC000819365902	GG	On-Demand	Anodyne	SLC6A3	20	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)c3ccc(F)cc3)C[C@H]2C1	ZINC000819365902	GG	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)c3ccc(F)cc3)CC[C@H]2C1	ZINC000819365903	GG	On-Demand	Anodyne	SLC6A3	20	42
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)c3ccc(F)cc3)CC[C@H]2C1	ZINC000819365903	GG	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)c3ccc(F)cc3)CC[C@H]2C1	ZINC000819365904	GG	On-Demand	Anodyne	SLC6A3	20	42
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)c3ccc(F)cc3)CC[C@H]2C1	ZINC000819365904	GG	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)c3ccc(F)cc3)C[C@H]2C1	ZINC000819365905	GG	On-Demand	Anodyne	SLC6A3	20	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)c3ccc(F)cc3)C[C@H]2C1	ZINC000819365905	GG	On-Demand	Anodyne	GPR119	29	41
O=C(CCCCCNC(=O)C(F)=C1CCC1)OCc1ccccc1	ZINC000819365910	EH	On-Demand	Anodyne	CAPN2	48	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CNC(=O)C1	ZINC000819365944	GD	On-Demand	Anodyne	CTSD	87	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CNC(=O)C1	ZINC000819365944	GD	On-Demand	Anodyne	PGC	63	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CNC(=O)C1	ZINC000819365944	GD	On-Demand	Anodyne	PAPA1_CARPA	33	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CNC(=O)C1	ZINC000819365944	GD	On-Demand	Anodyne	CTSL	16	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CNC(=O)C1	ZINC000819365944	GD	On-Demand	Anodyne	BACE2	50	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CNC(=O)C1	ZINC000819365944	GD	On-Demand	Anodyne	REN	94	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CNC(=O)C1	ZINC000819365944	GD	On-Demand	Anodyne	REN1	20	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CNC(=O)C1	ZINC000819365944	GD	On-Demand	Anodyne	BACE1	77	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CNC(=O)C1	ZINC000819365944	GD	On-Demand	Anodyne	FPR1	50	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@@H]1CNC(=O)C1	ZINC000819365944	GD	On-Demand	Anodyne	PLM1_PLAFA	29	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CNC(=O)C1	ZINC000819365945	GD	On-Demand	Anodyne	CTSD	87	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CNC(=O)C1	ZINC000819365945	GD	On-Demand	Anodyne	PGC	63	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CNC(=O)C1	ZINC000819365945	GD	On-Demand	Anodyne	PAPA1_CARPA	33	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CNC(=O)C1	ZINC000819365945	GD	On-Demand	Anodyne	CTSL	16	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CNC(=O)C1	ZINC000819365945	GD	On-Demand	Anodyne	BACE2	50	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CNC(=O)C1	ZINC000819365945	GD	On-Demand	Anodyne	REN	94	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CNC(=O)C1	ZINC000819365945	GD	On-Demand	Anodyne	REN1	20	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CNC(=O)C1	ZINC000819365945	GD	On-Demand	Anodyne	BACE1	77	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CNC(=O)C1	ZINC000819365945	GD	On-Demand	Anodyne	FPR1	50	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC[C@H]1CNC(=O)C1	ZINC000819365945	GD	On-Demand	Anodyne	PLM1_PLAFA	29	40
CS(=O)(=O)c1ccc([C@@H](O)CNC2CCC(C(F)F)CC2)cc1	ZINC000819366053	EF	On-Demand	Anodyne	ADRB3	19	41
CS(=O)(=O)c1ccc([C@H](O)CNC2CCC(C(F)F)CC2)cc1	ZINC000819366054	EF	On-Demand	Anodyne	ADRB3	19	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NCCC(=O)Nc3cccnc3)CC[C@H]2C1	ZINC000819366065	GG	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NCCC(=O)Nc3cccnc3)CC[C@H]2C1	ZINC000819366065	GG	On-Demand	Anodyne	NAMPT	20	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NCCC(=O)Nc3cccnc3)CC[C@H]2C1	ZINC000819366066	GG	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NCCC(=O)Nc3cccnc3)CC[C@H]2C1	ZINC000819366066	GG	On-Demand	Anodyne	NAMPT	20	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NCCC(=O)Nc3cccnc3)C[C@H]2C1	ZINC000819366067	GG	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NCCC(=O)Nc3cccnc3)C[C@H]2C1	ZINC000819366067	GG	On-Demand	Anodyne	NAMPT	20	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](NCCC(=O)Nc3cccnc3)C[C@H]2C1	ZINC000819366068	GG	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](NCCC(=O)Nc3cccnc3)C[C@H]2C1	ZINC000819366068	GG	On-Demand	Anodyne	NAMPT	20	41
CC[C@@H](NC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)C(=O)OC	ZINC000819366093	GD	On-Demand	Anodyne	SSTR2	46	33
CC[C@@H](NC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)C(=O)OC	ZINC000819366093	GD	On-Demand	Anodyne	P2RY12	58	34
CC[C@@H](NC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)C(=O)OC	ZINC000819366095	GD	On-Demand	Anodyne	SSTR2	46	33
CC[C@@H](NC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)C(=O)OC	ZINC000819366095	GD	On-Demand	Anodyne	P2RY12	58	34
Cc1ccccc1[C@@H](O)CNCC1(N2CCOCC2)CCN(C)CC1	ZINC000819366119	ED	On-Demand	Anodyne	HCN1	58	36
COCC[C@H](C)CNC[C@H](O)c1cccnc1	ZINC000819366146	BD	On-Demand	Anodyne	ADRB2	25	47
COCC[C@H](C)CNC[C@H](O)c1cccnc1	ZINC000819366146	BD	On-Demand	Anodyne	ADRB1	25	47
COCC[C@H](C)CNC[C@H](O)c1cccnc1	ZINC000819366146	BD	On-Demand	Anodyne	ADRB3	92	47
COCC[C@@H](C)CNC[C@@H](O)c1cccnc1	ZINC000819366147	BD	On-Demand	Anodyne	ADRB2	25	47
COCC[C@@H](C)CNC[C@@H](O)c1cccnc1	ZINC000819366147	BD	On-Demand	Anodyne	ADRB1	25	47
COCC[C@@H](C)CNC[C@@H](O)c1cccnc1	ZINC000819366147	BD	On-Demand	Anodyne	ADRB3	92	47
COCC[C@H](C)CNC[C@@H](O)c1cccnc1	ZINC000819366148	BD	On-Demand	Anodyne	ADRB2	25	47
COCC[C@H](C)CNC[C@@H](O)c1cccnc1	ZINC000819366148	BD	On-Demand	Anodyne	ADRB1	25	47
COCC[C@H](C)CNC[C@@H](O)c1cccnc1	ZINC000819366148	BD	On-Demand	Anodyne	ADRB3	92	47
COCC[C@@H](C)CNC[C@H](O)c1cccnc1	ZINC000819366149	BD	On-Demand	Anodyne	ADRB2	25	47
COCC[C@@H](C)CNC[C@H](O)c1cccnc1	ZINC000819366149	BD	On-Demand	Anodyne	ADRB1	25	47
COCC[C@@H](C)CNC[C@H](O)c1cccnc1	ZINC000819366149	BD	On-Demand	Anodyne	ADRB3	92	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2CCC[C@H]2C2CC2)CC1	ZINC000819366251	FG	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2CCC[C@H]2C2CC2)CC1	ZINC000819366252	FG	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@H]2CCC[C@@H]2C2CC2)CC1	ZINC000819366253	FG	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2CCC[C@@H]2C2CC2)CC1	ZINC000819366254	FG	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)c3cccnc3)CC[C@H]2C1	ZINC000819366266	FF	On-Demand	Anodyne	ADRB1	18	40
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)c3cccnc3)CC[C@H]2C1	ZINC000819366266	FF	On-Demand	Anodyne	ADRB3	63	47
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)c3cccnc3)C[C@H]2C1	ZINC000819366267	FF	On-Demand	Anodyne	ADRB1	18	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)c3cccnc3)C[C@H]2C1	ZINC000819366267	FF	On-Demand	Anodyne	ADRB3	63	47
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)c3cccnc3)C[C@H]2C1	ZINC000819366268	FF	On-Demand	Anodyne	ADRB1	18	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)c3cccnc3)C[C@H]2C1	ZINC000819366268	FF	On-Demand	Anodyne	ADRB3	63	47
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)c3cccnc3)CC[C@H]2C1	ZINC000819366269	FF	On-Demand	Anodyne	ADRB1	18	40
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)c3cccnc3)CC[C@H]2C1	ZINC000819366269	FF	On-Demand	Anodyne	ADRB3	63	47
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cnc3ccccc3c2)c1	ZINC000819366311	GK	On-Demand	Anodyne	F10	15	45
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cnc3ccccc3c2)c1	ZINC000819366311	GK	On-Demand	Anodyne	KIT	15	40
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cnc3ccccc3c2)c1	ZINC000819366311	GK	On-Demand	Anodyne	LCK	43	42
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cnc3ccccc3c2)c1	ZINC000819366311	GK	On-Demand	Anodyne	KDR	25	62
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cnc3ccccc3c2)c1	ZINC000819366311	GK	On-Demand	Anodyne	ABCB1B	34	48
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cnc3ccccc3c2)c1	ZINC000819366311	GK	On-Demand	Anodyne	NR1H4	18	47
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cnc3ccccc3c2)c1	ZINC000819366311	GK	On-Demand	Anodyne	ABCB1	15	48
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cnc3ccccc3c2)c1	ZINC000819366311	GK	On-Demand	Anodyne	MAPK10	21	44
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cnc3ccccc3c2)c1	ZINC000819366311	GK	On-Demand	Anodyne	HCK	15	41
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cnc3ccccc3c2)c1	ZINC000819366311	GK	On-Demand	Anodyne	LYN	27	41
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cnc3ccccc3c2)c1	ZINC000819366311	GK	On-Demand	Anodyne	RPS6KA3	15	47
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cnc3ccccc3c2)c1	ZINC000819366311	GK	On-Demand	Anodyne	CSF1R	23	45
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cnc3ccccc3c2)c1	ZINC000819366311	GK	On-Demand	Anodyne	DDR1	17	40
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cnc3ccccc3c2)c1	ZINC000819366311	GK	On-Demand	Anodyne	SHH	45	36
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cnc3ccccc3c2)c1	ZINC000819366311	GK	On-Demand	Anodyne	ABCG2	21	48
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cnc3ccccc3c2)c1	ZINC000819366311	GK	On-Demand	Anodyne	KCNK3	137	53
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cnc3ccccc3c2)c1	ZINC000819366311	GK	On-Demand	Anodyne	KCNK9	99	53
CN1CCC(CNC[C@H](O)c2ccccc2Cl)(N2CCOCC2)CC1	ZINC000819366321	FD	On-Demand	Anodyne	HCN1	49	36
CCC[C@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000819366338	DH	On-Demand	Bother	CACNA1D	51	36
CCC[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000819366339	DH	On-Demand	Bother	CACNA1D	51	36
CCC[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000819366340	DH	On-Demand	Bother	CACNA1D	51	36
CCC[C@@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000819366341	DH	On-Demand	Bother	CACNA1D	51	36
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)c3cc(F)ccc3F)C[C@H]2C1	ZINC000819366346	GH	On-Demand	Anodyne	GPR119	30	46
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)c3cc(F)ccc3F)CC[C@H]2C1	ZINC000819366347	GH	On-Demand	Anodyne	GPR119	30	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)c3cc(F)ccc3F)C[C@H]2C1	ZINC000819366348	GH	On-Demand	Anodyne	GPR119	30	46
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)c3cc(F)ccc3F)CC[C@H]2C1	ZINC000819366349	GH	On-Demand	Anodyne	GPR119	30	46
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)c3c(F)cccc3F)CC[C@H]2C1	ZINC000819366370	GH	On-Demand	Anodyne	GPR119	30	46
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)c3c(F)cccc3F)CC[C@H]2C1	ZINC000819366371	GH	On-Demand	Anodyne	GPR119	30	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)c3c(F)cccc3F)C[C@H]2C1	ZINC000819366372	GH	On-Demand	Anodyne	GPR119	30	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)c3c(F)cccc3F)C[C@H]2C1	ZINC000819366373	GH	On-Demand	Anodyne	GPR119	30	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)c3ccc(Cl)cc3)C[C@H]2C1	ZINC000819366383	GH	On-Demand	Anodyne	ADRB3	20	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](NC[C@H](O)c3ccc(Cl)cc3)C[C@H]2C1	ZINC000819366384	GH	On-Demand	Anodyne	ADRB3	20	44
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@H](O)c3ccc(Cl)cc3)CC[C@H]2C1	ZINC000819366385	GH	On-Demand	Anodyne	ADRB3	20	44
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)c3ccc(Cl)cc3)CC[C@H]2C1	ZINC000819366386	GH	On-Demand	Anodyne	ADRB3	20	44
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)c3ccc(Cl)cc3)CC[C@H]2C1	ZINC000819366387	GH	On-Demand	Anodyne	ADRB3	20	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)c3ccc(Cl)cc3)C[C@H]2C1	ZINC000819366388	GH	On-Demand	Anodyne	ADRB3	20	44
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](NC[C@@H](O)c3ccc(Cl)cc3)CC[C@H]2C1	ZINC000819366389	GH	On-Demand	Anodyne	ADRB3	20	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](NC[C@@H](O)c3ccc(Cl)cc3)C[C@H]2C1	ZINC000819366390	GH	On-Demand	Anodyne	ADRB3	20	44
CCN(Cc1ccccn1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819366441	FG	On-Demand	Mild	PAPA1_CARPA	50	42
CCN(Cc1ccccn1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819366442	FG	On-Demand	Mild	PAPA1_CARPA	50	42
CN1CCC(CNC[C@@H](O)c2ccccc2F)(N2CCOCC2)CC1	ZINC000819366495	FD	On-Demand	Anodyne	HCN1	49	36
CN1CCC(CNC[C@H](O)c2ccccc2F)(N2CCOCC2)CC1	ZINC000819366496	FD	On-Demand	Anodyne	HCN1	49	36
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(=O)N1CCOCC1	ZINC000819366554	GD	On-Demand	Mild	PAPA1_CARPA	36	47
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(=O)N1CCOCC1	ZINC000819366554	GD	On-Demand	Mild	CTSS	21	43
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(=O)N1CCOCC1	ZINC000819366555	GD	On-Demand	Mild	PAPA1_CARPA	36	47
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(=O)N1CCOCC1	ZINC000819366555	GD	On-Demand	Mild	CTSS	21	43
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(=O)N1CCOCC1	ZINC000819366556	GD	On-Demand	Mild	PAPA1_CARPA	36	47
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(=O)N1CCOCC1	ZINC000819366556	GD	On-Demand	Mild	CTSS	21	43
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(=O)N1CCOCC1	ZINC000819366557	GD	On-Demand	Mild	PAPA1_CARPA	36	47
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(=O)N1CCOCC1	ZINC000819366557	GD	On-Demand	Mild	CTSS	21	43
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(OC(F)(F)F)c1	ZINC000819366597	EG	On-Demand	Anodyne	KCNQ2	53	39
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(OC(F)(F)F)c1	ZINC000819366598	EG	On-Demand	Anodyne	KCNQ2	53	39
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(OC(F)(F)F)c1	ZINC000819366599	EG	On-Demand	Anodyne	KCNQ2	53	39
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(OC(F)(F)F)c1	ZINC000819366600	EG	On-Demand	Anodyne	KCNQ2	53	39
CC(C)(C)OC(=O)NCC[C@H](O)CNCc1ccccc1S(C)(=O)=O	ZINC000819366622	FD	On-Demand	Anodyne	FPR1	40	33
CC(C)(C)OC(=O)NCC[C@@H](O)CNCc1ccccc1S(C)(=O)=O	ZINC000819366623	FD	On-Demand	Anodyne	FPR1	40	33
C=CCCn1cc(C(=O)Oc2ccc(NC(=O)C(C)C)cc2)nn1	ZINC000819366645	EF	On-Demand	Mild	ACR	43	37
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1	ZINC000819366652	EH	On-Demand	Anodyne	PRCP	54	43
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1	ZINC000819366653	EH	On-Demand	Anodyne	PRCP	54	43
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1	ZINC000819366654	EH	On-Demand	Anodyne	PRCP	54	43
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1	ZINC000819366655	EH	On-Demand	Anodyne	PRCP	54	43
COCC[C@H](C)CNC[C@H](O)c1ccccc1	ZINC000819366686	BD	On-Demand	Anodyne	ADRB2	25	40
COCC[C@H](C)CNC[C@H](O)c1ccccc1	ZINC000819366686	BD	On-Demand	Anodyne	AOC3	16	45
COCC[C@@H](C)CNC[C@H](O)c1ccccc1	ZINC000819366687	BD	On-Demand	Anodyne	ADRB2	25	40
COCC[C@@H](C)CNC[C@H](O)c1ccccc1	ZINC000819366687	BD	On-Demand	Anodyne	AOC3	16	45
CN1CCC(CNC[C@@H](O)c2ccccc2)(N2CCOCC2)CC1	ZINC000819366754	ED	On-Demand	Anodyne	HCN1	59	36
CN1CCC(CNC[C@H](O)c2ccccc2)(N2CCOCC2)CC1	ZINC000819366755	ED	On-Demand	Anodyne	HCN1	59	36
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)c3ccc(F)c(F)c3)CC[C@H]2C1	ZINC000819366756	GH	On-Demand	Anodyne	GPR119	32	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)c3ccc(F)c(F)c3)C[C@H]2C1	ZINC000819366757	GH	On-Demand	Anodyne	GPR119	32	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)c3ccc(F)c(F)c3)C[C@H]2C1	ZINC000819366758	GH	On-Demand	Anodyne	GPR119	32	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)c3ccc(F)c(F)c3)CC[C@H]2C1	ZINC000819366759	GH	On-Demand	Anodyne	GPR119	32	41
COc1ccc(N2CCN(C(=O)C[C@H](C)n3cccn3)CC2)cc1F	ZINC000819366774	EE	On-Demand	Clean	CCR1	26	41
COc1ccc(N2CCN(C(=O)C[C@@H](C)n3cccn3)CC2)cc1F	ZINC000819366775	EE	On-Demand	Clean	CCR1	26	41
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819366813	GF	On-Demand	Anodyne	ADRB3	35	46
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819366814	GF	On-Demand	Anodyne	ADRB3	35	46
O[C@H](CNCc1nccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819366822	EF	On-Demand	Anodyne	ADRB1	27	42
O[C@H](CNCc1nccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819366822	EF	On-Demand	Anodyne	ADRB3	42	42
O[C@@H](CNCc1nccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819366823	EF	On-Demand	Anodyne	ADRB1	27	42
O[C@@H](CNCc1nccc(C(F)(F)F)n1)c1cccc(Cl)c1	ZINC000819366823	EF	On-Demand	Anodyne	ADRB3	42	42
CCN1CC[C@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819366895	DE	On-Demand	Anodyne	ADRB3	16	40
CCN1CC[C@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819366895	DE	On-Demand	Anodyne	EPHX2	30	41
CCN1CC[C@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819366896	DE	On-Demand	Anodyne	ADRB3	16	40
CCN1CC[C@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)C1	ZINC000819366896	DE	On-Demand	Anodyne	EPHX2	30	41
N#Cc1ccc([C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819366905	FE	On-Demand	Mild	CTSK	15	41
N#Cc1ccc([C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819366905	FE	On-Demand	Mild	CTRB_BOVIN	50	34
N#Cc1ccc([C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819366906	FE	On-Demand	Mild	CTSK	15	41
N#Cc1ccc([C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819366906	FE	On-Demand	Mild	CTRB_BOVIN	50	34
O=C(OCc1ccccc1)N1CC(NCC2(O)CCCC2)C1	ZINC000819366909	DD	On-Demand	Anodyne	GRIN2B	25	43
O=C(OCc1ccccc1)N1CC(NCC2(O)CCCC2)C1	ZINC000819366909	DD	On-Demand	Anodyne	CTSK	21	42
O=C(OCc1ccccc1)N1CC(NCC2(O)CCCC2)C1	ZINC000819366909	DD	On-Demand	Anodyne	PREP	30	42
O=C(OCc1ccccc1)N1CC(NCC2(O)CCCC2)C1	ZINC000819366909	DD	On-Demand	Anodyne	LGMN	65	39
O=C(OCc1ccccc1)N1CC(NCC2(O)CCCC2)C1	ZINC000819366909	DD	On-Demand	Anodyne	TGM2	35	42
O=C(OCc1ccccc1)N1CC(NCC2(O)CCCC2)C1	ZINC000819366909	DD	On-Demand	Anodyne	F13A1	34	42
O=C(OCc1ccccc1)N1CC(NCC2(O)CCCC2)C1	ZINC000819366909	DD	On-Demand	Anodyne	SLC12A5	73	41
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819366910	GE	On-Demand	Anodyne	CTSD	118	45
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819366910	GE	On-Demand	Anodyne	PGC	66	38
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819366910	GE	On-Demand	Anodyne	CMA1	34	41
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819366910	GE	On-Demand	Anodyne	CTRA_BOVIN	15	41
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819366910	GE	On-Demand	Anodyne	SIGMAR1	19	40
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819366910	GE	On-Demand	Anodyne	PAPA1_CARPA	30	40
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819366910	GE	On-Demand	Anodyne	CCKAR	22	40
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819366910	GE	On-Demand	Anodyne	CTSK	20	44
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819366910	GE	On-Demand	Anodyne	CTSL	18	40
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819366910	GE	On-Demand	Anodyne	PGA	41	38
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819366910	GE	On-Demand	Anodyne	BACE2	58	43
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819366910	GE	On-Demand	Anodyne	REN	109	46
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819366910	GE	On-Demand	Anodyne	REN1	45	32
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819366910	GE	On-Demand	Anodyne	BACE1	95	45
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819366910	GE	On-Demand	Anodyne	FPR1	49	39
CCN1CC[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)C1	ZINC000819366910	GE	On-Demand	Anodyne	PLM1_PLAFA	29	44
CC[C@H](O)CNCC1(NC(=O)OC(C)(C)C)CCN(Cc2ccccc2)CC1	ZINC000819366924	GF	On-Demand	Anodyne	SIGMAR1	43	40
CC[C@H](O)CNCC1(NC(=O)OC(C)(C)C)CCN(Cc2ccccc2)CC1	ZINC000819366924	GF	On-Demand	Anodyne	NPFFR2	37	44
CC[C@H](O)CNCC1(NC(=O)OC(C)(C)C)CCN(Cc2ccccc2)CC1	ZINC000819366924	GF	On-Demand	Anodyne	NPFFR1	48	39
CC[C@@H](O)CNCC1(NC(=O)OC(C)(C)C)CCN(Cc2ccccc2)CC1	ZINC000819366926	GF	On-Demand	Anodyne	SIGMAR1	43	40
CC[C@@H](O)CNCC1(NC(=O)OC(C)(C)C)CCN(Cc2ccccc2)CC1	ZINC000819366926	GF	On-Demand	Anodyne	NPFFR2	37	44
CC[C@@H](O)CNCC1(NC(=O)OC(C)(C)C)CCN(Cc2ccccc2)CC1	ZINC000819366926	GF	On-Demand	Anodyne	NPFFR1	48	39
C=CC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819366938	DH	On-Demand	Mild	ADRB3	25	42
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819366943	DH	On-Demand	Mild	ADRB3	25	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)Cc3ccccc3)C[C@H]2C1	ZINC000819366946	FG	On-Demand	Anodyne	PGC	49	33
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)Cc3ccccc3)C[C@H]2C1	ZINC000819366946	FG	On-Demand	Anodyne	REN	47	38
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)Cc3ccccc3)C[C@H]2C1	ZINC000819366946	FG	On-Demand	Anodyne	FPR1	44	35
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)Cc3ccccc3)C[C@H]2C1	ZINC000819366948	FG	On-Demand	Anodyne	PGC	49	33
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)Cc3ccccc3)C[C@H]2C1	ZINC000819366948	FG	On-Demand	Anodyne	REN	47	38
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)Cc3ccccc3)C[C@H]2C1	ZINC000819366948	FG	On-Demand	Anodyne	FPR1	44	35
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)Cc3ccccc3)CC[C@H]2C1	ZINC000819366950	FG	On-Demand	Anodyne	PGC	49	33
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)Cc3ccccc3)CC[C@H]2C1	ZINC000819366950	FG	On-Demand	Anodyne	REN	47	38
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)Cc3ccccc3)CC[C@H]2C1	ZINC000819366950	FG	On-Demand	Anodyne	FPR1	44	35
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)Cc3ccccc3)CC[C@H]2C1	ZINC000819366952	FG	On-Demand	Anodyne	PGC	49	33
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)Cc3ccccc3)CC[C@H]2C1	ZINC000819366952	FG	On-Demand	Anodyne	REN	47	38
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)Cc3ccccc3)CC[C@H]2C1	ZINC000819366952	FG	On-Demand	Anodyne	FPR1	44	35
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819366956	GF	On-Demand	Anodyne	ADRB2	27	65
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819366956	GF	On-Demand	Anodyne	ADRB1	32	50
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819366956	GF	On-Demand	Anodyne	ADRB3	24	50
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819366956	GF	On-Demand	Anodyne	MMP11	52	32
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819366956	GF	On-Demand	Anodyne	ABCB1	34	46
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819366959	GF	On-Demand	Anodyne	ADRB2	27	65
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819366959	GF	On-Demand	Anodyne	ADRB1	32	50
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819366959	GF	On-Demand	Anodyne	ADRB3	24	50
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819366959	GF	On-Demand	Anodyne	MMP11	52	32
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819366959	GF	On-Demand	Anodyne	ABCB1	34	46
CCN1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819366966	CE	On-Demand	Anodyne	ADRB1	37	44
CCN1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819366966	CE	On-Demand	Anodyne	ADRB3	56	48
CCN1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819366966	CE	On-Demand	Anodyne	IGF1R	28	41
CCN1CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819366966	CE	On-Demand	Anodyne	CYP3A4	49	40
CN1CCC(CNC[C@@H](O)c2cccc(Cl)c2)(N2CCOCC2)CC1	ZINC000819366969	FD	On-Demand	Anodyne	CYP3A4	43	36
CCN1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819366970	CE	On-Demand	Anodyne	ADRB1	37	44
CCN1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819366970	CE	On-Demand	Anodyne	ADRB3	56	48
CCN1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819366970	CE	On-Demand	Anodyne	IGF1R	28	41
CCN1CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819366970	CE	On-Demand	Anodyne	CYP3A4	49	40
CN1CCC(CNC[C@H](O)c2cccc(Cl)c2)(N2CCOCC2)CC1	ZINC000819366971	FD	On-Demand	Anodyne	CYP3A4	43	36
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccccc2)C1	ZINC000819366973	EE	On-Demand	Anodyne	SLC6A3	15	42
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccccc2)C1	ZINC000819366973	EE	On-Demand	Anodyne	GRIN2B	25	43
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccccc2)C1	ZINC000819366973	EE	On-Demand	Anodyne	CTSB	32	40
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccccc2)C1	ZINC000819366973	EE	On-Demand	Anodyne	CTSK	24	40
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccccc2)C1	ZINC000819366973	EE	On-Demand	Anodyne	CTSL	29	40
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccccc2)C1	ZINC000819366973	EE	On-Demand	Anodyne	PREP	25	40
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccccc2)C1	ZINC000819366973	EE	On-Demand	Anodyne	CAPN2	61	39
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccccc2)C1	ZINC000819366973	EE	On-Demand	Anodyne	TGM2	38	44
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccccc2)C1	ZINC000819366973	EE	On-Demand	Anodyne	NPR	48	32
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccccc2)C1	ZINC000819366973	EE	On-Demand	Anodyne	F13A1	34	44
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccccc2)C1	ZINC000819366976	EE	On-Demand	Anodyne	SLC6A3	15	42
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccccc2)C1	ZINC000819366976	EE	On-Demand	Anodyne	GRIN2B	25	43
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccccc2)C1	ZINC000819366976	EE	On-Demand	Anodyne	CTSB	32	40
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccccc2)C1	ZINC000819366976	EE	On-Demand	Anodyne	CTSK	24	40
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccccc2)C1	ZINC000819366976	EE	On-Demand	Anodyne	CTSL	29	40
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccccc2)C1	ZINC000819366976	EE	On-Demand	Anodyne	PREP	25	40
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccccc2)C1	ZINC000819366976	EE	On-Demand	Anodyne	CAPN2	61	39
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccccc2)C1	ZINC000819366976	EE	On-Demand	Anodyne	TGM2	38	44
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccccc2)C1	ZINC000819366976	EE	On-Demand	Anodyne	NPR	48	32
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccccc2)C1	ZINC000819366976	EE	On-Demand	Anodyne	F13A1	34	44
CN(C[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819366986	GD	On-Demand	Anodyne	NPR	58	34
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)COc3ccccc3)C[C@H]2C1	ZINC000819366987	GG	On-Demand	Anodyne	ADRB2	41	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)COc3ccccc3)C[C@H]2C1	ZINC000819366987	GG	On-Demand	Anodyne	ADRB1	59	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)COc3ccccc3)C[C@H]2C1	ZINC000819366987	GG	On-Demand	Anodyne	ADRB3	46	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)COc3ccccc3)C[C@H]2C1	ZINC000819366987	GG	On-Demand	Anodyne	ABCB1	22	41
CN(C[C@H](O)CNC1CN(C(=O)OCc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000819366988	GD	On-Demand	Anodyne	NPR	58	34
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)COc3ccccc3)CC[C@H]2C1	ZINC000819366989	GG	On-Demand	Anodyne	ADRB2	41	43
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)COc3ccccc3)CC[C@H]2C1	ZINC000819366989	GG	On-Demand	Anodyne	ADRB1	59	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)COc3ccccc3)CC[C@H]2C1	ZINC000819366989	GG	On-Demand	Anodyne	ADRB3	46	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)COc3ccccc3)CC[C@H]2C1	ZINC000819366989	GG	On-Demand	Anodyne	ABCB1	22	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)COc3ccccc3)C[C@H]2C1	ZINC000819366991	GG	On-Demand	Anodyne	ADRB2	41	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)COc3ccccc3)C[C@H]2C1	ZINC000819366991	GG	On-Demand	Anodyne	ADRB1	59	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)COc3ccccc3)C[C@H]2C1	ZINC000819366991	GG	On-Demand	Anodyne	ADRB3	46	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)COc3ccccc3)C[C@H]2C1	ZINC000819366991	GG	On-Demand	Anodyne	ABCB1	22	41
O=C1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)[C@H](c2ccccc2)N1	ZINC000819366992	EF	On-Demand	Anodyne	ADRB1	16	43
O=C1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)[C@H](c2ccccc2)N1	ZINC000819366992	EF	On-Demand	Anodyne	ADRB3	21	43
O=C1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)[C@H](c2ccccc2)N1	ZINC000819366992	EF	On-Demand	Anodyne	GRIN2D	64	32
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)COc3ccccc3)CC[C@H]2C1	ZINC000819366993	GG	On-Demand	Anodyne	ADRB2	41	43
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)COc3ccccc3)CC[C@H]2C1	ZINC000819366993	GG	On-Demand	Anodyne	ADRB1	59	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)COc3ccccc3)CC[C@H]2C1	ZINC000819366993	GG	On-Demand	Anodyne	ADRB3	46	41
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)COc3ccccc3)CC[C@H]2C1	ZINC000819366993	GG	On-Demand	Anodyne	ABCB1	22	41
C=CC[C@H](Cc1ccccc1)NC[C@H](O)c1cc(OC)ccc1OC	ZINC000819366997	EH	On-Demand	Mild	ADRB2	24	45
C=CC[C@H](Cc1ccccc1)NC[C@H](O)c1cc(OC)ccc1OC	ZINC000819366997	EH	On-Demand	Mild	ADRB1	19	40
C=CC[C@H](Cc1ccccc1)NC[C@H](O)c1cc(OC)ccc1OC	ZINC000819366997	EH	On-Demand	Mild	ADRB3	26	42
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819366999	EH	On-Demand	Mild	ADRB2	24	45
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819366999	EH	On-Demand	Mild	ADRB1	19	40
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819366999	EH	On-Demand	Mild	ADRB3	26	42
C[C@H](NC[C@H](O)c1cccnc1)c1ccn(C)n1	ZINC000819367036	BD	On-Demand	Anodyne	ADRB1	20	46
C[C@H](NC[C@H](O)c1cccnc1)c1ccn(C)n1	ZINC000819367036	BD	On-Demand	Anodyne	ADRB3	63	46
C[C@@H](NC[C@@H](O)c1cccnc1)c1ccn(C)n1	ZINC000819367039	BD	On-Demand	Anodyne	ADRB1	20	46
C[C@@H](NC[C@@H](O)c1cccnc1)c1ccn(C)n1	ZINC000819367039	BD	On-Demand	Anodyne	ADRB3	63	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)c3cccc(Cl)c3)C[C@H]2C1	ZINC000819367045	GH	On-Demand	Anodyne	ADRB1	33	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)c3cccc(Cl)c3)C[C@H]2C1	ZINC000819367045	GH	On-Demand	Anodyne	ADRB3	53	48
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)c3cccc(Cl)c3)C[C@H]2C1	ZINC000819367045	GH	On-Demand	Anodyne	CYP3A4	50	37
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)c3cccc(Cl)c3)CC[C@H]2C1	ZINC000819367046	GH	On-Demand	Anodyne	ADRB1	33	46
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)c3cccc(Cl)c3)CC[C@H]2C1	ZINC000819367046	GH	On-Demand	Anodyne	ADRB3	53	48
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)c3cccc(Cl)c3)CC[C@H]2C1	ZINC000819367046	GH	On-Demand	Anodyne	CYP3A4	50	37
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)c3cccc(Cl)c3)CC[C@H]2C1	ZINC000819367047	GH	On-Demand	Anodyne	ADRB1	33	46
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)c3cccc(Cl)c3)CC[C@H]2C1	ZINC000819367047	GH	On-Demand	Anodyne	ADRB3	53	48
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)c3cccc(Cl)c3)CC[C@H]2C1	ZINC000819367047	GH	On-Demand	Anodyne	CYP3A4	50	37
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C[C@H]2C1	ZINC000819367048	GH	On-Demand	Anodyne	ADRB1	33	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C[C@H]2C1	ZINC000819367048	GH	On-Demand	Anodyne	ADRB3	53	48
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)c3cccc(Cl)c3)C[C@H]2C1	ZINC000819367048	GH	On-Demand	Anodyne	CYP3A4	50	37
COc1cccc([S@@](=O)CC(=O)NCCCc2c(C)noc2C)c1	ZINC000819367067	FE	On-Demand	Anodyne	MTNR1A	54	45
COc1cccc([S@@](=O)CC(=O)NCCCc2c(C)noc2C)c1	ZINC000819367067	FE	On-Demand	Anodyne	MTNR1B	54	45
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819367073	GH	On-Demand	Mild	CTSD	24	44
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819367073	GH	On-Demand	Mild	PGC	57	36
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819367073	GH	On-Demand	Mild	REN	73	46
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819367073	GH	On-Demand	Mild	CTSE	44	36
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819367073	GH	On-Demand	Mild	PGA5	45	34
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819367073	GH	On-Demand	Mild	GPR119	35	46
C=CC[C@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819367075	GH	On-Demand	Mild	CTSD	24	44
C=CC[C@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819367075	GH	On-Demand	Mild	PGC	57	36
C=CC[C@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819367075	GH	On-Demand	Mild	REN	73	46
C=CC[C@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819367075	GH	On-Demand	Mild	CTSE	44	36
C=CC[C@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819367075	GH	On-Demand	Mild	PGA5	45	34
C=CC[C@H](Cc1ccccc1)NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819367075	GH	On-Demand	Mild	GPR119	35	46
COC1([C@@H](C)NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCC1	ZINC000819367109	FF	On-Demand	Anodyne	GPR119	25	42
COC1([C@H](C)NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCC1	ZINC000819367111	FF	On-Demand	Anodyne	GPR119	25	42
COC1([C@H](C)NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCC1	ZINC000819367112	FF	On-Demand	Anodyne	GPR119	25	42
COC1([C@@H](C)NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCC1	ZINC000819367114	FF	On-Demand	Anodyne	GPR119	25	42
O=C1CC[C@@H](NC[C@H](O)c2ccccc2)[C@H](c2ccccc2)N1	ZINC000819367144	DE	On-Demand	Anodyne	ADRB1	15	40
O=C1CC[C@@H](NC[C@@H](O)c2ccccc2)[C@H](c2ccccc2)N1	ZINC000819367145	DE	On-Demand	Anodyne	ADRB1	15	40
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COCc2ccccc2)C1	ZINC000819367201	FE	On-Demand	Anodyne	GRIN2B	19	42
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COCc2ccccc2)C1	ZINC000819367201	FE	On-Demand	Anodyne	GHSR	32	40
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COCc2ccccc2)C1	ZINC000819367201	FE	On-Demand	Anodyne	TGM2	33	43
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COCc2ccccc2)C1	ZINC000819367201	FE	On-Demand	Anodyne	F13A1	30	43
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COCc2ccccc2)C1	ZINC000819367203	FE	On-Demand	Anodyne	GRIN2B	19	42
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COCc2ccccc2)C1	ZINC000819367203	FE	On-Demand	Anodyne	GHSR	32	40
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COCc2ccccc2)C1	ZINC000819367203	FE	On-Demand	Anodyne	TGM2	33	43
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COCc2ccccc2)C1	ZINC000819367203	FE	On-Demand	Anodyne	F13A1	30	43
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819367206	FE	On-Demand	Anodyne	DRD4	35	40
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819367206	FE	On-Demand	Anodyne	SLC6A3	23	47
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819367206	FE	On-Demand	Anodyne	ADRB3	50	39
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819367206	FE	On-Demand	Anodyne	LTA4H	25	49
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819367206	FE	On-Demand	Anodyne	HRH3	15	44
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819367206	FE	On-Demand	Anodyne	SIGMAR1	45	52
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819367206	FE	On-Demand	Anodyne	CCR5	24	41
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819367206	FE	On-Demand	Anodyne	DPP7	42	36
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819367206	FE	On-Demand	Anodyne	SCD	18	40
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819367206	FE	On-Demand	Anodyne	NPFFR1	40	35
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819367208	FE	On-Demand	Anodyne	DRD4	35	40
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819367208	FE	On-Demand	Anodyne	SLC6A3	23	47
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819367208	FE	On-Demand	Anodyne	ADRB3	50	39
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819367208	FE	On-Demand	Anodyne	LTA4H	25	49
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819367208	FE	On-Demand	Anodyne	HRH3	15	44
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819367208	FE	On-Demand	Anodyne	SIGMAR1	45	52
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819367208	FE	On-Demand	Anodyne	CCR5	24	41
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819367208	FE	On-Demand	Anodyne	DPP7	42	36
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819367208	FE	On-Demand	Anodyne	SCD	18	40
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819367208	FE	On-Demand	Anodyne	NPFFR1	40	35
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819367212	EG	On-Demand	Mild	ADRB1	21	42
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819367212	EG	On-Demand	Mild	ADRB3	42	42
C=CC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819367214	EG	On-Demand	Mild	ADRB1	21	42
C=CC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819367214	EG	On-Demand	Mild	ADRB3	42	42
C#CCNC(=O)CCNCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000819367221	FC	On-Demand	Mild	SIGMAR1	22	45
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COC2CCOCC2)C1	ZINC000819367224	FD	On-Demand	Anodyne	TGM2	25	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COC2CCOCC2)C1	ZINC000819367224	FD	On-Demand	Anodyne	NPR	42	32
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COC2CCOCC2)C1	ZINC000819367224	FD	On-Demand	Anodyne	F13A1	27	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COC2CCOCC2)C1	ZINC000819367226	FD	On-Demand	Anodyne	TGM2	25	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COC2CCOCC2)C1	ZINC000819367226	FD	On-Demand	Anodyne	NPR	42	32
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COC2CCOCC2)C1	ZINC000819367226	FD	On-Demand	Anodyne	F13A1	27	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819367239	FF	On-Demand	Anodyne	GRIN2B	19	40
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819367239	FF	On-Demand	Anodyne	TGM2	35	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2c(F)cccc2F)C1	ZINC000819367239	FF	On-Demand	Anodyne	F13A1	33	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819367241	FF	On-Demand	Anodyne	GRIN2B	19	40
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819367241	FF	On-Demand	Anodyne	TGM2	35	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000819367241	FF	On-Demand	Anodyne	F13A1	33	41
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1cccc(F)c1	ZINC000819367245	DE	On-Demand	Anodyne	ADRB1	27	40
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1cccc(F)c1	ZINC000819367245	DE	On-Demand	Anodyne	ADRB3	54	51
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccc(F)c1	ZINC000819367246	DE	On-Demand	Anodyne	ADRB1	27	40
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccc(F)c1	ZINC000819367246	DE	On-Demand	Anodyne	ADRB3	54	51
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)c3ccccc3F)CC[C@H]2C1	ZINC000819367266	GG	On-Demand	Anodyne	GPR119	29	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)c3ccccc3F)C[C@H]2C1	ZINC000819367268	GG	On-Demand	Anodyne	GPR119	29	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)c3ccccc3F)C[C@H]2C1	ZINC000819367269	GG	On-Demand	Anodyne	GPR119	29	45
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)c3ccccc3F)CC[C@H]2C1	ZINC000819367270	GG	On-Demand	Anodyne	GPR119	29	45
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)Cc3ccc(F)cc3)CC[C@H]2C1	ZINC000819367284	GG	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)Cc3ccc(F)cc3)CC[C@H]2C1	ZINC000819367285	GG	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)Cc3ccc(F)cc3)C[C@H]2C1	ZINC000819367286	GG	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)Cc3ccc(F)cc3)C[C@H]2C1	ZINC000819367287	GG	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](O)c3ccc(F)cc3F)C[C@H]2C1	ZINC000819367338	GH	On-Demand	Anodyne	GPR119	30	44
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@H](O)c3ccc(F)cc3F)CC[C@H]2C1	ZINC000819367339	GH	On-Demand	Anodyne	GPR119	30	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](O)c3ccc(F)cc3F)C[C@H]2C1	ZINC000819367340	GH	On-Demand	Anodyne	GPR119	30	44
CC(C)(C)OC(=O)N1C[C@H]2C[C@@H](NC[C@@H](O)c3ccc(F)cc3F)CC[C@H]2C1	ZINC000819367341	GH	On-Demand	Anodyne	GPR119	30	44
CN1CCC(CNC[C@H](O)c2cccnc2)(N2CCOCC2)CC1	ZINC000819367362	EC	On-Demand	Anodyne	ADRB3	72	40
CN1CCC(CNC[C@H](O)c2cccnc2)(N2CCOCC2)CC1	ZINC000819367362	EC	On-Demand	Anodyne	SCD	16	40
CN1CCC(CNC[C@@H](O)c2cccnc2)(N2CCOCC2)CC1	ZINC000819367363	EC	On-Demand	Anodyne	ADRB3	72	40
CN1CCC(CNC[C@@H](O)c2cccnc2)(N2CCOCC2)CC1	ZINC000819367363	EC	On-Demand	Anodyne	SCD	16	40
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819367378	FD	On-Demand	Bother	CACNA1D	40	35
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819367378	FD	On-Demand	Bother	COLA	54	38
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819367379	FD	On-Demand	Bother	CACNA1D	40	35
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819367379	FD	On-Demand	Bother	COLA	54	38
Cc1noc(C)c1CCCNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819367390	FH	On-Demand	Anodyne	MTNR1A	21	45
Cc1noc(C)c1CCCNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819367390	FH	On-Demand	Anodyne	MTNR1B	23	45
Cc1noc(C)c1CCCNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819367390	FH	On-Demand	Anodyne	CRTM	46	42
C[C@@H]1C[C@H](NC[C@@H](O)c2cccnc2)CS1	ZINC000819367396	BD	On-Demand	Anodyne	ADRB3	79	45
C[C@@H]1C[C@H](NC[C@H](O)c2cccnc2)CS1	ZINC000819367398	BD	On-Demand	Anodyne	ADRB3	79	45
O=C1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)N1	ZINC000819367416	FE	On-Demand	Bother	CACNA1C	58	39
O=C1CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)N1	ZINC000819367416	FE	On-Demand	Bother	CACNA1D	89	39
O=C1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)N1	ZINC000819367419	FE	On-Demand	Bother	CACNA1C	58	39
O=C1CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)N1	ZINC000819367419	FE	On-Demand	Bother	CACNA1D	89	39
CC[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367448	CD	On-Demand	Anodyne	GRIN2B	24	42
CC[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367448	CD	On-Demand	Anodyne	CTSB	46	39
CC[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367448	CD	On-Demand	Anodyne	PREP	24	40
CC[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367448	CD	On-Demand	Anodyne	CAPNS1	55	32
CC[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367448	CD	On-Demand	Anodyne	CAPN1	61	35
CC[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367448	CD	On-Demand	Anodyne	CAPN2	104	37
CC[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367448	CD	On-Demand	Anodyne	TGM2	38	43
CC[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367448	CD	On-Demand	Anodyne	NPR	61	37
CC[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367448	CD	On-Demand	Anodyne	F13A1	34	43
CC[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367448	CD	On-Demand	Anodyne	CCR8	18	40
CC[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367448	CD	On-Demand	Anodyne	BIRC2	19	48
CC[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367448	CD	On-Demand	Anodyne	Q6PRC7_IXORI	41	35
CC[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367448	CD	On-Demand	Anodyne	SLC12A5	52	36
O=C(CCNC1CN(C(=O)OCc2ccccc2)C1)Nc1ccccc1F	ZINC000819367498	FF	On-Demand	Anodyne	TGM2	33	41
O=C(CCNC1CN(C(=O)OCc2ccccc2)C1)Nc1ccccc1F	ZINC000819367498	FF	On-Demand	Anodyne	F13A1	35	41
CCN1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819367508	BC	On-Demand	Anodyne	ADRB1	25	40
CCN1CC[C@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819367508	BC	On-Demand	Anodyne	ADRB3	75	49
CCN1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819367509	BC	On-Demand	Anodyne	ADRB1	25	40
CCN1CC[C@H](NC[C@H](O)c2cccnc2)C1	ZINC000819367509	BC	On-Demand	Anodyne	ADRB3	75	49
O=C(OCc1ccccc1)N1CC(NCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819367521	GE	On-Demand	Anodyne	GRIN2B	17	41
O=C(OCc1ccccc1)N1CC(NCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819367521	GE	On-Demand	Anodyne	MMP2	15	42
O=C(OCc1ccccc1)N1CC(NCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819367521	GE	On-Demand	Anodyne	MMP3	15	45
O=C(OCc1ccccc1)N1CC(NCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819367521	GE	On-Demand	Anodyne	TGM2	46	47
O=C(OCc1ccccc1)N1CC(NCCS(=O)(=O)c2ccc(F)cc2)C1	ZINC000819367521	GE	On-Demand	Anodyne	F13A1	53	47
O=C(CCNC1CN(C(=O)OCc2ccccc2)C1)Nc1cccnc1	ZINC000819367527	FE	On-Demand	Anodyne	GRIN2B	20	58
O=C(CCNC1CN(C(=O)OCc2ccccc2)C1)Nc1cccnc1	ZINC000819367527	FE	On-Demand	Anodyne	TGM2	40	43
O=C(CCNC1CN(C(=O)OCc2ccccc2)C1)Nc1cccnc1	ZINC000819367527	FE	On-Demand	Anodyne	F13A1	41	43
O=C(CCNC1CN(C(=O)OCc2ccccc2)C1)Nc1cccnc1	ZINC000819367527	FE	On-Demand	Anodyne	NAMPT	36	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367529	GD	On-Demand	Anodyne	GRIN2B	20	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367529	GD	On-Demand	Anodyne	CTSK	25	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367529	GD	On-Demand	Anodyne	PREP	27	46
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367529	GD	On-Demand	Anodyne	CAPN2	63	33
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367529	GD	On-Demand	Anodyne	KLK5	32	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367529	GD	On-Demand	Anodyne	NPR	59	36
CC(C)(C)OC(=O)NC[C@](C)(O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367530	GD	On-Demand	Anodyne	GRIN2B	20	42
CC(C)(C)OC(=O)NC[C@](C)(O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367530	GD	On-Demand	Anodyne	CTSK	25	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367530	GD	On-Demand	Anodyne	PREP	27	46
CC(C)(C)OC(=O)NC[C@](C)(O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367530	GD	On-Demand	Anodyne	CAPN2	63	33
CC(C)(C)OC(=O)NC[C@](C)(O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367530	GD	On-Demand	Anodyne	KLK5	32	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367530	GD	On-Demand	Anodyne	NPR	59	36
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccccc2F)C1	ZINC000819367533	EE	On-Demand	Anodyne	GRIN2B	20	40
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccccc2F)C1	ZINC000819367533	EE	On-Demand	Anodyne	TGM2	38	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccccc2F)C1	ZINC000819367533	EE	On-Demand	Anodyne	F13A1	32	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccccc2F)C1	ZINC000819367535	EE	On-Demand	Anodyne	GRIN2B	20	40
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccccc2F)C1	ZINC000819367535	EE	On-Demand	Anodyne	TGM2	38	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccccc2F)C1	ZINC000819367535	EE	On-Demand	Anodyne	F13A1	32	41
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1ccccc1	ZINC000819367569	DD	On-Demand	Anodyne	ADRB3	55	43
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1ccccc1	ZINC000819367570	DD	On-Demand	Anodyne	ADRB3	55	43
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819367573	FD	On-Demand	Anodyne	ADRB2	22	41
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819367573	FD	On-Demand	Anodyne	ADRB1	31	44
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819367573	FD	On-Demand	Anodyne	ADRB3	102	45
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819367573	FD	On-Demand	Anodyne	SIGMAR1	21	42
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819367573	FD	On-Demand	Anodyne	NAMPT	24	41
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819367574	FD	On-Demand	Anodyne	ADRB2	22	41
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819367574	FD	On-Demand	Anodyne	ADRB1	31	44
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819367574	FD	On-Demand	Anodyne	ADRB3	102	45
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819367574	FD	On-Demand	Anodyne	SIGMAR1	21	42
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819367574	FD	On-Demand	Anodyne	NAMPT	24	41
O[C@@H](CNCC1(c2c(F)cccc2F)CCC1)c1cccnc1	ZINC000819367587	DG	On-Demand	Anodyne	ADRB2	22	41
O[C@@H](CNCC1(c2c(F)cccc2F)CCC1)c1cccnc1	ZINC000819367587	DG	On-Demand	Anodyne	ADRB1	23	43
O[C@@H](CNCC1(c2c(F)cccc2F)CCC1)c1cccnc1	ZINC000819367587	DG	On-Demand	Anodyne	ADRB3	93	43
O[C@H](CNCC1(c2c(F)cccc2F)CCC1)c1cccnc1	ZINC000819367588	DG	On-Demand	Anodyne	ADRB2	22	41
O[C@H](CNCC1(c2c(F)cccc2F)CCC1)c1cccnc1	ZINC000819367588	DG	On-Demand	Anodyne	ADRB1	23	43
O[C@H](CNCC1(c2c(F)cccc2F)CCC1)c1cccnc1	ZINC000819367588	DG	On-Demand	Anodyne	ADRB3	93	43
Cc1noc(C)c1CCCNC(=O)Cc1nsc2ccccc12	ZINC000819367591	EG	On-Demand	Anodyne	P2RX7	15	50
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CS1	ZINC000819367599	GF	On-Demand	Anodyne	CTSD	97	45
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CS1	ZINC000819367599	GF	On-Demand	Anodyne	PGC	59	38
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CS1	ZINC000819367599	GF	On-Demand	Anodyne	PAPA1_CARPA	32	42
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CS1	ZINC000819367599	GF	On-Demand	Anodyne	BACE2	55	45
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CS1	ZINC000819367599	GF	On-Demand	Anodyne	REN	80	46
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CS1	ZINC000819367599	GF	On-Demand	Anodyne	REN1	23	45
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CS1	ZINC000819367599	GF	On-Demand	Anodyne	BACE1	80	45
C[C@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CS1	ZINC000819367599	GF	On-Demand	Anodyne	FPR1	52	39
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CS1	ZINC000819367601	GF	On-Demand	Anodyne	CTSD	97	45
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CS1	ZINC000819367601	GF	On-Demand	Anodyne	PGC	59	38
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CS1	ZINC000819367601	GF	On-Demand	Anodyne	PAPA1_CARPA	32	42
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CS1	ZINC000819367601	GF	On-Demand	Anodyne	BACE2	55	45
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CS1	ZINC000819367601	GF	On-Demand	Anodyne	REN	80	46
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CS1	ZINC000819367601	GF	On-Demand	Anodyne	REN1	23	45
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CS1	ZINC000819367601	GF	On-Demand	Anodyne	BACE1	80	45
C[C@@H]1C[C@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CS1	ZINC000819367601	GF	On-Demand	Anodyne	FPR1	52	39
COCC[C@@H](C)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819367620	CD	On-Demand	Bother	CACNA1C	55	41
COCC[C@@H](C)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819367620	CD	On-Demand	Bother	CACNA1D	87	41
COCC[C@H](C)CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819367621	CD	On-Demand	Bother	CACNA1C	55	41
COCC[C@H](C)CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819367621	CD	On-Demand	Bother	CACNA1D	87	41
COCC[C@@H](C)CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819367622	CD	On-Demand	Bother	CACNA1C	55	41
COCC[C@@H](C)CNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819367622	CD	On-Demand	Bother	CACNA1D	87	41
COCC[C@H](C)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819367623	CD	On-Demand	Bother	CACNA1C	55	41
COCC[C@H](C)CNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819367623	CD	On-Demand	Bother	CACNA1D	87	41
CCn1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819367662	CD	On-Demand	Bother	CACNA1D	49	32
CCn1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)n1	ZINC000819367663	CD	On-Demand	Bother	CACNA1D	49	32
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1	ZINC000819367671	GF	On-Demand	Anodyne	ADRB1	46	36
CCOc1ccc(OC[C@H](O)CNC[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1	ZINC000819367672	GF	On-Demand	Anodyne	ADRB1	46	36
CC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1	ZINC000819367679	GE	On-Demand	Anodyne	ADRB1	50	38
CC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1	ZINC000819367680	GE	On-Demand	Anodyne	ADRB1	50	38
COCC[C@@H](C)CNC[C@@H](O)c1cccc(F)c1	ZINC000819367698	CE	On-Demand	Anodyne	ADRB1	22	42
COCC[C@@H](C)CNC[C@@H](O)c1cccc(F)c1	ZINC000819367698	CE	On-Demand	Anodyne	ADRB3	25	42
COCC[C@H](C)CNC[C@H](O)c1cccc(F)c1	ZINC000819367699	CE	On-Demand	Anodyne	ADRB1	22	42
COCC[C@H](C)CNC[C@H](O)c1cccc(F)c1	ZINC000819367699	CE	On-Demand	Anodyne	ADRB3	25	42
COCC[C@@H](C)CNC[C@H](O)c1cccc(F)c1	ZINC000819367700	CE	On-Demand	Anodyne	ADRB1	22	42
COCC[C@@H](C)CNC[C@H](O)c1cccc(F)c1	ZINC000819367700	CE	On-Demand	Anodyne	ADRB3	25	42
COCC[C@H](C)CNC[C@@H](O)c1cccc(F)c1	ZINC000819367701	CE	On-Demand	Anodyne	ADRB1	22	42
COCC[C@H](C)CNC[C@@H](O)c1cccc(F)c1	ZINC000819367701	CE	On-Demand	Anodyne	ADRB3	25	42
CN(Cc1ccc(O)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819367708	FF	On-Demand	Mild	CTSB	39	44
CN(Cc1ccc(O)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819367708	FF	On-Demand	Mild	PAPA1_CARPA	57	56
CN(Cc1ccc(O)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819367708	FF	On-Demand	Mild	CTSK	19	41
CN(Cc1ccc(O)cc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819367708	FF	On-Demand	Mild	CTSL	15	41
CN(Cc1ccc(O)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819367709	FF	On-Demand	Mild	CTSB	39	44
CN(Cc1ccc(O)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819367709	FF	On-Demand	Mild	PAPA1_CARPA	57	56
CN(Cc1ccc(O)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819367709	FF	On-Demand	Mild	CTSK	19	41
CN(Cc1ccc(O)cc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819367709	FF	On-Demand	Mild	CTSL	15	41
O=C(CCNCCS(=O)(=O)C1CC1)Nc1cccnc1	ZINC000819367712	CC	On-Demand	Anodyne	NAMPT	47	40
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCC(O)CC2)c(C#N)c1	ZINC000819367719	EG	On-Demand	Mild	NPY2R	47	40
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCC(O)CC2)c(C#N)c1	ZINC000819367719	EG	On-Demand	Mild	PFKFB3	47	31
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCC(O)CC2)c(C#N)c1	ZINC000819367721	EG	On-Demand	Mild	NPY2R	47	40
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCC(O)CC2)c(C#N)c1	ZINC000819367721	EG	On-Demand	Mild	PFKFB3	47	31
COC1([C@@H](C)NC[C@@H](O)c2cccc(Br)c2)CCC1	ZINC000819367744	EG	On-Demand	Anodyne	ADRB2	20	45
COC1([C@H](C)NC[C@H](O)c2cccc(Br)c2)CCC1	ZINC000819367746	EG	On-Demand	Anodyne	ADRB2	20	45
COC1([C@@H](C)NC[C@H](O)c2cccc(Br)c2)CCC1	ZINC000819367748	EG	On-Demand	Anodyne	ADRB2	20	45
COC1([C@H](C)NC[C@@H](O)c2cccc(Br)c2)CCC1	ZINC000819367750	EG	On-Demand	Anodyne	ADRB2	20	45
O=S(=O)(CCNC[C@@H](O)COc1cc(Cl)ccc1Cl)C1CC1	ZINC000819367774	FD	On-Demand	Anodyne	ADRB2	24	41
O=S(=O)(CCNC[C@@H](O)COc1cc(Cl)ccc1Cl)C1CC1	ZINC000819367774	FD	On-Demand	Anodyne	ADRB1	47	41
O=S(=O)(CCNC[C@H](O)COc1cc(Cl)ccc1Cl)C1CC1	ZINC000819367776	FD	On-Demand	Anodyne	ADRB2	24	41
O=S(=O)(CCNC[C@H](O)COc1cc(Cl)ccc1Cl)C1CC1	ZINC000819367776	FD	On-Demand	Anodyne	ADRB1	47	41
CC(C)(C)[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367780	DE	On-Demand	Anodyne	GHRHR	43	32
CC(C)(C)[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367780	DE	On-Demand	Anodyne	GRIN2B	24	44
CC(C)(C)[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367780	DE	On-Demand	Anodyne	CTSB	34	41
CC(C)(C)[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367780	DE	On-Demand	Anodyne	CYSP_TRYCR	41	35
CC(C)(C)[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367780	DE	On-Demand	Anodyne	CTSK	32	41
CC(C)(C)[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367780	DE	On-Demand	Anodyne	CTSL	38	41
CC(C)(C)[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367780	DE	On-Demand	Anodyne	CAPNS1	41	30
CC(C)(C)[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367780	DE	On-Demand	Anodyne	GHSR	32	40
CC(C)(C)[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367780	DE	On-Demand	Anodyne	CAPN1	40	36
CC(C)(C)[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367780	DE	On-Demand	Anodyne	CAPN2	60	34
CC(C)(C)[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367780	DE	On-Demand	Anodyne	TGM2	37	43
CC(C)(C)[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367780	DE	On-Demand	Anodyne	NPR	59	35
CC(C)(C)[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367780	DE	On-Demand	Anodyne	F13A1	33	43
CC(C)(C)[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367780	DE	On-Demand	Anodyne	BIRC2	27	49
CC(C)(C)[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819367780	DE	On-Demand	Anodyne	SLC12A5	57	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](O)COc1cccc(C)c1)C2	ZINC000819367781	GD	On-Demand	Anodyne	ADRB2	15	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](O)COc1cccc(C)c1)C2	ZINC000819367781	GD	On-Demand	Anodyne	ADRB1	18	45
C=CC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(F)cc1	ZINC000819367783	CH	On-Demand	Mild	ADRB3	21	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](O)COc1cccc(C)c1)C2	ZINC000819367784	GD	On-Demand	Anodyne	ADRB2	15	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](O)COc1cccc(C)c1)C2	ZINC000819367784	GD	On-Demand	Anodyne	ADRB1	18	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](O)COc1cccc(C)c1)C2	ZINC000819367786	GD	On-Demand	Anodyne	ADRB2	15	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](O)COc1cccc(C)c1)C2	ZINC000819367786	GD	On-Demand	Anodyne	ADRB1	18	45
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(F)cc1	ZINC000819367788	CH	On-Demand	Mild	ADRB3	21	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](O)COc1cccc(C)c1)C2	ZINC000819367789	GD	On-Demand	Anodyne	ADRB2	15	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](O)COc1cccc(C)c1)C2	ZINC000819367789	GD	On-Demand	Anodyne	ADRB1	18	45
COCC1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819367790	CD	On-Demand	Anodyne	ADRB1	23	41
COCC1CCC(NC[C@@H](O)c2cccnc2)CC1	ZINC000819367790	CD	On-Demand	Anodyne	ADRB3	66	46
COCC1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819367791	CD	On-Demand	Anodyne	ADRB1	23	41
COCC1CCC(NC[C@H](O)c2cccnc2)CC1	ZINC000819367791	CD	On-Demand	Anodyne	ADRB3	66	46
CN(C[C@H](O)C1CC1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819367806	ED	On-Demand	Mild	PAPA1_CARPA	32	42
CN(C[C@H](O)C1CC1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819367809	ED	On-Demand	Mild	PAPA1_CARPA	32	42
O=C(NC[C@H](O)Cc1ccccc1)C(F)=C1CCC1	ZINC000819367814	CE	On-Demand	Anodyne	MME	51	39
O=C(NC[C@@H](O)Cc1ccccc1)C(F)=C1CCC1	ZINC000819367816	CE	On-Demand	Anodyne	MME	51	39
CC(C)(C)OC(=O)NC1(CNCCC#N)CCN(Cc2ccccc2)CC1	ZINC000819367826	FG	On-Demand	Mild	SIGMAR1	42	40
CC(C)(C)OC(=O)NC1(CNCCC#N)CCN(Cc2ccccc2)CC1	ZINC000819367826	FG	On-Demand	Mild	NPFFR2	36	44
CC(C)(C)OC(=O)NC1(CNCCC#N)CCN(Cc2ccccc2)CC1	ZINC000819367826	FG	On-Demand	Mild	NPFFR1	47	39
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccc(F)cc1	ZINC000819367838	EF	On-Demand	Anodyne	ADRB1	32	40
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccc(F)cc1	ZINC000819367838	EF	On-Demand	Anodyne	ADRB3	50	42
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccc(F)cc1	ZINC000819367838	EF	On-Demand	Anodyne	IGF1R	29	40
O=C1[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccc(F)cc1	ZINC000819367838	EF	On-Demand	Anodyne	CYP3A4	51	40
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccc(F)cc1	ZINC000819367839	EF	On-Demand	Anodyne	ADRB1	32	40
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccc(F)cc1	ZINC000819367839	EF	On-Demand	Anodyne	ADRB3	50	42
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccc(F)cc1	ZINC000819367839	EF	On-Demand	Anodyne	IGF1R	29	40
O=C1[C@H](NC[C@@H](O)c2cccc(Cl)c2)CCN1c1ccc(F)cc1	ZINC000819367839	EF	On-Demand	Anodyne	CYP3A4	51	40
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccc(F)cc1	ZINC000819367841	EF	On-Demand	Anodyne	ADRB1	32	40
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccc(F)cc1	ZINC000819367841	EF	On-Demand	Anodyne	ADRB3	50	42
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccc(F)cc1	ZINC000819367841	EF	On-Demand	Anodyne	IGF1R	29	40
O=C1[C@@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccc(F)cc1	ZINC000819367841	EF	On-Demand	Anodyne	CYP3A4	51	40
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccc(F)cc1	ZINC000819367843	EF	On-Demand	Anodyne	ADRB1	32	40
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccc(F)cc1	ZINC000819367843	EF	On-Demand	Anodyne	ADRB3	50	42
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccc(F)cc1	ZINC000819367843	EF	On-Demand	Anodyne	IGF1R	29	40
O=C1[C@H](NC[C@H](O)c2cccc(Cl)c2)CCN1c1ccc(F)cc1	ZINC000819367843	EF	On-Demand	Anodyne	CYP3A4	51	40
O=S(=O)(CCNC[C@H](O)COCc1ccccc1)C1CC1	ZINC000819367847	DC	On-Demand	Anodyne	ADRB2	33	42
O=S(=O)(CCNC[C@H](O)COCc1ccccc1)C1CC1	ZINC000819367847	DC	On-Demand	Anodyne	ADRB1	58	42
O=S(=O)(CCNC[C@H](O)COCc1ccccc1)C1CC1	ZINC000819367847	DC	On-Demand	Anodyne	ADRB3	36	42
O=S(=O)(CCNC[C@H](O)COCc1ccccc1)C1CC1	ZINC000819367847	DC	On-Demand	Anodyne	CAPN2	41	38
O=S(=O)(CCNC[C@@H](O)COCc1ccccc1)C1CC1	ZINC000819367848	DC	On-Demand	Anodyne	ADRB2	33	42
O=S(=O)(CCNC[C@@H](O)COCc1ccccc1)C1CC1	ZINC000819367848	DC	On-Demand	Anodyne	ADRB1	58	42
O=S(=O)(CCNC[C@@H](O)COCc1ccccc1)C1CC1	ZINC000819367848	DC	On-Demand	Anodyne	ADRB3	36	42
O=S(=O)(CCNC[C@@H](O)COCc1ccccc1)C1CC1	ZINC000819367848	DC	On-Demand	Anodyne	CAPN2	41	38
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccc(F)cn3)cc2)CC1	ZINC000819367849	GD	On-Demand	Anodyne	SIGMAR1	22	42
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819367850	EE	On-Demand	Anodyne	ADRB1	21	40
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2cccc(Br)c2)C1	ZINC000819367850	EE	On-Demand	Anodyne	ADRB3	36	42
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccc(F)cn3)cc2)CC1	ZINC000819367851	GD	On-Demand	Anodyne	SIGMAR1	22	42
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819367852	EE	On-Demand	Anodyne	ADRB1	21	40
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2cccc(Br)c2)C1	ZINC000819367852	EE	On-Demand	Anodyne	ADRB3	36	42
O=C1CCc2cc(OC[C@H](O)CNCCS(=O)(=O)C3CC3)ccc2N1	ZINC000819367854	FC	On-Demand	Anodyne	ADRB1	51	41
O=C1CCc2cc(OC[C@H](O)CNCCS(=O)(=O)C3CC3)ccc2N1	ZINC000819367854	FC	On-Demand	Anodyne	ADRB3	33	41
O=C1CCc2cc(OC[C@@H](O)CNCCS(=O)(=O)C3CC3)ccc2N1	ZINC000819367856	FC	On-Demand	Anodyne	ADRB1	51	41
O=C1CCc2cc(OC[C@@H](O)CNCCS(=O)(=O)C3CC3)ccc2N1	ZINC000819367856	FC	On-Demand	Anodyne	ADRB3	33	41
CC(C)(C)OC(=O)NC1(CNCCC(N)=O)CCN(Cc2ccccc2)CC1	ZINC000819367857	GE	On-Demand	Anodyne	ACHE	26	40
CC(C)(C)OC(=O)NC1(CNCCC(N)=O)CCN(Cc2ccccc2)CC1	ZINC000819367857	GE	On-Demand	Anodyne	SIGMAR1	45	43
CC(C)(C)OC(=O)NC1(CNCCC(N)=O)CCN(Cc2ccccc2)CC1	ZINC000819367857	GE	On-Demand	Anodyne	NPFFR2	42	44
CC(C)(C)OC(=O)NC1(CNCCC(N)=O)CCN(Cc2ccccc2)CC1	ZINC000819367857	GE	On-Demand	Anodyne	NPFFR1	53	46
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819367874	BD	On-Demand	Anodyne	SLC6A3	48	47
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819367874	BD	On-Demand	Anodyne	ADRB3	46	38
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819367874	BD	On-Demand	Anodyne	AOC3	15	43
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819367874	BD	On-Demand	Anodyne	ACHP_LYMST	21	43
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2ccccc2)C1	ZINC000819367874	BD	On-Demand	Anodyne	Q8WSF8_APLCA	44	43
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819367875	BD	On-Demand	Anodyne	SLC6A3	48	47
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819367875	BD	On-Demand	Anodyne	ADRB3	46	38
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819367875	BD	On-Demand	Anodyne	AOC3	15	43
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819367875	BD	On-Demand	Anodyne	ACHP_LYMST	21	43
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2ccccc2)C1	ZINC000819367875	BD	On-Demand	Anodyne	Q8WSF8_APLCA	44	43
C=CC[C@H](Cc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819367876	CF	On-Demand	Mild	ADRB2	26	44
C=CC[C@H](Cc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819367876	CF	On-Demand	Mild	ADRB1	26	53
C=CC[C@H](Cc1ccccc1)NC[C@H](O)c1cccnc1	ZINC000819367876	CF	On-Demand	Mild	ADRB3	93	53
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819367877	CF	On-Demand	Mild	ADRB2	26	44
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819367877	CF	On-Demand	Mild	ADRB1	26	53
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccnc1	ZINC000819367877	CF	On-Demand	Mild	ADRB3	93	53
O=C(OCc1ccccc1)N1CC(NCCS(=O)(=O)c2ccccc2)C1	ZINC000819367880	FE	On-Demand	Anodyne	GRIN2B	22	42
O=C(OCc1ccccc1)N1CC(NCCS(=O)(=O)c2ccccc2)C1	ZINC000819367880	FE	On-Demand	Anodyne	MMP3	15	46
O=C(OCc1ccccc1)N1CC(NCCS(=O)(=O)c2ccccc2)C1	ZINC000819367880	FE	On-Demand	Anodyne	TGM2	51	48
O=C(OCc1ccccc1)N1CC(NCCS(=O)(=O)c2ccccc2)C1	ZINC000819367880	FE	On-Demand	Anodyne	F13A1	55	48
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819367942	FF	On-Demand	Anodyne	ADRB3	41	44
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819367942	FF	On-Demand	Anodyne	CCR2	37	44
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819367943	FF	On-Demand	Anodyne	ADRB3	41	44
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819367943	FF	On-Demand	Anodyne	CCR2	37	44
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)cc1	ZINC000819367951	GH	On-Demand	Anodyne	ADRB3	20	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CC[C@@H](c3ccc(Cl)cc3)C2)cc1	ZINC000819367952	GH	On-Demand	Anodyne	ADRB3	20	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CC[C@H](c3ccc(Cl)cc3)C2)cc1	ZINC000819367953	GH	On-Demand	Anodyne	ADRB3	20	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CC[C@@H](c3ccc(Cl)cc3)C2)cc1	ZINC000819367954	GH	On-Demand	Anodyne	ADRB3	20	40
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819367968	FF	On-Demand	Anodyne	ADRB3	35	41
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819367969	FF	On-Demand	Anodyne	ADRB3	35	41
C[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CS1	ZINC000819367983	CF	On-Demand	Anodyne	ADRB1	31	42
C[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CS1	ZINC000819367983	CF	On-Demand	Anodyne	ADRB3	50	45
C[C@@H]1C[C@H](NC[C@H](O)c2cccc(Cl)c2)CS1	ZINC000819367983	CF	On-Demand	Anodyne	CYP3A4	44	35
C[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CS1	ZINC000819367984	CF	On-Demand	Anodyne	ADRB1	31	42
C[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CS1	ZINC000819367984	CF	On-Demand	Anodyne	ADRB3	50	45
C[C@@H]1C[C@H](NC[C@@H](O)c2cccc(Cl)c2)CS1	ZINC000819367984	CF	On-Demand	Anodyne	CYP3A4	44	35
O=[N+]([O-])c1cccc([C@H](O)CNCCS(=O)(=O)C2CC2)c1	ZINC000819368032	DC	On-Demand	Bother	ADRB3	44	38
O=[N+]([O-])c1cccc([C@@H](O)CNCCS(=O)(=O)C2CC2)c1	ZINC000819368035	DC	On-Demand	Bother	ADRB3	44	38
N#Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819368054	DC	On-Demand	Mild	ADRB2	45	43
N#Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819368054	DC	On-Demand	Mild	ADRB1	82	43
N#Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819368054	DC	On-Demand	Mild	ADRB3	48	43
N#Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819368062	DC	On-Demand	Mild	ADRB2	45	43
N#Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819368062	DC	On-Demand	Mild	ADRB1	82	43
N#Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819368062	DC	On-Demand	Mild	ADRB3	48	43
COCC1CCC(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819368075	ED	On-Demand	Anodyne	ADRB3	24	42
COCC1CCC(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819368077	ED	On-Demand	Anodyne	ADRB3	24	42
COc1cccc([S@@](=O)CC(=O)Oc2ccc(NC(=O)C(C)C)cc2)c1	ZINC000819368087	GG	On-Demand	Anodyne	MTNR1A	34	53
COc1cccc([S@@](=O)CC(=O)Oc2ccc(NC(=O)C(C)C)cc2)c1	ZINC000819368087	GG	On-Demand	Anodyne	MTNR1B	35	59
COc1cccc([S@@](=O)CC(=O)Oc2ccc(NC(=O)C(C)C)cc2)c1	ZINC000819368087	GG	On-Demand	Anodyne	ACR	51	42
C=CC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(C#N)cc1	ZINC000819368109	DG	On-Demand	Mild	CTRB_BOVIN	44	31
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	CTSD	131	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	PGC	65	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	CMA1	32	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	CTRA_BOVIN	21	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	PAPA1_CARPA	47	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	CTSK	24	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	CTSL	24	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	PGA	61	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	BACE2	59	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	TACR3	18	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	CAPNS1	50	32
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	REN	102	52
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	REN1	37	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	CAPN1	35	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	BACE1	104	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	FPR1	64	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	PLM1_PLAFA	37	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	PLM2_PLAFA	74	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	GAG-PRO	66	33
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1CC1(C)C	ZINC000819368144	EF	On-Demand	Anodyne	Q82323_9DELA	78	34
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819368150	FE	On-Demand	Bother	TGM2	27	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819368150	FE	On-Demand	Bother	F13A1	30	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819368155	FE	On-Demand	Bother	TGM2	27	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000819368155	FE	On-Demand	Bother	F13A1	30	41
CC(C)(C)OC(=O)N1CCc2c(NC(=O)C(F)=C3CCC3)cccc21	ZINC000819368182	EI	On-Demand	Anodyne	KCNQ2	49	33
CC(=O)Nc1cccc(CC(=O)Oc2ccc(NC(=O)C(C)C)cc2)c1	ZINC000819368209	FG	On-Demand	Anodyne	TSHR	54	32
CC(=O)Nc1cccc(CC(=O)Oc2ccc(NC(=O)C(C)C)cc2)c1	ZINC000819368209	FG	On-Demand	Anodyne	LTA4H	15	43
CC(=O)Nc1cccc(CC(=O)Oc2ccc(NC(=O)C(C)C)cc2)c1	ZINC000819368209	FG	On-Demand	Anodyne	MTNR1A	28	44
CC(=O)Nc1cccc(CC(=O)Oc2ccc(NC(=O)C(C)C)cc2)c1	ZINC000819368209	FG	On-Demand	Anodyne	MTNR1B	31	49
CC(=O)Nc1cccc(CC(=O)Oc2ccc(NC(=O)C(C)C)cc2)c1	ZINC000819368209	FG	On-Demand	Anodyne	ACR	49	35
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2ccccc2Cl)C1	ZINC000819368213	CD	On-Demand	Anodyne	OPRL1	33	40
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819368215	DD	On-Demand	Anodyne	ADRB2	47	39
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819368215	DD	On-Demand	Anodyne	ADRB1	61	49
O=S(=O)(CCNC[C@@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819368215	DD	On-Demand	Anodyne	ADRB3	85	54
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819368218	DD	On-Demand	Anodyne	ADRB2	47	39
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819368218	DD	On-Demand	Anodyne	ADRB1	61	49
O=S(=O)(CCNC[C@H](O)c1cccc(Cl)c1)C1CC1	ZINC000819368218	DD	On-Demand	Anodyne	ADRB3	85	54
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCC(O)CC3)c(C#N)c2)c1	ZINC000819368233	GF	On-Demand	Mild	HTR1D	26	40
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCC(O)CC3)c(C#N)c2)c1	ZINC000819368233	GF	On-Demand	Mild	HTR1B	25	40
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCC(O)CC3)c(C#N)c2)c1	ZINC000819368233	GF	On-Demand	Mild	CSNK2A1	46	39
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCC(O)CC3)c(C#N)c2)c1	ZINC000819368233	GF	On-Demand	Mild	NPY2R	57	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCS(=O)(=O)C2CC2)CC1	ZINC000819368239	GD	On-Demand	Anodyne	GPR119	41	46
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1	ZINC000819368240	GE	On-Demand	Anodyne	ADRB2	37	44
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1	ZINC000819368240	GE	On-Demand	Anodyne	ADRB1	74	44
CC(=O)Nc1ccc(OC[C@H](O)CNC[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1	ZINC000819368240	GE	On-Demand	Anodyne	ADRB3	66	43
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1	ZINC000819368241	GE	On-Demand	Anodyne	ADRB2	37	44
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1	ZINC000819368241	GE	On-Demand	Anodyne	ADRB1	74	44
CC(=O)Nc1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1	ZINC000819368241	GE	On-Demand	Anodyne	ADRB3	66	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCS(=O)(=O)C2CC2)CC1	ZINC000819368242	GD	On-Demand	Anodyne	GPR119	41	46
CO[C@@H]1C[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1(C)C	ZINC000819368247	FF	On-Demand	Mild	PAPA1_CARPA	39	48
CO[C@@H]1C[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1(C)C	ZINC000819368254	FF	On-Demand	Mild	PAPA1_CARPA	39	48
COc1ccc(OC)c([C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000819368261	GE	On-Demand	Anodyne	TSHR	41	31
COc1ccc(OC)c([C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000819368261	GE	On-Demand	Anodyne	MMP3	15	46
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CC[C@@H](c3ccc(Cl)cc3)C2)c1	ZINC000819368266	FI	On-Demand	Bother	ADRB3	20	40
C=CC[C@H](Cc1ccccc1)NCCC(=O)N(C)OC	ZINC000819368267	CE	On-Demand	Mild	MME	49	38
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CC[C@@H](c3ccc(Cl)cc3)C2)c1	ZINC000819368269	FI	On-Demand	Bother	ADRB3	20	40
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)c1	ZINC000819368273	FI	On-Demand	Bother	ADRB3	20	40
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CC[C@H](c3ccc(Cl)cc3)C2)c1	ZINC000819368276	FI	On-Demand	Bother	ADRB3	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(F)cc1CSC)C2	ZINC000819368286	GG	On-Demand	Anodyne	P2RX7	44	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(F)cc1CSC)C2	ZINC000819368289	GG	On-Demand	Anodyne	P2RX7	44	38
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819368312	CC	On-Demand	Anodyne	ADRB2	18	41
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819368312	CC	On-Demand	Anodyne	ADRB1	27	43
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819368312	CC	On-Demand	Anodyne	ADRB3	91	49
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819368312	CC	On-Demand	Anodyne	KCNA5	24	41
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819368315	CC	On-Demand	Anodyne	ADRB2	18	41
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819368315	CC	On-Demand	Anodyne	ADRB1	27	43
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819368315	CC	On-Demand	Anodyne	ADRB3	91	49
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819368315	CC	On-Demand	Anodyne	KCNA5	24	41
O=C(OCc1ccccc1)N1CC(NCC2(O)CCS(=O)(=O)CC2)C1	ZINC000819368323	FC	On-Demand	Anodyne	GRIN2B	19	40
O=C(OCc1ccccc1)N1CC(NCC2(O)CCS(=O)(=O)CC2)C1	ZINC000819368323	FC	On-Demand	Anodyne	TGM2	29	42
O=C(OCc1ccccc1)N1CC(NCC2(O)CCS(=O)(=O)CC2)C1	ZINC000819368323	FC	On-Demand	Anodyne	F13A1	34	42
O=C(OCc1ccccc1)N1CC(NCC2(O)CCS(=O)(=O)CC2)C1	ZINC000819368323	FC	On-Demand	Anodyne	SLC12A5	56	36
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COc2ccccc2)C1	ZINC000819368332	FE	On-Demand	Anodyne	ADRB2	51	42
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COc2ccccc2)C1	ZINC000819368332	FE	On-Demand	Anodyne	ADRB1	75	44
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COc2ccccc2)C1	ZINC000819368332	FE	On-Demand	Anodyne	GRIN2B	21	43
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COc2ccccc2)C1	ZINC000819368332	FE	On-Demand	Anodyne	ADRB3	55	44
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COc2ccccc2)C1	ZINC000819368332	FE	On-Demand	Anodyne	ABCB1	37	46
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COc2ccccc2)C1	ZINC000819368332	FE	On-Demand	Anodyne	TGM2	35	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COc2ccccc2)C1	ZINC000819368332	FE	On-Demand	Anodyne	DPP7	20	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COc2ccccc2)C1	ZINC000819368332	FE	On-Demand	Anodyne	F13A1	31	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COc2ccccc2)C1	ZINC000819368332	FE	On-Demand	Anodyne	PDS	43	37
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COc2ccccc2)C1	ZINC000819368335	FE	On-Demand	Anodyne	ADRB2	51	42
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COc2ccccc2)C1	ZINC000819368335	FE	On-Demand	Anodyne	ADRB1	75	44
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COc2ccccc2)C1	ZINC000819368335	FE	On-Demand	Anodyne	GRIN2B	21	43
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COc2ccccc2)C1	ZINC000819368335	FE	On-Demand	Anodyne	ADRB3	55	44
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COc2ccccc2)C1	ZINC000819368335	FE	On-Demand	Anodyne	ABCB1	37	46
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COc2ccccc2)C1	ZINC000819368335	FE	On-Demand	Anodyne	TGM2	35	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COc2ccccc2)C1	ZINC000819368335	FE	On-Demand	Anodyne	DPP7	20	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COc2ccccc2)C1	ZINC000819368335	FE	On-Demand	Anodyne	F13A1	31	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COc2ccccc2)C1	ZINC000819368335	FE	On-Demand	Anodyne	PDS	43	37
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819368391	FF	On-Demand	Anodyne	TGM2	37	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819368391	FF	On-Demand	Anodyne	F13A1	35	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819368392	FF	On-Demand	Anodyne	TGM2	37	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2cc(F)ccc2F)C1	ZINC000819368392	FF	On-Demand	Anodyne	F13A1	35	41
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819368409	GE	On-Demand	Anodyne	ADRB1	25	40
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819368409	GE	On-Demand	Anodyne	ADRB3	38	40
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819368409	GE	On-Demand	Anodyne	SIGMAR1	30	47
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819368409	GE	On-Demand	Anodyne	CCR3	49	44
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819368409	GE	On-Demand	Anodyne	MLNR	27	40
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819368409	GE	On-Demand	Anodyne	CACNA1G	38	40
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819368410	GE	On-Demand	Anodyne	ADRB1	25	40
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819368410	GE	On-Demand	Anodyne	ADRB3	38	40
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819368410	GE	On-Demand	Anodyne	SIGMAR1	30	47
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819368410	GE	On-Demand	Anodyne	CCR3	49	44
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819368410	GE	On-Demand	Anodyne	MLNR	27	40
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819368410	GE	On-Demand	Anodyne	CACNA1G	38	40
CC(=O)c1cccc(OC[C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000819368413	GE	On-Demand	Anodyne	ADRB2	31	42
CC(=O)c1cccc(OC[C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000819368413	GE	On-Demand	Anodyne	ADRB1	53	39
CC(=O)c1cccc(OC[C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000819368413	GE	On-Demand	Anodyne	ADRB3	43	42
CC(=O)c1cccc(OC[C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000819368413	GE	On-Demand	Anodyne	ABCB1	35	46
CC(=O)c1cccc(OC[C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000819368413	GE	On-Demand	Anodyne	PDS	68	39
CC(=O)c1cccc(OC[C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000819368414	GE	On-Demand	Anodyne	ADRB2	31	42
CC(=O)c1cccc(OC[C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000819368414	GE	On-Demand	Anodyne	ADRB1	53	39
CC(=O)c1cccc(OC[C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000819368414	GE	On-Demand	Anodyne	ADRB3	43	42
CC(=O)c1cccc(OC[C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000819368414	GE	On-Demand	Anodyne	ABCB1	35	46
CC(=O)c1cccc(OC[C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000819368414	GE	On-Demand	Anodyne	PDS	68	39
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COCc2ccccc2F)C1	ZINC000819368437	GE	On-Demand	Anodyne	GRIN2B	17	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COCc2ccccc2F)C1	ZINC000819368438	GE	On-Demand	Anodyne	GRIN2B	17	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819368439	FF	On-Demand	Anodyne	PREP	24	40
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819368440	FF	On-Demand	Anodyne	PREP	24	40
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccc(F)cc3)C2=O)cc1	ZINC000819368474	GD	On-Demand	Anodyne	PTGS2	26	40
C=CC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819368475	FF	On-Demand	Mild	ADRB1	18	41
C=CC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819368475	FF	On-Demand	Mild	ADRB3	46	52
C=CC[C@H](Cc1ccccc1)NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819368475	FF	On-Demand	Mild	CTSF	41	39
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3ccc(F)cc3)C2=O)cc1	ZINC000819368476	GD	On-Demand	Anodyne	PTGS2	26	40
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819368477	FF	On-Demand	Mild	ADRB1	18	41
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819368477	FF	On-Demand	Mild	ADRB3	46	52
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819368477	FF	On-Demand	Mild	CTSF	41	39
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3ccc(F)cc3)C2=O)cc1	ZINC000819368478	GD	On-Demand	Anodyne	PTGS2	26	40
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3ccc(F)cc3)C2=O)cc1	ZINC000819368480	GD	On-Demand	Anodyne	PTGS2	26	40
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819368487	FE	On-Demand	Bother	CACNA1C	49	42
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819368487	FE	On-Demand	Bother	CACNA1D	74	42
N#Cc1cc(NC(=O)Cc2nsc3ccccc23)ccc1N1CCC(O)CC1	ZINC000819368488	GG	On-Demand	Mild	NPY2R	45	39
N#Cc1cc(NC(=O)Cc2nsc3ccccc23)ccc1N1CCC(O)CC1	ZINC000819368488	GG	On-Demand	Mild	IMDH_CRYPV	29	42
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819368489	FE	On-Demand	Bother	CACNA1C	49	42
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819368489	FE	On-Demand	Bother	CACNA1D	74	42
O=S(=O)(CCNC[C@@H](O)c1cccc(Br)c1)C1CC1	ZINC000819368514	ED	On-Demand	Anodyne	ADRB3	57	40
O=S(=O)(CCNC[C@H](O)c1cccc(Br)c1)C1CC1	ZINC000819368515	ED	On-Demand	Anodyne	ADRB3	57	40
N#CCc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819368516	EC	On-Demand	Mild	ADRB2	46	45
N#CCc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819368516	EC	On-Demand	Mild	ADRB1	87	45
N#CCc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819368516	EC	On-Demand	Mild	GRIN1	18	43
N#CCc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819368516	EC	On-Demand	Mild	ADRB3	55	45
N#CCc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819368518	EC	On-Demand	Mild	ADRB2	46	45
N#CCc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819368518	EC	On-Demand	Mild	ADRB1	87	45
N#CCc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819368518	EC	On-Demand	Mild	GRIN1	18	43
N#CCc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819368518	EC	On-Demand	Mild	ADRB3	55	45
O=S(=O)(CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1)C1CC1	ZINC000819368538	GE	On-Demand	Anodyne	ADRB2	65	47
O=S(=O)(CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1)C1CC1	ZINC000819368538	GE	On-Demand	Anodyne	ADRB1	110	49
O=S(=O)(CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1)C1CC1	ZINC000819368538	GE	On-Demand	Anodyne	ADRB3	80	49
O=S(=O)(CCNC[C@@H](O)COc1ccc(-c2ccccc2)cc1)C1CC1	ZINC000819368538	GE	On-Demand	Anodyne	ABCB1	15	46
O=S(=O)(CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1)C1CC1	ZINC000819368540	GE	On-Demand	Anodyne	ADRB2	65	47
O=S(=O)(CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1)C1CC1	ZINC000819368540	GE	On-Demand	Anodyne	ADRB1	110	49
O=S(=O)(CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1)C1CC1	ZINC000819368540	GE	On-Demand	Anodyne	ADRB3	80	49
O=S(=O)(CCNC[C@H](O)COc1ccc(-c2ccccc2)cc1)C1CC1	ZINC000819368540	GE	On-Demand	Anodyne	ABCB1	15	46
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccccc3F)cc2)CC1	ZINC000819368546	GE	On-Demand	Anodyne	LTA4H	15	43
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccccc3F)cc2)CC1	ZINC000819368546	GE	On-Demand	Anodyne	SIGMAR1	37	47
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccccc3F)cc2)CC1	ZINC000819368548	GE	On-Demand	Anodyne	LTA4H	15	43
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccccc3F)cc2)CC1	ZINC000819368548	GE	On-Demand	Anodyne	SIGMAR1	37	47
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2cccnc2)C1	ZINC000819368557	ED	On-Demand	Anodyne	ADRB2	18	42
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2cccnc2)C1	ZINC000819368557	ED	On-Demand	Anodyne	ADRB1	26	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2cccnc2)C1	ZINC000819368557	ED	On-Demand	Anodyne	GRIN2B	20	52
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2cccnc2)C1	ZINC000819368557	ED	On-Demand	Anodyne	ADRB3	83	46
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2cccnc2)C1	ZINC000819368557	ED	On-Demand	Anodyne	PTAFR	22	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2cccnc2)C1	ZINC000819368557	ED	On-Demand	Anodyne	C3AR1	39	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2cccnc2)C1	ZINC000819368557	ED	On-Demand	Anodyne	TGM2	36	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2cccnc2)C1	ZINC000819368557	ED	On-Demand	Anodyne	F13A1	30	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2cccnc2)C1	ZINC000819368559	ED	On-Demand	Anodyne	ADRB2	18	42
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2cccnc2)C1	ZINC000819368559	ED	On-Demand	Anodyne	ADRB1	26	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2cccnc2)C1	ZINC000819368559	ED	On-Demand	Anodyne	GRIN2B	20	52
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2cccnc2)C1	ZINC000819368559	ED	On-Demand	Anodyne	ADRB3	83	46
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2cccnc2)C1	ZINC000819368559	ED	On-Demand	Anodyne	PTAFR	22	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2cccnc2)C1	ZINC000819368559	ED	On-Demand	Anodyne	C3AR1	39	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2cccnc2)C1	ZINC000819368559	ED	On-Demand	Anodyne	TGM2	36	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2cccnc2)C1	ZINC000819368559	ED	On-Demand	Anodyne	F13A1	30	41
O=S(=O)(CCNC[C@H](O)COCc1ccc(Cl)cc1)C1CC1	ZINC000819368602	ED	On-Demand	Anodyne	ADRB2	19	42
O=S(=O)(CCNC[C@H](O)COCc1ccc(Cl)cc1)C1CC1	ZINC000819368602	ED	On-Demand	Anodyne	ADRB1	40	42
O=S(=O)(CCNC[C@H](O)COCc1ccc(Cl)cc1)C1CC1	ZINC000819368602	ED	On-Demand	Anodyne	ADRB3	27	42
O=S(=O)(CCNC[C@@H](O)COCc1ccc(Cl)cc1)C1CC1	ZINC000819368603	ED	On-Demand	Anodyne	ADRB2	19	42
O=S(=O)(CCNC[C@@H](O)COCc1ccc(Cl)cc1)C1CC1	ZINC000819368603	ED	On-Demand	Anodyne	ADRB1	40	42
O=S(=O)(CCNC[C@@H](O)COCc1ccc(Cl)cc1)C1CC1	ZINC000819368603	ED	On-Demand	Anodyne	ADRB3	27	42
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccccc2S(C)(=O)=O)cc1	ZINC000819368627	GD	On-Demand	Anodyne	ADRB3	33	40
CS(=O)(=O)c1ccc([C@@H](O)CNCc2ccccc2S(C)(=O)=O)cc1	ZINC000819368627	GD	On-Demand	Anodyne	CTSF	48	35
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccccc2S(C)(=O)=O)cc1	ZINC000819368629	GD	On-Demand	Anodyne	ADRB3	33	40
CS(=O)(=O)c1ccc([C@H](O)CNCc2ccccc2S(C)(=O)=O)cc1	ZINC000819368629	GD	On-Demand	Anodyne	CTSF	48	35
C[C@@H]1C[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CN1C1CC1	ZINC000819368643	FE	On-Demand	Mild	PAPA1_CARPA	36	45
C[C@@H]1C[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CN1C1CC1	ZINC000819368644	FE	On-Demand	Mild	PAPA1_CARPA	36	45
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819368646	EF	On-Demand	Anodyne	ADRB2	48	43
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819368646	EF	On-Demand	Anodyne	ADRB1	54	47
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819368646	EF	On-Demand	Anodyne	ADRB3	84	49
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819368647	EF	On-Demand	Anodyne	ADRB2	48	43
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819368647	EF	On-Demand	Anodyne	ADRB1	54	47
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819368647	EF	On-Demand	Anodyne	ADRB3	84	49
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1cccc(Br)c1	ZINC000819368677	GF	On-Demand	Anodyne	ADRB3	45	43
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccc(Br)c1	ZINC000819368680	GF	On-Demand	Anodyne	ADRB3	45	43
CON=Cc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1	ZINC000819368684	DG	On-Demand	Mild	KCNK3	61	36
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819368721	FD	On-Demand	Bother	COLA	69	38
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819368725	FD	On-Demand	Bother	COLA	69	38
O[C@H](CNCc1nccc(C(F)(F)F)n1)c1ccc(F)c(F)c1	ZINC000819368769	EF	On-Demand	Anodyne	TRPV1	49	31
O[C@@H](CNCc1nccc(C(F)(F)F)n1)c1ccc(F)c(F)c1	ZINC000819368770	EF	On-Demand	Anodyne	TRPV1	49	31
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819368783	EE	On-Demand	Anodyne	ADRB2	41	37
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819368783	EE	On-Demand	Anodyne	ADRB3	39	42
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819368783	EE	On-Demand	Anodyne	TRPV1	59	33
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819368784	EE	On-Demand	Anodyne	ADRB2	41	37
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819368784	EE	On-Demand	Anodyne	ADRB3	39	42
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819368784	EE	On-Demand	Anodyne	TRPV1	59	33
CCn1cc([C@@H]2OCC[C@H]2CNC[C@@H](O)c2cccc(Cl)c2)cn1	ZINC000819368791	EF	On-Demand	Anodyne	CYP3A4	45	34
CCn1cc([C@@H]2OCC[C@H]2CNC[C@H](O)c2cccc(Cl)c2)cn1	ZINC000819368792	EF	On-Demand	Anodyne	CYP3A4	45	34
COc1cc(CN2CC[C@H](NC(=O)C(F)=C3CCC3)C2)cc(OC)c1	ZINC000819368810	EF	On-Demand	Anodyne	DRD4	26	44
COc1cc(CN2CC[C@H](NC(=O)C(F)=C3CCC3)C2)cc(OC)c1	ZINC000819368810	EF	On-Demand	Anodyne	SIGMAR1	19	41
COc1cc(CN2CC[C@H](NC(=O)C(F)=C3CCC3)C2)cc(OC)c1	ZINC000819368810	EF	On-Demand	Anodyne	SSTR5	44	34
COc1cc(CN2CC[C@H](NC(=O)C(F)=C3CCC3)C2)cc(OC)c1	ZINC000819368810	EF	On-Demand	Anodyne	CCR3	33	43
COc1cc(CN2CC[C@H](NC(=O)C(F)=C3CCC3)C2)cc(OC)c1	ZINC000819368810	EF	On-Demand	Anodyne	MCHR1	25	52
COc1cc(CN2CC[C@@H](NC(=O)C(F)=C3CCC3)C2)cc(OC)c1	ZINC000819368811	EF	On-Demand	Anodyne	DRD4	26	44
COc1cc(CN2CC[C@@H](NC(=O)C(F)=C3CCC3)C2)cc(OC)c1	ZINC000819368811	EF	On-Demand	Anodyne	SIGMAR1	19	41
COc1cc(CN2CC[C@@H](NC(=O)C(F)=C3CCC3)C2)cc(OC)c1	ZINC000819368811	EF	On-Demand	Anodyne	SSTR5	44	34
COc1cc(CN2CC[C@@H](NC(=O)C(F)=C3CCC3)C2)cc(OC)c1	ZINC000819368811	EF	On-Demand	Anodyne	CCR3	33	43
COc1cc(CN2CC[C@@H](NC(=O)C(F)=C3CCC3)C2)cc(OC)c1	ZINC000819368811	EF	On-Demand	Anodyne	MCHR1	25	52
COc1ccc(-n2cc(CNC(=O)/C=C/[C@@H]3CCCO3)nn2)cc1	ZINC000819368814	ED	On-Demand	Anodyne	FIMH	23	40
COc1ccc(-n2cc(CNC(=O)/C=C\[C@H]3CCCO3)nn2)cc1	ZINC000819368815	ED	On-Demand	Anodyne	FIMH	23	40
COc1ccc(-n2cc(CNC(=O)/C=C\[C@@H]3CCCO3)nn2)cc1	ZINC000819368816	ED	On-Demand	Anodyne	FIMH	23	40
COc1ccc(-n2cc(CNC(=O)/C=C/[C@H]3CCCO3)nn2)cc1	ZINC000819368817	ED	On-Demand	Anodyne	FIMH	23	40
COc1cc(CN2CC[C@H](NC(=O)/C=C/[C@@H]3CCCO3)C2)cc(OC)c1	ZINC000819368822	FE	On-Demand	Anodyne	DRD4	25	43
COc1cc(CN2CC[C@H](NC(=O)/C=C/[C@@H]3CCCO3)C2)cc(OC)c1	ZINC000819368822	FE	On-Demand	Anodyne	CCR3	23	44
COc1cc(CN2CC[C@H](NC(=O)/C=C/[C@@H]3CCCO3)C2)cc(OC)c1	ZINC000819368822	FE	On-Demand	Anodyne	MCHR1	20	50
COc1cc(CN2CC[C@H](NC(=O)/C=C\[C@@H]3CCCO3)C2)cc(OC)c1	ZINC000819368823	FE	On-Demand	Anodyne	DRD4	25	43
COc1cc(CN2CC[C@H](NC(=O)/C=C\[C@@H]3CCCO3)C2)cc(OC)c1	ZINC000819368823	FE	On-Demand	Anodyne	CCR3	23	44
COc1cc(CN2CC[C@H](NC(=O)/C=C\[C@@H]3CCCO3)C2)cc(OC)c1	ZINC000819368823	FE	On-Demand	Anodyne	MCHR1	20	50
COc1cc(CN2CC[C@H](NC(=O)/C=C\[C@H]3CCCO3)C2)cc(OC)c1	ZINC000819368824	FE	On-Demand	Anodyne	DRD4	25	43
COc1cc(CN2CC[C@H](NC(=O)/C=C\[C@H]3CCCO3)C2)cc(OC)c1	ZINC000819368824	FE	On-Demand	Anodyne	CCR3	23	44
COc1cc(CN2CC[C@H](NC(=O)/C=C\[C@H]3CCCO3)C2)cc(OC)c1	ZINC000819368824	FE	On-Demand	Anodyne	MCHR1	20	50
COc1cc(CN2CC[C@H](NC(=O)/C=C/[C@H]3CCCO3)C2)cc(OC)c1	ZINC000819368825	FE	On-Demand	Anodyne	DRD4	25	43
COc1cc(CN2CC[C@H](NC(=O)/C=C/[C@H]3CCCO3)C2)cc(OC)c1	ZINC000819368825	FE	On-Demand	Anodyne	CCR3	23	44
COc1cc(CN2CC[C@H](NC(=O)/C=C/[C@H]3CCCO3)C2)cc(OC)c1	ZINC000819368825	FE	On-Demand	Anodyne	MCHR1	20	50
O=C(OCc1ccccc1)N1CC(NC[C@H](O)C2CC2)C1	ZINC000819368866	CD	On-Demand	Anodyne	GRIN2B	26	45
O=C(OCc1ccccc1)N1CC(NC[C@H](O)C2CC2)C1	ZINC000819368866	CD	On-Demand	Anodyne	CTSK	23	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)C2CC2)C1	ZINC000819368866	CD	On-Demand	Anodyne	CTSL	30	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)C2CC2)C1	ZINC000819368866	CD	On-Demand	Anodyne	PREP	27	42
O=C(OCc1ccccc1)N1CC(NC[C@H](O)C2CC2)C1	ZINC000819368866	CD	On-Demand	Anodyne	TGM2	35	45
O=C(OCc1ccccc1)N1CC(NC[C@H](O)C2CC2)C1	ZINC000819368866	CD	On-Demand	Anodyne	NPR	44	32
O=C(OCc1ccccc1)N1CC(NC[C@H](O)C2CC2)C1	ZINC000819368866	CD	On-Demand	Anodyne	F13A1	32	45
O=C(OCc1ccccc1)N1CC(NC[C@H](O)C2CC2)C1	ZINC000819368866	CD	On-Demand	Anodyne	BIRC2	18	50
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)C2CC2)C1	ZINC000819368868	CD	On-Demand	Anodyne	GRIN2B	26	45
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)C2CC2)C1	ZINC000819368868	CD	On-Demand	Anodyne	CTSK	23	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)C2CC2)C1	ZINC000819368868	CD	On-Demand	Anodyne	CTSL	30	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)C2CC2)C1	ZINC000819368868	CD	On-Demand	Anodyne	PREP	27	42
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)C2CC2)C1	ZINC000819368868	CD	On-Demand	Anodyne	TGM2	35	45
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)C2CC2)C1	ZINC000819368868	CD	On-Demand	Anodyne	NPR	44	32
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)C2CC2)C1	ZINC000819368868	CD	On-Demand	Anodyne	F13A1	32	45
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)C2CC2)C1	ZINC000819368868	CD	On-Demand	Anodyne	BIRC2	18	50
O=C1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)[C@H](c2ccccc2)N1	ZINC000819368879	EF	On-Demand	Anodyne	ADRB1	37	45
O=C1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)[C@H](c2ccccc2)N1	ZINC000819368879	EF	On-Demand	Anodyne	ADRB3	52	48
O=C1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)[C@H](c2ccccc2)N1	ZINC000819368879	EF	On-Demand	Anodyne	CYP3A4	47	35
O=C1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)[C@H](c2ccccc2)N1	ZINC000819368882	EF	On-Demand	Anodyne	ADRB1	37	45
O=C1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)[C@H](c2ccccc2)N1	ZINC000819368882	EF	On-Demand	Anodyne	ADRB3	52	48
O=C1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)[C@H](c2ccccc2)N1	ZINC000819368882	EF	On-Demand	Anodyne	CYP3A4	47	35
N#Cc1cccc(S(=O)(=O)CCNC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000819368893	GD	On-Demand	Mild	ITGA4	49	31
N#Cc1cccc(S(=O)(=O)CCNC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000819368893	GD	On-Demand	Mild	TGM2	29	41
N#Cc1cccc(S(=O)(=O)CCNC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000819368893	GD	On-Demand	Mild	F13A1	36	41
CCN1CC[C@H](NC[C@@H](O)c2cc3ccccc3o2)C1	ZINC000819368916	CE	On-Demand	Anodyne	SSTR5	40	37
CC1(C)C[C@@H]1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819368973	CE	On-Demand	Bother	CACNA1C	58	38
CC1(C)C[C@@H]1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819368973	CE	On-Demand	Bother	CACNA1D	90	38
CC1(C)C[C@@H]1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819368974	CE	On-Demand	Bother	CACNA1C	58	38
CC1(C)C[C@@H]1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819368974	CE	On-Demand	Bother	CACNA1D	90	38
CC(C)(C)OC(=O)N1CCC[C@](O)(CNCc2cnccc2C(C)(C)C)CC1	ZINC000819369043	GH	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNCc2cnccc2C(C)(C)C)CC1	ZINC000819369045	GH	On-Demand	Anodyne	GPR119	34	41
COc1ccc(N2CCN(C(=O)Cc3nsc4ccccc34)CC2)cc1F	ZINC000819369058	GG	On-Demand	Clean	HTR1A	24	41
COc1ccc(N2CCN(C(=O)Cc3nsc4ccccc34)CC2)cc1F	ZINC000819369058	GG	On-Demand	Clean	CCR1	27	44
COc1ccc(N2CCN(C(=O)Cc3nsc4ccccc34)CC2)cc1F	ZINC000819369058	GG	On-Demand	Clean	SSTR1	41	38
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1F	ZINC000819369075	GF	On-Demand	Clean	TSHR	54	34
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1F	ZINC000819369075	GF	On-Demand	Clean	HTR1B	27	43
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1F	ZINC000819369075	GF	On-Demand	Clean	CCR1	22	42
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1F	ZINC000819369075	GF	On-Demand	Clean	MLNR	15	40
COc1ccc(N2CCN(C(=O)Cc3cccc(NC(C)=O)c3)CC2)cc1F	ZINC000819369075	GF	On-Demand	Clean	MET	45	35
Cc1noc(C)c1CCCNC(=O)c1cn(-c2ccccc2)nc1C(C)C	ZINC000819369125	FH	On-Demand	Anodyne	P2RX7	16	44
O=C(Nc1cnc2ccccc2c1)c1cc(S(=O)(=O)NCCOc2ccccc2)ccc1Cl	ZINC000819369157	JI	On-Demand	Anodyne	HTR7	15	41
Cc1cc(F)ccc1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819369162	GG	On-Demand	Mild	PAPA1_CARPA	48	52
Cc1cc(F)ccc1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819369162	GG	On-Demand	Mild	CTSL	16	52
Cc1cc(F)ccc1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819369164	GG	On-Demand	Mild	PAPA1_CARPA	48	52
Cc1cc(F)ccc1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819369164	GG	On-Demand	Mild	CTSL	16	52
O=C1CCCN1C[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819369191	EC	On-Demand	Anodyne	GRIN2B	15	40
O=C1CCCN1C[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819369191	EC	On-Demand	Anodyne	TGM2	31	42
O=C1CCCN1C[C@@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819369191	EC	On-Demand	Anodyne	F13A1	32	42
Cc1noc(C)c1CCCNC(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819369192	EE	On-Demand	Anodyne	P2RX7	18	49
O=C1CCCN1C[C@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819369193	EC	On-Demand	Anodyne	GRIN2B	15	40
O=C1CCCN1C[C@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819369193	EC	On-Demand	Anodyne	TGM2	31	42
O=C1CCCN1C[C@H](O)CNC1CN(C(=O)OCc2ccccc2)C1	ZINC000819369193	EC	On-Demand	Anodyne	F13A1	32	42
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819369207	EE	On-Demand	Anodyne	CHRM1	15	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819369207	EE	On-Demand	Anodyne	SLC6A3	35	46
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819369207	EE	On-Demand	Anodyne	GRIN2B	21	42
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819369207	EE	On-Demand	Anodyne	TGM2	35	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819369207	EE	On-Demand	Anodyne	F13A1	33	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819369209	EE	On-Demand	Anodyne	CHRM1	15	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819369209	EE	On-Demand	Anodyne	SLC6A3	35	46
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819369209	EE	On-Demand	Anodyne	GRIN2B	21	42
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819369209	EE	On-Demand	Anodyne	TGM2	35	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819369209	EE	On-Demand	Anodyne	F13A1	33	41
C[C@@H](NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1csnn1	ZINC000819369211	FE	On-Demand	Anodyne	GPR119	39	43
C[C@H](NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)c1csnn1	ZINC000819369212	FE	On-Demand	Anodyne	GPR119	39	43
N#Cc1ccc(OC[C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369216	GD	On-Demand	Mild	ADRB1	69	39
N#Cc1ccc(OC[C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369216	GD	On-Demand	Mild	ADRB3	47	40
N#Cc1ccc(OC[C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369216	GD	On-Demand	Mild	ABCB1	22	41
N#Cc1ccc(OC[C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369216	GD	On-Demand	Mild	CTRB_BOVIN	45	32
N#Cc1ccc(OC[C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369217	GD	On-Demand	Mild	ADRB1	69	39
N#Cc1ccc(OC[C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369217	GD	On-Demand	Mild	ADRB3	47	40
N#Cc1ccc(OC[C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369217	GD	On-Demand	Mild	ABCB1	22	41
N#Cc1ccc(OC[C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369217	GD	On-Demand	Mild	CTRB_BOVIN	45	32
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819369218	GE	On-Demand	Anodyne	SLC6A3	25	47
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819369218	GE	On-Demand	Anodyne	SIGMAR1	34	49
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819369218	GE	On-Demand	Anodyne	CCR3	52	41
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819369218	GE	On-Demand	Anodyne	MLNR	30	40
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819369218	GE	On-Demand	Anodyne	MCHR1	23	44
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819369218	GE	On-Demand	Anodyne	CACNA1G	46	44
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819369218	GE	On-Demand	Anodyne	ALK	15	42
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819369219	GE	On-Demand	Anodyne	SLC6A3	25	47
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819369219	GE	On-Demand	Anodyne	SIGMAR1	34	49
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819369219	GE	On-Demand	Anodyne	CCR3	52	41
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819369219	GE	On-Demand	Anodyne	MLNR	30	40
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819369219	GE	On-Demand	Anodyne	MCHR1	23	44
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819369219	GE	On-Demand	Anodyne	CACNA1G	46	44
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819369219	GE	On-Demand	Anodyne	ALK	15	42
N#CCc1ccc(OC[C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369222	GE	On-Demand	Mild	ADRB2	40	38
N#CCc1ccc(OC[C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369222	GE	On-Demand	Mild	ADRB1	71	40
N#CCc1ccc(OC[C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369222	GE	On-Demand	Mild	ADRB3	51	41
N#CCc1ccc(OC[C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369222	GE	On-Demand	Mild	LGMN	40	36
N#CCc1ccc(OC[C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369222	GE	On-Demand	Mild	ABCB1	19	41
N#CCc1ccc(OC[C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369223	GE	On-Demand	Mild	ADRB2	40	38
N#CCc1ccc(OC[C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369223	GE	On-Demand	Mild	ADRB1	71	40
N#CCc1ccc(OC[C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369223	GE	On-Demand	Mild	ADRB3	51	41
N#CCc1ccc(OC[C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369223	GE	On-Demand	Mild	LGMN	40	36
N#CCc1ccc(OC[C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369223	GE	On-Demand	Mild	ABCB1	19	41
CON(C)C(=O)CCNCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000819369234	FC	On-Demand	Anodyne	ACHE	21	41
CON(C)C(=O)CCNCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000819369234	FC	On-Demand	Anodyne	SIGMAR1	25	42
NC(=O)C1CCN(Cc2ccc(CNC[C@@H](O)C3CC3)cc2)CC1	ZINC000819369235	ED	On-Demand	Anodyne	SIGMAR1	25	46
NC(=O)C1CCN(Cc2ccc(CNC[C@H](O)C3CC3)cc2)CC1	ZINC000819369236	ED	On-Demand	Anodyne	SIGMAR1	25	46
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000819369239	EE	On-Demand	Anodyne	GRIN2B	21	43
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000819369239	EE	On-Demand	Anodyne	MME	44	36
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000819369239	EE	On-Demand	Anodyne	ANPEP	40	31
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000819369239	EE	On-Demand	Anodyne	CTSB	35	40
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000819369239	EE	On-Demand	Anodyne	CYSP_TRYCR	44	38
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000819369239	EE	On-Demand	Anodyne	CTSK	25	40
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000819369239	EE	On-Demand	Anodyne	CTSL	41	40
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000819369239	EE	On-Demand	Anodyne	PREP	26	40
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000819369239	EE	On-Demand	Anodyne	CAPNS1	59	33
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000819369239	EE	On-Demand	Anodyne	CAPN1	51	34
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000819369239	EE	On-Demand	Anodyne	CAPN2	60	38
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000819369239	EE	On-Demand	Anodyne	ACE2	17	41
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000819369239	EE	On-Demand	Anodyne	TGM2	38	44
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000819369239	EE	On-Demand	Anodyne	NPR	57	32
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000819369239	EE	On-Demand	Anodyne	F13A1	34	44
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)Cc2ccccc2)C1	ZINC000819369239	EE	On-Demand	Anodyne	Q9NAW4_PLAFA	36	40
O=C(OCc1ccccc1)N1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000819369240	EE	On-Demand	Anodyne	GRIN2B	21	43
O=C(OCc1ccccc1)N1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000819369240	EE	On-Demand	Anodyne	MME	44	36
O=C(OCc1ccccc1)N1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000819369240	EE	On-Demand	Anodyne	ANPEP	40	31
O=C(OCc1ccccc1)N1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000819369240	EE	On-Demand	Anodyne	CTSB	35	40
O=C(OCc1ccccc1)N1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000819369240	EE	On-Demand	Anodyne	CYSP_TRYCR	44	38
O=C(OCc1ccccc1)N1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000819369240	EE	On-Demand	Anodyne	CTSK	25	40
O=C(OCc1ccccc1)N1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000819369240	EE	On-Demand	Anodyne	CTSL	41	40
O=C(OCc1ccccc1)N1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000819369240	EE	On-Demand	Anodyne	PREP	26	40
O=C(OCc1ccccc1)N1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000819369240	EE	On-Demand	Anodyne	CAPNS1	59	33
O=C(OCc1ccccc1)N1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000819369240	EE	On-Demand	Anodyne	CAPN1	51	34
O=C(OCc1ccccc1)N1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000819369240	EE	On-Demand	Anodyne	CAPN2	60	38
O=C(OCc1ccccc1)N1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000819369240	EE	On-Demand	Anodyne	ACE2	17	41
O=C(OCc1ccccc1)N1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000819369240	EE	On-Demand	Anodyne	TGM2	38	44
O=C(OCc1ccccc1)N1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000819369240	EE	On-Demand	Anodyne	NPR	57	32
O=C(OCc1ccccc1)N1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000819369240	EE	On-Demand	Anodyne	F13A1	34	44
O=C(OCc1ccccc1)N1CC(NC[C@H](O)Cc2ccccc2)C1	ZINC000819369240	EE	On-Demand	Anodyne	Q9NAW4_PLAFA	36	40
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COCC2CC2)C1	ZINC000819369246	ED	On-Demand	Anodyne	GRIN2B	23	45
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COCC2CC2)C1	ZINC000819369246	ED	On-Demand	Anodyne	TGM2	27	42
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COCC2CC2)C1	ZINC000819369246	ED	On-Demand	Anodyne	F13A1	29	42
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COCC2CC2)C1	ZINC000819369247	ED	On-Demand	Anodyne	GRIN2B	23	45
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COCC2CC2)C1	ZINC000819369247	ED	On-Demand	Anodyne	TGM2	27	42
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COCC2CC2)C1	ZINC000819369247	ED	On-Demand	Anodyne	F13A1	29	42
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COc2ccccc2F)C1	ZINC000819369248	FE	On-Demand	Anodyne	ADRB2	28	44
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COc2ccccc2F)C1	ZINC000819369248	FE	On-Demand	Anodyne	ADRB1	32	44
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COc2ccccc2F)C1	ZINC000819369248	FE	On-Demand	Anodyne	ADRB3	26	44
O=C(OCc1ccccc1)N1CC(NC[C@H](O)COc2ccccc2F)C1	ZINC000819369248	FE	On-Demand	Anodyne	ABCB1	49	49
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COc2ccccc2F)C1	ZINC000819369249	FE	On-Demand	Anodyne	ADRB2	28	44
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COc2ccccc2F)C1	ZINC000819369249	FE	On-Demand	Anodyne	ADRB1	32	44
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COc2ccccc2F)C1	ZINC000819369249	FE	On-Demand	Anodyne	ADRB3	26	44
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)COc2ccccc2F)C1	ZINC000819369249	FE	On-Demand	Anodyne	ABCB1	49	49
O=C(OCc1ccccc1)N1CC(NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819369256	EE	On-Demand	Anodyne	GRIN2B	21	43
O=C(OCc1ccccc1)N1CC(NC[C@H](O)c2cccc(F)c2)C1	ZINC000819369257	EE	On-Demand	Anodyne	GRIN2B	21	43
C=CC[C@H](Cc1ccccc1)NC[C@H](O)c1cccc(F)c1	ZINC000819369262	CH	On-Demand	Mild	ADRB3	36	44
C=CC[C@H](Cc1ccccc1)NC[C@@H](O)c1cccc(F)c1	ZINC000819369265	CH	On-Demand	Mild	ADRB3	36	44
O=C(CCNC1CN(C(=O)OCc2ccccc2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000819369269	GF	On-Demand	Bother	TGM2	28	41
O=C(CCNC1CN(C(=O)OCc2ccccc2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000819369269	GF	On-Demand	Bother	F13A1	33	41
N#Cc1ccc(S(=O)(=O)CCNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369270	GD	On-Demand	Mild	TGM2	38	45
N#Cc1ccc(S(=O)(=O)CCNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369270	GD	On-Demand	Mild	F13A1	47	45
CCOC(=O)C1CCC(O)(CNC2CN(C(=O)OCc3ccccc3)C2)CC1	ZINC000819369273	GE	On-Demand	Anodyne	FKBP1A	23	40
CCOC(=O)C1CCC(O)(CNC2CN(C(=O)OCc3ccccc3)C2)CC1	ZINC000819369273	GE	On-Demand	Anodyne	GRIN2B	23	40
CCOC(=O)C1CCC(O)(CNC2CN(C(=O)OCc3ccccc3)C2)CC1	ZINC000819369273	GE	On-Demand	Anodyne	TIMP3	69	34
CCOC(=O)C1CCC(O)(CNC2CN(C(=O)OCc3ccccc3)C2)CC1	ZINC000819369273	GE	On-Demand	Anodyne	SLC12A5	57	36
CCCCCC(C)(C)CNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819369286	DH	On-Demand	Anodyne	INHA	19	40
O=C1CC[C@@H](NC[C@H](O)c2ccc(OC(F)(F)F)cc2)[C@H](c2ccccc2)N1	ZINC000819369303	GG	On-Demand	Anodyne	TACR1	19	43
O=C1CC[C@@H](NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)[C@H](c2ccccc2)N1	ZINC000819369304	GG	On-Demand	Anodyne	TACR1	19	43
CC(=O)c1ccc(OC[C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369321	GE	On-Demand	Anodyne	ADRB2	46	39
CC(=O)c1ccc(OC[C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369321	GE	On-Demand	Anodyne	ADRB1	71	39
CC(=O)c1ccc(OC[C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369321	GE	On-Demand	Anodyne	ADRB3	52	40
CC(=O)c1ccc(OC[C@@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369321	GE	On-Demand	Anodyne	ABCB1	32	54
CC(=O)c1ccc(OC[C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369322	GE	On-Demand	Anodyne	ADRB2	46	39
CC(=O)c1ccc(OC[C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369322	GE	On-Demand	Anodyne	ADRB1	71	39
CC(=O)c1ccc(OC[C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369322	GE	On-Demand	Anodyne	ADRB3	52	40
CC(=O)c1ccc(OC[C@H](O)CNC2CN(C(=O)OCc3ccccc3)C2)cc1	ZINC000819369322	GE	On-Demand	Anodyne	ABCB1	32	54
CCN1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819369325	DE	On-Demand	Anodyne	RBP4	47	31
CCN1CC[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819369325	DE	On-Demand	Anodyne	SFRP1	52	35
CCN1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819369327	DE	On-Demand	Anodyne	RBP4	47	31
CCN1CC[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819369327	DE	On-Demand	Anodyne	SFRP1	52	35
Cc1cc(F)ccc1[C@@H](O)CNCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000819369331	GF	On-Demand	Anodyne	SIGMAR1	28	42
Cc1cc(F)ccc1[C@@H](O)CNCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000819369331	GF	On-Demand	Anodyne	CCR3	50	39
Cc1cc(F)ccc1[C@@H](O)CNCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000819369331	GF	On-Demand	Anodyne	MCHR1	27	43
Cc1cc(F)ccc1[C@@H](O)CNCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000819369331	GF	On-Demand	Anodyne	CACNA1G	38	41
Cc1cc(F)ccc1[C@@H](O)CNCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000819369331	GF	On-Demand	Anodyne	ALK	15	42
Cc1cc(F)ccc1[C@@H](O)CNCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000819369331	GF	On-Demand	Anodyne	LEF	45	33
O=S(=O)(CCNC[C@H](O)Cc1cccc(Cl)c1)C1CC1	ZINC000819369341	DD	On-Demand	Anodyne	ADRB3	31	40
O=S(=O)(CCNC[C@@H](O)Cc1cccc(Cl)c1)C1CC1	ZINC000819369342	DD	On-Demand	Anodyne	ADRB3	31	40
O[C@@H](CN[C@@H]1CCCC[C@H]1F)c1ccccc1	ZINC000819369345	BF	On-Demand	Anodyne	ADRB1	15	42
O[C@H](CN[C@@H]1CCCC[C@H]1F)c1ccccc1	ZINC000819369349	BF	On-Demand	Anodyne	ADRB1	15	42
COc1ccc(N2CCN(C(=O)Cc3ccc(-n4cnnc4)cc3)CC2)cc1F	ZINC000819369351	GE	On-Demand	Clean	CCR1	28	49
COc1ccc(N2CCN(C(=O)Cc3ccc(-n4cnnc4)cc3)CC2)cc1F	ZINC000819369351	GE	On-Demand	Clean	KCNJ1	65	42
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2ccc(C#N)cc2)C1	ZINC000819369355	CD	On-Demand	Mild	CTRB_BOVIN	43	30
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2ccc(C#N)cc2)C1	ZINC000819369361	CD	On-Demand	Mild	CTRB_BOVIN	43	30
COc1ccc(OC)c([C@H](O)CNCCS(=O)(=O)C2CC2)c1	ZINC000819369375	EC	On-Demand	Anodyne	ADRB2	19	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2cnccc2C(C)(C)C)CC1	ZINC000819369417	GG	On-Demand	Anodyne	GPR119	58	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2cnccc2C(C)(C)C)CC1	ZINC000819369419	GG	On-Demand	Anodyne	GPR119	58	47
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2ccc(Br)cc2)C1	ZINC000819369431	EE	On-Demand	Anodyne	SLC6A3	18	42
CC1(C)C[C@@H]1NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819369433	CF	On-Demand	Anodyne	ENV	40	36
CC1(C)C[C@@H]1NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819369434	CF	On-Demand	Anodyne	ENV	40	36
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2ccc(Br)cc2)C1	ZINC000819369436	EE	On-Demand	Anodyne	SLC6A3	18	42
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1ccc(F)cc1	ZINC000819369443	DE	On-Demand	Anodyne	ADRB3	31	44
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1ccc(F)cc1	ZINC000819369445	DE	On-Demand	Anodyne	ADRB3	31	44
O=S(=O)(CCNC[C@@H](O)COc1cccc2[nH]ccc12)C1CC1	ZINC000819369458	ED	On-Demand	Anodyne	ADRB2	31	61
O=S(=O)(CCNC[C@@H](O)COc1cccc2[nH]ccc12)C1CC1	ZINC000819369458	ED	On-Demand	Anodyne	ADRB1	65	56
O=S(=O)(CCNC[C@@H](O)COc1cccc2[nH]ccc12)C1CC1	ZINC000819369458	ED	On-Demand	Anodyne	HTR1A	16	61
O=S(=O)(CCNC[C@@H](O)COc1cccc2[nH]ccc12)C1CC1	ZINC000819369458	ED	On-Demand	Anodyne	SLC6A4	19	43
O=S(=O)(CCNC[C@@H](O)COc1cccc2[nH]ccc12)C1CC1	ZINC000819369458	ED	On-Demand	Anodyne	ADRB3	27	56
O=S(=O)(CCNC[C@H](O)COc1cccc2[nH]ccc12)C1CC1	ZINC000819369465	ED	On-Demand	Anodyne	ADRB2	31	61
O=S(=O)(CCNC[C@H](O)COc1cccc2[nH]ccc12)C1CC1	ZINC000819369465	ED	On-Demand	Anodyne	ADRB1	65	56
O=S(=O)(CCNC[C@H](O)COc1cccc2[nH]ccc12)C1CC1	ZINC000819369465	ED	On-Demand	Anodyne	HTR1A	16	61
O=S(=O)(CCNC[C@H](O)COc1cccc2[nH]ccc12)C1CC1	ZINC000819369465	ED	On-Demand	Anodyne	SLC6A4	19	43
O=S(=O)(CCNC[C@H](O)COc1cccc2[nH]ccc12)C1CC1	ZINC000819369465	ED	On-Demand	Anodyne	ADRB3	27	56
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCC(O)CC2)c(C#N)c1	ZINC000819369470	EG	On-Demand	Mild	NPY2R	61	39
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1cccnc1	ZINC000819369475	DD	On-Demand	Anodyne	ADRB2	27	44
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1cccnc1	ZINC000819369475	DD	On-Demand	Anodyne	ADRB1	30	44
CS(=O)(=O)c1ccccc1CNC[C@H](O)c1cccnc1	ZINC000819369475	DD	On-Demand	Anodyne	ADRB3	112	48
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccnc1	ZINC000819369476	DD	On-Demand	Anodyne	ADRB2	27	44
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccnc1	ZINC000819369476	DD	On-Demand	Anodyne	ADRB1	30	44
CS(=O)(=O)c1ccccc1CNC[C@@H](O)c1cccnc1	ZINC000819369476	DD	On-Demand	Anodyne	ADRB3	112	48
Cc1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1	ZINC000819369481	FE	On-Demand	Anodyne	ADRB1	47	38
Cc1ccc(OC[C@H](O)CNC[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1	ZINC000819369483	FE	On-Demand	Anodyne	ADRB1	47	38
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819369496	DE	On-Demand	Anodyne	ADRB3	15	49
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2ccc(C(F)(F)F)cc2)C1	ZINC000819369503	DE	On-Demand	Anodyne	ADRB3	15	49
O=C(C(F)=C1CCC1)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1	ZINC000819369578	EI	On-Demand	Anodyne	PRCP	55	44
O=C(C(F)=C1CCC1)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1	ZINC000819369579	EI	On-Demand	Anodyne	PRCP	55	44
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819369593	CD	On-Demand	Anodyne	SLC6A3	26	41
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2ccc(C)cc2)C1	ZINC000819369593	CD	On-Demand	Anodyne	ADRB3	19	47
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819369594	CD	On-Demand	Anodyne	SLC6A3	26	41
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2ccc(C)cc2)C1	ZINC000819369594	CD	On-Demand	Anodyne	ADRB3	19	47
O=S(=O)(CCNC[C@@H](O)c1ccccc1)C1CC1	ZINC000819369607	CC	On-Demand	Anodyne	ADRB2	32	45
O=S(=O)(CCNC[C@@H](O)c1ccccc1)C1CC1	ZINC000819369607	CC	On-Demand	Anodyne	ADRB1	39	40
O=S(=O)(CCNC[C@@H](O)c1ccccc1)C1CC1	ZINC000819369607	CC	On-Demand	Anodyne	ADRB3	74	42
O=S(=O)(CCNC[C@H](O)c1ccccc1)C1CC1	ZINC000819369608	CC	On-Demand	Anodyne	ADRB2	32	45
O=S(=O)(CCNC[C@H](O)c1ccccc1)C1CC1	ZINC000819369608	CC	On-Demand	Anodyne	ADRB1	39	40
O=S(=O)(CCNC[C@H](O)c1ccccc1)C1CC1	ZINC000819369608	CC	On-Demand	Anodyne	ADRB3	74	42
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)c1	ZINC000819369609	EC	On-Demand	Bother	ADRB2	37	49
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)c1	ZINC000819369609	EC	On-Demand	Bother	ADRB1	67	49
O=[N+]([O-])c1cccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)c1	ZINC000819369609	EC	On-Demand	Bother	ADRB3	44	49
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)c1	ZINC000819369610	EC	On-Demand	Bother	ADRB2	37	49
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)c1	ZINC000819369610	EC	On-Demand	Bother	ADRB1	67	49
O=[N+]([O-])c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)c1	ZINC000819369610	EC	On-Demand	Bother	ADRB3	44	49
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819369612	CD	On-Demand	Anodyne	ADRB2	24	45
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819369612	CD	On-Demand	Anodyne	ADRB1	50	50
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819369612	CD	On-Demand	Anodyne	SLC6A3	21	44
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819369612	CD	On-Demand	Anodyne	ADRB3	70	52
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819369612	CD	On-Demand	Anodyne	CYP3A4	48	37
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819369613	CD	On-Demand	Anodyne	ADRB2	24	45
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819369613	CD	On-Demand	Anodyne	ADRB1	50	50
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819369613	CD	On-Demand	Anodyne	SLC6A3	21	44
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819369613	CD	On-Demand	Anodyne	ADRB3	70	52
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819369613	CD	On-Demand	Anodyne	CYP3A4	48	37
CS(=O)(=O)c1ccc([C@H](O)CNCc2nccc(C(F)(F)F)n2)cc1	ZINC000819369634	GD	On-Demand	Anodyne	TRPV1	77	34
CS(=O)(=O)c1ccc([C@@H](O)CNCc2nccc(C(F)(F)F)n2)cc1	ZINC000819369635	GD	On-Demand	Anodyne	TRPV1	77	34
O[C@@H](CNCc1nccc(C(F)(F)F)n1)c1cccnc1	ZINC000819369666	CD	On-Demand	Anodyne	ADRB2	23	42
O[C@@H](CNCc1nccc(C(F)(F)F)n1)c1cccnc1	ZINC000819369666	CD	On-Demand	Anodyne	ADRB1	24	47
O[C@@H](CNCc1nccc(C(F)(F)F)n1)c1cccnc1	ZINC000819369666	CD	On-Demand	Anodyne	ADRB3	92	47
O[C@H](CNCc1nccc(C(F)(F)F)n1)c1cccnc1	ZINC000819369667	CD	On-Demand	Anodyne	ADRB2	23	42
O[C@H](CNCc1nccc(C(F)(F)F)n1)c1cccnc1	ZINC000819369667	CD	On-Demand	Anodyne	ADRB1	24	47
O[C@H](CNCc1nccc(C(F)(F)F)n1)c1cccnc1	ZINC000819369667	CD	On-Demand	Anodyne	ADRB3	92	47
C[C@H]1C[C@H](NC[C@@H](O)c2ccc(Cl)cc2)CS1	ZINC000819369673	CF	On-Demand	Anodyne	ADRB3	15	41
C[C@H]1C[C@H](NC[C@H](O)c2ccc(Cl)cc2)CS1	ZINC000819369674	CF	On-Demand	Anodyne	ADRB3	15	41
O=C1[C@@H](NC[C@@H](O)c2ccccc2)CCN1c1ccc(F)cc1	ZINC000819369716	DE	On-Demand	Anodyne	SLC6A3	19	47
O=C1[C@H](NC[C@@H](O)c2ccccc2)CCN1c1ccc(F)cc1	ZINC000819369720	DE	On-Demand	Anodyne	SLC6A3	19	47
O=C1[C@@H](NC[C@H](O)c2ccccc2)CCN1c1ccc(F)cc1	ZINC000819369722	DE	On-Demand	Anodyne	SLC6A3	19	47
O=C1[C@H](NC[C@H](O)c2ccccc2)CCN1c1ccc(F)cc1	ZINC000819369723	DE	On-Demand	Anodyne	SLC6A3	19	47
O=S(=O)(CCNC[C@@H](O)COc1ccc(Br)cc1)C1CC1	ZINC000819369748	GD	On-Demand	Anodyne	ADRB2	48	50
O=S(=O)(CCNC[C@@H](O)COc1ccc(Br)cc1)C1CC1	ZINC000819369748	GD	On-Demand	Anodyne	ADRB1	83	52
O=S(=O)(CCNC[C@@H](O)COc1ccc(Br)cc1)C1CC1	ZINC000819369748	GD	On-Demand	Anodyne	ADRB3	53	50
O=S(=O)(CCNC[C@H](O)COc1ccc(Br)cc1)C1CC1	ZINC000819369750	GD	On-Demand	Anodyne	ADRB2	48	50
O=S(=O)(CCNC[C@H](O)COc1ccc(Br)cc1)C1CC1	ZINC000819369750	GD	On-Demand	Anodyne	ADRB1	83	52
O=S(=O)(CCNC[C@H](O)COc1ccc(Br)cc1)C1CC1	ZINC000819369750	GD	On-Demand	Anodyne	ADRB3	53	50
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)c(Cl)c1)C1CC1	ZINC000819369755	FD	On-Demand	Anodyne	ADRB2	48	46
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)c(Cl)c1)C1CC1	ZINC000819369755	FD	On-Demand	Anodyne	ADRB1	82	46
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)c(Cl)c1)C1CC1	ZINC000819369755	FD	On-Demand	Anodyne	GRIN1	32	52
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)c(Cl)c1)C1CC1	ZINC000819369755	FD	On-Demand	Anodyne	ADRB3	54	48
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)c(Cl)c1)C1CC1	ZINC000819369755	FD	On-Demand	Anodyne	CCR3	15	42
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)C1CC1	ZINC000819369756	FD	On-Demand	Anodyne	ADRB2	48	46
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)C1CC1	ZINC000819369756	FD	On-Demand	Anodyne	ADRB1	82	46
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)C1CC1	ZINC000819369756	FD	On-Demand	Anodyne	GRIN1	32	52
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)C1CC1	ZINC000819369756	FD	On-Demand	Anodyne	ADRB3	54	48
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)c(Cl)c1)C1CC1	ZINC000819369756	FD	On-Demand	Anodyne	CCR3	15	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	CELA1	17	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	CTSD	135	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	PGC	72	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	CMA1	34	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	CTRA_BOVIN	19	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	PAPA1_CARPA	34	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	CCKAR	55	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	CTSK	22	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	CTSL	26	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	PGA	50	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	BACE2	55	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	TACR3	15	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	CAPNS1	49	29
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	REN	130	53
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	REN1	47	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	CTSE	46	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	BACE1	96	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	PGA5	44	31
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	FPR1	57	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CCCC[C@H]1F	ZINC000819369789	GG	On-Demand	Anodyne	PLM1_PLAFA	36	46
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1ccc(F)cc1	ZINC000819369829	DD	On-Demand	Anodyne	ADRB1	16	40
O=C1[C@H](NC[C@H](O)c2cccnc2)CCN1c1ccc(F)cc1	ZINC000819369829	DD	On-Demand	Anodyne	ADRB3	67	49
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1ccc(F)cc1	ZINC000819369831	DD	On-Demand	Anodyne	ADRB1	16	40
O=C1[C@@H](NC[C@H](O)c2cccnc2)CCN1c1ccc(F)cc1	ZINC000819369831	DD	On-Demand	Anodyne	ADRB3	67	49
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1ccc(F)cc1	ZINC000819369833	DD	On-Demand	Anodyne	ADRB1	16	40
O=C1[C@H](NC[C@@H](O)c2cccnc2)CCN1c1ccc(F)cc1	ZINC000819369833	DD	On-Demand	Anodyne	ADRB3	67	49
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1ccc(F)cc1	ZINC000819369835	DD	On-Demand	Anodyne	ADRB1	16	40
O=C1[C@@H](NC[C@@H](O)c2cccnc2)CCN1c1ccc(F)cc1	ZINC000819369835	DD	On-Demand	Anodyne	ADRB3	67	49
O=S(=O)(CCNC[C@H](O)COc1cccc2ccccc12)C1CC1	ZINC000819369838	ED	On-Demand	Anodyne	ADRB2	54	59
O=S(=O)(CCNC[C@H](O)COc1cccc2ccccc12)C1CC1	ZINC000819369838	ED	On-Demand	Anodyne	ADRB1	79	53
O=S(=O)(CCNC[C@H](O)COc1cccc2ccccc12)C1CC1	ZINC000819369838	ED	On-Demand	Anodyne	ADRB3	47	52
O=S(=O)(CCNC[C@H](O)COc1cccc2ccccc12)C1CC1	ZINC000819369838	ED	On-Demand	Anodyne	CYP2D6	16	43
O=S(=O)(CCNC[C@H](O)COc1cccc2ccccc12)C1CC1	ZINC000819369838	ED	On-Demand	Anodyne	ABCB1	25	44
O=S(=O)(CCNC[C@@H](O)COc1cccc2ccccc12)C1CC1	ZINC000819369840	ED	On-Demand	Anodyne	ADRB2	54	59
O=S(=O)(CCNC[C@@H](O)COc1cccc2ccccc12)C1CC1	ZINC000819369840	ED	On-Demand	Anodyne	ADRB1	79	53
O=S(=O)(CCNC[C@@H](O)COc1cccc2ccccc12)C1CC1	ZINC000819369840	ED	On-Demand	Anodyne	ADRB3	47	52
O=S(=O)(CCNC[C@@H](O)COc1cccc2ccccc12)C1CC1	ZINC000819369840	ED	On-Demand	Anodyne	CYP2D6	16	43
O=S(=O)(CCNC[C@@H](O)COc1cccc2ccccc12)C1CC1	ZINC000819369840	ED	On-Demand	Anodyne	ABCB1	25	44
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819369843	EC	On-Demand	Anodyne	ADRB3	25	43
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000819369845	EC	On-Demand	Anodyne	ADRB3	25	43
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819369857	CD	On-Demand	Bother	CACNA1C	66	44
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819369857	CD	On-Demand	Bother	CACNA1D	98	40
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819369859	CD	On-Demand	Bother	CACNA1C	66	44
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819369859	CD	On-Demand	Bother	CACNA1D	98	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCS(=O)(=O)C1CC1	ZINC000819369889	EC	On-Demand	Bother	ADRB2	37	43
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCS(=O)(=O)C1CC1	ZINC000819369889	EC	On-Demand	Bother	ADRB1	56	43
O=[N+]([O-])c1ccccc1OC[C@H](O)CNCCS(=O)(=O)C1CC1	ZINC000819369889	EC	On-Demand	Bother	ADRB3	33	43
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCS(=O)(=O)C1CC1	ZINC000819369890	EC	On-Demand	Bother	ADRB2	37	43
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCS(=O)(=O)C1CC1	ZINC000819369890	EC	On-Demand	Bother	ADRB1	56	43
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNCCS(=O)(=O)C1CC1	ZINC000819369890	EC	On-Demand	Bother	ADRB3	33	43
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1	ZINC000819369949	GD	On-Demand	Anodyne	ADRB2	31	40
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1	ZINC000819369949	GD	On-Demand	Anodyne	ADRB1	61	40
COC(=O)c1ccc(OC[C@@H](O)CNC[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1	ZINC000819369949	GD	On-Demand	Anodyne	ADRB3	47	40
O=C([C@H](O)c1ccc(Cl)cc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819369950	FG	On-Demand	Anodyne	DPP8	15	44
O=C([C@@H](O)c1ccc(Cl)cc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819369951	FG	On-Demand	Anodyne	DPP8	15	44
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1	ZINC000819369952	GD	On-Demand	Anodyne	ADRB2	31	40
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1	ZINC000819369952	GD	On-Demand	Anodyne	ADRB1	61	40
COC(=O)c1ccc(OC[C@H](O)CNC[C@@H]2CCN(C)[C@H]2c2cccnc2)cc1	ZINC000819369952	GD	On-Demand	Anodyne	ADRB3	47	40
CC1(C)C[C@@H]1NC[C@@H](O)c1cccnc1	ZINC000819369958	BD	On-Demand	Anodyne	ADRB2	20	40
CC1(C)C[C@@H]1NC[C@@H](O)c1cccnc1	ZINC000819369958	BD	On-Demand	Anodyne	ADRB1	22	45
CC1(C)C[C@@H]1NC[C@@H](O)c1cccnc1	ZINC000819369958	BD	On-Demand	Anodyne	ADRB3	76	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819369991	IH	On-Demand	Anodyne	PGC	56	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819369991	IH	On-Demand	Anodyne	MC4R	35	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819369991	IH	On-Demand	Anodyne	PAPA1_CARPA	57	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819369991	IH	On-Demand	Anodyne	CYSP_TRYCR	58	36
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819369991	IH	On-Demand	Anodyne	CCKAR	44	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819369991	IH	On-Demand	Anodyne	CTSL	32	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819369991	IH	On-Demand	Anodyne	TACR3	15	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819369991	IH	On-Demand	Anodyne	CAPNS1	55	31
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819369991	IH	On-Demand	Anodyne	REN	72	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819369991	IH	On-Demand	Anodyne	CAPN1	38	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819369991	IH	On-Demand	Anodyne	FPR1	60	42
COCC[C@H](C)CNC[C@@H](O)c1ccccc1	ZINC000819370029	BD	On-Demand	Anodyne	ADRB2	25	40
COCC[C@H](C)CNC[C@@H](O)c1ccccc1	ZINC000819370029	BD	On-Demand	Anodyne	AOC3	16	45
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2Cc3cnn(-c4ccccc4)c3C2)C1	ZINC000819370031	GG	On-Demand	Anodyne	GPR119	43	43
CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2Cc3cnn(-c4ccccc4)c3C2)C1	ZINC000819370031	GG	On-Demand	Anodyne	SFRP1	17	41
COCC[C@@H](C)CNC[C@@H](O)c1ccccc1	ZINC000819370032	BD	On-Demand	Anodyne	ADRB2	25	40
COCC[C@@H](C)CNC[C@@H](O)c1ccccc1	ZINC000819370032	BD	On-Demand	Anodyne	AOC3	16	45
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2Cc3cnn(-c4ccccc4)c3C2)C1	ZINC000819370033	GG	On-Demand	Anodyne	GPR119	43	43
CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2Cc3cnn(-c4ccccc4)c3C2)C1	ZINC000819370033	GG	On-Demand	Anodyne	SFRP1	17	41
O=C(COc1ccc([N+](=O)[O-])c(F)c1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370050	GF	On-Demand	Bother	CPT2	42	35
COc1cccc(C2=NO[C@H](C(=O)N3Cc4cnn(-c5ccccc5)c4C3)C2)c1	ZINC000819370071	GF	On-Demand	Anodyne	LUCI_PHOPY	40	48
COc1cccc(C2=NO[C@@H](C(=O)N3Cc4cnn(-c5ccccc5)c4C3)C2)c1	ZINC000819370072	GF	On-Demand	Anodyne	LUCI_PHOPY	40	48
O=S(=O)(CCNC[C@@H](O)COc1ccccc1C(F)(F)F)C1CC1	ZINC000819370110	FD	On-Demand	Anodyne	ADRB2	39	42
O=S(=O)(CCNC[C@@H](O)COc1ccccc1C(F)(F)F)C1CC1	ZINC000819370110	FD	On-Demand	Anodyne	ADRB1	63	47
O=S(=O)(CCNC[C@@H](O)COc1ccccc1C(F)(F)F)C1CC1	ZINC000819370110	FD	On-Demand	Anodyne	ADRB3	35	40
O=S(=O)(CCNC[C@@H](O)COc1ccccc1C(F)(F)F)C1CC1	ZINC000819370110	FD	On-Demand	Anodyne	ABCB1	19	41
O=S(=O)(CCNC[C@H](O)COc1ccccc1C(F)(F)F)C1CC1	ZINC000819370111	FD	On-Demand	Anodyne	ADRB2	39	42
O=S(=O)(CCNC[C@H](O)COc1ccccc1C(F)(F)F)C1CC1	ZINC000819370111	FD	On-Demand	Anodyne	ADRB1	63	47
O=S(=O)(CCNC[C@H](O)COc1ccccc1C(F)(F)F)C1CC1	ZINC000819370111	FD	On-Demand	Anodyne	ADRB3	35	40
O=S(=O)(CCNC[C@H](O)COc1ccccc1C(F)(F)F)C1CC1	ZINC000819370111	FD	On-Demand	Anodyne	ABCB1	19	41
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)cc1Cl)C1CC1	ZINC000819370114	FD	On-Demand	Anodyne	ADRB2	24	41
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)cc1Cl)C1CC1	ZINC000819370114	FD	On-Demand	Anodyne	ADRB1	47	39
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)cc1Cl)C1CC1	ZINC000819370115	FD	On-Demand	Anodyne	ADRB2	24	41
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)cc1Cl)C1CC1	ZINC000819370115	FD	On-Demand	Anodyne	ADRB1	47	39
COCC1CCC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819370116	DE	On-Demand	Bother	CACNA1C	57	45
COCC1CCC(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819370116	DE	On-Demand	Bother	CACNA1D	84	45
COCC1CCC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819370117	DE	On-Demand	Bother	CACNA1C	57	45
COCC1CCC(NC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819370117	DE	On-Demand	Bother	CACNA1D	84	45
O=S(=O)(CCNC[C@@H](O)COc1ccccc1Cl)C1CC1	ZINC000819370118	ED	On-Demand	Anodyne	ADRB2	46	55
O=S(=O)(CCNC[C@@H](O)COc1ccccc1Cl)C1CC1	ZINC000819370118	ED	On-Demand	Anodyne	ADRB1	74	45
O=S(=O)(CCNC[C@@H](O)COc1ccccc1Cl)C1CC1	ZINC000819370118	ED	On-Demand	Anodyne	ADRB3	44	41
O=S(=O)(CCNC[C@@H](O)COc1ccccc1Cl)C1CC1	ZINC000819370118	ED	On-Demand	Anodyne	ABCB1	21	40
O=S(=O)(CCNC[C@H](O)COc1ccccc1Cl)C1CC1	ZINC000819370119	ED	On-Demand	Anodyne	ADRB2	46	55
O=S(=O)(CCNC[C@H](O)COc1ccccc1Cl)C1CC1	ZINC000819370119	ED	On-Demand	Anodyne	ADRB1	74	45
O=S(=O)(CCNC[C@H](O)COc1ccccc1Cl)C1CC1	ZINC000819370119	ED	On-Demand	Anodyne	ADRB3	44	41
O=S(=O)(CCNC[C@H](O)COc1ccccc1Cl)C1CC1	ZINC000819370119	ED	On-Demand	Anodyne	ABCB1	21	40
O=S(=O)(CCNC[C@@H](O)COc1ccccc1)C1CC1	ZINC000819370121	CC	On-Demand	Anodyne	ADRB2	67	52
O=S(=O)(CCNC[C@@H](O)COc1ccccc1)C1CC1	ZINC000819370121	CC	On-Demand	Anodyne	ADRB1	108	53
O=S(=O)(CCNC[C@@H](O)COc1ccccc1)C1CC1	ZINC000819370121	CC	On-Demand	Anodyne	ADRB3	74	53
O=S(=O)(CCNC[C@@H](O)COc1ccccc1)C1CC1	ZINC000819370121	CC	On-Demand	Anodyne	ABCB1	18	46
O=S(=O)(CCNC[C@H](O)COc1ccccc1)C1CC1	ZINC000819370122	CC	On-Demand	Anodyne	ADRB2	67	52
O=S(=O)(CCNC[C@H](O)COc1ccccc1)C1CC1	ZINC000819370122	CC	On-Demand	Anodyne	ADRB1	108	53
O=S(=O)(CCNC[C@H](O)COc1ccccc1)C1CC1	ZINC000819370122	CC	On-Demand	Anodyne	ADRB3	74	53
O=S(=O)(CCNC[C@H](O)COc1ccccc1)C1CC1	ZINC000819370122	CC	On-Demand	Anodyne	ABCB1	18	46
O[C@H](CN[C@@H]1CCCC[C@H]1F)c1cccnc1	ZINC000819370126	BD	On-Demand	Anodyne	ADRB1	27	43
O[C@H](CN[C@@H]1CCCC[C@H]1F)c1cccnc1	ZINC000819370126	BD	On-Demand	Anodyne	ADRB3	82	44
O[C@@H](CN[C@@H]1CCCC[C@H]1F)c1cccnc1	ZINC000819370127	BD	On-Demand	Anodyne	ADRB1	27	43
O[C@@H](CN[C@@H]1CCCC[C@H]1F)c1cccnc1	ZINC000819370127	BD	On-Demand	Anodyne	ADRB3	82	44
O=C(NC[C@@H](O)c1ccccc1F)c1cc2c(cn1)OCCO2	ZINC000819370128	DD	On-Demand	Anodyne	SCD1	18	44
O=C(NC[C@H](O)c1ccccc1F)c1cc2c(cn1)OCCO2	ZINC000819370129	DD	On-Demand	Anodyne	SCD1	18	44
Cc1cc(-c2csc(NC(=O)/C=C/[C@@H]3CCCO3)n2)ccc1F	ZINC000819370130	EH	On-Demand	Anodyne	MPL	32	41
Cc1cc(-c2csc(NC(=O)/C=C\[C@H]3CCCO3)n2)ccc1F	ZINC000819370131	EH	On-Demand	Anodyne	MPL	32	41
Cc1cc(-c2csc(NC(=O)/C=C\[C@@H]3CCCO3)n2)ccc1F	ZINC000819370132	EH	On-Demand	Anodyne	MPL	32	41
Cc1cc(-c2csc(NC(=O)/C=C/[C@H]3CCCO3)n2)ccc1F	ZINC000819370133	EH	On-Demand	Anodyne	MPL	32	41
CC(=O)c1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370136	EC	On-Demand	Anodyne	ADRB2	51	44
CC(=O)c1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370136	EC	On-Demand	Anodyne	ADRB1	88	47
CC(=O)c1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370136	EC	On-Demand	Anodyne	ADRB3	56	44
CC(=O)c1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370136	EC	On-Demand	Anodyne	ABCB1	15	58
CC(=O)c1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370137	EC	On-Demand	Anodyne	ADRB2	51	44
CC(=O)c1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370137	EC	On-Demand	Anodyne	ADRB1	88	47
CC(=O)c1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370137	EC	On-Demand	Anodyne	ADRB3	56	44
CC(=O)c1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370137	EC	On-Demand	Anodyne	ABCB1	15	58
O=C(CCNCCS(=O)(=O)C1CC1)Nc1ccccc1	ZINC000819370145	CD	On-Demand	Anodyne	HDAC10	19	42
O=C(CCNCCS(=O)(=O)C1CC1)Nc1ccccc1	ZINC000819370145	CD	On-Demand	Anodyne	HDAC11	18	42
O=S(=O)(CCNC[C@@H](O)c1cccc(C(F)(F)F)c1)C1CC1	ZINC000819370146	ED	On-Demand	Anodyne	ADRB3	50	39
O=S(=O)(CCNC[C@H](O)c1cccc(C(F)(F)F)c1)C1CC1	ZINC000819370147	ED	On-Demand	Anodyne	ADRB3	50	39
O=S(=O)(CCNC[C@@H](O)CCc1ccccc1)C1CC1	ZINC000819370150	CD	On-Demand	Anodyne	ADRB1	40	39
O=S(=O)(CCNC[C@H](O)CCc1ccccc1)C1CC1	ZINC000819370151	CD	On-Demand	Anodyne	ADRB1	40	39
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819370154	CD	On-Demand	Anodyne	SLC6A3	31	42
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2ccc(Cl)cc2)C1	ZINC000819370154	CD	On-Demand	Anodyne	ADRB3	25	48
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370161	DC	On-Demand	Anodyne	ADRB2	57	50
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370161	DC	On-Demand	Anodyne	ADRB1	89	52
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370161	DC	On-Demand	Anodyne	GRIN1	18	46
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370161	DC	On-Demand	Anodyne	ADRB3	57	50
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370162	DC	On-Demand	Anodyne	ADRB2	57	50
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370162	DC	On-Demand	Anodyne	ADRB1	89	52
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370162	DC	On-Demand	Anodyne	GRIN1	18	46
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370162	DC	On-Demand	Anodyne	ADRB3	57	50
CC(C)(C)OC(=O)N[C@H](CC(=O)N1Cc2cnn(-c3ccccc3)c2C1)Cc1ccccc1	ZINC000819370190	II	On-Demand	Anodyne	PGC	46	33
CC(C)(C)OC(=O)N[C@H](CC(=O)N1Cc2cnn(-c3ccccc3)c2C1)Cc1ccccc1	ZINC000819370190	II	On-Demand	Anodyne	REN	49	34
CC(C)(C)OC(=O)N[C@H](CC(=O)N1Cc2cnn(-c3ccccc3)c2C1)Cc1ccccc1	ZINC000819370190	II	On-Demand	Anodyne	FPR1	47	37
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1Cc2cnn(-c3ccccc3)c2C1)Cc1ccccc1	ZINC000819370193	II	On-Demand	Anodyne	PGC	46	33
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1Cc2cnn(-c3ccccc3)c2C1)Cc1ccccc1	ZINC000819370193	II	On-Demand	Anodyne	REN	49	34
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1Cc2cnn(-c3ccccc3)c2C1)Cc1ccccc1	ZINC000819370193	II	On-Demand	Anodyne	FPR1	47	37
CCn1ccc(CNC[C@@H](O)c2cccnc2)n1	ZINC000819370250	BD	On-Demand	Anodyne	ADRB2	22	42
CCn1ccc(CNC[C@@H](O)c2cccnc2)n1	ZINC000819370250	BD	On-Demand	Anodyne	ADRB1	23	42
CCn1ccc(CNC[C@@H](O)c2cccnc2)n1	ZINC000819370250	BD	On-Demand	Anodyne	ADRB3	89	48
CCn1ccc(CNC[C@H](O)c2cccnc2)n1	ZINC000819370251	BD	On-Demand	Anodyne	ADRB2	22	42
CCn1ccc(CNC[C@H](O)c2cccnc2)n1	ZINC000819370251	BD	On-Demand	Anodyne	ADRB1	23	42
CCn1ccc(CNC[C@H](O)c2cccnc2)n1	ZINC000819370251	BD	On-Demand	Anodyne	ADRB3	89	48
COCC[C@@H](C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819370272	CF	On-Demand	Anodyne	ADRB2	46	44
COCC[C@@H](C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819370272	CF	On-Demand	Anodyne	ADRB1	49	44
COCC[C@@H](C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819370272	CF	On-Demand	Anodyne	ADRB3	59	44
COCC[C@H](C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819370273	CF	On-Demand	Anodyne	ADRB2	46	44
COCC[C@H](C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819370273	CF	On-Demand	Anodyne	ADRB1	49	44
COCC[C@H](C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819370273	CF	On-Demand	Anodyne	ADRB3	59	44
COCC[C@@H](C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819370274	CF	On-Demand	Anodyne	ADRB2	46	44
COCC[C@@H](C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819370274	CF	On-Demand	Anodyne	ADRB1	49	44
COCC[C@@H](C)CNC[C@H](O)c1cccc(Cl)c1	ZINC000819370274	CF	On-Demand	Anodyne	ADRB3	59	44
COCC[C@H](C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819370275	CF	On-Demand	Anodyne	ADRB2	46	44
COCC[C@H](C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819370275	CF	On-Demand	Anodyne	ADRB1	49	44
COCC[C@H](C)CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819370275	CF	On-Demand	Anodyne	ADRB3	59	44
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2Cc3cnn(-c4ccccc4)c3C2)C1	ZINC000819370321	IH	On-Demand	Anodyne	GRIN2B	17	40
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2Cc3cnn(-c4ccccc4)c3C2)C1	ZINC000819370321	IH	On-Demand	Anodyne	CPT2	40	33
O=C(OCc1ccccc1)N1CCC[C@H](C(=O)N2Cc3cnn(-c4ccccc4)c3C2)C1	ZINC000819370321	IH	On-Demand	Anodyne	PREP	69	48
O=C(OCc1ccccc1)N1CCC[C@@H](C(=O)N2Cc3cnn(-c4ccccc4)c3C2)C1	ZINC000819370322	IH	On-Demand	Anodyne	GRIN2B	17	40
O=C(OCc1ccccc1)N1CCC[C@@H](C(=O)N2Cc3cnn(-c4ccccc4)c3C2)C1	ZINC000819370322	IH	On-Demand	Anodyne	CPT2	40	33
O=C(OCc1ccccc1)N1CCC[C@@H](C(=O)N2Cc3cnn(-c4ccccc4)c3C2)C1	ZINC000819370322	IH	On-Demand	Anodyne	PREP	69	48
COc1ccc2c(C)c(CCC(=O)N3Cc4cnn(-c5ccccc5)c4C3)c(=O)oc2c1	ZINC000819370339	IH	On-Demand	Anodyne	MAOB	33	40
CC(C)(C)OC(=O)N1CCC(CCC(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819370360	HI	On-Demand	Anodyne	GPR119	47	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(C)(C)OCC2CC2)CC1	ZINC000819370372	FF	On-Demand	Anodyne	GPR119	28	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(C)(C)OCC2CC2)CC1	ZINC000819370374	FF	On-Demand	Anodyne	GPR119	28	40
CC[C@@H](CNC[C@H](O)c1cccnc1)CC(F)(F)F	ZINC000819370379	CF	On-Demand	Anodyne	ADRB2	22	42
CC[C@@H](CNC[C@H](O)c1cccnc1)CC(F)(F)F	ZINC000819370379	CF	On-Demand	Anodyne	ADRB1	24	42
CC[C@@H](CNC[C@H](O)c1cccnc1)CC(F)(F)F	ZINC000819370379	CF	On-Demand	Anodyne	ADRB3	90	42
CC[C@@H](CNC[C@@H](O)c1cccnc1)CC(F)(F)F	ZINC000819370381	CF	On-Demand	Anodyne	ADRB2	22	42
CC[C@@H](CNC[C@@H](O)c1cccnc1)CC(F)(F)F	ZINC000819370381	CF	On-Demand	Anodyne	ADRB1	24	42
CC[C@@H](CNC[C@@H](O)c1cccnc1)CC(F)(F)F	ZINC000819370381	CF	On-Demand	Anodyne	ADRB3	90	42
O=C(/C=C/[C@H]1CCCO1)N1CC(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819370399	EG	On-Demand	Anodyne	LIPG	15	40
O=C(/C=C\[C@@H]1CCCO1)N1CC(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819370400	EG	On-Demand	Anodyne	LIPG	15	40
O=C(/C=C/[C@@H]1CCCO1)N1CC(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819370401	EG	On-Demand	Anodyne	LIPG	15	40
O=C(/C=C\[C@H]1CCCO1)N1CC(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819370402	EG	On-Demand	Anodyne	LIPG	15	40
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370411	GH	On-Demand	Anodyne	CPT1A	52	43
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370411	GH	On-Demand	Anodyne	CPT2	52	43
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370411	GH	On-Demand	Anodyne	PREP	91	52
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370411	GH	On-Demand	Anodyne	SFRP1	52	44
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370411	GH	On-Demand	Anodyne	WNT3	58	44
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCC(O)CC2)cc1	ZINC000819370433	GE	On-Demand	Anodyne	HTR1D	52	45
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1ccc(N2CCC(O)CC2)cc1	ZINC000819370433	GE	On-Demand	Anodyne	HTR1B	44	45
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819370451	DE	On-Demand	Anodyne	ADRB3	26	40
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)C1	ZINC000819370453	DE	On-Demand	Anodyne	ADRB3	26	40
COc1cc(NC2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)cc(OC)c1	ZINC000819370454	FF	On-Demand	Anodyne	ITGAL	41	33
O=C1[C@@H](NC[C@@H](O)c2ccccc2C(F)(F)F)CCN1c1ccc(F)cc1	ZINC000819370455	GG	On-Demand	Anodyne	RBP4	40	32
O=C1[C@H](NC[C@@H](O)c2ccccc2C(F)(F)F)CCN1c1ccc(F)cc1	ZINC000819370456	GG	On-Demand	Anodyne	RBP4	40	32
O=C1[C@@H](NC[C@H](O)c2ccccc2C(F)(F)F)CCN1c1ccc(F)cc1	ZINC000819370457	GG	On-Demand	Anodyne	RBP4	40	32
COc1cc(NC2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)cc(OC)c1	ZINC000819370458	FF	On-Demand	Anodyne	ITGAL	41	33
O=C1[C@H](NC[C@H](O)c2ccccc2C(F)(F)F)CCN1c1ccc(F)cc1	ZINC000819370459	GG	On-Demand	Anodyne	RBP4	40	32
COc1cc(NC2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)cc(OC)c1	ZINC000819370460	FF	On-Demand	Anodyne	ITGAL	41	33
COc1cc(NC2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)cc(OC)c1	ZINC000819370462	FF	On-Demand	Anodyne	ITGAL	41	33
O=C(Nc1cnc2ccccc2c1)c1cc(S(=O)(=O)N2CCOCC2)ccc1Br	ZINC000819370471	JG	On-Demand	Anodyne	MERTK	36	44
O=C(Nc1cnc2ccccc2c1)c1cc(S(=O)(=O)N2CCOCC2)ccc1Br	ZINC000819370471	JG	On-Demand	Anodyne	NAMPT	24	42
CSc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370473	ED	On-Demand	Anodyne	ADRB2	50	44
CSc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370473	ED	On-Demand	Anodyne	ADRB1	80	44
CSc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370473	ED	On-Demand	Anodyne	ADRB3	53	44
CSc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370474	ED	On-Demand	Anodyne	ADRB2	50	44
CSc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370474	ED	On-Demand	Anodyne	ADRB1	80	44
CSc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370474	ED	On-Demand	Anodyne	ADRB3	53	44
O=C(C[C@@H]1CCCN1C(=O)C(F)=C1CCC1)c1ccccc1	ZINC000819370481	DH	On-Demand	Anodyne	PREP	58	47
O=C(C[C@H]1CCCN1C(=O)C(F)=C1CCC1)c1ccccc1	ZINC000819370483	DH	On-Demand	Anodyne	PREP	58	47
O=S(=O)(CCNC[C@@H](O)COc1cccc(Br)c1)C1CC1	ZINC000819370492	GD	On-Demand	Anodyne	ADRB2	43	44
O=S(=O)(CCNC[C@@H](O)COc1cccc(Br)c1)C1CC1	ZINC000819370492	GD	On-Demand	Anodyne	ADRB1	79	49
O=S(=O)(CCNC[C@@H](O)COc1cccc(Br)c1)C1CC1	ZINC000819370492	GD	On-Demand	Anodyne	ADRB3	51	41
O=S(=O)(CCNC[C@H](O)COc1cccc(Br)c1)C1CC1	ZINC000819370494	GD	On-Demand	Anodyne	ADRB2	43	44
O=S(=O)(CCNC[C@H](O)COc1cccc(Br)c1)C1CC1	ZINC000819370494	GD	On-Demand	Anodyne	ADRB1	79	49
O=S(=O)(CCNC[C@H](O)COc1cccc(Br)c1)C1CC1	ZINC000819370494	GD	On-Demand	Anodyne	ADRB3	51	41
O=S(=O)(CCNC[C@@H](O)c1cccc(F)c1)C1CC1	ZINC000819370509	CD	On-Demand	Anodyne	ADRB1	33	41
O=S(=O)(CCNC[C@@H](O)c1cccc(F)c1)C1CC1	ZINC000819370509	CD	On-Demand	Anodyne	ADRB3	61	41
O=S(=O)(CCNC[C@H](O)c1cccc(F)c1)C1CC1	ZINC000819370511	CD	On-Demand	Anodyne	ADRB1	33	41
O=S(=O)(CCNC[C@H](O)c1cccc(F)c1)C1CC1	ZINC000819370511	CD	On-Demand	Anodyne	ADRB3	61	41
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2ccc(F)cc2)C1	ZINC000819370513	CD	On-Demand	Anodyne	SLC6A3	42	45
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2ccc(F)cc2)C1	ZINC000819370514	CD	On-Demand	Anodyne	SLC6A3	42	45
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819370519	DE	On-Demand	Anodyne	ADRB1	18	40
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819370519	DE	On-Demand	Anodyne	ADRB3	29	40
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819370519	DE	On-Demand	Anodyne	CCR2	53	36
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819370519	DE	On-Demand	Anodyne	PDS	43	34
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819370520	DE	On-Demand	Anodyne	ADRB1	18	40
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819370520	DE	On-Demand	Anodyne	ADRB3	29	40
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819370520	DE	On-Demand	Anodyne	CCR2	53	36
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819370520	DE	On-Demand	Anodyne	PDS	43	34
O=S(=O)(CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1)C1CC1	ZINC000819370535	FD	On-Demand	Anodyne	ADRB2	40	42
O=S(=O)(CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1)C1CC1	ZINC000819370535	FD	On-Demand	Anodyne	ADRB1	70	51
O=S(=O)(CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1)C1CC1	ZINC000819370535	FD	On-Demand	Anodyne	ADRB3	44	40
O=S(=O)(CCNC[C@@H](O)COc1cccc(C(F)(F)F)c1)C1CC1	ZINC000819370535	FD	On-Demand	Anodyne	PDS	47	40
O=S(=O)(CCNC[C@H](O)COc1cccc(C(F)(F)F)c1)C1CC1	ZINC000819370537	FD	On-Demand	Anodyne	ADRB2	40	42
O=S(=O)(CCNC[C@H](O)COc1cccc(C(F)(F)F)c1)C1CC1	ZINC000819370537	FD	On-Demand	Anodyne	ADRB1	70	51
O=S(=O)(CCNC[C@H](O)COc1cccc(C(F)(F)F)c1)C1CC1	ZINC000819370537	FD	On-Demand	Anodyne	ADRB3	44	40
O=S(=O)(CCNC[C@H](O)COc1cccc(C(F)(F)F)c1)C1CC1	ZINC000819370537	FD	On-Demand	Anodyne	PDS	47	40
COC(=O)[C@H]1C[C@@H](NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000819370539	GC	On-Demand	Clean	DRD4	44	36
COC(=O)[C@H]1C[C@@H](NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000819370539	GC	On-Demand	Clean	ACOX1	43	30
COC(=O)[C@H]1C[C@@H](NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000819370539	GC	On-Demand	Clean	ABCB1	46	40
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000819370541	GC	On-Demand	Clean	DRD4	44	36
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000819370541	GC	On-Demand	Clean	ACOX1	43	30
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000819370541	GC	On-Demand	Clean	ABCB1	46	40
O=S(=O)(CCNC[C@@H](O)COc1ccc2c(c1)OCO2)C1CC1	ZINC000819370561	EC	On-Demand	Anodyne	ADRB2	35	42
O=S(=O)(CCNC[C@@H](O)COc1ccc2c(c1)OCO2)C1CC1	ZINC000819370561	EC	On-Demand	Anodyne	ADRB1	64	42
O=S(=O)(CCNC[C@@H](O)COc1ccc2c(c1)OCO2)C1CC1	ZINC000819370561	EC	On-Demand	Anodyne	ADRB3	43	41
O=S(=O)(CCNC[C@H](O)COc1ccc2c(c1)OCO2)C1CC1	ZINC000819370562	EC	On-Demand	Anodyne	ADRB2	35	42
O=S(=O)(CCNC[C@H](O)COc1ccc2c(c1)OCO2)C1CC1	ZINC000819370562	EC	On-Demand	Anodyne	ADRB1	64	42
O=S(=O)(CCNC[C@H](O)COc1ccc2c(c1)OCO2)C1CC1	ZINC000819370562	EC	On-Demand	Anodyne	ADRB3	43	41
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2cccc(F)c2)C1	ZINC000819370565	CD	On-Demand	Anodyne	SLC6A3	19	42
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2cccc(F)c2)C1	ZINC000819370566	CD	On-Demand	Anodyne	SLC6A3	19	42
CC(=O)Nc1cccc(CC(=O)N2CCC(C3(C)OCCO3)CC2)c1	ZINC000819370572	EE	On-Demand	Anodyne	EPHX2	20	40
CC(=O)Nc1cccc(CC(=O)N2CCC(C3(C)OCCO3)CC2)c1	ZINC000819370572	EE	On-Demand	Anodyne	P2RY14	42	33
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc(OCc3ccccc3)nc2)C1	ZINC000819370615	FF	On-Demand	Anodyne	PREP	63	40
O=C(O)C[C@H]1CCCN(C(=O)c2ccc(OCc3ccccc3)nc2)C1	ZINC000819370616	FF	On-Demand	Anodyne	PREP	63	40
O=C(O)C[C@@H]1CCCN(C(=O)c2cccc(Cn3ccnc3)c2)C1	ZINC000819370620	EE	On-Demand	Anodyne	CYP11B1	35	44
O=C(O)C[C@@H]1CCCN(C(=O)c2cccc(Cn3ccnc3)c2)C1	ZINC000819370620	EE	On-Demand	Anodyne	TBXAS1	43	48
O=C(O)C[C@@H]1CCCN(C(=O)c2cccc(Cn3ccnc3)c2)C1	ZINC000819370620	EE	On-Demand	Anodyne	CYP11B2	19	44
O=C(O)C[C@H]1CCCN(C(=O)c2cccc(Cn3ccnc3)c2)C1	ZINC000819370623	EE	On-Demand	Anodyne	CYP11B1	35	44
O=C(O)C[C@H]1CCCN(C(=O)c2cccc(Cn3ccnc3)c2)C1	ZINC000819370623	EE	On-Demand	Anodyne	TBXAS1	43	48
O=C(O)C[C@H]1CCCN(C(=O)c2cccc(Cn3ccnc3)c2)C1	ZINC000819370623	EE	On-Demand	Anodyne	CYP11B2	19	44
O=C(O)C[C@@H]1CCCN(C(=O)c2cc[n+]([O-])cc2)C1	ZINC000819370624	CC	On-Demand	Anodyne	L3MBTL3	46	38
O=C(O)C[C@H]1CCCN(C(=O)c2cc[n+]([O-])cc2)C1	ZINC000819370625	CC	On-Demand	Anodyne	L3MBTL3	46	38
O=C(O)C[C@H]1CCCN(C(=O)c2ccc(-n3ccnc3)nn2)C1	ZINC000819370640	DC	On-Demand	Anodyne	NOS2	50	32
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc(-n3ccnc3)nn2)C1	ZINC000819370647	DC	On-Demand	Anodyne	NOS2	50	32
O=C(O)C[C@H]1CCCN(C(=O)c2cc3c(ccc4ccccc43)[nH]2)C1	ZINC000819370678	EH	On-Demand	Anodyne	GRIN2B	38	47
O=C(O)C[C@H]1CCCN(C(=O)c2cc3c(ccc4ccccc43)[nH]2)C1	ZINC000819370678	EH	On-Demand	Anodyne	HRH4	24	43
O=C(O)C[C@H]1CCCN(C(=O)c2cc3c(ccc4ccccc43)[nH]2)C1	ZINC000819370678	EH	On-Demand	Anodyne	AKR1C3	19	44
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3c(ccc4ccccc43)[nH]2)C1	ZINC000819370682	EH	On-Demand	Anodyne	GRIN2B	38	47
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3c(ccc4ccccc43)[nH]2)C1	ZINC000819370682	EH	On-Demand	Anodyne	HRH4	24	43
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3c(ccc4ccccc43)[nH]2)C1	ZINC000819370682	EH	On-Demand	Anodyne	AKR1C3	19	44
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc(C(F)F)cc2)C1	ZINC000819370685	CF	On-Demand	Anodyne	L3MBTL3	64	40
O=C(O)C[C@H]1CCCN(C(=O)c2ccc(C(F)F)cc2)C1	ZINC000819370686	CF	On-Demand	Anodyne	L3MBTL3	64	40
O=C(O)C[C@H]1CCCN(C(=O)c2cc3ccsc3[nH]2)C1	ZINC000819370689	CF	On-Demand	Anodyne	HRH4	26	56
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3ccsc3[nH]2)C1	ZINC000819370691	CF	On-Demand	Anodyne	HRH4	26	56
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC000819370693	DG	On-Demand	Anodyne	F10	19	40
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC000819370693	DG	On-Demand	Anodyne	GRIN2B	30	46
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC000819370693	DG	On-Demand	Anodyne	HRH4	36	60
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC000819370693	DG	On-Demand	Anodyne	CYP51A1	24	41
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC000819370693	DG	On-Demand	Anodyne	PYGL	85	45
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC000819370693	DG	On-Demand	Anodyne	PYGM	15	43
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC000819370693	DG	On-Demand	Anodyne	AKR1C3	19	44
O=C(O)C[C@H]1CCCN(C(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC000819370696	DG	On-Demand	Anodyne	F10	19	40
O=C(O)C[C@H]1CCCN(C(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC000819370696	DG	On-Demand	Anodyne	GRIN2B	30	46
O=C(O)C[C@H]1CCCN(C(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC000819370696	DG	On-Demand	Anodyne	HRH4	36	60
O=C(O)C[C@H]1CCCN(C(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC000819370696	DG	On-Demand	Anodyne	CYP51A1	24	41
O=C(O)C[C@H]1CCCN(C(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC000819370696	DG	On-Demand	Anodyne	PYGL	85	45
O=C(O)C[C@H]1CCCN(C(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC000819370696	DG	On-Demand	Anodyne	PYGM	15	43
O=C(O)C[C@H]1CCCN(C(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC000819370696	DG	On-Demand	Anodyne	AKR1C3	19	44
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc(CN3CCCC3)cc2)C1	ZINC000819370698	EF	On-Demand	Anodyne	ACHE	22	40
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc(CN3CCCC3)cc2)C1	ZINC000819370698	EF	On-Demand	Anodyne	SLC6A1	53	33
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc(CN3CCCC3)cc2)C1	ZINC000819370698	EF	On-Demand	Anodyne	HRH3	34	50
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc(CN3CCCC3)cc2)C1	ZINC000819370698	EF	On-Demand	Anodyne	SIGMAR1	31	43
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc(CN3CCCC3)cc2)C1	ZINC000819370698	EF	On-Demand	Anodyne	L3MBTL3	81	54
O=C(O)C[C@H]1CCCN(C(=O)c2ccc(CN3CCCC3)cc2)C1	ZINC000819370699	EF	On-Demand	Anodyne	ACHE	22	40
O=C(O)C[C@H]1CCCN(C(=O)c2ccc(CN3CCCC3)cc2)C1	ZINC000819370699	EF	On-Demand	Anodyne	SLC6A1	53	33
O=C(O)C[C@H]1CCCN(C(=O)c2ccc(CN3CCCC3)cc2)C1	ZINC000819370699	EF	On-Demand	Anodyne	HRH3	34	50
O=C(O)C[C@H]1CCCN(C(=O)c2ccc(CN3CCCC3)cc2)C1	ZINC000819370699	EF	On-Demand	Anodyne	SIGMAR1	31	43
O=C(O)C[C@H]1CCCN(C(=O)c2ccc(CN3CCCC3)cc2)C1	ZINC000819370699	EF	On-Demand	Anodyne	L3MBTL3	81	54
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3c(OC(F)F)cccc3[nH]2)C1	ZINC000819370700	FG	On-Demand	Anodyne	GRIN2B	28	46
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3c(OC(F)F)cccc3[nH]2)C1	ZINC000819370700	FG	On-Demand	Anodyne	HRH4	15	45
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3c(OC(F)F)cccc3[nH]2)C1	ZINC000819370700	FG	On-Demand	Anodyne	AKR1C3	16	40
O=C(O)C[C@H]1CCCN(C(=O)c2cc3c(OC(F)F)cccc3[nH]2)C1	ZINC000819370701	FG	On-Demand	Anodyne	GRIN2B	28	46
O=C(O)C[C@H]1CCCN(C(=O)c2cc3c(OC(F)F)cccc3[nH]2)C1	ZINC000819370701	FG	On-Demand	Anodyne	HRH4	15	45
O=C(O)C[C@H]1CCCN(C(=O)c2cc3c(OC(F)F)cccc3[nH]2)C1	ZINC000819370701	FG	On-Demand	Anodyne	AKR1C3	16	40
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc(N3CCc4ccccc4C3)cc2)C1	ZINC000819370706	GH	On-Demand	Anodyne	L3MBTL3	43	37
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)c(C)c1	ZINC000819370707	ED	On-Demand	Anodyne	ADRB2	34	44
Cc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)c(C)c1	ZINC000819370707	ED	On-Demand	Anodyne	ADRB1	50	39
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)c(C)c1	ZINC000819370709	ED	On-Demand	Anodyne	ADRB2	34	44
Cc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)c(C)c1	ZINC000819370709	ED	On-Demand	Anodyne	ADRB1	50	39
O=C(O)C[C@H]1CCCN(C(=O)c2ccc(N3CCc4ccccc4C3)cc2)C1	ZINC000819370711	GH	On-Demand	Anodyne	L3MBTL3	43	37
O=C(O)C[C@@H]1CCCN(C(=O)c2cccc[n+]2[O-])C1	ZINC000819370726	CC	On-Demand	Anodyne	SLC6A1	41	37
O=C(O)C[C@H]1CCCN(C(=O)c2cccc[n+]2[O-])C1	ZINC000819370729	CC	On-Demand	Anodyne	SLC6A1	41	37
O=S(=O)(CCNC[C@H](O)COc1ccc2ccccc2c1)C1CC1	ZINC000819370730	ED	On-Demand	Anodyne	ADRB2	58	52
O=S(=O)(CCNC[C@H](O)COc1ccc2ccccc2c1)C1CC1	ZINC000819370730	ED	On-Demand	Anodyne	ADRB1	91	45
O=S(=O)(CCNC[C@H](O)COc1ccc2ccccc2c1)C1CC1	ZINC000819370730	ED	On-Demand	Anodyne	ADRB3	63	48
O=S(=O)(CCNC[C@H](O)COc1ccc2ccccc2c1)C1CC1	ZINC000819370730	ED	On-Demand	Anodyne	ABCB1	16	40
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1	ZINC000819370732	EE	On-Demand	Bother	GRIN2B	23	46
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1	ZINC000819370732	EE	On-Demand	Bother	HRH4	19	60
O=S(=O)(CCNC[C@@H](O)COc1ccc2ccccc2c1)C1CC1	ZINC000819370733	ED	On-Demand	Anodyne	ADRB2	58	52
O=S(=O)(CCNC[C@@H](O)COc1ccc2ccccc2c1)C1CC1	ZINC000819370733	ED	On-Demand	Anodyne	ADRB1	91	45
O=S(=O)(CCNC[C@@H](O)COc1ccc2ccccc2c1)C1CC1	ZINC000819370733	ED	On-Demand	Anodyne	ADRB3	63	48
O=S(=O)(CCNC[C@@H](O)COc1ccc2ccccc2c1)C1CC1	ZINC000819370733	ED	On-Demand	Anodyne	ABCB1	16	40
O=C(O)C[C@H]1CCCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1	ZINC000819370734	EE	On-Demand	Bother	GRIN2B	23	46
O=C(O)C[C@H]1CCCN(C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)C1	ZINC000819370734	EE	On-Demand	Bother	HRH4	19	60
O[C@@H](CN[C@@H]1CCCC[C@H]1F)c1ccccc1Cl	ZINC000819370735	CG	On-Demand	Anodyne	OPRL1	36	40
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc(CN3CCCCC3)cc2)C1	ZINC000819370736	EF	On-Demand	Anodyne	SLC6A1	43	33
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc(CN3CCCCC3)cc2)C1	ZINC000819370736	EF	On-Demand	Anodyne	HRH3	37	52
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc(CN3CCCCC3)cc2)C1	ZINC000819370736	EF	On-Demand	Anodyne	SIGMAR1	29	50
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc(CN3CCCCC3)cc2)C1	ZINC000819370736	EF	On-Demand	Anodyne	DPP7	42	32
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc(CN3CCCCC3)cc2)C1	ZINC000819370736	EF	On-Demand	Anodyne	L3MBTL3	79	53
O=C(O)C[C@H]1CCCN(C(=O)c2ccc(CN3CCCCC3)cc2)C1	ZINC000819370738	EF	On-Demand	Anodyne	SLC6A1	43	33
O=C(O)C[C@H]1CCCN(C(=O)c2ccc(CN3CCCCC3)cc2)C1	ZINC000819370738	EF	On-Demand	Anodyne	HRH3	37	52
O=C(O)C[C@H]1CCCN(C(=O)c2ccc(CN3CCCCC3)cc2)C1	ZINC000819370738	EF	On-Demand	Anodyne	SIGMAR1	29	50
O=C(O)C[C@H]1CCCN(C(=O)c2ccc(CN3CCCCC3)cc2)C1	ZINC000819370738	EF	On-Demand	Anodyne	DPP7	42	32
O=C(O)C[C@H]1CCCN(C(=O)c2ccc(CN3CCCCC3)cc2)C1	ZINC000819370738	EF	On-Demand	Anodyne	L3MBTL3	79	53
O=C(O)C[C@H]1CCCN(C(=O)c2ccc3nc(O)[nH]c3c2)C1	ZINC000819370740	DD	On-Demand	Anodyne	GRIN2B	35	42
O=C(O)C[C@H]1CCCN(C(=O)c2ccc3nc(O)[nH]c3c2)C1	ZINC000819370740	DD	On-Demand	Anodyne	L3MBTL3	40	34
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc3nc(O)[nH]c3c2)C1	ZINC000819370741	DD	On-Demand	Anodyne	GRIN2B	35	42
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc3nc(O)[nH]c3c2)C1	ZINC000819370741	DD	On-Demand	Anodyne	L3MBTL3	40	34
O=C(O)C[C@@H]1CCCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1	ZINC000819370742	EE	On-Demand	Bother	GABRA1	15	47
O=C(O)C[C@@H]1CCCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1	ZINC000819370742	EE	On-Demand	Bother	GABRA2	15	47
O=C(O)C[C@H]1CCCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1	ZINC000819370744	EE	On-Demand	Bother	GABRA1	15	47
O=C(O)C[C@H]1CCCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1	ZINC000819370744	EE	On-Demand	Bother	GABRA2	15	47
O=C(O)C[C@H]1CCCN(C(=O)c2ccc3nc(Cl)ccc3c2)C1	ZINC000819370745	EG	On-Demand	Anodyne	L3MBTL3	42	38
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc3nc(Cl)ccc3c2)C1	ZINC000819370746	EG	On-Demand	Anodyne	L3MBTL3	42	38
O=C(O)C[C@@H]1CCCN(C(=O)c2cc(Oc3ccccc3)ccc2O)C1	ZINC000819370759	FH	On-Demand	Anodyne	MMP2	19	45
O=C(O)C[C@@H]1CCCN(C(=O)c2cc(Oc3ccccc3)ccc2O)C1	ZINC000819370759	FH	On-Demand	Anodyne	MMP9	21	45
O=C(O)C[C@H]1CCCN(C(=O)c2cc(Oc3ccccc3)ccc2O)C1	ZINC000819370760	FH	On-Demand	Anodyne	MMP2	19	45
O=C(O)C[C@H]1CCCN(C(=O)c2cc(Oc3ccccc3)ccc2O)C1	ZINC000819370760	FH	On-Demand	Anodyne	MMP9	21	45
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3c(Br)cccc3[nH]2)C1	ZINC000819370764	FG	On-Demand	Anodyne	GRIN2B	28	48
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3c(Br)cccc3[nH]2)C1	ZINC000819370764	FG	On-Demand	Anodyne	HRH4	22	56
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3c(Br)cccc3[nH]2)C1	ZINC000819370764	FG	On-Demand	Anodyne	AKR1C3	17	40
O=C(O)C[C@H]1CCCN(C(=O)c2cc3c(Br)cccc3[nH]2)C1	ZINC000819370765	FG	On-Demand	Anodyne	GRIN2B	28	48
O=C(O)C[C@H]1CCCN(C(=O)c2cc3c(Br)cccc3[nH]2)C1	ZINC000819370765	FG	On-Demand	Anodyne	HRH4	22	56
O=C(O)C[C@H]1CCCN(C(=O)c2cc3c(Br)cccc3[nH]2)C1	ZINC000819370765	FG	On-Demand	Anodyne	AKR1C3	17	40
O=C(O)C[C@@H]1CCCN(C(=O)c2cccc(CN3CCOCC3)c2)C1	ZINC000819370769	ED	On-Demand	Anodyne	SIGMAR1	23	42
O=C(O)C[C@H]1CCCN(C(=O)c2cccc(CN3CCOCC3)c2)C1	ZINC000819370770	ED	On-Demand	Anodyne	SIGMAR1	23	42
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3ccc(OC(F)(F)F)cc3[nH]2)C1	ZINC000819370771	FG	On-Demand	Anodyne	GRIN2B	29	46
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3ccc(OC(F)(F)F)cc3[nH]2)C1	ZINC000819370771	FG	On-Demand	Anodyne	AKR1C3	18	41
O=S(=O)(CCNC[C@@H](O)COc1ccc(F)cc1)C1CC1	ZINC000819370773	DC	On-Demand	Anodyne	ADRB2	54	50
O=S(=O)(CCNC[C@@H](O)COc1ccc(F)cc1)C1CC1	ZINC000819370773	DC	On-Demand	Anodyne	ADRB1	92	52
O=S(=O)(CCNC[C@@H](O)COc1ccc(F)cc1)C1CC1	ZINC000819370773	DC	On-Demand	Anodyne	GRIN1	16	54
O=S(=O)(CCNC[C@@H](O)COc1ccc(F)cc1)C1CC1	ZINC000819370773	DC	On-Demand	Anodyne	ADRB3	58	50
O=S(=O)(CCNC[C@H](O)COc1ccc(F)cc1)C1CC1	ZINC000819370774	DC	On-Demand	Anodyne	ADRB2	54	50
O=S(=O)(CCNC[C@H](O)COc1ccc(F)cc1)C1CC1	ZINC000819370774	DC	On-Demand	Anodyne	ADRB1	92	52
O=S(=O)(CCNC[C@H](O)COc1ccc(F)cc1)C1CC1	ZINC000819370774	DC	On-Demand	Anodyne	GRIN1	16	54
O=S(=O)(CCNC[C@H](O)COc1ccc(F)cc1)C1CC1	ZINC000819370774	DC	On-Demand	Anodyne	ADRB3	58	50
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)c2cc(OC)ccc2OC)C1	ZINC000819370778	DD	On-Demand	Anodyne	MTNR1A	34	45
COC(=O)[C@H]1C[C@@H](NC[C@H](O)c2cc(OC)ccc2OC)C1	ZINC000819370779	DD	On-Demand	Anodyne	MTNR1A	34	45
O=C(O)C[C@H]1CCCN(C(=O)c2cc3ccc(OC(F)(F)F)cc3[nH]2)C1	ZINC000819370811	FG	On-Demand	Anodyne	GRIN2B	29	46
O=C(O)C[C@H]1CCCN(C(=O)c2cc3ccc(OC(F)(F)F)cc3[nH]2)C1	ZINC000819370811	FG	On-Demand	Anodyne	AKR1C3	18	41
CCn1ccc(CNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819370824	CE	On-Demand	Anodyne	ADRB1	29	42
CCn1ccc(CNC[C@H](O)c2cccc(Cl)c2)n1	ZINC000819370824	CE	On-Demand	Anodyne	ADRB3	44	42
O=C(O)C[C@H]1CCCN(C(=O)c2ccc(F)c(I)c2)C1	ZINC000819370825	GF	On-Demand	Anodyne	L3MBTL3	51	35
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc(F)c(I)c2)C1	ZINC000819370831	GF	On-Demand	Anodyne	L3MBTL3	51	35
CCn1ccc(CNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819370836	CE	On-Demand	Anodyne	ADRB1	29	42
CCn1ccc(CNC[C@@H](O)c2cccc(Cl)c2)n1	ZINC000819370836	CE	On-Demand	Anodyne	ADRB3	44	42
O=C(O)C[C@H]1CCCN(C(=O)c2cc3ccccn3c2)C1	ZINC000819370843	CE	On-Demand	Anodyne	L3MBTL3	47	35
O=S(=O)(CCNC[C@@H](O)COCc1ccccc1Cl)C1CC1	ZINC000819370845	ED	On-Demand	Anodyne	ADRB1	31	40
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3ccccn3c2)C1	ZINC000819370847	CE	On-Demand	Anodyne	L3MBTL3	47	35
O=S(=O)(CCNC[C@H](O)COCc1ccccc1Cl)C1CC1	ZINC000819370848	ED	On-Demand	Anodyne	ADRB1	31	40
O=C(O)C[C@H]1CCCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)C1	ZINC000819370857	FH	On-Demand	Anodyne	GRIN2B	23	42
O=C(O)C[C@H]1CCCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)C1	ZINC000819370857	FH	On-Demand	Anodyne	HRH4	23	56
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)C1	ZINC000819370864	FH	On-Demand	Anodyne	GRIN2B	23	42
O=C(O)C[C@@H]1CCCN(C(=O)c2cc3c(Cl)c(Cl)ccc3[nH]2)C1	ZINC000819370864	FH	On-Demand	Anodyne	HRH4	23	56
CC(=O)Nc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370867	FC	On-Demand	Anodyne	ADRB2	54	59
CC(=O)Nc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370867	FC	On-Demand	Anodyne	ADRB1	100	59
CC(=O)Nc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370867	FC	On-Demand	Anodyne	GRIN1	29	46
CC(=O)Nc1ccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370867	FC	On-Demand	Anodyne	ADRB3	65	59
CC(=O)Nc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370871	FC	On-Demand	Anodyne	ADRB2	54	59
CC(=O)Nc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370871	FC	On-Demand	Anodyne	ADRB1	100	59
CC(=O)Nc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370871	FC	On-Demand	Anodyne	GRIN1	29	46
CC(=O)Nc1ccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)cc1	ZINC000819370871	FC	On-Demand	Anodyne	ADRB3	65	59
O=C(Nc1cccc(CN2CCC(CO)CC2)c1)C(F)=C1CCC1	ZINC000819370875	EG	On-Demand	Anodyne	DRD4	20	40
O=C(Nc1cccc(CN2CCC(CO)CC2)c1)C(F)=C1CCC1	ZINC000819370875	EG	On-Demand	Anodyne	ACHE	34	42
O=C(Nc1cccc(CN2CCC(CO)CC2)c1)C(F)=C1CCC1	ZINC000819370875	EG	On-Demand	Anodyne	SIGMAR1	30	41
O=C(Nc1cccc(CN2CCC(CO)CC2)c1)C(F)=C1CCC1	ZINC000819370875	EG	On-Demand	Anodyne	CCR3	67	47
O=C(Nc1cccc(CN2CCC(CO)CC2)c1)C(F)=C1CCC1	ZINC000819370875	EG	On-Demand	Anodyne	MCHR1	24	41
COC(=O)[C@H]1C[C@@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819370876	FD	On-Demand	Anodyne	GPR119	26	42
COC(=O)[C@H]1C[C@@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000819370879	FD	On-Demand	Anodyne	GPR119	26	42
O=C(O)C[C@H]1CCCN(C(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)C1	ZINC000819370896	EC	On-Demand	Anodyne	PARP1	16	43
O=C(O)C[C@H]1CCCN(C(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)C1	ZINC000819370896	EC	On-Demand	Anodyne	L3MBTL3	68	37
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)C1	ZINC000819370899	EC	On-Demand	Anodyne	PARP1	16	43
O=C(O)C[C@@H]1CCCN(C(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)C1	ZINC000819370899	EC	On-Demand	Anodyne	L3MBTL3	68	37
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370951	IH	On-Demand	Anodyne	FKBP1A	50	40
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370951	IH	On-Demand	Anodyne	CELA1	22	53
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370951	IH	On-Demand	Anodyne	CPT1A	56	46
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370951	IH	On-Demand	Anodyne	CPT2	54	44
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370951	IH	On-Demand	Anodyne	PREP	127	64
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370951	IH	On-Demand	Anodyne	LGMN	73	43
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370951	IH	On-Demand	Anodyne	KLK5	24	44
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370953	IH	On-Demand	Anodyne	FKBP1A	50	40
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370953	IH	On-Demand	Anodyne	CELA1	22	53
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370953	IH	On-Demand	Anodyne	CPT1A	56	46
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370953	IH	On-Demand	Anodyne	CPT2	54	44
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370953	IH	On-Demand	Anodyne	PREP	127	64
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370953	IH	On-Demand	Anodyne	LGMN	73	43
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370953	IH	On-Demand	Anodyne	KLK5	24	44
CC(=O)c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)c1	ZINC000819370958	EC	On-Demand	Anodyne	ADRB2	46	46
CC(=O)c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)c1	ZINC000819370958	EC	On-Demand	Anodyne	ADRB1	88	44
CC(=O)c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)c1	ZINC000819370958	EC	On-Demand	Anodyne	ADRB3	57	41
CC(=O)c1cccc(OC[C@@H](O)CNCCS(=O)(=O)C2CC2)c1	ZINC000819370958	EC	On-Demand	Anodyne	ABCB1	20	47
CC(=O)c1cccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)c1	ZINC000819370960	EC	On-Demand	Anodyne	ADRB2	46	46
CC(=O)c1cccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)c1	ZINC000819370960	EC	On-Demand	Anodyne	ADRB1	88	44
CC(=O)c1cccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)c1	ZINC000819370960	EC	On-Demand	Anodyne	ADRB3	57	41
CC(=O)c1cccc(OC[C@H](O)CNCCS(=O)(=O)C2CC2)c1	ZINC000819370960	EC	On-Demand	Anodyne	ABCB1	20	47
C[C@@H](Cc1ccc(F)cc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819370962	EH	On-Demand	Anodyne	DPP8	19	41
O=S(=O)(CCNC[C@@H](O)COCc1ccccc1F)C1CC1	ZINC000819370968	EC	On-Demand	Anodyne	ADRB1	32	40
O=S(=O)(CCNC[C@H](O)COCc1ccccc1F)C1CC1	ZINC000819370971	EC	On-Demand	Anodyne	ADRB1	32	40
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371084	FF	On-Demand	Anodyne	CPT2	44	37
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371084	FF	On-Demand	Anodyne	PREP	32	44
NS(=O)(=O)c1cc(C(=O)N2Cc3cnn(-c4ccccc4)c3C2)ccc1Cl	ZINC000819371091	HE	On-Demand	Anodyne	CA6	17	44
NS(=O)(=O)c1cc(C(=O)N2Cc3cnn(-c4ccccc4)c3C2)ccc1Cl	ZINC000819371091	HE	On-Demand	Anodyne	CA1	15	44
NS(=O)(=O)c1cc(C(=O)N2Cc3cnn(-c4ccccc4)c3C2)ccc1Cl	ZINC000819371091	HE	On-Demand	Anodyne	CA7	20	44
NS(=O)(=O)c1cc(C(=O)N2Cc3cnn(-c4ccccc4)c3C2)ccc1Cl	ZINC000819371091	HE	On-Demand	Anodyne	CA13	37	44
NS(=O)(=O)c1cc(C(=O)N2Cc3cnn(-c4ccccc4)c3C2)ccc1Cl	ZINC000819371091	HE	On-Demand	Anodyne	CA4	15	44
CCOC(=O)N[C@H](C(=O)N1Cc2cnn(-c3ccccc3)c2C1)C(C)C	ZINC000819371135	FE	On-Demand	Anodyne	P2RY12	42	39
CCOC(=O)N[C@@H](C(=O)N1Cc2cnn(-c3ccccc3)c2C1)C(C)C	ZINC000819371136	FE	On-Demand	Anodyne	P2RY12	42	39
CO[C@H]1c2ccccc2C[C@H]1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819371145	GF	On-Demand	Anodyne	GPR119	35	46
CO[C@H]1c2ccccc2C[C@H]1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819371146	GF	On-Demand	Anodyne	GPR119	35	46
O=C1[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)CCN1c1ccc(F)cc1	ZINC000819371160	GG	On-Demand	Anodyne	TACR1	46	35
O=C1[C@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)CCN1c1ccc(F)cc1	ZINC000819371161	GG	On-Demand	Anodyne	TACR1	46	35
O=C1[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)CCN1c1ccc(F)cc1	ZINC000819371162	GG	On-Demand	Anodyne	TACR1	46	35
O=C1[C@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)CCN1c1ccc(F)cc1	ZINC000819371163	GG	On-Demand	Anodyne	TACR1	46	35
O=S(=O)(CCNC[C@@H](O)COc1ccccc1F)C1CC1	ZINC000819371169	DC	On-Demand	Anodyne	ADRB2	45	43
O=S(=O)(CCNC[C@@H](O)COc1ccccc1F)C1CC1	ZINC000819371169	DC	On-Demand	Anodyne	ADRB1	73	49
O=S(=O)(CCNC[C@@H](O)COc1ccccc1F)C1CC1	ZINC000819371169	DC	On-Demand	Anodyne	ADRB3	43	39
O=S(=O)(CCNC[C@@H](O)COc1ccccc1F)C1CC1	ZINC000819371169	DC	On-Demand	Anodyne	ABCB1	19	40
O=S(=O)(CCNC[C@H](O)COc1ccccc1F)C1CC1	ZINC000819371170	DC	On-Demand	Anodyne	ADRB2	45	43
O=S(=O)(CCNC[C@H](O)COc1ccccc1F)C1CC1	ZINC000819371170	DC	On-Demand	Anodyne	ADRB1	73	49
O=S(=O)(CCNC[C@H](O)COc1ccccc1F)C1CC1	ZINC000819371170	DC	On-Demand	Anodyne	ADRB3	43	39
O=S(=O)(CCNC[C@H](O)COc1ccccc1F)C1CC1	ZINC000819371170	DC	On-Demand	Anodyne	ABCB1	19	40
O=S(=O)(CCNC[C@H](O)COc1c(Cl)cccc1Cl)C1CC1	ZINC000819371171	FD	On-Demand	Anodyne	ADRB2	33	41
O=S(=O)(CCNC[C@H](O)COc1c(Cl)cccc1Cl)C1CC1	ZINC000819371171	FD	On-Demand	Anodyne	ADRB1	57	41
O=S(=O)(CCNC[C@@H](O)COc1c(Cl)cccc1Cl)C1CC1	ZINC000819371172	FD	On-Demand	Anodyne	ADRB2	33	41
O=S(=O)(CCNC[C@@H](O)COc1c(Cl)cccc1Cl)C1CC1	ZINC000819371172	FD	On-Demand	Anodyne	ADRB1	57	41
O=S(=O)(CCNC[C@@H](O)c1ccc(OC(F)(F)F)cc1)C1CC1	ZINC000819371204	FD	On-Demand	Anodyne	ADRB3	31	42
O=S(=O)(CCNC[C@H](O)c1ccc(OC(F)(F)F)cc1)C1CC1	ZINC000819371205	FD	On-Demand	Anodyne	ADRB3	31	42
O[C@@H](CN[C@@H]1CCCC[C@H]1F)c1cccc(Cl)c1	ZINC000819371226	CG	On-Demand	Anodyne	ADRB1	41	44
O[C@@H](CN[C@@H]1CCCC[C@H]1F)c1cccc(Cl)c1	ZINC000819371226	CG	On-Demand	Anodyne	ADRB3	53	46
O[C@@H](CN[C@@H]1CCCC[C@H]1F)c1cccc(Cl)c1	ZINC000819371226	CG	On-Demand	Anodyne	CYP3A4	40	33
O[C@H](CN[C@@H]1CCCC[C@H]1F)c1cccc(Cl)c1	ZINC000819371227	CG	On-Demand	Anodyne	ADRB1	41	44
O[C@H](CN[C@@H]1CCCC[C@H]1F)c1cccc(Cl)c1	ZINC000819371227	CG	On-Demand	Anodyne	ADRB3	53	46
O[C@H](CN[C@@H]1CCCC[C@H]1F)c1cccc(Cl)c1	ZINC000819371227	CG	On-Demand	Anodyne	CYP3A4	40	33
CCn1ccc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000819371235	FE	On-Demand	Anodyne	GPR119	49	46
CCn1ccc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000819371238	FE	On-Demand	Anodyne	GPR119	49	46
COCC1CCC(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819371249	FF	On-Demand	Anodyne	GPR119	29	41
COCC1CCC(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819371250	FF	On-Demand	Anodyne	GPR119	29	41
O=C(CCNCCS(=O)(=O)C1CC1)Nc1ccc(Oc2ccccc2)cc1	ZINC000819371263	GF	On-Demand	Anodyne	LTA4H	54	49
O=C(CCNCCS(=O)(=O)C1CC1)Nc1ccc(Oc2ccccc2)cc1	ZINC000819371263	GF	On-Demand	Anodyne	CA1	30	43
O=C(CCNCCS(=O)(=O)C1CC1)Nc1ccc(Oc2ccccc2)cc1	ZINC000819371263	GF	On-Demand	Anodyne	MMP2	15	45
CCOC(=O)[C@@H](NC(=O)Cc1cccc(NC(C)=O)c1)C(C)(C)C	ZINC000819371300	EE	On-Demand	Anodyne	KCNK3	53	34
CCOC(=O)[C@@H](NC(=O)Cc1cccc(NC(C)=O)c1)C(C)(C)C	ZINC000819371300	EE	On-Demand	Anodyne	KCNK9	57	34
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)cc1)C1CC1	ZINC000819371313	ED	On-Demand	Anodyne	ADRB2	49	50
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)cc1)C1CC1	ZINC000819371313	ED	On-Demand	Anodyne	ADRB1	88	52
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)cc1)C1CC1	ZINC000819371313	ED	On-Demand	Anodyne	GRIN1	26	54
O=S(=O)(CCNC[C@@H](O)COc1ccc(Cl)cc1)C1CC1	ZINC000819371313	ED	On-Demand	Anodyne	ADRB3	58	50
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)cc1)C1CC1	ZINC000819371316	ED	On-Demand	Anodyne	ADRB2	49	50
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)cc1)C1CC1	ZINC000819371316	ED	On-Demand	Anodyne	ADRB1	88	52
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)cc1)C1CC1	ZINC000819371316	ED	On-Demand	Anodyne	GRIN1	26	54
O=S(=O)(CCNC[C@H](O)COc1ccc(Cl)cc1)C1CC1	ZINC000819371316	ED	On-Demand	Anodyne	ADRB3	58	50
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371341	GG	On-Demand	Anodyne	P2RY12	153	38
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371341	GG	On-Demand	Anodyne	FPR1	46	37
O=S(=O)(CCNC[C@@H](O)COc1cc(F)cc(Br)c1)C1CC1	ZINC000819371343	GD	On-Demand	Anodyne	ADRB1	41	38
O=S(=O)(CCNC[C@H](O)COc1cc(F)cc(Br)c1)C1CC1	ZINC000819371346	GD	On-Demand	Anodyne	ADRB1	41	38
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2nc3ncccn3n2)CC1	ZINC000819371347	GD	On-Demand	Anodyne	GPR119	35	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2nc3ncccn3n2)CC1	ZINC000819371349	GD	On-Demand	Anodyne	GPR119	35	42
CC(C)(C)OC(=O)N1[C@H](C(=O)N2Cc3cnn(-c4ccccc4)c3C2)C[C@H]2CCCC[C@@H]21	ZINC000819371358	II	On-Demand	Anodyne	PREP	20	57
CC(C)(C)OC(=O)N1[C@H](C(=O)N2Cc3cnn(-c4ccccc4)c3C2)C[C@H]2CCCC[C@H]21	ZINC000819371361	II	On-Demand	Anodyne	PREP	20	57
CC(C)(C)OC(=O)N1[C@H](C(=O)N2Cc3cnn(-c4ccccc4)c3C2)C[C@@H]2CCCC[C@H]21	ZINC000819371364	II	On-Demand	Anodyne	PREP	20	57
CC(C)(C)OC(=O)N1[C@H](C(=O)N2Cc3cnn(-c4ccccc4)c3C2)C[C@@H]2CCCC[C@@H]21	ZINC000819371367	II	On-Demand	Anodyne	PREP	20	57
O=C(Nc1cnc2ccccc2c1)C1CCN(S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1	ZINC000819371377	JH	On-Demand	Bother	EPHX2	33	61
O=C(c1cc(-c2ccncc2)nc2ccccc12)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371380	HJ	On-Demand	Anodyne	PRS	20	40
O=C(c1ccc(-c2nnc(S)o2)cc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371415	GG	On-Demand	Anodyne	CYP73A16	56	42
Cn1cc([C@@H]2OCC[C@H]2CNC[C@H](O)c2cccnc2)cn1	ZINC000819371425	DD	On-Demand	Anodyne	ADRB3	69	41
Cn1cc([C@@H]2OCC[C@H]2CNC[C@@H](O)c2cccnc2)cn1	ZINC000819371427	DD	On-Demand	Anodyne	ADRB3	69	41
Cc1ccccc1CC1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819371461	GH	On-Demand	Mild	GHRHR	40	31
Cc1ccccc1CC1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819371461	GH	On-Demand	Mild	PAPA1_CARPA	49	45
Cc1ccccc1CC1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819371461	GH	On-Demand	Mild	CCKAR	52	42
Cc1ccccc1CC1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819371461	GH	On-Demand	Mild	CTSK	23	41
Cc1ccccc1CC1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819371461	GH	On-Demand	Mild	CTSL	19	45
Cc1ccccc1CC1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819371461	GH	On-Demand	Mild	CCKBR	16	42
Cc1ccccc1CC1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819371461	GH	On-Demand	Mild	CTSS	16	45
Cc1ccccc1CC1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819371461	GH	On-Demand	Mild	TGM2	16	40
Cc1ccccc1CC1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819371461	GH	On-Demand	Mild	FPR1	48	38
Cc1ccccc1CC1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819371462	GH	On-Demand	Mild	GHRHR	40	31
Cc1ccccc1CC1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819371462	GH	On-Demand	Mild	PAPA1_CARPA	49	45
Cc1ccccc1CC1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819371462	GH	On-Demand	Mild	CCKAR	52	42
Cc1ccccc1CC1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819371462	GH	On-Demand	Mild	CTSK	23	41
Cc1ccccc1CC1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819371462	GH	On-Demand	Mild	CTSL	19	45
Cc1ccccc1CC1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819371462	GH	On-Demand	Mild	CCKBR	16	42
Cc1ccccc1CC1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819371462	GH	On-Demand	Mild	CTSS	16	45
Cc1ccccc1CC1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819371462	GH	On-Demand	Mild	TGM2	16	40
Cc1ccccc1CC1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819371462	GH	On-Demand	Mild	FPR1	48	38
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371465	HE	On-Demand	Anodyne	P2RY12	40	36
Cc1cc(OCC(=O)N2Cc3cnn(-c4ccccc4)c3C2)no1	ZINC000819371481	DE	On-Demand	Anodyne	CPT2	40	33
O=C(OCc1ccccc1)N1CCC(C(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819371499	IH	On-Demand	Anodyne	GRIN2B	25	46
O=C(OCc1ccccc1)N1CCC(C(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819371499	IH	On-Demand	Anodyne	CPT2	40	33
O=C(OCc1ccccc1)N1CCC(C(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819371499	IH	On-Demand	Anodyne	PREP	37	44
O=C(OCc1ccccc1)N1CCC(C(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819371499	IH	On-Demand	Anodyne	TGM2	30	40
O=C(OCc1ccccc1)N1CCC(C(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819371499	IH	On-Demand	Anodyne	F13A1	38	40
O=C(c1cc([N+](=O)[O-])ccc1N1CCOCC1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371503	HF	On-Demand	Bother	SLC6A9	18	60
CC[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CC(F)(F)F	ZINC000819371567	GH	On-Demand	Anodyne	GPR119	29	44
CC[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CC(F)(F)F	ZINC000819371568	GH	On-Demand	Anodyne	GPR119	29	44
C=CCC1(C(=O)Nc2ccc(N3CCC(O)CC3)cc2)CCOCC1	ZINC000819371577	EF	On-Demand	Mild	STAT6	50	31
CC[C@@H](CNC[C@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819371609	DH	On-Demand	Anodyne	ADRB1	31	45
CC[C@@H](CNC[C@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819371609	DH	On-Demand	Anodyne	ADRB3	46	45
CC[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819371611	DH	On-Demand	Anodyne	ADRB1	31	45
CC[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819371611	DH	On-Demand	Anodyne	ADRB3	46	45
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371613	GE	On-Demand	Anodyne	PGC	42	30
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371613	GE	On-Demand	Anodyne	PAPA1_CARPA	35	40
COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371613	GE	On-Demand	Anodyne	FPR1	49	36
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371615	GE	On-Demand	Anodyne	PGC	42	30
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371615	GE	On-Demand	Anodyne	PAPA1_CARPA	35	40
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371615	GE	On-Demand	Anodyne	FPR1	49	36
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371660	IE	On-Demand	Anodyne	P2RY12	88	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371660	IE	On-Demand	Anodyne	KLK3	76	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371660	IE	On-Demand	Anodyne	CTSB	51	40
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371660	IE	On-Demand	Anodyne	PAPA1_CARPA	59	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371660	IE	On-Demand	Anodyne	CYSP_TRYCR	54	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371660	IE	On-Demand	Anodyne	CTSK	33	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371660	IE	On-Demand	Anodyne	CTSL	43	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371660	IE	On-Demand	Anodyne	CAPNS1	60	34
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371660	IE	On-Demand	Anodyne	MMP11	43	31
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371660	IE	On-Demand	Anodyne	CAPN1	65	45
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371660	IE	On-Demand	Anodyne	CAPN2	103	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371660	IE	On-Demand	Anodyne	TGM2	27	50
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371660	IE	On-Demand	Anodyne	NPR	52	31
O=C(NCCCCC(=O)N1Cc2cnn(-c3ccccc3)c2C1)OCc1ccccc1	ZINC000819371673	HH	On-Demand	Anodyne	PREP	15	55
O=C(NCCCCC(=O)N1Cc2cnn(-c3ccccc3)c2C1)OCc1ccccc1	ZINC000819371673	HH	On-Demand	Anodyne	TGM2	23	42
O=C(NCCCCC(=O)N1Cc2cnn(-c3ccccc3)c2C1)OCc1ccccc1	ZINC000819371673	HH	On-Demand	Anodyne	NPR	57	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371688	GG	On-Demand	Anodyne	ELANE	27	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371688	GG	On-Demand	Anodyne	KLK3	70	35
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371688	GG	On-Demand	Anodyne	CTSB	60	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371688	GG	On-Demand	Anodyne	PAPA1_CARPA	70	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371688	GG	On-Demand	Anodyne	CYSP_TRYCR	54	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371688	GG	On-Demand	Anodyne	CTSK	35	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371688	GG	On-Demand	Anodyne	CTSL	44	39
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371688	GG	On-Demand	Anodyne	CAPNS1	63	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371688	GG	On-Demand	Anodyne	CTSS	16	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371688	GG	On-Demand	Anodyne	CAPN1	73	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371688	GG	On-Demand	Anodyne	CAPN2	116	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371688	GG	On-Demand	Anodyne	TGM2	24	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371688	GG	On-Demand	Anodyne	NPR	69	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371688	GG	On-Demand	Anodyne	DPP8	20	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371688	GG	On-Demand	Anodyne	Q6PRC7_IXORI	41	33
O=C(COc1ccc2c(c1)CCC2)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371689	FG	On-Demand	Anodyne	CPT1A	57	44
O=C(COc1ccc2c(c1)CCC2)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371689	FG	On-Demand	Anodyne	CPT2	49	44
C[C@@H]1O[C@H](C)C[C@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819371806	GF	On-Demand	Anodyne	CTSD	86	41
C[C@@H]1O[C@H](C)C[C@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819371806	GF	On-Demand	Anodyne	PGC	58	37
C[C@@H]1O[C@H](C)C[C@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819371806	GF	On-Demand	Anodyne	PAPA1_CARPA	29	42
C[C@@H]1O[C@H](C)C[C@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819371806	GF	On-Demand	Anodyne	BACE2	51	41
C[C@@H]1O[C@H](C)C[C@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819371806	GF	On-Demand	Anodyne	REN	74	46
C[C@@H]1O[C@H](C)C[C@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819371806	GF	On-Demand	Anodyne	REN1	15	43
C[C@@H]1O[C@H](C)C[C@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819371806	GF	On-Demand	Anodyne	BACE1	77	41
C[C@@H]1O[C@H](C)C[C@H]1CNC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819371806	GF	On-Demand	Anodyne	FPR1	48	38
CCOC(=O)N1CCC(C(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819371814	FF	On-Demand	Anodyne	P2RY12	85	41
O=C([C@@H]1CCCN1C(=O)OCC(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371840	HF	On-Demand	Anodyne	CELA1	22	41
O=C([C@@H]1CCCN1C(=O)OCC(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371840	HF	On-Demand	Anodyne	CPT1A	18	41
O=C([C@@H]1CCCN1C(=O)OCC(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371840	HF	On-Demand	Anodyne	CPT2	49	40
O=C([C@@H]1CCCN1C(=O)OCC(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371840	HF	On-Demand	Anodyne	PREP	93	48
O=C([C@@H]1CCCN1C(=O)OCC(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371840	HF	On-Demand	Anodyne	SFRP1	46	37
O=C([C@@H]1CCCN1C(=O)OCC(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371840	HF	On-Demand	Anodyne	WNT3	56	37
O=C([C@H]1CCCN1C(=O)OCC(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371841	HF	On-Demand	Anodyne	CELA1	22	41
O=C([C@H]1CCCN1C(=O)OCC(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371841	HF	On-Demand	Anodyne	CPT1A	18	41
O=C([C@H]1CCCN1C(=O)OCC(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371841	HF	On-Demand	Anodyne	CPT2	49	40
O=C([C@H]1CCCN1C(=O)OCC(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371841	HF	On-Demand	Anodyne	PREP	93	48
O=C([C@H]1CCCN1C(=O)OCC(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371841	HF	On-Demand	Anodyne	SFRP1	46	37
O=C([C@H]1CCCN1C(=O)OCC(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371841	HF	On-Demand	Anodyne	WNT3	56	37
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371849	ID	On-Demand	Anodyne	KLK3	61	39
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371849	ID	On-Demand	Anodyne	CTSB	52	41
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371849	ID	On-Demand	Anodyne	PAPA1_CARPA	58	38
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371849	ID	On-Demand	Anodyne	CYSP_TRYCR	55	40
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371849	ID	On-Demand	Anodyne	CTSK	33	42
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371849	ID	On-Demand	Anodyne	CTSL	44	38
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371849	ID	On-Demand	Anodyne	CAPNS1	62	36
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371849	ID	On-Demand	Anodyne	MMP11	42	30
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371849	ID	On-Demand	Anodyne	CAPN1	68	38
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371849	ID	On-Demand	Anodyne	CAPN2	108	40
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371849	ID	On-Demand	Anodyne	TGM2	24	47
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371849	ID	On-Demand	Anodyne	NPR	59	32
C[C@@]1(C(=O)N2Cc3cnn(-c4ccccc4)c3C2)CCN(C(=O)OCc2ccccc2)C1	ZINC000819371853	IH	On-Demand	Anodyne	SLC12A5	48	33
C[C@]1(C(=O)N2Cc3cnn(-c4ccccc4)c3C2)CCN(C(=O)OCc2ccccc2)C1	ZINC000819371854	IH	On-Demand	Anodyne	SLC12A5	48	33
C#CCN1CCC[C@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371856	DD	On-Demand	Mild	CPT2	44	36
C#CCN1CCC[C@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371856	DD	On-Demand	Mild	PREP	67	36
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371858	HG	On-Demand	Anodyne	CPT1A	38	45
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371858	HG	On-Demand	Anodyne	CPT2	53	43
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371858	HG	On-Demand	Anodyne	PREP	105	59
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371858	HG	On-Demand	Anodyne	WNT3	43	39
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371859	HG	On-Demand	Anodyne	CPT1A	38	45
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371859	HG	On-Demand	Anodyne	CPT2	53	43
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371859	HG	On-Demand	Anodyne	PREP	105	59
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371859	HG	On-Demand	Anodyne	WNT3	43	39
C[C@@H](CC(=O)N1Cc2cnn(-c3ccccc3)c2C1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819371865	II	On-Demand	Anodyne	GPR119	45	45
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371866	FG	On-Demand	Anodyne	P2RY12	40	35
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371866	FG	On-Demand	Anodyne	FPR1	52	34
O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371868	IE	On-Demand	Anodyne	PREP	43	45
O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371868	IE	On-Demand	Anodyne	Q9NAW4_PLAFA	30	46
CCOC(=O)N1[C@H](C(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC[C@H]1c1ccc(C)o1	ZINC000819371873	IH	On-Demand	Anodyne	CPT2	40	37
CCOC(=O)N1[C@H](C(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC[C@@H]1c1ccc(C)o1	ZINC000819371874	IH	On-Demand	Anodyne	CPT2	40	37
CCOC(=O)N1[C@H](c2ccc(C)o2)CC[C@@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371875	IH	On-Demand	Anodyne	CPT2	40	37
CCOC(=O)N1[C@@H](C(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC[C@@H]1c1ccc(C)o1	ZINC000819371876	IH	On-Demand	Anodyne	CPT2	40	37
C[C@@H](CC(=O)N1Cc2cnn(-c3ccccc3)c2C1)NC(=O)OC(C)(C)C	ZINC000819371877	FG	On-Demand	Anodyne	FPR1	44	33
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371879	HG	On-Demand	Anodyne	POLG_HCV1	28	41
CC(C)(C)OC(=O)N[C@@H](CC(F)F)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371879	HG	On-Demand	Anodyne	FPR1	49	35
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371880	HG	On-Demand	Anodyne	POLG_HCV1	28	41
CC(C)(C)OC(=O)N[C@H](CC(F)F)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371880	HG	On-Demand	Anodyne	FPR1	49	35
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371882	IF	On-Demand	Anodyne	GRIN2B	17	40
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371891	GH	On-Demand	Anodyne	FPR1	47	33
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371892	GH	On-Demand	Anodyne	FPR1	47	33
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371897	HH	On-Demand	Anodyne	ACE	25	40
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371897	HH	On-Demand	Anodyne	FKBP1A	41	38
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371897	HH	On-Demand	Anodyne	CELA1	23	56
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371897	HH	On-Demand	Anodyne	CPT1A	29	43
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371897	HH	On-Demand	Anodyne	CPT2	51	42
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371897	HH	On-Demand	Anodyne	PREP	122	64
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371897	HH	On-Demand	Anodyne	LGMN	77	45
O=C([C@H]1CCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371897	HH	On-Demand	Anodyne	KLK5	25	46
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371937	HG	On-Demand	Anodyne	P2RY12	40	35
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371937	HG	On-Demand	Anodyne	PAPA1_CARPA	31	42
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371937	HG	On-Demand	Anodyne	FPR1	51	44
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371943	IF	On-Demand	Anodyne	CCR8	45	32
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371943	IF	On-Demand	Anodyne	SFRP1	111	34
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819371943	IF	On-Demand	Anodyne	WNT3	73	34
O=C(NC1CCN(S(=O)(=O)C2CC2)CC1)C(F)=C1CCC1	ZINC000819371980	DD	On-Demand	Anodyne	EPHX2	15	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCC(C)(C)S(C)(=O)=O)CC1	ZINC000819372010	GD	On-Demand	Anodyne	GPR119	45	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCC(C)(C)S(C)(=O)=O)CC1	ZINC000819372011	GD	On-Demand	Anodyne	GPR119	45	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H]1CC(=O)c1ccccc1)C2	ZINC000819372012	GG	On-Demand	Anodyne	PREP	46	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H]1CC(=O)c1ccccc1)C2	ZINC000819372013	GG	On-Demand	Anodyne	PREP	46	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H]1CC(=O)c1ccccc1)C2	ZINC000819372014	GG	On-Demand	Anodyne	PREP	46	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H]1CC(=O)c1ccccc1)C2	ZINC000819372015	GG	On-Demand	Anodyne	PREP	46	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC1CCN(S(=O)(=O)C2CC2)CC1	ZINC000819372022	GC	On-Demand	Anodyne	EPHX2	16	46
COc1ccc(OC)c([C@H](O)CNCCC(C)(C)S(C)(=O)=O)c1	ZINC000819372036	ED	On-Demand	Anodyne	ADRB2	17	46
COc1ccc(OC)c([C@H](O)CNCCC(C)(C)S(C)(=O)=O)c1	ZINC000819372036	ED	On-Demand	Anodyne	ADRB3	31	40
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000819372066	DE	On-Demand	Anodyne	L3MBTL3	36	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000819372077	GD	On-Demand	Anodyne	PREP	16	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H](CO)Cc1ccc(F)cc1	ZINC000819372130	FE	On-Demand	Anodyne	PAPA1_CARPA	28	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H](CO)Cc1ccc(F)cc1	ZINC000819372131	FE	On-Demand	Anodyne	PAPA1_CARPA	28	46
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000819372136	ED	On-Demand	Anodyne	ITGAL	40	31
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000819372136	ED	On-Demand	Anodyne	L3MBTL3	59	43
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000819372137	ED	On-Demand	Anodyne	ITGAL	40	31
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000819372137	ED	On-Demand	Anodyne	L3MBTL3	59	43
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000819372138	ED	On-Demand	Anodyne	ITGAL	40	31
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000819372138	ED	On-Demand	Anodyne	L3MBTL3	59	43
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000819372139	ED	On-Demand	Anodyne	ITGAL	40	31
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2cccc(O)c2)CC1	ZINC000819372139	ED	On-Demand	Anodyne	L3MBTL3	59	43
O=C(Nc1ccc(N2CCC(O)CC2)cc1)c1cc2c(cn1)OCCO2	ZINC000819372181	FE	On-Demand	Anodyne	MERTK	21	41
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000819372194	EF	On-Demand	Anodyne	CCR3	48	44
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000819372195	EF	On-Demand	Anodyne	CCR3	48	44
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000819372196	EF	On-Demand	Anodyne	CCR3	48	44
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000819372197	EF	On-Demand	Anodyne	CCR3	48	44
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819372198	FF	On-Demand	Anodyne	TSHR	52	30
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819372198	FF	On-Demand	Anodyne	HTR1D	27	40
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819372198	FF	On-Demand	Anodyne	HTR1B	31	40
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819372198	FF	On-Demand	Anodyne	MCHR1	34	40
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819372214	CH	On-Demand	Anodyne	ADRB2	22	43
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819372214	CH	On-Demand	Anodyne	ADRB1	37	46
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819372214	CH	On-Demand	Anodyne	ADRB3	53	46
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819372215	CH	On-Demand	Anodyne	ADRB2	22	43
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819372215	CH	On-Demand	Anodyne	ADRB1	37	46
C[C@H](CNC[C@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819372215	CH	On-Demand	Anodyne	ADRB3	53	46
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819372216	CH	On-Demand	Anodyne	ADRB2	22	43
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819372216	CH	On-Demand	Anodyne	ADRB1	37	46
C[C@H](CNC[C@@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819372216	CH	On-Demand	Anodyne	ADRB3	53	46
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819372217	CH	On-Demand	Anodyne	ADRB2	22	43
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819372217	CH	On-Demand	Anodyne	ADRB1	37	46
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)CC(F)(F)F	ZINC000819372217	CH	On-Demand	Anodyne	ADRB3	53	46
C[C@H](CNC[C@@H](O)c1cccnc1)CC(F)(F)F	ZINC000819372241	CE	On-Demand	Anodyne	ADRB2	24	43
C[C@H](CNC[C@@H](O)c1cccnc1)CC(F)(F)F	ZINC000819372241	CE	On-Demand	Anodyne	ADRB1	25	46
C[C@H](CNC[C@@H](O)c1cccnc1)CC(F)(F)F	ZINC000819372241	CE	On-Demand	Anodyne	ADRB3	93	46
C[C@@H](CNC[C@H](O)c1cccnc1)CC(F)(F)F	ZINC000819372242	CE	On-Demand	Anodyne	ADRB2	24	43
C[C@@H](CNC[C@H](O)c1cccnc1)CC(F)(F)F	ZINC000819372242	CE	On-Demand	Anodyne	ADRB1	25	46
C[C@@H](CNC[C@H](O)c1cccnc1)CC(F)(F)F	ZINC000819372242	CE	On-Demand	Anodyne	ADRB3	93	46
C[C@@H](CNC[C@@H](O)c1cccnc1)CC(F)(F)F	ZINC000819372243	CE	On-Demand	Anodyne	ADRB2	24	43
C[C@@H](CNC[C@@H](O)c1cccnc1)CC(F)(F)F	ZINC000819372243	CE	On-Demand	Anodyne	ADRB1	25	46
C[C@@H](CNC[C@@H](O)c1cccnc1)CC(F)(F)F	ZINC000819372243	CE	On-Demand	Anodyne	ADRB3	93	46
C[C@H](CNC[C@H](O)c1cccnc1)CC(F)(F)F	ZINC000819372244	CE	On-Demand	Anodyne	ADRB2	24	43
C[C@H](CNC[C@H](O)c1cccnc1)CC(F)(F)F	ZINC000819372244	CE	On-Demand	Anodyne	ADRB1	25	46
C[C@H](CNC[C@H](O)c1cccnc1)CC(F)(F)F	ZINC000819372244	CE	On-Demand	Anodyne	ADRB3	93	46
Cn1cc([C@@H]2OCC[C@H]2CNC[C@@H](O)c2cccc(Cl)c2)cn1	ZINC000819372262	EE	On-Demand	Anodyne	CYP3A4	46	34
Cn1cc([C@@H]2OCC[C@H]2CNC[C@H](O)c2cccc(Cl)c2)cn1	ZINC000819372263	EE	On-Demand	Anodyne	CYP3A4	46	34
O=C(C[C@@H]1CCCN1C(=O)/C=C\[C@@H]1CCCO1)c1ccccc1	ZINC000819372284	DF	On-Demand	Anodyne	PREP	42	43
O=C(C[C@@H]1CCCN1C(=O)/C=C\[C@H]1CCCO1)c1ccccc1	ZINC000819372285	DF	On-Demand	Anodyne	PREP	42	43
O=C(C[C@@H]1CCCN1C(=O)/C=C/[C@H]1CCCO1)c1ccccc1	ZINC000819372286	DF	On-Demand	Anodyne	PREP	42	43
O=C(C[C@@H]1CCCN1C(=O)/C=C/[C@@H]1CCCO1)c1ccccc1	ZINC000819372287	DF	On-Demand	Anodyne	PREP	42	43
C[C@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CC(F)(F)F	ZINC000819372288	FG	On-Demand	Anodyne	GPR119	31	45
C[C@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CC(F)(F)F	ZINC000819372289	FG	On-Demand	Anodyne	GPR119	31	45
C[C@@H](CNC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CC(F)(F)F	ZINC000819372290	FG	On-Demand	Anodyne	GPR119	31	45
C[C@@H](CNC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)CC(F)(F)F	ZINC000819372291	FG	On-Demand	Anodyne	GPR119	31	45
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819372343	GE	On-Demand	Anodyne	DRD4	47	39
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819372343	GE	On-Demand	Anodyne	MTNR1A	21	43
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819372343	GE	On-Demand	Anodyne	MTNR1B	29	43
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819372343	GE	On-Demand	Anodyne	ACR	27	40
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819372343	GE	On-Demand	Anodyne	MCHR1	15	41
CCOc1ccc(OC[C@H](O)CNCC(=O)N(C)OC)cc1	ZINC000819372396	DC	On-Demand	Anodyne	ADRB2	48	47
CCOc1ccc(OC[C@H](O)CNCC(=O)N(C)OC)cc1	ZINC000819372396	DC	On-Demand	Anodyne	ADRB1	68	45
CCOc1ccc(OC[C@H](O)CNCC(=O)N(C)OC)cc1	ZINC000819372396	DC	On-Demand	Anodyne	ADRB3	40	45
CCOc1ccc(OC[C@@H](O)CNCC(=O)N(C)OC)cc1	ZINC000819372397	DC	On-Demand	Anodyne	ADRB2	48	47
CCOc1ccc(OC[C@@H](O)CNCC(=O)N(C)OC)cc1	ZINC000819372397	DC	On-Demand	Anodyne	ADRB1	68	45
CCOc1ccc(OC[C@@H](O)CNCC(=O)N(C)OC)cc1	ZINC000819372397	DC	On-Demand	Anodyne	ADRB3	40	45
COC1([C@H](C)NC[C@@H](O)c2cccnc2)CCOCC1	ZINC000819372425	CD	On-Demand	Anodyne	ADRB1	16	43
COC1([C@H](C)NC[C@@H](O)c2cccnc2)CCOCC1	ZINC000819372425	CD	On-Demand	Anodyne	ADRB3	46	43
COC1([C@H](C)NC[C@H](O)c2cccnc2)CCOCC1	ZINC000819372426	CD	On-Demand	Anodyne	ADRB1	16	43
COC1([C@H](C)NC[C@H](O)c2cccnc2)CCOCC1	ZINC000819372426	CD	On-Demand	Anodyne	ADRB3	46	43
COC1([C@@H](C)NC[C@H](O)c2cccnc2)CCOCC1	ZINC000819372427	CD	On-Demand	Anodyne	ADRB1	16	43
COC1([C@@H](C)NC[C@H](O)c2cccnc2)CCOCC1	ZINC000819372427	CD	On-Demand	Anodyne	ADRB3	46	43
COC1([C@@H](C)NC[C@@H](O)c2cccnc2)CCOCC1	ZINC000819372428	CD	On-Demand	Anodyne	ADRB1	16	43
COC1([C@@H](C)NC[C@@H](O)c2cccnc2)CCOCC1	ZINC000819372428	CD	On-Demand	Anodyne	ADRB3	46	43
COC(=O)c1ccc(OC[C@H](O)CNCC(=O)N(C)OC)cc1	ZINC000819372449	EB	On-Demand	Anodyne	ADRB2	47	50
COC(=O)c1ccc(OC[C@H](O)CNCC(=O)N(C)OC)cc1	ZINC000819372449	EB	On-Demand	Anodyne	ADRB1	71	48
COC(=O)c1ccc(OC[C@H](O)CNCC(=O)N(C)OC)cc1	ZINC000819372449	EB	On-Demand	Anodyne	ADRB3	43	48
COC(=O)c1ccc(OC[C@@H](O)CNCC(=O)N(C)OC)cc1	ZINC000819372450	EB	On-Demand	Anodyne	ADRB2	47	50
COC(=O)c1ccc(OC[C@@H](O)CNCC(=O)N(C)OC)cc1	ZINC000819372450	EB	On-Demand	Anodyne	ADRB1	71	48
COC(=O)c1ccc(OC[C@@H](O)CNCC(=O)N(C)OC)cc1	ZINC000819372450	EB	On-Demand	Anodyne	ADRB3	43	48
C=C(Cl)CSc1nc(C)c(CC(=O)Nc2cc(OC)ccc2F)s1	ZINC000819372461	GJ	On-Demand	Mild	CSNK1D	20	40
O[C@@H](CNC1CCN(Cc2cccc(Br)c2)CC1)C1CC1	ZINC000819372462	FF	On-Demand	Anodyne	DRD4	23	52
O[C@@H](CNC1CCN(Cc2cccc(Br)c2)CC1)C1CC1	ZINC000819372462	FF	On-Demand	Anodyne	SIGMAR1	27	55
O[C@H](CNC1CCN(Cc2cccc(Br)c2)CC1)C1CC1	ZINC000819372463	FF	On-Demand	Anodyne	DRD4	23	52
O[C@H](CNC1CCN(Cc2cccc(Br)c2)CC1)C1CC1	ZINC000819372463	FF	On-Demand	Anodyne	SIGMAR1	27	55
Cc1sc([C@H](C)NC(=O)/C=C\[C@H]2CCCO2)nc1-c1ccc(Cl)cc1	ZINC000819372496	GJ	On-Demand	Anodyne	UL26	42	33
Cc1sc([C@H](C)NC(=O)/C=C/[C@H]2CCCO2)nc1-c1ccc(Cl)cc1	ZINC000819372497	GJ	On-Demand	Anodyne	UL26	42	33
Cc1sc([C@H](C)NC(=O)/C=C\[C@@H]2CCCO2)nc1-c1ccc(Cl)cc1	ZINC000819372498	GJ	On-Demand	Anodyne	UL26	42	33
Cc1sc([C@H](C)NC(=O)/C=C/[C@@H]2CCCO2)nc1-c1ccc(Cl)cc1	ZINC000819372499	GJ	On-Demand	Anodyne	UL26	42	33
CC[C@H](CCO)CNC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819372542	GD	On-Demand	Anodyne	LGALS3	39	41
CC[C@@H](CCO)CNC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819372543	GD	On-Demand	Anodyne	LGALS3	39	41
CC[C@H](CCO)CNC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819372544	GD	On-Demand	Anodyne	LGALS3	39	41
CC[C@@H](CCO)CNC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819372545	GD	On-Demand	Anodyne	LGALS3	39	41
O=C(NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1)OCc1ccccc1	ZINC000819372556	GF	On-Demand	Anodyne	CTSB	32	42
O=C(NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1)OCc1ccccc1	ZINC000819372556	GF	On-Demand	Anodyne	CYSP_TRYCR	45	32
O=C(NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1)OCc1ccccc1	ZINC000819372556	GF	On-Demand	Anodyne	CTSK	21	42
O=C(NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1)OCc1ccccc1	ZINC000819372556	GF	On-Demand	Anodyne	PREP	15	46
O=C(NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1)OCc1ccccc1	ZINC000819372556	GF	On-Demand	Anodyne	CAPNS1	43	32
O=C(NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1)OCc1ccccc1	ZINC000819372556	GF	On-Demand	Anodyne	CAPN1	44	33
O=C(NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1)OCc1ccccc1	ZINC000819372556	GF	On-Demand	Anodyne	CAPN2	70	34
O=C(NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1)OCc1ccccc1	ZINC000819372556	GF	On-Demand	Anodyne	NPR	64	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372557	IG	On-Demand	Anodyne	P2RY12	160	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372557	IG	On-Demand	Anodyne	KLK3	75	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372557	IG	On-Demand	Anodyne	CTSB	55	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372557	IG	On-Demand	Anodyne	PAPA1_CARPA	68	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372557	IG	On-Demand	Anodyne	CYSP_TRYCR	55	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372557	IG	On-Demand	Anodyne	CTSK	36	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372557	IG	On-Demand	Anodyne	CTSL	44	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372557	IG	On-Demand	Anodyne	CAPNS1	62	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372557	IG	On-Demand	Anodyne	MMP11	46	30
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372557	IG	On-Demand	Anodyne	CTSS	15	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372557	IG	On-Demand	Anodyne	CAPN1	75	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372557	IG	On-Demand	Anodyne	CAPN2	119	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372557	IG	On-Demand	Anodyne	TGM2	26	49
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372557	IG	On-Demand	Anodyne	TPSAB1	40	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372557	IG	On-Demand	Anodyne	NPR	65	33
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372558	IG	On-Demand	Anodyne	P2RY12	160	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372558	IG	On-Demand	Anodyne	KLK3	75	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372558	IG	On-Demand	Anodyne	CTSB	55	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372558	IG	On-Demand	Anodyne	PAPA1_CARPA	68	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372558	IG	On-Demand	Anodyne	CYSP_TRYCR	55	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372558	IG	On-Demand	Anodyne	CTSK	36	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372558	IG	On-Demand	Anodyne	CTSL	44	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372558	IG	On-Demand	Anodyne	CAPNS1	62	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372558	IG	On-Demand	Anodyne	MMP11	46	30
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372558	IG	On-Demand	Anodyne	CTSS	15	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372558	IG	On-Demand	Anodyne	CAPN1	75	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372558	IG	On-Demand	Anodyne	CAPN2	119	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372558	IG	On-Demand	Anodyne	TGM2	26	49
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372558	IG	On-Demand	Anodyne	TPSAB1	40	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372558	IG	On-Demand	Anodyne	NPR	65	33
O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372575	FF	On-Demand	Anodyne	INHA	20	43
O=C([C@@H]1CC(=O)N(C2CCCC2)C1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372576	FF	On-Demand	Anodyne	INHA	20	43
O=C([C@@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372579	IH	On-Demand	Anodyne	CPT2	46	37
O=C([C@@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372579	IH	On-Demand	Anodyne	PREP	75	40
O=C([C@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372580	IH	On-Demand	Anodyne	CPT2	46	37
O=C([C@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372580	IH	On-Demand	Anodyne	PREP	75	40
O=C(NCCCC(=O)N1Cc2cnn(-c3ccccc3)c2C1)OCc1ccccc1	ZINC000819372638	HG	On-Demand	Anodyne	PREP	17	51
O=C(NCCCC(=O)N1Cc2cnn(-c3ccccc3)c2C1)OCc1ccccc1	ZINC000819372638	HG	On-Demand	Anodyne	TGM2	23	41
O=C(NCCCC(=O)N1Cc2cnn(-c3ccccc3)c2C1)OCc1ccccc1	ZINC000819372638	HG	On-Demand	Anodyne	NPR	58	36
COc1ccccc1COC[C@H](O)CNCC(=O)N(C)OC	ZINC000819372670	DC	On-Demand	Anodyne	ADRB2	15	42
COc1ccccc1COC[C@@H](O)CNCC(=O)N(C)OC	ZINC000819372671	DC	On-Demand	Anodyne	ADRB2	15	42
O=C(c1cc(-c2ccc(Br)cc2)nc2ccccc12)N1CC2(CCOC2)C1	ZINC000819372673	HJ	On-Demand	Anodyne	PRS	92	57
O=C(c1cc(-c2ccc(Br)cc2)nc2ccccc12)N1CC2(CCOC2)C1	ZINC000819372673	HJ	On-Demand	Anodyne	MT-CO2	48	40
C[C@@H](C[C@H](O)c1ccccc1)NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819372677	FH	On-Demand	Anodyne	PTGER3	54	37
C[C@@H](C[C@H](O)c1ccccc1)NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819372677	FH	On-Demand	Anodyne	PLA2G4A	27	41
C[C@@H](C[C@H](O)c1ccccc1)NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819372677	FH	On-Demand	Anodyne	CAPN2	42	39
O=C(CN1C(=O)c2ccccc2S1(=O)=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372678	HD	On-Demand	Anodyne	ELANE	15	45
O=C(CN1C(=O)c2ccccc2S1(=O)=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372678	HD	On-Demand	Anodyne	CELA2A	22	45
C[C@H](C[C@@H](O)c1ccccc1)NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819372679	FH	On-Demand	Anodyne	PTGER3	54	37
C[C@H](C[C@@H](O)c1ccccc1)NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819372679	FH	On-Demand	Anodyne	PLA2G4A	27	41
C[C@H](C[C@@H](O)c1ccccc1)NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819372679	FH	On-Demand	Anodyne	CAPN2	42	39
COc1ccc(OC)c([C@H](O)CNC2CCN(OC)CC2)c1	ZINC000819372692	DD	On-Demand	Anodyne	ADRB3	17	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372696	II	On-Demand	Anodyne	BMP1	22	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372696	II	On-Demand	Anodyne	KLK3	55	33
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372696	II	On-Demand	Anodyne	CTSB	58	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372696	II	On-Demand	Anodyne	PAPA1_CARPA	78	38
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372696	II	On-Demand	Anodyne	CYSP_TRYCR	52	38
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372696	II	On-Demand	Anodyne	CTSK	34	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372696	II	On-Demand	Anodyne	CTSL	40	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372696	II	On-Demand	Anodyne	CAPNS1	61	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372696	II	On-Demand	Anodyne	CAPN1	72	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372696	II	On-Demand	Anodyne	CAPN2	115	39
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372696	II	On-Demand	Anodyne	TGM2	20	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372696	II	On-Demand	Anodyne	NPR	65	39
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372696	II	On-Demand	Anodyne	PSMB5	44	40
O[C@H](CN[C@@H]1CCc2nnnn2CC1)c1ccc(F)cc1	ZINC000819372727	CC	On-Demand	Anodyne	ADRB3	19	41
O[C@@H](CN[C@@H]1CCc2nnnn2CC1)c1ccc(F)cc1	ZINC000819372728	CC	On-Demand	Anodyne	ADRB3	19	41
O[C@H](CN[C@H]1CCc2nnnn2CC1)c1ccc(F)cc1	ZINC000819372730	CC	On-Demand	Anodyne	ADRB3	19	41
O[C@@H](CN[C@H]1CCc2nnnn2CC1)c1ccc(F)cc1	ZINC000819372732	CC	On-Demand	Anodyne	ADRB3	19	41
C/C=C\c1ccc(OC[C@H](O)CNCC(=O)N(C)OC)c(OC)c1	ZINC000819372735	ED	On-Demand	Anodyne	ADRB2	15	64
C/C=C\c1ccc(OC[C@H](O)CNCC(=O)N(C)OC)c(OC)c1	ZINC000819372735	ED	On-Demand	Anodyne	TUBB1	40	35
C/C=C/c1ccc(OC[C@@H](O)CNCC(=O)N(C)OC)c(OC)c1	ZINC000819372736	ED	On-Demand	Anodyne	ADRB2	15	64
C/C=C/c1ccc(OC[C@@H](O)CNCC(=O)N(C)OC)c(OC)c1	ZINC000819372736	ED	On-Demand	Anodyne	TUBB1	40	35
C/C=C\c1ccc(OC[C@@H](O)CNCC(=O)N(C)OC)c(OC)c1	ZINC000819372737	ED	On-Demand	Anodyne	ADRB2	15	64
C/C=C\c1ccc(OC[C@@H](O)CNCC(=O)N(C)OC)c(OC)c1	ZINC000819372737	ED	On-Demand	Anodyne	TUBB1	40	35
C/C=C/c1ccc(OC[C@H](O)CNCC(=O)N(C)OC)c(OC)c1	ZINC000819372739	ED	On-Demand	Anodyne	ADRB2	15	64
C/C=C/c1ccc(OC[C@H](O)CNCC(=O)N(C)OC)c(OC)c1	ZINC000819372739	ED	On-Demand	Anodyne	TUBB1	40	35
O=C([C@@H]1CC(c2ccccc2)=NO1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372746	FF	On-Demand	Anodyne	LUCI_PHOPY	44	37
O=C([C@H]1CC(c2ccccc2)=NO1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372747	FF	On-Demand	Anodyne	LUCI_PHOPY	44	37
NC(=O)c1cn(CCCCNC[C@H](O)c2cccc(Cl)c2)nn1	ZINC000819372764	ED	On-Demand	Anodyne	ADRB1	51	46
NC(=O)c1cn(CCCCNC[C@H](O)c2cccc(Cl)c2)nn1	ZINC000819372764	ED	On-Demand	Anodyne	ADRB3	64	46
NC(=O)c1cn(CCCCNC[C@@H](O)c2cccc(Cl)c2)nn1	ZINC000819372765	ED	On-Demand	Anodyne	ADRB1	51	46
NC(=O)c1cn(CCCCNC[C@@H](O)c2cccc(Cl)c2)nn1	ZINC000819372765	ED	On-Demand	Anodyne	ADRB3	64	46
NC(=O)c1cn(CCCCNC[C@@H](O)c2cc3ccccc3o2)nn1	ZINC000819372780	ED	On-Demand	Anodyne	PTPN22	45	32
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819372810	GH	On-Demand	Mild	PAPA1_CARPA	45	45
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819372810	GH	On-Demand	Mild	CTSK	22	43
Cc1ccc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819372810	GH	On-Demand	Mild	FPR1	44	41
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819372811	GH	On-Demand	Mild	PAPA1_CARPA	45	45
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819372811	GH	On-Demand	Mild	CTSK	22	43
Cc1ccc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819372811	GH	On-Demand	Mild	FPR1	44	41
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819372812	GH	On-Demand	Mild	PAPA1_CARPA	45	45
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819372812	GH	On-Demand	Mild	CTSK	22	43
Cc1ccc([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819372812	GH	On-Demand	Mild	FPR1	44	41
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819372813	GH	On-Demand	Mild	PAPA1_CARPA	45	45
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819372813	GH	On-Demand	Mild	CTSK	22	43
Cc1ccc([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819372813	GH	On-Demand	Mild	FPR1	44	41
COC(=O)c1ccc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000819372856	GF	On-Demand	Anodyne	GPR119	38	45
COC(=O)c1ccc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)s1	ZINC000819372857	GF	On-Demand	Anodyne	GPR119	38	45
COC(=O)c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)s1	ZINC000819372872	EG	On-Demand	Anodyne	ADRB2	37	42
COC(=O)c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)s1	ZINC000819372872	EG	On-Demand	Anodyne	ADRB1	51	55
COC(=O)c1ccc(CNC[C@@H](O)c2cccc(Cl)c2)s1	ZINC000819372872	EG	On-Demand	Anodyne	ADRB3	69	55
COC(=O)c1ccc(CNC[C@H](O)c2cccc(Cl)c2)s1	ZINC000819372873	EG	On-Demand	Anodyne	ADRB2	37	42
COC(=O)c1ccc(CNC[C@H](O)c2cccc(Cl)c2)s1	ZINC000819372873	EG	On-Demand	Anodyne	ADRB1	51	55
COC(=O)c1ccc(CNC[C@H](O)c2cccc(Cl)c2)s1	ZINC000819372873	EG	On-Demand	Anodyne	ADRB3	69	55
O=C(c1cc([N+](=O)[O-])ccc1N1CCCC1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819372891	HH	On-Demand	Bother	SLC6A9	16	49
O[C@@H](CN[C@H]1CCc2nnnn2CC1)c1ccc(F)c(Br)c1	ZINC000819372902	FD	On-Demand	Anodyne	ADRB3	21	41
O[C@H](CN[C@H]1CCc2nnnn2CC1)c1ccc(F)c(Br)c1	ZINC000819372904	FD	On-Demand	Anodyne	ADRB3	21	41
O[C@@H](CN[C@@H]1CCc2nnnn2CC1)c1ccc(F)c(Br)c1	ZINC000819372905	FD	On-Demand	Anodyne	ADRB3	21	41
O[C@H](CN[C@@H]1CCc2nnnn2CC1)c1ccc(F)c(Br)c1	ZINC000819372907	FD	On-Demand	Anodyne	ADRB3	21	41
COC(=O)c1ccc(CNC[C@@H](O)c2ccc([N+](=O)[O-])cc2)s1	ZINC000819372908	EE	On-Demand	Bother	CACNA1D	55	32
COC(=O)c1ccc(CNC[C@H](O)c2ccc([N+](=O)[O-])cc2)s1	ZINC000819372910	EE	On-Demand	Bother	CACNA1D	55	32
COc1cccc(OC)c1OC[C@H](O)CNCC(=O)N(C)OC	ZINC000819372929	EC	On-Demand	Anodyne	ADRB2	29	50
COc1cccc(OC)c1OC[C@H](O)CNCC(=O)N(C)OC	ZINC000819372929	EC	On-Demand	Anodyne	ADRB1	56	37
COc1cccc(OC)c1OC[C@@H](O)CNCC(=O)N(C)OC	ZINC000819372931	EC	On-Demand	Anodyne	ADRB2	29	50
COc1cccc(OC)c1OC[C@@H](O)CNCC(=O)N(C)OC	ZINC000819372931	EC	On-Demand	Anodyne	ADRB1	56	37
CC(C)(C(=O)N1Cc2cnn(-c3ccccc3)c2C1)C1CCCCC1	ZINC000819372946	EI	On-Demand	Anodyne	AMY2	44	30
N#Cc1ccc([C@@H](O)CN[C@H]2CCc3nnnn3CC2)cc1	ZINC000819372968	CC	On-Demand	Mild	ADRB3	15	49
O=C1CCCCN1Cc1ccc(C(=O)N2Cc3cnn(-c4ccccc4)c3C2)cc1	ZINC000819372973	HH	On-Demand	Anodyne	FABI	48	37
N#Cc1ccc([C@@H](O)CN[C@@H]2CCc3nnnn3CC2)cc1	ZINC000819372975	CC	On-Demand	Mild	ADRB3	15	49
N#Cc1ccc([C@H](O)CN[C@H]2CCc3nnnn3CC2)cc1	ZINC000819372976	CC	On-Demand	Mild	ADRB3	15	49
N#Cc1ccc([C@H](O)CN[C@@H]2CCc3nnnn3CC2)cc1	ZINC000819372977	CC	On-Demand	Mild	ADRB3	15	49
O=C([C@@H]1CC(c2cccc(F)c2)=NO1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373015	GG	On-Demand	Anodyne	LUCI_PHOPY	27	45
O=C([C@H]1CC(c2cccc(F)c2)=NO1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373016	GG	On-Demand	Anodyne	LUCI_PHOPY	27	45
O=C(c1cc(-c2ccccn2)nc2ccccc12)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373022	HJ	On-Demand	Anodyne	METAP1	48	41
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373025	GH	On-Demand	Anodyne	CPT1A	52	43
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373025	GH	On-Demand	Anodyne	CPT2	52	43
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373025	GH	On-Demand	Anodyne	PREP	91	52
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373025	GH	On-Demand	Anodyne	SFRP1	52	44
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373025	GH	On-Demand	Anodyne	WNT3	58	44
O=C(c1cc(=O)c2ccccc2o1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373030	FG	On-Demand	Anodyne	TNKS	23	41
CC(C)(C)OC(=O)N1CCC(SCC(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819373031	IH	On-Demand	Anodyne	GPR119	47	45
CC(C)(C)OC(=O)N1CCC(C(F)(F)C(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819373047	IH	On-Demand	Anodyne	GPR119	45	41
O[C@H](CNCc1nnc(C2CC2)s1)c1cccnc1	ZINC000819373050	CD	On-Demand	Anodyne	ADRB2	20	42
O[C@H](CNCc1nnc(C2CC2)s1)c1cccnc1	ZINC000819373050	CD	On-Demand	Anodyne	ADRB1	22	49
O[C@H](CNCc1nnc(C2CC2)s1)c1cccnc1	ZINC000819373050	CD	On-Demand	Anodyne	ADRB3	87	49
O[C@@H](CNCc1nnc(C2CC2)s1)c1cccnc1	ZINC000819373052	CD	On-Demand	Anodyne	ADRB2	20	42
O[C@@H](CNCc1nnc(C2CC2)s1)c1cccnc1	ZINC000819373052	CD	On-Demand	Anodyne	ADRB1	22	49
O[C@@H](CNCc1nnc(C2CC2)s1)c1cccnc1	ZINC000819373052	CD	On-Demand	Anodyne	ADRB3	87	49
C[C@@H](CC(=O)NCCc1ccc(NC(=O)OC(C)(C)C)cc1)n1cccn1	ZINC000819373080	FH	On-Demand	Anodyne	ADRB3	18	44
C[C@H](CC(=O)NCCc1ccc(NC(=O)OC(C)(C)C)cc1)n1cccn1	ZINC000819373081	FH	On-Demand	Anodyne	ADRB3	18	44
CC(=O)Nc1cccc(CC(=O)NCCC2CCC2)c1	ZINC000819373086	CE	On-Demand	Anodyne	CCR3	45	38
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCC(C)(C)CC1	ZINC000819373105	FI	On-Demand	Mild	PAPA1_CARPA	36	45
O=C(/C=C\c1ccsc1)Nc1cnc2ccccc2c1	ZINC000819373108	CH	On-Demand	Anodyne	MMP2	15	44
O=C(/C=C\c1ccsc1)Nc1cnc2ccccc2c1	ZINC000819373108	CH	On-Demand	Anodyne	UL26	18	40
C#CCN(C(=O)c1coc2c(C)cccc12)C1CCCC1	ZINC000819373110	CH	On-Demand	Mild	ACE	52	35
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819373124	EF	On-Demand	Anodyne	VCP	29	45
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819373126	EF	On-Demand	Anodyne	VCP	29	45
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cc3ccccc3o2)CC1	ZINC000819373173	DE	On-Demand	Anodyne	VCP	65	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCN(CC(C)C)C1)C2	ZINC000819373196	FD	On-Demand	Anodyne	CACNA1I	40	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCN(CC(C)C)C1)C2	ZINC000819373198	FD	On-Demand	Anodyne	CACNA1I	40	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCN(CC(C)C)C1)C2	ZINC000819373200	FD	On-Demand	Anodyne	CACNA1I	40	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCN(CC(C)C)C1)C2	ZINC000819373202	FD	On-Demand	Anodyne	CACNA1I	40	32
O[C@@H]1CC[C@@H](NC[C@@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819373208	CD	On-Demand	Anodyne	ADRB3	20	40
O[C@@H]1CC[C@@H](NC[C@H](O)c2ccc(F)c(F)c2)CC1	ZINC000819373210	CD	On-Demand	Anodyne	ADRB3	20	40
CN(C)C1CCC(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819373211	FE	On-Demand	Anodyne	GPR119	29	42
CN(C)C1CCC(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000819373213	FE	On-Demand	Anodyne	GPR119	29	42
O=C(Nc1ccccc1C(=O)Nc1cnc2ccccc2c1)c1ccsc1	ZINC000819373224	FJ	On-Demand	Anodyne	ABCB1B	32	49
O=C(Nc1ccccc1C(=O)Nc1cnc2ccccc2c1)c1ccsc1	ZINC000819373224	FJ	On-Demand	Anodyne	GRM4	19	42
O=C(Nc1ccccc1C(=O)Nc1cnc2ccccc2c1)c1ccsc1	ZINC000819373224	FJ	On-Demand	Anodyne	NR1H4	15	46
O=C(Nc1ccccc1C(=O)Nc1cnc2ccccc2c1)c1ccsc1	ZINC000819373224	FJ	On-Demand	Anodyne	KCNK3	51	48
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819373227	EF	On-Demand	Anodyne	CCR2	55	37
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819373227	EF	On-Demand	Anodyne	VCP	38	47
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819373228	EF	On-Demand	Anodyne	CCR2	55	37
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819373228	EF	On-Demand	Anodyne	VCP	38	47
NC(=O)CC1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819373233	CC	On-Demand	Bother	CACNA1C	43	34
NC(=O)CC1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819373233	CC	On-Demand	Bother	CACNA1D	67	34
NC(=O)CC1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819373234	CC	On-Demand	Bother	CACNA1C	43	34
NC(=O)CC1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819373234	CC	On-Demand	Bother	CACNA1D	67	34
C#CCNC(=O)CCNC1CCN(Cc2cccc(Br)c2)CC1	ZINC000819373272	GE	On-Demand	Mild	DRD4	31	52
C#CCNC(=O)CCNC1CCN(Cc2cccc(Br)c2)CC1	ZINC000819373272	GE	On-Demand	Mild	ACHE	24	40
C#CCNC(=O)CCNC1CCN(Cc2cccc(Br)c2)CC1	ZINC000819373272	GE	On-Demand	Mild	HRH2	32	40
C#CCNC(=O)CCNC1CCN(Cc2cccc(Br)c2)CC1	ZINC000819373272	GE	On-Demand	Mild	SIGMAR1	25	55
C#CCNC(=O)CCNC1CCN(Cc2cccc(Br)c2)CC1	ZINC000819373272	GE	On-Demand	Mild	SSTR5	68	35
COC(=O)[C@@]1(NC(=O)C[C@@H](C)n2cccn2)CCCN(Cc2ccccc2)C1	ZINC000819373284	GE	On-Demand	Anodyne	SLC12A5	52	37
COC(=O)[C@@]1(NC(=O)C[C@H](C)n2cccn2)CCCN(Cc2ccccc2)C1	ZINC000819373286	GE	On-Demand	Anodyne	SLC12A5	52	37
COC1([C@H](C)NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCOCC1	ZINC000819373325	GE	On-Demand	Anodyne	GPR119	24	40
COC1([C@@H](C)NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCOCC1	ZINC000819373327	GE	On-Demand	Anodyne	GPR119	24	40
COC1([C@H](C)NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCOCC1	ZINC000819373329	GE	On-Demand	Anodyne	GPR119	24	40
COC1([C@@H](C)NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCOCC1	ZINC000819373331	GE	On-Demand	Anodyne	GPR119	24	40
COC(=O)c1ccc(CNC[C@@H](O)c2cccc(Br)c2)s1	ZINC000819373376	FG	On-Demand	Anodyne	ADRB1	24	41
COC(=O)c1ccc(CNC[C@@H](O)c2cccc(Br)c2)s1	ZINC000819373376	FG	On-Demand	Anodyne	ADRB3	37	41
COC(=O)c1ccc(CNC[C@H](O)c2cccc(Br)c2)s1	ZINC000819373378	FG	On-Demand	Anodyne	ADRB1	24	41
COC(=O)c1ccc(CNC[C@H](O)c2cccc(Br)c2)s1	ZINC000819373378	FG	On-Demand	Anodyne	ADRB3	37	41
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(N2CCCC2)c1	ZINC000819373379	DG	On-Demand	Anodyne	KCNQ2	49	36
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(N2CCCC2)c1	ZINC000819373380	DG	On-Demand	Anodyne	KCNQ2	49	36
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(N2CCCC2)c1	ZINC000819373381	DG	On-Demand	Anodyne	KCNQ2	49	36
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(N2CCCC2)c1	ZINC000819373382	DG	On-Demand	Anodyne	KCNQ2	49	36
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2cnc3ccccc3c2)cc1OC	ZINC000819373410	IJ	On-Demand	Anodyne	CPT1A	44	30
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2cnc3ccccc3c2)cc1OC	ZINC000819373410	IJ	On-Demand	Anodyne	AURKB	15	43
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2cnc3ccccc3c2)cc1OC	ZINC000819373410	IJ	On-Demand	Anodyne	PRNP	42	42
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2cnc3ccccc3c2)cc1OC	ZINC000819373410	IJ	On-Demand	Anodyne	KDR	57	41
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2cnc3ccccc3c2)cc1OC	ZINC000819373410	IJ	On-Demand	Anodyne	ABCB1B	38	56
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2cnc3ccccc3c2)cc1OC	ZINC000819373410	IJ	On-Demand	Anodyne	GRM4	25	41
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2cnc3ccccc3c2)cc1OC	ZINC000819373410	IJ	On-Demand	Anodyne	NR1H4	17	46
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2cnc3ccccc3c2)cc1OC	ZINC000819373410	IJ	On-Demand	Anodyne	HDAC1	25	42
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2cnc3ccccc3c2)cc1OC	ZINC000819373410	IJ	On-Demand	Anodyne	HDAC2	19	42
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2cnc3ccccc3c2)cc1OC	ZINC000819373410	IJ	On-Demand	Anodyne	ABCB1	26	57
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2cnc3ccccc3c2)cc1OC	ZINC000819373410	IJ	On-Demand	Anodyne	AURKA	19	47
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2cnc3ccccc3c2)cc1OC	ZINC000819373410	IJ	On-Demand	Anodyne	LUCI_LUCLA	40	43
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2cnc3ccccc3c2)cc1OC	ZINC000819373410	IJ	On-Demand	Anodyne	SHH	33	41
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2cnc3ccccc3c2)cc1OC	ZINC000819373410	IJ	On-Demand	Anodyne	ABCG2	61	56
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2cnc3ccccc3c2)cc1OC	ZINC000819373410	IJ	On-Demand	Anodyne	SMO	37	43
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2cnc3ccccc3c2)cc1OC	ZINC000819373410	IJ	On-Demand	Anodyne	KCNK3	109	53
COc1cc(NC(=O)c2ccccc2)c(C(=O)Nc2cnc3ccccc3c2)cc1OC	ZINC000819373410	IJ	On-Demand	Anodyne	KCNK9	72	44
O[C@H](CN[C@@H]1CCc2nnnn2CC1)c1cccc(Cl)c1	ZINC000819373422	DD	On-Demand	Anodyne	ADRB1	36	49
O[C@H](CN[C@@H]1CCc2nnnn2CC1)c1cccc(Cl)c1	ZINC000819373422	DD	On-Demand	Anodyne	ADRB3	57	52
O[C@H](CN[C@@H]1CCc2nnnn2CC1)c1cccc(Cl)c1	ZINC000819373422	DD	On-Demand	Anodyne	CYP3A4	49	39
O[C@@H](CN[C@@H]1CCc2nnnn2CC1)c1cccc(Cl)c1	ZINC000819373424	DD	On-Demand	Anodyne	ADRB1	36	49
O[C@@H](CN[C@@H]1CCc2nnnn2CC1)c1cccc(Cl)c1	ZINC000819373424	DD	On-Demand	Anodyne	ADRB3	57	52
O[C@@H](CN[C@@H]1CCc2nnnn2CC1)c1cccc(Cl)c1	ZINC000819373424	DD	On-Demand	Anodyne	CYP3A4	49	39
O[C@H](CN[C@H]1CCc2nnnn2CC1)c1cccc(Cl)c1	ZINC000819373427	DD	On-Demand	Anodyne	ADRB1	36	49
O[C@H](CN[C@H]1CCc2nnnn2CC1)c1cccc(Cl)c1	ZINC000819373427	DD	On-Demand	Anodyne	ADRB3	57	52
O[C@H](CN[C@H]1CCc2nnnn2CC1)c1cccc(Cl)c1	ZINC000819373427	DD	On-Demand	Anodyne	CYP3A4	49	39
O[C@@H](CN[C@H]1CCc2nnnn2CC1)c1cccc(Cl)c1	ZINC000819373429	DD	On-Demand	Anodyne	ADRB1	36	49
O[C@@H](CN[C@H]1CCc2nnnn2CC1)c1cccc(Cl)c1	ZINC000819373429	DD	On-Demand	Anodyne	ADRB3	57	52
O[C@@H](CN[C@H]1CCc2nnnn2CC1)c1cccc(Cl)c1	ZINC000819373429	DD	On-Demand	Anodyne	CYP3A4	49	39
O[C@H](CN[C@@H]1CCc2nnnn2CC1)c1ccccc1	ZINC000819373448	CC	On-Demand	Anodyne	ADRB3	33	40
O[C@@H](CN[C@@H]1CCc2nnnn2CC1)c1ccccc1	ZINC000819373449	CC	On-Demand	Anodyne	ADRB3	33	40
O[C@H](CN[C@H]1CCc2nnnn2CC1)c1ccccc1	ZINC000819373450	CC	On-Demand	Anodyne	ADRB3	33	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373497	IE	On-Demand	Anodyne	F2	44	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373497	IE	On-Demand	Anodyne	P2RY12	19	42
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373497	IE	On-Demand	Anodyne	TRY1_BOVIN	40	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373497	IE	On-Demand	Anodyne	CPT2	42	35
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373497	IE	On-Demand	Anodyne	PREP	84	42
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373497	IE	On-Demand	Anodyne	LGMN	43	34
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373497	IE	On-Demand	Anodyne	WNT3	53	39
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373497	IE	On-Demand	Anodyne	BRCA1	43	30
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373497	IE	On-Demand	Anodyne	TMPRSS11D	49	36
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373500	IE	On-Demand	Anodyne	F2	44	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373500	IE	On-Demand	Anodyne	P2RY12	19	42
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373500	IE	On-Demand	Anodyne	TRY1_BOVIN	40	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373500	IE	On-Demand	Anodyne	CPT2	42	35
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373500	IE	On-Demand	Anodyne	PREP	84	42
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373500	IE	On-Demand	Anodyne	LGMN	43	34
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373500	IE	On-Demand	Anodyne	WNT3	53	39
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373500	IE	On-Demand	Anodyne	BRCA1	43	30
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373500	IE	On-Demand	Anodyne	TMPRSS11D	49	36
CC(C)(C)OC(=O)N1CCC(CC(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819373516	HH	On-Demand	Anodyne	GPR119	48	46
CC(C)(C)OC(=O)N1CCC(CC(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819373516	HH	On-Demand	Anodyne	SFRP1	15	44
O=C(c1cc2ccsc2[nH]1)N1CC2(CCOC2)C1	ZINC000819373535	CE	On-Demand	Anodyne	HRH4	19	58
CC(C)(C)OC(=O)N1CCC(OCC(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819373553	IG	On-Demand	Anodyne	GPR119	48	42
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2ccccc2Cl)CC1	ZINC000819373571	DE	On-Demand	Anodyne	VCP	52	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1nnc(-c3ccccc3)o1)C2	ZINC000819373581	GE	On-Demand	Anodyne	PDE8B	40	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1nnc(-c3ccccc3)o1)C2	ZINC000819373583	GE	On-Demand	Anodyne	PDE8B	40	34
NC(=O)CC1(CNC[C@H](O)c2ccccc2Cl)CC1	ZINC000819373585	CD	On-Demand	Anodyne	OPRL1	28	46
O=Cc1ccc(OCC(=O)N2Cc3cnn(-c4ccccc4)c3C2)cc1	ZINC000819373591	EF	On-Demand	Anodyne	CPT2	44	36
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2ccccc2Br)CC1	ZINC000819373602	FE	On-Demand	Anodyne	VCP	49	38
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccccc2Br)CC1	ZINC000819373603	FE	On-Demand	Anodyne	VCP	49	38
CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373618	HG	On-Demand	Anodyne	PREP	27	41
CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373620	HG	On-Demand	Anodyne	PREP	27	41
O[C@@H]1CC[C@@H](NC[C@H](O)c2ccccc2)CC1	ZINC000819373634	BD	On-Demand	Anodyne	SLC6A3	15	63
O[C@@H]1CC[C@@H](NC[C@H](O)c2ccccc2)CC1	ZINC000819373634	BD	On-Demand	Anodyne	AOC3	15	49
O[C@@H]1CC[C@@H](NC[C@@H](O)c2ccccc2)CC1	ZINC000819373636	BD	On-Demand	Anodyne	SLC6A3	15	63
O[C@@H]1CC[C@@H](NC[C@@H](O)c2ccccc2)CC1	ZINC000819373636	BD	On-Demand	Anodyne	AOC3	15	49
O=C(c1cccnc1Cl)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373652	DG	On-Demand	Anodyne	G2YM83_BOTF4	46	33
O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373654	HH	On-Demand	Bother	SLC6A9	16	50
Cc1ccccc1[C@@H](O)CNC[C@@H]1CC[C@@H](C(N)=O)CC1	ZINC000819373658	CD	On-Demand	Anodyne	VCP	53	38
O[C@@H]1CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819373669	CE	On-Demand	Anodyne	ADRB3	23	47
O[C@@H]1CC[C@@H](NC[C@H](O)c2ccccc2Cl)CC1	ZINC000819373670	CE	On-Demand	Anodyne	OPRL1	39	40
CN(CCC1CCOCC1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819373675	FF	On-Demand	Mild	PAPA1_CARPA	31	40
CN(CCC1CCOCC1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819373676	FF	On-Demand	Mild	PAPA1_CARPA	31	40
O=C(COc1ccc(C2SCCCS2)cc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373687	IJ	On-Demand	Anodyne	CPT1A	58	38
O=C(COc1ccc(C2SCCCS2)cc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819373687	IJ	On-Demand	Anodyne	CPT2	45	36
O[C@@H]1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819373690	CE	On-Demand	Anodyne	ADRB1	39	49
O[C@@H]1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819373690	CE	On-Demand	Anodyne	ADRB3	60	53
O[C@@H]1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819373690	CE	On-Demand	Anodyne	IGF1R	28	40
O[C@@H]1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819373690	CE	On-Demand	Anodyne	CYP3A4	48	40
O[C@@H]1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819373691	CE	On-Demand	Anodyne	ADRB1	39	49
O[C@@H]1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819373691	CE	On-Demand	Anodyne	ADRB3	60	53
O[C@@H]1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819373691	CE	On-Demand	Anodyne	IGF1R	28	40
O[C@@H]1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819373691	CE	On-Demand	Anodyne	CYP3A4	48	40
CC[C@H]1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819373705	GG	On-Demand	Anodyne	CTSD	102	44
CC[C@H]1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819373705	GG	On-Demand	Anodyne	PGC	65	36
CC[C@H]1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819373705	GG	On-Demand	Anodyne	BACE2	53	44
CC[C@H]1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819373705	GG	On-Demand	Anodyne	TACR3	15	41
CC[C@H]1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819373705	GG	On-Demand	Anodyne	REN	83	45
CC[C@H]1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819373705	GG	On-Demand	Anodyne	REN1	19	42
CC[C@H]1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819373705	GG	On-Demand	Anodyne	BACE1	83	44
CC[C@H]1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819373705	GG	On-Demand	Anodyne	FPR1	47	38
CC[C@H]1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819373705	GG	On-Demand	Anodyne	PLM1_PLAFA	26	40
CC[C@@H]1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819373707	GG	On-Demand	Anodyne	CTSD	102	44
CC[C@@H]1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819373707	GG	On-Demand	Anodyne	PGC	65	36
CC[C@@H]1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819373707	GG	On-Demand	Anodyne	BACE2	53	44
CC[C@@H]1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819373707	GG	On-Demand	Anodyne	TACR3	15	41
CC[C@@H]1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819373707	GG	On-Demand	Anodyne	REN	83	45
CC[C@@H]1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819373707	GG	On-Demand	Anodyne	REN1	19	42
CC[C@@H]1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819373707	GG	On-Demand	Anodyne	BACE1	83	44
CC[C@@H]1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819373707	GG	On-Demand	Anodyne	FPR1	47	38
CC[C@@H]1C[C@@H](NC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819373707	GG	On-Demand	Anodyne	PLM1_PLAFA	26	40
COC(=O)[C@H]1CN(C(=O)Cc2cccc(NC(C)=O)c2)C[C@H]1C	ZINC000819373734	DD	On-Demand	Anodyne	TSHR	40	29
COC(=O)[C@H]1CN(C(=O)Cc2cccc(NC(C)=O)c2)C[C@@H]1C	ZINC000819373735	DD	On-Demand	Anodyne	TSHR	40	29
O[C@H](CNCc1nnc(C2CC2)s1)c1cccc(Cl)c1	ZINC000819373741	DF	On-Demand	Anodyne	ADRB1	32	41
O[C@H](CNCc1nnc(C2CC2)s1)c1cccc(Cl)c1	ZINC000819373741	DF	On-Demand	Anodyne	ADRB3	44	41
O[C@@H](CNCc1nnc(C2CC2)s1)c1cccc(Cl)c1	ZINC000819373742	DF	On-Demand	Anodyne	ADRB1	32	41
O[C@@H](CNCc1nnc(C2CC2)s1)c1cccc(Cl)c1	ZINC000819373742	DF	On-Demand	Anodyne	ADRB3	44	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2C[C@H]2c2ccco2)CC1	ZINC000819373753	FF	On-Demand	Anodyne	GPR119	38	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2C[C@H]2c2ccco2)CC1	ZINC000819373754	FF	On-Demand	Anodyne	GPR119	38	44
O[C@@H](CN[C@H]1CCc2nnnn2CC1)c1ccccc1	ZINC000819373756	CC	On-Demand	Anodyne	ADRB3	33	40
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819373787	FE	On-Demand	Mild	PAPA1_CARPA	38	45
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819373789	FE	On-Demand	Mild	PAPA1_CARPA	38	45
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819373791	FE	On-Demand	Mild	PAPA1_CARPA	38	45
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819373793	FE	On-Demand	Mild	PAPA1_CARPA	38	45
COC(=O)[C@@]1(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCOC1	ZINC000819373837	FD	On-Demand	Mild	PAPA1_CARPA	34	48
COC(=O)[C@@]1(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCOC1	ZINC000819373840	FD	On-Demand	Mild	PAPA1_CARPA	34	48
COC(=O)[C@@H]1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@@H]1C	ZINC000819373846	FD	On-Demand	Mild	PAPA1_CARPA	36	47
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819373850	FH	On-Demand	Anodyne	LIPG	41	37
COC(=O)[C@@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@H]1C	ZINC000819373851	FD	On-Demand	Mild	PAPA1_CARPA	36	47
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819373853	FH	On-Demand	Anodyne	LIPG	41	37
COC(=O)[C@@H]1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@H]1C	ZINC000819373855	FD	On-Demand	Mild	PAPA1_CARPA	36	47
COC(=O)[C@@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@@H]1C	ZINC000819373857	FD	On-Demand	Mild	PAPA1_CARPA	36	47
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819373858	FH	On-Demand	Anodyne	LIPG	41	37
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819373861	FH	On-Demand	Anodyne	LIPG	41	37
CC(=O)Nc1cccc(CC(=O)N[C@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819373891	FH	On-Demand	Anodyne	BACE1	24	44
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CC3(CCC3)Oc3ccccc32)c1	ZINC000819373896	FH	On-Demand	Anodyne	BACE1	24	44
O=C(/C=C/[C@@H]1CCCO1)N1CC(c2nc3ccccc3[nH]2)C1	ZINC000819373954	CE	On-Demand	Anodyne	SMO	18	43
O=C(/C=C\[C@H]1CCCO1)N1CC(c2nc3ccccc3[nH]2)C1	ZINC000819373957	CE	On-Demand	Anodyne	SMO	18	43
O=C(/C=C/[C@H]1CCCO1)N1CC(c2nc3ccccc3[nH]2)C1	ZINC000819373960	CE	On-Demand	Anodyne	SMO	18	43
O=C(/C=C\[C@@H]1CCCO1)N1CC(c2nc3ccccc3[nH]2)C1	ZINC000819373962	CE	On-Demand	Anodyne	SMO	18	43
O=C(/C=C\[C@H]1CCCO1)Nc1cccc2ccncc12	ZINC000819373969	CF	On-Demand	Anodyne	TRPV1	19	46
O=C(/C=C\[C@H]1CCCO1)Nc1cccc2ccncc12	ZINC000819373969	CF	On-Demand	Anodyne	CDK5	29	47
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc2ccncc12	ZINC000819373970	CF	On-Demand	Anodyne	TRPV1	19	46
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc2ccncc12	ZINC000819373970	CF	On-Demand	Anodyne	CDK5	29	47
O=C(/C=C/[C@H]1CCCO1)Nc1cccc2ccncc12	ZINC000819373971	CF	On-Demand	Anodyne	TRPV1	19	46
O=C(/C=C/[C@H]1CCCO1)Nc1cccc2ccncc12	ZINC000819373971	CF	On-Demand	Anodyne	CDK5	29	47
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc2ccncc12	ZINC000819373972	CF	On-Demand	Anodyne	TRPV1	19	46
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc2ccncc12	ZINC000819373972	CF	On-Demand	Anodyne	CDK5	29	47
O[C@@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1ccccc1	ZINC000819373973	GH	On-Demand	Anodyne	DRD2	15	42
O[C@@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1ccccc1	ZINC000819373973	GH	On-Demand	Anodyne	DRD4	37	53
O[C@@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1ccccc1	ZINC000819373973	GH	On-Demand	Anodyne	ACHE	31	42
O[C@@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1ccccc1	ZINC000819373973	GH	On-Demand	Anodyne	SLC6A3	20	48
O[C@@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1ccccc1	ZINC000819373973	GH	On-Demand	Anodyne	SIGMAR1	44	58
O[C@@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1ccccc1	ZINC000819373973	GH	On-Demand	Anodyne	CCR3	16	45
O[C@@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1ccccc1	ZINC000819373973	GH	On-Demand	Anodyne	SLC18A3	17	46
O[C@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1ccccc1	ZINC000819373974	GH	On-Demand	Anodyne	DRD2	15	42
O[C@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1ccccc1	ZINC000819373974	GH	On-Demand	Anodyne	DRD4	37	53
O[C@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1ccccc1	ZINC000819373974	GH	On-Demand	Anodyne	ACHE	31	42
O[C@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1ccccc1	ZINC000819373974	GH	On-Demand	Anodyne	SLC6A3	20	48
O[C@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1ccccc1	ZINC000819373974	GH	On-Demand	Anodyne	SIGMAR1	44	58
O[C@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1ccccc1	ZINC000819373974	GH	On-Demand	Anodyne	CCR3	16	45
O[C@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1ccccc1	ZINC000819373974	GH	On-Demand	Anodyne	SLC18A3	17	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819373979	GG	On-Demand	Anodyne	GRM5	19	41
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819373984	GH	On-Demand	Anodyne	ADRB3	19	40
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819373985	GH	On-Demand	Anodyne	ADRB3	19	40
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819373986	GH	On-Demand	Anodyne	ADRB3	19	40
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819373987	GH	On-Demand	Anodyne	ADRB3	19	40
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2C(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819373997	IH	On-Demand	Anodyne	GPR119	42	44
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)N1CC2(CCOC2)C1	ZINC000819374011	FF	On-Demand	Anodyne	PREP	26	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNC[C@@H]2CC[C@@H](C(N)=O)CC2)CC1	ZINC000819374021	GD	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNC[C@@H]2CC[C@@H](C(N)=O)CC2)CC1	ZINC000819374024	GD	On-Demand	Anodyne	GPR119	29	41
O[C@@H]1CC[C@@H](NC[C@H](O)c2cccc(Br)c2)CC1	ZINC000819374038	DE	On-Demand	Anodyne	ADRB3	25	41
O[C@@H]1CC[C@@H](NC[C@@H](O)c2cccc(Br)c2)CC1	ZINC000819374041	DE	On-Demand	Anodyne	ADRB3	25	41
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2ccccc2F)CC1	ZINC000819374047	CD	On-Demand	Anodyne	VCP	51	43
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccccc2F)CC1	ZINC000819374049	CD	On-Demand	Anodyne	VCP	51	43
CC(C)(C)OC(=O)N1CC[C@H](CCC(=O)N2Cc3cnn(-c4ccccc4)c3C2)C1	ZINC000819374053	HH	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CC[C@@H](CCC(=O)N2Cc3cnn(-c4ccccc4)c3C2)C1	ZINC000819374055	HH	On-Demand	Anodyne	GPR119	40	42
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819374067	DE	On-Demand	Anodyne	ADRB1	17	40
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819374067	DE	On-Demand	Anodyne	ADRB3	28	40
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000819374067	DE	On-Demand	Anodyne	VCP	35	42
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccnc2)CC1	ZINC000819374071	CC	On-Demand	Anodyne	ADRB2	21	42
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccnc2)CC1	ZINC000819374071	CC	On-Demand	Anodyne	ADRB1	28	45
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccnc2)CC1	ZINC000819374071	CC	On-Demand	Anodyne	ADRB3	101	45
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccnc2)CC1	ZINC000819374071	CC	On-Demand	Anodyne	VCP	38	45
O=C(c1cc(S(=O)(=O)N2CCC2)ccc1Cl)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819374072	IG	On-Demand	Anodyne	AKR1C3	43	35
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccnc2)CC1	ZINC000819374073	CC	On-Demand	Anodyne	ADRB2	21	42
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccnc2)CC1	ZINC000819374073	CC	On-Demand	Anodyne	ADRB1	28	45
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccnc2)CC1	ZINC000819374073	CC	On-Demand	Anodyne	ADRB3	101	45
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccnc2)CC1	ZINC000819374073	CC	On-Demand	Anodyne	VCP	38	45
CCCCCCCCOCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819374080	FI	On-Demand	Mild	P2RY12	76	33
CCCCCCCCOCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819374080	FI	On-Demand	Mild	PLA2G4B	79	37
CC[C@@H]1C[C@@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCO1	ZINC000819374081	FF	On-Demand	Anodyne	GPR119	21	40
CC[C@@H]1C[C@@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)CCO1	ZINC000819374085	FF	On-Demand	Anodyne	GPR119	21	40
Cc1c(NC(=O)CC[C@@H](CC2CCCCC2)NC(=O)OC(C)(C)C)cnn1C	ZINC000819374119	GI	On-Demand	Anodyne	REN	58	39
Cc1c(NC(=O)CC[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)cnn1C	ZINC000819374120	GI	On-Demand	Anodyne	REN	58	39
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2ccc(Cl)cc2Cl)CC1	ZINC000819374138	EF	On-Demand	Anodyne	VCP	36	40
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccc(Cl)cc2Cl)CC1	ZINC000819374139	EF	On-Demand	Anodyne	VCP	36	40
O[C@H](CNCCCC1(O)CCC1)c1cccnc1	ZINC000819374144	CD	On-Demand	Anodyne	ADRB2	26	46
O[C@H](CNCCCC1(O)CCC1)c1cccnc1	ZINC000819374144	CD	On-Demand	Anodyne	ADRB1	27	44
O[C@H](CNCCCC1(O)CCC1)c1cccnc1	ZINC000819374144	CD	On-Demand	Anodyne	ADRB3	102	47
O[C@@H](CNCCCC1(O)CCC1)c1cccnc1	ZINC000819374146	CD	On-Demand	Anodyne	ADRB2	26	46
O[C@@H](CNCCCC1(O)CCC1)c1cccnc1	ZINC000819374146	CD	On-Demand	Anodyne	ADRB1	27	44
O[C@@H](CNCCCC1(O)CCC1)c1cccnc1	ZINC000819374146	CD	On-Demand	Anodyne	ADRB3	102	47
O[C@@H]1CC[C@@H](NC[C@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819374147	DF	On-Demand	Anodyne	ADRB3	20	41
O[C@@H]1CC[C@@H](NC[C@@H](O)c2cccc(C(F)(F)F)c2)CC1	ZINC000819374149	DF	On-Demand	Anodyne	ADRB3	20	41
CC(C)(C)OC(=O)N1CCN(CCC(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819374153	IF	On-Demand	Anodyne	GPR119	27	41
CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC2(CCOC2)C1)c1ccccc1	ZINC000819374156	EF	On-Demand	Anodyne	FPR1	41	33
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2ccc(F)cc2F)CC1	ZINC000819374157	DD	On-Demand	Anodyne	VCP	37	40
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccc(F)cc2F)CC1	ZINC000819374159	DD	On-Demand	Anodyne	VCP	37	40
Cc1ccc(N2CCCC2)c(C(=O)N2Cc3cnn(-c4ccccc4)c3C2)c1	ZINC000819374165	FH	On-Demand	Anodyne	HCRTR1	60	41
Cc1ccc(N2CCCC2)c(C(=O)N2Cc3cnn(-c4ccccc4)c3C2)c1	ZINC000819374165	FH	On-Demand	Anodyne	HCRTR2	34	46
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819374168	GH	On-Demand	Anodyne	CPT2	40	33
CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819374168	GH	On-Demand	Anodyne	PREP	51	38
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819374171	GH	On-Demand	Anodyne	CPT2	40	33
CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819374171	GH	On-Demand	Anodyne	PREP	51	38
O[C@@H](CN[C@@H]1CCc2nnnn2CC1)c1ccc(Cl)cc1	ZINC000819374249	DD	On-Demand	Anodyne	ADRB3	23	48
O[C@@H](CN[C@H]1CCc2nnnn2CC1)c1ccc(Cl)cc1	ZINC000819374250	DD	On-Demand	Anodyne	ADRB3	23	48
COC(=O)c1ccc(CNC[C@@H](O)c2ccccc2)s1	ZINC000819374251	CE	On-Demand	Anodyne	ADRB2	21	41
COC(=O)c1ccc(CNC[C@@H](O)c2ccccc2)s1	ZINC000819374251	CE	On-Demand	Anodyne	ADRB1	37	40
COC(=O)c1ccc(CNC[C@@H](O)c2ccccc2)s1	ZINC000819374251	CE	On-Demand	Anodyne	ADRB3	54	45
COC(=O)c1ccc(CNC[C@H](O)c2ccccc2)s1	ZINC000819374252	CE	On-Demand	Anodyne	ADRB2	21	41
COC(=O)c1ccc(CNC[C@H](O)c2ccccc2)s1	ZINC000819374252	CE	On-Demand	Anodyne	ADRB1	37	40
COC(=O)c1ccc(CNC[C@H](O)c2ccccc2)s1	ZINC000819374252	CE	On-Demand	Anodyne	ADRB3	54	45
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)Nc1cnc2ccccc2c1	ZINC000819374253	GF	On-Demand	Anodyne	PYGL	20	47
NC(=O)C[C@H](NC(=O)c1ccccc1Cl)C(=O)Nc1cnc2ccccc2c1	ZINC000819374253	GF	On-Demand	Anodyne	NR2E3	62	36
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)Nc1cnc2ccccc2c1	ZINC000819374254	GF	On-Demand	Anodyne	PYGL	20	47
NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)Nc1cnc2ccccc2c1	ZINC000819374254	GF	On-Demand	Anodyne	NR2E3	62	36
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819374279	CD	On-Demand	Anodyne	ADRB1	30	41
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819374279	CD	On-Demand	Anodyne	ADRB3	40	41
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc(F)c2)CC1	ZINC000819374279	CD	On-Demand	Anodyne	VCP	46	45
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819374281	CD	On-Demand	Anodyne	ADRB1	30	41
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819374281	CD	On-Demand	Anodyne	ADRB3	40	41
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc(F)c2)CC1	ZINC000819374281	CD	On-Demand	Anodyne	VCP	46	45
COc1ccccc1N1CC[C@@H](NC(=O)C(F)=C2CCC2)C1	ZINC000819374283	DF	On-Demand	Anodyne	HTR1A	63	46
COc1ccccc1N1CC[C@@H](NC(=O)C(F)=C2CCC2)C1	ZINC000819374283	DF	On-Demand	Anodyne	DRD2	56	43
COc1ccccc1N1CC[C@@H](NC(=O)C(F)=C2CCC2)C1	ZINC000819374283	DF	On-Demand	Anodyne	DRD4	31	44
COc1ccccc1N1CC[C@@H](NC(=O)C(F)=C2CCC2)C1	ZINC000819374283	DF	On-Demand	Anodyne	ADRA1D	60	39
COc1ccccc1N1CC[C@@H](NC(=O)C(F)=C2CCC2)C1	ZINC000819374283	DF	On-Demand	Anodyne	ADRA1A	52	39
COc1ccccc1N1CC[C@@H](NC(=O)C(F)=C2CCC2)C1	ZINC000819374283	DF	On-Demand	Anodyne	ADRA1B	46	39
COc1ccccc1N1CC[C@@H](NC(=O)C(F)=C2CCC2)C1	ZINC000819374283	DF	On-Demand	Anodyne	DRD3	58	38
COc1ccccc1N1CC[C@@H](NC(=O)C(F)=C2CCC2)C1	ZINC000819374283	DF	On-Demand	Anodyne	HTR7	43	42
COc1ccccc1N1CC[C@H](NC(=O)C(F)=C2CCC2)C1	ZINC000819374285	DF	On-Demand	Anodyne	HTR1A	63	46
COc1ccccc1N1CC[C@H](NC(=O)C(F)=C2CCC2)C1	ZINC000819374285	DF	On-Demand	Anodyne	DRD2	56	43
COc1ccccc1N1CC[C@H](NC(=O)C(F)=C2CCC2)C1	ZINC000819374285	DF	On-Demand	Anodyne	DRD4	31	44
COc1ccccc1N1CC[C@H](NC(=O)C(F)=C2CCC2)C1	ZINC000819374285	DF	On-Demand	Anodyne	ADRA1D	60	39
COc1ccccc1N1CC[C@H](NC(=O)C(F)=C2CCC2)C1	ZINC000819374285	DF	On-Demand	Anodyne	ADRA1A	52	39
COc1ccccc1N1CC[C@H](NC(=O)C(F)=C2CCC2)C1	ZINC000819374285	DF	On-Demand	Anodyne	ADRA1B	46	39
COc1ccccc1N1CC[C@H](NC(=O)C(F)=C2CCC2)C1	ZINC000819374285	DF	On-Demand	Anodyne	DRD3	58	38
COc1ccccc1N1CC[C@H](NC(=O)C(F)=C2CCC2)C1	ZINC000819374285	DF	On-Demand	Anodyne	HTR7	43	42
CC(=O)Nc1cccc(CC(=O)N[C@H](C)C[C@@H](O)c2ccccc2)c1	ZINC000819374311	EF	On-Demand	Anodyne	CAPN2	42	38
CC(=O)Nc1cccc(CC(=O)N[C@H](C)C[C@@H](O)c2ccccc2)c1	ZINC000819374311	EF	On-Demand	Anodyne	FPR1	33	41
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)C[C@@H](O)c2ccccc2)c1	ZINC000819374313	EF	On-Demand	Anodyne	CAPN2	42	38
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)C[C@@H](O)c2ccccc2)c1	ZINC000819374313	EF	On-Demand	Anodyne	FPR1	33	41
CC(=O)Nc1cccc(CC(=O)N[C@H](C)C[C@H](O)c2ccccc2)c1	ZINC000819374315	EF	On-Demand	Anodyne	CAPN2	42	38
CC(=O)Nc1cccc(CC(=O)N[C@H](C)C[C@H](O)c2ccccc2)c1	ZINC000819374315	EF	On-Demand	Anodyne	FPR1	33	41
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)C[C@H](O)c2ccccc2)c1	ZINC000819374316	EF	On-Demand	Anodyne	CAPN2	42	38
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)C[C@H](O)c2ccccc2)c1	ZINC000819374316	EF	On-Demand	Anodyne	FPR1	33	41
COc1ccccc1N1CC[C@@H](NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819374333	GE	On-Demand	Anodyne	HTR1A	62	42
COc1ccccc1N1CC[C@@H](NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819374333	GE	On-Demand	Anodyne	DRD2	53	50
COc1ccccc1N1CC[C@@H](NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819374333	GE	On-Demand	Anodyne	DRD4	29	40
COc1ccccc1N1CC[C@@H](NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819374333	GE	On-Demand	Anodyne	ADRA1D	58	39
COc1ccccc1N1CC[C@@H](NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819374333	GE	On-Demand	Anodyne	ADRA1A	49	39
COc1ccccc1N1CC[C@@H](NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819374333	GE	On-Demand	Anodyne	ADRA1B	46	39
COc1ccccc1N1CC[C@@H](NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819374333	GE	On-Demand	Anodyne	DRD3	59	40
COc1ccccc1N1CC[C@@H](NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1	ZINC000819374333	GE	On-Demand	Anodyne	HTR7	40	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(c3ccccc3OC)C1)C2	ZINC000819374340	GE	On-Demand	Anodyne	HTR1A	38	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCN(c3ccccc3OC)C1)C2	ZINC000819374340	GE	On-Demand	Anodyne	DRD3	40	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(c3ccccc3OC)C1)C2	ZINC000819374341	GE	On-Demand	Anodyne	HTR1A	38	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCN(c3ccccc3OC)C1)C2	ZINC000819374341	GE	On-Demand	Anodyne	DRD3	40	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCN(c3ccccc3OC)C1)C2	ZINC000819374343	GE	On-Demand	Anodyne	HTR1A	38	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCN(c3ccccc3OC)C1)C2	ZINC000819374343	GE	On-Demand	Anodyne	DRD3	40	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCN(c3ccccc3OC)C1)C2	ZINC000819374344	GE	On-Demand	Anodyne	HTR1A	38	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCN(c3ccccc3OC)C1)C2	ZINC000819374344	GE	On-Demand	Anodyne	DRD3	40	37
COC(=O)c1ccc(CNC[C@@H](O)c2cccc(F)c2)s1	ZINC000819374349	DE	On-Demand	Anodyne	ADRB1	27	48
COC(=O)c1ccc(CNC[C@@H](O)c2cccc(F)c2)s1	ZINC000819374349	DE	On-Demand	Anodyne	ADRB3	42	48
COC(=O)c1ccc(CNC[C@H](O)c2cccc(F)c2)s1	ZINC000819374350	DE	On-Demand	Anodyne	ADRB1	27	48
COC(=O)c1ccc(CNC[C@H](O)c2cccc(F)c2)s1	ZINC000819374350	DE	On-Demand	Anodyne	ADRB3	42	48
COc1cc(C)ccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819374370	GG	On-Demand	Mild	PAPA1_CARPA	52	49
COc1cc(C)ccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819374370	GG	On-Demand	Mild	CTSL	22	48
COc1cc(C)ccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819374370	GG	On-Demand	Mild	CTSS	16	53
COc1cc(C)ccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819374370	GG	On-Demand	Mild	FPR1	42	36
COc1cc(C)ccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819374372	GG	On-Demand	Mild	PAPA1_CARPA	52	49
COc1cc(C)ccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819374372	GG	On-Demand	Mild	CTSL	22	48
COc1cc(C)ccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819374372	GG	On-Demand	Mild	CTSS	16	53
COc1cc(C)ccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819374372	GG	On-Demand	Mild	FPR1	42	36
O[C@@H]1CC[C@@H](NC[C@H](O)c2cccnc2)CC1	ZINC000819374379	BD	On-Demand	Anodyne	ADRB1	23	41
O[C@@H]1CC[C@@H](NC[C@H](O)c2cccnc2)CC1	ZINC000819374379	BD	On-Demand	Anodyne	ADRB3	85	52
O[C@@H]1CC[C@@H](NC[C@@H](O)c2cccnc2)CC1	ZINC000819374382	BD	On-Demand	Anodyne	ADRB1	23	41
O[C@@H]1CC[C@@H](NC[C@@H](O)c2cccnc2)CC1	ZINC000819374382	BD	On-Demand	Anodyne	ADRB3	85	52
O[C@H](CN[C@@H]1CCc2nnnn2CC1)c1cccc(Br)c1	ZINC000819374383	FD	On-Demand	Anodyne	ADRB3	25	41
O[C@@H](CN[C@@H]1CCc2nnnn2CC1)c1cccc(Br)c1	ZINC000819374386	FD	On-Demand	Anodyne	ADRB3	25	41
O[C@H](CN[C@H]1CCc2nnnn2CC1)c1cccc(Br)c1	ZINC000819374389	FD	On-Demand	Anodyne	ADRB3	25	41
O[C@@H](CN[C@H]1CCc2nnnn2CC1)c1cccc(Br)c1	ZINC000819374391	FD	On-Demand	Anodyne	ADRB3	25	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc2ccncc12	ZINC000819374399	EG	On-Demand	Anodyne	TRPV1	28	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc2ccncc12	ZINC000819374399	EG	On-Demand	Anodyne	CDK5	26	42
CC[C@@H]1C[C@@H](NC[C@@H](O)c2cccnc2)CCO1	ZINC000819374436	CD	On-Demand	Anodyne	ADRB3	62	44
CC[C@@H]1C[C@@H](NC[C@H](O)c2cccnc2)CCO1	ZINC000819374443	CD	On-Demand	Anodyne	ADRB3	62	44
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@H](O)c1ccc(F)cc1	ZINC000819374462	EH	On-Demand	Anodyne	ADRB3	40	38
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@@H](O)c1ccc(F)cc1	ZINC000819374463	EH	On-Demand	Anodyne	ADRB3	40	38
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1ccc(Cl)c(F)c1	ZINC000819374494	FH	On-Demand	Anodyne	ADRB3	24	41
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccc(Cl)c(F)c1	ZINC000819374497	FH	On-Demand	Anodyne	ADRB3	24	41
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1ccc(Cl)c(F)c1	ZINC000819374499	FH	On-Demand	Anodyne	ADRB3	24	41
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccc(Cl)c(F)c1	ZINC000819374502	FH	On-Demand	Anodyne	ADRB3	24	41
CS(=O)(=O)CC1(CNC[C@H](O)c2cccc(F)c2)CCC1	ZINC000819374517	DD	On-Demand	Anodyne	ADRB3	52	45
CS(=O)(=O)CC1(CNC[C@@H](O)c2cccc(F)c2)CCC1	ZINC000819374519	DD	On-Demand	Anodyne	ADRB3	52	45
C[C@@H](CCCO)NC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819374526	GD	On-Demand	Anodyne	SSTR2	42	33
C[C@@H](CCCO)NC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819374530	GD	On-Demand	Anodyne	SSTR2	42	33
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819374534	EG	On-Demand	Anodyne	ADRB1	35	43
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819374534	EG	On-Demand	Anodyne	ADRB3	57	46
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819374534	EG	On-Demand	Anodyne	IGF1R	30	43
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819374534	EG	On-Demand	Anodyne	CYP3A4	53	43
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819374535	EG	On-Demand	Anodyne	ADRB1	35	43
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819374535	EG	On-Demand	Anodyne	ADRB3	57	46
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819374535	EG	On-Demand	Anodyne	IGF1R	30	43
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819374535	EG	On-Demand	Anodyne	CYP3A4	53	43
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819374538	EG	On-Demand	Anodyne	ADRB1	35	43
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819374538	EG	On-Demand	Anodyne	ADRB3	57	46
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819374538	EG	On-Demand	Anodyne	IGF1R	30	43
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819374538	EG	On-Demand	Anodyne	CYP3A4	53	43
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819374539	EG	On-Demand	Anodyne	ADRB1	35	43
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819374539	EG	On-Demand	Anodyne	ADRB3	57	46
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819374539	EG	On-Demand	Anodyne	IGF1R	30	43
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Cl)c1	ZINC000819374539	EG	On-Demand	Anodyne	CYP3A4	53	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCC(C)(C)c2cccnc2)CC1	ZINC000819374594	GF	On-Demand	Anodyne	GPR119	53	46
CC(C)(C)OC(=O)N1CCC[C@@H](CC(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819374595	HI	On-Demand	Anodyne	PREP	33	40
CC(C)(C)OC(=O)N1CCC[C@@H](CC(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819374595	HI	On-Demand	Anodyne	GPR119	43	44
CC(C)(C)OC(=O)N1CCC[C@@H](CC(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819374595	HI	On-Demand	Anodyne	SFRP1	15	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCC(C)(C)c2cccnc2)CC1	ZINC000819374596	GF	On-Demand	Anodyne	GPR119	53	46
CC(C)(C)OC(=O)N1CCC[C@H](CC(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819374597	HI	On-Demand	Anodyne	PREP	33	40
CC(C)(C)OC(=O)N1CCC[C@H](CC(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819374597	HI	On-Demand	Anodyne	GPR119	43	44
CC(C)(C)OC(=O)N1CCC[C@H](CC(=O)N2Cc3cnn(-c4ccccc4)c3C2)CC1	ZINC000819374597	HI	On-Demand	Anodyne	SFRP1	15	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](c3ccc(F)cc3)C1)C2	ZINC000819374615	FG	On-Demand	Anodyne	ADAM10	18	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](c3ccc(F)cc3)C1)C2	ZINC000819374617	FG	On-Demand	Anodyne	ADAM10	18	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3ccc(F)cc3)C1)C2	ZINC000819374619	FG	On-Demand	Anodyne	ADAM10	18	43
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CC2(CCOC2)C1	ZINC000819374620	IF	On-Demand	Anodyne	GHRHR	57	33
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CC2(CCOC2)C1	ZINC000819374620	IF	On-Demand	Anodyne	PGC	54	35
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CC2(CCOC2)C1	ZINC000819374620	IF	On-Demand	Anodyne	CPB2	29	45
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CC2(CCOC2)C1	ZINC000819374620	IF	On-Demand	Anodyne	REN	62	40
CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)N1CC2(CCOC2)C1	ZINC000819374620	IF	On-Demand	Anodyne	FPR1	48	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3ccc(F)cc3)C1)C2	ZINC000819374622	FG	On-Demand	Anodyne	ADAM10	18	43
CS(=O)(=O)CC1(CNC[C@H](O)c2cccc(Cl)c2)CCC1	ZINC000819374627	EE	On-Demand	Anodyne	ADRB2	44	39
CS(=O)(=O)CC1(CNC[C@H](O)c2cccc(Cl)c2)CCC1	ZINC000819374627	EE	On-Demand	Anodyne	ADRB1	57	44
CS(=O)(=O)CC1(CNC[C@H](O)c2cccc(Cl)c2)CCC1	ZINC000819374627	EE	On-Demand	Anodyne	ADRB3	84	48
CS(=O)(=O)CC1(CNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819374630	EE	On-Demand	Anodyne	ADRB2	44	39
CS(=O)(=O)CC1(CNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819374630	EE	On-Demand	Anodyne	ADRB1	57	44
CS(=O)(=O)CC1(CNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819374630	EE	On-Demand	Anodyne	ADRB3	84	48
CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819374670	GF	On-Demand	Anodyne	PREP	18	40
CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819374677	GF	On-Demand	Anodyne	PREP	18	40
O=C(C[C@@H]1CCCOC1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819374682	DF	On-Demand	Anodyne	ADAM10	15	40
O=C(C[C@H]1CCCOC1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819374684	DF	On-Demand	Anodyne	ADAM10	15	40
CN(CC(=O)N1CC2(CCOC2)C1)C1=NS(=O)(=O)c2ccccc21	ZINC000819374707	EC	On-Demand	Anodyne	KCNA3	34	43
O=C(c1ccc(-n2cnc3ccccc32)nc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819374719	HH	On-Demand	Anodyne	HPGD	41	42
O=C(N1CC2(CCOC2)C1)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819374720	FD	On-Demand	Anodyne	MMP13	21	48
O=C(N1CC2(CCOC2)C1)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819374720	FD	On-Demand	Anodyne	MMP2	16	46
O=C(N1CC2(CCOC2)C1)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000819374720	FD	On-Demand	Anodyne	MMP14	17	46
O=C(CCCCN1CCCC1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819374724	EF	On-Demand	Anodyne	HTR1A	21	46
O=C(CCCCN1CCCC1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819374724	EF	On-Demand	Anodyne	HTR7	51	46
O=C(CCCCN1CCCC1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819374724	EF	On-Demand	Anodyne	HRH3	15	40
O=C(CCCCN1CCCC1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819374724	EF	On-Demand	Anodyne	SIGMAR1	16	43
O[C@@H](CNCCCC1(O)CCC1)c1cccc(F)c1	ZINC000819374739	CE	On-Demand	Anodyne	ADRB1	23	40
O[C@@H](CNCCCC1(O)CCC1)c1cccc(F)c1	ZINC000819374739	CE	On-Demand	Anodyne	ADRB3	26	40
O[C@H](CNCCCC1(O)CCC1)c1cccc(F)c1	ZINC000819374740	CE	On-Demand	Anodyne	ADRB1	23	40
O[C@H](CNCCCC1(O)CCC1)c1cccc(F)c1	ZINC000819374740	CE	On-Demand	Anodyne	ADRB3	26	40
CCC[C@@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819374765	FH	On-Demand	Mild	PAPA1_CARPA	31	44
CCC[C@@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819374765	FH	On-Demand	Mild	CTSK	15	42
CCC[C@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819374767	FH	On-Demand	Mild	PAPA1_CARPA	31	44
CCC[C@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819374767	FH	On-Demand	Mild	CTSK	15	42
CCC[C@@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819374769	FH	On-Demand	Mild	PAPA1_CARPA	31	44
CCC[C@@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819374769	FH	On-Demand	Mild	CTSK	15	42
CCC[C@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819374770	FH	On-Demand	Mild	PAPA1_CARPA	31	44
CCC[C@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819374770	FH	On-Demand	Mild	CTSK	15	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@@H](O)CC1	ZINC000819374774	GE	On-Demand	Anodyne	CTSD	114	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@@H](O)CC1	ZINC000819374774	GE	On-Demand	Anodyne	PGC	63	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@@H](O)CC1	ZINC000819374774	GE	On-Demand	Anodyne	CMA1	31	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@@H](O)CC1	ZINC000819374774	GE	On-Demand	Anodyne	CTRA_BOVIN	15	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@@H](O)CC1	ZINC000819374774	GE	On-Demand	Anodyne	PAPA1_CARPA	38	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@@H](O)CC1	ZINC000819374774	GE	On-Demand	Anodyne	CCKAR	49	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@@H](O)CC1	ZINC000819374774	GE	On-Demand	Anodyne	CTSK	17	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@@H](O)CC1	ZINC000819374774	GE	On-Demand	Anodyne	PGA	40	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@@H](O)CC1	ZINC000819374774	GE	On-Demand	Anodyne	BACE2	58	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@@H](O)CC1	ZINC000819374774	GE	On-Demand	Anodyne	TACR3	18	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@@H](O)CC1	ZINC000819374774	GE	On-Demand	Anodyne	REN	98	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@@H](O)CC1	ZINC000819374774	GE	On-Demand	Anodyne	REN1	21	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@@H](O)CC1	ZINC000819374774	GE	On-Demand	Anodyne	BACE1	93	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@@H](O)CC1	ZINC000819374774	GE	On-Demand	Anodyne	FPR1	54	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@@H](O)CC1	ZINC000819374774	GE	On-Demand	Anodyne	PLM1_PLAFA	36	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@@H](O)CC1	ZINC000819374774	GE	On-Demand	Anodyne	PLM2_PLAFA	51	34
C[C@@](O)(CNC[C@@H]1CC[C@@H](C(N)=O)CC1)c1ccc(Br)cc1F	ZINC000819374789	GF	On-Demand	Anodyne	VCP	57	40
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819374791	DD	On-Demand	Bother	CACNA1C	53	40
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819374791	DD	On-Demand	Bother	CACNA1D	85	40
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819374791	DD	On-Demand	Bother	VCP	49	44
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819374793	DD	On-Demand	Bother	CACNA1C	53	40
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819374793	DD	On-Demand	Bother	CACNA1D	85	40
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819374793	DD	On-Demand	Bother	VCP	49	44
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2c(F)cccc2F)CC1	ZINC000819374810	DD	On-Demand	Anodyne	VCP	43	42
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2c(F)cccc2F)CC1	ZINC000819374812	DD	On-Demand	Anodyne	VCP	43	42
COc1ccccc1N1CC[C@H](NC(=O)/C=C/[C@@H]2CCCO2)C1=O	ZINC000819374824	ED	On-Demand	Anodyne	HTR1A	26	40
COc1ccccc1N1CC[C@H](NC(=O)/C=C\[C@@H]2CCCO2)C1=O	ZINC000819374826	ED	On-Demand	Anodyne	HTR1A	26	40
COc1ccccc1N1CC[C@H](NC(=O)/C=C\[C@H]2CCCO2)C1=O	ZINC000819374829	ED	On-Demand	Anodyne	HTR1A	26	40
COc1ccccc1N1CC[C@H](NC(=O)/C=C/[C@H]2CCCO2)C1=O	ZINC000819374830	ED	On-Demand	Anodyne	HTR1A	26	40
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2ccc(N3CCOCC3)cc2)C1	ZINC000819374840	FD	On-Demand	Anodyne	MTOR	73	37
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2ccc(N3CCOCC3)cc2)C1	ZINC000819374840	FD	On-Demand	Anodyne	EPHX2	19	42
O=C(O)C[C@H]1CCCN(CC(=O)Nc2ccc(N3CCOCC3)cc2)C1	ZINC000819374842	FD	On-Demand	Anodyne	MTOR	73	37
O=C(O)C[C@H]1CCCN(CC(=O)Nc2ccc(N3CCOCC3)cc2)C1	ZINC000819374842	FD	On-Demand	Anodyne	EPHX2	19	42
O=C(O)C[C@H]1CCCN(CC(=O)N(Cc2ccccc2)Cc2ccco2)C1	ZINC000819374843	FF	On-Demand	Anodyne	MRGPRX1	25	45
O=C(O)C[C@@H]1CCCN(CC(=O)N(Cc2ccccc2)Cc2ccco2)C1	ZINC000819374846	FF	On-Demand	Anodyne	MRGPRX1	25	45
O=C(O)C[C@@H]1CCCN(CC(=O)N2CCN(C(=O)Nc3ccccc3)CC2)C1	ZINC000819374848	GD	On-Demand	Anodyne	CCR3	37	43
O=C(O)C[C@@H]1CCCN(CC(=O)N2CCN(C(=O)Nc3ccccc3)CC2)C1	ZINC000819374848	GD	On-Demand	Anodyne	MAPK1	20	41
O=C(O)C[C@@H]1CCCN(CC(=O)N2CCN(C(=O)Nc3ccccc3)CC2)C1	ZINC000819374848	GD	On-Demand	Anodyne	EPHX2	18	40
O=C(O)C[C@H]1CCCN(CC(=O)N2CCN(C(=O)Nc3ccccc3)CC2)C1	ZINC000819374852	GD	On-Demand	Anodyne	CCR3	37	43
O=C(O)C[C@H]1CCCN(CC(=O)N2CCN(C(=O)Nc3ccccc3)CC2)C1	ZINC000819374852	GD	On-Demand	Anodyne	MAPK1	20	41
O=C(O)C[C@H]1CCCN(CC(=O)N2CCN(C(=O)Nc3ccccc3)CC2)C1	ZINC000819374852	GD	On-Demand	Anodyne	EPHX2	18	40
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2ccc(CN3CCOCC3)cc2)C1	ZINC000819374862	GD	On-Demand	Anodyne	LTA4H	18	46
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2ccc(CN3CCOCC3)cc2)C1	ZINC000819374862	GD	On-Demand	Anodyne	SIGMAR1	18	42
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2ccc(CN3CCOCC3)cc2)C1	ZINC000819374862	GD	On-Demand	Anodyne	CCR3	48	37
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2ccc(CN3CCOCC3)cc2)C1	ZINC000819374862	GD	On-Demand	Anodyne	EPHX2	21	41
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2ccc(CN3CCOCC3)cc2)C1	ZINC000819374862	GD	On-Demand	Anodyne	MCHR1	15	42
O=C(O)C[C@H]1CCCN(CC(=O)Nc2ccc(CN3CCOCC3)cc2)C1	ZINC000819374865	GD	On-Demand	Anodyne	LTA4H	18	46
O=C(O)C[C@H]1CCCN(CC(=O)Nc2ccc(CN3CCOCC3)cc2)C1	ZINC000819374865	GD	On-Demand	Anodyne	SIGMAR1	18	42
O=C(O)C[C@H]1CCCN(CC(=O)Nc2ccc(CN3CCOCC3)cc2)C1	ZINC000819374865	GD	On-Demand	Anodyne	CCR3	48	37
O=C(O)C[C@H]1CCCN(CC(=O)Nc2ccc(CN3CCOCC3)cc2)C1	ZINC000819374865	GD	On-Demand	Anodyne	EPHX2	21	41
O=C(O)C[C@H]1CCCN(CC(=O)Nc2ccc(CN3CCOCC3)cc2)C1	ZINC000819374865	GD	On-Demand	Anodyne	MCHR1	15	42
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2ccc3nc(O)[nH]c3c2)C1	ZINC000819374867	ED	On-Demand	Anodyne	CCR3	41	35
O=C(O)C[C@H]1CCCN(CC(=O)Nc2ccc3nc(O)[nH]c3c2)C1	ZINC000819374871	ED	On-Demand	Anodyne	CCR3	41	35
O=C(O)C[C@@H]1CCCN(C(=S)Nc2ccc(Cl)cc2)C1	ZINC000819374873	DG	On-Demand	Anodyne	CCR1	21	40
O=C(O)C[C@@H]1CCCN(C(=S)Nc2ccc(Cl)cc2)C1	ZINC000819374873	DG	On-Demand	Anodyne	EPHX2	20	42
O=C(O)C[C@@H]1CCCN(C(=S)Nc2ccc(Cl)cc2)C1	ZINC000819374873	DG	On-Demand	Anodyne	DPP7	37	40
O=C(O)C[C@H]1CCCN(C(=S)Nc2ccc(Cl)cc2)C1	ZINC000819374874	DG	On-Demand	Anodyne	CCR1	21	40
O=C(O)C[C@H]1CCCN(C(=S)Nc2ccc(Cl)cc2)C1	ZINC000819374874	DG	On-Demand	Anodyne	EPHX2	20	42
O=C(O)C[C@H]1CCCN(C(=S)Nc2ccc(Cl)cc2)C1	ZINC000819374874	DG	On-Demand	Anodyne	DPP7	37	40
NC(=O)CC1(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819374886	BC	On-Demand	Anodyne	ADRB2	19	42
NC(=O)CC1(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819374886	BC	On-Demand	Anodyne	ADRB1	22	41
NC(=O)CC1(CNC[C@@H](O)c2cccnc2)CC1	ZINC000819374886	BC	On-Demand	Anodyne	ADRB3	89	46
NC(=O)CC1(CNC[C@H](O)c2cccnc2)CC1	ZINC000819374898	BC	On-Demand	Anodyne	ADRB2	19	42
NC(=O)CC1(CNC[C@H](O)c2cccnc2)CC1	ZINC000819374898	BC	On-Demand	Anodyne	ADRB1	22	41
NC(=O)CC1(CNC[C@H](O)c2cccnc2)CC1	ZINC000819374898	BC	On-Demand	Anodyne	ADRB3	89	46
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CC[C@@H](C(N)=O)CC2)c1	ZINC000819374919	ED	On-Demand	Anodyne	MTNR1A	38	41
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CC[C@@H](C(N)=O)CC2)c1	ZINC000819374919	ED	On-Demand	Anodyne	MTNR1B	34	41
COc1ccc(OC)c([C@H](O)CNC[C@@H]2CC[C@@H](C(N)=O)CC2)c1	ZINC000819374919	ED	On-Demand	Anodyne	VCP	33	40
O=C(O)C[C@@H]1CCCN(CC(=O)N2CCC(NC(=O)c3ccccc3)CC2)C1	ZINC000819374925	GD	On-Demand	Anodyne	CHRM1	15	45
O=C(O)C[C@@H]1CCCN(CC(=O)N2CCC(NC(=O)c3ccccc3)CC2)C1	ZINC000819374925	GD	On-Demand	Anodyne	DRD4	23	44
O=C(O)C[C@@H]1CCCN(CC(=O)N2CCC(NC(=O)c3ccccc3)CC2)C1	ZINC000819374925	GD	On-Demand	Anodyne	SLC6A1	63	34
O=C(O)C[C@@H]1CCCN(CC(=O)N2CCC(NC(=O)c3ccccc3)CC2)C1	ZINC000819374925	GD	On-Demand	Anodyne	SIGMAR1	15	43
O=C(O)C[C@@H]1CCCN(CC(=O)N2CCC(NC(=O)c3ccccc3)CC2)C1	ZINC000819374925	GD	On-Demand	Anodyne	CCR8	43	38
O=C(O)C[C@@H]1CCCN(CC(=O)N2CCC(NC(=O)c3ccccc3)CC2)C1	ZINC000819374925	GD	On-Demand	Anodyne	SFRP1	26	40
O=C(O)C[C@@H]1CCCN(CC(=O)N2CCC(NC(=O)c3ccccc3)CC2)C1	ZINC000819374925	GD	On-Demand	Anodyne	WNT3	22	40
O=C(O)C[C@H]1CCCN(CC(=O)N2CCC(NC(=O)c3ccccc3)CC2)C1	ZINC000819374926	GD	On-Demand	Anodyne	CHRM1	15	45
O=C(O)C[C@H]1CCCN(CC(=O)N2CCC(NC(=O)c3ccccc3)CC2)C1	ZINC000819374926	GD	On-Demand	Anodyne	DRD4	23	44
O=C(O)C[C@H]1CCCN(CC(=O)N2CCC(NC(=O)c3ccccc3)CC2)C1	ZINC000819374926	GD	On-Demand	Anodyne	SLC6A1	63	34
O=C(O)C[C@H]1CCCN(CC(=O)N2CCC(NC(=O)c3ccccc3)CC2)C1	ZINC000819374926	GD	On-Demand	Anodyne	SIGMAR1	15	43
O=C(O)C[C@H]1CCCN(CC(=O)N2CCC(NC(=O)c3ccccc3)CC2)C1	ZINC000819374926	GD	On-Demand	Anodyne	CCR8	43	38
O=C(O)C[C@H]1CCCN(CC(=O)N2CCC(NC(=O)c3ccccc3)CC2)C1	ZINC000819374926	GD	On-Demand	Anodyne	SFRP1	26	40
O=C(O)C[C@H]1CCCN(CC(=O)N2CCC(NC(=O)c3ccccc3)CC2)C1	ZINC000819374926	GD	On-Demand	Anodyne	WNT3	22	40
O=C(O)C[C@@H]1CCCN(C(=O)c2ccccc2N2CCCCC2)C1	ZINC000819374927	EG	On-Demand	Anodyne	HTR1A	19	41
O=C(O)C[C@@H]1CCCN(C(=O)c2ccccc2N2CCCCC2)C1	ZINC000819374927	EG	On-Demand	Anodyne	SLC6A1	90	36
O=C(O)C[C@@H]1CCCN(C(=O)c2ccccc2N2CCCCC2)C1	ZINC000819374927	EG	On-Demand	Anodyne	KCNQ2	46	36
O=C(O)C[C@@H]1CCCN(C(=O)c2ccccc2N2CCCCC2)C1	ZINC000819374927	EG	On-Demand	Anodyne	PREP	55	41
O=C(O)C[C@@H]1CCCN(C(=O)c2ccccc2N2CCCCC2)C1	ZINC000819374927	EG	On-Demand	Anodyne	ADAM10	20	40
O=C(O)C[C@H]1CCCN(C(=O)c2ccccc2N2CCCCC2)C1	ZINC000819374928	EG	On-Demand	Anodyne	HTR1A	19	41
O=C(O)C[C@H]1CCCN(C(=O)c2ccccc2N2CCCCC2)C1	ZINC000819374928	EG	On-Demand	Anodyne	SLC6A1	90	36
O=C(O)C[C@H]1CCCN(C(=O)c2ccccc2N2CCCCC2)C1	ZINC000819374928	EG	On-Demand	Anodyne	KCNQ2	46	36
O=C(O)C[C@H]1CCCN(C(=O)c2ccccc2N2CCCCC2)C1	ZINC000819374928	EG	On-Demand	Anodyne	PREP	55	41
O=C(O)C[C@H]1CCCN(C(=O)c2ccccc2N2CCCCC2)C1	ZINC000819374928	EG	On-Demand	Anodyne	ADAM10	20	40
O=C(O)C[C@H]1CCCN(CC(=O)Nc2cc(-n3cnnn3)ccc2F)C1	ZINC000819374943	FC	On-Demand	Anodyne	CCR3	55	32
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2cc(-n3cnnn3)ccc2F)C1	ZINC000819374944	FC	On-Demand	Anodyne	CCR3	55	32
O=C(O)C[C@@H]1CCCN(CC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000819374956	FD	On-Demand	Anodyne	DRD4	31	43
O=C(O)C[C@@H]1CCCN(CC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000819374956	FD	On-Demand	Anodyne	MAPK14	20	41
O=C(O)C[C@@H]1CCCN(CC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000819374956	FD	On-Demand	Anodyne	SIGMAR1	15	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(c2cccs2)CC1	ZINC000819374957	FE	On-Demand	Anodyne	NPBWR1	41	33
O=C(O)C[C@H]1CCCN(CC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000819374958	FD	On-Demand	Anodyne	DRD4	31	43
O=C(O)C[C@H]1CCCN(CC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000819374958	FD	On-Demand	Anodyne	MAPK14	20	41
O=C(O)C[C@H]1CCCN(CC(=O)NCc2cccc(C(=O)NC3CC3)c2)C1	ZINC000819374958	FD	On-Demand	Anodyne	SIGMAR1	15	44
O=C(O)C[C@H]1CCCN(C(=S)Nc2ccccc2)C1	ZINC000819374965	CF	On-Demand	Anodyne	SLC6A1	40	34
O=C(O)C[C@H]1CCCN(C(=S)Nc2ccccc2)C1	ZINC000819374965	CF	On-Demand	Anodyne	NPY2R	29	40
O=C(O)C[C@H]1CCCN(C(=S)Nc2ccccc2)C1	ZINC000819374965	CF	On-Demand	Anodyne	CCR3	24	41
O=C(O)C[C@@H]1CCCN(C(=S)Nc2ccccc2)C1	ZINC000819374967	CF	On-Demand	Anodyne	SLC6A1	40	34
O=C(O)C[C@@H]1CCCN(C(=S)Nc2ccccc2)C1	ZINC000819374967	CF	On-Demand	Anodyne	NPY2R	29	40
O=C(O)C[C@@H]1CCCN(C(=S)Nc2ccccc2)C1	ZINC000819374967	CF	On-Demand	Anodyne	CCR3	24	41
O=C(O)C[C@H]1CCCN(C(=O)c2csc(NC3CC3)n2)C1	ZINC000819374968	DE	On-Demand	Anodyne	TRPC6	56	41
O=C(O)C[C@H]1CCCN(C(=O)c2csc(NC3CC3)n2)C1	ZINC000819374968	DE	On-Demand	Anodyne	TRPC3	50	41
O=C(O)C[C@@H]1CCCN(C(=O)c2csc(NC3CC3)n2)C1	ZINC000819374970	DE	On-Demand	Anodyne	TRPC6	56	41
O=C(O)C[C@@H]1CCCN(C(=O)c2csc(NC3CC3)n2)C1	ZINC000819374970	DE	On-Demand	Anodyne	TRPC3	50	41
O=C(O)C[C@@H]1CCCN(C(=S)Nc2ccc(F)cc2)C1	ZINC000819374976	CF	On-Demand	Anodyne	CCR3	105	43
O=C(O)C[C@@H]1CCCN(C(=S)Nc2ccc(F)cc2)C1	ZINC000819374976	CF	On-Demand	Anodyne	EPHX2	15	44
O=C(O)C[C@H]1CCCN(C(=S)Nc2ccc(F)cc2)C1	ZINC000819374977	CF	On-Demand	Anodyne	CCR3	105	43
O=C(O)C[C@H]1CCCN(C(=S)Nc2ccc(F)cc2)C1	ZINC000819374977	CF	On-Demand	Anodyne	EPHX2	15	44
O=C(O)C[C@@H]1CCCN(C(=S)NCCc2ccc3c(c2)OCCO3)C1	ZINC000819374988	FE	On-Demand	Anodyne	NOS2	86	40
O=C(O)C[C@H]1CCCN(C(=S)NCCc2ccc3c(c2)OCCO3)C1	ZINC000819374992	FE	On-Demand	Anodyne	NOS2	86	40
O=C(O)C[C@@H]1CCCN(C(=S)Nc2cccc(Cl)c2)C1	ZINC000819375002	DG	On-Demand	Anodyne	CCR3	34	43
O=C(O)C[C@@H]1CCCN(C(=S)Nc2cccc(Cl)c2)C1	ZINC000819375002	DG	On-Demand	Anodyne	GRM5	15	44
O=C(O)C[C@H]1CCCN(C(=S)Nc2cccc(Cl)c2)C1	ZINC000819375003	DG	On-Demand	Anodyne	CCR3	34	43
O=C(O)C[C@H]1CCCN(C(=S)Nc2cccc(Cl)c2)C1	ZINC000819375003	DG	On-Demand	Anodyne	GRM5	15	44
O=C(O)C[C@H]1CCCN(C(=O)c2ccccc2C(=O)c2ccc(F)c(F)c2)C1	ZINC000819375007	GH	On-Demand	Anodyne	SLC6A1	45	34
O=C(O)C[C@@H]1CCCN(C(=O)c2ccccc2C(=O)c2ccc(F)c(F)c2)C1	ZINC000819375008	GH	On-Demand	Anodyne	SLC6A1	45	34
O=C(O)C[C@@H]1CCCN(CC(=O)NCC#Cc2cccc(C(F)(F)F)c2)C1	ZINC000819375019	GE	On-Demand	Mild	CCR2	71	40
O=C(O)C[C@H]1CCCN(CC(=O)NCC#Cc2cccc(C(F)(F)F)c2)C1	ZINC000819375020	GE	On-Demand	Mild	CCR2	71	40
O=C(O)C[C@@H]1CCCN(C(=S)Nc2ccccc2F)C1	ZINC000819375023	CF	On-Demand	Anodyne	SLC6A1	45	35
O=C(O)C[C@@H]1CCCN(C(=S)Nc2ccccc2F)C1	ZINC000819375023	CF	On-Demand	Anodyne	CCR3	20	43
O=C(O)C[C@H]1CCCN(C(=S)Nc2ccccc2F)C1	ZINC000819375024	CF	On-Demand	Anodyne	SLC6A1	45	35
O=C(O)C[C@H]1CCCN(C(=S)Nc2ccccc2F)C1	ZINC000819375024	CF	On-Demand	Anodyne	CCR3	20	43
O=C(O)C[C@H]1CCCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819375025	FC	On-Demand	Reactive	CACNA1D	55	34
O=C(O)C[C@@H]1CCCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000819375026	FC	On-Demand	Reactive	CACNA1D	55	34
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@H](O)c1cccnc1	ZINC000819375035	EF	On-Demand	Anodyne	ADRB2	35	40
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@H](O)c1cccnc1	ZINC000819375035	EF	On-Demand	Anodyne	ADRB1	32	48
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@H](O)c1cccnc1	ZINC000819375035	EF	On-Demand	Anodyne	ADRB3	76	48
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@@H](O)c1cccnc1	ZINC000819375036	EF	On-Demand	Anodyne	ADRB2	35	40
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@@H](O)c1cccnc1	ZINC000819375036	EF	On-Demand	Anodyne	ADRB1	32	48
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@@H](O)c1cccnc1	ZINC000819375036	EF	On-Demand	Anodyne	ADRB3	76	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2COCc3ccccc32)CC1	ZINC000819375075	GF	On-Demand	Anodyne	GPR119	36	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2COCc3ccccc32)CC1	ZINC000819375076	GF	On-Demand	Anodyne	GPR119	36	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2COCc3ccccc32)CC1	ZINC000819375078	GF	On-Demand	Anodyne	GPR119	36	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2COCc3ccccc32)CC1	ZINC000819375080	GF	On-Demand	Anodyne	GPR119	36	45
O[C@@H](CN[C@@H]1COCc2ccccc21)c1cccnc1	ZINC000819375088	CD	On-Demand	Anodyne	ADRB3	51	41
O[C@@H](CN[C@H]1COCc2ccccc21)c1cccnc1	ZINC000819375091	CD	On-Demand	Anodyne	ADRB3	51	41
O[C@H](CN[C@@H]1COCc2ccccc21)c1cccnc1	ZINC000819375093	CD	On-Demand	Anodyne	ADRB3	51	41
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2Cc3cnn(-c4ccccc4)c3C2)C1	ZINC000819375094	HG	On-Demand	Anodyne	GRIN2B	22	43
O=C(OCc1ccccc1)N1CC[C@H](C(=O)N2Cc3cnn(-c4ccccc4)c3C2)C1	ZINC000819375094	HG	On-Demand	Anodyne	PREP	37	43
O[C@H](CN[C@H]1COCc2ccccc21)c1cccnc1	ZINC000819375095	CD	On-Demand	Anodyne	ADRB3	51	41
O=C(OCc1ccccc1)N1CC[C@@H](C(=O)N2Cc3cnn(-c4ccccc4)c3C2)C1	ZINC000819375097	HG	On-Demand	Anodyne	GRIN2B	22	43
O=C(OCc1ccccc1)N1CC[C@@H](C(=O)N2Cc3cnn(-c4ccccc4)c3C2)C1	ZINC000819375097	HG	On-Demand	Anodyne	PREP	37	43
O=C(COc1ccc(-c2ccccc2)cc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375111	GI	On-Demand	Anodyne	CPT1A	80	38
O=C(COc1ccc(-c2ccccc2)cc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375111	GI	On-Demand	Anodyne	CPT2	48	37
CON(C)C(=O)CCNC1CCN(Cc2cccc(Br)c2)CC1	ZINC000819375115	GE	On-Demand	Anodyne	DRD2	15	46
CON(C)C(=O)CCNC1CCN(Cc2cccc(Br)c2)CC1	ZINC000819375115	GE	On-Demand	Anodyne	DRD4	35	52
CON(C)C(=O)CCNC1CCN(Cc2cccc(Br)c2)CC1	ZINC000819375115	GE	On-Demand	Anodyne	ACHE	31	40
CON(C)C(=O)CCNC1CCN(Cc2cccc(Br)c2)CC1	ZINC000819375115	GE	On-Demand	Anodyne	SIGMAR1	32	53
CON(C)C(=O)CCNC1CCN(Cc2cccc(Br)c2)CC1	ZINC000819375115	GE	On-Demand	Anodyne	SSTR5	72	37
CON(C)C(=O)CCNC1CCN(Cc2cccc(Br)c2)CC1	ZINC000819375115	GE	On-Demand	Anodyne	MCHR1	43	43
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@H](O)c1cccc(F)c1	ZINC000819375138	EH	On-Demand	Anodyne	ADRB1	30	43
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@H](O)c1cccc(F)c1	ZINC000819375138	EH	On-Demand	Anodyne	ADRB3	47	43
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@@H](O)c1cccc(F)c1	ZINC000819375139	EH	On-Demand	Anodyne	ADRB1	30	43
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@@H](O)c1cccc(F)c1	ZINC000819375139	EH	On-Demand	Anodyne	ADRB3	47	43
O=C(C[C@H](O)c1cccc(F)c1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375163	FF	On-Demand	Anodyne	DPP8	15	41
O=C(C[C@@H](O)c1cccc(F)c1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375166	FF	On-Demand	Anodyne	DPP8	15	41
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375207	HH	On-Demand	Anodyne	ACE	25	40
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375207	HH	On-Demand	Anodyne	FKBP1A	41	38
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375207	HH	On-Demand	Anodyne	CELA1	23	56
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375207	HH	On-Demand	Anodyne	CPT1A	29	43
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375207	HH	On-Demand	Anodyne	CPT2	51	42
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375207	HH	On-Demand	Anodyne	PREP	122	64
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375207	HH	On-Demand	Anodyne	LGMN	77	45
O=C([C@@H]1CCCN1C(=O)OCc1ccccc1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375207	HH	On-Demand	Anodyne	KLK5	25	46
O=C(CCCn1ccnc1)N1CC2(CCOC2)C1	ZINC000819375224	BC	On-Demand	Anodyne	TBXAS1	34	44
O=C(COc1ccc2ccc(=O)oc2c1)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375227	GF	On-Demand	Anodyne	CPT2	40	34
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375247	GE	On-Demand	Anodyne	CPT2	47	39
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375247	GE	On-Demand	Anodyne	PREP	84	41
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375247	GE	On-Demand	Anodyne	SFRP1	40	37
O=C([C@@H]1CCCN1C(=O)C(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375247	GE	On-Demand	Anodyne	WNT3	50	37
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375249	GE	On-Demand	Anodyne	CPT2	47	39
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375249	GE	On-Demand	Anodyne	PREP	84	41
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375249	GE	On-Demand	Anodyne	SFRP1	40	37
O=C([C@H]1CCCN1C(=O)C(F)(F)F)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375249	GE	On-Demand	Anodyne	WNT3	50	37
CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2Cc3cnn(-c4ccccc4)c3C2)C(F)(F)C1	ZINC000819375272	IH	On-Demand	Anodyne	GPR119	42	40
CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2Cc3cnn(-c4ccccc4)c3C2)C(F)(F)C1	ZINC000819375275	IH	On-Demand	Anodyne	GPR119	42	40
CC(C)(C)OC(=O)N1CCC[C@@H]1CCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375282	HH	On-Demand	Anodyne	PREP	48	36
CC(C)(C)OC(=O)N1CCC[C@H]1CCC(=O)N1Cc2cnn(-c3ccccc3)c2C1	ZINC000819375284	HH	On-Demand	Anodyne	PREP	48	36
CN(CCCC(=O)N1CC2(CCOC2)C1)C1=NS(=O)(=O)c2ccccc21	ZINC000819375294	GD	On-Demand	Anodyne	KCNA3	29	41
O=C(O)C[C@@H]1CCCN(C(=O)c2nc(=O)c3ccccc3[nH]2)C1	ZINC000819375325	DD	On-Demand	Anodyne	GRIN2B	33	43
O=C(O)C[C@@H]1CCCN(C(=O)c2nc(=O)c3ccccc3[nH]2)C1	ZINC000819375325	DD	On-Demand	Anodyne	GRIN2D	42	31
COC(=O)c1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819375352	EE	On-Demand	Bother	CACNA1C	69	42
COC(=O)c1ccc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819375352	EE	On-Demand	Bother	CACNA1D	102	42
COC(=O)c1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819375354	EE	On-Demand	Bother	CACNA1C	69	42
COC(=O)c1ccc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819375354	EE	On-Demand	Bother	CACNA1D	102	42
O=C(O)C[C@H]1CCCN(C(=O)c2nc(=O)c3ccccc3[nH]2)C1	ZINC000819375359	DD	On-Demand	Anodyne	GRIN2B	33	43
O=C(O)C[C@H]1CCCN(C(=O)c2nc(=O)c3ccccc3[nH]2)C1	ZINC000819375359	DD	On-Demand	Anodyne	GRIN2D	42	31
O=C(O)C[C@H]1CCCN(C(=S)NCCc2cccs2)C1	ZINC000819375364	DE	On-Demand	Anodyne	DPP7	20	42
O=C(O)C[C@@H]1CCCN(C(=S)NCCc2cccs2)C1	ZINC000819375368	DE	On-Demand	Anodyne	DPP7	20	42
O[C@@H](CNCCCC1(O)CCC1)c1ccccc1	ZINC000819375372	BE	On-Demand	Anodyne	ADRB2	19	46
O[C@H](CNCCCC1(O)CCC1)c1ccccc1	ZINC000819375375	BE	On-Demand	Anodyne	ADRB2	19	46
O[C@@H](CNCCCC1(O)CCC1)c1cccc(Cl)c1	ZINC000819375382	CF	On-Demand	Anodyne	ADRB2	43	40
O[C@@H](CNCCCC1(O)CCC1)c1cccc(Cl)c1	ZINC000819375382	CF	On-Demand	Anodyne	ADRB1	53	47
O[C@@H](CNCCCC1(O)CCC1)c1cccc(Cl)c1	ZINC000819375382	CF	On-Demand	Anodyne	ADRB3	60	47
O[C@H](CNCCCC1(O)CCC1)c1cccc(Cl)c1	ZINC000819375387	CF	On-Demand	Anodyne	ADRB2	43	40
O[C@H](CNCCCC1(O)CCC1)c1cccc(Cl)c1	ZINC000819375387	CF	On-Demand	Anodyne	ADRB1	53	47
O[C@H](CNCCCC1(O)CCC1)c1cccc(Cl)c1	ZINC000819375387	CF	On-Demand	Anodyne	ADRB3	60	47
O=C(O)C[C@@H]1CCCN(C(=S)Nc2ccc3c(c2)OCO3)C1	ZINC000819375391	DE	On-Demand	Anodyne	NOS2	90	35
O=C(O)C[C@H]1CCCN(C(=S)Nc2ccc3c(c2)OCO3)C1	ZINC000819375394	DE	On-Demand	Anodyne	NOS2	90	35
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc(Br)c2)CC1	ZINC000819375409	FE	On-Demand	Anodyne	ADRB3	42	36
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc(Br)c2)CC1	ZINC000819375409	FE	On-Demand	Anodyne	VCP	43	36
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc(Br)c2)CC1	ZINC000819375410	FE	On-Demand	Anodyne	ADRB3	42	36
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc(Br)c2)CC1	ZINC000819375410	FE	On-Demand	Anodyne	VCP	43	36
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CC[C@@H](O)CC2)c1	ZINC000819375441	CD	On-Demand	Bother	ADRB3	22	40
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CC[C@@H](O)CC2)c1	ZINC000819375445	CD	On-Demand	Bother	ADRB3	22	40
O=C(O)C[C@@H]1CCCN(CC(=O)N[C@H](c2ccccc2)c2nccs2)C1	ZINC000819375450	FF	On-Demand	Anodyne	BIRC8	43	30
O=C(O)C[C@H]1CCCN(CC(=O)N[C@@H](c2ccccc2)c2nccs2)C1	ZINC000819375454	FF	On-Demand	Anodyne	BIRC8	43	30
O=C(O)C[C@@H]1CCCN(CC(=O)N[C@@H](c2ccccc2)c2nccs2)C1	ZINC000819375457	FF	On-Demand	Anodyne	BIRC8	43	30
O=C(O)C[C@H]1CCCN(CC(=O)N[C@H](c2ccccc2)c2nccs2)C1	ZINC000819375460	FF	On-Demand	Anodyne	BIRC8	43	30
O=C(O)C[C@@H]1CCCN(CC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819375470	GD	On-Demand	Anodyne	PROC	41	33
O=C(O)C[C@@H]1CCCN(CC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819375470	GD	On-Demand	Anodyne	L3MBTL3	76	40
O=C(O)C[C@H]1CCCN(CC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819375473	GD	On-Demand	Anodyne	PROC	41	33
O=C(O)C[C@H]1CCCN(CC(=O)NCc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819375473	GD	On-Demand	Anodyne	L3MBTL3	76	40
COc1ccccc1N1CC[C@@H](NC(=O)C(F)=C2CCC2)C1=O	ZINC000819375475	DE	On-Demand	Anodyne	HTR1A	40	43
COc1ccccc1N1CC[C@@H](NC(=O)C(F)=C2CCC2)C1=O	ZINC000819375475	DE	On-Demand	Anodyne	DRD2	27	42
COc1ccccc1N1CC[C@@H](NC(=O)C(F)=C2CCC2)C1=O	ZINC000819375475	DE	On-Demand	Anodyne	DRD4	15	40
COc1ccccc1N1CC[C@@H](NC(=O)C(F)=C2CCC2)C1=O	ZINC000819375475	DE	On-Demand	Anodyne	HTR7	26	40
O=C(O)C[C@H]1CCCN(CC(=O)NNC(=O)c2ccccc2Cl)C1	ZINC000819375477	FD	On-Demand	Reactive	SLC6A1	115	40
COc1ccccc1N1CC[C@H](NC(=O)C(F)=C2CCC2)C1=O	ZINC000819375478	DE	On-Demand	Anodyne	HTR1A	40	43
COc1ccccc1N1CC[C@H](NC(=O)C(F)=C2CCC2)C1=O	ZINC000819375478	DE	On-Demand	Anodyne	DRD2	27	42
COc1ccccc1N1CC[C@H](NC(=O)C(F)=C2CCC2)C1=O	ZINC000819375478	DE	On-Demand	Anodyne	DRD4	15	40
COc1ccccc1N1CC[C@H](NC(=O)C(F)=C2CCC2)C1=O	ZINC000819375478	DE	On-Demand	Anodyne	HTR7	26	40
O=C(O)C[C@@H]1CCCN(CC(=O)NNC(=O)c2ccccc2Cl)C1	ZINC000819375480	FD	On-Demand	Reactive	SLC6A1	115	40
O=C(O)C[C@@H]1CCCN(CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)C1	ZINC000819375525	GE	On-Demand	Anodyne	SLC6A1	51	34
O=C(O)C[C@@H]1CCCN(CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)C1	ZINC000819375525	GE	On-Demand	Anodyne	MAPK1	24	48
O=C(O)C[C@@H]1CCCN(CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)C1	ZINC000819375525	GE	On-Demand	Anodyne	EPHX2	20	40
COC(=O)c1ccc(CNC[C@H](O)c2ccc(Cl)cc2)s1	ZINC000819375536	EG	On-Demand	Anodyne	ADRB1	20	43
COC(=O)c1ccc(CNC[C@H](O)c2ccc(Cl)cc2)s1	ZINC000819375536	EG	On-Demand	Anodyne	ADRB3	31	43
COC(=O)c1ccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)s1	ZINC000819375538	FG	On-Demand	Anodyne	PDS	40	32
O=C(O)C[C@H]1CCCN(CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)C1	ZINC000819375540	GE	On-Demand	Anodyne	SLC6A1	51	34
O=C(O)C[C@H]1CCCN(CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)C1	ZINC000819375540	GE	On-Demand	Anodyne	MAPK1	24	48
O=C(O)C[C@H]1CCCN(CC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)C1	ZINC000819375540	GE	On-Demand	Anodyne	EPHX2	20	40
COC(=O)c1ccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)s1	ZINC000819375541	FG	On-Demand	Anodyne	PDS	40	32
O=C(O)C[C@H]1CCCN(CC(=O)NNC(=O)c2cccc(Cl)c2)C1	ZINC000819375549	FD	On-Demand	Reactive	SLC6A1	40	42
O=C(O)C[C@H]1CCCN(CC(=O)NNC(=O)c2cccc(Cl)c2)C1	ZINC000819375549	FD	On-Demand	Reactive	CACNA1I	58	44
O=C(O)C[C@@H]1CCCN(CC(=O)NNC(=O)c2cccc(Cl)c2)C1	ZINC000819375551	FD	On-Demand	Reactive	SLC6A1	40	42
O=C(O)C[C@@H]1CCCN(CC(=O)NNC(=O)c2cccc(Cl)c2)C1	ZINC000819375551	FD	On-Demand	Reactive	CACNA1I	58	44
O=C(O)C[C@H]1CCCN(CC(=O)NCC(=O)c2ccccc2)C1	ZINC000819375586	DD	On-Demand	Anodyne	SLC6A1	86	37
O=C(O)C[C@@H]1CCCN(CC(=O)NCC(=O)c2ccccc2)C1	ZINC000819375590	DD	On-Demand	Anodyne	SLC6A1	86	37
O=C(O)C[C@@H]1CCCN(C(=S)N[C@@H]2CCOc3ccccc32)C1	ZINC000819375594	EF	On-Demand	Anodyne	BIRC3	34	40
O=C(O)C[C@@H]1CCCN(C(=S)N[C@H]2CCOc3ccccc32)C1	ZINC000819375596	EF	On-Demand	Anodyne	BIRC3	34	40
O=C(O)C[C@H]1CCCN(C(=S)N[C@H]2CCOc3ccccc32)C1	ZINC000819375598	EF	On-Demand	Anodyne	BIRC3	34	40
O=C(O)C[C@H]1CCCN(C(=S)N[C@@H]2CCOc3ccccc32)C1	ZINC000819375601	EF	On-Demand	Anodyne	BIRC3	34	40
O=C(O)C[C@H]1CCCN(C(=S)NCc2ccccc2)C1	ZINC000819375610	CE	On-Demand	Anodyne	ACE	42	34
O=C(O)C[C@H]1CCCN(C(=S)NCc2ccccc2)C1	ZINC000819375610	CE	On-Demand	Anodyne	SIGMAR1	22	42
O=C(O)C[C@H]1CCCN(C(=S)NCc2ccccc2)C1	ZINC000819375610	CE	On-Demand	Anodyne	PREP	60	45
O=C(O)C[C@H]1CCCN(C(=S)NCc2ccccc2)C1	ZINC000819375610	CE	On-Demand	Anodyne	DPP7	59	42
O=C(O)C[C@H]1CCCN(C(=S)NCc2ccccc2)C1	ZINC000819375610	CE	On-Demand	Anodyne	DGAT1	17	41
O=C(O)C[C@H]1CCCN(C(=S)NCc2ccccc2)C1	ZINC000819375610	CE	On-Demand	Anodyne	TMPRSS11D	59	34
O=C(O)C[C@@H]1CCCN(C(=S)NCc2ccccc2)C1	ZINC000819375612	CE	On-Demand	Anodyne	ACE	42	34
O=C(O)C[C@@H]1CCCN(C(=S)NCc2ccccc2)C1	ZINC000819375612	CE	On-Demand	Anodyne	SIGMAR1	22	42
O=C(O)C[C@@H]1CCCN(C(=S)NCc2ccccc2)C1	ZINC000819375612	CE	On-Demand	Anodyne	PREP	60	45
O=C(O)C[C@@H]1CCCN(C(=S)NCc2ccccc2)C1	ZINC000819375612	CE	On-Demand	Anodyne	DPP7	59	42
O=C(O)C[C@@H]1CCCN(C(=S)NCc2ccccc2)C1	ZINC000819375612	CE	On-Demand	Anodyne	DGAT1	17	41
O=C(O)C[C@@H]1CCCN(C(=S)NCc2ccccc2)C1	ZINC000819375612	CE	On-Demand	Anodyne	TMPRSS11D	59	34
O=C(O)C[C@@H]1CCCN(CC#Cc2ccc(Cl)cc2)C1	ZINC000819375613	CF	On-Demand	Mild	GRIN2C	15	40
O=C(O)C[C@H]1CCCN(CC#Cc2ccc(Cl)cc2)C1	ZINC000819375616	CF	On-Demand	Mild	GRIN2C	15	40
O=C(O)C[C@@H]1CCCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000819375621	FG	On-Demand	Anodyne	CHRNA7	44	38
O=C(O)C[C@@H]1CCCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000819375621	FG	On-Demand	Anodyne	NAMPT	43	40
O=C(O)C[C@H]1CCCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000819375623	FG	On-Demand	Anodyne	CHRNA7	44	38
O=C(O)C[C@H]1CCCN(C(=O)c2ccccc2NCc2cccnc2)C1	ZINC000819375623	FG	On-Demand	Anodyne	NAMPT	43	40
O=C(O)C[C@H]1CCCN(CC(=O)NNC(=O)c2ccc(F)cc2)C1	ZINC000819375624	EC	On-Demand	Reactive	CCR3	95	38
O=C(O)C[C@@H]1CCCN(CC(=O)NNC(=O)c2ccc(F)cc2)C1	ZINC000819375625	EC	On-Demand	Reactive	CCR3	95	38
O=C(O)C[C@H]1CCCN(C(=S)Nc2ccc(F)cc2F)C1	ZINC000819375634	DF	On-Demand	Anodyne	CCR3	66	36
O=C(O)C[C@@H]1CCCN(C(=S)Nc2ccc(F)cc2F)C1	ZINC000819375635	DF	On-Demand	Anodyne	CCR3	66	36
O=C(O)C[C@@H]1CCCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1	ZINC000819375638	GD	On-Demand	Clean	CCR3	42	33
O=C(O)C[C@H]1CCCN(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)C1	ZINC000819375639	GD	On-Demand	Clean	CCR3	42	33
NC(=O)c1cn(CCCCNC[C@H](O)c2cccc(F)c2)nn1	ZINC000819375645	DC	On-Demand	Anodyne	ADRB1	29	41
NC(=O)c1cn(CCCCNC[C@H](O)c2cccc(F)c2)nn1	ZINC000819375645	DC	On-Demand	Anodyne	ADRB3	36	41
NC(=O)c1cn(CCCCNC[C@@H](O)c2cccc(F)c2)nn1	ZINC000819375646	DC	On-Demand	Anodyne	ADRB1	29	41
NC(=O)c1cn(CCCCNC[C@@H](O)c2cccc(F)c2)nn1	ZINC000819375646	DC	On-Demand	Anodyne	ADRB3	36	41
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819375661	EG	On-Demand	Anodyne	GRM5	20	46
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819375661	EG	On-Demand	Anodyne	SMO	36	40
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819375661	EG	On-Demand	Anodyne	ETHR	34	41
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819375662	EG	On-Demand	Anodyne	GRM5	20	46
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819375662	EG	On-Demand	Anodyne	SMO	36	40
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819375662	EG	On-Demand	Anodyne	ETHR	34	41
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819375663	EG	On-Demand	Anodyne	GRM5	20	46
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819375663	EG	On-Demand	Anodyne	SMO	36	40
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819375663	EG	On-Demand	Anodyne	ETHR	34	41
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819375664	EG	On-Demand	Anodyne	GRM5	20	46
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819375664	EG	On-Demand	Anodyne	SMO	36	40
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819375664	EG	On-Demand	Anodyne	ETHR	34	41
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Br)c1	ZINC000819375684	GG	On-Demand	Anodyne	ADRB3	23	46
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Br)c1	ZINC000819375685	GG	On-Demand	Anodyne	ADRB3	23	46
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Br)c1	ZINC000819375686	GG	On-Demand	Anodyne	ADRB3	23	46
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1cccc(Br)c1	ZINC000819375687	GG	On-Demand	Anodyne	ADRB3	23	46
O[C@H](CN[C@H]1COCc2ccccc21)c1cccc(Cl)c1	ZINC000819375697	DG	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CN[C@H]1COCc2ccccc21)c1cccc(Cl)c1	ZINC000819375697	DG	On-Demand	Anodyne	ADRB3	41	45
O[C@H](CN[C@@H]1COCc2ccccc21)c1cccc(Cl)c1	ZINC000819375698	DG	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CN[C@@H]1COCc2ccccc21)c1cccc(Cl)c1	ZINC000819375698	DG	On-Demand	Anodyne	ADRB3	41	45
O[C@@H](CN[C@H]1COCc2ccccc21)c1cccc(Cl)c1	ZINC000819375699	DG	On-Demand	Anodyne	ADRB1	26	40
O[C@@H](CN[C@H]1COCc2ccccc21)c1cccc(Cl)c1	ZINC000819375699	DG	On-Demand	Anodyne	ADRB3	41	45
O[C@@H](CN[C@@H]1COCc2ccccc21)c1cccc(Cl)c1	ZINC000819375700	DG	On-Demand	Anodyne	ADRB1	26	40
O[C@@H](CN[C@@H]1COCc2ccccc21)c1cccc(Cl)c1	ZINC000819375700	DG	On-Demand	Anodyne	ADRB3	41	45
COC(=O)[C@@]1(NC(=O)C(F)=C2CCC2)CCCN(Cc2ccccc2)C1	ZINC000819375710	FF	On-Demand	Anodyne	SLC12A5	58	36
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@@H](O)c1ccccc1	ZINC000819375720	EH	On-Demand	Anodyne	ADRB1	29	43
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@@H](O)c1ccccc1	ZINC000819375720	EH	On-Demand	Anodyne	ADRB3	52	42
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@H](O)c1ccccc1	ZINC000819375722	EH	On-Demand	Anodyne	ADRB1	29	43
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@H](O)c1ccccc1	ZINC000819375722	EH	On-Demand	Anodyne	ADRB3	52	42
O=C(O)C[C@H]1CCCN(CC(=O)Nc2cc(-n3cnnn3)ccc2Cl)C1	ZINC000819375741	GD	On-Demand	Anodyne	CCR3	43	31
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2cc(-n3cnnn3)ccc2Cl)C1	ZINC000819375743	GD	On-Demand	Anodyne	CCR3	43	31
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc(F)c1	ZINC000819375744	DF	On-Demand	Anodyne	ADRB3	25	48
O=C(O)C[C@@H]1CCCN(C(=S)NCc2cccs2)C1	ZINC000819375745	CE	On-Demand	Anodyne	DPP7	24	46
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1cccc(F)c1	ZINC000819375746	DF	On-Demand	Anodyne	ADRB3	25	48
O=C(O)C[C@H]1CCCN(C(=S)NCc2cccs2)C1	ZINC000819375747	CE	On-Demand	Anodyne	DPP7	24	46
O=C(O)C[C@@H]1CCCN(CC(=O)N2CC=C(c3c[nH]c4ccccc34)CC2)C1	ZINC000819375756	GF	On-Demand	Anodyne	SLC6A4	15	49
O=C(O)C[C@H]1CCCN(CC(=O)N2CC=C(c3c[nH]c4ccccc34)CC2)C1	ZINC000819375757	GF	On-Demand	Anodyne	SLC6A4	15	49
O=C(O)C[C@H]1CCCN(CC(=O)Nc2ccc(O)cc2)C1	ZINC000819375758	CD	On-Demand	Anodyne	CCR3	42	37
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2ccc(O)cc2)C1	ZINC000819375759	CD	On-Demand	Anodyne	CCR3	42	37
O=C(O)C[C@H]1CCCN(CC(=O)NCc2cccnc2)C1	ZINC000819375760	CC	On-Demand	Anodyne	CHRNA7	46	36
O=C(O)C[C@H]1CCCN(CC(=O)NCc2cccnc2)C1	ZINC000819375760	CC	On-Demand	Anodyne	NAMPT	76	43
O=C(O)C[C@@H]1CCCN(CC(=O)NCc2cccnc2)C1	ZINC000819375761	CC	On-Demand	Anodyne	CHRNA7	46	36
O=C(O)C[C@@H]1CCCN(CC(=O)NCc2cccnc2)C1	ZINC000819375761	CC	On-Demand	Anodyne	NAMPT	76	43
O=C(O)C[C@@H]1CCCN(CC(=O)NCc2ccccc2CN2CCOCC2)C1	ZINC000819375764	GD	On-Demand	Anodyne	AVPR1B	15	40
O=C(O)C[C@H]1CCCN(CC(=O)NCc2ccccc2CN2CCOCC2)C1	ZINC000819375765	GD	On-Demand	Anodyne	AVPR1B	15	40
O=C(O)C[C@H]1CCCN(C(=S)NCCc2cccnc2)C1	ZINC000819375766	DD	On-Demand	Anodyne	FKBP1A	18	42
O=C(O)C[C@H]1CCCN(C(=S)NCCc2cccnc2)C1	ZINC000819375766	DD	On-Demand	Anodyne	TBXAS1	41	39
O=C(O)C[C@H]1CCCN(C(=S)NCCc2cccnc2)C1	ZINC000819375766	DD	On-Demand	Anodyne	CHRNA7	45	38
O=C(O)C[C@H]1CCCN(C(=S)NCCc2cccnc2)C1	ZINC000819375766	DD	On-Demand	Anodyne	C3AR1	41	42
O=C(O)C[C@H]1CCCN(C(=S)NCCc2cccnc2)C1	ZINC000819375766	DD	On-Demand	Anodyne	NAMPT	43	42
O=C(O)C[C@@H]1CCCN(C(=S)NCCc2cccnc2)C1	ZINC000819375767	DD	On-Demand	Anodyne	FKBP1A	18	42
O=C(O)C[C@@H]1CCCN(C(=S)NCCc2cccnc2)C1	ZINC000819375767	DD	On-Demand	Anodyne	TBXAS1	41	39
O=C(O)C[C@@H]1CCCN(C(=S)NCCc2cccnc2)C1	ZINC000819375767	DD	On-Demand	Anodyne	CHRNA7	45	38
O=C(O)C[C@@H]1CCCN(C(=S)NCCc2cccnc2)C1	ZINC000819375767	DD	On-Demand	Anodyne	C3AR1	41	42
O=C(O)C[C@@H]1CCCN(C(=S)NCCc2cccnc2)C1	ZINC000819375767	DD	On-Demand	Anodyne	NAMPT	43	42
O=C(O)C[C@@H]1CCCN(C(=S)NCCc2ccccc2)C1	ZINC000819375768	DE	On-Demand	Anodyne	ACE	43	38
O=C(O)C[C@@H]1CCCN(C(=S)NCCc2ccccc2)C1	ZINC000819375768	DE	On-Demand	Anodyne	SIGMAR1	20	40
O=C(O)C[C@@H]1CCCN(C(=S)NCCc2ccccc2)C1	ZINC000819375768	DE	On-Demand	Anodyne	PREP	64	39
O=C(O)C[C@@H]1CCCN(C(=S)NCCc2ccccc2)C1	ZINC000819375768	DE	On-Demand	Anodyne	DPP7	47	45
O=C(O)C[C@H]1CCCN(C(=S)NCCc2ccccc2)C1	ZINC000819375769	DE	On-Demand	Anodyne	ACE	43	38
O=C(O)C[C@H]1CCCN(C(=S)NCCc2ccccc2)C1	ZINC000819375769	DE	On-Demand	Anodyne	SIGMAR1	20	40
O=C(O)C[C@H]1CCCN(C(=S)NCCc2ccccc2)C1	ZINC000819375769	DE	On-Demand	Anodyne	PREP	64	39
O=C(O)C[C@H]1CCCN(C(=S)NCCc2ccccc2)C1	ZINC000819375769	DE	On-Demand	Anodyne	DPP7	47	45
O=C(O)C[C@@H]1CCCN(C(=S)Nc2ccccc2Cl)C1	ZINC000819375771	DG	On-Demand	Anodyne	SLC6A1	58	35
O=C(O)C[C@@H]1CCCN(C(=S)Nc2ccccc2Cl)C1	ZINC000819375771	DG	On-Demand	Anodyne	EPHB3	41	32
O=C(O)C[C@H]1CCCN(C(=S)Nc2ccccc2Cl)C1	ZINC000819375773	DG	On-Demand	Anodyne	SLC6A1	58	35
O=C(O)C[C@H]1CCCN(C(=S)Nc2ccccc2Cl)C1	ZINC000819375773	DG	On-Demand	Anodyne	EPHB3	41	32
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc(F)c1	ZINC000819375776	DF	On-Demand	Anodyne	ADRB3	25	48
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1cccc(F)c1	ZINC000819375780	DF	On-Demand	Anodyne	ADRB3	25	48
O=C(O)C[C@H]1CCCN(C(=S)Nc2ccc3c(c2)OCCO3)C1	ZINC000819375794	EE	On-Demand	Anodyne	NOS2	43	31
O=C(O)C[C@@H]1CCCN(C(=S)Nc2ccc3c(c2)OCCO3)C1	ZINC000819375796	EE	On-Demand	Anodyne	NOS2	43	31
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cc(F)ccc2F)CC1	ZINC000819375812	DD	On-Demand	Anodyne	VCP	39	40
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cc(F)ccc2F)CC1	ZINC000819375813	DD	On-Demand	Anodyne	VCP	39	40
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccccc2)CC1	ZINC000819375820	CD	On-Demand	Anodyne	ADRB1	31	41
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccccc2)CC1	ZINC000819375820	CD	On-Demand	Anodyne	ADRB3	53	41
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccccc2)CC1	ZINC000819375820	CD	On-Demand	Anodyne	AOC3	15	45
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccccc2)CC1	ZINC000819375820	CD	On-Demand	Anodyne	VCP	66	42
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccccc2)CC1	ZINC000819375820	CD	On-Demand	Anodyne	Q8WSF8_APLCA	25	42
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2ccccc2)CC1	ZINC000819375821	CD	On-Demand	Anodyne	ADRB1	31	41
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2ccccc2)CC1	ZINC000819375821	CD	On-Demand	Anodyne	ADRB3	53	41
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2ccccc2)CC1	ZINC000819375821	CD	On-Demand	Anodyne	AOC3	15	45
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2ccccc2)CC1	ZINC000819375821	CD	On-Demand	Anodyne	VCP	66	42
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2ccccc2)CC1	ZINC000819375821	CD	On-Demand	Anodyne	Q8WSF8_APLCA	25	42
NC(=O)CC1(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819375858	CD	On-Demand	Anodyne	ADRB1	35	46
NC(=O)CC1(CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819375858	CD	On-Demand	Anodyne	ADRB3	49	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCc3nnnn3CC2)CC1	ZINC000819375859	GC	On-Demand	Anodyne	GPR119	26	43
NC(=O)CC1(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819375860	CD	On-Demand	Anodyne	ADRB1	35	46
NC(=O)CC1(CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819375860	CD	On-Demand	Anodyne	ADRB3	49	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCc3nnnn3CC2)CC1	ZINC000819375861	GC	On-Demand	Anodyne	GPR119	26	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCc3nnnn3CC2)CC1	ZINC000819375863	GC	On-Demand	Anodyne	GPR119	26	43
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc3ccccc23)CC1	ZINC000819375865	EF	On-Demand	Anodyne	VCP	62	39
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCc3nnnn3CC2)CC1	ZINC000819375866	GC	On-Demand	Anodyne	GPR119	26	43
O[C@@H](CN[C@H]1CCc2nnnn2CC1)c1ccc(Cl)c(F)c1	ZINC000819375868	ED	On-Demand	Anodyne	ADRB3	23	42
O[C@H](CN[C@H]1CCc2nnnn2CC1)c1ccc(Cl)c(F)c1	ZINC000819375870	ED	On-Demand	Anodyne	ADRB3	23	42
O[C@@H](CN[C@@H]1CCc2nnnn2CC1)c1ccc(Cl)c(F)c1	ZINC000819375872	ED	On-Demand	Anodyne	ADRB3	23	42
O[C@H](CN[C@@H]1CCc2nnnn2CC1)c1ccc(Cl)c(F)c1	ZINC000819375874	ED	On-Demand	Anodyne	ADRB3	23	42
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819375897	DE	On-Demand	Anodyne	ADRB2	35	41
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819375897	DE	On-Demand	Anodyne	ADRB1	57	46
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819375897	DE	On-Demand	Anodyne	ADRB3	71	47
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819375897	DE	On-Demand	Anodyne	CYP3A4	47	36
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2cccc(Cl)c2)CC1	ZINC000819375897	DE	On-Demand	Anodyne	VCP	45	40
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819375899	DE	On-Demand	Anodyne	ADRB2	35	41
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819375899	DE	On-Demand	Anodyne	ADRB1	57	46
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819375899	DE	On-Demand	Anodyne	ADRB3	71	47
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819375899	DE	On-Demand	Anodyne	CYP3A4	47	36
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2cccc(Cl)c2)CC1	ZINC000819375899	DE	On-Demand	Anodyne	VCP	45	40
O[C@@H]1CC[C@@H](NC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819375923	CD	On-Demand	Anodyne	SLC6A3	18	60
O[C@@H]1CC[C@@H](NC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819375924	CD	On-Demand	Anodyne	SLC6A3	18	60
O[C@H](CN[C@@H]1CCc2nnnn2CC1)c1ccc(C(F)(F)F)cc1	ZINC000819375937	ED	On-Demand	Anodyne	ADRB3	15	50
O[C@@H](CN[C@@H]1CCc2nnnn2CC1)c1ccc(C(F)(F)F)cc1	ZINC000819375938	ED	On-Demand	Anodyne	ADRB3	15	50
O[C@H](CN[C@H]1CCc2nnnn2CC1)c1ccc(C(F)(F)F)cc1	ZINC000819375939	ED	On-Demand	Anodyne	ADRB3	15	50
O[C@@H](CN[C@H]1CCc2nnnn2CC1)c1ccc(C(F)(F)F)cc1	ZINC000819375940	ED	On-Demand	Anodyne	ADRB3	15	50
COC(=O)c1ccc(CNC[C@@H](O)c2cccnc2)s1	ZINC000819375947	CD	On-Demand	Anodyne	ADRB2	26	45
COC(=O)c1ccc(CNC[C@@H](O)c2cccnc2)s1	ZINC000819375947	CD	On-Demand	Anodyne	ADRB1	37	46
COC(=O)c1ccc(CNC[C@@H](O)c2cccnc2)s1	ZINC000819375947	CD	On-Demand	Anodyne	ADRB3	113	46
COC(=O)c1ccc(CNC[C@H](O)c2cccnc2)s1	ZINC000819375948	CD	On-Demand	Anodyne	ADRB2	26	45
COC(=O)c1ccc(CNC[C@H](O)c2cccnc2)s1	ZINC000819375948	CD	On-Demand	Anodyne	ADRB1	37	46
COC(=O)c1ccc(CNC[C@H](O)c2cccnc2)s1	ZINC000819375948	CD	On-Demand	Anodyne	ADRB3	113	46
O[C@@H](CN[C@H]1CCc2nnnn2CC1)c1ccc(F)c(F)c1	ZINC000819375951	DC	On-Demand	Anodyne	ADRB3	24	43
O[C@H](CN[C@H]1CCc2nnnn2CC1)c1ccc(F)c(F)c1	ZINC000819375952	DC	On-Demand	Anodyne	ADRB3	24	43
O[C@@H](CN[C@@H]1CCc2nnnn2CC1)c1ccc(F)c(F)c1	ZINC000819375953	DC	On-Demand	Anodyne	ADRB3	24	43
O[C@H](CN[C@@H]1CCc2nnnn2CC1)c1ccc(F)c(F)c1	ZINC000819375954	DC	On-Demand	Anodyne	ADRB3	24	43
O[C@H](CN[C@@H]1CCc2nnnn2CC1)c1cccc(C(F)(F)F)c1	ZINC000819375961	ED	On-Demand	Anodyne	ADRB3	21	41
O[C@@H](CN[C@@H]1CCc2nnnn2CC1)c1cccc(C(F)(F)F)c1	ZINC000819375962	ED	On-Demand	Anodyne	ADRB3	21	41
O[C@H](CN[C@H]1CCc2nnnn2CC1)c1cccc(C(F)(F)F)c1	ZINC000819375963	ED	On-Demand	Anodyne	ADRB3	21	41
O[C@@H](CN[C@H]1CCc2nnnn2CC1)c1cccc(C(F)(F)F)c1	ZINC000819375964	ED	On-Demand	Anodyne	ADRB3	21	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCc3nnnn3CC2)c1	ZINC000819375974	DC	On-Demand	Bother	ADRB3	24	41
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCc3nnnn3CC2)c1	ZINC000819375975	DC	On-Demand	Bother	ADRB3	24	41
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCc3nnnn3CC2)c1	ZINC000819375976	DC	On-Demand	Bother	ADRB3	24	41
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCc3nnnn3CC2)c1	ZINC000819375977	DC	On-Demand	Bother	ADRB3	24	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cccs3)CC1)C2	ZINC000819376003	FE	On-Demand	Anodyne	NPBWR1	65	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cccs3)CC1)C2	ZINC000819376004	FE	On-Demand	Anodyne	NPBWR1	65	32
O[C@H](CN[C@@H]1CCc2nnnn2CC1)c1cccc(F)c1	ZINC000819376018	CC	On-Demand	Anodyne	ADRB3	27	40
O[C@@H](CN[C@@H]1CCc2nnnn2CC1)c1cccc(F)c1	ZINC000819376019	CC	On-Demand	Anodyne	ADRB3	27	40
O[C@H](CN[C@H]1CCc2nnnn2CC1)c1cccc(F)c1	ZINC000819376020	CC	On-Demand	Anodyne	ADRB3	27	40
O[C@@H](CN[C@H]1CCc2nnnn2CC1)c1cccc(F)c1	ZINC000819376021	CC	On-Demand	Anodyne	ADRB3	27	40
CN(C)C1CCC(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819376075	ED	On-Demand	Anodyne	ADRB3	19	41
CN(C)C1CCC(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000819376076	ED	On-Demand	Anodyne	ADRB3	19	41
O[C@@H]1CC[C@@H](NC[C@H](O)c2ccc(F)cn2)CC1	ZINC000819376077	CD	On-Demand	Anodyne	MERTK	20	42
O[C@@H]1CC[C@@H](NC[C@@H](O)c2ccc(F)cn2)CC1	ZINC000819376078	CD	On-Demand	Anodyne	MERTK	20	42
COc1ccccc1N1CC[C@@H](NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1=O	ZINC000819376079	GD	On-Demand	Anodyne	HTR1A	37	43
COc1ccccc1N1CC[C@@H](NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1=O	ZINC000819376079	GD	On-Demand	Anodyne	DRD2	24	45
COc1ccccc1N1CC[C@H](NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1=O	ZINC000819376080	GD	On-Demand	Anodyne	HTR1A	37	43
COc1ccccc1N1CC[C@H](NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)C1=O	ZINC000819376080	GD	On-Demand	Anodyne	DRD2	24	45
COc1ccccc1N1CC[C@H](NC(=O)/C=C/[C@@H]2CCCO2)C1	ZINC000819376091	DE	On-Demand	Anodyne	HTR1A	48	39
COc1ccccc1N1CC[C@H](NC(=O)/C=C/[C@@H]2CCCO2)C1	ZINC000819376091	DE	On-Demand	Anodyne	DRD2	41	39
COc1ccccc1N1CC[C@H](NC(=O)/C=C/[C@@H]2CCCO2)C1	ZINC000819376091	DE	On-Demand	Anodyne	ADRA1D	43	37
COc1ccccc1N1CC[C@H](NC(=O)/C=C/[C@@H]2CCCO2)C1	ZINC000819376091	DE	On-Demand	Anodyne	DRD3	49	37
COc1ccccc1N1CC[C@H](NC(=O)/C=C\[C@H]2CCCO2)C1	ZINC000819376093	DE	On-Demand	Anodyne	HTR1A	48	39
COc1ccccc1N1CC[C@H](NC(=O)/C=C\[C@H]2CCCO2)C1	ZINC000819376093	DE	On-Demand	Anodyne	DRD2	41	39
COc1ccccc1N1CC[C@H](NC(=O)/C=C\[C@H]2CCCO2)C1	ZINC000819376093	DE	On-Demand	Anodyne	ADRA1D	43	37
COc1ccccc1N1CC[C@H](NC(=O)/C=C\[C@H]2CCCO2)C1	ZINC000819376093	DE	On-Demand	Anodyne	DRD3	49	37
COc1ccccc1N1CC[C@H](NC(=O)/C=C\[C@@H]2CCCO2)C1	ZINC000819376094	DE	On-Demand	Anodyne	HTR1A	48	39
COc1ccccc1N1CC[C@H](NC(=O)/C=C\[C@@H]2CCCO2)C1	ZINC000819376094	DE	On-Demand	Anodyne	DRD2	41	39
COc1ccccc1N1CC[C@H](NC(=O)/C=C\[C@@H]2CCCO2)C1	ZINC000819376094	DE	On-Demand	Anodyne	ADRA1D	43	37
COc1ccccc1N1CC[C@H](NC(=O)/C=C\[C@@H]2CCCO2)C1	ZINC000819376094	DE	On-Demand	Anodyne	DRD3	49	37
CS(=O)(=O)c1ccc([C@@H](O)CNCCCC2(O)CCC2)cc1	ZINC000819376112	ED	On-Demand	Anodyne	ADRB2	18	43
CS(=O)(=O)c1ccc([C@@H](O)CNCCCC2(O)CCC2)cc1	ZINC000819376112	ED	On-Demand	Anodyne	ADRB3	41	36
CS(=O)(=O)c1ccc([C@H](O)CNCCCC2(O)CCC2)cc1	ZINC000819376114	ED	On-Demand	Anodyne	ADRB2	18	43
CS(=O)(=O)c1ccc([C@H](O)CNCCCC2(O)CCC2)cc1	ZINC000819376114	ED	On-Demand	Anodyne	ADRB3	41	36
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccccc1	ZINC000819376130	DF	On-Demand	Anodyne	SLC6A3	28	54
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccccc1	ZINC000819376130	DF	On-Demand	Anodyne	ADRB3	32	43
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccccc1	ZINC000819376130	DF	On-Demand	Anodyne	SLC18A3	15	40
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1ccccc1	ZINC000819376132	DF	On-Demand	Anodyne	SLC6A3	28	54
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1ccccc1	ZINC000819376132	DF	On-Demand	Anodyne	ADRB3	32	43
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1ccccc1	ZINC000819376132	DF	On-Demand	Anodyne	SLC18A3	15	40
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccccc1	ZINC000819376134	DF	On-Demand	Anodyne	SLC6A3	28	54
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccccc1	ZINC000819376134	DF	On-Demand	Anodyne	ADRB3	32	43
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccccc1	ZINC000819376134	DF	On-Demand	Anodyne	SLC18A3	15	40
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1ccccc1	ZINC000819376136	DF	On-Demand	Anodyne	SLC6A3	28	54
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1ccccc1	ZINC000819376136	DF	On-Demand	Anodyne	ADRB3	32	43
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1ccccc1	ZINC000819376136	DF	On-Demand	Anodyne	SLC18A3	15	40
O[C@@H]1CC[C@@H](NC[C@@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819376167	CE	On-Demand	Anodyne	ADRB3	22	41
O[C@@H]1CC[C@@H](NC[C@H](O)c2ccc(Cl)c(F)c2)CC1	ZINC000819376169	CE	On-Demand	Anodyne	ADRB3	22	41
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819376186	EF	On-Demand	Anodyne	VCP	42	39
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccccc2C(F)(F)F)CC1	ZINC000819376187	EF	On-Demand	Anodyne	VCP	42	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(-c3noc(C4CC4)n3)c1)C2	ZINC000819376200	GG	On-Demand	Anodyne	GRM5	20	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(-c3noc(C4CC4)n3)c1)C2	ZINC000819376200	GG	On-Demand	Anodyne	SMO	31	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(-c3noc(C4CC4)n3)c1)C2	ZINC000819376201	GG	On-Demand	Anodyne	GRM5	20	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(-c3noc(C4CC4)n3)c1)C2	ZINC000819376201	GG	On-Demand	Anodyne	SMO	31	41
NC(=O)c1cn(CCCCNC[C@H](O)c2ccccc2)nn1	ZINC000819376236	DC	On-Demand	Anodyne	ADRB3	52	38
NC(=O)c1cn(CCCCNC[C@H](O)c2ccccc2)nn1	ZINC000819376236	DC	On-Demand	Anodyne	C3AR1	45	33
NC(=O)c1cn(CCCCNC[C@@H](O)c2ccccc2)nn1	ZINC000819376237	DC	On-Demand	Anodyne	ADRB3	52	38
NC(=O)c1cn(CCCCNC[C@@H](O)c2ccccc2)nn1	ZINC000819376237	DC	On-Demand	Anodyne	C3AR1	45	33
C#CCN(C(=O)c1cc(Br)c(C)s1)C1CCCC1	ZINC000819376263	EH	On-Demand	Mild	ACE	44	31
C#CCN(C(=O)CCc1cccc(OC(F)F)c1)C1CCCC1	ZINC000819376268	DH	On-Demand	Mild	CRTM	45	35
NC(=O)[C@@H]1CC[C@@H](CNC[C@@H](O)c2ccc(F)cc2)CC1	ZINC000819376285	CD	On-Demand	Anodyne	VCP	36	42
NC(=O)[C@@H]1CC[C@@H](CNC[C@H](O)c2ccc(F)cc2)CC1	ZINC000819376286	CD	On-Demand	Anodyne	VCP	36	42
Cc1cc(CNC[C@H](O)c2cc(F)ccc2F)cc(C)n1	ZINC000819376371	CF	On-Demand	Anodyne	LEF	48	34
Cc1cc(CNC[C@@H](O)c2cc(F)ccc2F)cc(C)n1	ZINC000819376372	CF	On-Demand	Anodyne	LEF	48	34
O[C@@H](CN[C@H]1CCN(CC(F)F)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819376401	FF	On-Demand	Anodyne	EPHX2	35	40
O[C@H](CN[C@@H]1CCN(CC(F)F)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819376402	FF	On-Demand	Anodyne	EPHX2	35	40
O[C@H](CN[C@H]1CCN(CC(F)F)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819376403	FF	On-Demand	Anodyne	EPHX2	35	40
O[C@@H](CN[C@@H]1CCN(CC(F)F)C1)c1ccc(OC(F)(F)F)cc1	ZINC000819376404	FF	On-Demand	Anodyne	EPHX2	35	40
COC(=O)CCCc1csc(NC(=O)Cc2cccc(NC(C)=O)c2)n1	ZINC000819376415	GF	On-Demand	Anodyne	AOC3	15	43
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819376454	FH	On-Demand	Anodyne	ADRB3	21	45
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819376454	FH	On-Demand	Anodyne	LIPG	46	38
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819376455	FH	On-Demand	Anodyne	ADRB3	21	45
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819376455	FH	On-Demand	Anodyne	LIPG	46	38
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819376456	FH	On-Demand	Anodyne	ADRB3	21	45
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819376456	FH	On-Demand	Anodyne	LIPG	46	38
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819376457	FH	On-Demand	Anodyne	ADRB3	21	45
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1cccc(C(F)(F)F)c1	ZINC000819376457	FH	On-Demand	Anodyne	LIPG	46	38
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccc(F)cc3)C2)cc1	ZINC000819376492	GE	On-Demand	Anodyne	ADRB3	23	48
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(c3ccc(F)cc3)C2)cc1	ZINC000819376492	GE	On-Demand	Anodyne	GPR119	19	44
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3ccc(F)cc3)C2)cc1	ZINC000819376493	GE	On-Demand	Anodyne	ADRB3	23	48
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(c3ccc(F)cc3)C2)cc1	ZINC000819376493	GE	On-Demand	Anodyne	GPR119	19	44
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3ccc(F)cc3)C2)cc1	ZINC000819376494	GE	On-Demand	Anodyne	ADRB3	23	48
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(c3ccc(F)cc3)C2)cc1	ZINC000819376494	GE	On-Demand	Anodyne	GPR119	19	44
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3ccc(F)cc3)C2)cc1	ZINC000819376495	GE	On-Demand	Anodyne	ADRB3	23	48
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(c3ccc(F)cc3)C2)cc1	ZINC000819376495	GE	On-Demand	Anodyne	GPR119	19	44
O=C(Nc1cccc(-c2noc(C3CC3)n2)c1)C(F)=C1CCC1	ZINC000819376515	DH	On-Demand	Anodyne	GRM5	21	46
O=C(Nc1cccc(-c2noc(C3CC3)n2)c1)C(F)=C1CCC1	ZINC000819376515	DH	On-Demand	Anodyne	SMO	36	40
O=C(Nc1cccc(-c2noc(C3CC3)n2)c1)C(F)=C1CCC1	ZINC000819376515	DH	On-Demand	Anodyne	ETHR	50	43
O[C@@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1cccnc1	ZINC000819376516	GG	On-Demand	Anodyne	ADRB3	62	48
O[C@@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1cccnc1	ZINC000819376516	GG	On-Demand	Anodyne	SIGMAR1	19	48
O[C@@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1cccnc1	ZINC000819376516	GG	On-Demand	Anodyne	SSTR5	42	33
O[C@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1cccnc1	ZINC000819376517	GG	On-Demand	Anodyne	ADRB3	62	48
O[C@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1cccnc1	ZINC000819376517	GG	On-Demand	Anodyne	SIGMAR1	19	48
O[C@H](CNC1CCN(Cc2cccc(Br)c2)CC1)c1cccnc1	ZINC000819376517	GG	On-Demand	Anodyne	SSTR5	42	33
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819376542	FG	On-Demand	Bother	ADRB2	27	40
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819376542	FG	On-Demand	Bother	ADRB1	27	40
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819376542	FG	On-Demand	Bother	ADRB3	45	38
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819376544	FG	On-Demand	Bother	ADRB2	27	40
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819376544	FG	On-Demand	Bother	ADRB1	27	40
C[C@@H](Cc1cn(C)c2ccc(F)cc12)NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819376544	FG	On-Demand	Bother	ADRB3	45	38
O[C@H](CNC[C@@H]1C[C@H]2C=C[C@H]1CC2)c1cccnc1	ZINC000819376580	CE	On-Demand	Anodyne	ADRB3	70	40
O[C@@H](CNC[C@@H]1C[C@H]2C=C[C@H]1CC2)c1cccnc1	ZINC000819376583	CE	On-Demand	Anodyne	ADRB3	70	40
O[C@@H](CNC[C@H]1C[C@H]2C=C[C@H]1CC2)c1cccnc1	ZINC000819376584	CE	On-Demand	Anodyne	ADRB3	70	40
O[C@H](CNC[C@H]1C[C@H]2C=C[C@H]1CC2)c1cccnc1	ZINC000819376586	CE	On-Demand	Anodyne	ADRB3	70	40
O[C@H](CN[C@@H]1CCN(CC(F)F)C1)c1cccc(C(F)(F)F)c1	ZINC000819376595	EF	On-Demand	Anodyne	CCR2	54	42
O[C@@H](CN[C@@H]1CCN(CC(F)F)C1)c1cccc(C(F)(F)F)c1	ZINC000819376597	EF	On-Demand	Anodyne	CCR2	54	42
O[C@H](CN[C@H]1CCN(CC(F)F)C1)c1cccc(C(F)(F)F)c1	ZINC000819376598	EF	On-Demand	Anodyne	CCR2	54	42
O[C@@H](CN[C@H]1CCN(CC(F)F)C1)c1cccc(C(F)(F)F)c1	ZINC000819376599	EF	On-Demand	Anodyne	CCR2	54	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CCC1	ZINC000819376670	FF	On-Demand	Mild	CTSD	99	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CCC1	ZINC000819376670	FF	On-Demand	Mild	PGC	61	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CCC1	ZINC000819376670	FF	On-Demand	Mild	PAPA1_CARPA	54	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CCC1	ZINC000819376670	FF	On-Demand	Mild	CTSK	19	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CCC1	ZINC000819376670	FF	On-Demand	Mild	CTSL	21	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CCC1	ZINC000819376670	FF	On-Demand	Mild	PGA	34	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CCC1	ZINC000819376670	FF	On-Demand	Mild	BACE2	52	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CCC1	ZINC000819376670	FF	On-Demand	Mild	REN	77	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CCC1	ZINC000819376670	FF	On-Demand	Mild	REN1	20	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CCC1	ZINC000819376670	FF	On-Demand	Mild	BACE1	88	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCC1(C#N)CCC1	ZINC000819376670	FF	On-Demand	Mild	FPR1	50	41
O[C@@H](CN[C@@H]1C[C@H]1c1ccco1)c1cccc(Cl)c1	ZINC000819376675	CG	On-Demand	Anodyne	ADRB3	38	41
O[C@H](CN[C@@H]1C[C@H]1c1ccco1)c1cccc(Cl)c1	ZINC000819376681	CG	On-Demand	Anodyne	ADRB3	38	41
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819376705	GF	On-Demand	Clean	ADRB2	39	58
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819376705	GF	On-Demand	Clean	ADRB1	60	58
CC(=O)Nc1ccc(OC[C@H](O)CN[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819376705	GF	On-Demand	Clean	ADRB3	35	45
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819376706	GF	On-Demand	Clean	ADRB2	39	58
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819376706	GF	On-Demand	Clean	ADRB1	60	58
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819376706	GF	On-Demand	Clean	ADRB3	35	45
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819376707	GF	On-Demand	Clean	ADRB2	39	58
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819376707	GF	On-Demand	Clean	ADRB1	60	58
CC(=O)Nc1ccc(OC[C@H](O)CN[C@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819376707	GF	On-Demand	Clean	ADRB3	35	45
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819376708	GF	On-Demand	Clean	ADRB2	39	58
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819376708	GF	On-Demand	Clean	ADRB1	60	58
CC(=O)Nc1ccc(OC[C@@H](O)CN[C@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819376708	GF	On-Demand	Clean	ADRB3	35	45
C[C@@H]1CCCC[C@@H]1C(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000819376724	FE	On-Demand	Anodyne	EPHX2	24	42
C[C@@H]1CCCC[C@H]1C(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000819376725	FE	On-Demand	Anodyne	EPHX2	24	42
Cc1ccccc1[C@@H](O)CNCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000819376727	GF	On-Demand	Anodyne	ACHE	25	42
Cc1ccccc1[C@@H](O)CNCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000819376727	GF	On-Demand	Anodyne	LTA4H	16	43
Cc1ccccc1[C@@H](O)CNCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000819376727	GF	On-Demand	Anodyne	SIGMAR1	34	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCCc3cc(C#N)ccc32)CC1	ZINC000819376776	GH	On-Demand	Mild	GPR119	32	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCCc3cc(C#N)ccc32)CC1	ZINC000819376777	GH	On-Demand	Mild	GPR119	32	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCCc3cc(C#N)ccc32)CC1	ZINC000819376778	GH	On-Demand	Mild	GPR119	32	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCCc3cc(C#N)ccc32)CC1	ZINC000819376779	GH	On-Demand	Mild	GPR119	32	41
CS(=O)(=O)CC1(CNC[C@H](O)c2ccccc2)CCC1	ZINC000819376862	CD	On-Demand	Anodyne	ADRB3	64	41
CS(=O)(=O)CC1(CNC[C@@H](O)c2ccccc2)CCC1	ZINC000819376863	CD	On-Demand	Anodyne	ADRB3	64	41
CC(=O)c1cccc(OC[C@H](O)CN[C@@H](C)Cc2ccc(N(C)C)cc2C)c1	ZINC000819376910	GG	On-Demand	Clean	ADRB2	26	48
CC(=O)c1cccc(OC[C@H](O)CN[C@@H](C)Cc2ccc(N(C)C)cc2C)c1	ZINC000819376910	GG	On-Demand	Clean	ADRB1	26	44
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H](C)Cc2ccc(N(C)C)cc2C)c1	ZINC000819376911	GG	On-Demand	Clean	ADRB2	26	48
CC(=O)c1cccc(OC[C@@H](O)CN[C@@H](C)Cc2ccc(N(C)C)cc2C)c1	ZINC000819376911	GG	On-Demand	Clean	ADRB1	26	44
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)Cc2ccc(N(C)C)cc2C)c1	ZINC000819376912	GG	On-Demand	Clean	ADRB2	26	48
CC(=O)c1cccc(OC[C@H](O)CN[C@H](C)Cc2ccc(N(C)C)cc2C)c1	ZINC000819376912	GG	On-Demand	Clean	ADRB1	26	44
CC(=O)c1cccc(OC[C@@H](O)CN[C@H](C)Cc2ccc(N(C)C)cc2C)c1	ZINC000819376913	GG	On-Demand	Clean	ADRB2	26	48
CC(=O)c1cccc(OC[C@@H](O)CN[C@H](C)Cc2ccc(N(C)C)cc2C)c1	ZINC000819376913	GG	On-Demand	Clean	ADRB1	26	44
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1cccnc1	ZINC000819376916	DE	On-Demand	Anodyne	ADRB3	72	59
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccnc1	ZINC000819376917	DE	On-Demand	Anodyne	ADRB3	72	59
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1cccnc1	ZINC000819376918	DE	On-Demand	Anodyne	ADRB3	72	59
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccnc1	ZINC000819376919	DE	On-Demand	Anodyne	ADRB3	72	59
O[C@H](CN[C@@H]1C[C@H]1c1ccco1)c1cccnc1	ZINC000819376955	BD	On-Demand	Anodyne	ADRB3	51	41
O[C@@H](CN[C@@H]1C[C@H]1c1ccco1)c1cccnc1	ZINC000819376956	BD	On-Demand	Anodyne	ADRB3	51	41
CS(=O)(=O)CC1(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)CCC1	ZINC000819376958	ED	On-Demand	Bother	ADRB3	42	35
CS(=O)(=O)CC1(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)CCC1	ZINC000819376959	ED	On-Demand	Bother	ADRB3	42	35
CS(=O)(=O)c1ccc([C@@H](O)CNCC2(C#N)CCC2)cc1	ZINC000819376983	DD	On-Demand	Mild	CTSF	50	38
CS(=O)(=O)c1ccc([C@H](O)CNCC2(C#N)CCC2)cc1	ZINC000819376984	DD	On-Demand	Mild	CTSF	50	38
CCOC(=O)Nc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1	ZINC000819377019	EI	On-Demand	Anodyne	DNMT1	34	41
CCOC(=O)Nc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1	ZINC000819377019	EI	On-Demand	Anodyne	LCK	21	41
CCOC(=O)Nc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1	ZINC000819377019	EI	On-Demand	Anodyne	TRPV1	26	67
CCOC(=O)Nc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1	ZINC000819377019	EI	On-Demand	Anodyne	PRNP	73	42
CCOC(=O)Nc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1	ZINC000819377019	EI	On-Demand	Anodyne	KDR	21	60
CCOC(=O)Nc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1	ZINC000819377019	EI	On-Demand	Anodyne	ABCB1B	25	40
CCOC(=O)Nc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1	ZINC000819377019	EI	On-Demand	Anodyne	HDAC1	30	52
CCOC(=O)Nc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1	ZINC000819377019	EI	On-Demand	Anodyne	ABCB1	15	44
CCOC(=O)Nc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1	ZINC000819377019	EI	On-Demand	Anodyne	PLAU	31	42
CCOC(=O)Nc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1	ZINC000819377019	EI	On-Demand	Anodyne	MCHR1	15	40
CCOC(=O)Nc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1	ZINC000819377019	EI	On-Demand	Anodyne	SHH	69	42
CCOC(=O)Nc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1	ZINC000819377019	EI	On-Demand	Anodyne	ABCG2	23	42
CCOC(=O)Nc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1	ZINC000819377019	EI	On-Demand	Anodyne	DGAT1	29	40
CCOC(=O)Nc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1	ZINC000819377019	EI	On-Demand	Anodyne	IMDH_CRYPV	19	42
CCOC(=O)Nc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1	ZINC000819377019	EI	On-Demand	Anodyne	NOD2	42	39
CCOC(=O)Nc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1	ZINC000819377019	EI	On-Demand	Anodyne	KCNK3	83	39
CCOC(=O)Nc1ccc(C(=O)Nc2cnc3ccccc3c2)cc1	ZINC000819377019	EI	On-Demand	Anodyne	KCNK9	54	39
Cc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc(C)n1	ZINC000819377055	DE	On-Demand	Bother	CACNA1C	54	36
Cc1cc(CNC[C@H](O)c2cccc([N+](=O)[O-])c2)cc(C)n1	ZINC000819377055	DE	On-Demand	Bother	CACNA1D	84	35
Cc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc(C)n1	ZINC000819377056	DE	On-Demand	Bother	CACNA1C	54	36
Cc1cc(CNC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc(C)n1	ZINC000819377056	DE	On-Demand	Bother	CACNA1D	84	35
CCC1(CC)CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819377071	FH	On-Demand	Mild	PAPA1_CARPA	33	43
CCC1(CC)CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819377071	FH	On-Demand	Mild	CTSK	15	41
CCC1(CC)CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819377072	FH	On-Demand	Mild	PAPA1_CARPA	33	43
CCC1(CC)CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819377072	FH	On-Demand	Mild	CTSK	15	41
CC(C)c1nn(-c2ccccc2)cc1C(=O)NCCC1CCC1	ZINC000819377133	DH	On-Demand	Anodyne	SIRT3	42	34
CC(C)c1nn(-c2ccccc2)cc1C(=O)NCCC1CCC1	ZINC000819377133	DH	On-Demand	Anodyne	SIRT2	40	34
CC(C)c1nn(-c2ccccc2)cc1C(=O)NCCC1CCC1	ZINC000819377133	DH	On-Demand	Anodyne	SIRT1	42	34
O[C@H](CN[C@@H]1CCN(CC(F)F)C1)c1ccc(F)cc1	ZINC000819377186	CD	On-Demand	Anodyne	SLC6A3	29	46
O[C@@H](CN[C@@H]1CCN(CC(F)F)C1)c1ccc(F)cc1	ZINC000819377187	CD	On-Demand	Anodyne	SLC6A3	29	46
O[C@H](CN[C@H]1CCN(CC(F)F)C1)c1ccc(F)cc1	ZINC000819377188	CD	On-Demand	Anodyne	SLC6A3	29	46
O[C@@H](CN[C@H]1CCN(CC(F)F)C1)c1ccc(F)cc1	ZINC000819377189	CD	On-Demand	Anodyne	SLC6A3	29	46
O[C@@H](CN[C@H]1CCN(CC(F)F)C1)c1ccccc1C(F)(F)F	ZINC000819377216	EF	On-Demand	Anodyne	RBP4	54	32
O[C@@H](CN[C@H]1CCN(CC(F)F)C1)c1ccccc1C(F)(F)F	ZINC000819377216	EF	On-Demand	Anodyne	SFRP1	69	34
O[C@@H](CN[C@H]1CCN(CC(F)F)C1)c1ccccc1C(F)(F)F	ZINC000819377216	EF	On-Demand	Anodyne	WNT3	40	32
O[C@H](CN[C@H]1CCN(CC(F)F)C1)c1ccccc1C(F)(F)F	ZINC000819377217	EF	On-Demand	Anodyne	RBP4	54	32
O[C@H](CN[C@H]1CCN(CC(F)F)C1)c1ccccc1C(F)(F)F	ZINC000819377217	EF	On-Demand	Anodyne	SFRP1	69	34
O[C@H](CN[C@H]1CCN(CC(F)F)C1)c1ccccc1C(F)(F)F	ZINC000819377217	EF	On-Demand	Anodyne	WNT3	40	32
O[C@@H](CN[C@@H]1CCN(CC(F)F)C1)c1ccccc1C(F)(F)F	ZINC000819377218	EF	On-Demand	Anodyne	RBP4	54	32
O[C@@H](CN[C@@H]1CCN(CC(F)F)C1)c1ccccc1C(F)(F)F	ZINC000819377218	EF	On-Demand	Anodyne	SFRP1	69	34
O[C@@H](CN[C@@H]1CCN(CC(F)F)C1)c1ccccc1C(F)(F)F	ZINC000819377218	EF	On-Demand	Anodyne	WNT3	40	32
O[C@H](CN[C@@H]1CCN(CC(F)F)C1)c1ccccc1C(F)(F)F	ZINC000819377219	EF	On-Demand	Anodyne	RBP4	54	32
O[C@H](CN[C@@H]1CCN(CC(F)F)C1)c1ccccc1C(F)(F)F	ZINC000819377219	EF	On-Demand	Anodyne	SFRP1	69	34
O[C@H](CN[C@@H]1CCN(CC(F)F)C1)c1ccccc1C(F)(F)F	ZINC000819377219	EF	On-Demand	Anodyne	WNT3	40	32
O=C(N[C@H]1CCN(C(=O)CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819377220	EF	On-Demand	Anodyne	GRIN2B	16	44
O=C(N[C@H]1CCN(C(=O)CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819377220	EF	On-Demand	Anodyne	C3AR1	45	44
O=C(N[C@H]1CCN(C(=O)CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819377220	EF	On-Demand	Anodyne	BIRC2	34	43
O=C(N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819377221	EF	On-Demand	Anodyne	GRIN2B	16	44
O=C(N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819377221	EF	On-Demand	Anodyne	C3AR1	45	44
O=C(N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)C(F)=C1CCC1	ZINC000819377221	EF	On-Demand	Anodyne	BIRC2	34	43
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc(C)n1	ZINC000819377224	GG	On-Demand	Anodyne	CTSD	102	44
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc(C)n1	ZINC000819377224	GG	On-Demand	Anodyne	PGC	60	40
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc(C)n1	ZINC000819377224	GG	On-Demand	Anodyne	PAPA1_CARPA	38	46
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc(C)n1	ZINC000819377224	GG	On-Demand	Anodyne	CTSK	17	51
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc(C)n1	ZINC000819377224	GG	On-Demand	Anodyne	CTSL	16	46
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc(C)n1	ZINC000819377224	GG	On-Demand	Anodyne	PGA	37	40
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc(C)n1	ZINC000819377224	GG	On-Demand	Anodyne	BACE2	54	42
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc(C)n1	ZINC000819377224	GG	On-Demand	Anodyne	TACR3	16	41
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc(C)n1	ZINC000819377224	GG	On-Demand	Anodyne	REN	81	49
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc(C)n1	ZINC000819377224	GG	On-Demand	Anodyne	REN1	23	46
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc(C)n1	ZINC000819377224	GG	On-Demand	Anodyne	BACE1	106	45
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc(C)n1	ZINC000819377224	GG	On-Demand	Anodyne	FPR1	51	43
Cc1cc(CNC[C@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)cc(C)n1	ZINC000819377224	GG	On-Demand	Anodyne	PLM2_PLAFA	42	37
CS(=O)(=O)Nc1cc2ccccc2cc1C(=O)Nc1cnc2ccccc2c1	ZINC000819377256	GI	On-Demand	Anodyne	PLA2G7	29	40
COC(=O)[C@H]1CN(C(=O)Cc2ccc(-n3cnnc3)cc2)C[C@H]1C	ZINC000819377265	ED	On-Demand	Anodyne	KCNJ1	40	34
COC(=O)[C@H]1CN(C(=O)Cc2ccc(-n3cnnc3)cc2)C[C@@H]1C	ZINC000819377267	ED	On-Demand	Anodyne	KCNJ1	40	34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1c1ccco1	ZINC000819377268	GG	On-Demand	Anodyne	CTSD	77	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1c1ccco1	ZINC000819377268	GG	On-Demand	Anodyne	PGC	58	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1c1ccco1	ZINC000819377268	GG	On-Demand	Anodyne	PAPA1_CARPA	28	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1c1ccco1	ZINC000819377268	GG	On-Demand	Anodyne	BACE2	38	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1c1ccco1	ZINC000819377268	GG	On-Demand	Anodyne	REN	76	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1c1ccco1	ZINC000819377268	GG	On-Demand	Anodyne	REN1	18	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1c1ccco1	ZINC000819377268	GG	On-Demand	Anodyne	BACE1	61	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1C[C@H]1c1ccco1	ZINC000819377268	GG	On-Demand	Anodyne	FPR1	50	39
O[C@@H](CNCc1cccc(S(F)(F)(F)(F)F)c1)COc1ccccc1	ZINC000819377336	GJ	On-Demand	Reactive	ADRB2	51	51
O[C@@H](CNCc1cccc(S(F)(F)(F)(F)F)c1)COc1ccccc1	ZINC000819377336	GJ	On-Demand	Reactive	ADRB1	78	47
O[C@@H](CNCc1cccc(S(F)(F)(F)(F)F)c1)COc1ccccc1	ZINC000819377336	GJ	On-Demand	Reactive	ADRB3	44	47
O[C@@H](CNCc1cccc(S(F)(F)(F)(F)F)c1)COc1ccccc1	ZINC000819377336	GJ	On-Demand	Reactive	ABCB1	18	47
O[C@@H](CNCc1cccc(S(F)(F)(F)(F)F)c1)COc1ccccc1	ZINC000819377336	GJ	On-Demand	Reactive	PDS	62	37
O[C@H](CNCc1cccc(S(F)(F)(F)(F)F)c1)COc1ccccc1	ZINC000819377337	GJ	On-Demand	Reactive	ADRB2	51	51
O[C@H](CNCc1cccc(S(F)(F)(F)(F)F)c1)COc1ccccc1	ZINC000819377337	GJ	On-Demand	Reactive	ADRB1	78	47
O[C@H](CNCc1cccc(S(F)(F)(F)(F)F)c1)COc1ccccc1	ZINC000819377337	GJ	On-Demand	Reactive	ADRB3	44	47
O[C@H](CNCc1cccc(S(F)(F)(F)(F)F)c1)COc1ccccc1	ZINC000819377337	GJ	On-Demand	Reactive	ABCB1	18	47
O[C@H](CNCc1cccc(S(F)(F)(F)(F)F)c1)COc1ccccc1	ZINC000819377337	GJ	On-Demand	Reactive	PDS	62	37
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000819377369	EE	On-Demand	Anodyne	C3AR1	44	41
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000819377370	EE	On-Demand	Anodyne	C3AR1	44	41
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000819377371	EE	On-Demand	Anodyne	C3AR1	44	41
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000819377372	EE	On-Demand	Anodyne	C3AR1	44	41
Cc1cc(CNC[C@H](O)c2ccccc2)cc(C)n1	ZINC000819377411	CF	On-Demand	Anodyne	ADRB2	28	43
Cc1cc(CNC[C@H](O)c2ccccc2)cc(C)n1	ZINC000819377411	CF	On-Demand	Anodyne	ADRB3	54	40
Cc1cc(CNC[C@H](O)c2ccccc2)cc(C)n1	ZINC000819377411	CF	On-Demand	Anodyne	AOC3	15	45
Cc1cc(CNC[C@@H](O)c2ccccc2)cc(C)n1	ZINC000819377412	CF	On-Demand	Anodyne	ADRB2	28	43
Cc1cc(CNC[C@@H](O)c2ccccc2)cc(C)n1	ZINC000819377412	CF	On-Demand	Anodyne	ADRB3	54	40
Cc1cc(CNC[C@@H](O)c2ccccc2)cc(C)n1	ZINC000819377412	CF	On-Demand	Anodyne	AOC3	15	45
COC(=O)[C@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)c1ccccc1F	ZINC000819377442	FE	On-Demand	Anodyne	PAPA1_CARPA	26	40
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccc(Cl)cc1	ZINC000819377475	EG	On-Demand	Anodyne	ADRB3	23	44
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1ccc(Cl)cc1	ZINC000819377476	EG	On-Demand	Anodyne	ADRB3	23	44
O[C@@H]1CCCC[C@H]1NCc1cccc(S(F)(F)(F)(F)F)c1	ZINC000819377481	EJ	On-Demand	Reactive	SSTR3	27	44
O[C@H]1CCCC[C@H]1NCc1cccc(S(F)(F)(F)(F)F)c1	ZINC000819377482	EJ	On-Demand	Reactive	SSTR3	27	44
O[C@@H]1CCCC[C@@H]1NCc1cccc(S(F)(F)(F)(F)F)c1	ZINC000819377483	EJ	On-Demand	Reactive	SSTR3	27	44
O[C@H]1CCCC[C@@H]1NCc1cccc(S(F)(F)(F)(F)F)c1	ZINC000819377484	EJ	On-Demand	Reactive	SSTR3	27	44
CCOc1ccc([C@@H](C)NC(=O)CCCNC(=O)C(F)=C2CCC2)cc1	ZINC000819377494	FH	On-Demand	Anodyne	ACACA	21	42
CCOc1ccc([C@@H](C)NC(=O)CCCNC(=O)C(F)=C2CCC2)cc1	ZINC000819377494	FH	On-Demand	Anodyne	ACACB	22	46
CS(=O)(=O)CC1(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)CCC1	ZINC000819377537	GE	On-Demand	Anodyne	ADRB3	26	42
CS(=O)(=O)CC1(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)CCC1	ZINC000819377538	GE	On-Demand	Anodyne	ADRB3	26	42
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819377539	GG	On-Demand	Clean	ADRB2	30	47
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819377539	GG	On-Demand	Clean	ADRB1	32	47
CC(=O)c1ccc(OC[C@H](O)CN[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819377539	GG	On-Demand	Clean	ADRB3	17	47
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819377540	GG	On-Demand	Clean	ADRB2	30	47
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819377540	GG	On-Demand	Clean	ADRB1	32	47
CC(=O)c1ccc(OC[C@@H](O)CN[C@@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819377540	GG	On-Demand	Clean	ADRB3	17	47
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819377541	GG	On-Demand	Clean	ADRB2	30	47
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819377541	GG	On-Demand	Clean	ADRB1	32	47
CC(=O)c1ccc(OC[C@H](O)CN[C@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819377541	GG	On-Demand	Clean	ADRB3	17	47
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819377542	GG	On-Demand	Clean	ADRB2	30	47
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819377542	GG	On-Demand	Clean	ADRB1	32	47
CC(=O)c1ccc(OC[C@@H](O)CN[C@H](C)Cc2ccc(N(C)C)cc2C)cc1	ZINC000819377542	GG	On-Demand	Clean	ADRB3	17	47
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCN(CC(F)F)C2)CC1	ZINC000819377613	GD	On-Demand	Anodyne	GPR119	26	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@H]2CCN(CC(F)F)C2)CC1	ZINC000819377614	GD	On-Demand	Anodyne	GPR119	26	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCN(CC(F)F)C2)CC1	ZINC000819377615	GD	On-Demand	Anodyne	GPR119	26	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@H]2CCN(CC(F)F)C2)CC1	ZINC000819377616	GD	On-Demand	Anodyne	GPR119	26	45
Cc1cc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)cc(C)n1	ZINC000819377617	DH	On-Demand	Anodyne	CCR2	27	40
Cc1cc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)cc(C)n1	ZINC000819377617	DH	On-Demand	Anodyne	PDS	40	32
Cc1cc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc(C)n1	ZINC000819377618	DH	On-Demand	Anodyne	CCR2	27	40
Cc1cc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)cc(C)n1	ZINC000819377618	DH	On-Demand	Anodyne	PDS	40	32
O[C@H](CN[C@@H]1CCN(CC(F)F)C1)c1cccc(Cl)c1	ZINC000819377619	DE	On-Demand	Anodyne	ADRB1	32	43
O[C@H](CN[C@@H]1CCN(CC(F)F)C1)c1cccc(Cl)c1	ZINC000819377619	DE	On-Demand	Anodyne	ADRB3	52	47
O[C@H](CN[C@@H]1CCN(CC(F)F)C1)c1cccc(Cl)c1	ZINC000819377619	DE	On-Demand	Anodyne	CYP3A4	47	37
O[C@@H](CN[C@@H]1CCN(CC(F)F)C1)c1cccc(Cl)c1	ZINC000819377620	DE	On-Demand	Anodyne	ADRB1	32	43
O[C@@H](CN[C@@H]1CCN(CC(F)F)C1)c1cccc(Cl)c1	ZINC000819377620	DE	On-Demand	Anodyne	ADRB3	52	47
O[C@@H](CN[C@@H]1CCN(CC(F)F)C1)c1cccc(Cl)c1	ZINC000819377620	DE	On-Demand	Anodyne	CYP3A4	47	37
O[C@H](CN[C@H]1CCN(CC(F)F)C1)c1cccc(Cl)c1	ZINC000819377621	DE	On-Demand	Anodyne	ADRB1	32	43
O[C@H](CN[C@H]1CCN(CC(F)F)C1)c1cccc(Cl)c1	ZINC000819377621	DE	On-Demand	Anodyne	ADRB3	52	47
O[C@H](CN[C@H]1CCN(CC(F)F)C1)c1cccc(Cl)c1	ZINC000819377621	DE	On-Demand	Anodyne	CYP3A4	47	37
O[C@@H](CN[C@H]1CCN(CC(F)F)C1)c1cccc(Cl)c1	ZINC000819377622	DE	On-Demand	Anodyne	ADRB1	32	43
O[C@@H](CN[C@H]1CCN(CC(F)F)C1)c1cccc(Cl)c1	ZINC000819377622	DE	On-Demand	Anodyne	ADRB3	52	47
O[C@@H](CN[C@H]1CCN(CC(F)F)C1)c1cccc(Cl)c1	ZINC000819377622	DE	On-Demand	Anodyne	CYP3A4	47	37
Cc1cc(CNC[C@H](O)c2cccc(Cl)c2)cc(C)n1	ZINC000819377627	CG	On-Demand	Anodyne	ADRB2	25	43
Cc1cc(CNC[C@H](O)c2cccc(Cl)c2)cc(C)n1	ZINC000819377627	CG	On-Demand	Anodyne	ADRB1	39	47
Cc1cc(CNC[C@H](O)c2cccc(Cl)c2)cc(C)n1	ZINC000819377627	CG	On-Demand	Anodyne	ADRB3	56	47
Cc1cc(CNC[C@H](O)c2cccc(Cl)c2)cc(C)n1	ZINC000819377627	CG	On-Demand	Anodyne	CYP3A4	41	34
Cc1cc(CNC[C@@H](O)c2cccc(Cl)c2)cc(C)n1	ZINC000819377628	CG	On-Demand	Anodyne	ADRB2	25	43
Cc1cc(CNC[C@@H](O)c2cccc(Cl)c2)cc(C)n1	ZINC000819377628	CG	On-Demand	Anodyne	ADRB1	39	47
Cc1cc(CNC[C@@H](O)c2cccc(Cl)c2)cc(C)n1	ZINC000819377628	CG	On-Demand	Anodyne	ADRB3	56	47
Cc1cc(CNC[C@@H](O)c2cccc(Cl)c2)cc(C)n1	ZINC000819377628	CG	On-Demand	Anodyne	CYP3A4	41	34
CC[C@@H](C)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819377659	CF	On-Demand	Anodyne	ADRB3	24	40
CC[C@H](C)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819377660	CF	On-Demand	Anodyne	ADRB3	24	40
CC[C@@H](C)CNC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819377661	CF	On-Demand	Anodyne	ADRB3	24	40
CC[C@H](C)CNC[C@H](O)Cc1cccc(Cl)c1	ZINC000819377662	CF	On-Demand	Anodyne	ADRB3	24	40
Cc1cc(CNC[C@H](O)c2cccc(F)c2)cc(C)n1	ZINC000819377696	CF	On-Demand	Anodyne	ADRB1	18	42
Cc1cc(CNC[C@H](O)c2cccc(F)c2)cc(C)n1	ZINC000819377696	CF	On-Demand	Anodyne	ADRB3	27	42
Cc1cc(CNC[C@@H](O)c2cccc(F)c2)cc(C)n1	ZINC000819377697	CF	On-Demand	Anodyne	ADRB1	18	42
Cc1cc(CNC[C@@H](O)c2cccc(F)c2)cc(C)n1	ZINC000819377697	CF	On-Demand	Anodyne	ADRB3	27	42
CS(=O)(=O)CC1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819377722	CC	On-Demand	Anodyne	ADRB2	29	44
CS(=O)(=O)CC1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819377722	CC	On-Demand	Anodyne	ADRB1	32	45
CS(=O)(=O)CC1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819377722	CC	On-Demand	Anodyne	ADRB3	117	48
CS(=O)(=O)CC1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819377723	CC	On-Demand	Anodyne	ADRB2	29	44
CS(=O)(=O)CC1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819377723	CC	On-Demand	Anodyne	ADRB1	32	45
CS(=O)(=O)CC1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819377723	CC	On-Demand	Anodyne	ADRB3	117	48
COc1cccc([S@@](=O)CC(=O)NCCC2CCC2)c1	ZINC000819377771	CE	On-Demand	Anodyne	DRD4	44	33
COc1cccc([S@@](=O)CC(=O)NCCC2CCC2)c1	ZINC000819377771	CE	On-Demand	Anodyne	NQO2	32	40
COc1cccc([S@@](=O)CC(=O)NCCC2CCC2)c1	ZINC000819377771	CE	On-Demand	Anodyne	MTNR1A	71	41
COc1cccc([S@@](=O)CC(=O)NCCC2CCC2)c1	ZINC000819377771	CE	On-Demand	Anodyne	MTNR1B	62	41
CS(=O)(=O)CC1(CNC[C@H](O)c2cccc(Br)c2)CCC1	ZINC000819377785	GE	On-Demand	Anodyne	ADRB3	47	38
CS(=O)(=O)CC1(CNC[C@@H](O)c2cccc(Br)c2)CCC1	ZINC000819377786	GE	On-Demand	Anodyne	ADRB3	47	38
COC(=O)[C@H]1CN(C(=O)c2coc(=O)c3ccccc23)C[C@@H]1C	ZINC000819377800	DD	On-Demand	Anodyne	INHA	55	35
COC(=O)[C@@H]1CN(C(=O)c2coc(=O)c3ccccc23)C[C@@H]1C	ZINC000819377801	DD	On-Demand	Anodyne	INHA	55	35
COC(=O)[C@H]1CN(C(=O)c2coc(=O)c3ccccc23)C[C@H]1C	ZINC000819377802	DD	On-Demand	Anodyne	INHA	55	35
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccc(F)cc1	ZINC000819377813	DF	On-Demand	Anodyne	SLC6A3	19	47
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccc(F)cc1	ZINC000819377813	DF	On-Demand	Anodyne	ADRB3	19	44
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(CC(F)F)C2)cc1	ZINC000819377834	ED	On-Demand	Anodyne	ADRB3	18	42
CS(=O)(=O)c1ccc([C@H](O)CN[C@H]2CCN(CC(F)F)C2)cc1	ZINC000819377834	ED	On-Demand	Anodyne	CCR5	25	43
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(CC(F)F)C2)cc1	ZINC000819377835	ED	On-Demand	Anodyne	ADRB3	18	42
CS(=O)(=O)c1ccc([C@@H](O)CN[C@H]2CCN(CC(F)F)C2)cc1	ZINC000819377835	ED	On-Demand	Anodyne	CCR5	25	43
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(CC(F)F)C2)cc1	ZINC000819377836	ED	On-Demand	Anodyne	ADRB3	18	42
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCN(CC(F)F)C2)cc1	ZINC000819377836	ED	On-Demand	Anodyne	CCR5	25	43
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(CC(F)F)C2)cc1	ZINC000819377837	ED	On-Demand	Anodyne	ADRB3	18	42
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCN(CC(F)F)C2)cc1	ZINC000819377837	ED	On-Demand	Anodyne	CCR5	25	43
N#CC1(CNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819377878	CF	On-Demand	Mild	ADRB1	28	42
N#CC1(CNC[C@@H](O)c2cccc(Cl)c2)CCC1	ZINC000819377878	CF	On-Demand	Mild	ADRB3	42	42
N#CC1(CNC[C@H](O)c2cccc(Cl)c2)CCC1	ZINC000819377879	CF	On-Demand	Mild	ADRB1	28	42
N#CC1(CNC[C@H](O)c2cccc(Cl)c2)CCC1	ZINC000819377879	CF	On-Demand	Mild	ADRB3	42	42
CSc1cc(C)ccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819377910	GH	On-Demand	Mild	PAPA1_CARPA	49	50
CSc1cc(C)ccc1CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819377910	GH	On-Demand	Mild	CTSL	15	48
CSc1cc(C)ccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819377911	GH	On-Demand	Mild	PAPA1_CARPA	49	50
CSc1cc(C)ccc1CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819377911	GH	On-Demand	Mild	CTSL	15	48
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1ccc(F)cc1	ZINC000819377914	DF	On-Demand	Anodyne	SLC6A3	19	47
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1ccc(F)cc1	ZINC000819377914	DF	On-Demand	Anodyne	ADRB3	19	44
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccc(F)cc1	ZINC000819377915	DF	On-Demand	Anodyne	SLC6A3	19	47
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccc(F)cc1	ZINC000819377915	DF	On-Demand	Anodyne	ADRB3	19	44
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1ccc(F)cc1	ZINC000819377916	DF	On-Demand	Anodyne	SLC6A3	19	47
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1ccc(F)cc1	ZINC000819377916	DF	On-Demand	Anodyne	ADRB3	19	44
CN(C)c1ccc(NC(=O)CCNCC(C)(C)c2cccnc2)cc1	ZINC000819377922	EG	On-Demand	Anodyne	NAMPT	18	40
O=[N+]([O-])c1cccc([C@H](O)CN[C@@H]2CCN(c3ccc(F)cc3)C2)c1	ZINC000819377943	EF	On-Demand	Bother	ADRB3	21	45
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2CCN(c3ccc(F)cc3)C2)c1	ZINC000819377944	EF	On-Demand	Bother	ADRB3	21	45
O=[N+]([O-])c1cccc([C@@H](O)CN[C@@H]2CCN(c3ccc(F)cc3)C2)c1	ZINC000819377945	EF	On-Demand	Bother	ADRB3	21	45
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2CCN(c3ccc(F)cc3)C2)c1	ZINC000819377946	EF	On-Demand	Bother	ADRB3	21	45
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@@H]1CCN(c2ccc(F)cc2)C1	ZINC000819377978	FE	On-Demand	Anodyne	GPR119	16	40
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@@H]1CCN(c2ccc(F)cc2)C1	ZINC000819377979	FE	On-Demand	Anodyne	GPR119	16	40
CC(C)(C)OC(=O)NC[C@](C)(O)CN[C@H]1CCN(c2ccc(F)cc2)C1	ZINC000819377980	FE	On-Demand	Anodyne	GPR119	16	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CN[C@H]1CCN(c2ccc(F)cc2)C1	ZINC000819377981	FE	On-Demand	Anodyne	GPR119	16	40
COC(=O)[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)C[C@@H]1C	ZINC000819378000	DE	On-Demand	Anodyne	SLC6A4	32	45
COC(=O)[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)C[C@@H]1C	ZINC000819378000	DE	On-Demand	Anodyne	SLC6A3	57	45
COC(=O)[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)C[C@@H]1C	ZINC000819378001	DE	On-Demand	Anodyne	SLC6A4	32	45
COC(=O)[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)C[C@@H]1C	ZINC000819378001	DE	On-Demand	Anodyne	SLC6A3	57	45
O[C@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1ccc(F)c(Br)c1	ZINC000819378011	GH	On-Demand	Anodyne	ADRB3	19	44
O[C@@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccc(F)c(Br)c1	ZINC000819378012	GH	On-Demand	Anodyne	ADRB3	19	44
O[C@@H](CN[C@H]1CCN(c2ccc(F)cc2)C1)c1ccc(F)c(Br)c1	ZINC000819378013	GH	On-Demand	Anodyne	ADRB3	19	44
O[C@H](CN[C@@H]1CCN(CC(F)F)C1)c1ccccc1	ZINC000819378053	CD	On-Demand	Anodyne	SLC6A3	23	47
O[C@H](CN[C@@H]1CCN(CC(F)F)C1)c1ccccc1	ZINC000819378053	CD	On-Demand	Anodyne	SIGMAR1	16	41
O[C@@H](CN[C@@H]1CCN(CC(F)F)C1)c1ccccc1	ZINC000819378054	CD	On-Demand	Anodyne	SLC6A3	23	47
O[C@@H](CN[C@@H]1CCN(CC(F)F)C1)c1ccccc1	ZINC000819378054	CD	On-Demand	Anodyne	SIGMAR1	16	41
O[C@H](CN[C@H]1CCN(CC(F)F)C1)c1ccccc1	ZINC000819378055	CD	On-Demand	Anodyne	SLC6A3	23	47
O[C@H](CN[C@H]1CCN(CC(F)F)C1)c1ccccc1	ZINC000819378055	CD	On-Demand	Anodyne	SIGMAR1	16	41
O[C@@H](CN[C@H]1CCN(CC(F)F)C1)c1ccccc1	ZINC000819378056	CD	On-Demand	Anodyne	SLC6A3	23	47
O[C@@H](CN[C@H]1CCN(CC(F)F)C1)c1ccccc1	ZINC000819378056	CD	On-Demand	Anodyne	SIGMAR1	16	41
O=C(CCSc1nc2ccccc2s1)Nc1cnc2ccccc2c1	ZINC000819378061	FJ	On-Demand	Anodyne	HMOX2	31	40
N#CC1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819378074	BD	On-Demand	Mild	ADRB2	22	41
N#CC1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819378074	BD	On-Demand	Mild	ADRB1	23	41
N#CC1(CNC[C@@H](O)c2cccnc2)CCC1	ZINC000819378074	BD	On-Demand	Mild	ADRB3	89	42
N#CC1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819378075	BD	On-Demand	Mild	ADRB2	22	41
N#CC1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819378075	BD	On-Demand	Mild	ADRB1	23	41
N#CC1(CNC[C@H](O)c2cccnc2)CCC1	ZINC000819378075	BD	On-Demand	Mild	ADRB3	89	42
Cc1cc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc(C)n1	ZINC000819378082	FF	On-Demand	Anodyne	GPR119	52	48
Cc1cc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc(C)n1	ZINC000819378083	FF	On-Demand	Anodyne	GPR119	52	48
O[C@H](CN[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccc(F)c(Br)c1	ZINC000819378114	GH	On-Demand	Anodyne	ADRB3	19	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCc2nnc(C3CC3)s2)CC1	ZINC000819378138	GF	On-Demand	Anodyne	GPR119	29	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCc2nnc(C3CC3)s2)CC1	ZINC000819378139	GF	On-Demand	Anodyne	GPR119	29	42
O[C@@H](CN[C@@H]1CCN(CC(F)F)C1)c1cccnc1	ZINC000819378211	CD	On-Demand	Anodyne	ADRB3	60	49
O[C@H](CN[C@H]1CCN(CC(F)F)C1)c1cccnc1	ZINC000819378212	CD	On-Demand	Anodyne	ADRB3	60	49
O[C@@H](CN[C@H]1CCN(CC(F)F)C1)c1cccnc1	ZINC000819378213	CD	On-Demand	Anodyne	ADRB3	60	49
O[C@H](CN[C@@H]1CCN(CC(F)F)C1)c1cccnc1	ZINC000819378214	CD	On-Demand	Anodyne	ADRB3	60	49
C=C[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819378233	CE	On-Demand	Mild	PAPA1_CARPA	42	52
C=C[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819378233	CE	On-Demand	Mild	CTSK	20	49
C=C[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819378233	CE	On-Demand	Mild	FPR1	42	39
C=C[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819378234	CE	On-Demand	Mild	PAPA1_CARPA	42	52
C=C[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819378234	CE	On-Demand	Mild	CTSK	20	49
C=C[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819378234	CE	On-Demand	Mild	FPR1	42	39
C=C[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819378235	CE	On-Demand	Mild	PAPA1_CARPA	42	52
C=C[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819378235	CE	On-Demand	Mild	CTSK	20	49
C=C[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819378235	CE	On-Demand	Mild	FPR1	42	39
C=C[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819378236	CE	On-Demand	Mild	PAPA1_CARPA	42	52
C=C[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819378236	CE	On-Demand	Mild	CTSK	20	49
C=C[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819378236	CE	On-Demand	Mild	FPR1	42	39
O[C@@H](CN[C@@H]1CCN(CC(F)F)C1)c1ccc(Cl)cc1	ZINC000819378297	DE	On-Demand	Anodyne	ADRB3	20	45
O[C@@H](CN[C@H]1CCN(CC(F)F)C1)c1ccc(Cl)cc1	ZINC000819378298	DE	On-Demand	Anodyne	ADRB3	20	45
O[C@H](CNC[C@@H]1CC12CCSCC2)c1cccc(Cl)c1	ZINC000819378299	DG	On-Demand	Anodyne	ADRB1	27	42
O[C@H](CNC[C@@H]1CC12CCSCC2)c1cccc(Cl)c1	ZINC000819378299	DG	On-Demand	Anodyne	ADRB3	40	42
O[C@@H](CNC[C@H]1CC12CCSCC2)c1cccc(Cl)c1	ZINC000819378300	DG	On-Demand	Anodyne	ADRB1	27	42
O[C@@H](CNC[C@H]1CC12CCSCC2)c1cccc(Cl)c1	ZINC000819378300	DG	On-Demand	Anodyne	ADRB3	40	42
O[C@H](CNC[C@H]1CC12CCSCC2)c1cccc(Cl)c1	ZINC000819378301	DG	On-Demand	Anodyne	ADRB1	27	42
O[C@H](CNC[C@H]1CC12CCSCC2)c1cccc(Cl)c1	ZINC000819378301	DG	On-Demand	Anodyne	ADRB3	40	42
O[C@@H](CNC[C@@H]1CC12CCSCC2)c1cccc(Cl)c1	ZINC000819378302	DG	On-Demand	Anodyne	ADRB1	27	42
O[C@@H](CNC[C@@H]1CC12CCSCC2)c1cccc(Cl)c1	ZINC000819378302	DG	On-Demand	Anodyne	ADRB3	40	42
O[C@@H](CNC[C@@H]1CC12CCSCC2)c1cccnc1	ZINC000819378303	CE	On-Demand	Anodyne	ADRB3	82	42
O[C@@H](CNC[C@H]1CC12CCSCC2)c1cccnc1	ZINC000819378304	CE	On-Demand	Anodyne	ADRB3	82	42
O[C@H](CNC[C@@H]1CC12CCSCC2)c1cccnc1	ZINC000819378305	CE	On-Demand	Anodyne	ADRB3	82	42
O[C@H](CNC[C@H]1CC12CCSCC2)c1cccnc1	ZINC000819378306	CE	On-Demand	Anodyne	ADRB3	82	42
Cc1cc(CNC[C@H](O)c2cccnc2)cc(C)n1	ZINC000819378331	CD	On-Demand	Anodyne	ADRB2	28	46
Cc1cc(CNC[C@H](O)c2cccnc2)cc(C)n1	ZINC000819378331	CD	On-Demand	Anodyne	ADRB1	30	46
Cc1cc(CNC[C@H](O)c2cccnc2)cc(C)n1	ZINC000819378331	CD	On-Demand	Anodyne	ADRB3	102	48
Cc1cc(CNC[C@H](O)c2cccnc2)cc(C)n1	ZINC000819378331	CD	On-Demand	Anodyne	CYP51A1	16	40
Cc1cc(CNC[C@@H](O)c2cccnc2)cc(C)n1	ZINC000819378332	CD	On-Demand	Anodyne	ADRB2	28	46
Cc1cc(CNC[C@@H](O)c2cccnc2)cc(C)n1	ZINC000819378332	CD	On-Demand	Anodyne	ADRB1	30	46
Cc1cc(CNC[C@@H](O)c2cccnc2)cc(C)n1	ZINC000819378332	CD	On-Demand	Anodyne	ADRB3	102	48
Cc1cc(CNC[C@@H](O)c2cccnc2)cc(C)n1	ZINC000819378332	CD	On-Demand	Anodyne	CYP51A1	16	40
O=C([C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1)N1CC2(CCOC2)C1	ZINC000819378354	HE	On-Demand	Anodyne	PREP	16	42
O=C([C@@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1)N1CC2(CCOC2)C1	ZINC000819378354	HE	On-Demand	Anodyne	MMP8	23	40
O=C([C@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1)N1CC2(CCOC2)C1	ZINC000819378355	HE	On-Demand	Anodyne	PREP	16	42
O=C([C@H]1Cc2ccccc2CN1S(=O)(=O)c1cccs1)N1CC2(CCOC2)C1	ZINC000819378355	HE	On-Demand	Anodyne	MMP8	23	40
CO/C(=C/c1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378362	CD	On-Demand	Anodyne	TLR4	25	41
CO/C(=C\c1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378363	CD	On-Demand	Anodyne	TLR4	25	41
CCCCCCCCCCCC(=O)N1CC2(CCOC2)C1	ZINC000819378368	CI	On-Demand	Mild	CQSS	51	33
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CC2(CCOC2)C1	ZINC000819378398	FF	On-Demand	Anodyne	ALOX5	15	41
O=C(C[C@H](O)c1ccc(OCc2ccccc2)cc1)N1CC2(CCOC2)C1	ZINC000819378398	FF	On-Demand	Anodyne	FFAR1	31	42
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CC2(CCOC2)C1	ZINC000819378399	FF	On-Demand	Anodyne	ALOX5	15	41
O=C(C[C@@H](O)c1ccc(OCc2ccccc2)cc1)N1CC2(CCOC2)C1	ZINC000819378399	FF	On-Demand	Anodyne	FFAR1	31	42
CSCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCOC2)C1	ZINC000819378404	ED	On-Demand	Anodyne	PAPA1_CARPA	16	46
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CC2(CCOC2)C1)Cc1ccccc1	ZINC000819378418	FF	On-Demand	Anodyne	GHRHR	48	33
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CC2(CCOC2)C1)Cc1ccccc1	ZINC000819378418	FF	On-Demand	Anodyne	PGC	53	35
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CC2(CCOC2)C1)Cc1ccccc1	ZINC000819378418	FF	On-Demand	Anodyne	CMA1	28	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CC2(CCOC2)C1)Cc1ccccc1	ZINC000819378418	FF	On-Demand	Anodyne	CTRA_BOVIN	17	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CC2(CCOC2)C1)Cc1ccccc1	ZINC000819378418	FF	On-Demand	Anodyne	PAPA1_CARPA	34	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CC2(CCOC2)C1)Cc1ccccc1	ZINC000819378418	FF	On-Demand	Anodyne	CCKAR	41	36
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CC2(CCOC2)C1)Cc1ccccc1	ZINC000819378418	FF	On-Demand	Anodyne	CTSL	19	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CC2(CCOC2)C1)Cc1ccccc1	ZINC000819378418	FF	On-Demand	Anodyne	TACR3	19	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CC2(CCOC2)C1)Cc1ccccc1	ZINC000819378418	FF	On-Demand	Anodyne	REN	64	39
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CC2(CCOC2)C1)Cc1ccccc1	ZINC000819378418	FF	On-Demand	Anodyne	FPR1	51	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CC2(CCOC2)C1)Cc1ccccc1	ZINC000819378418	FF	On-Demand	Anodyne	CTRB_BOVIN	21	42
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CC2(CCOC2)C1	ZINC000819378423	FD	On-Demand	Anodyne	GRIN2B	25	45
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CC2(CCOC2)C1	ZINC000819378423	FD	On-Demand	Anodyne	TGM2	27	40
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)N1CC2(CCOC2)C1	ZINC000819378423	FD	On-Demand	Anodyne	SLC12A5	61	37
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CC2(CCOC2)C1	ZINC000819378428	IH	On-Demand	Anodyne	CPT2	41	35
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CC2(CCOC2)C1	ZINC000819378428	IH	On-Demand	Anodyne	PREP	79	47
O=C([C@@H]1CCCN1C(=O)OCC1c2ccccc2-c2ccccc21)N1CC2(CCOC2)C1	ZINC000819378428	IH	On-Demand	Anodyne	LGMN	54	34
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378444	GC	On-Demand	Anodyne	GHRHR	64	35
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378444	GC	On-Demand	Anodyne	CTRA_BOVIN	56	34
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378444	GC	On-Demand	Anodyne	KLK3	82	44
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378444	GC	On-Demand	Anodyne	CTSB	61	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378444	GC	On-Demand	Anodyne	PAPA1_CARPA	64	38
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378444	GC	On-Demand	Anodyne	CYSP_TRYCR	63	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378444	GC	On-Demand	Anodyne	CTSG	44	34
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378444	GC	On-Demand	Anodyne	CTSK	47	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378444	GC	On-Demand	Anodyne	CTSL	48	41
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378444	GC	On-Demand	Anodyne	CAPNS1	69	39
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378444	GC	On-Demand	Anodyne	CELA2A	52	34
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378444	GC	On-Demand	Anodyne	CTSS	21	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378444	GC	On-Demand	Anodyne	CAPN1	81	47
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378444	GC	On-Demand	Anodyne	CAPN2	131	43
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378444	GC	On-Demand	Anodyne	TGM2	33	49
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378444	GC	On-Demand	Anodyne	TPSAB1	41	37
NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378444	GC	On-Demand	Anodyne	NPR	62	35
O=C(c1cc(-c2ccccc2)nc2cc(F)ccc12)N1CC2(CCOC2)C1	ZINC000819378448	FH	On-Demand	Anodyne	DHODH	36	46
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	GHRHR	74	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	PGC	53	35
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	CMA1	29	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	CTRA_BOVIN	40	31
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	CTSB	43	38
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	PAPA1_CARPA	51	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	CYSP_TRYCR	56	39
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	CCKAR	42	38
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	CTSK	41	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	CTSL	44	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	TACR3	16	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	CAPNS1	63	37
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	REN	64	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	CCKBR	18	40
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	CTSS	25	41
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	GHSR	22	43
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	CAPN1	66	39
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	CAPN2	102	36
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	KLK5	26	51
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	FPR1	50	42
CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378461	HE	On-Demand	Anodyne	NPR	59	35
COc1cccc(C2=NO[C@H](C(=O)N3CC4(CCOC4)C3)C2)c1	ZINC000819378479	DD	On-Demand	Anodyne	LUCI_PHOPY	23	43
COc1cccc(C2=NO[C@@H](C(=O)N3CC4(CCOC4)C3)C2)c1	ZINC000819378480	DD	On-Demand	Anodyne	LUCI_PHOPY	23	43
O=C(c1ccc(Oc2ccc(F)cc2)cc1)N1CC2(CCOC2)C1	ZINC000819378481	EG	On-Demand	Anodyne	MMP13	20	44
CCCCCCCCC(=O)N1CC2(CCOC2)C1	ZINC000819378522	CF	On-Demand	Mild	CQSS	51	33
CCCCCCCCCC(=O)N1CC2(CCOC2)C1	ZINC000819378538	CG	On-Demand	Mild	CQSS	51	33
O=C(/C=C\c1ccccc1)N1CCC(C(=O)N2CC3(CCOC3)C2)CC1	ZINC000819378591	FE	On-Demand	Anodyne	ITGAL	54	36
O=C(/C=C/c1ccccc1)N1CCC(C(=O)N2CC3(CCOC3)C2)CC1	ZINC000819378592	FE	On-Demand	Anodyne	ITGAL	54	36
O=C(c1cc(S(=O)(=O)N2CCc3ccccc3C2)ccc1Cl)N1CC2(CCOC2)C1	ZINC000819378605	IF	On-Demand	Anodyne	AKR1C3	68	52
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378641	FE	On-Demand	Anodyne	FKBP1A	57	46
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378641	FE	On-Demand	Anodyne	CELA1	26	55
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378641	FE	On-Demand	Anodyne	CTRA_BOVIN	60	33
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378641	FE	On-Demand	Anodyne	CTSG	42	33
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378641	FE	On-Demand	Anodyne	CPT2	48	39
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378641	FE	On-Demand	Anodyne	PREP	116	67
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378641	FE	On-Demand	Anodyne	CELA2A	50	33
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378641	FE	On-Demand	Anodyne	LGMN	79	46
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378641	FE	On-Demand	Anodyne	KLK5	26	47
O=C([C@@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378641	FE	On-Demand	Anodyne	SLC12A5	67	42
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378642	FE	On-Demand	Anodyne	FKBP1A	57	46
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378642	FE	On-Demand	Anodyne	CELA1	26	55
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378642	FE	On-Demand	Anodyne	CTRA_BOVIN	60	33
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378642	FE	On-Demand	Anodyne	CTSG	42	33
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378642	FE	On-Demand	Anodyne	CPT2	48	39
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378642	FE	On-Demand	Anodyne	PREP	116	67
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378642	FE	On-Demand	Anodyne	CELA2A	50	33
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378642	FE	On-Demand	Anodyne	LGMN	79	46
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378642	FE	On-Demand	Anodyne	KLK5	26	47
O=C([C@H]1CCCCN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378642	FE	On-Demand	Anodyne	SLC12A5	67	42
Cn1cc(-c2cccc(C(=O)N3CC4(CCOC4)C3)c2)cn1	ZINC000819378656	CD	On-Demand	Anodyne	ACACA	19	40
O=C(c1cc(-c2ccccc2)nc2cc(Br)ccc12)N1CC2(CCOC2)C1	ZINC000819378663	HJ	On-Demand	Anodyne	PRS	68	45
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	GHRHR	61	37
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	CTRA_BOVIN	52	34
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	CASP3	17	44
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	KLK3	74	40
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	CTSB	61	44
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	PAPA1_CARPA	58	39
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	CYSP_TRYCR	63	42
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	CTSG	42	34
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	CTSK	45	42
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	CTSL	48	44
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	CAPNS1	71	42
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	CELA2A	50	34
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	LGMN	52	37
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	CTSS	22	42
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	GHSR	18	40
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	CAPN1	85	42
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	CASP1	23	41
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	CAPN2	134	44
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	TGM2	32	46
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	TPSAB1	41	35
NC(=O)C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819378683	FC	On-Demand	Anodyne	NPR	65	35
O=C(c1cccc(Nc2ncccn2)c1)N1CC2(CCOC2)C1	ZINC000819378695	DE	On-Demand	Anodyne	AKR1C3	15	40
O=C([C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl)N1CC2(CCOC2)C1	ZINC000819378703	HG	On-Demand	Anodyne	PREP	25	40
O=C([C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl)N1CC2(CCOC2)C1	ZINC000819378704	HG	On-Demand	Anodyne	PREP	25	40
O=C(CNc1cccc(C(F)(F)F)c1)N1CC2(CCOC2)C1	ZINC000819378706	DE	On-Demand	Anodyne	EPHX2	22	42
O=C(c1cc([N+](=O)[O-])ccc1N1CCOCC1)N1CC2(CCOC2)C1	ZINC000819378710	ED	On-Demand	Bother	SLC6A9	19	61
O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378721	FD	On-Demand	Anodyne	PREP	34	44
O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378721	FD	On-Demand	Anodyne	SLC12A5	42	35
O=C([C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)N1CC2(CCOC2)C1	ZINC000819378721	FD	On-Demand	Anodyne	Q9NAW4_PLAFA	30	48
C[C@@H](CC(=O)N1CC2(CCOC2)C1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819378727	FF	On-Demand	Anodyne	GPR119	25	41
C[C@@](O)(C(=O)N1CC2(CCOC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819378737	EE	On-Demand	Anodyne	CACNA1B	35	41
CCCCSCC(=O)N1CC2(CCOC2)C1	ZINC000819378744	BD	On-Demand	Anodyne	EST1_PIG	43	37
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CC4(CCOC4)C3)c2c1	ZINC000819378779	FI	On-Demand	Anodyne	PRS	43	35
Cc1ccc2nc(-c3ccccc3)cc(C(=O)N3CC4(CCOC4)C3)c2c1	ZINC000819378779	FI	On-Demand	Anodyne	MT-CO2	49	35
CC(C)(C)OC(=O)N1CCC(Cc2ccccc2C(=O)N2CC3(CCOC3)C2)CC1	ZINC000819378786	HH	On-Demand	Anodyne	GPR119	36	40
CCCCCCCC(=O)N1CC2(CCOC2)C1	ZINC000819378816	BF	On-Demand	Mild	CQSS	51	33
O=C(c1cc(-c2ccc(F)cc2)nc2ccccc12)N1CC2(CCOC2)C1	ZINC000819378827	FH	On-Demand	Anodyne	DHODH	30	44
O=C(c1cc(-c2ccc(F)cc2)nc2ccccc12)N1CC2(CCOC2)C1	ZINC000819378827	FH	On-Demand	Anodyne	PRS	41	43
O=C(c1cc(-c2ccc(F)cc2)nc2ccccc12)N1CC2(CCOC2)C1	ZINC000819378827	FH	On-Demand	Anodyne	TACR3	15	41
O=C(c1cc(-c2ccc(F)cc2)nc2ccccc12)N1CC2(CCOC2)C1	ZINC000819378827	FH	On-Demand	Anodyne	MT-CO2	48	40
O=C(OCc1ccccc1)N1CCC(C(=O)N2CC3(CCOC3)C2)CC1	ZINC000819378855	FE	On-Demand	Anodyne	GRIN2B	40	48
O=C(OCc1ccccc1)N1CCC(C(=O)N2CC3(CCOC3)C2)CC1	ZINC000819378855	FE	On-Demand	Anodyne	PREP	33	45
O=C(OCc1ccccc1)N1CCC(C(=O)N2CC3(CCOC3)C2)CC1	ZINC000819378855	FE	On-Demand	Anodyne	TGM2	33	44
O=C(OCc1ccccc1)N1CCC(C(=O)N2CC3(CCOC3)C2)CC1	ZINC000819378855	FE	On-Demand	Anodyne	F13A1	43	44
O=C(OCc1ccccc1)N1CCC(C(=O)N2CC3(CCOC3)C2)CC1	ZINC000819378855	FE	On-Demand	Anodyne	SLC12A5	60	42
O=C(c1cccc(NS(=O)(=O)C(F)(F)F)c1)N1CC2(CCOC2)C1	ZINC000819378858	FD	On-Demand	Anodyne	EPHX2	17	44
O=C(OCc1ccccc1)N1CC[C@@](F)(C(=O)N2CC3(CCOC3)C2)C1	ZINC000819378861	FD	On-Demand	Anodyne	SLC12A5	64	36
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)N2CC3(CCOC3)C2)C1	ZINC000819378862	FD	On-Demand	Anodyne	SLC12A5	64	36
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CC2(CCOC2)C1	ZINC000819378866	CF	On-Demand	Anodyne	HRH4	30	58
O=C(c1cc2cc(Cl)ccc2[nH]1)N1CC2(CCOC2)C1	ZINC000819378866	CF	On-Demand	Anodyne	PYGL	77	42
O=C(c1ccc(F)c(S(=O)(=O)NC2CC2)c1)N1CC2(CCOC2)C1	ZINC000819378881	FD	On-Demand	Anodyne	SFRP1	76	39
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOC2)C1)c1cccs1	ZINC000819378895	FE	On-Demand	Anodyne	GHRHR	73	35
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOC2)C1)c1cccs1	ZINC000819378895	FE	On-Demand	Anodyne	MC4R	27	43
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOC2)C1)c1cccs1	ZINC000819378895	FE	On-Demand	Anodyne	BLA1_STEMA	41	32
O=C(N[C@H](Cc1ccccc1)C(=O)N1CC2(CCOC2)C1)c1cccs1	ZINC000819378896	FE	On-Demand	Anodyne	GHRHR	73	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CC2(CCOC2)C1)c1cccs1	ZINC000819378896	FE	On-Demand	Anodyne	MC4R	27	43
O=C(N[C@H](Cc1ccccc1)C(=O)N1CC2(CCOC2)C1)c1cccs1	ZINC000819378896	FE	On-Demand	Anodyne	BLA1_STEMA	41	32
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CC2(CCOC2)C1	ZINC000819378897	ED	On-Demand	Anodyne	CPT2	46	38
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CC2(CCOC2)C1	ZINC000819378897	ED	On-Demand	Anodyne	PREP	93	61
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CC2(CCOC2)C1	ZINC000819378897	ED	On-Demand	Anodyne	SFRP1	39	41
O=C([C@@H]1CCCCN1C(=O)c1ccccc1)N1CC2(CCOC2)C1	ZINC000819378897	ED	On-Demand	Anodyne	WNT3	44	41
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CC2(CCOC2)C1	ZINC000819378898	ED	On-Demand	Anodyne	CPT2	46	38
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CC2(CCOC2)C1	ZINC000819378898	ED	On-Demand	Anodyne	PREP	93	61
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CC2(CCOC2)C1	ZINC000819378898	ED	On-Demand	Anodyne	SFRP1	39	41
O=C([C@H]1CCCCN1C(=O)c1ccccc1)N1CC2(CCOC2)C1	ZINC000819378898	ED	On-Demand	Anodyne	WNT3	44	41
O=C(N[C@@]1(C(=O)N2CC3(CCOC3)C2)CCOC1)OCc1ccccc1	ZINC000819378903	FD	On-Demand	Anodyne	CTSL	20	44
O=C(N[C@@]1(C(=O)N2CC3(CCOC3)C2)CCOC1)OCc1ccccc1	ZINC000819378903	FD	On-Demand	Anodyne	CAPNS1	49	33
O=C(N[C@@]1(C(=O)N2CC3(CCOC3)C2)CCOC1)OCc1ccccc1	ZINC000819378903	FD	On-Demand	Anodyne	CAPN2	47	35
O=C(N[C@@]1(C(=O)N2CC3(CCOC3)C2)CCOC1)OCc1ccccc1	ZINC000819378903	FD	On-Demand	Anodyne	NPR	53	32
O=C(N[C@@]1(C(=O)N2CC3(CCOC3)C2)CCOC1)OCc1ccccc1	ZINC000819378903	FD	On-Demand	Anodyne	SLC12A5	45	35
O=C(N[C@]1(C(=O)N2CC3(CCOC3)C2)CCOC1)OCc1ccccc1	ZINC000819378904	FD	On-Demand	Anodyne	CTSL	20	44
O=C(N[C@]1(C(=O)N2CC3(CCOC3)C2)CCOC1)OCc1ccccc1	ZINC000819378904	FD	On-Demand	Anodyne	CAPNS1	49	33
O=C(N[C@]1(C(=O)N2CC3(CCOC3)C2)CCOC1)OCc1ccccc1	ZINC000819378904	FD	On-Demand	Anodyne	CAPN2	47	35
O=C(N[C@]1(C(=O)N2CC3(CCOC3)C2)CCOC1)OCc1ccccc1	ZINC000819378904	FD	On-Demand	Anodyne	NPR	53	32
O=C(N[C@]1(C(=O)N2CC3(CCOC3)C2)CCOC1)OCc1ccccc1	ZINC000819378904	FD	On-Demand	Anodyne	SLC12A5	45	35
COc1ccc(N2CC[C@H](CNCCS(=O)(=O)c3ccc(C#N)cc3)C2)cc1	ZINC000819378943	GE	On-Demand	Mild	MMP13	40	38
COc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)n1	ZINC000819378968	FF	On-Demand	Mild	PAPA1_CARPA	48	46
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819378990	GG	On-Demand	Clean	ADRB2	28	53
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819378990	GG	On-Demand	Clean	ADRB1	34	54
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819378990	GG	On-Demand	Clean	HTR1A	19	53
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819378990	GG	On-Demand	Clean	SLC6A4	20	43
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819378990	GG	On-Demand	Clean	ADRB3	26	51
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819378991	GG	On-Demand	Clean	ADRB2	28	53
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819378991	GG	On-Demand	Clean	ADRB1	34	54
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819378991	GG	On-Demand	Clean	HTR1A	19	53
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819378991	GG	On-Demand	Clean	SLC6A4	20	43
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3cccc4[nH]ccc34)C2)cc1	ZINC000819378991	GG	On-Demand	Clean	ADRB3	26	51
COc1ccc(N2CC[C@H](CNCCS(=O)(=O)c3ccccc3)C2)cc1	ZINC000819379002	FF	On-Demand	Clean	MMP13	57	39
COc1ccc(N2CC[C@H](CNCCS(=O)(=O)c3ccccc3)C2)cc1	ZINC000819379002	FF	On-Demand	Clean	MMP3	52	39
COc1ccc(N2CC[C@H](CNCCS(=O)(=O)c3ccccc3)C2)cc1	ZINC000819379002	FF	On-Demand	Clean	MMP9	44	39
COc1ccc(N2CC[C@H](CNCCS(=O)(=O)c3ccccc3)C2)cc1	ZINC000819379002	FF	On-Demand	Clean	MMP7	40	39
COc1ccc(N2CC[C@H](CNCCS(=O)(=O)c3ccccc3)C2)cc1	ZINC000819379002	FF	On-Demand	Clean	MMP1	50	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCO[C@@H](c2ccsc2)C1	ZINC000819379058	FF	On-Demand	Anodyne	NPBWR1	86	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCO[C@H](c2ccsc2)C1	ZINC000819379060	FF	On-Demand	Anodyne	NPBWR1	86	34
COCCOc1ccccc1N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819379098	EF	On-Demand	Anodyne	HTR1A	77	41
COCCOc1ccccc1N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819379098	EF	On-Demand	Anodyne	DRD2	62	41
COCCOc1ccccc1N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819379098	EF	On-Demand	Anodyne	DRD4	31	41
COCCOc1ccccc1N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819379098	EF	On-Demand	Anodyne	ADRA1D	47	40
COCCOc1ccccc1N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819379098	EF	On-Demand	Anodyne	ADRA1A	47	40
COCCOc1ccccc1N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819379098	EF	On-Demand	Anodyne	DRD3	66	41
COCCOc1ccccc1N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819379098	EF	On-Demand	Anodyne	HTR7	51	38
COCCOc1ccccc1N1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819379098	EF	On-Demand	Anodyne	KCNQ2	41	32
COc1ccc(N2CC[C@H](CNCCS(=O)(=O)c3ccc(F)cc3)C2)cc1	ZINC000819379123	GF	On-Demand	Clean	MMP13	48	39
COc1ccc(N2CC[C@H](CNCCS(=O)(=O)c3ccc(F)cc3)C2)cc1	ZINC000819379123	GF	On-Demand	Clean	MMP3	45	37
COc1ccc(N2CC[C@H](CNCCS(=O)(=O)c3ccc(F)cc3)C2)cc1	ZINC000819379123	GF	On-Demand	Clean	MMP7	41	37
COc1ccc(N2CC[C@H](CNCCS(=O)(=O)c3ccc(F)cc3)C2)cc1	ZINC000819379123	GF	On-Demand	Clean	MMP1	44	39
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000819379143	FH	On-Demand	Anodyne	HRH1	39	45
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000819379143	FH	On-Demand	Anodyne	CCR3	43	46
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000819379144	FH	On-Demand	Anodyne	HRH1	39	45
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000819379144	FH	On-Demand	Anodyne	CCR3	43	46
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000819379145	FH	On-Demand	Anodyne	HRH1	39	45
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000819379145	FH	On-Demand	Anodyne	CCR3	43	46
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000819379146	FH	On-Demand	Anodyne	HRH1	39	45
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000819379146	FH	On-Demand	Anodyne	CCR3	43	46
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3cc(C)cc(C)c3)C2)cc1	ZINC000819379191	GG	On-Demand	Clean	ADRB2	36	43
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3cc(C)cc(C)c3)C2)cc1	ZINC000819379191	GG	On-Demand	Clean	ADRB1	43	38
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3cc(C)cc(C)c3)C2)cc1	ZINC000819379191	GG	On-Demand	Clean	ADRB3	34	43
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3cc(C)cc(C)c3)C2)cc1	ZINC000819379194	GG	On-Demand	Clean	ADRB2	36	43
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3cc(C)cc(C)c3)C2)cc1	ZINC000819379194	GG	On-Demand	Clean	ADRB1	43	38
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3cc(C)cc(C)c3)C2)cc1	ZINC000819379194	GG	On-Demand	Clean	ADRB3	34	43
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(F)c1	ZINC000819379248	GG	On-Demand	Mild	PAPA1_CARPA	52	53
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(F)c1	ZINC000819379248	GG	On-Demand	Mild	CTSK	16	46
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(F)c1	ZINC000819379248	GG	On-Demand	Mild	CTSL	26	53
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(F)c1	ZINC000819379248	GG	On-Demand	Mild	CTSS	21	53
COc1ccc(N2CC[C@H](CNC[C@H](C)S(C)(=O)=O)C2)cc1	ZINC000819379292	ED	On-Demand	Clean	MMP13	42	37
COc1ccc(N2CC[C@H](CNC[C@H](C)S(C)(=O)=O)C2)cc1	ZINC000819379292	ED	On-Demand	Clean	MMP3	40	36
COc1ccc(N2CC[C@H](CNC[C@@H](C)S(C)(=O)=O)C2)cc1	ZINC000819379294	ED	On-Demand	Clean	MMP13	42	37
COc1ccc(N2CC[C@H](CNC[C@@H](C)S(C)(=O)=O)C2)cc1	ZINC000819379294	ED	On-Demand	Clean	MMP3	40	36
COc1ccc(N2CC[C@H](CNC[C@@H](O)c3ccc(F)cc3)C2)cc1	ZINC000819379315	EF	On-Demand	Clean	SLC6A3	21	42
COc1ccc(N2CC[C@H](CNC[C@H](O)c3ccc(F)cc3)C2)cc1	ZINC000819379318	EF	On-Demand	Clean	SLC6A3	21	42
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3c(C)cccc3C)C2)cc1	ZINC000819379353	GG	On-Demand	Clean	ADRB3	26	43
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3c(C)cccc3C)C2)cc1	ZINC000819379356	GG	On-Demand	Clean	ADRB3	26	43
COc1ccc(N2CC[C@H](CNC[C@@H](O)c3ccccc3)C2)cc1	ZINC000819379372	EF	On-Demand	Clean	ADRB2	15	42
COc1ccc(N2CC[C@H](CNC[C@@H](O)c3ccccc3)C2)cc1	ZINC000819379372	EF	On-Demand	Clean	ADRB1	17	41
COc1ccc(N2CC[C@H](CNC[C@@H](O)c3ccccc3)C2)cc1	ZINC000819379372	EF	On-Demand	Clean	SLC6A3	17	43
COc1ccc(N2CC[C@H](CNC[C@@H](O)c3ccccc3)C2)cc1	ZINC000819379372	EF	On-Demand	Clean	ADRB3	29	41
COc1ccc(N2CC[C@H](CNC[C@H](O)c3ccccc3)C2)cc1	ZINC000819379373	EF	On-Demand	Clean	ADRB2	15	42
COc1ccc(N2CC[C@H](CNC[C@H](O)c3ccccc3)C2)cc1	ZINC000819379373	EF	On-Demand	Clean	ADRB1	17	41
COc1ccc(N2CC[C@H](CNC[C@H](O)c3ccccc3)C2)cc1	ZINC000819379373	EF	On-Demand	Clean	SLC6A3	17	43
COc1ccc(N2CC[C@H](CNC[C@H](O)c3ccccc3)C2)cc1	ZINC000819379373	EF	On-Demand	Clean	ADRB3	29	41
COc1ccc(N2CC[C@H](CNCCC(=O)Nc3cccc(Cl)c3)C2)cc1	ZINC000819379382	GH	On-Demand	Clean	DRD4	43	37
COc1ccc(N2CC[C@H](CNCCC(=O)Nc3cccc(Cl)c3)C2)cc1	ZINC000819379382	GH	On-Demand	Clean	MTNR1B	15	41
COc1ccc(N2CC[C@H](CNCCC(=O)Nc3cccc(Cl)c3)C2)cc1	ZINC000819379382	GH	On-Demand	Clean	MCHR1	34	55
COc1ccc(N2CC[C@H](CNC[C@@H](O)c3cccc(Cl)c3)C2)cc1	ZINC000819379407	FG	On-Demand	Clean	ADRB2	23	45
COc1ccc(N2CC[C@H](CNC[C@@H](O)c3cccc(Cl)c3)C2)cc1	ZINC000819379407	FG	On-Demand	Clean	ADRB1	40	44
COc1ccc(N2CC[C@H](CNC[C@@H](O)c3cccc(Cl)c3)C2)cc1	ZINC000819379407	FG	On-Demand	Clean	ADRB3	60	44
COc1ccc(N2CC[C@H](CNC[C@@H](O)c3cccc(Cl)c3)C2)cc1	ZINC000819379407	FG	On-Demand	Clean	IGF1R	29	41
COc1ccc(N2CC[C@H](CNC[C@@H](O)c3cccc(Cl)c3)C2)cc1	ZINC000819379407	FG	On-Demand	Clean	CYP3A4	52	40
COc1ccc(N2CC[C@H](CNC[C@H](O)c3cccc(Cl)c3)C2)cc1	ZINC000819379409	FG	On-Demand	Clean	ADRB2	23	45
COc1ccc(N2CC[C@H](CNC[C@H](O)c3cccc(Cl)c3)C2)cc1	ZINC000819379409	FG	On-Demand	Clean	ADRB1	40	44
COc1ccc(N2CC[C@H](CNC[C@H](O)c3cccc(Cl)c3)C2)cc1	ZINC000819379409	FG	On-Demand	Clean	ADRB3	60	44
COc1ccc(N2CC[C@H](CNC[C@H](O)c3cccc(Cl)c3)C2)cc1	ZINC000819379409	FG	On-Demand	Clean	IGF1R	29	41
COc1ccc(N2CC[C@H](CNC[C@H](O)c3cccc(Cl)c3)C2)cc1	ZINC000819379409	FG	On-Demand	Clean	CYP3A4	52	40
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000819379506	ED	On-Demand	Anodyne	L3MBTL3	80	43
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000819379508	ED	On-Demand	Anodyne	L3MBTL3	80	43
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000819379510	ED	On-Demand	Anodyne	L3MBTL3	80	43
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000819379512	ED	On-Demand	Anodyne	L3MBTL3	80	43
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccccc3C(C)C)C2)cc1	ZINC000819379567	GH	On-Demand	Clean	ADRB2	43	52
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccccc3C(C)C)C2)cc1	ZINC000819379567	GH	On-Demand	Clean	ADRB1	45	52
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccccc3C(C)C)C2)cc1	ZINC000819379567	GH	On-Demand	Clean	ADRB3	32	48
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccccc3C(C)C)C2)cc1	ZINC000819379567	GH	On-Demand	Clean	ABCB1	42	41
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccccc3C(C)C)C2)cc1	ZINC000819379572	GH	On-Demand	Clean	ADRB2	43	52
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccccc3C(C)C)C2)cc1	ZINC000819379572	GH	On-Demand	Clean	ADRB1	45	52
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccccc3C(C)C)C2)cc1	ZINC000819379572	GH	On-Demand	Clean	ADRB3	32	48
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccccc3C(C)C)C2)cc1	ZINC000819379572	GH	On-Demand	Clean	ABCB1	42	41
COc1cccc(C2(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC2)c1	ZINC000819379632	GG	On-Demand	Mild	PAPA1_CARPA	41	43
COc1cccc(C2(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC2)c1	ZINC000819379632	GG	On-Demand	Mild	CTSS	15	45
COc1cccc(C2(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC2)c1	ZINC000819379633	GG	On-Demand	Mild	PAPA1_CARPA	41	43
COc1cccc(C2(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC2)c1	ZINC000819379633	GG	On-Demand	Mild	CTSS	15	45
COCCOc1ccccc1N1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819379652	FE	On-Demand	Anodyne	HTR1A	65	39
COCCOc1ccccc1N1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819379652	FE	On-Demand	Anodyne	DRD2	50	39
COCCOc1ccccc1N1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819379652	FE	On-Demand	Anodyne	ADRA1D	42	37
COCCOc1ccccc1N1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819379652	FE	On-Demand	Anodyne	DRD3	55	39
COCCOc1ccccc1N1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819379652	FE	On-Demand	Anodyne	ITGAL	46	35
COCCOc1ccccc1N1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819379652	FE	On-Demand	Anodyne	HTR7	44	36
COCCOc1ccccc1N1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819379653	FE	On-Demand	Anodyne	HTR1A	65	39
COCCOc1ccccc1N1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819379653	FE	On-Demand	Anodyne	DRD2	50	39
COCCOc1ccccc1N1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819379653	FE	On-Demand	Anodyne	ADRA1D	42	37
COCCOc1ccccc1N1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819379653	FE	On-Demand	Anodyne	DRD3	55	39
COCCOc1ccccc1N1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819379653	FE	On-Demand	Anodyne	ITGAL	46	35
COCCOc1ccccc1N1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819379653	FE	On-Demand	Anodyne	HTR7	44	36
COCCOc1ccccc1N1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819379654	FE	On-Demand	Anodyne	HTR1A	65	39
COCCOc1ccccc1N1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819379654	FE	On-Demand	Anodyne	DRD2	50	39
COCCOc1ccccc1N1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819379654	FE	On-Demand	Anodyne	ADRA1D	42	37
COCCOc1ccccc1N1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819379654	FE	On-Demand	Anodyne	DRD3	55	39
COCCOc1ccccc1N1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819379654	FE	On-Demand	Anodyne	ITGAL	46	35
COCCOc1ccccc1N1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819379654	FE	On-Demand	Anodyne	HTR7	44	36
COCCOc1ccccc1N1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819379655	FE	On-Demand	Anodyne	HTR1A	65	39
COCCOc1ccccc1N1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819379655	FE	On-Demand	Anodyne	DRD2	50	39
COCCOc1ccccc1N1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819379655	FE	On-Demand	Anodyne	ADRA1D	42	37
COCCOc1ccccc1N1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819379655	FE	On-Demand	Anodyne	DRD3	55	39
COCCOc1ccccc1N1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819379655	FE	On-Demand	Anodyne	ITGAL	46	35
COCCOc1ccccc1N1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819379655	FE	On-Demand	Anodyne	HTR7	44	36
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3cccc(C)c3)C2)cc1	ZINC000819379761	FF	On-Demand	Clean	ADRB2	39	47
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3cccc(C)c3)C2)cc1	ZINC000819379761	FF	On-Demand	Clean	ADRB1	47	47
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3cccc(C)c3)C2)cc1	ZINC000819379761	FF	On-Demand	Clean	ADRB3	38	41
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3cccc(C)c3)C2)cc1	ZINC000819379764	FF	On-Demand	Clean	ADRB2	39	47
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3cccc(C)c3)C2)cc1	ZINC000819379764	FF	On-Demand	Clean	ADRB1	47	47
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3cccc(C)c3)C2)cc1	ZINC000819379764	FF	On-Demand	Clean	ADRB3	38	41
O=C(O)C[C@H]1CCCN(CCP(=O)(c2ccccc2)c2ccccc2)C1	ZINC000819379777	FG	On-Demand	Reactive	SLC6A1	144	39
O=C(O)C[C@@H]1CCCN(CCP(=O)(c2ccccc2)c2ccccc2)C1	ZINC000819379782	FG	On-Demand	Reactive	SLC6A1	144	39
O=C(O)C[C@H]1CCCN(Cc2cc(=O)c(O)co2)C1	ZINC000819379788	CD	On-Demand	Anodyne	PPO2	15	44
O=C(O)C[C@@H]1CCCN(Cc2cc(=O)c(O)co2)C1	ZINC000819379790	CD	On-Demand	Anodyne	PPO2	15	44
O=C(O)C[C@H]1CCCN(CCn2cnc3ccccc3c2=O)C1	ZINC000819379795	DD	On-Demand	Anodyne	HTR1A	16	53
O=C(O)C[C@H]1CCCN(CCn2cnc3ccccc3c2=O)C1	ZINC000819379795	DD	On-Demand	Anodyne	SLC6A1	103	36
O=C(O)C[C@H]1CCCN(CCn2cnc3ccccc3c2=O)C1	ZINC000819379795	DD	On-Demand	Anodyne	HTR7	20	53
O=C(O)C[C@H]1CCCN(CCn2cnc3ccccc3c2=O)C1	ZINC000819379795	DD	On-Demand	Anodyne	HNMT	50	34
O=C(O)C[C@H]1CCCN(CCn2cnc3ccccc3c2=O)C1	ZINC000819379795	DD	On-Demand	Anodyne	Q8MHZ5_SHEEP	47	36
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccccc3C)C2)cc1	ZINC000819379796	FF	On-Demand	Clean	ADRB2	45	49
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccccc3C)C2)cc1	ZINC000819379796	FF	On-Demand	Clean	ADRB1	48	44
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccccc3C)C2)cc1	ZINC000819379796	FF	On-Demand	Clean	ADRB3	34	46
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccccc3C)C2)cc1	ZINC000819379796	FF	On-Demand	Clean	ABCB1	57	42
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccccc3C)C2)cc1	ZINC000819379797	FF	On-Demand	Clean	ADRB2	45	49
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccccc3C)C2)cc1	ZINC000819379797	FF	On-Demand	Clean	ADRB1	48	44
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccccc3C)C2)cc1	ZINC000819379797	FF	On-Demand	Clean	ADRB3	34	46
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccccc3C)C2)cc1	ZINC000819379797	FF	On-Demand	Clean	ABCB1	57	42
O=C(O)C[C@@H]1CCCN(CCn2cnc3ccccc3c2=O)C1	ZINC000819379798	DD	On-Demand	Anodyne	HTR1A	16	53
O=C(O)C[C@@H]1CCCN(CCn2cnc3ccccc3c2=O)C1	ZINC000819379798	DD	On-Demand	Anodyne	SLC6A1	103	36
O=C(O)C[C@@H]1CCCN(CCn2cnc3ccccc3c2=O)C1	ZINC000819379798	DD	On-Demand	Anodyne	HTR7	20	53
O=C(O)C[C@@H]1CCCN(CCn2cnc3ccccc3c2=O)C1	ZINC000819379798	DD	On-Demand	Anodyne	HNMT	50	34
O=C(O)C[C@@H]1CCCN(CCn2cnc3ccccc3c2=O)C1	ZINC000819379798	DD	On-Demand	Anodyne	Q8MHZ5_SHEEP	47	36
O=C(O)C[C@@H]1CCCN(CN2C(=O)C(=O)c3cccc(F)c32)C1	ZINC000819379800	DD	On-Demand	Anodyne	SLC6A1	61	35
O=C(O)C[C@H]1CCCN(CN2C(=O)C(=O)c3cccc(F)c32)C1	ZINC000819379801	DD	On-Demand	Anodyne	SLC6A1	61	35
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819379807	FE	On-Demand	Anodyne	ACOX1	47	35
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819379807	FE	On-Demand	Anodyne	ABCB1	67	46
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc(Br)c2)C1	ZINC000819379809	FE	On-Demand	Anodyne	ACOX1	47	35
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc(Br)c2)C1	ZINC000819379809	FE	On-Demand	Anodyne	ABCB1	67	46
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc(Br)c2)C1	ZINC000819379810	FE	On-Demand	Anodyne	ACOX1	47	35
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc(Br)c2)C1	ZINC000819379810	FE	On-Demand	Anodyne	ABCB1	67	46
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819379811	FE	On-Demand	Anodyne	ACOX1	47	35
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc(Br)c2)C1	ZINC000819379811	FE	On-Demand	Anodyne	ABCB1	67	46
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccccc2F)C1	ZINC000819379817	DD	On-Demand	Anodyne	ADRB2	21	45
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccccc2F)C1	ZINC000819379817	DD	On-Demand	Anodyne	ADRB1	21	45
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccccc2F)C1	ZINC000819379817	DD	On-Demand	Anodyne	SLC6A1	78	36
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccccc2F)C1	ZINC000819379817	DD	On-Demand	Anodyne	ABCB1	90	48
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccccc2F)C1	ZINC000819379818	DD	On-Demand	Anodyne	ADRB2	21	45
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccccc2F)C1	ZINC000819379818	DD	On-Demand	Anodyne	ADRB1	21	45
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccccc2F)C1	ZINC000819379818	DD	On-Demand	Anodyne	SLC6A1	78	36
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccccc2F)C1	ZINC000819379818	DD	On-Demand	Anodyne	ABCB1	90	48
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccccc2F)C1	ZINC000819379820	DD	On-Demand	Anodyne	ADRB2	21	45
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccccc2F)C1	ZINC000819379820	DD	On-Demand	Anodyne	ADRB1	21	45
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccccc2F)C1	ZINC000819379820	DD	On-Demand	Anodyne	SLC6A1	78	36
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccccc2F)C1	ZINC000819379820	DD	On-Demand	Anodyne	ABCB1	90	48
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccccc2F)C1	ZINC000819379821	DD	On-Demand	Anodyne	ADRB2	21	45
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccccc2F)C1	ZINC000819379821	DD	On-Demand	Anodyne	ADRB1	21	45
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccccc2F)C1	ZINC000819379821	DD	On-Demand	Anodyne	SLC6A1	78	36
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccccc2F)C1	ZINC000819379821	DD	On-Demand	Anodyne	ABCB1	90	48
O=C(O)C[C@@H]1CCCN(Cc2csc(CC(=O)Nc3ccccc3)n2)C1	ZINC000819379827	FG	On-Demand	Anodyne	CCR3	23	40
O=C(O)C[C@H]1CCCN(Cc2csc(CC(=O)Nc3ccccc3)n2)C1	ZINC000819379829	FG	On-Demand	Anodyne	CCR3	23	40
O=C(O)C[C@H]1CCCN(Cc2nnnn2-c2ccccc2Br)C1	ZINC000819379831	GE	On-Demand	Anodyne	SLC6A1	60	39
O=C(O)C[C@@H]1CCCN(Cc2nnnn2-c2ccccc2Br)C1	ZINC000819379833	GE	On-Demand	Anodyne	SLC6A1	60	39
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccccc2Cl)C1	ZINC000819379834	EE	On-Demand	Anodyne	ADRB2	21	44
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccccc2Cl)C1	ZINC000819379834	EE	On-Demand	Anodyne	ADRB1	19	44
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccccc2Cl)C1	ZINC000819379834	EE	On-Demand	Anodyne	SLC6A1	84	37
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccccc2Cl)C1	ZINC000819379834	EE	On-Demand	Anodyne	CCR3	15	45
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccccc2Cl)C1	ZINC000819379834	EE	On-Demand	Anodyne	ABCB1	92	48
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccccc2Cl)C1	ZINC000819379835	EE	On-Demand	Anodyne	ADRB2	21	44
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccccc2Cl)C1	ZINC000819379835	EE	On-Demand	Anodyne	ADRB1	19	44
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccccc2Cl)C1	ZINC000819379835	EE	On-Demand	Anodyne	SLC6A1	84	37
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccccc2Cl)C1	ZINC000819379835	EE	On-Demand	Anodyne	CCR3	15	45
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccccc2Cl)C1	ZINC000819379835	EE	On-Demand	Anodyne	ABCB1	92	48
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccccc2Cl)C1	ZINC000819379836	EE	On-Demand	Anodyne	ADRB2	21	44
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccccc2Cl)C1	ZINC000819379836	EE	On-Demand	Anodyne	ADRB1	19	44
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccccc2Cl)C1	ZINC000819379836	EE	On-Demand	Anodyne	SLC6A1	84	37
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccccc2Cl)C1	ZINC000819379836	EE	On-Demand	Anodyne	CCR3	15	45
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccccc2Cl)C1	ZINC000819379836	EE	On-Demand	Anodyne	ABCB1	92	48
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccccc2Cl)C1	ZINC000819379838	EE	On-Demand	Anodyne	ADRB2	21	44
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccccc2Cl)C1	ZINC000819379838	EE	On-Demand	Anodyne	ADRB1	19	44
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccccc2Cl)C1	ZINC000819379838	EE	On-Demand	Anodyne	SLC6A1	84	37
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccccc2Cl)C1	ZINC000819379838	EE	On-Demand	Anodyne	CCR3	15	45
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccccc2Cl)C1	ZINC000819379838	EE	On-Demand	Anodyne	ABCB1	92	48
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3cccc(C(C)=O)c3)C2)cc1	ZINC000819379841	GF	On-Demand	Clean	ADRB2	32	42
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3cccc(C(C)=O)c3)C2)cc1	ZINC000819379841	GF	On-Demand	Clean	ADRB1	52	41
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3cccc(C(C)=O)c3)C2)cc1	ZINC000819379841	GF	On-Demand	Clean	DRD4	45	37
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3cccc(C(C)=O)c3)C2)cc1	ZINC000819379841	GF	On-Demand	Clean	ADRB3	40	41
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3cccc(C(C)=O)c3)C2)cc1	ZINC000819379841	GF	On-Demand	Clean	ABCB1	36	47
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3cccc(C(C)=O)c3)C2)cc1	ZINC000819379847	GF	On-Demand	Clean	ADRB2	32	42
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3cccc(C(C)=O)c3)C2)cc1	ZINC000819379847	GF	On-Demand	Clean	ADRB1	52	41
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3cccc(C(C)=O)c3)C2)cc1	ZINC000819379847	GF	On-Demand	Clean	DRD4	45	37
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3cccc(C(C)=O)c3)C2)cc1	ZINC000819379847	GF	On-Demand	Clean	ADRB3	40	41
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3cccc(C(C)=O)c3)C2)cc1	ZINC000819379847	GF	On-Demand	Clean	ABCB1	36	47
O=C(O)C[C@H]1CCCN(CN2C(=O)CN(c3ccccc3)C2=O)C1	ZINC000819379861	ED	On-Demand	Anodyne	SLC6A1	45	34
O=C(O)C[C@@H]1CCCN(CN2C(=O)CN(c3ccccc3)C2=O)C1	ZINC000819379863	ED	On-Demand	Anodyne	SLC6A1	45	34
O[C@@H](CNC[C@@H]1C[C@H]1C1CCC1)c1cccnc1	ZINC000819379865	BE	On-Demand	Anodyne	ADRB1	22	43
O[C@@H](CNC[C@@H]1C[C@H]1C1CCC1)c1cccnc1	ZINC000819379865	BE	On-Demand	Anodyne	ADRB3	88	45
O[C@H](CNC[C@@H]1C[C@H]1C1CCC1)c1cccnc1	ZINC000819379867	BE	On-Demand	Anodyne	ADRB1	22	43
O[C@H](CNC[C@@H]1C[C@H]1C1CCC1)c1cccnc1	ZINC000819379867	BE	On-Demand	Anodyne	ADRB3	88	45
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2cccc(F)c2)C1	ZINC000819379872	CE	On-Demand	Anodyne	SLC6A1	65	47
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2cccc(F)c2)C1	ZINC000819379872	CE	On-Demand	Anodyne	CCR3	61	36
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2cccc(F)c2)C1	ZINC000819379872	CE	On-Demand	Anodyne	CCR5	40	37
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2cccc(F)c2)C1	ZINC000819379873	CE	On-Demand	Anodyne	SLC6A1	65	47
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2cccc(F)c2)C1	ZINC000819379873	CE	On-Demand	Anodyne	CCR3	61	36
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2cccc(F)c2)C1	ZINC000819379873	CE	On-Demand	Anodyne	CCR5	40	37
O=C(O)C[C@H]1CCCN(C[C@H](O)c2cccc(F)c2)C1	ZINC000819379874	CE	On-Demand	Anodyne	SLC6A1	65	47
O=C(O)C[C@H]1CCCN(C[C@H](O)c2cccc(F)c2)C1	ZINC000819379874	CE	On-Demand	Anodyne	CCR3	61	36
O=C(O)C[C@H]1CCCN(C[C@H](O)c2cccc(F)c2)C1	ZINC000819379874	CE	On-Demand	Anodyne	CCR5	40	37
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2cccc(F)c2)C1	ZINC000819379875	CE	On-Demand	Anodyne	SLC6A1	65	47
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2cccc(F)c2)C1	ZINC000819379875	CE	On-Demand	Anodyne	CCR3	61	36
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2cccc(F)c2)C1	ZINC000819379875	CE	On-Demand	Anodyne	CCR5	40	37
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819379876	EE	On-Demand	Anodyne	ADRB1	31	41
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819379876	EE	On-Demand	Anodyne	ACOX1	52	31
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819379876	EE	On-Demand	Anodyne	EBP	19	45
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819379876	EE	On-Demand	Anodyne	ABCB1	63	44
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819379877	EE	On-Demand	Anodyne	ADRB1	31	41
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819379877	EE	On-Demand	Anodyne	ACOX1	52	31
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819379877	EE	On-Demand	Anodyne	EBP	19	45
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819379877	EE	On-Demand	Anodyne	ABCB1	63	44
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819379878	EE	On-Demand	Anodyne	ADRB1	31	41
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819379878	EE	On-Demand	Anodyne	ACOX1	52	31
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819379878	EE	On-Demand	Anodyne	EBP	19	45
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc(Cl)cc2)C1	ZINC000819379878	EE	On-Demand	Anodyne	ABCB1	63	44
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819379879	EE	On-Demand	Anodyne	ADRB1	31	41
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819379879	EE	On-Demand	Anodyne	ACOX1	52	31
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819379879	EE	On-Demand	Anodyne	EBP	19	45
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc(Cl)cc2)C1	ZINC000819379879	EE	On-Demand	Anodyne	ABCB1	63	44
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2c(F)cccc2F)C1	ZINC000819379880	CE	On-Demand	Anodyne	SLC6A1	67	37
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2c(F)cccc2F)C1	ZINC000819379881	CE	On-Demand	Anodyne	SLC6A1	67	37
O=C(O)C[C@H]1CCCN(C[C@H](O)c2c(F)cccc2F)C1	ZINC000819379882	CE	On-Demand	Anodyne	SLC6A1	67	37
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2c(F)cccc2F)C1	ZINC000819379883	CE	On-Demand	Anodyne	SLC6A1	67	37
O=C(O)C[C@H]1CCCN(Cc2cnc3ccccn23)C1	ZINC000819379886	CE	On-Demand	Anodyne	SLC6A1	49	33
O=C(O)C[C@@H]1CCCN(Cc2cnc3ccccn23)C1	ZINC000819379887	CE	On-Demand	Anodyne	SLC6A1	49	33
O=C(O)C[C@@H]1CCCN(CN2C(=O)c3ccc(F)cc3C2=O)C1	ZINC000819379890	DD	On-Demand	Anodyne	SLC6A1	47	39
O=C(O)C[C@@H]1CCCN(CN2C(=O)c3ccc(F)cc3C2=O)C1	ZINC000819379890	DD	On-Demand	Anodyne	CCR3	65	35
O=C(O)C[C@H]1CCCN(CN2C(=O)c3ccc(F)cc3C2=O)C1	ZINC000819379891	DD	On-Demand	Anodyne	SLC6A1	47	39
O=C(O)C[C@H]1CCCN(CN2C(=O)c3ccc(F)cc3C2=O)C1	ZINC000819379891	DD	On-Demand	Anodyne	CCR3	65	35
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819379900	EF	On-Demand	Anodyne	ADRB2	18	44
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819379900	EF	On-Demand	Anodyne	ADRB1	29	40
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819379900	EF	On-Demand	Anodyne	ACOX1	81	41
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819379900	EF	On-Demand	Anodyne	ABCB1	77	45
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819379901	EF	On-Demand	Anodyne	ADRB2	18	44
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819379901	EF	On-Demand	Anodyne	ADRB1	29	40
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819379901	EF	On-Demand	Anodyne	ACOX1	81	41
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc3ccccc3c2)C1	ZINC000819379901	EF	On-Demand	Anodyne	ABCB1	77	45
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819379902	EF	On-Demand	Anodyne	ADRB2	18	44
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819379902	EF	On-Demand	Anodyne	ADRB1	29	40
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819379902	EF	On-Demand	Anodyne	ACOX1	81	41
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819379902	EF	On-Demand	Anodyne	ABCB1	77	45
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819379903	EF	On-Demand	Anodyne	ADRB2	18	44
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819379903	EF	On-Demand	Anodyne	ADRB1	29	40
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819379903	EF	On-Demand	Anodyne	ACOX1	81	41
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc3ccccc3c2)C1	ZINC000819379903	EF	On-Demand	Anodyne	ABCB1	77	45
O=C(O)C[C@@H]1CCCN(CCN2c3cccc4cccc(c34)S2(=O)=O)C1	ZINC000819379904	FF	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)C[C@H]1CCCN(CCN2c3cccc4cccc(c34)S2(=O)=O)C1	ZINC000819379905	FF	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COCc2ccccc2F)C1	ZINC000819379908	ED	On-Demand	Anodyne	SLC6A1	70	38
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COCc2ccccc2F)C1	ZINC000819379908	ED	On-Demand	Anodyne	ABCB1	48	37
O=C(O)C[C@H]1CCCN(C[C@H](O)COCc2ccccc2F)C1	ZINC000819379909	ED	On-Demand	Anodyne	SLC6A1	70	38
O=C(O)C[C@H]1CCCN(C[C@H](O)COCc2ccccc2F)C1	ZINC000819379909	ED	On-Demand	Anodyne	ABCB1	48	37
O=C(O)C[C@H]1CCCN(C[C@@H](O)COCc2ccccc2F)C1	ZINC000819379910	ED	On-Demand	Anodyne	SLC6A1	70	38
O=C(O)C[C@H]1CCCN(C[C@@H](O)COCc2ccccc2F)C1	ZINC000819379910	ED	On-Demand	Anodyne	ABCB1	48	37
O=C(O)C[C@@H]1CCCN(C[C@H](O)COCc2ccccc2F)C1	ZINC000819379911	ED	On-Demand	Anodyne	SLC6A1	70	38
O=C(O)C[C@@H]1CCCN(C[C@H](O)COCc2ccccc2F)C1	ZINC000819379911	ED	On-Demand	Anodyne	ABCB1	48	37
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819379912	EE	On-Demand	Anodyne	ADRB2	18	55
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819379912	EE	On-Demand	Anodyne	ADRB1	19	48
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819379912	EE	On-Demand	Anodyne	HTR1A	19	55
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819379912	EE	On-Demand	Anodyne	SLC6A4	21	46
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819379912	EE	On-Demand	Anodyne	ABCB1	72	41
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819379913	EE	On-Demand	Anodyne	ADRB2	18	55
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819379913	EE	On-Demand	Anodyne	ADRB1	19	48
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819379913	EE	On-Demand	Anodyne	HTR1A	19	55
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819379913	EE	On-Demand	Anodyne	SLC6A4	21	46
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819379913	EE	On-Demand	Anodyne	ABCB1	72	41
COc1ccc(N2CC[C@H](CNC[C@@H](O)Cc3ccccc3)C2)cc1	ZINC000819379990	EF	On-Demand	Clean	GRIN2B	15	41
COc1ccc(N2CC[C@H](CNC[C@@H](O)Cc3ccccc3)C2)cc1	ZINC000819379990	EF	On-Demand	Clean	ADRB3	19	40
COc1ccc(N2CC[C@H](CNC[C@@H](O)Cc3ccccc3)C2)cc1	ZINC000819379990	EF	On-Demand	Clean	SIGMAR1	17	45
COc1ccc(N2CC[C@H](CNC[C@H](O)Cc3ccccc3)C2)cc1	ZINC000819379992	EF	On-Demand	Clean	GRIN2B	15	41
COc1ccc(N2CC[C@H](CNC[C@H](O)Cc3ccccc3)C2)cc1	ZINC000819379992	EF	On-Demand	Clean	ADRB3	19	40
COc1ccc(N2CC[C@H](CNC[C@H](O)Cc3ccccc3)C2)cc1	ZINC000819379992	EF	On-Demand	Clean	SIGMAR1	17	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(OCCF)c1)C2	ZINC000819380006	FF	On-Demand	Anodyne	EPHX2	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(OCCF)c1)C2	ZINC000819380008	FF	On-Demand	Anodyne	EPHX2	21	40
COc1ccc(N2CC[C@H](CNC[C@H](O)COCc3cccs3)C2)cc1	ZINC000819380011	GF	On-Demand	Clean	ADRB3	16	41
COc1ccc(N2CC[C@H](CNC[C@@H](O)COCc3cccs3)C2)cc1	ZINC000819380015	GF	On-Demand	Clean	ADRB3	16	41
COc1ccc(N2CC[C@H](CNC[C@H](O)c3cccnc3)C2)cc1	ZINC000819380033	EE	On-Demand	Clean	ADRB2	26	42
COc1ccc(N2CC[C@H](CNC[C@H](O)c3cccnc3)C2)cc1	ZINC000819380033	EE	On-Demand	Clean	ADRB1	27	42
COc1ccc(N2CC[C@H](CNC[C@H](O)c3cccnc3)C2)cc1	ZINC000819380033	EE	On-Demand	Clean	ADRB3	86	45
COc1ccc(N2CC[C@H](CNC[C@@H](O)c3cccnc3)C2)cc1	ZINC000819380035	EE	On-Demand	Clean	ADRB2	26	42
COc1ccc(N2CC[C@H](CNC[C@@H](O)c3cccnc3)C2)cc1	ZINC000819380035	EE	On-Demand	Clean	ADRB1	27	42
COc1ccc(N2CC[C@H](CNC[C@@H](O)c3cccnc3)C2)cc1	ZINC000819380035	EE	On-Demand	Clean	ADRB3	86	45
CCNc1ccc(C#N)cc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819380038	GH	On-Demand	Mild	PAPA1_CARPA	43	45
CCNc1ccc(C#N)cc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819380038	GH	On-Demand	Mild	CTRB_BOVIN	53	31
COc1ccc(N2CC[C@H](CNC[C@@H](O)CCc3ccccc3)C2)cc1	ZINC000819380040	FG	On-Demand	Clean	ADRB2	18	43
COc1ccc(N2CC[C@H](CNC[C@@H](O)CCc3ccccc3)C2)cc1	ZINC000819380040	FG	On-Demand	Clean	SLC18A2	44	38
COc1ccc(N2CC[C@H](CNC[C@@H](O)CCc3ccccc3)C2)cc1	ZINC000819380040	FG	On-Demand	Clean	GRIN2B	19	42
COc1ccc(N2CC[C@H](CNC[C@@H](O)CCc3ccccc3)C2)cc1	ZINC000819380040	FG	On-Demand	Clean	SIGMAR1	22	44
COc1ccc(N2CC[C@H](CNC[C@@H](O)CCc3ccccc3)C2)cc1	ZINC000819380040	FG	On-Demand	Clean	ABCB1	40	37
CCNc1ccc(C#N)cc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819380042	GH	On-Demand	Mild	PAPA1_CARPA	43	45
CCNc1ccc(C#N)cc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819380042	GH	On-Demand	Mild	CTRB_BOVIN	53	31
COc1ccc(N2CC[C@H](CNC[C@H](O)CCc3ccccc3)C2)cc1	ZINC000819380045	FG	On-Demand	Clean	ADRB2	18	43
COc1ccc(N2CC[C@H](CNC[C@H](O)CCc3ccccc3)C2)cc1	ZINC000819380045	FG	On-Demand	Clean	SLC18A2	44	38
COc1ccc(N2CC[C@H](CNC[C@H](O)CCc3ccccc3)C2)cc1	ZINC000819380045	FG	On-Demand	Clean	GRIN2B	19	42
COc1ccc(N2CC[C@H](CNC[C@H](O)CCc3ccccc3)C2)cc1	ZINC000819380045	FG	On-Demand	Clean	SIGMAR1	22	44
COc1ccc(N2CC[C@H](CNC[C@H](O)CCc3ccccc3)C2)cc1	ZINC000819380045	FG	On-Demand	Clean	ABCB1	40	37
COc1ccc(N2CC[C@H](CNCCC(N)=O)C2)cc1	ZINC000819380085	CC	On-Demand	Clean	F10	15	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(OCCF)c1	ZINC000819380097	EF	On-Demand	Anodyne	EPHX2	22	43
O[C@@H](CNC[C@@H]1C[C@H]1C1CCC1)c1cccc(Cl)c1	ZINC000819380100	CG	On-Demand	Anodyne	ADRB1	32	44
O[C@@H](CNC[C@@H]1C[C@H]1C1CCC1)c1cccc(Cl)c1	ZINC000819380100	CG	On-Demand	Anodyne	ADRB3	46	44
O[C@H](CNC[C@@H]1C[C@H]1C1CCC1)c1cccc(Cl)c1	ZINC000819380101	CG	On-Demand	Anodyne	ADRB1	32	44
O[C@H](CNC[C@@H]1C[C@H]1C1CCC1)c1cccc(Cl)c1	ZINC000819380101	CG	On-Demand	Anodyne	ADRB3	46	44
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819380114	EE	On-Demand	Anodyne	ADRB2	18	55
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819380114	EE	On-Demand	Anodyne	ADRB1	19	48
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819380114	EE	On-Demand	Anodyne	HTR1A	19	55
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819380114	EE	On-Demand	Anodyne	SLC6A4	21	46
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819380114	EE	On-Demand	Anodyne	ABCB1	72	41
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819380115	EE	On-Demand	Anodyne	ADRB2	18	55
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819380115	EE	On-Demand	Anodyne	ADRB1	19	48
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819380115	EE	On-Demand	Anodyne	HTR1A	19	55
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819380115	EE	On-Demand	Anodyne	SLC6A4	21	46
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc3[nH]ccc23)C1	ZINC000819380115	EE	On-Demand	Anodyne	ABCB1	72	41
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819380116	ED	On-Demand	Bother	ACOX1	45	34
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819380116	ED	On-Demand	Bother	CACNA1D	47	34
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819380116	ED	On-Demand	Bother	ABCB1	58	44
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819380117	ED	On-Demand	Bother	ACOX1	45	34
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819380117	ED	On-Demand	Bother	CACNA1D	47	34
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819380117	ED	On-Demand	Bother	ABCB1	58	44
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819380118	ED	On-Demand	Bother	ACOX1	45	34
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819380118	ED	On-Demand	Bother	CACNA1D	47	34
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819380118	ED	On-Demand	Bother	ABCB1	58	44
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819380119	ED	On-Demand	Bother	ACOX1	45	34
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819380119	ED	On-Demand	Bother	CACNA1D	47	34
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)C1	ZINC000819380119	ED	On-Demand	Bother	ABCB1	58	44
O=C(O)C[C@H]1CCCN(CCc2ccc(F)c(F)c2)C1	ZINC000819380120	CF	On-Demand	Anodyne	SLC6A1	122	38
O=C(O)C[C@H]1CCCN(CCc2ccc(F)c(F)c2)C1	ZINC000819380120	CF	On-Demand	Anodyne	SIGMAR1	20	42
O=C(O)C[C@H]1CCCN(CCc2ccc(F)c(F)c2)C1	ZINC000819380120	CF	On-Demand	Anodyne	CCR3	78	50
O=C(O)C[C@H]1CCCN(CCc2ccc(F)c(F)c2)C1	ZINC000819380120	CF	On-Demand	Anodyne	ABCC1	103	38
O=C(O)C[C@H]1CCCN(CCc2ccc(F)c(F)c2)C1	ZINC000819380120	CF	On-Demand	Anodyne	ABCB1A	52	37
O=C(O)C[C@@H]1CCCN(CCc2ccc(F)c(F)c2)C1	ZINC000819380121	CF	On-Demand	Anodyne	SLC6A1	122	38
O=C(O)C[C@@H]1CCCN(CCc2ccc(F)c(F)c2)C1	ZINC000819380121	CF	On-Demand	Anodyne	SIGMAR1	20	42
O=C(O)C[C@@H]1CCCN(CCc2ccc(F)c(F)c2)C1	ZINC000819380121	CF	On-Demand	Anodyne	CCR3	78	50
O=C(O)C[C@@H]1CCCN(CCc2ccc(F)c(F)c2)C1	ZINC000819380121	CF	On-Demand	Anodyne	ABCC1	103	38
O=C(O)C[C@@H]1CCCN(CCc2ccc(F)c(F)c2)C1	ZINC000819380121	CF	On-Demand	Anodyne	ABCB1A	52	37
O=C(O)C[C@H]1CCCN(CC(=O)Nc2nc(-c3ccco3)cs2)C1	ZINC000819380126	EF	On-Demand	Anodyne	CCR3	42	35
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2nc(-c3ccco3)cs2)C1	ZINC000819380127	EF	On-Demand	Anodyne	CCR3	42	35
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819380128	EF	On-Demand	Anodyne	OPRK1	22	42
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819380128	EF	On-Demand	Anodyne	RBP4	42	38
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819380129	EF	On-Demand	Anodyne	OPRK1	22	42
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819380129	EF	On-Demand	Anodyne	RBP4	42	38
O=C(O)C[C@H]1CCCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819380130	EF	On-Demand	Anodyne	OPRK1	22	42
O=C(O)C[C@H]1CCCN(C[C@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819380130	EF	On-Demand	Anodyne	RBP4	42	38
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819380131	EF	On-Demand	Anodyne	OPRK1	22	42
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2ccccc2C(F)(F)F)C1	ZINC000819380131	EF	On-Demand	Anodyne	RBP4	42	38
O=C(O)C[C@H]1CCCN(CC(=O)Nc2cccc(C(=O)NC3CC3)c2)C1	ZINC000819380134	FD	On-Demand	Anodyne	DRD4	31	42
O=C(O)C[C@H]1CCCN(CC(=O)Nc2cccc(C(=O)NC3CC3)c2)C1	ZINC000819380134	FD	On-Demand	Anodyne	CCR3	53	42
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2cccc(C(=O)NC3CC3)c2)C1	ZINC000819380135	FD	On-Demand	Anodyne	DRD4	31	42
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2cccc(C(=O)NC3CC3)c2)C1	ZINC000819380135	FD	On-Demand	Anodyne	CCR3	53	42
O=C(O)C[C@@H]1CCCN(CCCS(=O)(=O)c2ccccc2)C1	ZINC000819380136	EE	On-Demand	Anodyne	SLC6A1	134	44
O=C(O)C[C@@H]1CCCN(CCCS(=O)(=O)c2ccccc2)C1	ZINC000819380136	EE	On-Demand	Anodyne	HTR7	20	40
O=C(O)C[C@H]1CCCN(CCCS(=O)(=O)c2ccccc2)C1	ZINC000819380137	EE	On-Demand	Anodyne	SLC6A1	134	44
O=C(O)C[C@H]1CCCN(CCCS(=O)(=O)c2ccccc2)C1	ZINC000819380137	EE	On-Demand	Anodyne	HTR7	20	40
O=C(O)C[C@H]1CCCN(Cc2ccc(OCC(F)(F)F)nc2)C1	ZINC000819380138	EF	On-Demand	Anodyne	SLC6A1	83	35
O=C(O)C[C@@H]1CCCN(Cc2ccc(OCC(F)(F)F)nc2)C1	ZINC000819380139	EF	On-Demand	Anodyne	SLC6A1	83	35
O=C(O)C[C@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000819380150	DF	On-Demand	Bother	SLC6A1	65	36
O=C(O)C[C@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000819380150	DF	On-Demand	Bother	KCNH2	15	40
O=C(O)C[C@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000819380150	DF	On-Demand	Bother	LTA4H	36	52
O=C(O)C[C@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000819380150	DF	On-Demand	Bother	HRH3	96	50
O=C(O)C[C@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000819380150	DF	On-Demand	Bother	SIGMAR1	17	46
O=C(O)C[C@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000819380150	DF	On-Demand	Bother	SSTR1	18	40
O=C(O)C[C@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000819380150	DF	On-Demand	Bother	MEN1	44	36
O=C(O)C[C@@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000819380151	DF	On-Demand	Bother	SLC6A1	65	36
O=C(O)C[C@@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000819380151	DF	On-Demand	Bother	KCNH2	15	40
O=C(O)C[C@@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000819380151	DF	On-Demand	Bother	LTA4H	36	52
O=C(O)C[C@@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000819380151	DF	On-Demand	Bother	HRH3	96	50
O=C(O)C[C@@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000819380151	DF	On-Demand	Bother	SIGMAR1	17	46
O=C(O)C[C@@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000819380151	DF	On-Demand	Bother	SSTR1	18	40
O=C(O)C[C@@H]1CCCN(CCCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000819380151	DF	On-Demand	Bother	MEN1	44	36
O=C(O)C[C@@H]1CCCN(CN2C(=O)C(=O)c3c(Cl)cccc32)C1	ZINC000819380156	EE	On-Demand	Anodyne	SLC6A1	43	35
O=C(O)C[C@H]1CCCN(CN2C(=O)C(=O)c3c(Cl)cccc32)C1	ZINC000819380157	EE	On-Demand	Anodyne	SLC6A1	43	35
O=C(O)C[C@H]1CCCN(CCc2nnnn2-c2ccccc2)C1	ZINC000819380160	DD	On-Demand	Anodyne	SLC6A1	99	37
O=C(O)C[C@@H]1CCCN(CCc2nnnn2-c2ccccc2)C1	ZINC000819380161	DD	On-Demand	Anodyne	SLC6A1	99	37
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819380162	EF	On-Demand	Anodyne	ADRB2	24	52
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819380162	EF	On-Demand	Anodyne	ADRB1	20	46
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819380162	EF	On-Demand	Anodyne	HTR1A	19	43
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819380162	EF	On-Demand	Anodyne	ABCB1	89	50
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819380162	EF	On-Demand	Anodyne	MCL1	40	41
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819380163	EF	On-Demand	Anodyne	ADRB2	24	52
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819380163	EF	On-Demand	Anodyne	ADRB1	20	46
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819380163	EF	On-Demand	Anodyne	HTR1A	19	43
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819380163	EF	On-Demand	Anodyne	ABCB1	89	50
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc3ccccc23)C1	ZINC000819380163	EF	On-Demand	Anodyne	MCL1	40	41
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc3ccccc23)C1	ZINC000819380164	EF	On-Demand	Anodyne	ADRB2	24	52
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc3ccccc23)C1	ZINC000819380164	EF	On-Demand	Anodyne	ADRB1	20	46
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc3ccccc23)C1	ZINC000819380164	EF	On-Demand	Anodyne	HTR1A	19	43
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc3ccccc23)C1	ZINC000819380164	EF	On-Demand	Anodyne	ABCB1	89	50
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc3ccccc23)C1	ZINC000819380164	EF	On-Demand	Anodyne	MCL1	40	41
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc3ccccc23)C1	ZINC000819380165	EF	On-Demand	Anodyne	ADRB2	24	52
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc3ccccc23)C1	ZINC000819380165	EF	On-Demand	Anodyne	ADRB1	20	46
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc3ccccc23)C1	ZINC000819380165	EF	On-Demand	Anodyne	HTR1A	19	43
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc3ccccc23)C1	ZINC000819380165	EF	On-Demand	Anodyne	ABCB1	89	50
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc3ccccc23)C1	ZINC000819380165	EF	On-Demand	Anodyne	MCL1	40	41
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2ccc(F)cc2F)C1	ZINC000819380166	CE	On-Demand	Anodyne	SLC6A1	50	38
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2ccc(F)cc2F)C1	ZINC000819380166	CE	On-Demand	Anodyne	CCR3	73	36
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819380167	CE	On-Demand	Anodyne	SLC6A1	50	38
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819380167	CE	On-Demand	Anodyne	CCR3	73	36
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819380168	CE	On-Demand	Anodyne	SLC6A1	50	38
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2ccc(F)cc2F)C1	ZINC000819380168	CE	On-Demand	Anodyne	CCR3	73	36
O=C(O)C[C@H]1CCCN(C[C@H](O)c2ccc(F)cc2F)C1	ZINC000819380169	CE	On-Demand	Anodyne	SLC6A1	50	38
O=C(O)C[C@H]1CCCN(C[C@H](O)c2ccc(F)cc2F)C1	ZINC000819380169	CE	On-Demand	Anodyne	CCR3	73	36
O=C(O)C[C@@H]1CCCN(CN2C[C@H](c3cccc(F)c3)CC2=O)C1	ZINC000819380172	EE	On-Demand	Anodyne	CCR5	62	37
O=C(O)C[C@H]1CCCN(CN2C[C@@H](c3cccc(F)c3)CC2=O)C1	ZINC000819380173	EE	On-Demand	Anodyne	CCR5	62	37
O=C(O)C[C@H]1CCCN(CN2C[C@H](c3cccc(F)c3)CC2=O)C1	ZINC000819380174	EE	On-Demand	Anodyne	CCR5	62	37
O=C(O)C[C@@H]1CCCN(CN2C[C@@H](c3cccc(F)c3)CC2=O)C1	ZINC000819380175	EE	On-Demand	Anodyne	CCR5	62	37
O=C(O)C[C@H]1CCCN(Cc2nnc(-c3cccc(F)c3)o2)C1	ZINC000819380176	DF	On-Demand	Anodyne	SLC6A1	40	33
O=C(O)C[C@H]1CCCN(Cc2nnc(-c3cccc(F)c3)o2)C1	ZINC000819380176	DF	On-Demand	Anodyne	CCR3	55	42
O=C(O)C[C@@H]1CCCN(Cc2nnc(-c3cccc(F)c3)o2)C1	ZINC000819380177	DF	On-Demand	Anodyne	SLC6A1	40	33
O=C(O)C[C@@H]1CCCN(Cc2nnc(-c3cccc(F)c3)o2)C1	ZINC000819380177	DF	On-Demand	Anodyne	CCR3	55	42
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2ccccc2F)C1	ZINC000819380182	CE	On-Demand	Anodyne	SLC6A1	88	38
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2ccccc2F)C1	ZINC000819380182	CE	On-Demand	Anodyne	CCR3	25	42
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2ccccc2F)C1	ZINC000819380183	CE	On-Demand	Anodyne	SLC6A1	88	38
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2ccccc2F)C1	ZINC000819380183	CE	On-Demand	Anodyne	CCR3	25	42
O=C(O)C[C@H]1CCCN(C[C@H](O)c2ccccc2F)C1	ZINC000819380184	CE	On-Demand	Anodyne	SLC6A1	88	38
O=C(O)C[C@H]1CCCN(C[C@H](O)c2ccccc2F)C1	ZINC000819380184	CE	On-Demand	Anodyne	CCR3	25	42
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2ccccc2F)C1	ZINC000819380185	CE	On-Demand	Anodyne	SLC6A1	88	38
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2ccccc2F)C1	ZINC000819380185	CE	On-Demand	Anodyne	CCR3	25	42
O=C(O)C[C@H]1CCCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000819380186	DD	On-Demand	Anodyne	SLC6A1	87	38
O=C(O)C[C@H]1CCCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000819380186	DD	On-Demand	Anodyne	ALDH1A1	61	43
O=C(O)C[C@H]1CCCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000819380186	DD	On-Demand	Anodyne	ALDH3A1	44	53
O=C(O)C[C@H]1CCCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000819380186	DD	On-Demand	Anodyne	CES1	16	42
O=C(O)C[C@H]1CCCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000819380186	DD	On-Demand	Anodyne	CASP7	42	35
O=C(O)C[C@@H]1CCCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000819380187	DD	On-Demand	Anodyne	SLC6A1	87	38
O=C(O)C[C@@H]1CCCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000819380187	DD	On-Demand	Anodyne	ALDH1A1	61	43
O=C(O)C[C@@H]1CCCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000819380187	DD	On-Demand	Anodyne	ALDH3A1	44	53
O=C(O)C[C@@H]1CCCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000819380187	DD	On-Demand	Anodyne	CES1	16	42
O=C(O)C[C@@H]1CCCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000819380187	DD	On-Demand	Anodyne	CASP7	42	35
O=C(O)C[C@@H]1CCCN(Cc2nc(O)c3ccc(Cl)cc3n2)C1	ZINC000819380198	EF	On-Demand	Anodyne	Q8MHZ5_SHEEP	47	34
O=C(O)C[C@H]1CCCN(Cc2nc(O)c3ccc(Cl)cc3n2)C1	ZINC000819380199	EF	On-Demand	Anodyne	Q8MHZ5_SHEEP	47	34
O=C(O)C[C@H]1CCCN(Cc2ccc(-n3ccnc3)nc2)C1	ZINC000819380210	DD	On-Demand	Anodyne	NOS2	95	36
O=C(O)C[C@@H]1CCCN(Cc2ccc(-n3ccnc3)nc2)C1	ZINC000819380211	DD	On-Demand	Anodyne	NOS2	95	36
O=C(O)C[C@@H]1CCCN(Cn2[nH]c(-c3cc(F)cc(F)c3)nc2=S)C1	ZINC000819380212	FG	On-Demand	Anodyne	CCR3	93	33
O=C(O)C[C@H]1CCCN(Cn2[nH]c(-c3cc(F)cc(F)c3)nc2=S)C1	ZINC000819380213	FG	On-Demand	Anodyne	CCR3	93	33
C#CCCCCNC(=O)c1cnc2cc(OC)ccn12	ZINC000819380221	CD	On-Demand	Mild	DRD4	40	32
CCOc1cc(Cl)ccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819380277	GI	On-Demand	Mild	PAPA1_CARPA	39	44
CCOc1cc(Cl)ccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819380278	GI	On-Demand	Mild	PAPA1_CARPA	39	44
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1ccc(OCC2CC2)c(F)c1	ZINC000819380283	EH	On-Demand	Anodyne	KCNQ2	49	41
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1ccc(OCC2CC2)c(F)c1	ZINC000819380284	EH	On-Demand	Anodyne	KCNQ2	49	41
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1ccc(OCC2CC2)c(F)c1	ZINC000819380285	EH	On-Demand	Anodyne	KCNQ2	49	41
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1ccc(OCC2CC2)c(F)c1	ZINC000819380286	EH	On-Demand	Anodyne	KCNQ2	49	41
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1CCC(CO)CC1	ZINC000819380292	FF	On-Demand	Mild	PAPA1_CARPA	31	41
C#CCCCCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819380308	CD	On-Demand	Mild	DRD4	40	31
C#CCCCCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819380308	CD	On-Demand	Mild	MTNR1A	46	45
C#CCCCCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819380308	CD	On-Demand	Mild	MTNR1B	44	45
C#CCCCCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819380309	CD	On-Demand	Mild	DRD4	40	31
C#CCCCCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819380309	CD	On-Demand	Mild	MTNR1A	46	45
C#CCCCCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819380309	CD	On-Demand	Mild	MTNR1B	44	45
C=C(Cl)CSc1nc(C)c(CC(=O)N(C)Cc2cccc(O)c2)s1	ZINC000819380353	GI	On-Demand	Mild	HSD17B2	25	41
COc1ccc(N2CC[C@H](CNCCC(=O)Nc3ccc(Cl)cc3)C2)cc1	ZINC000819380364	GH	On-Demand	Clean	F10	23	40
COc1ccc(N2CC[C@H](CNCCC(=O)Nc3ccc(Cl)cc3)C2)cc1	ZINC000819380364	GH	On-Demand	Clean	MCHR1	20	51
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccccc3F)C2)cc1	ZINC000819380370	FF	On-Demand	Clean	ADRB2	40	41
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccccc3F)C2)cc1	ZINC000819380370	FF	On-Demand	Clean	ADRB1	51	43
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccccc3F)C2)cc1	ZINC000819380370	FF	On-Demand	Clean	ADRB3	35	46
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccccc3F)C2)cc1	ZINC000819380372	FF	On-Demand	Clean	ADRB2	40	41
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccccc3F)C2)cc1	ZINC000819380372	FF	On-Demand	Clean	ADRB1	51	43
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccccc3F)C2)cc1	ZINC000819380372	FF	On-Demand	Clean	ADRB3	35	46
COc1ccc(N2CC[C@H](CNCCC(=O)Nc3cc(F)cc(F)c3)C2)cc1	ZINC000819380399	GG	On-Demand	Clean	CCR3	40	39
COc1ccc(N2CC[C@H](CNCCC(=O)Nc3cc(F)cc(F)c3)C2)cc1	ZINC000819380399	GG	On-Demand	Clean	MCHR1	21	44
COc1ccc(N2CC[C@H](CNCCS(C)(=O)=O)C2)cc1	ZINC000819380405	DD	On-Demand	Clean	MMP13	36	40
O=C(O)C[C@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1	ZINC000819380408	EF	On-Demand	Anodyne	PIM1	18	52
O=C(O)C[C@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1	ZINC000819380408	EF	On-Demand	Anodyne	PIM2	15	52
O=C(O)C[C@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1	ZINC000819380408	EF	On-Demand	Anodyne	CDC7	21	52
O=C(O)C[C@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1	ZINC000819380408	EF	On-Demand	Anodyne	PIM3	23	52
O=C(O)C[C@@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1	ZINC000819380410	EF	On-Demand	Anodyne	PIM1	18	52
O=C(O)C[C@@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1	ZINC000819380410	EF	On-Demand	Anodyne	PIM2	15	52
O=C(O)C[C@@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1	ZINC000819380410	EF	On-Demand	Anodyne	CDC7	21	52
O=C(O)C[C@@H]1CCCN(Cc2nc(O)c3oc4ccccc4c3n2)C1	ZINC000819380410	EF	On-Demand	Anodyne	PIM3	23	52
O=C(O)C[C@@H]1CCCN(CC[S@](=O)c2ccccc2)C1	ZINC000819380412	CD	On-Demand	Anodyne	SLC6A1	145	47
O=C(O)C[C@@H]1CCCN(CC[S@](=O)c2ccccc2)C1	ZINC000819380412	CD	On-Demand	Anodyne	SIGMAR1	18	44
O=C(O)C[C@@H]1CCCN(CC[S@@](=O)c2ccccc2)C1	ZINC000819380414	CD	On-Demand	Anodyne	SLC6A1	145	47
O=C(O)C[C@@H]1CCCN(CC[S@@](=O)c2ccccc2)C1	ZINC000819380414	CD	On-Demand	Anodyne	SIGMAR1	18	44
O=C(O)C[C@H]1CCCN(CC[S@](=O)c2ccccc2)C1	ZINC000819380416	CD	On-Demand	Anodyne	SLC6A1	145	47
O=C(O)C[C@H]1CCCN(CC[S@](=O)c2ccccc2)C1	ZINC000819380416	CD	On-Demand	Anodyne	SIGMAR1	18	44
O=C(O)C[C@H]1CCCN(CC[S@@](=O)c2ccccc2)C1	ZINC000819380418	CD	On-Demand	Anodyne	SLC6A1	145	47
O=C(O)C[C@H]1CCCN(CC[S@@](=O)c2ccccc2)C1	ZINC000819380418	CD	On-Demand	Anodyne	SIGMAR1	18	44
O=C(O)C[C@@H]1CCCN(Cc2nc3cc(C(F)(F)F)ccc3o2)C1	ZINC000819380422	EH	On-Demand	Anodyne	LIPG	50	38
O=C(O)C[C@H]1CCCN(Cc2nc3cc(C(F)(F)F)ccc3o2)C1	ZINC000819380423	EH	On-Demand	Anodyne	LIPG	50	38
O=C(O)C[C@H]1CCCN(CCS(=O)(=O)c2ccccc2)C1	ZINC000819380424	DD	On-Demand	Anodyne	SLC6A1	140	39
O=C(O)C[C@@H]1CCCN(CCS(=O)(=O)c2ccccc2)C1	ZINC000819380425	DD	On-Demand	Anodyne	SLC6A1	140	39
O=C(O)C[C@H]1CCCN(CC2=Nc3ccccc3S(=O)(=O)N2)C1	ZINC000819380428	ED	On-Demand	Anodyne	SLC6A1	64	33
O=C(O)C[C@@H]1CCCN(CC2=Nc3ccccc3S(=O)(=O)N2)C1	ZINC000819380429	ED	On-Demand	Anodyne	SLC6A1	64	33
O=C(O)C[C@@H]1CCCN(CCn2ccc([N+](=O)[O-])n2)C1	ZINC000819380434	CC	On-Demand	Bother	SLC6A1	57	33
O=C(O)C[C@H]1CCCN(CCn2ccc([N+](=O)[O-])n2)C1	ZINC000819380435	CC	On-Demand	Bother	SLC6A1	57	33
O=C(O)C[C@@H]1CCCN(CCC(=O)N2CCN(c3ncccn3)CC2)C1	ZINC000819380438	FC	On-Demand	Anodyne	SLC6A1	67	34
O=C(O)C[C@H]1CCCN(CCC(=O)N2CCN(c3ncccn3)CC2)C1	ZINC000819380439	FC	On-Demand	Anodyne	SLC6A1	67	34
O=C(O)C[C@H]1CCCN(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)C1	ZINC000819380444	ED	On-Demand	Anodyne	SIGMAR1	18	47
O=C(O)C[C@H]1CCCN(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)C1	ZINC000819380444	ED	On-Demand	Anodyne	CCR3	42	31
O=C(O)C[C@@H]1CCCN(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)C1	ZINC000819380445	ED	On-Demand	Anodyne	SIGMAR1	18	47
O=C(O)C[C@@H]1CCCN(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)C1	ZINC000819380445	ED	On-Demand	Anodyne	CCR3	42	31
O=C(O)C[C@H]1CCCN(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)C1	ZINC000819380446	ED	On-Demand	Anodyne	SIGMAR1	18	47
O=C(O)C[C@H]1CCCN(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)C1	ZINC000819380446	ED	On-Demand	Anodyne	CCR3	42	31
O=C(O)C[C@@H]1CCCN(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)C1	ZINC000819380447	ED	On-Demand	Anodyne	SIGMAR1	18	47
O=C(O)C[C@@H]1CCCN(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)C1	ZINC000819380447	ED	On-Demand	Anodyne	CCR3	42	31
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2nc3ccc(F)cc3s2)C1	ZINC000819380448	FF	On-Demand	Anodyne	CSNK1D	46	52
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2nc3ccc(F)cc3s2)C1	ZINC000819380448	FF	On-Demand	Anodyne	NMT1	33	40
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2nc3ccc(F)cc3s2)C1	ZINC000819380448	FF	On-Demand	Anodyne	CCR3	102	41
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2nc3ccc(F)cc3s2)C1	ZINC000819380448	FF	On-Demand	Anodyne	PIK3CA	15	43
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2nc3ccc(F)cc3s2)C1	ZINC000819380448	FF	On-Demand	Anodyne	Q8MHZ5_SHEEP	41	36
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2nc3ccc(F)cc3s2)C1	ZINC000819380448	FF	On-Demand	Anodyne	SLC27A1	47	51
O=C(O)C[C@H]1CCCN(CC(=O)Nc2nc3ccc(F)cc3s2)C1	ZINC000819380449	FF	On-Demand	Anodyne	CSNK1D	46	52
O=C(O)C[C@H]1CCCN(CC(=O)Nc2nc3ccc(F)cc3s2)C1	ZINC000819380449	FF	On-Demand	Anodyne	NMT1	33	40
O=C(O)C[C@H]1CCCN(CC(=O)Nc2nc3ccc(F)cc3s2)C1	ZINC000819380449	FF	On-Demand	Anodyne	CCR3	102	41
O=C(O)C[C@H]1CCCN(CC(=O)Nc2nc3ccc(F)cc3s2)C1	ZINC000819380449	FF	On-Demand	Anodyne	PIK3CA	15	43
O=C(O)C[C@H]1CCCN(CC(=O)Nc2nc3ccc(F)cc3s2)C1	ZINC000819380449	FF	On-Demand	Anodyne	Q8MHZ5_SHEEP	41	36
O=C(O)C[C@H]1CCCN(CC(=O)Nc2nc3ccc(F)cc3s2)C1	ZINC000819380449	FF	On-Demand	Anodyne	SLC27A1	47	51
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819380456	DD	On-Demand	Anodyne	ADRB1	34	41
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819380456	DD	On-Demand	Anodyne	ACOX1	45	37
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819380456	DD	On-Demand	Anodyne	CCR3	73	38
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819380456	DD	On-Demand	Anodyne	CYP2D6	17	49
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819380456	DD	On-Demand	Anodyne	ABCB1	71	52
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc(F)cc2)C1	ZINC000819380457	DD	On-Demand	Anodyne	ADRB1	34	41
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc(F)cc2)C1	ZINC000819380457	DD	On-Demand	Anodyne	ACOX1	45	37
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc(F)cc2)C1	ZINC000819380457	DD	On-Demand	Anodyne	CCR3	73	38
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc(F)cc2)C1	ZINC000819380457	DD	On-Demand	Anodyne	CYP2D6	17	49
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc(F)cc2)C1	ZINC000819380457	DD	On-Demand	Anodyne	ABCB1	71	52
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc(F)cc2)C1	ZINC000819380458	DD	On-Demand	Anodyne	ADRB1	34	41
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc(F)cc2)C1	ZINC000819380458	DD	On-Demand	Anodyne	ACOX1	45	37
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc(F)cc2)C1	ZINC000819380458	DD	On-Demand	Anodyne	CCR3	73	38
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc(F)cc2)C1	ZINC000819380458	DD	On-Demand	Anodyne	CYP2D6	17	49
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc(F)cc2)C1	ZINC000819380458	DD	On-Demand	Anodyne	ABCB1	71	52
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819380459	DD	On-Demand	Anodyne	ADRB1	34	41
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819380459	DD	On-Demand	Anodyne	ACOX1	45	37
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819380459	DD	On-Demand	Anodyne	CCR3	73	38
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819380459	DD	On-Demand	Anodyne	CYP2D6	17	49
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc(F)cc2)C1	ZINC000819380459	DD	On-Demand	Anodyne	ABCB1	71	52
O=C(O)C[C@@H]1CCCN(CCC(=O)Nc2ccc(N3CCOCC3)cc2)C1	ZINC000819380460	GE	On-Demand	Anodyne	SLC6A1	50	32
O=C(O)C[C@@H]1CCCN(CCC(=O)Nc2ccc(N3CCOCC3)cc2)C1	ZINC000819380460	GE	On-Demand	Anodyne	MTOR	42	36
O=C(O)C[C@@H]1CCCN(CCC(=O)Nc2ccc(N3CCOCC3)cc2)C1	ZINC000819380460	GE	On-Demand	Anodyne	EPHX2	15	41
O=C(O)C[C@H]1CCCN(CCC(=O)Nc2ccc(N3CCOCC3)cc2)C1	ZINC000819380461	GE	On-Demand	Anodyne	SLC6A1	50	32
O=C(O)C[C@H]1CCCN(CCC(=O)Nc2ccc(N3CCOCC3)cc2)C1	ZINC000819380461	GE	On-Demand	Anodyne	MTOR	42	36
O=C(O)C[C@H]1CCCN(CCC(=O)Nc2ccc(N3CCOCC3)cc2)C1	ZINC000819380461	GE	On-Demand	Anodyne	EPHX2	15	41
O=C(O)C[C@@H]1CCCN(Cc2cc3c(cc2O)OCO3)C1	ZINC000819380462	CD	On-Demand	Clean	SLC6A1	53	33
O=C(O)C[C@H]1CCCN(Cc2cc3c(cc2O)OCO3)C1	ZINC000819380463	CD	On-Demand	Clean	SLC6A1	53	33
O=C(O)C[C@H]1CCCN(CC(=O)c2c[nH]c3ccccc23)C1	ZINC000819380474	DF	On-Demand	Anodyne	SLC6A1	45	34
O=C(O)C[C@H]1CCCN(CC(=O)c2c[nH]c3ccccc23)C1	ZINC000819380474	DF	On-Demand	Anodyne	GRIN2B	15	62
O=C(O)C[C@@H]1CCCN(CC(=O)c2c[nH]c3ccccc23)C1	ZINC000819380475	DF	On-Demand	Anodyne	SLC6A1	45	34
O=C(O)C[C@@H]1CCCN(CC(=O)c2c[nH]c3ccccc23)C1	ZINC000819380475	DF	On-Demand	Anodyne	GRIN2B	15	62
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380476	FF	On-Demand	Anodyne	ADRB1	15	41
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380476	FF	On-Demand	Anodyne	PTGFR	41	34
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380476	FF	On-Demand	Anodyne	ACOX1	54	33
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380476	FF	On-Demand	Anodyne	ABCB1	62	44
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380476	FF	On-Demand	Anodyne	CCR2	41	39
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380476	FF	On-Demand	Anodyne	LIPG	46	34
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380476	FF	On-Demand	Anodyne	PDS	45	39
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380477	FF	On-Demand	Anodyne	ADRB1	15	41
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380477	FF	On-Demand	Anodyne	PTGFR	41	34
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380477	FF	On-Demand	Anodyne	ACOX1	54	33
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380477	FF	On-Demand	Anodyne	ABCB1	62	44
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380477	FF	On-Demand	Anodyne	CCR2	41	39
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380477	FF	On-Demand	Anodyne	LIPG	46	34
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380477	FF	On-Demand	Anodyne	PDS	45	39
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380478	FF	On-Demand	Anodyne	ADRB1	15	41
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380478	FF	On-Demand	Anodyne	PTGFR	41	34
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380478	FF	On-Demand	Anodyne	ACOX1	54	33
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380478	FF	On-Demand	Anodyne	ABCB1	62	44
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380478	FF	On-Demand	Anodyne	CCR2	41	39
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380478	FF	On-Demand	Anodyne	LIPG	46	34
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380478	FF	On-Demand	Anodyne	PDS	45	39
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380479	FF	On-Demand	Anodyne	ADRB1	15	41
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380479	FF	On-Demand	Anodyne	PTGFR	41	34
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380479	FF	On-Demand	Anodyne	ACOX1	54	33
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380479	FF	On-Demand	Anodyne	ABCB1	62	44
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380479	FF	On-Demand	Anodyne	CCR2	41	39
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380479	FF	On-Demand	Anodyne	LIPG	46	34
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000819380479	FF	On-Demand	Anodyne	PDS	45	39
O=C(O)C[C@@H]1CCCN(CCC(=O)Nc2ccccc2C(=O)NC2CC2)C1	ZINC000819380480	FE	On-Demand	Anodyne	SLC6A1	114	35
O=C(O)C[C@H]1CCCN(CCC(=O)Nc2ccccc2C(=O)NC2CC2)C1	ZINC000819380481	FE	On-Demand	Anodyne	SLC6A1	114	35
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819380486	ED	On-Demand	Anodyne	EDNRB	56	38
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819380486	ED	On-Demand	Anodyne	EDNRA	57	38
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819380486	ED	On-Demand	Anodyne	ACOX1	45	32
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819380486	ED	On-Demand	Anodyne	ABCB1	54	39
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819380487	ED	On-Demand	Anodyne	EDNRB	56	38
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819380487	ED	On-Demand	Anodyne	EDNRA	57	38
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819380487	ED	On-Demand	Anodyne	ACOX1	45	32
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819380487	ED	On-Demand	Anodyne	ABCB1	54	39
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819380488	ED	On-Demand	Anodyne	EDNRB	56	38
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819380488	ED	On-Demand	Anodyne	EDNRA	57	38
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819380488	ED	On-Demand	Anodyne	ACOX1	45	32
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819380488	ED	On-Demand	Anodyne	ABCB1	54	39
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819380489	ED	On-Demand	Anodyne	EDNRB	56	38
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819380489	ED	On-Demand	Anodyne	EDNRA	57	38
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819380489	ED	On-Demand	Anodyne	ACOX1	45	32
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc3c(c2)OCO3)C1	ZINC000819380489	ED	On-Demand	Anodyne	ABCB1	54	39
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000819380490	CD	On-Demand	Anodyne	ADRB2	30	45
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000819380490	CD	On-Demand	Anodyne	ADRB1	52	41
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000819380490	CD	On-Demand	Anodyne	SLC6A1	68	38
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000819380490	CD	On-Demand	Anodyne	PTGFR	25	41
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000819380490	CD	On-Demand	Anodyne	ADRB3	30	40
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000819380490	CD	On-Demand	Anodyne	LTA4H	22	40
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000819380490	CD	On-Demand	Anodyne	ACOX1	47	35
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000819380490	CD	On-Demand	Anodyne	CPT1A	68	34
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000819380490	CD	On-Demand	Anodyne	ABCB1	84	49
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000819380491	CD	On-Demand	Anodyne	ADRB2	30	45
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000819380491	CD	On-Demand	Anodyne	ADRB1	52	41
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000819380491	CD	On-Demand	Anodyne	SLC6A1	68	38
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000819380491	CD	On-Demand	Anodyne	PTGFR	25	41
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000819380491	CD	On-Demand	Anodyne	ADRB3	30	40
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000819380491	CD	On-Demand	Anodyne	LTA4H	22	40
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000819380491	CD	On-Demand	Anodyne	ACOX1	47	35
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000819380491	CD	On-Demand	Anodyne	CPT1A	68	34
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccccc2)C1	ZINC000819380491	CD	On-Demand	Anodyne	ABCB1	84	49
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819380492	CD	On-Demand	Anodyne	ADRB2	30	45
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819380492	CD	On-Demand	Anodyne	ADRB1	52	41
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819380492	CD	On-Demand	Anodyne	SLC6A1	68	38
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819380492	CD	On-Demand	Anodyne	PTGFR	25	41
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819380492	CD	On-Demand	Anodyne	ADRB3	30	40
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819380492	CD	On-Demand	Anodyne	LTA4H	22	40
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819380492	CD	On-Demand	Anodyne	ACOX1	47	35
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819380492	CD	On-Demand	Anodyne	CPT1A	68	34
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819380492	CD	On-Demand	Anodyne	ABCB1	84	49
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819380493	CD	On-Demand	Anodyne	ADRB2	30	45
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819380493	CD	On-Demand	Anodyne	ADRB1	52	41
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819380493	CD	On-Demand	Anodyne	SLC6A1	68	38
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819380493	CD	On-Demand	Anodyne	PTGFR	25	41
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819380493	CD	On-Demand	Anodyne	ADRB3	30	40
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819380493	CD	On-Demand	Anodyne	LTA4H	22	40
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819380493	CD	On-Demand	Anodyne	ACOX1	47	35
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819380493	CD	On-Demand	Anodyne	CPT1A	68	34
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccccc2)C1	ZINC000819380493	CD	On-Demand	Anodyne	ABCB1	84	49
O=C(O)C[C@@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380498	CD	On-Demand	Anodyne	ACE	37	40
O=C(O)C[C@@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380498	CD	On-Demand	Anodyne	SLC6A1	79	38
O=C(O)C[C@@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380498	CD	On-Demand	Anodyne	CELA1	20	43
O=C(O)C[C@@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380498	CD	On-Demand	Anodyne	GRIN2B	30	40
O=C(O)C[C@@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380498	CD	On-Demand	Anodyne	LTA4H	18	41
O=C(O)C[C@@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380498	CD	On-Demand	Anodyne	SIGMAR1	31	48
O=C(O)C[C@@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380498	CD	On-Demand	Anodyne	CTSB	15	40
O=C(O)C[C@@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380498	CD	On-Demand	Anodyne	CYSP_TRYCR	21	40
O=C(O)C[C@@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380498	CD	On-Demand	Anodyne	CTSL	22	40
O=C(O)C[C@@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380498	CD	On-Demand	Anodyne	PREP	50	43
O=C(O)C[C@@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380498	CD	On-Demand	Anodyne	SLC12A5	65	43
O=C(O)C[C@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380499	CD	On-Demand	Anodyne	ACE	37	40
O=C(O)C[C@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380499	CD	On-Demand	Anodyne	SLC6A1	79	38
O=C(O)C[C@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380499	CD	On-Demand	Anodyne	CELA1	20	43
O=C(O)C[C@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380499	CD	On-Demand	Anodyne	GRIN2B	30	40
O=C(O)C[C@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380499	CD	On-Demand	Anodyne	LTA4H	18	41
O=C(O)C[C@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380499	CD	On-Demand	Anodyne	SIGMAR1	31	48
O=C(O)C[C@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380499	CD	On-Demand	Anodyne	CTSB	15	40
O=C(O)C[C@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380499	CD	On-Demand	Anodyne	CYSP_TRYCR	21	40
O=C(O)C[C@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380499	CD	On-Demand	Anodyne	CTSL	22	40
O=C(O)C[C@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380499	CD	On-Demand	Anodyne	PREP	50	43
O=C(O)C[C@H]1CCCN(CC(=O)OCc2ccccc2)C1	ZINC000819380499	CD	On-Demand	Anodyne	SLC12A5	65	43
O=C(O)C[C@H]1CCCN(CCN2C(=O)NC3(CCCC3)C2=O)C1	ZINC000819380502	DD	On-Demand	Anodyne	SLC6A1	86	34
O=C(O)C[C@@H]1CCCN(CCN2C(=O)NC3(CCCC3)C2=O)C1	ZINC000819380503	DD	On-Demand	Anodyne	SLC6A1	86	34
O=C(O)C[C@@H]1CCCN(CC[S@@](=O)c2cc(Cl)ccc2Cl)C1	ZINC000819380504	FG	On-Demand	Anodyne	SLC6A1	66	38
O=C(O)C[C@H]1CCCN(CC[S@@](=O)c2cc(Cl)ccc2Cl)C1	ZINC000819380505	FG	On-Demand	Anodyne	SLC6A1	66	38
O=C(O)C[C@@H]1CCCN(CC[S@](=O)c2cc(Cl)ccc2Cl)C1	ZINC000819380506	FG	On-Demand	Anodyne	SLC6A1	66	38
O=C(O)C[C@H]1CCCN(CC[S@](=O)c2cc(Cl)ccc2Cl)C1	ZINC000819380507	FG	On-Demand	Anodyne	SLC6A1	66	38
O=C(O)C[C@@H]1CCCN(CN2C(=O)C[C@@H]2c2ccccc2)C1	ZINC000819380508	DE	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)C[C@H]1CCCN(CN2C(=O)C[C@H]2c2ccccc2)C1	ZINC000819380509	DE	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)C[C@H]1CCCN(CN2C(=O)C[C@@H]2c2ccccc2)C1	ZINC000819380510	DE	On-Demand	Anodyne	SLC6A1	47	34
O=C(O)C[C@@H]1CCCN(CN2C(=O)C[C@H]2c2ccccc2)C1	ZINC000819380511	DE	On-Demand	Anodyne	SLC6A1	47	34
COC(=O)c1cnc(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819380581	GE	On-Demand	Mild	PAPA1_CARPA	35	40
COC(=O)c1cnc(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819380582	GE	On-Demand	Mild	PAPA1_CARPA	35	40
COc1ccc(N2CC[C@H](CNCCC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000819380614	FG	On-Demand	Clean	CCR3	51	43
COc1ccc(N2CC[C@H](CNCCC(=O)Nc3cccc(F)c3)C2)cc1	ZINC000819380614	FG	On-Demand	Clean	MCHR1	28	43
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(Cl)cc3)C2)cc1	ZINC000819380635	GG	On-Demand	Clean	ADRB2	34	41
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(Cl)cc3)C2)cc1	ZINC000819380635	GG	On-Demand	Clean	ADRB1	49	41
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(Cl)cc3)C2)cc1	ZINC000819380635	GG	On-Demand	Clean	ADRB3	36	43
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(Cl)cc3)C2)cc1	ZINC000819380638	GG	On-Demand	Clean	ADRB2	34	41
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(Cl)cc3)C2)cc1	ZINC000819380638	GG	On-Demand	Clean	ADRB1	49	41
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(Cl)cc3)C2)cc1	ZINC000819380638	GG	On-Demand	Clean	ADRB3	36	43
O=C(Nc1cccc(OCCF)c1)C(F)=C1CCC1	ZINC000819380641	CG	On-Demand	Anodyne	ADRB1	16	41
O=C(Nc1cccc(OCCF)c1)C(F)=C1CCC1	ZINC000819380641	CG	On-Demand	Anodyne	EPHX2	20	40
O=C(O)C[C@@H]1CCCN(Cc2nc(O)c3ccc(C(F)(F)F)cc3n2)C1	ZINC000819380646	FG	On-Demand	Anodyne	LIPG	46	33
O=C(O)C[C@H]1CCCN(Cc2nc(O)c3ccc(C(F)(F)F)cc3n2)C1	ZINC000819380648	FG	On-Demand	Anodyne	LIPG	46	33
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2cc(F)ccc2F)C1	ZINC000819380650	CE	On-Demand	Anodyne	SLC6A1	52	38
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2cc(F)ccc2F)C1	ZINC000819380650	CE	On-Demand	Anodyne	TBXA2R	16	40
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2cc(F)ccc2F)C1	ZINC000819380650	CE	On-Demand	Anodyne	CCR3	70	35
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819380652	CE	On-Demand	Anodyne	SLC6A1	52	38
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819380652	CE	On-Demand	Anodyne	TBXA2R	16	40
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819380652	CE	On-Demand	Anodyne	CCR3	70	35
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819380654	CE	On-Demand	Anodyne	SLC6A1	52	38
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819380654	CE	On-Demand	Anodyne	TBXA2R	16	40
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2cc(F)ccc2F)C1	ZINC000819380654	CE	On-Demand	Anodyne	CCR3	70	35
O=C(O)C[C@H]1CCCN(C[C@H](O)c2cc(F)ccc2F)C1	ZINC000819380655	CE	On-Demand	Anodyne	SLC6A1	52	38
O=C(O)C[C@H]1CCCN(C[C@H](O)c2cc(F)ccc2F)C1	ZINC000819380655	CE	On-Demand	Anodyne	TBXA2R	16	40
O=C(O)C[C@H]1CCCN(C[C@H](O)c2cc(F)ccc2F)C1	ZINC000819380655	CE	On-Demand	Anodyne	CCR3	70	35
O=C(O)C[C@H]1CCCN(Cc2cc3ccccc3nc2O)C1	ZINC000819380662	DF	On-Demand	Anodyne	SLC6A1	72	34
O=C(O)C[C@@H]1CCCN(Cc2cc3ccccc3nc2O)C1	ZINC000819380664	DF	On-Demand	Anodyne	SLC6A1	72	34
O=C(O)C[C@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000819380672	CD	On-Demand	Anodyne	ACE	54	37
O=C(O)C[C@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000819380672	CD	On-Demand	Anodyne	SLC6A1	69	37
O=C(O)C[C@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000819380672	CD	On-Demand	Anodyne	OPRM1	16	42
O=C(O)C[C@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000819380672	CD	On-Demand	Anodyne	PGC	41	32
O=C(O)C[C@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000819380672	CD	On-Demand	Anodyne	SIGMAR1	28	49
O=C(O)C[C@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000819380672	CD	On-Demand	Anodyne	SLC18A3	15	44
O=C(O)C[C@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000819380672	CD	On-Demand	Anodyne	PREP	44	37
O=C(O)C[C@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000819380672	CD	On-Demand	Anodyne	REN	48	35
O=C(O)C[C@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000819380672	CD	On-Demand	Anodyne	ABCB1	49	38
O=C(O)C[C@@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000819380677	CD	On-Demand	Anodyne	ACE	54	37
O=C(O)C[C@@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000819380677	CD	On-Demand	Anodyne	SLC6A1	69	37
O=C(O)C[C@@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000819380677	CD	On-Demand	Anodyne	OPRM1	16	42
O=C(O)C[C@@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000819380677	CD	On-Demand	Anodyne	PGC	41	32
O=C(O)C[C@@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000819380677	CD	On-Demand	Anodyne	SIGMAR1	28	49
O=C(O)C[C@@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000819380677	CD	On-Demand	Anodyne	SLC18A3	15	44
O=C(O)C[C@@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000819380677	CD	On-Demand	Anodyne	PREP	44	37
O=C(O)C[C@@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000819380677	CD	On-Demand	Anodyne	REN	48	35
O=C(O)C[C@@H]1CCCN(C[C@@H](O)Cc2ccccc2)C1	ZINC000819380677	CD	On-Demand	Anodyne	ABCB1	49	38
O=C(O)C[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000819380678	CD	On-Demand	Anodyne	ACE	54	37
O=C(O)C[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000819380678	CD	On-Demand	Anodyne	SLC6A1	69	37
O=C(O)C[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000819380678	CD	On-Demand	Anodyne	OPRM1	16	42
O=C(O)C[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000819380678	CD	On-Demand	Anodyne	PGC	41	32
O=C(O)C[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000819380678	CD	On-Demand	Anodyne	SIGMAR1	28	49
O=C(O)C[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000819380678	CD	On-Demand	Anodyne	SLC18A3	15	44
O=C(O)C[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000819380678	CD	On-Demand	Anodyne	PREP	44	37
O=C(O)C[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000819380678	CD	On-Demand	Anodyne	REN	48	35
O=C(O)C[C@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000819380678	CD	On-Demand	Anodyne	ABCB1	49	38
O=C(O)C[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000819380680	CD	On-Demand	Anodyne	ACE	54	37
O=C(O)C[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000819380680	CD	On-Demand	Anodyne	SLC6A1	69	37
O=C(O)C[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000819380680	CD	On-Demand	Anodyne	OPRM1	16	42
O=C(O)C[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000819380680	CD	On-Demand	Anodyne	PGC	41	32
O=C(O)C[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000819380680	CD	On-Demand	Anodyne	SIGMAR1	28	49
O=C(O)C[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000819380680	CD	On-Demand	Anodyne	SLC18A3	15	44
O=C(O)C[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000819380680	CD	On-Demand	Anodyne	PREP	44	37
O=C(O)C[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000819380680	CD	On-Demand	Anodyne	REN	48	35
O=C(O)C[C@@H]1CCCN(C[C@H](O)Cc2ccccc2)C1	ZINC000819380680	CD	On-Demand	Anodyne	ABCB1	49	38
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819380688	FF	On-Demand	Anodyne	SLC6A1	58	35
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819380688	FF	On-Demand	Anodyne	ABCB1	70	40
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819380690	FF	On-Demand	Anodyne	SLC6A1	58	35
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819380690	FF	On-Demand	Anodyne	ABCB1	70	40
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819380692	FF	On-Demand	Anodyne	SLC6A1	58	35
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819380692	FF	On-Demand	Anodyne	ABCB1	70	40
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819380694	FF	On-Demand	Anodyne	SLC6A1	58	35
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2c(Cl)cccc2Cl)C1	ZINC000819380694	FF	On-Demand	Anodyne	ABCB1	70	40
COc1ccc(N2CC[C@H](CNCCC(=O)Nc3cccnc3)C2)cc1	ZINC000819380695	FF	On-Demand	Clean	CHRNA7	29	41
COc1ccc(N2CC[C@H](CNC[C@H](O)c3ccccc3Cl)C2)cc1	ZINC000819380697	FG	On-Demand	Clean	OPRL1	22	40
O=C(O)C[C@H]1CCCN(CCC(=O)Nc2ccccc2C(F)(F)F)C1	ZINC000819380699	FG	On-Demand	Anodyne	SLC6A1	112	41
O=C(O)C[C@H]1CCCN(CCC(=O)Nc2ccccc2C(F)(F)F)C1	ZINC000819380699	FG	On-Demand	Anodyne	RBP4	81	40
O=C(O)C[C@H]1CCCN(CCC(=O)Nc2ccccc2C(F)(F)F)C1	ZINC000819380699	FG	On-Demand	Anodyne	SFRP1	42	38
O=C(O)C[C@@H]1CCCN(CCC(=O)Nc2ccccc2C(F)(F)F)C1	ZINC000819380701	FG	On-Demand	Anodyne	SLC6A1	112	41
O=C(O)C[C@@H]1CCCN(CCC(=O)Nc2ccccc2C(F)(F)F)C1	ZINC000819380701	FG	On-Demand	Anodyne	RBP4	81	40
O=C(O)C[C@@H]1CCCN(CCC(=O)Nc2ccccc2C(F)(F)F)C1	ZINC000819380701	FG	On-Demand	Anodyne	SFRP1	42	38
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	CHRM2	21	40
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	HTR1A	40	46
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	DRD2	35	46
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	DRD4	21	46
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	ACHE	15	43
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	HTR2A	30	46
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	SLC6A1	166	47
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	HRH1	32	46
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	DRD3	29	46
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	KCNH2	19	40
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	CHRM3	34	40
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	LTA4H	76	52
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	CYSLTR2	69	35
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	HTR7	34	41
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	HRH3	105	56
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	SIGMAR1	49	53
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	NPY1R	43	35
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	CCR3	27	45
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	CPT1A	43	34
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	PPARD	19	44
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	EBP	22	43
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	PLA2G4B	58	33
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	EPHX2	19	42
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	CHRNA10	50	41
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	PSMB2	40	39
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	PSMB1	43	40
O=C(O)C[C@@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380703	CG	On-Demand	Anodyne	MEN1	45	38
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	CHRM2	21	40
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	HTR1A	40	46
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	DRD2	35	46
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	DRD4	21	46
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	ACHE	15	43
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	HTR2A	30	46
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	SLC6A1	166	47
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	HRH1	32	46
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	DRD3	29	46
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	KCNH2	19	40
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	CHRM3	34	40
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	LTA4H	76	52
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	CYSLTR2	69	35
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	HTR7	34	41
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	HRH3	105	56
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	SIGMAR1	49	53
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	NPY1R	43	35
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	CCR3	27	45
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	CPT1A	43	34
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	PPARD	19	44
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	EBP	22	43
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	PLA2G4B	58	33
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	EPHX2	19	42
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	CHRNA10	50	41
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	PSMB2	40	39
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	PSMB1	43	40
O=C(O)C[C@H]1CCCN(CCCCOc2ccccc2)C1	ZINC000819380705	CG	On-Demand	Anodyne	MEN1	45	38
O=C(O)C[C@H]1CCCN(CCc2nc(O)c3ccccc3n2)C1	ZINC000819380714	DE	On-Demand	Anodyne	SLC6A1	96	34
O=C(O)C[C@@H]1CCCN(CCc2nc(O)c3ccccc3n2)C1	ZINC000819380716	DE	On-Demand	Anodyne	SLC6A1	96	34
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819380717	EF	On-Demand	Anodyne	OPRK1	18	45
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819380717	EF	On-Demand	Anodyne	CCR5	15	40
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819380717	EF	On-Demand	Anodyne	CCR2	59	42
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819380717	EF	On-Demand	Anodyne	LIPG	42	33
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819380718	EF	On-Demand	Anodyne	OPRK1	18	45
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819380718	EF	On-Demand	Anodyne	CCR5	15	40
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819380718	EF	On-Demand	Anodyne	CCR2	59	42
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819380718	EF	On-Demand	Anodyne	LIPG	42	33
O=C(O)C[C@H]1CCCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819380720	EF	On-Demand	Anodyne	OPRK1	18	45
O=C(O)C[C@H]1CCCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819380720	EF	On-Demand	Anodyne	CCR5	15	40
O=C(O)C[C@H]1CCCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819380720	EF	On-Demand	Anodyne	CCR2	59	42
O=C(O)C[C@H]1CCCN(C[C@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819380720	EF	On-Demand	Anodyne	LIPG	42	33
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819380722	EF	On-Demand	Anodyne	OPRK1	18	45
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819380722	EF	On-Demand	Anodyne	CCR5	15	40
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819380722	EF	On-Demand	Anodyne	CCR2	59	42
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2cccc(C(F)(F)F)c2)C1	ZINC000819380722	EF	On-Demand	Anodyne	LIPG	42	33
O=C(O)C[C@H]1CCCN(CN2C(=O)C[C@H]2c2ccc(Cl)cc2)C1	ZINC000819380723	EF	On-Demand	Anodyne	GRIN2D	55	31
O=C(O)C[C@H]1CCCN(CN2C(=O)C[C@@H]2c2ccc(Cl)cc2)C1	ZINC000819380725	EF	On-Demand	Anodyne	GRIN2D	55	31
O=C(O)C[C@@H]1CCCN(CN2C(=O)C[C@@H]2c2ccc(Cl)cc2)C1	ZINC000819380727	EF	On-Demand	Anodyne	GRIN2D	55	31
O=C(O)C[C@@H]1CCCN(CN2C(=O)C[C@H]2c2ccc(Cl)cc2)C1	ZINC000819380729	EF	On-Demand	Anodyne	GRIN2D	55	31
O=C(O)C[C@@H]1CCCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819380746	FD	On-Demand	Anodyne	HTR1A	16	51
O=C(O)C[C@@H]1CCCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819380746	FD	On-Demand	Anodyne	DRD2	15	45
O=C(O)C[C@@H]1CCCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819380746	FD	On-Demand	Anodyne	DRD4	32	44
O=C(O)C[C@@H]1CCCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819380746	FD	On-Demand	Anodyne	SLC6A1	110	36
O=C(O)C[C@@H]1CCCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819380746	FD	On-Demand	Anodyne	SSTR1	36	40
O=C(O)C[C@H]1CCCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819380748	FD	On-Demand	Anodyne	HTR1A	16	51
O=C(O)C[C@H]1CCCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819380748	FD	On-Demand	Anodyne	DRD2	15	45
O=C(O)C[C@H]1CCCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819380748	FD	On-Demand	Anodyne	DRD4	32	44
O=C(O)C[C@H]1CCCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819380748	FD	On-Demand	Anodyne	SLC6A1	110	36
O=C(O)C[C@H]1CCCN(CCC(=O)N2CCN(c3ccccn3)CC2)C1	ZINC000819380748	FD	On-Demand	Anodyne	SSTR1	36	40
O=C(O)C[C@@H]1CCCN(Cc2nnc(-c3c(Cl)cccc3Cl)o2)C1	ZINC000819380760	FH	On-Demand	Anodyne	SLC6A1	41	36
O=C(O)C[C@H]1CCCN(Cc2nnc(-c3c(Cl)cccc3Cl)o2)C1	ZINC000819380762	FH	On-Demand	Anodyne	SLC6A1	41	36
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819380764	FE	On-Demand	Anodyne	ADRB1	27	41
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819380764	FE	On-Demand	Anodyne	ACOX1	40	31
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819380764	FE	On-Demand	Anodyne	ABCB1	60	44
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819380766	FE	On-Demand	Anodyne	ADRB1	27	41
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819380766	FE	On-Demand	Anodyne	ACOX1	40	31
O=C(O)C[C@@H]1CCCN(C[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819380766	FE	On-Demand	Anodyne	ABCB1	60	44
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819380767	FE	On-Demand	Anodyne	ADRB1	27	41
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819380767	FE	On-Demand	Anodyne	ACOX1	40	31
O=C(O)C[C@H]1CCCN(C[C@H](O)COc2ccc(Br)cc2)C1	ZINC000819380767	FE	On-Demand	Anodyne	ABCB1	60	44
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819380769	FE	On-Demand	Anodyne	ADRB1	27	41
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819380769	FE	On-Demand	Anodyne	ACOX1	40	31
O=C(O)C[C@H]1CCCN(C[C@@H](O)COc2ccc(Br)cc2)C1	ZINC000819380769	FE	On-Demand	Anodyne	ABCB1	60	44
O=C(O)C[C@H]1CCCN(Cc2nnc(C(=O)Nc3ccc(F)cc3)s2)C1	ZINC000819380771	GF	On-Demand	Anodyne	CCR3	110	42
O=C(O)C[C@@H]1CCCN(Cc2nnc(C(=O)Nc3ccc(F)cc3)s2)C1	ZINC000819380773	GF	On-Demand	Anodyne	CCR3	110	42
COc1ccc(N2CC[C@H](CNCCC(=O)Nc3ccccc3)C2)cc1	ZINC000819380774	FG	On-Demand	Clean	CCR3	25	42
COc1ccc(N2CC[C@H](CNCCC(=O)Nc3ccccc3)C2)cc1	ZINC000819380774	FG	On-Demand	Clean	MTNR1A	15	41
COc1ccc(N2CC[C@H](CNCCC(=O)Nc3ccccc3)C2)cc1	ZINC000819380774	FG	On-Demand	Clean	MTNR1B	19	41
COc1ccc(N2CC[C@H](CNCCC(=O)Nc3ccccc3)C2)cc1	ZINC000819380774	FG	On-Demand	Clean	MCHR1	22	48
O=C(O)C[C@@H]1CCCN(Cc2nc3cc(F)ccc3o2)C1	ZINC000819380804	CF	On-Demand	Anodyne	CCR3	89	34
O=C(O)C[C@H]1CCCN(Cc2nc3cc(F)ccc3o2)C1	ZINC000819380805	CF	On-Demand	Anodyne	CCR3	89	34
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819380806	CE	On-Demand	Anodyne	SLC6A1	48	41
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819380806	CE	On-Demand	Anodyne	SLC6A3	32	43
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819380806	CE	On-Demand	Anodyne	CCR3	94	37
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819380807	CE	On-Demand	Anodyne	SLC6A1	48	41
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819380807	CE	On-Demand	Anodyne	SLC6A3	32	43
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819380807	CE	On-Demand	Anodyne	CCR3	94	37
O=C(O)C[C@H]1CCCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819380808	CE	On-Demand	Anodyne	SLC6A1	48	41
O=C(O)C[C@H]1CCCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819380808	CE	On-Demand	Anodyne	SLC6A3	32	43
O=C(O)C[C@H]1CCCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC000819380808	CE	On-Demand	Anodyne	CCR3	94	37
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819380809	CE	On-Demand	Anodyne	SLC6A1	48	41
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819380809	CE	On-Demand	Anodyne	SLC6A3	32	43
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC000819380809	CE	On-Demand	Anodyne	CCR3	94	37
O=C(O)C[C@H]1CCCN(Cc2c(O)nnn2-c2ccccc2)C1	ZINC000819380810	DD	On-Demand	Anodyne	SLC6A1	52	35
O=C(O)C[C@@H]1CCCN(Cc2c(O)nnn2-c2ccccc2)C1	ZINC000819380811	DD	On-Demand	Anodyne	SLC6A1	52	35
C[C@H](C[C@@H]1CCOC1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819380815	FF	On-Demand	Mild	PAPA1_CARPA	36	44
C[C@H](C[C@@H]1CCOC1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819380817	FF	On-Demand	Mild	PAPA1_CARPA	36	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(OC)cc1F)C2	ZINC000819380852	FE	On-Demand	Anodyne	P2RX7	41	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(OC)cc1F)C2	ZINC000819380853	FE	On-Demand	Anodyne	P2RX7	41	38
Cc1nn(C)cc1[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819380908	GF	On-Demand	Mild	PLG	17	40
Cc1nn(C)cc1[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819380908	GF	On-Demand	Mild	CELA1	18	40
Cc1nn(C)cc1[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819380909	GF	On-Demand	Mild	PLG	17	40
Cc1nn(C)cc1[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819380909	GF	On-Demand	Mild	CELA1	18	40
Cc1nn(C)cc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819380910	GF	On-Demand	Mild	PLG	17	40
Cc1nn(C)cc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819380910	GF	On-Demand	Mild	CELA1	18	40
Cc1nn(C)cc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819380911	GF	On-Demand	Mild	PLG	17	40
Cc1nn(C)cc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819380911	GF	On-Demand	Mild	CELA1	18	40
O=C(O)C[C@@H]1CCCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000819380948	DF	On-Demand	Bother	CCR3	21	41
O=C(O)C[C@H]1CCCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)C1	ZINC000819380950	DF	On-Demand	Bother	CCR3	21	41
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(OCCF)c1	ZINC000819380951	CF	On-Demand	Anodyne	EPHX2	20	42
O=C(O)C[C@@H]1CCCN(C[C@@H]2CN(c3ccccc3)C(=O)O2)C1	ZINC000819380952	DE	On-Demand	Anodyne	SLC6A1	83	34
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(OCCF)c1	ZINC000819380953	CF	On-Demand	Anodyne	EPHX2	20	42
O=C(O)C[C@H]1CCCN(C[C@H]2CN(c3ccccc3)C(=O)O2)C1	ZINC000819380954	DE	On-Demand	Anodyne	SLC6A1	83	34
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(OCCF)c1	ZINC000819380955	CF	On-Demand	Anodyne	EPHX2	20	42
O=C(O)C[C@H]1CCCN(C[C@@H]2CN(c3ccccc3)C(=O)O2)C1	ZINC000819380956	DE	On-Demand	Anodyne	SLC6A1	83	34
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(OCCF)c1	ZINC000819380957	CF	On-Demand	Anodyne	EPHX2	20	42
O=C(O)C[C@@H]1CCCN(C[C@H]2CN(c3ccccc3)C(=O)O2)C1	ZINC000819380959	DE	On-Demand	Anodyne	SLC6A1	83	34
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2cccnc2Cl)C1	ZINC000819380973	DD	On-Demand	Anodyne	G2YM83_BOTF4	58	35
O=C(O)C[C@H]1CCCN(CC(=O)Nc2cccnc2Cl)C1	ZINC000819380975	DD	On-Demand	Anodyne	G2YM83_BOTF4	58	35
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(C(C)=O)cc3)C2)cc1	ZINC000819380982	GF	On-Demand	Clean	ADRB2	33	40
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(C(C)=O)cc3)C2)cc1	ZINC000819380982	GF	On-Demand	Clean	ADRB1	55	42
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(C(C)=O)cc3)C2)cc1	ZINC000819380982	GF	On-Demand	Clean	ADRB3	41	44
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(C(C)=O)cc3)C2)cc1	ZINC000819380982	GF	On-Demand	Clean	ABCB1	28	49
O=C(O)C[C@H]1CCCN(CC(=O)Nc2nc(-c3ccccc3)cs2)C1	ZINC000819380985	FF	On-Demand	Anodyne	CCR3	41	36
O=C(O)C[C@H]1CCCN(CC(=O)Nc2nc(-c3ccccc3)cs2)C1	ZINC000819380985	FF	On-Demand	Anodyne	CPT1A	31	42
O=C(O)C[C@H]1CCCN(CC(=O)Nc2nc(-c3ccccc3)cs2)C1	ZINC000819380985	FF	On-Demand	Anodyne	ROCK1	21	42
O=C(O)C[C@H]1CCCN(CC(=O)Nc2nc(-c3ccccc3)cs2)C1	ZINC000819380985	FF	On-Demand	Anodyne	ROCK2	15	42
O=C(O)C[C@H]1CCCN(CC(=O)Nc2nc(-c3ccccc3)cs2)C1	ZINC000819380985	FF	On-Demand	Anodyne	SPHK1	42	36
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(C(C)=O)cc3)C2)cc1	ZINC000819380986	GF	On-Demand	Clean	ADRB2	33	40
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(C(C)=O)cc3)C2)cc1	ZINC000819380986	GF	On-Demand	Clean	ADRB1	55	42
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(C(C)=O)cc3)C2)cc1	ZINC000819380986	GF	On-Demand	Clean	ADRB3	41	44
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(C(C)=O)cc3)C2)cc1	ZINC000819380986	GF	On-Demand	Clean	ABCB1	28	49
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2nc(-c3ccccc3)cs2)C1	ZINC000819380987	FF	On-Demand	Anodyne	CCR3	41	36
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2nc(-c3ccccc3)cs2)C1	ZINC000819380987	FF	On-Demand	Anodyne	CPT1A	31	42
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2nc(-c3ccccc3)cs2)C1	ZINC000819380987	FF	On-Demand	Anodyne	ROCK1	21	42
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2nc(-c3ccccc3)cs2)C1	ZINC000819380987	FF	On-Demand	Anodyne	ROCK2	15	42
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2nc(-c3ccccc3)cs2)C1	ZINC000819380987	FF	On-Demand	Anodyne	SPHK1	42	36
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819381000	CF	On-Demand	Anodyne	ADRB1	26	41
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819381000	CF	On-Demand	Anodyne	ADRB3	40	41
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2cccc(Cl)c2)C1	ZINC000819381005	CF	On-Demand	Anodyne	ADRB1	26	41
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2cccc(Cl)c2)C1	ZINC000819381005	CF	On-Demand	Anodyne	ADRB3	40	41
O=C(O)C[C@H]1CCCN(C[C@H](O)c2cccc(Cl)c2)C1	ZINC000819381006	CF	On-Demand	Anodyne	ADRB1	26	41
O=C(O)C[C@H]1CCCN(C[C@H](O)c2cccc(Cl)c2)C1	ZINC000819381006	CF	On-Demand	Anodyne	ADRB3	40	41
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819381007	CF	On-Demand	Anodyne	ADRB1	26	41
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819381007	CF	On-Demand	Anodyne	ADRB3	40	41
O=C(O)C[C@@H]1CCCN(C[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819381008	CE	On-Demand	Anodyne	CCR3	47	34
O=C(O)C[C@@H]1CCCN(C[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819381009	CE	On-Demand	Anodyne	CCR3	47	34
O=C(O)C[C@H]1CCCN(C[C@@H](O)c2ccc(F)c(F)c2)C1	ZINC000819381010	CE	On-Demand	Anodyne	CCR3	47	34
O=C(O)C[C@H]1CCCN(C[C@H](O)c2ccc(F)c(F)c2)C1	ZINC000819381011	CE	On-Demand	Anodyne	CCR3	47	34
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2ccccc2C(=O)NC2CCCC2)C1	ZINC000819381012	GE	On-Demand	Anodyne	SLC6A1	45	31
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2ccccc2C(=O)NC2CCCC2)C1	ZINC000819381012	GE	On-Demand	Anodyne	CNR2	21	42
O=C(O)C[C@H]1CCCN(CC(=O)Nc2ccccc2C(=O)NC2CCCC2)C1	ZINC000819381013	GE	On-Demand	Anodyne	SLC6A1	45	31
O=C(O)C[C@H]1CCCN(CC(=O)Nc2ccccc2C(=O)NC2CCCC2)C1	ZINC000819381013	GE	On-Demand	Anodyne	CNR2	21	42
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COCc2ccccc2Cl)C1	ZINC000819381014	EE	On-Demand	Anodyne	SLC6A1	75	38
O=C(O)C[C@@H]1CCCN(C[C@@H](O)COCc2ccccc2Cl)C1	ZINC000819381014	EE	On-Demand	Anodyne	ABCB1	50	37
O=C(O)C[C@H]1CCCN(C[C@H](O)COCc2ccccc2Cl)C1	ZINC000819381015	EE	On-Demand	Anodyne	SLC6A1	75	38
O=C(O)C[C@H]1CCCN(C[C@H](O)COCc2ccccc2Cl)C1	ZINC000819381015	EE	On-Demand	Anodyne	ABCB1	50	37
O=C(O)C[C@H]1CCCN(C[C@@H](O)COCc2ccccc2Cl)C1	ZINC000819381016	EE	On-Demand	Anodyne	SLC6A1	75	38
O=C(O)C[C@H]1CCCN(C[C@@H](O)COCc2ccccc2Cl)C1	ZINC000819381016	EE	On-Demand	Anodyne	ABCB1	50	37
O=C(O)C[C@@H]1CCCN(C[C@H](O)COCc2ccccc2Cl)C1	ZINC000819381017	EE	On-Demand	Anodyne	SLC6A1	75	38
O=C(O)C[C@@H]1CCCN(C[C@H](O)COCc2ccccc2Cl)C1	ZINC000819381017	EE	On-Demand	Anodyne	ABCB1	50	37
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(C#N)cc3)C2)cc1	ZINC000819381027	GE	On-Demand	Mild	ADRB2	29	40
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(C#N)cc3)C2)cc1	ZINC000819381027	GE	On-Demand	Mild	ADRB1	42	40
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(C#N)cc3)C2)cc1	ZINC000819381027	GE	On-Demand	Mild	ADRB3	28	42
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(C#N)cc3)C2)cc1	ZINC000819381029	GE	On-Demand	Mild	ADRB2	29	40
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(C#N)cc3)C2)cc1	ZINC000819381029	GE	On-Demand	Mild	ADRB1	42	40
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(C#N)cc3)C2)cc1	ZINC000819381029	GE	On-Demand	Mild	ADRB3	28	42
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccccc3)C2)cc1	ZINC000819381037	FF	On-Demand	Clean	ADRB2	60	47
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccccc3)C2)cc1	ZINC000819381037	FF	On-Demand	Clean	ADRB1	80	46
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccccc3)C2)cc1	ZINC000819381037	FF	On-Demand	Clean	ADRB3	62	46
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccccc3)C2)cc1	ZINC000819381037	FF	On-Demand	Clean	ABCB1	42	41
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccccc3)C2)cc1	ZINC000819381039	FF	On-Demand	Clean	ADRB2	60	47
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccccc3)C2)cc1	ZINC000819381039	FF	On-Demand	Clean	ADRB1	80	46
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccccc3)C2)cc1	ZINC000819381039	FF	On-Demand	Clean	ADRB3	62	46
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccccc3)C2)cc1	ZINC000819381039	FF	On-Demand	Clean	ABCB1	42	41
O=C(O)C[C@@H]1CCCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819381044	EF	On-Demand	Anodyne	SLC6A1	71	36
O=C(O)C[C@@H]1CCCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819381044	EF	On-Demand	Anodyne	HRH3	32	50
O=C(O)C[C@@H]1CCCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819381044	EF	On-Demand	Anodyne	SIGMAR1	22	57
O=C(O)C[C@@H]1CCCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819381044	EF	On-Demand	Anodyne	L3MBTL3	94	54
O=C(O)C[C@H]1CCCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819381045	EF	On-Demand	Anodyne	SLC6A1	71	36
O=C(O)C[C@H]1CCCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819381045	EF	On-Demand	Anodyne	HRH3	32	50
O=C(O)C[C@H]1CCCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819381045	EF	On-Demand	Anodyne	SIGMAR1	22	57
O=C(O)C[C@H]1CCCN(Cc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000819381045	EF	On-Demand	Anodyne	L3MBTL3	94	54
O=C(O)C[C@@H]1CCCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819381046	FD	On-Demand	Anodyne	SLC6A1	53	34
O=C(O)C[C@@H]1CCCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819381046	FD	On-Demand	Anodyne	SIGMAR1	39	52
O=C(O)C[C@H]1CCCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819381048	FD	On-Demand	Anodyne	SLC6A1	53	34
O=C(O)C[C@H]1CCCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000819381048	FD	On-Demand	Anodyne	SIGMAR1	39	52
O=C(O)C[C@@H]1CCCN(CN2C(=O)C(=O)c3ccc(OC(F)(F)F)cc32)C1	ZINC000819381055	GE	On-Demand	Anodyne	CHRM5	15	42
O=C(O)C[C@H]1CCCN(CN2C(=O)C(=O)c3ccc(OC(F)(F)F)cc32)C1	ZINC000819381057	GE	On-Demand	Anodyne	CHRM5	15	42
O=C(O)C[C@@H]1CCCN(Cc2cccc(C(=O)NCc3ccco3)c2)C1	ZINC000819381090	FF	On-Demand	Anodyne	DRD4	21	40
O=C(O)C[C@@H]1CCCN(Cc2cccc(C(=O)NCc3ccco3)c2)C1	ZINC000819381090	FF	On-Demand	Anodyne	CHRM3	17	41
O=C(O)C[C@H]1CCCN(Cc2cccc(C(=O)NCc3ccco3)c2)C1	ZINC000819381091	FF	On-Demand	Anodyne	DRD4	21	40
O=C(O)C[C@H]1CCCN(Cc2cccc(C(=O)NCc3ccco3)c2)C1	ZINC000819381091	FF	On-Demand	Anodyne	CHRM3	17	41
O=C(O)C[C@H]1CCCN(CCC(=O)N2CCCCC2)C1	ZINC000819381096	CD	On-Demand	Anodyne	SLC6A1	48	33
O=C(O)C[C@@H]1CCCN(CCC(=O)N2CCCCC2)C1	ZINC000819381098	CD	On-Demand	Anodyne	SLC6A1	48	33
O=C(O)C[C@@H]1CCCN(CN2C(=O)C(=O)c3cc(Br)ccc32)C1	ZINC000819381099	GE	On-Demand	Anodyne	CASP3	55	39
O=C(O)C[C@@H]1CCCN(CN2C(=O)C(=O)c3cc(Br)ccc32)C1	ZINC000819381099	GE	On-Demand	Anodyne	ALDH1A1	23	45
O=C(O)C[C@@H]1CCCN(CN2C(=O)C(=O)c3cc(Br)ccc32)C1	ZINC000819381099	GE	On-Demand	Anodyne	CASP7	78	39
O=C(O)C[C@H]1CCCN(CN2C(=O)C(=O)c3cc(Br)ccc32)C1	ZINC000819381101	GE	On-Demand	Anodyne	CASP3	55	39
O=C(O)C[C@H]1CCCN(CN2C(=O)C(=O)c3cc(Br)ccc32)C1	ZINC000819381101	GE	On-Demand	Anodyne	ALDH1A1	23	45
O=C(O)C[C@H]1CCCN(CN2C(=O)C(=O)c3cc(Br)ccc32)C1	ZINC000819381101	GE	On-Demand	Anodyne	CASP7	78	39
O=C(O)C[C@H]1CCCN(CC(=O)Nc2ccccc2C(=O)NC2CC2)C1	ZINC000819381103	FD	On-Demand	Anodyne	SLC6A1	54	31
O=C(O)C[C@@H]1CCCN(CC(=O)Nc2ccccc2C(=O)NC2CC2)C1	ZINC000819381105	FD	On-Demand	Anodyne	SLC6A1	54	31
C#CCCCCNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819381171	CG	On-Demand	Mild	CRTM	46	43
COc1ccc(N2CC[C@H](CNCCC(=O)Nc3cc(C)on3)C2)cc1	ZINC000819381260	FE	On-Demand	Clean	PDK1	45	35
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(F)cc3)C2)cc1	ZINC000819381267	FF	On-Demand	Clean	ADRB2	39	41
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(F)cc3)C2)cc1	ZINC000819381267	FF	On-Demand	Clean	ADRB1	55	41
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(F)cc3)C2)cc1	ZINC000819381267	FF	On-Demand	Clean	ADRB3	38	43
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(F)cc3)C2)cc1	ZINC000819381267	FF	On-Demand	Clean	ABCB1	15	41
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(F)cc3)C2)cc1	ZINC000819381270	FF	On-Demand	Clean	ADRB2	39	41
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(F)cc3)C2)cc1	ZINC000819381270	FF	On-Demand	Clean	ADRB1	55	41
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(F)cc3)C2)cc1	ZINC000819381270	FF	On-Demand	Clean	ADRB3	38	43
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(F)cc3)C2)cc1	ZINC000819381270	FF	On-Demand	Clean	ABCB1	15	41
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(C)cc3)C2)cc1	ZINC000819381273	FF	On-Demand	Clean	ADRB2	38	44
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(C)cc3)C2)cc1	ZINC000819381273	FF	On-Demand	Clean	ADRB1	50	42
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(C)cc3)C2)cc1	ZINC000819381273	FF	On-Demand	Clean	ADRB3	35	44
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(C)cc3)C2)cc1	ZINC000819381274	FF	On-Demand	Clean	ADRB2	38	44
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(C)cc3)C2)cc1	ZINC000819381274	FF	On-Demand	Clean	ADRB1	50	42
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(C)cc3)C2)cc1	ZINC000819381274	FF	On-Demand	Clean	ADRB3	35	44
CCOc1ccc(OC[C@@H](O)CNCc2nn(CC)nc2C)cc1	ZINC000819381279	ED	On-Demand	Anodyne	ADRB2	34	43
CCOc1ccc(OC[C@@H](O)CNCc2nn(CC)nc2C)cc1	ZINC000819381279	ED	On-Demand	Anodyne	ADRB1	43	42
CCOc1ccc(OC[C@H](O)CNCc2nn(CC)nc2C)cc1	ZINC000819381280	ED	On-Demand	Anodyne	ADRB2	34	43
CCOc1ccc(OC[C@H](O)CNCc2nn(CC)nc2C)cc1	ZINC000819381280	ED	On-Demand	Anodyne	ADRB1	43	42
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(CC#N)cc3)C2)cc1	ZINC000819381296	GF	On-Demand	Mild	ADRB2	35	42
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(CC#N)cc3)C2)cc1	ZINC000819381296	GF	On-Demand	Mild	ADRB1	54	42
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccc(CC#N)cc3)C2)cc1	ZINC000819381296	GF	On-Demand	Mild	ADRB3	40	44
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(CC#N)cc3)C2)cc1	ZINC000819381299	GF	On-Demand	Mild	ADRB2	35	42
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(CC#N)cc3)C2)cc1	ZINC000819381299	GF	On-Demand	Mild	ADRB1	54	42
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccc(CC#N)cc3)C2)cc1	ZINC000819381299	GF	On-Demand	Mild	ADRB3	40	44
C=C[C@@H]1OCC[C@H]1CNC[C@H](O)c1cccnc1	ZINC000819381338	BD	On-Demand	Mild	ADRB3	72	40
C=C[C@@H]1OCC[C@H]1CNC[C@@H](O)c1cccnc1	ZINC000819381339	BD	On-Demand	Mild	ADRB3	72	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1ccc3c(c1)OCO3)C2	ZINC000819381346	GD	On-Demand	Anodyne	EDNRB	42	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1ccc3c(c1)OCO3)C2	ZINC000819381347	GD	On-Demand	Anodyne	EDNRB	42	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1ccccc1F)C2	ZINC000819381356	FE	On-Demand	Anodyne	ADRB1	42	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1ccccc1F)C2	ZINC000819381357	FE	On-Demand	Anodyne	ADRB1	42	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1ccc(F)cc1)C2	ZINC000819381387	FE	On-Demand	Anodyne	ADRB1	47	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1ccc(F)cc1)C2	ZINC000819381389	FE	On-Demand	Anodyne	ADRB1	47	42
Cc1c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cccc1C(F)(F)F	ZINC000819381399	GJ	On-Demand	Mild	PAPA1_CARPA	44	44
Cc1c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cccc1C(F)(F)F	ZINC000819381399	GJ	On-Demand	Mild	CCKAR	23	40
Cc1c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cccc1C(F)(F)F	ZINC000819381401	GJ	On-Demand	Mild	PAPA1_CARPA	44	44
Cc1c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cccc1C(F)(F)F	ZINC000819381401	GJ	On-Demand	Mild	CCKAR	23	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1C[C@H](C)O[C@H](c3ccsc3)C1)C2	ZINC000819381444	GF	On-Demand	Anodyne	NPBWR1	94	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1C[C@H](C)O[C@@H](c3ccsc3)C1)C2	ZINC000819381445	GF	On-Demand	Anodyne	NPBWR1	94	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1C[C@H](c3ccsc3)O[C@H](C)C1)C2	ZINC000819381446	GF	On-Demand	Anodyne	NPBWR1	94	35
COc1ccc(N2CC[C@H](CNC[C@@H](O)c3ccc(F)c(F)c3)C2)cc1	ZINC000819381522	FG	On-Demand	Clean	ADRB3	16	40
COc1ccc(N2CC[C@H](CNC[C@H](O)c3ccc(F)c(F)c3)C2)cc1	ZINC000819381524	FG	On-Demand	Clean	ADRB3	16	40
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccccc3Cl)C2)cc1	ZINC000819381562	GG	On-Demand	Clean	ADRB2	42	43
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccccc3Cl)C2)cc1	ZINC000819381562	GG	On-Demand	Clean	ADRB1	47	41
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccccc3Cl)C2)cc1	ZINC000819381562	GG	On-Demand	Clean	ADRB3	33	46
COc1ccc(N2CC[C@H](CNC[C@H](O)COc3ccccc3Cl)C2)cc1	ZINC000819381562	GG	On-Demand	Clean	ABCB1	45	36
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccccc3Cl)C2)cc1	ZINC000819381564	GG	On-Demand	Clean	ADRB2	42	43
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccccc3Cl)C2)cc1	ZINC000819381564	GG	On-Demand	Clean	ADRB1	47	41
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccccc3Cl)C2)cc1	ZINC000819381564	GG	On-Demand	Clean	ADRB3	33	46
COc1ccc(N2CC[C@H](CNC[C@@H](O)COc3ccccc3Cl)C2)cc1	ZINC000819381564	GG	On-Demand	Clean	ABCB1	45	36
COC(=O)[C@@]1(C)CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819381567	FD	On-Demand	Mild	PAPA1_CARPA	33	42
COC(=O)[C@@]1(C)CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819381570	FD	On-Demand	Mild	PAPA1_CARPA	33	42
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)c2ccccc2O)CC1	ZINC000819381571	ED	On-Demand	Anodyne	L3MBTL3	57	41
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)c2ccccc2O)CC1	ZINC000819381572	ED	On-Demand	Anodyne	L3MBTL3	57	41
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)c2ccccc2O)CC1	ZINC000819381573	ED	On-Demand	Anodyne	L3MBTL3	57	41
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)c2ccccc2O)CC1	ZINC000819381574	ED	On-Demand	Anodyne	L3MBTL3	57	41
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000819381584	DE	On-Demand	Anodyne	MLYCD	18	40
O=C(C(F)=C1CCC1)N1CCN(C(=O)c2ccc(O)cc2)CC1	ZINC000819381584	DE	On-Demand	Anodyne	L3MBTL3	64	40
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	OPRM1	50	44
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	OPRD1	41	43
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	MME	61	40
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	TACR1	17	41
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	FCER2	76	40
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	PAPA1_CARPA	48	39
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	CYSP_TRYCR	40	39
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	CTSL	48	39
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	NPFFR2	76	36
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	TIMP3	79	37
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	TACR3	18	41
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	CAPNS1	42	31
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	GRIA1	51	41
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	HLA-DRB1	51	34
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	REN	78	36
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	FURIN	49	36
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	CAPN1	57	37
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	CAPN2	41	35
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	CTSE	48	31
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	PROC	41	42
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	MMP1	21	40
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	QRFPR	41	32
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819381641	FC	On-Demand	Anodyne	NPFFR1	77	39
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	OPRM1	50	44
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	OPRD1	41	43
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	MME	61	40
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	TACR1	17	41
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	FCER2	76	40
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	PAPA1_CARPA	48	39
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	CYSP_TRYCR	40	39
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	CTSL	48	39
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	NPFFR2	76	36
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	TIMP3	79	37
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	TACR3	18	41
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	CAPNS1	42	31
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	GRIA1	51	41
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	HLA-DRB1	51	34
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	REN	78	36
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	FURIN	49	36
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	CAPN1	57	37
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	CAPN2	41	35
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	CTSE	48	31
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	PROC	41	42
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	MMP1	21	40
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	QRFPR	41	32
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819381642	FC	On-Demand	Anodyne	NPFFR1	77	39
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	OPRM1	50	44
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	OPRD1	41	43
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	MME	61	40
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	TACR1	17	41
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	FCER2	76	40
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	PAPA1_CARPA	48	39
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	CYSP_TRYCR	40	39
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	CTSL	48	39
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	NPFFR2	76	36
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	TIMP3	79	37
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	TACR3	18	41
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	CAPNS1	42	31
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	GRIA1	51	41
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	HLA-DRB1	51	34
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	REN	78	36
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	FURIN	49	36
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	CAPN1	57	37
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	CAPN2	41	35
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	CTSE	48	31
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	PROC	41	42
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	MMP1	21	40
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	QRFPR	41	32
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819381643	FC	On-Demand	Anodyne	NPFFR1	77	39
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	OPRM1	50	44
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	OPRD1	41	43
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	MME	61	40
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	TACR1	17	41
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	FCER2	76	40
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	PAPA1_CARPA	48	39
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	CYSP_TRYCR	40	39
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	CTSL	48	39
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	NPFFR2	76	36
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	TIMP3	79	37
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	TACR3	18	41
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	CAPNS1	42	31
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	GRIA1	51	41
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	HLA-DRB1	51	34
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	REN	78	36
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	FURIN	49	36
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	CAPN1	57	37
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	CAPN2	41	35
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	CTSE	48	31
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	PROC	41	42
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	MMP1	21	40
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	QRFPR	41	32
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819381644	FC	On-Demand	Anodyne	NPFFR1	77	39
COc1cc(F)c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819381673	GG	On-Demand	Mild	PAPA1_CARPA	42	48
COc1cc(F)c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819381675	GG	On-Demand	Mild	PAPA1_CARPA	42	48
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	ACE	48	42
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	OPRM1	62	50
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	OPRD1	59	48
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	MME	126	46
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	ANPEP	66	35
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	TACR1	26	44
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	FCER2	97	39
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	GRB2	60	38
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	CTSB	54	43
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	PAPA1_CARPA	71	44
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	CYSP_TRYCR	55	36
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	CTSK	17	42
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	CTSL	62	43
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	NPFFR2	76	36
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	TIMP3	80	38
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	TACR3	26	44
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	CAPNS1	63	38
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	MMP8	22	41
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	GRIA1	62	40
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	HLA-DRB1	76	39
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	FURIN	60	38
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	CTSS	25	43
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	CAPN1	83	40
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	MMP9	22	41
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	CAPN2	85	39
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	ACE2	63	35
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	MC1R	57	36
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	PROC	31	40
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	MMP1	28	43
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	FPR1	68	41
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	NPR	36	42
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	AMP1_PLAFQ	43	36
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	KISS1R	56	32
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	QRFPR	50	36
NC(=O)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381691	ED	On-Demand	Anodyne	NPFFR1	79	37
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	ACE	48	42
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	OPRM1	62	50
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	OPRD1	59	48
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	MME	126	46
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	ANPEP	66	35
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	TACR1	26	44
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	FCER2	97	39
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	GRB2	60	38
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	CTSB	54	43
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	PAPA1_CARPA	71	44
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	CYSP_TRYCR	55	36
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	CTSK	17	42
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	CTSL	62	43
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	NPFFR2	76	36
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	TIMP3	80	38
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	TACR3	26	44
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	CAPNS1	63	38
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	MMP8	22	41
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	GRIA1	62	40
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	HLA-DRB1	76	39
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	FURIN	60	38
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	CTSS	25	43
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	CAPN1	83	40
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	MMP9	22	41
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	CAPN2	85	39
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	ACE2	63	35
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	MC1R	57	36
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	PROC	31	40
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	MMP1	28	43
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	FPR1	68	41
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	NPR	36	42
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	AMP1_PLAFQ	43	36
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	KISS1R	56	32
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	QRFPR	50	36
NC(=O)CCNC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819381693	ED	On-Demand	Anodyne	NPFFR1	79	37
COc1ccc(CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1O	ZINC000819381801	GF	On-Demand	Mild	PAPA1_CARPA	53	45
COc1ccc(CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1O	ZINC000819381802	GF	On-Demand	Mild	PAPA1_CARPA	53	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCO[C@@H](c3ccsc3)C1)C2	ZINC000819381831	FF	On-Demand	Anodyne	NPBWR1	87	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCO[C@@H](c3ccsc3)C1)C2	ZINC000819381832	FF	On-Demand	Anodyne	NPBWR1	87	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCO[C@H](c3ccsc3)C1)C2	ZINC000819381833	FF	On-Demand	Anodyne	NPBWR1	87	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCO[C@H](c3ccsc3)C1)C2	ZINC000819381834	FF	On-Demand	Anodyne	NPBWR1	87	33
C#CCCCCNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819381868	CE	On-Demand	Mild	KCNK3	44	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1ccc(OC)cc1Cl)C2	ZINC000819381912	GF	On-Demand	Anodyne	MTNR1A	72	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1ccc(OC)cc1Cl)C2	ZINC000819381912	GF	On-Demand	Anodyne	MTNR1B	53	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1ccc(OC)cc1Cl)C2	ZINC000819381913	GF	On-Demand	Anodyne	MTNR1A	72	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1ccc(OC)cc1Cl)C2	ZINC000819381913	GF	On-Demand	Anodyne	MTNR1B	53	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1ccc(C)cc1)C2	ZINC000819381916	FE	On-Demand	Anodyne	ADRB2	23	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1ccc(C)cc1)C2	ZINC000819381916	FE	On-Demand	Anodyne	ADRB1	46	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1ccc(C)cc1)C2	ZINC000819381916	FE	On-Demand	Anodyne	ACOX1	44	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1ccc(C)cc1)C2	ZINC000819381917	FE	On-Demand	Anodyne	ADRB2	23	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1ccc(C)cc1)C2	ZINC000819381917	FE	On-Demand	Anodyne	ADRB1	46	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1ccc(C)cc1)C2	ZINC000819381917	FE	On-Demand	Anodyne	ACOX1	44	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000819381947	GG	On-Demand	Anodyne	CCR2	80	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000819381948	GG	On-Demand	Anodyne	CCR2	80	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)c1ccc(Br)cc1)C2	ZINC000819381991	GF	On-Demand	Anodyne	SLC6A3	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)c1ccc(Br)cc1)C2	ZINC000819381992	GF	On-Demand	Anodyne	SLC6A3	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)c1ccc(Cl)cc1)C2	ZINC000819382082	FF	On-Demand	Anodyne	SLC6A3	32	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1cccc3ccccc13)C2	ZINC000819382084	GG	On-Demand	Anodyne	ADRB2	26	51
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1cccc3ccccc13)C2	ZINC000819382084	GG	On-Demand	Anodyne	ADRB1	45	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1cccc3ccccc13)C2	ZINC000819382084	GG	On-Demand	Anodyne	ADRB3	15	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1cccc3ccccc13)C2	ZINC000819382088	GG	On-Demand	Anodyne	ADRB2	26	51
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1cccc3ccccc13)C2	ZINC000819382088	GG	On-Demand	Anodyne	ADRB1	45	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1cccc3ccccc13)C2	ZINC000819382088	GG	On-Demand	Anodyne	ADRB3	15	44
O=C(NC[C@@H](O)c1ccccc1)C(F)=C1CCC1	ZINC000819382138	BE	On-Demand	Anodyne	CAPN2	27	40
O=C(NC[C@H](O)c1ccccc1)C(F)=C1CCC1	ZINC000819382140	BE	On-Demand	Anodyne	CAPN2	27	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1cccc(C)c1)C2	ZINC000819382153	FE	On-Demand	Anodyne	ADRB2	21	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1cccc(C)c1)C2	ZINC000819382153	FE	On-Demand	Anodyne	ADRB1	33	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1cccc(C)c1)C2	ZINC000819382154	FE	On-Demand	Anodyne	ADRB2	21	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1cccc(C)c1)C2	ZINC000819382154	FE	On-Demand	Anodyne	ADRB1	33	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1ccc(Cl)cc1)C2	ZINC000819382199	GF	On-Demand	Anodyne	ADRB1	45	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1ccc(Cl)cc1)C2	ZINC000819382200	GF	On-Demand	Anodyne	ADRB1	45	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)COc1cccc3ccccc13)C2	ZINC000819382206	GF	On-Demand	Anodyne	ADRB2	30	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)COc1cccc3ccccc13)C2	ZINC000819382206	GF	On-Demand	Anodyne	ADRB3	19	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)COc1cccc3ccccc13)C2	ZINC000819382207	GF	On-Demand	Anodyne	ADRB2	30	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)COc1cccc3ccccc13)C2	ZINC000819382207	GF	On-Demand	Anodyne	ADRB3	19	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)COc1cccc3ccccc13)C2	ZINC000819382208	GF	On-Demand	Anodyne	ADRB2	30	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)COc1cccc3ccccc13)C2	ZINC000819382208	GF	On-Demand	Anodyne	ADRB3	19	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)COc1cccc3ccccc13)C2	ZINC000819382209	GF	On-Demand	Anodyne	ADRB2	30	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)COc1cccc3ccccc13)C2	ZINC000819382209	GF	On-Demand	Anodyne	ADRB3	19	47
O=C(NC[C@@H](O)COc1cccc(F)c1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819382283	GG	On-Demand	Anodyne	ADRB2	19	43
O=C(NC[C@@H](O)COc1cccc(F)c1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819382283	GG	On-Demand	Anodyne	ADRB1	38	43
O=C(NC[C@@H](O)COc1cccc(F)c1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819382283	GG	On-Demand	Anodyne	ADRB3	20	40
O=C(NC[C@@H](O)COc1cccc(F)c1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819382283	GG	On-Demand	Anodyne	PDS	49	39
O=C(NC[C@H](O)COc1cccc(F)c1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819382284	GG	On-Demand	Anodyne	ADRB2	19	43
O=C(NC[C@H](O)COc1cccc(F)c1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819382284	GG	On-Demand	Anodyne	ADRB1	38	43
O=C(NC[C@H](O)COc1cccc(F)c1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819382284	GG	On-Demand	Anodyne	ADRB3	20	40
O=C(NC[C@H](O)COc1cccc(F)c1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819382284	GG	On-Demand	Anodyne	PDS	49	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H](O)c1ccc2ccccc2c1	ZINC000819382295	FF	On-Demand	Anodyne	PAPA1_CARPA	21	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H](O)c1ccc2ccccc2c1	ZINC000819382296	FF	On-Demand	Anodyne	PAPA1_CARPA	21	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1ccc3ccccc3c1)C2	ZINC000819382340	GG	On-Demand	Anodyne	ADRB2	25	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1ccc3ccccc3c1)C2	ZINC000819382340	GG	On-Demand	Anodyne	ADRB1	43	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1ccc3ccccc3c1)C2	ZINC000819382340	GG	On-Demand	Anodyne	ACOX1	50	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1ccc3ccccc3c1)C2	ZINC000819382342	GG	On-Demand	Anodyne	ADRB2	25	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1ccc3ccccc3c1)C2	ZINC000819382342	GG	On-Demand	Anodyne	ADRB1	43	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1ccc3ccccc3c1)C2	ZINC000819382342	GG	On-Demand	Anodyne	ACOX1	50	36
C[C@H](CC(=O)NCCc1ccc(Cl)nc1)n1cccn1	ZINC000819382343	CE	On-Demand	Anodyne	NACHRBETA2	48	34
C[C@@H](CC(=O)NCCc1ccc(Cl)nc1)n1cccn1	ZINC000819382344	CE	On-Demand	Anodyne	NACHRBETA2	48	34
C=C[C@@H]1OCC[C@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819382369	CF	On-Demand	Mild	ADRB1	28	41
C=C[C@@H]1OCC[C@H]1CNC[C@@H](O)c1cccc(Cl)c1	ZINC000819382369	CF	On-Demand	Mild	ADRB3	40	41
C=C[C@@H]1OCC[C@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819382370	CF	On-Demand	Mild	ADRB1	28	41
C=C[C@@H]1OCC[C@H]1CNC[C@H](O)c1cccc(Cl)c1	ZINC000819382370	CF	On-Demand	Mild	ADRB3	40	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1ccc(CC#N)cc1)C2	ZINC000819382375	GD	On-Demand	Mild	ADRB1	51	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1ccc(CC#N)cc1)C2	ZINC000819382378	GD	On-Demand	Mild	ADRB1	51	36
C=CCn1cc(CNC[C@@H](O)c2cccnc2)nn1	ZINC000819382379	CC	On-Demand	Mild	ADRB3	66	38
C=CCn1cc(CNC[C@H](O)c2cccnc2)nn1	ZINC000819382380	CC	On-Demand	Mild	ADRB3	66	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)c1cccnc1)C2	ZINC000819382383	DD	On-Demand	Anodyne	ADRB3	71	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)c1cccnc1)C2	ZINC000819382386	DD	On-Demand	Anodyne	ADRB3	71	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)COc1ccccc1F)C2	ZINC000819382419	FD	On-Demand	Anodyne	ADRB2	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)COc1ccccc1F)C2	ZINC000819382420	FD	On-Demand	Anodyne	ADRB2	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)COc1ccccc1F)C2	ZINC000819382421	FD	On-Demand	Anodyne	ADRB2	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)COc1ccccc1F)C2	ZINC000819382422	FD	On-Demand	Anodyne	ADRB2	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000819382450	FF	On-Demand	Anodyne	CACNA1B	45	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000819382450	FF	On-Demand	Anodyne	CCR2	80	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000819382451	FF	On-Demand	Anodyne	CACNA1B	45	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000819382451	FF	On-Demand	Anodyne	CCR2	80	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000819382452	FF	On-Demand	Anodyne	CACNA1B	45	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000819382452	FF	On-Demand	Anodyne	CCR2	80	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000819382453	FF	On-Demand	Anodyne	CACNA1B	45	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)c1cccc(C(F)(F)F)c1)C2	ZINC000819382453	FF	On-Demand	Anodyne	CCR2	80	37
O=[N+]([O-])c1cccc([C@H](O)CNC2C[C@@H]3C[C@H]3C2)c1	ZINC000819382458	CE	On-Demand	Bother	CACNA1C	52	37
O=[N+]([O-])c1cccc([C@H](O)CNC2C[C@@H]3C[C@H]3C2)c1	ZINC000819382458	CE	On-Demand	Bother	CACNA1D	83	35
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000819382459	CE	On-Demand	Bother	CACNA1C	52	37
O=[N+]([O-])c1cccc([C@H](O)CN[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000819382459	CE	On-Demand	Bother	CACNA1D	83	35
O=[N+]([O-])c1cccc([C@H](O)CNC2C[C@H]3C[C@@H]3C2)c1	ZINC000819382460	CE	On-Demand	Bother	CACNA1C	52	37
O=[N+]([O-])c1cccc([C@H](O)CNC2C[C@H]3C[C@@H]3C2)c1	ZINC000819382460	CE	On-Demand	Bother	CACNA1D	83	35
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000819382461	CE	On-Demand	Bother	CACNA1C	52	37
O=[N+]([O-])c1cccc([C@@H](O)CN[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000819382461	CE	On-Demand	Bother	CACNA1D	83	35
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819382464	GD	On-Demand	Anodyne	ADRB2	29	48
COCCc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819382464	GD	On-Demand	Anodyne	ADRB1	59	48
COCCc1ccc(OC[C@H](O)CN[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819382465	GD	On-Demand	Anodyne	ADRB2	29	48
COCCc1ccc(OC[C@H](O)CN[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819382465	GD	On-Demand	Anodyne	ADRB1	59	48
COCCc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819382467	GD	On-Demand	Anodyne	ADRB2	29	48
COCCc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819382467	GD	On-Demand	Anodyne	ADRB1	59	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)C2	ZINC000819382468	GD	On-Demand	Bother	CACNA1D	43	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)C2	ZINC000819382469	GD	On-Demand	Bother	CACNA1D	43	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)COc1cccc([N+](=O)[O-])c1)C2	ZINC000819382470	GD	On-Demand	Bother	CACNA1D	43	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)COc1cccc([N+](=O)[O-])c1)C2	ZINC000819382471	GD	On-Demand	Bother	CACNA1D	43	32
COc1ccc(OC)c([C@H](O)CNC(=O)c2cc(Br)oc2C)c1	ZINC000819382472	GF	On-Demand	Anodyne	MTNR1A	27	43
O=C(NC[C@@H](O)c1ccccc1)c1cc2c(cn1)OCCO2	ZINC000819382474	DD	On-Demand	Anodyne	SCD1	22	45
O=C(NC[C@@H](O)c1ccccc1)c1cc2c(cn1)OCCO2	ZINC000819382474	DD	On-Demand	Anodyne	SCD	32	45
O=C(NC[C@H](O)c1ccccc1)c1cc2c(cn1)OCCO2	ZINC000819382475	DD	On-Demand	Anodyne	SCD1	22	45
O=C(NC[C@H](O)c1ccccc1)c1cc2c(cn1)OCCO2	ZINC000819382475	DD	On-Demand	Anodyne	SCD	32	45
CC(C)(C)OC(=O)C(C)(C)CCNC[C@H](O)c1ccc(C#N)cc1	ZINC000819382524	EF	On-Demand	Mild	CTRB_BOVIN	45	33
CC(C)(C)OC(=O)C(C)(C)CCNC[C@@H](O)c1ccc(C#N)cc1	ZINC000819382536	EF	On-Demand	Mild	CTRB_BOVIN	45	33
O=C(Nc1ccc(O)cc1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819382544	EF	On-Demand	Anodyne	EPHX2	25	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1ccccc1C(C)C)C2	ZINC000819382560	GG	On-Demand	Anodyne	ADRB2	19	48
CCC(CC)(CNC[C@H](O)c1ccc(C#N)cc1)C(=O)OC(C)(C)C	ZINC000819382564	EG	On-Demand	Mild	CTRB_BOVIN	45	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1ccccc1C(C)C)C2	ZINC000819382565	GG	On-Demand	Anodyne	ADRB2	19	48
CCC(CC)(CNC[C@@H](O)c1ccc(C#N)cc1)C(=O)OC(C)(C)C	ZINC000819382567	EG	On-Demand	Mild	CTRB_BOVIN	45	32
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819382579	EF	On-Demand	Anodyne	DRD4	24	40
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819382579	EF	On-Demand	Anodyne	SIGMAR1	22	44
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819382582	EF	On-Demand	Anodyne	DRD4	24	40
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819382582	EF	On-Demand	Anodyne	SIGMAR1	22	44
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819382584	EF	On-Demand	Anodyne	DRD4	24	40
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819382584	EF	On-Demand	Anodyne	SIGMAR1	22	44
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819382586	EF	On-Demand	Anodyne	DRD4	24	40
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819382586	EF	On-Demand	Anodyne	SIGMAR1	22	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819382595	GE	On-Demand	Anodyne	ADRB2	17	51
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819382595	GE	On-Demand	Anodyne	ADRB1	31	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819382595	GE	On-Demand	Anodyne	SLC6A4	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819382598	GE	On-Demand	Anodyne	ADRB2	17	51
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819382598	GE	On-Demand	Anodyne	ADRB1	31	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819382598	GE	On-Demand	Anodyne	SLC6A4	15	41
O=C(Nc1ccc(O)cc1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819382606	EE	On-Demand	Anodyne	EPHX2	15	44
O=C(Nc1ccc(O)cc1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819382608	EE	On-Demand	Anodyne	EPHX2	15	44
O=C(Nc1ccc(O)cc1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819382610	EE	On-Demand	Anodyne	EPHX2	15	44
O=C(Nc1ccc(O)cc1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819382612	EE	On-Demand	Anodyne	EPHX2	15	44
CC(C)(C)OC(=O)N1CC[C@H](Oc2ccnc(CNCCS(C)(=O)=O)c2)C1	ZINC000819382614	GD	On-Demand	Anodyne	GPR119	75	44
CC(C)(C)OC(=O)N1CC[C@@H](Oc2ccnc(CNCCS(C)(=O)=O)c2)C1	ZINC000819382616	GD	On-Demand	Anodyne	GPR119	75	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNCCCCS(C)(=O)=O)CC1	ZINC000819382625	GD	On-Demand	Anodyne	GPR119	42	48
CC(C)(C)OC(=O)N1CCC([C@H](O)CNCCCCS(C)(=O)=O)CC1	ZINC000819382626	GD	On-Demand	Anodyne	GPR119	42	48
CCC(CC)(CNC[C@H](O)c1cccnc1)C(=O)OC(C)(C)C	ZINC000819382646	DF	On-Demand	Anodyne	ADRB2	21	41
CCC(CC)(CNC[C@H](O)c1cccnc1)C(=O)OC(C)(C)C	ZINC000819382646	DF	On-Demand	Anodyne	ADRB1	24	43
CCC(CC)(CNC[C@H](O)c1cccnc1)C(=O)OC(C)(C)C	ZINC000819382646	DF	On-Demand	Anodyne	ADRB3	94	44
CCC(CC)(CNC[C@@H](O)c1cccnc1)C(=O)OC(C)(C)C	ZINC000819382648	DF	On-Demand	Anodyne	ADRB2	21	41
CCC(CC)(CNC[C@@H](O)c1cccnc1)C(=O)OC(C)(C)C	ZINC000819382648	DF	On-Demand	Anodyne	ADRB1	24	43
CCC(CC)(CNC[C@@H](O)c1cccnc1)C(=O)OC(C)(C)C	ZINC000819382648	DF	On-Demand	Anodyne	ADRB3	94	44
O[C@H](CN[C@@H]1CCOC1)c1ccc(Cl)c(F)c1	ZINC000819382654	CD	On-Demand	Anodyne	MAPK1	47	41
O[C@@H](CN[C@@H]1CCOC1)c1ccc(Cl)c(F)c1	ZINC000819382656	CD	On-Demand	Anodyne	MAPK1	47	41
CN1C(=O)CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819382665	CD	On-Demand	Anodyne	ADRB1	32	41
CN1C(=O)CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819382665	CD	On-Demand	Anodyne	ADRB3	48	45
CN1C(=O)CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819382665	CD	On-Demand	Anodyne	IGF1R	29	42
CN1C(=O)CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819382665	CD	On-Demand	Anodyne	CYP3A4	49	37
CN1C(=O)CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819382667	CD	On-Demand	Anodyne	ADRB1	32	41
CN1C(=O)CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819382667	CD	On-Demand	Anodyne	ADRB3	48	45
CN1C(=O)CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819382667	CD	On-Demand	Anodyne	IGF1R	29	42
CN1C(=O)CC[C@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819382667	CD	On-Demand	Anodyne	CYP3A4	49	37
CN1C(=O)CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819382669	CD	On-Demand	Anodyne	ADRB1	32	41
CN1C(=O)CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819382669	CD	On-Demand	Anodyne	ADRB3	48	45
CN1C(=O)CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819382669	CD	On-Demand	Anodyne	IGF1R	29	42
CN1C(=O)CC[C@H](NC[C@H](O)c2cccc(Cl)c2)C1=O	ZINC000819382669	CD	On-Demand	Anodyne	CYP3A4	49	37
CN1C(=O)CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819382670	CD	On-Demand	Anodyne	ADRB1	32	41
CN1C(=O)CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819382670	CD	On-Demand	Anodyne	ADRB3	48	45
CN1C(=O)CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819382670	CD	On-Demand	Anodyne	IGF1R	29	42
CN1C(=O)CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1=O	ZINC000819382670	CD	On-Demand	Anodyne	CYP3A4	49	37
C=CCn1cc(CNC[C@H](O)c2cccc(Cl)c2)nn1	ZINC000819382676	CD	On-Demand	Mild	ADRB1	23	40
C=CCn1cc(CNC[C@H](O)c2cccc(Cl)c2)nn1	ZINC000819382676	CD	On-Demand	Mild	ADRB3	34	40
C=CCn1cc(CNC[C@@H](O)c2cccc(Cl)c2)nn1	ZINC000819382677	CD	On-Demand	Mild	ADRB1	23	40
C=CCn1cc(CNC[C@@H](O)c2cccc(Cl)c2)nn1	ZINC000819382677	CD	On-Demand	Mild	ADRB3	34	40
C=CCn1cc(CNC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)nn1	ZINC000819382685	FD	On-Demand	Mild	GPR119	26	41
C=CCn1cc(CNC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)nn1	ZINC000819382687	FD	On-Demand	Mild	GPR119	26	41
O=C(CCc1cccc(OC(F)F)c1)NCCc1ccc(Cl)nc1	ZINC000819382688	FH	On-Demand	Anodyne	PDS	41	34
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819382693	FG	On-Demand	Anodyne	ADRB2	89	46
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819382693	FG	On-Demand	Anodyne	ADRB1	90	58
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819382693	FG	On-Demand	Anodyne	ADRB3	121	58
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cccc(Cl)c1	ZINC000819382693	FG	On-Demand	Anodyne	SLC6A5	20	40
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819382695	FG	On-Demand	Anodyne	ADRB2	89	46
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819382695	FG	On-Demand	Anodyne	ADRB1	90	58
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819382695	FG	On-Demand	Anodyne	ADRB3	121	58
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819382695	FG	On-Demand	Anodyne	SLC6A5	20	40
O=C(NC[C@@H](O)c1ccc(F)cc1)c1cc2c(cn1)OCCO2	ZINC000819382726	DD	On-Demand	Anodyne	SCD1	18	42
O=C(NC[C@@H](O)c1ccc(F)cc1)c1cc2c(cn1)OCCO2	ZINC000819382726	DD	On-Demand	Anodyne	SCD	28	41
O=C(NC[C@H](O)c1ccc(F)cc1)c1cc2c(cn1)OCCO2	ZINC000819382727	DD	On-Demand	Anodyne	SCD1	18	42
O=C(NC[C@H](O)c1ccc(F)cc1)c1cc2c(cn1)OCCO2	ZINC000819382727	DD	On-Demand	Anodyne	SCD	28	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)COc1ccc3ccccc3c1)C2	ZINC000819382733	GF	On-Demand	Anodyne	ADRB2	35	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)COc1ccc3ccccc3c1)C2	ZINC000819382733	GF	On-Demand	Anodyne	ACOX1	51	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)COc1ccc3ccccc3c1)C2	ZINC000819382734	GF	On-Demand	Anodyne	ADRB2	35	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)COc1ccc3ccccc3c1)C2	ZINC000819382734	GF	On-Demand	Anodyne	ACOX1	51	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)COc1ccc3ccccc3c1)C2	ZINC000819382735	GF	On-Demand	Anodyne	ADRB2	35	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)COc1ccc3ccccc3c1)C2	ZINC000819382735	GF	On-Demand	Anodyne	ACOX1	51	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)COc1ccc3ccccc3c1)C2	ZINC000819382736	GF	On-Demand	Anodyne	ADRB2	35	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)COc1ccc3ccccc3c1)C2	ZINC000819382736	GF	On-Demand	Anodyne	ACOX1	51	36
COc1ccc(OC)c([C@H](O)CNC(=O)[C@H]2CCCC[C@@H]2C)c1	ZINC000819382743	DF	On-Demand	Anodyne	MTNR1A	44	45
COc1ccc(OC)c([C@H](O)CNC(=O)[C@H]2CCCC[C@@H]2C)c1	ZINC000819382743	DF	On-Demand	Anodyne	MTNR1B	40	43
COc1ccc(OC)c([C@H](O)CNC(=O)[C@H]2CCCC[C@H]2C)c1	ZINC000819382744	DF	On-Demand	Anodyne	MTNR1A	44	45
COc1ccc(OC)c([C@H](O)CNC(=O)[C@H]2CCCC[C@H]2C)c1	ZINC000819382744	DF	On-Demand	Anodyne	MTNR1B	40	43
COc1ccc(OC)c([C@H](O)CNC(=O)[C@@H]2CCCC[C@@H]2C)c1	ZINC000819382745	DF	On-Demand	Anodyne	MTNR1A	44	45
COc1ccc(OC)c([C@H](O)CNC(=O)[C@@H]2CCCC[C@@H]2C)c1	ZINC000819382745	DF	On-Demand	Anodyne	MTNR1B	40	43
COc1ccc(OC)c([C@H](O)CNC(=O)[C@@H]2CCCC[C@H]2C)c1	ZINC000819382746	DF	On-Demand	Anodyne	MTNR1A	44	45
COc1ccc(OC)c([C@H](O)CNC(=O)[C@@H]2CCCC[C@H]2C)c1	ZINC000819382746	DF	On-Demand	Anodyne	MTNR1B	40	43
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)COc2cccc(F)c2)c1	ZINC000819382760	GD	On-Demand	Anodyne	ADRB2	15	45
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)COc2cccc(F)c2)c1	ZINC000819382760	GD	On-Demand	Anodyne	MTNR1A	21	40
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)COc2cccc(F)c2)c1	ZINC000819382760	GD	On-Demand	Anodyne	MTNR1B	23	40
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)COc2cccc(F)c2)c1	ZINC000819382760	GD	On-Demand	Anodyne	PDS	39	40
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)COc2cccc(F)c2)c1	ZINC000819382762	GD	On-Demand	Anodyne	ADRB2	15	45
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)COc2cccc(F)c2)c1	ZINC000819382762	GD	On-Demand	Anodyne	MTNR1A	21	40
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)COc2cccc(F)c2)c1	ZINC000819382762	GD	On-Demand	Anodyne	MTNR1B	23	40
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)COc2cccc(F)c2)c1	ZINC000819382762	GD	On-Demand	Anodyne	PDS	39	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819382769	FD	On-Demand	Anodyne	PDS	49	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819382770	FD	On-Demand	Anodyne	PDS	49	41
COc1ccc(OC)c([C@H](O)CNC(=O)[C@H]2C[C@H]2c2ccc(C)cc2)c1	ZINC000819382801	FF	On-Demand	Anodyne	MTNR1A	19	42
COc1ccc(OC)c([C@H](O)CNC(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)c1	ZINC000819382802	FF	On-Demand	Anodyne	MTNR1A	19	42
Cc1ccccc1[C@@H](O)CNCCNC(=O)CCCc1ccccc1	ZINC000819382811	EF	On-Demand	Anodyne	ADRB2	55	41
Cc1ccccc1[C@@H](O)CNCCNC(=O)CCCc1ccccc1	ZINC000819382811	EF	On-Demand	Anodyne	ADRB1	48	41
Cc1ccccc1[C@@H](O)CNCCNC(=O)CCCc1ccccc1	ZINC000819382811	EF	On-Demand	Anodyne	ADRB3	44	39
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(F)cc1Cl	ZINC000819382817	GG	On-Demand	Anodyne	ADRB2	54	37
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(F)cc1Cl	ZINC000819382817	GG	On-Demand	Anodyne	ADRB1	45	40
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819382818	GG	On-Demand	Anodyne	ADRB2	54	37
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(F)cc1Cl	ZINC000819382818	GG	On-Demand	Anodyne	ADRB1	45	40
COc1cccc(C=C2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c1	ZINC000819382826	EG	On-Demand	Anodyne	DRD4	41	31
COc1cccc(C=C2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c1	ZINC000819382827	EG	On-Demand	Anodyne	DRD4	41	31
COc1cccc(C=C2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c1	ZINC000819382828	EG	On-Demand	Anodyne	DRD4	41	31
COc1cccc(C=C2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c1	ZINC000819382829	EG	On-Demand	Anodyne	DRD4	41	31
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1cccnc1	ZINC000819382849	ED	On-Demand	Anodyne	ADRB2	57	58
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1cccnc1	ZINC000819382849	ED	On-Demand	Anodyne	ADRB1	73	53
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1cccnc1	ZINC000819382849	ED	On-Demand	Anodyne	ADRB3	159	63
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1cccnc1	ZINC000819382849	ED	On-Demand	Anodyne	TBXAS1	65	43
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1cccnc1	ZINC000819382849	ED	On-Demand	Anodyne	PTAFR	36	49
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1cccnc1	ZINC000819382849	ED	On-Demand	Anodyne	KCNA5	19	56
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1cccnc1	ZINC000819382849	ED	On-Demand	Anodyne	CES1D	44	31
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cccnc1	ZINC000819382851	ED	On-Demand	Anodyne	ADRB2	57	58
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cccnc1	ZINC000819382851	ED	On-Demand	Anodyne	ADRB1	73	53
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cccnc1	ZINC000819382851	ED	On-Demand	Anodyne	ADRB3	159	63
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cccnc1	ZINC000819382851	ED	On-Demand	Anodyne	TBXAS1	65	43
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cccnc1	ZINC000819382851	ED	On-Demand	Anodyne	PTAFR	36	49
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cccnc1	ZINC000819382851	ED	On-Demand	Anodyne	KCNA5	19	56
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cccnc1	ZINC000819382851	ED	On-Demand	Anodyne	CES1D	44	31
Cc1c(NC(=O)/C=C/[C@@H]2CCCO2)cccc1C(F)(F)F	ZINC000819382862	CH	On-Demand	Anodyne	RBP4	46	38
Cc1c(NC(=O)/C=C\[C@H]2CCCO2)cccc1C(F)(F)F	ZINC000819382863	CH	On-Demand	Anodyne	RBP4	46	38
Cc1c(NC(=O)/C=C\[C@@H]2CCCO2)cccc1C(F)(F)F	ZINC000819382864	CH	On-Demand	Anodyne	RBP4	46	38
Cc1c(NC(=O)/C=C/[C@H]2CCCO2)cccc1C(F)(F)F	ZINC000819382866	CH	On-Demand	Anodyne	RBP4	46	38
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccccc1F	ZINC000819382870	EF	On-Demand	Anodyne	ADRB2	40	41
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccccc1F	ZINC000819382870	EF	On-Demand	Anodyne	ADRB1	40	41
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccccc1F	ZINC000819382872	EF	On-Demand	Anodyne	ADRB2	40	41
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccccc1F	ZINC000819382872	EF	On-Demand	Anodyne	ADRB1	40	41
CC(C)(C)OC(=O)N1CCC(c2cc(CNCC3(O)CCC3)on2)CC1	ZINC000819382874	FF	On-Demand	Anodyne	GPR119	40	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C#N)C1	ZINC000819382897	FF	On-Demand	Mild	CTSD	91	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C#N)C1	ZINC000819382897	FF	On-Demand	Mild	PGC	62	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C#N)C1	ZINC000819382897	FF	On-Demand	Mild	PAPA1_CARPA	53	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C#N)C1	ZINC000819382897	FF	On-Demand	Mild	CTSL	18	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C#N)C1	ZINC000819382897	FF	On-Demand	Mild	BACE2	51	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C#N)C1	ZINC000819382897	FF	On-Demand	Mild	REN	87	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C#N)C1	ZINC000819382897	FF	On-Demand	Mild	REN1	18	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C#N)C1	ZINC000819382897	FF	On-Demand	Mild	BACE1	74	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C#N)C1	ZINC000819382897	FF	On-Demand	Mild	FPR1	52	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@@H]1CC[C@H](C#N)C1	ZINC000819382897	FF	On-Demand	Mild	PLM1_PLAFA	30	41
COc1ccc(OC)c([C@H](O)CNC(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)c1	ZINC000819382914	FF	On-Demand	Anodyne	MTNR1A	19	42
COc1ccc(OC)c([C@H](O)CNC(=O)[C@H]2C[C@@H]2c2ccc(C)cc2)c1	ZINC000819382918	FF	On-Demand	Anodyne	MTNR1A	19	42
Cn1cc([C@@H]2OCC[C@H]2NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	ZINC000819382921	GD	On-Demand	Anodyne	GPR119	42	44
Cn1cc([C@@H]2OCC[C@H]2NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cn1	ZINC000819382923	GD	On-Demand	Anodyne	GPR119	42	44
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)COc2cccc(F)c2)c1	ZINC000819382958	FD	On-Demand	Anodyne	ADRB2	30	43
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)COc2cccc(F)c2)c1	ZINC000819382958	FD	On-Demand	Anodyne	ADRB1	57	43
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)COc2cccc(F)c2)c1	ZINC000819382958	FD	On-Demand	Anodyne	GRIN1	17	44
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)COc2cccc(F)c2)c1	ZINC000819382958	FD	On-Demand	Anodyne	ADRB3	33	43
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)COc2cccc(F)c2)c1	ZINC000819382958	FD	On-Demand	Anodyne	PDS	78	46
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)COc2cccc(F)c2)c1	ZINC000819382961	FD	On-Demand	Anodyne	ADRB2	30	43
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)COc2cccc(F)c2)c1	ZINC000819382961	FD	On-Demand	Anodyne	ADRB1	57	43
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)COc2cccc(F)c2)c1	ZINC000819382961	FD	On-Demand	Anodyne	GRIN1	17	44
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)COc2cccc(F)c2)c1	ZINC000819382961	FD	On-Demand	Anodyne	ADRB3	33	43
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)COc2cccc(F)c2)c1	ZINC000819382961	FD	On-Demand	Anodyne	PDS	78	46
CC(C)(C)OC(=O)C(C)(C)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819382981	EH	On-Demand	Anodyne	ADRB2	55	42
CC(C)(C)OC(=O)C(C)(C)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819382981	EH	On-Demand	Anodyne	ADRB1	64	52
CC(C)(C)OC(=O)C(C)(C)CCNC[C@H](O)c1cccc(Cl)c1	ZINC000819382981	EH	On-Demand	Anodyne	ADRB3	79	52
CC(C)(C)OC(=O)C(C)(C)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819382984	EH	On-Demand	Anodyne	ADRB2	55	42
CC(C)(C)OC(=O)C(C)(C)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819382984	EH	On-Demand	Anodyne	ADRB1	64	52
CC(C)(C)OC(=O)C(C)(C)CCNC[C@@H](O)c1cccc(Cl)c1	ZINC000819382984	EH	On-Demand	Anodyne	ADRB3	79	52
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(C(F)(F)F)c1C)C2	ZINC000819382992	FH	On-Demand	Anodyne	RBP4	48	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(C(F)(F)F)c1C)C2	ZINC000819382995	FH	On-Demand	Anodyne	RBP4	48	32
COC(=O)c1cnc([C@@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819383008	FE	On-Demand	Bother	CACNA1C	55	37
COC(=O)c1cnc([C@@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819383008	FE	On-Demand	Bother	ADRB3	58	35
COC(=O)c1cnc([C@@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819383008	FE	On-Demand	Bother	CACNA1D	80	37
COC(=O)c1cnc([C@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819383011	FE	On-Demand	Bother	CACNA1C	55	37
COC(=O)c1cnc([C@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819383011	FE	On-Demand	Bother	ADRB3	58	35
COC(=O)c1cnc([C@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819383011	FE	On-Demand	Bother	CACNA1D	80	37
COC(=O)c1cnc([C@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819383014	FE	On-Demand	Bother	CACNA1C	55	37
COC(=O)c1cnc([C@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819383014	FE	On-Demand	Bother	ADRB3	58	35
COC(=O)c1cnc([C@H](C)NC[C@@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819383014	FE	On-Demand	Bother	CACNA1D	80	37
COC(=O)c1cnc([C@@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819383017	FE	On-Demand	Bother	CACNA1C	55	37
COC(=O)c1cnc([C@@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819383017	FE	On-Demand	Bother	ADRB3	58	35
COC(=O)c1cnc([C@@H](C)NC[C@H](O)c2cccc([N+](=O)[O-])c2)s1	ZINC000819383017	FE	On-Demand	Bother	CACNA1D	80	37
CCOc1ccc(OC[C@H](O)CNC[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819383033	GE	On-Demand	Anodyne	ADRB1	47	38
CCOc1ccc(OC[C@@H](O)CNC[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819383036	GE	On-Demand	Anodyne	ADRB1	47	38
CCOc1ccc(OC[C@@H](O)CNC[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819383039	GE	On-Demand	Anodyne	ADRB1	47	38
CCOc1ccc(OC[C@H](O)CNC[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819383041	GE	On-Demand	Anodyne	ADRB1	47	38
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1ccccc1	ZINC000819383071	BE	On-Demand	Mild	ADRB3	20	41
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1ccccc1	ZINC000819383072	BE	On-Demand	Mild	ADRB3	20	41
O=C(NC[C@@H](O)COc1cccc(F)c1)C(F)=C1CCC1	ZINC000819383093	CE	On-Demand	Anodyne	ADRB2	24	42
O=C(NC[C@@H](O)COc1cccc(F)c1)C(F)=C1CCC1	ZINC000819383093	CE	On-Demand	Anodyne	ADRB1	40	42
O=C(NC[C@@H](O)COc1cccc(F)c1)C(F)=C1CCC1	ZINC000819383093	CE	On-Demand	Anodyne	PDS	48	42
O=C(NC[C@H](O)COc1cccc(F)c1)C(F)=C1CCC1	ZINC000819383094	CE	On-Demand	Anodyne	ADRB2	24	42
O=C(NC[C@H](O)COc1cccc(F)c1)C(F)=C1CCC1	ZINC000819383094	CE	On-Demand	Anodyne	ADRB1	40	42
O=C(NC[C@H](O)COc1cccc(F)c1)C(F)=C1CCC1	ZINC000819383094	CE	On-Demand	Anodyne	PDS	48	42
CCOc1ccc(OC[C@@H](O)CN[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819383101	GE	On-Demand	Anodyne	ADRB2	29	40
CCOc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819383102	GE	On-Demand	Anodyne	ADRB2	29	40
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819383109	GG	On-Demand	Anodyne	ADRB2	62	42
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819383109	GG	On-Demand	Anodyne	ADRB1	52	44
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819383109	GG	On-Demand	Anodyne	ADRB3	70	44
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819383110	GG	On-Demand	Anodyne	ADRB2	62	42
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819383110	GG	On-Demand	Anodyne	ADRB1	52	44
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819383110	GG	On-Demand	Anodyne	ADRB3	70	44
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cc(F)ccc1F	ZINC000819383111	FF	On-Demand	Anodyne	ADRB2	44	39
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cc(F)ccc1F	ZINC000819383111	FF	On-Demand	Anodyne	ADRB1	44	39
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1cc(F)ccc1F	ZINC000819383112	FF	On-Demand	Anodyne	ADRB2	44	39
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1cc(F)ccc1F	ZINC000819383112	FF	On-Demand	Anodyne	ADRB1	44	39
Cn1cc([C@@H]2OCC[C@H]2NC[C@@H](O)c2cccc(Cl)c2)cn1	ZINC000819383113	DE	On-Demand	Anodyne	ADRB1	23	40
Cn1cc([C@@H]2OCC[C@H]2NC[C@@H](O)c2cccc(Cl)c2)cn1	ZINC000819383113	DE	On-Demand	Anodyne	ADRB3	38	40
Cn1cc([C@@H]2OCC[C@H]2NC[C@@H](O)c2cccc(Cl)c2)cn1	ZINC000819383113	DE	On-Demand	Anodyne	IGF1R	29	41
Cn1cc([C@@H]2OCC[C@H]2NC[C@@H](O)c2cccc(Cl)c2)cn1	ZINC000819383113	DE	On-Demand	Anodyne	CYP3A4	49	37
Cn1cc([C@@H]2OCC[C@H]2NC[C@H](O)c2cccc(Cl)c2)cn1	ZINC000819383114	DE	On-Demand	Anodyne	ADRB1	23	40
Cn1cc([C@@H]2OCC[C@H]2NC[C@H](O)c2cccc(Cl)c2)cn1	ZINC000819383114	DE	On-Demand	Anodyne	ADRB3	38	40
Cn1cc([C@@H]2OCC[C@H]2NC[C@H](O)c2cccc(Cl)c2)cn1	ZINC000819383114	DE	On-Demand	Anodyne	IGF1R	29	41
Cn1cc([C@@H]2OCC[C@H]2NC[C@H](O)c2cccc(Cl)c2)cn1	ZINC000819383114	DE	On-Demand	Anodyne	CYP3A4	49	37
O=C(CCCc1ccccc1)NCCNC[C@H](O)C1CC1	ZINC000819383115	CD	On-Demand	Anodyne	PREP	44	39
O=C(CCCc1ccccc1)NCCNC[C@H](O)C1CC1	ZINC000819383115	CD	On-Demand	Anodyne	MMP2	65	36
O=C(CCCc1ccccc1)NCCNC[C@H](O)C1CC1	ZINC000819383115	CD	On-Demand	Anodyne	MMP3	24	40
O=C(CCCc1ccccc1)NCCNC[C@@H](O)C1CC1	ZINC000819383116	CD	On-Demand	Anodyne	PREP	44	39
O=C(CCCc1ccccc1)NCCNC[C@@H](O)C1CC1	ZINC000819383116	CD	On-Demand	Anodyne	MMP2	65	36
O=C(CCCc1ccccc1)NCCNC[C@@H](O)C1CC1	ZINC000819383116	CD	On-Demand	Anodyne	MMP3	24	40
CC(C)(C)OC(=O)N1CC[C@@H](Oc2ccnc(CNC[C@H](O)C3CC3)c2)C1	ZINC000819383125	GE	On-Demand	Anodyne	GPR119	51	40
CC(C)(C)OC(=O)N1CC[C@@H](Oc2ccnc(CNC[C@@H](O)C3CC3)c2)C1	ZINC000819383126	GE	On-Demand	Anodyne	GPR119	51	40
CC(C)(C)OC(=O)N1CC[C@H](Oc2ccnc(CNC[C@H](O)C3CC3)c2)C1	ZINC000819383127	GE	On-Demand	Anodyne	GPR119	51	40
CC(C)(C)OC(=O)N1CC[C@H](Oc2ccnc(CNC[C@@H](O)C3CC3)c2)C1	ZINC000819383128	GE	On-Demand	Anodyne	GPR119	51	40
CN1C(=O)CC[C@@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1=O	ZINC000819383129	ED	On-Demand	Anodyne	P2RX7	25	40
CN1C(=O)CC[C@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1=O	ZINC000819383130	ED	On-Demand	Anodyne	P2RX7	25	40
CN1C(=O)CC[C@H](NC[C@H](O)c2ccc(Cl)cc2Cl)C1=O	ZINC000819383131	ED	On-Demand	Anodyne	P2RX7	25	40
CN1C(=O)CC[C@@H](NC[C@@H](O)c2ccc(Cl)cc2Cl)C1=O	ZINC000819383132	ED	On-Demand	Anodyne	P2RX7	25	40
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)C(F)=C1CCC1	ZINC000819383144	EH	On-Demand	Anodyne	DRD4	26	42
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)C(F)=C1CCC1	ZINC000819383144	EH	On-Demand	Anodyne	SIGMAR1	33	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)C(F)=C1CCC1	ZINC000819383145	EH	On-Demand	Anodyne	DRD4	26	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)C(F)=C1CCC1	ZINC000819383145	EH	On-Demand	Anodyne	SIGMAR1	33	40
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)C(F)=C1CCC1	ZINC000819383146	EH	On-Demand	Anodyne	DRD4	26	42
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)C(F)=C1CCC1	ZINC000819383146	EH	On-Demand	Anodyne	SIGMAR1	33	40
CCOc1ccc(OC[C@H](O)CN[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819383147	GE	On-Demand	Anodyne	ADRB2	29	40
CCOc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819383149	GE	On-Demand	Anodyne	ADRB2	29	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@@H]2C[C@H]2C1	ZINC000819383150	FF	On-Demand	Anodyne	CTSD	122	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@@H]2C[C@H]2C1	ZINC000819383150	FF	On-Demand	Anodyne	PGC	65	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@@H]2C[C@H]2C1	ZINC000819383150	FF	On-Demand	Anodyne	PAPA1_CARPA	44	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@@H]2C[C@H]2C1	ZINC000819383150	FF	On-Demand	Anodyne	CTSK	19	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@@H]2C[C@H]2C1	ZINC000819383150	FF	On-Demand	Anodyne	CTSL	24	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@@H]2C[C@H]2C1	ZINC000819383150	FF	On-Demand	Anodyne	PGA	47	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@@H]2C[C@H]2C1	ZINC000819383150	FF	On-Demand	Anodyne	BACE2	60	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@@H]2C[C@H]2C1	ZINC000819383150	FF	On-Demand	Anodyne	TACR3	16	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@@H]2C[C@H]2C1	ZINC000819383150	FF	On-Demand	Anodyne	REN	93	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@@H]2C[C@H]2C1	ZINC000819383150	FF	On-Demand	Anodyne	REN1	24	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@@H]2C[C@H]2C1	ZINC000819383150	FF	On-Demand	Anodyne	BACE1	101	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@@H]2C[C@H]2C1	ZINC000819383150	FF	On-Demand	Anodyne	FPR1	56	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@@H]2C[C@H]2C1	ZINC000819383150	FF	On-Demand	Anodyne	PLM1_PLAFA	37	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@@H]2C[C@H]2C1	ZINC000819383150	FF	On-Demand	Anodyne	PLM2_PLAFA	48	35
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@H]2C[C@@H]2C1	ZINC000819383151	FF	On-Demand	Anodyne	CTSD	122	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@H]2C[C@@H]2C1	ZINC000819383151	FF	On-Demand	Anodyne	PGC	65	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@H]2C[C@@H]2C1	ZINC000819383151	FF	On-Demand	Anodyne	PAPA1_CARPA	44	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@H]2C[C@@H]2C1	ZINC000819383151	FF	On-Demand	Anodyne	CTSK	19	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@H]2C[C@@H]2C1	ZINC000819383151	FF	On-Demand	Anodyne	CTSL	24	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@H]2C[C@@H]2C1	ZINC000819383151	FF	On-Demand	Anodyne	PGA	47	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@H]2C[C@@H]2C1	ZINC000819383151	FF	On-Demand	Anodyne	BACE2	60	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@H]2C[C@@H]2C1	ZINC000819383151	FF	On-Demand	Anodyne	TACR3	16	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@H]2C[C@@H]2C1	ZINC000819383151	FF	On-Demand	Anodyne	REN	93	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@H]2C[C@@H]2C1	ZINC000819383151	FF	On-Demand	Anodyne	REN1	24	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@H]2C[C@@H]2C1	ZINC000819383151	FF	On-Demand	Anodyne	BACE1	101	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@H]2C[C@@H]2C1	ZINC000819383151	FF	On-Demand	Anodyne	FPR1	56	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@H]2C[C@@H]2C1	ZINC000819383151	FF	On-Demand	Anodyne	PLM1_PLAFA	37	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNC1C[C@H]2C[C@@H]2C1	ZINC000819383151	FF	On-Demand	Anodyne	PLM2_PLAFA	48	35
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819383152	FF	On-Demand	Anodyne	CTSD	122	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819383152	FF	On-Demand	Anodyne	PGC	65	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819383152	FF	On-Demand	Anodyne	PAPA1_CARPA	44	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819383152	FF	On-Demand	Anodyne	CTSK	19	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819383152	FF	On-Demand	Anodyne	CTSL	24	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819383152	FF	On-Demand	Anodyne	PGA	47	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819383152	FF	On-Demand	Anodyne	BACE2	60	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819383152	FF	On-Demand	Anodyne	TACR3	16	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819383152	FF	On-Demand	Anodyne	REN	93	50
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819383152	FF	On-Demand	Anodyne	REN1	24	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819383152	FF	On-Demand	Anodyne	BACE1	101	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819383152	FF	On-Demand	Anodyne	FPR1	56	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819383152	FF	On-Demand	Anodyne	PLM1_PLAFA	37	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000819383152	FF	On-Demand	Anodyne	PLM2_PLAFA	48	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)c1ccc(Cl)cc1)C2	ZINC000819383195	EF	On-Demand	Anodyne	ADRB3	17	42
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1nc(-c2ccc(Br)cc2)no1	ZINC000819383196	GG	On-Demand	Anodyne	UL26	51	32
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1nc(-c2ccc(Br)cc2)no1	ZINC000819383196	GG	On-Demand	Anodyne	SCAF_EBVB9	49	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)c1ccc(Cl)cc1)C2	ZINC000819383197	EF	On-Demand	Anodyne	ADRB3	17	42
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1nc(-c2ccc(Br)cc2)no1	ZINC000819383198	GG	On-Demand	Anodyne	UL26	51	32
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1nc(-c2ccc(Br)cc2)no1	ZINC000819383198	GG	On-Demand	Anodyne	SCAF_EBVB9	49	32
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1nc(-c2ccc(Br)cc2)no1	ZINC000819383200	GG	On-Demand	Anodyne	UL26	51	32
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1nc(-c2ccc(Br)cc2)no1	ZINC000819383200	GG	On-Demand	Anodyne	SCAF_EBVB9	49	32
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1nc(-c2ccc(Br)cc2)no1	ZINC000819383202	GG	On-Demand	Anodyne	UL26	51	32
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1nc(-c2ccc(Br)cc2)no1	ZINC000819383202	GG	On-Demand	Anodyne	SCAF_EBVB9	49	32
Cc1cc(F)ccc1[C@@H](O)CNCCNC(=O)CCCc1ccccc1	ZINC000819383215	FF	On-Demand	Anodyne	ADRB2	63	40
Cc1cc(F)ccc1[C@@H](O)CNCCNC(=O)CCCc1ccccc1	ZINC000819383215	FF	On-Demand	Anodyne	ADRB1	50	40
O=C(NC[C@H](O)CN1CCc2ccccc2C1)C(F)=C1CCC1	ZINC000819383216	DD	On-Demand	Anodyne	NOD2	40	34
O=C(NC[C@@H](O)CN1CCc2ccccc2C1)C(F)=C1CCC1	ZINC000819383218	DD	On-Demand	Anodyne	NOD2	40	34
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(F)cc1F	ZINC000819383223	FF	On-Demand	Anodyne	ADRB2	67	41
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(F)cc1F	ZINC000819383223	FF	On-Demand	Anodyne	ADRB1	55	41
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(F)cc1F	ZINC000819383223	FF	On-Demand	Anodyne	ADRB3	40	39
O=C(NC[C@H](O)c1ccc2ccccc2c1)C(F)=C1CCC1	ZINC000819383224	CG	On-Demand	Anodyne	CAPN2	17	41
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(F)cc1F	ZINC000819383225	FF	On-Demand	Anodyne	ADRB2	67	41
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(F)cc1F	ZINC000819383225	FF	On-Demand	Anodyne	ADRB1	55	41
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(F)cc1F	ZINC000819383225	FF	On-Demand	Anodyne	ADRB3	40	39
O=C(NC[C@@H](O)c1ccc2ccccc2c1)C(F)=C1CCC1	ZINC000819383226	CG	On-Demand	Anodyne	CAPN2	17	41
CC(=O)Nc1cccc(CC(=O)N2CCC(CC(C)C)CC2)c1	ZINC000819383248	DG	On-Demand	Anodyne	HTR1D	22	42
CC(=O)Nc1cccc(CC(=O)N2CCC(CC(C)C)CC2)c1	ZINC000819383248	DG	On-Demand	Anodyne	GRIN2B	37	43
CC(=O)Nc1cccc(CC(=O)N2CCC(CC(C)C)CC2)c1	ZINC000819383248	DG	On-Demand	Anodyne	CCR3	57	39
CC(=O)Nc1cccc(CC(=O)N2CCC(CC(C)C)CC2)c1	ZINC000819383248	DG	On-Demand	Anodyne	EPHX2	19	41
CC(=O)Nc1cccc(CC(=O)N2CCC(CC(C)C)CC2)c1	ZINC000819383248	DG	On-Demand	Anodyne	ST14	66	36
O[C@H](CNC1C[C@@H]2C[C@H]2C1)c1cccc(Cl)c1	ZINC000819383251	CF	On-Demand	Anodyne	ADRB1	35	46
O[C@H](CNC1C[C@@H]2C[C@H]2C1)c1cccc(Cl)c1	ZINC000819383251	CF	On-Demand	Anodyne	ADRB3	54	51
O[C@H](CNC1C[C@@H]2C[C@H]2C1)c1cccc(Cl)c1	ZINC000819383251	CF	On-Demand	Anodyne	CYP3A4	47	37
O[C@H](CNC1C[C@H]2C[C@@H]2C1)c1cccc(Cl)c1	ZINC000819383254	CF	On-Demand	Anodyne	ADRB1	35	46
O[C@H](CNC1C[C@H]2C[C@@H]2C1)c1cccc(Cl)c1	ZINC000819383254	CF	On-Demand	Anodyne	ADRB3	54	51
O[C@H](CNC1C[C@H]2C[C@@H]2C1)c1cccc(Cl)c1	ZINC000819383254	CF	On-Demand	Anodyne	CYP3A4	47	37
O[C@@H](CN[C@H]1C[C@@H]2C[C@@H]2C1)c1cccc(Cl)c1	ZINC000819383256	CF	On-Demand	Anodyne	ADRB1	35	46
O[C@@H](CN[C@H]1C[C@@H]2C[C@@H]2C1)c1cccc(Cl)c1	ZINC000819383256	CF	On-Demand	Anodyne	ADRB3	54	51
O[C@@H](CN[C@H]1C[C@@H]2C[C@@H]2C1)c1cccc(Cl)c1	ZINC000819383256	CF	On-Demand	Anodyne	CYP3A4	47	37
O[C@H](CN[C@H]1C[C@@H]2C[C@@H]2C1)c1cccc(Cl)c1	ZINC000819383258	CF	On-Demand	Anodyne	ADRB1	35	46
O[C@H](CN[C@H]1C[C@@H]2C[C@@H]2C1)c1cccc(Cl)c1	ZINC000819383258	CF	On-Demand	Anodyne	ADRB3	54	51
O[C@H](CN[C@H]1C[C@@H]2C[C@@H]2C1)c1cccc(Cl)c1	ZINC000819383258	CF	On-Demand	Anodyne	CYP3A4	47	37
O[C@H](CNC1C[C@@H]2C[C@H]2C1)c1cccnc1	ZINC000819383260	BD	On-Demand	Anodyne	ADRB2	19	41
O[C@H](CNC1C[C@@H]2C[C@H]2C1)c1cccnc1	ZINC000819383260	BD	On-Demand	Anodyne	ADRB1	22	41
O[C@H](CNC1C[C@@H]2C[C@H]2C1)c1cccnc1	ZINC000819383260	BD	On-Demand	Anodyne	ADRB3	86	50
O[C@H](CNC1C[C@H]2C[C@@H]2C1)c1cccnc1	ZINC000819383263	BD	On-Demand	Anodyne	ADRB2	19	41
O[C@H](CNC1C[C@H]2C[C@@H]2C1)c1cccnc1	ZINC000819383263	BD	On-Demand	Anodyne	ADRB1	22	41
O[C@H](CNC1C[C@H]2C[C@@H]2C1)c1cccnc1	ZINC000819383263	BD	On-Demand	Anodyne	ADRB3	86	50
O[C@@H](CN[C@H]1C[C@@H]2C[C@@H]2C1)c1cccnc1	ZINC000819383264	BD	On-Demand	Anodyne	ADRB2	19	41
O[C@@H](CN[C@H]1C[C@@H]2C[C@@H]2C1)c1cccnc1	ZINC000819383264	BD	On-Demand	Anodyne	ADRB1	22	41
O[C@@H](CN[C@H]1C[C@@H]2C[C@@H]2C1)c1cccnc1	ZINC000819383264	BD	On-Demand	Anodyne	ADRB3	86	50
O[C@H](CN[C@H]1C[C@@H]2C[C@@H]2C1)c1cccnc1	ZINC000819383266	BD	On-Demand	Anodyne	ADRB2	19	41
O[C@H](CN[C@H]1C[C@@H]2C[C@@H]2C1)c1cccnc1	ZINC000819383266	BD	On-Demand	Anodyne	ADRB1	22	41
O[C@H](CN[C@H]1C[C@@H]2C[C@@H]2C1)c1cccnc1	ZINC000819383266	BD	On-Demand	Anodyne	ADRB3	86	50
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1ccccc1C)C2	ZINC000819383295	FE	On-Demand	Anodyne	ADRB2	18	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1ccccc1C)C2	ZINC000819383295	FE	On-Demand	Anodyne	ADRB1	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1ccccc1C)C2	ZINC000819383298	FE	On-Demand	Anodyne	ADRB2	18	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1ccccc1C)C2	ZINC000819383298	FE	On-Demand	Anodyne	ADRB1	40	31
O=C(NC[C@H](O)c1ccco1)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819383302	GG	On-Demand	Anodyne	CNR1	51	31
O=C(NC[C@@H](O)c1ccco1)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819383309	GG	On-Demand	Anodyne	CNR1	51	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)COc1ccccc1Cl)C2	ZINC000819383310	GF	On-Demand	Anodyne	ADRB2	19	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)COc1ccccc1Cl)C2	ZINC000819383312	GF	On-Demand	Anodyne	ADRB2	19	46
O[C@H](CN[C@H]1C[C@@H]2C[C@@H]2C1)c1ccc(Cl)c(F)c1	ZINC000819383328	CF	On-Demand	Anodyne	ADRB3	19	40
O[C@H](CNC1C[C@H]2C[C@@H]2C1)c1ccc(Cl)c(F)c1	ZINC000819383330	CF	On-Demand	Anodyne	ADRB3	19	40
O[C@@H](CN[C@H]1C[C@@H]2C[C@@H]2C1)c1ccc(Cl)c(F)c1	ZINC000819383332	CF	On-Demand	Anodyne	ADRB3	19	40
O[C@H](CNC1C[C@@H]2C[C@H]2C1)c1ccc(Cl)c(F)c1	ZINC000819383336	CF	On-Demand	Anodyne	ADRB3	19	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](O)c1ccc(F)cc1)C2	ZINC000819383340	FD	On-Demand	Anodyne	SLC6A3	37	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](O)c1ccc(F)cc1)C2	ZINC000819383342	FD	On-Demand	Anodyne	SLC6A3	37	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](O)c1ccc(F)cc1)C2	ZINC000819383345	FD	On-Demand	Anodyne	SLC6A3	37	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](O)c1ccc(F)cc1)C2	ZINC000819383347	FD	On-Demand	Anodyne	SLC6A3	37	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819383368	FF	On-Demand	Anodyne	ADRB1	32	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819383368	FF	On-Demand	Anodyne	SLC6A3	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819383368	FF	On-Demand	Anodyne	ADRB3	51	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)C2	ZINC000819383368	FF	On-Demand	Anodyne	CYP3A4	46	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819383369	FF	On-Demand	Anodyne	ADRB1	32	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819383369	FF	On-Demand	Anodyne	SLC6A3	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819383369	FF	On-Demand	Anodyne	ADRB3	51	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](CNC[C@H](O)c1cccc(Cl)c1)C2	ZINC000819383369	FF	On-Demand	Anodyne	CYP3A4	46	34
O=C(c1ccc(O)cc1)C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819383388	EF	On-Demand	Anodyne	L3MBTL3	52	34
O=C(c1ccc(O)cc1)C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819383389	EF	On-Demand	Anodyne	L3MBTL3	52	34
O=C(c1ccc(O)cc1)C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819383390	EF	On-Demand	Anodyne	L3MBTL3	52	34
O=C(c1ccc(O)cc1)C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819383391	EF	On-Demand	Anodyne	L3MBTL3	52	34
COC(=O)[C@@H](C)NC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819383428	GD	On-Demand	Anodyne	SSTR2	40	33
COC(=O)[C@@H](C)NC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819383429	GD	On-Demand	Anodyne	SSTR2	40	33
CC(C)(C)OC(=O)N1CC[C@H](Oc2ccnc(CNCCC#N)c2)C1	ZINC000819383453	EE	On-Demand	Mild	GPR119	46	40
CC(C)(C)OC(=O)N1CC[C@@H](Oc2ccnc(CNCCC#N)c2)C1	ZINC000819383454	EE	On-Demand	Mild	GPR119	46	40
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccco2)c1	ZINC000819383512	DD	On-Demand	Anodyne	ADRB2	43	35
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccco2)c1	ZINC000819383512	DD	On-Demand	Anodyne	KCNK3	21	42
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccco2)c1	ZINC000819383514	DD	On-Demand	Anodyne	ADRB2	43	35
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccco2)c1	ZINC000819383514	DD	On-Demand	Anodyne	KCNK3	21	42
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H](O)COc1cccc(F)c1	ZINC000819383537	DD	On-Demand	Anodyne	ADRB1	24	41
O=C(/C=C/[C@@H]1CCCO1)NC[C@H](O)COc1cccc(F)c1	ZINC000819383538	DD	On-Demand	Anodyne	ADRB1	24	41
O=C(/C=C\[C@@H]1CCCO1)NC[C@H](O)COc1cccc(F)c1	ZINC000819383539	DD	On-Demand	Anodyne	ADRB1	24	41
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H](O)COc1cccc(F)c1	ZINC000819383540	DD	On-Demand	Anodyne	ADRB1	24	41
C=C(C)C(C)(C)C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819383551	CE	On-Demand	Mild	ADRB2	24	41
C=C(C)C(C)(C)C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819383551	CE	On-Demand	Mild	ADRB1	31	41
C=C(C)C(C)(C)C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819383551	CE	On-Demand	Mild	PDS	67	44
C=C(C)C(C)(C)C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819383552	CE	On-Demand	Mild	ADRB2	24	41
C=C(C)C(C)(C)C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819383552	CE	On-Demand	Mild	ADRB1	31	41
C=C(C)C(C)(C)C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819383552	CE	On-Demand	Mild	PDS	67	44
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)COc1cccc(F)c1	ZINC000819383557	GF	On-Demand	Anodyne	ABCB1	21	42
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)COc1cccc(F)c1	ZINC000819383557	GF	On-Demand	Anodyne	PDS	58	44
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)COc1cccc(F)c1	ZINC000819383558	GF	On-Demand	Anodyne	ABCB1	21	42
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)COc1cccc(F)c1	ZINC000819383558	GF	On-Demand	Anodyne	PDS	58	44
COc1cccc([S@@](=O)CC(=O)NCCc2ccc(Cl)nc2)c1	ZINC000819383626	FE	On-Demand	Anodyne	MTNR1A	60	41
COc1cccc([S@@](=O)CC(=O)NCCc2ccc(Cl)nc2)c1	ZINC000819383626	FE	On-Demand	Anodyne	MTNR1B	60	41
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1ccccc1	ZINC000819383635	EG	On-Demand	Anodyne	ADRB1	34	42
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1ccccc1	ZINC000819383635	EG	On-Demand	Anodyne	ADRB3	47	42
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1ccccc1	ZINC000819383635	EG	On-Demand	Anodyne	PLA2G4A	28	44
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1ccccc1	ZINC000819383635	EG	On-Demand	Anodyne	FFAR1	34	40
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1ccccc1	ZINC000819383635	EG	On-Demand	Anodyne	CRTM	52	38
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1ccccc1	ZINC000819383635	EG	On-Demand	Anodyne	PDS	48	34
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1ccccc1	ZINC000819383636	EG	On-Demand	Anodyne	ADRB1	34	42
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1ccccc1	ZINC000819383636	EG	On-Demand	Anodyne	ADRB3	47	42
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1ccccc1	ZINC000819383636	EG	On-Demand	Anodyne	PLA2G4A	28	44
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1ccccc1	ZINC000819383636	EG	On-Demand	Anodyne	FFAR1	34	40
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1ccccc1	ZINC000819383636	EG	On-Demand	Anodyne	CRTM	52	38
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1ccccc1	ZINC000819383636	EG	On-Demand	Anodyne	PDS	48	34
C[C@@H](CC(=O)NC[C@@H](O)COc1cccc(F)c1)n1cccn1	ZINC000819383672	DD	On-Demand	Anodyne	PDS	38	40
O=C(c1ccc(O)cc1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819383676	DG	On-Demand	Anodyne	SLC18A3	43	40
O=C(c1ccc(O)cc1)C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819383676	DG	On-Demand	Anodyne	L3MBTL3	62	36
C[C@@H](c1cccc(O)c1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819383693	GG	On-Demand	Mild	PAPA1_CARPA	53	43
C[C@@H](c1cccc(O)c1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819383693	GG	On-Demand	Mild	CTSK	26	41
C[C@@H](c1cccc(O)c1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819383693	GG	On-Demand	Mild	CTSL	16	43
C[C@@H](c1cccc(O)c1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819383693	GG	On-Demand	Mild	CTSS	16	43
C[C@@H](c1cccc(O)c1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819383694	GG	On-Demand	Mild	PAPA1_CARPA	53	43
C[C@@H](c1cccc(O)c1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819383694	GG	On-Demand	Mild	CTSK	26	41
C[C@@H](c1cccc(O)c1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819383694	GG	On-Demand	Mild	CTSL	16	43
C[C@@H](c1cccc(O)c1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819383694	GG	On-Demand	Mild	CTSS	16	43
CC(C)(C)OC(=O)C(C)(C)CCNC[C@H](O)c1ccccc1	ZINC000819383715	DG	On-Demand	Anodyne	ADRB2	32	45
CC(C)(C)OC(=O)C(C)(C)CCNC[C@H](O)c1ccccc1	ZINC000819383715	DG	On-Demand	Anodyne	ADRB1	45	40
CC(C)(C)OC(=O)C(C)(C)CCNC[C@H](O)c1ccccc1	ZINC000819383715	DG	On-Demand	Anodyne	ADRB3	64	51
CC(C)(C)OC(=O)C(C)(C)CCNC[C@@H](O)c1ccccc1	ZINC000819383716	DG	On-Demand	Anodyne	ADRB2	32	45
CC(C)(C)OC(=O)C(C)(C)CCNC[C@@H](O)c1ccccc1	ZINC000819383716	DG	On-Demand	Anodyne	ADRB1	45	40
CC(C)(C)OC(=O)C(C)(C)CCNC[C@@H](O)c1ccccc1	ZINC000819383716	DG	On-Demand	Anodyne	ADRB3	64	51
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccccc1	ZINC000819383735	EE	On-Demand	Anodyne	ADRB2	64	45
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccccc1	ZINC000819383735	EE	On-Demand	Anodyne	ADRB1	74	45
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccccc1	ZINC000819383735	EE	On-Demand	Anodyne	ADRB3	108	49
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccccc1	ZINC000819383735	EE	On-Demand	Anodyne	MME	21	41
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccccc1	ZINC000819383735	EE	On-Demand	Anodyne	MMP3	16	40
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccccc1	ZINC000819383735	EE	On-Demand	Anodyne	FAAH	40	37
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccccc1	ZINC000819383735	EE	On-Demand	Anodyne	AMP1_PLAFQ	26	40
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccccc1	ZINC000819383735	EE	On-Demand	Anodyne	CES1D	43	30
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccccc1	ZINC000819383736	EE	On-Demand	Anodyne	ADRB2	64	45
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccccc1	ZINC000819383736	EE	On-Demand	Anodyne	ADRB1	74	45
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccccc1	ZINC000819383736	EE	On-Demand	Anodyne	ADRB3	108	49
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccccc1	ZINC000819383736	EE	On-Demand	Anodyne	MME	21	41
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccccc1	ZINC000819383736	EE	On-Demand	Anodyne	MMP3	16	40
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccccc1	ZINC000819383736	EE	On-Demand	Anodyne	FAAH	40	37
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccccc1	ZINC000819383736	EE	On-Demand	Anodyne	AMP1_PLAFQ	26	40
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccccc1	ZINC000819383736	EE	On-Demand	Anodyne	CES1D	43	30
N#C[C@H]1CC[C@@H](NC[C@@H](O)c2cccnc2)C1	ZINC000819383739	BD	On-Demand	Mild	ADRB3	58	46
N#C[C@H]1CC[C@@H](NC[C@H](O)c2cccnc2)C1	ZINC000819383740	BD	On-Demand	Mild	ADRB3	58	46
CC(C)(C)OC(=O)N1CCC(c2cc(CNC[C@H](O)C(C)(C)C)on2)CC1	ZINC000819383756	GG	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CCC(c2cc(CNC[C@@H](O)C(C)(C)C)on2)CC1	ZINC000819383757	GG	On-Demand	Anodyne	GPR119	41	41
CN1C(=O)CC[C@@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000819383760	CB	On-Demand	Anodyne	ADRB3	70	45
CN1C(=O)CC[C@@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000819383761	CB	On-Demand	Anodyne	ADRB3	70	45
CN1C(=O)CC[C@H](NC[C@H](O)c2cccnc2)C1=O	ZINC000819383762	CB	On-Demand	Anodyne	ADRB3	70	45
CN1C(=O)CC[C@H](NC[C@@H](O)c2cccnc2)C1=O	ZINC000819383763	CB	On-Demand	Anodyne	ADRB3	70	45
COC[C@@H](O)CNCc1cc(O[C@@H]2CCN(C(=O)OC(C)(C)C)C2)ccn1	ZINC000819383779	GD	On-Demand	Anodyne	GPR119	45	38
COC[C@@H](O)CNCc1cc(O[C@H]2CCN(C(=O)OC(C)(C)C)C2)ccn1	ZINC000819383781	GD	On-Demand	Anodyne	GPR119	45	38
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(F)cn1	ZINC000819383789	ED	On-Demand	Anodyne	ADRB3	42	42
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(F)cn1	ZINC000819383789	ED	On-Demand	Anodyne	CES1D	53	31
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(F)cn1	ZINC000819383790	ED	On-Demand	Anodyne	ADRB3	42	42
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(F)cn1	ZINC000819383790	ED	On-Demand	Anodyne	CES1D	53	31
C[C@@H](CC(=O)NC[C@H](O)COc1cccc(F)c1)n1cccn1	ZINC000819383812	DD	On-Demand	Anodyne	PDS	38	40
C[C@H](CC(=O)NC[C@H](O)COc1cccc(F)c1)n1cccn1	ZINC000819383813	DD	On-Demand	Anodyne	PDS	38	40
C[C@H](CC(=O)NC[C@@H](O)COc1cccc(F)c1)n1cccn1	ZINC000819383814	DD	On-Demand	Anodyne	PDS	38	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)c1cccnc1)C2	ZINC000819383821	DD	On-Demand	Anodyne	ADRB1	16	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)c1cccnc1)C2	ZINC000819383821	DD	On-Demand	Anodyne	ADRB3	55	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)c1cccnc1)C2	ZINC000819383822	DD	On-Demand	Anodyne	ADRB1	16	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)c1cccnc1)C2	ZINC000819383822	DD	On-Demand	Anodyne	ADRB3	55	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)c1cccnc1)C2	ZINC000819383823	DD	On-Demand	Anodyne	ADRB1	16	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)c1cccnc1)C2	ZINC000819383823	DD	On-Demand	Anodyne	ADRB3	55	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)c1cccnc1)C2	ZINC000819383824	DD	On-Demand	Anodyne	ADRB1	16	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)c1cccnc1)C2	ZINC000819383824	DD	On-Demand	Anodyne	ADRB3	55	42
COC(=O)c1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819383839	GD	On-Demand	Anodyne	ADRB2	26	41
COC(=O)c1ccc(OC[C@@H](O)CN[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819383840	GD	On-Demand	Anodyne	ADRB2	26	41
COC(=O)c1ccc(OC[C@H](O)CN[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819383841	GD	On-Demand	Anodyne	ADRB2	26	41
COC(=O)c1ccc(OC[C@H](O)CN[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)cc1	ZINC000819383842	GD	On-Demand	Anodyne	ADRB2	26	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](O)c1ccc3ccccc3c1)C2	ZINC000819383855	GF	On-Demand	Anodyne	SLC6A3	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](O)c1ccc3ccccc3c1)C2	ZINC000819383856	GF	On-Demand	Anodyne	SLC6A3	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](O)c1ccc3ccccc3c1)C2	ZINC000819383857	GF	On-Demand	Anodyne	SLC6A3	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](O)c1ccc3ccccc3c1)C2	ZINC000819383858	GF	On-Demand	Anodyne	SLC6A3	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)C2	ZINC000819383877	GG	On-Demand	Anodyne	CCR2	55	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NCCC(=O)Nc1cccc(C(F)(F)F)c1)C2	ZINC000819383878	GG	On-Demand	Anodyne	CCR2	55	36
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cccc2ccccc12	ZINC000819383916	GH	On-Demand	Anodyne	ADRB2	75	41
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cccc2ccccc12	ZINC000819383916	GH	On-Demand	Anodyne	ADRB1	54	41
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cccc2ccccc12	ZINC000819383916	GH	On-Demand	Anodyne	ADRB3	45	39
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cccc2ccccc12	ZINC000819383916	GH	On-Demand	Anodyne	MTNR1A	20	40
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cccc2ccccc12	ZINC000819383916	GH	On-Demand	Anodyne	MTNR1B	17	40
CC(C)(C)OC(=O)N1CC[C@@H](Oc2ccnc(CNC[C@H](O)C(C)(C)C)c2)C1	ZINC000819383935	GF	On-Demand	Anodyne	GPR119	51	39
CC(C)(C)OC(=O)N1CC[C@@H](Oc2ccnc(CNC[C@@H](O)C(C)(C)C)c2)C1	ZINC000819383936	GF	On-Demand	Anodyne	GPR119	51	39
CC(C)(C)OC(=O)N1CC[C@H](Oc2ccnc(CNC[C@H](O)C(C)(C)C)c2)C1	ZINC000819383937	GF	On-Demand	Anodyne	GPR119	51	39
CC(C)(C)OC(=O)N1CC[C@H](Oc2ccnc(CNC[C@@H](O)C(C)(C)C)c2)C1	ZINC000819383938	GF	On-Demand	Anodyne	GPR119	51	39
CN1C(=O)CC[C@@H](NC[C@H](O)c2ccc(F)cc2Cl)C1=O	ZINC000819383945	DD	On-Demand	Anodyne	P2RX7	30	43
CN1C(=O)CC[C@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1=O	ZINC000819383946	DD	On-Demand	Anodyne	P2RX7	30	43
CN1C(=O)CC[C@H](NC[C@H](O)c2ccc(F)cc2Cl)C1=O	ZINC000819383947	DD	On-Demand	Anodyne	P2RX7	30	43
CN1C(=O)CC[C@@H](NC[C@@H](O)c2ccc(F)cc2Cl)C1=O	ZINC000819383948	DD	On-Demand	Anodyne	P2RX7	30	43
O=C(NCCOc1ccc(C(F)(F)F)cn1)C(F)=C1CCC1	ZINC000819383956	DG	On-Demand	Anodyne	LIPE	19	42
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(F)cc1	ZINC000819383966	EF	On-Demand	Anodyne	ADRB2	71	43
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(F)cc1	ZINC000819383966	EF	On-Demand	Anodyne	ADRB1	65	42
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(F)cc1	ZINC000819383966	EF	On-Demand	Anodyne	ADRB3	82	43
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(F)cc1	ZINC000819383967	EF	On-Demand	Anodyne	ADRB2	71	43
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(F)cc1	ZINC000819383967	EF	On-Demand	Anodyne	ADRB1	65	42
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(F)cc1	ZINC000819383967	EF	On-Demand	Anodyne	ADRB3	82	43
CC(C)(C)OC(=O)C(C)(C)CCNC[C@H](O)c1cccnc1	ZINC000819383968	DE	On-Demand	Anodyne	ADRB2	29	45
CC(C)(C)OC(=O)C(C)(C)CCNC[C@H](O)c1cccnc1	ZINC000819383968	DE	On-Demand	Anodyne	ADRB1	44	46
CC(C)(C)OC(=O)C(C)(C)CCNC[C@H](O)c1cccnc1	ZINC000819383968	DE	On-Demand	Anodyne	ADRB3	121	45
CC(C)(C)OC(=O)C(C)(C)CCNC[C@@H](O)c1cccnc1	ZINC000819383969	DE	On-Demand	Anodyne	ADRB2	29	45
CC(C)(C)OC(=O)C(C)(C)CCNC[C@@H](O)c1cccnc1	ZINC000819383969	DE	On-Demand	Anodyne	ADRB1	44	46
CC(C)(C)OC(=O)C(C)(C)CCNC[C@@H](O)c1cccnc1	ZINC000819383969	DE	On-Demand	Anodyne	ADRB3	121	45
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1cc2ccccc2o1	ZINC000819383983	FG	On-Demand	Anodyne	MTNR1A	27	42
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1cc2ccccc2o1	ZINC000819383983	FG	On-Demand	Anodyne	MTNR1B	27	42
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1cc2ccccc2o1	ZINC000819383983	FG	On-Demand	Anodyne	CES1D	43	30
CC(C)(C)OC(=O)N1CC[C@H](Oc2ccnc(CNCC3(O)CCC3)c2)C1	ZINC000819383986	GE	On-Demand	Anodyne	GPR119	43	38
CC(C)(C)OC(=O)N1CC[C@@H](Oc2ccnc(CNCC3(O)CCC3)c2)C1	ZINC000819383987	GE	On-Demand	Anodyne	GPR119	43	38
COC(=O)c1cnc([C@H](C)NC[C@@H](O)c2cccnc2)s1	ZINC000819383995	DD	On-Demand	Anodyne	ADRB2	27	40
COC(=O)c1cnc([C@H](C)NC[C@@H](O)c2cccnc2)s1	ZINC000819383995	DD	On-Demand	Anodyne	ADRB1	44	47
COC(=O)c1cnc([C@H](C)NC[C@@H](O)c2cccnc2)s1	ZINC000819383995	DD	On-Demand	Anodyne	ADRB3	111	47
COC(=O)c1cnc([C@@H](C)NC[C@H](O)c2cccnc2)s1	ZINC000819383996	DD	On-Demand	Anodyne	ADRB2	27	40
COC(=O)c1cnc([C@@H](C)NC[C@H](O)c2cccnc2)s1	ZINC000819383996	DD	On-Demand	Anodyne	ADRB1	44	47
COC(=O)c1cnc([C@@H](C)NC[C@H](O)c2cccnc2)s1	ZINC000819383996	DD	On-Demand	Anodyne	ADRB3	111	47
COC(=O)c1cnc([C@@H](C)NC[C@@H](O)c2cccnc2)s1	ZINC000819383997	DD	On-Demand	Anodyne	ADRB2	27	40
COC(=O)c1cnc([C@@H](C)NC[C@@H](O)c2cccnc2)s1	ZINC000819383997	DD	On-Demand	Anodyne	ADRB1	44	47
COC(=O)c1cnc([C@@H](C)NC[C@@H](O)c2cccnc2)s1	ZINC000819383997	DD	On-Demand	Anodyne	ADRB3	111	47
COC(=O)c1cnc([C@H](C)NC[C@H](O)c2cccnc2)s1	ZINC000819383998	DD	On-Demand	Anodyne	ADRB2	27	40
COC(=O)c1cnc([C@H](C)NC[C@H](O)c2cccnc2)s1	ZINC000819383998	DD	On-Demand	Anodyne	ADRB1	44	47
COC(=O)c1cnc([C@H](C)NC[C@H](O)c2cccnc2)s1	ZINC000819383998	DD	On-Demand	Anodyne	ADRB3	111	47
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819384011	FF	On-Demand	Anodyne	ADRB2	63	44
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819384011	FF	On-Demand	Anodyne	ADRB1	58	44
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(F)c(F)c1	ZINC000819384011	FF	On-Demand	Anodyne	ADRB3	87	44
COc1ccc(OC)c([C@H](O)CNC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819384016	GG	On-Demand	Anodyne	MTNR1A	56	47
COc1ccc(OC)c([C@H](O)CNC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819384016	GG	On-Demand	Anodyne	MTNR1B	55	47
COc1ccc(OC)c([C@H](O)CNC(=O)C2(c3ccc(C)cc3)CCC2)c1	ZINC000819384026	FG	On-Demand	Anodyne	MTNR1A	21	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)COc1ccc3c(c1)OCO3)C2	ZINC000819384027	GD	On-Demand	Anodyne	EDNRB	53	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)COc1ccc3c(c1)OCO3)C2	ZINC000819384027	GD	On-Demand	Anodyne	EDNRA	49	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)COc1ccc3c(c1)OCO3)C2	ZINC000819384027	GD	On-Demand	Anodyne	BMP1	44	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)COc1ccc3c(c1)OCO3)C2	ZINC000819384028	GD	On-Demand	Anodyne	EDNRB	53	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)COc1ccc3c(c1)OCO3)C2	ZINC000819384028	GD	On-Demand	Anodyne	EDNRA	49	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)COc1ccc3c(c1)OCO3)C2	ZINC000819384028	GD	On-Demand	Anodyne	BMP1	44	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)COc1ccc3c(c1)OCO3)C2	ZINC000819384029	GD	On-Demand	Anodyne	EDNRB	53	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)COc1ccc3c(c1)OCO3)C2	ZINC000819384029	GD	On-Demand	Anodyne	EDNRA	49	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)COc1ccc3c(c1)OCO3)C2	ZINC000819384029	GD	On-Demand	Anodyne	BMP1	44	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)COc1ccc3c(c1)OCO3)C2	ZINC000819384030	GD	On-Demand	Anodyne	EDNRB	53	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)COc1ccc3c(c1)OCO3)C2	ZINC000819384030	GD	On-Demand	Anodyne	EDNRA	49	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)COc1ccc3c(c1)OCO3)C2	ZINC000819384030	GD	On-Demand	Anodyne	BMP1	44	33
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1ccc2ccccc2c1	ZINC000819384033	CH	On-Demand	Mild	TPH1	43	33
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1ccc2ccccc2c1	ZINC000819384034	CH	On-Demand	Mild	TPH1	43	33
C[C@@H]1CCCC[C@H]1C(=O)NC[C@H](O)c1ccccc1Cl	ZINC000819384047	CG	On-Demand	Anodyne	OPRL1	41	42
C[C@@H]1CCCC[C@H]1C(=O)NC[C@@H](O)c1ccccc1Cl	ZINC000819384048	CG	On-Demand	Anodyne	OPRL1	41	42
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@@H](O)c1ccccc1Cl	ZINC000819384049	CG	On-Demand	Anodyne	OPRL1	41	42
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@H](O)c1ccccc1Cl	ZINC000819384050	CG	On-Demand	Anodyne	OPRL1	41	42
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819384051	DF	On-Demand	Anodyne	ADRB2	29	45
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819384051	DF	On-Demand	Anodyne	ADRB1	43	45
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819384051	DF	On-Demand	Anodyne	ADRB3	21	40
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819384051	DF	On-Demand	Anodyne	PDS	44	42
C[C@@H]1CCCC[C@H]1C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819384052	DF	On-Demand	Anodyne	ADRB2	29	45
C[C@@H]1CCCC[C@H]1C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819384052	DF	On-Demand	Anodyne	ADRB1	43	45
C[C@@H]1CCCC[C@H]1C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819384052	DF	On-Demand	Anodyne	ADRB3	21	40
C[C@@H]1CCCC[C@H]1C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819384052	DF	On-Demand	Anodyne	PDS	44	42
C[C@@H]1CCCC[C@H]1C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819384053	DF	On-Demand	Anodyne	ADRB2	29	45
C[C@@H]1CCCC[C@H]1C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819384053	DF	On-Demand	Anodyne	ADRB1	43	45
C[C@@H]1CCCC[C@H]1C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819384053	DF	On-Demand	Anodyne	ADRB3	21	40
C[C@@H]1CCCC[C@H]1C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819384053	DF	On-Demand	Anodyne	PDS	44	42
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819384054	DF	On-Demand	Anodyne	ADRB2	29	45
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819384054	DF	On-Demand	Anodyne	ADRB1	43	45
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819384054	DF	On-Demand	Anodyne	ADRB3	21	40
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819384054	DF	On-Demand	Anodyne	PDS	44	42
O[C@@H](CN[C@@H]1CCC[C@H](C2CC2)C1)c1cccnc1	ZINC000819384057	CF	On-Demand	Anodyne	ADRB1	24	41
O[C@@H](CN[C@@H]1CCC[C@H](C2CC2)C1)c1cccnc1	ZINC000819384057	CF	On-Demand	Anodyne	ADRB3	81	48
O[C@H](CN[C@@H]1CCC[C@H](C2CC2)C1)c1cccnc1	ZINC000819384058	CF	On-Demand	Anodyne	ADRB1	24	41
O[C@H](CN[C@@H]1CCC[C@H](C2CC2)C1)c1cccnc1	ZINC000819384058	CF	On-Demand	Anodyne	ADRB3	81	48
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819384091	FF	On-Demand	Anodyne	ADRB2	63	44
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819384091	FF	On-Demand	Anodyne	ADRB1	58	44
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819384091	FF	On-Demand	Anodyne	ADRB3	87	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)COc1ccccc1C(C)C)C2	ZINC000819384101	GF	On-Demand	Anodyne	ADRB2	25	55
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)COc1ccccc1C(C)C)C2	ZINC000819384103	GF	On-Demand	Anodyne	ADRB2	25	55
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)COc1ccccc1C(C)C)C2	ZINC000819384105	GF	On-Demand	Anodyne	ADRB2	25	55
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)COc1ccccc1C(C)C)C2	ZINC000819384106	GF	On-Demand	Anodyne	ADRB2	25	55
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1ccccc1Cl	ZINC000819384125	FH	On-Demand	Anodyne	CRTM	42	36
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1ccccc1Cl	ZINC000819384129	FH	On-Demand	Anodyne	CRTM	42	36
N#C[C@H]1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819384143	CF	On-Demand	Mild	ADRB1	30	45
N#C[C@H]1CC[C@@H](NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819384143	CF	On-Demand	Mild	ADRB3	48	47
N#C[C@H]1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819384144	CF	On-Demand	Mild	ADRB1	30	45
N#C[C@H]1CC[C@@H](NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819384144	CF	On-Demand	Mild	ADRB3	48	47
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819384157	GH	On-Demand	Anodyne	ADRB2	58	38
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819384157	GH	On-Demand	Anodyne	ADRB1	55	42
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819384157	GH	On-Demand	Anodyne	ADRB3	41	42
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819384157	GH	On-Demand	Anodyne	MC4R	18	40
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819384158	GH	On-Demand	Anodyne	ADRB2	58	38
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819384158	GH	On-Demand	Anodyne	ADRB1	55	42
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819384158	GH	On-Demand	Anodyne	ADRB3	41	42
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819384158	GH	On-Demand	Anodyne	MC4R	18	40
CC(C)(C)OC(=O)C(C)(C)CCNC[C@H](O)c1cc(F)ccc1F	ZINC000819384159	EG	On-Demand	Anodyne	LEF	40	32
CC(C)(C)OC(=O)C(C)(C)CCNC[C@@H](O)c1cc(F)ccc1F	ZINC000819384160	EG	On-Demand	Anodyne	LEF	40	32
CC(C)(C)OC(=O)N1CCC(c2cc(CNC[C@H](O)C3CC3)on2)CC1	ZINC000819384182	FF	On-Demand	Anodyne	GPR119	38	42
CC(C)(C)OC(=O)N1CCC(c2cc(CNC[C@@H](O)C3CC3)on2)CC1	ZINC000819384183	FF	On-Demand	Anodyne	GPR119	38	42
CC[C@H](O)CNCc1cc(O[C@@H]2CCN(C(=O)OC(C)(C)C)C2)ccn1	ZINC000819384184	FE	On-Demand	Anodyne	GPR119	59	42
CC[C@@H](O)CNCc1cc(O[C@@H]2CCN(C(=O)OC(C)(C)C)C2)ccn1	ZINC000819384185	FE	On-Demand	Anodyne	GPR119	59	42
CC[C@H](O)CNCc1cc(O[C@H]2CCN(C(=O)OC(C)(C)C)C2)ccn1	ZINC000819384186	FE	On-Demand	Anodyne	GPR119	59	42
CC[C@@H](O)CNCc1cc(O[C@H]2CCN(C(=O)OC(C)(C)C)C2)ccn1	ZINC000819384187	FE	On-Demand	Anodyne	GPR119	59	42
CCC1(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCCC1	ZINC000819384205	FH	On-Demand	Mild	PAPA1_CARPA	45	56
CCC1(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCCC1	ZINC000819384205	FH	On-Demand	Mild	CTSK	24	50
CCC1(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCCC1	ZINC000819384206	FH	On-Demand	Mild	PAPA1_CARPA	45	56
CCC1(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCCC1	ZINC000819384206	FH	On-Demand	Mild	CTSK	24	50
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819384218	FE	On-Demand	Anodyne	ADRB2	18	59
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819384218	FE	On-Demand	Anodyne	ADRB1	21	59
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819384218	FE	On-Demand	Anodyne	HTR1A	15	59
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819384218	FE	On-Demand	Anodyne	SLC6A4	19	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819384219	FE	On-Demand	Anodyne	ADRB2	18	59
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819384219	FE	On-Demand	Anodyne	ADRB1	21	59
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819384219	FE	On-Demand	Anodyne	HTR1A	15	59
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819384219	FE	On-Demand	Anodyne	SLC6A4	19	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819384220	FE	On-Demand	Anodyne	ADRB2	18	59
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819384220	FE	On-Demand	Anodyne	ADRB1	21	59
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819384220	FE	On-Demand	Anodyne	HTR1A	15	59
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819384220	FE	On-Demand	Anodyne	SLC6A4	19	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819384221	FE	On-Demand	Anodyne	ADRB2	18	59
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819384221	FE	On-Demand	Anodyne	ADRB1	21	59
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819384221	FE	On-Demand	Anodyne	HTR1A	15	59
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)COc1cccc3[nH]ccc13)C2	ZINC000819384221	FE	On-Demand	Anodyne	SLC6A4	19	43
O=C(NC[C@@H](O)c1ccccc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819384226	EG	On-Demand	Anodyne	SCD	17	41
O=C(NC[C@H](O)c1ccccc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819384227	EG	On-Demand	Anodyne	SCD	17	41
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2ccco2)c1	ZINC000819384228	DD	On-Demand	Anodyne	MTNR1A	30	40
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2ccco2)c1	ZINC000819384228	DD	On-Demand	Anodyne	MTNR1B	31	40
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2ccco2)c1	ZINC000819384231	DD	On-Demand	Anodyne	MTNR1A	30	40
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2ccco2)c1	ZINC000819384231	DD	On-Demand	Anodyne	MTNR1B	31	40
COc1ccc(OC)c([C@H](O)CNC(=O)c2coc3c(C)cccc23)c1	ZINC000819384237	FG	On-Demand	Anodyne	MTNR1A	32	47
O[C@@H](CNC1C[C@H]2C[C@@H]2C1)c1ccc(Cl)cc1	ZINC000819384238	CF	On-Demand	Anodyne	ADRB3	19	46
O[C@@H](CNC1C[C@@H]2C[C@H]2C1)c1ccc(Cl)cc1	ZINC000819384239	CF	On-Demand	Anodyne	ADRB3	19	46
C=CCCn1cc(C(=O)NC[C@H](O)c2ccccc2)nn1	ZINC000819384240	CD	On-Demand	Mild	SCD1	19	42
C=CCCn1cc(C(=O)NC[C@H](O)c2ccccc2)nn1	ZINC000819384240	CD	On-Demand	Mild	SCD	28	42
C=CCCn1cc(C(=O)NC[C@@H](O)c2ccccc2)nn1	ZINC000819384241	CD	On-Demand	Mild	SCD1	19	42
C=CCCn1cc(C(=O)NC[C@@H](O)c2ccccc2)nn1	ZINC000819384241	CD	On-Demand	Mild	SCD	28	42
CS(=O)(=O)c1ccc([C@@H](O)CN[C@@H]2CCC[C@H](C3CC3)C2)cc1	ZINC000819384260	EF	On-Demand	Anodyne	ADRB3	21	44
CS(=O)(=O)c1ccc([C@H](O)CN[C@@H]2CCC[C@H](C3CC3)C2)cc1	ZINC000819384261	EF	On-Demand	Anodyne	ADRB3	21	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)COc1ccccc1Cl)C2	ZINC000819384309	FE	On-Demand	Anodyne	ADRB2	22	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)COc1ccccc1Cl)C2	ZINC000819384310	FE	On-Demand	Anodyne	ADRB2	22	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)COc1ccccc1Cl)C2	ZINC000819384313	FE	On-Demand	Anodyne	ADRB2	22	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)COc1ccccc1Cl)C2	ZINC000819384314	FE	On-Demand	Anodyne	ADRB2	22	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CN[C@@H]2CCC[C@H](C3CC3)C2)CC1	ZINC000819384333	FH	On-Demand	Anodyne	GPR119	41	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CN[C@@H]2CCC[C@H](C3CC3)C2)CC1	ZINC000819384335	FH	On-Demand	Anodyne	GPR119	41	43
N#Cc1ccc([C@@H](O)CNCCNC(=O)CCCc2ccccc2)cc1	ZINC000819384339	FE	On-Demand	Mild	ADRB2	43	44
N#Cc1ccc([C@@H](O)CNCCNC(=O)CCCc2ccccc2)cc1	ZINC000819384339	FE	On-Demand	Mild	ADRB1	54	42
N#Cc1ccc([C@@H](O)CNCCNC(=O)CCCc2ccccc2)cc1	ZINC000819384339	FE	On-Demand	Mild	ADRB3	64	42
N#Cc1ccc([C@@H](O)CNCCNC(=O)CCCc2ccccc2)cc1	ZINC000819384339	FE	On-Demand	Mild	FAAH	17	41
N#Cc1ccc([C@@H](O)CNCCNC(=O)CCCc2ccccc2)cc1	ZINC000819384339	FE	On-Demand	Mild	CTRB_BOVIN	47	35
N#Cc1ccc([C@H](O)CNCCNC(=O)CCCc2ccccc2)cc1	ZINC000819384342	FE	On-Demand	Mild	ADRB2	43	44
N#Cc1ccc([C@H](O)CNCCNC(=O)CCCc2ccccc2)cc1	ZINC000819384342	FE	On-Demand	Mild	ADRB1	54	42
N#Cc1ccc([C@H](O)CNCCNC(=O)CCCc2ccccc2)cc1	ZINC000819384342	FE	On-Demand	Mild	ADRB3	64	42
N#Cc1ccc([C@H](O)CNCCNC(=O)CCCc2ccccc2)cc1	ZINC000819384342	FE	On-Demand	Mild	FAAH	17	41
N#Cc1ccc([C@H](O)CNCCNC(=O)CCCc2ccccc2)cc1	ZINC000819384342	FE	On-Demand	Mild	CTRB_BOVIN	47	35
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819384344	FG	On-Demand	Anodyne	ADRB2	63	43
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819384344	FG	On-Demand	Anodyne	ADRB1	67	44
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819384344	FG	On-Demand	Anodyne	ADRB3	84	44
C[C@@H](CC(=O)NC[C@@H](O)c1ccc2ccccc2c1)n1cccn1	ZINC000819384345	DF	On-Demand	Anodyne	CYP26A1	41	37
C[C@H](CC(=O)NC[C@H](O)c1ccc2ccccc2c1)n1cccn1	ZINC000819384347	DF	On-Demand	Anodyne	CYP26A1	41	37
C[C@@H](CC(=O)NC[C@H](O)c1ccc2ccccc2c1)n1cccn1	ZINC000819384350	DF	On-Demand	Anodyne	CYP26A1	41	37
Cc1cc(-c2noc([C@H](C)NC(=O)/C=C\[C@H]3CCCO3)n2)ccc1F	ZINC000819384359	EG	On-Demand	Anodyne	UL26	90	35
Cc1cc(-c2noc([C@H](C)NC(=O)/C=C\[C@H]3CCCO3)n2)ccc1F	ZINC000819384359	EG	On-Demand	Anodyne	SCAF_EBVB9	76	32
Cc1cc(-c2noc([C@H](C)NC(=O)/C=C\[C@@H]3CCCO3)n2)ccc1F	ZINC000819384360	EG	On-Demand	Anodyne	UL26	90	35
Cc1cc(-c2noc([C@H](C)NC(=O)/C=C\[C@@H]3CCCO3)n2)ccc1F	ZINC000819384360	EG	On-Demand	Anodyne	SCAF_EBVB9	76	32
Cc1cc(-c2noc([C@H](C)NC(=O)/C=C/[C@H]3CCCO3)n2)ccc1F	ZINC000819384361	EG	On-Demand	Anodyne	UL26	90	35
Cc1cc(-c2noc([C@H](C)NC(=O)/C=C/[C@H]3CCCO3)n2)ccc1F	ZINC000819384361	EG	On-Demand	Anodyne	SCAF_EBVB9	76	32
Cc1cc(-c2noc([C@H](C)NC(=O)/C=C/[C@@H]3CCCO3)n2)ccc1F	ZINC000819384362	EG	On-Demand	Anodyne	UL26	90	35
Cc1cc(-c2noc([C@H](C)NC(=O)/C=C/[C@@H]3CCCO3)n2)ccc1F	ZINC000819384362	EG	On-Demand	Anodyne	SCAF_EBVB9	76	32
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cccc(F)c1	ZINC000819384369	EF	On-Demand	Anodyne	ADRB2	60	44
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cccc(F)c1	ZINC000819384369	EF	On-Demand	Anodyne	ADRB1	64	49
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1cccc(F)c1	ZINC000819384369	EF	On-Demand	Anodyne	ADRB3	98	49
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1cccc(F)c1	ZINC000819384370	EF	On-Demand	Anodyne	ADRB2	60	44
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1cccc(F)c1	ZINC000819384370	EF	On-Demand	Anodyne	ADRB1	64	49
O=C(CCCc1ccccc1)NCCNC[C@@H](O)c1cccc(F)c1	ZINC000819384370	EF	On-Demand	Anodyne	ADRB3	98	49
CC(C)(C)OC(=O)C(C)(C)CCNC[C@H](O)c1cccc(F)c1	ZINC000819384379	EG	On-Demand	Anodyne	ADRB1	36	46
CC(C)(C)OC(=O)C(C)(C)CCNC[C@H](O)c1cccc(F)c1	ZINC000819384379	EG	On-Demand	Anodyne	ADRB3	46	46
CC(C)(C)OC(=O)C(C)(C)CCNC[C@@H](O)c1cccc(F)c1	ZINC000819384380	EG	On-Demand	Anodyne	ADRB1	36	46
CC(C)(C)OC(=O)C(C)(C)CCNC[C@@H](O)c1cccc(F)c1	ZINC000819384380	EG	On-Demand	Anodyne	ADRB3	46	46
CC(C)(C)OC(=O)C(C)(C)CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819384385	EH	On-Demand	Anodyne	ADRB1	26	42
CC(C)(C)OC(=O)C(C)(C)CCNC[C@H](O)c1ccc(Cl)cc1	ZINC000819384385	EH	On-Demand	Anodyne	ADRB3	33	42
CC(C)(C)OC(=O)C(C)(C)CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819384386	FF	On-Demand	Bother	ADRB3	41	38
CC(C)(C)OC(=O)C(C)(C)CCNC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819384386	FF	On-Demand	Bother	CACNA1D	52	33
CC(C)(C)OC(=O)C(C)(C)CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819384387	FF	On-Demand	Bother	ADRB3	41	38
CC(C)(C)OC(=O)C(C)(C)CCNC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819384387	FF	On-Demand	Bother	CACNA1D	52	33
CN1C(=O)CC[C@@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819384394	DC	On-Demand	Bother	CACNA1D	45	32
CN1C(=O)CC[C@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819384395	DC	On-Demand	Bother	CACNA1D	45	32
CN1C(=O)CC[C@H](NC[C@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819384396	DC	On-Demand	Bother	CACNA1D	45	32
CN1C(=O)CC[C@@H](NC[C@@H](O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000819384397	DC	On-Demand	Bother	CACNA1D	45	32
CC[C@H](O)CNCc1cc(C2CCN(C(=O)OC(C)(C)C)CC2)no1	ZINC000819384402	FF	On-Demand	Anodyne	GPR119	43	44
CN1C(=O)CC[C@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1=O	ZINC000819384403	FC	On-Demand	Anodyne	GPR119	31	42
CN1C(=O)CC[C@@H](NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1=O	ZINC000819384404	FC	On-Demand	Anodyne	GPR119	31	42
CN1C(=O)CC[C@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1=O	ZINC000819384405	FC	On-Demand	Anodyne	GPR119	31	42
CN1C(=O)CC[C@@H](NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)C1=O	ZINC000819384406	FC	On-Demand	Anodyne	GPR119	31	42
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccccc1Cl	ZINC000819384411	FG	On-Demand	Anodyne	ADRB2	48	38
O=C(CCCc1ccccc1)NCCNC[C@H](O)c1ccccc1Cl	ZINC000819384411	FG	On-Demand	Anodyne	ADRB1	47	41
O=C(NCCCC(=O)N1CC2(CCOC2)C1)OCc1ccccc1	ZINC000819384416	ED	On-Demand	Anodyne	CAPNS1	50	33
O=C(NCCCC(=O)N1CC2(CCOC2)C1)OCc1ccccc1	ZINC000819384416	ED	On-Demand	Anodyne	CAPN1	45	40
O=C(NCCCC(=O)N1CC2(CCOC2)C1)OCc1ccccc1	ZINC000819384416	ED	On-Demand	Anodyne	CAPN2	86	40
O=C(NCCCC(=O)N1CC2(CCOC2)C1)OCc1ccccc1	ZINC000819384416	ED	On-Demand	Anodyne	TGM2	30	41
O=C(NCCCC(=O)N1CC2(CCOC2)C1)OCc1ccccc1	ZINC000819384416	ED	On-Demand	Anodyne	NPR	65	39
O=C(NCCCC(=O)N1CC2(CCOC2)C1)OCc1ccccc1	ZINC000819384416	ED	On-Demand	Anodyne	SLC12A5	44	35
O=C(c1ccc(S(=O)(=O)N2CCCC2)o1)N1CC2(CCOC2)C1	ZINC000819384422	EC	On-Demand	Anodyne	LPL	40	36
CN(CCC(=O)N1CC2(CCOC2)C1)C(=O)OCC1c2ccccc2-c2ccccc21	ZINC000819384423	HH	On-Demand	Anodyne	SSTR1	41	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	GHRHR	65	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	P2RY12	76	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	CTRA_BOVIN	57	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	KLK3	78	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	CTSB	64	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	PAPA1_CARPA	64	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	CYSP_TRYCR	64	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	CTSG	42	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	CTSK	54	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	CTSL	47	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	CAPNS1	71	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	CELA2A	52	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	MMP11	45	30
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	CTSS	23	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	GHSR	19	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	CAPN1	87	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	CAPN2	136	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	TGM2	27	47
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	TPSAB1	45	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384426	FD	On-Demand	Anodyne	NPR	73	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	GHRHR	65	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	P2RY12	76	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	CTRA_BOVIN	57	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	KLK3	78	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	CTSB	64	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	PAPA1_CARPA	64	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	CYSP_TRYCR	64	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	CTSG	42	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	CTSK	54	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	CTSL	47	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	CAPNS1	71	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	CELA2A	52	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	MMP11	45	30
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	CTSS	23	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	GHSR	19	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	CAPN1	87	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	CAPN2	136	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	TGM2	27	47
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	TPSAB1	45	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCOC2)C1	ZINC000819384427	FD	On-Demand	Anodyne	NPR	73	38
O=C(N1CC2(CCOC2)C1)C1(S(=O)(=O)c2ccccc2)CC1	ZINC000819384441	DD	On-Demand	Anodyne	MMP13	19	43
CS(=O)(=O)Nc1cccc(C(=O)N2CC3(CCOC3)C2)c1	ZINC000819384470	DC	On-Demand	Anodyne	NR3C2	18	41
NS(=O)(=O)c1ccc(CCC(=O)N2CC3(CCOC3)C2)cc1	ZINC000819384495	DC	On-Demand	Anodyne	CA2	61	47
NS(=O)(=O)c1ccc(CCC(=O)N2CC3(CCOC3)C2)cc1	ZINC000819384495	DC	On-Demand	Anodyne	CA1	60	41
NS(=O)(=O)c1ccc(CCC(=O)N2CC3(CCOC3)C2)cc1	ZINC000819384495	DC	On-Demand	Anodyne	CA7	36	40
NS(=O)(=O)c1ccc(CCC(=O)N2CC3(CCOC3)C2)cc1	ZINC000819384495	DC	On-Demand	Anodyne	CA4	45	41
NS(=O)(=O)c1ccc(CCC(=O)N2CC3(CCOC3)C2)cc1	ZINC000819384495	DC	On-Demand	Anodyne	CA12	41	40
NS(=O)(=O)c1ccc(CCC(=O)N2CC3(CCOC3)C2)cc1	ZINC000819384495	DC	On-Demand	Anodyne	CA9	47	40
NS(=O)(=O)c1ccc(CCC(=O)N2CC3(CCOC3)C2)cc1	ZINC000819384495	DC	On-Demand	Anodyne	NCE103	16	47
CC(C)(C)OC(=O)N1CC[C@H](Oc2ccnc(CNCCC(N)=O)c2)C1	ZINC000819384512	FD	On-Demand	Anodyne	GPR119	46	39
CC(C)(C)OC(=O)N1CC[C@@H](Oc2ccnc(CNCCC(N)=O)c2)C1	ZINC000819384513	FD	On-Demand	Anodyne	GPR119	46	39
C[C@H](CC(=O)NC[C@@H](O)c1ccc2ccccc2c1)n1cccn1	ZINC000819384516	DF	On-Demand	Anodyne	CYP26A1	41	37
Cc1cc(F)ccc1[C@@H](O)CNCCC(C)(C)C(=O)OC(C)(C)C	ZINC000819384534	EH	On-Demand	Anodyne	LEF	60	32
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819384537	GG	On-Demand	Anodyne	HMGCR	38	40
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819384537	GG	On-Demand	Anodyne	PDS	76	45
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819384539	GG	On-Demand	Anodyne	HMGCR	38	40
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819384539	GG	On-Demand	Anodyne	PDS	76	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)COc1ccc(NC(C)=O)cc1)C2	ZINC000819384546	GD	On-Demand	Anodyne	ADRB2	28	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)COc1ccc(NC(C)=O)cc1)C2	ZINC000819384546	GD	On-Demand	Anodyne	ADRB1	61	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)COc1ccc(NC(C)=O)cc1)C2	ZINC000819384546	GD	On-Demand	Anodyne	ADRB3	40	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)COc1ccc(NC(C)=O)cc1)C2	ZINC000819384548	GD	On-Demand	Anodyne	ADRB2	28	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)COc1ccc(NC(C)=O)cc1)C2	ZINC000819384548	GD	On-Demand	Anodyne	ADRB1	61	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)COc1ccc(NC(C)=O)cc1)C2	ZINC000819384548	GD	On-Demand	Anodyne	ADRB3	40	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)COc1ccc(NC(C)=O)cc1)C2	ZINC000819384550	GD	On-Demand	Anodyne	ADRB2	28	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)COc1ccc(NC(C)=O)cc1)C2	ZINC000819384550	GD	On-Demand	Anodyne	ADRB1	61	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)COc1ccc(NC(C)=O)cc1)C2	ZINC000819384550	GD	On-Demand	Anodyne	ADRB3	40	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)COc1ccc(NC(C)=O)cc1)C2	ZINC000819384552	GD	On-Demand	Anodyne	ADRB2	28	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)COc1ccc(NC(C)=O)cc1)C2	ZINC000819384552	GD	On-Demand	Anodyne	ADRB1	61	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)COc1ccc(NC(C)=O)cc1)C2	ZINC000819384552	GD	On-Demand	Anodyne	ADRB3	40	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@H](O)COc1ccc(F)cc1)C2	ZINC000819384562	FD	On-Demand	Anodyne	ADRB1	42	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@@H](O)COc1ccc(F)cc1)C2	ZINC000819384563	FD	On-Demand	Anodyne	ADRB1	42	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](NC[C@H](O)COc1ccc(F)cc1)C2	ZINC000819384564	FD	On-Demand	Anodyne	ADRB1	42	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC[C@@H](O)COc1ccc(F)cc1)C2	ZINC000819384565	FD	On-Demand	Anodyne	ADRB1	42	38
COc1ccc(OC)c([C@H](O)CNC(=O)Cc2ccc(-n3cnnc3)cc2)c1	ZINC000819384619	GD	On-Demand	Anodyne	MTNR1A	41	42
CC(C)(C)OC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)N1CC2(CCOC2)C1	ZINC000819384669	GH	On-Demand	Anodyne	FPR1	42	34
CC(C)(C)C(=O)N1CCC[C@@H]1C(=O)N1CC2(CCOC2)C1	ZINC000819384676	CD	On-Demand	Anodyne	PREP	26	40
CC(C)(C)C(=O)N1CCC[C@H]1C(=O)N1CC2(CCOC2)C1	ZINC000819384677	CD	On-Demand	Anodyne	PREP	26	40
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	ACE	18	41
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	SSTR2	22	41
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	GHRHR	31	49
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	MME	24	41
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	TACR1	26	54
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	UGCG	20	51
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	MC4R	110	45
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	CCKAR	69	53
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	CCR1	20	41
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	BRS3	25	42
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	NMBR	44	36
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	MC3R	71	45
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	MC5R	67	36
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	MMP2	25	48
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	MMP8	33	48
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	ECE1	55	43
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	MMP11	95	34
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	CCKBR	71	54
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	GHSR	52	53
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	MMP9	24	48
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	MC1R	69	45
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	KISS1R	76	42
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	ERAP2	44	41
O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384718	IG	On-Demand	Anodyne	PSMB8	24	40
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	ACE	18	41
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	SSTR2	22	41
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	GHRHR	31	49
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	MME	24	41
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	TACR1	26	54
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	UGCG	20	51
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	MC4R	110	45
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	CCKAR	69	53
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	CCR1	20	41
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	BRS3	25	42
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	NMBR	44	36
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	MC3R	71	45
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	MC5R	67	36
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	MMP2	25	48
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	MMP8	33	48
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	ECE1	55	43
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	MMP11	95	34
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	CCKBR	71	54
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	GHSR	52	53
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	MMP9	24	48
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	MC1R	69	45
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	KISS1R	76	42
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	ERAP2	44	41
O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1)c1ccc(Cl)cc1	ZINC000819384719	IG	On-Demand	Anodyne	PSMB8	24	40
O=C(c1ccc(OCc2cccnc2)cc1)N1CC2(CCOC2)C1	ZINC000819384756	DF	On-Demand	Anodyne	NAMPT	18	40
O=C(c1cc(-c2ccncc2)nc2ccc(Br)cc12)N1CC2(CCOC2)C1	ZINC000819384761	HH	On-Demand	Anodyne	PRS	69	47
O=C(c1cc2ccc(OCc3ccccc3)cc2[nH]1)N1CC2(CCOC2)C1	ZINC000819384786	FH	On-Demand	Anodyne	GRIN2B	29	48
O=C(c1ccc(Oc2ccccc2Cl)cc1)N1CC2(CCOC2)C1	ZINC000819384787	EH	On-Demand	Anodyne	CCR8	18	43
C[C@H]1CCCCN1CCOc1ccccc1C(=O)N1CC2(CCOC2)C1	ZINC000819384856	FF	On-Demand	Anodyne	HCN1	43	32
C[C@H]1CCCCN1CCOc1ccccc1C(=O)N1CC2(CCOC2)C1	ZINC000819384856	FF	On-Demand	Anodyne	HCN4	40	32
C[C@@H]1CCCCN1CCOc1ccccc1C(=O)N1CC2(CCOC2)C1	ZINC000819384857	FF	On-Demand	Anodyne	HCN1	43	32
C[C@@H]1CCCCN1CCOc1ccccc1C(=O)N1CC2(CCOC2)C1	ZINC000819384857	FF	On-Demand	Anodyne	HCN4	40	32
CCCCCCCCCCC(=O)N1CC2(CCOC2)C1	ZINC000819384896	CH	On-Demand	Mild	CQSS	51	33
O=C(c1cc(-c2ccccc2)n(-c2ccccc2)n1)N1CC2(CCOC2)C1	ZINC000819384912	FG	On-Demand	Anodyne	RPA1	62	44
CCCCCCCC[C@H](O)CCC(=O)N1CC2(CCOC2)C1	ZINC000819384936	DG	On-Demand	Mild	CQSS	40	33
CCCCCCCC[C@@H](O)CCC(=O)N1CC2(CCOC2)C1	ZINC000819384937	DG	On-Demand	Mild	CQSS	40	33
O=C(NCC1(CC(=O)N2CC3(CCOC3)C2)CCCCC1)OCc1ccccc1	ZINC000819385001	HH	On-Demand	Anodyne	CAPNS1	47	31
O=C(NCC1(CC(=O)N2CC3(CCOC3)C2)CCCCC1)OCc1ccccc1	ZINC000819385001	HH	On-Demand	Anodyne	CAPN2	40	34
O=C(NCC1(CC(=O)N2CC3(CCOC3)C2)CCCCC1)OCc1ccccc1	ZINC000819385001	HH	On-Demand	Anodyne	NPR	61	34
O=C(NCC1(CC(=O)N2CC3(CCOC3)C2)CCCCC1)OCc1ccccc1	ZINC000819385001	HH	On-Demand	Anodyne	SLC12A5	48	35
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CC2(CCOC2)C1	ZINC000819385018	HF	On-Demand	Anodyne	CELA1	20	46
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CC2(CCOC2)C1	ZINC000819385018	HF	On-Demand	Anodyne	CTRA_BOVIN	49	31
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CC2(CCOC2)C1	ZINC000819385018	HF	On-Demand	Anodyne	PREP	63	53
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CC2(CCOC2)C1	ZINC000819385018	HF	On-Demand	Anodyne	LGMN	82	50
O=C([C@@H]1CCCN1C(=O)OCc1ccc(Br)cc1)N1CC2(CCOC2)C1	ZINC000819385018	HF	On-Demand	Anodyne	KLK5	22	40
O=C(c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)N1CC2(CCOC2)C1	ZINC000819385023	FD	On-Demand	Anodyne	CCR8	52	33
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2C(=O)N2CC3(CCOC3)C2)CC1	ZINC000819385026	FF	On-Demand	Anodyne	GPR119	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](O)c1cc(OC)ccc1OC)C2	ZINC000819385038	GD	On-Demand	Anodyne	MTNR1A	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](O)c1cc(OC)ccc1OC)C2	ZINC000819385039	GD	On-Demand	Anodyne	MTNR1A	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](O)c1cc(OC)ccc1OC)C2	ZINC000819385040	GD	On-Demand	Anodyne	MTNR1A	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](O)c1cc(OC)ccc1OC)C2	ZINC000819385041	GD	On-Demand	Anodyne	MTNR1A	18	40
COc1cccc([C@H](O)CNC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819385047	FG	On-Demand	Anodyne	ADRB1	25	42
COc1cccc([C@H](O)CNC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819385047	FG	On-Demand	Anodyne	ADRB3	36	42
COc1cccc([C@H](O)CNC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819385047	FG	On-Demand	Anodyne	MTNR1A	49	48
COc1cccc([C@H](O)CNC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819385047	FG	On-Demand	Anodyne	MTNR1B	50	48
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H](O)COc1ccc(C(F)(F)F)cc1	ZINC000819385066	FE	On-Demand	Anodyne	ADRB1	25	45
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H](O)COc1ccc(C(F)(F)F)cc1	ZINC000819385067	FE	On-Demand	Anodyne	ADRB1	25	45
O=C(/C=C/[C@@H]1CCCO1)NC[C@H](O)COc1ccc(C(F)(F)F)cc1	ZINC000819385068	FE	On-Demand	Anodyne	ADRB1	25	45
O=C(/C=C\[C@@H]1CCCO1)NC[C@H](O)COc1ccc(C(F)(F)F)cc1	ZINC000819385069	FE	On-Demand	Anodyne	ADRB1	25	45
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccc(C(C)(C)C)cc2)c1	ZINC000819385072	FG	On-Demand	Anodyne	ADRB2	59	42
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccc(C(C)(C)C)cc2)c1	ZINC000819385072	FG	On-Demand	Anodyne	KCNK3	50	41
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccc(C(C)(C)C)cc2)c1	ZINC000819385073	FG	On-Demand	Anodyne	ADRB2	59	42
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccc(C(C)(C)C)cc2)c1	ZINC000819385073	FG	On-Demand	Anodyne	KCNK3	50	41
O=C(NC[C@@H](O)COc1ccccc1)C(F)=C1CCC1	ZINC000819385074	CD	On-Demand	Anodyne	ADRB2	55	51
O=C(NC[C@@H](O)COc1ccccc1)C(F)=C1CCC1	ZINC000819385074	CD	On-Demand	Anodyne	ADRB1	76	45
O=C(NC[C@@H](O)COc1ccccc1)C(F)=C1CCC1	ZINC000819385074	CD	On-Demand	Anodyne	ADRB3	42	45
O=C(NC[C@@H](O)COc1ccccc1)C(F)=C1CCC1	ZINC000819385074	CD	On-Demand	Anodyne	ABCB1	35	40
O=C(NC[C@@H](O)COc1ccccc1)C(F)=C1CCC1	ZINC000819385074	CD	On-Demand	Anodyne	PDS	50	36
O=C(NC[C@H](O)COc1ccccc1)C(F)=C1CCC1	ZINC000819385075	CD	On-Demand	Anodyne	ADRB2	55	51
O=C(NC[C@H](O)COc1ccccc1)C(F)=C1CCC1	ZINC000819385075	CD	On-Demand	Anodyne	ADRB1	76	45
O=C(NC[C@H](O)COc1ccccc1)C(F)=C1CCC1	ZINC000819385075	CD	On-Demand	Anodyne	ADRB3	42	45
O=C(NC[C@H](O)COc1ccccc1)C(F)=C1CCC1	ZINC000819385075	CD	On-Demand	Anodyne	ABCB1	35	40
O=C(NC[C@H](O)COc1ccccc1)C(F)=C1CCC1	ZINC000819385075	CD	On-Demand	Anodyne	PDS	50	36
COc1cccc([C@H](O)CNC(=O)C2(c3ccc(C)cc3)CCC2)c1	ZINC000819385083	EG	On-Demand	Anodyne	DRD4	42	38
COc1cccc([C@H](O)CNC(=O)C2(c3ccc(C)cc3)CCC2)c1	ZINC000819385083	EG	On-Demand	Anodyne	ADRB3	42	37
O=C(NC[C@@H](O)c1cccc(C(F)(F)F)c1)c1cc2c(cn1)OCCO2	ZINC000819385084	FE	On-Demand	Anodyne	SCD	42	39
O=C(NC[C@H](O)c1cccc(C(F)(F)F)c1)c1cc2c(cn1)OCCO2	ZINC000819385085	FE	On-Demand	Anodyne	SCD	42	39
COc1ccc([C@@H](O)CNC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819385086	FG	On-Demand	Anodyne	ADRB1	20	40
COc1ccc([C@@H](O)CNC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819385086	FG	On-Demand	Anodyne	ADRB3	38	40
COc1ccc([C@@H](O)CNC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819385086	FG	On-Demand	Anodyne	PLA2G4A	22	40
COc1ccc([C@@H](O)CNC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819385086	FG	On-Demand	Anodyne	MTNR1A	54	48
COc1ccc([C@@H](O)CNC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819385086	FG	On-Demand	Anodyne	MTNR1B	52	48
COc1ccccc1[C@@H](O)CNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819385095	FG	On-Demand	Anodyne	MTNR1A	23	42
COc1ccccc1[C@@H](O)CNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819385095	FG	On-Demand	Anodyne	MTNR1B	27	42
COc1ccccc1[C@@H](O)CNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819385095	FG	On-Demand	Anodyne	CRTM	40	35
COc1ccccc1[C@@H](O)CNC(=O)c1cc(Br)oc1C	ZINC000819385098	FF	On-Demand	Anodyne	KCNA3	31	42
COc1ccccc1[C@@H](O)CNC(=O)c1cc(Br)oc1C	ZINC000819385098	FF	On-Demand	Anodyne	KCNK3	38	40
COc1ccccc1[C@@H](O)CNC(=O)c1cc(Br)oc1C	ZINC000819385098	FF	On-Demand	Anodyne	KCNK9	33	40
COc1ccc(OC)c([C@H](O)CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819385106	GD	On-Demand	Anodyne	MTNR1A	17	41
COc1cccc([C@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819385107	EE	On-Demand	Anodyne	ADRB2	51	38
COc1cccc([C@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819385107	EE	On-Demand	Anodyne	ADRB1	35	42
COc1cccc([C@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819385107	EE	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819385107	EE	On-Demand	Anodyne	ADRB3	58	42
COc1cccc([C@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819385107	EE	On-Demand	Anodyne	MTNR1A	72	47
COc1cccc([C@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819385107	EE	On-Demand	Anodyne	MTNR1B	71	47
COc1cccc([C@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819385107	EE	On-Demand	Anodyne	TAAR1	32	43
COc1cccc([C@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819385107	EE	On-Demand	Anodyne	KCNK3	36	43
CC(C)c1ccc2cc(C(=O)N3CC4(CCOC4)C3)[nH]c2c1	ZINC000819385118	CG	On-Demand	Anodyne	HRH4	19	41
O=C(c1ccc(N2CCOCC2)c(F)c1)N1CC2(CCOC2)C1	ZINC000819385125	DD	On-Demand	Anodyne	SLC6A9	19	46
CCCCCCC(=O)N1CC2(CCOC2)C1	ZINC000819385142	BE	On-Demand	Anodyne	CQSS	51	33
O=C(O)C[C@H]1CCCN(Cn2nnn(-c3ccccc3)c2=S)C1	ZINC000819385193	ED	On-Demand	Anodyne	SLC6A1	62	34
O=C(O)C[C@@H]1CCCN(Cn2nnn(-c3ccccc3)c2=S)C1	ZINC000819385194	ED	On-Demand	Anodyne	SLC6A1	62	34
O=C(O)C[C@@H]1CCCN(Cn2c(=O)oc3ccc(Cl)cc32)C1	ZINC000819385198	DE	On-Demand	Anodyne	Q8MHZ5_SHEEP	43	35
O=C(O)C[C@H]1CCCN(Cn2c(=O)oc3ccc(Cl)cc32)C1	ZINC000819385199	DE	On-Demand	Anodyne	Q8MHZ5_SHEEP	43	35
O=C(O)C[C@H]1CCCN(Cn2nc3ccccn3c2=S)C1	ZINC000819385206	DE	On-Demand	Anodyne	SLC6A1	58	35
O=C(O)C[C@@H]1CCCN(Cn2nc3ccccn3c2=S)C1	ZINC000819385207	DE	On-Demand	Anodyne	SLC6A1	58	35
O=C(O)C[C@H]1CCCN(Cn2nnc3ccccc3c2=S)C1	ZINC000819385214	DE	On-Demand	Anodyne	SLC6A1	82	35
O=C(O)C[C@@H]1CCCN(Cn2nnc3ccccc3c2=S)C1	ZINC000819385215	DE	On-Demand	Anodyne	SLC6A1	82	35
O=C(O)CCCCCNC(=O)C(=O)Nc1ccc2[nH]ncc2c1	ZINC000819385218	DD	On-Demand	Anodyne	MAOB	15	45
O=C(O)CCCCCNC(=O)C(=O)Nc1ccc2[nH]ncc2c1	ZINC000819385218	DD	On-Demand	Anodyne	ROCK1	20	55
O=C(O)CCCCCNC(=O)C(=O)Nc1ccc2[nH]ncc2c1	ZINC000819385218	DD	On-Demand	Anodyne	ROCK2	18	55
O=C(O)C[C@H]1CCCN(Cn2[nH]c(-c3ccccc3)nc2=S)C1	ZINC000819385223	EF	On-Demand	Anodyne	SLC6A1	45	33
O=C(O)C[C@H]1CCCN(Cn2[nH]c(-c3ccccc3)nc2=S)C1	ZINC000819385223	EF	On-Demand	Anodyne	CCR3	54	31
O=C(O)C[C@@H]1CCCN(Cn2[nH]c(-c3ccccc3)nc2=S)C1	ZINC000819385224	EF	On-Demand	Anodyne	SLC6A1	45	33
O=C(O)C[C@@H]1CCCN(Cn2[nH]c(-c3ccccc3)nc2=S)C1	ZINC000819385224	EF	On-Demand	Anodyne	CCR3	54	31
O=C(O)C[C@@H]1CCCN(Cn2ncn(CCc3ccccn3)c2=S)C1	ZINC000819385238	FE	On-Demand	Anodyne	SLC6A1	66	35
O=C(O)C[C@H]1CCCN(Cn2ncn(CCc3ccccn3)c2=S)C1	ZINC000819385239	FE	On-Demand	Anodyne	SLC6A1	66	35
O=C(O)CCCCCNC(=O)C#Cc1ccc2c(c1)OCO2	ZINC000819385240	DD	On-Demand	Mild	LTB4R	22	43
O=C(O)C[C@H]1CCCN(Cn2sc3ccccc3c2=O)C1	ZINC000819385257	DE	On-Demand	Anodyne	SLC6A1	47	33
O=C(O)C[C@@H]1CCCN(Cn2sc3ccccc3c2=O)C1	ZINC000819385258	DE	On-Demand	Anodyne	SLC6A1	47	33
O=C(O)C[C@H]1CCCN(Cn2ncn(CCc3cccs3)c2=S)C1	ZINC000819385271	FF	On-Demand	Anodyne	SLC6A1	46	34
O=C(O)C[C@@H]1CCCN(Cn2ncn(CCc3cccs3)c2=S)C1	ZINC000819385272	FF	On-Demand	Anodyne	SLC6A1	46	34
O=C(O)C[C@H]1CCCN(Cn2ncn(-c3ccccc3)c2=S)C1	ZINC000819385277	EF	On-Demand	Anodyne	SLC6A1	47	33
O=C(O)C[C@@H]1CCCN(Cn2ncn(-c3ccccc3)c2=S)C1	ZINC000819385279	EF	On-Demand	Anodyne	SLC6A1	47	33
O=C(O)C[C@H]1CCCN(Cn2c(=O)oc3ccccc32)C1	ZINC000819385281	CD	On-Demand	Anodyne	TSPO	15	42
O=C(O)C[C@@H]1CCCN(Cn2c(=O)oc3ccccc32)C1	ZINC000819385283	CD	On-Demand	Anodyne	TSPO	15	42
COc1ccc(OC)c([C@H](O)CNC(=O)C[C@@H](C)n2cccn2)c1	ZINC000819385290	ED	On-Demand	Anodyne	MTNR1A	26	44
COc1ccc(OC)c([C@H](O)CNC(=O)C[C@H](C)n2cccn2)c1	ZINC000819385291	ED	On-Demand	Anodyne	MTNR1A	26	44
Cc1ccccc1[C@@H](O)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819385364	GF	On-Demand	Mild	PAPA1_CARPA	63	57
Cc1ccccc1[C@@H](O)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819385364	GF	On-Demand	Mild	CCKAR	51	39
Cc1ccccc1[C@@H](O)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819385364	GF	On-Demand	Mild	CTSK	20	46
Cc1ccccc1[C@@H](O)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819385364	GF	On-Demand	Mild	CTSL	34	57
Cc1ccccc1[C@@H](O)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819385364	GF	On-Demand	Mild	TACR3	15	40
Cc1ccccc1[C@@H](O)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819385364	GF	On-Demand	Mild	REN	54	40
Cc1ccccc1[C@@H](O)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819385364	GF	On-Demand	Mild	CTSS	24	57
Cc1ccccc1[C@@H](O)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819385364	GF	On-Demand	Mild	FPR1	51	43
Cc1ccccc1[C@@H](O)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819385365	GF	On-Demand	Mild	PAPA1_CARPA	63	57
Cc1ccccc1[C@@H](O)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819385365	GF	On-Demand	Mild	CCKAR	51	39
Cc1ccccc1[C@@H](O)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819385365	GF	On-Demand	Mild	CTSK	20	46
Cc1ccccc1[C@@H](O)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819385365	GF	On-Demand	Mild	CTSL	34	57
Cc1ccccc1[C@@H](O)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819385365	GF	On-Demand	Mild	TACR3	15	40
Cc1ccccc1[C@@H](O)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819385365	GF	On-Demand	Mild	REN	54	40
Cc1ccccc1[C@@H](O)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819385365	GF	On-Demand	Mild	CTSS	24	57
Cc1ccccc1[C@@H](O)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819385365	GF	On-Demand	Mild	FPR1	51	43
O=C(NC[C@@H](O)COc1cccc(C(F)(F)F)c1)C(F)=C1CCC1	ZINC000819385366	EF	On-Demand	Anodyne	ADRB2	15	40
O=C(NC[C@@H](O)COc1cccc(C(F)(F)F)c1)C(F)=C1CCC1	ZINC000819385366	EF	On-Demand	Anodyne	ADRB1	23	44
O=C(NC[C@@H](O)COc1cccc(C(F)(F)F)c1)C(F)=C1CCC1	ZINC000819385366	EF	On-Demand	Anodyne	PDS	63	45
O=C(NC[C@H](O)COc1cccc(C(F)(F)F)c1)C(F)=C1CCC1	ZINC000819385367	EF	On-Demand	Anodyne	ADRB2	15	40
O=C(NC[C@H](O)COc1cccc(C(F)(F)F)c1)C(F)=C1CCC1	ZINC000819385367	EF	On-Demand	Anodyne	ADRB1	23	44
O=C(NC[C@H](O)COc1cccc(C(F)(F)F)c1)C(F)=C1CCC1	ZINC000819385367	EF	On-Demand	Anodyne	PDS	63	45
O=C(O)C[C@H]1CCCN(Cn2ncc3ccccc3c2=O)C1	ZINC000819385383	DD	On-Demand	Anodyne	SLC6A1	50	34
O=C(O)C[C@H]1CCCN(Cn2ncc3ccccc3c2=O)C1	ZINC000819385383	DD	On-Demand	Anodyne	Q8MHZ5_SHEEP	45	33
O=C(O)C[C@@H]1CCCN(Cn2ncc3ccccc3c2=O)C1	ZINC000819385384	DD	On-Demand	Anodyne	SLC6A1	50	34
O=C(O)C[C@@H]1CCCN(Cn2ncc3ccccc3c2=O)C1	ZINC000819385384	DD	On-Demand	Anodyne	Q8MHZ5_SHEEP	45	33
O=C(O)C[C@H]1CCCN(Cn2nc(-c3ccccc3F)ccc2=O)C1	ZINC000819385385	EE	On-Demand	Anodyne	SLC6A1	53	36
O=C(O)C[C@@H]1CCCN(Cn2nc(-c3ccccc3F)ccc2=O)C1	ZINC000819385386	EE	On-Demand	Anodyne	SLC6A1	53	36
O=C(O)CCC(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819385387	GE	On-Demand	Anodyne	TBXA2R	43	36
O=C(O)CCC(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819385387	GE	On-Demand	Anodyne	PRTN3	58	39
O=C(O)CCC(=O)c1ccc(S(=O)(=O)Nc2ccccc2CC(=O)O)cc1	ZINC000819385387	GE	On-Demand	Anodyne	LIMK2	35	46
O=C(O)C[C@H]1CCCN(Cn2nc(Cc3ccccc3F)oc2=S)C1	ZINC000819385406	FG	On-Demand	Anodyne	SLC6A1	56	38
O=C(O)C[C@@H]1CCCN(Cn2nc(Cc3ccccc3F)oc2=S)C1	ZINC000819385407	FG	On-Demand	Anodyne	SLC6A1	56	38
O=C(O)C[C@H]1CCCN(Cn2nc(Cc3cccc(F)c3)oc2=S)C1	ZINC000819385410	FG	On-Demand	Anodyne	CCR3	41	32
O=C(O)C[C@H]1CCCN(Cn2nc(Cc3cccc(F)c3)oc2=S)C1	ZINC000819385410	FG	On-Demand	Anodyne	CCR5	77	37
O=C(O)C[C@@H]1CCCN(Cn2nc(Cc3cccc(F)c3)oc2=S)C1	ZINC000819385411	FG	On-Demand	Anodyne	CCR3	41	32
O=C(O)C[C@@H]1CCCN(Cn2nc(Cc3cccc(F)c3)oc2=S)C1	ZINC000819385411	FG	On-Demand	Anodyne	CCR5	77	37
O=C(O)C[C@H]1CCCN(Cn2ccc(=S)c3ccccc32)C1	ZINC000819385412	DH	On-Demand	Anodyne	SLC6A1	92	37
O=C(O)C[C@@H]1CCCN(Cn2ccc(=S)c3ccccc32)C1	ZINC000819385413	DH	On-Demand	Anodyne	SLC6A1	92	37
O=C(O)C[C@@H]1CCCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000819385416	ED	On-Demand	Anodyne	HDAC1	18	44
O=C(O)C[C@@H]1CCCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000819385416	ED	On-Demand	Anodyne	DGAT1	26	40
O=C(O)C[C@@H]1CCCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000819385416	ED	On-Demand	Anodyne	HPGDS	18	41
O=C(O)C[C@H]1CCCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000819385417	ED	On-Demand	Anodyne	HDAC1	18	44
O=C(O)C[C@H]1CCCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000819385417	ED	On-Demand	Anodyne	DGAT1	26	40
O=C(O)C[C@H]1CCCN(c2ccc(C(=O)Nc3nncs3)cn2)C1	ZINC000819385417	ED	On-Demand	Anodyne	HPGDS	18	41
O=C(O)C[C@H]1CCCN(Cn2nc(Nc3cccc(F)c3)sc2=S)C1	ZINC000819385420	GH	On-Demand	Anodyne	CCR3	71	40
O=C(O)C[C@@H]1CCCN(Cn2nc(Nc3cccc(F)c3)sc2=S)C1	ZINC000819385423	GH	On-Demand	Anodyne	CCR3	71	40
O=C(O)C[C@H]1CCCN(Cn2cnc(-c3ccccc3)n2)C1	ZINC000819385431	DE	On-Demand	Anodyne	SLC6A1	47	35
O=C(O)C[C@@H]1CCCN(Cn2cnc(-c3ccccc3)n2)C1	ZINC000819385433	DE	On-Demand	Anodyne	SLC6A1	47	35
O=C(O)C[C@@H]1CCCN(c2nc(-c3ccncc3)nc3ccccc23)C1	ZINC000819385455	EG	On-Demand	Anodyne	SMO	18	41
O=C(O)C[C@H]1CCCN(c2nc(-c3ccncc3)nc3ccccc23)C1	ZINC000819385457	EG	On-Demand	Anodyne	SMO	18	41
O=C(O)C[C@H]1CCCN(Cn2c(=S)ncn2-c2ccccc2)C1	ZINC000819385460	EF	On-Demand	Anodyne	SLC6A1	50	33
O=C(O)C[C@@H]1CCCN(Cn2c(=S)ncn2-c2ccccc2)C1	ZINC000819385462	EF	On-Demand	Anodyne	SLC6A1	50	33
O=C(O)C[C@H]1CCCN(Cn2nc(-c3ccccc3F)n(C3CC3)c2=S)C1	ZINC000819385464	GH	On-Demand	Anodyne	SLC6A1	65	38
O=C(O)C[C@@H]1CCCN(Cn2nc(-c3ccccc3F)n(C3CC3)c2=S)C1	ZINC000819385467	GH	On-Demand	Anodyne	SLC6A1	65	38
COc1ccc([C@@H](O)CNC(=O)c2cn(-c3ccccc3)nc2C(C)C)cc1	ZINC000819385474	GG	On-Demand	Anodyne	CYP24A1	24	42
COc1ccc([C@@H](O)CNC(=O)c2cn(-c3ccccc3)nc2C(C)C)cc1	ZINC000819385474	GG	On-Demand	Anodyne	CYP27B1	32	42
O=C(O)C[C@@H]1CCCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000819385478	DB	On-Demand	Anodyne	SCD1	60	50
O=C(O)C[C@@H]1CCCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000819385478	DB	On-Demand	Anodyne	SCD	48	48
O=C(O)C[C@H]1CCCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000819385480	DB	On-Demand	Anodyne	SCD1	60	50
O=C(O)C[C@H]1CCCN(c2ccc(C(=O)NCCO)nn2)C1	ZINC000819385480	DB	On-Demand	Anodyne	SCD	48	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H](O)COc1ccccc1	ZINC000819385481	FD	On-Demand	Anodyne	ADRB2	38	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H](O)COc1ccccc1	ZINC000819385481	FD	On-Demand	Anodyne	ADRB1	54	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H](O)COc1ccccc1	ZINC000819385481	FD	On-Demand	Anodyne	PDS	52	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H](O)COc1ccccc1	ZINC000819385483	FD	On-Demand	Anodyne	ADRB2	38	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H](O)COc1ccccc1	ZINC000819385483	FD	On-Demand	Anodyne	ADRB1	54	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H](O)COc1ccccc1	ZINC000819385483	FD	On-Demand	Anodyne	PDS	52	36
O=C(O)C[C@H]1CCCN(Cn2nc(-c3ccc(F)cc3)oc2=O)C1	ZINC000819385493	ED	On-Demand	Anodyne	CCR3	68	35
O=C(O)C[C@@H]1CCCN(Cn2nc(-c3ccc(F)cc3)oc2=O)C1	ZINC000819385495	ED	On-Demand	Anodyne	CCR3	68	35
O=C(O)C[C@H]1CCCN(Cn2nc(-c3ccc(F)cc3)ccc2=O)C1	ZINC000819385498	EE	On-Demand	Anodyne	CCR3	93	35
O=C(O)C[C@H]1CCCN(Cn2nc(-c3ccc(F)cc3)ccc2=O)C1	ZINC000819385498	EE	On-Demand	Anodyne	Q8MHZ5_SHEEP	40	40
O=C(O)C[C@@H]1CCCN(Cn2nc(-c3ccc(F)cc3)ccc2=O)C1	ZINC000819385500	EE	On-Demand	Anodyne	CCR3	93	35
O=C(O)C[C@@H]1CCCN(Cn2nc(-c3ccc(F)cc3)ccc2=O)C1	ZINC000819385500	EE	On-Demand	Anodyne	Q8MHZ5_SHEEP	40	40
O=C(O)C[C@H]1CCCN(c2nccc(N3CCCC3)n2)C1	ZINC000819385502	CD	On-Demand	Anodyne	SORD	98	40
O=C(O)C[C@H]1CCCN(c2nccc(N3CCCC3)n2)C1	ZINC000819385502	CD	On-Demand	Anodyne	GPBAR1	18	41
O=C(O)C[C@@H]1CCCN(c2nccc(N3CCCC3)n2)C1	ZINC000819385504	CD	On-Demand	Anodyne	SORD	98	40
O=C(O)C[C@@H]1CCCN(c2nccc(N3CCCC3)n2)C1	ZINC000819385504	CD	On-Demand	Anodyne	GPBAR1	18	41
O=C(O)C[C@H]1CCCN(Cn2ncn(-c3ccccc3F)c2=S)C1	ZINC000819385512	FF	On-Demand	Anodyne	SLC6A1	52	35
O=C(O)C[C@@H]1CCCN(Cn2ncn(-c3ccccc3F)c2=S)C1	ZINC000819385513	FF	On-Demand	Anodyne	SLC6A1	52	35
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccccc2C)c1	ZINC000819385523	EE	On-Demand	Anodyne	ADRB2	45	37
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccccc2C)c1	ZINC000819385523	EE	On-Demand	Anodyne	KCNK3	91	38
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccccc2C)c1	ZINC000819385523	EE	On-Demand	Anodyne	KCNK9	68	36
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccccc2C)c1	ZINC000819385525	EE	On-Demand	Anodyne	ADRB2	45	37
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccccc2C)c1	ZINC000819385525	EE	On-Demand	Anodyne	KCNK3	91	38
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccccc2C)c1	ZINC000819385525	EE	On-Demand	Anodyne	KCNK9	68	36
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819385556	EE	On-Demand	Anodyne	ADRB2	55	40
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819385556	EE	On-Demand	Anodyne	KCNK3	72	37
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819385556	EE	On-Demand	Anodyne	KCNK9	51	37
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819385557	EE	On-Demand	Anodyne	ADRB2	55	40
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819385557	EE	On-Demand	Anodyne	KCNK3	72	37
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819385557	EE	On-Demand	Anodyne	KCNK9	51	37
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819385573	DG	On-Demand	Mild	PDS	40	35
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819385574	DG	On-Demand	Mild	PDS	40	35
O=C(O)C[C@@H]1CCCN(Cn2c(C3CC3)nn(-c3ccccc3)c2=S)C1	ZINC000819385582	FG	On-Demand	Anodyne	SLC6A1	47	33
O=C(O)C[C@H]1CCCN(Cn2c(C3CC3)nn(-c3ccccc3)c2=S)C1	ZINC000819385583	FG	On-Demand	Anodyne	SLC6A1	47	33
O=C(O)C[C@H]1CCCN(Cn2nnn(-c3ccccc3)c2=O)C1	ZINC000819385586	DC	On-Demand	Anodyne	SLC6A1	53	33
O=C(O)C[C@@H]1CCCN(Cn2nnn(-c3ccccc3)c2=O)C1	ZINC000819385587	DC	On-Demand	Anodyne	SLC6A1	53	33
O=C(O)C[C@@H]1CCCN(Cn2nc(-c3ccccc3)c3ccccc3c2=O)C1	ZINC000819385600	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	41	32
O=C(O)C[C@H]1CCCN(Cn2nc(-c3ccccc3)c3ccccc3c2=O)C1	ZINC000819385601	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	41	32
O=C(O)C[C@@H]1CCCN(S(=O)(=O)/C=C\c2ccccc2Cl)C1	ZINC000819385610	EF	On-Demand	Anodyne	SLC6A1	60	40
O=C(O)C[C@H]1CCCN(S(=O)(=O)/C=C\c2ccccc2Cl)C1	ZINC000819385611	EF	On-Demand	Anodyne	SLC6A1	60	40
C=CCCn1cc(C(=O)NC[C@H](O)c2cccc(F)c2)nn1	ZINC000819385616	DD	On-Demand	Mild	SCD1	15	43
C=CCCn1cc(C(=O)NC[C@@H](O)c2cccc(F)c2)nn1	ZINC000819385617	DD	On-Demand	Mild	SCD1	15	43
Cc1ccccc1[C@@H](O)CNC(=O)c1cn(-c2ccccc2)nc1C(C)C	ZINC000819385618	FH	On-Demand	Anodyne	CTSA	56	45
Cc1ccccc1[C@@H](O)CNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819385634	EG	On-Demand	Anodyne	CRTM	41	36
Cc1ccccc1[C@@H](O)CNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819385634	EG	On-Demand	Anodyne	PDS	41	33
Cc1ccccc1[C@H](O)CNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819385635	EG	On-Demand	Anodyne	CRTM	41	36
Cc1ccccc1[C@H](O)CNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819385635	EG	On-Demand	Anodyne	PDS	41	33
COc1ccccc1[C@@H](O)CNC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819385643	FD	On-Demand	Anodyne	PAPA1_CARPA	31	40
O=C(NC[C@@H](O)COc1ccc(F)cc1)C(F)=C1CCC1	ZINC000819385651	CE	On-Demand	Anodyne	ADRB2	38	42
O=C(NC[C@@H](O)COc1ccc(F)cc1)C(F)=C1CCC1	ZINC000819385651	CE	On-Demand	Anodyne	ADRB1	59	45
O=C(NC[C@@H](O)COc1ccc(F)cc1)C(F)=C1CCC1	ZINC000819385651	CE	On-Demand	Anodyne	ADRB3	31	40
O=C(NC[C@H](O)COc1ccc(F)cc1)C(F)=C1CCC1	ZINC000819385652	CE	On-Demand	Anodyne	ADRB2	38	42
O=C(NC[C@H](O)COc1ccc(F)cc1)C(F)=C1CCC1	ZINC000819385652	CE	On-Demand	Anodyne	ADRB1	59	45
O=C(NC[C@H](O)COc1ccc(F)cc1)C(F)=C1CCC1	ZINC000819385652	CE	On-Demand	Anodyne	ADRB3	31	40
COc1ccccc1[C@@H](O)CNC(=O)C1(c2ccc(C)cc2)CCC1	ZINC000819385654	EG	On-Demand	Anodyne	KCNA3	43	37
O=C(/C=C/[C@@H]1CCCO1)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819385655	EF	On-Demand	Anodyne	CCR2	49	36
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819385656	EF	On-Demand	Anodyne	CCR2	49	36
O=C(/C=C\[C@@H]1CCCO1)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819385657	EF	On-Demand	Anodyne	CCR2	49	36
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819385658	EF	On-Demand	Anodyne	CCR2	49	36
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2cccc(OC(C)C)c2)c1	ZINC000819385684	GE	On-Demand	Anodyne	MTNR1A	25	44
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2cccc(OC(C)C)c2)c1	ZINC000819385684	GE	On-Demand	Anodyne	MTNR1B	28	44
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2cccc(OC(C)C)c2)c1	ZINC000819385686	GE	On-Demand	Anodyne	MTNR1A	25	44
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2cccc(OC(C)C)c2)c1	ZINC000819385686	GE	On-Demand	Anodyne	MTNR1B	28	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819385691	GF	On-Demand	Anodyne	CCR2	49	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819385691	GF	On-Demand	Anodyne	PDS	40	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819385692	GF	On-Demand	Anodyne	CCR2	49	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819385692	GF	On-Demand	Anodyne	PDS	40	35
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2ccccc2C)c1	ZINC000819385713	ED	On-Demand	Anodyne	MTNR1A	27	46
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2ccccc2C)c1	ZINC000819385713	ED	On-Demand	Anodyne	MTNR1B	30	40
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2ccccc2C)c1	ZINC000819385714	ED	On-Demand	Anodyne	MTNR1A	27	46
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2ccccc2C)c1	ZINC000819385714	ED	On-Demand	Anodyne	MTNR1B	30	40
COc1ccc([C@@H](O)CNC(=O)c2c(C)ccc(Br)c2OC)cc1	ZINC000819385721	GG	On-Demand	Anodyne	ADRB3	15	40
COc1ccc(OC)c([C@H](O)CNC(=O)c2cnc3cc(OC)ccn23)c1	ZINC000819385726	FD	On-Demand	Anodyne	MTNR1A	18	42
COc1ccccc1[C@@H](O)CNC(=O)c1cn(-c2ccccc2)nc1C(C)C	ZINC000819385743	GG	On-Demand	Anodyne	KCNA3	31	44
COc1ccccc1[C@@H](O)CNC(=O)c1cn(-c2ccccc2)nc1C(C)C	ZINC000819385743	GG	On-Demand	Anodyne	CTSA	20	45
O=C(NC[C@@H](O)c1ccccc1C(F)(F)F)c1cc2c(cn1)OCCO2	ZINC000819385774	FE	On-Demand	Anodyne	SCD1	34	42
O=C(NC[C@@H](O)c1ccccc1C(F)(F)F)c1cc2c(cn1)OCCO2	ZINC000819385774	FE	On-Demand	Anodyne	SCD	39	42
O=C(NC[C@H](O)c1ccccc1C(F)(F)F)c1cc2c(cn1)OCCO2	ZINC000819385775	FE	On-Demand	Anodyne	SCD1	34	42
O=C(NC[C@H](O)c1ccccc1C(F)(F)F)c1cc2c(cn1)OCCO2	ZINC000819385775	FE	On-Demand	Anodyne	SCD	39	42
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1cccc(OC)c1	ZINC000819385776	CE	On-Demand	Mild	ADRB3	35	41
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1cccc(OC)c1	ZINC000819385776	CE	On-Demand	Mild	MTNR1A	51	45
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1cccc(OC)c1	ZINC000819385776	CE	On-Demand	Mild	MTNR1B	53	44
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1cccc(OC)c1	ZINC000819385777	CE	On-Demand	Mild	ADRB3	35	41
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1cccc(OC)c1	ZINC000819385777	CE	On-Demand	Mild	MTNR1A	51	45
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1cccc(OC)c1	ZINC000819385777	CE	On-Demand	Mild	MTNR1B	53	44
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819385819	GG	On-Demand	Anodyne	KCNK3	61	43
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819385819	GG	On-Demand	Anodyne	KCNK9	56	43
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819385820	GG	On-Demand	Anodyne	KCNK3	61	43
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819385820	GG	On-Demand	Anodyne	KCNK9	56	43
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1cccc(F)c1	ZINC000819385840	FG	On-Demand	Anodyne	ADRB1	18	43
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1cccc(F)c1	ZINC000819385840	FG	On-Demand	Anodyne	ADRB3	25	43
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1cccc(F)c1	ZINC000819385841	FG	On-Demand	Anodyne	ADRB1	18	43
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1cccc(F)c1	ZINC000819385841	FG	On-Demand	Anodyne	ADRB3	25	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](O)c1cccc(OC)c1)C2	ZINC000819385842	FD	On-Demand	Anodyne	MTNR1A	22	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](O)c1cccc(OC)c1)C2	ZINC000819385842	FD	On-Demand	Anodyne	MTNR1B	23	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](O)c1cccc(OC)c1)C2	ZINC000819385843	FD	On-Demand	Anodyne	MTNR1A	22	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](O)c1cccc(OC)c1)C2	ZINC000819385843	FD	On-Demand	Anodyne	MTNR1B	23	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](O)c1cccc(OC)c1)C2	ZINC000819385844	FD	On-Demand	Anodyne	MTNR1A	22	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](O)c1cccc(OC)c1)C2	ZINC000819385844	FD	On-Demand	Anodyne	MTNR1B	23	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](O)c1cccc(OC)c1)C2	ZINC000819385845	FD	On-Demand	Anodyne	MTNR1A	22	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](O)c1cccc(OC)c1)C2	ZINC000819385845	FD	On-Demand	Anodyne	MTNR1B	23	42
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1ccc(OC)cc1	ZINC000819385856	CE	On-Demand	Mild	MTNR1A	20	43
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1ccc(OC)cc1	ZINC000819385857	CE	On-Demand	Mild	MTNR1A	20	43
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819385862	FE	On-Demand	Anodyne	PTGFR	28	41
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819385862	FE	On-Demand	Anodyne	PDS	46	40
O=C(/C=C/[C@@H]1CCCO1)NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819385863	FE	On-Demand	Anodyne	PTGFR	28	41
O=C(/C=C/[C@@H]1CCCO1)NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819385863	FE	On-Demand	Anodyne	PDS	46	40
O=C(/C=C\[C@@H]1CCCO1)NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819385864	FE	On-Demand	Anodyne	PTGFR	28	41
O=C(/C=C\[C@@H]1CCCO1)NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819385864	FE	On-Demand	Anodyne	PDS	46	40
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819385865	FE	On-Demand	Anodyne	PTGFR	28	41
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819385865	FE	On-Demand	Anodyne	PDS	46	40
O=C(/C=C/[C@@H]1CCCO1)NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819385866	EE	On-Demand	Anodyne	CTSS	16	42
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819385867	EE	On-Demand	Anodyne	CTSS	16	42
O=C(/C=C\[C@@H]1CCCO1)NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819385868	EE	On-Demand	Anodyne	CTSS	16	42
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819385869	EE	On-Demand	Anodyne	CTSS	16	42
O=C(NC[C@@H](O)COc1ccc(C(F)(F)F)cc1)C(F)=C1CCC1	ZINC000819385880	EF	On-Demand	Anodyne	ADRB2	21	43
O=C(NC[C@@H](O)COc1ccc(C(F)(F)F)cc1)C(F)=C1CCC1	ZINC000819385880	EF	On-Demand	Anodyne	ADRB1	38	47
O=C(NC[C@H](O)COc1ccc(C(F)(F)F)cc1)C(F)=C1CCC1	ZINC000819385881	EF	On-Demand	Anodyne	ADRB2	21	43
O=C(NC[C@H](O)COc1ccc(C(F)(F)F)cc1)C(F)=C1CCC1	ZINC000819385881	EF	On-Demand	Anodyne	ADRB1	38	47
COc1ccc(OC)c([C@H](O)CNC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819385890	DD	On-Demand	Anodyne	MTNR1A	18	40
COc1ccc(OC)c([C@H](O)CNC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819385891	DD	On-Demand	Anodyne	MTNR1A	18	40
COc1ccc(OC)c([C@H](O)CNC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819385892	DD	On-Demand	Anodyne	MTNR1A	18	40
COc1ccc(OC)c([C@H](O)CNC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819385893	DD	On-Demand	Anodyne	MTNR1A	18	40
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819385897	EH	On-Demand	Anodyne	EPHX2	27	40
C[C@@H]1CCCC[C@H]1C(=O)NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819385898	EH	On-Demand	Anodyne	EPHX2	27	40
C[C@@H]1CCCC[C@H]1C(=O)NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819385899	EH	On-Demand	Anodyne	EPHX2	27	40
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819385900	EH	On-Demand	Anodyne	EPHX2	27	40
O=C(NC[C@H](O)COc1cccc(Cl)c1Cl)C(F)=C1CCC1	ZINC000819385909	EG	On-Demand	Anodyne	ADRB2	22	46
O=C(NC[C@H](O)COc1cccc(Cl)c1Cl)C(F)=C1CCC1	ZINC000819385909	EG	On-Demand	Anodyne	ADRB1	58	34
O=C(NC[C@@H](O)COc1cccc(Cl)c1Cl)C(F)=C1CCC1	ZINC000819385910	EG	On-Demand	Anodyne	ADRB2	22	46
O=C(NC[C@@H](O)COc1cccc(Cl)c1Cl)C(F)=C1CCC1	ZINC000819385910	EG	On-Demand	Anodyne	ADRB1	58	34
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819385915	EH	On-Demand	Anodyne	CACNA1B	46	35
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819385915	EH	On-Demand	Anodyne	CCR2	75	39
C[C@@H]1CCCC[C@H]1C(=O)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819385916	EH	On-Demand	Anodyne	CACNA1B	46	35
C[C@@H]1CCCC[C@H]1C(=O)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819385916	EH	On-Demand	Anodyne	CCR2	75	39
C[C@@H]1CCCC[C@H]1C(=O)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819385917	EH	On-Demand	Anodyne	CACNA1B	46	35
C[C@@H]1CCCC[C@H]1C(=O)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819385917	EH	On-Demand	Anodyne	CCR2	75	39
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819385918	EH	On-Demand	Anodyne	CACNA1B	46	35
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819385918	EH	On-Demand	Anodyne	CCR2	75	39
O=C(NC[C@@H](O)c1cccc(F)c1)c1cc2c(cn1)OCCO2	ZINC000819385919	DD	On-Demand	Anodyne	SCD1	18	45
O=C(NC[C@@H](O)c1cccc(F)c1)c1cc2c(cn1)OCCO2	ZINC000819385919	DD	On-Demand	Anodyne	SCD	29	45
O=C(NC[C@H](O)c1cccc(F)c1)c1cc2c(cn1)OCCO2	ZINC000819385920	DD	On-Demand	Anodyne	SCD1	18	45
O=C(NC[C@H](O)c1cccc(F)c1)c1cc2c(cn1)OCCO2	ZINC000819385920	DD	On-Demand	Anodyne	SCD	29	45
O=C(NC[C@@H](O)c1cccc(C(F)(F)F)c1)C(F)=C1CCC1	ZINC000819385925	DG	On-Demand	Anodyne	PDS	40	35
O=C(NC[C@H](O)c1cccc(C(F)(F)F)c1)C(F)=C1CCC1	ZINC000819385926	DG	On-Demand	Anodyne	PDS	40	35
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819385927	GF	On-Demand	Anodyne	ADRB2	54	39
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819385927	GF	On-Demand	Anodyne	GCGR	30	40
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819385927	GF	On-Demand	Anodyne	ADRB3	33	41
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819385927	GF	On-Demand	Anodyne	CSNK1D	20	41
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819385927	GF	On-Demand	Anodyne	SHH	40	36
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819385928	GF	On-Demand	Anodyne	ADRB2	54	39
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819385928	GF	On-Demand	Anodyne	GCGR	30	40
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819385928	GF	On-Demand	Anodyne	ADRB3	33	41
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819385928	GF	On-Demand	Anodyne	CSNK1D	20	41
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819385928	GF	On-Demand	Anodyne	SHH	40	36
COc1ccc(OC)c([C@H](O)CNC(=O)c2cc3c(cn2)OCCO3)c1	ZINC000819385933	FD	On-Demand	Anodyne	MTNR1A	16	41
COc1ccc(OC)c([C@H](O)CNC(=O)[C@@H]2CCCO[C@@H]2C(C)C)c1	ZINC000819385938	FE	On-Demand	Anodyne	MTNR1A	27	41
COc1ccc(OC)c([C@H](O)CNC(=O)[C@@H]2CCCO[C@@H]2C(C)C)c1	ZINC000819385938	FE	On-Demand	Anodyne	MTNR1B	24	41
C=CCC1(C(=O)NC[C@H](O)c2cc(OC)ccc2OC)CCOCC1	ZINC000819385940	EE	On-Demand	Mild	MTNR1A	15	41
C=CCC1(C(=O)NC[C@@H](O)c2cc(OC)ccc2OC)CCOCC1	ZINC000819385941	EE	On-Demand	Mild	MTNR1A	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](O)c1cccc(F)c1)C2	ZINC000819385944	FD	On-Demand	Anodyne	SLC6A3	17	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](O)c1cccc(F)c1)C2	ZINC000819385945	FD	On-Demand	Anodyne	SLC6A3	17	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](O)c1cccc(F)c1)C2	ZINC000819385946	FD	On-Demand	Anodyne	SLC6A3	17	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](O)c1cccc(F)c1)C2	ZINC000819385947	FD	On-Demand	Anodyne	SLC6A3	17	41
COc1ccc([C@@H](O)CNC(=O)C[S@](=O)c2cccc(OC)c2)cc1	ZINC000819385949	FD	On-Demand	Anodyne	MTNR1A	57	46
COc1ccc([C@@H](O)CNC(=O)C[S@](=O)c2cccc(OC)c2)cc1	ZINC000819385949	FD	On-Demand	Anodyne	MTNR1B	56	45
COc1ccc([C@@H](O)CNC(=O)C[S@@](=O)c2cccc(OC)c2)cc1	ZINC000819385951	FD	On-Demand	Anodyne	MTNR1A	57	46
COc1ccc([C@@H](O)CNC(=O)C[S@@](=O)c2cccc(OC)c2)cc1	ZINC000819385951	FD	On-Demand	Anodyne	MTNR1B	56	45
COc1cccc([C@H](O)CNC(=O)C[C@@H](C)n2cccn2)c1	ZINC000819386009	DD	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@H](O)CNC(=O)C[C@@H](C)n2cccn2)c1	ZINC000819386009	DD	On-Demand	Anodyne	ADRB3	19	40
COc1cccc([C@H](O)CNC(=O)C[C@@H](C)n2cccn2)c1	ZINC000819386009	DD	On-Demand	Anodyne	MTNR1A	28	42
COc1cccc([C@H](O)CNC(=O)C[C@@H](C)n2cccn2)c1	ZINC000819386009	DD	On-Demand	Anodyne	MTNR1B	33	42
COc1cccc([C@H](O)CNC(=O)C[C@H](C)n2cccn2)c1	ZINC000819386010	DD	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@H](O)CNC(=O)C[C@H](C)n2cccn2)c1	ZINC000819386010	DD	On-Demand	Anodyne	ADRB3	19	40
COc1cccc([C@H](O)CNC(=O)C[C@H](C)n2cccn2)c1	ZINC000819386010	DD	On-Demand	Anodyne	MTNR1A	28	42
COc1cccc([C@H](O)CNC(=O)C[C@H](C)n2cccn2)c1	ZINC000819386010	DD	On-Demand	Anodyne	MTNR1B	33	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](O)COc1ccccc1)C2	ZINC000819386032	FD	On-Demand	Anodyne	ADRB2	31	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](O)COc1ccccc1)C2	ZINC000819386032	FD	On-Demand	Anodyne	ADRB1	51	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](O)COc1ccccc1)C2	ZINC000819386033	FD	On-Demand	Anodyne	ADRB2	31	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](O)COc1ccccc1)C2	ZINC000819386033	FD	On-Demand	Anodyne	ADRB1	51	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](O)COc1ccccc1)C2	ZINC000819386034	FD	On-Demand	Anodyne	ADRB2	31	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](O)COc1ccccc1)C2	ZINC000819386034	FD	On-Demand	Anodyne	ADRB1	51	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](O)COc1ccccc1)C2	ZINC000819386035	FD	On-Demand	Anodyne	ADRB2	31	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](O)COc1ccccc1)C2	ZINC000819386035	FD	On-Demand	Anodyne	ADRB1	51	36
COc1cccc([C@H](O)CNC(=O)C(F)=C2CCC2)c1	ZINC000819386040	CE	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](O)CNC(=O)C(F)=C2CCC2)c1	ZINC000819386040	CE	On-Demand	Anodyne	MTNR1A	37	41
COc1cccc([C@H](O)CNC(=O)C(F)=C2CCC2)c1	ZINC000819386040	CE	On-Demand	Anodyne	MTNR1B	39	40
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H](O)COc1ccccc1	ZINC000819386078	CD	On-Demand	Anodyne	ADRB2	36	43
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H](O)COc1ccccc1	ZINC000819386078	CD	On-Demand	Anodyne	ADRB1	56	40
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H](O)COc1ccccc1	ZINC000819386079	CD	On-Demand	Anodyne	ADRB2	36	43
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H](O)COc1ccccc1	ZINC000819386079	CD	On-Demand	Anodyne	ADRB1	56	40
O=C(/C=C/[C@@H]1CCCO1)NC[C@H](O)COc1ccccc1	ZINC000819386080	CD	On-Demand	Anodyne	ADRB2	36	43
O=C(/C=C/[C@@H]1CCCO1)NC[C@H](O)COc1ccccc1	ZINC000819386080	CD	On-Demand	Anodyne	ADRB1	56	40
O=C(/C=C\[C@@H]1CCCO1)NC[C@H](O)COc1ccccc1	ZINC000819386081	CD	On-Demand	Anodyne	ADRB2	36	43
O=C(/C=C\[C@@H]1CCCO1)NC[C@H](O)COc1ccccc1	ZINC000819386081	CD	On-Demand	Anodyne	ADRB1	56	40
C[C@H](CC(=O)NC[C@@H](O)c1cccc(C(F)(F)F)c1)n1cccn1	ZINC000819386090	EF	On-Demand	Anodyne	PDS	40	34
C[C@@H](CC(=O)NC[C@H](O)c1cccc(C(F)(F)F)c1)n1cccn1	ZINC000819386091	EF	On-Demand	Anodyne	PDS	40	34
C[C@H](CC(=O)NC[C@H](O)c1cccc(C(F)(F)F)c1)n1cccn1	ZINC000819386092	EF	On-Demand	Anodyne	PDS	40	34
C[C@@H](CC(=O)NC[C@@H](O)c1cccc(C(F)(F)F)c1)n1cccn1	ZINC000819386093	EF	On-Demand	Anodyne	PDS	40	34
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1cc(OC)ccc1OC	ZINC000819386094	DE	On-Demand	Mild	MTNR1A	42	49
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819386095	DE	On-Demand	Mild	MTNR1A	42	49
COc1ccc(OC)c([C@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819386098	FE	On-Demand	Anodyne	ADRB1	16	40
COc1ccc(OC)c([C@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819386098	FE	On-Demand	Anodyne	TSHR	70	35
COc1ccc(OC)c([C@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819386098	FE	On-Demand	Anodyne	MTNR1A	82	54
COc1ccc(OC)c([C@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819386098	FE	On-Demand	Anodyne	MTNR1B	80	43
COc1ccc(OC)c([C@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819386098	FE	On-Demand	Anodyne	FLT4	20	41
COc1ccc(OC)c([C@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819386098	FE	On-Demand	Anodyne	KCNK3	56	41
COc1ccc(OC)c([C@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819386098	FE	On-Demand	Anodyne	KCNK9	43	41
COc1ccc([C@@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819386102	EE	On-Demand	Anodyne	ADRB2	56	38
COc1ccc([C@@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819386102	EE	On-Demand	Anodyne	ADRB1	28	40
COc1ccc([C@@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819386102	EE	On-Demand	Anodyne	TSHR	48	32
COc1ccc([C@@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819386102	EE	On-Demand	Anodyne	ADRB3	43	43
COc1ccc([C@@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819386102	EE	On-Demand	Anodyne	MMP13	18	40
COc1ccc([C@@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819386102	EE	On-Demand	Anodyne	CTSL	17	40
COc1ccc([C@@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819386102	EE	On-Demand	Anodyne	MTNR1A	87	49
COc1ccc([C@@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819386102	EE	On-Demand	Anodyne	MTNR1B	79	44
COc1ccc([C@@H](O)CNC(=O)Cc2cccc(NC(C)=O)c2)cc1	ZINC000819386102	EE	On-Demand	Anodyne	KCNK3	40	38
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2ccccc2OC)c1	ZINC000819386133	FD	On-Demand	Anodyne	MTNR1A	34	47
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2ccccc2OC)c1	ZINC000819386133	FD	On-Demand	Anodyne	MTNR1B	38	41
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2ccccc2OC)c1	ZINC000819386135	FD	On-Demand	Anodyne	MTNR1A	34	47
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2ccccc2OC)c1	ZINC000819386135	FD	On-Demand	Anodyne	MTNR1B	38	41
COc1ccc(OC)c([C@H](O)CNC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819386152	FG	On-Demand	Anodyne	MTNR1A	21	44
COc1cccc([C@H](O)CNC(=O)C[S@@](=O)c2cccc(OC)c2)c1	ZINC000819386163	FD	On-Demand	Anodyne	ADRB3	25	41
COc1cccc([C@H](O)CNC(=O)C[S@@](=O)c2cccc(OC)c2)c1	ZINC000819386163	FD	On-Demand	Anodyne	MTNR1A	36	43
COc1cccc([C@H](O)CNC(=O)C[S@@](=O)c2cccc(OC)c2)c1	ZINC000819386163	FD	On-Demand	Anodyne	MTNR1B	38	43
COc1cccc([C@H](O)CNC(=O)C[S@](=O)c2cccc(OC)c2)c1	ZINC000819386165	FD	On-Demand	Anodyne	ADRB3	25	41
COc1cccc([C@H](O)CNC(=O)C[S@](=O)c2cccc(OC)c2)c1	ZINC000819386165	FD	On-Demand	Anodyne	MTNR1A	36	43
COc1cccc([C@H](O)CNC(=O)C[S@](=O)c2cccc(OC)c2)c1	ZINC000819386165	FD	On-Demand	Anodyne	MTNR1B	38	43
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819386171	GG	On-Demand	Anodyne	ADRB2	44	39
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819386171	GG	On-Demand	Anodyne	CSNK1D	27	42
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819386171	GG	On-Demand	Anodyne	CCR2	57	41
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819386171	GG	On-Demand	Anodyne	KCNK3	26	42
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819386171	GG	On-Demand	Anodyne	PDS	41	36
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819386172	GG	On-Demand	Anodyne	ADRB2	44	39
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819386172	GG	On-Demand	Anodyne	CSNK1D	27	42
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819386172	GG	On-Demand	Anodyne	CCR2	57	41
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819386172	GG	On-Demand	Anodyne	KCNK3	26	42
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819386172	GG	On-Demand	Anodyne	PDS	41	36
COc1ccccc1[C@@H](O)CNC(=O)c1cc(C)ccc1C1CC1	ZINC000819386180	EG	On-Demand	Anodyne	DRD2	24	48
COc1ccccc1[C@@H](O)CNC(=O)c1cc(C)ccc1C1CC1	ZINC000819386180	EG	On-Demand	Anodyne	DRD4	26	48
COc1ccccc1[C@@H](O)CNC(=O)c1cc(C)ccc1C1CC1	ZINC000819386180	EG	On-Demand	Anodyne	DRD3	26	43
COc1ccccc1[C@@H](O)CNC(=O)c1cc(C)ccc1C1CC1	ZINC000819386180	EG	On-Demand	Anodyne	KCNA3	46	42
COc1ccccc1[C@@H](O)CNC(=O)c1cc(C)ccc1C1CC1	ZINC000819386180	EG	On-Demand	Anodyne	KCNK3	42	41
COc1ccccc1[C@@H](O)CNC(=O)c1cc(C)ccc1C1CC1	ZINC000819386180	EG	On-Demand	Anodyne	KCNK9	40	41
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819386186	GD	On-Demand	Anodyne	MTNR1A	44	48
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819386186	GD	On-Demand	Anodyne	MTNR1B	45	42
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819386187	GD	On-Demand	Anodyne	MTNR1A	44	48
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819386187	GD	On-Demand	Anodyne	MTNR1B	45	42
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccc(OC(C)C)cc2)c1	ZINC000819386219	FF	On-Demand	Anodyne	ADRB2	49	39
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccc(OC(C)C)cc2)c1	ZINC000819386219	FF	On-Demand	Anodyne	ADRB3	35	41
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccc(OC(C)C)cc2)c1	ZINC000819386219	FF	On-Demand	Anodyne	KCNK3	43	35
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccc(OC(C)C)cc2)c1	ZINC000819386220	FF	On-Demand	Anodyne	ADRB2	49	39
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccc(OC(C)C)cc2)c1	ZINC000819386220	FF	On-Demand	Anodyne	ADRB3	35	41
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccc(OC(C)C)cc2)c1	ZINC000819386220	FF	On-Demand	Anodyne	KCNK3	43	35
Cc1ccccc1[C@@H](O)CNC(=O)c1cc2c(cn1)OCCO2	ZINC000819386223	DD	On-Demand	Anodyne	SCD1	17	40
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2cccc(OC(C)C)c2)c1	ZINC000819386234	FF	On-Demand	Anodyne	ADRB2	59	39
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2cccc(OC(C)C)c2)c1	ZINC000819386234	FF	On-Demand	Anodyne	ADRB1	37	41
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2cccc(OC(C)C)c2)c1	ZINC000819386234	FF	On-Demand	Anodyne	ADRB3	54	41
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2cccc(OC(C)C)c2)c1	ZINC000819386234	FF	On-Demand	Anodyne	KCNK3	41	35
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2cccc(OC(C)C)c2)c1	ZINC000819386235	FF	On-Demand	Anodyne	ADRB2	59	39
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2cccc(OC(C)C)c2)c1	ZINC000819386235	FF	On-Demand	Anodyne	ADRB1	37	41
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2cccc(OC(C)C)c2)c1	ZINC000819386235	FF	On-Demand	Anodyne	ADRB3	54	41
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2cccc(OC(C)C)c2)c1	ZINC000819386235	FF	On-Demand	Anodyne	KCNK3	41	35
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H](O)COc1cccc(Cl)c1Cl	ZINC000819386236	FF	On-Demand	Anodyne	ADRB2	15	43
O=C(/C=C/[C@@H]1CCCO1)NC[C@H](O)COc1cccc(Cl)c1Cl	ZINC000819386237	FF	On-Demand	Anodyne	ADRB2	15	43
O=C(/C=C\[C@@H]1CCCO1)NC[C@H](O)COc1cccc(Cl)c1Cl	ZINC000819386238	FF	On-Demand	Anodyne	ADRB2	15	43
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H](O)COc1cccc(Cl)c1Cl	ZINC000819386239	FF	On-Demand	Anodyne	ADRB2	15	43
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H](O)COc1ccc(F)cc1	ZINC000819386280	DD	On-Demand	Anodyne	ADRB1	36	43
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H](O)COc1ccc(F)cc1	ZINC000819386281	DD	On-Demand	Anodyne	ADRB1	36	43
O=C(/C=C/[C@@H]1CCCO1)NC[C@H](O)COc1ccc(F)cc1	ZINC000819386282	DD	On-Demand	Anodyne	ADRB1	36	43
O=C(/C=C\[C@@H]1CCCO1)NC[C@H](O)COc1ccc(F)cc1	ZINC000819386283	DD	On-Demand	Anodyne	ADRB1	36	43
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819386288	ED	On-Demand	Anodyne	MTNR1A	29	41
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819386288	ED	On-Demand	Anodyne	MTNR1B	30	41
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819386289	ED	On-Demand	Anodyne	MTNR1A	29	41
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819386289	ED	On-Demand	Anodyne	MTNR1B	30	41
C=CCC1(C(=O)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)CCOCC1	ZINC000819386302	FG	On-Demand	Mild	MMP13	18	41
C=CCC1(C(=O)NC[C@H](O)c2ccc(OC(F)(F)F)cc2)CCOCC1	ZINC000819386302	FG	On-Demand	Mild	MMP2	24	41
C=CCC1(C(=O)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)CCOCC1	ZINC000819386303	FG	On-Demand	Mild	MMP13	18	41
C=CCC1(C(=O)NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)CCOCC1	ZINC000819386303	FG	On-Demand	Mild	MMP2	24	41
COc1ccccc1[C@@H](O)CNC(=O)c1cc2c(cn1)OCCO2	ZINC000819386340	ED	On-Demand	Anodyne	DRD2	15	42
COc1ccccc1[C@@H](O)CNC(=O)c1cc2c(cn1)OCCO2	ZINC000819386340	ED	On-Demand	Anodyne	DRD3	29	42
COc1ccccc1[C@@H](O)CNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819386343	EE	On-Demand	Anodyne	ADRB2	49	39
COc1ccccc1[C@@H](O)CNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819386343	EE	On-Demand	Anodyne	ADRB1	19	44
COc1ccccc1[C@@H](O)CNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819386343	EE	On-Demand	Anodyne	TSHR	56	33
COc1ccccc1[C@@H](O)CNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819386343	EE	On-Demand	Anodyne	MTNR1A	31	46
COc1ccccc1[C@@H](O)CNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819386343	EE	On-Demand	Anodyne	MTNR1B	38	40
COc1ccccc1[C@@H](O)CNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819386343	EE	On-Demand	Anodyne	KCNK3	76	49
COc1ccccc1[C@@H](O)CNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819386343	EE	On-Demand	Anodyne	KCNK9	70	49
COc1ccc(OC)c([C@H](O)CNC(=O)Cc2nsc3ccccc23)c1	ZINC000819386348	FF	On-Demand	Anodyne	MTNR1A	42	44
COc1ccc(OC)c([C@H](O)CNC(=O)Cc2nsc3ccccc23)c1	ZINC000819386348	FF	On-Demand	Anodyne	MTNR1B	40	37
COc1ccc(OC)c([C@H](O)CNC(=O)C(F)=C2CCC2)c1	ZINC000819386361	DE	On-Demand	Anodyne	MTNR1A	30	45
C=CCCn1cc(C(=O)NC[C@H](O)c2ccccc2C(F)(F)F)nn1	ZINC000819386376	FE	On-Demand	Mild	SCD1	21	40
C=CCCn1cc(C(=O)NC[C@H](O)c2ccccc2C(F)(F)F)nn1	ZINC000819386376	FE	On-Demand	Mild	SCD	23	40
C=CCCn1cc(C(=O)NC[C@@H](O)c2ccccc2C(F)(F)F)nn1	ZINC000819386377	FE	On-Demand	Mild	SCD1	21	40
C=CCCn1cc(C(=O)NC[C@@H](O)c2ccccc2C(F)(F)F)nn1	ZINC000819386377	FE	On-Demand	Mild	SCD	23	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccccc1N1CCC(CO)CC1	ZINC000819386427	GF	On-Demand	Anodyne	KCNQ2	70	38
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2cccc(Cl)c2)cs1	ZINC000819386429	EI	On-Demand	Anodyne	MPL	42	36
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2cccc(Cl)c2)cs1	ZINC000819386429	EI	On-Demand	Anodyne	ROCK1	18	41
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2cccc(Cl)c2)cs1	ZINC000819386429	EI	On-Demand	Anodyne	SPHK2	37	40
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2cccc(Cl)c2)cs1	ZINC000819386429	EI	On-Demand	Anodyne	SPHK1	33	42
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2cccc(Cl)c2)cs1	ZINC000819386430	EI	On-Demand	Anodyne	MPL	42	36
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2cccc(Cl)c2)cs1	ZINC000819386430	EI	On-Demand	Anodyne	ROCK1	18	41
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2cccc(Cl)c2)cs1	ZINC000819386430	EI	On-Demand	Anodyne	SPHK2	37	40
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2cccc(Cl)c2)cs1	ZINC000819386430	EI	On-Demand	Anodyne	SPHK1	33	42
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2cccc(Cl)c2)cs1	ZINC000819386431	EI	On-Demand	Anodyne	MPL	42	36
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2cccc(Cl)c2)cs1	ZINC000819386431	EI	On-Demand	Anodyne	ROCK1	18	41
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2cccc(Cl)c2)cs1	ZINC000819386431	EI	On-Demand	Anodyne	SPHK2	37	40
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2cccc(Cl)c2)cs1	ZINC000819386431	EI	On-Demand	Anodyne	SPHK1	33	42
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2cccc(Cl)c2)cs1	ZINC000819386432	EI	On-Demand	Anodyne	MPL	42	36
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2cccc(Cl)c2)cs1	ZINC000819386432	EI	On-Demand	Anodyne	ROCK1	18	41
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2cccc(Cl)c2)cs1	ZINC000819386432	EI	On-Demand	Anodyne	SPHK2	37	40
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2cccc(Cl)c2)cs1	ZINC000819386432	EI	On-Demand	Anodyne	SPHK1	33	42
CC(C)(C)OC(=O)N(CCCNC[C@H](O)c1cccc(F)c1)C1CC1	ZINC000819386510	FG	On-Demand	Anodyne	ADRB1	36	41
CC(C)(C)OC(=O)N(CCCNC[C@H](O)c1cccc(F)c1)C1CC1	ZINC000819386510	FG	On-Demand	Anodyne	ADRB3	43	41
CC(C)(C)OC(=O)N(CCCNC[C@@H](O)c1cccc(F)c1)C1CC1	ZINC000819386511	FG	On-Demand	Anodyne	ADRB1	36	41
CC(C)(C)OC(=O)N(CCCNC[C@@H](O)c1cccc(F)c1)C1CC1	ZINC000819386511	FG	On-Demand	Anodyne	ADRB3	43	41
O[C@H](CNCCc1cn[nH]c1)c1cc2ccccc2o1	ZINC000819386600	CE	On-Demand	Anodyne	ADRB3	42	38
O[C@H](CNCCc1cn[nH]c1)c1ccccc1Br	ZINC000819386601	DE	On-Demand	Anodyne	ADRB2	49	38
O[C@H](CNCCc1cn[nH]c1)c1ccccc1Br	ZINC000819386601	DE	On-Demand	Anodyne	ADRB1	56	38
O[C@H](CNCCc1cn[nH]c1)c1ccccc1Br	ZINC000819386601	DE	On-Demand	Anodyne	ADRB3	65	36
O[C@@H](CNCCc1cn[nH]c1)c1ccccc1Br	ZINC000819386602	DE	On-Demand	Anodyne	ADRB2	49	38
O[C@@H](CNCCc1cn[nH]c1)c1ccccc1Br	ZINC000819386602	DE	On-Demand	Anodyne	ADRB1	56	38
O[C@@H](CNCCc1cn[nH]c1)c1ccccc1Br	ZINC000819386602	DE	On-Demand	Anodyne	ADRB3	65	36
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2ccccc2C(F)(F)F)CC1	ZINC000819386638	FI	On-Demand	Anodyne	ITGAL	52	34
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2ccccc2C(F)(F)F)CC1	ZINC000819386638	FI	On-Demand	Anodyne	SLC9A1	41	42
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2ccccc2C(F)(F)F)CC1	ZINC000819386638	FI	On-Demand	Anodyne	RBP4	114	59
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2ccccc2C(F)(F)F)CC1	ZINC000819386639	FI	On-Demand	Anodyne	ITGAL	52	34
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2ccccc2C(F)(F)F)CC1	ZINC000819386639	FI	On-Demand	Anodyne	SLC9A1	41	42
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2ccccc2C(F)(F)F)CC1	ZINC000819386639	FI	On-Demand	Anodyne	RBP4	114	59
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2ccccc2C(F)(F)F)CC1	ZINC000819386640	FI	On-Demand	Anodyne	ITGAL	52	34
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2ccccc2C(F)(F)F)CC1	ZINC000819386640	FI	On-Demand	Anodyne	SLC9A1	41	42
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2ccccc2C(F)(F)F)CC1	ZINC000819386640	FI	On-Demand	Anodyne	RBP4	114	59
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2ccccc2C(F)(F)F)CC1	ZINC000819386641	FI	On-Demand	Anodyne	ITGAL	52	34
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2ccccc2C(F)(F)F)CC1	ZINC000819386641	FI	On-Demand	Anodyne	SLC9A1	41	42
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2ccccc2C(F)(F)F)CC1	ZINC000819386641	FI	On-Demand	Anodyne	RBP4	114	59
COc1ccc(-n2cnnc2SCC(=O)Nc2ncc(Cc3cccc(OC)c3)s2)cc1	ZINC000819386728	JI	On-Demand	Anodyne	SCD1	39	43
COc1ccc(-n2cnnc2SCC(=O)Nc2ncc(Cc3cccc(OC)c3)s2)cc1	ZINC000819386728	JI	On-Demand	Anodyne	SCD	39	50
COc1ccc(-n2cnnc2SCC(=O)Nc2ncc(Cc3cccc(OC)c3)s2)cc1	ZINC000819386728	JI	On-Demand	Anodyne	ENPP1	67	32
O=C(N[C@@H](CCO)C1CC1)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819386731	GG	On-Demand	Anodyne	CNR1	51	31
O=C(N[C@H](CCO)C1CC1)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819386732	GG	On-Demand	Anodyne	CNR1	51	31
O[C@H](CNCCc1cn[nH]c1)c1cccc(F)c1	ZINC000819386733	BD	On-Demand	Anodyne	ADRB2	55	44
O[C@H](CNCCc1cn[nH]c1)c1cccc(F)c1	ZINC000819386733	BD	On-Demand	Anodyne	ADRB1	63	49
O[C@H](CNCCc1cn[nH]c1)c1cccc(F)c1	ZINC000819386733	BD	On-Demand	Anodyne	ADRB3	117	49
O[C@@H](CNCCc1cn[nH]c1)c1cccc(F)c1	ZINC000819386734	BD	On-Demand	Anodyne	ADRB2	55	44
O[C@@H](CNCCc1cn[nH]c1)c1cccc(F)c1	ZINC000819386734	BD	On-Demand	Anodyne	ADRB1	63	49
O[C@@H](CNCCc1cn[nH]c1)c1cccc(F)c1	ZINC000819386734	BD	On-Demand	Anodyne	ADRB3	117	49
O=C(Cc1ccc(-n2cnnc2)cc1)N(C[C@H](O)c1ccc(F)cc1)C1CC1	ZINC000819386753	GF	On-Demand	Anodyne	CCR5	23	43
O=C(Cc1ccc(-n2cnnc2)cc1)N(C[C@@H](O)c1ccc(F)cc1)C1CC1	ZINC000819386756	GF	On-Demand	Anodyne	CCR5	23	43
O[C@H](CNCCc1cn[nH]c1)c1cccnc1	ZINC000819386808	BC	On-Demand	Anodyne	ADRB2	55	53
O[C@H](CNCCc1cn[nH]c1)c1cccnc1	ZINC000819386808	BC	On-Demand	Anodyne	ADRB1	66	52
O[C@H](CNCCc1cn[nH]c1)c1cccnc1	ZINC000819386808	BC	On-Demand	Anodyne	ADRB3	161	55
O[C@@H](CNCCc1cn[nH]c1)c1cccnc1	ZINC000819386810	BC	On-Demand	Anodyne	ADRB2	55	53
O[C@@H](CNCCc1cn[nH]c1)c1cccnc1	ZINC000819386810	BC	On-Demand	Anodyne	ADRB1	66	52
O[C@@H](CNCCc1cn[nH]c1)c1cccnc1	ZINC000819386810	BC	On-Demand	Anodyne	ADRB3	161	55
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cn[nH]c2)c1	ZINC000819386842	CD	On-Demand	Bother	ADRB2	52	41
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cn[nH]c2)c1	ZINC000819386842	CD	On-Demand	Bother	ADRB1	61	41
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cn[nH]c2)c1	ZINC000819386842	CD	On-Demand	Bother	CACNA1C	43	34
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cn[nH]c2)c1	ZINC000819386842	CD	On-Demand	Bother	ADRB3	129	41
O=[N+]([O-])c1cccc([C@H](O)CNCCc2cn[nH]c2)c1	ZINC000819386842	CD	On-Demand	Bother	CACNA1D	69	33
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cn[nH]c2)c1	ZINC000819386843	CD	On-Demand	Bother	ADRB2	52	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cn[nH]c2)c1	ZINC000819386843	CD	On-Demand	Bother	ADRB1	61	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cn[nH]c2)c1	ZINC000819386843	CD	On-Demand	Bother	CACNA1C	43	34
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cn[nH]c2)c1	ZINC000819386843	CD	On-Demand	Bother	ADRB3	129	41
O=[N+]([O-])c1cccc([C@@H](O)CNCCc2cn[nH]c2)c1	ZINC000819386843	CD	On-Demand	Bother	CACNA1D	69	33
O[C@H](CNCCc1cn[nH]c1)c1ccccc1	ZINC000819386862	BD	On-Demand	Anodyne	ADRB2	77	57
O[C@H](CNCCc1cn[nH]c1)c1ccccc1	ZINC000819386862	BD	On-Demand	Anodyne	ADRB1	92	45
O[C@H](CNCCc1cn[nH]c1)c1ccccc1	ZINC000819386862	BD	On-Demand	Anodyne	ADRB3	154	51
O[C@@H](CNCCc1cn[nH]c1)c1ccccc1	ZINC000819386863	BD	On-Demand	Anodyne	ADRB2	77	57
O[C@@H](CNCCc1cn[nH]c1)c1ccccc1	ZINC000819386863	BD	On-Demand	Anodyne	ADRB1	92	45
O[C@@H](CNCCc1cn[nH]c1)c1ccccc1	ZINC000819386863	BD	On-Demand	Anodyne	ADRB3	154	51
O[C@@H](CNCCc1cn[nH]c1)c1ccccc1Cl	ZINC000819386864	CD	On-Demand	Anodyne	ADRB2	54	38
O[C@@H](CNCCc1cn[nH]c1)c1ccccc1Cl	ZINC000819386864	CD	On-Demand	Anodyne	ADRB1	65	38
O[C@@H](CNCCc1cn[nH]c1)c1ccccc1Cl	ZINC000819386864	CD	On-Demand	Anodyne	ADRB3	64	38
C=CCC1(C(=O)NC[C@@H](O)c2cccc(OCc3ccccc3)c2)CCOCC1	ZINC000819386914	GH	On-Demand	Mild	ALOX5	19	43
C=CCC1(C(=O)NC[C@H](O)c2cccc(OCc3ccccc3)c2)CCOCC1	ZINC000819386915	GH	On-Demand	Mild	ALOX5	19	43
O=C(NC1CCN(Cc2ccc(Br)cc2)CC1)C(F)=C1CCC1	ZINC000819387020	GH	On-Demand	Anodyne	DRD4	24	53
O=C(NC1CCN(Cc2ccc(Br)cc2)CC1)C(F)=C1CCC1	ZINC000819387020	GH	On-Demand	Anodyne	SIGMAR1	31	59
O=C(NC1CCN(Cc2ccc(Br)cc2)CC1)C(F)=C1CCC1	ZINC000819387020	GH	On-Demand	Anodyne	SSTR5	40	35
O=C(NC1CCN(Cc2ccc(Br)cc2)CC1)C(F)=C1CCC1	ZINC000819387020	GH	On-Demand	Anodyne	CCR3	26	42
O=C(NC1CCN(Cc2ccc(Br)cc2)CC1)C(F)=C1CCC1	ZINC000819387020	GH	On-Demand	Anodyne	CXCR3	20	41
O=C(NC1CCN(Cc2ccc(Br)cc2)CC1)C(F)=C1CCC1	ZINC000819387020	GH	On-Demand	Anodyne	MCHR1	40	42
O=C(NC1CCN(Cc2ccc(Br)cc2)CC1)C(F)=C1CCC1	ZINC000819387020	GH	On-Demand	Anodyne	CACNA1G	23	40
Cc1ccccc1[C@@H](O)CNCCc1cn[nH]c1	ZINC000819387024	BD	On-Demand	Anodyne	ADRB2	62	38
Cc1ccccc1[C@@H](O)CNCCc1cn[nH]c1	ZINC000819387024	BD	On-Demand	Anodyne	ADRB1	68	38
Cc1ccccc1[C@@H](O)CNCCc1cn[nH]c1	ZINC000819387024	BD	On-Demand	Anodyne	ADRB3	70	41
O[C@H](CNCCc1cn[nH]c1)c1cccc(Cl)c1	ZINC000819387056	CD	On-Demand	Anodyne	ADRB2	79	41
O[C@H](CNCCc1cn[nH]c1)c1cccc(Cl)c1	ZINC000819387056	CD	On-Demand	Anodyne	ADRB1	98	56
O[C@H](CNCCc1cn[nH]c1)c1cccc(Cl)c1	ZINC000819387056	CD	On-Demand	Anodyne	ADRB3	146	56
O[C@@H](CNCCc1cn[nH]c1)c1cccc(Cl)c1	ZINC000819387058	CD	On-Demand	Anodyne	ADRB2	79	41
O[C@@H](CNCCc1cn[nH]c1)c1cccc(Cl)c1	ZINC000819387058	CD	On-Demand	Anodyne	ADRB1	98	56
O[C@@H](CNCCc1cn[nH]c1)c1cccc(Cl)c1	ZINC000819387058	CD	On-Demand	Anodyne	ADRB3	146	56
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2ccsc2)c1	ZINC000819387064	DE	On-Demand	Anodyne	ADRB2	45	37
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2ccsc2)c1	ZINC000819387066	DE	On-Demand	Anodyne	ADRB2	45	37
C[C@H](CC(=O)NC[C@@H](O)c1cccc(OCc2ccccc2)c1)n1cccn1	ZINC000819387086	GG	On-Demand	Anodyne	ADRB3	32	42
C[C@H](CC(=O)NC[C@@H](O)c1cccc(OCc2ccccc2)c1)n1cccn1	ZINC000819387086	GG	On-Demand	Anodyne	CAPN2	28	40
C[C@H](CC(=O)NC[C@@H](O)c1cccc(OCc2ccccc2)c1)n1cccn1	ZINC000819387086	GG	On-Demand	Anodyne	PDS	48	38
C[C@@H](CC(=O)NC[C@@H](O)c1cccc(OCc2ccccc2)c1)n1cccn1	ZINC000819387087	GG	On-Demand	Anodyne	ADRB3	32	42
C[C@@H](CC(=O)NC[C@@H](O)c1cccc(OCc2ccccc2)c1)n1cccn1	ZINC000819387087	GG	On-Demand	Anodyne	CAPN2	28	40
C[C@@H](CC(=O)NC[C@@H](O)c1cccc(OCc2ccccc2)c1)n1cccn1	ZINC000819387087	GG	On-Demand	Anodyne	PDS	48	38
C[C@H](CC(=O)NC[C@H](O)c1cccc(OCc2ccccc2)c1)n1cccn1	ZINC000819387088	GG	On-Demand	Anodyne	ADRB3	32	42
C[C@H](CC(=O)NC[C@H](O)c1cccc(OCc2ccccc2)c1)n1cccn1	ZINC000819387088	GG	On-Demand	Anodyne	CAPN2	28	40
C[C@H](CC(=O)NC[C@H](O)c1cccc(OCc2ccccc2)c1)n1cccn1	ZINC000819387088	GG	On-Demand	Anodyne	PDS	48	38
C[C@@H](CC(=O)NC[C@H](O)c1cccc(OCc2ccccc2)c1)n1cccn1	ZINC000819387089	GG	On-Demand	Anodyne	ADRB3	32	42
C[C@@H](CC(=O)NC[C@H](O)c1cccc(OCc2ccccc2)c1)n1cccn1	ZINC000819387089	GG	On-Demand	Anodyne	CAPN2	28	40
C[C@@H](CC(=O)NC[C@H](O)c1cccc(OCc2ccccc2)c1)n1cccn1	ZINC000819387089	GG	On-Demand	Anodyne	PDS	48	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC[C@@H]1c1nc3ccccc3o1)C2	ZINC000819387094	GH	On-Demand	Anodyne	CPT1A	55	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCC[C@H]1c1nc3ccccc3o1)C2	ZINC000819387095	GH	On-Demand	Anodyne	CPT1A	55	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC[C@H]1c1nc3ccccc3o1)C2	ZINC000819387096	GH	On-Demand	Anodyne	CPT1A	55	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCC[C@@H]1c1nc3ccccc3o1)C2	ZINC000819387097	GH	On-Demand	Anodyne	CPT1A	55	35
CCC(=O)N1CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819387114	FD	On-Demand	Mild	PAPA1_CARPA	36	47
CCC(=O)N1CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819387115	FD	On-Demand	Mild	PAPA1_CARPA	36	47
CCC(=O)N1CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819387116	FD	On-Demand	Mild	PAPA1_CARPA	36	47
CCC(=O)N1CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819387117	FD	On-Demand	Mild	PAPA1_CARPA	36	47
O[C@H](CNCCc1cn[nH]c1)c1c(F)cccc1F	ZINC000819387162	CD	On-Demand	Anodyne	ADRB3	45	39
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2ccc(Cl)cc2)cs1	ZINC000819387168	EI	On-Demand	Anodyne	MPL	19	43
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2ccc(Cl)cc2)cs1	ZINC000819387168	EI	On-Demand	Anodyne	SPHK1	24	43
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2ccc(Cl)cc2)cs1	ZINC000819387169	EI	On-Demand	Anodyne	MPL	19	43
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2ccc(Cl)cc2)cs1	ZINC000819387169	EI	On-Demand	Anodyne	SPHK1	24	43
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2ccc(Cl)cc2)cs1	ZINC000819387170	EI	On-Demand	Anodyne	MPL	19	43
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2ccc(Cl)cc2)cs1	ZINC000819387170	EI	On-Demand	Anodyne	SPHK1	24	43
O[C@@H](CNCCc1cn[nH]c1)c1c(F)cccc1F	ZINC000819387171	CD	On-Demand	Anodyne	ADRB3	45	39
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2ccc(Cl)cc2)cs1	ZINC000819387172	EI	On-Demand	Anodyne	MPL	19	43
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2ccc(Cl)cc2)cs1	ZINC000819387172	EI	On-Demand	Anodyne	SPHK1	24	43
Cn1cc([C@@H](O)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cn1	ZINC000819387179	FD	On-Demand	Mild	PAPA1_CARPA	42	46
Cn1cc([C@@H](O)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cn1	ZINC000819387184	FD	On-Demand	Mild	PAPA1_CARPA	42	46
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@H](O)c1ccsc1	ZINC000819387190	FH	On-Demand	Anodyne	SCD	16	42
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@@H](O)c1ccsc1	ZINC000819387191	FH	On-Demand	Anodyne	SCD	16	42
O=C(C(F)=C1CCC1)N1CCCC[C@H]1c1nc2ccccc2o1	ZINC000819387268	DI	On-Demand	Anodyne	CPT1A	68	37
O=C(C(F)=C1CCC1)N1CCCC[C@@H]1c1nc2ccccc2o1	ZINC000819387270	DI	On-Demand	Anodyne	CPT1A	68	37
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2ccc(C)o2)c1	ZINC000819387273	ED	On-Demand	Anodyne	MTNR1A	44	42
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2ccc(C)o2)c1	ZINC000819387273	ED	On-Demand	Anodyne	MTNR1B	42	42
COc1ccc(OC)c([C@H](O)CNCCc2cn[nH]c2)c1	ZINC000819387276	CD	On-Demand	Anodyne	ADRB2	48	53
COc1ccc(OC)c([C@H](O)CNCCc2cn[nH]c2)c1	ZINC000819387276	CD	On-Demand	Anodyne	ADRB1	50	42
COc1ccc(OC)c([C@H](O)CNCCc2cn[nH]c2)c1	ZINC000819387276	CD	On-Demand	Anodyne	ADRB3	39	42
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2ccc(C)o2)c1	ZINC000819387277	ED	On-Demand	Anodyne	MTNR1A	44	42
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2ccc(C)o2)c1	ZINC000819387277	ED	On-Demand	Anodyne	MTNR1B	42	42
O[C@@H](CNCCc1cn[nH]c1)c1ccc(Cl)cc1	ZINC000819387282	CD	On-Demand	Anodyne	ADRB2	40	47
O[C@@H](CNCCc1cn[nH]c1)c1ccc(Cl)cc1	ZINC000819387282	CD	On-Demand	Anodyne	ADRB1	47	45
O[C@@H](CNCCc1cn[nH]c1)c1ccc(Cl)cc1	ZINC000819387282	CD	On-Demand	Anodyne	ADRB3	78	45
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2ccc(OC(C)C)cc2)c1	ZINC000819387348	GE	On-Demand	Anodyne	MTNR1A	31	46
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2ccc(OC(C)C)cc2)c1	ZINC000819387348	GE	On-Demand	Anodyne	MTNR1B	30	46
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2ccc(OC(C)C)cc2)c1	ZINC000819387352	GE	On-Demand	Anodyne	MTNR1A	31	46
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2ccc(OC(C)C)cc2)c1	ZINC000819387352	GE	On-Demand	Anodyne	MTNR1B	30	46
O[C@H](CNCCc1cn[nH]c1)c1ccc(F)cc1Cl	ZINC000819387356	CE	On-Demand	Anodyne	ADRB1	40	35
Cn1ccnc1N1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819387357	GD	On-Demand	Mild	TGM2	16	44
O[C@@H](CNCCc1cn[nH]c1)c1ccc(F)cc1Cl	ZINC000819387358	CE	On-Demand	Anodyne	ADRB1	40	35
Cn1ccnc1N1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819387359	GD	On-Demand	Mild	TGM2	16	44
O[C@H](CNCCc1cn[nH]c1)c1ccc(F)cc1	ZINC000819387360	BD	On-Demand	Anodyne	ADRB2	43	47
O[C@H](CNCCc1cn[nH]c1)c1ccc(F)cc1	ZINC000819387360	BD	On-Demand	Anodyne	ADRB1	44	38
O[C@H](CNCCc1cn[nH]c1)c1ccc(F)cc1	ZINC000819387360	BD	On-Demand	Anodyne	ADRB3	83	39
O[C@@H](CNCCc1cn[nH]c1)c1ccc(F)cc1	ZINC000819387362	BD	On-Demand	Anodyne	ADRB2	43	47
O[C@@H](CNCCc1cn[nH]c1)c1ccc(F)cc1	ZINC000819387362	BD	On-Demand	Anodyne	ADRB1	44	38
O[C@@H](CNCCc1cn[nH]c1)c1ccc(F)cc1	ZINC000819387362	BD	On-Demand	Anodyne	ADRB3	83	39
CN(Cc1ncc(-c2ccccc2)[nH]1)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819387377	FF	On-Demand	Anodyne	REN	41	34
O[C@H](CNCCc1cn[nH]c1)c1cccc(Br)c1	ZINC000819387385	DE	On-Demand	Anodyne	ADRB2	53	44
O[C@H](CNCCc1cn[nH]c1)c1cccc(Br)c1	ZINC000819387385	DE	On-Demand	Anodyne	ADRB1	60	41
O[C@H](CNCCc1cn[nH]c1)c1cccc(Br)c1	ZINC000819387385	DE	On-Demand	Anodyne	ADRB3	111	41
O[C@@H](CNCCc1cn[nH]c1)c1cccc(Br)c1	ZINC000819387386	DE	On-Demand	Anodyne	ADRB2	53	44
O[C@@H](CNCCc1cn[nH]c1)c1cccc(Br)c1	ZINC000819387386	DE	On-Demand	Anodyne	ADRB1	60	41
O[C@@H](CNCCc1cn[nH]c1)c1cccc(Br)c1	ZINC000819387386	DE	On-Demand	Anodyne	ADRB3	111	41
O[C@H](CNCCc1cn[nH]c1)c1ccc(OC(F)(F)F)cc1	ZINC000819387393	DE	On-Demand	Anodyne	ADRB2	38	41
O[C@H](CNCCc1cn[nH]c1)c1ccc(OC(F)(F)F)cc1	ZINC000819387393	DE	On-Demand	Anodyne	ADRB1	43	38
O[C@H](CNCCc1cn[nH]c1)c1ccc(OC(F)(F)F)cc1	ZINC000819387393	DE	On-Demand	Anodyne	ADRB3	71	47
O[C@@H](CNCCc1cn[nH]c1)c1ccc(OC(F)(F)F)cc1	ZINC000819387394	DE	On-Demand	Anodyne	ADRB2	38	41
O[C@@H](CNCCc1cn[nH]c1)c1ccc(OC(F)(F)F)cc1	ZINC000819387394	DE	On-Demand	Anodyne	ADRB1	43	38
O[C@@H](CNCCc1cn[nH]c1)c1ccc(OC(F)(F)F)cc1	ZINC000819387394	DE	On-Demand	Anodyne	ADRB3	71	47
O[C@H](CNCCc1cn[nH]c1)c1ccc(Br)cc1	ZINC000819387407	DE	On-Demand	Anodyne	ADRB2	35	50
O[C@H](CNCCc1cn[nH]c1)c1ccc(Br)cc1	ZINC000819387407	DE	On-Demand	Anodyne	ADRB3	67	44
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819387408	DH	On-Demand	Anodyne	MAOB	20	44
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819387408	DH	On-Demand	Anodyne	ROCK1	17	42
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819387409	DH	On-Demand	Anodyne	MAOB	20	44
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819387409	DH	On-Demand	Anodyne	ROCK1	17	42
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819387410	DH	On-Demand	Anodyne	MAOB	20	44
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819387410	DH	On-Demand	Anodyne	ROCK1	17	42
O[C@@H](CNCCc1cn[nH]c1)c1ccc(Br)cc1	ZINC000819387411	DE	On-Demand	Anodyne	ADRB2	35	50
O[C@@H](CNCCc1cn[nH]c1)c1ccc(Br)cc1	ZINC000819387411	DE	On-Demand	Anodyne	ADRB3	67	44
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819387412	DH	On-Demand	Anodyne	MAOB	20	44
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2ccc(F)cc2)cs1	ZINC000819387412	DH	On-Demand	Anodyne	ROCK1	17	42
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@H]1c1nc2ccccc2o1	ZINC000819387422	EH	On-Demand	Anodyne	CPT1A	59	36
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@H]1c1nc2ccccc2o1	ZINC000819387424	EH	On-Demand	Anodyne	CPT1A	59	36
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@@H]1c1nc2ccccc2o1	ZINC000819387426	EH	On-Demand	Anodyne	CPT1A	59	36
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@@H]1c1nc2ccccc2o1	ZINC000819387428	EH	On-Demand	Anodyne	CPT1A	59	36
O[C@H](CNCCc1cn[nH]c1)c1cc(F)ccc1F	ZINC000819387443	CD	On-Demand	Anodyne	ADRB3	41	37
O[C@@H](CNCCc1cn[nH]c1)c1cc(F)ccc1F	ZINC000819387444	CD	On-Demand	Anodyne	ADRB3	41	37
N#Cc1ccc([C@@H](O)CNCCc2cn[nH]c2)cc1	ZINC000819387476	CD	On-Demand	Mild	ADRB2	27	40
N#Cc1ccc([C@@H](O)CNCCc2cn[nH]c2)cc1	ZINC000819387476	CD	On-Demand	Mild	ADRB3	51	37
N#Cc1ccc([C@H](O)CNCCc2cn[nH]c2)cc1	ZINC000819387479	CD	On-Demand	Mild	ADRB2	27	40
N#Cc1ccc([C@H](O)CNCCc2cn[nH]c2)cc1	ZINC000819387479	CD	On-Demand	Mild	ADRB3	51	37
Cc1ccccc1CC(=O)NNC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819387560	FG	On-Demand	Reactive	P2RX7	20	40
O[C@@H](CNCC[C@@H]1CCc2ccccc2N1)c1cccc(Cl)c1	ZINC000819387565	EH	On-Demand	Anodyne	ADRB1	43	44
O[C@@H](CNCC[C@@H]1CCc2ccccc2N1)c1cccc(Cl)c1	ZINC000819387565	EH	On-Demand	Anodyne	ADRB3	56	44
O[C@H](CNCC[C@H]1CCc2ccccc2N1)c1cccc(Cl)c1	ZINC000819387566	EH	On-Demand	Anodyne	ADRB1	43	44
O[C@H](CNCC[C@H]1CCc2ccccc2N1)c1cccc(Cl)c1	ZINC000819387566	EH	On-Demand	Anodyne	ADRB3	56	44
O[C@@H](CNCC[C@H]1CCc2ccccc2N1)c1cccc(Cl)c1	ZINC000819387567	EH	On-Demand	Anodyne	ADRB1	43	44
O[C@@H](CNCC[C@H]1CCc2ccccc2N1)c1cccc(Cl)c1	ZINC000819387567	EH	On-Demand	Anodyne	ADRB3	56	44
O[C@H](CNCC[C@@H]1CCc2ccccc2N1)c1cccc(Cl)c1	ZINC000819387568	EH	On-Demand	Anodyne	ADRB1	43	44
O[C@H](CNCC[C@@H]1CCc2ccccc2N1)c1cccc(Cl)c1	ZINC000819387568	EH	On-Demand	Anodyne	ADRB3	56	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCCC[C@H]1c1nc2ccccc2o1	ZINC000819387619	GH	On-Demand	Anodyne	CPT1A	62	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCCC[C@@H]1c1nc2ccccc2o1	ZINC000819387621	GH	On-Demand	Anodyne	CPT1A	62	35
Cc1nc(CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)sc1C	ZINC000819387632	GG	On-Demand	Mild	PAPA1_CARPA	44	49
Cc1nc(CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)sc1C	ZINC000819387634	GG	On-Demand	Mild	PAPA1_CARPA	44	49
O[C@H](CNCCc1cn[nH]c1)c1ccc(Cl)c(F)c1	ZINC000819387666	CE	On-Demand	Anodyne	ADRB2	37	41
O[C@H](CNCCc1cn[nH]c1)c1ccc(Cl)c(F)c1	ZINC000819387666	CE	On-Demand	Anodyne	ADRB1	37	41
O[C@H](CNCCc1cn[nH]c1)c1ccc(Cl)c(F)c1	ZINC000819387666	CE	On-Demand	Anodyne	ADRB3	66	41
O[C@@H](CNCCc1cn[nH]c1)c1ccc(Cl)c(F)c1	ZINC000819387668	CE	On-Demand	Anodyne	ADRB2	37	41
O[C@@H](CNCCc1cn[nH]c1)c1ccc(Cl)c(F)c1	ZINC000819387668	CE	On-Demand	Anodyne	ADRB1	37	41
O[C@@H](CNCCc1cn[nH]c1)c1ccc(Cl)c(F)c1	ZINC000819387668	CE	On-Demand	Anodyne	ADRB3	66	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(NC(N)=O)c(OC)c1)C2	ZINC000819387683	GD	On-Demand	Anodyne	ENPP1	59	30
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(NC(N)=O)c(OC)c1)C2	ZINC000819387686	GD	On-Demand	Anodyne	ENPP1	59	30
Cc1cc(F)ccc1[C@@H](O)CNCCc1cn[nH]c1	ZINC000819387708	CD	On-Demand	Anodyne	ADRB2	43	38
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)CC(C)C)c1	ZINC000819387745	CD	On-Demand	Anodyne	ANPEP	37	41
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)CC(C)C)c1	ZINC000819387745	CD	On-Demand	Anodyne	KCNK3	50	32
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)CC(C)C)c1	ZINC000819387745	CD	On-Demand	Anodyne	KCNK9	43	32
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)CC(C)C)c1	ZINC000819387747	CD	On-Demand	Anodyne	ANPEP	37	41
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)CC(C)C)c1	ZINC000819387747	CD	On-Demand	Anodyne	KCNK3	50	32
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)CC(C)C)c1	ZINC000819387747	CD	On-Demand	Anodyne	KCNK9	43	32
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2cccc(F)c2)cs1	ZINC000819387749	DH	On-Demand	Anodyne	MPL	53	36
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2cccc(F)c2)cs1	ZINC000819387749	DH	On-Demand	Anodyne	ROCK1	18	41
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2cccc(F)c2)cs1	ZINC000819387749	DH	On-Demand	Anodyne	HDAC9	15	50
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2cccc(F)c2)cs1	ZINC000819387749	DH	On-Demand	Anodyne	SPHK1	24	40
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2cccc(F)c2)cs1	ZINC000819387750	DH	On-Demand	Anodyne	MPL	53	36
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2cccc(F)c2)cs1	ZINC000819387750	DH	On-Demand	Anodyne	ROCK1	18	41
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2cccc(F)c2)cs1	ZINC000819387750	DH	On-Demand	Anodyne	HDAC9	15	50
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2cccc(F)c2)cs1	ZINC000819387750	DH	On-Demand	Anodyne	SPHK1	24	40
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2cccc(F)c2)cs1	ZINC000819387752	DH	On-Demand	Anodyne	MPL	53	36
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2cccc(F)c2)cs1	ZINC000819387752	DH	On-Demand	Anodyne	ROCK1	18	41
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2cccc(F)c2)cs1	ZINC000819387752	DH	On-Demand	Anodyne	HDAC9	15	50
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2cccc(F)c2)cs1	ZINC000819387752	DH	On-Demand	Anodyne	SPHK1	24	40
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2cccc(F)c2)cs1	ZINC000819387754	DH	On-Demand	Anodyne	MPL	53	36
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2cccc(F)c2)cs1	ZINC000819387754	DH	On-Demand	Anodyne	ROCK1	18	41
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2cccc(F)c2)cs1	ZINC000819387754	DH	On-Demand	Anodyne	HDAC9	15	50
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2cccc(F)c2)cs1	ZINC000819387754	DH	On-Demand	Anodyne	SPHK1	24	40
O[C@H](CNCCc1cn[nH]c1)c1ccccc1C(F)(F)F	ZINC000819387797	CE	On-Demand	Anodyne	ADRB2	43	37
O[C@H](CNCCc1cn[nH]c1)c1ccccc1C(F)(F)F	ZINC000819387797	CE	On-Demand	Anodyne	ADRB1	50	37
O[C@H](CNCCc1cn[nH]c1)c1ccccc1C(F)(F)F	ZINC000819387797	CE	On-Demand	Anodyne	ADRB3	69	38
O[C@@H](CNCCc1cn[nH]c1)c1ccccc1C(F)(F)F	ZINC000819387798	CE	On-Demand	Anodyne	ADRB2	43	37
O[C@@H](CNCCc1cn[nH]c1)c1ccccc1C(F)(F)F	ZINC000819387798	CE	On-Demand	Anodyne	ADRB1	50	37
O[C@@H](CNCCc1cn[nH]c1)c1ccccc1C(F)(F)F	ZINC000819387798	CE	On-Demand	Anodyne	ADRB3	69	38
O[C@H](CNCCc1cn[nH]c1)c1ccc(Cl)cc1Cl	ZINC000819387799	DF	On-Demand	Anodyne	ADRB2	44	38
O[C@H](CNCCc1cn[nH]c1)c1ccc(Cl)cc1Cl	ZINC000819387799	DF	On-Demand	Anodyne	ADRB1	46	39
O[C@@H](CNCCc1cn[nH]c1)c1ccc(Cl)cc1Cl	ZINC000819387800	DF	On-Demand	Anodyne	ADRB2	44	38
O[C@@H](CNCCc1cn[nH]c1)c1ccc(Cl)cc1Cl	ZINC000819387800	DF	On-Demand	Anodyne	ADRB1	46	39
CCC(=O)N1CC[C@H](NC(=O)C(F)=C2CCC2)C1	ZINC000819387824	CD	On-Demand	Anodyne	EPHX2	20	47
CCC(=O)N1CC[C@@H](NC(=O)C(F)=C2CCC2)C1	ZINC000819387825	CD	On-Demand	Anodyne	EPHX2	20	47
O=C(/C=C/[C@H]1CCCO1)Nc1ccccc1N1CCC(CO)CC1	ZINC000819387862	EF	On-Demand	Anodyne	KCNQ2	72	39
O=C(/C=C\[C@@H]1CCCO1)Nc1ccccc1N1CCC(CO)CC1	ZINC000819387863	EF	On-Demand	Anodyne	KCNQ2	72	39
O=C(/C=C/[C@@H]1CCCO1)Nc1ccccc1N1CCC(CO)CC1	ZINC000819387864	EF	On-Demand	Anodyne	KCNQ2	72	39
O=C(/C=C\[C@H]1CCCO1)Nc1ccccc1N1CCC(CO)CC1	ZINC000819387865	EF	On-Demand	Anodyne	KCNQ2	72	39
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819387900	FJ	On-Demand	Anodyne	MPL	54	49
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819387900	FJ	On-Demand	Anodyne	SPHK2	27	42
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819387900	FJ	On-Demand	Anodyne	SPHK1	29	42
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819387902	FJ	On-Demand	Anodyne	MPL	54	49
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819387902	FJ	On-Demand	Anodyne	SPHK2	27	42
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819387902	FJ	On-Demand	Anodyne	SPHK1	29	42
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819387904	FJ	On-Demand	Anodyne	MPL	54	49
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819387904	FJ	On-Demand	Anodyne	SPHK2	27	42
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819387904	FJ	On-Demand	Anodyne	SPHK1	29	42
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819387906	FJ	On-Demand	Anodyne	MPL	54	49
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819387906	FJ	On-Demand	Anodyne	SPHK2	27	42
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819387906	FJ	On-Demand	Anodyne	SPHK1	29	42
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819387970	GG	On-Demand	Anodyne	DRD4	20	51
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819387970	GG	On-Demand	Anodyne	SIGMAR1	24	54
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819387970	GG	On-Demand	Anodyne	CXCR3	18	40
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819387970	GG	On-Demand	Anodyne	MCHR1	34	40
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819387972	GG	On-Demand	Anodyne	DRD4	20	51
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819387972	GG	On-Demand	Anodyne	SIGMAR1	24	54
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819387972	GG	On-Demand	Anodyne	CXCR3	18	40
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819387972	GG	On-Demand	Anodyne	MCHR1	34	40
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819387974	GG	On-Demand	Anodyne	DRD4	20	51
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819387974	GG	On-Demand	Anodyne	SIGMAR1	24	54
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819387974	GG	On-Demand	Anodyne	CXCR3	18	40
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819387974	GG	On-Demand	Anodyne	MCHR1	34	40
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819387976	GG	On-Demand	Anodyne	DRD4	20	51
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819387976	GG	On-Demand	Anodyne	SIGMAR1	24	54
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819387976	GG	On-Demand	Anodyne	CXCR3	18	40
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819387976	GG	On-Demand	Anodyne	MCHR1	34	40
COc1ccc(OC)c([C@H](O)CNCCCc2c[nH]nc2C)c1	ZINC000819388008	DD	On-Demand	Anodyne	ADRB2	22	46
O=C(/C=C/[C@@H]1CCCO1)N1CC=C(c2ccccc2C(F)(F)F)CC1	ZINC000819388029	FI	On-Demand	Anodyne	RBP4	46	36
O=C(/C=C\[C@@H]1CCCO1)N1CC=C(c2ccccc2C(F)(F)F)CC1	ZINC000819388031	FI	On-Demand	Anodyne	RBP4	46	36
O=C(/C=C/[C@H]1CCCO1)N1CC=C(c2ccccc2C(F)(F)F)CC1	ZINC000819388033	FI	On-Demand	Anodyne	RBP4	46	36
O=C(/C=C\[C@H]1CCCO1)N1CC=C(c2ccccc2C(F)(F)F)CC1	ZINC000819388035	FI	On-Demand	Anodyne	RBP4	46	36
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)CC(C)C)c1	ZINC000819388124	DD	On-Demand	Anodyne	MTNR1A	32	45
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)CC(C)C)c1	ZINC000819388124	DD	On-Demand	Anodyne	MTNR1B	32	45
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)CC(C)C)c1	ZINC000819388126	DD	On-Demand	Anodyne	MTNR1A	32	45
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)CC(C)C)c1	ZINC000819388126	DD	On-Demand	Anodyne	MTNR1B	32	45
O=C(Nc1ccccc1N1CCC(CO)CC1)C(F)=C1CCC1	ZINC000819388134	DG	On-Demand	Anodyne	KCNQ2	80	43
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2cnn(C)c2)c1	ZINC000819388154	EC	On-Demand	Anodyne	DRD4	40	30
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2cnn(C)c2)c1	ZINC000819388156	EC	On-Demand	Anodyne	DRD4	40	30
O[C@H](CNC[C@@H]1CCCO[C@H]1c1cc[nH]n1)c1cccc(Cl)c1	ZINC000819388158	EF	On-Demand	Anodyne	ADRB3	41	39
O[C@H](CNC[C@@H]1CCCO[C@H]1c1cc[nH]n1)c1cccc(Cl)c1	ZINC000819388158	EF	On-Demand	Anodyne	CYP3A4	47	35
O[C@@H](CNC[C@@H]1CCCO[C@H]1c1cc[nH]n1)c1cccc(Cl)c1	ZINC000819388159	EF	On-Demand	Anodyne	ADRB3	41	39
O[C@@H](CNC[C@@H]1CCCO[C@H]1c1cc[nH]n1)c1cccc(Cl)c1	ZINC000819388159	EF	On-Demand	Anodyne	CYP3A4	47	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388168	GF	On-Demand	Anodyne	ACHE	35	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388168	GF	On-Demand	Anodyne	LTA4H	18	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388168	GF	On-Demand	Anodyne	SIGMAR1	40	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388168	GF	On-Demand	Anodyne	SLC18A3	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388168	GF	On-Demand	Anodyne	MBTPS1	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388171	GF	On-Demand	Anodyne	ACHE	35	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388171	GF	On-Demand	Anodyne	LTA4H	18	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388171	GF	On-Demand	Anodyne	SIGMAR1	40	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388171	GF	On-Demand	Anodyne	SLC18A3	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388171	GF	On-Demand	Anodyne	MBTPS1	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388173	GF	On-Demand	Anodyne	ACHE	35	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388173	GF	On-Demand	Anodyne	LTA4H	18	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388173	GF	On-Demand	Anodyne	SIGMAR1	40	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388173	GF	On-Demand	Anodyne	SLC18A3	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388173	GF	On-Demand	Anodyne	MBTPS1	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388175	GF	On-Demand	Anodyne	ACHE	35	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388175	GF	On-Demand	Anodyne	LTA4H	18	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388175	GF	On-Demand	Anodyne	SIGMAR1	40	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388175	GF	On-Demand	Anodyne	SLC18A3	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819388175	GF	On-Demand	Anodyne	MBTPS1	40	31
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@H]2C[C@H](O)c2ccco2)c1	ZINC000819388206	GH	On-Demand	Anodyne	OPRK1	17	42
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@@H]2C[C@H](O)c2ccco2)c1	ZINC000819388209	GH	On-Demand	Anodyne	OPRK1	17	42
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@H]2C[C@@H](O)c2ccco2)c1	ZINC000819388211	GH	On-Demand	Anodyne	OPRK1	17	42
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@@H]2C[C@@H](O)c2ccco2)c1	ZINC000819388213	GH	On-Demand	Anodyne	OPRK1	17	42
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2cnn(C)c2)c1	ZINC000819388234	DC	On-Demand	Anodyne	ADRB2	45	37
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2cnn(C)c2)c1	ZINC000819388236	DC	On-Demand	Anodyne	ADRB2	45	37
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cn[nH]c2)cc1	ZINC000819388255	CD	On-Demand	Bother	ADRB2	31	40
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cn[nH]c2)cc1	ZINC000819388255	CD	On-Demand	Bother	ADRB1	36	40
O=[N+]([O-])c1ccc([C@H](O)CNCCc2cn[nH]c2)cc1	ZINC000819388255	CD	On-Demand	Bother	ADRB3	74	40
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cn[nH]c2)cc1	ZINC000819388258	CD	On-Demand	Bother	ADRB2	31	40
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cn[nH]c2)cc1	ZINC000819388258	CD	On-Demand	Bother	ADRB1	36	40
O=[N+]([O-])c1ccc([C@@H](O)CNCCc2cn[nH]c2)cc1	ZINC000819388258	CD	On-Demand	Bother	ADRB3	74	40
O[C@H](CNCCc1cn[nH]c1)c1ccccc1F	ZINC000819388260	BD	On-Demand	Anodyne	ADRB2	51	40
O[C@H](CNCCc1cn[nH]c1)c1ccccc1F	ZINC000819388260	BD	On-Demand	Anodyne	ADRB1	58	40
O[C@H](CNCCc1cn[nH]c1)c1ccccc1F	ZINC000819388260	BD	On-Demand	Anodyne	ADRB3	67	37
O[C@@H](CNCCc1cn[nH]c1)c1ccccc1F	ZINC000819388262	BD	On-Demand	Anodyne	ADRB2	51	40
O[C@@H](CNCCc1cn[nH]c1)c1ccccc1F	ZINC000819388262	BD	On-Demand	Anodyne	ADRB1	58	40
O[C@@H](CNCCc1cn[nH]c1)c1ccccc1F	ZINC000819388262	BD	On-Demand	Anodyne	ADRB3	67	37
O[C@H](CNCCc1cn[nH]c1)c1ccc(C(F)(F)F)cc1	ZINC000819388289	CE	On-Demand	Anodyne	ADRB2	28	42
O[C@H](CNCCc1cn[nH]c1)c1ccc(C(F)(F)F)cc1	ZINC000819388289	CE	On-Demand	Anodyne	ADRB3	59	42
O[C@@H](CNCCc1cn[nH]c1)c1ccc(C(F)(F)F)cc1	ZINC000819388290	CE	On-Demand	Anodyne	ADRB2	28	42
O[C@@H](CNCCc1cn[nH]c1)c1ccc(C(F)(F)F)cc1	ZINC000819388290	CE	On-Demand	Anodyne	ADRB3	59	42
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1cccc(OCc2ccccc2)c1	ZINC000819388341	FI	On-Demand	Mild	ADRB3	45	43
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1cccc(OCc2ccccc2)c1	ZINC000819388341	FI	On-Demand	Mild	CTSB	16	41
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1cccc(OCc2ccccc2)c1	ZINC000819388341	FI	On-Demand	Mild	CAPN2	33	41
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1cccc(OCc2ccccc2)c1	ZINC000819388341	FI	On-Demand	Mild	ACE2	15	41
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1cccc(OCc2ccccc2)c1	ZINC000819388341	FI	On-Demand	Mild	PDS	74	39
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1cccc(OCc2ccccc2)c1	ZINC000819388343	FI	On-Demand	Mild	ADRB3	45	43
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1cccc(OCc2ccccc2)c1	ZINC000819388343	FI	On-Demand	Mild	CTSB	16	41
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1cccc(OCc2ccccc2)c1	ZINC000819388343	FI	On-Demand	Mild	CAPN2	33	41
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1cccc(OCc2ccccc2)c1	ZINC000819388343	FI	On-Demand	Mild	ACE2	15	41
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1cccc(OCc2ccccc2)c1	ZINC000819388343	FI	On-Demand	Mild	PDS	74	39
Cc1ccccc1CC(=O)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819388400	FF	On-Demand	Reactive	PLA2G4A	27	41
Cc1ccccc1CC(=O)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819388400	FF	On-Demand	Reactive	FFAR1	49	40
Cc1ccccc1CC(=O)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819388400	FF	On-Demand	Reactive	CRTM	44	33
Cc1ccccc1CC(=O)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819388400	FF	On-Demand	Reactive	PDS	41	32
C[C@H](CCO)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819388416	DD	On-Demand	Mild	PAPA1_CARPA	45	54
C[C@H](CCO)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819388416	DD	On-Demand	Mild	CTSK	19	51
C[C@H](CCO)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819388416	DD	On-Demand	Mild	POLG_HCV1	23	40
C[C@H](CCO)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819388416	DD	On-Demand	Mild	FPR1	44	40
C[C@@H](CCO)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819388418	DD	On-Demand	Mild	PAPA1_CARPA	45	54
C[C@@H](CCO)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819388418	DD	On-Demand	Mild	CTSK	19	51
C[C@@H](CCO)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819388418	DD	On-Demand	Mild	POLG_HCV1	23	40
C[C@@H](CCO)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819388418	DD	On-Demand	Mild	FPR1	44	40
C[C@@H](CCO)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819388420	DD	On-Demand	Mild	PAPA1_CARPA	45	54
C[C@@H](CCO)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819388420	DD	On-Demand	Mild	CTSK	19	51
C[C@@H](CCO)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819388420	DD	On-Demand	Mild	POLG_HCV1	23	40
C[C@@H](CCO)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819388420	DD	On-Demand	Mild	FPR1	44	40
C[C@H](CCO)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819388422	DD	On-Demand	Mild	PAPA1_CARPA	45	54
C[C@H](CCO)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819388422	DD	On-Demand	Mild	CTSK	19	51
C[C@H](CCO)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819388422	DD	On-Demand	Mild	POLG_HCV1	23	40
C[C@H](CCO)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819388422	DD	On-Demand	Mild	FPR1	44	40
Cc1ccc(NC[C@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819388443	CH	On-Demand	Anodyne	ADRB2	19	47
Cc1ccc(NC[C@@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819388449	CH	On-Demand	Anodyne	ADRB2	19	47
C#Cc1cccc(NC(=O)[C@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)c1	ZINC000819388452	FI	On-Demand	Mild	ANPEP	22	42
C#Cc1cccc(NC(=O)[C@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)c1	ZINC000819388452	FI	On-Demand	Mild	CTSK	27	49
C#Cc1cccc(NC(=O)[C@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)c1	ZINC000819388452	FI	On-Demand	Mild	CTSL	31	49
C#Cc1cccc(NC(=O)[C@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)c1	ZINC000819388452	FI	On-Demand	Mild	MMP3	25	45
C#Cc1cccc(NC(=O)[C@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)c1	ZINC000819388452	FI	On-Demand	Mild	CTSS	21	49
C#Cc1cccc(NC(=O)[C@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)c1	ZINC000819388452	FI	On-Demand	Mild	CAPN2	18	40
C#Cc1cccc(NC(=O)[C@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)c1	ZINC000819388452	FI	On-Demand	Mild	UTS2	45	35
C#Cc1cccc(NC(=O)[C@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)c1	ZINC000819388452	FI	On-Demand	Mild	KCNK3	50	42
C#Cc1cccc(NC(=O)[C@@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)c1	ZINC000819388455	FI	On-Demand	Mild	ANPEP	22	42
C#Cc1cccc(NC(=O)[C@@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)c1	ZINC000819388455	FI	On-Demand	Mild	CTSK	27	49
C#Cc1cccc(NC(=O)[C@@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)c1	ZINC000819388455	FI	On-Demand	Mild	CTSL	31	49
C#Cc1cccc(NC(=O)[C@@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)c1	ZINC000819388455	FI	On-Demand	Mild	MMP3	25	45
C#Cc1cccc(NC(=O)[C@@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)c1	ZINC000819388455	FI	On-Demand	Mild	CTSS	21	49
C#Cc1cccc(NC(=O)[C@@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)c1	ZINC000819388455	FI	On-Demand	Mild	CAPN2	18	40
C#Cc1cccc(NC(=O)[C@@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)c1	ZINC000819388455	FI	On-Demand	Mild	UTS2	45	35
C#Cc1cccc(NC(=O)[C@@H](CC(C)C)NC(=O)c2ccc(Cl)cc2)c1	ZINC000819388455	FI	On-Demand	Mild	KCNK3	50	42
C[C@@](CO)(NC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2)C1CC1	ZINC000819388494	GG	On-Demand	Anodyne	CNR1	51	31
C#Cc1cccc(NC(=O)[C@H](NC(=O)c2ccc(Cl)cc2)C(C)C)c1	ZINC000819388512	FH	On-Demand	Mild	CCR1	33	40
C#Cc1cccc(NC(=O)[C@H](NC(=O)c2ccc(Cl)cc2)C(C)C)c1	ZINC000819388512	FH	On-Demand	Mild	UTS2	42	32
C#Cc1cccc(NC(=O)[C@H](NC(=O)c2ccc(Cl)cc2)C(C)C)c1	ZINC000819388512	FH	On-Demand	Mild	KCNK3	62	44
C#Cc1cccc(NC(=O)[C@@H](NC(=O)c2ccc(Cl)cc2)C(C)C)c1	ZINC000819388516	FH	On-Demand	Mild	CCR1	33	40
C#Cc1cccc(NC(=O)[C@@H](NC(=O)c2ccc(Cl)cc2)C(C)C)c1	ZINC000819388516	FH	On-Demand	Mild	UTS2	42	32
C#Cc1cccc(NC(=O)[C@@H](NC(=O)c2ccc(Cl)cc2)C(C)C)c1	ZINC000819388516	FH	On-Demand	Mild	KCNK3	62	44
O[C@H](CNCCc1cn[nH]c1)c1ccc(F)cc1F	ZINC000819388567	CD	On-Demand	Anodyne	ADRB2	50	40
O[C@H](CNCCc1cn[nH]c1)c1ccc(F)cc1F	ZINC000819388567	CD	On-Demand	Anodyne	ADRB1	43	37
O[C@H](CNCCc1cn[nH]c1)c1ccc(F)cc1F	ZINC000819388567	CD	On-Demand	Anodyne	ADRB3	41	37
O[C@@H](CNCCc1cn[nH]c1)c1ccc(F)cc1F	ZINC000819388571	CD	On-Demand	Anodyne	ADRB2	50	40
O[C@@H](CNCCc1cn[nH]c1)c1ccc(F)cc1F	ZINC000819388571	CD	On-Demand	Anodyne	ADRB1	43	37
O[C@@H](CNCCc1cn[nH]c1)c1ccc(F)cc1F	ZINC000819388571	CD	On-Demand	Anodyne	ADRB3	41	37
Cc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819388597	DI	On-Demand	Anodyne	ADRB2	18	48
Cc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819388615	DI	On-Demand	Anodyne	ADRB2	18	48
CC(C)(C)OC(=O)N(CCCNC[C@H](O)c1cc(F)ccc1F)C1CC1	ZINC000819388652	FG	On-Demand	Anodyne	LEF	46	33
CC(C)(C)OC(=O)N(CCCNC[C@@H](O)c1cc(F)ccc1F)C1CC1	ZINC000819388654	FG	On-Demand	Anodyne	LEF	46	33
C#Cc1cccc(NC(=O)c2ccc(OC)c(S(=O)(=O)N(C)Cc3ccccc3)c2)c1	ZINC000819388655	IH	On-Demand	Mild	CPT1A	90	42
C#Cc1cccc(NC(=O)c2ccc(OC)c(S(=O)(=O)N(C)Cc3ccccc3)c2)c1	ZINC000819388655	IH	On-Demand	Mild	CPT2	47	36
C#Cc1cccc(NC(=O)c2ccc(OC)c(S(=O)(=O)N(C)Cc3ccccc3)c2)c1	ZINC000819388655	IH	On-Demand	Mild	CPT1B	79	40
C#Cc1cccc(NC(=O)c2ccc(OC)c(S(=O)(=O)N(C)Cc3ccccc3)c2)c1	ZINC000819388655	IH	On-Demand	Mild	TAAR1	48	39
C#Cc1cccc(NC(=O)c2ccc(OC)c(S(=O)(=O)N(C)Cc3ccccc3)c2)c1	ZINC000819388655	IH	On-Demand	Mild	KCNK3	109	41
C#Cc1cccc(NC(=O)c2ccc(OC)c(S(=O)(=O)N(C)Cc3ccccc3)c2)c1	ZINC000819388655	IH	On-Demand	Mild	KCNK9	70	38
O=C(C(F)=C1CCC1)N1CCN(C2CCCCC2)CC1	ZINC000819388661	CF	On-Demand	Anodyne	HRH3	15	42
O=C(C(F)=C1CCC1)N1CCN(C2CCCCC2)CC1	ZINC000819388661	CF	On-Demand	Anodyne	L3MBTL3	50	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3cccc(F)c3)CC1)C2	ZINC000819388668	GE	On-Demand	Anodyne	SIGMAR1	21	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3cccc(F)c3)CC1)C2	ZINC000819388668	GE	On-Demand	Anodyne	MLNR	43	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(Cc3cccc(F)c3)CC1)C2	ZINC000819388668	GE	On-Demand	Anodyne	CACNA1G	29	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3cccc(F)c3)CC1)C2	ZINC000819388674	GE	On-Demand	Anodyne	SIGMAR1	21	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3cccc(F)c3)CC1)C2	ZINC000819388674	GE	On-Demand	Anodyne	MLNR	43	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(Cc3cccc(F)c3)CC1)C2	ZINC000819388674	GE	On-Demand	Anodyne	CACNA1G	29	41
COc1cc(NC[C@@H](O)c2cccnc2)cc(OC)c1OC	ZINC000819388677	DE	On-Demand	Anodyne	ADRB1	24	45
COc1cc(NC[C@@H](O)c2cccnc2)cc(OC)c1OC	ZINC000819388677	DE	On-Demand	Anodyne	ADRB3	83	45
COc1cc(NC[C@@H](O)c2cccnc2)cc(OC)c1OC	ZINC000819388677	DE	On-Demand	Anodyne	PTK2	59	41
COc1cc(NC[C@H](O)c2cccnc2)cc(OC)c1OC	ZINC000819388679	DE	On-Demand	Anodyne	ADRB1	24	45
COc1cc(NC[C@H](O)c2cccnc2)cc(OC)c1OC	ZINC000819388679	DE	On-Demand	Anodyne	ADRB3	83	45
COc1cc(NC[C@H](O)c2cccnc2)cc(OC)c1OC	ZINC000819388679	DE	On-Demand	Anodyne	PTK2	59	41
O[C@H](CNCCc1cn[nH]c1)c1ccc(F)c(Br)c1	ZINC000819388708	EE	On-Demand	Anodyne	ADRB2	35	42
O[C@H](CNCCc1cn[nH]c1)c1ccc(F)c(Br)c1	ZINC000819388708	EE	On-Demand	Anodyne	ADRB1	34	40
O[C@H](CNCCc1cn[nH]c1)c1ccc(F)c(Br)c1	ZINC000819388708	EE	On-Demand	Anodyne	ADRB3	63	40
O[C@@H](CNCCc1cn[nH]c1)c1ccc(F)c(Br)c1	ZINC000819388709	EE	On-Demand	Anodyne	ADRB2	35	42
O[C@@H](CNCCc1cn[nH]c1)c1ccc(F)c(Br)c1	ZINC000819388709	EE	On-Demand	Anodyne	ADRB1	34	40
O[C@@H](CNCCc1cn[nH]c1)c1ccc(F)c(Br)c1	ZINC000819388709	EE	On-Demand	Anodyne	ADRB3	63	40
O[C@H](CNCCc1cn[nH]c1)c1cccc(C(F)(F)F)c1	ZINC000819388720	CE	On-Demand	Anodyne	ADRB2	44	41
O[C@H](CNCCc1cn[nH]c1)c1cccc(C(F)(F)F)c1	ZINC000819388720	CE	On-Demand	Anodyne	ADRB1	48	41
O[C@H](CNCCc1cn[nH]c1)c1cccc(C(F)(F)F)c1	ZINC000819388720	CE	On-Demand	Anodyne	ADRB3	102	42
O[C@@H](CNCCc1cn[nH]c1)c1cccc(C(F)(F)F)c1	ZINC000819388721	CE	On-Demand	Anodyne	ADRB2	44	41
O[C@@H](CNCCc1cn[nH]c1)c1cccc(C(F)(F)F)c1	ZINC000819388721	CE	On-Demand	Anodyne	ADRB1	48	41
O[C@@H](CNCCc1cn[nH]c1)c1cccc(C(F)(F)F)c1	ZINC000819388721	CE	On-Demand	Anodyne	ADRB3	102	42
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc(Br)cc1	ZINC000819388748	FG	On-Demand	Anodyne	PAPA1_CARPA	31	42
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc(Br)cc1	ZINC000819388749	FG	On-Demand	Anodyne	PAPA1_CARPA	31	42
C#Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N(C)c3cc(Cl)c(OC)cc3OC)c2)c1	ZINC000819388758	JI	On-Demand	Mild	CPT1A	54	31
C#Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N(C)c3cc(Cl)c(OC)cc3OC)c2)c1	ZINC000819388758	JI	On-Demand	Mild	TAAR1	33	40
C#Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N(C)c3cc(Cl)c(OC)cc3OC)c2)c1	ZINC000819388758	JI	On-Demand	Mild	KCNK3	99	38
C#Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N(C)c3cc(Cl)c(OC)cc3OC)c2)c1	ZINC000819388758	JI	On-Demand	Mild	KCNK9	65	38
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCOCC1	ZINC000819388785	GF	On-Demand	Anodyne	KCNA3	40	38
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCOCC1	ZINC000819388785	GF	On-Demand	Anodyne	CPT1A	46	32
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCOCC1	ZINC000819388785	GF	On-Demand	Anodyne	HDAC1	15	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCOCC1	ZINC000819388785	GF	On-Demand	Anodyne	HDAC2	22	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCOCC1	ZINC000819388785	GF	On-Demand	Anodyne	SMO	15	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCOCC1	ZINC000819388785	GF	On-Demand	Anodyne	GPR35	48	36
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCOCC1	ZINC000819388785	GF	On-Demand	Anodyne	KCNK3	86	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCOCC1	ZINC000819388785	GF	On-Demand	Anodyne	KCNK9	49	37
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C1CC1	ZINC000819388791	FG	On-Demand	Anodyne	DRD4	16	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C1CC1	ZINC000819388791	FG	On-Demand	Anodyne	DRD3	19	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C1CC1	ZINC000819388791	FG	On-Demand	Anodyne	CPT1A	47	33
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C1CC1	ZINC000819388791	FG	On-Demand	Anodyne	PRNP	44	32
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C1CC1	ZINC000819388791	FG	On-Demand	Anodyne	HDAC1	17	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C1CC1	ZINC000819388791	FG	On-Demand	Anodyne	HDAC2	22	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C1CC1	ZINC000819388791	FG	On-Demand	Anodyne	SMO	20	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C1CC1	ZINC000819388791	FG	On-Demand	Anodyne	KCNK3	84	44
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C1CC1	ZINC000819388791	FG	On-Demand	Anodyne	KCNK9	46	37
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C1CC1	ZINC000819388792	FG	On-Demand	Anodyne	DRD4	16	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C1CC1	ZINC000819388792	FG	On-Demand	Anodyne	DRD3	19	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C1CC1	ZINC000819388792	FG	On-Demand	Anodyne	CPT1A	47	33
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C1CC1	ZINC000819388792	FG	On-Demand	Anodyne	PRNP	44	32
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C1CC1	ZINC000819388792	FG	On-Demand	Anodyne	HDAC1	17	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C1CC1	ZINC000819388792	FG	On-Demand	Anodyne	HDAC2	22	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C1CC1	ZINC000819388792	FG	On-Demand	Anodyne	SMO	20	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C1CC1	ZINC000819388792	FG	On-Demand	Anodyne	KCNK3	84	44
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C1CC1	ZINC000819388792	FG	On-Demand	Anodyne	KCNK9	46	37
C#Cc1cccc(NC(=O)c2ccccc2OCc2ccc(F)cc2)c1	ZINC000819388793	EJ	On-Demand	Mild	PPIA	42	38
C#Cc1cccc(NC(=O)c2ccccc2OCc2ccc(F)cc2)c1	ZINC000819388793	EJ	On-Demand	Mild	MET	15	51
C#Cc1cccc(NC(=O)c2ccccc2OCc2ccc(F)cc2)c1	ZINC000819388793	EJ	On-Demand	Mild	NR2E3	60	34
C#Cc1cccc(NC(=O)c2ccccc2OCc2ccc(F)cc2)c1	ZINC000819388793	EJ	On-Demand	Mild	KCNK3	95	49
C#Cc1cccc(NC(=O)c2ccccc2OCc2ccc(F)cc2)c1	ZINC000819388793	EJ	On-Demand	Mild	KCNK9	84	49
CCOC[C@H](O)CNc1cc(OC)c(NC(=O)c2ccccc2)cc1OC	ZINC000819388809	FF	On-Demand	Anodyne	CPT1A	44	30
CCOC[C@H](O)CNc1cc(OC)c(NC(=O)c2ccccc2)cc1OC	ZINC000819388809	FF	On-Demand	Anodyne	KCNK3	52	40
C#Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N(C)c3ccc(C)cc3)c2)c1	ZINC000819388812	HI	On-Demand	Mild	KCNK3	108	47
C#Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N(C)c3ccc(C)cc3)c2)c1	ZINC000819388812	HI	On-Demand	Mild	KCNK9	58	43
CC[C@H](O)CNc1cc(OC)c(NC(=O)c2ccccc2)cc1OC	ZINC000819388817	EG	On-Demand	Anodyne	PPARA	16	40
CC[C@H](O)CNc1cc(OC)c(NC(=O)c2ccccc2)cc1OC	ZINC000819388817	EG	On-Demand	Anodyne	CPT1A	46	32
CC[C@H](O)CNc1cc(OC)c(NC(=O)c2ccccc2)cc1OC	ZINC000819388817	EG	On-Demand	Anodyne	HDAC1	20	42
CC[C@H](O)CNc1cc(OC)c(NC(=O)c2ccccc2)cc1OC	ZINC000819388817	EG	On-Demand	Anodyne	HDAC2	23	42
CC[C@H](O)CNc1cc(OC)c(NC(=O)c2ccccc2)cc1OC	ZINC000819388817	EG	On-Demand	Anodyne	ITGAV	22	41
CC[C@H](O)CNc1cc(OC)c(NC(=O)c2ccccc2)cc1OC	ZINC000819388817	EG	On-Demand	Anodyne	SMO	22	41
CC[C@H](O)CNc1cc(OC)c(NC(=O)c2ccccc2)cc1OC	ZINC000819388817	EG	On-Demand	Anodyne	KCNK3	76	43
CC[C@H](O)CNc1cc(OC)c(NC(=O)c2ccccc2)cc1OC	ZINC000819388817	EG	On-Demand	Anodyne	KCNK9	46	36
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1c(F)cccc1Cl	ZINC000819388847	GH	On-Demand	Anodyne	CRTM	40	35
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1c(F)cccc1Cl	ZINC000819388848	GH	On-Demand	Anodyne	CRTM	40	35
Cn1cc([C@@H](O)CNC(=O)C2(c3ccc(Cl)cc3Cl)CCCCC2)cn1	ZINC000819388870	GH	On-Demand	Anodyne	UGCG	35	42
O=C(NC[C@@H](O)c1ccsc1)c1cc2c(cn1)OCCO2	ZINC000819388915	DD	On-Demand	Anodyne	SCD1	15	42
O=C(NC[C@H](O)c1ccsc1)c1cc2c(cn1)OCCO2	ZINC000819388917	DD	On-Demand	Anodyne	SCD1	15	42
O=C(NC[C@H](O)c1cccc(OCc2ccccc2)c1)C(F)=C1CCC1	ZINC000819389008	FH	On-Demand	Anodyne	ADRB3	39	41
O=C(NC[C@H](O)c1cccc(OCc2ccccc2)c1)C(F)=C1CCC1	ZINC000819389008	FH	On-Demand	Anodyne	CAPN2	35	44
O=C(NC[C@H](O)c1cccc(OCc2ccccc2)c1)C(F)=C1CCC1	ZINC000819389008	FH	On-Demand	Anodyne	PDS	74	39
O=C(NC[C@@H](O)c1cccc(OCc2ccccc2)c1)C(F)=C1CCC1	ZINC000819389013	FH	On-Demand	Anodyne	ADRB3	39	41
O=C(NC[C@@H](O)c1cccc(OCc2ccccc2)c1)C(F)=C1CCC1	ZINC000819389013	FH	On-Demand	Anodyne	CAPN2	35	44
O=C(NC[C@@H](O)c1cccc(OCc2ccccc2)c1)C(F)=C1CCC1	ZINC000819389013	FH	On-Demand	Anodyne	PDS	74	39
CC(C)(C)OC(=O)N(CCCNC[C@H](O)c1cccnc1)C1CC1	ZINC000819389018	EE	On-Demand	Anodyne	ADRB2	23	42
CC(C)(C)OC(=O)N(CCCNC[C@H](O)c1cccnc1)C1CC1	ZINC000819389018	EE	On-Demand	Anodyne	ADRB1	29	42
CC(C)(C)OC(=O)N(CCCNC[C@H](O)c1cccnc1)C1CC1	ZINC000819389018	EE	On-Demand	Anodyne	ADRB3	99	47
CC(C)(C)OC(=O)N(CCCNC[C@@H](O)c1cccnc1)C1CC1	ZINC000819389020	EE	On-Demand	Anodyne	ADRB2	23	42
CC(C)(C)OC(=O)N(CCCNC[C@@H](O)c1cccnc1)C1CC1	ZINC000819389020	EE	On-Demand	Anodyne	ADRB1	29	42
CC(C)(C)OC(=O)N(CCCNC[C@@H](O)c1cccnc1)C1CC1	ZINC000819389020	EE	On-Demand	Anodyne	ADRB3	99	47
C#Cc1cccc(NC(=O)c2ccccc2OCC(=O)Nc2ccc(SC(F)F)cc2)c1	ZINC000819389130	JK	On-Demand	Mild	NR2E3	50	31
C#Cc1cccc(NC(=O)c2ccccc2OCC(=O)Nc2ccc(SC(F)F)cc2)c1	ZINC000819389130	JK	On-Demand	Mild	KCNK3	59	43
C#Cc1cccc(NC(=O)c2ccccc2OCC(=O)Nc2ccc(SC(F)F)cc2)c1	ZINC000819389130	JK	On-Demand	Mild	KCNK9	60	43
COc1cc(NCCC(=O)Nc2cccnc2)cc(OC)c1OC	ZINC000819389144	EF	On-Demand	Anodyne	PTK2	63	39
COc1cc(NCCC(=O)Nc2cccnc2)cc(OC)c1OC	ZINC000819389144	EF	On-Demand	Anodyne	ENPP1	60	37
COc1cc(NCCC(=O)Nc2cccnc2)cc(OC)c1OC	ZINC000819389144	EF	On-Demand	Anodyne	NAMPT	15	40
COc1cc(NC[C@@H](O)Cc2ccc3ccccc3c2)cc(OC)c1OC	ZINC000819389156	FH	On-Demand	Anodyne	ADRB2	19	40
COc1cc(NC[C@@H](O)Cc2ccc3ccccc3c2)cc(OC)c1OC	ZINC000819389156	FH	On-Demand	Anodyne	CASR	49	45
COc1cc(NC[C@H](O)Cc2ccc3ccccc3c2)cc(OC)c1OC	ZINC000819389161	FH	On-Demand	Anodyne	ADRB2	19	40
COc1cc(NC[C@H](O)Cc2ccc3ccccc3c2)cc(OC)c1OC	ZINC000819389161	FH	On-Demand	Anodyne	CASR	49	45
C/C=C/c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389188	EH	On-Demand	Anodyne	ADRB2	32	69
C/C=C/c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389188	EH	On-Demand	Anodyne	ADRB1	21	69
C/C=C/c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389188	EH	On-Demand	Anodyne	CYP1B1	32	40
C/C=C/c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389188	EH	On-Demand	Anodyne	CYP1A1	32	40
C/C=C\c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389190	EH	On-Demand	Anodyne	ADRB2	32	69
C/C=C\c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389190	EH	On-Demand	Anodyne	ADRB1	21	69
C/C=C\c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389190	EH	On-Demand	Anodyne	CYP1B1	32	40
C/C=C\c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389190	EH	On-Demand	Anodyne	CYP1A1	32	40
C/C=C/c1ccc(OC[C@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389192	EH	On-Demand	Anodyne	ADRB2	32	69
C/C=C/c1ccc(OC[C@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389192	EH	On-Demand	Anodyne	ADRB1	21	69
C/C=C/c1ccc(OC[C@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389192	EH	On-Demand	Anodyne	CYP1B1	32	40
C/C=C/c1ccc(OC[C@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389192	EH	On-Demand	Anodyne	CYP1A1	32	40
C/C=C\c1ccc(OC[C@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389193	EH	On-Demand	Anodyne	ADRB2	32	69
C/C=C\c1ccc(OC[C@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389193	EH	On-Demand	Anodyne	ADRB1	21	69
C/C=C\c1ccc(OC[C@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389193	EH	On-Demand	Anodyne	CYP1B1	32	40
C/C=C\c1ccc(OC[C@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389193	EH	On-Demand	Anodyne	CYP1A1	32	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cc(C)ccn3)CC1)C2	ZINC000819389200	FD	On-Demand	Anodyne	NPBWR1	41	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cc(C)ccn3)CC1)C2	ZINC000819389203	FD	On-Demand	Anodyne	NPBWR1	41	34
O=C(C(F)=C1CCC1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389221	DF	On-Demand	Anodyne	FABP4	19	43
O=C(C(F)=C1CCC1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389221	DF	On-Demand	Anodyne	SIGMAR1	24	50
O=C(C(F)=C1CCC1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389221	DF	On-Demand	Anodyne	CCR3	18	42
O=C(C(F)=C1CCC1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389221	DF	On-Demand	Anodyne	FAAH	22	41
O=C(C(F)=C1CCC1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389221	DF	On-Demand	Anodyne	CACNA1G	26	42
O=C(CCNC(=O)C(F)=C1CCC1)OCc1ccccc1	ZINC000819389243	CF	On-Demand	Anodyne	CAPN2	65	33
O=C(CCNC(=O)C(F)=C1CCC1)OCc1ccccc1	ZINC000819389243	CF	On-Demand	Anodyne	NPR	41	34
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819389248	GG	On-Demand	Mild	PAPA1_CARPA	52	49
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819389248	GG	On-Demand	Mild	CTSL	26	48
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819389248	GG	On-Demand	Mild	CTSS	19	53
O=C(N[C@H](Cc1ccccc1)C(F)(F)F)C(F)=C1CCC1	ZINC000819389256	DH	On-Demand	Anodyne	ACE	30	40
O=C(N[C@H](Cc1ccccc1)C(F)(F)F)C(F)=C1CCC1	ZINC000819389256	DH	On-Demand	Anodyne	MME	73	40
O=C(N[C@H](Cc1ccccc1)C(F)(F)F)C(F)=C1CCC1	ZINC000819389256	DH	On-Demand	Anodyne	CAPN2	44	32
O=C(N[C@@H](Cc1ccccc1)C(F)(F)F)C(F)=C1CCC1	ZINC000819389257	DH	On-Demand	Anodyne	ACE	30	40
O=C(N[C@@H](Cc1ccccc1)C(F)(F)F)C(F)=C1CCC1	ZINC000819389257	DH	On-Demand	Anodyne	MME	73	40
O=C(N[C@@H](Cc1ccccc1)C(F)(F)F)C(F)=C1CCC1	ZINC000819389257	DH	On-Demand	Anodyne	CAPN2	44	32
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CCC(C)C	ZINC000819389268	GI	On-Demand	Anodyne	CPT1A	44	31
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CCC(C)C	ZINC000819389268	GI	On-Demand	Anodyne	HDAC2	16	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CCC(C)C	ZINC000819389268	GI	On-Demand	Anodyne	SMO	18	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CCC(C)C	ZINC000819389268	GI	On-Demand	Anodyne	GPR35	42	35
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CCC(C)C	ZINC000819389268	GI	On-Demand	Anodyne	KCNK3	68	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CCC(C)C	ZINC000819389269	GI	On-Demand	Anodyne	CPT1A	44	31
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CCC(C)C	ZINC000819389269	GI	On-Demand	Anodyne	HDAC2	16	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CCC(C)C	ZINC000819389269	GI	On-Demand	Anodyne	SMO	18	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CCC(C)C	ZINC000819389269	GI	On-Demand	Anodyne	GPR35	42	35
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CCC(C)C	ZINC000819389269	GI	On-Demand	Anodyne	KCNK3	68	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CC1CCCC1	ZINC000819389279	GI	On-Demand	Anodyne	DRD2	19	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CC1CCCC1	ZINC000819389279	GI	On-Demand	Anodyne	DRD4	15	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CC1CCCC1	ZINC000819389279	GI	On-Demand	Anodyne	DRD3	23	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CC1CCCC1	ZINC000819389279	GI	On-Demand	Anodyne	CPT1A	45	31
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CC1CCCC1	ZINC000819389279	GI	On-Demand	Anodyne	PRNP	47	31
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CC1CCCC1	ZINC000819389279	GI	On-Demand	Anodyne	CTSS	16	44
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CC1CCCC1	ZINC000819389279	GI	On-Demand	Anodyne	CCR8	29	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CC1CCCC1	ZINC000819389279	GI	On-Demand	Anodyne	SMO	16	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CC1CCCC1	ZINC000819389279	GI	On-Demand	Anodyne	ACKR3	43	34
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CC1CCCC1	ZINC000819389279	GI	On-Demand	Anodyne	KCNK3	69	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CC1CCCC1	ZINC000819389280	GI	On-Demand	Anodyne	DRD2	19	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CC1CCCC1	ZINC000819389280	GI	On-Demand	Anodyne	DRD4	15	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CC1CCCC1	ZINC000819389280	GI	On-Demand	Anodyne	DRD3	23	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CC1CCCC1	ZINC000819389280	GI	On-Demand	Anodyne	CPT1A	45	31
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CC1CCCC1	ZINC000819389280	GI	On-Demand	Anodyne	PRNP	47	31
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CC1CCCC1	ZINC000819389280	GI	On-Demand	Anodyne	CTSS	16	44
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CC1CCCC1	ZINC000819389280	GI	On-Demand	Anodyne	CCR8	29	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CC1CCCC1	ZINC000819389280	GI	On-Demand	Anodyne	SMO	16	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CC1CCCC1	ZINC000819389280	GI	On-Demand	Anodyne	ACKR3	43	34
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CC1CCCC1	ZINC000819389280	GI	On-Demand	Anodyne	KCNK3	69	41
C=CCCn1cc(C(=O)NCCC(=O)OCc2ccccc2)nn1	ZINC000819389293	ED	On-Demand	Mild	NPR	53	34
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc(Br)cc2)CC1	ZINC000819389302	GH	On-Demand	Anodyne	GPR119	52	48
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc(Br)cc2)CC1	ZINC000819389303	GH	On-Demand	Anodyne	GPR119	52	48
CC(=O)Nc1cccc(CC(=O)NCCC(=O)OCc2ccccc2)c1	ZINC000819389304	FE	On-Demand	Anodyne	LTA4H	15	43
CC(=O)Nc1cccc(CC(=O)NCCC(=O)OCc2ccccc2)c1	ZINC000819389304	FE	On-Demand	Anodyne	CAPN2	41	30
CC(=O)Nc1cccc(CC(=O)NCCC(=O)OCc2ccccc2)c1	ZINC000819389304	FE	On-Demand	Anodyne	NPR	66	36
CC(=O)Nc1cccc(CC(=O)NCCC(=O)OCc2ccccc2)c1	ZINC000819389304	FE	On-Demand	Anodyne	KCNK3	72	34
CC(=O)Nc1cccc(CC(=O)NCCC(=O)OCc2ccccc2)c1	ZINC000819389304	FE	On-Demand	Anodyne	KCNK9	56	33
O=C(CCNC(=O)c1cc2c(cn1)OCCO2)OCc1ccccc1	ZINC000819389311	ED	On-Demand	Anodyne	NPR	50	34
C#Cc1cccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCc4ccccc43)c2)c1	ZINC000819389314	II	On-Demand	Mild	AVPR2	35	42
C#Cc1cccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCc4ccccc43)c2)c1	ZINC000819389314	II	On-Demand	Mild	CPT1A	68	46
C#Cc1cccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCc4ccccc43)c2)c1	ZINC000819389314	II	On-Demand	Mild	CPT2	43	45
C#Cc1cccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCc4ccccc43)c2)c1	ZINC000819389314	II	On-Demand	Mild	CPT1B	47	45
C#Cc1cccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N3CCc4ccccc43)c2)c1	ZINC000819389314	II	On-Demand	Mild	KCNK3	45	36
C[C@@H](CC(=O)NCCC(=O)OCc1ccccc1)n1cccn1	ZINC000819389317	DE	On-Demand	Anodyne	CAPNS1	52	32
C[C@@H](CC(=O)NCCC(=O)OCc1ccccc1)n1cccn1	ZINC000819389317	DE	On-Demand	Anodyne	CAPN1	48	37
C[C@@H](CC(=O)NCCC(=O)OCc1ccccc1)n1cccn1	ZINC000819389317	DE	On-Demand	Anodyne	CAPN2	77	37
C[C@@H](CC(=O)NCCC(=O)OCc1ccccc1)n1cccn1	ZINC000819389317	DE	On-Demand	Anodyne	NPR	69	35
C[C@H](CC(=O)NCCC(=O)OCc1ccccc1)n1cccn1	ZINC000819389318	DE	On-Demand	Anodyne	CAPNS1	52	32
C[C@H](CC(=O)NCCC(=O)OCc1ccccc1)n1cccn1	ZINC000819389318	DE	On-Demand	Anodyne	CAPN1	48	37
C[C@H](CC(=O)NCCC(=O)OCc1ccccc1)n1cccn1	ZINC000819389318	DE	On-Demand	Anodyne	CAPN2	77	37
C[C@H](CC(=O)NCCC(=O)OCc1ccccc1)n1cccn1	ZINC000819389318	DE	On-Demand	Anodyne	NPR	69	35
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCCC(=O)N(C)OC	ZINC000819389319	GF	On-Demand	Anodyne	DRD3	15	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCCC(=O)N(C)OC	ZINC000819389319	GF	On-Demand	Anodyne	CPT1A	46	32
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCCC(=O)N(C)OC	ZINC000819389319	GF	On-Demand	Anodyne	HDAC2	18	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCCC(=O)N(C)OC	ZINC000819389319	GF	On-Demand	Anodyne	KCNK3	61	41
O=C(NCCNC(=O)C(F)=C1CCC1)NC1CCCCC1	ZINC000819389326	CE	On-Demand	Anodyne	EPHX2	17	48
Cc1ccc(NC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1C	ZINC000819389366	EH	On-Demand	Anodyne	GPR119	31	43
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389373	DE	On-Demand	Anodyne	FABP4	19	42
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389373	DE	On-Demand	Anodyne	SIGMAR1	24	47
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389373	DE	On-Demand	Anodyne	CCR3	28	44
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389373	DE	On-Demand	Anodyne	MLNR	33	40
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389373	DE	On-Demand	Anodyne	MCHR1	15	42
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389373	DE	On-Demand	Anodyne	CACNA1G	24	40
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389375	DE	On-Demand	Anodyne	FABP4	19	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389375	DE	On-Demand	Anodyne	SIGMAR1	24	47
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389375	DE	On-Demand	Anodyne	CCR3	28	44
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389375	DE	On-Demand	Anodyne	MLNR	33	40
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389375	DE	On-Demand	Anodyne	MCHR1	15	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389375	DE	On-Demand	Anodyne	CACNA1G	24	40
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389377	DE	On-Demand	Anodyne	FABP4	19	42
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389377	DE	On-Demand	Anodyne	SIGMAR1	24	47
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389377	DE	On-Demand	Anodyne	CCR3	28	44
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389377	DE	On-Demand	Anodyne	MLNR	33	40
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389377	DE	On-Demand	Anodyne	MCHR1	15	42
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389377	DE	On-Demand	Anodyne	CACNA1G	24	40
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389379	DE	On-Demand	Anodyne	FABP4	19	42
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389379	DE	On-Demand	Anodyne	SIGMAR1	24	47
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389379	DE	On-Demand	Anodyne	CCR3	28	44
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389379	DE	On-Demand	Anodyne	MLNR	33	40
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389379	DE	On-Demand	Anodyne	MCHR1	15	42
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819389379	DE	On-Demand	Anodyne	CACNA1G	24	40
C#Cc1cccc(NC(=O)c2ccc(OC)c(S(=O)(=O)N3CCCc4ccccc43)c2)c1	ZINC000819389402	II	On-Demand	Mild	AVPR2	38	47
C#Cc1cccc(NC(=O)c2ccc(OC)c(S(=O)(=O)N3CCCc4ccccc43)c2)c1	ZINC000819389402	II	On-Demand	Mild	DRD3	17	43
C#Cc1cccc(NC(=O)c2ccc(OC)c(S(=O)(=O)N3CCCc4ccccc43)c2)c1	ZINC000819389402	II	On-Demand	Mild	CPT1A	106	58
C#Cc1cccc(NC(=O)c2ccc(OC)c(S(=O)(=O)N3CCCc4ccccc43)c2)c1	ZINC000819389402	II	On-Demand	Mild	CPT2	63	53
C#Cc1cccc(NC(=O)c2ccc(OC)c(S(=O)(=O)N3CCCc4ccccc43)c2)c1	ZINC000819389402	II	On-Demand	Mild	CPT1B	81	54
C#Cc1cccc(NC(=O)c2ccc(OC)c(S(=O)(=O)N3CCCc4ccccc43)c2)c1	ZINC000819389402	II	On-Demand	Mild	TAAR1	49	42
C#Cc1cccc(NC(=O)c2ccc(OC)c(S(=O)(=O)N3CCCc4ccccc43)c2)c1	ZINC000819389402	II	On-Demand	Mild	KCNK3	59	35
C#Cc1cccc(NC(=O)c2ccc(OC)c(S(=O)(=O)N3CCCc4ccccc43)c2)c1	ZINC000819389402	II	On-Demand	Mild	KCNK9	40	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](Oc3ccccn3)C1)C2	ZINC000819389407	FD	On-Demand	Anodyne	PDE3A	23	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](Oc3ccccn3)C1)C2	ZINC000819389407	FD	On-Demand	Anodyne	PDE3B	26	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](Oc3ccccn3)C1)C2	ZINC000819389410	FD	On-Demand	Anodyne	PDE3A	23	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](Oc3ccccn3)C1)C2	ZINC000819389410	FD	On-Demand	Anodyne	PDE3B	26	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](Oc3ccccn3)C1)C2	ZINC000819389412	FD	On-Demand	Anodyne	PDE3A	23	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](Oc3ccccn3)C1)C2	ZINC000819389412	FD	On-Demand	Anodyne	PDE3B	26	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](Oc3ccccn3)C1)C2	ZINC000819389415	FD	On-Demand	Anodyne	PDE3A	23	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](Oc3ccccn3)C1)C2	ZINC000819389415	FD	On-Demand	Anodyne	PDE3B	26	42
C#Cc1cccc(NC(=O)[C@@H]2Cc3ccccc3CN2S(=O)(=O)c2ccc(C)cc2)c1	ZINC000819389416	IH	On-Demand	Mild	MMP3	45	56
C#Cc1cccc(NC(=O)[C@@H]2Cc3ccccc3CN2S(=O)(=O)c2ccc(C)cc2)c1	ZINC000819389416	IH	On-Demand	Mild	MMP8	48	56
C#Cc1cccc(NC(=O)[C@@H]2Cc3ccccc3CN2S(=O)(=O)c2ccc(C)cc2)c1	ZINC000819389416	IH	On-Demand	Mild	CFTR	64	36
C#Cc1cccc(NC(=O)[C@@H]2Cc3ccccc3CN2S(=O)(=O)c2ccc(C)cc2)c1	ZINC000819389416	IH	On-Demand	Mild	ADAM9	49	33
CC(=O)N1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H](C)C1	ZINC000819389456	FD	On-Demand	Mild	PAPA1_CARPA	39	46
CC(=O)N1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H](C)C1	ZINC000819389458	FD	On-Demand	Mild	PAPA1_CARPA	39	46
CC(=O)N1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H](C)C1	ZINC000819389459	FD	On-Demand	Mild	PAPA1_CARPA	39	46
CC(=O)N1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H](C)C1	ZINC000819389460	FD	On-Demand	Mild	PAPA1_CARPA	39	46
O[C@@H](CNCC[C@H]1CCc2ccccc2N1)c1cccnc1	ZINC000819389463	CF	On-Demand	Anodyne	ADRB2	22	41
O[C@@H](CNCC[C@H]1CCc2ccccc2N1)c1cccnc1	ZINC000819389463	CF	On-Demand	Anodyne	ADRB1	24	41
O[C@@H](CNCC[C@H]1CCc2ccccc2N1)c1cccnc1	ZINC000819389463	CF	On-Demand	Anodyne	ADRB3	95	43
O[C@H](CNCC[C@@H]1CCc2ccccc2N1)c1cccnc1	ZINC000819389465	CF	On-Demand	Anodyne	ADRB2	22	41
O[C@H](CNCC[C@@H]1CCc2ccccc2N1)c1cccnc1	ZINC000819389465	CF	On-Demand	Anodyne	ADRB1	24	41
O[C@H](CNCC[C@@H]1CCc2ccccc2N1)c1cccnc1	ZINC000819389465	CF	On-Demand	Anodyne	ADRB3	95	43
O[C@H](CNCC[C@H]1CCc2ccccc2N1)c1cccnc1	ZINC000819389466	CF	On-Demand	Anodyne	ADRB2	22	41
O[C@H](CNCC[C@H]1CCc2ccccc2N1)c1cccnc1	ZINC000819389466	CF	On-Demand	Anodyne	ADRB1	24	41
O[C@H](CNCC[C@H]1CCc2ccccc2N1)c1cccnc1	ZINC000819389466	CF	On-Demand	Anodyne	ADRB3	95	43
O[C@@H](CNCC[C@@H]1CCc2ccccc2N1)c1cccnc1	ZINC000819389468	CF	On-Demand	Anodyne	ADRB2	22	41
O[C@@H](CNCC[C@@H]1CCc2ccccc2N1)c1cccnc1	ZINC000819389468	CF	On-Demand	Anodyne	ADRB1	24	41
O[C@@H](CNCC[C@@H]1CCc2ccccc2N1)c1cccnc1	ZINC000819389468	CF	On-Demand	Anodyne	ADRB3	95	43
Cc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1C	ZINC000819389486	EH	On-Demand	Anodyne	EPHX2	17	40
Cc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1C	ZINC000819389486	EH	On-Demand	Anodyne	F13A1	16	42
Cc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1C	ZINC000819389486	EH	On-Demand	Anodyne	GPR119	56	49
Cc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1C	ZINC000819389488	EH	On-Demand	Anodyne	EPHX2	17	40
Cc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1C	ZINC000819389488	EH	On-Demand	Anodyne	F13A1	16	42
Cc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1C	ZINC000819389488	EH	On-Demand	Anodyne	GPR119	56	49
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)C	ZINC000819389568	CD	On-Demand	Anodyne	ADRB2	25	45
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)C	ZINC000819389568	CD	On-Demand	Anodyne	ADRB1	40	47
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)C	ZINC000819389568	CD	On-Demand	Anodyne	ADRB3	59	46
C[C@@H](CNC[C@H](O)c1cccc(Cl)c1)N(C)C	ZINC000819389568	CD	On-Demand	Anodyne	AOC3	18	40
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)C	ZINC000819389569	CD	On-Demand	Anodyne	ADRB2	25	45
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)C	ZINC000819389569	CD	On-Demand	Anodyne	ADRB1	40	47
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)C	ZINC000819389569	CD	On-Demand	Anodyne	ADRB3	59	46
C[C@@H](CNC[C@@H](O)c1cccc(Cl)c1)N(C)C	ZINC000819389569	CD	On-Demand	Anodyne	AOC3	18	40
COc1cccc([S@@](=O)CC(=O)NCCC(=O)OCc2ccccc2)c1	ZINC000819389577	GE	On-Demand	Anodyne	MTNR1A	52	42
COc1cccc([S@@](=O)CC(=O)NCCC(=O)OCc2ccccc2)c1	ZINC000819389577	GE	On-Demand	Anodyne	MTNR1B	51	42
COc1cccc([S@@](=O)CC(=O)NCCC(=O)OCc2ccccc2)c1	ZINC000819389577	GE	On-Demand	Anodyne	CAPN2	45	39
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](C)O	ZINC000819389578	EF	On-Demand	Anodyne	CPT1A	47	33
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](C)O	ZINC000819389578	EF	On-Demand	Anodyne	NR1H4	15	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](C)O	ZINC000819389578	EF	On-Demand	Anodyne	HDAC1	21	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](C)O	ZINC000819389578	EF	On-Demand	Anodyne	HDAC2	25	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](C)O	ZINC000819389578	EF	On-Demand	Anodyne	ABCB1	17	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](C)O	ZINC000819389578	EF	On-Demand	Anodyne	ITGAV	22	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](C)O	ZINC000819389578	EF	On-Demand	Anodyne	CCR8	34	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](C)O	ZINC000819389578	EF	On-Demand	Anodyne	SMO	25	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](C)O	ZINC000819389578	EF	On-Demand	Anodyne	GPR35	52	38
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](C)O	ZINC000819389578	EF	On-Demand	Anodyne	KCNK3	85	45
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](C)O	ZINC000819389578	EF	On-Demand	Anodyne	KCNK9	47	37
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](C)O	ZINC000819389579	EF	On-Demand	Anodyne	CPT1A	47	33
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](C)O	ZINC000819389579	EF	On-Demand	Anodyne	NR1H4	15	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](C)O	ZINC000819389579	EF	On-Demand	Anodyne	HDAC1	21	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](C)O	ZINC000819389579	EF	On-Demand	Anodyne	HDAC2	25	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](C)O	ZINC000819389579	EF	On-Demand	Anodyne	ABCB1	17	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](C)O	ZINC000819389579	EF	On-Demand	Anodyne	ITGAV	22	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](C)O	ZINC000819389579	EF	On-Demand	Anodyne	CCR8	34	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](C)O	ZINC000819389579	EF	On-Demand	Anodyne	SMO	25	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](C)O	ZINC000819389579	EF	On-Demand	Anodyne	GPR35	52	38
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](C)O	ZINC000819389579	EF	On-Demand	Anodyne	KCNK3	85	45
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](C)O	ZINC000819389579	EF	On-Demand	Anodyne	KCNK9	47	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCC(=O)OCc1ccccc1	ZINC000819389586	FE	On-Demand	Anodyne	CTSK	25	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCC(=O)OCc1ccccc1	ZINC000819389586	FE	On-Demand	Anodyne	CAPN2	52	30
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCC(=O)OCc1ccccc1	ZINC000819389586	FE	On-Demand	Anodyne	KLK5	26	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCC(=O)OCc1ccccc1	ZINC000819389586	FE	On-Demand	Anodyne	NPR	51	35
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CSC	ZINC000819389611	GG	On-Demand	Anodyne	CPT1A	45	31
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CSC	ZINC000819389611	GG	On-Demand	Anodyne	HDAC2	16	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CSC	ZINC000819389611	GG	On-Demand	Anodyne	SMO	17	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CSC	ZINC000819389611	GG	On-Demand	Anodyne	GPR35	40	35
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CSC	ZINC000819389611	GG	On-Demand	Anodyne	KCNK3	66	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CSC	ZINC000819389612	GG	On-Demand	Anodyne	CPT1A	45	31
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CSC	ZINC000819389612	GG	On-Demand	Anodyne	HDAC2	16	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CSC	ZINC000819389612	GG	On-Demand	Anodyne	SMO	17	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CSC	ZINC000819389612	GG	On-Demand	Anodyne	GPR35	40	35
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CSC	ZINC000819389612	GG	On-Demand	Anodyne	KCNK3	66	42
C#Cc1cccc(NC(=O)COc2ccc(-c3ccccc3)cc2)c1	ZINC000819389617	EI	On-Demand	Mild	ADORA2A	15	44
C#Cc1cccc(NC(=O)COc2ccc(-c3ccccc3)cc2)c1	ZINC000819389617	EI	On-Demand	Mild	ADORA2B	43	44
C#Cc1cccc(NC(=O)COc2ccc(-c3ccccc3)cc2)c1	ZINC000819389617	EI	On-Demand	Mild	CPT1A	38	41
C#Cc1cccc(NC(=O)COc2ccc(-c3ccccc3)cc2)c1	ZINC000819389617	EI	On-Demand	Mild	HDAC8	18	40
C#Cc1cccc(NC(=O)COc2ccc(-c3ccccc3)cc2)c1	ZINC000819389617	EI	On-Demand	Mild	HDAC6	21	42
C#Cc1cccc(NC(=O)COc2ccc(-c3ccccc3)cc2)c1	ZINC000819389617	EI	On-Demand	Mild	PTPN22	24	46
C#Cc1cccc(NC(=O)COc2ccc(-c3ccccc3)cc2)c1	ZINC000819389617	EI	On-Demand	Mild	HIF1A	15	45
C#Cc1cccc(NC(=O)COc2ccc(-c3ccccc3)cc2)c1	ZINC000819389617	EI	On-Demand	Mild	KCNK3	48	33
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCCC1	ZINC000819389636	GI	On-Demand	Anodyne	DRD3	18	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCCC1	ZINC000819389636	GI	On-Demand	Anodyne	KCNA3	41	39
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCCC1	ZINC000819389636	GI	On-Demand	Anodyne	CPT1A	47	33
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCCC1	ZINC000819389636	GI	On-Demand	Anodyne	HDAC1	17	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCCC1	ZINC000819389636	GI	On-Demand	Anodyne	HDAC2	24	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCCC1	ZINC000819389636	GI	On-Demand	Anodyne	SMO	17	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCCC1	ZINC000819389636	GI	On-Demand	Anodyne	HCN1	53	37
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCCC1	ZINC000819389636	GI	On-Demand	Anodyne	HCN4	50	35
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCCC1	ZINC000819389636	GI	On-Demand	Anodyne	GPR35	44	35
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCCC1	ZINC000819389636	GI	On-Demand	Anodyne	KCNK3	76	44
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCCC1	ZINC000819389636	GI	On-Demand	Anodyne	KCNK9	41	36
C#Cc1cccc(NC(=O)c2ccc(S(=O)(=O)N3CCCCCC3)cc2)c1	ZINC000819389642	GG	On-Demand	Mild	LPL	45	38
C#Cc1cccc(NC(=O)c2ccc(S(=O)(=O)N3CCCCCC3)cc2)c1	ZINC000819389642	GG	On-Demand	Mild	TGM2	72	39
C#Cc1cccc(NC(=O)c2ccc(S(=O)(=O)N3CCCCCC3)cc2)c1	ZINC000819389642	GG	On-Demand	Mild	F13A1	73	44
C#Cc1cccc(NC(=O)c2ccc(S(=O)(=O)N3CCCCCC3)cc2)c1	ZINC000819389642	GG	On-Demand	Mild	TAAR1	50	40
C#Cc1cccc(NC(=O)c2ccc(S(=O)(=O)N3CCCCCC3)cc2)c1	ZINC000819389642	GG	On-Demand	Mild	AKR1C3	42	41
C#Cc1cccc(NC(=O)c2ccc(S(=O)(=O)N3CCCCCC3)cc2)c1	ZINC000819389642	GG	On-Demand	Mild	NAMPT	40	44
C#Cc1cccc(NC(=O)c2ccc(S(=O)(=O)N3CCCCCC3)cc2)c1	ZINC000819389642	GG	On-Demand	Mild	KCNK3	81	41
C#Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N3CCCc4ccccc43)c2)c1	ZINC000819389645	HI	On-Demand	Mild	AVPR2	30	45
C#Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N3CCCc4ccccc43)c2)c1	ZINC000819389645	HI	On-Demand	Mild	CYP11B2	21	40
C#Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N3CCCc4ccccc43)c2)c1	ZINC000819389645	HI	On-Demand	Mild	CPT1A	39	57
C#Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N3CCCc4ccccc43)c2)c1	ZINC000819389645	HI	On-Demand	Mild	AKR1C3	61	46
C#Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N3CCCc4ccccc43)c2)c1	ZINC000819389645	HI	On-Demand	Mild	KCNK3	83	37
C#Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N3CCCc4ccccc43)c2)c1	ZINC000819389645	HI	On-Demand	Mild	KCNK9	40	33
Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1C	ZINC000819389695	CG	On-Demand	Bother	CACNA1C	46	34
Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1C	ZINC000819389695	CG	On-Demand	Bother	CACNA1D	73	34
Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1C	ZINC000819389696	CG	On-Demand	Bother	CACNA1C	46	34
Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1C	ZINC000819389696	CG	On-Demand	Bother	CACNA1D	73	34
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)cc2)cc1	ZINC000819389744	DF	On-Demand	Anodyne	ADRB2	63	48
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)cc2)cc1	ZINC000819389744	DF	On-Demand	Anodyne	ADRB1	70	48
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)cc2)cc1	ZINC000819389744	DF	On-Demand	Anodyne	ADRB3	47	50
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)cc2)cc1	ZINC000819389746	DF	On-Demand	Anodyne	ADRB2	63	48
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)cc2)cc1	ZINC000819389746	DF	On-Demand	Anodyne	ADRB1	70	48
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)cc2)cc1	ZINC000819389746	DF	On-Demand	Anodyne	ADRB3	47	50
C=CCc1ccc(OC[C@@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389750	EG	On-Demand	Mild	ADRB2	36	43
C=CCc1ccc(OC[C@@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389750	EG	On-Demand	Mild	ADRB1	34	43
C=CCc1ccc(OC[C@@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389750	EG	On-Demand	Mild	ADRB3	20	42
C=CCc1ccc(OC[C@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389752	EG	On-Demand	Mild	ADRB2	36	43
C=CCc1ccc(OC[C@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389752	EG	On-Demand	Mild	ADRB1	34	43
C=CCc1ccc(OC[C@H](O)CNc2ccc(OC)cc2)c(OC)c1	ZINC000819389752	EG	On-Demand	Mild	ADRB3	20	42
C=C(C)C(C)(C)C(=O)NCc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819389755	FI	On-Demand	Mild	FPR1	44	37
C=C(C)C(C)(C)C(=O)NCc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819389760	FI	On-Demand	Mild	FPR1	44	37
COc1cccc(OCCN2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c1	ZINC000819389762	FD	On-Demand	Anodyne	ESR1	30	40
COc1cccc(OCCN2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c1	ZINC000819389762	FD	On-Demand	Anodyne	HTR1A	18	42
COc1cccc(OCCN2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c1	ZINC000819389762	FD	On-Demand	Anodyne	DRD4	47	36
COc1cccc(OCCN2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c1	ZINC000819389762	FD	On-Demand	Anodyne	ESR2	22	40
COc1cccc(OCCN2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c1	ZINC000819389762	FD	On-Demand	Anodyne	LTA4H	25	44
COc1cccc(OCCN2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c1	ZINC000819389762	FD	On-Demand	Anodyne	HRH3	38	46
COc1cccc(OCCN2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c1	ZINC000819389762	FD	On-Demand	Anodyne	SIGMAR1	19	42
COc1cccc(OCCN2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c1	ZINC000819389762	FD	On-Demand	Anodyne	EPHX2	16	40
COc1cccc(OCCN2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c1	ZINC000819389762	FD	On-Demand	Anodyne	CHRNA10	28	41
COc1cccc(OCCN2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c1	ZINC000819389765	FD	On-Demand	Anodyne	ESR1	30	40
COc1cccc(OCCN2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c1	ZINC000819389765	FD	On-Demand	Anodyne	HTR1A	18	42
COc1cccc(OCCN2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c1	ZINC000819389765	FD	On-Demand	Anodyne	DRD4	47	36
COc1cccc(OCCN2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c1	ZINC000819389765	FD	On-Demand	Anodyne	ESR2	22	40
COc1cccc(OCCN2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c1	ZINC000819389765	FD	On-Demand	Anodyne	LTA4H	25	44
COc1cccc(OCCN2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c1	ZINC000819389765	FD	On-Demand	Anodyne	HRH3	38	46
COc1cccc(OCCN2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c1	ZINC000819389765	FD	On-Demand	Anodyne	SIGMAR1	19	42
COc1cccc(OCCN2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c1	ZINC000819389765	FD	On-Demand	Anodyne	EPHX2	16	40
COc1cccc(OCCN2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c1	ZINC000819389765	FD	On-Demand	Anodyne	CHRNA10	28	41
COc1cccc(OCCN2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c1	ZINC000819389767	FD	On-Demand	Anodyne	ESR1	30	40
COc1cccc(OCCN2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c1	ZINC000819389767	FD	On-Demand	Anodyne	HTR1A	18	42
COc1cccc(OCCN2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c1	ZINC000819389767	FD	On-Demand	Anodyne	DRD4	47	36
COc1cccc(OCCN2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c1	ZINC000819389767	FD	On-Demand	Anodyne	ESR2	22	40
COc1cccc(OCCN2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c1	ZINC000819389767	FD	On-Demand	Anodyne	LTA4H	25	44
COc1cccc(OCCN2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c1	ZINC000819389767	FD	On-Demand	Anodyne	HRH3	38	46
COc1cccc(OCCN2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c1	ZINC000819389767	FD	On-Demand	Anodyne	SIGMAR1	19	42
COc1cccc(OCCN2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c1	ZINC000819389767	FD	On-Demand	Anodyne	EPHX2	16	40
COc1cccc(OCCN2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c1	ZINC000819389767	FD	On-Demand	Anodyne	CHRNA10	28	41
COc1cccc(OCCN2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c1	ZINC000819389769	FD	On-Demand	Anodyne	ESR1	30	40
COc1cccc(OCCN2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c1	ZINC000819389769	FD	On-Demand	Anodyne	HTR1A	18	42
COc1cccc(OCCN2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c1	ZINC000819389769	FD	On-Demand	Anodyne	DRD4	47	36
COc1cccc(OCCN2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c1	ZINC000819389769	FD	On-Demand	Anodyne	ESR2	22	40
COc1cccc(OCCN2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c1	ZINC000819389769	FD	On-Demand	Anodyne	LTA4H	25	44
COc1cccc(OCCN2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c1	ZINC000819389769	FD	On-Demand	Anodyne	HRH3	38	46
COc1cccc(OCCN2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c1	ZINC000819389769	FD	On-Demand	Anodyne	SIGMAR1	19	42
COc1cccc(OCCN2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c1	ZINC000819389769	FD	On-Demand	Anodyne	EPHX2	16	40
COc1cccc(OCCN2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c1	ZINC000819389769	FD	On-Demand	Anodyne	CHRNA10	28	41
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2ccc(F)c(Cl)c2)cs1	ZINC000819389828	FI	On-Demand	Anodyne	MPL	43	41
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2ccc(F)c(Cl)c2)cs1	ZINC000819389829	FI	On-Demand	Anodyne	MPL	43	41
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2ccc(F)c(Cl)c2)cs1	ZINC000819389830	FI	On-Demand	Anodyne	MPL	43	41
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2ccc(F)c(Cl)c2)cs1	ZINC000819389831	FI	On-Demand	Anodyne	MPL	43	41
COC(=O)c1ccc(OCc2ccccc2)c(NC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819389834	GH	On-Demand	Anodyne	PPIA	31	41
COC(=O)c1ccc(OCc2ccccc2)c(NC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819389835	GH	On-Demand	Anodyne	PPIA	31	41
COC(=O)c1ccc(OCc2ccccc2)c(NC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819389836	GH	On-Demand	Anodyne	PPIA	31	41
COC(=O)c1ccc(OCc2ccccc2)c(NC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819389837	GH	On-Demand	Anodyne	PPIA	31	41
Cc1ccccc1[C@@H](O)CNC1CCN(CCN(C)C)CC1	ZINC000819389858	DD	On-Demand	Anodyne	CCR8	42	32
C#Cc1cccc(NC(=O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819389873	DH	On-Demand	Mild	KDR	16	41
C#Cc1cccc(NC(=O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819389873	DH	On-Demand	Mild	TEK	26	41
C#Cc1cccc(NC(=O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819389873	DH	On-Demand	Mild	MCHR1	16	42
C#Cc1cccc(NC(=O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819389873	DH	On-Demand	Mild	PDS	46	45
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)COC(C)C	ZINC000819389878	GG	On-Demand	Anodyne	CPT1A	46	32
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)COC(C)C	ZINC000819389878	GG	On-Demand	Anodyne	SMO	17	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)COC(C)C	ZINC000819389878	GG	On-Demand	Anodyne	KCNK3	76	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)COC(C)C	ZINC000819389878	GG	On-Demand	Anodyne	KCNK9	41	35
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)COC(C)C	ZINC000819389879	GG	On-Demand	Anodyne	CPT1A	46	32
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)COC(C)C	ZINC000819389879	GG	On-Demand	Anodyne	SMO	17	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)COC(C)C	ZINC000819389879	GG	On-Demand	Anodyne	KCNK3	76	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)COC(C)C	ZINC000819389879	GG	On-Demand	Anodyne	KCNK9	41	35
C[C@@H]1CCCC[C@H]1C(=O)NCCC(=O)OCc1ccccc1	ZINC000819389884	DG	On-Demand	Anodyne	CTSK	30	42
C[C@@H]1CCCC[C@H]1C(=O)NCCC(=O)OCc1ccccc1	ZINC000819389884	DG	On-Demand	Anodyne	CAPN2	52	34
C[C@@H]1CCCC[C@H]1C(=O)NCCC(=O)OCc1ccccc1	ZINC000819389884	DG	On-Demand	Anodyne	NPR	55	34
C[C@@H]1CCCC[C@H]1C(=O)NCCC(=O)OCc1ccccc1	ZINC000819389884	DG	On-Demand	Anodyne	SLC12A5	52	34
C[C@@H]1CCCC[C@@H]1C(=O)NCCC(=O)OCc1ccccc1	ZINC000819389887	DG	On-Demand	Anodyne	CTSK	30	42
C[C@@H]1CCCC[C@@H]1C(=O)NCCC(=O)OCc1ccccc1	ZINC000819389887	DG	On-Demand	Anodyne	CAPN2	52	34
C[C@@H]1CCCC[C@@H]1C(=O)NCCC(=O)OCc1ccccc1	ZINC000819389887	DG	On-Demand	Anodyne	NPR	55	34
C[C@@H]1CCCC[C@@H]1C(=O)NCCC(=O)OCc1ccccc1	ZINC000819389887	DG	On-Demand	Anodyne	SLC12A5	52	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F)C2	ZINC000819389914	GG	On-Demand	Anodyne	CMA1	41	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F)C2	ZINC000819389915	GG	On-Demand	Anodyne	CMA1	41	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(F)(F)F)C2	ZINC000819389916	GG	On-Demand	Anodyne	CMA1	41	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(F)(F)F)C2	ZINC000819389917	GG	On-Demand	Anodyne	CMA1	41	35
CCOc1ccc(OC[C@@H](O)CNc2cc(OC)c(OC)cc2C)cc1	ZINC000819389944	FG	On-Demand	Anodyne	ADRB2	35	43
CCOc1ccc(OC[C@@H](O)CNc2cc(OC)c(OC)cc2C)cc1	ZINC000819389944	FG	On-Demand	Anodyne	ADRB1	31	41
CCOc1ccc(OC[C@H](O)CNc2cc(OC)c(OC)cc2C)cc1	ZINC000819389945	FG	On-Demand	Anodyne	ADRB2	35	43
CCOc1ccc(OC[C@H](O)CNc2cc(OC)c(OC)cc2C)cc1	ZINC000819389945	FG	On-Demand	Anodyne	ADRB1	31	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)c2ccc(C)cc2)[C@H]1n1cccn1	ZINC000819390036	IG	On-Demand	Anodyne	AMP1_PLAFQ	29	46
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)c2ccc(C)cc2)[C@@H]1n1cccn1	ZINC000819390037	IG	On-Demand	Anodyne	AMP1_PLAFQ	29	46
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccc(C)cc2)[C@@H]1n1cccn1	ZINC000819390038	IG	On-Demand	Anodyne	AMP1_PLAFQ	29	46
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccc(C)cc2)[C@H]1n1cccn1	ZINC000819390039	IG	On-Demand	Anodyne	AMP1_PLAFQ	29	46
CCO[C@@H]1C[C@H](NC(=O)[C@]2(C)CCN(C(=O)OCc3ccccc3)C2)[C@H]1n1cccn1	ZINC000819390050	IF	On-Demand	Anodyne	SLC12A5	58	33
CCO[C@@H]1C[C@H](NC(=O)[C@]2(C)CCN(C(=O)OCc3ccccc3)C2)[C@@H]1n1cccn1	ZINC000819390051	IF	On-Demand	Anodyne	SLC12A5	58	33
CCO[C@@H]1C[C@H](NC(=O)[C@@]2(C)CCN(C(=O)OCc3ccccc3)C2)[C@@H]1n1cccn1	ZINC000819390052	IF	On-Demand	Anodyne	SLC12A5	58	33
CCO[C@@H]1C[C@H](NC(=O)[C@@]2(C)CCN(C(=O)OCc3ccccc3)C2)[C@H]1n1cccn1	ZINC000819390053	IF	On-Demand	Anodyne	SLC12A5	58	33
Cc1ccc(NC[C@@H](O)CCNC(=O)OC(C)(C)C)cc1	ZINC000819390087	CF	On-Demand	Anodyne	PTPRB	26	41
Cc1ccc(NC[C@H](O)CCNC(=O)OC(C)(C)C)cc1	ZINC000819390088	CF	On-Demand	Anodyne	PTPRB	26	41
C#Cc1cccc(NC(=O)c2ccc(OCC(=O)Nc3ccc(Br)cc3)c(OC)c2)c1	ZINC000819390098	JJ	On-Demand	Mild	ADORA2B	15	46
C#Cc1cccc(NC(=O)c2ccc(OCC(=O)Nc3ccc(Br)cc3)c(OC)c2)c1	ZINC000819390098	JJ	On-Demand	Mild	CPT1A	56	37
C#Cc1cccc(NC(=O)c2ccc(OCC(=O)Nc3ccc(Br)cc3)c(OC)c2)c1	ZINC000819390098	JJ	On-Demand	Mild	CPT1B	40	37
C#Cc1cccc(NC(=O)c2ccc(OCC(=O)Nc3ccc(Br)cc3)c(OC)c2)c1	ZINC000819390098	JJ	On-Demand	Mild	TAAR1	48	40
C#Cc1cccc(NC(=O)c2ccc(OCC(=O)Nc3ccc(Br)cc3)c(OC)c2)c1	ZINC000819390098	JJ	On-Demand	Mild	ENPP1	71	37
C#Cc1cccc(NC(=O)c2ccc(OCC(=O)Nc3ccc(Br)cc3)c(OC)c2)c1	ZINC000819390098	JJ	On-Demand	Mild	KCNK3	93	38
C#Cc1cccc(NC(=O)c2ccc(OCC(=O)Nc3ccc(Br)cc3)c(OC)c2)c1	ZINC000819390098	JJ	On-Demand	Mild	KCNK9	69	37
Cc1ccc(NCCS(=O)(=O)CC(=O)OC(C)(C)C)cc1	ZINC000819390113	DE	On-Demand	Anodyne	PTPRB	50	37
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc(F)c1	ZINC000819390116	CF	On-Demand	Anodyne	PAPA1_CARPA	29	44
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc(F)c1	ZINC000819390117	CF	On-Demand	Anodyne	PAPA1_CARPA	29	44
Cc1ccccc1CC(=O)NNC(=O)[C@@H]1CCCC[C@@H]1C	ZINC000819390166	CF	On-Demand	Reactive	P2RX7	17	45
Cc1ccccc1CC(=O)NNC(=O)[C@H]1CCCC[C@H]1C	ZINC000819390167	CF	On-Demand	Reactive	P2RX7	17	45
Cc1ccccc1CC(=O)NNC(=O)[C@@H]1CCCC[C@H]1C	ZINC000819390168	CF	On-Demand	Reactive	P2RX7	17	45
Cc1ccccc1CC(=O)NNC(=O)[C@H]1CCCC[C@@H]1C	ZINC000819390169	CF	On-Demand	Reactive	P2RX7	17	45
CCNS(=O)(=O)c1ccc(CNC(=O)C(F)=C2CCC2)cc1	ZINC000819390176	EE	On-Demand	Anodyne	CA2	17	40
CCNS(=O)(=O)c1ccc(CNC(=O)C(F)=C2CCC2)cc1	ZINC000819390176	EE	On-Demand	Anodyne	CA1	18	40
Cc1ccc2c(c1)[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CO2	ZINC000819390196	FG	On-Demand	Mild	PAPA1_CARPA	38	40
Cc1ccc2c(c1)[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CO2	ZINC000819390197	FG	On-Demand	Mild	PAPA1_CARPA	38	40
Cc1ccc2c(c1)[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CO2	ZINC000819390198	FG	On-Demand	Mild	PAPA1_CARPA	38	40
Cc1ccc2c(c1)[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CO2	ZINC000819390199	FG	On-Demand	Mild	PAPA1_CARPA	38	40
Cc1ccccc1CC(=O)NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819390200	GE	On-Demand	Reactive	PAPA1_CARPA	62	48
Cc1ccccc1CC(=O)NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819390200	GE	On-Demand	Reactive	CCKAR	42	37
Cc1ccccc1CC(=O)NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819390200	GE	On-Demand	Reactive	CTSK	23	43
Cc1ccccc1CC(=O)NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819390200	GE	On-Demand	Reactive	CTSL	20	48
Cc1ccccc1CC(=O)NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819390200	GE	On-Demand	Reactive	CTSS	15	48
Cc1ccccc1CC(=O)NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819390200	GE	On-Demand	Reactive	FPR1	46	40
Cc1ccccc1CC(=O)NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819390201	GE	On-Demand	Reactive	PAPA1_CARPA	62	48
Cc1ccccc1CC(=O)NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819390201	GE	On-Demand	Reactive	CCKAR	42	37
Cc1ccccc1CC(=O)NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819390201	GE	On-Demand	Reactive	CTSK	23	43
Cc1ccccc1CC(=O)NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819390201	GE	On-Demand	Reactive	CTSL	20	48
Cc1ccccc1CC(=O)NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819390201	GE	On-Demand	Reactive	CTSS	15	48
Cc1ccccc1CC(=O)NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819390201	GE	On-Demand	Reactive	FPR1	46	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCC1	ZINC000819390244	FH	On-Demand	Anodyne	DRD3	19	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCC1	ZINC000819390244	FH	On-Demand	Anodyne	KCNA3	42	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCC1	ZINC000819390244	FH	On-Demand	Anodyne	CPT1A	48	33
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCC1	ZINC000819390244	FH	On-Demand	Anodyne	HDAC1	19	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCC1	ZINC000819390244	FH	On-Demand	Anodyne	HDAC2	25	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCC1	ZINC000819390244	FH	On-Demand	Anodyne	SMO	18	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCC1	ZINC000819390244	FH	On-Demand	Anodyne	HCN1	43	35
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCC1	ZINC000819390244	FH	On-Demand	Anodyne	HCN4	40	34
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCC1	ZINC000819390244	FH	On-Demand	Anodyne	GPR35	45	35
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCC1	ZINC000819390244	FH	On-Demand	Anodyne	KCNK3	82	44
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCCC1	ZINC000819390244	FH	On-Demand	Anodyne	KCNK9	46	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccncn1	ZINC000819390259	FE	On-Demand	Anodyne	CTSD	70	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccncn1	ZINC000819390259	FE	On-Demand	Anodyne	PGC	56	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccncn1	ZINC000819390259	FE	On-Demand	Anodyne	PAPA1_CARPA	31	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccncn1	ZINC000819390259	FE	On-Demand	Anodyne	BACE2	35	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccncn1	ZINC000819390259	FE	On-Demand	Anodyne	TACR3	15	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccncn1	ZINC000819390259	FE	On-Demand	Anodyne	REN	83	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccncn1	ZINC000819390259	FE	On-Demand	Anodyne	REN1	26	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccncn1	ZINC000819390259	FE	On-Demand	Anodyne	BACE1	72	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccncn1	ZINC000819390259	FE	On-Demand	Anodyne	FPR1	47	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNCc1ccncn1	ZINC000819390259	FE	On-Demand	Anodyne	PLM2_PLAFA	40	34
COC[C@@H](O)CNc1cc(OC)c(NC(=O)c2ccccc2)cc1OC	ZINC000819390294	FE	On-Demand	Anodyne	CPT1A	45	32
COC[C@@H](O)CNc1cc(OC)c(NC(=O)c2ccccc2)cc1OC	ZINC000819390294	FE	On-Demand	Anodyne	HDAC2	20	41
COC[C@@H](O)CNc1cc(OC)c(NC(=O)c2ccccc2)cc1OC	ZINC000819390294	FE	On-Demand	Anodyne	ITGAV	19	40
COC[C@@H](O)CNc1cc(OC)c(NC(=O)c2ccccc2)cc1OC	ZINC000819390294	FE	On-Demand	Anodyne	SMO	18	41
COC[C@@H](O)CNc1cc(OC)c(NC(=O)c2ccccc2)cc1OC	ZINC000819390294	FE	On-Demand	Anodyne	KCNK3	69	43
C#Cc1cccc(NC(=O)c2ccc(N(CC)CC)cc2)c1	ZINC000819390298	CH	On-Demand	Mild	PRNP	52	42
C#Cc1cccc(NC(=O)c2ccc(N(CC)CC)cc2)c1	ZINC000819390298	CH	On-Demand	Mild	ESRRG	21	42
C#Cc1cccc(NC(=O)c2ccc(N(CC)CC)cc2)c1	ZINC000819390298	CH	On-Demand	Mild	TAAR1	49	38
C#Cc1cccc(NC(=O)c2ccc(N(CC)CC)cc2)c1	ZINC000819390298	CH	On-Demand	Mild	KCNK3	116	50
C#Cc1cccc(NC(=O)c2ccc(N(CC)CC)cc2)c1	ZINC000819390298	CH	On-Demand	Mild	KCNK9	69	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C1CCCCC1	ZINC000819390322	GI	On-Demand	Anodyne	DRD4	15	44
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C1CCCCC1	ZINC000819390322	GI	On-Demand	Anodyne	DRD3	18	44
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C1CCCCC1	ZINC000819390322	GI	On-Demand	Anodyne	CPT1A	45	32
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C1CCCCC1	ZINC000819390322	GI	On-Demand	Anodyne	AMY2	44	31
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C1CCCCC1	ZINC000819390322	GI	On-Demand	Anodyne	CCR8	50	47
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C1CCCCC1	ZINC000819390322	GI	On-Demand	Anodyne	SMO	15	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C1CCCCC1	ZINC000819390322	GI	On-Demand	Anodyne	KCNK3	73	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C1CCCCC1	ZINC000819390322	GI	On-Demand	Anodyne	KCNK9	40	35
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C1CCCCC1	ZINC000819390323	GI	On-Demand	Anodyne	DRD4	15	44
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C1CCCCC1	ZINC000819390323	GI	On-Demand	Anodyne	DRD3	18	44
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C1CCCCC1	ZINC000819390323	GI	On-Demand	Anodyne	CPT1A	45	32
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C1CCCCC1	ZINC000819390323	GI	On-Demand	Anodyne	AMY2	44	31
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C1CCCCC1	ZINC000819390323	GI	On-Demand	Anodyne	CCR8	50	47
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C1CCCCC1	ZINC000819390323	GI	On-Demand	Anodyne	SMO	15	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C1CCCCC1	ZINC000819390323	GI	On-Demand	Anodyne	KCNK3	73	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C1CCCCC1	ZINC000819390323	GI	On-Demand	Anodyne	KCNK9	40	35
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CC(F)(F)F	ZINC000819390358	GH	On-Demand	Anodyne	KCNJ11	44	36
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CC(F)(F)F	ZINC000819390358	GH	On-Demand	Anodyne	CPT1A	44	30
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CC(F)(F)F	ZINC000819390358	GH	On-Demand	Anodyne	KCNK3	70	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)CC(F)(F)F	ZINC000819390358	GH	On-Demand	Anodyne	KCNK9	40	34
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CC(F)(F)F	ZINC000819390360	GH	On-Demand	Anodyne	KCNJ11	44	36
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CC(F)(F)F	ZINC000819390360	GH	On-Demand	Anodyne	CPT1A	44	30
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CC(F)(F)F	ZINC000819390360	GH	On-Demand	Anodyne	KCNK3	70	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)CC(F)(F)F	ZINC000819390360	GH	On-Demand	Anodyne	KCNK9	40	34
CCO[C@@H]1C[C@H](NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)[C@@H]1n1cccn1	ZINC000819390363	IF	On-Demand	Anodyne	GRIN2B	23	48
CCO[C@@H]1C[C@H](NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)[C@@H]1n1cccn1	ZINC000819390363	IF	On-Demand	Anodyne	SLC12A5	41	32
C#Cc1cccc(NC(=O)c2c3c(nc4ccccc24)CCN(C)C3)c1	ZINC000819390365	EG	On-Demand	Mild	BCHE	51	37
C#Cc1cccc(NC(=O)c2c3c(nc4ccccc24)CCN(C)C3)c1	ZINC000819390365	EG	On-Demand	Mild	P2RY14	46	33
C#Cc1cccc(NC(=O)c2c3c(nc4ccccc24)CCN(C)C3)c1	ZINC000819390365	EG	On-Demand	Mild	KCNK3	41	32
CCO[C@@H]1C[C@@H](NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)[C@H]1n1cccn1	ZINC000819390366	IF	On-Demand	Anodyne	GRIN2B	23	48
CCO[C@@H]1C[C@@H](NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)[C@H]1n1cccn1	ZINC000819390366	IF	On-Demand	Anodyne	SLC12A5	41	32
CCO[C@@H]1C[C@@H](NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)[C@@H]1n1cccn1	ZINC000819390368	IF	On-Demand	Anodyne	GRIN2B	23	48
CCO[C@@H]1C[C@@H](NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)[C@@H]1n1cccn1	ZINC000819390368	IF	On-Demand	Anodyne	SLC12A5	41	32
CCO[C@@H]1C[C@H](NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)[C@H]1n1cccn1	ZINC000819390369	IF	On-Demand	Anodyne	GRIN2B	23	48
CCO[C@@H]1C[C@H](NC(=O)C2CCN(C(=O)OCc3ccccc3)CC2)[C@H]1n1cccn1	ZINC000819390369	IF	On-Demand	Anodyne	SLC12A5	41	32
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C(F)(F)F	ZINC000819390374	GG	On-Demand	Anodyne	KCNJ11	57	37
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C(F)(F)F	ZINC000819390374	GG	On-Demand	Anodyne	ECR	51	44
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C(F)(F)F	ZINC000819390374	GG	On-Demand	Anodyne	CPT1A	47	33
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C(F)(F)F	ZINC000819390374	GG	On-Demand	Anodyne	NR1H4	17	44
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C(F)(F)F	ZINC000819390374	GG	On-Demand	Anodyne	HDAC1	20	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C(F)(F)F	ZINC000819390374	GG	On-Demand	Anodyne	HDAC2	22	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C(F)(F)F	ZINC000819390374	GG	On-Demand	Anodyne	MTTP	38	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C(F)(F)F	ZINC000819390374	GG	On-Demand	Anodyne	CCR8	20	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C(F)(F)F	ZINC000819390374	GG	On-Demand	Anodyne	KCNK3	84	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C(F)(F)F	ZINC000819390374	GG	On-Demand	Anodyne	KCNK9	54	35
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C(F)(F)F	ZINC000819390376	GG	On-Demand	Anodyne	KCNJ11	57	37
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C(F)(F)F	ZINC000819390376	GG	On-Demand	Anodyne	ECR	51	44
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C(F)(F)F	ZINC000819390376	GG	On-Demand	Anodyne	CPT1A	47	33
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C(F)(F)F	ZINC000819390376	GG	On-Demand	Anodyne	NR1H4	17	44
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C(F)(F)F	ZINC000819390376	GG	On-Demand	Anodyne	HDAC1	20	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C(F)(F)F	ZINC000819390376	GG	On-Demand	Anodyne	HDAC2	22	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C(F)(F)F	ZINC000819390376	GG	On-Demand	Anodyne	MTTP	38	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C(F)(F)F	ZINC000819390376	GG	On-Demand	Anodyne	CCR8	20	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C(F)(F)F	ZINC000819390376	GG	On-Demand	Anodyne	KCNK3	84	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C(F)(F)F	ZINC000819390376	GG	On-Demand	Anodyne	KCNK9	54	35
O=C(/C=C/[C@H]1CCCO1)N1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819390415	GF	On-Demand	Anodyne	SIGMAR1	16	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819390416	GH	On-Demand	Anodyne	DRD2	15	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819390416	GH	On-Demand	Anodyne	DRD4	17	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819390416	GH	On-Demand	Anodyne	DRD3	22	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819390416	GH	On-Demand	Anodyne	KCNJ11	110	45
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819390416	GH	On-Demand	Anodyne	CPT1A	48	33
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819390416	GH	On-Demand	Anodyne	NR1H4	15	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819390416	GH	On-Demand	Anodyne	HDAC1	20	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819390416	GH	On-Demand	Anodyne	HDAC2	24	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819390416	GH	On-Demand	Anodyne	SMO	22	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819390416	GH	On-Demand	Anodyne	KCNK3	83	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819390416	GH	On-Demand	Anodyne	KCNK9	54	36
O=C(/C=C/[C@@H]1CCCO1)N1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819390417	GF	On-Demand	Anodyne	SIGMAR1	16	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819390418	GH	On-Demand	Anodyne	DRD2	15	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819390418	GH	On-Demand	Anodyne	DRD4	17	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819390418	GH	On-Demand	Anodyne	DRD3	22	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819390418	GH	On-Demand	Anodyne	KCNJ11	110	45
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819390418	GH	On-Demand	Anodyne	CPT1A	48	33
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819390418	GH	On-Demand	Anodyne	NR1H4	15	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819390418	GH	On-Demand	Anodyne	HDAC1	20	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819390418	GH	On-Demand	Anodyne	HDAC2	24	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819390418	GH	On-Demand	Anodyne	SMO	22	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819390418	GH	On-Demand	Anodyne	KCNK3	83	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819390418	GH	On-Demand	Anodyne	KCNK9	54	36
O=C(/C=C\[C@@H]1CCCO1)N1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819390420	GF	On-Demand	Anodyne	SIGMAR1	16	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819390421	GF	On-Demand	Anodyne	SIGMAR1	16	42
C#Cc1cccc(NC(=O)c2csc3c2CC[C@@H](C)C3)c1	ZINC000819390455	CI	On-Demand	Mild	KCNK3	94	34
C#Cc1cccc(NC(=O)c2csc3c2CC[C@@H](C)C3)c1	ZINC000819390455	CI	On-Demand	Mild	KCNK9	70	33
C#Cc1cccc(NC(=O)c2csc3c2CC[C@H](C)C3)c1	ZINC000819390459	CI	On-Demand	Mild	KCNK3	94	34
C#Cc1cccc(NC(=O)c2csc3c2CC[C@H](C)C3)c1	ZINC000819390459	CI	On-Demand	Mild	KCNK9	70	33
COc1cc(NC[C@@H](O)Cc2cccc(Cl)c2)cc(OC)c1OC	ZINC000819390479	FG	On-Demand	Anodyne	ADRB3	19	44
COc1cc(NC[C@H](O)Cc2cccc(Cl)c2)cc(OC)c1OC	ZINC000819390481	FG	On-Demand	Anodyne	ADRB3	19	44
CCO[C@@H]1C[C@H](NC(=O)CCSc2nc3ccccc3s2)[C@@H]1n1cccn1	ZINC000819390506	HH	On-Demand	Anodyne	HMOX2	31	40
C[C@@H](CNC[C@@H](O)c1cccnc1)N(C)C	ZINC000819390512	BC	On-Demand	Anodyne	ADRB2	26	46
C[C@@H](CNC[C@@H](O)c1cccnc1)N(C)C	ZINC000819390512	BC	On-Demand	Anodyne	ADRB1	26	46
C[C@@H](CNC[C@@H](O)c1cccnc1)N(C)C	ZINC000819390512	BC	On-Demand	Anodyne	ADRB3	96	51
C[C@@H](CNC[C@@H](O)c1cccnc1)N(C)C	ZINC000819390512	BC	On-Demand	Anodyne	KCNA5	23	42
C[C@@H](CNC[C@@H](O)c1cccnc1)N(C)C	ZINC000819390512	BC	On-Demand	Anodyne	CYP51A1	17	40
O=C(NC[C@@H](O)COc1ccccc1Br)C(F)=C1CCC1	ZINC000819390521	FF	On-Demand	Anodyne	ADRB2	23	42
O=C(NC[C@@H](O)COc1ccccc1Br)C(F)=C1CCC1	ZINC000819390521	FF	On-Demand	Anodyne	ADRB1	61	35
O=C(NC[C@H](O)COc1ccccc1Br)C(F)=C1CCC1	ZINC000819390523	FF	On-Demand	Anodyne	ADRB2	23	42
O=C(NC[C@H](O)COc1ccccc1Br)C(F)=C1CCC1	ZINC000819390523	FF	On-Demand	Anodyne	ADRB1	61	35
O=C(O)CCCCCNC(=O)Cc1cc2ccccc2o1	ZINC000819390528	CF	On-Demand	Anodyne	TBXA2R	20	40
O=C(O)CCCCCNC(=O)Cc1cc2ccccc2o1	ZINC000819390528	CF	On-Demand	Anodyne	MTNR1A	15	42
O=C(O)CCCCCNC(=O)Cc1cc2ccccc2o1	ZINC000819390528	CF	On-Demand	Anodyne	MTNR1B	15	42
O=C(O)CCCCCNC(=O)Cc1cc2ccccc2o1	ZINC000819390528	CF	On-Demand	Anodyne	HDAC1	16	40
O=C(O)CCCCCNC(=O)Cc1cc(Br)ccc1F	ZINC000819390538	EF	On-Demand	Anodyne	HDAC2	17	42
O=C(O)CCCCCNC(=O)Cc1cc(Br)ccc1F	ZINC000819390538	EF	On-Demand	Anodyne	HDAC3	18	42
O=C(O)CCCCCNC(=O)Cc1cc(Br)ccc1F	ZINC000819390538	EF	On-Demand	Anodyne	HDAC5	16	42
O=C(O)CCCCCNC(=O)Cc1cc(Br)ccc1F	ZINC000819390538	EF	On-Demand	Anodyne	HDAC6	15	42
O=C(O)CCCCCNC(=O)Cc1cc(Br)ccc1F	ZINC000819390538	EF	On-Demand	Anodyne	HDAC9	42	42
O=C(O)CCCCCNC(=O)Cc1cc(Br)ccc1F	ZINC000819390538	EF	On-Demand	Anodyne	HDAC7	30	40
O=C(O)CCCCCNC(=O)/C=C\c1ccc(I)o1	ZINC000819390545	GF	On-Demand	Anodyne	HDAC9	36	40
O=C(O)CCCCCNC(=O)/C=C\c1ccc(I)o1	ZINC000819390545	GF	On-Demand	Anodyne	HDAC7	34	40
C=CCC1(C(=O)NCCC(=O)OCc2ccccc2)CCOCC1	ZINC000819390548	EF	On-Demand	Mild	MME	18	44
CC(C)c1nn(-c2ccccc2)cc1C(=O)NCCC(=O)OCc1ccccc1	ZINC000819390550	GH	On-Demand	Anodyne	CAPNS1	42	32
CC(C)c1nn(-c2ccccc2)cc1C(=O)NCCC(=O)OCc1ccccc1	ZINC000819390550	GH	On-Demand	Anodyne	CAPN1	44	35
CC(C)c1nn(-c2ccccc2)cc1C(=O)NCCC(=O)OCc1ccccc1	ZINC000819390550	GH	On-Demand	Anodyne	CAPN2	74	32
CC(C)c1nn(-c2ccccc2)cc1C(=O)NCCC(=O)OCc1ccccc1	ZINC000819390550	GH	On-Demand	Anodyne	NPR	68	38
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(Br)cc1	ZINC000819390560	FG	On-Demand	Anodyne	PAPA1_CARPA	28	42
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(Br)cc1	ZINC000819390562	FG	On-Demand	Anodyne	PAPA1_CARPA	28	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCC1	ZINC000819390563	FG	On-Demand	Anodyne	DRD3	19	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCC1	ZINC000819390563	FG	On-Demand	Anodyne	KCNA3	42	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCC1	ZINC000819390563	FG	On-Demand	Anodyne	CPT1A	48	33
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCC1	ZINC000819390563	FG	On-Demand	Anodyne	HDAC1	20	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCC1	ZINC000819390563	FG	On-Demand	Anodyne	HDAC2	26	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCC1	ZINC000819390563	FG	On-Demand	Anodyne	SMO	18	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCC1	ZINC000819390563	FG	On-Demand	Anodyne	GPR35	45	35
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCC1	ZINC000819390563	FG	On-Demand	Anodyne	KCNK3	82	44
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC1(O)CCC1	ZINC000819390563	FG	On-Demand	Anodyne	KCNK9	46	37
O=C(O)CCCCCNC(=O)Cc1c[nH]c2cc(Br)ccc12	ZINC000819390569	FG	On-Demand	Anodyne	ACHE	32	46
O=C(O)CCCCCNC(=O)Cc1c[nH]c2cc(Br)ccc12	ZINC000819390569	FG	On-Demand	Anodyne	GRIN1	17	40
O=C(O)CCCCCNC(=O)Cc1c[nH]c2cc(Br)ccc12	ZINC000819390569	FG	On-Demand	Anodyne	TPR	23	65
O=C(O)CCCCCNC(=O)Cc1c[nH]c2cc(Br)ccc12	ZINC000819390569	FG	On-Demand	Anodyne	GRIA1	29	43
O=C(O)CCCCCNC(=O)Cc1c[nH]c2cc(Br)ccc12	ZINC000819390569	FG	On-Demand	Anodyne	KISS1R	52	31
O=C(O)CCCCCNC(=O)[C@@H]1CC12CCC2	ZINC000819390574	BD	On-Demand	Anodyne	EPHX2	15	48
O=C(O)CCCCCNC(=O)[C@H]1CC12CCC2	ZINC000819390576	BD	On-Demand	Anodyne	EPHX2	15	48
O=C(O)CCCCCNC(=O)N1CC(Cc2ccccc2)C1	ZINC000819390578	DF	On-Demand	Anodyne	GRIN2B	44	34
O=C(O)CCCCCNC(=O)N1CC(Cc2ccccc2)C1	ZINC000819390578	DF	On-Demand	Anodyne	CCR3	26	47
CCO[C@@H]1C[C@H](NC(=O)CCSc2nc3ccccc3s2)[C@H]1n1cccn1	ZINC000819390596	HH	On-Demand	Anodyne	HMOX2	31	40
CCO[C@@H]1C[C@@H](NC(=O)CCSc2nc3ccccc3s2)[C@H]1n1cccn1	ZINC000819390600	HH	On-Demand	Anodyne	HMOX2	31	40
O=C(O)CCCCCNC(=O)N1CCC(C(=O)Nc2ccccc2O)CC1	ZINC000819390601	GE	On-Demand	Anodyne	EPHX2	25	44
CCO[C@@H]1C[C@@H](NC(=O)CCSc2nc3ccccc3s2)[C@@H]1n1cccn1	ZINC000819390605	HH	On-Demand	Anodyne	HMOX2	31	40
O=C(O)CCCCCNC(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000819390609	EG	On-Demand	Anodyne	ADRA1D	16	43
O=C(O)CCCCCNC(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000819390609	EG	On-Demand	Anodyne	ADRA1A	26	43
O=C(O)CCCCCNC(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000819390609	EG	On-Demand	Anodyne	ADRA1B	18	43
O=C(O)CCCCCNC(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000819390609	EG	On-Demand	Anodyne	CCR1	27	43
O=C(O)CCCCCNC(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000819390609	EG	On-Demand	Anodyne	EPHX2	23	46
O=C(O)CCCCCNC(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000819390609	EG	On-Demand	Anodyne	ASAH1	55	35
O=C(O)CCCCCNC(=O)CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2	ZINC000819390611	DE	On-Demand	Anodyne	EPHX2	32	56
O=C(O)CCCCCNC(=O)C12C[C@H]3C[C@@H](CC(F)(C3)C1)C2	ZINC000819390618	DG	On-Demand	Anodyne	EPHX2	28	52
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819390627	ID	On-Demand	Anodyne	Q9NAW4_PLAFA	43	51
O=C(O)CCCCCNC(=O)N1CCC(c2cccc(F)c2)CC1	ZINC000819390628	EG	On-Demand	Anodyne	CCR5	50	32
O=C(O)CCCCCNC(=O)N1CCC(c2cccc(F)c2)CC1	ZINC000819390628	EG	On-Demand	Anodyne	MCHR1	18	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819390629	ID	On-Demand	Anodyne	Q9NAW4_PLAFA	43	51
O=C(O)CCCCCNC(=O)C(=O)Nc1cccc2ccncc12	ZINC000819390630	ED	On-Demand	Anodyne	TBXAS1	62	40
O=C(O)CCCCCNC(=O)C(=O)Nc1cccc2ccncc12	ZINC000819390630	ED	On-Demand	Anodyne	TRPV1	24	47
O=C(O)CCCCCNC(=O)C(=O)Nc1cccc2ccncc12	ZINC000819390630	ED	On-Demand	Anodyne	CDK5	26	41
O=C(O)CCCCCNC(=O)Cn1c(S)nc2ccccc2c1=O	ZINC000819390631	ED	On-Demand	Anodyne	BCHE	47	34
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819390632	ID	On-Demand	Anodyne	Q9NAW4_PLAFA	43	51
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819390633	ID	On-Demand	Anodyne	Q9NAW4_PLAFA	43	51
O=C(NCC(=O)N1CC2(CCOC2)C1)Nc1ccccc1	ZINC000819390665	CD	On-Demand	Anodyne	EPHX2	27	41
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2ccc(O)cc2)cs1	ZINC000819390687	DG	On-Demand	Anodyne	ROCK1	18	41
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2ccc(O)cc2)cs1	ZINC000819390687	DG	On-Demand	Anodyne	VCP	17	41
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2ccc(O)cc2)cs1	ZINC000819390688	DG	On-Demand	Anodyne	ROCK1	18	41
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2ccc(O)cc2)cs1	ZINC000819390688	DG	On-Demand	Anodyne	VCP	17	41
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2ccc(O)cc2)cs1	ZINC000819390689	DG	On-Demand	Anodyne	ROCK1	18	41
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2ccc(O)cc2)cs1	ZINC000819390689	DG	On-Demand	Anodyne	VCP	17	41
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2ccc(O)cc2)cs1	ZINC000819390690	DG	On-Demand	Anodyne	ROCK1	18	41
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2ccc(O)cc2)cs1	ZINC000819390690	DG	On-Demand	Anodyne	VCP	17	41
O=C(O)CCCCCNC(=O)N1CCC(NC(=O)C2CC2)CC1	ZINC000819390695	ED	On-Demand	Anodyne	EPHX2	27	45
O=C(O)CCCCCNC(=O)[C@H]1CCCCN1C(=O)c1ccc(O)nn1	ZINC000819390700	FC	On-Demand	Anodyne	FKBP1A	18	40
O=C(O)CCCCCNC(=O)[C@H]1CCCCN1C(=O)c1ccc(O)nn1	ZINC000819390700	FC	On-Demand	Anodyne	NTSR1	44	33
O=C(O)CCCCCNC(=O)[C@H]1CCCCN1C(=O)c1ccc(O)nn1	ZINC000819390700	FC	On-Demand	Anodyne	NTSR2	41	30
O=C(O)CCCCCNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1	ZINC000819390702	FC	On-Demand	Anodyne	FKBP1A	18	40
O=C(O)CCCCCNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1	ZINC000819390702	FC	On-Demand	Anodyne	NTSR1	44	33
O=C(O)CCCCCNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1	ZINC000819390702	FC	On-Demand	Anodyne	NTSR2	41	30
O=C(O)CCCCCNC(=O)N1CCC(c2cc3ccccc3[nH]2)CC1	ZINC000819390704	FH	On-Demand	Anodyne	CYP51A1	21	41
O=C(/C=C/[C@@H]1CCCO1)Nc1nc(-c2ccccc2F)cs1	ZINC000819390706	DH	On-Demand	Anodyne	MPL	59	38
O=C(/C=C\[C@H]1CCCO1)Nc1nc(-c2ccccc2F)cs1	ZINC000819390709	DH	On-Demand	Anodyne	MPL	59	38
O=C(/C=C\[C@@H]1CCCO1)Nc1nc(-c2ccccc2F)cs1	ZINC000819390713	DH	On-Demand	Anodyne	MPL	59	38
O=C(/C=C/[C@H]1CCCO1)Nc1nc(-c2ccccc2F)cs1	ZINC000819390716	DH	On-Demand	Anodyne	MPL	59	38
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC(C)(C)O	ZINC000819390732	EG	On-Demand	Anodyne	DRD2	25	45
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC(C)(C)O	ZINC000819390732	EG	On-Demand	Anodyne	DRD4	22	45
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC(C)(C)O	ZINC000819390732	EG	On-Demand	Anodyne	DRD3	32	45
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC(C)(C)O	ZINC000819390732	EG	On-Demand	Anodyne	KCNJ11	57	38
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC(C)(C)O	ZINC000819390732	EG	On-Demand	Anodyne	ECR	35	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC(C)(C)O	ZINC000819390732	EG	On-Demand	Anodyne	CPT1A	50	35
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC(C)(C)O	ZINC000819390732	EG	On-Demand	Anodyne	PYGL	17	40
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC(C)(C)O	ZINC000819390732	EG	On-Demand	Anodyne	ABCB1B	24	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC(C)(C)O	ZINC000819390732	EG	On-Demand	Anodyne	NR1H4	18	45
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC(C)(C)O	ZINC000819390732	EG	On-Demand	Anodyne	HDAC1	43	46
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC(C)(C)O	ZINC000819390732	EG	On-Demand	Anodyne	HDAC2	38	46
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC(C)(C)O	ZINC000819390732	EG	On-Demand	Anodyne	ABCB1	22	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC(C)(C)O	ZINC000819390732	EG	On-Demand	Anodyne	CCR8	37	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC(C)(C)O	ZINC000819390732	EG	On-Demand	Anodyne	ABCG2	47	37
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC(C)(C)O	ZINC000819390732	EG	On-Demand	Anodyne	SMO	29	44
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC(C)(C)O	ZINC000819390732	EG	On-Demand	Anodyne	GPR35	50	36
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC(C)(C)O	ZINC000819390732	EG	On-Demand	Anodyne	KCNK3	86	46
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NCC(C)(C)O	ZINC000819390732	EG	On-Demand	Anodyne	KCNK9	52	38
O=C(O)CCCCCNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819390768	ED	On-Demand	Anodyne	TBXA2R	48	43
O=C(O)CCCCCNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819390768	ED	On-Demand	Anodyne	TBXAS1	109	44
O=C(O)CCCCCNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819390768	ED	On-Demand	Anodyne	L3MBTL3	49	36
O=C(O)CCCCCNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819390768	ED	On-Demand	Anodyne	NAMPT	24	54
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819390782	GI	On-Demand	Anodyne	TSHR	40	29
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819390782	GI	On-Demand	Anodyne	OPRK1	30	44
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819390782	GI	On-Demand	Anodyne	CPT1A	25	43
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819390782	GI	On-Demand	Anodyne	Q8WSF8_APLCA	21	42
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000819390785	GI	On-Demand	Anodyne	TSHR	40	29
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000819390785	GI	On-Demand	Anodyne	OPRK1	30	44
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000819390785	GI	On-Demand	Anodyne	CPT1A	25	43
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@H]2C[C@H](O)c2ccccc2)c1	ZINC000819390785	GI	On-Demand	Anodyne	Q8WSF8_APLCA	21	42
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000819390787	GI	On-Demand	Anodyne	TSHR	40	29
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000819390787	GI	On-Demand	Anodyne	OPRK1	30	44
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000819390787	GI	On-Demand	Anodyne	CPT1A	25	43
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@@H]2C[C@H](O)c2ccccc2)c1	ZINC000819390787	GI	On-Demand	Anodyne	Q8WSF8_APLCA	21	42
C/C=C/c1ccc(OC[C@H](O)CNc2cc(OC)c(OC)cc2C)c(OC)c1	ZINC000819390792	GH	On-Demand	Anodyne	ADRB2	16	69
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819390793	GI	On-Demand	Anodyne	TSHR	40	29
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819390793	GI	On-Demand	Anodyne	OPRK1	30	44
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819390793	GI	On-Demand	Anodyne	CPT1A	25	43
CC(=O)Nc1cccc(CC(=O)N2CCCCC[C@H]2C[C@@H](O)c2ccccc2)c1	ZINC000819390793	GI	On-Demand	Anodyne	Q8WSF8_APLCA	21	42
C/C=C\c1ccc(OC[C@H](O)CNc2cc(OC)c(OC)cc2C)c(OC)c1	ZINC000819390800	GH	On-Demand	Anodyne	ADRB2	16	69
C/C=C/c1ccc(OC[C@@H](O)CNc2cc(OC)c(OC)cc2C)c(OC)c1	ZINC000819390801	GH	On-Demand	Anodyne	ADRB2	16	69
C/C=C\c1ccc(OC[C@@H](O)CNc2cc(OC)c(OC)cc2C)c(OC)c1	ZINC000819390803	GH	On-Demand	Anodyne	ADRB2	16	69
CC(C)c1ccc(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819390857	FI	On-Demand	Mild	PAPA1_CARPA	50	42
CC(C)c1ccc(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819390857	FI	On-Demand	Mild	CTSK	22	46
CC(C)c1ccc(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819390857	FI	On-Demand	Mild	FPR1	43	37
CC(C)c1ccc(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819390858	FI	On-Demand	Mild	PAPA1_CARPA	50	42
CC(C)c1ccc(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819390858	FI	On-Demand	Mild	CTSK	22	46
CC(C)c1ccc(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819390858	FI	On-Demand	Mild	FPR1	43	37
C[C@@H](CNC[C@H](O)c1cccc([N+](=O)[O-])c1)N(C)C	ZINC000819390915	CD	On-Demand	Bother	CACNA1D	55	34
C[C@@H](CNC[C@@H](O)c1cccc([N+](=O)[O-])c1)N(C)C	ZINC000819390917	CD	On-Demand	Bother	CACNA1D	55	34
C[C@@H]1CCCC[C@@H]1C(=O)N1CCOC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819390930	EG	On-Demand	Anodyne	Q8WSF8_APLCA	17	43
C[C@@H]1CCCC[C@@H]1C(=O)N1CCOC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819390934	EG	On-Demand	Anodyne	Q8WSF8_APLCA	17	43
C[C@@H]1CCCC[C@@H]1C(=O)N1CCOC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819390936	EG	On-Demand	Anodyne	Q8WSF8_APLCA	17	43
C[C@@H]1CCCC[C@@H]1C(=O)N1CCOC[C@H]1C[C@H](O)c1ccccc1	ZINC000819390939	EG	On-Demand	Anodyne	Q8WSF8_APLCA	17	43
C#Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N3CCc4ccccc4C3)c2)c1	ZINC000819391033	HH	On-Demand	Mild	PPARD	18	62
C#Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N3CCc4ccccc4C3)c2)c1	ZINC000819391033	HH	On-Demand	Mild	AKR1C3	91	65
C#Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N3CCc4ccccc4C3)c2)c1	ZINC000819391033	HH	On-Demand	Mild	NOD2	42	36
C#Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N3CCc4ccccc4C3)c2)c1	ZINC000819391033	HH	On-Demand	Mild	KCNK3	89	36
C#Cc1cccc(NC(=O)c2cccc(S(=O)(=O)N3CCc4ccccc4C3)c2)c1	ZINC000819391033	HH	On-Demand	Mild	KCNK9	45	34
C#Cc1cccc(NC(=O)c2cc(S(=O)(=O)N(C)c3ccc(OC)cc3)ccc2Cl)c1	ZINC000819391040	JI	On-Demand	Mild	TAAR1	26	40
C#Cc1cccc(NC(=O)c2cc(S(=O)(=O)N(C)c3ccc(OC)cc3)ccc2Cl)c1	ZINC000819391040	JI	On-Demand	Mild	NR2E3	53	32
O=C(/C=C/[C@@H]1CCCO1)NC[C@H](O)COc1ccccc1Br	ZINC000819391111	FE	On-Demand	Anodyne	ADRB1	43	33
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H](O)COc1ccccc1Br	ZINC000819391113	FE	On-Demand	Anodyne	ADRB1	43	33
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H](O)COc1ccccc1Br	ZINC000819391115	FE	On-Demand	Anodyne	ADRB1	43	33
O=C(/C=C\[C@@H]1CCCO1)NC[C@H](O)COc1ccccc1Br	ZINC000819391116	FE	On-Demand	Anodyne	ADRB1	43	33
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C(C)(C)C	ZINC000819391118	FH	On-Demand	Anodyne	ECR	58	45
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C(C)(C)C	ZINC000819391118	FH	On-Demand	Anodyne	CPT1A	46	32
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C(C)(C)C	ZINC000819391118	FH	On-Demand	Anodyne	NR1H4	15	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C(C)(C)C	ZINC000819391118	FH	On-Demand	Anodyne	HDAC1	20	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C(C)(C)C	ZINC000819391118	FH	On-Demand	Anodyne	HDAC2	25	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C(C)(C)C	ZINC000819391118	FH	On-Demand	Anodyne	ITGAV	22	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C(C)(C)C	ZINC000819391118	FH	On-Demand	Anodyne	SMO	19	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C(C)(C)C	ZINC000819391118	FH	On-Demand	Anodyne	KCNK3	76	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@H](O)C(C)(C)C	ZINC000819391118	FH	On-Demand	Anodyne	KCNK9	45	36
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C(C)(C)C	ZINC000819391123	FH	On-Demand	Anodyne	ECR	58	45
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C(C)(C)C	ZINC000819391123	FH	On-Demand	Anodyne	CPT1A	46	32
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C(C)(C)C	ZINC000819391123	FH	On-Demand	Anodyne	NR1H4	15	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C(C)(C)C	ZINC000819391123	FH	On-Demand	Anodyne	HDAC1	20	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C(C)(C)C	ZINC000819391123	FH	On-Demand	Anodyne	HDAC2	25	42
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C(C)(C)C	ZINC000819391123	FH	On-Demand	Anodyne	ITGAV	22	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C(C)(C)C	ZINC000819391123	FH	On-Demand	Anodyne	SMO	19	41
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C(C)(C)C	ZINC000819391123	FH	On-Demand	Anodyne	KCNK3	76	43
COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC[C@@H](O)C(C)(C)C	ZINC000819391123	FH	On-Demand	Anodyne	KCNK9	45	36
C=C(C)C(C)(C)C(=O)NCCC(=O)OCc1ccccc1	ZINC000819391145	CF	On-Demand	Mild	CAPNS1	42	31
C=C(C)C(C)(C)C(=O)NCCC(=O)OCc1ccccc1	ZINC000819391145	CF	On-Demand	Mild	CAPN2	58	32
C=C(C)C(C)(C)C(=O)NCCC(=O)OCc1ccccc1	ZINC000819391145	CF	On-Demand	Mild	NPR	66	37
C=C(C)C(C)(C)C(=O)NCCC(=O)OCc1ccccc1	ZINC000819391145	CF	On-Demand	Mild	SLC12A5	61	34
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)[C@@H]1n1cccn1	ZINC000819391173	HD	On-Demand	Anodyne	LGMN	63	33
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)[C@@H]1n1cccn1	ZINC000819391174	HD	On-Demand	Anodyne	LGMN	63	33
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)[C@H]1n1cccn1	ZINC000819391175	HD	On-Demand	Anodyne	LGMN	63	33
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)[C@H]1n1cccn1	ZINC000819391176	HD	On-Demand	Anodyne	LGMN	63	33
CON(C)C(=O)CCNc1cccc(C)c1	ZINC000819391191	BD	On-Demand	Anodyne	KCNK3	62	37
CON(C)C(=O)CCNc1cccc(C)c1	ZINC000819391191	BD	On-Demand	Anodyne	KCNK9	52	37
O=C(/C=C/[C@@H]1CCCO1)N1CCOC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819391305	EE	On-Demand	Anodyne	Q8WSF8_APLCA	18	43
O=C(/C=C\[C@@H]1CCCO1)N1CCOC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819391306	EE	On-Demand	Anodyne	Q8WSF8_APLCA	18	43
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)[C@H](NC(=O)OC(C)(C)C)c2ccccc2)[C@H]1n1cccn1	ZINC000819391307	IH	On-Demand	Anodyne	FPR1	43	35
O=C(/C=C\[C@@H]1CCCO1)N1CCOC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819391308	EE	On-Demand	Anodyne	Q8WSF8_APLCA	18	43
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391309	IH	On-Demand	Anodyne	FPR1	43	35
O=C(/C=C/[C@@H]1CCCO1)N1CCOC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819391310	EE	On-Demand	Anodyne	Q8WSF8_APLCA	18	43
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)[C@H]1n1cccn1	ZINC000819391311	IH	On-Demand	Anodyne	FPR1	43	35
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)C[C@@H](C)n2cccn2)cc1	ZINC000819391346	GH	On-Demand	Anodyne	AMP1_PLAFQ	21	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)C[C@H](C)n2cccn2)cc1	ZINC000819391347	GH	On-Demand	Anodyne	AMP1_PLAFQ	21	42
C[C@@H](CC(=O)NCc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1)n1cccn1	ZINC000819391349	GH	On-Demand	Anodyne	AMP1_PLAFQ	21	42
O=C(/C=C\[C@@H]1CCCO1)N1CCCCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819391358	EH	On-Demand	Anodyne	Q8WSF8_APLCA	18	46
O=C(/C=C/[C@@H]1CCCO1)N1CCCCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819391359	EH	On-Demand	Anodyne	Q8WSF8_APLCA	18	46
O=C(/C=C\[C@@H]1CCCO1)N1CCCCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819391360	EH	On-Demand	Anodyne	Q8WSF8_APLCA	18	46
O=C(/C=C/[C@@H]1CCCO1)N1CCCCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819391361	EH	On-Demand	Anodyne	Q8WSF8_APLCA	18	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC[C@@H](Oc2ccccn2)C1	ZINC000819391387	ED	On-Demand	Anodyne	GPR119	18	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC[C@H](Oc2ccccn2)C1	ZINC000819391388	ED	On-Demand	Anodyne	GPR119	18	41
CC[C@@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)C(=O)OC(C)(C)C	ZINC000819391395	EE	On-Demand	Anodyne	CTSK	16	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)[C@H](NC(=O)OC(C)(C)C)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391409	IH	On-Demand	Anodyne	FPR1	43	35
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391410	HF	On-Demand	Anodyne	F2	49	39
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391410	HF	On-Demand	Anodyne	PLG	31	43
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391410	HF	On-Demand	Anodyne	PRSS1	31	41
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391410	HF	On-Demand	Anodyne	ACE	35	45
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391410	HF	On-Demand	Anodyne	FKBP1A	44	38
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391410	HF	On-Demand	Anodyne	CELA1	30	46
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391410	HF	On-Demand	Anodyne	ELANE	28	40
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391410	HF	On-Demand	Anodyne	CTRA_BOVIN	62	33
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391410	HF	On-Demand	Anodyne	TRY1_BOVIN	67	35
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391410	HF	On-Demand	Anodyne	CTSG	42	33
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391410	HF	On-Demand	Anodyne	PREP	64	46
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391410	HF	On-Demand	Anodyne	CELA2A	51	33
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391410	HF	On-Demand	Anodyne	LGMN	89	49
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391410	HF	On-Demand	Anodyne	KLK5	35	45
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391410	HF	On-Demand	Anodyne	SLC12A5	62	35
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391410	HF	On-Demand	Anodyne	TMPRSS11D	59	35
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391411	HF	On-Demand	Anodyne	F2	49	39
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391411	HF	On-Demand	Anodyne	PLG	31	43
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391411	HF	On-Demand	Anodyne	PRSS1	31	41
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391411	HF	On-Demand	Anodyne	ACE	35	45
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391411	HF	On-Demand	Anodyne	FKBP1A	44	38
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391411	HF	On-Demand	Anodyne	CELA1	30	46
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391411	HF	On-Demand	Anodyne	ELANE	28	40
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391411	HF	On-Demand	Anodyne	CTRA_BOVIN	62	33
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391411	HF	On-Demand	Anodyne	TRY1_BOVIN	67	35
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391411	HF	On-Demand	Anodyne	CTSG	42	33
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391411	HF	On-Demand	Anodyne	PREP	64	46
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391411	HF	On-Demand	Anodyne	CELA2A	51	33
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391411	HF	On-Demand	Anodyne	LGMN	89	49
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391411	HF	On-Demand	Anodyne	KLK5	35	45
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391411	HF	On-Demand	Anodyne	SLC12A5	62	35
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391411	HF	On-Demand	Anodyne	TMPRSS11D	59	35
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391412	HF	On-Demand	Anodyne	F2	49	39
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391412	HF	On-Demand	Anodyne	PLG	31	43
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391412	HF	On-Demand	Anodyne	PRSS1	31	41
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391412	HF	On-Demand	Anodyne	ACE	35	45
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391412	HF	On-Demand	Anodyne	FKBP1A	44	38
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391412	HF	On-Demand	Anodyne	CELA1	30	46
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391412	HF	On-Demand	Anodyne	ELANE	28	40
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391412	HF	On-Demand	Anodyne	CTRA_BOVIN	62	33
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391412	HF	On-Demand	Anodyne	TRY1_BOVIN	67	35
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391412	HF	On-Demand	Anodyne	CTSG	42	33
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391412	HF	On-Demand	Anodyne	PREP	64	46
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391412	HF	On-Demand	Anodyne	CELA2A	51	33
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391412	HF	On-Demand	Anodyne	LGMN	89	49
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391412	HF	On-Demand	Anodyne	KLK5	35	45
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391412	HF	On-Demand	Anodyne	SLC12A5	62	35
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391412	HF	On-Demand	Anodyne	TMPRSS11D	59	35
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391413	HF	On-Demand	Anodyne	F2	49	39
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391413	HF	On-Demand	Anodyne	PLG	31	43
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391413	HF	On-Demand	Anodyne	PRSS1	31	41
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391413	HF	On-Demand	Anodyne	ACE	35	45
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391413	HF	On-Demand	Anodyne	FKBP1A	44	38
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391413	HF	On-Demand	Anodyne	CELA1	30	46
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391413	HF	On-Demand	Anodyne	ELANE	28	40
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391413	HF	On-Demand	Anodyne	CTRA_BOVIN	62	33
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391413	HF	On-Demand	Anodyne	TRY1_BOVIN	67	35
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391413	HF	On-Demand	Anodyne	CTSG	42	33
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391413	HF	On-Demand	Anodyne	PREP	64	46
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391413	HF	On-Demand	Anodyne	CELA2A	51	33
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391413	HF	On-Demand	Anodyne	LGMN	89	49
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391413	HF	On-Demand	Anodyne	KLK5	35	45
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391413	HF	On-Demand	Anodyne	SLC12A5	62	35
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391413	HF	On-Demand	Anodyne	TMPRSS11D	59	35
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819391469	HE	On-Demand	Anodyne	POLG_HCV1	25	42
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819391469	HE	On-Demand	Anodyne	FPR1	43	35
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819391470	HE	On-Demand	Anodyne	POLG_HCV1	25	42
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819391470	HE	On-Demand	Anodyne	FPR1	43	35
CCO[C@@H]1C[C@H](NC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819391471	HE	On-Demand	Anodyne	POLG_HCV1	25	42
CCO[C@@H]1C[C@H](NC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819391471	HE	On-Demand	Anodyne	FPR1	43	35
CCO[C@@H]1C[C@H](NC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819391472	HE	On-Demand	Anodyne	POLG_HCV1	25	42
CCO[C@@H]1C[C@H](NC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819391472	HE	On-Demand	Anodyne	FPR1	43	35
CCO[C@@H]1C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OC)[C@H]1n1cccn1	ZINC000819391530	FD	On-Demand	Anodyne	CAPN2	60	33
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)OC)[C@H]1n1cccn1	ZINC000819391531	FD	On-Demand	Anodyne	CAPN2	60	33
CCO[C@@H]1C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OC)[C@@H]1n1cccn1	ZINC000819391532	FD	On-Demand	Anodyne	CAPN2	60	33
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)OC)[C@@H]1n1cccn1	ZINC000819391533	FD	On-Demand	Anodyne	CAPN2	60	33
CCO[C@@H]1C[C@@H](NC(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)[C@H]1n1cccn1	ZINC000819391572	ID	On-Demand	Anodyne	GRIN2B	19	41
CCO[C@@H]1C[C@@H](NC(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)[C@@H]1n1cccn1	ZINC000819391573	ID	On-Demand	Anodyne	GRIN2B	19	41
CCO[C@@H]1C[C@H](NC(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)[C@H]1n1cccn1	ZINC000819391574	ID	On-Demand	Anodyne	GRIN2B	19	41
CCO[C@@H]1C[C@H](NC(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)[C@@H]1n1cccn1	ZINC000819391575	ID	On-Demand	Anodyne	GRIN2B	19	41
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	ACE	19	42
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	SSTR2	76	43
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	GHRHR	45	54
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	MME	24	40
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	EDNRA	26	51
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	TACR1	36	56
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	MC4R	43	38
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	CCKAR	140	56
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	CTSL	22	48
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	PGA	17	45
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	NMBR	85	41
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	MC3R	54	36
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	MC5R	51	32
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	MMP2	24	47
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	GRPR	87	32
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	ECE1	60	42
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	REN	35	45
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	REN1	27	45
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	MMP11	82	35
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	CCKBR	113	55
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	GHSR	66	58
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	MMP9	23	47
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	MC1R	78	36
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	FPR1	46	53
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	KISS1R	62	31
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1CC2(CCOC2)C1	ZINC000819391741	GF	On-Demand	Anodyne	PSMB8	25	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391772	GE	On-Demand	Anodyne	ACE	32	42
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391772	GE	On-Demand	Anodyne	CELA1	15	50
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391772	GE	On-Demand	Anodyne	CASP3	18	46
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391772	GE	On-Demand	Anodyne	KLK3	76	37
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391772	GE	On-Demand	Anodyne	CTSB	62	40
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391772	GE	On-Demand	Anodyne	PAPA1_CARPA	78	39
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391772	GE	On-Demand	Anodyne	CYSP_TRYCR	57	39
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391772	GE	On-Demand	Anodyne	CTSK	38	46
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391772	GE	On-Demand	Anodyne	CTSL	45	37
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391772	GE	On-Demand	Anodyne	CAPNS1	66	38
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391772	GE	On-Demand	Anodyne	HLA-DRB1	45	38
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391772	GE	On-Demand	Anodyne	CTSS	19	40
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391772	GE	On-Demand	Anodyne	CAPN1	83	42
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391772	GE	On-Demand	Anodyne	CASP1	28	45
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391772	GE	On-Demand	Anodyne	CAPN2	140	44
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391772	GE	On-Demand	Anodyne	PLAU	17	45
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391772	GE	On-Demand	Anodyne	NPR	66	35
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391772	GE	On-Demand	Anodyne	PSMB5	53	44
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391772	GE	On-Demand	Anodyne	Q6PRC7_IXORI	45	37
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391773	GE	On-Demand	Anodyne	ACE	32	42
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391773	GE	On-Demand	Anodyne	CELA1	15	50
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391773	GE	On-Demand	Anodyne	CASP3	18	46
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391773	GE	On-Demand	Anodyne	KLK3	76	37
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391773	GE	On-Demand	Anodyne	CTSB	62	40
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391773	GE	On-Demand	Anodyne	PAPA1_CARPA	78	39
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391773	GE	On-Demand	Anodyne	CYSP_TRYCR	57	39
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391773	GE	On-Demand	Anodyne	CTSK	38	46
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391773	GE	On-Demand	Anodyne	CTSL	45	37
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391773	GE	On-Demand	Anodyne	CAPNS1	66	38
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391773	GE	On-Demand	Anodyne	HLA-DRB1	45	38
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391773	GE	On-Demand	Anodyne	CTSS	19	40
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391773	GE	On-Demand	Anodyne	CAPN1	83	42
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391773	GE	On-Demand	Anodyne	CASP1	28	45
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391773	GE	On-Demand	Anodyne	CAPN2	140	44
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391773	GE	On-Demand	Anodyne	PLAU	17	45
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391773	GE	On-Demand	Anodyne	NPR	66	35
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391773	GE	On-Demand	Anodyne	PSMB5	53	44
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391773	GE	On-Demand	Anodyne	Q6PRC7_IXORI	45	37
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391774	GE	On-Demand	Anodyne	ACE	32	42
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391774	GE	On-Demand	Anodyne	CELA1	15	50
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391774	GE	On-Demand	Anodyne	CASP3	18	46
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391774	GE	On-Demand	Anodyne	KLK3	76	37
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391774	GE	On-Demand	Anodyne	CTSB	62	40
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391774	GE	On-Demand	Anodyne	PAPA1_CARPA	78	39
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391774	GE	On-Demand	Anodyne	CYSP_TRYCR	57	39
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391774	GE	On-Demand	Anodyne	CTSK	38	46
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391774	GE	On-Demand	Anodyne	CTSL	45	37
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391774	GE	On-Demand	Anodyne	CAPNS1	66	38
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391774	GE	On-Demand	Anodyne	HLA-DRB1	45	38
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391774	GE	On-Demand	Anodyne	CTSS	19	40
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391774	GE	On-Demand	Anodyne	CAPN1	83	42
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391774	GE	On-Demand	Anodyne	CASP1	28	45
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391774	GE	On-Demand	Anodyne	CAPN2	140	44
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391774	GE	On-Demand	Anodyne	PLAU	17	45
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391774	GE	On-Demand	Anodyne	NPR	66	35
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391774	GE	On-Demand	Anodyne	PSMB5	53	44
CCO[C@@H]1C[C@@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391774	GE	On-Demand	Anodyne	Q6PRC7_IXORI	45	37
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391775	GE	On-Demand	Anodyne	ACE	32	42
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391775	GE	On-Demand	Anodyne	CELA1	15	50
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391775	GE	On-Demand	Anodyne	CASP3	18	46
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391775	GE	On-Demand	Anodyne	KLK3	76	37
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391775	GE	On-Demand	Anodyne	CTSB	62	40
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391775	GE	On-Demand	Anodyne	PAPA1_CARPA	78	39
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391775	GE	On-Demand	Anodyne	CYSP_TRYCR	57	39
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391775	GE	On-Demand	Anodyne	CTSK	38	46
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391775	GE	On-Demand	Anodyne	CTSL	45	37
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391775	GE	On-Demand	Anodyne	CAPNS1	66	38
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391775	GE	On-Demand	Anodyne	HLA-DRB1	45	38
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391775	GE	On-Demand	Anodyne	CTSS	19	40
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391775	GE	On-Demand	Anodyne	CAPN1	83	42
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391775	GE	On-Demand	Anodyne	CASP1	28	45
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391775	GE	On-Demand	Anodyne	CAPN2	140	44
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391775	GE	On-Demand	Anodyne	PLAU	17	45
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391775	GE	On-Demand	Anodyne	NPR	66	35
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391775	GE	On-Demand	Anodyne	PSMB5	53	44
CCO[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391775	GE	On-Demand	Anodyne	Q6PRC7_IXORI	45	37
CCO[C@@H]1C[C@@H](NC(=O)c2cc(-c3cccnc3)nc3ccccc23)[C@H]1n1cccn1	ZINC000819391854	HH	On-Demand	Anodyne	TACR3	29	41
CCO[C@@H]1C[C@H](NC(=O)c2cc(-c3cccnc3)nc3ccccc23)[C@H]1n1cccn1	ZINC000819391855	HH	On-Demand	Anodyne	TACR3	29	41
CCO[C@@H]1C[C@@H](NC(=O)c2cc(-c3cccnc3)nc3ccccc23)[C@@H]1n1cccn1	ZINC000819391856	HH	On-Demand	Anodyne	TACR3	29	41
CCO[C@@H]1C[C@H](NC(=O)c2cc(-c3cccnc3)nc3ccccc23)[C@@H]1n1cccn1	ZINC000819391857	HH	On-Demand	Anodyne	TACR3	29	41
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)[C@H]1n1cccn1	ZINC000819391890	HF	On-Demand	Anodyne	FPR1	42	34
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)[C@H]1n1cccn1	ZINC000819391890	HF	On-Demand	Anodyne	AMP1_PLAFQ	31	46
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)[C@H]1n1cccn1	ZINC000819391890	HF	On-Demand	Anodyne	Q82323_9DELA	69	33
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391891	HF	On-Demand	Anodyne	FPR1	42	34
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391891	HF	On-Demand	Anodyne	AMP1_PLAFQ	31	46
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391891	HF	On-Demand	Anodyne	Q82323_9DELA	69	33
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391892	HF	On-Demand	Anodyne	FPR1	42	34
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391892	HF	On-Demand	Anodyne	AMP1_PLAFQ	31	46
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391892	HF	On-Demand	Anodyne	Q82323_9DELA	69	33
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)[C@H]1n1cccn1	ZINC000819391893	HF	On-Demand	Anodyne	FPR1	42	34
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)[C@H]1n1cccn1	ZINC000819391893	HF	On-Demand	Anodyne	AMP1_PLAFQ	31	46
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)[C@H]1n1cccn1	ZINC000819391893	HF	On-Demand	Anodyne	Q82323_9DELA	69	33
CC(C)(C(=O)N1CC2(CCOC2)C1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819391904	GH	On-Demand	Anodyne	ALOX5	17	42
CC(C)(C(=O)N1CC2(CCOC2)C1)[C@@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819391904	GH	On-Demand	Anodyne	FFAR1	22	41
CC(C)(C(=O)N1CC2(CCOC2)C1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819391905	GH	On-Demand	Anodyne	ALOX5	17	42
CC(C)(C(=O)N1CC2(CCOC2)C1)[C@H](O)c1ccc(OCc2ccccc2)cc1	ZINC000819391905	GH	On-Demand	Anodyne	FFAR1	22	41
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391906	IF	On-Demand	Anodyne	PRSS1	24	40
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391906	IF	On-Demand	Anodyne	ACE	26	43
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391906	IF	On-Demand	Anodyne	FKBP1A	50	40
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391906	IF	On-Demand	Anodyne	CELA1	29	44
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391906	IF	On-Demand	Anodyne	CTRA_BOVIN	60	32
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391906	IF	On-Demand	Anodyne	TRY1_BOVIN	51	32
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391906	IF	On-Demand	Anodyne	CTSG	41	32
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391906	IF	On-Demand	Anodyne	PREP	57	44
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391906	IF	On-Demand	Anodyne	CELA2A	49	32
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391906	IF	On-Demand	Anodyne	LGMN	85	47
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391906	IF	On-Demand	Anodyne	KLK5	34	43
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391906	IF	On-Demand	Anodyne	SLC12A5	62	35
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391907	IF	On-Demand	Anodyne	PRSS1	24	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391907	IF	On-Demand	Anodyne	ACE	26	43
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391907	IF	On-Demand	Anodyne	FKBP1A	50	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391907	IF	On-Demand	Anodyne	CELA1	29	44
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391907	IF	On-Demand	Anodyne	CTRA_BOVIN	60	32
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391907	IF	On-Demand	Anodyne	TRY1_BOVIN	51	32
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391907	IF	On-Demand	Anodyne	CTSG	41	32
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391907	IF	On-Demand	Anodyne	PREP	57	44
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391907	IF	On-Demand	Anodyne	CELA2A	49	32
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391907	IF	On-Demand	Anodyne	LGMN	85	47
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391907	IF	On-Demand	Anodyne	KLK5	34	43
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819391907	IF	On-Demand	Anodyne	SLC12A5	62	35
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391908	IF	On-Demand	Anodyne	PRSS1	24	40
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391908	IF	On-Demand	Anodyne	ACE	26	43
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391908	IF	On-Demand	Anodyne	FKBP1A	50	40
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391908	IF	On-Demand	Anodyne	CELA1	29	44
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391908	IF	On-Demand	Anodyne	CTRA_BOVIN	60	32
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391908	IF	On-Demand	Anodyne	TRY1_BOVIN	51	32
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391908	IF	On-Demand	Anodyne	CTSG	41	32
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391908	IF	On-Demand	Anodyne	PREP	57	44
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391908	IF	On-Demand	Anodyne	CELA2A	49	32
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391908	IF	On-Demand	Anodyne	LGMN	85	47
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391908	IF	On-Demand	Anodyne	KLK5	34	43
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391908	IF	On-Demand	Anodyne	SLC12A5	62	35
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391909	IF	On-Demand	Anodyne	PRSS1	24	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391909	IF	On-Demand	Anodyne	ACE	26	43
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391909	IF	On-Demand	Anodyne	FKBP1A	50	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391909	IF	On-Demand	Anodyne	CELA1	29	44
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391909	IF	On-Demand	Anodyne	CTRA_BOVIN	60	32
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391909	IF	On-Demand	Anodyne	TRY1_BOVIN	51	32
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391909	IF	On-Demand	Anodyne	CTSG	41	32
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391909	IF	On-Demand	Anodyne	PREP	57	44
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391909	IF	On-Demand	Anodyne	CELA2A	49	32
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391909	IF	On-Demand	Anodyne	LGMN	85	47
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391909	IF	On-Demand	Anodyne	KLK5	34	43
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819391909	IF	On-Demand	Anodyne	SLC12A5	62	35
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391918	IG	On-Demand	Anodyne	CASP3	15	48
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391918	IG	On-Demand	Anodyne	KLK3	58	34
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391918	IG	On-Demand	Anodyne	CTSB	59	39
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391918	IG	On-Demand	Anodyne	PAPA1_CARPA	69	34
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391918	IG	On-Demand	Anodyne	CYSP_TRYCR	52	36
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391918	IG	On-Demand	Anodyne	CTSK	35	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391918	IG	On-Demand	Anodyne	CTSL	42	35
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391918	IG	On-Demand	Anodyne	CAPNS1	61	35
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391918	IG	On-Demand	Anodyne	CAPN1	77	38
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391918	IG	On-Demand	Anodyne	CASP1	24	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391918	IG	On-Demand	Anodyne	CAPN2	128	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391918	IG	On-Demand	Anodyne	CASP9	29	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391918	IG	On-Demand	Anodyne	NPR	60	33
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391918	IG	On-Demand	Anodyne	GAG-PRO	40	32
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391918	IG	On-Demand	Anodyne	CASP10	34	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391918	IG	On-Demand	Anodyne	Q82323_9DELA	69	32
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391919	IG	On-Demand	Anodyne	CASP3	15	48
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391919	IG	On-Demand	Anodyne	KLK3	58	34
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391919	IG	On-Demand	Anodyne	CTSB	59	39
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391919	IG	On-Demand	Anodyne	PAPA1_CARPA	69	34
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391919	IG	On-Demand	Anodyne	CYSP_TRYCR	52	36
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391919	IG	On-Demand	Anodyne	CTSK	35	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391919	IG	On-Demand	Anodyne	CTSL	42	35
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391919	IG	On-Demand	Anodyne	CAPNS1	61	35
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391919	IG	On-Demand	Anodyne	CAPN1	77	38
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391919	IG	On-Demand	Anodyne	CASP1	24	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391919	IG	On-Demand	Anodyne	CAPN2	128	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391919	IG	On-Demand	Anodyne	CASP9	29	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391919	IG	On-Demand	Anodyne	NPR	60	33
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391919	IG	On-Demand	Anodyne	GAG-PRO	40	32
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391919	IG	On-Demand	Anodyne	CASP10	34	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@@H]1n1cccn1	ZINC000819391919	IG	On-Demand	Anodyne	Q82323_9DELA	69	32
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391920	IG	On-Demand	Anodyne	CASP3	15	48
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391920	IG	On-Demand	Anodyne	KLK3	58	34
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391920	IG	On-Demand	Anodyne	CTSB	59	39
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391920	IG	On-Demand	Anodyne	PAPA1_CARPA	69	34
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391920	IG	On-Demand	Anodyne	CYSP_TRYCR	52	36
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391920	IG	On-Demand	Anodyne	CTSK	35	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391920	IG	On-Demand	Anodyne	CTSL	42	35
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391920	IG	On-Demand	Anodyne	CAPNS1	61	35
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391920	IG	On-Demand	Anodyne	CAPN1	77	38
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391920	IG	On-Demand	Anodyne	CASP1	24	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391920	IG	On-Demand	Anodyne	CAPN2	128	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391920	IG	On-Demand	Anodyne	CASP9	29	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391920	IG	On-Demand	Anodyne	NPR	60	33
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391920	IG	On-Demand	Anodyne	GAG-PRO	40	32
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391920	IG	On-Demand	Anodyne	CASP10	34	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391920	IG	On-Demand	Anodyne	Q82323_9DELA	69	32
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391921	IG	On-Demand	Anodyne	CASP3	15	48
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391921	IG	On-Demand	Anodyne	KLK3	58	34
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391921	IG	On-Demand	Anodyne	CTSB	59	39
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391921	IG	On-Demand	Anodyne	PAPA1_CARPA	69	34
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391921	IG	On-Demand	Anodyne	CYSP_TRYCR	52	36
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391921	IG	On-Demand	Anodyne	CTSK	35	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391921	IG	On-Demand	Anodyne	CTSL	42	35
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391921	IG	On-Demand	Anodyne	CAPNS1	61	35
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391921	IG	On-Demand	Anodyne	CAPN1	77	38
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391921	IG	On-Demand	Anodyne	CASP1	24	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391921	IG	On-Demand	Anodyne	CAPN2	128	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391921	IG	On-Demand	Anodyne	CASP9	29	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391921	IG	On-Demand	Anodyne	NPR	60	33
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391921	IG	On-Demand	Anodyne	GAG-PRO	40	32
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391921	IG	On-Demand	Anodyne	CASP10	34	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)[C@H]1n1cccn1	ZINC000819391921	IG	On-Demand	Anodyne	Q82323_9DELA	69	32
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)[C@@H]1n1cccn1	ZINC000819391926	IF	On-Demand	Anodyne	GRIN2B	20	43
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)[C@@H]1n1cccn1	ZINC000819391926	IF	On-Demand	Anodyne	PREP	30	40
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)[C@@H]1n1cccn1	ZINC000819391926	IF	On-Demand	Anodyne	SLC12A5	41	32
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)[C@@H]1n1cccn1	ZINC000819391927	IF	On-Demand	Anodyne	GRIN2B	20	43
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)[C@@H]1n1cccn1	ZINC000819391927	IF	On-Demand	Anodyne	PREP	30	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)[C@@H]1n1cccn1	ZINC000819391927	IF	On-Demand	Anodyne	SLC12A5	41	32
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)[C@H]1n1cccn1	ZINC000819391928	IF	On-Demand	Anodyne	GRIN2B	20	43
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)[C@H]1n1cccn1	ZINC000819391928	IF	On-Demand	Anodyne	PREP	30	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)[C@H]1n1cccn1	ZINC000819391928	IF	On-Demand	Anodyne	SLC12A5	41	32
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)[C@H]1n1cccn1	ZINC000819391929	IF	On-Demand	Anodyne	GRIN2B	20	43
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)[C@H]1n1cccn1	ZINC000819391929	IF	On-Demand	Anodyne	PREP	30	40
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)[C@H]1n1cccn1	ZINC000819391929	IF	On-Demand	Anodyne	SLC12A5	41	32
O=C(c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1)N1CC2(CCOC2)C1	ZINC000819391965	IH	On-Demand	Bother	GRIN2B	37	44
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)c2cccc(Cl)c2)[C@@H]1n1cccn1	ZINC000819392020	IH	On-Demand	Anodyne	AMP1_PLAFQ	18	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2cccc(Cl)c2)[C@@H]1n1cccn1	ZINC000819392021	IH	On-Demand	Anodyne	AMP1_PLAFQ	18	40
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)c2cccc(Cl)c2)[C@H]1n1cccn1	ZINC000819392022	IH	On-Demand	Anodyne	AMP1_PLAFQ	18	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)c2cccc(Cl)c2)[C@H]1n1cccn1	ZINC000819392023	IH	On-Demand	Anodyne	AMP1_PLAFQ	18	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)[C@@H]1n1cccn1	ZINC000819392045	GE	On-Demand	Anodyne	PGA5	22	40
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)C(C)C)[C@@H]1n1cccn1	ZINC000819392046	GE	On-Demand	Anodyne	PGA5	22	40
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)[C@H]1n1cccn1	ZINC000819392047	GE	On-Demand	Anodyne	PGA5	22	40
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)[C@@H]1n1cccn1	ZINC000819392048	GE	On-Demand	Anodyne	PGA5	22	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)[C@H]1n1cccn1	ZINC000819392049	GE	On-Demand	Anodyne	PGA5	22	40
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)C(C)C)[C@H]1n1cccn1	ZINC000819392050	GE	On-Demand	Anodyne	PGA5	22	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	ELANE	35	42
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	CASP3	30	47
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	CASP8	18	47
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	KLK3	75	36
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	CTSB	63	45
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	PAPA1_CARPA	80	43
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	CYSP_TRYCR	53	37
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	CTSK	38	49
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	CTSL	45	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	PGA	29	46
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	CAPNS1	64	37
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	HLA-DRB1	58	38
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	CTSS	17	49
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	CAPN1	82	46
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	CASP1	37	47
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	CAPN2	129	44
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	CASP6	22	47
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	CASP9	42	47
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	NPR	65	36
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	CASP10	37	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392075	HF	On-Demand	Anodyne	PSMB5	48	38
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	ELANE	35	42
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	CASP3	30	47
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	CASP8	18	47
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	KLK3	75	36
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	CTSB	63	45
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	PAPA1_CARPA	80	43
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	CYSP_TRYCR	53	37
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	CTSK	38	49
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	CTSL	45	41
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	PGA	29	46
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	CAPNS1	64	37
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	HLA-DRB1	58	38
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	CTSS	17	49
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	CAPN1	82	46
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	CASP1	37	47
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	CAPN2	129	44
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	CASP6	22	47
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	CASP9	42	47
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	NPR	65	36
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	CASP10	37	40
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392076	HF	On-Demand	Anodyne	PSMB5	48	38
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	ELANE	35	42
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	CASP3	30	47
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	CASP8	18	47
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	KLK3	75	36
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	CTSB	63	45
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	PAPA1_CARPA	80	43
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	CYSP_TRYCR	53	37
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	CTSK	38	49
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	CTSL	45	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	PGA	29	46
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	CAPNS1	64	37
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	HLA-DRB1	58	38
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	CTSS	17	49
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	CAPN1	82	46
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	CASP1	37	47
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	CAPN2	129	44
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	CASP6	22	47
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	CASP9	42	47
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	NPR	65	36
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	CASP10	37	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@H]1n1cccn1	ZINC000819392077	HF	On-Demand	Anodyne	PSMB5	48	38
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	ELANE	35	42
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	CASP3	30	47
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	CASP8	18	47
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	KLK3	75	36
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	CTSB	63	45
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	PAPA1_CARPA	80	43
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	CYSP_TRYCR	53	37
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	CTSK	38	49
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	CTSL	45	41
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	PGA	29	46
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	CAPNS1	64	37
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	HLA-DRB1	58	38
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	CTSS	17	49
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	CAPN1	82	46
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	CASP1	37	47
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	CAPN2	129	44
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	CASP6	22	47
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	CASP9	42	47
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	NPR	65	36
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	CASP10	37	40
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)[C@@H]1n1cccn1	ZINC000819392078	HF	On-Demand	Anodyne	PSMB5	48	38
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@H](OCC)[C@H]1n1cccn1	ZINC000819392147	GE	On-Demand	Anodyne	PAPA1_CARPA	18	41
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](OCC)[C@H]1n1cccn1	ZINC000819392148	GE	On-Demand	Anodyne	PAPA1_CARPA	18	41
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@H](OCC)[C@@H]1n1cccn1	ZINC000819392149	GE	On-Demand	Anodyne	PAPA1_CARPA	18	41
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H](OCC)[C@@H]1n1cccn1	ZINC000819392150	GE	On-Demand	Anodyne	PAPA1_CARPA	18	41
O=C(Nc1ccccc1C(=O)N1CC2(CCOC2)C1)OCc1ccccc1	ZINC000819392222	FG	On-Demand	Anodyne	CAPNS1	49	32
O=C(Nc1ccccc1C(=O)N1CC2(CCOC2)C1)OCc1ccccc1	ZINC000819392222	FG	On-Demand	Anodyne	CAPN2	40	34
O=C(Nc1ccccc1C(=O)N1CC2(CCOC2)C1)OCc1ccccc1	ZINC000819392222	FG	On-Demand	Anodyne	NPR	53	33
O=C(Nc1ccccc1C(=O)N1CC2(CCOC2)C1)OCc1ccccc1	ZINC000819392222	FG	On-Demand	Anodyne	SLC12A5	45	35
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	CTSD	19	40
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	PGC	61	40
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	PAPA1_CARPA	66	47
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	CYSP_TRYCR	59	37
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	CCKAR	65	51
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	CTSK	25	46
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	CTSL	42	47
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	PGA	34	43
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	TIMP3	80	38
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	TACR3	15	42
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	CAPNS1	53	33
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	HLA-DRB1	39	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	REN	98	48
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	REN1	50	43
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	CCKBR	22	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	CTSS	18	47
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	CAPN1	41	45
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	CAPN2	51	36
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	FPR1	72	48
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392228	IF	On-Demand	Anodyne	CTRB_BOVIN	20	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	CTSD	19	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	PGC	61	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	PAPA1_CARPA	66	47
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	CYSP_TRYCR	59	37
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	CCKAR	65	51
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	CTSK	25	46
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	CTSL	42	47
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	PGA	34	43
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	TIMP3	80	38
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	TACR3	15	42
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	CAPNS1	53	33
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	HLA-DRB1	39	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	REN	98	48
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	REN1	50	43
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	CCKBR	22	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	CTSS	18	47
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	CAPN1	41	45
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	CAPN2	51	36
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	FPR1	72	48
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392229	IF	On-Demand	Anodyne	CTRB_BOVIN	20	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	CTSD	19	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	PGC	61	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	PAPA1_CARPA	66	47
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	CYSP_TRYCR	59	37
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	CCKAR	65	51
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	CTSK	25	46
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	CTSL	42	47
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	PGA	34	43
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	TIMP3	80	38
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	TACR3	15	42
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	CAPNS1	53	33
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	HLA-DRB1	39	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	REN	98	48
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	REN1	50	43
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	CCKBR	22	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	CTSS	18	47
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	CAPN1	41	45
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	CAPN2	51	36
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	FPR1	72	48
CCO[C@@H]1C[C@H](NC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392230	IF	On-Demand	Anodyne	CTRB_BOVIN	20	40
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	CTSD	19	40
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	PGC	61	40
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	PAPA1_CARPA	66	47
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	CYSP_TRYCR	59	37
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	CCKAR	65	51
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	CTSK	25	46
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	CTSL	42	47
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	PGA	34	43
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	TIMP3	80	38
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	TACR3	15	42
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	CAPNS1	53	33
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	HLA-DRB1	39	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	REN	98	48
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	REN1	50	43
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	CCKBR	22	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	CTSS	18	47
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	CAPN1	41	45
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	CAPN2	51	36
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	FPR1	72	48
CCO[C@@H]1C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392231	IF	On-Demand	Anodyne	CTRB_BOVIN	20	40
CCO[C@@H]1C[C@H](NC(=O)[C@]2(F)CCN(C(=O)OCc3ccccc3)C2)[C@H]1n1cccn1	ZINC000819392303	IE	On-Demand	Anodyne	SLC12A5	58	33
CCO[C@@H]1C[C@H](NC(=O)[C@@]2(F)CCN(C(=O)OCc3ccccc3)C2)[C@H]1n1cccn1	ZINC000819392304	IE	On-Demand	Anodyne	SLC12A5	58	33
CCO[C@@H]1C[C@H](NC(=O)[C@@]2(F)CCN(C(=O)OCc3ccccc3)C2)[C@@H]1n1cccn1	ZINC000819392305	IE	On-Demand	Anodyne	SLC12A5	58	33
CCO[C@@H]1C[C@H](NC(=O)[C@]2(F)CCN(C(=O)OCc3ccccc3)C2)[C@@H]1n1cccn1	ZINC000819392306	IE	On-Demand	Anodyne	SLC12A5	58	33
CCO[C@@H]1C[C@H](NC(=O)C[C@@H](C)C2CCN(C(=O)OC(C)(C)C)CC2)[C@@H]1n1cccn1	ZINC000819392307	IG	On-Demand	Anodyne	GPR119	24	44
CCO[C@@H]1C[C@H](NC(=O)C[C@H](C)C2CCN(C(=O)OC(C)(C)C)CC2)[C@@H]1n1cccn1	ZINC000819392308	IG	On-Demand	Anodyne	GPR119	24	44
CCO[C@@H]1C[C@H](NC(=O)C[C@@H](C)C2CCN(C(=O)OC(C)(C)C)CC2)[C@H]1n1cccn1	ZINC000819392309	IG	On-Demand	Anodyne	GPR119	24	44
CCO[C@@H]1C[C@H](NC(=O)C[C@H](C)C2CCN(C(=O)OC(C)(C)C)CC2)[C@H]1n1cccn1	ZINC000819392310	IG	On-Demand	Anodyne	GPR119	24	44
CCO[C@@H]1C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392332	GF	On-Demand	Anodyne	PAPA1_CARPA	30	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392332	GF	On-Demand	Anodyne	REN	41	42
CCO[C@@H]1C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392332	GF	On-Demand	Anodyne	CAPN1	22	40
CCO[C@@H]1C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392332	GF	On-Demand	Anodyne	POLG_HCV1	23	40
CCO[C@@H]1C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392332	GF	On-Demand	Anodyne	FPR1	51	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392333	GF	On-Demand	Anodyne	PAPA1_CARPA	30	41
CCO[C@@H]1C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392333	GF	On-Demand	Anodyne	REN	41	42
CCO[C@@H]1C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392333	GF	On-Demand	Anodyne	CAPN1	22	40
CCO[C@@H]1C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392333	GF	On-Demand	Anodyne	POLG_HCV1	23	40
CCO[C@@H]1C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392333	GF	On-Demand	Anodyne	FPR1	51	41
CCO[C@@H]1C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392334	GF	On-Demand	Anodyne	PAPA1_CARPA	30	41
CCO[C@@H]1C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392334	GF	On-Demand	Anodyne	REN	41	42
CCO[C@@H]1C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392334	GF	On-Demand	Anodyne	CAPN1	22	40
CCO[C@@H]1C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392334	GF	On-Demand	Anodyne	POLG_HCV1	23	40
CCO[C@@H]1C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392334	GF	On-Demand	Anodyne	FPR1	51	41
CCO[C@@H]1C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392335	GF	On-Demand	Anodyne	PAPA1_CARPA	30	41
CCO[C@@H]1C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392335	GF	On-Demand	Anodyne	REN	41	42
CCO[C@@H]1C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392335	GF	On-Demand	Anodyne	CAPN1	22	40
CCO[C@@H]1C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392335	GF	On-Demand	Anodyne	POLG_HCV1	23	40
CCO[C@@H]1C[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392335	GF	On-Demand	Anodyne	FPR1	51	41
CCO[C@@H]1C[C@H](NC(=O)[C@H]2Cc3ccccc3CN2C(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392345	IG	On-Demand	Anodyne	CFTR	63	35
CCO[C@@H]1C[C@H](NC(=O)[C@H]2Cc3ccccc3CN2C(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392345	IG	On-Demand	Anodyne	ADAM9	59	34
CCO[C@@H]1C[C@H](NC(=O)[C@H]2Cc3ccccc3CN2C(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392346	IG	On-Demand	Anodyne	CFTR	63	35
CCO[C@@H]1C[C@H](NC(=O)[C@H]2Cc3ccccc3CN2C(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392346	IG	On-Demand	Anodyne	ADAM9	59	34
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2C(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392347	IG	On-Demand	Anodyne	CFTR	63	35
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2C(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819392347	IG	On-Demand	Anodyne	ADAM9	59	34
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2C(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392348	IG	On-Demand	Anodyne	CFTR	63	35
CCO[C@@H]1C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2C(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819392348	IG	On-Demand	Anodyne	ADAM9	59	34
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1Cl	ZINC000819392407	GH	On-Demand	Mild	PDE5A	41	38
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1Cl	ZINC000819392407	GH	On-Demand	Mild	CTSD	15	41
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1Cl	ZINC000819392407	GH	On-Demand	Mild	PAPA1_CARPA	56	50
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1Cl	ZINC000819392407	GH	On-Demand	Mild	CCKAR	40	37
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1Cl	ZINC000819392407	GH	On-Demand	Mild	CTSL	24	50
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1Cl	ZINC000819392407	GH	On-Demand	Mild	PDE6A	44	35
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1Cl	ZINC000819392407	GH	On-Demand	Mild	PCSK5	42	33
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1Cl	ZINC000819392407	GH	On-Demand	Mild	FURIN	56	33
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1Cl	ZINC000819392407	GH	On-Demand	Mild	CTSS	17	52
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1Cl	ZINC000819392407	GH	On-Demand	Mild	FPR1	44	38
CCOc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819392411	CH	On-Demand	Anodyne	ADRB2	31	45
CCOc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819392411	CH	On-Demand	Anodyne	ADRB1	40	45
CCOc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819392411	CH	On-Demand	Anodyne	ADRB3	62	53
CCOc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819392411	CH	On-Demand	Anodyne	CYP3A4	49	37
CCOc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819392412	CH	On-Demand	Anodyne	ADRB2	31	45
CCOc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819392412	CH	On-Demand	Anodyne	ADRB1	40	45
CCOc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819392412	CH	On-Demand	Anodyne	ADRB3	62	53
CCOc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819392412	CH	On-Demand	Anodyne	CYP3A4	49	37
COc1cc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc(OC)c1OC	ZINC000819392423	GF	On-Demand	Anodyne	ADRB2	35	45
COc1cc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc(OC)c1OC	ZINC000819392423	GF	On-Demand	Anodyne	ADRB1	52	40
COc1cc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc(OC)c1OC	ZINC000819392423	GF	On-Demand	Anodyne	MTNR1B	17	40
COc1cc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc(OC)c1OC	ZINC000819392423	GF	On-Demand	Anodyne	PTK2	44	36
COc1cc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc(OC)c1OC	ZINC000819392423	GF	On-Demand	Anodyne	ABCB1	27	44
COc1cc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc(OC)c1OC	ZINC000819392423	GF	On-Demand	Anodyne	SMO	18	40
COc1cc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc(OC)c1OC	ZINC000819392423	GF	On-Demand	Anodyne	PDS	56	37
COc1cc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc(OC)c1OC	ZINC000819392424	GF	On-Demand	Anodyne	ADRB2	35	45
COc1cc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc(OC)c1OC	ZINC000819392424	GF	On-Demand	Anodyne	ADRB1	52	40
COc1cc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc(OC)c1OC	ZINC000819392424	GF	On-Demand	Anodyne	MTNR1B	17	40
COc1cc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc(OC)c1OC	ZINC000819392424	GF	On-Demand	Anodyne	PTK2	44	36
COc1cc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc(OC)c1OC	ZINC000819392424	GF	On-Demand	Anodyne	ABCB1	27	44
COc1cc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc(OC)c1OC	ZINC000819392424	GF	On-Demand	Anodyne	SMO	18	40
COc1cc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc(OC)c1OC	ZINC000819392424	GF	On-Demand	Anodyne	PDS	56	37
COc1cc(NC[C@H](O)c2cccc(Cl)c2)cc(OC)c1OC	ZINC000819392437	EH	On-Demand	Anodyne	ADRB2	26	51
COc1cc(NC[C@H](O)c2cccc(Cl)c2)cc(OC)c1OC	ZINC000819392437	EH	On-Demand	Anodyne	ADRB1	38	51
COc1cc(NC[C@H](O)c2cccc(Cl)c2)cc(OC)c1OC	ZINC000819392437	EH	On-Demand	Anodyne	ADRB3	60	51
COc1cc(NC[C@H](O)c2cccc(Cl)c2)cc(OC)c1OC	ZINC000819392437	EH	On-Demand	Anodyne	CYP3A4	41	34
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)cc(OC)c1OC	ZINC000819392438	EH	On-Demand	Anodyne	ADRB2	26	51
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)cc(OC)c1OC	ZINC000819392438	EH	On-Demand	Anodyne	ADRB1	38	51
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)cc(OC)c1OC	ZINC000819392438	EH	On-Demand	Anodyne	ADRB3	60	51
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)cc(OC)c1OC	ZINC000819392438	EH	On-Demand	Anodyne	CYP3A4	41	34
COc1ccc(C)cc1NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819392439	FF	On-Demand	Anodyne	ADRB1	15	41
COc1ccc(C)cc1NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819392440	FF	On-Demand	Anodyne	ADRB1	15	41
C#Cc1cccc(NC(=O)CSc2ncnc3scc(-c4ccccc4)c23)c1	ZINC000819392442	HK	On-Demand	Mild	TGM2	15	41
COc1cc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc(OC)c1OC	ZINC000819392458	GF	On-Demand	Anodyne	ADRB2	48	59
COc1cc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc(OC)c1OC	ZINC000819392458	GF	On-Demand	Anodyne	ADRB1	74	59
COc1cc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc(OC)c1OC	ZINC000819392458	GF	On-Demand	Anodyne	TSHR	58	35
COc1cc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc(OC)c1OC	ZINC000819392458	GF	On-Demand	Anodyne	ADRB3	47	51
COc1cc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc(OC)c1OC	ZINC000819392458	GF	On-Demand	Anodyne	MTNR1A	18	40
COc1cc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc(OC)c1OC	ZINC000819392458	GF	On-Demand	Anodyne	MTNR1B	24	40
COc1cc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc(OC)c1OC	ZINC000819392458	GF	On-Demand	Anodyne	TUBB1	42	34
COc1cc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc(OC)c1OC	ZINC000819392458	GF	On-Demand	Anodyne	PDGFRA	46	35
COc1cc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc(OC)c1OC	ZINC000819392459	GF	On-Demand	Anodyne	ADRB2	48	59
COc1cc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc(OC)c1OC	ZINC000819392459	GF	On-Demand	Anodyne	ADRB1	74	59
COc1cc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc(OC)c1OC	ZINC000819392459	GF	On-Demand	Anodyne	TSHR	58	35
COc1cc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc(OC)c1OC	ZINC000819392459	GF	On-Demand	Anodyne	ADRB3	47	51
COc1cc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc(OC)c1OC	ZINC000819392459	GF	On-Demand	Anodyne	MTNR1A	18	40
COc1cc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc(OC)c1OC	ZINC000819392459	GF	On-Demand	Anodyne	MTNR1B	24	40
COc1cc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc(OC)c1OC	ZINC000819392459	GF	On-Demand	Anodyne	TUBB1	42	34
COc1cc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc(OC)c1OC	ZINC000819392459	GF	On-Demand	Anodyne	PDGFRA	46	35
CC(=O)Nc1cccc(CC(=O)NCc2c(C)cccc2C)c1	ZINC000819392471	DG	On-Demand	Anodyne	P2RX7	29	45
CC(=O)Nc1cccc(CC(=O)NCc2c(C)cccc2C)c1	ZINC000819392471	DG	On-Demand	Anodyne	KCNK3	86	39
CC(=O)Nc1cccc(CC(=O)NCc2c(C)cccc2C)c1	ZINC000819392471	DG	On-Demand	Anodyne	KCNK9	51	37
COc1cc(NC[C@H](O)COc2cccc3[nH]ccc23)cc(OC)c1OC	ZINC000819392478	FG	On-Demand	Anodyne	ADRB2	26	63
COc1cc(NC[C@H](O)COc2cccc3[nH]ccc23)cc(OC)c1OC	ZINC000819392478	FG	On-Demand	Anodyne	ADRB1	33	63
COc1cc(NC[C@H](O)COc2cccc3[nH]ccc23)cc(OC)c1OC	ZINC000819392478	FG	On-Demand	Anodyne	HTR1A	15	63
COc1cc(NC[C@H](O)COc2cccc3[nH]ccc23)cc(OC)c1OC	ZINC000819392478	FG	On-Demand	Anodyne	SLC6A4	16	47
COc1cc(NC[C@H](O)COc2cccc3[nH]ccc23)cc(OC)c1OC	ZINC000819392478	FG	On-Demand	Anodyne	CYP2D6	20	45
COc1cc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc(OC)c1OC	ZINC000819392479	FG	On-Demand	Anodyne	ADRB2	26	63
COc1cc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc(OC)c1OC	ZINC000819392479	FG	On-Demand	Anodyne	ADRB1	33	63
COc1cc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc(OC)c1OC	ZINC000819392479	FG	On-Demand	Anodyne	HTR1A	15	63
COc1cc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc(OC)c1OC	ZINC000819392479	FG	On-Demand	Anodyne	SLC6A4	16	47
COc1cc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc(OC)c1OC	ZINC000819392479	FG	On-Demand	Anodyne	CYP2D6	20	45
COc1ccc(C)cc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819392480	EG	On-Demand	Anodyne	ADRB2	34	49
COc1ccc(C)cc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819392480	EG	On-Demand	Anodyne	ADRB1	32	49
COc1ccc(C)cc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819392480	EG	On-Demand	Anodyne	ABCB1	24	45
COc1ccc(C)cc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819392481	EG	On-Demand	Anodyne	ADRB2	34	49
COc1ccc(C)cc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819392481	EG	On-Demand	Anodyne	ADRB1	32	49
COc1ccc(C)cc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819392481	EG	On-Demand	Anodyne	ABCB1	24	45
CCOc1ccccc1NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819392485	FH	On-Demand	Anodyne	HCN1	71	40
CCOc1ccccc1NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819392485	FH	On-Demand	Anodyne	HCN4	58	39
CCOc1ccccc1NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819392486	FH	On-Demand	Anodyne	HCN1	71	40
CCOc1ccccc1NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819392486	FH	On-Demand	Anodyne	HCN4	58	39
CCOc1ccccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819392510	FH	On-Demand	Anodyne	CCR8	34	41
CCOc1ccccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819392510	FH	On-Demand	Anodyne	GPR119	61	50
CCOc1ccccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819392510	FH	On-Demand	Anodyne	HCN1	49	32
CCOc1ccccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819392510	FH	On-Demand	Anodyne	HCN4	42	32
CCOc1ccccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819392511	FH	On-Demand	Anodyne	CCR8	34	41
CCOc1ccccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819392511	FH	On-Demand	Anodyne	GPR119	61	50
CCOc1ccccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819392511	FH	On-Demand	Anodyne	HCN1	49	32
CCOc1ccccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819392511	FH	On-Demand	Anodyne	HCN4	42	32
COc1cc(NC[C@H](O)COc2cc(C)ccc2Cl)cc(OC)c1OC	ZINC000819392513	GH	On-Demand	Anodyne	ADRB2	17	46
COc1cc(NC[C@@H](O)COc2cc(C)ccc2Cl)cc(OC)c1OC	ZINC000819392514	GH	On-Demand	Anodyne	ADRB2	17	46
COc1ccc(C)cc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819392517	EF	On-Demand	Mild	ADRB2	31	45
COc1ccc(C)cc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819392517	EF	On-Demand	Mild	ADRB1	32	41
COc1ccc(C)cc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819392517	EF	On-Demand	Mild	ADRB3	16	40
COc1ccc(C)cc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819392518	EF	On-Demand	Mild	ADRB2	31	45
COc1ccc(C)cc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819392518	EF	On-Demand	Mild	ADRB1	32	41
COc1ccc(C)cc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819392518	EF	On-Demand	Mild	ADRB3	16	40
COc1cccc([S@@](=O)CC(=O)NCc2c(C)cccc2C)c1	ZINC000819392526	EF	On-Demand	Anodyne	DRD4	40	31
COc1cccc([S@@](=O)CC(=O)NCc2c(C)cccc2C)c1	ZINC000819392526	EF	On-Demand	Anodyne	MTNR1A	68	39
COc1cccc([S@@](=O)CC(=O)NCc2c(C)cccc2C)c1	ZINC000819392526	EF	On-Demand	Anodyne	MTNR1B	69	39
CCOc1ccccc1NC[C@H](O)C1CCCCC1	ZINC000819392531	CG	On-Demand	Anodyne	AMY2	46	31
CCOc1ccccc1NC[C@H](O)C1CCCCC1	ZINC000819392531	CG	On-Demand	Anodyne	HCN1	51	36
CCOc1ccccc1NC[C@H](O)C1CCCCC1	ZINC000819392531	CG	On-Demand	Anodyne	HCN4	46	36
CCOc1ccccc1NC[C@@H](O)C1CCCCC1	ZINC000819392532	CG	On-Demand	Anodyne	AMY2	46	31
CCOc1ccccc1NC[C@@H](O)C1CCCCC1	ZINC000819392532	CG	On-Demand	Anodyne	HCN1	51	36
CCOc1ccccc1NC[C@@H](O)C1CCCCC1	ZINC000819392532	CG	On-Demand	Anodyne	HCN4	46	36
CCOc1ccc(OC[C@@H](O)CNc2ccccc2OCC)cc1	ZINC000819392539	EG	On-Demand	Clean	ADRB2	63	48
CCOc1ccc(OC[C@@H](O)CNc2ccccc2OCC)cc1	ZINC000819392539	EG	On-Demand	Clean	ADRB1	83	45
CCOc1ccc(OC[C@@H](O)CNc2ccccc2OCC)cc1	ZINC000819392539	EG	On-Demand	Clean	ADRB3	44	42
CCOc1ccc(OC[C@@H](O)CNc2ccccc2OCC)cc1	ZINC000819392539	EG	On-Demand	Clean	ABCB1	27	42
CCOc1ccc(OC[C@@H](O)CNc2ccccc2OCC)cc1	ZINC000819392539	EG	On-Demand	Clean	PDS	50	36
CCOc1ccc(OC[C@H](O)CNc2ccccc2OCC)cc1	ZINC000819392540	EG	On-Demand	Clean	ADRB2	63	48
CCOc1ccc(OC[C@H](O)CNc2ccccc2OCC)cc1	ZINC000819392540	EG	On-Demand	Clean	ADRB1	83	45
CCOc1ccc(OC[C@H](O)CNc2ccccc2OCC)cc1	ZINC000819392540	EG	On-Demand	Clean	ADRB3	44	42
CCOc1ccc(OC[C@H](O)CNc2ccccc2OCC)cc1	ZINC000819392540	EG	On-Demand	Clean	ABCB1	27	42
CCOc1ccc(OC[C@H](O)CNc2ccccc2OCC)cc1	ZINC000819392540	EG	On-Demand	Clean	PDS	50	36
COc1cc(NC[C@H](O)COc2ccc(C(C)(C)C)cc2)cc(OC)c1OC	ZINC000819392547	GH	On-Demand	Anodyne	ADRB2	37	40
COc1cc(NC[C@H](O)COc2ccc(C(C)(C)C)cc2)cc(OC)c1OC	ZINC000819392547	GH	On-Demand	Anodyne	ADRB1	43	41
COc1cc(NC[C@H](O)COc2ccc(C(C)(C)C)cc2)cc(OC)c1OC	ZINC000819392547	GH	On-Demand	Anodyne	ADRB3	24	40
COc1cc(NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)cc(OC)c1OC	ZINC000819392548	GH	On-Demand	Anodyne	ADRB2	37	40
COc1cc(NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)cc(OC)c1OC	ZINC000819392548	GH	On-Demand	Anodyne	ADRB1	43	41
COc1cc(NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)cc(OC)c1OC	ZINC000819392548	GH	On-Demand	Anodyne	ADRB3	24	40
CC(C)c1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819392549	DH	On-Demand	Bother	ADRB2	16	43
CC(C)c1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819392549	DH	On-Demand	Bother	ADRB1	17	43
CC(C)c1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819392549	DH	On-Demand	Bother	CACNA1D	43	34
CC(C)c1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819392550	DH	On-Demand	Bother	ADRB2	16	43
CC(C)c1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819392550	DH	On-Demand	Bother	ADRB1	17	43
CC(C)c1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819392550	DH	On-Demand	Bother	CACNA1D	43	34
COc1cc(NC[C@@H](O)CCc2ccccc2)cc(OC)c1OC	ZINC000819392551	EG	On-Demand	Anodyne	ABCB1	33	42
COc1cc(NC[C@H](O)CCc2ccccc2)cc(OC)c1OC	ZINC000819392552	EG	On-Demand	Anodyne	ABCB1	33	42
CC(C)c1ccc(NC[C@@](C)(O)CNC(=O)OC(C)(C)C)cc1	ZINC000819392554	DG	On-Demand	Anodyne	CTSK	16	40
CC(C)c1ccc(NC[C@](C)(O)CNC(=O)OC(C)(C)C)cc1	ZINC000819392555	DG	On-Demand	Anodyne	CTSK	16	40
CCOc1ccccc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819392558	EF	On-Demand	Clean	HCN1	41	36
CCOc1ccccc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819392558	EF	On-Demand	Clean	NOD2	44	42
CCOc1ccccc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819392559	EF	On-Demand	Clean	HCN1	41	36
CCOc1ccccc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819392559	EF	On-Demand	Clean	NOD2	44	42
CCOc1ccccc1NC[C@H](O)COCc1ccc(OC)cc1	ZINC000819392561	EG	On-Demand	Clean	ADRB2	37	44
CCOc1ccccc1NC[C@H](O)COCc1ccc(OC)cc1	ZINC000819392561	EG	On-Demand	Clean	ADRB1	35	40
CCOc1ccccc1NC[C@H](O)COCc1ccc(OC)cc1	ZINC000819392561	EG	On-Demand	Clean	ADRB3	24	44
CCOc1ccccc1NC[C@@H](O)COCc1ccc(OC)cc1	ZINC000819392562	EG	On-Demand	Clean	ADRB2	37	44
CCOc1ccccc1NC[C@@H](O)COCc1ccc(OC)cc1	ZINC000819392562	EG	On-Demand	Clean	ADRB1	35	40
CCOc1ccccc1NC[C@@H](O)COCc1ccc(OC)cc1	ZINC000819392562	EG	On-Demand	Clean	ADRB3	24	44
COc1ccc(C)cc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819392563	EF	On-Demand	Anodyne	ABCB1B	46	35
COc1ccc(C)cc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819392564	EF	On-Demand	Anodyne	ABCB1B	46	35
COc1ccc(C)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392568	EF	On-Demand	Anodyne	ADRB2	49	59
COc1ccc(C)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392568	EF	On-Demand	Anodyne	ADRB1	71	59
COc1ccc(C)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392568	EF	On-Demand	Anodyne	TSHR	60	37
COc1ccc(C)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392568	EF	On-Demand	Anodyne	ADRB3	44	48
COc1ccc(C)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392568	EF	On-Demand	Anodyne	PDGFRA	47	38
COc1ccc(C)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392569	EF	On-Demand	Anodyne	ADRB2	49	59
COc1ccc(C)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392569	EF	On-Demand	Anodyne	ADRB1	71	59
COc1ccc(C)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392569	EF	On-Demand	Anodyne	TSHR	60	37
COc1ccc(C)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392569	EF	On-Demand	Anodyne	ADRB3	44	48
COc1ccc(C)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392569	EF	On-Demand	Anodyne	PDGFRA	47	38
CCOc1ccccc1NC[C@H](O)COCc1ccccc1OC	ZINC000819392571	EG	On-Demand	Clean	ADRB2	24	40
CCOc1ccccc1NC[C@@H](O)COCc1ccccc1OC	ZINC000819392572	EG	On-Demand	Clean	ADRB2	24	40
CCOc1ccccc1NC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819392575	EI	On-Demand	Anodyne	KCNK3	19	45
CCOc1ccccc1NC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819392575	EI	On-Demand	Anodyne	KCNK9	19	45
CCOc1ccccc1NC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819392576	EI	On-Demand	Anodyne	KCNK3	19	45
CCOc1ccccc1NC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819392576	EI	On-Demand	Anodyne	KCNK9	19	45
CCOc1ccccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392582	EF	On-Demand	Clean	ADRB2	59	59
CCOc1ccccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392582	EF	On-Demand	Clean	ADRB1	91	59
CCOc1ccccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392582	EF	On-Demand	Clean	TSHR	47	32
CCOc1ccccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392582	EF	On-Demand	Clean	ADRB3	54	51
CCOc1ccccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392582	EF	On-Demand	Clean	CA1	17	49
CCOc1ccccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392582	EF	On-Demand	Clean	ABCB1	24	42
CCOc1ccccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392583	EF	On-Demand	Clean	ADRB2	59	59
CCOc1ccccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392583	EF	On-Demand	Clean	ADRB1	91	59
CCOc1ccccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392583	EF	On-Demand	Clean	TSHR	47	32
CCOc1ccccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392583	EF	On-Demand	Clean	ADRB3	54	51
CCOc1ccccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392583	EF	On-Demand	Clean	CA1	17	49
CCOc1ccccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819392583	EF	On-Demand	Clean	ABCB1	24	42
COc1ccc(C)cc1NC[C@H](O)COc1ccc(SC)cc1	ZINC000819392600	EH	On-Demand	Anodyne	ADRB2	29	48
COc1ccc(C)cc1NC[C@H](O)COc1ccc(SC)cc1	ZINC000819392600	EH	On-Demand	Anodyne	ADRB1	24	42
COc1ccc(C)cc1NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819392601	EH	On-Demand	Anodyne	ADRB2	29	48
COc1ccc(C)cc1NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819392601	EH	On-Demand	Anodyne	ADRB1	24	42
CCOc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819392604	EG	On-Demand	Mild	ADRB2	50	43
CCOc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819392604	EG	On-Demand	Mild	ADRB1	74	38
CCOc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819392604	EG	On-Demand	Mild	ADRB3	39	43
CCOc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819392604	EG	On-Demand	Mild	CASR	44	40
CCOc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819392604	EG	On-Demand	Mild	CYP2D6	19	43
CCOc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819392605	EG	On-Demand	Mild	ADRB2	50	43
CCOc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819392605	EG	On-Demand	Mild	ADRB1	74	38
CCOc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819392605	EG	On-Demand	Mild	ADRB3	39	43
CCOc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819392605	EG	On-Demand	Mild	CASR	44	40
CCOc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819392605	EG	On-Demand	Mild	CYP2D6	19	43
COCCc1ccc(OC[C@@H](O)CNc2cc(C)ccc2OC)cc1	ZINC000819392615	EG	On-Demand	Anodyne	ADRB2	45	61
COCCc1ccc(OC[C@@H](O)CNc2cc(C)ccc2OC)cc1	ZINC000819392615	EG	On-Demand	Anodyne	ADRB1	55	61
COCCc1ccc(OC[C@@H](O)CNc2cc(C)ccc2OC)cc1	ZINC000819392615	EG	On-Demand	Anodyne	ADRB3	35	45
COCCc1ccc(OC[C@H](O)CNc2cc(C)ccc2OC)cc1	ZINC000819392616	EG	On-Demand	Anodyne	ADRB2	45	61
COCCc1ccc(OC[C@H](O)CNc2cc(C)ccc2OC)cc1	ZINC000819392616	EG	On-Demand	Anodyne	ADRB1	55	61
COCCc1ccc(OC[C@H](O)CNc2cc(C)ccc2OC)cc1	ZINC000819392616	EG	On-Demand	Anodyne	ADRB3	35	45
CCOc1ccccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819392617	CD	On-Demand	Clean	ADRB2	20	43
CCOc1ccccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819392617	CD	On-Demand	Clean	ABCB1	69	41
CCOc1ccccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819392617	CD	On-Demand	Clean	HCN1	63	40
CCOc1ccccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819392617	CD	On-Demand	Clean	HCN4	42	35
CCOc1ccccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819392618	CD	On-Demand	Clean	ADRB2	20	43
CCOc1ccccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819392618	CD	On-Demand	Clean	ABCB1	69	41
CCOc1ccccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819392618	CD	On-Demand	Clean	HCN1	63	40
CCOc1ccccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819392618	CD	On-Demand	Clean	HCN4	42	35
C#Cc1cccc(NC(=O)c2cc(S(=O)(=O)N3CCN(CC)CC3)ccc2Cl)c1	ZINC000819392638	IF	On-Demand	Mild	ITGA4	44	32
C#Cc1cccc(NC(=O)c2cc(S(=O)(=O)N3CCN(CC)CC3)ccc2Cl)c1	ZINC000819392638	IF	On-Demand	Mild	F13A1	51	36
C#Cc1cccc(NC(=O)c2cc(S(=O)(=O)N3CCN(CC)CC3)ccc2Cl)c1	ZINC000819392638	IF	On-Demand	Mild	NR2E3	59	31
COc1ccccc1COC[C@@H](O)CNc1cc(C)ccc1OC	ZINC000819392645	EG	On-Demand	Anodyne	ADRB2	20	41
COc1ccccc1COC[C@H](O)CNc1cc(C)ccc1OC	ZINC000819392646	EG	On-Demand	Anodyne	ADRB2	20	41
O=C(NCC[C@@H]1COc2ccccc2O1)C(F)=C1CCC1	ZINC000819392647	CF	On-Demand	Anodyne	ADRA2B	15	41
O=C(NCC[C@H]1COc2ccccc2O1)C(F)=C1CCC1	ZINC000819392648	CF	On-Demand	Anodyne	ADRA2B	15	41
COc1cc(NCCC(=O)Nc2cccc(F)c2C)cc(OC)c1OC	ZINC000819392649	FH	On-Demand	Anodyne	PTK2	42	35
COc1ccc(C)cc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819392650	DG	On-Demand	Bother	CACNA1C	49	37
COc1ccc(C)cc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819392650	DG	On-Demand	Bother	TBXA2R	16	41
COc1ccc(C)cc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819392650	DG	On-Demand	Bother	CACNA1D	75	37
COc1ccc(C)cc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819392650	DG	On-Demand	Bother	KCNMA1	24	41
COc1ccc(C)cc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819392651	DG	On-Demand	Bother	CACNA1C	49	37
COc1ccc(C)cc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819392651	DG	On-Demand	Bother	TBXA2R	16	41
COc1ccc(C)cc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819392651	DG	On-Demand	Bother	CACNA1D	75	37
COc1ccc(C)cc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819392651	DG	On-Demand	Bother	KCNMA1	24	41
COc1ccc(C)cc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819392656	EG	On-Demand	Anodyne	ADRB2	29	64
COc1ccc(C)cc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819392656	EG	On-Demand	Anodyne	ADRB1	31	64
COc1ccc(C)cc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819392656	EG	On-Demand	Anodyne	HTR1A	16	64
COc1ccc(C)cc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819392656	EG	On-Demand	Anodyne	SLC6A4	18	45
COc1ccc(C)cc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819392656	EG	On-Demand	Anodyne	CYP2D6	21	43
COc1ccc(C)cc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819392657	EG	On-Demand	Anodyne	ADRB2	29	64
COc1ccc(C)cc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819392657	EG	On-Demand	Anodyne	ADRB1	31	64
COc1ccc(C)cc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819392657	EG	On-Demand	Anodyne	HTR1A	16	64
COc1ccc(C)cc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819392657	EG	On-Demand	Anodyne	SLC6A4	18	45
COc1ccc(C)cc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819392657	EG	On-Demand	Anodyne	CYP2D6	21	43
COc1cc(NC[C@H](O)COc2ccccc2C(C)C)cc(OC)c1OC	ZINC000819392662	GH	On-Demand	Anodyne	ADRB2	36	50
COc1cc(NC[C@H](O)COc2ccccc2C(C)C)cc(OC)c1OC	ZINC000819392662	GH	On-Demand	Anodyne	ABCB1	23	41
COc1cc(NC[C@@H](O)COc2ccccc2C(C)C)cc(OC)c1OC	ZINC000819392663	GH	On-Demand	Anodyne	ADRB2	36	50
COc1cc(NC[C@@H](O)COc2ccccc2C(C)C)cc(OC)c1OC	ZINC000819392663	GH	On-Demand	Anodyne	ABCB1	23	41
CCOc1ccccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819392671	EG	On-Demand	Clean	ADRB2	40	46
CCOc1ccccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819392671	EG	On-Demand	Clean	ADRB1	69	41
CCOc1ccccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819392671	EG	On-Demand	Clean	CASR	41	36
CCOc1ccccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819392671	EG	On-Demand	Clean	ABCB1	37	47
CCOc1ccccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819392671	EG	On-Demand	Clean	PDS	77	42
CCOc1ccccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819392672	EG	On-Demand	Clean	ADRB2	40	46
CCOc1ccccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819392672	EG	On-Demand	Clean	ADRB1	69	41
CCOc1ccccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819392672	EG	On-Demand	Clean	CASR	41	36
CCOc1ccccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819392672	EG	On-Demand	Clean	ABCB1	37	47
CCOc1ccccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819392672	EG	On-Demand	Clean	PDS	77	42
CCOc1ccccc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819392675	EF	On-Demand	Clean	ADRB2	31	40
CCOc1ccccc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819392675	EF	On-Demand	Clean	EDNRB	40	38
CCOc1ccccc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819392675	EF	On-Demand	Clean	EDNRA	43	38
CCOc1ccccc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819392676	EF	On-Demand	Clean	ADRB2	31	40
CCOc1ccccc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819392676	EF	On-Demand	Clean	EDNRB	40	38
CCOc1ccccc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819392676	EF	On-Demand	Clean	EDNRA	43	38
CCOc1ccccc1NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819392677	FF	On-Demand	Clean	ADRB2	24	41
CCOc1ccccc1NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819392677	FF	On-Demand	Clean	ADRB1	27	46
CCOc1ccccc1NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819392678	FF	On-Demand	Clean	ADRB2	24	41
CCOc1ccccc1NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819392678	FF	On-Demand	Clean	ADRB1	27	46
CCOc1ccccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819392683	EG	On-Demand	Clean	ADRB2	32	65
CCOc1ccccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819392683	EG	On-Demand	Clean	ADRB1	59	65
CCOc1ccccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819392683	EG	On-Demand	Clean	ADRB3	15	65
CCOc1ccccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819392683	EG	On-Demand	Clean	CYP2D6	21	48
CCOc1ccccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819392684	EG	On-Demand	Clean	ADRB2	32	65
CCOc1ccccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819392684	EG	On-Demand	Clean	ADRB1	59	65
CCOc1ccccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819392684	EG	On-Demand	Clean	ADRB3	15	65
CCOc1ccccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819392684	EG	On-Demand	Clean	CYP2D6	21	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(OC)c(Cl)c1)C2	ZINC000819392687	FF	On-Demand	Anodyne	PDE5A	48	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(OC)c(Cl)c1)C2	ZINC000819392687	FF	On-Demand	Anodyne	P2RX7	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(OC)c(Cl)c1)C2	ZINC000819392687	FF	On-Demand	Anodyne	PDE6A	46	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(OC)c(Cl)c1)C2	ZINC000819392688	FF	On-Demand	Anodyne	PDE5A	48	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(OC)c(Cl)c1)C2	ZINC000819392688	FF	On-Demand	Anodyne	P2RX7	16	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(OC)c(Cl)c1)C2	ZINC000819392688	FF	On-Demand	Anodyne	PDE6A	46	35
C#Cc1cccc(NC(=O)CCCOc2cccc(Br)c2)c1	ZINC000819392692	FI	On-Demand	Mild	HDAC10	32	41
C#Cc1cccc(NC(=O)CCCOc2cccc(Br)c2)c1	ZINC000819392692	FI	On-Demand	Mild	HDAC1	17	43
C#Cc1cccc(NC(=O)CCCOc2cccc(Br)c2)c1	ZINC000819392692	FI	On-Demand	Mild	HDAC2	20	43
C#Cc1cccc(NC(=O)CCCOc2cccc(Br)c2)c1	ZINC000819392692	FI	On-Demand	Mild	HDAC3	37	41
C#Cc1cccc(NC(=O)CCCOc2cccc(Br)c2)c1	ZINC000819392692	FI	On-Demand	Mild	HDAC6	30	41
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392693	FE	On-Demand	Anodyne	HTR1A	54	55
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392693	FE	On-Demand	Anodyne	DRD2	41	55
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392693	FE	On-Demand	Anodyne	DRD4	51	42
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392693	FE	On-Demand	Anodyne	HTR2A	39	52
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392693	FE	On-Demand	Anodyne	HTR2C	20	44
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392693	FE	On-Demand	Anodyne	DRD3	64	45
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392693	FE	On-Demand	Anodyne	HTR7	39	43
O=C(/C=C/[C@@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392693	FE	On-Demand	Anodyne	PLD2	48	37
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392694	FE	On-Demand	Anodyne	HTR1A	54	55
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392694	FE	On-Demand	Anodyne	DRD2	41	55
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392694	FE	On-Demand	Anodyne	DRD4	51	42
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392694	FE	On-Demand	Anodyne	HTR2A	39	52
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392694	FE	On-Demand	Anodyne	HTR2C	20	44
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392694	FE	On-Demand	Anodyne	DRD3	64	45
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392694	FE	On-Demand	Anodyne	HTR7	39	43
O=C(/C=C\[C@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392694	FE	On-Demand	Anodyne	PLD2	48	37
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392695	FE	On-Demand	Anodyne	HTR1A	54	55
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392695	FE	On-Demand	Anodyne	DRD2	41	55
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392695	FE	On-Demand	Anodyne	DRD4	51	42
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392695	FE	On-Demand	Anodyne	HTR2A	39	52
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392695	FE	On-Demand	Anodyne	HTR2C	20	44
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392695	FE	On-Demand	Anodyne	DRD3	64	45
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392695	FE	On-Demand	Anodyne	HTR7	39	43
O=C(/C=C/[C@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392695	FE	On-Demand	Anodyne	PLD2	48	37
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392696	FE	On-Demand	Anodyne	HTR1A	54	55
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392696	FE	On-Demand	Anodyne	DRD2	41	55
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392696	FE	On-Demand	Anodyne	DRD4	51	42
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392696	FE	On-Demand	Anodyne	HTR2A	39	52
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392696	FE	On-Demand	Anodyne	HTR2C	20	44
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392696	FE	On-Demand	Anodyne	DRD3	64	45
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392696	FE	On-Demand	Anodyne	HTR7	39	43
O=C(/C=C\[C@@H]1CCCO1)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819392696	FE	On-Demand	Anodyne	PLD2	48	37
COc1ccc(C)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819392697	CG	On-Demand	Anodyne	ADRB2	18	40
COc1ccc(C)cc1NC[C@H](O)CCc1ccccc1	ZINC000819392698	CG	On-Demand	Anodyne	ADRB2	18	40
COc1cc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc(OC)c1OC	ZINC000819392701	GE	On-Demand	Anodyne	EDNRB	45	42
COc1cc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc(OC)c1OC	ZINC000819392701	GE	On-Demand	Anodyne	EDNRA	50	43
COc1cc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc(OC)c1OC	ZINC000819392702	GE	On-Demand	Anodyne	EDNRB	45	42
COc1cc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc(OC)c1OC	ZINC000819392702	GE	On-Demand	Anodyne	EDNRA	50	43
CCOc1ccccc1NC[C@@H](O)CN1CCCC1=O	ZINC000819392703	CD	On-Demand	Clean	HCN1	51	34
CCOc1ccccc1NC[C@@H](O)CN1CCCC1=O	ZINC000819392703	CD	On-Demand	Clean	HCN4	43	34
CCOc1ccccc1NC[C@H](O)CN1CCCC1=O	ZINC000819392704	CD	On-Demand	Clean	HCN1	51	34
CCOc1ccccc1NC[C@H](O)CN1CCCC1=O	ZINC000819392704	CD	On-Demand	Clean	HCN4	43	34
CCOc1ccccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819392707	EF	On-Demand	Clean	ADRB2	28	45
CCOc1ccccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819392707	EF	On-Demand	Clean	ADRB1	62	38
CCOc1ccccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819392707	EF	On-Demand	Clean	COLA	72	32
CCOc1ccccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819392708	EF	On-Demand	Clean	ADRB2	28	45
CCOc1ccccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819392708	EF	On-Demand	Clean	ADRB1	62	38
CCOc1ccccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819392708	EF	On-Demand	Clean	COLA	72	32
CCOc1ccccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819392721	DG	On-Demand	Bother	ADRB1	18	40
CCOc1ccccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819392721	DG	On-Demand	Bother	CACNA1C	53	37
CCOc1ccccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819392721	DG	On-Demand	Bother	ADRB3	40	40
CCOc1ccccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819392721	DG	On-Demand	Bother	CACNA1D	82	36
CCOc1ccccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819392722	DG	On-Demand	Bother	ADRB1	18	40
CCOc1ccccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819392722	DG	On-Demand	Bother	CACNA1C	53	37
CCOc1ccccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819392722	DG	On-Demand	Bother	ADRB3	40	40
CCOc1ccccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819392722	DG	On-Demand	Bother	CACNA1D	82	36
COc1cc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc(OC)c1OC	ZINC000819392723	GE	On-Demand	Bother	ADRB2	24	40
COc1cc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc(OC)c1OC	ZINC000819392723	GE	On-Demand	Bother	ADRB1	57	36
COc1cc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc(OC)c1OC	ZINC000819392723	GE	On-Demand	Bother	ABCB1	15	42
COc1cc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc(OC)c1OC	ZINC000819392724	GE	On-Demand	Bother	ADRB2	24	40
COc1cc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc(OC)c1OC	ZINC000819392724	GE	On-Demand	Bother	ADRB1	57	36
COc1cc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc(OC)c1OC	ZINC000819392724	GE	On-Demand	Bother	ABCB1	15	42
C#Cc1cccc(NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccccc2)c1	ZINC000819392729	GH	On-Demand	Mild	OPRD1	56	39
C#Cc1cccc(NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccccc2)c1	ZINC000819392729	GH	On-Demand	Mild	CFTR	97	58
C#Cc1cccc(NC(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccccc2)c1	ZINC000819392729	GH	On-Demand	Mild	KCNK3	41	39
COc1cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1OC	ZINC000819392739	EF	On-Demand	Bother	CACNA1C	43	35
COc1cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1OC	ZINC000819392739	EF	On-Demand	Bother	CACNA1D	66	34
COc1cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1OC	ZINC000819392740	EF	On-Demand	Bother	CACNA1C	43	35
COc1cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1OC	ZINC000819392740	EF	On-Demand	Bother	CACNA1D	66	34
CCOc1ccc(OC[C@@H](O)CNc2cc(C)ccc2OC)cc1	ZINC000819392744	EG	On-Demand	Anodyne	ADRB2	36	51
CCOc1ccc(OC[C@@H](O)CNc2cc(C)ccc2OC)cc1	ZINC000819392744	EG	On-Demand	Anodyne	ADRB1	30	44
CCOc1ccc(OC[C@H](O)CNc2cc(C)ccc2OC)cc1	ZINC000819392745	EG	On-Demand	Anodyne	ADRB2	36	51
CCOc1ccc(OC[C@H](O)CNc2cc(C)ccc2OC)cc1	ZINC000819392745	EG	On-Demand	Anodyne	ADRB1	30	44
CCOc1ccccc1NC[C@@H](O)CCc1ccccc1	ZINC000819392756	CG	On-Demand	Clean	ADRB2	22	41
CCOc1ccccc1NC[C@@H](O)CCc1ccccc1	ZINC000819392756	CG	On-Demand	Clean	ADRB1	17	41
CCOc1ccccc1NC[C@@H](O)CCc1ccccc1	ZINC000819392756	CG	On-Demand	Clean	ABCB1	40	42
CCOc1ccccc1NC[C@H](O)CCc1ccccc1	ZINC000819392757	CG	On-Demand	Clean	ADRB2	22	41
CCOc1ccccc1NC[C@H](O)CCc1ccccc1	ZINC000819392757	CG	On-Demand	Clean	ADRB1	17	41
CCOc1ccccc1NC[C@H](O)CCc1ccccc1	ZINC000819392757	CG	On-Demand	Clean	ABCB1	40	42
COc1ccc(C)cc1NC[C@H](O)COc1c(OC)cccc1OC	ZINC000819392762	EF	On-Demand	Anodyne	ADRB2	36	50
COc1ccc(C)cc1NC[C@H](O)COc1c(OC)cccc1OC	ZINC000819392762	EF	On-Demand	Anodyne	ADRB1	25	46
COc1ccc(C)cc1NC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819392763	EF	On-Demand	Anodyne	ADRB2	36	50
COc1ccc(C)cc1NC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819392763	EF	On-Demand	Anodyne	ADRB1	25	46
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1c(C)cccc1C)C2	ZINC000819392765	EF	On-Demand	Anodyne	P2RX7	19	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1c(C)cccc1C)C2	ZINC000819392766	EF	On-Demand	Anodyne	P2RX7	19	41
COc1cc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc(OC)c1OC	ZINC000819392769	GH	On-Demand	Anodyne	ADRB2	17	40
COc1cc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc(OC)c1OC	ZINC000819392769	GH	On-Demand	Anodyne	GRIN2B	15	40
COc1cc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc(OC)c1OC	ZINC000819392770	GH	On-Demand	Anodyne	ADRB2	17	40
COc1cc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc(OC)c1OC	ZINC000819392770	GH	On-Demand	Anodyne	GRIN2B	15	40
COc1ccc(C)cc1NC[C@@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819392771	FG	On-Demand	Anodyne	ADRB2	48	44
COc1ccc(C)cc1NC[C@@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819392771	FG	On-Demand	Anodyne	ADRB1	62	52
COc1ccc(C)cc1NC[C@@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819392771	FG	On-Demand	Anodyne	ADRB3	44	43
COc1ccc(C)cc1NC[C@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819392772	FG	On-Demand	Anodyne	ADRB2	48	44
COc1ccc(C)cc1NC[C@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819392772	FG	On-Demand	Anodyne	ADRB1	62	52
COc1ccc(C)cc1NC[C@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819392772	FG	On-Demand	Anodyne	ADRB3	44	43
CCOc1ccccc1NC[C@@H](O)COC1CCOCC1	ZINC000819392775	CE	On-Demand	Clean	ADRB2	24	40
CCOc1ccccc1NC[C@@H](O)COC1CCOCC1	ZINC000819392775	CE	On-Demand	Clean	ADRB1	28	42
CCOc1ccccc1NC[C@H](O)COC1CCOCC1	ZINC000819392776	CE	On-Demand	Clean	ADRB2	24	40
CCOc1ccccc1NC[C@H](O)COC1CCOCC1	ZINC000819392776	CE	On-Demand	Clean	ADRB1	28	42
CCOc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392781	GF	On-Demand	Clean	ADRB2	15	43
CCOc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392781	GF	On-Demand	Clean	HTR1A	42	42
CCOc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392781	GF	On-Demand	Clean	DRD2	30	42
CCOc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392781	GF	On-Demand	Clean	DRD4	44	35
CCOc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392781	GF	On-Demand	Clean	ADRA1D	21	45
CCOc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392781	GF	On-Demand	Clean	HTR2A	24	47
CCOc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392781	GF	On-Demand	Clean	HTR2C	15	47
CCOc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392781	GF	On-Demand	Clean	ADRA1A	19	45
CCOc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392781	GF	On-Demand	Clean	DRD3	41	42
CCOc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392781	GF	On-Demand	Clean	HTR7	37	41
CCOc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392781	GF	On-Demand	Clean	ACOX1	41	34
CCOc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392781	GF	On-Demand	Clean	ABCB1	76	48
CCOc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392782	GF	On-Demand	Clean	ADRB2	15	43
CCOc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392782	GF	On-Demand	Clean	HTR1A	42	42
CCOc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392782	GF	On-Demand	Clean	DRD2	30	42
CCOc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392782	GF	On-Demand	Clean	DRD4	44	35
CCOc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392782	GF	On-Demand	Clean	ADRA1D	21	45
CCOc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392782	GF	On-Demand	Clean	HTR2A	24	47
CCOc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392782	GF	On-Demand	Clean	HTR2C	15	47
CCOc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392782	GF	On-Demand	Clean	ADRA1A	19	45
CCOc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392782	GF	On-Demand	Clean	DRD3	41	42
CCOc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392782	GF	On-Demand	Clean	HTR7	37	41
CCOc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392782	GF	On-Demand	Clean	ACOX1	41	34
CCOc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819392782	GF	On-Demand	Clean	ABCB1	76	48
CCOc1ccccc1NCC1(O)CCOCC1	ZINC000819392785	CE	On-Demand	Anodyne	HCN1	55	44
CCOc1ccccc1NCC1(O)CCOCC1	ZINC000819392785	CE	On-Demand	Anodyne	HCN4	45	35
CCOc1ccccc1NC[C@@H](O)C1CC1	ZINC000819392788	BE	On-Demand	Anodyne	HCN1	48	32
CCOc1ccccc1NC[C@@H](O)C1CC1	ZINC000819392788	BE	On-Demand	Anodyne	HCN4	42	32
CCOc1ccccc1NC[C@H](O)C1CC1	ZINC000819392789	BE	On-Demand	Anodyne	HCN1	48	32
CCOc1ccccc1NC[C@H](O)C1CC1	ZINC000819392789	BE	On-Demand	Anodyne	HCN4	42	32
CCOc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819392791	CF	On-Demand	Anodyne	ADRB2	22	42
CCOc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819392791	CF	On-Demand	Anodyne	ADRB1	23	42
CCOc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819392791	CF	On-Demand	Anodyne	ADRB3	75	42
CCOc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819392792	CF	On-Demand	Anodyne	ADRB2	22	42
CCOc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819392792	CF	On-Demand	Anodyne	ADRB1	23	42
CCOc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819392792	CF	On-Demand	Anodyne	ADRB3	75	42
COc1ccc(C)cc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819392802	FG	On-Demand	Anodyne	GPR119	51	46
COc1ccc(C)cc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819392803	FG	On-Demand	Anodyne	GPR119	51	46
COc1cc(NC[C@@](C)(O)CNC(=O)OC(C)(C)C)cc(OC)c1OC	ZINC000819392804	FE	On-Demand	Anodyne	TUBB1	42	34
COc1cc(NC[C@](C)(O)CNC(=O)OC(C)(C)C)cc(OC)c1OC	ZINC000819392805	FE	On-Demand	Anodyne	TUBB1	42	34
CCOc1ccccc1NC[C@H](O)COc1ccc(SC)cc1	ZINC000819392808	EH	On-Demand	Clean	ADRB2	45	42
CCOc1ccccc1NC[C@H](O)COc1ccc(SC)cc1	ZINC000819392808	EH	On-Demand	Clean	ADRB1	60	40
CCOc1ccccc1NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819392809	EH	On-Demand	Clean	ADRB2	45	42
CCOc1ccccc1NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819392809	EH	On-Demand	Clean	ADRB1	60	40
COc1cc(NC[C@H](O)COc2ccc(CC#N)cc2)cc(OC)c1OC	ZINC000819392810	FF	On-Demand	Mild	ADRB2	38	42
COc1cc(NC[C@H](O)COc2ccc(CC#N)cc2)cc(OC)c1OC	ZINC000819392810	FF	On-Demand	Mild	ADRB1	48	41
COc1cc(NC[C@H](O)COc2ccc(CC#N)cc2)cc(OC)c1OC	ZINC000819392810	FF	On-Demand	Mild	ADRB3	30	42
COc1cc(NC[C@H](O)COc2ccc(CC#N)cc2)cc(OC)c1OC	ZINC000819392810	FF	On-Demand	Mild	CASR	40	37
COc1cc(NC[C@H](O)COc2ccc(CC#N)cc2)cc(OC)c1OC	ZINC000819392810	FF	On-Demand	Mild	CYP2D6	17	42
COc1cc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc(OC)c1OC	ZINC000819392811	FF	On-Demand	Mild	ADRB2	38	42
COc1cc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc(OC)c1OC	ZINC000819392811	FF	On-Demand	Mild	ADRB1	48	41
COc1cc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc(OC)c1OC	ZINC000819392811	FF	On-Demand	Mild	ADRB3	30	42
COc1cc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc(OC)c1OC	ZINC000819392811	FF	On-Demand	Mild	CASR	40	37
COc1cc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc(OC)c1OC	ZINC000819392811	FF	On-Demand	Mild	CYP2D6	17	42
CCOc1ccccc1NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819392831	DF	On-Demand	Anodyne	HCN1	50	33
CCOc1ccccc1NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819392831	DF	On-Demand	Anodyne	HCN4	42	32
CCOc1ccccc1NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819392833	DF	On-Demand	Anodyne	HCN1	50	33
CCOc1ccccc1NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819392833	DF	On-Demand	Anodyne	HCN4	42	32
C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819392839	EF	On-Demand	Anodyne	PAPA1_CARPA	29	44
C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819392839	EF	On-Demand	Anodyne	YARS	41	33
C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819392839	EF	On-Demand	Anodyne	FPR1	43	34
CCOc1ccccc1NCC1(O)CCS(=O)(=O)CC1	ZINC000819392842	CD	On-Demand	Anodyne	HCN1	63	42
CCOc1ccccc1NCC1(O)CCS(=O)(=O)CC1	ZINC000819392842	CD	On-Demand	Anodyne	HCN4	50	38
COc1ccc(C)cc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819392844	EF	On-Demand	Anodyne	ADRB2	21	42
COc1ccc(C)cc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819392844	EF	On-Demand	Anodyne	ADRB1	18	41
COc1ccc(C)cc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819392844	EF	On-Demand	Anodyne	EDNRA	42	37
COc1ccc(C)cc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819392845	EF	On-Demand	Anodyne	ADRB2	21	42
COc1ccc(C)cc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819392845	EF	On-Demand	Anodyne	ADRB1	18	41
COc1ccc(C)cc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819392845	EF	On-Demand	Anodyne	EDNRA	42	37
CCOc1ccccc1NC[C@H](O)CCC(C)C	ZINC000819392861	CG	On-Demand	Clean	ADRB2	20	41
CCOc1ccccc1NC[C@@H](O)CCC(C)C	ZINC000819392863	CG	On-Demand	Clean	ADRB2	20	41
CCOc1ccccc1NC[C@H](O)COc1c(OC)cccc1OC	ZINC000819392868	EF	On-Demand	Clean	ADRB2	35	45
CCOc1ccccc1NC[C@H](O)COc1c(OC)cccc1OC	ZINC000819392868	EF	On-Demand	Clean	ADRB1	51	37
CCOc1ccccc1NC[C@H](O)COc1c(OC)cccc1OC	ZINC000819392868	EF	On-Demand	Clean	KCNK3	30	41
CCOc1ccccc1NC[C@H](O)COc1c(OC)cccc1OC	ZINC000819392868	EF	On-Demand	Clean	KCNK9	23	41
CCOc1ccccc1NC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819392869	EF	On-Demand	Clean	ADRB2	35	45
CCOc1ccccc1NC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819392869	EF	On-Demand	Clean	ADRB1	51	37
CCOc1ccccc1NC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819392869	EF	On-Demand	Clean	KCNK3	30	41
CCOc1ccccc1NC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819392869	EF	On-Demand	Clean	KCNK9	23	41
COc1cc(NC[C@@H](O)CN2CCc3ccccc3C2)cc(OC)c1OC	ZINC000819392871	FF	On-Demand	Anodyne	ABCB1B	47	32
COc1cc(NC[C@@H](O)CN2CCc3ccccc3C2)cc(OC)c1OC	ZINC000819392871	FF	On-Demand	Anodyne	NOD2	41	38
COc1cc(NC[C@H](O)CN2CCc3ccccc3C2)cc(OC)c1OC	ZINC000819392873	FF	On-Demand	Anodyne	ABCB1B	47	32
COc1cc(NC[C@H](O)CN2CCc3ccccc3C2)cc(OC)c1OC	ZINC000819392873	FF	On-Demand	Anodyne	NOD2	41	38
O[C@H](CNc1ccc2c(c1)OCCO2)CN1CCc2ccccc2C1	ZINC000819392874	EE	On-Demand	Anodyne	TRPC6	15	40
O[C@H](CNc1ccc2c(c1)OCCO2)CN1CCc2ccccc2C1	ZINC000819392874	EE	On-Demand	Anodyne	TRPC3	17	40
O[C@@H](CNc1ccc2c(c1)OCCO2)CN1CCc2ccccc2C1	ZINC000819392876	EE	On-Demand	Anodyne	TRPC6	15	40
O[C@@H](CNc1ccc2c(c1)OCCO2)CN1CCc2ccccc2C1	ZINC000819392876	EE	On-Demand	Anodyne	TRPC3	17	40
Cc1cc(Cl)ncc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819392886	FH	On-Demand	Mild	PAPA1_CARPA	40	44
Cc1cc(Cl)ncc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819392888	FH	On-Demand	Mild	PAPA1_CARPA	40	44
COc1ccc(C)cc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819392889	EF	On-Demand	Bother	ADRB2	29	45
C#Cc1cccc(NC(=O)[C@H]2CC(=O)N(c3ccc(C)cc3)C2)c1	ZINC000819392890	DF	On-Demand	Mild	INHA	15	45
COc1ccc(C)cc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819392891	EF	On-Demand	Bother	ADRB2	29	45
C#Cc1cccc(NC(=O)[C@@H]2CC(=O)N(c3ccc(C)cc3)C2)c1	ZINC000819392892	DF	On-Demand	Mild	INHA	15	45
O=C1CCc2cc(OC[C@@H](O)CNc3ccc(N4CCCCC4)cc3)ccc2N1	ZINC000819392906	GG	On-Demand	Anodyne	PKM	34	40
O=C1CCc2cc(OC[C@H](O)CNc3ccc(N4CCCCC4)cc3)ccc2N1	ZINC000819392907	GG	On-Demand	Anodyne	PKM	34	40
OC1(CNc2ccc(OCc3ccccc3)cc2)CCOCC1	ZINC000819392930	DG	On-Demand	Anodyne	ALOX5	22	42
OC1(CNc2ccc(OCc3ccccc3)cc2)CCOCC1	ZINC000819392930	DG	On-Demand	Anodyne	MAOB	21	42
OC1(CNc2ccc(OCc3ccccc3)cc2)CCOCC1	ZINC000819392930	DG	On-Demand	Anodyne	LTA4H	21	45
Cc1c(F)cccc1NC(=O)CCNc1ccc(N2CCCCC2)cc1	ZINC000819392933	FJ	On-Demand	Anodyne	KCNQ2	66	39
O=C1CCCN1C[C@H](O)CNc1ccc(OCc2ccccc2)cc1	ZINC000819392935	EF	On-Demand	Anodyne	LTA4H	25	42
O=C1CCCN1C[C@@H](O)CNc1ccc(OCc2ccccc2)cc1	ZINC000819392936	EF	On-Demand	Anodyne	LTA4H	25	42
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc2ccccc2c1	ZINC000819392950	EH	On-Demand	Anodyne	PAPA1_CARPA	29	44
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc2ccccc2c1	ZINC000819392951	EH	On-Demand	Anodyne	PAPA1_CARPA	29	44
OC1(CNc2ccc(N3CCCCC3)cc2)CCOCC1	ZINC000819392954	CF	On-Demand	Anodyne	STAT6	51	32
O[C@@H](CNc1ccc(OCc2ccccc2)cc1)COC1CCOCC1	ZINC000819392968	FG	On-Demand	Anodyne	ADRB1	51	40
O[C@H](CNc1ccc(OCc2ccccc2)cc1)COC1CCOCC1	ZINC000819392969	FG	On-Demand	Anodyne	ADRB1	51	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)c1	ZINC000819392975	EF	On-Demand	Anodyne	ADRB2	22	43
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)c1	ZINC000819392975	EF	On-Demand	Anodyne	GRIN1	19	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)c1	ZINC000819392975	EF	On-Demand	Anodyne	ABCB1	15	46
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)c1	ZINC000819392975	EF	On-Demand	Anodyne	PDS	41	35
CC(=O)c1cccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)c1	ZINC000819392976	EF	On-Demand	Anodyne	ADRB2	22	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)c1	ZINC000819392976	EF	On-Demand	Anodyne	GRIN1	19	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)c1	ZINC000819392976	EF	On-Demand	Anodyne	ABCB1	15	46
CC(=O)c1cccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)c1	ZINC000819392976	EF	On-Demand	Anodyne	PDS	41	35
C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819392989	GG	On-Demand	Mild	CTSB	37	43
C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819392989	GG	On-Demand	Mild	PAPA1_CARPA	60	58
C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819392989	GG	On-Demand	Mild	CTSK	27	43
C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819392989	GG	On-Demand	Mild	CTSL	18	58
C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819392989	GG	On-Demand	Mild	FPR1	48	39
C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819392991	GG	On-Demand	Mild	CTSB	37	43
C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819392991	GG	On-Demand	Mild	PAPA1_CARPA	60	58
C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819392991	GG	On-Demand	Mild	CTSK	27	43
C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819392991	GG	On-Demand	Mild	CTSL	18	58
C[C@@H](Cc1ccc(O)cc1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819392991	GG	On-Demand	Mild	FPR1	48	39
O=S1(=O)CCC(O)(CNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000819392994	FF	On-Demand	Anodyne	MAOB	20	40
O=S1(=O)CCC(O)(CNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000819392994	FF	On-Demand	Anodyne	LTA4H	25	49
O=S1(=O)CCC(O)(CNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000819392994	FF	On-Demand	Anodyne	ADAM17	17	44
O=S1(=O)CCC(O)(CNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000819392994	FF	On-Demand	Anodyne	FFAR1	25	41
O=C(NOCC(F)(F)F)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819393001	GG	On-Demand	Anodyne	CNR1	54	33
O[C@@H](CNc1ccc2c(c1)OCCO2)COc1cccc(C(F)(F)F)c1	ZINC000819393006	FG	On-Demand	Anodyne	PDS	47	42
O[C@H](CNc1ccc2c(c1)OCCO2)COc1cccc(C(F)(F)F)c1	ZINC000819393007	FG	On-Demand	Anodyne	PDS	47	42
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(N3CCCCC3)cc2)c1	ZINC000819393031	EH	On-Demand	Bother	IGF1R	15	40
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(N3CCCCC3)cc2)c1	ZINC000819393032	EH	On-Demand	Bother	IGF1R	15	40
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819393040	GG	On-Demand	Anodyne	ADRB2	46	60
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819393040	GG	On-Demand	Anodyne	ADRB1	77	60
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819393040	GG	On-Demand	Anodyne	ADRB3	50	49
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819393040	GG	On-Demand	Anodyne	PRNP	45	33
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819393041	GG	On-Demand	Anodyne	ADRB2	46	60
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819393041	GG	On-Demand	Anodyne	ADRB1	77	60
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819393041	GG	On-Demand	Anodyne	ADRB3	50	49
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819393041	GG	On-Demand	Anodyne	PRNP	45	33
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc(N2CCCCC2)cc1	ZINC000819393042	FG	On-Demand	Anodyne	CTSK	15	46
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc(N2CCCCC2)cc1	ZINC000819393043	FG	On-Demand	Anodyne	CTSK	15	46
COCCc1ccc(OC[C@@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393044	FH	On-Demand	Anodyne	ADRB2	66	60
COCCc1ccc(OC[C@@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393044	FH	On-Demand	Anodyne	ADRB1	84	60
COCCc1ccc(OC[C@@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393044	FH	On-Demand	Anodyne	GRIN1	28	41
COCCc1ccc(OC[C@@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393044	FH	On-Demand	Anodyne	ADRB3	57	51
COCCc1ccc(OC[C@@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393044	FH	On-Demand	Anodyne	CASR	45	41
COCCc1ccc(OC[C@@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393044	FH	On-Demand	Anodyne	CYP2D6	18	52
COCCc1ccc(OC[C@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393045	FH	On-Demand	Anodyne	ADRB2	66	60
COCCc1ccc(OC[C@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393045	FH	On-Demand	Anodyne	ADRB1	84	60
COCCc1ccc(OC[C@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393045	FH	On-Demand	Anodyne	GRIN1	28	41
COCCc1ccc(OC[C@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393045	FH	On-Demand	Anodyne	ADRB3	57	51
COCCc1ccc(OC[C@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393045	FH	On-Demand	Anodyne	CASR	45	41
COCCc1ccc(OC[C@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393045	FH	On-Demand	Anodyne	CYP2D6	18	52
C[C@@H](CNc1ccc(OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819393046	DG	On-Demand	Anodyne	MAOB	25	50
C[C@@H](CNc1ccc(OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819393046	DG	On-Demand	Anodyne	ADRB3	17	40
C[C@@H](CNc1ccc(OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819393046	DG	On-Demand	Anodyne	LTA4H	31	55
C[C@@H](CNc1ccc(OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819393046	DG	On-Demand	Anodyne	MMP13	15	49
C[C@@H](CNc1ccc(OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819393046	DG	On-Demand	Anodyne	MMP2	15	46
C[C@@H](CNc1ccc(OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819393046	DG	On-Demand	Anodyne	ACE2	20	40
C[C@@H](CNc1ccc(OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819393046	DG	On-Demand	Anodyne	ADAMTS4	38	44
C[C@@H](CNc1ccc(OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819393046	DG	On-Demand	Anodyne	TAAR1	16	44
C[C@@H](CNc1ccc(OCc2ccccc2)cc1)S(C)(=O)=O	ZINC000819393046	DG	On-Demand	Anodyne	FFAR1	33	40
C#Cc1cccc(NC(=O)c2ccc(OCCCC)c(OCC)c2)c1	ZINC000819393052	EI	On-Demand	Mild	LPAR2	20	42
C#Cc1cccc(NC(=O)c2ccc(OCCCC)c(OCC)c2)c1	ZINC000819393052	EI	On-Demand	Mild	PLA2G4B	51	35
C#Cc1cccc(NC(=O)c2ccc(OCCCC)c(OCC)c2)c1	ZINC000819393052	EI	On-Demand	Mild	S1PR2	17	42
C#Cc1cccc(NC(=O)c2ccc(OCCCC)c(OCC)c2)c1	ZINC000819393052	EI	On-Demand	Mild	TAAR1	50	42
C#Cc1cccc(NC(=O)c2ccc(OCCCC)c(OCC)c2)c1	ZINC000819393052	EI	On-Demand	Mild	DDR1	25	47
C#Cc1cccc(NC(=O)c2ccc(OCCCC)c(OCC)c2)c1	ZINC000819393052	EI	On-Demand	Mild	KCNK3	113	46
C#Cc1cccc(NC(=O)c2ccc(OCCCC)c(OCC)c2)c1	ZINC000819393052	EI	On-Demand	Mild	KCNK9	80	46
O[C@@H](CCc1ccccc1)CNc1ccc(N2CCCCC2)cc1	ZINC000819393053	DI	On-Demand	Anodyne	KCNQ2	20	45
O[C@@H](CCc1ccccc1)CNc1ccc(N2CCCCC2)cc1	ZINC000819393053	DI	On-Demand	Anodyne	CTSL	16	59
O[C@@H](CCc1ccccc1)CNc1ccc(N2CCCCC2)cc1	ZINC000819393053	DI	On-Demand	Anodyne	ABCB1	25	40
O[C@@H](CCc1ccccc1)CNc1ccc(N2CCCCC2)cc1	ZINC000819393053	DI	On-Demand	Anodyne	STAT6	30	41
O[C@H](CCc1ccccc1)CNc1ccc(N2CCCCC2)cc1	ZINC000819393054	DI	On-Demand	Anodyne	KCNQ2	20	45
O[C@H](CCc1ccccc1)CNc1ccc(N2CCCCC2)cc1	ZINC000819393054	DI	On-Demand	Anodyne	CTSL	16	59
O[C@H](CCc1ccccc1)CNc1ccc(N2CCCCC2)cc1	ZINC000819393054	DI	On-Demand	Anodyne	ABCB1	25	40
O[C@H](CCc1ccccc1)CNc1ccc(N2CCCCC2)cc1	ZINC000819393054	DI	On-Demand	Anodyne	STAT6	30	41
N#CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393058	EE	On-Demand	Mild	ADRB1	44	36
N#CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393058	EE	On-Demand	Mild	GRIN1	26	45
N#CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393059	EE	On-Demand	Mild	ADRB1	44	36
N#CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393059	EE	On-Demand	Mild	GRIN1	26	45
O[C@H](CNc1ccc(N2CCCCC2)cc1)c1cccnc1	ZINC000819393070	CG	On-Demand	Anodyne	ADRB2	24	41
O[C@H](CNc1ccc(N2CCCCC2)cc1)c1cccnc1	ZINC000819393070	CG	On-Demand	Anodyne	ADRB3	92	50
O[C@@H](CNc1ccc(N2CCCCC2)cc1)c1cccnc1	ZINC000819393071	CG	On-Demand	Anodyne	ADRB2	24	41
O[C@@H](CNc1ccc(N2CCCCC2)cc1)c1cccnc1	ZINC000819393071	CG	On-Demand	Anodyne	ADRB3	92	50
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc3ccccc3c2)CC1	ZINC000819393078	FI	On-Demand	Anodyne	GPR119	53	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc3ccccc3c2)CC1	ZINC000819393079	FI	On-Demand	Anodyne	GPR119	53	49
O[C@@H](CNc1ccc(N2CCCCC2)cc1)COc1cccc2[nH]ccc12	ZINC000819393100	FI	On-Demand	Anodyne	ADRB2	22	60
O[C@@H](CNc1ccc(N2CCCCC2)cc1)COc1cccc2[nH]ccc12	ZINC000819393100	FI	On-Demand	Anodyne	ADRB1	28	60
O[C@@H](CNc1ccc(N2CCCCC2)cc1)COc1cccc2[nH]ccc12	ZINC000819393100	FI	On-Demand	Anodyne	SLC6A4	15	41
O[C@H](CNc1ccc(N2CCCCC2)cc1)COc1cccc2[nH]ccc12	ZINC000819393101	FI	On-Demand	Anodyne	ADRB2	22	60
O[C@H](CNc1ccc(N2CCCCC2)cc1)COc1cccc2[nH]ccc12	ZINC000819393101	FI	On-Demand	Anodyne	ADRB1	28	60
O[C@H](CNc1ccc(N2CCCCC2)cc1)COc1cccc2[nH]ccc12	ZINC000819393101	FI	On-Demand	Anodyne	SLC6A4	15	41
O[C@@H](CNc1ccc(OCc2ccccc2)cc1)COCc1ccccc1F	ZINC000819393107	GI	On-Demand	Anodyne	ADRB1	40	39
O[C@H](CNc1ccc(OCc2ccccc2)cc1)COCc1ccccc1F	ZINC000819393108	GI	On-Demand	Anodyne	ADRB1	40	39
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393117	FF	On-Demand	Anodyne	ADRB2	41	45
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393117	FF	On-Demand	Anodyne	ADRB1	70	46
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393117	FF	On-Demand	Anodyne	GRIN1	30	49
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393117	FF	On-Demand	Anodyne	ADRB3	49	45
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393118	FF	On-Demand	Anodyne	ADRB2	41	45
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393118	FF	On-Demand	Anodyne	ADRB1	70	46
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393118	FF	On-Demand	Anodyne	GRIN1	30	49
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393118	FF	On-Demand	Anodyne	ADRB3	49	45
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc2ccccc2c1	ZINC000819393139	EH	On-Demand	Anodyne	NQO2	19	44
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc2ccccc2c1	ZINC000819393139	EH	On-Demand	Anodyne	PAPA1_CARPA	24	43
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc2ccccc2c1	ZINC000819393140	EH	On-Demand	Anodyne	NQO2	19	44
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc2ccccc2c1	ZINC000819393140	EH	On-Demand	Anodyne	PAPA1_CARPA	24	43
CC(=O)Nc1cccc(NCCS(=O)(=O)CC(=O)OC(C)(C)C)c1	ZINC000819393144	FD	On-Demand	Anodyne	KCNK3	55	32
CC(=O)Nc1cccc(NCCS(=O)(=O)CC(=O)OC(C)(C)C)c1	ZINC000819393144	FD	On-Demand	Anodyne	KCNK9	48	32
CC(=O)Nc1cccc(NC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819393145	CG	On-Demand	Anodyne	KCNK3	95	40
CC(=O)Nc1cccc(NC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819393145	CG	On-Demand	Anodyne	KCNK9	66	40
CC(=O)Nc1cccc(NC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819393146	CG	On-Demand	Anodyne	KCNK3	95	40
CC(=O)Nc1cccc(NC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819393146	CG	On-Demand	Anodyne	KCNK9	66	40
N#Cc1ccc(S(=O)(=O)CCNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393150	GI	On-Demand	Mild	MAOB	22	41
N#Cc1ccc(S(=O)(=O)CCNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393150	GI	On-Demand	Mild	ADAMTS4	24	40
N#CCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819393153	FH	On-Demand	Mild	ADRB1	60	39
N#CCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819393153	FH	On-Demand	Mild	ADRB3	42	42
N#CCc1ccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819393154	FH	On-Demand	Mild	ADRB1	60	39
N#CCc1ccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819393154	FH	On-Demand	Mild	ADRB3	42	42
O=C(CCNc1ccc(N2CCCCC2)cc1)Nc1cccnc1	ZINC000819393162	DH	On-Demand	Anodyne	CHRNA7	30	49
O=C(CCNc1ccc(N2CCCCC2)cc1)Nc1cccnc1	ZINC000819393162	DH	On-Demand	Anodyne	PRNP	36	42
O=C(CCNc1ccc(N2CCCCC2)cc1)Nc1cccnc1	ZINC000819393162	DH	On-Demand	Anodyne	STAT6	69	32
O=C(CCNc1ccc(N2CCCCC2)cc1)Nc1cccnc1	ZINC000819393162	DH	On-Demand	Anodyne	NAMPT	43	42
CC(C)c1nn(-c2ccccc2)cc1C(=O)N[C@@H](C)C[C@@H](O)c1ccc(F)cc1	ZINC000819393165	GI	On-Demand	Anodyne	HMGCR	94	42
CC(C)c1nn(-c2ccccc2)cc1C(=O)N[C@H](C)C[C@H](O)c1ccc(F)cc1	ZINC000819393166	GI	On-Demand	Anodyne	HMGCR	94	42
CC(C)c1nn(-c2ccccc2)cc1C(=O)N[C@H](C)C[C@@H](O)c1ccc(F)cc1	ZINC000819393168	GI	On-Demand	Anodyne	HMGCR	94	42
CC(C)c1nn(-c2ccccc2)cc1C(=O)N[C@@H](C)C[C@H](O)c1ccc(F)cc1	ZINC000819393170	GI	On-Demand	Anodyne	HMGCR	94	42
CCOC(=O)C1CCC(O)(CNc2ccc(OCC)c(OCC)c2)CC1	ZINC000819393179	FG	On-Demand	Anodyne	HCN1	40	32
CCOC(=O)C1CCC(O)(CNc2ccc(OCC)c(OCC)c2)CC1	ZINC000819393179	FG	On-Demand	Anodyne	HCN4	40	32
O=C(CCc1cccc(OC(F)F)c1)NOCC(F)(F)F	ZINC000819393190	DF	On-Demand	Anodyne	PLA2G4A	25	41
CON(C)C(=O)CCNc1cccc(NC(C)=O)c1	ZINC000819393199	CD	On-Demand	Anodyne	KCNK3	86	37
CON(C)C(=O)CCNc1cccc(NC(C)=O)c1	ZINC000819393199	CD	On-Demand	Anodyne	KCNK9	69	37
O[C@@H](CNc1ccc(Oc2ccccc2)cc1)C1CC1	ZINC000819393207	CH	On-Demand	Anodyne	LTA4H	36	40
O[C@H](CNc1ccc(Oc2ccccc2)cc1)C1CC1	ZINC000819393209	CH	On-Demand	Anodyne	LTA4H	36	40
CC[C@H](O)CNc1ccc(OC)c(Cc2ccccc2)c1	ZINC000819393215	CG	On-Demand	Anodyne	TSHR	40	29
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393221	GH	On-Demand	Anodyne	ADRB2	42	43
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393221	GH	On-Demand	Anodyne	MAOB	15	40
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393221	GH	On-Demand	Anodyne	ADRB3	82	48
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393221	GH	On-Demand	Anodyne	LTA4H	27	46
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393221	GH	On-Demand	Anodyne	MMP13	22	46
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393221	GH	On-Demand	Anodyne	CTSB	15	42
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393221	GH	On-Demand	Anodyne	ADAM17	19	44
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393221	GH	On-Demand	Anodyne	MMP2	18	44
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393221	GH	On-Demand	Anodyne	GHSR	24	45
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393221	GH	On-Demand	Anodyne	MMP9	15	44
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393221	GH	On-Demand	Anodyne	ADAMTS4	34	44
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393221	GH	On-Demand	Anodyne	FFAR1	50	43
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393221	GH	On-Demand	Anodyne	FFAR4	42	35
CON(C)C(=O)CCNc1ccc2nc(C)sc2c1	ZINC000819393222	CE	On-Demand	Anodyne	LDHA	39	43
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393223	GH	On-Demand	Anodyne	ADRB2	42	43
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393223	GH	On-Demand	Anodyne	MAOB	15	40
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393223	GH	On-Demand	Anodyne	ADRB3	82	48
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393223	GH	On-Demand	Anodyne	LTA4H	27	46
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393223	GH	On-Demand	Anodyne	MMP13	22	46
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393223	GH	On-Demand	Anodyne	CTSB	15	42
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393223	GH	On-Demand	Anodyne	ADAM17	19	44
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393223	GH	On-Demand	Anodyne	MMP2	18	44
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393223	GH	On-Demand	Anodyne	GHSR	24	45
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393223	GH	On-Demand	Anodyne	MMP9	15	44
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393223	GH	On-Demand	Anodyne	ADAMTS4	34	44
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393223	GH	On-Demand	Anodyne	FFAR1	50	43
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OCc3ccccc3)cc2)cc1	ZINC000819393223	GH	On-Demand	Anodyne	FFAR4	42	35
CCOc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393229	EF	On-Demand	Anodyne	ADRB2	31	40
CCOc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393229	EF	On-Demand	Anodyne	ADRB1	46	40
CCOc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393229	EF	On-Demand	Anodyne	GRIN1	27	46
CCOc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393231	EF	On-Demand	Anodyne	ADRB2	31	40
CCOc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393231	EF	On-Demand	Anodyne	ADRB1	46	40
CCOc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393231	EF	On-Demand	Anodyne	GRIN1	27	46
O[C@H](CNc1ccc(N2CCCCC2)cc1)CN1CCc2ccccc2C1	ZINC000819393233	FH	On-Demand	Anodyne	NOD2	40	34
O[C@@H](CNc1ccc(N2CCCCC2)cc1)CN1CCc2ccccc2C1	ZINC000819393235	FH	On-Demand	Anodyne	NOD2	40	34
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc2c(c1)OCCO2	ZINC000819393241	EE	On-Demand	Bother	ADRB1	47	32
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc2c(c1)OCCO2	ZINC000819393243	EE	On-Demand	Bother	ADRB1	47	32
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)c(C)c1	ZINC000819393261	FI	On-Demand	Anodyne	ADRB2	18	46
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)c(C)c1	ZINC000819393263	FI	On-Demand	Anodyne	ADRB2	18	46
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc2c(c1)OCCCO2	ZINC000819393265	FF	On-Demand	Bother	ADRB1	42	32
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc2c(c1)OCCCO2	ZINC000819393268	FF	On-Demand	Bother	ADRB1	42	32
O[C@@H](CNc1ccc(N2CCCCC2)cc1)c1cccc(Cl)c1	ZINC000819393271	EI	On-Demand	Anodyne	ADRB1	28	47
O[C@@H](CNc1ccc(N2CCCCC2)cc1)c1cccc(Cl)c1	ZINC000819393271	EI	On-Demand	Anodyne	ADRB3	43	43
O[C@@H](CNc1ccc(N2CCCCC2)cc1)c1cccc(Cl)c1	ZINC000819393271	EI	On-Demand	Anodyne	IGF1R	31	43
O[C@@H](CNc1ccc(N2CCCCC2)cc1)c1cccc(Cl)c1	ZINC000819393271	EI	On-Demand	Anodyne	KCNQ2	15	40
O[C@@H](CNc1ccc(N2CCCCC2)cc1)c1cccc(Cl)c1	ZINC000819393271	EI	On-Demand	Anodyne	CYP3A4	54	43
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2ccc3c(c2)OCCCO3)CC1	ZINC000819393272	GG	On-Demand	Anodyne	GPR119	21	48
O[C@H](CNc1ccc(N2CCCCC2)cc1)c1cccc(Cl)c1	ZINC000819393273	EI	On-Demand	Anodyne	ADRB1	28	47
O[C@H](CNc1ccc(N2CCCCC2)cc1)c1cccc(Cl)c1	ZINC000819393273	EI	On-Demand	Anodyne	ADRB3	43	43
O[C@H](CNc1ccc(N2CCCCC2)cc1)c1cccc(Cl)c1	ZINC000819393273	EI	On-Demand	Anodyne	IGF1R	31	43
O[C@H](CNc1ccc(N2CCCCC2)cc1)c1cccc(Cl)c1	ZINC000819393273	EI	On-Demand	Anodyne	KCNQ2	15	40
O[C@H](CNc1ccc(N2CCCCC2)cc1)c1cccc(Cl)c1	ZINC000819393273	EI	On-Demand	Anodyne	CYP3A4	54	43
CON(C)C(=O)CCNc1ccc(OCc2ccccc2)cc1	ZINC000819393282	DG	On-Demand	Anodyne	ALOX5	17	53
CON(C)C(=O)CCNc1ccc(OCc2ccccc2)cc1	ZINC000819393282	DG	On-Demand	Anodyne	TSHR	42	32
CON(C)C(=O)CCNc1ccc(OCc2ccccc2)cc1	ZINC000819393282	DG	On-Demand	Anodyne	MAOB	27	43
CON(C)C(=O)CCNc1ccc(OCc2ccccc2)cc1	ZINC000819393282	DG	On-Demand	Anodyne	LTA4H	53	50
CON(C)C(=O)CCNc1ccc(OCc2ccccc2)cc1	ZINC000819393282	DG	On-Demand	Anodyne	CTSK	18	48
CON(C)C(=O)CCNc1ccc(OCc2ccccc2)cc1	ZINC000819393282	DG	On-Demand	Anodyne	FFAR1	57	46
CON(C)C(=O)CCNc1ccc(OCc2ccccc2)cc1	ZINC000819393282	DG	On-Demand	Anodyne	FFAR4	41	37
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(N2CCCCC2)cc1	ZINC000819393287	FG	On-Demand	Bother	ADRB1	48	32
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(N2CCCCC2)cc1	ZINC000819393288	FG	On-Demand	Bother	ADRB1	48	32
N#Cc1cccc(S(=O)(=O)CCNc2ccc(OCc3ccccc3)cc2)c1	ZINC000819393293	GI	On-Demand	Mild	MAOB	34	44
N#Cc1cccc(S(=O)(=O)CCNc2ccc(OCc3ccccc3)cc2)c1	ZINC000819393293	GI	On-Demand	Mild	ADAMTS4	16	45
N#Cc1cccc(S(=O)(=O)CCNc2ccc(OCc3ccccc3)cc2)c1	ZINC000819393293	GI	On-Demand	Mild	FFAR1	16	45
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2ccc3c(c2)OCCCO3)CC1	ZINC000819393295	GG	On-Demand	Anodyne	GPR119	21	48
COc1ccc(OCC(F)(F)C(F)F)c(C(=O)Nc2ccc(F)nc2)c1	ZINC000819393322	GH	On-Demand	Anodyne	KCNK3	49	35
COc1ccc(OCC(F)(F)C(F)F)c(C(=O)Nc2ccc(F)nc2)c1	ZINC000819393322	GH	On-Demand	Anodyne	KCNK9	46	35
O[C@H](CNc1ccc2c(c1)OCCO2)COc1ccc2c(c1)OCO2	ZINC000819393324	EE	On-Demand	Anodyne	GRIN1	22	49
O[C@@H](CNc1ccc2c(c1)OCCO2)COc1ccc2c(c1)OCO2	ZINC000819393326	EE	On-Demand	Anodyne	GRIN1	22	49
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393334	FE	On-Demand	Anodyne	ADRB2	35	57
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393334	FE	On-Demand	Anodyne	ADRB1	68	57
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393334	FE	On-Demand	Anodyne	GRIN1	28	46
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393334	FE	On-Demand	Anodyne	ADRB3	40	49
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393336	FE	On-Demand	Anodyne	ADRB2	35	57
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393336	FE	On-Demand	Anodyne	ADRB1	68	57
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393336	FE	On-Demand	Anodyne	GRIN1	28	46
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393336	FE	On-Demand	Anodyne	ADRB3	40	49
O[C@@H](CNc1ccc(OC(F)F)c(Cc2ccccc2)c1)CN1CCOCC1	ZINC000819393355	GF	On-Demand	Anodyne	ABCB1	26	42
O[C@H](CNc1ccc(OC(F)F)c(Cc2ccccc2)c1)CN1CCOCC1	ZINC000819393356	GF	On-Demand	Anodyne	ABCB1	26	42
C=C(C)C(C)(C)C(=O)NNC(=O)CN1CCN(Cc2ccc(C)cc2)CC1	ZINC000819393366	FD	On-Demand	Reactive	DRD4	21	41
CC(C)c1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819393375	CG	On-Demand	Anodyne	ADRB2	29	41
CC(C)c1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819393375	CG	On-Demand	Anodyne	ADRB1	26	44
CC(C)c1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819393375	CG	On-Demand	Anodyne	ADRB3	89	46
CC(C)c1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819393376	CG	On-Demand	Anodyne	ADRB2	29	41
CC(C)c1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819393376	CG	On-Demand	Anodyne	ADRB1	26	44
CC(C)c1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819393376	CG	On-Demand	Anodyne	ADRB3	89	46
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2ccc3c(c2)CCC3)CC1	ZINC000819393377	FH	On-Demand	Anodyne	GPR119	30	49
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2ccc3c(c2)CCC3)CC1	ZINC000819393378	FH	On-Demand	Anodyne	GPR119	30	49
CCCc1ccc(NC[C@H](O)COc2c(OC)cccc2OC)cc1	ZINC000819393385	EH	On-Demand	Anodyne	ADRB2	55	47
CCCc1ccc(NC[C@H](O)COc2c(OC)cccc2OC)cc1	ZINC000819393385	EH	On-Demand	Anodyne	ADRB1	63	47
CCCc1ccc(NC[C@H](O)COc2c(OC)cccc2OC)cc1	ZINC000819393385	EH	On-Demand	Anodyne	ADRB3	42	43
CCCc1ccc(NC[C@@H](O)COc2c(OC)cccc2OC)cc1	ZINC000819393386	EH	On-Demand	Anodyne	ADRB2	55	47
CCCc1ccc(NC[C@@H](O)COc2c(OC)cccc2OC)cc1	ZINC000819393386	EH	On-Demand	Anodyne	ADRB1	63	47
CCCc1ccc(NC[C@@H](O)COc2c(OC)cccc2OC)cc1	ZINC000819393386	EH	On-Demand	Anodyne	ADRB3	42	43
CCCc1ccc(NC[C@H](O)COC2CCOCC2)cc1	ZINC000819393403	CF	On-Demand	Anodyne	ADRB1	19	43
CCCc1ccc(NC[C@@H](O)COC2CCOCC2)cc1	ZINC000819393404	CF	On-Demand	Anodyne	ADRB1	19	43
Cc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819393419	EH	On-Demand	Anodyne	EPHX2	18	48
Cc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819393419	EH	On-Demand	Anodyne	GPR119	58	47
Cc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819393420	EH	On-Demand	Anodyne	EPHX2	18	48
Cc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819393420	EH	On-Demand	Anodyne	GPR119	58	47
CCCc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819393422	DH	On-Demand	Mild	ADRB2	49	58
CCCc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819393422	DH	On-Demand	Mild	ADRB1	70	58
CCCc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819393422	DH	On-Demand	Mild	GRIN1	27	42
CCCc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819393422	DH	On-Demand	Mild	ADRB3	49	45
CCCc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819393422	DH	On-Demand	Mild	CASR	40	36
CCCc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819393423	DH	On-Demand	Mild	ADRB2	49	58
CCCc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819393423	DH	On-Demand	Mild	ADRB1	70	58
CCCc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819393423	DH	On-Demand	Mild	GRIN1	27	42
CCCc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819393423	DH	On-Demand	Mild	ADRB3	49	45
CCCc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819393423	DH	On-Demand	Mild	CASR	40	36
CCCc1ccc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819393426	FG	On-Demand	Anodyne	ADRB2	38	46
CCCc1ccc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819393426	FG	On-Demand	Anodyne	ADRB1	63	46
CCCc1ccc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819393426	FG	On-Demand	Anodyne	GRIN1	27	40
CCCc1ccc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819393426	FG	On-Demand	Anodyne	ADRB3	46	43
CCCc1ccc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819393427	FG	On-Demand	Anodyne	ADRB2	38	46
CCCc1ccc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819393427	FG	On-Demand	Anodyne	ADRB1	63	46
CCCc1ccc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819393427	FG	On-Demand	Anodyne	GRIN1	27	40
CCCc1ccc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819393427	FG	On-Demand	Anodyne	ADRB3	46	43
Cc1ccc(NC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)c(C)c1	ZINC000819393429	EH	On-Demand	Anodyne	GPR119	29	41
CC(=O)Nc1cccc(NC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819393476	GG	On-Demand	Anodyne	GPR119	29	40
CC(=O)Nc1cccc(NC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819393478	GG	On-Demand	Anodyne	GPR119	29	40
CC(=O)Nc1cccc(NC[C@@H](O)C2CC2)c1	ZINC000819393490	BD	On-Demand	Anodyne	KCNK3	110	38
CC(=O)Nc1cccc(NC[C@@H](O)C2CC2)c1	ZINC000819393490	BD	On-Demand	Anodyne	KCNK9	75	38
CC(=O)Nc1cccc(NC[C@H](O)C2CC2)c1	ZINC000819393492	BD	On-Demand	Anodyne	KCNK3	110	38
CC(=O)Nc1cccc(NC[C@H](O)C2CC2)c1	ZINC000819393492	BD	On-Demand	Anodyne	KCNK9	75	38
O[C@@H](CNc1ccc2c(c1)OCCCO2)COc1cccc(C(F)(F)F)c1	ZINC000819393497	GH	On-Demand	Anodyne	PDS	46	41
O[C@H](CNc1ccc2c(c1)OCCCO2)COc1cccc(C(F)(F)F)c1	ZINC000819393499	GH	On-Demand	Anodyne	PDS	46	41
CC(=O)Nc1cccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819393503	GG	On-Demand	Anodyne	EPHX2	16	43
CC(=O)Nc1cccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819393503	GG	On-Demand	Anodyne	GPR119	51	50
CC(=O)Nc1cccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819393505	GG	On-Demand	Anodyne	EPHX2	16	43
CC(=O)Nc1cccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819393505	GG	On-Demand	Anodyne	GPR119	51	50
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2ccc3c(c2)OCCO3)CC1	ZINC000819393523	GG	On-Demand	Anodyne	GPR119	23	49
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2ccc3c(c2)OCCO3)CC1	ZINC000819393530	GG	On-Demand	Anodyne	GPR119	23	49
CC(=O)Nc1cccc(CC(=O)NOCC(F)(F)F)c1	ZINC000819393540	CD	On-Demand	Anodyne	KCNK3	52	37
CC(=O)Nc1cccc(CC(=O)NOCC(F)(F)F)c1	ZINC000819393540	CD	On-Demand	Anodyne	KCNK9	45	36
CCOC(=O)C1CCC(O)(CNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000819393541	GI	On-Demand	Anodyne	TSHR	42	32
CCOC(=O)C1CCC(O)(CNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000819393541	GI	On-Demand	Anodyne	LTA4H	37	45
CCOC(=O)C1CCC(O)(CNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000819393541	GI	On-Demand	Anodyne	CTSK	17	41
CCOC(=O)C1CCC(O)(CNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000819393541	GI	On-Demand	Anodyne	ADAM17	57	44
CCOC(=O)C1CCC(O)(CNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000819393541	GI	On-Demand	Anodyne	TIMP3	78	37
CCOC(=O)C1CCC(O)(CNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000819393541	GI	On-Demand	Anodyne	FAAH	15	42
CCOC(=O)C1CCC(O)(CNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000819393541	GI	On-Demand	Anodyne	FFAR1	44	39
CCOC(=O)C1CCC(O)(CNc2ccc(OCc3ccccc3)cc2)CC1	ZINC000819393541	GI	On-Demand	Anodyne	SLC12A5	46	36
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393547	FE	On-Demand	Anodyne	ADRB2	39	56
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393547	FE	On-Demand	Anodyne	ADRB1	65	56
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393547	FE	On-Demand	Anodyne	GRIN1	29	49
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393547	FE	On-Demand	Anodyne	ADRB3	44	41
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393549	FE	On-Demand	Anodyne	ADRB2	39	56
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393549	FE	On-Demand	Anodyne	ADRB1	65	56
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393549	FE	On-Demand	Anodyne	GRIN1	29	49
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393549	FE	On-Demand	Anodyne	ADRB3	44	41
N#CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393582	FF	On-Demand	Mild	ADRB1	45	37
N#CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393582	FF	On-Demand	Mild	GRIN1	20	44
N#CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393584	FF	On-Demand	Mild	ADRB1	45	37
N#CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393584	FF	On-Demand	Mild	GRIN1	20	44
C[C@H](C[C@@H](O)c1ccc(F)cc1)NC(=O)C[C@@H](C)n1cccn1	ZINC000819393598	DF	On-Demand	Anodyne	AMP1_PLAFQ	42	35
CN(CCC#N)C[C@@H](O)CNc1ccc2ccccc2c1	ZINC000819393601	CE	On-Demand	Mild	CASR	41	38
CN(CCC#N)C[C@H](O)CNc1ccc2ccccc2c1	ZINC000819393603	CE	On-Demand	Mild	CASR	41	38
O[C@H](CNc1ccc(N2CCCCC2)cc1)c1ccc(F)cn1	ZINC000819393608	DG	On-Demand	Anodyne	STAT6	46	31
O[C@@H](CNc1ccc(N2CCCCC2)cc1)c1ccc(F)cn1	ZINC000819393610	DG	On-Demand	Anodyne	STAT6	46	31
COCCc1ccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819393613	GH	On-Demand	Anodyne	ADRB2	44	58
COCCc1ccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819393613	GH	On-Demand	Anodyne	ADRB1	71	58
COCCc1ccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819393613	GH	On-Demand	Anodyne	ADRB3	50	41
COCCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819393615	GH	On-Demand	Anodyne	ADRB2	44	58
COCCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819393615	GH	On-Demand	Anodyne	ADRB1	71	58
COCCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819393615	GH	On-Demand	Anodyne	ADRB3	50	41
O[C@@H](CNc1ccc2c(c1)OCCCO2)c1cccc(Cl)c1	ZINC000819393620	DH	On-Demand	Anodyne	ADRB1	25	44
O[C@@H](CNc1ccc2c(c1)OCCCO2)c1cccc(Cl)c1	ZINC000819393620	DH	On-Demand	Anodyne	ADRB3	38	40
O[C@H](CNc1ccc2c(c1)OCCCO2)c1cccc(Cl)c1	ZINC000819393622	DH	On-Demand	Anodyne	ADRB1	25	44
O[C@H](CNc1ccc2c(c1)OCCCO2)c1cccc(Cl)c1	ZINC000819393622	DH	On-Demand	Anodyne	ADRB3	38	40
CSc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393626	FG	On-Demand	Anodyne	GRIN1	20	43
CSc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393627	FG	On-Demand	Anodyne	GRIN1	20	43
CSc1ccc(NC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819393636	FH	On-Demand	Anodyne	GPR119	31	50
CSc1ccc(NC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819393637	FH	On-Demand	Anodyne	GPR119	31	50
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393644	FF	On-Demand	Anodyne	ADRB2	37	58
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393644	FF	On-Demand	Anodyne	ADRB1	67	58
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393644	FF	On-Demand	Anodyne	GRIN1	26	45
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393644	FF	On-Demand	Anodyne	ADRB3	40	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393645	FF	On-Demand	Anodyne	ADRB2	37	58
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393645	FF	On-Demand	Anodyne	ADRB1	67	58
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393645	FF	On-Demand	Anodyne	GRIN1	26	45
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393645	FF	On-Demand	Anodyne	ADRB3	40	48
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc3c(c2)OCCCO3)c1	ZINC000819393647	FF	On-Demand	Anodyne	ADRB2	23	44
CC(=O)c1cccc(OC[C@H](O)CNc2ccc3c(c2)OCCCO3)c1	ZINC000819393649	FF	On-Demand	Anodyne	ADRB2	23	44
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393653	FI	On-Demand	Anodyne	ADRB2	68	52
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393653	FI	On-Demand	Anodyne	ADRB1	91	53
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393653	FI	On-Demand	Anodyne	GRIN1	29	42
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393653	FI	On-Demand	Anodyne	ADRB3	64	53
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393653	FI	On-Demand	Anodyne	CASR	48	44
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393653	FI	On-Demand	Anodyne	CYP2D6	18	42
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393653	FI	On-Demand	Anodyne	ABCB1	46	43
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393653	FI	On-Demand	Anodyne	FFAR1	41	37
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393653	FI	On-Demand	Anodyne	FFAR4	44	34
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393654	FI	On-Demand	Anodyne	ADRB2	68	52
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393654	FI	On-Demand	Anodyne	ADRB1	91	53
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393654	FI	On-Demand	Anodyne	GRIN1	29	42
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393654	FI	On-Demand	Anodyne	ADRB3	64	53
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393654	FI	On-Demand	Anodyne	CASR	48	44
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393654	FI	On-Demand	Anodyne	CYP2D6	18	42
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393654	FI	On-Demand	Anodyne	ABCB1	46	43
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393654	FI	On-Demand	Anodyne	FFAR1	41	37
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3ccccc3c2)cc1	ZINC000819393654	FI	On-Demand	Anodyne	FFAR4	44	34
O[C@H](CNc1ccc2c(c1)OCCO2)COc1ccccc1C(F)(F)F	ZINC000819393659	FG	On-Demand	Anodyne	ADRB1	46	32
O[C@@H](CNc1ccc2c(c1)OCCO2)COc1ccccc1C(F)(F)F	ZINC000819393660	FG	On-Demand	Anodyne	ADRB1	46	32
CN(CCC#N)C[C@@H](O)CNc1ccc(OCc2ccccc2)cc1	ZINC000819393668	EF	On-Demand	Mild	MAOB	22	41
CN(CCC#N)C[C@@H](O)CNc1ccc(OCc2ccccc2)cc1	ZINC000819393668	EF	On-Demand	Mild	LTA4H	22	41
CN(CCC#N)C[C@H](O)CNc1ccc(OCc2ccccc2)cc1	ZINC000819393669	EF	On-Demand	Mild	MAOB	22	41
CN(CCC#N)C[C@H](O)CNc1ccc(OCc2ccccc2)cc1	ZINC000819393669	EF	On-Demand	Mild	LTA4H	22	41
CC(C)c1nn(-c2ccccc2)cc1C(=O)NOCC(F)(F)F	ZINC000819393682	EG	On-Demand	Anodyne	CARM1	51	36
O[C@H](CNc1ccc(OCc2ccccc2)cc1)C1CC1	ZINC000819393689	CG	On-Demand	Anodyne	MAOB	21	42
O[C@H](CNc1ccc(OCc2ccccc2)cc1)C1CC1	ZINC000819393689	CG	On-Demand	Anodyne	LTA4H	33	47
O[C@H](CNc1ccc(OCc2ccccc2)cc1)C1CC1	ZINC000819393689	CG	On-Demand	Anodyne	FFAR1	24	40
O[C@@H](CNc1ccc(OCc2ccccc2)cc1)C1CC1	ZINC000819393690	CG	On-Demand	Anodyne	MAOB	21	42
O[C@@H](CNc1ccc(OCc2ccccc2)cc1)C1CC1	ZINC000819393690	CG	On-Demand	Anodyne	LTA4H	33	47
O[C@@H](CNc1ccc(OCc2ccccc2)cc1)C1CC1	ZINC000819393690	CG	On-Demand	Anodyne	FFAR1	24	40
CON(C)C(=O)CCNc1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1	ZINC000819393697	GF	On-Demand	Anodyne	PTPRB	46	35
CON(C)C(=O)CCNc1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1	ZINC000819393697	GF	On-Demand	Anodyne	ALPL	15	51
CON(C)C(=O)CCNc1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1	ZINC000819393697	GF	On-Demand	Anodyne	ALPI	20	42
CCOc1ccc(OC[C@@H](O)CNc2ccccc2OC)cc1	ZINC000819393705	DF	On-Demand	Clean	ADRB2	62	49
CCOc1ccc(OC[C@@H](O)CNc2ccccc2OC)cc1	ZINC000819393705	DF	On-Demand	Clean	ADRB1	72	48
CCOc1ccc(OC[C@@H](O)CNc2ccccc2OC)cc1	ZINC000819393705	DF	On-Demand	Clean	ADRB3	39	48
CCOc1ccc(OC[C@@H](O)CNc2ccccc2OC)cc1	ZINC000819393705	DF	On-Demand	Clean	CYP2D6	20	41
CCOc1ccc(OC[C@@H](O)CNc2ccccc2OC)cc1	ZINC000819393705	DF	On-Demand	Clean	ABCB1	27	40
CCOc1ccc(OC[C@@H](O)CNc2ccccc2OC)cc1	ZINC000819393705	DF	On-Demand	Clean	PDS	42	35
CCOc1ccc(OC[C@H](O)CNc2ccccc2OC)cc1	ZINC000819393706	DF	On-Demand	Clean	ADRB2	62	49
CCOc1ccc(OC[C@H](O)CNc2ccccc2OC)cc1	ZINC000819393706	DF	On-Demand	Clean	ADRB1	72	48
CCOc1ccc(OC[C@H](O)CNc2ccccc2OC)cc1	ZINC000819393706	DF	On-Demand	Clean	ADRB3	39	48
CCOc1ccc(OC[C@H](O)CNc2ccccc2OC)cc1	ZINC000819393706	DF	On-Demand	Clean	CYP2D6	20	41
CCOc1ccc(OC[C@H](O)CNc2ccccc2OC)cc1	ZINC000819393706	DF	On-Demand	Clean	ABCB1	27	40
CCOc1ccc(OC[C@H](O)CNc2ccccc2OC)cc1	ZINC000819393706	DF	On-Demand	Clean	PDS	42	35
CCCc1ccc(NC[C@@H](O)CCNC(=O)OC(C)(C)C)cc1	ZINC000819393709	DG	On-Demand	Anodyne	CTSK	17	41
CCCc1ccc(NC[C@@H](O)CCNC(=O)OC(C)(C)C)cc1	ZINC000819393709	DG	On-Demand	Anodyne	PTPRB	27	41
CCCc1ccc(NC[C@H](O)CCNC(=O)OC(C)(C)C)cc1	ZINC000819393710	DG	On-Demand	Anodyne	CTSK	17	41
CCCc1ccc(NC[C@H](O)CCNC(=O)OC(C)(C)C)cc1	ZINC000819393710	DG	On-Demand	Anodyne	PTPRB	27	41
CCCc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819393713	EG	On-Demand	Bother	ADRB2	50	46
CCCc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819393713	EG	On-Demand	Bother	ADRB1	69	46
CCCc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819393713	EG	On-Demand	Bother	ADRB3	46	46
CCCc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819393713	EG	On-Demand	Bother	CASR	42	38
CCCc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819393713	EG	On-Demand	Bother	ABCB1	28	42
CCCc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819393714	EG	On-Demand	Bother	ADRB2	50	46
CCCc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819393714	EG	On-Demand	Bother	ADRB1	69	46
CCCc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819393714	EG	On-Demand	Bother	ADRB3	46	46
CCCc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819393714	EG	On-Demand	Bother	CASR	42	38
CCCc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819393714	EG	On-Demand	Bother	ABCB1	28	42
O=C(NCCS(=O)(=O)CC1CC1)c1cc(-c2ccc3ccccc3c2)[nH]n1	ZINC000819393728	GF	On-Demand	Anodyne	VCP	41	34
C=C(C)C(C)(C)C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	ZINC000819393742	FD	On-Demand	Reactive	NPY2R	19	40
CCCc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819393745	EH	On-Demand	Anodyne	ADRB2	58	48
CCCc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819393745	EH	On-Demand	Anodyne	ADRB1	84	48
CCCc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819393745	EH	On-Demand	Anodyne	GRIN1	27	40
CCCc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819393745	EH	On-Demand	Anodyne	ADRB3	61	48
CCCc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819393745	EH	On-Demand	Anodyne	CASR	42	36
CCCc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819393745	EH	On-Demand	Anodyne	ABCB1	27	45
CCCc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819393745	EH	On-Demand	Anodyne	PDS	80	39
CCCc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819393746	EH	On-Demand	Anodyne	ADRB2	58	48
CCCc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819393746	EH	On-Demand	Anodyne	ADRB1	84	48
CCCc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819393746	EH	On-Demand	Anodyne	GRIN1	27	40
CCCc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819393746	EH	On-Demand	Anodyne	ADRB3	61	48
CCCc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819393746	EH	On-Demand	Anodyne	CASR	42	36
CCCc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819393746	EH	On-Demand	Anodyne	ABCB1	27	45
CCCc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819393746	EH	On-Demand	Anodyne	PDS	80	39
C[C@@H]1CCCC[C@@H]1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	ZINC000819393750	GD	On-Demand	Reactive	L3MBTL3	61	34
C[C@@H]1CCCC[C@H]1C(=O)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	ZINC000819393752	GD	On-Demand	Reactive	L3MBTL3	61	34
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393763	GG	On-Demand	Anodyne	ADRB2	41	44
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393763	GG	On-Demand	Anodyne	ADRB1	70	47
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393763	GG	On-Demand	Anodyne	GRIN1	28	48
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393763	GG	On-Demand	Anodyne	ADRB3	48	44
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393765	GG	On-Demand	Anodyne	ADRB2	41	44
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393765	GG	On-Demand	Anodyne	ADRB1	70	47
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393765	GG	On-Demand	Anodyne	GRIN1	28	48
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393765	GG	On-Demand	Anodyne	ADRB3	48	44
CC(C)c1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819393766	DH	On-Demand	Bother	CACNA1C	40	36
CC(C)c1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819393766	DH	On-Demand	Bother	CACNA1D	61	36
CCOc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393767	FG	On-Demand	Anodyne	ADRB2	34	41
CCOc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393767	FG	On-Demand	Anodyne	ADRB1	48	41
CCOc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393767	FG	On-Demand	Anodyne	GRIN1	23	45
CC(C)c1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819393768	DH	On-Demand	Bother	CACNA1C	40	36
CC(C)c1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819393768	DH	On-Demand	Bother	CACNA1D	61	36
CCOc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393769	FG	On-Demand	Anodyne	ADRB2	34	41
CCOc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393769	FG	On-Demand	Anodyne	ADRB1	48	41
CCOc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393769	FG	On-Demand	Anodyne	GRIN1	23	45
CCCc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819393797	DH	On-Demand	Bother	ADRB2	27	46
CCCc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819393797	DH	On-Demand	Bother	ADRB1	26	42
CCCc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819393797	DH	On-Demand	Bother	ADRB3	52	42
CCCc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819393797	DH	On-Demand	Bother	CACNA1D	46	35
CCCc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819393798	DH	On-Demand	Bother	ADRB2	27	46
CCCc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819393798	DH	On-Demand	Bother	ADRB1	26	42
CCCc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819393798	DH	On-Demand	Bother	ADRB3	52	42
CCCc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819393798	DH	On-Demand	Bother	CACNA1D	46	35
O=S(=O)(CCNc1ccc2c(c1)OCCCO2)c1ccc(F)cc1	ZINC000819393819	FF	On-Demand	Anodyne	PKM	39	45
C/C=C\c1ccc(OC[C@H](O)CNc2ccccc2OC)c(OC)c1	ZINC000819393823	EH	On-Demand	Clean	ADRB2	31	72
C/C=C\c1ccc(OC[C@H](O)CNc2ccccc2OC)c(OC)c1	ZINC000819393823	EH	On-Demand	Clean	TUBB1	41	36
C/C=C/c1ccc(OC[C@H](O)CNc2ccccc2OC)c(OC)c1	ZINC000819393825	EH	On-Demand	Clean	ADRB2	31	72
C/C=C/c1ccc(OC[C@H](O)CNc2ccccc2OC)c(OC)c1	ZINC000819393825	EH	On-Demand	Clean	TUBB1	41	36
C/C=C\c1ccc(OC[C@@H](O)CNc2ccccc2OC)c(OC)c1	ZINC000819393827	EH	On-Demand	Clean	ADRB2	31	72
C/C=C\c1ccc(OC[C@@H](O)CNc2ccccc2OC)c(OC)c1	ZINC000819393827	EH	On-Demand	Clean	TUBB1	41	36
C/C=C/c1ccc(OC[C@@H](O)CNc2ccccc2OC)c(OC)c1	ZINC000819393829	EH	On-Demand	Clean	ADRB2	31	72
C/C=C/c1ccc(OC[C@@H](O)CNc2ccccc2OC)c(OC)c1	ZINC000819393829	EH	On-Demand	Clean	TUBB1	41	36
C#Cc1cccc(NC(=O)c2cc3c4ccccc4n(C)c3s2)c1	ZINC000819393833	EJ	On-Demand	Mild	KCNK3	59	36
CC(=O)Nc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819393834	GG	On-Demand	Anodyne	EPHX2	25	42
CC(=O)Nc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819393834	GG	On-Demand	Anodyne	TGM2	16	41
CC(=O)Nc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819393834	GG	On-Demand	Anodyne	F13A1	25	41
CC(=O)Nc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819393834	GG	On-Demand	Anodyne	GPR119	53	48
CC(=O)Nc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819393836	GG	On-Demand	Anodyne	EPHX2	25	42
CC(=O)Nc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819393836	GG	On-Demand	Anodyne	TGM2	16	41
CC(=O)Nc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819393836	GG	On-Demand	Anodyne	F13A1	25	41
CC(=O)Nc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819393836	GG	On-Demand	Anodyne	GPR119	53	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc3c(c2)OCCO3)CC1	ZINC000819393876	GF	On-Demand	Anodyne	GPR119	48	53
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc3c(c2)OCCO3)CC1	ZINC000819393877	GF	On-Demand	Anodyne	GPR119	48	53
O[C@@H](CNc1ccc2c(c1)OCCO2)COc1cccc2[nH]ccc12	ZINC000819393890	EF	On-Demand	Anodyne	ADRB1	21	56
O[C@H](CNc1ccc2c(c1)OCCO2)COc1cccc2[nH]ccc12	ZINC000819393891	EF	On-Demand	Anodyne	ADRB1	21	56
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393922	FF	On-Demand	Anodyne	ADRB2	38	56
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393922	FF	On-Demand	Anodyne	ADRB1	65	56
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393922	FF	On-Demand	Anodyne	GRIN1	27	47
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393922	FF	On-Demand	Anodyne	ADRB3	43	41
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393924	FF	On-Demand	Anodyne	ADRB2	38	56
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393924	FF	On-Demand	Anodyne	ADRB1	65	56
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393924	FF	On-Demand	Anodyne	GRIN1	27	47
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCCO3)cc1	ZINC000819393924	FF	On-Demand	Anodyne	ADRB3	43	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc3c(c2)OCCCO3)CC1	ZINC000819393926	GG	On-Demand	Anodyne	GPR119	43	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc3c(c2)OCCCO3)CC1	ZINC000819393928	GG	On-Demand	Anodyne	GPR119	43	51
Cc1cc(F)ccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819393929	FH	On-Demand	Anodyne	GPR119	59	56
Cc1cc(F)ccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819393932	FH	On-Demand	Anodyne	GPR119	59	56
CSc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819393937	FH	On-Demand	Anodyne	GPR119	59	58
CSc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819393940	FH	On-Demand	Anodyne	GPR119	59	58
COc1ccccc1COC[C@@H](O)CNc1ccccc1OC	ZINC000819393952	DF	On-Demand	Clean	ADRB2	28	42
COc1ccccc1COC[C@H](O)CNc1ccccc1OC	ZINC000819393954	DF	On-Demand	Clean	ADRB2	28	42
CSc1ccc(OC[C@@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393955	EG	On-Demand	Anodyne	GRIN1	24	44
CSc1ccc(OC[C@H](O)CNc2ccc3c(c2)OCCO3)cc1	ZINC000819393957	EG	On-Demand	Anodyne	GRIN1	24	44
C[C@H](C[C@@H](O)c1ccc(F)cc1)NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819393966	GH	On-Demand	Anodyne	PTGER3	43	38
C[C@@H](C[C@H](O)c1ccc(F)cc1)NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819393968	GH	On-Demand	Anodyne	PTGER3	43	38
C#Cc1cccc(NC(=O)c2ccc3c(=O)n4c(nc3c2)CCCCC4)c1	ZINC000819393976	FG	On-Demand	Mild	RPS6KA3	43	37
CCCc1ccc(NCCC(=O)Nc2cccnc2)cc1	ZINC000819393979	CG	On-Demand	Anodyne	ADRB3	48	44
CCCc1ccc(NCCC(=O)Nc2cccnc2)cc1	ZINC000819393979	CG	On-Demand	Anodyne	NAMPT	34	44
O[C@@H](CNc1ccc2c(c1)OCCCO2)c1cccnc1	ZINC000819393992	CE	On-Demand	Anodyne	ADRB3	86	43
O[C@H](CNc1ccc2c(c1)OCCCO2)c1cccnc1	ZINC000819393994	CE	On-Demand	Anodyne	ADRB3	86	43
CCCc1ccc(NCCC(=O)Nc2cc(OC)c(OC)c(OC)c2)cc1	ZINC000819394000	FI	On-Demand	Anodyne	MTNR1A	21	45
CCCc1ccc(NCCC(=O)Nc2cc(OC)c(OC)c(OC)c2)cc1	ZINC000819394000	FI	On-Demand	Anodyne	MTNR1B	23	45
CCCc1ccc(NCCC(=O)Nc2cc(OC)c(OC)c(OC)c2)cc1	ZINC000819394000	FI	On-Demand	Anodyne	ENPP1	66	33
CCCc1ccc(NCCC(=O)Nc2cc(OC)c(OC)c(OC)c2)cc1	ZINC000819394000	FI	On-Demand	Anodyne	DRTS_TRYCR	57	33
O[C@@H](CNc1ccc2c(c1)CCC2)c1cccnc1	ZINC000819394006	CF	On-Demand	Anodyne	ADRB2	25	40
O[C@@H](CNc1ccc2c(c1)CCC2)c1cccnc1	ZINC000819394006	CF	On-Demand	Anodyne	ADRB3	93	45
O[C@H](CNc1ccc2c(c1)CCC2)c1cccnc1	ZINC000819394014	CF	On-Demand	Anodyne	ADRB2	25	40
O[C@H](CNc1ccc2c(c1)CCC2)c1cccnc1	ZINC000819394014	CF	On-Demand	Anodyne	ADRB3	93	45
C[C@@H](CNc1ccc2c(c1)OCCO2)S(C)(=O)=O	ZINC000819394043	CD	On-Demand	Anodyne	PKM	32	40
C=C(C)C(C)(C)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819394074	GE	On-Demand	Reactive	DRD4	30	45
C=C(C)C(C)(C)C(=O)NNC(=O)CN1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819394074	GE	On-Demand	Reactive	LSS	16	42
CCCc1ccc(NC[C@@H](O)CCOC(C)C)cc1	ZINC000819394075	CG	On-Demand	Anodyne	ADRB1	15	43
CCCc1ccc(NC[C@H](O)CCOC(C)C)cc1	ZINC000819394076	CG	On-Demand	Anodyne	ADRB1	15	43
Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819394081	CG	On-Demand	Bother	CACNA1D	55	34
Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819394082	CG	On-Demand	Bother	CACNA1D	55	34
COCCc1ccc(OC[C@@H](O)CNc2ccc(OC)c(Cl)c2)cc1	ZINC000819394093	FG	On-Demand	Anodyne	ADRB2	47	57
COCCc1ccc(OC[C@@H](O)CNc2ccc(OC)c(Cl)c2)cc1	ZINC000819394093	FG	On-Demand	Anodyne	ADRB1	71	57
COCCc1ccc(OC[C@@H](O)CNc2ccc(OC)c(Cl)c2)cc1	ZINC000819394093	FG	On-Demand	Anodyne	GRIN1	30	43
COCCc1ccc(OC[C@@H](O)CNc2ccc(OC)c(Cl)c2)cc1	ZINC000819394093	FG	On-Demand	Anodyne	ADRB3	51	44
COCCc1ccc(OC[C@H](O)CNc2ccc(OC)c(Cl)c2)cc1	ZINC000819394094	FG	On-Demand	Anodyne	ADRB2	47	57
COCCc1ccc(OC[C@H](O)CNc2ccc(OC)c(Cl)c2)cc1	ZINC000819394094	FG	On-Demand	Anodyne	ADRB1	71	57
COCCc1ccc(OC[C@H](O)CNc2ccc(OC)c(Cl)c2)cc1	ZINC000819394094	FG	On-Demand	Anodyne	GRIN1	30	43
COCCc1ccc(OC[C@H](O)CNc2ccc(OC)c(Cl)c2)cc1	ZINC000819394094	FG	On-Demand	Anodyne	ADRB3	51	44
C#CCNC(=O)CCNc1ccc(OC)c(Cc2ccccc2)c1	ZINC000819394147	DF	On-Demand	Mild	TSHR	53	31
C#CCNC(=O)CCNc1ccc(OC)c(Cc2ccccc2)c1	ZINC000819394147	DF	On-Demand	Mild	DRTS_TRYCR	44	31
O=C(/C=C/[C@@H]1CCCO1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	ZINC000819394158	GC	On-Demand	Reactive	L3MBTL3	43	32
O=C(/C=C\[C@@H]1CCCO1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	ZINC000819394160	GC	On-Demand	Reactive	L3MBTL3	43	32
O=C(/C=C/[C@H]1CCCO1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	ZINC000819394162	GC	On-Demand	Reactive	L3MBTL3	43	32
O=C(/C=C\[C@H]1CCCO1)NNC(=O)CN1CCN(C(=O)c2ccccc2)CC1	ZINC000819394164	GC	On-Demand	Reactive	L3MBTL3	43	32
CCCc1ccc(NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819394166	EG	On-Demand	Bother	CYNT	19	47
CCCc1ccc(NCCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819394166	EG	On-Demand	Bother	RORC	17	41
COCCc1ccc(OC[C@@H](O)CNc2ccccc2OC)cc1	ZINC000819394172	EF	On-Demand	Clean	ADRB2	68	65
COCCc1ccc(OC[C@@H](O)CNc2ccccc2OC)cc1	ZINC000819394172	EF	On-Demand	Clean	ADRB1	88	65
COCCc1ccc(OC[C@@H](O)CNc2ccccc2OC)cc1	ZINC000819394172	EF	On-Demand	Clean	ADRB3	59	53
COCCc1ccc(OC[C@@H](O)CNc2ccccc2OC)cc1	ZINC000819394172	EF	On-Demand	Clean	CYP2D6	18	43
COCCc1ccc(OC[C@H](O)CNc2ccccc2OC)cc1	ZINC000819394174	EF	On-Demand	Clean	ADRB2	68	65
COCCc1ccc(OC[C@H](O)CNc2ccccc2OC)cc1	ZINC000819394174	EF	On-Demand	Clean	ADRB1	88	65
COCCc1ccc(OC[C@H](O)CNc2ccccc2OC)cc1	ZINC000819394174	EF	On-Demand	Clean	ADRB3	59	53
COCCc1ccc(OC[C@H](O)CNc2ccccc2OC)cc1	ZINC000819394174	EF	On-Demand	Clean	CYP2D6	18	43
Cc1cc(F)ccc1NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819394204	FH	On-Demand	Anodyne	GPR119	30	40
Cc1cc(F)ccc1NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819394206	FH	On-Demand	Anodyne	GPR119	30	40
CCCc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819394214	EG	On-Demand	Anodyne	ADRB2	64	65
CCCc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819394214	EG	On-Demand	Anodyne	ADRB1	95	65
CCCc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819394214	EG	On-Demand	Anodyne	INHA	15	41
CCCc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819394214	EG	On-Demand	Anodyne	GRIN1	31	45
CCCc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819394214	EG	On-Demand	Anodyne	ADRB3	65	65
CCCc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819394215	EG	On-Demand	Anodyne	ADRB2	64	65
CCCc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819394215	EG	On-Demand	Anodyne	ADRB1	95	65
CCCc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819394215	EG	On-Demand	Anodyne	INHA	15	41
CCCc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819394215	EG	On-Demand	Anodyne	GRIN1	31	45
CCCc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819394215	EG	On-Demand	Anodyne	ADRB3	65	65
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	NPR1	41	33
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	CASP3	20	52
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	BMP1	27	56
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	KLK3	78	37
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	CTSB	86	52
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	PAPA1_CARPA	93	43
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	CYSP_TRYCR	53	41
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	CTSK	45	56
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	CTSL	63	52
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	PGA	22	41
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	CAPNS1	68	41
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	MMP3	16	41
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	CTSS	24	56
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	CAPN1	95	53
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	CASP1	25	43
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	CTRC	17	40
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	CAPN2	143	44
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	ACE2	45	37
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	CASP6	21	42
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	CASP9	46	42
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	NPR	77	44
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	CASP10	25	40
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	PSMB5	50	44
C#Cc1cccc(NC(=O)[C@@H](NC(=O)OCc2ccccc2)[C@@H](C)CC)c1	ZINC000819394226	FH	On-Demand	Mild	PDS	51	35
CCCc1ccc(NCCS(=O)(=O)CC(=O)OC(C)(C)C)cc1	ZINC000819394228	EF	On-Demand	Anodyne	PTPRB	59	37
COc1cccc([S@@](=O)CC(=O)NCCS(=O)(=O)CC2CC2)c1	ZINC000819394249	FC	On-Demand	Anodyne	DRD4	40	30
COc1cccc([S@@](=O)CC(=O)NCCS(=O)(=O)CC2CC2)c1	ZINC000819394249	FC	On-Demand	Anodyne	MTNR1A	43	38
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)C(F)=C1CCC1	ZINC000819394301	GE	On-Demand	Reactive	DRD4	29	45
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)C(F)=C1CCC1	ZINC000819394301	GE	On-Demand	Reactive	SIGMAR1	16	40
O=C(CN1CCN(Cc2ccc(Cl)cc2)CC1)NNC(=O)C(F)=C1CCC1	ZINC000819394301	GE	On-Demand	Reactive	CACNA1G	19	43
C=CCc1ccc(OC[C@@H](O)CNc2ccccc2OC)c(OC)c1	ZINC000819394325	EG	On-Demand	Mild	ADRB2	35	50
C=CCc1ccc(OC[C@@H](O)CNc2ccccc2OC)c(OC)c1	ZINC000819394325	EG	On-Demand	Mild	ADRB3	15	50
C=CCc1ccc(OC[C@H](O)CNc2ccccc2OC)c(OC)c1	ZINC000819394326	EG	On-Demand	Mild	ADRB2	35	50
C=CCc1ccc(OC[C@H](O)CNc2ccccc2OC)c(OC)c1	ZINC000819394326	EG	On-Demand	Mild	ADRB3	15	50
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc3c(c2)CCC3)CC1	ZINC000819394331	FH	On-Demand	Anodyne	GPR119	49	52
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc3c(c2)CCC3)CC1	ZINC000819394332	FH	On-Demand	Anodyne	GPR119	49	52
C#Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1	ZINC000819394340	FJ	On-Demand	Mild	KCNK3	66	36
C#Cc1cccc(NC(=O)COc2cc(C)ccc2Cl)c1	ZINC000819394341	CH	On-Demand	Mild	KCNK3	66	37
C#Cc1cccc(NC(=O)COc2cc(C)ccc2Cl)c1	ZINC000819394341	CH	On-Demand	Mild	KCNK9	58	34
C=C(C)C(C)(C)C(=O)NNC(=O)CN1CCN(Cc2ccccc2Cl)CC1	ZINC000819394342	GE	On-Demand	Reactive	DRD4	18	44
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)c1	ZINC000819394435	FI	On-Demand	Mild	ECR	15	41
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)c1	ZINC000819394435	FI	On-Demand	Mild	NR1H4	20	57
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)c1	ZINC000819394435	FI	On-Demand	Mild	CSF1R	18	47
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)c1	ZINC000819394435	FI	On-Demand	Mild	TAAR1	43	41
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)c1	ZINC000819394435	FI	On-Demand	Mild	AKR1C3	15	42
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)c1	ZINC000819394435	FI	On-Demand	Mild	NR2E3	63	38
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)c1	ZINC000819394435	FI	On-Demand	Mild	KCNK3	157	63
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)c1	ZINC000819394435	FI	On-Demand	Mild	KCNK9	111	61
O=S(=O)(CCNc1ccc2c(c1)OCCO2)c1ccc(F)cc1	ZINC000819394444	EE	On-Demand	Anodyne	PKM	41	50
O=C(O)CCCCCNC(=O)N[C@@H]1CCOC2(CCSCC2)C1	ZINC000819394464	EE	On-Demand	Anodyne	EPHX2	26	46
O=C(O)CCCCCNC(=O)N[C@H]1CCOC2(CCSCC2)C1	ZINC000819394465	EE	On-Demand	Anodyne	EPHX2	26	46
O=C(O)CCCCCNC(=O)NC1CCN(C2CCCCC2)CC1	ZINC000819394466	EF	On-Demand	Anodyne	EPHX2	29	55
O=C(O)CCCCCNC(=O)NC1CCC(N2CCCCC2)CC1	ZINC000819394467	EF	On-Demand	Anodyne	EPHX2	23	52
O=C(O)CCCCCNC(=O)N1CCN(Cc2ccc3c(c2)OCCO3)CC1	ZINC000819394468	GD	On-Demand	Anodyne	MCHR1	24	44
O=C(O)CCCCCNC(=O)NC1(c2ccc(F)cc2)CCC1	ZINC000819394477	DG	On-Demand	Anodyne	EPHX2	20	46
O=C(O)CCCCCNC(=O)NC1CCN(C2CCCC2)CC1	ZINC000819394481	EE	On-Demand	Anodyne	EPHX2	29	53
O=C(O)CCCCCNC(=O)N1CCC(n2ccnc2)CC1	ZINC000819394484	DD	On-Demand	Anodyne	TBXAS1	22	43
O=C(O)CCCCCNC(=O)N1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000819394490	EC	On-Demand	Anodyne	SLC18A3	28	40
O=C(O)CCCCCNC(=O)N1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000819394491	EC	On-Demand	Anodyne	SLC18A3	28	40
O=C(O)CCCCCNC(=O)N1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000819394492	EC	On-Demand	Anodyne	SLC18A3	28	40
O=C(O)CCCCCNC(=O)N1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000819394493	EC	On-Demand	Anodyne	SLC18A3	28	40
O=C(O)CCCCCNC(=O)N[C@@H]1CC[S@@](=O)C1	ZINC000819394494	CC	On-Demand	Anodyne	EPHX2	21	46
O=C(O)CCCCCNC(=O)N[C@@H]1CC[S@](=O)C1	ZINC000819394495	CC	On-Demand	Anodyne	EPHX2	21	46
O=C(O)CCCCCNC(=O)N[C@H]1CC[S@@](=O)C1	ZINC000819394496	CC	On-Demand	Anodyne	EPHX2	21	46
O=C(O)CCCCCNC(=O)N[C@H]1CC[S@](=O)C1	ZINC000819394497	CC	On-Demand	Anodyne	EPHX2	21	46
O=C(O)CCCCCNC(=O)NC1CCN(c2cccs2)CC1	ZINC000819394500	EF	On-Demand	Anodyne	EPHX2	34	43
O=C(O)CCCCCNC(=O)N1CCCN(C2CCCC2)CC1	ZINC000819394501	EE	On-Demand	Anodyne	HRH3	16	50
O=C(O)CCCCCNC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1	ZINC000819394505	FC	On-Demand	Anodyne	EPHX2	30	47
O=C(O)CCCCCNC(=O)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819394506	FF	On-Demand	Anodyne	HRH2	20	42
O=C(O)CCCCCNC(=O)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819394506	FF	On-Demand	Anodyne	SIGMAR1	23	42
O=C(O)CCCCCNC(=O)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819394506	FF	On-Demand	Anodyne	CCR3	30	49
O=C(O)CCCCCNC(=O)NC1CCN(C(=O)c2ccoc2)CC1	ZINC000819394507	FD	On-Demand	Anodyne	EPHX2	40	46
O=C(O)CCCCCNC(=O)NC1CCC2(CC1)OCCO2	ZINC000819394511	DD	On-Demand	Anodyne	EPHX2	27	47
O=C(O)CCCCCNC(=O)N1CCC[C@H](N2CCCC2)CC1	ZINC000819394515	EE	On-Demand	Anodyne	L3MBTL3	84	44
O=C(O)CCCCCNC(=O)N1CCC[C@@H](N2CCCC2)CC1	ZINC000819394516	EE	On-Demand	Anodyne	L3MBTL3	84	44
O=C(O)CCCCCNC(=O)NCc1ccc(Cl)nc1	ZINC000819394517	CE	On-Demand	Anodyne	EPHX2	16	42
O=C(O)CCCCCNC(=O)NCc1ccc(Cl)nc1	ZINC000819394517	CE	On-Demand	Anodyne	NACHRBETA2	27	42
O=C(O)CCCCCNC(=O)N[C@@H]1CCOC2(CCOCC2)C1	ZINC000819394522	ED	On-Demand	Anodyne	EPHX2	24	44
CC(=O)N1CCc2cc(NC[C@H](O)c3ccc(C#N)cc3)ccc21	ZINC000819394523	DF	On-Demand	Mild	HSD17B3	35	42
O=C(O)CCCCCNC(=O)N[C@H]1CCOC2(CCOCC2)C1	ZINC000819394524	ED	On-Demand	Anodyne	EPHX2	24	44
CC(=O)Nc1ccc(NC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819394543	GG	On-Demand	Anodyne	EPHX2	18	42
CC(=O)Nc1ccc(NC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819394543	GG	On-Demand	Anodyne	F13A1	16	41
CC(=O)Nc1ccc(NC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819394544	GG	On-Demand	Anodyne	EPHX2	18	42
CC(=O)Nc1ccc(NC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819394544	GG	On-Demand	Anodyne	F13A1	16	41
O[C@@H](CNc1ccc(-c2nc3ccccc3s2)cc1)C1CC1	ZINC000819394545	DI	On-Demand	Anodyne	APP	20	41
O[C@@H](CNc1ccc(-c2nc3ccccc3s2)cc1)C1CC1	ZINC000819394545	DI	On-Demand	Anodyne	LUCI_PHOPE	15	45
O[C@H](CNc1ccc(-c2nc3ccccc3s2)cc1)C1CC1	ZINC000819394546	DI	On-Demand	Anodyne	APP	20	41
O[C@H](CNc1ccc(-c2nc3ccccc3s2)cc1)C1CC1	ZINC000819394546	DI	On-Demand	Anodyne	LUCI_PHOPE	15	45
CC(=O)N1CCc2cc(NC[C@@H](O)c3ccc(C#N)cc3)ccc21	ZINC000819394554	DF	On-Demand	Mild	HSD17B3	35	42
CC(=O)N1CCc2cc(NC[C@@H](O)c3ccc(F)c(Br)c3)ccc21	ZINC000819394564	GH	On-Demand	Anodyne	HSD17B3	44	36
O[C@@H](CNc1ccc2c(c1)OCCCO2)COc1cccc2[nH]ccc12	ZINC000819394565	FG	On-Demand	Anodyne	ADRB1	21	57
O[C@H](CNc1ccc2c(c1)OCCCO2)COc1cccc2[nH]ccc12	ZINC000819394566	FG	On-Demand	Anodyne	ADRB1	21	57
CC(=O)N1CCc2cc(NC[C@H](O)c3ccc(F)c(Br)c3)ccc21	ZINC000819394570	GH	On-Demand	Anodyne	HSD17B3	44	36
CCC[C@H](C)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394576	FI	On-Demand	Mild	CELA1	29	40
CCC[C@H](C)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394576	FI	On-Demand	Mild	HLA-DRB3	55	37
CCC[C@H](C)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394576	FI	On-Demand	Mild	CMA1	30	40
CCC[C@H](C)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394576	FI	On-Demand	Mild	PAPA1_CARPA	32	45
CCC[C@H](C)[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394576	FI	On-Demand	Mild	NTSR1	43	42
CCC[C@H](C)[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394578	FI	On-Demand	Mild	CELA1	29	40
CCC[C@H](C)[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394578	FI	On-Demand	Mild	HLA-DRB3	55	37
CCC[C@H](C)[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394578	FI	On-Demand	Mild	CMA1	30	40
CCC[C@H](C)[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394578	FI	On-Demand	Mild	PAPA1_CARPA	32	45
CCC[C@H](C)[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394578	FI	On-Demand	Mild	NTSR1	43	42
CCC[C@H](C)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394579	FI	On-Demand	Mild	CELA1	29	40
CCC[C@H](C)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394579	FI	On-Demand	Mild	HLA-DRB3	55	37
CCC[C@H](C)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394579	FI	On-Demand	Mild	CMA1	30	40
CCC[C@H](C)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394579	FI	On-Demand	Mild	PAPA1_CARPA	32	45
CCC[C@H](C)[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394579	FI	On-Demand	Mild	NTSR1	43	42
CCC[C@H](C)[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394580	FI	On-Demand	Mild	CELA1	29	40
CCC[C@H](C)[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394580	FI	On-Demand	Mild	HLA-DRB3	55	37
CCC[C@H](C)[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394580	FI	On-Demand	Mild	CMA1	30	40
CCC[C@H](C)[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394580	FI	On-Demand	Mild	PAPA1_CARPA	32	45
CCC[C@H](C)[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819394580	FI	On-Demand	Mild	NTSR1	43	42
O=C(CCNc1ccc(N2CCCCCC2)cc1)Nc1ccccc1F	ZINC000819394593	FJ	On-Demand	Anodyne	KCNQ2	76	44
O=C(CCNc1ccc(N2CCCCCC2)cc1)Nc1ccccc1F	ZINC000819394593	FJ	On-Demand	Anodyne	CHRNA7	22	40
O=C(CCNc1ccc(N2CCCCCC2)cc1)Nc1ccccc1F	ZINC000819394593	FJ	On-Demand	Anodyne	PRNP	40	34
O=C(CCNc1ccc(N2CCCCCC2)cc1)Nc1ccccc1F	ZINC000819394593	FJ	On-Demand	Anodyne	DGAT1	18	53
CC(=O)N1CCc2cc(NC[C@H](O)C3CC3)ccc21	ZINC000819394596	CD	On-Demand	Anodyne	HSD17B3	47	41
CC(=O)N1CCc2cc(NC[C@@H](O)C3CC3)ccc21	ZINC000819394597	CD	On-Demand	Anodyne	HSD17B3	47	41
O=C(O)CCCCCNC(=O)N1CCC[C@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000819394609	GH	On-Demand	Anodyne	PRCP	38	51
O=C(O)CCCCCNC(=O)N1CCC[C@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000819394609	GH	On-Demand	Anodyne	GRIN2D	52	34
O=C(O)CCCCCNC(=O)N1CCC[C@@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000819394610	GH	On-Demand	Anodyne	PRCP	38	51
O=C(O)CCCCCNC(=O)N1CCC[C@@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000819394610	GH	On-Demand	Anodyne	GRIN2D	52	34
O=C(O)CCCCCNC(=O)N1CCN(Cc2cccnc2)CC1	ZINC000819394612	ED	On-Demand	Anodyne	TBXAS1	97	52
O=C(O)CCCCCNC(=O)N1CCN(Cc2cccnc2)CC1	ZINC000819394612	ED	On-Demand	Anodyne	PTAFR	26	53
O=C(O)CCCCCNC(=O)N1CCN(Cc2cccnc2)CC1	ZINC000819394612	ED	On-Demand	Anodyne	FAAH	35	43
O=C(O)CCCCCNC(=O)N1CCN(Cc2cccnc2)CC1	ZINC000819394612	ED	On-Demand	Anodyne	NAMPT	41	37
O=C(O)CCCCCNC(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000819394621	ED	On-Demand	Anodyne	EPHX2	43	57
O=C(O)CCCCCNC(=O)NC1(c2ccccc2)CC1	ZINC000819394624	CF	On-Demand	Anodyne	EPHX2	39	51
O=C(O)CCCCCNC(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000819394625	FD	On-Demand	Anodyne	SLC18A3	33	42
O=C(O)CCCCCNC(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000819394625	FD	On-Demand	Anodyne	EPHX2	28	49
O=C(O)CCCCCNC(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000819394626	FD	On-Demand	Anodyne	SLC18A3	33	42
O=C(O)CCCCCNC(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000819394626	FD	On-Demand	Anodyne	EPHX2	28	49
O=C(O)CCCCCNC(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000819394627	FD	On-Demand	Anodyne	SLC18A3	33	42
O=C(O)CCCCCNC(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000819394627	FD	On-Demand	Anodyne	EPHX2	28	49
O=C(O)CCCCCNC(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000819394628	FD	On-Demand	Anodyne	SLC18A3	33	42
O=C(O)CCCCCNC(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000819394628	FD	On-Demand	Anodyne	EPHX2	28	49
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)c1	ZINC000819394642	GI	On-Demand	Anodyne	ADRB2	34	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)c1	ZINC000819394642	GI	On-Demand	Anodyne	ADRB1	51	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)c1	ZINC000819394642	GI	On-Demand	Anodyne	DRD4	45	37
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)c1	ZINC000819394642	GI	On-Demand	Anodyne	ACOX1	41	33
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)c1	ZINC000819394642	GI	On-Demand	Anodyne	PRNP	49	35
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)c1	ZINC000819394642	GI	On-Demand	Anodyne	ABCB1	39	50
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)c1	ZINC000819394644	GI	On-Demand	Anodyne	ADRB2	34	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)c1	ZINC000819394644	GI	On-Demand	Anodyne	ADRB1	51	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)c1	ZINC000819394644	GI	On-Demand	Anodyne	DRD4	45	37
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)c1	ZINC000819394644	GI	On-Demand	Anodyne	ACOX1	41	33
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)c1	ZINC000819394644	GI	On-Demand	Anodyne	PRNP	49	35
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)c1	ZINC000819394644	GI	On-Demand	Anodyne	ABCB1	39	50
CC(=O)N1CCc2cc(NC[C@H](O)c3cc(C)cc(C)c3)ccc21	ZINC000819394650	DG	On-Demand	Anodyne	HSD17B3	42	29
CC(=O)N1CCc2cc(NC[C@@H](O)c3cc(C)cc(C)c3)ccc21	ZINC000819394653	DG	On-Demand	Anodyne	HSD17B3	42	29
O=C(O)CCCCCNC(=O)N1CCCN(C(=O)Oc2ccccc2)CC1	ZINC000819394657	GF	On-Demand	Anodyne	P2RY12	51	36
CC1CCN(c2ccc(NC[C@@H](O)CCNC(=O)OC(C)(C)C)cc2)CC1	ZINC000819394658	GH	On-Demand	Anodyne	GPR119	18	42
O=C(O)CCCCCNC(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819394659	FE	On-Demand	Anodyne	FAAH	22	43
O=C(O)CCCCCNC(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819394659	FE	On-Demand	Anodyne	NACHRBETA2	42	37
CC1CCN(c2ccc(NC[C@H](O)CCNC(=O)OC(C)(C)C)cc2)CC1	ZINC000819394660	GH	On-Demand	Anodyne	GPR119	18	42
CC(=O)N1CCc2cc(NC[C@@H](O)c3ccc(F)cc3Cl)ccc21	ZINC000819394661	EH	On-Demand	Anodyne	HSD17B3	41	36
CC(=O)N1CCc2cc(NC[C@H](O)c3ccc(F)cc3Cl)ccc21	ZINC000819394662	EH	On-Demand	Anodyne	HSD17B3	41	36
O[C@@H](CNc1ccc2nc(N3CCOCC3)sc2c1)c1ccccc1	ZINC000819394665	FG	On-Demand	Anodyne	CASR	43	43
O[C@H](CNc1ccc2nc(N3CCOCC3)sc2c1)c1ccccc1	ZINC000819394666	FG	On-Demand	Anodyne	CASR	43	43
O=C(CCNc1ccc(N2CCCCCC2)cc1)Nc1cccnc1	ZINC000819394667	EH	On-Demand	Anodyne	CHRNA7	30	49
O=C(CCNc1ccc(N2CCCCCC2)cc1)Nc1cccnc1	ZINC000819394667	EH	On-Demand	Anodyne	PRNP	36	42
O=C(CCNc1ccc(N2CCCCCC2)cc1)Nc1cccnc1	ZINC000819394667	EH	On-Demand	Anodyne	STAT6	69	32
O=C(CCNc1ccc(N2CCCCCC2)cc1)Nc1cccnc1	ZINC000819394667	EH	On-Demand	Anodyne	NAMPT	43	42
COCCc1ccc(OC[C@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819394676	GH	On-Demand	Anodyne	ADRB2	43	53
COCCc1ccc(OC[C@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819394676	GH	On-Demand	Anodyne	ADRB1	73	53
COCCc1ccc(OC[C@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819394676	GH	On-Demand	Anodyne	ADRB3	53	42
COCCc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819394677	GH	On-Demand	Anodyne	ADRB2	43	53
COCCc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819394677	GH	On-Demand	Anodyne	ADRB1	73	53
COCCc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819394677	GH	On-Demand	Anodyne	ADRB3	53	42
NC(=O)CCNc1ccc(N2CCCCCC2)cc1	ZINC000819394680	CE	On-Demand	Anodyne	STAT6	68	33
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819394686	GH	On-Demand	Anodyne	ADRB2	46	60
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819394686	GH	On-Demand	Anodyne	ADRB1	77	60
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819394686	GH	On-Demand	Anodyne	ADRB3	50	49
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819394686	GH	On-Demand	Anodyne	PRNP	45	33
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819394687	GH	On-Demand	Anodyne	ADRB2	46	60
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819394687	GH	On-Demand	Anodyne	ADRB1	77	60
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819394687	GH	On-Demand	Anodyne	ADRB3	50	49
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819394687	GH	On-Demand	Anodyne	PRNP	45	33
CC(=O)N1CCc2cc(NC[C@@H](O)c3ccc(Cl)cc3Cl)ccc21	ZINC000819394690	FI	On-Demand	Anodyne	CNR1	51	31
CC(=O)N1CCc2cc(NC[C@@H](O)c3ccc(Cl)cc3Cl)ccc21	ZINC000819394690	FI	On-Demand	Anodyne	HSD17B3	54	38
CC(=O)N1CCc2cc(NC[C@H](O)c3ccc(Cl)cc3Cl)ccc21	ZINC000819394691	FI	On-Demand	Anodyne	CNR1	51	31
CC(=O)N1CCc2cc(NC[C@H](O)c3ccc(Cl)cc3Cl)ccc21	ZINC000819394691	FI	On-Demand	Anodyne	HSD17B3	54	38
CC1CCN(c2ccc(NC[C@H](O)CN3CCOCC3)cc2)CC1	ZINC000819394698	EE	On-Demand	Anodyne	STAT6	42	31
CC1CCN(c2ccc(NC[C@@H](O)CN3CCOCC3)cc2)CC1	ZINC000819394699	EE	On-Demand	Anodyne	STAT6	42	31
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(C(=O)OCC)cc3)CC2)c1	ZINC000819394700	IF	On-Demand	Mild	P2RY12	23	40
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(C(=O)OCC)cc3)CC2)c1	ZINC000819394700	IF	On-Demand	Mild	EPHX2	40	49
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(C(=O)OCC)cc3)CC2)c1	ZINC000819394700	IF	On-Demand	Mild	TGM2	69	39
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(C(=O)OCC)cc3)CC2)c1	ZINC000819394700	IF	On-Demand	Mild	F13A1	72	39
O=C(O)CCCCCNC(=O)N1CCN(Cc2ccncc2)CC1	ZINC000819394714	ED	On-Demand	Anodyne	FAAH	22	42
O=C(O)CCCCCNC(=O)N1CCCC[C@H](N2CCCC2)C1	ZINC000819394719	EE	On-Demand	Anodyne	L3MBTL3	52	37
O=C(O)CCCCCNC(=O)N1CCCC[C@@H](N2CCCC2)C1	ZINC000819394720	EE	On-Demand	Anodyne	L3MBTL3	52	37
O=C(O)CCCCCNC(=O)N[C@@H]1CCO[C@@]2(CCSC2)C1	ZINC000819394721	ED	On-Demand	Anodyne	EPHX2	22	44
O=C(O)CCCCCNC(=O)N[C@@H]1CCO[C@]2(CCSC2)C1	ZINC000819394722	ED	On-Demand	Anodyne	EPHX2	22	44
O=C(O)CCCCCNC(=O)N[C@H]1CCO[C@]2(CCSC2)C1	ZINC000819394723	ED	On-Demand	Anodyne	EPHX2	22	44
O=C(O)CCCCCNC(=O)N[C@H]1CCO[C@@]2(CCSC2)C1	ZINC000819394724	ED	On-Demand	Anodyne	EPHX2	22	44
O=C(O)CCCCCNC(=O)NC1CCN(C(=O)c2ccco2)CC1	ZINC000819394731	FD	On-Demand	Anodyne	EPHX2	41	46
O=C(O)CCCCCNC(=O)NCc1ccc(O)cc1	ZINC000819394734	CD	On-Demand	Anodyne	FOLH1	20	42
O=C(O)CCCCCNC(=O)NCc1ccc(O)cc1	ZINC000819394734	CD	On-Demand	Anodyne	NAALAD2	19	40
O=C(O)CCCCCNC(=O)NCc1ccc(O)cc1	ZINC000819394734	CD	On-Demand	Anodyne	GRIA1	80	38
O=C(O)CCCCCNC(=O)NCc1ccc(O)cc1	ZINC000819394734	CD	On-Demand	Anodyne	EPHX2	20	45
O=C(O)CCCCCNC(=O)N1CCN(CC(F)F)CC1	ZINC000819394754	DD	On-Demand	Anodyne	ASAH1	44	30
O=C(O)CCCCCNC(=O)N1CCN(Cc2cn3ccccc3n2)CC1	ZINC000819394756	FD	On-Demand	Anodyne	DRD3	20	48
O=C(O)CCCCCNC(=O)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000819394757	ED	On-Demand	Anodyne	EPHX2	27	46
O=C(O)CCCCCNC(=O)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000819394758	ED	On-Demand	Anodyne	EPHX2	27	46
O=C(O)CCCCCNC(=O)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000819394759	ED	On-Demand	Anodyne	EPHX2	27	46
O=C(O)CCCCCNC(=O)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000819394760	ED	On-Demand	Anodyne	EPHX2	27	46
O=C(O)CCCCCNC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000819394761	GD	On-Demand	Anodyne	EPHX2	30	47
O=C(O)CCCCCNC(=O)NC[C@]1(O)CCSC1	ZINC000819394762	CC	On-Demand	Anodyne	EPHX2	20	47
O=C(O)CCCCCNC(=O)NC[C@@]1(O)CCSC1	ZINC000819394763	CC	On-Demand	Anodyne	EPHX2	20	47
O=C(O)CCCCCNC(=O)N1CC[C@H]1c1cccc(F)c1	ZINC000819394765	DF	On-Demand	Anodyne	ASAH1	53	33
O=C(O)CCCCCNC(=O)N1CC[C@@H]1c1cccc(F)c1	ZINC000819394766	DF	On-Demand	Anodyne	ASAH1	53	33
O=C(O)CCCCCNC(=O)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819394767	FE	On-Demand	Anodyne	DRD2	15	40
O=C(O)CCCCCNC(=O)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819394767	FE	On-Demand	Anodyne	DRD4	19	40
O=C(O)CCCCCNC(=O)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819394767	FE	On-Demand	Anodyne	CHRM3	15	41
O=C(O)CCCCCNC(=O)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819394767	FE	On-Demand	Anodyne	SIGMAR1	26	51
O=C(O)CCCCCNC(=O)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819394767	FE	On-Demand	Anodyne	CCR3	34	45
O=C(O)CCCCCNC(=O)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819394767	FE	On-Demand	Anodyne	FAAH	26	48
O=C(O)CCCCCNC(=O)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819394767	FE	On-Demand	Anodyne	CACNA1G	28	41
O=C(O)CCCCCNC(=O)N[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819394781	EG	On-Demand	Anodyne	EPHX2	17	40
O=C(O)CCCCCNC(=O)N[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819394782	EG	On-Demand	Anodyne	EPHX2	17	40
O=C(O)CCCCCNC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819394784	FE	On-Demand	Bother	SSTR1	43	45
O=C(O)CCCCCNC(=O)NC1CCN(C2CC2)CC1	ZINC000819394785	CD	On-Demand	Anodyne	EPHX2	31	50
O=C(O)CCCCCNC(=O)NC[C@H]1CC1(Cl)Cl	ZINC000819394786	CE	On-Demand	Anodyne	EPHX2	31	55
O=C(O)CCCCCNC(=O)NC[C@@H]1CC1(Cl)Cl	ZINC000819394787	CE	On-Demand	Anodyne	EPHX2	31	55
O=C(O)CCCCCNC(=O)N1CCC[C@@H](c2noc(C3CC3)n2)C1	ZINC000819394788	FE	On-Demand	Anodyne	ETHR	59	44
O=C(O)CCCCCNC(=O)N1CCC[C@H](c2noc(C3CC3)n2)C1	ZINC000819394789	FE	On-Demand	Anodyne	ETHR	59	44
O=C(O)CCCCCNC(=O)N1CCC[C@@H](n2ccnc2)C1	ZINC000819394790	DD	On-Demand	Anodyne	TBXAS1	18	40
O=C(O)CCCCCNC(=O)N1CCC[C@H](n2ccnc2)C1	ZINC000819394791	DD	On-Demand	Anodyne	TBXAS1	18	40
O=C(O)CCCCCNC(=O)NC1(c2ccccc2)CCC1	ZINC000819394796	DG	On-Demand	Anodyne	EPHX2	32	49
O=C(O)CCCCCNC(=O)NCC1(O)CCOCC1	ZINC000819394800	CC	On-Demand	Anodyne	EPHX2	16	50
COc1cc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc(OC)c1	ZINC000819394820	FH	On-Demand	Anodyne	ADRB2	18	40
COc1cc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc(OC)c1	ZINC000819394820	FH	On-Demand	Anodyne	GRIN2B	18	40
COc1cc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc(OC)c1	ZINC000819394821	FH	On-Demand	Anodyne	ADRB2	18	40
COc1cc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc(OC)c1	ZINC000819394821	FH	On-Demand	Anodyne	GRIN2B	18	40
O[C@@H](CNc1ccc(N2CCCCC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819394835	GJ	On-Demand	Anodyne	ADRB2	29	40
O[C@@H](CNc1ccc(N2CCCCC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819394835	GJ	On-Demand	Anodyne	ADRB1	38	40
O[C@@H](CNc1ccc(N2CCCCC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819394835	GJ	On-Demand	Anodyne	GRIN1	28	41
O[C@@H](CNc1ccc(N2CCCCC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819394835	GJ	On-Demand	Anodyne	ADRB3	27	40
O[C@H](CNc1ccc(N2CCCCC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819394836	GJ	On-Demand	Anodyne	ADRB2	29	40
O[C@H](CNc1ccc(N2CCCCC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819394836	GJ	On-Demand	Anodyne	ADRB1	38	40
O[C@H](CNc1ccc(N2CCCCC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819394836	GJ	On-Demand	Anodyne	GRIN1	28	41
O[C@H](CNc1ccc(N2CCCCC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819394836	GJ	On-Demand	Anodyne	ADRB3	27	40
CCOC(=O)CC[C@@H](O)CNc1ccc(N2CCN(CC)CC2)cc1	ZINC000819394842	ED	On-Demand	Anodyne	PRNP	41	43
CCOC(=O)CC[C@H](O)CNc1ccc(N2CCN(CC)CC2)cc1	ZINC000819394847	ED	On-Demand	Anodyne	PRNP	41	43
COCCc1ccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819394862	GI	On-Demand	Anodyne	ADRB2	44	58
COCCc1ccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819394862	GI	On-Demand	Anodyne	ADRB1	71	58
COCCc1ccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819394862	GI	On-Demand	Anodyne	ADRB3	50	41
COCCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819394863	GI	On-Demand	Anodyne	ADRB2	44	58
COCCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819394863	GI	On-Demand	Anodyne	ADRB1	71	58
COCCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819394863	GI	On-Demand	Anodyne	ADRB3	50	41
C#CCNC(=O)CCNc1ccc(OC)cc1OC	ZINC000819394865	CD	On-Demand	Mild	CYP1B1	15	45
C#CCNC(=O)CCNc1ccc(OC)cc1OC	ZINC000819394865	CD	On-Demand	Mild	NQO2	41	43
C#CCNC(=O)CCNc1ccc(OC)cc1OC	ZINC000819394865	CD	On-Demand	Mild	MTNR1A	94	41
C#CCNC(=O)CCNc1ccc(OC)cc1OC	ZINC000819394865	CD	On-Demand	Mild	MTNR1B	84	43
O=[N+]([O-])c1ccc([C@@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819394866	FI	On-Demand	Bother	SSTR1	34	40
O=[N+]([O-])c1ccc([C@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819394867	FI	On-Demand	Bother	SSTR1	34	40
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H]1CCCc1ccccc1	ZINC000819394879	DH	On-Demand	Anodyne	ACE	23	41
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H]1CCCc1ccccc1	ZINC000819394879	DH	On-Demand	Anodyne	FKBP1A	47	39
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H]1CCCc1ccccc1	ZINC000819394879	DH	On-Demand	Anodyne	SLC18A2	44	44
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H]1CCCc1ccccc1	ZINC000819394879	DH	On-Demand	Anodyne	PREP	75	41
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H]1CCCc1ccccc1	ZINC000819394881	DH	On-Demand	Anodyne	ACE	23	41
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H]1CCCc1ccccc1	ZINC000819394881	DH	On-Demand	Anodyne	FKBP1A	47	39
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H]1CCCc1ccccc1	ZINC000819394881	DH	On-Demand	Anodyne	SLC18A2	44	44
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H]1CCCc1ccccc1	ZINC000819394881	DH	On-Demand	Anodyne	PREP	75	41
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H]1CCCc1ccccc1	ZINC000819394883	DH	On-Demand	Anodyne	ACE	23	41
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H]1CCCc1ccccc1	ZINC000819394883	DH	On-Demand	Anodyne	FKBP1A	47	39
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H]1CCCc1ccccc1	ZINC000819394883	DH	On-Demand	Anodyne	SLC18A2	44	44
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H]1CCCc1ccccc1	ZINC000819394883	DH	On-Demand	Anodyne	PREP	75	41
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H]1CCCc1ccccc1	ZINC000819394884	DH	On-Demand	Anodyne	ACE	23	41
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H]1CCCc1ccccc1	ZINC000819394884	DH	On-Demand	Anodyne	FKBP1A	47	39
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H]1CCCc1ccccc1	ZINC000819394884	DH	On-Demand	Anodyne	SLC18A2	44	44
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H]1CCCc1ccccc1	ZINC000819394884	DH	On-Demand	Anodyne	PREP	75	41
CC(=O)N1CCc2cc(NC[C@H](O)c3ccccc3C)ccc21	ZINC000819394885	DG	On-Demand	Anodyne	HSD17B3	49	43
CC(=O)N1CCc2cc(NC[C@@H](O)c3ccccc3C)ccc21	ZINC000819394886	DG	On-Demand	Anodyne	HSD17B3	49	43
CON(C)C(=O)CCNc1ccc2c(c1)CCN2C(C)=O	ZINC000819394897	CD	On-Demand	Anodyne	HSD17B3	44	32
CC(=O)N1CCc2cc(NC[C@H](O)c3ccc(C)cc3)ccc21	ZINC000819394906	DG	On-Demand	Anodyne	HSD17B3	48	40
CC(=O)N1CCc2cc(NC[C@@H](O)c3ccc(C)cc3)ccc21	ZINC000819394907	DG	On-Demand	Anodyne	HSD17B3	48	40
C#Cc1cccc(NC(=O)c2cccc(CN3C(=O)c4ccccc4C3=O)c2)c1	ZINC000819394911	GH	On-Demand	Mild	KCNK3	102	39
C#Cc1cccc(NC(=O)c2cccc(CN3C(=O)c4ccccc4C3=O)c2)c1	ZINC000819394911	GH	On-Demand	Mild	KCNK9	54	38
CC1CCN(c2ccc(NC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819394919	DG	On-Demand	Anodyne	ADRB3	85	56
CC1CCN(c2ccc(NC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819394921	DG	On-Demand	Anodyne	ADRB3	85	56
CC(=O)N1CCc2cc(NC[C@H](O)c3cccnc3)ccc21	ZINC000819394928	CE	On-Demand	Anodyne	ADRB2	21	41
CC(=O)N1CCc2cc(NC[C@H](O)c3cccnc3)ccc21	ZINC000819394928	CE	On-Demand	Anodyne	ADRB1	23	41
CC(=O)N1CCc2cc(NC[C@H](O)c3cccnc3)ccc21	ZINC000819394928	CE	On-Demand	Anodyne	HTR2C	15	44
CC(=O)N1CCc2cc(NC[C@H](O)c3cccnc3)ccc21	ZINC000819394928	CE	On-Demand	Anodyne	ADRB3	86	44
CC(=O)N1CCc2cc(NC[C@H](O)c3cccnc3)ccc21	ZINC000819394928	CE	On-Demand	Anodyne	CYP11B2	21	56
CC(=O)N1CCc2cc(NC[C@@H](O)c3cccnc3)ccc21	ZINC000819394930	CE	On-Demand	Anodyne	ADRB2	21	41
CC(=O)N1CCc2cc(NC[C@@H](O)c3cccnc3)ccc21	ZINC000819394930	CE	On-Demand	Anodyne	ADRB1	23	41
CC(=O)N1CCc2cc(NC[C@@H](O)c3cccnc3)ccc21	ZINC000819394930	CE	On-Demand	Anodyne	HTR2C	15	44
CC(=O)N1CCc2cc(NC[C@@H](O)c3cccnc3)ccc21	ZINC000819394930	CE	On-Demand	Anodyne	ADRB3	86	44
CC(=O)N1CCc2cc(NC[C@@H](O)c3cccnc3)ccc21	ZINC000819394930	CE	On-Demand	Anodyne	CYP11B2	21	56
CCOC[C@H](O)CNc1ccc(N2CCN(CC)CC2)cc1	ZINC000819394942	DD	On-Demand	Anodyne	PRNP	30	42
CC1CCN(c2ccc(NCCS(=O)(=O)CC(=O)OC(C)(C)C)cc2)CC1	ZINC000819394943	GG	On-Demand	Anodyne	GPR119	25	44
CC1CCN(c2ccc(NC[C@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819394945	EI	On-Demand	Anodyne	CYP3A4	45	36
CC1CCN(c2ccc(NC[C@@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819394948	EI	On-Demand	Anodyne	CYP3A4	45	36
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	ACE	56	37
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	OPRM1	52	38
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	OPRD1	46	39
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	MME	69	40
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	PGC	43	32
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	CMA1	60	36
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	CTRA_BOVIN	63	35
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	PAPA1_CARPA	44	35
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	TRY1_BOVIN	43	32
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	CYSP_TRYCR	56	38
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	CTSL	42	36
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	TIMP3	79	36
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	CAPNS1	69	36
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	HLA-DRB1	41	35
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	REN	87	37
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	REN1	43	33
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	CAPN1	69	39
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	CTRC	42	36
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	CAPN2	56	35
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	ACE2	81	34
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	CTRB_BOVIN	47	32
C[C@H](CC(=O)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1)n1cccn1	ZINC000819394950	FG	On-Demand	Anodyne	BRCA1	60	32
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(N3CCCCCC3)cc2)c1	ZINC000819394958	FI	On-Demand	Bother	IGF1R	15	40
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(N3CCCCCC3)cc2)c1	ZINC000819394959	FI	On-Demand	Bother	IGF1R	15	40
CC1CCN(c2ccc(NCCC(=O)Nc3cccnc3)cc2)CC1	ZINC000819394968	EH	On-Demand	Anodyne	CHRNA7	37	40
CC1CCN(c2ccc(NCCC(=O)Nc3cccnc3)cc2)CC1	ZINC000819394968	EH	On-Demand	Anodyne	PRNP	36	41
CC1CCN(c2ccc(NCCC(=O)Nc3cccnc3)cc2)CC1	ZINC000819394968	EH	On-Demand	Anodyne	STAT6	58	31
CC1CCN(c2ccc(NCCC(=O)Nc3cccnc3)cc2)CC1	ZINC000819394968	EH	On-Demand	Anodyne	NAMPT	40	41
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819394972	GH	On-Demand	Anodyne	ADRB2	43	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819394972	GH	On-Demand	Anodyne	ADRB1	76	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819394972	GH	On-Demand	Anodyne	ADRB3	55	47
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819394976	GH	On-Demand	Anodyne	ADRB2	43	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819394976	GH	On-Demand	Anodyne	ADRB1	76	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819394976	GH	On-Demand	Anodyne	ADRB3	55	47
CC(=O)N1CCc2cc(NC[C@@H](O)c3ccc(OC(F)(F)F)cc3)ccc21	ZINC000819394988	GH	On-Demand	Anodyne	P2RY1	45	36
CC(=O)N1CCc2cc(NC[C@@H](O)c3ccc(OC(F)(F)F)cc3)ccc21	ZINC000819394988	GH	On-Demand	Anodyne	EPHX2	42	36
CC(=O)N1CCc2cc(NC[C@H](O)c3ccc(OC(F)(F)F)cc3)ccc21	ZINC000819394989	GH	On-Demand	Anodyne	P2RY1	45	36
CC(=O)N1CCc2cc(NC[C@H](O)c3ccc(OC(F)(F)F)cc3)ccc21	ZINC000819394989	GH	On-Demand	Anodyne	EPHX2	42	36
CC(=O)N1CCc2cc(NC[C@H](O)c3ccccc3Cl)ccc21	ZINC000819394998	EG	On-Demand	Anodyne	AVPR2	24	42
CC(=O)N1CCc2cc(NC[C@H](O)c3ccccc3Cl)ccc21	ZINC000819394998	EG	On-Demand	Anodyne	HSD17B3	55	42
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(N2CCCCCC2)cc1	ZINC000819394999	GH	On-Demand	Bother	ADRB1	48	32
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(N2CCCCCC2)cc1	ZINC000819395000	GH	On-Demand	Bother	ADRB1	48	32
CC[C@H](O)CNc1ccc(N2CCN(CC)CC2)cc1	ZINC000819395006	CE	On-Demand	Anodyne	PRNP	43	46
C#CCNC(=O)CCNc1ccc(OCC)c(OC)c1	ZINC000819395027	CD	On-Demand	Mild	ENPP1	69	35
C#CCNC(=O)CCNc1ccc(OCC)c(OC)c1	ZINC000819395027	CD	On-Demand	Mild	DRTS_TRYCR	48	35
CC1CCN(c2ccc(NC[C@H](O)COc3ccc(C#N)cc3)cc2)CC1	ZINC000819395041	FH	On-Demand	Mild	ADRB1	40	39
CC1CCN(c2ccc(NC[C@H](O)COc3ccc(C#N)cc3)cc2)CC1	ZINC000819395041	FH	On-Demand	Mild	ADRB3	24	41
CC1CCN(c2ccc(NC[C@@H](O)COc3ccc(C#N)cc3)cc2)CC1	ZINC000819395044	FH	On-Demand	Mild	ADRB1	40	39
CC1CCN(c2ccc(NC[C@@H](O)COc3ccc(C#N)cc3)cc2)CC1	ZINC000819395044	FH	On-Demand	Mild	ADRB3	24	41
O[C@@H](CNc1ccc(N2CCCCCC2)cc1)c1cccnc1	ZINC000819395047	DH	On-Demand	Anodyne	ADRB2	24	41
O[C@@H](CNc1ccc(N2CCCCCC2)cc1)c1cccnc1	ZINC000819395047	DH	On-Demand	Anodyne	ADRB3	92	50
O[C@H](CNc1ccc(N2CCCCCC2)cc1)c1cccnc1	ZINC000819395049	DH	On-Demand	Anodyne	ADRB2	24	41
O[C@H](CNc1ccc(N2CCCCCC2)cc1)c1cccnc1	ZINC000819395049	DH	On-Demand	Anodyne	ADRB3	92	50
OC1(CNc2ccc(N3CCCCCC3)cc2)CCOCC1	ZINC000819395071	DG	On-Demand	Anodyne	STAT6	51	32
CC(=O)N1CCc2cc(NC[C@@H](O)c3cc(F)ccc3F)ccc21	ZINC000819395083	EG	On-Demand	Anodyne	EIF2AK3	34	41
CC(=O)N1CCc2cc(NC[C@H](O)c3cc(F)ccc3F)ccc21	ZINC000819395084	EG	On-Demand	Anodyne	EIF2AK3	34	41
CC1CCN(c2ccc(NC[C@](C)(O)CNC(=O)OC(C)(C)C)cc2)CC1	ZINC000819395097	GH	On-Demand	Anodyne	GPR119	20	46
CC1CCN(c2ccc(NC[C@@](C)(O)CNC(=O)OC(C)(C)C)cc2)CC1	ZINC000819395099	GH	On-Demand	Anodyne	GPR119	20	46
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819395112	GH	On-Demand	Anodyne	ADRB2	26	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819395112	GH	On-Demand	Anodyne	ADRB1	47	38
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819395112	GH	On-Demand	Anodyne	ADRB3	35	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819395112	GH	On-Demand	Anodyne	ABCB1	29	48
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819395114	GH	On-Demand	Anodyne	ADRB2	26	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819395114	GH	On-Demand	Anodyne	ADRB1	47	38
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819395114	GH	On-Demand	Anodyne	ADRB3	35	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCC(C)CC3)cc2)c1	ZINC000819395114	GH	On-Demand	Anodyne	ABCB1	29	48
CC[C@H](O)CNc1ccc(N2CCCCCC2)cc1	ZINC000819395115	CG	On-Demand	Anodyne	KCNQ2	25	47
CC1CCN(c2ccc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cc2)CC1	ZINC000819395140	FH	On-Demand	Bother	CYP3A4	45	35
CC1CCN(c2ccc(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2)CC1	ZINC000819395142	FH	On-Demand	Bother	CYP3A4	45	35
C#Cc1cccc(NC(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)c1	ZINC000819395143	DD	On-Demand	Mild	TAAR1	50	41
C#Cc1cccc(NC(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)c1	ZINC000819395143	DD	On-Demand	Mild	NR2E3	45	35
C#Cc1cccc(NC(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)c1	ZINC000819395143	DD	On-Demand	Mild	KCNK3	107	43
C#Cc1cccc(NC(=O)c2ccc3[nH]c(=O)c(=O)[nH]c3c2)c1	ZINC000819395143	DD	On-Demand	Mild	KCNK9	55	41
CCOC(=O)C1CCC(O)(CNc2ccc(OCC)c(OC)c2)CC1	ZINC000819395187	FF	On-Demand	Anodyne	ENPP1	51	34
CCOC(=O)C1CCC(O)(CNc2ccc(OCC)c(OC)c2)CC1	ZINC000819395187	FF	On-Demand	Anodyne	DRTS_TRYCR	45	34
Cc1nc2cc(NC[C@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)ccc2o1	ZINC000819395217	GH	On-Demand	Anodyne	GPR119	49	41
Cc1nc2cc(NC[C@@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)ccc2o1	ZINC000819395220	GH	On-Demand	Anodyne	GPR119	49	41
C#Cc1cccc(NC(=O)c2ccc(-n3nc(SCc4ccccc4)sc3=S)cc2)c1	ZINC000819395232	JK	On-Demand	Mild	KCNK3	72	36
CC(=O)N1CCc2cc(NCCS(C)(=O)=O)ccc21	ZINC000819395255	CD	On-Demand	Anodyne	HSD17B3	49	42
CC(=O)N1CCc2cc(NCCS(C)(=O)=O)ccc21	ZINC000819395255	CD	On-Demand	Anodyne	EIF2AK3	45	34
COc1cc(NC[C@H](O)c2ccc(Br)cc2)cc(OC)c1	ZINC000819395290	FH	On-Demand	Anodyne	ADRB2	15	50
COc1cc(NC[C@@H](O)c2ccc(Br)cc2)cc(OC)c1	ZINC000819395292	FH	On-Demand	Anodyne	ADRB2	15	50
C=CCCn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)OC2CCCC2)nn1	ZINC000819395295	GF	On-Demand	Mild	P2RY12	40	38
C=CCCn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)OC2CCCC2)nn1	ZINC000819395295	GF	On-Demand	Mild	PGC	42	33
C=CCCn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)OC2CCCC2)nn1	ZINC000819395295	GF	On-Demand	Mild	TIMP3	43	32
C=CCCn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)OC2CCCC2)nn1	ZINC000819395295	GF	On-Demand	Mild	CAPNS1	46	30
C=CCCn1cc(C(=O)N[C@@H](Cc2ccccc2)C(=O)OC2CCCC2)nn1	ZINC000819395295	GF	On-Demand	Mild	REN	61	35
CC1CCN(c2ccc(NC[C@@H](O)COc3ccc(CC#N)cc3)cc2)CC1	ZINC000819395301	GH	On-Demand	Mild	ADRB1	57	42
CC1CCN(c2ccc(NC[C@@H](O)COc3ccc(CC#N)cc3)cc2)CC1	ZINC000819395301	GH	On-Demand	Mild	ADRB3	42	45
CC1CCN(c2ccc(NC[C@H](O)COc3ccc(CC#N)cc3)cc2)CC1	ZINC000819395304	GH	On-Demand	Mild	ADRB1	57	42
CC1CCN(c2ccc(NC[C@H](O)COc3ccc(CC#N)cc3)cc2)CC1	ZINC000819395304	GH	On-Demand	Mild	ADRB3	42	45
COc1cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1	ZINC000819395330	DF	On-Demand	Bother	CACNA1C	48	36
COc1cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1	ZINC000819395330	DF	On-Demand	Bother	CACNA1D	74	36
COc1cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1	ZINC000819395332	DF	On-Demand	Bother	CACNA1C	48	36
COc1cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1	ZINC000819395332	DF	On-Demand	Bother	CACNA1D	74	36
CC1CCN(c2ccc(NCCC(=O)NC(N)=O)cc2)CC1	ZINC000819395337	DD	On-Demand	Anodyne	STAT6	46	30
O=[N+]([O-])c1ccc([C@@H](O)CNc2cccc(Oc3ccccc3)c2)cc1	ZINC000819395346	FJ	On-Demand	Bother	ADRB3	19	43
O=[N+]([O-])c1ccc([C@H](O)CNc2cccc(Oc3ccccc3)c2)cc1	ZINC000819395347	FJ	On-Demand	Bother	ADRB3	19	43
C#Cc1cccc(NC(=O)CCNC(=O)NC23CC4CC(CC(C4)C2)C3)c1	ZINC000819395352	FG	On-Demand	Mild	EPHX2	119	52
COc1cc(NC[C@H](O)c2cccc(Cl)c2)cc(OC)c1	ZINC000819395353	DH	On-Demand	Anodyne	ADRB2	25	48
COc1cc(NC[C@H](O)c2cccc(Cl)c2)cc(OC)c1	ZINC000819395353	DH	On-Demand	Anodyne	ADRB1	36	48
COc1cc(NC[C@H](O)c2cccc(Cl)c2)cc(OC)c1	ZINC000819395353	DH	On-Demand	Anodyne	ADRB3	59	48
COc1cc(NC[C@H](O)c2cccc(Cl)c2)cc(OC)c1	ZINC000819395353	DH	On-Demand	Anodyne	CYP3A4	42	35
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)cc(OC)c1	ZINC000819395354	DH	On-Demand	Anodyne	ADRB2	25	48
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)cc(OC)c1	ZINC000819395354	DH	On-Demand	Anodyne	ADRB1	36	48
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)cc(OC)c1	ZINC000819395354	DH	On-Demand	Anodyne	ADRB3	59	48
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)cc(OC)c1	ZINC000819395354	DH	On-Demand	Anodyne	CYP3A4	42	35
O[C@@H](CNc1ccc(N2CCCCCC2)cc1)c1ccc(F)cn1	ZINC000819395357	EH	On-Demand	Anodyne	STAT6	46	31
O[C@H](CNc1ccc(N2CCCCCC2)cc1)c1ccc(F)cn1	ZINC000819395359	EH	On-Demand	Anodyne	STAT6	46	31
COc1cc(NCCC(=O)Nc2ccc(N(C)C)cc2)cc(OC)c1	ZINC000819395364	EG	On-Demand	Anodyne	MTNR1A	19	52
COc1cc(NCCC(=O)Nc2ccc(N(C)C)cc2)cc(OC)c1	ZINC000819395364	EG	On-Demand	Anodyne	MTNR1B	26	52
O[C@@H](CNc1ccc(N2CCCCCC2)cc1)c1ccccc1	ZINC000819395372	DI	On-Demand	Anodyne	KCNQ2	32	51
O[C@H](CNc1ccc(N2CCCCCC2)cc1)c1ccccc1	ZINC000819395374	DI	On-Demand	Anodyne	KCNQ2	32	51
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2cccc(C)c2)c1	ZINC000819395379	ED	On-Demand	Anodyne	MTNR1A	26	40
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2cccc(C)c2)c1	ZINC000819395379	ED	On-Demand	Anodyne	MTNR1B	28	40
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2cccc(C)c2)c1	ZINC000819395382	ED	On-Demand	Anodyne	MTNR1A	26	40
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2cccc(C)c2)c1	ZINC000819395382	ED	On-Demand	Anodyne	MTNR1B	28	40
C=C(C)C(C)(C)C(=O)NNc1ccc(OC)cc1[N+](=O)[O-]	ZINC000819395389	CF	On-Demand	Reactive	TAAR1	19	41
C=C(C)C(C)(C)C(=O)NNc1ccc(OC)cc1[N+](=O)[O-]	ZINC000819395389	CF	On-Demand	Reactive	AKR1C2	27	48
N#CCc1ccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819395390	GH	On-Demand	Mild	ADRB1	60	39
N#CCc1ccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819395390	GH	On-Demand	Mild	ADRB3	42	42
N#CCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819395391	GH	On-Demand	Mild	ADRB1	60	39
N#CCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819395391	GH	On-Demand	Mild	ADRB3	42	42
CC1CCN(c2ccc(NC[C@H](O)c3ccc(S(C)(=O)=O)cc3)cc2)CC1	ZINC000819395392	GG	On-Demand	Anodyne	ADRB3	17	42
CC1CCN(c2ccc(NC[C@H](O)c3ccc(S(C)(=O)=O)cc3)cc2)CC1	ZINC000819395392	GG	On-Demand	Anodyne	GPR119	24	46
CC1CCN(c2ccc(NC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)cc2)CC1	ZINC000819395393	GG	On-Demand	Anodyne	ADRB3	17	42
CC1CCN(c2ccc(NC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)cc2)CC1	ZINC000819395393	GG	On-Demand	Anodyne	GPR119	24	46
C#Cc1cccc(NC(=O)c2ccccc2CSc2nc3ccccc3[nH]2)c1	ZINC000819395397	GK	On-Demand	Mild	NR2E3	75	42
C#Cc1cccc(NC(=O)c2ccccc2CSc2nc3ccccc3[nH]2)c1	ZINC000819395397	GK	On-Demand	Mild	KCNK3	42	34
CCOc1ccc(OC[C@@H](O)CNc2ccc(N3CCN(CC)CC3)cc2)cc1	ZINC000819395426	GG	On-Demand	Anodyne	ADRB1	44	39
CCOc1ccc(OC[C@@H](O)CNc2ccc(N3CCN(CC)CC3)cc2)cc1	ZINC000819395426	GG	On-Demand	Anodyne	ABCB1	22	42
CCOc1ccc(OC[C@H](O)CNc2ccc(N3CCN(CC)CC3)cc2)cc1	ZINC000819395427	GG	On-Demand	Anodyne	ADRB1	44	39
CCOc1ccc(OC[C@H](O)CNc2ccc(N3CCN(CC)CC3)cc2)cc1	ZINC000819395427	GG	On-Demand	Anodyne	ABCB1	22	42
O[C@@H](CNc1cccc(Oc2ccccc2)c1)C1CC1	ZINC000819395461	CH	On-Demand	Anodyne	F13A1	15	42
O[C@H](CNc1cccc(Oc2ccccc2)c1)C1CC1	ZINC000819395462	CH	On-Demand	Anodyne	F13A1	15	42
COC[C@@H](O)CNc1ccc(Nc2ccccc2)cc1	ZINC000819395476	CF	On-Demand	Clean	ADRB2	32	41
COC[C@@H](O)CNc1ccc(Nc2ccccc2)cc1	ZINC000819395476	CF	On-Demand	Clean	ADRB1	28	47
CCOC[C@H](O)CNc1ccc(Nc2ccccc2)cc1	ZINC000819395485	CG	On-Demand	Clean	ADRB2	26	40
CCOC[C@H](O)CNc1ccc(Nc2ccccc2)cc1	ZINC000819395485	CG	On-Demand	Clean	ADRB1	21	45
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc(Nc2ccccc2)cc1	ZINC000819395499	FI	On-Demand	Clean	CTSK	19	40
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc(Nc2ccccc2)cc1	ZINC000819395499	FI	On-Demand	Clean	FPR1	43	35
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc(Nc2ccccc2)cc1	ZINC000819395502	FI	On-Demand	Clean	CTSK	19	40
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc(Nc2ccccc2)cc1	ZINC000819395502	FI	On-Demand	Clean	FPR1	43	35
CC(=O)N1CCc2cc(NC[C@@H](O)c3cc4ccccc4o3)ccc21	ZINC000819395514	EG	On-Demand	Anodyne	HSD17B3	45	31
CC(=O)N1CCc2cc(NC[C@@H](O)c3ccccc3Br)ccc21	ZINC000819395535	GH	On-Demand	Anodyne	HSD17B3	47	34
CC(=O)N1CCc2cc(NC[C@H](O)c3ccccc3Br)ccc21	ZINC000819395536	GH	On-Demand	Anodyne	HSD17B3	47	34
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2cccc(C)c2)c1	ZINC000819395577	EE	On-Demand	Anodyne	ADRB2	52	39
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2cccc(C)c2)c1	ZINC000819395577	EE	On-Demand	Anodyne	KCNK3	71	42
CC(=O)Nc1cccc(CC(=O)NC[C@@H](O)c2cccc(C)c2)c1	ZINC000819395577	EE	On-Demand	Anodyne	KCNK9	55	42
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2cccc(C)c2)c1	ZINC000819395578	EE	On-Demand	Anodyne	ADRB2	52	39
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2cccc(C)c2)c1	ZINC000819395578	EE	On-Demand	Anodyne	KCNK3	71	42
CC(=O)Nc1cccc(CC(=O)NC[C@H](O)c2cccc(C)c2)c1	ZINC000819395578	EE	On-Demand	Anodyne	KCNK9	55	42
O[C@@H](CNc1ccc2nc(N3CCOCC3)sc2c1)c1cccc(Cl)c1	ZINC000819395581	GH	On-Demand	Anodyne	IGF1R	30	46
O[C@@H](CNc1ccc2nc(N3CCOCC3)sc2c1)c1cccc(Cl)c1	ZINC000819395581	GH	On-Demand	Anodyne	CASR	22	43
O[C@@H](CNc1ccc2nc(N3CCOCC3)sc2c1)c1cccc(Cl)c1	ZINC000819395581	GH	On-Demand	Anodyne	CYP3A4	52	41
O[C@H](CNc1ccc2nc(N3CCOCC3)sc2c1)c1cccc(Cl)c1	ZINC000819395582	GH	On-Demand	Anodyne	IGF1R	30	46
O[C@H](CNc1ccc2nc(N3CCOCC3)sc2c1)c1cccc(Cl)c1	ZINC000819395582	GH	On-Demand	Anodyne	CASR	22	43
O[C@H](CNc1ccc2nc(N3CCOCC3)sc2c1)c1cccc(Cl)c1	ZINC000819395582	GH	On-Demand	Anodyne	CYP3A4	52	41
CC(=O)N1CCc2cc(NC[C@@H](O)c3ccccc3C(F)(F)F)ccc21	ZINC000819395597	FH	On-Demand	Anodyne	HSD17B3	44	30
CC(=O)N1CCc2cc(NC[C@H](O)c3ccccc3C(F)(F)F)ccc21	ZINC000819395598	FH	On-Demand	Anodyne	HSD17B3	44	30
CC(C)(O)CNc1ccc(Nc2ccccc2)cc1	ZINC000819395616	CH	On-Demand	Clean	AKR1C3	18	41
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819395624	GI	On-Demand	Anodyne	ADRB2	45	45
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819395624	GI	On-Demand	Anodyne	ADRB1	75	48
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819395624	GI	On-Demand	Anodyne	ADRB3	55	45
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819395624	GI	On-Demand	Anodyne	ABCB1	50	44
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819395625	GI	On-Demand	Anodyne	ADRB2	45	45
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819395625	GI	On-Demand	Anodyne	ADRB1	75	48
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819395625	GI	On-Demand	Anodyne	ADRB3	55	45
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)cc1	ZINC000819395625	GI	On-Demand	Anodyne	ABCB1	50	44
COc1cc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc(OC)c1	ZINC000819395641	GG	On-Demand	Anodyne	GPR119	50	48
COc1cc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc(OC)c1	ZINC000819395642	GG	On-Demand	Anodyne	GPR119	50	48
O[C@H](CNc1ccc(N2CCCCCC2)cc1)COCc1ccccc1	ZINC000819395701	FI	On-Demand	Anodyne	CTSL	16	51
O[C@@H](CNc1ccc(N2CCCCCC2)cc1)COCc1ccccc1	ZINC000819395702	FI	On-Demand	Anodyne	CTSL	16	51
O=C(/C=C/[C@@H]1CCCO1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000819395711	DD	On-Demand	Anodyne	SLC18A3	31	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000819395712	DD	On-Demand	Anodyne	SLC18A3	31	41
O=C(/C=C/[C@@H]1CCCO1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000819395713	DD	On-Demand	Anodyne	SLC18A3	31	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000819395714	DD	On-Demand	Anodyne	SLC18A3	31	41
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395720	EG	On-Demand	Anodyne	ESR1	81	37
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395720	EG	On-Demand	Anodyne	HTR2A	19	40
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395720	EG	On-Demand	Anodyne	ESR2	58	42
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395720	EG	On-Demand	Anodyne	LTA4H	62	43
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395720	EG	On-Demand	Anodyne	HRH3	63	48
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395720	EG	On-Demand	Anodyne	EPHX2	24	48
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395720	EG	On-Demand	Anodyne	PSMB2	47	47
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395720	EG	On-Demand	Anodyne	PSMB1	51	47
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395721	EG	On-Demand	Anodyne	ESR1	81	37
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395721	EG	On-Demand	Anodyne	HTR2A	19	40
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395721	EG	On-Demand	Anodyne	ESR2	58	42
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395721	EG	On-Demand	Anodyne	LTA4H	62	43
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395721	EG	On-Demand	Anodyne	HRH3	63	48
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395721	EG	On-Demand	Anodyne	EPHX2	24	48
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395721	EG	On-Demand	Anodyne	PSMB2	47	47
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395721	EG	On-Demand	Anodyne	PSMB1	51	47
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395722	EG	On-Demand	Anodyne	ESR1	81	37
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395722	EG	On-Demand	Anodyne	HTR2A	19	40
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395722	EG	On-Demand	Anodyne	ESR2	58	42
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395722	EG	On-Demand	Anodyne	LTA4H	62	43
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395722	EG	On-Demand	Anodyne	HRH3	63	48
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395722	EG	On-Demand	Anodyne	EPHX2	24	48
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395722	EG	On-Demand	Anodyne	PSMB2	47	47
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395722	EG	On-Demand	Anodyne	PSMB1	51	47
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395723	EG	On-Demand	Anodyne	ESR1	81	37
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395723	EG	On-Demand	Anodyne	HTR2A	19	40
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395723	EG	On-Demand	Anodyne	ESR2	58	42
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395723	EG	On-Demand	Anodyne	LTA4H	62	43
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395723	EG	On-Demand	Anodyne	HRH3	63	48
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395723	EG	On-Demand	Anodyne	EPHX2	24	48
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395723	EG	On-Demand	Anodyne	PSMB2	47	47
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819395723	EG	On-Demand	Anodyne	PSMB1	51	47
O[C@@H](CNc1ccc2nc(N3CCOCC3)sc2c1)c1cccnc1	ZINC000819395729	FF	On-Demand	Anodyne	ADRB3	77	38
O[C@H](CNc1ccc2nc(N3CCOCC3)sc2c1)c1cccnc1	ZINC000819395730	FF	On-Demand	Anodyne	ADRB3	77	38
O[C@@H](CNc1ccc(N2CCCCCC2)cc1)c1cccc(F)c1	ZINC000819395738	EI	On-Demand	Anodyne	KCNQ2	20	40
O[C@H](CNc1ccc(N2CCCCCC2)cc1)c1cccc(F)c1	ZINC000819395739	EI	On-Demand	Anodyne	KCNQ2	20	40
CC1CCN(c2ccc(NC[C@H](O)c3ccc([N+](=O)[O-])cc3)cc2)CC1	ZINC000819395742	FH	On-Demand	Bother	SSTR1	35	42
CC1CCN(c2ccc(NC[C@@H](O)c3ccc([N+](=O)[O-])cc3)cc2)CC1	ZINC000819395743	FH	On-Demand	Bother	SSTR1	35	42
CC1CCN(c2ccc(NCCC(=O)Nc3ccccc3[N+](=O)[O-])cc2)CC1	ZINC000819395749	GI	On-Demand	Bother	SERPINE1	28	41
CC(=O)N1CCc2cc(NC[C@H](O)c3ccc(F)cn3)ccc21	ZINC000819395752	DE	On-Demand	Anodyne	EIF2AK3	45	38
CC(=O)N1CCc2cc(NC[C@@H](O)c3ccc(F)cn3)ccc21	ZINC000819395753	DE	On-Demand	Anodyne	EIF2AK3	45	38
C#Cc1cccc(NC(=O)CCSc2ccc(F)cc2)c1	ZINC000819395754	CH	On-Demand	Mild	FUCA1	15	40
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)C(F)=C1CCC1	ZINC000819395769	DE	On-Demand	Anodyne	SLC18A3	35	46
O=C(NC1CCN([C@H]2CCCC[C@@H]2O)CC1)C(F)=C1CCC1	ZINC000819395770	DE	On-Demand	Anodyne	SLC18A3	35	46
O=C(NC1CCN([C@@H]2CCCC[C@H]2O)CC1)C(F)=C1CCC1	ZINC000819395771	DE	On-Demand	Anodyne	SLC18A3	35	46
O=C(NC1CCN([C@H]2CCCC[C@H]2O)CC1)C(F)=C1CCC1	ZINC000819395772	DE	On-Demand	Anodyne	SLC18A3	35	46
CC(=O)N1CCc2cc(NC[C@@H](O)c3ccccc3)ccc21	ZINC000819395794	CF	On-Demand	Anodyne	ADRB3	29	40
CC(=O)N1CCc2cc(NC[C@@H](O)c3ccccc3)ccc21	ZINC000819395794	CF	On-Demand	Anodyne	NPY2R	51	34
CC(=O)N1CCc2cc(NC[C@@H](O)c3ccccc3)ccc21	ZINC000819395794	CF	On-Demand	Anodyne	HSD17B3	54	47
CC(=O)N1CCc2cc(NC[C@H](O)c3ccccc3)ccc21	ZINC000819395795	CF	On-Demand	Anodyne	ADRB3	29	40
CC(=O)N1CCc2cc(NC[C@H](O)c3ccccc3)ccc21	ZINC000819395795	CF	On-Demand	Anodyne	NPY2R	51	34
CC(=O)N1CCc2cc(NC[C@H](O)c3ccccc3)ccc21	ZINC000819395795	CF	On-Demand	Anodyne	HSD17B3	54	47
O[C@@H](CNc1ccc(N2CCCCCC2)cc1)CN1CCOCC1	ZINC000819395796	EE	On-Demand	Anodyne	STAT6	55	32
O[C@H](CNc1ccc(N2CCCCCC2)cc1)CN1CCOCC1	ZINC000819395797	EE	On-Demand	Anodyne	STAT6	55	32
CC1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819395798	EH	On-Demand	Anodyne	ADRB2	57	46
CC1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819395798	EH	On-Demand	Anodyne	ADRB1	77	43
CC1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819395798	EH	On-Demand	Anodyne	ADRB3	57	49
CC1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819395798	EH	On-Demand	Anodyne	ABCB1	22	40
CC1CCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819395799	EH	On-Demand	Anodyne	ADRB2	57	46
CC1CCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819395799	EH	On-Demand	Anodyne	ADRB1	77	43
CC1CCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819395799	EH	On-Demand	Anodyne	ADRB3	57	49
CC1CCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819395799	EH	On-Demand	Anodyne	ABCB1	22	40
CC(=O)N1CCc2cc(NC[C@H](O)c3c(F)cccc3F)ccc21	ZINC000819395800	EG	On-Demand	Anodyne	HSD17B3	49	41
COc1cc(NC[C@H](O)c2cccnc2)cc(OC)c1	ZINC000819395818	CE	On-Demand	Anodyne	ADRB2	30	41
COc1cc(NC[C@H](O)c2cccnc2)cc(OC)c1	ZINC000819395818	CE	On-Demand	Anodyne	ADRB1	28	44
COc1cc(NC[C@H](O)c2cccnc2)cc(OC)c1	ZINC000819395818	CE	On-Demand	Anodyne	ADRB3	95	44
COc1cc(NC[C@@H](O)c2cccnc2)cc(OC)c1	ZINC000819395819	CE	On-Demand	Anodyne	ADRB2	30	41
COc1cc(NC[C@@H](O)c2cccnc2)cc(OC)c1	ZINC000819395819	CE	On-Demand	Anodyne	ADRB1	28	44
COc1cc(NC[C@@H](O)c2cccnc2)cc(OC)c1	ZINC000819395819	CE	On-Demand	Anodyne	ADRB3	95	44
C#CCNC(=O)CCNc1ccc(N2CCN(CC)CC2)cc1	ZINC000819395820	DD	On-Demand	Mild	PRNP	37	45
CCOC(=O)CC[C@@H](O)CNc1ccc(Nc2ccccc2)cc1	ZINC000819395827	EH	On-Demand	Clean	LTA4H	18	42
CCOC(=O)CC[C@H](O)CNc1ccc(Nc2ccccc2)cc1	ZINC000819395828	EH	On-Demand	Clean	LTA4H	18	42
CCOC(=O)C1CCC(O)(CNc2ccc(Nc3ccccc3)cc2)CC1	ZINC000819395850	FI	On-Demand	Clean	TIMP3	71	33
O=C(/C=C\[C@H]1CCCO1)Nc1c[nH]nc1-c1ccccn1	ZINC000819395890	CE	On-Demand	Anodyne	TGFBR1	17	41
O=C(/C=C/[C@@H]1CCCO1)Nc1c[nH]nc1-c1ccccn1	ZINC000819395891	CE	On-Demand	Anodyne	TGFBR1	17	41
O=C(/C=C/[C@H]1CCCO1)Nc1c[nH]nc1-c1ccccn1	ZINC000819395892	CE	On-Demand	Anodyne	TGFBR1	17	41
O=C(/C=C\[C@@H]1CCCO1)Nc1c[nH]nc1-c1ccccn1	ZINC000819395893	CE	On-Demand	Anodyne	TGFBR1	17	41
CC(=O)N1CCc2cc(NC[C@@H](O)c3c(F)cccc3F)ccc21	ZINC000819395901	EG	On-Demand	Anodyne	HSD17B3	49	41
O=C(CCNc1ccc(N2CCCCCC2)cc1)Nc1ccccc1[N+](=O)[O-]	ZINC000819395902	GI	On-Demand	Bother	KCNQ2	52	39
CON(C)C(=O)CCNc1ccc2nc(N3CCOCC3)sc2c1	ZINC000819395915	FD	On-Demand	Anodyne	EPHB4	53	31
N#Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819395926	FH	On-Demand	Mild	ADRB1	47	39
N#Cc1ccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819395927	FH	On-Demand	Mild	ADRB1	47	39
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819395928	GI	On-Demand	Anodyne	ADRB2	38	47
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819395928	GI	On-Demand	Anodyne	ADRB1	65	47
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819395928	GI	On-Demand	Anodyne	ADRB3	44	39
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819395928	GI	On-Demand	Anodyne	ABCB1	26	47
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819395929	GI	On-Demand	Anodyne	ADRB2	38	47
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819395929	GI	On-Demand	Anodyne	ADRB1	65	47
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819395929	GI	On-Demand	Anodyne	ADRB3	44	39
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCCCCC3)cc2)cc1	ZINC000819395929	GI	On-Demand	Anodyne	ABCB1	26	47
CC(=O)N1CCc2cc(NC[C@@H](O)c3ccccc3F)ccc21	ZINC000819395943	DF	On-Demand	Anodyne	HSD17B3	50	42
CC(=O)N1CCc2cc(NC[C@H](O)c3ccccc3F)ccc21	ZINC000819395944	DF	On-Demand	Anodyne	HSD17B3	50	42
CC(=O)N1CCc2cc(NC[C@@H](O)c3ccc(C(F)(F)F)cc3)ccc21	ZINC000819395970	FH	On-Demand	Anodyne	HSD17B3	43	29
CC(=O)N1CCc2cc(NC[C@H](O)c3ccc(C(F)(F)F)cc3)ccc21	ZINC000819395971	FH	On-Demand	Anodyne	HSD17B3	43	29
O[C@@H](CNc1ccc2nc(N3CCOCC3)sc2c1)c1ccc(Cl)cc1	ZINC000819395985	GH	On-Demand	Anodyne	CASR	15	41
O[C@@H](CNc1ccc2nc(N3CCOCC3)sc2c1)c1ccc(Cl)cc1	ZINC000819395985	GH	On-Demand	Anodyne	PIK3CB	15	41
CCOC[C@H](O)CNc1ccc(OCC)c(OC)c1	ZINC000819396007	CD	On-Demand	Anodyne	ADRB2	19	41
CCOC(=O)C1CCC(O)(CNc2ccc(N3CCN(CC)CC3)cc2)CC1	ZINC000819396047	GF	On-Demand	Anodyne	PRNP	29	41
COc1cc(NC[C@H](O)c2ccc(C)cc2)cc(OC)c1	ZINC000819396050	CG	On-Demand	Anodyne	ADRB2	18	49
COc1cc(NC[C@@H](O)c2ccc(C)cc2)cc(OC)c1	ZINC000819396051	CG	On-Demand	Anodyne	ADRB2	18	49
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)c1	ZINC000819396068	FH	On-Demand	Anodyne	ADRB2	34	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)c1	ZINC000819396068	FH	On-Demand	Anodyne	ADRB1	51	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)c1	ZINC000819396068	FH	On-Demand	Anodyne	DRD4	45	37
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)c1	ZINC000819396068	FH	On-Demand	Anodyne	ACOX1	41	33
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)c1	ZINC000819396068	FH	On-Demand	Anodyne	PRNP	49	35
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)cc2)c1	ZINC000819396068	FH	On-Demand	Anodyne	ABCB1	39	50
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)c1	ZINC000819396069	FH	On-Demand	Anodyne	ADRB2	34	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)c1	ZINC000819396069	FH	On-Demand	Anodyne	ADRB1	51	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)c1	ZINC000819396069	FH	On-Demand	Anodyne	DRD4	45	37
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)c1	ZINC000819396069	FH	On-Demand	Anodyne	ACOX1	41	33
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)c1	ZINC000819396069	FH	On-Demand	Anodyne	PRNP	49	35
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCCC3)cc2)c1	ZINC000819396069	FH	On-Demand	Anodyne	ABCB1	39	50
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(Nc2ccccc2)cc1	ZINC000819396081	FI	On-Demand	Clean	FPR1	41	34
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(Nc2ccccc2)cc1	ZINC000819396082	FI	On-Demand	Clean	FPR1	41	34
CC1CCN(c2ccc(NCCC(N)=O)cc2)CC1	ZINC000819396106	CE	On-Demand	Anodyne	STAT6	65	32
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc(N2CCCCCC2)cc1	ZINC000819396123	GH	On-Demand	Anodyne	CTSK	15	46
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc(N2CCCCCC2)cc1	ZINC000819396124	GH	On-Demand	Anodyne	CTSK	15	46
COCCC(=O)N1CCC(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000819396130	FD	On-Demand	Anodyne	EPHX2	15	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819396133	GH	On-Demand	Anodyne	ADRB2	36	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819396133	GH	On-Demand	Anodyne	ADRB1	62	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819396133	GH	On-Demand	Anodyne	ADRB3	45	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819396133	GH	On-Demand	Anodyne	ABCB1	18	44
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819396134	GH	On-Demand	Anodyne	ADRB2	36	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819396134	GH	On-Demand	Anodyne	ADRB1	62	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819396134	GH	On-Demand	Anodyne	ADRB3	45	41
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCC(C)CC3)cc2)cc1	ZINC000819396134	GH	On-Demand	Anodyne	ABCB1	18	44
CC(=O)N1CCc2cc(NC[C@@H](O)c3cccc(Cl)c3)ccc21	ZINC000819396139	EG	On-Demand	Anodyne	ADRB1	29	46
CC(=O)N1CCc2cc(NC[C@@H](O)c3cccc(Cl)c3)ccc21	ZINC000819396139	EG	On-Demand	Anodyne	ADRB3	46	42
CC(=O)N1CCc2cc(NC[C@@H](O)c3cccc(Cl)c3)ccc21	ZINC000819396139	EG	On-Demand	Anodyne	HSD17B3	57	39
CC(=O)N1CCc2cc(NC[C@@H](O)c3cccc(Cl)c3)ccc21	ZINC000819396139	EG	On-Demand	Anodyne	CYP3A4	46	35
CC(=O)N1CCc2cc(NC[C@H](O)c3cccc(Cl)c3)ccc21	ZINC000819396140	EG	On-Demand	Anodyne	ADRB1	29	46
CC(=O)N1CCc2cc(NC[C@H](O)c3cccc(Cl)c3)ccc21	ZINC000819396140	EG	On-Demand	Anodyne	ADRB3	46	42
CC(=O)N1CCc2cc(NC[C@H](O)c3cccc(Cl)c3)ccc21	ZINC000819396140	EG	On-Demand	Anodyne	HSD17B3	57	39
CC(=O)N1CCc2cc(NC[C@H](O)c3cccc(Cl)c3)ccc21	ZINC000819396140	EG	On-Demand	Anodyne	CYP3A4	46	35
O=C(/C=C\[C@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396144	FF	On-Demand	Anodyne	CYSP_TRYCR	40	39
O=C(/C=C\[C@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396144	FF	On-Demand	Anodyne	TIMP3	65	34
O=C(/C=C\[C@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396144	FF	On-Demand	Anodyne	CAPNS1	55	31
O=C(/C=C\[C@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396144	FF	On-Demand	Anodyne	REN	56	35
O=C(/C=C\[C@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396144	FF	On-Demand	Anodyne	KLK5	40	42
O=C(/C=C\[C@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396144	FF	On-Demand	Anodyne	CTRB_BOVIN	44	30
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396145	FF	On-Demand	Anodyne	CYSP_TRYCR	40	39
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396145	FF	On-Demand	Anodyne	TIMP3	65	34
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396145	FF	On-Demand	Anodyne	CAPNS1	55	31
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396145	FF	On-Demand	Anodyne	REN	56	35
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396145	FF	On-Demand	Anodyne	KLK5	40	42
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396145	FF	On-Demand	Anodyne	CTRB_BOVIN	44	30
O=C(/C=C/[C@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396146	FF	On-Demand	Anodyne	CYSP_TRYCR	40	39
O=C(/C=C/[C@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396146	FF	On-Demand	Anodyne	TIMP3	65	34
O=C(/C=C/[C@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396146	FF	On-Demand	Anodyne	CAPNS1	55	31
O=C(/C=C/[C@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396146	FF	On-Demand	Anodyne	REN	56	35
O=C(/C=C/[C@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396146	FF	On-Demand	Anodyne	KLK5	40	42
O=C(/C=C/[C@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396146	FF	On-Demand	Anodyne	CTRB_BOVIN	44	30
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396147	FF	On-Demand	Anodyne	CYSP_TRYCR	40	39
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396147	FF	On-Demand	Anodyne	TIMP3	65	34
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396147	FF	On-Demand	Anodyne	CAPNS1	55	31
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396147	FF	On-Demand	Anodyne	REN	56	35
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396147	FF	On-Demand	Anodyne	KLK5	40	42
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)OC1CCCC1	ZINC000819396147	FF	On-Demand	Anodyne	CTRB_BOVIN	44	30
CC(=O)N1CCc2cc(NC[C@@H](O)c3cccc(Br)c3)ccc21	ZINC000819396157	GH	On-Demand	Anodyne	HSD17B3	45	36
CC(=O)N1CCc2cc(NC[C@H](O)c3cccc(Br)c3)ccc21	ZINC000819396158	GH	On-Demand	Anodyne	HSD17B3	45	36
NC(=O)NC(=O)CCNc1ccc(N2CCCCCC2)cc1	ZINC000819396167	DE	On-Demand	Anodyne	STAT6	60	31
CC(=O)N1CCc2cc(NC[C@@H](O)c3cccc(F)c3)ccc21	ZINC000819396175	DF	On-Demand	Anodyne	HSD17B3	43	29
CC(=O)N1CCc2cc(NC[C@H](O)c3cccc(F)c3)ccc21	ZINC000819396176	DF	On-Demand	Anodyne	HSD17B3	43	29
COC(=O)c1cncc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819396199	GE	On-Demand	Mild	PAPA1_CARPA	40	45
COC(=O)c1cncc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819396200	GE	On-Demand	Mild	PAPA1_CARPA	40	45
CCO[C@@H]1C[C@@H](NC(=O)c2cc(-c3ccncc3)nc3ccccc23)[C@H]1n1cccn1	ZINC000819396236	HH	On-Demand	Anodyne	TACR3	21	42
CCO[C@@H]1C[C@H](NC(=O)c2cc(-c3ccncc3)nc3ccccc23)[C@H]1n1cccn1	ZINC000819396237	HH	On-Demand	Anodyne	TACR3	21	42
CCO[C@@H]1C[C@@H](NC(=O)c2cc(-c3ccncc3)nc3ccccc23)[C@@H]1n1cccn1	ZINC000819396238	HH	On-Demand	Anodyne	TACR3	21	42
CCO[C@@H]1C[C@H](NC(=O)c2cc(-c3ccncc3)nc3ccccc23)[C@@H]1n1cccn1	ZINC000819396239	HH	On-Demand	Anodyne	TACR3	21	42
CCO[C@@H]1C[C@H](NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)[C@@H]1n1cccn1	ZINC000819396318	GE	On-Demand	Anodyne	GPR119	31	41
CCO[C@@H]1C[C@@H](NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)[C@H]1n1cccn1	ZINC000819396319	GE	On-Demand	Anodyne	GPR119	31	41
CCO[C@@H]1C[C@H](NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)[C@H]1n1cccn1	ZINC000819396320	GE	On-Demand	Anodyne	GPR119	31	41
CCO[C@@H]1C[C@@H](NC(=O)C2CCN(C(=O)OC(C)(C)C)CC2)[C@@H]1n1cccn1	ZINC000819396321	GE	On-Demand	Anodyne	GPR119	31	41
CCO[C@@H]1C[C@@H](NC(=O)c2cccnc2Cl)[C@H]1n1cccn1	ZINC000819396456	DE	On-Demand	Anodyne	G2YM83_BOTF4	74	39
CCO[C@@H]1C[C@@H](NC(=O)c2cccnc2Cl)[C@@H]1n1cccn1	ZINC000819396457	DE	On-Demand	Anodyne	G2YM83_BOTF4	74	39
CCO[C@@H]1C[C@H](NC(=O)c2cccnc2Cl)[C@@H]1n1cccn1	ZINC000819396458	DE	On-Demand	Anodyne	G2YM83_BOTF4	74	39
CCO[C@@H]1C[C@H](NC(=O)c2cccnc2Cl)[C@H]1n1cccn1	ZINC000819396459	DE	On-Demand	Anodyne	G2YM83_BOTF4	74	39
CCO[C@@H]1C[C@H](NC(=O)c2cc(=O)c3ccc(F)cc3o2)[C@H]1n1cccn1	ZINC000819396532	FE	On-Demand	Anodyne	KCNH2	15	48
CCO[C@@H]1C[C@@H](NC(=O)c2cc(=O)c3ccc(F)cc3o2)[C@H]1n1cccn1	ZINC000819396533	FE	On-Demand	Anodyne	KCNH2	15	48
CCO[C@@H]1C[C@@H](NC(=O)c2cc(=O)c3ccc(F)cc3o2)[C@@H]1n1cccn1	ZINC000819396534	FE	On-Demand	Anodyne	KCNH2	15	48
CCO[C@@H]1C[C@H](NC(=O)c2cc(=O)c3ccc(F)cc3o2)[C@@H]1n1cccn1	ZINC000819396535	FE	On-Demand	Anodyne	KCNH2	15	48
CCO[C@@H]1C[C@@H](NC(=O)c2cc(-c3ccccn3)nc3ccccc23)[C@H]1n1cccn1	ZINC000819396556	HH	On-Demand	Anodyne	METAP1	46	44
CCO[C@@H]1C[C@@H](NC(=O)c2cc(-c3ccccn3)nc3ccccc23)[C@H]1n1cccn1	ZINC000819396556	HH	On-Demand	Anodyne	TACR3	17	41
CCO[C@@H]1C[C@H](NC(=O)c2cc(-c3ccccn3)nc3ccccc23)[C@H]1n1cccn1	ZINC000819396557	HH	On-Demand	Anodyne	METAP1	46	44
CCO[C@@H]1C[C@H](NC(=O)c2cc(-c3ccccn3)nc3ccccc23)[C@H]1n1cccn1	ZINC000819396557	HH	On-Demand	Anodyne	TACR3	17	41
CCO[C@@H]1C[C@@H](NC(=O)c2cc(-c3ccccn3)nc3ccccc23)[C@@H]1n1cccn1	ZINC000819396558	HH	On-Demand	Anodyne	METAP1	46	44
CCO[C@@H]1C[C@@H](NC(=O)c2cc(-c3ccccn3)nc3ccccc23)[C@@H]1n1cccn1	ZINC000819396558	HH	On-Demand	Anodyne	TACR3	17	41
CCO[C@@H]1C[C@H](NC(=O)c2cc(-c3ccccn3)nc3ccccc23)[C@@H]1n1cccn1	ZINC000819396559	HH	On-Demand	Anodyne	METAP1	46	44
CCO[C@@H]1C[C@H](NC(=O)c2cc(-c3ccccn3)nc3ccccc23)[C@@H]1n1cccn1	ZINC000819396559	HH	On-Demand	Anodyne	TACR3	17	41
O=C1CCCN1c1ccc(NC[C@H](O)c2cccc(F)c2)cc1Cl	ZINC000819396731	EH	On-Demand	Anodyne	NPY2R	33	41
O=C1CCCN1c1ccc(NC[C@@H](O)c2cccc(F)c2)cc1Cl	ZINC000819396732	EH	On-Demand	Anodyne	NPY2R	33	41
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)c1cccnc1	ZINC000819396733	DG	On-Demand	Anodyne	ADRB2	28	47
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)c1cccnc1	ZINC000819396733	DG	On-Demand	Anodyne	ADRB1	27	50
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)c1cccnc1	ZINC000819396733	DG	On-Demand	Anodyne	ADRB3	91	50
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)c1cccnc1	ZINC000819396734	DG	On-Demand	Anodyne	ADRB2	28	47
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)c1cccnc1	ZINC000819396734	DG	On-Demand	Anodyne	ADRB1	27	50
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)c1cccnc1	ZINC000819396734	DG	On-Demand	Anodyne	ADRB3	91	50
O=C(CCNc1ccc(N2CCCC2=O)c(Cl)c1)Nc1cccnc1	ZINC000819396736	FG	On-Demand	Anodyne	NPY2R	49	35
C#Cc1cccc(NC(=O)[C@H]2CC(=O)N(Cc3ccccc3Cl)C2)c1	ZINC000819396757	FG	On-Demand	Mild	P2RX7	26	50
C#Cc1cccc(NC(=O)[C@@H]2CC(=O)N(Cc3ccccc3Cl)C2)c1	ZINC000819396758	FG	On-Demand	Mild	P2RX7	26	50
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(Cl)c([N+](=O)[O-])c3)CC2)c1	ZINC000819396772	IG	On-Demand	Mild	EPHX2	35	49
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1CO	ZINC000819396795	CD	On-Demand	Anodyne	QRFPR	47	39
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1CO	ZINC000819396797	CD	On-Demand	Anodyne	QRFPR	47	39
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1CO	ZINC000819396798	CD	On-Demand	Anodyne	QRFPR	47	39
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1CO	ZINC000819396800	CD	On-Demand	Anodyne	QRFPR	47	39
C#Cc1cccc(NC(=O)c2cn(-c3ccccc3)nc2-c2ccc(C)o2)c1	ZINC000819396813	FJ	On-Demand	Mild	KCNK3	67	35
C#Cc1cccc(NC(=O)c2cn(-c3ccccc3)nc2-c2ccc(C)o2)c1	ZINC000819396813	FJ	On-Demand	Mild	KCNK9	51	32
O=C1CCCN1c1ccc(NC[C@H](O)COc2ccccc2)cc1Cl	ZINC000819396820	FG	On-Demand	Anodyne	ADRB2	31	40
O=C1CCCN1c1ccc(NC[C@H](O)COc2ccccc2)cc1Cl	ZINC000819396820	FG	On-Demand	Anodyne	ADRB1	50	40
O=C1CCCN1c1ccc(NC[C@H](O)COc2ccccc2)cc1Cl	ZINC000819396820	FG	On-Demand	Anodyne	ADRB3	34	42
O=C1CCCN1c1ccc(NC[C@@H](O)COc2ccccc2)cc1Cl	ZINC000819396824	FG	On-Demand	Anodyne	ADRB2	31	40
O=C1CCCN1c1ccc(NC[C@@H](O)COc2ccccc2)cc1Cl	ZINC000819396824	FG	On-Demand	Anodyne	ADRB1	50	40
O=C1CCCN1c1ccc(NC[C@@H](O)COc2ccccc2)cc1Cl	ZINC000819396824	FG	On-Demand	Anodyne	ADRB3	34	42
O=C1CCCN1c1ccc(NC[C@@H](O)CCc2ccccc2)cc1Cl	ZINC000819396828	FH	On-Demand	Anodyne	NPY2R	34	40
O=C1CCCN1c1ccc(NC[C@H](O)CCc2ccccc2)cc1Cl	ZINC000819396830	FH	On-Demand	Anodyne	NPY2R	34	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	ACE	16	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	MME	24	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	KLK3	62	39
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	CTSB	30	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	PAPA1_CARPA	78	64
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	CYSP_TRYCR	43	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	CCKAR	42	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	NTSR1	42	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	CTSK	28	46
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	CTSL	39	64
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	TACR3	15	46
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	CAPNS1	54	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	GRIA1	50	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	REN	50	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	YARS	44	30
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	CCKBR	18	42
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	CTSS	17	64
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	CAPN1	35	44
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	CAPN2	51	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396853	GG	On-Demand	Mild	FPR1	58	47
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	ACE	16	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	MME	24	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	KLK3	62	39
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	CTSB	30	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	PAPA1_CARPA	78	64
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	CYSP_TRYCR	43	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	CCKAR	42	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	NTSR1	42	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	CTSK	28	46
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	CTSL	39	64
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	TACR3	15	46
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	CAPNS1	54	33
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	GRIA1	50	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	REN	50	41
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	YARS	44	30
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	CCKBR	18	42
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	CTSS	17	64
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	CAPN1	35	44
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	CAPN2	51	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396854	GG	On-Demand	Mild	FPR1	58	47
O=C1CCCN1c1ccc(NC[C@H](O)c2ccc(F)cc2Cl)cc1Cl	ZINC000819396858	GI	On-Demand	Anodyne	P2RX7	20	41
O=C1CCCN1c1ccc(NC[C@@H](O)c2ccc(F)cc2Cl)cc1Cl	ZINC000819396860	GI	On-Demand	Anodyne	P2RX7	20	41
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CC(c3cccc(OC)c3)=NO2)[C@@H]1n1cccn1	ZINC000819396914	GD	On-Demand	Anodyne	LUCI_PHOPY	16	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CC(c3cccc(OC)c3)=NO2)[C@@H]1n1cccn1	ZINC000819396915	GD	On-Demand	Anodyne	LUCI_PHOPY	16	40
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CC(c3cccc(OC)c3)=NO2)[C@H]1n1cccn1	ZINC000819396916	GD	On-Demand	Anodyne	LUCI_PHOPY	16	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CC(c3cccc(OC)c3)=NO2)[C@H]1n1cccn1	ZINC000819396917	GD	On-Demand	Anodyne	LUCI_PHOPY	16	40
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)COC1CCOCC1	ZINC000819396930	EF	On-Demand	Anodyne	ADRB1	23	40
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)COC1CCOCC1	ZINC000819396931	EF	On-Demand	Anodyne	ADRB1	23	40
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OCC(F)(F)F)cc2)cc1	ZINC000819396938	GG	On-Demand	Anodyne	ADRB3	25	44
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OCC(F)(F)F)cc2)cc1	ZINC000819396938	GG	On-Demand	Anodyne	CTSF	43	34
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OCC(F)(F)F)cc2)cc1	ZINC000819396939	GG	On-Demand	Anodyne	ADRB3	25	44
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OCC(F)(F)F)cc2)cc1	ZINC000819396939	GG	On-Demand	Anodyne	CTSF	43	34
O=C1CCCN1c1ccc(NC[C@H](O)c2ccc(F)cc2)cc1Cl	ZINC000819396940	EH	On-Demand	Anodyne	NPY2R	24	40
O=C1CCCN1c1ccc(NC[C@@H](O)c2ccc(F)cc2)cc1Cl	ZINC000819396941	EH	On-Demand	Anodyne	NPY2R	24	40
O=C(CCc1cccc(OC(F)F)c1)NCCc1ccc(O)c(O)c1	ZINC000819396946	FF	On-Demand	Clean	CRTM	57	40
CON(C)C(=O)CCNc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000819396951	EE	On-Demand	Anodyne	NPY2R	40	36
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)(C)C)cc3)CC2)c1	ZINC000819396955	HI	On-Demand	Mild	HSD11B1	15	47
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)(C)C)cc3)CC2)c1	ZINC000819396955	HI	On-Demand	Mild	EPHX2	45	56
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)(C)C)cc3)CC2)c1	ZINC000819396955	HI	On-Demand	Mild	TGM2	73	38
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(C(C)(C)C)cc3)CC2)c1	ZINC000819396955	HI	On-Demand	Mild	F13A1	75	38
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396975	GG	On-Demand	Mild	OPRM1	17	41
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396975	GG	On-Demand	Mild	KLK3	77	36
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396975	GG	On-Demand	Mild	CTSB	62	37
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396975	GG	On-Demand	Mild	PAPA1_CARPA	82	53
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396975	GG	On-Demand	Mild	CYSP_TRYCR	50	35
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396975	GG	On-Demand	Mild	CCKAR	45	42
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396975	GG	On-Demand	Mild	CTSK	39	45
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396975	GG	On-Demand	Mild	CTSL	66	54
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396975	GG	On-Demand	Mild	CAPNS1	55	33
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396975	GG	On-Demand	Mild	REN	57	42
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396975	GG	On-Demand	Mild	CCKBR	20	40
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396975	GG	On-Demand	Mild	CTSS	35	54
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396975	GG	On-Demand	Mild	CAPN1	57	44
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396975	GG	On-Demand	Mild	CAPN2	83	37
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396975	GG	On-Demand	Mild	CTSV	51	35
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396975	GG	On-Demand	Mild	FPR1	62	47
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396975	GG	On-Demand	Mild	CTRB_BOVIN	45	37
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396976	GG	On-Demand	Mild	OPRM1	17	41
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396976	GG	On-Demand	Mild	KLK3	77	36
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396976	GG	On-Demand	Mild	CTSB	62	37
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396976	GG	On-Demand	Mild	PAPA1_CARPA	82	53
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396976	GG	On-Demand	Mild	CYSP_TRYCR	50	35
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396976	GG	On-Demand	Mild	CCKAR	45	42
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396976	GG	On-Demand	Mild	CTSK	39	45
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396976	GG	On-Demand	Mild	CTSL	66	54
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396976	GG	On-Demand	Mild	CAPNS1	55	33
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396976	GG	On-Demand	Mild	REN	57	42
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396976	GG	On-Demand	Mild	CCKBR	20	40
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396976	GG	On-Demand	Mild	CTSS	35	54
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396976	GG	On-Demand	Mild	CAPN1	57	44
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396976	GG	On-Demand	Mild	CAPN2	83	37
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396976	GG	On-Demand	Mild	CTSV	51	35
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396976	GG	On-Demand	Mild	FPR1	62	47
C[C@@H](Cc1cccc(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819396976	GG	On-Demand	Mild	CTRB_BOVIN	45	37
C#CCNC(=O)CCNc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000819396996	DE	On-Demand	Mild	NPY2R	40	35
CCCOc1ccc(NCCS(C)(=O)=O)cc1OCCC	ZINC000819396997	DF	On-Demand	Anodyne	DRTS_TRYCR	46	34
NC(=O)CCNc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000819397033	CD	On-Demand	Anodyne	NPY2R	41	37
CCCOc1ccccc1NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819397087	FG	On-Demand	Clean	ADRB2	22	40
CCCOc1ccccc1NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819397087	FG	On-Demand	Clean	ADRB1	25	45
CCCOc1ccccc1NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819397089	FG	On-Demand	Clean	ADRB2	22	40
CCCOc1ccccc1NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819397089	FG	On-Demand	Clean	ADRB1	25	45
CCCOc1ccccc1NC[C@H](O)c1cc(OC)ccc1OC	ZINC000819397096	EH	On-Demand	Anodyne	MTNR1A	26	42
CCCOc1ccccc1NC[C@H](O)c1cc(OC)ccc1OC	ZINC000819397096	EH	On-Demand	Anodyne	MTNR1B	28	42
CCCOc1ccccc1NC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819397098	EH	On-Demand	Anodyne	MTNR1A	26	42
CCCOc1ccccc1NC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819397098	EH	On-Demand	Anodyne	MTNR1B	28	42
C[C@H](CCc1ccc(O)cc1)NC(=O)C(F)=C1CCC1	ZINC000819397100	CG	On-Demand	Anodyne	GRIA1	52	34
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(F)=C1CCC1	ZINC000819397102	CG	On-Demand	Anodyne	GRIA1	52	34
CCCOc1ccccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819397113	EH	On-Demand	Clean	ADRB2	47	45
CCCOc1ccccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819397113	EH	On-Demand	Clean	ADRB1	70	37
CCCOc1ccccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819397113	EH	On-Demand	Clean	ADRB3	37	41
CCCOc1ccccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819397113	EH	On-Demand	Clean	ABCB1	31	54
CCCOc1ccccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819397115	EH	On-Demand	Clean	ADRB2	47	45
CCCOc1ccccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819397115	EH	On-Demand	Clean	ADRB1	70	37
CCCOc1ccccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819397115	EH	On-Demand	Clean	ADRB3	37	41
CCCOc1ccccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819397115	EH	On-Demand	Clean	ABCB1	31	54
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397135	HF	On-Demand	Anodyne	F2	49	39
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397135	HF	On-Demand	Anodyne	PLG	31	43
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397135	HF	On-Demand	Anodyne	PRSS1	31	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397135	HF	On-Demand	Anodyne	ACE	35	45
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397135	HF	On-Demand	Anodyne	FKBP1A	44	38
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397135	HF	On-Demand	Anodyne	CELA1	30	46
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397135	HF	On-Demand	Anodyne	ELANE	28	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397135	HF	On-Demand	Anodyne	CTRA_BOVIN	62	33
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397135	HF	On-Demand	Anodyne	TRY1_BOVIN	67	35
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397135	HF	On-Demand	Anodyne	CTSG	42	33
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397135	HF	On-Demand	Anodyne	PREP	64	46
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397135	HF	On-Demand	Anodyne	CELA2A	51	33
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397135	HF	On-Demand	Anodyne	LGMN	89	49
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397135	HF	On-Demand	Anodyne	KLK5	35	45
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397135	HF	On-Demand	Anodyne	SLC12A5	62	35
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397135	HF	On-Demand	Anodyne	TMPRSS11D	59	35
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397136	HF	On-Demand	Anodyne	F2	49	39
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397136	HF	On-Demand	Anodyne	PLG	31	43
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397136	HF	On-Demand	Anodyne	PRSS1	31	41
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397136	HF	On-Demand	Anodyne	ACE	35	45
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397136	HF	On-Demand	Anodyne	FKBP1A	44	38
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397136	HF	On-Demand	Anodyne	CELA1	30	46
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397136	HF	On-Demand	Anodyne	ELANE	28	40
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397136	HF	On-Demand	Anodyne	CTRA_BOVIN	62	33
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397136	HF	On-Demand	Anodyne	TRY1_BOVIN	67	35
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397136	HF	On-Demand	Anodyne	CTSG	42	33
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397136	HF	On-Demand	Anodyne	PREP	64	46
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397136	HF	On-Demand	Anodyne	CELA2A	51	33
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397136	HF	On-Demand	Anodyne	LGMN	89	49
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397136	HF	On-Demand	Anodyne	KLK5	35	45
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397136	HF	On-Demand	Anodyne	SLC12A5	62	35
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397136	HF	On-Demand	Anodyne	TMPRSS11D	59	35
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397137	HF	On-Demand	Anodyne	F2	49	39
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397137	HF	On-Demand	Anodyne	PLG	31	43
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397137	HF	On-Demand	Anodyne	PRSS1	31	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397137	HF	On-Demand	Anodyne	ACE	35	45
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397137	HF	On-Demand	Anodyne	FKBP1A	44	38
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397137	HF	On-Demand	Anodyne	CELA1	30	46
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397137	HF	On-Demand	Anodyne	ELANE	28	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397137	HF	On-Demand	Anodyne	CTRA_BOVIN	62	33
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397137	HF	On-Demand	Anodyne	TRY1_BOVIN	67	35
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397137	HF	On-Demand	Anodyne	CTSG	42	33
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397137	HF	On-Demand	Anodyne	PREP	64	46
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397137	HF	On-Demand	Anodyne	CELA2A	51	33
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397137	HF	On-Demand	Anodyne	LGMN	89	49
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397137	HF	On-Demand	Anodyne	KLK5	35	45
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397137	HF	On-Demand	Anodyne	SLC12A5	62	35
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819397137	HF	On-Demand	Anodyne	TMPRSS11D	59	35
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397138	HF	On-Demand	Anodyne	F2	49	39
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397138	HF	On-Demand	Anodyne	PLG	31	43
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397138	HF	On-Demand	Anodyne	PRSS1	31	41
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397138	HF	On-Demand	Anodyne	ACE	35	45
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397138	HF	On-Demand	Anodyne	FKBP1A	44	38
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397138	HF	On-Demand	Anodyne	CELA1	30	46
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397138	HF	On-Demand	Anodyne	ELANE	28	40
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397138	HF	On-Demand	Anodyne	CTRA_BOVIN	62	33
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397138	HF	On-Demand	Anodyne	TRY1_BOVIN	67	35
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397138	HF	On-Demand	Anodyne	CTSG	42	33
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397138	HF	On-Demand	Anodyne	PREP	64	46
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397138	HF	On-Demand	Anodyne	CELA2A	51	33
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397138	HF	On-Demand	Anodyne	LGMN	89	49
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397138	HF	On-Demand	Anodyne	KLK5	35	45
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397138	HF	On-Demand	Anodyne	SLC12A5	62	35
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819397138	HF	On-Demand	Anodyne	TMPRSS11D	59	35
O=C1CCCN1c1ccc(NC[C@@H](O)Cc2ccc(F)cc2)cc1Cl	ZINC000819397162	FH	On-Demand	Anodyne	NPY2R	18	43
O=C1CCCN1c1ccc(NC[C@H](O)Cc2ccc(F)cc2)cc1Cl	ZINC000819397163	FH	On-Demand	Anodyne	NPY2R	18	43
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)COc1ccccc1F	ZINC000819397170	FH	On-Demand	Anodyne	ADRB2	39	40
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)COc1ccccc1F	ZINC000819397170	FH	On-Demand	Anodyne	ADRB1	60	36
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)COc1ccccc1F	ZINC000819397170	FH	On-Demand	Anodyne	ADRB3	25	40
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)COc1ccccc1F	ZINC000819397171	FH	On-Demand	Anodyne	ADRB2	39	40
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)COc1ccccc1F	ZINC000819397171	FH	On-Demand	Anodyne	ADRB1	60	36
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)COc1ccccc1F	ZINC000819397171	FH	On-Demand	Anodyne	ADRB3	25	40
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)(F)F)cc2)cc1	ZINC000819397172	GG	On-Demand	Anodyne	ADRB2	48	62
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)(F)F)cc2)cc1	ZINC000819397172	GG	On-Demand	Anodyne	ADRB1	75	62
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)(F)F)cc2)cc1	ZINC000819397172	GG	On-Demand	Anodyne	ADRB3	46	53
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)(F)F)cc2)cc1	ZINC000819397172	GG	On-Demand	Anodyne	ACR	43	37
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OCC(F)(F)F)cc2)cc1	ZINC000819397173	GG	On-Demand	Anodyne	ADRB2	48	62
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OCC(F)(F)F)cc2)cc1	ZINC000819397173	GG	On-Demand	Anodyne	ADRB1	75	62
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OCC(F)(F)F)cc2)cc1	ZINC000819397173	GG	On-Demand	Anodyne	ADRB3	46	53
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OCC(F)(F)F)cc2)cc1	ZINC000819397173	GG	On-Demand	Anodyne	ACR	43	37
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@H](O)C1CC1	ZINC000819397175	GH	On-Demand	Anodyne	PRNP	44	33
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@H](O)C1CC1	ZINC000819397175	GH	On-Demand	Anodyne	CCR8	40	41
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@H](O)C1CC1	ZINC000819397175	GH	On-Demand	Anodyne	KCNK3	63	40
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@H](O)C1CC1	ZINC000819397175	GH	On-Demand	Anodyne	KCNK9	37	40
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@@H](O)C1CC1	ZINC000819397177	GH	On-Demand	Anodyne	PRNP	44	33
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@@H](O)C1CC1	ZINC000819397177	GH	On-Demand	Anodyne	CCR8	40	41
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@@H](O)C1CC1	ZINC000819397177	GH	On-Demand	Anodyne	KCNK3	63	40
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@@H](O)C1CC1	ZINC000819397177	GH	On-Demand	Anodyne	KCNK9	37	40
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)cc2OC)cc1	ZINC000819397180	EF	On-Demand	Anodyne	ADRB2	44	46
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)cc2OC)cc1	ZINC000819397180	EF	On-Demand	Anodyne	ADRB1	45	42
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)cc2OC)cc1	ZINC000819397180	EF	On-Demand	Anodyne	ADRB3	23	43
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)cc2OC)cc1	ZINC000819397180	EF	On-Demand	Anodyne	CYP1B1	15	42
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)cc2OC)cc1	ZINC000819397181	EF	On-Demand	Anodyne	ADRB2	44	46
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)cc2OC)cc1	ZINC000819397181	EF	On-Demand	Anodyne	ADRB1	45	42
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)cc2OC)cc1	ZINC000819397181	EF	On-Demand	Anodyne	ADRB3	23	43
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)cc2OC)cc1	ZINC000819397181	EF	On-Demand	Anodyne	CYP1B1	15	42
CCCOc1ccccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819397182	EH	On-Demand	Clean	ADRB2	35	44
CCCOc1ccccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819397182	EH	On-Demand	Clean	ADRB1	63	40
CCCOc1ccccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819397182	EH	On-Demand	Clean	CASR	41	37
CCCOc1ccccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819397182	EH	On-Demand	Clean	ABCB1	34	45
CCCOc1ccccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819397182	EH	On-Demand	Clean	PDS	66	39
CCCOc1ccccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819397184	EH	On-Demand	Clean	ADRB2	35	44
CCCOc1ccccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819397184	EH	On-Demand	Clean	ADRB1	63	40
CCCOc1ccccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819397184	EH	On-Demand	Clean	CASR	41	37
CCCOc1ccccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819397184	EH	On-Demand	Clean	ABCB1	34	45
CCCOc1ccccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819397184	EH	On-Demand	Clean	PDS	66	39
COc1cc2c(cc1NC[C@H](O)CN1CCCC1=O)oc1ccccc12	ZINC000819397192	FF	On-Demand	Clean	HCRTR2	15	46
Cc1c(F)cccc1NC(=O)CCNc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000819397212	GI	On-Demand	Anodyne	KCNQ2	43	35
Cc1c(F)cccc1NC(=O)CCNc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000819397212	GI	On-Demand	Anodyne	NPY2R	44	40
CC[C@H](O)CNc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000819397219	CF	On-Demand	Anodyne	NPY2R	44	36
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)COCc1cccs1	ZINC000819397223	FH	On-Demand	Anodyne	ADRB1	19	41
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)COCc1cccs1	ZINC000819397225	FH	On-Demand	Anodyne	ADRB1	19	41
O=C(CCNc1ccc(N2CCCC2=O)c(Cl)c1)Nc1ccccc1	ZINC000819397228	FH	On-Demand	Anodyne	NPY2R	54	42
C#Cc1cccc(NC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2OC)c1	ZINC000819397252	GJ	On-Demand	Mild	KCNK3	76	46
C#Cc1cccc(NC(=O)c2cn(-c3ccccc3)nc2-c2ccccc2OC)c1	ZINC000819397252	GJ	On-Demand	Mild	KCNK9	66	46
O=C1CCCN1c1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1Cl	ZINC000819397260	GH	On-Demand	Anodyne	ADRB1	24	49
O=C1CCCN1c1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1Cl	ZINC000819397264	GH	On-Demand	Anodyne	ADRB1	24	49
COc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1CO	ZINC000819397273	GF	On-Demand	Mild	PAPA1_CARPA	44	44
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@@H](O)CC	ZINC000819397274	FH	On-Demand	Anodyne	KCNK3	63	40
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@@H](O)CC	ZINC000819397274	FH	On-Demand	Anodyne	KCNK9	37	40
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@H](O)CC	ZINC000819397275	FH	On-Demand	Anodyne	KCNK3	63	40
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@H](O)CC	ZINC000819397275	FH	On-Demand	Anodyne	KCNK9	37	40
C#Cc1cccc(NC(=O)c2ccc(-c3nc4ccccc4s3)o2)c1	ZINC000819397289	EJ	On-Demand	Mild	SCN10A	16	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc(F)c(F)c2)CC1	ZINC000819397291	FG	On-Demand	Anodyne	F13A1	16	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc(F)c(F)c2)CC1	ZINC000819397291	FG	On-Demand	Anodyne	GPR119	66	56
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc(F)c(F)c2)CC1	ZINC000819397291	FG	On-Demand	Anodyne	WNT3	42	35
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc(F)c(F)c2)CC1	ZINC000819397293	FG	On-Demand	Anodyne	F13A1	16	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc(F)c(F)c2)CC1	ZINC000819397293	FG	On-Demand	Anodyne	GPR119	66	56
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc(F)c(F)c2)CC1	ZINC000819397293	FG	On-Demand	Anodyne	WNT3	42	35
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H](Nc2ccccc2)C1	ZINC000819397324	DF	On-Demand	Anodyne	ITGAL	40	32
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H](Nc2ccccc2)C1	ZINC000819397325	DF	On-Demand	Anodyne	ITGAL	40	32
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H](Nc2ccccc2)C1	ZINC000819397326	DF	On-Demand	Anodyne	ITGAL	40	32
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H](Nc2ccccc2)C1	ZINC000819397327	DF	On-Demand	Anodyne	ITGAL	40	32
COc1ccc(O)c(CNC(=O)C[C@@H](C)n2cccn2)c1	ZINC000819397335	CD	On-Demand	Clean	NQO2	17	40
COc1ccc(O)c(CNC(=O)C[C@@H](C)n2cccn2)c1	ZINC000819397335	CD	On-Demand	Clean	MTNR1A	67	41
COc1ccc(O)c(CNC(=O)C[C@@H](C)n2cccn2)c1	ZINC000819397335	CD	On-Demand	Clean	MTNR1B	59	41
COc1ccc(O)c(CNC(=O)C[C@H](C)n2cccn2)c1	ZINC000819397336	CD	On-Demand	Clean	NQO2	17	40
COc1ccc(O)c(CNC(=O)C[C@H](C)n2cccn2)c1	ZINC000819397336	CD	On-Demand	Clean	MTNR1A	67	41
COc1ccc(O)c(CNC(=O)C[C@H](C)n2cccn2)c1	ZINC000819397336	CD	On-Demand	Clean	MTNR1B	59	41
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CN(Cc2ccccc2)CC[C@H]1CO	ZINC000819397353	ED	On-Demand	Anodyne	DRD4	30	42
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CN(Cc2ccccc2)CC[C@H]1CO	ZINC000819397353	ED	On-Demand	Anodyne	SIGMAR1	29	44
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CN(Cc2ccccc2)CC[C@H]1CO	ZINC000819397354	ED	On-Demand	Anodyne	DRD4	30	42
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CN(Cc2ccccc2)CC[C@H]1CO	ZINC000819397354	ED	On-Demand	Anodyne	SIGMAR1	29	44
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO	ZINC000819397355	ED	On-Demand	Anodyne	DRD4	30	42
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO	ZINC000819397355	ED	On-Demand	Anodyne	SIGMAR1	29	44
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO	ZINC000819397356	ED	On-Demand	Anodyne	DRD4	30	42
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO	ZINC000819397356	ED	On-Demand	Anodyne	SIGMAR1	29	44
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819397357	GF	On-Demand	Anodyne	ADRB1	28	46
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819397357	GF	On-Demand	Anodyne	ADRB3	43	44
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819397357	GF	On-Demand	Anodyne	IGF1R	29	42
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819397357	GF	On-Demand	Anodyne	CASR	47	36
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819397357	GF	On-Demand	Anodyne	EPHX2	24	41
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819397357	GF	On-Demand	Anodyne	CYP3A4	49	38
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819397358	GF	On-Demand	Anodyne	ADRB1	28	46
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819397358	GF	On-Demand	Anodyne	ADRB3	43	44
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819397358	GF	On-Demand	Anodyne	IGF1R	29	42
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819397358	GF	On-Demand	Anodyne	CASR	47	36
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819397358	GF	On-Demand	Anodyne	EPHX2	24	41
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819397358	GF	On-Demand	Anodyne	CYP3A4	49	38
COc1ccc(O)c(CNC(=O)C2(c3ccc(C)cc3)CCC2)c1	ZINC000819397359	EG	On-Demand	Clean	MTNR1A	36	44
COc1ccc(O)c(CNC(=O)C2(c3ccc(C)cc3)CCC2)c1	ZINC000819397359	EG	On-Demand	Clean	MTNR1B	24	44
CC(=O)Nc1ccc(NCCS(C)(=O)=O)cc1Cl	ZINC000819397376	CD	On-Demand	Anodyne	CA4	15	50
CC(=O)Nc1ccc(NCCS(C)(=O)=O)cc1Cl	ZINC000819397376	CD	On-Demand	Anodyne	IDO1	25	40
COc1ccc(O)c(CNC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)c1	ZINC000819397377	FH	On-Demand	Clean	MTNR1A	46	44
COc1ccc(O)c(CNC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)c1	ZINC000819397377	FH	On-Demand	Clean	MTNR1B	35	44
C#Cc1cccc(NC(=O)c2cc3c(Cl)cccc3s2)c1	ZINC000819397382	DJ	On-Demand	Mild	KCNK3	50	38
COc1cccc([S@@](=O)CC(=O)N[C@@H](C)c2cc(OC)ccc2O)c1	ZINC000819397393	FE	On-Demand	Clean	THRB	43	34
COc1cccc([S@@](=O)CC(=O)N[C@H](C)c2cc(OC)ccc2O)c1	ZINC000819397395	FE	On-Demand	Clean	THRB	43	34
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(NS(C)(=O)=O)cc1	ZINC000819397399	FD	On-Demand	Anodyne	TRPV1	18	44
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(NS(C)(=O)=O)cc1	ZINC000819397399	FD	On-Demand	Anodyne	PTPRB	47	43
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(NS(C)(=O)=O)cc1	ZINC000819397400	FD	On-Demand	Anodyne	TRPV1	18	44
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(NS(C)(=O)=O)cc1	ZINC000819397400	FD	On-Demand	Anodyne	PTPRB	47	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@H](Nc3ccccc3)C1)C2	ZINC000819397402	FF	On-Demand	Anodyne	WNT3	49	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@H](Nc3ccccc3)C1)C2	ZINC000819397404	FF	On-Demand	Anodyne	WNT3	49	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@H](Nc3ccccc3)C1)C2	ZINC000819397406	FF	On-Demand	Anodyne	WNT3	49	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@H](Nc3ccccc3)C1)C2	ZINC000819397408	FF	On-Demand	Anodyne	WNT3	49	32
CS(=O)(=O)Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819397430	GG	On-Demand	Anodyne	ADRB2	22	55
CS(=O)(=O)Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819397430	GG	On-Demand	Anodyne	GRIN1	27	43
CS(=O)(=O)Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819397430	GG	On-Demand	Anodyne	ADRB3	47	49
CS(=O)(=O)Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819397430	GG	On-Demand	Anodyne	TRPV1	16	40
CS(=O)(=O)Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819397432	GG	On-Demand	Anodyne	ADRB2	22	55
CS(=O)(=O)Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819397432	GG	On-Demand	Anodyne	GRIN1	27	43
CS(=O)(=O)Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819397432	GG	On-Demand	Anodyne	ADRB3	47	49
CS(=O)(=O)Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819397432	GG	On-Demand	Anodyne	TRPV1	16	40
C=C(C)C(C)(C)C(=O)N[C@H](C)c1cc(OC)ccc1O	ZINC000819397434	CG	On-Demand	Mild	THRA	45	35
C=C(C)C(C)(C)C(=O)N[C@H](C)c1cc(OC)ccc1O	ZINC000819397434	CG	On-Demand	Mild	THRB	49	38
C=C(C)C(C)(C)C(=O)N[C@@H](C)c1cc(OC)ccc1O	ZINC000819397435	CG	On-Demand	Mild	THRA	45	35
C=C(C)C(C)(C)C(=O)N[C@@H](C)c1cc(OC)ccc1O	ZINC000819397435	CG	On-Demand	Mild	THRB	49	38
NS(=O)(=O)C[C@H]1CCCCN1C(=O)CCc1cccc(OC(F)F)c1	ZINC000819397437	GD	On-Demand	Anodyne	FKBP1A	47	39
NS(=O)(=O)C[C@H]1CCCCN1C(=O)CCc1cccc(OC(F)F)c1	ZINC000819397437	GD	On-Demand	Anodyne	CPT1A	52	36
NS(=O)(=O)C[C@@H]1CCCCN1C(=O)CCc1cccc(OC(F)F)c1	ZINC000819397439	GD	On-Demand	Anodyne	FKBP1A	47	39
NS(=O)(=O)C[C@@H]1CCCCN1C(=O)CCc1cccc(OC(F)F)c1	ZINC000819397439	GD	On-Demand	Anodyne	CPT1A	52	36
CCCOc1ccccc1NC[C@H](O)c1ccccc1	ZINC000819397544	CH	On-Demand	Anodyne	ADRB3	36	42
CCCOc1ccccc1NC[C@@H](O)c1ccccc1	ZINC000819397545	CH	On-Demand	Anodyne	ADRB3	36	42
CCCOc1ccccc1NCC1(O)CCCC1	ZINC000819397554	BG	On-Demand	Anodyne	HCN1	54	34
CCCOc1ccccc1NCC1(O)CCCC1	ZINC000819397554	BG	On-Demand	Anodyne	HCN4	51	33
CCCOc1ccccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819397559	DH	On-Demand	Bother	ADRB1	15	43
CCCOc1ccccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819397559	DH	On-Demand	Bother	CACNA1C	52	37
CCCOc1ccccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819397559	DH	On-Demand	Bother	ADRB3	37	42
CCCOc1ccccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819397559	DH	On-Demand	Bother	CACNA1D	77	37
CCCOc1ccccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819397560	DH	On-Demand	Bother	ADRB1	15	43
CCCOc1ccccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819397560	DH	On-Demand	Bother	CACNA1C	52	37
CCCOc1ccccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819397560	DH	On-Demand	Bother	ADRB3	37	42
CCCOc1ccccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819397560	DH	On-Demand	Bother	CACNA1D	77	37
Cc1ccc(NC[C@H](O)c2cccnc2)cc1C(F)(F)F	ZINC000819397583	CH	On-Demand	Anodyne	ADRB2	28	40
Cc1ccc(NC[C@H](O)c2cccnc2)cc1C(F)(F)F	ZINC000819397583	CH	On-Demand	Anodyne	ADRB1	25	43
Cc1ccc(NC[C@H](O)c2cccnc2)cc1C(F)(F)F	ZINC000819397583	CH	On-Demand	Anodyne	ADRB3	94	46
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1C(F)(F)F	ZINC000819397584	CH	On-Demand	Anodyne	ADRB2	28	40
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1C(F)(F)F	ZINC000819397584	CH	On-Demand	Anodyne	ADRB1	25	43
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1C(F)(F)F	ZINC000819397584	CH	On-Demand	Anodyne	ADRB3	94	46
C#Cc1cccc(NC(=O)c2cc(Cl)c(OCCCC)c(OC)c2)c1	ZINC000819397594	FJ	On-Demand	Mild	CPT1A	46	33
C#Cc1cccc(NC(=O)c2cc(Cl)c(OCCCC)c(OC)c2)c1	ZINC000819397594	FJ	On-Demand	Mild	LPAR2	39	43
C#Cc1cccc(NC(=O)c2cc(Cl)c(OCCCC)c(OC)c2)c1	ZINC000819397594	FJ	On-Demand	Mild	S1PR2	39	43
C#Cc1cccc(NC(=O)c2cc(Cl)c(OCCCC)c(OC)c2)c1	ZINC000819397594	FJ	On-Demand	Mild	TAAR1	34	43
C#Cc1cccc(NC(=O)c2cc(Cl)c(OCCCC)c(OC)c2)c1	ZINC000819397594	FJ	On-Demand	Mild	SMO	19	44
C#Cc1cccc(NC(=O)c2cc(Cl)c(OCCCC)c(OC)c2)c1	ZINC000819397594	FJ	On-Demand	Mild	KCNK3	90	40
C#Cc1cccc(NC(=O)c2cc(Cl)c(OCCCC)c(OC)c2)c1	ZINC000819397594	FJ	On-Demand	Mild	KCNK9	70	40
O=C1CCCN1c1ccc(NC[C@H](O)c2ccccc2)cc1Cl	ZINC000819397597	EH	On-Demand	Anodyne	ADRB3	17	45
O=C1CCCN1c1ccc(NC[C@H](O)c2ccccc2)cc1Cl	ZINC000819397597	EH	On-Demand	Anodyne	NPY2R	44	39
O=C1CCCN1c1ccc(NC[C@@H](O)c2ccccc2)cc1Cl	ZINC000819397599	EH	On-Demand	Anodyne	ADRB3	17	45
O=C1CCCN1c1ccc(NC[C@@H](O)c2ccccc2)cc1Cl	ZINC000819397599	EH	On-Demand	Anodyne	NPY2R	44	39
O=C1CCCN1c1ccc(NC[C@@H](O)Cc2ccccc2)cc1Cl	ZINC000819397601	EG	On-Demand	Anodyne	NPY2R	39	42
O=C1CCCN1c1ccc(NC[C@H](O)Cc2ccccc2)cc1Cl	ZINC000819397603	EG	On-Demand	Anodyne	NPY2R	39	42
C/C=C/c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2OC)c(OC)c1	ZINC000819397609	FH	On-Demand	Anodyne	ADRB2	23	66
C/C=C/c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2OC)c(OC)c1	ZINC000819397609	FH	On-Demand	Anodyne	ADRB1	16	66
C/C=C/c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2OC)c(OC)c1	ZINC000819397609	FH	On-Demand	Anodyne	CYP1B1	39	43
C/C=C/c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2OC)c(OC)c1	ZINC000819397609	FH	On-Demand	Anodyne	CYP1A1	36	43
C/C=C\c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2OC)c(OC)c1	ZINC000819397611	FH	On-Demand	Anodyne	ADRB2	23	66
C/C=C\c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2OC)c(OC)c1	ZINC000819397611	FH	On-Demand	Anodyne	ADRB1	16	66
C/C=C\c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2OC)c(OC)c1	ZINC000819397611	FH	On-Demand	Anodyne	CYP1B1	39	43
C/C=C\c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2OC)c(OC)c1	ZINC000819397611	FH	On-Demand	Anodyne	CYP1A1	36	43
C/C=C\c1ccc(OC[C@H](O)CNc2ccc(OC)cc2OC)c(OC)c1	ZINC000819397613	FH	On-Demand	Anodyne	ADRB2	23	66
C/C=C\c1ccc(OC[C@H](O)CNc2ccc(OC)cc2OC)c(OC)c1	ZINC000819397613	FH	On-Demand	Anodyne	ADRB1	16	66
C/C=C\c1ccc(OC[C@H](O)CNc2ccc(OC)cc2OC)c(OC)c1	ZINC000819397613	FH	On-Demand	Anodyne	CYP1B1	39	43
C/C=C\c1ccc(OC[C@H](O)CNc2ccc(OC)cc2OC)c(OC)c1	ZINC000819397613	FH	On-Demand	Anodyne	CYP1A1	36	43
C/C=C/c1ccc(OC[C@H](O)CNc2ccc(OC)cc2OC)c(OC)c1	ZINC000819397615	FH	On-Demand	Anodyne	ADRB2	23	66
C/C=C/c1ccc(OC[C@H](O)CNc2ccc(OC)cc2OC)c(OC)c1	ZINC000819397615	FH	On-Demand	Anodyne	ADRB1	16	66
C/C=C/c1ccc(OC[C@H](O)CNc2ccc(OC)cc2OC)c(OC)c1	ZINC000819397615	FH	On-Demand	Anodyne	CYP1B1	39	43
C/C=C/c1ccc(OC[C@H](O)CNc2ccc(OC)cc2OC)c(OC)c1	ZINC000819397615	FH	On-Demand	Anodyne	CYP1A1	36	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N(CCCO)Cc1ccccc1	ZINC000819397617	EE	On-Demand	Anodyne	CTSB	15	47
COC[C@@H](O)CNc1ccc(OCC(F)(F)F)cc1	ZINC000819397625	CE	On-Demand	Anodyne	ADRB2	30	41
COC[C@@H](O)CNc1ccc(OCC(F)(F)F)cc1	ZINC000819397625	CE	On-Demand	Anodyne	ADRB1	40	41
O=C(CCNc1ccc(N2CCCC2=O)c(Cl)c1)Nc1cc(F)cc(F)c1	ZINC000819397646	GI	On-Demand	Anodyne	NPY2R	40	42
CCCOc1ccccc1NC[C@H](O)COc1ccccc1	ZINC000819397658	DG	On-Demand	Clean	ADRB2	55	52
CCCOc1ccccc1NC[C@H](O)COc1ccccc1	ZINC000819397658	DG	On-Demand	Clean	ADRB1	70	46
CCCOc1ccccc1NC[C@H](O)COc1ccccc1	ZINC000819397658	DG	On-Demand	Clean	ADRB3	39	46
CCCOc1ccccc1NC[C@H](O)COc1ccccc1	ZINC000819397658	DG	On-Demand	Clean	CYP2D6	17	41
CCCOc1ccccc1NC[C@H](O)COc1ccccc1	ZINC000819397658	DG	On-Demand	Clean	ABCB1	30	41
CCCOc1ccccc1NC[C@H](O)COc1ccccc1	ZINC000819397658	DG	On-Demand	Clean	PDS	50	37
CCCOc1ccccc1NC[C@@H](O)COc1ccccc1	ZINC000819397659	DG	On-Demand	Clean	ADRB2	55	52
CCCOc1ccccc1NC[C@@H](O)COc1ccccc1	ZINC000819397659	DG	On-Demand	Clean	ADRB1	70	46
CCCOc1ccccc1NC[C@@H](O)COc1ccccc1	ZINC000819397659	DG	On-Demand	Clean	ADRB3	39	46
CCCOc1ccccc1NC[C@@H](O)COc1ccccc1	ZINC000819397659	DG	On-Demand	Clean	CYP2D6	17	41
CCCOc1ccccc1NC[C@@H](O)COc1ccccc1	ZINC000819397659	DG	On-Demand	Clean	ABCB1	30	41
CCCOc1ccccc1NC[C@@H](O)COc1ccccc1	ZINC000819397659	DG	On-Demand	Clean	PDS	50	37
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1ccc(Cc2ccncc2)cc1	ZINC000819397665	GF	On-Demand	Anodyne	PTPRB	41	45
O[C@H](CNc1ccc(OC(F)F)c(Cl)c1)COc1ccccc1	ZINC000819397671	EH	On-Demand	Anodyne	ADRB2	38	44
O[C@H](CNc1ccc(OC(F)F)c(Cl)c1)COc1ccccc1	ZINC000819397671	EH	On-Demand	Anodyne	ADRB1	48	42
O[C@H](CNc1ccc(OC(F)F)c(Cl)c1)COc1ccccc1	ZINC000819397671	EH	On-Demand	Anodyne	ADRB3	33	42
O[C@@H](CNc1ccc(OC(F)F)c(Cl)c1)COc1ccccc1	ZINC000819397672	EH	On-Demand	Anodyne	ADRB2	38	44
O[C@@H](CNc1ccc(OC(F)F)c(Cl)c1)COc1ccccc1	ZINC000819397672	EH	On-Demand	Anodyne	ADRB1	48	42
O[C@@H](CNc1ccc(OC(F)F)c(Cl)c1)COc1ccccc1	ZINC000819397672	EH	On-Demand	Anodyne	ADRB3	33	42
O[C@@H](CNc1ccc(-c2nnc3n2CCCCCC3)cc1)COc1ccccc1	ZINC000819397700	GH	On-Demand	Anodyne	ADRB2	46	42
O[C@@H](CNc1ccc(-c2nnc3n2CCCCCC3)cc1)COc1ccccc1	ZINC000819397700	GH	On-Demand	Anodyne	ADRB1	68	41
O[C@@H](CNc1ccc(-c2nnc3n2CCCCCC3)cc1)COc1ccccc1	ZINC000819397700	GH	On-Demand	Anodyne	ADRB3	51	41
O[C@H](CNc1ccc(-c2nnc3n2CCCCCC3)cc1)COc1ccccc1	ZINC000819397704	GH	On-Demand	Anodyne	ADRB2	46	42
O[C@H](CNc1ccc(-c2nnc3n2CCCCCC3)cc1)COc1ccccc1	ZINC000819397704	GH	On-Demand	Anodyne	ADRB1	68	41
O[C@H](CNc1ccc(-c2nnc3n2CCCCCC3)cc1)COc1ccccc1	ZINC000819397704	GH	On-Demand	Anodyne	ADRB3	51	41
N#Cc1ccc([C@H](O)CNc2ccc(NC(=O)C3CC3)cc2)cc1	ZINC000819397706	DG	On-Demand	Mild	DHODH	21	48
N#Cc1ccc([C@@H](O)CNc2ccc(NC(=O)C3CC3)cc2)cc1	ZINC000819397708	DG	On-Demand	Mild	DHODH	21	48
CC(C)(C)[C@@H](O)CNc1ccc(-c2nnc3n2CCCCCC3)cc1	ZINC000819397709	EH	On-Demand	Anodyne	HSD11B2	15	42
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)c1	ZINC000819397713	HH	On-Demand	Mild	TRY2_BOVIN	53	37
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)c1	ZINC000819397713	HH	On-Demand	Mild	EPHX2	37	58
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)c1	ZINC000819397713	HH	On-Demand	Mild	TGM2	48	37
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)c1	ZINC000819397713	HH	On-Demand	Mild	F13A1	57	37
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc4ccccc4c3)CC2)c1	ZINC000819397713	HH	On-Demand	Mild	AKR1C3	19	48
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000819397715	GG	On-Demand	Anodyne	NPY2R	40	36
C#Cc1cccc(NC(=O)c2cn(-c3ccccc3)nc2-c2ccc(OC)c(OC)c2)c1	ZINC000819397716	HJ	On-Demand	Mild	CPT1A	48	33
C#Cc1cccc(NC(=O)c2cn(-c3ccccc3)nc2-c2ccc(OC)c(OC)c2)c1	ZINC000819397716	HJ	On-Demand	Mild	NR1H4	18	43
C#Cc1cccc(NC(=O)c2cn(-c3ccccc3)nc2-c2ccc(OC)c(OC)c2)c1	ZINC000819397716	HJ	On-Demand	Mild	ENPP1	65	31
C#Cc1cccc(NC(=O)c2cn(-c3ccccc3)nc2-c2ccc(OC)c(OC)c2)c1	ZINC000819397716	HJ	On-Demand	Mild	KCNK3	59	41
C#Cc1cccc(NC(=O)c2cn(-c3ccccc3)nc2-c2ccc(OC)c(OC)c2)c1	ZINC000819397716	HJ	On-Demand	Mild	KCNK9	56	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000819397717	GG	On-Demand	Anodyne	NPY2R	40	36
C#Cc1cccc(NC(=O)c2cc(OC)c(OC)cc2NC(=O)Cc2cccs2)c1	ZINC000819397718	HI	On-Demand	Mild	KCNK3	58	40
C#Cc1cccc(NC(=O)c2cc(OC)c(OC)cc2NC(=O)Cc2cccs2)c1	ZINC000819397718	HI	On-Demand	Mild	KCNK9	58	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCCCNC(=O)c1cccc(O)c1	ZINC000819397719	GD	On-Demand	Anodyne	DRD4	41	32
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819397722	FE	On-Demand	Anodyne	CASR	48	37
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819397722	FE	On-Demand	Anodyne	EPHX2	24	41
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819397723	FE	On-Demand	Anodyne	CASR	48	37
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819397723	FE	On-Demand	Anodyne	EPHX2	24	41
C=CCCn1cc(C(=O)N[C@H](C)c2cc(OC)ccc2O)nn1	ZINC000819397727	DE	On-Demand	Mild	THRB	43	33
C=CCCn1cc(C(=O)N[C@@H](C)c2cc(OC)ccc2O)nn1	ZINC000819397728	DE	On-Demand	Mild	THRB	43	33
C#Cc1cccc(NC(=O)[C@@H]2CC(=O)N(c3cccc4ccccc34)C2)c1	ZINC000819397741	FH	On-Demand	Mild	INHA	20	46
C#Cc1cccc(NC(=O)[C@H]2CC(=O)N(c3cccc4ccccc34)C2)c1	ZINC000819397742	FH	On-Demand	Mild	INHA	20	46
O=C(Nc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819397746	EH	On-Demand	Anodyne	ADRB2	15	52
O=C(Nc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819397746	EH	On-Demand	Anodyne	ADRB1	40	52
O=C(Nc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819397746	EH	On-Demand	Anodyne	ADRB3	60	45
O=C(Nc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819397746	EH	On-Demand	Anodyne	IGF1R	27	40
O=C(Nc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819397746	EH	On-Demand	Anodyne	TYK2	41	37
O=C(Nc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819397746	EH	On-Demand	Anodyne	CYP3A4	48	40
O=C(Nc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819397748	EH	On-Demand	Anodyne	ADRB2	15	52
O=C(Nc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819397748	EH	On-Demand	Anodyne	ADRB1	40	52
O=C(Nc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819397748	EH	On-Demand	Anodyne	ADRB3	60	45
O=C(Nc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819397748	EH	On-Demand	Anodyne	IGF1R	27	40
O=C(Nc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819397748	EH	On-Demand	Anodyne	TYK2	41	37
O=C(Nc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819397748	EH	On-Demand	Anodyne	CYP3A4	48	40
O=C(CCNc1ccc(OCC(F)(F)F)cc1)Nc1cccnc1	ZINC000819397753	EG	On-Demand	Anodyne	NAMPT	19	42
CCCOc1ccc(NCCC(=O)NC(N)=O)cc1OCCC	ZINC000819397758	DE	On-Demand	Anodyne	ENPP1	50	30
CCCOc1ccc(NCCC(=O)NC(N)=O)cc1OCCC	ZINC000819397758	DE	On-Demand	Anodyne	DRTS_TRYCR	52	40
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)Cc1ccc(F)cc1	ZINC000819397760	EH	On-Demand	Anodyne	ADRB2	18	42
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)Cc1ccc(F)cc1	ZINC000819397760	EH	On-Demand	Anodyne	ADRB1	26	42
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)Cc1ccc(F)cc1	ZINC000819397760	EH	On-Demand	Anodyne	ADRB3	18	42
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)Cc1ccc(F)cc1	ZINC000819397761	EH	On-Demand	Anodyne	ADRB2	18	42
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)Cc1ccc(F)cc1	ZINC000819397761	EH	On-Demand	Anodyne	ADRB1	26	42
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)Cc1ccc(F)cc1	ZINC000819397761	EH	On-Demand	Anodyne	ADRB3	18	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)(F)F)cc2)c1	ZINC000819397762	GH	On-Demand	Anodyne	ADRB2	43	44
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)(F)F)cc2)c1	ZINC000819397762	GH	On-Demand	Anodyne	ADRB1	65	43
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)(F)F)cc2)c1	ZINC000819397762	GH	On-Demand	Anodyne	GRIN1	18	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)(F)F)cc2)c1	ZINC000819397762	GH	On-Demand	Anodyne	ADRB3	39	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)(F)F)cc2)c1	ZINC000819397762	GH	On-Demand	Anodyne	ABCB1	17	43
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)(F)F)cc2)c1	ZINC000819397762	GH	On-Demand	Anodyne	PDS	69	38
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(F)(F)F)cc2)c1	ZINC000819397764	GH	On-Demand	Anodyne	ADRB2	43	44
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(F)(F)F)cc2)c1	ZINC000819397764	GH	On-Demand	Anodyne	ADRB1	65	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(F)(F)F)cc2)c1	ZINC000819397764	GH	On-Demand	Anodyne	GRIN1	18	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(F)(F)F)cc2)c1	ZINC000819397764	GH	On-Demand	Anodyne	ADRB3	39	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(F)(F)F)cc2)c1	ZINC000819397764	GH	On-Demand	Anodyne	ABCB1	17	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(F)(F)F)cc2)c1	ZINC000819397764	GH	On-Demand	Anodyne	PDS	69	38
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1ccc(NC(=O)C2CC2)cc1	ZINC000819397772	GE	On-Demand	Anodyne	EPHX2	17	41
O=C(CCNc1ccc(N2CCCC2=O)c(Cl)c1)Nc1ccccc1F	ZINC000819397776	GI	On-Demand	Anodyne	KCNQ2	53	38
O=C(CCNc1ccc(N2CCCC2=O)c(Cl)c1)Nc1ccccc1F	ZINC000819397776	GI	On-Demand	Anodyne	NPY2R	51	42
C#Cc1cccc(NC(=O)CSCC(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)c1	ZINC000819397791	IF	On-Demand	Mild	FPR2	57	51
COc1ccc(O)c([C@@H](C)NC(=O)c2cc(Br)c(C)s2)c1	ZINC000819397798	FI	On-Demand	Clean	THRA	52	38
COc1ccc(O)c([C@@H](C)NC(=O)c2cc(Br)c(C)s2)c1	ZINC000819397798	FI	On-Demand	Clean	THRB	57	40
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1O	ZINC000819397799	GF	On-Demand	Mild	CTSD	15	41
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1O	ZINC000819397799	GF	On-Demand	Mild	PAPA1_CARPA	57	53
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1O	ZINC000819397799	GF	On-Demand	Mild	CCKAR	43	38
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1O	ZINC000819397799	GF	On-Demand	Mild	CTSL	21	53
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1O	ZINC000819397799	GF	On-Demand	Mild	FURIN	48	31
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1O	ZINC000819397799	GF	On-Demand	Mild	CTSS	16	53
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1O	ZINC000819397799	GF	On-Demand	Mild	FPR1	43	36
COc1ccc(O)c([C@H](C)NC(=O)c2cc(Br)c(C)s2)c1	ZINC000819397800	FI	On-Demand	Clean	THRA	52	38
COc1ccc(O)c([C@H](C)NC(=O)c2cc(Br)c(C)s2)c1	ZINC000819397800	FI	On-Demand	Clean	THRB	57	40
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819397801	GF	On-Demand	Anodyne	MTOR	15	42
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819397801	GF	On-Demand	Anodyne	EPHX2	25	47
O=C(Nc1ccc(NC[C@H](O)c2ccc(Cl)c(F)c2)cc1)C1CC1	ZINC000819397802	EH	On-Demand	Anodyne	ENV	40	34
O=C(Nc1ccc(NC[C@@H](O)c2ccc(Cl)c(F)c2)cc1)C1CC1	ZINC000819397805	EH	On-Demand	Anodyne	ENV	40	34
C[C@@](O)(CNc1ccc(-c2nnc3n2CCCCCC3)cc1)C(F)(F)F	ZINC000819397810	FH	On-Demand	Anodyne	HSD11B2	15	42
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc(NC(=O)c2ccco2)cc1	ZINC000819397818	GG	On-Demand	Anodyne	NQO2	15	41
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc(NC(=O)c2ccco2)cc1	ZINC000819397819	GG	On-Demand	Anodyne	NQO2	15	41
CCO[C@@H]1C[C@H](NC(=O)c2ccc(-c3ccccc3)cc2)[C@@H]1n1cccn1	ZINC000819397860	FH	On-Demand	Anodyne	PRNP	42	36
CCO[C@@H]1C[C@@H](NC(=O)c2ccc(-c3ccccc3)cc2)[C@H]1n1cccn1	ZINC000819397861	FH	On-Demand	Anodyne	PRNP	42	36
CCO[C@@H]1C[C@@H](NC(=O)c2ccc(-c3ccccc3)cc2)[C@@H]1n1cccn1	ZINC000819397862	FH	On-Demand	Anodyne	PRNP	42	36
CCO[C@@H]1C[C@H](NC(=O)c2ccc(-c3ccccc3)cc2)[C@H]1n1cccn1	ZINC000819397863	FH	On-Demand	Anodyne	PRNP	42	36
CCO[C@@H]1C[C@@H](NC(=O)c2ccccc2OCC#N)[C@H]1n1cccn1	ZINC000819397896	ED	On-Demand	Mild	HCN1	54	32
CCO[C@@H]1C[C@@H](NC(=O)c2ccccc2OCC#N)[C@H]1n1cccn1	ZINC000819397896	ED	On-Demand	Mild	HCN4	42	32
CCO[C@@H]1C[C@@H](NC(=O)c2ccccc2OCC#N)[C@@H]1n1cccn1	ZINC000819397897	ED	On-Demand	Mild	HCN1	54	32
CCO[C@@H]1C[C@@H](NC(=O)c2ccccc2OCC#N)[C@@H]1n1cccn1	ZINC000819397897	ED	On-Demand	Mild	HCN4	42	32
CCO[C@@H]1C[C@H](NC(=O)c2ccccc2OCC#N)[C@@H]1n1cccn1	ZINC000819397898	ED	On-Demand	Mild	HCN1	54	32
CCO[C@@H]1C[C@H](NC(=O)c2ccccc2OCC#N)[C@@H]1n1cccn1	ZINC000819397898	ED	On-Demand	Mild	HCN4	42	32
CCO[C@@H]1C[C@H](NC(=O)c2ccccc2OCC#N)[C@H]1n1cccn1	ZINC000819397899	ED	On-Demand	Mild	HCN1	54	32
CCO[C@@H]1C[C@H](NC(=O)c2ccccc2OCC#N)[C@H]1n1cccn1	ZINC000819397899	ED	On-Demand	Mild	HCN4	42	32
COc1cc(CNC(=O)C(F)=C2CCC2)ccc1O	ZINC000819397939	CE	On-Demand	Anodyne	TRPV1	24	51
O[C@H](CNc1ccc(OC(F)F)c(Cl)c1)COc1ccc2c(c1)OCO2	ZINC000819397943	GH	On-Demand	Anodyne	GRIN1	21	42
O[C@@H](CNc1ccc(OC(F)F)c(Cl)c1)COc1ccc2c(c1)OCO2	ZINC000819397944	GH	On-Demand	Anodyne	GRIN1	21	42
CCCOc1ccccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819397966	DD	On-Demand	Clean	ABCB1	67	40
CCCOc1ccccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819397967	DD	On-Demand	Clean	ABCB1	67	40
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NCC(C)(C)O	ZINC000819397969	FH	On-Demand	Anodyne	KCNJ11	47	36
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NCC(C)(C)O	ZINC000819397969	FH	On-Demand	Anodyne	HCN1	49	33
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NCC(C)(C)O	ZINC000819397969	FH	On-Demand	Anodyne	HCN4	42	33
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NCC(C)(C)O	ZINC000819397969	FH	On-Demand	Anodyne	KCNK3	67	41
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NCC(C)(C)O	ZINC000819397969	FH	On-Demand	Anodyne	KCNK9	38	41
CON(C)C(=O)CCNc1ccc(NS(C)(=O)=O)cc1	ZINC000819397970	DC	On-Demand	Anodyne	TRPV1	18	40
CON(C)C(=O)CCNc1ccc(NS(C)(=O)=O)cc1	ZINC000819397970	DC	On-Demand	Anodyne	PTPRB	50	36
COc1ccc(O)c([C@@H](C)NC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819397972	EF	On-Demand	Clean	THRA	44	38
COc1ccc(O)c([C@@H](C)NC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819397972	EF	On-Demand	Clean	TSHR	47	33
COc1ccc(O)c([C@@H](C)NC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819397972	EF	On-Demand	Clean	THRB	58	38
COc1ccc(O)c([C@@H](C)NC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819397972	EF	On-Demand	Clean	MTNR1A	73	43
COc1ccc(O)c([C@@H](C)NC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819397972	EF	On-Demand	Clean	MTNR1B	70	43
COc1ccc(O)c([C@H](C)NC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819397973	EF	On-Demand	Clean	THRA	44	38
COc1ccc(O)c([C@H](C)NC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819397973	EF	On-Demand	Clean	TSHR	47	33
COc1ccc(O)c([C@H](C)NC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819397973	EF	On-Demand	Clean	THRB	58	38
COc1ccc(O)c([C@H](C)NC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819397973	EF	On-Demand	Clean	MTNR1A	73	43
COc1ccc(O)c([C@H](C)NC(=O)Cc2cccc(NC(C)=O)c2)c1	ZINC000819397973	EF	On-Demand	Clean	MTNR1B	70	43
O=C(Nc1ccc(NC[C@H](O)c2cccnc2)cc1)C1CC1	ZINC000819397978	CF	On-Demand	Anodyne	ADRB2	24	47
O=C(Nc1ccc(NC[C@H](O)c2cccnc2)cc1)C1CC1	ZINC000819397978	CF	On-Demand	Anodyne	ADRB1	25	41
O=C(Nc1ccc(NC[C@H](O)c2cccnc2)cc1)C1CC1	ZINC000819397978	CF	On-Demand	Anodyne	ADRB3	98	48
O=C(Nc1ccc(NC[C@H](O)c2cccnc2)cc1)C1CC1	ZINC000819397978	CF	On-Demand	Anodyne	NAMPT	52	39
O[C@H](CNc1ccc(OC(F)F)c(Cl)c1)COc1ccccc1F	ZINC000819397980	FH	On-Demand	Anodyne	ADRB1	48	34
O=C(Nc1ccc(NC[C@@H](O)c2cccnc2)cc1)C1CC1	ZINC000819397981	CF	On-Demand	Anodyne	ADRB2	24	47
O=C(Nc1ccc(NC[C@@H](O)c2cccnc2)cc1)C1CC1	ZINC000819397981	CF	On-Demand	Anodyne	ADRB1	25	41
O=C(Nc1ccc(NC[C@@H](O)c2cccnc2)cc1)C1CC1	ZINC000819397981	CF	On-Demand	Anodyne	ADRB3	98	48
O=C(Nc1ccc(NC[C@@H](O)c2cccnc2)cc1)C1CC1	ZINC000819397981	CF	On-Demand	Anodyne	NAMPT	52	39
O[C@@H](CNc1ccc(OC(F)F)c(Cl)c1)COc1ccccc1F	ZINC000819397982	FH	On-Demand	Anodyne	ADRB1	48	34
CS(=O)(=O)Nc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819397996	GD	On-Demand	Anodyne	ADRB3	53	44
CS(=O)(=O)Nc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819397998	GD	On-Demand	Anodyne	ADRB3	53	44
CCCOc1ccccc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819397999	EG	On-Demand	Clean	EDNRB	35	40
CCCOc1ccccc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819397999	EG	On-Demand	Clean	EDNRA	37	42
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2ccccc2F)cc1	ZINC000819398000	FE	On-Demand	Anodyne	CHRNA7	15	45
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2ccccc2F)cc1	ZINC000819398000	FE	On-Demand	Anodyne	EPHX2	21	40
CCCOc1ccccc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819398001	EG	On-Demand	Clean	EDNRB	35	40
CCCOc1ccccc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819398001	EG	On-Demand	Clean	EDNRA	37	42
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2ccccc2F)cc1	ZINC000819398002	FE	On-Demand	Anodyne	CHRNA7	15	45
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2ccccc2F)cc1	ZINC000819398002	FE	On-Demand	Anodyne	EPHX2	21	40
COc1ccc(OCC(F)(F)C(F)F)c(C(=O)NCc2ccccc2O)c1	ZINC000819398031	GH	On-Demand	Clean	KCNK3	24	40
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)COc1cccc2[nH]ccc12	ZINC000819398040	GH	On-Demand	Anodyne	ADRB2	23	57
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)COc1cccc2[nH]ccc12	ZINC000819398040	GH	On-Demand	Anodyne	ADRB1	33	57
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)COc1cccc2[nH]ccc12	ZINC000819398040	GH	On-Demand	Anodyne	ADRB3	16	57
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)COc1cccc2[nH]ccc12	ZINC000819398040	GH	On-Demand	Anodyne	CYP2D6	17	43
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)COc1cccc2[nH]ccc12	ZINC000819398044	GH	On-Demand	Anodyne	ADRB2	23	57
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)COc1cccc2[nH]ccc12	ZINC000819398044	GH	On-Demand	Anodyne	ADRB1	33	57
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)COc1cccc2[nH]ccc12	ZINC000819398044	GH	On-Demand	Anodyne	ADRB3	16	57
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)COc1cccc2[nH]ccc12	ZINC000819398044	GH	On-Demand	Anodyne	CYP2D6	17	43
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819398045	GE	On-Demand	Anodyne	EPHX2	23	43
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819398049	GE	On-Demand	Anodyne	EPHX2	23	43
O=C1CCCN1c1ccc(NC[C@H](O)COCc2ccccc2F)cc1Cl	ZINC000819398083	GH	On-Demand	Anodyne	NPY2R	21	41
O=C1CCCN1c1ccc(NC[C@@H](O)COCc2ccccc2F)cc1Cl	ZINC000819398086	GH	On-Demand	Anodyne	NPY2R	21	41
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(OCC(F)(F)F)cc1	ZINC000819398092	GG	On-Demand	Bother	ADRB2	33	43
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(OCC(F)(F)F)cc1	ZINC000819398092	GG	On-Demand	Bother	ADRB1	51	37
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(OCC(F)(F)F)cc1	ZINC000819398092	GG	On-Demand	Bother	ADRB3	23	43
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(OCC(F)(F)F)cc1	ZINC000819398094	GG	On-Demand	Bother	ADRB2	33	43
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(OCC(F)(F)F)cc1	ZINC000819398094	GG	On-Demand	Bother	ADRB1	51	37
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(OCC(F)(F)F)cc1	ZINC000819398094	GG	On-Demand	Bother	ADRB3	23	43
O=C(CCNc1ccc(-c2nnc3n2CCCCCC3)cc1)Nc1ccccc1	ZINC000819398107	GJ	On-Demand	Anodyne	CHRNA7	22	47
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)c1ccccc1	ZINC000819398112	DH	On-Demand	Anodyne	ADRB2	19	50
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)c1ccccc1	ZINC000819398112	DH	On-Demand	Anodyne	ADRB3	23	42
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)c1ccccc1	ZINC000819398112	DH	On-Demand	Anodyne	AOC3	17	41
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)c1ccccc1	ZINC000819398114	DH	On-Demand	Anodyne	ADRB2	19	50
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)c1ccccc1	ZINC000819398114	DH	On-Demand	Anodyne	ADRB3	23	42
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)c1ccccc1	ZINC000819398114	DH	On-Demand	Anodyne	AOC3	17	41
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819398116	FE	On-Demand	Anodyne	LTA4H	24	43
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819398116	FE	On-Demand	Anodyne	CASR	51	39
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819398116	FE	On-Demand	Anodyne	EPHX2	23	45
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819398117	FE	On-Demand	Anodyne	LTA4H	24	43
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819398117	FE	On-Demand	Anodyne	CASR	51	39
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819398117	FE	On-Demand	Anodyne	EPHX2	23	45
O[C@H](CNc1ccc2c(c1)Cc1ccccc1-2)C1CC1	ZINC000819398120	CG	On-Demand	Anodyne	SLC1A1	23	45
O[C@H](CNc1ccc2c(c1)Cc1ccccc1-2)C1CC1	ZINC000819398120	CG	On-Demand	Anodyne	SLC1A3	28	45
O[C@H](CNc1ccc2c(c1)Cc1ccccc1-2)C1CC1	ZINC000819398120	CG	On-Demand	Anodyne	SLC1A2	22	45
O[C@@H](CNc1ccc2c(c1)Cc1ccccc1-2)C1CC1	ZINC000819398121	CG	On-Demand	Anodyne	SLC1A1	23	45
O[C@@H](CNc1ccc2c(c1)Cc1ccccc1-2)C1CC1	ZINC000819398121	CG	On-Demand	Anodyne	SLC1A3	28	45
O[C@@H](CNc1ccc2c(c1)Cc1ccccc1-2)C1CC1	ZINC000819398121	CG	On-Demand	Anodyne	SLC1A2	22	45
C=C(C)C(C)(C)C(=O)NCc1ccc(O)c(O)c1	ZINC000819398130	BE	On-Demand	Mild	TRPV1	18	43
COc1ccc(O)c(CNC(=O)[C@@H]2CCCO[C@@H]2C(C)C)c1	ZINC000819398132	DE	On-Demand	Clean	MTNR1A	41	41
COc1ccc(O)c(CNC(=O)[C@@H]2CCCO[C@@H]2C(C)C)c1	ZINC000819398132	DE	On-Demand	Clean	MTNR1B	29	41
O=C(N[C@@H]1CN(Cc2ccccc2)CC[C@H]1CO)C(F)=C1CCC1	ZINC000819398156	EE	On-Demand	Anodyne	DRD4	36	44
O=C(N[C@@H]1CN(Cc2ccccc2)CC[C@H]1CO)C(F)=C1CCC1	ZINC000819398156	EE	On-Demand	Anodyne	SLC6A1	53	32
O=C(N[C@@H]1CN(Cc2ccccc2)CC[C@H]1CO)C(F)=C1CCC1	ZINC000819398156	EE	On-Demand	Anodyne	SIGMAR1	41	43
O=C(N[C@@H]1CN(Cc2ccccc2)CC[C@H]1CO)C(F)=C1CCC1	ZINC000819398156	EE	On-Demand	Anodyne	SLC18A3	19	40
O=C(N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO)C(F)=C1CCC1	ZINC000819398157	EE	On-Demand	Anodyne	DRD4	36	44
O=C(N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO)C(F)=C1CCC1	ZINC000819398157	EE	On-Demand	Anodyne	SLC6A1	53	32
O=C(N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO)C(F)=C1CCC1	ZINC000819398157	EE	On-Demand	Anodyne	SIGMAR1	41	43
O=C(N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO)C(F)=C1CCC1	ZINC000819398157	EE	On-Demand	Anodyne	SLC18A3	19	40
O=C(N[C@H]1CN(Cc2ccccc2)CC[C@H]1CO)C(F)=C1CCC1	ZINC000819398158	EE	On-Demand	Anodyne	DRD4	36	44
O=C(N[C@H]1CN(Cc2ccccc2)CC[C@H]1CO)C(F)=C1CCC1	ZINC000819398158	EE	On-Demand	Anodyne	SLC6A1	53	32
O=C(N[C@H]1CN(Cc2ccccc2)CC[C@H]1CO)C(F)=C1CCC1	ZINC000819398158	EE	On-Demand	Anodyne	SIGMAR1	41	43
O=C(N[C@H]1CN(Cc2ccccc2)CC[C@H]1CO)C(F)=C1CCC1	ZINC000819398158	EE	On-Demand	Anodyne	SLC18A3	19	40
O=C(N[C@H]1CN(Cc2ccccc2)CC[C@@H]1CO)C(F)=C1CCC1	ZINC000819398160	EE	On-Demand	Anodyne	DRD4	36	44
O=C(N[C@H]1CN(Cc2ccccc2)CC[C@@H]1CO)C(F)=C1CCC1	ZINC000819398160	EE	On-Demand	Anodyne	SLC6A1	53	32
O=C(N[C@H]1CN(Cc2ccccc2)CC[C@@H]1CO)C(F)=C1CCC1	ZINC000819398160	EE	On-Demand	Anodyne	SIGMAR1	41	43
O=C(N[C@H]1CN(Cc2ccccc2)CC[C@@H]1CO)C(F)=C1CCC1	ZINC000819398160	EE	On-Demand	Anodyne	SLC18A3	19	40
C=C(Cl)CSc1nc(C)c(CC(=O)Nc2ccc(OC)c(CO)c2)s1	ZINC000819398168	GH	On-Demand	Mild	ENPP1	78	39
CON(C)C(=O)CCNc1ccc(NC(=O)CN2CCOCC2)cc1	ZINC000819398189	FC	On-Demand	Anodyne	EPHX2	22	40
O=C1CCCN1c1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1Cl	ZINC000819398210	GJ	On-Demand	Anodyne	NPY2R	28	40
O=C1CCCN1c1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1Cl	ZINC000819398212	GJ	On-Demand	Anodyne	NPY2R	28	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(F)=C1CCC1	ZINC000819398214	CF	On-Demand	Anodyne	OPRM1	16	40
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(F)=C1CCC1	ZINC000819398214	CF	On-Demand	Anodyne	GRIA1	51	35
C[C@@H](Cc1ccc(O)cc1)NC(=O)C(F)=C1CCC1	ZINC000819398214	CF	On-Demand	Anodyne	YARS	62	33
NC(=O)CCNc1ccc(OCC(F)(F)F)cc1	ZINC000819398216	CD	On-Demand	Anodyne	ACR	40	40
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3=O)c(Cl)c2)cc1	ZINC000819398219	FH	On-Demand	Anodyne	ADRB2	25	43
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCCC3=O)c(Cl)c2)cc1	ZINC000819398220	FH	On-Demand	Anodyne	ADRB2	25	43
CCOC[C@H](O)CNc1ccc(OCC(F)(F)F)cc1	ZINC000819398221	CE	On-Demand	Anodyne	ADRB2	25	40
CCO[C@@H]1C[C@H](NC(=O)/C=C/c2ccc(OC)c(O)c2)[C@@H]1n1cccn1	ZINC000819398228	FE	On-Demand	Anodyne	TUBB1	41	42
CCO[C@@H]1C[C@H](NC(=O)/C=C\c2ccc(OC)c(O)c2)[C@H]1n1cccn1	ZINC000819398229	FE	On-Demand	Anodyne	TUBB1	41	42
CCO[C@@H]1C[C@H](NC(=O)/C=C/c2ccc(OC)c(O)c2)[C@H]1n1cccn1	ZINC000819398230	FE	On-Demand	Anodyne	TUBB1	41	42
CCO[C@@H]1C[C@H](NC(=O)/C=C\c2ccc(OC)c(O)c2)[C@@H]1n1cccn1	ZINC000819398231	FE	On-Demand	Anodyne	TUBB1	41	42
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)[C@@H]1n1cccn1	ZINC000819398292	GF	On-Demand	Anodyne	CTSD	19	43
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)[C@@H]1n1cccn1	ZINC000819398292	GF	On-Demand	Anodyne	ECE1	39	43
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)[C@H]1n1cccn1	ZINC000819398293	GF	On-Demand	Anodyne	CTSD	19	43
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)[C@H]1n1cccn1	ZINC000819398293	GF	On-Demand	Anodyne	ECE1	39	43
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)[C@H](C)CC)[C@@H]1n1cccn1	ZINC000819398294	GF	On-Demand	Anodyne	CTSD	19	43
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)[C@H](C)CC)[C@@H]1n1cccn1	ZINC000819398294	GF	On-Demand	Anodyne	ECE1	39	43
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)[C@H]1n1cccn1	ZINC000819398295	GF	On-Demand	Anodyne	CTSD	19	43
CCO[C@@H]1C[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)[C@H]1n1cccn1	ZINC000819398295	GF	On-Demand	Anodyne	ECE1	39	43
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)[C@@H]1n1cccn1	ZINC000819398296	GF	On-Demand	Anodyne	CTSD	19	43
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)[C@@H]1n1cccn1	ZINC000819398296	GF	On-Demand	Anodyne	ECE1	39	43
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)[C@@H]1n1cccn1	ZINC000819398297	GF	On-Demand	Anodyne	CTSD	19	43
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)[C@@H]1n1cccn1	ZINC000819398297	GF	On-Demand	Anodyne	ECE1	39	43
O=C(Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1)C1CC1	ZINC000819398309	GI	On-Demand	Anodyne	GCGR	24	42
O=C(Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1)C1CC1	ZINC000819398309	GI	On-Demand	Anodyne	P2RY1	52	37
O=C(Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1)C1CC1	ZINC000819398309	GI	On-Demand	Anodyne	CTSS	19	46
O=C(Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1)C1CC1	ZINC000819398309	GI	On-Demand	Anodyne	EPHX2	59	47
O=C(Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1)C1CC1	ZINC000819398310	GI	On-Demand	Anodyne	GCGR	24	42
O=C(Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1)C1CC1	ZINC000819398310	GI	On-Demand	Anodyne	P2RY1	52	37
O=C(Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1)C1CC1	ZINC000819398310	GI	On-Demand	Anodyne	CTSS	19	46
O=C(Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1)C1CC1	ZINC000819398310	GI	On-Demand	Anodyne	EPHX2	59	47
O=C(Nc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1)C1CC1	ZINC000819398311	FI	On-Demand	Anodyne	DHODH	15	45
O=C(Nc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1)C1CC1	ZINC000819398311	FI	On-Demand	Anodyne	EPHX2	33	47
O=C(Nc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1)C1CC1	ZINC000819398312	FI	On-Demand	Anodyne	DHODH	15	45
O=C(Nc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1)C1CC1	ZINC000819398312	FI	On-Demand	Anodyne	EPHX2	33	47
COc1ccc(O)c([C@@H](C)NC(=O)c2cc(Br)oc2C)c1	ZINC000819398313	FH	On-Demand	Clean	THRA	56	38
COc1ccc(O)c([C@@H](C)NC(=O)c2cc(Br)oc2C)c1	ZINC000819398313	FH	On-Demand	Clean	THRB	63	39
COc1ccc(O)c([C@H](C)NC(=O)c2cc(Br)oc2C)c1	ZINC000819398314	FH	On-Demand	Clean	THRA	56	38
COc1ccc(O)c([C@H](C)NC(=O)c2cc(Br)oc2C)c1	ZINC000819398314	FH	On-Demand	Clean	THRB	63	39
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)[C@H](C)CC)[C@H]1n1cccn1	ZINC000819398317	GF	On-Demand	Anodyne	CTSD	19	43
CCO[C@@H]1C[C@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)[C@H](C)CC)[C@H]1n1cccn1	ZINC000819398317	GF	On-Demand	Anodyne	ECE1	39	43
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)[C@H]1n1cccn1	ZINC000819398321	GF	On-Demand	Anodyne	CTSD	19	43
CCO[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)CC)[C@H]1n1cccn1	ZINC000819398321	GF	On-Demand	Anodyne	ECE1	39	43
CCCOc1ccccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819398325	EH	On-Demand	Clean	ADRB2	28	62
CCCOc1ccccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819398325	EH	On-Demand	Clean	ADRB1	41	62
CCCOc1ccccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819398325	EH	On-Demand	Clean	ADRB3	15	62
CCCOc1ccccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819398325	EH	On-Demand	Clean	CYP2D6	21	46
CCCOc1ccccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819398326	EH	On-Demand	Clean	ADRB2	28	62
CCCOc1ccccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819398326	EH	On-Demand	Clean	ADRB1	41	62
CCCOc1ccccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819398326	EH	On-Demand	Clean	ADRB3	15	62
CCCOc1ccccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819398326	EH	On-Demand	Clean	CYP2D6	21	46
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(OC(F)F)c(Cl)c1	ZINC000819398331	GH	On-Demand	Bother	ADRB1	43	33
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(OC(F)F)c(Cl)c1	ZINC000819398334	GH	On-Demand	Bother	ADRB1	43	33
COc1ccc(O)c(CNC(=O)[C@@H]2CCCC[C@H]2C)c1	ZINC000819398341	CF	On-Demand	Clean	NQO2	32	41
COc1ccc(O)c(CNC(=O)[C@@H]2CCCC[C@H]2C)c1	ZINC000819398341	CF	On-Demand	Clean	MTNR1A	61	46
COc1ccc(O)c(CNC(=O)[C@@H]2CCCC[C@H]2C)c1	ZINC000819398341	CF	On-Demand	Clean	MTNR1B	47	46
COc1ccc(O)c(CNC(=O)[C@H]2CCCC[C@@H]2C)c1	ZINC000819398342	CF	On-Demand	Clean	NQO2	32	41
COc1ccc(O)c(CNC(=O)[C@H]2CCCC[C@@H]2C)c1	ZINC000819398342	CF	On-Demand	Clean	MTNR1A	61	46
COc1ccc(O)c(CNC(=O)[C@H]2CCCC[C@@H]2C)c1	ZINC000819398342	CF	On-Demand	Clean	MTNR1B	47	46
COc1ccc(O)c(CNC(=O)[C@H]2CCCC[C@H]2C)c1	ZINC000819398344	CF	On-Demand	Clean	NQO2	32	41
COc1ccc(O)c(CNC(=O)[C@H]2CCCC[C@H]2C)c1	ZINC000819398344	CF	On-Demand	Clean	MTNR1A	61	46
COc1ccc(O)c(CNC(=O)[C@H]2CCCC[C@H]2C)c1	ZINC000819398344	CF	On-Demand	Clean	MTNR1B	47	46
COc1ccc(O)c(CNC(=O)[C@@H]2CCCC[C@@H]2C)c1	ZINC000819398345	CF	On-Demand	Clean	NQO2	32	41
COc1ccc(O)c(CNC(=O)[C@@H]2CCCC[C@@H]2C)c1	ZINC000819398345	CF	On-Demand	Clean	MTNR1A	61	46
COc1ccc(O)c(CNC(=O)[C@@H]2CCCC[C@@H]2C)c1	ZINC000819398345	CF	On-Demand	Clean	MTNR1B	47	46
C#Cc1cccc(NC(=O)c2ccc(C=NOC)cc2)c1	ZINC000819398351	CF	On-Demand	Mild	TAAR1	50	39
C#Cc1cccc(NC(=O)c2ccc(C=NOC)cc2)c1	ZINC000819398351	CF	On-Demand	Mild	KCNK3	116	41
C#Cc1cccc(NC(=O)c2ccc(C=NOC)cc2)c1	ZINC000819398351	CF	On-Demand	Mild	KCNK9	75	38
CCCOc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819398362	EG	On-Demand	Mild	ADRB2	46	42
CCCOc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819398362	EG	On-Demand	Mild	ADRB1	71	36
CCCOc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819398362	EG	On-Demand	Mild	ADRB3	38	42
CCCOc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819398362	EG	On-Demand	Mild	CASR	45	41
CCCOc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819398362	EG	On-Demand	Mild	CYP2D6	18	41
CCO[C@@H]1C[C@@H](NC(=O)COc2ccc3c(C)cc(=O)oc3c2)[C@@H]1n1cccn1	ZINC000819398365	GE	On-Demand	Anodyne	MAOA	62	51
CCO[C@@H]1C[C@@H](NC(=O)COc2ccc3c(C)cc(=O)oc3c2)[C@@H]1n1cccn1	ZINC000819398365	GE	On-Demand	Anodyne	MAOB	38	51
CCO[C@@H]1C[C@H](NC(=O)COc2ccc3c(C)cc(=O)oc3c2)[C@@H]1n1cccn1	ZINC000819398366	GE	On-Demand	Anodyne	MAOA	62	51
CCO[C@@H]1C[C@H](NC(=O)COc2ccc3c(C)cc(=O)oc3c2)[C@@H]1n1cccn1	ZINC000819398366	GE	On-Demand	Anodyne	MAOB	38	51
CCO[C@@H]1C[C@@H](NC(=O)COc2ccc3c(C)cc(=O)oc3c2)[C@H]1n1cccn1	ZINC000819398368	GE	On-Demand	Anodyne	MAOA	62	51
CCO[C@@H]1C[C@@H](NC(=O)COc2ccc3c(C)cc(=O)oc3c2)[C@H]1n1cccn1	ZINC000819398368	GE	On-Demand	Anodyne	MAOB	38	51
C#Cc1cccc(NC(=O)c2cc(I)ccc2-n2cnnn2)c1	ZINC000819398370	HF	On-Demand	Mild	Q25615_ONCVO	57	36
CCCOc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819398371	EG	On-Demand	Mild	ADRB2	46	42
CCCOc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819398371	EG	On-Demand	Mild	ADRB1	71	36
CCCOc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819398371	EG	On-Demand	Mild	ADRB3	38	42
CCCOc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819398371	EG	On-Demand	Mild	CASR	45	41
CCCOc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819398371	EG	On-Demand	Mild	CYP2D6	18	41
CCO[C@@H]1C[C@H](NC(=O)COc2ccc3c(C)cc(=O)oc3c2)[C@H]1n1cccn1	ZINC000819398372	GE	On-Demand	Anodyne	MAOA	62	51
CCO[C@@H]1C[C@H](NC(=O)COc2ccc3c(C)cc(=O)oc3c2)[C@H]1n1cccn1	ZINC000819398372	GE	On-Demand	Anodyne	MAOB	38	51
CCCOc1ccccc1NC[C@H](O)COCc1ccccc1	ZINC000819398395	DG	On-Demand	Clean	ADRB2	26	42
CCCOc1ccccc1NC[C@H](O)COCc1ccccc1	ZINC000819398395	DG	On-Demand	Clean	ABCB1	19	42
CCCOc1ccccc1NC[C@@H](O)COCc1ccccc1	ZINC000819398398	DG	On-Demand	Clean	ADRB2	26	42
CCCOc1ccccc1NC[C@@H](O)COCc1ccccc1	ZINC000819398398	DG	On-Demand	Clean	ABCB1	19	42
CCCOc1ccccc1NCC1(O)CCC1	ZINC000819398402	BF	On-Demand	Anodyne	HCN1	43	32
CCCOc1ccccc1NCC1(O)CCC1	ZINC000819398402	BF	On-Demand	Anodyne	HCN4	40	31
CCCOc1ccccc1NC[C@H](O)COc1ccccc1F	ZINC000819398405	DG	On-Demand	Clean	ADRB2	28	45
CCCOc1ccccc1NC[C@H](O)COc1ccccc1F	ZINC000819398405	DG	On-Demand	Clean	ADRB1	61	42
CCCOc1ccccc1NC[C@@H](O)COc1ccccc1F	ZINC000819398408	DG	On-Demand	Clean	ADRB2	28	45
CCCOc1ccccc1NC[C@@H](O)COc1ccccc1F	ZINC000819398408	DG	On-Demand	Clean	ADRB1	61	42
O=C1CCCN1c1ccc(NC[C@H](O)c2ccccc2C(F)(F)F)cc1Cl	ZINC000819398412	GJ	On-Demand	Anodyne	NPY2R	36	40
O=C1CCCN1c1ccc(NC[C@@H](O)c2ccccc2C(F)(F)F)cc1Cl	ZINC000819398414	GJ	On-Demand	Anodyne	NPY2R	36	40
C#Cc1cccc(NC(=O)CS[C@@H](C)C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)c1	ZINC000819398416	IG	On-Demand	Mild	FPR2	52	42
C#Cc1cccc(NC(=O)CS[C@H](C)C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)c1	ZINC000819398417	IG	On-Demand	Mild	FPR2	52	42
O=C1CCCN1c1ccc(NC[C@H](O)COc2ccccc2F)cc1Cl	ZINC000819398421	GG	On-Demand	Anodyne	ADRB1	40	31
O=C1CCCN1c1ccc(NC[C@@H](O)COc2ccccc2F)cc1Cl	ZINC000819398423	GG	On-Demand	Anodyne	ADRB1	40	31
C#Cc1cccc(NC(=O)c2cc(C)n(C)c2C)c1	ZINC000819398424	CF	On-Demand	Mild	KCNK3	115	39
C#Cc1cccc(NC(=O)c2cc(C)n(C)c2C)c1	ZINC000819398424	CF	On-Demand	Mild	KCNK9	83	38
O[C@@H](CNc1cccc2c1CCCC2)c1cccnc1	ZINC000819398425	CG	On-Demand	Anodyne	ADRB1	22	41
O[C@@H](CNc1cccc2c1CCCC2)c1cccnc1	ZINC000819398425	CG	On-Demand	Anodyne	ADRB3	85	42
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(O)c1	ZINC000819398426	CE	On-Demand	Anodyne	KCNQ2	52	37
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(O)c1	ZINC000819398427	CE	On-Demand	Anodyne	KCNQ2	52	37
O[C@H](CNc1cccc2c1CCCC2)c1cccnc1	ZINC000819398428	CG	On-Demand	Anodyne	ADRB1	22	41
O[C@H](CNc1cccc2c1CCCC2)c1cccnc1	ZINC000819398428	CG	On-Demand	Anodyne	ADRB3	85	42
C=CCC1(C(=O)NCc2cc(OC)ccc2O)CCOCC1	ZINC000819398429	DE	On-Demand	Mild	MTNR1A	31	41
C=CCC1(C(=O)NCc2cc(OC)ccc2O)CCOCC1	ZINC000819398429	DE	On-Demand	Mild	MTNR1B	24	41
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(O)c1	ZINC000819398430	CE	On-Demand	Anodyne	KCNQ2	52	37
O=C(Nc1ccc(NC[C@H](O)c2ccccc2)cc1)C1CC1	ZINC000819398432	CG	On-Demand	Anodyne	ADRB1	17	40
O=C(Nc1ccc(NC[C@H](O)c2ccccc2)cc1)C1CC1	ZINC000819398432	CG	On-Demand	Anodyne	ADRB3	44	40
O=C(Nc1ccc(NC[C@H](O)c2ccccc2)cc1)C1CC1	ZINC000819398432	CG	On-Demand	Anodyne	LTA4H	15	40
O=C(Nc1ccc(NC[C@H](O)c2ccccc2)cc1)C1CC1	ZINC000819398432	CG	On-Demand	Anodyne	Q8WSF8_APLCA	25	42
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(O)c1	ZINC000819398434	CE	On-Demand	Anodyne	KCNQ2	52	37
O=C(Nc1ccc(NC[C@@H](O)c2ccccc2)cc1)C1CC1	ZINC000819398436	CG	On-Demand	Anodyne	ADRB1	17	40
O=C(Nc1ccc(NC[C@@H](O)c2ccccc2)cc1)C1CC1	ZINC000819398436	CG	On-Demand	Anodyne	ADRB3	44	40
O=C(Nc1ccc(NC[C@@H](O)c2ccccc2)cc1)C1CC1	ZINC000819398436	CG	On-Demand	Anodyne	LTA4H	15	40
O=C(Nc1ccc(NC[C@@H](O)c2ccccc2)cc1)C1CC1	ZINC000819398436	CG	On-Demand	Anodyne	Q8WSF8_APLCA	25	42
CC[C@H](O)CNc1ccc(-c2nnc3n2CCCCCC3)cc1	ZINC000819398439	DG	On-Demand	Anodyne	HSD11B2	15	42
C[C@@H](CCc1ccc(O)cc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819398453	EF	On-Demand	Anodyne	PAPA1_CARPA	35	45
C[C@@H](CCc1ccc(O)cc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819398453	EF	On-Demand	Anodyne	CTSK	20	46
C[C@@H](CCc1ccc(O)cc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819398453	EF	On-Demand	Anodyne	FPR1	45	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCNC(=O)c1cccc(O)c1)C2	ZINC000819398454	GD	On-Demand	Anodyne	DRD4	42	33
C[C@H](CCc1ccc(O)cc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819398456	EF	On-Demand	Anodyne	PAPA1_CARPA	35	45
C[C@H](CCc1ccc(O)cc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819398456	EF	On-Demand	Anodyne	CTSK	20	46
C[C@H](CCc1ccc(O)cc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819398456	EF	On-Demand	Anodyne	FPR1	45	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCNC(=O)c1cccc(O)c1)C2	ZINC000819398457	GD	On-Demand	Anodyne	DRD4	42	33
CCCOc1ccccc1NC[C@@H](O)Cc1ccccc1	ZINC000819398459	CG	On-Demand	Clean	ADRB2	19	41
CCCOc1ccccc1NC[C@@H](O)Cc1ccccc1	ZINC000819398459	CG	On-Demand	Clean	ADRB1	15	41
CCCOc1ccccc1NC[C@@H](O)Cc1ccccc1	ZINC000819398459	CG	On-Demand	Clean	ADRB3	15	41
CCCOc1ccccc1NC[C@@H](O)Cc1ccccc1	ZINC000819398459	CG	On-Demand	Clean	ABCB1	18	41
CCCOc1ccccc1NC[C@H](O)Cc1ccccc1	ZINC000819398461	CG	On-Demand	Clean	ADRB2	19	41
CCCOc1ccccc1NC[C@H](O)Cc1ccccc1	ZINC000819398461	CG	On-Demand	Clean	ADRB1	15	41
CCCOc1ccccc1NC[C@H](O)Cc1ccccc1	ZINC000819398461	CG	On-Demand	Clean	ADRB3	15	41
CCCOc1ccccc1NC[C@H](O)Cc1ccccc1	ZINC000819398461	CG	On-Demand	Clean	ABCB1	18	41
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NCC1(O)CCC1	ZINC000819398483	GI	On-Demand	Anodyne	HCN1	53	37
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NCC1(O)CCC1	ZINC000819398483	GI	On-Demand	Anodyne	HCN4	46	37
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NCC1(O)CCC1	ZINC000819398483	GI	On-Demand	Anodyne	KCNK3	61	40
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NCC1(O)CCC1	ZINC000819398483	GI	On-Demand	Anodyne	KCNK9	33	40
CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1OCCC	ZINC000819398519	EH	On-Demand	Anodyne	ADRB2	24	42
CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1OCCC	ZINC000819398519	EH	On-Demand	Anodyne	ADRB1	27	50
CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1OCCC	ZINC000819398519	EH	On-Demand	Anodyne	ADRB3	87	50
CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1OCCC	ZINC000819398522	EH	On-Demand	Anodyne	ADRB2	24	42
CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1OCCC	ZINC000819398522	EH	On-Demand	Anodyne	ADRB1	27	50
CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1OCCC	ZINC000819398522	EH	On-Demand	Anodyne	ADRB3	87	50
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2ccccc2Cl)cc1	ZINC000819398524	GF	On-Demand	Anodyne	EPHX2	20	40
COc1ccc(O)c([C@H](C)NC(=O)c2cn(-c3ccccc3)nc2C(C)C)c1	ZINC000819398526	GI	On-Demand	Clean	THRA	48	33
COc1ccc(O)c([C@H](C)NC(=O)c2cn(-c3ccccc3)nc2C(C)C)c1	ZINC000819398526	GI	On-Demand	Clean	THRB	48	33
COc1ccc(O)c([C@@H](C)NC(=O)c2cn(-c3ccccc3)nc2C(C)C)c1	ZINC000819398529	GI	On-Demand	Clean	THRA	48	33
COc1ccc(O)c([C@@H](C)NC(=O)c2cn(-c3ccccc3)nc2C(C)C)c1	ZINC000819398529	GI	On-Demand	Clean	THRB	48	33
COc1ccc(O)c(CNC(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)c1	ZINC000819398533	DG	On-Demand	Clean	MTNR1A	38	44
COc1ccc(O)c(CNC(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)c1	ZINC000819398533	DG	On-Demand	Clean	MTNR1B	27	44
CCCOc1ccccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819398535	EG	On-Demand	Clean	ADRB2	23	41
CCCOc1ccccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819398535	EG	On-Demand	Clean	ADRB1	59	35
CCCOc1ccccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819398535	EG	On-Demand	Clean	COLA	48	31
COc1ccc(O)c(CNC(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)c1	ZINC000819398537	DG	On-Demand	Clean	MTNR1A	38	44
COc1ccc(O)c(CNC(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)c1	ZINC000819398537	DG	On-Demand	Clean	MTNR1B	27	44
CCCOc1ccccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819398538	EG	On-Demand	Clean	ADRB2	23	41
CCCOc1ccccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819398538	EG	On-Demand	Clean	ADRB1	59	35
CCCOc1ccccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819398538	EG	On-Demand	Clean	COLA	48	31
COc1ccc(O)c(CNC(=O)[C@H]2C[C@H]2c2ccc(C)cc2)c1	ZINC000819398539	DG	On-Demand	Clean	MTNR1A	38	44
COc1ccc(O)c(CNC(=O)[C@H]2C[C@H]2c2ccc(C)cc2)c1	ZINC000819398539	DG	On-Demand	Clean	MTNR1B	27	44
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)COc1ccccc1	ZINC000819398541	EG	On-Demand	Anodyne	ADRB2	58	50
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)COc1ccccc1	ZINC000819398541	EG	On-Demand	Anodyne	ADRB1	78	47
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)COc1ccccc1	ZINC000819398541	EG	On-Demand	Anodyne	ADRB3	48	47
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)COc1ccccc1	ZINC000819398541	EG	On-Demand	Anodyne	PDS	43	37
COc1ccc(O)c(CNC(=O)[C@H]2C[C@@H]2c2ccc(C)cc2)c1	ZINC000819398542	DG	On-Demand	Clean	MTNR1A	38	44
COc1ccc(O)c(CNC(=O)[C@H]2C[C@@H]2c2ccc(C)cc2)c1	ZINC000819398542	DG	On-Demand	Clean	MTNR1B	27	44
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)COc1ccccc1	ZINC000819398544	EG	On-Demand	Anodyne	ADRB2	58	50
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)COc1ccccc1	ZINC000819398544	EG	On-Demand	Anodyne	ADRB1	78	47
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)COc1ccccc1	ZINC000819398544	EG	On-Demand	Anodyne	ADRB3	48	47
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)COc1ccccc1	ZINC000819398544	EG	On-Demand	Anodyne	PDS	43	37
C#Cc1cccc(NC(=O)C2CCN(c3ccc(S(=O)(=O)N4CCCCC4)cc3[N+](=O)[O-])CC2)c1	ZINC000819398571	JH	On-Demand	Mild	EPHX2	27	49
C#Cc1cccc(NC(=O)C2CCN(c3ccc(S(=O)(=O)N4CCCCC4)cc3[N+](=O)[O-])CC2)c1	ZINC000819398571	JH	On-Demand	Mild	TAAR1	16	44
COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCCC[C@H]2C)c1	ZINC000819398580	CG	On-Demand	Clean	THRB	43	32
COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCCC[C@H]2C)c1	ZINC000819398582	CG	On-Demand	Clean	THRB	43	32
COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCCC[C@@H]2C)c1	ZINC000819398584	CG	On-Demand	Clean	THRB	43	32
COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCCC[C@@H]2C)c1	ZINC000819398586	CG	On-Demand	Clean	THRB	43	32
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1ccc(NS(C)(=O)=O)cc1	ZINC000819398588	GD	On-Demand	Anodyne	TRPV1	22	41
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1ccc(NS(C)(=O)=O)cc1	ZINC000819398588	GD	On-Demand	Anodyne	PTPRB	60	37
COc1ccc(O)c([C@@H](C)NC(=O)c2cnc(OC)c(Br)c2)c1	ZINC000819398597	GG	On-Demand	Clean	THRA	40	41
COc1ccc(O)c([C@@H](C)NC(=O)c2cnc(OC)c(Br)c2)c1	ZINC000819398597	GG	On-Demand	Clean	THRB	46	41
COc1ccc(O)c([C@H](C)NC(=O)c2cnc(OC)c(Br)c2)c1	ZINC000819398600	GG	On-Demand	Clean	THRA	40	41
COc1ccc(O)c([C@H](C)NC(=O)c2cnc(OC)c(Br)c2)c1	ZINC000819398600	GG	On-Demand	Clean	THRB	46	41
CCCOc1ccc(NCCC(N)=O)cc1OCCC	ZINC000819398616	CF	On-Demand	Anodyne	DRTS_TRYCR	55	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccccc1O	ZINC000819398617	DD	On-Demand	Clean	FPR1	41	33
CCO[C@@H]1C[C@@H](NC(=O)c2ccc(Cl)nc2)[C@@H]1n1cccn1	ZINC000819398644	DE	On-Demand	Anodyne	SSTR5	22	42
CCO[C@@H]1C[C@H](NC(=O)c2ccc(Cl)nc2)[C@H]1n1cccn1	ZINC000819398645	DE	On-Demand	Anodyne	SSTR5	22	42
CCO[C@@H]1C[C@H](NC(=O)c2ccc(Cl)nc2)[C@@H]1n1cccn1	ZINC000819398646	DE	On-Demand	Anodyne	SSTR5	22	42
CCO[C@@H]1C[C@@H](NC(=O)c2ccc(Cl)nc2)[C@H]1n1cccn1	ZINC000819398647	DE	On-Demand	Anodyne	SSTR5	22	42
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819398660	GE	On-Demand	Anodyne	EPHX2	27	40
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819398661	GE	On-Demand	Anodyne	EPHX2	27	40
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819398662	GE	On-Demand	Anodyne	EPHX2	21	41
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819398663	GE	On-Demand	Anodyne	EPHX2	21	41
C=C(C)C(C)(C)C(=O)NCc1cc(OC)ccc1O	ZINC000819398667	CF	On-Demand	Mild	MTNR1A	67	51
C=C(C)C(C)(C)C(=O)NCc1cc(OC)ccc1O	ZINC000819398667	CF	On-Demand	Mild	MTNR1B	54	51
COc1ccc(O)c([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819398673	GG	On-Demand	Mild	PAPA1_CARPA	44	44
COc1ccc(O)c([C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819398673	GG	On-Demand	Mild	FPR1	43	38
COc1ccc(O)c([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819398678	GG	On-Demand	Mild	PAPA1_CARPA	44	44
COc1ccc(O)c([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819398678	GG	On-Demand	Mild	FPR1	43	38
COc1ccc(O)c([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819398680	GG	On-Demand	Mild	PAPA1_CARPA	44	44
COc1ccc(O)c([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819398680	GG	On-Demand	Mild	FPR1	43	38
COc1ccc(O)c([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819398682	GG	On-Demand	Mild	PAPA1_CARPA	44	44
COc1ccc(O)c([C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819398682	GG	On-Demand	Mild	FPR1	43	38
C[C@@H](CNc1ccc(-c2nnc3n2CCCCCC3)cc1)S(C)(=O)=O	ZINC000819398684	FF	On-Demand	Anodyne	HSD11B2	15	43
CCCOc1ccccc1NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819398705	DH	On-Demand	Anodyne	ADRB3	15	41
CCCOc1ccccc1NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819398706	DH	On-Demand	Anodyne	ADRB3	15	41
O=C(Nc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819398753	FI	On-Demand	Anodyne	SLC1A3	17	40
O=C(Nc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819398753	FI	On-Demand	Anodyne	CCR2	42	36
O=C(Nc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819398753	FI	On-Demand	Anodyne	EPHX2	24	41
O=C(Nc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819398753	FI	On-Demand	Anodyne	SLC1A2	24	40
O=C(Nc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819398756	FI	On-Demand	Anodyne	SLC1A3	17	40
O=C(Nc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819398756	FI	On-Demand	Anodyne	CCR2	42	36
O=C(Nc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819398756	FI	On-Demand	Anodyne	EPHX2	24	41
O=C(Nc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819398756	FI	On-Demand	Anodyne	SLC1A2	24	40
COc1ccc(O)c([C@@H](C)NC(=O)c2c(C)ccc(Br)c2OC)c1	ZINC000819398759	GH	On-Demand	Clean	THRA	60	39
COc1ccc(O)c([C@@H](C)NC(=O)c2c(C)ccc(Br)c2OC)c1	ZINC000819398759	GH	On-Demand	Clean	THRB	68	40
COc1ccc(O)c([C@H](C)NC(=O)c2c(C)ccc(Br)c2OC)c1	ZINC000819398762	GH	On-Demand	Clean	THRA	60	39
COc1ccc(O)c([C@H](C)NC(=O)c2c(C)ccc(Br)c2OC)c1	ZINC000819398762	GH	On-Demand	Clean	THRB	68	40
CS(=O)(=O)Nc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819398770	FG	On-Demand	Anodyne	ADRB2	36	40
CS(=O)(=O)Nc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819398770	FG	On-Demand	Anodyne	ADRB3	57	39
CS(=O)(=O)Nc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819398773	FG	On-Demand	Anodyne	ADRB2	36	40
CS(=O)(=O)Nc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819398773	FG	On-Demand	Anodyne	ADRB3	57	39
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(NC(=O)c2ccco2)cc1	ZINC000819398776	GG	On-Demand	Anodyne	NQO2	21	45
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(NC(=O)c2ccco2)cc1	ZINC000819398779	GG	On-Demand	Anodyne	NQO2	21	45
OC1(CNc2ccc(-c3nnc4n3CCCCCC4)cc2)CCCC1	ZINC000819398780	EH	On-Demand	Anodyne	HSD11B2	17	49
C[C@H](CCc1ccc(O)cc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819398783	CF	On-Demand	Anodyne	YARS	45	31
C[C@H](CCc1ccc(O)cc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819398786	CF	On-Demand	Anodyne	YARS	45	31
C[C@H](CCc1ccc(O)cc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819398788	CF	On-Demand	Anodyne	YARS	45	31
C[C@H](CCc1ccc(O)cc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819398791	CF	On-Demand	Anodyne	YARS	45	31
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2ccc(F)c(F)c2)CC1	ZINC000819398800	FH	On-Demand	Anodyne	F13A1	16	43
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2ccc(F)c(F)c2)CC1	ZINC000819398800	FH	On-Demand	Anodyne	GPR119	40	43
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2ccc(F)c(F)c2)CC1	ZINC000819398802	FH	On-Demand	Anodyne	F13A1	16	43
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2ccc(F)c(F)c2)CC1	ZINC000819398802	FH	On-Demand	Anodyne	GPR119	40	43
O=[N+]([O-])c1ccc([C@@H](O)CNc2ccc3c(c2)Cc2ccccc2-3)cc1	ZINC000819398819	EI	On-Demand	Bother	SLC1A1	18	42
O=[N+]([O-])c1ccc([C@@H](O)CNc2ccc3c(c2)Cc2ccccc2-3)cc1	ZINC000819398819	EI	On-Demand	Bother	SLC1A3	21	42
O=[N+]([O-])c1ccc([C@H](O)CNc2ccc3c(c2)Cc2ccccc2-3)cc1	ZINC000819398822	EI	On-Demand	Bother	SLC1A1	18	42
O=[N+]([O-])c1ccc([C@H](O)CNc2ccc3c(c2)Cc2ccccc2-3)cc1	ZINC000819398822	EI	On-Demand	Bother	SLC1A3	21	42
CCCOc1ccccc1NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819398844	EG	On-Demand	Anodyne	ADRB3	33	41
CCCOc1ccccc1NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819398847	EG	On-Demand	Anodyne	ADRB3	33	41
O=C(NCCCNC(=O)c1cccc(O)c1)C(F)=C1CCC1	ZINC000819398849	DE	On-Demand	Anodyne	DRD4	43	34
CCCOc1ccccc1NC[C@H](O)COC1CCOCC1	ZINC000819398850	DE	On-Demand	Clean	ADRB1	23	41
CCCOc1ccccc1NC[C@@H](O)COC1CCOCC1	ZINC000819398853	DE	On-Demand	Clean	ADRB1	23	41
O=C1CCCN1c1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1Cl	ZINC000819398861	GJ	On-Demand	Anodyne	NPY2R	35	41
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc(NS(C)(=O)=O)cc1	ZINC000819398863	FD	On-Demand	Anodyne	TRPV1	21	44
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc(NS(C)(=O)=O)cc1	ZINC000819398863	FD	On-Demand	Anodyne	PTPRB	50	43
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc(NS(C)(=O)=O)cc1	ZINC000819398866	FD	On-Demand	Anodyne	TRPV1	21	44
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc(NS(C)(=O)=O)cc1	ZINC000819398866	FD	On-Demand	Anodyne	PTPRB	50	43
O=C1CCCN1c1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1Cl	ZINC000819398872	GJ	On-Demand	Anodyne	NPY2R	35	41
O=C(NCc1ccccc1O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819398886	EH	On-Demand	Clean	P2RX7	52	38
CCCOc1ccccc1NCC1(O)CCS(=O)(=O)CC1	ZINC000819398921	DD	On-Demand	Anodyne	HCN1	44	34
CCCOc1ccccc1NCC1(O)CCS(=O)(=O)CC1	ZINC000819398921	DD	On-Demand	Anodyne	HCN4	40	31
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)COCc1ccccc1	ZINC000819398948	FH	On-Demand	Anodyne	ADRB1	42	39
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)COCc1ccccc1	ZINC000819398951	FH	On-Demand	Anodyne	ADRB1	42	39
CCCOc1ccccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819398954	EG	On-Demand	Clean	ADRB2	26	43
CCCOc1ccccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819398954	EG	On-Demand	Clean	ADRB1	44	45
CCCOc1ccccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819398954	EG	On-Demand	Clean	CACNA1C	41	36
CCCOc1ccccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819398954	EG	On-Demand	Clean	ADRB3	15	45
CCCOc1ccccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819398954	EG	On-Demand	Clean	CACNA1D	68	36
CCCOc1ccccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819398954	EG	On-Demand	Clean	PDS	46	48
CCCOc1ccccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819398956	EG	On-Demand	Clean	ADRB2	26	43
CCCOc1ccccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819398956	EG	On-Demand	Clean	ADRB1	44	45
CCCOc1ccccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819398956	EG	On-Demand	Clean	CACNA1C	41	36
CCCOc1ccccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819398956	EG	On-Demand	Clean	ADRB3	15	45
CCCOc1ccccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819398956	EG	On-Demand	Clean	CACNA1D	68	36
CCCOc1ccccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819398956	EG	On-Demand	Clean	PDS	46	48
O=C1CCCN1c1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1Cl	ZINC000819398963	FI	On-Demand	Anodyne	ADRB1	27	42
O=C1CCCN1c1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1Cl	ZINC000819398963	FI	On-Demand	Anodyne	ADRB3	40	53
O=C1CCCN1c1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1Cl	ZINC000819398963	FI	On-Demand	Anodyne	CYP3A4	46	34
O=C1CCCN1c1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1Cl	ZINC000819398964	FI	On-Demand	Anodyne	ADRB1	27	42
O=C1CCCN1c1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1Cl	ZINC000819398964	FI	On-Demand	Anodyne	ADRB3	40	53
O=C1CCCN1c1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1Cl	ZINC000819398964	FI	On-Demand	Anodyne	CYP3A4	46	34
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)CN1CCc2ccccc2C1	ZINC000819399008	GG	On-Demand	Anodyne	NOD1	16	41
O[C@H](CNc1ccc(OCC(F)(F)F)cc1)CN1CCc2ccccc2C1	ZINC000819399008	GG	On-Demand	Anodyne	NOD2	45	41
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)CN1CCc2ccccc2C1	ZINC000819399009	GG	On-Demand	Anodyne	NOD1	16	41
O[C@@H](CNc1ccc(OCC(F)(F)F)cc1)CN1CCc2ccccc2C1	ZINC000819399009	GG	On-Demand	Anodyne	NOD2	45	41
O=C(CCNc1ccc(N2CCCC2=O)c(Cl)c1)Nc1cccc(F)c1	ZINC000819399040	GI	On-Demand	Anodyne	NPY2R	50	46
N#CCc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)(F)F)cc2)cc1	ZINC000819399054	GH	On-Demand	Mild	ADRB2	33	41
N#CCc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)(F)F)cc2)cc1	ZINC000819399054	GH	On-Demand	Mild	ADRB1	54	39
N#CCc1ccc(OC[C@H](O)CNc2ccc(OCC(F)(F)F)cc2)cc1	ZINC000819399055	GH	On-Demand	Mild	ADRB2	33	41
N#CCc1ccc(OC[C@H](O)CNc2ccc(OCC(F)(F)F)cc2)cc1	ZINC000819399055	GH	On-Demand	Mild	ADRB1	54	39
COc1ccc(O)c([C@@H](C)NC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819399093	FH	On-Demand	Clean	THRB	42	37
COc1ccc(O)c([C@@H](C)NC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819399093	FH	On-Demand	Clean	MTNR1A	46	44
COc1ccc(O)c([C@@H](C)NC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819399093	FH	On-Demand	Clean	MTNR1B	43	44
COc1ccc(O)c([C@H](C)NC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819399094	FH	On-Demand	Clean	THRB	42	37
COc1ccc(O)c([C@H](C)NC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819399094	FH	On-Demand	Clean	MTNR1A	46	44
COc1ccc(O)c([C@H](C)NC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819399094	FH	On-Demand	Clean	MTNR1B	43	44
COc1ccc(O)c(CNC(=O)C(F)=C2CCC2)c1	ZINC000819399106	CE	On-Demand	Clean	MTNR1A	57	47
COc1ccc(O)c(CNC(=O)C(F)=C2CCC2)c1	ZINC000819399106	CE	On-Demand	Clean	MTNR1B	45	47
O=C(CCNc1ccc(-c2nnc3n2CCCCCC3)cc1)Nc1cccnc1	ZINC000819399141	GH	On-Demand	Anodyne	CHRNA7	25	47
Cc1ccccc1[C@@H](O)CNc1ccc(NC(=O)CN2CCOCC2)cc1	ZINC000819399145	FE	On-Demand	Anodyne	EPHX2	17	40
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819399187	FD	On-Demand	Anodyne	ADRB2	22	43
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819399187	FD	On-Demand	Anodyne	ADRB1	24	43
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819399187	FD	On-Demand	Anodyne	ADRB3	93	51
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819399187	FD	On-Demand	Anodyne	CASR	45	46
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819399187	FD	On-Demand	Anodyne	PIK3CA	22	42
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819399187	FD	On-Demand	Anodyne	CHRNA7	21	56
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819399187	FD	On-Demand	Anodyne	MTOR	36	42
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819399187	FD	On-Demand	Anodyne	EPHX2	18	40
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819399187	FD	On-Demand	Anodyne	PIK3CG	16	42
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819399187	FD	On-Demand	Anodyne	NAMPT	32	40
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819399189	FD	On-Demand	Anodyne	ADRB2	22	43
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819399189	FD	On-Demand	Anodyne	ADRB1	24	43
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819399189	FD	On-Demand	Anodyne	ADRB3	93	51
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819399189	FD	On-Demand	Anodyne	CASR	45	46
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819399189	FD	On-Demand	Anodyne	PIK3CA	22	42
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819399189	FD	On-Demand	Anodyne	CHRNA7	21	56
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819399189	FD	On-Demand	Anodyne	MTOR	36	42
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819399189	FD	On-Demand	Anodyne	EPHX2	18	40
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819399189	FD	On-Demand	Anodyne	PIK3CG	16	42
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819399189	FD	On-Demand	Anodyne	NAMPT	32	40
COc1ccc(O)c(CNC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819399190	FG	On-Demand	Clean	THRA	28	43
COc1ccc(O)c(CNC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819399190	FG	On-Demand	Clean	THRB	32	43
COc1ccc(O)c(CNC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819399190	FG	On-Demand	Clean	PLA2G4A	24	41
COc1ccc(O)c(CNC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819399190	FG	On-Demand	Clean	MTNR1A	85	48
COc1ccc(O)c(CNC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819399190	FG	On-Demand	Clean	MTNR1B	76	48
O[C@@H](CNc1ccc2nc(N3CCCC3)sc2c1)c1cccnc1	ZINC000819399201	EG	On-Demand	Anodyne	ADRB3	87	45
O[C@H](CNc1ccc2nc(N3CCCC3)sc2c1)c1cccnc1	ZINC000819399205	EG	On-Demand	Anodyne	ADRB3	87	45
OC1(CNc2ccc(-c3nnc4n3CCCCCC4)cc2)CCOCC1	ZINC000819399231	FG	On-Demand	Anodyne	HSD11B2	15	43
CON(C)C(=O)CCNc1ccc2c(c1)Cc1ccccc1-2	ZINC000819399252	CG	On-Demand	Anodyne	SLC1A1	19	44
CON(C)C(=O)CCNc1ccc2c(c1)Cc1ccccc1-2	ZINC000819399252	CG	On-Demand	Anodyne	SLC1A3	23	44
COc1ccc(O)c([C@@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819399254	CF	On-Demand	Clean	THRA	53	41
COc1ccc(O)c([C@@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819399254	CF	On-Demand	Clean	THRB	65	41
COc1ccc(O)c([C@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819399257	CF	On-Demand	Clean	THRA	53	41
COc1ccc(O)c([C@H](C)NC(=O)C(F)=C2CCC2)c1	ZINC000819399257	CF	On-Demand	Clean	THRB	65	41
COc1cccc([S@](=O)CC(=O)N2CCCC[C@H]2CS(N)(=O)=O)c1	ZINC000819399261	FC	On-Demand	Anodyne	FKBP1A	33	40
COc1cccc([S@](=O)CC(=O)N2CCCC[C@H]2CS(N)(=O)=O)c1	ZINC000819399261	FC	On-Demand	Anodyne	CPT1A	49	36
CCCOc1ccccc1NC[C@H](O)CN1CCOCC1	ZINC000819399267	CD	On-Demand	Clean	ABCB1	48	41
CCCOc1ccccc1NC[C@@H](O)CN1CCOCC1	ZINC000819399269	CD	On-Demand	Clean	ABCB1	48	41
COc1cccc([S@@](=O)CC(=O)N2CCCC[C@H]2CS(N)(=O)=O)c1	ZINC000819399272	FC	On-Demand	Anodyne	FKBP1A	33	40
COc1cccc([S@@](=O)CC(=O)N2CCCC[C@H]2CS(N)(=O)=O)c1	ZINC000819399272	FC	On-Demand	Anodyne	CPT1A	49	36
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC(F)F)c(Cl)c2)c1	ZINC000819399273	GH	On-Demand	Anodyne	ADRB2	22	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC(F)F)c(Cl)c2)c1	ZINC000819399273	GH	On-Demand	Anodyne	PDS	62	38
COc1cccc([S@](=O)CC(=O)N2CCCC[C@@H]2CS(N)(=O)=O)c1	ZINC000819399275	FC	On-Demand	Anodyne	FKBP1A	33	40
COc1cccc([S@](=O)CC(=O)N2CCCC[C@@H]2CS(N)(=O)=O)c1	ZINC000819399275	FC	On-Demand	Anodyne	CPT1A	49	36
COc1cccc([S@@](=O)CC(=O)N2CCCC[C@@H]2CS(N)(=O)=O)c1	ZINC000819399276	FC	On-Demand	Anodyne	FKBP1A	33	40
COc1cccc([S@@](=O)CC(=O)N2CCCC[C@@H]2CS(N)(=O)=O)c1	ZINC000819399276	FC	On-Demand	Anodyne	CPT1A	49	36
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC(F)F)c(Cl)c2)c1	ZINC000819399279	GH	On-Demand	Anodyne	ADRB2	22	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC(F)F)c(Cl)c2)c1	ZINC000819399279	GH	On-Demand	Anodyne	PDS	62	38
CS(=O)(=O)Nc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819399307	FG	On-Demand	Anodyne	ADRB3	38	41
CS(=O)(=O)Nc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819399307	FG	On-Demand	Anodyne	TRPV1	32	46
CS(=O)(=O)Nc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819399309	FG	On-Demand	Anodyne	ADRB3	38	41
CS(=O)(=O)Nc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819399309	FG	On-Demand	Anodyne	TRPV1	32	46
O[C@@H](CNc1ccc(N2CCOCC2)c2ccncc12)c1cccc(Cl)c1	ZINC000819399316	GH	On-Demand	Anodyne	IGF1R	30	45
O[C@@H](CNc1ccc(N2CCOCC2)c2ccncc12)c1cccc(Cl)c1	ZINC000819399316	GH	On-Demand	Anodyne	CYP3A4	51	40
O[C@H](CNc1ccc(N2CCOCC2)c2ccncc12)c1cccc(Cl)c1	ZINC000819399318	GH	On-Demand	Anodyne	IGF1R	30	45
O[C@H](CNc1ccc(N2CCOCC2)c2ccncc12)c1cccc(Cl)c1	ZINC000819399318	GH	On-Demand	Anodyne	CYP3A4	51	40
CC(=O)Nc1cccc(CC(=O)N2CCCC[C@H]2CS(N)(=O)=O)c1	ZINC000819399321	FC	On-Demand	Anodyne	OPRK1	26	47
CC(=O)Nc1cccc(CC(=O)N2CCCC[C@H]2CS(N)(=O)=O)c1	ZINC000819399321	FC	On-Demand	Anodyne	CPT1A	18	44
CC(=O)Nc1cccc(CC(=O)N2CCCC[C@@H]2CS(N)(=O)=O)c1	ZINC000819399323	FC	On-Demand	Anodyne	OPRK1	26	47
CC(=O)Nc1cccc(CC(=O)N2CCCC[C@@H]2CS(N)(=O)=O)c1	ZINC000819399323	FC	On-Demand	Anodyne	CPT1A	18	44
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)c1	ZINC000819399336	FJ	On-Demand	Mild	F10	48	55
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)c1	ZINC000819399336	FJ	On-Demand	Mild	PRNP	17	48
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)c1	ZINC000819399336	FJ	On-Demand	Mild	GRM4	31	40
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)c1	ZINC000819399336	FJ	On-Demand	Mild	NR1H4	22	61
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)c1	ZINC000819399336	FJ	On-Demand	Mild	HDAC1	22	52
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)c1	ZINC000819399336	FJ	On-Demand	Mild	KCNMA1	17	40
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)c1	ZINC000819399336	FJ	On-Demand	Mild	TAAR1	42	42
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)c1	ZINC000819399336	FJ	On-Demand	Mild	AKR1C3	15	42
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)c1	ZINC000819399336	FJ	On-Demand	Mild	NR2E3	70	43
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)c1	ZINC000819399336	FJ	On-Demand	Mild	SHH	18	40
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)c1	ZINC000819399336	FJ	On-Demand	Mild	SMO	25	45
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)c1	ZINC000819399336	FJ	On-Demand	Mild	Q25615_ONCVO	51	36
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)c1	ZINC000819399336	FJ	On-Demand	Mild	KCNK3	128	54
C#Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)c1	ZINC000819399336	FJ	On-Demand	Mild	KCNK9	85	39
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@H](C)O	ZINC000819399386	FH	On-Demand	Anodyne	PRNP	58	33
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@H](C)O	ZINC000819399386	FH	On-Demand	Anodyne	CCR8	31	40
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@H](C)O	ZINC000819399386	FH	On-Demand	Anodyne	GPR35	42	38
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@H](C)O	ZINC000819399386	FH	On-Demand	Anodyne	KCNK3	66	41
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@H](C)O	ZINC000819399386	FH	On-Demand	Anodyne	KCNK9	42	41
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@@H](C)O	ZINC000819399387	FH	On-Demand	Anodyne	PRNP	58	33
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@@H](C)O	ZINC000819399387	FH	On-Demand	Anodyne	CCR8	31	40
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@@H](C)O	ZINC000819399387	FH	On-Demand	Anodyne	GPR35	42	38
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@@H](C)O	ZINC000819399387	FH	On-Demand	Anodyne	KCNK3	66	41
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC[C@@H](C)O	ZINC000819399387	FH	On-Demand	Anodyne	KCNK9	42	41
CCCOc1ccccc1NC[C@@H](O)COC	ZINC000819399396	BD	On-Demand	Clean	ADRB2	29	43
CCCOc1ccccc1NC[C@H](O)COC	ZINC000819399397	BD	On-Demand	Clean	ADRB2	29	43
CCCOc1ccccc1NC[C@H](O)c1ccc(C#N)cc1	ZINC000819399400	CG	On-Demand	Mild	CTRB_BOVIN	51	36
CCCOc1ccccc1NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819399401	CG	On-Demand	Mild	CTRB_BOVIN	51	36
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NCC1(O)CCCC1	ZINC000819399405	GI	On-Demand	Anodyne	HCN1	60	39
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NCC1(O)CCCC1	ZINC000819399405	GI	On-Demand	Anodyne	HCN4	49	39
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NCC1(O)CCCC1	ZINC000819399405	GI	On-Demand	Anodyne	KCNK3	61	40
CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NCC1(O)CCCC1	ZINC000819399405	GI	On-Demand	Anodyne	KCNK9	33	40
CCCOc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819399411	EG	On-Demand	Mild	ADRB2	40	43
CCCOc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819399411	EG	On-Demand	Mild	ADRB1	70	39
CCCOc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819399411	EG	On-Demand	Mild	ADRB3	23	42
CCCOc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819399411	EG	On-Demand	Mild	CASR	44	41
CCCOc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819399411	EG	On-Demand	Mild	CYP2D6	23	42
CCCOc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819399411	EG	On-Demand	Mild	CTRB_BOVIN	47	34
CCCOc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819399412	EG	On-Demand	Mild	ADRB2	40	43
CCCOc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819399412	EG	On-Demand	Mild	ADRB1	70	39
CCCOc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819399412	EG	On-Demand	Mild	ADRB3	23	42
CCCOc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819399412	EG	On-Demand	Mild	CASR	44	41
CCCOc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819399412	EG	On-Demand	Mild	CYP2D6	23	42
CCCOc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819399412	EG	On-Demand	Mild	CTRB_BOVIN	47	34
CCCOc1ccccc1NC[C@H](O)c1cccc(F)c1	ZINC000819399429	CH	On-Demand	Anodyne	ADRB1	16	43
CCCOc1ccccc1NC[C@H](O)c1cccc(F)c1	ZINC000819399429	CH	On-Demand	Anodyne	ADRB3	33	43
CCCOc1ccccc1NC[C@@H](O)c1cccc(F)c1	ZINC000819399430	CH	On-Demand	Anodyne	ADRB1	16	43
CCCOc1ccccc1NC[C@@H](O)c1cccc(F)c1	ZINC000819399430	CH	On-Demand	Anodyne	ADRB3	33	43
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819399450	GE	On-Demand	Anodyne	EPHX2	22	41
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819399451	GE	On-Demand	Anodyne	EPHX2	22	41
COc1ccc(O)c(CNC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819399461	CD	On-Demand	Clean	MTNR1A	30	41
COc1ccc(O)c(CNC(=O)/C=C/[C@H]2CCCO2)c1	ZINC000819399461	CD	On-Demand	Clean	MTNR1B	19	41
COc1ccc(O)c(CNC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819399462	CD	On-Demand	Clean	MTNR1A	30	41
COc1ccc(O)c(CNC(=O)/C=C\[C@@H]2CCCO2)c1	ZINC000819399462	CD	On-Demand	Clean	MTNR1B	19	41
COc1ccc(O)c(CNC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819399463	CD	On-Demand	Clean	MTNR1A	30	41
COc1ccc(O)c(CNC(=O)/C=C/[C@@H]2CCCO2)c1	ZINC000819399463	CD	On-Demand	Clean	MTNR1B	19	41
COc1ccc(O)c(CNC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819399464	CD	On-Demand	Clean	MTNR1A	30	41
COc1ccc(O)c(CNC(=O)/C=C\[C@H]2CCCO2)c1	ZINC000819399464	CD	On-Demand	Clean	MTNR1B	19	41
O=C(Nc1ccc(NC[C@H](O)c2ccccc2Cl)cc1)C1CC1	ZINC000819399465	EH	On-Demand	Anodyne	OPRL1	30	42
C#Cc1cccc(NC(=O)c2cc(C)n(C(C)C)c2C)c1	ZINC000819399472	CH	On-Demand	Mild	KCNK3	102	39
C#Cc1cccc(NC(=O)c2cc(C)n(C(C)C)c2C)c1	ZINC000819399472	CH	On-Demand	Mild	KCNK9	80	37
COc1ccc(O)c(CNC(=O)c2cc3c(cn2)OCCO3)c1	ZINC000819399496	DD	On-Demand	Clean	MTNR1A	31	41
COc1ccc(O)c(CNC(=O)c2cc3c(cn2)OCCO3)c1	ZINC000819399496	DD	On-Demand	Clean	MTNR1B	19	41
COc1cccc([S@@](=O)CC(=O)NCc2c(O)ccc3c2CCCC3)c1	ZINC000819399500	FF	On-Demand	Clean	DRD4	41	31
COc1ccc(O)c([C@H](C)NC(=O)C[C@@H](C)n2cccn2)c1	ZINC000819399512	DE	On-Demand	Clean	THRB	46	33
COc1ccc(O)c([C@@H](C)NC(=O)C[C@H](C)n2cccn2)c1	ZINC000819399514	DE	On-Demand	Clean	THRB	46	33
COc1ccc(O)c([C@H](C)NC(=O)C[C@H](C)n2cccn2)c1	ZINC000819399516	DE	On-Demand	Clean	THRB	46	33
COc1ccc(O)c([C@@H](C)NC(=O)C[C@@H](C)n2cccn2)c1	ZINC000819399517	DE	On-Demand	Clean	THRB	46	33
CN(C[C@@H](O)CNc1ccc(NS(C)(=O)=O)cc1)C(=O)OC(C)(C)C	ZINC000819399519	FD	On-Demand	Anodyne	PTPRB	40	35
CN(C[C@H](O)CNc1ccc(NS(C)(=O)=O)cc1)C(=O)OC(C)(C)C	ZINC000819399521	FD	On-Demand	Anodyne	PTPRB	40	35
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819399527	FE	On-Demand	Anodyne	EPHX2	22	45
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819399529	FE	On-Demand	Anodyne	EPHX2	22	45
NS(=O)(=O)C[C@@H]1CCCCN1C(=O)c1cc(-c2ccc3ccccc3c2)[nH]n1	ZINC000819399531	GF	On-Demand	Anodyne	CPT1A	85	36
NS(=O)(=O)C[C@H]1CCCCN1C(=O)c1cc(-c2ccc3ccccc3c2)[nH]n1	ZINC000819399533	GF	On-Demand	Anodyne	CPT1A	85	36
COc1ccc(O)c(CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819399556	ED	On-Demand	Clean	MTNR1A	33	41
COc1ccc(O)c(CNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819399556	ED	On-Demand	Clean	MTNR1B	23	41
CCO[C@@H]1C[C@H](NC(=O)/C=C(/C)c2cccc(C(F)(F)F)c2)[C@H]1n1cccn1	ZINC000819399571	GH	On-Demand	Anodyne	CCR2	49	40
CCO[C@@H]1C[C@H](NC(=O)/C=C(\C)c2cccc(C(F)(F)F)c2)[C@@H]1n1cccn1	ZINC000819399572	GH	On-Demand	Anodyne	CCR2	49	40
CCO[C@@H]1C[C@H](NC(=O)/C=C(/C)c2cccc(C(F)(F)F)c2)[C@@H]1n1cccn1	ZINC000819399573	GH	On-Demand	Anodyne	CCR2	49	40
O=C(C(F)=C1CCC1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000819399619	DG	On-Demand	Bother	CACNA1D	43	32
CCCOc1ccccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819399750	FG	On-Demand	Clean	ADRB2	54	57
CCCOc1ccccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819399750	FG	On-Demand	Clean	ADRB1	87	57
CCCOc1ccccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819399750	FG	On-Demand	Clean	ADRB3	54	49
CCCOc1ccccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819399750	FG	On-Demand	Clean	FAAH	20	41
CCCOc1ccccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819399750	FG	On-Demand	Clean	ABCB1	19	40
CCCOc1ccccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819399751	FG	On-Demand	Clean	ADRB2	54	57
CCCOc1ccccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819399751	FG	On-Demand	Clean	ADRB1	87	57
CCCOc1ccccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819399751	FG	On-Demand	Clean	ADRB3	54	49
CCCOc1ccccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819399751	FG	On-Demand	Clean	FAAH	20	41
CCCOc1ccccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819399751	FG	On-Demand	Clean	ABCB1	19	40
COc1cc2c(cc1NC[C@H](C)S(C)(=O)=O)oc1ccccc12	ZINC000819399772	EG	On-Demand	Clean	MMP12	50	36
CCCOc1ccccc1NC[C@H](O)COCC(C)C	ZINC000819399780	CF	On-Demand	Clean	ADRB2	28	43
CCCOc1ccccc1NC[C@@H](O)COCC(C)C	ZINC000819399781	CF	On-Demand	Clean	ADRB2	28	43
CCCOc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819399790	CG	On-Demand	Anodyne	ADRB2	18	43
CCCOc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819399790	CG	On-Demand	Anodyne	ADRB1	23	52
CCCOc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819399790	CG	On-Demand	Anodyne	ADRB3	70	52
CCCOc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819399791	CG	On-Demand	Anodyne	ADRB2	18	43
CCCOc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819399791	CG	On-Demand	Anodyne	ADRB1	23	52
CCCOc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819399791	CG	On-Demand	Anodyne	ADRB3	70	52
CCCOc1ccccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819399804	GH	On-Demand	Anodyne	CCR8	42	40
CCCOc1ccccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819399804	GH	On-Demand	Anodyne	GPR119	53	48
CCCOc1ccccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819399805	GH	On-Demand	Anodyne	CCR8	42	40
CCCOc1ccccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819399805	GH	On-Demand	Anodyne	GPR119	53	48
C#Cc1cccc(NC(=O)[C@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)c1	ZINC000819399819	HH	On-Demand	Mild	F2	21	41
C#Cc1cccc(NC(=O)[C@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)c1	ZINC000819399819	HH	On-Demand	Mild	MMP13	48	63
C#Cc1cccc(NC(=O)[C@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)c1	ZINC000819399819	HH	On-Demand	Mild	TRY2_BOVIN	67	37
C#Cc1cccc(NC(=O)[C@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)c1	ZINC000819399819	HH	On-Demand	Mild	MMP2	30	63
C#Cc1cccc(NC(=O)[C@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)c1	ZINC000819399819	HH	On-Demand	Mild	MMP12	85	44
C#Cc1cccc(NC(=O)[C@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)c1	ZINC000819399819	HH	On-Demand	Mild	ADAMTS4	39	45
C#Cc1cccc(NC(=O)[C@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)c1	ZINC000819399819	HH	On-Demand	Mild	LEF	17	45
C#Cc1cccc(NC(=O)[C@@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)c1	ZINC000819399820	HH	On-Demand	Mild	F2	21	41
C#Cc1cccc(NC(=O)[C@@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)c1	ZINC000819399820	HH	On-Demand	Mild	MMP13	48	63
C#Cc1cccc(NC(=O)[C@@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)c1	ZINC000819399820	HH	On-Demand	Mild	TRY2_BOVIN	67	37
C#Cc1cccc(NC(=O)[C@@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)c1	ZINC000819399820	HH	On-Demand	Mild	MMP2	30	63
C#Cc1cccc(NC(=O)[C@@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)c1	ZINC000819399820	HH	On-Demand	Mild	MMP12	85	44
C#Cc1cccc(NC(=O)[C@@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)c1	ZINC000819399820	HH	On-Demand	Mild	ADAMTS4	39	45
C#Cc1cccc(NC(=O)[C@@H](NS(=O)(=O)c2ccc3ccccc3c2)C(C)C)c1	ZINC000819399820	HH	On-Demand	Mild	LEF	17	45
C#Cc1cccc(NC(=O)COc2ccc(S(=O)(=O)N(CC)CC)cc2[N+](=O)[O-])c1	ZINC000819399840	IF	On-Demand	Mild	MMP8	19	40
NS(=O)(=O)C[C@@H]1CCCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819399857	FC	On-Demand	Anodyne	OPRK1	19	52
NS(=O)(=O)C[C@H]1CCCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819399858	FC	On-Demand	Anodyne	OPRK1	19	52
OC1(CNc2ccc(-c3nnc4n3CCCCCC4)cc2)CCC1	ZINC000819399878	EG	On-Demand	Anodyne	HSD11B2	16	46
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819399898	FD	On-Demand	Anodyne	STAT6	43	33
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819399898	FD	On-Demand	Anodyne	SLC27A1	45	38
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819399899	FD	On-Demand	Anodyne	STAT6	43	33
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819399899	FD	On-Demand	Anodyne	SLC27A1	45	38
O=C(CN1CCOCC1)Nc1ccc(NC[C@H](O)C2CC2)cc1	ZINC000819399946	DD	On-Demand	Anodyne	MTOR	40	33
O=C(CN1CCOCC1)Nc1ccc(NC[C@@H](O)C2CC2)cc1	ZINC000819399948	DD	On-Demand	Anodyne	MTOR	40	33
COc1ccc(O)c(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819399950	GF	On-Demand	Mild	PAPA1_CARPA	52	49
COc1ccc(O)c(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819399950	GF	On-Demand	Mild	CTSL	22	48
COc1ccc(O)c(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819399950	GF	On-Demand	Mild	CTSS	16	53
COc1ccc(O)c(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819399951	GF	On-Demand	Mild	PAPA1_CARPA	52	49
COc1ccc(O)c(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819399951	GF	On-Demand	Mild	CTSL	22	48
COc1ccc(O)c(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819399951	GF	On-Demand	Mild	CTSS	16	53
COc1ccc(O)c(CNC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819399953	DH	On-Demand	Clean	MTNR1A	39	42
COc1ccc(O)c(CNC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819399953	DH	On-Demand	Clean	MTNR1B	31	42
CCO[C@@H]1C[C@H](NC(=O)[C@@H](F)Cc2ccccc2)[C@H]1n1cccn1	ZINC000819399970	EE	On-Demand	Anodyne	TIMP3	71	35
CCO[C@@H]1C[C@H](NC(=O)[C@@H](F)Cc2ccccc2)[C@@H]1n1cccn1	ZINC000819399971	EE	On-Demand	Anodyne	TIMP3	71	35
CCO[C@@H]1C[C@H](NC(=O)[C@H](F)Cc2ccccc2)[C@@H]1n1cccn1	ZINC000819399972	EE	On-Demand	Anodyne	TIMP3	71	35
CCO[C@@H]1C[C@H](NC(=O)[C@H](F)Cc2ccccc2)[C@H]1n1cccn1	ZINC000819399973	EE	On-Demand	Anodyne	TIMP3	71	35
C#Cc1cccc(NC(=O)c2cn(Cc3ccccc3)nc2-c2ccc(OC)c(OC)c2)c1	ZINC000819399979	IJ	On-Demand	Mild	TSHR	55	35
C#Cc1cccc(NC(=O)c2cn(Cc3ccccc3)nc2-c2ccc(OC)c(OC)c2)c1	ZINC000819399979	IJ	On-Demand	Mild	CPT1A	49	34
C#Cc1cccc(NC(=O)c2cn(Cc3ccccc3)nc2-c2ccc(OC)c(OC)c2)c1	ZINC000819399979	IJ	On-Demand	Mild	NR1H4	15	43
C#Cc1cccc(NC(=O)c2cn(Cc3ccccc3)nc2-c2ccc(OC)c(OC)c2)c1	ZINC000819399979	IJ	On-Demand	Mild	NR2E3	51	31
C#Cc1cccc(NC(=O)c2cn(Cc3ccccc3)nc2-c2ccc(OC)c(OC)c2)c1	ZINC000819399979	IJ	On-Demand	Mild	ENPP1	65	32
C#Cc1cccc(NC(=O)c2cn(Cc3ccccc3)nc2-c2ccc(OC)c(OC)c2)c1	ZINC000819399979	IJ	On-Demand	Mild	KCNK3	52	40
C#Cc1cccc(NC(=O)c2cn(Cc3ccccc3)nc2-c2ccc(OC)c(OC)c2)c1	ZINC000819399979	IJ	On-Demand	Mild	KCNK9	43	40
CCCOc1ccccc1NC[C@@H](O)COCC	ZINC000819399997	CE	On-Demand	Clean	ADRB2	27	43
CCCOc1ccccc1NC[C@H](O)COCC	ZINC000819399998	CE	On-Demand	Clean	ADRB2	27	43
O=C(/C=C/[C@@H]1CCCO1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000819399999	DF	On-Demand	Bother	CACNA1D	45	32
O=C(/C=C/[C@@H]1CCCO1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000819399999	DF	On-Demand	Bother	LUXR	17	44
O=C(/C=C\[C@H]1CCCO1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000819400002	DF	On-Demand	Bother	CACNA1D	45	32
O=C(/C=C\[C@H]1CCCO1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000819400002	DF	On-Demand	Bother	LUXR	17	44
O=C(/C=C\[C@@H]1CCCO1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000819400005	DF	On-Demand	Bother	CACNA1D	45	32
O=C(/C=C\[C@@H]1CCCO1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000819400005	DF	On-Demand	Bother	LUXR	17	44
O=C(/C=C/[C@H]1CCCO1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000819400007	DF	On-Demand	Bother	CACNA1D	45	32
O=C(/C=C/[C@H]1CCCO1)N(Cc1cccc([N+](=O)[O-])c1)C1CC1	ZINC000819400007	DF	On-Demand	Bother	LUXR	17	44
COC[C@@H](O)CNc1ccc(CC(=O)OC)cc1	ZINC000819400072	CC	On-Demand	Anodyne	ADRB1	30	40
C=C(Cl)CSc1nc(C)c(CC(=O)N[C@H]2c3ccccc3C[C@H]2O)s1	ZINC000819400100	GH	On-Demand	Mild	PLM2_PLAFA	81	36
C=C(Cl)CSc1nc(C)c(CC(=O)N[C@@H]2c3ccccc3C[C@H]2O)s1	ZINC000819400109	GH	On-Demand	Mild	PLM2_PLAFA	81	36
C=C(Cl)CSc1nc(C)c(CC(=O)N[C@@H]2c3ccccc3C[C@@H]2O)s1	ZINC000819400111	GH	On-Demand	Mild	PLM2_PLAFA	81	36
C=C(Cl)CSc1nc(C)c(CC(=O)N[C@H]2c3ccccc3C[C@@H]2O)s1	ZINC000819400113	GH	On-Demand	Mild	PLM2_PLAFA	81	36
O=C(NC[C@H]1CCCO1)Nc1ccc(NC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819400138	GG	On-Demand	Anodyne	TNK2	22	41
O=C(NC[C@H]1CCCO1)Nc1ccc(NC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819400140	GG	On-Demand	Anodyne	TNK2	22	41
CCO[C@@H]1C[C@@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)C(C)C)[C@@H]1n1cccn1	ZINC000819400192	GE	On-Demand	Anodyne	PGA5	22	40
CCO[C@@H]1C[C@@H](NC(=O)[C@H](NC(=O)OC(C)(C)C)C(C)C)[C@H]1n1cccn1	ZINC000819400193	GE	On-Demand	Anodyne	PGA5	22	40
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2C2CCN(C(=O)OC(C)(C)C)CC2)[C@H]1n1cccn1	ZINC000819400218	IG	On-Demand	Anodyne	GPR119	22	42
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2C2CCN(C(=O)OC(C)(C)C)CC2)[C@H]1n1cccn1	ZINC000819400221	IG	On-Demand	Anodyne	GPR119	22	42
O=C(NC[C@H]1CCCO1)Nc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819400222	FG	On-Demand	Anodyne	F7	16	40
CCO[C@@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2C2CCN(C(=O)OC(C)(C)C)CC2)[C@@H]1n1cccn1	ZINC000819400223	IG	On-Demand	Anodyne	GPR119	22	42
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2C2CCN(C(=O)OC(C)(C)C)CC2)[C@@H]1n1cccn1	ZINC000819400225	IG	On-Demand	Anodyne	GPR119	22	42
O=C(NC[C@H]1CCCO1)Nc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819400227	FG	On-Demand	Anodyne	F7	16	40
CCO[C@@H]1C[C@H](NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)[C@@H]1n1cccn1	ZINC000819400228	GD	On-Demand	Anodyne	CA6	17	41
CCO[C@@H]1C[C@H](NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)[C@@H]1n1cccn1	ZINC000819400228	GD	On-Demand	Anodyne	CA7	19	41
CCO[C@@H]1C[C@H](NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)[C@@H]1n1cccn1	ZINC000819400228	GD	On-Demand	Anodyne	CA13	36	41
CCO[C@@H]1C[C@H](NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)[C@H]1n1cccn1	ZINC000819400230	GD	On-Demand	Anodyne	CA6	17	41
CCO[C@@H]1C[C@H](NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)[C@H]1n1cccn1	ZINC000819400230	GD	On-Demand	Anodyne	CA7	19	41
CCO[C@@H]1C[C@H](NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)[C@H]1n1cccn1	ZINC000819400230	GD	On-Demand	Anodyne	CA13	36	41
CCO[C@@H]1C[C@@H](NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)[C@@H]1n1cccn1	ZINC000819400231	GD	On-Demand	Anodyne	CA6	17	41
CCO[C@@H]1C[C@@H](NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)[C@@H]1n1cccn1	ZINC000819400231	GD	On-Demand	Anodyne	CA7	19	41
CCO[C@@H]1C[C@@H](NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)[C@@H]1n1cccn1	ZINC000819400231	GD	On-Demand	Anodyne	CA13	36	41
CCO[C@@H]1C[C@@H](NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)[C@H]1n1cccn1	ZINC000819400232	GD	On-Demand	Anodyne	CA6	17	41
CCO[C@@H]1C[C@@H](NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)[C@H]1n1cccn1	ZINC000819400232	GD	On-Demand	Anodyne	CA7	19	41
CCO[C@@H]1C[C@@H](NC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)[C@H]1n1cccn1	ZINC000819400232	GD	On-Demand	Anodyne	CA13	36	41
C#Cc1cccc(NC(=O)CCc2cccc(OC)c2OC)c1	ZINC000819400255	DG	On-Demand	Mild	MTNR1A	19	41
C#Cc1cccc(NC(=O)CCc2cccc(OC)c2OC)c1	ZINC000819400255	DG	On-Demand	Mild	MTNR1B	18	41
C#Cc1cccc(NC(=O)c2ccc(CC(C)C)cc2)c1	ZINC000819400301	CI	On-Demand	Mild	TAAR1	49	38
C#Cc1cccc(NC(=O)c2ccc(CC(C)C)cc2)c1	ZINC000819400301	CI	On-Demand	Mild	KCNK3	121	41
C#Cc1cccc(NC(=O)c2ccc(CC(C)C)cc2)c1	ZINC000819400301	CI	On-Demand	Mild	KCNK9	78	40
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC)c(NC(C)=O)c2)cc1	ZINC000819400312	GE	On-Demand	Anodyne	ADRB2	46	52
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC)c(NC(C)=O)c2)cc1	ZINC000819400312	GE	On-Demand	Anodyne	ADRB1	70	52
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC)c(NC(C)=O)c2)cc1	ZINC000819400312	GE	On-Demand	Anodyne	TSHR	46	30
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC)c(NC(C)=O)c2)cc1	ZINC000819400312	GE	On-Demand	Anodyne	ADRB3	41	45
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC)c(NC(C)=O)c2)cc1	ZINC000819400312	GE	On-Demand	Anodyne	ACR	46	35
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC)c(NC(C)=O)c2)cc1	ZINC000819400313	GE	On-Demand	Anodyne	ADRB2	46	52
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC)c(NC(C)=O)c2)cc1	ZINC000819400313	GE	On-Demand	Anodyne	ADRB1	70	52
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC)c(NC(C)=O)c2)cc1	ZINC000819400313	GE	On-Demand	Anodyne	TSHR	46	30
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC)c(NC(C)=O)c2)cc1	ZINC000819400313	GE	On-Demand	Anodyne	ADRB3	41	45
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC)c(NC(C)=O)c2)cc1	ZINC000819400313	GE	On-Demand	Anodyne	ACR	46	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)C2	ZINC000819400463	GF	On-Demand	Bother	CACNA1C	40	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)C2	ZINC000819400463	GF	On-Demand	Bother	CACNA1D	61	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)C2	ZINC000819400464	GF	On-Demand	Bother	CACNA1C	40	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1)C2	ZINC000819400464	GF	On-Demand	Bother	CACNA1D	61	33
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)c(NC(C)=O)c2)cc1	ZINC000819400494	FF	On-Demand	Anodyne	ADRB2	47	53
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)c(NC(C)=O)c2)cc1	ZINC000819400494	FF	On-Demand	Anodyne	ADRB1	66	53
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)c(NC(C)=O)c2)cc1	ZINC000819400494	FF	On-Demand	Anodyne	TSHR	53	31
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)c(NC(C)=O)c2)cc1	ZINC000819400494	FF	On-Demand	Anodyne	ADRB3	40	44
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)c(NC(C)=O)c2)cc1	ZINC000819400495	FF	On-Demand	Anodyne	ADRB2	47	53
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)c(NC(C)=O)c2)cc1	ZINC000819400495	FF	On-Demand	Anodyne	ADRB1	66	53
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)c(NC(C)=O)c2)cc1	ZINC000819400495	FF	On-Demand	Anodyne	TSHR	53	31
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)c(NC(C)=O)c2)cc1	ZINC000819400495	FF	On-Demand	Anodyne	ADRB3	40	44
CC[C@H](O)CNc1ccc(OC)c(NC(C)=O)c1	ZINC000819400499	CD	On-Demand	Anodyne	DRTS_TRYCR	44	31
C=CCNC(=O)Nc1ccc(NCCS(=O)(=O)CC)cc1	ZINC000819400509	DD	On-Demand	Mild	P96878_MYCTU	40	34
O=C(NC[C@H]1CCCO1)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819400544	FF	On-Demand	Anodyne	ADRB2	18	44
O=C(NC[C@H]1CCCO1)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819400544	FF	On-Demand	Anodyne	ADRB1	18	44
O=C(NC[C@H]1CCCO1)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819400544	FF	On-Demand	Anodyne	ADRB3	83	44
O=C(NC[C@H]1CCCO1)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819400544	FF	On-Demand	Anodyne	NAMPT	40	39
O=C(NC[C@H]1CCCO1)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819400545	FF	On-Demand	Anodyne	ADRB2	18	44
O=C(NC[C@H]1CCCO1)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819400545	FF	On-Demand	Anodyne	ADRB1	18	44
O=C(NC[C@H]1CCCO1)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819400545	FF	On-Demand	Anodyne	ADRB3	83	44
O=C(NC[C@H]1CCCO1)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819400545	FF	On-Demand	Anodyne	NAMPT	40	39
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	CTSD	19	40
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	PGC	61	40
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	PAPA1_CARPA	66	47
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	CYSP_TRYCR	59	37
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	CCKAR	65	51
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	CTSK	25	46
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	CTSL	42	47
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	PGA	34	43
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	TIMP3	80	38
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	TACR3	15	42
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	CAPNS1	53	33
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	HLA-DRB1	39	41
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	REN	98	48
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	REN1	50	43
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	CCKBR	22	41
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	CTSS	18	47
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	CAPN1	41	45
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	CAPN2	51	36
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	FPR1	72	48
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400572	IF	On-Demand	Anodyne	CTRB_BOVIN	20	40
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	CTSD	19	40
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	PGC	61	40
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	PAPA1_CARPA	66	47
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	CYSP_TRYCR	59	37
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	CCKAR	65	51
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	CTSK	25	46
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	CTSL	42	47
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	PGA	34	43
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	TIMP3	80	38
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	TACR3	15	42
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	CAPNS1	53	33
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	HLA-DRB1	39	41
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	REN	98	48
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	REN1	50	43
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	CCKBR	22	41
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	CTSS	18	47
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	CAPN1	41	45
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	CAPN2	51	36
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	FPR1	72	48
CCO[C@@H]1C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400573	IF	On-Demand	Anodyne	CTRB_BOVIN	20	40
CCO[C@@H]1C[C@@H](NC(=O)CNC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819400618	FD	On-Demand	Anodyne	CAPN2	71	33
CCO[C@@H]1C[C@@H](NC(=O)CNC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819400618	FD	On-Demand	Anodyne	NPR	55	33
CCO[C@@H]1C[C@@H](NC(=O)CNC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819400618	FD	On-Demand	Anodyne	PSMB5	17	40
CCO[C@@H]1C[C@H](NC(=O)CNC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819400619	FD	On-Demand	Anodyne	CAPN2	71	33
CCO[C@@H]1C[C@H](NC(=O)CNC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819400619	FD	On-Demand	Anodyne	NPR	55	33
CCO[C@@H]1C[C@H](NC(=O)CNC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819400619	FD	On-Demand	Anodyne	PSMB5	17	40
CCO[C@@H]1C[C@H](NC(=O)CNC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819400620	FD	On-Demand	Anodyne	CAPN2	71	33
CCO[C@@H]1C[C@H](NC(=O)CNC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819400620	FD	On-Demand	Anodyne	NPR	55	33
CCO[C@@H]1C[C@H](NC(=O)CNC(=O)OCc2ccccc2)[C@H]1n1cccn1	ZINC000819400620	FD	On-Demand	Anodyne	PSMB5	17	40
CCO[C@@H]1C[C@@H](NC(=O)CNC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819400621	FD	On-Demand	Anodyne	CAPN2	71	33
CCO[C@@H]1C[C@@H](NC(=O)CNC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819400621	FD	On-Demand	Anodyne	NPR	55	33
CCO[C@@H]1C[C@@H](NC(=O)CNC(=O)OCc2ccccc2)[C@@H]1n1cccn1	ZINC000819400621	FD	On-Demand	Anodyne	PSMB5	17	40
COC[C@@H](O)CNc1ccc(OC)c(NC(C)=O)c1	ZINC000819400732	CD	On-Demand	Anodyne	ADRB2	15	42
C#Cc1cccc(NC(=O)c2cncn2-c2ccc(F)cc2)c1	ZINC000819400741	DG	On-Demand	Mild	KCNK3	55	36
C#Cc1cccc(NC(=O)c2cncn2-c2ccc(F)cc2)c1	ZINC000819400741	DG	On-Demand	Mild	KCNK9	47	34
C#Cc1cccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c1	ZINC000819400746	EE	On-Demand	Mild	TAAR1	50	50
C#Cc1cccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c1	ZINC000819400746	EE	On-Demand	Mild	KCNK3	45	33
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400792	GF	On-Demand	Anodyne	PAPA1_CARPA	30	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400792	GF	On-Demand	Anodyne	REN	41	42
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400792	GF	On-Demand	Anodyne	CAPN1	22	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400792	GF	On-Demand	Anodyne	POLG_HCV1	23	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)[C@@H]1n1cccn1	ZINC000819400792	GF	On-Demand	Anodyne	FPR1	51	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400793	GF	On-Demand	Anodyne	PAPA1_CARPA	30	41
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400793	GF	On-Demand	Anodyne	REN	41	42
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400793	GF	On-Demand	Anodyne	CAPN1	22	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400793	GF	On-Demand	Anodyne	POLG_HCV1	23	40
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)[C@H]1n1cccn1	ZINC000819400793	GF	On-Demand	Anodyne	FPR1	51	41
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)[C@@H]1n1cccn1	ZINC000819400820	HE	On-Demand	Anodyne	GRIN2B	21	46
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)[C@H]1n1cccn1	ZINC000819400821	HE	On-Demand	Anodyne	GRIN2B	21	46
CCO[C@@H]1C[C@H](NC(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)[C@H]1n1cccn1	ZINC000819400822	HE	On-Demand	Anodyne	GRIN2B	21	46
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)[C@@H]1n1cccn1	ZINC000819400823	HE	On-Demand	Anodyne	GRIN2B	21	46
CCO[C@@H]1C[C@@H](NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)[C@@H]1n1cccn1	ZINC000819400848	HF	On-Demand	Anodyne	GPR119	31	40
CCO[C@@H]1C[C@H](NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)[C@@H]1n1cccn1	ZINC000819400849	HF	On-Demand	Anodyne	GPR119	31	40
CCO[C@@H]1C[C@H](NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)[C@H]1n1cccn1	ZINC000819400850	HF	On-Demand	Anodyne	GPR119	31	40
CCO[C@@H]1C[C@@H](NC(=O)CC2CCN(C(=O)OC(C)(C)C)CC2)[C@H]1n1cccn1	ZINC000819400851	HF	On-Demand	Anodyne	GPR119	31	40
CCO[C@@H]1C[C@H](NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)[C@@H]1n1cccn1	ZINC000819400948	IH	On-Demand	Anodyne	F10	38	44
CCO[C@@H]1C[C@@H](NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)[C@H]1n1cccn1	ZINC000819400951	IH	On-Demand	Anodyne	F10	38	44
CCO[C@@H]1C[C@@H](NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)[C@@H]1n1cccn1	ZINC000819400953	IH	On-Demand	Anodyne	F10	38	44
CCO[C@@H]1C[C@H](NC(=O)c2ccccc2NC(=O)c2ccc(Cl)cc2)[C@H]1n1cccn1	ZINC000819400955	IH	On-Demand	Anodyne	F10	38	44
CCO[C@@H]1C[C@@H](NC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)[C@H]1n1cccn1	ZINC000819400972	ID	On-Demand	Anodyne	CCR8	40	35
CCO[C@@H]1C[C@H](NC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)[C@@H]1n1cccn1	ZINC000819400973	ID	On-Demand	Anodyne	CCR8	40	35
CCO[C@@H]1C[C@@H](NC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)[C@@H]1n1cccn1	ZINC000819400974	ID	On-Demand	Anodyne	CCR8	40	35
CCO[C@@H]1C[C@H](NC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)[C@H]1n1cccn1	ZINC000819400975	ID	On-Demand	Anodyne	CCR8	40	35
COc1ccccc1COC[C@@H](O)CNc1ccc(OC)c(NC(C)=O)c1	ZINC000819401007	FF	On-Demand	Anodyne	ADRB1	15	41
COc1ccccc1COC[C@@H](O)CNc1ccc(OC)c(NC(C)=O)c1	ZINC000819401007	FF	On-Demand	Anodyne	TSHR	60	31
COc1ccccc1COC[C@H](O)CNc1ccc(OC)c(NC(C)=O)c1	ZINC000819401008	FF	On-Demand	Anodyne	ADRB1	15	41
COc1ccccc1COC[C@H](O)CNc1ccc(OC)c(NC(C)=O)c1	ZINC000819401008	FF	On-Demand	Anodyne	TSHR	60	31
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1c2ccccc2C[C@@H]1O	ZINC000819401061	CD	On-Demand	Anodyne	PLM1_PLAFA	45	38
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1c2ccccc2C[C@@H]1O	ZINC000819401061	CD	On-Demand	Anodyne	PLM2_PLAFA	22	40
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1c2ccccc2C[C@H]1O	ZINC000819401062	CD	On-Demand	Anodyne	PLM1_PLAFA	45	38
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1c2ccccc2C[C@H]1O	ZINC000819401062	CD	On-Demand	Anodyne	PLM2_PLAFA	22	40
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1c2ccccc2C[C@@H]1O	ZINC000819401063	CD	On-Demand	Anodyne	PLM1_PLAFA	45	38
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1c2ccccc2C[C@@H]1O	ZINC000819401063	CD	On-Demand	Anodyne	PLM2_PLAFA	22	40
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1c2ccccc2C[C@H]1O	ZINC000819401064	CD	On-Demand	Anodyne	PLM1_PLAFA	45	38
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1c2ccccc2C[C@H]1O	ZINC000819401064	CD	On-Demand	Anodyne	PLM2_PLAFA	22	40
C#Cc1cccc(NC(=O)c2ccc(OCCC)c(OCCC)c2)c1	ZINC000819401097	EI	On-Demand	Mild	CPT1A	42	29
C#Cc1cccc(NC(=O)c2ccc(OCCC)c(OCCC)c2)c1	ZINC000819401097	EI	On-Demand	Mild	TAAR1	52	40
C#Cc1cccc(NC(=O)c2ccc(OCCC)c(OCCC)c2)c1	ZINC000819401097	EI	On-Demand	Mild	DDR1	29	50
C#Cc1cccc(NC(=O)c2ccc(OCCC)c(OCCC)c2)c1	ZINC000819401097	EI	On-Demand	Mild	KCNK3	121	42
C#Cc1cccc(NC(=O)c2ccc(OCCC)c(OCCC)c2)c1	ZINC000819401097	EI	On-Demand	Mild	KCNK9	86	42
Cc1ccccc1[C@@H](O)CNc1ccc(NC(=O)CC(C)C)cc1	ZINC000819401114	EI	On-Demand	Anodyne	SLC1A2	45	43
C=CCNC(=O)Nc1ccc(NC[C@@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819401162	FG	On-Demand	Mild	MTNR1A	21	40
C=CCNC(=O)Nc1ccc(NC[C@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819401163	FG	On-Demand	Mild	MTNR1A	21	40
O=C(O)CCCCCNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819401181	DE	On-Demand	Bother	GABRA1	15	45
O=C(O)CCCCCNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819401181	DE	On-Demand	Bother	TPR	17	43
O=C(O)CCCCCNC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000819401181	DE	On-Demand	Bother	GABRA2	15	43
O=C(O)CCCCCNC(=O)NNc1ccccc1	ZINC000819401185	CD	On-Demand	Reactive	HDAC8	17	46
O=C(O)CCCCCNC(=O)NNc1ccccc1	ZINC000819401185	CD	On-Demand	Reactive	HDAC1	15	46
O=C(O)CCCCCNC(=O)NNc1ccccc1	ZINC000819401185	CD	On-Demand	Reactive	HDAC3	15	46
O=C(O)CCCCCNC(=O)NNc1ccccc1	ZINC000819401185	CD	On-Demand	Reactive	EPHX2	19	43
O=C(O)CCCCCNC(=O)NNc1ccccc1	ZINC000819401185	CD	On-Demand	Reactive	HDAC11	16	46
O=C(O)CCCCCNC(=O)Nc1cccc(N2CCCCC2)c1	ZINC000819401187	EG	On-Demand	Anodyne	HTR1A	16	46
O=C(O)CCCCCNC(=O)Nc1cccc(N2CCCCC2)c1	ZINC000819401187	EG	On-Demand	Anodyne	HRH2	36	46
O=C(O)CCCCCNC(=O)Nc1cccc(N2CCCCC2)c1	ZINC000819401187	EG	On-Demand	Anodyne	CCR3	33	41
O=C(O)CCCCCNC(=O)Nc1cccc(N2CCCCC2)c1	ZINC000819401187	EG	On-Demand	Anodyne	EPHX2	34	47
O=C(O)CCCCCNC(=O)NNC(=O)c1ccc(F)cc1Br	ZINC000819401193	GE	On-Demand	Reactive	FOLH1	37	40
O=C(O)CCCCCNC(=O)NNC(=O)c1ccc(F)cc1Br	ZINC000819401193	GE	On-Demand	Reactive	HDAC9	25	40
O=C(O)CCCCCNC(=O)NNC(=O)c1cccc(Cl)c1	ZINC000819401195	ED	On-Demand	Reactive	FBP1	24	42
O=C(O)CCCCCNC(=O)Nc1cccc(C2SCCS2)c1	ZINC000819401197	FH	On-Demand	Anodyne	EPHX2	34	47
O=C(O)CCCCCNC(=O)NNC(=O)c1ccccc1F	ZINC000819401199	DD	On-Demand	Reactive	FOLH1	41	38
O=C(O)CCCCCNC(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819401206	FE	On-Demand	Reactive	EPHX2	50	66
O=C(O)CCCCCNC(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1	ZINC000819401210	GE	On-Demand	Anodyne	NPY2R	40	35
O=C(O)CCCCCNC(=O)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000819401213	FF	On-Demand	Anodyne	CCR3	49	43
O=C(O)CCCCCNC(=O)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000819401213	FF	On-Demand	Anodyne	EPHX2	24	41
O=C(O)CCCCCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819401215	ED	On-Demand	Reactive	MME	18	41
O=C(O)CCCCCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819401215	ED	On-Demand	Reactive	EDNRA	15	43
O=C(O)CCCCCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819401215	ED	On-Demand	Reactive	TPR	18	47
O=C(O)CCCCCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819401215	ED	On-Demand	Reactive	CCKAR	72	45
O=C(O)CCCCCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819401215	ED	On-Demand	Reactive	BCHE	20	40
O=C(O)CCCCCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819401215	ED	On-Demand	Reactive	BRS3	25	43
O=C(O)CCCCCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819401215	ED	On-Demand	Reactive	MC3R	51	35
O=C(O)CCCCCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819401215	ED	On-Demand	Reactive	MC5R	62	34
O=C(O)CCCCCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819401215	ED	On-Demand	Reactive	GRIA1	15	41
O=C(O)CCCCCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819401215	ED	On-Demand	Reactive	MC1R	68	36
O=C(O)CCCCCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819401215	ED	On-Demand	Reactive	MMP1	18	46
O=C(O)CCCCCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819401215	ED	On-Demand	Reactive	KISS1R	66	34
O=C(O)CCCCCNC(=O)Nc1nnc(C2CC2)s1	ZINC000819401221	CE	On-Demand	Anodyne	EPHX2	15	44
O=C(O)CCCCCNC(=O)NNc1ccccc1Cl	ZINC000819401226	CF	On-Demand	Reactive	CXCL8	38	42
O=C(O)CCCCCNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000819401228	EG	On-Demand	Bother	TBXA2R	19	43
O=C(O)CCCCCNC(=O)NNC(=O)c1ccc2c(c1)OCCO2	ZINC000819401229	FD	On-Demand	Reactive	HDAC9	17	41
O=C(O)CCCCCNC(=O)Nc1ccc(-n2cccn2)nc1	ZINC000819401230	DE	On-Demand	Anodyne	FOLH1	21	44
O=C(O)CCCCCNC(=O)Nc1cccc(N2CCS(=O)(=O)CC2)c1	ZINC000819401231	GD	On-Demand	Anodyne	EPHX2	19	44
O=C(O)CCCCCNC(=O)c1ccc(-n2cccc2)nc1	ZINC000819401233	DE	On-Demand	Anodyne	TBXAS1	42	38
O=C(O)CCCCCNC(=O)c1ccc(-n2cccc2)nc1	ZINC000819401233	DE	On-Demand	Anodyne	HDAC1	17	46
O=C(O)CCCCCNC(=O)c1c[nH]c2cc(Cl)ccc12	ZINC000819401237	DG	On-Demand	Anodyne	TPR	20	46
O=C(O)CCCCCNC(=O)c1c[nH]c2cc(Cl)ccc12	ZINC000819401237	DG	On-Demand	Anodyne	ALPL	28	40
O=C(O)CCCCCNC(=O)NNC(=O)c1ccoc1	ZINC000819401239	CC	On-Demand	Reactive	FOLH1	45	38
O=C(O)CCCCCNC(=O)Nc1cccc(N2C(=O)CNC2=O)c1	ZINC000819401240	ED	On-Demand	Anodyne	EPHX2	15	44
O=C(O)CCCCCNC(=O)NNC(=O)c1cccc(Br)c1	ZINC000819401241	FE	On-Demand	Reactive	FOLH1	40	37
O=C(O)CCCCCNC(=O)NNC(=O)c1cccc(Br)c1	ZINC000819401241	FE	On-Demand	Reactive	TBXAS1	16	44
O=C(O)CCCCCNC(=O)NNC(=O)c1cccc(Br)c1	ZINC000819401241	FE	On-Demand	Reactive	HDAC8	20	48
O=C(O)CCCCCNC(=O)NNC(=O)c1cccc(Br)c1	ZINC000819401241	FE	On-Demand	Reactive	HDAC10	15	48
O=C(O)CCCCCNC(=O)NNC(=O)c1cccc(Br)c1	ZINC000819401241	FE	On-Demand	Reactive	HDAC1	19	65
O=C(O)CCCCCNC(=O)NNC(=O)c1cccc(Br)c1	ZINC000819401241	FE	On-Demand	Reactive	HDAC2	16	48
O=C(O)CCCCCNC(=O)NNC(=O)c1cccc(Br)c1	ZINC000819401241	FE	On-Demand	Reactive	HDAC3	19	48
O=C(O)CCCCCNC(=O)NNC(=O)c1cccc(Br)c1	ZINC000819401241	FE	On-Demand	Reactive	HDAC4	15	48
O=C(O)CCCCCNC(=O)NNC(=O)c1cccc(Br)c1	ZINC000819401241	FE	On-Demand	Reactive	HDAC5	20	48
O=C(O)CCCCCNC(=O)NNC(=O)c1cccc(Br)c1	ZINC000819401241	FE	On-Demand	Reactive	HDAC6	16	48
O=C(O)CCCCCNC(=O)NNC(=O)c1cccc(Br)c1	ZINC000819401241	FE	On-Demand	Reactive	HDAC9	39	44
O=C(O)CCCCCNC(=O)N[C@@H]1C=C[C@H](CO)C1	ZINC000819401242	CC	On-Demand	Anodyne	EPHX2	22	47
O=C(O)CCCCCNC(=O)Nc1ccc(N2CCCC2)nc1	ZINC000819401243	DE	On-Demand	Anodyne	FOLH1	21	43
O=C(O)CCCCCNC(=O)Nc1ccc(N2CCCC2)nc1	ZINC000819401243	DE	On-Demand	Anodyne	DGAT1	40	39
O=C(O)CCCCCNC(=O)NNc1ccc(Br)cn1	ZINC000819401244	EE	On-Demand	Reactive	HDAC9	19	41
O=C(O)CCCCCNC(=O)Nc1ccc(Cl)nc1	ZINC000819401249	CF	On-Demand	Anodyne	FOLH1	28	47
O=C(O)CCCCCNC(=O)Nc1ccc(Cl)nc1	ZINC000819401249	CF	On-Demand	Anodyne	EPHX2	15	45
O=C(O)CCCCCNC(=O)Nc1ccc(-n2nccn2)cc1	ZINC000819401250	DE	On-Demand	Anodyne	FOLH1	26	46
O=C(O)CCCCCNC(=O)Nc1ccc(-n2nccn2)cc1	ZINC000819401250	DE	On-Demand	Anodyne	HDAC10	15	45
O=C(O)CCCCCNC(=O)Nc1ccc(-n2nccn2)cc1	ZINC000819401250	DE	On-Demand	Anodyne	DOT1L	43	32
O=C(O)CCCCCNC(=O)Nc1cccnc1N1CCCC1	ZINC000819401252	DE	On-Demand	Anodyne	KCNQ2	59	35
O=C(O)CCCCCNC(=O)NNC(=O)c1ccccc1Br	ZINC000819401253	FE	On-Demand	Reactive	HDAC9	22	40
O=C(O)CCCCCNC(=O)NNC(=O)c1ccc(Cl)cc1	ZINC000819401254	ED	On-Demand	Reactive	FOLH1	40	44
O=C(O)CCCCCNC(=O)NNC(=O)c1ccc(Cl)cc1	ZINC000819401254	ED	On-Demand	Reactive	TBXAS1	19	44
O=C(O)CCCCCNC(=O)NNC(=O)c1ccc(Cl)cc1	ZINC000819401254	ED	On-Demand	Reactive	HDAC9	27	47
O=C(O)CCCCCNC(=O)Nc1ccc(Br)nc1	ZINC000819401257	EF	On-Demand	Anodyne	ADRB1	24	44
O=C(O)CCCCCNC(=O)Nc1ccc(Br)nc1	ZINC000819401257	EF	On-Demand	Anodyne	FOLH1	36	50
O=C(O)CCCCCNC(=O)Nc1ccc(Br)nc1	ZINC000819401257	EF	On-Demand	Anodyne	HDAC10	18	46
O=C(O)CCCCCNC(=O)Nc1ccc(Br)nc1	ZINC000819401257	EF	On-Demand	Anodyne	HDAC6	18	46
O=C(O)CCCCCNC(=O)NNC(=O)C1CCCC1	ZINC000819401259	CD	On-Demand	Reactive	EPHX2	24	48
O=C(O)CCCCCNC(=O)NNC(=O)c1ccc(Br)s1	ZINC000819401262	GE	On-Demand	Reactive	HDAC9	20	40
O=C(O)CCCCCNC(=O)NNC(=O)c1ccc(Cl)cc1Cl	ZINC000819401263	FF	On-Demand	Reactive	FOLH1	32	41
O=C(O)CCCCCNC(=O)NNC(=O)c1ccc(Cl)cc1Cl	ZINC000819401263	FF	On-Demand	Reactive	PYGL	15	41
O=C(O)CCCCCNC(=O)NNC(=O)c1ccc(Cl)cc1Cl	ZINC000819401263	FF	On-Demand	Reactive	ALPL	41	38
O=C(O)CCCCCNC(=O)NCc1ccccc1O	ZINC000819401264	CD	On-Demand	Clean	MME	15	49
O=C(O)CCCCCNC(=O)NCc1ccccc1O	ZINC000819401264	CD	On-Demand	Clean	GRIA1	50	39
O=C(O)CCCCCNC(=O)NCc1ccccc1O	ZINC000819401264	CD	On-Demand	Clean	EPHX2	22	45
O=C(O)CCCCCNC(=O)NNC(=O)c1ccccc1	ZINC000819401273	CD	On-Demand	Reactive	FOLH1	52	40
O=C(O)CCCCCNC(=O)NNC(=O)c1ccccc1	ZINC000819401273	CD	On-Demand	Reactive	HDAC8	22	58
O=C(O)CCCCCNC(=O)NNC(=O)c1ccccc1	ZINC000819401273	CD	On-Demand	Reactive	HDAC1	20	58
O=C(O)CCCCCNC(=O)NNC(=O)c1ccccc1	ZINC000819401273	CD	On-Demand	Reactive	HDAC2	16	58
O=C(O)CCCCCNC(=O)NNC(=O)c1ccccc1	ZINC000819401273	CD	On-Demand	Reactive	HDAC3	17	58
O=C(O)CCCCCNC(=O)NNC(=O)c1ccccc1	ZINC000819401273	CD	On-Demand	Reactive	HDAC6	15	58
O=C(O)CCCCCNC(=O)NNC(=O)c1ccccc1	ZINC000819401273	CD	On-Demand	Reactive	EPHX2	17	42
O=C(O)CCCCCNC(=O)NNC(=O)c1ccccc1	ZINC000819401273	CD	On-Demand	Reactive	HDAC9	29	47
O=C(O)CCCCCNC(=O)Nc1ccn(-c2ccccc2)n1	ZINC000819401274	DF	On-Demand	Anodyne	HDAC10	15	44
O=C(O)CCCCCNC(=O)Nc1ccc(N2CCSCC2)cc1	ZINC000819401277	FG	On-Demand	Anodyne	FOLH1	20	45
O=C(O)CCCCCNC(=O)Nc1ccc(N2CCSCC2)cc1	ZINC000819401277	FG	On-Demand	Anodyne	EPHX2	27	41
O=C(O)CCCCCNC(=O)NNc1ccc(Cl)c(F)c1	ZINC000819401278	DF	On-Demand	Reactive	FOLH1	18	40
O=C(O)CCCCCNC(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819401279	EG	On-Demand	Anodyne	FOLH1	17	44
O=C(O)CCCCCNC(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819401279	EG	On-Demand	Anodyne	KCNQ2	47	33
O=C(O)CCCCCNC(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819401279	EG	On-Demand	Anodyne	NPY2R	88	41
O=C(O)CCCCCNC(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819401279	EG	On-Demand	Anodyne	CCR3	37	44
O=C(O)CCCCCNC(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819401279	EG	On-Demand	Anodyne	EPHX2	18	42
O=C(O)CCCCCNC(=O)c1cc(I)ccc1F	ZINC000819401283	GF	On-Demand	Anodyne	FOLH1	44	41
O=C(O)CCCCCNC(=O)Nc1ccc(N2CCCCC2)nc1	ZINC000819401286	EF	On-Demand	Anodyne	FOLH1	17	42
O=C(O)CCCCCNC(=O)Nc1ccc(N2CCCCC2)nc1	ZINC000819401286	EF	On-Demand	Anodyne	DGAT1	39	41
O=C(O)CCCCCNC(=O)NNC(=O)c1ccc(Cl)cc1F	ZINC000819401288	EE	On-Demand	Reactive	FOLH1	32	40
O=C(O)CCCCCNC(=O)NNC(=O)c1ccc(Cl)cc1F	ZINC000819401288	EE	On-Demand	Reactive	HDAC9	15	43
O=C(O)CCCCCNC(=O)NNc1ccc(F)cc1	ZINC000819401290	CE	On-Demand	Reactive	FOLH1	26	50
O=C(O)CCCCCNC(=O)Nc1cc(F)c(N2CCCC2)c(F)c1	ZINC000819401291	FG	On-Demand	Anodyne	CCR3	26	40
O=C(O)CCCCCNC(=O)Nc1ccc(-n2nccn2)nc1	ZINC000819401293	DD	On-Demand	Anodyne	FOLH1	21	43
O=C(O)CCCCCNC(=O)Nc1cccc(N2CCNC2=O)c1	ZINC000819401300	ED	On-Demand	Anodyne	FOLH1	15	40
O=C(O)CCCCCNC(=O)Nc1cccc(N2CCNC2=O)c1	ZINC000819401300	ED	On-Demand	Anodyne	CCR3	37	41
O=C(O)CCCCCNC(=O)Nc1cccc(N2CCNC2=O)c1	ZINC000819401300	ED	On-Demand	Anodyne	EPHX2	23	44
O=C(N[C@@H]1c2ccccc2C[C@@H]1O)C(F)=C1CCC1	ZINC000819401324	CE	On-Demand	Anodyne	PLM1_PLAFA	45	42
O=C(N[C@@H]1c2ccccc2C[C@@H]1O)C(F)=C1CCC1	ZINC000819401324	CE	On-Demand	Anodyne	PLM2_PLAFA	23	42
O=C(N[C@H]1c2ccccc2C[C@@H]1O)C(F)=C1CCC1	ZINC000819401325	CE	On-Demand	Anodyne	PLM1_PLAFA	45	42
O=C(N[C@H]1c2ccccc2C[C@@H]1O)C(F)=C1CCC1	ZINC000819401325	CE	On-Demand	Anodyne	PLM2_PLAFA	23	42
O=C(N[C@H]1c2ccccc2C[C@H]1O)C(F)=C1CCC1	ZINC000819401326	CE	On-Demand	Anodyne	PLM1_PLAFA	45	42
O=C(N[C@H]1c2ccccc2C[C@H]1O)C(F)=C1CCC1	ZINC000819401326	CE	On-Demand	Anodyne	PLM2_PLAFA	23	42
O=C(N[C@@H]1c2ccccc2C[C@H]1O)C(F)=C1CCC1	ZINC000819401327	CE	On-Demand	Anodyne	PLM1_PLAFA	45	42
O=C(N[C@@H]1c2ccccc2C[C@H]1O)C(F)=C1CCC1	ZINC000819401327	CE	On-Demand	Anodyne	PLM2_PLAFA	23	42
O=C(NC[C@H]1CCCO1)Nc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819401341	GH	On-Demand	Anodyne	ADRB1	28	43
O=C(NC[C@H]1CCCO1)Nc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819401341	GH	On-Demand	Anodyne	ADRB3	41	39
O=C(NC[C@H]1CCCO1)Nc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819401341	GH	On-Demand	Anodyne	CYP3A4	46	34
O=C(NC[C@H]1CCCO1)Nc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819401344	GH	On-Demand	Anodyne	ADRB1	28	43
O=C(NC[C@H]1CCCO1)Nc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819401344	GH	On-Demand	Anodyne	ADRB3	41	39
O=C(NC[C@H]1CCCO1)Nc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819401344	GH	On-Demand	Anodyne	CYP3A4	46	34
CC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)cc1C	ZINC000819401392	EG	On-Demand	Anodyne	ADRB2	28	49
CC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)cc1C	ZINC000819401392	EG	On-Demand	Anodyne	ADRB1	39	47
CC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)cc1C	ZINC000819401392	EG	On-Demand	Anodyne	ADRB3	24	41
CC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)cc1C	ZINC000819401393	EG	On-Demand	Anodyne	ADRB2	28	49
CC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)cc1C	ZINC000819401393	EG	On-Demand	Anodyne	ADRB1	39	47
CC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)cc1C	ZINC000819401393	EG	On-Demand	Anodyne	ADRB3	24	41
CC(=O)Nc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1C	ZINC000819401398	FI	On-Demand	Anodyne	SLC1A1	20	44
CC(=O)Nc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1C	ZINC000819401398	FI	On-Demand	Anodyne	SLC1A3	24	44
CC(=O)Nc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1C	ZINC000819401398	FI	On-Demand	Anodyne	SLC1A2	30	44
CC(=O)Nc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1C	ZINC000819401399	FI	On-Demand	Anodyne	SLC1A1	20	44
CC(=O)Nc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1C	ZINC000819401399	FI	On-Demand	Anodyne	SLC1A3	24	44
CC(=O)Nc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1C	ZINC000819401399	FI	On-Demand	Anodyne	SLC1A2	30	44
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc(NC(C)=O)c(C)c1	ZINC000819401404	FF	On-Demand	Anodyne	ADRB1	49	35
COc1cccc(OC)c1OC[C@H](O)CNc1ccc(NC(C)=O)c(C)c1	ZINC000819401405	FF	On-Demand	Anodyne	ADRB1	49	35
CC(=O)Nc1ccc(NC[C@H](O)COc2c(C)ccc(C)c2C)cc1C	ZINC000819401431	FH	On-Demand	Anodyne	ADRB2	17	41
CC(=O)Nc1ccc(NC[C@H](O)COc2c(C)ccc(C)c2C)cc1C	ZINC000819401431	FH	On-Demand	Anodyne	ADRB1	19	41
CC(=O)Nc1ccc(NC[C@@H](O)COc2c(C)ccc(C)c2C)cc1C	ZINC000819401432	FH	On-Demand	Anodyne	ADRB2	17	41
CC(=O)Nc1ccc(NC[C@@H](O)COc2c(C)ccc(C)c2C)cc1C	ZINC000819401432	FH	On-Demand	Anodyne	ADRB1	19	41
CC(=O)Nc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1C	ZINC000819401457	FI	On-Demand	Anodyne	SLC1A2	28	40
CC(=O)Nc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1C	ZINC000819401458	FI	On-Demand	Anodyne	SLC1A2	28	40
CC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2)cc1C	ZINC000819401471	DF	On-Demand	Anodyne	ADRB2	56	50
CC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2)cc1C	ZINC000819401471	DF	On-Demand	Anodyne	ADRB1	78	50
CC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2)cc1C	ZINC000819401471	DF	On-Demand	Anodyne	ADRB3	49	47
CC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2)cc1C	ZINC000819401471	DF	On-Demand	Anodyne	ABCB1	27	42
CC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2)cc1C	ZINC000819401471	DF	On-Demand	Anodyne	PDS	67	36
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2)cc1C	ZINC000819401472	DF	On-Demand	Anodyne	ADRB2	56	50
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2)cc1C	ZINC000819401472	DF	On-Demand	Anodyne	ADRB1	78	50
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2)cc1C	ZINC000819401472	DF	On-Demand	Anodyne	ADRB3	49	47
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2)cc1C	ZINC000819401472	DF	On-Demand	Anodyne	ABCB1	27	42
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2)cc1C	ZINC000819401472	DF	On-Demand	Anodyne	PDS	67	36
C#Cc1cccc(NC(=O)c2cc3c(=O)n4ccccc4nc3n2C)c1	ZINC000819401473	EE	On-Demand	Mild	POLR1A	69	32
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1C	ZINC000819401532	FF	On-Demand	Mild	ADRB2	37	47
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1C	ZINC000819401532	FF	On-Demand	Mild	ADRB1	66	47
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1C	ZINC000819401532	FF	On-Demand	Mild	GRIN1	21	41
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1C	ZINC000819401532	FF	On-Demand	Mild	ADRB3	40	45
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1C	ZINC000819401533	FF	On-Demand	Mild	ADRB2	37	47
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1C	ZINC000819401533	FF	On-Demand	Mild	ADRB1	66	47
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1C	ZINC000819401533	FF	On-Demand	Mild	GRIN1	21	41
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1C	ZINC000819401533	FF	On-Demand	Mild	ADRB3	40	45
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1C	ZINC000819401547	EG	On-Demand	Anodyne	ADRB2	37	54
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1C	ZINC000819401547	EG	On-Demand	Anodyne	ADRB1	50	54
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1C	ZINC000819401547	EG	On-Demand	Anodyne	PDS	54	41
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1C	ZINC000819401548	EG	On-Demand	Anodyne	ADRB2	37	54
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1C	ZINC000819401548	EG	On-Demand	Anodyne	ADRB1	50	54
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1C	ZINC000819401548	EG	On-Demand	Anodyne	PDS	54	41
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1C	ZINC000819401555	GI	On-Demand	Anodyne	ADRB2	32	50
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1C	ZINC000819401555	GI	On-Demand	Anodyne	ADRB1	49	50
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1C	ZINC000819401555	GI	On-Demand	Anodyne	GRIN1	30	51
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1C	ZINC000819401555	GI	On-Demand	Anodyne	ADRB3	32	44
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1C	ZINC000819401555	GI	On-Demand	Anodyne	ACOX1	40	33
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1C	ZINC000819401556	GI	On-Demand	Anodyne	ADRB2	32	50
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1C	ZINC000819401556	GI	On-Demand	Anodyne	ADRB1	49	50
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1C	ZINC000819401556	GI	On-Demand	Anodyne	GRIN1	30	51
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1C	ZINC000819401556	GI	On-Demand	Anodyne	ADRB3	32	44
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1C	ZINC000819401556	GI	On-Demand	Anodyne	ACOX1	40	33
C#Cc1cccc(NC(=O)c2cccc(-n3cccc3)c2)c1	ZINC000819401565	CH	On-Demand	Mild	TAAR1	47	38
C#Cc1cccc(NC(=O)c2cccc(-n3cccc3)c2)c1	ZINC000819401565	CH	On-Demand	Mild	KCNK3	110	43
C#Cc1cccc(NC(=O)c2cccc(-n3cccc3)c2)c1	ZINC000819401565	CH	On-Demand	Mild	KCNK9	58	43
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Br)cc2)cc1C	ZINC000819401578	GH	On-Demand	Anodyne	ADRB2	37	51
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Br)cc2)cc1C	ZINC000819401578	GH	On-Demand	Anodyne	ADRB1	60	51
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Br)cc2)cc1C	ZINC000819401578	GH	On-Demand	Anodyne	ADRB3	35	44
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Br)cc2)cc1C	ZINC000819401579	GH	On-Demand	Anodyne	ADRB2	37	51
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Br)cc2)cc1C	ZINC000819401579	GH	On-Demand	Anodyne	ADRB1	60	51
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Br)cc2)cc1C	ZINC000819401579	GH	On-Demand	Anodyne	ADRB3	35	44
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1C	ZINC000819401594	EG	On-Demand	Anodyne	ADRB2	39	51
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1C	ZINC000819401594	EG	On-Demand	Anodyne	ADRB1	67	51
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1C	ZINC000819401594	EG	On-Demand	Anodyne	GRIN1	27	44
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1C	ZINC000819401594	EG	On-Demand	Anodyne	ADRB3	41	44
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1C	ZINC000819401595	EG	On-Demand	Anodyne	ADRB2	39	51
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1C	ZINC000819401595	EG	On-Demand	Anodyne	ADRB1	67	51
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1C	ZINC000819401595	EG	On-Demand	Anodyne	GRIN1	27	44
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1C	ZINC000819401595	EG	On-Demand	Anodyne	ADRB3	41	44
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401600	FF	On-Demand	Anodyne	ADRB2	44	60
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401600	FF	On-Demand	Anodyne	ADRB1	72	60
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401600	FF	On-Demand	Anodyne	GRIN1	26	41
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401600	FF	On-Demand	Anodyne	ADRB3	45	52
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401601	FF	On-Demand	Anodyne	ADRB2	44	60
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401601	FF	On-Demand	Anodyne	ADRB1	72	60
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401601	FF	On-Demand	Anodyne	GRIN1	26	41
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401601	FF	On-Demand	Anodyne	ADRB3	45	52
CC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2F)cc1C	ZINC000819401610	EF	On-Demand	Anodyne	ADRB2	29	43
CC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2F)cc1C	ZINC000819401610	EF	On-Demand	Anodyne	ADRB1	66	40
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2F)cc1C	ZINC000819401611	EF	On-Demand	Anodyne	ADRB2	29	43
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2F)cc1C	ZINC000819401611	EF	On-Demand	Anodyne	ADRB1	66	40
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C(C)(C)C)cc2C)cc1C	ZINC000819401612	GI	On-Demand	Anodyne	ADRB2	20	40
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C(C)(C)C)cc2C)cc1C	ZINC000819401612	GI	On-Demand	Anodyne	VDR	22	44
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C(C)(C)C)cc2C)cc1C	ZINC000819401613	GI	On-Demand	Anodyne	ADRB2	20	40
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C(C)(C)C)cc2C)cc1C	ZINC000819401613	GI	On-Demand	Anodyne	VDR	22	44
CC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C)cc1C	ZINC000819401637	EG	On-Demand	Anodyne	ADRB2	34	52
CC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C)cc1C	ZINC000819401637	EG	On-Demand	Anodyne	ADRB1	63	37
CC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C)cc1C	ZINC000819401637	EG	On-Demand	Anodyne	CYP2D6	15	43
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C)cc1C	ZINC000819401638	EG	On-Demand	Anodyne	ADRB2	34	52
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C)cc1C	ZINC000819401638	EG	On-Demand	Anodyne	ADRB1	63	37
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C)cc1C	ZINC000819401638	EG	On-Demand	Anodyne	CYP2D6	15	43
CC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1C	ZINC000819401654	FF	On-Demand	Bother	ADRB2	24	40
CC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1C	ZINC000819401654	FF	On-Demand	Bother	ADRB1	61	36
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1C	ZINC000819401655	FF	On-Demand	Bother	ADRB2	24	40
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1C	ZINC000819401655	FF	On-Demand	Bother	ADRB1	61	36
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401664	GG	On-Demand	Anodyne	ADRB2	46	51
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401664	GG	On-Demand	Anodyne	ADRB1	76	51
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401664	GG	On-Demand	Anodyne	GRIN1	27	43
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401664	GG	On-Demand	Anodyne	ADRB3	51	51
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401665	GG	On-Demand	Anodyne	ADRB2	46	51
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401665	GG	On-Demand	Anodyne	ADRB1	76	51
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401665	GG	On-Demand	Anodyne	GRIN1	27	43
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401665	GG	On-Demand	Anodyne	ADRB3	51	51
CC(=O)Nc1ccc(NC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1C	ZINC000819401683	GH	On-Demand	Anodyne	GPR119	24	41
CC(=O)Nc1ccc(NC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1C	ZINC000819401684	GH	On-Demand	Anodyne	GPR119	24	41
CC(=O)Nc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1C	ZINC000819401687	GG	On-Demand	Anodyne	CCR8	47	39
CC(=O)Nc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1C	ZINC000819401687	GG	On-Demand	Anodyne	GPR119	46	44
CC(=O)Nc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1C	ZINC000819401688	GG	On-Demand	Anodyne	CCR8	47	39
CC(=O)Nc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1C	ZINC000819401688	GG	On-Demand	Anodyne	GPR119	46	44
C#Cc1cccc(NC(=O)c2c(C)nc3ccccc3c2C)c1	ZINC000819401693	DI	On-Demand	Mild	NR2E3	62	35
C#Cc1cccc(NC(=O)c2c(C)nc3ccccc3c2C)c1	ZINC000819401693	DI	On-Demand	Mild	KCNK3	100	37
C#Cc1cccc(NC(=O)c2c(C)nc3ccccc3c2C)c1	ZINC000819401693	DI	On-Demand	Mild	KCNK9	62	37
CSc1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401701	FH	On-Demand	Anodyne	ADRB2	32	49
CSc1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401701	FH	On-Demand	Anodyne	ADRB1	54	49
CSc1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401701	FH	On-Demand	Anodyne	ADRB3	31	43
CSc1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401702	FH	On-Demand	Anodyne	ADRB2	32	49
CSc1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401702	FH	On-Demand	Anodyne	ADRB1	54	49
CSc1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401702	FH	On-Demand	Anodyne	ADRB3	31	43
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C)cc2C)cc1C	ZINC000819401703	EG	On-Demand	Anodyne	ADRB2	20	44
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C)cc2C)cc1C	ZINC000819401704	EG	On-Demand	Anodyne	ADRB2	20	44
CC(=O)Nc1ccc(NCCC(=O)Nc2cccc(C(F)(F)F)c2)cc1C	ZINC000819401707	GI	On-Demand	Anodyne	LCK	28	43
CC(=O)Nc1ccc(NCCC(=O)Nc2cccc(C(F)(F)F)c2)cc1C	ZINC000819401707	GI	On-Demand	Anodyne	KDR	19	46
CC(=O)Nc1ccc(NCCC(=O)Nc2cccc(C(F)(F)F)c2)cc1C	ZINC000819401707	GI	On-Demand	Anodyne	SLC1A1	26	45
CC(=O)Nc1ccc(NCCC(=O)Nc2cccc(C(F)(F)F)c2)cc1C	ZINC000819401707	GI	On-Demand	Anodyne	SLC1A3	25	45
CC(=O)Nc1ccc(NCCC(=O)Nc2cccc(C(F)(F)F)c2)cc1C	ZINC000819401707	GI	On-Demand	Anodyne	SLC1A2	37	45
CC(=O)Nc1ccc(NCCC(=O)Nc2cccc(C(F)(F)F)c2)cc1C	ZINC000819401707	GI	On-Demand	Anodyne	TEK	30	41
CC(=O)Nc1ccc(NCCC(=O)Nc2cccc(C(F)(F)F)c2)cc1C	ZINC000819401707	GI	On-Demand	Anodyne	BTK	21	43
CC(=O)Nc1ccc(NCCC(=O)Nc2cccc(C(F)(F)F)c2)cc1C	ZINC000819401707	GI	On-Demand	Anodyne	KCNK3	19	42
CC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)ccc2Cl)cc1C	ZINC000819401710	FH	On-Demand	Anodyne	ADRB2	17	42
CC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)ccc2Cl)cc1C	ZINC000819401711	FH	On-Demand	Anodyne	ADRB2	17	42
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1C	ZINC000819401722	FG	On-Demand	Anodyne	ADRB2	22	56
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1C	ZINC000819401722	FG	On-Demand	Anodyne	ADRB1	51	56
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1C	ZINC000819401723	FG	On-Demand	Anodyne	ADRB2	22	56
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1C	ZINC000819401723	FG	On-Demand	Anodyne	ADRB1	51	56
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1C	ZINC000819401724	GF	On-Demand	Anodyne	ADRB1	22	40
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1C	ZINC000819401724	GF	On-Demand	Anodyne	PKM	38	41
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1C	ZINC000819401725	GF	On-Demand	Anodyne	ADRB1	22	40
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1C	ZINC000819401725	GF	On-Demand	Anodyne	PKM	38	41
C#Cc1cccc(NC(=O)c2ccccc2SCC)c1	ZINC000819401726	CI	On-Demand	Mild	NR2E3	54	36
C#Cc1cccc(NC(=O)c2ccccc2SCC)c1	ZINC000819401726	CI	On-Demand	Mild	KCNK3	114	42
C#Cc1cccc(NC(=O)c2ccccc2SCC)c1	ZINC000819401726	CI	On-Demand	Mild	KCNK9	88	42
C[C@H](NC(=O)C[C@@H](C)n1cccn1)[C@@H](O)c1ccc(F)cc1	ZINC000819401742	DE	On-Demand	Anodyne	AMP1_PLAFQ	43	37
C[C@H](NC(=O)C[C@H](C)n1cccn1)[C@H](O)c1ccc(F)cc1	ZINC000819401743	DE	On-Demand	Anodyne	AMP1_PLAFQ	43	37
C[C@H](NC(=O)C[C@H](C)n1cccn1)[C@@H](O)c1ccc(F)cc1	ZINC000819401744	DE	On-Demand	Anodyne	AMP1_PLAFQ	43	37
C[C@H](NC(=O)C[C@@H](C)n1cccn1)[C@H](O)c1ccc(F)cc1	ZINC000819401745	DE	On-Demand	Anodyne	AMP1_PLAFQ	43	37
COCCc1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401785	FF	On-Demand	Anodyne	ADRB2	45	54
COCCc1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401785	FF	On-Demand	Anodyne	ADRB1	77	54
COCCc1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401785	FF	On-Demand	Anodyne	GRIN1	27	43
COCCc1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401785	FF	On-Demand	Anodyne	ADRB3	52	50
COCCc1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401786	FF	On-Demand	Anodyne	ADRB2	45	54
COCCc1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401786	FF	On-Demand	Anodyne	ADRB1	77	54
COCCc1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401786	FF	On-Demand	Anodyne	GRIN1	27	43
COCCc1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401786	FF	On-Demand	Anodyne	ADRB3	52	50
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1C	ZINC000819401789	FG	On-Demand	Anodyne	ADRB2	36	51
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1C	ZINC000819401789	FG	On-Demand	Anodyne	ADRB1	62	51
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1C	ZINC000819401789	FG	On-Demand	Anodyne	ADRB3	34	44
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1C	ZINC000819401790	FG	On-Demand	Anodyne	ADRB2	36	51
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1C	ZINC000819401790	FG	On-Demand	Anodyne	ADRB1	62	51
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1C	ZINC000819401790	FG	On-Demand	Anodyne	ADRB3	34	44
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1C	ZINC000819401795	EF	On-Demand	Mild	ADRB2	33	49
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1C	ZINC000819401795	EF	On-Demand	Mild	ADRB1	61	49
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1C	ZINC000819401795	EF	On-Demand	Mild	ADRB3	31	43
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1C	ZINC000819401796	EF	On-Demand	Mild	ADRB2	33	49
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1C	ZINC000819401796	EF	On-Demand	Mild	ADRB1	61	49
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1C	ZINC000819401796	EF	On-Demand	Mild	ADRB3	31	43
CS(=O)(=O)Nc1cccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819401801	FG	On-Demand	Anodyne	ADRB2	33	40
CS(=O)(=O)Nc1cccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819401801	FG	On-Demand	Anodyne	ADRB3	49	43
CS(=O)(=O)Nc1cccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819401801	FG	On-Demand	Anodyne	TRPV1	35	41
CS(=O)(=O)Nc1cccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819401802	FG	On-Demand	Anodyne	ADRB2	33	40
CS(=O)(=O)Nc1cccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819401802	FG	On-Demand	Anodyne	ADRB3	49	43
CS(=O)(=O)Nc1cccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819401802	FG	On-Demand	Anodyne	TRPV1	35	41
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc(Br)c2)cc1C	ZINC000819401815	GH	On-Demand	Anodyne	ADRB2	30	43
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc(Br)c2)cc1C	ZINC000819401815	GH	On-Demand	Anodyne	ADRB1	41	43
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc(Br)c2)cc1C	ZINC000819401815	GH	On-Demand	Anodyne	PDS	65	42
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(Br)c2)cc1C	ZINC000819401816	GH	On-Demand	Anodyne	ADRB2	30	43
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(Br)c2)cc1C	ZINC000819401816	GH	On-Demand	Anodyne	ADRB1	41	43
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(Br)c2)cc1C	ZINC000819401816	GH	On-Demand	Anodyne	PDS	65	42
C#Cc1cccc(NC(=O)c2c(C)[nH]c(C(=O)OCC)c2C)c1	ZINC000819401831	DG	On-Demand	Mild	KCNK3	49	33
C#Cc1cccc(NC(=O)c2c(C)[nH]c(C(=O)OCC)c2C)c1	ZINC000819401831	DG	On-Demand	Mild	KCNK9	48	33
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1C	ZINC000819401853	EF	On-Demand	Anodyne	ADRB2	42	51
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1C	ZINC000819401853	EF	On-Demand	Anodyne	ADRB1	69	51
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1C	ZINC000819401853	EF	On-Demand	Anodyne	GRIN1	22	44
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1C	ZINC000819401853	EF	On-Demand	Anodyne	ADRB3	38	44
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1C	ZINC000819401854	EF	On-Demand	Anodyne	ADRB2	42	51
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1C	ZINC000819401854	EF	On-Demand	Anodyne	ADRB1	69	51
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1C	ZINC000819401854	EF	On-Demand	Anodyne	GRIN1	22	44
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1C	ZINC000819401854	EF	On-Demand	Anodyne	ADRB3	38	44
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1C	ZINC000819401881	FF	On-Demand	Bother	ADRB2	20	46
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1C	ZINC000819401881	FF	On-Demand	Bother	ADRB1	30	47
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1C	ZINC000819401881	FF	On-Demand	Bother	ADRB3	19	47
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1C	ZINC000819401881	FF	On-Demand	Bother	CACNA1D	60	33
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1C	ZINC000819401881	FF	On-Demand	Bother	PDS	23	45
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1C	ZINC000819401882	FF	On-Demand	Bother	ADRB2	20	46
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1C	ZINC000819401882	FF	On-Demand	Bother	ADRB1	30	47
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1C	ZINC000819401882	FF	On-Demand	Bother	ADRB3	19	47
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1C	ZINC000819401882	FF	On-Demand	Bother	CACNA1D	60	33
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1C	ZINC000819401882	FF	On-Demand	Bother	PDS	23	45
CCOc1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401887	FG	On-Demand	Anodyne	ADRB2	42	52
CCOc1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401887	FG	On-Demand	Anodyne	ADRB1	63	52
CCOc1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401887	FG	On-Demand	Anodyne	GRIN1	18	40
CCOc1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401887	FG	On-Demand	Anodyne	ADRB3	37	45
CCOc1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401888	FG	On-Demand	Anodyne	ADRB2	42	52
CCOc1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401888	FG	On-Demand	Anodyne	ADRB1	63	52
CCOc1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401888	FG	On-Demand	Anodyne	GRIN1	18	40
CCOc1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819401888	FG	On-Demand	Anodyne	ADRB3	37	45
CC(=O)Nc1ccc(NC[C@@H](O)Cc2ccc(F)cc2)cc1C	ZINC000819401892	DG	On-Demand	Anodyne	LEF	49	34
CC(=O)Nc1ccc(NC[C@H](O)Cc2ccc(F)cc2)cc1C	ZINC000819401893	DG	On-Demand	Anodyne	LEF	49	34
CC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1C	ZINC000819401896	EG	On-Demand	Anodyne	ADRB2	31	50
CC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1C	ZINC000819401896	EG	On-Demand	Anodyne	ADRB1	60	35
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1C	ZINC000819401897	EG	On-Demand	Anodyne	ADRB2	31	50
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1C	ZINC000819401897	EG	On-Demand	Anodyne	ADRB1	60	35
C#Cc1cccc(NC(=O)c2sc(-c3ccc(F)cc3)nc2C)c1	ZINC000819401926	EI	On-Demand	Mild	NR2E3	52	33
C#Cc1cccc(NC(=O)c2sc(-c3ccc(F)cc3)nc2C)c1	ZINC000819401926	EI	On-Demand	Mild	KCNK3	55	35
C#Cc1cccc(NC(=O)c2sc(-c3ccc(F)cc3)nc2C)c1	ZINC000819401926	EI	On-Demand	Mild	KCNK9	43	35
CC(C)c1nn(-c2ccccc2)cc1C(=O)N[C@@H](C)[C@H](O)c1ccc(F)cc1	ZINC000819401932	GH	On-Demand	Anodyne	HMGCR	52	38
CC(C)c1nn(-c2ccccc2)cc1C(=O)N[C@H](C)[C@@H](O)c1ccc(F)cc1	ZINC000819401933	GH	On-Demand	Anodyne	HMGCR	52	38
CC(C)c1nn(-c2ccccc2)cc1C(=O)N[C@H](C)[C@H](O)c1ccc(F)cc1	ZINC000819401934	GH	On-Demand	Anodyne	HMGCR	52	38
CC(C)c1nn(-c2ccccc2)cc1C(=O)N[C@@H](C)[C@@H](O)c1ccc(F)cc1	ZINC000819401935	GH	On-Demand	Anodyne	HMGCR	52	38
CS(=O)(=O)Nc1cccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819401938	FG	On-Demand	Anodyne	ADRB2	33	40
CS(=O)(=O)Nc1cccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819401938	FG	On-Demand	Anodyne	ADRB3	51	42
CS(=O)(=O)Nc1cccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819401939	FG	On-Demand	Anodyne	ADRB2	33	40
CS(=O)(=O)Nc1cccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819401939	FG	On-Demand	Anodyne	ADRB3	51	42
C#Cc1cccc(NC(=O)c2cc3c(C)cc(C)nc3s2)c1	ZINC000819401962	DI	On-Demand	Mild	KCNK3	51	36
C#Cc1cccc(NC(=O)c2cccc(NS(=O)(=O)c3cc(F)ccc3C)c2)c1	ZINC000819401977	HI	On-Demand	Mild	TAAR1	42	36
C#Cc1cccc(NC(=O)c2cccc(NS(=O)(=O)c3cc(F)ccc3C)c2)c1	ZINC000819401977	HI	On-Demand	Mild	KCNK3	105	46
C#Cc1cccc(NC(=O)c2cccc(NS(=O)(=O)c3cc(F)ccc3C)c2)c1	ZINC000819401977	HI	On-Demand	Mild	KCNK9	57	46
CC(=O)Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1C	ZINC000819401983	FH	On-Demand	Anodyne	GCGR	17	40
CC(=O)Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1C	ZINC000819401983	FH	On-Demand	Anodyne	P2RY1	47	37
CC(=O)Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1C	ZINC000819401983	FH	On-Demand	Anodyne	SHH	43	35
CC(=O)Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1C	ZINC000819401984	FH	On-Demand	Anodyne	GCGR	17	40
CC(=O)Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1C	ZINC000819401984	FH	On-Demand	Anodyne	P2RY1	47	37
CC(=O)Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1C	ZINC000819401984	FH	On-Demand	Anodyne	SHH	43	35
CS(=O)(=O)Nc1cccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819401985	GG	On-Demand	Anodyne	GRIN1	22	40
CS(=O)(=O)Nc1cccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819401985	GG	On-Demand	Anodyne	ADRB3	56	51
CS(=O)(=O)Nc1cccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819401986	GG	On-Demand	Anodyne	GRIN1	22	40
CS(=O)(=O)Nc1cccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819401986	GG	On-Demand	Anodyne	ADRB3	56	51
CC(=O)Nc1ccc(NC[C@H](O)COc2c(Cl)cccc2Cl)cc1C	ZINC000819402014	GI	On-Demand	Anodyne	ADRB2	21	40
CC(=O)Nc1ccc(NC[C@@H](O)COc2c(Cl)cccc2Cl)cc1C	ZINC000819402015	GI	On-Demand	Anodyne	ADRB2	21	40
CC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)ccc2C)cc1C	ZINC000819402020	EG	On-Demand	Anodyne	ADRB2	24	44
CC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)ccc2C)cc1C	ZINC000819402020	EG	On-Demand	Anodyne	ADRB1	50	34
CC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)ccc2C)cc1C	ZINC000819402021	EG	On-Demand	Anodyne	ADRB2	24	44
CC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)ccc2C)cc1C	ZINC000819402021	EG	On-Demand	Anodyne	ADRB1	50	34
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1c2ccccc2C[C@H]1O	ZINC000819402037	CD	On-Demand	Anodyne	PLM1_PLAFA	45	38
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1c2ccccc2C[C@H]1O	ZINC000819402037	CD	On-Demand	Anodyne	PLM2_PLAFA	22	40
O=C(/C=C/[C@H]1CCCO1)N[C@@H]1c2ccccc2C[C@@H]1O	ZINC000819402038	CD	On-Demand	Anodyne	PLM1_PLAFA	45	38
O=C(/C=C/[C@H]1CCCO1)N[C@@H]1c2ccccc2C[C@@H]1O	ZINC000819402038	CD	On-Demand	Anodyne	PLM2_PLAFA	22	40
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1c2ccccc2C[C@H]1O	ZINC000819402039	CD	On-Demand	Anodyne	PLM1_PLAFA	45	38
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1c2ccccc2C[C@H]1O	ZINC000819402039	CD	On-Demand	Anodyne	PLM2_PLAFA	22	40
O=C(/C=C\[C@H]1CCCO1)N[C@@H]1c2ccccc2C[C@@H]1O	ZINC000819402040	CD	On-Demand	Anodyne	PLM1_PLAFA	45	38
O=C(/C=C\[C@H]1CCCO1)N[C@@H]1c2ccccc2C[C@@H]1O	ZINC000819402040	CD	On-Demand	Anodyne	PLM2_PLAFA	22	40
O=C(/C=C\[C@H]1CCCO1)N[C@H]1c2ccccc2C[C@H]1O	ZINC000819402041	CD	On-Demand	Anodyne	PLM1_PLAFA	45	38
O=C(/C=C\[C@H]1CCCO1)N[C@H]1c2ccccc2C[C@H]1O	ZINC000819402041	CD	On-Demand	Anodyne	PLM2_PLAFA	22	40
O=C(/C=C/[C@H]1CCCO1)N[C@H]1c2ccccc2C[C@H]1O	ZINC000819402042	CD	On-Demand	Anodyne	PLM1_PLAFA	45	38
O=C(/C=C/[C@H]1CCCO1)N[C@H]1c2ccccc2C[C@H]1O	ZINC000819402042	CD	On-Demand	Anodyne	PLM2_PLAFA	22	40
C#Cc1cccc(NC(=O)c2ccccc2SCc2cccs2)c1	ZINC000819402051	EK	On-Demand	Mild	KCNK3	64	40
C#Cc1cccc(NC(=O)c2ccccc2SCc2cccs2)c1	ZINC000819402051	EK	On-Demand	Mild	KCNK9	60	40
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1C	ZINC000819402056	EG	On-Demand	Anodyne	ADRB2	41	53
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1C	ZINC000819402056	EG	On-Demand	Anodyne	ADRB1	64	53
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1C	ZINC000819402056	EG	On-Demand	Anodyne	GRIN1	20	41
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1C	ZINC000819402056	EG	On-Demand	Anodyne	ADRB3	38	46
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1C	ZINC000819402057	EG	On-Demand	Anodyne	ADRB2	41	53
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1C	ZINC000819402057	EG	On-Demand	Anodyne	ADRB1	64	53
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1C	ZINC000819402057	EG	On-Demand	Anodyne	GRIN1	20	41
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1C	ZINC000819402057	EG	On-Demand	Anodyne	ADRB3	38	46
CC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C(F)(F)F)cc1C	ZINC000819402080	GH	On-Demand	Anodyne	ADRB2	26	43
CC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C(F)(F)F)cc1C	ZINC000819402080	GH	On-Demand	Anodyne	ADRB1	63	36
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C(F)(F)F)cc1C	ZINC000819402081	GH	On-Demand	Anodyne	ADRB2	26	43
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C(F)(F)F)cc1C	ZINC000819402081	GH	On-Demand	Anodyne	ADRB1	63	36
CS(=O)(=O)Nc1cccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819402082	GD	On-Demand	Anodyne	ADRB2	34	40
CS(=O)(=O)Nc1cccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819402082	GD	On-Demand	Anodyne	ADRB3	53	46
CS(=O)(=O)Nc1cccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819402083	GD	On-Demand	Anodyne	ADRB2	34	40
CS(=O)(=O)Nc1cccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819402083	GD	On-Demand	Anodyne	ADRB3	53	46
CC(=O)Nc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1C	ZINC000819402086	FF	On-Demand	Anodyne	NOD1	17	41
CC(=O)Nc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1C	ZINC000819402086	FF	On-Demand	Anodyne	NOD2	46	41
CC(=O)Nc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1C	ZINC000819402087	FF	On-Demand	Anodyne	NOD1	17	41
CC(=O)Nc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1C	ZINC000819402087	FF	On-Demand	Anodyne	NOD2	46	41
CC(=O)Nc1ccc(NC[C@@H](O)COc2c(C)cccc2C)cc1C	ZINC000819402125	EG	On-Demand	Anodyne	ADRB2	23	42
CC(=O)Nc1ccc(NC[C@H](O)COc2c(C)cccc2C)cc1C	ZINC000819402126	EG	On-Demand	Anodyne	ADRB2	23	42
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1C	ZINC000819402147	FG	On-Demand	Anodyne	ADRB2	31	46
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1C	ZINC000819402147	FG	On-Demand	Anodyne	ADRB1	47	43
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1C	ZINC000819402147	FG	On-Demand	Anodyne	ADRB3	27	40
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1C	ZINC000819402147	FG	On-Demand	Anodyne	ABCB1	19	47
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1C	ZINC000819402148	FG	On-Demand	Anodyne	ADRB2	31	46
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1C	ZINC000819402148	FG	On-Demand	Anodyne	ADRB1	47	43
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1C	ZINC000819402148	FG	On-Demand	Anodyne	ADRB3	27	40
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1C	ZINC000819402148	FG	On-Demand	Anodyne	ABCB1	19	47
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819402157	FF	On-Demand	Anodyne	ADRB2	40	50
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819402157	FF	On-Demand	Anodyne	ADRB1	66	50
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819402157	FF	On-Demand	Anodyne	GRIN1	16	41
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819402157	FF	On-Demand	Anodyne	ADRB3	41	46
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819402157	FF	On-Demand	Anodyne	ACR	46	35
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819402158	FF	On-Demand	Anodyne	ADRB2	40	50
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819402158	FF	On-Demand	Anodyne	ADRB1	66	50
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819402158	FF	On-Demand	Anodyne	GRIN1	16	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819402158	FF	On-Demand	Anodyne	ADRB3	41	46
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(NC(C)=O)c(C)c2)cc1	ZINC000819402158	FF	On-Demand	Anodyne	ACR	46	35
C#Cc1cccc(NC(=O)c2oc3c(F)cccc3c2C)c1	ZINC000819402163	CI	On-Demand	Mild	KCNK3	58	34
C#Cc1cccc(NC(=O)c2cc3cc(F)ccc3s2)c1	ZINC000819402168	CI	On-Demand	Mild	PIN1	26	40
C#Cc1cccc(NC(=O)c2cc3cc(F)ccc3s2)c1	ZINC000819402168	CI	On-Demand	Mild	KCNK3	43	38
C#Cc1cccc(NC(=O)c2cc3cc(F)ccc3s2)c1	ZINC000819402168	CI	On-Demand	Mild	KCNK9	40	36
C#Cc1cccc(NC(=O)c2cc(C)n(Cc3ccccc3)c2C)c1	ZINC000819402169	EI	On-Demand	Mild	KCNK3	111	40
C#Cc1cccc(NC(=O)c2cc(C)n(Cc3ccccc3)c2C)c1	ZINC000819402169	EI	On-Demand	Mild	KCNK9	79	36
CC(=O)Nc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1C	ZINC000819402189	FF	On-Demand	Anodyne	ADRB3	16	42
CC(=O)Nc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1C	ZINC000819402190	FF	On-Demand	Anodyne	ADRB3	16	42
COc1ccccc1COC[C@H](O)CNc1ccc(NC(C)=O)c(C)c1	ZINC000819402216	FF	On-Demand	Anodyne	TSHR	40	31
COc1ccccc1COC[C@@H](O)CNc1ccc(NC(C)=O)c(C)c1	ZINC000819402217	FF	On-Demand	Anodyne	TSHR	40	31
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C(C)(C)C)cc2)cc1C	ZINC000819402223	FI	On-Demand	Anodyne	ADRB2	37	51
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C(C)(C)C)cc2)cc1C	ZINC000819402223	FI	On-Demand	Anodyne	ADRB1	60	51
CC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C(C)(C)C)cc2)cc1C	ZINC000819402223	FI	On-Demand	Anodyne	ADRB3	40	44
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)cc1C	ZINC000819402224	FI	On-Demand	Anodyne	ADRB2	37	51
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)cc1C	ZINC000819402224	FI	On-Demand	Anodyne	ADRB1	60	51
CC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)cc1C	ZINC000819402224	FI	On-Demand	Anodyne	ADRB3	40	44
COc1cc(F)ccc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819402298	DH	On-Demand	Anodyne	ADRB1	17	42
COc1cc(F)ccc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819402298	DH	On-Demand	Anodyne	ADRB3	24	44
COc1cc(F)ccc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819402299	DH	On-Demand	Anodyne	ADRB1	17	42
COc1cc(F)ccc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819402299	DH	On-Demand	Anodyne	ADRB3	24	44
CC(=O)Nc1ccc(NC[C@@H](O)Cc2ccccc2)cc1C	ZINC000819402331	CF	On-Demand	Anodyne	MME	44	35
CC(=O)Nc1ccc(NC[C@H](O)Cc2ccccc2)cc1C	ZINC000819402332	CF	On-Demand	Anodyne	MME	44	35
COc1cc(F)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819402337	EF	On-Demand	Mild	ADRB2	33	41
COc1cc(F)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819402337	EF	On-Demand	Mild	ADRB1	46	40
COc1cc(F)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819402337	EF	On-Demand	Mild	ADRB3	24	41
COc1cc(F)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819402337	EF	On-Demand	Mild	CASR	40	37
COc1cc(F)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819402338	EF	On-Demand	Mild	ADRB2	33	41
COc1cc(F)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819402338	EF	On-Demand	Mild	ADRB1	46	40
COc1cc(F)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819402338	EF	On-Demand	Mild	ADRB3	24	41
COc1cc(F)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819402338	EF	On-Demand	Mild	CASR	40	37
C#Cc1cccc(NC(=O)c2ccc(CNC(=O)OC(C)(C)C)cc2)c1	ZINC000819402362	FH	On-Demand	Mild	HDAC1	18	42
C#Cc1cccc(NC(=O)c2ccc(CNC(=O)OC(C)(C)C)cc2)c1	ZINC000819402362	FH	On-Demand	Mild	HDAC2	18	42
C#Cc1cccc(NC(=O)c2ccc(CNC(=O)OC(C)(C)C)cc2)c1	ZINC000819402362	FH	On-Demand	Mild	TAAR1	48	37
C#Cc1cccc(NC(=O)c2ccc(CNC(=O)OC(C)(C)C)cc2)c1	ZINC000819402362	FH	On-Demand	Mild	KCNK3	113	40
C#Cc1cccc(NC(=O)c2ccc(CNC(=O)OC(C)(C)C)cc2)c1	ZINC000819402362	FH	On-Demand	Mild	KCNK9	76	36
Cc1ccc(OC[C@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)c(C)c1	ZINC000819402369	FF	On-Demand	Anodyne	ADRB2	28	42
Cc1ccc(OC[C@@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)c(C)c1	ZINC000819402371	FF	On-Demand	Anodyne	ADRB2	28	42
COC[C@@H](O)CNc1ccc(OCC(=O)N(C)C)cc1	ZINC000819402375	CC	On-Demand	Anodyne	ADRB2	29	42
COC[C@@H](O)CNc1ccc(OCC(=O)N(C)C)cc1	ZINC000819402375	CC	On-Demand	Anodyne	ADRB1	44	42
COC[C@@H](O)CNc1ccc(OCC(=O)N(C)C)cc1	ZINC000819402375	CC	On-Demand	Anodyne	ADRB3	23	40
C#Cc1cccc(NC(=O)c2cc(OC)c(OCc3ccccc3)c(OC)c2)c1	ZINC000819402381	GJ	On-Demand	Mild	TSHR	47	33
C#Cc1cccc(NC(=O)c2cc(OC)c(OCc3ccccc3)c(OC)c2)c1	ZINC000819402381	GJ	On-Demand	Mild	PPIA	48	42
C#Cc1cccc(NC(=O)c2cc(OC)c(OCc3ccccc3)c(OC)c2)c1	ZINC000819402381	GJ	On-Demand	Mild	CPT1A	50	35
C#Cc1cccc(NC(=O)c2cc(OC)c(OCc3ccccc3)c(OC)c2)c1	ZINC000819402381	GJ	On-Demand	Mild	ABCB1	18	40
C#Cc1cccc(NC(=O)c2cc(OC)c(OCc3ccccc3)c(OC)c2)c1	ZINC000819402381	GJ	On-Demand	Mild	SLC6A5	17	54
C#Cc1cccc(NC(=O)c2cc(OC)c(OCc3ccccc3)c(OC)c2)c1	ZINC000819402381	GJ	On-Demand	Mild	TAAR1	45	38
C#Cc1cccc(NC(=O)c2cc(OC)c(OCc3ccccc3)c(OC)c2)c1	ZINC000819402381	GJ	On-Demand	Mild	DDR1	19	40
C#Cc1cccc(NC(=O)c2cc(OC)c(OCc3ccccc3)c(OC)c2)c1	ZINC000819402381	GJ	On-Demand	Mild	ADCYAP1R1	37	43
C#Cc1cccc(NC(=O)c2cc(OC)c(OCc3ccccc3)c(OC)c2)c1	ZINC000819402381	GJ	On-Demand	Mild	SMO	24	52
C#Cc1cccc(NC(=O)c2cc(OC)c(OCc3ccccc3)c(OC)c2)c1	ZINC000819402381	GJ	On-Demand	Mild	KCNK3	122	46
C#Cc1cccc(NC(=O)c2cc(OC)c(OCc3ccccc3)c(OC)c2)c1	ZINC000819402381	GJ	On-Demand	Mild	KCNK9	86	43
C#Cc1cccc(NC(=O)CCSc2nc3ccccc3s2)c1	ZINC000819402382	EI	On-Demand	Mild	LDHA	40	40
COc1cc(F)ccc1NC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819402412	FF	On-Demand	Anodyne	ADRB2	31	40
COc1cc(F)ccc1NC[C@H](O)COc1c(OC)cccc1OC	ZINC000819402425	FF	On-Demand	Anodyne	ADRB2	31	40
CC(=O)Nc1ccc(NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)cc1C	ZINC000819402476	GI	On-Demand	Anodyne	CYNT	43	57
COc1cc(F)ccc1NC[C@H](O)CN(C)Cc1ccccc1	ZINC000819402487	DF	On-Demand	Anodyne	GRIN2B	15	40
COc1cc(F)ccc1NC[C@@H](O)CN(C)Cc1ccccc1	ZINC000819402488	DF	On-Demand	Anodyne	GRIN2B	15	40
C#Cc1cccc(NC(=O)c2ccccc2OCc2cn3ccccc3n2)c1	ZINC000819402518	FI	On-Demand	Mild	NR2E3	43	30
C#Cc1cccc(NC(=O)c2ccccc2OCc2cn3ccccc3n2)c1	ZINC000819402518	FI	On-Demand	Mild	KCNK3	58	44
C#Cc1cccc(NC(=O)c2ccccc2OCc2cn3ccccc3n2)c1	ZINC000819402518	FI	On-Demand	Mild	KCNK9	58	44
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)cc1	ZINC000819402522	GE	On-Demand	Anodyne	ADRB2	37	47
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)cc1	ZINC000819402522	GE	On-Demand	Anodyne	ADRB1	55	47
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)cc1	ZINC000819402522	GE	On-Demand	Anodyne	ADRB3	32	41
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)cc1	ZINC000819402524	GE	On-Demand	Anodyne	ADRB2	37	47
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)cc1	ZINC000819402524	GE	On-Demand	Anodyne	ADRB1	55	47
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)cc1	ZINC000819402524	GE	On-Demand	Anodyne	ADRB3	32	41
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1C	ZINC000819402533	GH	On-Demand	Anodyne	ADRB2	23	42
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1C	ZINC000819402533	GH	On-Demand	Anodyne	ADRB1	34	40
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1C	ZINC000819402533	GH	On-Demand	Anodyne	SLC1A1	15	41
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1C	ZINC000819402533	GH	On-Demand	Anodyne	SLC1A3	18	41
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1C	ZINC000819402533	GH	On-Demand	Anodyne	SLC1A2	22	41
CC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1C	ZINC000819402533	GH	On-Demand	Anodyne	PDS	67	49
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1C	ZINC000819402536	GH	On-Demand	Anodyne	ADRB2	23	42
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1C	ZINC000819402536	GH	On-Demand	Anodyne	ADRB1	34	40
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1C	ZINC000819402536	GH	On-Demand	Anodyne	SLC1A1	15	41
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1C	ZINC000819402536	GH	On-Demand	Anodyne	SLC1A3	18	41
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1C	ZINC000819402536	GH	On-Demand	Anodyne	SLC1A2	22	41
CC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1C	ZINC000819402536	GH	On-Demand	Anodyne	PDS	67	49
C#Cc1cccc(NC(=O)CCn2c(=O)n(CCC)c3ccccc32)c1	ZINC000819402559	EG	On-Demand	Mild	ADORA2A	16	42
C#Cc1cccc(NC(=O)CCn2c(=O)n(CCC)c3ccccc32)c1	ZINC000819402559	EG	On-Demand	Mild	ADORA2B	55	42
C#Cc1cccc(NC(=O)CCn2c(=O)n(CCC)c3ccccc32)c1	ZINC000819402559	EG	On-Demand	Mild	KCNK3	54	32
COc1cc(F)ccc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819402609	EE	On-Demand	Anodyne	EDNRB	77	37
COc1cc(F)ccc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819402609	EE	On-Demand	Anodyne	EDNRA	69	38
COc1cc(F)ccc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819402611	EE	On-Demand	Anodyne	EDNRB	77	37
COc1cc(F)ccc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819402611	EE	On-Demand	Anodyne	EDNRA	69	38
C#Cc1cccc(NC[C@@H](O)COc2cccc(C(=O)OCC)c2)c1	ZINC000819402637	EF	On-Demand	Mild	ADRB2	30	49
C#Cc1cccc(NC[C@@H](O)COc2cccc(C(=O)OCC)c2)c1	ZINC000819402637	EF	On-Demand	Mild	PDS	64	48
C#Cc1cccc(NC[C@H](O)COc2cccc(C(=O)OCC)c2)c1	ZINC000819402638	EF	On-Demand	Mild	ADRB2	30	49
C#Cc1cccc(NC[C@H](O)COc2cccc(C(=O)OCC)c2)c1	ZINC000819402638	EF	On-Demand	Mild	PDS	64	48
COc1cc(F)ccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819402647	EF	On-Demand	Anodyne	ADRB2	36	41
COc1cc(F)ccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819402647	EF	On-Demand	Anodyne	ADRB1	54	39
COc1cc(F)ccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819402647	EF	On-Demand	Anodyne	ABCB1	15	47
COc1cc(F)ccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819402649	EF	On-Demand	Anodyne	ADRB2	36	41
COc1cc(F)ccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819402649	EF	On-Demand	Anodyne	ADRB1	54	39
COc1cc(F)ccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819402649	EF	On-Demand	Anodyne	ABCB1	15	47
COC(=O)c1cccc(NC2CCN(C(=O)/C=C/[C@@H]3CCCO3)CC2)c1	ZINC000819402666	FF	On-Demand	Anodyne	ITGAL	52	41
COC(=O)c1cccc(NC2CCN(C(=O)/C=C\[C@H]3CCCO3)CC2)c1	ZINC000819402667	FF	On-Demand	Anodyne	ITGAL	52	41
COC(=O)c1cccc(NC2CCN(C(=O)/C=C/[C@H]3CCCO3)CC2)c1	ZINC000819402668	FF	On-Demand	Anodyne	ITGAL	52	41
COC(=O)c1cccc(NC2CCN(C(=O)/C=C\[C@@H]3CCCO3)CC2)c1	ZINC000819402669	FF	On-Demand	Anodyne	ITGAL	52	41
COc1cc(F)ccc1NC[C@H](O)C1CCCCC1	ZINC000819402701	CG	On-Demand	Anodyne	GRIN2B	20	42
COc1cc(F)ccc1NC[C@@H](O)C1CCCCC1	ZINC000819402702	CG	On-Demand	Anodyne	GRIN2B	20	42
COc1cc(F)ccc1NC[C@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819402710	FG	On-Demand	Anodyne	ADRB2	48	42
COc1cc(F)ccc1NC[C@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819402710	FG	On-Demand	Anodyne	ADRB1	68	49
COc1cc(F)ccc1NC[C@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819402710	FG	On-Demand	Anodyne	GRIN1	22	44
COc1cc(F)ccc1NC[C@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819402710	FG	On-Demand	Anodyne	ADRB3	47	43
COc1cc(F)ccc1NC[C@@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819402711	FG	On-Demand	Anodyne	ADRB2	48	42
COc1cc(F)ccc1NC[C@@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819402711	FG	On-Demand	Anodyne	ADRB1	68	49
COc1cc(F)ccc1NC[C@@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819402711	FG	On-Demand	Anodyne	GRIN1	22	44
COc1cc(F)ccc1NC[C@@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819402711	FG	On-Demand	Anodyne	ADRB3	47	43
COC(=O)c1cccc(NC2CCN(C(=O)C(F)=C3CCC3)CC2)c1	ZINC000819402730	EG	On-Demand	Anodyne	ITGAL	40	32
O=C(CCCS(=O)(=O)c1cccc(Br)c1)NCc1ncccn1	ZINC000819402755	GE	On-Demand	Anodyne	SUCNR1	40	32
O=C(NCC1CCN(C(=O)C(F)=C2CCC2)CC1)c1ccccn1	ZINC000819402811	EE	On-Demand	Anodyne	CACNA1I	57	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(CCO)Cc1ccccc1OC)C2	ZINC000819402814	GD	On-Demand	Anodyne	MBTPS1	50	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(CCO)Cc1ccccc1OC)C2	ZINC000819402815	GD	On-Demand	Anodyne	MBTPS1	50	36
O=C(CCc1cccc(OC(F)F)c1)NCc1ncccn1	ZINC000819402823	DE	On-Demand	Anodyne	PLA2G4A	21	40
O=C(CCc1cccc(OC(F)F)c1)NCc1ncccn1	ZINC000819402823	DE	On-Demand	Anodyne	SUCNR1	46	38
O=C(CCc1cccc(OC(F)F)c1)NCc1ncccn1	ZINC000819402823	DE	On-Demand	Anodyne	PDS	55	33
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819402872	FF	On-Demand	Anodyne	ADRB2	34	43
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819402872	FF	On-Demand	Anodyne	ADRB1	63	44
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819402872	FF	On-Demand	Anodyne	GRIN1	28	43
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819402872	FF	On-Demand	Anodyne	ADRB3	44	43
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819402873	FF	On-Demand	Anodyne	ADRB2	34	43
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819402873	FF	On-Demand	Anodyne	ADRB1	63	44
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819402873	FF	On-Demand	Anodyne	GRIN1	28	43
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819402873	FF	On-Demand	Anodyne	ADRB3	44	43
N#CCc1ccc(OC[C@@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819402882	FH	On-Demand	Mild	ADRB2	42	39
N#CCc1ccc(OC[C@@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819402882	FH	On-Demand	Mild	ADRB1	68	47
N#CCc1ccc(OC[C@@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819402882	FH	On-Demand	Mild	ADRB3	44	39
N#CCc1ccc(OC[C@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819402883	FH	On-Demand	Mild	ADRB2	42	39
N#CCc1ccc(OC[C@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819402883	FH	On-Demand	Mild	ADRB1	68	47
N#CCc1ccc(OC[C@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819402883	FH	On-Demand	Mild	ADRB3	44	39
CCOc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819402913	EF	On-Demand	Anodyne	GRIN1	20	40
CCOc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819402914	EF	On-Demand	Anodyne	GRIN1	20	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC3CCCC3)cc2)c1	ZINC000819402923	FI	On-Demand	Anodyne	ADRB2	48	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC3CCCC3)cc2)c1	ZINC000819402923	FI	On-Demand	Anodyne	ADRB1	75	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC3CCCC3)cc2)c1	ZINC000819402923	FI	On-Demand	Anodyne	ADRB3	54	37
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC3CCCC3)cc2)c1	ZINC000819402923	FI	On-Demand	Anodyne	ABCB1	18	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC3CCCC3)cc2)c1	ZINC000819402924	FI	On-Demand	Anodyne	ADRB2	48	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC3CCCC3)cc2)c1	ZINC000819402924	FI	On-Demand	Anodyne	ADRB1	75	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC3CCCC3)cc2)c1	ZINC000819402924	FI	On-Demand	Anodyne	ADRB3	54	37
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC3CCCC3)cc2)c1	ZINC000819402924	FI	On-Demand	Anodyne	ABCB1	18	43
CCOC[C@H](O)CNc1ccc(OC2CCCC2)cc1	ZINC000819402934	CF	On-Demand	Anodyne	ADRB1	30	43
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2ccc3c(c2)CCO3)CC1	ZINC000819402945	FG	On-Demand	Anodyne	GPR119	23	51
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2ccc3c(c2)CCO3)CC1	ZINC000819402946	FG	On-Demand	Anodyne	GPR119	23	51
CON(C)C(=O)CCNc1cccc(OCc2ccc(F)cc2)c1	ZINC000819402962	EG	On-Demand	Anodyne	MAOB	20	42
CON(C)C(=O)CCNc1cccc(OCc2ccc(F)cc2)c1	ZINC000819402962	EG	On-Demand	Anodyne	PTGER3	43	36
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819402971	GH	On-Demand	Anodyne	ADRB2	53	61
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819402971	GH	On-Demand	Anodyne	ADRB1	84	61
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819402971	GH	On-Demand	Anodyne	ADRB3	56	50
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819402973	GH	On-Demand	Anodyne	ADRB2	53	61
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819402973	GH	On-Demand	Anodyne	ADRB1	84	61
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819402973	GH	On-Demand	Anodyne	ADRB3	56	50
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)c1	ZINC000819403009	GE	On-Demand	Anodyne	ADRB2	39	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)c1	ZINC000819403009	GE	On-Demand	Anodyne	ADRB1	58	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)c1	ZINC000819403009	GE	On-Demand	Anodyne	ADRB3	35	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)c1	ZINC000819403009	GE	On-Demand	Anodyne	ABCB1	16	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)c1	ZINC000819403009	GE	On-Demand	Anodyne	PDS	47	35
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)c1	ZINC000819403010	GE	On-Demand	Anodyne	ADRB2	39	43
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)c1	ZINC000819403010	GE	On-Demand	Anodyne	ADRB1	58	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)c1	ZINC000819403010	GE	On-Demand	Anodyne	ADRB3	35	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)c1	ZINC000819403010	GE	On-Demand	Anodyne	ABCB1	16	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)c1	ZINC000819403010	GE	On-Demand	Anodyne	PDS	47	35
O=C(NCC1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1)c1ccccn1	ZINC000819403019	ED	On-Demand	Anodyne	HTR4	45	37
O=C(NCC1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1)c1ccccn1	ZINC000819403019	ED	On-Demand	Anodyne	CACNA1I	54	33
O=C(NCC1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1)c1ccccn1	ZINC000819403020	ED	On-Demand	Anodyne	HTR4	45	37
O=C(NCC1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1)c1ccccn1	ZINC000819403020	ED	On-Demand	Anodyne	CACNA1I	54	33
O=C(NCC1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1)c1ccccn1	ZINC000819403021	ED	On-Demand	Anodyne	HTR4	45	37
O=C(NCC1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1)c1ccccn1	ZINC000819403021	ED	On-Demand	Anodyne	CACNA1I	54	33
O=C(NCC1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1)c1ccccn1	ZINC000819403022	ED	On-Demand	Anodyne	HTR4	45	37
O=C(NCC1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1)c1ccccn1	ZINC000819403022	ED	On-Demand	Anodyne	CACNA1I	54	33
C#Cc1cccc(NC(=O)c2c[nH]c3ccc(Br)cc23)c1	ZINC000819403038	EI	On-Demand	Mild	CFTR	34	41
C#Cc1cccc(NC(=O)c2c[nH]c3ccc(Br)cc23)c1	ZINC000819403038	EI	On-Demand	Mild	NR2E3	43	30
C#Cc1cccc(NC(=O)c2c[nH]c3ccc(Br)cc23)c1	ZINC000819403038	EI	On-Demand	Mild	KCNK3	54	33
C#Cc1cccc(NC(=O)c2c[nH]c3ccc(Br)cc23)c1	ZINC000819403038	EI	On-Demand	Mild	KCNK9	46	33
Cc1ccccc1[C@@H](O)CNc1cccc(NC(=O)C(C)C)c1	ZINC000819403046	DH	On-Demand	Anodyne	KCNK3	100	40
Cc1ccccc1[C@@H](O)CNc1cccc(NC(=O)C(C)C)c1	ZINC000819403046	DH	On-Demand	Anodyne	KCNK9	79	38
O[C@H](CNc1ccc(OC2CCCC2)cc1)c1cccnc1	ZINC000819403080	CH	On-Demand	Anodyne	ADRB2	26	40
O[C@H](CNc1ccc(OC2CCCC2)cc1)c1cccnc1	ZINC000819403080	CH	On-Demand	Anodyne	ADRB1	32	46
O[C@H](CNc1ccc(OC2CCCC2)cc1)c1cccnc1	ZINC000819403080	CH	On-Demand	Anodyne	ADRB3	100	48
O[C@@H](CNc1ccc(OC2CCCC2)cc1)c1cccnc1	ZINC000819403081	CH	On-Demand	Anodyne	ADRB2	26	40
O[C@@H](CNc1ccc(OC2CCCC2)cc1)c1cccnc1	ZINC000819403081	CH	On-Demand	Anodyne	ADRB1	32	46
O[C@@H](CNc1ccc(OC2CCCC2)cc1)c1cccnc1	ZINC000819403081	CH	On-Demand	Anodyne	ADRB3	100	48
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(OC3CCCC3)cc2)c1	ZINC000819403105	EI	On-Demand	Bother	ADRB3	24	40
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(OC3CCCC3)cc2)c1	ZINC000819403106	EI	On-Demand	Bother	ADRB3	24	40
COC[C@@H](O)CNc1ccc(OC2CCCC2)cc1	ZINC000819403112	CE	On-Demand	Anodyne	ADRB1	34	44
O[C@@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1cccc(C(F)(F)F)c1	ZINC000819403113	GI	On-Demand	Anodyne	CHRNA10	22	40
O[C@@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1cccc(C(F)(F)F)c1	ZINC000819403114	GI	On-Demand	Anodyne	CHRNA10	22	40
O[C@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1cccc(C(F)(F)F)c1	ZINC000819403115	GI	On-Demand	Anodyne	CHRNA10	22	40
O[C@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1cccc(C(F)(F)F)c1	ZINC000819403116	GI	On-Demand	Anodyne	CHRNA10	22	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819403123	EF	On-Demand	Anodyne	ADRB2	22	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819403123	EF	On-Demand	Anodyne	ADRB1	43	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819403123	EF	On-Demand	Anodyne	GRIN1	20	40
CC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819403124	EF	On-Demand	Anodyne	ADRB2	22	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819403124	EF	On-Demand	Anodyne	ADRB1	43	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819403124	EF	On-Demand	Anodyne	GRIN1	20	40
O[C@@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1cccnc1	ZINC000819403163	DF	On-Demand	Anodyne	ADRB1	19	40
O[C@@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1cccnc1	ZINC000819403163	DF	On-Demand	Anodyne	ADRB3	67	40
O[C@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1cccnc1	ZINC000819403165	DF	On-Demand	Anodyne	ADRB1	19	40
O[C@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1cccnc1	ZINC000819403165	DF	On-Demand	Anodyne	ADRB3	67	40
O[C@@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1cccnc1	ZINC000819403166	DF	On-Demand	Anodyne	ADRB1	19	40
O[C@@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1cccnc1	ZINC000819403166	DF	On-Demand	Anodyne	ADRB3	67	40
O[C@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1cccnc1	ZINC000819403168	DF	On-Demand	Anodyne	ADRB1	19	40
O[C@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1cccnc1	ZINC000819403168	DF	On-Demand	Anodyne	ADRB3	67	40
CC[C@H](O)CNc1ccc(OC2CCCC2)cc1	ZINC000819403181	BG	On-Demand	Anodyne	ADRB1	21	40
C#Cc1cccc(NC(=O)c2cn(CC)c3ccccc23)c1	ZINC000819403230	CH	On-Demand	Mild	CNR1	20	53
C#Cc1cccc(NC(=O)c2cn(CC)c3ccccc23)c1	ZINC000819403230	CH	On-Demand	Mild	CNR2	29	53
C#Cc1cccc(NC(=O)c2cn(CC)c3ccccc23)c1	ZINC000819403230	CH	On-Demand	Mild	KCNK3	85	38
C#Cc1cccc(NC(=O)c2cn(CC)c3ccccc23)c1	ZINC000819403230	CH	On-Demand	Mild	KCNK9	71	38
COC[C@@H](O)CNc1ccc(OCC(C)C)c(Cl)c1	ZINC000819403235	CF	On-Demand	Anodyne	ADRB2	18	41
C#Cc1cccc(NC(=O)c2ccc3c(c2)-c2ccccc2C3)c1	ZINC000819403242	DI	On-Demand	Mild	TAAR1	51	40
C#Cc1cccc(NC(=O)c2ccc3c(c2)-c2ccccc2C3)c1	ZINC000819403242	DI	On-Demand	Mild	KCNK3	108	40
C#Cc1cccc(NC(=O)c2ccc3c(c2)-c2ccccc2C3)c1	ZINC000819403242	DI	On-Demand	Mild	KCNK9	59	39
O=C(NCCO)C1CCN(C(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819403249	FD	On-Demand	Anodyne	C3AR1	40	38
O=C(NCCO)C1CCN(C(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819403249	FD	On-Demand	Anodyne	CACNA1G	35	42
O=C1CCc2cc(OC[C@H](O)CNc3ccc(OC4CCCC4)cc3)ccc2N1	ZINC000819403360	GH	On-Demand	Anodyne	ADRB1	33	40
O=C1CCc2cc(OC[C@@H](O)CNc3ccc(OC4CCCC4)cc3)ccc2N1	ZINC000819403361	GH	On-Demand	Anodyne	ADRB1	33	40
O[C@@H](CNc1ccc2c(c1)CCO2)c1cccnc1	ZINC000819403373	CE	On-Demand	Anodyne	ADRB3	78	40
O[C@H](CNc1ccc2c(c1)CCO2)c1cccnc1	ZINC000819403374	CE	On-Demand	Anodyne	ADRB3	78	40
O=C(c1nn(-c2cccc(Cl)c2F)c2c1CCC2)N1CCc2ncccc21	ZINC000819403375	GH	On-Demand	Anodyne	CNR1	51	31
CCOC[C@H](O)CNc1ccc(OCC(C)C)c(Cl)c1	ZINC000819403432	DG	On-Demand	Anodyne	ADRB2	17	40
NC(=O)CCNc1ccc(OC2CCCC2)cc1	ZINC000819403446	BE	On-Demand	Anodyne	EPHX2	25	44
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(S(N)(=O)=O)cc3)CC2)c1	ZINC000819403490	ID	On-Demand	Mild	CA2	37	43
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(S(N)(=O)=O)cc3)CC2)c1	ZINC000819403490	ID	On-Demand	Mild	CA1	30	43
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(S(N)(=O)=O)cc3)CC2)c1	ZINC000819403490	ID	On-Demand	Mild	CA14	19	43
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(S(N)(=O)=O)cc3)CC2)c1	ZINC000819403490	ID	On-Demand	Mild	EPHX2	39	47
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(S(N)(=O)=O)cc3)CC2)c1	ZINC000819403490	ID	On-Demand	Mild	TGM2	63	37
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(S(N)(=O)=O)cc3)CC2)c1	ZINC000819403490	ID	On-Demand	Mild	CA12	26	43
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(S(N)(=O)=O)cc3)CC2)c1	ZINC000819403490	ID	On-Demand	Mild	CA9	27	43
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(S(N)(=O)=O)cc3)CC2)c1	ZINC000819403490	ID	On-Demand	Mild	F13A1	79	37
C#Cc1cccc(NC(=O)C2CCN(S(=O)(=O)c3ccc(S(N)(=O)=O)cc3)CC2)c1	ZINC000819403490	ID	On-Demand	Mild	P96878_MYCTU	45	39
C#Cc1cccc(NC(=O)CCc2ccc(N(C)C)cc2)c1	ZINC000819403493	CG	On-Demand	Mild	FFAR1	23	46
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819403521	EE	On-Demand	Anodyne	ADRB2	30	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819403521	EE	On-Demand	Anodyne	ADRB1	61	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819403521	EE	On-Demand	Anodyne	GRIN1	26	40
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819403521	EE	On-Demand	Anodyne	ADRB3	36	47
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819403522	EE	On-Demand	Anodyne	ADRB2	30	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819403522	EE	On-Demand	Anodyne	ADRB1	61	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819403522	EE	On-Demand	Anodyne	GRIN1	26	40
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819403522	EE	On-Demand	Anodyne	ADRB3	36	47
O=C(CCNc1ccc2c(c1)CCO2)Nc1cccnc1	ZINC000819403534	CE	On-Demand	Anodyne	MTNR1B	19	41
CC(C)[C@H]1CN(C(=O)[C@@H](CNC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819403575	GH	On-Demand	Anodyne	SSTR2	48	38
CC(C)[C@H]1CN(C(=O)[C@@H](CNC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819403575	GH	On-Demand	Anodyne	FPR1	45	37
CC(C)[C@H]1CN(C(=O)[C@H](CNC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819403576	GH	On-Demand	Anodyne	SSTR2	48	38
CC(C)[C@H]1CN(C(=O)[C@H](CNC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819403576	GH	On-Demand	Anodyne	FPR1	45	37
COC(=O)N[C@@H](C(=O)N1CCCO[C@@H](C(C)C)C1)C(C)C	ZINC000819403607	DD	On-Demand	Anodyne	ELANE	15	40
COC(=O)N[C@@H](C(=O)N1CCCO[C@H](C(C)C)C1)C(C)C	ZINC000819403608	DD	On-Demand	Anodyne	ELANE	15	40
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)CCCO1	ZINC000819403615	FE	On-Demand	Anodyne	PREP	41	42
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)CCCO1	ZINC000819403617	FE	On-Demand	Anodyne	PREP	41	42
CC(C)[C@H]1CN(C(=O)Cc2ccccc2NC(=O)OC(C)(C)C)CCCO1	ZINC000819403625	GH	On-Demand	Anodyne	FPR1	41	33
CCCCCCCC(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819403641	CH	On-Demand	Mild	CQSS	53	34
CCCCCCCC(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819403642	CH	On-Demand	Mild	CQSS	53	34
CON(C)C(=O)CCNc1cccc(NC(=O)C(C)C)c1	ZINC000819403652	CE	On-Demand	Anodyne	KCNK3	64	35
CON(C)C(=O)CCNc1cccc(NC(=O)C(C)C)c1	ZINC000819403652	CE	On-Demand	Anodyne	KCNK9	59	35
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)c(Cl)c2)cc1	ZINC000819403668	GI	On-Demand	Anodyne	ADRB2	35	46
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)c(Cl)c2)cc1	ZINC000819403668	GI	On-Demand	Anodyne	ADRB1	58	46
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC(C)C)c(Cl)c2)cc1	ZINC000819403669	GI	On-Demand	Anodyne	ADRB2	35	46
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC(C)C)c(Cl)c2)cc1	ZINC000819403669	GI	On-Demand	Anodyne	ADRB1	58	46
C#Cc1cccc(NC(=O)c2ccccc2SCc2ccco2)c1	ZINC000819403670	EJ	On-Demand	Mild	NR2E3	51	32
C#Cc1cccc(NC(=O)c2ccccc2SCc2ccco2)c1	ZINC000819403670	EJ	On-Demand	Mild	KCNK3	66	39
C#Cc1cccc(NC(=O)c2ccccc2SCc2ccco2)c1	ZINC000819403670	EJ	On-Demand	Mild	KCNK9	54	34
C#Cc1cccc(NC(=O)c2cc3ccccc3cc2NS(C)(=O)=O)c1	ZINC000819403673	FG	On-Demand	Mild	PLA2G7	29	42
C#Cc1cccc(NC(=O)c2cc3ccccc3cc2NS(C)(=O)=O)c1	ZINC000819403673	FG	On-Demand	Mild	KCNK3	95	37
C#Cc1cccc(NC(=O)c2cc3ccccc3cc2NS(C)(=O)=O)c1	ZINC000819403673	FG	On-Demand	Mild	KCNK9	77	37
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc(OC2CCCC2)cc1	ZINC000819403700	GH	On-Demand	Anodyne	ADRB2	40	44
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc(OC2CCCC2)cc1	ZINC000819403700	GH	On-Demand	Anodyne	ADRB1	53	44
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc(OC2CCCC2)cc1	ZINC000819403700	GH	On-Demand	Anodyne	ADRB3	26	41
COc1cccc(OC)c1OC[C@H](O)CNc1ccc(OC2CCCC2)cc1	ZINC000819403702	GH	On-Demand	Anodyne	ADRB2	40	44
COc1cccc(OC)c1OC[C@H](O)CNc1ccc(OC2CCCC2)cc1	ZINC000819403702	GH	On-Demand	Anodyne	ADRB1	53	44
COc1cccc(OC)c1OC[C@H](O)CNc1ccc(OC2CCCC2)cc1	ZINC000819403702	GH	On-Demand	Anodyne	ADRB3	26	41
O[C@@H](CNc1ccc2c(c1)CCO2)COc1cccc(C(F)(F)F)c1	ZINC000819403707	FG	On-Demand	Anodyne	PDS	45	41
O[C@H](CNc1ccc2c(c1)CCO2)COc1cccc(C(F)(F)F)c1	ZINC000819403709	FG	On-Demand	Anodyne	PDS	45	41
CCCN(C(=O)c1ccccc1NC(=O)c1cc2c(cn1)OCCO2)C(C)C	ZINC000819403716	GG	On-Demand	Anodyne	G2YM83_BOTF4	44	31
COc1cccc([S@@](=O)CC(=O)NCCc2cnc(C)s2)c1	ZINC000819403731	ED	On-Demand	Anodyne	MTNR1A	62	39
COc1cccc([S@@](=O)CC(=O)NCCc2cnc(C)s2)c1	ZINC000819403731	ED	On-Demand	Anodyne	MTNR1B	58	39
Cc1ccc(OC[C@@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)cc1	ZINC000819403738	FE	On-Demand	Anodyne	ADRB2	45	51
Cc1ccc(OC[C@@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)cc1	ZINC000819403738	FE	On-Demand	Anodyne	ADRB1	62	46
Cc1ccc(OC[C@@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)cc1	ZINC000819403738	FE	On-Demand	Anodyne	ADRB3	37	42
Cc1ccc(OC[C@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)cc1	ZINC000819403741	FE	On-Demand	Anodyne	ADRB2	45	51
Cc1ccc(OC[C@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)cc1	ZINC000819403741	FE	On-Demand	Anodyne	ADRB1	62	46
Cc1ccc(OC[C@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)cc1	ZINC000819403741	FE	On-Demand	Anodyne	ADRB3	37	42
O=S1(=O)CCCN1c1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819403764	FG	On-Demand	Anodyne	CDK1	15	43
O[C@@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1cc(F)ccc1F	ZINC000819403783	EH	On-Demand	Anodyne	CHRNA10	40	37
O[C@@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1cc(F)ccc1F	ZINC000819403785	EH	On-Demand	Anodyne	CHRNA10	40	37
O=S1(=O)CCCN1c1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819403786	EE	On-Demand	Anodyne	CDK1	15	41
O[C@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1cc(F)ccc1F	ZINC000819403787	EH	On-Demand	Anodyne	CHRNA10	40	37
O=S1(=O)CCCN1c1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819403788	EE	On-Demand	Anodyne	CDK1	15	41
O[C@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1cc(F)ccc1F	ZINC000819403790	EH	On-Demand	Anodyne	CHRNA10	40	37
CON(C)C(=O)CCNc1ccc2c(c1)CCC(=O)N2	ZINC000819403796	CD	On-Demand	Anodyne	PKM	41	43
COC[C@@H](C)OC[C@H](O)CNc1ccc(OC2CCCC2)cc1	ZINC000819403842	DF	On-Demand	Anodyne	ADRB1	27	42
C#Cc1cccc(NC(=O)CCc2ccc3c(c2)OCCO3)c1	ZINC000819403847	DG	On-Demand	Mild	LUXR	28	43
COC[C@@H](C)OC[C@@H](O)CNc1ccc(OC2CCCC2)cc1	ZINC000819403848	DF	On-Demand	Anodyne	ADRB1	27	42
O[C@@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1cccc(Cl)c1	ZINC000819403871	EI	On-Demand	Anodyne	ADRB1	26	42
O[C@@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1cccc(Cl)c1	ZINC000819403871	EI	On-Demand	Anodyne	ADRB3	40	42
O[C@@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1cccc(Cl)c1	ZINC000819403871	EI	On-Demand	Anodyne	CYP3A4	47	35
O[C@@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1cccc(Cl)c1	ZINC000819403872	EI	On-Demand	Anodyne	ADRB1	26	42
O[C@@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1cccc(Cl)c1	ZINC000819403872	EI	On-Demand	Anodyne	ADRB3	40	42
O[C@@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1cccc(Cl)c1	ZINC000819403872	EI	On-Demand	Anodyne	CYP3A4	47	35
O[C@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1cccc(Cl)c1	ZINC000819403873	EI	On-Demand	Anodyne	ADRB1	26	42
O[C@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1cccc(Cl)c1	ZINC000819403873	EI	On-Demand	Anodyne	ADRB3	40	42
O[C@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1cccc(Cl)c1	ZINC000819403873	EI	On-Demand	Anodyne	CYP3A4	47	35
O[C@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1cccc(Cl)c1	ZINC000819403874	EI	On-Demand	Anodyne	ADRB1	26	42
O[C@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1cccc(Cl)c1	ZINC000819403874	EI	On-Demand	Anodyne	ADRB3	40	42
O[C@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1cccc(Cl)c1	ZINC000819403874	EI	On-Demand	Anodyne	CYP3A4	47	35
O[C@@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1ccc(F)cc1	ZINC000819403876	EH	On-Demand	Anodyne	CHRNA10	44	38
O[C@@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1ccc(F)cc1	ZINC000819403878	EH	On-Demand	Anodyne	CHRNA10	44	38
O[C@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1ccc(F)cc1	ZINC000819403880	EH	On-Demand	Anodyne	CHRNA10	44	38
O[C@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1ccc(F)cc1	ZINC000819403881	EH	On-Demand	Anodyne	CHRNA10	44	38
O=S1(=O)CCCN1c1ccc(NC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819403890	FF	On-Demand	Anodyne	CDK1	15	41
O=S1(=O)CCCN1c1ccc(NC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819403892	FF	On-Demand	Anodyne	CDK1	15	41
CS(=O)(=O)c1ccc([C@@H](O)CNc2cccc(OC3CCCC3)c2)cc1	ZINC000819403901	GH	On-Demand	Anodyne	ADRB3	46	38
CS(=O)(=O)c1ccc([C@H](O)CNc2cccc(OC3CCCC3)c2)cc1	ZINC000819403903	GH	On-Demand	Anodyne	ADRB3	46	38
O=S1(=O)CCCN1c1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819403917	FF	On-Demand	Anodyne	CDK1	15	45
O=S1(=O)CCCN1c1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819403918	FF	On-Demand	Anodyne	CDK1	15	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H](O)c1cccnc1	ZINC000819403924	DD	On-Demand	Anodyne	ADRB1	17	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H](O)c1cccnc1	ZINC000819403924	DD	On-Demand	Anodyne	ADRB3	55	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H](O)c1cccnc1	ZINC000819403925	DD	On-Demand	Anodyne	ADRB1	17	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H](O)c1cccnc1	ZINC000819403925	DD	On-Demand	Anodyne	ADRB3	55	40
Cc1ncc(CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819403931	FF	On-Demand	Mild	PAPA1_CARPA	45	47
Cc1ncc(CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819403932	FF	On-Demand	Mild	PAPA1_CARPA	45	47
O=C(NC[C@H](O)c1cccnc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819403946	EF	On-Demand	Anodyne	ADRB2	18	41
O=C(NC[C@H](O)c1cccnc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819403946	EF	On-Demand	Anodyne	ADRB1	20	41
O=C(NC[C@H](O)c1cccnc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819403946	EF	On-Demand	Anodyne	ADRB3	84	43
O=C(NC[C@@H](O)c1cccnc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819403947	EF	On-Demand	Anodyne	ADRB2	18	41
O=C(NC[C@@H](O)c1cccnc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819403947	EF	On-Demand	Anodyne	ADRB1	20	41
O=C(NC[C@@H](O)c1cccnc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819403947	EF	On-Demand	Anodyne	ADRB3	84	43
CC[C@H](C)N(CC(=O)Nc1cccc(C)c1C)S(=O)(=O)c1ccc(O)c([N+](=O)[O-])c1	ZINC000819403951	IG	On-Demand	Bother	COLA	92	39
C#Cc1ccc(C(=O)N2CCCO[C@H](C(C)C)C2)cn1	ZINC000819403978	CD	On-Demand	Mild	L3MBTL3	49	40
C#Cc1ccc(C(=O)N2CCCO[C@@H](C(C)C)C2)cn1	ZINC000819403979	CD	On-Demand	Mild	L3MBTL3	49	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC(C)C)c(Cl)c2)c1	ZINC000819404009	GI	On-Demand	Anodyne	ADRB2	29	44
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC(C)C)c(Cl)c2)c1	ZINC000819404009	GI	On-Demand	Anodyne	ADRB1	45	39
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC(C)C)c(Cl)c2)c1	ZINC000819404009	GI	On-Demand	Anodyne	ABCB1	18	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC(C)C)c(Cl)c2)c1	ZINC000819404009	GI	On-Demand	Anodyne	PDS	56	38
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC(C)C)c(Cl)c2)c1	ZINC000819404011	GI	On-Demand	Anodyne	ADRB2	29	44
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC(C)C)c(Cl)c2)c1	ZINC000819404011	GI	On-Demand	Anodyne	ADRB1	45	39
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC(C)C)c(Cl)c2)c1	ZINC000819404011	GI	On-Demand	Anodyne	ABCB1	18	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC(C)C)c(Cl)c2)c1	ZINC000819404011	GI	On-Demand	Anodyne	PDS	56	38
O[C@H](CNc1ccc(SC2CCCC2)cc1)c1cccnc1	ZINC000819404013	DI	On-Demand	Anodyne	ADRB3	86	46
O[C@H](CNc1ccc(SC2CCCC2)cc1)c1cccnc1	ZINC000819404013	DI	On-Demand	Anodyne	VCP	43	33
O[C@@H](CNc1ccc(SC2CCCC2)cc1)c1cccnc1	ZINC000819404015	DI	On-Demand	Anodyne	ADRB3	86	46
O[C@@H](CNc1ccc(SC2CCCC2)cc1)c1cccnc1	ZINC000819404015	DI	On-Demand	Anodyne	VCP	43	33
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)c(Cl)c2)cc1	ZINC000819404022	GH	On-Demand	Anodyne	ADRB2	43	58
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)c(Cl)c2)cc1	ZINC000819404022	GH	On-Demand	Anodyne	ADRB1	73	58
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)c(Cl)c2)cc1	ZINC000819404022	GH	On-Demand	Anodyne	GRIN1	29	41
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)c(Cl)c2)cc1	ZINC000819404022	GH	On-Demand	Anodyne	ADRB3	44	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC(C)C)c(Cl)c2)cc1	ZINC000819404026	GH	On-Demand	Anodyne	ADRB2	43	58
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC(C)C)c(Cl)c2)cc1	ZINC000819404026	GH	On-Demand	Anodyne	ADRB1	73	58
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC(C)C)c(Cl)c2)cc1	ZINC000819404026	GH	On-Demand	Anodyne	GRIN1	29	41
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC(C)C)c(Cl)c2)cc1	ZINC000819404026	GH	On-Demand	Anodyne	ADRB3	44	48
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	SSTR2	52	34
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	GHRHR	61	35
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	CELA1	29	40
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	PGC	54	35
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	CMA1	31	43
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	CTRA_BOVIN	61	33
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	KLK3	68	33
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	CTSB	43	42
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	PAPA1_CARPA	54	38
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	TRY1_BOVIN	39	40
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	CYSP_TRYCR	51	36
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	CCKAR	65	42
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	CTSG	42	33
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	CTSK	50	45
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	CTSL	50	45
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	CACNA1B	48	38
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	CAPNS1	58	34
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	CELA2A	51	33
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	REN	79	40
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	CCKBR	29	42
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	CTSS	32	45
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	CAPN1	62	41
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	CAPN2	96	38
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	TGM2	24	42
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	KLK5	48	56
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	FPR1	51	41
CC(C)[C@H]1CN(C(=O)[C@H](CC(=O)OCc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404052	IG	On-Demand	Anodyne	NPR	62	33
CC(C)[C@H]1CN(C(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCC3)c2)CCCO1	ZINC000819404057	IG	On-Demand	Anodyne	CNR2	18	61
CC(C)[C@H]1CN(C(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCC3)c2)CCCO1	ZINC000819404057	IG	On-Demand	Anodyne	L3MBTL3	52	36
CC(C)[C@H]1CN(C(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCC3)c2)CCCO1	ZINC000819404057	IG	On-Demand	Anodyne	HPGD	40	37
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)CCCO1	ZINC000819404064	FF	On-Demand	Anodyne	ACE	32	42
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)CCCO1	ZINC000819404064	FF	On-Demand	Anodyne	CPT2	47	38
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)CCCO1	ZINC000819404064	FF	On-Demand	Anodyne	PREP	106	63
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)CCCO1	ZINC000819404064	FF	On-Demand	Anodyne	SFRP1	43	40
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)CCCO1	ZINC000819404064	FF	On-Demand	Anodyne	WNT3	48	40
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCCN2C(=O)c2ccccc2)CCCO1	ZINC000819404064	FF	On-Demand	Anodyne	L3MBTL3	46	33
CC(C)[C@H]1CN(C(=O)[C@H]2CCCCN2C(=O)c2ccccc2)CCCO1	ZINC000819404065	FF	On-Demand	Anodyne	ACE	32	42
CC(C)[C@H]1CN(C(=O)[C@H]2CCCCN2C(=O)c2ccccc2)CCCO1	ZINC000819404065	FF	On-Demand	Anodyne	CPT2	47	38
CC(C)[C@H]1CN(C(=O)[C@H]2CCCCN2C(=O)c2ccccc2)CCCO1	ZINC000819404065	FF	On-Demand	Anodyne	PREP	106	63
CC(C)[C@H]1CN(C(=O)[C@H]2CCCCN2C(=O)c2ccccc2)CCCO1	ZINC000819404065	FF	On-Demand	Anodyne	SFRP1	43	40
CC(C)[C@H]1CN(C(=O)[C@H]2CCCCN2C(=O)c2ccccc2)CCCO1	ZINC000819404065	FF	On-Demand	Anodyne	WNT3	48	40
CC(C)[C@H]1CN(C(=O)[C@H]2CCCCN2C(=O)c2ccccc2)CCCO1	ZINC000819404065	FF	On-Demand	Anodyne	L3MBTL3	46	33
COc1cc(F)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819404090	EF	On-Demand	Anodyne	ADRB2	34	44
COc1cc(F)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819404090	EF	On-Demand	Anodyne	ADRB1	57	39
COc1cc(F)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819404090	EF	On-Demand	Anodyne	ABCB1	23	43
COc1cc(F)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819404090	EF	On-Demand	Anodyne	ACKR3	46	31
COc1cc(F)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819404093	EF	On-Demand	Anodyne	ADRB2	34	44
COc1cc(F)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819404093	EF	On-Demand	Anodyne	ADRB1	57	39
COc1cc(F)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819404093	EF	On-Demand	Anodyne	ABCB1	23	43
COc1cc(F)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819404093	EF	On-Demand	Anodyne	ACKR3	46	31
CC(C)[C@H]1CN(C(=O)[C@H]2Cc3ccccc3CN2C(=O)OC(C)(C)C)CCCO1	ZINC000819404100	HH	On-Demand	Anodyne	PREP	39	49
CC(C)[C@H]1CN(C(=O)[C@H]2Cc3ccccc3CN2C(=O)OC(C)(C)C)CCCO1	ZINC000819404100	HH	On-Demand	Anodyne	ADAM9	41	32
C#Cc1cccc(NC[C@@H](O)CO[C@H](C)c2ccc(Cl)cc2)c1	ZINC000819404108	EH	On-Demand	Mild	CASR	15	41
C#Cc1cccc(NC[C@@H](O)CO[C@@H](C)c2ccc(Cl)cc2)c1	ZINC000819404109	EH	On-Demand	Mild	CASR	15	41
C#Cc1cccc(NC[C@H](O)CO[C@H](C)c2ccc(Cl)cc2)c1	ZINC000819404110	EH	On-Demand	Mild	CASR	15	41
C#Cc1cccc(NC[C@H](O)CO[C@@H](C)c2ccc(Cl)cc2)c1	ZINC000819404111	EH	On-Demand	Mild	CASR	15	41
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)cc2OC)cc1	ZINC000819404119	EE	On-Demand	Anodyne	ADRB2	46	45
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)cc2OC)cc1	ZINC000819404119	EE	On-Demand	Anodyne	ADRB1	67	41
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)cc2OC)cc1	ZINC000819404119	EE	On-Demand	Anodyne	ADRB3	38	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)cc2OC)cc1	ZINC000819404121	EE	On-Demand	Anodyne	ADRB2	46	45
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)cc2OC)cc1	ZINC000819404121	EE	On-Demand	Anodyne	ADRB1	67	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)cc2OC)cc1	ZINC000819404121	EE	On-Demand	Anodyne	ADRB3	38	41
COc1cccc([S@@](=O)CC(=O)N2CCc3ncccc32)c1	ZINC000819404200	DD	On-Demand	Anodyne	DRD4	41	33
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc(OC2CCCC2)c1	ZINC000819404202	FH	On-Demand	Anodyne	ADRB1	17	40
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc(OC2CCCC2)c1	ZINC000819404204	FH	On-Demand	Anodyne	ADRB1	17	40
O[C@@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1ccc(OC(F)(F)F)cc1	ZINC000819404250	GI	On-Demand	Anodyne	CTSS	16	40
O[C@@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1ccc(OC(F)(F)F)cc1	ZINC000819404252	GI	On-Demand	Anodyne	CTSS	16	40
O[C@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1ccc(OC(F)(F)F)cc1	ZINC000819404255	GI	On-Demand	Anodyne	CTSS	16	40
O[C@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1ccc(OC(F)(F)F)cc1	ZINC000819404257	GI	On-Demand	Anodyne	CTSS	16	40
O[C@@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1cccc(F)c1	ZINC000819404258	EH	On-Demand	Anodyne	CHRNA10	42	41
O[C@@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1cccc(F)c1	ZINC000819404260	EH	On-Demand	Anodyne	CHRNA10	42	41
O[C@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1cccc(F)c1	ZINC000819404262	EH	On-Demand	Anodyne	CHRNA10	42	41
O[C@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1cccc(F)c1	ZINC000819404264	EH	On-Demand	Anodyne	CHRNA10	42	41
NC(=O)NC(=O)CCNc1ccc(OC2CCCC2)cc1	ZINC000819404266	CE	On-Demand	Anodyne	EPHX2	17	40
C#Cc1cccc(NC(=O)c2sc(-c3ccc(OC)cc3)nc2C)c1	ZINC000819404268	EI	On-Demand	Mild	SCN10A	45	37
C#Cc1cccc(NC(=O)c2sc(-c3ccc(OC)cc3)nc2C)c1	ZINC000819404268	EI	On-Demand	Mild	KCNK3	55	38
C#Cc1cccc(NC(=O)c2sc(-c3ccc(OC)cc3)nc2C)c1	ZINC000819404268	EI	On-Demand	Mild	KCNK9	48	34
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2cccnc2)c1	ZINC000819404335	ED	On-Demand	Anodyne	ADRB1	20	45
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2cccnc2)c1	ZINC000819404335	ED	On-Demand	Anodyne	ADRB3	51	45
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2cccnc2)c1	ZINC000819404343	ED	On-Demand	Anodyne	ADRB1	20	45
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2cccnc2)c1	ZINC000819404343	ED	On-Demand	Anodyne	ADRB3	51	45
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc2c(c1)CCC(=O)N2	ZINC000819404346	EE	On-Demand	Anodyne	PKM	38	40
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc2c(c1)CCC(=O)N2	ZINC000819404348	EE	On-Demand	Anodyne	PKM	38	40
Cc1c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cnn1-c1ccccc1	ZINC000819404372	GH	On-Demand	Mild	PAPA1_CARPA	51	45
Cc1c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cnn1-c1ccccc1	ZINC000819404372	GH	On-Demand	Mild	CTSL	15	45
Cc1c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cnn1-c1ccccc1	ZINC000819404372	GH	On-Demand	Mild	FPR1	46	38
Cc1c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cnn1-c1ccccc1	ZINC000819404375	GH	On-Demand	Mild	PAPA1_CARPA	51	45
Cc1c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cnn1-c1ccccc1	ZINC000819404375	GH	On-Demand	Mild	CTSL	15	45
Cc1c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cnn1-c1ccccc1	ZINC000819404375	GH	On-Demand	Mild	FPR1	46	38
CC(C)[C@H]1CN(C(=O)C[C@@H](C)C2CCN(C(=O)OC(C)(C)C)CC2)CCCO1	ZINC000819404384	GH	On-Demand	Anodyne	GPR119	19	41
CC(C)[C@H]1CN(C(=O)C[C@H](C)C2CCN(C(=O)OC(C)(C)C)CC2)CCCO1	ZINC000819404387	GH	On-Demand	Anodyne	GPR119	19	41
CCCN(C(=O)c1ccccc1NC(=O)c1cnc2cc(OC)ccn12)C(C)C	ZINC000819404392	GH	On-Demand	Anodyne	EPHB3	26	41
CC(C)[C@H]1CN(C(=O)COc2cccc(C#N)c2)CCCO1	ZINC000819404422	DE	On-Demand	Mild	CPT1A	85	42
CC(C)[C@H]1CN(C(=O)COc2cccc(C#N)c2)CCCO1	ZINC000819404422	DE	On-Demand	Mild	CPT2	42	35
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	F2	33	49
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	PLG	30	49
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	PRSS1	15	46
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	ACE	78	42
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	SSTR2	56	37
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	GHRHR	71	35
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	P2RY12	48	36
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	CELA1	26	51
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	MME	77	42
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	TACR1	16	46
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	CTSD	33	41
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	PGC	75	41
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	MC4R	73	40
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	CMA1	46	45
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	CTRA_BOVIN	47	47
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	FCER2	45	30
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	CTSB	41	37
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	TRY2_BOVIN	69	34
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	PAPA1_CARPA	69	48
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	TRY1_BOVIN	44	49
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	CYSP_TRYCR	57	38
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	CCKAR	69	46
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	CTSK	51	47
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	CTSL	50	48
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	CACNA1B	70	41
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	PGA	30	41
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	NPFFR2	52	31
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	PREP	24	47
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	TACR3	18	43
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	MC5R	46	34
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	CAPNS1	67	33
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	HLA-DRB1	32	41
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	CELA2A	53	35
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	REN	116	47
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	REN1	24	40
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	CCKBR	42	43
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	CTSS	31	48
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	CAPN1	70	45
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	CAPN2	55	35
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	ACE2	77	36
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	KLK5	34	43
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	FPR1	74	47
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	CTRB_BOVIN	47	42
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404443	GG	On-Demand	Anodyne	BRCA1	61	33
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	F2	33	49
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	PLG	30	49
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	PRSS1	15	46
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	ACE	78	42
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	SSTR2	56	37
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	GHRHR	71	35
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	P2RY12	48	36
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	CELA1	26	51
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	MME	77	42
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	TACR1	16	46
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	CTSD	33	41
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	PGC	75	41
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	MC4R	73	40
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	CMA1	46	45
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	CTRA_BOVIN	47	47
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	FCER2	45	30
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	CTSB	41	37
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	TRY2_BOVIN	69	34
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	PAPA1_CARPA	69	48
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	TRY1_BOVIN	44	49
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	CYSP_TRYCR	57	38
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	CCKAR	69	46
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	CTSK	51	47
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	CTSL	50	48
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	CACNA1B	70	41
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	PGA	30	41
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	NPFFR2	52	31
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	PREP	24	47
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	TACR3	18	43
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	MC5R	46	34
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	CAPNS1	67	33
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	HLA-DRB1	32	41
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	CELA2A	53	35
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	REN	116	47
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	REN1	24	40
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	CCKBR	42	43
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	CTSS	31	48
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	CAPN1	70	45
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	CAPN2	55	35
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	ACE2	77	36
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	KLK5	34	43
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	FPR1	74	47
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	CTRB_BOVIN	47	42
CC(C)[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819404444	GG	On-Demand	Anodyne	BRCA1	61	33
C=CCC1(C(=O)NC[C@H](O)c2cccnc2)CCOCC1	ZINC000819404453	CD	On-Demand	Mild	ADRB1	18	41
C=CCC1(C(=O)NC[C@H](O)c2cccnc2)CCOCC1	ZINC000819404453	CD	On-Demand	Mild	ADRB3	67	41
C=CCC1(C(=O)NC[C@@H](O)c2cccnc2)CCOCC1	ZINC000819404454	CD	On-Demand	Mild	ADRB1	18	41
C=CCC1(C(=O)NC[C@@H](O)c2cccnc2)CCOCC1	ZINC000819404454	CD	On-Demand	Mild	ADRB3	67	41
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1ccc2c(c1)CCC(=O)N2	ZINC000819404455	FD	On-Demand	Anodyne	PKM	43	45
O=S1(=O)CCCN1c1ccc(NC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819404457	FD	On-Demand	Anodyne	CDK1	15	41
O=S1(=O)CCCN1c1ccc(NC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819404458	FD	On-Demand	Anodyne	CDK1	15	41
O=C1CCc2cc(NC[C@H](O)c3cccc(C(F)(F)F)c3)ccc2N1	ZINC000819404475	FH	On-Demand	Anodyne	KIF11	15	63
O=C1CCc2cc(NC[C@H](O)c3cccc(C(F)(F)F)c3)ccc2N1	ZINC000819404475	FH	On-Demand	Anodyne	PTK2B	20	40
O=C1CCc2cc(NC[C@@H](O)c3cccc(C(F)(F)F)c3)ccc2N1	ZINC000819404476	FH	On-Demand	Anodyne	KIF11	15	63
O=C1CCc2cc(NC[C@@H](O)c3cccc(C(F)(F)F)c3)ccc2N1	ZINC000819404476	FH	On-Demand	Anodyne	PTK2B	20	40
C=CCCn1cc(C(=O)NC[C@@H](O)c2cccnc2)nn1	ZINC000819404492	CC	On-Demand	Mild	ADRB3	44	38
C=CCCn1cc(C(=O)NC[C@@H](O)c2cccnc2)nn1	ZINC000819404492	CC	On-Demand	Mild	SCD1	16	43
C=CCCn1cc(C(=O)NC[C@@H](O)c2cccnc2)nn1	ZINC000819404492	CC	On-Demand	Mild	SCD	28	41
C=CCCn1cc(C(=O)NC[C@H](O)c2cccnc2)nn1	ZINC000819404493	CC	On-Demand	Mild	ADRB3	44	38
C=CCCn1cc(C(=O)NC[C@H](O)c2cccnc2)nn1	ZINC000819404493	CC	On-Demand	Mild	SCD1	16	43
C=CCCn1cc(C(=O)NC[C@H](O)c2cccnc2)nn1	ZINC000819404493	CC	On-Demand	Mild	SCD	28	41
O=C1CCc2cc(NC[C@H](O)c3ccccc3C(F)(F)F)ccc2N1	ZINC000819404495	FH	On-Demand	Anodyne	PTK2B	24	47
O=C1CCc2cc(NC[C@@H](O)c3ccccc3C(F)(F)F)ccc2N1	ZINC000819404496	FH	On-Demand	Anodyne	PTK2B	24	47
O=C1CCc2cc(NC[C@H](O)c3cccnc3)ccc2N1	ZINC000819404497	CE	On-Demand	Anodyne	ADRB3	83	39
O=C1CCc2cc(NC[C@H](O)c3cccnc3)ccc2N1	ZINC000819404497	CE	On-Demand	Anodyne	PTK2B	18	41
O=C1CCc2cc(NC[C@@H](O)c3cccnc3)ccc2N1	ZINC000819404498	CE	On-Demand	Anodyne	ADRB3	83	39
O=C1CCc2cc(NC[C@@H](O)c3cccnc3)ccc2N1	ZINC000819404498	CE	On-Demand	Anodyne	PTK2B	18	41
O=C(NC[C@@H](O)c1cccnc1)C1(c2ccc(Cl)cc2Cl)CCCCC1	ZINC000819404500	GI	On-Demand	Anodyne	ADRB3	84	42
O=C(NC[C@H](O)c1cccnc1)C1(c2ccc(Cl)cc2Cl)CCCCC1	ZINC000819404501	GI	On-Demand	Anodyne	ADRB3	84	42
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819404509	EE	On-Demand	Anodyne	ADRB2	31	42
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819404509	EE	On-Demand	Anodyne	ADRB1	54	42
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819404509	EE	On-Demand	Anodyne	GRIN1	22	42
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819404509	EE	On-Demand	Anodyne	ADRB3	34	42
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819404509	EE	On-Demand	Anodyne	ACR	57	35
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819404511	EE	On-Demand	Anodyne	ADRB2	31	42
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819404511	EE	On-Demand	Anodyne	ADRB1	54	42
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819404511	EE	On-Demand	Anodyne	GRIN1	22	42
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819404511	EE	On-Demand	Anodyne	ADRB3	34	42
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819404511	EE	On-Demand	Anodyne	ACR	57	35
C#Cc1cccc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)c1	ZINC000819404519	EE	On-Demand	Mild	ADRB1	19	41
C#Cc1cccc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)c1	ZINC000819404522	EE	On-Demand	Mild	ADRB1	19	41
O=C(CCNc1ccc(OC2CCCC2)cc1)Nc1cccnc1	ZINC000819404535	EH	On-Demand	Anodyne	CHRNA7	24	41
O=C(CCNc1ccc(OC2CCCC2)cc1)Nc1cccnc1	ZINC000819404535	EH	On-Demand	Anodyne	NAMPT	32	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc3c(c2)CCO3)CC1	ZINC000819404602	FG	On-Demand	Anodyne	GPR119	41	55
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc3c(c2)CCO3)CC1	ZINC000819404604	FG	On-Demand	Anodyne	GPR119	41	55
O[C@@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1ccccc1	ZINC000819404613	DG	On-Demand	Anodyne	CHRNA10	44	32
C#Cc1cccc(NC[C@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819404614	EG	On-Demand	Mild	ADRB2	48	44
C#Cc1cccc(NC[C@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819404614	EG	On-Demand	Mild	ADRB1	73	47
C#Cc1cccc(NC[C@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819404614	EG	On-Demand	Mild	ADRB3	52	44
C#Cc1cccc(NC[C@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819404614	EG	On-Demand	Mild	FFAR1	42	43
O[C@@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1ccccc1	ZINC000819404615	DG	On-Demand	Anodyne	CHRNA10	44	32
C#Cc1cccc(NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819404616	EG	On-Demand	Mild	ADRB2	48	44
C#Cc1cccc(NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819404616	EG	On-Demand	Mild	ADRB1	73	47
C#Cc1cccc(NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819404616	EG	On-Demand	Mild	ADRB3	52	44
C#Cc1cccc(NC[C@@H](O)COc2ccc(CCC(C)=O)cc2)c1	ZINC000819404616	EG	On-Demand	Mild	FFAR1	42	43
O[C@H](CNc1cccc(OC[C@@H]2CCCO2)c1)c1ccccc1	ZINC000819404617	DG	On-Demand	Anodyne	CHRNA10	44	32
O[C@H](CNc1cccc(OC[C@H]2CCCO2)c1)c1ccccc1	ZINC000819404619	DG	On-Demand	Anodyne	CHRNA10	44	32
C#Cc1cccc(NC[C@@H](O)COc2ccccc2C(C)C)c1	ZINC000819404620	DH	On-Demand	Mild	ADRB2	33	47
C#Cc1cccc(NC[C@@H](O)COc2ccccc2C(C)C)c1	ZINC000819404620	DH	On-Demand	Mild	ADRB1	47	35
C#Cc1cccc(NC[C@H](O)COc2ccccc2C(C)C)c1	ZINC000819404622	DH	On-Demand	Mild	ADRB2	33	47
C#Cc1cccc(NC[C@H](O)COc2ccccc2C(C)C)c1	ZINC000819404622	DH	On-Demand	Mild	ADRB1	47	35
C#Cc1cccc(NC[C@H](O)COc2ccc(CCOC)cc2)c1	ZINC000819404628	EF	On-Demand	Mild	ADRB2	43	57
C#Cc1cccc(NC[C@H](O)COc2ccc(CCOC)cc2)c1	ZINC000819404628	EF	On-Demand	Mild	ADRB1	64	57
C#Cc1cccc(NC[C@H](O)COc2ccc(CCOC)cc2)c1	ZINC000819404628	EF	On-Demand	Mild	ADRB3	42	42
C#Cc1cccc(NC[C@@H](O)COc2ccc(CCOC)cc2)c1	ZINC000819404630	EF	On-Demand	Mild	ADRB2	43	57
C#Cc1cccc(NC[C@@H](O)COc2ccc(CCOC)cc2)c1	ZINC000819404630	EF	On-Demand	Mild	ADRB1	64	57
C#Cc1cccc(NC[C@@H](O)COc2ccc(CCOC)cc2)c1	ZINC000819404630	EF	On-Demand	Mild	ADRB3	42	42
O[C@@H](CNc1ccc2c(c1)CCO2)c1cccc(Cl)c1	ZINC000819404689	CG	On-Demand	Anodyne	ADRB1	24	44
O[C@@H](CNc1ccc2c(c1)CCO2)c1cccc(Cl)c1	ZINC000819404689	CG	On-Demand	Anodyne	ADRB3	37	41
O[C@H](CNc1ccc2c(c1)CCO2)c1cccc(Cl)c1	ZINC000819404691	CG	On-Demand	Anodyne	ADRB1	24	44
O[C@H](CNc1ccc2c(c1)CCO2)c1cccc(Cl)c1	ZINC000819404691	CG	On-Demand	Anodyne	ADRB3	37	41
COc1cc(F)ccc1NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819404696	FG	On-Demand	Anodyne	GPR119	36	44
COc1cc(F)ccc1NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819404698	FG	On-Demand	Anodyne	GPR119	36	44
O[C@@H](CNc1ccc2c(c1)CCO2)COc1cccc2[nH]ccc12	ZINC000819404707	DF	On-Demand	Anodyne	ADRB1	19	53
O[C@H](CNc1ccc2c(c1)CCO2)COc1cccc2[nH]ccc12	ZINC000819404708	DF	On-Demand	Anodyne	ADRB1	19	53
CC(C)[C@H]1CN(C(=O)c2cc(S(N)(=O)=O)ccc2Br)CCCO1	ZINC000819404718	HD	On-Demand	Anodyne	SLC6A9	17	41
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCCN2C(=O)OC(C)(C)C)CCCO1	ZINC000819404726	FG	On-Demand	Anodyne	PREP	43	63
CC(C)[C@H]1CN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)CCCO1	ZINC000819404728	GG	On-Demand	Anodyne	GRIN2B	25	43
CC(C)[C@H]1CN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)CCCO1	ZINC000819404728	GG	On-Demand	Anodyne	CTSK	20	41
CC(C)[C@H]1CN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)CCCO1	ZINC000819404728	GG	On-Demand	Anodyne	CTSL	19	41
CC(C)[C@H]1CN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)CCCO1	ZINC000819404728	GG	On-Demand	Anodyne	CCR5	17	40
CC(C)[C@H]1CN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)CCCO1	ZINC000819404728	GG	On-Demand	Anodyne	PREP	57	48
CC(C)[C@H]1CN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)CCCO1	ZINC000819404728	GG	On-Demand	Anodyne	KLK5	40	37
CC(C)[C@H]1CN(C(=O)C2CCN(C(=O)OCc3ccccc3)CC2)CCCO1	ZINC000819404728	GG	On-Demand	Anodyne	SLC12A5	60	40
CC(C)[C@H]1CN(C(=O)c2c(O)cccc2Cl)CCCO1	ZINC000819404757	CF	On-Demand	Anodyne	L3MBTL3	50	35
CCCCSCC(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819404769	CF	On-Demand	Anodyne	EST1_PIG	40	35
CCCCSCC(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819404770	CF	On-Demand	Anodyne	EST1_PIG	40	35
CC(C)[C@H]1CN(C(=O)COc2ccc3c(c2)CCC3)CCCO1	ZINC000819404789	DF	On-Demand	Anodyne	CPT1A	27	40
CC(C)[C@H]1CN(C(=O)COc2ccc3c(c2)CCC3)CCCO1	ZINC000819404789	DF	On-Demand	Anodyne	CPT2	41	40
CCO[C@@H]1C[C@H](NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)[C@@H]1n1cccn1	ZINC000819404793	HH	On-Demand	Anodyne	KCNK3	53	40
CCO[C@@H]1C[C@H](NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)[C@@H]1n1cccn1	ZINC000819404793	HH	On-Demand	Anodyne	KCNK9	43	40
CCO[C@@H]1C[C@H](NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)[C@H]1n1cccn1	ZINC000819404794	HH	On-Demand	Anodyne	KCNK3	53	40
CCO[C@@H]1C[C@H](NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)[C@H]1n1cccn1	ZINC000819404794	HH	On-Demand	Anodyne	KCNK9	43	40
CCO[C@@H]1C[C@@H](NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)[C@@H]1n1cccn1	ZINC000819404795	HH	On-Demand	Anodyne	KCNK3	53	40
CCO[C@@H]1C[C@@H](NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)[C@@H]1n1cccn1	ZINC000819404795	HH	On-Demand	Anodyne	KCNK9	43	40
CCO[C@@H]1C[C@@H](NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)[C@H]1n1cccn1	ZINC000819404796	HH	On-Demand	Anodyne	KCNK3	53	40
CCO[C@@H]1C[C@@H](NC(=O)c2ccccc2NC(=O)c2cccc(C)c2)[C@H]1n1cccn1	ZINC000819404796	HH	On-Demand	Anodyne	KCNK9	43	40
C=C(Cl)CSc1nc(C)c(CC(=O)NC[C@@H](O)c2cccnc2)s1	ZINC000819404836	GG	On-Demand	Mild	ADRB3	56	41
C=C(Cl)CSc1nc(C)c(CC(=O)NC[C@H](O)c2cccnc2)s1	ZINC000819404837	GG	On-Demand	Mild	ADRB3	56	41
COc1cc(F)ccc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819404855	EF	On-Demand	Anodyne	NOD2	40	36
COc1cc(F)ccc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819404857	EF	On-Demand	Anodyne	NOD2	40	36
C#Cc1cccc(NC(=O)[C@H](CC(N)=O)NC(=O)c2ccccc2Cl)c1	ZINC000819404862	FD	On-Demand	Mild	NR2E3	63	37
C#Cc1cccc(NC(=O)[C@H](CC(N)=O)NC(=O)c2ccccc2Cl)c1	ZINC000819404862	FD	On-Demand	Mild	KCNK3	48	42
C#Cc1cccc(NC(=O)[C@H](CC(N)=O)NC(=O)c2ccccc2Cl)c1	ZINC000819404862	FD	On-Demand	Mild	KCNK9	43	33
C#Cc1cccc(NC(=O)[C@@H](CC(N)=O)NC(=O)c2ccccc2Cl)c1	ZINC000819404863	FD	On-Demand	Mild	NR2E3	63	37
C#Cc1cccc(NC(=O)[C@@H](CC(N)=O)NC(=O)c2ccccc2Cl)c1	ZINC000819404863	FD	On-Demand	Mild	KCNK3	48	42
C#Cc1cccc(NC(=O)[C@@H](CC(N)=O)NC(=O)c2ccccc2Cl)c1	ZINC000819404863	FD	On-Demand	Mild	KCNK9	43	33
COc1cc(F)ccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819404870	CC	On-Demand	Anodyne	ADRA1D	17	42
COc1cc(F)ccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819404870	CC	On-Demand	Anodyne	DRD3	17	42
COc1cc(F)ccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819404870	CC	On-Demand	Anodyne	CCR1	36	42
COc1cc(F)ccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819404872	CC	On-Demand	Anodyne	ADRA1D	17	42
COc1cc(F)ccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819404872	CC	On-Demand	Anodyne	DRD3	17	42
COc1cc(F)ccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819404872	CC	On-Demand	Anodyne	CCR1	36	42
O=C(/C=C/[C@@H]1CCCO1)NC[C@H](O)c1cccnc1	ZINC000819404881	CC	On-Demand	Anodyne	ADRB3	70	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819404888	FI	On-Demand	Anodyne	ADRB2	46	48
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819404888	FI	On-Demand	Anodyne	ADRB1	72	48
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819404888	FI	On-Demand	Anodyne	ADRB3	48	40
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819404889	FI	On-Demand	Anodyne	ADRB2	46	48
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819404889	FI	On-Demand	Anodyne	ADRB1	72	48
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819404889	FI	On-Demand	Anodyne	ADRB3	48	40
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819404900	EF	On-Demand	Anodyne	ADRB2	33	53
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819404900	EF	On-Demand	Anodyne	ADRB1	59	53
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819404900	EF	On-Demand	Anodyne	GRIN1	27	42
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819404900	EF	On-Demand	Anodyne	ADRB3	40	39
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819404901	EF	On-Demand	Anodyne	ADRB2	33	53
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819404901	EF	On-Demand	Anodyne	ADRB1	59	53
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819404901	EF	On-Demand	Anodyne	GRIN1	27	42
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCO3)cc1	ZINC000819404901	EF	On-Demand	Anodyne	ADRB3	40	39
CON(C)C(=O)CCNc1ccc(OC2CCCC2)cc1	ZINC000819404903	CF	On-Demand	Anodyne	EPHX2	23	42
N#Cc1ccc(OC[C@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819404906	FH	On-Demand	Mild	ADRB1	57	45
C#Cc1cccc(NC(=O)/C=C\Sc2ccccc2)c1	ZINC000819404919	CH	On-Demand	Mild	KCNK3	44	33
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819404920	FH	On-Demand	Mild	ADRB1	57	45
C#Cc1cccc(NC(=O)/C=C/Sc2ccccc2)c1	ZINC000819404924	CH	On-Demand	Mild	KCNK3	44	33
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(OC2CCCC2)cc1	ZINC000819404936	FH	On-Demand	Bother	ADRB1	58	36
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(OC2CCCC2)cc1	ZINC000819404938	FH	On-Demand	Bother	ADRB1	58	36
O=C(/C=C\[C@@H]1CCCO1)NC[C@@H](O)c1cccnc1	ZINC000819404970	CC	On-Demand	Anodyne	ADRB3	70	40
C#Cc1cccc(NC(=O)c2sc(C)nc2-c2ccccc2)c1	ZINC000819404973	DI	On-Demand	Mild	NR2E3	44	33
C#Cc1cccc(NC(=O)c2sc(C)nc2-c2ccccc2)c1	ZINC000819404973	DI	On-Demand	Mild	KCNK3	93	36
C#Cc1cccc(NC(=O)c2sc(C)nc2-c2ccccc2)c1	ZINC000819404973	DI	On-Demand	Mild	KCNK9	49	36
O=C(/C=C\[C@@H]1CCCO1)NC[C@H](O)c1cccnc1	ZINC000819404974	CC	On-Demand	Anodyne	ADRB3	70	40
O=C(/C=C/[C@@H]1CCCO1)NC[C@@H](O)c1cccnc1	ZINC000819404976	CC	On-Demand	Anodyne	ADRB3	70	40
O=C(NC[C@@H](O)c1cccnc1)c1cc2c(cn1)OCCO2	ZINC000819404977	DC	On-Demand	Anodyne	ADRB3	62	40
O=C(NC[C@@H](O)c1cccnc1)c1cc2c(cn1)OCCO2	ZINC000819404977	DC	On-Demand	Anodyne	SCD1	19	47
O=C(NC[C@@H](O)c1cccnc1)c1cc2c(cn1)OCCO2	ZINC000819404977	DC	On-Demand	Anodyne	SCD	32	47
O=C(NC[C@H](O)c1cccnc1)c1cc2c(cn1)OCCO2	ZINC000819404979	DC	On-Demand	Anodyne	ADRB3	62	40
O=C(NC[C@H](O)c1cccnc1)c1cc2c(cn1)OCCO2	ZINC000819404979	DC	On-Demand	Anodyne	SCD1	19	47
O=C(NC[C@H](O)c1cccnc1)c1cc2c(cn1)OCCO2	ZINC000819404979	DC	On-Demand	Anodyne	SCD	32	47
O=C(/C=C/[C@@H]1CCCO1)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819404981	FG	On-Demand	Anodyne	DRD4	24	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	ZINC000819404984	FG	On-Demand	Anodyne	DRD4	24	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819404987	FG	On-Demand	Anodyne	DRD4	24	41
COC(=O)C1(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCCC1	ZINC000819404989	GF	On-Demand	Mild	PAPA1_CARPA	33	43
COC(=O)C1(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCCC1	ZINC000819404991	GF	On-Demand	Mild	PAPA1_CARPA	33	43
O=C(/C=C/[C@@H]1CCCO1)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	ZINC000819404992	FG	On-Demand	Anodyne	DRD4	24	41
COc1cc(F)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819404993	EF	On-Demand	Bother	ADRB2	25	41
COc1cc(F)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819404993	EF	On-Demand	Bother	ADRB1	36	42
COc1cc(F)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819404993	EF	On-Demand	Bother	CACNA1C	49	37
COc1cc(F)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819404993	EF	On-Demand	Bother	CACNA1D	76	37
COc1cc(F)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819404993	EF	On-Demand	Bother	KCNMA1	19	40
COc1cc(F)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819404995	EF	On-Demand	Bother	ADRB2	25	41
COc1cc(F)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819404995	EF	On-Demand	Bother	ADRB1	36	42
COc1cc(F)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819404995	EF	On-Demand	Bother	CACNA1C	49	37
COc1cc(F)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819404995	EF	On-Demand	Bother	CACNA1D	76	37
COc1cc(F)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819404995	EF	On-Demand	Bother	KCNMA1	19	40
C[C@@H](CC(=O)NC[C@H](O)c1cccnc1)n1cccn1	ZINC000819405006	CD	On-Demand	Anodyne	ADRB1	19	44
C[C@@H](CC(=O)NC[C@H](O)c1cccnc1)n1cccn1	ZINC000819405006	CD	On-Demand	Anodyne	ADRB3	69	56
C[C@@H](CC(=O)NC[C@H](O)c1cccnc1)n1cccn1	ZINC000819405006	CD	On-Demand	Anodyne	KCNA5	21	44
C[C@H](CC(=O)NC[C@@H](O)c1cccnc1)n1cccn1	ZINC000819405008	CD	On-Demand	Anodyne	ADRB1	19	44
C[C@H](CC(=O)NC[C@@H](O)c1cccnc1)n1cccn1	ZINC000819405008	CD	On-Demand	Anodyne	ADRB3	69	56
C[C@H](CC(=O)NC[C@@H](O)c1cccnc1)n1cccn1	ZINC000819405008	CD	On-Demand	Anodyne	KCNA5	21	44
C[C@@H](CC(=O)NC[C@@H](O)c1cccnc1)n1cccn1	ZINC000819405009	CD	On-Demand	Anodyne	ADRB1	19	44
C[C@@H](CC(=O)NC[C@@H](O)c1cccnc1)n1cccn1	ZINC000819405009	CD	On-Demand	Anodyne	ADRB3	69	56
C[C@@H](CC(=O)NC[C@@H](O)c1cccnc1)n1cccn1	ZINC000819405009	CD	On-Demand	Anodyne	KCNA5	21	44
C[C@H](CC(=O)NC[C@H](O)c1cccnc1)n1cccn1	ZINC000819405011	CD	On-Demand	Anodyne	ADRB1	19	44
C[C@H](CC(=O)NC[C@H](O)c1cccnc1)n1cccn1	ZINC000819405011	CD	On-Demand	Anodyne	ADRB3	69	56
C[C@H](CC(=O)NC[C@H](O)c1cccnc1)n1cccn1	ZINC000819405011	CD	On-Demand	Anodyne	KCNA5	21	44
CSc1ccc(OC[C@@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)cc1	ZINC000819405012	GF	On-Demand	Anodyne	ADRB2	34	44
CSc1ccc(OC[C@@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)cc1	ZINC000819405012	GF	On-Demand	Anodyne	ADRB1	52	44
CSc1ccc(OC[C@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)cc1	ZINC000819405015	GF	On-Demand	Anodyne	ADRB2	34	44
CSc1ccc(OC[C@H](O)CNc2ccc(OCC(=O)N(C)C)cc2)cc1	ZINC000819405015	GF	On-Demand	Anodyne	ADRB1	52	44
CCOC[C@H](O)CNc1ccc(OCC(=O)N(C)C)cc1	ZINC000819405025	CC	On-Demand	Anodyne	ADRB2	25	42
CCOC[C@H](O)CNc1ccc(OCC(=O)N(C)C)cc1	ZINC000819405025	CC	On-Demand	Anodyne	ADRB1	36	42
O=S1(=O)CCCN1c1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819405043	ED	On-Demand	Anodyne	ADRB2	22	40
O=S1(=O)CCCN1c1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819405043	ED	On-Demand	Anodyne	ADRB1	21	40
O=S1(=O)CCCN1c1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819405043	ED	On-Demand	Anodyne	ADRB3	90	46
C=CCc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OC)c(OC)c1	ZINC000819405046	FG	On-Demand	Mild	ADRB2	18	43
O=S1(=O)CCCN1c1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819405047	ED	On-Demand	Anodyne	ADRB2	22	40
O=S1(=O)CCCN1c1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819405047	ED	On-Demand	Anodyne	ADRB1	21	40
O=S1(=O)CCCN1c1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819405047	ED	On-Demand	Anodyne	ADRB3	90	46
C#Cc1cccc(NC(=O)c2csc(S(=O)(=O)N3CCc4ccccc4C3)c2)c1	ZINC000819405049	HH	On-Demand	Mild	AKR1C3	70	51
C#Cc1cccc(NC(=O)c2csc(S(=O)(=O)N3CCc4ccccc4C3)c2)c1	ZINC000819405049	HH	On-Demand	Mild	NOD2	41	36
C#Cc1cccc(NC(=O)c2csc(S(=O)(=O)N3CCc4ccccc4C3)c2)c1	ZINC000819405049	HH	On-Demand	Mild	KCNK3	47	34
C=CCc1ccc(OC[C@H](O)CNc2ccc(F)cc2OC)c(OC)c1	ZINC000819405050	FG	On-Demand	Mild	ADRB2	18	43
O[C@@H](CNc1ccc(OC2CCCC2)cc1)COC1CCOCC1	ZINC000819405061	EF	On-Demand	Anodyne	ADRB1	23	43
O[C@H](CNc1ccc(OC2CCCC2)cc1)COC1CCOCC1	ZINC000819405066	EF	On-Demand	Anodyne	ADRB1	23	43
CC(C)[C@H]1CN(C(=O)c2cc(-c3cccnc3)nc3ccccc23)CCCO1	ZINC000819405076	GI	On-Demand	Anodyne	TACR3	21	40
CC(C)[C@H]1CN(C(=O)c2cc(-c3cccnc3)nc3ccccc23)CCCO1	ZINC000819405076	GI	On-Demand	Anodyne	SMO	23	41
CC(C)[C@H]1CN(C(=O)c2cc(-c3cccnc3)nc3ccccc23)CCCO1	ZINC000819405076	GI	On-Demand	Anodyne	MT-CO2	48	37
C#Cc1cccc(NC[C@@H](O)COCc2ccc(OC)cc2)c1	ZINC000819405083	DF	On-Demand	Mild	ADRB2	20	40
C#Cc1cccc(NC[C@@H](O)COCc2ccc(OC)cc2)c1	ZINC000819405083	DF	On-Demand	Mild	CASR	24	44
C#Cc1cccc(NC[C@H](O)COCc2ccc(OC)cc2)c1	ZINC000819405085	DF	On-Demand	Mild	ADRB2	20	40
C#Cc1cccc(NC[C@H](O)COCc2ccc(OC)cc2)c1	ZINC000819405085	DF	On-Demand	Mild	CASR	24	44
O[C@H](CNc1cccc(OC2CCCC2)c1)c1cccnc1	ZINC000819405106	CH	On-Demand	Anodyne	ADRB1	30	47
O[C@H](CNc1cccc(OC2CCCC2)c1)c1cccnc1	ZINC000819405106	CH	On-Demand	Anodyne	ADRB3	92	47
O[C@@H](CNc1cccc(OC2CCCC2)c1)c1cccnc1	ZINC000819405109	CH	On-Demand	Anodyne	ADRB1	30	47
O[C@@H](CNc1cccc(OC2CCCC2)c1)c1cccnc1	ZINC000819405109	CH	On-Demand	Anodyne	ADRB3	92	47
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405118	GG	On-Demand	Anodyne	CELA1	19	41
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405118	GG	On-Demand	Anodyne	CTSK	22	43
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405118	GG	On-Demand	Anodyne	CTSL	22	43
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405118	GG	On-Demand	Anodyne	CCR5	22	41
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405118	GG	On-Demand	Anodyne	PREP	72	50
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405118	GG	On-Demand	Anodyne	DPP7	51	38
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405118	GG	On-Demand	Anodyne	KLK5	41	39
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405118	GG	On-Demand	Anodyne	BIRC2	18	49
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405118	GG	On-Demand	Anodyne	SLC12A5	60	38
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405119	GG	On-Demand	Anodyne	CELA1	19	41
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405119	GG	On-Demand	Anodyne	CTSK	22	43
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405119	GG	On-Demand	Anodyne	CTSL	22	43
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405119	GG	On-Demand	Anodyne	CCR5	22	41
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405119	GG	On-Demand	Anodyne	PREP	72	50
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405119	GG	On-Demand	Anodyne	DPP7	51	38
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405119	GG	On-Demand	Anodyne	KLK5	41	39
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405119	GG	On-Demand	Anodyne	BIRC2	18	49
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405119	GG	On-Demand	Anodyne	SLC12A5	60	38
C#Cc1cccc(NC(=O)c2csc(-c3ccc(OC)cc3)n2)c1	ZINC000819405122	EI	On-Demand	Mild	SCN10A	43	52
C#Cc1cccc(NC(=O)c2csc(-c3ccc(OC)cc3)n2)c1	ZINC000819405122	EI	On-Demand	Mild	TAAR1	29	40
C#Cc1cccc(NC(=O)c2csc(-c3ccc(OC)cc3)n2)c1	ZINC000819405122	EI	On-Demand	Mild	NR2E3	51	32
C#Cc1cccc(NC(=O)c2csc(-c3ccc(OC)cc3)n2)c1	ZINC000819405122	EI	On-Demand	Mild	KCNK3	51	37
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	F2	48	39
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	ACE	65	45
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	FKBP1A	60	42
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	CELA1	28	56
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	ELANE	38	44
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	CTRA_BOVIN	68	37
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	TRY1_BOVIN	72	37
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	CTSG	47	37
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	CTSK	19	45
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	CTSL	17	42
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	CPT2	46	37
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	PREP	137	67
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	CELA2A	56	37
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	LGMN	82	47
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	ACE2	23	46
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	KLK5	47	50
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	WNT3	40	33
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	BRCA1	52	32
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	SLC12A5	64	37
CC(C)[C@H]1CN(C(=O)[C@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819405138	FG	On-Demand	Anodyne	TMPRSS11D	67	39
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	F2	34	41
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	PLG	29	41
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	ACE	49	46
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	GHRHR	60	33
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	P2RY12	125	36
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	ELANE	30	43
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	CMA1	15	41
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	CTRA_BOVIN	69	38
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	CASP3	17	41
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	KLK3	103	47
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	CTSB	69	48
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	TRY2_BOVIN	64	34
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	PAPA1_CARPA	73	39
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	TRY1_BOVIN	45	38
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	CYSP_TRYCR	62	44
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	CTSG	48	38
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	CTSK	61	52
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	CTSL	51	43
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	CCR1	15	41
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	NPFFR2	41	37
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	PREP	41	44
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	CAPNS1	67	38
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	CELA2A	57	38
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	LGMN	41	35
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	MMP11	65	34
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	TGM1	24	44
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	CCKBR	23	41
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	CTSS	31	52
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	CAPN1	89	50
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	CASP1	26	41
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	CTRC	23	41
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	CAPN2	143	43
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	PLAU	19	41
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	TGM2	37	50
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	KLK5	41	37
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	TPSAB1	49	38
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	NPR	72	35
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	PSMB5	41	40
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	Q6PRC7_IXORI	51	35
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	SLC12A5	51	34
CC(C)[C@H]1CN(C(=O)[C@H](CCC(N)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819405201	HD	On-Demand	Anodyne	TMPRSS11D	48	36
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819405222	GH	On-Demand	Anodyne	ADRB1	16	41
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OC3CCCC3)cc2)cc1	ZINC000819405223	GH	On-Demand	Anodyne	ADRB1	16	41
O=C(NC[C@@H](O)c1cccnc1)C(F)=C1CCC1	ZINC000819405305	CD	On-Demand	Anodyne	ADRB2	21	41
O=C(NC[C@@H](O)c1cccnc1)C(F)=C1CCC1	ZINC000819405305	CD	On-Demand	Anodyne	ADRB1	23	42
O=C(NC[C@@H](O)c1cccnc1)C(F)=C1CCC1	ZINC000819405305	CD	On-Demand	Anodyne	ADRB3	91	43
O=C(NC[C@@H](O)c1cccnc1)C(F)=C1CCC1	ZINC000819405305	CD	On-Demand	Anodyne	SCD	16	41
O=C(NC[C@H](O)c1cccnc1)C(F)=C1CCC1	ZINC000819405306	CD	On-Demand	Anodyne	ADRB2	21	41
O=C(NC[C@H](O)c1cccnc1)C(F)=C1CCC1	ZINC000819405306	CD	On-Demand	Anodyne	ADRB1	23	42
O=C(NC[C@H](O)c1cccnc1)C(F)=C1CCC1	ZINC000819405306	CD	On-Demand	Anodyne	ADRB3	91	43
O=C(NC[C@H](O)c1cccnc1)C(F)=C1CCC1	ZINC000819405306	CD	On-Demand	Anodyne	SCD	16	41
C#Cc1cccc(NC(=O)CCc2ccc(C)cc2C)c1	ZINC000819405341	CH	On-Demand	Mild	KCNK3	52	35
C#Cc1cccc(NC(=O)CCc2ccc(C)cc2C)c1	ZINC000819405341	CH	On-Demand	Mild	KCNK9	41	35
COCCOc1cc(NC[C@H](O)c2cccnc2)ccc1OC	ZINC000819405378	DE	On-Demand	Anodyne	ADRB1	24	44
COCCOc1cc(NC[C@H](O)c2cccnc2)ccc1OC	ZINC000819405378	DE	On-Demand	Anodyne	ADRB3	80	46
COCCOc1cc(NC[C@H](O)c2cccnc2)ccc1OC	ZINC000819405378	DE	On-Demand	Anodyne	ENPP1	55	36
COCCOc1cc(NC[C@H](O)c2cccnc2)ccc1OC	ZINC000819405378	DE	On-Demand	Anodyne	DRTS_TRYCR	50	36
COCCOc1cc(NC[C@@H](O)c2cccnc2)ccc1OC	ZINC000819405379	DE	On-Demand	Anodyne	ADRB1	24	44
COCCOc1cc(NC[C@@H](O)c2cccnc2)ccc1OC	ZINC000819405379	DE	On-Demand	Anodyne	ADRB3	80	46
COCCOc1cc(NC[C@@H](O)c2cccnc2)ccc1OC	ZINC000819405379	DE	On-Demand	Anodyne	ENPP1	55	36
COCCOc1cc(NC[C@@H](O)c2cccnc2)ccc1OC	ZINC000819405379	DE	On-Demand	Anodyne	DRTS_TRYCR	50	36
C#Cc1cccc(NC(=O)c2cnn(-c3cccc(C)c3)c2C(F)(F)F)c1	ZINC000819405382	FI	On-Demand	Mild	MST1R	44	43
C#Cc1cccc(NC(=O)c2cnn(-c3cccc(C)c3)c2C(F)(F)F)c1	ZINC000819405382	FI	On-Demand	Mild	TAAR1	20	41
C#Cc1cccc(NC(=O)c2cnn(-c3cccc(C)c3)c2C(F)(F)F)c1	ZINC000819405382	FI	On-Demand	Mild	KCNK3	79	44
C#Cc1cccc(NC(=O)c2cnn(-c3cccc(C)c3)c2C(F)(F)F)c1	ZINC000819405382	FI	On-Demand	Mild	KCNK9	68	38
CC(C)[C@H]1CN(C(=O)C[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405392	HH	On-Demand	Anodyne	CELA1	17	41
CC(C)[C@H]1CN(C(=O)C[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405392	HH	On-Demand	Anodyne	PGC	55	37
CC(C)[C@H]1CN(C(=O)C[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405392	HH	On-Demand	Anodyne	CMA1	32	40
CC(C)[C@H]1CN(C(=O)C[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405392	HH	On-Demand	Anodyne	CTRA_BOVIN	17	40
CC(C)[C@H]1CN(C(=O)C[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405392	HH	On-Demand	Anodyne	PAPA1_CARPA	33	41
CC(C)[C@H]1CN(C(=O)C[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405392	HH	On-Demand	Anodyne	CCKAR	67	40
CC(C)[C@H]1CN(C(=O)C[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405392	HH	On-Demand	Anodyne	CTSK	26	42
CC(C)[C@H]1CN(C(=O)C[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405392	HH	On-Demand	Anodyne	CTSL	33	41
CC(C)[C@H]1CN(C(=O)C[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405392	HH	On-Demand	Anodyne	REN	86	41
CC(C)[C@H]1CN(C(=O)C[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405392	HH	On-Demand	Anodyne	CTSS	20	41
CC(C)[C@H]1CN(C(=O)C[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405392	HH	On-Demand	Anodyne	KLK5	23	41
CC(C)[C@H]1CN(C(=O)C[C@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405392	HH	On-Demand	Anodyne	FPR1	54	42
CC(C)[C@H]1CN(C(=O)C[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405393	HH	On-Demand	Anodyne	CELA1	17	41
CC(C)[C@H]1CN(C(=O)C[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405393	HH	On-Demand	Anodyne	PGC	55	37
CC(C)[C@H]1CN(C(=O)C[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405393	HH	On-Demand	Anodyne	CMA1	32	40
CC(C)[C@H]1CN(C(=O)C[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405393	HH	On-Demand	Anodyne	CTRA_BOVIN	17	40
CC(C)[C@H]1CN(C(=O)C[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405393	HH	On-Demand	Anodyne	PAPA1_CARPA	33	41
CC(C)[C@H]1CN(C(=O)C[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405393	HH	On-Demand	Anodyne	CCKAR	67	40
CC(C)[C@H]1CN(C(=O)C[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405393	HH	On-Demand	Anodyne	CTSK	26	42
CC(C)[C@H]1CN(C(=O)C[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405393	HH	On-Demand	Anodyne	CTSL	33	41
CC(C)[C@H]1CN(C(=O)C[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405393	HH	On-Demand	Anodyne	REN	86	41
CC(C)[C@H]1CN(C(=O)C[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405393	HH	On-Demand	Anodyne	CTSS	20	41
CC(C)[C@H]1CN(C(=O)C[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405393	HH	On-Demand	Anodyne	KLK5	23	41
CC(C)[C@H]1CN(C(=O)C[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405393	HH	On-Demand	Anodyne	FPR1	54	42
O=S1(=O)CCCN1c1ccc(NC[C@H](O)c2ccccc2Cl)cc1	ZINC000819405415	FG	On-Demand	Anodyne	CDK1	16	43
Cc1ccccc1[C@@H](O)CNc1ccc2c(c1)CCC(=O)N2	ZINC000819405431	CG	On-Demand	Anodyne	PKM	41	43
CC(C)[C@H]1CN(C(=O)[C@]2(F)CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405468	GG	On-Demand	Anodyne	TGM2	26	40
CC(C)[C@H]1CN(C(=O)[C@]2(F)CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405468	GG	On-Demand	Anodyne	SLC12A5	65	37
CC(C)[C@H]1CN(C(=O)[C@@]2(F)CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405471	GG	On-Demand	Anodyne	TGM2	26	40
CC(C)[C@H]1CN(C(=O)[C@@]2(F)CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405471	GG	On-Demand	Anodyne	SLC12A5	65	37
CC(C)[C@H]1CN(C(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCCC3)c2)CCCO1	ZINC000819405484	IH	On-Demand	Anodyne	CNR2	18	61
CC(C)[C@H]1CN(C(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCCC3)c2)CCCO1	ZINC000819405484	IH	On-Demand	Anodyne	L3MBTL3	52	36
CC(C)[C@H]1CN(C(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCCCC3)c2)CCCO1	ZINC000819405484	IH	On-Demand	Anodyne	HPGD	40	37
O=C1CCc2cc(NC[C@@H](O)C3CC3)ccc2N1	ZINC000819405494	BD	On-Demand	Anodyne	PKM	40	40
O=C1CCc2cc(NC[C@H](O)C3CC3)ccc2N1	ZINC000819405496	BD	On-Demand	Anodyne	PKM	40	40
COc1cc(F)ccc1NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819405505	EG	On-Demand	Anodyne	GRIN2B	16	41
COc1cc(F)ccc1NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819405505	EG	On-Demand	Anodyne	MTNR1B	15	45
COc1cc(F)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819405524	EF	On-Demand	Anodyne	ADRB2	50	56
COc1cc(F)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819405524	EF	On-Demand	Anodyne	ADRB1	80	56
COc1cc(F)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819405524	EF	On-Demand	Anodyne	TSHR	58	34
COc1cc(F)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819405524	EF	On-Demand	Anodyne	GRIN1	24	42
COc1cc(F)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819405524	EF	On-Demand	Anodyne	ADRB3	50	48
COc1cc(F)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819405524	EF	On-Demand	Anodyne	KDR	21	40
COc1cc(F)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819405524	EF	On-Demand	Anodyne	PDGFRA	41	40
COc1cc(F)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819405527	EF	On-Demand	Anodyne	ADRB2	50	56
COc1cc(F)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819405527	EF	On-Demand	Anodyne	ADRB1	80	56
COc1cc(F)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819405527	EF	On-Demand	Anodyne	TSHR	58	34
COc1cc(F)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819405527	EF	On-Demand	Anodyne	GRIN1	24	42
COc1cc(F)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819405527	EF	On-Demand	Anodyne	ADRB3	50	48
COc1cc(F)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819405527	EF	On-Demand	Anodyne	KDR	21	40
COc1cc(F)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819405527	EF	On-Demand	Anodyne	PDGFRA	41	40
COc1cc(F)ccc1NC[C@@H](O)Cc1ccccc1	ZINC000819405530	CF	On-Demand	Anodyne	ADRB2	19	40
COc1cc(F)ccc1NC[C@@H](O)Cc1ccccc1	ZINC000819405530	CF	On-Demand	Anodyne	GRIN2B	17	44
COc1cc(F)ccc1NC[C@@H](O)Cc1ccccc1	ZINC000819405530	CF	On-Demand	Anodyne	ADRB3	19	40
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2ccc3c(c2)CCC(=O)N3)CC1	ZINC000819405531	GG	On-Demand	Anodyne	GPR119	21	46
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2ccc3c(c2)CCC(=O)N3)CC1	ZINC000819405533	GG	On-Demand	Anodyne	GPR119	21	46
COc1cc(F)ccc1NC[C@H](O)Cc1ccccc1	ZINC000819405534	CF	On-Demand	Anodyne	ADRB2	19	40
COc1cc(F)ccc1NC[C@H](O)Cc1ccccc1	ZINC000819405534	CF	On-Demand	Anodyne	GRIN2B	17	44
COc1cc(F)ccc1NC[C@H](O)Cc1ccccc1	ZINC000819405534	CF	On-Demand	Anodyne	ADRB3	19	40
COCCc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OC)cc1	ZINC000819405578	EF	On-Demand	Anodyne	ADRB2	46	57
COCCc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OC)cc1	ZINC000819405578	EF	On-Demand	Anodyne	ADRB1	70	57
COCCc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OC)cc1	ZINC000819405578	EF	On-Demand	Anodyne	GRIN1	19	43
COCCc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OC)cc1	ZINC000819405578	EF	On-Demand	Anodyne	ADRB3	42	44
COCCc1ccc(OC[C@H](O)CNc2ccc(F)cc2OC)cc1	ZINC000819405579	EF	On-Demand	Anodyne	ADRB2	46	57
COCCc1ccc(OC[C@H](O)CNc2ccc(F)cc2OC)cc1	ZINC000819405579	EF	On-Demand	Anodyne	ADRB1	70	57
COCCc1ccc(OC[C@H](O)CNc2ccc(F)cc2OC)cc1	ZINC000819405579	EF	On-Demand	Anodyne	GRIN1	19	43
COCCc1ccc(OC[C@H](O)CNc2ccc(F)cc2OC)cc1	ZINC000819405579	EF	On-Demand	Anodyne	ADRB3	42	44
CCOc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OC)cc1	ZINC000819405580	EG	On-Demand	Anodyne	ADRB2	42	42
CCOc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OC)cc1	ZINC000819405580	EG	On-Demand	Anodyne	ADRB1	47	42
CCOc1ccc(OC[C@H](O)CNc2ccc(F)cc2OC)cc1	ZINC000819405581	EG	On-Demand	Anodyne	ADRB2	42	42
CCOc1ccc(OC[C@H](O)CNc2ccc(F)cc2OC)cc1	ZINC000819405581	EG	On-Demand	Anodyne	ADRB1	47	42
COc1cc(F)ccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819405616	FG	On-Demand	Anodyne	GPR119	58	59
COc1cc(F)ccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819405617	FG	On-Demand	Anodyne	GPR119	58	59
COc1cc(F)ccc1NC[C@@H](O)CCc1ccccc1	ZINC000819405618	CG	On-Demand	Anodyne	GRIN2B	17	42
COc1cc(F)ccc1NC[C@H](O)CCc1ccccc1	ZINC000819405619	CG	On-Demand	Anodyne	GRIN2B	17	42
CC(C)[C@H]1CN(C(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405652	FF	On-Demand	Anodyne	POLG_HCV1	26	44
CC(C)[C@H]1CN(C(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)CCCO1	ZINC000819405654	FF	On-Demand	Anodyne	POLG_HCV1	26	44
C#Cc1cccc(NC(=O)CCc2ccc(C)c(Cl)c2)c1	ZINC000819405713	CI	On-Demand	Mild	FFAR1	20	42
O=S1(=O)CCCN1c1ccc(NC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819405771	GG	On-Demand	Anodyne	CDK1	15	40
O=S1(=O)CCCN1c1ccc(NC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819405774	GG	On-Demand	Anodyne	CDK1	15	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc3c(c2)CCC(=O)N3)CC1	ZINC000819405789	GF	On-Demand	Anodyne	GPR119	34	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc3c(c2)CCC(=O)N3)CC1	ZINC000819405792	GF	On-Demand	Anodyne	GPR119	34	49
C#Cc1cccc(NC(=O)Cc2cc(Cl)ccc2OC)c1	ZINC000819405812	CH	On-Demand	Mild	TSHR	46	30
C#Cc1cccc(NC(=O)Cc2cc(Cl)ccc2OC)c1	ZINC000819405812	CH	On-Demand	Mild	CPT1A	48	43
C#Cc1cccc(NC(=O)Cc2cc(Cl)ccc2OC)c1	ZINC000819405812	CH	On-Demand	Mild	PTGDR2	15	42
C#Cc1cccc(NC(=O)Cc2cc(Cl)ccc2OC)c1	ZINC000819405812	CH	On-Demand	Mild	ENPP1	66	34
C#Cc1cccc(NC(=O)Cc2cc(Cl)ccc2OC)c1	ZINC000819405812	CH	On-Demand	Mild	KCNK3	43	37
CON(C)C(=O)CCNc1ccc(N2CCOCC2)cc1C	ZINC000819405820	DD	On-Demand	Anodyne	EPHB4	69	36
COc1cc(F)ccc1NC[C@H](O)c1ccccc1C	ZINC000819405824	CG	On-Demand	Anodyne	CTSA	48	33
COc1cc(F)ccc1NC[C@@H](O)c1ccccc1C	ZINC000819405825	CG	On-Demand	Anodyne	CTSA	48	33
COc1cc(F)ccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819405838	EF	On-Demand	Bother	ADRB2	24	41
COc1cc(F)ccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819405838	EF	On-Demand	Bother	ADRB1	59	37
COc1cc(F)ccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819405841	EF	On-Demand	Bother	ADRB2	24	41
COc1cc(F)ccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819405841	EF	On-Demand	Bother	ADRB1	59	37
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819405873	GH	On-Demand	Anodyne	CTSK	24	41
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819405873	GH	On-Demand	Anodyne	REN	43	36
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819405873	GH	On-Demand	Anodyne	FPR1	46	37
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819405875	GH	On-Demand	Anodyne	CTSK	24	41
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819405875	GH	On-Demand	Anodyne	REN	43	36
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819405875	GH	On-Demand	Anodyne	FPR1	46	37
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCCC2(C1)OCCO2	ZINC000819405900	ED	On-Demand	Anodyne	KCNJ1	56	39
COc1cc(F)ccc1NCCC(=O)N(C)OC	ZINC000819405931	CD	On-Demand	Anodyne	GRIN2B	19	40
C#Cc1cccc(NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819405932	FE	On-Demand	Mild	DRD4	45	36
C#Cc1cccc(NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819405932	FE	On-Demand	Mild	HTR2A	15	45
C#Cc1cccc(NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819405932	FE	On-Demand	Mild	DRD3	21	40
C#Cc1cccc(NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819405932	FE	On-Demand	Mild	ABCB1	40	38
C#Cc1cccc(NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819405933	FE	On-Demand	Mild	DRD4	45	36
C#Cc1cccc(NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819405933	FE	On-Demand	Mild	HTR2A	15	45
C#Cc1cccc(NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819405933	FE	On-Demand	Mild	DRD3	21	40
C#Cc1cccc(NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819405933	FE	On-Demand	Mild	ABCB1	40	38
C#Cc1cccc(NC[C@H](O)COc2ccc(OCC)cc2)c1	ZINC000819405949	DF	On-Demand	Mild	ADRB2	40	40
C#Cc1cccc(NC[C@H](O)COc2ccc(OCC)cc2)c1	ZINC000819405949	DF	On-Demand	Mild	ADRB1	45	40
C#Cc1cccc(NC[C@@H](O)COc2ccc(OCC)cc2)c1	ZINC000819405950	DF	On-Demand	Mild	ADRB2	40	40
C#Cc1cccc(NC[C@@H](O)COc2ccc(OCC)cc2)c1	ZINC000819405950	DF	On-Demand	Mild	ADRB1	45	40
COc1cc(F)ccc1NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819405955	FF	On-Demand	Anodyne	ADRB1	21	43
COc1cc(F)ccc1NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819405955	FF	On-Demand	Anodyne	GRIN2B	15	40
COc1cc(F)ccc1NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819405956	FF	On-Demand	Anodyne	ADRB1	21	43
COc1cc(F)ccc1NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819405956	FF	On-Demand	Anodyne	GRIN2B	15	40
CC(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)CCCO1	ZINC000819405964	GE	On-Demand	Bother	SLC6A9	21	59
CC(C)[C@H]1CN(C(=O)[C@]2(C)CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405985	GG	On-Demand	Anodyne	SLC12A5	65	37
CC(C)[C@H]1CN(C(=O)[C@@]2(C)CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819405987	GG	On-Demand	Anodyne	SLC12A5	65	37
O=C(C(F)=C1CCC1)N1CCc2ccc(F)cc2C1	ZINC000819405988	CG	On-Demand	Anodyne	HDAC6	38	47
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1cccnc1	ZINC000819405998	EE	On-Demand	Anodyne	ADRB2	21	45
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1cccnc1	ZINC000819405998	EE	On-Demand	Anodyne	ADRB1	31	53
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1cccnc1	ZINC000819405998	EE	On-Demand	Anodyne	ADRB3	98	53
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1cccnc1	ZINC000819405998	EE	On-Demand	Anodyne	KCNA5	17	48
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1cccnc1	ZINC000819406000	EE	On-Demand	Anodyne	ADRB2	21	45
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1cccnc1	ZINC000819406000	EE	On-Demand	Anodyne	ADRB1	31	53
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1cccnc1	ZINC000819406000	EE	On-Demand	Anodyne	ADRB3	98	53
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1cccnc1	ZINC000819406000	EE	On-Demand	Anodyne	KCNA5	17	48
C#Cc1cccc(NC(=O)c2sccc2S(=O)(=O)N2CCc3ccccc3C2)c1	ZINC000819406002	HH	On-Demand	Mild	AKR1C3	60	48
O=C(/C=C\[C@H]1CCCO1)N1CCc2ccc(F)cc2C1	ZINC000819406037	CE	On-Demand	Anodyne	HDAC6	34	40
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	ACE	48	43
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	CELA1	31	43
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	ELANE	72	53
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	CMA1	25	40
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	CTRA_BOVIN	68	36
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	CASP3	24	43
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	BMP1	19	41
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	KLK3	82	37
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	CTSB	74	56
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	PAPA1_CARPA	80	41
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	TRY1_BOVIN	41	36
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	CYSP_TRYCR	60	41
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	CTSG	46	36
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	CTSK	66	56
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	CTSL	52	49
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	CCR1	47	55
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	PGA	22	42
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	PREP	30	45
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	CAPNS1	67	38
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	CELA2A	55	36
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	MMP11	57	33
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	CTSS	30	52
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	CAPN1	87	55
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	CASP1	33	48
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	CTRC	24	40
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	CAPN2	137	45
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	CASP6	15	43
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	CASP9	39	43
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	TGM2	36	45
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	KLK5	40	36
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	TPSAB1	56	39
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	NPR	69	38
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	XIAP	40	40
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	PSMB5	47	39
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	BRCA1	58	32
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	Q6PRC7_IXORI	45	36
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)C(C)C)CCCO1	ZINC000819406039	GG	On-Demand	Anodyne	SLC12A5	55	35
O=C(/C=C/[C@H]1CCCO1)N1CCc2ccc(F)cc2C1	ZINC000819406040	CE	On-Demand	Anodyne	HDAC6	34	40
O=C(/C=C/[C@@H]1CCCO1)N1CCc2ccc(F)cc2C1	ZINC000819406044	CE	On-Demand	Anodyne	HDAC6	34	40
O=C(/C=C\[C@@H]1CCCO1)N1CCc2ccc(F)cc2C1	ZINC000819406047	CE	On-Demand	Anodyne	HDAC6	34	40
CCO[C@@H]1C[C@H](NC(=O)/C=C(\C)c2cccc(OC)c2)[C@@H]1n1cccn1	ZINC000819406054	FF	On-Demand	Anodyne	DRD4	43	33
CCO[C@@H]1C[C@H](NC(=O)/C=C(/C)c2cccc(OC)c2)[C@@H]1n1cccn1	ZINC000819406055	FF	On-Demand	Anodyne	DRD4	43	33
CCO[C@@H]1C[C@H](NC(=O)/C=C(/C)c2cccc(OC)c2)[C@H]1n1cccn1	ZINC000819406056	FF	On-Demand	Anodyne	DRD4	43	33
CCO[C@@H]1C[C@H](NC(=O)/C=C(\C)c2cccc(OC)c2)[C@H]1n1cccn1	ZINC000819406058	FF	On-Demand	Anodyne	DRD4	43	33
CC(C)[C@H]1CN(C(=O)c2ccc3c(c2)CCN3C)CCCO1	ZINC000819406093	DF	On-Demand	Anodyne	L3MBTL3	44	33
C#Cc1cccc(NC(=O)c2cc3ccccc3nc2C)c1	ZINC000819406116	CH	On-Demand	Mild	NR2E3	67	41
C#Cc1cccc(NC(=O)c2cc3ccccc3nc2C)c1	ZINC000819406116	CH	On-Demand	Mild	SHH	29	41
C#Cc1cccc(NC(=O)c2cc3ccccc3nc2C)c1	ZINC000819406116	CH	On-Demand	Mild	KCNK3	116	42
C#Cc1cccc(NC(=O)c2cc3ccccc3nc2C)c1	ZINC000819406116	CH	On-Demand	Mild	KCNK9	83	40
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819406129	FE	On-Demand	Anodyne	PTK2	25	42
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819406129	FE	On-Demand	Anodyne	PKM	42	47
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819406130	FE	On-Demand	Anodyne	PTK2	25	42
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819406130	FE	On-Demand	Anodyne	PKM	42	47
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1cccnc1	ZINC000819406135	BD	On-Demand	Mild	ADRB2	17	41
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1cccnc1	ZINC000819406135	BD	On-Demand	Mild	ADRB1	20	47
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1cccnc1	ZINC000819406135	BD	On-Demand	Mild	ADRB3	77	47
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1cccnc1	ZINC000819406136	BD	On-Demand	Mild	ADRB2	17	41
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1cccnc1	ZINC000819406136	BD	On-Demand	Mild	ADRB1	20	47
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1cccnc1	ZINC000819406136	BD	On-Demand	Mild	ADRB3	77	47
C#Cc1cccc(NC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819406140	HE	On-Demand	Mild	ADAM17	26	45
C#Cc1cccc(NC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819406140	HE	On-Demand	Mild	ITGA4	71	35
C#Cc1cccc(NC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819406140	HE	On-Demand	Mild	MMP2	15	49
C#Cc1cccc(NC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819406140	HE	On-Demand	Mild	MMP3	42	41
C#Cc1cccc(NC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819406140	HE	On-Demand	Mild	MMP8	23	41
C#Cc1cccc(NC(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819406141	HE	On-Demand	Mild	ADAM17	26	45
C#Cc1cccc(NC(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819406141	HE	On-Demand	Mild	ITGA4	71	35
C#Cc1cccc(NC(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819406141	HE	On-Demand	Mild	MMP2	15	49
C#Cc1cccc(NC(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819406141	HE	On-Demand	Mild	MMP3	42	41
C#Cc1cccc(NC(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000819406141	HE	On-Demand	Mild	MMP8	23	41
O=S1(=O)CCCN1c1ccc(NC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819406153	FF	On-Demand	Anodyne	CDK1	15	41
O=S1(=O)CCCN1c1ccc(NC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819406154	FF	On-Demand	Anodyne	CDK1	15	41
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)N2CCCO[C@@H](C(C)C)C2)c1	ZINC000819406164	IH	On-Demand	Anodyne	HCN1	48	33
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)N2CCCO[C@@H](C(C)C)C2)c1	ZINC000819406164	IH	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)N2CCCO[C@H](C(C)C)C2)c1	ZINC000819406165	IH	On-Demand	Anodyne	HCN1	48	33
CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)N2CCCO[C@H](C(C)C)C2)c1	ZINC000819406165	IH	On-Demand	Anodyne	HCN4	41	32
CC(C)[C@H]1CN(C(=O)c2cccc(CNC(=O)OC(C)(C)C)c2)CCCO1	ZINC000819406166	GH	On-Demand	Anodyne	FPR1	42	36
CC(C)[C@H]1CN(C(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)CCCO1	ZINC000819406245	GD	On-Demand	Anodyne	KCNA3	24	41
CC(C)[C@H]1CN(C(=O)c2cc(-c3ccc4c(c3)OCCO4)nc3ccccc23)CCCO1	ZINC000819406250	IJ	On-Demand	Anodyne	CCKAR	20	41
CC(C)[C@H]1CN(C(=O)c2cc(-c3ccc4c(c3)OCCO4)nc3ccccc23)CCCO1	ZINC000819406250	IJ	On-Demand	Anodyne	MT-CO2	48	38
CC(C)[C@H]1CN(C(=O)/C=C\c2ccccc2F)CCCO1	ZINC000819406253	CG	On-Demand	Anodyne	ITGAL	64	36
CC(C)[C@H]1CN(C(=O)/C=C/c2ccccc2F)CCCO1	ZINC000819406255	CG	On-Demand	Anodyne	ITGAL	64	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](O)c1cccnc1)C2	ZINC000819406267	ED	On-Demand	Anodyne	ADRB3	47	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](O)c1cccnc1)C2	ZINC000819406268	ED	On-Demand	Anodyne	ADRB3	47	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](O)c1cccnc1)C2	ZINC000819406269	ED	On-Demand	Anodyne	ADRB3	47	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](O)c1cccnc1)C2	ZINC000819406270	ED	On-Demand	Anodyne	ADRB3	47	39
C[C@@H]1CCCC[C@H]1C(=O)NC[C@H](O)c1cccnc1	ZINC000819406306	CE	On-Demand	Anodyne	ADRB1	20	42
C[C@@H]1CCCC[C@H]1C(=O)NC[C@H](O)c1cccnc1	ZINC000819406306	CE	On-Demand	Anodyne	ADRB3	84	46
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@@H](O)c1cccnc1	ZINC000819406307	CE	On-Demand	Anodyne	ADRB1	20	42
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@@H](O)c1cccnc1	ZINC000819406307	CE	On-Demand	Anodyne	ADRB3	84	46
C[C@@H]1CCCC[C@H]1C(=O)NC[C@@H](O)c1cccnc1	ZINC000819406308	CE	On-Demand	Anodyne	ADRB1	20	42
C[C@@H]1CCCC[C@H]1C(=O)NC[C@@H](O)c1cccnc1	ZINC000819406308	CE	On-Demand	Anodyne	ADRB3	84	46
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@H](O)c1cccnc1	ZINC000819406309	CE	On-Demand	Anodyne	ADRB1	20	42
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@H](O)c1cccnc1	ZINC000819406309	CE	On-Demand	Anodyne	ADRB3	84	46
COCCOc1cc(NC[C@H](C)O)ccc1OC	ZINC000819406335	CD	On-Demand	Anodyne	ENPP1	61	32
COCCOc1cc(NC[C@H](C)O)ccc1OC	ZINC000819406335	CD	On-Demand	Anodyne	DRTS_TRYCR	53	38
COCCOc1cc(NC[C@@H](C)O)ccc1OC	ZINC000819406336	CD	On-Demand	Anodyne	ENPP1	61	32
COCCOc1cc(NC[C@@H](C)O)ccc1OC	ZINC000819406336	CD	On-Demand	Anodyne	DRTS_TRYCR	53	38
CC(C)[C@H]1CN(C(=O)[C@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406435	GE	On-Demand	Anodyne	CTRA_BOVIN	50	31
CC(C)[C@H]1CN(C(=O)[C@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406435	GE	On-Demand	Anodyne	KLK3	51	31
CC(C)[C@H]1CN(C(=O)[C@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406435	GE	On-Demand	Anodyne	CTSG	40	31
CC(C)[C@H]1CN(C(=O)[C@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406435	GE	On-Demand	Anodyne	CTSK	37	42
CC(C)[C@H]1CN(C(=O)[C@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406435	GE	On-Demand	Anodyne	CTSL	31	42
CC(C)[C@H]1CN(C(=O)[C@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406435	GE	On-Demand	Anodyne	CAPNS1	59	37
CC(C)[C@H]1CN(C(=O)[C@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406435	GE	On-Demand	Anodyne	CELA2A	40	31
CC(C)[C@H]1CN(C(=O)[C@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406435	GE	On-Demand	Anodyne	CTSS	17	42
CC(C)[C@H]1CN(C(=O)[C@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406435	GE	On-Demand	Anodyne	CAPN1	53	38
CC(C)[C@H]1CN(C(=O)[C@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406435	GE	On-Demand	Anodyne	CAPN2	92	38
CC(C)[C@H]1CN(C(=O)[C@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406435	GE	On-Demand	Anodyne	NPR	59	35
CC(C)[C@H]1CN(C(=O)[C@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406435	GE	On-Demand	Anodyne	SLC12A5	63	38
CC(C)[C@H]1CN(C(=O)[C@@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406437	GE	On-Demand	Anodyne	CTRA_BOVIN	50	31
CC(C)[C@H]1CN(C(=O)[C@@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406437	GE	On-Demand	Anodyne	KLK3	51	31
CC(C)[C@H]1CN(C(=O)[C@@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406437	GE	On-Demand	Anodyne	CTSG	40	31
CC(C)[C@H]1CN(C(=O)[C@@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406437	GE	On-Demand	Anodyne	CTSK	37	42
CC(C)[C@H]1CN(C(=O)[C@@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406437	GE	On-Demand	Anodyne	CTSL	31	42
CC(C)[C@H]1CN(C(=O)[C@@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406437	GE	On-Demand	Anodyne	CAPNS1	59	37
CC(C)[C@H]1CN(C(=O)[C@@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406437	GE	On-Demand	Anodyne	CELA2A	40	31
CC(C)[C@H]1CN(C(=O)[C@@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406437	GE	On-Demand	Anodyne	CTSS	17	42
CC(C)[C@H]1CN(C(=O)[C@@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406437	GE	On-Demand	Anodyne	CAPN1	53	38
CC(C)[C@H]1CN(C(=O)[C@@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406437	GE	On-Demand	Anodyne	CAPN2	92	38
CC(C)[C@H]1CN(C(=O)[C@@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406437	GE	On-Demand	Anodyne	NPR	59	35
CC(C)[C@H]1CN(C(=O)[C@@]2(NC(=O)OCc3ccccc3)CCOC2)CCCO1	ZINC000819406437	GE	On-Demand	Anodyne	SLC12A5	63	38
CCCCCCCCC(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819406442	CI	On-Demand	Mild	CQSS	53	34
CCCCCCCCC(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819406443	CI	On-Demand	Mild	CQSS	53	34
O=C(O)CCCCCNCc1cccc(F)c1F	ZINC000819406448	CF	On-Demand	Anodyne	FOLH1	15	43
O=C(O)CCCCCNCc1cccc(F)c1F	ZINC000819406448	CF	On-Demand	Anodyne	LEF	69	41
CC(C)[C@H]1CN(C(=O)[C@](C)(O)c2ccccc2C(F)(F)F)CCCO1	ZINC000819406452	FG	On-Demand	Anodyne	RBP4	56	36
CC(C)[C@H]1CN(C(=O)[C@](C)(O)c2ccccc2C(F)(F)F)CCCO1	ZINC000819406452	FG	On-Demand	Anodyne	SFRP1	64	32
CC(C)[C@H]1CN(C(=O)[C@](C)(O)c2ccccc2C(F)(F)F)CCCO1	ZINC000819406452	FG	On-Demand	Anodyne	WNT3	55	32
CC(C)[C@H]1CN(C(=O)[C@@](C)(O)c2ccccc2C(F)(F)F)CCCO1	ZINC000819406455	FG	On-Demand	Anodyne	RBP4	56	36
CC(C)[C@H]1CN(C(=O)[C@@](C)(O)c2ccccc2C(F)(F)F)CCCO1	ZINC000819406455	FG	On-Demand	Anodyne	SFRP1	64	32
CC(C)[C@H]1CN(C(=O)[C@@](C)(O)c2ccccc2C(F)(F)F)CCCO1	ZINC000819406455	FG	On-Demand	Anodyne	WNT3	55	32
O=C(O)CCCCCNCc1cncnc1	ZINC000819406457	BD	On-Demand	Anodyne	S1PR2	18	48
O=C(O)CCCCCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000819406458	FG	On-Demand	Anodyne	EPHX2	19	50
O=C(O)CCCCCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000819406458	FG	On-Demand	Anodyne	SFRP1	22	43
O=C(O)CCCCCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000819406458	FG	On-Demand	Anodyne	L3MBTL3	41	41
O=C(O)CCCCCNCc1c(F)cccc1F	ZINC000819406463	CF	On-Demand	Anodyne	LEF	40	33
O=C(O)CCCCCNCc1cnc2ccccc2c1	ZINC000819406471	CF	On-Demand	Anodyne	LTB4R	21	41
O=C(O)CCCCCNCc1cnc2ccccc2c1	ZINC000819406471	CF	On-Demand	Anodyne	FAAH	39	41
O=C(O)CCCCCNCc1cnc2ccccc2c1	ZINC000819406471	CF	On-Demand	Anodyne	S1PR1	15	42
O=C(O)CCCCCNCc1cnc2ccccc2c1	ZINC000819406471	CF	On-Demand	Anodyne	METG	45	36
O=C(O)CCCCCNS(=O)(=O)C1=Cc2ccccc2CC1	ZINC000819406473	DF	On-Demand	Anodyne	TBXA2R	16	59
O=C(O)CCCCCN[C@H]1CCN(c2ccccc2)C1	ZINC000819406481	CE	On-Demand	Anodyne	PTGFR	40	39
O=C(O)CCCCCN[C@@H]1CCN(c2ccccc2)C1	ZINC000819406482	CE	On-Demand	Anodyne	PTGFR	40	39
O=C(O)CCCCCNCc1cccnc1Cl	ZINC000819406486	CE	On-Demand	Anodyne	TBXAS1	36	40
O=C(O)CCCCCNCc1ccc2c[nH]nc2c1	ZINC000819406491	CE	On-Demand	Anodyne	S1PR2	30	44
O=C(O)CCCCCNCc1ccc2c[nH]nc2c1	ZINC000819406491	CE	On-Demand	Anodyne	LEF	62	35
O=C(O)CCCCCNC(=O)c1nc(=O)c2ccccc2[nH]1	ZINC000819406492	DD	On-Demand	Anodyne	BCHE	45	34
O=C(O)CCCCCNCc1cc(Br)ccc1O	ZINC000819406494	DF	On-Demand	Clean	GRIA1	48	33
O=C(O)CCCCCNCc1nccc2ccccc12	ZINC000819406495	CF	On-Demand	Anodyne	LTB4R	19	40
O=C(O)CCCCCNCc1cc(F)c(F)c(F)c1	ZINC000819406498	CF	On-Demand	Anodyne	LPAR2	53	38
O=C(O)CCCCCNCc1cc(F)c(F)c(F)c1	ZINC000819406498	CF	On-Demand	Anodyne	S1PR2	57	38
O=C(O)CCCCCNCc1cc(F)c(F)c(F)c1	ZINC000819406498	CF	On-Demand	Anodyne	LEF	78	36
O=C(O)CCCCCNC(=O)c1ccc2c(O)nc(S)nc2c1	ZINC000819406499	ED	On-Demand	Anodyne	HDAC9	20	47
O=C(O)CCCCCNC1CCN(C(=O)c2ccoc2)CC1	ZINC000819406500	DE	On-Demand	Anodyne	L3MBTL3	43	32
O=C(O)CCCCCNCc1cc(Cl)ccc1O	ZINC000819406502	CF	On-Demand	Clean	GRIA1	61	35
O=C(O)CCCCCNCc1cc(Cl)ccc1O	ZINC000819406502	CF	On-Demand	Clean	METG	18	41
O=C(O)CCCCCNCc1ccc2nc[nH]c2c1	ZINC000819406505	CE	On-Demand	Anodyne	S1PR2	35	46
O=C(O)CCCCCNCc1ccc2nc[nH]c2c1	ZINC000819406505	CE	On-Demand	Anodyne	LEF	43	34
O=C(O)CCCCCNC(=O)c1cccnc1S	ZINC000819406506	CD	On-Demand	Anodyne	TBXA2R	15	40
O=C(O)CCCCCNC(=O)c1cccnc1S	ZINC000819406506	CD	On-Demand	Anodyne	TBXAS1	40	40
O=C(O)CCCCCNC(=O)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O	ZINC000819406508	GH	On-Demand	Anodyne	DRD3	26	41
O=C(O)CCCCCNC(=O)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O	ZINC000819406508	GH	On-Demand	Anodyne	HDAC9	19	40
O=C(O)CCCCCNC(=O)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O	ZINC000819406509	GH	On-Demand	Anodyne	DRD3	26	41
O=C(O)CCCCCNC(=O)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O	ZINC000819406509	GH	On-Demand	Anodyne	HDAC9	19	40
O=C(O)CCCCCNCc1cn2cc(Cl)ccc2n1	ZINC000819406510	CF	On-Demand	Anodyne	MAP3K5	24	41
O=C(O)CCCCCNC(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819406513	CD	On-Demand	Anodyne	DRD3	16	41
O=C(O)CCCCCNC(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819406513	CD	On-Demand	Anodyne	FOLH1	36	41
O=C(O)CCCCCNC(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819406513	CD	On-Demand	Anodyne	TBXAS1	42	37
O=C(O)CCCCCNC(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819406513	CD	On-Demand	Anodyne	BCHE	44	38
O=C(O)CCCCCNC(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819406513	CD	On-Demand	Anodyne	HDAC8	17	51
O=C(O)CCCCCNC(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819406513	CD	On-Demand	Anodyne	HDAC1	18	51
O=C(O)CCCCCNC(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819406513	CD	On-Demand	Anodyne	HDAC2	16	51
O=C(O)CCCCCNC(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819406513	CD	On-Demand	Anodyne	HDAC3	18	45
O=C(O)CCCCCNC(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819406513	CD	On-Demand	Anodyne	HDAC4	15	45
O=C(O)CCCCCNC(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819406513	CD	On-Demand	Anodyne	HDAC6	18	51
O=C(O)CCCCCNC1CCN(c2ccccn2)CC1	ZINC000819406515	CE	On-Demand	Anodyne	SIGMAR1	15	41
O=C(O)CCCCCNC(=S)N[C@@H]1CCOc2ccccc21	ZINC000819406516	DF	On-Demand	Anodyne	LUXR	43	34
O=C(O)CCCCCNC(=S)N[C@@H]1CCOc2ccccc21	ZINC000819406516	DF	On-Demand	Anodyne	TRAR	42	34
O=C(O)CCCCCNC(=S)N[C@@H]1CCOc2ccccc21	ZINC000819406516	DF	On-Demand	Anodyne	LASR	40	34
O=C(O)CCCCCNC(=S)N[C@H]1CCOc2ccccc21	ZINC000819406517	DF	On-Demand	Anodyne	LUXR	43	34
O=C(O)CCCCCNC(=S)N[C@H]1CCOc2ccccc21	ZINC000819406517	DF	On-Demand	Anodyne	TRAR	42	34
O=C(O)CCCCCNC(=S)N[C@H]1CCOc2ccccc21	ZINC000819406517	DF	On-Demand	Anodyne	LASR	40	34
O=C(O)CCCCCNC(=S)Nc1ccc2c(c1)OCCCO2	ZINC000819406519	EF	On-Demand	Anodyne	QPCT	50	51
O=C(O)CCCCCNC(=S)Nc1ccc2c(c1)CCC2	ZINC000819406521	DG	On-Demand	Anodyne	QPCT	45	44
O=C(O)CCCCCNC(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1	ZINC000819406524	GF	On-Demand	Anodyne	PTGS1	17	41
O=C(O)CCCCCNC(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1	ZINC000819406524	GF	On-Demand	Anodyne	DRD3	26	42
O=C(O)CCCCCNC(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1	ZINC000819406524	GF	On-Demand	Anodyne	HDAC8	18	40
O=C(O)CCCCCNC(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1	ZINC000819406524	GF	On-Demand	Anodyne	HDAC2	16	40
O=C(O)CCCCCNC(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1	ZINC000819406524	GF	On-Demand	Anodyne	HDAC3	19	40
C[C@@](O)(CNc1ccc2c(c1)CCC(=O)N2)c1ccc(Br)cc1F	ZINC000819406528	GH	On-Demand	Anodyne	PKM	38	43
O=C(O)CCCCCNCc1cc(O)ccc1Br	ZINC000819406534	DF	On-Demand	Anodyne	GRIA1	70	37
O=C(O)CCCCCNC(=S)Nc1ccc2c(c1)OCCO2	ZINC000819406537	DE	On-Demand	Anodyne	QPCT	51	54
O=C(O)CCCCCNC(=O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819406539	ED	On-Demand	Anodyne	DRD4	44	35
O=C(O)CCCCCNC(=O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819406539	ED	On-Demand	Anodyne	DRD3	26	42
O=C(O)CCCCCNC(=O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819406539	ED	On-Demand	Anodyne	HDAC9	24	40
O=C(O)CCCCCNC(=O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819406539	ED	On-Demand	Anodyne	PLD2	53	37
O=C(O)CCCCCNCc1cc[nH]c1	ZINC000819406541	BD	On-Demand	Anodyne	S1PR2	28	49
O=C(O)CCCCCNC(=O)c1ccc2nc(O)oc2c1	ZINC000819406542	CD	On-Demand	Anodyne	HDAC9	25	50
O=C(O)CCCCCNCc1ccc(Cl)nc1	ZINC000819406544	CE	On-Demand	Anodyne	LPAR2	45	38
O=C(O)CCCCCNCc1ccc(Cl)nc1	ZINC000819406544	CE	On-Demand	Anodyne	S1PR2	53	49
O=C(O)CCCCCNCc1ccc(Cl)nc1	ZINC000819406544	CE	On-Demand	Anodyne	NACHRBETA2	40	39
O=C(O)CCCCCNC1CCN(c2ccccc2)CC1	ZINC000819406546	CF	On-Demand	Anodyne	HTR1A	23	44
O=C(O)CCCCCNC1CCN(c2ccccc2)CC1	ZINC000819406546	CF	On-Demand	Anodyne	DRD4	17	42
O=C(O)CCCCCNC1CCN(c2ccccc2)CC1	ZINC000819406546	CF	On-Demand	Anodyne	HTR2A	18	44
O=C(O)CCCCCNC1CCN(c2ccccc2)CC1	ZINC000819406546	CF	On-Demand	Anodyne	DRD3	16	42
O=C(O)CCCCCNC1CCN(c2ccccc2)CC1	ZINC000819406546	CF	On-Demand	Anodyne	HTR7	30	42
O=C(O)CCCCCNC1CCN(c2ccccc2)CC1	ZINC000819406546	CF	On-Demand	Anodyne	SIGMAR1	16	40
O=C(O)CCCCCNC1CCN(c2ccccc2)CC1	ZINC000819406546	CF	On-Demand	Anodyne	HDAC8	18	45
O=C(O)CCCCCNCc1cnn2ccccc12	ZINC000819406548	CE	On-Demand	Anodyne	TBXAS1	20	43
O=S1(=O)CCCN1c1ccc(NC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819406557	FF	On-Demand	Anodyne	CDK1	15	44
O=S1(=O)CCCN1c1ccc(NC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819406558	FF	On-Demand	Anodyne	CDK1	15	44
O=C1CCc2cc(NC[C@H](O)c3ccc(C(F)(F)F)cc3)ccc2N1	ZINC000819406560	FH	On-Demand	Anodyne	PTK2B	20	42
O=C1CCc2cc(NC[C@@H](O)c3ccc(C(F)(F)F)cc3)ccc2N1	ZINC000819406561	FH	On-Demand	Anodyne	PTK2B	20	42
O=S1(=O)CCCN1c1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819406589	FG	On-Demand	Anodyne	ADRB1	26	46
O=S1(=O)CCCN1c1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819406589	FG	On-Demand	Anodyne	ADRB3	40	42
O=S1(=O)CCCN1c1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819406589	FG	On-Demand	Anodyne	CDK1	16	45
O=S1(=O)CCCN1c1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819406589	FG	On-Demand	Anodyne	CYP3A4	49	39
O=S1(=O)CCCN1c1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819406590	FG	On-Demand	Anodyne	ADRB1	26	46
O=S1(=O)CCCN1c1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819406590	FG	On-Demand	Anodyne	ADRB3	40	42
O=S1(=O)CCCN1c1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819406590	FG	On-Demand	Anodyne	CDK1	16	45
O=S1(=O)CCCN1c1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819406590	FG	On-Demand	Anodyne	CYP3A4	49	39
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@@H](O)c1cccnc1	ZINC000819406618	FF	On-Demand	Anodyne	ADRB2	17	44
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@@H](O)c1cccnc1	ZINC000819406618	FF	On-Demand	Anodyne	ADRB1	21	42
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@@H](O)c1cccnc1	ZINC000819406618	FF	On-Demand	Anodyne	ADRB3	80	44
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@@H](O)c1cccnc1	ZINC000819406618	FF	On-Demand	Anodyne	SCD1	18	43
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@H](O)c1cccnc1	ZINC000819406619	FF	On-Demand	Anodyne	ADRB2	17	44
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@H](O)c1cccnc1	ZINC000819406619	FF	On-Demand	Anodyne	ADRB1	21	42
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@H](O)c1cccnc1	ZINC000819406619	FF	On-Demand	Anodyne	ADRB3	80	44
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@H](O)c1cccnc1	ZINC000819406619	FF	On-Demand	Anodyne	SCD1	18	43
COCCOc1cc(NC[C@@H](C)S(C)(=O)=O)ccc1OC	ZINC000819406623	DD	On-Demand	Anodyne	ENPP1	45	30
COCCOc1cc(NC[C@@H](C)S(C)(=O)=O)ccc1OC	ZINC000819406623	DD	On-Demand	Anodyne	DRTS_TRYCR	53	38
COCCOc1cc(NC[C@H](C)S(C)(=O)=O)ccc1OC	ZINC000819406624	DD	On-Demand	Anodyne	ENPP1	45	30
COCCOc1cc(NC[C@H](C)S(C)(=O)=O)ccc1OC	ZINC000819406624	DD	On-Demand	Anodyne	DRTS_TRYCR	53	38
CC(=O)Nc1cccc(CC(=O)NCCc2cnc(C)s2)c1	ZINC000819406629	DE	On-Demand	Anodyne	PTGIR	16	42
CSc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819406634	GG	On-Demand	Anodyne	ADRB1	46	37
CSc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819406634	GG	On-Demand	Anodyne	ADRB3	29	40
CSc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819406637	GG	On-Demand	Anodyne	ADRB1	46	37
CSc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819406637	GG	On-Demand	Anodyne	ADRB3	29	40
CC(C)(C)OC(=O)N1CC[C@H](N(C(=O)c2cc3c(cn2)OCCO3)C2CC2)C1	ZINC000819406647	GE	On-Demand	Anodyne	GPR119	43	40
CC(C)(C)OC(=O)N1CC[C@@H](N(C(=O)c2cc3c(cn2)OCCO3)C2CC2)C1	ZINC000819406648	GE	On-Demand	Anodyne	GPR119	43	40
COCCOc1cc(NCCS(=O)(=O)c2ccc(C#N)cc2)ccc1OC	ZINC000819406650	GE	On-Demand	Mild	DRTS_TRYCR	47	34
CC(=O)Nc1cccc(CC(=O)N2CCC([C@H](O)c3nccn3C)CC2)c1	ZINC000819406651	FD	On-Demand	Anodyne	HTR1D	21	40
CC(=O)Nc1cccc(CC(=O)N2CCC([C@@H](O)c3nccn3C)CC2)c1	ZINC000819406652	FD	On-Demand	Anodyne	HTR1D	21	40
COCCOc1cc(NC[C@H](O)c2ccccc2Br)ccc1OC	ZINC000819406665	GH	On-Demand	Anodyne	DRTS_TRYCR	40	36
COCCOc1cc(NC[C@@H](O)c2ccccc2Br)ccc1OC	ZINC000819406666	GH	On-Demand	Anodyne	DRTS_TRYCR	40	36
COCCOc1cc(NC[C@H](O)c2ccc(F)cc2F)ccc1OC	ZINC000819406667	FG	On-Demand	Anodyne	DRTS_TRYCR	50	37
COCCOc1cc(NC[C@@H](O)c2ccc(F)cc2F)ccc1OC	ZINC000819406668	FG	On-Demand	Anodyne	DRTS_TRYCR	50	37
CCCOc1cccc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819406669	DH	On-Demand	Bother	ACR	17	44
CCCOc1cccc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819406670	DH	On-Demand	Bother	ACR	17	44
COCCOc1cc(NC[C@@H](O)Cc2ccccc2)ccc1OC	ZINC000819406675	EF	On-Demand	Anodyne	DRTS_TRYCR	54	39
COCCOc1cc(NC[C@H](O)Cc2ccccc2)ccc1OC	ZINC000819406676	EF	On-Demand	Anodyne	DRTS_TRYCR	54	39
CCCOc1cccc(NC[C@H](O)c2ccc(F)cc2)c1	ZINC000819406691	CH	On-Demand	Anodyne	FAAH	15	40
CCCOc1cccc(NC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819406692	CH	On-Demand	Anodyne	FAAH	15	40
COCCOc1cc(NC[C@H](O)c2ccc(F)cc2)ccc1OC	ZINC000819406695	EG	On-Demand	Anodyne	ENPP1	68	33
COCCOc1cc(NC[C@H](O)c2ccc(F)cc2)ccc1OC	ZINC000819406695	EG	On-Demand	Anodyne	DRTS_TRYCR	53	41
COCCOc1cc(NC[C@@H](O)c2ccc(F)cc2)ccc1OC	ZINC000819406696	EG	On-Demand	Anodyne	ENPP1	68	33
COCCOc1cc(NC[C@@H](O)c2ccc(F)cc2)ccc1OC	ZINC000819406696	EG	On-Demand	Anodyne	DRTS_TRYCR	53	41
COCCOc1cc(NC[C@@H](O)C2CC2)ccc1OC	ZINC000819406703	CD	On-Demand	Anodyne	ENPP1	69	34
COCCOc1cc(NC[C@@H](O)C2CC2)ccc1OC	ZINC000819406703	CD	On-Demand	Anodyne	DRTS_TRYCR	49	36
COCCOc1cc(NC[C@H](O)C2CC2)ccc1OC	ZINC000819406704	CD	On-Demand	Anodyne	ENPP1	69	34
COCCOc1cc(NC[C@H](O)C2CC2)ccc1OC	ZINC000819406704	CD	On-Demand	Anodyne	DRTS_TRYCR	49	36
CON(C)C(=O)CCNc1cccc(COc2cccc(F)c2)c1	ZINC000819406711	EG	On-Demand	Anodyne	MAOB	28	44
COCCOc1cc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)ccc1OC	ZINC000819406712	GH	On-Demand	Anodyne	DRTS_TRYCR	51	39
COCCOc1cc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)ccc1OC	ZINC000819406713	GH	On-Demand	Anodyne	DRTS_TRYCR	51	39
CCCOc1cccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819406715	EG	On-Demand	Anodyne	ADRB2	17	40
CCCOc1cccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819406715	EG	On-Demand	Anodyne	ADRB3	36	40
O[C@@H](CNc1cccc(OCC(F)(F)F)c1)c1ccccc1F	ZINC000819406716	EH	On-Demand	Anodyne	PDS	44	35
O[C@H](CNc1cccc(OCC(F)(F)F)c1)c1ccccc1F	ZINC000819406717	EH	On-Demand	Anodyne	PDS	44	35
COCCOc1cc(NCCC(=O)Nc2ccc(Cl)cc2)ccc1OC	ZINC000819406721	GH	On-Demand	Anodyne	HTR2A	24	40
COCCOc1cc(NCCC(=O)Nc2ccc(Cl)cc2)ccc1OC	ZINC000819406721	GH	On-Demand	Anodyne	CPT1A	68	37
COCCOc1cc(NCCC(=O)Nc2ccc(Cl)cc2)ccc1OC	ZINC000819406721	GH	On-Demand	Anodyne	CPT2	45	35
COCCOc1cc(NCCC(=O)Nc2ccc(Cl)cc2)ccc1OC	ZINC000819406721	GH	On-Demand	Anodyne	GRM4	16	41
COCCOc1cc(NCCC(=O)Nc2ccc(Cl)cc2)ccc1OC	ZINC000819406721	GH	On-Demand	Anodyne	CPT1B	55	36
COCCOc1cc(NCCC(=O)Nc2ccc(Cl)cc2)ccc1OC	ZINC000819406721	GH	On-Demand	Anodyne	SCD1	33	40
COCCOc1cc(NCCC(=O)Nc2ccc(Cl)cc2)ccc1OC	ZINC000819406721	GH	On-Demand	Anodyne	SCD	23	40
COCCOc1cc(NCCC(=O)Nc2ccc(Cl)cc2)ccc1OC	ZINC000819406721	GH	On-Demand	Anodyne	ENPP1	76	40
COCCOc1cc(NCCC(=O)Nc2ccc(Cl)cc2)ccc1OC	ZINC000819406721	GH	On-Demand	Anodyne	DRTS_TRYCR	56	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(OCC(F)(F)F)c1	ZINC000819406726	GG	On-Demand	Anodyne	PDS	53	38
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(OCC(F)(F)F)c1	ZINC000819406727	GG	On-Demand	Anodyne	PDS	53	38
CCCOc1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819406733	DH	On-Demand	Bother	ADRB3	21	40
CCCOc1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819406733	DH	On-Demand	Bother	CACNA1D	49	35
CCCOc1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819406734	DH	On-Demand	Bother	ADRB3	21	40
CCCOc1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819406734	DH	On-Demand	Bother	CACNA1D	49	35
C#CCNS(=O)(=O)c1ccc(C(=O)N2CCCO[C@H](C(C)C)C2)cc1	ZINC000819406761	FD	On-Demand	Mild	L3MBTL3	45	36
C#CCNS(=O)(=O)c1ccc(C(=O)N2CCCO[C@@H](C(C)C)C2)cc1	ZINC000819406762	FD	On-Demand	Mild	L3MBTL3	45	36
CC(C)[C@H]1CN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)CCCO1	ZINC000819406802	HE	On-Demand	Anodyne	PREP	32	40
CC(C)[C@H]1CN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)CCCO1	ZINC000819406802	HE	On-Demand	Anodyne	NPR	57	33
CC(C)[C@H]1CN(C(=O)CN2CCN(C(=O)OCc3ccccc3)CC2)CCCO1	ZINC000819406802	HE	On-Demand	Anodyne	SLC12A5	52	35
CC(C)[C@H]1CN(C(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)CCCO1	ZINC000819406807	HD	On-Demand	Anodyne	SLC6A9	35	41
CC(C)[C@H]1CN(C(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)CCCO1	ZINC000819406812	GE	On-Demand	Anodyne	CCR8	76	36
CC(C)[C@H]1CN(C(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)CCCO1	ZINC000819406812	GE	On-Demand	Anodyne	SFRP1	113	41
CC(C)[C@H]1CN(C(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)CCCO1	ZINC000819406812	GE	On-Demand	Anodyne	WNT3	73	33
CC(C)[C@H]1CN(C(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)CCCO1	ZINC000819406812	GE	On-Demand	Anodyne	L3MBTL3	40	32
Cn1ccnc1[C@H](O)C1CCN(C(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819406840	GF	On-Demand	Anodyne	C3AR1	42	41
Cn1ccnc1[C@@H](O)C1CCN(C(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819406841	GF	On-Demand	Anodyne	C3AR1	42	41
COCCOc1cc(NC[C@H](O)C(C)(C)C)ccc1OC	ZINC000819406842	CF	On-Demand	Anodyne	ENPP1	45	31
COCCOc1cc(NC[C@H](O)C(C)(C)C)ccc1OC	ZINC000819406842	CF	On-Demand	Anodyne	DRTS_TRYCR	52	37
COCCOc1cc(NC[C@@H](O)C(C)(C)C)ccc1OC	ZINC000819406843	CF	On-Demand	Anodyne	ENPP1	45	31
COCCOc1cc(NC[C@@H](O)C(C)(C)C)ccc1OC	ZINC000819406843	CF	On-Demand	Anodyne	DRTS_TRYCR	52	37
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	ACE	39	43
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	ELANE	29	42
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	CTRA_BOVIN	68	35
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	KLK3	81	36
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	CTSB	65	46
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	PAPA1_CARPA	58	37
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	TRY1_BOVIN	56	35
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	CYSP_TRYCR	58	41
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	CTSG	46	35
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	CTSK	65	49
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	CTSL	49	49
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	PREP	28	44
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	CAPNS1	65	36
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	CELA2A	55	35
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	MMP11	46	31
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	CTSS	31	49
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	CAPN1	86	44
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	CASP1	25	41
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	CAPN2	143	44
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	TGM2	34	44
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	KLK5	40	36
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	TPSAB1	50	37
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	NPR	70	35
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	Q6PRC7_IXORI	41	39
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406872	HH	On-Demand	Anodyne	SLC12A5	52	34
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	ACE	39	43
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	ELANE	29	42
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	CTRA_BOVIN	68	35
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	KLK3	81	36
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	CTSB	65	46
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	PAPA1_CARPA	58	37
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	TRY1_BOVIN	56	35
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	CYSP_TRYCR	58	41
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	CTSG	46	35
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	CTSK	65	49
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	CTSL	49	49
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	PREP	28	44
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	CAPNS1	65	36
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	CELA2A	55	35
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	MMP11	46	31
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	CTSS	31	49
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	CAPN1	86	44
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	CASP1	25	41
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	CAPN2	143	44
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	TGM2	34	44
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	KLK5	40	36
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	TPSAB1	50	37
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	NPR	70	35
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	Q6PRC7_IXORI	41	39
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)OCc2ccccc2)c2ccccc2)CCCO1	ZINC000819406876	HH	On-Demand	Anodyne	SLC12A5	52	34
CC(C)[C@H]1CN(C(=O)c2ccc(S(F)(F)(F)(F)F)cc2)CCCO1	ZINC000819406886	FK	On-Demand	Reactive	L3MBTL3	58	39
CC(C)[C@H]1CN(C(=O)c2ccc(SC(F)F)cc2)CCCO1	ZINC000819406893	EH	On-Demand	Anodyne	L3MBTL3	45	37
CCCOc1cccc(NCCC(=O)N(C)OC)c1	ZINC000819406899	CE	On-Demand	Anodyne	MTNR1A	29	40
CCCOc1cccc(NCCC(=O)N(C)OC)c1	ZINC000819406899	CE	On-Demand	Anodyne	MTNR1B	28	40
CC(C)[C@H]1CN(C(=O)/C=C\c2ccccc2Cl)CCCO1	ZINC000819406927	DH	On-Demand	Anodyne	ITGAL	57	40
CC(C)[C@H]1CN(C(=O)/C=C/c2ccccc2Cl)CCCO1	ZINC000819406929	DH	On-Demand	Anodyne	ITGAL	57	40
Cc1ccc(OC[C@@H](O)CNc2cccc(CN(C)C(=O)C(F)(F)F)c2)cc1	ZINC000819406982	GG	On-Demand	Anodyne	ADRB2	31	41
Cc1ccc(OC[C@@H](O)CNc2cccc(CN(C)C(=O)C(F)(F)F)c2)cc1	ZINC000819406982	GG	On-Demand	Anodyne	ADRB1	44	37
Cc1ccc(OC[C@@H](O)CNc2cccc(CN(C)C(=O)C(F)(F)F)c2)cc1	ZINC000819406982	GG	On-Demand	Anodyne	PDS	59	32
Cc1ccc(OC[C@H](O)CNc2cccc(CN(C)C(=O)C(F)(F)F)c2)cc1	ZINC000819406984	GG	On-Demand	Anodyne	ADRB2	31	41
Cc1ccc(OC[C@H](O)CNc2cccc(CN(C)C(=O)C(F)(F)F)c2)cc1	ZINC000819406984	GG	On-Demand	Anodyne	ADRB1	44	37
Cc1ccc(OC[C@H](O)CNc2cccc(CN(C)C(=O)C(F)(F)F)c2)cc1	ZINC000819406984	GG	On-Demand	Anodyne	PDS	59	32
COCCOc1cc(NCCS(=O)(=O)c2ccccc2)ccc1OC	ZINC000819406986	FF	On-Demand	Anodyne	CPT1A	42	29
COCCOc1cc(NCCS(=O)(=O)c2ccccc2)ccc1OC	ZINC000819406986	FF	On-Demand	Anodyne	DRTS_TRYCR	53	39
CC(C)[C@H]1CN(C(=O)/C=C\c2ccccc2OC(F)(F)F)CCCO1	ZINC000819406995	FH	On-Demand	Anodyne	ITGAL	93	39
CC(C)[C@H]1CN(C(=O)/C=C/c2ccccc2OC(F)(F)F)CCCO1	ZINC000819406998	FH	On-Demand	Anodyne	ITGAL	93	39
C#Cc1cccc(NC(=O)CSc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)c1	ZINC000819407004	IJ	On-Demand	Mild	HCRTR2	19	63
O[C@@H](CNc1cccc(OCC(F)(F)F)c1)c1cc(F)ccc1F	ZINC000819407023	EI	On-Demand	Anodyne	PDS	44	35
O[C@H](CNc1cccc(OCC(F)(F)F)c1)c1cc(F)ccc1F	ZINC000819407024	EI	On-Demand	Anodyne	PDS	44	35
CC(C)[C@H]1CN(C(=O)[C@](C)(O)c2cccc(C(F)(F)F)c2)CCCO1	ZINC000819407059	FG	On-Demand	Anodyne	CACNA1B	42	35
CC(C)[C@H]1CN(C(=O)[C@@](C)(O)c2cccc(C(F)(F)F)c2)CCCO1	ZINC000819407061	FG	On-Demand	Anodyne	CACNA1B	42	35
COCCOc1cc(NC[C@H](O)CC(F)(F)F)ccc1OC	ZINC000819407095	DE	On-Demand	Anodyne	DRTS_TRYCR	52	37
COCCOc1cc(NC[C@@H](O)CC(F)(F)F)ccc1OC	ZINC000819407096	DE	On-Demand	Anodyne	DRTS_TRYCR	52	37
COCCOc1cc(NCCC(=O)Nc2cccc(F)c2C)ccc1OC	ZINC000819407099	GH	On-Demand	Anodyne	ENPP1	66	32
COCCOc1cc(NCCC(=O)Nc2cccc(F)c2C)ccc1OC	ZINC000819407099	GH	On-Demand	Anodyne	DRTS_TRYCR	52	39
COCCOc1cc(NC[C@@H](O)Cc2ccc3ccccc3c2)ccc1OC	ZINC000819407120	GH	On-Demand	Anodyne	CASR	41	37
COCCOc1cc(NC[C@@H](O)Cc2ccc3ccccc3c2)ccc1OC	ZINC000819407120	GH	On-Demand	Anodyne	REN	26	41
COCCOc1cc(NC[C@@H](O)Cc2ccc3ccccc3c2)ccc1OC	ZINC000819407120	GH	On-Demand	Anodyne	DRTS_TRYCR	53	38
COCCOc1cc(NC[C@H](O)Cc2ccc3ccccc3c2)ccc1OC	ZINC000819407121	GH	On-Demand	Anodyne	CASR	41	37
COCCOc1cc(NC[C@H](O)Cc2ccc3ccccc3c2)ccc1OC	ZINC000819407121	GH	On-Demand	Anodyne	REN	26	41
COCCOc1cc(NC[C@H](O)Cc2ccc3ccccc3c2)ccc1OC	ZINC000819407121	GH	On-Demand	Anodyne	DRTS_TRYCR	53	38
CCCOc1cccc(NCCS(=O)(=O)CC)c1	ZINC000819407122	CE	On-Demand	Anodyne	MTNR1A	23	40
CCCOc1cccc(NCCS(=O)(=O)CC)c1	ZINC000819407122	CE	On-Demand	Anodyne	MTNR1B	20	40
COCCOc1cc(NCCC(=O)Nc2cc(F)cc(F)c2)ccc1OC	ZINC000819407134	GG	On-Demand	Anodyne	AURKA	28	40
COCCOc1cc(NCCC(=O)Nc2cc(F)cc(F)c2)ccc1OC	ZINC000819407134	GG	On-Demand	Anodyne	SCD1	31	43
COCCOc1cc(NCCC(=O)Nc2cc(F)cc(F)c2)ccc1OC	ZINC000819407134	GG	On-Demand	Anodyne	SCD	23	43
COCCOc1cc(NCCC(=O)Nc2cc(F)cc(F)c2)ccc1OC	ZINC000819407134	GG	On-Demand	Anodyne	ENPP1	75	36
COCCOc1cc(NCCC(=O)Nc2cc(F)cc(F)c2)ccc1OC	ZINC000819407134	GG	On-Demand	Anodyne	DRTS_TRYCR	54	40
Cc1ccccc1[C@@H](O)CNc1cccc(OCC(F)(F)F)c1	ZINC000819407141	EI	On-Demand	Anodyne	PDS	49	37
COCCOc1cc(NC[C@H](O)c2ccccc2C(F)(F)F)ccc1OC	ZINC000819407156	GH	On-Demand	Anodyne	DRTS_TRYCR	49	36
COCCOc1cc(NC[C@@H](O)c2ccccc2C(F)(F)F)ccc1OC	ZINC000819407157	GH	On-Demand	Anodyne	DRTS_TRYCR	49	36
Cn1ccnc1[C@@H](O)C1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819407160	GD	On-Demand	Anodyne	KCNJ1	45	38
Cn1ccnc1[C@H](O)C1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819407161	GD	On-Demand	Anodyne	KCNJ1	45	38
COc1cc(NCCS(C)(=O)=O)ccc1NC(=O)c1cccnc1	ZINC000819407167	ED	On-Demand	Anodyne	CPT1A	43	33
COc1cc(NCCS(C)(=O)=O)ccc1NC(=O)c1cccnc1	ZINC000819407167	ED	On-Demand	Anodyne	GRM4	19	41
COc1cc(NCCS(C)(=O)=O)ccc1NC(=O)c1cccnc1	ZINC000819407167	ED	On-Demand	Anodyne	HDAC1	17	42
COc1cc(NCCS(C)(=O)=O)ccc1NC(=O)c1cccnc1	ZINC000819407167	ED	On-Demand	Anodyne	DRTS_TRYCR	44	31
COCCOc1cc(NC[C@H](O)c2cccc3ccccc23)ccc1OC	ZINC000819407168	FI	On-Demand	Anodyne	DRTS_TRYCR	55	40
COCCOc1cc(NC[C@H](O)c2ccccc2)ccc1OC	ZINC000819407169	DF	On-Demand	Anodyne	ADRB2	19	42
COCCOc1cc(NC[C@H](O)c2ccccc2)ccc1OC	ZINC000819407169	DF	On-Demand	Anodyne	ADRB1	16	40
COCCOc1cc(NC[C@H](O)c2ccccc2)ccc1OC	ZINC000819407169	DF	On-Demand	Anodyne	ADRB3	30	40
COCCOc1cc(NC[C@H](O)c2ccccc2)ccc1OC	ZINC000819407169	DF	On-Demand	Anodyne	ENPP1	57	33
COCCOc1cc(NC[C@H](O)c2ccccc2)ccc1OC	ZINC000819407169	DF	On-Demand	Anodyne	DRTS_TRYCR	55	42
COCCOc1cc(NC[C@@H](O)c2ccccc2)ccc1OC	ZINC000819407170	DF	On-Demand	Anodyne	ADRB2	19	42
COCCOc1cc(NC[C@@H](O)c2ccccc2)ccc1OC	ZINC000819407170	DF	On-Demand	Anodyne	ADRB1	16	40
COCCOc1cc(NC[C@@H](O)c2ccccc2)ccc1OC	ZINC000819407170	DF	On-Demand	Anodyne	ADRB3	30	40
COCCOc1cc(NC[C@@H](O)c2ccccc2)ccc1OC	ZINC000819407170	DF	On-Demand	Anodyne	ENPP1	57	33
COCCOc1cc(NC[C@@H](O)c2ccccc2)ccc1OC	ZINC000819407170	DF	On-Demand	Anodyne	DRTS_TRYCR	55	42
COCCOc1cc(NC[C@@](C)(O)C(F)(F)F)ccc1OC	ZINC000819407183	DE	On-Demand	Anodyne	ENPP1	45	31
COCCOc1cc(NC[C@@](C)(O)C(F)(F)F)ccc1OC	ZINC000819407183	DE	On-Demand	Anodyne	DRTS_TRYCR	54	39
COCCOc1cc(NC[C@](C)(O)C(F)(F)F)ccc1OC	ZINC000819407184	DE	On-Demand	Anodyne	ENPP1	45	31
COCCOc1cc(NC[C@](C)(O)C(F)(F)F)ccc1OC	ZINC000819407184	DE	On-Demand	Anodyne	DRTS_TRYCR	54	39
COCCOc1cc(NC[C@H](O)CN2CCc3ccccc3C2)ccc1OC	ZINC000819407187	GF	On-Demand	Anodyne	NOD1	17	42
COCCOc1cc(NC[C@H](O)CN2CCc3ccccc3C2)ccc1OC	ZINC000819407187	GF	On-Demand	Anodyne	NOD2	47	42
COCCOc1cc(NC[C@@H](O)CN2CCc3ccccc3C2)ccc1OC	ZINC000819407188	GF	On-Demand	Anodyne	NOD1	17	42
COCCOc1cc(NC[C@@H](O)CN2CCc3ccccc3C2)ccc1OC	ZINC000819407188	GF	On-Demand	Anodyne	NOD2	47	42
COCCOc1cc(NC[C@H](O)CN2CCN(C)CC2)ccc1OC	ZINC000819407196	FC	On-Demand	Anodyne	SLC9A1	56	31
COCCOc1cc(NC[C@H](O)CN2CCN(C)CC2)ccc1OC	ZINC000819407196	FC	On-Demand	Anodyne	DRTS_TRYCR	49	36
COCCOc1cc(NC[C@@H](O)CN2CCN(C)CC2)ccc1OC	ZINC000819407197	FC	On-Demand	Anodyne	SLC9A1	56	31
COCCOc1cc(NC[C@@H](O)CN2CCN(C)CC2)ccc1OC	ZINC000819407197	FC	On-Demand	Anodyne	DRTS_TRYCR	49	36
COCCOc1cc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)ccc1OC	ZINC000819407222	FF	On-Demand	Bother	ENPP1	45	31
COCCOc1cc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)ccc1OC	ZINC000819407222	FF	On-Demand	Bother	DRTS_TRYCR	41	38
COCCOc1cc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)ccc1OC	ZINC000819407223	FF	On-Demand	Bother	ENPP1	45	31
COCCOc1cc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)ccc1OC	ZINC000819407223	FF	On-Demand	Bother	DRTS_TRYCR	41	38
COCCOc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819407233	FH	On-Demand	Anodyne	ADRB2	17	46
COCCOc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819407233	FH	On-Demand	Anodyne	ADRB1	34	47
COCCOc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819407233	FH	On-Demand	Anodyne	ADRB3	52	47
COCCOc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819407233	FH	On-Demand	Anodyne	CPT1A	43	29
COCCOc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819407233	FH	On-Demand	Anodyne	CYP3A4	41	37
COCCOc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819407233	FH	On-Demand	Anodyne	SCD1	30	42
COCCOc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819407233	FH	On-Demand	Anodyne	SCD	22	42
COCCOc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819407233	FH	On-Demand	Anodyne	DRTS_TRYCR	50	37
COCCOc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819407234	FH	On-Demand	Anodyne	ADRB2	17	46
COCCOc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819407234	FH	On-Demand	Anodyne	ADRB1	34	47
COCCOc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819407234	FH	On-Demand	Anodyne	ADRB3	52	47
COCCOc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819407234	FH	On-Demand	Anodyne	CPT1A	43	29
COCCOc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819407234	FH	On-Demand	Anodyne	CYP3A4	41	37
COCCOc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819407234	FH	On-Demand	Anodyne	SCD1	30	42
COCCOc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819407234	FH	On-Demand	Anodyne	SCD	22	42
COCCOc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1OC	ZINC000819407234	FH	On-Demand	Anodyne	DRTS_TRYCR	50	37
C#Cc1cccc(NC(=O)C2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000819407235	HI	On-Demand	Mild	NPY2R	28	45
C#Cc1cccc(NC(=O)C2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000819407235	HI	On-Demand	Mild	EPHX2	49	48
C#Cc1cccc(NC(=O)C2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000819407235	HI	On-Demand	Mild	RBP4	24	42
C#Cc1cccc(NC(=O)C2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000819407235	HI	On-Demand	Mild	SFRP1	36	43
C#Cc1cccc(NC(=O)C2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000819407235	HI	On-Demand	Mild	TRPM8	30	41
C#Cc1cccc(NC(=O)C2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000819407235	HI	On-Demand	Mild	L3MBTL3	77	36
C#Cc1cccc(NC(=O)C2CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)c1	ZINC000819407235	HI	On-Demand	Mild	KCNK3	23	40
O[C@@H](CNc1cccc(OCC(F)(F)F)c1)c1cccnc1	ZINC000819407236	DG	On-Demand	Anodyne	ADRB2	17	41
O[C@@H](CNc1cccc(OCC(F)(F)F)c1)c1cccnc1	ZINC000819407236	DG	On-Demand	Anodyne	ADRB1	22	44
O[C@@H](CNc1cccc(OCC(F)(F)F)c1)c1cccnc1	ZINC000819407236	DG	On-Demand	Anodyne	ADRB3	73	44
O[C@H](CNc1cccc(OCC(F)(F)F)c1)c1cccnc1	ZINC000819407237	DG	On-Demand	Anodyne	ADRB2	17	41
O[C@H](CNc1cccc(OCC(F)(F)F)c1)c1cccnc1	ZINC000819407237	DG	On-Demand	Anodyne	ADRB1	22	44
O[C@H](CNc1cccc(OCC(F)(F)F)c1)c1cccnc1	ZINC000819407237	DG	On-Demand	Anodyne	ADRB3	73	44
COCCOc1cc(NCCC(=O)Nc2ccccc2)ccc1OC	ZINC000819407247	EG	On-Demand	Anodyne	TSHR	46	30
COCCOc1cc(NCCC(=O)Nc2ccccc2)ccc1OC	ZINC000819407247	EG	On-Demand	Anodyne	CPT1A	49	34
COCCOc1cc(NCCC(=O)Nc2ccccc2)ccc1OC	ZINC000819407247	EG	On-Demand	Anodyne	GRM4	16	40
COCCOc1cc(NCCC(=O)Nc2ccccc2)ccc1OC	ZINC000819407247	EG	On-Demand	Anodyne	MTNR1B	21	46
COCCOc1cc(NCCC(=O)Nc2ccccc2)ccc1OC	ZINC000819407247	EG	On-Demand	Anodyne	HDAC2	16	44
COCCOc1cc(NCCC(=O)Nc2ccccc2)ccc1OC	ZINC000819407247	EG	On-Demand	Anodyne	ENPP1	76	37
COCCOc1cc(NCCC(=O)Nc2ccccc2)ccc1OC	ZINC000819407247	EG	On-Demand	Anodyne	DRTS_TRYCR	57	43
COCCOc1cc(NCCC(=O)Nc2ccccc2)ccc1OC	ZINC000819407247	EG	On-Demand	Anodyne	KCNK3	45	40
COCCOc1cc(NCCC(=O)Nc2ccccc2)ccc1OC	ZINC000819407247	EG	On-Demand	Anodyne	KCNK9	43	40
COc1cc(NC[C@H](O)C2CC2)ccc1NC(=O)c1cccnc1	ZINC000819407253	EF	On-Demand	Anodyne	GRM4	19	44
COc1cc(NC[C@H](O)C2CC2)ccc1NC(=O)c1cccnc1	ZINC000819407253	EF	On-Demand	Anodyne	ENPP1	42	35
COc1cc(NC[C@@H](O)C2CC2)ccc1NC(=O)c1cccnc1	ZINC000819407254	EF	On-Demand	Anodyne	GRM4	19	44
COc1cc(NC[C@@H](O)C2CC2)ccc1NC(=O)c1cccnc1	ZINC000819407254	EF	On-Demand	Anodyne	ENPP1	42	35
CCCOc1ccc2c(c1)CCN(C(=O)/C=C/[C@H]1CCCO1)C2	ZINC000819407257	DG	On-Demand	Anodyne	HRH3	17	41
CCCOc1ccc2c(c1)CCN(C(=O)/C=C/[C@@H]1CCCO1)C2	ZINC000819407258	DG	On-Demand	Anodyne	HRH3	17	41
CCCOc1ccc2c(c1)CCN(C(=O)/C=C\[C@@H]1CCCO1)C2	ZINC000819407259	DG	On-Demand	Anodyne	HRH3	17	41
CCCOc1ccc2c(c1)CCN(C(=O)/C=C\[C@H]1CCCO1)C2	ZINC000819407260	DG	On-Demand	Anodyne	HRH3	17	41
CCCOc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819407265	CG	On-Demand	Anodyne	ADRB2	29	47
CCCOc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819407265	CG	On-Demand	Anodyne	ADRB1	32	47
CCCOc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819407265	CG	On-Demand	Anodyne	ADRB3	89	48
CCCOc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819407266	CG	On-Demand	Anodyne	ADRB2	29	47
CCCOc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819407266	CG	On-Demand	Anodyne	ADRB1	32	47
CCCOc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819407266	CG	On-Demand	Anodyne	ADRB3	89	48
CCCOc1cccc(NC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819407268	DH	On-Demand	Anodyne	PDS	41	36
CCCOc1cccc(NC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819407269	DH	On-Demand	Anodyne	PDS	41	36
COCCOc1cc(NC[C@H](O)c2cccc(F)c2)ccc1OC	ZINC000819407270	EG	On-Demand	Anodyne	DRTS_TRYCR	50	37
COCCOc1cc(NC[C@@H](O)c2cccc(F)c2)ccc1OC	ZINC000819407271	EG	On-Demand	Anodyne	DRTS_TRYCR	50	37
COCCOc1cc(NC[C@@H](O)CSC)ccc1OC	ZINC000819407272	DD	On-Demand	Anodyne	ENPP1	67	32
COCCOc1cc(NC[C@@H](O)CSC)ccc1OC	ZINC000819407272	DD	On-Demand	Anodyne	DRTS_TRYCR	50	36
COCCOc1cc(NC[C@H](O)CSC)ccc1OC	ZINC000819407273	DD	On-Demand	Anodyne	ENPP1	67	32
COCCOc1cc(NC[C@H](O)CSC)ccc1OC	ZINC000819407273	DD	On-Demand	Anodyne	DRTS_TRYCR	50	36
C#Cc1cccc(NC(=O)c2ccc(C)c(-n3cccc3)c2)c1	ZINC000819407275	DI	On-Demand	Mild	ABL1	36	40
C#Cc1cccc(NC(=O)c2ccc(C)c(-n3cccc3)c2)c1	ZINC000819407275	DI	On-Demand	Mild	KIT	17	41
C#Cc1cccc(NC(=O)c2ccc(C)c(-n3cccc3)c2)c1	ZINC000819407275	DI	On-Demand	Mild	LCK	24	40
C#Cc1cccc(NC(=O)c2ccc(C)c(-n3cccc3)c2)c1	ZINC000819407275	DI	On-Demand	Mild	TAAR1	54	44
C#Cc1cccc(NC(=O)c2ccc(C)c(-n3cccc3)c2)c1	ZINC000819407275	DI	On-Demand	Mild	DDR1	46	39
C#Cc1cccc(NC(=O)c2ccc(C)c(-n3cccc3)c2)c1	ZINC000819407275	DI	On-Demand	Mild	KCNK3	110	43
C#Cc1cccc(NC(=O)c2ccc(C)c(-n3cccc3)c2)c1	ZINC000819407275	DI	On-Demand	Mild	KCNK9	61	43
COCCOc1cc(NC[C@H](O)c2ccc(C#N)cc2)ccc1OC	ZINC000819407282	EF	On-Demand	Mild	DRTS_TRYCR	40	37
COCCOc1cc(NC[C@@H](O)c2ccc(C#N)cc2)ccc1OC	ZINC000819407283	EF	On-Demand	Mild	DRTS_TRYCR	40	37
OC1CCN(c2ccc(NC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819407288	DE	On-Demand	Anodyne	ADRB2	23	40
OC1CCN(c2ccc(NC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819407288	DE	On-Demand	Anodyne	ADRB3	87	51
OC1CCN(c2ccc(NC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819407289	DE	On-Demand	Anodyne	ADRB2	23	40
OC1CCN(c2ccc(NC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819407289	DE	On-Demand	Anodyne	ADRB3	87	51
COCCOc1cc(NCCS(=O)(=O)c2ccc(F)cc2)ccc1OC	ZINC000819407297	GF	On-Demand	Anodyne	ENPP1	45	31
COCCOc1cc(NCCS(=O)(=O)c2ccc(F)cc2)ccc1OC	ZINC000819407297	GF	On-Demand	Anodyne	DRTS_TRYCR	50	36
COCCOc1cc(NC[C@H](O)c2cc(F)ccc2F)ccc1OC	ZINC000819407309	FG	On-Demand	Anodyne	DRTS_TRYCR	53	39
COCCOc1cc(NC[C@@H](O)c2cc(F)ccc2F)ccc1OC	ZINC000819407310	FG	On-Demand	Anodyne	DRTS_TRYCR	53	39
COCCOc1cc(NC[C@H](O)c2ccc(C)cc2)ccc1OC	ZINC000819407338	EG	On-Demand	Anodyne	ENPP1	55	31
COCCOc1cc(NC[C@H](O)c2ccc(C)cc2)ccc1OC	ZINC000819407338	EG	On-Demand	Anodyne	DRTS_TRYCR	52	39
COCCOc1cc(NC[C@@H](O)c2ccc(C)cc2)ccc1OC	ZINC000819407339	EG	On-Demand	Anodyne	ENPP1	55	31
COCCOc1cc(NC[C@@H](O)c2ccc(C)cc2)ccc1OC	ZINC000819407339	EG	On-Demand	Anodyne	DRTS_TRYCR	52	39
COCCOc1cc(NC[C@H](O)c2ccc(F)cc2Cl)ccc1OC	ZINC000819407343	FH	On-Demand	Anodyne	DRTS_TRYCR	49	36
COCCOc1cc(NC[C@@H](O)c2ccc(F)cc2Cl)ccc1OC	ZINC000819407344	FH	On-Demand	Anodyne	DRTS_TRYCR	49	36
COCCOc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1OC	ZINC000819407345	FG	On-Demand	Anodyne	PDGFRB	27	42
COCCOc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1OC	ZINC000819407345	FG	On-Demand	Anodyne	AURKB	34	42
COCCOc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1OC	ZINC000819407345	FG	On-Demand	Anodyne	KDR	17	41
COCCOc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1OC	ZINC000819407345	FG	On-Demand	Anodyne	FLT4	20	42
COCCOc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1OC	ZINC000819407345	FG	On-Demand	Anodyne	PDGFRA	21	41
COCCOc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1OC	ZINC000819407345	FG	On-Demand	Anodyne	AURKA	32	50
COCCOc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1OC	ZINC000819407345	FG	On-Demand	Anodyne	ENPP1	76	37
COCCOc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1OC	ZINC000819407345	FG	On-Demand	Anodyne	DRTS_TRYCR	51	38
COCCOc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1OC	ZINC000819407345	FG	On-Demand	Anodyne	KCNK3	45	40
COCCOc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1OC	ZINC000819407345	FG	On-Demand	Anodyne	KCNK9	44	40
COCCOc1cc(NC[C@H](O)c2c(F)cccc2F)ccc1OC	ZINC000819407346	FG	On-Demand	Anodyne	DRTS_TRYCR	52	38
COCCOc1cc(NC[C@@H](O)c2c(F)cccc2F)ccc1OC	ZINC000819407347	FG	On-Demand	Anodyne	DRTS_TRYCR	52	38
O=C(NCC1(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819407348	CH	On-Demand	Anodyne	NPFFR2	17	44
O=C(NCC1(Cc2ccccc2)CC1)C(F)=C1CCC1	ZINC000819407348	CH	On-Demand	Anodyne	NPFFR1	22	44
COCCOc1cc(NC[C@H](O)c2ccccc2C)ccc1OC	ZINC000819407360	EG	On-Demand	Anodyne	DRTS_TRYCR	50	36
COCCOc1cc(NC[C@@H](O)c2ccccc2C)ccc1OC	ZINC000819407361	EG	On-Demand	Anodyne	DRTS_TRYCR	50	36
COCCOc1cc(NC[C@@H](O)c2cc(C)cc(C)c2)ccc1OC	ZINC000819407372	EG	On-Demand	Anodyne	ENPP1	55	31
COCCOc1cc(NC[C@@H](O)c2cc(C)cc(C)c2)ccc1OC	ZINC000819407372	EG	On-Demand	Anodyne	DRTS_TRYCR	51	37
COCCOc1cc(NC[C@H](O)c2cc(C)cc(C)c2)ccc1OC	ZINC000819407373	EG	On-Demand	Anodyne	ENPP1	55	31
COCCOc1cc(NC[C@H](O)c2cc(C)cc(C)c2)ccc1OC	ZINC000819407373	EG	On-Demand	Anodyne	DRTS_TRYCR	51	37
COCCOc1cc(NCC2(O)CCOCC2)ccc1OC	ZINC000819407376	DD	On-Demand	Anodyne	ENPP1	45	31
COCCOc1cc(NCC2(O)CCOCC2)ccc1OC	ZINC000819407376	DD	On-Demand	Anodyne	DRTS_TRYCR	48	35
COCCOc1cc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1OC	ZINC000819407378	GE	On-Demand	Anodyne	ADRB3	22	42
COCCOc1cc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1OC	ZINC000819407378	GE	On-Demand	Anodyne	ENPP1	45	31
COCCOc1cc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1OC	ZINC000819407378	GE	On-Demand	Anodyne	DRTS_TRYCR	42	38
COCCOc1cc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1OC	ZINC000819407379	GE	On-Demand	Anodyne	ADRB3	22	42
COCCOc1cc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1OC	ZINC000819407379	GE	On-Demand	Anodyne	ENPP1	45	31
COCCOc1cc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1OC	ZINC000819407379	GE	On-Demand	Anodyne	DRTS_TRYCR	42	38
COCCOc1cc(NCCC(=O)Nc2cccnc2)ccc1OC	ZINC000819407381	EF	On-Demand	Anodyne	CSF1R	23	40
COCCOc1cc(NCCC(=O)Nc2cccnc2)ccc1OC	ZINC000819407381	EF	On-Demand	Anodyne	AURKA	27	40
COCCOc1cc(NCCC(=O)Nc2cccnc2)ccc1OC	ZINC000819407381	EF	On-Demand	Anodyne	QPCT	15	40
COCCOc1cc(NCCC(=O)Nc2cccnc2)ccc1OC	ZINC000819407381	EF	On-Demand	Anodyne	ENPP1	79	40
COCCOc1cc(NCCC(=O)Nc2cccnc2)ccc1OC	ZINC000819407381	EF	On-Demand	Anodyne	DRTS_TRYCR	53	39
O[C@@H](CNc1cccc(OCC(F)(F)F)c1)c1ccccc1	ZINC000819407382	DH	On-Demand	Anodyne	PDS	55	39
O[C@H](CNc1cccc(OCC(F)(F)F)c1)c1ccccc1	ZINC000819407383	DH	On-Demand	Anodyne	PDS	55	39
COCCOc1cc(NC[C@H](O)c2ccccc2Cl)ccc1OC	ZINC000819407385	FH	On-Demand	Anodyne	DRTS_TRYCR	40	36
COC(=O)C[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819407386	FE	On-Demand	Mild	CELA1	40	39
COC(=O)C[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819407386	FE	On-Demand	Mild	PAPA1_CARPA	31	41
COC(=O)C[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819407387	FE	On-Demand	Mild	CELA1	40	39
COC(=O)C[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819407387	FE	On-Demand	Mild	PAPA1_CARPA	31	41
COC(=O)C[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819407388	FE	On-Demand	Mild	CELA1	40	39
COC(=O)C[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819407388	FE	On-Demand	Mild	PAPA1_CARPA	31	41
COC(=O)C[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819407389	FE	On-Demand	Mild	CELA1	40	39
COC(=O)C[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819407389	FE	On-Demand	Mild	PAPA1_CARPA	31	41
COCCOc1cc(NCCC(=O)NC(N)=O)ccc1OC	ZINC000819407396	DC	On-Demand	Anodyne	ENPP1	75	38
COCCOc1cc(NCCC(=O)NC(N)=O)ccc1OC	ZINC000819407396	DC	On-Demand	Anodyne	DRTS_TRYCR	60	44
CC(C)(C)OC(=O)N1CC[C@H](N(C(=O)c2coc(=O)c3ccccc23)C2CC2)C1	ZINC000819407397	GG	On-Demand	Anodyne	CCR8	49	35
CC(C)(C)OC(=O)N1CC[C@@H](N(C(=O)c2coc(=O)c3ccccc23)C2CC2)C1	ZINC000819407398	GG	On-Demand	Anodyne	CCR8	49	35
COCCOc1cc(NC[C@@H](O)COC)ccc1OC	ZINC000819407410	CD	On-Demand	Anodyne	ENPP1	61	32
COCCOc1cc(NC[C@@H](O)COC)ccc1OC	ZINC000819407410	CD	On-Demand	Anodyne	DRTS_TRYCR	52	38
COCCOc1cc(NC[C@H](O)COC)ccc1OC	ZINC000819407411	CD	On-Demand	Anodyne	ENPP1	61	32
COCCOc1cc(NC[C@H](O)COC)ccc1OC	ZINC000819407411	CD	On-Demand	Anodyne	DRTS_TRYCR	52	38
COCCOc1cc(NC[C@@H](O)Cc2ccc(F)cc2)ccc1OC	ZINC000819407414	EF	On-Demand	Anodyne	DRTS_TRYCR	55	39
COCCOc1cc(NC[C@H](O)Cc2ccc(F)cc2)ccc1OC	ZINC000819407415	EF	On-Demand	Anodyne	DRTS_TRYCR	55	39
COCCOc1cc(NC[C@@H](O)[C@H](C)c2ccccc2)ccc1OC	ZINC000819407418	EG	On-Demand	Anodyne	ENPP1	63	34
COCCOc1cc(NC[C@@H](O)[C@H](C)c2ccccc2)ccc1OC	ZINC000819407418	EG	On-Demand	Anodyne	DRTS_TRYCR	50	36
COCCOc1cc(NC[C@@H](O)[C@@H](C)c2ccccc2)ccc1OC	ZINC000819407419	EG	On-Demand	Anodyne	ENPP1	63	34
COCCOc1cc(NC[C@@H](O)[C@@H](C)c2ccccc2)ccc1OC	ZINC000819407419	EG	On-Demand	Anodyne	DRTS_TRYCR	50	36
COCCOc1cc(NC[C@H](O)[C@H](C)c2ccccc2)ccc1OC	ZINC000819407420	EG	On-Demand	Anodyne	ENPP1	63	34
COCCOc1cc(NC[C@H](O)[C@H](C)c2ccccc2)ccc1OC	ZINC000819407420	EG	On-Demand	Anodyne	DRTS_TRYCR	50	36
COCCOc1cc(NC[C@H](O)[C@@H](C)c2ccccc2)ccc1OC	ZINC000819407421	EG	On-Demand	Anodyne	ENPP1	63	34
COCCOc1cc(NC[C@H](O)[C@@H](C)c2ccccc2)ccc1OC	ZINC000819407421	EG	On-Demand	Anodyne	DRTS_TRYCR	50	36
CNC(=O)[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819407425	FD	On-Demand	Mild	PAPA1_CARPA	49	51
CNC(=O)[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819407425	FD	On-Demand	Mild	CTSK	17	48
CNC(=O)[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819407425	FD	On-Demand	Mild	PGA5	26	46
CNC(=O)[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819407425	FD	On-Demand	Mild	POLG_HCV1	23	41
CNC(=O)[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819407427	FD	On-Demand	Mild	PAPA1_CARPA	49	51
CNC(=O)[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819407427	FD	On-Demand	Mild	CTSK	17	48
CNC(=O)[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819407427	FD	On-Demand	Mild	PGA5	26	46
CNC(=O)[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)C	ZINC000819407427	FD	On-Demand	Mild	POLG_HCV1	23	41
COCCOc1cc(NCCS(C)(=O)=O)ccc1OC	ZINC000819407440	DD	On-Demand	Anodyne	ENPP1	55	31
COCCOc1cc(NCCS(C)(=O)=O)ccc1OC	ZINC000819407440	DD	On-Demand	Anodyne	DRTS_TRYCR	58	42
CCCOc1cccc(NC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819407445	EH	On-Demand	Anodyne	MTNR1A	24	40
CCCOc1cccc(NC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819407445	EH	On-Demand	Anodyne	MTNR1B	27	40
CCCOc1cccc(NC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819407446	EH	On-Demand	Anodyne	MTNR1A	24	40
CCCOc1cccc(NC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819407446	EH	On-Demand	Anodyne	MTNR1B	27	40
COCCOc1cc(NCCS(=O)(=O)c2ccc(C#N)cn2)ccc1OC	ZINC000819407449	GD	On-Demand	Mild	DRTS_TRYCR	47	34
CC[C@H](O)CNc1ccc(OC)c(OCCOC)c1	ZINC000819407451	CD	On-Demand	Anodyne	ENPP1	50	31
CC[C@H](O)CNc1ccc(OC)c(OCCOC)c1	ZINC000819407451	CD	On-Demand	Anodyne	DRTS_TRYCR	55	39
CCCOc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819407452	CH	On-Demand	Anodyne	ADRB2	30	42
CCCOc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819407452	CH	On-Demand	Anodyne	ADRB1	32	47
CCCOc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819407452	CH	On-Demand	Anodyne	ADRB3	41	47
CCCOc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819407452	CH	On-Demand	Anodyne	FAAH	17	44
CCCOc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819407452	CH	On-Demand	Anodyne	AOC3	15	41
CCCOc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819407452	CH	On-Demand	Anodyne	PDS	64	36
CCCOc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819407453	CH	On-Demand	Anodyne	ADRB2	30	42
CCCOc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819407453	CH	On-Demand	Anodyne	ADRB1	32	47
CCCOc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819407453	CH	On-Demand	Anodyne	ADRB3	41	47
CCCOc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819407453	CH	On-Demand	Anodyne	FAAH	17	44
CCCOc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819407453	CH	On-Demand	Anodyne	AOC3	15	41
CCCOc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819407453	CH	On-Demand	Anodyne	PDS	64	36
C=CCCn1cc(C(=O)N(C2CC2)[C@H]2CCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819407454	GE	On-Demand	Mild	GPR119	20	41
C=CCCn1cc(C(=O)N(C2CC2)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819407455	GE	On-Demand	Mild	GPR119	20	41
COCCOc1cc(NC[C@H](O)c2ccc(Cl)cc2Cl)ccc1OC	ZINC000819407459	GI	On-Demand	Anodyne	CPT1A	41	32
COCCOc1cc(NC[C@H](O)c2ccc(Cl)cc2Cl)ccc1OC	ZINC000819407459	GI	On-Demand	Anodyne	DRTS_TRYCR	50	37
COCCOc1cc(NC[C@@H](O)c2ccc(Cl)cc2Cl)ccc1OC	ZINC000819407460	GI	On-Demand	Anodyne	CPT1A	41	32
COCCOc1cc(NC[C@@H](O)c2ccc(Cl)cc2Cl)ccc1OC	ZINC000819407460	GI	On-Demand	Anodyne	DRTS_TRYCR	50	37
OC1CCN(c2ccc(NC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819407467	DF	On-Demand	Anodyne	STAT6	15	40
C#CCNC(=O)CCNc1ccc(OC)c(OCCOC)c1	ZINC000819407471	DD	On-Demand	Mild	ENPP1	62	32
C#CCNC(=O)CCNc1ccc(OC)c(OCCOC)c1	ZINC000819407471	DD	On-Demand	Mild	DRTS_TRYCR	54	40
CS(=O)(=O)c1ccc([C@@H](O)CNc2cccc(OCC(F)(F)F)c2)cc1	ZINC000819407481	GG	On-Demand	Anodyne	PTGS2	18	40
CS(=O)(=O)c1ccc([C@@H](O)CNc2cccc(OCC(F)(F)F)c2)cc1	ZINC000819407481	GG	On-Demand	Anodyne	ADRB3	26	42
CS(=O)(=O)c1ccc([C@H](O)CNc2cccc(OCC(F)(F)F)c2)cc1	ZINC000819407482	GG	On-Demand	Anodyne	PTGS2	18	40
CS(=O)(=O)c1ccc([C@H](O)CNc2cccc(OCC(F)(F)F)c2)cc1	ZINC000819407482	GG	On-Demand	Anodyne	ADRB3	26	42
CC[C@H](O)CNc1ccc(OC)c(NC(=O)OC(C)(C)C)c1	ZINC000819407557	DG	On-Demand	Anodyne	DRTS_TRYCR	43	30
COCCOc1cc(NCC2(O)CCC2)ccc1OC	ZINC000819407567	CE	On-Demand	Anodyne	ENPP1	72	36
COCCOc1cc(NCC2(O)CCC2)ccc1OC	ZINC000819407567	CE	On-Demand	Anodyne	DRTS_TRYCR	50	36
COCCOc1cc(NCCC(N)=O)ccc1OC	ZINC000819407568	CD	On-Demand	Anodyne	REN	27	42
COCCOc1cc(NCCC(N)=O)ccc1OC	ZINC000819407568	CD	On-Demand	Anodyne	ENPP1	72	37
COCCOc1cc(NCCC(N)=O)ccc1OC	ZINC000819407568	CD	On-Demand	Anodyne	DRTS_TRYCR	64	48
COCCOc1cc(NC[C@@H](O)Cn2cnc3cc(C)c(C)cc32)ccc1OC	ZINC000819407573	GG	On-Demand	Anodyne	ENPP1	57	32
COCCOc1cc(NC[C@@H](O)Cn2cnc3cc(C)c(C)cc32)ccc1OC	ZINC000819407573	GG	On-Demand	Anodyne	DRTS_TRYCR	49	34
COCCOc1cc(NC[C@H](O)Cn2cnc3cc(C)c(C)cc32)ccc1OC	ZINC000819407574	GG	On-Demand	Anodyne	ENPP1	57	32
COCCOc1cc(NC[C@H](O)Cn2cnc3cc(C)c(C)cc32)ccc1OC	ZINC000819407574	GG	On-Demand	Anodyne	DRTS_TRYCR	49	34
COCCOc1cc(NC[C@H](O)C2CCCCC2)ccc1OC	ZINC000819407577	DG	On-Demand	Anodyne	REN	28	43
COCCOc1cc(NC[C@H](O)C2CCCCC2)ccc1OC	ZINC000819407577	DG	On-Demand	Anodyne	ENPP1	62	32
COCCOc1cc(NC[C@H](O)C2CCCCC2)ccc1OC	ZINC000819407577	DG	On-Demand	Anodyne	DRTS_TRYCR	47	34
COCCOc1cc(NC[C@@H](O)C2CCCCC2)ccc1OC	ZINC000819407578	DG	On-Demand	Anodyne	REN	28	43
COCCOc1cc(NC[C@@H](O)C2CCCCC2)ccc1OC	ZINC000819407578	DG	On-Demand	Anodyne	ENPP1	62	32
COCCOc1cc(NC[C@@H](O)C2CCCCC2)ccc1OC	ZINC000819407578	DG	On-Demand	Anodyne	DRTS_TRYCR	47	34
COCCOc1cc(NC[C@@H](O)c2cc3ccccc3o2)ccc1OC	ZINC000819407585	FH	On-Demand	Anodyne	DRTS_TRYCR	49	36
COCCOc1cc(NC[C@@H](O)C(F)(F)F)ccc1OC	ZINC000819407589	DE	On-Demand	Anodyne	ENPP1	44	30
COCCOc1cc(NC[C@@H](O)C(F)(F)F)ccc1OC	ZINC000819407589	DE	On-Demand	Anodyne	DRTS_TRYCR	53	38
COCCOc1cc(NC[C@H](O)C(F)(F)F)ccc1OC	ZINC000819407590	DE	On-Demand	Anodyne	ENPP1	44	30
COCCOc1cc(NC[C@H](O)C(F)(F)F)ccc1OC	ZINC000819407590	DE	On-Demand	Anodyne	DRTS_TRYCR	53	38
COCCOc1cc(NCC2(O)CCCC2)ccc1OC	ZINC000819407601	CE	On-Demand	Anodyne	ENPP1	71	34
COCCOc1cc(NCC2(O)CCCC2)ccc1OC	ZINC000819407601	CE	On-Demand	Anodyne	DRTS_TRYCR	50	36
COCCOc1cc(NCCC(=O)N(C)OC)ccc1OC	ZINC000819407606	DD	On-Demand	Anodyne	ENPP1	60	31
COCCOc1cc(NCCC(=O)N(C)OC)ccc1OC	ZINC000819407606	DD	On-Demand	Anodyne	DRTS_TRYCR	56	41
COCCOc1cc(NC[C@H](O)c2ccc(Cl)cc2)ccc1OC	ZINC000819407607	FH	On-Demand	Anodyne	ENPP1	51	35
COCCOc1cc(NC[C@H](O)c2ccc(Cl)cc2)ccc1OC	ZINC000819407607	FH	On-Demand	Anodyne	DRTS_TRYCR	53	41
COCCOc1cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1OC	ZINC000819407615	FF	On-Demand	Bother	CACNA1C	51	38
COCCOc1cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1OC	ZINC000819407615	FF	On-Demand	Bother	CACNA1D	80	38
COCCOc1cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1OC	ZINC000819407616	FF	On-Demand	Bother	CACNA1C	51	38
COCCOc1cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1OC	ZINC000819407616	FF	On-Demand	Bother	CACNA1D	80	38
CCCOc1cccc(NC[C@H](O)c2ccccc2F)c1	ZINC000819407621	CH	On-Demand	Anodyne	PDS	41	33
CCCOc1cccc(NC[C@@H](O)c2ccccc2F)c1	ZINC000819407622	CH	On-Demand	Anodyne	PDS	41	33
C#Cc1cccc(NC(=O)c2ccc(OCC(F)(F)F)nc2)c1	ZINC000819407628	DG	On-Demand	Mild	TAAR1	49	40
C#Cc1cccc(NC(=O)c2ccc(OCC(F)(F)F)nc2)c1	ZINC000819407628	DG	On-Demand	Mild	DDR1	41	38
C#Cc1cccc(NC(=O)c2ccc(OCC(F)(F)F)nc2)c1	ZINC000819407628	DG	On-Demand	Mild	KCNK3	96	39
C#Cc1cccc(NC(=O)c2ccc(OCC(F)(F)F)nc2)c1	ZINC000819407628	DG	On-Demand	Mild	KCNK9	70	37
COCCOc1cc(NC[C@@H](O)Cc2cccc(Cl)c2)ccc1OC	ZINC000819407629	FG	On-Demand	Anodyne	ADRB1	15	42
COCCOc1cc(NC[C@@H](O)Cc2cccc(Cl)c2)ccc1OC	ZINC000819407629	FG	On-Demand	Anodyne	SCD1	30	44
COCCOc1cc(NC[C@@H](O)Cc2cccc(Cl)c2)ccc1OC	ZINC000819407629	FG	On-Demand	Anodyne	SCD	22	44
COCCOc1cc(NC[C@@H](O)Cc2cccc(Cl)c2)ccc1OC	ZINC000819407629	FG	On-Demand	Anodyne	DRTS_TRYCR	50	36
COCCOc1cc(NC[C@H](O)Cc2cccc(Cl)c2)ccc1OC	ZINC000819407630	FG	On-Demand	Anodyne	ADRB1	15	42
COCCOc1cc(NC[C@H](O)Cc2cccc(Cl)c2)ccc1OC	ZINC000819407630	FG	On-Demand	Anodyne	SCD1	30	44
COCCOc1cc(NC[C@H](O)Cc2cccc(Cl)c2)ccc1OC	ZINC000819407630	FG	On-Demand	Anodyne	SCD	22	44
COCCOc1cc(NC[C@H](O)Cc2cccc(Cl)c2)ccc1OC	ZINC000819407630	FG	On-Demand	Anodyne	DRTS_TRYCR	50	36
COCCOc1cc(NC[C@@H](O)CC2CCCC2)ccc1OC	ZINC000819407637	DG	On-Demand	Anodyne	REN	27	40
COCCOc1cc(NC[C@H](O)CC2CCCC2)ccc1OC	ZINC000819407638	DG	On-Demand	Anodyne	REN	27	40
COCCOc1cc(NC[C@H](O)c2ccc(Br)cc2)ccc1OC	ZINC000819407641	GH	On-Demand	Anodyne	ENPP1	46	34
COCCOc1cc(NC[C@H](O)c2ccc(Br)cc2)ccc1OC	ZINC000819407641	GH	On-Demand	Anodyne	DRTS_TRYCR	50	39
COCCOc1cc(NC[C@@H](O)c2ccc(Br)cc2)ccc1OC	ZINC000819407642	GH	On-Demand	Anodyne	ENPP1	46	34
COCCOc1cc(NC[C@@H](O)c2ccc(Br)cc2)ccc1OC	ZINC000819407642	GH	On-Demand	Anodyne	DRTS_TRYCR	50	39
COCCOc1cc(NC[C@H](O)c2ccc(Cl)c(F)c2)ccc1OC	ZINC000819407643	FH	On-Demand	Anodyne	DRTS_TRYCR	49	36
COCCOc1cc(NC[C@@H](O)c2ccc(Cl)c(F)c2)ccc1OC	ZINC000819407644	FH	On-Demand	Anodyne	DRTS_TRYCR	49	36
COCCOc1cc(NC[C@H](O)Cn2cccn2)ccc1OC	ZINC000819407650	DD	On-Demand	Anodyne	ENPP1	62	33
COCCOc1cc(NC[C@H](O)Cn2cccn2)ccc1OC	ZINC000819407650	DD	On-Demand	Anodyne	DRTS_TRYCR	49	35
COCCOc1cc(NC[C@@H](O)Cn2cccn2)ccc1OC	ZINC000819407651	DD	On-Demand	Anodyne	ENPP1	62	33
COCCOc1cc(NC[C@@H](O)Cn2cccn2)ccc1OC	ZINC000819407651	DD	On-Demand	Anodyne	DRTS_TRYCR	49	35
COCCOc1cc(NC[C@H](O)c2ccc(F)cn2)ccc1OC	ZINC000819407658	EE	On-Demand	Anodyne	DRTS_TRYCR	52	38
COCCOc1cc(NC[C@@H](O)c2ccc(F)cn2)ccc1OC	ZINC000819407659	EE	On-Demand	Anodyne	DRTS_TRYCR	52	38
COCCOc1cc(NC[C@H](O)c2ccc(F)cc2C)ccc1OC	ZINC000819407670	EG	On-Demand	Anodyne	DRTS_TRYCR	50	36
COCCOc1cc(NC[C@@H](O)c2ccc(F)cc2C)ccc1OC	ZINC000819407671	EG	On-Demand	Anodyne	DRTS_TRYCR	50	36
COCCOc1cc(NC[C@H](O)c2cccc(C(F)(F)F)c2)ccc1OC	ZINC000819407673	GH	On-Demand	Anodyne	SCD1	23	42
COCCOc1cc(NC[C@H](O)c2cccc(C(F)(F)F)c2)ccc1OC	ZINC000819407673	GH	On-Demand	Anodyne	SCD	31	42
COCCOc1cc(NC[C@H](O)c2cccc(C(F)(F)F)c2)ccc1OC	ZINC000819407673	GH	On-Demand	Anodyne	DRTS_TRYCR	48	36
COCCOc1cc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)ccc1OC	ZINC000819407674	GH	On-Demand	Anodyne	SCD1	23	42
COCCOc1cc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)ccc1OC	ZINC000819407674	GH	On-Demand	Anodyne	SCD	31	42
COCCOc1cc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)ccc1OC	ZINC000819407674	GH	On-Demand	Anodyne	DRTS_TRYCR	48	36
COCCOc1cc(NCCC(=O)Nc2ccccc2F)ccc1OC	ZINC000819407675	FG	On-Demand	Anodyne	GRM4	20	42
COCCOc1cc(NCCC(=O)Nc2ccccc2F)ccc1OC	ZINC000819407675	FG	On-Demand	Anodyne	ENPP1	68	33
COCCOc1cc(NCCC(=O)Nc2ccccc2F)ccc1OC	ZINC000819407675	FG	On-Demand	Anodyne	DRTS_TRYCR	51	38
COCCOc1cc(NC[C@H](O)c2ccccc2F)ccc1OC	ZINC000819407680	EG	On-Demand	Anodyne	DRTS_TRYCR	51	38
COCCOc1cc(NC[C@@H](O)c2ccccc2F)ccc1OC	ZINC000819407681	EG	On-Demand	Anodyne	DRTS_TRYCR	51	38
CCCOc1cccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819407682	GH	On-Demand	Anodyne	EPHX2	24	49
CCCOc1cccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819407682	GH	On-Demand	Anodyne	GPR119	53	47
CCCOc1cccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819407683	GH	On-Demand	Anodyne	EPHX2	24	49
CCCOc1cccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819407683	GH	On-Demand	Anodyne	GPR119	53	47
CCCOc1ccc2c(c1)CCN(C(=O)C(F)=C1CCC1)C2	ZINC000819407692	DH	On-Demand	Anodyne	HRH3	16	43
COCCOc1cc(NCCC#N)ccc1OC	ZINC000819407707	CE	On-Demand	Mild	DRTS_TRYCR	53	38
COCCOc1cc(NC[C@H](O)c2ccc(F)c(F)c2)ccc1OC	ZINC000819407732	FG	On-Demand	Anodyne	ENPP1	44	30
COCCOc1cc(NC[C@H](O)c2ccc(F)c(F)c2)ccc1OC	ZINC000819407732	FG	On-Demand	Anodyne	DRTS_TRYCR	57	41
COCCOc1cc(NC[C@@H](O)c2ccc(F)c(F)c2)ccc1OC	ZINC000819407733	FG	On-Demand	Anodyne	ENPP1	44	30
COCCOc1cc(NC[C@@H](O)c2ccc(F)c(F)c2)ccc1OC	ZINC000819407733	FG	On-Demand	Anodyne	DRTS_TRYCR	57	41
O=C(CCNc1ccc(N2CCC(O)CC2)cc1)Nc1cc(F)cc(F)c1	ZINC000819407736	GG	On-Demand	Anodyne	STAT6	41	34
COCCOc1ccc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819407749	GE	On-Demand	Anodyne	ADRB1	54	43
COCCOc1ccc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819407750	GE	On-Demand	Anodyne	ADRB1	54	43
OC1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819407751	EE	On-Demand	Anodyne	ADRB2	50	45
OC1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819407751	EE	On-Demand	Anodyne	ADRB1	74	44
OC1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819407751	EE	On-Demand	Anodyne	ADRB3	55	50
OC1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819407751	EE	On-Demand	Anodyne	ABCB1	22	41
OC1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819407751	EE	On-Demand	Anodyne	STAT6	32	41
OC1CCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819407752	EE	On-Demand	Anodyne	ADRB2	50	45
OC1CCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819407752	EE	On-Demand	Anodyne	ADRB1	74	44
OC1CCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819407752	EE	On-Demand	Anodyne	ADRB3	55	50
OC1CCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819407752	EE	On-Demand	Anodyne	ABCB1	22	41
OC1CCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819407752	EE	On-Demand	Anodyne	STAT6	32	41
O=C(CCNc1ccc(N2CCC(O)CC2)cc1)Nc1cccnc1	ZINC000819407759	EE	On-Demand	Anodyne	CHRNA7	47	42
O=C(CCNc1ccc(N2CCC(O)CC2)cc1)Nc1cccnc1	ZINC000819407759	EE	On-Demand	Anodyne	PRNP	31	40
O=C(CCNc1ccc(N2CCC(O)CC2)cc1)Nc1cccnc1	ZINC000819407759	EE	On-Demand	Anodyne	STAT6	60	31
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819407768	FF	On-Demand	Anodyne	ADRB2	38	57
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819407768	FF	On-Demand	Anodyne	ADRB1	66	57
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819407768	FF	On-Demand	Anodyne	ADRB3	38	49
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819407769	FF	On-Demand	Anodyne	ADRB2	38	57
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819407769	FF	On-Demand	Anodyne	ADRB1	66	57
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819407769	FF	On-Demand	Anodyne	ADRB3	38	49
OC1CCN(c2ccc(NC[C@H](O)COCc3ccccc3)cc2)CC1	ZINC000819407772	FF	On-Demand	Anodyne	STAT6	16	40
OC1CCN(c2ccc(NC[C@@H](O)COCc3ccccc3)cc2)CC1	ZINC000819407773	FF	On-Demand	Anodyne	STAT6	16	40
OC1CCN(c2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2)CC1	ZINC000819407783	GF	On-Demand	Anodyne	ADRB2	21	60
OC1CCN(c2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2)CC1	ZINC000819407783	GF	On-Demand	Anodyne	ADRB1	29	60
OC1CCN(c2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2)CC1	ZINC000819407783	GF	On-Demand	Anodyne	HTR1A	17	60
OC1CCN(c2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2)CC1	ZINC000819407783	GF	On-Demand	Anodyne	SLC6A4	20	43
OC1CCN(c2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2)CC1	ZINC000819407783	GF	On-Demand	Anodyne	ADRB3	18	55
OC1CCN(c2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2)CC1	ZINC000819407784	GF	On-Demand	Anodyne	ADRB2	21	60
OC1CCN(c2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2)CC1	ZINC000819407784	GF	On-Demand	Anodyne	ADRB1	29	60
OC1CCN(c2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2)CC1	ZINC000819407784	GF	On-Demand	Anodyne	HTR1A	17	60
OC1CCN(c2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2)CC1	ZINC000819407784	GF	On-Demand	Anodyne	SLC6A4	20	43
OC1CCN(c2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2)CC1	ZINC000819407784	GF	On-Demand	Anodyne	ADRB3	18	55
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(N2CCC(O)CC2)cc1	ZINC000819407787	GE	On-Demand	Bother	ADRB1	41	31
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(N2CCC(O)CC2)cc1	ZINC000819407788	GE	On-Demand	Bother	ADRB1	41	31
OC1CCN(c2ccc(NC[C@H](O)c3ccc(Cl)cc3)cc2)CC1	ZINC000819407791	EG	On-Demand	Anodyne	CYP3A4	40	38
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819407794	EG	On-Demand	Anodyne	ADRB2	30	45
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819407794	EG	On-Demand	Anodyne	ADRB1	49	45
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819407795	EG	On-Demand	Anodyne	ADRB2	30	45
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819407795	EG	On-Demand	Anodyne	ADRB1	49	45
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819407808	GF	On-Demand	Anodyne	ADRB2	38	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819407808	GF	On-Demand	Anodyne	ADRB1	66	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819407808	GF	On-Demand	Anodyne	ADRB3	47	41
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819407808	GF	On-Demand	Anodyne	ABCB1	21	45
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819407809	GF	On-Demand	Anodyne	ADRB2	38	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819407809	GF	On-Demand	Anodyne	ADRB1	66	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819407809	GF	On-Demand	Anodyne	ADRB3	47	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819407809	GF	On-Demand	Anodyne	ABCB1	21	45
CCOC[C@H](O)CNc1ccc(OCCOC)cc1	ZINC000819407816	CD	On-Demand	Anodyne	ADRB2	31	43
CCOC[C@H](O)CNc1ccc(OCCOC)cc1	ZINC000819407816	CD	On-Demand	Anodyne	ADRB1	45	47
COCCOc1ccc(NC[C@H](O)COc2cc(C)ccc2Cl)cc1	ZINC000819407818	FH	On-Demand	Anodyne	ADRB2	34	44
COCCOc1ccc(NC[C@H](O)COc2cc(C)ccc2Cl)cc1	ZINC000819407818	FH	On-Demand	Anodyne	ADRB1	43	41
COCCOc1ccc(NC[C@@H](O)COc2cc(C)ccc2Cl)cc1	ZINC000819407819	FH	On-Demand	Anodyne	ADRB2	34	44
COCCOc1ccc(NC[C@@H](O)COc2cc(C)ccc2Cl)cc1	ZINC000819407819	FH	On-Demand	Anodyne	ADRB1	43	41
OC1CCN(c2ccc(NCC3(O)CCOCC3)cc2)CC1	ZINC000819407835	DD	On-Demand	Anodyne	STAT6	42	31
OC1CCN(c2ccc(NC[C@@H](O)CN3CCOCC3)cc2)CC1	ZINC000819407836	EC	On-Demand	Anodyne	STAT6	51	32
OC1CCN(c2ccc(NC[C@H](O)CN3CCOCC3)cc2)CC1	ZINC000819407837	EC	On-Demand	Anodyne	STAT6	51	32
COCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819407838	CE	On-Demand	Anodyne	ADRB2	31	50
COCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819407838	CE	On-Demand	Anodyne	ADRB1	39	51
COCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819407838	CE	On-Demand	Anodyne	ADRB3	102	56
COCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819407838	CE	On-Demand	Anodyne	CYP26A1	47	33
COCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819407839	CE	On-Demand	Anodyne	ADRB2	31	50
COCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819407839	CE	On-Demand	Anodyne	ADRB1	39	51
COCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819407839	CE	On-Demand	Anodyne	ADRB3	102	56
COCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819407839	CE	On-Demand	Anodyne	CYP26A1	47	33
N#Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819407869	FE	On-Demand	Mild	ADRB1	41	36
N#Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819407869	FE	On-Demand	Mild	ADRB3	24	42
N#Cc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819407870	FE	On-Demand	Mild	ADRB1	41	36
N#Cc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819407870	FE	On-Demand	Mild	ADRB3	24	42
OC1CCN(c2ccc(NC[C@@H](O)COc3ccccc3F)cc2)CC1	ZINC000819407873	FF	On-Demand	Anodyne	ADRB2	29	44
OC1CCN(c2ccc(NC[C@@H](O)COc3ccccc3F)cc2)CC1	ZINC000819407873	FF	On-Demand	Anodyne	ADRB1	48	33
OC1CCN(c2ccc(NC[C@@H](O)COc3ccccc3F)cc2)CC1	ZINC000819407873	FF	On-Demand	Anodyne	ADRB3	21	44
OC1CCN(c2ccc(NC[C@@H](O)COc3ccccc3F)cc2)CC1	ZINC000819407873	FF	On-Demand	Anodyne	ABCB1	26	41
OC1CCN(c2ccc(NC[C@H](O)COc3ccccc3F)cc2)CC1	ZINC000819407874	FF	On-Demand	Anodyne	ADRB2	29	44
OC1CCN(c2ccc(NC[C@H](O)COc3ccccc3F)cc2)CC1	ZINC000819407874	FF	On-Demand	Anodyne	ADRB1	48	33
OC1CCN(c2ccc(NC[C@H](O)COc3ccccc3F)cc2)CC1	ZINC000819407874	FF	On-Demand	Anodyne	ADRB3	21	44
OC1CCN(c2ccc(NC[C@H](O)COc3ccccc3F)cc2)CC1	ZINC000819407874	FF	On-Demand	Anodyne	ABCB1	26	41
COCCOc1ccc(NC[C@H](C)O)cc1	ZINC000819407876	BD	On-Demand	Anodyne	ADRB2	15	43
COCCOc1ccc(NC[C@H](C)O)cc1	ZINC000819407876	BD	On-Demand	Anodyne	ADRB1	24	43
COCCOc1ccc(NC[C@@H](C)O)cc1	ZINC000819407877	BD	On-Demand	Anodyne	ADRB2	15	43
COCCOc1ccc(NC[C@@H](C)O)cc1	ZINC000819407877	BD	On-Demand	Anodyne	ADRB1	24	43
OC1CCN(c2ccc(NC[C@@H](O)COc3ccccc3Cl)cc2)CC1	ZINC000819407878	GG	On-Demand	Anodyne	ADRB2	30	41
OC1CCN(c2ccc(NC[C@H](O)COc3ccccc3Cl)cc2)CC1	ZINC000819407879	GG	On-Demand	Anodyne	ADRB2	30	41
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819407884	FF	On-Demand	Anodyne	ADRB2	42	48
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819407884	FF	On-Demand	Anodyne	ADRB1	58	49
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819407884	FF	On-Demand	Anodyne	ADRB3	37	42
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819407885	FF	On-Demand	Anodyne	ADRB2	42	48
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819407885	FF	On-Demand	Anodyne	ADRB1	58	49
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819407885	FF	On-Demand	Anodyne	ADRB3	37	42
OC1CCN(c2ccc(NC[C@H](O)c3ccc(Cl)cc3Cl)cc2)CC1	ZINC000819407900	GI	On-Demand	Anodyne	CYP3A4	40	38
OC1CCN(c2ccc(NC[C@@H](O)c3ccc(Cl)cc3Cl)cc2)CC1	ZINC000819407901	GI	On-Demand	Anodyne	CYP3A4	40	38
OC1CCN(c2ccc(NC[C@H](O)c3cccc(C(F)(F)F)c3)cc2)CC1	ZINC000819407904	GH	On-Demand	Anodyne	CYP3A4	43	39
OC1CCN(c2ccc(NC[C@@H](O)c3cccc(C(F)(F)F)c3)cc2)CC1	ZINC000819407905	GH	On-Demand	Anodyne	CYP3A4	43	39
C#Cc1cccc(NC(=O)c2ccc(SCc3cn4ccccc4n3)cc2)c1	ZINC000819407908	GJ	On-Demand	Mild	MAP3K5	47	33
C#Cc1cccc(NC(=O)c2ccc(SCc3cn4ccccc4n3)cc2)c1	ZINC000819407908	GJ	On-Demand	Mild	KCNK3	55	35
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)c1	ZINC000819407911	EG	On-Demand	Anodyne	ADRB2	27	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)c1	ZINC000819407911	EG	On-Demand	Anodyne	ADRB1	37	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)c1	ZINC000819407911	EG	On-Demand	Anodyne	PDS	44	35
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)c1	ZINC000819407912	EG	On-Demand	Anodyne	ADRB2	27	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)c1	ZINC000819407912	EG	On-Demand	Anodyne	ADRB1	37	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)c1	ZINC000819407912	EG	On-Demand	Anodyne	PDS	44	35
CCOc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819407927	EG	On-Demand	Anodyne	ADRB2	33	41
CCOc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819407927	EG	On-Demand	Anodyne	ADRB1	45	40
CCOc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819407928	EG	On-Demand	Anodyne	ADRB2	33	41
CCOc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819407928	EG	On-Demand	Anodyne	ADRB1	45	40
COCCOc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819407929	DH	On-Demand	Anodyne	ADRB2	18	42
COCCOc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819407929	DH	On-Demand	Anodyne	ADRB3	25	40
NC(=O)NC(=O)CCNc1ccc(N2CCC(O)CC2)cc1	ZINC000819407930	DC	On-Demand	Anodyne	STAT6	55	31
COCCOc1ccc(NCCC(=O)Nc2ccc(N(C)C)cc2)cc1	ZINC000819408021	FG	On-Demand	Anodyne	LTA4H	44	39
COCCOc1ccc(NCCC(=O)Nc2ccc(N(C)C)cc2)cc1	ZINC000819408021	FG	On-Demand	Anodyne	MTNR1B	15	43
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1ccc(N2CCC(O)CC2)cc1	ZINC000819408026	GD	On-Demand	Anodyne	GPR119	26	45
COCCOc1ccc(NC[C@@H](O)CC2CCCC2)cc1	ZINC000819408057	CG	On-Demand	Anodyne	ADRB2	15	41
COCCOc1ccc(NC[C@@H](O)CC2CCCC2)cc1	ZINC000819408057	CG	On-Demand	Anodyne	ADRB1	37	45
COCCOc1ccc(NC[C@@H](O)CC2CCCC2)cc1	ZINC000819408057	CG	On-Demand	Anodyne	CTSL	15	40
COCCOc1ccc(NC[C@@H](O)CC2CCCC2)cc1	ZINC000819408057	CG	On-Demand	Anodyne	CTSS	24	40
COCCOc1ccc(NC[C@H](O)CC2CCCC2)cc1	ZINC000819408058	CG	On-Demand	Anodyne	ADRB2	15	41
COCCOc1ccc(NC[C@H](O)CC2CCCC2)cc1	ZINC000819408058	CG	On-Demand	Anodyne	ADRB1	37	45
COCCOc1ccc(NC[C@H](O)CC2CCCC2)cc1	ZINC000819408058	CG	On-Demand	Anodyne	CTSL	15	40
COCCOc1ccc(NC[C@H](O)CC2CCCC2)cc1	ZINC000819408058	CG	On-Demand	Anodyne	CTSS	24	40
COCCOc1ccc(NC[C@@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819408119	FH	On-Demand	Anodyne	ADRB2	41	43
COCCOc1ccc(NC[C@@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819408119	FH	On-Demand	Anodyne	ADRB1	55	44
COCCOc1ccc(NC[C@@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819408119	FH	On-Demand	Anodyne	PPARG	16	56
COCCOc1ccc(NC[C@@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819408119	FH	On-Demand	Anodyne	ADRB3	36	44
COCCOc1ccc(NC[C@@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819408119	FH	On-Demand	Anodyne	CASR	44	43
COCCOc1ccc(NC[C@@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819408119	FH	On-Demand	Anodyne	CTSL	15	44
COCCOc1ccc(NC[C@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819408120	FH	On-Demand	Anodyne	ADRB2	41	43
COCCOc1ccc(NC[C@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819408120	FH	On-Demand	Anodyne	ADRB1	55	44
COCCOc1ccc(NC[C@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819408120	FH	On-Demand	Anodyne	PPARG	16	56
COCCOc1ccc(NC[C@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819408120	FH	On-Demand	Anodyne	ADRB3	36	44
COCCOc1ccc(NC[C@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819408120	FH	On-Demand	Anodyne	CASR	44	43
COCCOc1ccc(NC[C@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819408120	FH	On-Demand	Anodyne	CTSL	15	44
OC1CCN(c2ccc(NC[C@H](O)c3ccc(OC(F)(F)F)cc3)cc2)CC1	ZINC000819408133	GH	On-Demand	Anodyne	CTSS	19	41
OC1CCN(c2ccc(NC[C@@H](O)c3ccc(OC(F)(F)F)cc3)cc2)CC1	ZINC000819408134	GH	On-Demand	Anodyne	CTSS	19	41
NC(=O)CCNc1ccc(N2CCC(O)CC2)cc1	ZINC000819408137	CC	On-Demand	Anodyne	STAT6	67	33
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819408168	GF	On-Demand	Anodyne	ADRB2	31	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819408168	GF	On-Demand	Anodyne	ADRB1	51	38
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819408168	GF	On-Demand	Anodyne	ADRB3	40	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819408168	GF	On-Demand	Anodyne	PRNP	43	34
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819408168	GF	On-Demand	Anodyne	ABCB1	32	50
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819408169	GF	On-Demand	Anodyne	ADRB2	31	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819408169	GF	On-Demand	Anodyne	ADRB1	51	38
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819408169	GF	On-Demand	Anodyne	ADRB3	40	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819408169	GF	On-Demand	Anodyne	PRNP	43	34
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819408169	GF	On-Demand	Anodyne	ABCB1	32	50
CCOc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819408185	GF	On-Demand	Anodyne	ADRB2	41	39
CCOc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819408185	GF	On-Demand	Anodyne	ADRB1	58	39
CCOc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819408185	GF	On-Demand	Anodyne	CACNA2D1	36	42
CCOc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819408185	GF	On-Demand	Anodyne	ADRB3	38	42
CCOc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819408185	GF	On-Demand	Anodyne	CACNA2D2	52	32
CCOc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819408186	GF	On-Demand	Anodyne	ADRB2	41	39
CCOc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819408186	GF	On-Demand	Anodyne	ADRB1	58	39
CCOc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819408186	GF	On-Demand	Anodyne	CACNA2D1	36	42
CCOc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819408186	GF	On-Demand	Anodyne	ADRB3	38	42
CCOc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819408186	GF	On-Demand	Anodyne	CACNA2D2	52	32
COCCOc1ccc(NCCC(=O)Nc2cccc(Cl)c2)cc1	ZINC000819408189	EH	On-Demand	Anodyne	ADRB1	18	44
COCCOc1ccc(NCCC(=O)Nc2cccc(Cl)c2)cc1	ZINC000819408189	EH	On-Demand	Anodyne	PRNP	17	42
COCCOc1ccc(NCCC(=O)Nc2cccc(Cl)c2)cc1	ZINC000819408189	EH	On-Demand	Anodyne	KDR	16	45
COCCOc1ccc(NCCC(=O)Nc2cccc(Cl)c2)cc1	ZINC000819408189	EH	On-Demand	Anodyne	MTNR1A	20	40
COCCOc1ccc(NCCC(=O)Nc2cccc(Cl)c2)cc1	ZINC000819408189	EH	On-Demand	Anodyne	MTNR1B	22	40
COCCOc1ccc(NCCC(=O)Nc2cccc(Cl)c2)cc1	ZINC000819408189	EH	On-Demand	Anodyne	EPHX2	15	46
COCCOc1ccc(NCCC(=O)Nc2cccc(Cl)c2)cc1	ZINC000819408189	EH	On-Demand	Anodyne	KCNK3	50	38
COCCOc1ccc(NCCC(=O)Nc2cccc(Cl)c2)cc1	ZINC000819408189	EH	On-Demand	Anodyne	KCNK9	40	38
Cc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408215	DG	On-Demand	Anodyne	ADRB2	21	51
Cc1ccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408216	DG	On-Demand	Anodyne	ADRB2	21	51
CCOC(=O)Nc1ccc(NCC2(O)CCC(C(=O)OCC)CC2)cc1	ZINC000819408222	FG	On-Demand	Anodyne	TIMP3	47	32
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408226	FG	On-Demand	Anodyne	ADRB2	35	41
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408226	FG	On-Demand	Anodyne	ADRB1	54	46
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408226	FG	On-Demand	Anodyne	GRIN1	20	40
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408226	FG	On-Demand	Anodyne	ADRB3	37	41
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408227	FG	On-Demand	Anodyne	ADRB2	35	41
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408227	FG	On-Demand	Anodyne	ADRB1	54	46
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408227	FG	On-Demand	Anodyne	GRIN1	20	40
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408227	FG	On-Demand	Anodyne	ADRB3	37	41
O[C@H](CNc1cccc(OC(F)F)c1)C1CC1	ZINC000819408234	BE	On-Demand	Anodyne	GRM4	15	45
O[C@@H](CNc1cccc(OC(F)F)c1)C1CC1	ZINC000819408235	BE	On-Demand	Anodyne	GRM4	15	45
COCc1ccccc1NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819408242	EH	On-Demand	Anodyne	P2RY1	44	33
COCc1ccccc1NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819408243	EH	On-Demand	Anodyne	P2RY1	44	33
CCOC(=O)Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819408251	GI	On-Demand	Anodyne	GCGR	15	43
CCOC(=O)Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819408251	GI	On-Demand	Anodyne	P2RY1	50	36
CCOC(=O)Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819408251	GI	On-Demand	Anodyne	EPHX2	50	40
CCOC(=O)Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819408251	GI	On-Demand	Anodyne	ACR	47	37
CCOC(=O)Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819408252	GI	On-Demand	Anodyne	GCGR	15	43
CCOC(=O)Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819408252	GI	On-Demand	Anodyne	P2RY1	50	36
CCOC(=O)Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819408252	GI	On-Demand	Anodyne	EPHX2	50	40
CCOC(=O)Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819408252	GI	On-Demand	Anodyne	ACR	47	37
CS(=O)(=O)c1ccc([C@@H](O)CNc2cccc(OC(F)F)c2)cc1	ZINC000819408255	FF	On-Demand	Anodyne	ADRB3	35	43
CS(=O)(=O)c1ccc([C@H](O)CNc2cccc(OC(F)F)c2)cc1	ZINC000819408256	FF	On-Demand	Anodyne	ADRB3	35	43
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819408261	GG	On-Demand	Bother	ADRB2	28	48
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819408261	GG	On-Demand	Bother	ADRB1	59	38
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819408261	GG	On-Demand	Bother	ADRB3	20	41
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819408262	GG	On-Demand	Bother	ADRB2	28	48
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819408262	GG	On-Demand	Bother	ADRB1	59	38
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819408262	GG	On-Demand	Bother	ADRB3	20	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)C2	ZINC000819408268	GF	On-Demand	Bother	COLA	117	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1)C2	ZINC000819408269	GF	On-Demand	Bother	COLA	117	37
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819408273	FG	On-Demand	Mild	ADRB2	44	51
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819408273	FG	On-Demand	Mild	ADRB1	70	51
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819408273	FG	On-Demand	Mild	ADRB3	45	51
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819408274	FG	On-Demand	Mild	ADRB2	44	51
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819408274	FG	On-Demand	Mild	ADRB1	70	51
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819408274	FG	On-Demand	Mild	ADRB3	45	51
C=C(C)C(C)(C)C(=O)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408284	EG	On-Demand	Mild	P2RY12	24	40
C=C(C)C(C)(C)C(=O)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408284	EG	On-Demand	Mild	GRIN2B	25	49
C=C(C)C(C)(C)C(=O)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408284	EG	On-Demand	Mild	ELANE	15	40
C=C(C)C(C)(C)C(=O)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408284	EG	On-Demand	Mild	PREP	30	43
C=C(C)C(C)(C)C(=O)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408284	EG	On-Demand	Mild	TGM2	50	44
C=C(C)C(C)(C)C(=O)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408284	EG	On-Demand	Mild	F13A1	53	44
C=C(C)C(C)(C)C(=O)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408284	EG	On-Demand	Mild	SLC12A5	78	40
CCOC(=O)Nc1ccc(NC[C@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819408285	FG	On-Demand	Anodyne	MTNR1A	26	49
CCOC(=O)Nc1ccc(NC[C@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819408285	FG	On-Demand	Anodyne	MTNR1B	29	52
CCOC(=O)Nc1ccc(NC[C@@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819408286	FG	On-Demand	Anodyne	MTNR1A	26	49
CCOC(=O)Nc1ccc(NC[C@@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819408286	FG	On-Demand	Anodyne	MTNR1B	29	52
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408287	FF	On-Demand	Anodyne	ADRB2	34	55
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408287	FF	On-Demand	Anodyne	ADRB1	60	55
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408287	FF	On-Demand	Anodyne	ADRB3	35	48
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408288	FF	On-Demand	Anodyne	ADRB2	34	55
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408288	FF	On-Demand	Anodyne	ADRB1	60	55
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408288	FF	On-Demand	Anodyne	ADRB3	35	48
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OCc3ccccc3)CC2)c1	ZINC000819408292	GF	On-Demand	Anodyne	TSHR	40	30
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OCc3ccccc3)CC2)c1	ZINC000819408292	GF	On-Demand	Anodyne	P2RY12	30	40
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OCc3ccccc3)CC2)c1	ZINC000819408292	GF	On-Demand	Anodyne	GRIN2B	24	47
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OCc3ccccc3)CC2)c1	ZINC000819408292	GF	On-Demand	Anodyne	CCKBR	15	41
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OCc3ccccc3)CC2)c1	ZINC000819408292	GF	On-Demand	Anodyne	TGM2	59	57
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OCc3ccccc3)CC2)c1	ZINC000819408292	GF	On-Demand	Anodyne	ST14	38	46
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OCc3ccccc3)CC2)c1	ZINC000819408292	GF	On-Demand	Anodyne	F13A1	76	57
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OCc3ccccc3)CC2)c1	ZINC000819408292	GF	On-Demand	Anodyne	SLC12A5	69	37
COCCc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819408300	FG	On-Demand	Anodyne	ADRB2	42	56
COCCc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819408300	FG	On-Demand	Anodyne	ADRB1	63	56
COCCc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819408300	FG	On-Demand	Anodyne	GRIN1	26	42
COCCc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819408300	FG	On-Demand	Anodyne	ADRB3	42	42
COCCc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819408301	FG	On-Demand	Anodyne	ADRB2	42	56
COCCc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819408301	FG	On-Demand	Anodyne	ADRB1	63	56
COCCc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819408301	FG	On-Demand	Anodyne	GRIN1	26	42
COCCc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819408301	FG	On-Demand	Anodyne	ADRB3	42	42
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819408308	FF	On-Demand	Anodyne	ADRB2	39	46
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819408308	FF	On-Demand	Anodyne	ADRB1	60	44
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819408308	FF	On-Demand	Anodyne	GRIN1	20	41
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819408308	FF	On-Demand	Anodyne	ADRB3	37	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819408309	FF	On-Demand	Anodyne	ADRB2	39	46
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819408309	FF	On-Demand	Anodyne	ADRB1	60	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819408309	FF	On-Demand	Anodyne	GRIN1	20	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819408309	FF	On-Demand	Anodyne	ADRB3	37	44
COCCOc1ccc(NC[C@H](O)C2CCCCC2)cc1	ZINC000819408313	CG	On-Demand	Anodyne	ADRB1	28	41
COCCOc1ccc(NC[C@H](O)C2CCCCC2)cc1	ZINC000819408313	CG	On-Demand	Anodyne	S1PR4	17	41
COCCOc1ccc(NC[C@@H](O)C2CCCCC2)cc1	ZINC000819408314	CG	On-Demand	Anodyne	ADRB1	28	41
COCCOc1ccc(NC[C@@H](O)C2CCCCC2)cc1	ZINC000819408314	CG	On-Demand	Anodyne	S1PR4	17	41
COCCOc1ccc(NC[C@@H](O)Cc2ccc(F)cc2)cc1	ZINC000819408335	DF	On-Demand	Anodyne	ADRB2	28	43
COCCOc1ccc(NC[C@@H](O)Cc2ccc(F)cc2)cc1	ZINC000819408335	DF	On-Demand	Anodyne	ADRB1	47	43
COCCOc1ccc(NC[C@@H](O)Cc2ccc(F)cc2)cc1	ZINC000819408335	DF	On-Demand	Anodyne	PPARA	16	42
COCCOc1ccc(NC[C@H](O)Cc2ccc(F)cc2)cc1	ZINC000819408336	DF	On-Demand	Anodyne	ADRB2	28	43
COCCOc1ccc(NC[C@H](O)Cc2ccc(F)cc2)cc1	ZINC000819408336	DF	On-Demand	Anodyne	ADRB1	47	43
COCCOc1ccc(NC[C@H](O)Cc2ccc(F)cc2)cc1	ZINC000819408336	DF	On-Demand	Anodyne	PPARA	16	42
OC1CCN(c2ccc(NC[C@@H](O)COc3cccc4ccccc34)cc2)CC1	ZINC000819408339	GH	On-Demand	Anodyne	ADRB2	36	50
OC1CCN(c2ccc(NC[C@@H](O)COc3cccc4ccccc34)cc2)CC1	ZINC000819408339	GH	On-Demand	Anodyne	ADRB1	34	50
OC1CCN(c2ccc(NC[C@@H](O)COc3cccc4ccccc34)cc2)CC1	ZINC000819408339	GH	On-Demand	Anodyne	ADRB3	22	50
OC1CCN(c2ccc(NC[C@@H](O)COc3cccc4ccccc34)cc2)CC1	ZINC000819408339	GH	On-Demand	Anodyne	ABCB1	33	41
OC1CCN(c2ccc(NC[C@H](O)COc3cccc4ccccc34)cc2)CC1	ZINC000819408340	GH	On-Demand	Anodyne	ADRB2	36	50
OC1CCN(c2ccc(NC[C@H](O)COc3cccc4ccccc34)cc2)CC1	ZINC000819408340	GH	On-Demand	Anodyne	ADRB1	34	50
OC1CCN(c2ccc(NC[C@H](O)COc3cccc4ccccc34)cc2)CC1	ZINC000819408340	GH	On-Demand	Anodyne	ADRB3	22	50
OC1CCN(c2ccc(NC[C@H](O)COc3cccc4ccccc34)cc2)CC1	ZINC000819408340	GH	On-Demand	Anodyne	ABCB1	33	41
OC1CCN(c2ccc(NC[C@@H](O)CCc3ccccc3)cc2)CC1	ZINC000819408357	EG	On-Demand	Anodyne	STAT6	19	42
OC1CCN(c2ccc(NC[C@H](O)CCc3ccccc3)cc2)CC1	ZINC000819408358	EG	On-Demand	Anodyne	STAT6	19	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(N2CCC(O)CC2)cc1	ZINC000819408383	GE	On-Demand	Anodyne	GPR119	18	47
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(N2CCC(O)CC2)cc1	ZINC000819408384	GE	On-Demand	Anodyne	GPR119	18	47
OC1CCN(c2ccc(NC[C@@H](O)Cc3ccccc3)cc2)CC1	ZINC000819408396	EF	On-Demand	Anodyne	STAT6	23	43
COCc1ccccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819408408	FG	On-Demand	Anodyne	CCR8	28	40
COCc1ccccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819408408	FG	On-Demand	Anodyne	GPR119	49	53
COCc1ccccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819408409	FG	On-Demand	Anodyne	CCR8	28	40
COCc1ccccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819408409	FG	On-Demand	Anodyne	GPR119	49	53
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408410	EG	On-Demand	Anodyne	ADRB2	21	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408411	EG	On-Demand	Anodyne	ADRB2	21	43
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819408415	GI	On-Demand	Anodyne	ADRB2	24	45
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819408415	GI	On-Demand	Anodyne	ADRB1	28	40
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819408415	GI	On-Demand	Anodyne	AGPAT2	42	33
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819408416	GI	On-Demand	Anodyne	ADRB2	24	45
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819408416	GI	On-Demand	Anodyne	ADRB1	28	40
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819408416	GI	On-Demand	Anodyne	AGPAT2	42	33
COc1ccc(CNC(=O)[C@H]2CCCC[C@H]2C)cc1C#N	ZINC000819408418	CG	On-Demand	Mild	PDE5A	26	40
COc1ccc(CNC(=O)[C@H]2CCCC[C@H]2C)cc1C#N	ZINC000819408418	CG	On-Demand	Mild	CTSK	15	42
COc1ccc(CNC(=O)[C@H]2CCCC[C@@H]2C)cc1C#N	ZINC000819408421	CG	On-Demand	Mild	PDE5A	26	40
COc1ccc(CNC(=O)[C@H]2CCCC[C@@H]2C)cc1C#N	ZINC000819408421	CG	On-Demand	Mild	CTSK	15	42
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819408430	FH	On-Demand	Anodyne	ADRB2	39	50
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819408430	FH	On-Demand	Anodyne	ADRB1	53	47
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819408430	FH	On-Demand	Anodyne	ADRB3	35	47
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819408431	FH	On-Demand	Anodyne	ADRB2	39	50
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819408431	FH	On-Demand	Anodyne	ADRB1	53	47
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819408431	FH	On-Demand	Anodyne	ADRB3	35	47
CCc1ncsc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819408434	FG	On-Demand	Mild	PAPA1_CARPA	40	47
CCc1ncsc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819408435	FG	On-Demand	Mild	PAPA1_CARPA	40	47
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C#N	ZINC000819408463	GF	On-Demand	Mild	CTSD	15	41
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C#N	ZINC000819408463	GF	On-Demand	Mild	PAPA1_CARPA	56	50
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C#N	ZINC000819408463	GF	On-Demand	Mild	CTSL	19	50
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C#N	ZINC000819408463	GF	On-Demand	Mild	FURIN	55	33
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C#N	ZINC000819408463	GF	On-Demand	Mild	CTSS	18	52
COc1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C#N	ZINC000819408463	GF	On-Demand	Mild	FPR1	43	38
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C)cc2C)cc1	ZINC000819408465	FH	On-Demand	Anodyne	ADRB2	23	45
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C)cc2C)cc1	ZINC000819408465	FH	On-Demand	Anodyne	VDR	17	40
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C)cc2C)cc1	ZINC000819408466	FH	On-Demand	Anodyne	ADRB2	23	45
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C)cc2C)cc1	ZINC000819408466	FH	On-Demand	Anodyne	VDR	17	40
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2c(C)cccc2C)cc1	ZINC000819408467	FH	On-Demand	Anodyne	ADRB2	31	47
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2c(C)cccc2C)cc1	ZINC000819408467	FH	On-Demand	Anodyne	ADRB1	39	43
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2c(C)cccc2C)cc1	ZINC000819408467	FH	On-Demand	Anodyne	ADRB3	21	43
CCOC(=O)Nc1ccc(NC[C@H](O)COc2c(C)cccc2C)cc1	ZINC000819408468	FH	On-Demand	Anodyne	ADRB2	31	47
CCOC(=O)Nc1ccc(NC[C@H](O)COc2c(C)cccc2C)cc1	ZINC000819408468	FH	On-Demand	Anodyne	ADRB1	39	43
CCOC(=O)Nc1ccc(NC[C@H](O)COc2c(C)cccc2C)cc1	ZINC000819408468	FH	On-Demand	Anodyne	ADRB3	21	43
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)ccc2C)cc1	ZINC000819408470	FH	On-Demand	Anodyne	ADRB2	31	47
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)ccc2C)cc1	ZINC000819408470	FH	On-Demand	Anodyne	ADRB1	51	36
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)ccc2C)cc1	ZINC000819408470	FH	On-Demand	Anodyne	ADRB3	19	43
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)ccc2C)cc1	ZINC000819408471	FH	On-Demand	Anodyne	ADRB2	31	47
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)ccc2C)cc1	ZINC000819408471	FH	On-Demand	Anodyne	ADRB1	51	36
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)ccc2C)cc1	ZINC000819408471	FH	On-Demand	Anodyne	ADRB3	19	43
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408483	FF	On-Demand	Anodyne	ADRB2	29	46
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408483	FF	On-Demand	Anodyne	ADRB1	42	40
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408483	FF	On-Demand	Anodyne	ADRB3	20	40
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408484	FF	On-Demand	Anodyne	ADRB2	29	46
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408484	FF	On-Demand	Anodyne	ADRB1	42	40
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819408484	FF	On-Demand	Anodyne	ADRB3	20	40
CCOC(=O)Nc1ccc(NC[C@H](O)CC)cc1	ZINC000819408489	CE	On-Demand	Anodyne	ACR	45	34
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819408495	FH	On-Demand	Anodyne	ADRB2	27	58
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819408495	FH	On-Demand	Anodyne	ADRB1	58	58
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819408495	FH	On-Demand	Anodyne	ADRB3	21	58
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819408496	FH	On-Demand	Anodyne	ADRB2	27	58
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819408496	FH	On-Demand	Anodyne	ADRB1	58	58
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819408496	FH	On-Demand	Anodyne	ADRB3	21	58
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)c1	ZINC000819408547	EG	On-Demand	Anodyne	ADRB2	18	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)c1	ZINC000819408547	EG	On-Demand	Anodyne	ADRB1	17	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)c1	ZINC000819408547	EG	On-Demand	Anodyne	ABCB1	15	46
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)c1	ZINC000819408549	EG	On-Demand	Anodyne	ADRB2	18	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)c1	ZINC000819408549	EG	On-Demand	Anodyne	ADRB1	17	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)c1	ZINC000819408549	EG	On-Demand	Anodyne	ABCB1	15	46
CCOC(=O)Nc1ccc(NC[C@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819408572	GI	On-Demand	Anodyne	ADRB2	29	45
CCOC(=O)Nc1ccc(NC[C@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819408572	GI	On-Demand	Anodyne	ADRB1	39	42
CCOC(=O)Nc1ccc(NC[C@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819408572	GI	On-Demand	Anodyne	ADRB3	22	42
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819408574	GI	On-Demand	Anodyne	ADRB2	29	45
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819408574	GI	On-Demand	Anodyne	ADRB1	39	42
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819408574	GI	On-Demand	Anodyne	ADRB3	22	42
C=C(C)C(C)(C)C(=O)NCc1ccc(OC)c(C#N)c1	ZINC000819408578	CF	On-Demand	Mild	MT-ND1	24	42
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819408580	GG	On-Demand	Anodyne	ADRB2	51	62
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819408580	GG	On-Demand	Anodyne	ADRB1	72	62
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819408580	GG	On-Demand	Anodyne	ADRB3	44	53
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819408582	GG	On-Demand	Anodyne	ADRB2	51	62
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819408582	GG	On-Demand	Anodyne	ADRB1	72	62
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819408582	GG	On-Demand	Anodyne	ADRB3	44	53
O=C1OCCN1Cc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819408607	DE	On-Demand	Anodyne	ADRB3	81	40
O=C1OCCN1Cc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819408608	DE	On-Demand	Anodyne	ADRB3	81	40
CCOC(=O)Nc1ccc(NC[C@H](O)CN(C)Cc2ccccc2)cc1	ZINC000819408638	FG	On-Demand	Anodyne	LTA4H	28	42
CCOC(=O)Nc1ccc(NC[C@@H](O)CN(C)Cc2ccccc2)cc1	ZINC000819408639	FG	On-Demand	Anodyne	LTA4H	28	42
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(CC)c2)cc1	ZINC000819408640	FH	On-Demand	Anodyne	ADRB2	51	48
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(CC)c2)cc1	ZINC000819408640	FH	On-Demand	Anodyne	ADRB1	70	48
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(CC)c2)cc1	ZINC000819408640	FH	On-Demand	Anodyne	ADRB3	49	48
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(CC)c2)cc1	ZINC000819408640	FH	On-Demand	Anodyne	ACR	41	35
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(CC)c2)cc1	ZINC000819408640	FH	On-Demand	Anodyne	PDS	92	44
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(CC)c2)cc1	ZINC000819408641	FH	On-Demand	Anodyne	ADRB2	51	48
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(CC)c2)cc1	ZINC000819408641	FH	On-Demand	Anodyne	ADRB1	70	48
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(CC)c2)cc1	ZINC000819408641	FH	On-Demand	Anodyne	ADRB3	49	48
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(CC)c2)cc1	ZINC000819408641	FH	On-Demand	Anodyne	ACR	41	35
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(CC)c2)cc1	ZINC000819408641	FH	On-Demand	Anodyne	PDS	92	44
COCc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819408662	CH	On-Demand	Anodyne	ADRB2	19	43
COCc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819408662	CH	On-Demand	Anodyne	ADRB1	32	43
COCc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819408662	CH	On-Demand	Anodyne	ADRB3	46	45
COCc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819408662	CH	On-Demand	Anodyne	CYP3A4	50	38
COCc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819408664	CH	On-Demand	Anodyne	ADRB2	19	43
COCc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819408664	CH	On-Demand	Anodyne	ADRB1	32	43
COCc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819408664	CH	On-Demand	Anodyne	ADRB3	46	45
COCc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819408664	CH	On-Demand	Anodyne	CYP3A4	50	38
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C(C)C)cc1	ZINC000819408680	FI	On-Demand	Anodyne	ADRB2	40	50
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C(C)C)cc1	ZINC000819408680	FI	On-Demand	Anodyne	ADRB1	64	38
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C(C)C)cc1	ZINC000819408680	FI	On-Demand	Anodyne	ADRB3	25	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(NC(=O)c2ccccc2)c1	ZINC000819408682	GH	On-Demand	Anodyne	PRNP	26	42
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(NC(=O)c2ccccc2)c1	ZINC000819408682	GH	On-Demand	Anodyne	NR1H4	17	42
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(NC(=O)c2ccccc2)c1	ZINC000819408682	GH	On-Demand	Anodyne	TAAR1	42	35
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(NC(=O)c2ccccc2)c1	ZINC000819408682	GH	On-Demand	Anodyne	KCNK3	140	48
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(NC(=O)c2ccccc2)c1	ZINC000819408682	GH	On-Demand	Anodyne	KCNK9	93	48
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C(C)C)cc1	ZINC000819408683	FI	On-Demand	Anodyne	ADRB2	40	50
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C(C)C)cc1	ZINC000819408683	FI	On-Demand	Anodyne	ADRB1	64	38
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C(C)C)cc1	ZINC000819408683	FI	On-Demand	Anodyne	ADRB3	25	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(NC(=O)c2ccccc2)c1	ZINC000819408687	GH	On-Demand	Anodyne	PRNP	26	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(NC(=O)c2ccccc2)c1	ZINC000819408687	GH	On-Demand	Anodyne	NR1H4	17	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(NC(=O)c2ccccc2)c1	ZINC000819408687	GH	On-Demand	Anodyne	TAAR1	42	35
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(NC(=O)c2ccccc2)c1	ZINC000819408687	GH	On-Demand	Anodyne	KCNK3	140	48
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(NC(=O)c2ccccc2)c1	ZINC000819408687	GH	On-Demand	Anodyne	KCNK9	93	48
OC1CCN(c2ccc(NC[C@H](O)Cc3ccccc3)cc2)CC1	ZINC000819408698	EF	On-Demand	Anodyne	STAT6	23	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NNc1cccc(C(F)(F)F)c1)C2	ZINC000819408705	FG	On-Demand	Reactive	CCR2	53	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NNc1cccc(C(F)(F)F)c1)C2	ZINC000819408706	FG	On-Demand	Reactive	CCR2	53	34
CCOC(=O)CC[C@H](O)CNc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	ZINC000819408708	FF	On-Demand	Anodyne	NPY2R	63	33
CCOC(=O)CC[C@H](O)CNc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	ZINC000819408709	FF	On-Demand	Anodyne	NPY2R	63	33
CCOC(=O)CC[C@@H](O)CNc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	ZINC000819408710	FF	On-Demand	Anodyne	NPY2R	63	33
CCOC(=O)CC[C@H](O)CNc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	ZINC000819408712	FF	On-Demand	Anodyne	NPY2R	63	33
C=CCc1ccc(OC[C@@H](O)CNc2ccc(OC)c(F)c2)c(OC)c1	ZINC000819408713	FG	On-Demand	Mild	ADRB2	15	42
C=CCc1ccc(OC[C@@H](O)CNc2ccc(OC)c(F)c2)c(OC)c1	ZINC000819408713	FG	On-Demand	Mild	ADRB1	16	42
C=CCc1ccc(OC[C@H](O)CNc2ccc(OC)c(F)c2)c(OC)c1	ZINC000819408715	FG	On-Demand	Mild	ADRB2	15	42
C=CCc1ccc(OC[C@H](O)CNc2ccc(OC)c(F)c2)c(OC)c1	ZINC000819408715	FG	On-Demand	Mild	ADRB1	16	42
COCCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819408722	FG	On-Demand	Anodyne	ADRB2	36	60
COCCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819408722	FG	On-Demand	Anodyne	ADRB1	55	60
COCCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819408722	FG	On-Demand	Anodyne	ADRB3	25	60
COCCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819408722	FG	On-Demand	Anodyne	CYP2D6	18	43
COCCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819408726	FG	On-Demand	Anodyne	ADRB2	36	60
COCCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819408726	FG	On-Demand	Anodyne	ADRB1	55	60
COCCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819408726	FG	On-Demand	Anodyne	ADRB3	25	60
COCCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819408726	FG	On-Demand	Anodyne	CYP2D6	18	43
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc(N2CCC(O)CC2)cc1	ZINC000819408737	GE	On-Demand	Anodyne	GPR119	15	43
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc(N2CCC(O)CC2)cc1	ZINC000819408739	GE	On-Demand	Anodyne	GPR119	15	43
C[C@@H]1CCCC[C@@H]1C(=O)NNc1cccc([N+](=O)[O-])c1	ZINC000819408783	CF	On-Demand	Reactive	CACNA1C	42	36
C[C@@H]1CCCC[C@@H]1C(=O)NNc1cccc([N+](=O)[O-])c1	ZINC000819408783	CF	On-Demand	Reactive	CACNA1D	68	36
C[C@@H]1CCCC[C@H]1C(=O)NNc1cccc([N+](=O)[O-])c1	ZINC000819408784	CF	On-Demand	Reactive	CACNA1C	42	36
C[C@@H]1CCCC[C@H]1C(=O)NNc1cccc([N+](=O)[O-])c1	ZINC000819408784	CF	On-Demand	Reactive	CACNA1D	68	36
OC1CCN(c2ccc(NC[C@H](O)COc3ccc(Cl)cc3)cc2)CC1	ZINC000819408814	GG	On-Demand	Anodyne	ADRB1	54	42
OC1CCN(c2ccc(NC[C@H](O)COc3ccc(Cl)cc3)cc2)CC1	ZINC000819408814	GG	On-Demand	Anodyne	ADRB3	35	44
OC1CCN(c2ccc(NC[C@@H](O)COc3ccc(Cl)cc3)cc2)CC1	ZINC000819408815	GG	On-Demand	Anodyne	ADRB1	54	42
OC1CCN(c2ccc(NC[C@@H](O)COc3ccc(Cl)cc3)cc2)CC1	ZINC000819408815	GG	On-Demand	Anodyne	ADRB3	35	44
OC1CCN(c2ccc(NC[C@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819408820	EF	On-Demand	Anodyne	IGF1R	23	40
OC1CCN(c2ccc(NC[C@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819408820	EF	On-Demand	Anodyne	CYP3A4	46	40
OC1CCN(c2ccc(NC[C@@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819408821	EF	On-Demand	Anodyne	IGF1R	23	40
OC1CCN(c2ccc(NC[C@@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819408821	EF	On-Demand	Anodyne	CYP3A4	46	40
OC1CCN(c2ccc(NC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819408826	DF	On-Demand	Anodyne	STAT6	15	40
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819408827	FF	On-Demand	Bother	CYP3A4	46	39
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819408828	FF	On-Demand	Bother	CYP3A4	46	39
COCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819408837	DF	On-Demand	Anodyne	ADRB2	42	40
COCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819408837	DF	On-Demand	Anodyne	ADRB1	60	43
COCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819408837	DF	On-Demand	Anodyne	PPARG	32	46
COCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819408837	DF	On-Demand	Anodyne	PPARA	32	47
COCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819408837	DF	On-Demand	Anodyne	ADRB3	41	43
COCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819408837	DF	On-Demand	Anodyne	LTA4H	47	41
COCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819408837	DF	On-Demand	Anodyne	PDS	50	35
COCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819408838	DF	On-Demand	Anodyne	ADRB2	42	40
COCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819408838	DF	On-Demand	Anodyne	ADRB1	60	43
COCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819408838	DF	On-Demand	Anodyne	PPARG	32	46
COCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819408838	DF	On-Demand	Anodyne	PPARA	32	47
COCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819408838	DF	On-Demand	Anodyne	ADRB3	41	43
COCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819408838	DF	On-Demand	Anodyne	LTA4H	47	41
COCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819408838	DF	On-Demand	Anodyne	PDS	50	35
COCCOc1ccc(NC[C@@H](O)CCC(C)C)cc1	ZINC000819408843	CF	On-Demand	Anodyne	ADRB2	16	41
COCCOc1ccc(NC[C@@H](O)CCC(C)C)cc1	ZINC000819408843	CF	On-Demand	Anodyne	ADRB1	25	41
COCCOc1ccc(NC[C@H](O)CCC(C)C)cc1	ZINC000819408844	CF	On-Demand	Anodyne	ADRB2	16	41
COCCOc1ccc(NC[C@H](O)CCC(C)C)cc1	ZINC000819408844	CF	On-Demand	Anodyne	ADRB1	25	41
OC1CCN(c2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2)CC1	ZINC000819408854	FF	On-Demand	Anodyne	ADRB2	36	41
OC1CCN(c2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2)CC1	ZINC000819408854	FF	On-Demand	Anodyne	ADRB1	58	42
OC1CCN(c2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2)CC1	ZINC000819408854	FF	On-Demand	Anodyne	ADRB3	37	44
OC1CCN(c2ccc(NC[C@@H](O)COc3ccc(F)cc3)cc2)CC1	ZINC000819408855	FF	On-Demand	Anodyne	ADRB2	36	41
OC1CCN(c2ccc(NC[C@@H](O)COc3ccc(F)cc3)cc2)CC1	ZINC000819408855	FF	On-Demand	Anodyne	ADRB1	58	42
OC1CCN(c2ccc(NC[C@@H](O)COc3ccc(F)cc3)cc2)CC1	ZINC000819408855	FF	On-Demand	Anodyne	ADRB3	37	44
COCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819408856	DH	On-Demand	Anodyne	ADRB2	28	55
COCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819408856	DH	On-Demand	Anodyne	ADRB1	48	52
COCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819408856	DH	On-Demand	Anodyne	ADRB3	64	55
COCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819408856	DH	On-Demand	Anodyne	CYP3A4	42	37
COCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819408857	DH	On-Demand	Anodyne	ADRB2	28	55
COCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819408857	DH	On-Demand	Anodyne	ADRB1	48	52
COCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819408857	DH	On-Demand	Anodyne	ADRB3	64	55
COCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819408857	DH	On-Demand	Anodyne	CYP3A4	42	37
N#Cc1cccc(S(=O)(=O)CCNc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819408858	GE	On-Demand	Mild	ITGA4	41	31
CCOC(=O)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819408869	DF	On-Demand	Anodyne	ADRB2	28	49
CCOC(=O)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819408869	DF	On-Demand	Anodyne	ADRB1	28	49
CCOC(=O)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819408869	DF	On-Demand	Anodyne	ADRB3	99	53
CCOC(=O)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819408869	DF	On-Demand	Anodyne	NAMPT	27	42
CCOC(=O)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819408870	DF	On-Demand	Anodyne	ADRB2	28	49
CCOC(=O)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819408870	DF	On-Demand	Anodyne	ADRB1	28	49
CCOC(=O)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819408870	DF	On-Demand	Anodyne	ADRB3	99	53
CCOC(=O)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819408870	DF	On-Demand	Anodyne	NAMPT	27	42
C=CCCn1cc(C(=O)N2CCN(C(=O)OCc3ccccc3)CC2)nn1	ZINC000819408871	FD	On-Demand	Mild	GRIN2B	20	42
C=CCCn1cc(C(=O)N2CCN(C(=O)OCc3ccccc3)CC2)nn1	ZINC000819408871	FD	On-Demand	Mild	TGM2	46	46
C=CCCn1cc(C(=O)N2CCN(C(=O)OCc3ccccc3)CC2)nn1	ZINC000819408871	FD	On-Demand	Mild	F13A1	45	41
COc1cccc(OC)c1C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl	ZINC000819408874	IJ	On-Demand	Anodyne	DRD4	42	33
COc1cccc(OC)c1C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl	ZINC000819408874	IJ	On-Demand	Anodyne	DHODH	15	46
O=C(/C=C/[C@H]1CCCO1)N(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000819408875	DF	On-Demand	Bother	COLA	108	35
O=C(/C=C/[C@@H]1CCCO1)N(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000819408876	DF	On-Demand	Bother	COLA	108	35
O=C(/C=C\[C@H]1CCCO1)N(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000819408877	DF	On-Demand	Bother	COLA	108	35
O=C(/C=C\[C@@H]1CCCO1)N(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000819408878	DF	On-Demand	Bother	COLA	108	35
CCOC(=O)Nc1ccc(NC[C@H](O)COCc2ccccc2Cl)cc1	ZINC000819408879	GH	On-Demand	Anodyne	ADRB1	18	41
CCOC(=O)Nc1ccc(NC[C@@H](O)COCc2ccccc2Cl)cc1	ZINC000819408880	GH	On-Demand	Anodyne	ADRB1	18	41
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819408886	FH	On-Demand	Anodyne	ADRB2	38	60
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819408886	FH	On-Demand	Anodyne	ADRB1	65	38
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819408886	FH	On-Demand	Anodyne	ADRB3	29	41
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819408886	FH	On-Demand	Anodyne	PDS	32	46
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819408887	FH	On-Demand	Anodyne	ADRB2	38	60
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819408887	FH	On-Demand	Anodyne	ADRB1	65	38
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819408887	FH	On-Demand	Anodyne	ADRB3	29	41
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819408887	FH	On-Demand	Anodyne	PDS	32	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2cccc(OC(F)F)c2)CC1	ZINC000819408899	GH	On-Demand	Anodyne	GPR119	49	50
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2cccc(OC(F)F)c2)CC1	ZINC000819408900	GH	On-Demand	Anodyne	GPR119	49	50
COCc1ccccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819408901	DF	On-Demand	Bother	CACNA1C	54	38
COCc1ccccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819408901	DF	On-Demand	Bother	CACNA1D	84	38
COCc1ccccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819408902	DF	On-Demand	Bother	CACNA1C	54	38
COCc1ccccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819408902	DF	On-Demand	Bother	CACNA1D	84	38
CCOC(=O)Nc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819408903	FG	On-Demand	Anodyne	NOD1	20	52
CCOC(=O)Nc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819408903	FG	On-Demand	Anodyne	NOD2	54	52
CCOC(=O)Nc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819408904	FG	On-Demand	Anodyne	NOD1	20	52
CCOC(=O)Nc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819408904	FG	On-Demand	Anodyne	NOD2	54	52
CCOC(=O)Nc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819408912	GF	On-Demand	Anodyne	ADRB3	18	41
CCOC(=O)Nc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819408912	GF	On-Demand	Anodyne	GHSR	17	41
CCOC(=O)Nc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819408912	GF	On-Demand	Anodyne	P96878_MYCTU	40	38
CCOC(=O)Nc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819408913	GF	On-Demand	Anodyne	ADRB3	18	41
CCOC(=O)Nc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819408913	GF	On-Demand	Anodyne	GHSR	17	41
CCOC(=O)Nc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819408913	GF	On-Demand	Anodyne	P96878_MYCTU	40	38
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)NNc3ccccc3)nn2)C1	ZINC000819408919	GF	On-Demand	Reactive	PREP	21	42
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)NNc3ccccc3)nn2)C1	ZINC000819408921	GF	On-Demand	Reactive	PREP	21	42
C/C=C/c1ccc(OC[C@@H](O)CNc2ccc(OC)c(F)c2)c(OC)c1	ZINC000819408924	FH	On-Demand	Anodyne	TUBB1	32	42
C/C=C\c1ccc(OC[C@@H](O)CNc2ccc(OC)c(F)c2)c(OC)c1	ZINC000819408925	FH	On-Demand	Anodyne	TUBB1	32	42
C/C=C/c1ccc(OC[C@H](O)CNc2ccc(OC)c(F)c2)c(OC)c1	ZINC000819408926	FH	On-Demand	Anodyne	TUBB1	32	42
C/C=C\c1ccc(OC[C@H](O)CNc2ccc(OC)c(F)c2)c(OC)c1	ZINC000819408928	FH	On-Demand	Anodyne	TUBB1	32	42
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819408940	FG	On-Demand	Anodyne	ADRB2	57	52
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819408940	FG	On-Demand	Anodyne	ADRB1	79	51
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819408940	FG	On-Demand	Anodyne	ADRB3	48	49
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819408940	FG	On-Demand	Anodyne	ACR	59	37
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819408941	GF	On-Demand	Anodyne	ADRB2	20	43
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819408941	GF	On-Demand	Anodyne	ADRB1	34	43
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819408941	GF	On-Demand	Anodyne	ADRB3	24	43
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819408942	FG	On-Demand	Anodyne	ADRB2	57	52
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819408942	FG	On-Demand	Anodyne	ADRB1	79	51
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819408942	FG	On-Demand	Anodyne	ADRB3	48	49
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819408942	FG	On-Demand	Anodyne	ACR	59	37
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819408943	GF	On-Demand	Anodyne	ADRB2	20	43
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819408943	GF	On-Demand	Anodyne	ADRB1	34	43
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819408943	GF	On-Demand	Anodyne	ADRB3	24	43
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408980	EE	On-Demand	Anodyne	CELA1	19	43
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408980	EE	On-Demand	Anodyne	GRIN2B	27	46
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408980	EE	On-Demand	Anodyne	PREP	42	46
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408980	EE	On-Demand	Anodyne	TGM2	44	42
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408980	EE	On-Demand	Anodyne	KLK5	31	41
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408980	EE	On-Demand	Anodyne	F13A1	48	42
O=C(/C=C/[C@@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408980	EE	On-Demand	Anodyne	SLC12A5	71	38
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408982	EE	On-Demand	Anodyne	CELA1	19	43
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408982	EE	On-Demand	Anodyne	GRIN2B	27	46
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408982	EE	On-Demand	Anodyne	PREP	42	46
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408982	EE	On-Demand	Anodyne	TGM2	44	42
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408982	EE	On-Demand	Anodyne	KLK5	31	41
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408982	EE	On-Demand	Anodyne	F13A1	48	42
O=C(/C=C\[C@@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408982	EE	On-Demand	Anodyne	SLC12A5	71	38
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408984	EE	On-Demand	Anodyne	CELA1	19	43
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408984	EE	On-Demand	Anodyne	GRIN2B	27	46
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408984	EE	On-Demand	Anodyne	PREP	42	46
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408984	EE	On-Demand	Anodyne	TGM2	44	42
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408984	EE	On-Demand	Anodyne	KLK5	31	41
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408984	EE	On-Demand	Anodyne	F13A1	48	42
O=C(/C=C/[C@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408984	EE	On-Demand	Anodyne	SLC12A5	71	38
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408986	EE	On-Demand	Anodyne	CELA1	19	43
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408986	EE	On-Demand	Anodyne	GRIN2B	27	46
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408986	EE	On-Demand	Anodyne	PREP	42	46
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408986	EE	On-Demand	Anodyne	TGM2	44	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408986	EE	On-Demand	Anodyne	KLK5	31	41
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408986	EE	On-Demand	Anodyne	F13A1	48	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819408986	EE	On-Demand	Anodyne	SLC12A5	71	38
Cc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819409062	DG	On-Demand	Anodyne	ADRB2	34	51
Cc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819409062	DG	On-Demand	Anodyne	ADRB1	47	41
Cc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819409062	DG	On-Demand	Anodyne	GRIN1	18	40
Cc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819409062	DG	On-Demand	Anodyne	ADRB3	25	40
Cc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819409063	DG	On-Demand	Anodyne	ADRB2	34	51
Cc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819409063	DG	On-Demand	Anodyne	ADRB1	47	41
Cc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819409063	DG	On-Demand	Anodyne	GRIN1	18	40
Cc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819409063	DG	On-Demand	Anodyne	ADRB3	25	40
COCCOc1ccc(NC[C@@H](O)COC)cc1	ZINC000819409064	CD	On-Demand	Anodyne	ADRB2	44	48
COCCOc1ccc(NC[C@@H](O)COC)cc1	ZINC000819409064	CD	On-Demand	Anodyne	ADRB1	60	48
COCCOc1ccc(NC[C@@H](O)COC)cc1	ZINC000819409064	CD	On-Demand	Anodyne	ADRB3	31	40
COCCOc1ccc(NC[C@H](O)COC)cc1	ZINC000819409065	CD	On-Demand	Anodyne	ADRB2	44	48
COCCOc1ccc(NC[C@H](O)COC)cc1	ZINC000819409065	CD	On-Demand	Anodyne	ADRB1	60	48
COCCOc1ccc(NC[C@H](O)COC)cc1	ZINC000819409065	CD	On-Demand	Anodyne	ADRB3	31	40
O=C(CCNc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1	ZINC000819409086	EG	On-Demand	Anodyne	PRNP	39	40
O=C(CCNc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1	ZINC000819409086	EG	On-Demand	Anodyne	HDAC10	27	40
O=C(CCNc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1	ZINC000819409086	EG	On-Demand	Anodyne	HDAC2	17	40
O=C(CCNc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1	ZINC000819409086	EG	On-Demand	Anodyne	HDAC3	22	40
O=C(CCNc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1	ZINC000819409086	EG	On-Demand	Anodyne	HDAC6	24	40
O=C(CCNc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1	ZINC000819409086	EG	On-Demand	Anodyne	HDAC11	16	40
O=C(CCNc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1	ZINC000819409086	EG	On-Demand	Anodyne	STAT6	21	42
COCCOc1ccc(NC[C@H](O)COC2CCOCC2)cc1	ZINC000819409090	ED	On-Demand	Anodyne	ADRB1	36	46
COCCOc1ccc(NC[C@@H](O)COC2CCOCC2)cc1	ZINC000819409091	ED	On-Demand	Anodyne	ADRB1	36	46
COCCOc1ccc(NCCC(=O)Nc2cccnc2)cc1	ZINC000819409094	DF	On-Demand	Anodyne	LTA4H	28	41
COCCOc1ccc(NCCC(=O)Nc2cccnc2)cc1	ZINC000819409094	DF	On-Demand	Anodyne	FAAH	19	41
COCCOc1ccc(NCCC(=O)Nc2cccnc2)cc1	ZINC000819409094	DF	On-Demand	Anodyne	NAMPT	17	44
OC1CCN(c2ccc(NC[C@@H](O)Cc3ccccc3C(F)(F)F)cc2)CC1	ZINC000819409097	GH	On-Demand	Anodyne	STAT6	22	41
OC1CCN(c2ccc(NC[C@H](O)Cc3ccccc3C(F)(F)F)cc2)CC1	ZINC000819409098	GH	On-Demand	Anodyne	STAT6	22	41
COCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819409100	CF	On-Demand	Anodyne	ADRB2	36	50
COCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819409100	CF	On-Demand	Anodyne	ADRB1	44	43
COCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819409100	CF	On-Demand	Anodyne	ADRB3	46	43
COCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819409100	CF	On-Demand	Anodyne	LTA4H	40	44
COCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819409100	CF	On-Demand	Anodyne	FAAH	18	46
COCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819409100	CF	On-Demand	Anodyne	AOC3	21	41
COCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819409101	CF	On-Demand	Anodyne	ADRB2	36	50
COCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819409101	CF	On-Demand	Anodyne	ADRB1	44	43
COCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819409101	CF	On-Demand	Anodyne	ADRB3	46	43
COCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819409101	CF	On-Demand	Anodyne	LTA4H	40	44
COCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819409101	CF	On-Demand	Anodyne	FAAH	18	46
COCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819409101	CF	On-Demand	Anodyne	AOC3	21	41
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819409102	GE	On-Demand	Anodyne	ADRB3	18	43
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819409102	GE	On-Demand	Anodyne	GPR119	23	47
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819409103	GE	On-Demand	Anodyne	ADRB3	18	43
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819409103	GE	On-Demand	Anodyne	GPR119	23	47
COCCOc1ccc(NCC2(O)CCOCC2)cc1	ZINC000819409104	CD	On-Demand	Anodyne	MMP13	15	41
COCCOc1ccc(NCCC(=O)Nc2ccc(Cl)cc2)cc1	ZINC000819409111	EH	On-Demand	Anodyne	LTA4H	33	42
COCCOc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819409112	EG	On-Demand	Anodyne	ADRB2	21	44
COCCOc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819409112	EG	On-Demand	Anodyne	ADRB1	50	44
COCCOc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819409112	EG	On-Demand	Anodyne	MAOB	28	53
COCCOc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819409112	EG	On-Demand	Anodyne	GRIN1	21	47
COCCOc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819409112	EG	On-Demand	Anodyne	ADRB3	37	44
COCCOc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819409112	EG	On-Demand	Anodyne	CTSL	19	46
COCCOc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819409112	EG	On-Demand	Anodyne	PDS	61	38
COCCOc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819409113	EG	On-Demand	Anodyne	ADRB2	21	44
COCCOc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819409113	EG	On-Demand	Anodyne	ADRB1	50	44
COCCOc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819409113	EG	On-Demand	Anodyne	MAOB	28	53
COCCOc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819409113	EG	On-Demand	Anodyne	GRIN1	21	47
COCCOc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819409113	EG	On-Demand	Anodyne	ADRB3	37	44
COCCOc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819409113	EG	On-Demand	Anodyne	CTSL	19	46
COCCOc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819409113	EG	On-Demand	Anodyne	PDS	61	38
COCCOc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819409116	EF	On-Demand	Bother	CACNA1C	59	41
COCCOc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819409116	EF	On-Demand	Bother	CACNA1D	92	41
COCCOc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819409117	EF	On-Demand	Bother	CACNA1C	59	41
COCCOc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819409117	EF	On-Demand	Bother	CACNA1D	92	41
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819409128	FG	On-Demand	Anodyne	ADRB2	44	45
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819409128	FG	On-Demand	Anodyne	ADRB1	69	46
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819409128	FG	On-Demand	Anodyne	GRIN1	28	43
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819409128	FG	On-Demand	Anodyne	ADRB3	46	45
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819409129	FG	On-Demand	Anodyne	ADRB2	44	45
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819409129	FG	On-Demand	Anodyne	ADRB1	69	46
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819409129	FG	On-Demand	Anodyne	GRIN1	28	43
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(N(C)C)c(C)c2)cc1	ZINC000819409129	FG	On-Demand	Anodyne	ADRB3	46	45
COCCOc1ccc(NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000819409131	FH	On-Demand	Anodyne	ADRB1	30	43
COCCOc1ccc(NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000819409131	FH	On-Demand	Anodyne	PPARG	18	41
COCCOc1ccc(NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000819409131	FH	On-Demand	Anodyne	PPARA	26	40
COCCOc1ccc(NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000819409131	FH	On-Demand	Anodyne	PPARD	38	41
COCCOc1ccc(NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000819409132	FH	On-Demand	Anodyne	ADRB1	30	43
COCCOc1ccc(NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000819409132	FH	On-Demand	Anodyne	PPARG	18	41
COCCOc1ccc(NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000819409132	FH	On-Demand	Anodyne	PPARA	26	40
COCCOc1ccc(NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000819409132	FH	On-Demand	Anodyne	PPARD	38	41
O=S(=O)(CCNc1ccc(N2CCC(O)CC2)cc1)c1ccccc1	ZINC000819409137	FF	On-Demand	Anodyne	SFRP1	28	40
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c(C)c1	ZINC000819409147	FG	On-Demand	Anodyne	ADRB2	15	42
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c(C)c1	ZINC000819409148	FG	On-Demand	Anodyne	ADRB2	15	42
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819409151	GE	On-Demand	Anodyne	ADRB2	46	55
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819409151	GE	On-Demand	Anodyne	ADRB1	78	55
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819409151	GE	On-Demand	Anodyne	ADRB3	55	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819409152	GE	On-Demand	Anodyne	ADRB2	46	55
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819409152	GE	On-Demand	Anodyne	ADRB1	78	55
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819409152	GE	On-Demand	Anodyne	ADRB3	55	48
CCOC(=O)Nc1ccc(NC[C@@H](C)O)cc1	ZINC000819409164	BE	On-Demand	Anodyne	ACR	53	35
CCOC(=O)Nc1ccc(NCCS(=O)(=O)CC)cc1	ZINC000819409168	DE	On-Demand	Anodyne	CA2	22	40
CCOC(=O)Nc1ccc(NCCS(=O)(=O)CC)cc1	ZINC000819409168	DE	On-Demand	Anodyne	CA1	39	40
CCOC(=O)Nc1ccc(NCCS(=O)(=O)CC)cc1	ZINC000819409168	DE	On-Demand	Anodyne	PTPRB	40	37
CCOC(=O)Nc1ccc(NCCS(=O)(=O)CC)cc1	ZINC000819409168	DE	On-Demand	Anodyne	CA12	30	40
CCOC(=O)Nc1ccc(NCCS(=O)(=O)CC)cc1	ZINC000819409168	DE	On-Demand	Anodyne	CA9	31	40
C[C@@H](CC(=O)N1CCN(C(=O)OCc2ccccc2)CC1)n1cccn1	ZINC000819409212	FE	On-Demand	Anodyne	GRIN2B	24	46
C[C@@H](CC(=O)N1CCN(C(=O)OCc2ccccc2)CC1)n1cccn1	ZINC000819409212	FE	On-Demand	Anodyne	PTAFR	27	43
C[C@@H](CC(=O)N1CCN(C(=O)OCc2ccccc2)CC1)n1cccn1	ZINC000819409212	FE	On-Demand	Anodyne	TGM2	44	42
C[C@@H](CC(=O)N1CCN(C(=O)OCc2ccccc2)CC1)n1cccn1	ZINC000819409212	FE	On-Demand	Anodyne	F13A1	45	41
C[C@@H](CC(=O)N1CCN(C(=O)OCc2ccccc2)CC1)n1cccn1	ZINC000819409212	FE	On-Demand	Anodyne	SLC12A5	63	37
C=CCC1(C(=O)N2CCN(C(=O)OCc3ccccc3)CC2)CCOCC1	ZINC000819409238	FF	On-Demand	Mild	GRIN2B	20	43
C=CCC1(C(=O)N2CCN(C(=O)OCc3ccccc3)CC2)CCOCC1	ZINC000819409238	FF	On-Demand	Mild	PREP	22	40
C=CCC1(C(=O)N2CCN(C(=O)OCc3ccccc3)CC2)CCOCC1	ZINC000819409238	FF	On-Demand	Mild	TGM2	50	45
C=CCC1(C(=O)N2CCN(C(=O)OCc3ccccc3)CC2)CCOCC1	ZINC000819409238	FF	On-Demand	Mild	F13A1	54	45
C=CCC1(C(=O)N2CCN(C(=O)OCc3ccccc3)CC2)CCOCC1	ZINC000819409238	FF	On-Demand	Mild	SLC12A5	64	37
COCc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819409241	GE	On-Demand	Clean	HTR2A	15	45
COCc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819409241	GE	On-Demand	Clean	ABCB1	48	41
COCc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819409243	GE	On-Demand	Clean	HTR2A	15	45
COCc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819409243	GE	On-Demand	Clean	ABCB1	48	41
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819409246	GG	On-Demand	Bother	ADRB2	30	49
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819409246	GG	On-Demand	Bother	ADRB1	45	50
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819409246	GG	On-Demand	Bother	CACNA1C	52	38
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819409246	GG	On-Demand	Bother	ADRB3	28	50
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819409246	GG	On-Demand	Bother	CACNA1D	86	35
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819409246	GG	On-Demand	Bother	PDS	65	50
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819409248	GG	On-Demand	Bother	ADRB2	30	49
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819409248	GG	On-Demand	Bother	ADRB1	45	50
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819409248	GG	On-Demand	Bother	CACNA1C	52	38
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819409248	GG	On-Demand	Bother	ADRB3	28	50
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819409248	GG	On-Demand	Bother	CACNA1D	86	35
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819409248	GG	On-Demand	Bother	PDS	65	50
O[C@@H](CNc1cccc(OC(F)F)c1)c1cccc(C(F)(F)F)c1	ZINC000819409266	EI	On-Demand	Anodyne	PDS	42	40
O[C@H](CNc1cccc(OC(F)F)c1)c1cccc(C(F)(F)F)c1	ZINC000819409268	EI	On-Demand	Anodyne	PDS	42	40
COCc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819409270	CE	On-Demand	Anodyne	ADRB1	19	43
COCc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819409270	CE	On-Demand	Anodyne	ADRB3	61	43
COCc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819409271	CE	On-Demand	Anodyne	ADRB1	19	43
COCc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819409271	CE	On-Demand	Anodyne	ADRB3	61	43
C=C(C)C(C)(C)C(=O)NNc1ccc(Br)cc1	ZINC000819409285	CG	On-Demand	Reactive	IDO1	18	40
CCOC(=O)Nc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819409288	FI	On-Demand	Anodyne	ACR	20	41
CCOC(=O)Nc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819409292	FI	On-Demand	Anodyne	ACR	20	41
COCCc1ccc(OC[C@@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409293	EF	On-Demand	Anodyne	ADRB2	46	58
COCCc1ccc(OC[C@@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409293	EF	On-Demand	Anodyne	ADRB1	72	58
COCCc1ccc(OC[C@@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409293	EF	On-Demand	Anodyne	GRIN1	28	44
COCCc1ccc(OC[C@@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409293	EF	On-Demand	Anodyne	ADRB3	47	45
COCCc1ccc(OC[C@@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409293	EF	On-Demand	Anodyne	DRTS_TRYCR	43	30
COCCc1ccc(OC[C@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409295	EF	On-Demand	Anodyne	ADRB2	46	58
COCCc1ccc(OC[C@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409295	EF	On-Demand	Anodyne	ADRB1	72	58
COCCc1ccc(OC[C@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409295	EF	On-Demand	Anodyne	GRIN1	28	44
COCCc1ccc(OC[C@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409295	EF	On-Demand	Anodyne	ADRB3	47	45
COCCc1ccc(OC[C@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409295	EF	On-Demand	Anodyne	DRTS_TRYCR	43	30
Cc1ccccc1[C@@H](O)CNc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	ZINC000819409318	FH	On-Demand	Anodyne	NPY2R	44	32
C#CCNC(=O)CCNc1ccc(N2CCCN(C)CC2)cc1	ZINC000819409361	DD	On-Demand	Mild	LCK	17	41
C#CCNC(=O)CCNc1ccc(N2CCCN(C)CC2)cc1	ZINC000819409361	DD	On-Demand	Mild	HCK	16	41
O[C@H](CCc1ccccc1)CNc1ccc(OC[C@@H]2CCCO2)cc1	ZINC000819409362	EH	On-Demand	Anodyne	ADRB1	28	43
O[C@@H](CCc1ccccc1)CNc1ccc(OC[C@@H]2CCCO2)cc1	ZINC000819409363	EH	On-Demand	Anodyne	ADRB1	28	43
O[C@@H](CCc1ccccc1)CNc1ccc(OC[C@H]2CCCO2)cc1	ZINC000819409364	EH	On-Demand	Anodyne	ADRB1	28	43
O[C@H](CCc1ccccc1)CNc1ccc(OC[C@H]2CCCO2)cc1	ZINC000819409365	EH	On-Demand	Anodyne	ADRB1	28	43
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)cc1	ZINC000819409370	FF	On-Demand	Mild	ADRB1	39	46
N#Cc1ccc(OC[C@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)cc1	ZINC000819409371	FF	On-Demand	Mild	ADRB1	39	46
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)cc1	ZINC000819409372	FF	On-Demand	Mild	ADRB1	39	46
N#Cc1ccc(OC[C@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)cc1	ZINC000819409373	FF	On-Demand	Mild	ADRB1	39	46
CN1CCCN(c2ccc(NCCC(=O)NC(N)=O)cc2)CC1	ZINC000819409374	DC	On-Demand	Anodyne	PRNP	37	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NNc1ccc(OC(F)(F)F)cc1)C2	ZINC000819409382	GF	On-Demand	Reactive	P2RY1	46	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NNc1ccc(OC(F)(F)F)cc1)C2	ZINC000819409383	GF	On-Demand	Reactive	P2RY1	46	38
CSc1ccc(OC[C@@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)cc1	ZINC000819409390	GH	On-Demand	Anodyne	ADRB1	40	47
CSc1ccc(OC[C@@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)cc1	ZINC000819409391	GH	On-Demand	Anodyne	ADRB1	40	47
CSc1ccc(OC[C@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)cc1	ZINC000819409392	GH	On-Demand	Anodyne	ADRB1	40	47
CSc1ccc(OC[C@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)cc1	ZINC000819409393	GH	On-Demand	Anodyne	ADRB1	40	47
CN1CCCN(c2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2)CC1	ZINC000819409394	FF	On-Demand	Anodyne	ADRB1	43	38
CN1CCCN(c2ccc(NC[C@@H](O)COc3ccc(F)cc3)cc2)CC1	ZINC000819409395	FF	On-Demand	Anodyne	ADRB1	43	38
CN1CCCN(c2ccc(NC[C@@H](O)Cc3cccc(Cl)c3)cc2)CC1	ZINC000819409404	FG	On-Demand	Anodyne	HRH4	16	41
CN1CCCN(c2ccc(NC[C@H](O)Cc3cccc(Cl)c3)cc2)CC1	ZINC000819409405	FG	On-Demand	Anodyne	HRH4	16	41
C=C(C)C(C)(C)C(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000819409417	FG	On-Demand	Reactive	IDO1	31	40
COc1cc(NC[C@@H](O)Cc2ccc(F)cc2)ccc1NC(=O)OC(C)(C)C	ZINC000819409443	GI	On-Demand	Anodyne	PAPA1_CARPA	23	43
COc1cc(NC[C@@H](O)Cc2ccc(F)cc2)ccc1NC(=O)OC(C)(C)C	ZINC000819409443	GI	On-Demand	Anodyne	DRTS_TRYCR	44	31
COc1cc(NC[C@H](O)Cc2ccc(F)cc2)ccc1NC(=O)OC(C)(C)C	ZINC000819409444	GI	On-Demand	Anodyne	PAPA1_CARPA	23	43
COc1cc(NC[C@H](O)Cc2ccc(F)cc2)ccc1NC(=O)OC(C)(C)C	ZINC000819409444	GI	On-Demand	Anodyne	DRTS_TRYCR	44	31
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(OC[C@@H]2CCCO2)cc1	ZINC000819409484	GG	On-Demand	Bother	ADRB1	49	35
O=C(CCNc1ccc(N2CCC(O)CC2)cc1)Nc1cccc(Cl)c1	ZINC000819409485	FH	On-Demand	Anodyne	MAPK1	18	40
O=C(CCNc1ccc(N2CCC(O)CC2)cc1)Nc1cccc(Cl)c1	ZINC000819409485	FH	On-Demand	Anodyne	MCHR1	40	41
N#CCc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819409498	GF	On-Demand	Mild	ADRB1	57	41
N#CCc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819409498	GF	On-Demand	Mild	ADRB3	42	47
N#CCc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819409499	GF	On-Demand	Mild	ADRB1	57	41
N#CCc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000819409499	GF	On-Demand	Mild	ADRB3	42	47
CC[C@H](O)CNc1ccc(OCCOC)cc1	ZINC000819409503	BD	On-Demand	Anodyne	ADRB2	16	41
CC[C@H](O)CNc1ccc(OCCOC)cc1	ZINC000819409503	BD	On-Demand	Anodyne	ADRB1	29	41
OC1CCN(c2ccc(NC[C@@H](O)c3ccc(F)cn3)cc2)CC1	ZINC000819409514	EE	On-Demand	Anodyne	STAT6	42	32
OC1CCN(c2ccc(NC[C@H](O)c3ccc(F)cn3)cc2)CC1	ZINC000819409515	EE	On-Demand	Anodyne	STAT6	42	32
COCCOc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819409516	GG	On-Demand	Anodyne	MMP13	23	47
COCCOc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819409516	GG	On-Demand	Anodyne	EPHX2	15	44
COCCOc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819409516	GG	On-Demand	Anodyne	GPR119	56	46
COCCOc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819409517	GG	On-Demand	Anodyne	MMP13	23	47
COCCOc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819409517	GG	On-Demand	Anodyne	EPHX2	15	44
COCCOc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819409517	GG	On-Demand	Anodyne	GPR119	56	46
OC1CCN(c2ccc(NC[C@H](O)c3cccc(Br)c3)cc2)CC1	ZINC000819409518	GH	On-Demand	Anodyne	IGF1R	23	40
OC1CCN(c2ccc(NC[C@H](O)c3cccc(Br)c3)cc2)CC1	ZINC000819409518	GH	On-Demand	Anodyne	CYP3A4	46	40
OC1CCN(c2ccc(NC[C@@H](O)c3cccc(Br)c3)cc2)CC1	ZINC000819409519	GH	On-Demand	Anodyne	IGF1R	23	40
OC1CCN(c2ccc(NC[C@@H](O)c3cccc(Br)c3)cc2)CC1	ZINC000819409519	GH	On-Demand	Anodyne	CYP3A4	46	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819409522	GE	On-Demand	Bother	ADRB2	16	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819409522	GE	On-Demand	Bother	ADRB1	24	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819409522	GE	On-Demand	Bother	ADRB3	20	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819409523	GE	On-Demand	Bother	ADRB2	16	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819409523	GE	On-Demand	Bother	ADRB1	24	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000819409523	GE	On-Demand	Bother	ADRB3	20	43
OC1CCN(c2ccc(NC[C@@H](O)COc3ccc4ccccc4c3)cc2)CC1	ZINC000819409524	GH	On-Demand	Anodyne	ADRB2	39	50
OC1CCN(c2ccc(NC[C@@H](O)COc3ccc4ccccc4c3)cc2)CC1	ZINC000819409524	GH	On-Demand	Anodyne	ADRB1	52	38
OC1CCN(c2ccc(NC[C@@H](O)COc3ccc4ccccc4c3)cc2)CC1	ZINC000819409524	GH	On-Demand	Anodyne	ADRB3	38	41
OC1CCN(c2ccc(NC[C@H](O)COc3ccc4ccccc4c3)cc2)CC1	ZINC000819409525	GH	On-Demand	Anodyne	ADRB2	39	50
OC1CCN(c2ccc(NC[C@H](O)COc3ccc4ccccc4c3)cc2)CC1	ZINC000819409525	GH	On-Demand	Anodyne	ADRB1	52	38
OC1CCN(c2ccc(NC[C@H](O)COc3ccc4ccccc4c3)cc2)CC1	ZINC000819409525	GH	On-Demand	Anodyne	ADRB3	38	41
O=C(CCNc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1F	ZINC000819409528	FG	On-Demand	Anodyne	DGAT1	15	42
COCCOc1ccc(NC[C@@H](O)c2ccc(C)cc2)cc1	ZINC000819409531	DG	On-Demand	Anodyne	ADRB2	23	44
COCCOc1ccc(NC[C@H](O)c2ccc(C)cc2)cc1	ZINC000819409532	DG	On-Demand	Anodyne	ADRB2	23	44
OC1CCN(c2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819409552	EG	On-Demand	Anodyne	ADRB1	29	46
OC1CCN(c2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819409552	EG	On-Demand	Anodyne	ADRB3	47	41
OC1CCN(c2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819409552	EG	On-Demand	Anodyne	IGF1R	34	51
OC1CCN(c2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819409552	EG	On-Demand	Anodyne	CYP3A4	60	51
OC1CCN(c2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819409553	EG	On-Demand	Anodyne	ADRB1	29	46
OC1CCN(c2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819409553	EG	On-Demand	Anodyne	ADRB3	47	41
OC1CCN(c2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819409553	EG	On-Demand	Anodyne	IGF1R	34	51
OC1CCN(c2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819409553	EG	On-Demand	Anodyne	CYP3A4	60	51
O=C(/C=C\[C@H]1CCCO1)Nc1cc(Cl)ccc1O	ZINC000819409563	CF	On-Demand	Anodyne	KCNMA1	24	43
O=C(/C=C/[C@H]1CCCO1)Nc1cc(Cl)ccc1O	ZINC000819409564	CF	On-Demand	Anodyne	KCNMA1	24	43
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(Cl)ccc1O	ZINC000819409565	CF	On-Demand	Anodyne	KCNMA1	24	43
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(Cl)ccc1O	ZINC000819409566	CF	On-Demand	Anodyne	KCNMA1	24	43
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409575	EG	On-Demand	Anodyne	ADRB2	45	41
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409575	EG	On-Demand	Anodyne	ADRB1	57	41
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409575	EG	On-Demand	Anodyne	GRIN1	20	41
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409576	EG	On-Demand	Anodyne	ADRB2	45	41
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409576	EG	On-Demand	Anodyne	ADRB1	57	41
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409576	EG	On-Demand	Anodyne	GRIN1	20	41
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409581	EE	On-Demand	Anodyne	ADRB2	48	45
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409581	EE	On-Demand	Anodyne	ADRB1	76	45
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409581	EE	On-Demand	Anodyne	GRIN1	23	43
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409581	EE	On-Demand	Anodyne	ADRB3	44	45
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409581	EE	On-Demand	Anodyne	ACR	42	34
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409582	EE	On-Demand	Anodyne	ADRB2	48	45
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409582	EE	On-Demand	Anodyne	ADRB1	76	45
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409582	EE	On-Demand	Anodyne	GRIN1	23	43
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409582	EE	On-Demand	Anodyne	ADRB3	44	45
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC)c(F)c2)cc1	ZINC000819409582	EE	On-Demand	Anodyne	ACR	42	34
COc1cc(NC[C@H](O)c2cccnc2)ccc1NC(=O)OC(C)(C)C	ZINC000819409583	FH	On-Demand	Anodyne	ADRB1	24	42
COc1cc(NC[C@H](O)c2cccnc2)ccc1NC(=O)OC(C)(C)C	ZINC000819409583	FH	On-Demand	Anodyne	ADRB3	87	42
COc1cc(NC[C@@H](O)c2cccnc2)ccc1NC(=O)OC(C)(C)C	ZINC000819409584	FH	On-Demand	Anodyne	ADRB1	24	42
COc1cc(NC[C@@H](O)c2cccnc2)ccc1NC(=O)OC(C)(C)C	ZINC000819409584	FH	On-Demand	Anodyne	ADRB3	87	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cc(Cl)ccc1O	ZINC000819409599	EF	On-Demand	Anodyne	KCNMA1	25	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2)c1	ZINC000819409602	EH	On-Demand	Anodyne	ADRB2	53	49
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2)c1	ZINC000819409602	EH	On-Demand	Anodyne	ADRB1	70	46
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2)c1	ZINC000819409602	EH	On-Demand	Anodyne	ADRB3	43	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2)c1	ZINC000819409602	EH	On-Demand	Anodyne	ABCB1	21	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2)c1	ZINC000819409602	EH	On-Demand	Anodyne	PDS	69	38
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2)c1	ZINC000819409603	EH	On-Demand	Anodyne	ADRB2	53	49
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2)c1	ZINC000819409603	EH	On-Demand	Anodyne	ADRB1	70	46
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2)c1	ZINC000819409603	EH	On-Demand	Anodyne	ADRB3	43	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2)c1	ZINC000819409603	EH	On-Demand	Anodyne	ABCB1	21	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2)c1	ZINC000819409603	EH	On-Demand	Anodyne	PDS	69	38
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc(OC(C)C)cc1	ZINC000819409616	FG	On-Demand	Anodyne	ADRB2	47	42
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc(OC(C)C)cc1	ZINC000819409616	FG	On-Demand	Anodyne	ADRB1	49	42
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc(OC(C)C)cc1	ZINC000819409616	FG	On-Demand	Anodyne	ADRB3	24	42
COc1cccc(OC)c1OC[C@H](O)CNc1ccc(OC(C)C)cc1	ZINC000819409617	FG	On-Demand	Anodyne	ADRB2	47	42
COc1cccc(OC)c1OC[C@H](O)CNc1ccc(OC(C)C)cc1	ZINC000819409617	FG	On-Demand	Anodyne	ADRB1	49	42
COc1cccc(OC)c1OC[C@H](O)CNc1ccc(OC(C)C)cc1	ZINC000819409617	FG	On-Demand	Anodyne	ADRB3	24	42
CN(C[C@@H](O)CNc1cccc(NC(=O)c2ccccc2)c1)C(=O)OC(C)(C)C	ZINC000819409620	GH	On-Demand	Anodyne	KCNK3	132	48
CN(C[C@@H](O)CNc1cccc(NC(=O)c2ccccc2)c1)C(=O)OC(C)(C)C	ZINC000819409620	GH	On-Demand	Anodyne	KCNK9	87	44
CN(C[C@H](O)CNc1cccc(NC(=O)c2ccccc2)c1)C(=O)OC(C)(C)C	ZINC000819409621	GH	On-Demand	Anodyne	KCNK3	132	48
CN(C[C@H](O)CNc1cccc(NC(=O)c2ccccc2)c1)C(=O)OC(C)(C)C	ZINC000819409621	GH	On-Demand	Anodyne	KCNK9	87	44
CCOC[C@H](O)CNc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	ZINC000819409630	EE	On-Demand	Anodyne	NPY2R	50	32
CCOC[C@H](O)CNc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	ZINC000819409631	EE	On-Demand	Anodyne	NPY2R	50	32
CCOC[C@H](O)CNc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	ZINC000819409632	EE	On-Demand	Anodyne	NPY2R	50	32
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819409645	FG	On-Demand	Anodyne	ADRB2	59	70
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819409645	FG	On-Demand	Anodyne	ADRB1	83	70
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819409645	FG	On-Demand	Anodyne	ADRB3	51	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819409645	FG	On-Demand	Anodyne	ACACB	33	42
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819409647	FG	On-Demand	Anodyne	ADRB2	59	70
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819409647	FG	On-Demand	Anodyne	ADRB1	83	70
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819409647	FG	On-Demand	Anodyne	ADRB3	51	56
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819409647	FG	On-Demand	Anodyne	ACACB	33	42
CCOC(=O)Nc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819409699	FI	On-Demand	Anodyne	SLC1A1	20	40
CCOC(=O)Nc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819409699	FI	On-Demand	Anodyne	SLC1A3	18	40
CCOC(=O)Nc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819409699	FI	On-Demand	Anodyne	ACR	20	43
CCOC(=O)Nc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819409699	FI	On-Demand	Anodyne	SLC1A2	32	40
CCOC(=O)Nc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819409699	FI	On-Demand	Anodyne	PDS	44	46
CCOC(=O)Nc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819409700	FI	On-Demand	Anodyne	SLC1A1	20	40
CCOC(=O)Nc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819409700	FI	On-Demand	Anodyne	SLC1A3	18	40
CCOC(=O)Nc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819409700	FI	On-Demand	Anodyne	ACR	20	43
CCOC(=O)Nc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819409700	FI	On-Demand	Anodyne	SLC1A2	32	40
CCOC(=O)Nc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819409700	FI	On-Demand	Anodyne	PDS	44	46
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cccnc1Cl	ZINC000819409707	HJ	On-Demand	Anodyne	EPHB3	46	35
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cccnc1Cl	ZINC000819409707	HJ	On-Demand	Anodyne	G2YM83_BOTF4	82	43
CC(C)[C@H]1CN(C(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)CCCO1	ZINC000819409709	HG	On-Demand	Anodyne	CNR2	18	63
CC(C)[C@H]1CN(C(=O)c2ccc(Cl)c(S(=O)(=O)N3CCCC3)c2)CCCO1	ZINC000819409709	HG	On-Demand	Anodyne	L3MBTL3	54	37
O=C(C(F)=C1CCC1)N(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000819409727	DG	On-Demand	Bother	COLA	123	39
CCOC(=O)Nc1ccc(NC[C@@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819409734	GH	On-Demand	Anodyne	ADRB1	22	43
CCOC(=O)Nc1ccc(NC[C@@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819409734	GH	On-Demand	Anodyne	ADRB3	15	43
CCOC(=O)Nc1ccc(NC[C@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819409735	GH	On-Demand	Anodyne	ADRB1	22	43
CCOC(=O)Nc1ccc(NC[C@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819409735	GH	On-Demand	Anodyne	ADRB3	15	43
COc1cccc(C2=NO[C@@H](C(=O)N3CCCO[C@H](C(C)C)C3)C2)c1	ZINC000819409751	EE	On-Demand	Anodyne	LUCI_PHOPY	16	41
COc1cccc(C2=NO[C@@H](C(=O)N3CCCO[C@@H](C(C)C)C3)C2)c1	ZINC000819409753	EE	On-Demand	Anodyne	LUCI_PHOPY	16	41
COc1cccc(C2=NO[C@H](C(=O)N3CCCO[C@H](C(C)C)C3)C2)c1	ZINC000819409755	EE	On-Demand	Anodyne	LUCI_PHOPY	16	41
COc1cccc(C2=NO[C@H](C(=O)N3CCCO[C@@H](C(C)C)C3)C2)c1	ZINC000819409757	EE	On-Demand	Anodyne	LUCI_PHOPY	16	41
CC(C)[C@H]1CN(C(=O)C(C)(C)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819409770	HJ	On-Demand	Anodyne	PGC	41	32
CC(C)[C@H]1CN(C(=O)C(C)(C)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819409770	HJ	On-Demand	Anodyne	REN	41	35
CC(C)[C@H]1CN(C(=O)C(C)(C)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819409770	HJ	On-Demand	Anodyne	FPR1	46	36
CC(C)[C@H]1CN(C(=O)C(C)(C)[C@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819409774	HJ	On-Demand	Anodyne	PGC	41	32
CC(C)[C@H]1CN(C(=O)C(C)(C)[C@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819409774	HJ	On-Demand	Anodyne	REN	41	35
CC(C)[C@H]1CN(C(=O)C(C)(C)[C@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819409774	HJ	On-Demand	Anodyne	FPR1	46	36
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819409779	GI	On-Demand	Anodyne	ADRB2	31	45
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819409779	GI	On-Demand	Anodyne	ADRB1	47	42
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819409779	GI	On-Demand	Anodyne	ADRB3	27	42
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819409779	GI	On-Demand	Anodyne	P2RY1	15	41
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819409779	GI	On-Demand	Anodyne	ACR	28	47
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819409779	GI	On-Demand	Anodyne	PDS	90	60
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819409781	GI	On-Demand	Anodyne	ADRB2	31	45
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819409781	GI	On-Demand	Anodyne	ADRB1	47	42
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819409781	GI	On-Demand	Anodyne	ADRB3	27	42
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819409781	GI	On-Demand	Anodyne	P2RY1	15	41
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819409781	GI	On-Demand	Anodyne	ACR	28	47
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819409781	GI	On-Demand	Anodyne	PDS	90	60
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819409796	FH	On-Demand	Anodyne	ADRB2	48	51
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819409796	FH	On-Demand	Anodyne	ADRB1	74	51
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819409796	FH	On-Demand	Anodyne	GRIN1	26	46
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819409796	FH	On-Demand	Anodyne	ADRB3	45	51
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819409796	FH	On-Demand	Anodyne	ACR	28	40
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819409796	FH	On-Demand	Anodyne	PDS	49	36
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819409799	FH	On-Demand	Anodyne	ADRB2	48	51
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819409799	FH	On-Demand	Anodyne	ADRB1	74	51
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819409799	FH	On-Demand	Anodyne	GRIN1	26	46
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819409799	FH	On-Demand	Anodyne	ADRB3	45	51
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819409799	FH	On-Demand	Anodyne	ACR	28	40
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819409799	FH	On-Demand	Anodyne	PDS	49	36
CC(C)[C@H]1CN(C(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819409804	FF	On-Demand	Anodyne	GRIN2B	24	41
CC(C)[C@H]1CN(C(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819409804	FF	On-Demand	Anodyne	CTSB	15	40
CC(C)[C@H]1CN(C(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819409804	FF	On-Demand	Anodyne	CTSK	22	41
CC(C)[C@H]1CN(C(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819409804	FF	On-Demand	Anodyne	CTSL	22	41
CC(C)[C@H]1CN(C(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819409804	FF	On-Demand	Anodyne	PREP	56	48
CC(C)[C@H]1CN(C(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819409804	FF	On-Demand	Anodyne	DPP7	49	38
CC(C)[C@H]1CN(C(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819409804	FF	On-Demand	Anodyne	KLK5	40	37
CC(C)[C@H]1CN(C(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819409804	FF	On-Demand	Anodyne	BIRC2	17	48
CC(C)[C@H]1CN(C(=O)[C@H]2CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819409804	FF	On-Demand	Anodyne	SLC12A5	60	38
CC(C)[C@H]1CN(C(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819409806	FF	On-Demand	Anodyne	GRIN2B	24	41
CC(C)[C@H]1CN(C(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819409806	FF	On-Demand	Anodyne	CTSB	15	40
CC(C)[C@H]1CN(C(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819409806	FF	On-Demand	Anodyne	CTSK	22	41
CC(C)[C@H]1CN(C(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819409806	FF	On-Demand	Anodyne	CTSL	22	41
CC(C)[C@H]1CN(C(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819409806	FF	On-Demand	Anodyne	PREP	56	48
CC(C)[C@H]1CN(C(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819409806	FF	On-Demand	Anodyne	DPP7	49	38
CC(C)[C@H]1CN(C(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819409806	FF	On-Demand	Anodyne	KLK5	40	37
CC(C)[C@H]1CN(C(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819409806	FF	On-Demand	Anodyne	BIRC2	17	48
CC(C)[C@H]1CN(C(=O)[C@@H]2CCN(C(=O)OCc3ccccc3)C2)CCCO1	ZINC000819409806	FF	On-Demand	Anodyne	SLC12A5	60	38
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819409809	FF	On-Demand	Mild	ADRB2	43	49
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819409809	FF	On-Demand	Mild	ADRB1	69	49
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819409809	FF	On-Demand	Mild	ADRB3	38	49
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819409809	FF	On-Demand	Mild	CTRB_BOVIN	44	32
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819409811	FF	On-Demand	Mild	ADRB2	43	49
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819409811	FF	On-Demand	Mild	ADRB1	69	49
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819409811	FF	On-Demand	Mild	ADRB3	38	49
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819409811	FF	On-Demand	Mild	CTRB_BOVIN	44	32
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(OC[C@H]2CCCO2)cc1	ZINC000819409815	GG	On-Demand	Bother	ADRB1	49	35
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(OC[C@H]2CCCO2)cc1	ZINC000819409817	GG	On-Demand	Bother	ADRB1	49	35
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(OC[C@@H]2CCCO2)cc1	ZINC000819409819	GG	On-Demand	Bother	ADRB1	49	35
CC(C)[C@H]1CN(C(=O)c2cc(S(C)(=O)=O)ccc2Br)CCCO1	ZINC000819409836	HF	On-Demand	Anodyne	SLC6A9	42	40
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	F2	45	45
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	PLG	39	44
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	ACE	97	46
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	OPRM1	59	40
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	OPRD1	52	39
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	GHRHR	59	33
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	P2RY12	89	36
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	ELANE	33	43
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	MME	94	41
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	ANPEP	47	35
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	TACR1	26	50
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	PGC	52	31
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	MC4R	74	43
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	CMA1	43	43
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	CTRA_BOVIN	81	44
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	FCER2	53	32
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	CASP3	17	44
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	BMP1	20	41
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	KLK3	89	41
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	CTSB	89	50
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	TRY2_BOVIN	93	36
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	PAPA1_CARPA	91	45
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	TRY1_BOVIN	62	44
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	CYSP_TRYCR	76	50
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	CCKAR	21	44
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	NTSR1	54	35
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	CTSG	54	44
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	CTSK	73	54
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	CTSL	64	54
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	CACNA1B	50	46
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	CCR1	17	42
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	NPFFR2	67	33
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	PREP	37	48
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	CAPNS1	89	45
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	MMP3	15	40
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	ECE1	27	41
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	HLA-DRB1	41	37
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	CELA2A	73	44
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	REN	94	40
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	MMP11	74	36
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	CTSS	43	54
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	CAPN1	129	45
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	CASP1	27	44
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	CTRC	19	43
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	CAPN2	159	47
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	ACE2	84	37
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	PLAU	21	42
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	TGM2	39	49
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	KLK5	43	39
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	TPSAB1	49	39
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	ST14	40	37
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	KLK1	26	41
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	FPR1	61	38
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	NPR	81	40
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	PSMB5	45	41
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	BRCA1	62	34
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	NPFFR1	56	33
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	Q6PRC7_IXORI	40	33
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	SLC12A5	53	35
CC(C)[C@H]1CN(C(=O)[C@H](Cc2ccccc2)NC(=O)OCc2ccccc2)CCCO1	ZINC000819409841	HH	On-Demand	Anodyne	TMPRSS11D	41	35
COc1cc(NCCC(=O)NC(N)=O)ccc1NC(=O)OC(C)(C)C	ZINC000819409845	FE	On-Demand	Anodyne	ENPP1	67	32
COc1cc(NCCC(=O)NC(N)=O)ccc1NC(=O)OC(C)(C)C	ZINC000819409845	FE	On-Demand	Anodyne	DRTS_TRYCR	48	33
CC(C)[C@H]1CN(C(=O)COc2ccc(-c3ccccc3)cc2)CCCO1	ZINC000819409849	FI	On-Demand	Anodyne	CPT1A	126	40
CC(C)[C@H]1CN(C(=O)COc2ccc(-c3ccccc3)cc2)CCCO1	ZINC000819409849	FI	On-Demand	Anodyne	CPT2	49	37
CC(C)[C@H]1CN(C(=O)Cc2csc(NC(=O)Cc3cccs3)n2)CCCO1	ZINC000819409888	HG	On-Demand	Anodyne	ETHR	23	40
CC(C)[C@H]1CN(C(=O)c2cccc(Cl)c2O)CCCO1	ZINC000819409893	CF	On-Demand	Anodyne	P2RX7	18	41
CN1CCCN(c2ccc(NC[C@H](O)c3cccc4ccccc34)cc2)CC1	ZINC000819409896	GI	On-Demand	Anodyne	PRNP	26	40
CCOc1ccc(OC[C@@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)cc1	ZINC000819409907	GG	On-Demand	Anodyne	ADRB1	40	39
CCOc1ccc(OC[C@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)cc1	ZINC000819409908	GG	On-Demand	Anodyne	ADRB1	40	39
O=C(CCNc1ccc(OC[C@@H]2CCCO2)cc1)Nc1ccccc1	ZINC000819409911	EH	On-Demand	Anodyne	LTA4H	45	42
O=C(CCNc1ccc(OC[C@@H]2CCCO2)cc1)Nc1ccccc1	ZINC000819409911	EH	On-Demand	Anodyne	TNK2	45	33
O=C(CCNc1ccc(OC[C@H]2CCCO2)cc1)Nc1ccccc1	ZINC000819409912	EH	On-Demand	Anodyne	LTA4H	45	42
O=C(CCNc1ccc(OC[C@H]2CCCO2)cc1)Nc1ccccc1	ZINC000819409912	EH	On-Demand	Anodyne	TNK2	45	33
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)CN1CCc2ccccc2C1	ZINC000819409913	GG	On-Demand	Anodyne	NOD2	41	38
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)CN1CCc2ccccc2C1	ZINC000819409914	GG	On-Demand	Anodyne	NOD2	41	38
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)CN1CCc2ccccc2C1	ZINC000819409915	GG	On-Demand	Anodyne	NOD2	41	38
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)CN1CCc2ccccc2C1	ZINC000819409916	GG	On-Demand	Anodyne	NOD2	41	38
C[C@@H](CC(=O)NNc1ccc(OC(F)(F)F)cc1)n1cccn1	ZINC000819409917	EF	On-Demand	Reactive	P2RY1	56	37
C[C@@H](CC(=O)NNc1ccc(OC(F)(F)F)cc1)n1cccn1	ZINC000819409917	EF	On-Demand	Reactive	EPHX2	41	36
C[C@H](CC(=O)NNc1ccc(OC(F)(F)F)cc1)n1cccn1	ZINC000819409918	EF	On-Demand	Reactive	P2RY1	56	37
C[C@H](CC(=O)NNc1ccc(OC(F)(F)F)cc1)n1cccn1	ZINC000819409918	EF	On-Demand	Reactive	EPHX2	41	36
CN1CCCN(c2ccc(NC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819409924	EF	On-Demand	Anodyne	KCNQ2	17	45
CN1CCCN(c2ccc(NC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819409924	EF	On-Demand	Anodyne	PRNP	28	44
CN1CCCN(c2ccc(NC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819409925	EF	On-Demand	Anodyne	KCNQ2	17	45
CN1CCCN(c2ccc(NC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819409925	EF	On-Demand	Anodyne	PRNP	28	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNc1ccc(OC(F)(F)F)cc1	ZINC000819409946	GF	On-Demand	Reactive	EPHX2	45	40
O=C(NNc1cccc([N+](=O)[O-])c1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819409960	FH	On-Demand	Reactive	CACNA1D	44	34
O=C(CCOc1ccccc1)Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl	ZINC000819409973	HJ	On-Demand	Anodyne	CPT1A	45	34
O=C(Nc1cc(Cl)ccc1O)C(F)=C1CCC1	ZINC000819410005	CG	On-Demand	Anodyne	KCNMA1	28	51
CCOc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819410059	EG	On-Demand	Anodyne	ADRB2	20	41
CCOc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819410059	EG	On-Demand	Anodyne	ADRB1	18	40
CCOc1ccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819410060	EG	On-Demand	Anodyne	ADRB2	20	41
CCOc1ccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819410060	EG	On-Demand	Anodyne	ADRB1	18	40
O=C(OCc1ccccc1)N1CCN(C(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819410065	GD	On-Demand	Anodyne	GRIN2B	25	44
O=C(OCc1ccccc1)N1CCN(C(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819410065	GD	On-Demand	Anodyne	TGM2	32	43
O=C(OCc1ccccc1)N1CCN(C(=O)c2cc3c(cn2)OCCO3)CC1	ZINC000819410065	GD	On-Demand	Anodyne	SLC12A5	57	32
COCCc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819410067	FG	On-Demand	Anodyne	ADRB2	32	56
COCCc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819410067	FG	On-Demand	Anodyne	ADRB1	46	56
COCCc1ccc(OC[C@@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819410067	FG	On-Demand	Anodyne	ADRB3	28	41
COCCc1ccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819410069	FG	On-Demand	Anodyne	ADRB2	32	56
COCCc1ccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819410069	FG	On-Demand	Anodyne	ADRB1	46	56
COCCc1ccc(OC[C@H](O)CNc2ccc(N(C)C)cc2C)cc1	ZINC000819410069	FG	On-Demand	Anodyne	ADRB3	28	41
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1c(Cl)cccc1Cl	ZINC000819410074	IK	On-Demand	Anodyne	TYK2	44	37
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1c(Cl)cccc1Cl	ZINC000819410074	IK	On-Demand	Anodyne	EPHB3	45	34
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819410084	GH	On-Demand	Anodyne	ADRB2	41	49
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819410084	GH	On-Demand	Anodyne	ADRB1	63	49
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819410084	GH	On-Demand	Anodyne	ADRB3	38	49
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819410086	GH	On-Demand	Anodyne	ADRB2	41	49
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819410086	GH	On-Demand	Anodyne	ADRB1	63	49
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819410086	GH	On-Demand	Anodyne	ADRB3	38	49
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819410087	FF	On-Demand	Anodyne	ADRB2	25	44
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819410087	FF	On-Demand	Anodyne	ADRB1	40	44
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819410087	FF	On-Demand	Anodyne	ADRB3	25	44
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819410089	FF	On-Demand	Anodyne	ADRB2	25	44
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819410089	FF	On-Demand	Anodyne	ADRB1	40	44
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819410089	FF	On-Demand	Anodyne	ADRB3	25	44
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1ccc([N+](=O)[O-])o1	ZINC000819410090	HI	On-Demand	Bother	CSF1R	15	50
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819410097	GI	On-Demand	Anodyne	ADRB2	24	45
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819410097	GI	On-Demand	Anodyne	AGPAT2	42	35
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819410098	GI	On-Demand	Anodyne	ADRB2	24	45
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819410098	GI	On-Demand	Anodyne	AGPAT2	42	35
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)ccc2Cl)cc1	ZINC000819410100	GI	On-Demand	Anodyne	ADRB2	24	45
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)ccc2Cl)cc1	ZINC000819410102	GI	On-Demand	Anodyne	ADRB2	24	45
CC[C@H](O)CNc1ccc(OC)c(NC(=O)c2cccc(F)c2)c1	ZINC000819410133	EG	On-Demand	Anodyne	KCNK3	62	42
CC[C@H](O)CNc1ccc(OC)c(NC(=O)c2cccc(F)c2)c1	ZINC000819410133	EG	On-Demand	Anodyne	KCNK9	51	42
CN1CCCN(c2ccc(NCCC(=O)Nc3ccccc3F)cc2)CC1	ZINC000819410136	FG	On-Demand	Anodyne	KCNQ2	51	38
CN1CCCN(c2ccc(NCCC(=O)Nc3ccccc3F)cc2)CC1	ZINC000819410136	FG	On-Demand	Anodyne	PRNP	43	43
COc1cc(NC[C@H](O)CCc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819410139	GI	On-Demand	Anodyne	FPR1	42	34
COc1cc(NC[C@@H](O)CCc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819410142	GI	On-Demand	Anodyne	FPR1	42	34
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1cccc2[nH]ccc12	ZINC000819410148	GH	On-Demand	Anodyne	ADRB2	19	57
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1cccc2[nH]ccc12	ZINC000819410148	GH	On-Demand	Anodyne	ADRB1	36	57
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1cccc2[nH]ccc12	ZINC000819410148	GH	On-Demand	Anodyne	ADRB3	15	52
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1cccc2[nH]ccc12	ZINC000819410152	GH	On-Demand	Anodyne	ADRB2	19	57
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1cccc2[nH]ccc12	ZINC000819410152	GH	On-Demand	Anodyne	ADRB1	36	57
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1cccc2[nH]ccc12	ZINC000819410152	GH	On-Demand	Anodyne	ADRB3	15	52
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1cccc2[nH]ccc12	ZINC000819410155	GH	On-Demand	Anodyne	ADRB2	19	57
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1cccc2[nH]ccc12	ZINC000819410155	GH	On-Demand	Anodyne	ADRB1	36	57
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1cccc2[nH]ccc12	ZINC000819410155	GH	On-Demand	Anodyne	ADRB3	15	52
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1cccc2[nH]ccc12	ZINC000819410159	GH	On-Demand	Anodyne	ADRB2	19	57
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1cccc2[nH]ccc12	ZINC000819410159	GH	On-Demand	Anodyne	ADRB1	36	57
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1cccc2[nH]ccc12	ZINC000819410159	GH	On-Demand	Anodyne	ADRB3	15	52
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNc1ccc(S(C)(=O)=O)cc1	ZINC000819410166	FD	On-Demand	Reactive	GPR119	21	40
C=CCCn1cc(C(=O)NCc2ccc(OC)c(C#N)c2)nn1	ZINC000819410175	DD	On-Demand	Mild	HSP90AB1	58	31
C=CCCn1cc(C(=O)NCc2ccc(OC)c(C#N)c2)nn1	ZINC000819410175	DD	On-Demand	Mild	MAPK8	16	47
CN1CCCN(c2ccc(NC[C@H](O)COc3ccccc3Cl)cc2)CC1	ZINC000819410177	GG	On-Demand	Anodyne	ADRB2	22	42
CN1CCCN(c2ccc(NC[C@@H](O)COc3ccccc3Cl)cc2)CC1	ZINC000819410178	GG	On-Demand	Anodyne	ADRB2	22	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000819410192	GF	On-Demand	Bother	COLA	124	45
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COCc1ccc(Cl)cc1	ZINC000819410193	GH	On-Demand	Anodyne	ADRB1	25	43
COC[C@@H](O)CNc1ccc(OC)c(NC(=O)c2cccc(F)c2)c1	ZINC000819410195	EF	On-Demand	Anodyne	KCNK3	49	41
COC[C@@H](O)CNc1ccc(OC)c(NC(=O)c2cccc(F)c2)c1	ZINC000819410195	EF	On-Demand	Anodyne	KCNK9	45	41
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COCc1ccc(Cl)cc1	ZINC000819410197	GH	On-Demand	Anodyne	ADRB1	25	43
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COCc1ccc(Cl)cc1	ZINC000819410200	GH	On-Demand	Anodyne	ADRB1	25	43
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COCc1ccc(Cl)cc1	ZINC000819410203	GH	On-Demand	Anodyne	ADRB1	25	43
C=CCC1(C(=O)NNc2ccc(OC(F)(F)F)cc2)CCOCC1	ZINC000819410206	EG	On-Demand	Reactive	MMP13	23	44
C=CCC1(C(=O)NNc2ccc(OC(F)(F)F)cc2)CCOCC1	ZINC000819410206	EG	On-Demand	Reactive	MMP2	30	44
C=CCC1(C(=O)NNc2ccc(OC(F)(F)F)cc2)CCOCC1	ZINC000819410206	EG	On-Demand	Reactive	EPHX2	47	41
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819410215	FG	On-Demand	Anodyne	ADRB2	36	47
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819410215	FG	On-Demand	Anodyne	ADRB1	53	43
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819410215	FG	On-Demand	Anodyne	ADRB3	31	43
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819410215	FG	On-Demand	Anodyne	ABCB1	17	45
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819410215	FG	On-Demand	Anodyne	PDS	78	43
CN1CCCN(c2ccc(NCCC(=O)Nc3ccccc3)cc2)CC1	ZINC000819410216	FG	On-Demand	Anodyne	HTR1A	15	45
CN1CCCN(c2ccc(NCCC(=O)Nc3ccccc3)cc2)CC1	ZINC000819410216	FG	On-Demand	Anodyne	HTR7	15	41
CN1CCCN(c2ccc(NCCC(=O)Nc3ccccc3)cc2)CC1	ZINC000819410216	FG	On-Demand	Anodyne	LCK	21	42
CN1CCCN(c2ccc(NCCC(=O)Nc3ccccc3)cc2)CC1	ZINC000819410216	FG	On-Demand	Anodyne	KCNQ2	30	46
CN1CCCN(c2ccc(NCCC(=O)Nc3ccccc3)cc2)CC1	ZINC000819410216	FG	On-Demand	Anodyne	PRNP	43	52
CN1CCCN(c2ccc(NCCC(=O)Nc3ccccc3)cc2)CC1	ZINC000819410216	FG	On-Demand	Anodyne	HCK	15	42
CN1CCCN(c2ccc(NCCC(=O)Nc3ccccc3)cc2)CC1	ZINC000819410216	FG	On-Demand	Anodyne	FLT3	17	45
CN1CCCN(c2ccc(NCCC(=O)Nc3ccccc3)cc2)CC1	ZINC000819410216	FG	On-Demand	Anodyne	STAT6	18	40
CN1CCCN(c2ccc(NCCC(=O)Nc3ccccc3)cc2)CC1	ZINC000819410216	FG	On-Demand	Anodyne	SLC27A1	40	33
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819410217	FG	On-Demand	Anodyne	ADRB2	36	47
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819410217	FG	On-Demand	Anodyne	ADRB1	53	43
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819410217	FG	On-Demand	Anodyne	ADRB3	31	43
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819410217	FG	On-Demand	Anodyne	ABCB1	17	45
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819410217	FG	On-Demand	Anodyne	PDS	78	43
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819410229	GI	On-Demand	Anodyne	ADRB2	34	52
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819410229	GI	On-Demand	Anodyne	ADRB1	71	39
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819410229	GI	On-Demand	Anodyne	ADRB3	23	40
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819410229	GI	On-Demand	Anodyne	KCNK3	18	41
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819410229	GI	On-Demand	Anodyne	KCNK9	18	41
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819410231	GI	On-Demand	Anodyne	ADRB2	34	52
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819410231	GI	On-Demand	Anodyne	ADRB1	71	39
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819410231	GI	On-Demand	Anodyne	ADRB3	23	40
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819410231	GI	On-Demand	Anodyne	KCNK3	18	41
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819410231	GI	On-Demand	Anodyne	KCNK9	18	41
CN1CCCN(c2ccc(NC[C@H](O)COc3ccccc3F)cc2)CC1	ZINC000819410241	FF	On-Demand	Anodyne	ADRB2	21	42
CN1CCCN(c2ccc(NC[C@H](O)COc3ccccc3F)cc2)CC1	ZINC000819410241	FF	On-Demand	Anodyne	ABCB1	31	43
CN1CCCN(c2ccc(NC[C@@H](O)COc3ccccc3F)cc2)CC1	ZINC000819410243	FF	On-Demand	Anodyne	ADRB2	21	42
CN1CCCN(c2ccc(NC[C@@H](O)COc3ccccc3F)cc2)CC1	ZINC000819410243	FF	On-Demand	Anodyne	ABCB1	31	43
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819410250	FG	On-Demand	Anodyne	ADRB2	45	53
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819410250	FG	On-Demand	Anodyne	ADRB1	69	52
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819410250	FG	On-Demand	Anodyne	ADRB3	40	50
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819410250	FG	On-Demand	Anodyne	ACR	59	39
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819410252	FG	On-Demand	Anodyne	ADRB2	45	53
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819410252	FG	On-Demand	Anodyne	ADRB1	69	52
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819410252	FG	On-Demand	Anodyne	ADRB3	40	50
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819410252	FG	On-Demand	Anodyne	ACR	59	39
CN1CCCN(c2ccc(NCCS(C)(=O)=O)cc2)CC1	ZINC000819410259	DD	On-Demand	Anodyne	HRH4	19	42
CN1CCCN(c2ccc(NCCS(C)(=O)=O)cc2)CC1	ZINC000819410259	DD	On-Demand	Anodyne	CDK4	15	41
CC(C)[C@H]1CN(C(=O)c2ccc(F)c(S(C)(=O)=O)c2)CCCO1	ZINC000819410301	EE	On-Demand	Anodyne	L3MBTL3	58	34
COc1cc(NC[C@H](O)c2ccc(F)c(F)c2)ccc1NC(=O)OC(C)(C)C	ZINC000819410319	GI	On-Demand	Anodyne	DRTS_TRYCR	45	32
COc1cc(NC[C@@H](O)c2ccc(F)c(F)c2)ccc1NC(=O)OC(C)(C)C	ZINC000819410321	GI	On-Demand	Anodyne	DRTS_TRYCR	45	32
CC(C)[C@H]1CN(C(=O)CCN(C)C(=O)OCc2ccccc2)CCCO1	ZINC000819410338	FF	On-Demand	Anodyne	CTSK	16	45
CC(C)[C@H]1CN(C(=O)CCN(C)C(=O)OCc2ccccc2)CCCO1	ZINC000819410338	FF	On-Demand	Anodyne	NPR	64	34
CC(C)[C@H]1CN(C(=O)CCN(C)C(=O)OCc2ccccc2)CCCO1	ZINC000819410338	FF	On-Demand	Anodyne	SLC12A5	52	33
O=C(NNc1ccc(C(F)(F)F)cc1)C(F)=C1CCC1	ZINC000819410349	CH	On-Demand	Reactive	EPHX2	15	44
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)CC1CCCC1	ZINC000819410352	DH	On-Demand	Anodyne	CTSS	17	43
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)CC1CCCC1	ZINC000819410353	DH	On-Demand	Anodyne	CTSS	17	43
CON(C)C(=O)CCNc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	ZINC000819410371	EE	On-Demand	Anodyne	NPY2R	55	33
CON(C)C(=O)CCNc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	ZINC000819410372	EE	On-Demand	Anodyne	NPY2R	55	33
CON(C)C(=O)CCNc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	ZINC000819410373	EE	On-Demand	Anodyne	NPY2R	55	33
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1ccccc1	ZINC000819410428	CG	On-Demand	Anodyne	PPIA	17	43
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1ccccc1	ZINC000819410428	CG	On-Demand	Anodyne	PRNP	48	47
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1ccccc1	ZINC000819410428	CG	On-Demand	Anodyne	TAAR1	40	38
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1ccccc1	ZINC000819410428	CG	On-Demand	Anodyne	KCNK3	146	55
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1ccccc1	ZINC000819410428	CG	On-Demand	Anodyne	KCNK9	92	51
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1ccccc1	ZINC000819410429	CG	On-Demand	Anodyne	PPIA	17	43
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1ccccc1	ZINC000819410429	CG	On-Demand	Anodyne	PRNP	48	47
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1ccccc1	ZINC000819410429	CG	On-Demand	Anodyne	TAAR1	40	38
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1ccccc1	ZINC000819410429	CG	On-Demand	Anodyne	KCNK3	146	55
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1ccccc1	ZINC000819410429	CG	On-Demand	Anodyne	KCNK9	92	51
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)CC1CCCC1	ZINC000819410441	DH	On-Demand	Anodyne	CTSS	17	43
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)CC1CCCC1	ZINC000819410443	DH	On-Demand	Anodyne	CTSS	17	43
CC[C@H](O)CNc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	ZINC000819410452	CF	On-Demand	Anodyne	NPY2R	62	37
CC[C@H](O)CNc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	ZINC000819410454	CF	On-Demand	Anodyne	NPY2R	62	37
CC[C@H](O)CNc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	ZINC000819410455	CF	On-Demand	Anodyne	NPY2R	62	37
C=C(C)C(C)(C)C(=O)NNc1ccccc1Cl	ZINC000819410464	CG	On-Demand	Reactive	CXCL8	40	40
CN1CCCN(c2ccc(NCCC(=O)Nc3ccc(N(C)C)cc3)cc2)CC1	ZINC000819410471	GG	On-Demand	Anodyne	LCK	15	41
CN1CCCN(c2ccc(NCCC(=O)Nc3ccc(N(C)C)cc3)cc2)CC1	ZINC000819410471	GG	On-Demand	Anodyne	PRNP	37	42
CC(C)[C@H]1CN(C(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)CCCO1	ZINC000819410474	HE	On-Demand	Anodyne	CCR8	81	35
CC(C)[C@H]1CN(C(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)CCCO1	ZINC000819410474	HE	On-Demand	Anodyne	SFRP1	59	35
CC(=O)Nc1cccc(CC(=O)NNc2c(C)cc(C)cc2C)c1	ZINC000819410482	EG	On-Demand	Reactive	KCNK3	52	36
CC(=O)Nc1cccc(CC(=O)NNc2c(C)cc(C)cc2C)c1	ZINC000819410482	EG	On-Demand	Reactive	KCNK9	40	35
C/C(=C/C(=O)N1CCCO[C@H](C(C)C)C1)c1ccccc1C(F)(F)F	ZINC000819410483	FI	On-Demand	Anodyne	RBP4	76	37
C/C(=C/C(=O)N1CCCO[C@@H](C(C)C)C1)c1ccccc1C(F)(F)F	ZINC000819410484	FI	On-Demand	Anodyne	RBP4	76	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	F2	15	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	PLG	18	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	ACE	48	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	GHRHR	59	33
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	P2RY12	170	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	ELANE	30	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	CTRA_BOVIN	68	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	KLK3	83	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	CTSB	70	47
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	PAPA1_CARPA	70	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	TRY1_BOVIN	41	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	CYSP_TRYCR	60	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	CTSG	45	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	CTSK	60	51
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	CTSL	52	51
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	CCR1	17	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	PREP	35	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	CAPNS1	67	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	CELA2A	56	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	MMP11	61	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	CTSS	33	51
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	CAPN1	87	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	CAPN2	142	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	PLAU	17	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	TGM2	37	49
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	KLK5	40	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	TPSAB1	53	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	KLK1	20	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	NPR	78	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	PSMB5	42	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410509	GF	On-Demand	Anodyne	SLC12A5	45	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	F2	15	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	PLG	18	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	ACE	48	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	GHRHR	59	33
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	P2RY12	170	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	ELANE	30	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	CTRA_BOVIN	68	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	KLK3	83	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	CTSB	70	47
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	PAPA1_CARPA	70	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	TRY1_BOVIN	41	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	CYSP_TRYCR	60	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	CTSG	45	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	CTSK	60	51
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	CTSL	52	51
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	CCR1	17	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	PREP	35	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	CAPNS1	67	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	CELA2A	56	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	MMP11	61	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	CTSS	33	51
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	CAPN1	87	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	CAPN2	142	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	PLAU	17	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	TGM2	37	49
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	KLK5	40	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	TPSAB1	53	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	KLK1	20	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	NPR	78	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	PSMB5	42	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819410511	GF	On-Demand	Anodyne	SLC12A5	45	35
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	F2	15	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	PLG	18	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	ACE	48	44
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	GHRHR	59	33
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	P2RY12	170	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	ELANE	30	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	CTRA_BOVIN	68	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	KLK3	83	37
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	CTSB	70	47
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	PAPA1_CARPA	70	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	TRY1_BOVIN	41	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	CYSP_TRYCR	60	42
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	CTSG	45	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	CTSK	60	51
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	CTSL	52	51
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	CCR1	17	41
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	PREP	35	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	CAPNS1	67	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	CELA2A	56	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	MMP11	61	34
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	CTSS	33	51
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	CAPN1	87	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	CAPN2	142	43
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	PLAU	17	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	TGM2	37	49
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	KLK5	40	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	TPSAB1	53	38
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	KLK1	20	40
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	NPR	78	36
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	PSMB5	42	39
COCC[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410514	GF	On-Demand	Anodyne	SLC12A5	45	35
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	F2	15	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	PLG	18	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	ACE	48	44
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	GHRHR	59	33
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	P2RY12	170	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	ELANE	30	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	CTRA_BOVIN	68	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	KLK3	83	37
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	CTSB	70	47
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	PAPA1_CARPA	70	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	TRY1_BOVIN	41	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	CYSP_TRYCR	60	42
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	CTSG	45	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	CTSK	60	51
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	CTSL	52	51
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	CCR1	17	41
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	PREP	35	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	CAPNS1	67	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	CELA2A	56	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	MMP11	61	34
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	CTSS	33	51
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	CAPN1	87	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	CAPN2	142	43
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	PLAU	17	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	TGM2	37	49
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	KLK5	40	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	TPSAB1	53	38
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	KLK1	20	40
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	NPR	78	36
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	PSMB5	42	39
COCC[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819410517	GF	On-Demand	Anodyne	SLC12A5	45	35
CN1CCCN(c2ccc(NC[C@H](O)CCc3ccccc3)cc2)CC1	ZINC000819410520	FG	On-Demand	Anodyne	CTSL	18	49
CN1CCCN(c2ccc(NC[C@H](O)CCc3ccccc3)cc2)CC1	ZINC000819410520	FG	On-Demand	Anodyne	PRNP	27	41
CN1CCCN(c2ccc(NC[C@H](O)CCc3ccccc3)cc2)CC1	ZINC000819410520	FG	On-Demand	Anodyne	STAT6	22	40
CN1CCCN(c2ccc(NC[C@@H](O)CCc3ccccc3)cc2)CC1	ZINC000819410521	FG	On-Demand	Anodyne	CTSL	18	49
CN1CCCN(c2ccc(NC[C@@H](O)CCc3ccccc3)cc2)CC1	ZINC000819410521	FG	On-Demand	Anodyne	PRNP	27	41
CN1CCCN(c2ccc(NC[C@@H](O)CCc3ccccc3)cc2)CC1	ZINC000819410521	FG	On-Demand	Anodyne	STAT6	22	40
O=S(=O)(CCNc1ccc(OC[C@H]2CCCO2)cc1)c1ccccc1	ZINC000819410524	FG	On-Demand	Anodyne	TNK2	42	35
O=S(=O)(CCNc1ccc(OC[C@@H]2CCCO2)cc1)c1ccccc1	ZINC000819410527	FG	On-Demand	Anodyne	TNK2	42	35
C[C@H](CC(=O)NC[C@H]1CCCN1C(=O)C[C@@H](C)n1cccn1)n1cccn1	ZINC000819410540	FD	On-Demand	Anodyne	DPP4	23	42
C[C@@H](CC(=O)NC[C@H]1CCCN1C(=O)C[C@@H](C)n1cccn1)n1cccn1	ZINC000819410541	FD	On-Demand	Anodyne	DPP4	23	42
C[C@@H](CC(=O)N1CCC[C@@H]1CNC(=O)C[C@@H](C)n1cccn1)n1cccn1	ZINC000819410542	FD	On-Demand	Anodyne	DPP4	23	42
C[C@@H](CC(=O)NC[C@H]1CCCN1C(=O)C[C@H](C)n1cccn1)n1cccn1	ZINC000819410543	FD	On-Demand	Anodyne	DPP4	23	42
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	ACE	43	42
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	GHRHR	58	33
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	P2RY12	81	35
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	ELANE	26	40
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	CTRA_BOVIN	65	36
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	KLK3	81	36
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	CTSB	67	48
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	TRY2_BOVIN	82	34
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	PAPA1_CARPA	60	39
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	TRY1_BOVIN	42	36
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	CYSP_TRYCR	59	41
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	CTSG	45	35
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	CTSK	64	52
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	CTSL	53	52
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	PREP	23	44
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	CAPNS1	69	36
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	CELA2A	54	36
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	MMP11	41	32
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	TGM1	23	40
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	CTSS	34	52
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	CAPN1	90	42
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	CASP1	24	40
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	CAPN2	137	42
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	TGM2	41	48
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	TPSAB1	42	37
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	NPR	70	35
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	PSMB5	45	41
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	SLC12A5	45	33
CC(C)[C@H]1CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410548	ID	On-Demand	Anodyne	TMPRSS11D	49	36
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	ACE	43	42
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	GHRHR	58	33
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	P2RY12	81	35
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	ELANE	26	40
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	CTRA_BOVIN	65	36
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	KLK3	81	36
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	CTSB	67	48
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	TRY2_BOVIN	82	34
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	PAPA1_CARPA	60	39
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	TRY1_BOVIN	42	36
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	CYSP_TRYCR	59	41
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	CTSG	45	35
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	CTSK	64	52
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	CTSL	53	52
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	PREP	23	44
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	CAPNS1	69	36
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	CELA2A	54	36
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	MMP11	41	32
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	TGM1	23	40
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	CTSS	34	52
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	CAPN1	90	42
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	CASP1	24	40
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	CAPN2	137	42
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	TGM2	41	48
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	TPSAB1	42	37
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	NPR	70	35
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	PSMB5	45	41
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	SLC12A5	45	33
CC(C)[C@H]1CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc2ccccc2)CCCO1	ZINC000819410552	ID	On-Demand	Anodyne	TMPRSS11D	49	36
COCCOc1ccc(NC[C@H](O)COc2ccccc2C)cc1	ZINC000819410559	EF	On-Demand	Anodyne	ADRB2	54	54
COCCOc1ccc(NC[C@H](O)COc2ccccc2C)cc1	ZINC000819410559	EF	On-Demand	Anodyne	ADRB1	75	42
COCCOc1ccc(NC[C@H](O)COc2ccccc2C)cc1	ZINC000819410559	EF	On-Demand	Anodyne	ADRB3	36	40
COCCOc1ccc(NC[C@H](O)COc2ccccc2C)cc1	ZINC000819410559	EF	On-Demand	Anodyne	CYP2D6	20	42
CC(C)[C@H]1CN(C(=O)c2ccc(F)c(S(=O)(=O)N3CCCCC3)c2)CCCO1	ZINC000819410561	HF	On-Demand	Anodyne	CNR2	16	55
CC(C)[C@H]1CN(C(=O)c2ccc(F)c(S(=O)(=O)N3CCCCC3)c2)CCCO1	ZINC000819410561	HF	On-Demand	Anodyne	L3MBTL3	40	35
COCCOc1ccc(NC[C@@H](O)COc2ccccc2C)cc1	ZINC000819410564	EF	On-Demand	Anodyne	ADRB2	54	54
COCCOc1ccc(NC[C@@H](O)COc2ccccc2C)cc1	ZINC000819410564	EF	On-Demand	Anodyne	ADRB1	75	42
COCCOc1ccc(NC[C@@H](O)COc2ccccc2C)cc1	ZINC000819410564	EF	On-Demand	Anodyne	ADRB3	36	40
COCCOc1ccc(NC[C@@H](O)COc2ccccc2C)cc1	ZINC000819410564	EF	On-Demand	Anodyne	CYP2D6	20	42
COCCOc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819410566	FF	On-Demand	Anodyne	NOD1	18	45
COCCOc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819410566	FF	On-Demand	Anodyne	NOD2	51	46
COCCOc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819410569	FF	On-Demand	Anodyne	NOD1	18	45
COCCOc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819410569	FF	On-Demand	Anodyne	NOD2	51	46
O=C(Cc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1)N1CCOCC1	ZINC000819410573	FF	On-Demand	Anodyne	CTSS	15	47
COCCOc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1	ZINC000819410575	EF	On-Demand	Anodyne	ADRB2	53	57
COCCOc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1	ZINC000819410575	EF	On-Demand	Anodyne	ADRB1	74	57
COCCOc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1	ZINC000819410575	EF	On-Demand	Anodyne	ADRB3	44	42
COCCOc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1	ZINC000819410575	EF	On-Demand	Anodyne	CTSL	15	41
COCCOc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1	ZINC000819410575	EF	On-Demand	Anodyne	PDS	56	41
COCCOc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1	ZINC000819410577	EF	On-Demand	Anodyne	ADRB2	53	57
COCCOc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1	ZINC000819410577	EF	On-Demand	Anodyne	ADRB1	74	57
COCCOc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1	ZINC000819410577	EF	On-Demand	Anodyne	ADRB3	44	42
COCCOc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1	ZINC000819410577	EF	On-Demand	Anodyne	CTSL	15	41
COCCOc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1	ZINC000819410577	EF	On-Demand	Anodyne	PDS	56	41
O=S1(=O)CCCN1c1cccc(NC[C@H](O)c2ccccc2Cl)c1	ZINC000819410579	FG	On-Demand	Anodyne	CDK1	16	43
COCCOc1ccc(NC[C@H](O)CN2CCN(C)CC2)cc1	ZINC000819410594	DC	On-Demand	Anodyne	ACOX1	44	33
COCCOc1ccc(NC[C@@H](O)CN2CCN(C)CC2)cc1	ZINC000819410596	DC	On-Demand	Anodyne	ACOX1	44	33
O=S1(=O)CCCN1c1cccc(NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819410603	FG	On-Demand	Anodyne	CDK1	16	43
CCOC[C@H](O)CNc1ccccc1OC(C)C	ZINC000819410605	CE	On-Demand	Anodyne	ADRB2	25	42
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819410609	DG	On-Demand	Anodyne	LTA4H	72	48
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819410609	DG	On-Demand	Anodyne	S1PR4	25	40
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819410609	DG	On-Demand	Anodyne	HDAC8	18	41
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819410609	DG	On-Demand	Anodyne	PRNP	22	40
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819410609	DG	On-Demand	Anodyne	HDAC10	15	41
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819410609	DG	On-Demand	Anodyne	S1PR3	16	40
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819410609	DG	On-Demand	Anodyne	MTNR1A	15	42
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819410609	DG	On-Demand	Anodyne	MTNR1B	20	45
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819410609	DG	On-Demand	Anodyne	PLA2G4B	42	30
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819410609	DG	On-Demand	Anodyne	HDAC1	15	44
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819410609	DG	On-Demand	Anodyne	HDAC2	16	41
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819410609	DG	On-Demand	Anodyne	FAAH	22	44
Cc1cc(C)c(NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819410618	FH	On-Demand	Reactive	PAPA1_CARPA	44	46
Cc1cc(C)c(NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c(C)c1	ZINC000819410625	FH	On-Demand	Reactive	PAPA1_CARPA	44	46
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819410670	FG	On-Demand	Anodyne	ADRB2	55	48
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819410670	FG	On-Demand	Anodyne	ADRB1	78	46
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819410670	FG	On-Demand	Anodyne	ADRB3	47	46
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819410670	FG	On-Demand	Anodyne	ABCB1	29	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819410673	FG	On-Demand	Anodyne	ADRB2	55	48
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819410673	FG	On-Demand	Anodyne	ADRB1	78	46
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819410673	FG	On-Demand	Anodyne	ADRB3	47	46
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819410673	FG	On-Demand	Anodyne	ABCB1	29	44
CN1CCCN(c2ccc(NC[C@H](O)c3ccc([N+](=O)[O-])cc3)cc2)CC1	ZINC000819410693	FF	On-Demand	Bother	SSTR1	39	43
COCCOc1ccc(NCCC(N)=O)cc1	ZINC000819410694	BC	On-Demand	Anodyne	ACR	41	39
CN1CCCN(c2ccc(NC[C@@H](O)c3ccc([N+](=O)[O-])cc3)cc2)CC1	ZINC000819410697	FF	On-Demand	Bother	SSTR1	39	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819410806	EH	On-Demand	Anodyne	ADRB2	52	54
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819410806	EH	On-Demand	Anodyne	ADRB1	74	54
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819410806	EH	On-Demand	Anodyne	ADRB3	42	44
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819410807	EH	On-Demand	Anodyne	ADRB2	52	54
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819410807	EH	On-Demand	Anodyne	ADRB1	74	54
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2)cc1	ZINC000819410807	EH	On-Demand	Anodyne	ADRB3	42	44
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc(NC(=O)c2ccccc2)c1	ZINC000819410826	GH	On-Demand	Anodyne	NR1H4	15	40
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc(NC(=O)c2ccccc2)c1	ZINC000819410826	GH	On-Demand	Anodyne	KCNK3	133	45
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc(NC(=O)c2ccccc2)c1	ZINC000819410826	GH	On-Demand	Anodyne	KCNK9	88	45
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc(NC(=O)c2ccccc2)c1	ZINC000819410827	GH	On-Demand	Anodyne	NR1H4	15	40
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc(NC(=O)c2ccccc2)c1	ZINC000819410827	GH	On-Demand	Anodyne	KCNK3	133	45
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc(NC(=O)c2ccccc2)c1	ZINC000819410827	GH	On-Demand	Anodyne	KCNK9	88	45
COc1cc(NCCC(=O)Nc2cccnc2)ccc1NC(=O)OC(C)(C)C	ZINC000819410853	GH	On-Demand	Anodyne	ENPP1	52	35
C/C(=C/C(=O)N1CCCO[C@@H](C(C)C)C1)c1cccc(C(F)(F)F)c1	ZINC000819410877	FI	On-Demand	Anodyne	CACNA1B	43	36
C/C(=C/C(=O)N1CCCO[C@@H](C(C)C)C1)c1cccc(C(F)(F)F)c1	ZINC000819410877	FI	On-Demand	Anodyne	CCR2	61	39
C/C(=C/C(=O)N1CCCO[C@H](C(C)C)C1)c1cccc(C(F)(F)F)c1	ZINC000819410878	FI	On-Demand	Anodyne	CACNA1B	43	36
C/C(=C/C(=O)N1CCCO[C@H](C(C)C)C1)c1cccc(C(F)(F)F)c1	ZINC000819410878	FI	On-Demand	Anodyne	CCR2	61	39
CC(C)[C@H]1CN(C(=O)[C@H](F)Cc2ccccc2)CCCO1	ZINC000819410888	CF	On-Demand	Anodyne	ACE	52	35
CC(C)[C@H]1CN(C(=O)[C@H](F)Cc2ccccc2)CCCO1	ZINC000819410888	CF	On-Demand	Anodyne	MME	40	41
CC(C)[C@H]1CN(C(=O)[C@@H](F)Cc2ccccc2)CCCO1	ZINC000819410889	CF	On-Demand	Anodyne	ACE	52	35
CC(C)[C@H]1CN(C(=O)[C@@H](F)Cc2ccccc2)CCCO1	ZINC000819410889	CF	On-Demand	Anodyne	MME	40	41
C=C(C)C(C)(C)C(=O)NNc1cccc([N+](=O)[O-])c1	ZINC000819410897	CF	On-Demand	Reactive	CACNA1D	58	35
COCCOc1ccc(NCCS(=O)(=O)c2ccccc2)cc1	ZINC000819410943	EF	On-Demand	Anodyne	MMP13	21	40
COCCOc1ccc(NCCS(=O)(=O)c2ccccc2)cc1	ZINC000819410943	EF	On-Demand	Anodyne	MMP2	17	40
COCCOc1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819410954	EG	On-Demand	Anodyne	ADRB2	45	52
COCCOc1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819410954	EG	On-Demand	Anodyne	ADRB1	65	46
CC(C)[C@H]1CN(C(=O)[C@H]2CCCCN2C(=O)OC(C)(C)C)CCCO1	ZINC000819410957	FG	On-Demand	Anodyne	PREP	43	63
COCCOc1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819410963	EG	On-Demand	Anodyne	ADRB2	45	52
COCCOc1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819410963	EG	On-Demand	Anodyne	ADRB1	65	46
CC(C)[C@H]1CN(C(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)CCCO1	ZINC000819410964	HD	On-Demand	Anodyne	CNR2	19	54
Cc1ccc2nc(-c3cccnc3)cc(C(=O)N3CCCO[C@@H](C(C)C)C3)c2c1	ZINC000819410996	GI	On-Demand	Anodyne	MT-CO2	45	31
Cc1ccc2nc(-c3cccnc3)cc(C(=O)N3CCCO[C@H](C(C)C)C3)c2c1	ZINC000819410999	GI	On-Demand	Anodyne	MT-CO2	45	31
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C[C@@H](O)c2ccc(F)cc2)c1	ZINC000819411003	GG	On-Demand	Anodyne	OPRK1	18	44
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C[C@@H](O)c2ccc(F)cc2)c1	ZINC000819411003	GG	On-Demand	Anodyne	CCR3	73	42
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C[C@@H](O)c2ccc(F)cc2)c1	ZINC000819411008	GG	On-Demand	Anodyne	OPRK1	18	44
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C[C@@H](O)c2ccc(F)cc2)c1	ZINC000819411008	GG	On-Demand	Anodyne	CCR3	73	42
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)c1	ZINC000819411011	GG	On-Demand	Anodyne	OPRK1	18	44
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)c1	ZINC000819411011	GG	On-Demand	Anodyne	CCR3	73	42
CC(C)[C@H]1CN(C(=O)CC[C@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819411014	HI	On-Demand	Anodyne	FPR1	46	35
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)c1	ZINC000819411015	GG	On-Demand	Anodyne	OPRK1	18	44
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)c1	ZINC000819411015	GG	On-Demand	Anodyne	CCR3	73	42
CC(C)[C@H]1CN(C(=O)CC[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819411016	HI	On-Demand	Anodyne	FPR1	46	35
COCCOc1ccc(NCCC(=O)Nc2ccccc2F)cc1	ZINC000819411093	EG	On-Demand	Anodyne	FAAH	17	42
COCCOc1ccc(NCCC(=O)Nc2ccccc2F)cc1	ZINC000819411093	EG	On-Demand	Anodyne	DGAT1	16	40
COCCOc1ccc(NC[C@@H](O)COc2c(C)cccc2C)cc1	ZINC000819411094	EG	On-Demand	Anodyne	ADRB2	43	43
COCCOc1ccc(NC[C@@H](O)COc2c(C)cccc2C)cc1	ZINC000819411094	EG	On-Demand	Anodyne	ADRB1	58	43
COCCOc1ccc(NC[C@H](O)COc2c(C)cccc2C)cc1	ZINC000819411095	EG	On-Demand	Anodyne	ADRB2	43	43
COCCOc1ccc(NC[C@H](O)COc2c(C)cccc2C)cc1	ZINC000819411095	EG	On-Demand	Anodyne	ADRB1	58	43
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)Cc1ccc(F)cc1	ZINC000819411118	EG	On-Demand	Anodyne	ADRB1	16	41
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)Cc1ccc(F)cc1	ZINC000819411122	EG	On-Demand	Anodyne	ADRB1	16	41
COCCOc1ccc(NC[C@@H](O)COc2cc(C)ccc2C)cc1	ZINC000819411125	EG	On-Demand	Anodyne	ADRB2	45	45
COCCOc1ccc(NC[C@@H](O)COc2cc(C)ccc2C)cc1	ZINC000819411125	EG	On-Demand	Anodyne	ADRB1	62	42
COCCOc1ccc(NC[C@H](O)COc2cc(C)ccc2C)cc1	ZINC000819411126	EG	On-Demand	Anodyne	ADRB2	45	45
COCCOc1ccc(NC[C@H](O)COc2cc(C)ccc2C)cc1	ZINC000819411126	EG	On-Demand	Anodyne	ADRB1	62	42
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)Cc1ccc(F)cc1	ZINC000819411127	EG	On-Demand	Anodyne	ADRB1	16	41
COCCOc1ccc(NC[C@H](O)COc2cccc(Br)c2)cc1	ZINC000819411128	GG	On-Demand	Anodyne	ADRB2	44	43
COCCOc1ccc(NC[C@H](O)COc2cccc(Br)c2)cc1	ZINC000819411128	GG	On-Demand	Anodyne	ADRB1	67	46
COCCOc1ccc(NC[C@H](O)COc2cccc(Br)c2)cc1	ZINC000819411128	GG	On-Demand	Anodyne	ADRB3	38	41
COCCOc1ccc(NC[C@H](O)COc2cccc(Br)c2)cc1	ZINC000819411128	GG	On-Demand	Anodyne	PDS	66	43
COCCOc1ccc(NC[C@@H](O)COc2cccc(Br)c2)cc1	ZINC000819411129	GG	On-Demand	Anodyne	ADRB2	44	43
COCCOc1ccc(NC[C@@H](O)COc2cccc(Br)c2)cc1	ZINC000819411129	GG	On-Demand	Anodyne	ADRB1	67	46
COCCOc1ccc(NC[C@@H](O)COc2cccc(Br)c2)cc1	ZINC000819411129	GG	On-Demand	Anodyne	ADRB3	38	41
COCCOc1ccc(NC[C@@H](O)COc2cccc(Br)c2)cc1	ZINC000819411129	GG	On-Demand	Anodyne	PDS	66	43
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)Cc1ccc(F)cc1	ZINC000819411133	EG	On-Demand	Anodyne	ADRB1	16	41
COc1cc(NC[C@H](O)COc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819411144	GH	On-Demand	Anodyne	ADRB2	50	46
COc1cc(NC[C@H](O)COc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819411144	GH	On-Demand	Anodyne	ADRB1	70	49
COc1cc(NC[C@H](O)COc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819411144	GH	On-Demand	Anodyne	ADRB3	43	49
COc1cc(NC[C@H](O)COc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819411144	GH	On-Demand	Anodyne	PDS	57	35
COc1cc(NC[C@@H](O)COc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819411145	GH	On-Demand	Anodyne	ADRB2	50	46
COc1cc(NC[C@@H](O)COc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819411145	GH	On-Demand	Anodyne	ADRB1	70	49
COc1cc(NC[C@@H](O)COc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819411145	GH	On-Demand	Anodyne	ADRB3	43	49
COc1cc(NC[C@@H](O)COc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819411145	GH	On-Demand	Anodyne	PDS	57	35
CN1CCCN(c2ccc(NC[C@@H](O)Cc3ccccc3)cc2)CC1	ZINC000819411176	EF	On-Demand	Anodyne	PRNP	27	42
CN1CCCN(c2ccc(NC[C@@H](O)Cc3ccccc3)cc2)CC1	ZINC000819411176	EF	On-Demand	Anodyne	STAT6	20	41
CN1CCCN(c2ccc(NC[C@H](O)Cc3ccccc3)cc2)CC1	ZINC000819411177	EF	On-Demand	Anodyne	PRNP	27	42
CN1CCCN(c2ccc(NC[C@H](O)Cc3ccccc3)cc2)CC1	ZINC000819411177	EF	On-Demand	Anodyne	STAT6	20	41
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)c1cccnc1	ZINC000819411178	DF	On-Demand	Anodyne	ADRB2	21	43
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)c1cccnc1	ZINC000819411178	DF	On-Demand	Anodyne	ADRB1	24	45
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)c1cccnc1	ZINC000819411178	DF	On-Demand	Anodyne	ADRB3	82	45
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)c1cccnc1	ZINC000819411179	DF	On-Demand	Anodyne	ADRB2	21	43
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)c1cccnc1	ZINC000819411179	DF	On-Demand	Anodyne	ADRB1	24	45
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)c1cccnc1	ZINC000819411179	DF	On-Demand	Anodyne	ADRB3	82	45
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)c1cccnc1	ZINC000819411180	DF	On-Demand	Anodyne	ADRB2	21	43
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)c1cccnc1	ZINC000819411180	DF	On-Demand	Anodyne	ADRB1	24	45
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)c1cccnc1	ZINC000819411180	DF	On-Demand	Anodyne	ADRB3	82	45
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)c1cccnc1	ZINC000819411181	DF	On-Demand	Anodyne	ADRB2	21	43
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)c1cccnc1	ZINC000819411181	DF	On-Demand	Anodyne	ADRB1	24	45
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)c1cccnc1	ZINC000819411181	DF	On-Demand	Anodyne	ADRB3	82	45
CN1CCCN(c2ccc(NCCC(=O)Nc3cccc(F)c3)cc2)CC1	ZINC000819411192	FG	On-Demand	Anodyne	HTR1D	16	43
CN1CCCN(c2ccc(NCCC(=O)Nc3cccc(F)c3)cc2)CC1	ZINC000819411192	FG	On-Demand	Anodyne	PRNP	31	40
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)c1cccc(Cl)c1	ZINC000819411196	EI	On-Demand	Anodyne	ADRB1	29	42
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)c1cccc(Cl)c1	ZINC000819411196	EI	On-Demand	Anodyne	ADRB3	41	42
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)c1cccc(Cl)c1	ZINC000819411196	EI	On-Demand	Anodyne	CYP3A4	48	36
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)c1cccc(Cl)c1	ZINC000819411197	EI	On-Demand	Anodyne	ADRB1	29	42
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)c1cccc(Cl)c1	ZINC000819411197	EI	On-Demand	Anodyne	ADRB3	41	42
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)c1cccc(Cl)c1	ZINC000819411197	EI	On-Demand	Anodyne	CYP3A4	48	36
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)c1cccc(Cl)c1	ZINC000819411198	EI	On-Demand	Anodyne	ADRB1	29	42
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)c1cccc(Cl)c1	ZINC000819411198	EI	On-Demand	Anodyne	ADRB3	41	42
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)c1cccc(Cl)c1	ZINC000819411198	EI	On-Demand	Anodyne	CYP3A4	48	36
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)c1cccc(Cl)c1	ZINC000819411199	EI	On-Demand	Anodyne	ADRB1	29	42
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)c1cccc(Cl)c1	ZINC000819411199	EI	On-Demand	Anodyne	ADRB3	41	42
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)c1cccc(Cl)c1	ZINC000819411199	EI	On-Demand	Anodyne	CYP3A4	48	36
CN1CCCN(c2ccc(NC[C@H](O)COc3ccc(Cl)cc3)cc2)CC1	ZINC000819411208	GG	On-Demand	Anodyne	ADRB1	40	38
CN1CCCN(c2ccc(NC[C@@H](O)COc3ccc(Cl)cc3)cc2)CC1	ZINC000819411209	GG	On-Demand	Anodyne	ADRB1	40	38
COc1cc(NC[C@@H](O)Cc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819411216	FI	On-Demand	Anodyne	ADRB3	17	40
COc1cc(NC[C@@H](O)Cc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819411216	FI	On-Demand	Anodyne	PGC	47	33
COc1cc(NC[C@@H](O)Cc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819411216	FI	On-Demand	Anodyne	PAPA1_CARPA	33	42
COc1cc(NC[C@@H](O)Cc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819411216	FI	On-Demand	Anodyne	REN	48	38
COc1cc(NC[C@@H](O)Cc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819411216	FI	On-Demand	Anodyne	FPR1	50	37
COc1cc(NC[C@H](O)Cc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819411217	FI	On-Demand	Anodyne	ADRB3	17	40
COc1cc(NC[C@H](O)Cc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819411217	FI	On-Demand	Anodyne	PGC	47	33
COc1cc(NC[C@H](O)Cc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819411217	FI	On-Demand	Anodyne	PAPA1_CARPA	33	42
COc1cc(NC[C@H](O)Cc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819411217	FI	On-Demand	Anodyne	REN	48	38
COc1cc(NC[C@H](O)Cc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819411217	FI	On-Demand	Anodyne	FPR1	50	37
CN1CCCN(c2ccc(NC[C@@H](O)COc3ccc(CC#N)cc3)cc2)CC1	ZINC000819411218	GF	On-Demand	Mild	ADRB1	46	39
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C(C)C)CCCO1	ZINC000819411221	IG	On-Demand	Bother	CCR1	65	42
CC(C)[C@H]1CN(C(=O)[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C(C)C)CCCO1	ZINC000819411222	IG	On-Demand	Bother	CCR1	65	42
CC(C)[C@H]1CN(C(=O)[C@@H](NC(=O)C(F)(F)F)C(C)C)CCCO1	ZINC000819411246	ED	On-Demand	Anodyne	ELANE	39	46
CC(C)[C@H]1CN(C(=O)C[C@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819411253	GH	On-Demand	Anodyne	CTSK	32	41
CC(C)[C@H]1CN(C(=O)C[C@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819411253	GH	On-Demand	Anodyne	REN	41	37
CC(C)[C@H]1CN(C(=O)C[C@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819411253	GH	On-Demand	Anodyne	FPR1	46	35
CC(C)[C@H]1CN(C(=O)C[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819411254	GH	On-Demand	Anodyne	CTSK	32	41
CC(C)[C@H]1CN(C(=O)C[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819411254	GH	On-Demand	Anodyne	REN	41	37
CC(C)[C@H]1CN(C(=O)C[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)CCCO1	ZINC000819411254	GH	On-Demand	Anodyne	FPR1	46	35
O=C(NCCNS(=O)(=O)c1cccnc1)C(F)=C1CCC1	ZINC000819411260	DC	On-Demand	Anodyne	TBXAS1	42	42
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	F2	48	39
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	ACE	65	45
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	FKBP1A	60	42
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	CELA1	28	56
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	ELANE	38	44
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	CTRA_BOVIN	68	37
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	TRY1_BOVIN	72	37
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	CTSG	47	37
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	CTSK	19	45
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	CTSL	17	42
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	CPT2	46	37
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	PREP	137	67
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	CELA2A	56	37
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	LGMN	82	47
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	ACE2	23	46
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	KLK5	47	50
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	WNT3	40	33
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	BRCA1	52	32
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	SLC12A5	64	37
CC(C)[C@H]1CN(C(=O)[C@@H]2CCCN2C(=O)OCc2ccccc2)CCCO1	ZINC000819411271	FG	On-Demand	Anodyne	TMPRSS11D	67	39
CC(C)[C@H]1CN(C(=O)c2cc(-c3ccccn3)nc3ccccc23)CCCO1	ZINC000819411274	GI	On-Demand	Anodyne	METAP1	51	42
CC(C)[C@H]1CN(C(=O)c2cc(-c3ccccn3)nc3ccccc23)CCCO1	ZINC000819411274	GI	On-Demand	Anodyne	MT-CO2	46	34
CC(C)[C@H]1CN(C(=O)c2cc(-c3ccccn3)nc3ccccc23)CCCO1	ZINC000819411274	GI	On-Demand	Anodyne	MAP3K12	30	40
O=S1(=O)CCCN1c1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819411275	ED	On-Demand	Anodyne	ADRB3	79	42
O=S1(=O)CCCN1c1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819411277	ED	On-Demand	Anodyne	ADRB3	79	42
C#CCNC(=O)CCNc1ccc(OC)c(N2CCCCC2=O)c1	ZINC000819411297	ED	On-Demand	Mild	DRTS_TRYCR	44	31
COC[C@@H](C)OC[C@@H](O)CNc1ccccc1OC(C)C	ZINC000819411299	CE	On-Demand	Anodyne	ADRB2	21	40
COC[C@@H](C)OC[C@H](O)CNc1ccccc1OC(C)C	ZINC000819411302	CE	On-Demand	Anodyne	ADRB2	21	40
O=S1(=O)CCCN1c1cccc(NC[C@H](O)c2ccc(F)cn2)c1	ZINC000819411319	FD	On-Demand	Anodyne	CDK1	15	40
O=S1(=O)CCCN1c1cccc(NC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819411321	FD	On-Demand	Anodyne	CDK1	15	40
O=C(Cc1ccc(NC[C@H](O)c2cccc(F)c2)cc1)N1CCOCC1	ZINC000819411327	FE	On-Demand	Anodyne	CTSS	15	42
CC[C@@H](C)c1ccc(C(=O)N2CCCO[C@@H](C(C)C)C2)cc1	ZINC000819411328	DI	On-Demand	Anodyne	L3MBTL3	55	38
O=C(Cc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1)N1CCOCC1	ZINC000819411329	FE	On-Demand	Anodyne	CTSS	15	42
CC[C@H](C)c1ccc(C(=O)N2CCCO[C@@H](C(C)C)C2)cc1	ZINC000819411330	DI	On-Demand	Anodyne	L3MBTL3	55	38
O=C(Cc1ccc(NC[C@@H](O)c2cccnc2)cc1)N1CCOCC1	ZINC000819411331	ED	On-Demand	Anodyne	ADRB2	28	42
O=C(Cc1ccc(NC[C@@H](O)c2cccnc2)cc1)N1CCOCC1	ZINC000819411331	ED	On-Demand	Anodyne	ADRB1	27	42
O=C(Cc1ccc(NC[C@@H](O)c2cccnc2)cc1)N1CCOCC1	ZINC000819411331	ED	On-Demand	Anodyne	ADRB3	101	48
O=C(Cc1ccc(NC[C@@H](O)c2cccnc2)cc1)N1CCOCC1	ZINC000819411331	ED	On-Demand	Anodyne	PTAFR	17	43
O=C(Cc1ccc(NC[C@@H](O)c2cccnc2)cc1)N1CCOCC1	ZINC000819411331	ED	On-Demand	Anodyne	CHRNA7	15	40
O=C(Cc1ccc(NC[C@@H](O)c2cccnc2)cc1)N1CCOCC1	ZINC000819411331	ED	On-Demand	Anodyne	NAMPT	35	40
CC[C@@H](C)c1ccc(C(=O)N2CCCO[C@H](C(C)C)C2)cc1	ZINC000819411332	DI	On-Demand	Anodyne	L3MBTL3	55	38
O=C(Cc1ccc(NC[C@H](O)c2cccnc2)cc1)N1CCOCC1	ZINC000819411333	ED	On-Demand	Anodyne	ADRB2	28	42
O=C(Cc1ccc(NC[C@H](O)c2cccnc2)cc1)N1CCOCC1	ZINC000819411333	ED	On-Demand	Anodyne	ADRB1	27	42
O=C(Cc1ccc(NC[C@H](O)c2cccnc2)cc1)N1CCOCC1	ZINC000819411333	ED	On-Demand	Anodyne	ADRB3	101	48
O=C(Cc1ccc(NC[C@H](O)c2cccnc2)cc1)N1CCOCC1	ZINC000819411333	ED	On-Demand	Anodyne	PTAFR	17	43
O=C(Cc1ccc(NC[C@H](O)c2cccnc2)cc1)N1CCOCC1	ZINC000819411333	ED	On-Demand	Anodyne	CHRNA7	15	40
O=C(Cc1ccc(NC[C@H](O)c2cccnc2)cc1)N1CCOCC1	ZINC000819411333	ED	On-Demand	Anodyne	NAMPT	35	40
CC[C@H](C)c1ccc(C(=O)N2CCCO[C@H](C(C)C)C2)cc1	ZINC000819411334	DI	On-Demand	Anodyne	L3MBTL3	55	38
O=C(Cc1ccc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1)N1CCOCC1	ZINC000819411335	GE	On-Demand	Bother	KCNJ1	22	43
O=C(Cc1ccc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1)N1CCOCC1	ZINC000819411337	GE	On-Demand	Bother	KCNJ1	22	43
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCCO[C@H](C(C)C)C2)CC1	ZINC000819411345	GH	On-Demand	Bother	SLC6A9	22	49
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCCO[C@@H](C(C)C)C2)CC1	ZINC000819411348	GH	On-Demand	Bother	SLC6A9	22	49
COCCOc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819411351	FH	On-Demand	Anodyne	ADRB2	57	56
COCCOc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819411351	FH	On-Demand	Anodyne	ADRB1	82	56
COCCOc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819411351	FH	On-Demand	Anodyne	ADRB3	41	56
COCCOc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819411351	FH	On-Demand	Anodyne	CASR	40	37
COCCOc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819411351	FH	On-Demand	Anodyne	CYP2D6	24	46
COCCOc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819411353	FH	On-Demand	Anodyne	ADRB2	57	56
COCCOc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819411353	FH	On-Demand	Anodyne	ADRB1	82	56
COCCOc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819411353	FH	On-Demand	Anodyne	ADRB3	41	56
COCCOc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819411353	FH	On-Demand	Anodyne	CASR	40	37
COCCOc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819411353	FH	On-Demand	Anodyne	CYP2D6	24	46
O=S1(=O)CCCN1c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819411409	FG	On-Demand	Anodyne	ADRB1	25	41
O=S1(=O)CCCN1c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819411409	FG	On-Demand	Anodyne	CDK1	15	44
O=S1(=O)CCCN1c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819411409	FG	On-Demand	Anodyne	CYP3A4	48	36
O=S1(=O)CCCN1c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819411410	FG	On-Demand	Anodyne	ADRB1	25	41
O=S1(=O)CCCN1c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819411410	FG	On-Demand	Anodyne	CDK1	15	44
O=S1(=O)CCCN1c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819411410	FG	On-Demand	Anodyne	CYP3A4	48	36
O=S1(=O)CCCN1c1cccc(NC[C@H](O)c2cccc(F)c2)c1	ZINC000819411411	FF	On-Demand	Anodyne	CDK1	15	44
O=S1(=O)CCCN1c1cccc(NC[C@@H](O)c2cccc(F)c2)c1	ZINC000819411412	FF	On-Demand	Anodyne	CDK1	15	44
COCCOc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819411413	FE	On-Demand	Anodyne	ADRB2	23	41
COCCOc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819411413	FE	On-Demand	Anodyne	ADRB1	48	41
COCCOc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819411413	FE	On-Demand	Anodyne	GRIN1	15	50
COCCOc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819411413	FE	On-Demand	Anodyne	EDNRA	40	39
COCCOc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819411414	FE	On-Demand	Anodyne	ADRB2	23	41
COCCOc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819411414	FE	On-Demand	Anodyne	ADRB1	48	41
COCCOc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819411414	FE	On-Demand	Anodyne	GRIN1	15	50
COCCOc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819411414	FE	On-Demand	Anodyne	EDNRA	40	39
CN1CCCN(c2ccc(NC[C@H](O)COc3ccc(CC#N)cc3)cc2)CC1	ZINC000819411419	GF	On-Demand	Mild	ADRB1	46	39
COc1cc(NC[C@](C)(O)C(F)(F)F)ccc1NC(=O)OC(C)(C)C	ZINC000819411420	FH	On-Demand	Anodyne	DRTS_TRYCR	43	29
COc1cc(NC[C@@](C)(O)C(F)(F)F)ccc1NC(=O)OC(C)(C)C	ZINC000819411421	FH	On-Demand	Anodyne	DRTS_TRYCR	43	29
CN1CCCN(c2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2)CC1	ZINC000819411426	GG	On-Demand	Anodyne	ADRB2	18	56
CN1CCCN(c2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2)CC1	ZINC000819411426	GG	On-Demand	Anodyne	ADRB1	23	56
CN1CCCN(c2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2)CC1	ZINC000819411427	GG	On-Demand	Anodyne	ADRB2	18	56
CN1CCCN(c2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2)CC1	ZINC000819411427	GG	On-Demand	Anodyne	ADRB1	23	56
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COCc1ccccc1	ZINC000819411438	FG	On-Demand	Anodyne	ADRB1	38	42
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COCc1ccccc1	ZINC000819411439	FG	On-Demand	Anodyne	ADRB1	38	42
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COCc1ccccc1	ZINC000819411440	FG	On-Demand	Anodyne	ADRB1	38	42
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COCc1ccccc1	ZINC000819411441	FG	On-Demand	Anodyne	ADRB1	38	42
CN1CCCN(c2ccc(NCC3(O)CCS(=O)(=O)CC3)cc2)CC1	ZINC000819411456	FD	On-Demand	Anodyne	PRNP	30	40
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1nc(Cl)ccc1Cl	ZINC000819411457	IK	On-Demand	Anodyne	CNR1	52	32
C=C(C)C(C)(C)C(=O)NNc1ccc(OC(F)(F)F)cc1	ZINC000819411492	DH	On-Demand	Reactive	P2RY1	49	38
C=C(C)C(C)(C)C(=O)NNc1ccc(OC(F)(F)F)cc1	ZINC000819411492	DH	On-Demand	Reactive	EPHX2	46	41
CN1CCCN(c2ccc(NCC(C)(C)O)cc2)CC1	ZINC000819411495	CE	On-Demand	Anodyne	PRNP	26	40
CN1CCCN(c2ccc(NCCC(=O)Nc3cccnc3)cc2)CC1	ZINC000819411496	FF	On-Demand	Anodyne	LCK	22	41
CN1CCCN(c2ccc(NCCC(=O)Nc3cccnc3)cc2)CC1	ZINC000819411496	FF	On-Demand	Anodyne	CHRNA7	19	42
CN1CCCN(c2ccc(NCCC(=O)Nc3cccnc3)cc2)CC1	ZINC000819411496	FF	On-Demand	Anodyne	PRNP	39	42
CN1CCCN(c2ccc(NCCC(=O)Nc3cccnc3)cc2)CC1	ZINC000819411496	FF	On-Demand	Anodyne	HCK	16	41
CN1CCCN(c2ccc(NCCC(=O)Nc3cccnc3)cc2)CC1	ZINC000819411496	FF	On-Demand	Anodyne	FLT3	16	50
CN1CCCN(c2ccc(NCCC(=O)Nc3cccnc3)cc2)CC1	ZINC000819411496	FF	On-Demand	Anodyne	STAT6	48	39
CN1CCCN(c2ccc(NC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819411512	EE	On-Demand	Anodyne	ADRB2	21	40
CN1CCCN(c2ccc(NC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819411512	EE	On-Demand	Anodyne	ADRB3	83	54
CN1CCCN(c2ccc(NC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819411513	EE	On-Demand	Anodyne	ADRB2	21	40
CN1CCCN(c2ccc(NC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819411513	EE	On-Demand	Anodyne	ADRB3	83	54
CC(C)[C@H]1CN(C(=O)[C@@H]2CSCN2C(=O)OC(C)(C)C)CCCO1	ZINC000819411553	FF	On-Demand	Anodyne	PREP	16	44
CC(C)[C@H]1CN(C(=O)[C@H]2CSCN2C(=O)OC(C)(C)C)CCCO1	ZINC000819411555	FF	On-Demand	Anodyne	PREP	16	44
CC(C)[C@H]1CN(C(=O)c2cc(-c3cccs3)nc3ccccc23)CCCO1	ZINC000819411566	GJ	On-Demand	Anodyne	TACR3	19	46
CC(C)[C@H]1CN(C(=O)/C(=C/c2ccco2)NC(=O)c2ccccc2)CCCO1	ZINC000819411572	GG	On-Demand	Anodyne	ADAM12	24	41
Cc1nnc(-c2cccc(NC(=O)C(F)=C3CCC3)c2)n1C	ZINC000819411573	DG	On-Demand	Anodyne	PTPN11	43	32
CC(C)[C@H]1CN(C(=O)/C(=C\c2ccco2)NC(=O)c2ccccc2)CCCO1	ZINC000819411574	GG	On-Demand	Anodyne	ADAM12	24	41
O=C(NC[C@@H](O)c1ccccn1)c1cc2c(cn1)OCCO2	ZINC000819411590	DC	On-Demand	Anodyne	SCD1	16	44
O=C(NC[C@H](O)c1ccccn1)c1cc2c(cn1)OCCO2	ZINC000819411591	DC	On-Demand	Anodyne	SCD1	16	44
COCCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819411605	GH	On-Demand	Anodyne	ADRB2	33	40
COCCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819411605	GH	On-Demand	Anodyne	ADRB1	48	40
COCCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819411607	GH	On-Demand	Anodyne	ADRB2	33	40
COCCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819411607	GH	On-Demand	Anodyne	ADRB1	48	40
CC(C)[C@H]1CN(C(=O)c2ccnc(C(F)(F)F)c2)CCCO1	ZINC000819411618	DF	On-Demand	Anodyne	HPGD	40	36
CC(C)[C@H]1CN(C(=O)c2cc(=O)c3ccccc3o2)CCCO1	ZINC000819411633	DF	On-Demand	Anodyne	TNKS	25	47
COCCOc1ccc(NC[C@H](O)COc2ccc(Br)cc2)cc1	ZINC000819411652	GG	On-Demand	Anodyne	ADRB2	46	48
COCCOc1ccc(NC[C@H](O)COc2ccc(Br)cc2)cc1	ZINC000819411652	GG	On-Demand	Anodyne	ADRB1	66	48
COCCOc1ccc(NC[C@H](O)COc2ccc(Br)cc2)cc1	ZINC000819411652	GG	On-Demand	Anodyne	ADRB3	37	42
COCCOc1ccc(NC[C@@H](O)COc2ccc(Br)cc2)cc1	ZINC000819411653	GG	On-Demand	Anodyne	ADRB2	46	48
COCCOc1ccc(NC[C@@H](O)COc2ccc(Br)cc2)cc1	ZINC000819411653	GG	On-Demand	Anodyne	ADRB1	66	48
COCCOc1ccc(NC[C@@H](O)COc2ccc(Br)cc2)cc1	ZINC000819411653	GG	On-Demand	Anodyne	ADRB3	37	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	ACE	46	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	ELANE	36	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	MME	25	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	CMA1	18	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	CTRA_BOVIN	68	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	BMP1	22	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	KLK3	81	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	CTSB	71	47
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	PAPA1_CARPA	80	38
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	CYSP_TRYCR	57	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	NTSR1	59	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	CTSG	46	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	CTSK	64	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	CTSL	51	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	CCR1	30	47
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	PREP	23	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	CAPNS1	65	38
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	CELA2A	55	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	MMP11	40	31
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	CTSS	29	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	CAPN1	86	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	CASP1	26	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	CTRC	16	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	CAPN2	143	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	CASP9	30	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	TGM2	32	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	TPSAB1	53	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	NPR	67	39
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	CASP10	35	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	PSMB5	50	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	F2RL1	20	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819411673	GH	On-Demand	Anodyne	SLC12A5	51	34
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	ACE	46	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	ELANE	36	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	MME	25	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	CMA1	18	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	CTRA_BOVIN	68	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	BMP1	22	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	KLK3	81	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	CTSB	71	47
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	PAPA1_CARPA	80	38
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	CYSP_TRYCR	57	42
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	NTSR1	59	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	CTSG	46	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	CTSK	64	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	CTSL	51	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	CCR1	30	47
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	PREP	23	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	CAPNS1	65	38
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	CELA2A	55	35
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	MMP11	40	31
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	CTSS	29	48
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	CAPN1	86	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	CASP1	26	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	CTRC	16	46
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	CAPN2	143	45
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	CASP9	30	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	TGM2	32	44
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	TPSAB1	53	36
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	NPR	67	39
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	CASP10	35	40
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	PSMB5	50	41
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	F2RL1	20	43
CC[C@H](C)[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819411674	GH	On-Demand	Anodyne	SLC12A5	51	34
CON(C)C(=O)CCNc1ccc(CN2CCN(c3cccc(C)c3)CC2)cc1	ZINC000819411681	GG	On-Demand	Anodyne	HTR1A	26	43
CON(C)C(=O)CCNc1ccc(CN2CCN(c3cccc(C)c3)CC2)cc1	ZINC000819411681	GG	On-Demand	Anodyne	DRD2	21	43
CON(C)C(=O)CCNc1ccc(CN2CCN(c3cccc(C)c3)CC2)cc1	ZINC000819411681	GG	On-Demand	Anodyne	DRD4	45	37
CON(C)C(=O)CCNc1ccc(CN2CCN(c3cccc(C)c3)CC2)cc1	ZINC000819411681	GG	On-Demand	Anodyne	DRD3	22	43
C[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)S(C)(=O)=O	ZINC000819411722	DE	On-Demand	Anodyne	TNK2	41	35
C[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)S(C)(=O)=O	ZINC000819411723	DE	On-Demand	Anodyne	TNK2	41	35
COc1cc(NC[C@H](O)C2CC2)ccc1NC(=O)OC(C)(C)C	ZINC000819411728	DG	On-Demand	Anodyne	ENPP1	48	30
COc1cc(NC[C@@H](O)C2CC2)ccc1NC(=O)OC(C)(C)C	ZINC000819411729	DG	On-Demand	Anodyne	ENPP1	48	30
O=C(/C=C/[C@@H]1CCCO1)NNc1ccc(OC(F)(F)F)cc1	ZINC000819411730	DF	On-Demand	Reactive	CTSS	15	42
O=C(/C=C/[C@@H]1CCCO1)NNc1ccc(OC(F)(F)F)cc1	ZINC000819411730	DF	On-Demand	Reactive	EPHX2	42	42
O=C(/C=C\[C@H]1CCCO1)NNc1ccc(OC(F)(F)F)cc1	ZINC000819411731	DF	On-Demand	Reactive	CTSS	15	42
O=C(/C=C\[C@H]1CCCO1)NNc1ccc(OC(F)(F)F)cc1	ZINC000819411731	DF	On-Demand	Reactive	EPHX2	42	42
O=C(/C=C\[C@@H]1CCCO1)NNc1ccc(OC(F)(F)F)cc1	ZINC000819411732	DF	On-Demand	Reactive	CTSS	15	42
O=C(/C=C\[C@@H]1CCCO1)NNc1ccc(OC(F)(F)F)cc1	ZINC000819411732	DF	On-Demand	Reactive	EPHX2	42	42
O=C(/C=C/[C@H]1CCCO1)NNc1ccc(OC(F)(F)F)cc1	ZINC000819411733	DF	On-Demand	Reactive	CTSS	15	42
O=C(/C=C/[C@H]1CCCO1)NNc1ccc(OC(F)(F)F)cc1	ZINC000819411733	DF	On-Demand	Reactive	EPHX2	42	42
CN1CCCN(c2ccc(NC[C@H](O)c3ccc(Cl)cc3)cc2)CC1	ZINC000819411734	FH	On-Demand	Anodyne	DRD4	17	41
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)c1	ZINC000819411743	GG	On-Demand	Bother	ADRB2	16	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)c1	ZINC000819411743	GG	On-Demand	Bother	ADRB1	39	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)c1	ZINC000819411743	GG	On-Demand	Bother	ADRB3	18	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)c1	ZINC000819411744	GG	On-Demand	Bother	ADRB2	16	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)c1	ZINC000819411744	GG	On-Demand	Bother	ADRB1	39	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)c1	ZINC000819411744	GG	On-Demand	Bother	ADRB3	18	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)c1	ZINC000819411745	GG	On-Demand	Bother	ADRB2	16	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)c1	ZINC000819411745	GG	On-Demand	Bother	ADRB1	39	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)c1	ZINC000819411745	GG	On-Demand	Bother	ADRB3	18	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)c1	ZINC000819411746	GG	On-Demand	Bother	ADRB2	16	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)c1	ZINC000819411746	GG	On-Demand	Bother	ADRB1	39	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)c1	ZINC000819411746	GG	On-Demand	Bother	ADRB3	18	43
CN1CCCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819411752	FF	On-Demand	Anodyne	ADRB2	49	47
CN1CCCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819411752	FF	On-Demand	Anodyne	ADRB1	64	40
CN1CCCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819411752	FF	On-Demand	Anodyne	ADRB3	44	41
CN1CCCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819411752	FF	On-Demand	Anodyne	PRNP	26	40
CN1CCCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819411752	FF	On-Demand	Anodyne	ABCB1	22	41
CN1CCCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819411753	FF	On-Demand	Anodyne	ADRB2	49	47
CN1CCCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819411753	FF	On-Demand	Anodyne	ADRB1	64	40
CN1CCCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819411753	FF	On-Demand	Anodyne	ADRB3	44	41
CN1CCCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819411753	FF	On-Demand	Anodyne	PRNP	26	40
CN1CCCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819411753	FF	On-Demand	Anodyne	ABCB1	22	41
CN1CCCN(c2ccc(NC[C@H](O)COc3ccc(C#N)cc3)cc2)CC1	ZINC000819411755	GF	On-Demand	Mild	TNIK	23	40
CN1CCCN(c2ccc(NC[C@@H](O)COc3ccc(C#N)cc3)cc2)CC1	ZINC000819411756	GF	On-Demand	Mild	TNIK	23	40
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)cc1	ZINC000819411783	FF	On-Demand	Anodyne	ADRB2	30	48
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)cc1	ZINC000819411783	FF	On-Demand	Anodyne	ADRB1	40	42
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)cc1	ZINC000819411784	FF	On-Demand	Anodyne	ADRB2	30	48
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)cc1	ZINC000819411784	FF	On-Demand	Anodyne	ADRB1	40	42
CN1CCCN(c2ccc(NCCS(=O)(=O)c3ccc(F)cc3)cc2)CC1	ZINC000819411803	GF	On-Demand	Anodyne	HTR6	15	45
CC(C)[C@H]1CN(C(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)CCCO1	ZINC000819411865	FD	On-Demand	Anodyne	CA6	18	43
CC(C)[C@H]1CN(C(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)CCCO1	ZINC000819411865	FD	On-Demand	Anodyne	CA7	17	43
CC(C)[C@H]1CN(C(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)CCCO1	ZINC000819411865	FD	On-Demand	Anodyne	CA13	34	43
CC(C)c1ccc2cc(C(=O)N3CCCO[C@H](C(C)C)C3)[nH]c2c1	ZINC000819411884	EI	On-Demand	Anodyne	GRIN2B	21	42
CC(C)c1ccc2cc(C(=O)N3CCCO[C@H](C(C)C)C3)[nH]c2c1	ZINC000819411884	EI	On-Demand	Anodyne	HRH4	29	44
CC(C)c1ccc2cc(C(=O)N3CCCO[C@@H](C(C)C)C3)[nH]c2c1	ZINC000819411886	EI	On-Demand	Anodyne	GRIN2B	21	42
CC(C)c1ccc2cc(C(=O)N3CCCO[C@@H](C(C)C)C3)[nH]c2c1	ZINC000819411886	EI	On-Demand	Anodyne	HRH4	29	44
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	ACE	28	49
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	ELANE	25	43
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	CTRA_BOVIN	51	32
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	KLK3	76	35
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	CTSB	57	39
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	PAPA1_CARPA	45	33
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	TRY1_BOVIN	44	32
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	CYSP_TRYCR	46	39
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	CTSG	40	31
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	CTSK	44	42
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	CTSL	44	42
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	PREP	55	54
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	CAPNS1	60	36
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	CELA2A	41	32
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	REN	15	40
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	CTSS	23	42
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	CAPN1	74	43
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	CAPN2	126	43
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	TGM2	35	46
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	KLK5	41	44
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	TPSAB1	45	40
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	NPR	77	42
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	SLC12A5	52	34
CC(C)[C@H]1CN(C(=O)CCCNC(=O)OCc2ccccc2)CCCO1	ZINC000819411896	FF	On-Demand	Anodyne	TMPRSS11D	48	41
CC(C)[C@H]1CN(C(=O)c2cc(S(=O)(=O)NC3CC3)ccc2Br)CCCO1	ZINC000819411915	IF	On-Demand	Anodyne	SFRP1	62	34
CC(C)[C@H]1CN(C(=O)c2cc(S(=O)(=O)NC3CC3)ccc2Br)CCCO1	ZINC000819411915	IF	On-Demand	Anodyne	WNT3	40	32
O=C(Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)N1CCOCC1	ZINC000819411916	FF	On-Demand	Anodyne	ADRB1	29	56
O=C(Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)N1CCOCC1	ZINC000819411916	FF	On-Demand	Anodyne	ADRB3	45	46
O=C(Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)N1CCOCC1	ZINC000819411916	FF	On-Demand	Anodyne	IGF1R	29	41
O=C(Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)N1CCOCC1	ZINC000819411916	FF	On-Demand	Anodyne	CYP3A4	49	38
O=C(Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)N1CCOCC1	ZINC000819411921	FF	On-Demand	Anodyne	ADRB1	29	56
O=C(Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)N1CCOCC1	ZINC000819411921	FF	On-Demand	Anodyne	ADRB3	45	46
O=C(Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)N1CCOCC1	ZINC000819411921	FF	On-Demand	Anodyne	IGF1R	29	41
O=C(Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)N1CCOCC1	ZINC000819411921	FF	On-Demand	Anodyne	CYP3A4	49	38
CC(C)[C@H]1CN(C(=O)c2ccc(Br)c(S(C)(=O)=O)c2)CCCO1	ZINC000819411945	HF	On-Demand	Anodyne	L3MBTL3	59	38
CC(C)[C@H]1CN(C(=O)/C=C\c2ccc(Cl)cc2)CCCO1	ZINC000819411946	DH	On-Demand	Anodyne	ITGAL	22	42
CC(C)[C@H]1CN(C(=O)/C=C/c2ccc(Cl)cc2)CCCO1	ZINC000819411950	DH	On-Demand	Anodyne	ITGAL	22	42
CC(C)[C@H]1CN(C(=O)c2cc3c4ccccc4n(C)c3s2)CCCO1	ZINC000819411952	FI	On-Demand	Anodyne	SLC16A1	48	36
COCCOc1ccc(NC[C@H](O)COC(C)C)cc1	ZINC000819411974	CD	On-Demand	Anodyne	ADRB2	33	46
COCCOc1ccc(NC[C@H](O)COC(C)C)cc1	ZINC000819411974	CD	On-Demand	Anodyne	ADRB1	46	46
COCCOc1ccc(NC[C@@H](O)COC(C)C)cc1	ZINC000819411979	CD	On-Demand	Anodyne	ADRB2	33	46
COCCOc1ccc(NC[C@@H](O)COC(C)C)cc1	ZINC000819411979	CD	On-Demand	Anodyne	ADRB1	46	46
COCCOc1ccc(NC[C@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819411993	GH	On-Demand	Anodyne	ADRB2	33	40
COCCOc1ccc(NC[C@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819411993	GH	On-Demand	Anodyne	ADRB1	49	41
COCCOc1ccc(NC[C@@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819411997	GH	On-Demand	Anodyne	ADRB2	33	40
COCCOc1ccc(NC[C@@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819411997	GH	On-Demand	Anodyne	ADRB1	49	41
CC(C)[C@H]1CN(C(=O)CNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)CCCO1	ZINC000819412000	GD	On-Demand	Anodyne	PGA5	23	40
CC(C)[C@H]1CN(C(=O)c2cc(S(=O)(=O)NC3CC3)c(Cl)cc2Cl)CCCO1	ZINC000819412019	IG	On-Demand	Anodyne	CCR8	69	33
CC(C)[C@H]1CN(C(=O)c2cc(S(=O)(=O)NC3CC3)c(Cl)cc2Cl)CCCO1	ZINC000819412019	IG	On-Demand	Anodyne	SFRP1	55	38
O=C(NNc1ccc(OC(F)(F)F)cc1)C(F)=C1CCC1	ZINC000819412023	DG	On-Demand	Reactive	P2RY1	46	41
O=C(NNc1ccc(OC(F)(F)F)cc1)C(F)=C1CCC1	ZINC000819412023	DG	On-Demand	Reactive	EPHX2	43	43
CN1CCCN(c2ccc(NCCC(=O)Nc3cccc(Cl)c3)cc2)CC1	ZINC000819412041	GH	On-Demand	Anodyne	HTR1A	24	51
CN1CCCN(c2ccc(NCCC(=O)Nc3cccc(Cl)c3)cc2)CC1	ZINC000819412041	GH	On-Demand	Anodyne	DRD2	15	51
CN1CCCN(c2ccc(NCCC(=O)Nc3cccc(Cl)c3)cc2)CC1	ZINC000819412041	GH	On-Demand	Anodyne	DRD1	41	35
CN1CCCN(c2ccc(NCCC(=O)Nc3cccc(Cl)c3)cc2)CC1	ZINC000819412041	GH	On-Demand	Anodyne	HTR1B	25	42
CN1CCCN(c2ccc(NCCC(=O)Nc3cccc(Cl)c3)cc2)CC1	ZINC000819412041	GH	On-Demand	Anodyne	HTR2A	18	42
CN1CCCN(c2ccc(NCCC(=O)Nc3cccc(Cl)c3)cc2)CC1	ZINC000819412041	GH	On-Demand	Anodyne	HTR7	18	40
CN1CCCN(c2ccc(NCCC(=O)Nc3cccc(Cl)c3)cc2)CC1	ZINC000819412041	GH	On-Demand	Anodyne	LCK	23	41
CN1CCCN(c2ccc(NCCC(=O)Nc3cccc(Cl)c3)cc2)CC1	ZINC000819412041	GH	On-Demand	Anodyne	PRNP	36	40
CN1CCCN(c2ccc(NCCC(=O)Nc3cccc(Cl)c3)cc2)CC1	ZINC000819412041	GH	On-Demand	Anodyne	FLT3	16	42
CC[C@H](O)CNc1ccc(OC)c(N2CCCCC2=O)c1	ZINC000819412055	CE	On-Demand	Anodyne	DRTS_TRYCR	44	31
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1ccccc1F	ZINC000819412057	FG	On-Demand	Anodyne	ADRB1	56	35
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1ccccc1F	ZINC000819412058	FG	On-Demand	Anodyne	ADRB1	56	35
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1ccccc1F	ZINC000819412060	FG	On-Demand	Anodyne	ADRB1	56	35
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1ccccc1F	ZINC000819412062	FG	On-Demand	Anodyne	ADRB1	56	35
COc1cc(NCCC(=O)Nc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000819412063	GI	On-Demand	Anodyne	DRTS_TRYCR	45	32
CN1CCCN(c2ccc(NCCS(=O)(=O)c3ccc(C#N)cn3)cc2)CC1	ZINC000819412070	GD	On-Demand	Mild	TNIK	23	41
N#CCc1ccc(OC[C@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)cc1	ZINC000819412081	GG	On-Demand	Mild	ADRB1	51	48
N#CCc1ccc(OC[C@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)cc1	ZINC000819412082	GG	On-Demand	Mild	ADRB1	51	48
N#CCc1ccc(OC[C@@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)cc1	ZINC000819412083	GG	On-Demand	Mild	ADRB1	51	48
N#CCc1ccc(OC[C@@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)cc1	ZINC000819412085	GG	On-Demand	Mild	ADRB1	51	48
CN1CCCN(c2ccc(NCCC(=O)Nc3cc(F)cc(F)c3)cc2)CC1	ZINC000819412089	GH	On-Demand	Anodyne	HTR1B	19	42
CN1CCCN(c2ccc(NCCC(=O)Nc3cc(F)cc(F)c3)cc2)CC1	ZINC000819412089	GH	On-Demand	Anodyne	PRNP	32	40
CN1CCCN(c2ccc(NCCC(=O)Nc3cc(F)cc(F)c3)cc2)CC1	ZINC000819412089	GH	On-Demand	Anodyne	STAT6	45	38
O=C(Cc1ccc(NC[C@H](O)c2ccccc2F)cc1)N1CCOCC1	ZINC000819412095	FE	On-Demand	Anodyne	CTSS	19	41
O=C(Cc1ccc(NC[C@@H](O)c2ccccc2F)cc1)N1CCOCC1	ZINC000819412099	FE	On-Demand	Anodyne	CTSS	19	41
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819412105	FG	On-Demand	Anodyne	ADRB2	58	61
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819412105	FG	On-Demand	Anodyne	ADRB1	90	61
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819412105	FG	On-Demand	Anodyne	TSHR	41	33
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819412105	FG	On-Demand	Anodyne	ADRB3	52	50
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819412105	FG	On-Demand	Anodyne	ABCB1	23	41
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819412107	FG	On-Demand	Anodyne	ADRB2	58	61
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819412107	FG	On-Demand	Anodyne	ADRB1	90	61
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819412107	FG	On-Demand	Anodyne	TSHR	41	33
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819412107	FG	On-Demand	Anodyne	ADRB3	52	50
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819412107	FG	On-Demand	Anodyne	ABCB1	23	41
CN1CCCN(c2ccc(NCCS(=O)(=O)c3ccccc3)cc2)CC1	ZINC000819412120	FF	On-Demand	Anodyne	HTR7	21	42
CN1CCCN(c2ccc(NCCS(=O)(=O)c3ccccc3)cc2)CC1	ZINC000819412120	FF	On-Demand	Anodyne	HTR6	19	43
CN1CCCN(c2ccc(NCCS(=O)(=O)c3ccccc3)cc2)CC1	ZINC000819412120	FF	On-Demand	Anodyne	PRNP	26	42
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1ccccc1	ZINC000819412127	EG	On-Demand	Anodyne	ADRB2	49	45
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1ccccc1	ZINC000819412127	EG	On-Demand	Anodyne	ADRB1	76	48
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1ccccc1	ZINC000819412127	EG	On-Demand	Anodyne	ADRB3	51	41
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1ccccc1	ZINC000819412128	EG	On-Demand	Anodyne	ADRB2	49	45
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1ccccc1	ZINC000819412128	EG	On-Demand	Anodyne	ADRB1	76	48
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1ccccc1	ZINC000819412128	EG	On-Demand	Anodyne	ADRB3	51	41
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1ccccc1	ZINC000819412130	EG	On-Demand	Anodyne	ADRB2	49	45
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1ccccc1	ZINC000819412130	EG	On-Demand	Anodyne	ADRB1	76	48
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1ccccc1	ZINC000819412130	EG	On-Demand	Anodyne	ADRB3	51	41
COCCOc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819412136	DG	On-Demand	Anodyne	ADRB2	39	43
COCCOc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819412136	DG	On-Demand	Anodyne	ADRB1	61	43
COCCOc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819412136	DG	On-Demand	Anodyne	ADRB3	41	40
COCCOc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819412136	DG	On-Demand	Anodyne	LTA4H	44	44
COCCOc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819412136	DG	On-Demand	Anodyne	S1PR4	26	41
COCCOc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819412136	DG	On-Demand	Anodyne	S1PR3	15	41
COCCOc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819412136	DG	On-Demand	Anodyne	MMP2	15	41
COCCOc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819412137	DG	On-Demand	Anodyne	ADRB2	39	43
COCCOc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819412137	DG	On-Demand	Anodyne	ADRB1	61	43
COCCOc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819412137	DG	On-Demand	Anodyne	ADRB3	41	40
COCCOc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819412137	DG	On-Demand	Anodyne	LTA4H	44	44
COCCOc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819412137	DG	On-Demand	Anodyne	S1PR4	26	41
COCCOc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819412137	DG	On-Demand	Anodyne	S1PR3	15	41
COCCOc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819412137	DG	On-Demand	Anodyne	MMP2	15	41
COCCOc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819412139	FH	On-Demand	Anodyne	ADRB2	56	58
COCCOc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819412139	FH	On-Demand	Anodyne	ADRB1	72	45
COCCOc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819412139	FH	On-Demand	Anodyne	ADRB3	42	45
COCCOc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819412139	FH	On-Demand	Anodyne	CASR	42	38
COCCOc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819412139	FH	On-Demand	Anodyne	CYP2D6	17	46
COCCOc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819412140	FH	On-Demand	Anodyne	ADRB2	56	58
COCCOc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819412140	FH	On-Demand	Anodyne	ADRB1	72	45
COCCOc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819412140	FH	On-Demand	Anodyne	ADRB3	42	45
COCCOc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819412140	FH	On-Demand	Anodyne	CASR	42	38
COCCOc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819412140	FH	On-Demand	Anodyne	CYP2D6	17	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc3ccc(O)cc13)C2	ZINC000819412147	FG	On-Demand	Anodyne	TRPV1	17	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc3ccc(O)cc13)C2	ZINC000819412148	FG	On-Demand	Anodyne	TRPV1	17	44
COCCOc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819412153	FE	On-Demand	Anodyne	ADRB2	19	42
COCCOc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819412153	FE	On-Demand	Anodyne	ADRB1	19	40
COCCOc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819412153	FE	On-Demand	Anodyne	ADRB3	33	42
COCCOc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819412154	FE	On-Demand	Anodyne	ADRB2	19	42
COCCOc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819412154	FE	On-Demand	Anodyne	ADRB1	19	40
COCCOc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819412154	FE	On-Demand	Anodyne	ADRB3	33	42
COCCOc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819412163	FH	On-Demand	Anodyne	PDS	42	40
COCCOc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819412164	FH	On-Demand	Anodyne	PDS	42	40
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819412181	HH	On-Demand	Anodyne	FPR1	40	34
COc1ccccc1[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819412182	HH	On-Demand	Anodyne	FPR1	40	34
CC(C)[C@H]1CN(C(=O)c2ccc3c(=O)n(-c4ccccc4)c(O)nc3c2)CCCO1	ZINC000819412196	HF	On-Demand	Anodyne	HPGD	47	39
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1ccccc1	ZINC000819412220	EG	On-Demand	Anodyne	ADRB2	49	45
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1ccccc1	ZINC000819412220	EG	On-Demand	Anodyne	ADRB1	76	48
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1ccccc1	ZINC000819412220	EG	On-Demand	Anodyne	ADRB3	51	41
CN1CCCN(c2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819412227	FH	On-Demand	Anodyne	ADRB1	26	45
CN1CCCN(c2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819412227	FH	On-Demand	Anodyne	ADRB3	40	39
CN1CCCN(c2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819412227	FH	On-Demand	Anodyne	IGF1R	30	47
CN1CCCN(c2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819412227	FH	On-Demand	Anodyne	CYP3A4	51	41
CN1CCCN(c2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819412229	FH	On-Demand	Anodyne	ADRB1	26	45
CN1CCCN(c2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819412229	FH	On-Demand	Anodyne	ADRB3	40	39
CN1CCCN(c2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819412229	FH	On-Demand	Anodyne	IGF1R	30	47
CN1CCCN(c2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819412229	FH	On-Demand	Anodyne	CYP3A4	51	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)c1	ZINC000819412243	GF	On-Demand	Anodyne	ADRB2	17	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)c1	ZINC000819412243	GF	On-Demand	Anodyne	DRD4	45	38
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)c1	ZINC000819412243	GF	On-Demand	Anodyne	PRNP	50	37
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)c1	ZINC000819412243	GF	On-Demand	Anodyne	ABCB1	33	49
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)c1	ZINC000819412245	GF	On-Demand	Anodyne	ADRB2	17	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)c1	ZINC000819412245	GF	On-Demand	Anodyne	DRD4	45	38
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)c1	ZINC000819412245	GF	On-Demand	Anodyne	PRNP	50	37
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)c1	ZINC000819412245	GF	On-Demand	Anodyne	ABCB1	33	49
Cc1ccc(OC[C@@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)cc1	ZINC000819412282	FG	On-Demand	Anodyne	ADRB2	33	49
Cc1ccc(OC[C@@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)cc1	ZINC000819412282	FG	On-Demand	Anodyne	ADRB1	48	49
Cc1ccc(OC[C@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)cc1	ZINC000819412284	FG	On-Demand	Anodyne	ADRB2	33	49
Cc1ccc(OC[C@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)cc1	ZINC000819412284	FG	On-Demand	Anodyne	ADRB1	48	49
Cc1ccc(OC[C@@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)cc1	ZINC000819412286	FG	On-Demand	Anodyne	ADRB2	33	49
Cc1ccc(OC[C@@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)cc1	ZINC000819412286	FG	On-Demand	Anodyne	ADRB1	48	49
Cc1ccc(OC[C@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)cc1	ZINC000819412288	FG	On-Demand	Anodyne	ADRB2	33	49
Cc1ccc(OC[C@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)cc1	ZINC000819412288	FG	On-Demand	Anodyne	ADRB1	48	49
COc1cc(NCCS(C)(=O)=O)ccc1NC(=O)OC(C)(C)C	ZINC000819412290	EE	On-Demand	Anodyne	DRTS_TRYCR	46	32
CN1CCCN(c2ccc(NCCC(N)=O)cc2)CC1	ZINC000819412299	CD	On-Demand	Anodyne	PRNP	37	43
CN1CCCN(c2ccc(NCCC(N)=O)cc2)CC1	ZINC000819412299	CD	On-Demand	Anodyne	STAT6	66	41
CC(C)[C@H]1CN(C(=O)c2ccc(SC(F)(F)F)cc2)CCCO1	ZINC000819412318	EI	On-Demand	Anodyne	MLYCD	17	40
CC(C)[C@H]1CN(C(=O)c2ccc(SC(F)(F)F)cc2)CCCO1	ZINC000819412318	EI	On-Demand	Anodyne	L3MBTL3	40	36
CS(=O)(=O)c1ccc(NNC(=O)C(F)=C2CCC2)cc1	ZINC000819412345	CD	On-Demand	Reactive	PTGS2	16	45
CN1CCCN(c2ccc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cc2)CC1	ZINC000819412346	FF	On-Demand	Bother	SSTR1	32	40
CN1CCCN(c2ccc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cc2)CC1	ZINC000819412346	FF	On-Demand	Bother	WDR5	31	40
CN1CCCN(c2ccc(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2)CC1	ZINC000819412347	FF	On-Demand	Bother	SSTR1	32	40
CN1CCCN(c2ccc(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2)CC1	ZINC000819412347	FF	On-Demand	Bother	WDR5	31	40
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)cc1	ZINC000819412348	GG	On-Demand	Anodyne	ADRB2	30	45
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)cc1	ZINC000819412348	GG	On-Demand	Anodyne	ADRB1	57	49
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)cc1	ZINC000819412349	GG	On-Demand	Anodyne	ADRB2	30	45
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)cc1	ZINC000819412349	GG	On-Demand	Anodyne	ADRB1	57	49
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)cc1	ZINC000819412350	GG	On-Demand	Anodyne	ADRB2	30	45
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)cc1	ZINC000819412350	GG	On-Demand	Anodyne	ADRB1	57	49
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)cc1	ZINC000819412351	GG	On-Demand	Anodyne	ADRB2	30	45
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)cc1	ZINC000819412351	GG	On-Demand	Anodyne	ADRB1	57	49
COCCOc1ccc(NC[C@@H](O)CO[C@@H]2CCCc3ccccc32)cc1	ZINC000819412373	FH	On-Demand	Anodyne	ADRB1	41	41
COCCOc1ccc(NC[C@@H](O)CO[C@@H]2CCCc3ccccc32)cc1	ZINC000819412373	FH	On-Demand	Anodyne	ADRB3	16	41
COCCOc1ccc(NC[C@@H](O)CO[C@H]2CCCc3ccccc32)cc1	ZINC000819412374	FH	On-Demand	Anodyne	ADRB1	41	41
COCCOc1ccc(NC[C@@H](O)CO[C@H]2CCCc3ccccc32)cc1	ZINC000819412374	FH	On-Demand	Anodyne	ADRB3	16	41
COCCOc1ccc(NC[C@H](O)CO[C@@H]2CCCc3ccccc32)cc1	ZINC000819412375	FH	On-Demand	Anodyne	ADRB1	41	41
COCCOc1ccc(NC[C@H](O)CO[C@@H]2CCCc3ccccc32)cc1	ZINC000819412375	FH	On-Demand	Anodyne	ADRB3	16	41
COCCOc1ccc(NC[C@H](O)CO[C@H]2CCCc3ccccc32)cc1	ZINC000819412376	FH	On-Demand	Anodyne	ADRB1	41	41
COCCOc1ccc(NC[C@H](O)CO[C@H]2CCCc3ccccc32)cc1	ZINC000819412376	FH	On-Demand	Anodyne	ADRB3	16	41
COCCOc1ccc(NCCC(=O)Nc2ccc(Br)cc2)cc1	ZINC000819412386	GH	On-Demand	Anodyne	LTA4H	30	40
COCCOc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1	ZINC000819412395	EF	On-Demand	Anodyne	ADRB2	51	56
COCCOc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1	ZINC000819412395	EF	On-Demand	Anodyne	ADRB1	69	49
COCCOc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1	ZINC000819412395	EF	On-Demand	Anodyne	ADRB3	39	43
COCCOc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1	ZINC000819412396	EF	On-Demand	Anodyne	ADRB2	51	56
COCCOc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1	ZINC000819412396	EF	On-Demand	Anodyne	ADRB1	69	49
COCCOc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1	ZINC000819412396	EF	On-Demand	Anodyne	ADRB3	39	43
O=C(Cc1ccc(NC[C@H](O)c2ccccc2)cc1)N1CCOCC1	ZINC000819412408	EE	On-Demand	Anodyne	CTSS	25	47
O=C(Cc1ccc(NC[C@@H](O)c2ccccc2)cc1)N1CCOCC1	ZINC000819412409	EE	On-Demand	Anodyne	CTSS	25	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc2ccc(O)cc12	ZINC000819412412	EG	On-Demand	Anodyne	TRPV1	23	46
COCCOc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819412422	DF	On-Demand	Anodyne	ADRB2	70	53
COCCOc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819412422	DF	On-Demand	Anodyne	ADRB1	95	53
COCCOc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819412422	DF	On-Demand	Anodyne	GRIN1	18	40
COCCOc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819412422	DF	On-Demand	Anodyne	ADRB3	59	53
COCCOc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819412422	DF	On-Demand	Anodyne	ABCB1	20	44
COCCOc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819412422	DF	On-Demand	Anodyne	PDS	57	38
COCCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819412423	DF	On-Demand	Anodyne	ADRB2	70	53
COCCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819412423	DF	On-Demand	Anodyne	ADRB1	95	53
COCCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819412423	DF	On-Demand	Anodyne	GRIN1	18	40
COCCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819412423	DF	On-Demand	Anodyne	ADRB3	59	53
COCCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819412423	DF	On-Demand	Anodyne	ABCB1	20	44
COCCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819412423	DF	On-Demand	Anodyne	PDS	57	38
COCCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819412424	FG	On-Demand	Anodyne	ADRB2	48	48
COCCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819412424	FG	On-Demand	Anodyne	ADRB1	74	48
COCCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819412424	FG	On-Demand	Anodyne	GRIN1	27	47
COCCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819412424	FG	On-Demand	Anodyne	ADRB3	43	42
COCCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819412424	FG	On-Demand	Anodyne	CDK4	16	42
COCCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819412425	FG	On-Demand	Anodyne	ADRB2	48	48
COCCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819412425	FG	On-Demand	Anodyne	ADRB1	74	48
COCCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819412425	FG	On-Demand	Anodyne	GRIN1	27	47
COCCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819412425	FG	On-Demand	Anodyne	ADRB3	43	42
COCCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819412425	FG	On-Demand	Anodyne	CDK4	16	42
CON(C)C(=O)CCNc1cccc(OCc2cccc(C#N)c2)c1	ZINC000819412444	EF	On-Demand	Mild	MAOB	27	42
CON(C)C(=O)CCNc1cccc(OCc2cccc(C#N)c2)c1	ZINC000819412444	EF	On-Demand	Mild	PTGER3	32	41
CON(C)C(=O)CCNc1cccc(OCc2cccc(C#N)c2)c1	ZINC000819412444	EF	On-Demand	Mild	FFAR1	28	48
COCCOc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819412445	EF	On-Demand	Anodyne	ADRB2	53	48
COCCOc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819412445	EF	On-Demand	Anodyne	ADRB1	76	48
COCCOc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819412445	EF	On-Demand	Anodyne	GRIN1	17	47
COCCOc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819412445	EF	On-Demand	Anodyne	ADRB3	41	42
COCCOc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819412446	EF	On-Demand	Anodyne	ADRB2	53	48
COCCOc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819412446	EF	On-Demand	Anodyne	ADRB1	76	48
COCCOc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819412446	EF	On-Demand	Anodyne	GRIN1	17	47
COCCOc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819412446	EF	On-Demand	Anodyne	ADRB3	41	42
COc1cccc(OC)c1OC[C@@H](O)CNc1ccccc1OC(C)C	ZINC000819412447	FG	On-Demand	Anodyne	ADRB2	35	45
COc1cccc(OC)c1OC[C@H](O)CNc1ccccc1OC(C)C	ZINC000819412448	FG	On-Demand	Anodyne	ADRB2	35	45
COCCOc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819412462	DF	On-Demand	Anodyne	ADRB2	21	40
COCCOc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819412462	DF	On-Demand	Anodyne	ADRB3	35	40
COCCOc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819412463	DF	On-Demand	Anodyne	ADRB2	21	40
COCCOc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819412463	DF	On-Demand	Anodyne	ADRB3	35	40
O=S1(=O)CCCN1c1cccc(NC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819412466	FF	On-Demand	Anodyne	CDK1	15	41
O=S1(=O)CCCN1c1cccc(NC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819412467	FF	On-Demand	Anodyne	CDK1	15	41
COCCOc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819412468	EE	On-Demand	Mild	ADRB2	40	46
COCCOc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819412468	EE	On-Demand	Mild	ADRB1	66	46
COCCOc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819412469	EE	On-Demand	Mild	ADRB2	40	46
COCCOc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819412469	EE	On-Demand	Mild	ADRB1	66	46
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)cc1	ZINC000819412488	GF	On-Demand	Anodyne	ADRB2	25	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)cc1	ZINC000819412488	GF	On-Demand	Anodyne	ADRB1	50	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)cc1	ZINC000819412488	GF	On-Demand	Anodyne	ABCB1	20	45
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)cc1	ZINC000819412489	GF	On-Demand	Anodyne	ADRB2	25	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)cc1	ZINC000819412489	GF	On-Demand	Anodyne	ADRB1	50	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCCN(C)CC3)cc2)cc1	ZINC000819412489	GF	On-Demand	Anodyne	ABCB1	20	45
CN1CCCN(c2ccc(NCCC(=O)Nc3ccc(Cl)cc3)cc2)CC1	ZINC000819412502	GH	On-Demand	Anodyne	DRD4	17	48
CN1CCCN(c2ccc(NCCC(=O)Nc3ccc(Cl)cc3)cc2)CC1	ZINC000819412502	GH	On-Demand	Anodyne	LCK	17	42
CN1CCCN(c2ccc(NCCC(=O)Nc3ccc(Cl)cc3)cc2)CC1	ZINC000819412502	GH	On-Demand	Anodyne	PRNP	38	43
CN1CCCN(c2ccc(NCCC(=O)Nc3ccc(Cl)cc3)cc2)CC1	ZINC000819412502	GH	On-Demand	Anodyne	FLT3	16	40
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)c1ccc(OC(F)(F)F)cc1	ZINC000819412506	GI	On-Demand	Anodyne	CTSS	18	46
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)c1ccc(OC(F)(F)F)cc1	ZINC000819412507	GI	On-Demand	Anodyne	CTSS	18	46
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)c1ccc(OC(F)(F)F)cc1	ZINC000819412508	GI	On-Demand	Anodyne	CTSS	18	46
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)c1ccc(OC(F)(F)F)cc1	ZINC000819412509	GI	On-Demand	Anodyne	CTSS	18	46
COc1ccc(OCC(F)(F)C(F)F)c(C(=O)Nc2ccc(O)c(C)c2)c1	ZINC000819412510	GI	On-Demand	Anodyne	BTK	17	41
COc1ccc(OCC(F)(F)C(F)F)c(C(=O)Nc2ccc(O)c(C)c2)c1	ZINC000819412510	GI	On-Demand	Anodyne	KCNK3	50	36
COc1ccc(OCC(F)(F)C(F)F)c(C(=O)Nc2ccc(O)c(C)c2)c1	ZINC000819412510	GI	On-Demand	Anodyne	KCNK9	47	36
CN1CCCN(c2ccc(NCCC(=O)Nc3ccccc3[N+](=O)[O-])cc2)CC1	ZINC000819412520	GG	On-Demand	Bother	PRNP	26	40
CC(C)[C@H]1CN(C(=O)C2CCN(C(=O)c3cccnc3)CC2)CCCO1	ZINC000819412582	FE	On-Demand	Anodyne	L3MBTL3	63	36
O=S1(=O)CCCN1c1cccc(NC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819412617	GG	On-Demand	Anodyne	CDK1	15	40
O=S1(=O)CCCN1c1cccc(NC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819412618	GG	On-Demand	Anodyne	CDK1	15	40
O=S1(=O)CCCN1c1cccc(NC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819412627	FF	On-Demand	Anodyne	CDK1	15	41
CC(C)[C@H]1CN(C(=O)c2cc(-c3ccncc3)nc3ccccc23)CCCO1	ZINC000819412631	GI	On-Demand	Anodyne	PRS	35	41
CC(C)[C@H]1CN(C(=O)c2cc(-c3ccncc3)nc3ccccc23)CCCO1	ZINC000819412631	GI	On-Demand	Anodyne	TACR3	17	41
CC(C)[C@H]1CN(C(=O)c2cc(-c3ccncc3)nc3ccccc23)CCCO1	ZINC000819412631	GI	On-Demand	Anodyne	MT-CO2	51	41
O=S1(=O)CCCN1c1cccc(NC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819412632	FF	On-Demand	Anodyne	CDK1	15	41
CCOC(=O)CC[C@H](O)CNc1ccc(OC)c(N2CCCCC2=O)c1	ZINC000819412637	FE	On-Demand	Anodyne	DRTS_TRYCR	48	39
CCOC(=O)CC[C@@H](O)CNc1ccc(OC)c(N2CCCCC2=O)c1	ZINC000819412638	FE	On-Demand	Anodyne	DRTS_TRYCR	48	39
CC(C)[C@H]1CN(C(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)CCCO1	ZINC000819412645	GD	On-Demand	Anodyne	L3MBTL3	43	33
CCCCCCC(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819412662	CG	On-Demand	Anodyne	CQSS	53	34
CCCCCCC(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819412663	CG	On-Demand	Anodyne	CQSS	53	34
COCCOc1ccc(NC[C@@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819412703	EF	On-Demand	Anodyne	MTNR1A	18	40
COCCOc1ccc(NC[C@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819412704	EF	On-Demand	Anodyne	MTNR1A	18	40
COCCOc1ccc(NC[C@H](O)c2ccc(Br)cc2)cc1	ZINC000819412708	FH	On-Demand	Anodyne	ADRB2	18	45
COCCOc1ccc(NC[C@@H](O)c2ccc(Br)cc2)cc1	ZINC000819412709	FH	On-Demand	Anodyne	ADRB2	18	45
COCCOc1ccc(NCCC(=O)Nc2cccc(Br)c2)cc1	ZINC000819412712	GH	On-Demand	Anodyne	EGFR	46	42
COCCOc1ccc(NCCC(=O)Nc2cccc(Br)c2)cc1	ZINC000819412712	GH	On-Demand	Anodyne	HDAC10	16	40
COCCOc1ccc(NCCC(=O)Nc2cccc(Br)c2)cc1	ZINC000819412712	GH	On-Demand	Anodyne	MTNR1A	18	40
COCCOc1ccc(NCCC(=O)Nc2cccc(Br)c2)cc1	ZINC000819412712	GH	On-Demand	Anodyne	MTNR1B	21	40
COCCOc1ccc(NCCC(=O)Nc2cccc(Br)c2)cc1	ZINC000819412712	GH	On-Demand	Anodyne	HDAC3	16	41
O=C(Cc1ccc(NC[C@H](O)c2ccc(F)cc2)cc1)N1CCOCC1	ZINC000819412717	FE	On-Demand	Anodyne	MLNR	21	40
O=C(Cc1ccc(NC[C@@H](O)c2ccc(F)cc2)cc1)N1CCOCC1	ZINC000819412718	FE	On-Demand	Anodyne	MLNR	21	40
COCCOc1ccc(NC[C@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819412729	DG	On-Demand	Anodyne	ADRB2	21	40
COCCOc1ccc(NC[C@@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819412730	DG	On-Demand	Anodyne	ADRB2	21	40
COCCOc1ccc(NC[C@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819412735	GH	On-Demand	Anodyne	ADRB2	41	42
COCCOc1ccc(NC[C@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819412735	GH	On-Demand	Anodyne	ADRB1	61	42
COCCOc1ccc(NC[C@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819412735	GH	On-Demand	Anodyne	GRIN1	24	41
COCCOc1ccc(NC[C@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819412735	GH	On-Demand	Anodyne	ADRB3	31	41
COCCOc1ccc(NC[C@@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819412736	GH	On-Demand	Anodyne	ADRB2	41	42
COCCOc1ccc(NC[C@@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819412736	GH	On-Demand	Anodyne	ADRB1	61	42
COCCOc1ccc(NC[C@@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819412736	GH	On-Demand	Anodyne	GRIN1	24	41
COCCOc1ccc(NC[C@@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819412736	GH	On-Demand	Anodyne	ADRB3	31	41
CC(C)[C@H]1CN(C(=O)c2cc(-c3ccccc3)nc3ccccc23)CCCO1	ZINC000819412762	FJ	On-Demand	Anodyne	PRS	51	44
CC(C)[C@H]1CN(C(=O)c2cc(-c3ccccc3)nc3ccccc23)CCCO1	ZINC000819412762	FJ	On-Demand	Anodyne	TACR3	27	46
CC(C)[C@H]1CN(C(=O)c2cc(-c3ccccc3)nc3ccccc23)CCCO1	ZINC000819412762	FJ	On-Demand	Anodyne	SMO	49	34
CC(C)[C@H]1CN(C(=O)c2cc(-c3ccccc3)nc3ccccc23)CCCO1	ZINC000819412762	FJ	On-Demand	Anodyne	MT-CO2	54	43
CC(C)[C@H]1CN(C(=O)c2cc3ccc(OCc4ccccc4)cc3[nH]2)CCCO1	ZINC000819412766	GJ	On-Demand	Anodyne	GRIN2B	36	50
CC(C)[C@H]1CN(C(=O)c2cc3ccc(OCc4ccccc4)cc3[nH]2)CCCO1	ZINC000819412766	GJ	On-Demand	Anodyne	HRH4	18	41
COc1cc(NC[C@H](O)c2ccccc2C)ccc1NC(C)=O	ZINC000819412979	DG	On-Demand	Anodyne	TSHR	46	30
COc1cc(NC[C@@H](O)c2ccccc2C)ccc1NC(C)=O	ZINC000819412981	DG	On-Demand	Anodyne	TSHR	46	30
CCOc1ccc(OC[C@H](O)CNc2cccc(CN3CCOC3=O)c2)cc1	ZINC000819412989	GF	On-Demand	Anodyne	ADRB1	42	34
CCOc1ccc(OC[C@H](O)CNc2cccc(CN3CCOC3=O)c2)cc1	ZINC000819412989	GF	On-Demand	Anodyne	PDS	41	31
CCOc1ccc(OC[C@@H](O)CNc2cccc(CN3CCOC3=O)c2)cc1	ZINC000819412991	GF	On-Demand	Anodyne	ADRB1	42	34
CCOc1ccc(OC[C@@H](O)CNc2cccc(CN3CCOC3=O)c2)cc1	ZINC000819412991	GF	On-Demand	Anodyne	PDS	41	31
COCCOc1ccc(NC[C@@H](O)COc2ccc(C)cc2C)cc1	ZINC000819413032	EG	On-Demand	Anodyne	ADRB2	35	45
COCCOc1ccc(NC[C@@H](O)COc2ccc(C)cc2C)cc1	ZINC000819413032	EG	On-Demand	Anodyne	ADRB1	43	40
COCCOc1ccc(NC[C@H](O)COc2ccc(C)cc2C)cc1	ZINC000819413034	EG	On-Demand	Anodyne	ADRB2	35	45
COCCOc1ccc(NC[C@H](O)COc2ccc(C)cc2C)cc1	ZINC000819413034	EG	On-Demand	Anodyne	ADRB1	43	40
CCC(=O)Nc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819413044	GG	On-Demand	Anodyne	EPHX2	24	41
CCC(=O)Nc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819413044	GG	On-Demand	Anodyne	TGM2	15	41
CCC(=O)Nc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819413044	GG	On-Demand	Anodyne	F13A1	23	41
CCC(=O)Nc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819413044	GG	On-Demand	Anodyne	GPR119	54	47
CCC(=O)Nc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819413046	GG	On-Demand	Anodyne	EPHX2	24	41
CCC(=O)Nc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819413046	GG	On-Demand	Anodyne	TGM2	15	41
CCC(=O)Nc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819413046	GG	On-Demand	Anodyne	F13A1	23	41
CCC(=O)Nc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819413046	GG	On-Demand	Anodyne	GPR119	54	47
Cc1ccccc1[C@@H](O)CNc1ccc(CC(=O)N2CCOCC2)cc1	ZINC000819413070	FF	On-Demand	Anodyne	CTSS	21	40
COc1cc(NC[C@@H](O)C2CC2)ccc1NC(C)=O	ZINC000819413087	CD	On-Demand	Anodyne	ENPP1	67	32
COc1cc(NC[C@H](O)C2CC2)ccc1NC(C)=O	ZINC000819413089	CD	On-Demand	Anodyne	ENPP1	67	32
COCCOc1ccc(NC[C@H](O)CN2CCOCC2)cc1	ZINC000819413106	DC	On-Demand	Anodyne	EPHX2	19	45
COCCOc1ccc(NC[C@@H](O)CN2CCOCC2)cc1	ZINC000819413107	DC	On-Demand	Anodyne	EPHX2	19	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OC(C)C)c1	ZINC000819413118	EH	On-Demand	Anodyne	ADRB2	36	48
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OC(C)C)c1	ZINC000819413118	EH	On-Demand	Anodyne	ADRB1	66	43
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OC(C)C)c1	ZINC000819413118	EH	On-Demand	Anodyne	ABCB1	37	46
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OC(C)C)c1	ZINC000819413118	EH	On-Demand	Anodyne	PDS	51	37
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OC(C)C)c1	ZINC000819413121	EH	On-Demand	Anodyne	ADRB2	36	48
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OC(C)C)c1	ZINC000819413121	EH	On-Demand	Anodyne	ADRB1	66	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OC(C)C)c1	ZINC000819413121	EH	On-Demand	Anodyne	ABCB1	37	46
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OC(C)C)c1	ZINC000819413121	EH	On-Demand	Anodyne	PDS	51	37
O=S1(=O)CCCN1c1cccc(NC[C@H](O)c2ccc(F)cc2)c1	ZINC000819413132	FF	On-Demand	Anodyne	CDK1	16	43
O=S1(=O)CCCN1c1cccc(NC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819413135	FF	On-Demand	Anodyne	CDK1	16	43
COCCOc1ccc(NC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819413137	DF	On-Demand	Anodyne	ADRB2	19	42
COCCOc1ccc(NC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819413139	DF	On-Demand	Anodyne	ADRB2	19	42
CC(=O)Nc1cc(NC[C@H](O)c2cccnc2)ccc1C	ZINC000819413160	CE	On-Demand	Anodyne	ADRB2	29	45
CC(=O)Nc1cc(NC[C@H](O)c2cccnc2)ccc1C	ZINC000819413160	CE	On-Demand	Anodyne	ADRB1	32	48
CC(=O)Nc1cc(NC[C@H](O)c2cccnc2)ccc1C	ZINC000819413160	CE	On-Demand	Anodyne	ADRB3	107	52
CC(=O)Nc1cc(NC[C@H](O)c2cccnc2)ccc1C	ZINC000819413160	CE	On-Demand	Anodyne	TBXAS1	18	40
COCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1	ZINC000819413164	EG	On-Demand	Anodyne	MTNR1A	24	40
COCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1	ZINC000819413164	EG	On-Demand	Anodyne	MTNR1B	25	41
COCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1	ZINC000819413164	EG	On-Demand	Anodyne	PDGFRA	15	41
COCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1	ZINC000819413164	EG	On-Demand	Anodyne	AURKA	20	41
COCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1	ZINC000819413164	EG	On-Demand	Anodyne	KCNK3	51	38
COCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1	ZINC000819413164	EG	On-Demand	Anodyne	KCNK9	49	38
COCCOc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819413167	FH	On-Demand	Anodyne	GCGR	15	41
COCCOc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819413167	FH	On-Demand	Anodyne	CTSS	18	40
COCCOc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819413168	FH	On-Demand	Anodyne	GCGR	15	41
COCCOc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819413168	FH	On-Demand	Anodyne	CTSS	18	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc3ncsc3c2)CC1	ZINC000819413178	GH	On-Demand	Anodyne	GPR119	51	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc3ncsc3c2)CC1	ZINC000819413179	GH	On-Demand	Anodyne	GPR119	51	42
CC(C)[C@H]1CN(C(=O)c2cccc(C3OCCO3)c2)CCCO1	ZINC000819413188	DF	On-Demand	Anodyne	L3MBTL3	57	42
CC(C)[C@H]1CN(C(=O)c2cccc(C3OCCO3)c2)CCCO1	ZINC000819413188	DF	On-Demand	Anodyne	HPGD	42	39
CC(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CCCO1	ZINC000819413254	GG	On-Demand	Bother	SLC6A9	23	57
CCC(=O)c1cc(C(=O)N2CCCO[C@H](C(C)C)C2)ccc1F	ZINC000819413271	DG	On-Demand	Anodyne	L3MBTL3	47	34
CCC(=O)c1cc(C(=O)N2CCCO[C@@H](C(C)C)C2)ccc1F	ZINC000819413272	DG	On-Demand	Anodyne	L3MBTL3	47	34
COCCOc1ccc(NC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819413299	FH	On-Demand	Anodyne	ADRB2	22	40
COCCOc1ccc(NC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819413299	FH	On-Demand	Anodyne	ADRB3	37	40
COCCOc1ccc(NC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819413300	FH	On-Demand	Anodyne	ADRB2	22	40
COCCOc1ccc(NC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819413300	FH	On-Demand	Anodyne	ADRB3	37	40
C#CCNC(=O)CCNc1ccc(CN2CCN(c3cccc(C)c3)CC2)cc1	ZINC000819413309	GF	On-Demand	Mild	HTR1A	25	44
C#CCNC(=O)CCNc1ccc(CN2CCN(c3cccc(C)c3)CC2)cc1	ZINC000819413309	GF	On-Demand	Mild	DRD2	19	44
C#CCNC(=O)CCNc1ccc(CN2CCN(c3cccc(C)c3)CC2)cc1	ZINC000819413309	GF	On-Demand	Mild	DRD4	41	33
C#CCNC(=O)CCNc1ccc(CN2CCN(c3cccc(C)c3)CC2)cc1	ZINC000819413309	GF	On-Demand	Mild	HTR2A	17	44
C#CCNC(=O)CCNc1ccc(CN2CCN(c3cccc(C)c3)CC2)cc1	ZINC000819413309	GF	On-Demand	Mild	DRD3	22	44
O=S1(=O)CCCN1c1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819413317	EE	On-Demand	Anodyne	CDK1	16	42
O=S1(=O)CCCN1c1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819413318	EE	On-Demand	Anodyne	CDK1	16	42
O=C(Cc1ccc(NC[C@H](O)C2CC2)cc1)N1CCOCC1	ZINC000819413336	DD	On-Demand	Anodyne	CTSS	25	41
O=C(Cc1ccc(NC[C@@H](O)C2CC2)cc1)N1CCOCC1	ZINC000819413337	DD	On-Demand	Anodyne	CTSS	25	41
COCCOc1ccc(NC[C@H](O)COc2ccccc2F)cc1	ZINC000819413351	EF	On-Demand	Anodyne	ADRB2	50	45
COCCOc1ccc(NC[C@H](O)COc2ccccc2F)cc1	ZINC000819413351	EF	On-Demand	Anodyne	ADRB1	76	41
COCCOc1ccc(NC[C@H](O)COc2ccccc2F)cc1	ZINC000819413351	EF	On-Demand	Anodyne	ADRB3	36	40
COCCOc1ccc(NC[C@@H](O)COc2ccccc2F)cc1	ZINC000819413352	EF	On-Demand	Anodyne	ADRB2	50	45
COCCOc1ccc(NC[C@@H](O)COc2ccccc2F)cc1	ZINC000819413352	EF	On-Demand	Anodyne	ADRB1	76	41
COCCOc1ccc(NC[C@@H](O)COc2ccccc2F)cc1	ZINC000819413352	EF	On-Demand	Anodyne	ADRB3	36	40
O=C(Cc1ccc(NC[C@@H](O)c2ccc(F)cn2)cc1)N1CCOCC1	ZINC000819413369	FD	On-Demand	Anodyne	STAT6	44	33
O=C(Cc1ccc(NC[C@H](O)c2ccc(F)cn2)cc1)N1CCOCC1	ZINC000819413370	FD	On-Demand	Anodyne	STAT6	44	33
O=C(Cc1ccc(NC[C@H](O)c2ccccc2Cl)cc1)N1CCOCC1	ZINC000819413375	FF	On-Demand	Anodyne	CTSS	21	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819413380	EH	On-Demand	Anodyne	ADRB2	49	45
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819413380	EH	On-Demand	Anodyne	ADRB1	73	37
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819413380	EH	On-Demand	Anodyne	ADRB3	38	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819413380	EH	On-Demand	Anodyne	ABCB1	31	55
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819413381	EH	On-Demand	Anodyne	ADRB2	49	45
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819413381	EH	On-Demand	Anodyne	ADRB1	73	37
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819413381	EH	On-Demand	Anodyne	ADRB3	38	40
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OC(C)C)cc1	ZINC000819413381	EH	On-Demand	Anodyne	ABCB1	31	55
COCCOc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819413382	FG	On-Demand	Anodyne	ADRB2	52	48
COCCOc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819413382	FG	On-Demand	Anodyne	ADRB1	77	41
COCCOc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819413382	FG	On-Demand	Anodyne	GRIN1	24	42
COCCOc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819413382	FG	On-Demand	Anodyne	ADRB3	40	45
COCCOc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819413382	FG	On-Demand	Anodyne	CYP2D6	15	42
COCCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819413383	FG	On-Demand	Anodyne	ADRB2	52	48
COCCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819413383	FG	On-Demand	Anodyne	ADRB1	77	41
COCCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819413383	FG	On-Demand	Anodyne	GRIN1	24	42
COCCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819413383	FG	On-Demand	Anodyne	ADRB3	40	45
COCCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819413383	FG	On-Demand	Anodyne	CYP2D6	15	42
CC(=O)Nc1cc(NC[C@@H](O)c2cccnc2)ccc1C	ZINC000819413385	CE	On-Demand	Anodyne	ADRB2	29	45
CC(=O)Nc1cc(NC[C@@H](O)c2cccnc2)ccc1C	ZINC000819413385	CE	On-Demand	Anodyne	ADRB1	32	48
CC(=O)Nc1cc(NC[C@@H](O)c2cccnc2)ccc1C	ZINC000819413385	CE	On-Demand	Anodyne	ADRB3	107	52
CC(=O)Nc1cc(NC[C@@H](O)c2cccnc2)ccc1C	ZINC000819413385	CE	On-Demand	Anodyne	TBXAS1	18	40
CC(=O)Nc1cc(NC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)ccc1C	ZINC000819413394	GH	On-Demand	Anodyne	GPR119	22	41
CC(=O)Nc1cc(NC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)ccc1C	ZINC000819413395	GH	On-Demand	Anodyne	GPR119	22	41
CC(=O)Nc1cc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1C	ZINC000819413396	GG	On-Demand	Anodyne	GPR119	43	45
CC(=O)Nc1cc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1C	ZINC000819413397	GG	On-Demand	Anodyne	GPR119	43	45
O=C(NOCc1cccnc1)C(F)=C1CCC1	ZINC000819413407	BE	On-Demand	Anodyne	CHRNA7	42	37
CCC(=O)Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819413417	FI	On-Demand	Anodyne	GCGR	23	45
CCC(=O)Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819413417	FI	On-Demand	Anodyne	ADRB3	20	40
CCC(=O)Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819413417	FI	On-Demand	Anodyne	P2RY1	55	36
CCC(=O)Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819413417	FI	On-Demand	Anodyne	CTSS	19	41
CCC(=O)Nc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819413417	FI	On-Demand	Anodyne	EPHX2	50	43
CCC(=O)Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819413418	FI	On-Demand	Anodyne	GCGR	23	45
CCC(=O)Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819413418	FI	On-Demand	Anodyne	ADRB3	20	40
CCC(=O)Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819413418	FI	On-Demand	Anodyne	P2RY1	55	36
CCC(=O)Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819413418	FI	On-Demand	Anodyne	CTSS	19	41
CCC(=O)Nc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819413418	FI	On-Demand	Anodyne	EPHX2	50	43
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1ccccn1	ZINC000819413451	EE	On-Demand	Anodyne	GRM4	15	46
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1ccccn1	ZINC000819413453	EE	On-Demand	Anodyne	GRM4	15	46
COC[C@@H](O)CNc1ccccc1OC(C)C	ZINC000819413484	BD	On-Demand	Anodyne	ADRB2	29	44
O=C(/C=C/[C@H]1CCCO1)NCCNS(=O)(=O)c1cccnc1	ZINC000819413497	EC	On-Demand	Anodyne	TBXAS1	40	36
O=C(/C=C\[C@@H]1CCCO1)NCCNS(=O)(=O)c1cccnc1	ZINC000819413499	EC	On-Demand	Anodyne	TBXAS1	40	36
O=C(/C=C\[C@H]1CCCO1)NCCNS(=O)(=O)c1cccnc1	ZINC000819413501	EC	On-Demand	Anodyne	TBXAS1	40	36
O=C(/C=C/[C@@H]1CCCO1)NCCNS(=O)(=O)c1cccnc1	ZINC000819413503	EC	On-Demand	Anodyne	TBXAS1	40	36
O=C1OCCN1Cc1cccc(NC[C@H](O)COc2cccc3ccccc23)c1	ZINC000819413504	GH	On-Demand	Anodyne	ADRB2	22	44
O=C1OCCN1Cc1cccc(NC[C@@H](O)COc2cccc3ccccc23)c1	ZINC000819413507	GH	On-Demand	Anodyne	ADRB2	22	44
CCC(=O)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819413545	CF	On-Demand	Anodyne	ADRB2	26	48
CCC(=O)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819413545	CF	On-Demand	Anodyne	ADRB1	27	51
CCC(=O)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819413545	CF	On-Demand	Anodyne	ADRB3	102	55
CCC(=O)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819413545	CF	On-Demand	Anodyne	NAMPT	35	43
CCC(=O)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819413546	CF	On-Demand	Anodyne	ADRB2	26	48
CCC(=O)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819413546	CF	On-Demand	Anodyne	ADRB1	27	51
CCC(=O)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819413546	CF	On-Demand	Anodyne	ADRB3	102	55
CCC(=O)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819413546	CF	On-Demand	Anodyne	NAMPT	35	43
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc(CN3CCOC3=O)c2)cc1	ZINC000819413581	GF	On-Demand	Anodyne	ABCB1	19	41
CC(=O)c1ccc(OC[C@H](O)CNc2cccc(CN3CCOC3=O)c2)cc1	ZINC000819413582	GF	On-Demand	Anodyne	ABCB1	19	41
O=C1OCCN1Cc1cccc(NC[C@H](O)COc2ccccc2)c1	ZINC000819413599	EE	On-Demand	Anodyne	ADRB1	46	39
O=C1OCCN1Cc1cccc(NC[C@H](O)COc2ccccc2)c1	ZINC000819413599	EE	On-Demand	Anodyne	PDS	44	32
O=C1OCCN1Cc1cccc(NC[C@@H](O)COc2ccccc2)c1	ZINC000819413600	EE	On-Demand	Anodyne	ADRB1	46	39
O=C1OCCN1Cc1cccc(NC[C@@H](O)COc2ccccc2)c1	ZINC000819413600	EE	On-Demand	Anodyne	PDS	44	32
CCC(=O)Nc1ccc(NC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819413616	GH	On-Demand	Anodyne	EPHX2	20	40
CCC(=O)Nc1ccc(NC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819413617	GH	On-Demand	Anodyne	EPHX2	20	40
COc1cc(NCCC(=O)Nc2ccc(N(C)C)cc2)ccc1NC(C)=O	ZINC000819413625	FG	On-Demand	Anodyne	MTNR1B	18	42
COc1cc(NCCC(=O)Nc2ccc(N(C)C)cc2)ccc1NC(C)=O	ZINC000819413625	FG	On-Demand	Anodyne	ENPP1	54	30
O=C1OCCN1Cc1cccc(NC[C@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819413628	GF	On-Demand	Anodyne	ADRB1	21	48
O=C1OCCN1Cc1cccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819413629	GF	On-Demand	Anodyne	ADRB1	21	48
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(CN3CCOC3=O)c2)cc1	ZINC000819413645	GE	On-Demand	Anodyne	ADRB2	28	46
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(CN3CCOC3=O)c2)cc1	ZINC000819413645	GE	On-Demand	Anodyne	ADRB1	60	46
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(CN3CCOC3=O)c2)cc1	ZINC000819413645	GE	On-Demand	Anodyne	TSHR	42	31
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(CN3CCOC3=O)c2)cc1	ZINC000819413645	GE	On-Demand	Anodyne	ADRB3	43	43
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(CN3CCOC3=O)c2)cc1	ZINC000819413646	GE	On-Demand	Anodyne	ADRB2	28	46
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(CN3CCOC3=O)c2)cc1	ZINC000819413646	GE	On-Demand	Anodyne	ADRB1	60	46
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(CN3CCOC3=O)c2)cc1	ZINC000819413646	GE	On-Demand	Anodyne	TSHR	42	31
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(CN3CCOC3=O)c2)cc1	ZINC000819413646	GE	On-Demand	Anodyne	ADRB3	43	43
Cc1ccc(OC[C@H](O)CNc2cccc(CN3CCOC3=O)c2)cc1	ZINC000819413647	FF	On-Demand	Anodyne	ADRB2	24	40
Cc1ccc(OC[C@H](O)CNc2cccc(CN3CCOC3=O)c2)cc1	ZINC000819413647	FF	On-Demand	Anodyne	ADRB1	42	35
Cc1ccc(OC[C@@H](O)CNc2cccc(CN3CCOC3=O)c2)cc1	ZINC000819413648	FF	On-Demand	Anodyne	ADRB2	24	40
Cc1ccc(OC[C@@H](O)CNc2cccc(CN3CCOC3=O)c2)cc1	ZINC000819413648	FF	On-Demand	Anodyne	ADRB1	42	35
CCC(=O)Nc1ccc(NC[C@H](O)c2ccc(C)cc2)cc1	ZINC000819413662	CG	On-Demand	Anodyne	ENPP2	28	41
CCC(=O)Nc1ccc(NC[C@@H](O)c2ccc(C)cc2)cc1	ZINC000819413663	CG	On-Demand	Anodyne	ENPP2	28	41
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)C1(c2cccc(F)c2)CCCC1	ZINC000819413669	JK	On-Demand	Anodyne	P2RX7	17	41
COc1cc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)ccc1NC(C)=O	ZINC000819413670	FH	On-Demand	Anodyne	ADRB3	15	40
COc1cc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)ccc1NC(C)=O	ZINC000819413671	FH	On-Demand	Anodyne	ADRB3	15	40
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819413674	JK	On-Demand	Anodyne	TACR3	15	42
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819413674	JK	On-Demand	Anodyne	NR2E3	44	31
CCC(=O)Nc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819413697	FI	On-Demand	Anodyne	SLC1A1	20	44
CCC(=O)Nc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819413697	FI	On-Demand	Anodyne	SLC1A3	19	44
CCC(=O)Nc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819413697	FI	On-Demand	Anodyne	CCR2	39	42
CCC(=O)Nc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819413697	FI	On-Demand	Anodyne	SLC1A2	33	44
CCC(=O)Nc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819413697	FI	On-Demand	Anodyne	PDS	40	41
CCC(=O)Nc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819413698	FI	On-Demand	Anodyne	SLC1A1	20	44
CCC(=O)Nc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819413698	FI	On-Demand	Anodyne	SLC1A3	19	44
CCC(=O)Nc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819413698	FI	On-Demand	Anodyne	CCR2	39	42
CCC(=O)Nc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819413698	FI	On-Demand	Anodyne	SLC1A2	33	44
CCC(=O)Nc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819413698	FI	On-Demand	Anodyne	PDS	40	41
O=C(O)CCCCCNS(=O)(=O)c1ccc2c(c1)C(=O)OC2	ZINC000819413722	ED	On-Demand	Anodyne	TBXA2R	45	37
O=C(O)CCCCCNS(=O)(=O)c1ccc2c(c1)C(=O)OC2	ZINC000819413722	ED	On-Demand	Anodyne	TBXAS1	44	38
O=C(O)CCCNC(=O)C(=O)Nc1ccc2[nH]ncc2c1	ZINC000819413725	CC	On-Demand	Anodyne	MAOB	15	45
O=C(O)CCCNC(=O)C(=O)Nc1ccc2[nH]ncc2c1	ZINC000819413725	CC	On-Demand	Anodyne	ROCK1	20	56
O=C(O)CCCNC(=O)C(=O)Nc1ccc2[nH]ncc2c1	ZINC000819413725	CC	On-Demand	Anodyne	ROCK2	19	56
O=C(O)CCCNC(=O)C(=O)Nc1ccc2c(c1)ncn2-c1ccccc1	ZINC000819413726	FD	On-Demand	Anodyne	NR1I2	55	37
O=C(O)CCCNC(=O)C(=O)Nc1ccc2c(c1)ncn2-c1ccccc1	ZINC000819413726	FD	On-Demand	Anodyne	HPGD	41	43
O=C(O)CCCCCNc1c(F)c(F)nc(F)c1F	ZINC000819413728	CF	On-Demand	Anodyne	CA1	18	60
O=C(O)CCCCCNc1cnn(-c2nc3ccccc3[nH]2)c(=O)c1Cl	ZINC000819413734	GF	On-Demand	Anodyne	ALKBH3	41	36
O=C(O)CCCNC(=O)C(=O)Nc1cccc2ccncc12	ZINC000819413740	DD	On-Demand	Anodyne	TBXAS1	51	38
O=C(O)CCCNC(=O)C(=O)Nc1cccc2ccncc12	ZINC000819413740	DD	On-Demand	Anodyne	TRPV1	24	49
O=C(O)CCCNC(=O)C(=O)Nc1cccc2ccncc12	ZINC000819413740	DD	On-Demand	Anodyne	CDK5	27	42
O=C(O)CCCCCNc1nccc(N2CCCC2)n1	ZINC000819413741	CE	On-Demand	Anodyne	HNMT	45	36
O=C(O)CCCCCNc1nccc(N2CCCC2)n1	ZINC000819413741	CE	On-Demand	Anodyne	SORD	58	38
O=C(O)CCCCCNc1nccc(N2CCCC2)n1	ZINC000819413741	CE	On-Demand	Anodyne	MRGPRX1	44	38
O=C(O)CCCNC(=O)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1	ZINC000819413743	FD	On-Demand	Anodyne	PRNP	40	35
O=C(O)CCCNC(=O)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1	ZINC000819413743	FD	On-Demand	Anodyne	LUCI_LUCLA	40	49
O=C(O)CCCNC(=O)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1	ZINC000819413743	FD	On-Demand	Anodyne	KCNK3	43	34
O=C(O)CCCNC(=O)C#Cc1ccc2c(c1)OCO2	ZINC000819413751	CC	On-Demand	Mild	LTB4R	21	40
O=C(O)CCCNC(=O)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1	ZINC000819413752	GE	On-Demand	Anodyne	LTA4H	17	42
O=C(O)CCCNC(=O)C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	ZINC000819413753	GC	On-Demand	Anodyne	EPHX2	19	46
CC(=O)Nc1cc(NC[C@H](O)c2cccc(C(F)(F)F)c2)ccc1C	ZINC000819413772	FI	On-Demand	Anodyne	SLC1A2	26	40
CC(=O)Nc1cc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)ccc1C	ZINC000819413773	FI	On-Demand	Anodyne	SLC1A2	26	40
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000819413778	IK	On-Demand	Bother	CNR1	53	32
COc1cc(NC[C@H](O)c2cccnc2)ccc1NC(C)=O	ZINC000819413833	DE	On-Demand	Anodyne	ADRB2	26	41
COc1cc(NC[C@H](O)c2cccnc2)ccc1NC(C)=O	ZINC000819413833	DE	On-Demand	Anodyne	ADRB1	29	48
COc1cc(NC[C@H](O)c2cccnc2)ccc1NC(C)=O	ZINC000819413833	DE	On-Demand	Anodyne	ADRB3	101	48
COc1cc(NC[C@H](O)c2cccnc2)ccc1NC(C)=O	ZINC000819413833	DE	On-Demand	Anodyne	KCNA5	20	42
COc1cc(NC[C@H](O)c2cccnc2)ccc1NC(C)=O	ZINC000819413833	DE	On-Demand	Anodyne	ENPP1	43	35
COc1cc(NC[C@@H](O)c2cccnc2)ccc1NC(C)=O	ZINC000819413834	DE	On-Demand	Anodyne	ADRB2	26	41
COc1cc(NC[C@@H](O)c2cccnc2)ccc1NC(C)=O	ZINC000819413834	DE	On-Demand	Anodyne	ADRB1	29	48
COc1cc(NC[C@@H](O)c2cccnc2)ccc1NC(C)=O	ZINC000819413834	DE	On-Demand	Anodyne	ADRB3	101	48
COc1cc(NC[C@@H](O)c2cccnc2)ccc1NC(C)=O	ZINC000819413834	DE	On-Demand	Anodyne	KCNA5	20	42
COc1cc(NC[C@@H](O)c2cccnc2)ccc1NC(C)=O	ZINC000819413834	DE	On-Demand	Anodyne	ENPP1	43	35
O=C1OCCN1Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819413835	EG	On-Demand	Anodyne	ADRB1	28	42
O=C1OCCN1Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819413835	EG	On-Demand	Anodyne	ADRB3	42	40
O=C1OCCN1Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819413835	EG	On-Demand	Anodyne	CYP3A4	47	36
O=C1OCCN1Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819413836	EG	On-Demand	Anodyne	ADRB1	28	42
O=C1OCCN1Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819413836	EG	On-Demand	Anodyne	ADRB3	42	40
O=C1OCCN1Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819413836	EG	On-Demand	Anodyne	CYP3A4	47	36
COc1cc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)ccc1NC(C)=O	ZINC000819413861	GH	On-Demand	Anodyne	ADRB3	21	41
COc1cc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)ccc1NC(C)=O	ZINC000819413861	GH	On-Demand	Anodyne	P2RY1	46	40
COc1cc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)ccc1NC(C)=O	ZINC000819413862	GH	On-Demand	Anodyne	ADRB3	21	41
COc1cc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)ccc1NC(C)=O	ZINC000819413862	GH	On-Demand	Anodyne	P2RY1	46	40
O=C(/C=C/[C@H]1CCCO1)NOCc1cccnc1	ZINC000819413890	BD	On-Demand	Anodyne	CHRNA7	46	38
O=C(/C=C\[C@@H]1CCCO1)NOCc1cccnc1	ZINC000819413891	BD	On-Demand	Anodyne	CHRNA7	46	38
O=C(/C=C\[C@H]1CCCO1)NOCc1cccnc1	ZINC000819413892	BD	On-Demand	Anodyne	CHRNA7	46	38
O=C(/C=C/[C@@H]1CCCO1)NOCc1cccnc1	ZINC000819413893	BD	On-Demand	Anodyne	CHRNA7	46	38
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cc(-c2cccnc2)nc2ccccc12	ZINC000819413930	JK	On-Demand	Anodyne	TACR3	17	43
CCC(=O)Nc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819414019	FI	On-Demand	Anodyne	EPHX2	20	40
CCC(=O)Nc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819414020	FI	On-Demand	Anodyne	EPHX2	20	40
COc1cc(NCCS(C)(=O)=O)ccc1NC(C)=O	ZINC000819414047	CD	On-Demand	Anodyne	DRTS_TRYCR	54	32
C[C@@H]1CCCC[C@H]1C(=O)NOCc1cccnc1	ZINC000819414050	BE	On-Demand	Anodyne	CHRNA7	46	38
C[C@@H]1CCCC[C@H]1C(=O)NOCc1cccnc1	ZINC000819414050	BE	On-Demand	Anodyne	NAMPT	41	40
C[C@@H]1CCCC[C@@H]1C(=O)NOCc1cccnc1	ZINC000819414052	BE	On-Demand	Anodyne	CHRNA7	46	38
C[C@@H]1CCCC[C@@H]1C(=O)NOCc1cccnc1	ZINC000819414052	BE	On-Demand	Anodyne	NAMPT	41	40
CCC(=O)Nc1ccc(NC[C@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819414056	EG	On-Demand	Anodyne	MTNR1A	43	53
CCC(=O)Nc1ccc(NC[C@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819414056	EG	On-Demand	Anodyne	MTNR1B	47	53
CCC(=O)Nc1ccc(NC[C@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819414056	EG	On-Demand	Anodyne	ENPP1	65	31
CCC(=O)Nc1ccc(NC[C@@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819414057	EG	On-Demand	Anodyne	MTNR1A	43	53
CCC(=O)Nc1ccc(NC[C@@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819414057	EG	On-Demand	Anodyne	MTNR1B	47	53
CCC(=O)Nc1ccc(NC[C@@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819414057	EG	On-Demand	Anodyne	ENPP1	65	31
O=C(NOCc1cccnc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819414072	EG	On-Demand	Anodyne	CHRNA7	51	43
O=C(NOCc1cccnc1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819414072	EG	On-Demand	Anodyne	ACHP_LYMST	26	43
COc1cc(NC[C@H](O)c2ccc(C)cc2)ccc1NC(C)=O	ZINC000819414088	DG	On-Demand	Anodyne	ADRB3	18	40
COc1cc(NC[C@@H](O)c2ccc(C)cc2)ccc1NC(C)=O	ZINC000819414089	DG	On-Demand	Anodyne	ADRB3	18	40
CCC(=O)Nc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819414111	FF	On-Demand	Anodyne	CA2	18	52
CCC(=O)Nc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819414111	FF	On-Demand	Anodyne	CA1	21	40
CCC(=O)Nc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819414111	FF	On-Demand	Anodyne	CA4	18	41
CCC(=O)Nc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819414112	FF	On-Demand	Anodyne	CA2	18	52
CCC(=O)Nc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819414112	FF	On-Demand	Anodyne	CA1	21	40
CCC(=O)Nc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819414112	FF	On-Demand	Anodyne	CA4	18	41
CC(=O)Nc1cc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1C	ZINC000819414117	FF	On-Demand	Anodyne	ADRB3	29	44
CC(=O)Nc1cc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1C	ZINC000819414118	FF	On-Demand	Anodyne	ADRB3	29	44
CCOc1ccc(OC[C@@H](O)CNc2cc(C(=O)NC)ccc2OC)cc1	ZINC000819414125	FE	On-Demand	Anodyne	ADRB2	32	47
CCOc1ccc(OC[C@H](O)CNc2cc(C(=O)NC)ccc2OC)cc1	ZINC000819414126	FE	On-Demand	Anodyne	ADRB2	32	47
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc(CN3CCOC3=O)c2)c1	ZINC000819414127	GF	On-Demand	Anodyne	ABCB1	17	43
CC(=O)c1cccc(OC[C@H](O)CNc2cccc(CN3CCOC3=O)c2)c1	ZINC000819414128	GF	On-Demand	Anodyne	ABCB1	17	43
COC(=O)C1(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCC1	ZINC000819414132	FD	On-Demand	Mild	PAPA1_CARPA	40	50
COC(=O)C1(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCC1	ZINC000819414133	FD	On-Demand	Mild	PAPA1_CARPA	40	50
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)[C@H](O)Cc1ccccc1	ZINC000819414141	CD	On-Demand	Anodyne	REN	46	35
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)[C@@H](O)Cc1ccccc1	ZINC000819414142	CD	On-Demand	Anodyne	REN	46	35
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)[C@H](O)Cc1ccccc1	ZINC000819414143	CD	On-Demand	Anodyne	REN	46	35
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)[C@@H](O)Cc1ccccc1	ZINC000819414144	CD	On-Demand	Anodyne	REN	46	35
CC(=O)Nc1cc(NC[C@@H](O)c2ccc(C)cc2)ccc1C	ZINC000819414157	CG	On-Demand	Anodyne	ADRB3	16	41
CC(=O)Nc1cc(NC[C@H](O)c2ccc(C)cc2)ccc1C	ZINC000819414158	CG	On-Demand	Anodyne	ADRB3	16	41
CCC(=O)Nc1ccc(NCCS(C)(=O)=O)cc1	ZINC000819414165	CD	On-Demand	Anodyne	CA2	16	55
CCC(=O)Nc1ccc(NCCS(C)(=O)=O)cc1	ZINC000819414165	CD	On-Demand	Anodyne	RORC	15	42
O=C1OCCN1Cc1cccc(NC[C@H](O)Cc2ccc3ccccc3c2)c1	ZINC000819414170	GH	On-Demand	Anodyne	TRY2_BOVIN	54	33
O=C1OCCN1Cc1cccc(NC[C@@H](O)Cc2ccc3ccccc3c2)c1	ZINC000819414171	GH	On-Demand	Anodyne	TRY2_BOVIN	54	33
CC(=O)Nc1cc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)ccc1C	ZINC000819414172	FH	On-Demand	Anodyne	GCGR	21	42
CC(=O)Nc1cc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)ccc1C	ZINC000819414172	FH	On-Demand	Anodyne	ADRB3	20	40
CC(=O)Nc1cc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)ccc1C	ZINC000819414172	FH	On-Demand	Anodyne	P2RY1	47	37
CC(=O)Nc1cc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)ccc1C	ZINC000819414172	FH	On-Demand	Anodyne	SHH	42	35
CC(=O)Nc1cc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)ccc1C	ZINC000819414173	FH	On-Demand	Anodyne	GCGR	21	42
CC(=O)Nc1cc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)ccc1C	ZINC000819414173	FH	On-Demand	Anodyne	ADRB3	20	40
CC(=O)Nc1cc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)ccc1C	ZINC000819414173	FH	On-Demand	Anodyne	P2RY1	47	37
CC(=O)Nc1cc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)ccc1C	ZINC000819414173	FH	On-Demand	Anodyne	SHH	42	35
COc1cc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1NC(C)=O	ZINC000819414192	GE	On-Demand	Anodyne	ADRB3	28	40
COc1cc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1NC(C)=O	ZINC000819414193	GE	On-Demand	Anodyne	ADRB3	28	40
C=C(C)C(C)(C)C(=O)NOCc1cccnc1	ZINC000819414198	BE	On-Demand	Mild	NAMPT	21	40
CCC(=O)Nc1ccc(NCCS(=O)(=O)CC)cc1	ZINC000819414201	CD	On-Demand	Anodyne	CA2	19	57
CCC(=O)Nc1ccc(NCCS(=O)(=O)CC)cc1	ZINC000819414201	CD	On-Demand	Anodyne	CA4	17	40
CCC(=O)Nc1ccc(NCCS(=O)(=O)CC)cc1	ZINC000819414201	CD	On-Demand	Anodyne	CA12	15	57
CCC(=O)Nc1ccc(NCCS(=O)(=O)CC)cc1	ZINC000819414201	CD	On-Demand	Anodyne	CA9	15	57
CCC(=O)Nc1ccc(NCCS(=O)(=O)CC)cc1	ZINC000819414201	CD	On-Demand	Anodyne	RORC	24	42
CCOc1cc(F)ccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819414229	DD	On-Demand	Anodyne	CCR1	38	45
CCOc1cc(F)ccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819414230	DD	On-Demand	Anodyne	CCR1	38	45
CCOc1cc(F)ccc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819414235	EG	On-Demand	Anodyne	CCR1	35	40
CCOc1cc(F)ccc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819414235	EG	On-Demand	Anodyne	NOD2	41	38
CCOc1cc(F)ccc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819414236	EG	On-Demand	Anodyne	CCR1	35	40
CCOc1cc(F)ccc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819414236	EG	On-Demand	Anodyne	NOD2	41	38
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(OCc2cccnc2)c1	ZINC000819414243	GG	On-Demand	Anodyne	PDS	49	31
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(OCc2cccnc2)c1	ZINC000819414244	GG	On-Demand	Anodyne	PDS	49	31
O[C@@H](CNc1cccc(COCC(F)(F)C(F)F)c1)c1cccc(Cl)c1	ZINC000819414253	GJ	On-Demand	Anodyne	ADRB1	30	41
O[C@@H](CNc1cccc(COCC(F)(F)C(F)F)c1)c1cccc(Cl)c1	ZINC000819414253	GJ	On-Demand	Anodyne	ADRB3	41	41
O[C@H](CNc1cccc(COCC(F)(F)C(F)F)c1)c1cccc(Cl)c1	ZINC000819414254	GJ	On-Demand	Anodyne	ADRB1	30	41
O[C@H](CNc1cccc(COCC(F)(F)C(F)F)c1)c1cccc(Cl)c1	ZINC000819414254	GJ	On-Demand	Anodyne	ADRB3	41	41
CCOc1cc(F)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819414266	DG	On-Demand	Bother	CACNA1D	61	34
CCOc1cc(F)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819414267	DG	On-Demand	Bother	CACNA1D	61	34
N#Cc1ccc(NNC(=O)C(F)=C2CCC2)cc1C(F)(F)F	ZINC000819414310	DG	On-Demand	Reactive	AR	53	43
CCOc1cc(F)ccc1NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819414318	FF	On-Demand	Anodyne	PTGS2	27	40
CCOc1cc(F)ccc1NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819414319	FF	On-Demand	Anodyne	PTGS2	27	40
Cc1cc(F)ccc1NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819414320	FG	On-Demand	Reactive	PAPA1_CARPA	44	48
Cc1cc(F)ccc1NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819414321	FG	On-Demand	Reactive	PAPA1_CARPA	44	48
CCOc1cc(F)ccc1NCC1(O)CCC1	ZINC000819414374	BF	On-Demand	Anodyne	HCN1	45	33
CCOc1cc(F)ccc1NCC1(O)CCC1	ZINC000819414374	BF	On-Demand	Anodyne	HCN4	43	32
CCOc1cc(F)ccc1NC[C@H](O)c1cccnc1	ZINC000819414381	CF	On-Demand	Anodyne	ADRB1	21	41
CCOc1cc(F)ccc1NC[C@H](O)c1cccnc1	ZINC000819414381	CF	On-Demand	Anodyne	ADRB3	69	41
CCOc1cc(F)ccc1NC[C@@H](O)c1cccnc1	ZINC000819414382	CF	On-Demand	Anodyne	ADRB1	21	41
CCOc1cc(F)ccc1NC[C@@H](O)c1cccnc1	ZINC000819414382	CF	On-Demand	Anodyne	ADRB3	69	41
CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819414385	EF	On-Demand	Mild	ADRB1	59	37
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819414386	EF	On-Demand	Mild	ADRB1	59	37
CCOc1cc(F)ccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819414404	GH	On-Demand	Anodyne	GPR119	65	55
CCOc1cc(F)ccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819414405	GH	On-Demand	Anodyne	GPR119	65	55
CCOC[C@H](O)CNc1ccc(NC(=O)OC)cc1	ZINC000819414419	CD	On-Demand	Anodyne	ADRB2	15	40
CCOC[C@H](O)CNc1ccc(NC(=O)OC)cc1	ZINC000819414419	CD	On-Demand	Anodyne	ADRB1	18	40
CCOc1cc(F)ccc1NC[C@@H](O)CN1CCOCC1	ZINC000819414428	CD	On-Demand	Anodyne	CCR1	41	44
CCOc1cc(F)ccc1NC[C@@H](O)CN1CCOCC1	ZINC000819414428	CD	On-Demand	Anodyne	HIPK3	17	41
CCOc1cc(F)ccc1NC[C@@H](O)CN1CCOCC1	ZINC000819414428	CD	On-Demand	Anodyne	MUSK	18	41
CCOc1cc(F)ccc1NC[C@@H](O)CN1CCOCC1	ZINC000819414428	CD	On-Demand	Anodyne	SRMS	23	41
CCOc1cc(F)ccc1NC[C@H](O)CN1CCOCC1	ZINC000819414429	CD	On-Demand	Anodyne	CCR1	41	44
CCOc1cc(F)ccc1NC[C@H](O)CN1CCOCC1	ZINC000819414429	CD	On-Demand	Anodyne	HIPK3	17	41
CCOc1cc(F)ccc1NC[C@H](O)CN1CCOCC1	ZINC000819414429	CD	On-Demand	Anodyne	MUSK	18	41
CCOc1cc(F)ccc1NC[C@H](O)CN1CCOCC1	ZINC000819414429	CD	On-Demand	Anodyne	SRMS	23	41
C=CCC1(C(=O)NNc2ccc(C#N)c(C(F)(F)F)c2)CCOCC1	ZINC000819414435	FG	On-Demand	Reactive	AR	48	43
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cc(Cl)nc(Cl)c1	ZINC000819414438	IK	On-Demand	Anodyne	CNR1	50	31
CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819414440	EG	On-Demand	Mild	ADRB2	30	42
CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819414440	EG	On-Demand	Mild	ADRB1	48	36
CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819414440	EG	On-Demand	Mild	CASR	40	36
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819414441	EG	On-Demand	Mild	ADRB2	30	42
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819414441	EG	On-Demand	Mild	ADRB1	48	36
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819414441	EG	On-Demand	Mild	CASR	40	36
CC(=O)Nc1cccc(CC(=O)NCC2(C)OCCO2)c1	ZINC000819414444	CD	On-Demand	Anodyne	KCNK3	52	34
CCOc1cc(F)ccc1NC[C@H](O)c1cccc(F)c1	ZINC000819414445	CH	On-Demand	Anodyne	ADRB1	15	40
CCOc1cc(F)ccc1NC[C@@H](O)c1cccc(F)c1	ZINC000819414446	CH	On-Demand	Anodyne	ADRB1	15	40
CCOc1cc(F)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819414464	EG	On-Demand	Anodyne	ADRB2	28	43
CCOc1cc(F)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819414464	EG	On-Demand	Anodyne	ADRB1	63	39
CCOc1cc(F)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819414464	EG	On-Demand	Anodyne	ABCB1	18	42
CCOc1cc(F)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819414464	EG	On-Demand	Anodyne	PDS	56	38
CCOc1cc(F)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819414465	EG	On-Demand	Anodyne	ADRB2	28	43
CCOc1cc(F)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819414465	EG	On-Demand	Anodyne	ADRB1	63	39
CCOc1cc(F)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819414465	EG	On-Demand	Anodyne	ABCB1	18	42
CCOc1cc(F)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819414465	EG	On-Demand	Anodyne	PDS	56	38
C[C@@H]1CCCC[C@@H]1C(=O)NNc1cccc2cnccc12	ZINC000819414495	CH	On-Demand	Reactive	TRPV1	20	46
C[C@@H]1CCCC[C@@H]1C(=O)NNc1cccc2cnccc12	ZINC000819414495	CH	On-Demand	Reactive	CDK5	26	45
C[C@@H]1CCCC[C@H]1C(=O)NNc1cccc2cnccc12	ZINC000819414496	CH	On-Demand	Reactive	TRPV1	20	46
C[C@@H]1CCCC[C@H]1C(=O)NNc1cccc2cnccc12	ZINC000819414496	CH	On-Demand	Reactive	CDK5	26	45
C[C@@H]1CCCC[C@H]1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	ZINC000819414502	GD	On-Demand	Reactive	EPHX2	22	43
C[C@@H]1CCCC[C@H]1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	ZINC000819414502	GD	On-Demand	Reactive	TGM2	64	43
C[C@@H]1CCCC[C@H]1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	ZINC000819414502	GD	On-Demand	Reactive	F13A1	84	43
C[C@@H]1CCCC[C@H]1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	ZINC000819414502	GD	On-Demand	Reactive	NAMPT	32	40
C[C@@H]1CCCC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	ZINC000819414504	GD	On-Demand	Reactive	EPHX2	22	43
C[C@@H]1CCCC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	ZINC000819414504	GD	On-Demand	Reactive	TGM2	64	43
C[C@@H]1CCCC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	ZINC000819414504	GD	On-Demand	Reactive	F13A1	84	43
C[C@@H]1CCCC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	ZINC000819414504	GD	On-Demand	Reactive	NAMPT	32	40
O[C@@H](CNc1cccc(COCC(F)(F)C(F)F)c1)c1cccnc1	ZINC000819414514	FH	On-Demand	Anodyne	ADRB1	22	41
O[C@@H](CNc1cccc(COCC(F)(F)C(F)F)c1)c1cccnc1	ZINC000819414514	FH	On-Demand	Anodyne	ADRB3	82	41
O[C@H](CNc1cccc(COCC(F)(F)C(F)F)c1)c1cccnc1	ZINC000819414515	FH	On-Demand	Anodyne	ADRB1	22	41
O[C@H](CNc1cccc(COCC(F)(F)C(F)F)c1)c1cccnc1	ZINC000819414515	FH	On-Demand	Anodyne	ADRB3	82	41
CCOc1cc(F)ccc1NCC1(O)CCCCC1	ZINC000819414526	CG	On-Demand	Anodyne	HCN1	49	37
CCOc1cc(F)ccc1NCC1(O)CCCCC1	ZINC000819414526	CG	On-Demand	Anodyne	HCN4	47	36
CCOc1cc(F)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819414528	FF	On-Demand	Bother	ADRB2	21	41
CCOc1cc(F)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819414528	FF	On-Demand	Bother	ADRB1	46	42
CCOc1cc(F)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819414528	FF	On-Demand	Bother	CACNA1D	45	33
CCOc1cc(F)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819414528	FF	On-Demand	Bother	PDS	31	45
CCOc1cc(F)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819414529	FF	On-Demand	Bother	ADRB2	21	41
CCOc1cc(F)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819414529	FF	On-Demand	Bother	ADRB1	46	42
CCOc1cc(F)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819414529	FF	On-Demand	Bother	CACNA1D	45	33
CCOc1cc(F)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819414529	FF	On-Demand	Bother	PDS	31	45
Cc1ccc(F)c(NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819414551	FG	On-Demand	Reactive	PAPA1_CARPA	44	48
Cc1ccc(F)c(NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819414552	FG	On-Demand	Reactive	PAPA1_CARPA	44	48
CCOc1cc(F)ccc1NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819414555	GH	On-Demand	Anodyne	GPR119	33	41
CCOc1cc(F)ccc1NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819414555	GH	On-Demand	Anodyne	HCN1	50	34
CCOc1cc(F)ccc1NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819414555	GH	On-Demand	Anodyne	HCN4	43	33
CCOc1cc(F)ccc1NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819414556	GH	On-Demand	Anodyne	GPR119	33	41
CCOc1cc(F)ccc1NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819414556	GH	On-Demand	Anodyne	HCN1	50	34
CCOc1cc(F)ccc1NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819414556	GH	On-Demand	Anodyne	HCN4	43	33
COC[C@@H](O)CNc1ccc(NC(=O)OC)cc1	ZINC000819414572	CD	On-Demand	Anodyne	ADRB2	17	43
COC[C@@H](O)CNc1ccc(NC(=O)OC)cc1	ZINC000819414572	CD	On-Demand	Anodyne	ADRB1	28	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000819414575	GF	On-Demand	Reactive	AR	50	43
CCOC(=O)C1CCC(O)(CNc2ccc(NC(=O)OC)cc2)CC1	ZINC000819414585	FF	On-Demand	Anodyne	TIMP3	47	31
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccccc1F	ZINC000819414589	DG	On-Demand	Anodyne	ADRB2	28	45
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccccc1F	ZINC000819414589	DG	On-Demand	Anodyne	ADRB1	58	41
CCOc1cc(F)ccc1NC[C@H](O)COc1ccccc1F	ZINC000819414590	DG	On-Demand	Anodyne	ADRB2	28	45
CCOc1cc(F)ccc1NC[C@H](O)COc1ccccc1F	ZINC000819414590	DG	On-Demand	Anodyne	ADRB1	58	41
CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819414595	FG	On-Demand	Anodyne	ADRB2	44	55
CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819414595	FG	On-Demand	Anodyne	ADRB1	72	55
CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819414595	FG	On-Demand	Anodyne	GRIN1	24	41
CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819414595	FG	On-Demand	Anodyne	ADRB3	41	48
CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819414595	FG	On-Demand	Anodyne	CCR1	27	40
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819414596	FG	On-Demand	Anodyne	ADRB2	44	55
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819414596	FG	On-Demand	Anodyne	ADRB1	72	55
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819414596	FG	On-Demand	Anodyne	GRIN1	24	41
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819414596	FG	On-Demand	Anodyne	ADRB3	41	48
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819414596	FG	On-Demand	Anodyne	CCR1	27	40
CCOc1cc(F)ccc1NC[C@@H](O)COCc1ccccc1	ZINC000819414642	DG	On-Demand	Anodyne	PPIA	23	41
C/C=C\c1ccc(OC[C@H](O)CNc2ccc(NC(=O)OC)cc2)c(OC)c1	ZINC000819414684	GH	On-Demand	Anodyne	ADRB2	17	64
C/C=C\c1ccc(OC[C@H](O)CNc2ccc(NC(=O)OC)cc2)c(OC)c1	ZINC000819414684	GH	On-Demand	Anodyne	ADRB1	24	64
C/C=C\c1ccc(OC[C@H](O)CNc2ccc(NC(=O)OC)cc2)c(OC)c1	ZINC000819414684	GH	On-Demand	Anodyne	TUBB1	40	33
C/C=C/c1ccc(OC[C@H](O)CNc2ccc(NC(=O)OC)cc2)c(OC)c1	ZINC000819414685	GH	On-Demand	Anodyne	ADRB2	17	64
C/C=C/c1ccc(OC[C@H](O)CNc2ccc(NC(=O)OC)cc2)c(OC)c1	ZINC000819414685	GH	On-Demand	Anodyne	ADRB1	24	64
C/C=C/c1ccc(OC[C@H](O)CNc2ccc(NC(=O)OC)cc2)c(OC)c1	ZINC000819414685	GH	On-Demand	Anodyne	TUBB1	40	33
C/C=C/c1ccc(OC[C@@H](O)CNc2ccc(NC(=O)OC)cc2)c(OC)c1	ZINC000819414686	GH	On-Demand	Anodyne	ADRB2	17	64
C/C=C/c1ccc(OC[C@@H](O)CNc2ccc(NC(=O)OC)cc2)c(OC)c1	ZINC000819414686	GH	On-Demand	Anodyne	ADRB1	24	64
C/C=C/c1ccc(OC[C@@H](O)CNc2ccc(NC(=O)OC)cc2)c(OC)c1	ZINC000819414686	GH	On-Demand	Anodyne	TUBB1	40	33
C/C=C\c1ccc(OC[C@@H](O)CNc2ccc(NC(=O)OC)cc2)c(OC)c1	ZINC000819414687	GH	On-Demand	Anodyne	ADRB2	17	64
C/C=C\c1ccc(OC[C@@H](O)CNc2ccc(NC(=O)OC)cc2)c(OC)c1	ZINC000819414687	GH	On-Demand	Anodyne	ADRB1	24	64
C/C=C\c1ccc(OC[C@@H](O)CNc2ccc(NC(=O)OC)cc2)c(OC)c1	ZINC000819414687	GH	On-Demand	Anodyne	TUBB1	40	33
CCOc1cc(F)ccc1NC[C@@H](O)COCC(C)C	ZINC000819414689	CF	On-Demand	Anodyne	ADRB2	17	40
CCOc1cc(F)ccc1NC[C@H](O)COCC(C)C	ZINC000819414690	CF	On-Demand	Anodyne	ADRB2	17	40
C[C@@H](CC(=O)NNc1ccc(C#N)c(C(F)(F)F)c1)n1cccn1	ZINC000819414700	EF	On-Demand	Reactive	AR	60	41
C[C@H](CC(=O)NNc1ccc(C#N)c(C(F)(F)F)c1)n1cccn1	ZINC000819414701	EF	On-Demand	Reactive	AR	60	41
CCOc1ccc(OC[C@@H](O)CNc2ccc(NC(=O)OC)cc2)cc1	ZINC000819414702	FG	On-Demand	Anodyne	ADRB2	53	54
CCOc1ccc(OC[C@@H](O)CNc2ccc(NC(=O)OC)cc2)cc1	ZINC000819414702	FG	On-Demand	Anodyne	ADRB1	78	54
CCOc1ccc(OC[C@@H](O)CNc2ccc(NC(=O)OC)cc2)cc1	ZINC000819414702	FG	On-Demand	Anodyne	ADRB3	48	49
CCOc1ccc(OC[C@@H](O)CNc2ccc(NC(=O)OC)cc2)cc1	ZINC000819414702	FG	On-Demand	Anodyne	PDS	46	37
CCOc1ccc(OC[C@H](O)CNc2ccc(NC(=O)OC)cc2)cc1	ZINC000819414703	FG	On-Demand	Anodyne	ADRB2	53	54
CCOc1ccc(OC[C@H](O)CNc2ccc(NC(=O)OC)cc2)cc1	ZINC000819414703	FG	On-Demand	Anodyne	ADRB1	78	54
CCOc1ccc(OC[C@H](O)CNc2ccc(NC(=O)OC)cc2)cc1	ZINC000819414703	FG	On-Demand	Anodyne	ADRB3	48	49
CCOc1ccc(OC[C@H](O)CNc2ccc(NC(=O)OC)cc2)cc1	ZINC000819414703	FG	On-Demand	Anodyne	PDS	46	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NNc1ccc(C#N)c(C(F)(F)F)c1)C2	ZINC000819414704	GF	On-Demand	Reactive	AR	51	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NNc1ccc(C#N)c(C(F)(F)F)c1)C2	ZINC000819414705	GF	On-Demand	Reactive	AR	51	43
CCOc1cc(F)ccc1NC[C@H](O)c1ccccc1	ZINC000819414706	CG	On-Demand	Anodyne	ADRB3	35	44
CCOc1cc(F)ccc1NC[C@@H](O)c1ccccc1	ZINC000819414707	CG	On-Demand	Anodyne	ADRB3	35	44
CCOc1cc(F)ccc1NC[C@@H](O)Cc1ccccc1	ZINC000819414708	CG	On-Demand	Anodyne	PDS	41	37
CCOc1cc(F)ccc1NC[C@H](O)Cc1ccccc1	ZINC000819414709	CG	On-Demand	Anodyne	PDS	41	37
CON(C)C(=O)CCNc1cccc(COc2ccc3c(c2)OCO3)c1	ZINC000819414737	FF	On-Demand	Anodyne	MAOB	44	43
CON(C)C(=O)CCNc1cccc(COc2ccc3c(c2)OCO3)c1	ZINC000819414737	FF	On-Demand	Anodyne	EDNRB	48	42
CON(C)C(=O)CCNc1cccc(COc2ccc3c(c2)OCO3)c1	ZINC000819414737	FF	On-Demand	Anodyne	EDNRA	55	42
CON(C)C(=O)CCNc1cccc(COc2ccc3c(c2)OCO3)c1	ZINC000819414737	FF	On-Demand	Anodyne	BMP1	47	34
CON(C)C(=O)CCNc1cccc(COc2ccc3c(c2)OCO3)c1	ZINC000819414737	FF	On-Demand	Anodyne	FFAR1	58	36
N#Cc1ccc(NNC(=O)/C=C/[C@H]2CCCO2)cc1C(F)(F)F	ZINC000819414738	EF	On-Demand	Reactive	AR	44	42
N#Cc1ccc(NNC(=O)/C=C\[C@@H]2CCCO2)cc1C(F)(F)F	ZINC000819414739	EF	On-Demand	Reactive	AR	44	42
N#Cc1ccc(NNC(=O)/C=C\[C@H]2CCCO2)cc1C(F)(F)F	ZINC000819414740	EF	On-Demand	Reactive	AR	44	42
N#Cc1ccc(NNC(=O)/C=C/[C@@H]2CCCO2)cc1C(F)(F)F	ZINC000819414741	EF	On-Demand	Reactive	AR	44	42
C=C(C)C(C)(C)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	ZINC000819414745	GD	On-Demand	Reactive	TGM2	66	39
C=C(C)C(C)(C)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1	ZINC000819414745	GD	On-Demand	Reactive	F13A1	94	42
COc1cccc([S@@](=O)CC(=O)NCC2(C)OCCO2)c1	ZINC000819414757	DC	On-Demand	Anodyne	MTNR1A	44	38
COc1cccc([S@@](=O)CC(=O)NCC2(C)OCCO2)c1	ZINC000819414757	DC	On-Demand	Anodyne	MTNR1B	41	38
CCOc1cc(F)ccc1NCC1(O)CCS(=O)(=O)CC1	ZINC000819414778	DD	On-Demand	Anodyne	HCN1	46	35
CCOc1cc(F)ccc1NCC1(O)CCS(=O)(=O)CC1	ZINC000819414778	DD	On-Demand	Anodyne	HCN4	43	32
C=C(C)C(C)(C)C(=O)NNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000819414789	DH	On-Demand	Reactive	AR	62	48
CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819414790	FF	On-Demand	Anodyne	ADRB2	38	48
CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819414790	FF	On-Demand	Anodyne	ADRB1	55	42
CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819414790	FF	On-Demand	Anodyne	ADRB3	27	40
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819414791	FF	On-Demand	Anodyne	ADRB2	38	48
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819414791	FF	On-Demand	Anodyne	ADRB1	55	42
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819414791	FF	On-Demand	Anodyne	ADRB3	27	40
CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819414801	DG	On-Demand	Anodyne	ADRB2	42	44
CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819414801	DG	On-Demand	Anodyne	ADRB1	53	37
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819414802	DG	On-Demand	Anodyne	ADRB2	42	44
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819414802	DG	On-Demand	Anodyne	ADRB1	53	37
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1ccccc1Cl	ZINC000819414803	GH	On-Demand	Anodyne	ADRB1	53	37
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1ccccc1Cl	ZINC000819414804	GH	On-Demand	Anodyne	ADRB1	53	37
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1ccccc1Cl	ZINC000819414805	GH	On-Demand	Anodyne	ADRB1	53	37
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1ccccc1Cl	ZINC000819414806	GH	On-Demand	Anodyne	ADRB1	53	37
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819414813	FF	On-Demand	Bother	ADRB2	20	41
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819414813	FF	On-Demand	Bother	ADRB1	57	38
CCOc1cc(F)ccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819414814	FF	On-Demand	Bother	ADRB2	20	41
CCOc1cc(F)ccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819414814	FF	On-Demand	Bother	ADRB1	57	38
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)c1	ZINC000819414816	GG	On-Demand	Anodyne	ADRB2	31	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)c1	ZINC000819414816	GG	On-Demand	Anodyne	ADRB1	60	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)c1	ZINC000819414816	GG	On-Demand	Anodyne	ABCB1	16	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)c1	ZINC000819414817	GG	On-Demand	Anodyne	ADRB2	31	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)c1	ZINC000819414817	GG	On-Demand	Anodyne	ADRB1	60	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)c1	ZINC000819414817	GG	On-Demand	Anodyne	ABCB1	16	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)c1	ZINC000819414818	GG	On-Demand	Anodyne	ADRB2	31	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)c1	ZINC000819414818	GG	On-Demand	Anodyne	ADRB1	60	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC[C@H]3CCCO3)cc2)c1	ZINC000819414818	GG	On-Demand	Anodyne	ABCB1	16	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)c1	ZINC000819414819	GG	On-Demand	Anodyne	ADRB2	31	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)c1	ZINC000819414819	GG	On-Demand	Anodyne	ADRB1	60	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC[C@@H]3CCCO3)cc2)c1	ZINC000819414819	GG	On-Demand	Anodyne	ABCB1	16	42
O=C(/C=C/[C@H]1CCCO1)NNc1c(F)cc(C(=O)NC2CC2)cc1F	ZINC000819414839	FE	On-Demand	Reactive	MAPK13	63	32
O=C(/C=C\[C@@H]1CCCO1)NNc1c(F)cc(C(=O)NC2CC2)cc1F	ZINC000819414840	FE	On-Demand	Reactive	MAPK13	63	32
O=C(/C=C\[C@H]1CCCO1)NNc1c(F)cc(C(=O)NC2CC2)cc1F	ZINC000819414841	FE	On-Demand	Reactive	MAPK13	63	32
O=C(/C=C/[C@@H]1CCCO1)NNc1c(F)cc(C(=O)NC2CC2)cc1F	ZINC000819414842	FE	On-Demand	Reactive	MAPK13	63	32
CCOc1cc(F)ccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819414854	EH	On-Demand	Anodyne	ADRB2	22	59
CCOc1cc(F)ccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819414854	EH	On-Demand	Anodyne	ADRB1	40	59
CCOc1cc(F)ccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819414854	EH	On-Demand	Anodyne	HTR1A	15	60
CCOc1cc(F)ccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819414854	EH	On-Demand	Anodyne	SLC6A4	16	44
CCOc1cc(F)ccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819414856	EH	On-Demand	Anodyne	ADRB2	22	59
CCOc1cc(F)ccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819414856	EH	On-Demand	Anodyne	ADRB1	40	59
CCOc1cc(F)ccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819414856	EH	On-Demand	Anodyne	HTR1A	15	60
CCOc1cc(F)ccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819414856	EH	On-Demand	Anodyne	SLC6A4	16	44
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1ccc(F)cc1	ZINC000819414867	FG	On-Demand	Anodyne	ADRB1	48	47
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1ccc(F)cc1	ZINC000819414869	FG	On-Demand	Anodyne	ADRB1	48	47
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1ccc(F)cc1	ZINC000819414871	FG	On-Demand	Anodyne	ADRB1	48	47
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1ccc(F)cc1	ZINC000819414872	FG	On-Demand	Anodyne	ADRB1	48	47
O[C@@H](CNc1cccc(COc2ccc3c(c2)OCO3)c1)C1CC1	ZINC000819414919	EG	On-Demand	Anodyne	MAOB	18	54
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1ccc(OCc2ccccc2)cc1	ZINC000819414920	JK	On-Demand	Anodyne	CYSLTR2	52	33
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1ccc(OCc2ccccc2)cc1	ZINC000819414920	JK	On-Demand	Anodyne	ADAM17	41	36
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1ccc(OCc2ccccc2)cc1	ZINC000819414920	JK	On-Demand	Anodyne	SLC6A5	37	41
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1ccc(OCc2ccccc2)cc1	ZINC000819414920	JK	On-Demand	Anodyne	FLT3	20	45
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1ccc(OCc2ccccc2)cc1	ZINC000819414920	JK	On-Demand	Anodyne	SMO	28	41
O[C@H](CNc1cccc(COc2ccc3c(c2)OCO3)c1)C1CC1	ZINC000819414921	EG	On-Demand	Anodyne	MAOB	18	54
C/C=C/c1ccc(OC[C@@H](O)CNc2cccc(NC(=O)OC)c2)c(OC)c1	ZINC000819414947	GH	On-Demand	Anodyne	ADRB2	19	60
C/C=C/c1ccc(OC[C@H](O)CNc2cccc(NC(=O)OC)c2)c(OC)c1	ZINC000819414949	GH	On-Demand	Anodyne	ADRB2	19	60
C/C=C\c1ccc(OC[C@@H](O)CNc2cccc(NC(=O)OC)c2)c(OC)c1	ZINC000819414951	GH	On-Demand	Anodyne	ADRB2	19	60
C/C=C\c1ccc(OC[C@H](O)CNc2cccc(NC(=O)OC)c2)c(OC)c1	ZINC000819414953	GH	On-Demand	Anodyne	ADRB2	19	60
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cc2c(s1)CCC2	ZINC000819414982	HK	On-Demand	Anodyne	CNR1	49	30
C[C@@H]1CCCC[C@H]1C(=O)Nc1cc(Cl)[nH]n1	ZINC000819414989	BF	On-Demand	Anodyne	TYK2	56	37
C[C@@H]1CCCC[C@@H]1C(=O)Nc1cc(Cl)[nH]n1	ZINC000819414991	BF	On-Demand	Anodyne	TYK2	56	37
O=C(/C=C\[C@H]1CCCO1)NNc1ccc(Cl)c(F)c1	ZINC000819414998	CF	On-Demand	Reactive	ENV	42	39
O=C(/C=C/[C@H]1CCCO1)NNc1ccc(Cl)c(F)c1	ZINC000819415001	CF	On-Demand	Reactive	ENV	42	39
O=C(/C=C\[C@@H]1CCCO1)NNc1ccc(Cl)c(F)c1	ZINC000819415003	CF	On-Demand	Reactive	ENV	42	39
O=C(/C=C/[C@@H]1CCCO1)NNc1ccc(Cl)c(F)c1	ZINC000819415005	CF	On-Demand	Reactive	ENV	42	39
CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819415077	EG	On-Demand	Anodyne	ADRB2	31	46
CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819415077	EG	On-Demand	Anodyne	ADRB1	62	35
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819415079	EG	On-Demand	Anodyne	ADRB2	31	46
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819415079	EG	On-Demand	Anodyne	ADRB1	62	35
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccc(Cl)cc1	ZINC000819415092	EI	On-Demand	Anodyne	NPY2R	74	43
Cc1cc(OC(C)C)ccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819415102	DD	On-Demand	Anodyne	ACOX1	44	31
Cc1cc(OC(C)C)ccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819415105	DD	On-Demand	Anodyne	ACOX1	44	31
O[C@@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1ccc(Cl)cc1	ZINC000819415112	GH	On-Demand	Anodyne	ADRB1	43	47
O[C@@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1ccc(Cl)cc1	ZINC000819415116	GH	On-Demand	Anodyne	ADRB1	43	47
O[C@H](CNc1ccc(OC[C@@H]2CCCO2)cc1)COc1ccc(Cl)cc1	ZINC000819415118	GH	On-Demand	Anodyne	ADRB1	43	47
O[C@H](CNc1ccc(OC[C@H]2CCCO2)cc1)COc1ccc(Cl)cc1	ZINC000819415120	GH	On-Demand	Anodyne	ADRB1	43	47
Cc1cc(OC(C)C)ccc1NC[C@H](O)c1cccnc1	ZINC000819415135	CG	On-Demand	Anodyne	ADRB2	16	42
Cc1cc(OC(C)C)ccc1NC[C@H](O)c1cccnc1	ZINC000819415135	CG	On-Demand	Anodyne	ADRB1	27	46
Cc1cc(OC(C)C)ccc1NC[C@H](O)c1cccnc1	ZINC000819415135	CG	On-Demand	Anodyne	ADRB3	62	46
Cc1cc(OC(C)C)ccc1NC[C@@H](O)c1cccnc1	ZINC000819415147	CG	On-Demand	Anodyne	ADRB2	16	42
Cc1cc(OC(C)C)ccc1NC[C@@H](O)c1cccnc1	ZINC000819415147	CG	On-Demand	Anodyne	ADRB1	27	46
Cc1cc(OC(C)C)ccc1NC[C@@H](O)c1cccnc1	ZINC000819415147	CG	On-Demand	Anodyne	ADRB3	62	46
COC[C@@H](C)OC[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819415159	EE	On-Demand	Anodyne	NPY2R	61	35
COC[C@@H](C)OC[C@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819415163	EE	On-Demand	Anodyne	NPY2R	61	35
O=S(=O)(CCNc1ccc(N2CCCC2)c(F)c1)c1ccccc1	ZINC000819415169	EG	On-Demand	Anodyne	KCNQ2	44	33
O=S(=O)(CCNc1ccc(N2CCCC2)c(F)c1)c1ccccc1	ZINC000819415169	EG	On-Demand	Anodyne	NPY2R	85	39
CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1Cl	ZINC000819415188	DH	On-Demand	Anodyne	ADRB2	23	41
CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1Cl	ZINC000819415188	DH	On-Demand	Anodyne	ADRB1	27	49
CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1Cl	ZINC000819415188	DH	On-Demand	Anodyne	ADRB3	83	49
CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1Cl	ZINC000819415188	DH	On-Demand	Anodyne	CYP51A1	16	42
CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1Cl	ZINC000819415191	DH	On-Demand	Anodyne	ADRB2	23	41
CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1Cl	ZINC000819415191	DH	On-Demand	Anodyne	ADRB1	27	49
CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1Cl	ZINC000819415191	DH	On-Demand	Anodyne	ADRB3	83	49
CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1Cl	ZINC000819415191	DH	On-Demand	Anodyne	CYP51A1	16	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415194	FG	On-Demand	Anodyne	ADRB2	25	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415194	FG	On-Demand	Anodyne	ADRB1	54	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415194	FG	On-Demand	Anodyne	NPY2R	72	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415194	FG	On-Demand	Anodyne	ABCB1	26	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415196	FG	On-Demand	Anodyne	ADRB2	25	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415196	FG	On-Demand	Anodyne	ADRB1	54	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415196	FG	On-Demand	Anodyne	NPY2R	72	41
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415196	FG	On-Demand	Anodyne	ABCB1	26	43
CCCOc1ccc(NCCC(=O)NC(N)=O)cc1Cl	ZINC000819415212	CE	On-Demand	Anodyne	PPARA	17	40
COC[C@@H](O)CNc1ccc(OC)c(NC(=O)c2ccc(Cl)cc2F)c1	ZINC000819415245	GG	On-Demand	Anodyne	CPT1A	60	38
COC[C@@H](O)CNc1ccc(OC)c(NC(=O)c2ccc(Cl)cc2F)c1	ZINC000819415245	GG	On-Demand	Anodyne	CPT2	44	36
COC[C@@H](O)CNc1ccc(OC)c(NC(=O)c2ccc(Cl)cc2F)c1	ZINC000819415245	GG	On-Demand	Anodyne	KCNMA1	34	44
COC[C@@H](O)CNc1ccc(OC)c(NC(=O)c2ccc(Cl)cc2F)c1	ZINC000819415245	GG	On-Demand	Anodyne	CPT1B	45	38
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1c(F)cccc1F	ZINC000819415295	EH	On-Demand	Anodyne	NPY2R	69	36
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1c(F)cccc1F	ZINC000819415297	EH	On-Demand	Anodyne	NPY2R	69	36
C#CCNC(=O)CCNc1cccc(COc2ccc3c(c2)OCO3)c1	ZINC000819415300	FF	On-Demand	Mild	HRH2	19	41
C#CCNC(=O)CCNc1cccc(COc2ccc3c(c2)OCO3)c1	ZINC000819415300	FF	On-Demand	Mild	MAOB	39	48
C#CCNC(=O)CCNc1cccc(COc2ccc3c(c2)OCO3)c1	ZINC000819415300	FF	On-Demand	Mild	EDNRB	24	41
C#CCNC(=O)CCNc1cccc(COc2ccc3c(c2)OCO3)c1	ZINC000819415300	FF	On-Demand	Mild	EDNRA	31	41
C#CCNC(=O)CCNc1cccc(COc2ccc3c(c2)OCO3)c1	ZINC000819415300	FF	On-Demand	Mild	FFAR1	51	35
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccc(F)cc1F	ZINC000819415315	EH	On-Demand	Anodyne	NPY2R	48	43
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccc(F)cc1F	ZINC000819415317	EH	On-Demand	Anodyne	NPY2R	48	43
O=C(NNc1cccc2cnccc12)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819415329	FI	On-Demand	Reactive	TRPV1	24	48
O=C(NNc1cccc2cnccc12)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819415329	FI	On-Demand	Reactive	CDK5	25	42
C=CCC1(C(=O)NNc2cccc3cnccc23)CCOCC1	ZINC000819415341	DG	On-Demand	Reactive	TRPV1	18	42
C=C(C)C(C)(C)C(=O)NNc1cccc2cnccc12	ZINC000819415344	CG	On-Demand	Reactive	TRPV1	21	49
CCOc1cc(F)ccc1NC[C@H](O)COc1ccccc1	ZINC000819415357	DG	On-Demand	Anodyne	ADRB2	54	48
CCOc1cc(F)ccc1NC[C@H](O)COc1ccccc1	ZINC000819415357	DG	On-Demand	Anodyne	ADRB1	65	42
CCOc1cc(F)ccc1NC[C@H](O)COc1ccccc1	ZINC000819415357	DG	On-Demand	Anodyne	ADRB3	36	42
CCOc1cc(F)ccc1NC[C@H](O)COc1ccccc1	ZINC000819415357	DG	On-Demand	Anodyne	PDS	66	39
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccccc1	ZINC000819415358	DG	On-Demand	Anodyne	ADRB2	54	48
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccccc1	ZINC000819415358	DG	On-Demand	Anodyne	ADRB1	65	42
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccccc1	ZINC000819415358	DG	On-Demand	Anodyne	ADRB3	36	42
CCOc1cc(F)ccc1NC[C@@H](O)COc1ccccc1	ZINC000819415358	DG	On-Demand	Anodyne	PDS	66	39
O=C(Nc1cc(Cl)[nH]n1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819415359	DH	On-Demand	Anodyne	TYK2	44	33
CCOc1cc(F)ccc1NCC1(O)CCCC1	ZINC000819415368	CF	On-Demand	Anodyne	HCN1	47	35
CCOc1cc(F)ccc1NCC1(O)CCCC1	ZINC000819415368	CF	On-Demand	Anodyne	HCN4	45	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)C(=O)Cc1ccccc1)C2	ZINC000819415385	FE	On-Demand	Anodyne	SLC6A3	25	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)C(=O)Cc1ccccc1)C2	ZINC000819415385	FE	On-Demand	Anodyne	XIAP	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)C(=O)Cc1ccccc1)C2	ZINC000819415385	FE	On-Demand	Anodyne	BIRC2	29	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)C(=O)Cc1ccccc1)C2	ZINC000819415386	FE	On-Demand	Anodyne	SLC6A3	25	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)C(=O)Cc1ccccc1)C2	ZINC000819415386	FE	On-Demand	Anodyne	XIAP	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)C(=O)Cc1ccccc1)C2	ZINC000819415386	FE	On-Demand	Anodyne	BIRC2	29	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)C(=O)Cc1ccccc1)C2	ZINC000819415387	FE	On-Demand	Anodyne	SLC6A3	25	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)C(=O)Cc1ccccc1)C2	ZINC000819415387	FE	On-Demand	Anodyne	XIAP	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)C(=O)Cc1ccccc1)C2	ZINC000819415387	FE	On-Demand	Anodyne	BIRC2	29	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)C(=O)Cc1ccccc1)C2	ZINC000819415388	FE	On-Demand	Anodyne	SLC6A3	25	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)C(=O)Cc1ccccc1)C2	ZINC000819415388	FE	On-Demand	Anodyne	XIAP	18	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)C(=O)Cc1ccccc1)C2	ZINC000819415388	FE	On-Demand	Anodyne	BIRC2	29	40
C[C@@H](CC(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)n1cccn1	ZINC000819415455	FE	On-Demand	Reactive	MAPK14	29	43
C[C@@H](CC(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)n1cccn1	ZINC000819415455	FE	On-Demand	Reactive	MAPK13	89	39
C[C@H](CC(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)n1cccn1	ZINC000819415456	FE	On-Demand	Reactive	MAPK14	29	43
C[C@H](CC(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F)n1cccn1	ZINC000819415456	FE	On-Demand	Reactive	MAPK13	89	39
COC[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819415477	CD	On-Demand	Anodyne	NPY2R	72	38
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2C)cc1	ZINC000819415485	FH	On-Demand	Anodyne	ADRB2	41	60
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2C)cc1	ZINC000819415485	FH	On-Demand	Anodyne	ADRB1	67	60
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2C)cc1	ZINC000819415485	FH	On-Demand	Anodyne	GRIN1	22	41
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2C)cc1	ZINC000819415485	FH	On-Demand	Anodyne	ADRB3	41	49
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2C)cc1	ZINC000819415487	FH	On-Demand	Anodyne	ADRB2	41	60
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2C)cc1	ZINC000819415487	FH	On-Demand	Anodyne	ADRB1	67	60
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2C)cc1	ZINC000819415487	FH	On-Demand	Anodyne	GRIN1	22	41
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2C)cc1	ZINC000819415487	FH	On-Demand	Anodyne	ADRB3	41	49
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccccc1	ZINC000819415495	DH	On-Demand	Anodyne	KCNQ2	69	38
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccccc1	ZINC000819415495	DH	On-Demand	Anodyne	NPY2R	119	46
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccccc1	ZINC000819415497	DH	On-Demand	Anodyne	KCNQ2	69	38
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccccc1	ZINC000819415497	DH	On-Demand	Anodyne	NPY2R	119	46
Cc1cc(OC(C)C)ccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819415501	FH	On-Demand	Bother	ADRB2	24	41
Cc1cc(OC(C)C)ccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819415501	FH	On-Demand	Bother	ADRB1	51	33
Cc1cc(OC(C)C)ccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819415501	FH	On-Demand	Bother	COLA	49	32
Cc1cc(OC(C)C)ccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819415503	FH	On-Demand	Bother	ADRB2	24	41
Cc1cc(OC(C)C)ccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819415503	FH	On-Demand	Bother	ADRB1	51	33
Cc1cc(OC(C)C)ccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819415503	FH	On-Demand	Bother	COLA	49	32
COc1cccc([S@@](=O)CC(=O)NC[C@H](C)CNC(=O)OC(C)(C)C)c1	ZINC000819415521	GE	On-Demand	Anodyne	MTNR1A	32	42
COc1cccc([S@@](=O)CC(=O)NC[C@H](C)CNC(=O)OC(C)(C)C)c1	ZINC000819415521	GE	On-Demand	Anodyne	MTNR1B	33	42
COc1cccc([S@@](=O)CC(=O)NC[C@@H](C)CNC(=O)OC(C)(C)C)c1	ZINC000819415522	GE	On-Demand	Anodyne	MTNR1A	32	42
COc1cccc([S@@](=O)CC(=O)NC[C@@H](C)CNC(=O)OC(C)(C)C)c1	ZINC000819415522	GE	On-Demand	Anodyne	MTNR1B	33	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc2[nH]c(-c3ccco3)nc2c1	ZINC000819415525	GH	On-Demand	Anodyne	NR2E3	53	32
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc2[nH]c(-c3ccco3)nc2c1	ZINC000819415526	GH	On-Demand	Anodyne	NR2E3	53	32
COCCOc1cc(C)ccc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819415530	FF	On-Demand	Anodyne	NOD2	40	36
COCCOc1cc(C)ccc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819415531	FF	On-Demand	Anodyne	NOD2	40	36
CN(C[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1)C1CC1	ZINC000819415532	DE	On-Demand	Anodyne	NPY2R	79	42
CN(C[C@H](O)CNc1ccc(N2CCCC2)c(F)c1)C1CC1	ZINC000819415533	DE	On-Demand	Anodyne	NPY2R	79	42
CCOC[C@H](O)CNc1ccc(OC)c(NC(=O)c2ccc(Cl)cc2F)c1	ZINC000819415537	GH	On-Demand	Anodyne	CPT1A	52	37
CCOC[C@H](O)CNc1ccc(OC)c(NC(=O)c2ccc(Cl)cc2F)c1	ZINC000819415537	GH	On-Demand	Anodyne	CPT2	40	35
CCOC[C@H](O)CNc1ccc(OC)c(NC(=O)c2ccc(Cl)cc2F)c1	ZINC000819415537	GH	On-Demand	Anodyne	KCNMA1	28	42
CCOC[C@H](O)CNc1ccc(OC)c(NC(=O)c2ccc(Cl)cc2F)c1	ZINC000819415537	GH	On-Demand	Anodyne	CPT1B	40	37
CC[C@H](O)CNc1ccccc1OCC(C)C	ZINC000819415539	BF	On-Demand	Clean	ADRB2	28	48
CCCOc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1Cl	ZINC000819415540	GH	On-Demand	Anodyne	ADRB2	38	54
CCCOc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1Cl	ZINC000819415540	GH	On-Demand	Anodyne	ADRB1	69	54
CCCOc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1Cl	ZINC000819415540	GH	On-Demand	Anodyne	GRIN1	29	42
CCCOc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1Cl	ZINC000819415540	GH	On-Demand	Anodyne	ADRB3	40	47
CCCOc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1Cl	ZINC000819415541	GH	On-Demand	Anodyne	ADRB2	38	54
CCCOc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1Cl	ZINC000819415541	GH	On-Demand	Anodyne	ADRB1	69	54
CCCOc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1Cl	ZINC000819415541	GH	On-Demand	Anodyne	GRIN1	29	42
CCCOc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1Cl	ZINC000819415541	GH	On-Demand	Anodyne	ADRB3	40	47
O=[N+]([O-])c1ccc(S(=O)(=O)CCNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415550	GG	On-Demand	Bother	SLC6A9	15	41
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1cc(F)ccc1F	ZINC000819415571	EH	On-Demand	Anodyne	NPY2R	47	38
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1cc(F)ccc1F	ZINC000819415572	EH	On-Demand	Anodyne	NPY2R	47	38
COC[C@@H](O)CNc1ccccc1OCC(C)C	ZINC000819415576	CE	On-Demand	Clean	ADRB2	36	50
COC[C@@H](O)CNc1ccccc1OCC(C)C	ZINC000819415576	CE	On-Demand	Clean	ADRB1	56	37
COCCOc1cc(C)ccc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819415577	EG	On-Demand	Anodyne	ADRB2	34	44
COCCOc1cc(C)ccc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819415577	EG	On-Demand	Anodyne	ADRB1	42	42
COCCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819415578	EG	On-Demand	Anodyne	ADRB2	34	44
COCCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819415578	EG	On-Demand	Anodyne	ADRB1	42	42
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccc(F)c1	ZINC000819415579	DH	On-Demand	Anodyne	KCNQ2	50	44
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccc(F)c1	ZINC000819415579	DH	On-Demand	Anodyne	NPY2R	81	44
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccc(F)c1	ZINC000819415579	DH	On-Demand	Anodyne	TAAR1	19	40
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccc(F)c1	ZINC000819415580	DH	On-Demand	Anodyne	KCNQ2	50	44
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccc(F)c1	ZINC000819415580	DH	On-Demand	Anodyne	NPY2R	81	44
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccc(F)c1	ZINC000819415580	DH	On-Demand	Anodyne	TAAR1	19	40
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccnc1	ZINC000819415583	DF	On-Demand	Anodyne	ADRB3	88	50
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccnc1	ZINC000819415583	DF	On-Demand	Anodyne	NPY2R	81	42
N#CCCCOc1cccc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819415628	EG	On-Demand	Mild	ACR	15	47
N#CCCCOc1cccc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819415629	EG	On-Demand	Mild	ACR	15	47
CON(C)C(=O)CCNc1cccc(OCC(C)C)c1	ZINC000819415671	CF	On-Demand	Anodyne	MTNR1A	16	40
CON(C)C(=O)CCNc1cccc(OCC(C)C)c1	ZINC000819415671	CF	On-Demand	Anodyne	MTNR1B	20	40
CON(C)C(=O)CCNc1cccc(OCC(C)C)c1	ZINC000819415671	CF	On-Demand	Anodyne	PDS	66	35
O=C(NC1CC1)c1cc(F)c(NNC(=O)c2cc3c(cn2)OCCO3)c(F)c1	ZINC000819415672	GD	On-Demand	Reactive	MAPK13	66	34
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccnc1	ZINC000819415712	DF	On-Demand	Anodyne	ADRB3	88	50
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccnc1	ZINC000819415712	DF	On-Demand	Anodyne	NPY2R	81	42
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccccc1Cl	ZINC000819415718	EI	On-Demand	Anodyne	KCNQ2	49	37
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccccc1Cl	ZINC000819415718	EI	On-Demand	Anodyne	NPY2R	93	37
CCOC(=O)C1CCC(O)(CNc2ccc(N3CCCC3)c(F)c2)CC1	ZINC000819415746	FG	On-Demand	Anodyne	NPY2R	83	38
O[C@H](CCc1ccccc1)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819415752	EH	On-Demand	Anodyne	KCNQ2	61	35
O[C@H](CCc1ccccc1)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819415752	EH	On-Demand	Anodyne	NPY2R	92	40
O[C@@H](CCc1ccccc1)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819415753	EH	On-Demand	Anodyne	KCNQ2	61	35
O[C@@H](CCc1ccccc1)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819415753	EH	On-Demand	Anodyne	NPY2R	92	40
N#CCc1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415759	FG	On-Demand	Mild	ADRB1	48	36
N#CCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415760	FG	On-Demand	Mild	ADRB1	48	36
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)CN1CCOCC1	ZINC000819415766	DD	On-Demand	Anodyne	NPY2R	61	37
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)CN1CCOCC1	ZINC000819415767	DD	On-Demand	Anodyne	NPY2R	61	37
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819415770	EG	On-Demand	Bother	NPY2R	74	38
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819415771	EG	On-Demand	Bother	NPY2R	74	38
N#Cc1ccc(S(=O)(=O)CCNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415772	FG	On-Demand	Mild	NPY2R	23	41
N#Cc1ccc(S(=O)(=O)CCNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415772	FG	On-Demand	Mild	SLC6A9	16	47
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)CN1CCc2ccccc2C1	ZINC000819415785	FG	On-Demand	Anodyne	NPY2R	70	38
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)CN1CCc2ccccc2C1	ZINC000819415786	FG	On-Demand	Anodyne	NPY2R	70	38
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819415791	GG	On-Demand	Bother	ADRB1	15	42
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819415791	GG	On-Demand	Bother	NPY2R	44	35
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819415792	GG	On-Demand	Bother	ADRB1	15	42
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819415792	GG	On-Demand	Bother	NPY2R	44	35
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2C)cc1	ZINC000819415793	FH	On-Demand	Anodyne	ADRB2	27	47
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2C)cc1	ZINC000819415793	FH	On-Demand	Anodyne	ADRB1	33	44
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2C)cc1	ZINC000819415793	FH	On-Demand	Anodyne	ABCB1	16	48
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2C)cc1	ZINC000819415794	FH	On-Demand	Anodyne	ADRB2	27	47
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2C)cc1	ZINC000819415794	FH	On-Demand	Anodyne	ADRB1	33	44
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2C)cc1	ZINC000819415794	FH	On-Demand	Anodyne	ABCB1	16	48
Cc1cc(OC(C)C)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819415802	FH	On-Demand	Mild	ADRB2	29	41
Cc1cc(OC(C)C)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819415802	FH	On-Demand	Mild	ADRB1	33	41
Cc1cc(OC(C)C)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819415803	FH	On-Demand	Mild	ADRB2	29	41
Cc1cc(OC(C)C)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819415803	FH	On-Demand	Mild	ADRB1	33	41
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)Cc1ccccc1	ZINC000819415807	DG	On-Demand	Anodyne	KCNQ2	50	37
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)Cc1ccccc1	ZINC000819415807	DG	On-Demand	Anodyne	NPY2R	96	41
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)Cc1ccccc1	ZINC000819415808	DG	On-Demand	Anodyne	KCNQ2	50	37
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)Cc1ccccc1	ZINC000819415808	DG	On-Demand	Anodyne	NPY2R	96	41
CON(C)C(=O)CCNc1ccc2[nH]c(-c3ccco3)nc2c1	ZINC000819415811	DF	On-Demand	Anodyne	NR2E3	62	33
CCCOc1ccc(NCCS(C)(=O)=O)cc1Cl	ZINC000819415812	CF	On-Demand	Anodyne	EGFR	19	41
CCCOc1ccc(NCCS(C)(=O)=O)cc1Cl	ZINC000819415812	CF	On-Demand	Anodyne	ERBB2	23	41
CCOC[C@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819415813	CE	On-Demand	Anodyne	NPY2R	73	38
Cc1cc(OC(C)C)ccc1NC[C@@H](O)c1ccccc1	ZINC000819415818	CH	On-Demand	Anodyne	ADRB1	22	44
Cc1cc(OC(C)C)ccc1NC[C@@H](O)c1ccccc1	ZINC000819415818	CH	On-Demand	Anodyne	ADRB3	42	41
Cc1cc(OC(C)C)ccc1NC[C@@H](O)c1ccccc1	ZINC000819415818	CH	On-Demand	Anodyne	AOC3	16	43
Cc1cc(OC(C)C)ccc1NC[C@H](O)c1ccccc1	ZINC000819415819	CH	On-Demand	Anodyne	ADRB1	22	44
Cc1cc(OC(C)C)ccc1NC[C@H](O)c1ccccc1	ZINC000819415819	CH	On-Demand	Anodyne	ADRB3	42	41
Cc1cc(OC(C)C)ccc1NC[C@H](O)c1ccccc1	ZINC000819415819	CH	On-Demand	Anodyne	AOC3	16	43
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415822	GG	On-Demand	Anodyne	ADRB2	35	55
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415822	GG	On-Demand	Anodyne	ADRB1	68	55
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415822	GG	On-Demand	Anodyne	ADRB3	42	45
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415822	GG	On-Demand	Anodyne	KCNQ2	47	35
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415822	GG	On-Demand	Anodyne	NPY2R	81	43
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415823	GG	On-Demand	Anodyne	ADRB2	35	55
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415823	GG	On-Demand	Anodyne	ADRB1	68	55
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415823	GG	On-Demand	Anodyne	ADRB3	42	45
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415823	GG	On-Demand	Anodyne	KCNQ2	47	35
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819415823	GG	On-Demand	Anodyne	NPY2R	81	43
N#CCCCOc1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819415843	EG	On-Demand	Mild	ACR	17	44
N#CCCCOc1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819415844	EG	On-Demand	Mild	ACR	17	44
OC1(CNc2cccc(Cn3cncn3)c2)CCCCC1	ZINC000819415848	CE	On-Demand	Anodyne	CYP19A1	28	40
COc1ccc(-c2cnc(NC(=O)c3cccc[n+]3[O-])n2C)cc1	ZINC000819415937	DD	On-Demand	Anodyne	LUCI_LUCLA	22	42
COc1ccc(-c2cnc(NC(=O)[C@@H]3CSCN3C(=O)OC(C)(C)C)n2C)cc1	ZINC000819415938	HG	On-Demand	Anodyne	CACNA1B	15	46
COc1ccc(-c2cnc(NC(=O)[C@H]3CSCN3C(=O)OC(C)(C)C)n2C)cc1	ZINC000819415939	HG	On-Demand	Anodyne	CACNA1B	15	46
COc1ccc(-c2cnc(NC(=O)[C@H]3CCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819415946	HG	On-Demand	Anodyne	MMP13	20	45
COc1ccc(-c2cnc(NC(=O)[C@H]3CCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819415946	HG	On-Demand	Anodyne	MMP3	16	45
COc1ccc(-c2cnc(NC(=O)[C@H]3CCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819415946	HG	On-Demand	Anodyne	MMP9	15	45
COc1ccc(-c2cnc(NC(=O)[C@H]3CCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819415946	HG	On-Demand	Anodyne	MMP1	15	45
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819415947	HG	On-Demand	Anodyne	MMP13	20	45
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819415947	HG	On-Demand	Anodyne	MMP3	16	45
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819415947	HG	On-Demand	Anodyne	MMP9	15	45
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819415947	HG	On-Demand	Anodyne	MMP1	15	45
COc1ccc(-c2cnc(NC(=O)c3nn(C)c(=O)c4ccccc34)n2C)cc1	ZINC000819415952	GF	On-Demand	Anodyne	IMDH_CRYPV	23	48
COc1ccc(-c2cnc(NC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)n2C)cc1	ZINC000819415961	HF	On-Demand	Anodyne	CA2	20	47
COc1ccc(-c2cnc(NC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)n2C)cc1	ZINC000819415961	HF	On-Demand	Anodyne	F10	16	41
COc1ccc(-c2cnc(NC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)n2C)cc1	ZINC000819415961	HF	On-Demand	Anodyne	CA6	17	40
COc1ccc(-c2cnc(NC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)n2C)cc1	ZINC000819415961	HF	On-Demand	Anodyne	CA1	19	47
COc1ccc(-c2cnc(NC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)n2C)cc1	ZINC000819415961	HF	On-Demand	Anodyne	CA7	22	40
COc1ccc(-c2cnc(NC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)n2C)cc1	ZINC000819415961	HF	On-Demand	Anodyne	CPT1A	49	35
COc1ccc(-c2cnc(NC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)n2C)cc1	ZINC000819415961	HF	On-Demand	Anodyne	CA13	38	40
COc1ccc(-c2cnc(NC(=O)CN(C)C3=NS(=O)(=O)c4ccccc43)n2C)cc1	ZINC000819415969	IE	On-Demand	Anodyne	KCNA3	17	42
COc1ccc(-c2cnc(NC(=O)C3CCN(C(=O)/C=C\c4ccccc4)CC3)n2C)cc1	ZINC000819415972	IH	On-Demand	Anodyne	MMP9	15	42
COc1ccc(-c2cnc(NC(=O)C3CCN(C(=O)/C=C/c4ccccc4)CC3)n2C)cc1	ZINC000819415973	IH	On-Demand	Anodyne	MMP9	15	42
COc1ccc(-c2cnc(NC(=O)c3ccc(N)c([N+](=O)[O-])c3)n2C)cc1	ZINC000819415977	FF	On-Demand	Bother	TAAR1	25	41
COc1ccc(-c2cnc(NC(=O)[C@H](CC(F)F)NC(=O)OC(C)(C)C)n2C)cc1	ZINC000819415981	HH	On-Demand	Anodyne	POLG_HCV1	24	43
COc1ccc(-c2cnc(NC(=O)[C@@H](CC(F)F)NC(=O)OC(C)(C)C)n2C)cc1	ZINC000819415982	HH	On-Demand	Anodyne	POLG_HCV1	24	43
COc1ccc(-c2cnc(NC(=O)[C@@H]3CC(c4cccc(OC)c4)=NO3)n2C)cc1	ZINC000819415983	HG	On-Demand	Anodyne	LUCI_PHOPY	25	41
COc1ccc(-c2cnc(NC(=O)[C@H]3CC(c4cccc(OC)c4)=NO3)n2C)cc1	ZINC000819415984	HG	On-Demand	Anodyne	LUCI_PHOPY	25	41
CCOc1ccccc1C(F)(F)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819415987	EG	On-Demand	Anodyne	HCN1	49	34
CCOc1ccccc1C(F)(F)C(=O)N1CCCO[C@H](C(C)C)C1	ZINC000819415987	EG	On-Demand	Anodyne	HCN4	42	33
CCOc1ccccc1C(F)(F)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819415988	EG	On-Demand	Anodyne	HCN1	49	34
CCOc1ccccc1C(F)(F)C(=O)N1CCCO[C@@H](C(C)C)C1	ZINC000819415988	EG	On-Demand	Anodyne	HCN4	42	33
COc1ccc(-c2cnc(NC(=O)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819415991	HH	On-Demand	Anodyne	MMP13	18	47
COc1ccc(-c2cnc(NC(=O)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819415991	HH	On-Demand	Anodyne	MMP3	15	44
COc1ccc(-c2cnc(NC(=O)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819415991	HH	On-Demand	Anodyne	MMP9	15	47
COc1ccc(-c2cnc(NC(=O)[C@H]3CCCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819415991	HH	On-Demand	Anodyne	MMP1	15	47
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819415992	HH	On-Demand	Anodyne	MMP13	18	47
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819415992	HH	On-Demand	Anodyne	MMP3	15	44
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819415992	HH	On-Demand	Anodyne	MMP9	15	47
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819415992	HH	On-Demand	Anodyne	MMP1	15	47
COc1ccc(-c2cnc(NC(=O)[C@H](CCSC)NC(=O)OC(C)(C)C)n2C)cc1	ZINC000819415993	IH	On-Demand	Anodyne	PAPA1_CARPA	32	46
COc1ccc(-c2cnc(NC(=O)[C@H](CCSC)NC(=O)OC(C)(C)C)n2C)cc1	ZINC000819415993	IH	On-Demand	Anodyne	FPR1	23	42
COc1ccc(-c2cnc(NC(=O)[C@@H](CCSC)NC(=O)OC(C)(C)C)n2C)cc1	ZINC000819415994	IH	On-Demand	Anodyne	PAPA1_CARPA	32	46
COc1ccc(-c2cnc(NC(=O)[C@@H](CCSC)NC(=O)OC(C)(C)C)n2C)cc1	ZINC000819415994	IH	On-Demand	Anodyne	FPR1	23	42
CCOC(=O)N1CCC(C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)CC1	ZINC000819415999	GF	On-Demand	Anodyne	CHRM2	17	44
CCOC(=O)N1CCC(C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)CC1	ZINC000819415999	GF	On-Demand	Anodyne	P2RY12	69	38
CCOC(=O)N1CCC(C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)CC1	ZINC000819415999	GF	On-Demand	Anodyne	GRIN2B	15	41
CCOC(=O)N1CCC(C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)CC1	ZINC000819415999	GF	On-Demand	Anodyne	MMP13	25	48
COc1ccc(-c2cnc(NC(=O)c3ccccc3NC(=O)c3ccsc3)n2C)cc1	ZINC000819416013	IJ	On-Demand	Anodyne	LUCI_LUCLA	23	42
CC(C)[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)CCCO1	ZINC000819416031	FG	On-Demand	Bother	SLC6A9	23	55
Cc1cc(OC(C)C)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819416034	EH	On-Demand	Bother	CACNA1C	52	37
Cc1cc(OC(C)C)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819416034	EH	On-Demand	Bother	CACNA1D	82	36
Cc1cc(OC(C)C)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819416035	EH	On-Demand	Bother	CACNA1C	52	37
Cc1cc(OC(C)C)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819416035	EH	On-Demand	Bother	CACNA1D	82	36
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccc2c(c1)OCO2	ZINC000819416040	FG	On-Demand	Anodyne	NPY2R	44	37
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccc2c(c1)OCO2	ZINC000819416041	FG	On-Demand	Anodyne	NPY2R	44	37
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819416048	GG	On-Demand	Anodyne	ADRB2	19	40
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819416048	GG	On-Demand	Anodyne	NPY2R	69	37
COc1cccc(OC)c1OC[C@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819416049	GG	On-Demand	Anodyne	ADRB2	19	40
COc1cccc(OC)c1OC[C@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819416049	GG	On-Demand	Anodyne	NPY2R	69	37
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@@H](O)c1ccncc1	ZINC000819416055	FF	On-Demand	Anodyne	SCD	21	41
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@H](O)c1ccncc1	ZINC000819416056	FF	On-Demand	Anodyne	SCD	21	41
CN(C)CC1CCC(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819416057	GF	On-Demand	Mild	PAPA1_CARPA	37	46
CN(C)CC1CCC(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819416058	GF	On-Demand	Mild	PAPA1_CARPA	37	46
CC(C)(C)[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819416059	CG	On-Demand	Anodyne	NPY2R	76	39
CN(C[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1)C(=O)OC(C)(C)C	ZINC000819416061	FG	On-Demand	Anodyne	KCNQ2	41	33
CN(C[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1)C(=O)OC(C)(C)C	ZINC000819416061	FG	On-Demand	Anodyne	NPY2R	86	40
CN(C[C@H](O)CNc1ccc(N2CCCC2)c(F)c1)C(=O)OC(C)(C)C	ZINC000819416062	FG	On-Demand	Anodyne	KCNQ2	41	33
CN(C[C@H](O)CNc1ccc(N2CCCC2)c(F)c1)C(=O)OC(C)(C)C	ZINC000819416062	FG	On-Demand	Anodyne	NPY2R	86	40
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccccc1	ZINC000819416063	EG	On-Demand	Anodyne	ADRB2	43	45
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccccc1	ZINC000819416063	EG	On-Demand	Anodyne	ADRB1	65	41
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccccc1	ZINC000819416063	EG	On-Demand	Anodyne	ADRB3	44	41
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccccc1	ZINC000819416063	EG	On-Demand	Anodyne	KCNQ2	42	33
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccccc1	ZINC000819416063	EG	On-Demand	Anodyne	NPY2R	83	39
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccccc1	ZINC000819416064	EG	On-Demand	Anodyne	ADRB2	43	45
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccccc1	ZINC000819416064	EG	On-Demand	Anodyne	ADRB1	65	41
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccccc1	ZINC000819416064	EG	On-Demand	Anodyne	ADRB3	44	41
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccccc1	ZINC000819416064	EG	On-Demand	Anodyne	KCNQ2	42	33
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccccc1	ZINC000819416064	EG	On-Demand	Anodyne	NPY2R	83	39
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416067	FH	On-Demand	Clean	ADRB2	61	61
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416067	FH	On-Demand	Clean	ADRB1	94	61
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416067	FH	On-Demand	Clean	TSHR	40	31
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416067	FH	On-Demand	Clean	ADRB3	56	50
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416067	FH	On-Demand	Clean	ABCB1	29	41
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416068	FH	On-Demand	Clean	ADRB2	61	61
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416068	FH	On-Demand	Clean	ADRB1	94	61
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416068	FH	On-Demand	Clean	TSHR	40	31
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416068	FH	On-Demand	Clean	ADRB3	56	50
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416068	FH	On-Demand	Clean	ABCB1	29	41
CC[C@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819416075	CF	On-Demand	Anodyne	KCNQ2	54	38
CC[C@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819416075	CF	On-Demand	Anodyne	NPY2R	96	42
O=[N+]([O-])c1cnn(C[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819416076	EE	On-Demand	Bother	NPY2R	47	33
O=[N+]([O-])c1cnn(C[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819416077	EE	On-Demand	Bother	NPY2R	47	33
COCCOc1cc(C)ccc1NC[C@H](O)COc1ccccc1Cl	ZINC000819416078	FH	On-Demand	Anodyne	ADRB2	26	48
COCCOc1cc(C)ccc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819416079	FH	On-Demand	Anodyne	ADRB2	26	48
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)COCc1ccccc1	ZINC000819416092	EG	On-Demand	Anodyne	NPY2R	76	38
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)COCc1ccccc1	ZINC000819416093	EG	On-Demand	Anodyne	NPY2R	76	38
CON(C)C(=O)CCNc1ccc(N2CCCC2)c(F)c1	ZINC000819416097	CE	On-Demand	Anodyne	NPY2R	79	41
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccc(F)cn1	ZINC000819416102	DG	On-Demand	Anodyne	NPY2R	64	34
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccc(F)cn1	ZINC000819416103	DG	On-Demand	Anodyne	NPY2R	64	34
COc1ccccc1NC(=O)CN1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819416104	FE	On-Demand	Anodyne	HTR1A	22	43
COc1ccccc1NC(=O)CN1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819416104	FE	On-Demand	Anodyne	DRD4	17	42
COc1ccccc1COC[C@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819416107	FG	On-Demand	Anodyne	NPY2R	74	36
COc1ccccc1COC[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819416108	FG	On-Demand	Anodyne	NPY2R	74	36
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416121	GF	On-Demand	Anodyne	NPY2R	72	39
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416121	GF	On-Demand	Anodyne	SLC6A9	23	48
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416122	GF	On-Demand	Anodyne	NPY2R	72	39
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416122	GF	On-Demand	Anodyne	SLC6A9	23	48
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416123	GG	On-Demand	Anodyne	ADRB2	38	43
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416123	GG	On-Demand	Anodyne	ADRB1	67	42
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416123	GG	On-Demand	Anodyne	ADRB3	42	41
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416123	GG	On-Demand	Anodyne	NPY2R	75	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416124	GG	On-Demand	Anodyne	ADRB2	38	43
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416124	GG	On-Demand	Anodyne	ADRB1	67	42
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416124	GG	On-Demand	Anodyne	ADRB3	42	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416124	GG	On-Demand	Anodyne	NPY2R	75	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2C)c1	ZINC000819416125	FH	On-Demand	Anodyne	ADRB2	27	48
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2C)c1	ZINC000819416125	FH	On-Demand	Anodyne	ADRB1	29	44
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC(C)C)cc2C)c1	ZINC000819416125	FH	On-Demand	Anodyne	ABCB1	25	47
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2C)c1	ZINC000819416126	FH	On-Demand	Anodyne	ADRB2	27	48
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2C)c1	ZINC000819416126	FH	On-Demand	Anodyne	ADRB1	29	44
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC(C)C)cc2C)c1	ZINC000819416126	FH	On-Demand	Anodyne	ABCB1	25	47
C#CCNC(=O)CCNc1ccc(OCC)c(Cl)c1	ZINC000819416162	CE	On-Demand	Mild	AGPAT2	42	37
N#CCCCOc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819416202	CF	On-Demand	Mild	ADRB2	19	42
N#CCCCOc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819416202	CF	On-Demand	Mild	ADRB1	24	42
N#CCCCOc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819416202	CF	On-Demand	Mild	ADRB3	67	44
N#CCCCOc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819416203	CF	On-Demand	Mild	ADRB2	19	42
N#CCCCOc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819416203	CF	On-Demand	Mild	ADRB1	24	42
N#CCCCOc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819416203	CF	On-Demand	Mild	ADRB3	67	44
O=C(NNc1ccc(Cl)c(F)c1)C(F)=C1CCC1	ZINC000819416220	CG	On-Demand	Reactive	ENV	46	40
COc1ccc(-c2cnc(NC(=O)C3CCN(C(=O)OCC(C)C)CC3)n2C)cc1	ZINC000819416231	HH	On-Demand	Anodyne	MMP13	16	41
COc1ccc(-c2cnc(NC(=O)c3cccnc3F)n2C)cc1	ZINC000819416235	EF	On-Demand	Anodyne	LUCI_LUCLA	16	40
COc1ccc(-c2cnc(NC(=O)[C@H]3CCN3C(=O)OC(C)(C)C)n2C)cc1	ZINC000819416240	GG	On-Demand	Anodyne	MMP13	15	41
COc1ccc(-c2cnc(NC(=O)[C@H]3CCN3C(=O)OC(C)(C)C)n2C)cc1	ZINC000819416240	GG	On-Demand	Anodyne	HDAC8	16	48
COc1ccc(-c2cnc(NC(=O)c3cn(C)c(=O)n(C)c3=O)n2C)cc1	ZINC000819416244	FC	On-Demand	Anodyne	LUCI_LUCLA	17	41
COc1ccc(-c2cnc(NC(=O)/C=C\c3ccsc3)n2C)cc1	ZINC000819416246	EH	On-Demand	Anodyne	UL26	18	40
COc1ccc(-c2cnc(NC(=O)/C=C/c3ccsc3)n2C)cc1	ZINC000819416247	EH	On-Demand	Anodyne	UL26	18	40
COc1ccc(-c2cnc(NC(=O)c3cc(Cl)nc4ccccc34)n2C)cc1	ZINC000819416254	GJ	On-Demand	Anodyne	TACR3	22	40
COc1ccc(-c2cnc(NC(=O)c3cc(Cl)nc4ccccc34)n2C)cc1	ZINC000819416254	GJ	On-Demand	Anodyne	LUCI_LUCLA	37	41
COc1ccc(-c2cnc(NC(=O)c3ccc(S(=O)(=O)N(C)OC)cc3)n2C)cc1	ZINC000819416255	IF	On-Demand	Anodyne	LUCI_LUCLA	15	40
COc1ccc(-c2cnc(NC(=O)c3c(O)cccc3Cl)n2C)cc1	ZINC000819416259	FH	On-Demand	Anodyne	FGFR1	18	40
COc1ccc(-c2cnc(NC(=O)c3c(O)cccc3Cl)n2C)cc1	ZINC000819416259	FH	On-Demand	Anodyne	SRC	15	40
COc1ccc(-c2cnc(NC(=O)c3c(O)cccc3Cl)n2C)cc1	ZINC000819416259	FH	On-Demand	Anodyne	PDK1	49	36
COc1ccc(-c2cnc(NC(=O)Cc3ccc(NC(=O)OC(C)(C)C)cc3)n2C)cc1	ZINC000819416261	IJ	On-Demand	Anodyne	HDAC8	21	42
COc1ccc(-c2cnc(NC(=O)Cc3ccc(NC(=O)OC(C)(C)C)cc3)n2C)cc1	ZINC000819416261	IJ	On-Demand	Anodyne	CA9	16	42
CC(C)[C@H]1CN(C(=O)c2ccc(NC(=O)OC(C)(C)C)cc2Cl)CCCO1	ZINC000819416265	GJ	On-Demand	Anodyne	NPY2R	44	39
COc1ccc(-c2cnc(NC(=O)[C@H]3C[C@H](F)CN3C(=O)OC(C)(C)C)n2C)cc1	ZINC000819416273	HG	On-Demand	Anodyne	HDAC8	15	44
COc1ccc(-c2cnc(NC(=O)c3cc(Cl)c4c(c3)OCCO4)n2C)cc1	ZINC000819416274	GH	On-Demand	Anodyne	PDK1	43	32
COc1ccc(-c2cnc(NC(=O)c3nc(NCc4ccco4)ncc3Cl)n2C)cc1	ZINC000819416280	IH	On-Demand	Anodyne	PDK1	43	33
COc1ccc(-c2cnc(NC(=O)c3ccc(CNC(=O)C=C(C)C)cc3)n2C)cc1	ZINC000819416281	HH	On-Demand	Anodyne	PROKR1	52	31
COc1ccc(-c2cnc(NC(=O)c3ccc(CNC(=O)C=C(C)C)cc3)n2C)cc1	ZINC000819416281	HH	On-Demand	Anodyne	RPA1	36	44
O=C(Nc1sc2c(c1C(=O)c1ccc(Cl)cc1)CCC2)c1cccnc1Cl	ZINC000819416286	HK	On-Demand	Anodyne	G2YM83_BOTF4	80	42
COc1ccc(-c2cnc(NC(=O)c3ccc(S(=O)(=O)C(F)(F)F)cc3)n2C)cc1	ZINC000819416293	IH	On-Demand	Anodyne	SHH	44	35
COc1ccc(-c2cnc(NC(=O)c3cc(S(C)(=O)=O)ccc3Cl)n2C)cc1	ZINC000819416309	HG	On-Demand	Anodyne	PTGS1	16	43
COc1ccc(-c2cnc(NC(=O)c3cc(S(C)(=O)=O)ccc3Cl)n2C)cc1	ZINC000819416309	HG	On-Demand	Anodyne	PTGS2	28	42
COc1ccc(-c2cnc(NC(=O)c3nc(C)n(-c4ccccc4)n3)n2C)cc1	ZINC000819416318	GG	On-Demand	Anodyne	LUCI_LUCLA	23	43
COc1ccc(-c2cnc(NC(=O)c3nc(C)n(-c4ccccc4)n3)n2C)cc1	ZINC000819416318	GG	On-Demand	Anodyne	RPA1	21	43
COc1ccc(-c2cnc(NC(=O)CN3CCC(NC(=O)OC(C)(C)C)CC3)n2C)cc1	ZINC000819416319	IG	On-Demand	Anodyne	PDK1	42	35
COCCOc1cc(C)ccc1NC[C@H](O)COc1cccc(C)c1	ZINC000819416327	EG	On-Demand	Anodyne	ADRB2	33	56
COCCOc1cc(C)ccc1NC[C@H](O)COc1cccc(C)c1	ZINC000819416327	EG	On-Demand	Anodyne	ADRB1	33	56
COCCOc1cc(C)ccc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819416329	EG	On-Demand	Anodyne	ADRB2	33	56
COCCOc1cc(C)ccc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819416329	EG	On-Demand	Anodyne	ADRB1	33	56
Cc1cc(OC(C)C)ccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819416330	EH	On-Demand	Mild	ADRB2	23	42
Cc1cc(OC(C)C)ccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819416332	EH	On-Demand	Mild	ADRB2	23	42
COc1ccc(-c2cnc(NC(=O)/C=C/c3ccc(OC)c(O)c3)n2C)cc1	ZINC000819416333	GG	On-Demand	Anodyne	TUBB1	54	45
O=C1OCCN1Cc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819416334	DE	On-Demand	Anodyne	ADRB2	26	41
O=C1OCCN1Cc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819416334	DE	On-Demand	Anodyne	ADRB1	25	41
O=C1OCCN1Cc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819416334	DE	On-Demand	Anodyne	ADRB3	97	45
O=C1OCCN1Cc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819416335	DE	On-Demand	Anodyne	ADRB2	26	41
O=C1OCCN1Cc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819416335	DE	On-Demand	Anodyne	ADRB1	25	41
O=C1OCCN1Cc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819416335	DE	On-Demand	Anodyne	ADRB3	97	45
COCCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416336	GG	On-Demand	Anodyne	ADRB2	36	53
COCCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416336	GG	On-Demand	Anodyne	ADRB1	64	53
COCCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416336	GG	On-Demand	Anodyne	GRIN1	22	40
COCCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416336	GG	On-Demand	Anodyne	ADRB3	45	38
COCCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416336	GG	On-Demand	Anodyne	NPY2R	44	36
COCCc1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416337	GG	On-Demand	Anodyne	ADRB2	36	53
COCCc1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416337	GG	On-Demand	Anodyne	ADRB1	64	53
COCCc1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416337	GG	On-Demand	Anodyne	GRIN1	22	40
COCCc1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416337	GG	On-Demand	Anodyne	ADRB3	45	38
COCCc1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416337	GG	On-Demand	Anodyne	NPY2R	44	36
COCCOc1cc(C)ccc1NC[C@H](O)COc1ccc(Cl)cc1	ZINC000819416342	FH	On-Demand	Anodyne	ADRB2	28	44
COCCOc1cc(C)ccc1NC[C@H](O)COc1ccc(Cl)cc1	ZINC000819416342	FH	On-Demand	Anodyne	ADRB1	34	42
COCCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819416343	FH	On-Demand	Anodyne	ADRB2	28	44
COCCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819416343	FH	On-Demand	Anodyne	ADRB1	34	42
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)C1CC1	ZINC000819416346	CF	On-Demand	Anodyne	NPY2R	75	39
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)C1CC1	ZINC000819416347	CF	On-Demand	Anodyne	NPY2R	75	39
CCCOc1ccc(NCCC(N)=O)cc1Cl	ZINC000819416352	CE	On-Demand	Anodyne	PPARA	21	41
CCCOc1ccc(NCCC(N)=O)cc1Cl	ZINC000819416352	CE	On-Demand	Anodyne	DRTS_TRYCR	40	37
NC(=O)CCNc1ccc(N2CCCC2)c(F)c1	ZINC000819416357	CD	On-Demand	Anodyne	KCNQ2	51	35
NC(=O)CCNc1ccc(N2CCCC2)c(F)c1	ZINC000819416357	CD	On-Demand	Anodyne	NPY2R	82	39
O=[N+]([O-])c1ccc([C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416358	EG	On-Demand	Bother	NPY2R	65	38
O=[N+]([O-])c1ccc([C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416359	EG	On-Demand	Bother	NPY2R	65	38
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1ccc(N2CCCC2)c(F)c1	ZINC000819416362	GF	On-Demand	Anodyne	NPY2R	76	38
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1ccc(N2CCCC2)c(F)c1	ZINC000819416362	GF	On-Demand	Anodyne	SLC6A9	19	41
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819416363	FH	On-Demand	Anodyne	ADRB1	23	54
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819416363	FH	On-Demand	Anodyne	HTR1A	17	54
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819416363	FH	On-Demand	Anodyne	SLC6A4	19	43
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819416364	FH	On-Demand	Anodyne	ADRB1	23	54
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819416364	FH	On-Demand	Anodyne	HTR1A	17	54
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819416364	FH	On-Demand	Anodyne	SLC6A4	19	43
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416369	EH	On-Demand	Anodyne	ADRB2	33	48
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416369	EH	On-Demand	Anodyne	ADRB1	47	42
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416369	EH	On-Demand	Anodyne	NPY2R	64	39
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416370	EH	On-Demand	Anodyne	ADRB2	33	48
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416370	EH	On-Demand	Anodyne	ADRB1	47	42
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416370	EH	On-Demand	Anodyne	NPY2R	64	39
O=C(NNc1c(F)cc(C(=O)NC2CC2)cc1F)C(F)=C1CCC1	ZINC000819416378	EF	On-Demand	Reactive	MAPK13	67	34
O=c1onc(-c2ccccc2)n1C[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819416386	GF	On-Demand	Anodyne	NPY2R	78	39
O=c1onc(-c2ccccc2)n1C[C@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819416388	GF	On-Demand	Anodyne	NPY2R	78	39
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)COCc1ccco1	ZINC000819416395	EG	On-Demand	Anodyne	NPY2R	46	33
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)COCc1ccco1	ZINC000819416396	EG	On-Demand	Anodyne	NPY2R	46	33
C=CCCn1cc(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)nn1	ZINC000819416398	GD	On-Demand	Reactive	MAPK13	74	35
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416404	FH	On-Demand	Clean	ADRB2	54	46
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416404	FH	On-Demand	Clean	ADRB1	79	39
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416404	FH	On-Demand	Clean	ADRB3	42	40
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416404	FH	On-Demand	Clean	CYP2D6	19	40
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416404	FH	On-Demand	Clean	ABCB1	39	55
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416406	FH	On-Demand	Clean	ADRB2	54	46
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416406	FH	On-Demand	Clean	ADRB1	79	39
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416406	FH	On-Demand	Clean	ADRB3	42	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416406	FH	On-Demand	Clean	CYP2D6	19	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OCC(C)C)cc1	ZINC000819416406	FH	On-Demand	Clean	ABCB1	39	55
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819416416	EI	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819416416	EI	On-Demand	Anodyne	ADRB3	39	41
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819416416	EI	On-Demand	Anodyne	KCNQ2	57	42
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819416416	EI	On-Demand	Anodyne	NPY2R	89	46
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819416416	EI	On-Demand	Anodyne	CYP3A4	45	35
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819416418	EI	On-Demand	Anodyne	ADRB1	25	42
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819416418	EI	On-Demand	Anodyne	ADRB3	39	41
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819416418	EI	On-Demand	Anodyne	KCNQ2	57	42
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819416418	EI	On-Demand	Anodyne	NPY2R	89	46
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819416418	EI	On-Demand	Anodyne	CYP3A4	45	35
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1ccncc1	ZINC000819416420	EE	On-Demand	Anodyne	ADRB3	23	41
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1ccncc1	ZINC000819416427	EE	On-Demand	Anodyne	ADRB3	23	41
OC1(CNc2ccc(N3CCCC3)c(F)c2)CCOCC1	ZINC000819416431	CE	On-Demand	Anodyne	NPY2R	48	35
N#CCCCOc1cccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819416432	FJ	On-Demand	Mild	PDS	41	38
Cc1c(F)cccc1NC(=O)CCNc1ccc(N2CCCC2)c(F)c1	ZINC000819416433	FI	On-Demand	Anodyne	KCNQ2	81	44
Cc1c(F)cccc1NC(=O)CCNc1ccc(N2CCCC2)c(F)c1	ZINC000819416433	FI	On-Demand	Anodyne	NPY2R	95	39
N#CCCCOc1cccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819416436	FJ	On-Demand	Mild	PDS	41	38
C[C@@](O)(CNc1ccc(N2CCCC2)c(F)c1)C(F)(F)F	ZINC000819416442	DG	On-Demand	Anodyne	NPY2R	75	39
O=C(CCNc1ccc(N2CCCC2)c(F)c1)Nc1cccc(F)c1	ZINC000819416448	EI	On-Demand	Anodyne	KCNQ2	66	47
O=C(CCNc1ccc(N2CCCC2)c(F)c1)Nc1cccc(F)c1	ZINC000819416448	EI	On-Demand	Anodyne	NPY2R	104	43
O=C(CCNc1ccc(N2CCCC2)c(F)c1)Nc1cccc(F)c1	ZINC000819416448	EI	On-Demand	Anodyne	TAAR1	28	51
CSc1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416456	GH	On-Demand	Anodyne	ADRB1	41	38
CSc1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416456	GH	On-Demand	Anodyne	NPY2R	63	38
CSc1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416457	GH	On-Demand	Anodyne	ADRB1	41	38
CSc1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819416457	GH	On-Demand	Anodyne	NPY2R	63	38
CN(CCC#N)C[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819416458	DE	On-Demand	Mild	NPY2R	61	39
CN(CCC#N)C[C@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819416467	DE	On-Demand	Mild	NPY2R	61	39
Cc1cc(OC(C)C)ccc1NC[C@@H](O)COCc1ccccc1	ZINC000819416484	EH	On-Demand	Anodyne	CASR	24	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1nc3ccc(C(F)(F)F)cc3[nH]1)C2	ZINC000819416491	GG	On-Demand	Anodyne	CSNK1D	22	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1nc3ccc(C(F)(F)F)cc3[nH]1)C2	ZINC000819416491	GG	On-Demand	Anodyne	TEK	19	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1nc3ccc(C(F)(F)F)cc3[nH]1)C2	ZINC000819416492	GG	On-Demand	Anodyne	CSNK1D	22	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1nc3ccc(C(F)(F)F)cc3[nH]1)C2	ZINC000819416492	GG	On-Demand	Anodyne	TEK	19	42
Cc1cc(OC(C)C)ccc1NC[C@H](O)COCc1ccccc1	ZINC000819416493	EH	On-Demand	Anodyne	CASR	24	47
O=C(CCNc1ccc(N2CCCC2)c(F)c1)Nc1cccnc1	ZINC000819416508	EG	On-Demand	Anodyne	KCNQ2	41	35
O=C(CCNc1ccc(N2CCCC2)c(F)c1)Nc1cccnc1	ZINC000819416508	EG	On-Demand	Anodyne	NPY2R	83	41
O=C(CCNc1ccc(N2CCCC2)c(F)c1)Nc1cccnc1	ZINC000819416508	EG	On-Demand	Anodyne	CHRNA7	28	44
COc1ccc(-c2cnc(NC(=O)/C=C\c3ccc(OC)c(O)c3)n2C)cc1	ZINC000819416530	GG	On-Demand	Anodyne	TUBB1	54	45
COc1ccc(-c2cnc(NC(=O)/C(=C/c3ccco3)NC(=O)c3ccccc3)n2C)cc1	ZINC000819416531	II	On-Demand	Anodyne	LUCI_LUCLA	22	42
COc1ccc(-c2cnc(NC(=O)/C(=C\c3ccco3)NC(=O)c3ccccc3)n2C)cc1	ZINC000819416532	II	On-Demand	Anodyne	LUCI_LUCLA	22	42
COc1ccc(-c2cnc(NC(=O)[C@@H](NC(=O)C(F)(F)F)C(C)C)n2C)cc1	ZINC000819416538	GF	On-Demand	Anodyne	ELANE	43	41
COc1ccc(-c2cnc(NC(=O)c3ccc(C4SCCCS4)cc3)n2C)cc1	ZINC000819416539	IK	On-Demand	Anodyne	LUCI_LUCLA	15	41
COc1ccc(-c2cnc(NC(=O)c3ccc(-n4c(C)cnc4O)cc3)n2C)cc1	ZINC000819416543	HH	On-Demand	Anodyne	LUCI_LUCLA	15	40
COc1ccc(-c2cnc(NC(=O)c3ccccc3NC(=O)C(C)(C)C)n2C)cc1	ZINC000819416551	HI	On-Demand	Anodyne	LUCI_LUCLA	16	40
COc1ccc(-c2cnc(NC(=O)c3c(C)noc3C3CC3)n2C)cc1	ZINC000819416558	FH	On-Demand	Anodyne	PDK1	43	33
COc1ccc(-c2cnc(NC(=O)CSc3nnc(S)s3)n2C)cc1	ZINC000819416561	GF	On-Demand	Anodyne	ENPP1	60	31
COc1ccc(-c2cnc(NC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)n2C)cc1	ZINC000819416577	HH	On-Demand	Anodyne	MMP13	17	49
COc1ccc(-c2cnc(NC(=O)C3CCN(C(=O)OC(C)(C)C)CC3)n2C)cc1	ZINC000819416577	HH	On-Demand	Anodyne	GPR119	44	40
COc1ccc(-c2cnc(NC(=O)C[C@@H]3CCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819416594	HH	On-Demand	Anodyne	GPR119	42	39
COc1ccc(-c2cnc(NC(=O)C[C@H]3CCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819416596	HH	On-Demand	Anodyne	GPR119	42	39
CCOc1ccc(OC[C@@H](O)CNc2cccc(NC(=O)OC)c2)cc1	ZINC000819416611	FG	On-Demand	Anodyne	ADRB2	50	44
CCOc1ccc(OC[C@@H](O)CNc2cccc(NC(=O)OC)c2)cc1	ZINC000819416611	FG	On-Demand	Anodyne	ADRB1	70	44
CCOc1ccc(OC[C@@H](O)CNc2cccc(NC(=O)OC)c2)cc1	ZINC000819416611	FG	On-Demand	Anodyne	ADRB3	44	43
CCOc1ccc(OC[C@@H](O)CNc2cccc(NC(=O)OC)c2)cc1	ZINC000819416611	FG	On-Demand	Anodyne	KCNK3	44	40
CCOc1ccc(OC[C@@H](O)CNc2cccc(NC(=O)OC)c2)cc1	ZINC000819416611	FG	On-Demand	Anodyne	KCNK9	46	40
CCOc1ccc(OC[C@@H](O)CNc2cccc(NC(=O)OC)c2)cc1	ZINC000819416611	FG	On-Demand	Anodyne	PDS	80	41
CCOc1ccc(OC[C@H](O)CNc2cccc(NC(=O)OC)c2)cc1	ZINC000819416612	FG	On-Demand	Anodyne	ADRB2	50	44
CCOc1ccc(OC[C@H](O)CNc2cccc(NC(=O)OC)c2)cc1	ZINC000819416612	FG	On-Demand	Anodyne	ADRB1	70	44
CCOc1ccc(OC[C@H](O)CNc2cccc(NC(=O)OC)c2)cc1	ZINC000819416612	FG	On-Demand	Anodyne	ADRB3	44	43
CCOc1ccc(OC[C@H](O)CNc2cccc(NC(=O)OC)c2)cc1	ZINC000819416612	FG	On-Demand	Anodyne	KCNK3	44	40
CCOc1ccc(OC[C@H](O)CNc2cccc(NC(=O)OC)c2)cc1	ZINC000819416612	FG	On-Demand	Anodyne	KCNK9	46	40
CCOc1ccc(OC[C@H](O)CNc2cccc(NC(=O)OC)c2)cc1	ZINC000819416612	FG	On-Demand	Anodyne	PDS	80	41
COc1ccc(-c2cnc(NC(=O)C(C)(C)CNC(=O)OC(C)(C)C)n2C)cc1	ZINC000819416616	HH	On-Demand	Anodyne	PROKR1	43	30
COc1ccc(CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cn1	ZINC000819416633	GF	On-Demand	Mild	PAPA1_CARPA	50	43
COc1ccc(CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cn1	ZINC000819416635	GF	On-Demand	Mild	PAPA1_CARPA	50	43
N#CCCCOc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819416641	EI	On-Demand	Mild	ADRB1	30	40
N#CCCCOc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819416641	EI	On-Demand	Mild	ADRB3	44	40
N#CCCCOc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819416643	EI	On-Demand	Mild	ADRB1	30	40
N#CCCCOc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819416643	EI	On-Demand	Mild	ADRB3	44	40
COc1ccc(-c2cnc(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])n2C)cc1	ZINC000819416645	GH	On-Demand	Bother	F10	50	32
C=CCC1(C(=O)NNc2c(F)cc(C(=O)NC3CC3)cc2F)CCOCC1	ZINC000819416659	GF	On-Demand	Reactive	MAPK13	55	33
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCCCN3C(=O)c3ccccc3)n2C)cc1	ZINC000819416662	HH	On-Demand	Anodyne	MMP13	23	40
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCCCN3C(=O)c3ccccc3)n2C)cc1	ZINC000819416662	HH	On-Demand	Anodyne	CPT1A	103	43
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCCCN3C(=O)c3ccccc3)n2C)cc1	ZINC000819416662	HH	On-Demand	Anodyne	CPT2	41	36
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCCCN3C(=O)c3ccccc3)n2C)cc1	ZINC000819416662	HH	On-Demand	Anodyne	PREP	51	44
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCCCN3C(=O)c3ccccc3)n2C)cc1	ZINC000819416662	HH	On-Demand	Anodyne	MMP9	19	40
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCCCN3C(=O)c3ccccc3)n2C)cc1	ZINC000819416662	HH	On-Demand	Anodyne	MMP1	20	40
COc1ccc(-c2cnc(NC(=O)[C@H]3CCCCN3C(=O)c3ccccc3)n2C)cc1	ZINC000819416664	HH	On-Demand	Anodyne	MMP13	23	40
COc1ccc(-c2cnc(NC(=O)[C@H]3CCCCN3C(=O)c3ccccc3)n2C)cc1	ZINC000819416664	HH	On-Demand	Anodyne	CPT1A	103	43
COc1ccc(-c2cnc(NC(=O)[C@H]3CCCCN3C(=O)c3ccccc3)n2C)cc1	ZINC000819416664	HH	On-Demand	Anodyne	CPT2	41	36
COc1ccc(-c2cnc(NC(=O)[C@H]3CCCCN3C(=O)c3ccccc3)n2C)cc1	ZINC000819416664	HH	On-Demand	Anodyne	PREP	51	44
COc1ccc(-c2cnc(NC(=O)[C@H]3CCCCN3C(=O)c3ccccc3)n2C)cc1	ZINC000819416664	HH	On-Demand	Anodyne	MMP9	19	40
COc1ccc(-c2cnc(NC(=O)[C@H]3CCCCN3C(=O)c3ccccc3)n2C)cc1	ZINC000819416664	HH	On-Demand	Anodyne	MMP1	20	40
COc1ccc(-c2cnc(NC(=O)c3cccc(CNC(=O)OC(C)(C)C)c3)n2C)cc1	ZINC000819416677	II	On-Demand	Anodyne	DRD4	43	33
COc1ccc(-c2cnc(NC(=O)c3ccc(Cl)c(S(C)(=O)=O)c3)n2C)cc1	ZINC000819416684	HG	On-Demand	Anodyne	CPT1A	52	35
COc1ccc(-c2cnc(NC(=O)c3ccc(Cl)c(S(C)(=O)=O)c3)n2C)cc1	ZINC000819416684	HG	On-Demand	Anodyne	CPT1B	41	32
COc1ccc(-c2cnc(NC(=O)c3cc(-c4ccncc4)nc4ccccc34)n2C)cc1	ZINC000819416685	IJ	On-Demand	Anodyne	PRS	30	40
COc1ccc(-c2cnc(NC(=O)c3cc(-c4ccncc4)nc4ccccc34)n2C)cc1	ZINC000819416685	IJ	On-Demand	Anodyne	TACR3	27	48
COc1ccc(-c2cnc(NC(=O)c3cc(-c4ccncc4)nc4ccccc34)n2C)cc1	ZINC000819416685	IJ	On-Demand	Anodyne	MET	20	41
COc1ccc(-c2cnc(NC(=O)c3cc(-c4ccncc4)nc4ccccc34)n2C)cc1	ZINC000819416685	IJ	On-Demand	Anodyne	MT-CO2	49	39
C=C(C)C(C)(C)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	ZINC000819416692	EF	On-Demand	Reactive	MAPK14	19	41
C=C(C)C(C)(C)C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	ZINC000819416692	EF	On-Demand	Reactive	MAPK13	73	38
C=C(C)C(C)(C)C(=O)NNc1ccc(Cl)c(F)c1	ZINC000819416705	CH	On-Demand	Reactive	ENV	42	36
COc1ccc(-c2cnc(NC(=O)[C@@H]3CC(=O)N(c4cn[nH]c4)C3)n2C)cc1	ZINC000819416718	GD	On-Demand	Anodyne	ROCK2	56	41
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)COCc1ccccc1F	ZINC000819416719	FH	On-Demand	Anodyne	NPY2R	71	36
COc1ccc(-c2cnc(NC(=O)[C@H]3CC(=O)N(c4cn[nH]c4)C3)n2C)cc1	ZINC000819416721	GD	On-Demand	Anodyne	ROCK2	56	41
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)COCc1ccccc1F	ZINC000819416725	FH	On-Demand	Anodyne	NPY2R	71	36
COc1ccc(-c2cnc(NC(=O)CCc3c(C)c4ccc(OC)cc4oc3=O)n2C)cc1	ZINC000819416729	II	On-Demand	Anodyne	MAOB	35	43
COc1ccc(-c2cnc(NC(=O)CCc3c(C)c4ccc(OC)cc4oc3=O)n2C)cc1	ZINC000819416729	II	On-Demand	Anodyne	NQO1	17	42
O=C1c2ccccc2C(=O)N1C[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819416743	GE	On-Demand	Anodyne	KCNQ2	49	33
O=C1c2ccccc2C(=O)N1C[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819416743	GE	On-Demand	Anodyne	NPY2R	87	39
O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819416744	GE	On-Demand	Anodyne	KCNQ2	49	33
O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819416744	GE	On-Demand	Anodyne	NPY2R	87	39
O=C1CCCN1C[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819416749	DD	On-Demand	Anodyne	NPY2R	62	36
O=C1CCCN1C[C@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819416750	DD	On-Demand	Anodyne	NPY2R	62	36
CCOC[C@H](O)CNc1ccccc1OCC(C)C	ZINC000819416757	CF	On-Demand	Clean	ADRB2	32	48
CCOC[C@H](O)CNc1ccccc1OCC(C)C	ZINC000819416757	CF	On-Demand	Clean	ADRB1	41	36
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccc(F)cc1	ZINC000819416765	DH	On-Demand	Anodyne	NPY2R	69	38
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccc(F)cc1	ZINC000819416766	DH	On-Demand	Anodyne	NPY2R	69	38
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccc(F)cc1	ZINC000819416773	EG	On-Demand	Anodyne	ADRB1	49	39
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccc(F)cc1	ZINC000819416773	EG	On-Demand	Anodyne	NPY2R	46	38
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccc(F)cc1	ZINC000819416774	EG	On-Demand	Anodyne	ADRB1	49	39
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccc(F)cc1	ZINC000819416774	EG	On-Demand	Anodyne	NPY2R	46	38
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)C(F)(F)F	ZINC000819416777	CF	On-Demand	Anodyne	NPY2R	73	39
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)C(F)(F)F	ZINC000819416778	CF	On-Demand	Anodyne	NPY2R	73	39
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)Cn1cccn1	ZINC000819416779	DE	On-Demand	Anodyne	NPY2R	73	37
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)Cn1cccn1	ZINC000819416780	DE	On-Demand	Anodyne	NPY2R	73	37
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccc(F)c(F)c1	ZINC000819416787	EH	On-Demand	Anodyne	KCNQ2	19	43
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccc(F)c(F)c1	ZINC000819416787	EH	On-Demand	Anodyne	NPY2R	68	37
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccc(F)c(F)c1	ZINC000819416788	EH	On-Demand	Anodyne	KCNQ2	19	43
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccc(F)c(F)c1	ZINC000819416788	EH	On-Demand	Anodyne	NPY2R	68	37
O=S1(=O)CCC(O)(CNc2ccc(N3CCCC3)c(F)c2)CC1	ZINC000819416797	ED	On-Demand	Anodyne	NPY2R	73	38
CC[C@H](O)CNc1ccc(OC)c(NC(=O)c2ccc(Cl)cc2F)c1	ZINC000819416801	FH	On-Demand	Anodyne	CPT1A	65	39
CC[C@H](O)CNc1ccc(OC)c(NC(=O)c2ccc(Cl)cc2F)c1	ZINC000819416801	FH	On-Demand	Anodyne	CPT2	45	37
CC[C@H](O)CNc1ccc(OC)c(NC(=O)c2ccc(Cl)cc2F)c1	ZINC000819416801	FH	On-Demand	Anodyne	KCNMA1	35	45
CC[C@H](O)CNc1ccc(OC)c(NC(=O)c2ccc(Cl)cc2F)c1	ZINC000819416801	FH	On-Demand	Anodyne	CPT1B	48	39
NC(=O)NC(=O)CCNc1ccc(N2CCCC2)c(F)c1	ZINC000819416810	CD	On-Demand	Anodyne	NPY2R	75	37
COCCOc1cc(C)ccc1NC[C@H](O)COc1ccccc1	ZINC000819416811	EF	On-Demand	Anodyne	ADRB2	45	47
COCCOc1cc(C)ccc1NC[C@H](O)COc1ccccc1	ZINC000819416811	EF	On-Demand	Anodyne	ADRB1	52	45
COCCOc1cc(C)ccc1NC[C@H](O)COc1ccccc1	ZINC000819416811	EF	On-Demand	Anodyne	ADRB3	27	42
COCCOc1cc(C)ccc1NC[C@@H](O)COc1ccccc1	ZINC000819416812	EF	On-Demand	Anodyne	ADRB2	45	47
COCCOc1cc(C)ccc1NC[C@@H](O)COc1ccccc1	ZINC000819416812	EF	On-Demand	Anodyne	ADRB1	52	45
COCCOc1cc(C)ccc1NC[C@@H](O)COc1ccccc1	ZINC000819416812	EF	On-Demand	Anodyne	ADRB3	27	42
CCOC(=O)C1CCC(O)(CNc2ccccc2OCC(C)C)CC1	ZINC000819416825	EH	On-Demand	Anodyne	TIMP3	46	31
COCCOc1cc(C)ccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819416826	FF	On-Demand	Mild	ADRB2	22	43
COCCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819416827	FF	On-Demand	Mild	ADRB2	22	43
COc1ccccc1NC(=O)CN1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819416828	FD	On-Demand	Anodyne	HTR1A	19	40
COc1ccccc1NC(=O)CN1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819416828	FD	On-Demand	Anodyne	DRD4	25	45
COc1ccccc1NC(=O)CN1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819416829	FD	On-Demand	Anodyne	HTR1A	19	40
COc1ccccc1NC(=O)CN1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819416829	FD	On-Demand	Anodyne	DRD4	25	45
C[C@@H]1CCCC[C@@H]1C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	ZINC000819416866	FG	On-Demand	Reactive	MAPK13	72	38
C[C@@H]1CCCC[C@H]1C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	ZINC000819416867	FG	On-Demand	Reactive	MAPK13	72	38
C=CCC1(C(=O)NNc2ccc(Cl)c(F)c2)CCOCC1	ZINC000819416870	DG	On-Demand	Reactive	ENV	40	35
CN1CCC(N(C)c2ccc(NC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819416908	EF	On-Demand	Anodyne	ADRB3	78	48
CN1CCC(N(C)c2ccc(NC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819416909	EF	On-Demand	Anodyne	ADRB3	78	48
COc1ccc(-c2cnc(NC(=O)[C@@H](O)c3cccc(C(F)(F)F)c3)n2C)cc1	ZINC000819416917	HH	On-Demand	Anodyne	SCD	21	40
COc1ccc(-c2cnc(NC(=O)[C@H](O)c3cccc(C(F)(F)F)c3)n2C)cc1	ZINC000819416919	HH	On-Demand	Anodyne	SCD	21	40
COc1ccc(-c2cnc(NC(=O)c3nc(-c4ccccc4F)oc3C)n2C)cc1	ZINC000819416941	HI	On-Demand	Anodyne	LUCI_PHOPE	15	41
COc1ccc(-c2cnc(NC(=O)c3ccc(C)c(NC(=O)OC(C)(C)C)c3)n2C)cc1	ZINC000819416953	IK	On-Demand	Anodyne	MAPK11	21	40
COc1ccc(-c2cnc(NC(=O)c3ccc(C)c(NC(=O)OC(C)(C)C)c3)n2C)cc1	ZINC000819416953	IK	On-Demand	Anodyne	MAPK14	31	40
COc1ccc(-c2cnc(NC(=O)c3cccnc3-n3cccn3)n2C)cc1	ZINC000819416954	FF	On-Demand	Anodyne	LUCI_LUCLA	23	41
COc1ccc(-c2cnc(NC(=O)C[C@H]3c4ccccc4CCN3C(C)=O)n2C)cc1	ZINC000819416957	HH	On-Demand	Anodyne	MTNR1B	15	44
COc1ccc(-c2cnc(NC(=O)C[C@@H]3c4ccccc4CCN3C(C)=O)n2C)cc1	ZINC000819416958	HH	On-Demand	Anodyne	MTNR1B	15	44
COc1ccc(-c2cnc(NC(=O)c3cc(S(N)(=O)=O)cc(Cl)c3F)n2C)cc1	ZINC000819416959	IF	On-Demand	Anodyne	CA12	15	42
COc1ccc(-c2cnc(NC(=O)c3cc(S(N)(=O)=O)cc(Cl)c3F)n2C)cc1	ZINC000819416959	IF	On-Demand	Anodyne	CA9	19	42
COc1ccc(-c2cnc(NC(=O)[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819416960	HH	On-Demand	Anodyne	JAK1	15	43
COc1ccc(-c2cnc(NC(=O)[C@H]3CC[C@H](NC(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819416961	HH	On-Demand	Anodyne	JAK1	15	43
COc1ccc(-c2cnc(NC(=O)[C@@H]3CC[C@@H](NC(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819416962	HH	On-Demand	Anodyne	JAK1	15	43
COc1ccc(-c2cnc(NC(=O)[C@H]3CC[C@@H](NC(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819416963	HH	On-Demand	Anodyne	JAK1	15	43
COc1ccccc1NC(=O)CN1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819416972	FD	On-Demand	Anodyne	HTR1A	19	40
COc1ccccc1NC(=O)CN1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819416972	FD	On-Demand	Anodyne	DRD4	25	45
COc1ccccc1NC(=O)CN1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819416973	FD	On-Demand	Anodyne	HTR1A	19	40
COc1ccccc1NC(=O)CN1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819416973	FD	On-Demand	Anodyne	DRD4	25	45
COc1ccc(-c2cnc(NC(=O)c3cc(Cl)c(Cl)n3C)n2C)cc1	ZINC000819416983	GH	On-Demand	Anodyne	SCN10A	32	40
COc1ccc(-c2cnc(NC(=O)c3cc(Cl)c(Cl)n3C)n2C)cc1	ZINC000819416983	GH	On-Demand	Anodyne	PDK1	45	35
Cc1ccc(OC[C@H](O)CNc2ccc(N(C)C3CCN(C)CC3)cc2)cc1	ZINC000819416984	GG	On-Demand	Anodyne	ADRB2	30	46
Cc1ccc(OC[C@H](O)CNc2ccc(N(C)C3CCN(C)CC3)cc2)cc1	ZINC000819416984	GG	On-Demand	Anodyne	ADRB1	45	47
COc1ccc(-c2cnc(NC(=O)[C@H]3Cc4cc(Br)ccc4O3)n2C)cc1	ZINC000819416985	IH	On-Demand	Anodyne	ROCK2	30	40
COc1ccc(-c2cnc(NC(=O)[C@@H]3Cc4cc(Br)ccc4O3)n2C)cc1	ZINC000819416987	IH	On-Demand	Anodyne	ROCK2	30	40
Cc1ccc(OC[C@@H](O)CNc2ccc(N(C)C3CCN(C)CC3)cc2)cc1	ZINC000819416989	GG	On-Demand	Anodyne	ADRB2	30	46
Cc1ccc(OC[C@@H](O)CNc2ccc(N(C)C3CCN(C)CC3)cc2)cc1	ZINC000819416989	GG	On-Demand	Anodyne	ADRB1	45	47
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)COCc1cccs1	ZINC000819416992	FG	On-Demand	Anodyne	NPY2R	58	35
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)COCc1cccs1	ZINC000819416993	FG	On-Demand	Anodyne	NPY2R	58	35
O[C@@H](CNc1ccc2[nH]c(-c3ccco3)nc2c1)C1CC1	ZINC000819416995	CG	On-Demand	Anodyne	NR2E3	65	36
O[C@H](CNc1ccc2[nH]c(-c3ccco3)nc2c1)C1CC1	ZINC000819416999	CG	On-Demand	Anodyne	NR2E3	65	36
COc1ccc(-c2cnc(NC(=O)Cc3ccc(S(=O)(=O)C(F)F)cc3)n2C)cc1	ZINC000819417005	IG	On-Demand	Anodyne	MMP13	49	40
COc1ccc(-c2cnc(NC(=O)Cc3ccc(S(=O)(=O)C(F)F)cc3)n2C)cc1	ZINC000819417005	IG	On-Demand	Anodyne	MMP2	35	41
COc1ccc(-c2cnc(NC(=O)Cc3ccc(S(=O)(=O)C(F)F)cc3)n2C)cc1	ZINC000819417005	IG	On-Demand	Anodyne	MMP3	37	41
COc1ccc(-c2cnc(NC(=O)Cc3ccc(S(=O)(=O)C(F)F)cc3)n2C)cc1	ZINC000819417005	IG	On-Demand	Anodyne	MMP8	36	40
COc1ccc(-c2cnc(NC(=O)Cc3ccc(S(=O)(=O)C(F)F)cc3)n2C)cc1	ZINC000819417005	IG	On-Demand	Anodyne	MMP9	38	40
COc1ccc(-c2cnc(NC(=O)Cc3ccc(S(=O)(=O)C(F)F)cc3)n2C)cc1	ZINC000819417005	IG	On-Demand	Anodyne	CA9	19	44
COc1ccc(-c2cnc(NC(=O)Cc3ccc(S(=O)(=O)C(F)F)cc3)n2C)cc1	ZINC000819417005	IG	On-Demand	Anodyne	MMP1	30	41
COc1ccc(-c2cnc(NC(=O)Cc3ccc(S(=O)(=O)C(F)F)cc3)n2C)cc1	ZINC000819417005	IG	On-Demand	Anodyne	RORC	46	35
C#CCN1CCC[C@H]1C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819417008	EE	On-Demand	Mild	MMP13	21	40
C#CCN1CCC[C@H]1C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819417008	EE	On-Demand	Mild	MMP9	16	40
C#CCN1CCC[C@H]1C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819417008	EE	On-Demand	Mild	MMP1	20	40
O=C1OCCN1Cc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819417009	GH	On-Demand	Anodyne	ADRB2	26	45
O=C1OCCN1Cc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819417009	GH	On-Demand	Anodyne	ADRB1	35	45
O=C1OCCN1Cc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819417009	GH	On-Demand	Anodyne	ADRB3	20	45
O=C1OCCN1Cc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819417014	GH	On-Demand	Anodyne	ADRB2	26	45
O=C1OCCN1Cc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819417014	GH	On-Demand	Anodyne	ADRB1	35	45
O=C1OCCN1Cc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819417014	GH	On-Demand	Anodyne	ADRB3	20	45
O=C(CCNc1ccc(N2CCCC2)c(F)c1)Nc1ccccc1F	ZINC000819417019	EI	On-Demand	Anodyne	KCNQ2	84	47
O=C(CCNc1ccc(N2CCCC2)c(F)c1)Nc1ccccc1F	ZINC000819417019	EI	On-Demand	Anodyne	NPY2R	102	42
CC(C)[C@H]1CN(C(=O)c2ccc3c(c2)-c2ccccc2C3)CCCO1	ZINC000819417034	EI	On-Demand	Anodyne	L3MBTL3	50	38
COc1ccc(-c2cnc(NC(=O)/C=C/c3ccc(NS(C)(=O)=O)cc3)n2C)cc1	ZINC000819417036	IG	On-Demand	Anodyne	HDAC8	17	47
COc1ccc(-c2cnc(NC(=O)/C=C\c3ccc(NS(C)(=O)=O)cc3)n2C)cc1	ZINC000819417039	IG	On-Demand	Anodyne	HDAC8	17	47
COc1cc(C)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819417062	CH	On-Demand	Anodyne	ADRB2	17	47
COc1cc(C)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819417062	CH	On-Demand	Anodyne	ADRB1	35	48
COc1cc(C)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819417062	CH	On-Demand	Anodyne	ADRB3	58	48
COc1cc(C)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819417062	CH	On-Demand	Anodyne	IGF1R	32	44
COc1cc(C)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819417062	CH	On-Demand	Anodyne	CYP3A4	52	40
COc1cc(C)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819417064	CH	On-Demand	Anodyne	ADRB2	17	47
COc1cc(C)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819417064	CH	On-Demand	Anodyne	ADRB1	35	48
COc1cc(C)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819417064	CH	On-Demand	Anodyne	ADRB3	58	48
COc1cc(C)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819417064	CH	On-Demand	Anodyne	IGF1R	32	44
COc1cc(C)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819417064	CH	On-Demand	Anodyne	CYP3A4	52	40
COc1ccc(-c2cnc(NC(=O)C3(CNC(=O)OC(C)(C)C)CC3)n2C)cc1	ZINC000819417065	HG	On-Demand	Anodyne	PROKR1	60	32
COc1ccc(-c2cnc(NC(=O)c3ccc(S(=O)(=O)C(F)F)cc3)n2C)cc1	ZINC000819417067	HG	On-Demand	Anodyne	LUCI_LUCLA	16	43
COc1ccc(-c2cnc(NC(=O)c3cccc(CN4C(=O)CSC4=O)c3)n2C)cc1	ZINC000819417081	IH	On-Demand	Anodyne	DRD4	41	32
COc1ccc(-c2cnc(NC(=O)c3cccc(CN4C(=O)CSC4=O)c3)n2C)cc1	ZINC000819417081	IH	On-Demand	Anodyne	PROKR1	43	30
COc1cc(C)ccc1NC[C@@H](O)Cc1ccccc1	ZINC000819417082	CG	On-Demand	Anodyne	ADRB2	19	42
COc1cc(C)ccc1NC[C@@H](O)Cc1ccccc1	ZINC000819417082	CG	On-Demand	Anodyne	ADRB3	18	40
COc1cc(C)ccc1NC[C@H](O)Cc1ccccc1	ZINC000819417086	CG	On-Demand	Anodyne	ADRB2	19	42
COc1cc(C)ccc1NC[C@H](O)Cc1ccccc1	ZINC000819417086	CG	On-Demand	Anodyne	ADRB3	18	40
COc1cc(C)ccc1NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819417116	FF	On-Demand	Anodyne	ADRB1	19	41
COc1cc(C)ccc1NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819417117	FF	On-Demand	Anodyne	ADRB1	19	41
N#Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819417121	FG	On-Demand	Mild	NPY2R	35	42
N#Cc1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819417123	FG	On-Demand	Mild	NPY2R	35	42
COCCOc1cc(C)ccc1NC[C@H](O)COc1ccccc1F	ZINC000819417125	EG	On-Demand	Anodyne	ADRB2	25	44
COCCOc1cc(C)ccc1NC[C@H](O)COc1ccccc1F	ZINC000819417125	EG	On-Demand	Anodyne	ADRB1	49	37
COCCOc1cc(C)ccc1NC[C@@H](O)COc1ccccc1F	ZINC000819417126	EG	On-Demand	Anodyne	ADRB2	25	44
COCCOc1cc(C)ccc1NC[C@@H](O)COc1ccccc1F	ZINC000819417126	EG	On-Demand	Anodyne	ADRB1	49	37
CSc1ccc(OC[C@@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417131	GG	On-Demand	Anodyne	ADRB1	53	35
CSc1ccc(OC[C@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417132	GG	On-Demand	Anodyne	ADRB1	53	35
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc2[nH]c(-c3ccco3)nc2c1	ZINC000819417135	GH	On-Demand	Anodyne	NR2E3	44	32
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc2[nH]c(-c3ccco3)nc2c1	ZINC000819417136	GH	On-Demand	Anodyne	NR2E3	44	32
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1cc2ccccc2o1	ZINC000819417142	EI	On-Demand	Anodyne	NPY2R	63	37
N#Cc1ccc([C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819417147	EG	On-Demand	Mild	NPY2R	53	46
N#Cc1ccc([C@H](O)CNc2ccc(N3CCCC3)c(F)c2)cc1	ZINC000819417148	EG	On-Demand	Mild	NPY2R	53	46
O=S(=O)(CCNc1ccc(N2CCCC2)c(F)c1)c1ccc(F)cc1	ZINC000819417149	FG	On-Demand	Anodyne	NPY2R	42	34
O=S(=O)(CCNc1ccc(N2CCCC2)c(F)c1)c1ccc(F)cc1	ZINC000819417149	FG	On-Demand	Anodyne	SLC6A9	15	40
O=C(CCNc1ccc(N2CCCC2)c(F)c1)Nc1ccccc1[N+](=O)[O-]	ZINC000819417159	FH	On-Demand	Bother	KCNQ2	76	43
O=C(CCNc1ccc(N2CCCC2)c(F)c1)Nc1ccccc1[N+](=O)[O-]	ZINC000819417159	FH	On-Demand	Bother	NPY2R	80	38
CCCOc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1Cl	ZINC000819417164	GH	On-Demand	Anodyne	ADRB3	20	41
CCCOc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1Cl	ZINC000819417165	GH	On-Demand	Anodyne	ADRB3	20	41
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccccc1F	ZINC000819417168	EG	On-Demand	Anodyne	ADRB1	51	37
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccccc1F	ZINC000819417168	EG	On-Demand	Anodyne	NPY2R	71	37
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccccc1F	ZINC000819417168	EG	On-Demand	Anodyne	ABCB1	43	34
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccccc1F	ZINC000819417169	EG	On-Demand	Anodyne	ADRB1	51	37
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccccc1F	ZINC000819417169	EG	On-Demand	Anodyne	NPY2R	71	37
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)COc1ccccc1F	ZINC000819417169	EG	On-Demand	Anodyne	ABCB1	43	34
COc1cc(C)ccc1NC[C@H](O)COc1ccc(SC)cc1	ZINC000819417193	EH	On-Demand	Anodyne	ADRB2	28	45
COc1cc(C)ccc1NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819417194	EH	On-Demand	Anodyne	ADRB2	28	45
O=C1OCCN1Cc1ccc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819417220	FF	On-Demand	Bother	KCNJ1	23	41
COc1ccc(-c2cnc(NC(=O)[C@H](O)c3cccc(OC)c3)n2C)cc1	ZINC000819417221	FF	On-Demand	Anodyne	ROCK2	41	39
O=C1OCCN1Cc1ccc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819417222	FF	On-Demand	Bother	KCNJ1	23	41
COc1ccc(-c2cnc(NC(=O)[C@@H](O)c3cccc(OC)c3)n2C)cc1	ZINC000819417223	FF	On-Demand	Anodyne	ROCK2	41	39
COCCc1ccc(OC[C@@H](O)CNc2ccc(C)cc2OC)cc1	ZINC000819417234	EG	On-Demand	Anodyne	ADRB2	45	58
COCCc1ccc(OC[C@@H](O)CNc2ccc(C)cc2OC)cc1	ZINC000819417234	EG	On-Demand	Anodyne	ADRB1	67	58
COCCc1ccc(OC[C@@H](O)CNc2ccc(C)cc2OC)cc1	ZINC000819417234	EG	On-Demand	Anodyne	ADRB3	40	45
COCCc1ccc(OC[C@H](O)CNc2ccc(C)cc2OC)cc1	ZINC000819417235	EG	On-Demand	Anodyne	ADRB2	45	58
COCCc1ccc(OC[C@H](O)CNc2ccc(C)cc2OC)cc1	ZINC000819417235	EG	On-Demand	Anodyne	ADRB1	67	58
COCCc1ccc(OC[C@H](O)CNc2ccc(C)cc2OC)cc1	ZINC000819417235	EG	On-Demand	Anodyne	ADRB3	40	45
Cc1ccc(OC[C@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417237	FF	On-Demand	Anodyne	ADRB2	36	43
Cc1ccc(OC[C@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417237	FF	On-Demand	Anodyne	ADRB1	63	40
Cc1ccc(OC[C@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417237	FF	On-Demand	Anodyne	ADRB3	44	40
Cc1ccc(OC[C@@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417239	FF	On-Demand	Anodyne	ADRB2	36	43
Cc1ccc(OC[C@@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417239	FF	On-Demand	Anodyne	ADRB1	63	40
Cc1ccc(OC[C@@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417239	FF	On-Demand	Anodyne	ADRB3	44	40
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)Cc1ccc(F)cc1	ZINC000819417266	EH	On-Demand	Anodyne	NPY2R	57	35
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)Cc1ccc(F)cc1	ZINC000819417271	EH	On-Demand	Anodyne	NPY2R	57	35
N#CCc1ccc(OC[C@@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417275	GF	On-Demand	Mild	ADRB1	49	34
N#CCc1ccc(OC[C@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417279	GF	On-Demand	Mild	ADRB1	49	34
CO/C(=C/c1ccccc1)C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819417284	FH	On-Demand	Anodyne	LUCI_LUCLA	15	41
CO/C(=C\c1ccccc1)C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819417287	FH	On-Demand	Anodyne	LUCI_LUCLA	15	41
COc1ccc(-c2cnc(NC(=O)c3cnc(Br)c(OC)c3)n2C)cc1	ZINC000819417290	HH	On-Demand	Anodyne	LUCI_LUCLA	23	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OCC(C)C)c1	ZINC000819417292	FH	On-Demand	Clean	ADRB2	40	48
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OCC(C)C)c1	ZINC000819417292	FH	On-Demand	Clean	ADRB1	73	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OCC(C)C)c1	ZINC000819417292	FH	On-Demand	Clean	ADRB3	28	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OCC(C)C)c1	ZINC000819417292	FH	On-Demand	Clean	CASR	42	38
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OCC(C)C)c1	ZINC000819417292	FH	On-Demand	Clean	ABCB1	41	46
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OCC(C)C)c1	ZINC000819417292	FH	On-Demand	Clean	PDS	51	37
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OCC(C)C)c1	ZINC000819417295	FH	On-Demand	Clean	ADRB2	40	48
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OCC(C)C)c1	ZINC000819417295	FH	On-Demand	Clean	ADRB1	73	43
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OCC(C)C)c1	ZINC000819417295	FH	On-Demand	Clean	ADRB3	28	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OCC(C)C)c1	ZINC000819417295	FH	On-Demand	Clean	CASR	42	38
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OCC(C)C)c1	ZINC000819417295	FH	On-Demand	Clean	ABCB1	41	46
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OCC(C)C)c1	ZINC000819417295	FH	On-Demand	Clean	PDS	51	37
O=C1CCc2cc(OC[C@@H](O)CNc3ccc(N4CCCC4)c(F)c3)ccc2N1	ZINC000819417296	GG	On-Demand	Anodyne	PKM	35	42
O=C1CCc2cc(OC[C@H](O)CNc3ccc(N4CCCC4)c(F)c3)ccc2N1	ZINC000819417300	GG	On-Demand	Anodyne	PKM	35	42
O[C@H](CNc1cccc(OCc2cccc(F)c2)c1)C1CC1	ZINC000819417309	DH	On-Demand	Anodyne	MAOB	16	40
C[C@@H](CNc1ccc(N2CCCC2)c(F)c1)S(C)(=O)=O	ZINC000819417310	DE	On-Demand	Anodyne	NPY2R	71	36
C[C@@H](CNc1ccc(N2CCCC2)c(F)c1)S(C)(=O)=O	ZINC000819417310	DE	On-Demand	Anodyne	SLC6A9	18	41
O[C@@H](CNc1cccc(OCc2cccc(F)c2)c1)C1CC1	ZINC000819417312	DH	On-Demand	Anodyne	MAOB	16	40
CN1CCC(N(C)c2ccc(NCCC(=O)Nc3cccc(F)c3)cc2)CC1	ZINC000819417321	GH	On-Demand	Anodyne	HTR1F	41	36
CN1CCC(N(C)c2ccc(NCCC(=O)Nc3cccc(F)c3)cc2)CC1	ZINC000819417321	GH	On-Demand	Anodyne	MCHR1	41	44
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819417328	FG	On-Demand	Anodyne	KCNQ2	42	35
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819417328	FG	On-Demand	Anodyne	NPY2R	90	41
O=C1OCCN1Cc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819417329	GE	On-Demand	Anodyne	GRIN1	23	47
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819417331	FG	On-Demand	Anodyne	KCNQ2	42	35
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819417331	FG	On-Demand	Anodyne	NPY2R	90	41
O=C1OCCN1Cc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819417332	GE	On-Demand	Anodyne	GRIN1	23	47
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)CC(F)(F)F	ZINC000819417346	DG	On-Demand	Anodyne	NPY2R	66	36
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)CC(F)(F)F	ZINC000819417348	DG	On-Demand	Anodyne	NPY2R	66	36
COc1ccc(-c2cnc(NC(=O)c3cccc(C4OCCO4)c3)n2C)cc1	ZINC000819417353	GG	On-Demand	Anodyne	LUCI_LUCLA	23	40
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccccc1F	ZINC000819417355	DH	On-Demand	Anodyne	KCNQ2	56	42
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccccc1F	ZINC000819417355	DH	On-Demand	Anodyne	NPY2R	75	38
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccccc1F	ZINC000819417357	DH	On-Demand	Anodyne	KCNQ2	56	42
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)c1ccccc1F	ZINC000819417357	DH	On-Demand	Anodyne	NPY2R	75	38
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819417363	HH	On-Demand	Anodyne	PAPA1_CARPA	35	44
CCOC(=O)CC[C@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819417364	DF	On-Demand	Anodyne	KCNQ2	50	36
CCOC(=O)CC[C@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819417364	DF	On-Demand	Anodyne	NPY2R	82	40
CCOC(=O)CC[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819417366	DF	On-Demand	Anodyne	KCNQ2	50	36
CCOC(=O)CC[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819417366	DF	On-Demand	Anodyne	NPY2R	82	40
COc1ccc(-c2cnc(NC(=O)c3cccc(O)c3O)n2C)cc1	ZINC000819417372	EF	On-Demand	Clean	LUCI_LUCLA	17	41
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCCN3C(=O)OCC(F)(F)F)n2C)cc1	ZINC000819417377	IG	On-Demand	Anodyne	LGMN	74	44
COc1ccc(-c2cnc(NC(=O)[C@H]3CCCN3C(=O)OCC(F)(F)F)n2C)cc1	ZINC000819417378	IG	On-Demand	Anodyne	LGMN	74	44
CC(C)[C@H]1CN(C(=O)c2ccc(CN3CCCCC3=O)cc2)CCCO1	ZINC000819417385	FG	On-Demand	Anodyne	FABI	43	35
CC(C)[C@H]1CN(C(=O)c2ccc(CN3CCCCC3=O)cc2)CCCO1	ZINC000819417385	FG	On-Demand	Anodyne	L3MBTL3	54	40
COc1ccc(-c2cnc(NC(=O)COc3cc(C)on3)n2C)cc1	ZINC000819417387	EE	On-Demand	Anodyne	ADORA2B	40	45
O[C@@H](CNc1ccc(N2CCCC2)c(F)c1)COC1CCOCC1	ZINC000819417389	EE	On-Demand	Anodyne	NPY2R	55	39
O[C@H](CNc1ccc(N2CCCC2)c(F)c1)COC1CCOCC1	ZINC000819417390	EE	On-Demand	Anodyne	NPY2R	55	39
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819417402	FG	On-Demand	Anodyne	NPY2R	78	37
COc1ccc(-c2cnc(NC(=O)c3cccc(-c4cnn(C)c4)c3)n2C)cc1	ZINC000819417415	GH	On-Demand	Anodyne	DRD4	41	32
COc1ccc(-c2cnc(NC(=O)c3cccc(-c4cnn(C)c4)c3)n2C)cc1	ZINC000819417415	GH	On-Demand	Anodyne	LUCI_LUCLA	30	41
COCCOc1cc(C)ccc1NC[C@H](O)COc1ccccc1C	ZINC000819417417	EG	On-Demand	Anodyne	ADRB2	28	52
COCCOc1cc(C)ccc1NC[C@H](O)COc1ccccc1C	ZINC000819417417	EG	On-Demand	Anodyne	CYP2D6	16	43
COCCOc1cc(C)ccc1NC[C@@H](O)COc1ccccc1C	ZINC000819417418	EG	On-Demand	Anodyne	ADRB2	28	52
COCCOc1cc(C)ccc1NC[C@@H](O)COc1ccccc1C	ZINC000819417418	EG	On-Demand	Anodyne	CYP2D6	16	43
COc1ccc(-c2cnc(NC(=O)[C@@](C)(O)c3cccc(C(F)(F)F)c3)n2C)cc1	ZINC000819417423	HH	On-Demand	Anodyne	SCD	26	40
COc1ccc(-c2cnc(NC(=O)[C@](C)(O)c3cccc(C(F)(F)F)c3)n2C)cc1	ZINC000819417425	HH	On-Demand	Anodyne	SCD	26	40
COc1ccc(-c2cnc(NC(=O)c3ccc(NC=O)cc3)n2C)cc1	ZINC000819417428	FF	On-Demand	Anodyne	PRNP	48	31
COc1ccc(-c2cnc(NC(=O)c3ccc(NC=O)cc3)n2C)cc1	ZINC000819417428	FF	On-Demand	Anodyne	LUCI_LUCLA	22	42
COc1ccc(-c2cnc(NC(=O)c3ccc(NC=O)cc3)n2C)cc1	ZINC000819417428	FF	On-Demand	Anodyne	SHH	47	33
CCCOc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1Cl	ZINC000819417429	FI	On-Demand	Mild	ADRB1	47	39
CCCOc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1Cl	ZINC000819417429	FI	On-Demand	Mild	GRIN1	28	40
CCCOc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1Cl	ZINC000819417429	FI	On-Demand	Mild	CASR	41	38
CCCOc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1Cl	ZINC000819417433	FI	On-Demand	Mild	ADRB1	47	39
CCCOc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1Cl	ZINC000819417433	FI	On-Demand	Mild	GRIN1	28	40
CCCOc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1Cl	ZINC000819417433	FI	On-Demand	Mild	CASR	41	38
COCCOc1cc(C)ccc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819417434	EG	On-Demand	Anodyne	ADRB2	34	51
COCCOc1cc(C)ccc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819417434	EG	On-Demand	Anodyne	ADRB1	40	45
COCCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819417436	EG	On-Demand	Anodyne	ADRB2	34	51
COCCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819417436	EG	On-Demand	Anodyne	ADRB1	40	45
C#CCNC(=O)CCNc1ccc(N2CCCC2)c(F)c1	ZINC000819417438	CD	On-Demand	Mild	KCNQ2	42	34
C#CCNC(=O)CCNc1ccc(N2CCCC2)c(F)c1	ZINC000819417438	CD	On-Demand	Mild	NPY2R	83	40
OC1(CNc2ccc(N3CCCC3)c(F)c2)CCCC1	ZINC000819417440	CG	On-Demand	Anodyne	NPY2R	50	37
CC(=O)Nc1cccc(CC(=O)NC[C@@H](C)CNC(=O)OC(C)(C)C)c1	ZINC000819417446	FE	On-Demand	Anodyne	FPR1	43	35
CC(=O)Nc1cccc(CC(=O)NC[C@H](C)CNC(=O)OC(C)(C)C)c1	ZINC000819417448	FE	On-Demand	Anodyne	FPR1	43	35
C#Cc1ccc(C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)cn1	ZINC000819417449	EF	On-Demand	Mild	LUCI_LUCLA	15	40
Cc1ccccc1[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819417450	DH	On-Demand	Anodyne	KCNQ2	53	38
Cc1ccccc1[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819417450	DH	On-Demand	Anodyne	NPY2R	80	38
OC1(CNc2ccc(N3CCCC3)c(F)c2)CCC1	ZINC000819417453	CF	On-Demand	Anodyne	NPY2R	50	35
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819417454	GG	On-Demand	Bother	ADRB1	43	37
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819417454	GG	On-Demand	Bother	NPY2R	66	35
COc1ccc(-c2cnc(NC(=O)c3cnc(Cl)c(Cl)c3)n2C)cc1	ZINC000819417455	GI	On-Demand	Anodyne	PDK1	43	34
COc1ccc(-c2cnc(NC(=O)c3cnc(Cl)c(Cl)c3)n2C)cc1	ZINC000819417455	GI	On-Demand	Anodyne	LUCI_LUCLA	30	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819417456	GG	On-Demand	Bother	ADRB1	43	37
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(N2CCCC2)c(F)c1	ZINC000819417456	GG	On-Demand	Bother	NPY2R	66	35
O=C(CCNc1ccc(N2CCCC2)c(F)c1)Nc1ccccc1	ZINC000819417460	EH	On-Demand	Anodyne	KCNQ2	77	42
O=C(CCNc1ccc(N2CCCC2)c(F)c1)Nc1ccccc1	ZINC000819417460	EH	On-Demand	Anodyne	NPY2R	129	45
O=C(CCNc1ccc(N2CCCC2)c(F)c1)Nc1ccccc1	ZINC000819417460	EH	On-Demand	Anodyne	CHRNA7	20	44
O=C(CCNc1ccc(N2CCCC2)c(F)c1)Nc1ccccc1	ZINC000819417460	EH	On-Demand	Anodyne	HDAC3	15	43
O=C(CCNc1ccc(N2CCCC2)c(F)c1)Nc1ccccc1	ZINC000819417460	EH	On-Demand	Anodyne	SLC1A2	51	34
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2ccncc2)c1	ZINC000819417461	ED	On-Demand	Anodyne	MTNR1A	27	40
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2ccncc2)c1	ZINC000819417461	ED	On-Demand	Anodyne	MTNR1B	30	40
COc1cccc([S@@](=O)CC(=O)NC[C@@H](O)c2ccncc2)c1	ZINC000819417461	ED	On-Demand	Anodyne	ROCK2	17	41
CC(C)[C@H]1CN(C(=O)c2ccc(OC(F)(F)Cl)cc2)CCCO1	ZINC000819417462	EH	On-Demand	Anodyne	L3MBTL3	51	38
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2ccncc2)c1	ZINC000819417466	ED	On-Demand	Anodyne	MTNR1A	27	40
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2ccncc2)c1	ZINC000819417466	ED	On-Demand	Anodyne	MTNR1B	30	40
COc1cccc([S@@](=O)CC(=O)NC[C@H](O)c2ccncc2)c1	ZINC000819417466	ED	On-Demand	Anodyne	ROCK2	17	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819417473	FG	On-Demand	Anodyne	ADRB2	20	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819417473	FG	On-Demand	Anodyne	NPY2R	99	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819417473	FG	On-Demand	Anodyne	ABCB1	31	51
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819417473	FG	On-Demand	Anodyne	TAAR1	31	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819417475	FG	On-Demand	Anodyne	ADRB2	20	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819417475	FG	On-Demand	Anodyne	NPY2R	99	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819417475	FG	On-Demand	Anodyne	ABCB1	31	51
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(F)c2)c1	ZINC000819417475	FG	On-Demand	Anodyne	TAAR1	31	42
CCOc1cc(C)ccc1NC[C@H](O)COCC(C)C	ZINC000819417490	CF	On-Demand	Anodyne	ADRB2	17	46
CCOc1cc(C)ccc1NC[C@@H](O)COCC(C)C	ZINC000819417491	CF	On-Demand	Anodyne	ADRB2	17	46
COCCOc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c(C)c1	ZINC000819417513	FI	On-Demand	Anodyne	PPARD	44	39
COCCOc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)c(C)c1	ZINC000819417514	FI	On-Demand	Anodyne	PPARD	44	39
CCCOc1cc(C)ccc1NC[C@@H](O)COC	ZINC000819417523	CE	On-Demand	Anodyne	ADRB2	16	45
CCCOc1cc(C)ccc1NC[C@H](O)COC	ZINC000819417524	CE	On-Demand	Anodyne	ADRB2	16	45
CCOc1cc(C)ccc1NCC1(O)CCCC1	ZINC000819417529	BG	On-Demand	Anodyne	HCN1	43	33
CCOc1cc(C)ccc1NCC1(O)CCCC1	ZINC000819417529	BG	On-Demand	Anodyne	HCN4	43	33
COCCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)c(C)c1	ZINC000819417549	FG	On-Demand	Anodyne	ADRB2	24	55
COCCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)c(C)c1	ZINC000819417549	FG	On-Demand	Anodyne	ADRB1	28	55
COCCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)c(C)c1	ZINC000819417549	FG	On-Demand	Anodyne	CYP2D6	18	40
COCCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c(C)c1	ZINC000819417550	FG	On-Demand	Anodyne	ADRB2	24	55
COCCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c(C)c1	ZINC000819417550	FG	On-Demand	Anodyne	ADRB1	28	55
COCCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c(C)c1	ZINC000819417550	FG	On-Demand	Anodyne	CYP2D6	18	40
COCCOc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)c(C)c1	ZINC000819417553	FF	On-Demand	Mild	ADRB2	20	41
COCCOc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)c(C)c1	ZINC000819417553	FF	On-Demand	Mild	ADRB1	33	41
COCCOc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)c(C)c1	ZINC000819417554	FF	On-Demand	Mild	ADRB2	20	41
COCCOc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)c(C)c1	ZINC000819417554	FF	On-Demand	Mild	ADRB1	33	41
CC(=O)Nc1cccc(CC(=O)NOCC(C)C)c1	ZINC000819417570	CD	On-Demand	Anodyne	KCNK3	40	33
CCOc1ccc(OC[C@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417571	GF	On-Demand	Anodyne	ADRB1	62	39
CCOc1ccc(OC[C@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417571	GF	On-Demand	Anodyne	ADRB3	44	37
CCOc1ccc(OC[C@@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417572	GF	On-Demand	Anodyne	ADRB1	62	39
CCOc1ccc(OC[C@@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417572	GF	On-Demand	Anodyne	ADRB3	44	37
COc1cc(C)ccc1NC[C@H](O)c1cccnc1	ZINC000819417589	CF	On-Demand	Anodyne	ADRB2	17	42
COc1cc(C)ccc1NC[C@H](O)c1cccnc1	ZINC000819417589	CF	On-Demand	Anodyne	ADRB1	22	48
COc1cc(C)ccc1NC[C@H](O)c1cccnc1	ZINC000819417589	CF	On-Demand	Anodyne	ADRB3	64	48
COc1cc(C)ccc1NC[C@H](O)c1cccnc1	ZINC000819417589	CF	On-Demand	Anodyne	KCNA5	20	41
COc1cc(C)ccc1NC[C@@H](O)c1cccnc1	ZINC000819417591	CF	On-Demand	Anodyne	ADRB2	17	42
COc1cc(C)ccc1NC[C@@H](O)c1cccnc1	ZINC000819417591	CF	On-Demand	Anodyne	ADRB1	22	48
COc1cc(C)ccc1NC[C@@H](O)c1cccnc1	ZINC000819417591	CF	On-Demand	Anodyne	ADRB3	64	48
COc1cc(C)ccc1NC[C@@H](O)c1cccnc1	ZINC000819417591	CF	On-Demand	Anodyne	KCNA5	20	41
COc1cc(C)ccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819417595	EG	On-Demand	Anodyne	ADRB2	28	60
COc1cc(C)ccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819417595	EG	On-Demand	Anodyne	ADRB1	32	60
COc1cc(C)ccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819417595	EG	On-Demand	Anodyne	HTR1A	17	60
COc1cc(C)ccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819417595	EG	On-Demand	Anodyne	SLC6A4	20	47
COc1cc(C)ccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819417595	EG	On-Demand	Anodyne	CYP2D6	19	43
COc1cc(C)ccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819417596	EG	On-Demand	Anodyne	ADRB2	28	60
COc1cc(C)ccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819417596	EG	On-Demand	Anodyne	ADRB1	32	60
COc1cc(C)ccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819417596	EG	On-Demand	Anodyne	HTR1A	17	60
COc1cc(C)ccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819417596	EG	On-Demand	Anodyne	SLC6A4	20	47
COc1cc(C)ccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819417596	EG	On-Demand	Anodyne	CYP2D6	19	43
CN1CCC(N(C)c2ccc(NCCS(=O)(=O)c3ccccc3)cc2)CC1	ZINC000819417603	GG	On-Demand	Anodyne	SFRP1	57	37
CN1CCC(N(C)c2ccc(NCCS(=O)(=O)c3ccccc3)cc2)CC1	ZINC000819417603	GG	On-Demand	Anodyne	WNT3	41	37
COCCOc1cc(C)ccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819417613	FG	On-Demand	Anodyne	ADRB2	21	57
COCCOc1cc(C)ccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819417613	FG	On-Demand	Anodyne	ADRB1	24	57
COCCOc1cc(C)ccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819417614	FG	On-Demand	Anodyne	ADRB2	21	57
COCCOc1cc(C)ccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819417614	FG	On-Demand	Anodyne	ADRB1	24	57
CCOc1cc(C)ccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819417615	EH	On-Demand	Anodyne	ADRB2	25	59
CCOc1cc(C)ccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819417615	EH	On-Demand	Anodyne	ADRB1	27	59
CCOc1cc(C)ccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819417615	EH	On-Demand	Anodyne	CYP2D6	15	42
CCOc1cc(C)ccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819417617	EH	On-Demand	Anodyne	ADRB2	25	59
CCOc1cc(C)ccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819417617	EH	On-Demand	Anodyne	ADRB1	27	59
CCOc1cc(C)ccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819417617	EH	On-Demand	Anodyne	CYP2D6	15	42
CC(=O)Nc1cccc(CC(=O)Nc2ccc(C)nc2N(C)C)c1	ZINC000819417634	EF	On-Demand	Anodyne	HTR1D	24	42
CC(=O)Nc1cccc(CC(=O)Nc2ccc(C)nc2N(C)C)c1	ZINC000819417634	EF	On-Demand	Anodyne	HTR1B	18	42
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417635	GE	On-Demand	Anodyne	ADRB2	33	50
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417635	GE	On-Demand	Anodyne	ADRB1	68	50
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417635	GE	On-Demand	Anodyne	ADRB3	47	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417636	GE	On-Demand	Anodyne	ADRB2	33	50
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417636	GE	On-Demand	Anodyne	ADRB1	68	50
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417636	GE	On-Demand	Anodyne	ADRB3	47	48
CN1CCC(N(C)c2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2)CC1	ZINC000819417645	GG	On-Demand	Anodyne	ADRB2	32	41
CN1CCC(N(C)c2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2)CC1	ZINC000819417645	GG	On-Demand	Anodyne	ADRB1	50	41
CN1CCC(N(C)c2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2)CC1	ZINC000819417645	GG	On-Demand	Anodyne	ADRB3	31	41
CN1CCC(N(C)c2ccc(NC[C@@H](O)COc3ccc(F)cc3)cc2)CC1	ZINC000819417646	GG	On-Demand	Anodyne	ADRB2	32	41
CN1CCC(N(C)c2ccc(NC[C@@H](O)COc3ccc(F)cc3)cc2)CC1	ZINC000819417646	GG	On-Demand	Anodyne	ADRB1	50	41
CN1CCC(N(C)c2ccc(NC[C@@H](O)COc3ccc(F)cc3)cc2)CC1	ZINC000819417646	GG	On-Demand	Anodyne	ADRB3	31	41
CN1CCC(N(C)c2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819417647	FI	On-Demand	Anodyne	ADRB1	27	46
CN1CCC(N(C)c2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819417647	FI	On-Demand	Anodyne	ADRB3	42	41
CN1CCC(N(C)c2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819417647	FI	On-Demand	Anodyne	IGF1R	29	43
CN1CCC(N(C)c2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819417647	FI	On-Demand	Anodyne	CYP3A4	49	40
CN1CCC(N(C)c2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819417648	FI	On-Demand	Anodyne	ADRB1	27	46
CN1CCC(N(C)c2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819417648	FI	On-Demand	Anodyne	ADRB3	42	41
CN1CCC(N(C)c2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819417648	FI	On-Demand	Anodyne	IGF1R	29	43
CN1CCC(N(C)c2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819417648	FI	On-Demand	Anodyne	CYP3A4	49	40
C[C@@H](CNc1ccc(OCc2ccccc2Cl)cc1)S(C)(=O)=O	ZINC000819417650	FH	On-Demand	Anodyne	GRIN1	18	46
O=C1OCCN1Cc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819417651	GH	On-Demand	Anodyne	ADRB2	30	45
O=C1OCCN1Cc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819417651	GH	On-Demand	Anodyne	ADRB1	51	40
O=C1OCCN1Cc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819417651	GH	On-Demand	Anodyne	ADRB3	43	40
O=C1OCCN1Cc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819417652	GH	On-Demand	Anodyne	ADRB2	30	45
O=C1OCCN1Cc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819417652	GH	On-Demand	Anodyne	ADRB1	51	40
O=C1OCCN1Cc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819417652	GH	On-Demand	Anodyne	ADRB3	43	40
N#Cc1ccc(OC[C@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417659	FE	On-Demand	Mild	ADRB1	50	36
N#Cc1ccc(OC[C@@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417660	FE	On-Demand	Mild	ADRB1	50	36
COc1cc(C)ccc1NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819417673	FH	On-Demand	Anodyne	GPR119	33	40
COc1cc(C)ccc1NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819417674	FH	On-Demand	Anodyne	GPR119	33	40
O=C1OCCN1Cc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819417678	GE	On-Demand	Anodyne	NOD1	18	41
O=C1OCCN1Cc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819417678	GE	On-Demand	Anodyne	NOD2	47	39
O=C1OCCN1Cc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819417679	GE	On-Demand	Anodyne	NOD1	18	41
O=C1OCCN1Cc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819417679	GE	On-Demand	Anodyne	NOD2	47	39
COc1ccc(-c2cnc(NC(=O)c3ccc(CNC(=O)OC(C)(C)C)cc3)n2C)cc1	ZINC000819417685	II	On-Demand	Anodyne	PROKR1	63	34
COc1ccc(-c2cnc(NC(=O)c3ccc(CNC(=O)OC(C)(C)C)cc3)n2C)cc1	ZINC000819417685	II	On-Demand	Anodyne	RPA1	22	42
COc1ccc(-c2cnc(NC(=O)c3ccc(F)c(S(N)(=O)=O)c3)n2C)cc1	ZINC000819417697	HE	On-Demand	Anodyne	F10	21	42
COc1ccc(-c2cnc(NC(=O)c3ccc(F)c(S(N)(=O)=O)c3)n2C)cc1	ZINC000819417697	HE	On-Demand	Anodyne	CPT1A	51	35
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	ACE	21	44
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	SSTR2	91	51
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	GHRHR	31	48
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	MME	26	42
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	EDNRA	42	52
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	TACR1	42	55
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	MC4R	58	40
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	CCKAR	146	60
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	CTSL	25	54
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	PGA	18	47
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	NMBR	47	42
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	MC3R	62	35
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	MC5R	66	33
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	MMP2	27	50
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	MMP8	35	50
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	GRPR	67	32
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	ECE1	66	46
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	REN	56	47
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	REN1	28	47
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	SSTR3	26	48
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	MMP11	99	38
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	CCKBR	117	60
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	GHSR	66	51
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	MMP9	26	50
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	MC1R	87	36
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	MMP1	20	40
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	FPR1	51	53
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	NPR	27	41
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	KISS1R	74	35
CC(C)[C@H]1CN(C(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)OC(C)(C)C)CCCO1	ZINC000819417700	IH	On-Demand	Anodyne	ERAP2	41	38
COc1ccc(-c2cnc(NC(=O)c3cc(S(C)(=O)=O)ccc3F)n2C)cc1	ZINC000819417702	HF	On-Demand	Anodyne	PTGS1	18	43
COc1ccc(-c2cnc(NC(=O)c3cc(S(C)(=O)=O)ccc3F)n2C)cc1	ZINC000819417702	HF	On-Demand	Anodyne	PTGS2	34	41
COc1ccc(-c2cnc(NC(=O)Cn3ncc4ccc([N+](=O)[O-])cc43)n2C)cc1	ZINC000819417705	HF	On-Demand	Bother	F2RL3	44	32
COc1ccc(-c2cnc(NC(=O)c3ccc[n+]([O-])c3)n2C)cc1	ZINC000819417710	DD	On-Demand	Anodyne	LUCI_LUCLA	31	46
COc1ccc(-c2cnc(NC(=O)c3nc(Cl)sc3C)n2C)cc1	ZINC000819417716	FH	On-Demand	Anodyne	PDK1	43	35
COc1ccc(-c2cnc(NC(=O)c3cnc(OC)nc3)n2C)cc1	ZINC000819417717	EE	On-Demand	Anodyne	LUCI_LUCLA	24	44
COc1ccc(-c2cnc(NC(=O)c3ccnc(Br)c3)n2C)cc1	ZINC000819417722	GH	On-Demand	Anodyne	LUCI_LUCLA	22	40
COc1ccc(-c2cnc(NC(=O)COc3ccc4c(C)cc(=O)oc4c3)n2C)cc1	ZINC000819417725	HH	On-Demand	Anodyne	MAOA	66	56
COc1ccc(-c2cnc(NC(=O)COc3ccc4c(C)cc(=O)oc4c3)n2C)cc1	ZINC000819417725	HH	On-Demand	Anodyne	MAOB	47	56
COc1ccc(-c2cnc(NC(=O)c3cccc(C)c3NC(=O)c3ccncc3)n2C)cc1	ZINC000819417728	II	On-Demand	Anodyne	LUCI_LUCLA	23	42
COc1ccc(-c2cnc(NC(=O)c3cccc(C)c3NC(=O)c3ccncc3)n2C)cc1	ZINC000819417728	II	On-Demand	Anodyne	SHH	57	42
CCn1c(=O)c2ccccc2n(CC(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)c1=O	ZINC000819417729	IE	On-Demand	Anodyne	ADORA1	24	40
CCn1c(=O)c2ccccc2n(CC(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)c1=O	ZINC000819417729	IE	On-Demand	Anodyne	AVPR1B	43	36
CCn1c(=O)c2ccccc2n(CC(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)c1=O	ZINC000819417729	IE	On-Demand	Anodyne	ADORA2A	24	41
CCn1c(=O)c2ccccc2n(CC(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)c1=O	ZINC000819417729	IE	On-Demand	Anodyne	ADORA2B	66	41
COc1ccc(-c2cnc(NC(=O)c3ccc(-n4cccc4)nc3)n2C)cc1	ZINC000819417731	FH	On-Demand	Anodyne	LUCI_LUCLA	15	41
C=CCNS(=O)(=O)c1cc(C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)ccc1F	ZINC000819417732	IF	On-Demand	Mild	CPT1A	47	33
COc1ccc(-c2cnc(NC(=O)C=C3CCN(C(=O)OC(C)(C)C)CC3)n2C)cc1	ZINC000819417739	IH	On-Demand	Anodyne	GPR119	20	40
COc1ccc(-c2cnc(NC(=O)c3cc(S(N)(=O)=O)ccc3F)n2C)cc1	ZINC000819417742	HE	On-Demand	Anodyne	CA2	28	44
COc1ccc(-c2cnc(NC(=O)c3cc(S(N)(=O)=O)ccc3F)n2C)cc1	ZINC000819417742	HE	On-Demand	Anodyne	PTGS2	28	43
COc1ccc(-c2cnc(NC(=O)c3cc(S(N)(=O)=O)ccc3F)n2C)cc1	ZINC000819417742	HE	On-Demand	Anodyne	CA1	25	44
COc1ccc(-c2cnc(NC(=O)c3cc(S(N)(=O)=O)ccc3F)n2C)cc1	ZINC000819417742	HE	On-Demand	Anodyne	CA4	20	43
COc1ccc(-c2cnc(NC(=O)c3cc(S(N)(=O)=O)ccc3F)n2C)cc1	ZINC000819417742	HE	On-Demand	Anodyne	CA12	23	44
COc1ccc(-c2cnc(NC(=O)c3cc(S(N)(=O)=O)ccc3F)n2C)cc1	ZINC000819417742	HE	On-Demand	Anodyne	CA9	30	40
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819417745	FF	On-Demand	Anodyne	ANPEP	15	45
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819417745	FF	On-Demand	Anodyne	CTSK	24	41
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819417745	FF	On-Demand	Anodyne	CAPNS1	43	32
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819417745	FF	On-Demand	Anodyne	CAPN1	49	39
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819417745	FF	On-Demand	Anodyne	CAPN2	85	37
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819417745	FF	On-Demand	Anodyne	MMP1	17	41
COC(=O)N[C@H](CC(C)C)C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819417746	FF	On-Demand	Anodyne	ANPEP	15	45
COC(=O)N[C@H](CC(C)C)C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819417746	FF	On-Demand	Anodyne	CTSK	24	41
COC(=O)N[C@H](CC(C)C)C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819417746	FF	On-Demand	Anodyne	CAPNS1	43	32
COC(=O)N[C@H](CC(C)C)C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819417746	FF	On-Demand	Anodyne	CAPN1	49	39
COC(=O)N[C@H](CC(C)C)C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819417746	FF	On-Demand	Anodyne	CAPN2	85	37
COC(=O)N[C@H](CC(C)C)C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819417746	FF	On-Demand	Anodyne	MMP1	17	41
COc1ccc(-c2cnc(NC(=O)CCN3CCOCC3)n2C)cc1	ZINC000819417750	ED	On-Demand	Anodyne	AVPR1B	27	41
COc1ccc(-c2cnc(NC(=O)/C=C\c3nc4ccccc4s3)n2C)cc1	ZINC000819417760	GI	On-Demand	Anodyne	LUCI_PHOPE	15	41
COc1ccc(-c2cnc(NC(=O)/C=C/c3nc4ccccc4s3)n2C)cc1	ZINC000819417761	GI	On-Demand	Anodyne	LUCI_PHOPE	15	41
COc1ccc(-c2cnc(NC(=O)c3cc4c(c(OC)c3)O[C@H](C)C4)n2C)cc1	ZINC000819417767	GH	On-Demand	Anodyne	PDK1	45	31
COc1ccc(-c2cnc(NC(=O)c3cc4c(c(OC)c3)O[C@@H](C)C4)n2C)cc1	ZINC000819417768	GH	On-Demand	Anodyne	PDK1	45	31
COc1ccc(-c2cnc(NC(=O)c3ccnc(Cl)c3)n2C)cc1	ZINC000819417777	EG	On-Demand	Anodyne	PDK1	43	35
COc1ccc(-c2cnc(NC(=O)c3ccnc(Cl)c3)n2C)cc1	ZINC000819417777	EG	On-Demand	Anodyne	LUCI_LUCLA	30	40
CC(C)[C@H]1CN(C(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)CCCO1	ZINC000819417779	GG	On-Demand	Anodyne	PREP	20	44
CC(C)[C@H]1CN(C(=O)CNC(=O)c2ccc(-c3ccccc3)cc2)CCCO1	ZINC000819417779	GG	On-Demand	Anodyne	DPP7	15	40
COc1ccc(-c2cnc(NC(=O)[C@H](C)NC(=O)OCc3ccccc3)n2C)cc1	ZINC000819417780	HG	On-Demand	Anodyne	ELANE	33	48
COc1ccc(-c2cnc(NC(=O)[C@H](C)NC(=O)OCc3ccccc3)n2C)cc1	ZINC000819417780	HG	On-Demand	Anodyne	KLK3	79	35
COc1ccc(-c2cnc(NC(=O)[C@H](C)NC(=O)OCc3ccccc3)n2C)cc1	ZINC000819417780	HG	On-Demand	Anodyne	CTSB	61	47
COc1ccc(-c2cnc(NC(=O)[C@H](C)NC(=O)OCc3ccccc3)n2C)cc1	ZINC000819417780	HG	On-Demand	Anodyne	PAPA1_CARPA	76	41
COc1ccc(-c2cnc(NC(=O)[C@H](C)NC(=O)OCc3ccccc3)n2C)cc1	ZINC000819417780	HG	On-Demand	Anodyne	CYSP_TRYCR	54	44
COc1ccc(-c2cnc(NC(=O)[C@H](C)NC(=O)OCc3ccccc3)n2C)cc1	ZINC000819417780	HG	On-Demand	Anodyne	CTSK	39	46
COc1ccc(-c2cnc(NC(=O)[C@H](C)NC(=O)OCc3ccccc3)n2C)cc1	ZINC000819417780	HG	On-Demand	Anodyne	CTSL	46	38
COc1ccc(-c2cnc(NC(=O)[C@H](C)NC(=O)OCc3ccccc3)n2C)cc1	ZINC000819417780	HG	On-Demand	Anodyne	CAPNS1	66	38
COc1ccc(-c2cnc(NC(=O)[C@H](C)NC(=O)OCc3ccccc3)n2C)cc1	ZINC000819417780	HG	On-Demand	Anodyne	MMP11	46	34
COc1ccc(-c2cnc(NC(=O)[C@H](C)NC(=O)OCc3ccccc3)n2C)cc1	ZINC000819417780	HG	On-Demand	Anodyne	CTSS	20	44
COc1ccc(-c2cnc(NC(=O)[C@H](C)NC(=O)OCc3ccccc3)n2C)cc1	ZINC000819417780	HG	On-Demand	Anodyne	CAPN1	86	43
COc1ccc(-c2cnc(NC(=O)[C@H](C)NC(=O)OCc3ccccc3)n2C)cc1	ZINC000819417780	HG	On-Demand	Anodyne	CASP1	23	43
COc1ccc(-c2cnc(NC(=O)[C@H](C)NC(=O)OCc3ccccc3)n2C)cc1	ZINC000819417780	HG	On-Demand	Anodyne	CTRC	20	44
COc1ccc(-c2cnc(NC(=O)[C@H](C)NC(=O)OCc3ccccc3)n2C)cc1	ZINC000819417780	HG	On-Demand	Anodyne	CAPN2	133	47
COc1ccc(-c2cnc(NC(=O)[C@H](C)NC(=O)OCc3ccccc3)n2C)cc1	ZINC000819417780	HG	On-Demand	Anodyne	NPR	67	34
COc1ccc(-c2cnc(NC(=O)[C@H](C)NC(=O)OCc3ccccc3)n2C)cc1	ZINC000819417780	HG	On-Demand	Anodyne	PSMB5	43	38
CN1CCC(N(C)c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819417827	FG	On-Demand	Anodyne	ADRB2	52	45
CN1CCC(N(C)c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819417827	FG	On-Demand	Anodyne	ADRB1	72	45
CN1CCC(N(C)c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819417827	FG	On-Demand	Anodyne	ADRB3	51	41
CN1CCC(N(C)c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819417829	FG	On-Demand	Anodyne	ADRB2	52	45
CN1CCC(N(C)c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819417829	FG	On-Demand	Anodyne	ADRB1	72	45
CN1CCC(N(C)c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819417829	FG	On-Demand	Anodyne	ADRB3	51	41
COCCOc1cc(C)ccc1NC[C@H](O)c1cccnc1	ZINC000819417843	DF	On-Demand	Anodyne	ADRB1	18	42
COCCOc1cc(C)ccc1NC[C@H](O)c1cccnc1	ZINC000819417843	DF	On-Demand	Anodyne	ADRB3	48	46
COCCOc1cc(C)ccc1NC[C@@H](O)c1cccnc1	ZINC000819417846	DF	On-Demand	Anodyne	ADRB1	18	42
COCCOc1cc(C)ccc1NC[C@@H](O)c1cccnc1	ZINC000819417846	DF	On-Demand	Anodyne	ADRB3	48	46
CCOC[C@H](O)CNc1ccc(OCc2ccccc2Cl)cc1	ZINC000819417852	EH	On-Demand	Anodyne	ADRB1	32	43
CCOC[C@H](O)CNc1ccc(OCc2ccccc2Cl)cc1	ZINC000819417852	EH	On-Demand	Anodyne	GRIN1	19	47
CCOC[C@H](O)CNc1ccc(OCc2ccccc2Cl)cc1	ZINC000819417852	EH	On-Demand	Anodyne	ADRB3	21	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417857	GF	On-Demand	Anodyne	ADRB2	28	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417857	GF	On-Demand	Anodyne	ADRB1	59	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417857	GF	On-Demand	Anodyne	ADRB3	43	39
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417859	GF	On-Demand	Anodyne	ADRB2	28	40
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417859	GF	On-Demand	Anodyne	ADRB1	59	40
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(CN3CCOC3=O)cc2)cc1	ZINC000819417859	GF	On-Demand	Anodyne	ADRB3	43	39
CON(C)C(=O)CCNc1cccc(OCc2cccc(F)c2)c1	ZINC000819417881	EG	On-Demand	Anodyne	MAOB	30	46
CON(C)C(=O)CCNc1cccc(OCc2cccc(F)c2)c1	ZINC000819417881	EG	On-Demand	Anodyne	ERBB2	21	41
COc1cccc(C(C)(C)CNC(=O)C(F)=C2CCC2)c1	ZINC000819417884	CG	On-Demand	Anodyne	DRD4	42	32
O=C1OCCN1Cc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819417900	GH	On-Demand	Anodyne	CTSS	18	42
O=C1OCCN1Cc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819417901	GH	On-Demand	Anodyne	CTSS	18	42
CN1CCC(N(C)c2ccc(NC[C@H](O)COc3ccccc3F)cc2)CC1	ZINC000819417920	GG	On-Demand	Anodyne	ADRB2	27	49
CN1CCC(N(C)c2ccc(NC[C@H](O)COc3ccccc3F)cc2)CC1	ZINC000819417920	GG	On-Demand	Anodyne	ADRB3	15	41
CN1CCC(N(C)c2ccc(NC[C@@H](O)COc3ccccc3F)cc2)CC1	ZINC000819417921	GG	On-Demand	Anodyne	ADRB2	27	49
CN1CCC(N(C)c2ccc(NC[C@@H](O)COc3ccccc3F)cc2)CC1	ZINC000819417921	GG	On-Demand	Anodyne	ADRB3	15	41
COCCOc1ccc(NC[C@H](O)COc2ccccc2)c(C)c1	ZINC000819417925	EF	On-Demand	Anodyne	ADRB2	48	47
COCCOc1ccc(NC[C@H](O)COc2ccccc2)c(C)c1	ZINC000819417925	EF	On-Demand	Anodyne	ADRB1	62	47
COCCOc1ccc(NC[C@H](O)COc2ccccc2)c(C)c1	ZINC000819417925	EF	On-Demand	Anodyne	ADRB3	34	47
COCCOc1ccc(NC[C@H](O)COc2ccccc2)c(C)c1	ZINC000819417925	EF	On-Demand	Anodyne	PDS	52	32
COCCOc1ccc(NC[C@@H](O)COc2ccccc2)c(C)c1	ZINC000819417929	EF	On-Demand	Anodyne	ADRB2	48	47
COCCOc1ccc(NC[C@@H](O)COc2ccccc2)c(C)c1	ZINC000819417929	EF	On-Demand	Anodyne	ADRB1	62	47
COCCOc1ccc(NC[C@@H](O)COc2ccccc2)c(C)c1	ZINC000819417929	EF	On-Demand	Anodyne	ADRB3	34	47
COCCOc1ccc(NC[C@@H](O)COc2ccccc2)c(C)c1	ZINC000819417929	EF	On-Demand	Anodyne	PDS	52	32
CCCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819417941	FH	On-Demand	Anodyne	ADRB2	39	54
CCCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819417941	FH	On-Demand	Anodyne	ADRB1	63	54
CCCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819417941	FH	On-Demand	Anodyne	ADRB3	37	47
CCCOc1cc(C)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819417946	FH	On-Demand	Anodyne	ADRB2	39	54
CCCOc1cc(C)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819417946	FH	On-Demand	Anodyne	ADRB1	63	54
CCCOc1cc(C)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819417946	FH	On-Demand	Anodyne	ADRB3	37	47
CCOc1cc(C)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819417949	EG	On-Demand	Bother	ADRB2	20	47
CCOc1cc(C)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819417949	EG	On-Demand	Bother	ADRB1	18	44
CCOc1cc(C)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819417949	EG	On-Demand	Bother	CACNA1C	46	36
CCOc1cc(C)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819417949	EG	On-Demand	Bother	CACNA1D	73	33
CCOc1cc(C)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819417949	EG	On-Demand	Bother	PDS	29	46
CCOc1cc(C)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819417953	EG	On-Demand	Bother	ADRB2	20	47
CCOc1cc(C)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819417953	EG	On-Demand	Bother	ADRB1	18	44
CCOc1cc(C)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819417953	EG	On-Demand	Bother	CACNA1C	46	36
CCOc1cc(C)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819417953	EG	On-Demand	Bother	CACNA1D	73	33
CCOc1cc(C)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819417953	EG	On-Demand	Bother	PDS	29	46
CCOc1cc(C)ccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819417981	EG	On-Demand	Anodyne	ADRB2	29	49
CCOc1cc(C)ccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819417981	EG	On-Demand	Anodyne	ADRB1	40	39
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819417982	EG	On-Demand	Anodyne	ADRB2	29	49
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819417982	EG	On-Demand	Anodyne	ADRB1	40	39
COCCOc1ccc(NC[C@H](O)COC2CCOCC2)c(C)c1	ZINC000819417989	ED	On-Demand	Anodyne	ADRB1	19	40
COCCOc1ccc(NC[C@@H](O)COC2CCOCC2)c(C)c1	ZINC000819417990	ED	On-Demand	Anodyne	ADRB1	19	40
COCCOc1ccc(NC[C@H](O)COc2ccccc2Cl)c(C)c1	ZINC000819417991	FH	On-Demand	Anodyne	ADRB2	28	47
COCCOc1ccc(NC[C@H](O)COc2ccccc2Cl)c(C)c1	ZINC000819417991	FH	On-Demand	Anodyne	ADRB1	40	34
COCCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)c(C)c1	ZINC000819417992	FH	On-Demand	Anodyne	ADRB2	28	47
COCCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)c(C)c1	ZINC000819417992	FH	On-Demand	Anodyne	ADRB1	40	34
CCOc1cc(C)ccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819417993	DD	On-Demand	Anodyne	ABCB1	32	40
CCOc1cc(C)ccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819417994	DD	On-Demand	Anodyne	ABCB1	32	40
COCCOc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)c(C)c1	ZINC000819418000	EH	On-Demand	Anodyne	MAOB	24	47
COCCOc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)c(C)c1	ZINC000819418001	EH	On-Demand	Anodyne	MAOB	24	47
COCCOc1ccc(NC[C@H](O)CN2CCOCC2)c(C)c1	ZINC000819418002	DD	On-Demand	Anodyne	ACOX1	47	31
COCCOc1ccc(NC[C@@H](O)CN2CCOCC2)c(C)c1	ZINC000819418003	DD	On-Demand	Anodyne	ACOX1	47	31
COc1ccc(-c2cnc(NC(=O)c3cc4ccccc4oc3=O)n2C)cc1	ZINC000819418021	GG	On-Demand	Anodyne	MAOB	23	63
COc1ccc(-c2cnc(NC(=O)c3cc4ccccc4oc3=O)n2C)cc1	ZINC000819418021	GG	On-Demand	Anodyne	GRM7	38	40
COc1ccc(-c2cnc(NC(=O)c3cc4ccccc4oc3=O)n2C)cc1	ZINC000819418021	GG	On-Demand	Anodyne	AKR1B10	44	38
COc1ccc(-c2cnc(NC(=O)[C@@H]3C[C@H]3c3ccccc3)n2C)cc1	ZINC000819418022	EH	On-Demand	Anodyne	NPBWR1	46	31
COc1ccc(-c2cnc(NC(=O)c3cc(C)nc(Cl)c3)n2C)cc1	ZINC000819418024	FH	On-Demand	Anodyne	PDK1	42	33
COc1ccc(-c2cnc(NC(=O)c3cnn(Cc4ccccc4)c3Cl)n2C)cc1	ZINC000819418038	HI	On-Demand	Anodyne	LUCI_LUCLA	29	40
COc1ccc(-c2cnc(NC(=O)c3cnn(Cc4ccccc4)c3Cl)n2C)cc1	ZINC000819418038	HI	On-Demand	Anodyne	NPBWR1	45	44
COc1ccc(-c2cnc(NC(=O)c3ccc4c(c3)CCN4C)n2C)cc1	ZINC000819418050	FG	On-Demand	Anodyne	SRD5A1	15	42
COc1ccc(-c2cnc(NC(=O)c3ccc4c(c3)CCN4C)n2C)cc1	ZINC000819418050	FG	On-Demand	Anodyne	DRD4	42	32
COc1ccc(-c2cnc(NC(=O)c3cc(Cl)c(Cl)[nH]3)n2C)cc1	ZINC000819418061	FH	On-Demand	Anodyne	PDK1	43	33
COc1ccc(-c2cnc(NC(=O)c3ccc(F)c(S(=O)(=O)NC4CC4)c3)n2C)cc1	ZINC000819418066	IF	On-Demand	Anodyne	CPT1A	51	35
COc1ccc(-c2cnc(NC(=O)/C=C/c3ccc(O)cc3)n2C)cc1	ZINC000819418071	EG	On-Demand	Anodyne	HDAC8	18	52
COc1ccc(-c2cnc(NC(=O)/C=C\c3ccc(O)cc3)n2C)cc1	ZINC000819418072	EG	On-Demand	Anodyne	HDAC8	18	52
COc1ccc(-c2cnc(NC(=O)c3cc(-c4cccnc4)nc4ccccc34)n2C)cc1	ZINC000819418074	IJ	On-Demand	Anodyne	DHODH	19	40
COc1ccc(-c2cnc(NC(=O)c3cc(-c4cccnc4)nc4ccccc34)n2C)cc1	ZINC000819418074	IJ	On-Demand	Anodyne	TACR3	31	47
COc1ccc(-c2cnc(NC(=O)c3cc(-c4cccnc4)nc4ccccc34)n2C)cc1	ZINC000819418074	IJ	On-Demand	Anodyne	MET	18	43
COc1ccc(-c2cnc(NC(=O)c3cc(-c4cccnc4)nc4ccccc34)n2C)cc1	ZINC000819418074	IJ	On-Demand	Anodyne	PTK2B	15	42
COc1ccc(-c2cnc(NC(=O)c3cnc4c(c3)c(C)nn4-c3ccccc3)n2C)cc1	ZINC000819418075	II	On-Demand	Anodyne	LUCI_LUCLA	22	40
COc1ccc(-c2cnc(NC(=O)c3cnc4c(c3)c(C)nn4-c3ccccc3)n2C)cc1	ZINC000819418075	II	On-Demand	Anodyne	RPA1	20	40
COc1ccc(-c2cnc(NC(=O)CSc3nncn3C)n2C)cc1	ZINC000819418086	FD	On-Demand	Anodyne	ENPP1	61	32
COc1ccc(-c2cnc(NC(=O)c3ccc(CNC(=O)OC(C)(C)C)o3)n2C)cc1	ZINC000819418090	IH	On-Demand	Anodyne	PROKR1	52	31
CCOC(=O)N[C@H](C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C)C(C)C	ZINC000819418094	FF	On-Demand	Anodyne	HLA-DRB1	38	41
CCOC(=O)N[C@@H](C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C)C(C)C	ZINC000819418095	FF	On-Demand	Anodyne	HLA-DRB1	38	41
COc1ccc(-c2cnc(NC(=O)COc3cccc(C#N)c3)n2C)cc1	ZINC000819418097	FF	On-Demand	Mild	ADORA1	19	43
COc1ccc(-c2cnc(NC(=O)COc3cccc(C#N)c3)n2C)cc1	ZINC000819418097	FF	On-Demand	Mild	ADORA2A	26	46
COc1ccc(-c2cnc(NC(=O)COc3cccc(C#N)c3)n2C)cc1	ZINC000819418097	FF	On-Demand	Mild	ADORA2B	51	40
COc1ccc(-c2cnc(NC(=O)COc3cccc(C#N)c3)n2C)cc1	ZINC000819418097	FF	On-Demand	Mild	ETHR	15	50
CC(C)[C@H]1CN(C(=O)CNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)CCCO1	ZINC000819418100	GD	On-Demand	Anodyne	PREP	15	47
CC(C)[C@H]1CN(C(=O)CNC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)CCCO1	ZINC000819418101	GD	On-Demand	Anodyne	PREP	15	47
COc1ccc(-c2cnc(NC(=O)c3ccc(C(N)=S)cc3)n2C)cc1	ZINC000819418107	FF	On-Demand	Anodyne	LUCI_LUCLA	23	44
COc1ccc(-c2cnc(NC(=O)c3cc[n+]([O-])cc3)n2C)cc1	ZINC000819418112	DD	On-Demand	Anodyne	LUCI_LUCLA	31	46
COc1ccc(-c2cnc(NC(=O)c3ccc(-n4ccnc4S)cc3)n2C)cc1	ZINC000819418115	HH	On-Demand	Anodyne	LUCI_LUCLA	15	40
COc1ccc(-c2cnc(NC(=O)c3cc(-c4ccccc4OC)on3)n2C)cc1	ZINC000819418116	HI	On-Demand	Anodyne	PDK1	48	34
COc1cc(C)ccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819418145	FG	On-Demand	Anodyne	GPR119	57	48
COc1cc(C)ccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819418146	FG	On-Demand	Anodyne	GPR119	57	48
CON(C)C(=O)CCNc1cccc(NC(=O)c2ccccc2)c1C	ZINC000819418163	EG	On-Demand	Anodyne	KCNK3	57	36
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)cc1	ZINC000819418164	HE	On-Demand	Mild	MMP13	27	41
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)cc1	ZINC000819418164	HE	On-Demand	Mild	MMP2	23	41
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)cc1	ZINC000819418164	HE	On-Demand	Mild	MMP8	18	41
C#CCNS(=O)(=O)c1ccc(C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)cc1	ZINC000819418164	HE	On-Demand	Mild	MMP9	19	41
COc1ccc(-c2cnc(NC(=O)[C@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)n2C)cc1	ZINC000819418188	HE	On-Demand	Anodyne	HDAC8	15	44
COc1ccc(-c2cnc(NC(=O)[C@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)n2C)cc1	ZINC000819418188	HE	On-Demand	Anodyne	VHL	40	32
COc1ccc(-c2cnc(NC(=O)[C@@H]3C[C@H](O)CN3C(=O)OC(C)(C)C)n2C)cc1	ZINC000819418190	HE	On-Demand	Anodyne	HDAC8	15	44
COc1ccc(-c2cnc(NC(=O)[C@@H]3C[C@H](O)CN3C(=O)OC(C)(C)C)n2C)cc1	ZINC000819418190	HE	On-Demand	Anodyne	VHL	40	32
COc1ccc(-c2cnc(NC(=O)c3cc(C(F)(F)F)cnc3Cl)n2C)cc1	ZINC000819418191	HI	On-Demand	Anodyne	ATF1	55	34
COc1ccc(-c2cnc(NC(=O)c3cc(C(F)(F)F)cnc3Cl)n2C)cc1	ZINC000819418191	HI	On-Demand	Anodyne	NFKB1	51	34
COc1cc(C)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418233	DG	On-Demand	Bother	CACNA1C	65	39
COc1cc(C)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418233	DG	On-Demand	Bother	CACNA1D	96	39
COc1cc(C)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418233	DG	On-Demand	Bother	KCNMA1	25	43
COc1cc(C)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418234	DG	On-Demand	Bother	CACNA1C	65	39
COc1cc(C)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418234	DG	On-Demand	Bother	CACNA1D	96	39
COc1cc(C)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418234	DG	On-Demand	Bother	KCNMA1	25	43
COCCOc1cc(C)ccc1NC[C@@H](O)COC	ZINC000819418272	CD	On-Demand	Anodyne	ADRB2	17	47
COCCOc1cc(C)ccc1NC[C@H](O)COC	ZINC000819418273	CD	On-Demand	Anodyne	ADRB2	17	47
COCCOc1ccc(NC[C@H](O)COc2cccc(C)c2)c(C)c1	ZINC000819418276	EG	On-Demand	Anodyne	ADRB2	27	55
COCCOc1ccc(NC[C@H](O)COc2cccc(C)c2)c(C)c1	ZINC000819418276	EG	On-Demand	Anodyne	ADRB1	34	55
COCCOc1ccc(NC[C@@H](O)COc2cccc(C)c2)c(C)c1	ZINC000819418277	EG	On-Demand	Anodyne	ADRB2	27	55
COCCOc1ccc(NC[C@@H](O)COc2cccc(C)c2)c(C)c1	ZINC000819418277	EG	On-Demand	Anodyne	ADRB1	34	55
CCOc1cc(C)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819418292	EG	On-Demand	Mild	ADRB2	28	42
CCOc1cc(C)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819418292	EG	On-Demand	Mild	ADRB1	34	40
CCOc1cc(C)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819418292	EG	On-Demand	Mild	CASR	40	35
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819418293	EG	On-Demand	Mild	ADRB2	28	42
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819418293	EG	On-Demand	Mild	ADRB1	34	40
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819418293	EG	On-Demand	Mild	CASR	40	35
COCCOc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819418301	EG	On-Demand	Bother	CACNA1C	58	39
COCCOc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819418301	EG	On-Demand	Bother	CACNA1D	92	39
COCCOc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819418302	EG	On-Demand	Bother	CACNA1C	58	39
COCCOc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819418302	EG	On-Demand	Bother	CACNA1D	92	39
COCCOc1ccc(NC[C@@H](O)c2ccccc2)c(C)c1	ZINC000819418323	DG	On-Demand	Anodyne	ADRB1	20	40
COCCOc1ccc(NC[C@@H](O)c2ccccc2)c(C)c1	ZINC000819418323	DG	On-Demand	Anodyne	ADRB3	32	40
COCCOc1ccc(NC[C@H](O)c2ccccc2)c(C)c1	ZINC000819418330	DG	On-Demand	Anodyne	ADRB1	20	40
COCCOc1ccc(NC[C@H](O)c2ccccc2)c(C)c1	ZINC000819418330	DG	On-Demand	Anodyne	ADRB3	32	40
O=C1OCCN1Cc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819418346	GE	On-Demand	Bother	ADRB1	22	44
O=C1OCCN1Cc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819418346	GE	On-Demand	Bother	ADRB3	18	44
O=C1OCCN1Cc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819418348	GE	On-Demand	Bother	ADRB1	22	44
O=C1OCCN1Cc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819418348	GE	On-Demand	Bother	ADRB3	18	44
CCOc1cc(C)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418353	DG	On-Demand	Bother	CACNA1C	55	37
CCOc1cc(C)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418353	DG	On-Demand	Bother	CACNA1D	85	35
CCOc1cc(C)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418354	DG	On-Demand	Bother	CACNA1C	55	37
CCOc1cc(C)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418354	DG	On-Demand	Bother	CACNA1D	85	35
COC[C@@H](O)CNc1ccc(OCc2ccccc2Cl)cc1	ZINC000819418360	DG	On-Demand	Anodyne	ADRB2	34	40
COC[C@@H](O)CNc1ccc(OCc2ccccc2Cl)cc1	ZINC000819418360	DG	On-Demand	Anodyne	ADRB1	45	45
COC[C@@H](O)CNc1ccc(OCc2ccccc2Cl)cc1	ZINC000819418360	DG	On-Demand	Anodyne	GRIN1	21	48
COC[C@@H](O)CNc1ccc(OCc2ccccc2Cl)cc1	ZINC000819418360	DG	On-Demand	Anodyne	ADRB3	28	45
CN1CCC(N(C)c2ccc(NCCC(=O)Nc3cccnc3)cc2)CC1	ZINC000819418364	FG	On-Demand	Anodyne	CHRNA7	33	40
COCCOc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)c(C)c1	ZINC000819418377	FI	On-Demand	Anodyne	PDS	40	38
COCCOc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)c(C)c1	ZINC000819418381	FI	On-Demand	Anodyne	PDS	40	38
N#Cc1cccc(S(=O)(=O)CCNc2ccc(CN3CCOC3=O)cc2)c1	ZINC000819418392	GE	On-Demand	Mild	ITGA4	43	32
CCOc1cc(C)ccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819418405	EG	On-Demand	Bother	ADRB2	24	43
CCOc1cc(C)ccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819418405	EG	On-Demand	Bother	ADRB1	58	34
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819418409	EG	On-Demand	Bother	ADRB2	24	43
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819418409	EG	On-Demand	Bother	ADRB1	58	34
CCOc1cc(C)ccc1NC[C@H](O)COc1ccccc1F	ZINC000819418430	DG	On-Demand	Anodyne	ADRB2	27	46
CCOc1cc(C)ccc1NC[C@H](O)COc1ccccc1F	ZINC000819418430	DG	On-Demand	Anodyne	ADRB1	57	40
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccccc1F	ZINC000819418431	DG	On-Demand	Anodyne	ADRB2	27	46
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccccc1F	ZINC000819418431	DG	On-Demand	Anodyne	ADRB1	57	40
COCCOc1ccc(NCCC(=O)Nc2ccccc2)c(C)c1	ZINC000819418434	EG	On-Demand	Anodyne	LPL	20	40
COCCOc1ccc(NCCC(=O)Nc2ccccc2)c(C)c1	ZINC000819418434	EG	On-Demand	Anodyne	LTA4H	35	40
COCCOc1ccc(NCCC(=O)Nc2ccccc2)c(C)c1	ZINC000819418434	EG	On-Demand	Anodyne	MTNR1A	17	40
COCCOc1ccc(NCCC(=O)Nc2ccccc2)c(C)c1	ZINC000819418434	EG	On-Demand	Anodyne	MTNR1B	20	40
CCOc1cc(C)ccc1NC[C@H](O)CN1C(=O)c2ccccc2C1=O	ZINC000819418437	FE	On-Demand	Anodyne	ADRB2	15	41
CCOc1cc(C)ccc1NC[C@@H](O)CN1C(=O)c2ccccc2C1=O	ZINC000819418438	FE	On-Demand	Anodyne	ADRB2	15	41
CCCOc1cc(C)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418440	EH	On-Demand	Bother	CACNA1C	51	36
CCCOc1cc(C)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418440	EH	On-Demand	Bother	ADRB3	19	41
CCCOc1cc(C)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418440	EH	On-Demand	Bother	CACNA1D	81	36
CCCOc1cc(C)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418441	EH	On-Demand	Bother	CACNA1C	51	36
CCCOc1cc(C)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418441	EH	On-Demand	Bother	ADRB3	19	41
CCCOc1cc(C)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418441	EH	On-Demand	Bother	CACNA1D	81	36
COCCOc1ccc(NC[C@@H](O)Cc2ccccc2)c(C)c1	ZINC000819418446	DG	On-Demand	Anodyne	PPARG	27	43
COCCOc1ccc(NC[C@@H](O)Cc2ccccc2)c(C)c1	ZINC000819418446	DG	On-Demand	Anodyne	PPARA	22	44
COCCOc1ccc(NC[C@H](O)Cc2ccccc2)c(C)c1	ZINC000819418447	DG	On-Demand	Anodyne	PPARG	27	43
COCCOc1ccc(NC[C@H](O)Cc2ccccc2)c(C)c1	ZINC000819418447	DG	On-Demand	Anodyne	PPARA	22	44
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)C1(c2ccccc2)CCCC1	ZINC000819418458	IK	On-Demand	Anodyne	TACR3	35	45
OC1(CNc2ccc(OCc3ccccc3Cl)cc2)CCOCC1	ZINC000819418465	EH	On-Demand	Anodyne	ADAMTS4	15	45
O=C1OCCN1Cc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819418489	GF	On-Demand	Anodyne	ADRB1	24	49
O=C1OCCN1Cc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819418490	GF	On-Demand	Anodyne	ADRB1	24	49
O=C1OCCN1Cc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819418495	FF	On-Demand	Anodyne	ADRB2	33	41
O=C1OCCN1Cc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819418495	FF	On-Demand	Anodyne	ADRB1	63	41
O=C1OCCN1Cc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819418495	FF	On-Demand	Anodyne	GRIN1	25	44
O=C1OCCN1Cc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819418495	FF	On-Demand	Anodyne	ADRB3	44	41
O=C1OCCN1Cc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819418496	FF	On-Demand	Anodyne	ADRB2	33	41
O=C1OCCN1Cc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819418496	FF	On-Demand	Anodyne	ADRB1	63	41
O=C1OCCN1Cc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819418496	FF	On-Demand	Anodyne	GRIN1	25	44
O=C1OCCN1Cc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819418496	FF	On-Demand	Anodyne	ADRB3	44	41
O=C1OCCN1Cc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819418523	GG	On-Demand	Anodyne	ADRB2	30	41
O=C1OCCN1Cc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819418523	GG	On-Demand	Anodyne	ADRB1	60	42
O=C1OCCN1Cc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819418523	GG	On-Demand	Anodyne	GRIN1	27	44
O=C1OCCN1Cc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819418523	GG	On-Demand	Anodyne	ADRB3	42	41
O=C1OCCN1Cc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819418525	GG	On-Demand	Anodyne	ADRB2	30	41
O=C1OCCN1Cc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819418525	GG	On-Demand	Anodyne	ADRB1	60	42
O=C1OCCN1Cc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819418525	GG	On-Demand	Anodyne	GRIN1	27	44
O=C1OCCN1Cc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819418525	GG	On-Demand	Anodyne	ADRB3	42	41
COc1cc(C)ccc1NC[C@H](O)c1ccc(C)cc1	ZINC000819418527	CG	On-Demand	Anodyne	ADRB2	17	49
COc1cc(C)ccc1NC[C@@H](O)c1ccc(C)cc1	ZINC000819418529	CG	On-Demand	Anodyne	ADRB2	17	49
CCOc1cc(C)ccc1NC[C@H](O)c1cccnc1	ZINC000819418547	CF	On-Demand	Anodyne	ADRB2	16	42
CCOc1cc(C)ccc1NC[C@H](O)c1cccnc1	ZINC000819418547	CF	On-Demand	Anodyne	ADRB1	20	42
CCOc1cc(C)ccc1NC[C@H](O)c1cccnc1	ZINC000819418547	CF	On-Demand	Anodyne	ADRB3	59	45
CCOc1cc(C)ccc1NC[C@@H](O)c1cccnc1	ZINC000819418548	CF	On-Demand	Anodyne	ADRB2	16	42
CCOc1cc(C)ccc1NC[C@@H](O)c1cccnc1	ZINC000819418548	CF	On-Demand	Anodyne	ADRB1	20	42
CCOc1cc(C)ccc1NC[C@@H](O)c1cccnc1	ZINC000819418548	CF	On-Demand	Anodyne	ADRB3	59	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(CN3CCOC3=O)cc2)c1	ZINC000819418553	GF	On-Demand	Anodyne	ADRB1	44	39
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(CN3CCOC3=O)cc2)c1	ZINC000819418553	GF	On-Demand	Anodyne	ABCB1	15	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(CN3CCOC3=O)cc2)c1	ZINC000819418555	GF	On-Demand	Anodyne	ADRB1	44	39
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(CN3CCOC3=O)cc2)c1	ZINC000819418555	GF	On-Demand	Anodyne	ABCB1	15	43
C#CCNC(=O)CCNc1cccc(OCCc2ccccc2)c1	ZINC000819418594	DF	On-Demand	Mild	HRH2	44	42
C#CCNC(=O)CCNc1cccc(OCCc2ccccc2)c1	ZINC000819418594	DF	On-Demand	Mild	MTNR1A	32	41
C#CCNC(=O)CCNc1cccc(OCCc2ccccc2)c1	ZINC000819418594	DF	On-Demand	Mild	MTNR1B	30	41
C#CCNC(=O)CCNc1cccc(OCCc2ccccc2)c1	ZINC000819418594	DF	On-Demand	Mild	FFAR1	32	44
C#CCNC(=O)CCNc1cccc(OCCc2ccccc2)c1	ZINC000819418594	DF	On-Demand	Mild	PDS	56	39
COCCOc1ccc(NC[C@H](O)c2cccnc2)c(C)c1	ZINC000819418608	DF	On-Demand	Anodyne	ADRB1	25	46
COCCOc1ccc(NC[C@H](O)c2cccnc2)c(C)c1	ZINC000819418608	DF	On-Demand	Anodyne	ADRB3	55	46
COCCOc1ccc(NC[C@@H](O)c2cccnc2)c(C)c1	ZINC000819418610	DF	On-Demand	Anodyne	ADRB1	25	46
COCCOc1ccc(NC[C@@H](O)c2cccnc2)c(C)c1	ZINC000819418610	DF	On-Demand	Anodyne	ADRB3	55	46
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cc([N+](=O)[O-])ccc1N1CCCCC1	ZINC000819418612	JK	On-Demand	Bother	WDR5	37	44
CN1CCC(N(C)c2ccc(NC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819418614	FH	On-Demand	Anodyne	SLC6A3	19	41
CN1CCC(N(C)c2ccc(NC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819418615	FH	On-Demand	Anodyne	SLC6A3	19	41
CN1CCC(N(C)c2ccc(NCCC(=O)Nc3ccccc3)cc2)CC1	ZINC000819418635	FH	On-Demand	Anodyne	CCR5	20	42
CCOC[C@H](O)CNc1ccc(C)cc1OCC	ZINC000819418641	CE	On-Demand	Anodyne	ADRB2	17	46
CON(C)C(=O)CCNc1cccc(OCCc2ccccc2)c1	ZINC000819418643	EG	On-Demand	Anodyne	LTA4H	22	40
CON(C)C(=O)CCNc1cccc(OCCc2ccccc2)c1	ZINC000819418643	EG	On-Demand	Anodyne	MTNR1A	26	44
CON(C)C(=O)CCNc1cccc(OCCc2ccccc2)c1	ZINC000819418643	EG	On-Demand	Anodyne	MTNR1B	27	44
CON(C)C(=O)CCNc1cccc(OCCc2ccccc2)c1	ZINC000819418643	EG	On-Demand	Anodyne	FFAR1	35	45
CON(C)C(=O)CCNc1cccc(OCCc2ccccc2)c1	ZINC000819418643	EG	On-Demand	Anodyne	PDS	61	38
CCOc1cc(C)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819418644	FG	On-Demand	Anodyne	ADRB2	44	56
CCOc1cc(C)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819418644	FG	On-Demand	Anodyne	ADRB1	69	56
CCOc1cc(C)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819418644	FG	On-Demand	Anodyne	ADRB3	40	48
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819418646	FG	On-Demand	Anodyne	ADRB2	44	56
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819418646	FG	On-Demand	Anodyne	ADRB1	69	56
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819418646	FG	On-Demand	Anodyne	ADRB3	40	48
COCCOc1ccc(NC[C@H](O)CN2CCN(C)CC2)c(C)c1	ZINC000819418651	ED	On-Demand	Anodyne	ACOX1	58	33
COCCOc1ccc(NC[C@@H](O)CN2CCN(C)CC2)c(C)c1	ZINC000819418652	ED	On-Demand	Anodyne	ACOX1	58	33
COCCOc1ccc(NC[C@@H](O)COC)c(C)c1	ZINC000819418653	CD	On-Demand	Anodyne	ADRB2	19	40
COCCOc1ccc(NC[C@@H](O)COC)c(C)c1	ZINC000819418653	CD	On-Demand	Anodyne	ADRB1	19	40
COCCOc1ccc(NC[C@H](O)COC)c(C)c1	ZINC000819418654	CD	On-Demand	Anodyne	ADRB2	19	40
COCCOc1ccc(NC[C@H](O)COC)c(C)c1	ZINC000819418654	CD	On-Demand	Anodyne	ADRB1	19	40
COCCOc1cc(C)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418658	EG	On-Demand	Bother	CACNA1C	59	39
COCCOc1cc(C)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418658	EG	On-Demand	Bother	CACNA1D	94	39
COCCOc1cc(C)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418659	EG	On-Demand	Bother	CACNA1C	59	39
COCCOc1cc(C)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819418659	EG	On-Demand	Bother	CACNA1D	94	39
O[C@@H](CNc1cccc(OCCc2ccccc2)c1)C1CC1	ZINC000819418671	CG	On-Demand	Anodyne	PDS	47	35
O[C@H](CNc1cccc(OCCc2ccccc2)c1)C1CC1	ZINC000819418672	CG	On-Demand	Anodyne	PDS	47	35
COCCOc1cc(C)ccc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819418681	EH	On-Demand	Anodyne	CTSV	30	41
COCCOc1cc(C)ccc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819418682	EH	On-Demand	Anodyne	CTSV	30	41
COCCOc1ccc(NC[C@H](O)COc2ccc(F)cc2)c(C)c1	ZINC000819418720	EG	On-Demand	Anodyne	ADRB2	30	43
COCCOc1ccc(NC[C@H](O)COc2ccc(F)cc2)c(C)c1	ZINC000819418720	EG	On-Demand	Anodyne	ADRB1	41	43
COCCOc1ccc(NC[C@@H](O)COc2ccc(F)cc2)c(C)c1	ZINC000819418721	EG	On-Demand	Anodyne	ADRB2	30	43
COCCOc1ccc(NC[C@@H](O)COc2ccc(F)cc2)c(C)c1	ZINC000819418721	EG	On-Demand	Anodyne	ADRB1	41	43
COCCOc1cc(C)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819418747	EH	On-Demand	Anodyne	ADRB1	32	44
COCCOc1cc(C)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819418747	EH	On-Demand	Anodyne	ADRB3	48	44
COCCOc1cc(C)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819418747	EH	On-Demand	Anodyne	IGF1R	28	40
COCCOc1cc(C)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819418747	EH	On-Demand	Anodyne	CYP3A4	49	40
COCCOc1cc(C)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819418748	EH	On-Demand	Anodyne	ADRB1	32	44
COCCOc1cc(C)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819418748	EH	On-Demand	Anodyne	ADRB3	48	44
COCCOc1cc(C)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819418748	EH	On-Demand	Anodyne	IGF1R	28	40
COCCOc1cc(C)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819418748	EH	On-Demand	Anodyne	CYP3A4	49	40
COCCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)c(C)c1	ZINC000819418781	FH	On-Demand	Anodyne	ADRB2	26	43
COCCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)c(C)c1	ZINC000819418781	FH	On-Demand	Anodyne	ADRB1	38	43
COCCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)c(C)c1	ZINC000819418782	FH	On-Demand	Anodyne	ADRB2	26	43
COCCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)c(C)c1	ZINC000819418782	FH	On-Demand	Anodyne	ADRB1	38	43
COCCOc1ccc(NCCC(=O)Nc2ccc(N(C)C)cc2)c(C)c1	ZINC000819418804	FH	On-Demand	Anodyne	MTNR1B	15	43
COCCOc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)c(C)c1	ZINC000819418829	FF	On-Demand	Anodyne	ACOX1	44	32
COCCOc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)c(C)c1	ZINC000819418829	FF	On-Demand	Anodyne	NOD2	42	38
COCCOc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)c(C)c1	ZINC000819418830	FF	On-Demand	Anodyne	ACOX1	44	32
COCCOc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)c(C)c1	ZINC000819418830	FF	On-Demand	Anodyne	NOD2	42	38
CCOc1cc(C)ccc1NC[C@@H](O)Cc1ccccc1	ZINC000819418834	CG	On-Demand	Anodyne	PDS	41	36
CCOc1cc(C)ccc1NC[C@H](O)Cc1ccccc1	ZINC000819418835	CG	On-Demand	Anodyne	PDS	41	36
CCOc1cc(C)ccc1NCC1(O)CCC1	ZINC000819418847	BF	On-Demand	Anodyne	HCN1	40	31
CCOc1cc(C)ccc1NCC1(O)CCC1	ZINC000819418847	BF	On-Demand	Anodyne	HCN4	41	31
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2Cl)c1	ZINC000819418854	KK	On-Demand	Anodyne	EPHB3	56	39
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2Cl)c1	ZINC000819418854	KK	On-Demand	Anodyne	NR2E3	52	33
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2Cl)c1	ZINC000819418854	KK	On-Demand	Anodyne	KCNK3	63	47
Cc1cccc(C(=O)Nc2ccccc2C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2Cl)c1	ZINC000819418854	KK	On-Demand	Anodyne	KCNK9	45	39
COCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)c(C)c1	ZINC000819418881	EH	On-Demand	Anodyne	ADRB1	32	46
COCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)c(C)c1	ZINC000819418881	EH	On-Demand	Anodyne	ADRB3	52	46
COCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)c(C)c1	ZINC000819418881	EH	On-Demand	Anodyne	IGF1R	29	41
COCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)c(C)c1	ZINC000819418881	EH	On-Demand	Anodyne	CYP3A4	51	41
COCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)c(C)c1	ZINC000819418882	EH	On-Demand	Anodyne	ADRB1	32	46
COCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)c(C)c1	ZINC000819418882	EH	On-Demand	Anodyne	ADRB3	52	46
COCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)c(C)c1	ZINC000819418882	EH	On-Demand	Anodyne	IGF1R	29	41
COCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)c(C)c1	ZINC000819418882	EH	On-Demand	Anodyne	CYP3A4	51	41
CCc1nc2cc(NC[C@H](O)c3cccnc3)ccc2o1	ZINC000819418938	CF	On-Demand	Anodyne	ADRB2	19	42
CCc1nc2cc(NC[C@H](O)c3cccnc3)ccc2o1	ZINC000819418938	CF	On-Demand	Anodyne	ADRB1	20	48
CCc1nc2cc(NC[C@H](O)c3cccnc3)ccc2o1	ZINC000819418938	CF	On-Demand	Anodyne	ADRB3	81	48
CCc1nc2cc(NC[C@@H](O)c3cccnc3)ccc2o1	ZINC000819418939	CF	On-Demand	Anodyne	ADRB2	19	42
CCc1nc2cc(NC[C@@H](O)c3cccnc3)ccc2o1	ZINC000819418939	CF	On-Demand	Anodyne	ADRB1	20	48
CCc1nc2cc(NC[C@@H](O)c3cccnc3)ccc2o1	ZINC000819418939	CF	On-Demand	Anodyne	ADRB3	81	48
CCCOc1cc(C)ccc1NC[C@H](O)COCC(C)C	ZINC000819418987	CG	On-Demand	Anodyne	ADRB2	17	45
CCCOc1cc(C)ccc1NC[C@@H](O)COCC(C)C	ZINC000819418988	CG	On-Demand	Anodyne	ADRB2	17	45
CCOc1cc(C)ccc1NCC1(O)CCS(=O)(=O)CC1	ZINC000819418995	DD	On-Demand	Anodyne	HCN1	41	31
CCOc1cc(C)ccc1NCC1(O)CCS(=O)(=O)CC1	ZINC000819418995	DD	On-Demand	Anodyne	HCN4	41	31
COCCOc1ccc(NC[C@H](O)COc2ccc(C)cc2)c(C)c1	ZINC000819418996	EG	On-Demand	Anodyne	ADRB2	28	50
COCCOc1ccc(NC[C@H](O)COc2ccc(C)cc2)c(C)c1	ZINC000819418996	EG	On-Demand	Anodyne	ADRB1	37	44
COCCOc1ccc(NC[C@@H](O)COc2ccc(C)cc2)c(C)c1	ZINC000819418997	EG	On-Demand	Anodyne	ADRB2	28	50
COCCOc1ccc(NC[C@@H](O)COc2ccc(C)cc2)c(C)c1	ZINC000819418997	EG	On-Demand	Anodyne	ADRB1	37	44
CCOc1cc(C)ccc1NC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819419009	FG	On-Demand	Anodyne	ADRB2	37	52
CCOc1cc(C)ccc1NC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819419009	FG	On-Demand	Anodyne	ADRB1	48	40
CCOc1cc(C)ccc1NC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819419009	FG	On-Demand	Anodyne	ADRB3	24	40
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819419010	FG	On-Demand	Anodyne	ADRB2	37	52
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819419010	FG	On-Demand	Anodyne	ADRB1	48	40
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819419010	FG	On-Demand	Anodyne	ADRB3	24	40
CCOc1cc(C)ccc1NC[C@H](O)COCc1ccccc1	ZINC000819419024	DG	On-Demand	Anodyne	ADRB2	18	40
CCOc1cc(C)ccc1NC[C@@H](O)COCc1ccccc1	ZINC000819419025	DG	On-Demand	Anodyne	ADRB2	18	40
CS(=O)(=O)c1ccc([C@@H](O)CNc2cccc(OCCCC#N)c2)cc1	ZINC000819419038	FF	On-Demand	Mild	CTSF	49	33
CS(=O)(=O)c1ccc([C@H](O)CNc2cccc(OCCCC#N)c2)cc1	ZINC000819419039	FF	On-Demand	Mild	CTSF	49	33
CCCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819419050	FH	On-Demand	Mild	ADRB2	22	40
CCCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819419050	FH	On-Demand	Mild	ADRB1	29	40
CCCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819419050	FH	On-Demand	Mild	CASR	40	36
CCCOc1cc(C)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819419051	FH	On-Demand	Mild	ADRB2	22	40
CCCOc1cc(C)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819419051	FH	On-Demand	Mild	ADRB1	29	40
CCCOc1cc(C)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819419051	FH	On-Demand	Mild	CASR	40	36
CCOc1cc(C)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819419056	EG	On-Demand	Anodyne	ADRB2	27	49
CCOc1cc(C)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819419056	EG	On-Demand	Anodyne	ADRB1	35	46
CCOc1cc(C)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819419056	EG	On-Demand	Anodyne	ABCB1	23	45
CCOc1cc(C)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819419056	EG	On-Demand	Anodyne	PDS	43	38
CCOc1cc(C)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819419057	EG	On-Demand	Anodyne	ADRB2	27	49
CCOc1cc(C)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819419057	EG	On-Demand	Anodyne	ADRB1	35	46
CCOc1cc(C)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819419057	EG	On-Demand	Anodyne	ABCB1	23	45
CCOc1cc(C)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819419057	EG	On-Demand	Anodyne	PDS	43	38
CCOc1cc(C)ccc1NC[C@@H](O)COC	ZINC000819419059	BD	On-Demand	Anodyne	ADRB2	18	46
CCOc1cc(C)ccc1NC[C@H](O)COC	ZINC000819419060	BD	On-Demand	Anodyne	ADRB2	18	46
COCCOc1ccc(NC[C@H](O)COc2ccccc2F)c(C)c1	ZINC000819419084	EG	On-Demand	Anodyne	ADRB2	28	40
COCCOc1ccc(NC[C@H](O)COc2ccccc2F)c(C)c1	ZINC000819419084	EG	On-Demand	Anodyne	ADRB1	50	36
COCCOc1ccc(NC[C@@H](O)COc2ccccc2F)c(C)c1	ZINC000819419085	EG	On-Demand	Anodyne	ADRB2	28	40
COCCOc1ccc(NC[C@@H](O)COc2ccccc2F)c(C)c1	ZINC000819419085	EG	On-Demand	Anodyne	ADRB1	50	36
CCOc1cc(C)ccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819419098	GH	On-Demand	Anodyne	GPR119	64	45
CCOc1cc(C)ccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819419099	GH	On-Demand	Anodyne	GPR119	64	45
CCOc1cc(C)ccc1NC[C@H](O)COc1c(OC)cccc1OC	ZINC000819419100	FG	On-Demand	Anodyne	ADRB2	27	43
CCOc1cc(C)ccc1NC[C@H](O)COc1c(OC)cccc1OC	ZINC000819419100	FG	On-Demand	Anodyne	KCNK3	36	40
CCOc1cc(C)ccc1NC[C@H](O)COc1c(OC)cccc1OC	ZINC000819419100	FG	On-Demand	Anodyne	KCNK9	28	40
CCOc1cc(C)ccc1NC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819419101	FG	On-Demand	Anodyne	ADRB2	27	43
CCOc1cc(C)ccc1NC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819419101	FG	On-Demand	Anodyne	KCNK3	36	40
CCOc1cc(C)ccc1NC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819419101	FG	On-Demand	Anodyne	KCNK9	28	40
O[C@H](CNc1ccccc1SC[C@@H]1CC1(Cl)Cl)c1cccnc1	ZINC000819419105	FJ	On-Demand	Anodyne	ADRB3	40	36
O[C@@H](CNc1ccccc1SC[C@H]1CC1(Cl)Cl)c1cccnc1	ZINC000819419106	FJ	On-Demand	Anodyne	ADRB3	40	36
O[C@H](CNc1ccccc1SC[C@H]1CC1(Cl)Cl)c1cccnc1	ZINC000819419107	FJ	On-Demand	Anodyne	ADRB3	40	36
O[C@@H](CNc1ccccc1SC[C@@H]1CC1(Cl)Cl)c1cccnc1	ZINC000819419108	FJ	On-Demand	Anodyne	ADRB3	40	36
CCc1nc2cc(NC[C@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)ccc2o1	ZINC000819419116	GH	On-Demand	Anodyne	GPR119	43	43
CCc1nc2cc(NC[C@@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)ccc2o1	ZINC000819419117	GH	On-Demand	Anodyne	GPR119	43	43
CCOc1cc(C)ccc1NC[C@H](O)c1ccccc1	ZINC000819419118	CH	On-Demand	Anodyne	ADRB3	36	45
CCOc1cc(C)ccc1NC[C@@H](O)c1ccccc1	ZINC000819419119	CH	On-Demand	Anodyne	ADRB3	36	45
CCOc1cc(C)ccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819419128	EG	On-Demand	Mild	ADRB2	25	44
CCOc1cc(C)ccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819419128	EG	On-Demand	Mild	ADRB1	49	39
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819419129	EG	On-Demand	Mild	ADRB2	25	44
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819419129	EG	On-Demand	Mild	ADRB1	49	39
CCOc1cc(C)ccc1NC[C@H](O)COc1ccccc1	ZINC000819419145	DG	On-Demand	Anodyne	ADRB2	50	49
CCOc1cc(C)ccc1NC[C@H](O)COc1ccccc1	ZINC000819419145	DG	On-Demand	Anodyne	ADRB1	57	47
CCOc1cc(C)ccc1NC[C@H](O)COc1ccccc1	ZINC000819419145	DG	On-Demand	Anodyne	ADRB3	32	43
CCOc1cc(C)ccc1NC[C@H](O)COc1ccccc1	ZINC000819419145	DG	On-Demand	Anodyne	PDS	58	38
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccccc1	ZINC000819419146	DG	On-Demand	Anodyne	ADRB2	50	49
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccccc1	ZINC000819419146	DG	On-Demand	Anodyne	ADRB1	57	47
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccccc1	ZINC000819419146	DG	On-Demand	Anodyne	ADRB3	32	43
CCOc1cc(C)ccc1NC[C@@H](O)COc1ccccc1	ZINC000819419146	DG	On-Demand	Anodyne	PDS	58	38
C[C@@H]1CCCC[C@@H]1C(=O)NCc1cccc(F)n1	ZINC000819419151	CF	On-Demand	Anodyne	PDE8B	44	34
C[C@@H]1CCCC[C@H]1C(=O)NCc1cccc(F)n1	ZINC000819419152	CF	On-Demand	Anodyne	PDE8B	44	34
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	F2	85	43
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	PLG	35	41
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	PRSS1	27	42
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	ACE	46	50
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	FKBP1A	98	52
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	OPRM1	39	44
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	OPRD1	28	41
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	CELA1	35	57
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	GRIN2B	21	40
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	ELANE	38	44
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	LTA4H	20	41
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	HLA-DRB3	50	34
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	CMA1	30	42
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	CTRA_BOVIN	63	34
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	TRY1_BOVIN	102	40
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	NTSR1	94	36
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	NTSR2	84	34
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	CTSG	44	34
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	CTSK	17	57
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	HLA-A	53	34
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	DPP4	17	48
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	PREP	110	60
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	CELA2A	51	34
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	LGMN	94	55
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	SORT1	48	34
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	GHSR	22	41
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	CTRC	18	41
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	CAPN2	42	37
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	KLK5	48	51
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	XIAP	47	44
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	BRCA1	60	33
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	SLC12A5	61	39
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419154	EE	On-Demand	Anodyne	TMPRSS11D	76	44
COCCOc1ccc(NC[C@H](O)COc2ccccc2C)c(C)c1	ZINC000819419155	EG	On-Demand	Anodyne	ADRB2	32	51
COCCOc1ccc(NC[C@H](O)COc2ccccc2C)c(C)c1	ZINC000819419155	EG	On-Demand	Anodyne	ADRB1	47	36
COCCOc1ccc(NC[C@H](O)COc2ccccc2C)c(C)c1	ZINC000819419155	EG	On-Demand	Anodyne	CYP2D6	20	42
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	F2	85	43
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	PLG	35	41
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	PRSS1	27	42
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	ACE	46	50
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	FKBP1A	98	52
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	OPRM1	39	44
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	OPRD1	28	41
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	CELA1	35	57
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	GRIN2B	21	40
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	ELANE	38	44
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	LTA4H	20	41
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	HLA-DRB3	50	34
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	CMA1	30	42
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	CTRA_BOVIN	63	34
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	TRY1_BOVIN	102	40
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	NTSR1	94	36
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	NTSR2	84	34
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	CTSG	44	34
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	CTSK	17	57
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	HLA-A	53	34
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	DPP4	17	48
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	PREP	110	60
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	CELA2A	51	34
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	LGMN	94	55
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	SORT1	48	34
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	GHSR	22	41
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	CTRC	18	41
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	CAPN2	42	37
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	KLK5	48	51
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	XIAP	47	44
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	BRCA1	60	33
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	SLC12A5	61	39
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)OCc1ccccc1	ZINC000819419156	EE	On-Demand	Anodyne	TMPRSS11D	76	44
COCCOc1ccc(NC[C@@H](O)COc2ccccc2C)c(C)c1	ZINC000819419157	EG	On-Demand	Anodyne	ADRB2	32	51
COCCOc1ccc(NC[C@@H](O)COc2ccccc2C)c(C)c1	ZINC000819419157	EG	On-Demand	Anodyne	ADRB1	47	36
COCCOc1ccc(NC[C@@H](O)COc2ccccc2C)c(C)c1	ZINC000819419157	EG	On-Demand	Anodyne	CYP2D6	20	42
CCCOc1cc(C)ccc1NC[C@H](O)c1cccnc1	ZINC000819419163	CG	On-Demand	Anodyne	ADRB1	22	51
CCCOc1cc(C)ccc1NC[C@H](O)c1cccnc1	ZINC000819419163	CG	On-Demand	Anodyne	ADRB3	58	51
CCCOc1cc(C)ccc1NC[C@@H](O)c1cccnc1	ZINC000819419164	CG	On-Demand	Anodyne	ADRB1	22	51
CCCOc1cc(C)ccc1NC[C@@H](O)c1cccnc1	ZINC000819419164	CG	On-Demand	Anodyne	ADRB3	58	51
O=C(O)CCCNC(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC000819419184	DD	On-Demand	Anodyne	FKBP1A	25	46
O=C(O)CCCNC(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC000819419184	DD	On-Demand	Anodyne	ACHE	18	45
O=C(O)CCCNC(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC000819419184	DD	On-Demand	Anodyne	SLC6A1	107	36
O=C(O)CCCNC(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC000819419184	DD	On-Demand	Anodyne	TBXAS1	90	44
O=C(O)CCCNC(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC000819419184	DD	On-Demand	Anodyne	PTAFR	17	40
O=C(O)CCCNC(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC000819419184	DD	On-Demand	Anodyne	SIGMAR1	20	42
O=C(O)CCCNC(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC000819419184	DD	On-Demand	Anodyne	CHRNA7	43	39
O=C(O)CCCNC(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC000819419184	DD	On-Demand	Anodyne	TBK1	53	36
O=C(O)CCCNC(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC000819419184	DD	On-Demand	Anodyne	GPBAR1	21	41
O=C(O)CCCNC(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC000819419184	DD	On-Demand	Anodyne	NAMPT	44	38
O=C(O)CCCNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC000819419186	DD	On-Demand	Anodyne	FKBP1A	25	46
O=C(O)CCCNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC000819419186	DD	On-Demand	Anodyne	ACHE	18	45
O=C(O)CCCNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC000819419186	DD	On-Demand	Anodyne	SLC6A1	107	36
O=C(O)CCCNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC000819419186	DD	On-Demand	Anodyne	TBXAS1	90	44
O=C(O)CCCNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC000819419186	DD	On-Demand	Anodyne	PTAFR	17	40
O=C(O)CCCNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC000819419186	DD	On-Demand	Anodyne	SIGMAR1	20	42
O=C(O)CCCNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC000819419186	DD	On-Demand	Anodyne	CHRNA7	43	39
O=C(O)CCCNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC000819419186	DD	On-Demand	Anodyne	TBK1	53	36
O=C(O)CCCNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC000819419186	DD	On-Demand	Anodyne	GPBAR1	21	41
O=C(O)CCCNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC000819419186	DD	On-Demand	Anodyne	NAMPT	44	38
O=C(O)CCCNC(=O)CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2	ZINC000819419188	CD	On-Demand	Anodyne	EPHX2	21	51
O=C(O)CCCNC(=O)CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2	ZINC000819419188	CD	On-Demand	Anodyne	BOTA	27	40
O=C(O)CCCNC(=O)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1	ZINC000819419192	GD	On-Demand	Anodyne	EPHX2	29	43
O=C(O)CCCNC(=O)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1	ZINC000819419193	GD	On-Demand	Anodyne	EPHX2	29	43
O=C(O)CCCNC(=O)CCC(=O)N1CCC(c2ccccc2)=N1	ZINC000819419194	ED	On-Demand	Anodyne	P2RY12	62	32
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)c1ccc(O)nn1	ZINC000819419203	EC	On-Demand	Anodyne	FKBP1A	22	41
O=C(O)CCCNC(=O)[C@H]1CCCCN1C(=O)c1ccc(O)nn1	ZINC000819419203	EC	On-Demand	Anodyne	TRY1_BOVIN	42	33
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1	ZINC000819419204	EC	On-Demand	Anodyne	FKBP1A	22	41
O=C(O)CCCNC(=O)[C@@H]1CCCCN1C(=O)c1ccc(O)nn1	ZINC000819419204	EC	On-Demand	Anodyne	TRY1_BOVIN	42	33
O=C(O)CCCNC(=O)C(=O)Nc1cnn(C[C@H]2CCCO2)c1	ZINC000819419205	DB	On-Demand	Anodyne	PANC	49	33
O=C(O)CCCNC(=O)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	ZINC000819419206	DB	On-Demand	Anodyne	PANC	49	33
O=C(O)CCCNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819419212	EE	On-Demand	Anodyne	F2	15	40
O=C(O)CCCNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819419212	EE	On-Demand	Anodyne	FKBP1A	42	42
O=C(O)CCCNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819419212	EE	On-Demand	Anodyne	P2RY12	132	38
O=C(O)CCCNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819419212	EE	On-Demand	Anodyne	GRIN2B	41	51
O=C(O)CCCNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819419212	EE	On-Demand	Anodyne	CTSK	16	41
O=C(O)CCCNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819419212	EE	On-Demand	Anodyne	PREP	53	46
O=C(O)CCCNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819419212	EE	On-Demand	Anodyne	CAPN1	30	40
O=C(O)CCCNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819419212	EE	On-Demand	Anodyne	CAPN2	55	38
O=C(O)CCCNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819419212	EE	On-Demand	Anodyne	EPHX2	26	40
O=C(O)CCCNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819419212	EE	On-Demand	Anodyne	TGM2	47	43
O=C(O)CCCNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819419212	EE	On-Demand	Anodyne	KLK5	40	37
O=C(O)CCCNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819419212	EE	On-Demand	Anodyne	F13A1	41	43
O=C(O)CCCNC(=O)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819419212	EE	On-Demand	Anodyne	SLC12A5	40	36
O=C(O)CCCNC(=O)C12C[C@H]3C[C@@H](CC(F)(C3)C1)C2	ZINC000819419214	CE	On-Demand	Anodyne	EPHX2	16	49
O=C(O)CCCNC(=O)C1CC(OCc2ccccc2)C1	ZINC000819419216	CD	On-Demand	Anodyne	CAPN2	46	37
O=C(O)CCCNC(=O)C1CCN(C(=O)c2ccoc2)CC1	ZINC000819419217	DD	On-Demand	Anodyne	L3MBTL3	66	39
O=C(O)CCCNC(=O)C(=O)Nc1cnccc1-c1cccc(F)c1	ZINC000819419224	ED	On-Demand	Anodyne	TBXAS1	32	40
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	CHRM2	19	44
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	DRD2	31	50
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	FKBP1A	25	43
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	DRD4	64	50
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	ACHE	57	51
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	HRH2	38	41
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	HTR2A	17	46
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	DRD3	29	50
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	CHRM3	31	41
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	LTA4H	28	50
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	HRH3	19	48
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	SIGMAR1	81	70
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	BCHE	21	41
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	CCR3	36	44
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	SCN2A	19	47
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	CCR5	19	43
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	MTNR1A	18	42
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	MTNR1B	18	42
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	EPHX2	26	43
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	MCHR1	30	44
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	CACNA1G	62	56
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	CYP2J2	44	31
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	NPFFR1	45	39
O=C(O)CCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000819419229	DD	On-Demand	Anodyne	ARG2	15	43
O=C(O)CCCNC(=O)C(=O)Nc1nc(-c2cccs2)cs1	ZINC000819419236	ED	On-Demand	Anodyne	ROCK1	20	41
O=C(O)CCCNC(=O)[C@@H]1CCCN(CC(F)(F)F)C1	ZINC000819419237	CD	On-Demand	Anodyne	SLC6A1	47	33
O=C(O)CCCNC(=O)[C@H]1CCCN(CC(F)(F)F)C1	ZINC000819419238	CD	On-Demand	Anodyne	SLC6A1	47	33
O=C(O)CCCNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819419244	DC	On-Demand	Anodyne	TBXA2R	47	41
O=C(O)CCCNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819419244	DC	On-Demand	Anodyne	TBXAS1	101	43
O=C(O)CCCNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819419244	DC	On-Demand	Anodyne	SLC18A3	15	43
O=C(O)CCCNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819419244	DC	On-Demand	Anodyne	PREP	15	40
O=C(O)CCCNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819419244	DC	On-Demand	Anodyne	EPHX2	15	48
O=C(O)CCCNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819419244	DC	On-Demand	Anodyne	TBK1	47	38
O=C(O)CCCNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819419244	DC	On-Demand	Anodyne	SFRP1	16	42
O=C(O)CCCNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819419244	DC	On-Demand	Anodyne	L3MBTL3	54	37
O=C(O)CCCNC(=O)C1CCN(C(=O)c2cccnc2)CC1	ZINC000819419244	DC	On-Demand	Anodyne	NAMPT	24	53
O=C(O)CCCNC(=O)C(=O)Nc1ccnc(Oc2ccccc2)c1	ZINC000819419250	ED	On-Demand	Anodyne	LTA4H	15	44
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc(SC)cc1	ZINC000819419272	GF	On-Demand	Anodyne	ADRB2	20	40
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819419273	GF	On-Demand	Anodyne	ADRB2	20	40
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819419285	EG	On-Demand	Anodyne	ADRB1	32	48
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819419285	EG	On-Demand	Anodyne	ADRB3	52	48
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819419285	EG	On-Demand	Anodyne	CPT1A	46	32
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819419285	EG	On-Demand	Anodyne	CYP3A4	48	36
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819419286	EG	On-Demand	Anodyne	ADRB1	32	48
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819419286	EG	On-Demand	Anodyne	ADRB3	52	48
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819419286	EG	On-Demand	Anodyne	CPT1A	46	32
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819419286	EG	On-Demand	Anodyne	CYP3A4	48	36
COc1cc(C)ccc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819419293	EF	On-Demand	Anodyne	NOD2	40	37
COc1cc(C)ccc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819419294	EF	On-Demand	Anodyne	NOD2	40	37
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000819419299	GG	On-Demand	Anodyne	PPARA	19	46
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000819419299	GG	On-Demand	Anodyne	PPARD	33	46
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000819419300	GG	On-Demand	Anodyne	PPARA	19	46
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000819419300	GG	On-Demand	Anodyne	PPARD	33	46
COc1cccc(OC)c1OC[C@H](O)CNc1cc(F)c(OC)c(F)c1	ZINC000819419303	FF	On-Demand	Anodyne	ADRB2	27	40
COc1cccc(OC)c1OC[C@@H](O)CNc1cc(F)c(OC)c(F)c1	ZINC000819419304	FF	On-Demand	Anodyne	ADRB2	27	40
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)CN(C)Cc1ccccc1	ZINC000819419336	FE	On-Demand	Anodyne	NCEH1	40	32
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)CN(C)Cc1ccccc1	ZINC000819419336	FE	On-Demand	Anodyne	LIMK2	19	42
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)CN(C)Cc1ccccc1	ZINC000819419337	FE	On-Demand	Anodyne	NCEH1	40	32
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)CN(C)Cc1ccccc1	ZINC000819419337	FE	On-Demand	Anodyne	LIMK2	19	42
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819419338	GG	On-Demand	Anodyne	ADRB2	33	52
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819419338	GG	On-Demand	Anodyne	CASR	42	38
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819419338	GG	On-Demand	Anodyne	MTNR1A	40	36
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819419338	GG	On-Demand	Anodyne	CYP2D6	19	40
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819419338	GG	On-Demand	Anodyne	NCEH1	41	36
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819419339	GG	On-Demand	Anodyne	ADRB2	33	52
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819419339	GG	On-Demand	Anodyne	CASR	42	38
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819419339	GG	On-Demand	Anodyne	MTNR1A	40	36
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819419339	GG	On-Demand	Anodyne	CYP2D6	19	40
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819419339	GG	On-Demand	Anodyne	NCEH1	41	36
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819419340	GG	On-Demand	Anodyne	GRIN2B	16	44
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819419341	GG	On-Demand	Anodyne	GRIN2B	16	44
COc1cc(C)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819419353	EF	On-Demand	Bother	ADRB2	25	45
COc1cc(C)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819419353	EF	On-Demand	Bother	ADRB1	23	45
COc1cc(C)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819419353	EF	On-Demand	Bother	CACNA1C	57	38
COc1cc(C)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819419353	EF	On-Demand	Bother	CACNA1D	91	38
COc1cc(C)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819419353	EF	On-Demand	Bother	KCNMA1	19	41
COC[C@@H](O)CNc1cccc(COc2ccccc2)c1	ZINC000819419355	CF	On-Demand	Anodyne	ADRB2	40	44
COC[C@@H](O)CNc1cccc(COc2ccccc2)c1	ZINC000819419355	CF	On-Demand	Anodyne	ADRB1	50	42
COC[C@@H](O)CNc1cccc(COc2ccccc2)c1	ZINC000819419355	CF	On-Demand	Anodyne	MAOB	22	54
COC[C@@H](O)CNc1cccc(COc2ccccc2)c1	ZINC000819419355	CF	On-Demand	Anodyne	ADRB3	32	42
COC[C@@H](O)CNc1cccc(COc2ccccc2)c1	ZINC000819419355	CF	On-Demand	Anodyne	CASR	27	40
COC[C@@H](O)CNc1cccc(COc2ccccc2)c1	ZINC000819419355	CF	On-Demand	Anodyne	PDS	71	36
CCOC[C@H](O)CNc1cccc(COc2ccccc2)c1	ZINC000819419380	DG	On-Demand	Anodyne	ADRB2	33	42
CCOC[C@H](O)CNc1cccc(COc2ccccc2)c1	ZINC000819419380	DG	On-Demand	Anodyne	ADRB1	40	40
CCOC[C@H](O)CNc1cccc(COc2ccccc2)c1	ZINC000819419380	DG	On-Demand	Anodyne	ADRB3	26	40
CCOC[C@H](O)CNc1cccc(COc2ccccc2)c1	ZINC000819419380	DG	On-Demand	Anodyne	PDS	72	37
CCCOc1ccc(NC[C@H](O)CN2CCN(C)CC2)c(C)c1	ZINC000819419396	DD	On-Demand	Anodyne	ACOX1	64	32
CCCOc1ccc(NC[C@@H](O)CN2CCN(C)CC2)c(C)c1	ZINC000819419397	DD	On-Demand	Anodyne	ACOX1	64	32
O[C@H](CNc1cccc2c1OCCO2)COc1cccc2[nH]ccc12	ZINC000819419433	EF	On-Demand	Anodyne	ADRB1	20	57
O[C@@H](CNc1cccc2c1OCCO2)COc1cccc2[nH]ccc12	ZINC000819419434	EF	On-Demand	Anodyne	ADRB1	20	57
COc1cc(C)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819419453	EF	On-Demand	Bother	ADRB2	25	45
COc1cc(C)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819419453	EF	On-Demand	Bother	ADRB1	23	45
COc1cc(C)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819419453	EF	On-Demand	Bother	CACNA1C	57	38
COc1cc(C)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819419453	EF	On-Demand	Bother	CACNA1D	91	38
COc1cc(C)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819419453	EF	On-Demand	Bother	KCNMA1	19	41
CCOc1ccc(OC[C@@H](O)CNc2cc(C(=O)N(C)C)ccc2OC)cc1	ZINC000819419454	GF	On-Demand	Anodyne	ADRB2	31	47
CCOc1ccc(OC[C@H](O)CNc2cc(C(=O)N(C)C)ccc2OC)cc1	ZINC000819419455	GF	On-Demand	Anodyne	ADRB2	31	47
COc1cc(C)ccc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819419456	EF	On-Demand	Anodyne	ADRB2	22	40
COc1cc(C)ccc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819419456	EF	On-Demand	Anodyne	EDNRB	74	39
COc1cc(C)ccc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819419456	EF	On-Demand	Anodyne	EDNRA	71	39
COc1cc(C)ccc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819419457	EF	On-Demand	Anodyne	ADRB2	22	40
COc1cc(C)ccc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819419457	EF	On-Demand	Anodyne	EDNRB	74	39
COc1cc(C)ccc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819419457	EF	On-Demand	Anodyne	EDNRA	71	39
C[C@@H](CNc1ccc(N(C)Cc2ccccc2)cc1)S(C)(=O)=O	ZINC000819419458	EG	On-Demand	Anodyne	RORC	21	40
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1ccc(Cl)cc1Cl	ZINC000819419460	GH	On-Demand	Anodyne	CPT1A	46	32
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1ccc(Cl)cc1Cl	ZINC000819419461	GH	On-Demand	Anodyne	CPT1A	46	32
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1C(C)C	ZINC000819419489	GG	On-Demand	Anodyne	ADRB2	31	43
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1C(C)C	ZINC000819419489	GG	On-Demand	Anodyne	ADRB1	55	35
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1C(C)C	ZINC000819419490	GG	On-Demand	Anodyne	ADRB2	31	43
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1C(C)C	ZINC000819419490	GG	On-Demand	Anodyne	ADRB1	55	35
N#CCc1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819419503	EE	On-Demand	Mild	ADRB1	40	37
N#CCc1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819419504	EE	On-Demand	Mild	ADRB1	40	37
C[C@@H](CNc1cccc(COc2ccccc2)c1)S(C)(=O)=O	ZINC000819419521	DG	On-Demand	Anodyne	PTGER3	41	35
C[C@@H](CNc1cccc(COc2ccccc2)c1)S(C)(=O)=O	ZINC000819419521	DG	On-Demand	Anodyne	ADAMTS4	33	41
C[C@@H](CNc1cccc(COc2ccccc2)c1)S(C)(=O)=O	ZINC000819419521	DG	On-Demand	Anodyne	PDS	59	33
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)CCC(C)C	ZINC000819419546	DF	On-Demand	Anodyne	NCEH1	44	31
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)CCC(C)C	ZINC000819419547	DF	On-Demand	Anodyne	NCEH1	44	31
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819419549	FE	On-Demand	Bother	CACNA1D	48	34
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819419553	FE	On-Demand	Bother	CACNA1D	48	34
CON(C)C(=O)CCNc1cccc(COc2ccccc2)c1	ZINC000819419562	DG	On-Demand	Anodyne	LTA4H	25	44
CON(C)C(=O)CCNc1cccc(COc2ccccc2)c1	ZINC000819419562	DG	On-Demand	Anodyne	PTGER3	52	37
CON(C)C(=O)CCNc1cccc(COc2ccccc2)c1	ZINC000819419562	DG	On-Demand	Anodyne	GYS1	40	37
CON(C)C(=O)CCNc1cccc(COc2ccccc2)c1	ZINC000819419562	DG	On-Demand	Anodyne	FFAR1	69	44
CON(C)C(=O)CCNc1cccc(COc2ccccc2)c1	ZINC000819419562	DG	On-Demand	Anodyne	FFAR4	28	42
CON(C)C(=O)CCNc1cccc(COc2ccccc2)c1	ZINC000819419562	DG	On-Demand	Anodyne	PDS	51	31
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](C)O	ZINC000819419565	CD	On-Demand	Anodyne	NCEH1	45	32
COc1ccc(C(=O)N(C)C)cc1NC[C@H](C)O	ZINC000819419566	CD	On-Demand	Anodyne	NCEH1	45	32
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1ccc(C(F)(F)F)cc1	ZINC000819419584	GH	On-Demand	Anodyne	EPHX2	17	46
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1ccc(C(F)(F)F)cc1	ZINC000819419586	GH	On-Demand	Anodyne	EPHX2	17	46
CCCOc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)c(C)c1	ZINC000819419605	FH	On-Demand	Mild	ADRB2	21	41
CCCOc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)c(C)c1	ZINC000819419605	FH	On-Demand	Mild	ADRB1	24	41
CCCOc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)c(C)c1	ZINC000819419607	FH	On-Demand	Mild	ADRB2	21	41
CCCOc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)c(C)c1	ZINC000819419607	FH	On-Demand	Mild	ADRB1	24	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2cccc3c2OCCO3)CC1	ZINC000819419616	GF	On-Demand	Anodyne	GPR119	43	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2cccc3c2OCCO3)CC1	ZINC000819419617	GF	On-Demand	Anodyne	GPR119	43	46
O[C@@H](CNc1cccc(COc2ccccc2)c1)COC1CCOCC1	ZINC000819419649	FG	On-Demand	Anodyne	ADRB1	40	38
O[C@H](CNc1cccc(COc2ccccc2)c1)COC1CCOCC1	ZINC000819419650	FG	On-Demand	Anodyne	ADRB1	40	38
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cc(C)ccc1C	ZINC000819419653	FF	On-Demand	Anodyne	ADRB2	21	46
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cc(C)ccc1C	ZINC000819419653	FF	On-Demand	Anodyne	ADRB1	42	34
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cc(C)ccc1C	ZINC000819419654	FF	On-Demand	Anodyne	ADRB2	21	46
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cc(C)ccc1C	ZINC000819419654	FF	On-Demand	Anodyne	ADRB1	42	34
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819419673	GE	On-Demand	Anodyne	NCEH1	41	32
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819419675	GE	On-Demand	Anodyne	NCEH1	41	32
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819419689	GG	On-Demand	Anodyne	ADRB2	15	44
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819419691	GG	On-Demand	Anodyne	ADRB2	15	44
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1ccccc1	ZINC000819419718	DF	On-Demand	Anodyne	ADRB1	15	41
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1ccccc1	ZINC000819419718	DF	On-Demand	Anodyne	ADRB3	32	41
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1ccccc1	ZINC000819419718	DF	On-Demand	Anodyne	CPT1A	45	32
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1ccccc1	ZINC000819419720	DF	On-Demand	Anodyne	ADRB1	15	41
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1ccccc1	ZINC000819419720	DF	On-Demand	Anodyne	ADRB3	32	41
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1ccccc1	ZINC000819419720	DF	On-Demand	Anodyne	CPT1A	45	32
COc1cc(C)ccc1NC[C@H](O)COc1c(OC)cccc1OC	ZINC000819419722	EF	On-Demand	Anodyne	ADRB2	32	46
COc1cc(C)ccc1NC[C@H](O)COc1c(OC)cccc1OC	ZINC000819419722	EF	On-Demand	Anodyne	ADRB1	26	42
COc1cc(C)ccc1NC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819419724	EF	On-Demand	Anodyne	ADRB2	32	46
COc1cc(C)ccc1NC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819419724	EF	On-Demand	Anodyne	ADRB1	26	42
COc1cc(C)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819419743	EF	On-Demand	Anodyne	ADRB2	47	57
COc1cc(C)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819419743	EF	On-Demand	Anodyne	ADRB1	73	57
COc1cc(C)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819419743	EF	On-Demand	Anodyne	TSHR	59	34
COc1cc(C)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819419743	EF	On-Demand	Anodyne	ADRB3	47	49
COc1cc(C)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819419743	EF	On-Demand	Anodyne	PDGFRA	41	34
COc1cc(C)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819419745	EF	On-Demand	Anodyne	ADRB2	47	57
COc1cc(C)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819419745	EF	On-Demand	Anodyne	ADRB1	73	57
COc1cc(C)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819419745	EF	On-Demand	Anodyne	TSHR	59	34
COc1cc(C)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819419745	EF	On-Demand	Anodyne	ADRB3	47	49
COc1cc(C)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819419745	EF	On-Demand	Anodyne	PDGFRA	41	34
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1cccnc1	ZINC000819419755	DD	On-Demand	Anodyne	ADRB1	18	45
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1cccnc1	ZINC000819419755	DD	On-Demand	Anodyne	ADRB3	54	45
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1cccnc1	ZINC000819419757	DD	On-Demand	Anodyne	ADRB1	18	45
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1cccnc1	ZINC000819419757	DD	On-Demand	Anodyne	ADRB3	54	45
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1	ZINC000819419777	EE	On-Demand	Anodyne	ADRB2	49	46
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1	ZINC000819419777	EE	On-Demand	Anodyne	ADRB1	65	44
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1	ZINC000819419777	EE	On-Demand	Anodyne	ADRB3	38	44
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1	ZINC000819419777	EE	On-Demand	Anodyne	ABCB1	33	41
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1	ZINC000819419777	EE	On-Demand	Anodyne	PDS	47	34
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1	ZINC000819419778	EE	On-Demand	Anodyne	ADRB2	49	46
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1	ZINC000819419778	EE	On-Demand	Anodyne	ADRB1	65	44
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1	ZINC000819419778	EE	On-Demand	Anodyne	ADRB3	38	44
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1	ZINC000819419778	EE	On-Demand	Anodyne	ABCB1	33	41
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1	ZINC000819419778	EE	On-Demand	Anodyne	PDS	47	34
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819419781	FG	On-Demand	Anodyne	ADRB2	17	48
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819419781	FG	On-Demand	Anodyne	ADRB1	30	48
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819419781	FG	On-Demand	Anodyne	ADRB3	46	48
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819419781	FG	On-Demand	Anodyne	IGF1R	28	40
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819419781	FG	On-Demand	Anodyne	CASR	42	38
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819419781	FG	On-Demand	Anodyne	CYP3A4	47	39
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819419783	FG	On-Demand	Anodyne	ADRB2	17	48
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819419783	FG	On-Demand	Anodyne	ADRB1	30	48
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819419783	FG	On-Demand	Anodyne	ADRB3	46	48
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819419783	FG	On-Demand	Anodyne	IGF1R	28	40
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819419783	FG	On-Demand	Anodyne	CASR	42	38
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819419783	FG	On-Demand	Anodyne	CYP3A4	47	39
O[C@H](CNc1cccc2c1OCCO2)c1cccnc1	ZINC000819419787	CD	On-Demand	Anodyne	ADRB3	48	38
O[C@@H](CNc1cccc2c1OCCO2)c1cccnc1	ZINC000819419789	CD	On-Demand	Anodyne	ADRB3	48	38
O[C@@H](CNc1cccc2c1OCCO2)c1cccc(Cl)c1	ZINC000819419812	DG	On-Demand	Anodyne	ADRB3	37	40
O[C@@H](CNc1cccc2c1OCCO2)c1cccc(Cl)c1	ZINC000819419812	DG	On-Demand	Anodyne	IGF1R	29	40
O[C@@H](CNc1cccc2c1OCCO2)c1cccc(Cl)c1	ZINC000819419812	DG	On-Demand	Anodyne	CYP3A4	50	38
O[C@H](CNc1cccc2c1OCCO2)c1cccc(Cl)c1	ZINC000819419814	DG	On-Demand	Anodyne	ADRB3	37	40
O[C@H](CNc1cccc2c1OCCO2)c1cccc(Cl)c1	ZINC000819419814	DG	On-Demand	Anodyne	IGF1R	29	40
O[C@H](CNc1cccc2c1OCCO2)c1cccc(Cl)c1	ZINC000819419814	DG	On-Demand	Anodyne	CYP3A4	50	38
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc(Cl)cc1	ZINC000819419821	GF	On-Demand	Anodyne	ADRB2	29	41
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819419823	GF	On-Demand	Anodyne	ADRB2	29	41
CCOC(=O)C1CCC(O)(CNc2cccc(COc3ccccc3)c2)CC1	ZINC000819419843	GI	On-Demand	Anodyne	FKBP1A	15	41
CCOC(=O)C1CCC(O)(CNc2cccc(COc3ccccc3)c2)CC1	ZINC000819419843	GI	On-Demand	Anodyne	ADAM17	41	39
CCOC(=O)C1CCC(O)(CNc2cccc(COc3ccccc3)c2)CC1	ZINC000819419843	GI	On-Demand	Anodyne	TIMP3	72	34
CCOC(=O)C1CCC(O)(CNc2cccc(COc3ccccc3)c2)CC1	ZINC000819419843	GI	On-Demand	Anodyne	GYS1	42	35
CCOC(=O)C1CCC(O)(CNc2cccc(COc3ccccc3)c2)CC1	ZINC000819419843	GI	On-Demand	Anodyne	FFAR1	62	39
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc(C)cc1C	ZINC000819419851	FF	On-Demand	Anodyne	ADRB2	17	44
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc(C)cc1C	ZINC000819419852	FF	On-Demand	Anodyne	ADRB2	17	44
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccnc1	ZINC000819419875	EE	On-Demand	Anodyne	ADRB2	32	43
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccnc1	ZINC000819419875	EE	On-Demand	Anodyne	ADRB1	29	40
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccnc1	ZINC000819419875	EE	On-Demand	Anodyne	ADRB3	104	48
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccnc1	ZINC000819419875	EE	On-Demand	Anodyne	CASR	40	46
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccnc1	ZINC000819419875	EE	On-Demand	Anodyne	CHRNA7	18	45
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccnc1	ZINC000819419876	EE	On-Demand	Anodyne	ADRB2	32	43
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccnc1	ZINC000819419876	EE	On-Demand	Anodyne	ADRB1	29	40
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccnc1	ZINC000819419876	EE	On-Demand	Anodyne	ADRB3	104	48
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccnc1	ZINC000819419876	EE	On-Demand	Anodyne	CASR	40	46
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccnc1	ZINC000819419876	EE	On-Demand	Anodyne	CHRNA7	18	45
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1ccccc1Br	ZINC000819419890	GG	On-Demand	Anodyne	NCEH1	40	32
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1ccccc1Br	ZINC000819419892	GG	On-Demand	Anodyne	NCEH1	40	32
CCOc1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819419925	EF	On-Demand	Anodyne	ADRB2	33	40
CCOc1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819419925	EF	On-Demand	Anodyne	ADRB1	44	38
CCOc1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819419927	EF	On-Demand	Anodyne	ADRB2	33	40
CCOc1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819419927	EF	On-Demand	Anodyne	ADRB1	44	38
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1Cl	ZINC000819419952	GF	On-Demand	Anodyne	ADRB2	27	48
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1Cl	ZINC000819419952	GF	On-Demand	Anodyne	ADRB1	58	36
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)C1CC1	ZINC000819419953	CD	On-Demand	Anodyne	L3MBTL3	25	45
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)C1CC1	ZINC000819419954	CD	On-Demand	Anodyne	L3MBTL3	25	45
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819419955	GF	On-Demand	Anodyne	ADRB2	27	48
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819419955	GF	On-Demand	Anodyne	ADRB1	58	36
Cc1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819419964	DF	On-Demand	Anodyne	ADRB2	34	48
Cc1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819419964	DF	On-Demand	Anodyne	ADRB1	44	39
Cc1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819419965	DF	On-Demand	Anodyne	ADRB2	34	48
Cc1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819419965	DF	On-Demand	Anodyne	ADRB1	44	39
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)CN(C)C1CC1	ZINC000819419978	DD	On-Demand	Anodyne	NCEH1	46	35
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)CN(C)C1CC1	ZINC000819419979	DD	On-Demand	Anodyne	NCEH1	46	35
COc1cc(C)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819419980	EG	On-Demand	Anodyne	ADRB2	32	47
COc1cc(C)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819419980	EG	On-Demand	Anodyne	ADRB1	36	47
COc1cc(C)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819419980	EG	On-Demand	Anodyne	ABCB1	24	45
COc1cc(C)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819419981	EG	On-Demand	Anodyne	ADRB2	32	47
COc1cc(C)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819419981	EG	On-Demand	Anodyne	ADRB1	36	47
COc1cc(C)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819419981	EG	On-Demand	Anodyne	ABCB1	24	45
CCCOc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)c(C)c1	ZINC000819419992	FH	On-Demand	Anodyne	ADRB2	36	55
CCCOc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)c(C)c1	ZINC000819419992	FH	On-Demand	Anodyne	ADRB1	64	55
CCCOc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)c(C)c1	ZINC000819419992	FH	On-Demand	Anodyne	GRIN1	25	41
CCCOc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)c(C)c1	ZINC000819419992	FH	On-Demand	Anodyne	ADRB3	38	48
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1c(C)cccc1C	ZINC000819419993	FF	On-Demand	Anodyne	ADRB2	23	40
CCCOc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)c(C)c1	ZINC000819419994	FH	On-Demand	Anodyne	ADRB2	36	55
CCCOc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)c(C)c1	ZINC000819419994	FH	On-Demand	Anodyne	ADRB1	64	55
CCCOc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)c(C)c1	ZINC000819419994	FH	On-Demand	Anodyne	GRIN1	25	41
CCCOc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)c(C)c1	ZINC000819419994	FH	On-Demand	Anodyne	ADRB3	38	48
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1c(C)cccc1C	ZINC000819419995	FF	On-Demand	Anodyne	ADRB2	23	40
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819419998	GD	On-Demand	Anodyne	EDNRB	50	41
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819419998	GD	On-Demand	Anodyne	EDNRA	55	41
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819419998	GD	On-Demand	Anodyne	BMP1	40	36
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819420000	GD	On-Demand	Anodyne	EDNRB	50	41
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819420000	GD	On-Demand	Anodyne	EDNRA	55	41
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819420000	GD	On-Demand	Anodyne	BMP1	40	36
COCCCOc1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819420002	DG	On-Demand	Anodyne	HRH2	31	41
COCCCOc1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819420002	DG	On-Demand	Anodyne	ROCK2	23	41
COCCCOc1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819420002	DG	On-Demand	Anodyne	CRTM	44	33
COCCCOc1cccc(CNC(=O)C(F)=C2CCC2)c1	ZINC000819420002	DG	On-Demand	Anodyne	PDS	62	38
CCOC(=O)Nc1ccc(NC(=O)c2cc(C)ccc2C2CC2)cc1C#N	ZINC000819420004	FJ	On-Demand	Mild	KCNK3	57	37
CCOC(=O)Nc1ccc(NC(=O)c2cc(C)ccc2C2CC2)cc1C#N	ZINC000819420004	FJ	On-Demand	Mild	KCNK9	50	37
COc1ccc(C(=O)N(C)C)cc1NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819420013	GF	On-Demand	Anodyne	CPT1A	44	31
COc1ccc(C(=O)N(C)C)cc1NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819420013	GF	On-Demand	Anodyne	MTNR1B	22	46
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819420029	GH	On-Demand	Anodyne	CASR	41	36
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819420029	GH	On-Demand	Anodyne	NCEH1	43	37
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819420030	GH	On-Demand	Anodyne	CASR	41	36
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819420030	GH	On-Demand	Anodyne	NCEH1	43	37
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)CC1CCCC1	ZINC000819420043	DF	On-Demand	Anodyne	ACKR3	43	32
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)CC1CCCC1	ZINC000819420044	DF	On-Demand	Anodyne	ACKR3	43	32
CCCOc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c(C)c1	ZINC000819420073	FG	On-Demand	Anodyne	ADRB3	20	41
CCCOc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c(C)c1	ZINC000819420074	FG	On-Demand	Anodyne	ADRB3	20	41
CCOC(=O)Nc1ccc(NC(=O)[C@H]2CCCC[C@H]2C)cc1C#N	ZINC000819420116	EH	On-Demand	Mild	PFKFB3	60	33
CCOC(=O)Nc1ccc(NC(=O)[C@@H]2CCCC[C@H]2C)cc1C#N	ZINC000819420117	EH	On-Demand	Mild	PFKFB3	60	33
CCOC(=O)Nc1ccc(NC(=O)[C@@H]2CCCC[C@@H]2C)cc1C#N	ZINC000819420118	EH	On-Demand	Mild	PFKFB3	60	33
CCOC(=O)Nc1ccc(NC(=O)[C@H]2CCCC[C@@H]2C)cc1C#N	ZINC000819420119	EH	On-Demand	Mild	PFKFB3	60	33
C[C@@](O)(CNc1cccc(COc2ccccc2)c1)C(F)(F)F	ZINC000819420125	EH	On-Demand	Anodyne	MAOB	34	40
C[C@@](O)(CNc1cccc(COc2ccccc2)c1)C(F)(F)F	ZINC000819420125	EH	On-Demand	Anodyne	FFAR1	29	40
C[C@@](O)(CNc1cccc(COc2ccccc2)c1)C(F)(F)F	ZINC000819420125	EH	On-Demand	Anodyne	PDS	45	35
COc1cc(C)ccc1NC[C@@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819420150	FG	On-Demand	Anodyne	ADRB2	48	42
COc1cc(C)ccc1NC[C@@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819420150	FG	On-Demand	Anodyne	ADRB1	67	50
COc1cc(C)ccc1NC[C@@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819420150	FG	On-Demand	Anodyne	GRIN1	19	40
COc1cc(C)ccc1NC[C@@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819420150	FG	On-Demand	Anodyne	ADRB3	46	43
COc1cc(C)ccc1NC[C@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819420151	FG	On-Demand	Anodyne	ADRB2	48	42
COc1cc(C)ccc1NC[C@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819420151	FG	On-Demand	Anodyne	ADRB1	67	50
COc1cc(C)ccc1NC[C@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819420151	FG	On-Demand	Anodyne	GRIN1	19	40
COc1cc(C)ccc1NC[C@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819420151	FG	On-Demand	Anodyne	ADRB3	46	43
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420155	FF	On-Demand	Anodyne	ADRB2	40	45
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420155	FF	On-Demand	Anodyne	ADRB1	62	44
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420155	FF	On-Demand	Anodyne	GRIN1	17	44
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420155	FF	On-Demand	Anodyne	ADRB3	37	44
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420156	FF	On-Demand	Anodyne	ADRB2	40	45
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420156	FF	On-Demand	Anodyne	ADRB1	62	44
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420156	FF	On-Demand	Anodyne	GRIN1	17	44
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420156	FF	On-Demand	Anodyne	ADRB3	37	44
COc1cc(C)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819420157	EF	On-Demand	Mild	ADRB2	31	43
COc1cc(C)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819420157	EF	On-Demand	Mild	ADRB1	38	40
COc1cc(C)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819420157	EF	On-Demand	Mild	ADRB3	21	40
COc1cc(C)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819420158	EF	On-Demand	Mild	ADRB2	31	43
COc1cc(C)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819420158	EF	On-Demand	Mild	ADRB1	38	40
COc1cc(C)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819420158	EF	On-Demand	Mild	ADRB3	21	40
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cc(C)cc(C)c1	ZINC000819420171	FF	On-Demand	Anodyne	ADRB2	23	47
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000819420173	FF	On-Demand	Anodyne	ADRB2	23	47
Cc1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)c(C)c1	ZINC000819420178	EF	On-Demand	Anodyne	ADRB2	19	42
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819420179	GE	On-Demand	Anodyne	ABCB1B	52	34
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819420179	GE	On-Demand	Anodyne	NOD2	43	39
Cc1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)c(C)c1	ZINC000819420180	EF	On-Demand	Anodyne	ADRB2	19	42
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819420181	GE	On-Demand	Anodyne	ABCB1B	52	34
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819420181	GE	On-Demand	Anodyne	NOD2	43	39
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cccc2ccccc12	ZINC000819420183	GG	On-Demand	Anodyne	ADRB2	33	54
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cccc2ccccc12	ZINC000819420183	GG	On-Demand	Anodyne	ADRB1	64	34
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cccc2ccccc12	ZINC000819420183	GG	On-Demand	Anodyne	ADRB3	15	53
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cccc2ccccc12	ZINC000819420183	GG	On-Demand	Anodyne	CASR	40	36
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cccc2ccccc12	ZINC000819420183	GG	On-Demand	Anodyne	CYP2D6	23	42
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cccc2ccccc12	ZINC000819420184	GG	On-Demand	Anodyne	ADRB2	33	54
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cccc2ccccc12	ZINC000819420184	GG	On-Demand	Anodyne	ADRB1	64	34
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cccc2ccccc12	ZINC000819420184	GG	On-Demand	Anodyne	ADRB3	15	53
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cccc2ccccc12	ZINC000819420184	GG	On-Demand	Anodyne	CASR	40	36
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cccc2ccccc12	ZINC000819420184	GG	On-Demand	Anodyne	CYP2D6	23	42
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819420212	GE	On-Demand	Mild	ADRB1	42	35
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819420213	GE	On-Demand	Mild	ADRB1	42	35
COc1cccc(Oc2ccc(NCCS(C)(=O)=O)cc2)c1	ZINC000819420221	DF	On-Demand	Anodyne	MTNR1A	36	55
COc1cccc(Oc2ccc(NCCS(C)(=O)=O)cc2)c1	ZINC000819420221	DF	On-Demand	Anodyne	MTNR1B	36	55
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819420226	FE	On-Demand	Mild	ADRB2	22	40
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819420226	FE	On-Demand	Mild	ADRB1	50	39
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819420227	FE	On-Demand	Mild	ADRB2	22	40
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819420227	FE	On-Demand	Mild	ADRB1	50	39
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(C)cc2OC)cc1	ZINC000819420234	EF	On-Demand	Anodyne	ADRB2	42	48
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(C)cc2OC)cc1	ZINC000819420234	EF	On-Demand	Anodyne	ADRB1	57	42
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(C)cc2OC)cc1	ZINC000819420234	EF	On-Demand	Anodyne	ADRB3	32	42
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(C)cc2OC)cc1	ZINC000819420235	EF	On-Demand	Anodyne	ADRB2	42	48
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(C)cc2OC)cc1	ZINC000819420235	EF	On-Demand	Anodyne	ADRB1	57	42
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(C)cc2OC)cc1	ZINC000819420235	EF	On-Demand	Anodyne	ADRB3	32	42
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819420248	GH	On-Demand	Anodyne	PPARD	23	43
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819420249	GH	On-Demand	Anodyne	PPARD	23	43
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819420305	FC	On-Demand	Anodyne	SLC9A1	59	33
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819420306	FC	On-Demand	Anodyne	SLC9A1	59	33
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819420307	GF	On-Demand	Anodyne	ADRB2	24	57
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819420307	GF	On-Demand	Anodyne	ADRB1	45	57
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819420308	GF	On-Demand	Anodyne	ADRB2	24	57
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819420308	GF	On-Demand	Anodyne	ADRB1	45	57
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819420311	GH	On-Demand	Anodyne	CCR2	19	41
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819420312	GH	On-Demand	Anodyne	CCR2	19	41
COc1ccc(C(=O)N(C)C)cc1NCC1(O)CCCC1	ZINC000819420317	CE	On-Demand	Anodyne	SLC6A5	15	41
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1ccc(Br)cc1	ZINC000819420323	GG	On-Demand	Anodyne	NCEH1	42	36
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1ccc(Br)cc1	ZINC000819420324	GG	On-Demand	Anodyne	NCEH1	42	36
COc1ccc(C(=O)N(C)C)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819420331	DE	On-Demand	Anodyne	NCEH1	45	32
COc1ccc(C(=O)N(C)C)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819420332	DE	On-Demand	Anodyne	NCEH1	45	32
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819420333	FF	On-Demand	Anodyne	ADRB2	31	47
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819420334	FF	On-Demand	Anodyne	ADRB2	31	47
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819420339	EF	On-Demand	Anodyne	LIMK2	17	42
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)CCc1ccccc1	ZINC000819420340	EF	On-Demand	Anodyne	LIMK2	17	42
COc1cccc(Oc2ccc(NCCC(=O)N(C)OC)cc2)c1	ZINC000819420352	EG	On-Demand	Anodyne	DRD4	41	31
COc1cccc(Oc2ccc(NCCC(=O)N(C)OC)cc2)c1	ZINC000819420352	EG	On-Demand	Anodyne	RAF1	19	44
COc1cccc(Oc2ccc(NCCC(=O)N(C)OC)cc2)c1	ZINC000819420352	EG	On-Demand	Anodyne	MTNR1A	54	55
COc1cccc(Oc2ccc(NCCC(=O)N(C)OC)cc2)c1	ZINC000819420352	EG	On-Demand	Anodyne	MTNR1B	53	55
COc1cccc(Oc2ccc(NCCC(=O)N(C)OC)cc2)c1	ZINC000819420352	EG	On-Demand	Anodyne	NPY5R	21	41
COc1cc(C)ccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819420355	EF	On-Demand	Bother	ADRB2	28	42
COc1cc(C)ccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819420355	EF	On-Demand	Bother	ADRB1	54	35
COc1cc(C)ccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819420356	EF	On-Demand	Bother	ADRB2	28	42
COc1cc(C)ccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819420356	EF	On-Demand	Bother	ADRB1	54	35
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1ccc(Cl)cc1	ZINC000819420359	EG	On-Demand	Anodyne	CPT1A	46	33
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1ccc(Cl)cc1	ZINC000819420359	EG	On-Demand	Anodyne	UTS2	45	36
COc1ccc(C(=O)N(C)C)cc1NCC(C)(C)O	ZINC000819420372	CD	On-Demand	Anodyne	MT-ND1	29	40
COc1ccc(C(=O)N(C)C)cc1NCC(C)(C)O	ZINC000819420372	CD	On-Demand	Anodyne	NCEH1	52	33
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1C	ZINC000819420373	FF	On-Demand	Anodyne	ADRB2	28	52
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1C	ZINC000819420373	FF	On-Demand	Anodyne	ADRB1	59	36
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1C	ZINC000819420373	FF	On-Demand	Anodyne	CYP2D6	20	40
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819420374	FF	On-Demand	Anodyne	ADRB2	28	52
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819420374	FF	On-Demand	Anodyne	ADRB1	59	36
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819420374	FF	On-Demand	Anodyne	CYP2D6	20	40
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)Cc1ccccc1	ZINC000819420382	EE	On-Demand	Anodyne	ADRB3	17	41
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)Cc1ccccc1	ZINC000819420383	EE	On-Demand	Anodyne	ADRB3	17	41
COc1ccc(C(=O)N(C)C)cc1NCC1(O)CCCCC1	ZINC000819420388	DF	On-Demand	Anodyne	SLC6A5	15	42
COc1cc(C)ccc1NC[C@@H](O)CCc1ccccc1	ZINC000819420402	CG	On-Demand	Anodyne	ADRB2	15	40
COc1cc(C)ccc1NC[C@H](O)CCc1ccccc1	ZINC000819420403	CG	On-Demand	Anodyne	ADRB2	15	40
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819420408	GE	On-Demand	Anodyne	ADRB2	24	43
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819420408	GE	On-Demand	Anodyne	ABCB1	17	40
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819420409	GE	On-Demand	Anodyne	ADRB2	24	43
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819420409	GE	On-Demand	Anodyne	ABCB1	17	40
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819420412	GE	On-Demand	Bother	ADRB1	58	35
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819420413	GE	On-Demand	Bother	ADRB1	58	35
COc1cccc(Oc2ccc(NC[C@@H](O)C3CC3)cc2)c1	ZINC000819420414	CH	On-Demand	Anodyne	MTNR1A	26	54
COc1cccc(Oc2ccc(NC[C@@H](O)C3CC3)cc2)c1	ZINC000819420414	CH	On-Demand	Anodyne	MTNR1B	30	54
COc1cccc(Oc2ccc(NC[C@H](O)C3CC3)cc2)c1	ZINC000819420415	CH	On-Demand	Anodyne	MTNR1A	26	54
COc1cccc(Oc2ccc(NC[C@H](O)C3CC3)cc2)c1	ZINC000819420415	CH	On-Demand	Anodyne	MTNR1B	30	54
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819420434	FE	On-Demand	Anodyne	ADRB2	35	41
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819420434	FE	On-Demand	Anodyne	ADRB1	53	34
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819420435	FE	On-Demand	Anodyne	ADRB2	35	41
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819420435	FE	On-Demand	Anodyne	ADRB1	53	34
CCOc1ccc(OC[C@@H](O)CNc2ccc(C)cc2OC)cc1	ZINC000819420436	EG	On-Demand	Anodyne	ADRB2	39	48
CCOc1ccc(OC[C@@H](O)CNc2ccc(C)cc2OC)cc1	ZINC000819420436	EG	On-Demand	Anodyne	ADRB1	42	42
CCOc1ccc(OC[C@H](O)CNc2ccc(C)cc2OC)cc1	ZINC000819420437	EG	On-Demand	Anodyne	ADRB2	39	48
CCOc1ccc(OC[C@H](O)CNc2ccc(C)cc2OC)cc1	ZINC000819420437	EG	On-Demand	Anodyne	ADRB1	42	42
COCCc1ccc(OC[C@@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420438	FG	On-Demand	Anodyne	ADRB2	41	59
COCCc1ccc(OC[C@@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420438	FG	On-Demand	Anodyne	ADRB1	62	59
COCCc1ccc(OC[C@@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420438	FG	On-Demand	Anodyne	GRIN1	25	45
COCCc1ccc(OC[C@@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420438	FG	On-Demand	Anodyne	ADRB3	42	46
COCCc1ccc(OC[C@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420439	FG	On-Demand	Anodyne	ADRB2	41	59
COCCc1ccc(OC[C@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420439	FG	On-Demand	Anodyne	ADRB1	62	59
COCCc1ccc(OC[C@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420439	FG	On-Demand	Anodyne	GRIN1	25	45
COCCc1ccc(OC[C@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420439	FG	On-Demand	Anodyne	ADRB3	42	46
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cccc(C)c1	ZINC000819420457	FF	On-Demand	Anodyne	ADRB2	28	52
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cccc(C)c1	ZINC000819420457	FF	On-Demand	Anodyne	ADRB1	25	52
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819420458	FF	On-Demand	Anodyne	ADRB2	28	52
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819420458	FF	On-Demand	Anodyne	ADRB1	25	52
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819420459	FG	On-Demand	Anodyne	ADRB3	20	45
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819420459	FG	On-Demand	Anodyne	CPT1A	43	30
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819420460	FG	On-Demand	Anodyne	ADRB3	20	45
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819420460	FG	On-Demand	Anodyne	CPT1A	43	30
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819420461	GE	On-Demand	Anodyne	ADRB2	27	42
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819420462	GE	On-Demand	Anodyne	ADRB2	27	42
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1ccccc1Cl	ZINC000819420465	EG	On-Demand	Anodyne	CPT1A	44	31
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1F	ZINC000819420491	FE	On-Demand	Anodyne	ADRB2	25	41
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1F	ZINC000819420491	FE	On-Demand	Anodyne	ADRB1	61	40
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1F	ZINC000819420492	FE	On-Demand	Anodyne	ADRB2	25	41
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1F	ZINC000819420492	FE	On-Demand	Anodyne	ADRB1	61	40
COc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819420509	GE	On-Demand	Bother	ADRB1	18	40
COc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819420510	GE	On-Demand	Bother	ADRB1	18	40
COc1cc(C)ccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819420512	EG	On-Demand	Anodyne	ADRB2	34	45
COc1cc(C)ccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819420512	EG	On-Demand	Anodyne	ADRB1	44	40
COc1cc(C)ccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819420512	EG	On-Demand	Anodyne	ABCB1	16	48
COc1cc(C)ccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819420513	EG	On-Demand	Anodyne	ADRB2	34	45
COc1cc(C)ccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819420513	EG	On-Demand	Anodyne	ADRB1	44	40
COc1cc(C)ccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819420513	EG	On-Demand	Anodyne	ABCB1	16	48
CC[C@H](O)CNc1cccc(COc2ccccc2)c1	ZINC000819420549	CG	On-Demand	Anodyne	ADRB2	22	40
CC[C@H](O)CNc1cccc(COc2ccccc2)c1	ZINC000819420549	CG	On-Demand	Anodyne	MAOB	35	42
CC[C@H](O)CNc1cccc(COc2ccccc2)c1	ZINC000819420549	CG	On-Demand	Anodyne	ACE2	28	41
CC[C@H](O)CNc1cccc(COc2ccccc2)c1	ZINC000819420549	CG	On-Demand	Anodyne	FFAR1	44	41
CC[C@H](O)CNc1cccc(COc2ccccc2)c1	ZINC000819420549	CG	On-Demand	Anodyne	PDS	93	40
O=S1(=O)CCC(O)(CNc2cccc(COc3ccccc3)c2)CC1	ZINC000819420560	FF	On-Demand	Anodyne	FFAR1	30	42
C/C=C\c1ccc(OC[C@H](O)CNc2cc(F)c(OC)c(F)c2)c(OC)c1	ZINC000819420589	GH	On-Demand	Anodyne	TUBB1	56	38
C/C=C/c1ccc(OC[C@H](O)CNc2cc(F)c(OC)c(F)c2)c(OC)c1	ZINC000819420590	GH	On-Demand	Anodyne	TUBB1	56	38
C/C=C/c1ccc(OC[C@@H](O)CNc2cc(F)c(OC)c(F)c2)c(OC)c1	ZINC000819420591	GH	On-Demand	Anodyne	TUBB1	56	38
C/C=C\c1ccc(OC[C@@H](O)CNc2cc(F)c(OC)c(F)c2)c(OC)c1	ZINC000819420592	GH	On-Demand	Anodyne	TUBB1	56	38
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1cccc2c1OCCO2	ZINC000819420627	EE	On-Demand	Bother	ADRB1	42	33
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1cccc2c1OCCO2	ZINC000819420628	EE	On-Demand	Bother	ADRB1	42	33
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420629	FE	On-Demand	Anodyne	ADRB2	40	53
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420629	FE	On-Demand	Anodyne	ADRB1	72	53
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420629	FE	On-Demand	Anodyne	ADRB3	43	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420630	FE	On-Demand	Anodyne	ADRB2	40	53
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420630	FE	On-Demand	Anodyne	ADRB1	72	53
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420630	FE	On-Demand	Anodyne	ADRB3	43	48
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420641	FE	On-Demand	Anodyne	ADRB2	40	44
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420641	FE	On-Demand	Anodyne	ADRB1	61	43
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420641	FE	On-Demand	Anodyne	ADRB3	34	43
COC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420642	FE	On-Demand	Anodyne	ADRB2	40	44
COC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420642	FE	On-Demand	Anodyne	ADRB1	61	43
COC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420642	FE	On-Demand	Anodyne	ADRB3	34	43
CCCOc1ccc(NC[C@H](O)c2cccnc2)c(C)c1	ZINC000819420653	CG	On-Demand	Anodyne	ADRB2	18	49
CCCOc1ccc(NC[C@H](O)c2cccnc2)c(C)c1	ZINC000819420653	CG	On-Demand	Anodyne	ADRB1	26	49
CCCOc1ccc(NC[C@H](O)c2cccnc2)c(C)c1	ZINC000819420653	CG	On-Demand	Anodyne	ADRB3	61	49
CCCOc1ccc(NC[C@@H](O)c2cccnc2)c(C)c1	ZINC000819420654	CG	On-Demand	Anodyne	ADRB2	18	49
CCCOc1ccc(NC[C@@H](O)c2cccnc2)c(C)c1	ZINC000819420654	CG	On-Demand	Anodyne	ADRB1	26	49
CCCOc1ccc(NC[C@@H](O)c2cccnc2)c(C)c1	ZINC000819420654	CG	On-Demand	Anodyne	ADRB3	61	49
O[C@@H](CNc1cccc(COc2ccccc2)c1)C(F)(F)F	ZINC000819420663	DH	On-Demand	Anodyne	FFAR1	32	42
O[C@@H](CNc1cccc(COc2ccccc2)c1)C(F)(F)F	ZINC000819420663	DH	On-Demand	Anodyne	PDS	64	37
O[C@H](CNc1cccc(COc2ccccc2)c1)C(F)(F)F	ZINC000819420664	DH	On-Demand	Anodyne	FFAR1	32	42
O[C@H](CNc1cccc(COc2ccccc2)c1)C(F)(F)F	ZINC000819420664	DH	On-Demand	Anodyne	PDS	64	37
O[C@H](CNc1cccc2c1OCCO2)COc1ccccc1	ZINC000819420672	DE	On-Demand	Anodyne	ADRB2	39	48
O[C@H](CNc1cccc2c1OCCO2)COc1ccccc1	ZINC000819420672	DE	On-Demand	Anodyne	ADRB1	53	41
O[C@H](CNc1cccc2c1OCCO2)COc1ccccc1	ZINC000819420672	DE	On-Demand	Anodyne	ADRB3	34	41
O[C@@H](CNc1cccc2c1OCCO2)COc1ccccc1	ZINC000819420673	DE	On-Demand	Anodyne	ADRB2	39	48
O[C@@H](CNc1cccc2c1OCCO2)COc1ccccc1	ZINC000819420673	DE	On-Demand	Anodyne	ADRB1	53	41
O[C@@H](CNc1cccc2c1OCCO2)COc1ccccc1	ZINC000819420673	DE	On-Demand	Anodyne	ADRB3	34	41
O[C@H](CNc1cccc2c1OCCO2)COc1cccc(C(F)(F)F)c1	ZINC000819420692	FG	On-Demand	Anodyne	PDS	44	39
O[C@@H](CNc1cccc2c1OCCO2)COc1cccc(C(F)(F)F)c1	ZINC000819420693	FG	On-Demand	Anodyne	PDS	44	39
CN(C[C@@H](O)CNc1cccc(COc2ccccc2)c1)C1CC1	ZINC000819420694	EG	On-Demand	Anodyne	GYS1	40	32
CN(C[C@@H](O)CNc1cccc(COc2ccccc2)c1)C1CC1	ZINC000819420694	EG	On-Demand	Anodyne	PDS	44	33
CN(C[C@H](O)CNc1cccc(COc2ccccc2)c1)C1CC1	ZINC000819420695	EG	On-Demand	Anodyne	GYS1	40	32
CN(C[C@H](O)CNc1cccc(COc2ccccc2)c1)C1CC1	ZINC000819420695	EG	On-Demand	Anodyne	PDS	44	33
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1ccccc1	ZINC000819420703	EF	On-Demand	Anodyne	ADRB2	15	57
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1ccccc1	ZINC000819420703	EF	On-Demand	Anodyne	ADRB3	33	43
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1ccccc1	ZINC000819420703	EF	On-Demand	Anodyne	CASR	48	39
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1ccccc1	ZINC000819420703	EF	On-Demand	Anodyne	SIGMAR1	24	43
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1ccccc1	ZINC000819420704	EF	On-Demand	Anodyne	ADRB2	15	57
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1ccccc1	ZINC000819420704	EF	On-Demand	Anodyne	ADRB3	33	43
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1ccccc1	ZINC000819420704	EF	On-Demand	Anodyne	CASR	48	39
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1ccccc1	ZINC000819420704	EF	On-Demand	Anodyne	SIGMAR1	24	43
CCOC(=O)Nc1ccc(NC(=O)[C@@H]2CCCO[C@@H]2C(C)C)cc1C#N	ZINC000819420718	FH	On-Demand	Mild	PFKFB3	43	33
C[C@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1C(=O)c1coc(=O)c2ccccc12	ZINC000819420743	GG	On-Demand	Anodyne	INHA	78	37
C[C@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1C(=O)c1coc(=O)c2ccccc12	ZINC000819420743	GG	On-Demand	Anodyne	ACACB	15	42
COCCCOc1ccccc1NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819420770	EG	On-Demand	Mild	CTRB_BOVIN	49	34
COCCCOc1ccccc1NC[C@H](O)c1ccc(C#N)cc1	ZINC000819420771	EG	On-Demand	Mild	CTRB_BOVIN	49	34
CCOC(=O)N(C)c1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819420780	EI	On-Demand	Anodyne	ADRB1	28	50
CCOC(=O)N(C)c1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819420780	EI	On-Demand	Anodyne	ADRB3	42	44
CCOC(=O)N(C)c1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819420780	EI	On-Demand	Anodyne	CYP3A4	42	34
CCOC(=O)N(C)c1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819420781	EI	On-Demand	Anodyne	ADRB1	28	50
CCOC(=O)N(C)c1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819420781	EI	On-Demand	Anodyne	ADRB3	42	44
CCOC(=O)N(C)c1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819420781	EI	On-Demand	Anodyne	CYP3A4	42	34
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819420793	GH	On-Demand	Anodyne	ADRB2	18	54
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819420793	GH	On-Demand	Anodyne	ADRB1	26	54
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819420794	GH	On-Demand	Anodyne	ADRB2	18	54
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819420794	GH	On-Demand	Anodyne	ADRB1	26	54
COCCCOc1ccccc1NC[C@H](O)CN1CCOCC1	ZINC000819420799	DD	On-Demand	Clean	ABCB1	45	40
COCCCOc1ccccc1NC[C@@H](O)CN1CCOCC1	ZINC000819420800	DD	On-Demand	Clean	ABCB1	45	40
COCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1Cl	ZINC000819420835	EG	On-Demand	Anodyne	ERBB2	17	40
COCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1Cl	ZINC000819420837	EG	On-Demand	Anodyne	ERBB2	17	40
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420847	FE	On-Demand	Anodyne	ADRB2	37	54
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420847	FE	On-Demand	Anodyne	ADRB1	60	54
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420847	FE	On-Demand	Anodyne	ADRB3	38	42
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420848	FE	On-Demand	Anodyne	ADRB2	37	54
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420848	FE	On-Demand	Anodyne	ADRB1	60	54
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420848	FE	On-Demand	Anodyne	ADRB3	38	42
CCOc1ccc(OC[C@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420856	FG	On-Demand	Anodyne	ADRB2	35	41
CCOc1ccc(OC[C@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420856	FG	On-Demand	Anodyne	ADRB1	41	41
CCOc1ccc(OC[C@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420856	FG	On-Demand	Anodyne	GRIN1	16	42
CCOc1ccc(OC[C@@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420857	FG	On-Demand	Anodyne	ADRB2	35	41
CCOc1ccc(OC[C@@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420857	FG	On-Demand	Anodyne	ADRB1	41	41
CCOc1ccc(OC[C@@H](O)CNc2cc(F)c(OC)c(F)c2)cc1	ZINC000819420857	FG	On-Demand	Anodyne	GRIN1	16	42
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1ccccc1Cl	ZINC000819420870	FG	On-Demand	Anodyne	SIGMAR1	17	48
OC1(CNc2cccc(COc3ccccc3)c2)CCC1	ZINC000819420874	CH	On-Demand	Anodyne	MAOB	29	44
OC1(CNc2cccc(COc3ccccc3)c2)CCC1	ZINC000819420874	CH	On-Demand	Anodyne	LTA4H	17	40
OC1(CNc2cccc(COc3ccccc3)c2)CCC1	ZINC000819420874	CH	On-Demand	Anodyne	FFAR1	35	40
CON(C)C(=O)CCNc1ccc(CCN2CCOCC2)cc1	ZINC000819420877	DD	On-Demand	Anodyne	EPHX2	19	40
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc3c2OCCO3)c1	ZINC000819420922	EF	On-Demand	Anodyne	ADRB2	18	42
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc3c2OCCO3)c1	ZINC000819420922	EF	On-Demand	Anodyne	ABCB1	16	46
CC(=O)c1cccc(OC[C@H](O)CNc2cccc3c2OCCO3)c1	ZINC000819420923	EF	On-Demand	Anodyne	ADRB2	18	42
CC(=O)c1cccc(OC[C@H](O)CNc2cccc3c2OCCO3)c1	ZINC000819420923	EF	On-Demand	Anodyne	ABCB1	16	46
O[C@H](CNc1cccc(COc2ccccc2)c1)CC(F)(F)F	ZINC000819420930	EH	On-Demand	Anodyne	PDS	50	35
O[C@@H](CNc1cccc(COc2ccccc2)c1)CC(F)(F)F	ZINC000819420931	EH	On-Demand	Anodyne	PDS	50	35
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420932	FF	On-Demand	Anodyne	ADRB2	42	42
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420932	FF	On-Demand	Anodyne	ADRB1	68	44
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420932	FF	On-Demand	Anodyne	ADRB3	46	42
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420932	FF	On-Demand	Anodyne	ABCB1	28	40
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420933	FF	On-Demand	Anodyne	ADRB2	42	42
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420933	FF	On-Demand	Anodyne	ADRB1	68	44
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420933	FF	On-Demand	Anodyne	ADRB3	46	42
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420933	FF	On-Demand	Anodyne	ABCB1	28	40
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1cc2ccccc2o1	ZINC000819420934	FG	On-Demand	Anodyne	SIGMAR1	17	46
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420952	EF	On-Demand	Anodyne	ADRB2	30	42
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420952	EF	On-Demand	Anodyne	ADRB1	49	38
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420952	EF	On-Demand	Anodyne	ABCB1	15	50
CC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420954	EF	On-Demand	Anodyne	ADRB2	30	42
CC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420954	EF	On-Demand	Anodyne	ADRB1	49	38
CC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCCO3)cc1	ZINC000819420954	EF	On-Demand	Anodyne	ABCB1	15	50
CCCOc1ccc(NCCC(N)=O)c(C)c1	ZINC000819420962	BE	On-Demand	Anodyne	PLA2G4B	46	32
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc2ccccc12	ZINC000819420967	GH	On-Demand	Anodyne	ADCY5	17	40
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc2ccccc12	ZINC000819420967	GH	On-Demand	Anodyne	PTGDS	37	40
O[C@H](CNc1cccc2c1OCCO2)COc1ccc(F)cc1	ZINC000819420968	DE	On-Demand	Anodyne	ADRB1	45	38
O[C@@H](CNc1cccc2c1OCCO2)COc1ccc(F)cc1	ZINC000819420970	DE	On-Demand	Anodyne	ADRB1	45	38
CCCOc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819421038	EH	On-Demand	Bother	CACNA1C	40	34
CCCOc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819421038	EH	On-Demand	Bother	CACNA1D	61	34
CCCOc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819421040	EH	On-Demand	Bother	CACNA1C	40	34
CCCOc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819421040	EH	On-Demand	Bother	CACNA1D	61	34
CCOC(=O)N(C)c1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819421096	DG	On-Demand	Anodyne	AOC3	19	40
CCOC(=O)N(C)c1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819421097	DG	On-Demand	Anodyne	AOC3	19	40
COCCOc1ccc(NC[C@H](O)c2cccnc2)cc1Cl	ZINC000819421098	DF	On-Demand	Anodyne	ADRB1	28	42
COCCOc1ccc(NC[C@H](O)c2cccnc2)cc1Cl	ZINC000819421098	DF	On-Demand	Anodyne	ADRB3	83	46
COCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1Cl	ZINC000819421099	DF	On-Demand	Anodyne	ADRB1	28	42
COCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1Cl	ZINC000819421099	DF	On-Demand	Anodyne	ADRB3	83	46
COCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1Cl	ZINC000819421107	FI	On-Demand	Anodyne	ADRB2	17	48
COCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1Cl	ZINC000819421107	FI	On-Demand	Anodyne	ADRB1	35	49
COCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1Cl	ZINC000819421107	FI	On-Demand	Anodyne	ADRB3	53	49
COCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1Cl	ZINC000819421107	FI	On-Demand	Anodyne	CYP3A4	43	38
COCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1Cl	ZINC000819421108	FI	On-Demand	Anodyne	ADRB2	17	48
COCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1Cl	ZINC000819421108	FI	On-Demand	Anodyne	ADRB1	35	49
COCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1Cl	ZINC000819421108	FI	On-Demand	Anodyne	ADRB3	53	49
COCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1Cl	ZINC000819421108	FI	On-Demand	Anodyne	CYP3A4	43	38
CON(C)C(=O)CCNc1ccc(NC(=O)c2ccco2)c(Cl)c1	ZINC000819421109	FG	On-Demand	Anodyne	GRM4	19	49
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1cccc(F)c1	ZINC000819421110	EH	On-Demand	Anodyne	SIGMAR1	16	40
O[C@H](CNc1ccc(CCN2CCCCC2)cc1)c1cccc(F)c1	ZINC000819421111	EH	On-Demand	Anodyne	SIGMAR1	16	40
COCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1Cl	ZINC000819421112	FH	On-Demand	Anodyne	EGFR	45	45
COCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1Cl	ZINC000819421112	FH	On-Demand	Anodyne	ERBB2	61	45
COCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1Cl	ZINC000819421112	FH	On-Demand	Anodyne	GRM4	28	42
COCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1Cl	ZINC000819421112	FH	On-Demand	Anodyne	AURKA	21	42
COCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1Cl	ZINC000819421112	FH	On-Demand	Anodyne	KCNK3	41	35
N#Cc1ccc([C@H](O)CNc2ccc(CCN3CCCCC3)cc2)cc1	ZINC000819421113	EH	On-Demand	Mild	HRH3	17	47
N#Cc1ccc([C@H](O)CNc2ccc(CCN3CCCCC3)cc2)cc1	ZINC000819421113	EH	On-Demand	Mild	KCNJ1	24	53
N#Cc1ccc([C@@H](O)CNc2ccc(CCN3CCCCC3)cc2)cc1	ZINC000819421114	EH	On-Demand	Mild	HRH3	17	47
N#Cc1ccc([C@@H](O)CNc2ccc(CCN3CCCCC3)cc2)cc1	ZINC000819421114	EH	On-Demand	Mild	KCNJ1	24	53
O=C(/C=C/[C@H]1CCCO1)N1CCN(c2ccc(C(F)(F)F)cc2)CC1	ZINC000819421115	FG	On-Demand	Anodyne	ITGAL	75	34
O=C(/C=C\[C@@H]1CCCO1)N1CCN(c2ccc(C(F)(F)F)cc2)CC1	ZINC000819421116	FG	On-Demand	Anodyne	ITGAL	75	34
O=C(/C=C/[C@@H]1CCCO1)N1CCN(c2ccc(C(F)(F)F)cc2)CC1	ZINC000819421117	FG	On-Demand	Anodyne	ITGAL	75	34
O=C(/C=C\[C@H]1CCCO1)N1CCN(c2ccc(C(F)(F)F)cc2)CC1	ZINC000819421118	FG	On-Demand	Anodyne	ITGAL	75	34
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1ccc(F)cc1	ZINC000819421121	EF	On-Demand	Anodyne	SLC6A3	22	41
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1ccc(F)cc1	ZINC000819421122	EF	On-Demand	Anodyne	SLC6A3	22	41
COCCOc1ccc(NCCC(N)=O)cc1Cl	ZINC000819421123	CD	On-Demand	Anodyne	DRTS_TRYCR	51	39
COCCCOc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819421131	DF	On-Demand	Anodyne	ADRB2	17	41
COCCCOc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819421131	DF	On-Demand	Anodyne	ADRB1	20	43
COCCCOc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819421131	DF	On-Demand	Anodyne	ADRB3	64	43
COCCCOc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819421132	DF	On-Demand	Anodyne	ADRB2	17	41
COCCCOc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819421132	DF	On-Demand	Anodyne	ADRB1	20	43
COCCCOc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819421132	DF	On-Demand	Anodyne	ADRB3	64	43
COCCOc1ccc(NC[C@H](O)COc2ccccc2F)cc1Cl	ZINC000819421150	FG	On-Demand	Anodyne	EGFR	20	40
COCCOc1ccc(NC[C@H](O)COc2ccccc2F)cc1Cl	ZINC000819421150	FG	On-Demand	Anodyne	ADRB2	23	41
COCCOc1ccc(NC[C@H](O)COc2ccccc2F)cc1Cl	ZINC000819421150	FG	On-Demand	Anodyne	ADRB1	56	34
COCCOc1ccc(NC[C@@H](O)COc2ccccc2F)cc1Cl	ZINC000819421151	FG	On-Demand	Anodyne	EGFR	20	40
COCCOc1ccc(NC[C@@H](O)COc2ccccc2F)cc1Cl	ZINC000819421151	FG	On-Demand	Anodyne	ADRB2	23	41
COCCOc1ccc(NC[C@@H](O)COc2ccccc2F)cc1Cl	ZINC000819421151	FG	On-Demand	Anodyne	ADRB1	56	34
O=[N+]([O-])c1ccc([C@@H](O)CNc2ccc(CCN3CCCCC3)cc2)cc1	ZINC000819421167	FH	On-Demand	Bother	KCNJ1	38	55
O=[N+]([O-])c1ccc([C@H](O)CNc2ccc(CCN3CCCCC3)cc2)cc1	ZINC000819421168	FH	On-Demand	Bother	KCNJ1	38	55
CCOC(=O)N(C)c1ccc(NC[C@H](O)C2CCCCC2)cc1	ZINC000819421172	DH	On-Demand	Anodyne	AMY2	47	32
CCOC(=O)N(C)c1ccc(NC[C@@H](O)C2CCCCC2)cc1	ZINC000819421173	DH	On-Demand	Anodyne	AMY2	47	32
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1	ZINC000819421177	DH	On-Demand	Anodyne	ADRB2	21	60
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1	ZINC000819421177	DH	On-Demand	Anodyne	ADRB1	17	47
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1	ZINC000819421177	DH	On-Demand	Anodyne	SLC6A3	18	42
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1	ZINC000819421177	DH	On-Demand	Anodyne	ADRB3	51	44
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1	ZINC000819421177	DH	On-Demand	Anodyne	LTA4H	23	43
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1	ZINC000819421177	DH	On-Demand	Anodyne	HRH3	26	48
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1	ZINC000819421177	DH	On-Demand	Anodyne	SIGMAR1	30	55
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1	ZINC000819421177	DH	On-Demand	Anodyne	HNMT	66	34
O[C@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1	ZINC000819421178	DH	On-Demand	Anodyne	ADRB2	21	60
O[C@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1	ZINC000819421178	DH	On-Demand	Anodyne	ADRB1	17	47
O[C@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1	ZINC000819421178	DH	On-Demand	Anodyne	SLC6A3	18	42
O[C@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1	ZINC000819421178	DH	On-Demand	Anodyne	ADRB3	51	44
O[C@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1	ZINC000819421178	DH	On-Demand	Anodyne	LTA4H	23	43
O[C@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1	ZINC000819421178	DH	On-Demand	Anodyne	HRH3	26	48
O[C@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1	ZINC000819421178	DH	On-Demand	Anodyne	SIGMAR1	30	55
O[C@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1	ZINC000819421178	DH	On-Demand	Anodyne	HNMT	66	34
COCCCOc1ccccc1NCC1(O)CCCC1	ZINC000819421185	CF	On-Demand	Anodyne	HCN1	53	32
COCCCOc1ccccc1NCC1(O)CCCC1	ZINC000819421185	CF	On-Demand	Anodyne	HCN4	50	32
CC(C)c1nn(-c2ccccc2)cc1C(=O)NCC1([C@H](O)c2ccccc2)CC1	ZINC000819421200	GI	On-Demand	Anodyne	HCN1	62	36
CC(C)c1nn(-c2ccccc2)cc1C(=O)NCC1([C@@H](O)c2ccccc2)CC1	ZINC000819421201	GI	On-Demand	Anodyne	HCN1	62	36
COCCOc1ccc(NC[C@H](O)COc2ccccc2)cc1Cl	ZINC000819421202	FG	On-Demand	Anodyne	ADRB2	51	45
COCCOc1ccc(NC[C@H](O)COc2ccccc2)cc1Cl	ZINC000819421202	FG	On-Demand	Anodyne	ADRB1	71	41
COCCOc1ccc(NC[C@H](O)COc2ccccc2)cc1Cl	ZINC000819421202	FG	On-Demand	Anodyne	ADRB3	41	41
COCCOc1ccc(NC[C@H](O)COc2ccccc2)cc1Cl	ZINC000819421202	FG	On-Demand	Anodyne	PDS	60	35
COCCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1Cl	ZINC000819421203	FG	On-Demand	Anodyne	ADRB2	51	45
COCCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1Cl	ZINC000819421203	FG	On-Demand	Anodyne	ADRB1	71	41
COCCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1Cl	ZINC000819421203	FG	On-Demand	Anodyne	ADRB3	41	41
COCCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1Cl	ZINC000819421203	FG	On-Demand	Anodyne	PDS	60	35
COCCOc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1Cl	ZINC000819421211	FH	On-Demand	Anodyne	ADRB2	33	46
COCCOc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1Cl	ZINC000819421211	FH	On-Demand	Anodyne	ADRB1	50	41
COCCOc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1Cl	ZINC000819421212	FH	On-Demand	Anodyne	ADRB2	33	46
COCCOc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1Cl	ZINC000819421212	FH	On-Demand	Anodyne	ADRB1	50	41
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1F	ZINC000819421225	EH	On-Demand	Anodyne	HRH3	15	43
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1F	ZINC000819421225	EH	On-Demand	Anodyne	SIGMAR1	19	41
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1F	ZINC000819421225	EH	On-Demand	Anodyne	CHRNA7	15	40
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccccc1F	ZINC000819421225	EH	On-Demand	Anodyne	HNMT	58	32
COCCOc1ccc(NC[C@H](O)c2ccccc2Cl)cc1Cl	ZINC000819421227	FI	On-Demand	Anodyne	GRM4	15	40
CON(C)C(=O)CCNc1ccc(CCN2CCCCC2)cc1	ZINC000819421234	DF	On-Demand	Anodyne	HRH3	28	45
O=C(Nc1ccc(NC[C@H](O)C2CC2)cc1)c1ccc(Cl)cc1	ZINC000819421262	EH	On-Demand	Anodyne	F10	17	44
O=C(Nc1ccc(NC[C@H](O)C2CC2)cc1)c1ccc(Cl)cc1	ZINC000819421262	EH	On-Demand	Anodyne	PRNP	52	42
O=C(Nc1ccc(NC[C@H](O)C2CC2)cc1)c1ccc(Cl)cc1	ZINC000819421262	EH	On-Demand	Anodyne	NOD1	15	44
O=C(Nc1ccc(NC[C@@H](O)C2CC2)cc1)c1ccc(Cl)cc1	ZINC000819421263	EH	On-Demand	Anodyne	F10	17	44
O=C(Nc1ccc(NC[C@@H](O)C2CC2)cc1)c1ccc(Cl)cc1	ZINC000819421263	EH	On-Demand	Anodyne	PRNP	52	42
O=C(Nc1ccc(NC[C@@H](O)C2CC2)cc1)c1ccc(Cl)cc1	ZINC000819421263	EH	On-Demand	Anodyne	NOD1	15	44
COCCCOc1ccccc1NC[C@@H](O)COC	ZINC000819421278	CD	On-Demand	Clean	ADRB2	28	43
COCCCOc1ccccc1NC[C@H](O)COC	ZINC000819421279	CD	On-Demand	Clean	ADRB2	28	43
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819421280	GG	On-Demand	Bother	ADRB2	18	45
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819421280	GG	On-Demand	Bother	ADRB1	43	33
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819421281	GG	On-Demand	Bother	ADRB2	18	45
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819421281	GG	On-Demand	Bother	ADRB1	43	33
COCCCOc1ccccc1NCC1(O)CCS(=O)(=O)CC1	ZINC000819421282	ED	On-Demand	Anodyne	HCN1	52	33
COCCCOc1ccccc1NCC1(O)CCS(=O)(=O)CC1	ZINC000819421282	ED	On-Demand	Anodyne	HCN4	47	31
COc1ccc(-c2cnc(NC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)n2C)cc1	ZINC000819421294	GG	On-Demand	Bother	LUCI_LUCLA	15	40
COc1ccc(-c2cnc(NC(=O)c3cccc(N4CCOC4=O)c3)n2C)cc1	ZINC000819421309	GG	On-Demand	Anodyne	DRD4	41	33
COc1ccc(-c2cnc(NC(=O)[C@@H]3CC(c4ccccc4)=NO3)n2C)cc1	ZINC000819421313	GG	On-Demand	Anodyne	LUCI_PHOPY	44	43
COc1ccc(-c2cnc(NC(=O)[C@H]3CC(c4ccccc4)=NO3)n2C)cc1	ZINC000819421314	GG	On-Demand	Anodyne	LUCI_PHOPY	44	43
COc1ccc(-c2cnc(NC(=O)/C=C/c3cccc(O)c3)n2C)cc1	ZINC000819421321	EG	On-Demand	Anodyne	HDAC8	47	44
COc1ccc(-c2cnc(NC(=O)/C=C/c3cccc(O)c3)n2C)cc1	ZINC000819421321	EG	On-Demand	Anodyne	HDAC1	18	43
COc1ccc(-c2cnc(NC(=O)/C=C/c3cccc(O)c3)n2C)cc1	ZINC000819421321	EG	On-Demand	Anodyne	HDAC6	29	44
COc1ccc(-c2cnc(NC(=O)/C=C\c3cccc(O)c3)n2C)cc1	ZINC000819421322	EG	On-Demand	Anodyne	HDAC8	47	44
COc1ccc(-c2cnc(NC(=O)/C=C\c3cccc(O)c3)n2C)cc1	ZINC000819421322	EG	On-Demand	Anodyne	HDAC1	18	43
COc1ccc(-c2cnc(NC(=O)/C=C\c3cccc(O)c3)n2C)cc1	ZINC000819421322	EG	On-Demand	Anodyne	HDAC6	29	44
COc1ccc(-c2cnc(NC(=O)COc3ccc(C=O)cc3OC)n2C)cc1	ZINC000819421326	GF	On-Demand	Anodyne	ENPP1	46	32
COc1ccc(-c2cnc(NC(=O)COCc3ccccn3)n2C)cc1	ZINC000819421330	FF	On-Demand	Anodyne	SMO	19	41
COc1ccc(-c2cnc(NC(=O)c3ccc(C)cn3)n2C)cc1	ZINC000819421331	DG	On-Demand	Anodyne	SCN10A	47	35
COc1ccc(-c2cnc(NC(=O)c3ccc(C)cn3)n2C)cc1	ZINC000819421331	DG	On-Demand	Anodyne	LUCI_LUCLA	18	42
COc1ccc(-c2cnc(NC(=O)/C=C\c3ccccc3)n2C)cc1	ZINC000819421334	EH	On-Demand	Anodyne	HDAC8	54	50
COc1ccc(-c2cnc(NC(=O)/C=C\c3ccccc3)n2C)cc1	ZINC000819421334	EH	On-Demand	Anodyne	MMP2	19	59
COc1ccc(-c2cnc(NC(=O)/C=C\c3ccccc3)n2C)cc1	ZINC000819421334	EH	On-Demand	Anodyne	HDAC1	27	44
COc1ccc(-c2cnc(NC(=O)/C=C\c3ccccc3)n2C)cc1	ZINC000819421334	EH	On-Demand	Anodyne	HDAC2	15	40
COc1ccc(-c2cnc(NC(=O)/C=C\c3ccccc3)n2C)cc1	ZINC000819421334	EH	On-Demand	Anodyne	HDAC6	38	50
COc1ccc(-c2cnc(NC(=O)/C=C\c3ccccc3)n2C)cc1	ZINC000819421334	EH	On-Demand	Anodyne	MMP9	17	59
COc1ccc(-c2cnc(NC(=O)/C=C/c3ccccc3)n2C)cc1	ZINC000819421335	EH	On-Demand	Anodyne	HDAC8	54	50
COc1ccc(-c2cnc(NC(=O)/C=C/c3ccccc3)n2C)cc1	ZINC000819421335	EH	On-Demand	Anodyne	MMP2	19	59
COc1ccc(-c2cnc(NC(=O)/C=C/c3ccccc3)n2C)cc1	ZINC000819421335	EH	On-Demand	Anodyne	HDAC1	27	44
COc1ccc(-c2cnc(NC(=O)/C=C/c3ccccc3)n2C)cc1	ZINC000819421335	EH	On-Demand	Anodyne	HDAC2	15	40
COc1ccc(-c2cnc(NC(=O)/C=C/c3ccccc3)n2C)cc1	ZINC000819421335	EH	On-Demand	Anodyne	HDAC6	38	50
COc1ccc(-c2cnc(NC(=O)/C=C/c3ccccc3)n2C)cc1	ZINC000819421335	EH	On-Demand	Anodyne	MMP9	17	59
COc1ccc(-c2cnc(NC(=O)c3cc(Cl)ncc3Cl)n2C)cc1	ZINC000819421339	GI	On-Demand	Anodyne	PDK1	43	33
COc1ccc(-c2cnc(NC(=O)c3c(C)nn(-c4ccccc4)c3Cl)n2C)cc1	ZINC000819421343	HI	On-Demand	Anodyne	RPA1	26	41
COc1ccc(-c2cnc(NC(=O)CCCCCCC(C)=O)n2C)cc1	ZINC000819421346	FH	On-Demand	Anodyne	HDAC8	19	43
COc1ccc(-c2cnc(NC(=O)CCCCCCC(C)=O)n2C)cc1	ZINC000819421346	FH	On-Demand	Anodyne	HDAC1	27	46
COc1ccc(-c2cnc(NC(=O)C(O)(c3ccccc3)c3ccccc3)n2C)cc1	ZINC000819421347	HH	On-Demand	Anodyne	LUCI_LUCLA	16	41
COc1ccc(-c2cnc(NC(=O)CN3C(=O)c4ccccc4S3(=O)=O)n2C)cc1	ZINC000819421348	ID	On-Demand	Anodyne	ELANE	41	35
COc1ccc(-c2cnc(NC(=O)c3cc(Cl)nc(N4CCCC4)c3)n2C)cc1	ZINC000819421349	HH	On-Demand	Anodyne	GALR2	41	32
COc1ccc(-c2cnc(NC(=O)c3cc(Cl)nc(N4CCCC4)c3)n2C)cc1	ZINC000819421349	HH	On-Demand	Anodyne	PDK1	42	31
COc1ccc(-c2cnc(NC(=O)CCCCN3CCCC3)n2C)cc1	ZINC000819421351	FG	On-Demand	Anodyne	HTR1A	16	45
COc1ccc(-c2cnc(NC(=O)CCCCN3CCCC3)n2C)cc1	ZINC000819421351	FG	On-Demand	Anodyne	AVPR1B	47	40
COc1ccc(-c2cnc(NC(=O)CCCCN3CCCC3)n2C)cc1	ZINC000819421351	FG	On-Demand	Anodyne	HTR7	35	45
COc1ccc(-c2cnc(NC(=O)CCCCN3CCCC3)n2C)cc1	ZINC000819421351	FG	On-Demand	Anodyne	HRH3	48	41
COc1ccc(-c2cnc(NC(=O)CCCCN3CCCC3)n2C)cc1	ZINC000819421351	FG	On-Demand	Anodyne	CHRNA7	27	63
COc1ccc(-c2cnc(NC(=O)CCCCN3CCCC3)n2C)cc1	ZINC000819421351	FG	On-Demand	Anodyne	EBP	26	40
COc1ccc(-c2cnc(NC(=O)CCCCN3CCCC3)n2C)cc1	ZINC000819421351	FG	On-Demand	Anodyne	MCHR1	18	40
COc1ccc(-c2cnc(NC(=O)c3cn(C)nc3C(F)(F)F)n2C)cc1	ZINC000819421354	GG	On-Demand	Anodyne	ATF1	44	31
COc1ccc(-c2cnc(NC(=O)c3cn(C)nc3C(F)(F)F)n2C)cc1	ZINC000819421354	GG	On-Demand	Anodyne	NFKB1	41	31
CCCCCCCCCNS(=O)(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819421355	EG	On-Demand	Mild	ALOX15	57	41
CCCCCCCCCNS(=O)(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819421355	EG	On-Demand	Mild	ASAH1	48	33
COc1ccc(-c2cnc(NC(=O)/C=C/c3ccc4c(c3)OCO4)n2C)cc1	ZINC000819421356	GG	On-Demand	Anodyne	EDNRB	62	38
COc1ccc(-c2cnc(NC(=O)/C=C/c3ccc4c(c3)OCO4)n2C)cc1	ZINC000819421356	GG	On-Demand	Anodyne	EDNRA	60	36
COc1ccc(-c2cnc(NC(=O)/C=C/c3ccc4c(c3)OCO4)n2C)cc1	ZINC000819421356	GG	On-Demand	Anodyne	DYRK1A	20	44
COc1ccc(-c2cnc(NC(=O)/C=C/c3ccc4c(c3)OCO4)n2C)cc1	ZINC000819421356	GG	On-Demand	Anodyne	CLK1	34	44
COc1ccc(-c2cnc(NC(=O)/C=C/c3ccc4c(c3)OCO4)n2C)cc1	ZINC000819421356	GG	On-Demand	Anodyne	DYRK2	66	44
COc1ccc(-c2cnc(NC(=O)/C=C\c3ccc4c(c3)OCO4)n2C)cc1	ZINC000819421357	GG	On-Demand	Anodyne	EDNRB	62	38
COc1ccc(-c2cnc(NC(=O)/C=C\c3ccc4c(c3)OCO4)n2C)cc1	ZINC000819421357	GG	On-Demand	Anodyne	EDNRA	60	36
COc1ccc(-c2cnc(NC(=O)/C=C\c3ccc4c(c3)OCO4)n2C)cc1	ZINC000819421357	GG	On-Demand	Anodyne	DYRK1A	20	44
COc1ccc(-c2cnc(NC(=O)/C=C\c3ccc4c(c3)OCO4)n2C)cc1	ZINC000819421357	GG	On-Demand	Anodyne	CLK1	34	44
COc1ccc(-c2cnc(NC(=O)/C=C\c3ccc4c(c3)OCO4)n2C)cc1	ZINC000819421357	GG	On-Demand	Anodyne	DYRK2	66	44
COc1ccc(-c2cnc(NC(=O)c3ccc(F)c(S(=O)(=O)N(C)C)c3)n2C)cc1	ZINC000819421366	IF	On-Demand	Anodyne	CPT1A	51	34
COc1ccc(-c2cnc(NC(=O)c3cccc(NS(C)(=O)=O)c3)n2C)cc1	ZINC000819421376	HF	On-Demand	Anodyne	CPT1A	45	32
COc1ccc(-c2cnc(NC(=O)c3cccc(NS(C)(=O)=O)c3)n2C)cc1	ZINC000819421376	HF	On-Demand	Anodyne	LUCI_LUCLA	29	41
COc1ccc(-c2cnc(NC(=O)c3cccc(NS(C)(=O)=O)c3)n2C)cc1	ZINC000819421376	HF	On-Demand	Anodyne	KCNK3	46	39
COc1ccc(-c2cnc(NC(=O)c3csc(C=O)c3)n2C)cc1	ZINC000819421378	EG	On-Demand	Anodyne	LUCI_LUCLA	15	41
COc1ccc(-c2cnc(NC(=O)c3csc(C=O)c3)n2C)cc1	ZINC000819421378	EG	On-Demand	Anodyne	TBK1	21	40
CCOC(=O)N(C)c1ccc(NC[C@@H](O)CC2CCCC2)cc1	ZINC000819421385	DH	On-Demand	Anodyne	AMY2	44	30
COc1ccc(-c2cnc(NC(=O)[C@H]3CCCN3C(=O)C(F)(F)F)n2C)cc1	ZINC000819421386	GF	On-Demand	Anodyne	ELANE	44	43
CCOC(=O)N(C)c1ccc(NC[C@H](O)CC2CCCC2)cc1	ZINC000819421387	DH	On-Demand	Anodyne	AMY2	44	30
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCCN3C(=O)C(F)(F)F)n2C)cc1	ZINC000819421388	GF	On-Demand	Anodyne	ELANE	44	43
CCCCCCCCCNS(=O)(=O)c1ccc2c(c1)CCCN2C(C)=O	ZINC000819421390	GI	On-Demand	Mild	HTR7	20	41
COCCOc1ccc(NCCC(=O)NC(N)=O)cc1Cl	ZINC000819421392	DD	On-Demand	Anodyne	DRTS_TRYCR	40	37
COc1ccc(-c2cnc(NC(=O)C3(CNC(=O)OC(C)(C)C)CCOCC3)n2C)cc1	ZINC000819421395	IG	On-Demand	Anodyne	PROKR1	50	31
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819421409	GH	On-Demand	Anodyne	ADRB2	26	43
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819421409	GH	On-Demand	Anodyne	ADRB1	35	40
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819421410	GH	On-Demand	Anodyne	ADRB2	26	43
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819421410	GH	On-Demand	Anodyne	ADRB1	35	40
COc1ccc(-c2cnc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)n2C)cc1	ZINC000819421413	HH	On-Demand	Bother	WDR5	36	41
COc1ccc(-c2cnc(NC(=O)c3cc(Cl)cs3)n2C)cc1	ZINC000819421416	EI	On-Demand	Anodyne	TBK1	20	41
COCCOc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1Cl	ZINC000819421420	GG	On-Demand	Mild	ADRB1	49	36
COCCOc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1Cl	ZINC000819421421	GG	On-Demand	Mild	ADRB1	49	36
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1ccc(F)cc1F	ZINC000819421425	FF	On-Demand	Anodyne	HTR2A	18	44
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1ccc(F)cc1F	ZINC000819421426	FF	On-Demand	Anodyne	HTR2A	18	44
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(CCN3CCCCC3)cc2)c1	ZINC000819421427	FH	On-Demand	Bother	KCNJ1	30	45
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(CCN3CCCCC3)cc2)c1	ZINC000819421428	FH	On-Demand	Bother	KCNJ1	30	45
CCOC(=O)N(C)c1ccc(NC[C@H](O)Cc2ccc(F)cc2)cc1	ZINC000819421436	EG	On-Demand	Anodyne	NPY5R	15	40
CCOC(=O)N(C)c1ccc(NC[C@@H](O)Cc2ccc(F)cc2)cc1	ZINC000819421437	EG	On-Demand	Anodyne	NPY5R	15	40
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc(C(F)(F)F)c1	ZINC000819421442	GH	On-Demand	Anodyne	CASR	33	46
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc(C(F)(F)F)c1	ZINC000819421442	GH	On-Demand	Anodyne	EPHX2	17	43
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc(C(F)(F)F)c1	ZINC000819421443	GH	On-Demand	Anodyne	CASR	33	46
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc(C(F)(F)F)c1	ZINC000819421443	GH	On-Demand	Anodyne	EPHX2	17	43
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccc(F)cc1	ZINC000819421451	EH	On-Demand	Anodyne	SLC6A3	25	43
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccc(F)cc1	ZINC000819421451	EH	On-Demand	Anodyne	SIGMAR1	15	50
O[C@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccc(F)cc1	ZINC000819421452	EH	On-Demand	Anodyne	SLC6A3	25	43
O[C@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccc(F)cc1	ZINC000819421452	EH	On-Demand	Anodyne	SIGMAR1	15	50
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(CCN2CCCCC2)cc1	ZINC000819421471	GG	On-Demand	Anodyne	HRH3	20	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(CCN2CCCCC2)cc1	ZINC000819421472	GG	On-Demand	Anodyne	HRH3	20	41
COc1ccc(-c2cnc(NC(=O)c3cc(Cl)nc(Cl)c3)n2C)cc1	ZINC000819421491	GI	On-Demand	Anodyne	PDK1	44	35
COc1ccc(-c2cnc(NC(=O)c3cc(Cl)nc(Cl)c3)n2C)cc1	ZINC000819421491	GI	On-Demand	Anodyne	LUCI_LUCLA	31	42
COc1ccc(-c2cnc(NC(=O)COC3CCN(C(=O)OC(C)(C)C)CC3)n2C)cc1	ZINC000819421496	IG	On-Demand	Anodyne	GPR119	46	40
COc1ccc(-c2cnc(NC(=O)COc3ccc4ccc(=O)oc4c3)n2C)cc1	ZINC000819421499	HG	On-Demand	Anodyne	MAOB	18	40
COc1ccc(-c2cnc(NC(=O)c3cccnc3S)n2C)cc1	ZINC000819421508	EG	On-Demand	Anodyne	LUCI_LUCLA	16	41
COc1ccc(-c2cnc(NC(=O)C3CCN(C(=O)c4cccnc4)CC3)n2C)cc1	ZINC000819421510	HF	On-Demand	Anodyne	SLC18A3	16	51
COc1ccc(-c2cnc(NC(=O)c3ccc(C(F)(F)F)nc3Cl)n2C)cc1	ZINC000819421511	HI	On-Demand	Anodyne	ATF1	43	31
COc1ccc(-c2cnc(NC(=O)c3ccc(C(F)(F)F)nc3Cl)n2C)cc1	ZINC000819421511	HI	On-Demand	Anodyne	NFKB1	40	31
COc1ccc(-c2cnc(NC(=O)CC3OCCO3)n2C)cc1	ZINC000819421512	DD	On-Demand	Anodyne	PDK1	43	32
COc1ccc(-c2cnc(NC(=O)CC[C@H]3CCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819421514	II	On-Demand	Anodyne	GPR119	40	39
COc1ccc(-c2cnc(NC(=O)CC[C@@H]3CCN(C(=O)OC(C)(C)C)C3)n2C)cc1	ZINC000819421515	II	On-Demand	Anodyne	GPR119	40	39
COc1ccc(-c2cnc(NC(=O)[C@H]3CC(=O)N(C4CCCC4)C3)n2C)cc1	ZINC000819421521	GF	On-Demand	Anodyne	INHA	22	47
COc1ccc(-c2cnc(NC(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)n2C)cc1	ZINC000819421522	GF	On-Demand	Anodyne	INHA	22	47
COc1ccc(-c2cnc(NC(=O)c3cc(C(F)(F)F)cc(Cl)n3)n2C)cc1	ZINC000819421532	HI	On-Demand	Anodyne	ATF1	45	33
COc1ccc(-c2cnc(NC(=O)c3cc(C(F)(F)F)cc(Cl)n3)n2C)cc1	ZINC000819421532	HI	On-Demand	Anodyne	NFKB1	42	33
COc1ccc(-c2cnc(NC(=O)c3ccc(S(=O)(=O)N4CCCC4)o3)n2C)cc1	ZINC000819421536	IF	On-Demand	Anodyne	LPL	46	44
COc1ccc(-c2cnc(NC(=O)c3ccc(S(=O)(=O)N4CCCC4)o3)n2C)cc1	ZINC000819421536	IF	On-Demand	Anodyne	PDK1	44	35
COc1ccc(-c2cnc(NC(=O)c3ccc(S(=O)(=O)N4CCCC4)o3)n2C)cc1	ZINC000819421536	IF	On-Demand	Anodyne	LIPG	19	44
CCCCCCCCCNS(=O)(=O)c1ccc(C(N)=O)cc1	ZINC000819421537	EF	On-Demand	Mild	CA2	28	55
CCCCCCCCCNS(=O)(=O)c1ccc(C(N)=O)cc1	ZINC000819421537	EF	On-Demand	Mild	CA1	24	41
CCCCCCCCCNS(=O)(=O)c1ccc(C(N)=O)cc1	ZINC000819421537	EF	On-Demand	Mild	CA4	15	40
CCCCCCCCCNS(=O)(=O)c1ccc(C(N)=O)cc1	ZINC000819421537	EF	On-Demand	Mild	ALOX15	64	45
CCCCCCCCCNS(=O)(=O)c1ccc(C(N)=O)cc1	ZINC000819421537	EF	On-Demand	Mild	CA9	19	42
CCCCCCCCCNS(=O)(=O)c1ccc(C(N)=O)cc1	ZINC000819421537	EF	On-Demand	Mild	ASAH1	57	33
COc1ccc(-c2cnc(NC(=O)C#Cc3ccc4c(c3)OCO4)n2C)cc1	ZINC000819421539	GF	On-Demand	Mild	EDNRB	69	36
COc1ccc(-c2cnc(NC(=O)C#Cc3ccc4c(c3)OCO4)n2C)cc1	ZINC000819421539	GF	On-Demand	Mild	EDNRA	67	36
COc1ccc(-c2cnc(NC(=O)C#Cc3ccc4c(c3)OCO4)n2C)cc1	ZINC000819421539	GF	On-Demand	Mild	BMP1	54	36
COc1ccc(-c2cnc(NC(=O)c3cc(=O)c4ccccc4o3)n2C)cc1	ZINC000819421552	GG	On-Demand	Anodyne	TNKS	27	51
COc1ccc(-c2cnc(NC(=O)c3cc(=O)c4ccccc4o3)n2C)cc1	ZINC000819421552	GG	On-Demand	Anodyne	GPR35	49	40
COc1ccc(-c2cnc(NC(=O)c3cccc(NC(=O)OC(C)(C)C)c3)n2C)cc1	ZINC000819421553	HJ	On-Demand	Anodyne	LUCI_LUCLA	16	40
COc1ccc(-c2cnc(NC(=O)c3cccc(NC(=O)OC(C)(C)C)c3)n2C)cc1	ZINC000819421553	HJ	On-Demand	Anodyne	TAAR1	42	38
COc1ccc(-c2cnc(NC(=O)c3cccc(NC(=O)OC(C)(C)C)c3)n2C)cc1	ZINC000819421553	HJ	On-Demand	Anodyne	KCNK3	80	40
COc1ccc(-c2cnc(NC(=O)c3cccc(NC(=O)OC(C)(C)C)c3)n2C)cc1	ZINC000819421553	HJ	On-Demand	Anodyne	KCNK9	52	33
COc1ccc(-c2cnc(NC(=O)Cc3ccc(OCC#N)cc3)n2C)cc1	ZINC000819421554	GG	On-Demand	Mild	PROKR1	53	33
COc1ccc(-c2cnc(NC(=O)c3nc(Cl)ccc3Cl)n2C)cc1	ZINC000819421560	GI	On-Demand	Anodyne	PDK1	44	36
COc1ccc(-c2cnc(NC(=O)C[C@@H]3CCCN3C(=O)OC(C)(C)C)n2C)cc1	ZINC000819421564	HH	On-Demand	Anodyne	HDAC8	15	46
COc1ccc(-c2cnc(NC(=O)C[C@H]3CCCN3C(=O)OC(C)(C)C)n2C)cc1	ZINC000819421567	HH	On-Demand	Anodyne	HDAC8	15	46
COCCOc1ccc(NCCC(=O)Nc2cccnc2)cc1Cl	ZINC000819421600	EG	On-Demand	Anodyne	GRM4	27	43
COCCOc1ccc(NCCC(=O)Nc2cccnc2)cc1Cl	ZINC000819421600	EG	On-Demand	Anodyne	CSF1R	18	43
COCCOc1ccc(NC[C@H](O)c2ccccc2)cc1Cl	ZINC000819421607	DH	On-Demand	Anodyne	ADRB2	18	44
COCCOc1ccc(NC[C@H](O)c2ccccc2)cc1Cl	ZINC000819421607	DH	On-Demand	Anodyne	ADRB1	25	40
COCCOc1ccc(NC[C@H](O)c2ccccc2)cc1Cl	ZINC000819421607	DH	On-Demand	Anodyne	ADRB3	43	40
COCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1Cl	ZINC000819421609	DH	On-Demand	Anodyne	ADRB2	18	44
COCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1Cl	ZINC000819421609	DH	On-Demand	Anodyne	ADRB1	25	40
COCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1Cl	ZINC000819421609	DH	On-Demand	Anodyne	ADRB3	43	40
COc1ccc(-c2cnc(NC(=O)c3cccnc3Br)n2C)cc1	ZINC000819421625	GH	On-Demand	Anodyne	LUCI_LUCLA	16	40
COc1ccc(-c2cnc(NC(=O)COc3ccc(C=O)cc3)n2C)cc1	ZINC000819421631	FF	On-Demand	Anodyne	ADORA2A	20	41
COc1ccc(-c2cnc(NC(=O)COc3ccc(C=O)cc3)n2C)cc1	ZINC000819421631	FF	On-Demand	Anodyne	ADORA2B	49	41
COc1ccc(-c2cnc(NC(=O)CCN3CCN(C(=O)OC(C)(C)C)CC3)n2C)cc1	ZINC000819421634	IF	On-Demand	Anodyne	GPR119	27	42
COc1ccc(-c2cnc(NC(=O)[C@H]3CCNC(=O)CC3)n2C)cc1	ZINC000819421646	ED	On-Demand	Anodyne	GSK3B	15	41
Cc1noc(C)c1[C@H](C)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819421695	GG	On-Demand	Mild	PAPA1_CARPA	43	48
Cc1noc(C)c1[C@H](C)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819421696	GG	On-Demand	Mild	PAPA1_CARPA	43	48
Cc1noc(C)c1[C@@H](C)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819421697	GG	On-Demand	Mild	PAPA1_CARPA	43	48
Cc1noc(C)c1[C@@H](C)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819421698	GG	On-Demand	Mild	PAPA1_CARPA	43	48
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCNC(=O)CC3)n2C)cc1	ZINC000819421712	ED	On-Demand	Anodyne	GSK3B	15	41
COc1ccc(-c2cnc(NC(=O)c3cc(Cl)cc(Cl)n3)n2C)cc1	ZINC000819421713	GI	On-Demand	Anodyne	SCN10A	33	42
COc1ccc(-c2cnc(NC(=O)c3cc(Cl)cc(Cl)n3)n2C)cc1	ZINC000819421713	GI	On-Demand	Anodyne	PDK1	44	34
COc1ccc(-c2cnc(NC(=O)c3ccccc3NC(=O)c3cccs3)n2C)cc1	ZINC000819421714	IJ	On-Demand	Anodyne	IKBKE	17	41
COc1ccc(-c2cnc(NC(=O)c3ccccc3NC(=O)c3cccs3)n2C)cc1	ZINC000819421714	IJ	On-Demand	Anodyne	TBK1	18	41
COc1ccc(-c2cnc(NC(=O)c3ccccc3NC(=O)c3cccs3)n2C)cc1	ZINC000819421714	IJ	On-Demand	Anodyne	STK33	29	44
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCCN3C(=O)OC(C)(C)C)n2C)cc1	ZINC000819421717	HG	On-Demand	Anodyne	HDAC8	15	52
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCCN3C(=O)OC(C)(C)C)n2C)cc1	ZINC000819421717	HG	On-Demand	Anodyne	MMP3	19	40
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCCN3C(=O)OC(C)(C)C)n2C)cc1	ZINC000819421717	HG	On-Demand	Anodyne	LGMN	55	41
COc1ccc(-c2cnc(NC(=O)[C@@H]3CCCN3C(=O)OC(C)(C)C)n2C)cc1	ZINC000819421717	HG	On-Demand	Anodyne	MMP1	17	41
COc1ccc(-c2cnc(NC(=O)[C@H]3CCCN3C(=O)OC(C)(C)C)n2C)cc1	ZINC000819421718	HG	On-Demand	Anodyne	HDAC8	15	52
COc1ccc(-c2cnc(NC(=O)[C@H]3CCCN3C(=O)OC(C)(C)C)n2C)cc1	ZINC000819421718	HG	On-Demand	Anodyne	MMP3	19	40
COc1ccc(-c2cnc(NC(=O)[C@H]3CCCN3C(=O)OC(C)(C)C)n2C)cc1	ZINC000819421718	HG	On-Demand	Anodyne	LGMN	55	41
COc1ccc(-c2cnc(NC(=O)[C@H]3CCCN3C(=O)OC(C)(C)C)n2C)cc1	ZINC000819421718	HG	On-Demand	Anodyne	MMP1	17	41
O=S(=O)(c1cccc(C(F)(F)F)c1)N(Cc1ccccc1O)C[C@@H]1CCCO1	ZINC000819421719	HH	On-Demand	Clean	CACNA1B	48	36
O=S(=O)(c1cccc(C(F)(F)F)c1)N(Cc1ccccc1O)C[C@H]1CCCO1	ZINC000819421720	HH	On-Demand	Clean	CACNA1B	48	36
COc1ccc(-c2cnc(NC(=O)c3ncccn3)n2C)cc1	ZINC000819421730	DE	On-Demand	Anodyne	LUCI_LUCLA	16	42
COc1ccc(-c2cnc(NC(=O)c3cnn(-c4ccccc4)n3)n2C)cc1	ZINC000819421732	FF	On-Demand	Anodyne	RPA1	21	40
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	CA2	121	60
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	CA6	35	53
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	CA1	104	53
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	CA7	82	53
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	CA13	39	53
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	CA5B	51	36
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	CA4	76	53
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	CA5A	58	36
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	CA14	56	53
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	ALOX15	64	52
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	CA12	78	53
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	ALPL	16	50
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	CA9	94	53
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	CAH_METTE	44	48
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	CYNT	64	53
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	NCE103	34	53
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	ALPI	17	50
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	CA15	36	53
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	MTCA1	44	53
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	P96878_MYCTU	54	49
CCCCCCCCCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819421736	FE	On-Demand	Mild	A6YCJ1_9METZ	41	53
COc1ccc(-c2cnc(NC(=O)c3ccc(C)c(C#N)c3)n2C)cc1	ZINC000819421737	EH	On-Demand	Mild	TAAR1	17	40
COc1ccc(-c2cnc(NC(=O)c3ccc(C)c(C#N)c3)n2C)cc1	ZINC000819421737	EH	On-Demand	Mild	DDR1	48	45
COc1ccc(-c2cnc(NC(=O)c3ccc([N+](=O)[O-])c(Cl)c3)n2C)cc1	ZINC000819421750	GH	On-Demand	Bother	TAAR1	29	45
COc1ccc(-c2cnc(NC(=O)c3cc(Cl)cc(Cl)c3[N+](=O)[O-])n2C)cc1	ZINC000819421757	HJ	On-Demand	Bother	F10	49	32
COc1ccc(-c2cnc(NC(=O)c3cc(Cl)cc(Cl)c3[N+](=O)[O-])n2C)cc1	ZINC000819421757	HJ	On-Demand	Bother	PDK1	44	36
N#Cc1ccc([C@@H](O)CNc2ccc(CCN3CCOCC3)cc2)cc1	ZINC000819421770	FF	On-Demand	Mild	KCNJ1	30	51
N#Cc1ccc([C@H](O)CNc2ccc(CCN3CCOCC3)cc2)cc1	ZINC000819421771	FF	On-Demand	Mild	KCNJ1	30	51
O=C(Nc1ccc(NC[C@H](O)C2CC2)cc1Cl)c1ccco1	ZINC000819421786	DG	On-Demand	Anodyne	GRM4	24	49
O=C(Nc1ccc(NC[C@@H](O)C2CC2)cc1Cl)c1ccco1	ZINC000819421787	DG	On-Demand	Anodyne	GRM4	24	49
COc1ccc(-c2cnc(NC(=O)c3cccnc3Cl)n2C)cc1	ZINC000819421792	EG	On-Demand	Anodyne	LUCI_LUCLA	29	40
COc1ccc(-c2cnc(NC(=O)c3cccnc3Cl)n2C)cc1	ZINC000819421792	EG	On-Demand	Anodyne	G2YM83_BOTF4	77	40
CCOC(=O)N1CCC[C@H](C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)C1	ZINC000819421797	GF	On-Demand	Anodyne	P2RY12	49	39
CCOC(=O)N1CCC[C@H](C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)C1	ZINC000819421797	GF	On-Demand	Anodyne	MMP13	23	41
CCOC(=O)N1CCC[C@@H](C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)C1	ZINC000819421799	GF	On-Demand	Anodyne	P2RY12	49	39
CCOC(=O)N1CCC[C@@H](C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)C1	ZINC000819421799	GF	On-Demand	Anodyne	MMP13	23	41
COc1ccc(-c2cnc(NC(=O)c3ccc(F)c(S(C)(=O)=O)c3)n2C)cc1	ZINC000819421801	HF	On-Demand	Anodyne	CPT1A	57	35
COc1ccc(-c2cnc(NC(=O)c3ccc(F)c(S(C)(=O)=O)c3)n2C)cc1	ZINC000819421801	HF	On-Demand	Anodyne	CPT1B	43	32
COc1ccc(-c2cnc(NC(=O)C3CCC(NC(=O)OC(C)(C)C)CC3)n2C)cc1	ZINC000819421807	II	On-Demand	Anodyne	JAK1	19	46
CCOC(=O)Nc1ccc(C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)cc1	ZINC000819421809	GH	On-Demand	Anodyne	PRNP	57	35
CCOC(=O)Nc1ccc(C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)cc1	ZINC000819421809	GH	On-Demand	Anodyne	ACR	46	40
CCOC(=O)Nc1ccc(C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)cc1	ZINC000819421809	GH	On-Demand	Anodyne	LUCI_LUCLA	15	40
CCOC(=O)Nc1ccc(C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)cc1	ZINC000819421809	GH	On-Demand	Anodyne	SHH	53	35
C[C@H]1CCc2c(sc(NC(=O)c3cccnc3Cl)c2C(=O)c2ccco2)C1	ZINC000819421813	HJ	On-Demand	Anodyne	G2YM83_BOTF4	79	46
COc1ccc(-c2cnc(NC(=O)CCCNC(=O)OCc3ccccc3)n2C)cc1	ZINC000819421815	HH	On-Demand	Anodyne	HDAC2	25	41
COc1ccc(-c2cnc(NC(=O)CCCNC(=O)OCc3ccccc3)n2C)cc1	ZINC000819421815	HH	On-Demand	Anodyne	FAAH	15	41
COc1ccc(-c2cnc(NC(=O)CCCNC(=O)OCc3ccccc3)n2C)cc1	ZINC000819421815	HH	On-Demand	Anodyne	CAPN1	40	40
COc1ccc(-c2cnc(NC(=O)CCCNC(=O)OCc3ccccc3)n2C)cc1	ZINC000819421815	HH	On-Demand	Anodyne	CAPN2	67	40
COc1ccc(-c2cnc(NC(=O)c3cc(Br)ncc3Cl)n2C)cc1	ZINC000819421820	HI	On-Demand	Anodyne	PDK1	43	32
COc1ccc(-c2cnc(NC(=O)[C@@H](F)Cc3ccccc3)n2C)cc1	ZINC000819421826	FH	On-Demand	Anodyne	MMP13	19	40
COc1ccc(-c2cnc(NC(=O)[C@@H](F)Cc3ccccc3)n2C)cc1	ZINC000819421826	FH	On-Demand	Anodyne	MMP2	20	41
COc1ccc(-c2cnc(NC(=O)[C@@H](F)Cc3ccccc3)n2C)cc1	ZINC000819421826	FH	On-Demand	Anodyne	MMP3	21	41
COc1ccc(-c2cnc(NC(=O)[C@@H](F)Cc3ccccc3)n2C)cc1	ZINC000819421826	FH	On-Demand	Anodyne	MMP9	23	40
COc1ccc(-c2cnc(NC(=O)[C@@H](F)Cc3ccccc3)n2C)cc1	ZINC000819421826	FH	On-Demand	Anodyne	MMP1	22	41
COc1ccc(-c2cnc(NC(=O)[C@H](F)Cc3ccccc3)n2C)cc1	ZINC000819421827	FH	On-Demand	Anodyne	MMP13	19	40
COc1ccc(-c2cnc(NC(=O)[C@H](F)Cc3ccccc3)n2C)cc1	ZINC000819421827	FH	On-Demand	Anodyne	MMP2	20	41
COc1ccc(-c2cnc(NC(=O)[C@H](F)Cc3ccccc3)n2C)cc1	ZINC000819421827	FH	On-Demand	Anodyne	MMP3	21	41
COc1ccc(-c2cnc(NC(=O)[C@H](F)Cc3ccccc3)n2C)cc1	ZINC000819421827	FH	On-Demand	Anodyne	MMP9	23	40
COc1ccc(-c2cnc(NC(=O)[C@H](F)Cc3ccccc3)n2C)cc1	ZINC000819421827	FH	On-Demand	Anodyne	MMP1	22	41
O[C@@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc(F)c1	ZINC000819421845	EF	On-Demand	Anodyne	CASR	42	36
O[C@H](CNc1ccc(CCN2CCOCC2)cc1)c1cccc(F)c1	ZINC000819421846	EF	On-Demand	Anodyne	CASR	42	36
COc1ccc(-c2cnc(NC(=O)c3ccc(NC(=O)OCC(F)(F)F)cc3)n2C)cc1	ZINC000819421851	II	On-Demand	Anodyne	PRNP	47	30
COc1ccc(-c2cnc(NC(=O)c3ccc(NC(=O)OCC(F)(F)F)cc3)n2C)cc1	ZINC000819421851	II	On-Demand	Anodyne	ACR	47	40
COc1ccc(-c2cnc(NC(=O)c3ccc(NC(=O)OCC(F)(F)F)cc3)n2C)cc1	ZINC000819421851	II	On-Demand	Anodyne	SHH	48	35
COc1ccc(-c2cnc(NC(=O)c3ccc(N4CCOC4=O)cc3)n2C)cc1	ZINC000819421856	GG	On-Demand	Anodyne	PRNP	48	32
COc1ccc(-c2cnc(NC(=O)c3ccc(CN4CCCCC4=O)cc3)n2C)cc1	ZINC000819421863	HH	On-Demand	Anodyne	F10	18	47
COc1ccc(-c2cnc(NC(=O)c3ccc(CN4CCCCC4=O)cc3)n2C)cc1	ZINC000819421863	HH	On-Demand	Anodyne	MCHR1	17	47
COc1ccc(-c2cnc(NC(=O)c3ccc(CN4CCCCC4=O)cc3)n2C)cc1	ZINC000819421863	HH	On-Demand	Anodyne	TYRO3	15	40
COc1ccc(-c2cnc(NC(=O)c3ccc(CN4CCCCC4=O)cc3)n2C)cc1	ZINC000819421863	HH	On-Demand	Anodyne	PROKR1	58	31
COc1ccc(-c2cnc(NC(=O)c3ccc(CN4CCCCC4=O)cc3)n2C)cc1	ZINC000819421863	HH	On-Demand	Anodyne	NOD1	15	44
COc1ccc(-c2cnc(NC(=O)c3ccc(CN4CCCCC4=O)cc3)n2C)cc1	ZINC000819421863	HH	On-Demand	Anodyne	NOD2	43	44
COCCOc1ccc(NC[C@H](O)c2cccc(F)c2)cc1Cl	ZINC000819421865	EH	On-Demand	Anodyne	ADRB1	20	41
COCCOc1ccc(NC[C@H](O)c2cccc(F)c2)cc1Cl	ZINC000819421865	EH	On-Demand	Anodyne	ERBB2	51	39
COCCOc1ccc(NC[C@H](O)c2cccc(F)c2)cc1Cl	ZINC000819421865	EH	On-Demand	Anodyne	ADRB3	25	41
COCCOc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1Cl	ZINC000819421867	EH	On-Demand	Anodyne	ADRB1	20	41
COCCOc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1Cl	ZINC000819421867	EH	On-Demand	Anodyne	ERBB2	51	39
COCCOc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1Cl	ZINC000819421867	EH	On-Demand	Anodyne	ADRB3	25	41
COc1ccc(-c2cnc(NC(=O)c3ccccc3OCC#N)n2C)cc1	ZINC000819421886	FG	On-Demand	Mild	KCNK3	43	37
CON=Cc1ccc(C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)cc1	ZINC000819421888	FG	On-Demand	Mild	LUCI_LUCLA	15	41
COc1ccc(-c2cnc(NC(=O)c3cc(C)cc(C)n3)n2C)cc1	ZINC000819421894	EG	On-Demand	Anodyne	SCN10A	49	38
COc1ccc(-c2cnc(NC(=O)c3cccc(C)c3NC(C)=O)n2C)cc1	ZINC000819421909	GH	On-Demand	Anodyne	SHH	45	34
COc1ccc(-c2cnc(NC(=O)CCCCNC(=O)OC(C)(C)C)n2C)cc1	ZINC000819421910	HH	On-Demand	Anodyne	HDAC8	19	40
COc1ccc(-c2cnc(NC(=O)CCCCNC(=O)OC(C)(C)C)n2C)cc1	ZINC000819421910	HH	On-Demand	Anodyne	HDAC10	17	44
C[C@@H](Nc1ccc(NC[C@](C)(O)CNC(=O)OC(C)(C)C)cc1)c1ccccc1	ZINC000819421912	GJ	On-Demand	Anodyne	CTSK	20	44
C[C@@H](Nc1ccc(NC[C@@](C)(O)CNC(=O)OC(C)(C)C)cc1)c1ccccc1	ZINC000819421914	GJ	On-Demand	Anodyne	CTSK	20	44
COCCOc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1Cl	ZINC000819421922	FG	On-Demand	Anodyne	ADRB2	35	41
COCCOc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1Cl	ZINC000819421922	FG	On-Demand	Anodyne	ADRB1	55	41
COCCOc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1Cl	ZINC000819421922	FG	On-Demand	Anodyne	GRIN1	27	41
COCCOc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1Cl	ZINC000819421922	FG	On-Demand	Anodyne	PPARA	17	42
COCCOc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1Cl	ZINC000819421923	FG	On-Demand	Anodyne	ADRB2	35	41
COCCOc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1Cl	ZINC000819421923	FG	On-Demand	Anodyne	ADRB1	55	41
COCCOc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1Cl	ZINC000819421923	FG	On-Demand	Anodyne	GRIN1	27	41
COCCOc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1Cl	ZINC000819421923	FG	On-Demand	Anodyne	PPARA	17	42
CCOC(=O)N(C)c1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819421936	EI	On-Demand	Anodyne	UTS2	41	33
COCCCOc1ccccc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819421945	FF	On-Demand	Clean	ABCB1	31	40
COCCCOc1ccccc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819421945	FF	On-Demand	Clean	NOD2	42	36
COCCCOc1ccccc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819421946	FF	On-Demand	Clean	ABCB1	31	40
COCCCOc1ccccc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819421946	FF	On-Demand	Clean	NOD2	42	36
COc1ccc(-c2cnc(NC(=O)Cc3cccc(OCC#N)c3)n2C)cc1	ZINC000819421950	GG	On-Demand	Mild	CSNK1D	15	43
COc1ccc(-c2cnc(NC(=O)Cc3cccc(OCC#N)c3)n2C)cc1	ZINC000819421950	GG	On-Demand	Mild	ROCK2	41	35
COc1ccc(-c2cnc(NC(=O)/C=C\c3ccc(OC)c(OC)c3)n2C)cc1	ZINC000819421951	GH	On-Demand	Anodyne	HDAC8	15	46
COc1ccc(-c2cnc(NC(=O)/C=C\c3ccc(OC)c(OC)c3)n2C)cc1	ZINC000819421951	GH	On-Demand	Anodyne	ABCG2	19	43
COc1ccc(-c2cnc(NC(=O)/C=C\c3ccc(OC)c(OC)c3)n2C)cc1	ZINC000819421951	GH	On-Demand	Anodyne	ENPP1	44	30
COc1ccc(-c2cnc(NC(=O)/C=C/c3ccc(OC)c(OC)c3)n2C)cc1	ZINC000819421952	GH	On-Demand	Anodyne	HDAC8	15	46
COc1ccc(-c2cnc(NC(=O)/C=C/c3ccc(OC)c(OC)c3)n2C)cc1	ZINC000819421952	GH	On-Demand	Anodyne	ABCG2	19	43
COc1ccc(-c2cnc(NC(=O)/C=C/c3ccc(OC)c(OC)c3)n2C)cc1	ZINC000819421952	GH	On-Demand	Anodyne	ENPP1	44	30
CCC(=O)Nc1ccccc1C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819421956	GH	On-Demand	Anodyne	ADORA1	17	42
CCC(=O)Nc1ccccc1C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819421956	GH	On-Demand	Anodyne	ADORA2A	18	42
CCC(=O)Nc1ccccc1C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819421956	GH	On-Demand	Anodyne	ADORA2B	32	42
CCC(=O)Nc1ccccc1C(=O)Nc1ncc(-c2ccc(OC)cc2)n1C	ZINC000819421956	GH	On-Demand	Anodyne	LUCI_LUCLA	16	40
COc1ccc(-c2cnc(NC(=O)c3cc(C4CC4)cnc3Cl)n2C)cc1	ZINC000819421979	GI	On-Demand	Anodyne	PDK1	43	32
CCOc1cc(Cl)ccc1CNC(=O)[C@@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819421986	GG	On-Demand	Anodyne	P2RX7	55	39
CCOc1cc(Cl)ccc1CNC(=O)[C@H]1C[C@H]2CC[C@H]1N(C(=O)OC)C2	ZINC000819421987	GG	On-Demand	Anodyne	P2RX7	55	39
COc1ccc(-c2cnc(NC(=O)c3ccc(-n4cccn4)nc3)n2C)cc1	ZINC000819421993	FF	On-Demand	Anodyne	LUCI_LUCLA	22	41
COc1ccc(-c2cnc(NC(=O)Cn3c(S)nc4ccccc4c3=O)n2C)cc1	ZINC000819422013	HF	On-Demand	Anodyne	AVPR1B	55	38
CCOc1cc(Cl)ccc1CNC(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819422018	GF	On-Demand	Anodyne	P2RX7	47	39
CCOc1cc(Cl)ccc1CNC(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819422021	GF	On-Demand	Anodyne	P2RX7	47	39
C#CCNC(=O)CCNc1ccc(OCCCC)cc1C	ZINC000819422027	CF	On-Demand	Mild	PLA2G4B	65	33
C#CCOc1ccc(C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)cc1	ZINC000819422028	FG	On-Demand	Mild	LUCI_LUCLA	15	42
COc1ccc(-c2cnc(NC(=O)c3cc(=O)c4ccc(F)cc4o3)n2C)cc1	ZINC000819422029	GH	On-Demand	Anodyne	GPR35	55	40
COCCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1Cl	ZINC000819422032	GH	On-Demand	Anodyne	ADRB2	19	55
COCCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1Cl	ZINC000819422032	GH	On-Demand	Anodyne	ADRB1	31	55
COCCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1Cl	ZINC000819422034	GH	On-Demand	Anodyne	ADRB2	19	55
COCCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1Cl	ZINC000819422034	GH	On-Demand	Anodyne	ADRB1	31	55
COc1ccc(-c2cnc(NC(=O)CNC(=O)OCc3ccccc3)n2C)cc1	ZINC000819422037	GF	On-Demand	Anodyne	ELANE	15	46
COc1ccc(-c2cnc(NC(=O)CNC(=O)OCc3ccccc3)n2C)cc1	ZINC000819422037	GF	On-Demand	Anodyne	CTSB	27	40
COc1ccc(-c2cnc(NC(=O)CNC(=O)OCc3ccccc3)n2C)cc1	ZINC000819422037	GF	On-Demand	Anodyne	CAPN1	43	37
COc1ccc(-c2cnc(NC(=O)CNC(=O)OCc3ccccc3)n2C)cc1	ZINC000819422037	GF	On-Demand	Anodyne	CAPN2	81	40
COc1ccc(-c2cnc(NC(=O)CNC(=O)OCc3ccccc3)n2C)cc1	ZINC000819422037	GF	On-Demand	Anodyne	NPR	50	32
C[C@@H](Nc1ccc(NCCS(C)(=O)=O)cc1)c1ccccc1	ZINC000819422048	DG	On-Demand	Anodyne	HTR7	22	42
COc1ccc(-c2cnc(NC(=O)c3ccc(Cl)nc3)n2C)cc1	ZINC000819422050	EG	On-Demand	Anodyne	LUCI_LUCLA	29	41
COc1ccc(-c2cnc(NC(=O)c3cc(S(=O)(=O)NC(C)C)ccc3F)n2C)cc1	ZINC000819422051	IG	On-Demand	Anodyne	MMP9	15	40
COc1ccc(-c2cnc(NC(=O)c3ccc(F)c(S(=O)(=O)NC(C)C)c3)n2C)cc1	ZINC000819422068	IG	On-Demand	Anodyne	CPT1A	45	31
O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1	ZINC000819422079	GF	On-Demand	Clean	COLA	64	40
O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1	ZINC000819422079	GF	On-Demand	Clean	MMP8	26	40
O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1	ZINC000819422079	GF	On-Demand	Clean	MMP1	18	40
O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1	ZINC000819422080	GF	On-Demand	Clean	COLA	64	40
O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1	ZINC000819422080	GF	On-Demand	Clean	MMP8	26	40
O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1	ZINC000819422080	GF	On-Demand	Clean	MMP1	18	40
COc1ccc(-c2cnc(NC(=O)c3ccccc3NC(=O)C3CC3)n2C)cc1	ZINC000819422084	GH	On-Demand	Anodyne	GSK3B	18	41
COc1ccc(-c2cnc(NC(=O)c3ccccc3NC(=O)C3CC3)n2C)cc1	ZINC000819422084	GH	On-Demand	Anodyne	JAK1	15	50
CCCCCCCCCNS(=O)(=O)c1ccc2nc(O)oc2c1	ZINC000819422085	EH	On-Demand	Mild	ALOX15	51	39
COc1ccc(-c2cnc(NC(=O)CC3CCN(C(=O)OC(C)(C)C)CC3)n2C)cc1	ZINC000819422087	II	On-Demand	Anodyne	GRIN2B	15	42
COc1ccc(-c2cnc(NC(=O)CC3CCN(C(=O)OC(C)(C)C)CC3)n2C)cc1	ZINC000819422087	II	On-Demand	Anodyne	GPR119	53	41
COc1ccc(-c2cnc(NC(=O)c3cnc(Cl)c4ccccc34)n2C)cc1	ZINC000819422092	GJ	On-Demand	Anodyne	LUCI_LUCLA	30	41
COc1ccc(-c2cnc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)n2C)cc1	ZINC000819422093	II	On-Demand	Bother	WDR5	35	40
COc1ccc(-c2cnc(NC(=O)c3ccc(F)nc3)n2C)cc1	ZINC000819422101	EF	On-Demand	Anodyne	LUCI_LUCLA	16	41
COc1ccc(-c2cnc(NC(=O)c3ccc(N4CCOCC4)nc3)n2C)cc1	ZINC000819422107	GF	On-Demand	Anodyne	HDAC1	18	41
COc1ccc(-c2cnc(NC(=O)c3ccc(N4CCOCC4)nc3)n2C)cc1	ZINC000819422107	GF	On-Demand	Anodyne	MTOR	55	39
COc1ccc(-c2cnc(NC(=O)c3ccc(N4CCOCC4)nc3)n2C)cc1	ZINC000819422107	GF	On-Demand	Anodyne	DGAT1	27	43
COc1ccc(-c2cnc(NC(=O)c3ccc(N4CCOCC4)nc3)n2C)cc1	ZINC000819422107	GF	On-Demand	Anodyne	HPGDS	25	42
COCCCOc1ccccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819422221	ED	On-Demand	Clean	ABCB1	65	38
COCCCOc1ccccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819422222	ED	On-Demand	Clean	ABCB1	65	38
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1ccccc1-n1cnnn1	ZINC000819422223	IH	On-Demand	Anodyne	CNR1	49	30
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1ccccc1-n1cnnn1	ZINC000819422223	IH	On-Demand	Anodyne	EPHB3	45	34
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(CCN3CCOCC3)cc2)c1	ZINC000819422228	FF	On-Demand	Bother	KCNJ1	33	44
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(CCN3CCOCC3)cc2)c1	ZINC000819422229	FF	On-Demand	Bother	KCNJ1	33	44
COc1ccc(-c2cnc(NC(=O)C3=C(C)C(C)(C)OC3=O)n2C)cc1	ZINC000819422244	FF	On-Demand	Anodyne	LUCI_LUCLA	16	41
CCCCCCCCCNS(=O)(=O)c1ccc2c(c1)CCN2C(C)=O	ZINC000819422249	FH	On-Demand	Mild	HTR7	21	44
CCCCCCCCCNS(=O)(=O)c1ccc2c(c1)CCN2C(C)=O	ZINC000819422249	FH	On-Demand	Mild	HSD17B3	42	29
COCCCOc1ccccc1NC[C@H](O)C1CCCCC1	ZINC000819422254	DG	On-Demand	Anodyne	AMY2	46	33
COCCCOc1ccccc1NC[C@H](O)C1CCCCC1	ZINC000819422254	DG	On-Demand	Anodyne	REN	19	40
COCCCOc1ccccc1NC[C@@H](O)C1CCCCC1	ZINC000819422257	DG	On-Demand	Anodyne	AMY2	46	33
COCCCOc1ccccc1NC[C@@H](O)C1CCCCC1	ZINC000819422257	DG	On-Demand	Anodyne	REN	19	40
COc1ccc(-c2cnc(NC(=O)c3ccnc(F)c3)n2C)cc1	ZINC000819422259	EF	On-Demand	Anodyne	LUCI_LUCLA	22	40
COCCOc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1Cl	ZINC000819422279	GH	On-Demand	Anodyne	ADRB2	30	47
COCCOc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1Cl	ZINC000819422279	GH	On-Demand	Anodyne	ADRB1	53	35
COCCOc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1Cl	ZINC000819422279	GH	On-Demand	Anodyne	GRM4	15	40
COCCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1Cl	ZINC000819422280	GH	On-Demand	Anodyne	ADRB2	30	47
COCCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1Cl	ZINC000819422280	GH	On-Demand	Anodyne	ADRB1	53	35
COCCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1Cl	ZINC000819422280	GH	On-Demand	Anodyne	GRM4	15	40
COc1ccc(-c2cnc(NC(=O)Cc3cc(-c4ccccc4)on3)n2C)cc1	ZINC000819422282	GH	On-Demand	Anodyne	PDK1	42	33
COc1ccc(-c2cnc(NC(=O)Cc3cc(-c4ccccc4)on3)n2C)cc1	ZINC000819422282	GH	On-Demand	Anodyne	GRM7	60	42
CCOC(=O)N(C)c1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819422286	DF	On-Demand	Anodyne	ADRB3	84	45
COc1ccc(-c2cnc(NC(=O)c3ccc(NC(=O)OC(C)(C)C)cc3)n2C)cc1	ZINC000819422289	HJ	On-Demand	Anodyne	PRNP	53	32
COc1ccc(-c2cnc(NC(=O)c3ccc(NC(=O)OC(C)(C)C)cc3)n2C)cc1	ZINC000819422289	HJ	On-Demand	Anodyne	SHH	45	33
CCOC(=O)N(C)c1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819422290	DF	On-Demand	Anodyne	ADRB3	84	45
COCCOc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1Cl	ZINC000819422295	FG	On-Demand	Bother	ADRB1	18	40
COCCOc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1Cl	ZINC000819422295	FG	On-Demand	Bother	CACNA1C	52	45
COCCOc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1Cl	ZINC000819422295	FG	On-Demand	Bother	ADRB3	28	40
COCCOc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1Cl	ZINC000819422295	FG	On-Demand	Bother	CACNA1D	85	45
COc1ccc(-c2cnc(NC(=O)c3ccc(Cl)c(S(=O)(=O)N(C)C)c3)n2C)cc1	ZINC000819422297	IG	On-Demand	Anodyne	CPT1A	49	34
COc1ccc(-c2cnc(NC(=O)c3ccc(Cl)c(S(=O)(=O)N(C)C)c3)n2C)cc1	ZINC000819422297	IG	On-Demand	Anodyne	CPT1B	41	32
COCCOc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1Cl	ZINC000819422298	FG	On-Demand	Bother	ADRB1	18	40
COCCOc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1Cl	ZINC000819422298	FG	On-Demand	Bother	CACNA1C	52	45
COCCOc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1Cl	ZINC000819422298	FG	On-Demand	Bother	ADRB3	28	40
COCCOc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1Cl	ZINC000819422298	FG	On-Demand	Bother	CACNA1D	85	45
COc1ccc(-c2cnc(NC(=O)/C=C/c3ccc(O)c(O)c3)n2C)cc1	ZINC000819422299	FG	On-Demand	Clean	HDAC8	15	46
COc1ccc(-c2cnc(NC(=O)/C=C\c3ccc(O)c(O)c3)n2C)cc1	ZINC000819422300	FG	On-Demand	Clean	HDAC8	15	46
COCCOc1ccc(NCCC(=O)Nc2ccccc2F)cc1Cl	ZINC000819422301	FH	On-Demand	Anodyne	GRM4	33	42
COCCOc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1Cl	ZINC000819422304	GF	On-Demand	Anodyne	GRIN1	19	43
COCCOc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1Cl	ZINC000819422305	GF	On-Demand	Anodyne	GRIN1	19	43
C=CC(=O)NCc1ccc(C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)cc1	ZINC000819422321	GG	On-Demand	Anodyne	PROKR1	53	31
C=CC(=O)NCc1ccc(C(=O)Nc2ncc(-c3ccc(OC)cc3)n2C)cc1	ZINC000819422321	GG	On-Demand	Anodyne	RPA1	22	43
COc1ccc(-c2cnc(NC(=O)c3ccc(Br)nc3)n2C)cc1	ZINC000819422332	GH	On-Demand	Anodyne	LUCI_LUCLA	23	44
CCCCCCCCCNS(=O)(=O)c1ccc(C(=O)NC)cc1	ZINC000819422333	EG	On-Demand	Mild	CA2	21	57
CCCCCCCCCNS(=O)(=O)c1ccc(C(=O)NC)cc1	ZINC000819422333	EG	On-Demand	Mild	TBXA2R	42	33
CCCCCCCCCNS(=O)(=O)c1ccc(C(=O)NC)cc1	ZINC000819422333	EG	On-Demand	Mild	CA1	15	43
CCCCCCCCCNS(=O)(=O)c1ccc(C(=O)NC)cc1	ZINC000819422333	EG	On-Demand	Mild	S1PR2	43	36
CCCCCCCCCNS(=O)(=O)c1ccc(C(=O)NC)cc1	ZINC000819422333	EG	On-Demand	Mild	ALOX15	63	45
CCCCCCCCCNS(=O)(=O)c1ccc(C(=O)NC)cc1	ZINC000819422333	EG	On-Demand	Mild	ASAH1	53	32
O[C@H](CNc1ccc(CCN2CCCCC2)cc1)C1CC1	ZINC000819422335	CF	On-Demand	Anodyne	HRH3	23	49
O[C@H](CNc1ccc(CCN2CCCCC2)cc1)C1CC1	ZINC000819422335	CF	On-Demand	Anodyne	L3MBTL3	34	44
COc1ccc(-c2cnc(NC(=O)[C@@]3(O)CCc4ccccc4C3)n2C)cc1	ZINC000819422337	GF	On-Demand	Anodyne	LUCI_LUCLA	23	43
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)C1CC1	ZINC000819422338	CF	On-Demand	Anodyne	HRH3	23	49
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)C1CC1	ZINC000819422338	CF	On-Demand	Anodyne	L3MBTL3	34	44
COc1ccc(-c2cnc(NC(=O)[C@]3(O)CCc4ccccc4C3)n2C)cc1	ZINC000819422339	GF	On-Demand	Anodyne	LUCI_LUCLA	23	43
COc1ccc(-c2cnc(NC(=O)Cn3c(S)nnc3-c3cccc(C)c3)n2C)cc1	ZINC000819422367	IH	On-Demand	Anodyne	AVPR1B	53	39
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1cccnc1	ZINC000819422411	EG	On-Demand	Anodyne	ADRB2	33	45
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1cccnc1	ZINC000819422411	EG	On-Demand	Anodyne	ADRB1	30	42
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1cccnc1	ZINC000819422411	EG	On-Demand	Anodyne	ADRB3	110	56
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1cccnc1	ZINC000819422411	EG	On-Demand	Anodyne	CHRNA7	24	44
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1cccnc1	ZINC000819422411	EG	On-Demand	Anodyne	HNMT	47	32
O[C@H](CNc1ccc(CCN2CCCCC2)cc1)c1cccnc1	ZINC000819422412	EG	On-Demand	Anodyne	ADRB2	33	45
O[C@H](CNc1ccc(CCN2CCCCC2)cc1)c1cccnc1	ZINC000819422412	EG	On-Demand	Anodyne	ADRB1	30	42
O[C@H](CNc1ccc(CCN2CCCCC2)cc1)c1cccnc1	ZINC000819422412	EG	On-Demand	Anodyne	ADRB3	110	56
O[C@H](CNc1ccc(CCN2CCCCC2)cc1)c1cccnc1	ZINC000819422412	EG	On-Demand	Anodyne	CHRNA7	24	44
O[C@H](CNc1ccc(CCN2CCCCC2)cc1)c1cccnc1	ZINC000819422412	EG	On-Demand	Anodyne	HNMT	47	32
COCCOc1ccc(NC[C@H](O)COc2ccccc2C)cc1Cl	ZINC000819422425	FH	On-Demand	Anodyne	ADRB2	28	49
COCCOc1ccc(NC[C@H](O)COc2ccccc2C)cc1Cl	ZINC000819422425	FH	On-Demand	Anodyne	ADRB1	49	33
COCCOc1ccc(NC[C@@H](O)COc2ccccc2C)cc1Cl	ZINC000819422426	FH	On-Demand	Anodyne	ADRB2	28	49
COCCOc1ccc(NC[C@@H](O)COc2ccccc2C)cc1Cl	ZINC000819422426	FH	On-Demand	Anodyne	ADRB1	49	33
O=[N+]([O-])c1ccc([C@@H](O)CNc2ccc(CCN3CCOCC3)cc2)cc1	ZINC000819422440	FF	On-Demand	Bother	KCNJ1	39	53
O=[N+]([O-])c1ccc([C@H](O)CNc2ccc(CCN3CCOCC3)cc2)cc1	ZINC000819422441	FF	On-Demand	Bother	KCNJ1	39	53
COCCCOc1ccccc1NCC1(O)CCCCC1	ZINC000819422448	CG	On-Demand	Anodyne	HCN1	55	34
COCCCOc1ccccc1NCC1(O)CCCCC1	ZINC000819422448	CG	On-Demand	Anodyne	HCN4	53	34
CCOC(=O)N(C)c1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819422451	FG	On-Demand	Bother	CACNA1C	55	39
CCOC(=O)N(C)c1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819422451	FG	On-Demand	Bother	CACNA1D	85	35
CCOC(=O)N(C)c1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819422452	FG	On-Demand	Bother	CACNA1C	55	39
CCOC(=O)N(C)c1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819422452	FG	On-Demand	Bother	CACNA1D	85	35
O[C@@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819422453	FI	On-Demand	Anodyne	ABCC1	40	34
O[C@H](CNc1ccc(CCN2CCCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819422454	FI	On-Demand	Anodyne	ABCC1	40	34
COCCCOc1ccccc1NCC1(O)CCC1	ZINC000819422463	CE	On-Demand	Anodyne	HCN1	49	30
COCCCOc1ccccc1NCC1(O)CCC1	ZINC000819422463	CE	On-Demand	Anodyne	HCN4	47	30
CCOC(=O)N(C)c1ccc(NCCS(=O)(=O)CC)cc1	ZINC000819422468	DE	On-Demand	Anodyne	PTPRB	40	34
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1Cl	ZINC000819422470	EH	On-Demand	Anodyne	EGFR	21	41
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1Cl	ZINC000819422470	EH	On-Demand	Anodyne	ERBB2	29	41
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1Cl	ZINC000819422470	EH	On-Demand	Anodyne	CPT1A	49	34
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1Cl	ZINC000819422470	EH	On-Demand	Anodyne	GRM4	34	45
COCCCOc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819422475	EH	On-Demand	Anodyne	ADRB2	20	44
COCCCOc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819422475	EH	On-Demand	Anodyne	ADRB1	37	44
COCCCOc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819422475	EH	On-Demand	Anodyne	ADRB3	56	44
COCCCOc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819422475	EH	On-Demand	Anodyne	IGF1R	29	41
COCCCOc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819422475	EH	On-Demand	Anodyne	CYP3A4	49	41
COCCCOc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819422476	EH	On-Demand	Anodyne	ADRB2	20	44
COCCCOc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819422476	EH	On-Demand	Anodyne	ADRB1	37	44
COCCCOc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819422476	EH	On-Demand	Anodyne	ADRB3	56	44
COCCCOc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819422476	EH	On-Demand	Anodyne	IGF1R	29	41
COCCCOc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819422476	EH	On-Demand	Anodyne	CYP3A4	49	41
COCCOc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1Cl	ZINC000819422486	FH	On-Demand	Anodyne	ADRB2	28	51
COCCOc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1Cl	ZINC000819422486	FH	On-Demand	Anodyne	ADRB1	38	51
COCCOc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1Cl	ZINC000819422487	FH	On-Demand	Anodyne	ADRB2	28	51
COCCOc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1Cl	ZINC000819422487	FH	On-Demand	Anodyne	ADRB1	38	51
COCCOc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1Cl	ZINC000819422572	GG	On-Demand	Anodyne	NOD2	46	39
COCCOc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1Cl	ZINC000819422573	GG	On-Demand	Anodyne	NOD2	46	39
CC(=O)Nc1cccc(CC(=O)NCC2([C@@H](O)c3ccccc3)CC2)c1	ZINC000819422580	FF	On-Demand	Anodyne	KCNK3	85	35
CC(=O)Nc1cccc(CC(=O)NCC2([C@@H](O)c3ccccc3)CC2)c1	ZINC000819422580	FF	On-Demand	Anodyne	KCNK9	65	35
CC(=O)Nc1cccc(CC(=O)NCC2([C@H](O)c3ccccc3)CC2)c1	ZINC000819422581	FF	On-Demand	Anodyne	KCNK3	85	35
CC(=O)Nc1cccc(CC(=O)NCC2([C@H](O)c3ccccc3)CC2)c1	ZINC000819422581	FF	On-Demand	Anodyne	KCNK9	65	35
COCCCOc1ccccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819422582	EG	On-Demand	Bother	CACNA1C	56	40
COCCCOc1ccccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819422582	EG	On-Demand	Bother	CACNA1D	85	40
COCCCOc1ccccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819422583	EG	On-Demand	Bother	CACNA1C	56	40
COCCCOc1ccccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819422583	EG	On-Demand	Bother	CACNA1D	85	40
O[C@@H](CNc1cc(Cl)ccc1OC[C@H]1CCCO1)c1ccc(F)cc1	ZINC000819422593	FI	On-Demand	Anodyne	CYP3A4	45	33
O[C@H](CNc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1ccc(F)cc1	ZINC000819422594	FI	On-Demand	Anodyne	CYP3A4	45	33
O[C@H](CNc1cc(Cl)ccc1OC[C@H]1CCCO1)c1ccc(F)cc1	ZINC000819422595	FI	On-Demand	Anodyne	CYP3A4	45	33
O[C@@H](CNc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1ccc(F)cc1	ZINC000819422596	FI	On-Demand	Anodyne	CYP3A4	45	33
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2cc(C)ccc2C)cc1	ZINC000819422619	FH	On-Demand	Anodyne	ADRB2	18	44
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2cc(C)ccc2C)cc1	ZINC000819422620	FH	On-Demand	Anodyne	ADRB2	18	44
COC[C@@H](O)CNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819422672	GG	On-Demand	Anodyne	HTR1A	27	46
COC[C@@H](O)CNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819422672	GG	On-Demand	Anodyne	DRD2	40	46
COC[C@@H](O)CNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819422672	GG	On-Demand	Anodyne	DRD4	48	44
COC[C@@H](O)CNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819422672	GG	On-Demand	Anodyne	DRD3	40	44
COC[C@@H](O)CNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819422672	GG	On-Demand	Anodyne	NPY2R	74	59
COC[C@@H](O)CNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819422672	GG	On-Demand	Anodyne	ABCB1	41	38
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccccc2C)cc1	ZINC000819422769	FG	On-Demand	Anodyne	ADRB2	26	56
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccccc2C)cc1	ZINC000819422769	FG	On-Demand	Anodyne	ADRB1	56	33
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccccc2C)cc1	ZINC000819422770	FG	On-Demand	Anodyne	ADRB2	26	56
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccccc2C)cc1	ZINC000819422770	FG	On-Demand	Anodyne	ADRB1	56	33
NC(=O)CCNc1cccc(N2CCCCC2)c1	ZINC000819422771	BD	On-Demand	Anodyne	DPP7	21	40
CCOC(=O)N(C)c1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819422798	EH	On-Demand	Anodyne	CTSK	15	43
CCOC(=O)N(C)c1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819422799	EH	On-Demand	Anodyne	CTSK	15	43
O[C@@H](CNc1cccc(N2CCCCC2)c1)c1ccccc1	ZINC000819422800	CH	On-Demand	Anodyne	KCNQ2	36	40
O[C@H](CNc1cccc(N2CCCCC2)c1)c1ccccc1	ZINC000819422801	CH	On-Demand	Anodyne	KCNQ2	36	40
N#CCc1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819422811	FH	On-Demand	Mild	ADRB1	50	36
N#CCc1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819422812	FH	On-Demand	Mild	ADRB1	50	36
CCOC(=O)N(C)c1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819422815	EH	On-Demand	Anodyne	LTA4H	35	40
CCOC(=O)N(C)c1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819422815	EH	On-Demand	Anodyne	SLC27A1	19	40
Cc1c(F)cccc1NC(=O)CCNc1cccc(N2CCCCC2)c1	ZINC000819422833	FJ	On-Demand	Anodyne	KCNQ2	68	40
O[C@@H](CNc1cccc(N2CCCCC2)c1)COCc1ccccc1	ZINC000819422846	EH	On-Demand	Anodyne	CASR	18	47
O[C@H](CNc1cccc(N2CCCCC2)c1)COCc1ccccc1	ZINC000819422847	EH	On-Demand	Anodyne	CASR	18	47
Cc1ccc(NC[C@H](O)c2cccc(F)c2)c(OC[C@@H]2CCCO2)c1	ZINC000819422880	EH	On-Demand	Anodyne	CYP3A4	44	32
Cc1ccc(NC[C@@H](O)c2cccc(F)c2)c(OC[C@H]2CCCO2)c1	ZINC000819422881	EH	On-Demand	Anodyne	CYP3A4	44	32
Cc1ccc(NC[C@H](O)c2cccc(F)c2)c(OC[C@H]2CCCO2)c1	ZINC000819422882	EH	On-Demand	Anodyne	CYP3A4	44	32
Cc1ccc(NC[C@@H](O)c2cccc(F)c2)c(OC[C@@H]2CCCO2)c1	ZINC000819422883	EH	On-Demand	Anodyne	CYP3A4	44	32
Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c(OCC(=O)N(C)C)c1	ZINC000819422909	FF	On-Demand	Bother	CACNA1D	55	33
Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(OCC(=O)N(C)C)c1	ZINC000819422910	FF	On-Demand	Bother	CACNA1D	55	33
COCCc1ccc(OC[C@@H](O)CNc2cccc(Cl)c2OC)cc1	ZINC000819422935	FG	On-Demand	Anodyne	ADRB2	41	57
COCCc1ccc(OC[C@@H](O)CNc2cccc(Cl)c2OC)cc1	ZINC000819422935	FG	On-Demand	Anodyne	ADRB1	62	57
COCCc1ccc(OC[C@@H](O)CNc2cccc(Cl)c2OC)cc1	ZINC000819422935	FG	On-Demand	Anodyne	ADRB3	41	45
COCCc1ccc(OC[C@H](O)CNc2cccc(Cl)c2OC)cc1	ZINC000819422937	FG	On-Demand	Anodyne	ADRB2	41	57
COCCc1ccc(OC[C@H](O)CNc2cccc(Cl)c2OC)cc1	ZINC000819422937	FG	On-Demand	Anodyne	ADRB1	62	57
COCCc1ccc(OC[C@H](O)CNc2cccc(Cl)c2OC)cc1	ZINC000819422937	FG	On-Demand	Anodyne	ADRB3	41	45
CN1Cc2ccc(NC[C@H](O)c3cccnc3)cc2C1	ZINC000819422949	CE	On-Demand	Anodyne	ADRB3	85	48
CN1Cc2ccc(NC[C@@H](O)c3cccnc3)cc2C1	ZINC000819422950	CE	On-Demand	Anodyne	ADRB3	85	48
N#CCCNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819422952	FH	On-Demand	Mild	HTR1A	15	42
N#CCCNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819422952	FH	On-Demand	Mild	DRD2	28	48
N#CCCNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819422952	FH	On-Demand	Mild	DRD4	48	48
N#CCCNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819422952	FH	On-Demand	Mild	DRD3	28	48
N#CCCNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819422952	FH	On-Demand	Mild	SIGMAR1	32	43
N#CCCNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819422952	FH	On-Demand	Mild	NPY2R	50	58
COc1cccc(OC)c1OC[C@@H](O)CNc1cc(C#N)ccc1OC(C)C	ZINC000819422957	GG	On-Demand	Mild	ADRB2	22	40
COc1cccc(OC)c1OC[C@H](O)CNc1cc(C#N)ccc1OC(C)C	ZINC000819422958	GG	On-Demand	Mild	ADRB2	22	40
COCCOc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1F	ZINC000819422968	GH	On-Demand	Anodyne	ADRB2	35	51
COCCOc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1F	ZINC000819422968	GH	On-Demand	Anodyne	ADRB1	48	37
COCCOc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1F	ZINC000819422968	GH	On-Demand	Anodyne	CASR	41	36
COCCOc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1F	ZINC000819422971	GH	On-Demand	Anodyne	ADRB2	35	51
COCCOc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1F	ZINC000819422971	GH	On-Demand	Anodyne	ADRB1	48	37
COCCOc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1F	ZINC000819422971	GH	On-Demand	Anodyne	CASR	41	36
CN1Cc2ccc(NC[C@]3(O)CCCN(C(=O)OC(C)(C)C)CC3)cc2C1	ZINC000819422976	GG	On-Demand	Anodyne	GPR119	24	43
CN1Cc2ccc(NC[C@@]3(O)CCCN(C(=O)OC(C)(C)C)CC3)cc2C1	ZINC000819422979	GG	On-Demand	Anodyne	GPR119	24	43
CC(=O)c1cccc(OC[C@H](O)CNc2cc(C#N)ccc2OC(C)C)c1	ZINC000819422997	FG	On-Demand	Mild	ADRB2	22	43
CC(=O)c1cccc(OC[C@H](O)CNc2cc(C#N)ccc2OC(C)C)c1	ZINC000819422997	FG	On-Demand	Mild	ADRB1	58	38
CC(=O)c1cccc(OC[C@H](O)CNc2cc(C#N)ccc2OC(C)C)c1	ZINC000819422997	FG	On-Demand	Mild	CASR	40	35
CC(=O)c1cccc(OC[C@H](O)CNc2cc(C#N)ccc2OC(C)C)c1	ZINC000819422997	FG	On-Demand	Mild	ABCB1	15	40
CC(=O)c1cccc(OC[C@@H](O)CNc2cc(C#N)ccc2OC(C)C)c1	ZINC000819422998	FG	On-Demand	Mild	ADRB2	22	43
CC(=O)c1cccc(OC[C@@H](O)CNc2cc(C#N)ccc2OC(C)C)c1	ZINC000819422998	FG	On-Demand	Mild	ADRB1	58	38
CC(=O)c1cccc(OC[C@@H](O)CNc2cc(C#N)ccc2OC(C)C)c1	ZINC000819422998	FG	On-Demand	Mild	CASR	40	35
CC(=O)c1cccc(OC[C@@H](O)CNc2cc(C#N)ccc2OC(C)C)c1	ZINC000819422998	FG	On-Demand	Mild	ABCB1	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](Oc3ccccc3Cl)C1)C2	ZINC000819423008	GG	On-Demand	Anodyne	SCD1	26	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](Oc3ccccc3Cl)C1)C2	ZINC000819423008	GG	On-Demand	Anodyne	SCD	20	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](Oc3ccccc3Cl)C1)C2	ZINC000819423009	GG	On-Demand	Anodyne	SCD1	26	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](Oc3ccccc3Cl)C1)C2	ZINC000819423009	GG	On-Demand	Anodyne	SCD	20	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](Oc3ccccc3Cl)C1)C2	ZINC000819423010	GG	On-Demand	Anodyne	SCD1	26	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](Oc3ccccc3Cl)C1)C2	ZINC000819423010	GG	On-Demand	Anodyne	SCD	20	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](Oc3ccccc3Cl)C1)C2	ZINC000819423011	GG	On-Demand	Anodyne	SCD1	26	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](Oc3ccccc3Cl)C1)C2	ZINC000819423011	GG	On-Demand	Anodyne	SCD	20	42
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc(N2CCCCC2)c1	ZINC000819423016	FG	On-Demand	Anodyne	HRH2	18	42
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc(N2CCCCC2)c1	ZINC000819423017	FG	On-Demand	Anodyne	HRH2	18	42
COCCc1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423021	GH	On-Demand	Anodyne	ADRB2	43	54
COCCc1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423021	GH	On-Demand	Anodyne	ADRB1	70	54
COCCc1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423021	GH	On-Demand	Anodyne	ADRB3	51	39
COCCc1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423021	GH	On-Demand	Anodyne	CASR	28	40
COCCc1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423022	GH	On-Demand	Anodyne	ADRB2	43	54
COCCc1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423022	GH	On-Demand	Anodyne	ADRB1	70	54
COCCc1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423022	GH	On-Demand	Anodyne	ADRB3	51	39
COCCc1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423022	GH	On-Demand	Anodyne	CASR	28	40
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819423027	GH	On-Demand	Anodyne	ADRB2	33	45
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819423027	GH	On-Demand	Anodyne	ADRB1	49	41
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819423027	GH	On-Demand	Anodyne	GRIN1	25	43
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819423027	GH	On-Demand	Anodyne	CDK4	18	40
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819423028	GH	On-Demand	Anodyne	ADRB2	33	45
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819423028	GH	On-Demand	Anodyne	ADRB1	49	41
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819423028	GH	On-Demand	Anodyne	GRIN1	25	43
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819423028	GH	On-Demand	Anodyne	CDK4	18	40
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819423039	FG	On-Demand	Mild	ADRB2	28	43
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819423039	FG	On-Demand	Mild	ADRB1	42	40
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819423040	FG	On-Demand	Mild	ADRB2	28	43
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819423040	FG	On-Demand	Mild	ADRB1	42	40
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819423042	FG	On-Demand	Anodyne	ADRB2	38	45
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819423042	FG	On-Demand	Anodyne	ADRB1	53	41
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819423042	FG	On-Demand	Anodyne	GRIN1	17	43
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819423043	FG	On-Demand	Anodyne	ADRB2	38	45
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819423043	FG	On-Demand	Anodyne	ADRB1	53	41
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819423043	FG	On-Demand	Anodyne	GRIN1	17	43
O[C@@H](CNc1cccc(N2CCCCC2)c1)COc1cccc2[nH]ccc12	ZINC000819423050	FI	On-Demand	Anodyne	ADRB2	20	58
O[C@@H](CNc1cccc(N2CCCCC2)c1)COc1cccc2[nH]ccc12	ZINC000819423050	FI	On-Demand	Anodyne	ADRB1	26	58
O[C@@H](CNc1cccc(N2CCCCC2)c1)COc1cccc2[nH]ccc12	ZINC000819423050	FI	On-Demand	Anodyne	HTR1A	16	58
O[C@@H](CNc1cccc(N2CCCCC2)c1)COc1cccc2[nH]ccc12	ZINC000819423050	FI	On-Demand	Anodyne	SLC6A4	18	41
O[C@@H](CNc1cccc(N2CCCCC2)c1)COc1cccc2[nH]ccc12	ZINC000819423050	FI	On-Demand	Anodyne	CYP2D6	16	41
O=C(CCNc1cccc(N2CCCCC2)c1)Nc1cccnc1	ZINC000819423064	DH	On-Demand	Anodyne	CHRNA7	18	45
O=C(CCNc1cccc(N2CCCCC2)c1)Nc1cccnc1	ZINC000819423064	DH	On-Demand	Anodyne	HDAC3	17	46
O=C(CCNc1cccc(N2CCCCC2)c1)Nc1cccnc1	ZINC000819423064	DH	On-Demand	Anodyne	HDAC6	17	46
O=C(CCNc1cccc(N2CCCCC2)c1)Nc1cccnc1	ZINC000819423064	DH	On-Demand	Anodyne	NAMPT	21	41
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819423067	FH	On-Demand	Anodyne	ADRB2	20	46
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819423068	FH	On-Demand	Anodyne	ADRB2	20	46
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819423071	GI	On-Demand	Anodyne	ADRB2	29	59
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819423071	GI	On-Demand	Anodyne	ADRB1	55	33
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819423071	GI	On-Demand	Anodyne	CYP2D6	21	44
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819423072	GI	On-Demand	Anodyne	ADRB2	29	59
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819423072	GI	On-Demand	Anodyne	ADRB1	55	33
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819423072	GI	On-Demand	Anodyne	CYP2D6	21	44
O[C@@H](CNc1ccc(OC2CCCC2)c(Cl)c1)c1cccnc1	ZINC000819423078	EI	On-Demand	Anodyne	ADRB1	27	49
O[C@@H](CNc1ccc(OC2CCCC2)c(Cl)c1)c1cccnc1	ZINC000819423078	EI	On-Demand	Anodyne	ADRB3	93	49
O[C@H](CNc1ccc(OC2CCCC2)c(Cl)c1)c1cccnc1	ZINC000819423079	EI	On-Demand	Anodyne	ADRB1	27	49
O[C@H](CNc1ccc(OC2CCCC2)c(Cl)c1)c1cccnc1	ZINC000819423079	EI	On-Demand	Anodyne	ADRB3	93	49
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423082	FH	On-Demand	Anodyne	ADRB2	35	42
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423082	FH	On-Demand	Anodyne	ADRB1	61	42
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423082	FH	On-Demand	Anodyne	ADRB3	40	36
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423082	FH	On-Demand	Anodyne	ABCB1	33	46
CC(=O)c1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423083	FH	On-Demand	Anodyne	ADRB2	35	42
CC(=O)c1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423083	FH	On-Demand	Anodyne	ADRB1	61	42
CC(=O)c1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423083	FH	On-Demand	Anodyne	ADRB3	40	36
CC(=O)c1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423083	FH	On-Demand	Anodyne	ABCB1	33	46
Cc1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423085	EH	On-Demand	Anodyne	ADRB2	40	49
Cc1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423085	EH	On-Demand	Anodyne	ADRB1	49	43
Cc1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423085	EH	On-Demand	Anodyne	ACOX1	44	33
Cc1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423086	EH	On-Demand	Anodyne	ADRB2	40	49
Cc1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423086	EH	On-Demand	Anodyne	ADRB1	49	43
Cc1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423086	EH	On-Demand	Anodyne	ACOX1	44	33
CC(=O)Nc1ccc(OC[C@H](O)CNc2cc(C#N)ccc2OC(C)C)cc1	ZINC000819423091	GG	On-Demand	Mild	ADRB2	30	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2cc(C#N)ccc2OC(C)C)cc1	ZINC000819423091	GG	On-Demand	Mild	ADRB1	63	39
CC(=O)Nc1ccc(OC[C@H](O)CNc2cc(C#N)ccc2OC(C)C)cc1	ZINC000819423091	GG	On-Demand	Mild	ADRB3	30	45
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cc(C#N)ccc2OC(C)C)cc1	ZINC000819423092	GG	On-Demand	Mild	ADRB2	30	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cc(C#N)ccc2OC(C)C)cc1	ZINC000819423092	GG	On-Demand	Mild	ADRB1	63	39
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cc(C#N)ccc2OC(C)C)cc1	ZINC000819423092	GG	On-Demand	Mild	ADRB3	30	45
COc1c(Cl)cccc1NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819423100	EH	On-Demand	Anodyne	MTNR1B	18	49
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423101	GI	On-Demand	Anodyne	ADRB2	45	41
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423101	GI	On-Demand	Anodyne	ADRB1	74	45
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423101	GI	On-Demand	Anodyne	ADRB3	59	41
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423101	GI	On-Demand	Anodyne	ABCB1	56	43
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423103	GI	On-Demand	Anodyne	ADRB2	45	41
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423103	GI	On-Demand	Anodyne	ADRB1	74	45
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423103	GI	On-Demand	Anodyne	ADRB3	59	41
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423103	GI	On-Demand	Anodyne	ABCB1	56	43
Cc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)c(OCC(=O)N(C)C)c1	ZINC000819423140	GF	On-Demand	Anodyne	ADRB2	18	53
Cc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)c(OCC(=O)N(C)C)c1	ZINC000819423140	GF	On-Demand	Anodyne	ADRB1	22	53
Cc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c(OCC(=O)N(C)C)c1	ZINC000819423143	GF	On-Demand	Anodyne	ADRB2	18	53
Cc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c(OCC(=O)N(C)C)c1	ZINC000819423143	GF	On-Demand	Anodyne	ADRB1	22	53
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000819423158	DG	On-Demand	Anodyne	SCD1	26	47
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](Oc2ccccc2Cl)C1	ZINC000819423160	DG	On-Demand	Anodyne	SCD1	26	47
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](Oc2ccccc2Cl)C1	ZINC000819423162	DG	On-Demand	Anodyne	SCD1	26	47
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](Oc2ccccc2Cl)C1	ZINC000819423164	DG	On-Demand	Anodyne	SCD1	26	47
CCOC(=O)N(C)c1ccc(NC[C@@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819423172	FG	On-Demand	Anodyne	MTNR1A	17	41
CCOC(=O)N(C)c1ccc(NC[C@@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819423172	FG	On-Demand	Anodyne	MTNR1B	22	41
CCOC(=O)N(C)c1ccc(NC[C@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819423173	FG	On-Demand	Anodyne	MTNR1A	17	41
CCOC(=O)N(C)c1ccc(NC[C@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819423173	FG	On-Demand	Anodyne	MTNR1B	22	41
CON(C)C(=O)CCNc1cccc(N2CCCCC2)c1	ZINC000819423184	CE	On-Demand	Anodyne	DRD4	41	32
COc1c(Cl)cccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819423252	FG	On-Demand	Bother	ADRB2	21	43
COc1c(Cl)cccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819423253	FG	On-Demand	Bother	ADRB2	21	43
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cnn(-c2ccccc2)n1	ZINC000819423282	II	On-Demand	Anodyne	EPHB3	52	37
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819423304	GG	On-Demand	Anodyne	ADRB2	19	44
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819423304	GG	On-Demand	Anodyne	PDS	46	39
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819423306	GG	On-Demand	Anodyne	ADRB2	19	44
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819423306	GG	On-Demand	Anodyne	PDS	46	39
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819423314	GI	On-Demand	Anodyne	ADRB2	35	50
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819423314	GI	On-Demand	Anodyne	ADRB1	37	40
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819423314	GI	On-Demand	Anodyne	ADRB3	26	40
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819423314	GI	On-Demand	Anodyne	CASR	40	38
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819423314	GI	On-Demand	Anodyne	PDS	44	32
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819423317	GI	On-Demand	Anodyne	ADRB2	35	50
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819423317	GI	On-Demand	Anodyne	ADRB1	37	40
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819423317	GI	On-Demand	Anodyne	ADRB3	26	40
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819423317	GI	On-Demand	Anodyne	CASR	40	38
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819423317	GI	On-Demand	Anodyne	PDS	44	32
CN1Cc2ccc(NC[C@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)cc2C1	ZINC000819423321	GG	On-Demand	Anodyne	GPR119	49	48
CN1Cc2ccc(NC[C@@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)cc2C1	ZINC000819423324	GG	On-Demand	Anodyne	GPR119	49	48
COCCOC(=O)Nc1cccc(NC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000819423354	GH	On-Demand	Anodyne	PDS	40	36
COCCOc1ccccc1NC[C@@H](O)COc1cccc2ccccc12	ZINC000819423359	FH	On-Demand	Clean	ADRB2	34	60
COCCOc1ccccc1NC[C@@H](O)COc1cccc2ccccc12	ZINC000819423359	FH	On-Demand	Clean	ADRB1	57	40
COCCOc1ccccc1NC[C@@H](O)COc1cccc2ccccc12	ZINC000819423359	FH	On-Demand	Clean	CASR	40	36
COCCOc1ccccc1NC[C@@H](O)COc1cccc2ccccc12	ZINC000819423359	FH	On-Demand	Clean	CYP2D6	23	48
COCCOc1ccccc1NC[C@H](O)COc1cccc2ccccc12	ZINC000819423364	FH	On-Demand	Clean	ADRB2	34	60
COCCOc1ccccc1NC[C@H](O)COc1cccc2ccccc12	ZINC000819423364	FH	On-Demand	Clean	ADRB1	57	40
COCCOc1ccccc1NC[C@H](O)COc1cccc2ccccc12	ZINC000819423364	FH	On-Demand	Clean	CASR	40	36
COCCOc1ccccc1NC[C@H](O)COc1cccc2ccccc12	ZINC000819423364	FH	On-Demand	Clean	CYP2D6	23	48
COCCOc1ccccc1NC[C@H](O)COC1CCOCC1	ZINC000819423368	ED	On-Demand	Clean	ADRB1	25	44
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1cccc(N2CCCCC2)c1	ZINC000819423369	GF	On-Demand	Anodyne	DRD4	40	30
COCCOc1ccccc1NC[C@@H](O)COC1CCOCC1	ZINC000819423371	ED	On-Demand	Clean	ADRB1	25	44
O=C(CCNc1cccc(N2CCCCC2)c1)Nc1ccccc1[N+](=O)[O-]	ZINC000819423375	FI	On-Demand	Bother	KCNQ2	61	38
O=C(CCNc1cccc(N2CCCCC2)c1)Nc1ccccc1[N+](=O)[O-]	ZINC000819423375	FI	On-Demand	Bother	SERPINE1	28	46
O=C(CCNc1cccc(N2CCCCC2)c1)Nc1ccccc1[N+](=O)[O-]	ZINC000819423375	FI	On-Demand	Bother	TAAR1	24	41
N#Cc1ccc(OC[C@@H](O)CNc2ccccc2OC[C@H]2CCCCO2)cc1	ZINC000819423385	GG	On-Demand	Mild	ADRB1	51	35
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)c1	ZINC000819423387	FH	On-Demand	Anodyne	ADRB2	22	44
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)c1	ZINC000819423387	FH	On-Demand	Anodyne	DRD4	42	32
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)c1	ZINC000819423387	FH	On-Demand	Anodyne	ABCB1	33	49
CC(=O)c1cccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)c1	ZINC000819423388	FH	On-Demand	Anodyne	ADRB2	22	44
CC(=O)c1cccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)c1	ZINC000819423388	FH	On-Demand	Anodyne	DRD4	42	32
CC(=O)c1cccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)c1	ZINC000819423388	FH	On-Demand	Anodyne	ABCB1	33	49
N#Cc1ccc(OC[C@@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)cc1	ZINC000819423393	GG	On-Demand	Mild	ADRB1	51	35
N#Cc1ccc(OC[C@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)cc1	ZINC000819423395	GG	On-Demand	Mild	ADRB1	51	35
N#Cc1ccc(OC[C@H](O)CNc2ccccc2OC[C@H]2CCCCO2)cc1	ZINC000819423398	GG	On-Demand	Mild	ADRB1	51	35
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423400	GG	On-Demand	Anodyne	ADRB2	47	55
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423400	GG	On-Demand	Anodyne	ADRB1	80	55
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423400	GG	On-Demand	Anodyne	ADRB3	55	45
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423400	GG	On-Demand	Anodyne	ACOX1	42	34
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423404	GG	On-Demand	Anodyne	ADRB2	47	55
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423404	GG	On-Demand	Anodyne	ADRB1	80	55
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423404	GG	On-Demand	Anodyne	ADRB3	55	45
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819423404	GG	On-Demand	Anodyne	ACOX1	42	34
COCCOc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819423415	DH	On-Demand	Anodyne	ADRB1	40	46
COCCOc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819423415	DH	On-Demand	Anodyne	ADRB3	59	46
COCCOc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819423415	DH	On-Demand	Anodyne	IGF1R	29	42
COCCOc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819423415	DH	On-Demand	Anodyne	CYP3A4	51	42
COCCOc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819423418	DH	On-Demand	Anodyne	ADRB1	40	46
COCCOc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819423418	DH	On-Demand	Anodyne	ADRB3	59	46
COCCOc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819423418	DH	On-Demand	Anodyne	IGF1R	29	42
COCCOc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819423418	DH	On-Demand	Anodyne	CYP3A4	51	42
COCCOc1ccccc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819423420	EF	On-Demand	Clean	ADRB2	50	45
COCCOc1ccccc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819423420	EF	On-Demand	Clean	ADRB1	71	45
COCCOc1ccccc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819423420	EF	On-Demand	Clean	ADRB3	36	41
COCCOc1ccccc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819423424	EF	On-Demand	Clean	ADRB2	50	45
COCCOc1ccccc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819423424	EF	On-Demand	Clean	ADRB1	71	45
COCCOc1ccccc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819423424	EF	On-Demand	Clean	ADRB3	36	41
COCCOc1ccccc1NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819423425	GE	On-Demand	Clean	ADRB2	21	40
COCCOc1ccccc1NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819423425	GE	On-Demand	Clean	ADRB1	28	45
COCCOc1ccccc1NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819423428	GE	On-Demand	Clean	ADRB2	21	40
COCCOc1ccccc1NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819423428	GE	On-Demand	Clean	ADRB1	28	45
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cc(Cl)nc2ccccc12	ZINC000819423447	JK	On-Demand	Anodyne	EPHB3	43	35
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cc(Cl)nc2ccccc12	ZINC000819423447	JK	On-Demand	Anodyne	NR2E3	52	33
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2cccc(CC)c2)cc1	ZINC000819423448	FH	On-Demand	Anodyne	ADRB2	37	45
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2cccc(CC)c2)cc1	ZINC000819423448	FH	On-Demand	Anodyne	ADRB1	47	40
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2cccc(CC)c2)cc1	ZINC000819423448	FH	On-Demand	Anodyne	PDS	76	39
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2cccc(CC)c2)cc1	ZINC000819423449	FH	On-Demand	Anodyne	ADRB2	37	45
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2cccc(CC)c2)cc1	ZINC000819423449	FH	On-Demand	Anodyne	ADRB1	47	40
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2cccc(CC)c2)cc1	ZINC000819423449	FH	On-Demand	Anodyne	PDS	76	39
COCCOC(=O)Nc1cccc(NC[C@@H](O)CN2CCOCC2)c1	ZINC000819423460	FC	On-Demand	Anodyne	CASR	36	41
COCCOC(=O)Nc1cccc(NC[C@@H](O)CN2CCOCC2)c1	ZINC000819423460	FC	On-Demand	Anodyne	EPHX2	26	42
O[C@H](CNc1ccc(CN2CCN(c3ccccn3)CC2)cc1)c1ccccc1	ZINC000819423462	GH	On-Demand	Anodyne	HTR1A	15	60
O[C@H](CNc1ccc(CN2CCN(c3ccccn3)CC2)cc1)c1ccccc1	ZINC000819423462	GH	On-Demand	Anodyne	DRD2	18	49
O[C@H](CNc1ccc(CN2CCN(c3ccccn3)CC2)cc1)c1ccccc1	ZINC000819423462	GH	On-Demand	Anodyne	DRD4	46	49
CC(=O)c1ccc(OC[C@H](O)CNc2cc(C#N)ccc2OC(C)C)cc1	ZINC000819423469	FG	On-Demand	Mild	ADRB2	19	40
CC(=O)c1ccc(OC[C@H](O)CNc2cc(C#N)ccc2OC(C)C)cc1	ZINC000819423469	FG	On-Demand	Mild	ADRB1	53	36
O[C@@H](CNc1ccc(CN2CCN(c3ccccn3)CC2)cc1)c1ccccc1	ZINC000819423470	GH	On-Demand	Anodyne	HTR1A	15	60
O[C@@H](CNc1ccc(CN2CCN(c3ccccn3)CC2)cc1)c1ccccc1	ZINC000819423470	GH	On-Demand	Anodyne	DRD2	18	49
O[C@@H](CNc1ccc(CN2CCN(c3ccccn3)CC2)cc1)c1ccccc1	ZINC000819423470	GH	On-Demand	Anodyne	DRD4	46	49
CC(=O)c1ccc(OC[C@@H](O)CNc2cc(C#N)ccc2OC(C)C)cc1	ZINC000819423473	FG	On-Demand	Mild	ADRB2	19	40
CC(=O)c1ccc(OC[C@@H](O)CNc2cc(C#N)ccc2OC(C)C)cc1	ZINC000819423473	FG	On-Demand	Mild	ADRB1	53	36
O[C@H](CNc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1cccnc1	ZINC000819423482	EG	On-Demand	Anodyne	CYP3A4	47	35
O[C@H](CNc1cc(Cl)ccc1OC[C@H]1CCCO1)c1cccnc1	ZINC000819423487	EG	On-Demand	Anodyne	CYP3A4	47	35
O[C@@H](CNc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1cccnc1	ZINC000819423491	EG	On-Demand	Anodyne	CYP3A4	47	35
O[C@@H](CNc1cc(Cl)ccc1OC[C@H]1CCCO1)c1cccnc1	ZINC000819423495	EG	On-Demand	Anodyne	CYP3A4	47	35
COCCOc1ccccc1NC[C@H](O)COc1cccc(Br)c1	ZINC000819423497	GG	On-Demand	Clean	ADRB2	35	41
COCCOc1ccccc1NC[C@H](O)COc1cccc(Br)c1	ZINC000819423497	GG	On-Demand	Clean	ADRB1	43	41
COCCOc1ccccc1NC[C@H](O)COc1cccc(Br)c1	ZINC000819423497	GG	On-Demand	Clean	PDS	53	42
COCCOc1ccccc1NC[C@@H](O)COc1cccc(Br)c1	ZINC000819423501	GG	On-Demand	Clean	ADRB2	35	41
COCCOc1ccccc1NC[C@@H](O)COc1cccc(Br)c1	ZINC000819423501	GG	On-Demand	Clean	ADRB1	43	41
COCCOc1ccccc1NC[C@@H](O)COc1cccc(Br)c1	ZINC000819423501	GG	On-Demand	Clean	PDS	53	42
CC(=O)OC1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(C)cc2)CC1	ZINC000819423505	DF	On-Demand	Anodyne	SLC6A3	22	43
CC(=O)OC1CCN(C(=O)[C@@H]2C[C@@H]2c2ccc(C)cc2)CC1	ZINC000819423510	DF	On-Demand	Anodyne	SLC6A3	22	43
CC(=O)OC1CCN(C(=O)[C@H]2C[C@H]2c2ccc(C)cc2)CC1	ZINC000819423513	DF	On-Demand	Anodyne	SLC6A3	22	43
COCCOc1ccccc1NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819423515	GG	On-Demand	Anodyne	HCN1	66	33
COCCOc1ccccc1NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819423515	GG	On-Demand	Anodyne	HCN4	50	32
CC(=O)OC1CCN(C(=O)[C@H]2C[C@@H]2c2ccc(C)cc2)CC1	ZINC000819423516	DF	On-Demand	Anodyne	SLC6A3	22	43
COCCOc1ccccc1NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819423518	GG	On-Demand	Anodyne	HCN1	66	33
COCCOc1ccccc1NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819423518	GG	On-Demand	Anodyne	HCN4	50	32
COCCOc1ccc(NC[C@H](O)COc2cc(C)ccc2C)cc1F	ZINC000819423533	FG	On-Demand	Anodyne	ADRB2	18	45
COCCOc1ccc(NC[C@H](O)COc2cc(C)ccc2C)cc1F	ZINC000819423533	FG	On-Demand	Anodyne	ADRB1	43	34
COCCOc1ccc(NC[C@@H](O)COc2cc(C)ccc2C)cc1F	ZINC000819423535	FG	On-Demand	Anodyne	ADRB2	18	45
COCCOc1ccc(NC[C@@H](O)COc2cc(C)ccc2C)cc1F	ZINC000819423535	FG	On-Demand	Anodyne	ADRB1	43	34
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819423538	EG	On-Demand	Anodyne	ADRB2	33	41
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819423538	EG	On-Demand	Anodyne	ADRB1	46	38
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819423538	EG	On-Demand	Anodyne	ADRB3	25	41
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819423538	EG	On-Demand	Anodyne	ABCB1	15	49
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819423542	EG	On-Demand	Anodyne	ADRB2	33	41
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819423542	EG	On-Demand	Anodyne	ADRB1	46	38
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819423542	EG	On-Demand	Anodyne	ADRB3	25	41
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819423542	EG	On-Demand	Anodyne	ABCB1	15	49
COCCOc1ccccc1NC[C@H](O)COc1ccccc1F	ZINC000819423545	EF	On-Demand	Clean	ADRB2	29	45
COCCOc1ccccc1NC[C@H](O)COc1ccccc1F	ZINC000819423545	EF	On-Demand	Clean	ADRB1	61	42
COCCOc1ccccc1NC[C@@H](O)COc1ccccc1F	ZINC000819423547	EF	On-Demand	Clean	ADRB2	29	45
COCCOc1ccccc1NC[C@@H](O)COc1ccccc1F	ZINC000819423547	EF	On-Demand	Clean	ADRB1	61	42
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2cccc(F)c2C)c1	ZINC000819423551	GH	On-Demand	Anodyne	KCNK3	56	33
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2cccc(F)c2C)c1	ZINC000819423551	GH	On-Demand	Anodyne	KCNK9	52	33
O=C(O)CCCNC(=O)CCSc1ccccn1	ZINC000819423554	CD	On-Demand	Anodyne	FAS	23	45
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819423555	FG	On-Demand	Anodyne	KCNK3	69	38
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819423555	FG	On-Demand	Anodyne	KCNK9	69	37
Cc1ccc(NC[C@H](O)c2cccnc2)c(OC[C@H]2CCCO2)c1	ZINC000819423558	EG	On-Demand	Anodyne	ADRB3	46	40
O=C(O)CCCNC(=O)CNC(=O)c1ccc(Br)s1	ZINC000819423560	ED	On-Demand	Anodyne	FOLR1	15	42
Cc1ccc(NC[C@@H](O)c2cccnc2)c(OC[C@@H]2CCCO2)c1	ZINC000819423562	EG	On-Demand	Anodyne	ADRB3	46	40
Cc1ccc(NC[C@@H](O)c2cccnc2)c(OC[C@H]2CCCO2)c1	ZINC000819423566	EG	On-Demand	Anodyne	ADRB3	46	40
Cc1ccc(NC[C@H](O)c2cccnc2)c(OC[C@@H]2CCCO2)c1	ZINC000819423569	EG	On-Demand	Anodyne	ADRB3	46	40
O=C(O)CCCNC(=O)Cc1ccc(-n2cccc2)cc1	ZINC000819423573	CE	On-Demand	Anodyne	MME	17	55
O=C(O)CCCNC(=O)Cc1ccc(-n2cccc2)cc1	ZINC000819423573	CE	On-Demand	Anodyne	CA5B	17	41
O=C(O)CCCNC(=O)Cc1ccc(-n2cccc2)cc1	ZINC000819423573	CE	On-Demand	Anodyne	CA5A	15	41
O=C(O)CCCNC(=O)Cc1ccc(-n2cccc2)cc1	ZINC000819423573	CE	On-Demand	Anodyne	CRTM	23	40
O=C(O)CCCNC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000819423587	DC	On-Demand	Bother	CACNA1D	40	32
O=C(O)CCCNC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000819423587	DC	On-Demand	Bother	CCR2	15	48
CC(=O)OC1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819423597	FE	On-Demand	Mild	PAPA1_CARPA	31	41
O=C(O)CCCNC(=O)CSc1ncnc2scc(-c3ccccc3)c12	ZINC000819423605	GG	On-Demand	Anodyne	TGM2	15	44
COc1c(Cl)cccc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819423609	DH	On-Demand	Anodyne	ADRB2	26	56
COc1c(Cl)cccc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819423609	DH	On-Demand	Anodyne	ADRB1	24	56
COc1c(Cl)cccc1NC[C@H](O)COc1cccc(C)c1	ZINC000819423611	DH	On-Demand	Anodyne	ADRB2	26	56
COc1c(Cl)cccc1NC[C@H](O)COc1cccc(C)c1	ZINC000819423611	DH	On-Demand	Anodyne	ADRB1	24	56
O=C(O)CCCNC(=O)CCOc1ccc2ccccc2c1	ZINC000819423618	DF	On-Demand	Anodyne	HRH2	24	40
O=C(O)CCCNC(=O)CCOc1ccc2ccccc2c1	ZINC000819423618	DF	On-Demand	Anodyne	PPARG	15	47
O=C(O)CCCNC(=O)CCOc1ccc2ccccc2c1	ZINC000819423618	DF	On-Demand	Anodyne	CYSLTR1	33	48
O=C(O)CCCNC(=O)CCOc1ccc2ccccc2c1	ZINC000819423618	DF	On-Demand	Anodyne	LTA4H	25	44
O=C(O)CCCNC(=O)CCOc1ccc2ccccc2c1	ZINC000819423618	DF	On-Demand	Anodyne	PLA2G2A	16	42
O=C(O)CCCNC(=O)CCOc1ccc2ccccc2c1	ZINC000819423618	DF	On-Demand	Anodyne	SERPINE1	16	40
O=C(O)CCCNC(=O)CCOc1ccc2ccccc2c1	ZINC000819423618	DF	On-Demand	Anodyne	MTNR1A	56	45
O=C(O)CCCNC(=O)CCOc1ccc2ccccc2c1	ZINC000819423618	DF	On-Demand	Anodyne	MTNR1B	43	45
O=C(O)CCCNC(=O)CCOc1ccc2ccccc2c1	ZINC000819423618	DF	On-Demand	Anodyne	PLA2G4B	56	34
O=C(O)CCCNC(=O)CCc1nc2ccccc2oc1=O	ZINC000819423619	DD	On-Demand	Anodyne	MTNR1A	21	41
O=C(O)CCCNC(=O)CCc1nc2ccccc2oc1=O	ZINC000819423619	DD	On-Demand	Anodyne	MTNR1B	24	41
O=C(O)CCCNC(=O)CNC(=O)c1ccccc1I	ZINC000819423620	GD	On-Demand	Anodyne	MME	16	42
O=C(O)CCCNC(=O)Cc1cc2ccccc2o1	ZINC000819423623	CD	On-Demand	Anodyne	MTNR1A	21	43
O=C(O)CCCNC(=O)Cc1cc2ccccc2o1	ZINC000819423623	CD	On-Demand	Anodyne	MTNR1B	21	43
O=C(O)CCCNC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000819423626	FF	On-Demand	Anodyne	GSK3A	36	40
O=C(O)CCCNC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1	ZINC000819423626	FF	On-Demand	Anodyne	ALOX15	53	45
COc1c(Cl)cccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819423631	GH	On-Demand	Anodyne	GPR119	41	47
COc1c(Cl)cccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819423633	GH	On-Demand	Anodyne	GPR119	41	47
O=C(O)CCCNC(=O)Cc1c[nH]c2cc(Br)ccc12	ZINC000819423634	EE	On-Demand	Anodyne	ACHE	27	44
O=C(O)CCCNC(=O)Cc1c[nH]c2cc(Br)ccc12	ZINC000819423634	EE	On-Demand	Anodyne	GRIN1	18	40
O=C(O)CCCNC(=O)Cc1c[nH]c2cc(Br)ccc12	ZINC000819423634	EE	On-Demand	Anodyne	TPR	22	63
O=C(O)CCCNC(=O)Cc1c[nH]c2cc(Br)ccc12	ZINC000819423634	EE	On-Demand	Anodyne	GRIA1	24	41
O=C(O)CCCNC(=O)Cc1c[nH]c2cc(Br)ccc12	ZINC000819423634	EE	On-Demand	Anodyne	KISS1R	44	30
O=C(O)CCCNC(=O)COc1ccc2ccccc2c1Br	ZINC000819423643	FF	On-Demand	Anodyne	NCEH1	53	49
O=C(O)CCCNC(=O)CCCc1ccccc1Br	ZINC000819423654	EF	On-Demand	Anodyne	MME	16	46
O=C(O)CCCNC(=O)CCCc1ccccc1Br	ZINC000819423654	EF	On-Demand	Anodyne	HDAC8	17	47
O=C(O)CCCNC(=O)CCCc1ccccc1Br	ZINC000819423654	EF	On-Demand	Anodyne	MTNR1A	30	42
O=C(O)CCCNC(=O)CCCc1ccccc1Br	ZINC000819423654	EF	On-Demand	Anodyne	CA9	17	43
O=C(O)CCCNC(=O)CCCc1ccccc1Br	ZINC000819423654	EF	On-Demand	Anodyne	POLG_WNV	42	31
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819423663	EG	On-Demand	Anodyne	ADRB2	37	45
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819423663	EG	On-Demand	Anodyne	ADRB1	44	37
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819423663	EG	On-Demand	Anodyne	ADRB3	19	45
O=C(O)CCCNC(=O)CCCc1nc2ccccc2[nH]1	ZINC000819423664	CD	On-Demand	Anodyne	HDAC2	18	40
O=C(O)CCCNC(=O)CCCc1nc2ccccc2[nH]1	ZINC000819423664	CD	On-Demand	Anodyne	HDAC9	33	44
COCCOc1ccc(NCCC(=O)Nc2cccnc2)cc1F	ZINC000819423668	EF	On-Demand	Anodyne	MET	69	40
COCCOc1ccc(NCCC(=O)Nc2cccnc2)cc1F	ZINC000819423668	EF	On-Demand	Anodyne	ENPP1	41	32
COCCOc1ccc(NCCC(=O)Nc2cc(C)on2)cc1F	ZINC000819423675	EF	On-Demand	Anodyne	MET	44	36
C#CCNC(=O)CCNc1ccc(N2CCN(CCC)CC2)c(Cl)c1	ZINC000819423678	FE	On-Demand	Mild	HTR1A	37	41
C#CCNC(=O)CCNc1ccc(N2CCN(CCC)CC2)c(Cl)c1	ZINC000819423678	FE	On-Demand	Mild	DRD2	45	43
C#CCNC(=O)CCNc1ccc(N2CCN(CCC)CC2)c(Cl)c1	ZINC000819423678	FE	On-Demand	Mild	HTR2A	28	40
C#CCNC(=O)CCNc1ccc(N2CCN(CCC)CC2)c(Cl)c1	ZINC000819423678	FE	On-Demand	Mild	HTR2C	27	40
C#CCNC(=O)CCNc1ccc(N2CCN(CCC)CC2)c(Cl)c1	ZINC000819423678	FE	On-Demand	Mild	DRD3	80	43
C#CCNC(=O)CCNc1ccc(N2CCN(CCC)CC2)c(Cl)c1	ZINC000819423678	FE	On-Demand	Mild	NPY2R	62	43
COCCOc1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)cc1F	ZINC000819423692	FG	On-Demand	Anodyne	ADRB2	20	46
COCCOc1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)cc1F	ZINC000819423693	FG	On-Demand	Anodyne	ADRB2	20	46
CC(=O)OC1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819423737	FE	On-Demand	Mild	PAPA1_CARPA	31	41
COCCOc1ccccc1NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819423761	FH	On-Demand	Clean	ADRB2	42	57
COCCOc1ccccc1NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819423761	FH	On-Demand	Clean	ADRB1	49	38
COCCOc1ccccc1NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819423761	FH	On-Demand	Clean	ADRB3	20	40
COCCOc1ccccc1NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819423761	FH	On-Demand	Clean	CASR	45	42
COCCOc1ccccc1NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819423761	FH	On-Demand	Clean	CYP2D6	22	43
COCCOc1ccccc1NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819423764	FH	On-Demand	Clean	ADRB2	42	57
COCCOc1ccccc1NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819423764	FH	On-Demand	Clean	ADRB1	49	38
COCCOc1ccccc1NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819423764	FH	On-Demand	Clean	ADRB3	20	40
COCCOc1ccccc1NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819423764	FH	On-Demand	Clean	CASR	45	42
COCCOc1ccccc1NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819423764	FH	On-Demand	Clean	CYP2D6	22	43
COCCOc1ccccc1NC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819423774	GH	On-Demand	Clean	ADRB2	27	42
COCCOc1ccccc1NC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819423777	GH	On-Demand	Clean	ADRB2	27	42
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2cccnc2)c1	ZINC000819423783	FF	On-Demand	Anodyne	CSF1R	15	41
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2cccnc2)c1	ZINC000819423783	FF	On-Demand	Anodyne	KCNK3	49	34
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2cccnc2)c1	ZINC000819423783	FF	On-Demand	Anodyne	KCNK9	47	33
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2cccc(Cl)c2)c1	ZINC000819423785	GH	On-Demand	Anodyne	KCNK3	76	40
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2cccc(Cl)c2)c1	ZINC000819423785	GH	On-Demand	Anodyne	KCNK9	60	40
CC(=O)OC1CCN(C(=O)c2cc(-c3ccc4ccccc4c3)[nH]n2)CC1	ZINC000819423787	FG	On-Demand	Anodyne	GRIN2B	31	40
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2cc(F)cc(F)c2)c1	ZINC000819423788	GH	On-Demand	Anodyne	KCNK3	64	35
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2cc(F)cc(F)c2)c1	ZINC000819423788	GH	On-Demand	Anodyne	KCNK9	59	35
COCCOc1ccccc1NC[C@H](O)c1ccccc1	ZINC000819423800	CF	On-Demand	Anodyne	AOC3	15	43
COCCOc1ccccc1NC[C@@H](O)c1ccccc1	ZINC000819423801	CF	On-Demand	Anodyne	AOC3	15	43
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819423822	FG	On-Demand	Anodyne	KCNK3	56	35
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819423822	FG	On-Demand	Anodyne	KCNK9	60	35
O=C(CCNc1cccc(N2CCCCC2)c1)Nc1ccccc1F	ZINC000819423823	EI	On-Demand	Anodyne	KCNQ2	75	44
COCCOC(=O)Nc1cccc(NCCS(C)(=O)=O)c1	ZINC000819423826	DD	On-Demand	Anodyne	KCNK3	106	37
COCCOC(=O)Nc1cccc(NCCS(C)(=O)=O)c1	ZINC000819423826	DD	On-Demand	Anodyne	KCNK9	78	37
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819423827	GH	On-Demand	Anodyne	ADRB2	22	56
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819423827	GH	On-Demand	Anodyne	ADRB1	48	34
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819423829	GH	On-Demand	Anodyne	ADRB2	22	56
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819423829	GH	On-Demand	Anodyne	ADRB1	48	34
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819423835	FH	On-Demand	Anodyne	ADRB2	23	42
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819423835	FH	On-Demand	Anodyne	ADRB1	40	46
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819423835	FH	On-Demand	Anodyne	ADRB3	60	44
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819423835	FH	On-Demand	Anodyne	CYP3A4	41	37
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819423835	FH	On-Demand	Anodyne	KCNK3	46	39
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819423835	FH	On-Demand	Anodyne	KCNK9	44	39
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819423838	GI	On-Demand	Anodyne	KCNK3	45	42
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819423838	GI	On-Demand	Anodyne	KCNK9	45	34
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819423838	GI	On-Demand	Anodyne	PDS	42	42
O[C@@H](CNc1cccc(N2CCCCC2)c1)c1cccc(Cl)c1	ZINC000819423842	EI	On-Demand	Anodyne	ADRB1	27	42
O[C@@H](CNc1cccc(N2CCCCC2)c1)c1cccc(Cl)c1	ZINC000819423842	EI	On-Demand	Anodyne	ADRB3	40	40
O[C@@H](CNc1cccc(N2CCCCC2)c1)c1cccc(Cl)c1	ZINC000819423842	EI	On-Demand	Anodyne	IGF1R	31	41
O[C@@H](CNc1cccc(N2CCCCC2)c1)c1cccc(Cl)c1	ZINC000819423842	EI	On-Demand	Anodyne	CYP3A4	53	41
O[C@H](CNc1cccc(N2CCCCC2)c1)c1cccc(Cl)c1	ZINC000819423844	EI	On-Demand	Anodyne	ADRB1	27	42
O[C@H](CNc1cccc(N2CCCCC2)c1)c1cccc(Cl)c1	ZINC000819423844	EI	On-Demand	Anodyne	ADRB3	40	40
O[C@H](CNc1cccc(N2CCCCC2)c1)c1cccc(Cl)c1	ZINC000819423844	EI	On-Demand	Anodyne	IGF1R	31	41
O[C@H](CNc1cccc(N2CCCCC2)c1)c1cccc(Cl)c1	ZINC000819423844	EI	On-Demand	Anodyne	CYP3A4	53	41
OC1(CNc2ccc(CN3CCN(c4ccccn4)CC3)cc2)CCCCC1	ZINC000819423845	GH	On-Demand	Anodyne	DRD2	17	47
OC1(CNc2ccc(CN3CCN(c4ccccn4)CC3)cc2)CCCCC1	ZINC000819423845	GH	On-Demand	Anodyne	DRD4	42	47
COCCOc1ccccc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819423854	FE	On-Demand	Clean	EDNRA	42	38
COCCOc1ccccc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819423857	FE	On-Demand	Clean	EDNRA	42	38
COCCOc1ccccc1NC[C@H](O)COc1cc(C)ccc1C	ZINC000819423880	EG	On-Demand	Clean	ADRB2	30	48
COCCOc1ccccc1NC[C@H](O)COc1cc(C)ccc1C	ZINC000819423880	EG	On-Demand	Clean	ADRB1	61	37
COCCOc1ccccc1NC[C@H](O)COc1cc(C)ccc1C	ZINC000819423880	EG	On-Demand	Clean	CASR	40	37
COCCOc1ccccc1NC[C@H](O)COc1cc(C)ccc1C	ZINC000819423880	EG	On-Demand	Clean	CYP2D6	21	41
COCCOc1ccccc1NC[C@@H](O)COc1cc(C)ccc1C	ZINC000819423881	EG	On-Demand	Clean	ADRB2	30	48
COCCOc1ccccc1NC[C@@H](O)COc1cc(C)ccc1C	ZINC000819423881	EG	On-Demand	Clean	ADRB1	61	37
COCCOc1ccccc1NC[C@@H](O)COc1cc(C)ccc1C	ZINC000819423881	EG	On-Demand	Clean	CASR	40	37
COCCOc1ccccc1NC[C@@H](O)COc1cc(C)ccc1C	ZINC000819423881	EG	On-Demand	Clean	CYP2D6	21	41
O=C(CCNc1cccc(N2CCCCC2)c1)Nc1ccccc1	ZINC000819423891	DI	On-Demand	Anodyne	HRH2	16	40
O=C(CCNc1cccc(N2CCCCC2)c1)Nc1ccccc1	ZINC000819423891	DI	On-Demand	Anodyne	KCNQ2	68	41
O=C(CCNc1cccc(N2CCCCC2)c1)Nc1ccccc1	ZINC000819423891	DI	On-Demand	Anodyne	CHRNA7	16	45
O=C(CCNc1cccc(N2CCCCC2)c1)Nc1ccccc1	ZINC000819423891	DI	On-Demand	Anodyne	HDAC10	22	40
O=C(CCNc1cccc(N2CCCCC2)c1)Nc1ccccc1	ZINC000819423891	DI	On-Demand	Anodyne	HDAC3	27	40
O=C(CCNc1cccc(N2CCCCC2)c1)Nc1ccccc1	ZINC000819423891	DI	On-Demand	Anodyne	HDAC6	22	40
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc(Oc2ccccc2C#N)cc1	ZINC000819423892	GI	On-Demand	Mild	ADRB1	65	41
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc(Oc2ccccc2C#N)cc1	ZINC000819423892	GI	On-Demand	Mild	CYP2D6	15	41
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc(Oc2ccccc2C#N)cc1	ZINC000819423895	GI	On-Demand	Mild	ADRB1	65	41
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc(Oc2ccccc2C#N)cc1	ZINC000819423895	GI	On-Demand	Mild	CYP2D6	15	41
O[C@@H](CNc1cc(Cl)ccc1OC[C@H]1CCCO1)c1cccc(F)c1	ZINC000819423897	FI	On-Demand	Anodyne	CYP3A4	49	37
O[C@H](CNc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1cccc(F)c1	ZINC000819423900	FI	On-Demand	Anodyne	CYP3A4	49	37
O[C@H](CNc1cc(Cl)ccc1OC[C@H]1CCCO1)c1cccc(F)c1	ZINC000819423902	FI	On-Demand	Anodyne	CYP3A4	49	37
O[C@@H](CNc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1cccc(F)c1	ZINC000819423904	FI	On-Demand	Anodyne	CYP3A4	49	37
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819423920	GH	On-Demand	Anodyne	KCNK3	42	31
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccccc2C(C)C)cc1	ZINC000819423928	GI	On-Demand	Anodyne	ADRB2	27	47
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccccc2C(C)C)cc1	ZINC000819423928	GI	On-Demand	Anodyne	ADRB1	48	33
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccccc2C(C)C)cc1	ZINC000819423929	GI	On-Demand	Anodyne	ADRB2	27	47
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccccc2C(C)C)cc1	ZINC000819423929	GI	On-Demand	Anodyne	ADRB1	48	33
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)c1	ZINC000819423952	FG	On-Demand	Bother	ADRB1	15	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)c1	ZINC000819423953	FG	On-Demand	Bother	ADRB1	15	44
COCCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1F	ZINC000819423963	FG	On-Demand	Anodyne	ADRB2	31	41
COCCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1F	ZINC000819423963	FG	On-Demand	Anodyne	ADRB1	54	41
COCCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1F	ZINC000819423963	FG	On-Demand	Anodyne	GRIN1	24	42
COCCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1F	ZINC000819423964	FG	On-Demand	Anodyne	ADRB2	31	41
COCCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1F	ZINC000819423964	FG	On-Demand	Anodyne	ADRB1	54	41
COCCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1F	ZINC000819423964	FG	On-Demand	Anodyne	GRIN1	24	42
COCCOc1ccc(NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)cc1F	ZINC000819423979	GH	On-Demand	Anodyne	PPARA	21	40
COCCOc1ccc(NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)cc1F	ZINC000819423979	GH	On-Demand	Anodyne	PPARD	45	42
COCCOc1ccc(NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)cc1F	ZINC000819423980	GH	On-Demand	Anodyne	PPARA	21	40
COCCOc1ccc(NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)cc1F	ZINC000819423980	GH	On-Demand	Anodyne	PPARD	45	42
Cc1ccc(NC[C@H](O)c2ccccc2)c(OC[C@@H]2CCCO2)c1	ZINC000819423994	EH	On-Demand	Anodyne	CYP3A4	43	31
Cc1ccc(NC[C@@H](O)c2ccccc2)c(OC[C@H]2CCCO2)c1	ZINC000819423995	EH	On-Demand	Anodyne	CYP3A4	43	31
Cc1ccc(NC[C@H](O)c2ccccc2)c(OC[C@H]2CCCO2)c1	ZINC000819423996	EH	On-Demand	Anodyne	CYP3A4	43	31
Cc1ccc(NC[C@@H](O)c2ccccc2)c(OC[C@@H]2CCCO2)c1	ZINC000819423997	EH	On-Demand	Anodyne	CYP3A4	43	31
Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c(OC[C@@H]2CCCO2)c1	ZINC000819424004	FH	On-Demand	Bother	CACNA1D	40	33
Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c(OC[C@@H]2CCCO2)c1	ZINC000819424004	FH	On-Demand	Bother	CYP3A4	44	32
Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(OC[C@H]2CCCO2)c1	ZINC000819424005	FH	On-Demand	Bother	CACNA1D	40	33
Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(OC[C@H]2CCCO2)c1	ZINC000819424005	FH	On-Demand	Bother	CYP3A4	44	32
Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c(OC[C@H]2CCCO2)c1	ZINC000819424006	FH	On-Demand	Bother	CACNA1D	40	33
Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c(OC[C@H]2CCCO2)c1	ZINC000819424006	FH	On-Demand	Bother	CYP3A4	44	32
Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(OC[C@@H]2CCCO2)c1	ZINC000819424007	FH	On-Demand	Bother	CACNA1D	40	33
Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(OC[C@@H]2CCCO2)c1	ZINC000819424007	FH	On-Demand	Bother	CYP3A4	44	32
COc1c(Cl)cccc1NC[C@@H](O)COc1ccccc1F	ZINC000819424008	EG	On-Demand	Anodyne	ADRB2	25	44
COc1c(Cl)cccc1NC[C@@H](O)COc1ccccc1F	ZINC000819424008	EG	On-Demand	Anodyne	CYP2D6	17	41
COc1c(Cl)cccc1NC[C@H](O)COc1ccccc1F	ZINC000819424009	EG	On-Demand	Anodyne	ADRB2	25	44
COc1c(Cl)cccc1NC[C@H](O)COc1ccccc1F	ZINC000819424009	EG	On-Demand	Anodyne	CYP2D6	17	41
COCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1F	ZINC000819424010	FG	On-Demand	Anodyne	KDR	21	43
COCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1F	ZINC000819424010	FG	On-Demand	Anodyne	MET	69	42
COCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1F	ZINC000819424010	FG	On-Demand	Anodyne	AURKA	21	43
COCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1F	ZINC000819424010	FG	On-Demand	Anodyne	KCNK3	47	36
COCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1F	ZINC000819424010	FG	On-Demand	Anodyne	KCNK9	49	36
COCCOc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1F	ZINC000819424019	FF	On-Demand	Bother	CACNA1C	50	37
COCCOc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1F	ZINC000819424019	FF	On-Demand	Bother	CACNA1D	75	37
COCCOc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1F	ZINC000819424020	FF	On-Demand	Bother	CACNA1C	50	37
COCCOc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1F	ZINC000819424020	FF	On-Demand	Bother	CACNA1D	75	37
C=CCOc1cccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819424022	GH	On-Demand	Mild	GPR119	48	46
C=CCOc1cccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819424023	GH	On-Demand	Mild	GPR119	48	46
COCCOc1ccc(NCCC(=O)NC(N)=O)cc1F	ZINC000819424036	CC	On-Demand	Anodyne	MET	55	36
COCCOc1ccc(NCCC(=O)NC(N)=O)cc1F	ZINC000819424036	CC	On-Demand	Anodyne	DRTS_TRYCR	40	35
COCCOc1ccc(NCCC(N)=O)cc1F	ZINC000819424049	CD	On-Demand	Anodyne	DRTS_TRYCR	51	38
COCCOc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1F	ZINC000819424050	FF	On-Demand	Mild	ADRB1	57	36
COCCOc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1F	ZINC000819424051	FF	On-Demand	Mild	ADRB1	57	36
COCCOc1ccccc1NC[C@H](O)COc1ccc(Br)cc1	ZINC000819424056	GG	On-Demand	Clean	ADRB2	46	44
COCCOc1ccccc1NC[C@H](O)COc1ccc(Br)cc1	ZINC000819424056	GG	On-Demand	Clean	ADRB1	61	44
COCCOc1ccccc1NC[C@H](O)COc1ccc(Br)cc1	ZINC000819424056	GG	On-Demand	Clean	ADRB3	27	40
COCCOc1ccccc1NC[C@@H](O)COc1ccc(Br)cc1	ZINC000819424057	GG	On-Demand	Clean	ADRB2	46	44
COCCOc1ccccc1NC[C@@H](O)COc1ccc(Br)cc1	ZINC000819424057	GG	On-Demand	Clean	ADRB1	61	44
COCCOc1ccccc1NC[C@@H](O)COc1ccc(Br)cc1	ZINC000819424057	GG	On-Demand	Clean	ADRB3	27	40
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2cccc(F)c2)c1	ZINC000819424058	GG	On-Demand	Anodyne	KCNK3	72	41
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2cccc(F)c2)c1	ZINC000819424058	GG	On-Demand	Anodyne	KCNK9	64	41
COCCOc1ccccc1NC[C@H](O)COc1ccccc1C	ZINC000819424068	EF	On-Demand	Clean	ADRB2	34	58
COCCOc1ccccc1NC[C@H](O)COc1ccccc1C	ZINC000819424068	EF	On-Demand	Clean	ADRB1	56	35
COCCOc1ccccc1NC[C@H](O)COc1ccccc1C	ZINC000819424068	EF	On-Demand	Clean	CYP2D6	18	44
COCCOc1ccccc1NC[C@@H](O)COc1ccccc1C	ZINC000819424069	EF	On-Demand	Clean	ADRB2	34	58
COCCOc1ccccc1NC[C@@H](O)COc1ccccc1C	ZINC000819424069	EF	On-Demand	Clean	ADRB1	56	35
COCCOc1ccccc1NC[C@@H](O)COc1ccccc1C	ZINC000819424069	EF	On-Demand	Clean	CYP2D6	18	44
COCCOc1ccccc1NC[C@H](O)COc1cccc(C)c1	ZINC000819424070	EF	On-Demand	Clean	ADRB2	41	56
COCCOc1ccccc1NC[C@H](O)COc1cccc(C)c1	ZINC000819424070	EF	On-Demand	Clean	ADRB1	49	56
COCCOc1ccccc1NC[C@H](O)COc1cccc(C)c1	ZINC000819424070	EF	On-Demand	Clean	PDS	41	40
COCCOc1ccccc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819424071	EF	On-Demand	Clean	ADRB2	41	56
COCCOc1ccccc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819424071	EF	On-Demand	Clean	ADRB1	49	56
COCCOc1ccccc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819424071	EF	On-Demand	Clean	PDS	41	40
COCCOc1ccccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819424081	DC	On-Demand	Clean	ABCB1	69	40
COCCOc1ccccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819424082	DC	On-Demand	Clean	ABCB1	69	40
COCCOC(=O)Nc1cccc(NCCS(=O)(=O)c2ccc(F)cc2)c1	ZINC000819424085	GF	On-Demand	Anodyne	KCNK3	55	36
COCCOC(=O)Nc1cccc(NCCS(=O)(=O)c2ccc(F)cc2)c1	ZINC000819424085	GF	On-Demand	Anodyne	KCNK9	59	36
O[C@@H](CNc1ccc(CN2CCN(c3ccccn3)CC2)cc1)C1CC1	ZINC000819424086	FF	On-Demand	Anodyne	DRD2	18	46
O[C@@H](CNc1ccc(CN2CCN(c3ccccn3)CC2)cc1)C1CC1	ZINC000819424086	FF	On-Demand	Anodyne	DRD4	42	46
O[C@@H](CNc1ccc(CN2CCN(c3ccccn3)CC2)cc1)C1CC1	ZINC000819424086	FF	On-Demand	Anodyne	SIGMAR1	16	44
O[C@H](CNc1ccc(CN2CCN(c3ccccn3)CC2)cc1)C1CC1	ZINC000819424087	FF	On-Demand	Anodyne	DRD2	18	46
O[C@H](CNc1ccc(CN2CCN(c3ccccn3)CC2)cc1)C1CC1	ZINC000819424087	FF	On-Demand	Anodyne	DRD4	42	46
O[C@H](CNc1ccc(CN2CCN(c3ccccn3)CC2)cc1)C1CC1	ZINC000819424087	FF	On-Demand	Anodyne	SIGMAR1	16	44
O[C@H](CNc1ccc(CN2CCN(c3ccccn3)CC2)cc1)c1cccnc1	ZINC000819424088	GF	On-Demand	Anodyne	DRD4	37	44
O[C@H](CNc1ccc(CN2CCN(c3ccccn3)CC2)cc1)c1cccnc1	ZINC000819424088	GF	On-Demand	Anodyne	ADRB3	87	51
O[C@@H](CNc1ccc(CN2CCN(c3ccccn3)CC2)cc1)c1cccnc1	ZINC000819424089	GF	On-Demand	Anodyne	DRD4	37	44
O[C@@H](CNc1ccc(CN2CCN(c3ccccn3)CC2)cc1)c1cccnc1	ZINC000819424089	GF	On-Demand	Anodyne	ADRB3	87	51
COCCOc1ccccc1NC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000819424099	GH	On-Demand	Clean	ADRB2	23	42
COCCOc1ccccc1NC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000819424100	GH	On-Demand	Clean	ADRB2	23	42
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819424115	EE	On-Demand	Anodyne	ADRB2	22	47
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819424115	EE	On-Demand	Anodyne	ADRB1	29	43
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819424115	EE	On-Demand	Anodyne	ADRB3	93	49
COCCOc1ccccc1NC[C@H](O)COc1ccc(Cl)cc1	ZINC000819424117	FG	On-Demand	Clean	ADRB2	48	44
COCCOc1ccccc1NC[C@H](O)COc1ccc(Cl)cc1	ZINC000819424117	FG	On-Demand	Clean	ADRB1	66	44
COCCOc1ccccc1NC[C@H](O)COc1ccc(Cl)cc1	ZINC000819424117	FG	On-Demand	Clean	ADRB3	33	40
COCCOc1ccccc1NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819424118	FG	On-Demand	Clean	ADRB2	48	44
COCCOc1ccccc1NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819424118	FG	On-Demand	Clean	ADRB1	66	44
COCCOc1ccccc1NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819424118	FG	On-Demand	Clean	ADRB3	33	40
Cc1ccccc1[C@@H](O)CNc1cccc(NC(=O)OCC(C)C)c1	ZINC000819424125	EI	On-Demand	Anodyne	KCNK3	62	37
Cc1ccccc1[C@@H](O)CNc1cccc(NC(=O)OCC(C)C)c1	ZINC000819424125	EI	On-Demand	Anodyne	KCNK9	64	37
CC(=O)OC1CCN(C(=O)c2coc(=O)c3ccccc23)CC1	ZINC000819424139	DD	On-Demand	Anodyne	L3MBTL3	25	43
COCCOc1ccccc1NC[C@H](O)c1cc(OC)ccc1OC	ZINC000819424147	EF	On-Demand	Anodyne	ADRB2	15	45
COCCOc1ccccc1NC[C@H](O)c1cc(OC)ccc1OC	ZINC000819424147	EF	On-Demand	Anodyne	MTNR1A	19	41
COCCOc1ccccc1NC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819424148	EF	On-Demand	Anodyne	ADRB2	15	45
COCCOc1ccccc1NC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819424148	EF	On-Demand	Anodyne	MTNR1A	19	41
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2ccccc2F)c1	ZINC000819424151	GG	On-Demand	Anodyne	KCNK3	75	36
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2ccccc2F)c1	ZINC000819424151	GG	On-Demand	Anodyne	KCNK9	64	36
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc(C)cc2C)cc1	ZINC000819424164	FH	On-Demand	Anodyne	ADRB2	16	42
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc(C)cc2C)cc1	ZINC000819424165	FH	On-Demand	Anodyne	ADRB2	16	42
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1	ZINC000819424180	FG	On-Demand	Anodyne	ADRB2	29	56
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1	ZINC000819424180	FG	On-Demand	Anodyne	ADRB1	31	51
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1	ZINC000819424180	FG	On-Demand	Anodyne	PDS	66	42
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2cccc(C)c2)cc1	ZINC000819424181	FG	On-Demand	Anodyne	ADRB2	29	56
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2cccc(C)c2)cc1	ZINC000819424181	FG	On-Demand	Anodyne	ADRB1	31	51
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2cccc(C)c2)cc1	ZINC000819424181	FG	On-Demand	Anodyne	PDS	66	42
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(C#N)ccc2OC(C)C)cc1	ZINC000819424182	GF	On-Demand	Mild	ADRB2	24	43
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(C#N)ccc2OC(C)C)cc1	ZINC000819424182	GF	On-Demand	Mild	ADRB1	49	36
COC(=O)c1ccc(OC[C@H](O)CNc2cc(C#N)ccc2OC(C)C)cc1	ZINC000819424183	GF	On-Demand	Mild	ADRB2	24	43
COC(=O)c1ccc(OC[C@H](O)CNc2cc(C#N)ccc2OC(C)C)cc1	ZINC000819424183	GF	On-Demand	Mild	ADRB1	49	36
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819424201	GG	On-Demand	Bother	ADRB1	15	44
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819424201	GG	On-Demand	Bother	CACNA1C	48	36
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819424201	GG	On-Demand	Bother	CACNA1D	75	33
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819424201	GG	On-Demand	Bother	PDS	39	45
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819424202	GG	On-Demand	Bother	ADRB1	15	44
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819424202	GG	On-Demand	Bother	CACNA1C	48	36
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819424202	GG	On-Demand	Bother	CACNA1D	75	33
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819424202	GG	On-Demand	Bother	PDS	39	45
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819424213	GG	On-Demand	Anodyne	ADRB2	28	49
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819424213	GG	On-Demand	Anodyne	ADRB1	40	43
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819424214	GG	On-Demand	Anodyne	ADRB2	28	49
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819424214	GG	On-Demand	Anodyne	ADRB1	40	43
O[C@@H](CNc1cccc(N2CCCCC2)c1)COc1ccc(F)cc1	ZINC000819424219	EH	On-Demand	Anodyne	ADRB1	54	39
O[C@@H](CNc1cccc(N2CCCCC2)c1)COc1ccc(F)cc1	ZINC000819424219	EH	On-Demand	Anodyne	ABCB1	20	43
O[C@H](CNc1cccc(N2CCCCC2)c1)COc1ccc(F)cc1	ZINC000819424220	EH	On-Demand	Anodyne	ADRB1	54	39
O[C@H](CNc1cccc(N2CCCCC2)c1)COc1ccc(F)cc1	ZINC000819424220	EH	On-Demand	Anodyne	ABCB1	20	43
COCCOc1ccc(NCC2(O)CCS(=O)(=O)CC2)cc1F	ZINC000819424256	ED	On-Demand	Anodyne	MET	40	37
COCCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1F	ZINC000819424261	FG	On-Demand	Anodyne	ADRB2	17	55
COCCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1F	ZINC000819424261	FG	On-Demand	Anodyne	ADRB1	42	55
COCCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1F	ZINC000819424261	FG	On-Demand	Anodyne	SLC6A4	15	40
COCCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1F	ZINC000819424262	FG	On-Demand	Anodyne	ADRB2	17	55
COCCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1F	ZINC000819424262	FG	On-Demand	Anodyne	ADRB1	42	55
COCCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1F	ZINC000819424262	FG	On-Demand	Anodyne	SLC6A4	15	40
COc1c(Cl)cccc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819424271	EG	On-Demand	Anodyne	ABCB1B	40	32
COc1c(Cl)cccc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819424271	EG	On-Demand	Anodyne	NOD2	40	37
COc1c(Cl)cccc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819424272	EG	On-Demand	Anodyne	ABCB1B	40	32
COc1c(Cl)cccc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819424272	EG	On-Demand	Anodyne	NOD2	40	37
COCCOc1ccc(NC[C@H](O)c2cccnc2)cc1F	ZINC000819424320	DE	On-Demand	Anodyne	ADRB1	23	41
COCCOc1ccc(NC[C@H](O)c2cccnc2)cc1F	ZINC000819424320	DE	On-Demand	Anodyne	ADRB3	81	45
COCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1F	ZINC000819424321	DE	On-Demand	Anodyne	ADRB1	23	41
COCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1F	ZINC000819424321	DE	On-Demand	Anodyne	ADRB3	81	45
Cc1ccc(NC[C@H](O)c2cccnc2)c(OCC(=O)N(C)C)c1	ZINC000819424336	EE	On-Demand	Anodyne	ADRB3	51	43
Cc1ccc(NC[C@@H](O)c2cccnc2)c(OCC(=O)N(C)C)c1	ZINC000819424337	EE	On-Demand	Anodyne	ADRB3	51	43
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819424338	FG	On-Demand	Anodyne	ADRB2	46	55
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819424338	FG	On-Demand	Anodyne	ADRB1	74	55
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819424338	FG	On-Demand	Anodyne	TSHR	42	33
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819424338	FG	On-Demand	Anodyne	GRIN1	28	42
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819424338	FG	On-Demand	Anodyne	ADRB3	50	48
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819424339	FG	On-Demand	Anodyne	ADRB2	46	55
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819424339	FG	On-Demand	Anodyne	ADRB1	74	55
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819424339	FG	On-Demand	Anodyne	TSHR	42	33
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819424339	FG	On-Demand	Anodyne	GRIN1	28	42
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819424339	FG	On-Demand	Anodyne	ADRB3	50	48
COCCOc1ccc(NC[C@@H](O)Cn2cccn2)cc1F	ZINC000819424367	DD	On-Demand	Anodyne	MET	44	37
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819424368	GI	On-Demand	Anodyne	MTTP	47	37
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819424368	GI	On-Demand	Anodyne	KCNK3	65	40
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819424368	GI	On-Demand	Anodyne	KCNK9	54	34
COCCOc1ccccc1NC[C@H](O)COc1cc(C)cc(C)c1	ZINC000819424378	EG	On-Demand	Clean	ADRB2	38	50
COCCOc1ccccc1NC[C@H](O)COc1cc(C)cc(C)c1	ZINC000819424378	EG	On-Demand	Clean	ADRB1	46	43
COCCOc1ccccc1NC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000819424379	EG	On-Demand	Clean	ADRB2	38	50
COCCOc1ccccc1NC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000819424379	EG	On-Demand	Clean	ADRB1	46	43
COCCOC(=O)Nc1cccc(NC[C@@H](O)Cc2ccc(F)cc2)c1	ZINC000819424393	FG	On-Demand	Anodyne	KCNK3	51	35
COCCOC(=O)Nc1cccc(NC[C@@H](O)Cc2ccc(F)cc2)c1	ZINC000819424393	FG	On-Demand	Anodyne	KCNK9	59	35
COCCOC(=O)Nc1cccc(NCCS(=O)(=O)c2ccccc2)c1	ZINC000819424399	GF	On-Demand	Anodyne	KCNK3	101	38
COCCOC(=O)Nc1cccc(NCCS(=O)(=O)c2ccccc2)c1	ZINC000819424399	GF	On-Demand	Anodyne	KCNK9	73	37
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819424403	GI	On-Demand	Anodyne	KCNK3	83	44
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819424403	GI	On-Demand	Anodyne	KCNK9	76	44
COCCOC(=O)Nc1cccc(NC[C@@H](O)Cc2ccc3ccccc3c2)c1	ZINC000819424407	GI	On-Demand	Anodyne	KCNK3	51	35
COCCOC(=O)Nc1cccc(NC[C@@H](O)Cc2ccc3ccccc3c2)c1	ZINC000819424407	GI	On-Demand	Anodyne	KCNK9	52	35
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819424409	GF	On-Demand	Bother	CACNA1C	42	37
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819424409	GF	On-Demand	Bother	CACNA1D	67	36
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccccc2F)cc1	ZINC000819424439	FG	On-Demand	Anodyne	ADRB2	21	48
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccccc2F)cc1	ZINC000819424439	FG	On-Demand	Anodyne	ADRB1	56	36
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccccc2F)cc1	ZINC000819424441	FG	On-Demand	Anodyne	ADRB2	21	48
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccccc2F)cc1	ZINC000819424441	FG	On-Demand	Anodyne	ADRB1	56	36
CN(C)c1ncc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cn1	ZINC000819424442	FE	On-Demand	Mild	PAPA1_CARPA	40	45
CN(C)c1ncc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cn1	ZINC000819424443	FE	On-Demand	Mild	PAPA1_CARPA	40	45
COCCOc1ccccc1NC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819424444	GH	On-Demand	Clean	ADRB2	23	42
COCCOc1ccccc1NC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819424446	GH	On-Demand	Clean	ADRB2	23	42
CON(C)C(=O)CCNc1ccc(CN2CCN(c3ccccn3)CC2)cc1	ZINC000819424448	GE	On-Demand	Anodyne	HTR1A	23	45
CON(C)C(=O)CCNc1ccc(CN2CCN(c3ccccn3)CC2)cc1	ZINC000819424448	GE	On-Demand	Anodyne	DRD2	26	42
CON(C)C(=O)CCNc1ccc(CN2CCN(c3ccccn3)CC2)cc1	ZINC000819424448	GE	On-Demand	Anodyne	DRD4	49	45
CON(C)C(=O)CCNc1ccc(CN2CCN(c3ccccn3)CC2)cc1	ZINC000819424448	GE	On-Demand	Anodyne	DRD3	22	43
CON(C)C(=O)CCNc1ccc(CN2CCN(c3ccccn3)CC2)cc1	ZINC000819424448	GE	On-Demand	Anodyne	NOD2	40	35
O=[N+]([O-])c1cccc([C@@H](O)CNc2cc(Cl)ccc2OC[C@H]2CCCO2)c1	ZINC000819424470	GH	On-Demand	Bother	CYP3A4	49	36
O=[N+]([O-])c1cccc([C@H](O)CNc2cc(Cl)ccc2OC[C@@H]2CCCO2)c1	ZINC000819424472	GH	On-Demand	Bother	CYP3A4	49	36
O=[N+]([O-])c1cccc([C@H](O)CNc2cc(Cl)ccc2OC[C@H]2CCCO2)c1	ZINC000819424474	GH	On-Demand	Bother	CYP3A4	49	36
O=[N+]([O-])c1cccc([C@@H](O)CNc2cc(Cl)ccc2OC[C@@H]2CCCO2)c1	ZINC000819424476	GH	On-Demand	Bother	CYP3A4	49	36
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819424479	GI	On-Demand	Anodyne	KCNK3	46	37
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819424479	GI	On-Demand	Anodyne	KCNK9	40	37
CC(=O)Nc1cccc(CC(=O)N2CCC(OC(C)=O)CC2)c1	ZINC000819424485	DD	On-Demand	Anodyne	TSHR	42	31
CC(=O)Nc1cccc(CC(=O)N2CCC(OC(C)=O)CC2)c1	ZINC000819424485	DD	On-Demand	Anodyne	HTR1D	15	40
CC(=O)Nc1cccc(CC(=O)N2CCC(OC(C)=O)CC2)c1	ZINC000819424485	DD	On-Demand	Anodyne	CCR3	52	38
CC(=O)Nc1cccc(CC(=O)N2CCC(OC(C)=O)CC2)c1	ZINC000819424485	DD	On-Demand	Anodyne	MLNR	31	40
CC(=O)Nc1cccc(CC(=O)N2CCC(OC(C)=O)CC2)c1	ZINC000819424485	DD	On-Demand	Anodyne	EPHX2	36	42
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819424516	GG	On-Demand	Anodyne	ADRB2	44	43
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819424516	GG	On-Demand	Anodyne	ADRB1	71	41
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819424516	GG	On-Demand	Anodyne	ADRB3	51	41
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819424516	GG	On-Demand	Anodyne	ABCB1	31	40
COC(=O)c1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819424517	GG	On-Demand	Anodyne	ADRB2	44	43
COC(=O)c1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819424517	GG	On-Demand	Anodyne	ADRB1	71	41
COC(=O)c1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819424517	GG	On-Demand	Anodyne	ADRB3	51	41
COC(=O)c1ccc(OC[C@H](O)CNc2cccc(N3CCCCC3)c2)cc1	ZINC000819424517	GG	On-Demand	Anodyne	ABCB1	31	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(Oc2ccccc2C#N)cc1	ZINC000819424534	GI	On-Demand	Mild	ADRB1	44	35
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(Oc2ccccc2C#N)cc1	ZINC000819424535	GI	On-Demand	Mild	ADRB1	44	35
O[C@@H](CNc1cc(Cl)ccc1OC[C@H]1CCCO1)c1ccccc1	ZINC000819424536	EI	On-Demand	Anodyne	CYP3A4	48	36
O[C@H](CNc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1ccccc1	ZINC000819424537	EI	On-Demand	Anodyne	CYP3A4	48	36
O[C@H](CNc1cc(Cl)ccc1OC[C@H]1CCCO1)c1ccccc1	ZINC000819424538	EI	On-Demand	Anodyne	CYP3A4	48	36
O[C@@H](CNc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1ccccc1	ZINC000819424539	EI	On-Demand	Anodyne	CYP3A4	48	36
O[C@@H](CNc1cccc(N2CCCCC2)c1)COc1ccccc1	ZINC000819424546	EH	On-Demand	Anodyne	ADRB2	45	47
O[C@@H](CNc1cccc(N2CCCCC2)c1)COc1ccccc1	ZINC000819424546	EH	On-Demand	Anodyne	ADRB1	57	42
O[C@@H](CNc1cccc(N2CCCCC2)c1)COc1ccccc1	ZINC000819424546	EH	On-Demand	Anodyne	ADRB3	41	42
O[C@@H](CNc1cccc(N2CCCCC2)c1)COc1ccccc1	ZINC000819424546	EH	On-Demand	Anodyne	ABCB1	32	40
O[C@H](CNc1cccc(N2CCCCC2)c1)COc1ccccc1	ZINC000819424547	EH	On-Demand	Anodyne	ADRB2	45	47
O[C@H](CNc1cccc(N2CCCCC2)c1)COc1ccccc1	ZINC000819424547	EH	On-Demand	Anodyne	ADRB1	57	42
O[C@H](CNc1cccc(N2CCCCC2)c1)COc1ccccc1	ZINC000819424547	EH	On-Demand	Anodyne	ADRB3	41	42
O[C@H](CNc1cccc(N2CCCCC2)c1)COc1ccccc1	ZINC000819424547	EH	On-Demand	Anodyne	ABCB1	32	40
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819424550	EG	On-Demand	Anodyne	ADRB2	51	51
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819424550	EG	On-Demand	Anodyne	ADRB1	63	45
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819424550	EG	On-Demand	Anodyne	ADRB3	43	45
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819424550	EG	On-Demand	Anodyne	PDS	61	37
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819424551	EG	On-Demand	Anodyne	ADRB2	51	51
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819424551	EG	On-Demand	Anodyne	ADRB1	63	45
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819424551	EG	On-Demand	Anodyne	ADRB3	43	45
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819424551	EG	On-Demand	Anodyne	PDS	61	37
COCCOc1ccc(NC[C@H](O)Cn2cccn2)cc1F	ZINC000819424555	DD	On-Demand	Anodyne	MET	44	37
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819424557	GH	On-Demand	Anodyne	ADRB2	46	43
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819424557	GH	On-Demand	Anodyne	ADRB1	71	48
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819424557	GH	On-Demand	Anodyne	ADRB3	49	43
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819424558	GH	On-Demand	Anodyne	ADRB2	46	43
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819424558	GH	On-Demand	Anodyne	ADRB1	71	48
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819424558	GH	On-Demand	Anodyne	ADRB3	49	43
COCCOc1ccccc1NC[C@H](O)COc1ccc(C)cc1C	ZINC000819424585	EG	On-Demand	Clean	ADRB2	28	46
COCCOc1ccccc1NC[C@@H](O)COc1ccc(C)cc1C	ZINC000819424586	EG	On-Demand	Clean	ADRB2	28	46
COCCOc1ccccc1NC[C@H](O)COc1ccccc1	ZINC000819424587	DF	On-Demand	Clean	ADRB2	57	52
COCCOc1ccccc1NC[C@H](O)COc1ccccc1	ZINC000819424587	DF	On-Demand	Clean	ADRB1	75	46
COCCOc1ccccc1NC[C@H](O)COc1ccccc1	ZINC000819424587	DF	On-Demand	Clean	ADRB3	38	46
COCCOc1ccccc1NC[C@H](O)COc1ccccc1	ZINC000819424587	DF	On-Demand	Clean	CYP2D6	15	41
COCCOc1ccccc1NC[C@H](O)COc1ccccc1	ZINC000819424587	DF	On-Demand	Clean	ABCB1	28	40
COCCOc1ccccc1NC[C@@H](O)COc1ccccc1	ZINC000819424588	DF	On-Demand	Clean	ADRB2	57	52
COCCOc1ccccc1NC[C@@H](O)COc1ccccc1	ZINC000819424588	DF	On-Demand	Clean	ADRB1	75	46
COCCOc1ccccc1NC[C@@H](O)COc1ccccc1	ZINC000819424588	DF	On-Demand	Clean	ADRB3	38	46
COCCOc1ccccc1NC[C@@H](O)COc1ccccc1	ZINC000819424588	DF	On-Demand	Clean	CYP2D6	15	41
COCCOc1ccccc1NC[C@@H](O)COc1ccccc1	ZINC000819424588	DF	On-Demand	Clean	ABCB1	28	40
COCCOC(=O)Nc1cccc(NC[C@@H](O)[C@H](C)c2ccccc2)c1	ZINC000819424660	FG	On-Demand	Anodyne	KCNK3	84	37
COCCOC(=O)Nc1cccc(NC[C@@H](O)[C@H](C)c2ccccc2)c1	ZINC000819424660	FG	On-Demand	Anodyne	KCNK9	60	37
COCCOC(=O)Nc1cccc(NC[C@@H](O)[C@@H](C)c2ccccc2)c1	ZINC000819424661	FG	On-Demand	Anodyne	KCNK3	84	37
COCCOC(=O)Nc1cccc(NC[C@@H](O)[C@@H](C)c2ccccc2)c1	ZINC000819424661	FG	On-Demand	Anodyne	KCNK9	60	37
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819424669	GF	On-Demand	Bother	CACNA1C	57	40
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819424669	GF	On-Demand	Bother	CACNA1D	87	40
NC(=O)CCNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819424670	FF	On-Demand	Anodyne	HTR1A	41	44
NC(=O)CCNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819424670	FF	On-Demand	Anodyne	DRD2	62	46
NC(=O)CCNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819424670	FF	On-Demand	Anodyne	DRD4	78	46
NC(=O)CCNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819424670	FF	On-Demand	Anodyne	ACHE	33	41
NC(=O)CCNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819424670	FF	On-Demand	Anodyne	ADRA1A	15	43
NC(=O)CCNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819424670	FF	On-Demand	Anodyne	DRD3	69	46
NC(=O)CCNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819424670	FF	On-Demand	Anodyne	HTR7	23	42
NC(=O)CCNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819424670	FF	On-Demand	Anodyne	SIGMAR1	44	41
NC(=O)CCNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819424670	FF	On-Demand	Anodyne	NPY2R	98	65
NC(=O)CCNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819424670	FF	On-Demand	Anodyne	NPFFR2	33	43
NC(=O)CCNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819424670	FF	On-Demand	Anodyne	FAAH	15	42
NC(=O)CCNc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1	ZINC000819424670	FF	On-Demand	Anodyne	NPFFR1	44	43
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819424675	FG	On-Demand	Anodyne	KCNK3	49	33
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819424675	FG	On-Demand	Anodyne	KCNK9	52	33
COCCOc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819424676	EE	On-Demand	Mild	ADRB2	42	44
COCCOc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819424676	EE	On-Demand	Mild	ADRB1	73	41
COCCOc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819424676	EE	On-Demand	Mild	ADRB3	22	44
COCCOc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819424676	EE	On-Demand	Mild	CASR	42	39
COCCOc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819424676	EE	On-Demand	Mild	CYP2D6	22	44
COCCOc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819424676	EE	On-Demand	Mild	CTRB_BOVIN	45	34
COCCOc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819424678	EE	On-Demand	Mild	ADRB2	42	44
COCCOc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819424678	EE	On-Demand	Mild	ADRB1	73	41
COCCOc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819424678	EE	On-Demand	Mild	ADRB3	22	44
COCCOc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819424678	EE	On-Demand	Mild	CASR	42	39
COCCOc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819424678	EE	On-Demand	Mild	CYP2D6	22	44
COCCOc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819424678	EE	On-Demand	Mild	CTRB_BOVIN	45	34
COCCOc1ccc(NC[C@H](O)c2ccccc2C)cc1F	ZINC000819424682	DG	On-Demand	Anodyne	CTSA	40	33
COCCOc1ccc(NC[C@@H](O)c2ccccc2C)cc1F	ZINC000819424683	DG	On-Demand	Anodyne	CTSA	40	33
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1	ZINC000819424690	FG	On-Demand	Anodyne	ADRB2	38	47
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1	ZINC000819424690	FG	On-Demand	Anodyne	ADRB1	49	43
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1	ZINC000819424693	FG	On-Demand	Anodyne	ADRB2	38	47
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1	ZINC000819424693	FG	On-Demand	Anodyne	ADRB1	49	43
COC(=O)c1ccc(OC[C@H](O)CNc2cccc(Cl)c2OC)cc1	ZINC000819424698	FF	On-Demand	Anodyne	ADRB2	43	44
COC(=O)c1ccc(OC[C@H](O)CNc2cccc(Cl)c2OC)cc1	ZINC000819424698	FF	On-Demand	Anodyne	ADRB1	62	42
COC(=O)c1ccc(OC[C@H](O)CNc2cccc(Cl)c2OC)cc1	ZINC000819424698	FF	On-Demand	Anodyne	GRIN1	20	41
COC(=O)c1ccc(OC[C@H](O)CNc2cccc(Cl)c2OC)cc1	ZINC000819424698	FF	On-Demand	Anodyne	ADRB3	40	42
NC(=O)CCNc1ccc(OC2CCCC2)c(Cl)c1	ZINC000819424705	CF	On-Demand	Anodyne	PDE4A	30	41
NC(=O)CCNc1ccc(OC2CCCC2)c(Cl)c1	ZINC000819424705	CF	On-Demand	Anodyne	PDE4B	19	41
NC(=O)CCNc1ccc(OC2CCCC2)c(Cl)c1	ZINC000819424705	CF	On-Demand	Anodyne	PDE4D	19	42
NC(=O)CCNc1ccc(OC2CCCC2)c(Cl)c1	ZINC000819424705	CF	On-Demand	Anodyne	PDE4C	15	41
CC(=O)OC1CCN(C(=O)CCc2cccc(OC(F)F)c2)CC1	ZINC000819424706	EF	On-Demand	Anodyne	C3AR1	40	39
COCCOC(=O)Nc1cccc(NC[C@H](O)C2CC2)c1	ZINC000819424711	CE	On-Demand	Anodyne	KCNK3	105	38
COCCOC(=O)Nc1cccc(NC[C@H](O)C2CC2)c1	ZINC000819424711	CE	On-Demand	Anodyne	KCNK9	78	38
COCCOC(=O)Nc1cccc(NC[C@@H](O)C2CC2)c1	ZINC000819424712	CE	On-Demand	Anodyne	KCNK3	105	38
COCCOC(=O)Nc1cccc(NC[C@@H](O)C2CC2)c1	ZINC000819424712	CE	On-Demand	Anodyne	KCNK9	78	38
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819424717	GG	On-Demand	Mild	ADRB2	33	41
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819424717	GG	On-Demand	Mild	ADRB1	49	39
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819424719	GG	On-Demand	Mild	ADRB2	33	41
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819424719	GG	On-Demand	Mild	ADRB1	49	39
CN1Cc2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2C1	ZINC000819424725	DG	On-Demand	Anodyne	ADRB1	26	47
CN1Cc2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2C1	ZINC000819424725	DG	On-Demand	Anodyne	ADRB3	39	42
CN1Cc2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2C1	ZINC000819424725	DG	On-Demand	Anodyne	CYP3A4	41	36
CN1Cc2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2C1	ZINC000819424727	DG	On-Demand	Anodyne	ADRB1	26	47
CN1Cc2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2C1	ZINC000819424727	DG	On-Demand	Anodyne	ADRB3	39	42
CN1Cc2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2C1	ZINC000819424727	DG	On-Demand	Anodyne	CYP3A4	41	36
COCCOc1ccccc1NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819424740	FH	On-Demand	Anodyne	ADRB3	15	41
COCCOc1ccccc1NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819424740	FH	On-Demand	Anodyne	P2RY1	46	38
COCCOc1ccccc1NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819424742	FH	On-Demand	Anodyne	ADRB3	15	41
COCCOc1ccccc1NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819424742	FH	On-Demand	Anodyne	P2RY1	46	38
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc(Cl)c2OC)cc1	ZINC000819424765	FF	On-Demand	Anodyne	ADRB2	43	44
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc(Cl)c2OC)cc1	ZINC000819424765	FF	On-Demand	Anodyne	ADRB1	62	42
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc(Cl)c2OC)cc1	ZINC000819424765	FF	On-Demand	Anodyne	GRIN1	20	41
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc(Cl)c2OC)cc1	ZINC000819424765	FF	On-Demand	Anodyne	ADRB3	40	42
N#Cc1ccccc1Oc1ccc(NC[C@H](O)C2CC2)cc1	ZINC000819424770	CH	On-Demand	Mild	ADRB1	46	36
N#Cc1ccccc1Oc1ccc(NC[C@@H](O)C2CC2)cc1	ZINC000819424772	CH	On-Demand	Mild	ADRB1	46	36
CN(CC1(O)CCCC1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819424791	FE	On-Demand	Mild	PAPA1_CARPA	34	43
CN(CC1(O)CCCC1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819424793	FE	On-Demand	Mild	PAPA1_CARPA	34	43
COCCOc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1F	ZINC000819424809	FG	On-Demand	Anodyne	ADRB2	23	44
COCCOc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1F	ZINC000819424809	FG	On-Demand	Anodyne	ADRB1	56	36
COCCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1F	ZINC000819424811	FG	On-Demand	Anodyne	ADRB2	23	44
COCCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1F	ZINC000819424811	FG	On-Demand	Anodyne	ADRB1	56	36
COc1c(Cl)cccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819424813	EG	On-Demand	Anodyne	ADRB2	22	44
COc1c(Cl)cccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819424813	EG	On-Demand	Anodyne	ABCB1	18	43
COc1c(Cl)cccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819424813	EG	On-Demand	Anodyne	PDS	42	38
COc1c(Cl)cccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819424815	EG	On-Demand	Anodyne	ADRB2	22	44
COc1c(Cl)cccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819424815	EG	On-Demand	Anodyne	ABCB1	18	43
COc1c(Cl)cccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819424815	EG	On-Demand	Anodyne	PDS	42	38
CCOC(=O)N(C)c1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819424838	GG	On-Demand	Anodyne	NOD1	17	45
CCOC(=O)N(C)c1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819424838	GG	On-Demand	Anodyne	NOD2	46	45
CCOC(=O)N(C)c1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819424839	GG	On-Demand	Anodyne	NOD1	17	45
CCOC(=O)N(C)c1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819424839	GG	On-Demand	Anodyne	NOD2	46	45
CC[C@H](O)CNc1cccc(N2CCCCC2)c1	ZINC000819424849	BF	On-Demand	Anodyne	KCNQ2	43	38
CCOC(=O)N(C)c1ccc(NC[C@H](O)COc2c(C)cccc2C)cc1	ZINC000819424876	FH	On-Demand	Anodyne	ADRB2	16	44
CCOC(=O)N(C)c1ccc(NC[C@@H](O)COc2c(C)cccc2C)cc1	ZINC000819424877	FH	On-Demand	Anodyne	ADRB2	16	44
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2cc(C)on2)c1	ZINC000819424913	FF	On-Demand	Anodyne	KCNK3	62	33
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2cc(C)on2)c1	ZINC000819424913	FF	On-Demand	Anodyne	KCNK9	56	33
COCCOC(=O)Nc1cccc(NC[C@@H](O)CN2CCc3ccccc3C2)c1	ZINC000819424918	GF	On-Demand	Anodyne	NOD1	17	40
COCCOC(=O)Nc1cccc(NC[C@@H](O)CN2CCc3ccccc3C2)c1	ZINC000819424918	GF	On-Demand	Anodyne	NOD2	46	40
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819424934	FF	On-Demand	Mild	CTRB_BOVIN	45	32
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819424937	FG	On-Demand	Anodyne	KCNK3	56	35
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819424937	FG	On-Demand	Anodyne	KCNK9	60	35
C#CCNC(=O)CCNc1ccc(CN2CCN(c3ccccn3)CC2)cc1	ZINC000819424941	GD	On-Demand	Mild	HTR1A	23	43
C#CCNC(=O)CCNc1ccc(CN2CCN(c3ccccn3)CC2)cc1	ZINC000819424941	GD	On-Demand	Mild	DRD2	25	42
C#CCNC(=O)CCNc1ccc(CN2CCN(c3ccccn3)CC2)cc1	ZINC000819424941	GD	On-Demand	Mild	DRD4	46	42
C#CCNC(=O)CCNc1ccc(CN2CCN(c3ccccn3)CC2)cc1	ZINC000819424941	GD	On-Demand	Mild	DRD3	21	42
C#CCNC(=O)CCNc1ccc(CN2CCN(c3ccccn3)CC2)cc1	ZINC000819424941	GD	On-Demand	Mild	HTR7	16	42
COCCOc1ccccc1NC[C@H](O)CN1CCOCC1	ZINC000819424951	DC	On-Demand	Clean	ABCB1	49	41
COCCOc1ccccc1NC[C@@H](O)CN1CCOCC1	ZINC000819424952	DC	On-Demand	Clean	ABCB1	49	41
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819424956	FH	On-Demand	Anodyne	KCNK3	85	37
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819424956	FH	On-Demand	Anodyne	KCNK9	74	37
CC(=O)OC1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819424959	ED	On-Demand	Anodyne	HTR1D	48	38
CC(=O)OC1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819424959	ED	On-Demand	Anodyne	HTR1B	41	38
CC(=O)OC1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819424959	ED	On-Demand	Anodyne	MLNR	25	41
CC(=O)OC1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819424959	ED	On-Demand	Anodyne	KCNJ1	56	42
COCCOC(=O)Nc1cccc(NC[C@@H](C)O)c1	ZINC000819424962	CD	On-Demand	Anodyne	KCNK3	112	40
COCCOC(=O)Nc1cccc(NC[C@@H](C)O)c1	ZINC000819424962	CD	On-Demand	Anodyne	KCNK9	81	40
Cn1c(=O)oc2c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cccc21	ZINC000819424963	GF	On-Demand	Mild	PAPA1_CARPA	40	43
Cn1c(=O)oc2c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cccc21	ZINC000819424963	GF	On-Demand	Mild	FPR1	42	36
Cn1c(=O)oc2c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cccc21	ZINC000819424964	GF	On-Demand	Mild	PAPA1_CARPA	40	43
Cn1c(=O)oc2c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cccc21	ZINC000819424964	GF	On-Demand	Mild	FPR1	42	36
COCCOc1ccccc1NC[C@H](O)COc1ccccc1Cl	ZINC000819424965	FG	On-Demand	Clean	ADRB2	30	51
COCCOc1ccccc1NC[C@H](O)COc1ccccc1Cl	ZINC000819424965	FG	On-Demand	Clean	ADRB1	58	34
COCCOc1ccccc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819424966	FG	On-Demand	Clean	ADRB2	30	51
COCCOc1ccccc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819424966	FG	On-Demand	Clean	ADRB1	58	34
CCOC(=O)C1CCC(O)(CNc2cccc(NC(=O)OCC(C)C)c2)CC1	ZINC000819424971	GH	On-Demand	Anodyne	TIMP3	61	33
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819424989	FF	On-Demand	Anodyne	EDNRB	42	34
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819424989	FF	On-Demand	Anodyne	EDNRA	42	35
COc1c(Cl)cccc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819424990	FF	On-Demand	Anodyne	EDNRB	42	34
COc1c(Cl)cccc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819424990	FF	On-Demand	Anodyne	EDNRA	42	35
C=CCOc1cccc(NCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819425019	EH	On-Demand	Mild	MTNR1A	18	45
C=CCOc1cccc(NCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819425019	EH	On-Demand	Mild	MTNR1B	22	45
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819425038	EG	On-Demand	Mild	ADRB2	28	47
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819425038	EG	On-Demand	Mild	ADRB3	23	44
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819425038	EG	On-Demand	Mild	CASR	30	40
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819425039	EG	On-Demand	Mild	ADRB2	28	47
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819425039	EG	On-Demand	Mild	ADRB3	23	44
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819425039	EG	On-Demand	Mild	CASR	30	40
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819425062	DH	On-Demand	Anodyne	ADRB2	34	50
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819425062	DH	On-Demand	Anodyne	ADRB1	40	41
COc1c(Cl)cccc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819425062	DH	On-Demand	Anodyne	ADRB3	17	44
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819425063	DH	On-Demand	Anodyne	ADRB2	34	50
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819425063	DH	On-Demand	Anodyne	ADRB1	40	41
COc1c(Cl)cccc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819425063	DH	On-Demand	Anodyne	ADRB3	17	44
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819425073	GH	On-Demand	Anodyne	KCNK3	58	34
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819425073	GH	On-Demand	Anodyne	KCNK9	54	34
COCCOc1ccccc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819425091	FF	On-Demand	Clean	NOD2	43	37
COCCOc1ccccc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819425092	FF	On-Demand	Clean	NOD2	43	37
CC(=O)Nc1cc(NCCS(C)(=O)=O)ccc1Cl	ZINC000819425094	CD	On-Demand	Anodyne	IDO1	25	40
COCCOc1ccccc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819425102	EF	On-Demand	Clean	ADRB2	50	51
COCCOc1ccccc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819425102	EF	On-Demand	Clean	ADRB1	64	45
COCCOc1ccccc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819425102	EF	On-Demand	Clean	ADRB3	30	41
COCCOc1ccccc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819425103	EF	On-Demand	Clean	ADRB2	50	51
COCCOc1ccccc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819425103	EF	On-Demand	Clean	ADRB1	64	45
COCCOc1ccccc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819425103	EF	On-Demand	Clean	ADRB3	30	41
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819425120	FG	On-Demand	Anodyne	KCNK3	70	35
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819425120	FG	On-Demand	Anodyne	KCNK9	58	35
COCCOc1ccccc1NC[C@H](O)COc1c(C)cccc1C	ZINC000819425140	EG	On-Demand	Clean	ADRB2	29	46
COCCOc1ccccc1NC[C@@H](O)COc1c(C)cccc1C	ZINC000819425141	EG	On-Demand	Clean	ADRB2	29	46
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cc3ccccc3o2)c1	ZINC000819425142	FH	On-Demand	Anodyne	KCNK3	48	34
COCCOC(=O)Nc1cccc(NC[C@@H](O)c2cc3ccccc3o2)c1	ZINC000819425142	FH	On-Demand	Anodyne	KCNK9	47	34
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2ccccc2)c1	ZINC000819425143	FG	On-Demand	Anodyne	LTA4H	20	41
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2ccccc2)c1	ZINC000819425143	FG	On-Demand	Anodyne	MTNR1B	15	40
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2ccccc2)c1	ZINC000819425143	FG	On-Demand	Anodyne	KCNK3	111	40
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2ccccc2)c1	ZINC000819425143	FG	On-Demand	Anodyne	KCNK9	78	39
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2ccc(Cl)cc2)c1	ZINC000819425155	GH	On-Demand	Anodyne	IMDH_CRYPV	17	42
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2ccc(Cl)cc2)c1	ZINC000819425155	GH	On-Demand	Anodyne	KCNK3	68	39
COCCOC(=O)Nc1cccc(NCCC(=O)Nc2ccc(Cl)cc2)c1	ZINC000819425155	GH	On-Demand	Anodyne	KCNK9	58	34
COCCOc1ccccc1NC[C@H](O)CO[C@@H]1CCCc2ccccc21	ZINC000819425173	FH	On-Demand	Clean	ADRB1	17	40
COCCOc1ccccc1NC[C@@H](O)CO[C@H]1CCCc2ccccc21	ZINC000819425174	FH	On-Demand	Clean	ADRB1	17	40
COCCOc1ccccc1NC[C@H](O)CO[C@H]1CCCc2ccccc21	ZINC000819425175	FH	On-Demand	Clean	ADRB1	17	40
COCCOc1ccccc1NC[C@@H](O)CO[C@@H]1CCCc2ccccc21	ZINC000819425176	FH	On-Demand	Clean	ADRB1	17	40
Cc1ccc(NC[C@@H](O)Cc2ccc3ccccc3c2)c(OCC(=O)N(C)C)c1	ZINC000819425195	GH	On-Demand	Anodyne	CASR	41	36
Cc1ccc(NC[C@H](O)Cc2ccc3ccccc3c2)c(OCC(=O)N(C)C)c1	ZINC000819425196	GH	On-Demand	Anodyne	CASR	41	36
COCCOc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1F	ZINC000819425204	FF	On-Demand	Anodyne	NOD2	44	38
COCCOc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1F	ZINC000819425205	FF	On-Demand	Anodyne	NOD2	44	38
COCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1F	ZINC000819425214	EH	On-Demand	Anodyne	ADRB1	31	49
COCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1F	ZINC000819425214	EH	On-Demand	Anodyne	ADRB3	47	49
COCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1F	ZINC000819425215	EH	On-Demand	Anodyne	ADRB1	31	49
COCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1F	ZINC000819425215	EH	On-Demand	Anodyne	ADRB3	47	49
COc1c(Cl)cccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819425218	FG	On-Demand	Bother	ADRB2	15	41
COc1c(Cl)cccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819425218	FG	On-Demand	Bother	ADRB1	15	41
COc1c(Cl)cccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819425218	FG	On-Demand	Bother	PDS	20	42
COc1c(Cl)cccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819425219	FG	On-Demand	Bother	ADRB2	15	41
COc1c(Cl)cccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819425219	FG	On-Demand	Bother	ADRB1	15	41
COc1c(Cl)cccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819425219	FG	On-Demand	Bother	PDS	20	42
COCCOc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1F	ZINC000819425249	FF	On-Demand	Anodyne	ADRB2	39	42
COCCOc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1F	ZINC000819425249	FF	On-Demand	Anodyne	ADRB1	61	42
COCCOc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1F	ZINC000819425250	FF	On-Demand	Anodyne	ADRB2	39	42
COCCOc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1F	ZINC000819425250	FF	On-Demand	Anodyne	ADRB1	61	42
Cc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c(OC[C@@H]2CCCO2)c1	ZINC000819425251	GH	On-Demand	Anodyne	ADRB2	15	53
Cc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c(OC[C@@H]2CCCO2)c1	ZINC000819425251	GH	On-Demand	Anodyne	ADRB1	21	51
Cc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c(OC[C@@H]2CCCO2)c1	ZINC000819425251	GH	On-Demand	Anodyne	HTR1A	15	53
Cc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c(OC[C@@H]2CCCO2)c1	ZINC000819425251	GH	On-Demand	Anodyne	SLC6A4	18	42
Cc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c(OC[C@H]2CCCO2)c1	ZINC000819425252	GH	On-Demand	Anodyne	ADRB2	15	53
Cc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c(OC[C@H]2CCCO2)c1	ZINC000819425252	GH	On-Demand	Anodyne	ADRB1	21	51
Cc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c(OC[C@H]2CCCO2)c1	ZINC000819425252	GH	On-Demand	Anodyne	HTR1A	15	53
Cc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c(OC[C@H]2CCCO2)c1	ZINC000819425252	GH	On-Demand	Anodyne	SLC6A4	18	42
Cc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)c(OC[C@@H]2CCCO2)c1	ZINC000819425253	GH	On-Demand	Anodyne	ADRB2	15	53
Cc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)c(OC[C@@H]2CCCO2)c1	ZINC000819425253	GH	On-Demand	Anodyne	ADRB1	21	51
Cc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)c(OC[C@@H]2CCCO2)c1	ZINC000819425253	GH	On-Demand	Anodyne	HTR1A	15	53
Cc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)c(OC[C@@H]2CCCO2)c1	ZINC000819425253	GH	On-Demand	Anodyne	SLC6A4	18	42
Cc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)c(OC[C@H]2CCCO2)c1	ZINC000819425254	GH	On-Demand	Anodyne	ADRB2	15	53
Cc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)c(OC[C@H]2CCCO2)c1	ZINC000819425254	GH	On-Demand	Anodyne	ADRB1	21	51
Cc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)c(OC[C@H]2CCCO2)c1	ZINC000819425254	GH	On-Demand	Anodyne	HTR1A	15	53
Cc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)c(OC[C@H]2CCCO2)c1	ZINC000819425254	GH	On-Demand	Anodyne	SLC6A4	18	42
COc1cccc(OC)c1OC[C@H](O)CNc1cccc(Cl)c1OC	ZINC000819425258	FG	On-Demand	Anodyne	ADRB2	25	45
COc1cccc(OC)c1OC[C@H](O)CNc1cccc(Cl)c1OC	ZINC000819425258	FG	On-Demand	Anodyne	ADRB1	26	40
COc1cccc(OC)c1OC[C@@H](O)CNc1cccc(Cl)c1OC	ZINC000819425259	FG	On-Demand	Anodyne	ADRB2	25	45
COc1cccc(OC)c1OC[C@@H](O)CNc1cccc(Cl)c1OC	ZINC000819425259	FG	On-Demand	Anodyne	ADRB1	26	40
COc1c(Cl)cccc1NC[C@@H](O)COc1ccccc1C	ZINC000819425260	DH	On-Demand	Anodyne	ADRB2	29	53
COc1c(Cl)cccc1NC[C@@H](O)COc1ccccc1C	ZINC000819425260	DH	On-Demand	Anodyne	ADRB1	29	43
COc1c(Cl)cccc1NC[C@@H](O)COc1ccccc1C	ZINC000819425260	DH	On-Demand	Anodyne	CYP2D6	17	42
COc1c(Cl)cccc1NC[C@H](O)COc1ccccc1C	ZINC000819425261	DH	On-Demand	Anodyne	ADRB2	29	53
COc1c(Cl)cccc1NC[C@H](O)COc1ccccc1C	ZINC000819425261	DH	On-Demand	Anodyne	ADRB1	29	43
COc1c(Cl)cccc1NC[C@H](O)COc1ccccc1C	ZINC000819425261	DH	On-Demand	Anodyne	CYP2D6	17	42
COc1c(Cl)cccc1NC[C@@H](O)COc1ccccc1	ZINC000819425262	DG	On-Demand	Anodyne	ADRB2	47	50
COc1c(Cl)cccc1NC[C@@H](O)COc1ccccc1	ZINC000819425262	DG	On-Demand	Anodyne	ADRB1	54	45
COc1c(Cl)cccc1NC[C@@H](O)COc1ccccc1	ZINC000819425262	DG	On-Demand	Anodyne	ADRB3	32	45
COc1c(Cl)cccc1NC[C@@H](O)COc1ccccc1	ZINC000819425262	DG	On-Demand	Anodyne	CASR	20	47
COc1c(Cl)cccc1NC[C@H](O)COc1ccccc1	ZINC000819425263	DG	On-Demand	Anodyne	ADRB2	47	50
COc1c(Cl)cccc1NC[C@H](O)COc1ccccc1	ZINC000819425263	DG	On-Demand	Anodyne	ADRB1	54	45
COc1c(Cl)cccc1NC[C@H](O)COc1ccccc1	ZINC000819425263	DG	On-Demand	Anodyne	ADRB3	32	45
COc1c(Cl)cccc1NC[C@H](O)COc1ccccc1	ZINC000819425263	DG	On-Demand	Anodyne	CASR	20	47
Cc1ccc(NC[C@@H](O)Cc2ccccc2)c(OCC(=O)N(C)C)c1	ZINC000819425269	EE	On-Demand	Anodyne	CAPN2	43	30
Cc1ccc(NC[C@H](O)Cc2ccccc2)c(OCC(=O)N(C)C)c1	ZINC000819425270	EE	On-Demand	Anodyne	CAPN2	43	30
COCCOc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1F	ZINC000819425316	GH	On-Demand	Anodyne	ADRB2	26	51
COCCOc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1F	ZINC000819425316	GH	On-Demand	Anodyne	ADRB1	57	35
COCCOc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1F	ZINC000819425316	GH	On-Demand	Anodyne	CYP2D6	21	43
COCCOc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1F	ZINC000819425317	GH	On-Demand	Anodyne	ADRB2	26	51
COCCOc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1F	ZINC000819425317	GH	On-Demand	Anodyne	ADRB1	57	35
COCCOc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1F	ZINC000819425317	GH	On-Demand	Anodyne	CYP2D6	21	43
COCCOc1ccc(NC[C@H](O)CN2CCN(C)CC2)cc1F	ZINC000819425318	EC	On-Demand	Anodyne	MET	35	41
COCCOc1ccc(NC[C@@H](O)CN2CCN(C)CC2)cc1F	ZINC000819425319	EC	On-Demand	Anodyne	MET	35	41
Cc1ccc(NC[C@H](O)COc2ccccc2)c(OC[C@@H]2CCCO2)c1	ZINC000819425326	FG	On-Demand	Anodyne	ADRB2	37	41
Cc1ccc(NC[C@H](O)COc2ccccc2)c(OC[C@@H]2CCCO2)c1	ZINC000819425326	FG	On-Demand	Anodyne	ADRB1	44	40
Cc1ccc(NC[C@@H](O)COc2ccccc2)c(OC[C@H]2CCCO2)c1	ZINC000819425327	FG	On-Demand	Anodyne	ADRB2	37	41
Cc1ccc(NC[C@@H](O)COc2ccccc2)c(OC[C@H]2CCCO2)c1	ZINC000819425327	FG	On-Demand	Anodyne	ADRB1	44	40
Cc1ccc(NC[C@@H](O)COc2ccccc2)c(OC[C@@H]2CCCO2)c1	ZINC000819425328	FG	On-Demand	Anodyne	ADRB2	37	41
Cc1ccc(NC[C@@H](O)COc2ccccc2)c(OC[C@@H]2CCCO2)c1	ZINC000819425328	FG	On-Demand	Anodyne	ADRB1	44	40
Cc1ccc(NC[C@H](O)COc2ccccc2)c(OC[C@H]2CCCO2)c1	ZINC000819425329	FG	On-Demand	Anodyne	ADRB2	37	41
Cc1ccc(NC[C@H](O)COc2ccccc2)c(OC[C@H]2CCCO2)c1	ZINC000819425329	FG	On-Demand	Anodyne	ADRB1	44	40
COCCOc1ccc(NC[C@H](O)COc2ccccc2F)cc1F	ZINC000819425372	FF	On-Demand	Anodyne	ADRB2	27	44
COCCOc1ccc(NC[C@H](O)COc2ccccc2F)cc1F	ZINC000819425372	FF	On-Demand	Anodyne	ADRB1	59	38
COCCOc1ccc(NC[C@@H](O)COc2ccccc2F)cc1F	ZINC000819425373	FF	On-Demand	Anodyne	ADRB2	27	44
COCCOc1ccc(NC[C@@H](O)COc2ccccc2F)cc1F	ZINC000819425373	FF	On-Demand	Anodyne	ADRB1	59	38
COCCOc1ccc(NC[C@H](O)COc2ccccc2C)cc1F	ZINC000819425379	EG	On-Demand	Anodyne	ADRB2	27	49
COCCOc1ccc(NC[C@H](O)COc2ccccc2C)cc1F	ZINC000819425379	EG	On-Demand	Anodyne	ADRB1	57	36
COCCOc1ccc(NC[C@@H](O)COc2ccccc2C)cc1F	ZINC000819425380	EG	On-Demand	Anodyne	ADRB2	27	49
COCCOc1ccc(NC[C@@H](O)COc2ccccc2C)cc1F	ZINC000819425380	EG	On-Demand	Anodyne	ADRB1	57	36
C=CCOc1cccc(NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819425381	GF	On-Demand	Mild	DRD4	44	37
C=CCOc1cccc(NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819425381	GF	On-Demand	Mild	ACOX1	46	36
C=CCOc1cccc(NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819425381	GF	On-Demand	Mild	ABCB1	45	43
C=CCOc1cccc(NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819425382	GF	On-Demand	Mild	DRD4	44	37
C=CCOc1cccc(NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819425382	GF	On-Demand	Mild	ACOX1	46	36
C=CCOc1cccc(NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819425382	GF	On-Demand	Mild	ABCB1	45	43
COCCOc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1F	ZINC000819425387	FH	On-Demand	Anodyne	MAOB	18	45
COCCOc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1F	ZINC000819425388	FH	On-Demand	Anodyne	MAOB	18	45
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)c(OCC(=O)N(C)C)c1	ZINC000819425389	FG	On-Demand	Anodyne	ADRB1	30	44
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)c(OCC(=O)N(C)C)c1	ZINC000819425389	FG	On-Demand	Anodyne	ADRB3	48	43
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)c(OCC(=O)N(C)C)c1	ZINC000819425389	FG	On-Demand	Anodyne	CYP3A4	47	36
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)c(OCC(=O)N(C)C)c1	ZINC000819425390	FG	On-Demand	Anodyne	ADRB1	30	44
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)c(OCC(=O)N(C)C)c1	ZINC000819425390	FG	On-Demand	Anodyne	ADRB3	48	43
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)c(OCC(=O)N(C)C)c1	ZINC000819425390	FG	On-Demand	Anodyne	CYP3A4	47	36
COCCOc1ccc(NCCC(=O)Nc2ccccc2F)cc1F	ZINC000819425391	FG	On-Demand	Anodyne	MET	53	40
COCCOc1ccc(NCCC(=O)Nc2ccc(Cl)cc2)cc1F	ZINC000819425393	FH	On-Demand	Anodyne	CPT1A	49	35
COCCOc1ccc(NCCC(=O)Nc2ccc(Cl)cc2)cc1F	ZINC000819425393	FH	On-Demand	Anodyne	CPT1B	40	33
COCCOc1ccc(NCCC(=O)Nc2cccc(Cl)c2)cc1F	ZINC000819425394	FH	On-Demand	Anodyne	CPT1A	46	33
COCCOc1ccc(NCCC(=O)Nc2cccc(Cl)c2)cc1F	ZINC000819425394	FH	On-Demand	Anodyne	KDR	22	42
COCCOc1ccc(NCCC(=O)Nc2cccc(Cl)c2)cc1F	ZINC000819425394	FH	On-Demand	Anodyne	MET	49	38
COCCOc1ccc(NCCC(=O)Nc2cccc(Cl)c2)cc1F	ZINC000819425394	FH	On-Demand	Anodyne	KCNK3	42	35
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1F	ZINC000819425433	EG	On-Demand	Anodyne	LTA4H	25	40
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1F	ZINC000819425433	EG	On-Demand	Anodyne	CPT1A	47	33
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1F	ZINC000819425433	EG	On-Demand	Anodyne	S1PR4	21	40
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1F	ZINC000819425433	EG	On-Demand	Anodyne	KDR	21	43
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1F	ZINC000819425433	EG	On-Demand	Anodyne	MET	66	40
COCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1F	ZINC000819425433	EG	On-Demand	Anodyne	KCNK3	41	36
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(C)cc2OC[C@@H]2CCCO2)c1	ZINC000819425467	GH	On-Demand	Anodyne	ADRB2	16	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(C)cc2OC[C@@H]2CCCO2)c1	ZINC000819425467	GH	On-Demand	Anodyne	ADRB1	17	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(C)cc2OC[C@@H]2CCCO2)c1	ZINC000819425468	GH	On-Demand	Anodyne	ADRB2	16	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(C)cc2OC[C@@H]2CCCO2)c1	ZINC000819425468	GH	On-Demand	Anodyne	ADRB1	17	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(C)cc2OC[C@H]2CCCO2)c1	ZINC000819425469	GH	On-Demand	Anodyne	ADRB2	16	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(C)cc2OC[C@H]2CCCO2)c1	ZINC000819425469	GH	On-Demand	Anodyne	ADRB1	17	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(C)cc2OC[C@H]2CCCO2)c1	ZINC000819425470	GH	On-Demand	Anodyne	ADRB2	16	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(C)cc2OC[C@H]2CCCO2)c1	ZINC000819425470	GH	On-Demand	Anodyne	ADRB1	17	41
COCCOc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1F	ZINC000819425475	EG	On-Demand	Anodyne	ADRB2	31	46
COCCOc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1F	ZINC000819425475	EG	On-Demand	Anodyne	ADRB1	48	41
COCCOc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1F	ZINC000819425476	EG	On-Demand	Anodyne	ADRB2	31	46
COCCOc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1F	ZINC000819425476	EG	On-Demand	Anodyne	ADRB1	48	41
COCCOc1ccc(NC[C@H](O)COc2ccccc2)cc1F	ZINC000819425489	EF	On-Demand	Anodyne	ADRB2	48	45
COCCOc1ccc(NC[C@H](O)COc2ccccc2)cc1F	ZINC000819425489	EF	On-Demand	Anodyne	ADRB1	71	41
COCCOc1ccc(NC[C@H](O)COc2ccccc2)cc1F	ZINC000819425489	EF	On-Demand	Anodyne	ADRB3	37	41
COCCOc1ccc(NC[C@H](O)COc2ccccc2)cc1F	ZINC000819425489	EF	On-Demand	Anodyne	PDS	50	33
COCCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1F	ZINC000819425490	EF	On-Demand	Anodyne	ADRB2	48	45
COCCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1F	ZINC000819425490	EF	On-Demand	Anodyne	ADRB1	71	41
COCCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1F	ZINC000819425490	EF	On-Demand	Anodyne	ADRB3	37	41
COCCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1F	ZINC000819425490	EF	On-Demand	Anodyne	PDS	50	33
COCCOc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1F	ZINC000819425499	EG	On-Demand	Anodyne	ADRB2	26	51
COCCOc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1F	ZINC000819425499	EG	On-Demand	Anodyne	ADRB1	39	51
COCCOc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1F	ZINC000819425500	EG	On-Demand	Anodyne	ADRB2	26	51
COCCOc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1F	ZINC000819425500	EG	On-Demand	Anodyne	ADRB1	39	51
O[C@H](CNc1ccccc1OC[C@@H]1CCCCO1)COc1cccc2[nH]ccc12	ZINC000819425570	GH	On-Demand	Clean	ADRB2	19	60
O[C@H](CNc1ccccc1OC[C@@H]1CCCCO1)COc1cccc2[nH]ccc12	ZINC000819425570	GH	On-Demand	Clean	ADRB1	30	52
O[C@H](CNc1ccccc1OC[C@H]1CCCCO1)COc1cccc2[nH]ccc12	ZINC000819425571	GH	On-Demand	Clean	ADRB2	19	60
O[C@H](CNc1ccccc1OC[C@H]1CCCCO1)COc1cccc2[nH]ccc12	ZINC000819425571	GH	On-Demand	Clean	ADRB1	30	52
O[C@@H](CNc1ccccc1OC[C@@H]1CCCCO1)COc1cccc2[nH]ccc12	ZINC000819425572	GH	On-Demand	Clean	ADRB2	19	60
O[C@@H](CNc1ccccc1OC[C@@H]1CCCCO1)COc1cccc2[nH]ccc12	ZINC000819425572	GH	On-Demand	Clean	ADRB1	30	52
O[C@@H](CNc1ccccc1OC[C@H]1CCCCO1)COc1cccc2[nH]ccc12	ZINC000819425573	GH	On-Demand	Clean	ADRB2	19	60
O[C@@H](CNc1ccccc1OC[C@H]1CCCCO1)COc1cccc2[nH]ccc12	ZINC000819425573	GH	On-Demand	Clean	ADRB1	30	52
O[C@@H](CNc1ccccc1OC[C@@H]1CCCCO1)COc1ccc(F)cc1	ZINC000819425582	GH	On-Demand	Clean	ADRB1	52	41
O[C@H](CNc1ccccc1OC[C@H]1CCCCO1)COc1ccc(F)cc1	ZINC000819425583	GH	On-Demand	Clean	ADRB1	52	41
O[C@H](CNc1ccccc1OC[C@@H]1CCCCO1)COc1ccc(F)cc1	ZINC000819425584	GH	On-Demand	Clean	ADRB1	52	41
O[C@@H](CNc1ccccc1OC[C@H]1CCCCO1)COc1ccc(F)cc1	ZINC000819425585	GH	On-Demand	Clean	ADRB1	52	41
COCCOc1ccccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819425602	GG	On-Demand	Anodyne	CCR8	40	41
COCCOc1ccccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819425602	GG	On-Demand	Anodyne	GPR119	54	50
COCCOc1ccccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819425603	GG	On-Demand	Anodyne	CCR8	40	41
COCCOc1ccccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819425603	GG	On-Demand	Anodyne	GPR119	54	50
Cc1ccc(OC[C@@H](O)CNc2ccc(C)cc2OCC(=O)N(C)C)cc1	ZINC000819425606	FF	On-Demand	Anodyne	ADRB2	27	47
Cc1ccc(OC[C@H](O)CNc2ccc(C)cc2OCC(=O)N(C)C)cc1	ZINC000819425607	FF	On-Demand	Anodyne	ADRB2	27	47
Cc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)c(OCC(=O)N(C)C)c1	ZINC000819425644	GE	On-Demand	Mild	ADRB2	17	40
Cc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)c(OCC(=O)N(C)C)c1	ZINC000819425645	GE	On-Demand	Mild	ADRB2	17	40
Cc1ccc(NC[C@H](O)COc2ccccc2Cl)c(OCC(=O)N(C)C)c1	ZINC000819425665	GF	On-Demand	Anodyne	ADRB2	22	50
Cc1ccc(NC[C@@H](O)COc2ccccc2Cl)c(OCC(=O)N(C)C)c1	ZINC000819425666	GF	On-Demand	Anodyne	ADRB2	22	50
CON(C)C(=O)CCNc1cccc(N2CCN(CC3CC3)CC2)c1	ZINC000819425706	EE	On-Demand	Anodyne	HTR1A	31	49
CON(C)C(=O)CCNc1cccc(N2CCN(CC3CC3)CC2)c1	ZINC000819425706	EE	On-Demand	Anodyne	DRD2	25	43
CON(C)C(=O)CCNc1cccc(N2CCN(CC3CC3)CC2)c1	ZINC000819425706	EE	On-Demand	Anodyne	DRD4	46	37
CON(C)C(=O)CCNc1cccc(N2CCN(CC3CC3)CC2)c1	ZINC000819425706	EE	On-Demand	Anodyne	DRD3	30	43
CON(C)C(=O)CCNc1cccc(N2CCN(CC3CC3)CC2)c1	ZINC000819425706	EE	On-Demand	Anodyne	HTR7	25	45
CON(C)C(=O)CCNc1cccc(N2CCN(CC3CC3)CC2)c1	ZINC000819425706	EE	On-Demand	Anodyne	CCR3	28	40
O[C@@H](CNc1ccccc1OC[C@H]1CCCCO1)c1cccnc1	ZINC000819425709	EG	On-Demand	Anodyne	ADRB1	15	40
O[C@@H](CNc1ccccc1OC[C@H]1CCCCO1)c1cccnc1	ZINC000819425709	EG	On-Demand	Anodyne	ADRB3	55	40
O[C@H](CNc1ccccc1OC[C@@H]1CCCCO1)c1cccnc1	ZINC000819425710	EG	On-Demand	Anodyne	ADRB1	15	40
O[C@H](CNc1ccccc1OC[C@@H]1CCCCO1)c1cccnc1	ZINC000819425710	EG	On-Demand	Anodyne	ADRB3	55	40
O[C@H](CNc1ccccc1OC[C@H]1CCCCO1)c1cccnc1	ZINC000819425711	EG	On-Demand	Anodyne	ADRB1	15	40
O[C@H](CNc1ccccc1OC[C@H]1CCCCO1)c1cccnc1	ZINC000819425711	EG	On-Demand	Anodyne	ADRB3	55	40
O[C@@H](CNc1ccccc1OC[C@@H]1CCCCO1)c1cccnc1	ZINC000819425712	EG	On-Demand	Anodyne	ADRB1	15	40
O[C@@H](CNc1ccccc1OC[C@@H]1CCCCO1)c1cccnc1	ZINC000819425712	EG	On-Demand	Anodyne	ADRB3	55	40
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)cc1	ZINC000819425717	GH	On-Demand	Clean	ADRB2	32	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)cc1	ZINC000819425717	GH	On-Demand	Clean	ADRB1	53	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)cc1	ZINC000819425717	GH	On-Demand	Clean	ABCB1	20	48
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)cc1	ZINC000819425718	GH	On-Demand	Clean	ADRB2	32	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)cc1	ZINC000819425718	GH	On-Demand	Clean	ADRB1	53	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)cc1	ZINC000819425718	GH	On-Demand	Clean	ABCB1	20	48
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OC[C@H]2CCCCO2)cc1	ZINC000819425719	GH	On-Demand	Clean	ADRB2	32	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OC[C@H]2CCCCO2)cc1	ZINC000819425719	GH	On-Demand	Clean	ADRB1	53	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OC[C@H]2CCCCO2)cc1	ZINC000819425719	GH	On-Demand	Clean	ABCB1	20	48
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OC[C@H]2CCCCO2)cc1	ZINC000819425720	GH	On-Demand	Clean	ADRB2	32	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OC[C@H]2CCCCO2)cc1	ZINC000819425720	GH	On-Demand	Clean	ADRB1	53	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OC[C@H]2CCCCO2)cc1	ZINC000819425720	GH	On-Demand	Clean	ABCB1	20	48
O[C@@H](CNc1ccccc1OC[C@@H]1CCCCO1)c1cccc(F)c1	ZINC000819425727	EH	On-Demand	Anodyne	CYP3A4	44	32
O[C@H](CNc1ccccc1OC[C@H]1CCCCO1)c1cccc(F)c1	ZINC000819425728	EH	On-Demand	Anodyne	CYP3A4	44	32
O[C@@H](CNc1ccccc1OC[C@H]1CCCCO1)c1cccc(F)c1	ZINC000819425729	EH	On-Demand	Anodyne	CYP3A4	44	32
O[C@H](CNc1ccccc1OC[C@@H]1CCCCO1)c1cccc(F)c1	ZINC000819425730	EH	On-Demand	Anodyne	CYP3A4	44	32
Cc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1NS(C)(=O)=O	ZINC000819425731	GH	On-Demand	Anodyne	ADRB2	34	41
Cc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1NS(C)(=O)=O	ZINC000819425731	GH	On-Demand	Anodyne	ADRB3	47	44
Cc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1NS(C)(=O)=O	ZINC000819425731	GH	On-Demand	Anodyne	TRPV1	71	44
Cc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1NS(C)(=O)=O	ZINC000819425732	GH	On-Demand	Anodyne	ADRB2	34	41
Cc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1NS(C)(=O)=O	ZINC000819425732	GH	On-Demand	Anodyne	ADRB3	47	44
Cc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1NS(C)(=O)=O	ZINC000819425732	GH	On-Demand	Anodyne	TRPV1	71	44
COCCOc1ccccc1NC[C@@H](O)CC1CCCC1	ZINC000819425757	CG	On-Demand	Clean	ADRB1	22	41
COCCOc1ccccc1NC[C@H](O)CC1CCCC1	ZINC000819425759	CG	On-Demand	Clean	ADRB1	22	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(c2ccccn2)CC1	ZINC000819425774	EF	On-Demand	Anodyne	GPR119	16	44
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819425782	FG	On-Demand	Anodyne	KCNK3	50	34
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819425782	FG	On-Demand	Anodyne	KCNK9	49	34
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2c(F)cccc2F)c1	ZINC000819425783	FG	On-Demand	Anodyne	KCNK3	50	34
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2c(F)cccc2F)c1	ZINC000819425783	FG	On-Demand	Anodyne	KCNK9	49	34
C#CCNC(=O)CCNc1ccc2nc(C(C)C)sc2c1	ZINC000819425811	DF	On-Demand	Mild	LDHA	42	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819425813	EG	On-Demand	Anodyne	ADRB2	25	48
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819425813	EG	On-Demand	Anodyne	ADRB1	45	50
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819425813	EG	On-Demand	Anodyne	ADRB3	71	46
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819425813	EG	On-Demand	Anodyne	CYP3A4	42	33
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819425813	EG	On-Demand	Anodyne	KCNK3	41	38
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819425815	EG	On-Demand	Anodyne	ADRB2	25	48
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819425815	EG	On-Demand	Anodyne	ADRB1	45	50
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819425815	EG	On-Demand	Anodyne	ADRB3	71	46
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819425815	EG	On-Demand	Anodyne	CYP3A4	42	33
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819425815	EG	On-Demand	Anodyne	KCNK3	41	38
Cc1ccc(NC[C@H](O)c2ccc(Br)cc2)cc1NS(C)(=O)=O	ZINC000819425816	GG	On-Demand	Anodyne	ADRB2	36	41
Cc1ccc(NC[C@H](O)c2ccc(Br)cc2)cc1NS(C)(=O)=O	ZINC000819425816	GG	On-Demand	Anodyne	ADRB3	47	46
Cc1ccc(NC[C@H](O)c2ccc(Br)cc2)cc1NS(C)(=O)=O	ZINC000819425816	GG	On-Demand	Anodyne	TRPV1	17	40
Cc1ccc(NC[C@@H](O)c2ccc(Br)cc2)cc1NS(C)(=O)=O	ZINC000819425817	GG	On-Demand	Anodyne	ADRB2	36	41
Cc1ccc(NC[C@@H](O)c2ccc(Br)cc2)cc1NS(C)(=O)=O	ZINC000819425817	GG	On-Demand	Anodyne	ADRB3	47	46
Cc1ccc(NC[C@@H](O)c2ccc(Br)cc2)cc1NS(C)(=O)=O	ZINC000819425817	GG	On-Demand	Anodyne	TRPV1	17	40
COCCOc1ccccc1NC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819425826	FH	On-Demand	Clean	ADRB2	25	44
COCCOc1ccccc1NC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819425827	FH	On-Demand	Clean	ADRB2	25	44
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1NS(C)(=O)=O	ZINC000819425828	FG	On-Demand	Anodyne	ADRB2	43	48
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1NS(C)(=O)=O	ZINC000819425828	FG	On-Demand	Anodyne	ADRB1	43	48
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1NS(C)(=O)=O	ZINC000819425828	FG	On-Demand	Anodyne	GRIN1	24	45
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1NS(C)(=O)=O	ZINC000819425828	FG	On-Demand	Anodyne	ADRB3	99	51
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1NS(C)(=O)=O	ZINC000819425828	FG	On-Demand	Anodyne	IGF1R	29	42
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1NS(C)(=O)=O	ZINC000819425828	FG	On-Demand	Anodyne	CYP3A4	48	36
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1NS(C)(=O)=O	ZINC000819425830	FG	On-Demand	Anodyne	ADRB2	43	48
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1NS(C)(=O)=O	ZINC000819425830	FG	On-Demand	Anodyne	ADRB1	43	48
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1NS(C)(=O)=O	ZINC000819425830	FG	On-Demand	Anodyne	GRIN1	24	45
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1NS(C)(=O)=O	ZINC000819425830	FG	On-Demand	Anodyne	ADRB3	99	51
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1NS(C)(=O)=O	ZINC000819425830	FG	On-Demand	Anodyne	IGF1R	29	42
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1NS(C)(=O)=O	ZINC000819425830	FG	On-Demand	Anodyne	CYP3A4	48	36
COCCOc1ccccc1NCC1(O)CCCCC1	ZINC000819425839	CF	On-Demand	Anodyne	HCN1	57	35
COCCOc1ccccc1NCC1(O)CCCCC1	ZINC000819425839	CF	On-Demand	Anodyne	HCN4	54	35
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819425849	GE	On-Demand	Anodyne	ADRB3	40	39
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819425849	GE	On-Demand	Anodyne	CTSF	46	32
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819425851	GE	On-Demand	Anodyne	ADRB3	40	39
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819425851	GE	On-Demand	Anodyne	CTSF	46	32
O[C@@H](CNc1cccc(N2CCN(CC3CC3)CC2)c1)c1cccnc1	ZINC000819425861	FF	On-Demand	Anodyne	ADRB3	50	42
O[C@H](CNc1cccc(N2CCN(CC3CC3)CC2)c1)c1cccnc1	ZINC000819425862	FF	On-Demand	Anodyne	ADRB3	50	42
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CC(C)(C)OC2=O)c1	ZINC000819425877	DD	On-Demand	Anodyne	LUXR	66	42
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CC(C)(C)OC2=O)c1	ZINC000819425877	DD	On-Demand	Anodyne	TRAR	34	42
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CC(C)(C)OC2=O)c1	ZINC000819425877	DD	On-Demand	Anodyne	LASR	16	42
CC(=O)Nc1cccc(CC(=O)N[C@H]2CC(C)(C)OC2=O)c1	ZINC000819425878	DD	On-Demand	Anodyne	LUXR	66	42
CC(=O)Nc1cccc(CC(=O)N[C@H]2CC(C)(C)OC2=O)c1	ZINC000819425878	DD	On-Demand	Anodyne	TRAR	34	42
CC(=O)Nc1cccc(CC(=O)N[C@H]2CC(C)(C)OC2=O)c1	ZINC000819425878	DD	On-Demand	Anodyne	LASR	16	42
O[C@H](CNc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccc(F)cc1	ZINC000819425903	FH	On-Demand	Anodyne	SLC6A3	29	40
O[C@@H](CNc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccc(F)cc1	ZINC000819425904	FH	On-Demand	Anodyne	SLC6A3	29	40
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)[C@@H](C)c1ccccc1	ZINC000819425946	GF	On-Demand	Anodyne	LRRK2	33	44
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)[C@@H](C)c1ccccc1	ZINC000819425947	GF	On-Demand	Anodyne	LRRK2	33	44
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000819425948	GF	On-Demand	Anodyne	LRRK2	33	44
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)[C@H](C)c1ccccc1	ZINC000819425949	GF	On-Demand	Anodyne	LRRK2	33	44
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1c(F)cccc1F	ZINC000819425956	GF	On-Demand	Anodyne	BDKRB1	17	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1c(F)cccc1F	ZINC000819425956	GF	On-Demand	Anodyne	LRRK2	34	42
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1c(F)cccc1F	ZINC000819425958	GF	On-Demand	Anodyne	BDKRB1	17	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1c(F)cccc1F	ZINC000819425958	GF	On-Demand	Anodyne	LRRK2	34	42
Cc1ccc(NC[C@H](O)c2cccnc2)cc1NS(C)(=O)=O	ZINC000819425959	DD	On-Demand	Anodyne	ADRB2	44	46
Cc1ccc(NC[C@H](O)c2cccnc2)cc1NS(C)(=O)=O	ZINC000819425959	DD	On-Demand	Anodyne	ADRB1	35	41
Cc1ccc(NC[C@H](O)c2cccnc2)cc1NS(C)(=O)=O	ZINC000819425959	DD	On-Demand	Anodyne	ADRB3	147	51
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1cc(F)ccc1F	ZINC000819425960	GF	On-Demand	Anodyne	LRRK2	31	41
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1NS(C)(=O)=O	ZINC000819425961	DD	On-Demand	Anodyne	ADRB2	44	46
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1NS(C)(=O)=O	ZINC000819425961	DD	On-Demand	Anodyne	ADRB1	35	41
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1NS(C)(=O)=O	ZINC000819425961	DD	On-Demand	Anodyne	ADRB3	147	51
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1cc(F)ccc1F	ZINC000819425963	GF	On-Demand	Anodyne	LRRK2	31	41
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cnn(Cc2ccccc2)c1	ZINC000819425972	IJ	On-Demand	Anodyne	EPHB3	50	35
OC1(CNc2ccc(OCc3ccccn3)c(Cl)c2)CCC1	ZINC000819425983	DH	On-Demand	Anodyne	EGFR	21	48
OC1(CNc2ccc(OCc3ccccn3)c(Cl)c2)CCC1	ZINC000819425983	DH	On-Demand	Anodyne	ERBB2	41	48
OC1(CNc2ccc(OCc3ccccn3)c(Cl)c2)CCC1	ZINC000819425983	DH	On-Demand	Anodyne	GRM4	24	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1ccc(F)cc1	ZINC000819425985	FG	On-Demand	Anodyne	HRH3	26	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1ccc(F)cc1	ZINC000819425987	FG	On-Demand	Anodyne	HRH3	26	42
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccccc2F)c1	ZINC000819425988	EF	On-Demand	Anodyne	KCNK3	65	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccccc2F)c1	ZINC000819425988	EF	On-Demand	Anodyne	KCNK9	70	40
CON(C)C(=O)CCNc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819425990	EG	On-Demand	Anodyne	EGFR	41	49
CON(C)C(=O)CCNc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819425990	EG	On-Demand	Anodyne	ERBB2	65	49
CON(C)C(=O)CCNc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819425990	EG	On-Demand	Anodyne	GRM4	29	47
CCCCCCCCNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819425991	DH	On-Demand	Mild	INHA	35	46
CCCCCCCCNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819425991	DH	On-Demand	Mild	S1PR4	19	47
CCCCCCCCNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819425991	DH	On-Demand	Mild	MTNR1A	61	40
CCCCCCCCNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819425991	DH	On-Demand	Mild	MTNR1B	55	40
CCCCCCCCNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819425991	DH	On-Demand	Mild	GRIA1	48	35
CCCCCCCCNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819425991	DH	On-Demand	Mild	SOAT1	23	40
CCCCCCCCNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819425991	DH	On-Demand	Mild	HDAC3	15	45
CCCCCCCCNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819425991	DH	On-Demand	Mild	FAAH	19	42
CCCCCCCCNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819425991	DH	On-Demand	Mild	S1PR2	50	35
CCCCCCCCNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819425991	DH	On-Demand	Mild	S1PR5	17	47
CCCCCCCCNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819425991	DH	On-Demand	Mild	ASAH1	91	36
CCCCCCCCNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819425991	DH	On-Demand	Mild	KCNK3	64	33
CCCCCCCCNC(=O)Cc1cccc(NC(C)=O)c1	ZINC000819425991	DH	On-Demand	Mild	KCNK9	44	33
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccccc2F)c1	ZINC000819425992	EF	On-Demand	Anodyne	KCNK3	65	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccccc2F)c1	ZINC000819425992	EF	On-Demand	Anodyne	KCNK9	70	40
COc1ccc(C(=O)N2CCN(C)CC2)cc1NCC1(O)CCCC1	ZINC000819425997	ED	On-Demand	Anodyne	HRH4	15	40
COc1ccc(C(=O)N2CCN(C)CC2)cc1NCC1(O)CCCC1	ZINC000819425997	ED	On-Demand	Anodyne	HCN1	24	42
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)c1cccc(F)c1	ZINC000819425999	GE	On-Demand	Anodyne	HRH3	24	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCCc3c(OC)cccc31)C2	ZINC000819426002	FG	On-Demand	Anodyne	SSTR1	50	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCCc3c(OC)cccc31)C2	ZINC000819426003	FG	On-Demand	Anodyne	SSTR1	50	36
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)c1cccc(F)c1	ZINC000819426006	GE	On-Demand	Anodyne	HRH3	24	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)[C@@H](C)c1ccccc1	ZINC000819426008	FH	On-Demand	Anodyne	HPGD	28	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)[C@@H](C)c1ccccc1	ZINC000819426010	FH	On-Demand	Anodyne	HPGD	28	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000819426012	FH	On-Demand	Anodyne	HPGD	28	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)[C@H](C)c1ccccc1	ZINC000819426014	FH	On-Demand	Anodyne	HPGD	28	41
CO[C@@H](C)C(=O)Nc1cccc(NC[C@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819426018	GE	On-Demand	Anodyne	KCNK3	40	33
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819426019	GE	On-Demand	Anodyne	KCNK3	40	33
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819426028	GD	On-Demand	Anodyne	ADRB2	40	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819426028	GD	On-Demand	Anodyne	ADRB1	51	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819426028	GD	On-Demand	Anodyne	ADRB3	36	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819426028	GD	On-Demand	Anodyne	ABCB1	48	40
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819426029	GD	On-Demand	Anodyne	ADRB2	40	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819426029	GD	On-Demand	Anodyne	ADRB1	51	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819426029	GD	On-Demand	Anodyne	ADRB3	36	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819426029	GD	On-Demand	Anodyne	ABCB1	48	40
CC[C@H](O)CNc1cc(C(=O)N2CCN(C)CC2)ccc1OC	ZINC000819426031	DD	On-Demand	Anodyne	HRH4	17	41
CC[C@H](O)CNc1cc(C(=O)N2CCN(C)CC2)ccc1OC	ZINC000819426031	DD	On-Demand	Anodyne	SLC9A1	43	30
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819426034	GH	On-Demand	Anodyne	KCNK3	65	44
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819426034	GH	On-Demand	Anodyne	KCNK9	63	44
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819426037	GH	On-Demand	Anodyne	KCNK3	65	44
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819426037	GH	On-Demand	Anodyne	KCNK9	63	44
C=CCC1(C(=O)N[C@@H](C)CC(=O)OCc2ccccc2)CCOCC1	ZINC000819426038	EF	On-Demand	Mild	KLK3	53	34
C=CCC1(C(=O)N[C@@H](C)CC(=O)OCc2ccccc2)CCOCC1	ZINC000819426038	EF	On-Demand	Mild	TIMP3	57	32
C=CCC1(C(=O)N[C@@H](C)CC(=O)OCc2ccccc2)CCOCC1	ZINC000819426038	EF	On-Demand	Mild	CAPNS1	59	34
C=CCC1(C(=O)N[C@@H](C)CC(=O)OCc2ccccc2)CCOCC1	ZINC000819426038	EF	On-Demand	Mild	CAPN1	64	37
C=CCC1(C(=O)N[C@@H](C)CC(=O)OCc2ccccc2)CCOCC1	ZINC000819426038	EF	On-Demand	Mild	CAPN2	96	36
C=CCC1(C(=O)N[C@@H](C)CC(=O)OCc2ccccc2)CCOCC1	ZINC000819426038	EF	On-Demand	Mild	NPR	66	36
C=CCC1(C(=O)N[C@@H](C)CC(=O)OCc2ccccc2)CCOCC1	ZINC000819426038	EF	On-Demand	Mild	SLC12A5	45	33
C=CCC1(C(=O)N[C@H](C)CC(=O)OCc2ccccc2)CCOCC1	ZINC000819426040	EF	On-Demand	Mild	KLK3	53	34
C=CCC1(C(=O)N[C@H](C)CC(=O)OCc2ccccc2)CCOCC1	ZINC000819426040	EF	On-Demand	Mild	TIMP3	57	32
C=CCC1(C(=O)N[C@H](C)CC(=O)OCc2ccccc2)CCOCC1	ZINC000819426040	EF	On-Demand	Mild	CAPNS1	59	34
C=CCC1(C(=O)N[C@H](C)CC(=O)OCc2ccccc2)CCOCC1	ZINC000819426040	EF	On-Demand	Mild	CAPN1	64	37
C=CCC1(C(=O)N[C@H](C)CC(=O)OCc2ccccc2)CCOCC1	ZINC000819426040	EF	On-Demand	Mild	CAPN2	96	36
C=CCC1(C(=O)N[C@H](C)CC(=O)OCc2ccccc2)CCOCC1	ZINC000819426040	EF	On-Demand	Mild	NPR	66	36
C=CCC1(C(=O)N[C@H](C)CC(=O)OCc2ccccc2)CCOCC1	ZINC000819426040	EF	On-Demand	Mild	SLC12A5	45	33
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)C(C)(C)C	ZINC000819426047	DF	On-Demand	Anodyne	L3MBTL3	52	36
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)C(C)(C)C	ZINC000819426047	DF	On-Demand	Anodyne	HPGD	34	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)C(C)(C)C	ZINC000819426048	DF	On-Demand	Anodyne	L3MBTL3	52	36
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)C(C)(C)C	ZINC000819426048	DF	On-Demand	Anodyne	HPGD	34	40
COc1ccc(C(=O)N2CCN(C)CC2)cc1NCC1(O)CCC1	ZINC000819426061	ED	On-Demand	Anodyne	HRH4	15	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1cccc2ccccc12	ZINC000819426076	GI	On-Demand	Anodyne	HPGD	31	41
CO[C@@H](C)C(=O)Nc1cccc(NCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819426077	GG	On-Demand	Anodyne	MTNR1B	19	43
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)CN1CCCC1=O	ZINC000819426099	GC	On-Demand	Anodyne	LRRK2	32	43
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)CN1CCCC1=O	ZINC000819426101	GC	On-Demand	Anodyne	LRRK2	32	43
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C[C@@H](C)n1cccn1	ZINC000819426108	EE	On-Demand	Anodyne	CYSP_TRYCR	47	35
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C[C@@H](C)n1cccn1	ZINC000819426108	EE	On-Demand	Anodyne	CAPNS1	55	34
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C[C@@H](C)n1cccn1	ZINC000819426108	EE	On-Demand	Anodyne	CAPN1	60	37
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C[C@@H](C)n1cccn1	ZINC000819426108	EE	On-Demand	Anodyne	CASP1	21	40
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C[C@@H](C)n1cccn1	ZINC000819426108	EE	On-Demand	Anodyne	CAPN2	84	34
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C[C@@H](C)n1cccn1	ZINC000819426108	EE	On-Demand	Anodyne	NPR	66	33
Cc1ccc(NCCS(C)(=O)=O)cc1NC(=O)c1ccncc1	ZINC000819426115	EE	On-Demand	Anodyne	MAPK14	39	45
Cc1ccc(NCCS(C)(=O)=O)cc1NC(=O)c1ccncc1	ZINC000819426115	EE	On-Demand	Anodyne	HDAC1	16	41
Cc1ccc(NCCS(C)(=O)=O)cc1NC(=O)c1ccncc1	ZINC000819426115	EE	On-Demand	Anodyne	SMO	25	42
Cc1ccc(NCCS(C)(=O)=O)cc1NC(=O)c1ccncc1	ZINC000819426115	EE	On-Demand	Anodyne	KCNK3	34	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819426122	FG	On-Demand	Anodyne	ABCB1	52	38
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819426122	FG	On-Demand	Anodyne	L3MBTL3	26	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819426122	FG	On-Demand	Anodyne	HPGD	35	40
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426124	FF	On-Demand	Anodyne	TSHR	41	30
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426124	FF	On-Demand	Anodyne	LTA4H	21	47
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426124	FF	On-Demand	Anodyne	CTSB	45	37
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426124	FF	On-Demand	Anodyne	PAPA1_CARPA	41	40
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426124	FF	On-Demand	Anodyne	CAPNS1	60	35
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426124	FF	On-Demand	Anodyne	CAPN1	67	38
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426124	FF	On-Demand	Anodyne	CAPN2	92	35
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426124	FF	On-Demand	Anodyne	PLAU	17	40
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426124	FF	On-Demand	Anodyne	NPR	65	35
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426124	FF	On-Demand	Anodyne	PSMB5	18	42
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426124	FF	On-Demand	Anodyne	KCNK3	41	33
CC(=O)Nc1cccc(CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426125	FF	On-Demand	Anodyne	TSHR	41	30
CC(=O)Nc1cccc(CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426125	FF	On-Demand	Anodyne	LTA4H	21	47
CC(=O)Nc1cccc(CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426125	FF	On-Demand	Anodyne	CTSB	45	37
CC(=O)Nc1cccc(CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426125	FF	On-Demand	Anodyne	PAPA1_CARPA	41	40
CC(=O)Nc1cccc(CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426125	FF	On-Demand	Anodyne	CAPNS1	60	35
CC(=O)Nc1cccc(CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426125	FF	On-Demand	Anodyne	CAPN1	67	38
CC(=O)Nc1cccc(CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426125	FF	On-Demand	Anodyne	CAPN2	92	35
CC(=O)Nc1cccc(CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426125	FF	On-Demand	Anodyne	PLAU	17	40
CC(=O)Nc1cccc(CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426125	FF	On-Demand	Anodyne	NPR	65	35
CC(=O)Nc1cccc(CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426125	FF	On-Demand	Anodyne	PSMB5	18	42
CC(=O)Nc1cccc(CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819426125	FF	On-Demand	Anodyne	KCNK3	41	33
C[C@H](CC(=O)OCc1ccccc1)NC(=O)Cc1nsc2ccccc12	ZINC000819426127	FG	On-Demand	Anodyne	CAPNS1	52	32
C[C@H](CC(=O)OCc1ccccc1)NC(=O)Cc1nsc2ccccc12	ZINC000819426127	FG	On-Demand	Anodyne	CAPN1	52	35
C[C@H](CC(=O)OCc1ccccc1)NC(=O)Cc1nsc2ccccc12	ZINC000819426127	FG	On-Demand	Anodyne	CAPN2	74	33
C[C@H](CC(=O)OCc1ccccc1)NC(=O)Cc1nsc2ccccc12	ZINC000819426127	FG	On-Demand	Anodyne	NPR	48	32
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819426128	DG	On-Demand	Anodyne	CELA1	18	40
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819426128	DG	On-Demand	Anodyne	ELANE	18	40
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819426128	DG	On-Demand	Anodyne	MME	28	40
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819426128	DG	On-Demand	Anodyne	CASP3	18	42
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819426128	DG	On-Demand	Anodyne	KLK3	55	33
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819426128	DG	On-Demand	Anodyne	CTSB	51	41
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819426128	DG	On-Demand	Anodyne	PAPA1_CARPA	42	37
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819426128	DG	On-Demand	Anodyne	CTSK	34	41
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819426128	DG	On-Demand	Anodyne	CAPNS1	64	36
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819426128	DG	On-Demand	Anodyne	CTSS	24	41
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819426128	DG	On-Demand	Anodyne	CAPN1	79	39
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819426128	DG	On-Demand	Anodyne	CAPN2	118	37
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819426128	DG	On-Demand	Anodyne	NPR	75	35
C[C@H](CC(=O)OCc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819426128	DG	On-Demand	Anodyne	SLC12A5	51	34
O[C@@H](CNc1ccccc1OC[C@H]1CCCCO1)COc1ccccc1F	ZINC000819426152	GH	On-Demand	Clean	ADRB1	49	40
O[C@H](CNc1ccccc1OC[C@H]1CCCCO1)COc1ccccc1F	ZINC000819426153	GH	On-Demand	Clean	ADRB1	49	40
O[C@@H](CNc1ccccc1OC[C@@H]1CCCCO1)COc1ccccc1F	ZINC000819426154	GH	On-Demand	Clean	ADRB1	49	40
O[C@H](CNc1ccccc1OC[C@@H]1CCCCO1)COc1ccccc1F	ZINC000819426155	GH	On-Demand	Clean	ADRB1	49	40
Cc1ccc(OC[C@H](O)CNc2ccc(C)cc2OCC(=O)N(C)C)c(C)c1	ZINC000819426167	GF	On-Demand	Anodyne	ADRB2	17	46
Cc1ccc(OC[C@H](O)CNc2ccc(C)cc2OCC(=O)N(C)C)c(C)c1	ZINC000819426167	GF	On-Demand	Anodyne	VDR	16	41
Cc1ccc(OC[C@@H](O)CNc2ccc(C)cc2OCC(=O)N(C)C)c(C)c1	ZINC000819426168	GF	On-Demand	Anodyne	ADRB2	17	46
Cc1ccc(OC[C@@H](O)CNc2ccc(C)cc2OCC(=O)N(C)C)c(C)c1	ZINC000819426168	GF	On-Demand	Anodyne	VDR	16	41
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@]1(O)CCc2ccccc21	ZINC000819426181	GH	On-Demand	Anodyne	HCN1	48	34
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@@]1(O)CCc2ccccc21	ZINC000819426182	GH	On-Demand	Anodyne	HCN1	48	34
COCCOc1ccccc1NCC1(O)CCCC1	ZINC000819426188	CE	On-Demand	Anodyne	HCN1	56	35
COCCOc1ccccc1NCC1(O)CCCC1	ZINC000819426188	CE	On-Demand	Anodyne	HCN4	52	33
COCCOc1ccccc1NC[C@H](O)c1ccc(C#N)cc1	ZINC000819426191	DF	On-Demand	Mild	CTRB_BOVIN	49	35
COCCOc1ccccc1NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819426192	DF	On-Demand	Mild	CTRB_BOVIN	49	35
O[C@@H](CNc1ccccc1OC[C@@H]1CCCCO1)COc1ccccc1	ZINC000819426195	FG	On-Demand	Clean	ADRB2	39	43
O[C@@H](CNc1ccccc1OC[C@@H]1CCCCO1)COc1ccccc1	ZINC000819426195	FG	On-Demand	Clean	ADRB1	58	39
O[C@H](CNc1ccccc1OC[C@H]1CCCCO1)COc1ccccc1	ZINC000819426196	FG	On-Demand	Clean	ADRB2	39	43
O[C@H](CNc1ccccc1OC[C@H]1CCCCO1)COc1ccccc1	ZINC000819426196	FG	On-Demand	Clean	ADRB1	58	39
O[C@H](CNc1ccccc1OC[C@@H]1CCCCO1)COc1ccccc1	ZINC000819426197	FG	On-Demand	Clean	ADRB2	39	43
O[C@H](CNc1ccccc1OC[C@@H]1CCCCO1)COc1ccccc1	ZINC000819426197	FG	On-Demand	Clean	ADRB1	58	39
O[C@@H](CNc1ccccc1OC[C@H]1CCCCO1)COc1ccccc1	ZINC000819426198	FG	On-Demand	Clean	ADRB2	39	43
O[C@@H](CNc1ccccc1OC[C@H]1CCCCO1)COc1ccccc1	ZINC000819426198	FG	On-Demand	Clean	ADRB1	58	39
Cc1ccc(NC[C@H](O)CN2CCN(C)CC2)c(OCC(=O)N(C)C)c1	ZINC000819426205	FC	On-Demand	Anodyne	ACOX1	43	31
Cc1ccc(NC[C@@H](O)CN2CCN(C)CC2)c(OCC(=O)N(C)C)c1	ZINC000819426206	FC	On-Demand	Anodyne	ACOX1	43	31
COCCOc1ccccc1NC[C@@H](O)COC	ZINC000819426213	CD	On-Demand	Clean	ADRB2	33	45
COCCOc1ccccc1NC[C@@H](O)COC	ZINC000819426213	CD	On-Demand	Clean	ADRB1	41	34
COCCOc1ccccc1NC[C@H](O)COC	ZINC000819426214	CD	On-Demand	Clean	ADRB2	33	45
COCCOc1ccccc1NC[C@H](O)COC	ZINC000819426214	CD	On-Demand	Clean	ADRB1	41	34
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)c1	ZINC000819426227	GH	On-Demand	Clean	ADRB2	29	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)c1	ZINC000819426227	GH	On-Demand	Clean	ADRB1	45	36
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)c1	ZINC000819426227	GH	On-Demand	Clean	ABCB1	22	43
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819426233	EF	On-Demand	Mild	CTRB_BOVIN	44	31
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819426234	EF	On-Demand	Mild	CTRB_BOVIN	44	31
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)c1	ZINC000819426240	GH	On-Demand	Clean	ADRB2	29	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)c1	ZINC000819426240	GH	On-Demand	Clean	ADRB1	45	36
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)c1	ZINC000819426240	GH	On-Demand	Clean	ABCB1	22	43
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)CCc1ccccc1	ZINC000819426241	FG	On-Demand	Anodyne	ABCB1	52	38
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)CCc1ccccc1	ZINC000819426241	FG	On-Demand	Anodyne	L3MBTL3	26	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)CCc1ccccc1	ZINC000819426241	FG	On-Demand	Anodyne	HPGD	35	40
CO[C@@H](C)C(=O)Nc1cccc(NCCC(=O)N(C)OC)c1	ZINC000819426244	DD	On-Demand	Anodyne	KCNK3	54	34
CO[C@@H](C)C(=O)Nc1cccc(NCCC(=O)N(C)OC)c1	ZINC000819426244	DD	On-Demand	Anodyne	KCNK9	54	34
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OC[C@H]2CCCCO2)c1	ZINC000819426245	GH	On-Demand	Clean	ADRB2	29	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OC[C@H]2CCCCO2)c1	ZINC000819426245	GH	On-Demand	Clean	ADRB1	45	36
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OC[C@H]2CCCCO2)c1	ZINC000819426245	GH	On-Demand	Clean	ABCB1	22	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OC[C@H]2CCCCO2)c1	ZINC000819426251	GH	On-Demand	Clean	ADRB2	29	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OC[C@H]2CCCCO2)c1	ZINC000819426251	GH	On-Demand	Clean	ADRB1	45	36
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OC[C@H]2CCCCO2)c1	ZINC000819426251	GH	On-Demand	Clean	ABCB1	22	43
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819426262	GC	On-Demand	Anodyne	SLC9A1	58	33
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819426264	GC	On-Demand	Anodyne	SLC9A1	58	33
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](C)O	ZINC000819426281	CC	On-Demand	Anodyne	SLC9A1	42	29
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](C)O	ZINC000819426281	CC	On-Demand	Anodyne	LRRK2	40	48
CO[C@@H](C)C(=O)Nc1cccc(NCCS(C)(=O)=O)c1	ZINC000819426283	DD	On-Demand	Anodyne	KCNK3	80	36
CO[C@@H](C)C(=O)Nc1cccc(NCCS(C)(=O)=O)c1	ZINC000819426283	DD	On-Demand	Anodyne	KCNK9	73	36
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](C)O	ZINC000819426284	CC	On-Demand	Anodyne	SLC9A1	42	29
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](C)O	ZINC000819426284	CC	On-Demand	Anodyne	LRRK2	40	48
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1ccc(C#N)cc1	ZINC000819426293	FF	On-Demand	Mild	HRH3	26	45
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819426296	FF	On-Demand	Mild	HRH3	26	45
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819426300	EG	On-Demand	Anodyne	ADRB3	43	39
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819426300	EG	On-Demand	Anodyne	KCNK3	49	38
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819426300	EG	On-Demand	Anodyne	KCNK9	44	34
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)C(F)(F)F	ZINC000819426307	EE	On-Demand	Anodyne	MLYCD	18	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)C(F)(F)F	ZINC000819426307	EE	On-Demand	Anodyne	L3MBTL3	43	35
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)C(F)(F)F	ZINC000819426309	EE	On-Demand	Anodyne	MLYCD	18	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)C(F)(F)F	ZINC000819426309	EE	On-Demand	Anodyne	L3MBTL3	43	35
Cc1ccc(NCC2(O)CCCCC2)cc1NC(=O)c1ccncc1	ZINC000819426310	EH	On-Demand	Anodyne	MAPK14	36	42
Cc1ccc(NCC2(O)CCCCC2)cc1NC(=O)c1ccncc1	ZINC000819426310	EH	On-Demand	Anodyne	KCNK3	28	41
O=S1(=O)CCC(O)(CNc2ccc(OCc3ccccn3)c(Cl)c2)CC1	ZINC000819426324	GF	On-Demand	Anodyne	EGFR	21	44
O=S1(=O)CCC(O)(CNc2ccc(OCc3ccccn3)c(Cl)c2)CC1	ZINC000819426324	GF	On-Demand	Anodyne	ERBB2	39	42
O=S1(=O)CCC(O)(CNc2ccc(OCc3ccccn3)c(Cl)c2)CC1	ZINC000819426324	GF	On-Demand	Anodyne	GRM4	39	42
COc1ccc(C(=O)N2CCCC2)cc1NCC1(O)CCCC1	ZINC000819426326	DF	On-Demand	Anodyne	L3MBTL3	52	38
COc1ccc(C(=O)N2CCCC2)cc1NCC1(O)CCCC1	ZINC000819426326	DF	On-Demand	Anodyne	HPGD	33	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)CCC(C)C	ZINC000819426336	EG	On-Demand	Anodyne	L3MBTL3	41	34
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)CCC(C)C	ZINC000819426337	EG	On-Demand	Anodyne	L3MBTL3	41	34
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)COC1CCOCC1	ZINC000819426340	GD	On-Demand	Anodyne	LRRK2	34	44
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)COC1CCOCC1	ZINC000819426341	GD	On-Demand	Anodyne	LRRK2	34	44
C[C@H](CC(=O)OCc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819426344	DE	On-Demand	Anodyne	CAPNS1	55	31
C[C@H](CC(=O)OCc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819426344	DE	On-Demand	Anodyne	CAPN1	48	40
C[C@H](CC(=O)OCc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819426344	DE	On-Demand	Anodyne	CAPN2	65	40
C[C@H](CC(=O)OCc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819426346	DE	On-Demand	Anodyne	CAPNS1	55	31
C[C@H](CC(=O)OCc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819426346	DE	On-Demand	Anodyne	CAPN1	48	40
C[C@H](CC(=O)OCc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819426346	DE	On-Demand	Anodyne	CAPN2	65	40
C[C@H](CC(=O)OCc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819426348	DE	On-Demand	Anodyne	CAPNS1	55	31
C[C@H](CC(=O)OCc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819426348	DE	On-Demand	Anodyne	CAPN1	48	40
C[C@H](CC(=O)OCc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819426348	DE	On-Demand	Anodyne	CAPN2	65	40
C[C@H](CC(=O)OCc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819426350	DE	On-Demand	Anodyne	CAPNS1	55	31
C[C@H](CC(=O)OCc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819426350	DE	On-Demand	Anodyne	CAPN1	48	40
C[C@H](CC(=O)OCc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819426350	DE	On-Demand	Anodyne	CAPN2	65	40
CC[C@H](O)CNc1cc(C(=O)N2CCOCC2)ccc1OC	ZINC000819426353	DD	On-Demand	Anodyne	LRRK2	37	46
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)COCC(C)C	ZINC000819426355	FD	On-Demand	Anodyne	LRRK2	31	43
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)COCC(C)C	ZINC000819426357	FD	On-Demand	Anodyne	LRRK2	31	43
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819426363	GF	On-Demand	Mild	ADRB1	42	35
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819426363	GF	On-Demand	Mild	HRH3	26	45
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819426363	GF	On-Demand	Mild	FASN	17	40
CCC1(CNC(=O)/C=C/[C@@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819426364	FH	On-Demand	Anodyne	SIGMAR1	53	37
CCC1(CNC(=O)/C=C/[C@@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819426364	FH	On-Demand	Anodyne	NPFFR2	35	44
CCC1(CNC(=O)/C=C/[C@@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819426364	FH	On-Demand	Anodyne	CACNA1G	17	40
CCC1(CNC(=O)/C=C/[C@@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819426364	FH	On-Demand	Anodyne	NPFFR1	45	44
CCC1(CNC(=O)/C=C/[C@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819426365	FH	On-Demand	Anodyne	SIGMAR1	53	37
CCC1(CNC(=O)/C=C/[C@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819426365	FH	On-Demand	Anodyne	NPFFR2	35	44
CCC1(CNC(=O)/C=C/[C@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819426365	FH	On-Demand	Anodyne	CACNA1G	17	40
CCC1(CNC(=O)/C=C/[C@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819426365	FH	On-Demand	Anodyne	NPFFR1	45	44
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819426366	GF	On-Demand	Mild	ADRB1	42	35
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819426366	GF	On-Demand	Mild	HRH3	26	45
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819426366	GF	On-Demand	Mild	FASN	17	40
CCC1(CNC(=O)/C=C\[C@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819426367	FH	On-Demand	Anodyne	SIGMAR1	53	37
CCC1(CNC(=O)/C=C\[C@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819426367	FH	On-Demand	Anodyne	NPFFR2	35	44
CCC1(CNC(=O)/C=C\[C@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819426367	FH	On-Demand	Anodyne	CACNA1G	17	40
CCC1(CNC(=O)/C=C\[C@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819426367	FH	On-Demand	Anodyne	NPFFR1	45	44
COc1ccc(C(=O)N2CCN(C)CC2)cc1NCC1(O)CCCCC1	ZINC000819426368	FE	On-Demand	Anodyne	HCN1	25	43
CCC1(CNC(=O)/C=C\[C@@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819426369	FH	On-Demand	Anodyne	SIGMAR1	53	37
CCC1(CNC(=O)/C=C\[C@@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819426369	FH	On-Demand	Anodyne	NPFFR2	35	44
CCC1(CNC(=O)/C=C\[C@@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819426369	FH	On-Demand	Anodyne	CACNA1G	17	40
CCC1(CNC(=O)/C=C\[C@@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819426369	FH	On-Demand	Anodyne	NPFFR1	45	44
C=C(C)C(C)(C)C(=O)N[C@@H](C)CC(=O)OCc1ccccc1	ZINC000819426370	DG	On-Demand	Mild	KLK3	53	34
C=C(C)C(C)(C)C(=O)N[C@@H](C)CC(=O)OCc1ccccc1	ZINC000819426370	DG	On-Demand	Mild	CTSB	45	39
C=C(C)C(C)(C)C(=O)N[C@@H](C)CC(=O)OCc1ccccc1	ZINC000819426370	DG	On-Demand	Mild	PAPA1_CARPA	48	38
C=C(C)C(C)(C)C(=O)N[C@@H](C)CC(=O)OCc1ccccc1	ZINC000819426370	DG	On-Demand	Mild	CYSP_TRYCR	42	39
C=C(C)C(C)(C)C(=O)N[C@@H](C)CC(=O)OCc1ccccc1	ZINC000819426370	DG	On-Demand	Mild	CAPNS1	63	37
C=C(C)C(C)(C)C(=O)N[C@@H](C)CC(=O)OCc1ccccc1	ZINC000819426370	DG	On-Demand	Mild	CAPN1	74	40
C=C(C)C(C)(C)C(=O)N[C@@H](C)CC(=O)OCc1ccccc1	ZINC000819426370	DG	On-Demand	Mild	CAPN2	101	39
C=C(C)C(C)(C)C(=O)N[C@@H](C)CC(=O)OCc1ccccc1	ZINC000819426370	DG	On-Demand	Mild	NPR	76	35
C=C(C)C(C)(C)C(=O)N[C@@H](C)CC(=O)OCc1ccccc1	ZINC000819426370	DG	On-Demand	Mild	SLC12A5	55	33
O[C@@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)COC1CCOCC1	ZINC000819426371	GG	On-Demand	Anodyne	ERBB2	37	42
C=C(C)C(C)(C)C(=O)N[C@H](C)CC(=O)OCc1ccccc1	ZINC000819426372	DG	On-Demand	Mild	KLK3	53	34
C=C(C)C(C)(C)C(=O)N[C@H](C)CC(=O)OCc1ccccc1	ZINC000819426372	DG	On-Demand	Mild	CTSB	45	39
C=C(C)C(C)(C)C(=O)N[C@H](C)CC(=O)OCc1ccccc1	ZINC000819426372	DG	On-Demand	Mild	PAPA1_CARPA	48	38
C=C(C)C(C)(C)C(=O)N[C@H](C)CC(=O)OCc1ccccc1	ZINC000819426372	DG	On-Demand	Mild	CYSP_TRYCR	42	39
C=C(C)C(C)(C)C(=O)N[C@H](C)CC(=O)OCc1ccccc1	ZINC000819426372	DG	On-Demand	Mild	CAPNS1	63	37
C=C(C)C(C)(C)C(=O)N[C@H](C)CC(=O)OCc1ccccc1	ZINC000819426372	DG	On-Demand	Mild	CAPN1	74	40
C=C(C)C(C)(C)C(=O)N[C@H](C)CC(=O)OCc1ccccc1	ZINC000819426372	DG	On-Demand	Mild	CAPN2	101	39
C=C(C)C(C)(C)C(=O)N[C@H](C)CC(=O)OCc1ccccc1	ZINC000819426372	DG	On-Demand	Mild	NPR	76	35
C=C(C)C(C)(C)C(=O)N[C@H](C)CC(=O)OCc1ccccc1	ZINC000819426372	DG	On-Demand	Mild	SLC12A5	55	33
O[C@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)COC1CCOCC1	ZINC000819426373	GG	On-Demand	Anodyne	ERBB2	37	42
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(F)cc2)c1	ZINC000819426376	EF	On-Demand	Anodyne	KCNK3	54	38
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(F)cc2)c1	ZINC000819426376	EF	On-Demand	Anodyne	KCNK9	59	36
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819426380	EF	On-Demand	Anodyne	KCNK3	54	38
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819426380	EF	On-Demand	Anodyne	KCNK9	59	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)CC(=O)OCc1ccccc1)C2	ZINC000819426383	GE	On-Demand	Anodyne	GHRHR	43	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)CC(=O)OCc1ccccc1)C2	ZINC000819426383	GE	On-Demand	Anodyne	CTRA_BOVIN	46	30
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)CC(=O)OCc1ccccc1)C2	ZINC000819426383	GE	On-Demand	Anodyne	CAPNS1	41	30
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](C)CC(=O)OCc1ccccc1)C2	ZINC000819426383	GE	On-Demand	Anodyne	LGMN	70	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)CC(=O)OCc1ccccc1)C2	ZINC000819426385	GE	On-Demand	Anodyne	GHRHR	43	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)CC(=O)OCc1ccccc1)C2	ZINC000819426385	GE	On-Demand	Anodyne	CTRA_BOVIN	46	30
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)CC(=O)OCc1ccccc1)C2	ZINC000819426385	GE	On-Demand	Anodyne	CAPNS1	41	30
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)CC(=O)OCc1ccccc1)C2	ZINC000819426385	GE	On-Demand	Anodyne	LGMN	70	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)CC(=O)OCc1ccccc1)C2	ZINC000819426387	GE	On-Demand	Anodyne	GHRHR	43	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)CC(=O)OCc1ccccc1)C2	ZINC000819426387	GE	On-Demand	Anodyne	CTRA_BOVIN	46	30
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)CC(=O)OCc1ccccc1)C2	ZINC000819426387	GE	On-Demand	Anodyne	CAPNS1	41	30
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)CC(=O)OCc1ccccc1)C2	ZINC000819426387	GE	On-Demand	Anodyne	LGMN	70	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)CC(=O)OCc1ccccc1)C2	ZINC000819426389	GE	On-Demand	Anodyne	GHRHR	43	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)CC(=O)OCc1ccccc1)C2	ZINC000819426389	GE	On-Demand	Anodyne	CTRA_BOVIN	46	30
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)CC(=O)OCc1ccccc1)C2	ZINC000819426389	GE	On-Demand	Anodyne	CAPNS1	41	30
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](C)CC(=O)OCc1ccccc1)C2	ZINC000819426389	GE	On-Demand	Anodyne	LGMN	70	40
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2Cl)cc1	ZINC000819426394	JK	On-Demand	Anodyne	HDAC1	23	43
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2Cl)cc1	ZINC000819426394	JK	On-Demand	Anodyne	HDAC2	16	43
CC(C)(C)OC(=O)NCc1ccc(C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2Cl)cc1	ZINC000819426394	JK	On-Demand	Anodyne	FLT3	19	43
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)COCc1ccco1	ZINC000819426401	GD	On-Demand	Anodyne	LRRK2	30	40
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)COCc1ccco1	ZINC000819426403	GD	On-Demand	Anodyne	LRRK2	30	40
OC1(CNc2ccc(OCc3ccccn3)c(Cl)c2)CCCC1	ZINC000819426412	EI	On-Demand	Anodyne	EGFR	21	48
OC1(CNc2ccc(OCc3ccccn3)c(Cl)c2)CCCC1	ZINC000819426412	EI	On-Demand	Anodyne	ERBB2	41	48
OC1(CNc2ccc(OCc3ccccn3)c(Cl)c2)CCCC1	ZINC000819426412	EI	On-Demand	Anodyne	GRM4	24	41
Cc1ccc(NC[C@H](O)c2ccccc2C)cc1NS(C)(=O)=O	ZINC000819426415	EF	On-Demand	Anodyne	ADRB3	35	40
Cc1ccc(NC[C@@H](O)c2ccccc2C)cc1NS(C)(=O)=O	ZINC000819426417	EF	On-Demand	Anodyne	ADRB3	35	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)CSC	ZINC000819426418	DE	On-Demand	Anodyne	L3MBTL3	42	35
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)CSC	ZINC000819426420	DE	On-Demand	Anodyne	L3MBTL3	42	35
O[C@@H](CNc1cccc(COC2CCCCC2)c1)c1cccnc1	ZINC000819426423	EI	On-Demand	Anodyne	ADRB1	32	47
O[C@@H](CNc1cccc(COC2CCCCC2)c1)c1cccnc1	ZINC000819426423	EI	On-Demand	Anodyne	ADRB3	89	47
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](C)O	ZINC000819426426	CD	On-Demand	Anodyne	SLC9A1	55	31
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](C)O	ZINC000819426426	CD	On-Demand	Anodyne	L3MBTL3	75	39
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](C)O	ZINC000819426426	CD	On-Demand	Anodyne	HPGD	37	41
O[C@H](CNc1cccc(COC2CCCCC2)c1)c1cccnc1	ZINC000819426427	EI	On-Demand	Anodyne	ADRB1	32	47
O[C@H](CNc1cccc(COC2CCCCC2)c1)c1cccnc1	ZINC000819426427	EI	On-Demand	Anodyne	ADRB3	89	47
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](C)O	ZINC000819426428	CD	On-Demand	Anodyne	SLC9A1	55	31
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](C)O	ZINC000819426428	CD	On-Demand	Anodyne	L3MBTL3	75	39
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](C)O	ZINC000819426428	CD	On-Demand	Anodyne	HPGD	37	41
OC1(CNc2ccc(OCc3ccccn3)c(Cl)c2)CCOCC1	ZINC000819426430	EG	On-Demand	Anodyne	EGFR	22	47
OC1(CNc2ccc(OCc3ccccn3)c(Cl)c2)CCOCC1	ZINC000819426430	EG	On-Demand	Anodyne	ERBB2	44	47
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1cc(C)cc(C)c1	ZINC000819426434	GG	On-Demand	Anodyne	ADRB2	24	46
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000819426436	GG	On-Demand	Anodyne	ADRB2	24	46
CC(=O)Nc1cccc(CC(=O)N[C@@H](CO)C[C@H](O)c2ccccc2)c1	ZINC000819426437	FD	On-Demand	Anodyne	ADRB3	22	43
CC(=O)Nc1cccc(CC(=O)N[C@@H](CO)C[C@H](O)c2ccccc2)c1	ZINC000819426437	FD	On-Demand	Anodyne	FPR1	24	40
Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1NS(C)(=O)=O	ZINC000819426438	FE	On-Demand	Bother	ADRB3	50	39
CC(=O)Nc1cccc(CC(=O)N[C@H](CO)C[C@H](O)c2ccccc2)c1	ZINC000819426439	FD	On-Demand	Anodyne	ADRB3	22	43
CC(=O)Nc1cccc(CC(=O)N[C@H](CO)C[C@H](O)c2ccccc2)c1	ZINC000819426439	FD	On-Demand	Anodyne	FPR1	24	40
CC(=O)Nc1cccc(CC(=O)N[C@H](CO)C[C@@H](O)c2ccccc2)c1	ZINC000819426440	FD	On-Demand	Anodyne	ADRB3	22	43
CC(=O)Nc1cccc(CC(=O)N[C@H](CO)C[C@@H](O)c2ccccc2)c1	ZINC000819426440	FD	On-Demand	Anodyne	FPR1	24	40
CC(=O)Nc1cccc(CC(=O)N[C@@H](CO)C[C@@H](O)c2ccccc2)c1	ZINC000819426441	FD	On-Demand	Anodyne	ADRB3	22	43
CC(=O)Nc1cccc(CC(=O)N[C@@H](CO)C[C@@H](O)c2ccccc2)c1	ZINC000819426441	FD	On-Demand	Anodyne	FPR1	24	40
COCCOc1ccccc1NC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819426444	FH	On-Demand	Clean	ADRB2	22	40
COCCOc1ccccc1NC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819426444	FH	On-Demand	Clean	CASR	45	42
COCCOc1ccccc1NC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819426444	FH	On-Demand	Clean	CYP2D6	17	42
COCCOc1ccccc1NC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819426445	FH	On-Demand	Clean	ADRB2	22	40
COCCOc1ccccc1NC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819426445	FH	On-Demand	Clean	CASR	45	42
COCCOc1ccccc1NC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819426445	FH	On-Demand	Clean	CYP2D6	17	42
COCCOc1ccccc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819426446	EG	On-Demand	Clean	MAOB	17	45
COCCOc1ccccc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819426446	EG	On-Demand	Clean	ADRB3	24	41
COCCOc1ccccc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819426446	EG	On-Demand	Clean	CTSV	28	40
Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1NS(C)(=O)=O	ZINC000819426447	FE	On-Demand	Bother	ADRB3	50	39
COCCOc1ccccc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819426448	EG	On-Demand	Clean	MAOB	17	45
COCCOc1ccccc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819426448	EG	On-Demand	Clean	ADRB3	24	41
COCCOc1ccccc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819426448	EG	On-Demand	Clean	CTSV	28	40
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cccc(NC(=O)C2CC2)c1	ZINC000819426474	IJ	On-Demand	Anodyne	TYK2	50	37
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cccc(NC(=O)C2CC2)c1	ZINC000819426474	IJ	On-Demand	Anodyne	KCNK3	49	44
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819426477	GG	On-Demand	Anodyne	ADRB2	32	51
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819426477	GG	On-Demand	Anodyne	ADRB1	26	51
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819426477	GG	On-Demand	Anodyne	HPGD	41	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819426479	GH	On-Demand	Anodyne	GCGR	15	43
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819426479	GH	On-Demand	Anodyne	ADRB3	27	41
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819426479	GH	On-Demand	Anodyne	P2RY1	57	38
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819426479	GH	On-Demand	Anodyne	CTSS	19	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819426479	GH	On-Demand	Anodyne	SCN10A	22	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819426479	GH	On-Demand	Anodyne	KCNK3	43	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819426479	GH	On-Demand	Anodyne	KCNK9	39	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1cccc(C)c1	ZINC000819426481	GG	On-Demand	Anodyne	ADRB2	32	51
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1cccc(C)c1	ZINC000819426481	GG	On-Demand	Anodyne	ADRB1	26	51
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1cccc(C)c1	ZINC000819426481	GG	On-Demand	Anodyne	HPGD	41	40
COc1ccc(C(=O)N2CCCC2)cc1NCC(C)(C)O	ZINC000819426484	CE	On-Demand	Anodyne	MLYCD	18	40
COc1ccc(C(=O)N2CCCC2)cc1NCC(C)(C)O	ZINC000819426484	CE	On-Demand	Anodyne	L3MBTL3	70	38
COc1ccc(C(=O)N2CCCC2)cc1NCC(C)(C)O	ZINC000819426484	CE	On-Demand	Anodyne	HPGD	36	43
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819426485	GH	On-Demand	Anodyne	GCGR	15	43
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819426485	GH	On-Demand	Anodyne	ADRB3	27	41
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819426485	GH	On-Demand	Anodyne	P2RY1	57	38
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819426485	GH	On-Demand	Anodyne	CTSS	19	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819426485	GH	On-Demand	Anodyne	SCN10A	22	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819426485	GH	On-Demand	Anodyne	KCNK3	43	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819426485	GH	On-Demand	Anodyne	KCNK9	39	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819426492	EE	On-Demand	Anodyne	KCNK3	41	33
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(F)cn2)c1	ZINC000819426492	EE	On-Demand	Anodyne	KCNK9	40	33
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(F)cn2)c1	ZINC000819426494	EE	On-Demand	Anodyne	KCNK3	41	33
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(F)cn2)c1	ZINC000819426494	EE	On-Demand	Anodyne	KCNK9	40	33
CCOC(=O)C1CCC(O)(CNc2ccccc2OCCOC)CC1	ZINC000819426500	FF	On-Demand	Anodyne	HCN1	44	32
CCOC(=O)C1CCC(O)(CNc2ccccc2OCCOC)CC1	ZINC000819426500	FF	On-Demand	Anodyne	HCN4	42	32
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819426505	GG	On-Demand	Anodyne	ADRB2	31	46
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819426509	GG	On-Demand	Anodyne	ADRB2	31	46
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819426512	GD	On-Demand	Anodyne	HRH4	19	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819426512	GD	On-Demand	Anodyne	SLC9A1	51	31
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819426515	GD	On-Demand	Anodyne	HRH4	19	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819426515	GD	On-Demand	Anodyne	SLC9A1	51	31
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1c(C)cccc1C	ZINC000819426538	GG	On-Demand	Anodyne	ADRB2	24	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1c(C)cccc1C	ZINC000819426541	GG	On-Demand	Anodyne	ADRB2	24	40
COCCOc1ccccc1NC[C@H](O)c1ccc(Cl)cc1	ZINC000819426576	DH	On-Demand	Anodyne	UTS2	40	31
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1ccc(F)cc1C	ZINC000819426580	GF	On-Demand	Anodyne	LRRK2	33	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1ccc(F)cc1C	ZINC000819426583	GF	On-Demand	Anodyne	LRRK2	33	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1ccc(F)cn1	ZINC000819426587	FF	On-Demand	Anodyne	HPGD	33	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1ccc(F)cn1	ZINC000819426590	FF	On-Demand	Anodyne	HPGD	33	40
CS(=O)(=O)c1ccc([C@@H](O)CNc2cccc(COCC3CC3)c2)cc1	ZINC000819426594	GG	On-Demand	Anodyne	ADRB2	22	41
CS(=O)(=O)c1ccc([C@@H](O)CNc2cccc(COCC3CC3)c2)cc1	ZINC000819426594	GG	On-Demand	Anodyne	ADRB1	15	41
CS(=O)(=O)c1ccc([C@@H](O)CNc2cccc(COCC3CC3)c2)cc1	ZINC000819426594	GG	On-Demand	Anodyne	ADRB3	26	41
CS(=O)(=O)c1ccc([C@H](O)CNc2cccc(COCC3CC3)c2)cc1	ZINC000819426596	GG	On-Demand	Anodyne	ADRB2	22	41
CS(=O)(=O)c1ccc([C@H](O)CNc2cccc(COCC3CC3)c2)cc1	ZINC000819426596	GG	On-Demand	Anodyne	ADRB1	15	41
CS(=O)(=O)c1ccc([C@H](O)CNc2cccc(COCC3CC3)c2)cc1	ZINC000819426596	GG	On-Demand	Anodyne	ADRB3	26	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819426607	GH	On-Demand	Anodyne	ADRB3	20	43
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819426607	GH	On-Demand	Anodyne	HRH3	25	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819426607	GH	On-Demand	Anodyne	CPT1A	54	34
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819426611	GH	On-Demand	Anodyne	ADRB3	20	43
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819426611	GH	On-Demand	Anodyne	HRH3	25	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819426611	GH	On-Demand	Anodyne	CPT1A	54	34
Cc1ccc(NC[C@H](O)COc2ccc(F)cc2)c(OCC(=O)N(C)C)c1	ZINC000819426622	GE	On-Demand	Anodyne	ADRB2	25	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)Cn1cccn1	ZINC000819426625	FC	On-Demand	Anodyne	LRRK2	34	43
Cc1ccc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1NS(C)(=O)=O	ZINC000819426626	FE	On-Demand	Bother	ADRB3	36	41
Cc1ccc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1NS(C)(=O)=O	ZINC000819426627	FE	On-Demand	Bother	ADRB3	36	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)Cn1cccn1	ZINC000819426630	FC	On-Demand	Anodyne	LRRK2	34	43
Cc1ccc(NC[C@@H](O)COc2ccc(F)cc2)c(OCC(=O)N(C)C)c1	ZINC000819426632	GE	On-Demand	Anodyne	ADRB2	25	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)C(C)(C)C	ZINC000819426636	ED	On-Demand	Anodyne	HRH4	16	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)C(C)(C)C	ZINC000819426636	ED	On-Demand	Anodyne	SLC9A1	43	30
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)C(C)(C)C	ZINC000819426649	ED	On-Demand	Anodyne	HRH4	16	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)C(C)(C)C	ZINC000819426649	ED	On-Demand	Anodyne	SLC9A1	43	30
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1c(F)cccc1F	ZINC000819426653	GG	On-Demand	Anodyne	HPGD	35	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1c(F)cccc1F	ZINC000819426656	GG	On-Demand	Anodyne	HPGD	35	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COCc1ccccc1	ZINC000819426659	GF	On-Demand	Anodyne	L3MBTL3	21	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COCc1ccccc1	ZINC000819426662	GF	On-Demand	Anodyne	L3MBTL3	21	41
COc1cccc([S@@](=O)CC(=O)NC[C@]2(O)CCc3ccccc32)c1	ZINC000819426673	FD	On-Demand	Anodyne	DRD4	40	31
COc1cccc([S@@](=O)CC(=O)NC[C@@]2(O)CCc3ccccc32)c1	ZINC000819426675	FD	On-Demand	Anodyne	DRD4	40	31
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)Cc1ccccc1	ZINC000819426683	FF	On-Demand	Anodyne	CTSD	15	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)Cc1ccccc1	ZINC000819426683	FF	On-Demand	Anodyne	PREP	15	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)Cc1ccccc1	ZINC000819426683	FF	On-Demand	Anodyne	PLM2_PLAFA	18	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)Cc1ccccc1	ZINC000819426683	FF	On-Demand	Anodyne	L3MBTL3	35	43
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)Cc1ccccc1	ZINC000819426683	FF	On-Demand	Anodyne	HPGD	28	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)Cc1ccccc1	ZINC000819426686	FF	On-Demand	Anodyne	CTSD	15	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)Cc1ccccc1	ZINC000819426686	FF	On-Demand	Anodyne	PREP	15	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)Cc1ccccc1	ZINC000819426686	FF	On-Demand	Anodyne	PLM2_PLAFA	18	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)Cc1ccccc1	ZINC000819426686	FF	On-Demand	Anodyne	L3MBTL3	35	43
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)Cc1ccccc1	ZINC000819426686	FF	On-Demand	Anodyne	HPGD	28	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819426695	GF	On-Demand	Anodyne	ADRB1	29	45
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819426695	GF	On-Demand	Anodyne	ADRB3	46	45
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819426695	GF	On-Demand	Anodyne	IGF1R	35	45
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819426695	GF	On-Demand	Anodyne	HRH3	24	40
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819426695	GF	On-Demand	Anodyne	CPT1A	54	36
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819426695	GF	On-Demand	Anodyne	CYP3A4	56	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819426695	GF	On-Demand	Anodyne	LRRK2	31	45
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819426698	GF	On-Demand	Anodyne	ADRB1	29	45
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819426698	GF	On-Demand	Anodyne	ADRB3	46	45
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819426698	GF	On-Demand	Anodyne	IGF1R	35	45
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819426698	GF	On-Demand	Anodyne	HRH3	24	40
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819426698	GF	On-Demand	Anodyne	CPT1A	54	36
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819426698	GF	On-Demand	Anodyne	CYP3A4	56	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819426698	GF	On-Demand	Anodyne	LRRK2	31	45
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccccc2C)c1	ZINC000819426699	EG	On-Demand	Anodyne	KCNK3	83	41
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccccc2C)c1	ZINC000819426699	EG	On-Demand	Anodyne	KCNK9	80	41
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccccc2C)c1	ZINC000819426703	EG	On-Demand	Anodyne	KCNK3	83	41
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccccc2C)c1	ZINC000819426703	EG	On-Demand	Anodyne	KCNK9	80	41
COc1ccc(C(=O)N2CCOCC2)cc1NCC1(O)CCC1	ZINC000819426715	DD	On-Demand	Anodyne	LRRK2	34	46
COC[C@@H](O)CNc1cc(C(=O)N2CCCC2)ccc1OC	ZINC000819426718	DD	On-Demand	Anodyne	SLC9A1	54	30
COC[C@@H](O)CNc1cc(C(=O)N2CCCC2)ccc1OC	ZINC000819426718	DD	On-Demand	Anodyne	L3MBTL3	60	36
COC[C@@H](O)CNc1cc(C(=O)N2CCCC2)ccc1OC	ZINC000819426718	DD	On-Demand	Anodyne	HPGD	31	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1ccccc1C	ZINC000819426719	FG	On-Demand	Anodyne	HPGD	28	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1ccccc1C	ZINC000819426720	FG	On-Demand	Anodyne	HPGD	28	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)CN1CCOCC1	ZINC000819426723	FD	On-Demand	Anodyne	LRRK2	30	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)CN1CCOCC1	ZINC000819426724	FD	On-Demand	Anodyne	LRRK2	30	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819426726	FH	On-Demand	Anodyne	ADRB1	32	47
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819426726	FH	On-Demand	Anodyne	ADRB3	53	47
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819426726	FH	On-Demand	Anodyne	IGF1R	32	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819426726	FH	On-Demand	Anodyne	HRH3	27	43
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819426726	FH	On-Demand	Anodyne	CPT1A	52	36
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819426726	FH	On-Demand	Anodyne	CPT2	40	31
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819426726	FH	On-Demand	Anodyne	CYP3A4	53	39
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819426727	FH	On-Demand	Anodyne	ADRB1	32	47
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819426727	FH	On-Demand	Anodyne	ADRB3	53	47
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819426727	FH	On-Demand	Anodyne	IGF1R	32	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819426727	FH	On-Demand	Anodyne	HRH3	27	43
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819426727	FH	On-Demand	Anodyne	CPT1A	52	36
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819426727	FH	On-Demand	Anodyne	CPT2	40	31
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819426727	FH	On-Demand	Anodyne	CYP3A4	53	39
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819426768	GH	On-Demand	Anodyne	KCNK3	43	41
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819426768	GH	On-Demand	Anodyne	PDS	41	41
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819426770	GH	On-Demand	Anodyne	KCNK3	43	41
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819426770	GH	On-Demand	Anodyne	PDS	41	41
Cc1ccc(NC[C@H](O)c2ccccc2)cc1NS(C)(=O)=O	ZINC000819426775	DF	On-Demand	Anodyne	NR3C1	15	40
Cc1ccc(NC[C@H](O)c2ccccc2)cc1NS(C)(=O)=O	ZINC000819426775	DF	On-Demand	Anodyne	ADRB2	44	48
Cc1ccc(NC[C@H](O)c2ccccc2)cc1NS(C)(=O)=O	ZINC000819426775	DF	On-Demand	Anodyne	ADRB1	29	48
Cc1ccc(NC[C@H](O)c2ccccc2)cc1NS(C)(=O)=O	ZINC000819426775	DF	On-Demand	Anodyne	ADRB3	99	47
Cc1ccc(NC[C@@H](O)c2ccccc2)cc1NS(C)(=O)=O	ZINC000819426776	DF	On-Demand	Anodyne	NR3C1	15	40
Cc1ccc(NC[C@@H](O)c2ccccc2)cc1NS(C)(=O)=O	ZINC000819426776	DF	On-Demand	Anodyne	ADRB2	44	48
Cc1ccc(NC[C@@H](O)c2ccccc2)cc1NS(C)(=O)=O	ZINC000819426776	DF	On-Demand	Anodyne	ADRB1	29	48
Cc1ccc(NC[C@@H](O)c2ccccc2)cc1NS(C)(=O)=O	ZINC000819426776	DF	On-Demand	Anodyne	ADRB3	99	47
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819426785	FG	On-Demand	Anodyne	KCNK3	53	37
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(F)cc2F)c1	ZINC000819426785	FG	On-Demand	Anodyne	KCNK9	51	37
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819426788	FG	On-Demand	Anodyne	KCNK3	53	37
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(F)cc2F)c1	ZINC000819426788	FG	On-Demand	Anodyne	KCNK9	51	37
N#Cc1ccc(Oc2ccc(NC[C@@H](O)C3CC3)cc2)cc1	ZINC000819426796	CH	On-Demand	Mild	PFKFB3	47	33
N#Cc1ccc(Oc2ccc(NC[C@H](O)C3CC3)cc2)cc1	ZINC000819426797	CH	On-Demand	Mild	PFKFB3	47	33
O=C(NNC(=S)NCCc1cccs1)c1cccc(NC(=O)c2cccnc2)c1	ZINC000819426800	IF	On-Demand	Reactive	CSF1R	16	42
O=C(NNC(=S)NCCc1cccs1)c1cccc(NC(=O)c2cccnc2)c1	ZINC000819426800	IF	On-Demand	Reactive	KCNK3	71	39
C=CCCn1cc(C(=O)N[C@@H](C)CC(=O)OCc2ccccc2)nn1	ZINC000819426805	EE	On-Demand	Mild	KLK3	50	34
C=CCCn1cc(C(=O)N[C@@H](C)CC(=O)OCc2ccccc2)nn1	ZINC000819426805	EE	On-Demand	Mild	CAPNS1	52	32
C=CCCn1cc(C(=O)N[C@@H](C)CC(=O)OCc2ccccc2)nn1	ZINC000819426805	EE	On-Demand	Mild	CAPN1	53	36
C=CCCn1cc(C(=O)N[C@@H](C)CC(=O)OCc2ccccc2)nn1	ZINC000819426805	EE	On-Demand	Mild	CAPN2	76	35
C=CCCn1cc(C(=O)N[C@@H](C)CC(=O)OCc2ccccc2)nn1	ZINC000819426805	EE	On-Demand	Mild	NPR	63	34
C=CCCn1cc(C(=O)N[C@@H](C)CC(=O)OCc2ccccc2)nn1	ZINC000819426805	EE	On-Demand	Mild	Q6PRC7_IXORI	40	31
C=CCCn1cc(C(=O)N[C@H](C)CC(=O)OCc2ccccc2)nn1	ZINC000819426807	EE	On-Demand	Mild	KLK3	50	34
C=CCCn1cc(C(=O)N[C@H](C)CC(=O)OCc2ccccc2)nn1	ZINC000819426807	EE	On-Demand	Mild	CAPNS1	52	32
C=CCCn1cc(C(=O)N[C@H](C)CC(=O)OCc2ccccc2)nn1	ZINC000819426807	EE	On-Demand	Mild	CAPN1	53	36
C=CCCn1cc(C(=O)N[C@H](C)CC(=O)OCc2ccccc2)nn1	ZINC000819426807	EE	On-Demand	Mild	CAPN2	76	35
C=CCCn1cc(C(=O)N[C@H](C)CC(=O)OCc2ccccc2)nn1	ZINC000819426807	EE	On-Demand	Mild	NPR	63	34
C=CCCn1cc(C(=O)N[C@H](C)CC(=O)OCc2ccccc2)nn1	ZINC000819426807	EE	On-Demand	Mild	Q6PRC7_IXORI	40	31
COCc1c(C(=O)NNC(=S)NCCc2cccs2)cnn1-c1ccccc1	ZINC000819426818	HE	On-Demand	Reactive	GPR142	52	34
O=C(NNC(=S)NCCc1cccs1)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819426826	HF	On-Demand	Reactive	SLC6A1	75	36
O=C(NNC(=S)NCCc1cccs1)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819426828	HF	On-Demand	Reactive	SLC6A1	75	36
C[C@H](CC(=O)OCc1ccccc1)NC(=O)c1cc2c(cn1)OCCO2	ZINC000819426842	FE	On-Demand	Anodyne	CAPNS1	52	32
C[C@H](CC(=O)OCc1ccccc1)NC(=O)c1cc2c(cn1)OCCO2	ZINC000819426842	FE	On-Demand	Anodyne	CAPN1	55	36
C[C@H](CC(=O)OCc1ccccc1)NC(=O)c1cc2c(cn1)OCCO2	ZINC000819426842	FE	On-Demand	Anodyne	CAPN2	66	32
C[C@H](CC(=O)OCc1ccccc1)NC(=O)c1cc2c(cn1)OCCO2	ZINC000819426842	FE	On-Demand	Anodyne	NPR	65	34
CCOc1cc2c(cc1NC[C@@H](O)COc1ccccc1)O[C@H](C)C2	ZINC000819426849	EG	On-Demand	Anodyne	ADRB2	26	40
CCOc1cc2c(cc1NC[C@@H](O)COc1ccccc1)O[C@@H](C)C2	ZINC000819426850	EG	On-Demand	Anodyne	ADRB2	26	40
CCOc1cc2c(cc1NC[C@H](O)COc1ccccc1)O[C@@H](C)C2	ZINC000819426852	EG	On-Demand	Anodyne	ADRB2	26	40
CCOc1cc2c(cc1NC[C@H](O)COc1ccccc1)O[C@H](C)C2	ZINC000819426854	EG	On-Demand	Anodyne	ADRB2	26	40
O=C(NNC(=S)NCCc1cccs1)c1cccn2c(O)nnc12	ZINC000819426857	FC	On-Demand	Reactive	POLR1A	49	30
Cc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1NS(C)(=O)=O	ZINC000819426906	FG	On-Demand	Anodyne	ADRB2	37	41
Cc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1NS(C)(=O)=O	ZINC000819426906	FG	On-Demand	Anodyne	ADRB1	15	49
Cc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1NS(C)(=O)=O	ZINC000819426906	FG	On-Demand	Anodyne	GRIN1	22	43
Cc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1NS(C)(=O)=O	ZINC000819426906	FG	On-Demand	Anodyne	ADRB3	55	46
Cc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1NS(C)(=O)=O	ZINC000819426906	FG	On-Demand	Anodyne	TRPV1	27	42
Cc1ccc(NC[C@H](O)c2ccc(Cl)cc2Cl)cc1NS(C)(=O)=O	ZINC000819426930	GH	On-Demand	Anodyne	GRIN1	26	41
O[C@H](CNc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccccc1	ZINC000819426938	FG	On-Demand	Anodyne	HTR1A	21	49
O[C@H](CNc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccccc1	ZINC000819426938	FG	On-Demand	Anodyne	DRD2	15	45
O[C@H](CNc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccccc1	ZINC000819426938	FG	On-Demand	Anodyne	DRD3	17	45
O[C@H](CNc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccccc1	ZINC000819426938	FG	On-Demand	Anodyne	HTR7	20	45
O[C@@H](CNc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccccc1	ZINC000819426940	FG	On-Demand	Anodyne	HTR1A	21	49
O[C@@H](CNc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccccc1	ZINC000819426940	FG	On-Demand	Anodyne	DRD2	15	45
O[C@@H](CNc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccccc1	ZINC000819426940	FG	On-Demand	Anodyne	DRD3	17	45
O[C@@H](CNc1cccc(N2CCN(CC3CC3)CC2)c1)c1ccccc1	ZINC000819426940	FG	On-Demand	Anodyne	HTR7	20	45
Cc1ccc(NC[C@@H](O)c2ccc(Cl)cc2Cl)cc1NS(C)(=O)=O	ZINC000819426941	GH	On-Demand	Anodyne	GRIN1	26	41
O=C(NNC(=S)NCCc1cccs1)c1ncccc1Oc1ccccc1	ZINC000819426954	GG	On-Demand	Reactive	MAP1	24	40
CCOc1ccc(OC[C@@H](O)CNc2ccc(N(C)C(=O)OC)cc2)cc1	ZINC000819426958	FG	On-Demand	Anodyne	ADRB2	39	44
CCOc1ccc(OC[C@@H](O)CNc2ccc(N(C)C(=O)OC)cc2)cc1	ZINC000819426958	FG	On-Demand	Anodyne	ADRB1	55	44
CCOc1ccc(OC[C@H](O)CNc2ccc(N(C)C(=O)OC)cc2)cc1	ZINC000819426959	FG	On-Demand	Anodyne	ADRB2	39	44
CCOc1ccc(OC[C@H](O)CNc2ccc(N(C)C(=O)OC)cc2)cc1	ZINC000819426959	FG	On-Demand	Anodyne	ADRB1	55	44
Cc1ccc(NC[C@H](O)COc2ccccc2F)c(OCC(=O)N(C)C)c1	ZINC000819427007	GE	On-Demand	Anodyne	ADRB2	20	41
Cc1ccc(NC[C@@H](O)COc2ccccc2F)c(OCC(=O)N(C)C)c1	ZINC000819427008	GE	On-Demand	Anodyne	ADRB2	20	41
O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2ccccc2O)C2CCCCC2)cc1	ZINC000819427013	GH	On-Demand	Clean	COLA	65	41
O=C(NCCCc1ccccc1)C(=O)NNC(=S)NCCc1cccs1	ZINC000819427014	GD	On-Demand	Reactive	AMP1_PLAFQ	22	40
C[C@@H]1CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819427019	GI	On-Demand	Mild	PAPA1_CARPA	44	45
C[C@@H]1CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819427019	GI	On-Demand	Mild	CTSK	20	42
C[C@@H]1CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819427019	GI	On-Demand	Mild	CTSL	20	45
C[C@@H]1CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819427019	GI	On-Demand	Mild	FPR1	46	39
C[C@@H]1CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819427021	GI	On-Demand	Mild	PAPA1_CARPA	44	45
C[C@@H]1CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819427021	GI	On-Demand	Mild	CTSK	20	42
C[C@@H]1CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819427021	GI	On-Demand	Mild	CTSL	20	45
C[C@@H]1CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819427021	GI	On-Demand	Mild	FPR1	46	39
COCCOc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819427030	CE	On-Demand	Anodyne	ADRB2	17	41
COCCOc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819427030	CE	On-Demand	Anodyne	ADRB1	22	43
COCCOc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819427030	CE	On-Demand	Anodyne	ADRB3	66	45
COCCOc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819427031	CE	On-Demand	Anodyne	ADRB2	17	41
COCCOc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819427031	CE	On-Demand	Anodyne	ADRB1	22	43
COCCOc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819427031	CE	On-Demand	Anodyne	ADRB3	66	45
C[C@H](CC(=O)NNC(=S)NCCc1cccs1)NC(=O)OC(C)(C)C	ZINC000819427038	GE	On-Demand	Reactive	PAPA1_CARPA	32	48
C[C@@H](CC(=O)NNC(=S)NCCc1cccs1)NC(=O)OC(C)(C)C	ZINC000819427040	GE	On-Demand	Reactive	PAPA1_CARPA	32	48
COC(=O)c1sccc1S(=O)(=O)N(Cc1ccccc1O)C1CCCCC1	ZINC000819427068	HH	On-Demand	Clean	AVPR1B	19	42
C[C@@H](CC(=O)N1CCSc2ccccc21)NC(=O)OC(C)(C)C	ZINC000819427070	EG	On-Demand	Anodyne	FPR1	41	34
O=C(NNC(=S)NCCc1cccs1)c1ccc(Cn2ccnc2)cc1	ZINC000819427111	GE	On-Demand	Reactive	CYP11B1	42	41
O=C(NNC(=S)NCCc1cccs1)c1ccc(Cn2ccnc2)cc1	ZINC000819427111	GE	On-Demand	Reactive	TBXAS1	36	42
CCOC(=O)c1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)on1	ZINC000819427112	FD	On-Demand	Clean	P2RY12	43	42
CCOC(=O)c1cc(C(=O)N2CCN(c3ccc(OC)cc3)CC2)on1	ZINC000819427112	FD	On-Demand	Clean	CCKAR	41	39
Cc1ccc(NC[C@H](O)c2ccccc2Cl)cc1NS(C)(=O)=O	ZINC000819427155	FG	On-Demand	Anodyne	GRIN1	27	42
Cc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1NS(C)(=O)=O	ZINC000819427159	GH	On-Demand	Anodyne	ADRB2	37	42
Cc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1NS(C)(=O)=O	ZINC000819427159	GH	On-Demand	Anodyne	ADRB3	55	40
Cc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1NS(C)(=O)=O	ZINC000819427159	GH	On-Demand	Anodyne	TRPV1	46	36
Cc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1NS(C)(=O)=O	ZINC000819427161	GH	On-Demand	Anodyne	ADRB2	37	42
Cc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1NS(C)(=O)=O	ZINC000819427161	GH	On-Demand	Anodyne	ADRB3	55	40
Cc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1NS(C)(=O)=O	ZINC000819427161	GH	On-Demand	Anodyne	TRPV1	46	36
COc1cccc([S@@](=O)CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819427171	GE	On-Demand	Anodyne	CASP3	15	40
COc1cccc([S@@](=O)CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819427171	GE	On-Demand	Anodyne	KLK3	47	32
COc1cccc([S@@](=O)CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819427171	GE	On-Demand	Anodyne	CTSB	39	41
COc1cccc([S@@](=O)CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819427171	GE	On-Demand	Anodyne	CTSK	25	41
COc1cccc([S@@](=O)CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819427171	GE	On-Demand	Anodyne	CAPNS1	54	33
COc1cccc([S@@](=O)CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819427171	GE	On-Demand	Anodyne	CAPN1	61	41
COc1cccc([S@@](=O)CC(=O)N[C@@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819427171	GE	On-Demand	Anodyne	CAPN2	88	41
COc1cccc([S@@](=O)CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819427172	GE	On-Demand	Anodyne	CASP3	15	40
COc1cccc([S@@](=O)CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819427172	GE	On-Demand	Anodyne	KLK3	47	32
COc1cccc([S@@](=O)CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819427172	GE	On-Demand	Anodyne	CTSB	39	41
COc1cccc([S@@](=O)CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819427172	GE	On-Demand	Anodyne	CTSK	25	41
COc1cccc([S@@](=O)CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819427172	GE	On-Demand	Anodyne	CAPNS1	54	33
COc1cccc([S@@](=O)CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819427172	GE	On-Demand	Anodyne	CAPN1	61	41
COc1cccc([S@@](=O)CC(=O)N[C@H](C)CC(=O)OCc2ccccc2)c1	ZINC000819427172	GE	On-Demand	Anodyne	CAPN2	88	41
CC(=O)Nc1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)cc1	ZINC000819427188	HF	On-Demand	Clean	COLA	35	41
CC(=O)Nc1ccc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)cc1	ZINC000819427190	HF	On-Demand	Clean	COLA	35	41
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819427197	FG	On-Demand	Anodyne	KCNK3	54	37
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2cc(F)ccc2F)c1	ZINC000819427197	FG	On-Demand	Anodyne	KCNK9	55	37
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819427201	FG	On-Demand	Anodyne	KCNK3	54	37
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2cc(F)ccc2F)c1	ZINC000819427201	FG	On-Demand	Anodyne	KCNK9	55	37
Cc1ccc(NC[C@H](O)c2ccc(F)c(F)c2)cc1NS(C)(=O)=O	ZINC000819427207	FF	On-Demand	Anodyne	ADRB2	37	42
Cc1ccc(NC[C@H](O)c2ccc(F)c(F)c2)cc1NS(C)(=O)=O	ZINC000819427207	FF	On-Demand	Anodyne	ADRB3	57	44
Cc1ccc(NC[C@H](O)c2ccc(F)c(F)c2)cc1NS(C)(=O)=O	ZINC000819427207	FF	On-Demand	Anodyne	TRPV1	93	38
Cc1ccc(NC[C@@H](O)c2ccc(F)c(F)c2)cc1NS(C)(=O)=O	ZINC000819427209	FF	On-Demand	Anodyne	ADRB2	37	42
Cc1ccc(NC[C@@H](O)c2ccc(F)c(F)c2)cc1NS(C)(=O)=O	ZINC000819427209	FF	On-Demand	Anodyne	ADRB3	57	44
Cc1ccc(NC[C@@H](O)c2ccc(F)c(F)c2)cc1NS(C)(=O)=O	ZINC000819427209	FF	On-Demand	Anodyne	TRPV1	93	38
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2cccc(F)c2)c1	ZINC000819427222	EF	On-Demand	Anodyne	KCNK9	41	38
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2cccc(F)c2)c1	ZINC000819427224	EF	On-Demand	Anodyne	KCNK9	41	38
Cc1ccc(NC[C@H](O)c2ccc(F)cn2)cc1NS(C)(=O)=O	ZINC000819427256	EE	On-Demand	Anodyne	GRIN1	20	40
Cc1ccc(NC[C@@H](O)c2ccc(F)cn2)cc1NS(C)(=O)=O	ZINC000819427257	EE	On-Demand	Anodyne	GRIN1	20	40
Cc1ccc(NC[C@@H](O)COc2c(C)cccc2C)c(OCC(=O)N(C)C)c1	ZINC000819427295	GF	On-Demand	Anodyne	ADRB2	17	40
Cc1ccc(NC[C@H](O)COc2c(C)cccc2C)c(OCC(=O)N(C)C)c1	ZINC000819427296	GF	On-Demand	Anodyne	ADRB2	17	40
Cc1ccc(NC[C@H](O)COc2ccccc2C)c(OCC(=O)N(C)C)c1	ZINC000819427320	FF	On-Demand	Anodyne	ADRB2	24	50
Cc1ccc(NC[C@@H](O)COc2ccccc2C)c(OCC(=O)N(C)C)c1	ZINC000819427321	FF	On-Demand	Anodyne	ADRB2	24	50
O=C(NNC(=S)NCCc1cccs1)[C@@H]1CCCN(CC(F)(F)F)C1	ZINC000819427365	GE	On-Demand	Reactive	SLC6A1	83	37
O=C(NNC(=S)NCCc1cccs1)[C@H]1CCCN(CC(F)(F)F)C1	ZINC000819427366	GE	On-Demand	Reactive	SLC6A1	83	37
NS(=O)(=O)c1ccc(S(=O)(=O)N(Cc2ccccc2O)C2CCCCC2)cc1	ZINC000819427375	HF	On-Demand	Clean	CA2	31	40
NS(=O)(=O)c1ccc(S(=O)(=O)N(Cc2ccccc2O)C2CCCCC2)cc1	ZINC000819427375	HF	On-Demand	Clean	AVPR1B	19	40
NS(=O)(=O)c1ccc(S(=O)(=O)N(Cc2ccccc2O)C2CCCCC2)cc1	ZINC000819427375	HF	On-Demand	Clean	CA5A	44	35
CC(=O)Nc1ccc(S(=O)(=O)N(Cc2ccccc2O)C2CCCCC2)cc1	ZINC000819427377	HH	On-Demand	Clean	CA2	17	41
CC(=O)Nc1ccc(S(=O)(=O)N(Cc2ccccc2O)C2CCCCC2)cc1	ZINC000819427377	HH	On-Demand	Clean	AVPR1B	20	45
CC(=O)Nc1ccc(S(=O)(=O)N(Cc2ccccc2O)C2CCCCC2)cc1	ZINC000819427377	HH	On-Demand	Clean	COLA	37	42
CC(=O)Nc1ccc(S(=O)(=O)N(Cc2ccccc2O)C2CCCCC2)cc1	ZINC000819427377	HH	On-Demand	Clean	CA12	15	41
CC(=O)Nc1ccc(S(=O)(=O)N(Cc2ccccc2O)C2CCCCC2)cc1	ZINC000819427377	HH	On-Demand	Clean	CA9	16	41
O=S(=O)(c1ccc(F)cc1)N(Cc1ccccc1O)C1CCCCC1	ZINC000819427391	FI	On-Demand	Clean	AVPR1B	19	41
O=S(=O)(c1ccc(F)cc1)N(Cc1ccccc1O)C1CCCCC1	ZINC000819427391	FI	On-Demand	Clean	PTGDR2	15	43
O=C(NNC(=S)NCCc1cccs1)[C@@H](O)Cc1ccccc1	ZINC000819427413	ED	On-Demand	Reactive	CTSC	38	43
O=S(=O)(c1ccc(S(=O)(=O)N(Cc2ccccc2O)C2CCCCC2)cc1)N1CCCC1	ZINC000819427417	JH	On-Demand	Clean	NAMPT	23	44
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819427431	DF	On-Demand	Anodyne	ADRB2	29	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819427431	DF	On-Demand	Anodyne	ADRB1	40	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819427431	DF	On-Demand	Anodyne	ADRB3	66	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819427431	DF	On-Demand	Anodyne	KCNK3	97	38
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819427431	DF	On-Demand	Anodyne	KCNK9	74	38
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819427432	DF	On-Demand	Anodyne	ADRB2	29	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819427432	DF	On-Demand	Anodyne	ADRB1	40	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819427432	DF	On-Demand	Anodyne	ADRB3	66	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819427432	DF	On-Demand	Anodyne	KCNK3	97	38
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819427432	DF	On-Demand	Anodyne	KCNK9	74	38
O=[N+]([O-])c1cc(S(=O)(=O)N(Cc2ccccc2O)C[C@@H]2CCCO2)ccc1O	ZINC000819427434	HE	On-Demand	Clean	COLA	79	34
O=[N+]([O-])c1cc(S(=O)(=O)N(Cc2ccccc2O)C[C@H]2CCCO2)ccc1O	ZINC000819427437	HE	On-Demand	Clean	COLA	79	34
Cc1ccc(NC[C@H](O)c2cccc(Br)c2)cc1NS(C)(=O)=O	ZINC000819427438	GG	On-Demand	Anodyne	ADRB2	36	41
Cc1ccc(NC[C@H](O)c2cccc(Br)c2)cc1NS(C)(=O)=O	ZINC000819427438	GG	On-Demand	Anodyne	ADRB3	61	44
Cc1ccc(NC[C@@H](O)c2cccc(Br)c2)cc1NS(C)(=O)=O	ZINC000819427441	GG	On-Demand	Anodyne	ADRB2	36	41
Cc1ccc(NC[C@@H](O)c2cccc(Br)c2)cc1NS(C)(=O)=O	ZINC000819427441	GG	On-Demand	Anodyne	ADRB3	61	44
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccccc2Cl)c1	ZINC000819427446	EG	On-Demand	Anodyne	KCNK3	70	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccccc2Cl)c1	ZINC000819427446	EG	On-Demand	Anodyne	KCNK9	65	40
CN1C(=O)CC[C@H]1C(=O)NNC(=S)NCCc1cccs1	ZINC000819427447	EC	On-Demand	Reactive	P2RX7	27	46
CN1C(=O)CC[C@@H]1C(=O)NNC(=S)NCCc1cccs1	ZINC000819427449	EC	On-Demand	Reactive	P2RX7	27	46
O[C@@H](CNc1cccc(COCC2CC2)c1)c1cccc(Cl)c1	ZINC000819427471	EI	On-Demand	Anodyne	ADRB1	36	42
O[C@@H](CNc1cccc(COCC2CC2)c1)c1cccc(Cl)c1	ZINC000819427471	EI	On-Demand	Anodyne	ADRB3	45	39
O[C@@H](CNc1cccc(COCC2CC2)c1)c1cccc(Cl)c1	ZINC000819427471	EI	On-Demand	Anodyne	CYP3A4	45	34
O[C@H](CNc1cccc(COCC2CC2)c1)c1cccc(Cl)c1	ZINC000819427473	EI	On-Demand	Anodyne	ADRB1	36	42
O[C@H](CNc1cccc(COCC2CC2)c1)c1cccc(Cl)c1	ZINC000819427473	EI	On-Demand	Anodyne	ADRB3	45	39
O[C@H](CNc1cccc(COCC2CC2)c1)c1cccc(Cl)c1	ZINC000819427473	EI	On-Demand	Anodyne	CYP3A4	45	34
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1ccc(-n2cccc2)cc1	ZINC000819427474	IK	On-Demand	Anodyne	PRNP	44	33
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1ccc(-n2cccc2)cc1	ZINC000819427474	IK	On-Demand	Anodyne	EPHB3	40	37
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccccc2Br)c1	ZINC000819427502	GH	On-Demand	Anodyne	KCNK3	55	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccccc2Br)c1	ZINC000819427502	GH	On-Demand	Anodyne	KCNK9	60	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccccc2Br)c1	ZINC000819427505	GH	On-Demand	Anodyne	KCNK3	55	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccccc2Br)c1	ZINC000819427505	GH	On-Demand	Anodyne	KCNK9	60	40
O=C(NNC(=S)NCCc1cccs1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000819427511	HD	On-Demand	Reactive	DRD4	20	40
O=C(NNC(=S)NCCc1cccs1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000819427519	HD	On-Demand	Reactive	DRD4	20	40
O[C@H](CNc1cccc(COCC2CC2)c1)c1cccnc1	ZINC000819427522	CG	On-Demand	Anodyne	ADRB3	68	41
O[C@@H](CNc1cccc(COCC2CC2)c1)c1cccnc1	ZINC000819427524	CG	On-Demand	Anodyne	ADRB3	68	41
COC(=O)c1ccc(S(=O)(=O)N(Cc2ccccc2O)C2CCCCC2)cc1	ZINC000819427525	HH	On-Demand	Clean	AVPR1B	22	47
CS(=O)(=O)CC(=O)NNC(=S)NCCc1cccs1	ZINC000819427538	DB	On-Demand	Reactive	CA5B	40	45
Cc1ccc(NC[C@@H](O)CCNC(=O)OC(C)(C)C)cc1NS(C)(=O)=O	ZINC000819427553	GE	On-Demand	Anodyne	PTPRB	18	40
Cc1ccc(NC[C@H](O)CCNC(=O)OC(C)(C)C)cc1NS(C)(=O)=O	ZINC000819427554	GE	On-Demand	Anodyne	PTPRB	18	40
Cc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)c(OCC(=O)N(C)C)c1	ZINC000819427633	GF	On-Demand	Anodyne	ADRB2	24	41
Cc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)c(OCC(=O)N(C)C)c1	ZINC000819427634	GF	On-Demand	Anodyne	ADRB2	24	41
CC(=O)c1ccc(CC(=O)NNC(=S)NCCc2cccs2)cc1	ZINC000819427656	FE	On-Demand	Reactive	CA5B	36	42
O=[N+]([O-])c1cc(S(=O)(=O)N(Cc2ccccc2O)C2CCCCC2)ccc1O	ZINC000819427660	HH	On-Demand	Clean	COLA	105	37
COCCOc1ccccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819427697	EF	On-Demand	Bother	CACNA1C	60	43
COCCOc1ccccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819427697	EF	On-Demand	Bother	CACNA1D	94	43
COCCOc1ccccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819427699	EF	On-Demand	Bother	CACNA1C	60	43
COCCOc1ccccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819427699	EF	On-Demand	Bother	CACNA1D	94	43
COCCOc1ccccc1NCC1(O)CCS(=O)(=O)CC1	ZINC000819427702	ED	On-Demand	Anodyne	HCN1	62	34
COCCOc1ccccc1NCC1(O)CCS(=O)(=O)CC1	ZINC000819427702	ED	On-Demand	Anodyne	HCN4	49	31
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)cc1	ZINC000819427730	GH	On-Demand	Mild	ADRB2	24	40
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)cc1	ZINC000819427730	GH	On-Demand	Mild	ADRB1	51	37
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)cc1	ZINC000819427730	GH	On-Demand	Mild	ADRB3	20	40
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)cc1	ZINC000819427730	GH	On-Demand	Mild	CASR	40	38
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)cc1	ZINC000819427735	GH	On-Demand	Mild	ADRB2	24	40
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)cc1	ZINC000819427735	GH	On-Demand	Mild	ADRB1	51	37
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)cc1	ZINC000819427735	GH	On-Demand	Mild	ADRB3	20	40
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)cc1	ZINC000819427735	GH	On-Demand	Mild	CASR	40	38
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OC[C@H]2CCCCO2)cc1	ZINC000819427738	GH	On-Demand	Mild	ADRB2	24	40
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OC[C@H]2CCCCO2)cc1	ZINC000819427738	GH	On-Demand	Mild	ADRB1	51	37
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OC[C@H]2CCCCO2)cc1	ZINC000819427738	GH	On-Demand	Mild	ADRB3	20	40
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OC[C@H]2CCCCO2)cc1	ZINC000819427738	GH	On-Demand	Mild	CASR	40	38
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OC[C@H]2CCCCO2)cc1	ZINC000819427742	GH	On-Demand	Mild	ADRB2	24	40
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OC[C@H]2CCCCO2)cc1	ZINC000819427742	GH	On-Demand	Mild	ADRB1	51	37
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OC[C@H]2CCCCO2)cc1	ZINC000819427742	GH	On-Demand	Mild	ADRB3	20	40
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OC[C@H]2CCCCO2)cc1	ZINC000819427742	GH	On-Demand	Mild	CASR	40	38
COCCOc1ccccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819427745	FG	On-Demand	Clean	ADRB2	27	62
COCCOc1ccccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819427745	FG	On-Demand	Clean	ADRB1	41	62
COCCOc1ccccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819427745	FG	On-Demand	Clean	CYP2D6	20	46
COc1ccccc1-n1ncc(C(=O)NNC(=S)NCCc2cccs2)c1C	ZINC000819427746	HF	On-Demand	Reactive	GPR142	48	31
COCCOc1ccccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819427748	FG	On-Demand	Clean	ADRB2	27	62
COCCOc1ccccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819427748	FG	On-Demand	Clean	ADRB1	41	62
COCCOc1ccccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819427748	FG	On-Demand	Clean	CYP2D6	20	46
CC(C)(C)OC(=O)N[C@@H](C(=O)NNC(=S)NCCc1cccs1)C1CCOCC1	ZINC000819427758	IE	On-Demand	Reactive	PAPA1_CARPA	24	45
COCCOc1ccccc1NC[C@H](O)C1CCCCC1	ZINC000819427775	CG	On-Demand	Anodyne	AMY2	45	32
COCCOc1ccccc1NC[C@@H](O)C1CCCCC1	ZINC000819427779	CG	On-Demand	Anodyne	AMY2	45	32
O=S(=O)(c1ccccc1)N(Cc1ccccc1O)C1CCCCC1	ZINC000819427783	EH	On-Demand	Clean	ACE	45	36
O=S(=O)(c1ccccc1)N(Cc1ccccc1O)C1CCCCC1	ZINC000819427783	EH	On-Demand	Clean	AVPR1B	19	41
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)c1	ZINC000819427807	FH	On-Demand	Bother	CYP3A4	43	32
O=[N+]([O-])c1cccc([C@H](O)CNc2ccccc2OC[C@H]2CCCCO2)c1	ZINC000819427808	FH	On-Demand	Bother	CYP3A4	43	32
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccccc2OC[C@H]2CCCCO2)c1	ZINC000819427809	FH	On-Demand	Bother	CYP3A4	43	32
O=[N+]([O-])c1cccc([C@H](O)CNc2ccccc2OC[C@@H]2CCCCO2)c1	ZINC000819427810	FH	On-Demand	Bother	CYP3A4	43	32
COCCOc1ccccc1NC[C@@H](O)CCc1ccccc1	ZINC000819427816	DG	On-Demand	Clean	CTSG	15	40
COCCOc1ccccc1NC[C@@H](O)CCc1ccccc1	ZINC000819427816	DG	On-Demand	Clean	CTRB1	25	40
COCCOc1ccccc1NC[C@@H](O)CCc1ccccc1	ZINC000819427816	DG	On-Demand	Clean	CELA2A	17	40
COCCOc1ccccc1NC[C@@H](O)CCc1ccccc1	ZINC000819427816	DG	On-Demand	Clean	ABCB1	45	41
Cc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1NS(C)(=O)=O	ZINC000819427817	GD	On-Demand	Anodyne	ADRB2	36	41
Cc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1NS(C)(=O)=O	ZINC000819427817	GD	On-Demand	Anodyne	ADRB3	56	47
Cc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1NS(C)(=O)=O	ZINC000819427818	GD	On-Demand	Anodyne	ADRB2	36	41
Cc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1NS(C)(=O)=O	ZINC000819427818	GD	On-Demand	Anodyne	ADRB3	56	47
COCCOc1ccccc1NC[C@H](O)CCc1ccccc1	ZINC000819427820	DG	On-Demand	Clean	CTSG	15	40
COCCOc1ccccc1NC[C@H](O)CCc1ccccc1	ZINC000819427820	DG	On-Demand	Clean	CTRB1	25	40
COCCOc1ccccc1NC[C@H](O)CCc1ccccc1	ZINC000819427820	DG	On-Demand	Clean	CELA2A	17	40
COCCOc1ccccc1NC[C@H](O)CCc1ccccc1	ZINC000819427820	DG	On-Demand	Clean	ABCB1	45	41
Cc1ccc(NC[C@H](O)c2ccc(Cl)c(F)c2)cc1NS(C)(=O)=O	ZINC000819427828	FG	On-Demand	Anodyne	ADRB2	37	40
Cc1ccc(NC[C@H](O)c2ccc(Cl)c(F)c2)cc1NS(C)(=O)=O	ZINC000819427828	FG	On-Demand	Anodyne	GRIN1	26	46
Cc1ccc(NC[C@H](O)c2ccc(Cl)c(F)c2)cc1NS(C)(=O)=O	ZINC000819427828	FG	On-Demand	Anodyne	ADRB3	48	44
Cc1ccc(NC[C@H](O)c2ccc(Cl)c(F)c2)cc1NS(C)(=O)=O	ZINC000819427828	FG	On-Demand	Anodyne	TRPV1	86	38
Cc1ccc(NC[C@@H](O)c2ccc(Cl)c(F)c2)cc1NS(C)(=O)=O	ZINC000819427829	FG	On-Demand	Anodyne	ADRB2	37	40
Cc1ccc(NC[C@@H](O)c2ccc(Cl)c(F)c2)cc1NS(C)(=O)=O	ZINC000819427829	FG	On-Demand	Anodyne	GRIN1	26	46
Cc1ccc(NC[C@@H](O)c2ccc(Cl)c(F)c2)cc1NS(C)(=O)=O	ZINC000819427829	FG	On-Demand	Anodyne	ADRB3	48	44
Cc1ccc(NC[C@@H](O)c2ccc(Cl)c(F)c2)cc1NS(C)(=O)=O	ZINC000819427829	FG	On-Demand	Anodyne	TRPV1	86	38
O=C(C(F)=C1CCC1)N1CCC(Oc2ccccc2Cl)CC1	ZINC000819427831	DI	On-Demand	Anodyne	SCD1	49	48
O=C(C(F)=C1CCC1)N1CCC(Oc2ccccc2Cl)CC1	ZINC000819427831	DI	On-Demand	Anodyne	SCD	33	48
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819427834	EG	On-Demand	Anodyne	KCNK3	62	37
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(F)cc2C)c1	ZINC000819427834	EG	On-Demand	Anodyne	KCNK9	68	36
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819427835	EG	On-Demand	Anodyne	KCNK3	62	37
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(F)cc2C)c1	ZINC000819427835	EG	On-Demand	Anodyne	KCNK9	68	36
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819427881	FF	On-Demand	Bother	CACNA1C	46	36
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819427881	FF	On-Demand	Bother	CACNA1D	70	36
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819427883	FF	On-Demand	Bother	CACNA1C	46	36
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819427883	FF	On-Demand	Bother	CACNA1D	70	36
O=C(NNC(=S)NCCc1cccs1)c1nc(-c2ccccc2)cs1	ZINC000819427927	GG	On-Demand	Reactive	ROCK1	17	43
O=C(NNC(=S)NCCc1cccs1)c1cc2ccc(Cl)cc2[nH]1	ZINC000819427956	GG	On-Demand	Reactive	PYGL	61	41
CCN(CC)S(=O)(=O)CC(=O)NNC(=S)NCCc1cccs1	ZINC000819427973	GC	On-Demand	Reactive	CA5B	30	42
COc1ccc(Cn2cc(C(=O)NNC(=S)NCCc3cccs3)cn2)cc1	ZINC000819427978	HE	On-Demand	Reactive	PROKR1	53	33
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819428124	FH	On-Demand	Anodyne	KCNK3	48	35
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(F)cc2Cl)c1	ZINC000819428124	FH	On-Demand	Anodyne	KCNK9	45	35
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819428126	FH	On-Demand	Anodyne	KCNK3	48	35
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(F)cc2Cl)c1	ZINC000819428126	FH	On-Demand	Anodyne	KCNK9	45	35
CCOC[C@H](O)CNc1ccccc1OCCOC	ZINC000819428134	CD	On-Demand	Clean	ADRB2	25	41
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819428141	EG	On-Demand	Anodyne	ADRB2	18	43
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819428141	EG	On-Demand	Anodyne	KCNK3	76	37
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819428141	EG	On-Demand	Anodyne	KCNK9	70	37
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819428143	EG	On-Demand	Anodyne	ADRB2	18	43
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819428143	EG	On-Demand	Anodyne	KCNK3	76	37
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819428143	EG	On-Demand	Anodyne	KCNK9	70	37
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819428151	DE	On-Demand	Anodyne	ADRB2	24	41
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819428151	DE	On-Demand	Anodyne	ADRB1	29	44
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819428151	DE	On-Demand	Anodyne	ADRB3	92	45
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819428151	DE	On-Demand	Anodyne	KCNA5	21	40
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819428152	DE	On-Demand	Anodyne	ADRB2	24	41
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819428152	DE	On-Demand	Anodyne	ADRB1	29	44
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819428152	DE	On-Demand	Anodyne	ADRB3	92	45
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819428152	DE	On-Demand	Anodyne	KCNA5	21	40
CCSc1ccccc1C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl	ZINC000819428156	IK	On-Demand	Anodyne	EPHB3	42	35
C#CCNC(=O)CCNc1cccc(COCc2ccc(OC)cc2)c1	ZINC000819428169	FF	On-Demand	Mild	CTSK	16	41
C#CCNC(=O)CCNc1cccc(COCc2ccc(OC)cc2)c1	ZINC000819428169	FF	On-Demand	Mild	MTNR1A	44	36
C#CCNC(=O)CCNc1cccc(COCc2ccc(OC)cc2)c1	ZINC000819428169	FF	On-Demand	Mild	MTNR1B	41	36
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cncn1-c1ccccc1	ZINC000819428201	IJ	On-Demand	Anodyne	EPHB3	49	39
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819428231	EG	On-Demand	Anodyne	KCNK3	75	35
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2cc(C)cc(C)c2)c1	ZINC000819428231	EG	On-Demand	Anodyne	KCNK9	68	35
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819428232	EG	On-Demand	Anodyne	KCNK3	75	35
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2cc(C)cc(C)c2)c1	ZINC000819428232	EG	On-Demand	Anodyne	KCNK9	68	35
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N(C)C(=O)OC)cc2)cc1	ZINC000819428235	GF	On-Demand	Anodyne	ADRB2	39	45
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N(C)C(=O)OC)cc2)cc1	ZINC000819428235	GF	On-Demand	Anodyne	ADRB1	60	45
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N(C)C(=O)OC)cc2)cc1	ZINC000819428235	GF	On-Demand	Anodyne	ADRB3	38	45
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(N(C)C(=O)OC)cc2)cc1	ZINC000819428236	GF	On-Demand	Anodyne	ADRB2	39	45
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(N(C)C(=O)OC)cc2)cc1	ZINC000819428236	GF	On-Demand	Anodyne	ADRB1	60	45
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(N(C)C(=O)OC)cc2)cc1	ZINC000819428236	GF	On-Demand	Anodyne	ADRB3	38	45
Cc1ccccc1[C@@H](O)CNc1cccc(N2CCN(CC3CC3)CC2)c1	ZINC000819428247	FH	On-Demand	Anodyne	HTR1A	18	48
C#CCNC(=O)CCNc1ccc(Oc2ccc(C)cc2OC)c(F)c1	ZINC000819428254	FG	On-Demand	Mild	MET	53	36
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)C2CC2)c1	ZINC000819428324	CD	On-Demand	Anodyne	TIMP3	47	31
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)C2CC2)c1	ZINC000819428324	CD	On-Demand	Anodyne	KCNK3	94	38
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)C2CC2)c1	ZINC000819428324	CD	On-Demand	Anodyne	KCNK9	73	38
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)C2CC2)c1	ZINC000819428326	CD	On-Demand	Anodyne	TIMP3	47	31
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)C2CC2)c1	ZINC000819428326	CD	On-Demand	Anodyne	KCNK3	94	38
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)C2CC2)c1	ZINC000819428326	CD	On-Demand	Anodyne	KCNK9	73	38
Cc1ccc(NC[C@H](O)COc2ccccc2)c(OCC(=O)N(C)C)c1	ZINC000819428355	FE	On-Demand	Anodyne	ADRB2	36	44
Cc1ccc(NC[C@H](O)COc2ccccc2)c(OCC(=O)N(C)C)c1	ZINC000819428355	FE	On-Demand	Anodyne	ADRB1	39	42
Cc1ccc(NC[C@H](O)COc2ccccc2)c(OCC(=O)N(C)C)c1	ZINC000819428355	FE	On-Demand	Anodyne	ADRB3	24	42
Cc1ccc(NC[C@@H](O)COc2ccccc2)c(OCC(=O)N(C)C)c1	ZINC000819428356	FE	On-Demand	Anodyne	ADRB2	36	44
Cc1ccc(NC[C@@H](O)COc2ccccc2)c(OCC(=O)N(C)C)c1	ZINC000819428356	FE	On-Demand	Anodyne	ADRB1	39	42
Cc1ccc(NC[C@@H](O)COc2ccccc2)c(OCC(=O)N(C)C)c1	ZINC000819428356	FE	On-Demand	Anodyne	ADRB3	24	42
COCCOc1ccccc1NC[C@H](C)O	ZINC000819428369	BD	On-Demand	Clean	ADRB2	15	46
COCCOc1ccccc1NC[C@@H](C)O	ZINC000819428370	BD	On-Demand	Clean	ADRB2	15	46
Cc1ccc(NC[C@H](O)c2cccc(F)c2)cc1NS(C)(=O)=O	ZINC000819428382	EF	On-Demand	Anodyne	ADRB2	36	41
Cc1ccc(NC[C@H](O)c2cccc(F)c2)cc1NS(C)(=O)=O	ZINC000819428382	EF	On-Demand	Anodyne	ADRB1	17	41
Cc1ccc(NC[C@H](O)c2cccc(F)c2)cc1NS(C)(=O)=O	ZINC000819428382	EF	On-Demand	Anodyne	ADRB3	68	43
Cc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1NS(C)(=O)=O	ZINC000819428387	EF	On-Demand	Anodyne	ADRB2	36	41
Cc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1NS(C)(=O)=O	ZINC000819428387	EF	On-Demand	Anodyne	ADRB1	17	41
Cc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1NS(C)(=O)=O	ZINC000819428387	EF	On-Demand	Anodyne	ADRB3	68	43
COCCOc1ccccc1NCC1(O)CCC1	ZINC000819428388	CE	On-Demand	Anodyne	HCN1	52	33
COCCOc1ccccc1NCC1(O)CCC1	ZINC000819428388	CE	On-Demand	Anodyne	HCN4	49	31
O[C@@H](CNc1ccc(CCN2CCSCC2)cc1)c1ccc(F)cc1	ZINC000819428444	FH	On-Demand	Anodyne	SLC6A3	20	41
O[C@H](CNc1ccc(CCN2CCSCC2)cc1)c1ccc(F)cc1	ZINC000819428446	FH	On-Demand	Anodyne	SLC6A3	20	41
CON(C)C(=O)CCNc1ccc(CS(C)(=O)=O)cc1	ZINC000819428448	DD	On-Demand	Anodyne	PTPRB	45	35
O=C(/C=C\[C@@H]1CCCO1)N1CCC(Oc2ccccc2Cl)CC1	ZINC000819428461	EG	On-Demand	Anodyne	EPHX2	15	50
O=C(/C=C\[C@@H]1CCCO1)N1CCC(Oc2ccccc2Cl)CC1	ZINC000819428461	EG	On-Demand	Anodyne	SCD1	32	51
O=C(/C=C\[C@@H]1CCCO1)N1CCC(Oc2ccccc2Cl)CC1	ZINC000819428461	EG	On-Demand	Anodyne	SCD	20	46
O=C(/C=C/[C@H]1CCCO1)N1CCC(Oc2ccccc2Cl)CC1	ZINC000819428463	EG	On-Demand	Anodyne	EPHX2	15	50
O=C(/C=C/[C@H]1CCCO1)N1CCC(Oc2ccccc2Cl)CC1	ZINC000819428463	EG	On-Demand	Anodyne	SCD1	32	51
O=C(/C=C/[C@H]1CCCO1)N1CCC(Oc2ccccc2Cl)CC1	ZINC000819428463	EG	On-Demand	Anodyne	SCD	20	46
O=C(/C=C/[C@@H]1CCCO1)N1CCC(Oc2ccccc2Cl)CC1	ZINC000819428464	EG	On-Demand	Anodyne	EPHX2	15	50
O=C(/C=C/[C@@H]1CCCO1)N1CCC(Oc2ccccc2Cl)CC1	ZINC000819428464	EG	On-Demand	Anodyne	SCD1	32	51
O=C(/C=C/[C@@H]1CCCO1)N1CCC(Oc2ccccc2Cl)CC1	ZINC000819428464	EG	On-Demand	Anodyne	SCD	20	46
O=C(/C=C\[C@H]1CCCO1)N1CCC(Oc2ccccc2Cl)CC1	ZINC000819428466	EG	On-Demand	Anodyne	EPHX2	15	50
O=C(/C=C\[C@H]1CCCO1)N1CCC(Oc2ccccc2Cl)CC1	ZINC000819428466	EG	On-Demand	Anodyne	SCD1	32	51
O=C(/C=C\[C@H]1CCCO1)N1CCC(Oc2ccccc2Cl)CC1	ZINC000819428466	EG	On-Demand	Anodyne	SCD	20	46
O=C(N[C@@H](CO)Cc1ccccc1)C(F)=C1CCC1	ZINC000819428484	CE	On-Demand	Anodyne	MME	76	44
O=C(N[C@H](CO)Cc1ccccc1)C(F)=C1CCC1	ZINC000819428485	CE	On-Demand	Anodyne	MME	76	44
Cc1ccc(NC[C@H](O)c2ccc(F)cc2)cc1NS(C)(=O)=O	ZINC000819428507	EF	On-Demand	Anodyne	ADRB2	36	41
Cc1ccc(NC[C@H](O)c2ccc(F)cc2)cc1NS(C)(=O)=O	ZINC000819428507	EF	On-Demand	Anodyne	ADRB3	58	47
Cc1ccc(NC[C@H](O)c2ccc(F)cc2)cc1NS(C)(=O)=O	ZINC000819428507	EF	On-Demand	Anodyne	TRPV1	36	43
Cc1ccc(NC[C@@H](O)c2ccc(F)cc2)cc1NS(C)(=O)=O	ZINC000819428509	EF	On-Demand	Anodyne	ADRB2	36	41
Cc1ccc(NC[C@@H](O)c2ccc(F)cc2)cc1NS(C)(=O)=O	ZINC000819428509	EF	On-Demand	Anodyne	ADRB3	58	47
Cc1ccc(NC[C@@H](O)c2ccc(F)cc2)cc1NS(C)(=O)=O	ZINC000819428509	EF	On-Demand	Anodyne	TRPV1	36	43
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819428554	GH	On-Demand	Anodyne	MTTP	40	33
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819428554	GH	On-Demand	Anodyne	KCNK3	55	39
CO[C@@H](C)C(=O)Nc1cccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819428554	GH	On-Demand	Anodyne	KCNK9	49	35
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819428556	GH	On-Demand	Anodyne	MTTP	40	33
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819428556	GH	On-Demand	Anodyne	KCNK3	55	39
CO[C@@H](C)C(=O)Nc1cccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819428556	GH	On-Demand	Anodyne	KCNK9	49	35
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1ccc(F)cc1	ZINC000819428564	FE	On-Demand	Anodyne	LRRK2	32	43
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1ccc(F)cc1	ZINC000819428565	FE	On-Demand	Anodyne	LRRK2	32	43
CCOC[C@H](O)CNc1cc(C(=O)N2CCOCC2)ccc1OC	ZINC000819428567	EC	On-Demand	Anodyne	LRRK2	32	44
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)CN1CCOCC1	ZINC000819428568	GC	On-Demand	Anodyne	LRRK2	32	45
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)CN1CCOCC1	ZINC000819428569	GC	On-Demand	Anodyne	LRRK2	32	45
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)C1CCCCC1	ZINC000819428571	GE	On-Demand	Anodyne	L3MBTL3	54	37
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)C1CCCCC1	ZINC000819428572	GE	On-Demand	Anodyne	L3MBTL3	54	37
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)CN(C)CCC#N	ZINC000819428585	GC	On-Demand	Mild	LRRK2	24	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)CN(C)CCC#N	ZINC000819428586	GC	On-Demand	Mild	LRRK2	24	41
COc1ccc(C(=O)N2CCCC2)cc1NCC1(O)CCCCC1	ZINC000819428587	EG	On-Demand	Anodyne	L3MBTL3	46	37
COc1ccc(C(=O)N2CCCC2)cc1NCC1(O)CCCCC1	ZINC000819428587	EG	On-Demand	Anodyne	HPGD	35	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1ccc(Cl)cc1	ZINC000819428590	FH	On-Demand	Anodyne	ADRB3	15	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1ccc(Cl)cc1	ZINC000819428590	FH	On-Demand	Anodyne	HRH3	27	43
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1ccc(Cl)cc1	ZINC000819428590	FH	On-Demand	Anodyne	CPT1A	57	36
COC[C@@H](O)CNc1cc(C(=O)N2CCOCC2)ccc1OC	ZINC000819428594	DC	On-Demand	Anodyne	LRRK2	35	46
O[C@@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)C(F)(F)F	ZINC000819428599	EH	On-Demand	Anodyne	EGFR	20	47
O[C@@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)C(F)(F)F	ZINC000819428599	EH	On-Demand	Anodyne	ERBB2	43	48
O[C@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)C(F)(F)F	ZINC000819428600	EH	On-Demand	Anodyne	EGFR	20	47
O[C@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)C(F)(F)F	ZINC000819428600	EH	On-Demand	Anodyne	ERBB2	43	48
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819428601	FD	On-Demand	Anodyne	MLYCD	24	49
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819428601	FD	On-Demand	Anodyne	LRRK2	40	49
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819428602	FD	On-Demand	Anodyne	MLYCD	24	49
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819428602	FD	On-Demand	Anodyne	LRRK2	40	49
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1cccnc1	ZINC000819428607	FD	On-Demand	Anodyne	ADRB3	43	43
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1cccnc1	ZINC000819428607	FD	On-Demand	Anodyne	IGF1R	18	45
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1cccnc1	ZINC000819428607	FD	On-Demand	Anodyne	PTAFR	20	40
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1cccnc1	ZINC000819428607	FD	On-Demand	Anodyne	LRRK2	34	45
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1cccnc1	ZINC000819428608	FD	On-Demand	Anodyne	ADRB3	43	43
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1cccnc1	ZINC000819428608	FD	On-Demand	Anodyne	IGF1R	18	45
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1cccnc1	ZINC000819428608	FD	On-Demand	Anodyne	PTAFR	20	40
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1cccnc1	ZINC000819428608	FD	On-Demand	Anodyne	LRRK2	34	45
O=C(CCc1cccc(OC(F)F)c1)N[C@@H](CO)C[C@H](O)c1ccccc1	ZINC000819428613	GF	On-Demand	Anodyne	PLA2G4A	26	41
O=C(CCc1cccc(OC(F)F)c1)N[C@H](CO)C[C@@H](O)c1ccccc1	ZINC000819428614	GF	On-Demand	Anodyne	PLA2G4A	26	41
O=C(CCc1cccc(OC(F)F)c1)N[C@@H](CO)C[C@@H](O)c1ccccc1	ZINC000819428615	GF	On-Demand	Anodyne	PLA2G4A	26	41
O=C(CCc1cccc(OC(F)F)c1)N[C@H](CO)C[C@H](O)c1ccccc1	ZINC000819428616	GF	On-Demand	Anodyne	PLA2G4A	26	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(CS(C)(=O)=O)cc1	ZINC000819428638	FD	On-Demand	Anodyne	PTPRB	41	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(CS(C)(=O)=O)cc1	ZINC000819428639	FD	On-Demand	Anodyne	PTPRB	41	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)C1CCCCC1	ZINC000819428651	FF	On-Demand	Anodyne	CNR2	16	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)C1CCCCC1	ZINC000819428651	FF	On-Demand	Anodyne	LRRK2	34	45
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)C1CCCCC1	ZINC000819428651	FF	On-Demand	Anodyne	L3MBTL3	41	34
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)C1CCCCC1	ZINC000819428654	FF	On-Demand	Anodyne	CNR2	16	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)C1CCCCC1	ZINC000819428654	FF	On-Demand	Anodyne	LRRK2	34	45
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)C1CCCCC1	ZINC000819428654	FF	On-Demand	Anodyne	L3MBTL3	41	34
COC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1C(=O)/C=C\[C@H]1CCCO1	ZINC000819428667	GE	On-Demand	Anodyne	SLC18A2	47	34
COC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1C(=O)/C=C/[C@H]1CCCO1	ZINC000819428668	GE	On-Demand	Anodyne	SLC18A2	47	34
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)CSC	ZINC000819428669	ED	On-Demand	Anodyne	LRRK2	32	47
COC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819428670	GE	On-Demand	Anodyne	SLC18A2	47	34
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)CSC	ZINC000819428671	ED	On-Demand	Anodyne	LRRK2	32	47
COC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819428672	GE	On-Demand	Anodyne	SLC18A2	47	34
O[C@@H](CNc1ccc(CCN2CCSCC2)cc1)c1cccnc1	ZINC000819428673	EF	On-Demand	Anodyne	ADRB2	34	45
O[C@@H](CNc1ccc(CCN2CCSCC2)cc1)c1cccnc1	ZINC000819428673	EF	On-Demand	Anodyne	ADRB1	30	42
O[C@@H](CNc1ccc(CCN2CCSCC2)cc1)c1cccnc1	ZINC000819428673	EF	On-Demand	Anodyne	ADRB3	109	50
COc1ccc(C(=O)N2CCOCC2)cc1NCC1(O)CCCCC1	ZINC000819428674	EE	On-Demand	Anodyne	LRRK2	34	45
O[C@H](CNc1ccc(CCN2CCSCC2)cc1)c1cccnc1	ZINC000819428675	EF	On-Demand	Anodyne	ADRB2	34	45
O[C@H](CNc1ccc(CCN2CCSCC2)cc1)c1cccnc1	ZINC000819428675	EF	On-Demand	Anodyne	ADRB1	30	42
O[C@H](CNc1ccc(CCN2CCSCC2)cc1)c1cccnc1	ZINC000819428675	EF	On-Demand	Anodyne	ADRB3	109	50
COc1ccc(C(=O)N2CCN(C)CC2)cc1NCCS(C)(=O)=O	ZINC000819428684	FC	On-Demand	Anodyne	CPT1A	43	30
COc1ccc(C(=O)N2CCN(C)CC2)cc1NCCS(C)(=O)=O	ZINC000819428684	FC	On-Demand	Anodyne	SLC9A1	58	33
CCOc1ccccc1N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819428685	GH	On-Demand	Mild	PAPA1_CARPA	52	44
CCOc1ccccc1N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819428686	GH	On-Demand	Mild	PAPA1_CARPA	52	44
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819428718	FF	On-Demand	Anodyne	ADRB2	53	45
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819428718	FF	On-Demand	Anodyne	ADRB1	64	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819428718	FF	On-Demand	Anodyne	ADRB3	45	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819428718	FF	On-Demand	Anodyne	HRH3	26	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819428718	FF	On-Demand	Anodyne	ABCB1	53	39
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819428718	FF	On-Demand	Anodyne	L3MBTL3	25	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819428718	FF	On-Demand	Anodyne	HPGD	36	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819428720	FF	On-Demand	Anodyne	ADRB2	53	45
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819428720	FF	On-Demand	Anodyne	ADRB1	64	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819428720	FF	On-Demand	Anodyne	ADRB3	45	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819428720	FF	On-Demand	Anodyne	HRH3	26	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819428720	FF	On-Demand	Anodyne	ABCB1	53	39
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819428720	FF	On-Demand	Anodyne	L3MBTL3	25	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819428720	FF	On-Demand	Anodyne	HPGD	36	42
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819428742	GC	On-Demand	Anodyne	SLC9A1	56	30
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819428742	GC	On-Demand	Anodyne	LRRK2	32	42
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819428746	GC	On-Demand	Anodyne	SLC9A1	56	30
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819428746	GC	On-Demand	Anodyne	LRRK2	32	42
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H]1CCCO1	ZINC000819428757	FF	On-Demand	Mild	PAPA1_CARPA	34	46
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H]1CCCO1	ZINC000819428758	FF	On-Demand	Mild	PAPA1_CARPA	34	46
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H]1CCCO1	ZINC000819428759	FF	On-Demand	Mild	PAPA1_CARPA	34	46
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)CCOC(C)C	ZINC000819428764	FD	On-Demand	Anodyne	LRRK2	32	42
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)CCOC(C)C	ZINC000819428765	FD	On-Demand	Anodyne	LRRK2	32	42
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000819428773	FD	On-Demand	Mild	PAPA1_CARPA	46	55
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000819428773	FD	On-Demand	Mild	CTSK	15	52
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000819428774	FD	On-Demand	Mild	PAPA1_CARPA	46	55
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000819428774	FD	On-Demand	Mild	CTSK	15	52
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H]1CCCO1	ZINC000819428780	FF	On-Demand	Mild	PAPA1_CARPA	34	46
COc1ccc(C(=O)N2CCCC2)cc1NCC1(O)CCC1	ZINC000819428789	DE	On-Demand	Anodyne	L3MBTL3	52	38
COc1ccc(C(=O)N2CCCC2)cc1NCC1(O)CCC1	ZINC000819428789	DE	On-Demand	Anodyne	HPGD	33	40
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)C(F)(F)F	ZINC000819428797	ED	On-Demand	Anodyne	MLYCD	19	44
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)C(F)(F)F	ZINC000819428797	ED	On-Demand	Anodyne	LRRK2	37	47
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)C(F)(F)F	ZINC000819428799	ED	On-Demand	Anodyne	MLYCD	19	44
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)C(F)(F)F	ZINC000819428799	ED	On-Demand	Anodyne	LRRK2	37	47
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1ccc(Cl)cc1	ZINC000819428838	GF	On-Demand	Anodyne	CPT1A	55	36
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1ccc(Cl)cc1	ZINC000819428838	GF	On-Demand	Anodyne	CYP3A4	40	32
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1ccc(Cl)cc1	ZINC000819428838	GF	On-Demand	Anodyne	LRRK2	34	47
O=[N+]([O-])c1ccc([C@@H](O)CNc2ccc(CCN3CCSCC3)cc2)cc1	ZINC000819428848	GG	On-Demand	Bother	KCNJ1	37	53
O=[N+]([O-])c1ccc([C@H](O)CNc2ccc(CCN3CCSCC3)cc2)cc1	ZINC000819428849	GG	On-Demand	Bother	KCNJ1	37	53
COc1ccc(C(=O)N2CCCC2)cc1NCCS(C)(=O)=O	ZINC000819428923	ED	On-Demand	Anodyne	SLC9A1	46	33
COc1ccc(C(=O)N2CCCC2)cc1NCCS(C)(=O)=O	ZINC000819428923	ED	On-Demand	Anodyne	L3MBTL3	54	36
COc1ccc(C(=O)N2CCCC2)cc1NCCS(C)(=O)=O	ZINC000819428923	ED	On-Demand	Anodyne	HPGD	31	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccc(C)cc1C	ZINC000819428924	GG	On-Demand	Anodyne	ADRB2	20	43
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccc(C)cc1C	ZINC000819428925	GG	On-Demand	Anodyne	ADRB2	20	43
CCCCCCCCNC(=O)C[C@H](C)n1cccn1	ZINC000819428934	CG	On-Demand	Mild	ASAH1	91	36
CCCCCCCCNC(=O)C[C@@H](C)n1cccn1	ZINC000819428935	CG	On-Demand	Mild	ASAH1	91	36
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)Cc1ccc(F)cc1	ZINC000819428936	GE	On-Demand	Anodyne	LRRK2	31	42
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)Cc1ccc(F)cc1	ZINC000819428937	GE	On-Demand	Anodyne	LRRK2	31	42
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)C1CC1	ZINC000819428938	DD	On-Demand	Anodyne	LRRK2	35	47
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)C1CC1	ZINC000819428939	DD	On-Demand	Anodyne	LRRK2	35	47
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1ccc(F)c(F)c1	ZINC000819428948	GF	On-Demand	Anodyne	LRRK2	32	42
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1ccc(F)c(F)c1	ZINC000819428949	GF	On-Demand	Anodyne	LRRK2	32	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1ccccc1	ZINC000819428953	EG	On-Demand	Anodyne	ADRB1	15	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1ccccc1	ZINC000819428953	EG	On-Demand	Anodyne	ADRB3	31	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1ccccc1	ZINC000819428953	EG	On-Demand	Anodyne	HRH3	26	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1ccccc1	ZINC000819428953	EG	On-Demand	Anodyne	CPT1A	45	32
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1ccccc1	ZINC000819428953	EG	On-Demand	Anodyne	L3MBTL3	45	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1ccccc1	ZINC000819428953	EG	On-Demand	Anodyne	HPGD	34	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1ccccc1	ZINC000819428954	EG	On-Demand	Anodyne	ADRB1	15	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1ccccc1	ZINC000819428954	EG	On-Demand	Anodyne	ADRB3	31	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1ccccc1	ZINC000819428954	EG	On-Demand	Anodyne	HRH3	26	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1ccccc1	ZINC000819428954	EG	On-Demand	Anodyne	CPT1A	45	32
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1ccccc1	ZINC000819428954	EG	On-Demand	Anodyne	L3MBTL3	45	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1ccccc1	ZINC000819428954	EG	On-Demand	Anodyne	HPGD	34	42
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)CN(C)C1CC1	ZINC000819428961	FD	On-Demand	Anodyne	LRRK2	35	44
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)CN(C)C1CC1	ZINC000819428963	FD	On-Demand	Anodyne	LRRK2	35	44
CN(C)CCn1c(=O)oc2ccc(NC[C@H](O)c3ccccc3)cc21	ZINC000819428964	EE	On-Demand	Anodyne	TSPO	18	41
CN(C)CCn1c(=O)oc2ccc(NC[C@@H](O)c3ccccc3)cc21	ZINC000819428966	EE	On-Demand	Anodyne	TSPO	18	41
COc1ccc(C(=O)N2CCOCC2)cc1NCC1(O)CCCC1	ZINC000819428973	ED	On-Demand	Anodyne	LRRK2	34	46
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1cc(C)cc(C)c1	ZINC000819428975	GF	On-Demand	Anodyne	LRRK2	34	44
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1cc(C)cc(C)c1	ZINC000819428979	GF	On-Demand	Anodyne	LRRK2	34	44
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1cccc(F)c1	ZINC000819428989	FG	On-Demand	Anodyne	HRH3	26	43
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1cccc(F)c1	ZINC000819428989	FG	On-Demand	Anodyne	ACKR3	51	34
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1cccc(F)c1	ZINC000819428991	FG	On-Demand	Anodyne	HRH3	26	43
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1cccc(F)c1	ZINC000819428991	FG	On-Demand	Anodyne	ACKR3	51	34
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1ccc(C)cc1	ZINC000819429000	FF	On-Demand	Anodyne	LRRK2	32	44
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1ccc(C)cc1	ZINC000819429001	FF	On-Demand	Anodyne	LRRK2	32	44
Cc1ccc(NC[C@H](O)C2CC2)cc1NC(=O)c1ccncc1	ZINC000819429009	DF	On-Demand	Anodyne	MAPK11	24	40
Cc1ccc(NC[C@H](O)C2CC2)cc1NC(=O)c1ccncc1	ZINC000819429009	DF	On-Demand	Anodyne	MAPK14	39	44
Cc1ccc(NC[C@H](O)C2CC2)cc1NC(=O)c1ccncc1	ZINC000819429009	DF	On-Demand	Anodyne	FLT1	22	41
Cc1ccc(NC[C@H](O)C2CC2)cc1NC(=O)c1ccncc1	ZINC000819429009	DF	On-Demand	Anodyne	KCNK3	28	41
Cc1ccc(NC[C@@H](O)C2CC2)cc1NC(=O)c1ccncc1	ZINC000819429011	DF	On-Demand	Anodyne	MAPK11	24	40
Cc1ccc(NC[C@@H](O)C2CC2)cc1NC(=O)c1ccncc1	ZINC000819429011	DF	On-Demand	Anodyne	MAPK14	39	44
Cc1ccc(NC[C@@H](O)C2CC2)cc1NC(=O)c1ccncc1	ZINC000819429011	DF	On-Demand	Anodyne	FLT1	22	41
Cc1ccc(NC[C@@H](O)C2CC2)cc1NC(=O)c1ccncc1	ZINC000819429011	DF	On-Demand	Anodyne	KCNK3	28	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)CN1CCOCC1	ZINC000819429013	GC	On-Demand	Anodyne	SLC9A1	48	29
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)CN1CCOCC1	ZINC000819429013	GC	On-Demand	Anodyne	LRRK2	31	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)CN1CCOCC1	ZINC000819429015	GC	On-Demand	Anodyne	SLC9A1	48	29
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)CN1CCOCC1	ZINC000819429015	GC	On-Demand	Anodyne	LRRK2	31	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1ccccc1Cl	ZINC000819429017	FH	On-Demand	Anodyne	HRH3	27	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1ccccc1Cl	ZINC000819429017	FH	On-Demand	Anodyne	CPT1A	45	32
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1ccccc1Cl	ZINC000819429017	FH	On-Demand	Anodyne	RBP4	15	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1ccccc1Cl	ZINC000819429017	FH	On-Demand	Anodyne	HPGD	29	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1ccc(C#N)cc1	ZINC000819429035	GE	On-Demand	Mild	HRH3	24	42
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1ccc(C#N)cc1	ZINC000819429035	GE	On-Demand	Mild	LRRK2	30	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819429037	GE	On-Demand	Mild	HRH3	24	42
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819429037	GE	On-Demand	Mild	LRRK2	30	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)Cc1ccccc1	ZINC000819429039	FE	On-Demand	Anodyne	LRRK2	33	43
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)Cc1ccccc1	ZINC000819429041	FE	On-Demand	Anodyne	LRRK2	33	43
O[C@@H](CNc1ccc2nc(C3CC3)sc2c1)c1cccnc1	ZINC000819429044	DH	On-Demand	Anodyne	ADRB2	24	40
O[C@@H](CNc1ccc2nc(C3CC3)sc2c1)c1cccnc1	ZINC000819429044	DH	On-Demand	Anodyne	ADRB1	23	42
O[C@@H](CNc1ccc2nc(C3CC3)sc2c1)c1cccnc1	ZINC000819429044	DH	On-Demand	Anodyne	ADRB3	91	42
O[C@H](CNc1ccc2nc(C3CC3)sc2c1)c1cccnc1	ZINC000819429046	DH	On-Demand	Anodyne	ADRB2	24	40
O[C@H](CNc1ccc2nc(C3CC3)sc2c1)c1cccnc1	ZINC000819429046	DH	On-Demand	Anodyne	ADRB1	23	42
O[C@H](CNc1ccc2nc(C3CC3)sc2c1)c1cccnc1	ZINC000819429046	DH	On-Demand	Anodyne	ADRB3	91	42
COC[C@@H](C)OC[C@H](O)CNc1cc(C(=O)N2CCOCC2)ccc1OC	ZINC000819429052	GC	On-Demand	Anodyne	LRRK2	30	42
COC[C@@H](C)OC[C@@H](O)CNc1cc(C(=O)N2CCOCC2)ccc1OC	ZINC000819429060	GC	On-Demand	Anodyne	LRRK2	30	42
O[C@@H](CNc1ccc(CCN2CCSCC2)cc1)c1cccc(F)c1	ZINC000819429065	FH	On-Demand	Anodyne	ADRB3	25	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1cccnc1	ZINC000819429066	EE	On-Demand	Anodyne	ADRB1	17	45
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1cccnc1	ZINC000819429066	EE	On-Demand	Anodyne	ADRB3	61	45
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1cccnc1	ZINC000819429066	EE	On-Demand	Anodyne	PTAFR	26	42
O[C@H](CNc1ccc(CCN2CCSCC2)cc1)c1cccc(F)c1	ZINC000819429067	FH	On-Demand	Anodyne	ADRB3	25	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1cccnc1	ZINC000819429068	EE	On-Demand	Anodyne	ADRB1	17	45
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1cccnc1	ZINC000819429068	EE	On-Demand	Anodyne	ADRB3	61	45
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1cccnc1	ZINC000819429068	EE	On-Demand	Anodyne	PTAFR	26	42
CN(C)CCn1c(=O)oc2ccc(NC[C@H](O)c3ccccc3Cl)cc21	ZINC000819429070	GF	On-Demand	Anodyne	TSPO	15	40
CN(C[C@@H]1CCC[C@@H]1O)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819429072	FE	On-Demand	Mild	PAPA1_CARPA	34	40
CN(C[C@@H]1CCC[C@H]1O)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819429074	FE	On-Demand	Mild	PAPA1_CARPA	34	40
CN(C[C@@H]1CCC[C@H]1O)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819429076	FE	On-Demand	Mild	PAPA1_CARPA	34	40
CN(C[C@@H]1CCC[C@@H]1O)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819429078	FE	On-Demand	Mild	PAPA1_CARPA	34	40
CCc1nnc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819429093	FD	On-Demand	Mild	PAPA1_CARPA	45	53
CCc1nnc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819429093	FD	On-Demand	Mild	CTSK	15	47
CCc1nnc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819429096	FD	On-Demand	Mild	PAPA1_CARPA	45	53
CCc1nnc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819429096	FD	On-Demand	Mild	CTSK	15	47
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)Cc1ccccc1	ZINC000819429117	GE	On-Demand	Anodyne	CPT1A	42	29
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)Cc1ccccc1	ZINC000819429117	GE	On-Demand	Anodyne	HCRTR2	15	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)Cc1ccccc1	ZINC000819429118	GE	On-Demand	Anodyne	CPT1A	42	29
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)Cc1ccccc1	ZINC000819429118	GE	On-Demand	Anodyne	HCRTR2	15	41
COC[C@@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819429122	DF	On-Demand	Anodyne	EGFR	23	46
COC[C@@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819429122	DF	On-Demand	Anodyne	ERBB2	40	45
COC[C@@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819429122	DF	On-Demand	Anodyne	GRM4	19	45
CC[C@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819429134	DG	On-Demand	Anodyne	EGFR	27	47
CC[C@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819429134	DG	On-Demand	Anodyne	ERBB2	44	51
CC[C@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819429134	DG	On-Demand	Anodyne	GRM4	24	44
CCCCCCCCNC(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819429138	DG	On-Demand	Mild	GRIA1	45	35
CCCCCCCCNC(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819429138	DG	On-Demand	Mild	S1PR2	72	40
CCCCCCCCNC(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819429138	DG	On-Demand	Mild	ASAH1	100	38
Cc1cc(F)ccc1OC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819429140	FH	On-Demand	Mild	PAPA1_CARPA	43	48
Cc1cc(F)ccc1OC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819429140	FH	On-Demand	Mild	CTSK	16	40
Cc1cc(F)ccc1OC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819429142	FH	On-Demand	Mild	PAPA1_CARPA	43	48
Cc1cc(F)ccc1OC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819429142	FH	On-Demand	Mild	CTSK	16	40
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1cc2ccccc2o1	ZINC000819429153	GG	On-Demand	Anodyne	LRRK2	33	43
O[C@@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)CC(F)(F)F	ZINC000819429154	FI	On-Demand	Anodyne	EGFR	16	44
O[C@@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)CC(F)(F)F	ZINC000819429154	FI	On-Demand	Anodyne	ERBB2	38	43
O[C@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)CC(F)(F)F	ZINC000819429156	FI	On-Demand	Anodyne	EGFR	16	44
O[C@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)CC(F)(F)F	ZINC000819429156	FI	On-Demand	Anodyne	ERBB2	38	43
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)CCC(C)C	ZINC000819429176	FE	On-Demand	Anodyne	LRRK2	35	44
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)CCC(C)C	ZINC000819429177	FE	On-Demand	Anodyne	LRRK2	35	44
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)CC(F)(F)F	ZINC000819429181	FD	On-Demand	Anodyne	LRRK2	36	46
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)CC(F)(F)F	ZINC000819429182	FD	On-Demand	Anodyne	LRRK2	36	46
COc1ccc(C(=O)N2CCCC2)cc1NCC1(O)CCOCC1	ZINC000819429196	ED	On-Demand	Anodyne	LRRK2	29	41
CC(C)(C)[C@@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819429205	EI	On-Demand	Anodyne	EGFR	18	51
CC(C)(C)[C@@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819429205	EI	On-Demand	Anodyne	ERBB2	39	47
CC(C)(C)[C@@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819429205	EI	On-Demand	Anodyne	GRM4	20	44
COc1ccc(C(=O)N2CCOCC2)cc1NCC1(O)CCOCC1	ZINC000819429209	FD	On-Demand	Anodyne	LRRK2	35	46
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1ccc(CS(C)(=O)=O)cc1	ZINC000819429217	GD	On-Demand	Anodyne	PTPRB	55	36
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819429222	GE	On-Demand	Mild	PAPA1_CARPA	34	45
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819429224	GE	On-Demand	Mild	PAPA1_CARPA	34	45
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819429226	GE	On-Demand	Mild	PAPA1_CARPA	34	45
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819429228	GE	On-Demand	Mild	PAPA1_CARPA	34	45
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1ccccc1Cl	ZINC000819429229	GF	On-Demand	Anodyne	LRRK2	35	48
COc1ccc(C(=O)N2CCOCC2)cc1NCC(C)(C)O	ZINC000819429235	DD	On-Demand	Anodyne	CNR2	15	43
COc1ccc(C(=O)N2CCOCC2)cc1NCC(C)(C)O	ZINC000819429235	DD	On-Demand	Anodyne	MLYCD	17	43
COc1ccc(C(=O)N2CCOCC2)cc1NCC(C)(C)O	ZINC000819429235	DD	On-Demand	Anodyne	LRRK2	39	49
O[C@@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)C1CC1	ZINC000819429237	DG	On-Demand	Anodyne	EGFR	15	47
O[C@@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)C1CC1	ZINC000819429237	DG	On-Demand	Anodyne	ERBB2	42	43
O[C@@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)C1CC1	ZINC000819429237	DG	On-Demand	Anodyne	GRM4	32	42
O[C@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)C1CC1	ZINC000819429238	DG	On-Demand	Anodyne	EGFR	15	47
O[C@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)C1CC1	ZINC000819429238	DG	On-Demand	Anodyne	ERBB2	42	43
O[C@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)C1CC1	ZINC000819429238	DG	On-Demand	Anodyne	GRM4	32	42
COc1ccc(C(=O)N2CCOCC2)cc1NCCC(=O)N(C)OC	ZINC000819429240	FC	On-Demand	Anodyne	LRRK2	33	46
O=C1CCCN1C[C@@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819429241	GF	On-Demand	Anodyne	ERBB2	37	40
O=C1CCCN1C[C@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819429243	GF	On-Demand	Anodyne	ERBB2	37	40
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000819429245	GF	On-Demand	Anodyne	HRH4	15	42
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)[C@@H](C)c1ccccc1	ZINC000819429248	GF	On-Demand	Anodyne	HRH4	15	42
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)[C@H](C)c1ccccc1	ZINC000819429250	GF	On-Demand	Anodyne	HRH4	15	42
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)[C@@H](C)c1ccccc1	ZINC000819429252	GF	On-Demand	Anodyne	HRH4	15	42
Cc1ccnn1-c1ccc(C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2Cl)cc1	ZINC000819429261	IK	On-Demand	Anodyne	PRNP	44	33
CN1CC[C@H](NC(=O)C(F)=C2CCC2)[C@H]1c1ccc(Cl)c(F)c1	ZINC000819429263	EH	On-Demand	Anodyne	ENV	42	37
CN1CC[C@H](NC(=O)C(F)=C2CCC2)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000819429264	EH	On-Demand	Anodyne	ENV	42	37
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1ccccc1F	ZINC000819429280	FE	On-Demand	Anodyne	LRRK2	35	42
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1ccccc1F	ZINC000819429282	FE	On-Demand	Anodyne	LRRK2	35	42
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)c1ccc(C#N)cc1	ZINC000819429294	GE	On-Demand	Mild	HRH3	25	42
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819429296	GE	On-Demand	Mild	HRH3	25	42
CCCCCCCCNC(=O)/C=C\[C@@H]1CCCO1	ZINC000819429299	CG	On-Demand	Mild	LASR	45	34
CCCCCCCCNC(=O)/C=C\[C@H]1CCCO1	ZINC000819429300	CG	On-Demand	Mild	LASR	45	34
CCCCCCCCNC(=O)/C=C/[C@H]1CCCO1	ZINC000819429301	CG	On-Demand	Mild	LASR	45	34
CCCCCCCCNC(=O)/C=C/[C@@H]1CCCO1	ZINC000819429302	CG	On-Demand	Mild	LASR	45	34
C[C@@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)S(C)(=O)=O	ZINC000819429314	FG	On-Demand	Anodyne	EGFR	33	51
C[C@@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)S(C)(=O)=O	ZINC000819429314	FG	On-Demand	Anodyne	ERBB2	57	54
C[C@@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)S(C)(=O)=O	ZINC000819429314	FG	On-Demand	Anodyne	GRM4	24	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)c1ccccc1F	ZINC000819429316	FG	On-Demand	Anodyne	HPGD	32	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)c1ccccc1F	ZINC000819429318	FG	On-Demand	Anodyne	HPGD	32	40
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc(CS(C)(=O)=O)cc1	ZINC000819429351	FD	On-Demand	Anodyne	PTPRB	38	42
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc(CS(C)(=O)=O)cc1	ZINC000819429352	FD	On-Demand	Anodyne	PTPRB	38	42
CC[C@H](O)CNc1cc(C(=O)N2CCCC2)ccc1OC	ZINC000819429369	CE	On-Demand	Anodyne	L3MBTL3	54	36
CC[C@H](O)CNc1cc(C(=O)N2CCCC2)ccc1OC	ZINC000819429369	CE	On-Demand	Anodyne	HPGD	34	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819429370	EF	On-Demand	Anodyne	SLC9A1	43	30
COc1ccc(C(=O)N2CCCC2)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819429370	EF	On-Demand	Anodyne	MLYCD	20	45
COc1ccc(C(=O)N2CCCC2)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819429370	EF	On-Demand	Anodyne	LRRK2	28	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819429370	EF	On-Demand	Anodyne	L3MBTL3	49	36
COc1ccc(C(=O)N2CCCC2)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819429370	EF	On-Demand	Anodyne	HPGD	37	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819429371	EF	On-Demand	Anodyne	SLC9A1	43	30
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819429371	EF	On-Demand	Anodyne	MLYCD	20	45
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819429371	EF	On-Demand	Anodyne	LRRK2	28	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819429371	EF	On-Demand	Anodyne	L3MBTL3	49	36
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819429371	EF	On-Demand	Anodyne	HPGD	37	40
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)c1cccnc1	ZINC000819429374	FD	On-Demand	Anodyne	ADRB1	15	44
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)c1cccnc1	ZINC000819429374	FD	On-Demand	Anodyne	ADRB3	50	44
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)c1cccnc1	ZINC000819429374	FD	On-Demand	Anodyne	PTAFR	25	42
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)c1cccnc1	ZINC000819429375	FD	On-Demand	Anodyne	ADRB1	15	44
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)c1cccnc1	ZINC000819429375	FD	On-Demand	Anodyne	ADRB3	50	44
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)c1cccnc1	ZINC000819429375	FD	On-Demand	Anodyne	PTAFR	25	42
COc1ccc(C(=O)N2CCN(C)CC2)cc1NCCC(=O)N(C)OC	ZINC000819429378	FC	On-Demand	Anodyne	HRH4	17	41
CCOC(=O)Nc1ccc(C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2Cl)cc1	ZINC000819429379	JK	On-Demand	Anodyne	PRNP	56	35
CCOC(=O)Nc1ccc(C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2Cl)cc1	ZINC000819429379	JK	On-Demand	Anodyne	FLT3	21	42
CCOC(=O)Nc1ccc(C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2Cl)cc1	ZINC000819429379	JK	On-Demand	Anodyne	NOD2	40	38
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)C(F)(F)F	ZINC000819429381	FD	On-Demand	Anodyne	HRH4	15	40
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)C(F)(F)F	ZINC000819429382	FD	On-Demand	Anodyne	HRH4	15	40
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1ccccc1C	ZINC000819429395	FF	On-Demand	Anodyne	LRRK2	32	42
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1ccccc1C	ZINC000819429396	FF	On-Demand	Anodyne	LRRK2	32	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819429397	GF	On-Demand	Anodyne	ADRB2	36	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819429397	GF	On-Demand	Anodyne	ADRB1	43	39
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819429397	GF	On-Demand	Anodyne	HRH3	25	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819429398	GF	On-Demand	Anodyne	ADRB2	36	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819429398	GF	On-Demand	Anodyne	ADRB1	43	39
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819429398	GF	On-Demand	Anodyne	HRH3	25	42
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)C(C)(C)C	ZINC000819429405	ED	On-Demand	Anodyne	LRRK2	37	46
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)C(C)(C)C	ZINC000819429406	ED	On-Demand	Anodyne	LRRK2	37	46
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)c1ccccc1F	ZINC000819429407	GE	On-Demand	Anodyne	HRH4	16	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)c1ccccc1F	ZINC000819429408	GE	On-Demand	Anodyne	HRH4	16	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NCC(C)(C)O	ZINC000819429417	DD	On-Demand	Anodyne	HTR1B	15	42
COc1ccc(C(=O)N2CCN(C)CC2)cc1NCC(C)(C)O	ZINC000819429417	DD	On-Demand	Anodyne	HRH4	25	44
COc1ccc(C(=O)N2CCN(C)CC2)cc1NCC(C)(C)O	ZINC000819429417	DD	On-Demand	Anodyne	SLC9A1	50	31
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1ccc(F)cn1	ZINC000819429418	GD	On-Demand	Anodyne	LRRK2	39	46
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1ccc(F)cn1	ZINC000819429419	GD	On-Demand	Anodyne	LRRK2	39	46
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)C1CCCCC1	ZINC000819429422	EG	On-Demand	Anodyne	HRH3	27	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)C1CCCCC1	ZINC000819429422	EG	On-Demand	Anodyne	L3MBTL3	75	38
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)C1CCCCC1	ZINC000819429422	EG	On-Demand	Anodyne	HPGD	42	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)C1CCCCC1	ZINC000819429423	EG	On-Demand	Anodyne	HRH3	27	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)C1CCCCC1	ZINC000819429423	EG	On-Demand	Anodyne	L3MBTL3	75	38
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)C1CCCCC1	ZINC000819429423	EG	On-Demand	Anodyne	HPGD	42	42
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)CC1CCCC1	ZINC000819429426	FF	On-Demand	Anodyne	CTSS	29	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)CC1CCCC1	ZINC000819429426	FF	On-Demand	Anodyne	LRRK2	35	44
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)CC1CCCC1	ZINC000819429427	FF	On-Demand	Anodyne	CTSS	29	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)CC1CCCC1	ZINC000819429427	FF	On-Demand	Anodyne	LRRK2	35	44
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)CC1CCCC1	ZINC000819429430	GE	On-Demand	Anodyne	L3MBTL3	47	37
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)CC1CCCC1	ZINC000819429430	GE	On-Demand	Anodyne	ACKR3	41	30
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)CC1CCCC1	ZINC000819429431	GE	On-Demand	Anodyne	L3MBTL3	47	37
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)CC1CCCC1	ZINC000819429431	GE	On-Demand	Anodyne	ACKR3	41	30
COc1cccc([C@H](O)CN(Cc2ccccc2)C(=O)C[C@H](C)n2cccn2)c1	ZINC000819429440	GH	On-Demand	Anodyne	PTGES	22	44
COc1cccc([C@H](O)CN(Cc2ccccc2)C(=O)C[C@@H](C)n2cccn2)c1	ZINC000819429441	GH	On-Demand	Anodyne	PTGES	22	44
O[C@@H](CNc1ccc(CCN2CCSCC2)cc1)c1ccccc1	ZINC000819429509	EG	On-Demand	Anodyne	ADRB2	20	61
O[C@@H](CNc1ccc(CCN2CCSCC2)cc1)c1ccccc1	ZINC000819429509	EG	On-Demand	Anodyne	ADRB1	20	47
O[C@@H](CNc1ccc(CCN2CCSCC2)cc1)c1ccccc1	ZINC000819429509	EG	On-Demand	Anodyne	ADRB3	54	45
O[C@@H](CNc1ccc(CCN2CCSCC2)cc1)c1ccccc1	ZINC000819429509	EG	On-Demand	Anodyne	SIGMAR1	20	42
O[C@H](CNc1ccc(CCN2CCSCC2)cc1)c1ccccc1	ZINC000819429510	EG	On-Demand	Anodyne	ADRB2	20	61
O[C@H](CNc1ccc(CCN2CCSCC2)cc1)c1ccccc1	ZINC000819429510	EG	On-Demand	Anodyne	ADRB1	20	47
O[C@H](CNc1ccc(CCN2CCSCC2)cc1)c1ccccc1	ZINC000819429510	EG	On-Demand	Anodyne	ADRB3	54	45
O[C@H](CNc1ccc(CCN2CCSCC2)cc1)c1ccccc1	ZINC000819429510	EG	On-Demand	Anodyne	SIGMAR1	20	42
CC(=O)c1cc(C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2Cl)n(C)c1	ZINC000819429513	HI	On-Demand	Anodyne	CNR1	51	33
CC[C@H](O)CNc1cc(COc2cccc(F)c2)ccc1OC	ZINC000819429532	DH	On-Demand	Anodyne	MAOB	19	43
N#Cc1ccc([C@@H](O)CNc2ccc(CCN3CCSCC3)cc2)cc1	ZINC000819429551	FG	On-Demand	Mild	KCNJ1	21	51
N#Cc1ccc([C@H](O)CNc2ccc(CCN3CCSCC3)cc2)cc1	ZINC000819429552	FG	On-Demand	Mild	KCNJ1	21	51
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819429577	GG	On-Demand	Anodyne	ADRB2	32	49
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819429577	GG	On-Demand	Anodyne	ADRB1	40	33
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819429577	GG	On-Demand	Anodyne	CYP2D6	19	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819429577	GG	On-Demand	Anodyne	ABCB1	64	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819429577	GG	On-Demand	Anodyne	HPGD	31	43
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccccc1C	ZINC000819429578	GG	On-Demand	Anodyne	ADRB2	32	49
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccccc1C	ZINC000819429578	GG	On-Demand	Anodyne	ADRB1	40	33
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccccc1C	ZINC000819429578	GG	On-Demand	Anodyne	CYP2D6	19	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccccc1C	ZINC000819429578	GG	On-Demand	Anodyne	ABCB1	64	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccccc1C	ZINC000819429578	GG	On-Demand	Anodyne	HPGD	31	43
CN(CCC#N)C[C@@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819429579	FF	On-Demand	Mild	ERBB2	36	43
CN(CCC#N)C[C@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819429580	FF	On-Demand	Mild	ERBB2	36	43
CCOC[C@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819429586	EG	On-Demand	Anodyne	EGFR	17	48
CCOC[C@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819429586	EG	On-Demand	Anodyne	ERBB2	38	44
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819429591	GE	On-Demand	Anodyne	ADRB2	39	45
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819429591	GE	On-Demand	Anodyne	ADRB1	45	43
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819429591	GE	On-Demand	Anodyne	ADRB3	33	45
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819429591	GE	On-Demand	Anodyne	LRRK2	33	44
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819429592	GE	On-Demand	Anodyne	ADRB2	39	45
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819429592	GE	On-Demand	Anodyne	ADRB1	45	43
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819429592	GE	On-Demand	Anodyne	ADRB3	33	45
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819429592	GE	On-Demand	Anodyne	LRRK2	33	44
COC[C@@H](C)OC[C@H](O)CNc1cc(C(=O)N2CCN(C)CC2)ccc1OC	ZINC000819429594	GC	On-Demand	Anodyne	SLC9A1	48	29
COC[C@@H](C)OC[C@@H](O)CNc1cc(C(=O)N2CCN(C)CC2)ccc1OC	ZINC000819429596	GC	On-Demand	Anodyne	SLC9A1	48	29
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)CN(C)Cc1ccccc1	ZINC000819429600	GF	On-Demand	Anodyne	L3MBTL3	21	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)CN(C)Cc1ccccc1	ZINC000819429601	GF	On-Demand	Anodyne	L3MBTL3	21	40
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)C1CC1	ZINC000819429611	ED	On-Demand	Anodyne	HRH4	18	42
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)C1CC1	ZINC000819429611	ED	On-Demand	Anodyne	L3MBTL3	42	37
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)C1CC1	ZINC000819429612	ED	On-Demand	Anodyne	HRH4	18	42
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)C1CC1	ZINC000819429612	ED	On-Demand	Anodyne	L3MBTL3	42	37
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1ccccc1OCc1cscn1	ZINC000819429617	JK	On-Demand	Anodyne	GRM4	15	41
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1ccccc1OCc1cscn1	ZINC000819429617	JK	On-Demand	Anodyne	HCN1	40	30
O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1ccccc1OCc1cscn1	ZINC000819429617	JK	On-Demand	Anodyne	HCN4	40	30
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)c1ccccc1	ZINC000819429618	FE	On-Demand	Anodyne	CPT1A	46	33
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)c1ccccc1	ZINC000819429619	FE	On-Demand	Anodyne	CPT1A	46	33
CON(C)C(=O)CCNc1ccc(C)c(NC(=O)c2ccncc2)c1	ZINC000819429626	EE	On-Demand	Anodyne	MAPK14	27	45
CON(C)C(=O)CCNc1ccc(C)c(NC(=O)c2ccncc2)c1	ZINC000819429626	EE	On-Demand	Anodyne	SMO	25	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](C)O	ZINC000819429627	DC	On-Demand	Anodyne	HRH4	21	42
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](C)O	ZINC000819429627	DC	On-Demand	Anodyne	SLC9A1	58	32
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](C)O	ZINC000819429628	DC	On-Demand	Anodyne	HRH4	21	42
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](C)O	ZINC000819429628	DC	On-Demand	Anodyne	SLC9A1	58	32
C[C@@](O)(CNc1ccc(OCc2ccccn2)c(Cl)c1)C(F)(F)F	ZINC000819429630	FI	On-Demand	Anodyne	EGFR	27	45
C[C@@](O)(CNc1ccc(OCc2ccccn2)c(Cl)c1)C(F)(F)F	ZINC000819429630	FI	On-Demand	Anodyne	ERBB2	48	50
C[C@@](O)(CNc1ccc(OCc2ccccn2)c(Cl)c1)C(F)(F)F	ZINC000819429630	FI	On-Demand	Anodyne	GRM4	21	43
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)CC1CCCC1	ZINC000819429633	EG	On-Demand	Anodyne	L3MBTL3	74	37
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)CC1CCCC1	ZINC000819429634	EG	On-Demand	Anodyne	L3MBTL3	74	37
COc1cccc([C@H](O)CN(Cc2ccccc2)C(=O)C(F)=C2CCC2)c1	ZINC000819429657	FI	On-Demand	Anodyne	PTGES	19	45
C[C@@H]1CN(C)C[C@@H](C)N1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819429681	FE	On-Demand	Mild	PAPA1_CARPA	37	44
C[C@@H]1CN(C)C[C@@H](C)N1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819429681	FE	On-Demand	Mild	CTSK	15	42
C[C@@H]1CN(C)C[C@@H](C)N1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819429683	FE	On-Demand	Mild	PAPA1_CARPA	37	44
C[C@@H]1CN(C)C[C@@H](C)N1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819429683	FE	On-Demand	Mild	CTSK	15	42
CC[C@H](O)CNc1ccc(OCCC(=O)OC)cc1	ZINC000819429705	CD	On-Demand	Anodyne	LTA4H	19	40
CCc1noc(C)c1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819429726	FG	On-Demand	Mild	PAPA1_CARPA	38	47
CCc1noc(C)c1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819429727	FG	On-Demand	Mild	PAPA1_CARPA	38	47
CN(C)CCn1c(=O)oc2ccc(NC[C@H](O)c3cccnc3)cc21	ZINC000819429756	ED	On-Demand	Anodyne	ADRB3	69	40
CN(C)CCn1c(=O)oc2ccc(NC[C@H](O)c3cccnc3)cc21	ZINC000819429756	ED	On-Demand	Anodyne	TSPO	17	42
CN(C)CCn1c(=O)oc2ccc(NC[C@@H](O)c3cccnc3)cc21	ZINC000819429757	ED	On-Demand	Anodyne	ADRB3	69	40
CN(C)CCn1c(=O)oc2ccc(NC[C@@H](O)c3cccnc3)cc21	ZINC000819429757	ED	On-Demand	Anodyne	TSPO	17	42
COC[C@@H](O)CNc1ccc(OCCC(=O)OC)cc1	ZINC000819429759	CD	On-Demand	Anodyne	ADRB2	37	44
COC[C@@H](O)CNc1ccc(OCCC(=O)OC)cc1	ZINC000819429759	CD	On-Demand	Anodyne	ADRB1	54	49
COC[C@@H](O)CNc1ccc(OCCC(=O)OC)cc1	ZINC000819429759	CD	On-Demand	Anodyne	LTA4H	18	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1cc(C)ccc1C	ZINC000819429761	GG	On-Demand	Anodyne	ADRB2	20	45
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1cc(C)ccc1C	ZINC000819429762	GG	On-Demand	Anodyne	ADRB2	20	45
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819429763	GF	On-Demand	Anodyne	LRRK2	32	42
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)CCc1ccccc1	ZINC000819429764	GF	On-Demand	Anodyne	LRRK2	32	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COC1CCOCC1	ZINC000819429769	GD	On-Demand	Anodyne	LRRK2	26	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COC1CCOCC1	ZINC000819429769	GD	On-Demand	Anodyne	L3MBTL3	51	35
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COC1CCOCC1	ZINC000819429770	GD	On-Demand	Anodyne	LRRK2	26	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COC1CCOCC1	ZINC000819429770	GD	On-Demand	Anodyne	L3MBTL3	51	35
CCOC(=O)CC[C@H](O)CNc1cc(C(=O)N2CCOCC2)ccc1OC	ZINC000819429771	GD	On-Demand	Anodyne	LRRK2	33	42
CCOC(=O)CC[C@@H](O)CNc1cc(C(=O)N2CCOCC2)ccc1OC	ZINC000819429772	GD	On-Demand	Anodyne	LRRK2	33	42
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1cccc(F)c1	ZINC000819429776	FE	On-Demand	Anodyne	HRH3	24	40
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1cccc(F)c1	ZINC000819429776	FE	On-Demand	Anodyne	CYP3A4	42	33
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1cccc(F)c1	ZINC000819429776	FE	On-Demand	Anodyne	LRRK2	31	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1cccc(F)c1	ZINC000819429777	FE	On-Demand	Anodyne	HRH3	24	40
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1cccc(F)c1	ZINC000819429777	FE	On-Demand	Anodyne	CYP3A4	42	33
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1cccc(F)c1	ZINC000819429777	FE	On-Demand	Anodyne	LRRK2	31	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@@H](O)c1ccc(F)cc1F	ZINC000819429782	GF	On-Demand	Anodyne	LRRK2	31	41
COc1ccc(C(=O)N2CCOCC2)cc1NC[C@H](O)c1ccc(F)cc1F	ZINC000819429783	GF	On-Demand	Anodyne	LRRK2	31	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccccc1F	ZINC000819429789	GF	On-Demand	Anodyne	ADRB2	28	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccccc1F	ZINC000819429789	GF	On-Demand	Anodyne	ADRB1	47	36
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccccc1F	ZINC000819429789	GF	On-Demand	Anodyne	ABCB1	42	35
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccccc1F	ZINC000819429789	GF	On-Demand	Anodyne	HPGD	32	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)COc1ccccc1F	ZINC000819429789	GF	On-Demand	Anodyne	ACKR3	50	32
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccccc1F	ZINC000819429790	GF	On-Demand	Anodyne	ADRB2	28	40
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccccc1F	ZINC000819429790	GF	On-Demand	Anodyne	ADRB1	47	36
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccccc1F	ZINC000819429790	GF	On-Demand	Anodyne	ABCB1	42	35
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccccc1F	ZINC000819429790	GF	On-Demand	Anodyne	HPGD	32	42
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)COc1ccccc1F	ZINC000819429790	GF	On-Demand	Anodyne	ACKR3	50	32
COc1ccc(C(=O)N2CCN(C)CC2)cc1NCC1(O)CCOCC1	ZINC000819429791	FD	On-Demand	Anodyne	LRRK2	26	40
COc1ccc(C(=O)N2CCOCC2)cc1NCCS(C)(=O)=O	ZINC000819429792	EC	On-Demand	Anodyne	CNR2	15	40
COc1ccc(C(=O)N2CCOCC2)cc1NCCS(C)(=O)=O	ZINC000819429792	EC	On-Demand	Anodyne	LRRK2	36	48
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)CN(C)C1CC1	ZINC000819429803	ED	On-Demand	Anodyne	L3MBTL3	61	37
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)CN(C)C1CC1	ZINC000819429804	ED	On-Demand	Anodyne	L3MBTL3	61	37
CN(C[C@@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1)C1CC1	ZINC000819429805	FG	On-Demand	Anodyne	EGFR	19	46
CN(C[C@@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1)C1CC1	ZINC000819429805	FG	On-Demand	Anodyne	ERBB2	42	46
CN(C[C@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1)C1CC1	ZINC000819429806	FG	On-Demand	Anodyne	EGFR	19	46
CN(C[C@H](O)CNc1ccc(OCc2ccccn2)c(Cl)c1)C1CC1	ZINC000819429806	FG	On-Demand	Anodyne	ERBB2	42	46
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)C1CC1	ZINC000819429808	DE	On-Demand	Anodyne	HRH3	28	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)C1CC1	ZINC000819429808	DE	On-Demand	Anodyne	L3MBTL3	79	39
COc1ccc(C(=O)N2CCCC2)cc1NC[C@H](O)C1CC1	ZINC000819429808	DE	On-Demand	Anodyne	HPGD	43	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)C1CC1	ZINC000819429809	DE	On-Demand	Anodyne	HRH3	28	41
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)C1CC1	ZINC000819429809	DE	On-Demand	Anodyne	L3MBTL3	79	39
COc1ccc(C(=O)N2CCCC2)cc1NC[C@@H](O)C1CC1	ZINC000819429809	DE	On-Demand	Anodyne	HPGD	43	41
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)c1ccc(F)cc1	ZINC000819429810	GE	On-Demand	Anodyne	HRH4	17	42
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)c1ccc(F)cc1	ZINC000819429811	GE	On-Demand	Anodyne	HRH4	17	42
O[C@@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)CN1CCOCC1	ZINC000819429812	GE	On-Demand	Anodyne	EGFR	23	52
O[C@@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)CN1CCOCC1	ZINC000819429812	GE	On-Demand	Anodyne	ERBB2	45	52
O[C@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)CN1CCOCC1	ZINC000819429813	GE	On-Demand	Anodyne	EGFR	23	52
O[C@H](CNc1ccc(OCc2ccccn2)c(Cl)c1)CN1CCOCC1	ZINC000819429813	GE	On-Demand	Anodyne	ERBB2	45	52
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)C[C@@H](O)c1ccccc1	ZINC000819429830	FD	On-Demand	Anodyne	REN	43	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)C[C@@H](O)c1ccccc1	ZINC000819429830	FD	On-Demand	Anodyne	FPR1	48	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)C[C@H](O)c1ccccc1	ZINC000819429831	FD	On-Demand	Anodyne	REN	43	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)C[C@H](O)c1ccccc1	ZINC000819429831	FD	On-Demand	Anodyne	FPR1	48	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)C[C@@H](O)c1ccccc1	ZINC000819429832	FD	On-Demand	Anodyne	REN	43	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)C[C@@H](O)c1ccccc1	ZINC000819429832	FD	On-Demand	Anodyne	FPR1	48	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)C[C@H](O)c1ccccc1	ZINC000819429833	FD	On-Demand	Anodyne	REN	43	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)C[C@H](O)c1ccccc1	ZINC000819429833	FD	On-Demand	Anodyne	FPR1	48	37
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819429836	GE	On-Demand	Anodyne	ABCB1	46	37
COc1ccc(C(=O)N2CCN(C)CC2)cc1NC[C@H](O)CCc1ccccc1	ZINC000819429837	GE	On-Demand	Anodyne	ABCB1	46	37
COC[C@@H](O)CNc1cc(C(=O)N2CCN(C)CC2)ccc1OC	ZINC000819429840	EC	On-Demand	Anodyne	HRH4	15	41
COC[C@@H](O)CNc1cc(C(=O)N2CCN(C)CC2)ccc1OC	ZINC000819429840	EC	On-Demand	Anodyne	SLC9A1	56	31
O=C(CN1CCN(C(=O)C(F)=C2CCC2)CC1)Nc1ccccc1F	ZINC000819429867	EE	On-Demand	Anodyne	SLC27A1	41	37
C#CCNC(=O)CCNc1cc(COc2cccc(F)c2)ccc1OC	ZINC000819429928	FF	On-Demand	Mild	MAOB	18	40
COC[C@@H](O)CNc1cc(COc2cccc(F)c2)ccc1OC	ZINC000819429930	EF	On-Demand	Anodyne	MAOB	18	42
O=C(O)CCCNC(=O)N1CCC(c2cccc(F)c2)CC1	ZINC000819429948	DF	On-Demand	Anodyne	CCR5	64	33
O=C(O)CCCNC(=O)N1CCC(c2cccc(F)c2)CC1	ZINC000819429948	DF	On-Demand	Anodyne	EPHX2	27	40
O=C(O)CCCNC(=O)N1CCC(c2cccc(F)c2)CC1	ZINC000819429948	DF	On-Demand	Anodyne	MCHR1	23	41
O=C(O)CCCNC(=O)N(Cc1ccccc1O)C1CCCCC1	ZINC000819429956	EG	On-Demand	Clean	ACE	54	42
O=C(O)CCCNC(=O)N(CCc1ccccc1)C1CC1	ZINC000819429976	CE	On-Demand	Anodyne	ACE	47	37
O=C(O)CCCNC(=O)N(CCc1ccccc1)C1CC1	ZINC000819429976	CE	On-Demand	Anodyne	FKBP1A	22	40
O=C(O)CCCNC(=O)N(CCc1ccccc1)C1CC1	ZINC000819429976	CE	On-Demand	Anodyne	MME	15	43
O=C(O)CCCNC(=O)N1CC(Cc2ccccc2)C1	ZINC000819429978	CD	On-Demand	Anodyne	GRIN2B	46	35
O=C(O)CCCNC(=O)N1CC(Cc2ccccc2)C1	ZINC000819429978	CD	On-Demand	Anodyne	MME	15	44
O=C(O)CCCNC(=O)N1CC(Cc2ccccc2)C1	ZINC000819429978	CD	On-Demand	Anodyne	CCR3	28	46
O=C(O)CCCNC(=O)N1CCC(c2cc3ccccc3[nH]2)CC1	ZINC000819429982	EF	On-Demand	Anodyne	CYP51A1	21	41
O=C(O)CCCNC(=O)N1CCC(c2cc3ccccc3[nH]2)CC1	ZINC000819429982	EF	On-Demand	Anodyne	AKR1C3	16	40
O=C(O)CCCNC(=O)N1CCC[C@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000819429987	FF	On-Demand	Anodyne	PRCP	33	53
O=C(O)CCCNC(=O)N1CCC[C@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000819429987	FF	On-Demand	Anodyne	GRIN2D	46	33
O=C(O)CCCNC(=O)N1CCC[C@@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000819429989	FF	On-Demand	Anodyne	PRCP	33	53
O=C(O)CCCNC(=O)N1CCC[C@@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000819429989	FF	On-Demand	Anodyne	GRIN2D	46	33
O=C(O)CCCNC(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000819429990	DF	On-Demand	Anodyne	ADRA1D	19	44
O=C(O)CCCNC(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000819429990	DF	On-Demand	Anodyne	ADRA1A	32	44
O=C(O)CCCNC(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000819429990	DF	On-Demand	Anodyne	ADRA1B	22	44
O=C(O)CCCNC(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000819429990	DF	On-Demand	Anodyne	CCR1	29	45
O=C(O)CCCNC(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000819429990	DF	On-Demand	Anodyne	EPHX2	19	48
O=C(O)CCCNC(=O)N1CC[C@@H]1c1cccc(F)c1	ZINC000819430013	CE	On-Demand	Anodyne	CCR5	48	33
O=C(O)CCCNC(=O)N1CC[C@H]1c1cccc(F)c1	ZINC000819430015	CE	On-Demand	Anodyne	CCR5	48	33
O=C(O)CCCNC(=O)N1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	ZINC000819430016	GC	On-Demand	Anodyne	KCNA3	18	42
O=C(O)CCCNC(=O)Cc1csc(NC(=O)c2cccc(O)c2)n1	ZINC000819430018	FD	On-Demand	Anodyne	CPT1A	28	42
O=C(O)CCCNC(=O)Cc1csc(NC(=O)c2cccc(O)c2)n1	ZINC000819430018	FD	On-Demand	Anodyne	CPT1B	39	41
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(CCN3CCSCC3)cc2)c1	ZINC000819430032	GG	On-Demand	Bother	KCNJ1	27	44
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(CCN3CCSCC3)cc2)c1	ZINC000819430033	GG	On-Demand	Bother	KCNJ1	27	44
CN(C)CCn1c(=O)oc2ccc(NC[C@H](O)c3cccc(Cl)c3)cc21	ZINC000819430052	GF	On-Demand	Anodyne	ADRB1	20	41
CN(C)CCn1c(=O)oc2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc21	ZINC000819430053	GF	On-Demand	Anodyne	ADRB1	20	41
COC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1C(=O)C(F)=C1CCC1	ZINC000819430087	GG	On-Demand	Anodyne	SLC18A2	49	36
COC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1C(=O)C(F)=C1CCC1	ZINC000819430087	GG	On-Demand	Anodyne	HCRTR1	15	43
COC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1C(=O)C(F)=C1CCC1	ZINC000819430087	GG	On-Demand	Anodyne	MTNR1B	15	48
COC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1C(=O)C(F)=C1CCC1	ZINC000819430088	GG	On-Demand	Anodyne	SLC18A2	49	36
COC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1C(=O)C(F)=C1CCC1	ZINC000819430088	GG	On-Demand	Anodyne	HCRTR1	15	43
COC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1C(=O)C(F)=C1CCC1	ZINC000819430088	GG	On-Demand	Anodyne	MTNR1B	15	48
Cn1c(=O)n(C)c2cc(NC[C@H](O)c3cccnc3)ccc21	ZINC000819430109	CD	On-Demand	Anodyne	ADRB2	24	43
Cn1c(=O)n(C)c2cc(NC[C@H](O)c3cccnc3)ccc21	ZINC000819430109	CD	On-Demand	Anodyne	ADRB3	91	45
Cn1c(=O)n(C)c2cc(NC[C@@H](O)c3cccnc3)ccc21	ZINC000819430110	CD	On-Demand	Anodyne	ADRB2	24	43
Cn1c(=O)n(C)c2cc(NC[C@@H](O)c3cccnc3)ccc21	ZINC000819430110	CD	On-Demand	Anodyne	ADRB3	91	45
CO[C@@H](C)c1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819430125	DG	On-Demand	Bother	CACNA1C	45	36
CO[C@@H](C)c1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819430125	DG	On-Demand	Bother	CACNA1D	68	36
CO[C@@H](C)c1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819430127	DG	On-Demand	Bother	CACNA1C	45	36
CO[C@@H](C)c1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819430127	DG	On-Demand	Bother	CACNA1D	68	36
CO[C@@H](C)c1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819430128	CF	On-Demand	Anodyne	ADRB1	25	41
CO[C@@H](C)c1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819430128	CF	On-Demand	Anodyne	ADRB3	84	42
CO[C@@H](C)c1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819430129	CF	On-Demand	Anodyne	ADRB1	25	41
CO[C@@H](C)c1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819430129	CF	On-Demand	Anodyne	ADRB3	84	42
O=C(Cc1nsc2ccccc12)NN1CCCCC1	ZINC000819430147	CE	On-Demand	Anodyne	HTR1A	17	41
O=C(Cc1nsc2ccccc12)NN1CCCCC1	ZINC000819430147	CE	On-Demand	Anodyne	DRD2	21	41
CO[C@@H](C)c1cccc(NCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819430151	EH	On-Demand	Anodyne	MTNR1B	17	44
COC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819430179	FC	On-Demand	Anodyne	REN	19	46
O[C@H](CNc1ccc2c(ccn2CCN2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819430227	GH	On-Demand	Anodyne	IGF1R	28	40
O[C@H](CNc1ccc2c(ccn2CCN2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819430227	GH	On-Demand	Anodyne	CYP3A4	46	37
O[C@@H](CNc1ccc2c(ccn2CCN2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819430228	GH	On-Demand	Anodyne	IGF1R	28	40
O[C@@H](CNc1ccc2c(ccn2CCN2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819430228	GH	On-Demand	Anodyne	CYP3A4	46	37
CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1c(C)noc1C	ZINC000819430238	GG	On-Demand	Mild	PAPA1_CARPA	37	46
CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1c(C)noc1C	ZINC000819430239	GG	On-Demand	Mild	PAPA1_CARPA	37	46
CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1c(C)noc1C	ZINC000819430240	GG	On-Demand	Mild	PAPA1_CARPA	37	46
CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1c(C)noc1C	ZINC000819430241	GG	On-Demand	Mild	PAPA1_CARPA	37	46
O=C(/C=C\[C@H]1CCCO1)N1CCN(c2ccc(F)cc2Cl)CC1	ZINC000819430247	EF	On-Demand	Anodyne	NPY2R	28	41
O=C(/C=C\[C@@H]1CCCO1)N1CCN(c2ccc(F)cc2Cl)CC1	ZINC000819430248	EF	On-Demand	Anodyne	NPY2R	28	41
O=C(/C=C/[C@H]1CCCO1)N1CCN(c2ccc(F)cc2Cl)CC1	ZINC000819430249	EF	On-Demand	Anodyne	NPY2R	28	41
O=C(/C=C/[C@@H]1CCCO1)N1CCN(c2ccc(F)cc2Cl)CC1	ZINC000819430250	EF	On-Demand	Anodyne	NPY2R	28	41
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819430277	FG	On-Demand	Anodyne	ADRB2	34	53
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819430277	FG	On-Demand	Anodyne	ADRB1	57	53
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819430277	FG	On-Demand	Anodyne	GRIN1	26	41
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819430278	FG	On-Demand	Anodyne	ADRB2	34	53
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819430278	FG	On-Demand	Anodyne	ADRB1	57	53
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819430278	FG	On-Demand	Anodyne	GRIN1	26	41
CC(C)(C)OC(=O)N1CCc2cc(NCCC(=O)Nc3cccnc3)ccc21	ZINC000819430289	GH	On-Demand	Anodyne	HTR2C	18	49
CC(C)(C)OC(=O)N1CCc2cc(NCCC(=O)Nc3cccnc3)ccc21	ZINC000819430289	GH	On-Demand	Anodyne	CYP11B2	23	42
O[C@@H](CNc1ccc2c(ccn2CCN2CCOCC2)c1)c1cccnc1	ZINC000819430294	FF	On-Demand	Anodyne	ADRB3	65	38
O[C@@H](CNc1ccc2c(ccn2CCN2CCOCC2)c1)c1cccnc1	ZINC000819430294	FF	On-Demand	Anodyne	CASR	41	42
O[C@H](CNc1ccc2c(ccn2CCN2CCOCC2)c1)c1cccnc1	ZINC000819430295	FF	On-Demand	Anodyne	ADRB3	65	38
O[C@H](CNc1ccc2c(ccn2CCN2CCOCC2)c1)c1cccnc1	ZINC000819430295	FF	On-Demand	Anodyne	CASR	41	42
C#CCNC(=O)CCNc1ccc(OC)cc1C	ZINC000819430389	BD	On-Demand	Mild	NQO2	38	40
C#CCNC(=O)CCNc1ccc(OC)cc1C	ZINC000819430389	BD	On-Demand	Mild	MTNR1A	75	40
C#CCNC(=O)CCNc1ccc(OC)cc1C	ZINC000819430389	BD	On-Demand	Mild	MTNR1B	61	40
Cc1ccc(NC[C@H](O)c2ccccc2)cc1OCC(F)F	ZINC000819430397	DH	On-Demand	Anodyne	ADRB2	24	45
Cc1ccc(NC[C@@H](O)c2ccccc2)cc1OCC(F)F	ZINC000819430398	DH	On-Demand	Anodyne	ADRB2	24	45
Cc1cc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ncn1	ZINC000819430417	ED	On-Demand	Mild	PAPA1_CARPA	45	48
Cc1cc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ncn1	ZINC000819430418	ED	On-Demand	Mild	PAPA1_CARPA	45	48
CC(=O)c1cccc(OC[C@H](O)CNc2ccc3c(c2)CCCO3)c1	ZINC000819430441	EG	On-Demand	Anodyne	ADRB2	18	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc3c(c2)CCCO3)c1	ZINC000819430442	EG	On-Demand	Anodyne	ADRB2	18	42
O[C@@H](CNc1ccc(NCC2CCCC2)cc1)c1cccnc1	ZINC000819430493	DH	On-Demand	Anodyne	ADRB2	25	42
O[C@@H](CNc1ccc(NCC2CCCC2)cc1)c1cccnc1	ZINC000819430493	DH	On-Demand	Anodyne	ADRB1	25	43
O[C@@H](CNc1ccc(NCC2CCCC2)cc1)c1cccnc1	ZINC000819430493	DH	On-Demand	Anodyne	ADRB3	95	48
O[C@H](CNc1ccc(NCC2CCCC2)cc1)c1cccnc1	ZINC000819430494	DH	On-Demand	Anodyne	ADRB2	25	42
O[C@H](CNc1ccc(NCC2CCCC2)cc1)c1cccnc1	ZINC000819430494	DH	On-Demand	Anodyne	ADRB1	25	43
O[C@H](CNc1ccc(NCC2CCCC2)cc1)c1cccnc1	ZINC000819430494	DH	On-Demand	Anodyne	ADRB3	95	48
CC(C)(C)OC(=O)N1CCc2cc(NCCC(=O)Nc3ccccc3)ccc21	ZINC000819430504	GI	On-Demand	Anodyne	AVPR2	25	40
CC(C)(C)OC(=O)N1CCc2cc(NCCC(=O)Nc3ccccc3)ccc21	ZINC000819430504	GI	On-Demand	Anodyne	NPY2R	46	35
CC(C)(C)OC(=O)N1CCc2cc(NCCC(=O)Nc3ccccc3)ccc21	ZINC000819430504	GI	On-Demand	Anodyne	GPR119	15	42
Cc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCN3C(=O)OC(C)(C)C)cc1	ZINC000819430506	GI	On-Demand	Anodyne	ADRB2	17	42
Cc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCN3C(=O)OC(C)(C)C)cc1	ZINC000819430506	GI	On-Demand	Anodyne	ACOX1	50	36
Cc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCN3C(=O)OC(C)(C)C)cc1	ZINC000819430507	GI	On-Demand	Anodyne	ADRB2	17	42
Cc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCN3C(=O)OC(C)(C)C)cc1	ZINC000819430507	GI	On-Demand	Anodyne	ACOX1	50	36
C#CC[C@@H](NC(=O)CCc1cccc(OC(F)F)c1)c1ccccc1	ZINC000819430516	EI	On-Demand	Mild	CRTM	44	35
COC[C@@H](O)CNc1cc2sc(C)nc2cc1OC	ZINC000819430522	CE	On-Demand	Anodyne	ACOX1	64	34
CO[C@@H](C)c1cccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819430545	GH	On-Demand	Anodyne	GPR119	40	49
CO[C@@H](C)c1cccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819430546	GH	On-Demand	Anodyne	GPR119	40	49
O=C(Nc1cc(N2CCCS2(=O)=O)ccc1O)C(F)=C1CCC1	ZINC000819430556	EE	On-Demand	Anodyne	CDK1	19	40
O[C@@H](CNc1ccc(CN2CCc3ccccc32)cc1)C1CC1	ZINC000819430599	DG	On-Demand	Anodyne	NOD2	40	34
O[C@H](CNc1ccc(CN2CCc3ccccc32)cc1)C1CC1	ZINC000819430600	DG	On-Demand	Anodyne	NOD2	40	34
C#CC[C@H](NC(=O)CCc1cccc(OC(F)F)c1)c1ccccc1	ZINC000819430617	EI	On-Demand	Mild	CRTM	44	35
C#CC[C@@H](NC(=O)[C@H]1C[C@H]1NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819430646	EF	On-Demand	Mild	FPR1	42	34
C#CC[C@H](NC(=O)[C@H]1C[C@H]1NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819430647	EF	On-Demand	Mild	FPR1	42	34
CC(C)(C)OC(=O)N1CCc2cc(NC[C@H](O)C3CC3)ccc21	ZINC000819430657	DG	On-Demand	Anodyne	GPR119	23	49
CC(C)(C)OC(=O)N1CCc2cc(NC[C@@H](O)C3CC3)ccc21	ZINC000819430658	DG	On-Demand	Anodyne	GPR119	23	49
CC(C)(C)OC(=O)N1CCc2cc(NC[C@@H](O)c3c(F)cccc3F)ccc21	ZINC000819430660	GI	On-Demand	Anodyne	GPR119	15	40
CC(C)(C)OC(=O)N1CCc2cc(NC[C@H](O)c3c(F)cccc3F)ccc21	ZINC000819430661	GI	On-Demand	Anodyne	GPR119	15	40
Cn1c(=O)oc2ccc(NC[C@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)cc21	ZINC000819430673	GF	On-Demand	Anodyne	GPR119	43	43
Cn1c(=O)oc2ccc(NC[C@@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)cc21	ZINC000819430674	GF	On-Demand	Anodyne	GPR119	43	43
CC(C)(C)OC(=O)N1CCc2cc(NC[C@@H](O)c3cccnc3)ccc21	ZINC000819430698	FH	On-Demand	Anodyne	HTR2C	15	41
CC(C)(C)OC(=O)N1CCc2cc(NC[C@@H](O)c3cccnc3)ccc21	ZINC000819430698	FH	On-Demand	Anodyne	ADRB3	79	44
CC(C)(C)OC(=O)N1CCc2cc(NC[C@@H](O)c3cccnc3)ccc21	ZINC000819430698	FH	On-Demand	Anodyne	CYP11B2	18	42
CC(C)(C)OC(=O)N1CCc2cc(NC[C@H](O)c3cccnc3)ccc21	ZINC000819430699	FH	On-Demand	Anodyne	HTR2C	15	41
CC(C)(C)OC(=O)N1CCc2cc(NC[C@H](O)c3cccnc3)ccc21	ZINC000819430699	FH	On-Demand	Anodyne	ADRB3	79	44
CC(C)(C)OC(=O)N1CCc2cc(NC[C@H](O)c3cccnc3)ccc21	ZINC000819430699	FH	On-Demand	Anodyne	CYP11B2	18	42
CC(C)(C)OC(=O)N1CCc2cc(NCCS(C)(=O)=O)ccc21	ZINC000819430702	EE	On-Demand	Anodyne	GPR119	32	50
O=C(/C=C\[C@H]1CCCO1)Nc1cc(S(=O)(=O)N2CCCC2)ccc1O	ZINC000819430703	FD	On-Demand	Anodyne	TGM2	52	37
O=C(/C=C\[C@H]1CCCO1)Nc1cc(S(=O)(=O)N2CCCC2)ccc1O	ZINC000819430703	FD	On-Demand	Anodyne	F13A1	39	40
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(S(=O)(=O)N2CCCC2)ccc1O	ZINC000819430704	FD	On-Demand	Anodyne	TGM2	52	37
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(S(=O)(=O)N2CCCC2)ccc1O	ZINC000819430704	FD	On-Demand	Anodyne	F13A1	39	40
O=C(/C=C/[C@H]1CCCO1)Nc1cc(S(=O)(=O)N2CCCC2)ccc1O	ZINC000819430705	FD	On-Demand	Anodyne	TGM2	52	37
O=C(/C=C/[C@H]1CCCO1)Nc1cc(S(=O)(=O)N2CCCC2)ccc1O	ZINC000819430705	FD	On-Demand	Anodyne	F13A1	39	40
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(S(=O)(=O)N2CCCC2)ccc1O	ZINC000819430706	FD	On-Demand	Anodyne	TGM2	52	37
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(S(=O)(=O)N2CCCC2)ccc1O	ZINC000819430706	FD	On-Demand	Anodyne	F13A1	39	40
O[C@@H](CNc1ccc2c(c1)CCCO2)c1cccnc1	ZINC000819430708	CF	On-Demand	Anodyne	ADRB3	83	41
O[C@H](CNc1ccc2c(c1)CCCO2)c1cccnc1	ZINC000819430709	CF	On-Demand	Anodyne	ADRB3	83	41
CC(C)(C)OC(=O)N1CCc2cc(NC[C@@H](O)c3ccc(F)cn3)ccc21	ZINC000819430715	FH	On-Demand	Anodyne	EIF2AK3	41	38
CC(C)(C)OC(=O)N1CCc2cc(NC[C@H](O)c3ccc(F)cn3)ccc21	ZINC000819430716	FH	On-Demand	Anodyne	EIF2AK3	41	38
CO[C@@H](C)c1cccc(NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819430733	DI	On-Demand	Anodyne	ADRB3	43	36
CO[C@@H](C)c1cccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819430736	EF	On-Demand	Anodyne	ADRB1	21	40
CO[C@@H](C)c1cccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819430736	EF	On-Demand	Anodyne	ADRB3	52	41
CO[C@@H](C)c1cccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819430737	EF	On-Demand	Anodyne	ADRB1	21	40
CO[C@@H](C)c1cccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819430737	EF	On-Demand	Anodyne	ADRB3	52	41
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(SC(C)(C)C)cc2)cc1	ZINC000819430758	GI	On-Demand	Anodyne	ADRB2	47	62
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(SC(C)(C)C)cc2)cc1	ZINC000819430758	GI	On-Demand	Anodyne	ADRB1	72	62
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(SC(C)(C)C)cc2)cc1	ZINC000819430758	GI	On-Demand	Anodyne	ADRB3	47	53
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(SC(C)(C)C)cc2)cc1	ZINC000819430759	GI	On-Demand	Anodyne	ADRB2	47	62
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(SC(C)(C)C)cc2)cc1	ZINC000819430759	GI	On-Demand	Anodyne	ADRB1	72	62
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(SC(C)(C)C)cc2)cc1	ZINC000819430759	GI	On-Demand	Anodyne	ADRB3	47	53
COc1cccc([S@@](=O)CC(=O)NN2CCCCC2)c1	ZINC000819430791	CD	On-Demand	Anodyne	DRD4	44	34
COc1cccc([S@@](=O)CC(=O)NN2CCCCC2)c1	ZINC000819430791	CD	On-Demand	Anodyne	MTNR1A	54	39
COc1cccc([S@@](=O)CC(=O)NN2CCCCC2)c1	ZINC000819430791	CD	On-Demand	Anodyne	MTNR1B	53	39
CO[C@@H](C)c1cccc(NC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819430811	DI	On-Demand	Anodyne	ADRB1	16	40
CO[C@@H](C)c1cccc(NC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819430813	DI	On-Demand	Anodyne	ADRB1	16	40
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(NCC3CCCC3)cc2)c1	ZINC000819430843	FI	On-Demand	Bother	CACNA1C	44	36
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(NCC3CCCC3)cc2)c1	ZINC000819430843	FI	On-Demand	Bother	CACNA1D	67	36
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(NCC3CCCC3)cc2)c1	ZINC000819430844	FI	On-Demand	Bother	CACNA1C	44	36
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(NCC3CCCC3)cc2)c1	ZINC000819430844	FI	On-Demand	Bother	CACNA1D	67	36
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2ccc3c(c2)CCCO3)CC1	ZINC000819430845	GH	On-Demand	Anodyne	GPR119	21	48
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2ccc3c(c2)CCCO3)CC1	ZINC000819430846	GH	On-Demand	Anodyne	GPR119	21	48
O[C@H](CNc1ccc2c(ccn2CCN2CCOCC2)c1)c1ccccc1	ZINC000819430855	FG	On-Demand	Anodyne	CASR	48	38
O[C@@H](CNc1ccc2c(ccn2CCN2CCOCC2)c1)c1ccccc1	ZINC000819430856	FG	On-Demand	Anodyne	CASR	48	38
CN(C[C@@H](O)CNc1ccc2c(c1)CCN2C(=O)OC(C)(C)C)C1CC1	ZINC000819430895	FF	On-Demand	Anodyne	GPR119	22	43
CN(C[C@H](O)CNc1ccc2c(c1)CCN2C(=O)OC(C)(C)C)C1CC1	ZINC000819430896	FF	On-Demand	Anodyne	GPR119	22	43
CN1Cc2ccccc2[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819430903	GF	On-Demand	Mild	PAPA1_CARPA	40	44
CN1Cc2ccccc2[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819430903	GF	On-Demand	Mild	CTSL	19	44
CN1Cc2ccccc2[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819430903	GF	On-Demand	Mild	FPR1	45	37
CN1Cc2ccccc2[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819430904	GF	On-Demand	Mild	PAPA1_CARPA	40	44
CN1Cc2ccccc2[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819430904	GF	On-Demand	Mild	CTSL	19	44
CN1Cc2ccccc2[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819430904	GF	On-Demand	Mild	FPR1	45	37
CN1Cc2ccccc2[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819430905	GF	On-Demand	Mild	PAPA1_CARPA	40	44
CN1Cc2ccccc2[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819430905	GF	On-Demand	Mild	CTSL	19	44
CN1Cc2ccccc2[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819430905	GF	On-Demand	Mild	FPR1	45	37
CN1Cc2ccccc2[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819430906	GF	On-Demand	Mild	PAPA1_CARPA	40	44
CN1Cc2ccccc2[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819430906	GF	On-Demand	Mild	CTSL	19	44
CN1Cc2ccccc2[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819430906	GF	On-Demand	Mild	FPR1	45	37
CO[C@@H](C)c1cccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819430927	FI	On-Demand	Anodyne	ADRB3	25	41
CO[C@@H](C)c1cccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819430929	FI	On-Demand	Anodyne	ADRB3	25	41
CC(=O)Nc1cccc(CC(=O)NN2CCCCC2)c1	ZINC000819430963	CD	On-Demand	Anodyne	KCNQ2	26	40
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819430970	EF	On-Demand	Anodyne	ADRB2	40	49
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819430970	EF	On-Demand	Anodyne	ADRB1	48	42
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819430970	EF	On-Demand	Anodyne	ADRB3	31	43
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819430970	EF	On-Demand	Anodyne	ABCB1	20	40
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819430971	EF	On-Demand	Anodyne	ADRB2	40	49
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819430971	EF	On-Demand	Anodyne	ADRB1	48	42
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819430971	EF	On-Demand	Anodyne	ADRB3	31	43
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819430971	EF	On-Demand	Anodyne	ABCB1	20	40
CO[C@@H](C)c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819430975	DI	On-Demand	Anodyne	ADRB2	24	49
CO[C@@H](C)c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819430975	DI	On-Demand	Anodyne	ADRB1	39	49
CO[C@@H](C)c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819430975	DI	On-Demand	Anodyne	ADRB3	63	44
CO[C@@H](C)c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819430975	DI	On-Demand	Anodyne	CYP3A4	40	35
CO[C@@H](C)c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819430977	DI	On-Demand	Anodyne	ADRB2	24	49
CO[C@@H](C)c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819430977	DI	On-Demand	Anodyne	ADRB1	39	49
CO[C@@H](C)c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819430977	DI	On-Demand	Anodyne	ADRB3	63	44
CO[C@@H](C)c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819430977	DI	On-Demand	Anodyne	CYP3A4	40	35
O=C(NN1CCCCC1)c1cc2c(cn1)OCCO2	ZINC000819430992	CC	On-Demand	Anodyne	CNR1	52	32
O=C(Cc1ccc(-n2cnnc2)cc1)NN1CCCCC1	ZINC000819431009	CD	On-Demand	Anodyne	KCNJ1	44	35
Cc1ccc(OC[C@H](O)CNc2cccc(OCCS(C)(=O)=O)c2)c(C)c1	ZINC000819431017	GF	On-Demand	Anodyne	ADRB2	26	42
Cc1ccc(OC[C@H](O)CNc2cccc(OCCS(C)(=O)=O)c2)c(C)c1	ZINC000819431017	GF	On-Demand	Anodyne	ADRB1	32	42
Cc1ccc(OC[C@@H](O)CNc2cccc(OCCS(C)(=O)=O)c2)c(C)c1	ZINC000819431018	GF	On-Demand	Anodyne	ADRB2	26	42
Cc1ccc(OC[C@@H](O)CNc2cccc(OCCS(C)(=O)=O)c2)c(C)c1	ZINC000819431018	GF	On-Demand	Anodyne	ADRB1	32	42
O=C(/C=C\[C@H]1CCCO1)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1O	ZINC000819431024	GD	On-Demand	Anodyne	TGM2	45	38
O=C(/C=C\[C@@H]1CCCO1)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1O	ZINC000819431025	GD	On-Demand	Anodyne	TGM2	45	38
O=C(/C=C/[C@H]1CCCO1)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1O	ZINC000819431026	GD	On-Demand	Anodyne	TGM2	45	38
O=C(/C=C/[C@@H]1CCCO1)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1O	ZINC000819431027	GD	On-Demand	Anodyne	TGM2	45	38
CC(C)(C)OC(=O)N1CCc2cc(NC[C@H](O)COC3CCOCC3)ccc21	ZINC000819431053	GF	On-Demand	Anodyne	GPR119	18	43
CC(C)(C)OC(=O)N1CCc2cc(NC[C@@H](O)COC3CCOCC3)ccc21	ZINC000819431054	GF	On-Demand	Anodyne	GPR119	18	43
CC(C)(C)OC(=O)N1CCc2cc(NC[C@@H](O)COc3ccccc3)ccc21	ZINC000819431055	GH	On-Demand	Anodyne	ADRB2	34	41
CC(C)(C)OC(=O)N1CCc2cc(NC[C@@H](O)COc3ccccc3)ccc21	ZINC000819431055	GH	On-Demand	Anodyne	ADRB1	52	44
CC(C)(C)OC(=O)N1CCc2cc(NC[C@@H](O)COc3ccccc3)ccc21	ZINC000819431055	GH	On-Demand	Anodyne	ADRB3	36	44
CC(C)(C)OC(=O)N1CCc2cc(NC[C@@H](O)COc3ccccc3)ccc21	ZINC000819431055	GH	On-Demand	Anodyne	GPR119	15	42
CC(C)(C)OC(=O)N1CCc2cc(NC[C@H](O)COc3ccccc3)ccc21	ZINC000819431056	GH	On-Demand	Anodyne	ADRB2	34	41
CC(C)(C)OC(=O)N1CCc2cc(NC[C@H](O)COc3ccccc3)ccc21	ZINC000819431056	GH	On-Demand	Anodyne	ADRB1	52	44
CC(C)(C)OC(=O)N1CCc2cc(NC[C@H](O)COc3ccccc3)ccc21	ZINC000819431056	GH	On-Demand	Anodyne	ADRB3	36	44
CC(C)(C)OC(=O)N1CCc2cc(NC[C@H](O)COc3ccccc3)ccc21	ZINC000819431056	GH	On-Demand	Anodyne	GPR119	15	42
N#Cc1ccc([C@H](O)CNc2ccc3c(ccn3CCN3CCOCC3)c2)cc1	ZINC000819431061	GF	On-Demand	Mild	RORC	15	41
N#Cc1ccc([C@@H](O)CNc2ccc3c(ccn3CCN3CCOCC3)c2)cc1	ZINC000819431062	GF	On-Demand	Mild	RORC	15	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc3scnc3c2)CC1	ZINC000819431066	GH	On-Demand	Anodyne	GPR119	51	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc3scnc3c2)CC1	ZINC000819431067	GH	On-Demand	Anodyne	GPR119	51	42
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431068	FF	On-Demand	Anodyne	ADRB2	31	55
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431068	FF	On-Demand	Anodyne	ADRB1	60	55
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431068	FF	On-Demand	Anodyne	ADRB3	35	45
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431069	FF	On-Demand	Anodyne	ADRB2	31	55
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431069	FF	On-Demand	Anodyne	ADRB1	60	55
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431069	FF	On-Demand	Anodyne	ADRB3	35	45
O=CN1CCCN(C(=O)c2ccc(Oc3cccc(Cl)c3Cl)cc2)CC1	ZINC000819431119	GI	On-Demand	Anodyne	HRH3	27	40
O=CN1CCCN(C(=O)c2ccc(Oc3cccc(Cl)c3Cl)cc2)CC1	ZINC000819431119	GI	On-Demand	Anodyne	MLYCD	17	40
O=CN1CCCN(C(=O)c2ccc(Oc3cccc(Cl)c3Cl)cc2)CC1	ZINC000819431119	GI	On-Demand	Anodyne	L3MBTL3	46	40
O=CN1CCCN(C(=O)Cc2c[nH]c3cc(F)ccc23)CC1	ZINC000819431131	DD	On-Demand	Anodyne	MPO	78	38
COC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431134	EE	On-Demand	Anodyne	CTSK	27	40
COC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431134	EE	On-Demand	Anodyne	CAPNS1	63	37
COC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431134	EE	On-Demand	Anodyne	MMP3	18	41
COC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431134	EE	On-Demand	Anodyne	HLA-DRB1	40	33
COC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431134	EE	On-Demand	Anodyne	CTSS	15	40
COC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431134	EE	On-Demand	Anodyne	CAPN1	72	46
COC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431134	EE	On-Demand	Anodyne	CAPN2	94	38
COC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431134	EE	On-Demand	Anodyne	MMP7	20	41
COC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431134	EE	On-Demand	Anodyne	MMP1	17	41
COC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431134	EE	On-Demand	Anodyne	FPR1	63	37
COC(=O)N[C@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431134	EE	On-Demand	Anodyne	NPR	67	34
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431135	EE	On-Demand	Anodyne	CTSK	27	40
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431135	EE	On-Demand	Anodyne	CAPNS1	63	37
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431135	EE	On-Demand	Anodyne	MMP3	18	41
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431135	EE	On-Demand	Anodyne	HLA-DRB1	40	33
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431135	EE	On-Demand	Anodyne	CTSS	15	40
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431135	EE	On-Demand	Anodyne	CAPN1	72	46
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431135	EE	On-Demand	Anodyne	CAPN2	94	38
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431135	EE	On-Demand	Anodyne	MMP7	20	41
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431135	EE	On-Demand	Anodyne	MMP1	17	41
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431135	EE	On-Demand	Anodyne	FPR1	63	37
COC(=O)N[C@@H](CC(C)C)C(=O)Nc1ccc(C(=O)OC)s1	ZINC000819431135	EE	On-Demand	Anodyne	NPR	67	34
CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CCCN(C=O)CC1	ZINC000819431136	EC	On-Demand	Anodyne	PREP	15	53
O=C(NNC(=S)NCCc1cccs1)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819431147	ID	On-Demand	Reactive	MMP13	20	40
O=C(NNC(=S)NCCc1cccs1)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819431147	ID	On-Demand	Reactive	ADAM17	23	44
O=C(NNC(=S)NCCc1cccs1)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819431147	ID	On-Demand	Reactive	ITGA4	32	42
O=C(NNC(=S)NCCc1cccs1)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819431147	ID	On-Demand	Reactive	CAPNS1	20	41
O=C(NNC(=S)NCCc1cccs1)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819431147	ID	On-Demand	Reactive	MMP8	15	40
O=C(NNC(=S)NCCc1cccs1)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819431147	ID	On-Demand	Reactive	CAPN1	16	47
O=C(NNC(=S)NCCc1cccs1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819431148	ID	On-Demand	Reactive	MMP13	20	40
O=C(NNC(=S)NCCc1cccs1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819431148	ID	On-Demand	Reactive	ADAM17	23	44
O=C(NNC(=S)NCCc1cccs1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819431148	ID	On-Demand	Reactive	ITGA4	32	42
O=C(NNC(=S)NCCc1cccs1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819431148	ID	On-Demand	Reactive	CAPNS1	20	41
O=C(NNC(=S)NCCc1cccs1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819431148	ID	On-Demand	Reactive	MMP8	15	40
O=C(NNC(=S)NCCc1cccs1)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000819431148	ID	On-Demand	Reactive	CAPN1	16	47
O=CN1CCCN(C(=O)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000819431153	CC	On-Demand	Bother	KCNJ1	34	48
CCCOc1cccc(CC(=O)N2CCCN(C=O)CC2)c1	ZINC000819431165	DD	On-Demand	Anodyne	HRH2	31	42
CCCOc1cccc(CC(=O)N2CCCN(C=O)CC2)c1	ZINC000819431165	DD	On-Demand	Anodyne	BRS3	24	44
CCCOc1cccc(CC(=O)N2CCCN(C=O)CC2)c1	ZINC000819431165	DD	On-Demand	Anodyne	UPP1	58	40
CCCOc1cccc(CC(=O)N2CCCN(C=O)CC2)c1	ZINC000819431165	DD	On-Demand	Anodyne	PLA2G4B	26	40
CCC[C@H](NC(=O)NCc1ccc(F)cc1)C(=O)N1CCCN(C=O)CC1	ZINC000819431168	GD	On-Demand	Anodyne	P2RY12	47	32
CCC[C@H](NC(=O)NCc1ccc(F)cc1)C(=O)N1CCCN(C=O)CC1	ZINC000819431168	GD	On-Demand	Anodyne	DPP7	58	34
O=CN1CCCN(C(=O)c2ccc(-c3nc[nH]n3)cc2)CC1	ZINC000819431179	CC	On-Demand	Anodyne	L3MBTL3	43	36
O=CN1CCCN(C(=O)[C@@H]2C[C@H]3CCCC[C@@H]3N2C(=O)c2ccccc2)CC1	ZINC000819431182	GE	On-Demand	Anodyne	PREP	61	56
O=CN1CCCN(C(=O)[C@@H]2C[C@H]3CCCC[C@H]3N2C(=O)c2ccccc2)CC1	ZINC000819431183	GE	On-Demand	Anodyne	PREP	61	56
O=CN1CCCN(C(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2C(=O)c2ccccc2)CC1	ZINC000819431184	GE	On-Demand	Anodyne	PREP	61	56
O=CN1CCCN(C(=O)[C@@H]2C[C@@H]3CCCC[C@H]3N2C(=O)c2ccccc2)CC1	ZINC000819431185	GE	On-Demand	Anodyne	PREP	61	56
O=CN1CCCN(C(=O)c2[nH]c3ccc(Cl)cc3c2Cl)CC1	ZINC000819431195	EF	On-Demand	Anodyne	HRH4	21	45
O=CN1CCCN(C(=O)CCCc2ccc(F)c(F)c2)CC1	ZINC000819431196	DD	On-Demand	Anodyne	PREP	55	42
Cc1nnc(SCC(=O)Nc2cnccn2)n1Cc1ccccc1	ZINC000819431201	EE	On-Demand	Anodyne	SLC27A1	29	40
COc1cccc(SCC(=O)N2CCCN(C=O)CC2)c1	ZINC000819431202	DD	On-Demand	Anodyne	DRD4	41	32
COc1cccc(SCC(=O)N2CCCN(C=O)CC2)c1	ZINC000819431202	DD	On-Demand	Anodyne	MTNR1A	24	44
COc1cccc(SCC(=O)N2CCCN(C=O)CC2)c1	ZINC000819431202	DD	On-Demand	Anodyne	MTNR1B	38	44
COc1cccc(SCC(=O)N2CCCN(C=O)CC2)c1	ZINC000819431202	DD	On-Demand	Anodyne	FAS	20	43
O=CN1CCCN(C(=O)c2ccc(C(F)(F)F)cc2O)CC1	ZINC000819431208	DD	On-Demand	Anodyne	MLYCD	18	40
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc(SC(C)(C)C)cc1	ZINC000819431236	GI	On-Demand	Anodyne	ADRB2	25	41
COc1cccc(OC)c1OC[C@H](O)CNc1ccc(SC(C)(C)C)cc1	ZINC000819431237	GI	On-Demand	Anodyne	ADRB2	25	41
CCOC(=O)CC[C@@H](O)CNc1cc2sc(C)nc2cc1OC	ZINC000819431246	EF	On-Demand	Anodyne	ACOX1	51	34
CCOC(=O)CC[C@H](O)CNc1cc2sc(C)nc2cc1OC	ZINC000819431247	EF	On-Demand	Anodyne	ACOX1	51	34
CCOC[C@H](O)CNc1cc2sc(C)nc2cc1OC	ZINC000819431273	CE	On-Demand	Anodyne	ACOX1	59	33
O=C(CCc1cccc(OC(F)F)c1)NN1CCCCC1	ZINC000819431274	CF	On-Demand	Anodyne	PLA2G4A	25	41
CO[C@@H](C)c1cccc(NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819431280	CH	On-Demand	Anodyne	ADRB2	19	47
CO[C@@H](C)c1cccc(NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819431282	CH	On-Demand	Anodyne	ADRB2	19	47
Cc1ccc(OC[C@@H](O)CNc2cccc(OCCS(C)(=O)=O)c2)cc1	ZINC000819431317	GE	On-Demand	Anodyne	ADRB2	51	46
Cc1ccc(OC[C@@H](O)CNc2cccc(OCCS(C)(=O)=O)c2)cc1	ZINC000819431317	GE	On-Demand	Anodyne	ADRB1	63	45
Cc1ccc(OC[C@@H](O)CNc2cccc(OCCS(C)(=O)=O)c2)cc1	ZINC000819431317	GE	On-Demand	Anodyne	GRIN1	28	44
Cc1ccc(OC[C@@H](O)CNc2cccc(OCCS(C)(=O)=O)c2)cc1	ZINC000819431317	GE	On-Demand	Anodyne	ADRB3	42	41
Cc1ccc(OC[C@H](O)CNc2cccc(OCCS(C)(=O)=O)c2)cc1	ZINC000819431318	GE	On-Demand	Anodyne	ADRB2	51	46
Cc1ccc(OC[C@H](O)CNc2cccc(OCCS(C)(=O)=O)c2)cc1	ZINC000819431318	GE	On-Demand	Anodyne	ADRB1	63	45
Cc1ccc(OC[C@H](O)CNc2cccc(OCCS(C)(=O)=O)c2)cc1	ZINC000819431318	GE	On-Demand	Anodyne	GRIN1	28	44
Cc1ccc(OC[C@H](O)CNc2cccc(OCCS(C)(=O)=O)c2)cc1	ZINC000819431318	GE	On-Demand	Anodyne	ADRB3	42	41
CC(C)(C)OC(=O)N1CCc2cc(NCC3(O)CCCCC3)ccc21	ZINC000819431331	EI	On-Demand	Anodyne	GPR119	16	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc3c(c2)CCCO3)CC1	ZINC000819431334	GG	On-Demand	Anodyne	GPR119	38	51
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc3c(c2)CCCO3)CC1	ZINC000819431335	GG	On-Demand	Anodyne	GPR119	38	51
O=C(Nc1cc(S(=O)(=O)N2CCCC2)ccc1O)C(F)=C1CCC1	ZINC000819431354	FF	On-Demand	Anodyne	F13A1	23	40
O=C(Nc1cc([N+](=O)[O-])ccc1O)C(F)=C1CCC1	ZINC000819431362	CF	On-Demand	Bother	KCNMA1	29	41
C#CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431384	FG	On-Demand	Mild	PAPA1_CARPA	70	51
C#CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431384	FG	On-Demand	Mild	CCKAR	42	37
C#CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431384	FG	On-Demand	Mild	CTSK	30	45
C#CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431384	FG	On-Demand	Mild	CTSL	27	51
C#CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431384	FG	On-Demand	Mild	CTSS	23	51
C#CC[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431384	FG	On-Demand	Mild	FPR1	52	44
C#CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431385	FG	On-Demand	Mild	PAPA1_CARPA	70	51
C#CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431385	FG	On-Demand	Mild	CCKAR	42	37
C#CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431385	FG	On-Demand	Mild	CTSK	30	45
C#CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431385	FG	On-Demand	Mild	CTSL	27	51
C#CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431385	FG	On-Demand	Mild	CTSS	23	51
C#CC[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431385	FG	On-Demand	Mild	FPR1	52	44
C#CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431386	FG	On-Demand	Mild	PAPA1_CARPA	70	51
C#CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431386	FG	On-Demand	Mild	CCKAR	42	37
C#CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431386	FG	On-Demand	Mild	CTSK	30	45
C#CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431386	FG	On-Demand	Mild	CTSL	27	51
C#CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431386	FG	On-Demand	Mild	CTSS	23	51
C#CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431386	FG	On-Demand	Mild	FPR1	52	44
C#CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431387	FG	On-Demand	Mild	PAPA1_CARPA	70	51
C#CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431387	FG	On-Demand	Mild	CCKAR	42	37
C#CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431387	FG	On-Demand	Mild	CTSK	30	45
C#CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431387	FG	On-Demand	Mild	CTSL	27	51
C#CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431387	FG	On-Demand	Mild	CTSS	23	51
C#CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccccc1	ZINC000819431387	FG	On-Demand	Mild	FPR1	52	44
CC(C)(C)OC(=O)N1CCc2cc(NC[C@](C)(O)C(F)(F)F)ccc21	ZINC000819431389	FH	On-Demand	Anodyne	GPR119	17	43
CC(C)(C)OC(=O)N1CCc2cc(NC[C@@](C)(O)C(F)(F)F)ccc21	ZINC000819431390	FH	On-Demand	Anodyne	GPR119	17	43
CC(C)(C)OC(=O)N1CCc2cc(NC[C@H](O)CC(F)(F)F)ccc21	ZINC000819431391	FH	On-Demand	Anodyne	GPR119	17	42
CC(C)(C)OC(=O)N1CCc2cc(NC[C@@H](O)CC(F)(F)F)ccc21	ZINC000819431392	FH	On-Demand	Anodyne	GPR119	17	42
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431406	FG	On-Demand	Anodyne	ADRB2	36	42
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431406	FG	On-Demand	Anodyne	ADRB1	65	45
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431406	FG	On-Demand	Anodyne	GRIN1	27	42
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431406	FG	On-Demand	Anodyne	ADRB3	45	42
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431407	FG	On-Demand	Anodyne	ADRB2	36	42
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431407	FG	On-Demand	Anodyne	ADRB1	65	45
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431407	FG	On-Demand	Anodyne	GRIN1	27	42
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431407	FG	On-Demand	Anodyne	ADRB3	45	42
O[C@@H](CNc1ccc2c(c1)CCCO2)COc1cccc2[nH]ccc12	ZINC000819431414	EG	On-Demand	Anodyne	ADRB1	18	54
O[C@H](CNc1ccc2c(c1)CCCO2)COc1cccc2[nH]ccc12	ZINC000819431415	EG	On-Demand	Anodyne	ADRB1	18	54
CC(C)(C)OC(=O)N1CCc2cc(NC[C@H](O)c3ccccc3)ccc21	ZINC000819431416	FI	On-Demand	Anodyne	NPY2R	69	35
CC(C)(C)OC(=O)N1CCc2cc(NC[C@H](O)c3ccccc3)ccc21	ZINC000819431416	FI	On-Demand	Anodyne	GPR119	15	42
COc1cccc(C[C@@H](C(=O)N2CCCN(C=O)CC2)n2nnnc2C)c1	ZINC000819431417	FC	On-Demand	Anodyne	TRY2_BOVIN	76	39
COc1cccc(C[C@@H](C(=O)N2CCCN(C=O)CC2)n2nnnc2C)c1	ZINC000819431417	FC	On-Demand	Anodyne	DPP7	18	44
COc1cccc(C[C@H](C(=O)N2CCCN(C=O)CC2)n2nnnc2C)c1	ZINC000819431418	FC	On-Demand	Anodyne	TRY2_BOVIN	76	39
COc1cccc(C[C@H](C(=O)N2CCCN(C=O)CC2)n2nnnc2C)c1	ZINC000819431418	FC	On-Demand	Anodyne	DPP7	18	44
O=CN1CCCN(C(=O)Cn2c(COc3ccc(Cl)cc3)nc3ccccc32)CC1	ZINC000819431423	IF	On-Demand	Anodyne	NPY1R	34	49
C[C@@H](CC(=O)N1CCCN(C=O)CC1)S(=O)(=O)c1ccc(F)cc1	ZINC000819431431	FD	On-Demand	Anodyne	DPP4	17	41
C[C@@H](CC(=O)N1CCCN(C=O)CC1)S(=O)(=O)c1ccc(F)cc1	ZINC000819431431	FD	On-Demand	Anodyne	DPP8	16	41
O=CN1CCCN(C(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)CC1	ZINC000819431432	FC	On-Demand	Anodyne	PREP	67	49
O=CN1CCCN(C(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)CC1	ZINC000819431432	FC	On-Demand	Anodyne	WNT3	43	35
O=CN1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)CC1	ZINC000819431433	FC	On-Demand	Anodyne	PREP	67	49
O=CN1CCCN(C(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)CC1	ZINC000819431433	FC	On-Demand	Anodyne	WNT3	43	35
O=CN1CCCN(C(=O)Cn2nnc(-c3ccccc3)n2)CC1	ZINC000819431440	DC	On-Demand	Anodyne	SCARB1	28	41
O=CN1CCCN(C(=O)c2cc3ccccn3c2)CC1	ZINC000819431455	CD	On-Demand	Anodyne	L3MBTL3	67	38
O=C(Cc1cncnc1)NNC(=S)NCCc1cccs1	ZINC000819431466	DC	On-Demand	Reactive	CA5B	32	41
O=CN1CCCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1	ZINC000819431470	HG	On-Demand	Bother	HRH3	27	44
CCCOc1cc(OC)ccc1C(=O)NNC(=S)NCCc1cccs1	ZINC000819431480	GF	On-Demand	Reactive	MTNR1A	49	42
CCCOc1cc(OC)ccc1C(=O)NNC(=S)NCCc1cccs1	ZINC000819431480	GF	On-Demand	Reactive	MTNR1B	38	42
O=CN1CCCN(C(=O)c2cccc(NC(=O)Cc3ccc(Br)cc3)c2)CC1	ZINC000819431497	IF	On-Demand	Anodyne	NPY2R	18	48
O=C(NNC(=S)NCCc1cccs1)[C@H]1CCCN(C(=O)Nc2ccccc2F)C1	ZINC000819431503	IF	On-Demand	Reactive	DPP7	35	41
O=C(NNC(=S)NCCc1cccs1)[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1	ZINC000819431504	IF	On-Demand	Reactive	DPP7	35	41
O=CN1CCCN(C(=O)CCCCCNC(=O)NC2CCCCC2)CC1	ZINC000819431511	FD	On-Demand	Anodyne	EPHX2	23	53
O=CN1CCCN(C(=O)c2ccc(C(=O)c3cccc(O)c3)cc2)CC1	ZINC000819431512	FD	On-Demand	Anodyne	HSD17B1	23	40
O=CN1CCCN(C(=O)c2ccc(C(=O)c3cccc(O)c3)cc2)CC1	ZINC000819431512	FD	On-Demand	Anodyne	HSD17B2	26	40
O=CN1CCCN(C(=O)c2ccc(C(=O)c3cccc(O)c3)cc2)CC1	ZINC000819431512	FD	On-Demand	Anodyne	L3MBTL3	55	37
O=C(CSc1ccc(O)cc1)Nc1cnccn1	ZINC000819431513	CD	On-Demand	Anodyne	FAS	62	37
Cc1ccc(NC[C@H](O)c2cccnc2)cc1OCC(F)F	ZINC000819431523	DG	On-Demand	Anodyne	ADRB2	28	40
Cc1ccc(NC[C@H](O)c2cccnc2)cc1OCC(F)F	ZINC000819431523	DG	On-Demand	Anodyne	ADRB1	29	40
Cc1ccc(NC[C@H](O)c2cccnc2)cc1OCC(F)F	ZINC000819431523	DG	On-Demand	Anodyne	ADRB3	90	43
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1OCC(F)F	ZINC000819431524	DG	On-Demand	Anodyne	ADRB2	28	40
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1OCC(F)F	ZINC000819431524	DG	On-Demand	Anodyne	ADRB1	29	40
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1OCC(F)F	ZINC000819431524	DG	On-Demand	Anodyne	ADRB3	90	43
COCCc1ccc(OC[C@@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819431531	EG	On-Demand	Anodyne	ADRB2	44	60
COCCc1ccc(OC[C@@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819431531	EG	On-Demand	Anodyne	ADRB1	56	60
COCCc1ccc(OC[C@@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819431531	EG	On-Demand	Anodyne	GRIN1	17	43
COCCc1ccc(OC[C@@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819431531	EG	On-Demand	Anodyne	ADRB3	37	49
COCCc1ccc(OC[C@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819431532	EG	On-Demand	Anodyne	ADRB2	44	60
COCCc1ccc(OC[C@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819431532	EG	On-Demand	Anodyne	ADRB1	56	60
COCCc1ccc(OC[C@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819431532	EG	On-Demand	Anodyne	GRIN1	17	43
COCCc1ccc(OC[C@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819431532	EG	On-Demand	Anodyne	ADRB3	37	49
CO[C@@H](C)c1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819431557	CH	On-Demand	Anodyne	ADRB2	30	45
CO[C@@H](C)c1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819431557	CH	On-Demand	Anodyne	ADRB3	51	37
CO[C@@H](C)c1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819431557	CH	On-Demand	Anodyne	AOC3	27	43
CO[C@@H](C)c1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819431558	CH	On-Demand	Anodyne	ADRB2	30	45
CO[C@@H](C)c1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819431558	CH	On-Demand	Anodyne	ADRB3	51	37
CO[C@@H](C)c1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819431558	CH	On-Demand	Anodyne	AOC3	27	43
CC[C@H](O)CNc1cc2sc(C)nc2cc1OC	ZINC000819431603	CF	On-Demand	Anodyne	ACOX1	58	32
C#CCNC(=O)CCNc1ccc(CN2CCc3ccccc32)cc1	ZINC000819431609	EF	On-Demand	Mild	AVPR2	27	41
C#CCNC(=O)CCNc1ccc(CN2CCc3ccccc32)cc1	ZINC000819431609	EF	On-Demand	Mild	NOD2	41	34
CC(C)(C)OC(=O)N1CCc2cc(NC[C@@H](O)c3ccccc3)ccc21	ZINC000819431617	FI	On-Demand	Anodyne	NPY2R	69	35
CC(C)(C)OC(=O)N1CCc2cc(NC[C@@H](O)c3ccccc3)ccc21	ZINC000819431617	FI	On-Demand	Anodyne	GPR119	15	42
C[C@@H](CNc1ccc2c(c1)CCN2C(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000819431625	FF	On-Demand	Anodyne	GPR119	29	51
CC(C)(C)OC(=O)N1CCc2cc(NC[C@H](O)c3cc(F)ccc3F)ccc21	ZINC000819431649	GI	On-Demand	Anodyne	EIF2AK3	25	40
CC(C)(C)OC(=O)N1CCc2cc(NC[C@@H](O)c3cc(F)ccc3F)ccc21	ZINC000819431650	GI	On-Demand	Anodyne	EIF2AK3	25	40
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431677	FF	On-Demand	Anodyne	ADRB2	32	43
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431677	FF	On-Demand	Anodyne	ADRB1	53	43
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431677	FF	On-Demand	Anodyne	GRIN1	20	41
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431677	FF	On-Demand	Anodyne	ADRB3	33	43
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431678	FF	On-Demand	Anodyne	ADRB2	32	43
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431678	FF	On-Demand	Anodyne	ADRB1	53	43
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431678	FF	On-Demand	Anodyne	GRIN1	20	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431678	FF	On-Demand	Anodyne	ADRB3	33	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431707	EG	On-Demand	Anodyne	ADRB2	21	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431707	EG	On-Demand	Anodyne	ADRB1	45	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431708	EG	On-Demand	Anodyne	ADRB2	21	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCCO3)cc1	ZINC000819431708	EG	On-Demand	Anodyne	ADRB1	45	43
O[C@@H](CNc1ccc2c(c1)CCCO2)c1cccc(Cl)c1	ZINC000819431718	DH	On-Demand	Anodyne	ADRB1	24	42
O[C@@H](CNc1ccc2c(c1)CCCO2)c1cccc(Cl)c1	ZINC000819431718	DH	On-Demand	Anodyne	ADRB3	37	44
O=C(CN1CCN(Cc2ccccc2)CC1)NNC(=S)NCCc1cccs1	ZINC000819431720	HD	On-Demand	Reactive	ACHE	19	41
O=C(CN1CCN(Cc2ccccc2)CC1)NNC(=S)NCCc1cccs1	ZINC000819431720	HD	On-Demand	Reactive	SIGMAR1	35	50
O[C@H](CNc1ccc2c(c1)CCCO2)c1cccc(Cl)c1	ZINC000819431722	DH	On-Demand	Anodyne	ADRB1	24	42
O[C@H](CNc1ccc2c(c1)CCCO2)c1cccc(Cl)c1	ZINC000819431722	DH	On-Demand	Anodyne	ADRB3	37	44
COC(=O)c1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1O	ZINC000819431730	GF	On-Demand	Mild	PAPA1_CARPA	47	46
CS(=O)(=O)c1ccc(Oc2ccc(NC[C@@H](O)C3CC3)cc2)cc1	ZINC000819431738	EG	On-Demand	Anodyne	MMP2	26	40
CS(=O)(=O)c1ccc(Oc2ccc(NC[C@@H](O)C3CC3)cc2)cc1	ZINC000819431738	EG	On-Demand	Anodyne	MMP14	25	40
CS(=O)(=O)c1ccc(Oc2ccc(NC[C@@H](O)C3CC3)cc2)cc1	ZINC000819431738	EG	On-Demand	Anodyne	MMP9	21	40
CS(=O)(=O)c1ccc(Oc2ccc(NC[C@H](O)C3CC3)cc2)cc1	ZINC000819431739	EG	On-Demand	Anodyne	MMP2	26	40
CS(=O)(=O)c1ccc(Oc2ccc(NC[C@H](O)C3CC3)cc2)cc1	ZINC000819431739	EG	On-Demand	Anodyne	MMP14	25	40
CS(=O)(=O)c1ccc(Oc2ccc(NC[C@H](O)C3CC3)cc2)cc1	ZINC000819431739	EG	On-Demand	Anodyne	MMP9	21	40
COC(=O)c1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1O	ZINC000819431743	GF	On-Demand	Mild	PAPA1_CARPA	47	46
O[C@@H](CNc1ccc2c(ccn2CCN2CCOCC2)c1)c1ccc(F)cn1	ZINC000819431752	GF	On-Demand	Anodyne	STAT6	44	33
O[C@H](CNc1ccc2c(ccn2CCN2CCOCC2)c1)c1ccc(F)cn1	ZINC000819431755	GF	On-Demand	Anodyne	STAT6	44	33
Cn1cc(Oc2ccccc2C(=O)NNC(=S)NCCc2cccs2)cn1	ZINC000819431760	HF	On-Demand	Reactive	HCN1	56	33
C/C(=C/C(=O)N1CCCN(C=O)CC1)c1cccc(C(F)(F)F)c1	ZINC000819431812	EF	On-Demand	Anodyne	ITGAL	40	33
C/C(=C/C(=O)N1CCCN(C=O)CC1)c1cccc(C(F)(F)F)c1	ZINC000819431812	EF	On-Demand	Anodyne	CCR2	45	39
NC(=O)c1cc(N2CCOCC2)ccc1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819431824	ED	On-Demand	Anodyne	STAT6	53	33
NC(=O)c1cc(N2CCOCC2)ccc1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819431827	ED	On-Demand	Anodyne	STAT6	53	33
NC(=O)c1cc(N2CCOCC2)ccc1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819431829	ED	On-Demand	Anodyne	STAT6	53	33
NC(=O)c1cc(N2CCOCC2)ccc1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819431831	ED	On-Demand	Anodyne	STAT6	53	33
C#CCNC(=O)CCNc1ccc(CC(=O)N2CCCc3ccccc32)cc1	ZINC000819431834	GF	On-Demand	Mild	AVPR2	43	47
CN(C[C@@H](O)CNc1cccc(NC(=O)c2ccoc2)c1)C(=O)OC(C)(C)C	ZINC000819431836	GG	On-Demand	Anodyne	KCNK3	102	49
CN(C[C@@H](O)CNc1cccc(NC(=O)c2ccoc2)c1)C(=O)OC(C)(C)C	ZINC000819431836	GG	On-Demand	Anodyne	KCNK9	73	33
CN(C[C@H](O)CNc1cccc(NC(=O)c2ccoc2)c1)C(=O)OC(C)(C)C	ZINC000819431839	GG	On-Demand	Anodyne	KCNK3	102	49
CN(C[C@H](O)CNc1cccc(NC(=O)c2ccoc2)c1)C(=O)OC(C)(C)C	ZINC000819431839	GG	On-Demand	Anodyne	KCNK9	73	33
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@H]1c1n[nH]c(-c2ccccc2)n1	ZINC000819431848	EF	On-Demand	Anodyne	CPT1A	81	36
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@@H]1c1n[nH]c(-c2ccccc2)n1	ZINC000819431851	EF	On-Demand	Anodyne	CPT1A	81	36
O=C(/C=C\[C@@H]1CCCO1)N1CCC[C@H]1c1n[nH]c(-c2ccccc2)n1	ZINC000819431852	EF	On-Demand	Anodyne	CPT1A	81	36
O=C(/C=C/[C@@H]1CCCO1)N1CCC[C@@H]1c1n[nH]c(-c2ccccc2)n1	ZINC000819431853	EF	On-Demand	Anodyne	CPT1A	81	36
CN1CCN(c2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2Cl)CC1	ZINC000819431856	GG	On-Demand	Anodyne	ADRB1	41	37
CN1CCN(c2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2Cl)CC1	ZINC000819431856	GG	On-Demand	Anodyne	GRIN1	25	40
CN1CCN(c2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2Cl)CC1	ZINC000819431856	GG	On-Demand	Anodyne	NPY2R	53	44
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819431882	EG	On-Demand	Anodyne	ADRB2	35	46
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819431882	EG	On-Demand	Anodyne	ADRB1	29	42
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819431883	EG	On-Demand	Anodyne	ADRB2	35	46
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)cc2C)cc1	ZINC000819431883	EG	On-Demand	Anodyne	ADRB1	29	42
CO[C@@H](C)c1cccc(NC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819431888	FI	On-Demand	Anodyne	ADRB2	15	48
CO[C@@H](C)c1cccc(NC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819431893	FI	On-Demand	Anodyne	ADRB2	15	48
CON(C)C(=O)CCNc1ccc(CN2CCc3ccccc32)cc1	ZINC000819431910	EG	On-Demand	Anodyne	NOD2	44	38
CC(=O)N1CCCc2cc(NC[C@H](O)c3cccc(Cl)c3)ccc21	ZINC000819431920	EH	On-Demand	Anodyne	ADRB1	31	45
CC(=O)N1CCCc2cc(NC[C@H](O)c3cccc(Cl)c3)ccc21	ZINC000819431920	EH	On-Demand	Anodyne	AVPR2	21	47
CC(=O)N1CCCc2cc(NC[C@H](O)c3cccc(Cl)c3)ccc21	ZINC000819431920	EH	On-Demand	Anodyne	ADRB3	48	44
CC(=O)N1CCCc2cc(NC[C@H](O)c3cccc(Cl)c3)ccc21	ZINC000819431920	EH	On-Demand	Anodyne	HSD17B3	54	39
CC(=O)N1CCCc2cc(NC[C@H](O)c3cccc(Cl)c3)ccc21	ZINC000819431920	EH	On-Demand	Anodyne	CYP3A4	46	35
CC(=O)N1CCCc2cc(NC[C@@H](O)c3cccc(Cl)c3)ccc21	ZINC000819431924	EH	On-Demand	Anodyne	ADRB1	31	45
CC(=O)N1CCCc2cc(NC[C@@H](O)c3cccc(Cl)c3)ccc21	ZINC000819431924	EH	On-Demand	Anodyne	AVPR2	21	47
CC(=O)N1CCCc2cc(NC[C@@H](O)c3cccc(Cl)c3)ccc21	ZINC000819431924	EH	On-Demand	Anodyne	ADRB3	48	44
CC(=O)N1CCCc2cc(NC[C@@H](O)c3cccc(Cl)c3)ccc21	ZINC000819431924	EH	On-Demand	Anodyne	HSD17B3	54	39
CC(=O)N1CCCc2cc(NC[C@@H](O)c3cccc(Cl)c3)ccc21	ZINC000819431924	EH	On-Demand	Anodyne	CYP3A4	46	35
CN1CCN(c2ccc(NC[C@H](O)c3ccc(F)cn3)cc2Cl)CC1	ZINC000819431933	FF	On-Demand	Anodyne	NPY2R	56	42
CN1CCN(c2ccc(NC[C@H](O)c3ccc(F)cn3)cc2Cl)CC1	ZINC000819431933	FF	On-Demand	Anodyne	PAK1	41	36
O=CN1CCCN(C(=O)[C@H]2CCCN(C(=O)Nc3ccccc3)C2)CC1	ZINC000819431942	FD	On-Demand	Anodyne	SLC6A1	62	33
O=CN1CCCN(C(=O)[C@H]2CCCN(C(=O)Nc3ccccc3)C2)CC1	ZINC000819431942	FD	On-Demand	Anodyne	PREP	53	39
O=CN1CCCN(C(=O)[C@H]2CCCN(C(=O)Nc3ccccc3)C2)CC1	ZINC000819431942	FD	On-Demand	Anodyne	EPHX2	15	41
O=CN1CCCN(C(=O)[C@@H]2CCCN(C(=O)Nc3ccccc3)C2)CC1	ZINC000819431943	FD	On-Demand	Anodyne	SLC6A1	62	33
O=CN1CCCN(C(=O)[C@@H]2CCCN(C(=O)Nc3ccccc3)C2)CC1	ZINC000819431943	FD	On-Demand	Anodyne	PREP	53	39
O=CN1CCCN(C(=O)[C@@H]2CCCN(C(=O)Nc3ccccc3)C2)CC1	ZINC000819431943	FD	On-Demand	Anodyne	EPHX2	15	41
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccc(OC(F)(F)F)cc3)ccc21	ZINC000819431948	GI	On-Demand	Anodyne	P2RY1	45	40
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccc(OC(F)(F)F)cc3)ccc21	ZINC000819431948	GI	On-Demand	Anodyne	EPHX2	42	36
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccc(OC(F)(F)F)cc3)ccc21	ZINC000819431951	GI	On-Demand	Anodyne	P2RY1	45	40
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccc(OC(F)(F)F)cc3)ccc21	ZINC000819431951	GI	On-Demand	Anodyne	EPHX2	42	36
CON(C)C(=O)CCNc1cccc(NC(=O)c2ccoc2)c1	ZINC000819431963	DE	On-Demand	Anodyne	KCNK3	119	55
CON(C)C(=O)CCNc1cccc(NC(=O)c2ccoc2)c1	ZINC000819431963	DE	On-Demand	Anodyne	KCNK9	81	37
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccccc3F)ccc21	ZINC000819431972	EG	On-Demand	Anodyne	HSD17B3	50	42
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccccc3F)ccc21	ZINC000819431973	EG	On-Demand	Anodyne	HSD17B3	50	42
CC(=O)N1CCCc2cc(NC[C@](C)(O)CNC(=O)OC(C)(C)C)ccc21	ZINC000819431975	GF	On-Demand	Anodyne	AVPR2	22	40
O=CN1CCCN(C(=O)c2sccc2S(=O)(=O)N2CCc3ccccc3C2)CC1	ZINC000819431976	ID	On-Demand	Anodyne	AKR1C3	56	42
CC(=O)N1CCCc2cc(NC[C@@](C)(O)CNC(=O)OC(C)(C)C)ccc21	ZINC000819431977	GF	On-Demand	Anodyne	AVPR2	22	40
CNC(=O)COc1cccc(CC(=O)N2CCCN(C=O)CC2)c1	ZINC000819431992	EC	On-Demand	Anodyne	UPP1	56	33
O=CN1CCCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CC1	ZINC000819432019	ED	On-Demand	Anodyne	DRD4	15	41
O=CN1CCCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CC1	ZINC000819432019	ED	On-Demand	Anodyne	SLC6A1	147	43
O=CN1CCCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CC1	ZINC000819432019	ED	On-Demand	Anodyne	SIGMAR1	22	46
O=CN1CCCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CC1	ZINC000819432019	ED	On-Demand	Anodyne	CCR3	36	45
O=CN1CCCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CC1	ZINC000819432019	ED	On-Demand	Anodyne	PREP	47	36
O=CN1CCCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CC1	ZINC000819432019	ED	On-Demand	Anodyne	MLNR	42	41
O=CN1CCCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CC1	ZINC000819432019	ED	On-Demand	Anodyne	CACNA1G	21	41
O=CN1CCCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CC1	ZINC000819432020	ED	On-Demand	Anodyne	DRD4	15	41
O=CN1CCCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CC1	ZINC000819432020	ED	On-Demand	Anodyne	SLC6A1	147	43
O=CN1CCCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CC1	ZINC000819432020	ED	On-Demand	Anodyne	SIGMAR1	22	46
O=CN1CCCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CC1	ZINC000819432020	ED	On-Demand	Anodyne	CCR3	36	45
O=CN1CCCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CC1	ZINC000819432020	ED	On-Demand	Anodyne	PREP	47	36
O=CN1CCCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CC1	ZINC000819432020	ED	On-Demand	Anodyne	MLNR	42	41
O=CN1CCCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CC1	ZINC000819432020	ED	On-Demand	Anodyne	CACNA1G	21	41
O=CN1CCCN(C(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccccc2Cl)CC1	ZINC000819432021	IF	On-Demand	Anodyne	PREP	64	52
O=CN1CCCN(C(=O)[C@@H]2Cc3ccccc3CN2C(=O)c2ccccc2Cl)CC1	ZINC000819432021	IF	On-Demand	Anodyne	CFTR	30	40
O=CN1CCCN(C(=O)[C@H]2Cc3ccccc3CN2C(=O)c2ccccc2Cl)CC1	ZINC000819432022	IF	On-Demand	Anodyne	PREP	64	52
O=CN1CCCN(C(=O)[C@H]2Cc3ccccc3CN2C(=O)c2ccccc2Cl)CC1	ZINC000819432022	IF	On-Demand	Anodyne	CFTR	30	40
CCCC[C@@H](NC(=O)NCC)C(=O)N1CCCN(C=O)CC1	ZINC000819432076	DC	On-Demand	Anodyne	P2RY12	75	33
CCCC[C@@H](NC(=O)NCC)C(=O)N1CCCN(C=O)CC1	ZINC000819432076	DC	On-Demand	Anodyne	NOD1	42	34
CCCC[C@H](NC(=O)NCC)C(=O)N1CCCN(C=O)CC1	ZINC000819432078	DC	On-Demand	Anodyne	P2RY12	75	33
CCCC[C@H](NC(=O)NCC)C(=O)N1CCCN(C=O)CC1	ZINC000819432078	DC	On-Demand	Anodyne	NOD1	42	34
O=CN1CCCN(C(=O)[C@@H]2CSCN2C(=O)c2c[nH]c3ccccc23)CC1	ZINC000819432092	GD	On-Demand	Anodyne	PREP	36	45
O=CN1CCCN(C(=O)[C@H]2CSCN2C(=O)c2c[nH]c3ccccc23)CC1	ZINC000819432094	GD	On-Demand	Anodyne	PREP	36	45
Cc1ccc(C[C@@H](C)C(=O)N2CCCN(C=O)CC2)cc1	ZINC000819432116	CD	On-Demand	Anodyne	MME	16	40
Cc1ccc(C[C@@H](C)C(=O)N2CCCN(C=O)CC2)cc1	ZINC000819432116	CD	On-Demand	Anodyne	MC4R	31	46
Cc1ccc(C[C@@H](C)C(=O)N2CCCN(C=O)CC2)cc1	ZINC000819432116	CD	On-Demand	Anodyne	DPP7	43	33
O=CN1CCCN(C(=O)[C@H]2Cc3ccccc3CN2S(=O)(=O)c2cccs2)CC1	ZINC000819432125	ID	On-Demand	Anodyne	PREP	41	50
O=CN1CCCN(C(=O)[C@H]2Cc3ccccc3CN2S(=O)(=O)c2cccs2)CC1	ZINC000819432125	ID	On-Demand	Anodyne	MMP8	27	43
O=CN1CCCN(C(=O)[C@@H]2Cc3ccccc3CN2S(=O)(=O)c2cccs2)CC1	ZINC000819432127	ID	On-Demand	Anodyne	PREP	41	50
O=CN1CCCN(C(=O)[C@@H]2Cc3ccccc3CN2S(=O)(=O)c2cccs2)CC1	ZINC000819432127	ID	On-Demand	Anodyne	MMP8	27	43
O=CN1CCCN(C(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)CC1	ZINC000819432128	GG	On-Demand	Anodyne	NPSR1	15	41
O=CN1CCCN(C(=O)c2ccc(CO)c(F)c2)CC1	ZINC000819432129	CC	On-Demand	Anodyne	L3MBTL3	48	34
O=C1CCCCN1Cc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819432132	EF	On-Demand	Anodyne	ADRB2	23	41
O=C1CCCCN1Cc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819432132	EF	On-Demand	Anodyne	ADRB3	93	45
O=C1CCCCN1Cc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819432133	EF	On-Demand	Anodyne	ADRB2	23	41
O=C1CCCCN1Cc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819432133	EF	On-Demand	Anodyne	ADRB3	93	45
CN1CCN(c2ccc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cc2Cl)CC1	ZINC000819432136	GG	On-Demand	Bother	NPY2R	53	38
CN1CCN(c2ccc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cc2Cl)CC1	ZINC000819432136	GG	On-Demand	Bother	WDR5	40	46
O=CN1CCCN(C(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)CC1	ZINC000819432138	EC	On-Demand	Anodyne	LIPE	22	42
O=CN1CCCN(C(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)CC1	ZINC000819432138	EC	On-Demand	Anodyne	SCARB1	26	42
NC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(F)=C1CCC1	ZINC000819432150	ED	On-Demand	Anodyne	MAPK9	32	41
NC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(F)=C1CCC1	ZINC000819432150	ED	On-Demand	Anodyne	MAPK10	35	41
NC(=O)c1cc(N2CCOCC2)ccc1NC(=O)C(F)=C1CCC1	ZINC000819432150	ED	On-Demand	Anodyne	STAT6	58	36
CN1CCN(c2ccc(NC[C@H](O)CN(C)CCC#N)cc2Cl)CC1	ZINC000819432167	FD	On-Demand	Mild	PAK1	41	36
O=CN1CCCN(C(=O)CCNC(=O)NC23CC4CC(CC(C4)C2)C3)CC1	ZINC000819432169	GD	On-Demand	Anodyne	EPHX2	93	50
NC(=O)NC(=O)CCNc1ccc(OCC2CCCCC2)cc1	ZINC000819432172	DF	On-Demand	Anodyne	HPGD	15	40
O=CN1CCCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccco2)CC1	ZINC000819432176	EC	On-Demand	Anodyne	CPT2	43	37
O=CN1CCCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccco2)CC1	ZINC000819432176	EC	On-Demand	Anodyne	PREP	125	52
O=CN1CCCN(C(=O)[C@@H]2CCCCN2C(=O)c2ccco2)CC1	ZINC000819432176	EC	On-Demand	Anodyne	WNT3	41	33
O=CN1CCCN(C(=O)[C@H]2CCCCN2C(=O)c2ccco2)CC1	ZINC000819432177	EC	On-Demand	Anodyne	CPT2	43	37
O=CN1CCCN(C(=O)[C@H]2CCCCN2C(=O)c2ccco2)CC1	ZINC000819432177	EC	On-Demand	Anodyne	PREP	125	52
O=CN1CCCN(C(=O)[C@H]2CCCCN2C(=O)c2ccco2)CC1	ZINC000819432177	EC	On-Demand	Anodyne	WNT3	41	33
O[C@@H](CNc1ccc(OCC2CCCCC2)cc1)c1cccnc1	ZINC000819432191	EI	On-Demand	Anodyne	ADRB2	25	42
O[C@@H](CNc1ccc(OCC2CCCCC2)cc1)c1cccnc1	ZINC000819432191	EI	On-Demand	Anodyne	ADRB1	34	47
O[C@@H](CNc1ccc(OCC2CCCCC2)cc1)c1cccnc1	ZINC000819432191	EI	On-Demand	Anodyne	ADRB3	92	49
O[C@H](CNc1ccc(OCC2CCCCC2)cc1)c1cccnc1	ZINC000819432193	EI	On-Demand	Anodyne	ADRB2	25	42
O[C@H](CNc1ccc(OCC2CCCCC2)cc1)c1cccnc1	ZINC000819432193	EI	On-Demand	Anodyne	ADRB1	34	47
O[C@H](CNc1ccc(OCC2CCCCC2)cc1)c1cccnc1	ZINC000819432193	EI	On-Demand	Anodyne	ADRB3	92	49
CCOC[C@H](O)CNc1ccc(N2CCN(C)CC2)c(Cl)c1	ZINC000819432200	ED	On-Demand	Anodyne	NPY2R	50	38
CC[C@@H](C(=O)N1CCCN(C=O)CC1)n1nnc(-c2ccc(Cl)cc2)n1	ZINC000819432220	GD	On-Demand	Anodyne	LIPE	19	41
CC[C@H](C(=O)N1CCCN(C=O)CC1)n1nnc(-c2ccc(Cl)cc2)n1	ZINC000819432221	GD	On-Demand	Anodyne	LIPE	19	41
O=CN1CCCN(C(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1	ZINC000819432225	GD	On-Demand	Anodyne	TGM2	65	46
O=CN1CCCN(C(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1	ZINC000819432225	GD	On-Demand	Anodyne	F13A1	73	46
O=CN1CCCN(C(=O)Cc2ccc(S(=O)(=O)N3CCCCC3)cc2)CC1	ZINC000819432225	GD	On-Demand	Anodyne	NAMPT	31	44
O=CN1CCCN(C(=O)CNC(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819432232	FD	On-Demand	Anodyne	MTTP	30	40
O=CN1CCCN(C(=O)CNC(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819432232	FD	On-Demand	Anodyne	CCR2	51	40
O=CN1CCCN(C(=O)CNC(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000819432232	FD	On-Demand	Anodyne	EPHX2	16	56
O=CN1CCCN(C(=O)c2ccccc2NS(=O)(=O)c2ccc3c(c2)OCCO3)CC1	ZINC000819432249	ID	On-Demand	Anodyne	PRTN3	51	32
O=CN1CCCN(C(=O)c2ccccc2NS(=O)(=O)c2ccc3c(c2)OCCO3)CC1	ZINC000819432249	ID	On-Demand	Anodyne	PKM	36	41
CN1CCN(c2ccc(NC[C@H](O)c3cccnc3)cc2Cl)CC1	ZINC000819432259	EF	On-Demand	Anodyne	ADRB3	81	49
CN1CCN(c2ccc(NC[C@H](O)c3cccnc3)cc2Cl)CC1	ZINC000819432259	EF	On-Demand	Anodyne	NPY2R	67	38
CN1CCN(c2ccc(NC[C@H](O)c3cccnc3)cc2Cl)CC1	ZINC000819432259	EF	On-Demand	Anodyne	PAK1	42	37
CON(C)C(=O)CCNc1ccc(CC(=O)N2CCc3ccccc32)cc1	ZINC000819432262	FF	On-Demand	Anodyne	AVPR2	42	40
CON(C)C(=O)CCNc1ccc(CC(=O)N2CCc3ccccc32)cc1	ZINC000819432262	FF	On-Demand	Anodyne	EIF2AK3	50	34
CN1CCN(c2ccc(NC[C@H](O)c3cc(F)ccc3F)cc2Cl)CC1	ZINC000819432263	GH	On-Demand	Anodyne	NPY2R	59	43
CN1CCN(c2ccc(NC[C@H](O)c3cc(F)ccc3F)cc2Cl)CC1	ZINC000819432263	GH	On-Demand	Anodyne	WDR5	26	40
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccccc3)ccc21	ZINC000819432265	DG	On-Demand	Anodyne	AVPR2	30	42
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccccc3)ccc21	ZINC000819432265	DG	On-Demand	Anodyne	NPY2R	57	35
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccccc3)ccc21	ZINC000819432265	DG	On-Demand	Anodyne	HSD17B3	54	47
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccccc3)ccc21	ZINC000819432266	DG	On-Demand	Anodyne	AVPR2	30	42
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccccc3)ccc21	ZINC000819432266	DG	On-Demand	Anodyne	NPY2R	57	35
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccccc3)ccc21	ZINC000819432266	DG	On-Demand	Anodyne	HSD17B3	54	47
C=CCCn1cc(C(=O)Nc2ccc(N3CCOCC3)cc2C(N)=O)nn1	ZINC000819432274	FD	On-Demand	Mild	STAT6	58	35
CN1CCN(c2ccc(NC[C@H](O)COc3ccccc3F)cc2Cl)CC1	ZINC000819432275	GG	On-Demand	Anodyne	ADRB2	19	41
CN1CCN(c2ccc(NC[C@H](O)COc3ccccc3F)cc2Cl)CC1	ZINC000819432275	GG	On-Demand	Anodyne	NPY2R	92	43
CN1CCN(c2ccc(NC[C@H](O)COc3ccccc3F)cc2Cl)CC1	ZINC000819432275	GG	On-Demand	Anodyne	PAK1	42	37
CN1CCN(c2ccc(NC[C@H](O)c3ccc([N+](=O)[O-])cc3)cc2Cl)CC1	ZINC000819432277	GG	On-Demand	Bother	NPY2R	49	37
CN1CCN(c2ccc(NC[C@H](O)c3ccc([N+](=O)[O-])cc3)cc2Cl)CC1	ZINC000819432277	GG	On-Demand	Bother	WDR5	43	49
CN1CCN(c2ccc(NC[C@H](O)Cc3ccccc3)cc2Cl)CC1	ZINC000819432291	FG	On-Demand	Anodyne	DRD1	45	37
CN1CCN(c2ccc(NC[C@H](O)Cc3ccccc3)cc2Cl)CC1	ZINC000819432291	FG	On-Demand	Anodyne	NPY2R	88	49
CN1CCN(c2ccc(NC[C@H](O)Cc3ccccc3)cc2Cl)CC1	ZINC000819432291	FG	On-Demand	Anodyne	PAK1	40	37
CN1CCN(c2ccc(NC[C@H](O)COC3CCOCC3)cc2Cl)CC1	ZINC000819432293	GE	On-Demand	Anodyne	NPY2R	43	37
CCCOc1nc2ccccc2cc1/C=C/C(=O)N1CCCN(C=O)CC1	ZINC000819432315	FF	On-Demand	Anodyne	ITGAL	43	32
CCCOc1nc2ccccc2cc1/C=C\C(=O)N1CCCN(C=O)CC1	ZINC000819432316	FF	On-Demand	Anodyne	ITGAL	43	32
O=CN1CCCN(C(=O)c2coc3ccccc23)CC1	ZINC000819432317	CD	On-Demand	Anodyne	INHA	49	32
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1ccoc1	ZINC000819432349	CF	On-Demand	Anodyne	KCNK3	107	60
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1ccoc1	ZINC000819432349	CF	On-Demand	Anodyne	KCNK9	63	37
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1ccoc1	ZINC000819432351	CF	On-Demand	Anodyne	KCNK3	107	60
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1ccoc1	ZINC000819432351	CF	On-Demand	Anodyne	KCNK9	63	37
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccc(Cl)cc3)ccc21	ZINC000819432353	EH	On-Demand	Anodyne	AVPR2	16	47
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccc(Cl)cc3)ccc21	ZINC000819432353	EH	On-Demand	Anodyne	HSD17B3	47	38
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccccc3Br)ccc21	ZINC000819432354	GH	On-Demand	Anodyne	HSD17B3	47	34
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccccc3Br)ccc21	ZINC000819432356	GH	On-Demand	Anodyne	HSD17B3	47	34
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc(NC(=O)c2ccoc2)c1	ZINC000819432361	GG	On-Demand	Anodyne	KCNK3	103	50
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc(NC(=O)c2ccoc2)c1	ZINC000819432361	GG	On-Demand	Anodyne	KCNK9	73	34
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc(NC(=O)c2ccoc2)c1	ZINC000819432362	GG	On-Demand	Anodyne	KCNK3	103	50
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc(NC(=O)c2ccoc2)c1	ZINC000819432362	GG	On-Demand	Anodyne	KCNK9	73	34
CON(C)C(=O)CCNc1ccc(Oc2ccncc2)cc1	ZINC000819432387	DF	On-Demand	Anodyne	RAF1	15	43
CC(=O)N1CCCc2cc(NC[C@@H](O)c3c(F)cccc3F)ccc21	ZINC000819432416	EG	On-Demand	Anodyne	AVPR2	22	40
CC(=O)N1CCCc2cc(NC[C@@H](O)c3c(F)cccc3F)ccc21	ZINC000819432416	EG	On-Demand	Anodyne	HSD17B3	49	40
CC(=O)N1CCCc2cc(NC[C@H](O)c3c(F)cccc3F)ccc21	ZINC000819432417	EG	On-Demand	Anodyne	AVPR2	22	40
CC(=O)N1CCCc2cc(NC[C@H](O)c3c(F)cccc3F)ccc21	ZINC000819432417	EG	On-Demand	Anodyne	HSD17B3	49	40
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccccc3Cl)ccc21	ZINC000819432418	EH	On-Demand	Anodyne	AVPR2	38	46
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccccc3Cl)ccc21	ZINC000819432418	EH	On-Demand	Anodyne	HSD17B3	55	42
NC(=O)c1cc(N2CCOCC2)ccc1NC(=O)Cc1nsc2ccccc12	ZINC000819432423	GE	On-Demand	Anodyne	PRKDC	86	37
NC(=O)c1cc(N2CCOCC2)ccc1NC(=O)Cc1nsc2ccccc12	ZINC000819432423	GE	On-Demand	Anodyne	MAPK9	34	41
NC(=O)c1cc(N2CCOCC2)ccc1NC(=O)Cc1nsc2ccccc12	ZINC000819432423	GE	On-Demand	Anodyne	MAPK10	37	41
NC(=O)c1cc(N2CCOCC2)ccc1NC(=O)Cc1nsc2ccccc12	ZINC000819432423	GE	On-Demand	Anodyne	STAT6	68	37
O[C@@H](CNc1ccc(OCC2CCCCC2)cc1)CN1CCOCC1	ZINC000819432424	EF	On-Demand	Anodyne	CTSS	21	41
O[C@H](CNc1ccc(OCC2CCCCC2)cc1)CN1CCOCC1	ZINC000819432426	EF	On-Demand	Anodyne	CTSS	21	41
CN1CCN(c2ccc(NC[C@H](O)c3ccccc3F)cc2Cl)CC1	ZINC000819432429	FG	On-Demand	Anodyne	DRD1	54	38
CN1CCN(c2ccc(NC[C@H](O)c3ccccc3F)cc2Cl)CC1	ZINC000819432429	FG	On-Demand	Anodyne	MC4R	21	42
CN1CCN(c2ccc(NC[C@H](O)c3ccccc3F)cc2Cl)CC1	ZINC000819432429	FG	On-Demand	Anodyne	NPY2R	99	46
O=CN1CCCN(C(=O)CNC(=O)NC2CCCCC2)CC1	ZINC000819432442	DC	On-Demand	Anodyne	EPHX2	29	48
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(CN2CCCCC2=O)c1	ZINC000819432451	GF	On-Demand	Anodyne	HRH2	26	42
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(CN2CCCCC2=O)c1	ZINC000819432453	GF	On-Demand	Anodyne	HRH2	26	42
CON(C)C(=O)CCNc1ccc(CC(=O)N2CCCc3ccccc32)cc1	ZINC000819432461	GG	On-Demand	Anodyne	AVPR2	49	45
CN1CCN(c2ccc(NC[C@H](O)c3cccc(F)c3)cc2Cl)CC1	ZINC000819432469	FG	On-Demand	Anodyne	NPY2R	84	48
CN1CCN(c2ccc(NC[C@H](O)c3ccc(C#N)cc3)cc2Cl)CC1	ZINC000819432482	FG	On-Demand	Mild	NPY2R	47	37
CN1CCN(c2ccc(NC[C@H](O)c3ccc(C#N)cc3)cc2Cl)CC1	ZINC000819432482	FG	On-Demand	Mild	PAK1	42	37
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1(C(N)=O)CCCC1	ZINC000819432485	FD	On-Demand	Mild	PAPA1_CARPA	33	41
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)C1CCCCC1	ZINC000819432499	DG	On-Demand	Anodyne	NPY2R	60	38
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)C1CCCCC1	ZINC000819432500	DG	On-Demand	Anodyne	NPY2R	60	38
N#CCc1ccc(OC[C@@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819432504	FH	On-Demand	Mild	ADRB1	49	39
N#CCc1ccc(OC[C@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819432505	FH	On-Demand	Mild	ADRB1	49	39
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1cccc(SC(F)F)c1	ZINC000819432516	FH	On-Demand	Bother	ADRB1	56	35
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1cccc(SC(F)F)c1	ZINC000819432517	FH	On-Demand	Bother	ADRB1	56	35
Cc1cc(OCc2cccc(C#N)c2)ccc1NCC(C)(C)O	ZINC000819432519	DH	On-Demand	Mild	MAOB	42	49
Cc1cc(OCc2cccc(C#N)c2)ccc1NCC(C)(C)O	ZINC000819432519	DH	On-Demand	Mild	DRTS_LEIMA	26	42
Cc1cc(OCc2cccc(C#N)c2)ccc1NCC(C)(C)O	ZINC000819432519	DH	On-Demand	Mild	FFAR1	48	38
CC(C)(C)C(=O)N1CSC[C@@H]1C(=O)N1CCCN(C=O)CC1	ZINC000819432542	EC	On-Demand	Anodyne	PREP	24	45
CC(C)(C)C(=O)N1CSC[C@H]1C(=O)N1CCCN(C=O)CC1	ZINC000819432543	EC	On-Demand	Anodyne	PREP	24	45
COc1cccc([C@@H](C)C(=O)N2CCCN(C=O)CC2)c1	ZINC000819432545	CD	On-Demand	Anodyne	MTNR1B	31	41
COc1cccc([C@@H](C)C(=O)N2CCCN(C=O)CC2)c1	ZINC000819432545	CD	On-Demand	Anodyne	DPP7	18	43
COc1cccc([C@H](C)C(=O)N2CCCN(C=O)CC2)c1	ZINC000819432546	CD	On-Demand	Anodyne	MTNR1B	31	41
COc1cccc([C@H](C)C(=O)N2CCCN(C=O)CC2)c1	ZINC000819432546	CD	On-Demand	Anodyne	DPP7	18	43
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)C(F)(F)F	ZINC000819432552	DD	On-Demand	Anodyne	NPY2R	66	37
CC(C)(C)C(=O)Nc1ccccc1C(=O)N1CCCN(C=O)CC1	ZINC000819432557	ED	On-Demand	Anodyne	NPSR1	15	45
O=CN1CCCN(C(=O)/C=C\c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1	ZINC000819432558	GG	On-Demand	Anodyne	ITGAL	45	35
O=CN1CCCN(C(=O)/C=C/c2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1	ZINC000819432559	GG	On-Demand	Anodyne	ITGAL	45	35
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)C(F)(F)F	ZINC000819432565	DD	On-Demand	Anodyne	NPY2R	66	37
O=C(Cc1ccc(NC[C@H](O)C2CC2)cc1)N1CCc2ccccc21	ZINC000819432571	EG	On-Demand	Anodyne	AVPR2	37	41
O=C(Cc1ccc(NC[C@@H](O)C2CC2)cc1)N1CCc2ccccc21	ZINC000819432576	EG	On-Demand	Anodyne	AVPR2	37	41
O=C(Cc1ccc(NC[C@@H](O)c2cccnc2)cc1)N1CCCc2ccccc21	ZINC000819432581	GH	On-Demand	Anodyne	ADRB2	24	41
O=C(Cc1ccc(NC[C@@H](O)c2cccnc2)cc1)N1CCCc2ccccc21	ZINC000819432581	GH	On-Demand	Anodyne	ADRB1	23	41
O=C(Cc1ccc(NC[C@@H](O)c2cccnc2)cc1)N1CCCc2ccccc21	ZINC000819432581	GH	On-Demand	Anodyne	AVPR2	33	43
O=C(Cc1ccc(NC[C@@H](O)c2cccnc2)cc1)N1CCCc2ccccc21	ZINC000819432581	GH	On-Demand	Anodyne	ADRB3	95	50
O=C(Cc1ccc(NC[C@H](O)c2cccnc2)cc1)N1CCCc2ccccc21	ZINC000819432583	GH	On-Demand	Anodyne	ADRB2	24	41
O=C(Cc1ccc(NC[C@H](O)c2cccnc2)cc1)N1CCCc2ccccc21	ZINC000819432583	GH	On-Demand	Anodyne	ADRB1	23	41
O=C(Cc1ccc(NC[C@H](O)c2cccnc2)cc1)N1CCCc2ccccc21	ZINC000819432583	GH	On-Demand	Anodyne	AVPR2	33	43
O=C(Cc1ccc(NC[C@H](O)c2cccnc2)cc1)N1CCCc2ccccc21	ZINC000819432583	GH	On-Demand	Anodyne	ADRB3	95	50
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc2c(c1)OCO2	ZINC000819432584	GF	On-Demand	Mild	PAPA1_CARPA	42	41
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccc(Cl)cc1	ZINC000819432586	GH	On-Demand	Anodyne	NPY2R	86	40
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccc(Cl)cc1	ZINC000819432586	GH	On-Demand	Anodyne	PIK3CA	20	47
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccc(Cl)cc1	ZINC000819432586	GH	On-Demand	Anodyne	MTOR	32	47
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccc(Cl)cc1	ZINC000819432586	GH	On-Demand	Anodyne	MAPK9	25	42
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccc(Cl)cc1	ZINC000819432586	GH	On-Demand	Anodyne	MAPK10	22	42
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccc(Cl)cc1	ZINC000819432586	GH	On-Demand	Anodyne	EPHX2	25	48
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccc(Cl)cc1	ZINC000819432586	GH	On-Demand	Anodyne	PIK3CG	22	41
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccc(Cl)cc1	ZINC000819432586	GH	On-Demand	Anodyne	PIK3CB	19	48
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccc(Cl)cc1	ZINC000819432586	GH	On-Demand	Anodyne	STAT6	45	33
O=CN1CCCN(C(=O)c2ccc3nc(O)[nH]c3c2)CC1	ZINC000819432616	CC	On-Demand	Anodyne	HRH4	15	40
O=CN1CCCN(C(=O)c2ccc3nc(O)[nH]c3c2)CC1	ZINC000819432616	CC	On-Demand	Anodyne	PARP1	17	41
O=S(=O)(CCNc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cc1	ZINC000819432622	GF	On-Demand	Anodyne	NPY2R	43	33
CCOc1ccccc1OCC(=O)N1CCCN(C=O)CC1	ZINC000819432623	DD	On-Demand	Anodyne	HCN1	51	35
CCOc1ccccc1OCC(=O)N1CCCN(C=O)CC1	ZINC000819432623	DD	On-Demand	Anodyne	HCN4	44	34
NC(=O)c1ccc(OCC(=O)N2CCCN(C=O)CC2)cc1	ZINC000819432625	DB	On-Demand	Anodyne	CPT1A	40	47
O=C(C(F)=C1CCC1)N1CCC[C@H]1c1n[nH]c(-c2ccccc2)n1	ZINC000819432630	EH	On-Demand	Anodyne	CPT1A	78	36
O=C(C(F)=C1CCC1)N1CCC[C@@H]1c1n[nH]c(-c2ccccc2)n1	ZINC000819432636	EH	On-Demand	Anodyne	CPT1A	78	36
CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)N2CCCN(C=O)CC2)c1	ZINC000819432640	GF	On-Demand	Anodyne	NPY2R	37	42
CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)N2CCCN(C=O)CC2)c1	ZINC000819432640	GF	On-Demand	Anodyne	IMDH_CRYPV	41	39
COCCS(=O)(=O)CC(=O)NNC(=S)NCCc1cccs1	ZINC000819432642	FB	On-Demand	Reactive	CA5B	37	44
O=CN1CCCN(C(=O)CCS(=O)(=O)c2ccc3c(c2)OCCO3)CC1	ZINC000819432656	GC	On-Demand	Anodyne	PKM	37	42
CSCCc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819432659	DI	On-Demand	Anodyne	ADRB2	18	53
CC[C@H](O)CNc1ccc(N2CCN(C)CC2)c(Cl)c1	ZINC000819432660	CE	On-Demand	Anodyne	NPY2R	93	42
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@](C)(O)C(F)(F)F	ZINC000819432667	FI	On-Demand	Mild	MAOB	38	48
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@](C)(O)C(F)(F)F	ZINC000819432676	FI	On-Demand	Mild	MAOB	38	48
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)C1CC1	ZINC000819432679	CD	On-Demand	Anodyne	NPY2R	71	40
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)C1CC1	ZINC000819432681	CD	On-Demand	Anodyne	NPY2R	71	40
CCOC[C@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819432688	CD	On-Demand	Anodyne	NPY2R	74	38
CCOC(=O)C1CCC(O)(CNc2ccc(N3CCOCC3)c(F)c2)CC1	ZINC000819432723	GF	On-Demand	Anodyne	NPY2R	69	39
CCOC(=O)C1CCC(O)(CNc2ccc(N3CCOCC3)c(F)c2)CC1	ZINC000819432723	GF	On-Demand	Anodyne	STAT6	44	33
CCOC(=O)C1CCC(O)(CNc2ccc(N3CCOCC3)c(F)c2)CC1	ZINC000819432723	GF	On-Demand	Anodyne	DGAT1	16	41
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccccc3C(F)(F)F)ccc21	ZINC000819432729	GI	On-Demand	Anodyne	AVPR2	21	40
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccccc3C(F)(F)F)ccc21	ZINC000819432729	GI	On-Demand	Anodyne	HSD17B3	44	31
CSCCc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819432731	GI	On-Demand	Anodyne	GPR119	46	47
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccccc3C(F)(F)F)ccc21	ZINC000819432732	GI	On-Demand	Anodyne	AVPR2	21	40
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccccc3C(F)(F)F)ccc21	ZINC000819432732	GI	On-Demand	Anodyne	HSD17B3	44	31
CSCCc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819432733	GI	On-Demand	Anodyne	GPR119	46	47
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccccc3C)ccc21	ZINC000819432745	DG	On-Demand	Anodyne	AVPR2	42	39
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccccc3C)ccc21	ZINC000819432745	DG	On-Demand	Anodyne	HSD17B3	46	32
CCOc1cc(NC[C@H](O)c2cc(OC)ccc2OC)ccc1C	ZINC000819432746	EH	On-Demand	Anodyne	MTNR1B	19	40
CCOc1cc(NC[C@@H](O)c2cc(OC)ccc2OC)ccc1C	ZINC000819432747	EH	On-Demand	Anodyne	MTNR1B	19	40
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccccc3C)ccc21	ZINC000819432749	DG	On-Demand	Anodyne	AVPR2	42	39
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccccc3C)ccc21	ZINC000819432749	DG	On-Demand	Anodyne	HSD17B3	46	32
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)cc2C(N)=O)c1	ZINC000819432752	GD	On-Demand	Anodyne	MAPK9	34	40
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)cc2C(N)=O)c1	ZINC000819432752	GD	On-Demand	Anodyne	MAPK10	38	40
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)cc2C(N)=O)c1	ZINC000819432752	GD	On-Demand	Anodyne	PIK3CB	17	40
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)cc2C(N)=O)c1	ZINC000819432752	GD	On-Demand	Anodyne	STAT6	73	41
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)Cc1cccc(Cl)c1	ZINC000819432757	FG	On-Demand	Anodyne	NPY2R	56	40
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)Cc1cccc(Cl)c1	ZINC000819432759	FG	On-Demand	Anodyne	NPY2R	56	40
C[C@@H](CNc1ccc(N2CCN(C)CC2)c(Cl)c1)S(C)(=O)=O	ZINC000819432784	ED	On-Demand	Anodyne	NPY2R	47	42
Cc1ccccc1[C@@H](O)CNc1ccc(N2CCN(C)CC2)c(Cl)c1	ZINC000819432787	FH	On-Demand	Anodyne	DRD1	50	40
Cc1ccccc1[C@@H](O)CNc1ccc(N2CCN(C)CC2)c(Cl)c1	ZINC000819432787	FH	On-Demand	Anodyne	NPY2R	62	41
CC(=O)N1CCCc2cc(NC[C@H](O)c3cccc(Br)c3)ccc21	ZINC000819432794	GH	On-Demand	Anodyne	HSD17B3	45	36
CC(=O)N1CCCc2cc(NC[C@@H](O)c3cccc(Br)c3)ccc21	ZINC000819432795	GH	On-Demand	Anodyne	HSD17B3	45	36
CN1CCN(c2ccc(NC[C@H](O)c3c(F)cccc3F)cc2Cl)CC1	ZINC000819432814	GH	On-Demand	Anodyne	DRD1	43	36
CN1CCN(c2ccc(NC[C@H](O)c3c(F)cccc3F)cc2Cl)CC1	ZINC000819432814	GH	On-Demand	Anodyne	NPY2R	83	45
CC(=O)N1CCCc2cc(NCCC(=O)Nc3ccc(N(C)C)cc3)ccc21	ZINC000819432830	GG	On-Demand	Anodyne	AVPR2	18	40
CN1CCN(c2ccc(NC[C@H](O)CN3CCCC3=O)cc2Cl)CC1	ZINC000819432846	FD	On-Demand	Anodyne	NPY2R	50	39
CON(C)C(=O)CCNc1ccc(NC(=O)c2cccs2)cc1	ZINC000819432855	EF	On-Demand	Anodyne	KCNK9	15	41
C=C(C)COc1cccc(NC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819432856	EH	On-Demand	Mild	MTNR1A	15	41
CC(=O)N1CCCc2cc(NC[C@H](O)c3cccc(F)c3)ccc21	ZINC000819432857	EG	On-Demand	Anodyne	HSD17B3	42	30
C=C(C)COc1cccc(NC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819432858	EH	On-Demand	Mild	MTNR1A	15	41
CC(=O)N1CCCc2cc(NC[C@@H](O)c3cccc(F)c3)ccc21	ZINC000819432859	EG	On-Demand	Anodyne	HSD17B3	42	30
CN1CCN(c2ccc(NC[C@](C)(O)C(F)(F)F)cc2Cl)CC1	ZINC000819432880	FF	On-Demand	Anodyne	NPY2R	56	46
CCOc1cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)ccc1C	ZINC000819432882	DG	On-Demand	Bother	CACNA1D	59	33
CCOc1cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)ccc1C	ZINC000819432883	DG	On-Demand	Bother	CACNA1D	59	33
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](O)CN1CCCC1=O	ZINC000819432898	GF	On-Demand	Mild	MAOB	26	46
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](O)CN1CCCC1=O	ZINC000819432900	GF	On-Demand	Mild	MAOB	26	46
CCOC[C@H](O)CNc1ccc(OCC2CCCCC2)cc1	ZINC000819432903	DG	On-Demand	Anodyne	ADRB2	21	44
CCOC[C@H](O)CNc1ccc(OCC2CCCCC2)cc1	ZINC000819432903	DG	On-Demand	Anodyne	ADRB1	37	47
COC[C@@H](O)CNc1ccc(N2CCN(C)CC2)c(Cl)c1	ZINC000819432911	DD	On-Demand	Anodyne	HTR1B	16	42
COC[C@@H](O)CNc1ccc(N2CCN(C)CC2)c(Cl)c1	ZINC000819432911	DD	On-Demand	Anodyne	NPY2R	52	39
CON(C)C(=O)CCNc1ccc(N2CCN(C)CC2)c(Cl)c1	ZINC000819432912	ED	On-Demand	Anodyne	DRD1	42	35
CON(C)C(=O)CCNc1ccc(N2CCN(C)CC2)c(Cl)c1	ZINC000819432912	ED	On-Demand	Anodyne	HTR1B	20	41
CON(C)C(=O)CCNc1ccc(N2CCN(C)CC2)c(Cl)c1	ZINC000819432912	ED	On-Demand	Anodyne	NPY2R	73	42
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819432920	GH	On-Demand	Anodyne	ADRB2	41	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819432920	GH	On-Demand	Anodyne	ADRB1	74	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819432920	GH	On-Demand	Anodyne	GRIN1	27	40
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819432920	GH	On-Demand	Anodyne	ADRB3	45	49
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819432921	GH	On-Demand	Anodyne	ADRB2	41	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819432921	GH	On-Demand	Anodyne	ADRB1	74	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819432921	GH	On-Demand	Anodyne	GRIN1	27	40
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819432921	GH	On-Demand	Anodyne	ADRB3	45	49
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](O)COCC(C)C	ZINC000819432922	FH	On-Demand	Mild	MAOB	15	43
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](O)COCC(C)C	ZINC000819432922	FH	On-Demand	Mild	FFAR1	18	42
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](O)COCC(C)C	ZINC000819432923	FH	On-Demand	Mild	MAOB	15	43
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](O)COCC(C)C	ZINC000819432923	FH	On-Demand	Mild	FFAR1	18	42
CCOc1cc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1C	ZINC000819432926	GH	On-Demand	Anodyne	GPR119	57	46
CCOc1cc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1C	ZINC000819432927	GH	On-Demand	Anodyne	GPR119	57	46
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccc(Cl)cc3Cl)ccc21	ZINC000819432928	GI	On-Demand	Anodyne	CNR1	56	34
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccc(Cl)cc3Cl)ccc21	ZINC000819432928	GI	On-Demand	Anodyne	AVPR2	19	49
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccc(Cl)cc3Cl)ccc21	ZINC000819432928	GI	On-Demand	Anodyne	HSD17B3	51	38
CS[C@@H]1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@@H]1N(C)C	ZINC000819432939	GE	On-Demand	Mild	PAPA1_CARPA	30	42
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccc(C(F)(F)F)cc3)ccc21	ZINC000819432942	GI	On-Demand	Anodyne	HSD17B3	43	30
CS[C@@H]1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@H]1N(C)C	ZINC000819432943	GE	On-Demand	Mild	PAPA1_CARPA	30	42
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccc(C(F)(F)F)cc3)ccc21	ZINC000819432944	GI	On-Demand	Anodyne	HSD17B3	43	30
CS[C@@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@H]1N(C)C	ZINC000819432945	GE	On-Demand	Mild	PAPA1_CARPA	30	42
CS[C@@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@@H]1N(C)C	ZINC000819432946	GE	On-Demand	Mild	PAPA1_CARPA	30	42
CN1CCN(c2ccc(NC[C@H](O)CN3CCOCC3)cc2Cl)CC1	ZINC000819432959	FD	On-Demand	Anodyne	NPY2R	46	38
CN1CCN(c2ccc(NC[C@H](O)c3ccc(F)cc3)cc2Cl)CC1	ZINC000819432962	FG	On-Demand	Anodyne	NPY2R	78	48
CN1CCN(c2ccc(NC[C@H](O)c3ccc(F)cc3)cc2Cl)CC1	ZINC000819432962	FG	On-Demand	Anodyne	WDR5	30	40
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccc(F)c(F)c3)ccc21	ZINC000819432966	EG	On-Demand	Anodyne	AVPR2	20	41
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccc(F)c(F)c3)ccc21	ZINC000819432968	EG	On-Demand	Anodyne	AVPR2	20	41
CSCCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819432981	CG	On-Demand	Anodyne	ADRB2	36	50
CSCCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819432981	CG	On-Demand	Anodyne	ADRB1	30	43
CSCCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819432981	CG	On-Demand	Anodyne	ADRB3	111	52
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)Cc1ccc(F)cc1	ZINC000819432984	EF	On-Demand	Anodyne	NPY2R	55	35
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)Cc1ccc(F)cc1	ZINC000819432985	EF	On-Demand	Anodyne	NPY2R	55	35
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](C)S(C)(=O)=O	ZINC000819432989	FG	On-Demand	Mild	MAOB	33	48
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](C)S(C)(=O)=O	ZINC000819432989	FG	On-Demand	Mild	ADAMTS4	20	51
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](C)S(C)(=O)=O	ZINC000819432989	FG	On-Demand	Mild	FFAR1	30	44
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](C)S(C)(=O)=O	ZINC000819432990	FG	On-Demand	Mild	MAOB	33	48
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](C)S(C)(=O)=O	ZINC000819432990	FG	On-Demand	Mild	ADAMTS4	20	51
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](C)S(C)(=O)=O	ZINC000819432990	FG	On-Demand	Mild	FFAR1	30	44
C[C@@](O)(CNc1ccc(N2CCOCC2)c(F)c1)C(F)(F)F	ZINC000819432991	DE	On-Demand	Anodyne	NPY2R	65	38
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccc(Cl)c(F)c3)ccc21	ZINC000819433025	FH	On-Demand	Anodyne	AVPR2	15	43
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccc(Cl)c(F)c3)ccc21	ZINC000819433026	FH	On-Demand	Anodyne	AVPR2	15	43
CN1CCN(c2ccc(NC[C@H](O)c3ccc(F)c(F)c3)cc2Cl)CC1	ZINC000819433050	GH	On-Demand	Anodyne	NPY2R	82	40
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](O)CN(C)CCC#N	ZINC000819433074	GG	On-Demand	Mild	MAOB	15	41
O[C@@H](CNc1ccc(OCC2CCCCC2)cc1)COC1CCOCC1	ZINC000819433075	FH	On-Demand	Anodyne	ADRB1	28	44
O[C@H](CNc1ccc(OCC2CCCCC2)cc1)COC1CCOCC1	ZINC000819433076	FH	On-Demand	Anodyne	ADRB1	28	44
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](O)CN(C)CCC#N	ZINC000819433077	GG	On-Demand	Mild	MAOB	15	41
CC[C@H](O)CNc1ccc(OCc2cccc(C#N)c2)cc1C	ZINC000819433093	DH	On-Demand	Mild	MAOB	33	47
COc1ccc(O)c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819433115	FF	On-Demand	Mild	PAPA1_CARPA	45	46
CC(=O)N1CCCc2cc(NC[C@H](O)c3cccc4ccccc34)ccc21	ZINC000819433116	FI	On-Demand	Anodyne	HSD17B3	46	32
COc1ccc(O)c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819433117	FF	On-Demand	Mild	PAPA1_CARPA	45	46
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819433130	GE	On-Demand	Anodyne	NPY2R	82	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819433132	GE	On-Demand	Anodyne	NPY2R	82	40
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccccc1Cl	ZINC000819433147	FG	On-Demand	Anodyne	NPY2R	74	37
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccccc1Cl	ZINC000819433147	FG	On-Demand	Anodyne	MAPK9	31	43
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccccc1Cl	ZINC000819433147	FG	On-Demand	Anodyne	MAPK10	28	43
CCOC(=O)CC[C@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819433149	ED	On-Demand	Anodyne	NPY2R	81	39
CCOC(=O)CC[C@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819433149	ED	On-Demand	Anodyne	STAT6	50	34
CCOC(=O)CC[C@@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819433150	ED	On-Demand	Anodyne	NPY2R	81	39
CCOC(=O)CC[C@@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819433150	ED	On-Demand	Anodyne	STAT6	50	34
C#CCNC(=O)CCNc1ccc(N2CCOCC2)c(F)c1	ZINC000819433161	DD	On-Demand	Mild	NPY2R	71	38
CCOC(=O)CC[C@H](O)CNc1ccc(N2CCN(C)CC2)c(Cl)c1	ZINC000819433165	FE	On-Demand	Anodyne	NPY2R	69	39
CCOC(=O)CC[C@@H](O)CNc1ccc(N2CCN(C)CC2)c(Cl)c1	ZINC000819433166	FE	On-Demand	Anodyne	NPY2R	69	39
O=C(Cc1ccc(NC[C@H](O)C2CC2)cc1)N1CCCc2ccccc21	ZINC000819433169	FG	On-Demand	Anodyne	AVPR2	49	48
O=C(Cc1ccc(NC[C@@H](O)C2CC2)cc1)N1CCCc2ccccc21	ZINC000819433171	FG	On-Demand	Anodyne	AVPR2	49	48
CN1CCN(c2ccc(NC[C@H](O)c3ccc(F)cc3F)cc2Cl)CC1	ZINC000819433178	GH	On-Demand	Anodyne	NPY2R	60	43
CN1CCN(c2ccc(NC[C@H](O)c3ccc(F)cc3F)cc2Cl)CC1	ZINC000819433178	GH	On-Demand	Anodyne	WDR5	32	42
CN1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2Cl)CC1	ZINC000819433182	GF	On-Demand	Anodyne	ADRB2	44	43
CN1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2Cl)CC1	ZINC000819433182	GF	On-Demand	Anodyne	ADRB1	59	41
CN1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2Cl)CC1	ZINC000819433182	GF	On-Demand	Anodyne	DRD1	40	34
CN1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2Cl)CC1	ZINC000819433182	GF	On-Demand	Anodyne	ADRB3	42	41
CN1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2Cl)CC1	ZINC000819433182	GF	On-Demand	Anodyne	NPY2R	77	42
CN1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2Cl)CC1	ZINC000819433182	GF	On-Demand	Anodyne	PAK1	42	36
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)Cc1ccc2ccccc2c1	ZINC000819433191	GH	On-Demand	Anodyne	NPY2R	67	36
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)Cc1ccc2ccccc2c1	ZINC000819433191	GH	On-Demand	Anodyne	STAT6	43	33
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)Cc1ccc2ccccc2c1	ZINC000819433194	GH	On-Demand	Anodyne	NPY2R	67	36
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)Cc1ccc2ccccc2c1	ZINC000819433194	GH	On-Demand	Anodyne	STAT6	43	33
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2cccc(SC(F)F)c2)c1	ZINC000819433195	FH	On-Demand	Bother	PDS	15	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2cccc(SC(F)F)c2)c1	ZINC000819433196	FH	On-Demand	Bother	PDS	15	44
Cn1cc([C@H](CO)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cn1	ZINC000819433197	FD	On-Demand	Mild	PAPA1_CARPA	39	43
Cn1cc([C@H](CO)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cn1	ZINC000819433198	FD	On-Demand	Mild	PAPA1_CARPA	39	43
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(NC(=O)c2ccoc2)c1	ZINC000819433200	GG	On-Demand	Anodyne	KCNK3	112	53
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(NC(=O)c2ccoc2)c1	ZINC000819433200	GG	On-Demand	Anodyne	KCNK9	77	36
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(NC(=O)c2ccoc2)c1	ZINC000819433204	GG	On-Demand	Anodyne	KCNK3	112	53
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(NC(=O)c2ccoc2)c1	ZINC000819433204	GG	On-Demand	Anodyne	KCNK9	77	36
CN1CCN(c2ccc(NC[C@H](O)c3ccccc3)cc2Cl)CC1	ZINC000819433219	EG	On-Demand	Anodyne	DRD1	58	37
CN1CCN(c2ccc(NC[C@H](O)c3ccccc3)cc2Cl)CC1	ZINC000819433219	EG	On-Demand	Anodyne	NPY2R	111	47
CC(=O)N1CCCc2cc(NC[C@@H](O)c3cc4ccccc4o3)ccc21	ZINC000819433224	FH	On-Demand	Anodyne	HSD17B3	44	31
O=C1CCCCN1Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819433238	FH	On-Demand	Anodyne	ADRB1	30	44
O=C1CCCCN1Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819433238	FH	On-Demand	Anodyne	ADRB3	46	43
O=C1CCCCN1Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819433238	FH	On-Demand	Anodyne	CYP3A4	45	35
O=C1CCCCN1Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819433239	FH	On-Demand	Anodyne	ADRB1	30	44
O=C1CCCCN1Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819433239	FH	On-Demand	Anodyne	ADRB3	46	43
O=C1CCCCN1Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819433239	FH	On-Demand	Anodyne	CYP3A4	45	35
CN1CCN(c2ccc(NC[C@H](O)Cn3cccn3)cc2Cl)CC1	ZINC000819433241	ED	On-Demand	Anodyne	NPY2R	57	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N(CCO)CCc1ccccc1	ZINC000819433249	ED	On-Demand	Anodyne	NA	26	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N(CCO)CCc1ccccc1	ZINC000819433249	ED	On-Demand	Anodyne	FPR1	40	34
CN1CCN(c2ccc(NC[C@H](O)Cn3cc([N+](=O)[O-])cn3)cc2Cl)CC1	ZINC000819433250	GD	On-Demand	Bother	WDR5	36	41
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819433277	DE	On-Demand	Anodyne	ADRB3	77	42
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819433277	DE	On-Demand	Anodyne	NPY2R	75	41
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819433277	DE	On-Demand	Anodyne	MAPK9	18	40
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819433277	DE	On-Demand	Anodyne	MAPK10	16	40
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819433277	DE	On-Demand	Anodyne	STAT6	45	33
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819433279	DE	On-Demand	Anodyne	ADRB3	77	42
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819433279	DE	On-Demand	Anodyne	NPY2R	75	41
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819433279	DE	On-Demand	Anodyne	MAPK9	18	40
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819433279	DE	On-Demand	Anodyne	MAPK10	16	40
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccnc1	ZINC000819433279	DE	On-Demand	Anodyne	STAT6	45	33
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cc2ccccc2o1	ZINC000819433281	FH	On-Demand	Anodyne	NPY2R	60	36
O[C@H](CNc1cccc(SC(F)F)c1)COc1ccccc1F	ZINC000819433283	EH	On-Demand	Anodyne	ADRB1	54	36
O[C@@H](CNc1cccc(SC(F)F)c1)COc1ccccc1F	ZINC000819433285	EH	On-Demand	Anodyne	ADRB1	54	36
O=C(Nc1ccc(NC[C@H](O)C2CC2)cc1)c1cccs1	ZINC000819433291	DG	On-Demand	Anodyne	NOS1	37	40
O=C(Nc1ccc(NC[C@@H](O)C2CC2)cc1)c1cccs1	ZINC000819433293	DG	On-Demand	Anodyne	NOS1	37	40
CSCCc1ccc(NC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819433297	DI	On-Demand	Anodyne	ADRB2	21	45
CC(=O)N1CCCc2cc(NC[C@@H](O)c3cccnc3)ccc21	ZINC000819433298	DF	On-Demand	Anodyne	ADRB1	25	41
CC(=O)N1CCCc2cc(NC[C@@H](O)c3cccnc3)ccc21	ZINC000819433298	DF	On-Demand	Anodyne	CYP11B1	19	42
CC(=O)N1CCCc2cc(NC[C@@H](O)c3cccnc3)ccc21	ZINC000819433298	DF	On-Demand	Anodyne	ADRB3	94	47
CC(=O)N1CCCc2cc(NC[C@@H](O)c3cccnc3)ccc21	ZINC000819433298	DF	On-Demand	Anodyne	CYP11B2	34	50
CSCCc1ccc(NC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819433299	DI	On-Demand	Anodyne	ADRB2	21	45
CC(=O)N1CCCc2cc(NC[C@H](O)c3cccnc3)ccc21	ZINC000819433300	DF	On-Demand	Anodyne	ADRB1	25	41
CC(=O)N1CCCc2cc(NC[C@H](O)c3cccnc3)ccc21	ZINC000819433300	DF	On-Demand	Anodyne	CYP11B1	19	42
CC(=O)N1CCCc2cc(NC[C@H](O)c3cccnc3)ccc21	ZINC000819433300	DF	On-Demand	Anodyne	ADRB3	94	47
CC(=O)N1CCCc2cc(NC[C@H](O)c3cccnc3)ccc21	ZINC000819433300	DF	On-Demand	Anodyne	CYP11B2	34	50
CN1CCN(c2ccc(NC[C@H](O)CN(C)C3CC3)cc2Cl)CC1	ZINC000819433302	FD	On-Demand	Anodyne	NPY2R	68	38
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccc2ccccc12	ZINC000819433305	FH	On-Demand	Anodyne	NPY2R	60	35
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc(CN2CCCCC2=O)c1	ZINC000819433323	GF	On-Demand	Anodyne	HRH2	21	43
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc(CN2CCCCC2=O)c1	ZINC000819433325	GF	On-Demand	Anodyne	HRH2	21	43
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccc(F)cc3Cl)ccc21	ZINC000819433342	FH	On-Demand	Anodyne	AVPR2	19	41
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccc(F)cc3Cl)ccc21	ZINC000819433343	FH	On-Demand	Anodyne	AVPR2	19	41
CC[C@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819433347	CD	On-Demand	Anodyne	NPY2R	91	41
COC[C@@H](O)CNc1ccc(OCC2CCCCC2)cc1	ZINC000819433352	CG	On-Demand	Anodyne	ADRB2	31	46
COC[C@@H](O)CNc1ccc(OCC2CCCCC2)cc1	ZINC000819433352	CG	On-Demand	Anodyne	ADRB1	44	47
CC(=O)N1CCCc2cc(NCCS(C)(=O)=O)ccc21	ZINC000819433375	CD	On-Demand	Anodyne	AVPR2	21	41
CC(=O)N1CCCc2cc(NCCS(C)(=O)=O)ccc21	ZINC000819433375	CD	On-Demand	Anodyne	HSD17B3	48	42
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](O)COC(C)C	ZINC000819433380	FH	On-Demand	Mild	MAOB	20	44
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](O)COC(C)C	ZINC000819433380	FH	On-Demand	Mild	FFAR1	19	43
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](O)COC(C)C	ZINC000819433381	FH	On-Demand	Mild	MAOB	20	44
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](O)COC(C)C	ZINC000819433381	FH	On-Demand	Mild	FFAR1	19	43
O[C@@H](CNc1ccc(NC2CCCCC2)cc1)c1ccccc1	ZINC000819433386	DJ	On-Demand	Anodyne	ADRB1	15	40
O[C@@H](CNc1ccc(NC2CCCCC2)cc1)c1ccccc1	ZINC000819433386	DJ	On-Demand	Anodyne	ADRB3	27	40
O[C@H](CNc1ccc(NC2CCCCC2)cc1)c1ccccc1	ZINC000819433387	DJ	On-Demand	Anodyne	ADRB1	15	40
O[C@H](CNc1ccc(NC2CCCCC2)cc1)c1ccccc1	ZINC000819433387	DJ	On-Demand	Anodyne	ADRB3	27	40
C=CCC1(C(=O)Nc2cc(C#N)ccc2O)CCOCC1	ZINC000819433392	CF	On-Demand	Mild	CTSC	19	40
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](O)C(F)(F)F	ZINC000819433396	FH	On-Demand	Mild	MAOB	29	45
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](O)C(F)(F)F	ZINC000819433396	FH	On-Demand	Mild	FFAR1	41	36
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](O)C(F)(F)F	ZINC000819433397	FH	On-Demand	Mild	MAOB	29	45
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](O)C(F)(F)F	ZINC000819433397	FH	On-Demand	Mild	FFAR1	41	36
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc(SC(F)F)c2)c1	ZINC000819433403	FI	On-Demand	Anodyne	ADRB2	20	45
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc(SC(F)F)c2)c1	ZINC000819433403	FI	On-Demand	Anodyne	ADRB1	41	39
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc(SC(F)F)c2)c1	ZINC000819433403	FI	On-Demand	Anodyne	PDS	72	38
CC(=O)c1cccc(OC[C@H](O)CNc2cccc(SC(F)F)c2)c1	ZINC000819433404	FI	On-Demand	Anodyne	ADRB2	20	45
CC(=O)c1cccc(OC[C@H](O)CNc2cccc(SC(F)F)c2)c1	ZINC000819433404	FI	On-Demand	Anodyne	ADRB1	41	39
CC(=O)c1cccc(OC[C@H](O)CNc2cccc(SC(F)F)c2)c1	ZINC000819433404	FI	On-Demand	Anodyne	PDS	72	38
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCOCC2)cc1C(N)=O	ZINC000819433412	EE	On-Demand	Anodyne	MAPK10	37	42
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCOCC2)cc1C(N)=O	ZINC000819433412	EE	On-Demand	Anodyne	STAT6	55	34
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCOCC2)cc1C(N)=O	ZINC000819433413	EE	On-Demand	Anodyne	MAPK10	37	42
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCOCC2)cc1C(N)=O	ZINC000819433413	EE	On-Demand	Anodyne	STAT6	55	34
CN1CCN(c2ccc(NC[C@H](O)Cc3ccc(F)cc3)cc2Cl)CC1	ZINC000819433445	GG	On-Demand	Anodyne	NPY2R	56	51
CN1CCN(c2ccc(NC[C@H](O)COCc3ccccc3)cc2Cl)CC1	ZINC000819433452	GG	On-Demand	Anodyne	UGCG	26	41
CN1CCN(c2ccc(NC[C@H](O)COCc3ccccc3)cc2Cl)CC1	ZINC000819433452	GG	On-Demand	Anodyne	NPY2R	63	45
NC(=O)c1cc(N2CCOCC2)ccc1NC(=O)c1cc2c(cn1)OCCO2	ZINC000819433464	GD	On-Demand	Anodyne	MAPK9	44	47
NC(=O)c1cc(N2CCOCC2)ccc1NC(=O)c1cc2c(cn1)OCCO2	ZINC000819433464	GD	On-Demand	Anodyne	MAPK10	47	47
NC(=O)c1cc(N2CCOCC2)ccc1NC(=O)c1cc2c(cn1)OCCO2	ZINC000819433464	GD	On-Demand	Anodyne	MAPK8	16	44
NC(=O)c1cc(N2CCOCC2)ccc1NC(=O)c1cc2c(cn1)OCCO2	ZINC000819433464	GD	On-Demand	Anodyne	STAT6	71	38
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccc(C)cc3)ccc21	ZINC000819433472	DG	On-Demand	Anodyne	HSD17B3	47	39
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccc(C)cc3)ccc21	ZINC000819433473	DG	On-Demand	Anodyne	HSD17B3	47	39
C#CCNC(=O)CCNc1ccc(N2CCN(C)CC2)c(Cl)c1	ZINC000819433477	ED	On-Demand	Mild	HTR1D	15	43
C#CCNC(=O)CCNc1ccc(N2CCN(C)CC2)c(Cl)c1	ZINC000819433477	ED	On-Demand	Mild	NPY2R	62	42
C#CCNC(=O)CCNc1ccc(N2CCN(C)CC2)c(Cl)c1	ZINC000819433477	ED	On-Demand	Mild	PAK1	40	34
C#CCNC(=O)CCNc1ccc(CC(=O)N2CCc3ccccc32)cc1	ZINC000819433478	FE	On-Demand	Mild	AVPR2	38	41
C#CCNC(=O)CCNc1ccc(CC(=O)N2CCc3ccccc32)cc1	ZINC000819433478	FE	On-Demand	Mild	EIF2AK3	44	31
CON(C)C(=O)CCNc1ccc2c(c1)CCCN2C(C)=O	ZINC000819433491	DD	On-Demand	Anodyne	HSD17B3	44	32
CC[C@H](O)CNc1cccc(OCCS(C)(=O)=O)c1	ZINC000819433493	CD	On-Demand	Anodyne	PDS	67	37
CC(=O)N1CCCc2cc(NC[C@H](O)C3CC3)ccc21	ZINC000819433505	CE	On-Demand	Anodyne	AVPR2	19	40
CC(=O)N1CCCc2cc(NC[C@H](O)C3CC3)ccc21	ZINC000819433505	CE	On-Demand	Anodyne	HSD17B3	44	32
CC(=O)N1CCCc2cc(NC[C@@H](O)C3CC3)ccc21	ZINC000819433506	CE	On-Demand	Anodyne	AVPR2	19	40
CC(=O)N1CCCc2cc(NC[C@@H](O)C3CC3)ccc21	ZINC000819433506	CE	On-Demand	Anodyne	HSD17B3	44	32
CC(=O)N1CCCc2cc(NC[C@H](O)c3ccc(C#N)cc3)ccc21	ZINC000819433519	EG	On-Demand	Mild	HSD17B3	30	42
CC(=O)N1CCCc2cc(NC[C@@H](O)c3ccc(C#N)cc3)ccc21	ZINC000819433520	EG	On-Demand	Mild	HSD17B3	30	42
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cn1	ZINC000819433528	EE	On-Demand	Anodyne	NPY2R	56	33
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cn1	ZINC000819433528	EE	On-Demand	Anodyne	STAT6	42	35
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cn1	ZINC000819433529	EE	On-Demand	Anodyne	NPY2R	56	33
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cn1	ZINC000819433529	EE	On-Demand	Anodyne	STAT6	42	35
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](C#N)CCC#N	ZINC000819433540	EI	On-Demand	Mild	MAOB	21	45
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](C#N)CCC#N	ZINC000819433541	EI	On-Demand	Mild	MAOB	21	45
CSCCc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819433546	DI	On-Demand	Anodyne	ADRB2	31	55
CSCCc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819433546	DI	On-Demand	Anodyne	ADRB1	38	55
CSCCc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819433546	DI	On-Demand	Anodyne	ADRB3	56	50
CSCCc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819433547	DI	On-Demand	Anodyne	ADRB2	31	55
CSCCc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819433547	DI	On-Demand	Anodyne	ADRB1	38	55
CSCCc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819433547	DI	On-Demand	Anodyne	ADRB3	56	50
CCOC(=O)Cn1ccc2cc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)ccc21	ZINC000819433554	GG	On-Demand	Bother	CACNA1D	56	32
CCOC(=O)Cn1ccc2cc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)ccc21	ZINC000819433554	GG	On-Demand	Bother	NR5A1	17	40
CCOC(=O)Cn1ccc2cc(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)ccc21	ZINC000819433555	GG	On-Demand	Bother	CACNA1D	56	32
CCOC(=O)Cn1ccc2cc(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)ccc21	ZINC000819433555	GG	On-Demand	Bother	NR5A1	17	40
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)CC(F)(F)F	ZINC000819433563	DE	On-Demand	Anodyne	NPY2R	60	36
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)CC(F)(F)F	ZINC000819433564	DE	On-Demand	Anodyne	NPY2R	60	36
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccnc1	ZINC000819433594	EE	On-Demand	Anodyne	NPY2R	75	40
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccnc1	ZINC000819433594	EE	On-Demand	Anodyne	PIK3CA	27	49
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccnc1	ZINC000819433594	EE	On-Demand	Anodyne	CHRNA7	15	47
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccnc1	ZINC000819433594	EE	On-Demand	Anodyne	MTOR	39	49
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccnc1	ZINC000819433594	EE	On-Demand	Anodyne	MAPK9	31	42
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccnc1	ZINC000819433594	EE	On-Demand	Anodyne	MAPK10	27	42
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccnc1	ZINC000819433594	EE	On-Demand	Anodyne	EPHX2	16	41
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccnc1	ZINC000819433594	EE	On-Demand	Anodyne	PIK3CG	18	49
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccnc1	ZINC000819433594	EE	On-Demand	Anodyne	PIK3CB	17	41
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccnc1	ZINC000819433594	EE	On-Demand	Anodyne	STAT6	57	35
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](C)O	ZINC000819433597	CG	On-Demand	Mild	MAOB	38	48
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](C)O	ZINC000819433598	CG	On-Demand	Mild	MAOB	38	48
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819433599	FI	On-Demand	Anodyne	ADRB2	34	41
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819433599	FI	On-Demand	Anodyne	ADRB1	59	41
CC(=O)c1ccc(OC[C@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819433600	FI	On-Demand	Anodyne	ADRB2	34	41
CC(=O)c1ccc(OC[C@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819433600	FI	On-Demand	Anodyne	ADRB1	59	41
CCOC[C@H](O)CNc1ccc(OCc2cccc(C#N)c2)cc1C	ZINC000819433611	EG	On-Demand	Mild	MAOB	17	44
CCOC[C@H](O)CNc1ccc(OCc2cccc(C#N)c2)cc1C	ZINC000819433611	EG	On-Demand	Mild	FFAR1	23	43
CSCCc1ccc(NC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819433613	DH	On-Demand	Anodyne	ADRB2	16	53
CSCCc1ccc(NC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819433614	DH	On-Demand	Anodyne	ADRB2	16	53
COC[C@@H](C)OC[C@@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819433618	ED	On-Demand	Anodyne	NPY2R	60	34
COC[C@@H](C)OC[C@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819433619	ED	On-Demand	Anodyne	NPY2R	60	34
CSCCc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819433631	CH	On-Demand	Anodyne	ADRB2	35	66
CSCCc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819433631	CH	On-Demand	Anodyne	ADRB1	31	50
CSCCc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819433631	CH	On-Demand	Anodyne	ADRB3	61	47
CSCCc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819433631	CH	On-Demand	Anodyne	AOC3	16	43
CSCCc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819433631	CH	On-Demand	Anodyne	FFAR1	16	45
CSCCc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819433632	CH	On-Demand	Anodyne	ADRB2	35	66
CSCCc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819433632	CH	On-Demand	Anodyne	ADRB1	31	50
CSCCc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819433632	CH	On-Demand	Anodyne	ADRB3	61	47
CSCCc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819433632	CH	On-Demand	Anodyne	AOC3	16	43
CSCCc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819433632	CH	On-Demand	Anodyne	FFAR1	16	45
Cc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1O	ZINC000819433645	EG	On-Demand	Mild	PAPA1_CARPA	45	46
Cc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1O	ZINC000819433645	EG	On-Demand	Mild	FPR1	43	38
Cc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1O	ZINC000819433646	EG	On-Demand	Mild	PAPA1_CARPA	45	46
Cc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1O	ZINC000819433646	EG	On-Demand	Mild	FPR1	43	38
O=[N+]([O-])c1cnn(C[C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819433653	FD	On-Demand	Bother	NPY2R	47	33
O=[N+]([O-])c1cnn(C[C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819433654	FD	On-Demand	Bother	NPY2R	47	33
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819433660	GE	On-Demand	Anodyne	NPY2R	74	37
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819433661	GE	On-Demand	Anodyne	NPY2R	74	37
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819433662	GH	On-Demand	Anodyne	ADRB2	42	45
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819433662	GH	On-Demand	Anodyne	ADRB1	65	45
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819433662	GH	On-Demand	Anodyne	GRIN1	18	40
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819433662	GH	On-Demand	Anodyne	ADRB3	44	45
COC(=O)c1ccc(OC[C@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819433663	GH	On-Demand	Anodyne	ADRB2	42	45
COC(=O)c1ccc(OC[C@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819433663	GH	On-Demand	Anodyne	ADRB1	65	45
COC(=O)c1ccc(OC[C@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819433663	GH	On-Demand	Anodyne	GRIN1	18	40
COC(=O)c1ccc(OC[C@H](O)CNc2cccc(SC(F)F)c2)cc1	ZINC000819433663	GH	On-Demand	Anodyne	ADRB3	44	45
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)Cn1cccn1	ZINC000819433671	DD	On-Demand	Anodyne	NPY2R	73	36
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)Cn1cccn1	ZINC000819433672	DD	On-Demand	Anodyne	NPY2R	73	36
CCOC(=O)Cn1ccc2cc(NC[C@@H](O)c3cccnc3)ccc21	ZINC000819433688	EF	On-Demand	Anodyne	ADRB3	75	44
CCOC(=O)Cn1ccc2cc(NC[C@H](O)c3cccnc3)ccc21	ZINC000819433689	EF	On-Demand	Anodyne	ADRB3	75	44
CN(C[C@@H](O)CNc1ccc(N2CCOCC2)c(F)c1)C1CC1	ZINC000819433690	DD	On-Demand	Anodyne	NPY2R	74	43
CN(C[C@H](O)CNc1ccc(N2CCOCC2)c(F)c1)C1CC1	ZINC000819433691	DD	On-Demand	Anodyne	NPY2R	74	43
O=C1CCc2cc(OC[C@@H](O)CNc3cccc(SC(F)F)c3)ccc2N1	ZINC000819433708	GH	On-Demand	Anodyne	ADRB1	18	40
O=C1CCc2cc(OC[C@H](O)CNc3cccc(SC(F)F)c3)ccc2N1	ZINC000819433709	GH	On-Demand	Anodyne	ADRB1	18	40
Cc1cc(OCc2cccc(C#N)c2)ccc1NCC1(O)CCC1	ZINC000819433712	DH	On-Demand	Mild	MAOB	33	48
Cc1cc(OCc2cccc(C#N)c2)ccc1NCC1(O)CCC1	ZINC000819433712	DH	On-Demand	Mild	FFAR1	46	34
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)c2ccc(F)cc2)c1	ZINC000819433713	GH	On-Demand	Anodyne	HRH2	17	44
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)c2ccc(F)cc2)c1	ZINC000819433713	GH	On-Demand	Anodyne	PDS	54	35
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819433718	GH	On-Demand	Anodyne	HRH2	17	44
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819433718	GH	On-Demand	Anodyne	PDS	54	35
O=C(Cn1ccc2cc(NC[C@H](O)c3cccnc3)ccc21)N1CCOCC1	ZINC000819433719	GE	On-Demand	Anodyne	ADRB3	64	40
O=C(Cn1ccc2cc(NC[C@@H](O)c3cccnc3)ccc21)N1CCOCC1	ZINC000819433720	GE	On-Demand	Anodyne	ADRB3	64	40
O=[N+]([O-])c1ccc([C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819433721	FF	On-Demand	Bother	NPY2R	54	37
O=[N+]([O-])c1ccc([C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819433723	FF	On-Demand	Bother	NPY2R	54	37
CC(C)(C)OC(=O)NCCOc1cccc(NCCC(=O)NC(N)=O)c1	ZINC000819433725	FD	On-Demand	Anodyne	HRH2	25	47
CC(C)(C)OC(=O)NCCOc1cccc(NCCS(C)(=O)=O)c1	ZINC000819433739	FE	On-Demand	Anodyne	HRH2	23	45
CC(C)(C)OC(=O)NCCOc1cccc(NCCS(C)(=O)=O)c1	ZINC000819433739	FE	On-Demand	Anodyne	MTNR1A	23	43
CC(C)(C)OC(=O)NCCOc1cccc(NCCS(C)(=O)=O)c1	ZINC000819433739	FE	On-Demand	Anodyne	MTNR1B	17	43
CC(C)(C)OC(=O)NCCOc1cccc(NCCS(C)(=O)=O)c1	ZINC000819433739	FE	On-Demand	Anodyne	PDS	41	34
CN(CCC#N)C[C@@H](O)CNc1ccc(OCc2cccc(C#N)c2)cc1	ZINC000819433757	FF	On-Demand	Mild	MAOB	17	40
CN(CCC#N)C[C@H](O)CNc1ccc(OCc2cccc(C#N)c2)cc1	ZINC000819433758	FF	On-Demand	Mild	MAOB	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCc1cc(OC)ccc1OC)C2	ZINC000819433761	GF	On-Demand	Anodyne	MTNR1A	53	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCc1cc(OC)ccc1OC)C2	ZINC000819433761	GF	On-Demand	Anodyne	MTNR1B	45	53
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCc1cc(OC)ccc1OC)C2	ZINC000819433762	GF	On-Demand	Anodyne	MTNR1A	53	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCc1cc(OC)ccc1OC)C2	ZINC000819433762	GF	On-Demand	Anodyne	MTNR1B	45	53
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccc(Br)cc1	ZINC000819433777	GH	On-Demand	Anodyne	NPY2R	57	38
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccc(Br)cc1	ZINC000819433778	GH	On-Demand	Anodyne	NPY2R	57	38
CC(C)(C)OC(=O)NCCOc1cccc(NCCC(N)=O)c1	ZINC000819433779	DD	On-Demand	Anodyne	HRH2	24	48
CC(C)(C)OC(=O)NCCOc1cccc(NCCC(N)=O)c1	ZINC000819433779	DD	On-Demand	Anodyne	MTNR1A	20	44
CC(C)(C)OC(=O)NCCOc1cccc(NCCC(N)=O)c1	ZINC000819433779	DD	On-Demand	Anodyne	MTNR1B	15	44
CC(C)(C)OC(=O)NCCOc1cccc(NCCC(N)=O)c1	ZINC000819433779	DD	On-Demand	Anodyne	PDS	49	37
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccc(Br)c1	ZINC000819433786	GH	On-Demand	Anodyne	NPY2R	70	38
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccc(Br)c1	ZINC000819433787	GH	On-Demand	Anodyne	NPY2R	70	38
COC[C@@H](O)CNc1ccc(OCc2cccc(C(F)(F)F)c2)cc1	ZINC000819433798	FH	On-Demand	Anodyne	MAOB	19	60
COC[C@@H](O)CNc1ccc(OCc2cccc(C(F)(F)F)c2)cc1	ZINC000819433798	FH	On-Demand	Anodyne	FFAR1	22	49
COC[C@@H](O)CNc1ccc(OCc2cccc(C(F)(F)F)c2)cc1	ZINC000819433798	FH	On-Demand	Anodyne	ADCYAP1R1	36	42
COC[C@@H](O)CNc1ccc(OCc2cccc(C(F)(F)F)c2)cc1	ZINC000819433798	FH	On-Demand	Anodyne	PDS	45	39
COC[C@@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819433804	CD	On-Demand	Anodyne	NPY2R	71	37
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819433807	FF	On-Demand	Anodyne	ADRB2	23	44
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819433807	FF	On-Demand	Anodyne	ADRB1	32	40
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819433807	FF	On-Demand	Anodyne	NPY2R	61	38
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819433808	FF	On-Demand	Anodyne	ADRB2	23	44
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819433808	FF	On-Demand	Anodyne	ADRB1	32	40
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819433808	FF	On-Demand	Anodyne	NPY2R	61	38
N#Cc1cccc(COc2ccc(NCC3(O)CCS(=O)(=O)CC3)cc2)c1	ZINC000819433813	GE	On-Demand	Mild	MAOB	20	44
N#Cc1cccc(COc2ccc(NCC3(O)CCS(=O)(=O)CC3)cc2)c1	ZINC000819433813	GE	On-Demand	Mild	FFAR1	19	48
OC1(CNc2ccc(N3CCOCC3)c(F)c2)CCCC1	ZINC000819433814	CE	On-Demand	Anodyne	NPY2R	48	35
OC1(CNc2ccc(N3CCOCC3)c(F)c2)CCCC1	ZINC000819433814	CE	On-Demand	Anodyne	STAT6	40	33
Cc1cc(OCc2cccc(Cl)c2)ccc1NCCS(C)(=O)=O	ZINC000819433815	FH	On-Demand	Anodyne	MAOB	71	55
Cc1cc(OCc2cccc(Cl)c2)ccc1NCCS(C)(=O)=O	ZINC000819433815	FH	On-Demand	Anodyne	FFAR1	52	44
N#Cc1cccc(COc2ccc(NC[C@H](O)CN3CCCC3=O)cc2)c1	ZINC000819433816	FF	On-Demand	Mild	MAOB	21	47
N#Cc1cccc(COc2ccc(NC[C@@H](O)CN3CCCC3=O)cc2)c1	ZINC000819433817	FF	On-Demand	Mild	MAOB	21	47
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](O)CCOC(C)C	ZINC000819433823	FI	On-Demand	Mild	MAOB	17	43
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](O)CCOC(C)C	ZINC000819433823	FI	On-Demand	Mild	FFAR1	17	42
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](O)CCOC(C)C	ZINC000819433824	FI	On-Demand	Mild	MAOB	17	43
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](O)CCOC(C)C	ZINC000819433824	FI	On-Demand	Mild	FFAR1	17	42
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1[N+](=O)[O-]	ZINC000819433825	GG	On-Demand	Bother	NPY2R	71	38
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1[N+](=O)[O-]	ZINC000819433825	GG	On-Demand	Bother	MAPK9	32	43
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1[N+](=O)[O-]	ZINC000819433825	GG	On-Demand	Bother	MAPK10	28	43
CN(C[C@@H](O)CNc1ccc(N2CCOCC2)c(F)c1)C(=O)OC(C)(C)C	ZINC000819433831	GE	On-Demand	Anodyne	NPY2R	84	40
CN(C[C@H](O)CNc1ccc(N2CCOCC2)c(F)c1)C(=O)OC(C)(C)C	ZINC000819433832	GE	On-Demand	Anodyne	NPY2R	84	40
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccccc1	ZINC000819433839	DF	On-Demand	Anodyne	NPY2R	105	44
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccccc1	ZINC000819433839	DF	On-Demand	Anodyne	STAT6	42	32
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccccc1	ZINC000819433840	DF	On-Demand	Anodyne	NPY2R	105	44
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccccc1	ZINC000819433840	DF	On-Demand	Anodyne	STAT6	42	32
COc1ccc(O)c(NC(=O)C(F)=C2CCC2)c1	ZINC000819433845	CF	On-Demand	Anodyne	MTNR1A	18	40
COc1ccc(O)c(NC(=O)C(F)=C2CCC2)c1	ZINC000819433845	CF	On-Demand	Anodyne	MTNR1B	21	40
CSCCc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819433850	FG	On-Demand	Anodyne	ADRB2	19	45
CSCCc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819433851	FG	On-Demand	Anodyne	ADRB2	19	45
COC[C@@H](O)CNc1ccc(OCc2cccc(C#N)c2)cc1C	ZINC000819433856	EF	On-Demand	Mild	MAOB	27	47
COC[C@@H](O)CNc1ccc(OCc2cccc(C#N)c2)cc1C	ZINC000819433856	EF	On-Demand	Mild	FFAR1	26	44
O=C1CCCN1C[C@@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819433863	ED	On-Demand	Anodyne	NPY2R	59	35
O=C1CCCN1C[C@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819433864	ED	On-Demand	Anodyne	NPY2R	59	35
CCOC(=O)Cn1ccc2cc(NC[C@H](O)c3ccc(F)cc3)ccc21	ZINC000819433869	FG	On-Demand	Anodyne	RORC	26	42
CCOC(=O)Cn1ccc2cc(NC[C@@H](O)c3ccc(F)cc3)ccc21	ZINC000819433870	FG	On-Demand	Anodyne	RORC	26	42
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc2ccccc2c1	ZINC000819433880	GH	On-Demand	Anodyne	ADRB2	18	47
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc2ccccc2c1	ZINC000819433880	GH	On-Demand	Anodyne	NPY2R	62	35
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc2ccccc2c1	ZINC000819433880	GH	On-Demand	Anodyne	STAT6	43	32
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc2ccccc2c1	ZINC000819433882	GH	On-Demand	Anodyne	ADRB2	18	47
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc2ccccc2c1	ZINC000819433882	GH	On-Demand	Anodyne	NPY2R	62	35
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc2ccccc2c1	ZINC000819433882	GH	On-Demand	Anodyne	STAT6	43	32
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccc(F)c1	ZINC000819433884	FG	On-Demand	Anodyne	NPY2R	88	41
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccc(F)c1	ZINC000819433884	FG	On-Demand	Anodyne	EPHX2	21	41
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccc(F)c1	ZINC000819433884	FG	On-Demand	Anodyne	PIK3CB	21	52
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccc(F)c1	ZINC000819433884	FG	On-Demand	Anodyne	TAAR1	20	42
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccc(F)c1	ZINC000819433884	FG	On-Demand	Anodyne	STAT6	42	37
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819433885	GH	On-Demand	Anodyne	NPY2R	59	35
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819433887	GH	On-Demand	Anodyne	NPY2R	59	35
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](O)CC(F)(F)F	ZINC000819433900	FI	On-Demand	Mild	MAOB	20	44
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](O)CC(F)(F)F	ZINC000819433901	FI	On-Demand	Mild	MAOB	20	44
CON(C)C(=O)CCNc1ccc(OCc2cccc(C#N)c2)cc1C	ZINC000819433909	FG	On-Demand	Mild	MAOB	32	45
CON(C)C(=O)CCNc1ccc(OCc2cccc(C#N)c2)cc1C	ZINC000819433909	FG	On-Demand	Mild	FFAR1	56	38
Cc1cc(OCc2cccc(C#N)c2)ccc1NCC1(O)CCOCC1	ZINC000819433912	FG	On-Demand	Mild	ALOX5	15	45
Cc1cc(OCc2cccc(C#N)c2)ccc1NCC1(O)CCOCC1	ZINC000819433912	FG	On-Demand	Mild	MAOB	29	46
C#CCNC(=O)CCNc1ccc(N2CCC(OC)CC2)c(C(F)(F)F)c1	ZINC000819433913	GF	On-Demand	Mild	SERPINE1	23	40
C#CCNC(=O)CCNc1ccc(N2CCC(OC)CC2)c(C(F)(F)F)c1	ZINC000819433913	GF	On-Demand	Mild	LIPG	43	34
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc3[nH]c(=O)ccc3c2)CC1	ZINC000819433919	GF	On-Demand	Anodyne	GPR119	37	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc3[nH]c(=O)ccc3c2)CC1	ZINC000819433921	GF	On-Demand	Anodyne	GPR119	37	45
N#Cc1cccc(COc2ccc(NC[C@@H](O)CC(F)(F)F)cc2)c1	ZINC000819433924	FH	On-Demand	Mild	MAOB	15	41
N#Cc1cccc(COc2ccc(NC[C@H](O)CC(F)(F)F)cc2)c1	ZINC000819433932	FH	On-Demand	Mild	MAOB	15	41
CCOC(=O)Cn1ccc2cc(NCCS(=O)(=O)CC)ccc21	ZINC000819433935	EE	On-Demand	Anodyne	RORC	30	40
C[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)S(C)(=O)=O	ZINC000819433945	DD	On-Demand	Anodyne	NPY2R	67	36
CSCCc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819433946	DH	On-Demand	Anodyne	ADRB2	22	48
CSCCc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819433946	DH	On-Demand	Anodyne	ADRB1	15	43
CSCCc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819433946	DH	On-Demand	Anodyne	ADRB3	27	41
CSCCc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819433947	DH	On-Demand	Anodyne	ADRB2	22	48
CSCCc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819433947	DH	On-Demand	Anodyne	ADRB1	15	43
CSCCc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819433947	DH	On-Demand	Anodyne	ADRB3	27	41
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2ccccc12	ZINC000819433958	GH	On-Demand	Anodyne	ADRB2	22	46
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2ccccc12	ZINC000819433958	GH	On-Demand	Anodyne	ADRB1	30	46
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2ccccc12	ZINC000819433958	GH	On-Demand	Anodyne	NPY2R	58	35
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2ccccc12	ZINC000819433958	GH	On-Demand	Anodyne	ABCB1	32	41
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2ccccc12	ZINC000819433958	GH	On-Demand	Anodyne	MAPK9	19	40
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2ccccc12	ZINC000819433958	GH	On-Demand	Anodyne	MAPK10	17	40
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2ccccc12	ZINC000819433958	GH	On-Demand	Anodyne	STAT6	47	32
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2ccccc12	ZINC000819433959	GH	On-Demand	Anodyne	ADRB2	22	46
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2ccccc12	ZINC000819433959	GH	On-Demand	Anodyne	ADRB1	30	46
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2ccccc12	ZINC000819433959	GH	On-Demand	Anodyne	NPY2R	58	35
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2ccccc12	ZINC000819433959	GH	On-Demand	Anodyne	ABCB1	32	41
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2ccccc12	ZINC000819433959	GH	On-Demand	Anodyne	MAPK9	19	40
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2ccccc12	ZINC000819433959	GH	On-Demand	Anodyne	MAPK10	17	40
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2ccccc12	ZINC000819433959	GH	On-Demand	Anodyne	STAT6	47	32
CC(C)(C)OC(=O)NCCOc1cccc(NCC2(O)CCOCC2)c1	ZINC000819433960	FF	On-Demand	Anodyne	HRH2	24	46
CC(C)(C)OC(=O)NCCOc1cccc(NCC2(O)CCOCC2)c1	ZINC000819433960	FF	On-Demand	Anodyne	EPHX2	19	41
O=S(=O)(CCNc1ccc(N2CCOCC2)c(F)c1)c1ccccc1	ZINC000819433963	FF	On-Demand	Anodyne	PRKDC	28	43
O=S(=O)(CCNc1ccc(N2CCOCC2)c(F)c1)c1ccccc1	ZINC000819433963	FF	On-Demand	Anodyne	NPY2R	75	38
CC[C@H](O)CNc1ccc(OCc2cccc(C#N)c2)cc1	ZINC000819433966	CG	On-Demand	Mild	MAOB	29	46
CC[C@H](O)CNc1ccc(OCc2cccc(C#N)c2)cc1	ZINC000819433966	CG	On-Demand	Mild	FFAR1	24	50
CC[C@H](O)CNc1ccc(OCc2cccc(C#N)c2)cc1	ZINC000819433966	CG	On-Demand	Mild	PDS	25	43
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819433971	GF	On-Demand	Anodyne	ADRB1	21	50
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819433971	GF	On-Demand	Anodyne	HTR1A	16	50
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819433971	GF	On-Demand	Anodyne	SLC6A4	17	41
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819433972	GF	On-Demand	Anodyne	ADRB1	21	50
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819433972	GF	On-Demand	Anodyne	HTR1A	16	50
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819433972	GF	On-Demand	Anodyne	SLC6A4	17	41
Cn1c(=O)oc2cc(NC[C@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)ccc21	ZINC000819433983	GF	On-Demand	Anodyne	GPR119	35	43
Cn1c(=O)oc2cc(NC[C@@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)ccc21	ZINC000819433984	GF	On-Demand	Anodyne	GPR119	35	43
CN(CCC#N)C[C@@H](O)CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1	ZINC000819433993	GG	On-Demand	Mild	EGFR	27	40
CN(CCC#N)C[C@@H](O)CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1	ZINC000819433993	GG	On-Demand	Mild	ERBB2	48	40
CN(CCC#N)C[C@H](O)CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1	ZINC000819433994	GG	On-Demand	Mild	EGFR	27	40
CN(CCC#N)C[C@H](O)CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1	ZINC000819433994	GG	On-Demand	Mild	ERBB2	48	40
CON(C)C(=O)CCNc1ccc(OCc2cccc(F)c2)c(F)c1	ZINC000819434000	FG	On-Demand	Anodyne	EGFR	40	39
CON(C)C(=O)CCNc1ccc(OCc2cccc(F)c2)c(F)c1	ZINC000819434000	FG	On-Demand	Anodyne	ERBB2	63	40
CON(C)C(=O)CCNc1ccc(N2CCC(N(C)C)CC2)c(F)c1	ZINC000819434007	FE	On-Demand	Anodyne	NPY2R	83	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434010	GF	On-Demand	Anodyne	ADRB2	15	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434010	GF	On-Demand	Anodyne	ADRB1	38	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434010	GF	On-Demand	Anodyne	NPY2R	72	40
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434010	GF	On-Demand	Anodyne	ABCB1	22	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434011	GF	On-Demand	Anodyne	ADRB2	15	41
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434011	GF	On-Demand	Anodyne	ADRB1	38	41
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434011	GF	On-Demand	Anodyne	NPY2R	72	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434011	GF	On-Demand	Anodyne	ABCB1	22	42
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COC1CCOCC1	ZINC000819434018	FD	On-Demand	Anodyne	NPY2R	59	38
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COC1CCOCC1	ZINC000819434019	FD	On-Demand	Anodyne	NPY2R	59	38
N#Cc1cccc(COc2ccc(NC[C@H](O)C3CC3)cc2)c1	ZINC000819434022	DG	On-Demand	Mild	MAOB	17	44
CON(C)C(=O)CCNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434027	DD	On-Demand	Anodyne	NPY2R	73	38
CON(C)C(=O)CCNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434027	DD	On-Demand	Anodyne	EPHB4	47	31
CON(C)C(=O)CCNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434027	DD	On-Demand	Anodyne	STAT6	43	32
O[C@@H](CNc1ccc(NC2CCCCC2)cc1)c1cccnc1	ZINC000819434030	DH	On-Demand	Anodyne	ADRB1	28	42
O[C@@H](CNc1ccc(NC2CCCCC2)cc1)c1cccnc1	ZINC000819434030	DH	On-Demand	Anodyne	ADRB3	97	55
O[C@H](CNc1ccc(NC2CCCCC2)cc1)c1cccnc1	ZINC000819434031	DH	On-Demand	Anodyne	ADRB1	28	42
O[C@H](CNc1ccc(NC2CCCCC2)cc1)c1cccnc1	ZINC000819434031	DH	On-Demand	Anodyne	ADRB3	97	55
N#Cc1cccc(COc2ccc(NC[C@@H](O)C3CC3)cc2)c1	ZINC000819434041	DG	On-Demand	Mild	MAOB	17	44
CSCCc1ccc(NC[C@@H](O)c2ccc(C)cc2)cc1	ZINC000819434048	DI	On-Demand	Anodyne	ADRB2	17	54
CSCCc1ccc(NC[C@H](O)c2ccc(C)cc2)cc1	ZINC000819434049	DI	On-Demand	Anodyne	ADRB2	17	54
O[C@H](CNc1cccc(SC(F)F)c1)COc1ccc(F)cc1	ZINC000819434069	EH	On-Demand	Anodyne	ADRB2	34	41
O[C@H](CNc1cccc(SC(F)F)c1)COc1ccc(F)cc1	ZINC000819434069	EH	On-Demand	Anodyne	ADRB1	47	41
O[C@H](CNc1cccc(SC(F)F)c1)COc1ccc(F)cc1	ZINC000819434069	EH	On-Demand	Anodyne	ADRB3	28	41
O[C@@H](CNc1cccc(SC(F)F)c1)COc1ccc(F)cc1	ZINC000819434070	EH	On-Demand	Anodyne	ADRB2	34	41
O[C@@H](CNc1cccc(SC(F)F)c1)COc1ccc(F)cc1	ZINC000819434070	EH	On-Demand	Anodyne	ADRB1	47	41
O[C@@H](CNc1cccc(SC(F)F)c1)COc1ccc(F)cc1	ZINC000819434070	EH	On-Demand	Anodyne	ADRB3	28	41
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)c2ccccc2F)c1	ZINC000819434076	GH	On-Demand	Anodyne	HRH2	17	42
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)c2ccccc2F)c1	ZINC000819434076	GH	On-Demand	Anodyne	PDS	74	35
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](O)C1CC1	ZINC000819434077	DH	On-Demand	Mild	MAOB	26	45
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](O)C1CC1	ZINC000819434077	DH	On-Demand	Mild	FFAR1	40	36
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)c2ccccc2F)c1	ZINC000819434078	GH	On-Demand	Anodyne	HRH2	17	42
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)c2ccccc2F)c1	ZINC000819434078	GH	On-Demand	Anodyne	PDS	74	35
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](O)C1CC1	ZINC000819434079	DH	On-Demand	Mild	MAOB	26	45
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](O)C1CC1	ZINC000819434079	DH	On-Demand	Mild	FFAR1	40	36
OC1(CNc2ccc(N3CCOCC3)c(F)c2)CCC1	ZINC000819434080	CD	On-Demand	Anodyne	NPY2R	48	33
OC1(CNc2ccc(N3CCOCC3)c(F)c2)CCC1	ZINC000819434080	CD	On-Demand	Anodyne	STAT6	40	33
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)CC1CCCC1	ZINC000819434083	DG	On-Demand	Anodyne	NPY2R	72	40
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)CC1CCCC1	ZINC000819434084	DG	On-Demand	Anodyne	NPY2R	72	40
CSCCc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819434085	EH	On-Demand	Bother	ADRB2	16	44
CSCCc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819434085	EH	On-Demand	Bother	ADRB1	18	40
CSCCc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819434085	EH	On-Demand	Bother	ADRB3	29	40
CSCCc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819434087	EH	On-Demand	Bother	ADRB2	16	44
CSCCc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819434087	EH	On-Demand	Bother	ADRB1	18	40
CSCCc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819434087	EH	On-Demand	Bother	ADRB3	29	40
CC(C)(C)[C@@H](O)CNc1ccc(OCc2cccc(C#N)c2)cc1	ZINC000819434089	DH	On-Demand	Mild	MAOB	26	46
CC(C)(C)[C@@H](O)CNc1ccc(OCc2cccc(C#N)c2)cc1	ZINC000819434089	DH	On-Demand	Mild	FFAR1	22	50
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)Cc1ccc(C(F)(F)F)cc1	ZINC000819434096	GH	On-Demand	Anodyne	NPY2R	46	34
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)Cc1ccc(C(F)(F)F)cc1	ZINC000819434099	GH	On-Demand	Anodyne	NPY2R	46	34
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc(Cl)cc1	ZINC000819434101	GG	On-Demand	Anodyne	ADRB2	15	40
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc(Cl)cc1	ZINC000819434101	GG	On-Demand	Anodyne	ADRB1	26	40
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc(Cl)cc1	ZINC000819434101	GG	On-Demand	Anodyne	GRIN1	22	41
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc(Cl)cc1	ZINC000819434101	GG	On-Demand	Anodyne	NPY2R	49	37
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc(Cl)cc1	ZINC000819434103	GG	On-Demand	Anodyne	ADRB2	15	40
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc(Cl)cc1	ZINC000819434103	GG	On-Demand	Anodyne	ADRB1	26	40
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc(Cl)cc1	ZINC000819434103	GG	On-Demand	Anodyne	GRIN1	22	41
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc(Cl)cc1	ZINC000819434103	GG	On-Demand	Anodyne	NPY2R	49	37
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)CN1CCOCC1	ZINC000819434108	EC	On-Demand	Anodyne	NPY2R	68	37
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)CN1CCOCC1	ZINC000819434109	EC	On-Demand	Anodyne	NPY2R	68	37
CON(C)C(=O)CCNc1ccc(OCc2cccc(C#N)c2)cc1	ZINC000819434113	EF	On-Demand	Mild	MAOB	34	44
CON(C)C(=O)CCNc1ccc(OCc2cccc(C#N)c2)cc1	ZINC000819434113	EF	On-Demand	Mild	FFAR1	38	53
CN(CCC#N)C[C@@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434117	ED	On-Demand	Mild	NPY2R	58	38
OC1(CNc2ccc(OCc3cccc(C(F)(F)F)c3)cc2)CCOCC1	ZINC000819434118	GI	On-Demand	Anodyne	MAOB	15	42
OC1(CNc2ccc(OCc3cccc(C(F)(F)F)c3)cc2)CCOCC1	ZINC000819434118	GI	On-Demand	Anodyne	ADCYAP1R1	34	41
CN(CCC#N)C[C@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434119	ED	On-Demand	Mild	NPY2R	58	38
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cc1	ZINC000819434120	EF	On-Demand	Anodyne	NPY2R	64	37
O[C@H](CNc1cccc(SC(F)F)c1)COc1ccccc1	ZINC000819434121	EH	On-Demand	Anodyne	ADRB2	38	46
O[C@H](CNc1cccc(SC(F)F)c1)COc1ccccc1	ZINC000819434121	EH	On-Demand	Anodyne	ADRB1	51	46
O[C@H](CNc1cccc(SC(F)F)c1)COc1ccccc1	ZINC000819434121	EH	On-Demand	Anodyne	ADRB3	35	46
O[C@H](CNc1cccc(SC(F)F)c1)COc1ccccc1	ZINC000819434121	EH	On-Demand	Anodyne	PDS	57	36
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cc1	ZINC000819434122	EF	On-Demand	Anodyne	NPY2R	64	37
O[C@@H](CNc1cccc(SC(F)F)c1)COc1ccccc1	ZINC000819434123	EH	On-Demand	Anodyne	ADRB2	38	46
O[C@@H](CNc1cccc(SC(F)F)c1)COc1ccccc1	ZINC000819434123	EH	On-Demand	Anodyne	ADRB1	51	46
O[C@@H](CNc1cccc(SC(F)F)c1)COc1ccccc1	ZINC000819434123	EH	On-Demand	Anodyne	ADRB3	35	46
O[C@@H](CNc1cccc(SC(F)F)c1)COc1ccccc1	ZINC000819434123	EH	On-Demand	Anodyne	PDS	57	36
Cc1ccccc1[C@@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434131	EG	On-Demand	Anodyne	NPY2R	73	37
CCOc1ccc(OC[C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434150	GF	On-Demand	Anodyne	ADRB2	22	40
CCOc1ccc(OC[C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434150	GF	On-Demand	Anodyne	ADRB1	32	40
CCOc1ccc(OC[C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434150	GF	On-Demand	Anodyne	NPY2R	69	45
CSc1ccc(OC[C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434151	GG	On-Demand	Anodyne	NPY2R	56	38
CCOc1ccc(OC[C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434152	GF	On-Demand	Anodyne	ADRB2	22	40
CCOc1ccc(OC[C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434152	GF	On-Demand	Anodyne	ADRB1	32	40
CCOc1ccc(OC[C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434152	GF	On-Demand	Anodyne	NPY2R	69	45
CSc1ccc(OC[C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434153	GG	On-Demand	Anodyne	NPY2R	56	38
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@H](O)CN1CCOCC1	ZINC000819434161	GF	On-Demand	Mild	MAOB	15	42
Cc1cc(OCc2cccc(C#N)c2)ccc1NC[C@@H](O)CN1CCOCC1	ZINC000819434163	GF	On-Demand	Mild	MAOB	15	42
COC[C@@H](O)CNc1ccc(O[C@@H](C)c2ccccc2)cc1C	ZINC000819434170	DH	On-Demand	Anodyne	CASR	27	42
COC[C@@H](O)CNc1ccc(O[C@H](C)c2ccccc2)cc1C	ZINC000819434172	DH	On-Demand	Anodyne	CASR	27	42
CCOc1cc(NC[C@H](O)c2cccnc2)ccc1C	ZINC000819434177	CF	On-Demand	Anodyne	ADRB2	33	44
CCOc1cc(NC[C@H](O)c2cccnc2)ccc1C	ZINC000819434177	CF	On-Demand	Anodyne	ADRB1	30	44
CCOc1cc(NC[C@H](O)c2cccnc2)ccc1C	ZINC000819434177	CF	On-Demand	Anodyne	ADRB3	95	45
CCOc1cc(NC[C@@H](O)c2cccnc2)ccc1C	ZINC000819434179	CF	On-Demand	Anodyne	ADRB2	33	44
CCOc1cc(NC[C@@H](O)c2cccnc2)ccc1C	ZINC000819434179	CF	On-Demand	Anodyne	ADRB1	30	44
CCOc1cc(NC[C@@H](O)c2cccnc2)ccc1C	ZINC000819434179	CF	On-Demand	Anodyne	ADRB3	95	45
CC(C)(C)[C@@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434180	CE	On-Demand	Anodyne	NPY2R	70	37
NC(=O)CCNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434189	CC	On-Demand	Anodyne	NPY2R	69	38
NC(=O)CCNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434189	CC	On-Demand	Anodyne	MAPK9	32	45
NC(=O)CCNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434189	CC	On-Demand	Anodyne	MAPK10	29	45
NC(=O)CCNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434189	CC	On-Demand	Anodyne	STAT6	61	39
CCOC[C@H](O)CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1	ZINC000819434191	FH	On-Demand	Mild	EGFR	37	42
CCOC[C@H](O)CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1	ZINC000819434191	FH	On-Demand	Mild	ERBB2	63	42
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)Cc1ccccc1C(F)(F)F	ZINC000819434199	GH	On-Demand	Anodyne	NPY2R	72	36
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)Cc1ccccc1C(F)(F)F	ZINC000819434199	GH	On-Demand	Anodyne	STAT6	23	40
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)Cc1ccccc1C(F)(F)F	ZINC000819434200	GH	On-Demand	Anodyne	NPY2R	72	36
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)Cc1ccccc1C(F)(F)F	ZINC000819434200	GH	On-Demand	Anodyne	STAT6	23	40
C[C@@H](CNc1ccc(OCc2cccc(F)c2)c(F)c1)S(C)(=O)=O	ZINC000819434203	FG	On-Demand	Anodyne	EGFR	45	42
C[C@@H](CNc1ccc(OCc2cccc(F)c2)c(F)c1)S(C)(=O)=O	ZINC000819434203	FG	On-Demand	Anodyne	ERBB2	67	42
CC(C)(C)OC(=O)NCCOc1cccc(NCC2(O)CCC2)c1	ZINC000819434204	EF	On-Demand	Anodyne	HRH2	30	50
CC(C)(C)OC(=O)NCCOc1cccc(NCC2(O)CCC2)c1	ZINC000819434204	EF	On-Demand	Anodyne	EPHX2	17	41
CCOC[C@H](O)CNc1ccc(N2CCC(N(C)C)CC2)c(F)c1	ZINC000819434206	EE	On-Demand	Anodyne	NPY2R	76	42
Cc1cc(OCc2cccc(C#N)c2)ccc1NCCS(C)(=O)=O	ZINC000819434229	EF	On-Demand	Mild	MAOB	59	52
Cc1cc(OCc2cccc(C#N)c2)ccc1NCCS(C)(=O)=O	ZINC000819434229	EF	On-Demand	Mild	FFAR1	45	38
N#Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434235	FE	On-Demand	Mild	NPY2R	34	41
N#Cc1ccc(OC[C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434236	FE	On-Demand	Mild	NPY2R	34	41
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)c2cccc(F)c2)c1	ZINC000819434249	GH	On-Demand	Anodyne	HRH2	15	42
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)c2cccc(F)c2)c1	ZINC000819434249	GH	On-Demand	Anodyne	PDS	53	38
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)c2cccc(F)c2)c1	ZINC000819434250	GH	On-Demand	Anodyne	HRH2	15	42
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)c2cccc(F)c2)c1	ZINC000819434250	GH	On-Demand	Anodyne	PDS	53	38
O[C@@H](CNc1ccc(OCc2cccc(F)c2)c(F)c1)C1CC1	ZINC000819434251	DH	On-Demand	Anodyne	ERBB2	52	39
O[C@H](CNc1ccc(OCc2cccc(F)c2)c(F)c1)C1CC1	ZINC000819434252	DH	On-Demand	Anodyne	ERBB2	52	39
Cc1cc(OCc2cccc(Cl)c2)ccc1NC[C@H](C#N)CCC#N	ZINC000819434256	FK	On-Demand	Mild	MAOB	37	54
Cc1cc(OCc2cccc(Cl)c2)ccc1NC[C@@H](C#N)CCC#N	ZINC000819434257	FK	On-Demand	Mild	MAOB	37	54
Cc1cc(OCc2cccc(Cl)c2)ccc1NC[C@@H](O)CN1CCCC1=O	ZINC000819434263	GH	On-Demand	Anodyne	MAOB	43	44
Cc1cc(OCc2cccc(Cl)c2)ccc1NC[C@@H](O)CN1CCCC1=O	ZINC000819434263	GH	On-Demand	Anodyne	FFAR1	18	41
Cc1cc(OCc2cccc(Cl)c2)ccc1NC[C@H](O)CN1CCCC1=O	ZINC000819434264	GH	On-Demand	Anodyne	MAOB	43	44
Cc1cc(OCc2cccc(Cl)c2)ccc1NC[C@H](O)CN1CCCC1=O	ZINC000819434264	GH	On-Demand	Anodyne	FFAR1	18	41
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc2c(c1)OCO2	ZINC000819434265	GE	On-Demand	Anodyne	NPY2R	44	36
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc2c(c1)OCO2	ZINC000819434266	GE	On-Demand	Anodyne	NPY2R	44	36
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)Cc1ccccc1	ZINC000819434275	EF	On-Demand	Anodyne	NPY2R	89	40
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)Cc1ccccc1	ZINC000819434275	EF	On-Demand	Anodyne	STAT6	46	33
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)Cc1ccccc1	ZINC000819434276	EF	On-Demand	Anodyne	NPY2R	89	40
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)Cc1ccccc1	ZINC000819434276	EF	On-Demand	Anodyne	STAT6	46	33
CN(CCC#N)C[C@H](O)CNc1ccc(N2CCC(N(C)C)CC2)c(F)c1	ZINC000819434277	GD	On-Demand	Mild	NPY2R	61	38
CN(CCC#N)C[C@@H](O)CNc1ccc(N2CCC(N(C)C)CC2)c(F)c1	ZINC000819434278	GD	On-Demand	Mild	NPY2R	61	38
CCOC[C@H](O)CNc1ccc(OCc2cccc(C#N)c2)cc1	ZINC000819434285	EF	On-Demand	Mild	MAOB	18	43
CCOC[C@H](O)CNc1ccc(OCc2cccc(C#N)c2)cc1	ZINC000819434285	EF	On-Demand	Mild	FFAR1	21	47
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1	ZINC000819434291	EG	On-Demand	Anodyne	NPY2R	117	43
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1	ZINC000819434291	EG	On-Demand	Anodyne	PIK3CA	28	45
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1	ZINC000819434291	EG	On-Demand	Anodyne	PIK3CD	16	47
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1	ZINC000819434291	EG	On-Demand	Anodyne	MTOR	44	45
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1	ZINC000819434291	EG	On-Demand	Anodyne	MAPK9	25	42
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1	ZINC000819434291	EG	On-Demand	Anodyne	MAPK10	22	42
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1	ZINC000819434291	EG	On-Demand	Anodyne	EPHX2	25	43
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1	ZINC000819434291	EG	On-Demand	Anodyne	PIK3CG	28	45
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1	ZINC000819434291	EG	On-Demand	Anodyne	PIK3CB	25	47
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1	ZINC000819434291	EG	On-Demand	Anodyne	STAT6	54	34
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1	ZINC000819434291	EG	On-Demand	Anodyne	DGAT1	19	49
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccc(F)c1	ZINC000819434292	EF	On-Demand	Anodyne	NPY2R	75	42
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccc(F)c1	ZINC000819434293	EF	On-Demand	Anodyne	NPY2R	75	42
CC(C)(C)OC(=O)NCCOc1cccc(NCC2(O)CCCC2)c1	ZINC000819434294	FG	On-Demand	Anodyne	HRH2	30	50
CC(C)(C)OC(=O)NCCOc1cccc(NCC2(O)CCCC2)c1	ZINC000819434294	FG	On-Demand	Anodyne	MTNR1A	15	42
CC(C)(C)OC(=O)NCCOc1cccc(NCC2(O)CCCC2)c1	ZINC000819434294	FG	On-Demand	Anodyne	EPHX2	17	41
COC[C@@H](O)CNc1ccc(N2CCC(N(C)C)CC2)c(F)c1	ZINC000819434295	ED	On-Demand	Anodyne	NPY2R	76	42
CCOC[C@H](O)CNc1ccc(OCc2cccc(C(F)(F)F)c2)cc1	ZINC000819434304	FI	On-Demand	Anodyne	FFAR1	19	47
CCOC[C@H](O)CNc1ccc(OCc2cccc(C(F)(F)F)c2)cc1	ZINC000819434304	FI	On-Demand	Anodyne	ADCYAP1R1	36	42
CCOC[C@H](O)CNc1ccc(OCc2cccc(C(F)(F)F)c2)cc1	ZINC000819434304	FI	On-Demand	Anodyne	PDS	45	40
O=C1CCCN1C[C@@H](O)CNc1ccc(OCc2cccc(F)c2)c(F)c1	ZINC000819434311	GF	On-Demand	Anodyne	ERBB2	46	36
O=C1CCCN1C[C@H](O)CNc1ccc(OCc2cccc(F)c2)c(F)c1	ZINC000819434312	GF	On-Demand	Anodyne	ERBB2	46	36
N#Cc1cccc(COc2ccc(NCC3(O)CCC3)cc2Cl)c1	ZINC000819434315	EI	On-Demand	Mild	EGFR	39	42
N#Cc1cccc(COc2ccc(NCC3(O)CCC3)cc2Cl)c1	ZINC000819434315	EI	On-Demand	Mild	ERBB2	66	42
CC(C)(C)OC(=O)NCCOc1cccc(NCCC#N)c1	ZINC000819434316	DF	On-Demand	Mild	HRH2	25	45
CC(C)(C)OC(=O)NCCOc1cccc(NCCC#N)c1	ZINC000819434316	DF	On-Demand	Mild	PAPA1_CARPA	34	40
CC(C)(C)OC(=O)NCCOc1cccc(NCCC#N)c1	ZINC000819434316	DF	On-Demand	Mild	MTNR1A	15	43
CC(C)(C)OC(=O)NCCOc1cccc(NCCC#N)c1	ZINC000819434316	DF	On-Demand	Mild	PDS	45	34
C[C@@H](CNc1ccc(OCc2cccc(C#N)c2)cc1)S(C)(=O)=O	ZINC000819434320	EF	On-Demand	Mild	MAOB	31	49
C[C@@H](CNc1ccc(OCc2cccc(C#N)c2)cc1)S(C)(=O)=O	ZINC000819434320	EF	On-Demand	Mild	ADAMTS4	24	55
C[C@@H](CNc1ccc(OCc2cccc(C#N)c2)cc1)S(C)(=O)=O	ZINC000819434320	EF	On-Demand	Mild	FFAR1	23	48
COC[C@@H](O)CNc1ccc(OCc2cccc(Cl)c2)cc1C	ZINC000819434322	EH	On-Demand	Anodyne	MAOB	46	65
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819434324	GE	On-Demand	Bother	NPY2R	48	34
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819434325	GE	On-Demand	Bother	NPY2R	48	34
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cc(F)cc(F)c1	ZINC000819434329	GG	On-Demand	Anodyne	NPY2R	71	38
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cc(F)cc(F)c1	ZINC000819434329	GG	On-Demand	Anodyne	PIK3CB	27	42
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cc(F)cc(F)c1	ZINC000819434329	GG	On-Demand	Anodyne	STAT6	42	36
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2ccc3[nH]c(=O)ccc3c2)CC1	ZINC000819434331	GG	On-Demand	Anodyne	GPR119	20	41
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2ccc3[nH]c(=O)ccc3c2)CC1	ZINC000819434332	GG	On-Demand	Anodyne	GPR119	20	41
C[C@@H](CNc1ccc(N2CCC(N(C)C)CC2)c(F)c1)S(C)(=O)=O	ZINC000819434336	FE	On-Demand	Anodyne	NPY2R	71	40
CCOC[C@H](O)CNc1ccc(OCc2cccc(F)c2)cc1C	ZINC000819434338	EH	On-Demand	Anodyne	MAOB	24	42
CC[C@H](O)CNc1ccc(OCc2cccc(F)c2)c(F)c1	ZINC000819434339	DH	On-Demand	Anodyne	EGFR	39	42
CC[C@H](O)CNc1ccc(OCc2cccc(F)c2)c(F)c1	ZINC000819434339	DH	On-Demand	Anodyne	ERBB2	60	42
CON(C)C(=O)CCNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1	ZINC000819434341	FH	On-Demand	Mild	EGFR	57	46
CON(C)C(=O)CCNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1	ZINC000819434341	FH	On-Demand	Mild	ERBB2	89	46
O=S1(=O)CCC(O)(CNc2ccc(OCc3cccc(F)c3)c(F)c2)CC1	ZINC000819434342	GF	On-Demand	Anodyne	ERBB2	53	37
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1c(F)cccc1F	ZINC000819434344	FG	On-Demand	Anodyne	NPY2R	64	36
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1c(F)cccc1F	ZINC000819434345	FG	On-Demand	Anodyne	NPY2R	64	36
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccc(Cl)cc1	ZINC000819434352	FG	On-Demand	Anodyne	NPY2R	62	41
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819434353	FH	On-Demand	Anodyne	NPY2R	56	36
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819434354	FH	On-Demand	Anodyne	NPY2R	56	36
N#Cc1cccc(COc2ccc(NC[C@@H](O)C3CC3)cc2Cl)c1	ZINC000819434359	EH	On-Demand	Mild	EGFR	34	41
N#Cc1cccc(COc2ccc(NC[C@@H](O)C3CC3)cc2Cl)c1	ZINC000819434359	EH	On-Demand	Mild	ERBB2	59	41
N#Cc1cccc(COc2ccc(NC[C@H](O)C3CC3)cc2Cl)c1	ZINC000819434360	EH	On-Demand	Mild	EGFR	34	41
N#Cc1cccc(COc2ccc(NC[C@H](O)C3CC3)cc2Cl)c1	ZINC000819434360	EH	On-Demand	Mild	ERBB2	59	41
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)c(F)c1	ZINC000819434363	FG	On-Demand	Anodyne	NPY2R	61	35
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)c(F)c1	ZINC000819434364	FG	On-Demand	Anodyne	NPY2R	61	35
CC[C@H](O)CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1	ZINC000819434378	EH	On-Demand	Mild	EGFR	48	43
CC[C@H](O)CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1	ZINC000819434378	EH	On-Demand	Mild	ERBB2	80	43
CCOC(=O)CC[C@H](O)CNc1ccc(N2CCC(N(C)C)CC2)c(F)c1	ZINC000819434380	GE	On-Demand	Anodyne	NPY2R	88	43
CCOC(=O)CC[C@@H](O)CNc1ccc(N2CCC(N(C)C)CC2)c(F)c1	ZINC000819434381	GE	On-Demand	Anodyne	NPY2R	88	43
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1Cl	ZINC000819434387	GG	On-Demand	Anodyne	NPY2R	75	37
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1Cl	ZINC000819434387	GG	On-Demand	Anodyne	MAPK9	32	44
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1Cl	ZINC000819434387	GG	On-Demand	Anodyne	MAPK10	29	44
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1Cl	ZINC000819434388	GG	On-Demand	Anodyne	NPY2R	75	37
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1Cl	ZINC000819434388	GG	On-Demand	Anodyne	MAPK9	32	44
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1Cl	ZINC000819434388	GG	On-Demand	Anodyne	MAPK10	29	44
OC1(CNc2ccc(OCc3cccc(F)c3)c(F)c2)CCOCC1	ZINC000819434397	EG	On-Demand	Anodyne	EGFR	36	41
OC1(CNc2ccc(OCc3cccc(F)c3)c(F)c2)CCOCC1	ZINC000819434397	EG	On-Demand	Anodyne	ERBB2	58	41
CN(C[C@@H](O)CNc1ccc(OCc2cccc(C#N)c2)cc1)C1CC1	ZINC000819434400	FG	On-Demand	Mild	MAOB	15	40
CN(C[C@H](O)CNc1ccc(OCc2cccc(C#N)c2)cc1)C1CC1	ZINC000819434401	FG	On-Demand	Mild	MAOB	15	40
COC[C@@H](O)CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1	ZINC000819434402	EG	On-Demand	Mild	EGFR	41	41
COC[C@@H](O)CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1	ZINC000819434402	EG	On-Demand	Mild	ERBB2	66	41
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)C(C)(C)C)c1	ZINC000819434412	FG	On-Demand	Anodyne	HRH2	23	45
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)C(C)(C)C)c1	ZINC000819434412	FG	On-Demand	Anodyne	MTNR1A	21	43
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)C(C)(C)C)c1	ZINC000819434412	FG	On-Demand	Anodyne	MTNR1B	18	43
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)C(C)(C)C)c1	ZINC000819434412	FG	On-Demand	Anodyne	PDS	65	34
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)C(C)(C)C)c1	ZINC000819434413	FG	On-Demand	Anodyne	HRH2	23	45
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)C(C)(C)C)c1	ZINC000819434413	FG	On-Demand	Anodyne	MTNR1A	21	43
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)C(C)(C)C)c1	ZINC000819434413	FG	On-Demand	Anodyne	MTNR1B	18	43
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)C(C)(C)C)c1	ZINC000819434413	FG	On-Demand	Anodyne	PDS	65	34
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)C2CC2)c1	ZINC000819434418	EF	On-Demand	Anodyne	HRH2	23	44
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)C2CC2)c1	ZINC000819434418	EF	On-Demand	Anodyne	MTNR1A	16	40
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)C2CC2)c1	ZINC000819434418	EF	On-Demand	Anodyne	PDS	48	32
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)C2CC2)c1	ZINC000819434419	EF	On-Demand	Anodyne	HRH2	23	44
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)C2CC2)c1	ZINC000819434419	EF	On-Demand	Anodyne	MTNR1A	16	40
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)C2CC2)c1	ZINC000819434419	EF	On-Demand	Anodyne	PDS	48	32
Cc1c(F)cccc1NC(=O)CCNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434420	GH	On-Demand	Anodyne	PRKDC	41	33
Cc1c(F)cccc1NC(=O)CCNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434420	GH	On-Demand	Anodyne	NPY2R	84	38
Cc1c(F)cccc1NC(=O)CCNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434420	GH	On-Demand	Anodyne	MAPK9	32	42
Cc1c(F)cccc1NC(=O)CCNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434420	GH	On-Demand	Anodyne	MAPK10	29	42
O[C@H](CNc1ccc(OCc2cccc(F)c2)c(F)c1)COC1CCOCC1	ZINC000819434422	GH	On-Demand	Anodyne	ERBB2	45	35
O[C@@H](CNc1ccc(OCc2cccc(F)c2)c(F)c1)COC1CCOCC1	ZINC000819434423	GH	On-Demand	Anodyne	ERBB2	45	35
Cc1cc(OCc2cccc(Cl)c2)ccc1NC[C@H](C)S(C)(=O)=O	ZINC000819434424	FI	On-Demand	Anodyne	MAOB	55	46
Cc1cc(OCc2cccc(Cl)c2)ccc1NC[C@H](C)S(C)(=O)=O	ZINC000819434424	FI	On-Demand	Anodyne	ADAMTS4	20	48
Cc1cc(OCc2cccc(Cl)c2)ccc1NC[C@@H](C)S(C)(=O)=O	ZINC000819434425	FI	On-Demand	Anodyne	MAOB	55	46
Cc1cc(OCc2cccc(Cl)c2)ccc1NC[C@@H](C)S(C)(=O)=O	ZINC000819434425	FI	On-Demand	Anodyne	ADAMTS4	20	48
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819434428	GH	On-Demand	Anodyne	NPY2R	76	37
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccccc1C(F)(F)F	ZINC000819434429	GH	On-Demand	Anodyne	NPY2R	76	37
O=C(O)CCCNC(=O)NCC(=O)Nc1ccc(Cl)cc1	ZINC000819434433	DD	On-Demand	Anodyne	FOLH1	15	52
O=C(O)CCCNC(=O)NCC(=O)Nc1ccc(Cl)cc1	ZINC000819434433	DD	On-Demand	Anodyne	EPHX2	15	45
O=C(O)CCCNC(=O)NC1CCN(C(=O)C2CC2)CC1	ZINC000819434435	CC	On-Demand	Anodyne	EPHX2	36	53
O=C(O)CCCNC(=O)NC1CCC(N2CCCCC2)CC1	ZINC000819434436	DD	On-Demand	Anodyne	EPHX2	15	50
O=C(O)CCCNC(=O)NC1CCN(CC(F)(F)F)CC1	ZINC000819434437	DD	On-Demand	Anodyne	EPHX2	25	43
O=C(O)CCCNC(=O)NC1CCN(CC(F)(F)F)CC1	ZINC000819434437	DD	On-Demand	Anodyne	HPGDS	39	44
O=C(O)CCCNC(=O)NC[C@@H](O)c1ccccc1	ZINC000819434439	CC	On-Demand	Anodyne	FOLH1	29	41
O=C(O)CCCNC(=O)NC[C@@H](O)c1ccccc1	ZINC000819434439	CC	On-Demand	Anodyne	MME	28	49
O=C(O)CCCNC(=O)NC[C@@H](O)c1ccccc1	ZINC000819434439	CC	On-Demand	Anodyne	CAPN2	22	40
O=C(O)CCCNC(=O)NC[C@H](O)c1ccccc1	ZINC000819434440	CC	On-Demand	Anodyne	FOLH1	29	41
O=C(O)CCCNC(=O)NC[C@H](O)c1ccccc1	ZINC000819434440	CC	On-Demand	Anodyne	MME	28	49
O=C(O)CCCNC(=O)NC[C@H](O)c1ccccc1	ZINC000819434440	CC	On-Demand	Anodyne	CAPN2	22	40
O=C(O)CCCNC(=O)N[C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000819434441	EG	On-Demand	Anodyne	FOLH1	29	44
O=C(O)CCCNC(=O)N[C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000819434441	EG	On-Demand	Anodyne	MME	16	44
O=C(O)CCCNC(=O)N[C@H](c1ccccc1)c1ccc(F)cc1	ZINC000819434442	EG	On-Demand	Anodyne	FOLH1	29	44
O=C(O)CCCNC(=O)N[C@H](c1ccccc1)c1ccc(F)cc1	ZINC000819434442	EG	On-Demand	Anodyne	MME	16	44
O=C(O)CCCNC(=O)NCC(=O)NC1CCCCC1	ZINC000819434443	CC	On-Demand	Anodyne	EPHX2	21	55
O=C(O)CCCNC(=O)NC1CCN(C2CCCC2)CC1	ZINC000819434450	CD	On-Demand	Anodyne	EPHX2	19	51
O=C(O)CCCNC(=O)N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819434451	GF	On-Demand	Anodyne	OPRM1	30	47
O=C(O)CCCNC(=O)N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819434451	GF	On-Demand	Anodyne	OPRD1	33	47
O=C(O)CCCNC(=O)N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819434451	GF	On-Demand	Anodyne	MME	34	40
O=C(O)CCCNC(=O)N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819434451	GF	On-Demand	Anodyne	NAALAD2	28	41
O=C(O)CCCNC(=O)N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819434451	GF	On-Demand	Anodyne	GRIA1	55	38
O=C(O)CCCNC(=O)N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819434451	GF	On-Demand	Anodyne	F11	44	35
O=C(O)CCCNC(=O)N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819434451	GF	On-Demand	Anodyne	PTPN1	41	49
O=C(O)CCCNC(=O)N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819434452	GF	On-Demand	Anodyne	OPRM1	30	47
O=C(O)CCCNC(=O)N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819434452	GF	On-Demand	Anodyne	OPRD1	33	47
O=C(O)CCCNC(=O)N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819434452	GF	On-Demand	Anodyne	MME	34	40
O=C(O)CCCNC(=O)N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819434452	GF	On-Demand	Anodyne	NAALAD2	28	41
O=C(O)CCCNC(=O)N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819434452	GF	On-Demand	Anodyne	GRIA1	55	38
O=C(O)CCCNC(=O)N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819434452	GF	On-Demand	Anodyne	F11	44	35
O=C(O)CCCNC(=O)N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819434452	GF	On-Demand	Anodyne	PTPN1	41	49
O=C(O)CCCNC(=O)N[C@@H](CC1CC1)c1ccccc1	ZINC000819434453	CF	On-Demand	Anodyne	MME	21	42
O=C(O)CCCNC(=O)N[C@@H](CC1CC1)c1ccccc1	ZINC000819434453	CF	On-Demand	Anodyne	NPFFR1	42	35
O=C(O)CCCNC(=O)N[C@H](CC1CC1)c1ccccc1	ZINC000819434454	CF	On-Demand	Anodyne	MME	21	42
O=C(O)CCCNC(=O)N[C@H](CC1CC1)c1ccccc1	ZINC000819434454	CF	On-Demand	Anodyne	NPFFR1	42	35
O=C(O)CCCNC(=O)NCC(=O)Nc1ccc(Br)cc1	ZINC000819434455	FD	On-Demand	Anodyne	FOLH1	17	52
O=C(O)CCCNC(=O)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000819434456	DC	On-Demand	Anodyne	SLC18A3	31	40
O=C(O)CCCNC(=O)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000819434456	DC	On-Demand	Anodyne	EPHX2	23	44
O=C(O)CCCNC(=O)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000819434457	DC	On-Demand	Anodyne	SLC18A3	31	40
O=C(O)CCCNC(=O)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000819434457	DC	On-Demand	Anodyne	EPHX2	23	44
O=C(O)CCCNC(=O)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000819434458	DC	On-Demand	Anodyne	SLC18A3	31	40
O=C(O)CCCNC(=O)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000819434458	DC	On-Demand	Anodyne	EPHX2	23	44
O=C(O)CCCNC(=O)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000819434459	DC	On-Demand	Anodyne	SLC18A3	31	40
O=C(O)CCCNC(=O)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000819434459	DC	On-Demand	Anodyne	EPHX2	23	44
O=C(O)CCCNC(=O)N1CCN(Cc2cccnc2)CC1	ZINC000819434463	DC	On-Demand	Anodyne	TBXAS1	94	48
O=C(O)CCCNC(=O)N1CCN(Cc2cccnc2)CC1	ZINC000819434463	DC	On-Demand	Anodyne	PTAFR	29	55
O=C(O)CCCNC(=O)N1CCN(Cc2cccnc2)CC1	ZINC000819434463	DC	On-Demand	Anodyne	FAAH	33	45
O=C(O)CCCNC(=O)N1CCN(Cc2cccnc2)CC1	ZINC000819434463	DC	On-Demand	Anodyne	NAMPT	45	37
O=C(O)CCCNC(=O)NC1CCN(CC2CC2)CC1	ZINC000819434466	CD	On-Demand	Anodyne	EPHX2	16	45
O=C(O)CCCNC(=O)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000819434467	EE	On-Demand	Mild	FFAR1	23	40
O=C(O)CCCNC(=O)NCC(=O)Nc1ccccc1	ZINC000819434468	CC	On-Demand	Anodyne	MME	17	42
O=C(O)CCCNC(=O)NCC(=O)Nc1ccccc1	ZINC000819434468	CC	On-Demand	Anodyne	LTA4H	20	47
O=C(O)CCCNC(=O)NCC(=O)Nc1ccccc1	ZINC000819434468	CC	On-Demand	Anodyne	HDAC8	15	46
O=C(O)CCCNC(=O)NCC(=O)Nc1ccccc1	ZINC000819434468	CC	On-Demand	Anodyne	HDAC10	24	46
O=C(O)CCCNC(=O)NCC(=O)Nc1ccccc1	ZINC000819434468	CC	On-Demand	Anodyne	HDAC1	15	46
O=C(O)CCCNC(=O)NCC(=O)Nc1ccccc1	ZINC000819434468	CC	On-Demand	Anodyne	HDAC2	21	46
O=C(O)CCCNC(=O)NCC(=O)Nc1ccccc1	ZINC000819434468	CC	On-Demand	Anodyne	HDAC3	21	46
O=C(O)CCCNC(=O)NCC(=O)Nc1ccccc1	ZINC000819434468	CC	On-Demand	Anodyne	HDAC6	19	46
O=C(O)CCCNC(=O)NCC(=O)Nc1ccccc1	ZINC000819434468	CC	On-Demand	Anodyne	EPHX2	17	45
O=C(O)CCCNC(=O)NCC(=O)Nc1ccccc1	ZINC000819434468	CC	On-Demand	Anodyne	HDAC11	17	46
O=C(O)CCCNC(=O)N[C@@H](c1ccc(Cl)cc1)c1cccs1	ZINC000819434472	FH	On-Demand	Anodyne	FOLH1	22	43
O=C(O)CCCNC(=O)N[C@H](c1ccc(Cl)cc1)c1cccs1	ZINC000819434473	FH	On-Demand	Anodyne	FOLH1	22	43
O=C(O)CCCNC(=O)N[C@@H](c1ccccc1)c1ccccn1	ZINC000819434475	DE	On-Demand	Anodyne	HRH2	19	42
O=C(O)CCCNC(=O)N[C@@H](c1ccccc1)c1ccccn1	ZINC000819434475	DE	On-Demand	Anodyne	C3AR1	40	33
O=C(O)CCCNC(=O)N[C@H](c1ccccc1)c1ccccn1	ZINC000819434476	DE	On-Demand	Anodyne	HRH2	19	42
O=C(O)CCCNC(=O)N[C@H](c1ccccc1)c1ccccn1	ZINC000819434476	DE	On-Demand	Anodyne	C3AR1	40	33
O=C(O)CCCNC(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000819434477	EC	On-Demand	Anodyne	SLC18A3	37	43
O=C(O)CCCNC(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000819434477	EC	On-Demand	Anodyne	EPHX2	27	47
O=C(O)CCCNC(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000819434478	EC	On-Demand	Anodyne	SLC18A3	37	43
O=C(O)CCCNC(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000819434478	EC	On-Demand	Anodyne	EPHX2	27	47
O=C(O)CCCNC(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000819434479	EC	On-Demand	Anodyne	SLC18A3	37	43
O=C(O)CCCNC(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000819434479	EC	On-Demand	Anodyne	EPHX2	27	47
O=C(O)CCCNC(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000819434480	EC	On-Demand	Anodyne	SLC18A3	37	43
O=C(O)CCCNC(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000819434480	EC	On-Demand	Anodyne	EPHX2	27	47
O=C(O)CCCNC(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819434482	EG	On-Demand	Anodyne	FOLH1	33	46
O=C(O)CCCNC(=O)NC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819434483	ED	On-Demand	Anodyne	SOAT1	15	40
O=C(O)CCCNC(=O)NC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819434484	ED	On-Demand	Anodyne	SOAT1	15	40
O=C(O)CCCNC(=O)NC1(c2ccc(Br)cc2)CC1	ZINC000819434485	EF	On-Demand	Anodyne	FOLH1	19	43
O=C(O)CCCNC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000819434487	FC	On-Demand	Anodyne	EPHX2	28	42
O=C(O)CCCNC(=O)NCC(=O)Nc1cccc(F)c1	ZINC000819434488	CC	On-Demand	Anodyne	KCNK3	18	40
O=C(O)CCCNC(=O)NC1CCN(CC(F)F)CC1	ZINC000819434491	CC	On-Demand	Anodyne	EPHX2	29	48
O=C(O)CCCNC(=O)N1CCN(Cc2ccncc2)CC1	ZINC000819434492	DC	On-Demand	Anodyne	FAAH	24	43
O=C(O)CCCNC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819434493	ED	On-Demand	Bother	SSTR1	44	47
O=C(O)CCCNC(=O)N[C@@H]1C[C@H]1Cc1ccccc1	ZINC000819434494	CD	On-Demand	Anodyne	MME	17	43
O=C(O)CCCNC(=O)N[C@@H]1C[C@H]1Cc1ccccc1	ZINC000819434494	CD	On-Demand	Anodyne	CCR3	15	41
O=C(O)CCCNC(=O)N[C@@H]1C[C@H]1Cc1ccccc1	ZINC000819434494	CD	On-Demand	Anodyne	EPHX2	17	43
O=C(O)CCCNC(=O)N[C@H]1C[C@H]1Cc1ccccc1	ZINC000819434495	CD	On-Demand	Anodyne	MME	17	43
O=C(O)CCCNC(=O)N[C@H]1C[C@H]1Cc1ccccc1	ZINC000819434495	CD	On-Demand	Anodyne	CCR3	15	41
O=C(O)CCCNC(=O)N[C@H]1C[C@H]1Cc1ccccc1	ZINC000819434495	CD	On-Demand	Anodyne	EPHX2	17	43
O=C(O)CCCNC(=O)N[C@@H]1C[C@@H]1Cc1ccccc1	ZINC000819434496	CD	On-Demand	Anodyne	MME	17	43
O=C(O)CCCNC(=O)N[C@@H]1C[C@@H]1Cc1ccccc1	ZINC000819434496	CD	On-Demand	Anodyne	CCR3	15	41
O=C(O)CCCNC(=O)N[C@@H]1C[C@@H]1Cc1ccccc1	ZINC000819434496	CD	On-Demand	Anodyne	EPHX2	17	43
O=C(O)CCCNC(=O)N[C@H]1C[C@@H]1Cc1ccccc1	ZINC000819434497	CD	On-Demand	Anodyne	MME	17	43
O=C(O)CCCNC(=O)N[C@H]1C[C@@H]1Cc1ccccc1	ZINC000819434497	CD	On-Demand	Anodyne	CCR3	15	41
O=C(O)CCCNC(=O)N[C@H]1C[C@@H]1Cc1ccccc1	ZINC000819434497	CD	On-Demand	Anodyne	EPHX2	17	43
O=C(O)CCCNC(=O)N[C@@H](c1cccc(Cl)c1)c1ccccn1	ZINC000819434498	EF	On-Demand	Anodyne	HRH2	16	41
O=C(O)CCCNC(=O)N[C@H](c1cccc(Cl)c1)c1ccccn1	ZINC000819434499	EF	On-Demand	Anodyne	HRH2	16	41
O=C(O)CCCNC(=O)NCC(=O)NCc1ccccc1	ZINC000819434502	CC	On-Demand	Anodyne	HRH2	15	42
O=C(O)CCCNC(=O)NCC(=O)NCc1ccccc1	ZINC000819434502	CC	On-Demand	Anodyne	FOLH1	24	41
O=C(O)CCCNC(=O)NCC(=O)NCc1ccccc1	ZINC000819434502	CC	On-Demand	Anodyne	MME	27	47
O=C(O)CCCNC(=O)NCC(=O)NCc1ccccc1	ZINC000819434502	CC	On-Demand	Anodyne	FURIN	53	38
O=C(O)CCCNC(=O)NCC(=O)NCc1ccccc1	ZINC000819434502	CC	On-Demand	Anodyne	POLG_WNV	41	34
O=C(O)CCCNC(=O)NCC(=O)NCc1ccccc1	ZINC000819434502	CC	On-Demand	Anodyne	NPFFR1	43	33
O=C(O)CCCNC(=O)NCC(=O)NCc1ccccc1	ZINC000819434502	CC	On-Demand	Anodyne	PDS	47	35
O=C(O)CCCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819434503	DD	On-Demand	Anodyne	DRD4	27	51
O=C(O)CCCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819434503	DD	On-Demand	Anodyne	ACHE	28	47
O=C(O)CCCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819434503	DD	On-Demand	Anodyne	HRH2	25	46
O=C(O)CCCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819434503	DD	On-Demand	Anodyne	SIGMAR1	32	52
O=C(O)CCCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819434503	DD	On-Demand	Anodyne	SSTR5	57	41
O=C(O)CCCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819434503	DD	On-Demand	Anodyne	CCR3	33	43
O=C(O)CCCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819434503	DD	On-Demand	Anodyne	SLC6A5	25	42
O=C(O)CCCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819434503	DD	On-Demand	Anodyne	EPHX2	29	46
O=C(O)CCCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819434503	DD	On-Demand	Anodyne	MCHR1	44	46
O=C(O)CCCNC(=O)NC1CCN(c2cccs2)CC1	ZINC000819434510	DD	On-Demand	Anodyne	EPHX2	29	41
O=C(O)CCCNC(=O)NCC(=O)NC1CCCC1	ZINC000819434511	CC	On-Demand	Anodyne	EPHX2	20	52
O=C(O)CCCNC(=O)N[C@@H](c1ccc(F)cc1)c1cccs1	ZINC000819434514	EG	On-Demand	Anodyne	FOLH1	24	43
O=C(O)CCCNC(=O)N[C@H](c1ccc(F)cc1)c1cccs1	ZINC000819434515	EG	On-Demand	Anodyne	FOLH1	24	43
O=C(O)CCCNC(=O)N1CCN(Cc2nc(O)c3ccccc3n2)CC1	ZINC000819434517	FD	On-Demand	Anodyne	HTR7	21	46
O=C(O)CCCNC(=O)N1CCN(Cc2nc(O)c3ccccc3n2)CC1	ZINC000819434517	FD	On-Demand	Anodyne	BCHE	47	33
O=C(O)CCCNC(=O)N1CCN(Cc2nc(O)c3ccccc3n2)CC1	ZINC000819434517	FD	On-Demand	Anodyne	TNKS	46	32
O=C(O)CCCNC(=O)NC1CCN(C2CC2)CC1	ZINC000819434522	CC	On-Demand	Anodyne	EPHX2	21	47
O=C(O)CCCNC(=O)NC1CCN(CC2CCCCC2)CC1	ZINC000819434523	EE	On-Demand	Anodyne	EPHX2	19	51
O=C(O)CCCNC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000819434525	DD	On-Demand	Anodyne	DRD4	21	59
O=C(O)CCCNC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000819434525	DD	On-Demand	Anodyne	HRH2	23	44
O=C(O)CCCNC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000819434525	DD	On-Demand	Anodyne	SIGMAR1	22	46
O=C(O)CCCNC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000819434525	DD	On-Demand	Anodyne	SSTR5	52	39
O=C(O)CCCNC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000819434525	DD	On-Demand	Anodyne	CCR3	20	41
O=C(O)CCCNC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000819434525	DD	On-Demand	Anodyne	EPHX2	27	44
O=C(O)CCCNC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000819434525	DD	On-Demand	Anodyne	MCHR1	30	40
O=C(O)CCCNC(=O)N1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000819434529	GE	On-Demand	Anodyne	HRH2	22	43
O=C(O)CCCNC(=O)N1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000819434529	GE	On-Demand	Anodyne	GCGR	41	44
O=C(O)CCCNC(=O)N1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000819434529	GE	On-Demand	Anodyne	LTA4H	27	40
O=C(O)CCCNC(=O)N1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000819434529	GE	On-Demand	Anodyne	FAAH	21	47
O=C(O)CCCNC(=O)N1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000819434529	GE	On-Demand	Anodyne	EPHX2	44	38
O=C(O)CCCNC(=O)N1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000819434529	GE	On-Demand	Anodyne	NOD2	17	42
O=C(O)CCCNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000819434531	FD	On-Demand	Anodyne	DRD4	31	53
O=C(O)CCCNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000819434531	FD	On-Demand	Anodyne	LTA4H	19	41
O=C(O)CCCNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000819434531	FD	On-Demand	Anodyne	SIGMAR1	18	45
O=C(O)CCCNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000819434531	FD	On-Demand	Anodyne	CCR3	40	48
O=C(O)CCCNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000819434531	FD	On-Demand	Anodyne	EPHX2	45	46
O=C(O)CCCNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000819434531	FD	On-Demand	Anodyne	CXCR3	16	41
Cc1cc(OCc2cccc(Cl)c2)ccc1NC[C@H](O)CN(C)CCC#N	ZINC000819434535	GH	On-Demand	Mild	MAOB	36	48
Cc1cc(OCc2cccc(Cl)c2)ccc1NC[C@@H](O)CN(C)CCC#N	ZINC000819434536	GH	On-Demand	Mild	MAOB	36	48
C#CCNC(=O)CCNc1ccc(OCc2cccc(F)c2)cc1C	ZINC000819434540	EG	On-Demand	Mild	MAOB	31	43
C#CCNC(=O)CCNc1ccc(OCc2cccc(F)c2)cc1C	ZINC000819434540	EG	On-Demand	Mild	FFAR1	59	38
OC1(CNc2ccc(N3CCOCC3)c(F)c2)CCOCC1	ZINC000819434545	DD	On-Demand	Anodyne	NPY2R	50	34
OC1(CNc2ccc(N3CCOCC3)c(F)c2)CCOCC1	ZINC000819434545	DD	On-Demand	Anodyne	STAT6	41	33
COC[C@@H](O)CNc1ccc(OCc2cccc(F)c2)c(F)c1	ZINC000819434553	DF	On-Demand	Anodyne	EGFR	40	40
COC[C@@H](O)CNc1ccc(OCc2cccc(F)c2)c(F)c1	ZINC000819434553	DF	On-Demand	Anodyne	ERBB2	60	40
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccc(Cl)c1	ZINC000819434560	GH	On-Demand	Anodyne	NPY2R	101	43
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccc(Cl)c1	ZINC000819434560	GH	On-Demand	Anodyne	MAPK9	24	41
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccc(Cl)c1	ZINC000819434560	GH	On-Demand	Anodyne	MAPK10	22	41
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccc(Cl)c1	ZINC000819434560	GH	On-Demand	Anodyne	EPHX2	25	42
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccc(Cl)c1	ZINC000819434560	GH	On-Demand	Anodyne	PIK3CB	19	51
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccc(Cl)c1	ZINC000819434560	GH	On-Demand	Anodyne	MCHR1	15	40
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccc(Cl)c1	ZINC000819434560	GH	On-Demand	Anodyne	TAAR1	23	42
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1cccc(Cl)c1	ZINC000819434560	GH	On-Demand	Anodyne	STAT6	44	33
O=C(O)CCCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819434562	ED	On-Demand	Anodyne	DRD4	35	44
O=C(O)CCCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819434562	ED	On-Demand	Anodyne	ACHE	31	43
O=C(O)CCCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819434562	ED	On-Demand	Anodyne	SIGMAR1	38	45
O=C(O)CCCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819434562	ED	On-Demand	Anodyne	CCR3	37	41
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)c(C)c1	ZINC000819434563	FG	On-Demand	Anodyne	NPY2R	50	33
O=C(O)CCCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819434564	ED	On-Demand	Anodyne	DRD4	35	44
O=C(O)CCCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819434564	ED	On-Demand	Anodyne	ACHE	31	43
O=C(O)CCCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819434564	ED	On-Demand	Anodyne	SIGMAR1	38	45
O=C(O)CCCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819434564	ED	On-Demand	Anodyne	CCR3	37	41
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)c(C)c1	ZINC000819434565	FG	On-Demand	Anodyne	NPY2R	50	33
O=C(O)CCCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819434566	ED	On-Demand	Anodyne	DRD4	35	44
O=C(O)CCCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819434566	ED	On-Demand	Anodyne	ACHE	31	43
O=C(O)CCCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819434566	ED	On-Demand	Anodyne	SIGMAR1	38	45
O=C(O)CCCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819434566	ED	On-Demand	Anodyne	CCR3	37	41
O=C(O)CCCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819434568	ED	On-Demand	Anodyne	DRD4	35	44
O=C(O)CCCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819434568	ED	On-Demand	Anodyne	ACHE	31	43
O=C(O)CCCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819434568	ED	On-Demand	Anodyne	SIGMAR1	38	45
O=C(O)CCCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819434568	ED	On-Demand	Anodyne	CCR3	37	41
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434572	GE	On-Demand	Anodyne	NPY2R	69	38
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434572	GE	On-Demand	Anodyne	SLC6A9	24	47
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434573	GE	On-Demand	Anodyne	NPY2R	69	38
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434573	GE	On-Demand	Anodyne	SLC6A9	24	47
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccccc1Br	ZINC000819434580	GH	On-Demand	Anodyne	NPY2R	60	35
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccccc1Br	ZINC000819434581	GH	On-Demand	Anodyne	NPY2R	60	35
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc(F)cc1	ZINC000819434592	FF	On-Demand	Anodyne	ADRB2	20	41
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc(F)cc1	ZINC000819434592	FF	On-Demand	Anodyne	ADRB1	32	41
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc(F)cc1	ZINC000819434592	FF	On-Demand	Anodyne	NPY2R	50	37
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc(F)cc1	ZINC000819434593	FF	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc(F)cc1	ZINC000819434593	FF	On-Demand	Anodyne	ADRB1	32	41
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccc(F)cc1	ZINC000819434593	FF	On-Demand	Anodyne	NPY2R	50	37
CN(C[C@H](O)CNc1ccc(OCc2cccc(F)c2)c(F)c1)C1CC1	ZINC000819434594	FG	On-Demand	Anodyne	ERBB2	51	39
CN(C[C@@H](O)CNc1ccc(OCc2cccc(F)c2)c(F)c1)C1CC1	ZINC000819434595	FG	On-Demand	Anodyne	ERBB2	51	39
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819434600	GH	On-Demand	Anodyne	NPY2R	77	36
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccc(C(F)(F)F)c1	ZINC000819434601	GH	On-Demand	Anodyne	NPY2R	77	36
N#Cc1cccc(COc2ccc(NC[C@@H](O)CC(F)(F)F)cc2Cl)c1	ZINC000819434610	GJ	On-Demand	Mild	EGFR	35	42
N#Cc1cccc(COc2ccc(NC[C@@H](O)CC(F)(F)F)cc2Cl)c1	ZINC000819434610	GJ	On-Demand	Mild	ERBB2	61	42
N#Cc1cccc(COc2ccc(NC[C@H](O)CC(F)(F)F)cc2Cl)c1	ZINC000819434611	GJ	On-Demand	Mild	EGFR	35	42
N#Cc1cccc(COc2ccc(NC[C@H](O)CC(F)(F)F)cc2Cl)c1	ZINC000819434611	GJ	On-Demand	Mild	ERBB2	61	42
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1F	ZINC000819434631	FG	On-Demand	Anodyne	PRKDC	49	35
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1F	ZINC000819434631	FG	On-Demand	Anodyne	KCNQ2	45	38
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1F	ZINC000819434631	FG	On-Demand	Anodyne	NPY2R	86	40
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1F	ZINC000819434631	FG	On-Demand	Anodyne	PIK3CA	16	42
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1F	ZINC000819434631	FG	On-Demand	Anodyne	MTOR	26	42
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1F	ZINC000819434631	FG	On-Demand	Anodyne	MAPK9	34	47
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1F	ZINC000819434631	FG	On-Demand	Anodyne	MAPK10	31	47
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1F	ZINC000819434631	FG	On-Demand	Anodyne	STAT6	49	35
O=C(CCNc1ccc(N2CCOCC2)c(F)c1)Nc1ccccc1F	ZINC000819434631	FG	On-Demand	Anodyne	DGAT1	26	57
O[C@H](CCc1ccccc1)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434632	EG	On-Demand	Anodyne	NPY2R	85	39
O[C@H](CCc1ccccc1)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434632	EG	On-Demand	Anodyne	STAT6	51	34
O[C@@H](CCc1ccccc1)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434633	EG	On-Demand	Anodyne	NPY2R	85	39
O[C@@H](CCc1ccccc1)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434633	EG	On-Demand	Anodyne	STAT6	51	34
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819434634	FF	On-Demand	Bother	NPY2R	67	37
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819434635	FF	On-Demand	Bother	NPY2R	67	37
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COCc1ccco1	ZINC000819434638	FE	On-Demand	Anodyne	NPY2R	46	33
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COCc1ccco1	ZINC000819434639	FE	On-Demand	Anodyne	NPY2R	46	33
CC[C@H](O)CNc1cccc(OCCNC(=O)OC(C)(C)C)c1	ZINC000819434640	DF	On-Demand	Anodyne	HRH2	22	44
CC[C@H](O)CNc1cccc(OCCNC(=O)OC(C)(C)C)c1	ZINC000819434640	DF	On-Demand	Anodyne	MTNR1A	21	43
CC[C@H](O)CNc1cccc(OCCNC(=O)OC(C)(C)C)c1	ZINC000819434640	DF	On-Demand	Anodyne	MTNR1B	17	43
CC[C@H](O)CNc1cccc(OCCNC(=O)OC(C)(C)C)c1	ZINC000819434640	DF	On-Demand	Anodyne	PDS	91	40
CN(C[C@@H](O)CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)C1CC1	ZINC000819434673	GH	On-Demand	Mild	EGFR	39	41
CN(C[C@@H](O)CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)C1CC1	ZINC000819434673	GH	On-Demand	Mild	ERBB2	66	41
CN(C[C@H](O)CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)C1CC1	ZINC000819434674	GH	On-Demand	Mild	EGFR	39	41
CN(C[C@H](O)CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)C1CC1	ZINC000819434674	GH	On-Demand	Mild	ERBB2	66	41
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@](C)(O)C(F)(F)F)c1	ZINC000819434675	GG	On-Demand	Anodyne	HRH2	24	46
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@](C)(O)C(F)(F)F)c1	ZINC000819434675	GG	On-Demand	Anodyne	MTNR1A	15	43
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@](C)(O)C(F)(F)F)c1	ZINC000819434675	GG	On-Demand	Anodyne	PDS	46	36
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@](C)(O)C(F)(F)F)c1	ZINC000819434676	GG	On-Demand	Anodyne	HRH2	24	46
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@](C)(O)C(F)(F)F)c1	ZINC000819434676	GG	On-Demand	Anodyne	MTNR1A	15	43
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@](C)(O)C(F)(F)F)c1	ZINC000819434676	GG	On-Demand	Anodyne	PDS	46	36
CC[C@H](O)CNc1ccc(N2CCC(N(C)C)CC2)c(F)c1	ZINC000819434678	DF	On-Demand	Anodyne	NPY2R	96	48
N#Cc1cccc(COc2ccc(NC[C@@H](O)CN3CCCC3=O)cc2Cl)c1	ZINC000819434700	GG	On-Demand	Mild	ERBB2	50	37
N#Cc1cccc(COc2ccc(NC[C@H](O)CN3CCCC3=O)cc2Cl)c1	ZINC000819434701	GG	On-Demand	Mild	ERBB2	50	37
CCOC[C@H](O)CNc1ccc(OCc2cccc(F)c2)c(F)c1	ZINC000819434705	EG	On-Demand	Anodyne	ERBB2	55	39
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)C(F)(F)F)c1	ZINC000819434708	FF	On-Demand	Anodyne	HRH2	20	43
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)C(F)(F)F)c1	ZINC000819434708	FF	On-Demand	Anodyne	MTNR1A	17	42
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)C(F)(F)F)c1	ZINC000819434708	FF	On-Demand	Anodyne	MTNR1B	15	42
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)C(F)(F)F)c1	ZINC000819434708	FF	On-Demand	Anodyne	PDS	71	40
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)C(F)(F)F)c1	ZINC000819434709	FF	On-Demand	Anodyne	HRH2	20	43
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)C(F)(F)F)c1	ZINC000819434709	FF	On-Demand	Anodyne	MTNR1A	17	42
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)C(F)(F)F)c1	ZINC000819434709	FF	On-Demand	Anodyne	MTNR1B	15	42
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)C(F)(F)F)c1	ZINC000819434709	FF	On-Demand	Anodyne	PDS	71	40
Cn1c(=O)oc2cc(NC[C@]3(O)CCCN(C(=O)OC(C)(C)C)CC3)ccc21	ZINC000819434718	GF	On-Demand	Anodyne	GPR119	18	40
Cn1c(=O)oc2cc(NC[C@@]3(O)CCCN(C(=O)OC(C)(C)C)CC3)ccc21	ZINC000819434719	GF	On-Demand	Anodyne	GPR119	18	40
CC[C@H](O)CNc1ccc(N2CCC(OC)CC2)c(C(F)(F)F)c1	ZINC000819434724	EH	On-Demand	Anodyne	LIPG	42	34
C[C@@H](CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)S(C)(=O)=O	ZINC000819434732	GH	On-Demand	Mild	EGFR	51	43
C[C@@H](CNc1ccc(OCc2cccc(C#N)c2)c(Cl)c1)S(C)(=O)=O	ZINC000819434732	GH	On-Demand	Mild	ERBB2	85	43
O=C1CCCc2cc(NC[C@H](O)c3cccnc3)ccc2N1	ZINC000819434733	CF	On-Demand	Anodyne	ADRB3	84	40
O=C1CCCc2cc(NC[C@@H](O)c3cccnc3)ccc2N1	ZINC000819434734	CF	On-Demand	Anodyne	ADRB3	84	40
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819434735	EF	On-Demand	Anodyne	ADRB2	32	41
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819434735	EF	On-Demand	Anodyne	ADRB1	46	39
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819434735	EF	On-Demand	Anodyne	NPY2R	80	38
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819434735	EF	On-Demand	Anodyne	MAPK9	24	41
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819434735	EF	On-Demand	Anodyne	MAPK10	22	41
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819434735	EF	On-Demand	Anodyne	STAT6	54	33
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819434736	EF	On-Demand	Anodyne	ADRB2	32	41
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819434736	EF	On-Demand	Anodyne	ADRB1	46	39
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819434736	EF	On-Demand	Anodyne	NPY2R	80	38
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819434736	EF	On-Demand	Anodyne	MAPK9	24	41
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819434736	EF	On-Demand	Anodyne	MAPK10	22	41
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1	ZINC000819434736	EF	On-Demand	Anodyne	STAT6	54	33
C[C@@](O)(CNc1ccc(OCc2cccc(C#N)c2)cc1)C(F)(F)F	ZINC000819434740	FH	On-Demand	Mild	MAOB	37	47
C[C@@](O)(CNc1ccc(OCc2cccc(C#N)c2)cc1)C(F)(F)F	ZINC000819434740	FH	On-Demand	Mild	FFAR1	20	49
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819434755	FH	On-Demand	Anodyne	ADRB1	42	41
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819434755	FH	On-Demand	Anodyne	HRH2	20	45
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819434755	FH	On-Demand	Anodyne	ADRB3	51	41
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819434755	FH	On-Demand	Anodyne	MTNR1A	18	41
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819434755	FH	On-Demand	Anodyne	MTNR1B	16	41
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819434755	FH	On-Demand	Anodyne	PDS	82	37
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819434756	FH	On-Demand	Anodyne	ADRB1	42	41
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819434756	FH	On-Demand	Anodyne	HRH2	20	45
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819434756	FH	On-Demand	Anodyne	ADRB3	51	41
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819434756	FH	On-Demand	Anodyne	MTNR1A	18	41
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819434756	FH	On-Demand	Anodyne	MTNR1B	16	41
CC(C)(C)OC(=O)NCCOc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819434756	FH	On-Demand	Anodyne	PDS	82	37
O=S1(=O)CCC(O)(CNc2ccc(N3CCOCC3)c(F)c2)CC1	ZINC000819434757	FD	On-Demand	Anodyne	NPY2R	62	36
O=S1(=O)CCC(O)(CNc2ccc(N3CCOCC3)c(F)c2)CC1	ZINC000819434757	FD	On-Demand	Anodyne	STAT6	40	32
O[C@H](CNc1ccc(OCc2cccc(F)c2)c(F)c1)CN1CCOCC1	ZINC000819434758	GF	On-Demand	Anodyne	EGFR	29	44
O[C@H](CNc1ccc(OCc2cccc(F)c2)c(F)c1)CN1CCOCC1	ZINC000819434758	GF	On-Demand	Anodyne	ERBB2	45	44
O[C@@H](CNc1ccc(OCc2cccc(F)c2)c(F)c1)CN1CCOCC1	ZINC000819434759	GF	On-Demand	Anodyne	EGFR	29	44
O[C@@H](CNc1ccc(OCc2cccc(F)c2)c(F)c1)CN1CCOCC1	ZINC000819434759	GF	On-Demand	Anodyne	ERBB2	45	44
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1F	ZINC000819434760	FF	On-Demand	Anodyne	ADRB2	18	40
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1F	ZINC000819434760	FF	On-Demand	Anodyne	NPY2R	71	36
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1F	ZINC000819434760	FF	On-Demand	Anodyne	MAPK9	19	40
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1F	ZINC000819434760	FF	On-Demand	Anodyne	MAPK10	22	40
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1F	ZINC000819434760	FF	On-Demand	Anodyne	STAT6	43	33
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1F	ZINC000819434761	FF	On-Demand	Anodyne	ADRB2	18	40
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1F	ZINC000819434761	FF	On-Demand	Anodyne	NPY2R	71	36
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1F	ZINC000819434761	FF	On-Demand	Anodyne	MAPK9	19	40
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1F	ZINC000819434761	FF	On-Demand	Anodyne	MAPK10	22	40
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COc1ccccc1F	ZINC000819434761	FF	On-Demand	Anodyne	STAT6	43	33
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cc1F	ZINC000819434765	FG	On-Demand	Anodyne	NPY2R	46	33
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccc(F)cc1F	ZINC000819434766	FG	On-Demand	Anodyne	NPY2R	46	33
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)CN1CCc2ccccc2C1	ZINC000819434768	GE	On-Demand	Anodyne	NPY2R	67	38
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)CN1CCc2ccccc2C1	ZINC000819434769	GE	On-Demand	Anodyne	NPY2R	67	38
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434770	GE	On-Demand	Bother	ADRB1	42	36
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434770	GE	On-Demand	Bother	NPY2R	62	36
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434771	GE	On-Demand	Bother	ADRB1	42	36
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434771	GE	On-Demand	Bother	NPY2R	62	36
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccccc1F	ZINC000819434774	EF	On-Demand	Anodyne	NPY2R	68	37
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1ccccc1F	ZINC000819434775	EF	On-Demand	Anodyne	NPY2R	68	37
C[C@@H](CNc1cccc(OCCNC(=O)OC(C)(C)C)c1)S(C)(=O)=O	ZINC000819434777	FE	On-Demand	Anodyne	HRH2	20	43
C[C@@H](CNc1cccc(OCCNC(=O)OC(C)(C)C)c1)S(C)(=O)=O	ZINC000819434777	FE	On-Demand	Anodyne	MTNR1B	22	44
C[C@@H](CNc1cccc(OCCNC(=O)OC(C)(C)C)c1)S(C)(=O)=O	ZINC000819434777	FE	On-Demand	Anodyne	PDS	60	33
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COCc1ccccc1Cl	ZINC000819434781	GG	On-Demand	Anodyne	NPY2R	68	36
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COCc1ccccc1Cl	ZINC000819434781	GG	On-Demand	Anodyne	MAPK9	24	40
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COCc1ccccc1Cl	ZINC000819434781	GG	On-Demand	Anodyne	MAPK10	21	40
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COCc1ccccc1Cl	ZINC000819434782	GG	On-Demand	Anodyne	NPY2R	68	36
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COCc1ccccc1Cl	ZINC000819434782	GG	On-Demand	Anodyne	MAPK9	24	40
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COCc1ccccc1Cl	ZINC000819434782	GG	On-Demand	Anodyne	MAPK10	21	40
COc1ccccc1COC[C@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434783	GF	On-Demand	Anodyne	NPY2R	74	37
COc1ccccc1COC[C@@H](O)CNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434784	GF	On-Demand	Anodyne	NPY2R	74	37
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COCc1ccccc1F	ZINC000819434785	GF	On-Demand	Anodyne	NPY2R	69	38
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COCc1ccccc1F	ZINC000819434786	GF	On-Demand	Anodyne	NPY2R	69	38
COC[C@@H](C)OC[C@H](O)CNc1ccc(N2CCC(N(C)C)CC2)c(F)c1	ZINC000819434787	GE	On-Demand	Anodyne	NPY2R	64	38
COC[C@@H](C)OC[C@@H](O)CNc1ccc(N2CCC(N(C)C)CC2)c(F)c1	ZINC000819434789	GE	On-Demand	Anodyne	NPY2R	64	38
N#Cc1cccc(COc2ccc(NCC3(O)CCC3)cc2)c1	ZINC000819434803	DG	On-Demand	Mild	MAOB	26	48
N#Cc1cccc(COc2ccc(NCC3(O)CCC3)cc2)c1	ZINC000819434803	DG	On-Demand	Mild	FFAR1	19	50
Cc1cc(OCc2cccc(Cl)c2)ccc1NCC1(O)CCOCC1	ZINC000819434806	FI	On-Demand	Anodyne	ALOX5	17	43
Cc1cc(OCc2cccc(Cl)c2)ccc1NCC1(O)CCOCC1	ZINC000819434806	FI	On-Demand	Anodyne	MAOB	49	47
COC[C@@H](O)CNc1ccc(OCc2cccc(C#N)c2)cc1	ZINC000819434807	DF	On-Demand	Mild	ADRB1	40	37
COC[C@@H](O)CNc1ccc(OCc2cccc(C#N)c2)cc1	ZINC000819434807	DF	On-Demand	Mild	MAOB	25	52
COC[C@@H](O)CNc1ccc(OCc2cccc(C#N)c2)cc1	ZINC000819434807	DF	On-Demand	Mild	FFAR1	20	48
OC1(CNc2ccc(OCc3cccc(F)c3)c(F)c2)CCC1	ZINC000819434811	DH	On-Demand	Anodyne	ERBB2	61	39
CCOC[C@H](O)CNc1ccc(O[C@@H](C)c2ccccc2)cc1C	ZINC000819434813	EH	On-Demand	Anodyne	CASR	25	41
CCOC[C@H](O)CNc1ccc(O[C@H](C)c2ccccc2)cc1C	ZINC000819434814	EH	On-Demand	Anodyne	CASR	25	41
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cc(F)ccc1F	ZINC000819434818	FG	On-Demand	Anodyne	NPY2R	43	36
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cc(F)ccc1F	ZINC000819434819	FG	On-Demand	Anodyne	NPY2R	43	36
NC(=O)NC(=O)CCNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434820	DC	On-Demand	Anodyne	NPY2R	68	37
NC(=O)NC(=O)CCNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434820	DC	On-Demand	Anodyne	MAPK9	25	42
NC(=O)NC(=O)CCNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434820	DC	On-Demand	Anodyne	MAPK10	23	42
NC(=O)NC(=O)CCNc1ccc(N2CCOCC2)c(F)c1	ZINC000819434820	DC	On-Demand	Anodyne	STAT6	58	36
N#Cc1ccc(S(=O)(=O)CCNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434824	GE	On-Demand	Mild	NPY2R	20	40
N#Cc1ccc(S(=O)(=O)CCNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434824	GE	On-Demand	Mild	SLC6A9	18	44
C#CCNC(=O)CCNc1ccc(N2CCC(N(C)C)CC2)c(F)c1	ZINC000819434836	ED	On-Demand	Mild	NPY2R	78	40
Cc1ccccc1[C@@H](O)CNc1ccc(N2CCC(N(C)C)CC2)c(F)c1	ZINC000819434845	FH	On-Demand	Anodyne	NPY2R	81	42
O[C@H](CNc1ccc(OCc2cccc(F)c2)c(F)c1)CC(F)(F)F	ZINC000819434849	FI	On-Demand	Anodyne	ERBB2	45	38
O[C@@H](CNc1ccc(OCc2cccc(F)c2)c(F)c1)CC(F)(F)F	ZINC000819434850	FI	On-Demand	Anodyne	ERBB2	45	38
COC[C@@H](O)CNc1ccc(OCc2cccc(F)c2)cc1C	ZINC000819434860	DG	On-Demand	Anodyne	MAOB	30	47
N#Cc1cccc(COc2ccc(NCC3(O)CCOCC3)cc2)c1	ZINC000819434864	EG	On-Demand	Mild	MAOB	24	44
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819434865	GF	On-Demand	Anodyne	NPY2R	92	39
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819434865	GF	On-Demand	Anodyne	ABCB1	28	50
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819434865	GF	On-Demand	Anodyne	STAT6	49	34
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819434866	GF	On-Demand	Anodyne	NPY2R	92	39
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819434866	GF	On-Demand	Anodyne	ABCB1	28	50
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)c1	ZINC000819434866	GF	On-Demand	Anodyne	STAT6	49	34
N#Cc1cccc(COc2ccc(NCC3(O)CCOCC3)cc2Cl)c1	ZINC000819434867	FH	On-Demand	Mild	EGFR	37	40
N#Cc1cccc(COc2ccc(NCC3(O)CCOCC3)cc2Cl)c1	ZINC000819434867	FH	On-Demand	Mild	ERBB2	63	40
N#Cc1ccc([C@@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434868	EF	On-Demand	Mild	NPY2R	55	44
N#Cc1ccc([C@H](O)CNc2ccc(N3CCOCC3)c(F)c2)cc1	ZINC000819434869	EF	On-Demand	Mild	NPY2R	55	44
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)COCc1cccs1	ZINC000819434874	FF	On-Demand	Anodyne	NPY2R	55	35
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)COCc1cccs1	ZINC000819434875	FF	On-Demand	Anodyne	NPY2R	55	35
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819434880	FG	On-Demand	Anodyne	ADRB1	24	40
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819434880	FG	On-Demand	Anodyne	IGF1R	28	43
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819434880	FG	On-Demand	Anodyne	NPY2R	80	44
O[C@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819434880	FG	On-Demand	Anodyne	CYP3A4	48	38
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819434881	FG	On-Demand	Anodyne	ADRB1	24	40
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819434881	FG	On-Demand	Anodyne	IGF1R	28	43
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819434881	FG	On-Demand	Anodyne	NPY2R	80	44
O[C@@H](CNc1ccc(N2CCOCC2)c(F)c1)c1cccc(Cl)c1	ZINC000819434881	FG	On-Demand	Anodyne	CYP3A4	48	38
C[C@@H](CNc1ccc(OCc2cccc(C(F)(F)F)c2)cc1)S(C)(=O)=O	ZINC000819434883	GI	On-Demand	Anodyne	MAOB	24	45
C[C@@H](CNc1ccc(OCc2cccc(C(F)(F)F)c2)cc1)S(C)(=O)=O	ZINC000819434883	GI	On-Demand	Anodyne	ADAMTS4	25	56
C[C@@H](CNc1ccc(OCc2cccc(C(F)(F)F)c2)cc1)S(C)(=O)=O	ZINC000819434883	GI	On-Demand	Anodyne	FFAR1	24	49
C[C@@H](CNc1ccc(OCc2cccc(C(F)(F)F)c2)cc1)S(C)(=O)=O	ZINC000819434883	GI	On-Demand	Anodyne	ADCYAP1R1	35	42
C[C@@H](CNc1ccc(OCc2cccc(C(F)(F)F)c2)cc1)S(C)(=O)=O	ZINC000819434883	GI	On-Demand	Anodyne	PDS	43	39
Cn1ncc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1C(F)F	ZINC000819434886	FF	On-Demand	Mild	PAPA1_CARPA	37	43
Cn1ncc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1C(F)F	ZINC000819434887	FF	On-Demand	Mild	PAPA1_CARPA	37	43
O[C@@H](CNc1ccc(OCc2cccc(F)c2)c(F)c1)C(F)(F)F	ZINC000819434893	EH	On-Demand	Anodyne	ERBB2	53	39
O[C@H](CNc1ccc(OCc2cccc(F)c2)c(F)c1)C(F)(F)F	ZINC000819434894	EH	On-Demand	Anodyne	ERBB2	53	39
N#Cc1cccc(COc2ccc(NCC3(O)CCCC3)cc2)c1	ZINC000819434936	DH	On-Demand	Mild	MAOB	26	48
N#Cc1cccc(COc2ccc(NCC3(O)CCCC3)cc2)c1	ZINC000819434936	DH	On-Demand	Mild	FFAR1	18	50
COc1ccc(OC(C)C)c(NC[C@H](O)c2ccccc2)c1	ZINC000819434939	DH	On-Demand	Anodyne	ADRB2	22	40
COc1ccc(OC(C)C)c(NC[C@H](O)c2ccccc2)c1	ZINC000819434939	DH	On-Demand	Anodyne	ADRB1	21	44
COc1ccc(OC(C)C)c(NC[C@H](O)c2ccccc2)c1	ZINC000819434939	DH	On-Demand	Anodyne	ADRB3	43	42
COc1ccc(OC(C)C)c(NC[C@H](O)c2ccccc2)c1	ZINC000819434939	DH	On-Demand	Anodyne	MTNR1A	21	40
COc1ccc(OC(C)C)c(NC[C@H](O)c2ccccc2)c1	ZINC000819434939	DH	On-Demand	Anodyne	MTNR1B	21	40
COc1ccc(OC(C)C)c(NC[C@H](O)c2ccccc2)c1	ZINC000819434939	DH	On-Demand	Anodyne	AOC3	17	48
COc1ccc(OC(C)C)c(NC[C@@H](O)c2ccccc2)c1	ZINC000819434940	DH	On-Demand	Anodyne	ADRB2	22	40
COc1ccc(OC(C)C)c(NC[C@@H](O)c2ccccc2)c1	ZINC000819434940	DH	On-Demand	Anodyne	ADRB1	21	44
COc1ccc(OC(C)C)c(NC[C@@H](O)c2ccccc2)c1	ZINC000819434940	DH	On-Demand	Anodyne	ADRB3	43	42
COc1ccc(OC(C)C)c(NC[C@@H](O)c2ccccc2)c1	ZINC000819434940	DH	On-Demand	Anodyne	MTNR1A	21	40
COc1ccc(OC(C)C)c(NC[C@@H](O)c2ccccc2)c1	ZINC000819434940	DH	On-Demand	Anodyne	MTNR1B	21	40
COc1ccc(OC(C)C)c(NC[C@@H](O)c2ccccc2)c1	ZINC000819434940	DH	On-Demand	Anodyne	AOC3	17	48
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@](C)(O)C(F)(F)F)ccc21	ZINC000819434941	FI	On-Demand	Anodyne	GPR119	17	46
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@@](C)(O)C(F)(F)F)ccc21	ZINC000819434942	FI	On-Demand	Anodyne	GPR119	17	46
CC(C)(C)OC(=O)N1CCCc2cc(NCC3(O)CCOCC3)ccc21	ZINC000819434971	FG	On-Demand	Anodyne	GPR119	15	44
CC(C)(C)OC(=O)N1CCCc2cc(NCC3(O)CCCC3)ccc21	ZINC000819434974	EI	On-Demand	Anodyne	GPR119	17	44
COc1ccc(OC(C)C)c(NCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819434994	FH	On-Demand	Anodyne	MTNR1A	40	51
COc1ccc(OC(C)C)c(NCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819434994	FH	On-Demand	Anodyne	MTNR1B	37	51
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819435014	FG	On-Demand	Mild	ADRB2	26	41
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819435014	FG	On-Demand	Mild	ADRB1	27	41
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819435015	FG	On-Demand	Mild	ADRB2	26	41
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819435015	FG	On-Demand	Mild	ADRB1	27	41
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819435016	GG	On-Demand	Anodyne	EDNRB	56	38
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819435016	GG	On-Demand	Anodyne	EDNRA	58	38
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819435017	GG	On-Demand	Anodyne	EDNRB	56	38
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccc3c(c2)OCO3)c1	ZINC000819435017	GG	On-Demand	Anodyne	EDNRA	58	38
COC[C@H](NC(=O)C1(c2ccc(Cl)cc2Cl)CCCCC1)C(N)=O	ZINC000819435025	FF	On-Demand	Anodyne	UGCG	46	50
COC[C@@H](NC(=O)C1(c2ccc(Cl)cc2Cl)CCCCC1)C(N)=O	ZINC000819435026	FF	On-Demand	Anodyne	UGCG	46	50
COc1ccc(OC(C)C)c(NC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819435062	FH	On-Demand	Anodyne	MTNR1A	15	42
COc1ccc(OC(C)C)c(NC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819435063	FH	On-Demand	Anodyne	MTNR1A	15	42
COc1ccc(OC(C)C)c(NCCC(=O)N(C)OC)c1	ZINC000819435087	CE	On-Demand	Anodyne	MTNR1A	51	40
COc1ccc(OC(C)C)c(NCCC(=O)N(C)OC)c1	ZINC000819435087	CE	On-Demand	Anodyne	MTNR1B	40	40
COC[C@@H](NC(=O)C1(c2ccc(C)cc2)CCC1)C(N)=O	ZINC000819435090	CD	On-Demand	Anodyne	AVPR1A	34	42
COC[C@H](NC(=O)C1(c2ccc(C)cc2)CCC1)C(N)=O	ZINC000819435091	CD	On-Demand	Anodyne	AVPR1A	34	42
COC[C@@H](O)CNc1ccc(OCc2cccc(C)c2)cc1C	ZINC000819435105	DG	On-Demand	Anodyne	MAOB	33	49
COC[C@@H](O)CNc1ccc(OCc2cccc(C)c2)cc1C	ZINC000819435105	DG	On-Demand	Anodyne	FFAR1	39	40
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@H](O)C(C)(C)C)ccc21	ZINC000819435111	EI	On-Demand	Anodyne	GPR119	18	44
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@@H](O)C(C)(C)C)ccc21	ZINC000819435112	EI	On-Demand	Anodyne	GPR119	18	44
COc1ccc(OC(C)C)c(NC[C@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819435232	FH	On-Demand	Anodyne	ADRB2	30	44
COc1ccc(OC(C)C)c(NC[C@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819435232	FH	On-Demand	Anodyne	MTNR1A	34	44
COc1ccc(OC(C)C)c(NC[C@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819435232	FH	On-Demand	Anodyne	MTNR1B	34	44
COc1ccc(OC(C)C)c(NC[C@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819435232	FH	On-Demand	Anodyne	ABCB1	23	41
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819435233	FH	On-Demand	Anodyne	ADRB2	30	44
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819435233	FH	On-Demand	Anodyne	MTNR1A	34	44
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819435233	FH	On-Demand	Anodyne	MTNR1B	34	44
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819435233	FH	On-Demand	Anodyne	ABCB1	23	41
CC[C@H](O)CNc1cc(OC)ccc1OC(C)C	ZINC000819435239	CF	On-Demand	Anodyne	MTNR1A	23	40
CC[C@H](O)CNc1cc(OC)ccc1OC(C)C	ZINC000819435239	CF	On-Demand	Anodyne	MTNR1B	19	40
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@H](O)c3ccccc3)ccc21	ZINC000819435242	FJ	On-Demand	Anodyne	AVPR2	25	40
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@H](O)c3ccccc3)ccc21	ZINC000819435242	FJ	On-Demand	Anodyne	NPY2R	71	35
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@@H](O)c3ccccc3)ccc21	ZINC000819435243	FJ	On-Demand	Anodyne	AVPR2	25	40
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@@H](O)c3ccccc3)ccc21	ZINC000819435243	FJ	On-Demand	Anodyne	NPY2R	71	35
COc1ccc(OC(C)C)c(NC[C@H](O)c2c(F)cccc2F)c1	ZINC000819435254	EH	On-Demand	Anodyne	MTNR1A	20	40
COc1ccc(OC(C)C)c(NC[C@H](O)c2c(F)cccc2F)c1	ZINC000819435254	EH	On-Demand	Anodyne	MTNR1B	16	40
COc1ccc(OC(C)C)c(NC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819435255	EH	On-Demand	Anodyne	MTNR1A	20	40
COc1ccc(OC(C)C)c(NC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819435255	EH	On-Demand	Anodyne	MTNR1B	16	40
COc1ccc(OC(C)C)c(NC[C@H](O)C2CC2)c1	ZINC000819435269	CF	On-Demand	Anodyne	MTNR1A	21	40
COc1ccc(OC(C)C)c(NC[C@H](O)C2CC2)c1	ZINC000819435269	CF	On-Demand	Anodyne	MTNR1B	15	40
COc1ccc(OC(C)C)c(NC[C@@H](O)C2CC2)c1	ZINC000819435270	CF	On-Demand	Anodyne	MTNR1A	21	40
COc1ccc(OC(C)C)c(NC[C@@H](O)C2CC2)c1	ZINC000819435270	CF	On-Demand	Anodyne	MTNR1B	15	40
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000819435271	FG	On-Demand	Mild	ADRB2	22	40
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000819435271	FG	On-Demand	Mild	CYP2D6	15	40
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000819435272	FG	On-Demand	Mild	ADRB2	22	40
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000819435272	FG	On-Demand	Mild	CYP2D6	15	40
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@H](O)C(F)(F)F)ccc21	ZINC000819435298	FH	On-Demand	Anodyne	GPR119	15	45
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@@H](O)C(F)(F)F)ccc21	ZINC000819435299	FH	On-Demand	Anodyne	GPR119	15	45
COc1ccc(OC(C)C)c(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819435300	GG	On-Demand	Anodyne	ADRB3	36	41
COc1ccc(OC(C)C)c(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819435301	GG	On-Demand	Anodyne	ADRB3	36	41
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccccc2F)c1	ZINC000819435311	EG	On-Demand	Anodyne	ADRB2	30	42
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccccc2F)c1	ZINC000819435311	EG	On-Demand	Anodyne	ADRB1	40	35
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccccc2F)c1	ZINC000819435311	EG	On-Demand	Anodyne	CYP2D6	18	40
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccccc2F)c1	ZINC000819435312	EG	On-Demand	Anodyne	ADRB2	30	42
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccccc2F)c1	ZINC000819435312	EG	On-Demand	Anodyne	ADRB1	40	35
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccccc2F)c1	ZINC000819435312	EG	On-Demand	Anodyne	CYP2D6	18	40
CC(C)(C)OC(=O)N1CCCc2cc(NCCS(C)(=O)=O)ccc21	ZINC000819435313	FF	On-Demand	Anodyne	GPR119	31	50
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819435321	FH	On-Demand	Anodyne	ADRB2	30	42
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819435321	FH	On-Demand	Anodyne	ABCB1	15	46
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819435321	FH	On-Demand	Anodyne	AKR1C2	20	41
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819435322	FH	On-Demand	Anodyne	ADRB2	30	42
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819435322	FH	On-Demand	Anodyne	ABCB1	15	46
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819435322	FH	On-Demand	Anodyne	AKR1C2	20	41
C[C@@H](CNc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000819435335	FG	On-Demand	Anodyne	GPR119	28	46
O=C(NCCc1cccc([N+](=O)[O-])c1)C(F)=C1CCC1	ZINC000819435338	CF	On-Demand	Bother	CACNA1D	52	33
CC(=O)Nc1cccc(CC(=O)N2CCN(c3ccc(C)c(C)c3)CC2)c1	ZINC000819435345	FG	On-Demand	Anodyne	HTR1D	25	41
CC(=O)Nc1cccc(CC(=O)N2CCN(c3ccc(C)c(C)c3)CC2)c1	ZINC000819435345	FG	On-Demand	Anodyne	HTR1B	28	41
CC(=O)Nc1cccc(CC(=O)N2CCN(c3ccc(C)c(C)c3)CC2)c1	ZINC000819435345	FG	On-Demand	Anodyne	CCR1	16	40
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@H](O)c3cccnc3)ccc21	ZINC000819435346	FH	On-Demand	Anodyne	ADRB3	90	44
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@@H](O)c3cccnc3)ccc21	ZINC000819435347	FH	On-Demand	Anodyne	ADRB3	90	44
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@@H](O)CC(F)(F)F)ccc21	ZINC000819435353	FI	On-Demand	Anodyne	GPR119	15	44
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@H](O)CC(F)(F)F)ccc21	ZINC000819435354	FI	On-Demand	Anodyne	GPR119	15	44
COC[C@H](NC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)C(N)=O	ZINC000819435376	GC	On-Demand	Anodyne	SSTR2	54	34
COC[C@H](NC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)C(N)=O	ZINC000819435376	GC	On-Demand	Anodyne	P2RY12	53	34
COC[C@@H](NC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)C(N)=O	ZINC000819435377	GC	On-Demand	Anodyne	SSTR2	54	34
COC[C@@H](NC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)C(N)=O	ZINC000819435377	GC	On-Demand	Anodyne	P2RY12	53	34
COC[C@@H](NC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)C(N)=O	ZINC000819435378	GC	On-Demand	Anodyne	SSTR2	54	34
COC[C@@H](NC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)C(N)=O	ZINC000819435378	GC	On-Demand	Anodyne	P2RY12	53	34
COC[C@H](NC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)C(N)=O	ZINC000819435379	GC	On-Demand	Anodyne	SSTR2	54	34
COC[C@H](NC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)C(N)=O	ZINC000819435379	GC	On-Demand	Anodyne	P2RY12	53	34
COC[C@@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)C(N)=O	ZINC000819435394	DB	On-Demand	Anodyne	CTSK	15	41
COC[C@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)C(N)=O	ZINC000819435395	DB	On-Demand	Anodyne	CTSK	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCc3c([nH]c4ccccc34)C1)C2	ZINC000819435400	FF	On-Demand	Anodyne	SSTR4	44	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCc3c([nH]c4ccccc34)C1)C2	ZINC000819435400	FF	On-Demand	Anodyne	SSTR1	17	51
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCc3c([nH]c4ccccc34)C1)C2	ZINC000819435401	FF	On-Demand	Anodyne	SSTR4	44	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCc3c([nH]c4ccccc34)C1)C2	ZINC000819435401	FF	On-Demand	Anodyne	SSTR1	17	51
COc1cccc([S@](=O)CC(=O)N2CCN(c3ccc(C)c(C)c3)CC2)c1	ZINC000819435420	GF	On-Demand	Anodyne	DRD4	50	42
COc1cccc([S@](=O)CC(=O)N2CCN(c3ccc(C)c(C)c3)CC2)c1	ZINC000819435420	GF	On-Demand	Anodyne	CCKAR	24	41
COc1cccc([S@](=O)CC(=O)N2CCN(c3ccc(C)c(C)c3)CC2)c1	ZINC000819435420	GF	On-Demand	Anodyne	CCR1	23	41
COc1cccc([S@@](=O)CC(=O)N2CCN(c3ccc(C)c(C)c3)CC2)c1	ZINC000819435421	GF	On-Demand	Anodyne	DRD4	50	42
COc1cccc([S@@](=O)CC(=O)N2CCN(c3ccc(C)c(C)c3)CC2)c1	ZINC000819435421	GF	On-Demand	Anodyne	CCKAR	24	41
COc1cccc([S@@](=O)CC(=O)N2CCN(c3ccc(C)c(C)c3)CC2)c1	ZINC000819435421	GF	On-Demand	Anodyne	CCR1	23	41
COc1ccc(OC(C)C)c(NC[C@H](O)CN2CCc3ccccc3C2)c1	ZINC000819435436	FG	On-Demand	Anodyne	NOD1	15	41
COc1ccc(OC(C)C)c(NC[C@H](O)CN2CCc3ccccc3C2)c1	ZINC000819435436	FG	On-Demand	Anodyne	NOD2	41	41
COc1ccc(OC(C)C)c(NC[C@@H](O)CN2CCc3ccccc3C2)c1	ZINC000819435437	FG	On-Demand	Anodyne	NOD1	15	41
COc1ccc(OC(C)C)c(NC[C@@H](O)CN2CCc3ccccc3C2)c1	ZINC000819435437	FG	On-Demand	Anodyne	NOD2	41	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCc2c([nH]c3ccccc23)C1	ZINC000819435438	FF	On-Demand	Anodyne	SSTR4	51	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCc2c([nH]c3ccccc23)C1	ZINC000819435438	FF	On-Demand	Anodyne	SSTR5	41	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCc2c([nH]c3ccccc23)C1	ZINC000819435438	FF	On-Demand	Anodyne	CCKAR	21	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCc2c([nH]c3ccccc23)C1	ZINC000819435438	FF	On-Demand	Anodyne	SSTR1	19	47
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819435459	GG	On-Demand	Anodyne	ADRB2	42	57
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819435459	GG	On-Demand	Anodyne	ADRB1	64	57
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819435459	GG	On-Demand	Anodyne	TSHR	55	35
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819435459	GG	On-Demand	Anodyne	ADRB3	42	47
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819435459	GG	On-Demand	Anodyne	MTNR1A	37	41
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819435459	GG	On-Demand	Anodyne	MTNR1B	40	41
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819435460	GG	On-Demand	Anodyne	ADRB2	42	57
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819435460	GG	On-Demand	Anodyne	ADRB1	64	57
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819435460	GG	On-Demand	Anodyne	TSHR	55	35
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819435460	GG	On-Demand	Anodyne	ADRB3	42	47
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819435460	GG	On-Demand	Anodyne	MTNR1A	37	41
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819435460	GG	On-Demand	Anodyne	MTNR1B	40	41
COc1ccc(OC(C)C)c(NC[C@H](O)COCc2ccccc2)c1	ZINC000819435461	EG	On-Demand	Anodyne	CASR	29	46
COc1ccc(OC(C)C)c(NC[C@@H](O)COCc2ccccc2)c1	ZINC000819435462	EG	On-Demand	Anodyne	CASR	29	46
COC[C@@H](NC(=O)C[S@](=O)c1cccc(OC)c1)C(N)=O	ZINC000819435463	DB	On-Demand	Anodyne	MTNR1A	31	40
COC[C@@H](NC(=O)C[S@](=O)c1cccc(OC)c1)C(N)=O	ZINC000819435463	DB	On-Demand	Anodyne	MTNR1B	31	40
COC[C@H](NC(=O)C[S@](=O)c1cccc(OC)c1)C(N)=O	ZINC000819435464	DB	On-Demand	Anodyne	MTNR1A	31	40
COC[C@H](NC(=O)C[S@](=O)c1cccc(OC)c1)C(N)=O	ZINC000819435464	DB	On-Demand	Anodyne	MTNR1B	31	40
COC[C@H](NC(=O)C[S@@](=O)c1cccc(OC)c1)C(N)=O	ZINC000819435465	DB	On-Demand	Anodyne	MTNR1A	31	40
COC[C@H](NC(=O)C[S@@](=O)c1cccc(OC)c1)C(N)=O	ZINC000819435465	DB	On-Demand	Anodyne	MTNR1B	31	40
COC[C@@H](NC(=O)C[S@@](=O)c1cccc(OC)c1)C(N)=O	ZINC000819435466	DB	On-Demand	Anodyne	MTNR1A	31	40
COC[C@@H](NC(=O)C[S@@](=O)c1cccc(OC)c1)C(N)=O	ZINC000819435466	DB	On-Demand	Anodyne	MTNR1B	31	40
O=C(C(F)=C1CCC1)N1CCc2c([nH]c3ccccc23)C1	ZINC000819435473	CG	On-Demand	Anodyne	DRD5	22	44
CC[C@H](O)CNc1ccccc1OCCN(CC)CC	ZINC000819435537	CF	On-Demand	Clean	AMY2	41	39
CC(C)(C)OC(=O)N1CCCc2cc(NCCC(=O)NC(N)=O)ccc21	ZINC000819435545	FE	On-Demand	Anodyne	GPR119	15	46
CN(C[C@H](O)CNc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C)C1CC1	ZINC000819435550	GG	On-Demand	Anodyne	GPR119	22	45
CN(C[C@@H](O)CNc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C)C1CC1	ZINC000819435551	GG	On-Demand	Anodyne	GPR119	22	45
COc1ccc(OC(C)C)c(NC[C@H](O)c2cccc(F)c2)c1	ZINC000819435560	DH	On-Demand	Anodyne	ADRB3	26	45
COc1ccc(OC(C)C)c(NC[C@@H](O)c2cccc(F)c2)c1	ZINC000819435561	DH	On-Demand	Anodyne	ADRB3	26	45
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccc(F)cc2)c1	ZINC000819435590	EG	On-Demand	Anodyne	ADRB2	34	40
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000819435591	EG	On-Demand	Anodyne	ADRB2	34	40
COc1ccc(OC(C)C)c(NC[C@H](O)c2cccnc2)c1	ZINC000819435607	DG	On-Demand	Anodyne	ADRB2	17	40
COc1ccc(OC(C)C)c(NC[C@H](O)c2cccnc2)c1	ZINC000819435607	DG	On-Demand	Anodyne	ADRB1	23	46
COc1ccc(OC(C)C)c(NC[C@H](O)c2cccnc2)c1	ZINC000819435607	DG	On-Demand	Anodyne	ADRB3	57	46
COc1ccc(OC(C)C)c(NC[C@@H](O)c2cccnc2)c1	ZINC000819435608	DG	On-Demand	Anodyne	ADRB2	17	40
COc1ccc(OC(C)C)c(NC[C@@H](O)c2cccnc2)c1	ZINC000819435608	DG	On-Demand	Anodyne	ADRB1	23	46
COc1ccc(OC(C)C)c(NC[C@@H](O)c2cccnc2)c1	ZINC000819435608	DG	On-Demand	Anodyne	ADRB3	57	46
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@H](O)c3ccc(F)cn3)ccc21	ZINC000819435611	GI	On-Demand	Anodyne	GPR119	15	40
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@@H](O)c3ccc(F)cn3)ccc21	ZINC000819435612	GI	On-Demand	Anodyne	GPR119	15	40
O=C(/C=C\[C@@H]1CCCO1)NCCc1cccc([N+](=O)[O-])c1	ZINC000819435614	CD	On-Demand	Bother	CACNA1D	51	32
O=C(/C=C\[C@@H]1CCCO1)NCCc1cccc([N+](=O)[O-])c1	ZINC000819435614	CD	On-Demand	Bother	LUXR	18	45
O=C(/C=C\[C@H]1CCCO1)NCCc1cccc([N+](=O)[O-])c1	ZINC000819435615	CD	On-Demand	Bother	CACNA1D	51	32
O=C(/C=C\[C@H]1CCCO1)NCCc1cccc([N+](=O)[O-])c1	ZINC000819435615	CD	On-Demand	Bother	LUXR	18	45
O=C(/C=C/[C@H]1CCCO1)NCCc1cccc([N+](=O)[O-])c1	ZINC000819435616	CD	On-Demand	Bother	CACNA1D	51	32
O=C(/C=C/[C@H]1CCCO1)NCCc1cccc([N+](=O)[O-])c1	ZINC000819435616	CD	On-Demand	Bother	LUXR	18	45
O=C(/C=C/[C@@H]1CCCO1)NCCc1cccc([N+](=O)[O-])c1	ZINC000819435617	CD	On-Demand	Bother	CACNA1D	51	32
O=C(/C=C/[C@@H]1CCCO1)NCCc1cccc([N+](=O)[O-])c1	ZINC000819435617	CD	On-Demand	Bother	LUXR	18	45
O=CN1CCCN(C(=O)CCOc2ccc(Cl)cc2)CC1	ZINC000819435625	DD	On-Demand	Anodyne	LTA4H	20	40
O=CN1CCCN(C(=O)CCOc2ccc(Cl)cc2)CC1	ZINC000819435625	DD	On-Demand	Anodyne	HRH3	17	60
O=C(C[C@@H]1CCc2ccccc2C1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819435627	DE	On-Demand	Anodyne	CPT1A	94	38
O=C(C[C@@H]1CCc2ccccc2C1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819435627	DE	On-Demand	Anodyne	PREP	60	58
O=C(C[C@@H]1CCc2ccccc2C1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819435628	DE	On-Demand	Anodyne	CPT1A	94	38
O=C(C[C@@H]1CCc2ccccc2C1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819435628	DE	On-Demand	Anodyne	PREP	60	58
O=C(C[C@H]1CCc2ccccc2C1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819435629	DE	On-Demand	Anodyne	CPT1A	94	38
O=C(C[C@H]1CCc2ccccc2C1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819435629	DE	On-Demand	Anodyne	PREP	60	58
O=C(C[C@H]1CCc2ccccc2C1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819435630	DE	On-Demand	Anodyne	CPT1A	94	38
O=C(C[C@H]1CCc2ccccc2C1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819435630	DE	On-Demand	Anodyne	PREP	60	58
COc1ccc(C(=O)N2CCCN(C=O)CC2)cc1-n1cnnn1	ZINC000819435631	EB	On-Demand	Anodyne	HPGD	33	45
O=CN1CCCN(C(=O)c2c3c(nc4ccccc24)CCC3)CC1	ZINC000819435650	DE	On-Demand	Anodyne	ACHE	65	44
O=CN1CCCN(C(=O)c2c3c(nc4ccccc24)CCC3)CC1	ZINC000819435650	DE	On-Demand	Anodyne	BCHE	96	44
O=CN1CCCN(C(=O)c2ccccc2Nc2ccc(OC(F)F)cc2)CC1	ZINC000819435651	GG	On-Demand	Anodyne	AKR1C3	19	42
O=CN1CCCN(C(=O)c2ccccc2Nc2ccc(OC(F)F)cc2)CC1	ZINC000819435651	GG	On-Demand	Anodyne	AKR1C2	46	42
O=CN1CCCN(C(=O)CNC(=O)NCc2ccc(Cl)cc2)CC1	ZINC000819435666	FC	On-Demand	Anodyne	DPP7	54	43
Cc1ccccc1[C@H](CC(=O)N1CCCN(C=O)CC1)NC(N)=O	ZINC000819435669	EC	On-Demand	Anodyne	PTAFR	18	41
Cc1ccccc1[C@H](CC(=O)N1CCCN(C=O)CC1)NC(N)=O	ZINC000819435669	EC	On-Demand	Anodyne	CTSA	58	36
Cc1ccccc1[C@@H](CC(=O)N1CCCN(C=O)CC1)NC(N)=O	ZINC000819435670	EC	On-Demand	Anodyne	PTAFR	18	41
Cc1ccccc1[C@@H](CC(=O)N1CCCN(C=O)CC1)NC(N)=O	ZINC000819435670	EC	On-Demand	Anodyne	CTSA	58	36
NC(=O)Nc1cccc(C(=O)N2CCCN(C=O)CC2)c1	ZINC000819435672	CC	On-Demand	Anodyne	KCNK3	50	35
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@H](O)COc3ccccc3)ccc21	ZINC000819435678	GI	On-Demand	Anodyne	ADRB2	41	44
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@H](O)COc3ccccc3)ccc21	ZINC000819435678	GI	On-Demand	Anodyne	ADRB1	65	48
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@H](O)COc3ccccc3)ccc21	ZINC000819435678	GI	On-Demand	Anodyne	ADRB3	41	48
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@@H](O)COc3ccccc3)ccc21	ZINC000819435681	GI	On-Demand	Anodyne	ADRB2	41	44
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@@H](O)COc3ccccc3)ccc21	ZINC000819435681	GI	On-Demand	Anodyne	ADRB1	65	48
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@@H](O)COc3ccccc3)ccc21	ZINC000819435681	GI	On-Demand	Anodyne	ADRB3	41	48
CC(=O)c1cc(C(=O)N2CCCN(C=O)CC2)ccc1C	ZINC000819435715	CD	On-Demand	Anodyne	L3MBTL3	60	38
CC(=O)c1cc(C(=O)N2CCCN(C=O)CC2)ccc1C	ZINC000819435715	CD	On-Demand	Anodyne	HPGD	45	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)C2	ZINC000819435743	FE	On-Demand	Bother	CACNA1C	44	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)C2	ZINC000819435743	FE	On-Demand	Bother	CACNA1D	67	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)C2	ZINC000819435743	FE	On-Demand	Bother	LUXR	16	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)C2	ZINC000819435745	FE	On-Demand	Bother	CACNA1C	44	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)C2	ZINC000819435745	FE	On-Demand	Bother	CACNA1D	67	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1cccc([N+](=O)[O-])c1)C2	ZINC000819435745	FE	On-Demand	Bother	LUXR	16	42
O=CN1CCCN(C(=O)c2ccc(F)cc2-c2ccc(Cl)c(Cl)c2)CC1	ZINC000819435755	GI	On-Demand	Anodyne	P2RX7	20	42
O=C(/C=C/[C@@H]1CCCO1)N1CCc2c([nH]c3ccccc23)C1	ZINC000819435760	CF	On-Demand	Anodyne	DRD5	21	40
O=C(/C=C\[C@H]1CCCO1)N1CCc2c([nH]c3ccccc23)C1	ZINC000819435762	CF	On-Demand	Anodyne	DRD5	21	40
O=CN1CCCN(C(=O)c2cc(-c3ccncc3)nc3ccc(Br)cc23)CC1	ZINC000819435763	IG	On-Demand	Anodyne	PRS	76	52
O=C(/C=C/[C@H]1CCCO1)N1CCc2c([nH]c3ccccc23)C1	ZINC000819435764	CF	On-Demand	Anodyne	DRD5	21	40
O=C(/C=C\[C@@H]1CCCO1)N1CCc2c([nH]c3ccccc23)C1	ZINC000819435766	CF	On-Demand	Anodyne	DRD5	21	40
COC(=O)C1(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCCCC1	ZINC000819435779	GF	On-Demand	Mild	PAPA1_CARPA	33	43
COC(=O)C1(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCCCC1	ZINC000819435781	GF	On-Demand	Mild	PAPA1_CARPA	33	43
COc1ccc(OC(C)C)c(NC[C@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819435795	FH	On-Demand	Anodyne	ADRB2	27	60
COc1ccc(OC(C)C)c(NC[C@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819435795	FH	On-Demand	Anodyne	ADRB1	30	60
COc1ccc(OC(C)C)c(NC[C@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819435795	FH	On-Demand	Anodyne	CYP2D6	18	42
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819435796	FH	On-Demand	Anodyne	ADRB2	27	60
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819435796	FH	On-Demand	Anodyne	ADRB1	30	60
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819435796	FH	On-Demand	Anodyne	CYP2D6	18	42
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@H](O)C3CC3)ccc21	ZINC000819435800	EH	On-Demand	Anodyne	GPR119	22	46
CC(C)(C)OC(=O)N1CCCc2cc(NC[C@@H](O)C3CC3)ccc21	ZINC000819435801	EH	On-Demand	Anodyne	GPR119	22	46
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccccc2)c1	ZINC000819435805	EG	On-Demand	Anodyne	ADRB2	52	50
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccccc2)c1	ZINC000819435805	EG	On-Demand	Anodyne	ADRB1	54	43
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccccc2)c1	ZINC000819435805	EG	On-Demand	Anodyne	ADRB3	38	43
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccccc2)c1	ZINC000819435805	EG	On-Demand	Anodyne	CASR	28	42
COc1ccc(OC(C)C)c(NC[C@H](O)COc2ccccc2)c1	ZINC000819435805	EG	On-Demand	Anodyne	CYP2D6	19	40
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccccc2)c1	ZINC000819435806	EG	On-Demand	Anodyne	ADRB2	52	50
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccccc2)c1	ZINC000819435806	EG	On-Demand	Anodyne	ADRB1	54	43
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccccc2)c1	ZINC000819435806	EG	On-Demand	Anodyne	ADRB3	38	43
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccccc2)c1	ZINC000819435806	EG	On-Demand	Anodyne	CASR	28	42
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2ccccc2)c1	ZINC000819435806	EG	On-Demand	Anodyne	CYP2D6	19	40
COc1ccc(OC(C)C)c(NC[C@@H](O)Cc2ccccc2)c1	ZINC000819435810	DG	On-Demand	Anodyne	ADRB2	19	43
COc1ccc(OC(C)C)c(NC[C@@H](O)Cc2ccccc2)c1	ZINC000819435810	DG	On-Demand	Anodyne	ADRB3	25	43
COc1ccc(OC(C)C)c(NC[C@H](O)Cc2ccccc2)c1	ZINC000819435811	DG	On-Demand	Anodyne	ADRB2	19	43
COc1ccc(OC(C)C)c(NC[C@H](O)Cc2ccccc2)c1	ZINC000819435811	DG	On-Demand	Anodyne	ADRB3	25	43
COc1ccc(OC(C)C)c(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819435847	GG	On-Demand	Bother	ADRB2	21	41
COc1ccc(OC(C)C)c(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819435847	GG	On-Demand	Bother	ADRB1	18	40
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819435848	GG	On-Demand	Bother	ADRB2	21	41
COc1ccc(OC(C)C)c(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000819435848	GG	On-Demand	Bother	ADRB1	18	40
COC[C@@H](O)CNc1cc(OC)ccc1OC(C)C	ZINC000819435897	CD	On-Demand	Anodyne	ADRB2	19	41
COC[C@@H](NC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2)C(N)=O	ZINC000819435907	GD	On-Demand	Anodyne	CNR1	51	31
COC[C@H](NC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2)C(N)=O	ZINC000819435908	GD	On-Demand	Anodyne	CNR1	51	31
O=CN1CCCN(C(=O)[C@@H](O)Cc2ccccc2)CC1	ZINC000819435928	CC	On-Demand	Anodyne	ACE	30	45
O=CN1CCCN(C(=O)[C@@H](O)Cc2ccccc2)CC1	ZINC000819435928	CC	On-Demand	Anodyne	MME	37	45
O=CN1CCCN(C(=O)[C@@H](O)Cc2ccccc2)CC1	ZINC000819435928	CC	On-Demand	Anodyne	PREP	18	45
O=CN1CCCN(C(=O)[C@@H](O)Cc2ccccc2)CC1	ZINC000819435928	CC	On-Demand	Anodyne	DPP7	53	42
N#Cc1cc(C(=O)N2CCCN(C=O)CC2)ccc1F	ZINC000819435931	CD	On-Demand	Mild	L3MBTL3	44	34
CCn1cc(C(=O)N2CCCN(C=O)CC2)c2ccccc21	ZINC000819435932	CD	On-Demand	Anodyne	CNR1	26	57
CCn1cc(C(=O)N2CCCN(C=O)CC2)c2ccccc21	ZINC000819435932	CD	On-Demand	Anodyne	CNR2	28	41
CCn1cc(C(=O)N2CCCN(C=O)CC2)c2ccccc21	ZINC000819435932	CD	On-Demand	Anodyne	TPSAB1	24	52
CC(C)(C)CNC(=O)c1ccc(C(=O)N2CCCN(C=O)CC2)cc1	ZINC000819435946	ED	On-Demand	Anodyne	MLYCD	19	42
CC(C)(C)CNC(=O)c1ccc(C(=O)N2CCCN(C=O)CC2)cc1	ZINC000819435946	ED	On-Demand	Anodyne	L3MBTL3	46	38
O=CN1CCCN(C(=O)C2(OCc3ccccc3)CCOCC2)CC1	ZINC000819435966	ED	On-Demand	Anodyne	SLC12A5	68	36
O=CN1CCCN(C(=O)CN2CCN(Cc3ccccc3)CC2)CC1	ZINC000819435973	EC	On-Demand	Anodyne	DRD2	17	43
O=CN1CCCN(C(=O)CN2CCN(Cc3ccccc3)CC2)CC1	ZINC000819435973	EC	On-Demand	Anodyne	DRD4	46	44
O=CN1CCCN(C(=O)CN2CCN(Cc3ccccc3)CC2)CC1	ZINC000819435973	EC	On-Demand	Anodyne	SIGMAR1	57	47
O=CN1CCCN(C(=O)CN2CCN(Cc3ccccc3)CC2)CC1	ZINC000819435973	EC	On-Demand	Anodyne	FAAH	20	49
O=CN1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)CC1	ZINC000819435980	ED	On-Demand	Bother	SLC6A9	25	59
O=CN1CCCN(C(=O)c2cc3ccc(Br)cc3[nH]2)CC1	ZINC000819435986	FE	On-Demand	Anodyne	GRIN2B	26	46
O=CN1CCCN(C(=O)c2cc3ccc(Br)cc3[nH]2)CC1	ZINC000819435986	FE	On-Demand	Anodyne	HRH4	35	68
O=CN1CCCN(C(=O)c2cc3ccc(Br)cc3[nH]2)CC1	ZINC000819435986	FE	On-Demand	Anodyne	AKR1C3	17	41
O=CN1CCCN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)CC1	ZINC000819435988	CC	On-Demand	Bother	L3MBTL3	45	46
O=CN1CCCN(C(=O)[C@@H](Oc2ccc(Cl)cc2)c2ccccc2)CC1	ZINC000819435994	FG	On-Demand	Anodyne	DPP7	52	34
O=CN1CCCN(C(=O)[C@H](Oc2ccc(Cl)cc2)c2ccccc2)CC1	ZINC000819435995	FG	On-Demand	Anodyne	DPP7	52	34
O=CN1CCCN(C(=O)c2cc(C(F)(F)F)ccc2F)CC1	ZINC000819435997	DE	On-Demand	Anodyne	SLC6A9	20	42
O=CN1CCCN(C(=O)c2cc(C(F)(F)F)ccc2F)CC1	ZINC000819435997	DE	On-Demand	Anodyne	PARP1	53	38
O=CN1CCCN(C(=O)c2cc(C(F)(F)F)ccc2F)CC1	ZINC000819435997	DE	On-Demand	Anodyne	MLYCD	18	40
O=CN1CCCN(C(=O)c2cc(C(F)(F)F)ccc2F)CC1	ZINC000819435997	DE	On-Demand	Anodyne	LIPG	42	33
COc1cccc(C2(C(=O)N3CCCN(C=O)CC3)CCCC2)c1	ZINC000819436007	EE	On-Demand	Anodyne	GRIN2C	17	40
O=CN1CCCN(C(=O)c2ccccc2NS(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000819436009	ID	On-Demand	Bother	PRTN3	43	31
O=CN1CCCN(C(=O)CSc2nnc(-c3ccc(Cl)cc3)o2)CC1	ZINC000819436015	GE	On-Demand	Anodyne	ALOX15	24	42
O=CN1CCCN(C(=O)c2ccc3[nH]ccc3c2)CC1	ZINC000819436016	CD	On-Demand	Anodyne	HRH4	20	43
O=CN1CCCN(C(=O)c2ccc3[nH]ccc3c2)CC1	ZINC000819436016	CD	On-Demand	Anodyne	L3MBTL3	51	37
COc1ccc(OC(C)C)c(NC[C@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819436038	FG	On-Demand	Anodyne	MTNR1A	60	38
COc1ccc(OC(C)C)c(NC[C@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819436038	FG	On-Demand	Anodyne	MTNR1B	48	38
COc1ccc(OC(C)C)c(NC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819436039	FG	On-Demand	Anodyne	MTNR1A	60	38
COc1ccc(OC(C)C)c(NC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819436039	FG	On-Demand	Anodyne	MTNR1B	48	38
COc1ccc(OC(C)C)c(NC[C@H](C)O)c1	ZINC000819436040	BE	On-Demand	Anodyne	MTNR1A	28	40
COc1ccc(OC(C)C)c(NC[C@H](C)O)c1	ZINC000819436040	BE	On-Demand	Anodyne	MTNR1B	22	40
COc1ccc(OC(C)C)c(NC[C@@H](C)O)c1	ZINC000819436041	BE	On-Demand	Anodyne	MTNR1A	28	40
COc1ccc(OC(C)C)c(NC[C@@H](C)O)c1	ZINC000819436041	BE	On-Demand	Anodyne	MTNR1B	22	40
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)COc1ccccc1	ZINC000819436063	EH	On-Demand	Anodyne	ADRB2	50	46
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)COc1ccccc1	ZINC000819436063	EH	On-Demand	Anodyne	ADRB1	67	42
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)COc1ccccc1	ZINC000819436063	EH	On-Demand	Anodyne	ADRB3	49	42
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)COc1ccccc1	ZINC000819436063	EH	On-Demand	Anodyne	KCNQ2	46	33
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)COc1ccccc1	ZINC000819436063	EH	On-Demand	Anodyne	NPY2R	56	40
COC[C@@H](NC(=O)CCc1cccc(OC(F)F)c1)C(N)=O	ZINC000819436065	DC	On-Demand	Anodyne	MTNR1A	15	43
COC[C@@H](NC(=O)CCc1cccc(OC(F)F)c1)C(N)=O	ZINC000819436065	DC	On-Demand	Anodyne	CRTM	53	35
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)COc1ccccc1	ZINC000819436066	EH	On-Demand	Anodyne	ADRB2	50	46
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)COc1ccccc1	ZINC000819436066	EH	On-Demand	Anodyne	ADRB1	67	42
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)COc1ccccc1	ZINC000819436066	EH	On-Demand	Anodyne	ADRB3	49	42
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)COc1ccccc1	ZINC000819436066	EH	On-Demand	Anodyne	KCNQ2	46	33
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)COc1ccccc1	ZINC000819436066	EH	On-Demand	Anodyne	NPY2R	56	40
COC[C@H](NC(=O)CCc1cccc(OC(F)F)c1)C(N)=O	ZINC000819436067	DC	On-Demand	Anodyne	MTNR1A	15	43
COC[C@H](NC(=O)CCc1cccc(OC(F)F)c1)C(N)=O	ZINC000819436067	DC	On-Demand	Anodyne	CRTM	53	35
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819436076	GH	On-Demand	Anodyne	NPY2R	53	39
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819436078	GH	On-Demand	Anodyne	NPY2R	53	39
CCOC[C@H](O)CNc1ccc(OCCC(=O)NC)cc1	ZINC000819436101	CD	On-Demand	Anodyne	ADRB2	22	40
CCOC[C@H](O)CNc1ccc(OCCC(=O)NC)cc1	ZINC000819436101	CD	On-Demand	Anodyne	ADRB1	36	44
NC(=O)CCNc1ccc(N2CCNC(=O)C2)c(Cl)c1	ZINC000819436110	CC	On-Demand	Anodyne	NPY2R	42	38
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)C(F)(F)F	ZINC000819436139	DG	On-Demand	Anodyne	NPY2R	53	42
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)C(F)(F)F	ZINC000819436141	DG	On-Demand	Anodyne	NPY2R	53	42
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819436143	FH	On-Demand	Bother	KCNQ2	42	34
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819436143	FH	On-Demand	Bother	NPY2R	44	38
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819436145	FH	On-Demand	Bother	KCNQ2	42	34
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819436145	FH	On-Demand	Bother	NPY2R	44	38
NC(=O)NC(=O)CCNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819436147	DD	On-Demand	Anodyne	KCNQ2	51	38
NC(=O)NC(=O)CCNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819436147	DD	On-Demand	Anodyne	NPY2R	53	40
O[C@@H](CNc1ccc(N2CCCCC2)c(Cl)c1)CC(F)(F)F	ZINC000819436153	EI	On-Demand	Anodyne	NPY2R	49	40
O[C@H](CNc1ccc(N2CCCCC2)c(Cl)c1)CC(F)(F)F	ZINC000819436157	EI	On-Demand	Anodyne	NPY2R	49	40
N#CCCNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819436162	BG	On-Demand	Mild	NPY2R	42	37
CC(C)(C)OC(=O)N1CCCc2cc(NCCC(=O)Nc3cccnc3)ccc21	ZINC000819436164	GI	On-Demand	Anodyne	HTR2C	16	45
O=C1CCCN1C[C@@H](O)CNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819436175	FF	On-Demand	Anodyne	NPY2R	46	39
O=C1CCCN1C[C@H](O)CNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819436177	FF	On-Demand	Anodyne	NPY2R	46	39
COC[C@@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819436184	CE	On-Demand	Anodyne	NPY2R	52	38
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1ccc(Cl)cc1	ZINC000819436197	EI	On-Demand	Anodyne	HRH3	16	45
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1ccc(Cl)cc1	ZINC000819436197	EI	On-Demand	Anodyne	SIGMAR1	16	44
O[C@@H](CNc1ccc(N2CCCCC2)c(Cl)c1)C1CC1	ZINC000819436198	CH	On-Demand	Anodyne	NPY2R	47	46
O[C@H](CNc1ccc(N2CCCCC2)c(Cl)c1)C1CC1	ZINC000819436199	CH	On-Demand	Anodyne	NPY2R	47	46
CCOC[C@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819436218	CF	On-Demand	Anodyne	NPY2R	50	37
CCOc1ccc(OC)cc1NC[C@H](O)c1cccnc1	ZINC000819436224	CF	On-Demand	Anodyne	ADRB2	19	43
CCOc1ccc(OC)cc1NC[C@H](O)c1cccnc1	ZINC000819436224	CF	On-Demand	Anodyne	ADRB1	22	45
CCOc1ccc(OC)cc1NC[C@H](O)c1cccnc1	ZINC000819436224	CF	On-Demand	Anodyne	ADRB3	62	45
CCOc1ccc(OC)cc1NC[C@@H](O)c1cccnc1	ZINC000819436229	CF	On-Demand	Anodyne	ADRB2	19	43
CCOc1ccc(OC)cc1NC[C@@H](O)c1cccnc1	ZINC000819436229	CF	On-Demand	Anodyne	ADRB1	22	45
CCOc1ccc(OC)cc1NC[C@@H](O)c1cccnc1	ZINC000819436229	CF	On-Demand	Anodyne	ADRB3	62	45
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1cccnc1	ZINC000819436239	DF	On-Demand	Anodyne	ADRB2	33	45
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1cccnc1	ZINC000819436239	DF	On-Demand	Anodyne	ADRB1	30	43
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1cccnc1	ZINC000819436239	DF	On-Demand	Anodyne	ADRB3	112	55
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1cccnc1	ZINC000819436239	DF	On-Demand	Anodyne	CHRNA7	24	42
O=CN1CCCN(C(=O)CCc2nc(C3CCCC3)no2)CC1	ZINC000819436240	DD	On-Demand	Anodyne	ETHR	29	47
O[C@H](CNc1ccc(CCN2CCCC2)cc1)c1cccnc1	ZINC000819436241	DF	On-Demand	Anodyne	ADRB2	33	45
O[C@H](CNc1ccc(CCN2CCCC2)cc1)c1cccnc1	ZINC000819436241	DF	On-Demand	Anodyne	ADRB1	30	43
O[C@H](CNc1ccc(CCN2CCCC2)cc1)c1cccnc1	ZINC000819436241	DF	On-Demand	Anodyne	ADRB3	112	55
O[C@H](CNc1ccc(CCN2CCCC2)cc1)c1cccnc1	ZINC000819436241	DF	On-Demand	Anodyne	CHRNA7	24	42
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	KIT	16	47
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	KCNJ11	20	40
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	LCK	33	49
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	RAF1	21	41
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	KDR	22	45
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	CCR2	72	43
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	BLK	20	43
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	HCK	20	41
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	LYN	31	41
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	TEK	35	42
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	BMX	32	43
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	BTK	29	49
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	BRAF	38	47
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	TEC	16	43
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	TXK	28	43
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	TAAR1	48	41
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	NTRK3	19	40
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	IMDH_CRYPV	42	35
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	KCNK3	131	59
CON(C)C(=O)CCNc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436244	GH	On-Demand	Anodyne	KCNK9	89	42
C/C(=C/C(=O)N1CCCN(C=O)CC1)c1ccccc1C(F)(F)F	ZINC000819436247	EF	On-Demand	Anodyne	RBP4	68	36
C/C(=C/C(=O)N1CCCN(C=O)CC1)c1ccccc1C(F)(F)F	ZINC000819436247	EF	On-Demand	Anodyne	SCD1	16	40
C[C@@H](CC(=O)N1CCC[C@H]1c1nn[nH]n1)S(=O)(=O)c1ccc(F)cc1	ZINC000819436253	FD	On-Demand	Anodyne	CPT1A	29	41
C[C@@H](CC(=O)N1CCC[C@@H]1c1nn[nH]n1)S(=O)(=O)c1ccc(F)cc1	ZINC000819436254	FD	On-Demand	Anodyne	CPT1A	29	41
CCOc1nc2ccc(C(=O)N3CCCN(C=O)CC3)cc2[nH]1	ZINC000819436260	DD	On-Demand	Anodyne	HPGD	46	37
O=CN1CCCN(C(=O)CSc2nnc(-c3ccc4ccccc4c3)o2)CC1	ZINC000819436266	GF	On-Demand	Anodyne	GSK3A	40	37
O=CN1CCCN(C(=O)CSc2nnc(-c3ccc4ccccc4c3)o2)CC1	ZINC000819436266	GF	On-Demand	Anodyne	ALOX15	59	46
CCOc1ccc(OC)cc1NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819436272	FF	On-Demand	Anodyne	MTNR1A	78	46
CCOc1ccc(OC)cc1NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819436272	FF	On-Demand	Anodyne	MTNR1B	64	46
CCOc1ccc(OC)cc1NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819436274	FF	On-Demand	Anodyne	MTNR1A	78	46
CCOc1ccc(OC)cc1NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819436274	FF	On-Demand	Anodyne	MTNR1B	64	46
COc1ccccc1NC(=O)COc1ccc(C(=O)N2CCCN(C=O)CC2)cc1OC	ZINC000819436277	IE	On-Demand	Anodyne	HPGD	18	41
O=CN1CCCN(C(=O)[C@@H]2CCCN2C(=O)c2ccccc2OC(F)F)CC1	ZINC000819436284	GD	On-Demand	Anodyne	PREP	86	48
O=CN1CCCN(C(=O)[C@@H]2CCCN2C(=O)c2ccccc2OC(F)F)CC1	ZINC000819436284	GD	On-Demand	Anodyne	WNT3	41	33
O=CN1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2OC(F)F)CC1	ZINC000819436286	GD	On-Demand	Anodyne	PREP	86	48
O=CN1CCCN(C(=O)[C@H]2CCCN2C(=O)c2ccccc2OC(F)F)CC1	ZINC000819436286	GD	On-Demand	Anodyne	WNT3	41	33
O=CN1CCCN(C(=O)CNC(=O)c2ccccn2)CC1	ZINC000819436294	CB	On-Demand	Anodyne	PREP	18	46
O=CN1CCCN(C(=O)CNC(=O)c2ccccn2)CC1	ZINC000819436294	CB	On-Demand	Anodyne	GRM4	51	36
Cc1c(Br)cccc1CC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819436295	FE	On-Demand	Anodyne	CPT1A	72	38
Cc1c(Br)cccc1CC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819436296	FE	On-Demand	Anodyne	CPT1A	72	38
O=CN1CCCN(C(=O)C[C@H](O)c2cccc(F)c2)CC1	ZINC000819436298	CC	On-Demand	Anodyne	DPP8	17	42
O=CN1CCCN(C(=O)C[C@@H](O)c2cccc(F)c2)CC1	ZINC000819436300	CC	On-Demand	Anodyne	DPP8	17	42
O=CN1CCCN(C(=O)c2ccccc2-n2cnnn2)CC1	ZINC000819436310	DB	On-Demand	Anodyne	KCNJ1	46	32
CCOc1ccc(OC)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819436311	DG	On-Demand	Anodyne	ADRB2	27	40
CCOc1ccc(OC)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819436311	DG	On-Demand	Anodyne	ADRB1	19	40
CCOc1ccc(OC)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819436311	DG	On-Demand	Anodyne	ADRB3	20	40
CCOc1ccc(OC)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819436311	DG	On-Demand	Anodyne	ABCB1	41	39
CCOc1ccc(OC)cc1NC[C@H](O)CCc1ccccc1	ZINC000819436314	DG	On-Demand	Anodyne	ADRB2	27	40
CCOc1ccc(OC)cc1NC[C@H](O)CCc1ccccc1	ZINC000819436314	DG	On-Demand	Anodyne	ADRB1	19	40
CCOc1ccc(OC)cc1NC[C@H](O)CCc1ccccc1	ZINC000819436314	DG	On-Demand	Anodyne	ADRB3	20	40
CCOc1ccc(OC)cc1NC[C@H](O)CCc1ccccc1	ZINC000819436314	DG	On-Demand	Anodyne	ABCB1	41	39
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCN(C=O)CC1	ZINC000819436321	HD	On-Demand	Bother	P2RY12	105	35
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCN(C=O)CC1	ZINC000819436321	HD	On-Demand	Bother	TRY2_BOVIN	45	37
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCN(C=O)CC1	ZINC000819436321	HD	On-Demand	Bother	CCKBR	22	41
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCN(C=O)CC1	ZINC000819436323	HD	On-Demand	Bother	P2RY12	105	35
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCN(C=O)CC1	ZINC000819436323	HD	On-Demand	Bother	TRY2_BOVIN	45	37
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCN(C=O)CC1	ZINC000819436323	HD	On-Demand	Bother	CCKBR	22	41
O=C1CCCc2cc(NC[C@H](O)c3ccc(F)cn3)ccc2N1	ZINC000819436330	DF	On-Demand	Anodyne	PTK2B	18	41
O=C1CCCc2cc(NC[C@@H](O)c3ccc(F)cn3)ccc2N1	ZINC000819436332	DF	On-Demand	Anodyne	PTK2B	18	41
O=CN1CCCN(C(=O)c2ccc3c(c2)C(=O)N(C2CCCCC2)C3=O)CC1	ZINC000819436344	GD	On-Demand	Anodyne	L3MBTL3	88	42
CCOc1ccc(OC)cc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819436350	FF	On-Demand	Bother	ADRB2	23	45
CCOc1ccc(OC)cc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819436350	FF	On-Demand	Bother	ADRB1	21	40
CCOc1ccc(OC)cc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819436354	FF	On-Demand	Bother	ADRB2	23	45
CCOc1ccc(OC)cc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819436354	FF	On-Demand	Bother	ADRB1	21	40
CCOc1ccc(OC)cc1NC[C@H](O)COCc1ccccc1	ZINC000819436357	EG	On-Demand	Anodyne	ABCB1	25	42
O=CN1CCCN(C(=O)c2nn(-c3ccc(Cl)cc3Cl)c3c2CCC3)CC1	ZINC000819436359	HF	On-Demand	Anodyne	CNR1	74	46
O=CN1CCCN(C(=O)c2nn(-c3ccc(Cl)cc3Cl)c3c2CCC3)CC1	ZINC000819436359	HF	On-Demand	Anodyne	CNR2	22	46
CCOc1ccc(OC)cc1NC[C@@H](O)COCc1ccccc1	ZINC000819436360	EG	On-Demand	Anodyne	ABCB1	25	42
CCOc1ccc(OC)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819436378	CF	On-Demand	Anodyne	MTNR1A	20	40
CCOc1ccc(OC)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819436378	CF	On-Demand	Anodyne	MTNR1B	19	40
CCOc1ccc(OC)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819436379	CF	On-Demand	Anodyne	MTNR1A	20	40
CCOc1ccc(OC)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819436379	CF	On-Demand	Anodyne	MTNR1B	19	40
O=CN1CCCN(C(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)CC1	ZINC000819436382	GC	On-Demand	Anodyne	L3MBTL3	52	37
O=CN1CCCN(C(=O)C(=O)NCCCc2ccccc2)CC1	ZINC000819436383	DC	On-Demand	Anodyne	FKBP1A	22	42
O=CN1CCCN(C(=O)C(=O)NCCCc2ccccc2)CC1	ZINC000819436383	DC	On-Demand	Anodyne	PREP	38	42
O=CN1CCCN(C(=O)C(=O)NCCCc2ccccc2)CC1	ZINC000819436383	DC	On-Demand	Anodyne	DPP7	25	46
O=CN1CCCN(C(=O)C(=O)NCCCc2ccccc2)CC1	ZINC000819436383	DC	On-Demand	Anodyne	AMP1_PLAFQ	23	44
O=CN1CCCN(C(=O)C(=O)NCCCc2ccccc2)CC1	ZINC000819436383	DC	On-Demand	Anodyne	POLG_WNV	45	32
O=CN1CCCN(C(=O)c2ccccc2OCc2ccc(Cl)cc2Cl)CC1	ZINC000819436386	HH	On-Demand	Anodyne	PTGER1	42	41
O=CN1CCCN(C(=O)Cc2cccs2)CC1	ZINC000819436391	CC	On-Demand	Anodyne	PREP	15	49
O=CN1CCCN(C(=O)Cc2cccs2)CC1	ZINC000819436391	CC	On-Demand	Anodyne	ETHR	32	46
O=C1CCCc2cc(NC[C@H](O)c3ccc(C(F)(F)F)cc3)ccc2N1	ZINC000819436395	FI	On-Demand	Anodyne	PTK2B	20	42
O=C1CCCc2cc(NC[C@@H](O)c3ccc(C(F)(F)F)cc3)ccc2N1	ZINC000819436398	FI	On-Demand	Anodyne	PTK2B	20	42
O=C1CCCc2cc(NC[C@H](O)c3ccc(Cl)c(F)c3)ccc2N1	ZINC000819436401	EH	On-Demand	Anodyne	PKM	32	42
O=C1CCCc2cc(NC[C@@H](O)c3ccc(Cl)c(F)c3)ccc2N1	ZINC000819436402	EH	On-Demand	Anodyne	PKM	32	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2[nH]ccc12	ZINC000819436404	GI	On-Demand	Anodyne	CTSD	72	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2[nH]ccc12	ZINC000819436404	GI	On-Demand	Anodyne	PGC	60	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2[nH]ccc12	ZINC000819436404	GI	On-Demand	Anodyne	PAPA1_CARPA	31	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2[nH]ccc12	ZINC000819436404	GI	On-Demand	Anodyne	CCKAR	86	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2[nH]ccc12	ZINC000819436404	GI	On-Demand	Anodyne	CTSL	18	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2[nH]ccc12	ZINC000819436404	GI	On-Demand	Anodyne	PGA	41	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2[nH]ccc12	ZINC000819436404	GI	On-Demand	Anodyne	BACE2	44	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2[nH]ccc12	ZINC000819436404	GI	On-Demand	Anodyne	TACR3	17	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2[nH]ccc12	ZINC000819436404	GI	On-Demand	Anodyne	ECE1	17	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2[nH]ccc12	ZINC000819436404	GI	On-Demand	Anodyne	REN	85	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2[nH]ccc12	ZINC000819436404	GI	On-Demand	Anodyne	REN1	30	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2[nH]ccc12	ZINC000819436404	GI	On-Demand	Anodyne	CCKBR	47	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2[nH]ccc12	ZINC000819436404	GI	On-Demand	Anodyne	BACE1	57	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2[nH]ccc12	ZINC000819436404	GI	On-Demand	Anodyne	FPR1	53	45
C[C@@](O)(CNC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F)c1ccc(F)cc1	ZINC000819436408	FH	On-Demand	Anodyne	CACNA1G	35	41
C[C@@H](c1cccc(NC[C@@H](O)c2cccnc2)c1)N1CCOCC1	ZINC000819436417	EF	On-Demand	Anodyne	ADRB3	64	39
C[C@@H](c1cccc(NC[C@@H](O)c2cccnc2)c1)N1CCOCC1	ZINC000819436417	EF	On-Demand	Anodyne	CASR	19	41
C[C@@H](c1cccc(NC[C@@H](O)c2cccnc2)c1)N1CCOCC1	ZINC000819436417	EF	On-Demand	Anodyne	KCNA5	17	41
C[C@@H](c1cccc(NC[C@H](O)c2cccnc2)c1)N1CCOCC1	ZINC000819436418	EF	On-Demand	Anodyne	ADRB3	64	39
C[C@@H](c1cccc(NC[C@H](O)c2cccnc2)c1)N1CCOCC1	ZINC000819436418	EF	On-Demand	Anodyne	CASR	19	41
C[C@@H](c1cccc(NC[C@H](O)c2cccnc2)c1)N1CCOCC1	ZINC000819436418	EF	On-Demand	Anodyne	KCNA5	17	41
COCC1(O)CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819436419	FD	On-Demand	Mild	GHRHR	40	34
COCC1(O)CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819436419	FD	On-Demand	Mild	PAPA1_CARPA	33	44
COCC1(O)CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819436420	FD	On-Demand	Mild	GHRHR	40	34
COCC1(O)CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819436420	FD	On-Demand	Mild	PAPA1_CARPA	33	44
COC(=O)CN1CCN(c2ccc(NCC3(O)CCOCC3)cc2)CC1	ZINC000819436421	FC	On-Demand	Anodyne	STAT6	69	35
CCOc1ccc(OC)cc1NC[C@@H](O)COCC(C)C	ZINC000819436422	CF	On-Demand	Anodyne	ADRB2	22	41
CCOc1ccc(OC)cc1NC[C@H](O)COCC(C)C	ZINC000819436423	CF	On-Demand	Anodyne	ADRB2	22	41
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1cccc(Cl)c1	ZINC000819436433	EI	On-Demand	Anodyne	ADRB2	23	50
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1cccc(Cl)c1	ZINC000819436433	EI	On-Demand	Anodyne	ADRB1	34	50
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1cccc(Cl)c1	ZINC000819436433	EI	On-Demand	Anodyne	ADRB3	58	50
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1cccc(Cl)c1	ZINC000819436433	EI	On-Demand	Anodyne	SIGMAR1	20	42
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1cccc(Cl)c1	ZINC000819436433	EI	On-Demand	Anodyne	CYP3A4	40	34
O[C@H](CNc1ccc(CCN2CCCC2)cc1)c1cccc(Cl)c1	ZINC000819436434	EI	On-Demand	Anodyne	ADRB2	23	50
O[C@H](CNc1ccc(CCN2CCCC2)cc1)c1cccc(Cl)c1	ZINC000819436434	EI	On-Demand	Anodyne	ADRB1	34	50
O[C@H](CNc1ccc(CCN2CCCC2)cc1)c1cccc(Cl)c1	ZINC000819436434	EI	On-Demand	Anodyne	ADRB3	58	50
O[C@H](CNc1ccc(CCN2CCCC2)cc1)c1cccc(Cl)c1	ZINC000819436434	EI	On-Demand	Anodyne	SIGMAR1	20	42
O[C@H](CNc1ccc(CCN2CCCC2)cc1)c1cccc(Cl)c1	ZINC000819436434	EI	On-Demand	Anodyne	CYP3A4	40	34
CC(C)(O)CNc1ccc(N2CCNC(=O)C2)c(Cl)c1	ZINC000819436441	CD	On-Demand	Anodyne	NPY2R	44	41
OC1(CNc2ccc(N3CCCC3)c(Cl)c2)CCC1	ZINC000819436460	CG	On-Demand	Anodyne	NPY2R	48	41
NC(=O)CCNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819436461	CF	On-Demand	Anodyne	CNR1	51	31
NC(=O)CCNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819436461	CF	On-Demand	Anodyne	KCNQ2	63	37
NC(=O)CCNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819436461	CF	On-Demand	Anodyne	NPY2R	61	43
CN(C[C@@H](O)CNc1ccc(N2CCCCC2)c(Cl)c1)C1CC1	ZINC000819436474	EG	On-Demand	Anodyne	NPY2R	59	41
CN(C[C@H](O)CNc1ccc(N2CCCCC2)c(Cl)c1)C1CC1	ZINC000819436475	EG	On-Demand	Anodyne	NPY2R	59	41
O[C@H](CNc1ccc(N2CCCCC2)c(Cl)c1)C(F)(F)F	ZINC000819436481	DH	On-Demand	Anodyne	NPY2R	52	43
O[C@@H](CNc1ccc(N2CCCCC2)c(Cl)c1)C(F)(F)F	ZINC000819436482	DH	On-Demand	Anodyne	NPY2R	52	43
O=C(CCNc1ccc(N2CCCC2)c(Cl)c1)Nc1ccccc1F	ZINC000819436483	FJ	On-Demand	Anodyne	AVPR2	16	40
O=C(CCNc1ccc(N2CCCC2)c(Cl)c1)Nc1ccccc1F	ZINC000819436483	FJ	On-Demand	Anodyne	KCNQ2	86	49
O=C(CCNc1ccc(N2CCCC2)c(Cl)c1)Nc1ccccc1F	ZINC000819436483	FJ	On-Demand	Anodyne	NPY2R	108	48
O=C(CCNc1ccc(N2CCCC2)c(Cl)c1)Nc1ccccc1F	ZINC000819436483	FJ	On-Demand	Anodyne	CHRNA7	15	40
CCOC[C@H](O)CNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819436489	DG	On-Demand	Anodyne	NPY2R	49	37
CC(C)(O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819436525	CG	On-Demand	Anodyne	KCNQ2	48	35
CC(C)(O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819436525	CG	On-Demand	Anodyne	NPY2R	57	45
O=CN1CCCN(C(=O)C2CCC(NC(=O)C3CCCC3)CC2)CC1	ZINC000819436527	ED	On-Demand	Anodyne	EPHX2	17	40
COc1cccc(OC)c1C(=O)N1CCCN(C=O)CC1	ZINC000819436534	CD	On-Demand	Anodyne	HTR1A	16	41
O=CN1CCCN(C(=O)CCOc2ccc(F)cc2)CC1	ZINC000819436552	CD	On-Demand	Anodyne	LTA4H	17	40
O=CN1CCCN(C(=O)COc2cccnc2)CC1	ZINC000819436566	CC	On-Demand	Anodyne	CHRNA7	24	40
O=CN1CCCN(C(=O)COc2cccnc2)CC1	ZINC000819436566	CC	On-Demand	Anodyne	CPT1A	79	44
O=CN1CCCN(C(=O)COc2cccnc2)CC1	ZINC000819436566	CC	On-Demand	Anodyne	CPT2	42	37
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N1CCCN(C=O)CC1	ZINC000819436569	FD	On-Demand	Anodyne	GHRHR	26	40
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N1CCCN(C=O)CC1	ZINC000819436569	FD	On-Demand	Anodyne	TACR1	16	41
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N1CCCN(C=O)CC1	ZINC000819436569	FD	On-Demand	Anodyne	MC4R	54	41
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N1CCCN(C=O)CC1	ZINC000819436569	FD	On-Demand	Anodyne	MPO	43	35
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N1CCCN(C=O)CC1	ZINC000819436569	FD	On-Demand	Anodyne	MC5R	52	36
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N1CCCN(C=O)CC1	ZINC000819436569	FD	On-Demand	Anodyne	MMP8	15	45
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N1CCCN(C=O)CC1	ZINC000819436569	FD	On-Demand	Anodyne	GRPR	51	32
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N1CCCN(C=O)CC1	ZINC000819436569	FD	On-Demand	Anodyne	GHSR	16	42
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)N1CCCN(C=O)CC1	ZINC000819436569	FD	On-Demand	Anodyne	KISS1R	42	34
O=CN1CCCN(C(=O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000819436570	ED	On-Demand	Anodyne	HTR1B	17	40
O=CN1CCCN(C(=O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000819436570	ED	On-Demand	Anodyne	CPT1A	46	40
O=CN1CCCN(C(=O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000819436570	ED	On-Demand	Anodyne	CPT2	40	35
O=CN1CCCN(C(=O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000819436570	ED	On-Demand	Anodyne	GALR3	46	34
O=CN1CCCN(C(=O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000819436570	ED	On-Demand	Anodyne	PDS	44	40
O=CN1CCCN(C(=O)[C@@H]2CCCCN2C2CCCC2)CC1	ZINC000819436575	DD	On-Demand	Anodyne	PREP	48	39
O=CN1CCCN(C(=O)[C@H]2CCCCN2C2CCCC2)CC1	ZINC000819436576	DD	On-Demand	Anodyne	PREP	48	39
O=CN1CCCN(C(=O)CCN2CCN(c3ccccc3)CC2)CC1	ZINC000819436577	EC	On-Demand	Anodyne	HTR1A	60	54
O=CN1CCCN(C(=O)CCN2CCN(c3ccccc3)CC2)CC1	ZINC000819436577	EC	On-Demand	Anodyne	DRD2	32	49
O=CN1CCCN(C(=O)CCN2CCN(c3ccccc3)CC2)CC1	ZINC000819436577	EC	On-Demand	Anodyne	DRD4	34	41
O=CN1CCCN(C(=O)CCN2CCN(c3ccccc3)CC2)CC1	ZINC000819436577	EC	On-Demand	Anodyne	HTR2A	33	49
O=CN1CCCN(C(=O)CCN2CCN(c3ccccc3)CC2)CC1	ZINC000819436577	EC	On-Demand	Anodyne	DRD3	33	42
O=CN1CCCN(C(=O)CCN2CCN(c3ccccc3)CC2)CC1	ZINC000819436577	EC	On-Demand	Anodyne	HTR7	81	45
O=CN1CCCN(C(=O)CCN2CCN(c3ccccc3)CC2)CC1	ZINC000819436577	EC	On-Demand	Anodyne	ADAM10	32	42
O=CN1CCCN(C(=O)c2ccc(Oc3ccc(Br)cc3)c(F)c2)CC1	ZINC000819436578	HH	On-Demand	Anodyne	HRH3	29	44
O=CN1CCCN(C(=O)COc2cccc(Br)c2)CC1	ZINC000819436581	ED	On-Demand	Anodyne	HTR1D	16	42
O=CN1CCCN(C(=O)COc2cccc(Br)c2)CC1	ZINC000819436581	ED	On-Demand	Anodyne	HTR1B	18	42
O=CN1CCCN(C(=O)COc2cccc(Br)c2)CC1	ZINC000819436581	ED	On-Demand	Anodyne	CPT1A	68	36
O=CN1CCCN(C(=O)COc2cccc(Br)c2)CC1	ZINC000819436581	ED	On-Demand	Anodyne	CPT2	42	36
O=CN1CCCN(C(=O)c2cccc(-n3cnnn3)c2)CC1	ZINC000819436593	DB	On-Demand	Anodyne	HPGD	47	40
O=CN1CCCN(C(=O)c2cccc(-n3cnnn3)c2)CC1	ZINC000819436593	DB	On-Demand	Anodyne	KCNJ1	47	36
O=CN1CCCN(C(=O)COc2ccc(OCc3ccccc3)cc2)CC1	ZINC000819436595	FE	On-Demand	Anodyne	MAOB	20	40
O=CN1CCCN(C(=O)COc2ccc(OCc3ccccc3)cc2)CC1	ZINC000819436595	FE	On-Demand	Anodyne	LTA4H	34	44
O=CN1CCCN(C(=O)COc2ccc(OCc3ccccc3)cc2)CC1	ZINC000819436595	FE	On-Demand	Anodyne	CPT1A	72	37
O=CN1CCCN(C(=O)COc2ccc(OCc3ccccc3)cc2)CC1	ZINC000819436595	FE	On-Demand	Anodyne	CPT2	42	36
O=CN1CCCN(C(=O)COc2ccc(OCc3ccccc3)cc2)CC1	ZINC000819436595	FE	On-Demand	Anodyne	FAAH	17	46
O=CN1CCCN(C(=O)COc2ccc(OCc3ccccc3)cc2)CC1	ZINC000819436595	FE	On-Demand	Anodyne	DPP7	20	46
O=CN1CCCN(C(=O)COc2ccc(OCc3ccccc3)cc2)CC1	ZINC000819436595	FE	On-Demand	Anodyne	FFAR1	35	43
O=CN1CCCN(C(=O)c2cc(-c3ccccc3)nc3cc(F)ccc23)CC1	ZINC000819436604	GG	On-Demand	Anodyne	DHODH	48	51
O=CN1CCCN(C(=O)c2cc(-c3ccccc3)nc3cc(F)ccc23)CC1	ZINC000819436604	GG	On-Demand	Anodyne	PRS	47	40
O=CN1CCCN(C(=O)[C@@H]2CSCN2C(=O)c2ccc(Cl)cc2)CC1	ZINC000819436607	GD	On-Demand	Anodyne	PREP	48	47
O=CN1CCCN(C(=O)[C@H]2CSCN2C(=O)c2ccc(Cl)cc2)CC1	ZINC000819436608	GD	On-Demand	Anodyne	PREP	48	47
O=CN1CCCN(C(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000819436613	IF	On-Demand	Bother	WDR5	34	44
CCCOc1ccc(OCC(=O)N2CCCN(C=O)CC2)cc1	ZINC000819436620	DD	On-Demand	Anodyne	PLA2G4B	87	38
O=CN1CCCN(C(=O)C2(Cc3cccc(Cl)c3)CCCC2)CC1	ZINC000819436621	EG	On-Demand	Anodyne	DPP7	15	41
CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)N1CCCN(C=O)CC1	ZINC000819436627	DD	On-Demand	Anodyne	PREP	83	64
CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)N1CCCN(C=O)CC1	ZINC000819436627	DD	On-Demand	Anodyne	SFRP1	39	44
CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)N1CCCN(C=O)CC1	ZINC000819436627	DD	On-Demand	Anodyne	WNT3	44	44
CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)N1CCCN(C=O)CC1	ZINC000819436629	DD	On-Demand	Anodyne	PREP	83	64
CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)N1CCCN(C=O)CC1	ZINC000819436629	DD	On-Demand	Anodyne	SFRP1	39	44
CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)N1CCCN(C=O)CC1	ZINC000819436629	DD	On-Demand	Anodyne	WNT3	44	44
CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCCN(C=O)CC1	ZINC000819436638	DD	On-Demand	Bother	HCN1	48	33
CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCCN(C=O)CC1	ZINC000819436638	DD	On-Demand	Bother	HCN4	41	32
CCNS(=O)(=O)c1ccc(F)c(C(=O)N2CCCN(C=O)CC2)c1	ZINC000819436656	FC	On-Demand	Anodyne	SLC6A9	32	40
CCNS(=O)(=O)c1ccc(F)c(C(=O)N2CCCN(C=O)CC2)c1	ZINC000819436656	FC	On-Demand	Anodyne	PARP1	51	39
C/C=C/c1ccc(OCC(=O)N2CCCN(C=O)CC2)c(OC)c1	ZINC000819436658	ED	On-Demand	Anodyne	ACKR3	44	32
C/C=C\c1ccc(OCC(=O)N2CCCN(C=O)CC2)c(OC)c1	ZINC000819436659	ED	On-Demand	Anodyne	ACKR3	44	32
CCOc1ccc(OC)cc1NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819436692	FF	On-Demand	Anodyne	ADRB3	31	41
CCOc1ccc(OC)cc1NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819436693	FF	On-Demand	Anodyne	ADRB3	31	41
C[C@@H](c1cccc(NC[C@@H](O)CCNC(=O)OC(C)(C)C)c1)N1CCOCC1	ZINC000819436698	GF	On-Demand	Anodyne	CASR	23	40
C[C@@H](c1cccc(NC[C@H](O)CCNC(=O)OC(C)(C)C)c1)N1CCOCC1	ZINC000819436699	GF	On-Demand	Anodyne	CASR	23	40
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)Cc3ccccc3)cc2)CC1	ZINC000819436701	GD	On-Demand	Anodyne	HTR1A	20	40
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)Cc3ccccc3)cc2)CC1	ZINC000819436701	GD	On-Demand	Anodyne	PRNP	39	40
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)Cc3ccccc3)cc2)CC1	ZINC000819436701	GD	On-Demand	Anodyne	ABCB1	52	40
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)Cc3ccccc3)cc2)CC1	ZINC000819436701	GD	On-Demand	Anodyne	STAT6	52	36
COC(=O)CN1CCN(c2ccc(NC[C@H](O)Cc3ccccc3)cc2)CC1	ZINC000819436702	GD	On-Demand	Anodyne	HTR1A	20	40
COC(=O)CN1CCN(c2ccc(NC[C@H](O)Cc3ccccc3)cc2)CC1	ZINC000819436702	GD	On-Demand	Anodyne	PRNP	39	40
COC(=O)CN1CCN(c2ccc(NC[C@H](O)Cc3ccccc3)cc2)CC1	ZINC000819436702	GD	On-Demand	Anodyne	ABCB1	52	40
COC(=O)CN1CCN(c2ccc(NC[C@H](O)Cc3ccccc3)cc2)CC1	ZINC000819436702	GD	On-Demand	Anodyne	STAT6	52	36
CCOc1ccc(OC)cc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819436713	EG	On-Demand	Bother	CACNA1D	54	34
CCOc1ccc(OC)cc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819436714	EG	On-Demand	Bother	CACNA1D	54	34
CCOc1ccc(OC)cc1NC[C@H](O)c1ccccc1Br	ZINC000819436717	FI	On-Demand	Anodyne	MTNR1A	20	41
CCOc1ccc(OC)cc1NC[C@@H](O)c1ccccc1Br	ZINC000819436718	FI	On-Demand	Anodyne	MTNR1A	20	41
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436727	FI	On-Demand	Anodyne	KIT	15	44
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436727	FI	On-Demand	Anodyne	KCNJ11	25	42
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436727	FI	On-Demand	Anodyne	LCK	28	44
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436727	FI	On-Demand	Anodyne	KDR	18	45
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436727	FI	On-Demand	Anodyne	CCR2	85	44
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436727	FI	On-Demand	Anodyne	BLK	19	41
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436727	FI	On-Demand	Anodyne	TEK	26	44
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436727	FI	On-Demand	Anodyne	BMX	31	41
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436727	FI	On-Demand	Anodyne	BTK	27	48
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436727	FI	On-Demand	Anodyne	BRAF	40	49
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436727	FI	On-Demand	Anodyne	EPHB4	18	43
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436727	FI	On-Demand	Anodyne	TEC	15	41
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436727	FI	On-Demand	Anodyne	TXK	27	41
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436727	FI	On-Demand	Anodyne	NTRK3	20	44
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436727	FI	On-Demand	Anodyne	KCNK3	126	63
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436727	FI	On-Demand	Anodyne	KCNK9	84	41
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436728	FI	On-Demand	Anodyne	KIT	15	44
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436728	FI	On-Demand	Anodyne	KCNJ11	25	42
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436728	FI	On-Demand	Anodyne	LCK	28	44
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436728	FI	On-Demand	Anodyne	KDR	18	45
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436728	FI	On-Demand	Anodyne	CCR2	85	44
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436728	FI	On-Demand	Anodyne	BLK	19	41
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436728	FI	On-Demand	Anodyne	TEK	26	44
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436728	FI	On-Demand	Anodyne	BMX	31	41
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436728	FI	On-Demand	Anodyne	BTK	27	48
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436728	FI	On-Demand	Anodyne	BRAF	40	49
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436728	FI	On-Demand	Anodyne	EPHB4	18	43
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436728	FI	On-Demand	Anodyne	TEC	15	41
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436728	FI	On-Demand	Anodyne	TXK	27	41
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436728	FI	On-Demand	Anodyne	NTRK3	20	44
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436728	FI	On-Demand	Anodyne	KCNK3	126	63
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)c1cccc(C(F)(F)F)c1	ZINC000819436728	FI	On-Demand	Anodyne	KCNK9	84	41
C[C@@H](c1cccc(NC[C@H](O)CN(C)C(=O)OC(C)(C)C)c1)N1CCOCC1	ZINC000819436730	GF	On-Demand	Anodyne	CASR	23	41
C[C@@H](c1cccc(NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)c1)N1CCOCC1	ZINC000819436731	GF	On-Demand	Anodyne	CASR	23	41
COC(=O)CSCc1cccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436735	GI	On-Demand	Anodyne	PDS	42	37
COC(=O)CSCc1cccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819436736	GI	On-Demand	Anodyne	PDS	42	37
N#Cc1ccc(Oc2cccc(NC[C@@H](O)C3CC3)c2)cc1	ZINC000819436753	CH	On-Demand	Mild	PFKFB3	47	32
N#Cc1ccc(Oc2cccc(NC[C@H](O)C3CC3)c2)cc1	ZINC000819436757	CH	On-Demand	Mild	PFKFB3	47	32
C#CCOc1ccc(NC[C@@H](O)COC)cc1	ZINC000819436758	BD	On-Demand	Mild	ADRB2	29	44
C#CCOc1ccc(NC[C@@H](O)COC)cc1	ZINC000819436758	BD	On-Demand	Mild	ADRB1	38	44
C#CCOc1ccc(NC[C@H](O)COC)cc1	ZINC000819436759	BD	On-Demand	Mild	ADRB2	29	44
C#CCOc1ccc(NC[C@H](O)COC)cc1	ZINC000819436759	BD	On-Demand	Mild	ADRB1	38	44
COC(=O)C1(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCSCC1	ZINC000819436764	GE	On-Demand	Mild	PAPA1_CARPA	39	48
COC(=O)C1(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCSCC1	ZINC000819436768	GE	On-Demand	Mild	PAPA1_CARPA	39	48
COC(=O)CSCc1cccc(NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819436772	FH	On-Demand	Anodyne	ADRB1	26	40
COC(=O)CSCc1cccc(NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819436772	FH	On-Demand	Anodyne	ADRB3	35	40
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1ccccc1F	ZINC000819436776	EI	On-Demand	Anodyne	KCNQ2	63	41
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1ccccc1F	ZINC000819436776	EI	On-Demand	Anodyne	NPY2R	78	44
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1ccccc1F	ZINC000819436778	EI	On-Demand	Anodyne	KCNQ2	63	41
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1ccccc1F	ZINC000819436778	EI	On-Demand	Anodyne	NPY2R	78	44
CN(C)CCCOc1ccc(NC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819436782	GH	On-Demand	Anodyne	ESRRG	43	31
CN(C)CCCOc1ccc(NC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819436783	GH	On-Demand	Anodyne	ESRRG	43	31
C#CCOc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1	ZINC000819436785	DF	On-Demand	Mild	ADRB2	44	58
C#CCOc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1	ZINC000819436785	DF	On-Demand	Mild	ADRB1	55	49
C#CCOc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1	ZINC000819436785	DF	On-Demand	Mild	ADRB3	31	42
C#CCOc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1	ZINC000819436787	DF	On-Demand	Mild	ADRB2	44	58
C#CCOc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1	ZINC000819436787	DF	On-Demand	Mild	ADRB1	55	49
C#CCOc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1	ZINC000819436787	DF	On-Demand	Mild	ADRB3	31	42
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(CCN3CCCC3)cc2)c1	ZINC000819436798	FG	On-Demand	Bother	KCNJ1	33	46
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(CCN3CCCC3)cc2)c1	ZINC000819436799	FG	On-Demand	Bother	KCNJ1	33	46
CN(C)CCCOc1ccc(NC[C@H](O)CC(F)(F)F)cc1	ZINC000819436802	DF	On-Demand	Anodyne	ESRRG	41	30
CN(C)CCCOc1ccc(NC[C@@H](O)CC(F)(F)F)cc1	ZINC000819436805	DF	On-Demand	Anodyne	ESRRG	41	30
CN(C)CCCOc1ccc(NC[C@H](O)C2CC2)cc1	ZINC000819436807	CE	On-Demand	Anodyne	ESRRG	42	30
CN(C)CCCOc1ccc(NC[C@@H](O)C2CC2)cc1	ZINC000819436809	CE	On-Demand	Anodyne	ESRRG	42	30
CN(C)CCCOc1ccc(NC[C@H](O)c2ccccc2Cl)cc1	ZINC000819436812	EH	On-Demand	Anodyne	LTA4H	20	40
CN(C)CCCOc1ccc(NC[C@H](O)c2ccccc2Cl)cc1	ZINC000819436812	EH	On-Demand	Anodyne	ESRRG	48	37
C#CCOc1ccc(NC[C@@H](O)COCC)cc1	ZINC000819436814	BD	On-Demand	Mild	ADRB2	23	40
C#CCOc1ccc(NC[C@@H](O)COCC)cc1	ZINC000819436814	BD	On-Demand	Mild	ADRB1	24	40
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@@](C)(O)c1ccc(F)cc1	ZINC000819436815	CF	On-Demand	Anodyne	CACNA1G	34	40
C#CCOc1ccc(NC[C@H](O)COCC)cc1	ZINC000819436816	BD	On-Demand	Mild	ADRB2	23	40
C#CCOc1ccc(NC[C@H](O)COCC)cc1	ZINC000819436816	BD	On-Demand	Mild	ADRB1	24	40
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@](C)(O)c1ccc(F)cc1	ZINC000819436819	CF	On-Demand	Anodyne	CACNA1G	34	40
C[C@@H]1CCCC[C@H]1C(=O)NC[C@@](C)(O)c1ccc(F)cc1	ZINC000819436824	CF	On-Demand	Anodyne	CACNA1G	34	40
C[C@@H]1CCCC[C@H]1C(=O)NC[C@](C)(O)c1ccc(F)cc1	ZINC000819436828	CF	On-Demand	Anodyne	CACNA1G	34	40
CCOc1ccc(OC)cc1NC[C@@H](O)CN1CCCC1=O	ZINC000819436836	DD	On-Demand	Anodyne	MTNR1A	17	42
CCOc1ccc(OC)cc1NC[C@H](O)CN1CCCC1=O	ZINC000819436839	DD	On-Demand	Anodyne	MTNR1A	17	42
O[C@H](CNc1ccc(N2CCSCC2)c(Cl)c1)C(F)(F)F	ZINC000819436844	EG	On-Demand	Anodyne	NPY2R	46	39
O[C@@H](CNc1ccc(N2CCSCC2)c(Cl)c1)C(F)(F)F	ZINC000819436846	EG	On-Demand	Anodyne	NPY2R	46	39
C#CCOc1cccc(NC[C@@H](O)COCc2ccc(OC)cc2)c1	ZINC000819436848	EF	On-Demand	Mild	ADRB2	23	42
C#CCOc1cccc(NC[C@@H](O)COCc2ccc(OC)cc2)c1	ZINC000819436848	EF	On-Demand	Mild	ADRB3	15	41
C#CCOc1cccc(NC[C@@H](O)COCc2ccc(OC)cc2)c1	ZINC000819436848	EF	On-Demand	Mild	CASR	29	44
C#CCOc1cccc(NC[C@H](O)COCc2ccc(OC)cc2)c1	ZINC000819436849	EF	On-Demand	Mild	ADRB2	23	42
C#CCOc1cccc(NC[C@H](O)COCc2ccc(OC)cc2)c1	ZINC000819436849	EF	On-Demand	Mild	ADRB3	15	41
C#CCOc1cccc(NC[C@H](O)COCc2ccc(OC)cc2)c1	ZINC000819436849	EF	On-Demand	Mild	CASR	29	44
C#CCOc1cccc(NC[C@H](O)COc2ccc(C)cc2)c1	ZINC000819436850	DF	On-Demand	Mild	ADRB2	42	51
C#CCOc1cccc(NC[C@H](O)COc2ccc(C)cc2)c1	ZINC000819436850	DF	On-Demand	Mild	ADRB1	50	50
C#CCOc1cccc(NC[C@H](O)COc2ccc(C)cc2)c1	ZINC000819436850	DF	On-Demand	Mild	ADRB3	23	41
C#CCOc1cccc(NC[C@@H](O)COc2ccc(C)cc2)c1	ZINC000819436852	DF	On-Demand	Mild	ADRB2	42	51
C#CCOc1cccc(NC[C@@H](O)COc2ccc(C)cc2)c1	ZINC000819436852	DF	On-Demand	Mild	ADRB1	50	50
C#CCOc1cccc(NC[C@@H](O)COc2ccc(C)cc2)c1	ZINC000819436852	DF	On-Demand	Mild	ADRB3	23	41
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1ccc(F)cn1	ZINC000819436857	EH	On-Demand	Anodyne	NPY2R	42	39
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1ccc(F)cn1	ZINC000819436859	EH	On-Demand	Anodyne	NPY2R	42	39
CCCCN(C)c1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819436863	CG	On-Demand	Anodyne	ADRB3	77	45
CCCCN(C)c1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819436865	CG	On-Demand	Anodyne	ADRB3	77	45
CN(C)CCCOc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819436866	EG	On-Demand	Anodyne	ESRRG	43	31
OC1(CNc2ccc(N3CCCC3)c(Cl)c2)CCOCC1	ZINC000819436867	DF	On-Demand	Anodyne	NPY2R	41	36
CN(C)CCCOc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819436868	EG	On-Demand	Anodyne	ESRRG	43	31
CN(C)CCCOc1ccc(NC[C@](C)(O)C(F)(F)F)cc1	ZINC000819436869	DF	On-Demand	Anodyne	ESRRG	43	31
CN(C)CCCOc1ccc(NC[C@@](C)(O)C(F)(F)F)cc1	ZINC000819436870	DF	On-Demand	Anodyne	ESRRG	43	31
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)cc1	ZINC000819436872	GH	On-Demand	Anodyne	ADRB2	31	44
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)cc1	ZINC000819436872	GH	On-Demand	Anodyne	ADRB1	58	44
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)cc1	ZINC000819436872	GH	On-Demand	Anodyne	NPY2R	51	37
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)cc1	ZINC000819436872	GH	On-Demand	Anodyne	ABCB1	29	46
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)cc1	ZINC000819436874	GH	On-Demand	Anodyne	ADRB2	31	44
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)cc1	ZINC000819436874	GH	On-Demand	Anodyne	ADRB1	58	44
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)cc1	ZINC000819436874	GH	On-Demand	Anodyne	NPY2R	51	37
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)cc1	ZINC000819436874	GH	On-Demand	Anodyne	ABCB1	29	46
CN(C)CCCOc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819436883	EH	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCCOc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819436883	EH	On-Demand	Anodyne	UTS2	44	37
CN(C[C@@H](O)CNc1ccc(N2CCCC2)c(Cl)c1)C1CC1	ZINC000819436902	DF	On-Demand	Anodyne	NPY2R	65	40
CN(C[C@H](O)CNc1ccc(N2CCCC2)c(Cl)c1)C1CC1	ZINC000819436903	DF	On-Demand	Anodyne	NPY2R	65	40
CC[C@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819436907	CG	On-Demand	Anodyne	KCNQ2	61	38
CC[C@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819436907	CG	On-Demand	Anodyne	NPY2R	91	41
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819436909	EH	On-Demand	Anodyne	ADRB2	15	45
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819436909	EH	On-Demand	Anodyne	SIGMAR1	19	41
CN(C[C@@H](O)CNc1ccc(N2CCSCC2)c(Cl)c1)C1CC1	ZINC000819436910	FF	On-Demand	Anodyne	NPY2R	52	38
O[C@H](CNc1ccc(CCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819436911	EH	On-Demand	Anodyne	ADRB2	15	45
O[C@H](CNc1ccc(CCN2CCCC2)cc1)c1cccc(F)c1	ZINC000819436911	EH	On-Demand	Anodyne	SIGMAR1	19	41
CN(C[C@H](O)CNc1ccc(N2CCSCC2)c(Cl)c1)C1CC1	ZINC000819436912	FF	On-Demand	Anodyne	NPY2R	52	38
C#CCOc1cccc(NC[C@H](O)COC(C)C)c1	ZINC000819436914	CD	On-Demand	Mild	ADRB2	20	43
C#CCOc1cccc(NC[C@H](O)COC(C)C)c1	ZINC000819436914	CD	On-Demand	Mild	ADRB1	18	43
C#CCOc1cccc(NC[C@@H](O)COC(C)C)c1	ZINC000819436916	CD	On-Demand	Mild	ADRB2	20	43
C#CCOc1cccc(NC[C@@H](O)COC(C)C)c1	ZINC000819436916	CD	On-Demand	Mild	ADRB1	18	43
C#CCOc1ccc(NC[C@H](O)COc2ccc(OCC)cc2)cc1	ZINC000819436931	EF	On-Demand	Mild	ADRB2	45	46
C#CCOc1ccc(NC[C@H](O)COc2ccc(OCC)cc2)cc1	ZINC000819436931	EF	On-Demand	Mild	ADRB1	55	46
C#CCOc1ccc(NC[C@H](O)COc2ccc(OCC)cc2)cc1	ZINC000819436931	EF	On-Demand	Mild	ADRB3	32	40
C#CCOc1ccc(NC[C@@H](O)COc2ccc(OCC)cc2)cc1	ZINC000819436932	EF	On-Demand	Mild	ADRB2	45	46
C#CCOc1ccc(NC[C@@H](O)COc2ccc(OCC)cc2)cc1	ZINC000819436932	EF	On-Demand	Mild	ADRB1	55	46
C#CCOc1ccc(NC[C@@H](O)COc2ccc(OCC)cc2)cc1	ZINC000819436932	EF	On-Demand	Mild	ADRB3	32	40
O[C@@H](CNc1ccc(N2CCSCC2)c(Cl)c1)C1CC1	ZINC000819436934	DG	On-Demand	Anodyne	NPY2R	43	39
O[C@H](CNc1ccc(N2CCSCC2)c(Cl)c1)C1CC1	ZINC000819436937	DG	On-Demand	Anodyne	NPY2R	43	39
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccccc2SCCC#N)cc1	ZINC000819436941	GG	On-Demand	Mild	CTSF	48	37
CS(=O)(=O)c1ccc([C@H](O)CNc2ccccc2SCCC#N)cc1	ZINC000819436947	GG	On-Demand	Mild	CTSF	48	37
OC1(CNc2ccc(N3CCCCC3)c(Cl)c2)CCOCC1	ZINC000819436962	DG	On-Demand	Anodyne	NPY2R	40	38
O=CN1CCCN(C(=O)c2cn(Cc3ccccc3)c3ccccc23)CC1	ZINC000819436974	FF	On-Demand	Anodyne	CNR1	24	50
O=CN1CCCN(C(=O)c2cn(Cc3ccccc3)c3ccccc23)CC1	ZINC000819436974	FF	On-Demand	Anodyne	FABI	48	36
O=CN1CCCN(C(=O)c2cn(Cc3ccccc3)c3ccccc23)CC1	ZINC000819436974	FF	On-Demand	Anodyne	CNR2	26	50
O=CN1CCCN(C(=O)c2cn(Cc3ccccc3)c3ccccc23)CC1	ZINC000819436974	FF	On-Demand	Anodyne	TPSAB1	25	44
O=CN1CCCN(C(=O)c2cc(O)nc3ccc(F)cc23)CC1	ZINC000819436985	DD	On-Demand	Anodyne	DHODH	52	41
C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@@H]1C(=O)N1CCCN(C=O)CC1	ZINC000819436991	GE	On-Demand	Anodyne	DRD4	23	42
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@H]1C(=O)N1CCCN(C=O)CC1	ZINC000819436992	GE	On-Demand	Anodyne	DRD4	23	42
C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@H]1C(=O)N1CCCN(C=O)CC1	ZINC000819436993	GE	On-Demand	Anodyne	DRD4	23	42
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@@H]1C(=O)N1CCCN(C=O)CC1	ZINC000819436994	GE	On-Demand	Anodyne	DRD4	23	42
O=CN1CCCN(C(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000819436996	HC	On-Demand	Anodyne	EPHX2	41	40
O=C(CCSc1ccccn1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819437009	DD	On-Demand	Anodyne	CPT1A	105	40
O=C(CCSc1ccccn1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819437010	DD	On-Demand	Anodyne	CPT1A	105	40
CN(C)CCOc1ccccc1C(=O)N1CCCN(C=O)CC1	ZINC000819437011	DC	On-Demand	Anodyne	HCN1	52	32
CN(C)CCOc1ccccc1C(=O)N1CCCN(C=O)CC1	ZINC000819437011	DC	On-Demand	Anodyne	HCN4	41	31
COc1ccc(-c2nnc(SCC(=O)N3CCCN(C=O)CC3)o2)cc1	ZINC000819437013	GD	On-Demand	Anodyne	GSK3A	19	41
O=CN1CCCN(C(=O)C2CCN(S(=O)(=O)c3ccc(F)c(Cl)c3)CC2)CC1	ZINC000819437015	ID	On-Demand	Anodyne	TGM2	43	44
O=CN1CCCN(C(=O)C2CCN(S(=O)(=O)c3ccc(F)c(Cl)c3)CC2)CC1	ZINC000819437015	ID	On-Demand	Anodyne	F13A1	56	44
O=C(CCNc1ccc(N2CCCC2)c(Cl)c1)Nc1ccccc1[N+](=O)[O-]	ZINC000819437017	GI	On-Demand	Bother	KCNQ2	78	45
O=C(CCNc1ccc(N2CCCC2)c(Cl)c1)Nc1ccccc1[N+](=O)[O-]	ZINC000819437017	GI	On-Demand	Bother	NPY2R	73	40
CCOc1ccc(OC)cc1NC[C@H](O)COC	ZINC000819437018	CD	On-Demand	Anodyne	ADRB2	26	41
CCOc1ccc(OC)cc1NC[C@H](O)COC	ZINC000819437018	CD	On-Demand	Anodyne	MTNR1A	23	40
CCOc1ccc(OC)cc1NC[C@H](O)COC	ZINC000819437018	CD	On-Demand	Anodyne	MTNR1B	20	40
CCOc1ccc(OC)cc1NC[C@@H](O)COC	ZINC000819437020	CD	On-Demand	Anodyne	ADRB2	26	41
CCOc1ccc(OC)cc1NC[C@@H](O)COC	ZINC000819437020	CD	On-Demand	Anodyne	MTNR1A	23	40
CCOc1ccc(OC)cc1NC[C@@H](O)COC	ZINC000819437020	CD	On-Demand	Anodyne	MTNR1B	20	40
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1ccccc1F	ZINC000819437022	EH	On-Demand	Anodyne	SIGMAR1	20	41
O[C@H](CNc1ccc(CCN2CCCC2)cc1)c1ccccc1F	ZINC000819437025	EH	On-Demand	Anodyne	SIGMAR1	20	41
C[C@@H](c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1)N1CCOCC1	ZINC000819437041	FH	On-Demand	Anodyne	ADRB1	26	44
C[C@@H](c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1)N1CCOCC1	ZINC000819437041	FH	On-Demand	Anodyne	ADRB3	41	40
C[C@@H](c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1)N1CCOCC1	ZINC000819437041	FH	On-Demand	Anodyne	IGF1R	29	43
C[C@@H](c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1)N1CCOCC1	ZINC000819437041	FH	On-Demand	Anodyne	CYP3A4	49	39
OC1(CNc2ccc(N3CCCC3)c(Cl)c2)CCCC1	ZINC000819437044	CH	On-Demand	Anodyne	NPY2R	49	40
C[C@@H](c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1)N1CCOCC1	ZINC000819437050	FH	On-Demand	Anodyne	ADRB1	26	44
C[C@@H](c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1)N1CCOCC1	ZINC000819437050	FH	On-Demand	Anodyne	ADRB3	41	40
C[C@@H](c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1)N1CCOCC1	ZINC000819437050	FH	On-Demand	Anodyne	IGF1R	29	43
C[C@@H](c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1)N1CCOCC1	ZINC000819437050	FH	On-Demand	Anodyne	CYP3A4	49	39
O[C@@H](CNc1ccc(N2CCSCC2)c(Cl)c1)CC(F)(F)F	ZINC000819437055	FH	On-Demand	Anodyne	NPY2R	42	37
O[C@H](CNc1ccc(N2CCSCC2)c(Cl)c1)CC(F)(F)F	ZINC000819437058	FH	On-Demand	Anodyne	NPY2R	42	37
O=CN1CCCN(C(=O)CCSc2ccnc3cc(Cl)ccc23)CC1	ZINC000819437068	GG	On-Demand	Anodyne	HRP1_PLAFA	91	37
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1ccccc1	ZINC000819437085	DG	On-Demand	Anodyne	ADRB2	23	61
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1ccccc1	ZINC000819437085	DG	On-Demand	Anodyne	ADRB1	17	47
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1ccccc1	ZINC000819437085	DG	On-Demand	Anodyne	SLC6A3	20	42
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1ccccc1	ZINC000819437085	DG	On-Demand	Anodyne	ADRB3	53	45
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1ccccc1	ZINC000819437085	DG	On-Demand	Anodyne	LTA4H	22	43
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1ccccc1	ZINC000819437085	DG	On-Demand	Anodyne	HRH3	20	46
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1ccccc1	ZINC000819437085	DG	On-Demand	Anodyne	SIGMAR1	31	53
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1ccccc1	ZINC000819437085	DG	On-Demand	Anodyne	HNMT	49	32
COC(=O)CN1CCN(c2ccc(NC[C@@H](C)O)cc2)CC1	ZINC000819437087	DC	On-Demand	Anodyne	PRNP	44	37
O=CN1CCCN(C(=O)c2cc(Cl)c(Cl)[nH]2)CC1	ZINC000819437089	CD	On-Demand	Anodyne	HRH4	30	44
COC(=O)CN1CCN(c2ccc(NC[C@H](C)O)cc2)CC1	ZINC000819437090	DC	On-Demand	Anodyne	PRNP	44	37
C[C@@](O)(CNc1ccc(N2CCCC2)c(Cl)c1)C(F)(F)F	ZINC000819437091	DH	On-Demand	Anodyne	NPY2R	55	45
CN(C)CCCOc1ccc(NC[C@H](O)CC2CCCC2)cc1	ZINC000819437101	DG	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)Cn1cccn1	ZINC000819437103	DF	On-Demand	Anodyne	NPY2R	46	37
CN(C)CCCOc1ccc(NC[C@@H](O)CC2CCCC2)cc1	ZINC000819437104	DG	On-Demand	Anodyne	ADRB1	27	40
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)Cn1cccn1	ZINC000819437106	DF	On-Demand	Anodyne	NPY2R	46	37
C#CCOc1cccc(NC[C@@H](O)COC)c1	ZINC000819437111	BD	On-Demand	Mild	ADRB2	22	42
C#CCOc1cccc(NC[C@@H](O)COC)c1	ZINC000819437111	BD	On-Demand	Mild	ADRB1	24	42
C#CCOc1cccc(NC[C@H](O)COC)c1	ZINC000819437113	BD	On-Demand	Mild	ADRB2	22	42
C#CCOc1cccc(NC[C@H](O)COC)c1	ZINC000819437113	BD	On-Demand	Mild	ADRB1	24	42
C#CCOc1cccc(NCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819437124	EG	On-Demand	Mild	MTNR1A	15	44
C#CCOc1cccc(NCCC(=O)Nc2ccc(N(C)C)cc2)c1	ZINC000819437124	EG	On-Demand	Mild	MTNR1B	19	44
CCOc1ccc(OC)cc1NC[C@H](O)c1ccccc1F	ZINC000819437127	DG	On-Demand	Anodyne	MTNR1A	19	41
C[C@@](O)(CNc1ccc(N2CCSCC2)c(Cl)c1)C(F)(F)F	ZINC000819437130	FH	On-Demand	Anodyne	NPY2R	47	43
CCOc1ccc(OC)cc1NC[C@@H](O)c1ccccc1F	ZINC000819437133	DG	On-Demand	Anodyne	MTNR1A	19	41
C#CCOc1ccc(NC[C@H](O)COc2ccc(C(=O)OC)cc2)cc1	ZINC000819437139	FE	On-Demand	Mild	ADRB2	48	49
C#CCOc1ccc(NC[C@H](O)COc2ccc(C(=O)OC)cc2)cc1	ZINC000819437139	FE	On-Demand	Mild	ADRB1	69	48
C#CCOc1ccc(NC[C@H](O)COc2ccc(C(=O)OC)cc2)cc1	ZINC000819437139	FE	On-Demand	Mild	ADRB3	43	47
C#CCOc1ccc(NC[C@H](O)COc2ccc(C(=O)OC)cc2)cc1	ZINC000819437139	FE	On-Demand	Mild	ACR	41	33
C#CCOc1ccc(NC[C@@H](O)COc2ccc(C(=O)OC)cc2)cc1	ZINC000819437141	FE	On-Demand	Mild	ADRB2	48	49
C#CCOc1ccc(NC[C@@H](O)COc2ccc(C(=O)OC)cc2)cc1	ZINC000819437141	FE	On-Demand	Mild	ADRB1	69	48
C#CCOc1ccc(NC[C@@H](O)COc2ccc(C(=O)OC)cc2)cc1	ZINC000819437141	FE	On-Demand	Mild	ADRB3	43	47
C#CCOc1ccc(NC[C@@H](O)COc2ccc(C(=O)OC)cc2)cc1	ZINC000819437141	FE	On-Demand	Mild	ACR	41	33
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)cc1	ZINC000819437142	GG	On-Demand	Anodyne	KCNQ2	47	35
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)cc1	ZINC000819437142	GG	On-Demand	Anodyne	NPY2R	54	37
C#CCOc1cccc(NC[C@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819437144	FE	On-Demand	Mild	ADRB2	50	45
C#CCOc1cccc(NC[C@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819437144	FE	On-Demand	Mild	ADRB1	66	45
C#CCOc1cccc(NC[C@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819437144	FE	On-Demand	Mild	ADRB3	44	45
C#CCOc1cccc(NC[C@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819437144	FE	On-Demand	Mild	PDS	47	36
C#CCOc1cccc(NC[C@@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819437145	FE	On-Demand	Mild	ADRB2	50	45
C#CCOc1cccc(NC[C@@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819437145	FE	On-Demand	Mild	ADRB1	66	45
C#CCOc1cccc(NC[C@@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819437145	FE	On-Demand	Mild	ADRB3	44	45
C#CCOc1cccc(NC[C@@H](O)COc2ccc(C(=O)OC)cc2)c1	ZINC000819437145	FE	On-Demand	Mild	PDS	47	36
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)cc1	ZINC000819437148	GG	On-Demand	Anodyne	KCNQ2	47	35
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)cc1	ZINC000819437148	GG	On-Demand	Anodyne	NPY2R	54	37
CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)N2CCCN(C=O)CC2)c1	ZINC000819437151	HD	On-Demand	Anodyne	SLC6A9	38	54
CCOC(=O)CC[C@H](O)CNc1ccc(N2CCSCC2)c(Cl)c1	ZINC000819437152	FG	On-Demand	Anodyne	NPY2R	49	36
CCOC(=O)CC[C@@H](O)CNc1ccc(N2CCSCC2)c(Cl)c1	ZINC000819437153	FG	On-Demand	Anodyne	NPY2R	49	36
C#CCOc1ccc(NC[C@H](O)COc2ccccc2C)cc1	ZINC000819437157	DF	On-Demand	Mild	ADRB2	46	56
C#CCOc1ccc(NC[C@H](O)COc2ccccc2C)cc1	ZINC000819437157	DF	On-Demand	Mild	ADRB1	61	37
C#CCOc1ccc(NC[C@H](O)COc2ccccc2C)cc1	ZINC000819437157	DF	On-Demand	Mild	ADRB3	24	40
C#CCOc1ccc(NC[C@H](O)COc2ccccc2C)cc1	ZINC000819437157	DF	On-Demand	Mild	CYP2D6	19	42
C#CCOc1ccc(NC[C@@H](O)COc2ccccc2C)cc1	ZINC000819437160	DF	On-Demand	Mild	ADRB2	46	56
C#CCOc1ccc(NC[C@@H](O)COc2ccccc2C)cc1	ZINC000819437160	DF	On-Demand	Mild	ADRB1	61	37
C#CCOc1ccc(NC[C@@H](O)COc2ccccc2C)cc1	ZINC000819437160	DF	On-Demand	Mild	ADRB3	24	40
C#CCOc1ccc(NC[C@@H](O)COc2ccccc2C)cc1	ZINC000819437160	DF	On-Demand	Mild	CYP2D6	19	42
C#CCNC(=O)CCNc1ccc(OCCCN(C)C)cc1	ZINC000819437162	DD	On-Demand	Mild	LTA4H	23	41
C#CCNC(=O)CCNc1ccc(OCCCN(C)C)cc1	ZINC000819437162	DD	On-Demand	Mild	ESRRG	42	30
C#CCOc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819437171	EF	On-Demand	Mild	ADRB2	42	51
C#CCOc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819437171	EF	On-Demand	Mild	ADRB1	65	51
C#CCOc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819437171	EF	On-Demand	Mild	ADRB3	36	42
C#CCOc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819437173	EF	On-Demand	Mild	ADRB2	42	51
C#CCOc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819437173	EF	On-Demand	Mild	ADRB1	65	51
C#CCOc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819437173	EF	On-Demand	Mild	ADRB3	36	42
C#CCOc1cccc(NC[C@H](O)COCC(C)C)c1	ZINC000819437185	CE	On-Demand	Mild	ADRB2	17	43
C#CCOc1cccc(NC[C@H](O)COCC(C)C)c1	ZINC000819437185	CE	On-Demand	Mild	ADRB1	21	43
O=CN1CCCN(C(=O)c2ccc(-c3nnc(S)o3)cc2)CC1	ZINC000819437188	ED	On-Demand	Anodyne	CYP73A16	57	41
C#CCOc1cccc(NC[C@@H](O)COCC(C)C)c1	ZINC000819437192	CE	On-Demand	Mild	ADRB2	17	43
C#CCOc1cccc(NC[C@@H](O)COCC(C)C)c1	ZINC000819437192	CE	On-Demand	Mild	ADRB1	21	43
C#CCOc1ccc(NC[C@@H](O)COCc2ccccc2)cc1	ZINC000819437195	DF	On-Demand	Mild	ADRB1	43	38
C#CCOc1ccc(NC[C@H](O)COCc2ccccc2)cc1	ZINC000819437196	DF	On-Demand	Mild	ADRB1	43	38
O=CN1CCCN(C(=O)[C@H]2CCCN(C(=O)Nc3ccccc3F)C2)CC1	ZINC000819437210	GD	On-Demand	Anodyne	SLC6A1	40	34
O=CN1CCCN(C(=O)[C@H]2CCCN(C(=O)Nc3ccccc3F)C2)CC1	ZINC000819437210	GD	On-Demand	Anodyne	RBP4	44	33
O=CN1CCCN(C(=O)[C@@H]2CCCN(C(=O)Nc3ccccc3F)C2)CC1	ZINC000819437214	GD	On-Demand	Anodyne	SLC6A1	40	34
O=CN1CCCN(C(=O)[C@@H]2CCCN(C(=O)Nc3ccccc3F)C2)CC1	ZINC000819437214	GD	On-Demand	Anodyne	RBP4	44	33
COC(=O)CN1CCN(c2ccc(NC[C@H](O)[C@@H](C)c3ccccc3)cc2)CC1	ZINC000819437220	GF	On-Demand	Anodyne	NPY2R	22	42
COC(=O)CN1CCN(c2ccc(NC[C@H](O)[C@@H](C)c3ccccc3)cc2)CC1	ZINC000819437220	GF	On-Demand	Anodyne	PRNP	44	39
COC(=O)CN1CCN(c2ccc(NC[C@H](O)[C@H](C)c3ccccc3)cc2)CC1	ZINC000819437222	GF	On-Demand	Anodyne	NPY2R	22	42
COC(=O)CN1CCN(c2ccc(NC[C@H](O)[C@H](C)c3ccccc3)cc2)CC1	ZINC000819437222	GF	On-Demand	Anodyne	PRNP	44	39
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)[C@@H](C)c3ccccc3)cc2)CC1	ZINC000819437226	GF	On-Demand	Anodyne	NPY2R	22	42
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)[C@@H](C)c3ccccc3)cc2)CC1	ZINC000819437226	GF	On-Demand	Anodyne	PRNP	44	39
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)[C@H](C)c3ccccc3)cc2)CC1	ZINC000819437233	GF	On-Demand	Anodyne	NPY2R	22	42
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)[C@H](C)c3ccccc3)cc2)CC1	ZINC000819437233	GF	On-Demand	Anodyne	PRNP	44	39
CN(C)CCCOc1ccc(NC[C@@H](O)CN2CCN(C)CC2)cc1	ZINC000819437235	FD	On-Demand	Anodyne	HRH3	20	44
CN(C)CCCOc1ccc(NC[C@H](O)CN2CCN(C)CC2)cc1	ZINC000819437236	FD	On-Demand	Anodyne	HRH3	20	44
O=CN1CCCN(C(=O)[C@@H]2C[C@H]3CCCC[C@H]3N2C(=O)c2cccc(Cl)c2)CC1	ZINC000819437238	HF	On-Demand	Anodyne	PREP	47	48
Cc1ccccc1[C@@H](O)CNc1ccc(OCCCN(C)C)cc1	ZINC000819437245	EG	On-Demand	Anodyne	LTA4H	23	41
Cc1ccccc1[C@@H](O)CNc1ccc(OCCCN(C)C)cc1	ZINC000819437245	EG	On-Demand	Anodyne	ESRRG	48	35
O=CN1CCCN(C(=O)[C@@H]2C[C@@H]3CCCC[C@H]3N2C(=O)c2cccc(Cl)c2)CC1	ZINC000819437248	HF	On-Demand	Anodyne	PREP	47	48
CC[C@H](O)CNc1ccc(N2CCN(CC(=O)OC)CC2)cc1	ZINC000819437252	DD	On-Demand	Anodyne	ABCB1	15	41
CC[C@H](O)CNc1ccc(N2CCN(CC(=O)OC)CC2)cc1	ZINC000819437252	DD	On-Demand	Anodyne	STAT6	57	36
O=CN1CCCN(C(=O)[C@@H]2C[C@H]3CCCC[C@@H]3N2C(=O)c2cccc(Cl)c2)CC1	ZINC000819437256	HF	On-Demand	Anodyne	PREP	47	48
O=CN1CCCN(C(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2C(=O)c2cccc(Cl)c2)CC1	ZINC000819437265	HF	On-Demand	Anodyne	PREP	47	48
C#CCOc1cccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819437268	EF	On-Demand	Mild	ADRB2	31	47
C#CCOc1cccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819437268	EF	On-Demand	Mild	ADRB1	54	42
C#CCOc1cccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819437268	EF	On-Demand	Mild	ABCB1	15	45
C#CCOc1cccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819437268	EF	On-Demand	Mild	PDS	50	37
C#CCOc1cccc(NC[C@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819437270	EF	On-Demand	Mild	ADRB2	31	47
C#CCOc1cccc(NC[C@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819437270	EF	On-Demand	Mild	ADRB1	54	42
C#CCOc1cccc(NC[C@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819437270	EF	On-Demand	Mild	ABCB1	15	45
C#CCOc1cccc(NC[C@H](O)COc2cccc(C(C)=O)c2)c1	ZINC000819437270	EF	On-Demand	Mild	PDS	50	37
O=C1c2ccccc2C(=O)N1C[C@@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819437303	GG	On-Demand	Anodyne	KCNQ2	54	35
O=C1c2ccccc2C(=O)N1C[C@@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819437303	GG	On-Demand	Anodyne	NPY2R	62	42
O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819437305	GG	On-Demand	Anodyne	KCNQ2	54	35
O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819437305	GG	On-Demand	Anodyne	NPY2R	62	42
O=C(CCNc1ccc(N2CCCC2)c(Cl)c1)Nc1cccnc1	ZINC000819437313	EH	On-Demand	Anodyne	KCNQ2	63	38
O=C(CCNc1ccc(N2CCCC2)c(Cl)c1)Nc1cccnc1	ZINC000819437313	EH	On-Demand	Anodyne	NPY2R	71	42
O=C(CCNc1ccc(N2CCCC2)c(Cl)c1)Nc1cccnc1	ZINC000819437313	EH	On-Demand	Anodyne	CHRNA7	25	44
O=C(CCNc1ccc(N2CCCC2)c(Cl)c1)Nc1cccnc1	ZINC000819437313	EH	On-Demand	Anodyne	CSF1R	15	40
O=C(CCNc1ccc(N2CCCC2)c(Cl)c1)Nc1cccnc1	ZINC000819437313	EH	On-Demand	Anodyne	NAMPT	33	40
COC(=O)CN1CCN(c2ccc(NC[C@H](O)C3CCCCC3)cc2)CC1	ZINC000819437316	GE	On-Demand	Anodyne	CTSL	15	41
COC(=O)CN1CCN(c2ccc(NC[C@H](O)C3CCCCC3)cc2)CC1	ZINC000819437316	GE	On-Demand	Anodyne	CTSS	17	41
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)C3CCCCC3)cc2)CC1	ZINC000819437319	GE	On-Demand	Anodyne	CTSL	15	41
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)C3CCCCC3)cc2)CC1	ZINC000819437319	GE	On-Demand	Anodyne	CTSS	17	41
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819437325	ED	On-Demand	Anodyne	DRD4	29	41
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819437325	ED	On-Demand	Anodyne	SIGMAR1	28	44
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819437327	ED	On-Demand	Anodyne	DRD4	29	41
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819437327	ED	On-Demand	Anodyne	SIGMAR1	28	44
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819437329	ED	On-Demand	Anodyne	DRD4	29	41
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819437329	ED	On-Demand	Anodyne	SIGMAR1	28	44
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819437331	ED	On-Demand	Anodyne	DRD4	29	41
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819437331	ED	On-Demand	Anodyne	SIGMAR1	28	44
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1cccc(F)c1	ZINC000819437348	EI	On-Demand	Anodyne	KCNQ2	61	44
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1cccc(F)c1	ZINC000819437348	EI	On-Demand	Anodyne	NPY2R	64	45
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1cccc(F)c1	ZINC000819437348	EI	On-Demand	Anodyne	TAAR1	19	40
CC(=O)Nc1cccc(CC(=O)NC[C@](C)(O)c2ccc(F)cc2)c1	ZINC000819437349	EE	On-Demand	Anodyne	CYP17A1	15	41
CC(=O)Nc1cccc(CC(=O)NC[C@](C)(O)c2ccc(F)cc2)c1	ZINC000819437349	EE	On-Demand	Anodyne	KCNK3	68	42
CC(=O)Nc1cccc(CC(=O)NC[C@](C)(O)c2ccc(F)cc2)c1	ZINC000819437349	EE	On-Demand	Anodyne	KCNK9	44	34
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1cccc(F)c1	ZINC000819437350	EI	On-Demand	Anodyne	KCNQ2	61	44
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1cccc(F)c1	ZINC000819437350	EI	On-Demand	Anodyne	NPY2R	64	45
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1cccc(F)c1	ZINC000819437350	EI	On-Demand	Anodyne	TAAR1	19	40
CC(=O)Nc1cccc(CC(=O)NC[C@@](C)(O)c2ccc(F)cc2)c1	ZINC000819437351	EE	On-Demand	Anodyne	CYP17A1	15	41
CC(=O)Nc1cccc(CC(=O)NC[C@@](C)(O)c2ccc(F)cc2)c1	ZINC000819437351	EE	On-Demand	Anodyne	KCNK3	68	42
CC(=O)Nc1cccc(CC(=O)NC[C@@](C)(O)c2ccc(F)cc2)c1	ZINC000819437351	EE	On-Demand	Anodyne	KCNK9	44	34
N#CCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCCC3)c(Cl)c2)cc1	ZINC000819437355	GI	On-Demand	Mild	ADRB1	45	36
N#CCc1ccc(OC[C@H](O)CNc2ccc(N3CCCCC3)c(Cl)c2)cc1	ZINC000819437361	GI	On-Demand	Mild	ADRB1	45	36
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819437426	FF	On-Demand	Anodyne	ADRB2	46	55
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819437426	FF	On-Demand	Anodyne	ADRB1	67	55
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819437426	FF	On-Demand	Anodyne	TSHR	55	33
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819437426	FF	On-Demand	Anodyne	ADRB3	45	48
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819437426	FF	On-Demand	Anodyne	MTNR1A	46	43
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819437426	FF	On-Demand	Anodyne	MTNR1B	45	43
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819437428	FF	On-Demand	Anodyne	ADRB2	46	55
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819437428	FF	On-Demand	Anodyne	ADRB1	67	55
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819437428	FF	On-Demand	Anodyne	TSHR	55	33
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819437428	FF	On-Demand	Anodyne	ADRB3	45	48
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819437428	FF	On-Demand	Anodyne	MTNR1A	46	43
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819437428	FF	On-Demand	Anodyne	MTNR1B	45	43
COC(=O)CN1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819437431	GD	On-Demand	Anodyne	ADRB2	46	42
COC(=O)CN1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819437431	GD	On-Demand	Anodyne	ADRB1	68	40
COC(=O)CN1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819437431	GD	On-Demand	Anodyne	ADRB3	45	41
COC(=O)CN1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819437431	GD	On-Demand	Anodyne	ACOX1	53	39
COC(=O)CN1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819437431	GD	On-Demand	Anodyne	PRNP	43	38
COC(=O)CN1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819437431	GD	On-Demand	Anodyne	ABCB1	72	48
COC(=O)CN1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819437431	GD	On-Demand	Anodyne	STAT6	72	36
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819437433	GD	On-Demand	Anodyne	ADRB2	46	42
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819437433	GD	On-Demand	Anodyne	ADRB1	68	40
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819437433	GD	On-Demand	Anodyne	ADRB3	45	41
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819437433	GD	On-Demand	Anodyne	ACOX1	53	39
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819437433	GD	On-Demand	Anodyne	PRNP	43	38
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819437433	GD	On-Demand	Anodyne	ABCB1	72	48
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819437433	GD	On-Demand	Anodyne	STAT6	72	36
CCC(=O)N1CSC[C@@H]1C(=O)N1CCCN(C=O)CC1	ZINC000819437437	CB	On-Demand	Anodyne	PREP	42	53
CCC(=O)N1CSC[C@H]1C(=O)N1CCCN(C=O)CC1	ZINC000819437440	CB	On-Demand	Anodyne	PREP	42	53
COC[C@@H](O)CNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819437441	CF	On-Demand	Anodyne	NPY2R	50	38
N#CCCNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819437454	CH	On-Demand	Mild	NPY2R	41	37
O=CN1CCCN(C(=O)[C@@H]2CSCN2C(=O)C2CCCC2)CC1	ZINC000819437456	EC	On-Demand	Anodyne	PREP	50	48
COC(=O)CN1CCN(c2ccc(NC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819437458	FD	On-Demand	Anodyne	ADRB3	77	44
COC(=O)CN1CCN(c2ccc(NC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819437458	FD	On-Demand	Anodyne	PRNP	43	43
COC(=O)CN1CCN(c2ccc(NC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819437458	FD	On-Demand	Anodyne	STAT6	58	37
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819437459	FD	On-Demand	Anodyne	ADRB3	77	44
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819437459	FD	On-Demand	Anodyne	PRNP	43	43
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819437459	FD	On-Demand	Anodyne	STAT6	58	37
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@@](C)(O)c1ccc(F)cc1	ZINC000819437460	GH	On-Demand	Anodyne	CYP24A1	24	41
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@@](C)(O)c1ccc(F)cc1	ZINC000819437460	GH	On-Demand	Anodyne	CYP27B1	32	41
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@](C)(O)c1ccc(F)cc1	ZINC000819437461	GH	On-Demand	Anodyne	CYP24A1	24	41
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC[C@](C)(O)c1ccc(F)cc1	ZINC000819437461	GH	On-Demand	Anodyne	CYP27B1	32	41
O=CN1CCCN(C(=O)[C@H]2CSCN2C(=O)C2CCCC2)CC1	ZINC000819437466	EC	On-Demand	Anodyne	PREP	50	48
COC(=O)CSCc1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819437471	GG	On-Demand	Bother	CACNA1D	60	34
O=CN1CCCN(C(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)CC1	ZINC000819437473	EC	On-Demand	Anodyne	PREP	41	42
O=CN1CCCN(C(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)CC1	ZINC000819437473	EC	On-Demand	Anodyne	L3MBTL3	54	38
COC(=O)CSCc1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819437474	GG	On-Demand	Bother	CACNA1D	60	34
O=CN1CCCN(C(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)CC1	ZINC000819437477	EC	On-Demand	Anodyne	PREP	41	42
O=CN1CCCN(C(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)CC1	ZINC000819437477	EC	On-Demand	Anodyne	L3MBTL3	54	38
CN(C[C@@H](O)CNc1ccc(N2CCCC2)c(Cl)c1)C(=O)OC(C)(C)C	ZINC000819437490	GH	On-Demand	Anodyne	KCNQ2	48	34
CN(C[C@@H](O)CNc1ccc(N2CCCC2)c(Cl)c1)C(=O)OC(C)(C)C	ZINC000819437490	GH	On-Demand	Anodyne	NPY2R	76	39
CN(C[C@H](O)CNc1ccc(N2CCCC2)c(Cl)c1)C(=O)OC(C)(C)C	ZINC000819437491	GH	On-Demand	Anodyne	KCNQ2	48	34
CN(C[C@H](O)CNc1ccc(N2CCCC2)c(Cl)c1)C(=O)OC(C)(C)C	ZINC000819437491	GH	On-Demand	Anodyne	NPY2R	76	39
NC(=O)CCNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819437493	CE	On-Demand	Anodyne	KCNQ2	64	38
NC(=O)CCNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819437493	CE	On-Demand	Anodyne	NPY2R	61	43
O=S1(=O)CCC(O)(CNc2ccc(N3CCCC3)c(Cl)c2)CC1	ZINC000819437495	FE	On-Demand	Anodyne	NPY2R	51	41
O=CN1CCCN(C(=O)[C@@H]2CCCN2C(=O)C23CC4CC(CC(C4)C2)C3)CC1	ZINC000819437504	GD	On-Demand	Anodyne	PREP	49	43
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)C1CC1	ZINC000819437505	CG	On-Demand	Anodyne	NPY2R	50	44
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)C1CC1	ZINC000819437506	CG	On-Demand	Anodyne	NPY2R	50	44
O=CN1CCCN(C(=O)[C@H]2CCCN2C(=O)C23CC4CC(CC(C4)C2)C3)CC1	ZINC000819437507	GD	On-Demand	Anodyne	PREP	49	43
CCOc1ccc(OC)cc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819437517	FG	On-Demand	Anodyne	ADRB2	31	49
CCOc1ccc(OC)cc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819437517	FG	On-Demand	Anodyne	ADRB1	40	38
CCOc1ccc(OC)cc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819437517	FG	On-Demand	Anodyne	MTNR1A	48	42
CCOc1ccc(OC)cc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819437517	FG	On-Demand	Anodyne	MTNR1B	45	42
CCOc1ccc(OC)cc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819437517	FG	On-Demand	Anodyne	ABCB1	25	41
CCOc1ccc(OC)cc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819437520	FG	On-Demand	Anodyne	ADRB2	31	49
CCOc1ccc(OC)cc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819437520	FG	On-Demand	Anodyne	ADRB1	40	38
CCOc1ccc(OC)cc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819437520	FG	On-Demand	Anodyne	MTNR1A	48	42
CCOc1ccc(OC)cc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819437520	FG	On-Demand	Anodyne	MTNR1B	45	42
CCOc1ccc(OC)cc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819437520	FG	On-Demand	Anodyne	ABCB1	25	41
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)Cn3cccn3)cc2)CC1	ZINC000819437532	FC	On-Demand	Anodyne	PRNP	43	38
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)Cn3cccn3)cc2)CC1	ZINC000819437532	FC	On-Demand	Anodyne	STAT6	60	35
COC(=O)CN1CCN(c2ccc(NC[C@H](O)Cn3cccn3)cc2)CC1	ZINC000819437534	FC	On-Demand	Anodyne	PRNP	43	38
COC(=O)CN1CCN(c2ccc(NC[C@H](O)Cn3cccn3)cc2)CC1	ZINC000819437534	FC	On-Demand	Anodyne	STAT6	60	35
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819437540	EF	On-Demand	Mild	ADRB2	26	41
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819437540	EF	On-Demand	Mild	CYP2D6	19	41
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819437543	EF	On-Demand	Mild	ADRB2	26	41
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819437543	EF	On-Demand	Mild	CYP2D6	19	41
O=CN1CCCN(C(=O)c2c(Cl)cccc2Cl)CC1	ZINC000819437554	DE	On-Demand	Anodyne	L3MBTL3	57	38
O[C@H](CNc1cc(F)ccc1OC[C@@H]1CCCO1)COc1ccccc1	ZINC000819437558	FG	On-Demand	Anodyne	ADRB1	41	37
O[C@@H](CNc1cc(F)ccc1OC[C@H]1CCCO1)COc1ccccc1	ZINC000819437561	FG	On-Demand	Anodyne	ADRB1	41	37
O[C@H](CNc1cc(F)ccc1OC[C@H]1CCCO1)COc1ccccc1	ZINC000819437564	FG	On-Demand	Anodyne	ADRB1	41	37
O[C@@H](CNc1cc(F)ccc1OC[C@@H]1CCCO1)COc1ccccc1	ZINC000819437565	FG	On-Demand	Anodyne	ADRB1	41	37
CON(C)C(=O)CCNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819437587	DF	On-Demand	Anodyne	KCNQ2	55	33
CON(C)C(=O)CCNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819437587	DF	On-Demand	Anodyne	NPY2R	71	41
CCCOc1cc(OC)ccc1C(=O)N1CCCN(C=O)CC1	ZINC000819437616	DD	On-Demand	Anodyne	MTNR1A	16	40
CCCOc1cc(OC)ccc1C(=O)N1CCCN(C=O)CC1	ZINC000819437616	DD	On-Demand	Anodyne	MTNR1B	22	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819437626	GH	On-Demand	Bother	NPY2R	43	36
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819437628	GH	On-Demand	Bother	NPY2R	43	36
CCOc1ccc(OC)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819437629	DH	On-Demand	Anodyne	ADRB2	17	45
CCOc1ccc(OC)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819437629	DH	On-Demand	Anodyne	ADRB1	31	45
CCOc1ccc(OC)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819437629	DH	On-Demand	Anodyne	ADRB3	57	52
CCOc1ccc(OC)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819437629	DH	On-Demand	Anodyne	MTNR1A	23	40
CCOc1ccc(OC)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819437629	DH	On-Demand	Anodyne	CYP3A4	47	36
CCOc1ccc(OC)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819437630	DH	On-Demand	Anodyne	ADRB2	17	45
CCOc1ccc(OC)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819437630	DH	On-Demand	Anodyne	ADRB1	31	45
CCOc1ccc(OC)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819437630	DH	On-Demand	Anodyne	ADRB3	57	52
CCOc1ccc(OC)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819437630	DH	On-Demand	Anodyne	MTNR1A	23	40
CCOc1ccc(OC)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819437630	DH	On-Demand	Anodyne	CYP3A4	47	36
CCOc1ccc(OC)cc1NCC1(O)CCOCC1	ZINC000819437633	CE	On-Demand	Anodyne	MTNR1A	16	40
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCCN(C=O)CC1	ZINC000819437636	ED	On-Demand	Anodyne	MC4R	52	37
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCCN(C=O)CC1	ZINC000819437636	ED	On-Demand	Anodyne	HRH3	19	41
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCCN(C=O)CC1	ZINC000819437636	ED	On-Demand	Anodyne	CCR1	62	48
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCCN(C=O)CC1	ZINC000819437636	ED	On-Demand	Anodyne	DPP7	43	38
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCCN(C=O)CC1	ZINC000819437636	ED	On-Demand	Anodyne	UTS2	44	34
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCCN(C=O)CC1	ZINC000819437638	ED	On-Demand	Anodyne	MC4R	52	37
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCCN(C=O)CC1	ZINC000819437638	ED	On-Demand	Anodyne	HRH3	19	41
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCCN(C=O)CC1	ZINC000819437638	ED	On-Demand	Anodyne	CCR1	62	48
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCCN(C=O)CC1	ZINC000819437638	ED	On-Demand	Anodyne	DPP7	43	38
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCCN(C=O)CC1	ZINC000819437638	ED	On-Demand	Anodyne	UTS2	44	34
COC(=O)CSCc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819437647	EG	On-Demand	Anodyne	ADRB3	50	39
COC(=O)CSCc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819437647	EG	On-Demand	Anodyne	PDS	50	33
CON(C)C(=O)CCNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819437648	EG	On-Demand	Anodyne	CNR1	49	30
CON(C)C(=O)CCNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819437648	EG	On-Demand	Anodyne	KCNQ2	52	33
CON(C)C(=O)CCNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819437648	EG	On-Demand	Anodyne	NPY2R	66	40
COC(=O)CSCc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819437649	EG	On-Demand	Anodyne	ADRB3	50	39
COC(=O)CSCc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819437649	EG	On-Demand	Anodyne	PDS	50	33
O=CN1CCCN(C(=O)[C@@H]2CSCN2C(=O)c2ccccc2)CC1	ZINC000819437652	EC	On-Demand	Anodyne	PREP	78	56
O=CN1CCCN(C(=O)[C@H]2CSCN2C(=O)c2ccccc2)CC1	ZINC000819437654	EC	On-Demand	Anodyne	PREP	78	56
COC(=O)CN1CCN(c2ccc(NCCC(=O)Nc3cccnc3)cc2)CC1	ZINC000819437658	GD	On-Demand	Anodyne	CHRNA7	18	40
COC(=O)CN1CCN(c2ccc(NCCC(=O)Nc3cccnc3)cc2)CC1	ZINC000819437658	GD	On-Demand	Anodyne	PRNP	39	45
COC(=O)CN1CCN(c2ccc(NCCC(=O)Nc3cccnc3)cc2)CC1	ZINC000819437658	GD	On-Demand	Anodyne	STAT6	76	40
O=C1CCCN1C[C@@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819437663	EE	On-Demand	Anodyne	NPY2R	46	38
O=C1CCCN1C[C@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819437666	EE	On-Demand	Anodyne	NPY2R	46	38
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)CC(F)(F)F	ZINC000819437669	DH	On-Demand	Anodyne	NPY2R	51	39
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)CC(F)(F)F	ZINC000819437670	DH	On-Demand	Anodyne	NPY2R	51	39
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819437673	FH	On-Demand	Anodyne	ADRB2	33	48
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819437673	FH	On-Demand	Anodyne	CASR	40	39
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819437673	FH	On-Demand	Anodyne	CYP2D6	21	44
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccccc1Cl	ZINC000819437675	FH	On-Demand	Anodyne	ADRB2	33	48
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccccc1Cl	ZINC000819437675	FH	On-Demand	Anodyne	CASR	40	39
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccccc1Cl	ZINC000819437675	FH	On-Demand	Anodyne	CYP2D6	21	44
CC(=O)c1cccc(OCC(=O)N2CCCN(C=O)CC2)c1	ZINC000819437683	DC	On-Demand	Anodyne	HTR1D	15	43
CC(=O)c1cccc(OCC(=O)N2CCCN(C=O)CC2)c1	ZINC000819437683	DC	On-Demand	Anodyne	HTR1B	18	43
CC(=O)c1cccc(OCC(=O)N2CCCN(C=O)CC2)c1	ZINC000819437683	DC	On-Demand	Anodyne	CPT1A	80	41
CC(=O)c1cccc(OCC(=O)N2CCCN(C=O)CC2)c1	ZINC000819437683	DC	On-Demand	Anodyne	CPT2	41	35
O=CN1CCCN(C(=O)c2ccc(F)c(C(F)(F)F)c2)CC1	ZINC000819437695	DE	On-Demand	Anodyne	MLYCD	19	43
O=CN1CCCN(C(=O)c2ccc(F)c(C(F)(F)F)c2)CC1	ZINC000819437695	DE	On-Demand	Anodyne	L3MBTL3	46	34
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1cccnc1	ZINC000819437696	DG	On-Demand	Anodyne	ADRB3	91	51
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1cccnc1	ZINC000819437696	DG	On-Demand	Anodyne	NPY2R	57	38
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1cccnc1	ZINC000819437697	DG	On-Demand	Anodyne	ADRB3	91	51
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1cccnc1	ZINC000819437697	DG	On-Demand	Anodyne	NPY2R	57	38
O=C(NCc1ccc(NC[C@@H](O)C2CC2)cc1)c1ccc(Br)cc1	ZINC000819437719	GH	On-Demand	Anodyne	GIPR	43	33
O=C(NCc1ccc(NC[C@H](O)C2CC2)cc1)c1ccc(Br)cc1	ZINC000819437720	GH	On-Demand	Anodyne	GIPR	43	33
COc1ccccc1COC[C@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819437721	GH	On-Demand	Anodyne	KCNQ2	42	33
COc1ccccc1COC[C@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819437721	GH	On-Demand	Anodyne	NPY2R	44	42
COc1ccccc1COC[C@@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819437722	GH	On-Demand	Anodyne	KCNQ2	42	33
COc1ccccc1COC[C@@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819437722	GH	On-Demand	Anodyne	NPY2R	44	42
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCNC(=O)C3)c(Cl)c2)cc1	ZINC000819437726	GE	On-Demand	Anodyne	ADRB2	15	40
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCNC(=O)C3)c(Cl)c2)cc1	ZINC000819437727	GE	On-Demand	Anodyne	ADRB2	15	40
CCOc1ccc(OC)cc1NCCS(C)(=O)=O	ZINC000819437733	CD	On-Demand	Anodyne	MTNR1A	41	44
CCOc1ccc(OC)cc1NCCS(C)(=O)=O	ZINC000819437733	CD	On-Demand	Anodyne	MTNR1B	29	44
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1ccc2c(c1)CCCC(=O)N2	ZINC000819437741	GE	On-Demand	Anodyne	PKM	39	41
COC(=O)CN1CCN(c2ccc(NC[C@H](O)c3ccccc3F)cc2)CC1	ZINC000819437765	GE	On-Demand	Anodyne	PRNP	42	36
COC(=O)CN1CCN(c2ccc(NC[C@H](O)c3ccccc3F)cc2)CC1	ZINC000819437765	GE	On-Demand	Anodyne	STAT6	53	35
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)c3ccccc3F)cc2)CC1	ZINC000819437767	GE	On-Demand	Anodyne	PRNP	42	36
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)c3ccccc3F)cc2)CC1	ZINC000819437767	GE	On-Demand	Anodyne	STAT6	53	35
CCOc1ccc(OC)cc1NC[C@H](O)CSC	ZINC000819437769	CE	On-Demand	Anodyne	MTNR1A	20	40
CCOc1ccc(OC)cc1NC[C@H](O)CSC	ZINC000819437769	CE	On-Demand	Anodyne	MTNR1B	18	40
CCOc1ccc(OC)cc1NC[C@@H](O)CSC	ZINC000819437771	CE	On-Demand	Anodyne	MTNR1A	20	40
CCOc1ccc(OC)cc1NC[C@@H](O)CSC	ZINC000819437771	CE	On-Demand	Anodyne	MTNR1B	18	40
C[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)S(C)(=O)=O	ZINC000819437802	DF	On-Demand	Anodyne	NPY2R	48	41
O=C1CCCc2cc(NC[C@H](O)c3ccc(Cl)cc3Cl)ccc2N1	ZINC000819437822	FI	On-Demand	Anodyne	PKM	32	42
C[C@@H](CNc1ccc(N2CCCCC2)c(Cl)c1)S(C)(=O)=O	ZINC000819437823	EG	On-Demand	Anodyne	NPY2R	47	40
O=C1CCCc2cc(NC[C@@H](O)c3ccc(Cl)cc3Cl)ccc2N1	ZINC000819437825	FI	On-Demand	Anodyne	PKM	32	42
CCOc1ccc(OC)cc1NCC1(O)CCC1	ZINC000819437834	CE	On-Demand	Anodyne	MTNR1A	25	42
CCOc1ccc(OC)cc1NCC1(O)CCC1	ZINC000819437834	CE	On-Demand	Anodyne	MTNR1B	24	42
C#CCNC(=O)CCNc1ccc(N2CCNC(=O)C2)c(Cl)c1	ZINC000819437843	EC	On-Demand	Mild	NPY2R	41	36
COC(=O)CN1CCN(c2ccc(NCCC(=O)NC(N)=O)cc2)CC1	ZINC000819437846	FB	On-Demand	Anodyne	STAT6	70	37
COC(=O)CN1CCN(c2ccc(NCCC(N)=O)cc2)CC1	ZINC000819437853	DC	On-Demand	Anodyne	STAT6	82	41
COC(=O)CSCc1cccc(NC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819437863	FG	On-Demand	Mild	CTRB_BOVIN	44	32
Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819437864	GG	On-Demand	Mild	TRY1_BOVIN	21	40
COC(=O)CSCc1cccc(NC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819437865	FG	On-Demand	Mild	CTRB_BOVIN	44	32
Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819437866	GG	On-Demand	Mild	TRY1_BOVIN	21	40
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)CC3CCCC3)cc2)CC1	ZINC000819437867	GE	On-Demand	Anodyne	CTSL	15	45
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)CC3CCCC3)cc2)CC1	ZINC000819437867	GE	On-Demand	Anodyne	CTSS	20	45
COC(=O)CN1CCN(c2ccc(NC[C@H](O)CC3CCCC3)cc2)CC1	ZINC000819437869	GE	On-Demand	Anodyne	CTSL	15	45
COC(=O)CN1CCN(c2ccc(NC[C@H](O)CC3CCCC3)cc2)CC1	ZINC000819437869	GE	On-Demand	Anodyne	CTSS	20	45
CCOc1ccc(OC)cc1NC[C@H](O)c1ccccc1Cl	ZINC000819437881	DH	On-Demand	Anodyne	MTNR1A	20	41
CCOc1ccc(OC)cc1NC[C@H](O)c1ccccc1	ZINC000819437900	CG	On-Demand	Anodyne	ADRB2	27	40
CCOc1ccc(OC)cc1NC[C@H](O)c1ccccc1	ZINC000819437900	CG	On-Demand	Anodyne	ADRB1	19	44
CCOc1ccc(OC)cc1NC[C@H](O)c1ccccc1	ZINC000819437900	CG	On-Demand	Anodyne	ADRB3	37	44
CCOc1ccc(OC)cc1NC[C@H](O)c1ccccc1	ZINC000819437900	CG	On-Demand	Anodyne	AOC3	15	45
OC1(CNc2ccc(N3CCCCC3)c(Cl)c2)CCC1	ZINC000819437954	CH	On-Demand	Anodyne	NPY2R	47	43
O[C@H](CNc1ccc(N2CCCCC2)c(Cl)c1)c1cccnc1	ZINC000819437955	EH	On-Demand	Anodyne	ADRB3	90	51
O[C@H](CNc1ccc(N2CCCCC2)c(Cl)c1)c1cccnc1	ZINC000819437955	EH	On-Demand	Anodyne	NPY2R	57	39
O[C@@H](CNc1ccc(N2CCCCC2)c(Cl)c1)c1cccnc1	ZINC000819437956	EH	On-Demand	Anodyne	ADRB3	90	51
O[C@@H](CNc1ccc(N2CCCCC2)c(Cl)c1)c1cccnc1	ZINC000819437956	EH	On-Demand	Anodyne	NPY2R	57	39
CC(C)(C)[C@@H](O)CNc1ccc(N2CCNC(=O)C2)c(Cl)c1	ZINC000819437957	EE	On-Demand	Anodyne	NPY2R	41	37
O[C@@H](CNc1cc(F)ccc1OC[C@H]1CCCO1)c1cccc(Cl)c1	ZINC000819437959	FI	On-Demand	Anodyne	CYP3A4	53	40
O[C@H](CNc1cc(F)ccc1OC[C@@H]1CCCO1)c1cccc(Cl)c1	ZINC000819437960	FI	On-Demand	Anodyne	CYP3A4	53	40
O[C@H](CNc1cc(F)ccc1OC[C@H]1CCCO1)c1cccc(Cl)c1	ZINC000819437962	FI	On-Demand	Anodyne	CYP3A4	53	40
O[C@@H](CNc1cc(F)ccc1OC[C@@H]1CCCO1)c1cccc(Cl)c1	ZINC000819437964	FI	On-Demand	Anodyne	CYP3A4	53	40
O=[N+]([O-])c1ccc([C@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)cc1	ZINC000819438042	FH	On-Demand	Bother	NPY2R	41	37
O=[N+]([O-])c1ccc([C@@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)cc1	ZINC000819438044	FH	On-Demand	Bother	NPY2R	41	37
CCOc1ccc(OC)cc1NC[C@@H](O)c1ccccc1	ZINC000819438085	CG	On-Demand	Anodyne	ADRB2	27	40
CCOc1ccc(OC)cc1NC[C@@H](O)c1ccccc1	ZINC000819438085	CG	On-Demand	Anodyne	ADRB1	19	44
CCOc1ccc(OC)cc1NC[C@@H](O)c1ccccc1	ZINC000819438085	CG	On-Demand	Anodyne	ADRB3	37	44
CCOc1ccc(OC)cc1NC[C@@H](O)c1ccccc1	ZINC000819438085	CG	On-Demand	Anodyne	AOC3	15	45
CCOc1ccc(OC)cc1NC[C@H](O)COc1cccc(C)c1	ZINC000819438102	EG	On-Demand	Anodyne	ADRB2	34	54
CCOc1ccc(OC)cc1NC[C@H](O)COc1cccc(C)c1	ZINC000819438102	EG	On-Demand	Anodyne	ADRB1	26	54
CCOc1ccc(OC)cc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819438103	EG	On-Demand	Anodyne	ADRB2	34	54
CCOc1ccc(OC)cc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819438103	EG	On-Demand	Anodyne	ADRB1	26	54
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819438107	EG	On-Demand	Anodyne	ADRB2	37	40
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819438107	EG	On-Demand	Anodyne	ADRB1	40	33
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819438107	EG	On-Demand	Anodyne	ADRB3	16	40
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819438108	EG	On-Demand	Anodyne	ADRB2	37	40
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819438108	EG	On-Demand	Anodyne	ADRB1	40	33
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819438108	EG	On-Demand	Anodyne	ADRB3	16	40
O=C1NCCN(C(=O)/C=C\[C@@H]2CCCO2)[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000819438113	FE	On-Demand	Anodyne	TRPM8	41	34
O=C1NCCN(C(=O)/C=C\[C@@H]2CCCO2)[C@@H]1c1ccc(C(F)(F)F)cc1	ZINC000819438114	FE	On-Demand	Anodyne	TRPM8	41	34
O=C1NCCN(C(=O)/C=C/[C@@H]2CCCO2)[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000819438115	FE	On-Demand	Anodyne	TRPM8	41	34
O=C1NCCN(C(=O)/C=C/[C@@H]2CCCO2)[C@@H]1c1ccc(C(F)(F)F)cc1	ZINC000819438116	FE	On-Demand	Anodyne	TRPM8	41	34
CCOc1ccc(OC)cc1NC[C@H](O)C(C)(C)C	ZINC000819438118	CF	On-Demand	Anodyne	MTNR1A	26	41
CCOc1ccc(OC)cc1NC[C@H](O)C(C)(C)C	ZINC000819438118	CF	On-Demand	Anodyne	MTNR1B	23	41
CCOc1ccc(OC)cc1NC[C@@H](O)C(C)(C)C	ZINC000819438119	CF	On-Demand	Anodyne	MTNR1A	26	41
CCOc1ccc(OC)cc1NC[C@@H](O)C(C)(C)C	ZINC000819438119	CF	On-Demand	Anodyne	MTNR1B	23	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2cccc3[nH]ccc23)CC1	ZINC000819438120	FH	On-Demand	Anodyne	SSTR2	47	36
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2cccc3[nH]ccc23)CC1	ZINC000819438120	FH	On-Demand	Anodyne	GPR119	45	47
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2cccc3[nH]ccc23)CC1	ZINC000819438121	FH	On-Demand	Anodyne	SSTR2	47	36
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2cccc3[nH]ccc23)CC1	ZINC000819438121	FH	On-Demand	Anodyne	GPR119	45	47
O=C1CCCc2cc(NC[C@H](O)c3cccc(Cl)c3)ccc2N1	ZINC000819438130	EH	On-Demand	Anodyne	ADRB1	29	42
O=C1CCCc2cc(NC[C@H](O)c3cccc(Cl)c3)ccc2N1	ZINC000819438130	EH	On-Demand	Anodyne	ADRB3	37	42
O=C1CCCc2cc(NC[C@H](O)c3cccc(Cl)c3)ccc2N1	ZINC000819438130	EH	On-Demand	Anodyne	PKM	32	45
O=C1CCCc2cc(NC[C@H](O)c3cccc(Cl)c3)ccc2N1	ZINC000819438130	EH	On-Demand	Anodyne	CYP3A4	40	33
O=C1CCCc2cc(NC[C@@H](O)c3cccc(Cl)c3)ccc2N1	ZINC000819438131	EH	On-Demand	Anodyne	ADRB1	29	42
O=C1CCCc2cc(NC[C@@H](O)c3cccc(Cl)c3)ccc2N1	ZINC000819438131	EH	On-Demand	Anodyne	ADRB3	37	42
O=C1CCCc2cc(NC[C@@H](O)c3cccc(Cl)c3)ccc2N1	ZINC000819438131	EH	On-Demand	Anodyne	PKM	32	45
O=C1CCCc2cc(NC[C@@H](O)c3cccc(Cl)c3)ccc2N1	ZINC000819438131	EH	On-Demand	Anodyne	CYP3A4	40	33
COC(=O)CN1CCN(c2ccc(NC[C@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819438148	GE	On-Demand	Anodyne	STAT6	50	37
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819438149	GE	On-Demand	Anodyne	STAT6	50	37
CCOc1ccc(OC)cc1NC[C@@H](C)O	ZINC000819438151	BD	On-Demand	Anodyne	MTNR1A	34	43
CCOc1ccc(OC)cc1NC[C@@H](C)O	ZINC000819438151	BD	On-Demand	Anodyne	MTNR1B	29	43
CCOc1ccc(OC)cc1NC[C@H](C)O	ZINC000819438152	BD	On-Demand	Anodyne	MTNR1A	34	43
CCOc1ccc(OC)cc1NC[C@H](C)O	ZINC000819438152	BD	On-Demand	Anodyne	MTNR1B	29	43
O=C1CCCc2cc(NC[C@H](O)c3ccccc3C(F)(F)F)ccc2N1	ZINC000819438158	FI	On-Demand	Anodyne	PTK2B	22	44
O=C1CCCc2cc(NC[C@@H](O)c3ccccc3C(F)(F)F)ccc2N1	ZINC000819438159	FI	On-Demand	Anodyne	PTK2B	22	44
CCOc1ccc(OC)cc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819438160	DD	On-Demand	Anodyne	MTNR1A	15	40
CCOc1ccc(OC)cc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819438160	DD	On-Demand	Anodyne	MTNR1B	15	40
CCOc1ccc(OC)cc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819438160	DD	On-Demand	Anodyne	ABCB1	28	40
CCOc1ccc(OC)cc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819438161	DD	On-Demand	Anodyne	MTNR1A	15	40
CCOc1ccc(OC)cc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819438161	DD	On-Demand	Anodyne	MTNR1B	15	40
CCOc1ccc(OC)cc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819438161	DD	On-Demand	Anodyne	ABCB1	28	40
COC(=O)CN1CCN(c2ccc(NC[C@H](O)c3ccccc3C)cc2)CC1	ZINC000819438169	GE	On-Demand	Anodyne	ABCB1	43	33
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)c3ccccc3C)cc2)CC1	ZINC000819438170	GE	On-Demand	Anodyne	ABCB1	43	33
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccccc1F	ZINC000819438181	EG	On-Demand	Anodyne	ADRB2	32	42
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccccc1F	ZINC000819438181	EG	On-Demand	Anodyne	ADRB1	53	38
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccccc1F	ZINC000819438181	EG	On-Demand	Anodyne	CYP2D6	21	40
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccccc1F	ZINC000819438182	EG	On-Demand	Anodyne	ADRB2	32	42
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccccc1F	ZINC000819438182	EG	On-Demand	Anodyne	ADRB1	53	38
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccccc1F	ZINC000819438182	EG	On-Demand	Anodyne	CYP2D6	21	40
CCOC(=O)CC[C@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819438186	EG	On-Demand	Anodyne	KCNQ2	52	36
CCOC(=O)CC[C@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819438186	EG	On-Demand	Anodyne	NPY2R	64	38
CCOC(=O)CC[C@@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819438187	EG	On-Demand	Anodyne	KCNQ2	52	36
CCOC(=O)CC[C@@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819438187	EG	On-Demand	Anodyne	NPY2R	64	38
Cc1ccc(OC[C@@H](O)CNc2cc(F)ccc2OC[C@@H]2CCCO2)cc1	ZINC000819438196	GH	On-Demand	Anodyne	ADRB2	18	42
Cc1ccc(OC[C@@H](O)CNc2cc(F)ccc2OC[C@@H]2CCCO2)cc1	ZINC000819438196	GH	On-Demand	Anodyne	ADRB1	22	43
Cc1ccc(OC[C@H](O)CNc2cc(F)ccc2OC[C@H]2CCCO2)cc1	ZINC000819438197	GH	On-Demand	Anodyne	ADRB2	18	42
Cc1ccc(OC[C@H](O)CNc2cc(F)ccc2OC[C@H]2CCCO2)cc1	ZINC000819438197	GH	On-Demand	Anodyne	ADRB1	22	43
Cc1ccc(OC[C@H](O)CNc2cc(F)ccc2OC[C@@H]2CCCO2)cc1	ZINC000819438198	GH	On-Demand	Anodyne	ADRB2	18	42
Cc1ccc(OC[C@H](O)CNc2cc(F)ccc2OC[C@@H]2CCCO2)cc1	ZINC000819438198	GH	On-Demand	Anodyne	ADRB1	22	43
Cc1ccc(OC[C@@H](O)CNc2cc(F)ccc2OC[C@H]2CCCO2)cc1	ZINC000819438199	GH	On-Demand	Anodyne	ADRB2	18	42
Cc1ccc(OC[C@@H](O)CNc2cc(F)ccc2OC[C@H]2CCCO2)cc1	ZINC000819438199	GH	On-Demand	Anodyne	ADRB1	22	43
CC(C)(O)CNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819438205	CH	On-Demand	Anodyne	KCNQ2	42	34
CC(C)(O)CNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819438205	CH	On-Demand	Anodyne	NPY2R	57	45
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(CCN2CCCC2)cc1	ZINC000819438247	GG	On-Demand	Anodyne	HRH3	17	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(CCN2CCCC2)cc1	ZINC000819438248	GG	On-Demand	Anodyne	HRH3	17	41
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819438249	EH	On-Demand	Anodyne	SLC6A3	27	43
O[C@H](CNc1ccc(CCN2CCCC2)cc1)c1ccc(F)cc1	ZINC000819438250	EH	On-Demand	Anodyne	SLC6A3	27	43
N#CCc1ccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)cc1	ZINC000819438258	GH	On-Demand	Mild	ADRB1	51	37
N#CCc1ccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)cc1	ZINC000819438259	GH	On-Demand	Mild	ADRB1	51	37
O=[N+]([O-])c1ccc([C@@H](O)CNc2ccc(CCN3CCCC3)cc2)cc1	ZINC000819438262	FG	On-Demand	Bother	KCNJ1	39	57
O=[N+]([O-])c1ccc([C@H](O)CNc2ccc(CCN3CCCC3)cc2)cc1	ZINC000819438263	FG	On-Demand	Bother	KCNJ1	39	57
CN(C[C@@H](O)CNc1ccc(N2CCNC(=O)C2)c(Cl)c1)C1CC1	ZINC000819438280	FD	On-Demand	Anodyne	NPY2R	40	35
CN(C[C@H](O)CNc1ccc(N2CCNC(=O)C2)c(Cl)c1)C1CC1	ZINC000819438281	FD	On-Demand	Anodyne	NPY2R	40	35
CCOc1ccc(OC)cc1NC[C@H](O)c1ccccc1C	ZINC000819438287	DH	On-Demand	Anodyne	MTNR1A	21	42
CCOc1ccc(OC)cc1NC[C@@H](O)c1ccccc1C	ZINC000819438288	DH	On-Demand	Anodyne	MTNR1A	21	42
COC(=O)CSCc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819438291	EF	On-Demand	Anodyne	ADRB2	23	42
COC(=O)CSCc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819438291	EF	On-Demand	Anodyne	ADRB1	33	43
COC(=O)CSCc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819438291	EF	On-Demand	Anodyne	ADRB3	96	43
COC(=O)CSCc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819438291	EF	On-Demand	Anodyne	KCNA5	18	41
COC(=O)CSCc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819438292	EF	On-Demand	Anodyne	ADRB2	23	42
COC(=O)CSCc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819438292	EF	On-Demand	Anodyne	ADRB1	33	43
COC(=O)CSCc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819438292	EF	On-Demand	Anodyne	ADRB3	96	43
COC(=O)CSCc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819438292	EF	On-Demand	Anodyne	KCNA5	18	41
C[C@@H](c1cccc(NCCC(=O)Nc2ccc(N(C)C)cc2)c1)N1CCOCC1	ZINC000819438294	GH	On-Demand	Anodyne	CASR	29	41
COC(=O)CSCc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819438297	FH	On-Demand	Anodyne	ADRB2	20	48
COC(=O)CSCc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819438297	FH	On-Demand	Anodyne	ADRB1	38	48
COC(=O)CSCc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819438297	FH	On-Demand	Anodyne	ADRB3	58	48
COC(=O)CSCc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819438297	FH	On-Demand	Anodyne	CYP3A4	43	34
COC(=O)CSCc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819438298	FH	On-Demand	Anodyne	ADRB2	20	48
COC(=O)CSCc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819438298	FH	On-Demand	Anodyne	ADRB1	38	48
COC(=O)CSCc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819438298	FH	On-Demand	Anodyne	ADRB3	58	48
COC(=O)CSCc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819438298	FH	On-Demand	Anodyne	CYP3A4	43	34
CCOc1ccc(OC)cc1NC[C@@H](O)CC	ZINC000819438300	BE	On-Demand	Anodyne	MTNR1A	29	42
CCOc1ccc(OC)cc1NC[C@@H](O)CC	ZINC000819438300	BE	On-Demand	Anodyne	MTNR1B	25	42
CCOc1ccc(OC)cc1NC[C@H](O)CC	ZINC000819438301	BE	On-Demand	Anodyne	MTNR1A	29	42
CCOc1ccc(OC)cc1NC[C@H](O)CC	ZINC000819438301	BE	On-Demand	Anodyne	MTNR1B	25	42
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819438313	FF	On-Demand	Bother	ADRB1	53	39
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819438314	FF	On-Demand	Bother	ADRB1	53	39
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccccc1	ZINC000819438317	DF	On-Demand	Anodyne	ADRB2	57	48
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccccc1	ZINC000819438317	DF	On-Demand	Anodyne	ADRB1	60	44
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccccc1	ZINC000819438317	DF	On-Demand	Anodyne	ADRB3	39	44
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccccc1	ZINC000819438317	DF	On-Demand	Anodyne	CYP2D6	22	40
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccccc1	ZINC000819438318	DF	On-Demand	Anodyne	ADRB2	57	48
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccccc1	ZINC000819438318	DF	On-Demand	Anodyne	ADRB1	60	44
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccccc1	ZINC000819438318	DF	On-Demand	Anodyne	ADRB3	39	44
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccccc1	ZINC000819438318	DF	On-Demand	Anodyne	CYP2D6	22	40
O=C1CCCc2cc(NC[C@H](O)c3cccc(F)c3)ccc2N1	ZINC000819438328	DG	On-Demand	Anodyne	GRIN2B	16	49
O=C1CCCc2cc(NC[C@H](O)c3cccc(F)c3)ccc2N1	ZINC000819438328	DG	On-Demand	Anodyne	PKM	31	45
O=C1CCCc2cc(NC[C@@H](O)c3cccc(F)c3)ccc2N1	ZINC000819438329	DG	On-Demand	Anodyne	GRIN2B	16	49
O=C1CCCc2cc(NC[C@@H](O)c3cccc(F)c3)ccc2N1	ZINC000819438329	DG	On-Demand	Anodyne	PKM	31	45
CCOc1ccc(OC)cc1NCCS(=O)(=O)CC	ZINC000819438340	CD	On-Demand	Anodyne	MTNR1A	53	45
CCOc1ccc(OC)cc1NCCS(=O)(=O)CC	ZINC000819438340	CD	On-Demand	Anodyne	MTNR1B	37	45
CCOc1ccc(OC)cc1NCC(C)(C)O	ZINC000819438347	BE	On-Demand	Anodyne	MTNR1A	36	43
CCOc1ccc(OC)cc1NCC(C)(C)O	ZINC000819438347	BE	On-Demand	Anodyne	MTNR1B	32	43
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccccc1C	ZINC000819438348	EG	On-Demand	Anodyne	ADRB2	38	52
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccccc1C	ZINC000819438348	EG	On-Demand	Anodyne	ADRB1	41	39
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccccc1C	ZINC000819438348	EG	On-Demand	Anodyne	ADRB3	15	42
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccccc1C	ZINC000819438348	EG	On-Demand	Anodyne	CYP2D6	23	43
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccccc1C	ZINC000819438348	EG	On-Demand	Anodyne	ABCB1	34	41
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819438349	EG	On-Demand	Anodyne	ADRB2	38	52
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819438349	EG	On-Demand	Anodyne	ADRB1	41	39
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819438349	EG	On-Demand	Anodyne	ADRB3	15	42
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819438349	EG	On-Demand	Anodyne	CYP2D6	23	43
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819438349	EG	On-Demand	Anodyne	ABCB1	34	41
COC(=O)CN1CCN(c2ccc(NCCC(=O)Nc3ccccc3)cc2)CC1	ZINC000819438353	GE	On-Demand	Anodyne	HTR1A	31	47
COC(=O)CN1CCN(c2ccc(NCCC(=O)Nc3ccccc3)cc2)CC1	ZINC000819438353	GE	On-Demand	Anodyne	DRD2	19	47
COC(=O)CN1CCN(c2ccc(NCCC(=O)Nc3ccccc3)cc2)CC1	ZINC000819438353	GE	On-Demand	Anodyne	HTR7	35	46
COC(=O)CN1CCN(c2ccc(NCCC(=O)Nc3ccccc3)cc2)CC1	ZINC000819438353	GE	On-Demand	Anodyne	NPY2R	18	41
COC(=O)CN1CCN(c2ccc(NCCC(=O)Nc3ccccc3)cc2)CC1	ZINC000819438353	GE	On-Demand	Anodyne	PRNP	43	45
COC(=O)CN1CCN(c2ccc(NCCC(=O)Nc3ccccc3)cc2)CC1	ZINC000819438353	GE	On-Demand	Anodyne	SLC27A1	48	39
O=C1CCCc2cc(NC[C@H](O)c3c(F)cccc3F)ccc2N1	ZINC000819438354	EG	On-Demand	Anodyne	PKM	35	40
O=C1CCCc2cc(NC[C@@H](O)c3c(F)cccc3F)ccc2N1	ZINC000819438355	EG	On-Demand	Anodyne	PKM	35	40
COC(=O)CN1CCN(c2ccc(NC[C@H](O)CN3CCOCC3)cc2)CC1	ZINC000819438358	GC	On-Demand	Anodyne	ABCB1	35	40
COC(=O)CN1CCN(c2ccc(NC[C@H](O)CN3CCOCC3)cc2)CC1	ZINC000819438358	GC	On-Demand	Anodyne	STAT6	65	35
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)CN3CCOCC3)cc2)CC1	ZINC000819438359	GC	On-Demand	Anodyne	ABCB1	35	40
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)CN3CCOCC3)cc2)CC1	ZINC000819438359	GC	On-Demand	Anodyne	STAT6	65	35
O=C1CCCc2cc(NC[C@H](O)c3ccc(F)c(F)c3)ccc2N1	ZINC000819438366	EG	On-Demand	Anodyne	PKM	33	40
O=C1CCCc2cc(NC[C@@H](O)c3ccc(F)c(F)c3)ccc2N1	ZINC000819438367	EG	On-Demand	Anodyne	PKM	33	40
O=C1CCCc2cc(NC[C@H](O)c3ccc(F)cc3Cl)ccc2N1	ZINC000819438370	EH	On-Demand	Anodyne	PKM	31	40
O=C1CCCc2cc(NC[C@@H](O)c3ccc(F)cc3Cl)ccc2N1	ZINC000819438371	EH	On-Demand	Anodyne	PKM	31	40
COC(=O)CSCc1cccc(NC[C@H](O)c2cccc(F)c2)c1	ZINC000819438375	EG	On-Demand	Anodyne	ADRB1	20	40
COC(=O)CSCc1cccc(NC[C@H](O)c2cccc(F)c2)c1	ZINC000819438375	EG	On-Demand	Anodyne	ADRB3	26	40
COC(=O)CSCc1cccc(NC[C@@H](O)c2cccc(F)c2)c1	ZINC000819438376	EG	On-Demand	Anodyne	ADRB1	20	40
COC(=O)CSCc1cccc(NC[C@@H](O)c2cccc(F)c2)c1	ZINC000819438376	EG	On-Demand	Anodyne	ADRB3	26	40
COC(=O)CN1CCN(c2ccc(NC[C@H](O)CCc3ccccc3)cc2)CC1	ZINC000819438383	GE	On-Demand	Anodyne	HTR1A	20	44
COC(=O)CN1CCN(c2ccc(NC[C@H](O)CCc3ccccc3)cc2)CC1	ZINC000819438383	GE	On-Demand	Anodyne	ABCB1	72	44
COC(=O)CN1CCN(c2ccc(NC[C@H](O)CCc3ccccc3)cc2)CC1	ZINC000819438383	GE	On-Demand	Anodyne	STAT6	51	36
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1ccccc1Cl	ZINC000819438389	EI	On-Demand	Anodyne	HRH3	15	42
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1ccccc1Cl	ZINC000819438389	EI	On-Demand	Anodyne	SIGMAR1	31	42
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1ccccc1Cl	ZINC000819438389	EI	On-Demand	Anodyne	HNMT	42	31
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)COCc1ccccc1	ZINC000819438394	FH	On-Demand	Anodyne	CASR	16	44
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)COCc1ccccc1	ZINC000819438394	FH	On-Demand	Anodyne	KCNQ2	45	34
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)COCc1ccccc1	ZINC000819438394	FH	On-Demand	Anodyne	NPY2R	46	43
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)COCc1ccccc1	ZINC000819438395	FH	On-Demand	Anodyne	CASR	16	44
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)COCc1ccccc1	ZINC000819438395	FH	On-Demand	Anodyne	KCNQ2	45	34
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)COCc1ccccc1	ZINC000819438395	FH	On-Demand	Anodyne	NPY2R	46	43
O[C@H](CNc1ccc(CCN2CCCC2)cc1)c1cc2ccccc2o1	ZINC000819438396	FI	On-Demand	Anodyne	SIGMAR1	20	47
N#Cc1ccc([C@@H](O)CNc2ccc(CCN3CCCC3)cc2)cc1	ZINC000819438405	EG	On-Demand	Mild	KCNJ1	26	55
N#Cc1ccc([C@H](O)CNc2ccc(CCN3CCCC3)cc2)cc1	ZINC000819438406	EG	On-Demand	Mild	KCNJ1	26	55
O[C@H](CNc1ccc(N2CCCCC2)c(Cl)c1)c1ccc(F)cn1	ZINC000819438409	EI	On-Demand	Anodyne	NPY2R	41	39
O[C@@H](CNc1ccc(N2CCCCC2)c(Cl)c1)c1ccc(F)cn1	ZINC000819438410	EI	On-Demand	Anodyne	NPY2R	41	39
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819438413	GH	On-Demand	Anodyne	ADRB2	24	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819438413	GH	On-Demand	Anodyne	ADRB1	44	38
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819438413	GH	On-Demand	Anodyne	DRD4	45	38
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819438413	GH	On-Demand	Anodyne	KCNQ2	45	35
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819438413	GH	On-Demand	Anodyne	NPY2R	74	46
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819438413	GH	On-Demand	Anodyne	ABCB1	34	52
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819438413	GH	On-Demand	Anodyne	TAAR1	30	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819438414	GH	On-Demand	Anodyne	ADRB2	24	43
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819438414	GH	On-Demand	Anodyne	ADRB1	44	38
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819438414	GH	On-Demand	Anodyne	DRD4	45	38
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819438414	GH	On-Demand	Anodyne	KCNQ2	45	35
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819438414	GH	On-Demand	Anodyne	NPY2R	74	46
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819438414	GH	On-Demand	Anodyne	ABCB1	34	52
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819438414	GH	On-Demand	Anodyne	TAAR1	30	41
CCOC(=O)C1CCC(O)(CNc2ccc(N3CCCC3)c(Cl)c2)CC1	ZINC000819438416	GH	On-Demand	Anodyne	NPY2R	55	40
CCOC(=O)CC[C@H](O)CNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819438429	FG	On-Demand	Anodyne	KCNQ2	47	36
CCOC(=O)CC[C@H](O)CNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819438429	FG	On-Demand	Anodyne	NPY2R	61	38
CCOC(=O)CC[C@@H](O)CNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819438430	FG	On-Demand	Anodyne	KCNQ2	47	36
CCOC(=O)CC[C@@H](O)CNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819438430	FG	On-Demand	Anodyne	NPY2R	61	38
CC[C@H](O)CNc1ccc(N2CCNC(=O)C2)c(Cl)c1	ZINC000819438432	CD	On-Demand	Anodyne	NPY2R	57	38
O=C(NCc1ccc(NC[C@@H](O)C2CC2)cc1)c1ccc(C(F)(F)F)cc1	ZINC000819438439	GH	On-Demand	Anodyne	GCGR	35	44
O=C(NCc1ccc(NC[C@@H](O)C2CC2)cc1)c1ccc(C(F)(F)F)cc1	ZINC000819438439	GH	On-Demand	Anodyne	TRPV1	16	44
O=C(NCc1ccc(NC[C@@H](O)C2CC2)cc1)c1ccc(C(F)(F)F)cc1	ZINC000819438439	GH	On-Demand	Anodyne	FLT1	15	41
O=C(NCc1ccc(NC[C@@H](O)C2CC2)cc1)c1ccc(C(F)(F)F)cc1	ZINC000819438439	GH	On-Demand	Anodyne	MTTP	48	42
O=C(NCc1ccc(NC[C@@H](O)C2CC2)cc1)c1ccc(C(F)(F)F)cc1	ZINC000819438439	GH	On-Demand	Anodyne	CCR2	44	40
O=C(NCc1ccc(NC[C@@H](O)C2CC2)cc1)c1ccc(C(F)(F)F)cc1	ZINC000819438439	GH	On-Demand	Anodyne	GIPR	63	44
O=C(NCc1ccc(NC[C@@H](O)C2CC2)cc1)c1ccc(C(F)(F)F)cc1	ZINC000819438439	GH	On-Demand	Anodyne	CYNT	18	41
O=C(NCc1ccc(NC[C@H](O)C2CC2)cc1)c1ccc(C(F)(F)F)cc1	ZINC000819438440	GH	On-Demand	Anodyne	GCGR	35	44
O=C(NCc1ccc(NC[C@H](O)C2CC2)cc1)c1ccc(C(F)(F)F)cc1	ZINC000819438440	GH	On-Demand	Anodyne	TRPV1	16	44
O=C(NCc1ccc(NC[C@H](O)C2CC2)cc1)c1ccc(C(F)(F)F)cc1	ZINC000819438440	GH	On-Demand	Anodyne	FLT1	15	41
O=C(NCc1ccc(NC[C@H](O)C2CC2)cc1)c1ccc(C(F)(F)F)cc1	ZINC000819438440	GH	On-Demand	Anodyne	MTTP	48	42
O=C(NCc1ccc(NC[C@H](O)C2CC2)cc1)c1ccc(C(F)(F)F)cc1	ZINC000819438440	GH	On-Demand	Anodyne	CCR2	44	40
O=C(NCc1ccc(NC[C@H](O)C2CC2)cc1)c1ccc(C(F)(F)F)cc1	ZINC000819438440	GH	On-Demand	Anodyne	GIPR	63	44
O=C(NCc1ccc(NC[C@H](O)C2CC2)cc1)c1ccc(C(F)(F)F)cc1	ZINC000819438440	GH	On-Demand	Anodyne	CYNT	18	41
CON(C)C(=O)CCNc1ccc(CCN2CCCC2)cc1	ZINC000819438448	DE	On-Demand	Anodyne	HRH3	23	46
CC[C@H](O)CNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819438450	CH	On-Demand	Anodyne	KCNQ2	58	38
CC[C@H](O)CNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819438450	CH	On-Demand	Anodyne	NPY2R	88	40
C#CCNC(=O)CCNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819438451	DE	On-Demand	Mild	KCNQ2	62	36
C#CCNC(=O)CCNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819438451	DE	On-Demand	Mild	NPY2R	62	41
O=C(N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO)C(F)=C1CCC1	ZINC000819438452	EE	On-Demand	Anodyne	DRD4	34	42
O=C(N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO)C(F)=C1CCC1	ZINC000819438452	EE	On-Demand	Anodyne	SIGMAR1	39	43
O=C(N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO)C(F)=C1CCC1	ZINC000819438453	EE	On-Demand	Anodyne	DRD4	34	42
O=C(N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO)C(F)=C1CCC1	ZINC000819438453	EE	On-Demand	Anodyne	SIGMAR1	39	43
O=C(N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO)C(F)=C1CCC1	ZINC000819438454	EE	On-Demand	Anodyne	DRD4	34	42
O=C(N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO)C(F)=C1CCC1	ZINC000819438454	EE	On-Demand	Anodyne	SIGMAR1	39	43
O=C(N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO)C(F)=C1CCC1	ZINC000819438455	EE	On-Demand	Anodyne	DRD4	34	42
O=C(N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO)C(F)=C1CCC1	ZINC000819438455	EE	On-Demand	Anodyne	SIGMAR1	39	43
C[C@@](O)(CNc1ccc(N2CCNC(=O)C2)c(Cl)c1)C(F)(F)F	ZINC000819438458	FE	On-Demand	Anodyne	NPY2R	40	41
O[C@@H](CNc1cc(F)ccc1OC[C@H]1CCCO1)c1cccc(F)c1	ZINC000819438461	EH	On-Demand	Anodyne	CYP3A4	42	32
O[C@H](CNc1cc(F)ccc1OC[C@@H]1CCCO1)c1cccc(F)c1	ZINC000819438462	EH	On-Demand	Anodyne	CYP3A4	42	32
O[C@H](CNc1cc(F)ccc1OC[C@H]1CCCO1)c1cccc(F)c1	ZINC000819438463	EH	On-Demand	Anodyne	CYP3A4	42	32
O[C@@H](CNc1cc(F)ccc1OC[C@@H]1CCCO1)c1cccc(F)c1	ZINC000819438464	EH	On-Demand	Anodyne	CYP3A4	42	32
O=S1(=O)CCC(O)(CNc2ccc(N3CCCCC3)c(Cl)c2)CC1	ZINC000819438482	FF	On-Demand	Anodyne	NPY2R	51	42
CC(C)(C)[C@@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819438483	CH	On-Demand	Anodyne	KCNQ2	43	34
CC(C)(C)[C@@H](O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819438483	CH	On-Demand	Anodyne	NPY2R	52	42
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)CCc3ccccc3)cc2)CC1	ZINC000819438484	GE	On-Demand	Anodyne	HTR1A	20	44
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)CCc3ccccc3)cc2)CC1	ZINC000819438484	GE	On-Demand	Anodyne	ABCB1	72	44
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)CCc3ccccc3)cc2)CC1	ZINC000819438484	GE	On-Demand	Anodyne	STAT6	51	36
CCOc1ccc(OC)cc1NC[C@@H](O)C(F)(F)F	ZINC000819438490	CE	On-Demand	Anodyne	MTNR1A	23	40
CCOc1ccc(OC)cc1NC[C@@H](O)C(F)(F)F	ZINC000819438490	CE	On-Demand	Anodyne	MTNR1B	20	40
CCOc1ccc(OC)cc1NC[C@H](O)C(F)(F)F	ZINC000819438491	CE	On-Demand	Anodyne	MTNR1A	23	40
CCOc1ccc(OC)cc1NC[C@H](O)C(F)(F)F	ZINC000819438491	CE	On-Demand	Anodyne	MTNR1B	20	40
O=C1NCCN(C(=O)C(F)=C2CCC2)[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000819438496	FG	On-Demand	Anodyne	TRPM8	47	39
O=C1NCCN(C(=O)C(F)=C2CCC2)[C@@H]1c1ccc(C(F)(F)F)cc1	ZINC000819438497	FG	On-Demand	Anodyne	TRPM8	47	39
O=C1CCCc2cc(NC[C@H](O)c3ccccc3F)ccc2N1	ZINC000819438498	DG	On-Demand	Anodyne	PKM	33	40
O=C1CCCc2cc(NC[C@@H](O)c3ccccc3F)ccc2N1	ZINC000819438499	DG	On-Demand	Anodyne	PKM	33	40
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819438506	FG	On-Demand	Anodyne	ADRB2	32	46
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819438506	FG	On-Demand	Anodyne	ADRB1	41	38
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819438506	FG	On-Demand	Anodyne	MTNR1A	36	42
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819438506	FG	On-Demand	Anodyne	MTNR1B	27	42
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819438506	FG	On-Demand	Anodyne	ABCB1	16	47
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819438506	FG	On-Demand	Anodyne	AKR1C2	20	41
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819438507	FG	On-Demand	Anodyne	ADRB2	32	46
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819438507	FG	On-Demand	Anodyne	ADRB1	41	38
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819438507	FG	On-Demand	Anodyne	MTNR1A	36	42
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819438507	FG	On-Demand	Anodyne	MTNR1B	27	42
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819438507	FG	On-Demand	Anodyne	ABCB1	16	47
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819438507	FG	On-Demand	Anodyne	AKR1C2	20	41
Cc1ccccc1[C@@H](O)CNc1ccc2c(c1)CCCC(=O)N2	ZINC000819438509	DG	On-Demand	Anodyne	PKM	36	40
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819438510	FG	On-Demand	Mild	ADRB2	30	41
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819438510	FG	On-Demand	Mild	ADRB1	28	40
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819438510	FG	On-Demand	Mild	CYP2D6	15	41
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819438511	FG	On-Demand	Mild	ADRB2	30	41
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819438511	FG	On-Demand	Mild	ADRB1	28	40
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819438511	FG	On-Demand	Mild	CYP2D6	15	41
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc3c(c2)CCCC(=O)N3)cc1	ZINC000819438512	FF	On-Demand	Anodyne	PKM	37	43
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc3c(c2)CCCC(=O)N3)cc1	ZINC000819438513	FF	On-Demand	Anodyne	PKM	37	43
CCOc1ccc(OC)cc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819438519	FG	On-Demand	Anodyne	ADRB2	29	58
CCOc1ccc(OC)cc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819438519	FG	On-Demand	Anodyne	ADRB1	30	58
CCOc1ccc(OC)cc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819438519	FG	On-Demand	Anodyne	CYP2D6	20	43
CCOc1ccc(OC)cc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819438520	FG	On-Demand	Anodyne	ADRB2	29	58
CCOc1ccc(OC)cc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819438520	FG	On-Demand	Anodyne	ADRB1	30	58
CCOc1ccc(OC)cc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819438520	FG	On-Demand	Anodyne	CYP2D6	20	43
O=C1CCCc2cc(NC[C@H](O)c3ccc(F)cc3)ccc2N1	ZINC000819438532	DG	On-Demand	Anodyne	GRIN2B	15	43
O=C1CCCc2cc(NC[C@@H](O)c3ccc(F)cc3)ccc2N1	ZINC000819438533	DG	On-Demand	Anodyne	GRIN2B	15	43
CCOc1ccc(OC)cc1NC[C@H](O)c1cccc(Br)c1	ZINC000819438534	FI	On-Demand	Anodyne	ADRB3	23	40
CCOc1ccc(OC)cc1NC[C@@H](O)c1cccc(Br)c1	ZINC000819438535	FI	On-Demand	Anodyne	ADRB3	23	40
COC(=O)CN1CCN(c2ccc(NC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819438539	FE	On-Demand	Anodyne	HTR1A	27	46
COC(=O)CN1CCN(c2ccc(NC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819438539	FE	On-Demand	Anodyne	HTR7	29	40
COC(=O)CN1CCN(c2ccc(NC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819438539	FE	On-Demand	Anodyne	KCNQ2	16	42
COC(=O)CN1CCN(c2ccc(NC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819438539	FE	On-Demand	Anodyne	NPY2R	29	44
COC(=O)CN1CCN(c2ccc(NC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819438539	FE	On-Demand	Anodyne	PRNP	45	41
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819438540	FE	On-Demand	Anodyne	HTR1A	27	46
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819438540	FE	On-Demand	Anodyne	HTR7	29	40
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819438540	FE	On-Demand	Anodyne	KCNQ2	16	42
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819438540	FE	On-Demand	Anodyne	NPY2R	29	44
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819438540	FE	On-Demand	Anodyne	PRNP	45	41
Cc1ccc(OC[C@H](O)CNc2ccc(NC(=O)OC(C)(C)C)cc2)cc1	ZINC000819438549	FI	On-Demand	Anodyne	ADRB2	50	54
Cc1ccc(OC[C@H](O)CNc2ccc(NC(=O)OC(C)(C)C)cc2)cc1	ZINC000819438549	FI	On-Demand	Anodyne	ADRB1	73	54
Cc1ccc(OC[C@H](O)CNc2ccc(NC(=O)OC(C)(C)C)cc2)cc1	ZINC000819438549	FI	On-Demand	Anodyne	ADRB3	43	44
Cc1ccc(OC[C@@H](O)CNc2ccc(NC(=O)OC(C)(C)C)cc2)cc1	ZINC000819438550	FI	On-Demand	Anodyne	ADRB2	50	54
Cc1ccc(OC[C@@H](O)CNc2ccc(NC(=O)OC(C)(C)C)cc2)cc1	ZINC000819438550	FI	On-Demand	Anodyne	ADRB1	73	54
Cc1ccc(OC[C@@H](O)CNc2ccc(NC(=O)OC(C)(C)C)cc2)cc1	ZINC000819438550	FI	On-Demand	Anodyne	ADRB3	43	44
O=C1CCCc2cc(NC[C@H](O)c3cccc(C(F)(F)F)c3)ccc2N1	ZINC000819438553	FI	On-Demand	Anodyne	PTK2B	18	40
O=C1CCCc2cc(NC[C@@H](O)c3cccc(C(F)(F)F)c3)ccc2N1	ZINC000819438554	FI	On-Demand	Anodyne	PTK2B	18	40
CCOc1ccc(OC)cc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819438556	GH	On-Demand	Anodyne	MMP13	16	47
CCOc1ccc(OC)cc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819438556	GH	On-Demand	Anodyne	GPR119	55	43
CCOc1ccc(OC)cc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819438557	GH	On-Demand	Anodyne	MMP13	16	47
CCOc1ccc(OC)cc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819438557	GH	On-Demand	Anodyne	GPR119	55	43
C#CCNC(=O)CCNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819438561	DF	On-Demand	Mild	KCNQ2	53	36
C#CCNC(=O)CCNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819438561	DF	On-Demand	Mild	NPY2R	62	41
N#Cc1cccc(S(=O)(=O)CCNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819438575	GH	On-Demand	Mild	ITGA4	51	34
CCOc1ccc(OC)cc1NC[C@H](O)c1cc(OC)ccc1OC	ZINC000819438576	EG	On-Demand	Anodyne	MTNR1A	26	43
CCOc1ccc(OC)cc1NC[C@H](O)c1cc(OC)ccc1OC	ZINC000819438576	EG	On-Demand	Anodyne	MTNR1B	24	40
CCOc1ccc(OC)cc1NC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819438578	EG	On-Demand	Anodyne	MTNR1A	26	43
CCOc1ccc(OC)cc1NC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819438578	EG	On-Demand	Anodyne	MTNR1B	24	40
COC(=O)CN1CCN(c2ccc(NC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819438591	GE	On-Demand	Anodyne	STAT6	40	37
COC(=O)CN1CCN(c2ccc(NC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819438591	GE	On-Demand	Anodyne	SLC27A1	28	42
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819438593	GE	On-Demand	Anodyne	STAT6	40	37
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819438593	GE	On-Demand	Anodyne	SLC27A1	28	42
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)C1CC1	ZINC000819438602	CF	On-Demand	Anodyne	HRH3	20	46
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)C1CC1	ZINC000819438602	CF	On-Demand	Anodyne	L3MBTL3	34	43
O[C@H](CNc1ccc(CCN2CCCC2)cc1)C1CC1	ZINC000819438606	CF	On-Demand	Anodyne	HRH3	20	46
O[C@H](CNc1ccc(CCN2CCCC2)cc1)C1CC1	ZINC000819438606	CF	On-Demand	Anodyne	L3MBTL3	34	43
CCOc1ccc(OC)cc1NCCC(=O)N(C)OC	ZINC000819438607	CD	On-Demand	Anodyne	MTNR1A	68	46
CCOc1ccc(OC)cc1NCCC(=O)N(C)OC	ZINC000819438607	CD	On-Demand	Anodyne	MTNR1B	58	46
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1ccccc1	ZINC000819438615	DI	On-Demand	Anodyne	KCNQ2	71	38
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1ccccc1	ZINC000819438615	DI	On-Demand	Anodyne	NPY2R	90	47
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1ccccc1	ZINC000819438616	DI	On-Demand	Anodyne	KCNQ2	71	38
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1ccccc1	ZINC000819438616	DI	On-Demand	Anodyne	NPY2R	90	47
CCC[C@@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCO1	ZINC000819438627	FF	On-Demand	Mild	PAPA1_CARPA	30	43
CCC[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCO1	ZINC000819438628	FF	On-Demand	Mild	PAPA1_CARPA	30	43
CCC[C@@H]1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCO1	ZINC000819438629	FF	On-Demand	Mild	PAPA1_CARPA	30	43
CCC[C@H]1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCO1	ZINC000819438630	FF	On-Demand	Mild	PAPA1_CARPA	30	43
O=S(=O)(CCNc1ccc(N2CCCC2)c(Cl)c1)c1ccccc1	ZINC000819438661	FH	On-Demand	Anodyne	KCNQ2	51	35
O=S(=O)(CCNc1ccc(N2CCCC2)c(Cl)c1)c1ccccc1	ZINC000819438661	FH	On-Demand	Anodyne	NPY2R	63	42
NC(=O)NC(=O)CCNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819438665	DE	On-Demand	Anodyne	KCNQ2	46	37
NC(=O)NC(=O)CCNc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819438665	DE	On-Demand	Anodyne	NPY2R	52	41
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1ccc(F)cc1	ZINC000819438666	EI	On-Demand	Anodyne	KCNQ2	48	38
O[C@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1ccc(F)cc1	ZINC000819438666	EI	On-Demand	Anodyne	NPY2R	55	45
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1ccc(F)cc1	ZINC000819438667	EI	On-Demand	Anodyne	KCNQ2	48	38
O[C@@H](CNc1ccc(N2CCCC2)c(Cl)c1)c1ccc(F)cc1	ZINC000819438667	EI	On-Demand	Anodyne	NPY2R	55	45
OC1(CNc2ccc(CCN3CCCC3)cc2)CCCCC1	ZINC000819438670	DG	On-Demand	Anodyne	HRH3	25	53
OC1(CNc2ccc(CCN3CCCC3)cc2)CCCCC1	ZINC000819438670	DG	On-Demand	Anodyne	L3MBTL3	30	41
OC1(CNc2ccc(CCN3CCCC3)cc2)CCCCC1	ZINC000819438670	DG	On-Demand	Anodyne	KCNJ1	18	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819438673	GH	On-Demand	Anodyne	KCNQ2	46	34
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(N2CCCC2)c(Cl)c1	ZINC000819438673	GH	On-Demand	Anodyne	NPY2R	63	42
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819438678	GH	On-Demand	Bother	ADRB1	20	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819438678	GH	On-Demand	Bother	ADRB3	16	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819438679	GH	On-Demand	Bother	ADRB1	20	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(N3CCCC3)c(Cl)c2)c1	ZINC000819438679	GH	On-Demand	Bother	ADRB3	16	43
O[C@@H](CNc1ccc(N2CCCCC2)c(Cl)c1)Cn1cccn1	ZINC000819438682	EF	On-Demand	Anodyne	NPY2R	44	38
O[C@H](CNc1ccc(N2CCCCC2)c(Cl)c1)Cn1cccn1	ZINC000819438683	EF	On-Demand	Anodyne	NPY2R	44	38
CCOc1ccc(OC)cc1NC[C@@H](O)Cc1ccccc1	ZINC000819438694	DG	On-Demand	Anodyne	ADRB2	28	43
CCOc1ccc(OC)cc1NC[C@@H](O)Cc1ccccc1	ZINC000819438694	DG	On-Demand	Anodyne	ADRB3	25	43
CCOc1ccc(OC)cc1NC[C@@H](O)Cc1ccccc1	ZINC000819438694	DG	On-Demand	Anodyne	ABCB1	23	40
CCOc1ccc(OC)cc1NC[C@H](O)Cc1ccccc1	ZINC000819438695	DG	On-Demand	Anodyne	ADRB2	28	43
CCOc1ccc(OC)cc1NC[C@H](O)Cc1ccccc1	ZINC000819438695	DG	On-Demand	Anodyne	ADRB3	25	43
CCOc1ccc(OC)cc1NC[C@H](O)Cc1ccccc1	ZINC000819438695	DG	On-Demand	Anodyne	ABCB1	23	40
COC(=O)[C@@]1(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCSC1	ZINC000819438700	GD	On-Demand	Mild	PAPA1_CARPA	39	47
COC(=O)[C@@]1(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCSC1	ZINC000819438701	GD	On-Demand	Mild	PAPA1_CARPA	39	47
CCOc1ccc(OC)cc1NCC1(O)CCCCC1	ZINC000819438704	CG	On-Demand	Anodyne	MTNR1A	22	41
CCOc1ccc(OC)cc1NCC1(O)CCCCC1	ZINC000819438704	CG	On-Demand	Anodyne	MTNR1B	21	41
CCOc1ccc(OC)cc1NCC1(O)CCCCC1	ZINC000819438704	CG	On-Demand	Anodyne	HCN1	41	31
CCOc1ccc(OC)cc1NCC1(O)CCCCC1	ZINC000819438704	CG	On-Demand	Anodyne	HCN4	40	31
CCOc1ccc(OC)cc1NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819438705	FH	On-Demand	Anodyne	MTNR1A	55	55
CCOc1ccc(OC)cc1NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819438705	FH	On-Demand	Anodyne	MTNR1B	51	55
O=S(=O)(CCNc1ccc(N2CCCC2)c(Cl)c1)c1ccc(F)cc1	ZINC000819438707	GH	On-Demand	Anodyne	NPY2R	45	44
CCOC[C@H](O)CNc1cc(OC)ccc1OCC	ZINC000819438729	CD	On-Demand	Anodyne	ADRB2	25	40
CCOC[C@H](O)CNc1cc(OC)ccc1OCC	ZINC000819438729	CD	On-Demand	Anodyne	MTNR1A	20	40
CCOC[C@H](O)CNc1cc(OC)ccc1OCC	ZINC000819438729	CD	On-Demand	Anodyne	MTNR1B	17	40
CCOc1ccc(OC)cc1NCC1(O)CCCC1	ZINC000819438733	CF	On-Demand	Anodyne	MTNR1A	25	42
CCOc1ccc(OC)cc1NCC1(O)CCCC1	ZINC000819438733	CF	On-Demand	Anodyne	MTNR1B	23	42
COc1cccc([S@](=O)CC(=O)N2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819438736	FE	On-Demand	Anodyne	DRD4	43	34
COc1cccc([S@@](=O)CC(=O)N2CCCN2C(=O)OC(C)(C)C)c1	ZINC000819438740	FE	On-Demand	Anodyne	DRD4	43	34
O=C(/C=C\[C@@H]1CCCO1)Nc1ccnn1Cc1ccc(OC(F)(F)F)cc1	ZINC000819438745	GH	On-Demand	Anodyne	GCGR	30	40
O=C(/C=C/[C@H]1CCCO1)Nc1ccnn1Cc1ccc(OC(F)(F)F)cc1	ZINC000819438747	GH	On-Demand	Anodyne	GCGR	30	40
O=C(/C=C/[C@@H]1CCCO1)Nc1ccnn1Cc1ccc(OC(F)(F)F)cc1	ZINC000819438748	GH	On-Demand	Anodyne	GCGR	30	40
O=C(/C=C\[C@H]1CCCO1)Nc1ccnn1Cc1ccc(OC(F)(F)F)cc1	ZINC000819438749	GH	On-Demand	Anodyne	GCGR	30	40
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819438752	EG	On-Demand	Anodyne	ADRB2	34	50
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819438752	EG	On-Demand	Anodyne	ADRB1	29	40
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819438753	EG	On-Demand	Anodyne	ADRB2	34	50
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819438753	EG	On-Demand	Anodyne	ADRB1	29	40
O=C1CCCc2cc(NC[C@H](O)c3ccc(Cl)cc3)ccc2N1	ZINC000819438763	EH	On-Demand	Anodyne	PKM	35	41
COC(=O)CN1CCN(c2ccc(NC[C@H](O)c3ccc(F)cn3)cc2)CC1	ZINC000819438764	GD	On-Demand	Anodyne	STAT6	74	40
COC(=O)CN1CCN(c2ccc(NC[C@H](O)c3ccc(F)cn3)cc2)CC1	ZINC000819438764	GD	On-Demand	Anodyne	SLC27A1	58	39
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)c3ccc(F)cn3)cc2)CC1	ZINC000819438766	GD	On-Demand	Anodyne	STAT6	74	40
COC(=O)CN1CCN(c2ccc(NC[C@@H](O)c3ccc(F)cn3)cc2)CC1	ZINC000819438766	GD	On-Demand	Anodyne	SLC27A1	58	39
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819438771	FF	On-Demand	Anodyne	EDNRB	65	39
CCOc1ccc(OC)cc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819438771	FF	On-Demand	Anodyne	EDNRA	67	42
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819438772	FF	On-Demand	Anodyne	EDNRB	65	39
CCOc1ccc(OC)cc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819438772	FF	On-Demand	Anodyne	EDNRA	67	42
CN(C)CCCOc1ccc(NCC2(O)CCCCC2)cc1	ZINC000819438773	DG	On-Demand	Anodyne	HRH3	18	49
CN(C)CCCOc1ccc(NCC2(O)CCCCC2)cc1	ZINC000819438773	DG	On-Demand	Anodyne	ESRRG	45	34
CN(C)CCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819438775	DG	On-Demand	Anodyne	ADRB2	21	47
CN(C)CCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819438775	DG	On-Demand	Anodyne	ADRB1	23	41
CN(C)CCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819438775	DG	On-Demand	Anodyne	ADRB3	24	41
CN(C)CCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819438775	DG	On-Demand	Anodyne	LTA4H	38	49
CN(C)CCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819438775	DG	On-Demand	Anodyne	ESRRG	54	39
CN(C)CCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819438775	DG	On-Demand	Anodyne	FAAH	16	43
CN(C)CCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819438776	DG	On-Demand	Anodyne	ADRB2	21	47
CN(C)CCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819438776	DG	On-Demand	Anodyne	ADRB1	23	41
CN(C)CCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819438776	DG	On-Demand	Anodyne	ADRB3	24	41
CN(C)CCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819438776	DG	On-Demand	Anodyne	LTA4H	38	49
CN(C)CCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819438776	DG	On-Demand	Anodyne	ESRRG	54	39
CN(C)CCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819438776	DG	On-Demand	Anodyne	FAAH	16	43
C#CCOc1cccc(NC[C@@H](O)CCNC(=O)OC(C)(C)C)c1	ZINC000819438777	EE	On-Demand	Mild	PDS	51	32
C#CCOc1cccc(NC[C@H](O)CCNC(=O)OC(C)(C)C)c1	ZINC000819438778	EE	On-Demand	Mild	PDS	51	32
C#CCOc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819438784	FF	On-Demand	Mild	ADRB2	49	65
C#CCOc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819438784	FF	On-Demand	Mild	ADRB1	74	65
C#CCOc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819438784	FF	On-Demand	Mild	ADRB3	43	53
C#CCOc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819438785	FF	On-Demand	Mild	ADRB2	49	65
C#CCOc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819438785	FF	On-Demand	Mild	ADRB1	74	65
C#CCOc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819438785	FF	On-Demand	Mild	ADRB3	43	53
CN(C)CCCOc1ccc(NC[C@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819438786	GI	On-Demand	Anodyne	ESRRG	45	33
CN(C)CCCOc1ccc(NC[C@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819438786	GI	On-Demand	Anodyne	NEK2	19	41
CN(C)CCCOc1ccc(NC[C@@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819438787	GI	On-Demand	Anodyne	ESRRG	45	33
CN(C)CCCOc1ccc(NC[C@@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819438787	GI	On-Demand	Anodyne	NEK2	19	41
CN(C)CCCOc1ccc(NC[C@H](O)C2CCCCC2)cc1	ZINC000819438788	DG	On-Demand	Anodyne	AMY2	40	40
CN(C)CCCOc1ccc(NC[C@H](O)C2CCCCC2)cc1	ZINC000819438788	DG	On-Demand	Anodyne	ESRRG	43	31
CN(C)CCCOc1ccc(NC[C@@H](O)C2CCCCC2)cc1	ZINC000819438789	DG	On-Demand	Anodyne	AMY2	40	40
CN(C)CCCOc1ccc(NC[C@@H](O)C2CCCCC2)cc1	ZINC000819438789	DG	On-Demand	Anodyne	ESRRG	43	31
C#CCOc1cccc(NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819438790	GE	On-Demand	Mild	HTR1A	15	42
C#CCOc1cccc(NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819438790	GE	On-Demand	Mild	DRD4	45	36
C#CCOc1cccc(NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819438790	GE	On-Demand	Mild	ACOX1	49	36
C#CCOc1cccc(NC[C@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819438790	GE	On-Demand	Mild	ABCB1	48	42
C#CCOc1cccc(NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819438791	GE	On-Demand	Mild	HTR1A	15	42
C#CCOc1cccc(NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819438791	GE	On-Demand	Mild	DRD4	45	36
C#CCOc1cccc(NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819438791	GE	On-Demand	Mild	ACOX1	49	36
C#CCOc1cccc(NC[C@@H](O)CN2CCN(c3ccc(OC)cc3)CC2)c1	ZINC000819438791	GE	On-Demand	Mild	ABCB1	48	42
C#CCOc1cccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819438792	FG	On-Demand	Mild	EPHX2	17	45
C#CCOc1cccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819438792	FG	On-Demand	Mild	GPR119	50	46
C#CCOc1cccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819438793	FG	On-Demand	Mild	EPHX2	17	45
C#CCOc1cccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819438793	FG	On-Demand	Mild	GPR119	50	46
COC[C@@H](O)CNc1ccc(OCCCN(C)C)cc1	ZINC000819438798	CD	On-Demand	Anodyne	ADRB2	27	40
COC[C@@H](O)CNc1ccc(OCCCN(C)C)cc1	ZINC000819438798	CD	On-Demand	Anodyne	ADRB1	36	40
COC[C@@H](O)CNc1ccc(OCCCN(C)C)cc1	ZINC000819438798	CD	On-Demand	Anodyne	ESRRG	43	31
C#CCOc1cccc(NC[C@H](O)COc2cccc(C)c2)c1	ZINC000819438822	DF	On-Demand	Mild	ADRB2	34	60
C#CCOc1cccc(NC[C@H](O)COc2cccc(C)c2)c1	ZINC000819438822	DF	On-Demand	Mild	ADRB1	34	60
C#CCOc1cccc(NC[C@@H](O)COc2cccc(C)c2)c1	ZINC000819438823	DF	On-Demand	Mild	ADRB2	34	60
C#CCOc1cccc(NC[C@@H](O)COc2cccc(C)c2)c1	ZINC000819438823	DF	On-Demand	Mild	ADRB1	34	60
C#CCOc1ccc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819438824	FE	On-Demand	Mild	ADRB1	24	41
C#CCOc1ccc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819438825	FE	On-Demand	Mild	ADRB1	24	41
Cc1ccccc1[C@@H](O)CNc1ccc(CCN2CCCC2)cc1	ZINC000819438826	DH	On-Demand	Anodyne	HNMT	59	33
CN(C)CCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1	ZINC000819438828	FH	On-Demand	Anodyne	LTA4H	45	43
CN(C)CCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1	ZINC000819438828	FH	On-Demand	Anodyne	AURKB	36	42
CN(C)CCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1	ZINC000819438828	FH	On-Demand	Anodyne	ESRRG	42	31
CN(C)CCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1	ZINC000819438828	FH	On-Demand	Anodyne	MET	15	40
CN(C)CCCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1	ZINC000819438828	FH	On-Demand	Anodyne	MCHR2	22	41
C#CCOc1ccc(NC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819438836	EG	On-Demand	Mild	ADRB2	31	43
C#CCOc1ccc(NC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819438836	EG	On-Demand	Mild	ADRB1	41	43
C#CCOc1ccc(NC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819438837	EG	On-Demand	Mild	ADRB2	31	43
C#CCOc1ccc(NC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819438837	EG	On-Demand	Mild	ADRB1	41	43
CN(C)CCCOc1ccc(NC[C@H](O)c2ccccc2F)cc1	ZINC000819438838	EG	On-Demand	Anodyne	LTA4H	22	40
CN(C)CCCOc1ccc(NC[C@H](O)c2ccccc2F)cc1	ZINC000819438838	EG	On-Demand	Anodyne	ESRRG	48	34
CN(C)CCCOc1ccc(NC[C@@H](O)c2ccccc2F)cc1	ZINC000819438839	EG	On-Demand	Anodyne	LTA4H	22	40
CN(C)CCCOc1ccc(NC[C@@H](O)c2ccccc2F)cc1	ZINC000819438839	EG	On-Demand	Anodyne	ESRRG	48	34
C#CCOc1cccc(NC[C@@H](O)COCc2ccccc2)c1	ZINC000819438842	DF	On-Demand	Mild	PDS	52	31
C#CCOc1cccc(NC[C@H](O)COCc2ccccc2)c1	ZINC000819438843	DF	On-Demand	Mild	PDS	52	31
C#CCOc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819438846	EF	On-Demand	Mild	ADRB2	43	46
C#CCOc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819438846	EF	On-Demand	Mild	ADRB1	65	46
C#CCOc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819438846	EF	On-Demand	Mild	ADRB3	36	40
C#CCOc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819438846	EF	On-Demand	Mild	CASR	44	31
C#CCOc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819438846	EF	On-Demand	Mild	ABCB1	20	45
C#CCOc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819438846	EF	On-Demand	Mild	PDS	47	36
C#CCOc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819438847	EF	On-Demand	Mild	ADRB2	43	46
C#CCOc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819438847	EF	On-Demand	Mild	ADRB1	65	46
C#CCOc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819438847	EF	On-Demand	Mild	ADRB3	36	40
C#CCOc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819438847	EF	On-Demand	Mild	CASR	44	31
C#CCOc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819438847	EF	On-Demand	Mild	ABCB1	20	45
C#CCOc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819438847	EF	On-Demand	Mild	PDS	47	36
COC[C@@H](O)CNc1ccc(N2CCSCC2)c(Cl)c1	ZINC000819438849	DE	On-Demand	Anodyne	NPY2R	45	37
C#CCOc1ccc(NC[C@H](O)COCCOC)cc1	ZINC000819438850	CD	On-Demand	Mild	ADRB2	20	43
C#CCOc1ccc(NC[C@H](O)COCCOC)cc1	ZINC000819438850	CD	On-Demand	Mild	ADRB1	28	43
C#CCOc1ccc(NC[C@@H](O)COCCOC)cc1	ZINC000819438851	CD	On-Demand	Mild	ADRB2	20	43
C#CCOc1ccc(NC[C@@H](O)COCCOC)cc1	ZINC000819438851	CD	On-Demand	Mild	ADRB1	28	43
CN(C)CCCOc1ccc(NCCC(=O)Nc2ccccc2F)cc1	ZINC000819438852	FH	On-Demand	Anodyne	LTA4H	44	43
CN(C)CCCOc1ccc(NCCC(=O)Nc2ccccc2F)cc1	ZINC000819438852	FH	On-Demand	Anodyne	ESRRG	45	33
CN(C)CCCOc1ccc(NCCC(=O)Nc2ccccc2F)cc1	ZINC000819438852	FH	On-Demand	Anodyne	FAAH	17	44
C#CCOc1cccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819438855	FF	On-Demand	Mild	ADRB2	49	57
C#CCOc1cccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819438855	FF	On-Demand	Mild	ADRB1	74	57
C#CCOc1cccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819438855	FF	On-Demand	Mild	ADRB3	44	47
C#CCOc1cccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819438855	FF	On-Demand	Mild	MTNR1B	15	41
C#CCOc1cccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819438855	FF	On-Demand	Mild	PDS	44	36
C#CCOc1cccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819438856	FF	On-Demand	Mild	ADRB2	49	57
C#CCOc1cccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819438856	FF	On-Demand	Mild	ADRB1	74	57
C#CCOc1cccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819438856	FF	On-Demand	Mild	ADRB3	44	47
C#CCOc1cccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819438856	FF	On-Demand	Mild	MTNR1B	15	41
C#CCOc1cccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)c1	ZINC000819438856	FF	On-Demand	Mild	PDS	44	36
O[C@H](CNc1ccc(N2CCSCC2)c(Cl)c1)c1ccccc1	ZINC000819438862	EI	On-Demand	Anodyne	NPY2R	66	42
O[C@@H](CNc1ccc(N2CCSCC2)c(Cl)c1)c1ccccc1	ZINC000819438863	EI	On-Demand	Anodyne	NPY2R	66	42
C#CCOc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819438864	EF	On-Demand	Mild	NOD2	43	40
C#CCOc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819438865	EF	On-Demand	Mild	NOD2	43	40
CN(C)CCCOc1ccc(NC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819438868	EG	On-Demand	Anodyne	ESRRG	43	31
CN(C)CCCOc1ccc(NC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819438869	EG	On-Demand	Anodyne	ESRRG	43	31
C#CCOc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819438870	FG	On-Demand	Mild	MMP13	17	46
C#CCOc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819438870	FG	On-Demand	Mild	GPR119	53	43
C#CCOc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819438871	FG	On-Demand	Mild	MMP13	17	46
C#CCOc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819438871	FG	On-Demand	Mild	GPR119	53	43
C#CCOc1cccc(NC[C@H](O)COc2ccc(OCC)cc2)c1	ZINC000819438873	EF	On-Demand	Mild	ADRB2	41	44
C#CCOc1cccc(NC[C@H](O)COc2ccc(OCC)cc2)c1	ZINC000819438873	EF	On-Demand	Mild	ADRB1	49	44
C#CCOc1cccc(NC[C@H](O)COc2ccc(OCC)cc2)c1	ZINC000819438873	EF	On-Demand	Mild	PDS	69	36
C#CCOc1cccc(NC[C@@H](O)COc2ccc(OCC)cc2)c1	ZINC000819438874	EF	On-Demand	Mild	ADRB2	41	44
C#CCOc1cccc(NC[C@@H](O)COc2ccc(OCC)cc2)c1	ZINC000819438874	EF	On-Demand	Mild	ADRB1	49	44
C#CCOc1cccc(NC[C@@H](O)COc2ccc(OCC)cc2)c1	ZINC000819438874	EF	On-Demand	Mild	PDS	69	36
O=C(CCNc1ccc(N2CCSCC2)c(Cl)c1)Nc1ccccc1F	ZINC000819438875	GI	On-Demand	Anodyne	KCNQ2	60	39
O=C(CCNc1ccc(N2CCSCC2)c(Cl)c1)Nc1ccccc1F	ZINC000819438875	GI	On-Demand	Anodyne	NPY2R	98	46
CN(C)CCCOc1ccc(NC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819438876	FH	On-Demand	Anodyne	ESRRG	45	32
C#CCOc1cccc(NC[C@@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819438879	EE	On-Demand	Mild	PDS	47	32
C#CCOc1cccc(NC[C@](C)(O)CNC(=O)OC(C)(C)C)c1	ZINC000819438880	EE	On-Demand	Mild	PDS	47	32
CC[C@H](O)CNc1ccc(N2CCSCC2)c(Cl)c1	ZINC000819438888	DG	On-Demand	Anodyne	NPY2R	78	39
C#CCOc1ccc(NC[C@@H](O)COCc2ccc(OC)cc2)cc1	ZINC000819438891	EF	On-Demand	Mild	ADRB2	29	42
C#CCOc1ccc(NC[C@@H](O)COCc2ccc(OC)cc2)cc1	ZINC000819438891	EF	On-Demand	Mild	ADRB1	40	42
C#CCOc1ccc(NC[C@@H](O)COCc2ccc(OC)cc2)cc1	ZINC000819438891	EF	On-Demand	Mild	ADRB3	26	46
C#CCOc1ccc(NC[C@H](O)COCc2ccc(OC)cc2)cc1	ZINC000819438892	EF	On-Demand	Mild	ADRB2	29	42
C#CCOc1ccc(NC[C@H](O)COCc2ccc(OC)cc2)cc1	ZINC000819438892	EF	On-Demand	Mild	ADRB1	40	42
C#CCOc1ccc(NC[C@H](O)COCc2ccc(OC)cc2)cc1	ZINC000819438892	EF	On-Demand	Mild	ADRB3	26	46
CN(C)CCCOc1ccc(NC[C@H](O)CN2CCOCC2)cc1	ZINC000819438896	ED	On-Demand	Anodyne	EPHX2	15	43
CN(C)CCCOc1ccc(NC[C@@H](O)CN2CCOCC2)cc1	ZINC000819438897	ED	On-Demand	Anodyne	EPHX2	15	43
C#CCOc1ccc(NC[C@H](O)COC(C)C)cc1	ZINC000819438911	CD	On-Demand	Mild	ADRB2	26	44
C#CCOc1ccc(NC[C@H](O)COC(C)C)cc1	ZINC000819438911	CD	On-Demand	Mild	ADRB1	26	40
C#CCOc1ccc(NC[C@@H](O)COC(C)C)cc1	ZINC000819438912	CD	On-Demand	Mild	ADRB2	26	44
C#CCOc1ccc(NC[C@@H](O)COC(C)C)cc1	ZINC000819438912	CD	On-Demand	Mild	ADRB1	26	40
C#CCOc1cccc(NC[C@H](O)COc2ccc(SC)cc2)c1	ZINC000819438913	EG	On-Demand	Mild	ADRB2	28	42
C#CCOc1cccc(NC[C@H](O)COc2ccc(SC)cc2)c1	ZINC000819438913	EG	On-Demand	Mild	ADRB1	40	42
C#CCOc1cccc(NC[C@@H](O)COc2ccc(SC)cc2)c1	ZINC000819438914	EG	On-Demand	Mild	ADRB2	28	42
C#CCOc1cccc(NC[C@@H](O)COc2ccc(SC)cc2)c1	ZINC000819438914	EG	On-Demand	Mild	ADRB1	40	42
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(CCN3CCCC3)cc2)cc1	ZINC000819438927	GF	On-Demand	Anodyne	ADRB2	23	42
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(CCN3CCCC3)cc2)cc1	ZINC000819438927	GF	On-Demand	Anodyne	ADRB1	15	40
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(CCN3CCCC3)cc2)cc1	ZINC000819438927	GF	On-Demand	Anodyne	ADRB3	60	37
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(CCN3CCCC3)cc2)cc1	ZINC000819438928	GF	On-Demand	Anodyne	ADRB2	23	42
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(CCN3CCCC3)cc2)cc1	ZINC000819438928	GF	On-Demand	Anodyne	ADRB1	15	40
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(CCN3CCCC3)cc2)cc1	ZINC000819438928	GF	On-Demand	Anodyne	ADRB3	60	37
CN(C)CCCOc1ccc(NCC(C)(C)O)cc1	ZINC000819438931	CE	On-Demand	Anodyne	LTA4H	28	42
CN(C)CCCOc1ccc(NCC(C)(C)O)cc1	ZINC000819438931	CE	On-Demand	Anodyne	ESRRG	46	33
CN(C)CCCOc1ccc(NCCC(N)=O)cc1	ZINC000819438937	CD	On-Demand	Anodyne	LTA4H	33	50
CN(C)CCCOc1ccc(NCCC(N)=O)cc1	ZINC000819438937	CD	On-Demand	Anodyne	ESRRG	46	33
C#CCOc1cccc(NC[C@H](O)CC)c1	ZINC000819438940	BD	On-Demand	Mild	PDS	50	35
C#CCOc1cccc(NC[C@@H](O)CC)c1	ZINC000819438941	BD	On-Demand	Mild	PDS	50	35
CN(C)CCCOc1ccc(NCCS(=O)(=O)c2ccccc2)cc1	ZINC000819438945	FF	On-Demand	Anodyne	LTA4H	29	43
CN(C)CCCOc1ccc(NCCS(=O)(=O)c2ccccc2)cc1	ZINC000819438945	FF	On-Demand	Anodyne	ESRRG	46	33
C#CCNC(=O)CCNc1ccc(N2CCSCC2)c(Cl)c1	ZINC000819438953	EE	On-Demand	Mild	NPY2R	52	39
C[C@@H](CNc1ccc(N2CCSCC2)c(Cl)c1)S(C)(=O)=O	ZINC000819438957	EF	On-Demand	Anodyne	NPY2R	41	39
OC1(CNc2ccc(N3CCSCC3)c(Cl)c2)CCC1	ZINC000819438967	DG	On-Demand	Anodyne	NPY2R	40	36
N#CCCSc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819438970	CG	On-Demand	Mild	ADRB3	40	36
N#CCCSc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819438971	CG	On-Demand	Mild	ADRB3	40	36
NC(=O)NC(=O)CCNc1ccc(N2CCSCC2)c(Cl)c1	ZINC000819438972	ED	On-Demand	Anodyne	NPY2R	47	38
C#CCOc1ccc(NC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819438979	FG	On-Demand	Mild	ADAM17	21	46
C#CCOc1ccc(NC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819438979	FG	On-Demand	Mild	GPR119	27	43
C#CCOc1ccc(NC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819438980	FG	On-Demand	Mild	ADAM17	21	46
C#CCOc1ccc(NC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819438980	FG	On-Demand	Mild	GPR119	27	43
CN(C)CCCOc1ccc(NCC2(O)CCCC2)cc1	ZINC000819438992	CF	On-Demand	Anodyne	ESRRG	43	33
C#CCOc1cccc(NCCC(=O)Nc2cc(OC)c(OC)c(OC)c2)c1	ZINC000819438995	GG	On-Demand	Mild	MTNR1B	16	44
C#CCOc1cccc(NCCC(=O)Nc2cc(OC)c(OC)c(OC)c2)c1	ZINC000819438995	GG	On-Demand	Mild	KCNK3	42	37
C#CCOc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1	ZINC000819439000	DF	On-Demand	Mild	ADRB2	44	59
C#CCOc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1	ZINC000819439000	DF	On-Demand	Mild	ADRB1	55	59
C#CCOc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1	ZINC000819439001	DF	On-Demand	Mild	ADRB2	44	59
C#CCOc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1	ZINC000819439001	DF	On-Demand	Mild	ADRB1	55	59
C#CCOc1ccc(NC[C@H](O)COC2CCOCC2)cc1	ZINC000819439004	DD	On-Demand	Mild	ADRB1	23	41
C#CCOc1ccc(NC[C@@H](O)COC2CCOCC2)cc1	ZINC000819439005	DD	On-Demand	Mild	ADRB1	23	41
CC(C)(C)[C@@H](O)CNc1ccc(N2CCSCC2)c(Cl)c1	ZINC000819439016	EH	On-Demand	Anodyne	NPY2R	47	40
C#CCOc1cccc(NC[C@H](O)CCc2ccccc2)c1	ZINC000819439030	CG	On-Demand	Mild	PDS	46	31
C#CCOc1cccc(NC[C@@H](O)CCc2ccccc2)c1	ZINC000819439031	CG	On-Demand	Mild	PDS	46	31
C#CCOc1ccc(NC[C@H](O)COCC(C)C)cc1	ZINC000819439032	CE	On-Demand	Mild	ADRB2	22	45
C#CCOc1ccc(NC[C@@H](O)COCC(C)C)cc1	ZINC000819439033	CE	On-Demand	Mild	ADRB2	22	45
CN(C)CCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819439036	EG	On-Demand	Anodyne	LTA4H	46	47
CN(C)CCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819439036	EG	On-Demand	Anodyne	ESRRG	50	36
CN(C)CCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819439037	EG	On-Demand	Anodyne	LTA4H	46	47
CN(C)CCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819439037	EG	On-Demand	Anodyne	ESRRG	50	36
C#CCOc1ccc(NC[C@@H](O)CO[C@@H](C)COC)cc1	ZINC000819439043	CD	On-Demand	Mild	ADRB2	20	42
C#CCOc1ccc(NC[C@@H](O)CO[C@@H](C)COC)cc1	ZINC000819439043	CD	On-Demand	Mild	ADRB1	20	42
C#CCOc1ccc(NC[C@H](O)CO[C@H](C)COC)cc1	ZINC000819439044	CD	On-Demand	Mild	ADRB2	20	42
C#CCOc1ccc(NC[C@H](O)CO[C@H](C)COC)cc1	ZINC000819439044	CD	On-Demand	Mild	ADRB1	20	42
C#CCOc1ccc(NC[C@@H](O)CO[C@H](C)COC)cc1	ZINC000819439045	CD	On-Demand	Mild	ADRB2	20	42
C#CCOc1ccc(NC[C@@H](O)CO[C@H](C)COC)cc1	ZINC000819439045	CD	On-Demand	Mild	ADRB1	20	42
C#CCOc1ccc(NC[C@H](O)CO[C@@H](C)COC)cc1	ZINC000819439046	CD	On-Demand	Mild	ADRB2	20	42
C#CCOc1ccc(NC[C@H](O)CO[C@@H](C)COC)cc1	ZINC000819439046	CD	On-Demand	Mild	ADRB1	20	42
CN(C)CCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819439055	EG	On-Demand	Anodyne	LTA4H	74	53
CN(C)CCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819439055	EG	On-Demand	Anodyne	HDAC10	15	43
CN(C)CCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819439055	EG	On-Demand	Anodyne	MTNR1B	22	44
CN(C)CCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819439055	EG	On-Demand	Anodyne	PLA2G4B	52	30
CN(C)CCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819439055	EG	On-Demand	Anodyne	ESRRG	51	38
CN(C)CCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819439055	EG	On-Demand	Anodyne	FAAH	22	44
CN(C)CCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819439055	EG	On-Demand	Anodyne	MCHR2	22	42
C#CCOc1cccc(NC[C@H](O)COc2ccccc2C)c1	ZINC000819439056	DF	On-Demand	Mild	ADRB2	34	54
C#CCOc1cccc(NC[C@H](O)COc2ccccc2C)c1	ZINC000819439056	DF	On-Demand	Mild	ADRB1	54	44
C#CCOc1cccc(NC[C@H](O)COc2ccccc2C)c1	ZINC000819439056	DF	On-Demand	Mild	CASR	40	38
C#CCOc1cccc(NC[C@H](O)COc2ccccc2C)c1	ZINC000819439056	DF	On-Demand	Mild	CYP2D6	19	42
C#CCOc1cccc(NC[C@@H](O)COc2ccccc2C)c1	ZINC000819439057	DF	On-Demand	Mild	ADRB2	34	54
C#CCOc1cccc(NC[C@@H](O)COc2ccccc2C)c1	ZINC000819439057	DF	On-Demand	Mild	ADRB1	54	44
C#CCOc1cccc(NC[C@@H](O)COc2ccccc2C)c1	ZINC000819439057	DF	On-Demand	Mild	CASR	40	38
C#CCOc1cccc(NC[C@@H](O)COc2ccccc2C)c1	ZINC000819439057	DF	On-Demand	Mild	CYP2D6	19	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCc3noc(C)n3)cc2)cc1	ZINC000819439069	GG	On-Demand	Anodyne	ADRB2	28	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCc3noc(C)n3)cc2)cc1	ZINC000819439069	GG	On-Demand	Anodyne	ADRB1	42	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCc3noc(C)n3)cc2)cc1	ZINC000819439070	GG	On-Demand	Anodyne	ADRB2	28	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCc3noc(C)n3)cc2)cc1	ZINC000819439070	GG	On-Demand	Anodyne	ADRB1	42	42
Cc1ccc(NC[C@@H](O)c2ccc(F)cc2)cc1NC(=O)C(C)(C)C	ZINC000819439077	EI	On-Demand	Anodyne	LEF	44	33
Cc1ccc(NC[C@H](O)c2ccc(F)cc2)cc1NC(=O)C(C)(C)C	ZINC000819439078	EI	On-Demand	Anodyne	LEF	44	33
O=S1(=O)CCCN1c1cc(NC[C@H](O)c2cccnc2)ccc1F	ZINC000819439101	FD	On-Demand	Anodyne	ADRB1	21	40
O=S1(=O)CCCN1c1cc(NC[C@H](O)c2cccnc2)ccc1F	ZINC000819439101	FD	On-Demand	Anodyne	ADRB3	86	43
O=S1(=O)CCCN1c1cc(NC[C@@H](O)c2cccnc2)ccc1F	ZINC000819439102	FD	On-Demand	Anodyne	ADRB1	21	40
O=S1(=O)CCCN1c1cc(NC[C@@H](O)c2cccnc2)ccc1F	ZINC000819439102	FD	On-Demand	Anodyne	ADRB3	86	43
COC[C@@H](O)CNc1cccc(OCc2ccc(C)cc2)c1	ZINC000819439131	DF	On-Demand	Anodyne	ADRB2	29	43
COC[C@@H](O)CNc1cccc(OCc2ccc(C)cc2)c1	ZINC000819439131	DF	On-Demand	Anodyne	ADRB1	35	43
COC[C@@H](O)CNc1cccc(OCc2ccc(C)cc2)c1	ZINC000819439131	DF	On-Demand	Anodyne	ADRB3	18	40
COC[C@@H](O)CNc1cccc(OCc2ccc(C)cc2)c1	ZINC000819439131	DF	On-Demand	Anodyne	CASR	26	40
CC(C)(C)Cc1nc2cc(NC[C@H](O)c3cccnc3)ccc2o1	ZINC000819439135	EH	On-Demand	Anodyne	ADRB1	19	47
CC(C)(C)Cc1nc2cc(NC[C@H](O)c3cccnc3)ccc2o1	ZINC000819439135	EH	On-Demand	Anodyne	ADRB3	76	47
CC(C)(C)Cc1nc2cc(NC[C@@H](O)c3cccnc3)ccc2o1	ZINC000819439136	EH	On-Demand	Anodyne	ADRB1	19	47
CC(C)(C)Cc1nc2cc(NC[C@@H](O)c3cccnc3)ccc2o1	ZINC000819439136	EH	On-Demand	Anodyne	ADRB3	76	47
O=C(CCNc1ccc(N2CCSCC2)c(Cl)c1)Nc1cccnc1	ZINC000819439168	GH	On-Demand	Anodyne	NPY2R	59	40
CN(C)CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819439184	DF	On-Demand	Anodyne	ADRB2	25	48
CN(C)CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819439184	DF	On-Demand	Anodyne	ADRB1	30	48
CN(C)CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819439184	DF	On-Demand	Anodyne	ADRB3	86	58
CN(C)CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819439184	DF	On-Demand	Anodyne	ESRRG	43	31
CN(C)CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819439185	DF	On-Demand	Anodyne	ADRB2	25	48
CN(C)CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819439185	DF	On-Demand	Anodyne	ADRB1	30	48
CN(C)CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819439185	DF	On-Demand	Anodyne	ADRB3	86	58
CN(C)CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819439185	DF	On-Demand	Anodyne	ESRRG	43	31
O[C@@H](CNc1ccc(N2CCSCC2)c(Cl)c1)c1cccnc1	ZINC000819439186	EG	On-Demand	Anodyne	ADRB3	86	45
O[C@@H](CNc1ccc(N2CCSCC2)c(Cl)c1)c1cccnc1	ZINC000819439186	EG	On-Demand	Anodyne	NPY2R	45	34
O[C@H](CNc1ccc(N2CCSCC2)c(Cl)c1)c1cccnc1	ZINC000819439187	EG	On-Demand	Anodyne	ADRB3	86	45
O[C@H](CNc1ccc(N2CCSCC2)c(Cl)c1)c1cccnc1	ZINC000819439187	EG	On-Demand	Anodyne	NPY2R	45	34
C#CCOc1ccc(NC[C@H](O)COCc2ccccc2Cl)cc1	ZINC000819439188	EG	On-Demand	Mild	ADRB1	23	42
C#CCOc1ccc(NC[C@H](O)COCc2ccccc2Cl)cc1	ZINC000819439188	EG	On-Demand	Mild	ADRB3	15	42
C#CCOc1ccc(NC[C@@H](O)COCc2ccccc2Cl)cc1	ZINC000819439189	EG	On-Demand	Mild	ADRB1	23	42
C#CCOc1ccc(NC[C@@H](O)COCc2ccccc2Cl)cc1	ZINC000819439189	EG	On-Demand	Mild	ADRB3	15	42
CC(=O)Nc1cccc(CC(=O)Nc2cccn(CCS(C)(=O)=O)c2=O)c1	ZINC000819439190	GD	On-Demand	Anodyne	PTGER3	15	50
C#CCOc1cccc(NC[C@@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819439203	EF	On-Demand	Mild	ADRB1	47	39
C#CCOc1cccc(NC[C@H](O)COc2ccc(CC#N)cc2)c1	ZINC000819439204	EF	On-Demand	Mild	ADRB1	47	39
CN(C)CCCOc1ccc(NCCC#N)cc1	ZINC000819439217	BE	On-Demand	Mild	ESRRG	44	41
CN(C)CCCOc1ccc(NC[C@H](O)C(C)(C)C)cc1	ZINC000819439218	CF	On-Demand	Anodyne	ESRRG	44	32
CN(C)CCCOc1ccc(NC[C@@H](O)C(C)(C)C)cc1	ZINC000819439219	CF	On-Demand	Anodyne	ESRRG	44	32
CN(C)CCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819439223	EH	On-Demand	Anodyne	ADRB2	22	53
CN(C)CCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819439223	EH	On-Demand	Anodyne	ADRB1	38	48
CN(C)CCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819439223	EH	On-Demand	Anodyne	ADRB3	52	48
CN(C)CCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819439223	EH	On-Demand	Anodyne	ESRRG	45	33
CN(C)CCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819439224	EH	On-Demand	Anodyne	ADRB2	22	53
CN(C)CCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819439224	EH	On-Demand	Anodyne	ADRB1	38	48
CN(C)CCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819439224	EH	On-Demand	Anodyne	ADRB3	52	48
CN(C)CCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819439224	EH	On-Demand	Anodyne	ESRRG	45	33
C#CCOc1cccc(NC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819439225	FG	On-Demand	Mild	EPHX2	17	46
C#CCOc1cccc(NC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819439226	FG	On-Demand	Mild	EPHX2	17	46
C#CCOc1ccc(NCCC(=O)Nc2cc(OC)c(OC)c(OC)c2)cc1	ZINC000819439233	GG	On-Demand	Mild	ENPP1	60	31
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccccc1SCCC#N	ZINC000819439238	FG	On-Demand	Mild	PAPA1_CARPA	36	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccccc1SCCC#N	ZINC000819439239	FG	On-Demand	Mild	PAPA1_CARPA	36	40
C#CCOc1ccc(NC[C@H](O)COc2c(OC)cccc2OC)cc1	ZINC000819439250	FF	On-Demand	Mild	ADRB2	39	40
C#CCOc1ccc(NC[C@H](O)COc2c(OC)cccc2OC)cc1	ZINC000819439250	FF	On-Demand	Mild	ADRB1	48	39
C#CCOc1ccc(NC[C@H](O)COc2c(OC)cccc2OC)cc1	ZINC000819439250	FF	On-Demand	Mild	ADRB3	19	40
C#CCOc1ccc(NC[C@@H](O)COc2c(OC)cccc2OC)cc1	ZINC000819439251	FF	On-Demand	Mild	ADRB2	39	40
C#CCOc1ccc(NC[C@@H](O)COc2c(OC)cccc2OC)cc1	ZINC000819439251	FF	On-Demand	Mild	ADRB1	48	39
C#CCOc1ccc(NC[C@@H](O)COc2c(OC)cccc2OC)cc1	ZINC000819439251	FF	On-Demand	Mild	ADRB3	19	40
O[C@H](CNc1ccc(N2CCSCC2)c(Cl)c1)COCc1ccccc1	ZINC000819439256	GH	On-Demand	Anodyne	NPY2R	38	41
O[C@@H](CNc1ccc(N2CCSCC2)c(Cl)c1)COCc1ccccc1	ZINC000819439257	GH	On-Demand	Anodyne	NPY2R	38	41
CCCOc1ccc(C(=O)CNC(=O)C(F)=C2CCC2)cc1	ZINC000819439264	DG	On-Demand	Anodyne	PLA2G4B	40	34
C[C@@H](CC#N)Sc1ccccc1NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819439270	GH	On-Demand	Mild	CTSF	53	36
C[C@@H](CC#N)Sc1ccccc1NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819439272	GH	On-Demand	Mild	CTSF	53	36
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1NC(=O)C(C)(C)C	ZINC000819439278	FJ	On-Demand	Anodyne	ADRB1	34	51
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1NC(=O)C(C)(C)C	ZINC000819439278	FJ	On-Demand	Anodyne	ADRB3	52	51
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1NC(=O)C(C)(C)C	ZINC000819439278	FJ	On-Demand	Anodyne	CYP3A4	47	35
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1NC(=O)C(C)(C)C	ZINC000819439279	FJ	On-Demand	Anodyne	ADRB1	34	51
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1NC(=O)C(C)(C)C	ZINC000819439279	FJ	On-Demand	Anodyne	ADRB3	52	51
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1NC(=O)C(C)(C)C	ZINC000819439279	FJ	On-Demand	Anodyne	CYP3A4	47	35
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(Oc2cccc(C#N)c2)cc1	ZINC000819439280	GI	On-Demand	Mild	PFKFB3	45	34
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(Oc2cccc(C#N)c2)cc1	ZINC000819439281	GI	On-Demand	Mild	PFKFB3	45	34
C[C@@H](CC#N)Sc1ccccc1NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819439301	GH	On-Demand	Mild	PAPA1_CARPA	39	42
C[C@@H](CC#N)Sc1ccccc1NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819439303	GH	On-Demand	Mild	PAPA1_CARPA	39	42
Cc1ccc(NC[C@H](O)c2cccnc2)cc1NC(=O)C(C)(C)C	ZINC000819439322	EH	On-Demand	Anodyne	ADRB2	28	43
Cc1ccc(NC[C@H](O)c2cccnc2)cc1NC(=O)C(C)(C)C	ZINC000819439322	EH	On-Demand	Anodyne	ADRB1	29	42
Cc1ccc(NC[C@H](O)c2cccnc2)cc1NC(=O)C(C)(C)C	ZINC000819439322	EH	On-Demand	Anodyne	ADRB3	102	49
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1NC(=O)C(C)(C)C	ZINC000819439323	EH	On-Demand	Anodyne	ADRB2	28	43
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1NC(=O)C(C)(C)C	ZINC000819439323	EH	On-Demand	Anodyne	ADRB1	29	42
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1NC(=O)C(C)(C)C	ZINC000819439323	EH	On-Demand	Anodyne	ADRB3	102	49
C[C@H](NC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)c1ccc[nH]1	ZINC000819439366	GF	On-Demand	Anodyne	SSTR2	55	34
C[C@@H](NC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)c1ccc[nH]1	ZINC000819439367	GF	On-Demand	Anodyne	SSTR2	55	34
C[C@H](NC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)c1ccc[nH]1	ZINC000819439368	GF	On-Demand	Anodyne	SSTR2	55	34
C[C@@H](NC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1)c1ccc[nH]1	ZINC000819439369	GF	On-Demand	Anodyne	SSTR2	55	34
C#CCOc1ccc(NC[C@@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819439370	EG	On-Demand	Mild	ADRB2	19	40
C#CCOc1ccc(NC[C@@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819439370	EG	On-Demand	Mild	ADRB1	34	41
C#CCOc1ccc(NC[C@@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819439370	EG	On-Demand	Mild	ADRB3	21	40
C#CCOc1ccc(NC[C@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819439371	EG	On-Demand	Mild	ADRB2	19	40
C#CCOc1ccc(NC[C@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819439371	EG	On-Demand	Mild	ADRB1	34	41
C#CCOc1ccc(NC[C@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819439371	EG	On-Demand	Mild	ADRB3	21	40
CN(C)CCCOc1ccc(NC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819439372	FG	On-Demand	Anodyne	ESRRG	46	33
CN(C)CCCOc1ccc(NC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819439373	FG	On-Demand	Anodyne	ESRRG	46	33
C#CCOc1ccc(NC[C@H](O)COCc2cccs2)cc1	ZINC000819439375	DF	On-Demand	Mild	ADRB1	18	41
C#CCOc1ccc(NC[C@@H](O)COCc2cccs2)cc1	ZINC000819439376	DF	On-Demand	Mild	ADRB1	18	41
CN(C)CCCOc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819439380	GI	On-Demand	Anodyne	GALR3	47	41
CN(C)CCCOc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819439381	GI	On-Demand	Anodyne	GALR3	47	41
CN(C)CCCOc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819439382	GF	On-Demand	Anodyne	ADRB3	18	42
CN(C)CCCOc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819439383	GF	On-Demand	Anodyne	ADRB3	18	42
C#CCOc1cccc(NC[C@@H](O)CO[C@@H](C)COC)c1	ZINC000819439388	CD	On-Demand	Mild	ADRB2	15	40
C#CCOc1cccc(NC[C@H](O)CO[C@H](C)COC)c1	ZINC000819439389	CD	On-Demand	Mild	ADRB2	15	40
C#CCOc1cccc(NC[C@@H](O)CO[C@H](C)COC)c1	ZINC000819439390	CD	On-Demand	Mild	ADRB2	15	40
C#CCOc1cccc(NC[C@H](O)CO[C@@H](C)COC)c1	ZINC000819439391	CD	On-Demand	Mild	ADRB2	15	40
O[C@H](CNc1ccc(N2CCSCC2)c(Cl)c1)c1ccc(F)cc1	ZINC000819439416	FI	On-Demand	Anodyne	NPY2R	38	43
O[C@@H](CNc1ccc(N2CCSCC2)c(Cl)c1)c1ccc(F)cc1	ZINC000819439417	FI	On-Demand	Anodyne	NPY2R	38	43
C[C@@H](NC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2)c1ccc[nH]1	ZINC000819439419	FH	On-Demand	Anodyne	CNR1	54	33
C[C@H](NC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2)c1ccc[nH]1	ZINC000819439420	FH	On-Demand	Anodyne	CNR1	54	33
CN(C)CCCOc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819439425	GF	On-Demand	Anodyne	NOD2	43	40
CN(C)CCCOc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819439426	GF	On-Demand	Anodyne	NOD2	43	40
O[C@H](CNc1ccc(N2CCSCC2)c(Cl)c1)c1ccccc1F	ZINC000819439439	FI	On-Demand	Anodyne	NPY2R	59	42
O[C@@H](CNc1ccc(N2CCSCC2)c(Cl)c1)c1ccccc1F	ZINC000819439440	FI	On-Demand	Anodyne	NPY2R	59	42
O[C@@H](CNc1ccc(N2CCSCC2)c(Cl)c1)COc1ccccc1	ZINC000819439446	GH	On-Demand	Anodyne	ADRB2	40	41
O[C@@H](CNc1ccc(N2CCSCC2)c(Cl)c1)COc1ccccc1	ZINC000819439446	GH	On-Demand	Anodyne	ADRB1	65	42
O[C@@H](CNc1ccc(N2CCSCC2)c(Cl)c1)COc1ccccc1	ZINC000819439446	GH	On-Demand	Anodyne	ADRB3	45	42
O[C@@H](CNc1ccc(N2CCSCC2)c(Cl)c1)COc1ccccc1	ZINC000819439446	GH	On-Demand	Anodyne	NPY2R	45	38
O[C@H](CNc1ccc(N2CCSCC2)c(Cl)c1)COc1ccccc1	ZINC000819439447	GH	On-Demand	Anodyne	ADRB2	40	41
O[C@H](CNc1ccc(N2CCSCC2)c(Cl)c1)COc1ccccc1	ZINC000819439447	GH	On-Demand	Anodyne	ADRB1	65	42
O[C@H](CNc1ccc(N2CCSCC2)c(Cl)c1)COc1ccccc1	ZINC000819439447	GH	On-Demand	Anodyne	ADRB3	45	42
O[C@H](CNc1ccc(N2CCSCC2)c(Cl)c1)COc1ccccc1	ZINC000819439447	GH	On-Demand	Anodyne	NPY2R	45	38
CN(C)CCCOc1ccc(NC[C@H](O)c2ccccc2Br)cc1	ZINC000819439448	GH	On-Demand	Anodyne	LTA4H	21	40
CN(C)CCCOc1ccc(NC[C@H](O)c2ccccc2Br)cc1	ZINC000819439448	GH	On-Demand	Anodyne	ESRRG	48	34
CN(C)CCCOc1ccc(NC[C@@H](O)c2ccccc2Br)cc1	ZINC000819439449	GH	On-Demand	Anodyne	LTA4H	21	40
CN(C)CCCOc1ccc(NC[C@@H](O)c2ccccc2Br)cc1	ZINC000819439449	GH	On-Demand	Anodyne	ESRRG	48	34
CN(C)CCCOc1ccc(NC[C@@H](O)C(F)(F)F)cc1	ZINC000819439453	DE	On-Demand	Anodyne	ESRRG	43	31
CN(C)CCCOc1ccc(NC[C@H](O)C(F)(F)F)cc1	ZINC000819439454	DE	On-Demand	Anodyne	ESRRG	43	31
C[C@@H](c1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)N1CCOCC1	ZINC000819439493	FH	On-Demand	Anodyne	ADRB1	27	48
C[C@@H](c1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)N1CCOCC1	ZINC000819439493	FH	On-Demand	Anodyne	ADRB3	39	40
C[C@@H](c1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)N1CCOCC1	ZINC000819439493	FH	On-Demand	Anodyne	IGF1R	29	43
C[C@@H](c1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)N1CCOCC1	ZINC000819439493	FH	On-Demand	Anodyne	CYP3A4	49	39
C[C@@H](c1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)N1CCOCC1	ZINC000819439495	FH	On-Demand	Anodyne	ADRB1	27	48
C[C@@H](c1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)N1CCOCC1	ZINC000819439495	FH	On-Demand	Anodyne	ADRB3	39	40
C[C@@H](c1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)N1CCOCC1	ZINC000819439495	FH	On-Demand	Anodyne	IGF1R	29	43
C[C@@H](c1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)N1CCOCC1	ZINC000819439495	FH	On-Demand	Anodyne	CYP3A4	49	39
Cc1ccc(COc2cccc(NC[C@H](O)COC(C)C)c2)cc1	ZINC000819439542	EH	On-Demand	Anodyne	ADRB2	26	44
Cc1ccc(COc2cccc(NC[C@H](O)COC(C)C)c2)cc1	ZINC000819439542	EH	On-Demand	Anodyne	ADRB1	29	44
Cc1ccc(COc2cccc(NC[C@H](O)COC(C)C)c2)cc1	ZINC000819439542	EH	On-Demand	Anodyne	CASR	34	42
Cc1ccc(COc2cccc(NC[C@@H](O)COC(C)C)c2)cc1	ZINC000819439543	EH	On-Demand	Anodyne	ADRB2	26	44
Cc1ccc(COc2cccc(NC[C@@H](O)COC(C)C)c2)cc1	ZINC000819439543	EH	On-Demand	Anodyne	ADRB1	29	44
Cc1ccc(COc2cccc(NC[C@@H](O)COC(C)C)c2)cc1	ZINC000819439543	EH	On-Demand	Anodyne	CASR	34	42
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N(C)CCO)cc2)c1	ZINC000819439557	FD	On-Demand	Anodyne	MTNR1A	27	52
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N(C)CCO)cc2)c1	ZINC000819439557	FD	On-Demand	Anodyne	MTNR1B	33	52
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N(C)CCO)cc2)c1	ZINC000819439557	FD	On-Demand	Anodyne	ACR	16	42
O[C@H](CNc1ccc(N2CCSCC2)c(Cl)c1)c1cccc(F)c1	ZINC000819439562	FI	On-Demand	Anodyne	NPY2R	48	43
O[C@@H](CNc1ccc(N2CCSCC2)c(Cl)c1)c1cccc(F)c1	ZINC000819439563	FI	On-Demand	Anodyne	NPY2R	48	43
CN(C)CCCOc1ccc(NC[C@H](O)c2ccc(Br)cc2)cc1	ZINC000819439566	GH	On-Demand	Anodyne	ESRRG	43	31
CN(C)CCCOc1ccc(NC[C@@H](O)c2ccc(Br)cc2)cc1	ZINC000819439567	GH	On-Demand	Anodyne	ESRRG	43	31
CN(C)CCCOc1ccc(NCCC(=O)Nc2cc(F)cc(F)c2)cc1	ZINC000819439568	GH	On-Demand	Anodyne	LTA4H	43	45
CN(C)CCCOc1ccc(NCCC(=O)Nc2cc(F)cc(F)c2)cc1	ZINC000819439568	GH	On-Demand	Anodyne	MCHR2	22	41
CN(C)CCCOc1ccc(NCC2(O)CCC2)cc1	ZINC000819439578	CE	On-Demand	Anodyne	ESRRG	43	33
CN(C)CCCOc1ccc(NC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819439579	EG	On-Demand	Mild	ESRRG	43	36
CN(C)CCCOc1ccc(NC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819439580	EG	On-Demand	Mild	ESRRG	43	36
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819439585	EH	On-Demand	Anodyne	HTR2A	21	46
O[C@H](CNc1ccc(CCN2CCCC2)cc1)c1ccc(F)cc1F	ZINC000819439586	EH	On-Demand	Anodyne	HTR2A	21	46
CON(C)C(=O)CCNc1ccc(OCCCN(C)C)cc1	ZINC000819439592	DD	On-Demand	Anodyne	LTA4H	25	43
CON(C)C(=O)CCNc1ccc(OCCCN(C)C)cc1	ZINC000819439592	DD	On-Demand	Anodyne	ESRRG	43	32
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819439594	EH	On-Demand	Anodyne	ADRB2	15	43
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819439594	EH	On-Demand	Anodyne	ABCC1	55	34
O[C@H](CNc1ccc(CCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819439595	EH	On-Demand	Anodyne	ADRB2	15	43
O[C@H](CNc1ccc(CCN2CCCC2)cc1)c1ccc(F)c(F)c1	ZINC000819439595	EH	On-Demand	Anodyne	ABCC1	55	34
CN(C)CCCOc1ccc(NCCS(=O)(=O)c2ccc(C#N)cn2)cc1	ZINC000819439608	GE	On-Demand	Mild	USP7	19	40
CN(C)CCCOc1ccc(NCCS(=O)(=O)c2ccc(C#N)cn2)cc1	ZINC000819439608	GE	On-Demand	Mild	USP47	24	40
O=S(=O)(CCNc1ccc(N2CCSCC2)c(Cl)c1)c1ccccc1	ZINC000819439611	GH	On-Demand	Anodyne	NPY2R	50	40
C#CCOc1cccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819439613	EF	On-Demand	Mild	ADRB2	43	43
C#CCOc1cccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819439613	EF	On-Demand	Mild	ADRB1	65	41
C#CCOc1cccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819439613	EF	On-Demand	Mild	ABCB1	18	48
C#CCOc1cccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819439613	EF	On-Demand	Mild	PDS	47	34
C#CCOc1cccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819439614	EF	On-Demand	Mild	ADRB2	43	43
C#CCOc1cccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819439614	EF	On-Demand	Mild	ADRB1	65	41
C#CCOc1cccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819439614	EF	On-Demand	Mild	ABCB1	18	48
C#CCOc1cccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)c1	ZINC000819439614	EF	On-Demand	Mild	PDS	47	34
CN(C)CCCOc1ccc(NCCC(=O)Nc2cccnc2)cc1	ZINC000819439627	EF	On-Demand	Anodyne	LTA4H	45	47
CN(C)CCCOc1ccc(NCCC(=O)Nc2cccnc2)cc1	ZINC000819439627	EF	On-Demand	Anodyne	FAAH	19	41
CN(C)CCCOc1ccc(NC[C@H](O)CN2C(=O)c3ccccc3C2=O)cc1	ZINC000819439628	GE	On-Demand	Anodyne	ESRRG	43	33
CN(C)CCCOc1ccc(NC[C@@H](O)CN2C(=O)c3ccccc3C2=O)cc1	ZINC000819439629	GE	On-Demand	Anodyne	ESRRG	43	33
C#CCNC(=O)CCNc1cccc(OCC#C)c1	ZINC000819439630	CD	On-Demand	Mild	MTNR1A	20	45
CN(C)CCCOc1ccc(NCCC(=O)NC(N)=O)cc1	ZINC000819439639	DD	On-Demand	Anodyne	LTA4H	32	43
CN(C)CCCOc1ccc(NCCC(=O)NC(N)=O)cc1	ZINC000819439639	DD	On-Demand	Anodyne	ESRRG	43	31
C#CCOc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819439644	EF	On-Demand	Mild	ADRB2	34	42
C#CCOc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819439644	EF	On-Demand	Mild	ADRB1	52	42
C#CCOc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819439644	EF	On-Demand	Mild	ADRB3	36	40
C#CCOc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819439645	EF	On-Demand	Mild	ADRB2	34	42
C#CCOc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819439645	EF	On-Demand	Mild	ADRB1	52	42
C#CCOc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819439645	EF	On-Demand	Mild	ADRB3	36	40
OC1(CNc2ccc(N3CCSCC3)c(Cl)c2)CCCC1	ZINC000819439648	EH	On-Demand	Anodyne	NPY2R	40	38
O[C@@H](CNc1ccc(CCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819439660	EH	On-Demand	Anodyne	HTR2A	16	46
O[C@H](CNc1ccc(CCN2CCCC2)cc1)c1cc(F)ccc1F	ZINC000819439661	EH	On-Demand	Anodyne	HTR2A	16	46
C#CCOc1cccc(NC[C@@H](O)COCC)c1	ZINC000819439671	BD	On-Demand	Mild	ADRB2	18	41
C#CCOc1cccc(NC[C@@H](O)COCC)c1	ZINC000819439671	BD	On-Demand	Mild	ADRB1	18	41
C#CCOc1cccc(NC[C@H](O)COCC)c1	ZINC000819439672	BD	On-Demand	Mild	ADRB2	18	41
C#CCOc1cccc(NC[C@H](O)COCC)c1	ZINC000819439672	BD	On-Demand	Mild	ADRB1	18	41
NC(=O)CCNc1ccc(N2CCSCC2)c(Cl)c1	ZINC000819439673	CE	On-Demand	Anodyne	NPY2R	53	41
C#CCOc1cccc(NC[C@H](O)CN2CCN(C)CC2)c1	ZINC000819439674	DC	On-Demand	Mild	ACOX1	45	35
C#CCOc1cccc(NC[C@@H](O)CN2CCN(C)CC2)c1	ZINC000819439675	DC	On-Demand	Mild	ACOX1	45	35
C#CCOc1cccc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)c1	ZINC000819439676	FE	On-Demand	Mild	ADRB1	20	43
C#CCOc1cccc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)c1	ZINC000819439677	FE	On-Demand	Mild	ADRB1	20	43
CN(C)CCCOc1ccc(NC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819439684	FG	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCCOc1ccc(NC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819439685	FG	On-Demand	Anodyne	ESRRG	44	33
CC(C)(O)CNc1ccc(N2CCSCC2)c(Cl)c1	ZINC000819439692	DG	On-Demand	Anodyne	NPY2R	50	43
C#CCOc1cccc(NCCC(=O)Nc2cc(OC)c(Cl)cc2OC)c1	ZINC000819439698	GH	On-Demand	Mild	KCNK3	42	36
C#CCOc1cccc(NC[C@H](O)COc2c(OC)cccc2OC)c1	ZINC000819439706	FF	On-Demand	Mild	ADRB2	29	41
C#CCOc1cccc(NC[C@H](O)COc2c(OC)cccc2OC)c1	ZINC000819439706	FF	On-Demand	Mild	ADRB1	29	41
C#CCOc1cccc(NC[C@@H](O)COc2c(OC)cccc2OC)c1	ZINC000819439708	FF	On-Demand	Mild	ADRB2	29	41
C#CCOc1cccc(NC[C@@H](O)COc2c(OC)cccc2OC)c1	ZINC000819439708	FF	On-Demand	Mild	ADRB1	29	41
CON(C)C(=O)CCNc1ccc(N2CCSCC2)c(Cl)c1	ZINC000819439715	EF	On-Demand	Anodyne	NPY2R	57	39
O=S1(=O)CCC(O)(CNc2ccc(N3CCSCC3)c(Cl)c2)CC1	ZINC000819439717	GE	On-Demand	Anodyne	NPY2R	45	38
Cc1c(F)cccc1NC(=O)CCNc1ccc(OCCCN(C)C)cc1	ZINC000819439720	FH	On-Demand	Anodyne	FAAH	15	40
CC[C@H](O)CNc1ccc(OCCCN(C)C)cc1	ZINC000819439728	CE	On-Demand	Anodyne	ESRRG	44	34
CN(CCO)c1ccc(NC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819439748	FG	On-Demand	Anodyne	MTNR1A	18	44
CN(CCO)c1ccc(NC(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819439748	FG	On-Demand	Anodyne	MTNR1B	23	44
C#CCNC(=O)CCNc1cccc(OCc2cccc(C)c2)c1	ZINC000819439778	DG	On-Demand	Mild	MAOB	28	41
C#CCNC(=O)CCNc1cccc(OCc2cccc(C)c2)c1	ZINC000819439778	DG	On-Demand	Mild	FFAR1	37	41
C#CCNC(=O)CCNc1ccc2oc(CC(C)(C)C)nc2c1	ZINC000819439781	DF	On-Demand	Mild	AGPAT2	28	41
Cc1ccc(COc2cccc(NCC3(O)CCOCC3)c2)cc1	ZINC000819439786	EH	On-Demand	Anodyne	ALOX5	20	43
Cc1ccc(COc2cccc(NCC3(O)CCOCC3)c2)cc1	ZINC000819439786	EH	On-Demand	Anodyne	MAOB	16	40
O=C(O)CCCNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000819439821	EC	On-Demand	Anodyne	EPHX2	15	48
O=C(O)CCCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819439822	EC	On-Demand	Anodyne	HTR1A	117	62
O=C(O)CCCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819439822	EC	On-Demand	Anodyne	DRD2	90	57
O=C(O)CCCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819439822	EC	On-Demand	Anodyne	DRD1	20	41
O=C(O)CCCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819439822	EC	On-Demand	Anodyne	DRD4	70	51
O=C(O)CCCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819439822	EC	On-Demand	Anodyne	ADRA1D	34	45
O=C(O)CCCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819439822	EC	On-Demand	Anodyne	HTR2A	77	55
O=C(O)CCCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819439822	EC	On-Demand	Anodyne	HTR2C	42	51
O=C(O)CCCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819439822	EC	On-Demand	Anodyne	SLC6A4	21	45
O=C(O)CCCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819439822	EC	On-Demand	Anodyne	ADRA1A	48	53
O=C(O)CCCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819439822	EC	On-Demand	Anodyne	ADRA1B	28	53
O=C(O)CCCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819439822	EC	On-Demand	Anodyne	DRD3	117	54
O=C(O)CCCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819439822	EC	On-Demand	Anodyne	DRD5	20	49
O=C(O)CCCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819439822	EC	On-Demand	Anodyne	HTR7	128	50
O=C(O)CCCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819439822	EC	On-Demand	Anodyne	SIGMAR1	19	49
O=C(O)CCCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819439822	EC	On-Demand	Anodyne	CCR3	18	41
O=C(O)CCCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819439822	EC	On-Demand	Anodyne	PLD2	61	37
O=C(O)CCCNC(=O)NCc1ccc(Cl)nc1	ZINC000819439823	CD	On-Demand	Anodyne	NACHRBETA2	28	43
O=C(O)CCCNC(=O)NCCc1nc2ccccc2s1	ZINC000819439824	DE	On-Demand	Anodyne	AKR1B1	25	40
O=C(O)CCCNC(=O)NCCc1nc2ccccc2s1	ZINC000819439824	DE	On-Demand	Anodyne	ST14	46	36
O=C(O)CCCNC(=O)NCCc1nc2ccccc2s1	ZINC000819439824	DE	On-Demand	Anodyne	TMPRSS6	69	36
O=C(O)CCCNC(=O)NCc1ccc(O)cc1	ZINC000819439825	CD	On-Demand	Anodyne	FOLH1	18	41
O=C(O)CCCNC(=O)NCc1ccc(O)cc1	ZINC000819439825	CD	On-Demand	Anodyne	NAALAD2	20	41
O=C(O)CCCNC(=O)NCc1ccc(O)cc1	ZINC000819439825	CD	On-Demand	Anodyne	GRIA1	60	35
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2ccccn2)c1	ZINC000819439832	FD	On-Demand	Anodyne	GRM4	68	50
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2ccccn2)c1	ZINC000819439832	FD	On-Demand	Anodyne	ROCK2	24	42
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2ccccn2)c1	ZINC000819439832	FD	On-Demand	Anodyne	KCNK3	55	52
O=C(O)CCCNC(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000819439833	DD	On-Demand	Anodyne	TBXAS1	44	67
O=C(O)CCCNC(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000819439833	DD	On-Demand	Anodyne	NOS2	62	34
O=C(O)CCCNC(=O)NCCNc1nc2ccccc2s1	ZINC000819439836	DD	On-Demand	Anodyne	CSNK1D	28	48
O=C(O)CCCNC(=O)NCCNc1nc2ccccc2s1	ZINC000819439836	DD	On-Demand	Anodyne	ST14	51	37
O=C(O)CCCNC(=O)NCCNc1nc2ccccc2s1	ZINC000819439836	DD	On-Demand	Anodyne	TMPRSS6	81	37
O=C(O)CCCNC(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000819439837	ED	On-Demand	Anodyne	HRH2	24	47
O=C(O)CCCNC(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000819439837	ED	On-Demand	Anodyne	SIGMAR1	20	42
O=C(O)CCCNC(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000819439837	ED	On-Demand	Anodyne	DPOL_VZVD	24	44
O=C(O)CCCNC(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000819439837	ED	On-Demand	Anodyne	NPFFR1	41	38
O=C(O)CCCNC(=O)NCc1ccc(N2CCC(CO)CC2)cc1	ZINC000819439838	ED	On-Demand	Clean	CCR3	21	48
O=C(O)CCCNC(=O)NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12	ZINC000819439839	FG	On-Demand	Anodyne	CCKAR	57	38
O=C(O)CCCNC(=O)NC[C@H](c1ccccc1)c1c[nH]c2ccccc12	ZINC000819439840	FG	On-Demand	Anodyne	CCKAR	57	38
O=C(O)CCCNC(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000819439841	ED	On-Demand	Anodyne	HRH2	37	53
O=C(O)CCCNC(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000819439841	ED	On-Demand	Anodyne	CHRM3	18	40
O=C(O)CCCNC(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000819439841	ED	On-Demand	Anodyne	NPFFR1	41	37
O=C(O)CCCNC(=O)NCc1ccc(Oc2cccnc2)c(F)c1	ZINC000819439843	EF	On-Demand	Anodyne	TBXAS1	72	40
O=C(O)CCCNC(=O)NCc1ccc(Oc2cccnc2)c(F)c1	ZINC000819439843	EF	On-Demand	Anodyne	NAMPT	24	41
O=C(O)CCCNC(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC000819439844	EF	On-Demand	Anodyne	LTA4H	15	40
O=C(O)CCCNC(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC000819439844	EF	On-Demand	Anodyne	PDS	44	34
O=C(O)CCCNC(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000819439845	DD	On-Demand	Clean	STAT6	51	37
O=C(O)CCCNC(=O)NCc1cc(-c2ccccc2)no1	ZINC000819439847	DE	On-Demand	Anodyne	HDAC10	15	41
O=C(O)CCCNC(=O)NCCc1cc2ccccc2[nH]1	ZINC000819439848	CD	On-Demand	Anodyne	CCKAR	15	41
O=C(O)CCCNC(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000819439849	DC	On-Demand	Anodyne	TBXAS1	30	49
O=C(O)CCCNC(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000819439849	DC	On-Demand	Anodyne	NOS2	85	34
O=C(O)CCCNC(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000819439849	DC	On-Demand	Anodyne	NAMPT	18	59
O=C(O)CCCNC(=O)NCc1cccc(N2CC=CC2)c1	ZINC000819439855	DD	On-Demand	Anodyne	HRH2	18	42
O=C(O)CCCNC(=O)NCc1ccc(N2CCCC2)cc1	ZINC000819439856	DD	On-Demand	Clean	HRH2	17	44
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2ccncc2)c1	ZINC000819439858	FD	On-Demand	Anodyne	ROCK2	34	44
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2ccncc2)c1	ZINC000819439858	FD	On-Demand	Anodyne	KCNK3	88	52
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2ccncc2)c1	ZINC000819439858	FD	On-Demand	Anodyne	KCNK9	40	37
O=C(O)CCCNC(=O)NC[C@@H]1CC1(Cl)Cl	ZINC000819439859	CD	On-Demand	Anodyne	EPHX2	17	51
O=C(O)CCCNC(=O)NC[C@H]1CC1(Cl)Cl	ZINC000819439860	CD	On-Demand	Anodyne	EPHX2	17	51
O=C(O)CCCNC(=O)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000819439864	FD	On-Demand	Anodyne	ADRB3	17	42
O=C(O)CCCNC(=O)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000819439864	FD	On-Demand	Anodyne	TBXA2R	53	43
O=C(O)CCCNC(=O)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000819439864	FD	On-Demand	Anodyne	TBXAS1	110	45
O=C(O)CCCNC(=O)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000819439864	FD	On-Demand	Anodyne	ROCK2	19	43
O=C(O)CCCNC(=O)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000819439864	FD	On-Demand	Anodyne	NAMPT	97	52
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000819439867	FF	On-Demand	Anodyne	FOLH1	15	45
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000819439867	FF	On-Demand	Anodyne	ROCK2	23	45
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000819439867	FF	On-Demand	Anodyne	HDAC1	20	40
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000819439867	FF	On-Demand	Anodyne	HDAC6	15	41
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000819439867	FF	On-Demand	Anodyne	EPHX2	17	53
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000819439867	FF	On-Demand	Anodyne	KCNK3	125	47
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000819439867	FF	On-Demand	Anodyne	KCNK9	77	44
O=C(O)CCCNC(=O)NCc1ccc(-n2cnc3ccccc32)cc1	ZINC000819439868	FF	On-Demand	Anodyne	F9	31	44
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000819439869	FF	On-Demand	Anodyne	FOLH1	15	42
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000819439869	FF	On-Demand	Anodyne	CCR3	39	42
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000819439869	FF	On-Demand	Anodyne	ROCK2	24	42
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000819439869	FF	On-Demand	Anodyne	KCNK3	98	53
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000819439869	FF	On-Demand	Anodyne	KCNK9	66	36
O=C(O)CCCNC(=O)NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1	ZINC000819439870	FF	On-Demand	Anodyne	FOLH1	19	47
O=C(O)CCCNC(=O)NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1	ZINC000819439870	FF	On-Demand	Anodyne	CCR3	22	44
O=C(O)CCCNC(=O)NCc1ccccc1CO	ZINC000819439871	CC	On-Demand	Anodyne	MME	15	45
O=C(O)CCCNC(=O)NCc1ccccc1CO	ZINC000819439871	CC	On-Demand	Anodyne	FURIN	40	32
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2cccc(F)c2)c1	ZINC000819439874	FF	On-Demand	Anodyne	ROCK2	22	44
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2cccc(F)c2)c1	ZINC000819439874	FF	On-Demand	Anodyne	KCNK3	100	54
O=C(O)CCCNC(=O)NCc1cccc(NC(=O)c2cccc(F)c2)c1	ZINC000819439874	FF	On-Demand	Anodyne	KCNK9	50	48
O=C(O)CCCNC(=O)NCc1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000819439877	FF	On-Demand	Anodyne	FOLH1	19	47
O=C(O)CCCNC(=O)NCc1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000819439877	FF	On-Demand	Anodyne	CCR3	22	44
O=C(O)CCCNC(=O)NCCN1Cc2ccccc2C1	ZINC000819439879	CD	On-Demand	Anodyne	HTR1A	22	43
O=C(O)CCCNC(=O)NCCN1Cc2ccccc2C1	ZINC000819439879	CD	On-Demand	Anodyne	DRD3	36	46
O=C(O)CCCNC(=O)NCCN1Cc2ccccc2C1	ZINC000819439879	CD	On-Demand	Anodyne	HTR7	31	43
O=C(O)CCCNC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000819439885	DE	On-Demand	Anodyne	MME	22	46
O=C(O)CCCNC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000819439885	DE	On-Demand	Anodyne	TBXA2R	47	40
O=C(O)CCCNC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000819439885	DE	On-Demand	Anodyne	TBXAS1	100	45
O=C(O)CCCNC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000819439885	DE	On-Demand	Anodyne	PTAFR	15	47
O=C(O)CCCNC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000819439885	DE	On-Demand	Anodyne	NAMPT	61	49
O=C(O)CCCNC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000819439885	DE	On-Demand	Anodyne	SUCNR1	30	40
O=C(O)CCCNC(=O)NCc1ccc(NC(=O)c2ccncc2)cc1	ZINC000819439887	FD	On-Demand	Anodyne	ROCK2	18	49
O=C(O)CCCNC(=O)NCc1ccc(NC(=O)c2ccncc2)cc1	ZINC000819439887	FD	On-Demand	Anodyne	NAMPT	50	40
O=C(O)CCCNC(=O)NCc1ccc(NC(=O)c2ccncc2)cc1	ZINC000819439887	FD	On-Demand	Anodyne	KCNK3	25	43
O=C(O)CCCNC(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000819439888	ED	On-Demand	Anodyne	ACHE	16	42
O=C(O)CCCNC(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000819439888	ED	On-Demand	Anodyne	HRH2	18	41
O=C(O)CCCNC(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000819439888	ED	On-Demand	Anodyne	SIGMAR1	29	45
O=C(O)CCCNC(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000819439888	ED	On-Demand	Anodyne	CCR3	25	46
O=C(O)CCCNC(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000819439888	ED	On-Demand	Anodyne	EPHX2	15	43
O=C(O)CCCNC(=O)NCc1ccc(Oc2cccc(F)c2)nc1	ZINC000819439889	EF	On-Demand	Anodyne	PDS	36	40
O=C(O)CCCNC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819439894	ED	On-Demand	Anodyne	PREP	17	43
O=C(O)CCCNC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819439894	ED	On-Demand	Anodyne	FURIN	47	34
O=C(O)CCCNC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819439894	ED	On-Demand	Anodyne	MLYCD	18	40
O=C(O)CCCNC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819439894	ED	On-Demand	Anodyne	L3MBTL3	71	41
O=C(O)CCCNC(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1	ZINC000819439895	FD	On-Demand	Clean	CCR3	22	42
O=C(O)CCCNC(=O)NCc1ccccc1CN1CCOCC1	ZINC000819439897	ED	On-Demand	Anodyne	HRH2	19	41
O=C(O)CCCNC(=O)NCc1ccccc1CN1CCOCC1	ZINC000819439897	ED	On-Demand	Anodyne	EPHX2	25	41
O=C(O)CCCNC(=O)NCc1ccc(-c2nc3ccccc3s2)o1	ZINC000819439898	FG	On-Demand	Anodyne	TMPRSS6	50	34
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439902	EE	On-Demand	Anodyne	ACE	24	41
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439902	EE	On-Demand	Anodyne	MME	17	41
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439903	EE	On-Demand	Anodyne	ACE	24	41
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439903	EE	On-Demand	Anodyne	MME	17	41
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439904	EE	On-Demand	Anodyne	ACE	24	41
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439904	EE	On-Demand	Anodyne	MME	17	41
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439905	EE	On-Demand	Anodyne	ACE	24	41
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439905	EE	On-Demand	Anodyne	MME	17	41
COC(=O)CCCOc1ccc(NC[C@@H](O)c2ccccc2F)cc1	ZINC000819439910	EG	On-Demand	Anodyne	LTA4H	24	42
COC(=O)CCCOc1ccc(NC[C@@H](O)c2ccccc2F)cc1	ZINC000819439910	EG	On-Demand	Anodyne	FAAH	18	41
COC(=O)CCCOc1ccc(NC[C@H](O)c2ccccc2F)cc1	ZINC000819439911	EG	On-Demand	Anodyne	LTA4H	24	42
COC(=O)CCCOc1ccc(NC[C@H](O)c2ccccc2F)cc1	ZINC000819439911	EG	On-Demand	Anodyne	FAAH	18	41
CN(C)CCCOc1cccc(NC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819439928	GI	On-Demand	Anodyne	NR1H3	20	40
CN(C)CCCOc1cccc(NC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819439928	GI	On-Demand	Anodyne	NR1H2	17	40
CN(C)CCCOc1cccc(NC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819439928	GI	On-Demand	Anodyne	NEK2	17	41
CN(C)CCCOc1cccc(NC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819439929	GI	On-Demand	Anodyne	NR1H3	20	40
CN(C)CCCOc1cccc(NC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819439929	GI	On-Demand	Anodyne	NR1H2	17	40
CN(C)CCCOc1cccc(NC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819439929	GI	On-Demand	Anodyne	NEK2	17	41
CN(C)CCCOc1cccc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819439930	FG	On-Demand	Bother	ACR	16	44
CN(C)CCCOc1cccc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819439931	FG	On-Demand	Bother	ACR	16	44
COC(=O)CCCOc1ccc(NCCC#N)cc1	ZINC000819439932	CE	On-Demand	Mild	LTA4H	17	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439938	GE	On-Demand	Anodyne	ACE	29	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439938	GE	On-Demand	Anodyne	CELA1	22	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439938	GE	On-Demand	Anodyne	MME	19	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439938	GE	On-Demand	Anodyne	CMA1	30	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439938	GE	On-Demand	Anodyne	CCKAR	24	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439939	GE	On-Demand	Anodyne	ACE	29	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439939	GE	On-Demand	Anodyne	CELA1	22	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439939	GE	On-Demand	Anodyne	MME	19	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439939	GE	On-Demand	Anodyne	CMA1	30	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439939	GE	On-Demand	Anodyne	CCKAR	24	45
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439944	GE	On-Demand	Anodyne	PRSS1	18	40
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439944	GE	On-Demand	Anodyne	ACE	38	42
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439944	GE	On-Demand	Anodyne	TSHR	58	34
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439944	GE	On-Demand	Anodyne	DRD4	21	40
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439944	GE	On-Demand	Anodyne	ACHE	17	43
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439944	GE	On-Demand	Anodyne	F10	28	46
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439944	GE	On-Demand	Anodyne	MME	24	42
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439944	GE	On-Demand	Anodyne	SIGMAR1	25	43
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439944	GE	On-Demand	Anodyne	NPY1R	31	45
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439944	GE	On-Demand	Anodyne	CCKAR	41	38
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439944	GE	On-Demand	Anodyne	CCKBR	61	38
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439944	GE	On-Demand	Anodyne	MCHR1	31	40
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439945	GE	On-Demand	Anodyne	PRSS1	18	40
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439945	GE	On-Demand	Anodyne	ACE	38	42
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439945	GE	On-Demand	Anodyne	TSHR	58	34
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439945	GE	On-Demand	Anodyne	DRD4	21	40
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439945	GE	On-Demand	Anodyne	ACHE	17	43
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439945	GE	On-Demand	Anodyne	F10	28	46
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439945	GE	On-Demand	Anodyne	MME	24	42
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439945	GE	On-Demand	Anodyne	SIGMAR1	25	43
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439945	GE	On-Demand	Anodyne	NPY1R	31	45
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439945	GE	On-Demand	Anodyne	CCKAR	41	38
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439945	GE	On-Demand	Anodyne	CCKBR	61	38
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)c1	ZINC000819439945	GE	On-Demand	Anodyne	MCHR1	31	40
COC(=O)CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819439946	EF	On-Demand	Anodyne	ADRB2	33	47
COC(=O)CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819439946	EF	On-Demand	Anodyne	ADRB1	39	47
COC(=O)CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819439946	EF	On-Demand	Anodyne	ADRB3	105	55
COC(=O)CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819439946	EF	On-Demand	Anodyne	TBXAS1	16	40
COC(=O)CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819439946	EF	On-Demand	Anodyne	KCNA5	18	40
COC(=O)CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819439946	EF	On-Demand	Anodyne	FAAH	16	43
COC(=O)CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819439946	EF	On-Demand	Anodyne	CYP26A1	52	33
COC(=O)CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819439947	EF	On-Demand	Anodyne	ADRB2	33	47
COC(=O)CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819439947	EF	On-Demand	Anodyne	ADRB1	39	47
COC(=O)CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819439947	EF	On-Demand	Anodyne	ADRB3	105	55
COC(=O)CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819439947	EF	On-Demand	Anodyne	TBXAS1	16	40
COC(=O)CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819439947	EF	On-Demand	Anodyne	KCNA5	18	40
COC(=O)CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819439947	EF	On-Demand	Anodyne	FAAH	16	43
COC(=O)CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819439947	EF	On-Demand	Anodyne	CYP26A1	52	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CCCN(Cc3ccccc3)C1=O)C2	ZINC000819439953	GE	On-Demand	Anodyne	BIRC2	47	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1CCCN(Cc3ccccc3)C1=O)C2	ZINC000819439954	GE	On-Demand	Anodyne	BIRC2	47	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CCCN(Cc3ccccc3)C1=O)C2	ZINC000819439955	GE	On-Demand	Anodyne	BIRC2	47	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H]1CCCN(Cc3ccccc3)C1=O)C2	ZINC000819439956	GE	On-Demand	Anodyne	BIRC2	47	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(c2ncccc2F)CC1	ZINC000819439959	FD	On-Demand	Anodyne	TRPV1	16	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(c2ncccc2F)CC1	ZINC000819439959	FD	On-Demand	Anodyne	PRKCQ	40	30
C=C(C)C(C)(C)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439972	DF	On-Demand	Mild	ACE	39	44
C=C(C)C(C)(C)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439972	DF	On-Demand	Mild	MME	24	44
C=C(C)C(C)(C)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439973	DF	On-Demand	Mild	ACE	39	44
C=C(C)C(C)(C)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819439973	DF	On-Demand	Mild	MME	24	44
COC(=O)CCCOc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819439991	EG	On-Demand	Anodyne	ADRB2	19	42
COC(=O)CCCOc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819439991	EG	On-Demand	Anodyne	ADRB1	26	42
COC(=O)CCCOc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819439991	EG	On-Demand	Anodyne	ADRB3	36	42
COC(=O)CCCOc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819439992	EG	On-Demand	Anodyne	ADRB2	19	42
COC(=O)CCCOc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819439992	EG	On-Demand	Anodyne	ADRB1	26	42
COC(=O)CCCOc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819439992	EG	On-Demand	Anodyne	ADRB3	36	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ncccc3F)CC1)C2	ZINC000819440014	GD	On-Demand	Anodyne	NPBWR1	42	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ncccc3F)CC1)C2	ZINC000819440015	GD	On-Demand	Anodyne	NPBWR1	42	31
COC(=O)CCCOc1ccc(NC[C@@H](C)S(C)(=O)=O)cc1	ZINC000819440017	ED	On-Demand	Anodyne	LTA4H	23	40
COC(=O)CCCOc1ccc(NC[C@H](C)S(C)(=O)=O)cc1	ZINC000819440018	ED	On-Demand	Anodyne	LTA4H	23	40
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc(Oc2ccncc2)c1	ZINC000819440030	FH	On-Demand	Anodyne	RAF1	20	43
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc(Oc2ccncc2)c1	ZINC000819440032	FH	On-Demand	Anodyne	RAF1	20	43
C=C(C)C(C)(C)C(=O)Nc1cccc(-c2cn[nH]c2)c1	ZINC000819440033	CH	On-Demand	Mild	ROCK2	87	39
C=C(C)C(C)(C)C(=O)Nc1cccc(-c2cn[nH]c2)c1	ZINC000819440033	CH	On-Demand	Mild	MELK	15	41
C=C(C)C(C)(C)C(=O)Nc1cccc(-c2cn[nH]c2)c1	ZINC000819440033	CH	On-Demand	Mild	RIPK1	49	41
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc(Oc2cccc(C#N)c2)cc1	ZINC000819440045	GI	On-Demand	Mild	PFKFB3	55	32
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc(Oc2cccc(C#N)c2)cc1	ZINC000819440047	GI	On-Demand	Mild	PFKFB3	55	32
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(-c2cn[nH]c2)c1	ZINC000819440053	CF	On-Demand	Anodyne	ROCK2	61	38
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(-c2cn[nH]c2)c1	ZINC000819440054	CF	On-Demand	Anodyne	ROCK2	61	38
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(-c2cn[nH]c2)c1	ZINC000819440055	CF	On-Demand	Anodyne	ROCK2	61	38
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(-c2cn[nH]c2)c1	ZINC000819440057	CF	On-Demand	Anodyne	ROCK2	61	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)C[C@H](C)Cc1ccc(OC)cc1)C2	ZINC000819440065	GG	On-Demand	Anodyne	PSMB8	47	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)C[C@@H](C)Cc1ccc(OC)cc1)C2	ZINC000819440067	GG	On-Demand	Anodyne	PSMB8	47	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)C[C@@H](C)Cc1ccc(OC)cc1)C2	ZINC000819440069	GG	On-Demand	Anodyne	PSMB8	47	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)C[C@H](C)Cc1ccc(OC)cc1)C2	ZINC000819440071	GG	On-Demand	Anodyne	PSMB8	47	34
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819440080	DF	On-Demand	Anodyne	PRSS1	15	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819440080	DF	On-Demand	Anodyne	ACE	46	45
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819440080	DF	On-Demand	Anodyne	MME	28	45
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819440082	DF	On-Demand	Anodyne	PRSS1	15	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819440082	DF	On-Demand	Anodyne	ACE	46	45
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)C(F)=C1CCC1	ZINC000819440082	DF	On-Demand	Anodyne	MME	28	45
CN(C)CCCOc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819440091	DF	On-Demand	Anodyne	ADRB2	21	42
CN(C)CCCOc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819440091	DF	On-Demand	Anodyne	ADRB1	27	42
CN(C)CCCOc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819440091	DF	On-Demand	Anodyne	ADRB3	71	49
CN(C)CCCOc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819440092	DF	On-Demand	Anodyne	ADRB2	21	42
CN(C)CCCOc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819440092	DF	On-Demand	Anodyne	ADRB1	27	42
CN(C)CCCOc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819440092	DF	On-Demand	Anodyne	ADRB3	71	49
COC(=O)CCCOc1ccc(NCCS(C)(=O)=O)cc1	ZINC000819440096	DD	On-Demand	Anodyne	LTA4H	21	42
COC(=O)CCCOc1ccc(NCCS(C)(=O)=O)cc1	ZINC000819440096	DD	On-Demand	Anodyne	PLA2G4B	40	35
Cc1ccc(COc2cccc(NC[C@H](O)CN3CCN(C)CC3)c2)cc1	ZINC000819440097	FF	On-Demand	Anodyne	ACOX1	60	38
Cc1ccc(COc2cccc(NC[C@H](O)CN3CCN(C)CC3)c2)cc1	ZINC000819440097	FF	On-Demand	Anodyne	ABCB1	43	36
Cc1ccc(COc2cccc(NC[C@@H](O)CN3CCN(C)CC3)c2)cc1	ZINC000819440099	FF	On-Demand	Anodyne	ACOX1	60	38
Cc1ccc(COc2cccc(NC[C@@H](O)CN3CCN(C)CC3)c2)cc1	ZINC000819440099	FF	On-Demand	Anodyne	ABCB1	43	36
O=S1(=O)CCCN1c1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1F	ZINC000819440126	GG	On-Demand	Anodyne	ADRB1	26	41
O=S1(=O)CCCN1c1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1F	ZINC000819440126	GG	On-Demand	Anodyne	ADRB3	40	41
O=S1(=O)CCCN1c1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1F	ZINC000819440126	GG	On-Demand	Anodyne	CYP3A4	47	35
O=S1(=O)CCCN1c1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1F	ZINC000819440127	GG	On-Demand	Anodyne	ADRB1	26	41
O=S1(=O)CCCN1c1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1F	ZINC000819440127	GG	On-Demand	Anodyne	ADRB3	40	41
O=S1(=O)CCCN1c1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1F	ZINC000819440127	GG	On-Demand	Anodyne	CYP3A4	47	35
C=CCCn1cc(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)nn1	ZINC000819440136	FD	On-Demand	Mild	PRSS1	19	40
C=CCCn1cc(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)nn1	ZINC000819440138	FD	On-Demand	Mild	PRSS1	19	40
COC(=O)CCCOc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819440144	FH	On-Demand	Anodyne	ADRB2	18	40
COC(=O)CCCOc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819440144	FH	On-Demand	Anodyne	ADRB1	20	40
COC(=O)CCCOc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819440144	FH	On-Demand	Anodyne	ADRB3	25	40
O=C(C(F)=C1CCC1)N1CCc2ccc(Cl)cc2C1	ZINC000819440169	CH	On-Demand	Anodyne	HDAC6	36	41
COC(=O)CCCOc1ccc(NC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819440175	EG	On-Demand	Anodyne	LTA4H	16	44
COC(=O)CCCOc1ccc(NC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819440175	EG	On-Demand	Anodyne	FAAH	17	46
COC(=O)CCCOc1ccc(NC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819440177	EG	On-Demand	Anodyne	LTA4H	16	44
COC(=O)CCCOc1ccc(NC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819440177	EG	On-Demand	Anodyne	FAAH	17	46
O[C@H](CNc1ccc(OCC2CC2)cc1)c1ccccc1	ZINC000819440190	CH	On-Demand	Anodyne	LTA4H	21	41
O[C@@H](CNc1ccc(OCC2CC2)cc1)c1ccccc1	ZINC000819440192	CH	On-Demand	Anodyne	LTA4H	21	41
C[C@@H](c1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1)N1CCOCC1	ZINC000819440218	GI	On-Demand	Anodyne	EPHX2	16	40
C[C@@H](c1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1)N1CCOCC1	ZINC000819440222	GI	On-Demand	Anodyne	EPHX2	16	40
CON(C)C(=O)CCNc1cccc(Oc2ccncc2)c1	ZINC000819440232	DF	On-Demand	Anodyne	KCNQ2	20	40
CON(C)C(=O)CCNc1cccc(Oc2ccncc2)c1	ZINC000819440232	DF	On-Demand	Anodyne	RAF1	26	50
COC(=O)CCCOc1ccc(NCC2(O)CCCC2)cc1	ZINC000819440299	DF	On-Demand	Anodyne	LTA4H	17	40
COC(=O)CCCOc1ccc(NCCC(N)=O)cc1	ZINC000819440304	CD	On-Demand	Anodyne	LTA4H	25	43
COC(=O)CCCOc1ccc(NCCC(N)=O)cc1	ZINC000819440304	CD	On-Demand	Anodyne	PLA2G4B	50	33
COC(=O)CCCOc1ccc(NCCC(N)=O)cc1	ZINC000819440304	CD	On-Demand	Anodyne	ACR	30	40
COC(=O)CCCOc1ccc(NCCC(N)=O)cc1	ZINC000819440304	CD	On-Demand	Anodyne	PPO2	17	40
O=C(CCNc1ccc(OCC2CC2)cc1)Nc1cccnc1	ZINC000819440313	DG	On-Demand	Anodyne	GRIN2B	20	41
O=C(Cc1nsc2ccccc12)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440321	GG	On-Demand	Anodyne	ACE	26	41
O=C(Cc1nsc2ccccc12)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440321	GG	On-Demand	Anodyne	DRD2	15	42
O=C(Cc1nsc2ccccc12)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440321	GG	On-Demand	Anodyne	HTR2A	21	42
O=C(Cc1nsc2ccccc12)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440321	GG	On-Demand	Anodyne	MME	18	41
O=C(Cc1nsc2ccccc12)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440323	GG	On-Demand	Anodyne	ACE	26	41
O=C(Cc1nsc2ccccc12)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440323	GG	On-Demand	Anodyne	DRD2	15	42
O=C(Cc1nsc2ccccc12)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440323	GG	On-Demand	Anodyne	HTR2A	21	42
O=C(Cc1nsc2ccccc12)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440323	GG	On-Demand	Anodyne	MME	18	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc(OCC3CC3)cc2)CC1	ZINC000819440326	GH	On-Demand	Anodyne	MMP13	16	47
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc(OCC3CC3)cc2)CC1	ZINC000819440326	GH	On-Demand	Anodyne	GPR119	60	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc(OCC3CC3)cc2)CC1	ZINC000819440328	GH	On-Demand	Anodyne	MMP13	16	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc(OCC3CC3)cc2)CC1	ZINC000819440328	GH	On-Demand	Anodyne	GPR119	60	44
COC(=O)CCCOc1ccc(NC[C@H](O)c2ccc(C)cc2)cc1	ZINC000819440333	EG	On-Demand	Anodyne	ADRB2	22	40
COC(=O)CCCOc1ccc(NC[C@@H](O)c2ccc(C)cc2)cc1	ZINC000819440335	EG	On-Demand	Anodyne	ADRB2	22	40
COC(=O)CCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819440337	EG	On-Demand	Anodyne	ADRB2	30	46
COC(=O)CCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819440337	EG	On-Demand	Anodyne	ADRB1	40	43
COC(=O)CCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819440337	EG	On-Demand	Anodyne	ADRB3	44	43
COC(=O)CCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819440337	EG	On-Demand	Anodyne	LTA4H	46	47
COC(=O)CCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819440337	EG	On-Demand	Anodyne	PLA2G4B	69	35
COC(=O)CCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819440337	EG	On-Demand	Anodyne	FAAH	26	42
COC(=O)CCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819440339	EG	On-Demand	Anodyne	ADRB2	30	46
COC(=O)CCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819440339	EG	On-Demand	Anodyne	ADRB1	40	43
COC(=O)CCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819440339	EG	On-Demand	Anodyne	ADRB3	44	43
COC(=O)CCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819440339	EG	On-Demand	Anodyne	LTA4H	46	47
COC(=O)CCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819440339	EG	On-Demand	Anodyne	PLA2G4B	69	35
COC(=O)CCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819440339	EG	On-Demand	Anodyne	FAAH	26	42
CN(C)CCCOc1cccc(NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819440344	EH	On-Demand	Anodyne	UTS2	48	35
C=CCC1(C(=O)Nc2cccc(-n3c(C)nnc3S)c2)CCOCC1	ZINC000819440353	FG	On-Demand	Mild	LIMK2	16	43
COC(=O)CCCOc1ccc(NC[C@H](O)c2ccccc2C)cc1	ZINC000819440359	EG	On-Demand	Anodyne	ADRB2	15	41
COC(=O)CCCOc1ccc(NC[C@H](O)c2ccccc2C)cc1	ZINC000819440359	EG	On-Demand	Anodyne	LTA4H	25	42
COC(=O)CCCOc1ccc(NC[C@@H](O)c2ccccc2C)cc1	ZINC000819440361	EG	On-Demand	Anodyne	ADRB2	15	41
COC(=O)CCCOc1ccc(NC[C@@H](O)c2ccccc2C)cc1	ZINC000819440361	EG	On-Demand	Anodyne	LTA4H	25	42
CON(C)C(=O)CCNc1cccc(OCCCN(C)C)c1	ZINC000819440404	DD	On-Demand	Anodyne	MTNR1A	22	41
CON(C)C(=O)CCNc1cccc(OCCCN(C)C)c1	ZINC000819440404	DD	On-Demand	Anodyne	MTNR1B	23	41
COC(=O)CCCOc1ccc(NCC2(O)CCOCC2)cc1	ZINC000819440406	DD	On-Demand	Anodyne	MMP13	19	45
COC(=O)CCCOc1ccc(NCC2(O)CCOCC2)cc1	ZINC000819440406	DD	On-Demand	Anodyne	EPHX2	16	42
C=CCC1(C(=O)Nc2cccc(-c3cn[nH]c3)c2)CCOCC1	ZINC000819440413	DG	On-Demand	Mild	ROCK2	64	39
C=CCC1(C(=O)Nc2cccc(-c3cn[nH]c3)c2)CCOCC1	ZINC000819440413	DG	On-Demand	Mild	LIMK2	21	43
CCC1(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCOCC1	ZINC000819440423	FF	On-Demand	Mild	PAPA1_CARPA	38	51
CCC1(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCOCC1	ZINC000819440424	FF	On-Demand	Mild	PAPA1_CARPA	38	51
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(-c3cn[nH]c3)c1)C2	ZINC000819440435	FF	On-Demand	Anodyne	ROCK2	81	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(-c3cn[nH]c3)c1)C2	ZINC000819440436	FF	On-Demand	Anodyne	ROCK2	81	39
COC(=O)CCCOc1ccc(NC[C@](C)(O)C(F)(F)F)cc1	ZINC000819440438	EF	On-Demand	Anodyne	LTA4H	18	40
COC(=O)CCCOc1ccc(NC[C@@](C)(O)C(F)(F)F)cc1	ZINC000819440439	EF	On-Demand	Anodyne	LTA4H	18	40
O[C@@H](CNc1ccc(OCC2CC2)cc1)c1cccnc1	ZINC000819440447	CG	On-Demand	Anodyne	ADRB2	25	44
O[C@@H](CNc1ccc(OCC2CC2)cc1)c1cccnc1	ZINC000819440447	CG	On-Demand	Anodyne	ADRB1	31	45
O[C@@H](CNc1ccc(OCC2CC2)cc1)c1cccnc1	ZINC000819440447	CG	On-Demand	Anodyne	ADRB3	91	48
O[C@H](CNc1ccc(OCC2CC2)cc1)c1cccnc1	ZINC000819440448	CG	On-Demand	Anodyne	ADRB2	25	44
O[C@H](CNc1ccc(OCC2CC2)cc1)c1cccnc1	ZINC000819440448	CG	On-Demand	Anodyne	ADRB1	31	45
O[C@H](CNc1ccc(OCC2CC2)cc1)c1cccnc1	ZINC000819440448	CG	On-Demand	Anodyne	ADRB3	91	48
C[C@@H]1CCCC[C@H]1C(=O)Nc1cccc(-c2cn[nH]c2)c1	ZINC000819440463	CH	On-Demand	Anodyne	ROCK1	42	37
C[C@@H]1CCCC[C@H]1C(=O)Nc1cccc(-c2cn[nH]c2)c1	ZINC000819440463	CH	On-Demand	Anodyne	ROCK2	96	43
C[C@@H]1CCCC[C@@H]1C(=O)Nc1cccc(-c2cn[nH]c2)c1	ZINC000819440465	CH	On-Demand	Anodyne	ROCK1	42	37
C[C@@H]1CCCC[C@@H]1C(=O)Nc1cccc(-c2cn[nH]c2)c1	ZINC000819440465	CH	On-Demand	Anodyne	ROCK2	96	43
CN(C)CCCOc1cccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819440470	GF	On-Demand	Anodyne	ADRB3	23	45
CN(C)CCCOc1cccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819440472	GF	On-Demand	Anodyne	ADRB3	23	45
O=S(=O)(Cc1cccc(NC[C@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819440484	FG	On-Demand	Anodyne	ADRB2	25	40
O=S(=O)(Cc1cccc(NC[C@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819440484	FG	On-Demand	Anodyne	ADRB1	26	40
O=S(=O)(Cc1cccc(NC[C@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819440484	FG	On-Demand	Anodyne	ADRB3	98	51
O=S(=O)(Cc1cccc(NC[C@@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819440486	FG	On-Demand	Anodyne	ADRB2	25	40
O=S(=O)(Cc1cccc(NC[C@@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819440486	FG	On-Demand	Anodyne	ADRB1	26	40
O=S(=O)(Cc1cccc(NC[C@@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819440486	FG	On-Demand	Anodyne	ADRB3	98	51
O[C@@H](CNc1ccc(OCC2CC2)cc1)Cc1ccccc1	ZINC000819440489	CG	On-Demand	Anodyne	ADRB1	49	40
O[C@@H](CNc1ccc(OCC2CC2)cc1)Cc1ccccc1	ZINC000819440489	CG	On-Demand	Anodyne	LTA4H	26	44
O[C@H](CNc1ccc(OCC2CC2)cc1)Cc1ccccc1	ZINC000819440491	CG	On-Demand	Anodyne	ADRB1	49	40
O[C@H](CNc1ccc(OCC2CC2)cc1)Cc1ccccc1	ZINC000819440491	CG	On-Demand	Anodyne	LTA4H	26	44
O[C@@H](CNc1ccc(OCC2CC2)cc1)COC1CCOCC1	ZINC000819440516	DE	On-Demand	Anodyne	ADRB1	28	42
O[C@H](CNc1ccc(OCC2CC2)cc1)COC1CCOCC1	ZINC000819440518	DE	On-Demand	Anodyne	ADRB1	28	42
C[C@H](CC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)n1cccn1	ZINC000819440523	EE	On-Demand	Anodyne	ACE	46	43
C[C@H](CC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)n1cccn1	ZINC000819440523	EE	On-Demand	Anodyne	MME	29	43
C[C@H](CC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)n1cccn1	ZINC000819440523	EE	On-Demand	Anodyne	BIRC2	46	38
Cc1ccc(NC[C@@H](O)c2ccccc2)cc1NC(=O)C(C)(C)C	ZINC000819440537	EI	On-Demand	Anodyne	ADRB2	21	45
Cc1ccc(NC[C@@H](O)c2ccccc2)cc1NC(=O)C(C)(C)C	ZINC000819440537	EI	On-Demand	Anodyne	ADRB1	21	41
Cc1ccc(NC[C@@H](O)c2ccccc2)cc1NC(=O)C(C)(C)C	ZINC000819440537	EI	On-Demand	Anodyne	ADRB3	45	41
Cc1ccc(NC[C@H](O)c2ccccc2)cc1NC(=O)C(C)(C)C	ZINC000819440538	EI	On-Demand	Anodyne	ADRB2	21	45
Cc1ccc(NC[C@H](O)c2ccccc2)cc1NC(=O)C(C)(C)C	ZINC000819440538	EI	On-Demand	Anodyne	ADRB1	21	41
Cc1ccc(NC[C@H](O)c2ccccc2)cc1NC(=O)C(C)(C)C	ZINC000819440538	EI	On-Demand	Anodyne	ADRB3	45	41
Cc1ccc(COc2cccc(NC[C@H](C)S(C)(=O)=O)c2)cc1	ZINC000819440539	EG	On-Demand	Anodyne	MAOB	25	41
Cc1ccc(COc2cccc(NC[C@H](C)S(C)(=O)=O)c2)cc1	ZINC000819440539	EG	On-Demand	Anodyne	ADAMTS4	32	42
Cc1ccc(COc2cccc(NC[C@@H](C)S(C)(=O)=O)c2)cc1	ZINC000819440540	EG	On-Demand	Anodyne	MAOB	25	41
Cc1ccc(COc2cccc(NC[C@@H](C)S(C)(=O)=O)c2)cc1	ZINC000819440540	EG	On-Demand	Anodyne	ADAMTS4	32	42
CC(=O)c1ccc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nc1C	ZINC000819440556	GF	On-Demand	Mild	PAPA1_CARPA	47	46
CC(=O)c1ccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)nc1C	ZINC000819440557	GF	On-Demand	Mild	PAPA1_CARPA	47	46
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@H]1CCc1ccccc1	ZINC000819440577	DH	On-Demand	Anodyne	FKBP1A	49	38
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@H]1CCc1ccccc1	ZINC000819440577	DH	On-Demand	Anodyne	SLC18A2	52	41
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@H]1CCc1ccccc1	ZINC000819440577	DH	On-Demand	Anodyne	PREP	65	37
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@@H]1CCc1ccccc1	ZINC000819440578	DH	On-Demand	Anodyne	FKBP1A	49	38
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@@H]1CCc1ccccc1	ZINC000819440578	DH	On-Demand	Anodyne	SLC18A2	52	41
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@@H]1CCc1ccccc1	ZINC000819440578	DH	On-Demand	Anodyne	PREP	65	37
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@H]1CCc1ccccc1	ZINC000819440579	DH	On-Demand	Anodyne	FKBP1A	49	38
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@H]1CCc1ccccc1	ZINC000819440579	DH	On-Demand	Anodyne	SLC18A2	52	41
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@H]1CCc1ccccc1	ZINC000819440579	DH	On-Demand	Anodyne	PREP	65	37
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@@H]1CCc1ccccc1	ZINC000819440580	DH	On-Demand	Anodyne	FKBP1A	49	38
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@@H]1CCc1ccccc1	ZINC000819440580	DH	On-Demand	Anodyne	SLC18A2	52	41
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@@H]1CCc1ccccc1	ZINC000819440580	DH	On-Demand	Anodyne	PREP	65	37
C#CCNC(=O)CCNc1cccc(OCc2ccc(C)cc2)c1	ZINC000819440599	DG	On-Demand	Mild	FFAR1	28	40
COC(=O)CCCOc1ccc(NC[C@@H](C)O)cc1	ZINC000819440606	CD	On-Demand	Anodyne	LTA4H	26	43
COC(=O)CCCOc1ccc(NC[C@@H](C)O)cc1	ZINC000819440606	CD	On-Demand	Anodyne	PLA2G4B	50	33
COC(=O)CCCOc1ccc(NC[C@H](C)O)cc1	ZINC000819440607	CD	On-Demand	Anodyne	LTA4H	26	43
COC(=O)CCCOc1ccc(NC[C@H](C)O)cc1	ZINC000819440607	CD	On-Demand	Anodyne	PLA2G4B	50	33
O[C@@H](CNc1ccc(OCC2CC2)cc1)Cc1ccc(F)cc1	ZINC000819440610	DH	On-Demand	Anodyne	ADRB1	35	41
O[C@H](CNc1ccc(OCC2CC2)cc1)Cc1ccc(F)cc1	ZINC000819440611	DH	On-Demand	Anodyne	ADRB1	35	41
O[C@@H](CNc1ccc(OCC2CC2)cc1)COc1cccc2[nH]ccc12	ZINC000819440625	FH	On-Demand	Anodyne	ADRB2	26	61
O[C@@H](CNc1ccc(OCC2CC2)cc1)COc1cccc2[nH]ccc12	ZINC000819440625	FH	On-Demand	Anodyne	ADRB1	58	56
O[C@@H](CNc1ccc(OCC2CC2)cc1)COc1cccc2[nH]ccc12	ZINC000819440625	FH	On-Demand	Anodyne	ADRB3	22	56
O[C@H](CNc1ccc(OCC2CC2)cc1)COc1cccc2[nH]ccc12	ZINC000819440626	FH	On-Demand	Anodyne	ADRB2	26	61
O[C@H](CNc1ccc(OCC2CC2)cc1)COc1cccc2[nH]ccc12	ZINC000819440626	FH	On-Demand	Anodyne	ADRB1	58	56
O[C@H](CNc1ccc(OCC2CC2)cc1)COc1cccc2[nH]ccc12	ZINC000819440626	FH	On-Demand	Anodyne	ADRB3	22	56
CN(C)CCCOc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819440628	EH	On-Demand	Anodyne	ADRB2	15	47
CN(C)CCCOc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819440628	EH	On-Demand	Anodyne	ADRB1	33	42
CN(C)CCCOc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819440628	EH	On-Demand	Anodyne	ADRB3	47	42
CN(C)CCCOc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819440631	EH	On-Demand	Anodyne	ADRB2	15	47
CN(C)CCCOc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819440631	EH	On-Demand	Anodyne	ADRB1	33	42
CN(C)CCCOc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819440631	EH	On-Demand	Anodyne	ADRB3	47	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCc3noc(C)n3)cc2)c1	ZINC000819440648	GG	On-Demand	Anodyne	ADRB2	31	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCc3noc(C)n3)cc2)c1	ZINC000819440648	GG	On-Demand	Anodyne	ADRB1	43	38
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCc3noc(C)n3)cc2)c1	ZINC000819440648	GG	On-Demand	Anodyne	ACOX1	40	32
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCc3noc(C)n3)cc2)c1	ZINC000819440648	GG	On-Demand	Anodyne	NR1H4	52	35
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCc3noc(C)n3)cc2)c1	ZINC000819440648	GG	On-Demand	Anodyne	ABCB1	15	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCc3noc(C)n3)cc2)c1	ZINC000819440649	GG	On-Demand	Anodyne	ADRB2	31	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCc3noc(C)n3)cc2)c1	ZINC000819440649	GG	On-Demand	Anodyne	ADRB1	43	38
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCc3noc(C)n3)cc2)c1	ZINC000819440649	GG	On-Demand	Anodyne	ACOX1	40	32
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCc3noc(C)n3)cc2)c1	ZINC000819440649	GG	On-Demand	Anodyne	NR1H4	52	35
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCc3noc(C)n3)cc2)c1	ZINC000819440649	GG	On-Demand	Anodyne	ABCB1	15	40
Cc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1NC(=O)C(C)(C)C	ZINC000819440669	FJ	On-Demand	Anodyne	ADRB3	20	41
CCOC[C@H](O)CNc1cccc(OCc2ccc(C)cc2)c1	ZINC000819440695	DG	On-Demand	Anodyne	ADRB2	26	42
CCOC[C@H](O)CNc1cccc(OCc2ccc(C)cc2)c1	ZINC000819440695	DG	On-Demand	Anodyne	ADRB1	26	42
CC(=O)CCN(C)C(=O)Cc1cccc(NC(C)=O)c1	ZINC000819440710	CD	On-Demand	Anodyne	KCNK3	55	33
Cc1ccc(COc2cccc(NCCS(C)(=O)=O)c2)cc1	ZINC000819440727	DG	On-Demand	Anodyne	MAOA	17	41
Cc1ccc(COc2cccc(NCCS(C)(=O)=O)c2)cc1	ZINC000819440727	DG	On-Demand	Anodyne	MAOB	54	43
Cc1ccc(COc2cccc(NCC3(O)CCS(=O)(=O)CC3)c2)cc1	ZINC000819440728	GF	On-Demand	Anodyne	FFAR1	15	40
COC(=O)CCCOc1ccc(NC[C@H](O)c2ccccc2Cl)cc1	ZINC000819440729	FH	On-Demand	Anodyne	LTA4H	24	42
C[C@@H](CC#N)Sc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819440739	EJ	On-Demand	Mild	ADRB1	24	42
C[C@@H](CC#N)Sc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819440739	EJ	On-Demand	Mild	ADRB3	37	42
C[C@@H](CC#N)Sc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819440739	EJ	On-Demand	Mild	CYP3A4	46	35
C[C@@H](CC#N)Sc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819440740	EJ	On-Demand	Mild	ADRB1	24	42
C[C@@H](CC#N)Sc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819440740	EJ	On-Demand	Mild	ADRB3	37	42
C[C@@H](CC#N)Sc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819440740	EJ	On-Demand	Mild	CYP3A4	46	35
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N(C)CCO)cc2)c1	ZINC000819440745	EE	On-Demand	Anodyne	MTNR1B	15	42
CC(=O)CCN(C)C(=O)CCc1cccc(OC(F)F)c1	ZINC000819440771	CF	On-Demand	Anodyne	CRTM	56	45
O=C(Cc1ccc(-n2cnnc2)cc1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440772	GE	On-Demand	Anodyne	PRSS1	15	40
O=C(Cc1ccc(-n2cnnc2)cc1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440772	GE	On-Demand	Anodyne	ACE	32	42
O=C(Cc1ccc(-n2cnnc2)cc1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440772	GE	On-Demand	Anodyne	HTR1D	40	41
O=C(Cc1ccc(-n2cnnc2)cc1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440772	GE	On-Demand	Anodyne	HTR1B	31	41
O=C(Cc1ccc(-n2cnnc2)cc1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440772	GE	On-Demand	Anodyne	MME	20	42
O=C(Cc1ccc(-n2cnnc2)cc1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440772	GE	On-Demand	Anodyne	SIGMAR1	20	43
O=C(Cc1ccc(-n2cnnc2)cc1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440772	GE	On-Demand	Anodyne	LUXR	47	38
O=C(Cc1ccc(-n2cnnc2)cc1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440773	GE	On-Demand	Anodyne	PRSS1	15	40
O=C(Cc1ccc(-n2cnnc2)cc1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440773	GE	On-Demand	Anodyne	ACE	32	42
O=C(Cc1ccc(-n2cnnc2)cc1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440773	GE	On-Demand	Anodyne	HTR1D	40	41
O=C(Cc1ccc(-n2cnnc2)cc1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440773	GE	On-Demand	Anodyne	HTR1B	31	41
O=C(Cc1ccc(-n2cnnc2)cc1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440773	GE	On-Demand	Anodyne	MME	20	42
O=C(Cc1ccc(-n2cnnc2)cc1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440773	GE	On-Demand	Anodyne	SIGMAR1	20	43
O=C(Cc1ccc(-n2cnnc2)cc1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819440773	GE	On-Demand	Anodyne	LUXR	47	38
COC(=O)CCCOc1ccc(NC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819440789	FG	On-Demand	Anodyne	LTA4H	16	40
COC(=O)CCCOc1ccc(NC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819440790	FG	On-Demand	Anodyne	LTA4H	16	40
CN(C)CCCOc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819440793	DG	On-Demand	Anodyne	ADRB3	30	40
CN(C)CCCOc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819440793	DG	On-Demand	Anodyne	ESRRG	45	33
CN(C)CCCOc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819440794	DG	On-Demand	Anodyne	ADRB3	30	40
CN(C)CCCOc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819440794	DG	On-Demand	Anodyne	ESRRG	45	33
COC(=O)CCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819440812	FH	On-Demand	Anodyne	ADRB2	29	56
COC(=O)CCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819440812	FH	On-Demand	Anodyne	ADRB1	50	56
COC(=O)CCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819440812	FH	On-Demand	Anodyne	ADRB3	67	56
COC(=O)CCCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819440812	FH	On-Demand	Anodyne	CYP3A4	42	34
COC(=O)CCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819440813	FH	On-Demand	Anodyne	ADRB2	29	56
COC(=O)CCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819440813	FH	On-Demand	Anodyne	ADRB1	50	56
COC(=O)CCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819440813	FH	On-Demand	Anodyne	ADRB3	67	56
COC(=O)CCCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819440813	FH	On-Demand	Anodyne	CYP3A4	42	34
CC(=O)CCN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819440819	EE	On-Demand	Mild	PAPA1_CARPA	38	45
CC(=O)CCN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819440819	EE	On-Demand	Mild	CTSK	15	43
CC(=O)CCN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819440839	EE	On-Demand	Mild	PAPA1_CARPA	38	45
CC(=O)CCN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819440839	EE	On-Demand	Mild	CTSK	15	43
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(Oc2ccncc2)c1	ZINC000819440851	FH	On-Demand	Anodyne	RAF1	23	46
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(Oc2ccncc2)c1	ZINC000819440853	FH	On-Demand	Anodyne	RAF1	23	46
C[C@@H](c1ccc(NC[C@@H](O)c2cccnc2)cc1)N1CCOCC1	ZINC000819440899	EF	On-Demand	Anodyne	ADRB1	21	40
C[C@@H](c1ccc(NC[C@@H](O)c2cccnc2)cc1)N1CCOCC1	ZINC000819440899	EF	On-Demand	Anodyne	ADRB3	80	42
C[C@@H](c1ccc(NC[C@H](O)c2cccnc2)cc1)N1CCOCC1	ZINC000819440901	EF	On-Demand	Anodyne	ADRB1	21	40
C[C@@H](c1ccc(NC[C@H](O)c2cccnc2)cc1)N1CCOCC1	ZINC000819440901	EF	On-Demand	Anodyne	ADRB3	80	42
CN(C)CCCOc1cccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819440935	GI	On-Demand	Anodyne	GALR3	34	41
CN(C)CCCOc1cccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819440936	GI	On-Demand	Anodyne	GALR3	34	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCc3ccc(Cl)cc3C1)C2	ZINC000819440950	FG	On-Demand	Anodyne	CCR2	21	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCc3ccc(Cl)cc3C1)C2	ZINC000819440953	FG	On-Demand	Anodyne	CCR2	21	40
COC(=O)CCCOc1ccc(NC[C@@H](O)C(F)(F)F)cc1	ZINC000819440968	DE	On-Demand	Anodyne	LTA4H	17	40
COC(=O)CCCOc1ccc(NC[C@H](O)C(F)(F)F)cc1	ZINC000819440970	DE	On-Demand	Anodyne	LTA4H	17	40
Cc1ccc(OC[C@@H](O)CNc2ccc(OCc3noc(C)n3)cc2)cc1	ZINC000819440980	FG	On-Demand	Anodyne	ADRB2	31	47
Cc1ccc(OC[C@@H](O)CNc2ccc(OCc3noc(C)n3)cc2)cc1	ZINC000819440980	FG	On-Demand	Anodyne	ADRB1	41	41
Cc1ccc(OC[C@@H](O)CNc2ccc(OCc3noc(C)n3)cc2)cc1	ZINC000819440980	FG	On-Demand	Anodyne	ADRB3	28	41
Cc1ccc(OC[C@H](O)CNc2ccc(OCc3noc(C)n3)cc2)cc1	ZINC000819440981	FG	On-Demand	Anodyne	ADRB2	31	47
Cc1ccc(OC[C@H](O)CNc2ccc(OCc3noc(C)n3)cc2)cc1	ZINC000819440981	FG	On-Demand	Anodyne	ADRB1	41	41
Cc1ccc(OC[C@H](O)CNc2ccc(OCc3noc(C)n3)cc2)cc1	ZINC000819440981	FG	On-Demand	Anodyne	ADRB3	28	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(Oc2cccnc2)nc1	ZINC000819440987	FG	On-Demand	Anodyne	NAMPT	20	44
C[C@@H](CC#N)Sc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819441003	DH	On-Demand	Mild	ADRB1	19	40
C[C@@H](CC#N)Sc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819441003	DH	On-Demand	Mild	ADRB3	68	40
C[C@@H](CC#N)Sc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819441006	DH	On-Demand	Mild	ADRB1	19	40
C[C@@H](CC#N)Sc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819441006	DH	On-Demand	Mild	ADRB3	68	40
N#Cc1cccc(Oc2ccc(NC[C@@H](O)C3CC3)cc2)c1	ZINC000819441008	CH	On-Demand	Mild	PFKFB3	57	32
N#Cc1cccc(Oc2ccc(NC[C@H](O)C3CC3)cc2)c1	ZINC000819441009	CH	On-Demand	Mild	PFKFB3	57	32
COC(=O)CCCOc1ccc(NCC2(O)CCC2)cc1	ZINC000819441066	CE	On-Demand	Anodyne	LTA4H	18	40
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1cccc(Oc2ccncc2)c1	ZINC000819441071	GG	On-Demand	Anodyne	RAF1	25	47
CN(C[C@@H](O)CNc1cccc(Oc2ccncc2)c1)C(=O)OC(C)(C)C	ZINC000819441087	FH	On-Demand	Anodyne	RAF1	15	43
CN(C[C@H](O)CNc1cccc(Oc2ccncc2)c1)C(=O)OC(C)(C)C	ZINC000819441088	FH	On-Demand	Anodyne	RAF1	15	43
CN(C)CCCOc1cccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819441089	GI	On-Demand	Anodyne	GALR3	60	44
CN(C)CCCOc1cccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819441089	GI	On-Demand	Anodyne	PDS	43	40
CN(C)CCCOc1cccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819441090	GI	On-Demand	Anodyne	GALR3	60	44
CN(C)CCCOc1cccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819441090	GI	On-Demand	Anodyne	PDS	43	40
CN(C)CCCOc1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819441117	FG	On-Demand	Bother	ACR	16	41
CN(C)CCCOc1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819441118	FG	On-Demand	Bother	ACR	16	41
COC(=O)CCCOc1ccc(NCCC(=O)NC(N)=O)cc1	ZINC000819441121	DD	On-Demand	Anodyne	LTA4H	21	40
C[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441131	EG	On-Demand	Anodyne	PRSS1	17	41
C[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441131	EG	On-Demand	Anodyne	ACE	46	47
C[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441131	EG	On-Demand	Anodyne	F10	22	41
C[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441131	EG	On-Demand	Anodyne	MME	28	47
C[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441131	EG	On-Demand	Anodyne	SIGMAR1	23	41
C[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441131	EG	On-Demand	Anodyne	XIAP	41	39
C[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441131	EG	On-Demand	Anodyne	BIRC3	52	36
C[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441131	EG	On-Demand	Anodyne	BIRC2	50	37
C[C@@H]1CCCC[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441131	EG	On-Demand	Anodyne	BIRC8	55	35
C[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441132	EG	On-Demand	Anodyne	PRSS1	17	41
C[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441132	EG	On-Demand	Anodyne	ACE	46	47
C[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441132	EG	On-Demand	Anodyne	F10	22	41
C[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441132	EG	On-Demand	Anodyne	MME	28	47
C[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441132	EG	On-Demand	Anodyne	SIGMAR1	23	41
C[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441132	EG	On-Demand	Anodyne	XIAP	41	39
C[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441132	EG	On-Demand	Anodyne	BIRC3	52	36
C[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441132	EG	On-Demand	Anodyne	BIRC2	50	37
C[C@@H]1CCCC[C@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441132	EG	On-Demand	Anodyne	BIRC8	55	35
C[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441133	EG	On-Demand	Anodyne	PRSS1	17	41
C[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441133	EG	On-Demand	Anodyne	ACE	46	47
C[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441133	EG	On-Demand	Anodyne	F10	22	41
C[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441133	EG	On-Demand	Anodyne	MME	28	47
C[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441133	EG	On-Demand	Anodyne	SIGMAR1	23	41
C[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441133	EG	On-Demand	Anodyne	XIAP	41	39
C[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441133	EG	On-Demand	Anodyne	BIRC3	52	36
C[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441133	EG	On-Demand	Anodyne	BIRC2	50	37
C[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441133	EG	On-Demand	Anodyne	BIRC8	55	35
C[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441134	EG	On-Demand	Anodyne	PRSS1	17	41
C[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441134	EG	On-Demand	Anodyne	ACE	46	47
C[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441134	EG	On-Demand	Anodyne	F10	22	41
C[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441134	EG	On-Demand	Anodyne	MME	28	47
C[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441134	EG	On-Demand	Anodyne	SIGMAR1	23	41
C[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441134	EG	On-Demand	Anodyne	XIAP	41	39
C[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441134	EG	On-Demand	Anodyne	BIRC3	52	36
C[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441134	EG	On-Demand	Anodyne	BIRC2	50	37
C[C@@H]1CCCC[C@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000819441134	EG	On-Demand	Anodyne	BIRC8	55	35
O=C1CCc2cc(OC[C@H](O)CNc3ccc(OCC4CC4)cc3)ccc2N1	ZINC000819441136	GG	On-Demand	Anodyne	ADRB2	17	40
O=C1CCc2cc(OC[C@H](O)CNc3ccc(OCC4CC4)cc3)ccc2N1	ZINC000819441136	GG	On-Demand	Anodyne	ADRB1	40	41
O=C1CCc2cc(OC[C@H](O)CNc3ccc(OCC4CC4)cc3)ccc2N1	ZINC000819441136	GG	On-Demand	Anodyne	GRIN2B	15	52
O=C1CCc2cc(OC[C@@H](O)CNc3ccc(OCC4CC4)cc3)ccc2N1	ZINC000819441137	GG	On-Demand	Anodyne	ADRB2	17	40
O=C1CCc2cc(OC[C@@H](O)CNc3ccc(OCC4CC4)cc3)ccc2N1	ZINC000819441137	GG	On-Demand	Anodyne	ADRB1	40	41
O=C1CCc2cc(OC[C@@H](O)CNc3ccc(OCC4CC4)cc3)ccc2N1	ZINC000819441137	GG	On-Demand	Anodyne	GRIN2B	15	52
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cccc(-c2cn[nH]c2)c1	ZINC000819441138	EF	On-Demand	Anodyne	ROCK2	82	42
COC(=O)CCCOc1ccc(NC[C@H](O)C(C)(C)C)cc1	ZINC000819441150	DF	On-Demand	Anodyne	LTA4H	18	41
COC(=O)CCCOc1ccc(NC[C@@H](O)C(C)(C)C)cc1	ZINC000819441151	DF	On-Demand	Anodyne	LTA4H	18	41
CC[C@H](O)CNc1ccc(OCCCC(=O)OC)cc1	ZINC000819441153	CE	On-Demand	Anodyne	LTA4H	18	41
CC[C@H](O)CNc1ccc(OCCCC(=O)OC)cc1	ZINC000819441153	CE	On-Demand	Anodyne	PLA2G4B	55	34
Cc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1OC(F)F	ZINC000819441192	FG	On-Demand	Anodyne	ADRB3	18	41
Cc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1OC(F)F	ZINC000819441193	FG	On-Demand	Anodyne	ADRB3	18	41
O[C@@H](CNc1ccc(OCC2CC2)cc1)COc1ccccc1	ZINC000819441260	DG	On-Demand	Anodyne	ADRB2	63	49
O[C@@H](CNc1ccc(OCC2CC2)cc1)COc1ccccc1	ZINC000819441260	DG	On-Demand	Anodyne	ADRB1	92	49
O[C@@H](CNc1ccc(OCC2CC2)cc1)COc1ccccc1	ZINC000819441260	DG	On-Demand	Anodyne	GRIN2B	16	43
O[C@@H](CNc1ccc(OCC2CC2)cc1)COc1ccccc1	ZINC000819441260	DG	On-Demand	Anodyne	ADRB3	61	46
O[C@H](CNc1ccc(OCC2CC2)cc1)COc1ccccc1	ZINC000819441261	DG	On-Demand	Anodyne	ADRB2	63	49
O[C@H](CNc1ccc(OCC2CC2)cc1)COc1ccccc1	ZINC000819441261	DG	On-Demand	Anodyne	ADRB1	92	49
O[C@H](CNc1ccc(OCC2CC2)cc1)COc1ccccc1	ZINC000819441261	DG	On-Demand	Anodyne	GRIN2B	16	43
O[C@H](CNc1ccc(OCC2CC2)cc1)COc1ccccc1	ZINC000819441261	DG	On-Demand	Anodyne	ADRB3	61	46
C[S@](=O)Cc1cccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819441267	FH	On-Demand	Anodyne	ADRB3	16	41
C[S@@](=O)Cc1cccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819441268	FH	On-Demand	Anodyne	ADRB3	16	41
C[S@](=O)Cc1cccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819441269	FH	On-Demand	Anodyne	ADRB3	16	41
C[S@@](=O)Cc1cccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819441270	FH	On-Demand	Anodyne	ADRB3	16	41
O=C(/C=C\[C@@H]1CCCO1)N1CCC2(CCN(Cc3ccccc3)C2)CC1	ZINC000819441276	FG	On-Demand	Anodyne	SIGMAR1	48	36
O=C(/C=C/[C@@H]1CCCO1)N1CCC2(CCN(Cc3ccccc3)C2)CC1	ZINC000819441277	FG	On-Demand	Anodyne	SIGMAR1	48	36
O=C(/C=C/[C@H]1CCCO1)N1CCC2(CCN(Cc3ccccc3)C2)CC1	ZINC000819441278	FG	On-Demand	Anodyne	SIGMAR1	48	36
O=C(/C=C\[C@H]1CCCO1)N1CCC2(CCN(Cc3ccccc3)C2)CC1	ZINC000819441279	FG	On-Demand	Anodyne	SIGMAR1	48	36
Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1OC(F)F	ZINC000819441296	EH	On-Demand	Bother	CACNA1D	42	32
Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1OC(F)F	ZINC000819441297	EH	On-Demand	Bother	CACNA1D	42	32
C[S@@](=O)Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819441316	DG	On-Demand	Anodyne	ADRB2	21	49
C[S@@](=O)Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819441316	DG	On-Demand	Anodyne	ADRB1	35	49
C[S@@](=O)Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819441316	DG	On-Demand	Anodyne	ADRB3	52	44
C[S@](=O)Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819441317	DG	On-Demand	Anodyne	ADRB2	21	49
C[S@](=O)Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819441317	DG	On-Demand	Anodyne	ADRB1	35	49
C[S@](=O)Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819441317	DG	On-Demand	Anodyne	ADRB3	52	44
C[S@@](=O)Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819441318	DG	On-Demand	Anodyne	ADRB2	21	49
C[S@@](=O)Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819441318	DG	On-Demand	Anodyne	ADRB1	35	49
C[S@@](=O)Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819441318	DG	On-Demand	Anodyne	ADRB3	52	44
C[S@](=O)Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819441319	DG	On-Demand	Anodyne	ADRB2	21	49
C[S@](=O)Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819441319	DG	On-Demand	Anodyne	ADRB1	35	49
C[S@](=O)Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819441319	DG	On-Demand	Anodyne	ADRB3	52	44
CC(=O)NCc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819441460	FG	On-Demand	Anodyne	ADRB1	16	42
CC(=O)NCc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819441460	FG	On-Demand	Anodyne	CCR2	54	43
CC(=O)NCc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819441460	FG	On-Demand	Anodyne	PDS	49	42
CC(=O)NCc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819441461	FG	On-Demand	Anodyne	ADRB1	16	42
CC(=O)NCc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819441461	FG	On-Demand	Anodyne	CCR2	54	43
CC(=O)NCc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819441461	FG	On-Demand	Anodyne	PDS	49	42
O=C(C(F)=C1CCC1)N1CCC2(CCN(Cc3ccccc3)C2)CC1	ZINC000819441477	EH	On-Demand	Anodyne	SIGMAR1	47	42
O=C(C(F)=C1CCC1)N1CCC2(CCN(Cc3ccccc3)C2)CC1	ZINC000819441477	EH	On-Demand	Anodyne	CCR8	29	42
CCSc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819441487	CG	On-Demand	Anodyne	ADRB3	74	40
CCSc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819441488	CG	On-Demand	Anodyne	ADRB3	74	40
C[C@@H](CNc1cccc2c1CCN(C(=O)OC(C)(C)C)C2)S(C)(=O)=O	ZINC000819441504	FF	On-Demand	Anodyne	GPR119	41	39
CC(C)(C)OC(=O)N1CC(CNC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819441507	FD	On-Demand	Anodyne	CACNA1I	46	43
CC(C)(C)OC(=O)N1CC(CNC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819441507	FD	On-Demand	Anodyne	GPR119	38	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccccc1CN1CCC(O)CC1	ZINC000819441508	GE	On-Demand	Anodyne	CCR3	15	42
O[C@@H](CNc1ccc(OCC2CC2)cc1)COCc1ccco1	ZINC000819441538	DG	On-Demand	Anodyne	ADRB1	21	42
O[C@H](CNc1ccc(OCC2CC2)cc1)COCc1ccco1	ZINC000819441539	DG	On-Demand	Anodyne	ADRB1	21	42
CC(C)(C)OC(=O)N1CC(CNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819441540	ED	On-Demand	Anodyne	CACNA1I	54	34
O=C(Nc1ccccc1CN1CCC(O)CC1)C(F)=C1CCC1	ZINC000819441549	DF	On-Demand	Anodyne	CCR3	23	47
O[C@@H](CNc1ccc(Oc2ccnc3ccccc23)cc1)C1CC1	ZINC000819441591	DI	On-Demand	Anodyne	KDR	50	39
O[C@@H](CNc1ccc(Oc2ccnc3ccccc23)cc1)C1CC1	ZINC000819441591	DI	On-Demand	Anodyne	PDGFRA	43	39
O[C@H](CNc1ccc(Oc2ccnc3ccccc23)cc1)C1CC1	ZINC000819441592	DI	On-Demand	Anodyne	KDR	50	39
O[C@H](CNc1ccc(Oc2ccnc3ccccc23)cc1)C1CC1	ZINC000819441592	DI	On-Demand	Anodyne	PDGFRA	43	39
O=C(CCNc1ccc(OCC2CC2)cc1)Nc1ccccc1	ZINC000819441610	DH	On-Demand	Anodyne	GRIN2B	26	46
O=C(CCNc1ccc(OCC2CC2)cc1)Nc1ccccc1	ZINC000819441610	DH	On-Demand	Anodyne	LTA4H	67	49
O=C(CCNc1ccc(OCC2CC2)cc1)Nc1ccccc1	ZINC000819441610	DH	On-Demand	Anodyne	HDAC8	17	40
O=C(CCNc1ccc(OCC2CC2)cc1)Nc1ccccc1	ZINC000819441610	DH	On-Demand	Anodyne	HDAC10	17	40
O=C(CCNc1ccc(OCC2CC2)cc1)Nc1ccccc1	ZINC000819441610	DH	On-Demand	Anodyne	EPHX2	22	40
O=C(CCNc1ccc(OCC2CC2)cc1)Nc1ccccc1	ZINC000819441610	DH	On-Demand	Anodyne	HDAC11	16	40
CC(=O)NCc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819441663	FD	On-Demand	Anodyne	TRPV1	15	41
CC(=O)NCc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819441663	FD	On-Demand	Anodyne	GHSR	22	41
CC(=O)NCc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819441664	FD	On-Demand	Anodyne	TRPV1	15	41
CC(=O)NCc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819441664	FD	On-Demand	Anodyne	GHSR	22	41
N#CCc1ccc(OC[C@@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441665	FG	On-Demand	Mild	ADRB2	37	47
N#CCc1ccc(OC[C@@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441665	FG	On-Demand	Mild	ADRB1	70	49
N#CCc1ccc(OC[C@@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441665	FG	On-Demand	Mild	ADRB3	42	38
N#CCc1ccc(OC[C@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441666	FG	On-Demand	Mild	ADRB2	37	47
N#CCc1ccc(OC[C@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441666	FG	On-Demand	Mild	ADRB1	70	49
N#CCc1ccc(OC[C@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441666	FG	On-Demand	Mild	ADRB3	42	38
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441680	FG	On-Demand	Anodyne	ADRB2	49	60
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441680	FG	On-Demand	Anodyne	ADRB1	83	60
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441680	FG	On-Demand	Anodyne	ADRB3	51	52
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441681	FG	On-Demand	Anodyne	ADRB2	49	60
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441681	FG	On-Demand	Anodyne	ADRB1	83	60
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441681	FG	On-Demand	Anodyne	ADRB3	51	52
CC(=O)NCc1ccc(NCCS(=O)(=O)CC(=O)OC(C)(C)C)cc1	ZINC000819441685	FD	On-Demand	Anodyne	PTPRB	46	36
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc3c(c2)CC(=O)N3)CC1	ZINC000819441687	GF	On-Demand	Anodyne	GPR119	36	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc3c(c2)CC(=O)N3)CC1	ZINC000819441688	GF	On-Demand	Anodyne	GPR119	36	47
C[S@@](=O)Cc1cccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819441706	FE	On-Demand	Anodyne	ADRB3	23	40
C[S@](=O)Cc1cccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819441707	FE	On-Demand	Anodyne	ADRB3	23	40
C[S@](=O)Cc1cccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819441708	FE	On-Demand	Anodyne	ADRB3	23	40
C[S@@](=O)Cc1cccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819441709	FE	On-Demand	Anodyne	ADRB3	23	40
O[C@@H](CNc1cccc(Oc2ccnc3ccccc23)c1)C1CC1	ZINC000819441717	DI	On-Demand	Anodyne	KDR	59	38
O[C@H](CNc1cccc(Oc2ccnc3ccccc23)c1)C1CC1	ZINC000819441718	DI	On-Demand	Anodyne	KDR	59	38
O[C@@H](CNc1ccc(OCC2CC2)cc1)COc1ccc(F)cc1	ZINC000819441724	EG	On-Demand	Anodyne	ADRB2	43	46
O[C@@H](CNc1ccc(OCC2CC2)cc1)COc1ccc(F)cc1	ZINC000819441724	EG	On-Demand	Anodyne	ADRB1	72	48
O[C@@H](CNc1ccc(OCC2CC2)cc1)COc1ccc(F)cc1	ZINC000819441724	EG	On-Demand	Anodyne	ADRB3	41	42
O[C@H](CNc1ccc(OCC2CC2)cc1)COc1ccc(F)cc1	ZINC000819441725	EG	On-Demand	Anodyne	ADRB2	43	46
O[C@H](CNc1ccc(OCC2CC2)cc1)COc1ccc(F)cc1	ZINC000819441725	EG	On-Demand	Anodyne	ADRB1	72	48
O[C@H](CNc1ccc(OCC2CC2)cc1)COc1ccc(F)cc1	ZINC000819441725	EG	On-Demand	Anodyne	ADRB3	41	42
N#Cc1ccc(OC[C@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441726	EG	On-Demand	Mild	ADRB2	32	46
N#Cc1ccc(OC[C@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441726	EG	On-Demand	Mild	ADRB1	64	47
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441727	EG	On-Demand	Mild	ADRB2	32	46
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441727	EG	On-Demand	Mild	ADRB1	64	47
O[C@@H](CNc1ccc(OCC2CC2)cc1)COCc1cccs1	ZINC000819441728	EH	On-Demand	Anodyne	ADRB1	36	44
O[C@@H](CNc1ccc(OCC2CC2)cc1)COCc1cccs1	ZINC000819441728	EH	On-Demand	Anodyne	ADRB3	15	41
O[C@H](CNc1ccc(OCC2CC2)cc1)COCc1cccs1	ZINC000819441729	EH	On-Demand	Anodyne	ADRB1	36	44
O[C@H](CNc1ccc(OCC2CC2)cc1)COCc1cccs1	ZINC000819441729	EH	On-Demand	Anodyne	ADRB3	15	41
O=C(c1cccnc1)N1CCc2cc(NCC3(O)CCCCC3)ccc21	ZINC000819441733	FG	On-Demand	Anodyne	HTR2C	15	45
O=C(c1cccnc1)N1CCc2cc(NCC3(O)CCCCC3)ccc21	ZINC000819441733	FG	On-Demand	Anodyne	CYP11B2	22	47
C[S@](=O)Cc1cccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819441741	GF	On-Demand	Anodyne	GPR119	38	51
C[S@@](=O)Cc1cccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819441742	GF	On-Demand	Anodyne	GPR119	38	51
C[S@](=O)Cc1cccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819441743	GF	On-Demand	Anodyne	GPR119	38	51
C[S@@](=O)Cc1cccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819441744	GF	On-Demand	Anodyne	GPR119	38	51
CC(=O)NCc1ccc(NC[C@@H](O)c2ccc(F)cc2C)cc1	ZINC000819441764	DF	On-Demand	Anodyne	LEF	74	35
CC(=O)NCc1ccc(NC[C@H](O)c2ccc(F)cc2C)cc1	ZINC000819441765	DF	On-Demand	Anodyne	LEF	74	35
CC(=O)NCc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819441768	FG	On-Demand	Anodyne	ADRB2	21	42
CC(=O)NCc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819441768	FG	On-Demand	Anodyne	GCGR	27	46
CC(=O)NCc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819441768	FG	On-Demand	Anodyne	CTSS	18	40
CC(=O)NCc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819441768	FG	On-Demand	Anodyne	GIPR	26	40
CC(=O)NCc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819441769	FG	On-Demand	Anodyne	ADRB2	21	42
CC(=O)NCc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819441769	FG	On-Demand	Anodyne	GCGR	27	46
CC(=O)NCc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819441769	FG	On-Demand	Anodyne	CTSS	18	40
CC(=O)NCc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819441769	FG	On-Demand	Anodyne	GIPR	26	40
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(CN2CCC(O)CC2)cc1	ZINC000819441774	EE	On-Demand	Anodyne	SIGMAR1	19	40
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(CN2CCC(O)CC2)cc1	ZINC000819441775	EE	On-Demand	Anodyne	SIGMAR1	19	40
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(CN2CCC(O)CC2)cc1	ZINC000819441776	EE	On-Demand	Anodyne	SIGMAR1	19	40
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(CN2CCC(O)CC2)cc1	ZINC000819441777	EE	On-Demand	Anodyne	SIGMAR1	19	40
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441787	FG	On-Demand	Anodyne	ADRB3	25	40
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441788	FG	On-Demand	Anodyne	ADRB3	25	40
CC(=O)NCc1ccc(NCCS(C)(=O)=O)cc1	ZINC000819441796	CC	On-Demand	Anodyne	TRPV1	25	46
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441811	FH	On-Demand	Anodyne	ADRB2	44	47
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441811	FH	On-Demand	Anodyne	ADRB1	74	47
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441811	FH	On-Demand	Anodyne	ADRB3	44	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441812	FH	On-Demand	Anodyne	ADRB2	44	47
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441812	FH	On-Demand	Anodyne	ADRB1	74	47
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCC3CC3)cc2)cc1	ZINC000819441812	FH	On-Demand	Anodyne	ADRB3	44	41
O=C(Nc1ccc(CN2CCC(O)CC2)cc1)C(F)=C1CCC1	ZINC000819441813	DF	On-Demand	Anodyne	SIGMAR1	28	43
O=C(Nc1ccc(CN2CCC(O)CC2)cc1)C(F)=C1CCC1	ZINC000819441813	DF	On-Demand	Anodyne	MCHR1	22	40
O=C(Nc1ccc(CN2CCC(O)CC2)cc1)C(F)=C1CCC1	ZINC000819441813	DF	On-Demand	Anodyne	NOD2	41	34
O[C@@H](CNc1ccc(OCC2CC2)cc1)CN1CCc2ccccc2C1	ZINC000819441815	FG	On-Demand	Anodyne	NOD2	43	40
O[C@H](CNc1ccc(OCC2CC2)cc1)CN1CCc2ccccc2C1	ZINC000819441816	FG	On-Demand	Anodyne	NOD2	43	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(OCC2CC2)cc1	ZINC000819441856	FG	On-Demand	Bother	ADRB2	34	42
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(OCC2CC2)cc1	ZINC000819441856	FG	On-Demand	Bother	ADRB1	64	42
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(OCC2CC2)cc1	ZINC000819441856	FG	On-Demand	Bother	ADRB3	31	42
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(OCC2CC2)cc1	ZINC000819441857	FG	On-Demand	Bother	ADRB2	34	42
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(OCC2CC2)cc1	ZINC000819441857	FG	On-Demand	Bother	ADRB1	64	42
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(OCC2CC2)cc1	ZINC000819441857	FG	On-Demand	Bother	ADRB3	31	42
CC(=O)NCc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819441873	GF	On-Demand	Anodyne	GPR119	48	50
CC(=O)NCc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819441874	GF	On-Demand	Anodyne	GPR119	48	50
CCSc1cccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819441898	GI	On-Demand	Anodyne	ITGAL	41	32
CCSc1cccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819441898	GI	On-Demand	Anodyne	GPR119	41	48
CCSc1cccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819441899	GI	On-Demand	Anodyne	ITGAL	41	32
CCSc1cccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819441899	GI	On-Demand	Anodyne	GPR119	41	48
O[C@@H](CNc1ccc(OCC2CC2)cc1)COc1ccc2c(c1)OCO2	ZINC000819441900	FG	On-Demand	Anodyne	ADRB2	19	41
O[C@@H](CNc1ccc(OCC2CC2)cc1)COc1ccc2c(c1)OCO2	ZINC000819441900	FG	On-Demand	Anodyne	ADRB1	41	43
O[C@H](CNc1ccc(OCC2CC2)cc1)COc1ccc2c(c1)OCO2	ZINC000819441901	FG	On-Demand	Anodyne	ADRB2	19	41
O[C@H](CNc1ccc(OCC2CC2)cc1)COc1ccc2c(c1)OCO2	ZINC000819441901	FG	On-Demand	Anodyne	ADRB1	41	43
O=C(CCNc1ccc(OCC2CC2)cc1)Nc1ccccc1F	ZINC000819441910	EI	On-Demand	Anodyne	LTA4H	16	40
CC(=O)NCc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819441950	CD	On-Demand	Anodyne	ADRB2	34	47
CC(=O)NCc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819441950	CD	On-Demand	Anodyne	ADRB1	31	47
CC(=O)NCc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819441950	CD	On-Demand	Anodyne	ADRB3	108	48
CC(=O)NCc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819441950	CD	On-Demand	Anodyne	KCNA5	20	43
CC(=O)NCc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819441950	CD	On-Demand	Anodyne	NAMPT	63	38
CC(=O)NCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819441951	CD	On-Demand	Anodyne	ADRB2	34	47
CC(=O)NCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819441951	CD	On-Demand	Anodyne	ADRB1	31	47
CC(=O)NCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819441951	CD	On-Demand	Anodyne	ADRB3	108	48
CC(=O)NCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819441951	CD	On-Demand	Anodyne	KCNA5	20	43
CC(=O)NCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819441951	CD	On-Demand	Anodyne	NAMPT	63	38
CC(C)(C)OC(=O)N1CC(CNC(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819441960	GG	On-Demand	Anodyne	CACNA1I	48	33
CC(C)(C)OC(=O)N1CC(CNC(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819441960	GG	On-Demand	Anodyne	GPR119	24	41
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1OC(F)F	ZINC000819441965	CG	On-Demand	Anodyne	ADRB3	92	44
Cc1ccc(NC[C@H](O)c2cccnc2)cc1OC(F)F	ZINC000819441966	CG	On-Demand	Anodyne	ADRB3	92	44
C=CCCn1cc(C(=O)NCC2CN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819441974	ED	On-Demand	Mild	CACNA1I	41	32
C[S@](=O)Cc1cc(NC[C@H](O)c2cccnc2)ccc1Cl	ZINC000819441981	DF	On-Demand	Anodyne	ADRB3	83	41
C[S@@](=O)Cc1cc(NC[C@@H](O)c2cccnc2)ccc1Cl	ZINC000819441982	DF	On-Demand	Anodyne	ADRB3	83	41
C[S@](=O)Cc1cc(NC[C@@H](O)c2cccnc2)ccc1Cl	ZINC000819441983	DF	On-Demand	Anodyne	ADRB3	83	41
C[S@@](=O)Cc1cc(NC[C@H](O)c2cccnc2)ccc1Cl	ZINC000819441984	DF	On-Demand	Anodyne	ADRB3	83	41
CC(C)(C)OC(=O)N1CC(CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819441985	FE	On-Demand	Anodyne	INHA	42	32
CC(C)(C)OC(=O)N1CC(CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819441985	FE	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)N1CCc2c(cccc2NC[C@H](O)c2cccnc2)C1	ZINC000819441987	FH	On-Demand	Anodyne	ADRB1	16	40
CC(C)(C)OC(=O)N1CCc2c(cccc2NC[C@H](O)c2cccnc2)C1	ZINC000819441987	FH	On-Demand	Anodyne	ADRB3	51	45
CC(C)(C)OC(=O)N1CCc2c(cccc2NC[C@@H](O)c2cccnc2)C1	ZINC000819441988	FH	On-Demand	Anodyne	ADRB1	16	40
CC(C)(C)OC(=O)N1CCc2c(cccc2NC[C@@H](O)c2cccnc2)C1	ZINC000819441988	FH	On-Demand	Anodyne	ADRB3	51	45
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2ccc3c(c2)CC(=O)N3)CC1	ZINC000819442001	GF	On-Demand	Anodyne	GPR119	20	43
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2ccc3c(c2)CC(=O)N3)CC1	ZINC000819442002	GF	On-Demand	Anodyne	GPR119	20	43
C[S@@](=O)Cc1cc(NC[C@H](O)c2ccccc2)ccc1Cl	ZINC000819442007	DG	On-Demand	Anodyne	ADRB1	15	43
C[S@](=O)Cc1cc(NC[C@@H](O)c2ccccc2)ccc1Cl	ZINC000819442008	DG	On-Demand	Anodyne	ADRB1	15	43
C[S@@](=O)Cc1cc(NC[C@@H](O)c2ccccc2)ccc1Cl	ZINC000819442009	DG	On-Demand	Anodyne	ADRB1	15	43
C[S@](=O)Cc1cc(NC[C@H](O)c2ccccc2)ccc1Cl	ZINC000819442010	DG	On-Demand	Anodyne	ADRB1	15	43
CCSc1cccc(NC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819442014	EH	On-Demand	Anodyne	MTNR1A	17	41
CCSc1cccc(NC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819442015	EH	On-Demand	Anodyne	MTNR1A	17	41
CON(C)C(=O)CCNc1ccc2c(c1)CCN2C(=O)c1cccnc1	ZINC000819442016	FE	On-Demand	Anodyne	HTR2C	15	40
CON(C)C(=O)CCNc1ccc2c(c1)CCN2C(=O)c1cccnc1	ZINC000819442016	FE	On-Demand	Anodyne	CYP11B2	16	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(CN2CCC(O)CC2)cc1	ZINC000819442043	GE	On-Demand	Anodyne	LTA4H	21	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(CN2CCC(O)CC2)cc1	ZINC000819442043	GE	On-Demand	Anodyne	SIGMAR1	21	43
O[C@@H](CNc1ccc(OCC2CC2)cc1)COc1ccccc1F	ZINC000819442049	EG	On-Demand	Anodyne	ADRB2	42	40
O[C@@H](CNc1ccc(OCC2CC2)cc1)COc1ccccc1F	ZINC000819442049	EG	On-Demand	Anodyne	ADRB1	76	42
O[C@H](CNc1ccc(OCC2CC2)cc1)COc1ccccc1F	ZINC000819442050	EG	On-Demand	Anodyne	ADRB2	42	40
O[C@H](CNc1ccc(OCC2CC2)cc1)COc1ccccc1F	ZINC000819442050	EG	On-Demand	Anodyne	ADRB1	76	42
CC(C)(C)OC(=O)N1CCc2c(cccc2NC[C@H](O)C2CC2)C1	ZINC000819442058	EG	On-Demand	Anodyne	GPR119	36	41
CC(C)(C)OC(=O)N1CCc2c(cccc2NC[C@@H](O)C2CC2)C1	ZINC000819442059	EG	On-Demand	Anodyne	GPR119	36	41
Cc1ccc(NC[C@H](O)c2ccccc2)cc1OC(F)F	ZINC000819442077	CH	On-Demand	Anodyne	ADRB2	15	47
Cc1ccc(NC[C@@H](O)c2ccccc2)cc1OC(F)F	ZINC000819442078	CH	On-Demand	Anodyne	ADRB2	15	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(OCC3CC3)cc2)c1	ZINC000819442080	FG	On-Demand	Bother	ADRB2	30	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(OCC3CC3)cc2)c1	ZINC000819442080	FG	On-Demand	Bother	ADRB1	61	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(OCC3CC3)cc2)c1	ZINC000819442080	FG	On-Demand	Bother	ADRB3	35	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(OCC3CC3)cc2)c1	ZINC000819442081	FG	On-Demand	Bother	ADRB2	30	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(OCC3CC3)cc2)c1	ZINC000819442081	FG	On-Demand	Bother	ADRB1	61	47
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(OCC3CC3)cc2)c1	ZINC000819442081	FG	On-Demand	Bother	ADRB3	35	47
CC(=O)Nc1cccc(CC(=O)NCC2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000819442082	FE	On-Demand	Anodyne	CACNA1I	61	38
CC(=O)Nc1cccc(CC(=O)NCC2CN(C(=O)OC(C)(C)C)C2)c1	ZINC000819442082	FE	On-Demand	Anodyne	GPR119	27	46
CC(C)(C)OC(=O)N1CCc2c(cccc2NCCS(C)(=O)=O)C1	ZINC000819442084	FE	On-Demand	Anodyne	GPR119	41	42
O[C@H](CNc1ccc(OCC2CC2)cc1)COCc1ccccc1F	ZINC000819442099	EH	On-Demand	Anodyne	ADRB1	36	42
O[C@@H](CNc1ccc(OCC2CC2)cc1)COCc1ccccc1F	ZINC000819442100	EH	On-Demand	Anodyne	ADRB1	36	42
C[S@@](=O)Cc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819442109	CE	On-Demand	Anodyne	ADRB2	24	43
C[S@@](=O)Cc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819442109	CE	On-Demand	Anodyne	ADRB1	24	41
C[S@@](=O)Cc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819442109	CE	On-Demand	Anodyne	ADRB3	89	43
C[S@@](=O)Cc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819442110	CE	On-Demand	Anodyne	ADRB2	24	43
C[S@@](=O)Cc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819442110	CE	On-Demand	Anodyne	ADRB1	24	41
C[S@@](=O)Cc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819442110	CE	On-Demand	Anodyne	ADRB3	89	43
C[S@](=O)Cc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819442111	CE	On-Demand	Anodyne	ADRB2	24	43
C[S@](=O)Cc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819442111	CE	On-Demand	Anodyne	ADRB1	24	41
C[S@](=O)Cc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819442111	CE	On-Demand	Anodyne	ADRB3	89	43
C[S@](=O)Cc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819442112	CE	On-Demand	Anodyne	ADRB2	24	43
C[S@](=O)Cc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819442112	CE	On-Demand	Anodyne	ADRB1	24	41
C[S@](=O)Cc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819442112	CE	On-Demand	Anodyne	ADRB3	89	43
CC(=O)NCc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819442132	FG	On-Demand	Anodyne	TRPV1	23	41
CC(=O)NCc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819442133	FG	On-Demand	Anodyne	TRPV1	23	41
C[S@](=O)Cc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1Cl	ZINC000819442164	FI	On-Demand	Anodyne	ADRB2	16	53
C[S@](=O)Cc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1Cl	ZINC000819442164	FI	On-Demand	Anodyne	ADRB1	29	53
C[S@](=O)Cc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1Cl	ZINC000819442164	FI	On-Demand	Anodyne	ADRB3	45	41
C[S@@](=O)Cc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1Cl	ZINC000819442165	FI	On-Demand	Anodyne	ADRB2	16	53
C[S@@](=O)Cc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1Cl	ZINC000819442165	FI	On-Demand	Anodyne	ADRB1	29	53
C[S@@](=O)Cc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1Cl	ZINC000819442165	FI	On-Demand	Anodyne	ADRB3	45	41
C[S@@](=O)Cc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1Cl	ZINC000819442166	FI	On-Demand	Anodyne	ADRB2	16	53
C[S@@](=O)Cc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1Cl	ZINC000819442166	FI	On-Demand	Anodyne	ADRB1	29	53
C[S@@](=O)Cc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1Cl	ZINC000819442166	FI	On-Demand	Anodyne	ADRB3	45	41
C[S@](=O)Cc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1Cl	ZINC000819442167	FI	On-Demand	Anodyne	ADRB2	16	53
C[S@](=O)Cc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1Cl	ZINC000819442167	FI	On-Demand	Anodyne	ADRB1	29	53
C[S@](=O)Cc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1Cl	ZINC000819442167	FI	On-Demand	Anodyne	ADRB3	45	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC3CC3)cc2)c1	ZINC000819442184	FH	On-Demand	Anodyne	ADRB2	47	43
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC3CC3)cc2)c1	ZINC000819442184	FH	On-Demand	Anodyne	ADRB1	80	43
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC3CC3)cc2)c1	ZINC000819442184	FH	On-Demand	Anodyne	ADRB3	51	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC3CC3)cc2)c1	ZINC000819442184	FH	On-Demand	Anodyne	ABCB1	20	44
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC3CC3)cc2)c1	ZINC000819442185	FH	On-Demand	Anodyne	ADRB2	47	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC3CC3)cc2)c1	ZINC000819442185	FH	On-Demand	Anodyne	ADRB1	80	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC3CC3)cc2)c1	ZINC000819442185	FH	On-Demand	Anodyne	ADRB3	51	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC3CC3)cc2)c1	ZINC000819442185	FH	On-Demand	Anodyne	ABCB1	20	44
CCOC[C@H](O)CNc1ccc(OC2CCCCC2)cc1	ZINC000819442268	CG	On-Demand	Anodyne	ADRB1	29	42
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccc(C)cc2)cc1)C(C)C	ZINC000819442282	EH	On-Demand	Anodyne	ADRB2	15	49
CC(=O)N(Cc1ccc(NC[C@@H](O)c2ccc(C)cc2)cc1)C(C)C	ZINC000819442283	EH	On-Demand	Anodyne	ADRB2	15	49
O[C@@H](CNc1ccc(OC2CCCCC2)cc1)COC1CCOCC1	ZINC000819442313	EG	On-Demand	Anodyne	ADRB1	24	44
O[C@H](CNc1ccc(OC2CCCCC2)cc1)COC1CCOCC1	ZINC000819442314	EG	On-Demand	Anodyne	ADRB1	24	44
CC[C@H](O)CNc1ccc(OC)c(NC(=O)C2CCCCC2)c1	ZINC000819442327	DG	On-Demand	Anodyne	STK17B	46	48
CC[C@H](O)CNc1ccc(OC)c(NC(=O)C2CCCCC2)c1	ZINC000819442327	DG	On-Demand	Anodyne	STK17A	16	43
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OC3CCCCC3)cc2)cc1	ZINC000819442362	GH	On-Demand	Anodyne	ADRB1	16	40
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OC3CCCCC3)cc2)cc1	ZINC000819442362	GH	On-Demand	Anodyne	ADRB3	29	40
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OC3CCCCC3)cc2)cc1	ZINC000819442363	GH	On-Demand	Anodyne	ADRB1	16	40
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OC3CCCCC3)cc2)cc1	ZINC000819442363	GH	On-Demand	Anodyne	ADRB3	29	40
COC[C@@H](O)CNc1ccc(OC2CCCCC2)cc1	ZINC000819442370	CF	On-Demand	Anodyne	ADRB1	34	45
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC3CCCCC3)cc2)cc1	ZINC000819442472	GI	On-Demand	Anodyne	ADRB2	50	60
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC3CCCCC3)cc2)cc1	ZINC000819442472	GI	On-Demand	Anodyne	ADRB1	83	60
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC3CCCCC3)cc2)cc1	ZINC000819442472	GI	On-Demand	Anodyne	ADRB3	55	49
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC3CCCCC3)cc2)cc1	ZINC000819442473	GI	On-Demand	Anodyne	ADRB2	50	60
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC3CCCCC3)cc2)cc1	ZINC000819442473	GI	On-Demand	Anodyne	ADRB1	83	60
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC3CCCCC3)cc2)cc1	ZINC000819442473	GI	On-Demand	Anodyne	ADRB3	55	49
O=C(c1cc2ccccn2c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442503	CD	On-Demand	Anodyne	CPT1A	57	34
O=C(c1cc2ccccn2c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442504	CD	On-Demand	Anodyne	CPT1A	57	34
O=C(Cn1cnc2c(oc3ccccc32)c1=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442505	FD	On-Demand	Anodyne	CPT1A	74	36
O=C(Cn1cnc2c(oc3ccccc32)c1=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442506	FD	On-Demand	Anodyne	CPT1A	74	36
O=C(COc1cccc(Br)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442507	FD	On-Demand	Anodyne	PRCP	20	40
O=C(COc1cccc(Br)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442507	FD	On-Demand	Anodyne	CPT1A	154	49
O=C(COc1cccc(Br)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442507	FD	On-Demand	Anodyne	CPT2	50	39
O=C(COc1cccc(Br)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442508	FD	On-Demand	Anodyne	PRCP	20	40
O=C(COc1cccc(Br)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442508	FD	On-Demand	Anodyne	CPT1A	154	49
O=C(COc1cccc(Br)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442508	FD	On-Demand	Anodyne	CPT2	50	39
O=C([C@@H]1C[C@]12CCCc1ccccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442524	DE	On-Demand	Anodyne	CPT1A	40	33
O=C([C@@H]1C[C@@]12CCCc1ccccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442525	DE	On-Demand	Anodyne	CPT1A	40	33
O=C([C@@H]1C[C@]12CCCc1ccccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442526	DE	On-Demand	Anodyne	CPT1A	40	33
O=C([C@@H]1C[C@@]12CCCc1ccccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442527	DE	On-Demand	Anodyne	CPT1A	40	33
O=C(/C=C\c1cccc(O)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442544	CD	On-Demand	Anodyne	CPT1A	66	36
O=C(/C=C/c1cccc(O)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442545	CD	On-Demand	Anodyne	CPT1A	66	36
O=C(/C=C/c1cccc(O)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442546	CD	On-Demand	Anodyne	CPT1A	66	36
O=C(/C=C\c1cccc(O)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442547	CD	On-Demand	Anodyne	CPT1A	66	36
O=C(c1ccc2nccn2c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442554	CC	On-Demand	Anodyne	CPT1A	18	42
O=C(c1ccc2nccn2c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442555	CC	On-Demand	Anodyne	CPT1A	18	42
O=C(Nc1ccccc1)N1CCC[C@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)C1	ZINC000819442556	FD	On-Demand	Anodyne	CPT1A	79	39
O=C(Nc1ccccc1)N1CCC[C@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)C1	ZINC000819442556	FD	On-Demand	Anodyne	PREP	76	37
O=C(Nc1ccccc1)N1CCC[C@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)C1	ZINC000819442556	FD	On-Demand	Anodyne	CXCR3	18	40
O=C(Nc1ccccc1)N1CCC[C@@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)C1	ZINC000819442557	FD	On-Demand	Anodyne	CPT1A	79	39
O=C(Nc1ccccc1)N1CCC[C@@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)C1	ZINC000819442557	FD	On-Demand	Anodyne	PREP	76	37
O=C(Nc1ccccc1)N1CCC[C@@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)C1	ZINC000819442557	FD	On-Demand	Anodyne	CXCR3	18	40
O=C(Nc1ccccc1)N1CCC[C@@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)C1	ZINC000819442558	FD	On-Demand	Anodyne	CPT1A	79	39
O=C(Nc1ccccc1)N1CCC[C@@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)C1	ZINC000819442558	FD	On-Demand	Anodyne	PREP	76	37
O=C(Nc1ccccc1)N1CCC[C@@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)C1	ZINC000819442558	FD	On-Demand	Anodyne	CXCR3	18	40
O=C(Nc1ccccc1)N1CCC[C@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)C1	ZINC000819442559	FD	On-Demand	Anodyne	CPT1A	79	39
O=C(Nc1ccccc1)N1CCC[C@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)C1	ZINC000819442559	FD	On-Demand	Anodyne	PREP	76	37
O=C(Nc1ccccc1)N1CCC[C@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)C1	ZINC000819442559	FD	On-Demand	Anodyne	CXCR3	18	40
O=C(CCSc1ccc(Cl)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442560	EF	On-Demand	Anodyne	PRCP	29	41
O=C(CCSc1ccc(Cl)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442560	EF	On-Demand	Anodyne	CPT1A	72	38
O=C(CCSc1ccc(Cl)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442561	EF	On-Demand	Anodyne	PRCP	29	41
O=C(CCSc1ccc(Cl)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442561	EF	On-Demand	Anodyne	CPT1A	72	38
O=C(c1cc(C2CC2)nc2ccccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442562	EF	On-Demand	Anodyne	CPT1A	76	37
O=C(c1cc(C2CC2)nc2ccccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442563	EF	On-Demand	Anodyne	CPT1A	76	37
O=C1CCC(C(=O)N2CCC[C@H]2c2nn[nH]n2)=NN1Cc1ccccc1	ZINC000819442564	FD	On-Demand	Anodyne	PREP	42	33
O=C1CCC(C(=O)N2CCC[C@@H]2c2nn[nH]n2)=NN1Cc1ccccc1	ZINC000819442565	FD	On-Demand	Anodyne	PREP	42	33
O=C(CCSCc1ccccn1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442568	DD	On-Demand	Anodyne	CPT1A	102	39
O=C(CCSCc1ccccn1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442569	DD	On-Demand	Anodyne	CPT1A	102	39
O=C(CCOc1ccccc1F)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442578	DD	On-Demand	Anodyne	CPT1A	111	46
O=C(CCOc1ccccc1F)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442579	DD	On-Demand	Anodyne	CPT1A	111	46
O=C(c1csc(-c2ccc(F)cc2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442592	EE	On-Demand	Anodyne	CPT1A	44	49
O=C(c1csc(-c2ccc(F)cc2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442593	EE	On-Demand	Anodyne	CPT1A	44	49
O=C(CS(=O)(=O)Cc1cccc(Br)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442596	HD	On-Demand	Anodyne	CPT1A	52	37
O=C(CS(=O)(=O)Cc1cccc(Br)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442597	HD	On-Demand	Anodyne	CPT1A	52	37
COC(=O)c1cc(C(=O)N2CCC[C@H]2c2nn[nH]n2)ccn1	ZINC000819442600	DC	On-Demand	Anodyne	CPT1A	55	36
COC(=O)c1cc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)ccn1	ZINC000819442601	DC	On-Demand	Anodyne	CPT1A	55	36
Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442602	GG	On-Demand	Anodyne	CPT1A	41	41
Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442603	GG	On-Demand	Anodyne	CPT1A	41	41
COc1cccc([S@@](=O)CC(=O)N[C@@H](C)C(=O)OCC(C)C)c1	ZINC000819442620	ED	On-Demand	Anodyne	MTNR1A	27	42
COc1cccc([S@@](=O)CC(=O)N[C@@H](C)C(=O)OCC(C)C)c1	ZINC000819442620	ED	On-Demand	Anodyne	MTNR1B	29	42
Cc1ccc(OC[C@@H](O)CNc2ccc(CNC(=O)OC(C)C)cc2)cc1	ZINC000819442632	FG	On-Demand	Anodyne	ADRB2	50	50
Cc1ccc(OC[C@@H](O)CNc2ccc(CNC(=O)OC(C)C)cc2)cc1	ZINC000819442632	FG	On-Demand	Anodyne	ADRB1	73	46
Cc1ccc(OC[C@@H](O)CNc2ccc(CNC(=O)OC(C)C)cc2)cc1	ZINC000819442632	FG	On-Demand	Anodyne	ADRB3	48	45
Cc1ccc(OC[C@@H](O)CNc2ccc(CNC(=O)OC(C)C)cc2)cc1	ZINC000819442632	FG	On-Demand	Anodyne	PDS	68	45
Cc1ccc(OC[C@H](O)CNc2ccc(CNC(=O)OC(C)C)cc2)cc1	ZINC000819442633	FG	On-Demand	Anodyne	ADRB2	50	50
Cc1ccc(OC[C@H](O)CNc2ccc(CNC(=O)OC(C)C)cc2)cc1	ZINC000819442633	FG	On-Demand	Anodyne	ADRB1	73	46
Cc1ccc(OC[C@H](O)CNc2ccc(CNC(=O)OC(C)C)cc2)cc1	ZINC000819442633	FG	On-Demand	Anodyne	ADRB3	48	45
Cc1ccc(OC[C@H](O)CNc2ccc(CNC(=O)OC(C)C)cc2)cc1	ZINC000819442633	FG	On-Demand	Anodyne	PDS	68	45
CCC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442652	FF	On-Demand	Mild	F2	17	41
CCC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442652	FF	On-Demand	Mild	PLG	16	41
CCC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442652	FF	On-Demand	Mild	CELA1	47	43
CCC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442652	FF	On-Demand	Mild	HLA-DRB3	52	35
CCC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442652	FF	On-Demand	Mild	PAPA1_CARPA	30	42
CCC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442652	FF	On-Demand	Mild	TRY1_BOVIN	33	41
CCC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442652	FF	On-Demand	Mild	NTSR1	34	40
CCC(=O)[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442652	FF	On-Demand	Mild	CTSK	15	41
CCC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442653	FF	On-Demand	Mild	F2	17	41
CCC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442653	FF	On-Demand	Mild	PLG	16	41
CCC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442653	FF	On-Demand	Mild	CELA1	47	43
CCC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442653	FF	On-Demand	Mild	HLA-DRB3	52	35
CCC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442653	FF	On-Demand	Mild	PAPA1_CARPA	30	42
CCC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442653	FF	On-Demand	Mild	TRY1_BOVIN	33	41
CCC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442653	FF	On-Demand	Mild	NTSR1	34	40
CCC(=O)[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442653	FF	On-Demand	Mild	CTSK	15	41
CCC(=O)[C@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442654	FF	On-Demand	Mild	F2	17	41
CCC(=O)[C@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442654	FF	On-Demand	Mild	PLG	16	41
CCC(=O)[C@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442654	FF	On-Demand	Mild	CELA1	47	43
CCC(=O)[C@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442654	FF	On-Demand	Mild	HLA-DRB3	52	35
CCC(=O)[C@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442654	FF	On-Demand	Mild	PAPA1_CARPA	30	42
CCC(=O)[C@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442654	FF	On-Demand	Mild	TRY1_BOVIN	33	41
CCC(=O)[C@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442654	FF	On-Demand	Mild	NTSR1	34	40
CCC(=O)[C@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442654	FF	On-Demand	Mild	CTSK	15	41
CCC(=O)[C@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442655	FF	On-Demand	Mild	F2	17	41
CCC(=O)[C@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442655	FF	On-Demand	Mild	PLG	16	41
CCC(=O)[C@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442655	FF	On-Demand	Mild	CELA1	47	43
CCC(=O)[C@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442655	FF	On-Demand	Mild	HLA-DRB3	52	35
CCC(=O)[C@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442655	FF	On-Demand	Mild	PAPA1_CARPA	30	42
CCC(=O)[C@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442655	FF	On-Demand	Mild	TRY1_BOVIN	33	41
CCC(=O)[C@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442655	FF	On-Demand	Mild	NTSR1	34	40
CCC(=O)[C@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819442655	FF	On-Demand	Mild	CTSK	15	41
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819442656	GF	On-Demand	Bother	ADRB2	22	41
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819442656	GF	On-Demand	Bother	ADRB1	49	35
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819442656	GF	On-Demand	Bother	COLA	79	33
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819442657	GF	On-Demand	Bother	ADRB2	22	41
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819442657	GF	On-Demand	Bother	ADRB1	49	35
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819442657	GF	On-Demand	Bother	COLA	79	33
COC(=O)N(C)Cc1ccc(NCCC(=O)Nc2ccc(Cl)cc2)cc1	ZINC000819442671	GH	On-Demand	Anodyne	LTA4H	24	44
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1)C(C)C	ZINC000819442771	GJ	On-Demand	Anodyne	ADRB2	19	43
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1)C(C)C	ZINC000819442771	GJ	On-Demand	Anodyne	ADRB1	17	42
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1)C(C)C	ZINC000819442772	GJ	On-Demand	Anodyne	ADRB2	19	43
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1)C(C)C	ZINC000819442772	GJ	On-Demand	Anodyne	ADRB1	17	42
O[C@@H](CNc1cccc(CSC2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819442789	GJ	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNc1cccc(CSC2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819442789	GJ	On-Demand	Anodyne	CYP3A4	45	35
O[C@H](CNc1cccc(CSC2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819442790	GJ	On-Demand	Anodyne	ADRB1	27	40
O[C@H](CNc1cccc(CSC2CCOCC2)c1)c1cccc(Cl)c1	ZINC000819442790	GJ	On-Demand	Anodyne	CYP3A4	45	35
O=C(Cc1csc(COc2ccc(Cl)cc2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442820	HF	On-Demand	Anodyne	CPT1A	101	49
O=C(Cc1csc(COc2ccc(Cl)cc2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442821	HF	On-Demand	Anodyne	CPT1A	101	49
COCCCOc1cccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819442824	ED	On-Demand	Anodyne	CPT1A	118	39
COCCCOc1cccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819442824	ED	On-Demand	Anodyne	CFTR	44	38
COCCCOc1cccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819442825	ED	On-Demand	Anodyne	CPT1A	118	39
COCCCOc1cccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819442825	ED	On-Demand	Anodyne	CFTR	44	38
O=C(Nc1ccccc1)c1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819442838	FE	On-Demand	Anodyne	AVPR2	60	42
O=C(Nc1ccccc1)c1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819442838	FE	On-Demand	Anodyne	AVPR1A	29	40
O=C(Nc1ccccc1)c1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819442838	FE	On-Demand	Anodyne	CPT1A	72	38
O=C(Nc1ccccc1)c1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819442838	FE	On-Demand	Anodyne	PRNP	57	35
O=C(Nc1ccccc1)c1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819442838	FE	On-Demand	Anodyne	NOD2	42	38
O=C(Nc1ccccc1)c1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819442839	FE	On-Demand	Anodyne	AVPR2	60	42
O=C(Nc1ccccc1)c1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819442839	FE	On-Demand	Anodyne	AVPR1A	29	40
O=C(Nc1ccccc1)c1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819442839	FE	On-Demand	Anodyne	CPT1A	72	38
O=C(Nc1ccccc1)c1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819442839	FE	On-Demand	Anodyne	PRNP	57	35
O=C(Nc1ccccc1)c1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819442839	FE	On-Demand	Anodyne	NOD2	42	38
O=C(c1cccc(COc2cccc(F)c2)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442844	FF	On-Demand	Anodyne	CPT1A	100	42
O=C(c1cccc(COc2cccc(F)c2)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442844	FF	On-Demand	Anodyne	GRM5	17	43
O=C(c1cccc(COc2cccc(F)c2)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442845	FF	On-Demand	Anodyne	CPT1A	100	42
O=C(c1cccc(COc2cccc(F)c2)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442845	FF	On-Demand	Anodyne	GRM5	17	43
NC(=O)NCc1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819442852	DC	On-Demand	Anodyne	TMPRSS11D	61	34
NC(=O)NCc1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819442853	DC	On-Demand	Anodyne	TMPRSS11D	61	34
O=C(c1ccc(=O)n(Cc2ccccc2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442858	FC	On-Demand	Anodyne	CPT1A	79	38
O=C(c1ccc(=O)n(Cc2ccccc2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442858	FC	On-Demand	Anodyne	PREP	54	32
O=C(c1ccc(=O)n(Cc2ccccc2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442859	FC	On-Demand	Anodyne	CPT1A	79	38
O=C(c1ccc(=O)n(Cc2ccccc2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442859	FC	On-Demand	Anodyne	PREP	54	32
O=C(Cc1cc(F)ccc1Br)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442864	FE	On-Demand	Anodyne	CPT1A	45	40
O=C(Cc1cc(F)ccc1Br)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442865	FE	On-Demand	Anodyne	CPT1A	45	40
O=C(Cc1csc2nccn12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442868	DC	On-Demand	Anodyne	CPT1A	46	35
O=C(Cc1csc2nccn12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442869	DC	On-Demand	Anodyne	CPT1A	46	35
COc1ccc(-n2cnnc2SCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819442870	GD	On-Demand	Anodyne	CPT1A	68	46
COc1ccc(-n2cnnc2SCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819442871	GD	On-Demand	Anodyne	CPT1A	68	46
O=C(c1nc(C2CC2)n(-c2ccccc2Cl)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442874	GE	On-Demand	Anodyne	CPT1A	41	34
O=C(c1nc(C2CC2)n(-c2ccccc2Cl)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442875	GE	On-Demand	Anodyne	CPT1A	41	34
COC(=O)N(C)Cc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819442912	GE	On-Demand	Anodyne	LIMK2	20	43
COC(=O)N(C)Cc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819442914	GE	On-Demand	Anodyne	LIMK2	20	43
O=C(O)CCCNC(=O)NNC(=O)Cc1ccc2ccccc2c1	ZINC000819442919	ED	On-Demand	Reactive	MME	20	40
O=C(O)CCCNC(=O)NNC(=O)Cc1ccc2ccccc2c1	ZINC000819442919	ED	On-Demand	Reactive	NPR1	42	34
O=C(O)CCCNC(=O)NNC(=O)Cc1ccc2ccccc2c1	ZINC000819442919	ED	On-Demand	Reactive	CXCR4	46	37
O=C(O)CCCNC(=O)NNC(=O)Cc1ccc2ccccc2c1	ZINC000819442919	ED	On-Demand	Reactive	FURIN	48	37
O=C(O)CCCNC(=O)NNC(=O)Cc1ccc2ccccc2c1	ZINC000819442919	ED	On-Demand	Reactive	POLG_WNV	42	31
O=C(O)CCCNC(=O)Nc1cccc(-n2cccn2)c1	ZINC000819442925	CD	On-Demand	Anodyne	CCR3	25	45
O=C(O)CCCNC(=O)Nc1cccc(-n2cccn2)c1	ZINC000819442925	CD	On-Demand	Anodyne	AMP1_PLAFQ	45	34
O=C(O)CCCNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000819442934	DE	On-Demand	Bother	TBXA2R	19	41
O=C(O)CCCNC(=O)Nc1ccc(-n2nccn2)cc1	ZINC000819442937	CD	On-Demand	Anodyne	FOLH1	20	45
O=C(O)CCCNC(=O)Nc1ccc(-n2nccn2)cc1	ZINC000819442937	CD	On-Demand	Anodyne	DOT1L	54	32
O=C(O)CCCNC(=O)Nc1ccc(N2CCSCC2)c(Cl)c1	ZINC000819442938	FF	On-Demand	Anodyne	FOLH1	16	43
O=C(O)CCCNC(=O)Nc1ccc(N2CCSCC2)c(Cl)c1	ZINC000819442938	FF	On-Demand	Anodyne	NPY2R	72	42
O=C(O)CCCNC(=O)Nc1ccc(N2CCSCC2)cc1	ZINC000819442941	DE	On-Demand	Anodyne	FOLH1	17	44
O=C(O)CCCNC(=O)Nc1ccc(N2CCSCC2)cc1	ZINC000819442941	DE	On-Demand	Anodyne	CCR3	15	40
O=C(O)CCCNC(=O)Nc1ccc(N2CCSCC2)cc1	ZINC000819442941	DE	On-Demand	Anodyne	EPHX2	22	45
O=C(O)CCCNC(=O)Nc1ccc(-n2cccn2)c(F)c1	ZINC000819442948	DD	On-Demand	Anodyne	FOLH1	15	44
O=C(O)CCCNC(=O)Nc1ccc(-n2cccn2)c(F)c1	ZINC000819442948	DD	On-Demand	Anodyne	NPY2R	42	33
O=C(O)CCCNC(=O)Nc1ccc(-n2cccn2)c(F)c1	ZINC000819442948	DD	On-Demand	Anodyne	CCR3	31	43
O=C(c1cccc2ccccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442949	CE	On-Demand	Anodyne	HCRTR1	37	48
O=C(c1cccc2ccccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442949	CE	On-Demand	Anodyne	CPT1A	81	39
O=C(c1cccc2ccccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442949	CE	On-Demand	Anodyne	PREP	35	42
O=C(c1cccc2ccccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819442949	CE	On-Demand	Anodyne	NR1D1	42	42
O=C(O)CCCNC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1	ZINC000819442951	EG	On-Demand	Anodyne	FASN	19	40
O=C(O)CCCNC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1	ZINC000819442951	EG	On-Demand	Anodyne	HPSE	59	40
O=C(O)CCCNC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1	ZINC000819442951	EG	On-Demand	Anodyne	AGPAT2	22	40
O=C(O)CCCNC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1	ZINC000819442951	EG	On-Demand	Anodyne	IMDH_CRYPV	37	42
O=C(c1cccc2ccccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442952	CE	On-Demand	Anodyne	HCRTR1	37	48
O=C(c1cccc2ccccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442952	CE	On-Demand	Anodyne	CPT1A	81	39
O=C(c1cccc2ccccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442952	CE	On-Demand	Anodyne	PREP	35	42
O=C(c1cccc2ccccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819442952	CE	On-Demand	Anodyne	NR1D1	42	42
CCc1nc(-c2ccc(C(=O)N3CCC[C@@H]3c3nn[nH]n3)cc2)n[nH]1	ZINC000819442955	ED	On-Demand	Anodyne	CPT1A	43	35
CCc1nc(-c2ccc(C(=O)N3CCC[C@H]3c3nn[nH]n3)cc2)n[nH]1	ZINC000819442959	ED	On-Demand	Anodyne	CPT1A	43	35
O=C(O)CCCNC(=O)NNc1cccc([N+](=O)[O-])c1	ZINC000819442960	CD	On-Demand	Reactive	CACNA1D	57	35
O=C(O)CCCNC(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	ZINC000819442962	ED	On-Demand	Anodyne	HRH2	25	41
O=C(O)CCCNC(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	ZINC000819442962	ED	On-Demand	Anodyne	FOLH1	26	44
O=C(O)CCCNC(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	ZINC000819442962	ED	On-Demand	Anodyne	CCR3	21	43
O=C(O)CCCNC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000819442964	DC	On-Demand	Reactive	CACNA1D	51	34
O=C(O)CCCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819442965	DC	On-Demand	Reactive	EDNRA	15	41
O=C(O)CCCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819442965	DC	On-Demand	Reactive	TPR	15	45
O=C(O)CCCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819442965	DC	On-Demand	Reactive	CCKAR	70	46
O=C(O)CCCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819442965	DC	On-Demand	Reactive	BRS3	24	41
O=C(O)CCCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819442965	DC	On-Demand	Reactive	MC1R	48	37
O=C(O)CCCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819442965	DC	On-Demand	Reactive	MMP1	16	42
O=C(O)CCCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819442965	DC	On-Demand	Reactive	KISS1R	64	33
O=C(O)CCCNC(=O)Nc1cccc(CN2CCOC2=O)c1	ZINC000819442971	DD	On-Demand	Anodyne	HRH2	41	45
O=C(O)CCCNC(=O)Nc1cccc(CN2CCOC2=O)c1	ZINC000819442971	DD	On-Demand	Anodyne	CCR3	43	41
O=C(O)CCCNC(=O)Nc1cccc(CN2CCOC2=O)c1	ZINC000819442971	DD	On-Demand	Anodyne	EPHX2	15	40
O=C(O)CCCNC(=O)Nc1ccc(-c2csnn2)cc1	ZINC000819442975	DE	On-Demand	Anodyne	FOLH1	15	45
O=C(O)CCCNC(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819442976	DD	On-Demand	Reactive	EPHX2	39	63
O=C(O)CCCNC(=O)NCc1ccccc1O	ZINC000819442989	CD	On-Demand	Clean	MME	19	47
O=C(O)CCCNC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1	ZINC000819442991	FC	On-Demand	Anodyne	PIK3CA	35	42
O=C(O)CCCNC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1	ZINC000819442991	FC	On-Demand	Anodyne	CHRNA7	16	53
O=C(O)CCCNC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1	ZINC000819442991	FC	On-Demand	Anodyne	MTOR	88	42
O=C(O)CCCNC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1	ZINC000819442991	FC	On-Demand	Anodyne	EPHX2	36	48
O=C(O)CCCNC(=O)Nc1ccc(NC(=O)CN2CCOCC2)cc1	ZINC000819442991	FC	On-Demand	Anodyne	PIK3CG	33	40
O=C(O)CCCNC(=O)Nc1ccc2c(c1)oc1ccccc12	ZINC000819442998	DH	On-Demand	Anodyne	ECE1	18	41
O=C(O)CCCNC(=O)Nc1ccc2c(c1)oc1ccccc12	ZINC000819442998	DH	On-Demand	Anodyne	MMP12	27	43
O=C(O)CCCNC(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819443000	DE	On-Demand	Anodyne	FOLH1	15	43
O=C(O)CCCNC(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819443000	DE	On-Demand	Anodyne	KCNQ2	48	34
O=C(O)CCCNC(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819443000	DE	On-Demand	Anodyne	NPY2R	96	42
O=C(O)CCCNC(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819443000	DE	On-Demand	Anodyne	CCR3	38	41
O=C(O)CCCNC(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000819443000	DE	On-Demand	Anodyne	EPHX2	16	42
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000819443006	EG	On-Demand	Anodyne	TSHR	49	37
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000819443006	EG	On-Demand	Anodyne	FOLH1	23	43
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000819443006	EG	On-Demand	Anodyne	LTA4H	29	46
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000819443006	EG	On-Demand	Anodyne	CA1	38	44
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000819443006	EG	On-Demand	Anodyne	EPHX2	22	46
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000819443006	EG	On-Demand	Anodyne	CA12	18	44
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000819443006	EG	On-Demand	Anodyne	CA9	19	44
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000819443006	EG	On-Demand	Anodyne	FFAR1	37	42
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000819443006	EG	On-Demand	Anodyne	NCE103	19	43
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000819443006	EG	On-Demand	Anodyne	FFAR4	60	42
O=C(O)CCCNC(=O)Nc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819443008	EG	On-Demand	Anodyne	HRH2	26	42
O=C(O)CCCNC(=O)Nc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819443008	EG	On-Demand	Anodyne	FOLH1	18	43
O=C(O)CCCNC(=O)Nc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819443008	EG	On-Demand	Anodyne	KCNQ2	52	36
O=C(O)CCCNC(=O)Nc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819443008	EG	On-Demand	Anodyne	NPY2R	80	48
O=C(O)CCCNC(=O)Nc1ccc(N2CCCCC2)c(Cl)c1	ZINC000819443008	EG	On-Demand	Anodyne	EPHX2	18	49
O=C(O)CCCNC(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1	ZINC000819443027	FH	On-Demand	Anodyne	ST14	40	34
O=C(O)CCCNC(=O)Nc1ccc(Cc2nc3ccccc3s2)cc1	ZINC000819443027	FH	On-Demand	Anodyne	TMPRSS6	66	34
O=C(O)CCCNC(=O)Nc1cccc(-n2ccnn2)c1	ZINC000819443031	CD	On-Demand	Anodyne	TBXAS1	15	41
O=C(O)CCCNC(=O)NNC(=O)COc1ccc(F)cc1	ZINC000819443033	DC	On-Demand	Reactive	PLA2G4B	50	36
O=C(O)CCCNC(=O)NNC(=O)COc1ccc(Br)cc1	ZINC000819443039	FD	On-Demand	Reactive	PLA2G4B	54	37
O=C(O)CCCNC(=O)NNC(=O)COc1ccc(Br)cc1	ZINC000819443039	FD	On-Demand	Reactive	TRAR	21	41
O=C(O)CCCNC(=O)Nc1ccc(-c2ccccc2)nn1	ZINC000819443044	DE	On-Demand	Anodyne	FOLH1	46	37
O=C(O)CCCNC(=O)Nc1ccc(-c2ccccc2)nn1	ZINC000819443044	DE	On-Demand	Anodyne	MME	17	40
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819443052	FG	On-Demand	Anodyne	EGFR	28	46
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819443052	FG	On-Demand	Anodyne	PPIA	37	40
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819443052	FG	On-Demand	Anodyne	ERBB2	47	46
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccn2)c(Cl)c1	ZINC000819443052	FG	On-Demand	Anodyne	GRM4	57	48
O=C(O)CCCNC(=O)NNC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819443054	FF	On-Demand	Reactive	FOLH1	31	47
O=C(O)CCCNC(=O)NNC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819443054	FF	On-Demand	Reactive	MME	25	45
O=C(O)CCCNC(=O)NNC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819443054	FF	On-Demand	Reactive	CA1	33	45
O=C(O)CCCNC(=O)NNC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819443054	FF	On-Demand	Reactive	EPHX2	17	49
O=C(O)CCCNC(=O)NNC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819443054	FF	On-Demand	Reactive	SLC1A2	20	40
O=C(O)CCCNC(=O)Nc1ccc(-n2cccn2)cc1	ZINC000819443056	CD	On-Demand	Anodyne	FOLH1	18	46
O=C(O)CCCNC(=O)Nc1ccc(-n2cccn2)cc1	ZINC000819443056	CD	On-Demand	Anodyne	AMP1_PLAFQ	57	41
O=C(O)CCCNC(=O)Nc1ccc(-n2cccn2)cc1	ZINC000819443056	CD	On-Demand	Anodyne	DOT1L	41	33
O=C(O)CCCNC(=O)NNC(=O)c1ccc(Cl)cc1Cl	ZINC000819443058	ED	On-Demand	Reactive	FOLH1	31	40
O=C(O)CCCNC(=O)NNC(=O)c1ccc(Cl)cc1Cl	ZINC000819443058	ED	On-Demand	Reactive	PYGL	16	42
O=C(O)CCCNC(=O)NNC(=O)c1ccc(Cl)cc1Cl	ZINC000819443058	ED	On-Demand	Reactive	ALPL	42	38
O=C(O)CCCNC(=O)NNC(=O)Cc1ccc(F)cc1	ZINC000819443065	CC	On-Demand	Reactive	FOLH1	22	42
O=C(O)CCCNC(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1	ZINC000819443072	FD	On-Demand	Anodyne	NPY2R	44	36
O=C(O)CCCNC(=O)NNc1ccc(F)cc1	ZINC000819443075	CD	On-Demand	Reactive	FOLH1	21	49
O=C(O)CCCNC(=O)Nc1ccc(N2CCCC2)nc1	ZINC000819443077	CD	On-Demand	Anodyne	FOLH1	17	42
O=C(O)CCCNC(=O)Nc1ccc(N2CCCC2)nc1	ZINC000819443077	CD	On-Demand	Anodyne	DGAT1	41	41
O=C(O)CCCNC(=O)Nc1ccc(Br)nc1	ZINC000819443079	DD	On-Demand	Anodyne	ADRB1	31	45
O=C(O)CCCNC(=O)Nc1ccc(Br)nc1	ZINC000819443079	DD	On-Demand	Anodyne	FOLH1	31	49
O=C(O)CCCNC(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	ZINC000819443080	FG	On-Demand	Anodyne	CCR3	26	41
O=C(O)CCCNC(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	ZINC000819443080	FG	On-Demand	Anodyne	EPHX2	22	46
O=C(O)CCCNC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	ZINC000819443081	ED	On-Demand	Reactive	FOLH1	25	43
O=C(O)CCCNC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	ZINC000819443081	ED	On-Demand	Reactive	LTA4H	18	44
O=C(O)CCCNC(=O)Nc1cc(Br)ccc1-n1cccn1	ZINC000819443083	FF	On-Demand	Anodyne	FOLH1	16	40
O=C(O)CCCNC(=O)Nc1ccc(-c2ccccc2)cc1F	ZINC000819443084	DG	On-Demand	Anodyne	DHODH	16	40
O=C(O)CCCNC(=O)Nc1ccc(-c2ccccc2)cc1F	ZINC000819443084	DG	On-Demand	Anodyne	MME	26	45
O=C(O)CCCNC(=O)Nc1ccc(-c2ccccc2)cc1F	ZINC000819443084	DG	On-Demand	Anodyne	POLG_WNV	40	33
O=C(O)CCCNC(=O)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000819443086	ED	On-Demand	Anodyne	CCR3	54	44
O=C(O)CCCNC(=O)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000819443086	ED	On-Demand	Anodyne	CCKBR	47	35
O=C(O)CCCNC(=O)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000819443086	ED	On-Demand	Anodyne	EPHX2	18	42
O=C(O)CCCNC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	ZINC000819443088	GF	On-Demand	Reactive	PRS	55	48
O=C(O)CCCNC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	ZINC000819443088	GF	On-Demand	Reactive	BCHE	40	33
O=C(O)CCCNC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	ZINC000819443088	GF	On-Demand	Reactive	LTB4R	23	40
O=C(O)CCCNC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	ZINC000819443088	GF	On-Demand	Reactive	TACR3	45	59
O=C(O)CCCNC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	ZINC000819443088	GF	On-Demand	Reactive	MT-CO2	50	42
O=C(O)CCCNC(=O)NCc1ccnc(Oc2ccccc2)c1	ZINC000819443089	EF	On-Demand	Anodyne	HRH2	18	42
O=C(O)CCCNC(=O)NCc1ccnc(Oc2ccccc2)c1	ZINC000819443089	EF	On-Demand	Anodyne	PDS	48	33
O=C(O)CCCNC(=O)NNC(=O)c1ccc2ccccc2n1	ZINC000819443090	DD	On-Demand	Reactive	CYSLTR1	16	44
O=C(O)CCCNC(=O)Nc1ccc(-n2nccn2)nc1	ZINC000819443092	CC	On-Demand	Anodyne	FOLH1	17	42
O=C(O)CCCNC(=O)Nc1ccc(Oc2ccc(F)cc2)nc1	ZINC000819443096	EF	On-Demand	Anodyne	FOLH1	19	47
O=C(O)CCCNC(=O)Nc1ccc(Oc2ccc(F)cc2)nc1	ZINC000819443096	EF	On-Demand	Anodyne	LTA4H	16	43
O=C(O)CCCNC(=O)Nc1ccc(NC(=O)c2ccco2)cc1	ZINC000819443097	EF	On-Demand	Anodyne	FOLH1	19	41
O=C(O)CCCNC(=O)Nc1ccc(NC(=O)c2ccco2)cc1	ZINC000819443097	EF	On-Demand	Anodyne	CA1	16	42
O=C(O)CCCNC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1	ZINC000819443099	GH	On-Demand	Anodyne	FOLH1	26	57
O=C(O)CCCNC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1	ZINC000819443099	GH	On-Demand	Anodyne	CPT1A	56	36
O=C(O)CCCNC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1	ZINC000819443099	GH	On-Demand	Anodyne	PRNP	33	45
O=C(O)CCCNC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1	ZINC000819443099	GH	On-Demand	Anodyne	EPHX2	24	60
O=C(O)CCCNC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1	ZINC000819443099	GH	On-Demand	Anodyne	NOD1	15	41
O=C(O)CCCNC(=O)NNC(=O)c1cccc(Cl)c1	ZINC000819443102	CD	On-Demand	Reactive	FOLH1	42	37
O=C(O)CCCNC(=O)NNC(=O)c1cccc(Cl)c1	ZINC000819443102	CD	On-Demand	Reactive	FBP1	23	40
O=C(O)CCCNC(=O)Nc1cccc(-c2nccs2)c1	ZINC000819443103	DF	On-Demand	Anodyne	CCR3	20	41
O=C(O)CCCNC(=O)Nc1cccc(-c2nccs2)c1	ZINC000819443103	DF	On-Demand	Anodyne	HDAC3	22	42
O=C(O)CCCNC(=O)Nc1ccc(-c2nccs2)cc1	ZINC000819443105	DF	On-Demand	Anodyne	HDAC3	16	40
O=C(O)CCCNC(=O)NNC(=O)CCc1ccccc1	ZINC000819443106	CC	On-Demand	Reactive	MME	26	47
O=C(O)CCCNC(=O)NNC(=O)CCc1ccccc1	ZINC000819443106	CC	On-Demand	Reactive	FFAR1	58	43
O=C(O)CCCNC(=O)NNC(=O)CCc1ccccc1	ZINC000819443106	CC	On-Demand	Reactive	FFAR4	42	37
O=C(O)CCCNC(=O)NNC(=O)Nc1ccc(Br)cc1Cl	ZINC000819443107	GE	On-Demand	Reactive	FOLH1	18	43
COC[C@@H](C)OC[C@H](O)CNc1ccc(OC2CCCCC2)cc1	ZINC000819443119	EG	On-Demand	Anodyne	ADRB1	28	43
COC[C@@H](C)OC[C@@H](O)CNc1ccc(OC2CCCCC2)cc1	ZINC000819443121	EG	On-Demand	Anodyne	ADRB1	28	43
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819443134	GH	On-Demand	Anodyne	ADRB1	20	44
O=C(CCc1cccc(OC(F)F)c1)NC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000819443134	GH	On-Demand	Anodyne	ADRB3	24	44
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819443135	GH	On-Demand	Anodyne	ADRB1	20	44
O=C(CCc1cccc(OC(F)F)c1)NC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000819443135	GH	On-Demand	Anodyne	ADRB3	24	44
COC[C@@H](O)CNc1ccc(OC)c(NC(=O)C2CCCCC2)c1	ZINC000819443140	EF	On-Demand	Anodyne	STK17B	46	45
COC[C@@H](O)CNc1ccc(OC)c(NC(=O)C2CCCCC2)c1	ZINC000819443140	EF	On-Demand	Anodyne	STK17A	16	42
C#CCNC(=O)CCNc1ccc(OC2CCCCC2)cc1	ZINC000819443142	DF	On-Demand	Mild	EPHX2	18	40
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccccc2)cc1)C(C)C	ZINC000819443161	EH	On-Demand	Anodyne	ADRB2	28	55
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccccc2)cc1)C(C)C	ZINC000819443161	EH	On-Demand	Anodyne	ADRB1	30	46
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccccc2)cc1)C(C)C	ZINC000819443161	EH	On-Demand	Anodyne	ADRB3	69	44
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccccc2)cc1)C(C)C	ZINC000819443161	EH	On-Demand	Anodyne	NPY5R	31	41
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccccc2)cc1)C(C)C	ZINC000819443161	EH	On-Demand	Anodyne	LIMK2	19	40
CC(=O)N(Cc1ccc(NC[C@@H](O)c2ccccc2)cc1)C(C)C	ZINC000819443162	EH	On-Demand	Anodyne	ADRB2	28	55
CC(=O)N(Cc1ccc(NC[C@@H](O)c2ccccc2)cc1)C(C)C	ZINC000819443162	EH	On-Demand	Anodyne	ADRB1	30	46
CC(=O)N(Cc1ccc(NC[C@@H](O)c2ccccc2)cc1)C(C)C	ZINC000819443162	EH	On-Demand	Anodyne	ADRB3	69	44
CC(=O)N(Cc1ccc(NC[C@@H](O)c2ccccc2)cc1)C(C)C	ZINC000819443162	EH	On-Demand	Anodyne	NPY5R	31	41
CC(=O)N(Cc1ccc(NC[C@@H](O)c2ccccc2)cc1)C(C)C	ZINC000819443162	EH	On-Demand	Anodyne	LIMK2	19	40
O=C(O)CCCNC(=O)Nc1cccc(COc2cccc(F)c2)c1	ZINC000819443208	EG	On-Demand	Anodyne	HRH2	42	46
O=C(O)CCCNC(=O)Nc1cccc(COc2cccc(F)c2)c1	ZINC000819443208	EG	On-Demand	Anodyne	MAOB	24	40
O=C(O)CCCNC(=O)Nc1cccc(COc2cccc(F)c2)c1	ZINC000819443208	EG	On-Demand	Anodyne	PTGER4	16	43
O=C(O)CCCNC(=O)Nc1cccc(COc2cccc(F)c2)c1	ZINC000819443208	EG	On-Demand	Anodyne	PTGER3	55	43
O=C(O)CCCNC(=O)Nc1cccc(COc2cccc(F)c2)c1	ZINC000819443208	EG	On-Demand	Anodyne	CCR3	36	42
O=C(O)CCCNC(=O)Nc1cccc(COc2cccc(F)c2)c1	ZINC000819443208	EG	On-Demand	Anodyne	EPHX2	20	44
O=C(O)CCCNC(=O)Nc1cccc(COc2cccc(F)c2)c1	ZINC000819443208	EG	On-Demand	Anodyne	FFAR1	56	44
O=C(O)CCCNC(=O)Nc1cccc(COc2cccc(F)c2)c1	ZINC000819443208	EG	On-Demand	Anodyne	FFAR4	20	40
O=C(O)CCCNC(=O)Nc1cccc(COc2cccc(F)c2)c1	ZINC000819443208	EG	On-Demand	Anodyne	PDS	46	42
O=C(O)CCCNC(=O)Nc1ccc2oc3ccccc3c2c1	ZINC000819443209	DH	On-Demand	Anodyne	MMP12	24	44
O=C(O)CCCNC(=O)Nc1ccc2oc3ccccc3c2c1	ZINC000819443209	DH	On-Demand	Anodyne	IMDH_CRYPV	22	44
O=C(O)CCCNC(=O)NCc1cccnc1Oc1cccc(F)c1	ZINC000819443210	EF	On-Demand	Anodyne	P2RY1	20	43
O=C(O)CCCNC(=O)NNC(=O)Cc1ccc(Cl)cc1	ZINC000819443211	DD	On-Demand	Reactive	FOLH1	19	42
O=C(O)CCCNC(=O)NNC(=O)Cc1ccc(Cl)cc1	ZINC000819443211	DD	On-Demand	Reactive	TBXA2R	44	35
O=C(O)CCCNC(=O)NNc1ccc(OC(F)(F)F)cc1	ZINC000819443212	DE	On-Demand	Reactive	GCGR	26	41
O=C(O)CCCNC(=O)NNc1ccc(OC(F)(F)F)cc1	ZINC000819443212	DE	On-Demand	Reactive	P2RY1	47	35
O=C(O)CCCNC(=O)NNc1ccc(OC(F)(F)F)cc1	ZINC000819443212	DE	On-Demand	Reactive	EPHX2	42	40
O=C(O)CCCNC(=O)NNc1ccc(OC(F)(F)F)cc1	ZINC000819443212	DE	On-Demand	Reactive	GIPR	31	40
O=C(O)CCCNC(=O)NNc1ccccc1Cl	ZINC000819443215	CD	On-Demand	Reactive	CXCL8	44	44
O=C(O)CCCNC(=O)Nc1ccc(CC(F)(F)F)cc1	ZINC000819443216	DF	On-Demand	Anodyne	FOLH1	20	46
O=C(O)CCCNC(=O)Nc1ccc(CC(F)(F)F)cc1	ZINC000819443216	DF	On-Demand	Anodyne	EPHX2	20	57
O=C(O)CCCNC(=O)NNC(=O)c1ccc(Cl)cc1	ZINC000819443217	CD	On-Demand	Reactive	FOLH1	32	43
O=C(O)CCCNC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000819443218	FD	On-Demand	Reactive	CA4	17	46
O=C(O)CCCNC(=O)NNC(=O)CSc1ccc(Cl)cc1	ZINC000819443219	ED	On-Demand	Reactive	FOLH1	17	41
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	ACE	15	45
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	ACHE	29	41
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	MME	25	40
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	EDNRB	21	42
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	EDNRA	34	47
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	TPR	16	59
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	MC4R	49	40
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	CCKAR	107	43
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	BCHE	17	41
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	BRS3	30	55
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	NMBR	44	39
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	MC3R	74	40
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	MC5R	75	38
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	MMP2	23	41
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	MMP8	31	41
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	GRIA1	29	48
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	GRPR	72	35
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	ECE1	51	39
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	HDAC1	15	44
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	HDAC3	19	40
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	MMP11	62	32
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	FURIN	23	42
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	CCKBR	88	40
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	MMP9	22	41
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	MC1R	102	40
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	HDAC11	15	40
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	MMP1	19	50
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	SSSIM	26	40
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	KISS1R	77	36
O=C(O)CCCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819443221	DC	On-Demand	Reactive	TMPRSS6	15	40
O=C(O)CCCNC(=O)NCc1cccnc1-n1ccnc1	ZINC000819443224	DC	On-Demand	Anodyne	TBXAS1	35	46
O=C(O)CCCNC(=O)Nc1cc(-c2ccccc2)ns1	ZINC000819443225	DF	On-Demand	Anodyne	LTB4R	18	40
O=C(O)CCCNC(=O)Nc1ccc(F)nc1	ZINC000819443230	BD	On-Demand	Anodyne	FOLH1	20	49
O=C(O)CCCNC(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1	ZINC000819443233	FF	On-Demand	Anodyne	HRH2	42	54
O=C(O)CCCNC(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1	ZINC000819443233	FF	On-Demand	Anodyne	MAOB	36	52
O=C(O)CCCNC(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1	ZINC000819443233	FF	On-Demand	Anodyne	EDNRB	34	45
O=C(O)CCCNC(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1	ZINC000819443233	FF	On-Demand	Anodyne	EDNRA	40	45
O=C(O)CCCNC(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1	ZINC000819443233	FF	On-Demand	Anodyne	FFAR1	65	38
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccc2)nc1	ZINC000819443237	EF	On-Demand	Anodyne	ADRB1	39	42
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccc2)nc1	ZINC000819443237	EF	On-Demand	Anodyne	PPIA	44	43
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccc2)nc1	ZINC000819443237	EF	On-Demand	Anodyne	LTA4H	15	41
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccc2)nc1	ZINC000819443237	EF	On-Demand	Anodyne	CA1	20	42
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccc2)nc1	ZINC000819443237	EF	On-Demand	Anodyne	FFAR1	22	42
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccc2)nc1	ZINC000819443237	EF	On-Demand	Anodyne	NAMPT	23	41
O=C(O)CCCNC(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1	ZINC000819443238	EH	On-Demand	Anodyne	FOLH1	19	47
O=C(O)CCCNC(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1	ZINC000819443238	EH	On-Demand	Anodyne	LTA4H	19	43
O=C(O)CCCNC(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1	ZINC000819443238	EH	On-Demand	Anodyne	LIPE	15	44
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccn2)c(F)c1	ZINC000819443239	EF	On-Demand	Anodyne	ADRB1	40	32
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccn2)c(F)c1	ZINC000819443239	EF	On-Demand	Anodyne	GRM4	23	40
O=C(O)CCCNC(=O)Nc1ccc(OCc2ccccn2)c(F)c1	ZINC000819443239	EF	On-Demand	Anodyne	MET	57	39
O=C(O)CCCNC(=O)Nc1ccc(N2CCCCC2)nc1	ZINC000819443241	DE	On-Demand	Anodyne	HRH2	24	40
O=C(O)CCCNC(=O)Nc1ccc(N2CCCCC2)nc1	ZINC000819443241	DE	On-Demand	Anodyne	FOLH1	16	41
O=C(O)CCCNC(=O)Nc1ccc(N2CCCCC2)nc1	ZINC000819443241	DE	On-Demand	Anodyne	DGAT1	41	42
O=C(O)CCCNC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000819443242	EC	On-Demand	Reactive	KCNMA1	25	41
O=C(O)CCCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819443243	EG	On-Demand	Anodyne	HRH2	49	50
O=C(O)CCCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819443243	EG	On-Demand	Anodyne	MAOB	27	40
O=C(O)CCCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819443243	EG	On-Demand	Anodyne	CYSLTR1	20	41
O=C(O)CCCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819443243	EG	On-Demand	Anodyne	PPIA	40	40
O=C(O)CCCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819443243	EG	On-Demand	Anodyne	LTA4H	29	45
O=C(O)CCCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819443243	EG	On-Demand	Anodyne	PTGER4	26	42
O=C(O)CCCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819443243	EG	On-Demand	Anodyne	CYSLTR2	46	31
O=C(O)CCCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819443243	EG	On-Demand	Anodyne	CA1	28	45
O=C(O)CCCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819443243	EG	On-Demand	Anodyne	PTGER3	59	39
O=C(O)CCCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819443243	EG	On-Demand	Anodyne	CCR3	31	47
O=C(O)CCCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819443243	EG	On-Demand	Anodyne	EPHX2	29	45
O=C(O)CCCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819443243	EG	On-Demand	Anodyne	FFAR1	76	51
O=C(O)CCCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819443243	EG	On-Demand	Anodyne	FFAR4	50	49
O=C(O)CCCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819443243	EG	On-Demand	Anodyne	PDS	58	34
O=C(O)CCCNC(=O)Nc1ccc([S@@](=O)C(F)(F)F)cc1	ZINC000819443244	EE	On-Demand	Anodyne	FOLH1	20	47
O=C(O)CCCNC(=O)Nc1ccc([S@](=O)C(F)(F)F)cc1	ZINC000819443245	EE	On-Demand	Anodyne	FOLH1	20	47
O=C(O)CCCNC(=O)NNC(=O)c1ccc2ccccc2c1	ZINC000819443247	DD	On-Demand	Reactive	DRD3	22	46
O=C(O)CCCNC(=O)NNC(=O)c1ccc2ccccc2c1	ZINC000819443247	DD	On-Demand	Reactive	NPR1	43	35
O=C(O)CCCNC(=O)NNC(=O)c1ccc2ccccc2c1	ZINC000819443247	DD	On-Demand	Reactive	HDAC8	15	42
O=C(O)CCCNC(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	ZINC000819443248	ED	On-Demand	Reactive	EPHX2	42	60
O=C(O)CCCNC(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	ZINC000819443248	ED	On-Demand	Reactive	BOTA	19	48
O=C(O)CCCNC(=O)Nc1ccc(NC(=O)NCc2ccco2)cc1	ZINC000819443250	FF	On-Demand	Anodyne	FOLH1	15	41
O=C(O)CCCNC(=O)Nc1ccc(NC(=O)NCc2ccco2)cc1	ZINC000819443250	FF	On-Demand	Anodyne	CA1	17	60
O=C(O)CCCNC(=O)NNC(=O)COc1ccccc1F	ZINC000819443251	DC	On-Demand	Reactive	CXCL8	17	40
O=C(O)CCCNC(=O)NNC(=O)c1ccccc1	ZINC000819443252	CC	On-Demand	Reactive	FOLH1	46	39
O=C(O)CCCNC(=O)NNC(=O)c1ccccc1	ZINC000819443252	CC	On-Demand	Reactive	MME	18	47
O=C(O)CCCNC(=O)NNC(=O)c1ccccc1	ZINC000819443252	CC	On-Demand	Reactive	HDAC9	19	40
O=C(O)CCCNC(=O)Nc1ccc(OCC(F)(F)F)nc1	ZINC000819443253	DE	On-Demand	Anodyne	ADRB1	36	40
O=C(O)CCCNC(=O)Nc1ccc(OCC(F)(F)F)nc1	ZINC000819443253	DE	On-Demand	Anodyne	FOLH1	18	41
O=C(O)CCCNC(=O)Nc1ccc(OCC(F)(F)F)nc1	ZINC000819443253	DE	On-Demand	Anodyne	EPHX2	16	50
O=C(O)CCCNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000819443254	DC	On-Demand	Anodyne	TBXAS1	27	46
O=C(O)CCCNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000819443254	DC	On-Demand	Anodyne	NOS2	96	36
O=C(O)CCCNC(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000819443255	GF	On-Demand	Anodyne	PIK3CA	54	46
O=C(O)CCCNC(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000819443255	GF	On-Demand	Anodyne	MTOR	142	46
O=C(O)CCCNC(=O)Nc1ccc(-c2csc(N3CCOCC3)n2)cc1	ZINC000819443255	GF	On-Demand	Anodyne	PIK3CG	42	44
O=C(O)CCCNC(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819443256	GF	On-Demand	Anodyne	HRH2	40	41
O=C(O)CCCNC(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819443256	GF	On-Demand	Anodyne	CCR3	38	40
O=C(O)CCCNC(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819443256	GF	On-Demand	Anodyne	HDAC10	40	66
O=C(O)CCCNC(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819443256	GF	On-Demand	Anodyne	HDAC1	15	66
O=C(O)CCCNC(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819443256	GF	On-Demand	Anodyne	HDAC2	17	66
O=C(O)CCCNC(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819443256	GF	On-Demand	Anodyne	HDAC3	39	66
O=C(O)CCCNC(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819443256	GF	On-Demand	Anodyne	HDAC6	32	66
O=C(O)CCCNC(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819443256	GF	On-Demand	Anodyne	CDC7	20	46
O=C(O)CCCNC(=O)NNC(=O)c1ccoc1	ZINC000819443258	CC	On-Demand	Reactive	FOLH1	43	37
O=C(O)CCCNC(=O)Nc1ccc(N2CCCCCC2)cc1	ZINC000819443261	DG	On-Demand	Anodyne	HRH2	25	43
O=C(O)CCCNC(=O)Nc1ccc(N2CCCCCC2)cc1	ZINC000819443261	DG	On-Demand	Anodyne	FOLH1	20	45
O=C(O)CCCNC(=O)Nc1ccc(N2CCCCCC2)cc1	ZINC000819443261	DG	On-Demand	Anodyne	CCR3	20	41
O=C(O)CCCNC(=O)Nc1ccc(N2CCCCCC2)cc1	ZINC000819443261	DG	On-Demand	Anodyne	EPHX2	32	46
O=C(O)CCCNC(=O)Nc1ccc(N2CCCCCC2)cc1	ZINC000819443261	DG	On-Demand	Anodyne	NAMPT	23	41
O=C(O)CCCNC(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	ZINC000819443263	FG	On-Demand	Anodyne	HRH2	30	41
O=C(O)CCCNC(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1	ZINC000819443263	FG	On-Demand	Anodyne	CHRNA7	16	50
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000819443264	GF	On-Demand	Anodyne	CA2	33	56
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000819443264	GF	On-Demand	Anodyne	FOLH1	21	56
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000819443264	GF	On-Demand	Anodyne	CA1	39	44
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000819443264	GF	On-Demand	Anodyne	CCR3	30	48
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000819443264	GF	On-Demand	Anodyne	CA4	28	56
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000819443264	GF	On-Demand	Anodyne	EPHX2	20	49
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000819443264	GF	On-Demand	Anodyne	CA12	36	50
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000819443264	GF	On-Demand	Anodyne	CA9	36	44
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000819443264	GF	On-Demand	Anodyne	IDO1	27	43
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000819443264	GF	On-Demand	Anodyne	NCE103	21	45
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000819443264	GF	On-Demand	Anodyne	MTCA1	42	50
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000819443264	GF	On-Demand	Anodyne	P96878_MYCTU	54	50
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1	ZINC000819443264	GF	On-Demand	Anodyne	NAMPT	59	49
O=C(O)CCCNC(=O)NN(Cc1ccccc1)c1ccccc1	ZINC000819443265	EF	On-Demand	Reactive	MME	20	48
O=C(O)CCCNC(=O)Nc1ccc(-n2cccn2)nc1	ZINC000819443270	CD	On-Demand	Anodyne	FOLH1	17	43
O=C(O)CCCNC(=O)Nc1cccc(COC2CCCCC2)c1	ZINC000819443271	EH	On-Demand	Anodyne	ADRB1	18	44
O=C(O)CCCNC(=O)Nc1cccc(COC2CCCCC2)c1	ZINC000819443271	EH	On-Demand	Anodyne	HRH2	42	44
O=C(O)CCCNC(=O)Nc1cccc(COC2CCCCC2)c1	ZINC000819443271	EH	On-Demand	Anodyne	NPY1R	44	38
O=C(O)CCCNC(=O)Nc1cccc(COC2CCCCC2)c1	ZINC000819443271	EH	On-Demand	Anodyne	CCR3	44	43
O=C(O)CCCNC(=O)Nc1cccc(COC2CCCCC2)c1	ZINC000819443271	EH	On-Demand	Anodyne	EPHX2	27	45
O=C(O)CCCNC(=O)NNC(=O)Cc1cccc2ccccc12	ZINC000819443274	ED	On-Demand	Reactive	MTNR1A	37	47
O=C(O)CCCNC(=O)NNC(=O)Cc1cccc2ccccc12	ZINC000819443274	ED	On-Demand	Reactive	FURIN	40	33
O=C(O)CCCNC(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000819443275	EE	On-Demand	Anodyne	NPY2R	42	37
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	CA2	40	57
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	PPIA	19	41
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	FOLH1	18	44
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	TBXA2R	51	42
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	TBXAS1	49	41
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	BMP1	16	43
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	CA1	55	47
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	CA7	17	57
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	CCR3	19	46
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	CA5B	32	40
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	CA4	29	57
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	CA5A	37	40
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	EPHX2	15	45
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	TGM2	15	40
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	CA12	46	51
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	CA9	49	49
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	F13A1	26	40
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	IDO1	37	40
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	NCE103	33	53
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	MTCA1	49	55
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	P96878_MYCTU	59	55
O=C(O)CCCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819443277	GE	On-Demand	Anodyne	NAMPT	62	50
NC(=O)N[C@H](CC(=O)N1CCC[C@H]1c1nn[nH]n1)c1cccs1	ZINC000819443292	EC	On-Demand	Anodyne	CPT1A	51	38
NC(=O)N[C@@H](CC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1cccs1	ZINC000819443293	EC	On-Demand	Anodyne	CPT1A	51	38
NC(=O)N[C@@H](CC(=O)N1CCC[C@H]1c1nn[nH]n1)c1cccs1	ZINC000819443294	EC	On-Demand	Anodyne	CPT1A	51	38
NC(=O)N[C@H](CC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1cccs1	ZINC000819443295	EC	On-Demand	Anodyne	CPT1A	51	38
COc1ccc(Cl)cc1NCCC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443299	FE	On-Demand	Anodyne	CPT1A	57	41
O=C(Cc1csc(-c2cccnc2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443316	ED	On-Demand	Anodyne	CPT1A	105	56
O=C(Cc1csc(-c2cccnc2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443317	ED	On-Demand	Anodyne	CPT1A	105	56
C[C@@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCN(c2ccc(F)cc2)CC1	ZINC000819443328	FD	On-Demand	Anodyne	CCR3	64	33
C[C@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCN(c2ccc(F)cc2)CC1	ZINC000819443329	FD	On-Demand	Anodyne	CCR3	64	33
C[C@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCN(c2ccc(F)cc2)CC1	ZINC000819443330	FD	On-Demand	Anodyne	CCR3	64	33
C[C@@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCN(c2ccc(F)cc2)CC1	ZINC000819443331	FD	On-Demand	Anodyne	CCR3	64	33
COC(=O)N(C)Cc1ccc(NC[C@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819443339	GI	On-Demand	Anodyne	FCER2	26	41
COC(=O)N(C)Cc1ccc(NC[C@@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819443340	GI	On-Demand	Anodyne	FCER2	26	41
O=C(CCSc1ccc(F)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443357	DE	On-Demand	Anodyne	CPT1A	60	43
O=C(CCSc1ccc(F)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443358	DE	On-Demand	Anodyne	CPT1A	60	43
C/C(=C/C(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccccc1Cl	ZINC000819443359	DF	On-Demand	Anodyne	CPT1A	77	38
C/C(=C/C(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccccc1Cl	ZINC000819443363	DF	On-Demand	Anodyne	CPT1A	77	38
O=C1c2ccccc2C(=O)N1Cc1cccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819443369	HD	On-Demand	Anodyne	CPT1A	47	33
COC(=O)N(C)Cc1ccc(NCCC(=O)Nc2ccccc2[N+](=O)[O-])cc1	ZINC000819443373	GG	On-Demand	Bother	COLA	59	34
O=C1c2ccccc2C(=O)N1Cc1cccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819443374	HD	On-Demand	Anodyne	CPT1A	47	33
O=C(CSc1nnc2ccccn12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443387	EC	On-Demand	Anodyne	CPT1A	88	38
O=C(CSc1nnc2ccccn12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443395	EC	On-Demand	Anodyne	CPT1A	88	38
C/C(=C/c1cccc(Cl)c1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443398	DF	On-Demand	Anodyne	CPT1A	51	33
C/C(=C/c1cccc(Cl)c1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443400	DF	On-Demand	Anodyne	CPT1A	51	33
O=C(Cc1ccccc1OC(F)F)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443406	DD	On-Demand	Anodyne	CPT1A	93	41
O=C(Cc1ccccc1OC(F)F)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443411	DD	On-Demand	Anodyne	CPT1A	93	41
O=C(c1csc(-c2ccc(Cl)cc2Cl)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443412	GH	On-Demand	Anodyne	ALPL	40	38
O=C(c1csc(-c2ccc(Cl)cc2Cl)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443413	GH	On-Demand	Anodyne	ALPL	40	38
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819443487	GE	On-Demand	Anodyne	ADRB1	46	37
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819443487	GE	On-Demand	Anodyne	GRIN1	25	50
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819443487	GE	On-Demand	Anodyne	EDNRA	40	37
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819443487	GE	On-Demand	Anodyne	BMP1	59	38
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819443488	GE	On-Demand	Anodyne	ADRB1	46	37
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819443488	GE	On-Demand	Anodyne	GRIN1	25	50
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819443488	GE	On-Demand	Anodyne	EDNRA	40	37
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819443488	GE	On-Demand	Anodyne	BMP1	59	38
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccc(F)c(F)c2)cc1)C(C)C	ZINC000819443536	FH	On-Demand	Anodyne	ADRB2	20	42
CC(=O)N(Cc1ccc(NC[C@@H](O)c2ccc(F)c(F)c2)cc1)C(C)C	ZINC000819443537	FH	On-Demand	Anodyne	ADRB2	20	42
O=[S@](Cc1cccc(NC[C@@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819443542	FH	On-Demand	Anodyne	ADRB1	19	40
O=[S@](Cc1cccc(NC[C@@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819443542	FH	On-Demand	Anodyne	ADRB3	83	45
O=[S@@](Cc1cccc(NC[C@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819443543	FH	On-Demand	Anodyne	ADRB1	19	40
O=[S@@](Cc1cccc(NC[C@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819443543	FH	On-Demand	Anodyne	ADRB3	83	45
O=[S@](Cc1cccc(NC[C@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819443544	FH	On-Demand	Anodyne	ADRB1	19	40
O=[S@](Cc1cccc(NC[C@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819443544	FH	On-Demand	Anodyne	ADRB3	83	45
O=[S@@](Cc1cccc(NC[C@@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819443545	FH	On-Demand	Anodyne	ADRB1	19	40
O=[S@@](Cc1cccc(NC[C@@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819443545	FH	On-Demand	Anodyne	ADRB3	83	45
O[C@@H](CNc1cccc(CSC2CCOCC2)c1)c1cccnc1	ZINC000819443568	EH	On-Demand	Anodyne	ADRB3	76	39
O[C@H](CNc1cccc(CSC2CCOCC2)c1)c1cccnc1	ZINC000819443569	EH	On-Demand	Anodyne	ADRB3	76	39
COCC[S@@](=O)Cc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819443577	EE	On-Demand	Anodyne	ADRB2	23	42
COCC[S@@](=O)Cc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819443577	EE	On-Demand	Anodyne	ADRB1	24	40
COCC[S@@](=O)Cc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819443577	EE	On-Demand	Anodyne	ADRB3	88	47
CC(C)c1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819443580	DE	On-Demand	Anodyne	PRCP	19	44
CC(C)c1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819443580	DE	On-Demand	Anodyne	CPT1A	143	48
CC(C)c1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819443580	DE	On-Demand	Anodyne	CPT2	47	36
CC(C)c1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819443581	DE	On-Demand	Anodyne	PRCP	19	44
CC(C)c1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819443581	DE	On-Demand	Anodyne	CPT1A	143	48
CC(C)c1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819443581	DE	On-Demand	Anodyne	CPT2	47	36
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443584	HC	On-Demand	Anodyne	CPT1A	49	38
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443584	HC	On-Demand	Anodyne	SFRP1	40	31
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443584	HC	On-Demand	Anodyne	WNT3	43	31
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443585	HC	On-Demand	Anodyne	CPT1A	49	38
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443585	HC	On-Demand	Anodyne	SFRP1	40	31
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443585	HC	On-Demand	Anodyne	WNT3	43	31
CCCOc1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819443586	ED	On-Demand	Anodyne	PRCP	15	45
CCCOc1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819443586	ED	On-Demand	Anodyne	CPT1A	145	49
CCCOc1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819443586	ED	On-Demand	Anodyne	CPT2	47	39
CCCOc1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819443586	ED	On-Demand	Anodyne	PLA2G4B	76	36
CCCOc1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819443587	ED	On-Demand	Anodyne	PRCP	15	45
CCCOc1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819443587	ED	On-Demand	Anodyne	CPT1A	145	49
CCCOc1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819443587	ED	On-Demand	Anodyne	CPT2	47	39
CCCOc1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819443587	ED	On-Demand	Anodyne	PLA2G4B	76	36
C/C(=C/C(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccccc1	ZINC000819443590	CD	On-Demand	Anodyne	CPT1A	91	37
C/C(=C/C(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccccc1	ZINC000819443593	CD	On-Demand	Anodyne	CPT1A	91	37
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)C1CCCCC1	ZINC000819443595	EH	On-Demand	Anodyne	CTSS	16	42
CC(=O)[C@@H]1CC(C(=O)N2CCC[C@@H]2c2nn[nH]n2)=NN1c1ccccc1	ZINC000819443597	FD	On-Demand	Anodyne	CPT1A	40	37
CC(=O)[C@@H]1CC(C(=O)N2CCC[C@H]2c2nn[nH]n2)=NN1c1ccccc1	ZINC000819443598	FD	On-Demand	Anodyne	CPT1A	40	37
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)C1CCCCC1	ZINC000819443599	EH	On-Demand	Anodyne	CTSS	16	42
CC(=O)[C@H]1CC(C(=O)N2CCC[C@@H]2c2nn[nH]n2)=NN1c1ccccc1	ZINC000819443600	FD	On-Demand	Anodyne	CPT1A	40	37
CC(=O)[C@H]1CC(C(=O)N2CCC[C@H]2c2nn[nH]n2)=NN1c1ccccc1	ZINC000819443602	FD	On-Demand	Anodyne	CPT1A	40	37
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)(F)F)c(C)c2)c1	ZINC000819443603	GH	On-Demand	Anodyne	ADRB2	24	43
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)(F)F)c(C)c2)c1	ZINC000819443603	GH	On-Demand	Anodyne	PPARD	30	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)(F)F)c(C)c2)c1	ZINC000819443603	GH	On-Demand	Anodyne	ABCB1	16	44
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)(F)F)c(C)c2)c1	ZINC000819443603	GH	On-Demand	Anodyne	PDS	50	36
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(F)(F)F)c(C)c2)c1	ZINC000819443605	GH	On-Demand	Anodyne	ADRB2	24	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(F)(F)F)c(C)c2)c1	ZINC000819443605	GH	On-Demand	Anodyne	PPARD	30	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(F)(F)F)c(C)c2)c1	ZINC000819443605	GH	On-Demand	Anodyne	ABCB1	16	44
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(F)(F)F)c(C)c2)c1	ZINC000819443605	GH	On-Demand	Anodyne	PDS	50	36
OC1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3)c2)CC1	ZINC000819443606	EF	On-Demand	Anodyne	SLC6A3	30	43
OC1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3)c2)CC1	ZINC000819443606	EF	On-Demand	Anodyne	SIGMAR1	29	53
OC1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3)c2)CC1	ZINC000819443606	EF	On-Demand	Anodyne	CCR3	51	39
OC1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3)c2)CC1	ZINC000819443606	EF	On-Demand	Anodyne	MCHR1	22	42
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccc(F)cc3)c2)CC1	ZINC000819443607	EF	On-Demand	Anodyne	SLC6A3	30	43
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccc(F)cc3)c2)CC1	ZINC000819443607	EF	On-Demand	Anodyne	SIGMAR1	29	53
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccc(F)cc3)c2)CC1	ZINC000819443607	EF	On-Demand	Anodyne	CCR3	51	39
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccc(F)cc3)c2)CC1	ZINC000819443607	EF	On-Demand	Anodyne	MCHR1	22	42
COc1ccccc1/C(C)=C\C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443618	DD	On-Demand	Anodyne	CPT1A	47	38
COc1ccccc1/C(C)=C\C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443618	DD	On-Demand	Anodyne	ACKR3	44	31
COc1ccccc1/C(C)=C/C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443620	DD	On-Demand	Anodyne	CPT1A	47	38
COc1ccccc1/C(C)=C/C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443620	DD	On-Demand	Anodyne	ACKR3	44	31
COc1ccccc1/C(C)=C/C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443622	DD	On-Demand	Anodyne	CPT1A	47	38
COc1ccccc1/C(C)=C/C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443622	DD	On-Demand	Anodyne	ACKR3	44	31
COc1ccccc1/C(C)=C\C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443624	DD	On-Demand	Anodyne	CPT1A	47	38
COc1ccccc1/C(C)=C\C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443624	DD	On-Demand	Anodyne	ACKR3	44	31
OC1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3Cl)c2)CC1	ZINC000819443625	GH	On-Demand	Anodyne	SIGMAR1	27	43
OC1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3Cl)c2)CC1	ZINC000819443625	GH	On-Demand	Anodyne	CCR3	41	39
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccc(F)cc3Cl)c2)CC1	ZINC000819443627	GH	On-Demand	Anodyne	SIGMAR1	27	43
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccc(F)cc3Cl)c2)CC1	ZINC000819443627	GH	On-Demand	Anodyne	CCR3	41	39
C=CCc1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)c(OC)c1	ZINC000819443630	ED	On-Demand	Mild	CPT1A	100	39
C=CCc1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)c(OC)c1	ZINC000819443632	ED	On-Demand	Mild	CPT1A	100	39
O=C(c1ccc(CS(=O)(=O)C(F)F)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443634	FD	On-Demand	Anodyne	TMPRSS11D	45	32
O=C(c1ccc(CS(=O)(=O)C(F)F)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443637	FD	On-Demand	Anodyne	TMPRSS11D	45	32
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCC3CCOCC3)cc2)cc1	ZINC000819443665	GH	On-Demand	Anodyne	ADRB2	27	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCC3CCOCC3)cc2)cc1	ZINC000819443665	GH	On-Demand	Anodyne	ADRB1	59	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCC3CCOCC3)cc2)cc1	ZINC000819443667	GH	On-Demand	Anodyne	ADRB2	27	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCC3CCOCC3)cc2)cc1	ZINC000819443667	GH	On-Demand	Anodyne	ADRB1	59	43
COc1cccc([C@H](C)C(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819443677	DD	On-Demand	Anodyne	FKBP1A	31	41
COc1cccc([C@H](C)C(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819443677	DD	On-Demand	Anodyne	CPT1A	85	39
COc1cccc([C@H](C)C(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819443679	DD	On-Demand	Anodyne	FKBP1A	31	41
COc1cccc([C@H](C)C(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819443679	DD	On-Demand	Anodyne	CPT1A	85	39
COc1cccc([C@@H](C)C(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819443681	DD	On-Demand	Anodyne	FKBP1A	31	41
COc1cccc([C@@H](C)C(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819443681	DD	On-Demand	Anodyne	CPT1A	85	39
COc1cccc([C@@H](C)C(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819443683	DD	On-Demand	Anodyne	FKBP1A	31	41
COc1cccc([C@@H](C)C(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819443683	DD	On-Demand	Anodyne	CPT1A	85	39
CON(C)C(=O)CCNc1cccc(CN2CCC(O)CC2)c1	ZINC000819443686	DD	On-Demand	Anodyne	DRD4	33	41
CON(C)C(=O)CCNc1cccc(CN2CCC(O)CC2)c1	ZINC000819443686	DD	On-Demand	Anodyne	OPRK1	18	42
CON(C)C(=O)CCNc1cccc(CN2CCC(O)CC2)c1	ZINC000819443686	DD	On-Demand	Anodyne	SSTR5	56	34
CON(C)C(=O)CCNc1cccc(CN2CCC(O)CC2)c1	ZINC000819443686	DD	On-Demand	Anodyne	CCR3	45	38
CON(C)C(=O)CCNc1cccc(CN2CCC(O)CC2)c1	ZINC000819443686	DD	On-Demand	Anodyne	MCHR1	53	39
O=C(C[C@](O)(c1nc2ccccc2s1)C(F)(F)F)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443689	HE	On-Demand	Anodyne	CPT1A	83	40
OC1CCN(Cc2cccc(NC[C@H](O)c3cccnc3)c2)CC1	ZINC000819443693	EE	On-Demand	Anodyne	ADRB3	71	45
OC1CCN(Cc2cccc(NC[C@H](O)c3cccnc3)c2)CC1	ZINC000819443693	EE	On-Demand	Anodyne	CHRNA7	40	34
O=C(C[C@](O)(c1nc2ccccc2s1)C(F)(F)F)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443694	HE	On-Demand	Anodyne	CPT1A	83	40
OC1CCN(Cc2cccc(NC[C@@H](O)c3cccnc3)c2)CC1	ZINC000819443695	EE	On-Demand	Anodyne	ADRB3	71	45
OC1CCN(Cc2cccc(NC[C@@H](O)c3cccnc3)c2)CC1	ZINC000819443695	EE	On-Demand	Anodyne	CHRNA7	40	34
O=C(C[C@@](O)(c1nc2ccccc2s1)C(F)(F)F)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443696	HE	On-Demand	Anodyne	CPT1A	83	40
O=C(C[C@@](O)(c1nc2ccccc2s1)C(F)(F)F)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443698	HE	On-Demand	Anodyne	CPT1A	83	40
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)COc1cccc2[nH]ccc12	ZINC000819443744	GH	On-Demand	Anodyne	ADRB2	17	56
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)COc1cccc2[nH]ccc12	ZINC000819443744	GH	On-Demand	Anodyne	ADRB1	41	56
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)COc1cccc2[nH]ccc12	ZINC000819443747	GH	On-Demand	Anodyne	ADRB2	17	56
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)COc1cccc2[nH]ccc12	ZINC000819443747	GH	On-Demand	Anodyne	ADRB1	41	56
Cc1nc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)nn1-c1c(Cl)cccc1Cl	ZINC000819443772	GE	On-Demand	Anodyne	CPT1A	51	36
Cc1nc(C(=O)N2CCC[C@H]2c2nn[nH]n2)nn1-c1c(Cl)cccc1Cl	ZINC000819443773	GE	On-Demand	Anodyne	CPT1A	51	36
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)ccc1F	ZINC000819443774	GD	On-Demand	Anodyne	SFRP1	41	31
CC(C)(C)NS(=O)(=O)c1cc(C(=O)N2CCC[C@H]2c2nn[nH]n2)ccc1F	ZINC000819443775	GD	On-Demand	Anodyne	SFRP1	41	31
COCC[S@](=O)Cc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819443786	EE	On-Demand	Anodyne	ADRB2	23	42
COCC[S@](=O)Cc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819443786	EE	On-Demand	Anodyne	ADRB1	24	40
COCC[S@](=O)Cc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819443786	EE	On-Demand	Anodyne	ADRB3	88	47
COCC[S@](=O)Cc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819443787	EE	On-Demand	Anodyne	ADRB2	23	42
COCC[S@](=O)Cc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819443787	EE	On-Demand	Anodyne	ADRB1	24	40
COCC[S@](=O)Cc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819443787	EE	On-Demand	Anodyne	ADRB3	88	47
COCC[S@@](=O)Cc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819443788	EE	On-Demand	Anodyne	ADRB2	23	42
COCC[S@@](=O)Cc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819443788	EE	On-Demand	Anodyne	ADRB1	24	40
COCC[S@@](=O)Cc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819443788	EE	On-Demand	Anodyne	ADRB3	88	47
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cc(C)cc(C)c2)cc1)C(C)C	ZINC000819443791	FI	On-Demand	Anodyne	ADRB2	15	41
CC(=O)N(Cc1ccc(NC[C@H](O)c2cc(C)cc(C)c2)cc1)C(C)C	ZINC000819443792	FI	On-Demand	Anodyne	ADRB2	15	41
COCC[S@@](=O)Cc1cccc(NC[C@H](O)CN2CCOCC2)c1	ZINC000819443793	FC	On-Demand	Anodyne	CASR	23	42
COCC[S@@](=O)Cc1cccc(NC[C@@H](O)CN2CCOCC2)c1	ZINC000819443794	FC	On-Demand	Anodyne	CASR	23	42
COCC[S@](=O)Cc1cccc(NC[C@@H](O)CN2CCOCC2)c1	ZINC000819443795	FC	On-Demand	Anodyne	CASR	23	42
COCC[S@](=O)Cc1cccc(NC[C@H](O)CN2CCOCC2)c1	ZINC000819443796	FC	On-Demand	Anodyne	CASR	23	42
CC[C@H](O)CNc1ccc(OC2CCCCC2)cc1	ZINC000819443861	CH	On-Demand	Anodyne	ADRB1	21	40
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc(F)c2)cc1)C(C)C	ZINC000819443891	EH	On-Demand	Anodyne	ADRB1	22	44
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc(F)c2)cc1)C(C)C	ZINC000819443891	EH	On-Demand	Anodyne	ADRB3	38	42
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1)C(C)C	ZINC000819443893	EH	On-Demand	Anodyne	ADRB1	22	44
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1)C(C)C	ZINC000819443893	EH	On-Demand	Anodyne	ADRB3	38	42
COCC[S@](=O)Cc1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819443901	GF	On-Demand	Bother	CACNA1D	52	34
COCC[S@@](=O)Cc1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819443902	GF	On-Demand	Bother	CACNA1D	52	34
COCC[S@](=O)Cc1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819443903	GF	On-Demand	Bother	CACNA1D	52	34
COCC[S@@](=O)Cc1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819443904	GF	On-Demand	Bother	CACNA1D	52	34
CCOC[C@H](O)CNc1ccc(OC)c(NC(=O)C2CCCCC2)c1	ZINC000819443936	FG	On-Demand	Anodyne	STK17B	44	45
CCOC[C@H](O)CNc1ccc(OC)c(NC(=O)C2CCCCC2)c1	ZINC000819443936	FG	On-Demand	Anodyne	STK17A	15	40
C#CCNC(=O)CCNc1ccc(OC)c(NC(=O)C2CCCCC2)c1	ZINC000819443941	FF	On-Demand	Mild	STK17B	44	43
C#CCNC(=O)CCNc1ccc(OC)c(NC(=O)C2CCCCC2)c1	ZINC000819443941	FF	On-Demand	Mild	STK17A	15	40
C#CCNC(=O)CCNc1ccc(OC)c(NC(=O)C2CCCCC2)c1	ZINC000819443941	FF	On-Demand	Mild	QRFPR	40	34
Cc1ccc(NC[C@H](O)COc2ccccc2F)c(OCCN(C)C)c1	ZINC000819443952	FF	On-Demand	Anodyne	ADRB2	18	41
Cc1ccc(NC[C@@H](O)COc2ccccc2F)c(OCCN(C)C)c1	ZINC000819443953	FF	On-Demand	Anodyne	ADRB2	18	41
N#Cc1ccc([C@@H](O)CNc2cccc(CN3CCC(O)CC3)c2)cc1	ZINC000819443957	FF	On-Demand	Mild	SIGMAR1	15	42
N#Cc1ccc([C@@H](O)CNc2cccc(CN3CCC(O)CC3)c2)cc1	ZINC000819443957	FF	On-Demand	Mild	CCR3	17	46
N#Cc1ccc([C@H](O)CNc2cccc(CN3CCC(O)CC3)c2)cc1	ZINC000819443958	FF	On-Demand	Mild	SIGMAR1	15	42
N#Cc1ccc([C@H](O)CNc2cccc(CN3CCC(O)CC3)c2)cc1	ZINC000819443958	FF	On-Demand	Mild	CCR3	17	46
O=C(CCCc1ccc2ccccc2c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443961	EG	On-Demand	Anodyne	FKBP1A	27	42
O=C(CCCc1ccc2ccccc2c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443961	EG	On-Demand	Anodyne	CPT1A	117	40
O=C(CCCc1ccc2ccccc2c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443961	EG	On-Demand	Anodyne	PREP	68	42
O=C(CCCc1ccc2ccccc2c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443962	EG	On-Demand	Anodyne	FKBP1A	27	42
O=C(CCCc1ccc2ccccc2c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443962	EG	On-Demand	Anodyne	CPT1A	117	40
O=C(CCCc1ccc2ccccc2c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443962	EG	On-Demand	Anodyne	PREP	68	42
O=C(Cc1cn2ccccc2n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443967	CC	On-Demand	Anodyne	CPT1A	98	38
Cc1ccc(OC[C@H](O)CNc2ccc(C)cc2OCCN(C)C)cc1	ZINC000819443969	FG	On-Demand	Anodyne	ADRB2	22	48
Cc1ccc(OC[C@@H](O)CNc2ccc(C)cc2OCCN(C)C)cc1	ZINC000819443970	FG	On-Demand	Anodyne	ADRB2	22	48
O=C(Cc1cn2ccccc2n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443977	CC	On-Demand	Anodyne	CPT1A	98	38
O=C([C@H]1CCCc2ccccc21)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443984	CD	On-Demand	Anodyne	CPT1A	56	35
CN(C)CC1CCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819443985	GG	On-Demand	Anodyne	ADRB2	40	42
CN(C)CC1CCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819443985	GG	On-Demand	Anodyne	ADRB1	62	42
CN(C)CC1CCN(c2ccc(NC[C@@H](O)COc3ccccc3)cc2)CC1	ZINC000819443985	GG	On-Demand	Anodyne	ADRB3	48	45
O=C([C@@H]1CCCc2ccccc21)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443986	CD	On-Demand	Anodyne	CPT1A	56	35
CN(C)CC1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819443987	GG	On-Demand	Anodyne	ADRB2	40	42
CN(C)CC1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819443987	GG	On-Demand	Anodyne	ADRB1	62	42
CN(C)CC1CCN(c2ccc(NC[C@H](O)COc3ccccc3)cc2)CC1	ZINC000819443987	GG	On-Demand	Anodyne	ADRB3	48	45
O=C([C@H]1CCCc2ccccc21)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443988	CD	On-Demand	Anodyne	CPT1A	56	35
O=C([C@@H]1CCCc2ccccc21)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443991	CD	On-Demand	Anodyne	CPT1A	56	35
O=C(C/C=C/c1ccc(F)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443994	DE	On-Demand	Anodyne	CPT1A	33	41
O=C(C/C=C\c1ccc(F)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443995	DE	On-Demand	Anodyne	CPT1A	33	41
O=C(C/C=C/c1ccc(F)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819443996	DE	On-Demand	Anodyne	CPT1A	33	41
O=C(C/C=C\c1ccc(F)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819443998	DE	On-Demand	Anodyne	CPT1A	33	41
O=C(c1cc(COc2c(Cl)cccc2Cl)on1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444002	HG	On-Demand	Anodyne	CPT1A	103	40
O=C(c1cc(COc2c(Cl)cccc2Cl)on1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444005	HG	On-Demand	Anodyne	CPT1A	103	40
CN(C)CC1CCN(c2ccc(NC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819444012	FG	On-Demand	Anodyne	ADRB3	73	47
CN(C)CC1CCN(c2ccc(NC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819444013	FG	On-Demand	Anodyne	ADRB3	73	47
NC(=O)Nc1cccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819444021	DC	On-Demand	Anodyne	CPT1A	50	38
NC(=O)Nc1cccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819444021	DC	On-Demand	Anodyne	CFTR	41	34
NC(=O)Nc1cccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819444025	DC	On-Demand	Anodyne	CPT1A	50	38
NC(=O)Nc1cccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819444025	DC	On-Demand	Anodyne	CFTR	41	34
CN(C[C@@H](O)CNc1cccc(CN2CCC(O)CC2)c1)C(=O)OC(C)(C)C	ZINC000819444033	GE	On-Demand	Anodyne	ACHE	21	40
CN(C[C@@H](O)CNc1cccc(CN2CCC(O)CC2)c1)C(=O)OC(C)(C)C	ZINC000819444033	GE	On-Demand	Anodyne	MCHR1	20	40
CN(C[C@H](O)CNc1cccc(CN2CCC(O)CC2)c1)C(=O)OC(C)(C)C	ZINC000819444034	GE	On-Demand	Anodyne	ACHE	21	40
CN(C[C@H](O)CNc1cccc(CN2CCC(O)CC2)c1)C(=O)OC(C)(C)C	ZINC000819444034	GE	On-Demand	Anodyne	MCHR1	20	40
O=C(CSc1ccc(F)c(F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444038	ED	On-Demand	Anodyne	CPT1A	45	40
O=C(CSc1ccc(F)c(F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444040	ED	On-Demand	Anodyne	CPT1A	45	40
Cc1ccc(NC[C@H](O)c2ccc(Cl)cc2)c(OCCN(C)C)c1	ZINC000819444057	EH	On-Demand	Anodyne	UTS2	55	39
O=C(CCn1cnc2ccccc21)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444060	DD	On-Demand	Anodyne	CPT1A	101	41
O=C(CCn1cnc2ccccc21)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444062	DD	On-Demand	Anodyne	CPT1A	101	41
COc1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)c(C)c1	ZINC000819444075	CD	On-Demand	Anodyne	CPT1A	54	40
COc1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)c(C)c1	ZINC000819444078	CD	On-Demand	Anodyne	CPT1A	54	40
CCOc1ccc(-c2nnc(S)n2CCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819444093	HD	On-Demand	Anodyne	CPT1A	95	36
CCOc1ccc(-c2nnc(S)n2CCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819444099	HD	On-Demand	Anodyne	CPT1A	95	36
COc1ccc(-n2nc(C(=O)N3CCC[C@H]3c3nn[nH]n3)cc2C)cc1	ZINC000819444112	FD	On-Demand	Anodyne	CPT1A	36	43
COc1ccc(-n2nc(C(=O)N3CCC[C@@H]3c3nn[nH]n3)cc2C)cc1	ZINC000819444113	FD	On-Demand	Anodyne	CPT1A	36	43
O=C(c1cccc2cccnc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444134	CD	On-Demand	Anodyne	HCRTR1	33	47
O=C(c1cccc2cccnc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444134	CD	On-Demand	Anodyne	CPT1A	57	39
O=C(c1cccc2cccnc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444134	CD	On-Demand	Anodyne	HCRTR2	19	47
O=C(c1cccc2cccnc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444136	CD	On-Demand	Anodyne	HCRTR1	33	47
O=C(c1cccc2cccnc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444136	CD	On-Demand	Anodyne	CPT1A	57	39
O=C(c1cccc2cccnc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444136	CD	On-Demand	Anodyne	HCRTR2	19	47
CN(CC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccccc1[N+](=O)[O-]	ZINC000819444138	EC	On-Demand	Bother	CPT1A	54	37
CN(CC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccccc1[N+](=O)[O-]	ZINC000819444144	EC	On-Demand	Bother	CPT1A	54	37
O=C(NCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccc(C(F)(F)F)cc1	ZINC000819444145	FD	On-Demand	Anodyne	CPT1A	41	38
O=C(NCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccc(C(F)(F)F)cc1	ZINC000819444145	FD	On-Demand	Anodyne	DPP4	20	53
O=C(NCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccc(C(F)(F)F)cc1	ZINC000819444145	FD	On-Demand	Anodyne	PREP	25	47
O=C(NCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccc(C(F)(F)F)cc1	ZINC000819444145	FD	On-Demand	Anodyne	CCR2	50	37
O=C(NCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccc(C(F)(F)F)cc1	ZINC000819444148	FD	On-Demand	Anodyne	CPT1A	41	38
O=C(NCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccc(C(F)(F)F)cc1	ZINC000819444148	FD	On-Demand	Anodyne	DPP4	20	53
O=C(NCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccc(C(F)(F)F)cc1	ZINC000819444148	FD	On-Demand	Anodyne	PREP	25	47
O=C(NCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccc(C(F)(F)F)cc1	ZINC000819444148	FD	On-Demand	Anodyne	CCR2	50	37
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)C(C)C	ZINC000819444221	FI	On-Demand	Anodyne	ADRB2	39	42
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)C(C)C	ZINC000819444221	FI	On-Demand	Anodyne	ADRB1	45	59
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)C(C)C	ZINC000819444221	FI	On-Demand	Anodyne	ADRB3	73	48
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)C(C)C	ZINC000819444222	FI	On-Demand	Anodyne	ADRB2	39	42
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)C(C)C	ZINC000819444222	FI	On-Demand	Anodyne	ADRB1	45	59
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)C(C)C	ZINC000819444222	FI	On-Demand	Anodyne	ADRB3	73	48
O=[S@@](Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1)C1CCOCC1	ZINC000819444227	GH	On-Demand	Anodyne	ADRB1	26	41
O=[S@@](Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1)C1CCOCC1	ZINC000819444227	GH	On-Demand	Anodyne	ADRB3	40	39
O=[S@@](Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1)C1CCOCC1	ZINC000819444227	GH	On-Demand	Anodyne	CYP3A4	48	37
O=[S@](Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1)C1CCOCC1	ZINC000819444228	GH	On-Demand	Anodyne	ADRB1	26	41
O=[S@](Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1)C1CCOCC1	ZINC000819444228	GH	On-Demand	Anodyne	ADRB3	40	39
O=[S@](Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1)C1CCOCC1	ZINC000819444228	GH	On-Demand	Anodyne	CYP3A4	48	37
O=[S@@](Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1)C1CCOCC1	ZINC000819444229	GH	On-Demand	Anodyne	ADRB1	26	41
O=[S@@](Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1)C1CCOCC1	ZINC000819444229	GH	On-Demand	Anodyne	ADRB3	40	39
O=[S@@](Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1)C1CCOCC1	ZINC000819444229	GH	On-Demand	Anodyne	CYP3A4	48	37
O=[S@](Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1)C1CCOCC1	ZINC000819444230	GH	On-Demand	Anodyne	ADRB1	26	41
O=[S@](Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1)C1CCOCC1	ZINC000819444230	GH	On-Demand	Anodyne	ADRB3	40	39
O=[S@](Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1)C1CCOCC1	ZINC000819444230	GH	On-Demand	Anodyne	CYP3A4	48	37
NC(=O)CCNc1ccc(OC2CCCCC2)cc1	ZINC000819444231	CF	On-Demand	Anodyne	EPHX2	24	46
COCC[S@@](=O)Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819444244	FG	On-Demand	Anodyne	ADRB2	22	40
COCC[S@@](=O)Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819444244	FG	On-Demand	Anodyne	ADRB1	37	44
COCC[S@@](=O)Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819444244	FG	On-Demand	Anodyne	ADRB3	51	40
COCC[S@](=O)Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819444245	FG	On-Demand	Anodyne	ADRB2	22	40
COCC[S@](=O)Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819444245	FG	On-Demand	Anodyne	ADRB1	37	44
COCC[S@](=O)Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819444245	FG	On-Demand	Anodyne	ADRB3	51	40
COCC[S@@](=O)Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819444246	FG	On-Demand	Anodyne	ADRB2	22	40
COCC[S@@](=O)Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819444246	FG	On-Demand	Anodyne	ADRB1	37	44
COCC[S@@](=O)Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819444246	FG	On-Demand	Anodyne	ADRB3	51	40
COCC[S@](=O)Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819444247	FG	On-Demand	Anodyne	ADRB2	22	40
COCC[S@](=O)Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819444247	FG	On-Demand	Anodyne	ADRB1	37	44
COCC[S@](=O)Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819444247	FG	On-Demand	Anodyne	ADRB3	51	40
CCC[C@H]1C(=O)NCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819444255	FD	On-Demand	Mild	PAPA1_CARPA	30	41
CCC[C@H]1C(=O)NCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819444256	FD	On-Demand	Mild	PAPA1_CARPA	30	41
CCC[C@@H]1C(=O)NCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819444257	FD	On-Demand	Mild	PAPA1_CARPA	30	41
CCC[C@@H]1C(=O)NCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819444258	FD	On-Demand	Mild	PAPA1_CARPA	30	41
Cc1ccccc1[C@@H](O)CNc1cccc(CN2CCC(O)CC2)c1	ZINC000819444272	EG	On-Demand	Anodyne	SIGMAR1	30	43
Cc1ccc(NC[C@H](O)COc2ccccc2)c(OCCN(C)C)c1	ZINC000819444274	EF	On-Demand	Anodyne	ADRB2	35	44
Cc1ccc(NC[C@H](O)COc2ccccc2)c(OCCN(C)C)c1	ZINC000819444274	EF	On-Demand	Anodyne	ADRB1	37	43
Cc1ccc(NC[C@H](O)COc2ccccc2)c(OCCN(C)C)c1	ZINC000819444274	EF	On-Demand	Anodyne	ADRB3	21	40
Cc1ccc(NC[C@H](O)COc2ccccc2)c(OCCN(C)C)c1	ZINC000819444274	EF	On-Demand	Anodyne	ESRRG	44	33
Cc1ccc(NC[C@@H](O)COc2ccccc2)c(OCCN(C)C)c1	ZINC000819444275	EF	On-Demand	Anodyne	ADRB2	35	44
Cc1ccc(NC[C@@H](O)COc2ccccc2)c(OCCN(C)C)c1	ZINC000819444275	EF	On-Demand	Anodyne	ADRB1	37	43
Cc1ccc(NC[C@@H](O)COc2ccccc2)c(OCCN(C)C)c1	ZINC000819444275	EF	On-Demand	Anodyne	ADRB3	21	40
Cc1ccc(NC[C@@H](O)COc2ccccc2)c(OCCN(C)C)c1	ZINC000819444275	EF	On-Demand	Anodyne	ESRRG	44	33
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)COC1CCOCC1	ZINC000819444278	FE	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)COC1CCOCC1	ZINC000819444279	FE	On-Demand	Anodyne	ADRB1	27	40
OC1CCN(Cc2cccc(NC[C@H](O)c3ccc(Cl)cc3Cl)c2)CC1	ZINC000819444304	GI	On-Demand	Anodyne	DRD4	20	40
OC1CCN(Cc2cccc(NC[C@H](O)c3ccc(Cl)cc3Cl)c2)CC1	ZINC000819444304	GI	On-Demand	Anodyne	SIGMAR1	25	43
OC1CCN(Cc2cccc(NC[C@H](O)c3ccc(Cl)cc3Cl)c2)CC1	ZINC000819444304	GI	On-Demand	Anodyne	MCHR1	25	41
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccc(Cl)cc3Cl)c2)CC1	ZINC000819444305	GI	On-Demand	Anodyne	DRD4	20	40
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccc(Cl)cc3Cl)c2)CC1	ZINC000819444305	GI	On-Demand	Anodyne	SIGMAR1	25	43
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccc(Cl)cc3Cl)c2)CC1	ZINC000819444305	GI	On-Demand	Anodyne	MCHR1	25	41
OC1CCN(Cc2cccc(NC[C@H](O)c3ccccc3)c2)CC1	ZINC000819444314	EF	On-Demand	Anodyne	DRD4	33	41
OC1CCN(Cc2cccc(NC[C@H](O)c3ccccc3)c2)CC1	ZINC000819444314	EF	On-Demand	Anodyne	OPRK1	19	44
OC1CCN(Cc2cccc(NC[C@H](O)c3ccccc3)c2)CC1	ZINC000819444314	EF	On-Demand	Anodyne	SLC6A3	22	43
OC1CCN(Cc2cccc(NC[C@H](O)c3ccccc3)c2)CC1	ZINC000819444314	EF	On-Demand	Anodyne	SIGMAR1	44	45
OC1CCN(Cc2cccc(NC[C@H](O)c3ccccc3)c2)CC1	ZINC000819444314	EF	On-Demand	Anodyne	CCR3	22	42
OC1CCN(Cc2cccc(NC[C@H](O)c3ccccc3)c2)CC1	ZINC000819444314	EF	On-Demand	Anodyne	MCHR1	19	40
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccccc3)c2)CC1	ZINC000819444315	EF	On-Demand	Anodyne	DRD4	33	41
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccccc3)c2)CC1	ZINC000819444315	EF	On-Demand	Anodyne	OPRK1	19	44
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccccc3)c2)CC1	ZINC000819444315	EF	On-Demand	Anodyne	SLC6A3	22	43
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccccc3)c2)CC1	ZINC000819444315	EF	On-Demand	Anodyne	SIGMAR1	44	45
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccccc3)c2)CC1	ZINC000819444315	EF	On-Demand	Anodyne	CCR3	22	42
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccccc3)c2)CC1	ZINC000819444315	EF	On-Demand	Anodyne	MCHR1	19	40
OC1CCN(Cc2cccc(NC[C@H](O)c3cccc(F)c3)c2)CC1	ZINC000819444322	EF	On-Demand	Anodyne	SIGMAR1	21	45
OC1CCN(Cc2cccc(NC[C@H](O)c3cccc(F)c3)c2)CC1	ZINC000819444322	EF	On-Demand	Anodyne	CCR3	33	40
OC1CCN(Cc2cccc(NC[C@@H](O)c3cccc(F)c3)c2)CC1	ZINC000819444323	EF	On-Demand	Anodyne	SIGMAR1	21	45
OC1CCN(Cc2cccc(NC[C@@H](O)c3cccc(F)c3)c2)CC1	ZINC000819444323	EF	On-Demand	Anodyne	CCR3	33	40
OC1CCN(Cc2cccc(NC[C@H](O)c3ccccc3C(F)(F)F)c2)CC1	ZINC000819444324	GH	On-Demand	Anodyne	ACHE	25	41
OC1CCN(Cc2cccc(NC[C@H](O)c3ccccc3C(F)(F)F)c2)CC1	ZINC000819444324	GH	On-Demand	Anodyne	SIGMAR1	25	42
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccccc3C(F)(F)F)c2)CC1	ZINC000819444325	GH	On-Demand	Anodyne	ACHE	25	41
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccccc3C(F)(F)F)c2)CC1	ZINC000819444325	GH	On-Demand	Anodyne	SIGMAR1	25	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCC(F)(F)F)c(C)c2)cc1	ZINC000819444327	GH	On-Demand	Anodyne	ADRB2	29	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCC(F)(F)F)c(C)c2)cc1	ZINC000819444327	GH	On-Demand	Anodyne	ADRB1	43	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCC(F)(F)F)c(C)c2)cc1	ZINC000819444327	GH	On-Demand	Anodyne	PPARD	42	46
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCC(F)(F)F)c(C)c2)cc1	ZINC000819444328	GH	On-Demand	Anodyne	ADRB2	29	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCC(F)(F)F)c(C)c2)cc1	ZINC000819444328	GH	On-Demand	Anodyne	ADRB1	43	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCC(F)(F)F)c(C)c2)cc1	ZINC000819444328	GH	On-Demand	Anodyne	PPARD	42	46
CNC(=O)COc1cccc(CC(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819444352	EC	On-Demand	Anodyne	CPT1A	132	42
CNC(=O)COc1cccc(CC(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819444353	EC	On-Demand	Anodyne	CPT1A	132	42
O=C1CC[C@@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)c2ccccc21	ZINC000819444366	DD	On-Demand	Anodyne	CPT1A	45	35
O=C1CC[C@@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)c2ccccc21	ZINC000819444368	DD	On-Demand	Anodyne	CPT1A	45	35
O=C1CC[C@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)c2ccccc21	ZINC000819444369	DD	On-Demand	Anodyne	CPT1A	45	35
O=C1CC[C@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)c2ccccc21	ZINC000819444370	DD	On-Demand	Anodyne	CPT1A	45	35
N#Cc1ccc(SCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819444371	DD	On-Demand	Mild	CPT1A	55	43
N#Cc1ccc(SCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819444372	DD	On-Demand	Mild	CPT1A	55	43
O=C(CSCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccccc1	ZINC000819444373	ED	On-Demand	Anodyne	CPT1A	111	40
O=C(CSCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccccc1	ZINC000819444373	ED	On-Demand	Anodyne	PREP	62	41
O=C(CSCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccccc1	ZINC000819444374	ED	On-Demand	Anodyne	CPT1A	111	40
O=C(CSCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccccc1	ZINC000819444374	ED	On-Demand	Anodyne	PREP	62	41
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819444375	DB	On-Demand	Anodyne	CA2	28	56
NS(=O)(=O)c1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819444376	DB	On-Demand	Anodyne	CA2	28	56
CCn1c(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)nc2cc(C#N)ccc21	ZINC000819444384	FF	On-Demand	Mild	ITK	45	43
COc1cccc(SCC(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819444385	DD	On-Demand	Anodyne	CPT1A	116	43
COc1cccc(SCC(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819444386	DD	On-Demand	Anodyne	CPT1A	116	43
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc(Cl)c2OC(C)C)c1	ZINC000819444392	GI	On-Demand	Anodyne	ADRB2	19	45
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc(Cl)c2OC(C)C)c1	ZINC000819444392	GI	On-Demand	Anodyne	ADRB1	22	40
CC(=O)c1cccc(OC[C@H](O)CNc2cccc(Cl)c2OC(C)C)c1	ZINC000819444393	GI	On-Demand	Anodyne	ADRB2	19	45
CC(=O)c1cccc(OC[C@H](O)CNc2cccc(Cl)c2OC(C)C)c1	ZINC000819444393	GI	On-Demand	Anodyne	ADRB1	22	40
O=C(Cc1csc2ccc(Cl)cc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444400	EF	On-Demand	Anodyne	CPT1A	44	38
O=C(Cc1csc2ccc(Cl)cc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444406	EF	On-Demand	Anodyne	CPT1A	44	38
O=C(c1ccc(OC2CCC2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444414	DE	On-Demand	Anodyne	CPT1A	53	37
O=C(c1ccc(OC2CCC2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444420	DE	On-Demand	Anodyne	CPT1A	53	37
Cc1c(C(=O)N2CCC[C@@H]2c2nn[nH]n2)nnn1-c1ccccc1	ZINC000819444421	DD	On-Demand	Anodyne	CPT1A	58	40
CCc1noc2ncc(C(=O)N3CCC[C@@H]3c3nn[nH]n3)cc12	ZINC000819444435	DD	On-Demand	Anodyne	CPT1A	53	34
CCc1noc2ncc(C(=O)N3CCC[C@H]3c3nn[nH]n3)cc12	ZINC000819444437	DD	On-Demand	Anodyne	CPT1A	53	34
O=C(c1cnc(Cc2ccccc2F)s1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444444	FE	On-Demand	Anodyne	CPT1A	42	36
O=C(c1cnc(Cc2ccccc2F)s1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444447	FE	On-Demand	Anodyne	CPT1A	42	36
COC(=O)NCc1ccc(NC[C@@H](C)O)cc1	ZINC000819444453	BD	On-Demand	Anodyne	PDS	58	36
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1)C1CC1	ZINC000819444455	GI	On-Demand	Anodyne	GCGR	29	45
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1)C1CC1	ZINC000819444455	GI	On-Demand	Anodyne	GIPR	59	45
CC(=O)N(Cc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1)C1CC1	ZINC000819444457	GI	On-Demand	Anodyne	GCGR	29	45
CC(=O)N(Cc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1)C1CC1	ZINC000819444457	GI	On-Demand	Anodyne	GIPR	59	45
O=C(c1csc(-c2ccc(Br)s2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444462	HG	On-Demand	Anodyne	CPT1A	22	41
O=C(c1csc(-c2ccc(Br)s2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444464	HG	On-Demand	Anodyne	CPT1A	22	41
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc(Cl)c2OC(C)C)cc1	ZINC000819444467	GI	On-Demand	Anodyne	ADRB2	29	42
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc(Cl)c2OC(C)C)cc1	ZINC000819444467	GI	On-Demand	Anodyne	ADRB1	40	37
CC(=O)c1ccc(OC[C@H](O)CNc2cccc(Cl)c2OC(C)C)cc1	ZINC000819444468	GI	On-Demand	Anodyne	ADRB2	29	42
CC(=O)c1ccc(OC[C@H](O)CNc2cccc(Cl)c2OC(C)C)cc1	ZINC000819444468	GI	On-Demand	Anodyne	ADRB1	40	37
CCn1c(NC(=O)[C@@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)nc2cc(C#N)ccc21	ZINC000819444473	GF	On-Demand	Mild	ITK	40	41
O=C(Cc1nc(-c2ccc(F)cc2)cs1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444478	FE	On-Demand	Anodyne	CPT1A	74	44
O=C(Cc1nc(-c2ccc(F)cc2)cs1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444479	FE	On-Demand	Anodyne	CPT1A	74	44
Cc1nn(-c2ccccc2)cc1C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444480	DD	On-Demand	Anodyne	CPT1A	42	39
Cc1nn(-c2ccccc2)cc1C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444481	DD	On-Demand	Anodyne	CPT1A	42	39
O=C(c1ccc(Oc2cccc(Cl)c2Cl)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444482	HI	On-Demand	Anodyne	CPT1A	90	36
O=C(c1ccc(Oc2cccc(Cl)c2Cl)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444483	HI	On-Demand	Anodyne	CPT1A	90	36
O=C(C1CCC(c2ccccc2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444484	EF	On-Demand	Anodyne	CPT1A	104	39
O=C(C1CCC(c2ccccc2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444484	EF	On-Demand	Anodyne	SLC18A3	41	36
O=C(C1CCC(c2ccccc2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444484	EF	On-Demand	Anodyne	PREP	58	35
CCn1c(NC(=O)[C@H]2C[C@H]3C=C[C@H]2N(C(=O)OC)C3)nc2cc(C#N)ccc21	ZINC000819444485	GF	On-Demand	Mild	ITK	40	41
O=C(C1CCC(c2ccccc2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444490	EF	On-Demand	Anodyne	CPT1A	104	39
O=C(C1CCC(c2ccccc2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444490	EF	On-Demand	Anodyne	SLC18A3	41	36
O=C(C1CCC(c2ccccc2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444490	EF	On-Demand	Anodyne	PREP	58	35
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2C(C)C)cc1	ZINC000819444497	FH	On-Demand	Anodyne	ADRB2	48	47
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2C(C)C)cc1	ZINC000819444497	FH	On-Demand	Anodyne	ADRB1	70	38
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2C(C)C)cc1	ZINC000819444497	FH	On-Demand	Anodyne	ADRB3	35	40
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2C(C)C)cc1	ZINC000819444497	FH	On-Demand	Anodyne	ABCB1	28	41
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2C(C)C)cc1	ZINC000819444497	FH	On-Demand	Anodyne	PDS	56	40
Cc1c(C(=O)N2CCC[C@@H]2c2nn[nH]n2)nnn1Cc1ccc(F)cc1	ZINC000819444498	FD	On-Demand	Anodyne	CCR3	55	32
COC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2C(C)C)cc1	ZINC000819444499	FH	On-Demand	Anodyne	ADRB2	48	47
COC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2C(C)C)cc1	ZINC000819444499	FH	On-Demand	Anodyne	ADRB1	70	38
COC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2C(C)C)cc1	ZINC000819444499	FH	On-Demand	Anodyne	ADRB3	35	40
COC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2C(C)C)cc1	ZINC000819444499	FH	On-Demand	Anodyne	ABCB1	28	41
COC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2C(C)C)cc1	ZINC000819444499	FH	On-Demand	Anodyne	PDS	56	40
O=C(c1ccc(OCC2CCCCC2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444503	FG	On-Demand	Anodyne	CPT1A	108	39
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819444504	GH	On-Demand	Anodyne	ADRB2	51	44
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819444504	GH	On-Demand	Anodyne	ADRB1	77	44
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819444504	GH	On-Demand	Anodyne	GRIN1	34	50
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819444504	GH	On-Demand	Anodyne	ADRB3	51	44
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819444504	GH	On-Demand	Anodyne	PDS	93	57
O=C(c1ccc(OCC2CCCCC2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444505	FG	On-Demand	Anodyne	CPT1A	108	39
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819444506	GH	On-Demand	Anodyne	ADRB2	51	44
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819444506	GH	On-Demand	Anodyne	ADRB1	77	44
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819444506	GH	On-Demand	Anodyne	GRIN1	34	50
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819444506	GH	On-Demand	Anodyne	ADRB3	51	44
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)cc1	ZINC000819444506	GH	On-Demand	Anodyne	PDS	93	57
O=C(Cc1csc(-c2ccccn2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444514	ED	On-Demand	Anodyne	CPT1A	107	54
O=C(Cc1csc(-c2ccccn2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444516	ED	On-Demand	Anodyne	CPT1A	107	54
O=C(CCCc1cccc(C(F)(F)F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444518	FF	On-Demand	Anodyne	CPT1A	69	44
O=C(CCCc1cccc(C(F)(F)F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444518	FF	On-Demand	Anodyne	PREP	51	41
O=C(CCCc1cccc(C(F)(F)F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444520	FF	On-Demand	Anodyne	CPT1A	69	44
O=C(CCCc1cccc(C(F)(F)F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444520	FF	On-Demand	Anodyne	PREP	51	41
O=C(NCC(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCc2ccccc2C1	ZINC000819444521	FC	On-Demand	Anodyne	CPT1A	77	41
O=C(NCC(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCc2ccccc2C1	ZINC000819444521	FC	On-Demand	Anodyne	PREP	47	36
O=C(NCC(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCc2ccccc2C1	ZINC000819444522	FC	On-Demand	Anodyne	CPT1A	77	41
O=C(NCC(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCc2ccccc2C1	ZINC000819444522	FC	On-Demand	Anodyne	PREP	47	36
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccccc2C(F)(F)F)cc1)C1CC1	ZINC000819444538	GI	On-Demand	Anodyne	GIPR	41	38
CC(=O)N(Cc1ccc(NC[C@@H](O)c2ccccc2C(F)(F)F)cc1)C1CC1	ZINC000819444539	GI	On-Demand	Anodyne	GIPR	41	38
COC(=O)NCc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819444542	DE	On-Demand	Anodyne	ADRB2	36	46
COC(=O)NCc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819444542	DE	On-Demand	Anodyne	ADRB1	34	47
COC(=O)NCc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819444542	DE	On-Demand	Anodyne	ADRB3	110	49
COC(=O)NCc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819444542	DE	On-Demand	Anodyne	KCNA5	22	45
COC(=O)NCc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819444542	DE	On-Demand	Anodyne	NAMPT	60	39
COC(=O)NCc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819444542	DE	On-Demand	Anodyne	PDS	44	34
COC(=O)NCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819444543	DE	On-Demand	Anodyne	ADRB2	36	46
COC(=O)NCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819444543	DE	On-Demand	Anodyne	ADRB1	34	47
COC(=O)NCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819444543	DE	On-Demand	Anodyne	ADRB3	110	49
COC(=O)NCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819444543	DE	On-Demand	Anodyne	KCNA5	22	45
COC(=O)NCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819444543	DE	On-Demand	Anodyne	NAMPT	60	39
COC(=O)NCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819444543	DE	On-Demand	Anodyne	PDS	44	34
COC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819444544	FG	On-Demand	Anodyne	ADRB2	46	49
COC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819444544	FG	On-Demand	Anodyne	ADRB1	67	38
COC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819444544	FG	On-Demand	Anodyne	ADRB3	40	44
COC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819444544	FG	On-Demand	Anodyne	CASR	40	39
COC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819444544	FG	On-Demand	Anodyne	CYP2D6	15	41
COC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819444544	FG	On-Demand	Anodyne	PDS	66	56
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819444545	FG	On-Demand	Anodyne	ADRB2	46	49
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819444545	FG	On-Demand	Anodyne	ADRB1	67	38
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819444545	FG	On-Demand	Anodyne	ADRB3	40	44
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819444545	FG	On-Demand	Anodyne	CASR	40	39
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819444545	FG	On-Demand	Anodyne	CYP2D6	15	41
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819444545	FG	On-Demand	Anodyne	PDS	66	56
OC1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3F)c2)CC1	ZINC000819444629	FG	On-Demand	Anodyne	SIGMAR1	21	42
OC1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3F)c2)CC1	ZINC000819444629	FG	On-Demand	Anodyne	CCR3	44	40
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccc(F)cc3F)c2)CC1	ZINC000819444630	FG	On-Demand	Anodyne	SIGMAR1	21	42
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccc(F)cc3F)c2)CC1	ZINC000819444630	FG	On-Demand	Anodyne	CCR3	44	40
OC1CCN(Cc2cccc(NC[C@H](O)c3cccc(Cl)c3)c2)CC1	ZINC000819444632	FG	On-Demand	Anodyne	ADRB1	27	41
OC1CCN(Cc2cccc(NC[C@H](O)c3cccc(Cl)c3)c2)CC1	ZINC000819444632	FG	On-Demand	Anodyne	DRD4	18	41
OC1CCN(Cc2cccc(NC[C@H](O)c3cccc(Cl)c3)c2)CC1	ZINC000819444632	FG	On-Demand	Anodyne	ADRB3	42	40
OC1CCN(Cc2cccc(NC[C@H](O)c3cccc(Cl)c3)c2)CC1	ZINC000819444632	FG	On-Demand	Anodyne	IGF1R	28	41
OC1CCN(Cc2cccc(NC[C@H](O)c3cccc(Cl)c3)c2)CC1	ZINC000819444632	FG	On-Demand	Anodyne	SIGMAR1	25	43
OC1CCN(Cc2cccc(NC[C@H](O)c3cccc(Cl)c3)c2)CC1	ZINC000819444632	FG	On-Demand	Anodyne	CYP3A4	48	41
OC1CCN(Cc2cccc(NC[C@H](O)c3cccc(Cl)c3)c2)CC1	ZINC000819444632	FG	On-Demand	Anodyne	MCHR1	23	40
OC1CCN(Cc2cccc(NC[C@@H](O)c3cccc(Cl)c3)c2)CC1	ZINC000819444633	FG	On-Demand	Anodyne	ADRB1	27	41
OC1CCN(Cc2cccc(NC[C@@H](O)c3cccc(Cl)c3)c2)CC1	ZINC000819444633	FG	On-Demand	Anodyne	DRD4	18	41
OC1CCN(Cc2cccc(NC[C@@H](O)c3cccc(Cl)c3)c2)CC1	ZINC000819444633	FG	On-Demand	Anodyne	ADRB3	42	40
OC1CCN(Cc2cccc(NC[C@@H](O)c3cccc(Cl)c3)c2)CC1	ZINC000819444633	FG	On-Demand	Anodyne	IGF1R	28	41
OC1CCN(Cc2cccc(NC[C@@H](O)c3cccc(Cl)c3)c2)CC1	ZINC000819444633	FG	On-Demand	Anodyne	SIGMAR1	25	43
OC1CCN(Cc2cccc(NC[C@@H](O)c3cccc(Cl)c3)c2)CC1	ZINC000819444633	FG	On-Demand	Anodyne	CYP3A4	48	41
OC1CCN(Cc2cccc(NC[C@@H](O)c3cccc(Cl)c3)c2)CC1	ZINC000819444633	FG	On-Demand	Anodyne	MCHR1	23	40
CN(Cc1ccc(Cl)c(F)c1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819444640	GI	On-Demand	Mild	PAPA1_CARPA	48	45
CN(Cc1ccc(Cl)c(F)c1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819444643	GI	On-Demand	Mild	PAPA1_CARPA	48	45
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)CC1CCCC1	ZINC000819444648	EH	On-Demand	Anodyne	ADRB1	23	40
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)CC1CCCC1	ZINC000819444648	EH	On-Demand	Anodyne	CTSS	19	44
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)CC1CCCC1	ZINC000819444649	EH	On-Demand	Anodyne	ADRB1	23	40
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)CC1CCCC1	ZINC000819444649	EH	On-Demand	Anodyne	CTSS	19	44
CS(=O)(=O)c1cccc(Oc2ccc(NC[C@@H](O)C3CC3)cc2)c1	ZINC000819444713	EG	On-Demand	Anodyne	NR1H3	46	37
CS(=O)(=O)c1cccc(Oc2ccc(NC[C@H](O)C3CC3)cc2)c1	ZINC000819444714	EG	On-Demand	Anodyne	NR1H3	46	37
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OCC3CCOCC3)cc2)cc1	ZINC000819444737	GG	On-Demand	Mild	ADRB2	21	40
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OCC3CCOCC3)cc2)cc1	ZINC000819444737	GG	On-Demand	Mild	ADRB1	48	41
N#Cc1ccc(OC[C@H](O)CNc2ccc(OCC3CCOCC3)cc2)cc1	ZINC000819444738	GG	On-Demand	Mild	ADRB2	21	40
N#Cc1ccc(OC[C@H](O)CNc2ccc(OCC3CCOCC3)cc2)cc1	ZINC000819444738	GG	On-Demand	Mild	ADRB1	48	41
O=C(CCNc1ccc(OCC2CCOCC2)cc1)Nc1ccccc1	ZINC000819444741	FH	On-Demand	Anodyne	LTA4H	43	45
O=C(CCNc1ccc(OCC2CCOCC2)cc1)Nc1ccccc1	ZINC000819444741	FH	On-Demand	Anodyne	EPHX2	23	44
O[C@@H](CCc1ccccc1)CNc1ccc(OCC2CCOCC2)cc1	ZINC000819444748	FH	On-Demand	Anodyne	CTSS	18	41
O[C@H](CCc1ccccc1)CNc1ccc(OCC2CCOCC2)cc1	ZINC000819444749	FH	On-Demand	Anodyne	CTSS	18	41
O=C(CCS(=O)(=O)c1ccc2c(c1)CCC2)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444777	GD	On-Demand	Anodyne	CPT1A	51	36
O=C(CCS(=O)(=O)c1ccc2c(c1)CCC2)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444779	GD	On-Demand	Anodyne	CPT1A	51	36
O=C(CSc1cc(Cl)ccc1Cl)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444800	FF	On-Demand	Anodyne	CPT1A	40	33
O=C(CSc1cc(Cl)ccc1Cl)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444802	FF	On-Demand	Anodyne	CPT1A	40	33
C=C[C@@H](CC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccccc1	ZINC000819444804	CE	On-Demand	Mild	CPT1A	97	39
C=C[C@@H](CC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccccc1	ZINC000819444806	CE	On-Demand	Mild	CPT1A	97	39
C=C[C@H](CC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccccc1	ZINC000819444808	CE	On-Demand	Mild	CPT1A	97	39
C=C[C@H](CC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccccc1	ZINC000819444810	CE	On-Demand	Mild	CPT1A	97	39
CCOc1ccc(-c2nc(CC(=O)N3CCC[C@H]3c3nn[nH]n3)cs2)cc1	ZINC000819444837	GF	On-Demand	Anodyne	CPT1A	117	48
CCOc1ccc(-c2nc(CC(=O)N3CCC[C@@H]3c3nn[nH]n3)cs2)cc1	ZINC000819444839	GF	On-Demand	Anodyne	CPT1A	117	48
O=C(CCCc1nccs1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444841	CD	On-Demand	Anodyne	CPT1A	59	38
O=C(CCCc1nccs1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444841	CD	On-Demand	Anodyne	PREP	35	43
O=C(CCCc1nccs1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444843	CD	On-Demand	Anodyne	CPT1A	59	38
O=C(CCCc1nccs1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444843	CD	On-Demand	Anodyne	PREP	35	43
O=C(CCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccc(Cl)cc1	ZINC000819444845	EE	On-Demand	Anodyne	PRCP	30	41
O=C(CCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccc(Cl)cc1	ZINC000819444845	EE	On-Demand	Anodyne	CPT1A	86	39
O=C(CCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccc(Cl)cc1	ZINC000819444847	EE	On-Demand	Anodyne	PRCP	30	41
O=C(CCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccc(Cl)cc1	ZINC000819444847	EE	On-Demand	Anodyne	CPT1A	86	39
O=C(Cn1cc(-c2ccccc2)nn1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444861	DC	On-Demand	Anodyne	CPT1A	108	42
O=C(Cn1cc(-c2ccccc2)nn1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444861	DC	On-Demand	Anodyne	DPP8	15	41
O=C(Cn1cc(-c2ccccc2)nn1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444861	DC	On-Demand	Anodyne	DPP9	18	41
O=C(Cn1cc(-c2ccccc2)nn1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444863	DC	On-Demand	Anodyne	CPT1A	108	42
O=C(Cn1cc(-c2ccccc2)nn1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444863	DC	On-Demand	Anodyne	DPP8	15	41
O=C(Cn1cc(-c2ccccc2)nn1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444863	DC	On-Demand	Anodyne	DPP9	18	41
O=C(CSCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccc(Cl)cc1	ZINC000819444869	FE	On-Demand	Anodyne	CPT1A	46	36
O=C(CSCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccc(Cl)cc1	ZINC000819444871	FE	On-Demand	Anodyne	CPT1A	46	36
CCCOc1nc2ccccc2cc1/C=C\C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444921	GF	On-Demand	Anodyne	CPT1A	44	34
CCCOc1nc2ccccc2cc1/C=C/C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444923	GF	On-Demand	Anodyne	CPT1A	44	34
CCCOc1nc2ccccc2cc1/C=C\C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444924	GF	On-Demand	Anodyne	CPT1A	44	34
CCCOc1nc2ccccc2cc1/C=C/C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444925	GF	On-Demand	Anodyne	CPT1A	44	34
O=C(CCSc1ccccc1Br)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819444926	GF	On-Demand	Anodyne	CPT1A	90	38
O=C(CCSc1ccccc1Br)N1CCC[C@H]1c1nn[nH]n1	ZINC000819444927	GF	On-Demand	Anodyne	CPT1A	90	38
O[C@@H](CNc1cccc(CSC2CCCCC2)c1)c1cccnc1	ZINC000819444961	EJ	On-Demand	Anodyne	ADRB2	22	40
O[C@@H](CNc1cccc(CSC2CCCCC2)c1)c1cccnc1	ZINC000819444961	EJ	On-Demand	Anodyne	ADRB1	23	41
O[C@@H](CNc1cccc(CSC2CCCCC2)c1)c1cccnc1	ZINC000819444961	EJ	On-Demand	Anodyne	ADRB3	87	44
O[C@@H](CNc1cccc(CSC2CCCCC2)c1)c1cccnc1	ZINC000819444961	EJ	On-Demand	Anodyne	QRFPR	18	44
O[C@H](CNc1cccc(CSC2CCCCC2)c1)c1cccnc1	ZINC000819444962	EJ	On-Demand	Anodyne	ADRB2	22	40
O[C@H](CNc1cccc(CSC2CCCCC2)c1)c1cccnc1	ZINC000819444962	EJ	On-Demand	Anodyne	ADRB1	23	41
O[C@H](CNc1cccc(CSC2CCCCC2)c1)c1cccnc1	ZINC000819444962	EJ	On-Demand	Anodyne	ADRB3	87	44
O[C@H](CNc1cccc(CSC2CCCCC2)c1)c1cccnc1	ZINC000819444962	EJ	On-Demand	Anodyne	QRFPR	18	44
O[C@@H](CNc1ccc(OC2CCCCC2)cc1)c1cccnc1	ZINC000819444979	DH	On-Demand	Anodyne	ADRB1	31	48
O[C@@H](CNc1ccc(OC2CCCCC2)cc1)c1cccnc1	ZINC000819444979	DH	On-Demand	Anodyne	ADRB3	98	50
O[C@H](CNc1ccc(OC2CCCCC2)cc1)c1cccnc1	ZINC000819444982	DH	On-Demand	Anodyne	ADRB1	31	48
O[C@H](CNc1ccc(OC2CCCCC2)cc1)c1cccnc1	ZINC000819444982	DH	On-Demand	Anodyne	ADRB3	98	50
O=[N+]([O-])c1cccc([C@@H](O)CNc2cccc(CN3CCC(O)CC3)c2)c1	ZINC000819445005	FF	On-Demand	Bother	SIGMAR1	15	48
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1)C(C)C	ZINC000819445006	FI	On-Demand	Anodyne	ADRB2	15	48
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1)C(C)C	ZINC000819445006	FI	On-Demand	Anodyne	ADRB1	15	42
O=[N+]([O-])c1cccc([C@H](O)CNc2cccc(CN3CCC(O)CC3)c2)c1	ZINC000819445007	FF	On-Demand	Bother	SIGMAR1	15	48
CN(C)CC1CCN(c2ccc(NCCC(=O)Nc3ccccc3)cc2)CC1	ZINC000819445013	GH	On-Demand	Anodyne	NPY2R	40	38
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccccc1	ZINC000819445025	FG	On-Demand	Anodyne	ADRB2	48	44
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccccc1	ZINC000819445025	FG	On-Demand	Anodyne	ADRB1	76	42
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccccc1	ZINC000819445025	FG	On-Demand	Anodyne	ADRB3	49	42
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccccc1	ZINC000819445026	FG	On-Demand	Anodyne	ADRB2	48	44
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccccc1	ZINC000819445026	FG	On-Demand	Anodyne	ADRB1	76	42
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccccc1	ZINC000819445026	FG	On-Demand	Anodyne	ADRB3	49	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC3CCOCC3)cc2)c1	ZINC000819445037	GH	On-Demand	Anodyne	ADRB2	30	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC3CCOCC3)cc2)c1	ZINC000819445037	GH	On-Demand	Anodyne	ADRB1	64	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC3CCOCC3)cc2)c1	ZINC000819445037	GH	On-Demand	Anodyne	ABCB1	15	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC3CCOCC3)cc2)c1	ZINC000819445038	GH	On-Demand	Anodyne	ADRB2	30	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC3CCOCC3)cc2)c1	ZINC000819445038	GH	On-Demand	Anodyne	ADRB1	64	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC3CCOCC3)cc2)c1	ZINC000819445038	GH	On-Demand	Anodyne	ABCB1	15	41
CN(C)CC1CCN(c2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819445040	GI	On-Demand	Anodyne	ADRB1	25	43
CN(C)CC1CCN(c2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819445040	GI	On-Demand	Anodyne	ADRB3	43	37
CN(C)CC1CCN(c2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819445040	GI	On-Demand	Anodyne	IGF1R	31	44
CN(C)CC1CCN(c2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819445040	GI	On-Demand	Anodyne	CYP3A4	55	44
CN(C)CC1CCN(c2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819445042	GI	On-Demand	Anodyne	ADRB1	25	43
CN(C)CC1CCN(c2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819445042	GI	On-Demand	Anodyne	ADRB3	43	37
CN(C)CC1CCN(c2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819445042	GI	On-Demand	Anodyne	IGF1R	31	44
CN(C)CC1CCN(c2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819445042	GI	On-Demand	Anodyne	CYP3A4	55	44
CN(C)CC1CCN(c2ccc(NC[C@@H](O)c3ccc([N+](=O)[O-])cc3)cc2)CC1	ZINC000819445054	GH	On-Demand	Bother	SSTR1	25	41
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1)C(C)C	ZINC000819445055	FG	On-Demand	Bother	COLA	26	42
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1)C(C)C	ZINC000819445055	FG	On-Demand	Bother	MMP2	18	42
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1)C(C)C	ZINC000819445055	FG	On-Demand	Bother	MMP8	36	42
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1)C(C)C	ZINC000819445055	FG	On-Demand	Bother	MMP9	19	42
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1)C(C)C	ZINC000819445055	FG	On-Demand	Bother	MMP1	29	42
CN(C)CC1CCN(c2ccc(NC[C@H](O)c3ccc([N+](=O)[O-])cc3)cc2)CC1	ZINC000819445056	GH	On-Demand	Bother	SSTR1	25	41
CC(=O)N(Cc1ccc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1)C(C)C	ZINC000819445058	FG	On-Demand	Bother	COLA	26	42
CC(=O)N(Cc1ccc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1)C(C)C	ZINC000819445058	FG	On-Demand	Bother	MMP2	18	42
CC(=O)N(Cc1ccc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1)C(C)C	ZINC000819445058	FG	On-Demand	Bother	MMP8	36	42
CC(=O)N(Cc1ccc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1)C(C)C	ZINC000819445058	FG	On-Demand	Bother	MMP9	19	42
CC(=O)N(Cc1ccc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1)C(C)C	ZINC000819445058	FG	On-Demand	Bother	MMP1	29	42
CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819445086	FD	On-Demand	Mild	PAPA1_CARPA	34	44
CNC(=O)[C@@H]1CCC[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819445087	FD	On-Demand	Mild	PAPA1_CARPA	34	44
CNC(=O)[C@@H]1CCC[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819445089	FD	On-Demand	Mild	PAPA1_CARPA	34	44
CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819445090	FD	On-Demand	Mild	PAPA1_CARPA	34	44
OC1CCN(Cc2cccc(NC[C@H](O)c3ccccc3Cl)c2)CC1	ZINC000819445095	FG	On-Demand	Anodyne	SIGMAR1	38	43
NC(=O)NC(=O)CCNc1ccc(OC2CCCCC2)cc1	ZINC000819445117	DE	On-Demand	Anodyne	EPHX2	16	42
O=C(c1ccc(C(F)(F)F)cc1O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445130	ED	On-Demand	Anodyne	LIPG	47	33
O=C(c1ccc(C(F)(F)F)cc1O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445131	ED	On-Demand	Anodyne	LIPG	47	33
O=C(c1ccc2cc[nH]c2c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445151	CD	On-Demand	Anodyne	CPT1A	63	42
O=C(c1ccc2cc[nH]c2c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445152	CD	On-Demand	Anodyne	CPT1A	63	42
O=C(c1cccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)c1O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445153	HC	On-Demand	Anodyne	CPT1A	44	37
O=C(c1cccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)c1O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445154	HC	On-Demand	Anodyne	CPT1A	44	37
O=C(c1cccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)c1O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445155	HC	On-Demand	Anodyne	CPT1A	44	37
O=C([C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445158	HD	On-Demand	Anodyne	CPT1A	66	36
O=C([C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445158	HD	On-Demand	Anodyne	PREP	63	34
O=C([C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445158	HD	On-Demand	Anodyne	TMPRSS11D	41	32
O=C([C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445160	HD	On-Demand	Anodyne	CPT1A	66	36
O=C([C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445160	HD	On-Demand	Anodyne	PREP	63	34
O=C([C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445160	HD	On-Demand	Anodyne	TMPRSS11D	41	32
O=C([C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445161	HD	On-Demand	Anodyne	CPT1A	66	36
O=C([C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445161	HD	On-Demand	Anodyne	PREP	63	34
O=C([C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445161	HD	On-Demand	Anodyne	TMPRSS11D	41	32
O=C([C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445164	HD	On-Demand	Anodyne	CPT1A	66	36
O=C([C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445164	HD	On-Demand	Anodyne	PREP	63	34
O=C([C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445164	HD	On-Demand	Anodyne	TMPRSS11D	41	32
O=C(NCC(=O)N1CCC[C@H]1c1nn[nH]n1)NCc1ccco1	ZINC000819445179	DB	On-Demand	Anodyne	CPT1A	42	33
O=C(NCC(=O)N1CCC[C@@H]1c1nn[nH]n1)NCc1ccco1	ZINC000819445180	DB	On-Demand	Anodyne	CPT1A	42	33
O=C(c1nc(-c2ccccc2)cs1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445181	EE	On-Demand	Anodyne	CPT1A	97	46
O=C(c1nc(-c2ccccc2)cs1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445182	EE	On-Demand	Anodyne	CPT1A	97	46
O=C(c1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1)c1cccc(O)c1	ZINC000819445183	FE	On-Demand	Anodyne	CPT1A	41	35
O=C(c1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1)c1cccc(O)c1	ZINC000819445184	FE	On-Demand	Anodyne	CPT1A	41	35
O=C(CCn1nc(O)c2ccccc2c1=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445185	FC	On-Demand	Anodyne	CPT1A	78	38
O=C(CCn1nc(O)c2ccccc2c1=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445186	FC	On-Demand	Anodyne	CPT1A	78	38
O=C(c1cn2ccccc2n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445189	CC	On-Demand	Anodyne	CPT1A	54	38
O=C(c1cn2ccccc2n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445190	CC	On-Demand	Anodyne	CPT1A	54	38
O=C(NCC(=O)N1CCC[C@@H]1c1nn[nH]n1)NCc1ccc(Cl)cc1	ZINC000819445191	FD	On-Demand	Anodyne	PREP	24	45
O=C(NCC(=O)N1CCC[C@H]1c1nn[nH]n1)NCc1ccc(Cl)cc1	ZINC000819445192	FD	On-Demand	Anodyne	PREP	24	45
Cc1c(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cccc1-c1ccccn1	ZINC000819445200	EF	On-Demand	Anodyne	CPT1A	48	35
Cc1c(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cccc1-c1ccccn1	ZINC000819445200	EF	On-Demand	Anodyne	HCRTR2	18	40
O=C(COc1ccccc1)N1CCC[C@@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)C1	ZINC000819445205	GD	On-Demand	Anodyne	CPT1A	159	52
O=C(COc1ccccc1)N1CCC[C@@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)C1	ZINC000819445205	GD	On-Demand	Anodyne	CPT2	57	43
O=C(COc1ccccc1)N1CCC[C@@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)C1	ZINC000819445205	GD	On-Demand	Anodyne	PREP	105	39
O=C(COc1ccccc1)N1CCC[C@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)C1	ZINC000819445206	GD	On-Demand	Anodyne	CPT1A	159	52
O=C(COc1ccccc1)N1CCC[C@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)C1	ZINC000819445206	GD	On-Demand	Anodyne	CPT2	57	43
O=C(COc1ccccc1)N1CCC[C@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)C1	ZINC000819445206	GD	On-Demand	Anodyne	PREP	105	39
O=C(COc1ccccc1)N1CCC[C@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)C1	ZINC000819445207	GD	On-Demand	Anodyne	CPT1A	159	52
O=C(COc1ccccc1)N1CCC[C@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)C1	ZINC000819445207	GD	On-Demand	Anodyne	CPT2	57	43
O=C(COc1ccccc1)N1CCC[C@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)C1	ZINC000819445207	GD	On-Demand	Anodyne	PREP	105	39
O=C(COc1ccccc1)N1CCC[C@@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)C1	ZINC000819445208	GD	On-Demand	Anodyne	CPT1A	159	52
O=C(COc1ccccc1)N1CCC[C@@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)C1	ZINC000819445208	GD	On-Demand	Anodyne	CPT2	57	43
O=C(COc1ccccc1)N1CCC[C@@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)C1	ZINC000819445208	GD	On-Demand	Anodyne	PREP	105	39
COC[C@@H](C)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445213	BC	On-Demand	Anodyne	TRHR	48	32
COC[C@H](C)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445214	BC	On-Demand	Anodyne	TRHR	48	32
COC[C@@H](C)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445215	BC	On-Demand	Anodyne	TRHR	48	32
COC[C@H](C)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445216	BC	On-Demand	Anodyne	TRHR	48	32
O=C(c1csc(-c2c(F)cccc2F)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445221	FF	On-Demand	Anodyne	CPT1A	47	38
O=C(c1csc(-c2c(F)cccc2F)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445221	FF	On-Demand	Anodyne	TRPC6	43	37
O=C(c1csc(-c2c(F)cccc2F)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445221	FF	On-Demand	Anodyne	TRPC3	42	37
O=C(c1csc(-c2c(F)cccc2F)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445222	FF	On-Demand	Anodyne	CPT1A	47	38
O=C(c1csc(-c2c(F)cccc2F)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445222	FF	On-Demand	Anodyne	TRPC6	43	37
O=C(c1csc(-c2c(F)cccc2F)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445222	FF	On-Demand	Anodyne	TRPC3	42	37
COCCOc1cc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)ccn1	ZINC000819445223	DC	On-Demand	Anodyne	CPT1A	73	34
COCCOc1cc(C(=O)N2CCC[C@H]2c2nn[nH]n2)ccn1	ZINC000819445224	DC	On-Demand	Anodyne	CPT1A	73	34
O=C(Cc1n[nH]c2ccccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445225	CC	On-Demand	Anodyne	CPT1A	86	42
O=C(Cc1n[nH]c2ccccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445226	CC	On-Demand	Anodyne	CPT1A	86	42
O=C(CCC(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCN(c2ccccn2)CC1	ZINC000819445237	GC	On-Demand	Anodyne	CPT1A	107	50
O=C(CCC(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCN(c2ccccn2)CC1	ZINC000819445238	GC	On-Demand	Anodyne	CPT1A	107	50
Cc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)c(OCCN(C)C)c1	ZINC000819445265	GG	On-Demand	Anodyne	ADRB2	15	54
Cc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)c(OCCN(C)C)c1	ZINC000819445265	GG	On-Demand	Anodyne	ADRB1	22	54
Cc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c(OCCN(C)C)c1	ZINC000819445267	GG	On-Demand	Anodyne	ADRB2	15	54
Cc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c(OCCN(C)C)c1	ZINC000819445267	GG	On-Demand	Anodyne	ADRB1	22	54
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)COCc1cccs1	ZINC000819445288	GH	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)COCc1cccs1	ZINC000819445290	GH	On-Demand	Anodyne	ADRB1	27	40
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccnc2)cc1)C(C)C	ZINC000819445297	EF	On-Demand	Anodyne	ADRB2	33	46
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccnc2)cc1)C(C)C	ZINC000819445297	EF	On-Demand	Anodyne	ADRB1	32	47
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccnc2)cc1)C(C)C	ZINC000819445297	EF	On-Demand	Anodyne	ADRB3	113	55
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccnc2)cc1)C(C)C	ZINC000819445297	EF	On-Demand	Anodyne	KCNA5	24	40
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccnc2)cc1)C(C)C	ZINC000819445299	EF	On-Demand	Anodyne	ADRB2	33	46
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccnc2)cc1)C(C)C	ZINC000819445299	EF	On-Demand	Anodyne	ADRB1	32	47
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccnc2)cc1)C(C)C	ZINC000819445299	EF	On-Demand	Anodyne	ADRB3	113	55
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccnc2)cc1)C(C)C	ZINC000819445299	EF	On-Demand	Anodyne	KCNA5	24	40
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccc(F)cc1	ZINC000819445310	GG	On-Demand	Anodyne	ADRB2	27	40
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccc(F)cc1	ZINC000819445310	GG	On-Demand	Anodyne	ADRB1	55	44
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccc(F)cc1	ZINC000819445311	GG	On-Demand	Anodyne	ADRB2	27	40
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccc(F)cc1	ZINC000819445311	GG	On-Demand	Anodyne	ADRB1	55	44
C[C@@H](O)C(=O)N1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819445316	GC	On-Demand	Mild	PAPA1_CARPA	37	44
C[C@@H](O)C(=O)N1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819445316	GC	On-Demand	Mild	CTSK	17	44
C[C@@H](O)C(=O)N1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819445320	GC	On-Demand	Mild	PAPA1_CARPA	37	44
C[C@@H](O)C(=O)N1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819445320	GC	On-Demand	Mild	CTSK	17	44
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1)C(C)C	ZINC000819445348	FG	On-Demand	Bother	ADRB2	15	41
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1)C(C)C	ZINC000819445348	FG	On-Demand	Bother	ADRB1	18	41
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1)C(C)C	ZINC000819445348	FG	On-Demand	Bother	COLA	44	37
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1)C(C)C	ZINC000819445349	FG	On-Demand	Bother	ADRB2	15	41
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1)C(C)C	ZINC000819445349	FG	On-Demand	Bother	ADRB1	18	41
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1)C(C)C	ZINC000819445349	FG	On-Demand	Bother	COLA	44	37
COC[C@@H](O)CNc1ccc(OCC2CCOCC2)cc1	ZINC000819445354	CD	On-Demand	Anodyne	ADRB2	16	42
COC[C@@H](O)CNc1ccc(OCC2CCOCC2)cc1	ZINC000819445354	CD	On-Demand	Anodyne	ADRB1	36	42
OC1CCN(Cc2cccc(NC[C@@H](O)c3cc4ccccc4o3)c2)CC1	ZINC000819445374	FH	On-Demand	Anodyne	SIGMAR1	28	40
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccc(Cl)cc1	ZINC000819445383	GH	On-Demand	Anodyne	ADRB2	23	40
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccc(Cl)cc1	ZINC000819445383	GH	On-Demand	Anodyne	ADRB1	48	44
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccc(Cl)cc1	ZINC000819445383	GH	On-Demand	Anodyne	GRIN1	18	41
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccc(Cl)cc1	ZINC000819445385	GH	On-Demand	Anodyne	ADRB2	23	40
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccc(Cl)cc1	ZINC000819445385	GH	On-Demand	Anodyne	ADRB1	48	44
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccc(Cl)cc1	ZINC000819445385	GH	On-Demand	Anodyne	GRIN1	18	41
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)COCc1ccccc1	ZINC000819445408	FG	On-Demand	Anodyne	ADRB1	44	46
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)COCc1ccccc1	ZINC000819445410	FG	On-Demand	Anodyne	ADRB1	44	46
OC1CCN(Cc2cccc(NC[C@H](O)c3cc(F)ccc3F)c2)CC1	ZINC000819445412	FG	On-Demand	Anodyne	SIGMAR1	22	42
OC1CCN(Cc2cccc(NC[C@H](O)c3cc(F)ccc3F)c2)CC1	ZINC000819445412	FG	On-Demand	Anodyne	CCR3	43	40
OC1CCN(Cc2cccc(NC[C@@H](O)c3cc(F)ccc3F)c2)CC1	ZINC000819445414	FG	On-Demand	Anodyne	SIGMAR1	22	42
OC1CCN(Cc2cccc(NC[C@@H](O)c3cc(F)ccc3F)c2)CC1	ZINC000819445414	FG	On-Demand	Anodyne	CCR3	43	40
OC1CCN(Cc2cccc(NC[C@H](O)c3cccc(C(F)(F)F)c3)c2)CC1	ZINC000819445425	GH	On-Demand	Anodyne	MCHR1	21	44
OC1CCN(Cc2cccc(NC[C@@H](O)c3cccc(C(F)(F)F)c3)c2)CC1	ZINC000819445426	GH	On-Demand	Anodyne	MCHR1	21	44
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccc(F)cc2C)cc1)C(C)C	ZINC000819445444	FI	On-Demand	Anodyne	LEF	40	32
CN(C)CC1CCN(c2ccc(NCCC(=O)Nc3cccc(F)c3)cc2)CC1	ZINC000819445446	GI	On-Demand	Anodyne	CCR3	46	36
CC(=O)N(Cc1ccc(NC[C@@H](O)c2ccc(F)cc2C)cc1)C(C)C	ZINC000819445448	FI	On-Demand	Anodyne	LEF	40	32
CON(C)C(=O)CCNc1ccc(OC2CCCCC2)cc1	ZINC000819445461	DG	On-Demand	Anodyne	EPHX2	21	43
COC(=O)N(C)Cc1ccc(NCCS(=O)(=O)c2ccccc2)cc1	ZINC000819445487	FF	On-Demand	Anodyne	PTPRB	66	45
COC(=O)N(C)Cc1ccc(NCCS(=O)(=O)c2ccccc2)cc1	ZINC000819445487	FF	On-Demand	Anodyne	LIMK2	29	42
COC(=O)N(C)Cc1ccc(NCCS(=O)(=O)c2ccccc2)cc1	ZINC000819445487	FF	On-Demand	Anodyne	RORC	20	40
CN(CC(C)(C)S(C)(=O)=O)C(=O)CCc1cccc(OC(F)F)c1	ZINC000819445488	FF	On-Demand	Anodyne	CRTM	41	37
O=[S@](Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1)C1CCCCC1	ZINC000819445489	GK	On-Demand	Anodyne	ADRB1	30	42
O=[S@](Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1)C1CCCCC1	ZINC000819445489	GK	On-Demand	Anodyne	ADRB3	43	40
O=[S@](Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1)C1CCCCC1	ZINC000819445489	GK	On-Demand	Anodyne	CYP3A4	47	36
O=[S@@](Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1)C1CCCCC1	ZINC000819445490	GK	On-Demand	Anodyne	ADRB1	30	42
O=[S@@](Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1)C1CCCCC1	ZINC000819445490	GK	On-Demand	Anodyne	ADRB3	43	40
O=[S@@](Cc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1)C1CCCCC1	ZINC000819445490	GK	On-Demand	Anodyne	CYP3A4	47	36
O=[S@](Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1)C1CCCCC1	ZINC000819445491	GK	On-Demand	Anodyne	ADRB1	30	42
O=[S@](Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1)C1CCCCC1	ZINC000819445491	GK	On-Demand	Anodyne	ADRB3	43	40
O=[S@](Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1)C1CCCCC1	ZINC000819445491	GK	On-Demand	Anodyne	CYP3A4	47	36
O=[S@@](Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1)C1CCCCC1	ZINC000819445492	GK	On-Demand	Anodyne	ADRB1	30	42
O=[S@@](Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1)C1CCCCC1	ZINC000819445492	GK	On-Demand	Anodyne	ADRB3	43	40
O=[S@@](Cc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1)C1CCCCC1	ZINC000819445492	GK	On-Demand	Anodyne	CYP3A4	47	36
O=C(CSc1nncn1-c1cccc(Cl)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445525	GD	On-Demand	Anodyne	CPT1A	49	36
O=C(CSc1nncn1-c1cccc(Cl)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445528	GD	On-Demand	Anodyne	CPT1A	49	36
O=C(CCCc1ccc(F)c(F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445537	DE	On-Demand	Anodyne	CPT1A	59	40
O=C(CCCc1ccc(F)c(F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445537	DE	On-Demand	Anodyne	PREP	64	44
O=C(CCCc1ccc(F)c(F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445539	DE	On-Demand	Anodyne	CPT1A	59	40
O=C(CCCc1ccc(F)c(F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445539	DE	On-Demand	Anodyne	PREP	64	44
O=C(CCCc1csc2ccccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445548	EG	On-Demand	Anodyne	CPT1A	76	37
O=C(CCCc1csc2ccccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445548	EG	On-Demand	Anodyne	PREP	43	38
O=C(CCCc1csc2ccccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445548	EG	On-Demand	Anodyne	FFAR2	52	34
O=C(CCCc1csc2ccccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445550	EG	On-Demand	Anodyne	CPT1A	76	37
O=C(CCCc1csc2ccccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445550	EG	On-Demand	Anodyne	PREP	43	38
O=C(CCCc1csc2ccccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445550	EG	On-Demand	Anodyne	FFAR2	52	34
Cc1ccc(OC[C@@H](O)CNc2ccc(CNC(=O)OC(C)C)cc2)c(C)c1	ZINC000819445557	GH	On-Demand	Anodyne	ADRB2	23	44
Cc1ccc(OC[C@@H](O)CNc2ccc(CNC(=O)OC(C)C)cc2)c(C)c1	ZINC000819445557	GH	On-Demand	Anodyne	PDS	58	39
O=C1CCCN1c1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819445558	FD	On-Demand	Anodyne	CPT1A	136	53
O=C1CCCN1c1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819445558	FD	On-Demand	Anodyne	CPT2	44	36
Cc1ccc(OC[C@H](O)CNc2ccc(CNC(=O)OC(C)C)cc2)c(C)c1	ZINC000819445559	GH	On-Demand	Anodyne	ADRB2	23	44
Cc1ccc(OC[C@H](O)CNc2ccc(CNC(=O)OC(C)C)cc2)c(C)c1	ZINC000819445559	GH	On-Demand	Anodyne	PDS	58	39
O=C1CCCN1c1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819445561	FD	On-Demand	Anodyne	CPT1A	136	53
O=C1CCCN1c1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819445561	FD	On-Demand	Anodyne	CPT2	44	36
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445562	HD	On-Demand	Anodyne	CPT1A	42	37
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445562	HD	On-Demand	Anodyne	NAMPT	35	41
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445565	HD	On-Demand	Anodyne	CPT1A	42	37
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445565	HD	On-Demand	Anodyne	NAMPT	35	41
Cc1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1S(=O)(=O)N1CCOCC1	ZINC000819445569	HC	On-Demand	Anodyne	CNR2	18	54
Cc1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1S(=O)(=O)N1CCOCC1	ZINC000819445571	HC	On-Demand	Anodyne	CNR2	18	54
O=C(Cn1nnc(-c2ccccc2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445573	EC	On-Demand	Anodyne	CPT1A	116	43
O=C(Cn1nnc(-c2ccccc2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445573	EC	On-Demand	Anodyne	SCARB1	32	41
O=C(Cn1nnc(-c2ccccc2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445574	EC	On-Demand	Anodyne	CPT1A	116	43
O=C(Cn1nnc(-c2ccccc2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445574	EC	On-Demand	Anodyne	SCARB1	32	41
O=C(C1CCN(c2ccc3cccc(O)c3n2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445589	GE	On-Demand	Anodyne	CPT1A	50	35
O=C(C1CCN(c2ccc3cccc(O)c3n2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445591	GE	On-Demand	Anodyne	CPT1A	50	35
NC(=O)c1cccc(OCCC(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819445592	EC	On-Demand	Anodyne	KCNH2	40	36
NC(=O)c1cccc(OCCC(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819445592	EC	On-Demand	Anodyne	CPT1A	129	50
NC(=O)c1cccc(OCCC(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819445595	EC	On-Demand	Anodyne	KCNH2	40	36
NC(=O)c1cccc(OCCC(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819445595	EC	On-Demand	Anodyne	CPT1A	129	50
COc1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1OC1CCCC1	ZINC000819445596	FF	On-Demand	Anodyne	PDE4A	50	47
COc1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1OC1CCCC1	ZINC000819445596	FF	On-Demand	Anodyne	PDE4B	30	52
COc1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1OC1CCCC1	ZINC000819445596	FF	On-Demand	Anodyne	PDE4D	39	47
COc1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1OC1CCCC1	ZINC000819445596	FF	On-Demand	Anodyne	CPT1A	69	38
COc1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1OC1CCCC1	ZINC000819445596	FF	On-Demand	Anodyne	PDE4C	17	47
COc1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1OC1CCCC1	ZINC000819445596	FF	On-Demand	Anodyne	SLC5A7	33	42
COc1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1OC1CCCC1	ZINC000819445598	FF	On-Demand	Anodyne	PDE4A	50	47
COc1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1OC1CCCC1	ZINC000819445598	FF	On-Demand	Anodyne	PDE4B	30	52
COc1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1OC1CCCC1	ZINC000819445598	FF	On-Demand	Anodyne	PDE4D	39	47
COc1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1OC1CCCC1	ZINC000819445598	FF	On-Demand	Anodyne	CPT1A	69	38
COc1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1OC1CCCC1	ZINC000819445598	FF	On-Demand	Anodyne	PDE4C	17	47
COc1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1OC1CCCC1	ZINC000819445598	FF	On-Demand	Anodyne	SLC5A7	33	42
Cc1c(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cnn1-c1ccccc1	ZINC000819445601	DD	On-Demand	Anodyne	CPT1A	80	39
O=C(CSc1ccc(O)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445613	DD	On-Demand	Anodyne	CPT1A	46	36
O=C(CSc1ccc(O)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445614	DD	On-Demand	Anodyne	CPT1A	46	36
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)c(OCCN(C)C)c1	ZINC000819445667	EH	On-Demand	Anodyne	ADRB1	27	42
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)c(OCCN(C)C)c1	ZINC000819445667	EH	On-Demand	Anodyne	ADRB3	41	43
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)c(OCCN(C)C)c1	ZINC000819445667	EH	On-Demand	Anodyne	CYP3A4	46	35
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)c(OCCN(C)C)c1	ZINC000819445668	EH	On-Demand	Anodyne	ADRB1	27	42
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)c(OCCN(C)C)c1	ZINC000819445668	EH	On-Demand	Anodyne	ADRB3	41	43
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)c(OCCN(C)C)c1	ZINC000819445668	EH	On-Demand	Anodyne	CYP3A4	46	35
Cc1ccc(OC[C@@H](O)CNc2ccc(OCC3CCOCC3)cc2)cc1	ZINC000819445669	FH	On-Demand	Anodyne	ADRB2	33	48
Cc1ccc(OC[C@@H](O)CNc2ccc(OCC3CCOCC3)cc2)cc1	ZINC000819445669	FH	On-Demand	Anodyne	ADRB1	52	49
Cc1ccc(OC[C@H](O)CNc2ccc(OCC3CCOCC3)cc2)cc1	ZINC000819445670	FH	On-Demand	Anodyne	ADRB2	33	48
Cc1ccc(OC[C@H](O)CNc2ccc(OCC3CCOCC3)cc2)cc1	ZINC000819445670	FH	On-Demand	Anodyne	ADRB1	52	49
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccccc1F	ZINC000819445691	GG	On-Demand	Anodyne	ADRB1	58	39
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccccc1F	ZINC000819445692	GG	On-Demand	Anodyne	ADRB1	58	39
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)Cc1ccccc1	ZINC000819445719	EH	On-Demand	Anodyne	LTA4H	17	41
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)Cc1ccccc1	ZINC000819445720	EH	On-Demand	Anodyne	LTA4H	17	41
O=C(/C=C\[C@@H]1CCCO1)NCCc1cccc(OCc2ccccc2)c1	ZINC000819445721	FH	On-Demand	Anodyne	FFAR1	22	40
O=C(/C=C\[C@@H]1CCCO1)NCCc1cccc(OCc2ccccc2)c1	ZINC000819445721	FH	On-Demand	Anodyne	CRTM	41	41
O=C(/C=C/[C@@H]1CCCO1)NCCc1cccc(OCc2ccccc2)c1	ZINC000819445722	FH	On-Demand	Anodyne	FFAR1	22	40
O=C(/C=C/[C@@H]1CCCO1)NCCc1cccc(OCc2ccccc2)c1	ZINC000819445722	FH	On-Demand	Anodyne	CRTM	41	41
O=C(/C=C/[C@H]1CCCO1)NCCc1cccc(OCc2ccccc2)c1	ZINC000819445723	FH	On-Demand	Anodyne	FFAR1	22	40
O=C(/C=C/[C@H]1CCCO1)NCCc1cccc(OCc2ccccc2)c1	ZINC000819445723	FH	On-Demand	Anodyne	CRTM	41	41
O=C(/C=C\[C@H]1CCCO1)NCCc1cccc(OCc2ccccc2)c1	ZINC000819445724	FH	On-Demand	Anodyne	FFAR1	22	40
O=C(/C=C\[C@H]1CCCO1)NCCc1cccc(OCc2ccccc2)c1	ZINC000819445724	FH	On-Demand	Anodyne	CRTM	41	41
OC1CCN(Cc2cccc(NC[C@H](O)c3ccccc3F)c2)CC1	ZINC000819445739	EF	On-Demand	Anodyne	SIGMAR1	33	42
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccccc3F)c2)CC1	ZINC000819445740	EF	On-Demand	Anodyne	SIGMAR1	33	42
O=C(CCNc1ccc(OCC2CCOCC2)cc1)Nc1cccnc1	ZINC000819445741	FG	On-Demand	Anodyne	CHRNA7	21	41
CCOC[C@H](O)CNc1ccc(OCC2CCOCC2)cc1	ZINC000819445747	DE	On-Demand	Anodyne	ADRB1	26	42
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819445757	FI	On-Demand	Anodyne	ADRB1	30	44
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819445757	FI	On-Demand	Anodyne	ADRB3	42	44
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819445757	FI	On-Demand	Anodyne	IGF1R	29	40
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819445757	FI	On-Demand	Anodyne	CYP3A4	51	38
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819445758	FI	On-Demand	Anodyne	ADRB1	30	44
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819445758	FI	On-Demand	Anodyne	ADRB3	42	44
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819445758	FI	On-Demand	Anodyne	IGF1R	29	40
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)c1cccc(Cl)c1	ZINC000819445758	FI	On-Demand	Anodyne	CYP3A4	51	38
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCC(CN(C)C)CC3)cc2)cc1	ZINC000819445761	GH	On-Demand	Anodyne	ADRB2	23	43
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCC(CN(C)C)CC3)cc2)cc1	ZINC000819445761	GH	On-Demand	Anodyne	ADRB1	34	44
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cc(C)ccc2Cl)cc1	ZINC000819445769	GH	On-Demand	Anodyne	ADRB2	15	40
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cc(C)ccc2Cl)cc1	ZINC000819445770	GH	On-Demand	Anodyne	ADRB2	15	40
COC(=O)N(C)Cc1ccc(NCCS(C)(=O)=O)cc1	ZINC000819445796	DD	On-Demand	Anodyne	PTPRB	61	40
COC(=O)N(C)Cc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819445809	GF	On-Demand	Anodyne	NOD1	18	43
COC(=O)N(C)Cc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819445809	GF	On-Demand	Anodyne	NOD2	49	43
COC(=O)N(C)Cc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819445810	GF	On-Demand	Anodyne	NOD1	18	43
COC(=O)N(C)Cc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819445810	GF	On-Demand	Anodyne	NOD2	49	43
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)C(=O)OCC(C)C)c1	ZINC000819445811	DD	On-Demand	Anodyne	MMP3	16	40
Cc1ccc(C[C@@H](C)C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819445865	CE	On-Demand	Anodyne	ACE	27	44
Cc1ccc(C[C@@H](C)C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819445865	CE	On-Demand	Anodyne	OPRM1	17	42
Cc1ccc(C[C@@H](C)C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819445865	CE	On-Demand	Anodyne	TRHR	49	36
Cc1ccc(C[C@@H](C)C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819445866	CE	On-Demand	Anodyne	ACE	27	44
Cc1ccc(C[C@@H](C)C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819445866	CE	On-Demand	Anodyne	OPRM1	17	42
Cc1ccc(C[C@@H](C)C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819445866	CE	On-Demand	Anodyne	TRHR	49	36
C[C@H](CCc1cccc(F)c1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445867	DE	On-Demand	Anodyne	ACE	48	43
C[C@H](CCc1cccc(F)c1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445867	DE	On-Demand	Anodyne	CCR3	43	33
C[C@H](CCc1cccc(F)c1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445867	DE	On-Demand	Anodyne	ACE2	19	43
C[C@H](CCc1cccc(F)c1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445867	DE	On-Demand	Anodyne	BIRC2	16	42
C[C@@H](CCc1cccc(F)c1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445868	DE	On-Demand	Anodyne	ACE	48	43
C[C@@H](CCc1cccc(F)c1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445868	DE	On-Demand	Anodyne	CCR3	43	33
C[C@@H](CCc1cccc(F)c1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445868	DE	On-Demand	Anodyne	ACE2	19	43
C[C@@H](CCc1cccc(F)c1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445868	DE	On-Demand	Anodyne	BIRC2	16	42
C[C@H](CCc1cccc(F)c1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445869	DE	On-Demand	Anodyne	ACE	48	43
C[C@H](CCc1cccc(F)c1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445869	DE	On-Demand	Anodyne	CCR3	43	33
C[C@H](CCc1cccc(F)c1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445869	DE	On-Demand	Anodyne	ACE2	19	43
C[C@H](CCc1cccc(F)c1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445869	DE	On-Demand	Anodyne	BIRC2	16	42
C[C@@H](CCc1cccc(F)c1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445870	DE	On-Demand	Anodyne	ACE	48	43
C[C@@H](CCc1cccc(F)c1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445870	DE	On-Demand	Anodyne	CCR3	43	33
C[C@@H](CCc1cccc(F)c1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445870	DE	On-Demand	Anodyne	ACE2	19	43
C[C@@H](CCc1cccc(F)c1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445870	DE	On-Demand	Anodyne	BIRC2	16	42
O=C(Cn1c(COc2ccc(Cl)cc2)nc2ccccc21)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445873	IG	On-Demand	Anodyne	NPY1R	35	49
O=C(Cn1c(COc2ccc(Cl)cc2)nc2ccccc21)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445873	IG	On-Demand	Anodyne	CPT1A	117	41
O=C(Cn1c(COc2ccc(Cl)cc2)nc2ccccc21)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445874	IG	On-Demand	Anodyne	NPY1R	35	49
O=C(Cn1c(COc2ccc(Cl)cc2)nc2ccccc21)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445874	IG	On-Demand	Anodyne	CPT1A	117	41
O=C(Nc1nc(CC(=O)N2CCC[C@H]2c2nn[nH]n2)cs1)c1cccs1	ZINC000819445889	GD	On-Demand	Anodyne	CPT1A	50	38
O=C(Nc1nc(CC(=O)N2CCC[C@@H]2c2nn[nH]n2)cs1)c1cccs1	ZINC000819445890	GD	On-Demand	Anodyne	CPT1A	50	38
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)s1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445891	HD	On-Demand	Anodyne	CPT1A	47	34
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)s1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445892	HD	On-Demand	Anodyne	CPT1A	47	34
O=C([C@@H]1CC(c2cccnc2)=NO1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445903	DC	On-Demand	Anodyne	CPT1A	58	41
O=C([C@H]1CC(c2cccnc2)=NO1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445904	DC	On-Demand	Anodyne	CPT1A	58	41
O=C([C@@H]1CC(c2cccnc2)=NO1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445905	DC	On-Demand	Anodyne	CPT1A	58	41
O=C([C@H]1CC(c2cccnc2)=NO1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445906	DC	On-Demand	Anodyne	CPT1A	58	41
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(CN(C)C)CC3)cc2)cc1	ZINC000819445910	GH	On-Demand	Anodyne	ADRB2	23	43
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(CN(C)C)CC3)cc2)cc1	ZINC000819445910	GH	On-Demand	Anodyne	ADRB1	34	44
CCOc1ccccc1OCC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445928	DD	On-Demand	Anodyne	PRCP	32	41
CCOc1ccccc1OCC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445928	DD	On-Demand	Anodyne	CPT1A	137	47
CCOc1ccccc1OCC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445928	DD	On-Demand	Anodyne	CPT2	45	39
CCOc1ccccc1OCC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445928	DD	On-Demand	Anodyne	HCN1	41	32
CCOc1ccccc1OCC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445928	DD	On-Demand	Anodyne	HCN4	42	32
CCOc1ccccc1OCC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445930	DD	On-Demand	Anodyne	PRCP	32	41
CCOc1ccccc1OCC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445930	DD	On-Demand	Anodyne	CPT1A	137	47
CCOc1ccccc1OCC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445930	DD	On-Demand	Anodyne	CPT2	45	39
CCOc1ccccc1OCC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445930	DD	On-Demand	Anodyne	HCN1	41	32
CCOc1ccccc1OCC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445930	DD	On-Demand	Anodyne	HCN4	42	32
NC(=O)c1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819445932	DC	On-Demand	Anodyne	PRCP	16	44
NC(=O)c1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819445932	DC	On-Demand	Anodyne	CPT1A	152	55
NC(=O)c1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819445932	DC	On-Demand	Anodyne	CPT2	47	38
NC(=O)c1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819445934	DC	On-Demand	Anodyne	PRCP	16	44
NC(=O)c1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819445934	DC	On-Demand	Anodyne	CPT1A	152	55
NC(=O)c1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819445934	DC	On-Demand	Anodyne	CPT2	47	38
Cc1c(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cnn1-c1ccccc1Cl	ZINC000819445938	FE	On-Demand	Anodyne	CPT1A	59	35
O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445956	FD	On-Demand	Anodyne	SLC6A1	89	39
O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445956	FD	On-Demand	Anodyne	CCR3	42	38
O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445956	FD	On-Demand	Anodyne	MLNR	34	40
O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445958	FD	On-Demand	Anodyne	SLC6A1	89	39
O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445958	FD	On-Demand	Anodyne	CCR3	42	38
O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819445958	FD	On-Demand	Anodyne	MLNR	34	40
O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445961	FD	On-Demand	Anodyne	SLC6A1	89	39
O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445961	FD	On-Demand	Anodyne	CCR3	42	38
O=C([C@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445961	FD	On-Demand	Anodyne	MLNR	34	40
O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445963	FD	On-Demand	Anodyne	SLC6A1	89	39
O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445963	FD	On-Demand	Anodyne	CCR3	42	38
O=C([C@@H]1CCCN(Cc2cccc(F)c2)C1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445963	FD	On-Demand	Anodyne	MLNR	34	40
N#CCc1ccc(OC[C@@H](O)CNc2ccc(OCC3CCOCC3)cc2)cc1	ZINC000819445968	GG	On-Demand	Mild	ADRB2	28	42
N#CCc1ccc(OC[C@@H](O)CNc2ccc(OCC3CCOCC3)cc2)cc1	ZINC000819445968	GG	On-Demand	Mild	ADRB1	55	45
N#CCc1ccc(OC[C@H](O)CNc2ccc(OCC3CCOCC3)cc2)cc1	ZINC000819445969	GG	On-Demand	Mild	ADRB2	28	42
N#CCc1ccc(OC[C@H](O)CNc2ccc(OCC3CCOCC3)cc2)cc1	ZINC000819445969	GG	On-Demand	Mild	ADRB1	55	45
OC1CCN(Cc2cccc(NC[C@H](O)C3CC3)c2)CC1	ZINC000819445973	CD	On-Demand	Anodyne	SIGMAR1	26	42
OC1CCN(Cc2cccc(NC[C@@H](O)C3CC3)c2)CC1	ZINC000819445976	CD	On-Demand	Anodyne	SIGMAR1	26	42
Cc1ccc(NC[C@@H](O)c2ccccc2)c(OCCN(C)C)c1	ZINC000819445977	DG	On-Demand	Anodyne	ESRRG	43	31
Cc1ccc(NC[C@H](O)c2ccccc2)c(OCCN(C)C)c1	ZINC000819445979	DG	On-Demand	Anodyne	ESRRG	43	31
Cc1nc2cc(F)ccc2cc1C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819445998	EE	On-Demand	Anodyne	CCR3	42	30
Cc1nc2cc(F)ccc2cc1C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446002	EE	On-Demand	Anodyne	CCR3	42	30
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)CN1CCc2ccccc2C1	ZINC000819446004	GG	On-Demand	Anodyne	NOD2	40	37
COc1ccccc1C[C@H](C)CC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446005	EE	On-Demand	Anodyne	TRHR	46	33
COc1ccccc1C[C@H](C)CC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446005	EE	On-Demand	Anodyne	CPT1A	86	39
COc1ccccc1C[C@H](C)CC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446006	EE	On-Demand	Anodyne	TRHR	46	33
COc1ccccc1C[C@H](C)CC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446006	EE	On-Demand	Anodyne	CPT1A	86	39
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)CN1CCc2ccccc2C1	ZINC000819446007	GG	On-Demand	Anodyne	NOD2	40	37
COc1ccccc1C[C@@H](C)CC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446008	EE	On-Demand	Anodyne	TRHR	46	33
COc1ccccc1C[C@@H](C)CC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446008	EE	On-Demand	Anodyne	CPT1A	86	39
COc1ccccc1C[C@@H](C)CC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446010	EE	On-Demand	Anodyne	TRHR	46	33
COc1ccccc1C[C@@H](C)CC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446010	EE	On-Demand	Anodyne	CPT1A	86	39
O=C(COc1ccccc1-c1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446012	EF	On-Demand	Anodyne	PTGIR	48	35
O=C(COc1ccccc1-c1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446012	EF	On-Demand	Anodyne	HCRTR1	20	42
O=C(COc1ccccc1-c1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446012	EF	On-Demand	Anodyne	PLA2G1B	58	38
O=C(COc1ccccc1-c1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446012	EF	On-Demand	Anodyne	PRCP	25	49
O=C(COc1ccccc1-c1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446012	EF	On-Demand	Anodyne	CPT1A	147	49
O=C(COc1ccccc1-c1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446012	EF	On-Demand	Anodyne	CPT2	45	38
O=C(COc1ccccc1-c1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446012	EF	On-Demand	Anodyne	PREP	45	34
O=C(COc1ccccc1-c1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446014	EF	On-Demand	Anodyne	PTGIR	48	35
O=C(COc1ccccc1-c1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446014	EF	On-Demand	Anodyne	HCRTR1	20	42
O=C(COc1ccccc1-c1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446014	EF	On-Demand	Anodyne	PLA2G1B	58	38
O=C(COc1ccccc1-c1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446014	EF	On-Demand	Anodyne	PRCP	25	49
O=C(COc1ccccc1-c1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446014	EF	On-Demand	Anodyne	CPT1A	147	49
O=C(COc1ccccc1-c1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446014	EF	On-Demand	Anodyne	CPT2	45	38
O=C(COc1ccccc1-c1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446014	EF	On-Demand	Anodyne	PREP	45	34
O=C(NCCC(=O)N1CCC[C@@H]1c1nn[nH]n1)NC12CC3CC(CC(C3)C1)C2	ZINC000819446016	GD	On-Demand	Anodyne	EPHX2	88	43
OC1CCN(Cc2cccc(NC[C@H](O)c3ccc(C(F)(F)F)cc3)c2)CC1	ZINC000819446017	GH	On-Demand	Anodyne	SIGMAR1	15	55
OC1CCN(Cc2cccc(NC[C@H](O)c3ccc(C(F)(F)F)cc3)c2)CC1	ZINC000819446017	GH	On-Demand	Anodyne	MCHR1	27	41
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccc(C(F)(F)F)cc3)c2)CC1	ZINC000819446018	GH	On-Demand	Anodyne	SIGMAR1	15	55
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccc(C(F)(F)F)cc3)c2)CC1	ZINC000819446018	GH	On-Demand	Anodyne	MCHR1	27	41
O=C(NCCC(=O)N1CCC[C@H]1c1nn[nH]n1)NC12CC3CC(CC(C3)C1)C2	ZINC000819446019	GD	On-Demand	Anodyne	EPHX2	88	43
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccccc1Cl	ZINC000819446027	GH	On-Demand	Anodyne	ADRB1	58	38
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)COc1ccccc1Cl	ZINC000819446028	GH	On-Demand	Anodyne	ADRB1	58	38
OC1CCN(Cc2cccc(NC[C@H](O)c3cccc4ccccc34)c2)CC1	ZINC000819446031	GH	On-Demand	Anodyne	DRD4	27	44
OC1CCN(Cc2cccc(NC[C@H](O)c3cccc4ccccc34)c2)CC1	ZINC000819446031	GH	On-Demand	Anodyne	SIGMAR1	31	45
Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(OCCN(C)C)c1	ZINC000819446035	FF	On-Demand	Bother	CACNA1C	40	35
Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(OCCN(C)C)c1	ZINC000819446035	FF	On-Demand	Bother	CACNA1D	58	34
Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c(OCCN(C)C)c1	ZINC000819446036	FF	On-Demand	Bother	CACNA1C	40	35
Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c(OCCN(C)C)c1	ZINC000819446036	FF	On-Demand	Bother	CACNA1D	58	34
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)CC(F)(F)F	ZINC000819446051	EG	On-Demand	Anodyne	CTSS	16	40
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)CC(F)(F)F	ZINC000819446052	EG	On-Demand	Anodyne	CTSS	16	40
O=[N+]([O-])c1ccc([C@@H](O)CNc2cccc(CN3CCC(O)CC3)c2)cc1	ZINC000819446057	FF	On-Demand	Bother	SIGMAR1	18	44
O=[N+]([O-])c1ccc([C@H](O)CNc2cccc(CN3CCC(O)CC3)c2)cc1	ZINC000819446058	FF	On-Demand	Bother	SIGMAR1	18	44
COC(=O)N(C)Cc1ccc(NC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819446066	GH	On-Demand	Anodyne	ADRB1	15	42
COC(=O)N(C)Cc1ccc(NC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819446067	GH	On-Demand	Anodyne	ADRB1	15	42
C#CCNC(=O)CCNc1ccc(OCc2ccccc2)cc1C	ZINC000819446085	DG	On-Demand	Mild	MAOB	32	41
C#CCNC(=O)CCNc1ccc(OCc2ccccc2)cc1C	ZINC000819446085	DG	On-Demand	Mild	FFAR1	59	40
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819446126	GG	On-Demand	Anodyne	ADRB2	34	41
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819446126	GG	On-Demand	Anodyne	ADRB1	61	41
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819446126	GG	On-Demand	Anodyne	ADRB3	40	40
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819446127	GG	On-Demand	Anodyne	ADRB2	34	41
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819446127	GG	On-Demand	Anodyne	ADRB1	61	41
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819446127	GG	On-Demand	Anodyne	ADRB3	40	40
COC(=O)N(C)Cc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819446128	GH	On-Demand	Anodyne	GCGR	23	42
COC(=O)N(C)Cc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819446128	GH	On-Demand	Anodyne	GIPR	29	42
COC(=O)N(C)Cc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819446129	GH	On-Demand	Anodyne	GCGR	23	42
COC(=O)N(C)Cc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819446129	GH	On-Demand	Anodyne	GIPR	29	42
COC(=O)N(C)Cc1ccc(NC[C@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819446145	EH	On-Demand	Anodyne	PTPRB	48	35
COC(=O)N(C)Cc1ccc(NC[C@@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819446146	EH	On-Demand	Anodyne	PTPRB	48	35
COC(=O)N(C)Cc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819446160	FH	On-Demand	Anodyne	ADRB1	17	41
COC(=O)N(C)Cc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819446160	FH	On-Demand	Anodyne	PDS	28	41
COC(=O)N(C)Cc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819446161	FH	On-Demand	Anodyne	ADRB1	17	41
COC(=O)N(C)Cc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819446161	FH	On-Demand	Anodyne	PDS	28	41
OC1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)c(F)c3)c2)CC1	ZINC000819446173	FG	On-Demand	Anodyne	SIGMAR1	18	44
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccc(F)c(F)c3)c2)CC1	ZINC000819446175	FG	On-Demand	Anodyne	SIGMAR1	18	44
C/C(=C/C(=O)N1CCC[C@@H]1c1nn[nH]n1)c1cccc(C(F)(F)F)c1	ZINC000819446178	FF	On-Demand	Anodyne	CPT1A	29	41
C/C(=C/C(=O)N1CCC[C@@H]1c1nn[nH]n1)c1cccc(C(F)(F)F)c1	ZINC000819446178	FF	On-Demand	Anodyne	CCR2	51	36
C/C(=C/C(=O)N1CCC[C@H]1c1nn[nH]n1)c1cccc(C(F)(F)F)c1	ZINC000819446183	FF	On-Demand	Anodyne	CPT1A	29	41
C/C(=C/C(=O)N1CCC[C@H]1c1nn[nH]n1)c1cccc(C(F)(F)F)c1	ZINC000819446183	FF	On-Demand	Anodyne	CCR2	51	36
OC1CCN(Cc2cccc(NC[C@H](O)c3ccc(Cl)c(F)c3)c2)CC1	ZINC000819446189	GH	On-Demand	Anodyne	SIGMAR1	22	41
OC1CCN(Cc2cccc(NC[C@@H](O)c3ccc(Cl)c(F)c3)c2)CC1	ZINC000819446192	GH	On-Demand	Anodyne	SIGMAR1	22	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(CN2CCC(O)CC2)c1	ZINC000819446195	GE	On-Demand	Anodyne	ACHE	36	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(CN2CCC(O)CC2)c1	ZINC000819446195	GE	On-Demand	Anodyne	HRH2	37	44
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(CN2CCC(O)CC2)c1	ZINC000819446195	GE	On-Demand	Anodyne	SSTR5	46	34
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(CN2CCC(O)CC2)c1	ZINC000819446195	GE	On-Demand	Anodyne	CACNA1G	35	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(CN2CCC(O)CC2)c1	ZINC000819446196	GE	On-Demand	Anodyne	ACHE	36	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(CN2CCC(O)CC2)c1	ZINC000819446196	GE	On-Demand	Anodyne	HRH2	37	44
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(CN2CCC(O)CC2)c1	ZINC000819446196	GE	On-Demand	Anodyne	SSTR5	46	34
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(CN2CCC(O)CC2)c1	ZINC000819446196	GE	On-Demand	Anodyne	CACNA1G	35	40
Cc1c(C(=O)N2CCC[C@@H]2c2nn[nH]n2)nnn1-c1ccc(-c2ccccc2)cc1	ZINC000819446199	HF	On-Demand	Anodyne	CPT1A	68	37
C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446216	GF	On-Demand	Anodyne	CCR3	40	32
C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446217	GF	On-Demand	Anodyne	CCR3	40	32
O=C(CCNc1ccc(OCC2CCOCC2)cc1)Nc1cccc(F)c1	ZINC000819446230	FI	On-Demand	Anodyne	EPHX2	19	40
CON(C)C(=O)CCNc1ccc(Oc2cccc(S(C)(=O)=O)c2)cc1	ZINC000819446231	GF	On-Demand	Anodyne	NR1H3	48	36
OC1CCN(Cc2cccc(NC[C@H](O)c3ccc(Cl)cc3)c2)CC1	ZINC000819446232	FG	On-Demand	Anodyne	SIGMAR1	29	42
OC1CCN(Cc2cccc(NC[C@H](O)c3ccc(Cl)cc3)c2)CC1	ZINC000819446232	FG	On-Demand	Anodyne	MCHR1	26	42
O=C(c1ccc(N2CCCC2)nc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446235	DD	On-Demand	Anodyne	CPT1A	46	34
O=C(c1ccc(N2CCCC2)nc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446237	DD	On-Demand	Anodyne	CPT1A	46	34
O=C(c1cc(-c2ccco2)on1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446239	DD	On-Demand	Anodyne	CPT1A	51	35
O=C(c1cc(-c2ccco2)on1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446241	DD	On-Demand	Anodyne	CPT1A	51	35
O=C([C@H]1CC(c2ccc(Cl)cc2Cl)=NO1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446247	GE	On-Demand	Anodyne	ALPL	42	36
O=C([C@@H]1CC(c2ccc(Cl)cc2Cl)=NO1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446250	GE	On-Demand	Anodyne	ALPL	42	36
Cc1ccc(OC[C@@H](O)CNc2ccc(OCC3CCOCC3)cc2)c(C)c1	ZINC000819446251	GH	On-Demand	Anodyne	ADRB2	16	40
Cc1ccc(OC[C@@H](O)CNc2ccc(OCC3CCOCC3)cc2)c(C)c1	ZINC000819446251	GH	On-Demand	Anodyne	ADRB1	29	41
O=C([C@H]1CC(c2ccc(Cl)cc2Cl)=NO1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446252	GE	On-Demand	Anodyne	ALPL	42	36
Cc1ccc(OC[C@H](O)CNc2ccc(OCC3CCOCC3)cc2)c(C)c1	ZINC000819446253	GH	On-Demand	Anodyne	ADRB2	16	40
Cc1ccc(OC[C@H](O)CNc2ccc(OCC3CCOCC3)cc2)c(C)c1	ZINC000819446253	GH	On-Demand	Anodyne	ADRB1	29	41
O=C([C@@H]1CC(c2ccc(Cl)cc2Cl)=NO1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446254	GE	On-Demand	Anodyne	ALPL	42	36
O=C(C/N=C1/NS(=O)(=O)c2ccccc21)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446256	FB	On-Demand	Mild	CPT1A	48	35
O=C(C/N=C1/NS(=O)(=O)c2ccccc21)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446261	FB	On-Demand	Mild	CPT1A	48	35
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc(CN2CCC(O)CC2)c1	ZINC000819446262	GE	On-Demand	Anodyne	ACHE	29	41
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc(CN2CCC(O)CC2)c1	ZINC000819446262	GE	On-Demand	Anodyne	HRH2	33	45
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc(CN2CCC(O)CC2)c1	ZINC000819446264	GE	On-Demand	Anodyne	ACHE	29	41
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc(CN2CCC(O)CC2)c1	ZINC000819446264	GE	On-Demand	Anodyne	HRH2	33	45
Cc1ccc(NC[C@H](O)c2cccnc2)c(OCCN(C)C)c1	ZINC000819446267	DE	On-Demand	Anodyne	ADRB1	15	41
Cc1ccc(NC[C@H](O)c2cccnc2)c(OCCN(C)C)c1	ZINC000819446267	DE	On-Demand	Anodyne	ADRB3	40	44
O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446268	FC	On-Demand	Anodyne	CPT1A	70	41
O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446268	FC	On-Demand	Anodyne	SCARB1	32	43
Cc1ccc(NC[C@@H](O)c2cccnc2)c(OCCN(C)C)c1	ZINC000819446269	DE	On-Demand	Anodyne	ADRB1	15	41
Cc1ccc(NC[C@@H](O)c2cccnc2)c(OCCN(C)C)c1	ZINC000819446269	DE	On-Demand	Anodyne	ADRB3	40	44
O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446272	FC	On-Demand	Anodyne	CPT1A	70	41
O=C(Cn1nnc(-c2ccc(Cl)cc2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446272	FC	On-Demand	Anodyne	SCARB1	32	43
O=C(Cn1c(C2CCCCC2)nc2ccccc21)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446283	GF	On-Demand	Anodyne	CPT1A	93	41
O=C(Cn1c(C2CCCCC2)nc2ccccc21)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446287	GF	On-Demand	Anodyne	CPT1A	93	41
O=C(c1cccc(CN2CCCC2)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446291	ED	On-Demand	Anodyne	CPT1A	58	35
O=C(c1cccc(CN2CCCC2)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446291	ED	On-Demand	Anodyne	PREP	32	41
O=C(c1cccc(CN2CCCC2)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446291	ED	On-Demand	Anodyne	PARP1	16	40
O=C(c1cccc(CN2CCCC2)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446294	ED	On-Demand	Anodyne	CPT1A	58	35
O=C(c1cccc(CN2CCCC2)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446294	ED	On-Demand	Anodyne	PREP	32	41
O=C(c1cccc(CN2CCCC2)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446294	ED	On-Demand	Anodyne	PARP1	16	40
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446296	GC	On-Demand	Anodyne	CPT1A	45	35
O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446297	GC	On-Demand	Anodyne	CPT1A	45	35
O=C(CCOc1ccccc1Br)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446299	FE	On-Demand	Anodyne	CPT1A	111	42
O=C(CCOc1ccccc1Br)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446300	FE	On-Demand	Anodyne	CPT1A	111	42
O=C(c1ccc2nc(O)[nH]c2c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446301	CC	On-Demand	Anodyne	CPT1A	50	35
O=C(c1ccc2nc(O)[nH]c2c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446303	CC	On-Demand	Anodyne	CPT1A	50	35
CC(C)c1ccc([C@@H](C)CC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819446307	EG	On-Demand	Anodyne	CPT1A	49	35
CC(C)c1ccc([C@H](C)CC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819446309	EG	On-Demand	Anodyne	CPT1A	49	35
CC(C)c1ccc([C@H](C)CC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819446310	EG	On-Demand	Anodyne	CPT1A	49	35
CC(C)c1ccc([C@@H](C)CC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819446311	EG	On-Demand	Anodyne	CPT1A	49	35
CON(C)C(=O)CCNc1ccc(-n2ccnc2)cc1	ZINC000819446312	CD	On-Demand	Anodyne	CYP2C19	19	40
CON(C)C(=O)CCNc1ccc(-n2ccnc2)cc1	ZINC000819446312	CD	On-Demand	Anodyne	CYP26A1	81	37
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccnc2)cc1)C1CC1	ZINC000819446321	EF	On-Demand	Anodyne	ADRB2	26	43
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccnc2)cc1)C1CC1	ZINC000819446321	EF	On-Demand	Anodyne	ADRB1	26	44
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccnc2)cc1)C1CC1	ZINC000819446321	EF	On-Demand	Anodyne	ADRB3	100	50
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccnc2)cc1)C1CC1	ZINC000819446322	EF	On-Demand	Anodyne	ADRB2	26	43
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccnc2)cc1)C1CC1	ZINC000819446322	EF	On-Demand	Anodyne	ADRB1	26	44
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccnc2)cc1)C1CC1	ZINC000819446322	EF	On-Demand	Anodyne	ADRB3	100	50
Cc1cc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc(C)c1Cl	ZINC000819446329	EE	On-Demand	Anodyne	PRCP	25	42
Cc1cc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc(C)c1Cl	ZINC000819446329	EE	On-Demand	Anodyne	CPT1A	137	44
Cc1cc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc(C)c1Cl	ZINC000819446329	EE	On-Demand	Anodyne	CPT2	45	36
Cc1cc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc(C)c1Cl	ZINC000819446330	EE	On-Demand	Anodyne	PRCP	25	42
Cc1cc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc(C)c1Cl	ZINC000819446330	EE	On-Demand	Anodyne	CPT1A	137	44
Cc1cc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc(C)c1Cl	ZINC000819446330	EE	On-Demand	Anodyne	CPT2	45	36
O=C(c1cnc(-c2ccccn2)s1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446363	ED	On-Demand	Anodyne	CPT1A	56	42
O=C(c1cnc(-c2ccccn2)s1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446365	ED	On-Demand	Anodyne	CPT1A	56	42
CCCOc1cccc(CC(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819446366	DD	On-Demand	Anodyne	BRS3	25	41
CCCOc1cccc(CC(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819446366	DD	On-Demand	Anodyne	CPT1A	122	42
CCCOc1cccc(CC(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819446366	DD	On-Demand	Anodyne	PLA2G4B	31	42
CCCOc1cccc(CC(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819446367	DD	On-Demand	Anodyne	BRS3	25	41
CCCOc1cccc(CC(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819446367	DD	On-Demand	Anodyne	CPT1A	122	42
CCCOc1cccc(CC(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819446367	DD	On-Demand	Anodyne	PLA2G4B	31	42
O=C(c1ccc(-c2nc[nH]n2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446369	DC	On-Demand	Anodyne	CPT1A	72	36
O=C(c1ccc(-c2nc[nH]n2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446370	DC	On-Demand	Anodyne	CPT1A	72	36
O=C(Cn1c(O)nc2ccccc21)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819446371	DC	On-Demand	Anodyne	CPT1A	94	38
O=C(Cn1c(O)nc2ccccc21)N1CCC[C@H]1c1nn[nH]n1	ZINC000819446372	DC	On-Demand	Anodyne	CPT1A	94	38
CC(C)c1ccc(OCCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819446374	EE	On-Demand	Anodyne	CPT1A	111	41
CC(C)c1ccc(OCCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819446375	EE	On-Demand	Anodyne	CPT1A	111	41
COC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819446381	GE	On-Demand	Bother	ADRB2	33	43
COC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819446381	GE	On-Demand	Bother	ADRB1	62	38
COC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819446381	GE	On-Demand	Bother	ADRB3	26	41
COC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819446381	GE	On-Demand	Bother	PDS	54	39
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819446382	GE	On-Demand	Bother	ADRB2	33	43
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819446382	GE	On-Demand	Bother	ADRB1	62	38
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819446382	GE	On-Demand	Bother	ADRB3	26	41
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819446382	GE	On-Demand	Bother	PDS	54	39
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819446393	FF	On-Demand	Mild	ADRB2	36	41
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819446393	FF	On-Demand	Mild	ADRB1	65	41
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819446393	FF	On-Demand	Mild	ADRB3	39	40
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819446394	FF	On-Demand	Mild	ADRB2	36	41
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819446394	FF	On-Demand	Mild	ADRB1	65	41
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819446394	FF	On-Demand	Mild	ADRB3	39	40
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cc(C)cc(C)c2)cc1)C1CC1	ZINC000819446423	FH	On-Demand	Anodyne	GIPR	34	40
CC(=O)N(Cc1ccc(NC[C@H](O)c2cc(C)cc(C)c2)cc1)C1CC1	ZINC000819446424	FH	On-Demand	Anodyne	GIPR	34	40
COC(=O)NCc1ccc(NC[C@H](O)COc2c(C)ccc(C)c2C)cc1	ZINC000819446443	FG	On-Demand	Anodyne	ADRB1	42	36
COC(=O)NCc1ccc(NC[C@H](O)COc2c(C)ccc(C)c2C)cc1	ZINC000819446443	FG	On-Demand	Anodyne	PDS	44	33
COC(=O)NCc1ccc(NC[C@@H](O)COc2c(C)ccc(C)c2C)cc1	ZINC000819446446	FG	On-Demand	Anodyne	ADRB1	42	36
COC(=O)NCc1ccc(NC[C@@H](O)COc2c(C)ccc(C)c2C)cc1	ZINC000819446446	FG	On-Demand	Anodyne	PDS	44	33
CCn1c(NC(=O)/C=C/[C@@H]2CCCO2)nc2cc(C#N)ccc21	ZINC000819446449	DF	On-Demand	Mild	ITK	51	49
CCn1c(NC(=O)/C=C\[C@H]2CCCO2)nc2cc(C#N)ccc21	ZINC000819446452	DF	On-Demand	Mild	ITK	51	49
CCn1c(NC(=O)/C=C/[C@H]2CCCO2)nc2cc(C#N)ccc21	ZINC000819446456	DF	On-Demand	Mild	ITK	51	49
CCn1c(NC(=O)/C=C\[C@@H]2CCCO2)nc2cc(C#N)ccc21	ZINC000819446459	DF	On-Demand	Mild	ITK	51	49
CN(CC(C)(C)S(C)(=O)=O)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819446475	GD	On-Demand	Mild	PAPA1_CARPA	37	44
CN(CC(C)(C)S(C)(=O)=O)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819446476	GD	On-Demand	Mild	PAPA1_CARPA	37	44
Cc1c(F)cccc1NC(=O)CCNc1ccc(CNC(=O)OC(C)C)cc1	ZINC000819446479	GI	On-Demand	Anodyne	PDS	54	34
COC(=O)N(C)Cc1ccc(NCCS(=O)(=O)c2ccc(F)cc2)cc1	ZINC000819446486	GF	On-Demand	Anodyne	PTPRB	46	35
COC(=O)N(C)Cc1ccc(NCCS(=O)(=O)c2ccc(F)cc2)cc1	ZINC000819446486	GF	On-Demand	Anodyne	LIMK2	25	47
COC(=O)N(C)Cc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819446497	DE	On-Demand	Anodyne	ADRB2	29	44
COC(=O)N(C)Cc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819446497	DE	On-Demand	Anodyne	ADRB1	28	44
COC(=O)N(C)Cc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819446497	DE	On-Demand	Anodyne	ADRB3	101	50
COC(=O)N(C)Cc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819446498	DE	On-Demand	Anodyne	ADRB2	29	44
COC(=O)N(C)Cc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819446498	DE	On-Demand	Anodyne	ADRB1	28	44
COC(=O)N(C)Cc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819446498	DE	On-Demand	Anodyne	ADRB3	101	50
COc1ccc2[nH]nc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2c1	ZINC000819446499	GG	On-Demand	Mild	PAPA1_CARPA	37	41
COc1ccc2[nH]nc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2c1	ZINC000819446500	GG	On-Demand	Mild	PAPA1_CARPA	37	41
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819446505	GG	On-Demand	Anodyne	ADRB2	20	55
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819446505	GG	On-Demand	Anodyne	ADRB1	30	55
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819446505	GG	On-Demand	Anodyne	ADRB3	17	55
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819446506	GG	On-Demand	Anodyne	ADRB2	20	55
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819446506	GG	On-Demand	Anodyne	ADRB1	30	55
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819446506	GG	On-Demand	Anodyne	ADRB3	17	55
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC(=O)N(Cc2ccccc2)C1	ZINC000819446528	FD	On-Demand	Anodyne	FPR1	41	34
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)NCCc3ccc[nH]3)nn2)C1	ZINC000819446534	GE	On-Demand	Anodyne	SSTR2	41	32
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)NCCc3ccc[nH]3)nn2)C1	ZINC000819446535	GE	On-Demand	Anodyne	SSTR2	41	32
C[C@@H](C1CCN(C)CC1)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819446548	GF	On-Demand	Mild	PAPA1_CARPA	32	43
C[C@@H](C1CCN(C)CC1)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819446550	GF	On-Demand	Mild	PAPA1_CARPA	32	43
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cc(C)ccc2C)cc1	ZINC000819446572	FG	On-Demand	Anodyne	ADRB2	26	41
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cc(C)ccc2C)cc1	ZINC000819446573	FG	On-Demand	Anodyne	ADRB2	26	41
COC(=O)NCc1ccc(NC[C@H](O)COc2cc(C)ccc2Cl)cc1	ZINC000819446599	GG	On-Demand	Anodyne	ADRB2	29	43
COC(=O)NCc1ccc(NC[C@H](O)COc2cc(C)ccc2Cl)cc1	ZINC000819446599	GG	On-Demand	Anodyne	PDS	57	42
COC(=O)NCc1ccc(NC[C@@H](O)COc2cc(C)ccc2Cl)cc1	ZINC000819446601	GG	On-Demand	Anodyne	ADRB2	29	43
COC(=O)NCc1ccc(NC[C@@H](O)COc2cc(C)ccc2Cl)cc1	ZINC000819446601	GG	On-Demand	Anodyne	PDS	57	42
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446610	FG	On-Demand	Anodyne	ADRB2	51	45
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446610	FG	On-Demand	Anodyne	ADRB1	82	48
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446610	FG	On-Demand	Anodyne	GRIN1	31	51
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446610	FG	On-Demand	Anodyne	ADRB3	54	45
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446610	FG	On-Demand	Anodyne	PDS	77	47
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446612	FG	On-Demand	Anodyne	ADRB2	51	45
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446612	FG	On-Demand	Anodyne	ADRB1	82	48
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446612	FG	On-Demand	Anodyne	GRIN1	31	51
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446612	FG	On-Demand	Anodyne	ADRB3	54	45
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446612	FG	On-Demand	Anodyne	PDS	77	47
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819446616	GE	On-Demand	Anodyne	ADRB2	50	59
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819446616	GE	On-Demand	Anodyne	ADRB1	83	59
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819446616	GE	On-Demand	Anodyne	GRIN1	29	42
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819446616	GE	On-Demand	Anodyne	ADRB3	54	56
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819446616	GE	On-Demand	Anodyne	PDS	62	43
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819446618	GE	On-Demand	Anodyne	ADRB2	50	59
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819446618	GE	On-Demand	Anodyne	ADRB1	83	59
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819446618	GE	On-Demand	Anodyne	GRIN1	29	42
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819446618	GE	On-Demand	Anodyne	ADRB3	54	56
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819446618	GE	On-Demand	Anodyne	PDS	62	43
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(C)cc2C)cc1	ZINC000819446634	FG	On-Demand	Anodyne	ADRB2	19	41
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(C)cc2C)cc1	ZINC000819446636	FG	On-Demand	Anodyne	ADRB2	19	41
COC(=O)NCc1ccc(NC[C@H](O)COCc2ccccc2F)cc1	ZINC000819446637	FF	On-Demand	Anodyne	PDS	51	34
COC(=O)NCc1ccc(NC[C@@H](O)COCc2ccccc2F)cc1	ZINC000819446639	FF	On-Demand	Anodyne	PDS	51	34
CC(=O)Nc1cccc(CC(=O)N2CC=C(C#N)CC2)c1	ZINC000819446651	CD	On-Demand	Reactive	P2RY14	44	37
CC(=O)Nc1cccc(CC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	ZINC000819446655	GD	On-Demand	Reactive	NQO2	19	42
CC(=O)Nc1cccc(CC(=O)NNC(=O)CCCNC(=O)OC(C)(C)C)c1	ZINC000819446655	GD	On-Demand	Reactive	HDAC10	15	44
COC(=O)N(C)Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819446678	FF	On-Demand	Bother	ADRB1	15	40
COC(=O)N(C)Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819446678	FF	On-Demand	Bother	CACNA1C	44	35
COC(=O)N(C)Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819446678	FF	On-Demand	Bother	CACNA1D	67	35
COC(=O)N(C)Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819446679	FF	On-Demand	Bother	ADRB1	15	40
COC(=O)N(C)Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819446679	FF	On-Demand	Bother	CACNA1C	44	35
COC(=O)N(C)Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819446679	FF	On-Demand	Bother	CACNA1D	67	35
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819446680	FF	On-Demand	Anodyne	ADRB2	26	58
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819446680	FF	On-Demand	Anodyne	ADRB1	58	58
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819446680	FF	On-Demand	Anodyne	ADRB3	24	58
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819446680	FF	On-Demand	Anodyne	CYP2D6	17	43
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819446680	FF	On-Demand	Anodyne	PDS	51	36
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819446681	FF	On-Demand	Anodyne	ADRB2	26	58
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819446681	FF	On-Demand	Anodyne	ADRB1	58	58
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819446681	FF	On-Demand	Anodyne	ADRB3	24	58
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819446681	FF	On-Demand	Anodyne	CYP2D6	17	43
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819446681	FF	On-Demand	Anodyne	PDS	51	36
COC(=O)NCc1ccc(NC[C@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819446682	GH	On-Demand	Anodyne	ADRB1	40	38
COC(=O)NCc1ccc(NC[C@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819446682	GH	On-Demand	Anodyne	GRIN1	25	41
COC(=O)NCc1ccc(NC[C@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819446682	GH	On-Demand	Anodyne	PDS	72	45
COC(=O)NCc1ccc(NC[C@@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819446683	GH	On-Demand	Anodyne	ADRB1	40	38
COC(=O)NCc1ccc(NC[C@@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819446683	GH	On-Demand	Anodyne	GRIN1	25	41
COC(=O)NCc1ccc(NC[C@@H](O)COc2cc(Cl)ccc2Cl)cc1	ZINC000819446683	GH	On-Demand	Anodyne	PDS	72	45
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819446684	GI	On-Demand	Anodyne	ADRB1	15	40
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819446684	GI	On-Demand	Anodyne	GCGR	20	45
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819446684	GI	On-Demand	Anodyne	GIPR	51	45
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819446685	GI	On-Demand	Anodyne	ADRB1	15	40
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819446685	GI	On-Demand	Anodyne	GCGR	20	45
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1)C1CC1	ZINC000819446685	GI	On-Demand	Anodyne	GIPR	51	45
COC(=O)NCc1ccc(NCCC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819446686	GI	On-Demand	Anodyne	RAF1	23	42
COC(=O)NCc1ccc(NCCC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819446686	GI	On-Demand	Anodyne	FLT1	18	44
COC(=O)NCc1ccc(NCCC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819446686	GI	On-Demand	Anodyne	KDR	20	44
COC(=O)NCc1ccc(NCCC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819446686	GI	On-Demand	Anodyne	CCR2	43	38
COC(=O)NCc1ccc(NCCC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819446686	GI	On-Demand	Anodyne	TEK	33	40
COC(=O)NCc1ccc(NCCC(=O)Nc2cccc(C(F)(F)F)c2)cc1	ZINC000819446686	GI	On-Demand	Anodyne	PDS	59	44
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)c1cccnc1	ZINC000819446687	EG	On-Demand	Anodyne	ADRB2	17	43
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)c1cccnc1	ZINC000819446687	EG	On-Demand	Anodyne	ADRB1	22	43
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)c1cccnc1	ZINC000819446687	EG	On-Demand	Anodyne	ADRB3	70	45
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)c1cccnc1	ZINC000819446688	EG	On-Demand	Anodyne	ADRB2	17	43
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)c1cccnc1	ZINC000819446688	EG	On-Demand	Anodyne	ADRB1	22	43
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)c1cccnc1	ZINC000819446688	EG	On-Demand	Anodyne	ADRB3	70	45
CC(C)(C)OC(=O)N[C@@H](CNC(=O)Cc1ccc(-n2cnnc2)cc1)C1CC1	ZINC000819446695	GE	On-Demand	Anodyne	PANC	49	35
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1)C1CC1	ZINC000819446703	FG	On-Demand	Bother	CACNA1D	44	32
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1)C1CC1	ZINC000819446704	FG	On-Demand	Bother	CACNA1D	44	32
O[C@H](CNc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)c1cccnc1	ZINC000819446716	GI	On-Demand	Anodyne	ADRB2	19	40
O[C@H](CNc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)c1cccnc1	ZINC000819446716	GI	On-Demand	Anodyne	ADRB1	21	43
O[C@H](CNc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)c1cccnc1	ZINC000819446716	GI	On-Demand	Anodyne	ADRB3	77	43
O[C@@H](CNc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)c1cccnc1	ZINC000819446717	GI	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)c1cccnc1	ZINC000819446717	GI	On-Demand	Anodyne	ADRB1	21	43
O[C@@H](CNc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1)c1cccnc1	ZINC000819446717	GI	On-Demand	Anodyne	ADRB3	77	43
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446718	GF	On-Demand	Bother	ADRB2	30	47
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446718	GF	On-Demand	Bother	ADRB1	42	48
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446718	GF	On-Demand	Bother	ADRB3	33	48
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446718	GF	On-Demand	Bother	CACNA1D	50	33
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446718	GF	On-Demand	Bother	PDS	40	46
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446719	GF	On-Demand	Bother	ADRB2	30	47
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446719	GF	On-Demand	Bother	ADRB1	42	48
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446719	GF	On-Demand	Bother	ADRB3	33	48
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446719	GF	On-Demand	Bother	CACNA1D	50	33
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446719	GF	On-Demand	Bother	PDS	40	46
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446730	GG	On-Demand	Anodyne	ADRB2	42	43
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446730	GG	On-Demand	Anodyne	ADRB1	70	46
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446730	GG	On-Demand	Anodyne	GRIN1	30	48
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446730	GG	On-Demand	Anodyne	ADRB3	47	43
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446730	GG	On-Demand	Anodyne	CDK4	17	41
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446731	GG	On-Demand	Anodyne	ADRB2	42	43
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446731	GG	On-Demand	Anodyne	ADRB1	70	46
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446731	GG	On-Demand	Anodyne	GRIN1	30	48
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446731	GG	On-Demand	Anodyne	ADRB3	47	43
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819446731	GG	On-Demand	Anodyne	CDK4	17	41
COC(=O)NCc1ccc(NC[C@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819446741	FF	On-Demand	Anodyne	ADRB2	19	55
COC(=O)NCc1ccc(NC[C@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819446741	FF	On-Demand	Anodyne	MTNR1A	34	43
COC(=O)NCc1ccc(NC[C@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819446741	FF	On-Demand	Anodyne	DRTS_TRYCR	44	31
COC(=O)NCc1ccc(NC[C@@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819446742	FF	On-Demand	Anodyne	ADRB2	19	55
COC(=O)NCc1ccc(NC[C@@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819446742	FF	On-Demand	Anodyne	MTNR1A	34	43
COC(=O)NCc1ccc(NC[C@@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819446742	FF	On-Demand	Anodyne	DRTS_TRYCR	44	31
COC(=O)NCc1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819446745	FG	On-Demand	Anodyne	ADRB2	48	49
COC(=O)NCc1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819446745	FG	On-Demand	Anodyne	ADRB1	65	40
COC(=O)NCc1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819446745	FG	On-Demand	Anodyne	ADRB3	44	39
COC(=O)NCc1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819446745	FG	On-Demand	Anodyne	PDS	65	43
COC(=O)NCc1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819446746	FG	On-Demand	Anodyne	ADRB2	48	49
COC(=O)NCc1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819446746	FG	On-Demand	Anodyne	ADRB1	65	40
COC(=O)NCc1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819446746	FG	On-Demand	Anodyne	ADRB3	44	39
COC(=O)NCc1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819446746	FG	On-Demand	Anodyne	PDS	65	43
COC(=O)NCc1ccc(NC[C@H](O)CN(C)Cc2ccccc2)cc1	ZINC000819446748	FE	On-Demand	Anodyne	UL54	47	32
COC(=O)NCc1ccc(NC[C@H](O)CN(C)Cc2ccccc2)cc1	ZINC000819446748	FE	On-Demand	Anodyne	PDS	58	38
COC(=O)NCc1ccc(NC[C@@H](O)CN(C)Cc2ccccc2)cc1	ZINC000819446749	FE	On-Demand	Anodyne	UL54	47	32
COC(=O)NCc1ccc(NC[C@@H](O)CN(C)Cc2ccccc2)cc1	ZINC000819446749	FE	On-Demand	Anodyne	PDS	58	38
CCn1c(NC(=O)C(F)=C2CCC2)nc2cc(C#N)ccc21	ZINC000819446756	CG	On-Demand	Mild	ITK	46	45
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819446776	GH	On-Demand	Anodyne	ADRB2	50	44
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819446776	GH	On-Demand	Anodyne	ADRB1	77	44
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819446776	GH	On-Demand	Anodyne	ADRB3	53	43
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819446776	GH	On-Demand	Anodyne	TRPV1	38	45
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819446776	GH	On-Demand	Anodyne	MT-ND1	27	40
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819446776	GH	On-Demand	Anodyne	PDS	75	41
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819446777	GH	On-Demand	Anodyne	ADRB2	50	44
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819446777	GH	On-Demand	Anodyne	ADRB1	77	44
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819446777	GH	On-Demand	Anodyne	ADRB3	53	43
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819446777	GH	On-Demand	Anodyne	TRPV1	38	45
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819446777	GH	On-Demand	Anodyne	MT-ND1	27	40
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819446777	GH	On-Demand	Anodyne	PDS	75	41
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819446778	GG	On-Demand	Anodyne	ADRB2	42	43
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819446778	GG	On-Demand	Anodyne	ADRB1	71	43
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819446778	GG	On-Demand	Anodyne	GRIN1	27	40
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819446778	GG	On-Demand	Anodyne	ADRB3	46	42
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(SC)cc2)cc1	ZINC000819446778	GG	On-Demand	Anodyne	PDS	61	42
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819446779	GG	On-Demand	Anodyne	ADRB2	42	43
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819446779	GG	On-Demand	Anodyne	ADRB1	71	43
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819446779	GG	On-Demand	Anodyne	GRIN1	27	40
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819446779	GG	On-Demand	Anodyne	ADRB3	46	42
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(SC)cc2)cc1	ZINC000819446779	GG	On-Demand	Anodyne	PDS	61	42
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccccc2F)cc1	ZINC000819446791	FF	On-Demand	Anodyne	ADRB2	32	43
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccccc2F)cc1	ZINC000819446791	FF	On-Demand	Anodyne	ADRB1	60	37
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccccc2F)cc1	ZINC000819446792	FF	On-Demand	Anodyne	ADRB2	32	43
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccccc2F)cc1	ZINC000819446792	FF	On-Demand	Anodyne	ADRB1	60	37
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)N3CC[C@@H](C4CC4)C3)nn2)C1	ZINC000819446802	GF	On-Demand	Anodyne	GPR119	21	43
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)N3CC[C@H](C4CC4)C3)nn2)C1	ZINC000819446803	GF	On-Demand	Anodyne	GPR119	21	43
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)N3CC[C@@H](C4CC4)C3)nn2)C1	ZINC000819446804	GF	On-Demand	Anodyne	GPR119	21	43
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)N3CC[C@H](C4CC4)C3)nn2)C1	ZINC000819446805	GF	On-Demand	Anodyne	GPR119	21	43
COc1cccc(OC)c1OC[C@@H](O)CNc1cccc(Cl)c1OC(C)C	ZINC000819446810	GH	On-Demand	Anodyne	ADRB2	23	42
COc1cccc(OC)c1OC[C@H](O)CNc1cccc(Cl)c1OC(C)C	ZINC000819446811	GH	On-Demand	Anodyne	ADRB2	23	42
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1	ZINC000819446818	FG	On-Demand	Anodyne	ADRB2	45	51
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1	ZINC000819446818	FG	On-Demand	Anodyne	ADRB1	58	51
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1	ZINC000819446818	FG	On-Demand	Anodyne	ADRB3	42	40
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1	ZINC000819446818	FG	On-Demand	Anodyne	PDS	67	42
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1	ZINC000819446819	FG	On-Demand	Anodyne	ADRB2	45	51
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1	ZINC000819446819	FG	On-Demand	Anodyne	ADRB1	58	51
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1	ZINC000819446819	FG	On-Demand	Anodyne	ADRB3	42	40
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1	ZINC000819446819	FG	On-Demand	Anodyne	PDS	67	42
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccccc2Cl)cc1)C1CC1	ZINC000819446820	FH	On-Demand	Anodyne	OPRL1	24	40
COC(=O)NCc1ccc(NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000819446821	GH	On-Demand	Anodyne	PPARA	19	45
COC(=O)NCc1ccc(NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000819446821	GH	On-Demand	Anodyne	TRPV1	31	41
COC(=O)NCc1ccc(NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000819446821	GH	On-Demand	Anodyne	PPARD	18	42
COC(=O)NCc1ccc(NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000819446821	GH	On-Demand	Anodyne	PDS	57	40
COC(=O)NCc1ccc(NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000819446822	GH	On-Demand	Anodyne	PPARA	19	45
COC(=O)NCc1ccc(NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000819446822	GH	On-Demand	Anodyne	TRPV1	31	41
COC(=O)NCc1ccc(NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000819446822	GH	On-Demand	Anodyne	PPARD	18	42
COC(=O)NCc1ccc(NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000819446822	GH	On-Demand	Anodyne	PDS	57	40
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819446823	FE	On-Demand	Mild	ADRB2	43	43
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819446823	FE	On-Demand	Mild	ADRB1	77	43
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819446823	FE	On-Demand	Mild	ADRB3	46	42
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819446823	FE	On-Demand	Mild	PDS	59	44
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819446824	FE	On-Demand	Mild	ADRB2	43	43
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819446824	FE	On-Demand	Mild	ADRB1	77	43
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819446824	FE	On-Demand	Mild	ADRB3	46	42
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819446824	FE	On-Demand	Mild	PDS	59	44
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819446834	FE	On-Demand	Mild	ADRB2	42	42
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819446834	FE	On-Demand	Mild	ADRB1	72	42
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819446834	FE	On-Demand	Mild	ADRB3	45	41
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819446834	FE	On-Demand	Mild	PDS	55	39
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819446835	FE	On-Demand	Mild	ADRB2	42	42
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819446835	FE	On-Demand	Mild	ADRB1	72	42
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819446835	FE	On-Demand	Mild	ADRB3	45	41
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819446835	FE	On-Demand	Mild	PDS	55	39
CC(=O)Nc1cccc(CC(=O)Oc2ccc3c(c2)CCCC(=O)N3)c1	ZINC000819446836	FG	On-Demand	Anodyne	PKM	15	41
O[C@@H](CNc1ccc(OCC2CCOCC2)cc1)C(F)(F)F	ZINC000819446837	DF	On-Demand	Anodyne	CTSS	17	40
O[C@H](CNc1ccc(OCC2CCOCC2)cc1)C(F)(F)F	ZINC000819446838	DF	On-Demand	Anodyne	CTSS	17	40
CCC1(CO)CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819446839	FF	On-Demand	Mild	GHRHR	42	35
CCC1(CO)CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819446839	FF	On-Demand	Mild	PAPA1_CARPA	36	45
CCC1(CO)CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819446839	FF	On-Demand	Mild	CTSK	15	42
CCC1(CO)CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819446840	FF	On-Demand	Mild	GHRHR	42	35
CCC1(CO)CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819446840	FF	On-Demand	Mild	PAPA1_CARPA	36	45
CCC1(CO)CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819446840	FF	On-Demand	Mild	CTSK	15	42
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1	ZINC000819446863	FG	On-Demand	Anodyne	ADRB2	45	47
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1	ZINC000819446863	FG	On-Demand	Anodyne	ADRB1	68	44
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1	ZINC000819446863	FG	On-Demand	Anodyne	ADRB3	45	43
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1	ZINC000819446864	FG	On-Demand	Anodyne	ADRB2	45	47
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1	ZINC000819446864	FG	On-Demand	Anodyne	ADRB1	68	44
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1	ZINC000819446864	FG	On-Demand	Anodyne	ADRB3	45	43
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819446867	GF	On-Demand	Mild	ADRB2	35	40
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819446867	GF	On-Demand	Mild	ADRB1	59	40
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819446868	GF	On-Demand	Mild	ADRB2	35	40
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819446868	GF	On-Demand	Mild	ADRB1	59	40
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C)cc2C)cc1	ZINC000819446869	FG	On-Demand	Anodyne	ADRB2	28	44
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C)cc2C)cc1	ZINC000819446869	FG	On-Demand	Anodyne	PDS	52	37
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C)cc2C)cc1	ZINC000819446870	FG	On-Demand	Anodyne	ADRB2	28	44
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C)cc2C)cc1	ZINC000819446870	FG	On-Demand	Anodyne	PDS	52	37
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819446871	GE	On-Demand	Anodyne	ADRB1	51	41
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819446871	GE	On-Demand	Anodyne	PDS	50	38
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819446872	GE	On-Demand	Anodyne	ADRB1	51	41
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819446872	GE	On-Demand	Anodyne	PDS	50	38
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819446873	FE	On-Demand	Anodyne	ADRB1	56	38
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819446873	FE	On-Demand	Anodyne	GRIN1	27	51
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819446873	FE	On-Demand	Anodyne	EDNRB	63	36
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819446873	FE	On-Demand	Anodyne	EDNRA	64	38
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819446873	FE	On-Demand	Anodyne	BMP1	61	41
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819446873	FE	On-Demand	Anodyne	NOS2	60	34
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819446873	FE	On-Demand	Anodyne	PDS	56	40
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819446874	FE	On-Demand	Anodyne	ADRB1	56	38
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819446874	FE	On-Demand	Anodyne	GRIN1	27	51
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819446874	FE	On-Demand	Anodyne	EDNRB	63	36
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819446874	FE	On-Demand	Anodyne	EDNRA	64	38
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819446874	FE	On-Demand	Anodyne	BMP1	61	41
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819446874	FE	On-Demand	Anodyne	NOS2	60	34
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819446874	FE	On-Demand	Anodyne	PDS	56	40
CCn1c(NC(=O)[C@@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)nc2cc(C#N)ccc21	ZINC000819446887	GF	On-Demand	Mild	ITK	42	42
CCn1c(NC(=O)[C@H]2C[C@H]3CC[C@H]2N(C(=O)OC)C3)nc2cc(C#N)ccc21	ZINC000819446888	GF	On-Demand	Mild	ITK	42	42
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819446894	GH	On-Demand	Anodyne	GRIN1	25	42
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819446894	GH	On-Demand	Anodyne	PDS	68	44
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819446895	GH	On-Demand	Anodyne	GRIN1	25	42
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2Cl)cc1	ZINC000819446895	GH	On-Demand	Anodyne	PDS	68	44
N#CC1=CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)CC1	ZINC000819446898	CD	On-Demand	Reactive	KCNJ1	57	46
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819446919	FF	On-Demand	Anodyne	ADRB2	45	44
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819446919	FF	On-Demand	Anodyne	ADRB1	67	42
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819446919	FF	On-Demand	Anodyne	ADRB3	45	42
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819446919	FF	On-Demand	Anodyne	PDS	99	45
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819446920	FF	On-Demand	Anodyne	ADRB2	45	44
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819446920	FF	On-Demand	Anodyne	ADRB1	67	42
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819446920	FF	On-Demand	Anodyne	ADRB3	45	42
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819446920	FF	On-Demand	Anodyne	PDS	99	45
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819446933	GF	On-Demand	Anodyne	ADRB2	35	42
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819446933	GF	On-Demand	Anodyne	ADRB1	51	41
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819446933	GF	On-Demand	Anodyne	ADRB3	35	41
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819446933	GF	On-Demand	Anodyne	PDS	55	37
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819446934	GF	On-Demand	Anodyne	ADRB2	35	42
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819446934	GF	On-Demand	Anodyne	ADRB1	51	41
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819446934	GF	On-Demand	Anodyne	ADRB3	35	41
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819446934	GF	On-Demand	Anodyne	PDS	55	37
COC(=O)NCc1ccc(NCCS(C)(=O)=O)cc1	ZINC000819446935	CC	On-Demand	Anodyne	TRPV1	30	44
COC(=O)NCc1ccc(NCCS(C)(=O)=O)cc1	ZINC000819446935	CC	On-Demand	Anodyne	PTPRB	59	41
COC(=O)NCc1ccc(NC[C@H](O)COCc2ccccc2Cl)cc1	ZINC000819446937	GG	On-Demand	Anodyne	ADRB1	20	43
COC(=O)NCc1ccc(NC[C@H](O)COCc2ccccc2Cl)cc1	ZINC000819446937	GG	On-Demand	Anodyne	PDS	56	40
COC(=O)NCc1ccc(NC[C@@H](O)COCc2ccccc2Cl)cc1	ZINC000819446938	GG	On-Demand	Anodyne	ADRB1	20	43
COC(=O)NCc1ccc(NC[C@@H](O)COCc2ccccc2Cl)cc1	ZINC000819446938	GG	On-Demand	Anodyne	PDS	56	40
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446949	GE	On-Demand	Bother	ADRB2	38	49
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446949	GE	On-Demand	Bother	ADRB1	53	50
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446949	GE	On-Demand	Bother	CACNA1C	50	36
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446949	GE	On-Demand	Bother	ADRB3	38	50
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446949	GE	On-Demand	Bother	CACNA1D	81	36
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446949	GE	On-Demand	Bother	PDS	91	60
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446950	GE	On-Demand	Bother	ADRB2	38	49
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446950	GE	On-Demand	Bother	ADRB1	53	50
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446950	GE	On-Demand	Bother	CACNA1C	50	36
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446950	GE	On-Demand	Bother	ADRB3	38	50
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446950	GE	On-Demand	Bother	CACNA1D	81	36
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819446950	GE	On-Demand	Bother	PDS	91	60
COC(=O)NCc1ccc(NC[C@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819446960	GH	On-Demand	Anodyne	ADRB2	37	40
COC(=O)NCc1ccc(NC[C@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819446960	GH	On-Demand	Anodyne	ADRB1	51	39
COC(=O)NCc1ccc(NC[C@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819446960	GH	On-Demand	Anodyne	ADRB3	31	40
COC(=O)NCc1ccc(NC[C@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819446960	GH	On-Demand	Anodyne	PDS	67	42
COC(=O)NCc1ccc(NC[C@@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819446961	GH	On-Demand	Anodyne	ADRB2	37	40
COC(=O)NCc1ccc(NC[C@@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819446961	GH	On-Demand	Anodyne	ADRB1	51	39
COC(=O)NCc1ccc(NC[C@@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819446961	GH	On-Demand	Anodyne	ADRB3	31	40
COC(=O)NCc1ccc(NC[C@@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819446961	GH	On-Demand	Anodyne	PDS	67	42
COC(=O)NCc1ccc(NC[C@H](O)CN2C(=O)c3ccccc3C2=O)cc1	ZINC000819446972	GD	On-Demand	Anodyne	PDS	47	34
COC(=O)NCc1ccc(NC[C@@H](O)CN2C(=O)c3ccccc3C2=O)cc1	ZINC000819446973	GD	On-Demand	Anodyne	PDS	47	34
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccccc2)cc1)C1CC1	ZINC000819446998	DG	On-Demand	Anodyne	ADRB1	19	41
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccccc2)cc1)C1CC1	ZINC000819446998	DG	On-Demand	Anodyne	ADRB3	51	39
CC(=O)N(Cc1ccc(NC[C@H](O)c2ccccc2)cc1)C1CC1	ZINC000819446998	DG	On-Demand	Anodyne	GIPR	41	38
CC(=O)N(Cc1ccc(NC[C@@H](O)c2ccccc2)cc1)C1CC1	ZINC000819446999	DG	On-Demand	Anodyne	ADRB1	19	41
CC(=O)N(Cc1ccc(NC[C@@H](O)c2ccccc2)cc1)C1CC1	ZINC000819446999	DG	On-Demand	Anodyne	ADRB3	51	39
CC(=O)N(Cc1ccc(NC[C@@H](O)c2ccccc2)cc1)C1CC1	ZINC000819446999	DG	On-Demand	Anodyne	GIPR	41	38
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc(-n3ccnc3)cc2)CC1	ZINC000819447008	GG	On-Demand	Anodyne	GPR119	50	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc(-n3ccnc3)cc2)CC1	ZINC000819447009	GG	On-Demand	Anodyne	GPR119	50	46
NC(=O)CCNc1ccc(OCC(F)(F)F)c(C(F)(F)F)c1	ZINC000819447014	EF	On-Demand	Anodyne	S1PR4	22	40
O=C(/C=C/[C@@H]1CCCO1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000819447015	DF	On-Demand	Bother	SLC27A4	50	32
O=C(/C=C/[C@@H]1CCCO1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000819447015	DF	On-Demand	Bother	LUXR	16	40
O=C(/C=C\[C@@H]1CCCO1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000819447016	DF	On-Demand	Bother	SLC27A4	50	32
O=C(/C=C\[C@@H]1CCCO1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000819447016	DF	On-Demand	Bother	LUXR	16	40
O=C(/C=C\[C@H]1CCCO1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000819447017	DF	On-Demand	Bother	SLC27A4	50	32
O=C(/C=C\[C@H]1CCCO1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000819447017	DF	On-Demand	Bother	LUXR	16	40
O=C(/C=C/[C@H]1CCCO1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000819447018	DF	On-Demand	Bother	SLC27A4	50	32
O=C(/C=C/[C@H]1CCCO1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000819447018	DF	On-Demand	Bother	LUXR	16	40
COC(=O)NCc1ccc(NC[C@@H](O)Cc2ccccc2C(F)(F)F)cc1	ZINC000819447019	GH	On-Demand	Anodyne	PDS	70	37
COC(=O)NCc1ccc(NC[C@H](O)Cc2ccccc2C(F)(F)F)cc1	ZINC000819447020	GH	On-Demand	Anodyne	PDS	70	37
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819447025	GG	On-Demand	Anodyne	ADRB2	42	39
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819447025	GG	On-Demand	Anodyne	ADRB1	61	41
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819447025	GG	On-Demand	Anodyne	ADRB3	39	40
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819447025	GG	On-Demand	Anodyne	CCR2	29	41
COC(=O)NCc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819447025	GG	On-Demand	Anodyne	PDS	111	60
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819447026	GG	On-Demand	Anodyne	ADRB2	42	39
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819447026	GG	On-Demand	Anodyne	ADRB1	61	41
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819447026	GG	On-Demand	Anodyne	ADRB3	39	40
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819447026	GG	On-Demand	Anodyne	CCR2	29	41
COC(=O)NCc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819447026	GG	On-Demand	Anodyne	PDS	111	60
C[C@@H](NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C)c1ncon1	ZINC000819447027	GH	On-Demand	Anodyne	REN	57	39
C[C@@H](NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C)c1ncon1	ZINC000819447030	GH	On-Demand	Anodyne	REN	57	39
COC(=O)NCc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819447036	GH	On-Demand	Anodyne	ADRB2	24	42
COC(=O)NCc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819447036	GH	On-Demand	Anodyne	GCGR	28	46
COC(=O)NCc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819447036	GH	On-Demand	Anodyne	ADRB3	17	43
COC(=O)NCc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819447036	GH	On-Demand	Anodyne	CTSS	21	40
COC(=O)NCc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819447036	GH	On-Demand	Anodyne	GIPR	26	40
COC(=O)NCc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819447036	GH	On-Demand	Anodyne	PDS	52	35
COC(=O)NCc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819447037	GH	On-Demand	Anodyne	ADRB2	24	42
COC(=O)NCc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819447037	GH	On-Demand	Anodyne	GCGR	28	46
COC(=O)NCc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819447037	GH	On-Demand	Anodyne	ADRB3	17	43
COC(=O)NCc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819447037	GH	On-Demand	Anodyne	CTSS	21	40
COC(=O)NCc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819447037	GH	On-Demand	Anodyne	GIPR	26	40
COC(=O)NCc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819447037	GH	On-Demand	Anodyne	PDS	52	35
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819447057	GH	On-Demand	Anodyne	ADRB2	50	51
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819447057	GH	On-Demand	Anodyne	ADRB1	65	44
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819447057	GH	On-Demand	Anodyne	ADRB3	44	44
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819447057	GH	On-Demand	Anodyne	CASR	43	38
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819447057	GH	On-Demand	Anodyne	PDS	42	36
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819447058	GH	On-Demand	Anodyne	ADRB2	50	51
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819447058	GH	On-Demand	Anodyne	ADRB1	65	44
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819447058	GH	On-Demand	Anodyne	ADRB3	44	44
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819447058	GH	On-Demand	Anodyne	CASR	43	38
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819447058	GH	On-Demand	Anodyne	PDS	42	36
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819447063	FF	On-Demand	Anodyne	ADRB2	45	43
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819447063	FF	On-Demand	Anodyne	ADRB1	73	43
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819447063	FF	On-Demand	Anodyne	GRIN1	28	48
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819447063	FF	On-Demand	Anodyne	ADRB3	47	43
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819447064	FF	On-Demand	Anodyne	ADRB2	45	43
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819447064	FF	On-Demand	Anodyne	ADRB1	73	43
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819447064	FF	On-Demand	Anodyne	GRIN1	28	48
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819447064	FF	On-Demand	Anodyne	ADRB3	47	43
COC(=O)NCc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819447065	FE	On-Demand	Anodyne	NOD1	19	45
COC(=O)NCc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819447065	FE	On-Demand	Anodyne	NOD2	51	45
COC(=O)NCc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819447066	FE	On-Demand	Anodyne	NOD1	19	45
COC(=O)NCc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819447066	FE	On-Demand	Anodyne	NOD2	51	45
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819447074	FH	On-Demand	Anodyne	ADRB2	15	55
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819447074	FH	On-Demand	Anodyne	ADRB1	36	55
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819447074	FH	On-Demand	Anodyne	GCGR	16	40
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819447074	FH	On-Demand	Anodyne	ADRB3	57	45
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819447074	FH	On-Demand	Anodyne	CYP3A4	47	37
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819447074	FH	On-Demand	Anodyne	GIPR	46	38
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819447075	FH	On-Demand	Anodyne	ADRB2	15	55
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819447075	FH	On-Demand	Anodyne	ADRB1	36	55
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819447075	FH	On-Demand	Anodyne	GCGR	16	40
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819447075	FH	On-Demand	Anodyne	ADRB3	57	45
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819447075	FH	On-Demand	Anodyne	CYP3A4	47	37
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1)C1CC1	ZINC000819447075	FH	On-Demand	Anodyne	GIPR	46	38
N#CC1=CCN(C(=O)c2nn(-c3cccc(Cl)c3F)c3c2CCC3)CC1	ZINC000819447078	FG	On-Demand	Reactive	CNR1	51	31
OC1(CNc2ccc(-n3ccnc3)cc2)CCCCC1	ZINC000819447079	CF	On-Demand	Anodyne	CYP2C19	17	40
CC(=O)N(Cc1ccc(NC[C@H](O)c2cccc(F)c2)cc1)C1CC1	ZINC000819447092	EG	On-Demand	Anodyne	GIPR	41	38
CC(=O)N(Cc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1)C1CC1	ZINC000819447093	EG	On-Demand	Anodyne	GIPR	41	38
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccccc2C)cc1	ZINC000819447094	FG	On-Demand	Anodyne	ADRB2	38	51
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccccc2C)cc1	ZINC000819447094	FG	On-Demand	Anodyne	ADRB1	58	35
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccccc2C)cc1	ZINC000819447095	FG	On-Demand	Anodyne	ADRB2	38	51
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccccc2C)cc1	ZINC000819447095	FG	On-Demand	Anodyne	ADRB1	58	35
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819447102	FG	On-Demand	Anodyne	ADRB2	36	46
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819447102	FG	On-Demand	Anodyne	ADRB1	54	38
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819447103	FG	On-Demand	Anodyne	ADRB2	36	46
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)cc1	ZINC000819447103	FG	On-Demand	Anodyne	ADRB1	54	38
COC(=O)NCc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819447118	FH	On-Demand	Anodyne	PPARA	18	44
COC(=O)NCc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819447118	FH	On-Demand	Anodyne	TRPV1	27	41
COC(=O)NCc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819447118	FH	On-Demand	Anodyne	PPARD	16	40
COC(=O)NCc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819447118	FH	On-Demand	Anodyne	PDS	47	38
COC(=O)NCc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819447119	FH	On-Demand	Anodyne	PPARA	18	44
COC(=O)NCc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819447119	FH	On-Demand	Anodyne	TRPV1	27	41
COC(=O)NCc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819447119	FH	On-Demand	Anodyne	PPARD	16	40
COC(=O)NCc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819447119	FH	On-Demand	Anodyne	PDS	47	38
COC(=O)NCc1ccc(NC[C@@](C)(O)CNC(=O)OC(C)(C)C)cc1	ZINC000819447122	FE	On-Demand	Anodyne	PTPRB	29	40
COC(=O)NCc1ccc(NC[C@](C)(O)CNC(=O)OC(C)(C)C)cc1	ZINC000819447123	FE	On-Demand	Anodyne	PTPRB	29	40
CCOC(=O)CCc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819447128	EH	On-Demand	Anodyne	ADRB2	43	56
CCOC(=O)CCc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819447128	EH	On-Demand	Anodyne	ADRB1	55	56
CCOC(=O)CCc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819447128	EH	On-Demand	Anodyne	ADRB3	89	51
CCOC(=O)CCc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819447128	EH	On-Demand	Anodyne	CYP3A4	43	33
CCOC(=O)CCc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819447129	EH	On-Demand	Anodyne	ADRB2	43	56
CCOC(=O)CCc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819447129	EH	On-Demand	Anodyne	ADRB1	55	56
CCOC(=O)CCc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819447129	EH	On-Demand	Anodyne	ADRB3	89	51
CCOC(=O)CCc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819447129	EH	On-Demand	Anodyne	CYP3A4	43	33
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)CC1CCCC1	ZINC000819447159	DG	On-Demand	Anodyne	CTSS	18	48
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)CC1CCCC1	ZINC000819447160	DG	On-Demand	Anodyne	CTSS	18	48
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)CC1CCCC1	ZINC000819447161	DG	On-Demand	Anodyne	CTSS	18	48
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)CC1CCCC1	ZINC000819447162	DG	On-Demand	Anodyne	CTSS	18	48
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1cccc2[nH]ccc12	ZINC000819447163	FG	On-Demand	Anodyne	ADRB2	15	56
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1cccc2[nH]ccc12	ZINC000819447163	FG	On-Demand	Anodyne	ADRB1	23	56
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1cccc2[nH]ccc12	ZINC000819447164	FG	On-Demand	Anodyne	ADRB2	15	56
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1cccc2[nH]ccc12	ZINC000819447164	FG	On-Demand	Anodyne	ADRB1	23	56
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1cccc2[nH]ccc12	ZINC000819447165	FG	On-Demand	Anodyne	ADRB2	15	56
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1cccc2[nH]ccc12	ZINC000819447165	FG	On-Demand	Anodyne	ADRB1	23	56
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1cccc2[nH]ccc12	ZINC000819447166	FG	On-Demand	Anodyne	ADRB2	15	56
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1cccc2[nH]ccc12	ZINC000819447166	FG	On-Demand	Anodyne	ADRB1	23	56
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccccc1Cl	ZINC000819447168	FG	On-Demand	Anodyne	ADRB2	19	41
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccccc1Cl	ZINC000819447169	FG	On-Demand	Anodyne	ADRB2	19	41
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccccc1Cl	ZINC000819447170	FG	On-Demand	Anodyne	ADRB2	19	41
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccccc1Cl	ZINC000819447171	FG	On-Demand	Anodyne	ADRB2	19	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC3CCOCC3)c(C)c2)c1	ZINC000819447184	GH	On-Demand	Anodyne	ADRB2	19	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC3CCOCC3)c(C)c2)c1	ZINC000819447185	GH	On-Demand	Anodyne	ADRB2	19	42
O=C(CCNc1ccc(O[C@@H]2CCOC2)cc1)Nc1cccc(F)c1	ZINC000819447198	EG	On-Demand	Anodyne	EPHX2	17	40
O=C(CCNc1ccc(O[C@H]2CCOC2)cc1)Nc1cccc(F)c1	ZINC000819447199	EG	On-Demand	Anodyne	EPHX2	17	40
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(Cl)c2OC(C)C)cc1	ZINC000819447272	GH	On-Demand	Anodyne	ADRB2	42	56
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(Cl)c2OC(C)C)cc1	ZINC000819447272	GH	On-Demand	Anodyne	ADRB1	70	56
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(Cl)c2OC(C)C)cc1	ZINC000819447272	GH	On-Demand	Anodyne	GRIN1	27	41
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(Cl)c2OC(C)C)cc1	ZINC000819447272	GH	On-Demand	Anodyne	ADRB3	42	46
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(Cl)c2OC(C)C)cc1	ZINC000819447273	GH	On-Demand	Anodyne	ADRB2	42	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(Cl)c2OC(C)C)cc1	ZINC000819447273	GH	On-Demand	Anodyne	ADRB1	70	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(Cl)c2OC(C)C)cc1	ZINC000819447273	GH	On-Demand	Anodyne	GRIN1	27	41
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(Cl)c2OC(C)C)cc1	ZINC000819447273	GH	On-Demand	Anodyne	ADRB3	42	46
COC(=O)NCc1ccc(NC[C@@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819447284	GG	On-Demand	Anodyne	PDS	53	38
COC(=O)NCc1ccc(NC[C@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819447285	GG	On-Demand	Anodyne	PDS	53	38
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819447286	FF	On-Demand	Anodyne	ADRB2	46	46
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819447286	FF	On-Demand	Anodyne	ADRB1	78	46
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819447286	FF	On-Demand	Anodyne	ADRB3	50	45
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819447286	FF	On-Demand	Anodyne	PDS	58	40
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819447287	FF	On-Demand	Anodyne	ADRB2	46	46
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819447287	FF	On-Demand	Anodyne	ADRB1	78	46
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819447287	FF	On-Demand	Anodyne	ADRB3	50	45
COC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819447287	FF	On-Demand	Anodyne	PDS	58	40
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819447297	GH	On-Demand	Anodyne	ADRB2	37	53
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819447297	GH	On-Demand	Anodyne	ADRB1	56	36
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819447297	GH	On-Demand	Anodyne	ADRB3	30	51
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819447297	GH	On-Demand	Anodyne	CASR	40	36
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819447297	GH	On-Demand	Anodyne	CYP2D6	21	43
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819447298	GH	On-Demand	Anodyne	ADRB2	37	53
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819447298	GH	On-Demand	Anodyne	ADRB1	56	36
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819447298	GH	On-Demand	Anodyne	ADRB3	30	51
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819447298	GH	On-Demand	Anodyne	CASR	40	36
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819447298	GH	On-Demand	Anodyne	CYP2D6	21	43
CC(=O)Nc1cccc(CC(=O)NC[C@H](NC(=O)OC(C)(C)C)C2CC2)c1	ZINC000819447301	GF	On-Demand	Anodyne	FPR1	40	36
CC(=O)Nc1cccc(CC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C2CC2)c1	ZINC000819447302	GF	On-Demand	Anodyne	FPR1	40	36
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819447303	GF	On-Demand	Anodyne	ADRB2	36	44
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819447303	GF	On-Demand	Anodyne	ADRB1	63	44
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819447303	GF	On-Demand	Anodyne	ADRB3	41	43
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819447304	GF	On-Demand	Anodyne	ADRB2	36	44
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819447304	GF	On-Demand	Anodyne	ADRB1	63	44
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819447304	GF	On-Demand	Anodyne	ADRB3	41	43
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819447306	GG	On-Demand	Anodyne	ADRB2	36	47
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819447306	GG	On-Demand	Anodyne	ADRB1	55	35
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819447306	GG	On-Demand	Anodyne	ADRB3	27	42
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819447306	GG	On-Demand	Anodyne	PDS	18	41
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819447307	GG	On-Demand	Anodyne	ADRB2	36	47
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819447307	GG	On-Demand	Anodyne	ADRB1	55	35
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819447307	GG	On-Demand	Anodyne	ADRB3	27	42
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819447307	GG	On-Demand	Anodyne	PDS	18	41
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccccc2C(C)C)cc1	ZINC000819447343	GH	On-Demand	Anodyne	ADRB2	38	47
COC(=O)N(C)Cc1ccc(NC[C@H](O)COc2ccccc2C(C)C)cc1	ZINC000819447343	GH	On-Demand	Anodyne	ADRB1	52	34
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccccc2C(C)C)cc1	ZINC000819447344	GH	On-Demand	Anodyne	ADRB2	38	47
COC(=O)N(C)Cc1ccc(NC[C@@H](O)COc2ccccc2C(C)C)cc1	ZINC000819447344	GH	On-Demand	Anodyne	ADRB1	52	34
COC(=O)NCc1ccc(NC[C@@H](O)COc2cc(C)ccc2C)cc1	ZINC000819447364	FG	On-Demand	Anodyne	ADRB2	36	44
COC(=O)NCc1ccc(NC[C@@H](O)COc2cc(C)ccc2C)cc1	ZINC000819447364	FG	On-Demand	Anodyne	ADRB1	56	36
COC(=O)NCc1ccc(NC[C@@H](O)COc2cc(C)ccc2C)cc1	ZINC000819447364	FG	On-Demand	Anodyne	PDS	52	37
COC(=O)NCc1ccc(NC[C@H](O)COc2cc(C)ccc2C)cc1	ZINC000819447365	FG	On-Demand	Anodyne	ADRB2	36	44
COC(=O)NCc1ccc(NC[C@H](O)COc2cc(C)ccc2C)cc1	ZINC000819447365	FG	On-Demand	Anodyne	ADRB1	56	36
COC(=O)NCc1ccc(NC[C@H](O)COc2cc(C)ccc2C)cc1	ZINC000819447365	FG	On-Demand	Anodyne	PDS	52	37
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819447376	GE	On-Demand	Anodyne	ADRB2	33	43
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819447376	GE	On-Demand	Anodyne	ADRB1	57	42
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819447376	GE	On-Demand	Anodyne	ADRB3	35	41
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819447377	GE	On-Demand	Anodyne	ADRB2	33	43
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819447377	GE	On-Demand	Anodyne	ADRB1	57	42
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819447377	GE	On-Demand	Anodyne	ADRB3	35	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819447378	GE	On-Demand	Anodyne	ADRB2	33	43
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819447378	GE	On-Demand	Anodyne	ADRB1	57	42
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819447378	GE	On-Demand	Anodyne	ADRB3	35	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819447379	GE	On-Demand	Anodyne	ADRB2	33	43
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819447379	GE	On-Demand	Anodyne	ADRB1	57	42
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819447379	GE	On-Demand	Anodyne	ADRB3	35	41
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccc(F)cc1	ZINC000819447386	EF	On-Demand	Anodyne	ADRB1	43	43
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccc(F)cc1	ZINC000819447387	EF	On-Demand	Anodyne	ADRB1	43	43
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccc(F)cc1	ZINC000819447389	EF	On-Demand	Anodyne	ADRB1	43	43
O=C(N[C@H](CO)Cc1ccc(O)cc1)C(F)=C1CCC1	ZINC000819447407	CD	On-Demand	Anodyne	GRIA1	41	32
O=C(N[C@H](CO)Cc1ccc(O)cc1)C(F)=C1CCC1	ZINC000819447407	CD	On-Demand	Anodyne	YARS	69	35
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(COC3CCCC3)cc2)cc1	ZINC000819447408	GH	On-Demand	Anodyne	GHSR	15	40
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(COC3CCCC3)cc2)cc1	ZINC000819447409	GH	On-Demand	Anodyne	GHSR	15	40
O[C@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1cccnc1	ZINC000819447414	EF	On-Demand	Anodyne	ADRB3	73	38
O[C@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1cccnc1	ZINC000819447414	EF	On-Demand	Anodyne	TNK2	29	45
O[C@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1cccnc1	ZINC000819447415	EF	On-Demand	Anodyne	ADRB3	73	38
O[C@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1cccnc1	ZINC000819447415	EF	On-Demand	Anodyne	TNK2	29	45
O[C@@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1cccnc1	ZINC000819447416	EF	On-Demand	Anodyne	ADRB3	73	38
O[C@@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1cccnc1	ZINC000819447416	EF	On-Demand	Anodyne	TNK2	29	45
O[C@@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1cccnc1	ZINC000819447417	EF	On-Demand	Anodyne	ADRB3	73	38
O[C@@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1cccnc1	ZINC000819447417	EF	On-Demand	Anodyne	TNK2	29	45
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1OCCC(C)C	ZINC000819447431	DH	On-Demand	Anodyne	ADRB2	25	41
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1OCCC(C)C	ZINC000819447431	DH	On-Demand	Anodyne	ADRB1	27	43
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1OCCC(C)C	ZINC000819447431	DH	On-Demand	Anodyne	ADRB3	86	44
Cc1ccc(NC[C@H](O)c2cccnc2)cc1OCCC(C)C	ZINC000819447432	DH	On-Demand	Anodyne	ADRB2	25	41
Cc1ccc(NC[C@H](O)c2cccnc2)cc1OCCC(C)C	ZINC000819447432	DH	On-Demand	Anodyne	ADRB1	27	43
Cc1ccc(NC[C@H](O)c2cccnc2)cc1OCCC(C)C	ZINC000819447432	DH	On-Demand	Anodyne	ADRB3	86	44
O[C@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1cc(F)ccc1F	ZINC000819447439	FH	On-Demand	Anodyne	TNK2	23	41
O[C@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1cc(F)ccc1F	ZINC000819447440	FH	On-Demand	Anodyne	TNK2	23	41
O[C@@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1cc(F)ccc1F	ZINC000819447441	FH	On-Demand	Anodyne	TNK2	23	41
O[C@@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1cc(F)ccc1F	ZINC000819447442	FH	On-Demand	Anodyne	TNK2	23	41
Cc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)c(OCCN(C)C)c1	ZINC000819447452	FF	On-Demand	Mild	ADRB2	15	40
Cc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)c(OCCN(C)C)c1	ZINC000819447453	FF	On-Demand	Mild	ADRB2	15	40
O[C@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1cc2ccccc2o1	ZINC000819447462	FI	On-Demand	Anodyne	TNK2	27	41
O[C@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1cc2ccccc2o1	ZINC000819447463	FI	On-Demand	Anodyne	TNK2	27	41
O=C(CCNc1ccc(O[C@@H]2CCOC2)cc1)Nc1ccc(Cl)cc1	ZINC000819447464	FH	On-Demand	Anodyne	EPHX2	18	46
O=C(CCNc1ccc(O[C@H]2CCOC2)cc1)Nc1ccc(Cl)cc1	ZINC000819447465	FH	On-Demand	Anodyne	EPHX2	18	46
COc1cccc([S@@](=O)CC(=O)N2CC=C(C#N)CC2)c1	ZINC000819447466	DD	On-Demand	Reactive	DRD4	43	35
COc1cccc([S@](=O)CC(=O)N2CC=C(C#N)CC2)c1	ZINC000819447467	DD	On-Demand	Reactive	DRD4	43	35
CC(=O)N(Cc1ccc(NCCC(=O)Nc2ccc(N(C)C)cc2)cc1)C1CC1	ZINC000819447469	GH	On-Demand	Anodyne	GCGR	15	41
CC(=O)N(Cc1ccc(NCCC(=O)Nc2ccc(N(C)C)cc2)cc1)C1CC1	ZINC000819447469	GH	On-Demand	Anodyne	GIPR	48	41
COC(=O)NCc1ccc(NC[C@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819447473	FH	On-Demand	Anodyne	PDS	61	36
COC(=O)NCc1ccc(NC[C@@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819447474	FH	On-Demand	Anodyne	PDS	61	36
COC(=O)NCc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819447485	GE	On-Demand	Anodyne	TRPV1	19	41
COC(=O)NCc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819447485	GE	On-Demand	Anodyne	GHSR	21	41
COC(=O)NCc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819447486	GE	On-Demand	Anodyne	TRPV1	19	41
COC(=O)NCc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819447486	GE	On-Demand	Anodyne	GHSR	21	41
COC(=O)NCc1ccc(NC[C@@H](O)COc2c(C)cccc2C)cc1	ZINC000819447489	FG	On-Demand	Anodyne	ADRB2	40	39
COC(=O)NCc1ccc(NC[C@@H](O)COc2c(C)cccc2C)cc1	ZINC000819447489	FG	On-Demand	Anodyne	ADRB1	51	37
COC(=O)NCc1ccc(NC[C@@H](O)COc2c(C)cccc2C)cc1	ZINC000819447489	FG	On-Demand	Anodyne	PDS	62	37
COC(=O)NCc1ccc(NC[C@H](O)COc2c(C)cccc2C)cc1	ZINC000819447490	FG	On-Demand	Anodyne	ADRB2	40	39
COC(=O)NCc1ccc(NC[C@H](O)COc2c(C)cccc2C)cc1	ZINC000819447490	FG	On-Demand	Anodyne	ADRB1	51	37
COC(=O)NCc1ccc(NC[C@H](O)COc2c(C)cccc2C)cc1	ZINC000819447490	FG	On-Demand	Anodyne	PDS	62	37
O=C(C(F)=C1CCC1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000819447491	DG	On-Demand	Bother	MMP2	15	40
O=C(C(F)=C1CCC1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000819447491	DG	On-Demand	Bother	MMP8	31	40
O=C(C(F)=C1CCC1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000819447491	DG	On-Demand	Bother	MMP9	16	40
O=C(C(F)=C1CCC1)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1	ZINC000819447491	DG	On-Demand	Bother	MMP1	23	40
COC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819447498	GG	On-Demand	Anodyne	ADRB2	38	47
COC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819447498	GG	On-Demand	Anodyne	ADRB1	65	37
COC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819447498	GG	On-Demand	Anodyne	PDS	75	40
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819447499	GG	On-Demand	Anodyne	ADRB2	38	47
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819447499	GG	On-Demand	Anodyne	ADRB1	65	37
COC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819447499	GG	On-Demand	Anodyne	PDS	75	40
COC(=O)NCc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819447501	FH	On-Demand	Anodyne	ADRB1	20	42
COC(=O)NCc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819447501	FH	On-Demand	Anodyne	CCR2	41	41
COC(=O)NCc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819447501	FH	On-Demand	Anodyne	PDS	75	46
COC(=O)NCc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819447502	FH	On-Demand	Anodyne	ADRB1	20	42
COC(=O)NCc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819447502	FH	On-Demand	Anodyne	CCR2	41	41
COC(=O)NCc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819447502	FH	On-Demand	Anodyne	PDS	75	46
COC(=O)NCc1ccc(NC[C@@H](O)CO[C@H](C)c2ccc(Cl)cc2)cc1	ZINC000819447504	GH	On-Demand	Anodyne	PDS	57	38
COC(=O)NCc1ccc(NC[C@@H](O)CO[C@@H](C)c2ccc(Cl)cc2)cc1	ZINC000819447505	GH	On-Demand	Anodyne	PDS	57	38
COC(=O)NCc1ccc(NC[C@H](O)CO[C@H](C)c2ccc(Cl)cc2)cc1	ZINC000819447506	GH	On-Demand	Anodyne	PDS	57	38
COC(=O)NCc1ccc(NC[C@H](O)CO[C@@H](C)c2ccc(Cl)cc2)cc1	ZINC000819447507	GH	On-Demand	Anodyne	PDS	57	38
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819447525	EG	On-Demand	Anodyne	ADRB2	26	49
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819447525	EG	On-Demand	Anodyne	ADRB1	41	47
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819447526	EG	On-Demand	Anodyne	ADRB2	26	49
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819447526	EG	On-Demand	Anodyne	ADRB1	41	47
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819447527	EG	On-Demand	Anodyne	ADRB2	26	49
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819447527	EG	On-Demand	Anodyne	ADRB1	41	47
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819447528	EG	On-Demand	Anodyne	ADRB2	26	49
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819447528	EG	On-Demand	Anodyne	ADRB1	41	47
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)c1ccc(OC(F)(F)F)cc1	ZINC000819447543	GH	On-Demand	Anodyne	CTSS	19	49
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)c1ccc(OC(F)(F)F)cc1	ZINC000819447544	GH	On-Demand	Anodyne	CTSS	19	49
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)c1ccc(OC(F)(F)F)cc1	ZINC000819447545	GH	On-Demand	Anodyne	CTSS	19	49
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)c1ccc(OC(F)(F)F)cc1	ZINC000819447546	GH	On-Demand	Anodyne	CTSS	19	49
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1cccc(C(F)(F)F)c1	ZINC000819447554	GH	On-Demand	Anodyne	ADRB1	19	42
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1cccc(C(F)(F)F)c1	ZINC000819447554	GH	On-Demand	Anodyne	PDS	43	39
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1cccc(C(F)(F)F)c1	ZINC000819447555	GH	On-Demand	Anodyne	ADRB1	19	42
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1cccc(C(F)(F)F)c1	ZINC000819447555	GH	On-Demand	Anodyne	PDS	43	39
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1cccc(C(F)(F)F)c1	ZINC000819447556	GH	On-Demand	Anodyne	ADRB1	19	42
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1cccc(C(F)(F)F)c1	ZINC000819447556	GH	On-Demand	Anodyne	PDS	43	39
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1cccc(C(F)(F)F)c1	ZINC000819447557	GH	On-Demand	Anodyne	ADRB1	19	42
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1cccc(C(F)(F)F)c1	ZINC000819447557	GH	On-Demand	Anodyne	PDS	43	39
O[C@@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1cccc(F)c1	ZINC000819447580	EH	On-Demand	Anodyne	TNK2	25	41
O[C@@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1cccc(F)c1	ZINC000819447581	EH	On-Demand	Anodyne	TNK2	25	41
O[C@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1cccc(F)c1	ZINC000819447582	EH	On-Demand	Anodyne	TNK2	25	41
O[C@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1cccc(F)c1	ZINC000819447583	EH	On-Demand	Anodyne	TNK2	25	41
O[C@@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1c(F)cccc1F	ZINC000819447608	FH	On-Demand	Anodyne	TNK2	30	42
O[C@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1c(F)cccc1F	ZINC000819447609	FH	On-Demand	Anodyne	TNK2	30	42
O[C@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1c(F)cccc1F	ZINC000819447610	FH	On-Demand	Anodyne	TNK2	30	42
O[C@@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1c(F)cccc1F	ZINC000819447611	FH	On-Demand	Anodyne	TNK2	30	42
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)c1	ZINC000819447616	FF	On-Demand	Bother	ADRB1	24	42
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)c1	ZINC000819447617	FF	On-Demand	Bother	ADRB1	24	42
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)c1	ZINC000819447618	FF	On-Demand	Bother	ADRB1	24	42
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)c1	ZINC000819447619	FF	On-Demand	Bother	ADRB1	24	42
O[C@@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1cccc(Cl)c1	ZINC000819447634	FI	On-Demand	Anodyne	CYP3A4	45	34
O[C@@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1cccc(Cl)c1	ZINC000819447635	FI	On-Demand	Anodyne	CYP3A4	45	34
O[C@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1cccc(Cl)c1	ZINC000819447636	FI	On-Demand	Anodyne	CYP3A4	45	34
O[C@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1cccc(Cl)c1	ZINC000819447637	FI	On-Demand	Anodyne	CYP3A4	45	34
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC3CCOCC3)c(C)c2)cc1	ZINC000819447648	GH	On-Demand	Anodyne	ADRB2	18	41
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC3CCOCC3)c(C)c2)cc1	ZINC000819447648	GH	On-Demand	Anodyne	ADRB1	41	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC3CCOCC3)c(C)c2)cc1	ZINC000819447649	GH	On-Demand	Anodyne	ADRB2	18	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC3CCOCC3)c(C)c2)cc1	ZINC000819447649	GH	On-Demand	Anodyne	ADRB1	41	41
O[C@@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819447654	GJ	On-Demand	Anodyne	TNK2	20	40
O[C@@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819447655	GJ	On-Demand	Anodyne	TNK2	20	40
O[C@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819447656	GJ	On-Demand	Anodyne	TNK2	20	40
O[C@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1ccc(C(F)(F)F)cc1	ZINC000819447657	GJ	On-Demand	Anodyne	TNK2	20	40
O[C@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819447689	GI	On-Demand	Anodyne	TNK2	22	40
O[C@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819447690	GI	On-Demand	Anodyne	TNK2	22	40
O[C@@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819447691	GI	On-Demand	Anodyne	TNK2	22	40
O[C@@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1ccc(Cl)c(F)c1	ZINC000819447692	GI	On-Demand	Anodyne	TNK2	22	40
Cc1ccc(NC[C@H](O)COc2ccc(F)cc2)c(OCCN(C)C)c1	ZINC000819447693	FF	On-Demand	Anodyne	ADRB2	22	42
Cc1ccc(NC[C@@H](O)COc2ccc(F)cc2)c(OCCN(C)C)c1	ZINC000819447694	FF	On-Demand	Anodyne	ADRB2	22	42
O=C(/C=C/[C@@H]1CCCO1)N[C@H](CO)Cc1ccc(O)cc1	ZINC000819447728	CD	On-Demand	Anodyne	YARS	69	35
O=C(/C=C/[C@H]1CCCO1)N[C@H](CO)Cc1ccc(O)cc1	ZINC000819447729	CD	On-Demand	Anodyne	YARS	69	35
O=C(/C=C\[C@@H]1CCCO1)N[C@H](CO)Cc1ccc(O)cc1	ZINC000819447730	CD	On-Demand	Anodyne	YARS	69	35
O=C(/C=C\[C@H]1CCCO1)N[C@H](CO)Cc1ccc(O)cc1	ZINC000819447731	CD	On-Demand	Anodyne	YARS	69	35
O=C(CCNc1ccc(O[C@@H]2CCOC2)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819447760	GI	On-Demand	Anodyne	EPHX2	26	42
O=C(CCNc1ccc(O[C@H]2CCOC2)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819447761	GI	On-Demand	Anodyne	EPHX2	26	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000819447798	FD	On-Demand	Anodyne	PAPA1_CARPA	29	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000819447798	FD	On-Demand	Anodyne	YARS	63	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1ccc(O)cc1	ZINC000819447798	FD	On-Demand	Anodyne	FPR1	43	34
N#CCc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819447805	FF	On-Demand	Mild	ADRB1	43	39
N#CCc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819447806	FF	On-Demand	Mild	ADRB1	43	39
N#CCc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819447807	FF	On-Demand	Mild	ADRB1	43	39
N#CCc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819447808	FF	On-Demand	Mild	ADRB1	43	39
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)c1	ZINC000819447813	FF	On-Demand	Anodyne	ADRB2	18	43
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)c1	ZINC000819447813	FF	On-Demand	Anodyne	ADRB1	41	37
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)c1	ZINC000819447814	FF	On-Demand	Anodyne	ADRB2	18	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)c1	ZINC000819447814	FF	On-Demand	Anodyne	ADRB1	41	37
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)c1	ZINC000819447815	FF	On-Demand	Anodyne	ADRB2	18	43
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)c1	ZINC000819447815	FF	On-Demand	Anodyne	ADRB1	41	37
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)c1	ZINC000819447816	FF	On-Demand	Anodyne	ADRB2	18	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)c1	ZINC000819447816	FF	On-Demand	Anodyne	ADRB1	41	37
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccccc1	ZINC000819447850	EF	On-Demand	Anodyne	ADRB2	44	45
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccccc1	ZINC000819447850	EF	On-Demand	Anodyne	ADRB1	67	41
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccccc1	ZINC000819447850	EF	On-Demand	Anodyne	ADRB3	45	41
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccccc1	ZINC000819447851	EF	On-Demand	Anodyne	ADRB2	44	45
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccccc1	ZINC000819447851	EF	On-Demand	Anodyne	ADRB1	67	41
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccccc1	ZINC000819447851	EF	On-Demand	Anodyne	ADRB3	45	41
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccccc1	ZINC000819447852	EF	On-Demand	Anodyne	ADRB2	44	45
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccccc1	ZINC000819447852	EF	On-Demand	Anodyne	ADRB1	67	41
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccccc1	ZINC000819447852	EF	On-Demand	Anodyne	ADRB3	45	41
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccccc1	ZINC000819447853	EF	On-Demand	Anodyne	ADRB2	44	45
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccccc1	ZINC000819447853	EF	On-Demand	Anodyne	ADRB1	67	41
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccccc1	ZINC000819447853	EF	On-Demand	Anodyne	ADRB3	45	41
O[C@@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1ccccc1Cl	ZINC000819447860	FI	On-Demand	Anodyne	TNK2	28	40
O[C@@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1ccccc1Cl	ZINC000819447861	FI	On-Demand	Anodyne	TNK2	28	40
Cc1ccc(NC[C@H](O)COc2ccccc2Cl)c(OCCN(C)C)c1	ZINC000819447871	GG	On-Demand	Anodyne	ADRB2	20	46
Cc1ccc(NC[C@@H](O)COc2ccccc2Cl)c(OCCN(C)C)c1	ZINC000819447872	GG	On-Demand	Anodyne	ADRB2	20	46
O[C@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1ccc(F)cc1F	ZINC000819447893	FH	On-Demand	Anodyne	TNK2	22	41
O[C@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1ccc(F)cc1F	ZINC000819447894	FH	On-Demand	Anodyne	TNK2	22	41
O[C@@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1ccc(F)cc1F	ZINC000819447895	FH	On-Demand	Anodyne	TNK2	22	41
O[C@@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1ccc(F)cc1F	ZINC000819447896	FH	On-Demand	Anodyne	TNK2	22	41
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccccc1F	ZINC000819447904	EF	On-Demand	Anodyne	ADRB1	43	32
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccccc1F	ZINC000819447905	EF	On-Demand	Anodyne	ADRB1	43	32
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccccc1F	ZINC000819447906	EF	On-Demand	Anodyne	ADRB1	43	32
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccccc1F	ZINC000819447907	EF	On-Demand	Anodyne	ADRB1	43	32
O[C@@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)C1CC1	ZINC000819447919	CF	On-Demand	Anodyne	TNK2	28	44
O[C@@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)C1CC1	ZINC000819447920	CF	On-Demand	Anodyne	TNK2	28	44
O[C@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)C1CC1	ZINC000819447921	CF	On-Demand	Anodyne	TNK2	28	44
O[C@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)C1CC1	ZINC000819447922	CF	On-Demand	Anodyne	TNK2	28	44
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1cccc2ccccc12	ZINC000819447927	GH	On-Demand	Anodyne	ADRB2	27	49
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1cccc2ccccc12	ZINC000819447927	GH	On-Demand	Anodyne	ADRB1	41	49
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1cccc2ccccc12	ZINC000819447927	GH	On-Demand	Anodyne	ADRB3	15	49
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1cccc2ccccc12	ZINC000819447927	GH	On-Demand	Anodyne	CYP2D6	21	43
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1cccc2ccccc12	ZINC000819447928	GH	On-Demand	Anodyne	ADRB2	27	49
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1cccc2ccccc12	ZINC000819447928	GH	On-Demand	Anodyne	ADRB1	41	49
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1cccc2ccccc12	ZINC000819447928	GH	On-Demand	Anodyne	ADRB3	15	49
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1cccc2ccccc12	ZINC000819447928	GH	On-Demand	Anodyne	CYP2D6	21	43
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1cccc2ccccc12	ZINC000819447929	GH	On-Demand	Anodyne	ADRB2	27	49
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1cccc2ccccc12	ZINC000819447929	GH	On-Demand	Anodyne	ADRB1	41	49
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1cccc2ccccc12	ZINC000819447929	GH	On-Demand	Anodyne	ADRB3	15	49
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1cccc2ccccc12	ZINC000819447929	GH	On-Demand	Anodyne	CYP2D6	21	43
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1cccc2ccccc12	ZINC000819447930	GH	On-Demand	Anodyne	ADRB2	27	49
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1cccc2ccccc12	ZINC000819447930	GH	On-Demand	Anodyne	ADRB1	41	49
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1cccc2ccccc12	ZINC000819447930	GH	On-Demand	Anodyne	ADRB3	15	49
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1cccc2ccccc12	ZINC000819447930	GH	On-Demand	Anodyne	CYP2D6	21	43
O[C@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1ccc(F)c(F)c1	ZINC000819447944	FH	On-Demand	Anodyne	TNK2	22	42
O[C@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1ccc(F)c(F)c1	ZINC000819447945	FH	On-Demand	Anodyne	TNK2	22	42
O[C@@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1ccc(F)c(F)c1	ZINC000819447946	FH	On-Demand	Anodyne	TNK2	22	42
O[C@@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1ccc(F)c(F)c1	ZINC000819447947	FH	On-Demand	Anodyne	TNK2	22	42
O[C@@H](CNc1ccc(COC2CCCC2)cc1)c1cccnc1	ZINC000819447962	DH	On-Demand	Anodyne	ADRB2	30	40
O[C@@H](CNc1ccc(COC2CCCC2)cc1)c1cccnc1	ZINC000819447962	DH	On-Demand	Anodyne	ADRB1	33	47
O[C@@H](CNc1ccc(COC2CCCC2)cc1)c1cccnc1	ZINC000819447962	DH	On-Demand	Anodyne	ADRB3	105	49
O[C@H](CNc1ccc(COC2CCCC2)cc1)c1cccnc1	ZINC000819447963	DH	On-Demand	Anodyne	ADRB2	30	40
O[C@H](CNc1ccc(COC2CCCC2)cc1)c1cccnc1	ZINC000819447963	DH	On-Demand	Anodyne	ADRB1	33	47
O[C@H](CNc1ccc(COC2CCCC2)cc1)c1cccnc1	ZINC000819447963	DH	On-Demand	Anodyne	ADRB3	105	49
O[C@@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1ccc(F)cc1	ZINC000819447972	EH	On-Demand	Anodyne	TNK2	24	42
O[C@@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1ccc(F)cc1	ZINC000819447973	EH	On-Demand	Anodyne	TNK2	24	42
O[C@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1ccc(F)cc1	ZINC000819447974	EH	On-Demand	Anodyne	TNK2	24	42
O[C@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1ccc(F)cc1	ZINC000819447975	EH	On-Demand	Anodyne	TNK2	24	42
O[C@@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1ccc(Cl)cc1	ZINC000819447976	FI	On-Demand	Anodyne	TNK2	24	42
O[C@@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1ccc(Cl)cc1	ZINC000819447977	FI	On-Demand	Anodyne	TNK2	24	42
O=C(CCNc1ccc(O[C@@H]2CCOC2)cc1)Nc1cccc(Cl)c1	ZINC000819447993	FH	On-Demand	Anodyne	EPHX2	21	44
O=C(CCNc1ccc(O[C@H]2CCOC2)cc1)Nc1cccc(Cl)c1	ZINC000819447994	FH	On-Demand	Anodyne	EPHX2	21	44
Cc1ccc(NC[C@@H](O)COc2ccccc2C)c(OCCN(C)C)c1	ZINC000819448055	FG	On-Demand	Anodyne	ADRB2	22	49
Cc1ccc(NC[C@H](O)COc2ccccc2C)c(OCCN(C)C)c1	ZINC000819448056	FG	On-Demand	Anodyne	ADRB2	22	49
Cc1ccc(OC[C@@H](O)CNc2ccc(OC3CCOCC3)c(C)c2)cc1	ZINC000819448057	FH	On-Demand	Anodyne	ADRB2	24	45
Cc1ccc(OC[C@@H](O)CNc2ccc(OC3CCOCC3)c(C)c2)cc1	ZINC000819448057	FH	On-Demand	Anodyne	ADRB1	34	42
Cc1ccc(OC[C@H](O)CNc2ccc(OC3CCOCC3)c(C)c2)cc1	ZINC000819448058	FH	On-Demand	Anodyne	ADRB2	24	45
Cc1ccc(OC[C@H](O)CNc2ccc(OC3CCOCC3)c(C)c2)cc1	ZINC000819448058	FH	On-Demand	Anodyne	ADRB1	34	42
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819448063	EH	On-Demand	Anodyne	ADRB1	28	44
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819448063	EH	On-Demand	Anodyne	ADRB3	42	44
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819448063	EH	On-Demand	Anodyne	CYP3A4	49	36
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819448064	EH	On-Demand	Anodyne	ADRB1	28	44
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819448064	EH	On-Demand	Anodyne	ADRB3	42	44
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819448064	EH	On-Demand	Anodyne	CYP3A4	49	36
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819448065	EH	On-Demand	Anodyne	ADRB1	28	44
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819448065	EH	On-Demand	Anodyne	ADRB3	42	44
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819448065	EH	On-Demand	Anodyne	CYP3A4	49	36
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819448066	EH	On-Demand	Anodyne	ADRB1	28	44
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819448066	EH	On-Demand	Anodyne	ADRB3	42	44
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819448066	EH	On-Demand	Anodyne	CYP3A4	49	36
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)c(C)c1	ZINC000819448087	FG	On-Demand	Anodyne	ADRB2	15	42
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)c(C)c1	ZINC000819448087	FG	On-Demand	Anodyne	ADRB1	19	41
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)c(C)c1	ZINC000819448088	FG	On-Demand	Anodyne	ADRB2	15	42
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)c(C)c1	ZINC000819448088	FG	On-Demand	Anodyne	ADRB1	19	41
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)c(C)c1	ZINC000819448089	FG	On-Demand	Anodyne	ADRB2	15	42
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)c(C)c1	ZINC000819448089	FG	On-Demand	Anodyne	ADRB1	19	41
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)c(C)c1	ZINC000819448090	FG	On-Demand	Anodyne	ADRB2	15	42
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)c(C)c1	ZINC000819448090	FG	On-Demand	Anodyne	ADRB1	19	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CO)Cc1ccc(O)cc1)C2	ZINC000819448118	FD	On-Demand	Anodyne	YARS	56	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CO)Cc1ccc(O)cc1)C2	ZINC000819448119	FD	On-Demand	Anodyne	YARS	56	33
COC[C@@H](O)CNc1ccc(O[C@@H]2CCOC2)cc1	ZINC000819448132	CD	On-Demand	Anodyne	ADRB1	15	40
COC[C@@H](O)CNc1ccc(O[C@H]2CCOC2)cc1	ZINC000819448133	CD	On-Demand	Anodyne	ADRB1	15	40
OC1(CNc2ccc(NC[C@@H]3CCCO3)c(F)c2)CCCCC1	ZINC000819448170	DH	On-Demand	Anodyne	TNK2	26	43
OC1(CNc2ccc(NC[C@H]3CCCO3)c(F)c2)CCCCC1	ZINC000819448171	DH	On-Demand	Anodyne	TNK2	26	43
O[C@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1ccccc1F	ZINC000819448184	EH	On-Demand	Anodyne	TNK2	35	42
O[C@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1ccccc1F	ZINC000819448185	EH	On-Demand	Anodyne	TNK2	35	42
O[C@@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1ccccc1F	ZINC000819448186	EH	On-Demand	Anodyne	TNK2	35	42
O[C@@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1ccccc1F	ZINC000819448187	EH	On-Demand	Anodyne	TNK2	35	42
Cc1ccccc1[C@@H](O)CNc1ccc(NC[C@@H]2CCCO2)c(F)c1	ZINC000819448227	EH	On-Demand	Anodyne	TNK2	34	41
Cc1ccccc1[C@@H](O)CNc1ccc(NC[C@H]2CCCO2)c(F)c1	ZINC000819448230	EH	On-Demand	Anodyne	TNK2	34	41
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)c1cccnc1	ZINC000819448240	DE	On-Demand	Anodyne	ADRB3	76	41
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)c1cccnc1	ZINC000819448241	DE	On-Demand	Anodyne	ADRB3	76	41
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)c1cccnc1	ZINC000819448242	DE	On-Demand	Anodyne	ADRB3	76	41
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)c1cccnc1	ZINC000819448243	DE	On-Demand	Anodyne	ADRB3	76	41
O[C@@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1ccccc1	ZINC000819448259	EH	On-Demand	Anodyne	TNK2	44	38
O[C@@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1ccccc1	ZINC000819448260	EH	On-Demand	Anodyne	TNK2	44	38
O[C@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1ccccc1	ZINC000819448261	EH	On-Demand	Anodyne	TNK2	44	38
O[C@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1ccccc1	ZINC000819448262	EH	On-Demand	Anodyne	TNK2	44	38
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccc(Cl)cc1	ZINC000819448297	FG	On-Demand	Anodyne	ADRB1	37	43
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccc(Cl)cc1	ZINC000819448298	FG	On-Demand	Anodyne	ADRB1	37	43
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccc(Cl)cc1	ZINC000819448299	FG	On-Demand	Anodyne	ADRB1	37	43
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccc(Cl)cc1	ZINC000819448300	FG	On-Demand	Anodyne	ADRB1	37	43
CCOC(=O)CCc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819448305	FG	On-Demand	Bother	ADRB2	24	41
CCOC(=O)CCc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819448305	FG	On-Demand	Bother	CACNA1C	60	38
CCOC(=O)CCc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819448305	FG	On-Demand	Bother	ADRB3	47	39
CCOC(=O)CCc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819448305	FG	On-Demand	Bother	CACNA1D	91	38
CCOC(=O)CCc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819448306	FG	On-Demand	Bother	ADRB2	24	41
CCOC(=O)CCc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819448306	FG	On-Demand	Bother	CACNA1C	60	38
CCOC(=O)CCc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819448306	FG	On-Demand	Bother	ADRB3	47	39
CCOC(=O)CCc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819448306	FG	On-Demand	Bother	CACNA1D	91	38
O[C@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1ccc(F)cn1	ZINC000819448311	EG	On-Demand	Anodyne	TNK2	36	45
O[C@@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1ccc(F)cn1	ZINC000819448312	EG	On-Demand	Anodyne	TNK2	36	45
O[C@@H](CNc1ccc(NC[C@@H]2CCCO2)c(F)c1)c1ccc(F)cn1	ZINC000819448313	EG	On-Demand	Anodyne	TNK2	36	45
O[C@H](CNc1ccc(NC[C@H]2CCCO2)c(F)c1)c1ccc(F)cn1	ZINC000819448314	EG	On-Demand	Anodyne	TNK2	36	45
O[C@@H](CNc1ccc(COC2CCCC2)cc1)c1ccccc1	ZINC000819448340	DI	On-Demand	Anodyne	ADRB1	23	43
O[C@@H](CNc1ccc(COC2CCCC2)cc1)c1ccccc1	ZINC000819448340	DI	On-Demand	Anodyne	ADRB3	46	43
O[C@H](CNc1ccc(COC2CCCC2)cc1)c1ccccc1	ZINC000819448341	DI	On-Demand	Anodyne	ADRB1	23	43
O[C@H](CNc1ccc(COC2CCCC2)cc1)c1ccccc1	ZINC000819448341	DI	On-Demand	Anodyne	ADRB3	46	43
CCOc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819448369	FG	On-Demand	Anodyne	ADRB2	26	40
CCOc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819448369	FG	On-Demand	Anodyne	ADRB1	43	40
CCOc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819448370	FG	On-Demand	Anodyne	ADRB2	26	40
CCOc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819448370	FG	On-Demand	Anodyne	ADRB1	43	40
CCOc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819448371	FG	On-Demand	Anodyne	ADRB2	26	40
CCOc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819448371	FG	On-Demand	Anodyne	ADRB1	43	40
CCOc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819448372	FG	On-Demand	Anodyne	ADRB2	26	40
CCOc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819448372	FG	On-Demand	Anodyne	ADRB1	43	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819448384	FF	On-Demand	Anodyne	ADRB2	23	44
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819448384	FF	On-Demand	Anodyne	ADRB1	49	44
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819448385	FF	On-Demand	Anodyne	ADRB2	23	44
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819448385	FF	On-Demand	Anodyne	ADRB1	49	44
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819448386	FF	On-Demand	Anodyne	ADRB2	23	44
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819448386	FF	On-Demand	Anodyne	ADRB1	49	44
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819448387	FF	On-Demand	Anodyne	ADRB2	23	44
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819448387	FF	On-Demand	Anodyne	ADRB1	49	44
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819448404	GF	On-Demand	Anodyne	ADRB2	32	56
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819448404	GF	On-Demand	Anodyne	ADRB1	64	56
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819448404	GF	On-Demand	Anodyne	ADRB3	36	46
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819448405	GF	On-Demand	Anodyne	ADRB2	32	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819448405	GF	On-Demand	Anodyne	ADRB1	64	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819448405	GF	On-Demand	Anodyne	ADRB3	36	46
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819448406	GF	On-Demand	Anodyne	ADRB2	32	56
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819448406	GF	On-Demand	Anodyne	ADRB1	64	56
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000819448406	GF	On-Demand	Anodyne	ADRB3	36	46
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819448407	GF	On-Demand	Anodyne	ADRB2	32	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819448407	GF	On-Demand	Anodyne	ADRB1	64	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000819448407	GF	On-Demand	Anodyne	ADRB3	36	46
O=C(CCNc1ccc(O[C@@H]2CCOC2)cc1)Nc1ccccc1	ZINC000819448410	EG	On-Demand	Anodyne	LTA4H	37	40
O=C(CCNc1ccc(O[C@H]2CCOC2)cc1)Nc1ccccc1	ZINC000819448411	EG	On-Demand	Anodyne	LTA4H	37	40
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819448414	GI	On-Demand	Anodyne	HRH1	21	42
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819448414	GI	On-Demand	Anodyne	GRIN1	25	41
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819448414	GI	On-Demand	Anodyne	CCR3	22	42
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819448415	GI	On-Demand	Anodyne	HRH1	21	42
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819448415	GI	On-Demand	Anodyne	GRIN1	25	41
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819448415	GI	On-Demand	Anodyne	CCR3	22	42
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819448416	GI	On-Demand	Anodyne	HRH1	21	42
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819448416	GI	On-Demand	Anodyne	GRIN1	25	41
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819448416	GI	On-Demand	Anodyne	CCR3	22	42
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819448417	GI	On-Demand	Anodyne	HRH1	21	42
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819448417	GI	On-Demand	Anodyne	GRIN1	25	41
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819448417	GI	On-Demand	Anodyne	CCR3	22	42
CCOC(=O)CCc1ccc(NC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819448483	EH	On-Demand	Anodyne	LEF	44	32
CCOC(=O)CCc1ccc(NC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819448484	EH	On-Demand	Anodyne	LEF	44	32
O[C@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccc2ccccc2c1	ZINC000819448492	GH	On-Demand	Anodyne	ADRB2	24	51
O[C@@H](CNc1ccc(O[C@@H]2CCOC2)cc1)COc1ccc2ccccc2c1	ZINC000819448493	GH	On-Demand	Anodyne	ADRB2	24	51
O[C@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccc2ccccc2c1	ZINC000819448494	GH	On-Demand	Anodyne	ADRB2	24	51
O[C@@H](CNc1ccc(O[C@H]2CCOC2)cc1)COc1ccc2ccccc2c1	ZINC000819448495	GH	On-Demand	Anodyne	ADRB2	24	51
O=C(O)CCCNC(=O)Nc1cccc(N2CCCCC2)c1	ZINC000819448509	DF	On-Demand	Anodyne	HRH2	39	48
O=C(O)CCCNC(=O)Nc1cccc(N2CCCCC2)c1	ZINC000819448509	DF	On-Demand	Anodyne	NPY1R	22	41
O=C(O)CCCNC(=O)Nc1cccc(N2CCCCC2)c1	ZINC000819448509	DF	On-Demand	Anodyne	CCR3	38	41
O=C(O)CCCNC(=O)Nc1cccc(N2CCCCC2)c1	ZINC000819448509	DF	On-Demand	Anodyne	EPHX2	28	45
O=C(O)CCCNC(=O)c1ccc(CSc2nc3ccccc3[nH]2)cc1	ZINC000819448510	FG	On-Demand	Anodyne	CYP2C19	24	42
O=C(O)CCCNC(=O)Nc1cnn(-c2ccccc2F)c1	ZINC000819448512	DD	On-Demand	Anodyne	FOLH1	18	40
O=C(O)CCCNC(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O	ZINC000819448513	EE	On-Demand	Anodyne	FOLH1	20	42
O=C(O)CCCNC(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O	ZINC000819448513	EE	On-Demand	Anodyne	PTGER3	15	48
O=C(O)CCCNC(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O	ZINC000819448513	EE	On-Demand	Anodyne	CCR3	31	42
O=C(O)CCCNC(=O)c1cc(I)ccc1F	ZINC000819448515	FE	On-Demand	Anodyne	FOLH1	40	40
O=C(O)CCCNC(=O)Nc1cccnc1N1CCCC1	ZINC000819448517	CD	On-Demand	Anodyne	KCNQ2	69	36
O=C(O)CCCNC(=O)Nc1cccn(Cc2ccccc2)c1=O	ZINC000819448524	ED	On-Demand	Anodyne	PTGER3	16	53
O=C(O)CCCNC(=O)Nc1cnn(CC(=O)NC2CCCC2)c1	ZINC000819448525	EC	On-Demand	Anodyne	EPHX2	21	45
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)c2cccs2)c1	ZINC000819448526	EF	On-Demand	Anodyne	NOS1	18	40
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)c2cccs2)c1	ZINC000819448526	EF	On-Demand	Anodyne	KCNK3	87	60
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)c2cccs2)c1	ZINC000819448526	EF	On-Demand	Anodyne	KCNK9	68	60
O=C(O)CCCNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl	ZINC000819448528	GC	On-Demand	Anodyne	NAMPT	22	41
O=C(O)CCCNC(=O)Nc1cccc(Cn2nc3ccccn3c2=O)c1	ZINC000819448530	FD	On-Demand	Anodyne	HRH2	39	41
O=C(O)CCCNC(=O)c1cc(F)cc(Cl)c1O	ZINC000819448535	CD	On-Demand	Anodyne	AKR1C1	41	35
C#CCNC(=O)CCNc1ccc(OC2CCCC2)c(F)c1	ZINC000819448556	DF	On-Demand	Mild	PDE4A	18	40
CNC(=O)Cn1nc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)cc1C	ZINC000819448561	FC	On-Demand	Anodyne	PTGER1	15	43
O=C(O)CCCNC(=O)Nc1ccccc1CN1CCOCC1	ZINC000819448564	DD	On-Demand	Anodyne	CCR3	21	45
O=C(O)CCCNC(=O)Nc1ccccc1CN1CCOCC1	ZINC000819448564	DD	On-Demand	Anodyne	EPHX2	21	42
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819448565	EF	On-Demand	Anodyne	PPIA	29	45
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819448565	EF	On-Demand	Anodyne	CCR3	26	42
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819448565	EF	On-Demand	Anodyne	PRNP	23	48
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819448565	EF	On-Demand	Anodyne	HDAC10	15	44
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819448565	EF	On-Demand	Anodyne	HDAC1	21	44
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819448565	EF	On-Demand	Anodyne	HDAC2	20	44
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819448565	EF	On-Demand	Anodyne	HDAC6	17	45
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819448565	EF	On-Demand	Anodyne	EPHX2	24	61
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819448565	EF	On-Demand	Anodyne	KCNK3	148	55
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)c2ccccc2)c1	ZINC000819448565	EF	On-Demand	Anodyne	KCNK9	95	52
O=C(O)CCCNC(=O)c1c(O)cc(Cl)cc1Cl	ZINC000819448567	CE	On-Demand	Anodyne	ALPL	48	38
O=C(O)CCCNC(=O)Nc1cnn(CCN2CCOCC2)c1	ZINC000819448569	EC	On-Demand	Anodyne	EPHX2	24	44
O=C(O)CCCNC(=O)Nc1cccnc1Oc1ccccc1	ZINC000819448572	DF	On-Demand	Anodyne	P2RY1	57	49
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)c2ccccc2F)cc1	ZINC000819448573	FJ	On-Demand	Anodyne	PAPA1_CARPA	28	43
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)c2ccccc2F)cc1	ZINC000819448573	FJ	On-Demand	Anodyne	FPR1	44	36
O=C(O)CCCNC(=O)Nc1cnc(Br)c(Br)c1	ZINC000819448574	GF	On-Demand	Anodyne	FOLH1	20	40
O=C(O)CCCNC(=O)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000819448576	EG	On-Demand	Anodyne	HRH2	37	45
O=C(O)CCCNC(=O)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000819448576	EG	On-Demand	Anodyne	FOLH1	18	44
O=C(O)CCCNC(=O)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000819448576	EG	On-Demand	Anodyne	LTA4H	15	45
O=C(O)CCCNC(=O)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000819448576	EG	On-Demand	Anodyne	PTGER3	58	40
O=C(O)CCCNC(=O)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000819448576	EG	On-Demand	Anodyne	CCR3	70	50
O=C(O)CCCNC(=O)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000819448576	EG	On-Demand	Anodyne	EPHX2	32	45
O=C(O)CCCNC(=O)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000819448576	EG	On-Demand	Anodyne	FFAR1	53	45
O=C(O)CCCNC(=O)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000819448576	EG	On-Demand	Anodyne	FFAR4	42	39
O=C(O)CCCNC(=O)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000819448576	EG	On-Demand	Anodyne	PDS	40	35
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)c2ccccc2F)cc1	ZINC000819448577	FJ	On-Demand	Anodyne	PAPA1_CARPA	28	43
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)c2ccccc2F)cc1	ZINC000819448577	FJ	On-Demand	Anodyne	FPR1	44	36
O=C(O)CCCNC(=O)Nc1ccn(CCN2CCOCC2)n1	ZINC000819448582	EC	On-Demand	Anodyne	EPHX2	20	40
Cc1ccccc1[C@@H](O)CNc1ccc(N2CCC(O)CC2)c(C#N)c1	ZINC000819448585	FF	On-Demand	Mild	AR	16	41
O=C(O)CCCNC(=O)Nc1ccnc(Oc2ccccc2)c1	ZINC000819448586	DF	On-Demand	Anodyne	HRH2	21	40
O=C(O)CCCNC(=O)Nc1ccnc(Oc2ccccc2)c1	ZINC000819448586	DF	On-Demand	Anodyne	LTA4H	17	44
O=C(O)CCCNC(=O)Nc1ccnc(Oc2ccccc2)c1	ZINC000819448586	DF	On-Demand	Anodyne	CA1	32	40
O=C(O)CCCNC(=O)Nc1ccccc1COc1ccccc1	ZINC000819448588	EG	On-Demand	Anodyne	FOLH1	18	42
O=C(O)CCCNC(=O)Nc1ccccc1COc1ccccc1	ZINC000819448588	EG	On-Demand	Anodyne	LTA4H	21	43
O=C(O)CCCNC(=O)Nc1ccccc1COc1ccccc1	ZINC000819448588	EG	On-Demand	Anodyne	FFAR1	30	44
O=C(O)CCCNC(=O)Nc1ccccc1COc1ccccc1	ZINC000819448588	EG	On-Demand	Anodyne	FFAR4	54	42
O=C(O)CCCNC(=O)Nc1ccccc1CN1CCSCC1	ZINC000819448590	EE	On-Demand	Anodyne	CCR3	22	46
N#Cc1cc(NCCC(=O)Nc2ccccc2F)ccc1N1CCC(O)CC1	ZINC000819448591	GG	On-Demand	Mild	NPY2R	60	37
O=C(O)CCCNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000819448594	FC	On-Demand	Anodyne	PKM	42	39
O=C(O)CCCNC(=O)Nc1cccnc1OCc1ccccc1	ZINC000819448598	EF	On-Demand	Anodyne	PPIA	45	47
O=C(O)CCCNC(=O)Nc1cccnc1OCc1ccccc1	ZINC000819448598	EF	On-Demand	Anodyne	P2RY1	43	39
O=C(O)CCCNC(=O)Nc1ncc(-c2ccccc2)s1	ZINC000819448600	DF	On-Demand	Anodyne	ADRB1	41	31
O=C(O)CCCNC(=O)Nc1ncc(-c2ccccc2)s1	ZINC000819448600	DF	On-Demand	Anodyne	PI4KB	16	41
O=C(O)CCCNC(=O)Nc1ncc(-c2ccccc2)s1	ZINC000819448600	DF	On-Demand	Anodyne	CDK5	30	42
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819448602	FG	On-Demand	Anodyne	HRH2	15	45
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819448602	FG	On-Demand	Anodyne	FOLH1	24	43
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819448602	FG	On-Demand	Anodyne	CA1	41	42
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819448602	FG	On-Demand	Anodyne	CCKAR	16	46
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819448602	FG	On-Demand	Anodyne	CCR3	34	45
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819448602	FG	On-Demand	Anodyne	HDAC10	17	40
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819448602	FG	On-Demand	Anodyne	HDAC2	15	40
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819448602	FG	On-Demand	Anodyne	HDAC3	15	40
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819448602	FG	On-Demand	Anodyne	EPHX2	34	59
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819448602	FG	On-Demand	Anodyne	CA12	18	48
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819448602	FG	On-Demand	Anodyne	CA9	18	42
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819448602	FG	On-Demand	Anodyne	NCE103	19	41
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819448602	FG	On-Demand	Anodyne	P96878_MYCTU	17	40
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819448602	FG	On-Demand	Anodyne	KCNK3	97	39
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819448602	FG	On-Demand	Anodyne	KCNK9	73	37
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)c2ccoc2)c1	ZINC000819448605	EF	On-Demand	Anodyne	KCNK3	112	63
O=C(O)CCCNC(=O)Nc1cccc(NC(=O)c2ccoc2)c1	ZINC000819448605	EF	On-Demand	Anodyne	KCNK9	69	38
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819448606	EG	On-Demand	Anodyne	HRH2	41	46
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819448606	EG	On-Demand	Anodyne	MAOB	26	42
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819448606	EG	On-Demand	Anodyne	FOLH1	17	41
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819448606	EG	On-Demand	Anodyne	ERBB2	22	42
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819448606	EG	On-Demand	Anodyne	PTGER4	17	41
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819448606	EG	On-Demand	Anodyne	PTGER3	56	41
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819448606	EG	On-Demand	Anodyne	DRTS_LEIMA	17	40
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819448606	EG	On-Demand	Anodyne	CCR3	46	44
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819448606	EG	On-Demand	Anodyne	EPHX2	24	44
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819448606	EG	On-Demand	Anodyne	FFAR1	56	44
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819448606	EG	On-Demand	Anodyne	FFAR4	21	40
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000819448606	EG	On-Demand	Anodyne	PDS	45	40
O=C(O)CCCNC(=O)Nc1cccc(S(=O)(=O)Nc2nccs2)c1	ZINC000819448608	GD	On-Demand	Anodyne	MAP1	51	33
O=C(O)CCCNC(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000819448615	DF	On-Demand	Anodyne	HRH2	32	42
O=C(O)CCCNC(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000819448615	DF	On-Demand	Anodyne	CA1	28	42
O=C(O)CCCNC(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000819448615	DF	On-Demand	Anodyne	CCR3	23	42
O=C(O)CCCNC(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000819448615	DF	On-Demand	Anodyne	EPHX2	16	42
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819448616	EF	On-Demand	Anodyne	HRH2	41	45
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819448616	EF	On-Demand	Anodyne	PPIA	41	43
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819448616	EF	On-Demand	Anodyne	TBXA2R	34	40
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819448616	EF	On-Demand	Anodyne	TBXAS1	91	44
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819448616	EF	On-Demand	Anodyne	CCR3	25	43
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819448616	EF	On-Demand	Anodyne	CHRNA7	20	41
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819448616	EF	On-Demand	Anodyne	EPHX2	22	41
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819448616	EF	On-Demand	Anodyne	FFAR1	33	41
O=C(O)CCCNC(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819448616	EF	On-Demand	Anodyne	NAMPT	50	47
O=C(O)CCCNC(=O)Nc1cccc(Cn2cncn2)c1	ZINC000819448623	DD	On-Demand	Anodyne	HRH2	41	44
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819448637	FI	On-Demand	Anodyne	ADRB2	16	45
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819448637	FI	On-Demand	Anodyne	PAPA1_CARPA	36	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819448637	FI	On-Demand	Anodyne	CTSK	42	49
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819448637	FI	On-Demand	Anodyne	CTSL	19	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819448637	FI	On-Demand	Anodyne	TACR3	15	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819448637	FI	On-Demand	Anodyne	REN	33	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819448637	FI	On-Demand	Anodyne	CTSS	15	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819448637	FI	On-Demand	Anodyne	FPR1	49	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819448638	FI	On-Demand	Anodyne	ADRB2	16	45
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819448638	FI	On-Demand	Anodyne	PAPA1_CARPA	36	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819448638	FI	On-Demand	Anodyne	CTSK	42	49
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819448638	FI	On-Demand	Anodyne	CTSL	19	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819448638	FI	On-Demand	Anodyne	TACR3	15	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819448638	FI	On-Demand	Anodyne	REN	33	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819448638	FI	On-Demand	Anodyne	CTSS	15	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819448638	FI	On-Demand	Anodyne	FPR1	49	40
C[C@H]1C[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819448651	FF	On-Demand	Mild	PAPA1_CARPA	39	48
C[C@@H]1CC(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819448652	FF	On-Demand	Mild	PAPA1_CARPA	39	48
C[C@@H]1CC(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819448653	FF	On-Demand	Mild	PAPA1_CARPA	39	48
C[C@H]1C[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@@H](C)O1	ZINC000819448654	FF	On-Demand	Mild	PAPA1_CARPA	39	48
N#Cc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1N1CCC(O)CC1	ZINC000819448657	FG	On-Demand	Mild	ADRB1	24	40
N#Cc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1N1CCC(O)CC1	ZINC000819448657	FG	On-Demand	Mild	ADRB3	38	40
N#Cc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1N1CCC(O)CC1	ZINC000819448657	FG	On-Demand	Mild	IGF1R	29	45
N#Cc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1N1CCC(O)CC1	ZINC000819448657	FG	On-Demand	Mild	CYP3A4	52	45
N#Cc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1N1CCC(O)CC1	ZINC000819448658	FG	On-Demand	Mild	ADRB1	24	40
N#Cc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1N1CCC(O)CC1	ZINC000819448658	FG	On-Demand	Mild	ADRB3	38	40
N#Cc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1N1CCC(O)CC1	ZINC000819448658	FG	On-Demand	Mild	IGF1R	29	45
N#Cc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1N1CCC(O)CC1	ZINC000819448658	FG	On-Demand	Mild	CYP3A4	52	45
C#CCOc1ccc(F)cc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819448668	FF	On-Demand	Mild	ADRB2	23	40
C#CCOc1ccc(F)cc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819448668	FF	On-Demand	Mild	ADRB1	48	33
C#CCOc1ccc(F)cc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819448669	FF	On-Demand	Mild	ADRB2	23	40
C#CCOc1ccc(F)cc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819448669	FF	On-Demand	Mild	ADRB1	48	33
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC(C)C)c(C)c2)c1	ZINC000819448671	FH	On-Demand	Anodyne	ADRB2	32	47
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC(C)C)c(C)c2)c1	ZINC000819448671	FH	On-Demand	Anodyne	ADRB1	53	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC(C)C)c(C)c2)c1	ZINC000819448671	FH	On-Demand	Anodyne	ABCB1	21	46
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC(C)C)c(C)c2)c1	ZINC000819448672	FH	On-Demand	Anodyne	ADRB2	32	47
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC(C)C)c(C)c2)c1	ZINC000819448672	FH	On-Demand	Anodyne	ADRB1	53	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC(C)C)c(C)c2)c1	ZINC000819448672	FH	On-Demand	Anodyne	ABCB1	21	46
O[C@@H](CNc1ccc(CC(F)(F)F)cc1)c1ccccc1	ZINC000819448701	CH	On-Demand	Anodyne	ADRB2	17	61
O[C@@H](CNc1ccc(CC(F)(F)F)cc1)c1ccccc1	ZINC000819448701	CH	On-Demand	Anodyne	ADRB3	25	44
O[C@H](CNc1ccc(CC(F)(F)F)cc1)c1ccccc1	ZINC000819448702	CH	On-Demand	Anodyne	ADRB2	17	61
O[C@H](CNc1ccc(CC(F)(F)F)cc1)c1ccccc1	ZINC000819448702	CH	On-Demand	Anodyne	ADRB3	25	44
CON(C)C(=O)CCNc1ccc(COCc2ccccc2)cc1	ZINC000819448735	EG	On-Demand	Anodyne	PTPRB	26	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)c(C)c2)cc1	ZINC000819448737	FH	On-Demand	Anodyne	ADRB2	37	46
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)c(C)c2)cc1	ZINC000819448737	FH	On-Demand	Anodyne	ADRB1	57	46
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC(C)C)c(C)c2)cc1	ZINC000819448738	FH	On-Demand	Anodyne	ADRB2	37	46
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC(C)C)c(C)c2)cc1	ZINC000819448738	FH	On-Demand	Anodyne	ADRB1	57	46
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc(CC(F)(F)F)cc1	ZINC000819448756	FG	On-Demand	Anodyne	PTPRB	36	42
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc(CC(F)(F)F)cc1	ZINC000819448757	FG	On-Demand	Anodyne	PTPRB	36	42
C#CCOc1ccc(F)cc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819448758	GG	On-Demand	Mild	GPR119	50	51
C#CCOc1ccc(F)cc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819448759	GG	On-Demand	Mild	GPR119	50	51
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc(OC(C)C)c(C)c1	ZINC000819448765	GH	On-Demand	Anodyne	ADRB2	27	40
N#Cc1cc(NC[C@H](O)c2ccccc2)ccc1N1CCC(O)CC1	ZINC000819448821	EF	On-Demand	Mild	NPY2R	47	42
N#Cc1cc(NC[C@@H](O)c2ccccc2)ccc1N1CCC(O)CC1	ZINC000819448822	EF	On-Demand	Mild	NPY2R	47	42
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1cccc(CC(F)(F)F)c1	ZINC000819448831	GF	On-Demand	Anodyne	PTPRB	32	40
N#Cc1cc(NC[C@H](O)COc2ccc(F)cc2)ccc1N1CCC(O)CC1	ZINC000819448865	GF	On-Demand	Mild	ADRB1	53	37
COc1cccc(OC)c1OC[C@H](O)CNc1ccc(OC(C)C)c(C)c1	ZINC000819448866	GH	On-Demand	Anodyne	ADRB2	27	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(CC(F)(F)F)cc1	ZINC000819448869	FG	On-Demand	Anodyne	PTPRB	38	42
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(CC(F)(F)F)cc1	ZINC000819448870	FG	On-Demand	Anodyne	PTPRB	38	42
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1ccc(CC(F)(F)F)cc1	ZINC000819448917	GF	On-Demand	Anodyne	PTPRB	71	41
C#CCOc1cc(F)ccc1NC[C@H](O)CN1CCOCC1	ZINC000819448922	DC	On-Demand	Mild	CCR1	35	41
C#CCOc1cc(F)ccc1NC[C@@H](O)CN1CCOCC1	ZINC000819448923	DC	On-Demand	Mild	CCR1	35	41
N#Cc1cc(NC[C@@H](O)COc2ccc(F)cc2)ccc1N1CCC(O)CC1	ZINC000819448966	GF	On-Demand	Mild	ADRB1	53	37
CON(C)C(=O)CCNc1ccc(OC2CCCC2)c(F)c1	ZINC000819448992	DF	On-Demand	Anodyne	PDE4D	19	41
NC(=O)NC(=O)CCNc1ccc(OC2CCCC2)c(F)c1	ZINC000819449013	DE	On-Demand	Anodyne	PDE4D	17	40
N#Cc1cc(NCCC(=O)Nc2ccccc2)ccc1N1CCC(O)CC1	ZINC000819449014	FF	On-Demand	Mild	NPY2R	72	41
N#Cc1cc(NCCC(=O)Nc2cccnc2)ccc1N1CCC(O)CC1	ZINC000819449020	FE	On-Demand	Mild	NPY2R	25	40
NC(=O)CCNc1ccc(OC2CCCC2)c(F)c1	ZINC000819449025	CE	On-Demand	Anodyne	PDE4A	35	40
NC(=O)CCNc1ccc(OC2CCCC2)c(F)c1	ZINC000819449025	CE	On-Demand	Anodyne	PDE4B	23	40
NC(=O)CCNc1ccc(OC2CCCC2)c(F)c1	ZINC000819449025	CE	On-Demand	Anodyne	PDE4D	26	43
NC(=O)CCNc1ccc(OC2CCCC2)c(F)c1	ZINC000819449025	CE	On-Demand	Anodyne	PDE4C	15	40
O[C@@H](CNc1cccc(CC(F)(F)F)c1)c1cccc(Cl)c1	ZINC000819449027	EJ	On-Demand	Anodyne	ADRB1	32	46
O[C@@H](CNc1cccc(CC(F)(F)F)c1)c1cccc(Cl)c1	ZINC000819449027	EJ	On-Demand	Anodyne	ADRB3	43	44
O[C@H](CNc1cccc(CC(F)(F)F)c1)c1cccc(Cl)c1	ZINC000819449028	EJ	On-Demand	Anodyne	ADRB1	32	46
O[C@H](CNc1cccc(CC(F)(F)F)c1)c1cccc(Cl)c1	ZINC000819449028	EJ	On-Demand	Anodyne	ADRB3	43	44
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cn2cccn2)cc1	ZINC000819449039	FF	On-Demand	Anodyne	AMP1_PLAFQ	26	43
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cn2cccn2)cc1	ZINC000819449040	FF	On-Demand	Anodyne	AMP1_PLAFQ	26	43
CS(=O)(=O)c1ccc([C@@H](O)CNc2cccc(CC(F)(F)F)c2)cc1	ZINC000819449060	FG	On-Demand	Anodyne	ADRB3	28	40
CS(=O)(=O)c1ccc([C@@H](O)CNc2cccc(CC(F)(F)F)c2)cc1	ZINC000819449060	FG	On-Demand	Anodyne	CTSF	53	35
CS(=O)(=O)c1ccc([C@H](O)CNc2cccc(CC(F)(F)F)c2)cc1	ZINC000819449061	FG	On-Demand	Anodyne	ADRB3	28	40
CS(=O)(=O)c1ccc([C@H](O)CNc2cccc(CC(F)(F)F)c2)cc1	ZINC000819449061	FG	On-Demand	Anodyne	CTSF	53	35
CCSCc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819449102	CI	On-Demand	Anodyne	ADRB2	19	45
CCSCc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819449103	CI	On-Demand	Anodyne	ADRB2	19	45
C#CCOc1cc(F)ccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819449108	GG	On-Demand	Mild	GPR119	55	51
C#CCOc1cc(F)ccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819449109	GG	On-Demand	Mild	GPR119	55	51
CON(C)C(=O)CCNc1ccc(CC(F)(F)F)cc1	ZINC000819449117	CF	On-Demand	Anodyne	PTPRB	57	38
O=C(/C=C\[C@@H]1CCCO1)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449119	DD	On-Demand	Anodyne	EDNRB	47	35
O=C(/C=C\[C@@H]1CCCO1)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449119	DD	On-Demand	Anodyne	TACR1	29	42
O=C(/C=C\[C@@H]1CCCO1)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449119	DD	On-Demand	Anodyne	CCKAR	54	43
O=C(/C=C\[C@@H]1CCCO1)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449119	DD	On-Demand	Anodyne	NMBR	41	38
O=C(/C=C\[C@@H]1CCCO1)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449119	DD	On-Demand	Anodyne	ECE1	49	38
O=C(/C=C\[C@@H]1CCCO1)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449119	DD	On-Demand	Anodyne	HDAC3	15	42
O=C(/C=C\[C@@H]1CCCO1)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449119	DD	On-Demand	Anodyne	CCKBR	56	43
O=C(/C=C\[C@@H]1CCCO1)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449119	DD	On-Demand	Anodyne	GHSR	56	45
O=C(/C=C/[C@@H]1CCCO1)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449120	DD	On-Demand	Anodyne	EDNRB	47	35
O=C(/C=C/[C@@H]1CCCO1)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449120	DD	On-Demand	Anodyne	TACR1	29	42
O=C(/C=C/[C@@H]1CCCO1)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449120	DD	On-Demand	Anodyne	CCKAR	54	43
O=C(/C=C/[C@@H]1CCCO1)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449120	DD	On-Demand	Anodyne	NMBR	41	38
O=C(/C=C/[C@@H]1CCCO1)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449120	DD	On-Demand	Anodyne	ECE1	49	38
O=C(/C=C/[C@@H]1CCCO1)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449120	DD	On-Demand	Anodyne	HDAC3	15	42
O=C(/C=C/[C@@H]1CCCO1)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449120	DD	On-Demand	Anodyne	CCKBR	56	43
O=C(/C=C/[C@@H]1CCCO1)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449120	DD	On-Demand	Anodyne	GHSR	56	45
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449121	DD	On-Demand	Anodyne	EDNRB	47	35
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449121	DD	On-Demand	Anodyne	TACR1	29	42
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449121	DD	On-Demand	Anodyne	CCKAR	54	43
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449121	DD	On-Demand	Anodyne	NMBR	41	38
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449121	DD	On-Demand	Anodyne	ECE1	49	38
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449121	DD	On-Demand	Anodyne	HDAC3	15	42
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449121	DD	On-Demand	Anodyne	CCKBR	56	43
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449121	DD	On-Demand	Anodyne	GHSR	56	45
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449122	DD	On-Demand	Anodyne	EDNRB	47	35
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449122	DD	On-Demand	Anodyne	TACR1	29	42
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449122	DD	On-Demand	Anodyne	CCKAR	54	43
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449122	DD	On-Demand	Anodyne	NMBR	41	38
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449122	DD	On-Demand	Anodyne	ECE1	49	38
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449122	DD	On-Demand	Anodyne	HDAC3	15	42
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449122	DD	On-Demand	Anodyne	CCKBR	56	43
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449122	DD	On-Demand	Anodyne	GHSR	56	45
C#CCOc1cc(F)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819449145	FF	On-Demand	Mild	ADRB2	21	43
C#CCOc1cc(F)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819449145	FF	On-Demand	Mild	ADRB1	48	38
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)C(C)(C)C)cc1	ZINC000819449146	EI	On-Demand	Anodyne	CTSK	24	40
C#CCOc1cc(F)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819449147	FF	On-Demand	Mild	ADRB2	21	43
C#CCOc1cc(F)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819449147	FF	On-Demand	Mild	ADRB1	48	38
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)C(C)(C)C)cc1	ZINC000819449152	EI	On-Demand	Anodyne	CTSK	24	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819449217	FJ	On-Demand	Anodyne	PAPA1_CARPA	31	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819449219	FJ	On-Demand	Anodyne	PAPA1_CARPA	31	42
CNC(=O)Cn1nc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819449222	GD	On-Demand	Mild	PAPA1_CARPA	35	40
CNC(=O)Cn1nc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819449223	GD	On-Demand	Mild	PAPA1_CARPA	35	40
O[C@@H](CNc1ccc(CC(F)(F)F)cc1)c1cccc(Cl)c1	ZINC000819449298	EJ	On-Demand	Anodyne	ADRB2	20	55
O[C@@H](CNc1ccc(CC(F)(F)F)cc1)c1cccc(Cl)c1	ZINC000819449298	EJ	On-Demand	Anodyne	ADRB1	33	55
O[C@@H](CNc1ccc(CC(F)(F)F)cc1)c1cccc(Cl)c1	ZINC000819449298	EJ	On-Demand	Anodyne	ADRB3	48	49
O[C@H](CNc1ccc(CC(F)(F)F)cc1)c1cccc(Cl)c1	ZINC000819449299	EJ	On-Demand	Anodyne	ADRB2	20	55
O[C@H](CNc1ccc(CC(F)(F)F)cc1)c1cccc(Cl)c1	ZINC000819449299	EJ	On-Demand	Anodyne	ADRB1	33	55
O[C@H](CNc1ccc(CC(F)(F)F)cc1)c1cccc(Cl)c1	ZINC000819449299	EJ	On-Demand	Anodyne	ADRB3	48	49
C#CCOc1ccc(F)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819449302	FF	On-Demand	Mild	ADRB2	33	53
C#CCOc1ccc(F)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819449302	FF	On-Demand	Mild	ADRB1	56	53
C#CCOc1ccc(F)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819449302	FF	On-Demand	Mild	ADRB3	30	44
C#CCOc1ccc(F)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819449303	FF	On-Demand	Mild	ADRB2	33	53
C#CCOc1ccc(F)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819449303	FF	On-Demand	Mild	ADRB1	56	53
C#CCOc1ccc(F)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819449303	FF	On-Demand	Mild	ADRB3	30	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449361	FE	On-Demand	Anodyne	ACE	18	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449361	FE	On-Demand	Anodyne	SSTR2	79	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449361	FE	On-Demand	Anodyne	EDNRB	21	50
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449361	FE	On-Demand	Anodyne	EDNRA	33	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449361	FE	On-Demand	Anodyne	TACR1	36	55
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449361	FE	On-Demand	Anodyne	CCKAR	131	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449361	FE	On-Demand	Anodyne	CTSL	24	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449361	FE	On-Demand	Anodyne	NMBR	83	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449361	FE	On-Demand	Anodyne	GRPR	89	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449361	FE	On-Demand	Anodyne	ECE1	56	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449361	FE	On-Demand	Anodyne	REN	20	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449361	FE	On-Demand	Anodyne	SSTR3	20	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449361	FE	On-Demand	Anodyne	MMP11	77	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449361	FE	On-Demand	Anodyne	CCKBR	110	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449361	FE	On-Demand	Anodyne	GHSR	62	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449361	FE	On-Demand	Anodyne	FPR1	45	50
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449362	FE	On-Demand	Anodyne	ACE	18	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449362	FE	On-Demand	Anodyne	SSTR2	79	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449362	FE	On-Demand	Anodyne	EDNRB	21	50
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449362	FE	On-Demand	Anodyne	EDNRA	33	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449362	FE	On-Demand	Anodyne	TACR1	36	55
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449362	FE	On-Demand	Anodyne	CCKAR	131	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449362	FE	On-Demand	Anodyne	CTSL	24	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449362	FE	On-Demand	Anodyne	NMBR	83	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449362	FE	On-Demand	Anodyne	GRPR	89	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449362	FE	On-Demand	Anodyne	ECE1	56	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449362	FE	On-Demand	Anodyne	REN	20	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449362	FE	On-Demand	Anodyne	SSTR3	20	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449362	FE	On-Demand	Anodyne	MMP11	77	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449362	FE	On-Demand	Anodyne	CCKBR	110	49
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449362	FE	On-Demand	Anodyne	GHSR	62	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)Cc1c[nH]c2ccccc12	ZINC000819449362	FE	On-Demand	Anodyne	FPR1	45	50
O[C@@H](CNc1ccc(OC2CCCC2)c(F)c1)c1cccnc1	ZINC000819449378	DH	On-Demand	Anodyne	ADRB1	26	49
O[C@@H](CNc1ccc(OC2CCCC2)c(F)c1)c1cccnc1	ZINC000819449378	DH	On-Demand	Anodyne	ADRB3	93	49
O[C@@H](CNc1ccc(OC2CCCC2)c(F)c1)c1cccnc1	ZINC000819449378	DH	On-Demand	Anodyne	PDE4A	32	43
O[C@H](CNc1ccc(OC2CCCC2)c(F)c1)c1cccnc1	ZINC000819449381	DH	On-Demand	Anodyne	ADRB1	26	49
O[C@H](CNc1ccc(OC2CCCC2)c(F)c1)c1cccnc1	ZINC000819449381	DH	On-Demand	Anodyne	ADRB3	93	49
O[C@H](CNc1ccc(OC2CCCC2)c(F)c1)c1cccnc1	ZINC000819449381	DH	On-Demand	Anodyne	PDE4A	32	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC=C(c3ccc(C#N)cc3)CC1)C2	ZINC000819449413	GG	On-Demand	Mild	ADAM10	36	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC=C(c3ccc(C#N)cc3)CC1)C2	ZINC000819449414	GG	On-Demand	Mild	ADAM10	36	41
N#Cc1cc(NCCC(=O)Nc2ccc(Cl)cc2)ccc1N1CCC(O)CC1	ZINC000819449478	GH	On-Demand	Mild	NPY2R	52	35
N#Cc1cc(NCCC(=O)Nc2ccc(Cl)cc2)ccc1N1CCC(O)CC1	ZINC000819449478	GH	On-Demand	Mild	MCHR1	23	43
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)c(C#N)c2)c(C)c1	ZINC000819449522	GF	On-Demand	Mild	ADRB1	40	31
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)c(C#N)c2)c(C)c1	ZINC000819449525	GF	On-Demand	Mild	ADRB1	40	31
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449539	DF	On-Demand	Anodyne	ACE	18	43
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449539	DF	On-Demand	Anodyne	MME	25	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449539	DF	On-Demand	Anodyne	EDNRB	19	44
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449539	DF	On-Demand	Anodyne	TACR1	33	44
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449539	DF	On-Demand	Anodyne	CCKAR	60	45
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449539	DF	On-Demand	Anodyne	BRS3	27	42
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449539	DF	On-Demand	Anodyne	NMBR	54	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449539	DF	On-Demand	Anodyne	GRPR	71	38
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449539	DF	On-Demand	Anodyne	ECE1	56	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449539	DF	On-Demand	Anodyne	MMP11	73	33
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449539	DF	On-Demand	Anodyne	CCKBR	59	45
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449539	DF	On-Demand	Anodyne	GHSR	62	46
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449539	DF	On-Demand	Anodyne	MMP9	24	41
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449539	DF	On-Demand	Anodyne	MC1R	53	36
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449539	DF	On-Demand	Anodyne	NPR	26	40
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449539	DF	On-Demand	Anodyne	SSSIM	28	42
O=C(N[C@@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449539	DF	On-Demand	Anodyne	KISS1R	53	31
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449541	DF	On-Demand	Anodyne	ACE	18	43
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449541	DF	On-Demand	Anodyne	MME	25	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449541	DF	On-Demand	Anodyne	EDNRB	19	44
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449541	DF	On-Demand	Anodyne	TACR1	33	44
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449541	DF	On-Demand	Anodyne	CCKAR	60	45
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449541	DF	On-Demand	Anodyne	BRS3	27	42
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449541	DF	On-Demand	Anodyne	NMBR	54	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449541	DF	On-Demand	Anodyne	GRPR	71	38
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449541	DF	On-Demand	Anodyne	ECE1	56	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449541	DF	On-Demand	Anodyne	MMP11	73	33
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449541	DF	On-Demand	Anodyne	CCKBR	59	45
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449541	DF	On-Demand	Anodyne	GHSR	62	46
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449541	DF	On-Demand	Anodyne	MMP9	24	41
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449541	DF	On-Demand	Anodyne	MC1R	53	36
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449541	DF	On-Demand	Anodyne	NPR	26	40
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449541	DF	On-Demand	Anodyne	SSSIM	28	42
O=C(N[C@H](CO)Cc1c[nH]c2ccccc12)C(F)=C1CCC1	ZINC000819449541	DF	On-Demand	Anodyne	KISS1R	53	31
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)c(C#N)c2)cc1	ZINC000819449598	GF	On-Demand	Mild	ADRB2	23	41
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(O)CC3)c(C#N)c2)cc1	ZINC000819449598	GF	On-Demand	Mild	ADRB1	34	40
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)c(C#N)c2)cc1	ZINC000819449600	GF	On-Demand	Mild	ADRB2	23	41
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCC(O)CC3)c(C#N)c2)cc1	ZINC000819449600	GF	On-Demand	Mild	ADRB1	34	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](C)O)cc1	ZINC000819449624	CG	On-Demand	Anodyne	CTSK	27	42
C#CCOc1ccc(F)cc1NC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819449636	FE	On-Demand	Mild	ADRB2	28	42
C#CCOc1ccc(F)cc1NC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819449636	FE	On-Demand	Mild	ADRB1	42	32
C#CCOc1ccc(F)cc1NC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819449637	FE	On-Demand	Mild	ADRB2	28	42
C#CCOc1ccc(F)cc1NC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819449637	FE	On-Demand	Mild	ADRB1	42	32
O[C@@H](CNc1cccc(CC(F)(F)F)c1)c1cccnc1	ZINC000819449649	CG	On-Demand	Anodyne	ADRB2	24	42
O[C@@H](CNc1cccc(CC(F)(F)F)c1)c1cccnc1	ZINC000819449649	CG	On-Demand	Anodyne	ADRB1	24	41
O[C@@H](CNc1cccc(CC(F)(F)F)c1)c1cccnc1	ZINC000819449649	CG	On-Demand	Anodyne	ADRB3	88	44
O[C@H](CNc1cccc(CC(F)(F)F)c1)c1cccnc1	ZINC000819449650	CG	On-Demand	Anodyne	ADRB2	24	42
O[C@H](CNc1cccc(CC(F)(F)F)c1)c1cccnc1	ZINC000819449650	CG	On-Demand	Anodyne	ADRB1	24	41
O[C@H](CNc1cccc(CC(F)(F)F)c1)c1cccnc1	ZINC000819449650	CG	On-Demand	Anodyne	ADRB3	88	44
O=C(CCNc1ccc(OC2CCCC2)c(F)c1)Nc1cccnc1	ZINC000819449655	EH	On-Demand	Anodyne	PDE4A	28	42
O=C(CCNc1ccc(OC2CCCC2)c(F)c1)Nc1cccnc1	ZINC000819449655	EH	On-Demand	Anodyne	NAMPT	19	40
N#Cc1cc(NC[C@H](O)c2cccc(F)c2)ccc1N1CCC(O)CC1	ZINC000819449678	FF	On-Demand	Mild	NPY2R	26	42
N#Cc1cc(NC[C@@H](O)c2cccc(F)c2)ccc1N1CCC(O)CC1	ZINC000819449680	FF	On-Demand	Mild	NPY2R	26	42
CN(CC1CCOCC1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819449697	FE	On-Demand	Mild	PAPA1_CARPA	31	41
CN(CC1CCOCC1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819449699	FE	On-Demand	Mild	PAPA1_CARPA	31	41
O=C(Nc1cccc(CN2CCOCC2)n1)C(F)=C1CCC1	ZINC000819449705	DE	On-Demand	Anodyne	CASR	46	38
N#Cc1cc(NC[C@H](O)COc2ccccc2)ccc1N1CCC(O)CC1	ZINC000819449711	FE	On-Demand	Mild	ADRB2	34	41
N#Cc1cc(NC[C@H](O)COc2ccccc2)ccc1N1CCC(O)CC1	ZINC000819449711	FE	On-Demand	Mild	ADRB1	59	35
N#Cc1cc(NC[C@H](O)COc2ccccc2)ccc1N1CCC(O)CC1	ZINC000819449711	FE	On-Demand	Mild	ADRB3	39	41
N#Cc1cc(NC[C@@H](O)COc2ccccc2)ccc1N1CCC(O)CC1	ZINC000819449724	FE	On-Demand	Mild	ADRB2	34	41
N#Cc1cc(NC[C@@H](O)COc2ccccc2)ccc1N1CCC(O)CC1	ZINC000819449724	FE	On-Demand	Mild	ADRB1	59	35
N#Cc1cc(NC[C@@H](O)COc2ccccc2)ccc1N1CCC(O)CC1	ZINC000819449724	FE	On-Demand	Mild	ADRB3	39	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)C2CC2)cc1	ZINC000819449725	DG	On-Demand	Anodyne	CTSK	20	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)C2CC2)cc1	ZINC000819449726	DG	On-Demand	Anodyne	CTSK	20	41
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)c(C)c2)cc1	ZINC000819449730	FH	On-Demand	Anodyne	ADRB2	46	59
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)c(C)c2)cc1	ZINC000819449730	FH	On-Demand	Anodyne	ADRB1	71	59
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC(C)C)c(C)c2)cc1	ZINC000819449730	FH	On-Demand	Anodyne	ADRB3	38	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC(C)C)c(C)c2)cc1	ZINC000819449733	FH	On-Demand	Anodyne	ADRB2	46	59
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC(C)C)c(C)c2)cc1	ZINC000819449733	FH	On-Demand	Anodyne	ADRB1	71	59
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC(C)C)c(C)c2)cc1	ZINC000819449733	FH	On-Demand	Anodyne	ADRB3	38	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449744	GE	On-Demand	Anodyne	ACE	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449744	GE	On-Demand	Anodyne	SSTR2	56	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449744	GE	On-Demand	Anodyne	EDNRB	27	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449744	GE	On-Demand	Anodyne	TACR1	38	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449744	GE	On-Demand	Anodyne	CCKAR	112	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449744	GE	On-Demand	Anodyne	NMBR	52	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449744	GE	On-Demand	Anodyne	MC3R	45	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449744	GE	On-Demand	Anodyne	MC5R	48	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449744	GE	On-Demand	Anodyne	MMP2	25	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449744	GE	On-Demand	Anodyne	MMP8	33	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449744	GE	On-Demand	Anodyne	GRPR	77	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449744	GE	On-Demand	Anodyne	ECE1	56	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449744	GE	On-Demand	Anodyne	MMP11	74	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449744	GE	On-Demand	Anodyne	CCKBR	107	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449744	GE	On-Demand	Anodyne	GHSR	69	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449744	GE	On-Demand	Anodyne	MMP9	23	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449744	GE	On-Demand	Anodyne	MC1R	61	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449744	GE	On-Demand	Anodyne	MMP1	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449746	GE	On-Demand	Anodyne	ACE	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449746	GE	On-Demand	Anodyne	SSTR2	56	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449746	GE	On-Demand	Anodyne	EDNRB	27	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449746	GE	On-Demand	Anodyne	TACR1	38	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449746	GE	On-Demand	Anodyne	CCKAR	112	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449746	GE	On-Demand	Anodyne	NMBR	52	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449746	GE	On-Demand	Anodyne	MC3R	45	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449746	GE	On-Demand	Anodyne	MC5R	48	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449746	GE	On-Demand	Anodyne	MMP2	25	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449746	GE	On-Demand	Anodyne	MMP8	33	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449746	GE	On-Demand	Anodyne	GRPR	77	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449746	GE	On-Demand	Anodyne	ECE1	56	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449746	GE	On-Demand	Anodyne	MMP11	74	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449746	GE	On-Demand	Anodyne	CCKBR	107	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449746	GE	On-Demand	Anodyne	GHSR	69	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449746	GE	On-Demand	Anodyne	MMP9	23	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449746	GE	On-Demand	Anodyne	MC1R	61	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449746	GE	On-Demand	Anodyne	MMP1	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449750	GE	On-Demand	Anodyne	ACE	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449750	GE	On-Demand	Anodyne	SSTR2	56	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449750	GE	On-Demand	Anodyne	EDNRB	27	47
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449750	GE	On-Demand	Anodyne	TACR1	38	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449750	GE	On-Demand	Anodyne	CCKAR	112	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449750	GE	On-Demand	Anodyne	NMBR	52	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449750	GE	On-Demand	Anodyne	MC3R	45	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449750	GE	On-Demand	Anodyne	MC5R	48	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449750	GE	On-Demand	Anodyne	MMP2	25	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449750	GE	On-Demand	Anodyne	MMP8	33	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449750	GE	On-Demand	Anodyne	GRPR	77	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449750	GE	On-Demand	Anodyne	ECE1	56	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449750	GE	On-Demand	Anodyne	MMP11	74	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449750	GE	On-Demand	Anodyne	CCKBR	107	48
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449750	GE	On-Demand	Anodyne	GHSR	69	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449750	GE	On-Demand	Anodyne	MMP9	23	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449750	GE	On-Demand	Anodyne	MC1R	61	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449750	GE	On-Demand	Anodyne	MMP1	20	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449754	GE	On-Demand	Anodyne	ACE	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449754	GE	On-Demand	Anodyne	SSTR2	56	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449754	GE	On-Demand	Anodyne	EDNRB	27	47
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449754	GE	On-Demand	Anodyne	TACR1	38	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449754	GE	On-Demand	Anodyne	CCKAR	112	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449754	GE	On-Demand	Anodyne	NMBR	52	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449754	GE	On-Demand	Anodyne	MC3R	45	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449754	GE	On-Demand	Anodyne	MC5R	48	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449754	GE	On-Demand	Anodyne	MMP2	25	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449754	GE	On-Demand	Anodyne	MMP8	33	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449754	GE	On-Demand	Anodyne	GRPR	77	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449754	GE	On-Demand	Anodyne	ECE1	56	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449754	GE	On-Demand	Anodyne	MMP11	74	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449754	GE	On-Demand	Anodyne	CCKBR	107	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449754	GE	On-Demand	Anodyne	GHSR	69	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449754	GE	On-Demand	Anodyne	MMP9	23	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449754	GE	On-Demand	Anodyne	MC1R	61	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CO)Cc1c[nH]c3ccccc13)C2	ZINC000819449754	GE	On-Demand	Anodyne	MMP1	20	40
C#CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819449775	FE	On-Demand	Mild	ADRB2	28	43
C#CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819449777	FE	On-Demand	Mild	ADRB2	28	43
N#CCc1ccc(OC[C@H](O)CNc2ccc(OC3CCCC3)c(F)c2)cc1	ZINC000819449820	GI	On-Demand	Mild	ADRB1	54	42
N#CCc1ccc(OC[C@@H](O)CNc2ccc(OC3CCCC3)c(F)c2)cc1	ZINC000819449828	GI	On-Demand	Mild	ADRB1	54	42
Cc1c(F)cccc1NC(=O)CCNc1ccc(N2CCC(O)CC2)c(C#N)c1	ZINC000819449850	GG	On-Demand	Mild	NPY2R	48	35
N#Cc1cc(NC[C@H](O)c2cccnc2)ccc1N1CCC(O)CC1	ZINC000819449887	EE	On-Demand	Mild	ADRB3	62	41
N#Cc1cc(NC[C@@H](O)c2cccnc2)ccc1N1CCC(O)CC1	ZINC000819449892	EE	On-Demand	Mild	ADRB3	62	41
C#CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819449962	FF	On-Demand	Mild	ADRB2	24	40
C#CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819449962	FF	On-Demand	Mild	ADRB1	44	34
C#CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819449965	FF	On-Demand	Mild	ADRB2	24	40
C#CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819449965	FF	On-Demand	Mild	ADRB1	44	34
CC[C@H](O)CNc1ccc(N2CCC(O)CC2)c(C#N)c1	ZINC000819449971	CD	On-Demand	Mild	NPY2R	34	40
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(CC(F)(F)F)cc2)cc1	ZINC000819450001	FG	On-Demand	Anodyne	CTSF	53	36
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(CC(F)(F)F)cc2)cc1	ZINC000819450002	FG	On-Demand	Anodyne	CTSF	53	36
C#CCOc1cc(F)ccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819450028	DC	On-Demand	Mild	CCR1	32	43
C#CCOc1cc(F)ccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819450029	DC	On-Demand	Mild	CCR1	32	43
C#CCOc1ccc(F)cc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819450037	FF	On-Demand	Mild	ADRB2	21	44
C#CCOc1ccc(F)cc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819450037	FF	On-Demand	Mild	ADRB1	47	38
C#CCOc1ccc(F)cc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819450037	FF	On-Demand	Mild	ABCB1	17	43
C#CCOc1ccc(F)cc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819450038	FF	On-Demand	Mild	ADRB2	21	44
C#CCOc1ccc(F)cc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819450038	FF	On-Demand	Mild	ADRB1	47	38
C#CCOc1ccc(F)cc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819450038	FF	On-Demand	Mild	ABCB1	17	43
O=C(Cn1cc(C(=O)O)c2ccccc21)Nc1cccc(NC(=O)c2cccs2)c1	ZINC000819450107	HI	On-Demand	Anodyne	PTPN11	62	36
O=C(Cn1cc(C(=O)O)c2ccccc21)Nc1cccc(NC(=O)c2cccs2)c1	ZINC000819450107	HI	On-Demand	Anodyne	KCNK3	66	54
O=C(Cn1cc(C(=O)O)c2ccccc21)Nc1cccc(NC(=O)c2cccs2)c1	ZINC000819450107	HI	On-Demand	Anodyne	KCNK9	44	54
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819450108	FJ	On-Demand	Anodyne	PAPA1_CARPA	26	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819450111	FJ	On-Demand	Anodyne	PAPA1_CARPA	26	42
CCSCc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819450115	CG	On-Demand	Anodyne	ADRB2	19	41
CCSCc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819450115	CG	On-Demand	Anodyne	ADRB1	22	41
CCSCc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819450115	CG	On-Demand	Anodyne	ADRB3	79	41
CCSCc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819450117	CG	On-Demand	Anodyne	ADRB2	19	41
CCSCc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819450117	CG	On-Demand	Anodyne	ADRB1	22	41
CCSCc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819450117	CG	On-Demand	Anodyne	ADRB3	79	41
N#Cc1cc(NC[C@@H](O)COc2ccccc2F)ccc1N1CCC(O)CC1	ZINC000819450128	GF	On-Demand	Mild	ADRB1	56	40
N#Cc1cc(NC[C@@H](O)COc2ccccc2F)ccc1N1CCC(O)CC1	ZINC000819450128	GF	On-Demand	Mild	CYP2D6	18	40
N#Cc1cc(NC[C@H](O)COc2ccccc2F)ccc1N1CCC(O)CC1	ZINC000819450129	GF	On-Demand	Mild	ADRB1	56	40
N#Cc1cc(NC[C@H](O)COc2ccccc2F)ccc1N1CCC(O)CC1	ZINC000819450129	GF	On-Demand	Mild	CYP2D6	18	40
C[C@@H](CC(=O)N1CCN(c2ccc(NS(C)(=O)=O)cc2)CC1)n1cccn1	ZINC000819450130	GD	On-Demand	Anodyne	PRNP	40	33
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccc(F)cc2)cc1	ZINC000819450134	GI	On-Demand	Anodyne	PAPA1_CARPA	30	48
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccc(F)cc2)cc1	ZINC000819450134	GI	On-Demand	Anodyne	CTSK	15	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccc(F)cc2)cc1	ZINC000819450134	GI	On-Demand	Anodyne	FPR1	46	36
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccc(F)cc2)cc1	ZINC000819450136	GI	On-Demand	Anodyne	PAPA1_CARPA	30	48
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccc(F)cc2)cc1	ZINC000819450136	GI	On-Demand	Anodyne	CTSK	15	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccc(F)cc2)cc1	ZINC000819450136	GI	On-Demand	Anodyne	FPR1	46	36
N#Cc1cc(NCCC(=O)Nc2cccc(Cl)c2)ccc1N1CCC(O)CC1	ZINC000819450152	GH	On-Demand	Mild	NPY2R	60	36
N#Cc1cc(NCCC(=O)Nc2cccc(Cl)c2)ccc1N1CCC(O)CC1	ZINC000819450152	GH	On-Demand	Mild	MCHR1	42	38
N#Cc1cc(NCCC(=O)Nc2cccc(Cl)c2)ccc1N1CCC(O)CC1	ZINC000819450152	GH	On-Demand	Mild	TAAR1	25	41
C#CCNC(=O)CCNc1ccc2nc(C(C)(C)C)sc2c1	ZINC000819450188	DG	On-Demand	Mild	LDHA	43	41
CCSCc1cccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819450207	FG	On-Demand	Anodyne	ADRB3	24	40
CCSCc1cccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819450208	FG	On-Demand	Anodyne	ADRB3	24	40
Cc1nc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1[C@@H](C)O	ZINC000819450211	GF	On-Demand	Mild	PAPA1_CARPA	47	45
Cc1nc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1[C@@H](C)O	ZINC000819450212	GF	On-Demand	Mild	PAPA1_CARPA	47	45
Cc1nc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1[C@H](C)O	ZINC000819450213	GF	On-Demand	Mild	PAPA1_CARPA	47	45
Cc1nc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1[C@H](C)O	ZINC000819450214	GF	On-Demand	Mild	PAPA1_CARPA	47	45
C#CCOc1ccc(F)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819450238	CF	On-Demand	Mild	NR3C1	19	40
C#CCOc1ccc(F)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819450239	CF	On-Demand	Mild	NR3C1	19	40
C#CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819450260	FF	On-Demand	Mild	ADRB2	33	54
C#CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819450260	FF	On-Demand	Mild	ADRB1	58	54
C#CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819450260	FF	On-Demand	Mild	ADRB3	31	45
C#CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819450261	FF	On-Demand	Mild	ADRB2	33	54
C#CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819450261	FF	On-Demand	Mild	ADRB1	58	54
C#CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819450261	FF	On-Demand	Mild	ADRB3	31	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccc(OC(C)(C)C)n1	ZINC000819450281	FF	On-Demand	Anodyne	PDE8B	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cccc(OC(C)(C)C)n1)C2	ZINC000819450290	GF	On-Demand	Anodyne	PDE8B	41	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cccc(OC(C)(C)C)n1)C2	ZINC000819450291	GF	On-Demand	Anodyne	PDE8B	41	33
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819450311	GI	On-Demand	Mild	CTRB_BOVIN	55	32
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819450313	GI	On-Demand	Mild	CTRB_BOVIN	55	32
N#Cc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1N1CCC(O)CC1	ZINC000819450322	GG	On-Demand	Mild	NPY2R	56	41
N#Cc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1N1CCC(O)CC1	ZINC000819450322	GG	On-Demand	Mild	TAAR1	25	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819450332	FH	On-Demand	Anodyne	ADRB1	24	44
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819450332	FH	On-Demand	Anodyne	ADRB3	86	44
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819450332	FH	On-Demand	Anodyne	KCNA5	19	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819450335	FH	On-Demand	Anodyne	ADRB1	24	44
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819450335	FH	On-Demand	Anodyne	ADRB3	86	44
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819450335	FH	On-Demand	Anodyne	KCNA5	19	41
Cn1cnnc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819450371	GE	On-Demand	Mild	PLG	16	41
Cn1cnnc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819450371	GE	On-Demand	Mild	TRHR	42	33
Cn1cnnc1[C@@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819450371	GE	On-Demand	Mild	TRY1_BOVIN	28	41
Cc1c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cnn1CC(C)C	ZINC000819450374	GG	On-Demand	Mild	PAPA1_CARPA	37	42
Cc1c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cnn1CC(C)C	ZINC000819450374	GG	On-Demand	Mild	FPR1	41	36
Cc1c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cnn1CC(C)C	ZINC000819450375	GG	On-Demand	Mild	PAPA1_CARPA	37	42
Cc1c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cnn1CC(C)C	ZINC000819450375	GG	On-Demand	Mild	FPR1	41	36
CCCCS(=O)(=O)Nc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819450386	EG	On-Demand	Anodyne	ADRB2	16	47
CCCCS(=O)(=O)Nc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819450386	EG	On-Demand	Anodyne	ADRB3	46	40
CCCCS(=O)(=O)Nc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819450387	EG	On-Demand	Anodyne	ADRB2	16	47
CCCCS(=O)(=O)Nc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819450387	EG	On-Demand	Anodyne	ADRB3	46	40
Cc1ccc(NC[C@H](O)c2cccnc2)cc1N1CCCS1(=O)=O	ZINC000819450391	EE	On-Demand	Anodyne	ADRB3	89	46
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1N1CCCS1(=O)=O	ZINC000819450392	EE	On-Demand	Anodyne	ADRB3	89	46
CSc1cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccn1	ZINC000819450393	FG	On-Demand	Mild	PAPA1_CARPA	40	44
CSc1cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccn1	ZINC000819450394	FG	On-Demand	Mild	PAPA1_CARPA	40	44
O[C@@H](CNc1ccccc1OCC1CC1)COc1ccccc1	ZINC000819450406	DG	On-Demand	Clean	ADRB2	55	47
O[C@@H](CNc1ccccc1OCC1CC1)COc1ccccc1	ZINC000819450406	DG	On-Demand	Clean	ADRB1	82	45
O[C@@H](CNc1ccccc1OCC1CC1)COc1ccccc1	ZINC000819450406	DG	On-Demand	Clean	GRIN2B	16	42
O[C@@H](CNc1ccccc1OCC1CC1)COc1ccccc1	ZINC000819450406	DG	On-Demand	Clean	ADRB3	48	42
O[C@H](CNc1ccccc1OCC1CC1)COc1ccccc1	ZINC000819450407	DG	On-Demand	Clean	ADRB2	55	47
O[C@H](CNc1ccccc1OCC1CC1)COc1ccccc1	ZINC000819450407	DG	On-Demand	Clean	ADRB1	82	45
O[C@H](CNc1ccccc1OCC1CC1)COc1ccccc1	ZINC000819450407	DG	On-Demand	Clean	GRIN2B	16	42
O[C@H](CNc1ccccc1OCC1CC1)COc1ccccc1	ZINC000819450407	DG	On-Demand	Clean	ADRB3	48	42
CCCCS(=O)(=O)Nc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819450419	GI	On-Demand	Anodyne	ADRB2	21	49
CCCCS(=O)(=O)Nc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819450419	GI	On-Demand	Anodyne	ADRB1	35	49
CCCCS(=O)(=O)Nc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819450419	GI	On-Demand	Anodyne	ADRB3	68	44
CCCCS(=O)(=O)Nc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819450420	GI	On-Demand	Anodyne	ADRB2	21	49
CCCCS(=O)(=O)Nc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819450420	GI	On-Demand	Anodyne	ADRB1	35	49
CCCCS(=O)(=O)Nc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819450420	GI	On-Demand	Anodyne	ADRB3	68	44
Cn1cnnc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819450422	GE	On-Demand	Mild	PLG	16	41
Cn1cnnc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819450422	GE	On-Demand	Mild	TRHR	42	33
Cn1cnnc1[C@@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819450422	GE	On-Demand	Mild	TRY1_BOVIN	28	41
Cn1cnnc1[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819450423	GE	On-Demand	Mild	PLG	16	41
Cn1cnnc1[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819450423	GE	On-Demand	Mild	TRHR	42	33
Cn1cnnc1[C@H]1CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819450423	GE	On-Demand	Mild	TRY1_BOVIN	28	41
Cn1cnnc1[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819450424	GE	On-Demand	Mild	PLG	16	41
Cn1cnnc1[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819450424	GE	On-Demand	Mild	TRHR	42	33
Cn1cnnc1[C@H]1CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819450424	GE	On-Demand	Mild	TRY1_BOVIN	28	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	MME	49	36
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	CTSD	18	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	PGC	54	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	CTSB	43	37
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	PAPA1_CARPA	68	47
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	CYSP_TRYCR	48	35
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	CTSK	45	52
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	CTSL	36	47
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	PGA	41	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	TACR3	17	43
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	CAPNS1	54	32
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	HLA-DRB1	19	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	REN	72	47
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	REN1	23	43
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	CTSS	18	47
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	CAPN1	58	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	CAPN2	73	38
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	ACE2	44	36
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	BACE1	20	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	FPR1	65	46
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819450448	FI	On-Demand	Anodyne	CTRB_BOVIN	21	43
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	MME	49	36
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	CTSD	18	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	PGC	54	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	CTSB	43	37
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	PAPA1_CARPA	68	47
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	CYSP_TRYCR	48	35
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	CTSK	45	52
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	CTSL	36	47
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	PGA	41	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	TACR3	17	43
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	CAPNS1	54	32
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	HLA-DRB1	19	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	REN	72	47
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	REN1	23	43
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	CTSS	18	47
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	CAPN1	58	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	CAPN2	73	38
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	ACE2	44	36
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	BACE1	20	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	FPR1	65	46
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819450449	FI	On-Demand	Anodyne	CTRB_BOVIN	21	43
OC1(CNc2ccccc2OCC2CC2)CCCCC1	ZINC000819450496	CH	On-Demand	Anodyne	HCN1	54	35
OC1(CNc2ccccc2OCC2CC2)CCCCC1	ZINC000819450496	CH	On-Demand	Anodyne	HCN4	52	35
CC(C)(C)OC(=O)Cc1cccc(NC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819450546	FH	On-Demand	Mild	CTRB_BOVIN	47	34
CC(C)(C)OC(=O)Cc1cccc(NC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819450547	FH	On-Demand	Mild	CTRB_BOVIN	47	34
CC(C)(C)OC(=O)Cc1cccc(NC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819450548	FH	On-Demand	Anodyne	ADRB2	47	36
CC(C)(C)OC(=O)Cc1cccc(NC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819450549	FH	On-Demand	Anodyne	ADRB2	47	36
CC(C)(C)OC(=O)Cc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819450569	EG	On-Demand	Anodyne	ADRB2	27	42
CC(C)(C)OC(=O)Cc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819450569	EG	On-Demand	Anodyne	ADRB1	32	43
CC(C)(C)OC(=O)Cc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819450569	EG	On-Demand	Anodyne	ADRB3	98	44
CC(C)(C)OC(=O)Cc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819450570	EG	On-Demand	Anodyne	ADRB2	27	42
CC(C)(C)OC(=O)Cc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819450570	EG	On-Demand	Anodyne	ADRB1	32	43
CC(C)(C)OC(=O)Cc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819450570	EG	On-Demand	Anodyne	ADRB3	98	44
Cn1cnc2cc(NCCS(C)(=O)=O)ccc21	ZINC000819450573	CD	On-Demand	Anodyne	NR1I2	62	39
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819450594	GJ	On-Demand	Anodyne	LTA4H	26	45
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819450594	GJ	On-Demand	Anodyne	CTSK	33	44
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819450594	GJ	On-Demand	Anodyne	F7	22	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819450594	GJ	On-Demand	Anodyne	FPR1	47	37
O[C@@H](CNc1ccccc1OCC1CC1)COCc1ccccc1F	ZINC000819450601	EH	On-Demand	Clean	ADRB1	20	40
O[C@H](CNc1ccccc1OCC1CC1)COCc1ccccc1F	ZINC000819450602	EH	On-Demand	Clean	ADRB1	20	40
O[C@@H](CNc1cccc(CSC2CCCC2)c1)c1cccnc1	ZINC000819450618	EI	On-Demand	Anodyne	ADRB2	22	40
O[C@@H](CNc1cccc(CSC2CCCC2)c1)c1cccnc1	ZINC000819450618	EI	On-Demand	Anodyne	ADRB1	23	40
O[C@@H](CNc1cccc(CSC2CCCC2)c1)c1cccnc1	ZINC000819450618	EI	On-Demand	Anodyne	ADRB3	89	43
O[C@@H](CNc1cccc(CSC2CCCC2)c1)c1cccnc1	ZINC000819450618	EI	On-Demand	Anodyne	QRFPR	18	45
O[C@H](CNc1cccc(CSC2CCCC2)c1)c1cccnc1	ZINC000819450619	EI	On-Demand	Anodyne	ADRB2	22	40
O[C@H](CNc1cccc(CSC2CCCC2)c1)c1cccnc1	ZINC000819450619	EI	On-Demand	Anodyne	ADRB1	23	40
O[C@H](CNc1cccc(CSC2CCCC2)c1)c1cccnc1	ZINC000819450619	EI	On-Demand	Anodyne	ADRB3	89	43
O[C@H](CNc1cccc(CSC2CCCC2)c1)c1cccnc1	ZINC000819450619	EI	On-Demand	Anodyne	QRFPR	18	45
O[C@@H](CNc1ccccc1OCC1CC1)COc1ccccc1F	ZINC000819450628	EG	On-Demand	Clean	ADRB2	25	41
O[C@@H](CNc1ccccc1OCC1CC1)COc1ccccc1F	ZINC000819450628	EG	On-Demand	Clean	ADRB1	60	45
O[C@H](CNc1ccccc1OCC1CC1)COc1ccccc1F	ZINC000819450629	EG	On-Demand	Clean	ADRB2	25	41
O[C@H](CNc1ccccc1OCC1CC1)COc1ccccc1F	ZINC000819450629	EG	On-Demand	Clean	ADRB1	60	45
O[C@@H](CNc1ccccc1OCC1CC1)c1cccc(F)c1	ZINC000819450640	DH	On-Demand	Anodyne	CYP3A4	41	32
O[C@H](CNc1ccccc1OCC1CC1)c1cccc(F)c1	ZINC000819450641	DH	On-Demand	Anodyne	CYP3A4	41	32
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccccc1OCC1CC1	ZINC000819450651	FG	On-Demand	Clean	ADRB2	20	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccccc1OCC1CC1	ZINC000819450651	FG	On-Demand	Clean	ADRB1	60	38
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccccc1OCC1CC1	ZINC000819450652	FG	On-Demand	Clean	ADRB2	20	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccccc1OCC1CC1	ZINC000819450652	FG	On-Demand	Clean	ADRB1	60	38
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819450689	FH	On-Demand	Clean	ADRB2	47	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819450689	FH	On-Demand	Clean	ADRB1	75	44
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819450689	FH	On-Demand	Clean	ADRB3	42	40
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819450689	FH	On-Demand	Clean	CYP2D6	16	40
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819450689	FH	On-Demand	Clean	ABCB1	26	51
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819450690	FH	On-Demand	Clean	ADRB2	47	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819450690	FH	On-Demand	Clean	ADRB1	75	44
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819450690	FH	On-Demand	Clean	ADRB3	42	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819450690	FH	On-Demand	Clean	CYP2D6	16	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819450690	FH	On-Demand	Clean	ABCB1	26	51
CCOC[C@H](O)CNc1ccccc1OCC1CC1	ZINC000819450695	CE	On-Demand	Clean	ADRB2	24	43
CCOC[C@H](O)CNc1ccccc1OCC1CC1	ZINC000819450695	CE	On-Demand	Clean	ADRB1	42	35
N#Cc1ccccc1Oc1ccc(NC[C@H](O)C2CC2)cc1F	ZINC000819450700	DH	On-Demand	Mild	ADRB1	44	37
N#Cc1ccccc1Oc1ccc(NC[C@H](O)C2CC2)cc1F	ZINC000819450700	DH	On-Demand	Mild	EZH2	28	44
N#Cc1ccccc1Oc1ccc(NC[C@@H](O)C2CC2)cc1F	ZINC000819450701	DH	On-Demand	Mild	ADRB1	44	37
N#Cc1ccccc1Oc1ccc(NC[C@@H](O)C2CC2)cc1F	ZINC000819450701	DH	On-Demand	Mild	EZH2	28	44
CCOc1cc(N2CCN(C)CC2)ccc1NCC(C)(C)O	ZINC000819450709	DE	On-Demand	Anodyne	MAPK7	41	39
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](O)c1ccccc1	ZINC000819450725	FF	On-Demand	Anodyne	ADRB3	22	41
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](O)c1ccccc1	ZINC000819450726	FF	On-Demand	Anodyne	ADRB3	22	41
CC(C)(C)OC(=O)Cc1cccc(NC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819450762	EH	On-Demand	Anodyne	ADRB2	42	35
CC(C)(C)OC(=O)Cc1cccc(NC[C@H](O)c2ccc(F)cc2)c1	ZINC000819450763	EH	On-Demand	Anodyne	ADRB2	42	35
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](O)COc1cccc(C)c1	ZINC000819450798	GF	On-Demand	Anodyne	ADRB2	19	47
Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1OCC1CCOCC1	ZINC000819450814	GH	On-Demand	Bother	CYP3A4	44	33
Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1OCC1CCOCC1	ZINC000819450815	GH	On-Demand	Bother	CYP3A4	44	33
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(F)cc2OCC2CC2)c1	ZINC000819450819	FH	On-Demand	Anodyne	ADRB2	26	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(F)cc2OCC2CC2)c1	ZINC000819450819	FH	On-Demand	Anodyne	ADRB1	60	39
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(F)cc2OCC2CC2)c1	ZINC000819450819	FH	On-Demand	Anodyne	ABCB1	17	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(F)cc2OCC2CC2)c1	ZINC000819450820	FH	On-Demand	Anodyne	ADRB2	26	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(F)cc2OCC2CC2)c1	ZINC000819450820	FH	On-Demand	Anodyne	ADRB1	60	39
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(F)cc2OCC2CC2)c1	ZINC000819450820	FH	On-Demand	Anodyne	ABCB1	17	42
N#CCc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819450821	FH	On-Demand	Mild	ADRB2	19	42
N#CCc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819450821	FH	On-Demand	Mild	ADRB1	46	43
N#CCc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819450822	FH	On-Demand	Mild	ADRB2	19	42
N#CCc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819450822	FH	On-Demand	Mild	ADRB1	46	43
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819450840	GF	On-Demand	Anodyne	ADRB2	19	47
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2cc(F)c(F)c(F)c2)CC1	ZINC000819450864	FH	On-Demand	Anodyne	F13A1	15	40
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2cc(F)c(F)c(F)c2)CC1	ZINC000819450864	FH	On-Demand	Anodyne	GPR119	35	41
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2cc(F)c(F)c(F)c2)CC1	ZINC000819450866	FH	On-Demand	Anodyne	F13A1	15	40
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2cc(F)c(F)c(F)c2)CC1	ZINC000819450866	FH	On-Demand	Anodyne	GPR119	35	41
CN(CCN(C)C(=O)OC(C)(C)C)C(=O)CCc1cccc(OC(F)F)c1	ZINC000819450924	GH	On-Demand	Anodyne	CRTM	33	41
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1N1CCCS1(=O)=O	ZINC000819450931	GG	On-Demand	Anodyne	ADRB1	27	43
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1N1CCCS1(=O)=O	ZINC000819450931	GG	On-Demand	Anodyne	ADRB3	42	42
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1N1CCCS1(=O)=O	ZINC000819450931	GG	On-Demand	Anodyne	IGF1R	29	40
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1N1CCCS1(=O)=O	ZINC000819450931	GG	On-Demand	Anodyne	CYP3A4	50	38
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1N1CCCS1(=O)=O	ZINC000819450932	GG	On-Demand	Anodyne	ADRB1	27	43
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1N1CCCS1(=O)=O	ZINC000819450932	GG	On-Demand	Anodyne	ADRB3	42	42
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1N1CCCS1(=O)=O	ZINC000819450932	GG	On-Demand	Anodyne	IGF1R	29	40
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1N1CCCS1(=O)=O	ZINC000819450932	GG	On-Demand	Anodyne	CYP3A4	50	38
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](O)COC1CCOCC1	ZINC000819450958	GD	On-Demand	Anodyne	TTK	21	41
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](O)COC1CCOCC1	ZINC000819450960	GD	On-Demand	Anodyne	TTK	21	41
Cc1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1NC(=O)Nc1ccccc1	ZINC000819450961	GG	On-Demand	Anodyne	CPT1A	50	39
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](O)C1CCCCC1	ZINC000819450962	FG	On-Demand	Anodyne	TTK	35	41
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](O)C1CCCCC1	ZINC000819450963	FG	On-Demand	Anodyne	TTK	35	41
Cc1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1NC(=O)Nc1ccccc1	ZINC000819450967	GG	On-Demand	Anodyne	CPT1A	50	39
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819450969	CC	On-Demand	Anodyne	ACE	55	39
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819450969	CC	On-Demand	Anodyne	OPRM1	28	47
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819450969	CC	On-Demand	Anodyne	OPRD1	19	43
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819450969	CC	On-Demand	Anodyne	MME	34	43
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819450969	CC	On-Demand	Anodyne	TRHR	33	43
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819450969	CC	On-Demand	Anodyne	TRY1_BOVIN	53	34
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819450969	CC	On-Demand	Anodyne	ADAM17	19	40
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819450969	CC	On-Demand	Anodyne	CPT1A	63	37
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819450969	CC	On-Demand	Anodyne	PREP	68	34
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819450969	CC	On-Demand	Anodyne	DPP8	21	42
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819450969	CC	On-Demand	Anodyne	DPP9	17	42
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819450969	CC	On-Demand	Anodyne	BRCA1	44	33
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819450971	CC	On-Demand	Anodyne	ACE	55	39
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819450971	CC	On-Demand	Anodyne	OPRM1	28	47
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819450971	CC	On-Demand	Anodyne	OPRD1	19	43
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819450971	CC	On-Demand	Anodyne	MME	34	43
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819450971	CC	On-Demand	Anodyne	TRHR	33	43
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819450971	CC	On-Demand	Anodyne	TRY1_BOVIN	53	34
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819450971	CC	On-Demand	Anodyne	ADAM17	19	40
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819450971	CC	On-Demand	Anodyne	CPT1A	63	37
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819450971	CC	On-Demand	Anodyne	PREP	68	34
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819450971	CC	On-Demand	Anodyne	DPP8	21	42
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819450971	CC	On-Demand	Anodyne	DPP9	17	42
O=C([C@@H](O)Cc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819450971	CC	On-Demand	Anodyne	BRCA1	44	33
COc1cccc([S@@](=O)CC(=O)NN2CC(=O)N(C)C2=O)c1	ZINC000819450977	EB	On-Demand	Anodyne	DRD4	41	32
CCOc1cc(N2CCN(C)CC2)ccc1NCCC(=O)Nc1ccccc1	ZINC000819450989	GG	On-Demand	Anodyne	HTR1A	17	41
CCOc1cc(N2CCN(C)CC2)ccc1NCCC(=O)Nc1ccccc1	ZINC000819450989	GG	On-Demand	Anodyne	HTR1D	15	40
CCOc1cc(N2CCN(C)CC2)ccc1NCCC(=O)Nc1ccccc1	ZINC000819450989	GG	On-Demand	Anodyne	PRNP	53	43
CCOc1cc(N2CCN(C)CC2)ccc1NCCC(=O)Nc1ccccc1	ZINC000819450989	GG	On-Demand	Anodyne	FLT3	18	42
CCOc1cc(N2CCN(C)CC2)ccc1NCCC(=O)Nc1ccccc1	ZINC000819450989	GG	On-Demand	Anodyne	MAPK7	41	38
CCOc1cc(N2CCN(C)CC2)ccc1NCCC(=O)Nc1ccccc1	ZINC000819450989	GG	On-Demand	Anodyne	HCN1	54	38
Cc1ccccc1[C@@H](O)CNc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819450999	FJ	On-Demand	Anodyne	CTSK	19	40
Cc1ccccc1[C@@H](O)CNc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819450999	FJ	On-Demand	Anodyne	FPR1	44	38
Cc1ccccc1[C@@H](O)CNc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819451005	FJ	On-Demand	Anodyne	CTSK	19	40
Cc1ccccc1[C@@H](O)CNc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000819451005	FJ	On-Demand	Anodyne	FPR1	44	38
O=C(CCOc1ccc(Cl)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451006	DD	On-Demand	Anodyne	HRH3	15	43
O=C(CCOc1ccc(Cl)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451006	DD	On-Demand	Anodyne	PRCP	29	42
O=C(CCOc1ccc(Cl)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451006	DD	On-Demand	Anodyne	CPT1A	119	43
O=C(CCOc1ccc(Cl)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451008	DD	On-Demand	Anodyne	HRH3	15	43
O=C(CCOc1ccc(Cl)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451008	DD	On-Demand	Anodyne	PRCP	29	42
O=C(CCOc1ccc(Cl)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451008	DD	On-Demand	Anodyne	CPT1A	119	43
O=C(c1cc(OCc2ccccc2)ccc1O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451023	FE	On-Demand	Anodyne	CPT1A	103	37
O=C(c1cc(OCc2ccccc2)ccc1O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451023	FE	On-Demand	Anodyne	PREP	44	35
O=C(c1cc(OCc2ccccc2)ccc1O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451025	FE	On-Demand	Anodyne	CPT1A	103	37
O=C(c1cc(OCc2ccccc2)ccc1O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451025	FE	On-Demand	Anodyne	PREP	44	35
CCC(=O)N1CSC[C@H]1C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451027	DC	On-Demand	Anodyne	PREP	25	44
CCC(=O)N1CSC[C@@H]1C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451029	DC	On-Demand	Anodyne	PREP	25	44
CCC(=O)N1CSC[C@H]1C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451031	DC	On-Demand	Anodyne	PREP	25	44
CCC(=O)N1CSC[C@@H]1C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451033	DC	On-Demand	Anodyne	PREP	25	44
CC(=O)CCCC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451049	CC	On-Demand	Anodyne	CPT1A	54	36
CC(=O)CCCC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451050	CC	On-Demand	Anodyne	CPT1A	54	36
O=C(CCc1nc(C2CCCC2)no1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451055	ED	On-Demand	Anodyne	CPT1A	83	44
O=C(CCc1nc(C2CCCC2)no1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451056	ED	On-Demand	Anodyne	CPT1A	83	44
O=C(CSc1nc2ccccc2s1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451073	EE	On-Demand	Anodyne	CPT1A	95	38
O=C(CSc1nc2ccccc2s1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451073	EE	On-Demand	Anodyne	PREP	15	42
O=C(CSc1nc2ccccc2s1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451074	EE	On-Demand	Anodyne	CPT1A	95	38
O=C(CSc1nc2ccccc2s1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451074	EE	On-Demand	Anodyne	PREP	15	42
N#CCOc1cccc(CC(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819451075	DD	On-Demand	Mild	CPT1A	117	41
N#CCOc1cccc(CC(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819451076	DD	On-Demand	Mild	CPT1A	117	41
O=C(c1cc(C(F)(F)F)ccc1F)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451081	EE	On-Demand	Anodyne	LIPG	50	36
O=C(c1cc(C(F)(F)F)ccc1F)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451082	EE	On-Demand	Anodyne	LIPG	50	36
O=C(CSc1ccc(C(F)(F)F)cn1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451085	FE	On-Demand	Anodyne	CPT1A	36	41
O=C(CSc1ccc(C(F)(F)F)cn1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451086	FE	On-Demand	Anodyne	CPT1A	36	41
O=C(CCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccc2c(c1)OCCO2	ZINC000819451087	FD	On-Demand	Anodyne	CPT1A	81	37
O=C(CCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccc2c(c1)OCCO2	ZINC000819451088	FD	On-Demand	Anodyne	CPT1A	81	37
O=C(c1cccc2[nH]ccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451089	CD	On-Demand	Anodyne	CPT1A	21	40
O=C(c1cccc2[nH]ccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451090	CD	On-Demand	Anodyne	CPT1A	21	40
CC(=O)c1cccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819451097	DD	On-Demand	Anodyne	PRCP	23	41
CC(=O)c1cccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819451097	DD	On-Demand	Anodyne	CPT1A	156	53
CC(=O)c1cccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819451097	DD	On-Demand	Anodyne	CPT2	49	39
CC(=O)c1cccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819451098	DD	On-Demand	Anodyne	PRCP	23	41
CC(=O)c1cccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819451098	DD	On-Demand	Anodyne	CPT1A	156	53
CC(=O)c1cccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819451098	DD	On-Demand	Anodyne	CPT2	49	39
O[C@@H](CNc1ccccc1OCC1CC1)c1cccnc1	ZINC000819451113	CG	On-Demand	Anodyne	ADRB3	56	41
O[C@H](CNc1ccccc1OCC1CC1)c1cccnc1	ZINC000819451114	CG	On-Demand	Anodyne	ADRB3	56	41
N#Cc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819451115	FG	On-Demand	Mild	ADRB2	17	40
N#Cc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819451115	FG	On-Demand	Mild	ADRB1	58	37
N#Cc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819451116	FG	On-Demand	Mild	ADRB2	17	40
N#Cc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819451116	FG	On-Demand	Mild	ADRB1	58	37
NC(=O)NC(=O)CCNc1ccc(OCc2noc(C3CC3)n2)cc1	ZINC000819451121	ED	On-Demand	Anodyne	ETHR	50	31
Cc1ccc(OC[C@H](O)CNc2ccc(OCc3noc(C4CC4)n3)cc2)cc1	ZINC000819451165	GH	On-Demand	Anodyne	ADRB2	26	42
Cc1ccc(OC[C@H](O)CNc2ccc(OCc3noc(C4CC4)n3)cc2)cc1	ZINC000819451165	GH	On-Demand	Anodyne	ADRB1	37	44
Cc1ccc(OC[C@@H](O)CNc2ccc(OCc3noc(C4CC4)n3)cc2)cc1	ZINC000819451166	GH	On-Demand	Anodyne	ADRB2	26	42
Cc1ccc(OC[C@@H](O)CNc2ccc(OCc3noc(C4CC4)n3)cc2)cc1	ZINC000819451166	GH	On-Demand	Anodyne	ADRB1	37	44
CCOc1cc(N2CCN(C)CC2)ccc1NCC1(O)CCOCC1	ZINC000819451171	ED	On-Demand	Anodyne	TTK	18	40
O[C@@H](CNc1ccccc1OCC1CC1)CN1CCOCC1	ZINC000819451186	DD	On-Demand	Clean	ABCB1	35	41
O[C@H](CNc1ccccc1OCC1CC1)CN1CCOCC1	ZINC000819451187	DD	On-Demand	Clean	ABCB1	35	41
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@](C)(O)C(F)(F)F	ZINC000819451199	FF	On-Demand	Anodyne	CCR1	15	41
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@](C)(O)C(F)(F)F	ZINC000819451201	FF	On-Demand	Anodyne	CCR1	15	41
O[C@@H](CNc1ccccc1OCC1CC1)COc1cccc2[nH]ccc12	ZINC000819451209	FH	On-Demand	Clean	ADRB2	24	63
O[C@@H](CNc1ccccc1OCC1CC1)COc1cccc2[nH]ccc12	ZINC000819451209	FH	On-Demand	Clean	ADRB1	60	57
O[C@@H](CNc1ccccc1OCC1CC1)COc1cccc2[nH]ccc12	ZINC000819451209	FH	On-Demand	Clean	SLC6A4	17	44
O[C@@H](CNc1ccccc1OCC1CC1)COc1cccc2[nH]ccc12	ZINC000819451209	FH	On-Demand	Clean	ADRB3	16	57
O[C@H](CNc1ccccc1OCC1CC1)COc1cccc2[nH]ccc12	ZINC000819451211	FH	On-Demand	Clean	ADRB2	24	63
O[C@H](CNc1ccccc1OCC1CC1)COc1cccc2[nH]ccc12	ZINC000819451211	FH	On-Demand	Clean	ADRB1	60	57
O[C@H](CNc1ccccc1OCC1CC1)COc1cccc2[nH]ccc12	ZINC000819451211	FH	On-Demand	Clean	SLC6A4	17	44
O[C@H](CNc1ccccc1OCC1CC1)COc1cccc2[nH]ccc12	ZINC000819451211	FH	On-Demand	Clean	ADRB3	16	57
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819451219	FG	On-Demand	Clean	ADRB2	57	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819451219	FG	On-Demand	Clean	ADRB1	94	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819451219	FG	On-Demand	Clean	TSHR	48	31
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819451219	FG	On-Demand	Clean	ADRB3	58	47
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819451219	FG	On-Demand	Clean	P2RY1	16	41
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819451221	FG	On-Demand	Clean	ADRB2	57	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819451221	FG	On-Demand	Clean	ADRB1	94	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819451221	FG	On-Demand	Clean	TSHR	48	31
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819451221	FG	On-Demand	Clean	ADRB3	58	47
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819451221	FG	On-Demand	Clean	P2RY1	16	41
Cc1nc2cc(NC[C@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)ccc2n1C	ZINC000819451226	GG	On-Demand	Anodyne	GPR119	47	42
Cc1nc2cc(NC[C@@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)ccc2n1C	ZINC000819451227	GG	On-Demand	Anodyne	GPR119	47	42
CCOc1cc(N2CCN(C)CC2)ccc1NCCC(=O)N(C)OC	ZINC000819451234	FD	On-Demand	Anodyne	MAPK7	41	37
C=C(Cl)CSc1nc(C)c(CC(=O)Nc2cc(F)ccc2OC)s1	ZINC000819451262	GJ	On-Demand	Mild	ENPP1	59	30
O=C([C@@H]1SCCc2ccccc21)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451266	DD	On-Demand	Anodyne	CPT1A	42	33
O=C([C@H]1SCCc2ccccc21)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451269	DD	On-Demand	Anodyne	CPT1A	42	33
O=C([C@@H]1SCCc2ccccc21)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451271	DD	On-Demand	Anodyne	CPT1A	42	33
O=C([C@H]1SCCc2ccccc21)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451273	DD	On-Demand	Anodyne	CPT1A	42	33
O=C(C[C@H](O)c1cccc(F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451280	DD	On-Demand	Anodyne	CPT1A	67	42
O=C(C[C@@H](O)c1cccc(F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451282	DD	On-Demand	Anodyne	CPT1A	67	42
O=C(C[C@H](O)c1cccc(F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451284	DD	On-Demand	Anodyne	CPT1A	67	42
O=C(C[C@@H](O)c1cccc(F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451285	DD	On-Demand	Anodyne	CPT1A	67	42
O=C(c1cc(Cc2ccccc2)ccc1O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451291	EE	On-Demand	Anodyne	CPT1A	62	34
O=C(c1cc(Cc2ccccc2)ccc1O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451293	EE	On-Demand	Anodyne	CPT1A	62	34
O=C(/C=C/c1ccnc2ccccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451296	DE	On-Demand	Anodyne	PREP	20	41
O=C(/C=C\c1ccnc2ccccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451298	DE	On-Demand	Anodyne	PREP	20	41
O=C(/C=C/c1ccnc2ccccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451300	DE	On-Demand	Anodyne	PREP	20	41
O=C(/C=C\c1ccnc2ccccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451302	DE	On-Demand	Anodyne	PREP	20	41
O=C(CCOc1ccc(F)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451304	DD	On-Demand	Anodyne	CPT1A	117	50
O=C(CCOc1ccc(F)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451306	DD	On-Demand	Anodyne	CPT1A	117	50
NC(=O)c1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819451317	CC	On-Demand	Anodyne	PREP	16	40
NC(=O)c1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819451321	CC	On-Demand	Anodyne	PREP	16	40
COc1ccccc1N1C[C@@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)CC1=O	ZINC000819451322	FC	On-Demand	Anodyne	HTR1A	54	43
COc1ccccc1N1C[C@@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)CC1=O	ZINC000819451322	FC	On-Demand	Anodyne	DRD2	28	40
COc1ccccc1N1C[C@@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)CC1=O	ZINC000819451322	FC	On-Demand	Anodyne	ADRA1A	32	41
COc1ccccc1N1C[C@@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)CC1=O	ZINC000819451322	FC	On-Demand	Anodyne	HTR7	31	42
COc1ccccc1N1C[C@@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)CC1=O	ZINC000819451322	FC	On-Demand	Anodyne	CPT1A	53	36
COc1ccccc1N1C[C@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)CC1=O	ZINC000819451324	FC	On-Demand	Anodyne	HTR1A	54	43
COc1ccccc1N1C[C@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)CC1=O	ZINC000819451324	FC	On-Demand	Anodyne	DRD2	28	40
COc1ccccc1N1C[C@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)CC1=O	ZINC000819451324	FC	On-Demand	Anodyne	ADRA1A	32	41
COc1ccccc1N1C[C@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)CC1=O	ZINC000819451324	FC	On-Demand	Anodyne	HTR7	31	42
COc1ccccc1N1C[C@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)CC1=O	ZINC000819451324	FC	On-Demand	Anodyne	CPT1A	53	36
COc1ccccc1N1C[C@@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)CC1=O	ZINC000819451325	FC	On-Demand	Anodyne	HTR1A	54	43
COc1ccccc1N1C[C@@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)CC1=O	ZINC000819451325	FC	On-Demand	Anodyne	DRD2	28	40
COc1ccccc1N1C[C@@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)CC1=O	ZINC000819451325	FC	On-Demand	Anodyne	ADRA1A	32	41
COc1ccccc1N1C[C@@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)CC1=O	ZINC000819451325	FC	On-Demand	Anodyne	HTR7	31	42
COc1ccccc1N1C[C@@H](C(=O)N2CCC[C@@H]2c2nn[nH]n2)CC1=O	ZINC000819451325	FC	On-Demand	Anodyne	CPT1A	53	36
COc1ccccc1N1C[C@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)CC1=O	ZINC000819451327	FC	On-Demand	Anodyne	HTR1A	54	43
COc1ccccc1N1C[C@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)CC1=O	ZINC000819451327	FC	On-Demand	Anodyne	DRD2	28	40
COc1ccccc1N1C[C@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)CC1=O	ZINC000819451327	FC	On-Demand	Anodyne	ADRA1A	32	41
COc1ccccc1N1C[C@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)CC1=O	ZINC000819451327	FC	On-Demand	Anodyne	HTR7	31	42
COc1ccccc1N1C[C@H](C(=O)N2CCC[C@H]2c2nn[nH]n2)CC1=O	ZINC000819451327	FC	On-Demand	Anodyne	CPT1A	53	36
O=C(CSc1ccc2ccccc2c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451334	EF	On-Demand	Anodyne	CPT1A	115	41
O=C(CSc1ccc2ccccc2c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451335	EF	On-Demand	Anodyne	CPT1A	115	41
O=C(CCc1nc(-c2cc(Br)cs2)no1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451349	HE	On-Demand	Anodyne	CPT1A	91	36
O=C(CCc1nc(-c2cc(Br)cs2)no1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451350	HE	On-Demand	Anodyne	CPT1A	91	36
O=C(c1csc(-c2cnccn2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451353	ED	On-Demand	Anodyne	CPT1A	43	49
O=C(c1csc(-c2cnccn2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451354	ED	On-Demand	Anodyne	CPT1A	43	49
COc1ccc(-c2nnc(SCC(=O)N3CCC[C@@H]3c3nn[nH]n3)o2)cc1	ZINC000819451355	GD	On-Demand	Anodyne	CPT1A	96	41
COc1ccc(-c2nnc(SCC(=O)N3CCC[C@H]3c3nn[nH]n3)o2)cc1	ZINC000819451356	GD	On-Demand	Anodyne	CPT1A	96	41
O=C(c1ccc2nc(-c3ccccc3)oc2c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451359	FF	On-Demand	Anodyne	CPT1A	96	38
O=C(c1ccc2nc(-c3ccccc3)oc2c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451360	FF	On-Demand	Anodyne	CPT1A	96	38
C/C(=C/c1ccccc1Cl)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451365	DF	On-Demand	Anodyne	CPT1A	62	36
C/C(=C/c1ccccc1Cl)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451368	DF	On-Demand	Anodyne	CPT1A	62	36
O=C(Cn1c(S)nc2ccccc2c1=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451379	FC	On-Demand	Anodyne	CPT1A	95	40
O=C(Cn1c(S)nc2ccccc2c1=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451380	FC	On-Demand	Anodyne	CPT1A	95	40
O=C(COc1ccccc1OCc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451381	GF	On-Demand	Anodyne	PRCP	18	40
O=C(COc1ccccc1OCc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451381	GF	On-Demand	Anodyne	CPT1A	139	48
O=C(COc1ccccc1OCc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451381	GF	On-Demand	Anodyne	CPT2	45	35
O=C(COc1ccccc1OCc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451381	GF	On-Demand	Anodyne	PREP	65	38
O=C(COc1ccccc1OCc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451382	GF	On-Demand	Anodyne	PRCP	18	40
O=C(COc1ccccc1OCc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451382	GF	On-Demand	Anodyne	CPT1A	139	48
O=C(COc1ccccc1OCc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451382	GF	On-Demand	Anodyne	CPT2	45	35
O=C(COc1ccccc1OCc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451382	GF	On-Demand	Anodyne	PREP	65	38
Cc1nn(-c2ccccc2)c(C)c1CC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451383	FD	On-Demand	Anodyne	CPT1A	95	42
Cc1nn(-c2ccccc2)c(C)c1CC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451384	FD	On-Demand	Anodyne	CPT1A	95	42
CN(C)CCOc1ccc(NC[C@H](O)c2ccccc2)cc1Cl	ZINC000819451386	EG	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1ccc(NC[C@@H](O)c2ccccc2)cc1Cl	ZINC000819451387	EG	On-Demand	Anodyne	ESRRG	44	33
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCc3nccn3C)cc2)cc1	ZINC000819451402	GG	On-Demand	Anodyne	ADRB2	23	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCc3nccn3C)cc2)cc1	ZINC000819451402	GG	On-Demand	Anodyne	ADRB1	49	42
O=C(/C=C\c1cnc2ccccc2n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451403	DD	On-Demand	Anodyne	CPT1A	57	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCc3nccn3C)cc2)cc1	ZINC000819451404	GG	On-Demand	Anodyne	ADRB2	23	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCc3nccn3C)cc2)cc1	ZINC000819451404	GG	On-Demand	Anodyne	ADRB1	49	42
O=C(/C=C/c1cnc2ccccc2n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451406	DD	On-Demand	Anodyne	CPT1A	57	41
O=C(/C=C/c1cnc2ccccc2n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451407	DD	On-Demand	Anodyne	CPT1A	57	41
O=C(/C=C\c1cnc2ccccc2n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451409	DD	On-Demand	Anodyne	CPT1A	57	41
CN(C)CCOc1ccc(NCCC(=O)Nc2ccccc2[N+](=O)[O-])cc1	ZINC000819451430	FF	On-Demand	Bother	COLA	47	33
CN(C)CCOc1ccc(NCCC(=O)Nc2ccccc2[N+](=O)[O-])cc1	ZINC000819451430	FF	On-Demand	Bother	ESRRG	47	35
CN(C)CCOc1ccc(NC[C@@H](O)c2ccccc2Br)cc1	ZINC000819451444	GH	On-Demand	Anodyne	LTA4H	15	43
CN(C)CCOc1ccc(NC[C@@H](O)c2ccccc2Br)cc1	ZINC000819451444	GH	On-Demand	Anodyne	ESRRG	53	38
CN(C)CCOc1ccc(NC[C@H](O)c2ccccc2Br)cc1	ZINC000819451445	GH	On-Demand	Anodyne	LTA4H	15	43
CN(C)CCOc1ccc(NC[C@H](O)c2ccccc2Br)cc1	ZINC000819451445	GH	On-Demand	Anodyne	ESRRG	53	38
CN(C)CCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1	ZINC000819451471	EG	On-Demand	Anodyne	ESRRG	47	34
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCc3nccn3C)cc2)c1	ZINC000819451474	GG	On-Demand	Anodyne	ADRB1	47	39
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCc3nccn3C)cc2)c1	ZINC000819451474	GG	On-Demand	Anodyne	ABCB1	17	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCc3nccn3C)cc2)c1	ZINC000819451475	GG	On-Demand	Anodyne	ADRB1	47	39
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCc3nccn3C)cc2)c1	ZINC000819451475	GG	On-Demand	Anodyne	ABCB1	17	42
COCCNC(=O)c1ccccc1NC(=O)c1cc(F)c(F)c(F)c1F	ZINC000819451478	FF	On-Demand	Anodyne	KIT	15	42
COCCNC(=O)c1ccccc1NC(=O)c1cc(F)c(F)c(F)c1F	ZINC000819451478	FF	On-Demand	Anodyne	KCNK3	52	33
COCCNC(=O)c1ccccc1NC(=O)c1cc(F)c(F)c(F)c1F	ZINC000819451478	FF	On-Demand	Anodyne	KCNK9	47	33
CON(C)C(=O)CCNc1ccc(OCCN(C)C)c(Cl)c1	ZINC000819451481	EE	On-Demand	Anodyne	MCHR2	18	40
Cc1ccc(OC[C@H](O)CNc2ccc(OCc3nccn3C)cc2)cc1	ZINC000819451484	FG	On-Demand	Anodyne	ADRB2	28	47
Cc1ccc(OC[C@H](O)CNc2ccc(OCc3nccn3C)cc2)cc1	ZINC000819451484	FG	On-Demand	Anodyne	ADRB1	44	41
Cc1ccc(OC[C@@H](O)CNc2ccc(OCc3nccn3C)cc2)cc1	ZINC000819451485	FG	On-Demand	Anodyne	ADRB2	28	47
Cc1ccc(OC[C@@H](O)CNc2ccc(OCc3nccn3C)cc2)cc1	ZINC000819451485	FG	On-Demand	Anodyne	ADRB1	44	41
CN(C)CCOc1ccc(NCC2(O)CCC2)cc1	ZINC000819451486	CD	On-Demand	Anodyne	ESRRG	48	36
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819451489	EF	On-Demand	Anodyne	ADRB2	40	42
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819451489	EF	On-Demand	Anodyne	ADRB1	61	42
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819451489	EF	On-Demand	Anodyne	GRIN1	23	46
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819451489	EF	On-Demand	Anodyne	ADRB3	33	41
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819451489	EF	On-Demand	Anodyne	ESRRG	45	34
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819451490	EF	On-Demand	Anodyne	ADRB2	40	42
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819451490	EF	On-Demand	Anodyne	ADRB1	61	42
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819451490	EF	On-Demand	Anodyne	GRIN1	23	46
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819451490	EF	On-Demand	Anodyne	ADRB3	33	41
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819451490	EF	On-Demand	Anodyne	ESRRG	45	34
CN(C)CCOc1ccc(NC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819451491	EG	On-Demand	Anodyne	ESRRG	51	37
CN(C)CCOc1ccc(NC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819451492	EG	On-Demand	Anodyne	ESRRG	51	37
CN(C)CCOc1ccc(NC[C@H](O)CN2CCOCC2)cc1	ZINC000819451495	DC	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1ccc(NC[C@@H](O)CN2CCOCC2)cc1	ZINC000819451496	DC	On-Demand	Anodyne	ESRRG	44	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)Cc1ccc(F)cc1	ZINC000819451507	FD	On-Demand	Anodyne	PAPA1_CARPA	30	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)Cc1ccc(F)cc1	ZINC000819451507	FD	On-Demand	Anodyne	FPR1	40	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1ccc(F)cc1	ZINC000819451508	FD	On-Demand	Anodyne	PAPA1_CARPA	30	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)Cc1ccc(F)cc1	ZINC000819451508	FD	On-Demand	Anodyne	FPR1	40	34
O[C@@H](CNc1ccc(OCc2noc(C3CC3)n2)cc1)c1cccnc1	ZINC000819451513	FG	On-Demand	Anodyne	ADRB2	16	41
O[C@@H](CNc1ccc(OCc2noc(C3CC3)n2)cc1)c1cccnc1	ZINC000819451513	FG	On-Demand	Anodyne	ADRB1	19	42
O[C@@H](CNc1ccc(OCc2noc(C3CC3)n2)cc1)c1cccnc1	ZINC000819451513	FG	On-Demand	Anodyne	ADRB3	71	47
O[C@H](CNc1ccc(OCc2noc(C3CC3)n2)cc1)c1cccnc1	ZINC000819451514	FG	On-Demand	Anodyne	ADRB2	16	41
O[C@H](CNc1ccc(OCc2noc(C3CC3)n2)cc1)c1cccnc1	ZINC000819451514	FG	On-Demand	Anodyne	ADRB1	19	42
O[C@H](CNc1ccc(OCc2noc(C3CC3)n2)cc1)c1cccnc1	ZINC000819451514	FG	On-Demand	Anodyne	ADRB3	71	47
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(F)cc1OCC1CC1	ZINC000819451516	GG	On-Demand	Bother	ADRB1	49	38
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(F)cc1OCC1CC1	ZINC000819451517	GG	On-Demand	Bother	ADRB1	49	38
COC[C@@H](O)CNc1ccccc1OCC1CC1	ZINC000819451523	CD	On-Demand	Clean	ADRB2	29	41
COC[C@@H](O)CNc1ccccc1OCC1CC1	ZINC000819451523	CD	On-Demand	Clean	ADRB1	57	36
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](O)COc1ccccc1	ZINC000819451540	GF	On-Demand	Anodyne	ADRB2	35	41
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](O)COc1ccccc1	ZINC000819451540	GF	On-Demand	Anodyne	ADRB1	42	39
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](O)COc1ccccc1	ZINC000819451540	GF	On-Demand	Anodyne	ABCB1	43	39
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](O)COc1ccccc1	ZINC000819451541	GF	On-Demand	Anodyne	ADRB2	35	41
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](O)COc1ccccc1	ZINC000819451541	GF	On-Demand	Anodyne	ADRB1	42	39
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](O)COc1ccccc1	ZINC000819451541	GF	On-Demand	Anodyne	ABCB1	43	39
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](O)CC1CCCC1	ZINC000819451567	FG	On-Demand	Anodyne	TTK	28	40
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](O)CC1CCCC1	ZINC000819451568	FG	On-Demand	Anodyne	TTK	28	40
O[C@@H](CNc1ccc(F)cc1OCC1CC1)c1cccnc1	ZINC000819451578	DG	On-Demand	Anodyne	ADRB3	54	39
O[C@H](CNc1ccc(F)cc1OCC1CC1)c1cccnc1	ZINC000819451580	DG	On-Demand	Anodyne	ADRB3	54	39
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819451583	GI	On-Demand	Anodyne	ADRB2	51	50
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819451583	GI	On-Demand	Anodyne	ADRB1	64	45
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819451583	GI	On-Demand	Anodyne	ADRB3	39	44
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819451583	GI	On-Demand	Anodyne	CASR	18	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819451583	GI	On-Demand	Anodyne	CTSK	30	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819451583	GI	On-Demand	Anodyne	ABCB1	19	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819451583	GI	On-Demand	Anodyne	FPR1	44	37
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819451583	GI	On-Demand	Anodyne	PDS	58	44
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819451585	GI	On-Demand	Anodyne	ADRB2	51	50
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819451585	GI	On-Demand	Anodyne	ADRB1	64	45
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819451585	GI	On-Demand	Anodyne	ADRB3	39	44
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819451585	GI	On-Demand	Anodyne	CASR	18	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819451585	GI	On-Demand	Anodyne	CTSK	30	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819451585	GI	On-Demand	Anodyne	ABCB1	19	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819451585	GI	On-Demand	Anodyne	FPR1	44	37
C[C@H](NC(=O)OC(C)(C)C)c1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819451585	GI	On-Demand	Anodyne	PDS	58	44
CCCCS(=O)(=O)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819451594	EF	On-Demand	Anodyne	ADRB2	30	48
CCCCS(=O)(=O)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819451594	EF	On-Demand	Anodyne	ADRB1	28	48
CCCCS(=O)(=O)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819451594	EF	On-Demand	Anodyne	ADRB3	106	52
CCCCS(=O)(=O)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819451596	EF	On-Demand	Anodyne	ADRB2	30	48
CCCCS(=O)(=O)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819451596	EF	On-Demand	Anodyne	ADRB1	28	48
CCCCS(=O)(=O)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819451596	EF	On-Demand	Anodyne	ADRB3	106	52
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3cccnc3)CC1)C2	ZINC000819451603	FF	On-Demand	Anodyne	ADAM10	22	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3cccnc3)CC1)C2	ZINC000819451605	FF	On-Demand	Anodyne	ADAM10	22	41
CC(C)(C)OC(=O)Cc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819451613	EH	On-Demand	Anodyne	ADRB2	48	38
CC(C)(C)OC(=O)Cc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819451613	EH	On-Demand	Anodyne	ADRB1	34	40
CC(C)(C)OC(=O)Cc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819451613	EH	On-Demand	Anodyne	ADRB3	53	40
CC(C)(C)OC(=O)Cc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819451614	EH	On-Demand	Anodyne	ADRB2	48	38
CC(C)(C)OC(=O)Cc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819451614	EH	On-Demand	Anodyne	ADRB1	34	40
CC(C)(C)OC(=O)Cc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819451614	EH	On-Demand	Anodyne	ADRB3	53	40
Cn1cnc(CNC(=O)CC[C@@H](CC2CCCCC2)NC(=O)OC(C)(C)C)n1	ZINC000819451637	GG	On-Demand	Anodyne	REN	61	45
Cn1cnc(CNC(=O)CC[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)n1	ZINC000819451639	GG	On-Demand	Anodyne	REN	61	45
O[C@@H](CNc1ccc(OCc2noc(C3CC3)n2)cc1)COc1ccccc1	ZINC000819451641	GG	On-Demand	Anodyne	ADRB2	40	39
O[C@@H](CNc1ccc(OCc2noc(C3CC3)n2)cc1)COc1ccccc1	ZINC000819451641	GG	On-Demand	Anodyne	ADRB1	65	38
O[C@@H](CNc1ccc(OCc2noc(C3CC3)n2)cc1)COc1ccccc1	ZINC000819451641	GG	On-Demand	Anodyne	ADRB3	49	38
O[C@H](CNc1ccc(OCc2noc(C3CC3)n2)cc1)COc1ccccc1	ZINC000819451643	GG	On-Demand	Anodyne	ADRB2	40	39
O[C@H](CNc1ccc(OCc2noc(C3CC3)n2)cc1)COc1ccccc1	ZINC000819451643	GG	On-Demand	Anodyne	ADRB1	65	38
O[C@H](CNc1ccc(OCc2noc(C3CC3)n2)cc1)COc1ccccc1	ZINC000819451643	GG	On-Demand	Anodyne	ADRB3	49	38
CCOc1cc(N2CCN(C)CC2)ccc1NCCC(N)=O	ZINC000819451662	DD	On-Demand	Anodyne	CSF1R	19	40
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)S(N)(=O)=O	ZINC000819451677	FC	On-Demand	Mild	PAPA1_CARPA	45	54
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)S(N)(=O)=O	ZINC000819451677	FC	On-Demand	Mild	CTSK	15	51
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)S(N)(=O)=O	ZINC000819451678	FC	On-Demand	Mild	PAPA1_CARPA	45	54
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)S(N)(=O)=O	ZINC000819451678	FC	On-Demand	Mild	CTSK	15	51
O=C([C@H]1CC(c2ccccc2)=NO1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451707	DD	On-Demand	Anodyne	CPT1A	87	37
O=C([C@H]1CC(c2ccccc2)=NO1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451707	DD	On-Demand	Anodyne	PREP	53	33
O=C([C@H]1CC(c2ccccc2)=NO1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451707	DD	On-Demand	Anodyne	LUCI_PHOPY	40	35
O=C([C@@H]1CC(c2ccccc2)=NO1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451708	DD	On-Demand	Anodyne	CPT1A	87	37
O=C([C@@H]1CC(c2ccccc2)=NO1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451708	DD	On-Demand	Anodyne	PREP	53	33
O=C([C@@H]1CC(c2ccccc2)=NO1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451708	DD	On-Demand	Anodyne	LUCI_PHOPY	40	35
O=C([C@H]1CC(c2ccccc2)=NO1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451709	DD	On-Demand	Anodyne	CPT1A	87	37
O=C([C@H]1CC(c2ccccc2)=NO1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451709	DD	On-Demand	Anodyne	PREP	53	33
O=C([C@H]1CC(c2ccccc2)=NO1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451709	DD	On-Demand	Anodyne	LUCI_PHOPY	40	35
O=C([C@@H]1CC(c2ccccc2)=NO1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451710	DD	On-Demand	Anodyne	CPT1A	87	37
O=C([C@@H]1CC(c2ccccc2)=NO1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451710	DD	On-Demand	Anodyne	PREP	53	33
O=C([C@@H]1CC(c2ccccc2)=NO1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451710	DD	On-Demand	Anodyne	LUCI_PHOPY	40	35
Cc1ccc(OCc2cccc(C(=O)N3CCC[C@H]3c3nn[nH]n3)c2)cn1	ZINC000819451717	FE	On-Demand	Anodyne	CPT1A	68	36
Cc1ccc(OCc2cccc(C(=O)N3CCC[C@H]3c3nn[nH]n3)c2)cn1	ZINC000819451717	FE	On-Demand	Anodyne	GYS1	16	43
Cc1ccc(OCc2cccc(C(=O)N3CCC[C@@H]3c3nn[nH]n3)c2)cn1	ZINC000819451718	FE	On-Demand	Anodyne	CPT1A	68	36
Cc1ccc(OCc2cccc(C(=O)N3CCC[C@@H]3c3nn[nH]n3)c2)cn1	ZINC000819451718	FE	On-Demand	Anodyne	GYS1	16	43
O=C(COc1ccc(Cl)cc1Cl)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451731	EE	On-Demand	Anodyne	CPT1A	120	43
O=C(COc1ccc(Cl)cc1Cl)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451732	EE	On-Demand	Anodyne	CPT1A	120	43
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451737	HC	On-Demand	Anodyne	CACNA1B	53	33
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451737	HC	On-Demand	Anodyne	CPT1A	46	41
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451737	HC	On-Demand	Anodyne	CCR2	54	37
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451737	HC	On-Demand	Anodyne	SFRP1	115	35
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451737	HC	On-Demand	Anodyne	WNT3	82	35
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451738	HC	On-Demand	Anodyne	CACNA1B	53	33
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451738	HC	On-Demand	Anodyne	CPT1A	46	41
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451738	HC	On-Demand	Anodyne	CCR2	54	37
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451738	HC	On-Demand	Anodyne	SFRP1	115	35
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451738	HC	On-Demand	Anodyne	WNT3	82	35
O=C(/C=C/c1cccc(OC2CCCC2)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451743	FF	On-Demand	Anodyne	CPT1A	111	39
O=C(/C=C\c1cccc(OC2CCCC2)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451744	FF	On-Demand	Anodyne	CPT1A	111	39
O=C(/C=C\c1cccc(OC2CCCC2)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451745	FF	On-Demand	Anodyne	CPT1A	111	39
O=C(/C=C/c1cccc(OC2CCCC2)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451746	FF	On-Demand	Anodyne	CPT1A	111	39
O=C(c1ccc(OC2CCCC2)nc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451753	ED	On-Demand	Anodyne	CPT1A	56	35
O=C(c1ccc(OC2CCCC2)nc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451755	ED	On-Demand	Anodyne	CPT1A	56	35
CN(C)CCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819451759	DF	On-Demand	Anodyne	LTA4H	43	55
CN(C)CCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819451759	DF	On-Demand	Anodyne	ESRRG	55	41
CN(C)CCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819451760	DF	On-Demand	Anodyne	LTA4H	43	55
CN(C)CCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819451760	DF	On-Demand	Anodyne	ESRRG	55	41
Cn1ccnc1COc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819451774	GI	On-Demand	Anodyne	CYP26A1	29	40
O=C(Cc1ccc(Br)c(F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451777	FE	On-Demand	Anodyne	CPT1A	43	36
O=C(Cc1ccc(Br)c(F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451778	FE	On-Demand	Anodyne	CPT1A	43	36
Cn1ccnc1COc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819451780	GI	On-Demand	Anodyne	CYP26A1	29	40
CN(C)CCOc1ccc(NC[C@H](O)CN(C)C2CC2)cc1	ZINC000819451782	DD	On-Demand	Anodyne	ESRRG	45	33
CN(C)CCOc1ccc(NC[C@@H](O)CN(C)C2CC2)cc1	ZINC000819451784	DD	On-Demand	Anodyne	ESRRG	45	33
CN(C)CCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819451795	EG	On-Demand	Anodyne	ADRB2	21	53
CN(C)CCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819451795	EG	On-Demand	Anodyne	ADRB1	35	48
CN(C)CCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819451795	EG	On-Demand	Anodyne	ADRB3	51	46
CN(C)CCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819451795	EG	On-Demand	Anodyne	ESRRG	50	37
CN(C)CCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819451797	EG	On-Demand	Anodyne	ADRB2	21	53
CN(C)CCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819451797	EG	On-Demand	Anodyne	ADRB1	35	48
CN(C)CCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819451797	EG	On-Demand	Anodyne	ADRB3	51	46
CN(C)CCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819451797	EG	On-Demand	Anodyne	ESRRG	50	37
C[C@H](SCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1nc2ccccc2[nH]1	ZINC000819451812	FE	On-Demand	Anodyne	CPT1A	66	36
CN(C)CCOc1ccc(NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000819451813	GH	On-Demand	Anodyne	ESRRG	42	31
CN(C)CCOc1ccc(NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000819451814	GH	On-Demand	Anodyne	ESRRG	42	31
Cc1ccc(OC[C@H](O)CNc2ccc(OCCN(C)C)cc2)cc1	ZINC000819451818	EF	On-Demand	Anodyne	ADRB2	39	53
Cc1ccc(OC[C@H](O)CNc2ccc(OCCN(C)C)cc2)cc1	ZINC000819451818	EF	On-Demand	Anodyne	ADRB1	55	45
Cc1ccc(OC[C@H](O)CNc2ccc(OCCN(C)C)cc2)cc1	ZINC000819451818	EF	On-Demand	Anodyne	ADRB3	30	42
Cc1ccc(OC[C@H](O)CNc2ccc(OCCN(C)C)cc2)cc1	ZINC000819451818	EF	On-Demand	Anodyne	ESRRG	46	34
Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN(C)C)cc2)cc1	ZINC000819451819	EF	On-Demand	Anodyne	ADRB2	39	53
Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN(C)C)cc2)cc1	ZINC000819451819	EF	On-Demand	Anodyne	ADRB1	55	45
Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN(C)C)cc2)cc1	ZINC000819451819	EF	On-Demand	Anodyne	ADRB3	30	42
Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN(C)C)cc2)cc1	ZINC000819451819	EF	On-Demand	Anodyne	ESRRG	46	34
C[C@H](SCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1nc2ccccc2[nH]1	ZINC000819451828	FE	On-Demand	Anodyne	CPT1A	66	36
O=C(c1cccc(C(F)F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451834	CE	On-Demand	Anodyne	CPT1A	43	33
O=C(c1cccc(C(F)F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451835	CE	On-Demand	Anodyne	CPT1A	43	33
Cn1ccnc1COc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819451838	GF	On-Demand	Mild	ADRB1	50	38
Cn1ccnc1COc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819451841	GF	On-Demand	Mild	ADRB1	50	38
CCOc1ccc(C2=CCN(C(=O)[C@@H]3C[C@H]4CC[C@H]3N(C(=O)OC)C4)CC2)cc1	ZINC000819451843	GH	On-Demand	Anodyne	ADAM10	33	42
CCOc1ccc(C2=CCN(C(=O)[C@H]3C[C@H]4CC[C@H]3N(C(=O)OC)C4)CC2)cc1	ZINC000819451844	GH	On-Demand	Anodyne	ADAM10	33	42
CN(C)CCOc1ccc(NC[C@H](O)c2ccccc2Cl)cc1	ZINC000819451845	EG	On-Demand	Anodyne	ESRRG	53	40
CN(C)CCOc1ccc(NC[C@H](O)c2cccnc2)cc1Cl	ZINC000819451846	EF	On-Demand	Anodyne	ADRB3	63	46
CN(C)CCOc1ccc(NC[C@H](O)c2cccnc2)cc1Cl	ZINC000819451846	EF	On-Demand	Anodyne	CYP51A1	15	40
CN(C)CCOc1ccc(NC[C@@H](O)c2cccnc2)cc1Cl	ZINC000819451847	EF	On-Demand	Anodyne	ADRB3	63	46
CN(C)CCOc1ccc(NC[C@@H](O)c2cccnc2)cc1Cl	ZINC000819451847	EF	On-Demand	Anodyne	CYP51A1	15	40
CN(C)CCOc1ccc(NC[C@H](O)Cc2ccc(F)cc2)cc1	ZINC000819451849	EF	On-Demand	Anodyne	GRIN1	15	42
CN(C)CCOc1ccc(NC[C@H](O)Cc2ccc(F)cc2)cc1	ZINC000819451849	EF	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1ccc(NC[C@@H](O)Cc2ccc(F)cc2)cc1	ZINC000819451850	EF	On-Demand	Anodyne	GRIN1	15	42
CN(C)CCOc1ccc(NC[C@@H](O)Cc2ccc(F)cc2)cc1	ZINC000819451850	EF	On-Demand	Anodyne	ESRRG	44	33
COc1ccc(CC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1F	ZINC000819451851	DD	On-Demand	Anodyne	CPT1A	59	36
COc1ccc(CC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1F	ZINC000819451853	DD	On-Demand	Anodyne	CPT1A	59	36
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2)cc1Cl	ZINC000819451861	FG	On-Demand	Anodyne	ADRB2	36	43
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2)cc1Cl	ZINC000819451861	FG	On-Demand	Anodyne	ADRB1	48	39
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2)cc1Cl	ZINC000819451861	FG	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2)cc1Cl	ZINC000819451861	FG	On-Demand	Anodyne	CDK4	19	43
O=C(c1ccc(COc2ccc3ccccc3c2)o1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819451862	GH	On-Demand	Anodyne	CPT1A	101	36
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1Cl	ZINC000819451863	FG	On-Demand	Anodyne	ADRB2	36	43
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1Cl	ZINC000819451863	FG	On-Demand	Anodyne	ADRB1	48	39
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1Cl	ZINC000819451863	FG	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1Cl	ZINC000819451863	FG	On-Demand	Anodyne	CDK4	19	43
O=C(c1ccc(COc2ccc3ccccc3c2)o1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819451865	GH	On-Demand	Anodyne	CPT1A	101	36
CN(C)CCOc1ccc(NC[C@H](O)C(C)(C)C)cc1	ZINC000819451870	CE	On-Demand	Anodyne	ESRRG	49	37
CN(C)CCOc1ccc(NC[C@@H](O)C(C)(C)C)cc1	ZINC000819451871	CE	On-Demand	Anodyne	ESRRG	49	37
CN(C)CCOc1ccc(NC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819451873	DF	On-Demand	Anodyne	ESRRG	48	35
CN(C)CCOc1ccc(NC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819451874	DF	On-Demand	Anodyne	ESRRG	48	35
CN(C)CCOc1ccc(NCC2(O)CCS(=O)(=O)CC2)cc1	ZINC000819451875	EC	On-Demand	Anodyne	ESRRG	45	33
CN(C)CCOc1ccc(NCCS(=O)(=O)c2ccccc2)cc1	ZINC000819451876	EF	On-Demand	Anodyne	LTA4H	23	48
CN(C)CCOc1ccc(NCCS(=O)(=O)c2ccccc2)cc1	ZINC000819451876	EF	On-Demand	Anodyne	ESRRG	51	39
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819451883	FG	On-Demand	Anodyne	ADRB2	40	44
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819451883	FG	On-Demand	Anodyne	ADRB1	58	38
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819451883	FG	On-Demand	Anodyne	GRIN1	26	41
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819451883	FG	On-Demand	Anodyne	ADRB3	24	42
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819451883	FG	On-Demand	Anodyne	ESRRG	48	36
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819451883	FG	On-Demand	Anodyne	CDK4	18	41
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819451884	FG	On-Demand	Anodyne	ADRB2	40	44
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819451884	FG	On-Demand	Anodyne	ADRB1	58	38
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819451884	FG	On-Demand	Anodyne	GRIN1	26	41
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819451884	FG	On-Demand	Anodyne	ADRB3	24	42
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819451884	FG	On-Demand	Anodyne	ESRRG	48	36
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819451884	FG	On-Demand	Anodyne	CDK4	18	41
CC[C@H](O)CNc1ccc(OCCN2CCCC2)c(C)c1	ZINC000819451894	CF	On-Demand	Anodyne	HTR2A	22	40
CC[C@H](O)CNc1ccc(OCCN2CCCC2)c(C)c1	ZINC000819451894	CF	On-Demand	Anodyne	PSMB1	41	36
CCOc1cc(N2CCN(C)CC2)ccc1NCC1(O)CCCC1	ZINC000819451913	EF	On-Demand	Anodyne	HCN1	54	42
CCOc1cc(N2CCN(C)CC2)ccc1NCC1(O)CCCC1	ZINC000819451913	EF	On-Demand	Anodyne	HCN4	43	33
O[C@H](CNc1ccccc1OCC1CC1)COCc1ccccc1	ZINC000819451920	EG	On-Demand	Clean	ADRB1	25	45
O[C@@H](CNc1ccccc1OCC1CC1)COCc1ccccc1	ZINC000819451922	EG	On-Demand	Clean	ADRB1	25	45
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](O)c1cccnc1	ZINC000819451925	FE	On-Demand	Anodyne	ADRB3	51	43
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](O)c1cccnc1	ZINC000819451927	FE	On-Demand	Anodyne	ADRB3	51	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OCC2CC2)c1	ZINC000819451935	FH	On-Demand	Clean	ADRB2	38	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OCC2CC2)c1	ZINC000819451935	FH	On-Demand	Clean	ADRB1	74	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OCC2CC2)c1	ZINC000819451935	FH	On-Demand	Clean	ABCB1	30	46
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)c1	ZINC000819451937	FH	On-Demand	Clean	ADRB2	38	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)c1	ZINC000819451937	FH	On-Demand	Clean	ADRB1	74	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)c1	ZINC000819451937	FH	On-Demand	Clean	ABCB1	30	46
CCOc1cc(N2CCN(C)CC2)ccc1NCC1(O)CCC1	ZINC000819451938	DE	On-Demand	Anodyne	HCN1	51	40
CCOc1cc(N2CCN(C)CC2)ccc1NCC1(O)CCC1	ZINC000819451938	DE	On-Demand	Anodyne	HCN4	41	31
CON(C)C(=O)CCNc1cccc(CSC2CCCC2)c1	ZINC000819451946	DH	On-Demand	Anodyne	QRFPR	42	35
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819451974	GH	On-Demand	Anodyne	ADRB1	27	40
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819451974	GH	On-Demand	Anodyne	ADRB3	43	42
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819451974	GH	On-Demand	Anodyne	IGF1R	44	48
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819451974	GH	On-Demand	Anodyne	CYP3A4	54	42
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819451976	GH	On-Demand	Anodyne	ADRB1	27	40
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819451976	GH	On-Demand	Anodyne	ADRB3	43	42
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819451976	GH	On-Demand	Anodyne	IGF1R	44	48
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819451976	GH	On-Demand	Anodyne	CYP3A4	54	42
O=C1CCc2cc(OC[C@@H](O)CNc3ccccc3OCC3CC3)ccc2N1	ZINC000819451989	GG	On-Demand	Clean	ADRB1	33	42
O=C1CCc2cc(OC[C@H](O)CNc3ccccc3OCC3CC3)ccc2N1	ZINC000819451991	GG	On-Demand	Clean	ADRB1	33	42
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](O)CCc1ccccc1	ZINC000819451994	GG	On-Demand	Anodyne	ABCB1	50	41
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](O)CCc1ccccc1	ZINC000819451996	GG	On-Demand	Anodyne	ABCB1	50	41
CCOc1cc(N2CCN(C)CC2)ccc1NCC1(O)CCS(=O)(=O)CC1	ZINC000819452021	GD	On-Demand	Anodyne	HCN1	51	40
CCOc1cc(N2CCN(C)CC2)ccc1NCC1(O)CCS(=O)(=O)CC1	ZINC000819452021	GD	On-Demand	Anodyne	HCN4	41	32
CCCCS(=O)(=O)Nc1ccc(NCCC(=O)N(C)OC)cc1	ZINC000819452031	EE	On-Demand	Anodyne	PTPRB	44	32
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)c1	ZINC000819452055	FG	On-Demand	Clean	ADRB2	23	42
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)c1	ZINC000819452055	FG	On-Demand	Clean	ADRB1	53	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)c1	ZINC000819452055	FG	On-Demand	Clean	ADRB3	17	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccccc2OCC2CC2)c1	ZINC000819452057	FG	On-Demand	Clean	ADRB2	23	42
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccccc2OCC2CC2)c1	ZINC000819452057	FG	On-Demand	Clean	ADRB1	53	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccccc2OCC2CC2)c1	ZINC000819452057	FG	On-Demand	Clean	ADRB3	17	43
NC(=O)c1cc(N2CCCCC2)ccc1NC(=O)c1cc2c(cn1)OCCO2	ZINC000819452058	GE	On-Demand	Anodyne	MAPK10	40	39
NC(=O)c1cc(N2CCCCC2)ccc1NC(=O)c1cc2c(cn1)OCCO2	ZINC000819452058	GE	On-Demand	Anodyne	CSF1R	21	40
NC(=O)c1cc(N2CCCCC2)ccc1NC(=O)c1cc2c(cn1)OCCO2	ZINC000819452058	GE	On-Demand	Anodyne	STAT6	52	33
CC(C)(C)OC(=O)Cc1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819452061	FH	On-Demand	Bother	CACNA1D	53	32
CC(C)(C)OC(=O)Cc1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819452063	FH	On-Demand	Bother	CACNA1D	53	32
NC(=O)CCNc1ccc(OCc2noc(C3CC3)n2)cc1	ZINC000819452067	DD	On-Demand	Anodyne	ETHR	50	31
OC1(CNc2ccccc2OCC2CC2)CCCC1	ZINC000819452079	CG	On-Demand	Anodyne	HCN1	42	33
OC1(CNc2ccccc2OCC2CC2)CCCC1	ZINC000819452079	CG	On-Demand	Anodyne	HCN4	43	33
Cc1ccc(NC[C@H](O)c2cccc(F)c2)cc1OCC1CCOCC1	ZINC000819452084	FI	On-Demand	Anodyne	CYP3A4	44	33
Cc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1OCC1CCOCC1	ZINC000819452085	FI	On-Demand	Anodyne	CYP3A4	44	33
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccccc2OCC2CC2)CC1	ZINC000819452091	GH	On-Demand	Anodyne	GPR119	59	48
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccccc2OCC2CC2)CC1	ZINC000819452092	GH	On-Demand	Anodyne	GPR119	59	48
N#Cc1ccccc1/C=C/C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452112	CD	On-Demand	Mild	DPP4	28	40
N#Cc1ccccc1/C=C\C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452113	CD	On-Demand	Mild	DPP4	28	40
N#Cc1ccccc1/C=C/C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452114	CD	On-Demand	Mild	DPP4	28	40
N#Cc1ccccc1/C=C\C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452115	CD	On-Demand	Mild	DPP4	28	40
O=C(c1ccc(Oc2ccc(Br)cc2)c(F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452122	IH	On-Demand	Anodyne	CPT1A	44	36
O=C(c1ccc(Oc2ccc(Br)cc2)c(F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452123	IH	On-Demand	Anodyne	CPT1A	44	36
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452131	GD	On-Demand	Anodyne	CPT1A	56	34
O=C(CN1c2cccc3cccc(c23)S1(=O)=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452133	GD	On-Demand	Anodyne	CPT1A	56	34
COC[C@@H](O)CNc1ccc(OCCN(C)C)cc1	ZINC000819452138	CD	On-Demand	Anodyne	ADRB2	24	41
COC[C@@H](O)CNc1ccc(OCCN(C)C)cc1	ZINC000819452138	CD	On-Demand	Anodyne	ADRB1	37	41
COC[C@@H](O)CNc1ccc(OCCN(C)C)cc1	ZINC000819452138	CD	On-Demand	Anodyne	ESRRG	48	36
O=C(/C=C\Sc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452142	DE	On-Demand	Anodyne	CPT1A	52	36
O=C(/C=C/Sc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452144	DE	On-Demand	Anodyne	CPT1A	52	36
O=C(/C=C\Sc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452146	DE	On-Demand	Anodyne	CPT1A	52	36
O=C(/C=C/Sc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452147	DE	On-Demand	Anodyne	CPT1A	52	36
CCc1nc2ccccc2n1CC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452165	ED	On-Demand	Anodyne	CPT1A	85	36
CCc1nc2ccccc2n1CC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452167	ED	On-Demand	Anodyne	CPT1A	85	36
CN(C)CCOc1ccc(NC[C@H](O)Cn2cccn2)cc1	ZINC000819452168	DD	On-Demand	Anodyne	ESRRG	46	38
CN(C)CCOc1ccc(NC[C@@H](O)Cn2cccn2)cc1	ZINC000819452170	DD	On-Demand	Anodyne	ESRRG	46	38
CN(C)CCOc1ccc(NCC(C)(C)O)cc1	ZINC000819452171	CD	On-Demand	Anodyne	LTA4H	19	50
CN(C)CCOc1ccc(NCC(C)(C)O)cc1	ZINC000819452171	CD	On-Demand	Anodyne	ESRRG	52	39
CN(C)CCOc1ccc(NCC2(O)CCCC2)cc1	ZINC000819452173	CE	On-Demand	Anodyne	ESRRG	48	36
O=C(Cc1noc2ccccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452181	CD	On-Demand	Anodyne	CPT1A	98	40
O=C(Cc1noc2ccccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452183	CD	On-Demand	Anodyne	CPT1A	98	40
CN(C)CCOc1ccc(NC[C@@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819452198	FH	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1ccc(NC[C@H](O)c2ccc(Cl)c(F)c2)cc1	ZINC000819452200	FH	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819452203	FH	On-Demand	Anodyne	ADRB3	18	43
CN(C)CCOc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819452203	FH	On-Demand	Anodyne	ESRRG	46	33
CN(C)CCOc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819452203	FH	On-Demand	Anodyne	GALR3	51	44
CN(C)CCOc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819452205	FH	On-Demand	Anodyne	ADRB3	18	43
CN(C)CCOc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819452205	FH	On-Demand	Anodyne	ESRRG	46	33
CN(C)CCOc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819452205	FH	On-Demand	Anodyne	GALR3	51	44
O=C(c1cc(-c2ccccc2)nc2cc(F)ccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452206	GH	On-Demand	Anodyne	DHODH	39	47
O=C(c1cc(-c2ccccc2)nc2cc(F)ccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452206	GH	On-Demand	Anodyne	CPT1A	69	38
O=C(c1cc(-c2ccccc2)nc2cc(F)ccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452208	GH	On-Demand	Anodyne	DHODH	39	47
O=C(c1cc(-c2ccccc2)nc2cc(F)ccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452208	GH	On-Demand	Anodyne	CPT1A	69	38
Cn1ccnc1COc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819452210	FF	On-Demand	Anodyne	ADRB2	28	40
Cn1ccnc1COc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819452210	FF	On-Demand	Anodyne	ADRB1	48	37
Cn1ccnc1COc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819452212	FF	On-Demand	Anodyne	ADRB2	28	40
Cn1ccnc1COc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819452212	FF	On-Demand	Anodyne	ADRB1	48	37
Cn1ccnc1COc1ccc(NC[C@H](O)COc2ccccc2F)cc1	ZINC000819452214	FF	On-Demand	Anodyne	ADRB1	45	32
Cn1ccnc1COc1ccc(NC[C@@H](O)COc2ccccc2F)cc1	ZINC000819452216	FF	On-Demand	Anodyne	ADRB1	45	32
O=C1Cc2cc(CCCC(=O)N3CCC[C@H]3c3nn[nH]n3)ccc2N1	ZINC000819452219	ED	On-Demand	Anodyne	CPT1A	41	44
O=C1Cc2cc(CCCC(=O)N3CCC[C@@H]3c3nn[nH]n3)ccc2N1	ZINC000819452221	ED	On-Demand	Anodyne	CPT1A	41	44
CN(C)CCOc1ccc(NC[C@H](O)c2ccc(F)cn2)cc1	ZINC000819452246	DE	On-Demand	Anodyne	ESRRG	45	33
CN(C)CCOc1ccc(NC[C@@H](O)c2ccc(F)cn2)cc1	ZINC000819452248	DE	On-Demand	Anodyne	ESRRG	45	33
Cn1ccnc1COc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819452250	FF	On-Demand	Anodyne	ADRB2	46	45
Cn1ccnc1COc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819452250	FF	On-Demand	Anodyne	ADRB1	65	44
Cn1ccnc1COc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819452250	FF	On-Demand	Anodyne	ADRB3	47	44
Cn1ccnc1COc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819452252	FF	On-Demand	Anodyne	ADRB2	46	45
Cn1ccnc1COc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819452252	FF	On-Demand	Anodyne	ADRB1	65	44
Cn1ccnc1COc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819452252	FF	On-Demand	Anodyne	ADRB3	47	44
O=C(c1ccc2[nH]ccc2c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452256	CD	On-Demand	Anodyne	CPT1A	31	46
CN(C)CCOc1ccc(NCCS(C)(=O)=O)cc1	ZINC000819452257	CD	On-Demand	Anodyne	LTA4H	15	43
CN(C)CCOc1ccc(NCCS(C)(=O)=O)cc1	ZINC000819452257	CD	On-Demand	Anodyne	ESRRG	46	35
O=C(c1ccc2[nH]ccc2c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452258	CD	On-Demand	Anodyne	CPT1A	31	46
O=C(Cn1c(SC(F)F)nc2ccccc21)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452260	GE	On-Demand	Anodyne	CPT1A	64	35
O=C(Cn1c(SC(F)F)nc2ccccc21)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452263	GE	On-Demand	Anodyne	CPT1A	64	35
C[C@@](O)(CC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccccc1	ZINC000819452267	DD	On-Demand	Anodyne	PRCP	24	40
C[C@@](O)(CC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccccc1	ZINC000819452267	DD	On-Demand	Anodyne	CPT1A	106	40
CN(C)CCOc1ccc(NC[C@H](O)c2cccc(F)c2)cc1Cl	ZINC000819452268	FH	On-Demand	Anodyne	ERBB2	40	37
CN(C)CCOc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1Cl	ZINC000819452269	FH	On-Demand	Anodyne	ERBB2	40	37
C[C@@](O)(CC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccccc1	ZINC000819452270	DD	On-Demand	Anodyne	PRCP	24	40
C[C@@](O)(CC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccccc1	ZINC000819452270	DD	On-Demand	Anodyne	CPT1A	106	40
CN(C)CCOc1ccc(NC[C@@H](O)C(F)(F)F)cc1	ZINC000819452280	CD	On-Demand	Anodyne	ESRRG	48	36
CN(C)CCOc1ccc(NC[C@H](O)C(F)(F)F)cc1	ZINC000819452282	CD	On-Demand	Anodyne	ESRRG	48	36
CN(C)CCOc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819452283	FH	On-Demand	Anodyne	ESRRG	46	33
CN(C)CCOc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)cc1	ZINC000819452285	FH	On-Demand	Anodyne	ESRRG	46	33
O=C(COc1ccc(OCc2ccccc2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452286	GF	On-Demand	Anodyne	ACE	16	43
O=C(COc1ccc(OCc2ccccc2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452286	GF	On-Demand	Anodyne	PRCP	19	48
O=C(COc1ccc(OCc2ccccc2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452286	GF	On-Demand	Anodyne	CPT1A	162	54
O=C(COc1ccc(OCc2ccccc2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452286	GF	On-Demand	Anodyne	CPT2	52	41
O=C(COc1ccc(OCc2ccccc2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452286	GF	On-Demand	Anodyne	PREP	66	38
Cc1c(F)cccc1NC(=O)CCNc1ccc(OCCN(C)C)cc1	ZINC000819452294	FH	On-Demand	Anodyne	ESRRG	45	33
Cn1cnc2cc(NCCS(=O)(=O)CC(=O)OC(C)(C)C)ccc21	ZINC000819452306	FD	On-Demand	Anodyne	NR1I2	54	34
Cc1nc2cc(NC[C@H](O)c3cccnc3)ccc2n1C	ZINC000819452308	CE	On-Demand	Anodyne	ADRB3	86	47
Cc1nc2cc(NC[C@@H](O)c3cccnc3)ccc2n1C	ZINC000819452309	CE	On-Demand	Anodyne	ADRB3	86	47
CCOc1cc(N2CCN(C)CC2)ccc1NCCS(=O)(=O)CC	ZINC000819452325	FD	On-Demand	Anodyne	MAPK7	42	39
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819452344	GF	On-Demand	Anodyne	ADRB2	19	42
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819452345	GF	On-Demand	Anodyne	ADRB2	19	42
CCOc1cc(N2CCN(C)CC2)ccc1NCCS(C)(=O)=O	ZINC000819452346	ED	On-Demand	Anodyne	MAPK7	42	38
Cn1cnc2cc(NC[C@@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)ccc21	ZINC000819452367	FF	On-Demand	Anodyne	GPR119	53	42
Cn1cnc2cc(NC[C@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)ccc21	ZINC000819452368	FF	On-Demand	Anodyne	GPR119	53	42
Cn1cnc2cc(NCC3(O)CCCCC3)ccc21	ZINC000819452377	CF	On-Demand	Anodyne	NR1I2	44	32
CCOc1cc(N2CCN(C)CC2)ccc1NCC1(O)CCCCC1	ZINC000819452379	EF	On-Demand	Anodyne	HCN1	51	43
CCOc1cc(N2CCN(C)CC2)ccc1NCC1(O)CCCCC1	ZINC000819452379	EF	On-Demand	Anodyne	HCN4	45	34
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](O)COc1ccccc1C	ZINC000819452385	GF	On-Demand	Anodyne	ADRB2	23	49
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](O)COc1ccccc1C	ZINC000819452385	GF	On-Demand	Anodyne	ABCB1	56	39
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](O)COc1ccccc1C	ZINC000819452386	GF	On-Demand	Anodyne	ADRB2	23	49
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](O)COc1ccccc1C	ZINC000819452386	GF	On-Demand	Anodyne	ABCB1	56	39
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819452426	FH	On-Demand	Anodyne	ADRB2	28	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819452426	FH	On-Demand	Anodyne	ADRB1	57	38
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819452427	FH	On-Demand	Anodyne	ADRB2	28	41
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819452427	FH	On-Demand	Anodyne	ADRB1	57	38
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccccc2OCC2CC2)c1	ZINC000819452428	EH	On-Demand	Bother	CACNA1C	33	40
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccccc2OCC2CC2)c1	ZINC000819452428	EH	On-Demand	Bother	CACNA1D	49	40
O=[N+]([O-])c1cccc([C@H](O)CNc2ccccc2OCC2CC2)c1	ZINC000819452429	EH	On-Demand	Bother	CACNA1C	33	40
O=[N+]([O-])c1cccc([C@H](O)CNc2ccccc2OCC2CC2)c1	ZINC000819452429	EH	On-Demand	Bother	CACNA1D	49	40
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819452432	FG	On-Demand	Mild	ADRB2	40	44
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819452432	FG	On-Demand	Mild	ADRB1	72	45
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819452432	FG	On-Demand	Mild	ADRB3	40	43
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819452432	FG	On-Demand	Mild	CASR	41	38
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819452433	FG	On-Demand	Mild	ADRB2	40	44
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819452433	FG	On-Demand	Mild	ADRB1	72	45
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819452433	FG	On-Demand	Mild	ADRB3	40	43
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819452433	FG	On-Demand	Mild	CASR	41	38
O[C@@H](CNc1ccccc1OCC1CC1)c1ccc(F)cc1	ZINC000819452442	DH	On-Demand	Anodyne	SLC6A3	23	41
O[C@H](CNc1ccccc1OCC1CC1)c1ccc(F)cc1	ZINC000819452443	DH	On-Demand	Anodyne	SLC6A3	23	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(F)cc1OCC1CC1	ZINC000819452444	FG	On-Demand	Anodyne	GPR119	21	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(F)cc1OCC1CC1	ZINC000819452445	FG	On-Demand	Anodyne	GPR119	21	40
O[C@H](CNc1ccc(OCc2noc(C3CC3)n2)cc1)c1cccc(Cl)c1	ZINC000819452456	GI	On-Demand	Anodyne	CYP3A4	42	33
O[C@@H](CNc1ccc(OCc2noc(C3CC3)n2)cc1)c1cccc(Cl)c1	ZINC000819452457	GI	On-Demand	Anodyne	CYP3A4	42	33
O[C@@H](CNc1ccc(F)cc1OCC1CC1)CN1CCOCC1	ZINC000819452458	DD	On-Demand	Anodyne	CCR1	36	41
O[C@H](CNc1ccc(F)cc1OCC1CC1)CN1CCOCC1	ZINC000819452459	DD	On-Demand	Anodyne	CCR1	36	41
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819452464	GG	On-Demand	Anodyne	ADRB2	36	51
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819452464	GG	On-Demand	Anodyne	ADRB1	73	51
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819452464	GG	On-Demand	Anodyne	ADRB3	42	45
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819452464	GG	On-Demand	Anodyne	CCR1	27	40
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819452465	GG	On-Demand	Anodyne	ADRB2	36	51
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819452465	GG	On-Demand	Anodyne	ADRB1	73	51
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819452465	GG	On-Demand	Anodyne	ADRB3	42	45
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC2CC2)cc1	ZINC000819452465	GG	On-Demand	Anodyne	CCR1	27	40
CCOC(=O)C1CCC(O)(CNc2ccccc2OCC2CC2)CC1	ZINC000819452466	EG	On-Demand	Anodyne	HCN1	44	32
CCOC(=O)C1CCC(O)(CNc2ccccc2OCC2CC2)CC1	ZINC000819452466	EG	On-Demand	Anodyne	HCN4	42	32
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2cc(F)c(F)c(F)c2)CC1	ZINC000819452476	FH	On-Demand	Anodyne	F13A1	15	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2cc(F)c(F)c(F)c2)CC1	ZINC000819452476	FH	On-Demand	Anodyne	GPR119	60	53
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2cc(F)c(F)c(F)c2)CC1	ZINC000819452477	FH	On-Demand	Anodyne	F13A1	15	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2cc(F)c(F)c(F)c2)CC1	ZINC000819452477	FH	On-Demand	Anodyne	GPR119	60	53
O[C@@H](CNc1ccccc1OCC1CC1)COc1ccc(F)cc1	ZINC000819452478	EG	On-Demand	Clean	ADRB2	50	43
O[C@@H](CNc1ccccc1OCC1CC1)COc1ccc(F)cc1	ZINC000819452478	EG	On-Demand	Clean	ADRB1	78	45
O[C@@H](CNc1ccccc1OCC1CC1)COc1ccc(F)cc1	ZINC000819452478	EG	On-Demand	Clean	ADRB3	42	40
O[C@H](CNc1ccccc1OCC1CC1)COc1ccc(F)cc1	ZINC000819452479	EG	On-Demand	Clean	ADRB2	50	43
O[C@H](CNc1ccccc1OCC1CC1)COc1ccc(F)cc1	ZINC000819452479	EG	On-Demand	Clean	ADRB1	78	45
O[C@H](CNc1ccccc1OCC1CC1)COc1ccc(F)cc1	ZINC000819452479	EG	On-Demand	Clean	ADRB3	42	40
O=C(CCNc1ccc(OCc2noc(C3CC3)n2)cc1)Nc1ccccc1	ZINC000819452486	GH	On-Demand	Anodyne	LTA4H	24	41
O=C(N[C@H]1CCCc2cc(F)ccc21)C(F)=C1CCC1	ZINC000819452489	CH	On-Demand	Anodyne	BDKRB1	51	39
O=C(N[C@@H]1CCCc2cc(F)ccc21)C(F)=C1CCC1	ZINC000819452490	CH	On-Demand	Anodyne	BDKRB1	51	39
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)[C@@H](C)c1ccccc1C(F)(F)F	ZINC000819452493	EI	On-Demand	Anodyne	RBP4	48	35
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)[C@H](C)c1ccccc1C(F)(F)F	ZINC000819452494	EI	On-Demand	Anodyne	RBP4	48	35
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)[C@@H](C)c1ccccc1C(F)(F)F	ZINC000819452495	EI	On-Demand	Anodyne	RBP4	48	35
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)[C@H](C)c1ccccc1C(F)(F)F	ZINC000819452496	EI	On-Demand	Anodyne	RBP4	48	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(-c3ncco3)cc1)C2	ZINC000819452498	FG	On-Demand	Anodyne	LTA4H	17	42
O=C(COc1ccc(OCc2ccccc2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452499	GF	On-Demand	Anodyne	ACE	16	43
O=C(COc1ccc(OCc2ccccc2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452499	GF	On-Demand	Anodyne	PRCP	19	48
O=C(COc1ccc(OCc2ccccc2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452499	GF	On-Demand	Anodyne	CPT1A	162	54
O=C(COc1ccc(OCc2ccccc2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452499	GF	On-Demand	Anodyne	CPT2	52	41
O=C(COc1ccc(OCc2ccccc2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452499	GF	On-Demand	Anodyne	PREP	66	38
O=C(NCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccccc1OC(F)F	ZINC000819452504	FC	On-Demand	Anodyne	CPT1A	65	40
O=C(NCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccccc1OC(F)F	ZINC000819452504	FC	On-Demand	Anodyne	PREP	25	41
O=C(NCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccccc1OC(F)F	ZINC000819452504	FC	On-Demand	Anodyne	HCN1	52	33
O=C(NCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccccc1OC(F)F	ZINC000819452504	FC	On-Demand	Anodyne	HCN4	48	31
O=C(NCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccccc1OC(F)F	ZINC000819452505	FC	On-Demand	Anodyne	CPT1A	65	40
O=C(NCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccccc1OC(F)F	ZINC000819452505	FC	On-Demand	Anodyne	PREP	25	41
O=C(NCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccccc1OC(F)F	ZINC000819452505	FC	On-Demand	Anodyne	HCN1	52	33
O=C(NCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccccc1OC(F)F	ZINC000819452505	FC	On-Demand	Anodyne	HCN4	48	31
CCOc1nc2ccc(C(=O)N3CCC[C@@H]3c3nn[nH]n3)cc2[nH]1	ZINC000819452512	ED	On-Demand	Anodyne	PRCP	41	38
CCOc1nc2ccc(C(=O)N3CCC[C@@H]3c3nn[nH]n3)cc2[nH]1	ZINC000819452512	ED	On-Demand	Anodyne	CPT1A	84	36
CCOc1nc2ccc(C(=O)N3CCC[C@H]3c3nn[nH]n3)cc2[nH]1	ZINC000819452513	ED	On-Demand	Anodyne	PRCP	41	38
CCOc1nc2ccc(C(=O)N3CCC[C@H]3c3nn[nH]n3)cc2[nH]1	ZINC000819452513	ED	On-Demand	Anodyne	CPT1A	84	36
COc1ccc(-c2cncc(C(=O)N3CCC[C@H]3c3nn[nH]n3)c2)cc1	ZINC000819452516	FE	On-Demand	Anodyne	CYP11B2	21	41
COc1ccc(-c2cncc(C(=O)N3CCC[C@H]3c3nn[nH]n3)c2)cc1	ZINC000819452516	FE	On-Demand	Anodyne	CPT1A	91	40
COc1ccc(-c2cncc(C(=O)N3CCC[C@@H]3c3nn[nH]n3)c2)cc1	ZINC000819452517	FE	On-Demand	Anodyne	CYP11B2	21	41
COc1ccc(-c2cncc(C(=O)N3CCC[C@@H]3c3nn[nH]n3)c2)cc1	ZINC000819452517	FE	On-Demand	Anodyne	CPT1A	91	40
CC(=O)CCc1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819452518	ED	On-Demand	Anodyne	PRCP	18	43
CC(=O)CCc1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819452518	ED	On-Demand	Anodyne	CPT1A	139	46
CC(=O)CCc1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819452518	ED	On-Demand	Anodyne	CPT2	46	37
CC(=O)CCc1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819452519	ED	On-Demand	Anodyne	PRCP	18	43
CC(=O)CCc1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819452519	ED	On-Demand	Anodyne	CPT1A	139	46
CC(=O)CCc1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819452519	ED	On-Demand	Anodyne	CPT2	46	37
Cn1ccnc1COc1ccc(NC[C@H](O)COCc2ccccc2)cc1	ZINC000819452534	FF	On-Demand	Anodyne	ADRB2	20	40
Cn1ccnc1COc1ccc(NC[C@H](O)COCc2ccccc2)cc1	ZINC000819452534	FF	On-Demand	Anodyne	ADRB1	36	40
Cn1ccnc1COc1ccc(NC[C@H](O)COCc2ccccc2)cc1	ZINC000819452534	FF	On-Demand	Anodyne	ADRB3	24	40
Cn1ccnc1COc1ccc(NC[C@@H](O)COCc2ccccc2)cc1	ZINC000819452535	FF	On-Demand	Anodyne	ADRB2	20	40
Cn1ccnc1COc1ccc(NC[C@@H](O)COCc2ccccc2)cc1	ZINC000819452535	FF	On-Demand	Anodyne	ADRB1	36	40
Cn1ccnc1COc1ccc(NC[C@@H](O)COCc2ccccc2)cc1	ZINC000819452535	FF	On-Demand	Anodyne	ADRB3	24	40
O=C(CN1CCN(Cc2ccccc2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452538	FC	On-Demand	Anodyne	DRD2	18	40
O=C(CN1CCN(Cc2ccccc2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452538	FC	On-Demand	Anodyne	DRD4	50	40
O=C(CN1CCN(Cc2ccccc2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452538	FC	On-Demand	Anodyne	SIGMAR1	47	42
O=C(CN1CCN(Cc2ccccc2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452538	FC	On-Demand	Anodyne	CPT1A	109	40
O=C(CN1CCN(Cc2ccccc2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452538	FC	On-Demand	Anodyne	PREP	71	34
O=C(CN1CCN(Cc2ccccc2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452539	FC	On-Demand	Anodyne	DRD2	18	40
O=C(CN1CCN(Cc2ccccc2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452539	FC	On-Demand	Anodyne	DRD4	50	40
O=C(CN1CCN(Cc2ccccc2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452539	FC	On-Demand	Anodyne	SIGMAR1	47	42
O=C(CN1CCN(Cc2ccccc2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452539	FC	On-Demand	Anodyne	CPT1A	109	40
O=C(CN1CCN(Cc2ccccc2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452539	FC	On-Demand	Anodyne	PREP	71	34
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1Cl	ZINC000819452541	GG	On-Demand	Anodyne	GRIN1	28	41
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1Cl	ZINC000819452545	GG	On-Demand	Anodyne	GRIN1	28	41
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819452547	FE	On-Demand	Mild	ADRB2	28	41
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819452547	FE	On-Demand	Mild	ADRB1	46	40
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819452547	FE	On-Demand	Mild	ESRRG	45	37
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819452548	FE	On-Demand	Mild	ADRB2	28	41
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819452548	FE	On-Demand	Mild	ADRB1	46	40
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819452548	FE	On-Demand	Mild	ESRRG	45	37
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2F)cc1Cl	ZINC000819452550	GG	On-Demand	Anodyne	ADRB1	42	32
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2F)cc1Cl	ZINC000819452552	GG	On-Demand	Anodyne	ADRB1	42	32
O=C(Cc1coc(-c2cccs2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452553	ED	On-Demand	Anodyne	CPT1A	83	47
C#CCNC(=O)CCNc1ccc(OCCN(C)C)c(Cl)c1	ZINC000819452554	DD	On-Demand	Mild	MCHR2	19	40
O=C(Cc1coc(-c2cccs2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452555	ED	On-Demand	Anodyne	CPT1A	83	47
CN(C)CCOc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819452567	EG	On-Demand	Anodyne	ADRB1	40	38
CN(C)CCOc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819452567	EG	On-Demand	Anodyne	LTA4H	39	52
CN(C)CCOc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819452567	EG	On-Demand	Anodyne	ESRRG	53	40
CN(C)CCOc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819452567	EG	On-Demand	Anodyne	ABCB1	19	43
CN(C)CCOc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819452568	EG	On-Demand	Anodyne	ADRB1	40	38
CN(C)CCOc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819452568	EG	On-Demand	Anodyne	LTA4H	39	52
CN(C)CCOc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819452568	EG	On-Demand	Anodyne	ESRRG	53	40
CN(C)CCOc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819452568	EG	On-Demand	Anodyne	ABCB1	19	43
CN(C)CCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819452574	EG	On-Demand	Anodyne	LTA4H	72	48
CN(C)CCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819452574	EG	On-Demand	Anodyne	MTNR1B	16	40
CN(C)CCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819452574	EG	On-Demand	Anodyne	ESRRG	57	41
CN(C)CCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819452574	EG	On-Demand	Anodyne	FAAH	20	42
CN(C)CCOc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819452576	DF	On-Demand	Anodyne	ADRB3	15	41
CN(C)CCOc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819452576	DF	On-Demand	Anodyne	ESRRG	48	35
CN(C)CCOc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819452577	DF	On-Demand	Anodyne	ADRB3	15	41
CN(C)CCOc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819452577	DF	On-Demand	Anodyne	ESRRG	48	35
Cn1ccnc1COc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819452582	EG	On-Demand	Anodyne	ADRB1	28	41
Cn1ccnc1COc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819452582	EG	On-Demand	Anodyne	ADRB3	22	41
Cn1ccnc1COc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819452584	EG	On-Demand	Anodyne	ADRB1	28	41
Cn1ccnc1COc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819452584	EG	On-Demand	Anodyne	ADRB3	22	41
C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452585	FG	On-Demand	Anodyne	MC4R	61	42
CN(C)CCOc1ccc(NCCC(=O)NC(N)=O)cc1	ZINC000819452586	CC	On-Demand	Anodyne	ESRRG	48	35
C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452587	FG	On-Demand	Anodyne	MC4R	61	42
CN(C)CCOc1ccc(NC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819452592	EG	On-Demand	Anodyne	ESRRG	49	37
CN(C)CCOc1ccc(NC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819452594	EG	On-Demand	Anodyne	ESRRG	49	37
CN(C)CCOc1ccc(NC[C@H](O)C2CC2)cc1	ZINC000819452606	CD	On-Demand	Anodyne	ESRRG	47	35
CN(C)CCOc1ccc(NC[C@@H](O)C2CC2)cc1	ZINC000819452608	CD	On-Demand	Anodyne	ESRRG	47	35
CN(C)CCOc1ccc(NC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819452612	EH	On-Demand	Anodyne	ESRRG	49	36
CN(C)CCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819452616	DF	On-Demand	Anodyne	ADRB2	20	48
CN(C)CCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819452616	DF	On-Demand	Anodyne	ADRB1	24	40
CN(C)CCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819452616	DF	On-Demand	Anodyne	ADRB3	25	42
CN(C)CCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819452616	DF	On-Demand	Anodyne	LTA4H	35	50
CN(C)CCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819452616	DF	On-Demand	Anodyne	ESRRG	60	44
CN(C)CCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819452616	DF	On-Demand	Anodyne	AOC3	21	40
Cc1ccc(F)c(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819452617	DD	On-Demand	Anodyne	CPT1A	115	43
CN(C)CCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819452618	DF	On-Demand	Anodyne	ADRB2	20	48
CN(C)CCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819452618	DF	On-Demand	Anodyne	ADRB1	24	40
CN(C)CCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819452618	DF	On-Demand	Anodyne	ADRB3	25	42
CN(C)CCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819452618	DF	On-Demand	Anodyne	LTA4H	35	50
CN(C)CCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819452618	DF	On-Demand	Anodyne	ESRRG	60	44
CN(C)CCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819452618	DF	On-Demand	Anodyne	AOC3	21	40
Cc1ccc(F)c(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819452619	DD	On-Demand	Anodyne	CPT1A	115	43
CN(C)CCOc1ccc(NC[C@@H](O)C2CCCCC2)cc1	ZINC000819452625	DF	On-Demand	Anodyne	ESRRG	48	36
CN(C)CCOc1ccc(NC[C@H](O)C2CCCCC2)cc1	ZINC000819452626	DF	On-Demand	Anodyne	ESRRG	48	36
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452631	ED	On-Demand	Anodyne	ACE	26	40
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452631	ED	On-Demand	Anodyne	ELANE	41	40
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452631	ED	On-Demand	Anodyne	CCR1	51	41
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452631	ED	On-Demand	Anodyne	PREP	19	48
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452633	ED	On-Demand	Anodyne	ACE	26	40
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452633	ED	On-Demand	Anodyne	ELANE	41	40
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452633	ED	On-Demand	Anodyne	CCR1	51	41
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452633	ED	On-Demand	Anodyne	PREP	19	48
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452635	ED	On-Demand	Anodyne	ACE	26	40
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452635	ED	On-Demand	Anodyne	ELANE	41	40
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452635	ED	On-Demand	Anodyne	CCR1	51	41
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452635	ED	On-Demand	Anodyne	PREP	19	48
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452637	ED	On-Demand	Anodyne	ACE	26	40
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452637	ED	On-Demand	Anodyne	ELANE	41	40
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452637	ED	On-Demand	Anodyne	CCR1	51	41
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452637	ED	On-Demand	Anodyne	PREP	19	48
O=C([C@@H]1C[C@]12CCOc1ccccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452639	ED	On-Demand	Anodyne	CPT1A	43	34
O=C([C@@H]1C[C@]12CCOc1ccccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452641	ED	On-Demand	Anodyne	CPT1A	43	34
Cc1ccccc1[C@@H](CC(=O)N1CCC[C@@H]1c1nn[nH]n1)NC(N)=O	ZINC000819452657	EC	On-Demand	Anodyne	CPT1A	69	35
Cc1ccccc1[C@@H](CC(=O)N1CCC[C@@H]1c1nn[nH]n1)NC(N)=O	ZINC000819452657	EC	On-Demand	Anodyne	CTSA	55	34
Cc1ccccc1[C@@H](CC(=O)N1CCC[C@H]1c1nn[nH]n1)NC(N)=O	ZINC000819452659	EC	On-Demand	Anodyne	CPT1A	69	35
Cc1ccccc1[C@@H](CC(=O)N1CCC[C@H]1c1nn[nH]n1)NC(N)=O	ZINC000819452659	EC	On-Demand	Anodyne	CTSA	55	34
Cc1ccccc1[C@H](CC(=O)N1CCC[C@@H]1c1nn[nH]n1)NC(N)=O	ZINC000819452661	EC	On-Demand	Anodyne	CPT1A	69	35
Cc1ccccc1[C@H](CC(=O)N1CCC[C@@H]1c1nn[nH]n1)NC(N)=O	ZINC000819452661	EC	On-Demand	Anodyne	CTSA	55	34
Cc1ccccc1[C@H](CC(=O)N1CCC[C@H]1c1nn[nH]n1)NC(N)=O	ZINC000819452663	EC	On-Demand	Anodyne	CPT1A	69	35
Cc1ccccc1[C@H](CC(=O)N1CCC[C@H]1c1nn[nH]n1)NC(N)=O	ZINC000819452663	EC	On-Demand	Anodyne	CTSA	55	34
O=C(c1cccc(-n2cnnn2)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452669	DC	On-Demand	Anodyne	CPT1A	31	43
CN(C)CCOc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819452670	GE	On-Demand	Anodyne	ADRB3	21	47
CN(C)CCOc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819452670	GE	On-Demand	Anodyne	ESRRG	45	33
O=C(c1cccc(-n2cnnn2)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452671	DC	On-Demand	Anodyne	CPT1A	31	43
CN(C)CCOc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819452672	GE	On-Demand	Anodyne	ADRB3	21	47
CN(C)CCOc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819452672	GE	On-Demand	Anodyne	ESRRG	45	33
CN(C)CCOc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819452683	GH	On-Demand	Anodyne	ADRB2	45	54
CN(C)CCOc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819452683	GH	On-Demand	Anodyne	ADRB1	62	54
CN(C)CCOc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819452683	GH	On-Demand	Anodyne	ADRB3	28	54
CN(C)CCOc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819452683	GH	On-Demand	Anodyne	ESRRG	47	35
CN(C)CCOc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819452683	GH	On-Demand	Anodyne	CYP2D6	23	45
CN(C)CCOc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819452684	GH	On-Demand	Anodyne	ADRB2	45	54
CN(C)CCOc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819452684	GH	On-Demand	Anodyne	ADRB1	62	54
CN(C)CCOc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819452684	GH	On-Demand	Anodyne	ADRB3	28	54
CN(C)CCOc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819452684	GH	On-Demand	Anodyne	ESRRG	47	35
CN(C)CCOc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819452684	GH	On-Demand	Anodyne	CYP2D6	23	45
CN(C)CCOc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819452696	GH	On-Demand	Anodyne	ESRRG	46	33
CN(C)CCOc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1	ZINC000819452697	GH	On-Demand	Anodyne	ESRRG	46	33
O=C(C(F)=C1CCC1)N1CCC(c2cccnc2)CC1	ZINC000819452704	CG	On-Demand	Anodyne	CHRNA7	15	40
O=C(C(F)=C1CCC1)N1CCC(c2cccnc2)CC1	ZINC000819452704	CG	On-Demand	Anodyne	ACHP_LYMST	20	40
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](O)CN1CCOCC1	ZINC000819452751	GC	On-Demand	Anodyne	TTK	17	40
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](O)CN1CCOCC1	ZINC000819452752	GC	On-Demand	Anodyne	TTK	17	40
CCOc1cc(N2CCN(C)CC2)ccc1NCCC(=O)Nc1cc(C)on1	ZINC000819452757	GF	On-Demand	Anodyne	FLT3	26	49
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCCC3)cc2C(N)=O)c1	ZINC000819452758	GF	On-Demand	Anodyne	KCNQ2	37	44
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCCCC3)cc2C(N)=O)c1	ZINC000819452758	GF	On-Demand	Anodyne	STAT6	42	38
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](O)CN1CCCC1=O	ZINC000819452775	GD	On-Demand	Anodyne	MAPK7	41	38
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](O)CN1CCCC1=O	ZINC000819452776	GD	On-Demand	Anodyne	MAPK7	41	38
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(-c3ncco3)cc1)C2	ZINC000819452778	FG	On-Demand	Anodyne	LTA4H	17	42
CCOc1cc(N2CCN(C)CC2)ccc1NCCC(=O)Nc1cccnc1	ZINC000819452781	GF	On-Demand	Anodyne	EGFR	15	49
CCOc1cc(N2CCN(C)CC2)ccc1NCCC(=O)Nc1cccnc1	ZINC000819452781	GF	On-Demand	Anodyne	FLT3	16	47
CSc1cc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)ccn1	ZINC000819452782	DF	On-Demand	Anodyne	TYK2	43	36
O=C(/C=C/[C@@H]1CCCO1)N1CCC(c2cccnc2)CC1	ZINC000819452811	CF	On-Demand	Anodyne	C3AR1	27	40
O=C(/C=C\[C@@H]1CCCO1)N1CCC(c2cccnc2)CC1	ZINC000819452813	CF	On-Demand	Anodyne	C3AR1	27	40
O=C(/C=C\[C@H]1CCCO1)N1CCC(c2cccnc2)CC1	ZINC000819452815	CF	On-Demand	Anodyne	C3AR1	27	40
O=C(/C=C/[C@H]1CCCO1)N1CCC(c2cccnc2)CC1	ZINC000819452817	CF	On-Demand	Anodyne	C3AR1	27	40
Cc1ccc(NC[C@H](O)c2cccnc2)cc1OCC1CCOCC1	ZINC000819452823	EG	On-Demand	Anodyne	ADRB3	74	42
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1OCC1CCOCC1	ZINC000819452824	EG	On-Demand	Anodyne	ADRB3	74	42
C[C@H]1CN(Cc2ccccc2)[C@H](C)CN1C(=O)/C=C\[C@@H]1CCCO1	ZINC000819452846	EF	On-Demand	Anodyne	CCR1	16	42
C[C@H]1CN(Cc2ccccc2)[C@H](C)CN1C(=O)/C=C/[C@@H]1CCCO1	ZINC000819452847	EF	On-Demand	Anodyne	CCR1	16	42
CN1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)(C)C1	ZINC000819452853	FE	On-Demand	Mild	PAPA1_CARPA	31	41
CN1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)(C)C1	ZINC000819452854	FE	On-Demand	Mild	PAPA1_CARPA	31	41
N#Cc1ccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819452887	EG	On-Demand	Mild	ADRB2	40	42
N#Cc1ccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819452887	EG	On-Demand	Mild	ADRB1	68	43
N#Cc1ccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819452887	EG	On-Demand	Mild	ADRB3	31	41
N#Cc1ccc(OC[C@@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819452887	EG	On-Demand	Mild	CYP2D6	15	41
N#Cc1ccc(OC[C@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819452888	EG	On-Demand	Mild	ADRB2	40	42
N#Cc1ccc(OC[C@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819452888	EG	On-Demand	Mild	ADRB1	68	43
N#Cc1ccc(OC[C@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819452888	EG	On-Demand	Mild	ADRB3	31	41
N#Cc1ccc(OC[C@H](O)CNc2ccccc2OCC2CC2)cc1	ZINC000819452888	EG	On-Demand	Mild	CYP2D6	15	41
COCCn1cc(C(=O)N2CCC[C@H]2c2nn[nH]n2)c2ccccc21	ZINC000819452899	ED	On-Demand	Anodyne	CNR1	21	48
COCCn1cc(C(=O)N2CCC[C@H]2c2nn[nH]n2)c2ccccc21	ZINC000819452899	ED	On-Demand	Anodyne	CNR2	25	48
COCCn1cc(C(=O)N2CCC[C@H]2c2nn[nH]n2)c2ccccc21	ZINC000819452899	ED	On-Demand	Anodyne	TPSAB1	15	47
COCCn1cc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)c2ccccc21	ZINC000819452901	ED	On-Demand	Anodyne	CNR1	21	48
COCCn1cc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)c2ccccc21	ZINC000819452901	ED	On-Demand	Anodyne	CNR2	25	48
COCCn1cc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)c2ccccc21	ZINC000819452901	ED	On-Demand	Anodyne	TPSAB1	15	47
CN(C)CCOc1ccc(NC[C@@H](O)Cc2ccccc2C(F)(F)F)cc1	ZINC000819452905	GH	On-Demand	Anodyne	ESRRG	46	34
CN(C)CCOc1ccc(NC[C@H](O)Cc2ccccc2C(F)(F)F)cc1	ZINC000819452906	GH	On-Demand	Anodyne	ESRRG	46	34
CN(C)CCOc1ccc(NCCC(N)=O)cc1	ZINC000819452910	CC	On-Demand	Anodyne	LTA4H	30	45
CN(C)CCOc1ccc(NCCC(N)=O)cc1	ZINC000819452910	CC	On-Demand	Anodyne	ESRRG	51	38
CC[C@H](O)CNc1ccc(OCCN(C)C)cc1	ZINC000819452916	CD	On-Demand	Anodyne	ESRRG	50	40
CN(C)CCOc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819452917	EG	On-Demand	Anodyne	ADRB1	24	41
CN(C)CCOc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819452917	EG	On-Demand	Anodyne	MAOB	22	46
CN(C)CCOc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819452917	EG	On-Demand	Anodyne	GRIN1	23	45
CN(C)CCOc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819452917	EG	On-Demand	Anodyne	ADRB3	20	42
CN(C)CCOc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819452917	EG	On-Demand	Anodyne	ESRRG	45	33
CN(C)CCOc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819452918	EG	On-Demand	Anodyne	ADRB1	24	41
CN(C)CCOc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819452918	EG	On-Demand	Anodyne	MAOB	22	46
CN(C)CCOc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819452918	EG	On-Demand	Anodyne	GRIN1	23	45
CN(C)CCOc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819452918	EG	On-Demand	Anodyne	ADRB3	20	42
CN(C)CCOc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819452918	EG	On-Demand	Anodyne	ESRRG	45	33
CN(C)CCOc1ccc(NC[C@@H](O)CO[C@@H]2CCCc3ccccc32)cc1	ZINC000819452919	GG	On-Demand	Anodyne	ESRRG	43	32
CN(C)CCOc1ccc(NC[C@H](O)CO[C@@H]2CCCc3ccccc32)cc1	ZINC000819452920	GG	On-Demand	Anodyne	ESRRG	43	32
CN(C)CCOc1ccc(NC[C@@H](O)CO[C@H]2CCCc3ccccc32)cc1	ZINC000819452922	GG	On-Demand	Anodyne	ESRRG	43	32
CN(C)CCOc1ccc(NC[C@H](O)CO[C@H]2CCCc3ccccc32)cc1	ZINC000819452924	GG	On-Demand	Anodyne	ESRRG	43	32
O=C(c1cc(COc2ccccc2F)on1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452926	FD	On-Demand	Anodyne	CPT1A	91	40
CN(C)CCOc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819452927	EF	On-Demand	Bother	ESRRG	45	32
CN(C)CCOc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819452928	EF	On-Demand	Bother	ESRRG	45	32
O=C(c1cc(COc2ccccc2F)on1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452929	FD	On-Demand	Anodyne	CPT1A	91	40
C[C@@H](Oc1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1)c1ccccc1	ZINC000819452945	FG	On-Demand	Anodyne	CPT1A	97	37
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819452946	GE	On-Demand	Anodyne	ADRB2	27	48
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819452946	GE	On-Demand	Anodyne	ADRB1	56	48
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819452946	GE	On-Demand	Anodyne	GRIN1	24	41
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819452948	GE	On-Demand	Anodyne	ADRB2	27	48
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819452948	GE	On-Demand	Anodyne	ADRB1	56	48
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819452948	GE	On-Demand	Anodyne	GRIN1	24	41
C[C@@H](Oc1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1)c1ccccc1	ZINC000819452949	FG	On-Demand	Anodyne	CPT1A	97	37
CN(C)CCOc1ccc(NCCC(N)=O)cc1Cl	ZINC000819452960	CD	On-Demand	Anodyne	MCHR2	19	42
CON(C)C(=O)CCNc1ccc(OCc2nccn2C)cc1	ZINC000819452962	DD	On-Demand	Anodyne	CYP26A1	58	34
Cn1ccnc1COc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819452969	GF	On-Demand	Bother	ADRB2	21	43
Cn1ccnc1COc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819452969	GF	On-Demand	Bother	ADRB1	34	43
Cn1ccnc1COc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819452969	GF	On-Demand	Bother	ADRB3	26	43
Cn1ccnc1COc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819452970	GF	On-Demand	Bother	ADRB2	21	43
Cn1ccnc1COc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819452970	GF	On-Demand	Bother	ADRB1	34	43
Cn1ccnc1COc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819452970	GF	On-Demand	Bother	ADRB3	26	43
Cn1ccnc1COc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819452975	FH	On-Demand	Anodyne	MAOB	25	44
Cn1ccnc1COc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819452976	FH	On-Demand	Anodyne	MAOB	25	44
CN(C)CCOc1ccc(NCC2(O)CCCCC2)cc1	ZINC000819452983	CF	On-Demand	Anodyne	ESRRG	50	38
Cn1ccnc1COc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819452984	GH	On-Demand	Anodyne	ADRB2	29	40
Cn1ccnc1COc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819452985	GH	On-Demand	Anodyne	ADRB2	29	40
CN(C)CCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819452988	FF	On-Demand	Anodyne	ADRB2	24	58
CN(C)CCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819452988	FF	On-Demand	Anodyne	ADRB1	40	58
CN(C)CCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819452988	FF	On-Demand	Anodyne	ESRRG	44	32
CN(C)CCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819452988	FF	On-Demand	Anodyne	CYP2D6	16	41
CN(C)CCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819452989	FF	On-Demand	Anodyne	ADRB2	24	58
CN(C)CCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819452989	FF	On-Demand	Anodyne	ADRB1	40	58
CN(C)CCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819452989	FF	On-Demand	Anodyne	ESRRG	44	32
CN(C)CCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819452989	FF	On-Demand	Anodyne	CYP2D6	16	41
O=C(CSc1nc2ccccc2o1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452992	ED	On-Demand	Anodyne	CPT1A	94	37
O=C(CSc1nc2ccccc2o1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452994	ED	On-Demand	Anodyne	CPT1A	94	37
O=C(Cc1csc(-c2ccc(Cl)cc2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819452995	FF	On-Demand	Anodyne	CPT1A	88	43
O=C(Cc1csc(-c2ccc(Cl)cc2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819452998	FF	On-Demand	Anodyne	CPT1A	88	43
O=C(CN1CCc2ccccc21)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453010	CC	On-Demand	Anodyne	CPT1A	87	38
O=C(CN1CCc2ccccc21)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453010	CC	On-Demand	Anodyne	PREP	26	43
O=C(CN1CCc2ccccc21)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453012	CC	On-Demand	Anodyne	CPT1A	87	38
O=C(CN1CCc2ccccc21)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453012	CC	On-Demand	Anodyne	PREP	26	43
O=C(c1coc(-c2ccccc2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453013	DD	On-Demand	Anodyne	CPT1A	97	38
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819453015	GH	On-Demand	Anodyne	ADRB2	44	56
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819453015	GH	On-Demand	Anodyne	ADRB1	59	41
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819453015	GH	On-Demand	Anodyne	ADRB3	33	41
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819453015	GH	On-Demand	Anodyne	CASR	40	37
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819453015	GH	On-Demand	Anodyne	ESRRG	48	36
O=C(c1coc(-c2ccccc2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453016	DD	On-Demand	Anodyne	CPT1A	97	38
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819453017	GH	On-Demand	Anodyne	ADRB2	44	56
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819453017	GH	On-Demand	Anodyne	ADRB1	59	41
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819453017	GH	On-Demand	Anodyne	ADRB3	33	41
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819453017	GH	On-Demand	Anodyne	CASR	40	37
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819453017	GH	On-Demand	Anodyne	ESRRG	48	36
COC(=O)c1cccc(CCNC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)c1	ZINC000819453027	FE	On-Demand	Anodyne	NQO2	17	40
Cc1ccc(OC[C@@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819453029	EE	On-Demand	Anodyne	ADRB2	16	42
Cc1ccc(OC[C@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819453031	EE	On-Demand	Anodyne	ADRB2	16	42
O=C(c1cc(-c2ccccc2)on1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453032	DD	On-Demand	Anodyne	CPT1A	110	40
O=C(c1cc(-c2ccccc2)on1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453032	DD	On-Demand	Anodyne	PREP	18	46
O=C(c1cc(-c2ccccc2)on1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453035	DD	On-Demand	Anodyne	CPT1A	110	40
O=C(c1cc(-c2ccccc2)on1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453035	DD	On-Demand	Anodyne	PREP	18	46
CN(C)CCOc1ccc(NC[C@@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819453044	FH	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1ccc(NC[C@H](O)c2ccc(F)cc2Cl)cc1	ZINC000819453045	FH	On-Demand	Anodyne	ESRRG	44	33
CCCOc1cn(-c2ccccc2)nc1C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453058	FE	On-Demand	Anodyne	CPT1A	73	40
CCCOc1cn(-c2ccccc2)nc1C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453059	FE	On-Demand	Anodyne	CPT1A	73	40
COc1ccc(-n2c(C)nnc2SCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819453062	HD	On-Demand	Anodyne	CPT1A	65	44
COc1ccc(-n2c(C)nnc2SCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819453063	HD	On-Demand	Anodyne	CPT1A	65	44
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453086	DF	On-Demand	Anodyne	F2	49	39
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453086	DF	On-Demand	Anodyne	ACE	92	48
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453086	DF	On-Demand	Anodyne	FKBP1A	55	39
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453086	DF	On-Demand	Anodyne	OPRM1	25	41
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453086	DF	On-Demand	Anodyne	GHRHR	44	34
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453086	DF	On-Demand	Anodyne	MME	16	41
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453086	DF	On-Demand	Anodyne	TRY1_BOVIN	70	38
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453086	DF	On-Demand	Anodyne	CPT1A	48	34
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453086	DF	On-Demand	Anodyne	PREP	84	42
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453086	DF	On-Demand	Anodyne	ACE2	39	48
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453086	DF	On-Demand	Anodyne	BRCA1	46	35
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453089	DF	On-Demand	Anodyne	F2	49	39
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453089	DF	On-Demand	Anodyne	ACE	92	48
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453089	DF	On-Demand	Anodyne	FKBP1A	55	39
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453089	DF	On-Demand	Anodyne	OPRM1	25	41
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453089	DF	On-Demand	Anodyne	GHRHR	44	34
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453089	DF	On-Demand	Anodyne	MME	16	41
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453089	DF	On-Demand	Anodyne	TRY1_BOVIN	70	38
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453089	DF	On-Demand	Anodyne	CPT1A	48	34
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453089	DF	On-Demand	Anodyne	PREP	84	42
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453089	DF	On-Demand	Anodyne	ACE2	39	48
C[C@@H](CCCc1ccccc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453089	DF	On-Demand	Anodyne	BRCA1	46	35
O=C(c1cc(F)cc2cccnc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453098	DD	On-Demand	Anodyne	CPT1A	45	36
O=C(c1cc(F)cc2cccnc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453099	DD	On-Demand	Anodyne	CPT1A	45	36
O[C@@H](CNc1cccc(CSC2CCCC2)c1)c1ccc(F)cn1	ZINC000819453119	EJ	On-Demand	Anodyne	QRFPR	15	44
O[C@H](CNc1cccc(CSC2CCCC2)c1)c1ccc(F)cn1	ZINC000819453120	EJ	On-Demand	Anodyne	QRFPR	15	44
O=C(NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)C(F)=C1CCC1	ZINC000819453142	FE	On-Demand	Anodyne	L3MBTL3	57	33
O=C(NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2)C(F)=C1CCC1	ZINC000819453143	FE	On-Demand	Anodyne	L3MBTL3	57	33
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cccc(F)c1F	ZINC000819453154	CF	On-Demand	Anodyne	KCNQ2	46	35
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cccc(F)c1F	ZINC000819453155	CF	On-Demand	Anodyne	KCNQ2	46	35
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cccc(F)c1F	ZINC000819453156	CF	On-Demand	Anodyne	KCNQ2	46	35
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cccc(F)c1F	ZINC000819453157	CF	On-Demand	Anodyne	KCNQ2	46	35
O[C@@H](CNc1ccc(CC(F)(F)F)cc1)c1cccnc1	ZINC000819453161	CG	On-Demand	Anodyne	ADRB2	31	44
O[C@@H](CNc1ccc(CC(F)(F)F)cc1)c1cccnc1	ZINC000819453161	CG	On-Demand	Anodyne	ADRB1	29	45
O[C@@H](CNc1ccc(CC(F)(F)F)cc1)c1cccnc1	ZINC000819453161	CG	On-Demand	Anodyne	ADRB3	102	53
O[C@H](CNc1ccc(CC(F)(F)F)cc1)c1cccnc1	ZINC000819453162	CG	On-Demand	Anodyne	ADRB2	31	44
O[C@H](CNc1ccc(CC(F)(F)F)cc1)c1cccnc1	ZINC000819453162	CG	On-Demand	Anodyne	ADRB1	29	45
O[C@H](CNc1ccc(CC(F)(F)F)cc1)c1cccnc1	ZINC000819453162	CG	On-Demand	Anodyne	ADRB3	102	53
Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN(C)C)cc2)c(C)c1	ZINC000819453163	FG	On-Demand	Anodyne	ADRB2	22	44
Cc1ccc(OC[C@H](O)CNc2ccc(OCCN(C)C)cc2)c(C)c1	ZINC000819453164	FG	On-Demand	Anodyne	ADRB2	22	44
CN(C)CCOc1ccc(NC[C@@](C)(O)C(F)(F)F)cc1	ZINC000819453166	DE	On-Demand	Anodyne	ESRRG	48	36
CN(C)CCOc1ccc(NC[C@](C)(O)C(F)(F)F)cc1	ZINC000819453167	DE	On-Demand	Anodyne	ESRRG	48	36
CN(C)CCOc1ccc(NCC2(O)CCOCC2)cc1	ZINC000819453168	CD	On-Demand	Anodyne	ESRRG	46	34
CCOC(=O)C1CCC(O)(CNc2ccc(OCCN(C)C)cc2)CC1	ZINC000819453177	FF	On-Demand	Anodyne	ESRRG	43	33
CCOC[C@H](O)CNc1ccc(OCCN(C)C)cc1	ZINC000819453186	CD	On-Demand	Anodyne	ADRB1	23	41
CCOC[C@H](O)CNc1ccc(OCCN(C)C)cc1	ZINC000819453186	CD	On-Demand	Anodyne	ESRRG	47	37
CN(C)CCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819453189	DE	On-Demand	Anodyne	ADRB2	24	48
CN(C)CCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819453189	DE	On-Demand	Anodyne	ADRB1	31	48
CN(C)CCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819453189	DE	On-Demand	Anodyne	ADRB3	87	59
CN(C)CCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819453189	DE	On-Demand	Anodyne	ESRRG	48	35
CN(C)CCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819453190	DE	On-Demand	Anodyne	ADRB2	24	48
CN(C)CCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819453190	DE	On-Demand	Anodyne	ADRB1	31	48
CN(C)CCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819453190	DE	On-Demand	Anodyne	ADRB3	87	59
CN(C)CCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819453190	DE	On-Demand	Anodyne	ESRRG	48	35
CN(C)CCOc1ccc(NCCC(=O)Nc2ccc(N(C)C)cc2)cc1	ZINC000819453192	FG	On-Demand	Anodyne	LTA4H	41	40
CN(C)CCOc1ccc(NCCC(=O)Nc2ccc(N(C)C)cc2)cc1	ZINC000819453192	FG	On-Demand	Anodyne	ESRRG	46	34
CN(C)CCOc1ccc(NCCC(=O)NC(N)=O)cc1Cl	ZINC000819453193	ED	On-Demand	Anodyne	MCHR2	19	41
CCOc1ccc(C2=CCN(C(=O)[C@@H]3C[C@H]4C=C[C@H]3N(C(=O)OC)C4)CC2)cc1	ZINC000819453194	GG	On-Demand	Anodyne	ADAM10	31	42
CCOc1ccc(C2=CCN(C(=O)[C@H]3C[C@H]4C=C[C@H]3N(C(=O)OC)C4)CC2)cc1	ZINC000819453195	GG	On-Demand	Anodyne	ADAM10	31	42
CN(C)CCOc1ccc(NC[C@@H](O)Cn2c(-c3ccccc3)noc2=O)cc1	ZINC000819453196	GD	On-Demand	Anodyne	ESRRG	44	34
CN(C)CCOc1ccc(NC[C@H](O)Cn2c(-c3ccccc3)noc2=O)cc1	ZINC000819453197	GD	On-Demand	Anodyne	ESRRG	44	34
CN(C)CCOc1ccc(NCCC(=O)Nc2cc(F)cc(F)c2)cc1	ZINC000819453198	FG	On-Demand	Anodyne	LTA4H	35	40
CN(C)CCOc1ccc(NCCC(=O)Nc2cc(F)cc(F)c2)cc1	ZINC000819453198	FG	On-Demand	Anodyne	ESRRG	48	35
CN(C)CCOc1ccc(NCCC(=O)Nc2ccccc2F)cc1	ZINC000819453202	EG	On-Demand	Anodyne	LTA4H	41	40
CN(C)CCOc1ccc(NCCC(=O)Nc2ccccc2F)cc1	ZINC000819453202	EG	On-Demand	Anodyne	ESRRG	50	37
CN(C)CCOc1ccc(NCCC(=O)Nc2ccccc2F)cc1	ZINC000819453202	EG	On-Demand	Anodyne	FAAH	15	40
CN(C)CCOc1ccc(NC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819453208	GH	On-Demand	Anodyne	ADRB3	16	41
CN(C)CCOc1ccc(NC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819453208	GH	On-Demand	Anodyne	ESRRG	48	35
CN(C)CCOc1ccc(NC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819453209	GH	On-Demand	Anodyne	ADRB3	16	41
CN(C)CCOc1ccc(NC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819453209	GH	On-Demand	Anodyne	ESRRG	48	35
CN(C)CCOc1ccc(NC[C@@H](O)c2ccc(Br)cc2)cc1	ZINC000819453210	GH	On-Demand	Anodyne	ESRRG	48	35
CN(C)CCOc1ccc(NC[C@H](O)c2ccc(Br)cc2)cc1	ZINC000819453211	GH	On-Demand	Anodyne	ESRRG	48	35
CN(C)CCOc1ccc(NC[C@@H](O)c2ccccc2F)cc1	ZINC000819453224	DF	On-Demand	Anodyne	ESRRG	53	38
CN(C)CCOc1ccc(NC[C@H](O)c2ccccc2F)cc1	ZINC000819453225	DF	On-Demand	Anodyne	ESRRG	53	38
O=C(Cn1cnc(-c2ccccc2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453234	DC	On-Demand	Anodyne	PRCP	17	40
O=C(Cn1cnc(-c2ccccc2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453234	DC	On-Demand	Anodyne	CPT1A	121	43
O=C(Cn1cnc(-c2ccccc2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453235	DC	On-Demand	Anodyne	PRCP	17	40
O=C(Cn1cnc(-c2ccccc2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453235	DC	On-Demand	Anodyne	CPT1A	121	43
O=C(CSc1ccc(Cl)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453236	DE	On-Demand	Anodyne	CPT1A	57	37
O=C(CSc1ccc(Cl)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453239	DE	On-Demand	Anodyne	CPT1A	57	37
O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453241	DC	On-Demand	Bother	CPT1A	71	38
O=C(CNc1ccccc1[N+](=O)[O-])N1CCC[C@H]1c1nn[nH]n1	ZINC000819453243	DC	On-Demand	Bother	CPT1A	71	38
O=C([C@@H]1CCOc2ccccc21)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453245	CD	On-Demand	Anodyne	CPT1A	50	34
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819453246	GD	On-Demand	Anodyne	ADRB2	19	49
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819453246	GD	On-Demand	Anodyne	ADRB1	46	49
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819453246	GD	On-Demand	Anodyne	ADRB3	28	43
O=C([C@H]1CCOc2ccccc21)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453247	CD	On-Demand	Anodyne	CPT1A	50	34
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819453248	GD	On-Demand	Anodyne	ADRB2	19	49
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819453248	GD	On-Demand	Anodyne	ADRB1	46	49
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819453248	GD	On-Demand	Anodyne	ADRB3	28	43
O=C([C@H]1CCOc2ccccc21)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453249	CD	On-Demand	Anodyne	CPT1A	50	34
CCNc1ccc(C(=O)Nc2ccccc2C(=O)NCCOC)cc1[N+](=O)[O-]	ZINC000819453250	GF	On-Demand	Bother	TAAR1	23	58
O=C([C@@H]1CCOc2ccccc21)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453251	CD	On-Demand	Anodyne	CPT1A	50	34
CN(C)CCOc1ccc(NCCC(=O)Nc2ccccc2F)cc1Cl	ZINC000819453252	GH	On-Demand	Anodyne	EGFR	24	44
CN(C)CCOc1ccc(NCCC(=O)Nc2ccccc2F)cc1Cl	ZINC000819453252	GH	On-Demand	Anodyne	ERBB2	26	40
CN(C)CCOc1ccc(NCCC(=O)Nc2ccccc2F)cc1Cl	ZINC000819453252	GH	On-Demand	Anodyne	MCHR2	19	42
O=C(Cn1cc(Br)c(O)nc1=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453253	FB	On-Demand	Anodyne	CPT1A	56	34
O=C(Cn1cc(Br)c(O)nc1=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453257	FB	On-Demand	Anodyne	CPT1A	56	34
CN(C)CCOc1ccc(NC[C@H](O)c2cccc3ccccc23)cc1	ZINC000819453260	FH	On-Demand	Anodyne	ESRRG	55	40
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819453273	GE	On-Demand	Anodyne	ADRB1	32	41
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819453275	GE	On-Demand	Anodyne	ADRB1	32	41
COc1ccc(-n2c(C)cc(C(=O)N3CCC[C@H]3c3nn[nH]n3)c2C)cc1	ZINC000819453281	FF	On-Demand	Clean	CPT1A	39	42
COc1ccc(-n2c(C)cc(C(=O)N3CCC[C@@H]3c3nn[nH]n3)c2C)cc1	ZINC000819453285	FF	On-Demand	Clean	CPT1A	39	42
O=C(Nc1ccccc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453287	CC	On-Demand	Anodyne	CPT1A	77	40
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819453288	EE	On-Demand	Anodyne	ADRB2	59	51
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819453288	EE	On-Demand	Anodyne	ADRB1	79	48
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819453288	EE	On-Demand	Anodyne	ADRB3	49	48
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819453288	EE	On-Demand	Anodyne	LTA4H	24	49
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819453288	EE	On-Demand	Anodyne	ESRRG	56	42
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819453288	EE	On-Demand	Anodyne	CDK4	22	45
O=C(Nc1ccccc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453289	CC	On-Demand	Anodyne	CPT1A	77	40
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819453290	EE	On-Demand	Anodyne	ADRB2	59	51
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819453290	EE	On-Demand	Anodyne	ADRB1	79	48
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819453290	EE	On-Demand	Anodyne	ADRB3	49	48
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819453290	EE	On-Demand	Anodyne	LTA4H	24	49
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819453290	EE	On-Demand	Anodyne	ESRRG	56	42
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819453290	EE	On-Demand	Anodyne	CDK4	22	45
O=C(Cc1csc(-c2cccc(F)c2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453291	FE	On-Demand	Anodyne	PRCP	28	41
O=C(Cc1csc(-c2cccc(F)c2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453291	FE	On-Demand	Anodyne	CPT1A	100	46
CN(C)CCOc1ccc(NC[C@H](O)CC(F)(F)F)cc1	ZINC000819453292	DE	On-Demand	Anodyne	ESRRG	46	34
O=C(Cc1csc(-c2cccc(F)c2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453293	FE	On-Demand	Anodyne	PRCP	28	41
O=C(Cc1csc(-c2cccc(F)c2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453293	FE	On-Demand	Anodyne	CPT1A	100	46
O=C(CCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccc(F)c(F)c1	ZINC000819453294	ED	On-Demand	Anodyne	CPT1A	79	42
O=C(CCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccc(F)c(F)c1	ZINC000819453295	ED	On-Demand	Anodyne	CPT1A	79	42
O=C(CS(=O)(=O)CCCc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453302	FC	On-Demand	Anodyne	CPT1A	86	38
O=C(CS(=O)(=O)CCCc1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453302	FC	On-Demand	Anodyne	PREP	83	40
O=C(CS(=O)(=O)CCCc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453303	FC	On-Demand	Anodyne	CPT1A	86	38
O=C(CS(=O)(=O)CCCc1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453303	FC	On-Demand	Anodyne	PREP	83	40
O=C(CSc1nnc(-c2ccc(Cl)cc2)o1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453308	GE	On-Demand	Anodyne	CPT1A	47	37
O=C(CSc1nnc(-c2ccc(Cl)cc2)o1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453309	GE	On-Demand	Anodyne	CPT1A	47	37
C[C@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453332	FE	On-Demand	Anodyne	ACE	58	40
C[C@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453332	FE	On-Demand	Anodyne	GRIN2B	63	48
C[C@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453332	FE	On-Demand	Anodyne	TRY1_BOVIN	50	33
C[C@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453332	FE	On-Demand	Anodyne	CCR3	53	31
C[C@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453332	FE	On-Demand	Anodyne	ACE2	30	40
C[C@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453332	FE	On-Demand	Anodyne	GRIN2C	19	42
C[C@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453332	FE	On-Demand	Anodyne	XIAP	42	38
C[C@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453332	FE	On-Demand	Anodyne	BRCA1	52	32
C[C@@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453333	FE	On-Demand	Anodyne	ACE	58	40
C[C@@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453333	FE	On-Demand	Anodyne	GRIN2B	63	48
C[C@@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453333	FE	On-Demand	Anodyne	TRY1_BOVIN	50	33
C[C@@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453333	FE	On-Demand	Anodyne	CCR3	53	31
C[C@@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453333	FE	On-Demand	Anodyne	ACE2	30	40
C[C@@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453333	FE	On-Demand	Anodyne	GRIN2C	19	42
C[C@@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453333	FE	On-Demand	Anodyne	XIAP	42	38
C[C@@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453333	FE	On-Demand	Anodyne	BRCA1	52	32
C[C@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453334	FE	On-Demand	Anodyne	ACE	58	40
C[C@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453334	FE	On-Demand	Anodyne	GRIN2B	63	48
C[C@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453334	FE	On-Demand	Anodyne	TRY1_BOVIN	50	33
C[C@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453334	FE	On-Demand	Anodyne	CCR3	53	31
C[C@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453334	FE	On-Demand	Anodyne	ACE2	30	40
C[C@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453334	FE	On-Demand	Anodyne	GRIN2C	19	42
C[C@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453334	FE	On-Demand	Anodyne	XIAP	42	38
C[C@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453334	FE	On-Demand	Anodyne	BRCA1	52	32
C[C@@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453335	FE	On-Demand	Anodyne	ACE	58	40
C[C@@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453335	FE	On-Demand	Anodyne	GRIN2B	63	48
C[C@@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453335	FE	On-Demand	Anodyne	TRY1_BOVIN	50	33
C[C@@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453335	FE	On-Demand	Anodyne	CCR3	53	31
C[C@@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453335	FE	On-Demand	Anodyne	ACE2	30	40
C[C@@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453335	FE	On-Demand	Anodyne	GRIN2C	19	42
C[C@@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453335	FE	On-Demand	Anodyne	XIAP	42	38
C[C@@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCC(Cc2ccccc2)CC1	ZINC000819453335	FE	On-Demand	Anodyne	BRCA1	52	32
O=C(c1csc(-c2ccc(F)c(F)c2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453340	FF	On-Demand	Anodyne	CPT1A	37	40
O=C(c1csc(-c2ccc(F)c(F)c2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453340	FF	On-Demand	Anodyne	TRPC6	53	36
O=C(c1csc(-c2ccc(F)c(F)c2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453340	FF	On-Demand	Anodyne	TRPC3	52	36
O=C(c1csc(-c2ccc(F)c(F)c2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453341	FF	On-Demand	Anodyne	CPT1A	37	40
O=C(c1csc(-c2ccc(F)c(F)c2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453341	FF	On-Demand	Anodyne	TRPC6	53	36
O=C(c1csc(-c2ccc(F)c(F)c2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453341	FF	On-Demand	Anodyne	TRPC3	52	36
O=C(CCSc1ccnc2cc(Cl)ccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453344	GG	On-Demand	Anodyne	HRP1_PLAFA	63	34
O=C(CCSc1ccnc2cc(Cl)ccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453344	GG	On-Demand	Anodyne	CPT1A	42	33
O=C(CCSc1ccnc2cc(Cl)ccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453345	GG	On-Demand	Anodyne	HRP1_PLAFA	63	34
O=C(CCSc1ccnc2cc(Cl)ccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453345	GG	On-Demand	Anodyne	CPT1A	42	33
O=C(Cc1csc2ccccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453346	DE	On-Demand	Anodyne	CPT1A	83	40
O=C(Cc1csc2ccccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453346	DE	On-Demand	Anodyne	FFAR2	54	36
O=C(Cc1csc2ccccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453347	DE	On-Demand	Anodyne	CPT1A	83	40
O=C(Cc1csc2ccccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453347	DE	On-Demand	Anodyne	FFAR2	54	36
Cc1cc(C)nc(SCC(=O)N2CCC[C@H]2c2nn[nH]n2)n1	ZINC000819453348	DD	On-Demand	Anodyne	CPT1A	59	38
Cc1cc(C)nc(SCC(=O)N2CCC[C@@H]2c2nn[nH]n2)n1	ZINC000819453349	DD	On-Demand	Anodyne	CPT1A	59	38
O=C(Cc1ccc(S(=O)(=O)N2CCCC2)s1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453350	GC	On-Demand	Anodyne	CPT1A	53	34
O=C(Cc1ccc(S(=O)(=O)N2CCCC2)s1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453351	GC	On-Demand	Anodyne	CPT1A	53	34
O=C(c1cn(Cc2ccccc2)c2ccccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453354	FG	On-Demand	Anodyne	CNR2	17	45
O=C(c1cn(Cc2ccccc2)c2ccccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453355	FG	On-Demand	Anodyne	CNR2	17	45
O=C(CS(=O)(=O)c1ccc(Cl)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453362	FC	On-Demand	Anodyne	CPT1A	42	37
CN(C)CCOc1ccc(NC[C@@H](O)CC(F)(F)F)cc1	ZINC000819453363	DE	On-Demand	Anodyne	ESRRG	46	34
CN(C)CCOc1ccc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819453368	EF	On-Demand	Bother	ESRRG	45	33
CN(C)CCOc1ccc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000819453369	EF	On-Demand	Bother	ESRRG	45	33
CN(C)CCOc1ccc(NC[C@H](O)CN2CCCC2=O)cc1	ZINC000819453371	DD	On-Demand	Anodyne	ESRRG	42	32
CN(C)CCOc1ccc(NC[C@@H](O)CN2CCCC2=O)cc1	ZINC000819453372	DD	On-Demand	Anodyne	ESRRG	42	32
CN(C)CCOc1ccc(NC[C@H](O)CN2CCN(C)CC2)cc1	ZINC000819453373	EC	On-Demand	Anodyne	ESRRG	45	34
CN(C)CCOc1ccc(NC[C@@H](O)CN2CCN(C)CC2)cc1	ZINC000819453374	EC	On-Demand	Anodyne	ESRRG	45	34
Cc1c(F)cccc1NC(=O)CCNc1ccc(OCCN(C)C)c(Cl)c1	ZINC000819453381	GI	On-Demand	Anodyne	EGFR	21	43
Cc1c(F)cccc1NC(=O)CCNc1ccc(OCCN(C)C)c(Cl)c1	ZINC000819453381	GI	On-Demand	Anodyne	MCHR2	23	42
CC[C@H](O)CNc1ccc(OCCN(CC)CC)cc1	ZINC000819453384	CF	On-Demand	Anodyne	ERG2	20	51
CN(C)CCOc1ccc(NC[C@@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819453388	FH	On-Demand	Anodyne	ESRRG	50	37
CN(C)CCOc1ccc(NC[C@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819453389	FH	On-Demand	Anodyne	ESRRG	50	37
CN(C)CCOc1ccc(NCCC(=O)Nc2ccc(Cl)cc2)cc1	ZINC000819453392	FH	On-Demand	Anodyne	LTA4H	43	41
CN(C)CCOc1ccc(NCCC(=O)Nc2ccc(Cl)cc2)cc1	ZINC000819453392	FH	On-Demand	Anodyne	ESRRG	47	35
CN(C)CCOc1ccc(NCCC(=O)Nc2ccc(Cl)cc2)cc1	ZINC000819453392	FH	On-Demand	Anodyne	UTS2	41	34
CN(C)CCOc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819453401	FE	On-Demand	Anodyne	ESRRG	47	35
CN(C)CCOc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819453401	FE	On-Demand	Anodyne	NOD2	44	41
CN(C)CCOc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819453402	FE	On-Demand	Anodyne	ESRRG	47	35
CN(C)CCOc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819453402	FE	On-Demand	Anodyne	NOD2	44	41
CN(C)CCOc1ccc(NCCC(=O)Nc2cccc(Cl)c2)cc1	ZINC000819453403	FH	On-Demand	Anodyne	ESRRG	47	35
CN(C)CCOc1ccc(NCCC(=O)Nc2cccc(Cl)c2)cc1	ZINC000819453403	FH	On-Demand	Anodyne	MCHR2	24	41
CN(C)CCOc1ccc(NC[C@@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819453404	GH	On-Demand	Anodyne	ESRRG	44	32
CN(C)CCOc1ccc(NC[C@H](O)c2ccc(F)c(Br)c2)cc1	ZINC000819453405	GH	On-Demand	Anodyne	ESRRG	44	32
CN(C)CCOc1ccc(NCCC#N)cc1	ZINC000819453417	BD	On-Demand	Mild	ESRRG	49	45
CN(C)CCOc1ccc(NC[C@@H](O)CC2CCCC2)cc1	ZINC000819453418	DF	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1ccc(NC[C@H](O)CC2CCCC2)cc1	ZINC000819453419	DF	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453429	FG	On-Demand	Anodyne	ADRB2	34	42
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453429	FG	On-Demand	Anodyne	ADRB1	55	42
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453429	FG	On-Demand	Anodyne	GRIN1	28	46
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453429	FG	On-Demand	Anodyne	ADRB3	30	41
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453429	FG	On-Demand	Anodyne	ESRRG	46	34
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453429	FG	On-Demand	Anodyne	CDK4	22	47
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453430	FG	On-Demand	Anodyne	ADRB2	34	42
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453430	FG	On-Demand	Anodyne	ADRB1	55	42
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453430	FG	On-Demand	Anodyne	GRIN1	28	46
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453430	FG	On-Demand	Anodyne	ADRB3	30	41
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453430	FG	On-Demand	Anodyne	ESRRG	46	34
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453430	FG	On-Demand	Anodyne	CDK4	22	47
CN(C)CCOc1ccc(NCCC(=O)Nc2ccccc2)cc1Cl	ZINC000819453433	FH	On-Demand	Anodyne	CPT1A	44	31
CN(C)CCOc1ccc(NCCC(=O)Nc2ccccc2)cc1Cl	ZINC000819453433	FH	On-Demand	Anodyne	MCHR2	26	46
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2F)cc1	ZINC000819453436	EF	On-Demand	Anodyne	ADRB2	38	40
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2F)cc1	ZINC000819453436	EF	On-Demand	Anodyne	ADRB1	66	38
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2F)cc1	ZINC000819453436	EF	On-Demand	Anodyne	GRIN1	17	42
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2F)cc1	ZINC000819453436	EF	On-Demand	Anodyne	ESRRG	48	35
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2F)cc1	ZINC000819453437	EF	On-Demand	Anodyne	ADRB2	38	40
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2F)cc1	ZINC000819453437	EF	On-Demand	Anodyne	ADRB1	66	38
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2F)cc1	ZINC000819453437	EF	On-Demand	Anodyne	GRIN1	17	42
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2F)cc1	ZINC000819453437	EF	On-Demand	Anodyne	ESRRG	48	35
Cc1ccccc1[C@@H](O)CNc1ccc(OCCN(C)C)cc1	ZINC000819453440	DG	On-Demand	Anodyne	ESRRG	53	39
Cn1ccnc1COc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819453456	GF	On-Demand	Anodyne	NOD2	41	38
Cn1ccnc1COc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819453457	GF	On-Demand	Anodyne	NOD2	41	38
O=C(CS(=O)(=O)c1ccc(Cl)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453461	FC	On-Demand	Anodyne	CPT1A	42	37
C[C@@H](CNc1ccc(OCCN(C)C)cc1)S(C)(=O)=O	ZINC000819453462	DD	On-Demand	Anodyne	ESRRG	45	33
O=C(CCc1nc2ccccc2n1-c1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453466	GF	On-Demand	Anodyne	CPT1A	103	41
O=C(CCc1nc2ccccc2n1-c1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453467	GF	On-Demand	Anodyne	CPT1A	103	41
C=CC(=O)NCc1ccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819453470	EC	On-Demand	Anodyne	TMPRSS11D	56	33
C=CC(=O)NCc1ccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819453471	EC	On-Demand	Anodyne	TMPRSS11D	56	33
N#Cc1ccccc1NC(=O)CCCC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453472	FD	On-Demand	Mild	CPT1A	82	37
N#Cc1ccccc1NC(=O)CCCC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453472	FD	On-Demand	Mild	PREP	42	35
N#Cc1ccccc1NC(=O)CCCC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453473	FD	On-Demand	Mild	CPT1A	82	37
N#Cc1ccccc1NC(=O)CCCC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453473	FD	On-Demand	Mild	PREP	42	35
O=C(COc1cccc(C(F)(F)F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453476	ED	On-Demand	Anodyne	CPT1A	148	56
O=C(COc1cccc(C(F)(F)F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453476	ED	On-Demand	Anodyne	CPT2	48	37
O=C(COc1cccc(C(F)(F)F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453476	ED	On-Demand	Anodyne	CHRNA10	20	45
O=C(COc1cccc(C(F)(F)F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453476	ED	On-Demand	Anodyne	LIPG	44	32
O=C(COc1cccc(C(F)(F)F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453477	ED	On-Demand	Anodyne	CPT1A	148	56
O=C(COc1cccc(C(F)(F)F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453477	ED	On-Demand	Anodyne	CPT2	48	37
O=C(COc1cccc(C(F)(F)F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453477	ED	On-Demand	Anodyne	CHRNA10	20	45
O=C(COc1cccc(C(F)(F)F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453477	ED	On-Demand	Anodyne	LIPG	44	32
O=C1CCc2cc(OCCCC(=O)N3CCC[C@H]3c3nn[nH]n3)ccc2N1	ZINC000819453490	FD	On-Demand	Anodyne	CPT1A	78	41
O=C1CCc2cc(OCCCC(=O)N3CCC[C@H]3c3nn[nH]n3)ccc2N1	ZINC000819453490	FD	On-Demand	Anodyne	CPT2	20	41
O=C1CCc2cc(OCCCC(=O)N3CCC[C@@H]3c3nn[nH]n3)ccc2N1	ZINC000819453491	FD	On-Demand	Anodyne	CPT1A	78	41
O=C1CCc2cc(OCCCC(=O)N3CCC[C@@H]3c3nn[nH]n3)ccc2N1	ZINC000819453491	FD	On-Demand	Anodyne	CPT2	20	41
O=C(CCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccc(-c2ccccc2)cc1	ZINC000819453500	GG	On-Demand	Anodyne	PRCP	37	44
O=C(CCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccc(-c2ccccc2)cc1	ZINC000819453500	GG	On-Demand	Anodyne	CPT1A	127	43
O=C(CCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccc(-c2ccccc2)cc1	ZINC000819453500	GG	On-Demand	Anodyne	PREP	43	49
O=C(CCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccc(-c2ccccc2)cc1	ZINC000819453501	GG	On-Demand	Anodyne	PRCP	37	44
O=C(CCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccc(-c2ccccc2)cc1	ZINC000819453501	GG	On-Demand	Anodyne	CPT1A	127	43
O=C(CCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccc(-c2ccccc2)cc1	ZINC000819453501	GG	On-Demand	Anodyne	PREP	43	49
N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819453504	GG	On-Demand	Mild	CPT1A	90	38
N#Cc1c(Cl)cccc1Oc1cccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819453505	GG	On-Demand	Mild	CPT1A	90	38
O=C([C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453510	GG	On-Demand	Anodyne	CPT1A	111	39
O=C([C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453510	GG	On-Demand	Anodyne	CPT2	40	33
O=C([C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453510	GG	On-Demand	Anodyne	PREP	61	39
O=C([C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453511	GG	On-Demand	Anodyne	CPT1A	111	39
O=C([C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453511	GG	On-Demand	Anodyne	CPT2	40	33
O=C([C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453511	GG	On-Demand	Anodyne	PREP	61	39
O=C([C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453512	GG	On-Demand	Anodyne	CPT1A	111	39
O=C([C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453512	GG	On-Demand	Anodyne	CPT2	40	33
O=C([C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453512	GG	On-Demand	Anodyne	PREP	61	39
O=C([C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453513	GG	On-Demand	Anodyne	CPT1A	111	39
O=C([C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453513	GG	On-Demand	Anodyne	CPT2	40	33
O=C([C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453513	GG	On-Demand	Anodyne	PREP	61	39
O=C(Cc1csc(-c2cccc(Br)c2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453526	HF	On-Demand	Anodyne	CPT1A	98	44
O=C(Cc1csc(-c2cccc(Br)c2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453527	HF	On-Demand	Anodyne	CPT1A	98	44
C[C@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCc2ccccc2C1	ZINC000819453532	ED	On-Demand	Anodyne	TRHR	48	35
C[C@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCc2ccccc2C1	ZINC000819453533	ED	On-Demand	Anodyne	TRHR	48	35
C[C@@H](C(=O)N1CCC[C@@H]1c1nn[nH]n1)N1CCc2ccccc2C1	ZINC000819453534	ED	On-Demand	Anodyne	TRHR	48	35
C[C@@H](C(=O)N1CCC[C@H]1c1nn[nH]n1)N1CCc2ccccc2C1	ZINC000819453535	ED	On-Demand	Anodyne	TRHR	48	35
C/C=C\c1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)c(OC)c1	ZINC000819453536	ED	On-Demand	Anodyne	CPT1A	105	40
C/C=C\c1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)c(OC)c1	ZINC000819453536	ED	On-Demand	Anodyne	ACKR3	41	35
C/C=C\c1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)c(OC)c1	ZINC000819453537	ED	On-Demand	Anodyne	CPT1A	105	40
C/C=C\c1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)c(OC)c1	ZINC000819453537	ED	On-Demand	Anodyne	ACKR3	41	35
C/C=C/c1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)c(OC)c1	ZINC000819453538	ED	On-Demand	Anodyne	CPT1A	105	40
C/C=C/c1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)c(OC)c1	ZINC000819453538	ED	On-Demand	Anodyne	ACKR3	41	35
C/C=C/c1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)c(OC)c1	ZINC000819453539	ED	On-Demand	Anodyne	CPT1A	105	40
C/C=C/c1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)c(OC)c1	ZINC000819453539	ED	On-Demand	Anodyne	ACKR3	41	35
COc1cccc(OC)c1CC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453540	DD	On-Demand	Anodyne	CPT1A	94	40
COc1cccc(OC)c1CC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453541	DD	On-Demand	Anodyne	CPT1A	94	40
O=Cc1ccccc1OCC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453546	DC	On-Demand	Anodyne	CPT1A	131	46
O=Cc1ccccc1OCC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453546	DC	On-Demand	Anodyne	CPT2	43	34
O=Cc1ccccc1OCC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453547	DC	On-Demand	Anodyne	CPT1A	131	46
O=Cc1ccccc1OCC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453547	DC	On-Demand	Anodyne	CPT2	43	34
O=C(CCSc1ccccc1Cl)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453552	EF	On-Demand	Anodyne	CPT1A	111	40
O=C(CCSc1ccccc1Cl)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453553	EF	On-Demand	Anodyne	CPT1A	111	40
N#Cc1ccc(C(=O)NCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819453554	EC	On-Demand	Mild	CPT1A	58	43
N#Cc1ccc(C(=O)NCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819453554	EC	On-Demand	Mild	DPP4	33	54
N#Cc1ccc(C(=O)NCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819453554	EC	On-Demand	Mild	PREP	29	44
N#Cc1ccc(C(=O)NCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819453554	EC	On-Demand	Mild	DPP9	19	44
N#Cc1ccc(C(=O)NCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819453555	EC	On-Demand	Mild	CPT1A	58	43
N#Cc1ccc(C(=O)NCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819453555	EC	On-Demand	Mild	DPP4	33	54
N#Cc1ccc(C(=O)NCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819453555	EC	On-Demand	Mild	PREP	29	44
N#Cc1ccc(C(=O)NCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819453555	EC	On-Demand	Mild	DPP9	19	44
CS(=O)(=O)c1ccccc1CC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453558	EC	On-Demand	Anodyne	CPT1A	83	42
CS(=O)(=O)c1ccccc1CC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453559	EC	On-Demand	Anodyne	CPT1A	83	42
COC[C@@H](O)CNc1ccc(OCc2nccn2C)cc1	ZINC000819453567	CD	On-Demand	Anodyne	ADRB1	22	40
Cn1ccnc1COc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819453568	FG	On-Demand	Anodyne	ADRB1	30	41
Cn1ccnc1COc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819453569	FG	On-Demand	Anodyne	ADRB1	30	41
CN(C)CCOc1ccc(NC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819453582	EG	On-Demand	Anodyne	ESRRG	46	33
CN(C)CCOc1ccc(NC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819453583	EG	On-Demand	Anodyne	ESRRG	46	33
CON(C)C(=O)CCNc1ccc(OCCN(C)C)cc1	ZINC000819453584	CD	On-Demand	Anodyne	LTA4H	20	40
CON(C)C(=O)CCNc1ccc(OCCN(C)C)cc1	ZINC000819453584	CD	On-Demand	Anodyne	ESRRG	48	36
CN(C)CCOc1ccc(NC[C@H](O)CN2C(=O)c3ccccc3C2=O)cc1	ZINC000819453592	GD	On-Demand	Anodyne	ESRRG	48	38
CN(C)CCOc1ccc(NC[C@@H](O)CN2C(=O)c3ccccc3C2=O)cc1	ZINC000819453593	GD	On-Demand	Anodyne	ESRRG	48	38
Cn1ccnc1COc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453603	GH	On-Demand	Anodyne	ADRB1	45	43
Cn1ccnc1COc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453603	GH	On-Demand	Anodyne	GRIN1	23	42
Cn1ccnc1COc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453603	GH	On-Demand	Anodyne	ADRB3	30	43
Cn1ccnc1COc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453603	GH	On-Demand	Anodyne	CDK4	16	41
Cn1ccnc1COc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453604	GH	On-Demand	Anodyne	ADRB1	45	43
Cn1ccnc1COc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453604	GH	On-Demand	Anodyne	GRIN1	23	42
Cn1ccnc1COc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453604	GH	On-Demand	Anodyne	ADRB3	30	43
Cn1ccnc1COc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819453604	GH	On-Demand	Anodyne	CDK4	16	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC=C(c3ccccc3Cl)CC1)C2	ZINC000819453607	GH	On-Demand	Anodyne	ADAM10	34	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC=C(c3ccccc3Cl)CC1)C2	ZINC000819453608	GH	On-Demand	Anodyne	ADAM10	34	42
CN(C)CCOc1ccc(NCCC(=O)Nc2cccnc2)cc1Cl	ZINC000819453609	FG	On-Demand	Anodyne	MCHR2	24	43
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819453614	GE	On-Demand	Anodyne	ADRB2	26	40
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819453614	GE	On-Demand	Anodyne	ADRB1	56	41
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819453614	GE	On-Demand	Anodyne	GRIN1	20	41
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819453614	GE	On-Demand	Anodyne	ADRB3	40	40
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819453615	GE	On-Demand	Anodyne	ADRB2	26	40
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819453615	GE	On-Demand	Anodyne	ADRB1	56	41
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819453615	GE	On-Demand	Anodyne	GRIN1	20	41
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)N(C)C(=O)CO3)cc1	ZINC000819453615	GE	On-Demand	Anodyne	ADRB3	40	40
CN(C)CCOc1ccc(NC[C@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819453621	GH	On-Demand	Anodyne	ADRB1	43	37
CN(C)CCOc1ccc(NC[C@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819453621	GH	On-Demand	Anodyne	ESRRG	46	34
CN(C)CCOc1ccc(NC[C@@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819453622	GH	On-Demand	Anodyne	ADRB1	43	37
CN(C)CCOc1ccc(NC[C@@H](O)COc2c(Cl)cccc2Cl)cc1	ZINC000819453622	GH	On-Demand	Anodyne	ESRRG	46	34
CN(C)CCOc1ccc(NC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819453625	EF	On-Demand	Mild	ESRRG	48	39
CN(C)CCOc1ccc(NC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819453626	EF	On-Demand	Mild	ESRRG	48	39
CN(C)CCOc1ccc(NC[C@H](C#N)CCC#N)cc1	ZINC000819453644	CE	On-Demand	Mild	ESRRG	39	42
CN(C)CCOc1ccc(NC[C@@H](C#N)CCC#N)cc1	ZINC000819453645	CE	On-Demand	Mild	ESRRG	39	42
O=C(c1cc(C2CC2)no1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453666	CD	On-Demand	Anodyne	CPT1A	44	35
O=C(c1cc(C2CC2)no1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453667	CD	On-Demand	Anodyne	CPT1A	44	35
Cc1ccc(OCc2nc(CC(=O)N3CCC[C@H]3c3nn[nH]n3)cs2)cc1	ZINC000819453668	GE	On-Demand	Anodyne	CPT1A	103	40
CN(C)CCOc1ccc(NC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819453671	EG	On-Demand	Anodyne	ESRRG	45	33
CN(C)CCOc1ccc(NC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819453672	EG	On-Demand	Anodyne	ESRRG	45	33
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819453673	FE	On-Demand	Anodyne	GRIN1	20	49
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819453673	FE	On-Demand	Anodyne	ESRRG	41	30
Cc1ccc(OCc2nc(CC(=O)N3CCC[C@@H]3c3nn[nH]n3)cs2)cc1	ZINC000819453674	GE	On-Demand	Anodyne	CPT1A	103	40
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819453675	FE	On-Demand	Anodyne	GRIN1	20	49
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819453675	FE	On-Demand	Anodyne	ESRRG	41	30
CN(C)CCOc1ccc(NCCC(=O)Nc2cccnc2)cc1	ZINC000819453677	EE	On-Demand	Anodyne	LTA4H	39	43
CN(C)CCOc1ccc(NCCC(=O)Nc2cccnc2)cc1	ZINC000819453677	EE	On-Demand	Anodyne	ESRRG	46	33
O=C(Cc1cc2c(ccc3ccccc32)o1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453679	EG	On-Demand	Anodyne	CPT1A	106	39
O=C(Cc1cc2c(ccc3ccccc32)o1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453680	EG	On-Demand	Anodyne	CPT1A	106	39
C#CCNC(=O)CCNc1ccc(OCCN(C)C)cc1	ZINC000819453681	CD	On-Demand	Mild	ESRRG	46	34
O=C(CSc1nnc(-c2ccc3ccccc3c2)o1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453683	HF	On-Demand	Anodyne	CPT1A	105	42
CN(C)CCOc1ccc(NC[C@H](O)COC2CCOCC2)cc1	ZINC000819453685	ED	On-Demand	Anodyne	ADRB1	25	42
O=C(CSc1nnc(-c2ccc3ccccc3c2)o1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453686	HF	On-Demand	Anodyne	CPT1A	105	42
CN(C)CCOc1ccc(NC[C@@H](O)COC2CCOCC2)cc1	ZINC000819453687	ED	On-Demand	Anodyne	ADRB1	25	42
COc1ccccc1/C=C(/C(=O)NC[C@@H]1CCCNC1=O)c1ccccc1	ZINC000819453693	FF	On-Demand	Anodyne	MBTPS1	48	32
COc1ccccc1/C=C(/C(=O)NC[C@H]1CCCNC1=O)c1ccccc1	ZINC000819453695	FF	On-Demand	Anodyne	MBTPS1	48	32
O=Cc1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819453700	DC	On-Demand	Anodyne	PRCP	17	44
O=Cc1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819453700	DC	On-Demand	Anodyne	CPT1A	146	54
O=Cc1ccc(OCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819453700	DC	On-Demand	Anodyne	CPT2	47	37
O=Cc1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819453701	DC	On-Demand	Anodyne	PRCP	17	44
O=Cc1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819453701	DC	On-Demand	Anodyne	CPT1A	146	54
O=Cc1ccc(OCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819453701	DC	On-Demand	Anodyne	CPT2	47	37
O=C([C@@H]1CCc2ccccc21)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453706	CD	On-Demand	Anodyne	CPT1A	58	35
O=C([C@@H]1CCc2ccccc21)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453707	CD	On-Demand	Anodyne	CPT1A	58	35
O=C([C@H]1CCc2ccccc21)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453708	CD	On-Demand	Anodyne	CPT1A	58	35
O=C([C@H]1CCc2ccccc21)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453709	CD	On-Demand	Anodyne	CPT1A	58	35
Cc1nnc(SCC(=O)N2CCC[C@H]2c2nn[nH]n2)n1Cc1ccccc1	ZINC000819453710	GD	On-Demand	Anodyne	CPT1A	79	36
Cc1nnc(SCC(=O)N2CCC[C@@H]2c2nn[nH]n2)n1Cc1ccccc1	ZINC000819453711	GD	On-Demand	Anodyne	CPT1A	79	36
O=C(CCN1CCN(c2ccccc2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453714	FD	On-Demand	Anodyne	HTR1A	66	48
O=C(CCN1CCN(c2ccccc2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453714	FD	On-Demand	Anodyne	DRD2	32	48
O=C(CCN1CCN(c2ccccc2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453714	FD	On-Demand	Anodyne	DRD4	29	42
O=C(CCN1CCN(c2ccccc2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453714	FD	On-Demand	Anodyne	HTR2A	31	40
O=C(CCN1CCN(c2ccccc2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453714	FD	On-Demand	Anodyne	DRD3	32	41
O=C(CCN1CCN(c2ccccc2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453714	FD	On-Demand	Anodyne	HTR7	80	46
O=C(CCN1CCN(c2ccccc2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453714	FD	On-Demand	Anodyne	PRCP	36	58
O=C(CCN1CCN(c2ccccc2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453714	FD	On-Demand	Anodyne	CPT1A	115	45
O=C(CCN1CCN(c2ccccc2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453715	FD	On-Demand	Anodyne	HTR1A	66	48
O=C(CCN1CCN(c2ccccc2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453715	FD	On-Demand	Anodyne	DRD2	32	48
O=C(CCN1CCN(c2ccccc2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453715	FD	On-Demand	Anodyne	DRD4	29	42
O=C(CCN1CCN(c2ccccc2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453715	FD	On-Demand	Anodyne	HTR2A	31	40
O=C(CCN1CCN(c2ccccc2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453715	FD	On-Demand	Anodyne	DRD3	32	41
O=C(CCN1CCN(c2ccccc2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453715	FD	On-Demand	Anodyne	HTR7	80	46
O=C(CCN1CCN(c2ccccc2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453715	FD	On-Demand	Anodyne	PRCP	36	58
O=C(CCN1CCN(c2ccccc2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453715	FD	On-Demand	Anodyne	CPT1A	115	45
O=C(NCCCc1ccccc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453718	EC	On-Demand	Anodyne	F2	32	41
O=C(NCCCc1ccccc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453718	EC	On-Demand	Anodyne	FKBP1A	48	48
O=C(NCCCc1ccccc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453718	EC	On-Demand	Anodyne	TRY1_BOVIN	48	38
O=C(NCCCc1ccccc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453718	EC	On-Demand	Anodyne	PREP	75	38
O=C(NCCCc1ccccc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453719	EC	On-Demand	Anodyne	F2	32	41
O=C(NCCCc1ccccc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453719	EC	On-Demand	Anodyne	FKBP1A	48	48
O=C(NCCCc1ccccc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453719	EC	On-Demand	Anodyne	TRY1_BOVIN	48	38
O=C(NCCCc1ccccc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453719	EC	On-Demand	Anodyne	PREP	75	38
O=C(/C=C\c1cccc(F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453720	CD	On-Demand	Anodyne	CPT1A	42	38
O=C(/C=C/c1cccc(F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453721	CD	On-Demand	Anodyne	CPT1A	42	38
O=C(/C=C/c1cccc(F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453722	CD	On-Demand	Anodyne	CPT1A	42	38
O=C(/C=C\c1cccc(F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453723	CD	On-Demand	Anodyne	CPT1A	42	38
O=C(c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453728	IE	On-Demand	Anodyne	SFRP1	58	36
O=C(c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453728	IE	On-Demand	Anodyne	WNT3	58	36
O=C(c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453729	IE	On-Demand	Anodyne	SFRP1	58	36
O=C(c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453729	IE	On-Demand	Anodyne	WNT3	58	36
N#Cc1cccc(OCc2cccc(C(=O)N3CCC[C@@H]3c3nn[nH]n3)c2)c1	ZINC000819453736	FF	On-Demand	Mild	CPT1A	95	44
N#Cc1cccc(OCc2cccc(C(=O)N3CCC[C@H]3c3nn[nH]n3)c2)c1	ZINC000819453737	FF	On-Demand	Mild	CPT1A	95	44
O=C1N[C@]2(CCc3ccccc32)C(=O)N1CC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453738	GC	On-Demand	Anodyne	CPT1A	55	34
O=C1N[C@@]2(CCc3ccccc32)C(=O)N1CC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453739	GC	On-Demand	Anodyne	CPT1A	55	34
O=C1N[C@@]2(CCc3ccccc32)C(=O)N1CC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453740	GC	On-Demand	Anodyne	CPT1A	55	34
O=C1N[C@]2(CCc3ccccc32)C(=O)N1CC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453741	GC	On-Demand	Anodyne	CPT1A	55	34
COC(=O)c1cccc(CC(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819453746	DC	On-Demand	Anodyne	CPT1A	100	43
COC(=O)c1cccc(CC(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819453747	DC	On-Demand	Anodyne	CPT1A	100	43
O=C(CNS(=O)(=O)c1cccs1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453752	EB	On-Demand	Anodyne	CPT1A	51	38
O=C(CNS(=O)(=O)c1cccs1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453753	EB	On-Demand	Anodyne	CPT1A	51	38
O=C(Cc1cnc2ccccc2c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453756	DD	On-Demand	Anodyne	PRCP	41	36
O=C(Cc1cnc2ccccc2c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453756	DD	On-Demand	Anodyne	CPT1A	114	42
O=C(Cc1cnc2ccccc2c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453757	DD	On-Demand	Anodyne	PRCP	41	36
O=C(Cc1cnc2ccccc2c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453757	DD	On-Demand	Anodyne	CPT1A	114	42
O=C(Cc1cccc(OC(F)(F)F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453766	EE	On-Demand	Anodyne	BRS3	33	42
O=C(Cc1cccc(OC(F)(F)F)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453766	EE	On-Demand	Anodyne	CPT1A	110	40
O=C(Cc1cccc(OC(F)(F)F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453767	EE	On-Demand	Anodyne	BRS3	33	42
O=C(Cc1cccc(OC(F)(F)F)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453767	EE	On-Demand	Anodyne	CPT1A	110	40
O=C(Cn1cnc2sccc2c1=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453770	EC	On-Demand	Anodyne	CPT1A	45	36
O=C(Cn1cnc2sccc2c1=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453771	EC	On-Demand	Anodyne	CPT1A	45	36
O=C(CCc1cc(Cl)ccc1Br)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453776	GF	On-Demand	Anodyne	PRCP	28	40
O=C(CCc1cc(Cl)ccc1Br)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453776	GF	On-Demand	Anodyne	CPT1A	65	34
O=C(CCc1cc(Cl)ccc1Br)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453777	GF	On-Demand	Anodyne	PRCP	28	40
O=C(CCc1cc(Cl)ccc1Br)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453777	GF	On-Demand	Anodyne	CPT1A	65	34
O=C([C@H]1CC(c2cccc(F)c2)=NO1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453794	ED	On-Demand	Anodyne	CPT1A	65	42
O=C([C@H]1CC(c2cccc(F)c2)=NO1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453794	ED	On-Demand	Anodyne	LUCI_PHOPY	16	40
O=C([C@@H]1CC(c2cccc(F)c2)=NO1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453795	ED	On-Demand	Anodyne	CPT1A	65	42
O=C([C@@H]1CC(c2cccc(F)c2)=NO1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453795	ED	On-Demand	Anodyne	LUCI_PHOPY	16	40
O=C([C@H]1CC(c2cccc(F)c2)=NO1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453796	ED	On-Demand	Anodyne	CPT1A	65	42
O=C([C@H]1CC(c2cccc(F)c2)=NO1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453796	ED	On-Demand	Anodyne	LUCI_PHOPY	16	40
O=C([C@@H]1CC(c2cccc(F)c2)=NO1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453797	ED	On-Demand	Anodyne	CPT1A	65	42
O=C([C@@H]1CC(c2cccc(F)c2)=NO1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453797	ED	On-Demand	Anodyne	LUCI_PHOPY	16	40
O=C(c1ccc(COc2ccccc2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453798	EF	On-Demand	Anodyne	CPT1A	134	44
O=C(c1ccc(COc2ccccc2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453798	EF	On-Demand	Anodyne	CPT2	44	34
O=C(c1ccc(COc2ccccc2)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453798	EF	On-Demand	Anodyne	PREP	50	37
O=C(c1ccc(COc2ccccc2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453799	EF	On-Demand	Anodyne	CPT1A	134	44
O=C(c1ccc(COc2ccccc2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453799	EF	On-Demand	Anodyne	CPT2	44	34
O=C(c1ccc(COc2ccccc2)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453799	EF	On-Demand	Anodyne	PREP	50	37
O=C(CCOc1cccc(Br)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453808	FE	On-Demand	Anodyne	CPT1A	125	43
O=C(CCOc1cccc(Br)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453809	FE	On-Demand	Anodyne	CPT1A	125	43
COC(=O)c1cccc(C(=O)N2CCC[C@H]2c2nn[nH]n2)n1	ZINC000819453810	DC	On-Demand	Anodyne	CPT1A	71	43
COC(=O)c1cccc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)n1	ZINC000819453811	DC	On-Demand	Anodyne	CPT1A	71	43
O=C(NCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccc(Cl)c(Cl)c1	ZINC000819453826	FD	On-Demand	Anodyne	CPT1A	73	35
O=C(NCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1ccc(Cl)c(Cl)c1	ZINC000819453826	FD	On-Demand	Anodyne	PREP	26	45
O=C(NCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccc(Cl)c(Cl)c1	ZINC000819453827	FD	On-Demand	Anodyne	CPT1A	73	35
O=C(NCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1ccc(Cl)c(Cl)c1	ZINC000819453827	FD	On-Demand	Anodyne	PREP	26	45
O=C(NCc1ccc(F)cc1)C(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453828	DC	On-Demand	Anodyne	CCR3	58	32
O=C(NCc1ccc(F)cc1)C(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453829	DC	On-Demand	Anodyne	CCR3	58	32
O=C(CSc1nnc(-c2ccccc2)n1-c1ccccc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453830	IF	On-Demand	Anodyne	CPT1A	91	40
O=C(CSc1nnc(-c2ccccc2)n1-c1ccccc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453831	IF	On-Demand	Anodyne	CPT1A	91	40
O=C1Nc2ccccc2O[C@@H]1CC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453834	EC	On-Demand	Anodyne	CPT1A	75	37
O=C1Nc2ccccc2O[C@H]1CC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453835	EC	On-Demand	Anodyne	CPT1A	75	37
O=C1Nc2ccccc2O[C@H]1CC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453836	EC	On-Demand	Anodyne	CPT1A	75	37
O=C1Nc2ccccc2O[C@@H]1CC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453837	EC	On-Demand	Anodyne	CPT1A	75	37
CCn1cc(C(=O)N2CCC[C@H]2c2nn[nH]n2)c2ccccc21	ZINC000819453846	DE	On-Demand	Anodyne	CNR1	20	47
CCn1cc(C(=O)N2CCC[C@H]2c2nn[nH]n2)c2ccccc21	ZINC000819453846	DE	On-Demand	Anodyne	TPSAB1	15	44
CCn1cc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)c2ccccc21	ZINC000819453847	DE	On-Demand	Anodyne	CNR1	20	47
CCn1cc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)c2ccccc21	ZINC000819453847	DE	On-Demand	Anodyne	TPSAB1	15	44
O=C(CN1CCN(c2ccccn2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453848	EC	On-Demand	Anodyne	HTR1A	17	44
O=C(CN1CCN(c2ccccn2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453848	EC	On-Demand	Anodyne	DRD4	28	40
O=C(CN1CCN(c2ccccn2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453848	EC	On-Demand	Anodyne	CPT1A	94	45
O=C(CN1CCN(c2ccccn2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453848	EC	On-Demand	Anodyne	PREP	17	40
O=C(CN1CCN(c2ccccn2)CC1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453848	EC	On-Demand	Anodyne	SLC27A1	21	41
O=C(CN1CCN(c2ccccn2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453849	EC	On-Demand	Anodyne	HTR1A	17	44
O=C(CN1CCN(c2ccccn2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453849	EC	On-Demand	Anodyne	DRD4	28	40
O=C(CN1CCN(c2ccccn2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453849	EC	On-Demand	Anodyne	CPT1A	94	45
O=C(CN1CCN(c2ccccn2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453849	EC	On-Demand	Anodyne	PREP	17	40
O=C(CN1CCN(c2ccccn2)CC1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453849	EC	On-Demand	Anodyne	SLC27A1	21	41
O=C(c1cc(Oc2ccccc2)ccn1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453858	EE	On-Demand	Anodyne	CPT1A	126	42
O=C(c1cc(Oc2ccccc2)ccn1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453858	EE	On-Demand	Anodyne	CPT2	43	35
O=C(c1cc(Oc2ccccc2)ccn1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453858	EE	On-Demand	Anodyne	CFTR	32	44
O=C(c1cc(Oc2ccccc2)ccn1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453859	EE	On-Demand	Anodyne	CPT1A	126	42
O=C(c1cc(Oc2ccccc2)ccn1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453859	EE	On-Demand	Anodyne	CPT2	43	35
O=C(c1cc(Oc2ccccc2)ccn1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453859	EE	On-Demand	Anodyne	CFTR	32	44
O=C(c1nn(-c2ccc(Cl)cc2Cl)c2c1CCC2)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453868	HG	On-Demand	Anodyne	CNR1	64	39
O=C(c1nn(-c2ccc(Cl)cc2Cl)c2c1CCC2)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453868	HG	On-Demand	Anodyne	CNR2	20	40
O=C(c1nn(-c2ccc(Cl)cc2Cl)c2c1CCC2)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453869	HG	On-Demand	Anodyne	CNR1	64	39
O=C(c1nn(-c2ccc(Cl)cc2Cl)c2c1CCC2)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453869	HG	On-Demand	Anodyne	CNR2	20	40
O=C(c1cnc(-c2ccc3c(c2)OCO3)s1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453872	FE	On-Demand	Anodyne	CPT1A	80	45
O=C(c1cnc(-c2ccc3c(c2)OCO3)s1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453872	FE	On-Demand	Anodyne	TRPC6	40	36
O=C(c1cnc(-c2ccc3c(c2)OCO3)s1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453873	FE	On-Demand	Anodyne	CPT1A	80	45
O=C(c1cnc(-c2ccc3c(c2)OCO3)s1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453873	FE	On-Demand	Anodyne	TRPC6	40	36
O=C(CCc1cccc(Br)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453874	FE	On-Demand	Anodyne	PRCP	24	41
O=C(CCc1cccc(Br)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453874	FE	On-Demand	Anodyne	CPT1A	91	38
O=C(CCc1cccc(Br)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453874	FE	On-Demand	Anodyne	PREP	43	35
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000819453902	FI	On-Demand	Anodyne	RBP4	66	39
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000819453903	FI	On-Demand	Anodyne	RBP4	66	39
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000819453904	FI	On-Demand	Anodyne	RBP4	66	39
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000819453905	FI	On-Demand	Anodyne	RBP4	66	39
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)cc3F)cc2)C1	ZINC000819453906	GH	On-Demand	Anodyne	ESR1	43	42
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)cc3F)cc2)C1	ZINC000819453906	GH	On-Demand	Anodyne	ESR2	23	43
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)cc3F)cc2)C1	ZINC000819453906	GH	On-Demand	Anodyne	EBP	19	44
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)cc3F)cc2)C1	ZINC000819453907	GH	On-Demand	Anodyne	ESR1	43	42
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)cc3F)cc2)C1	ZINC000819453907	GH	On-Demand	Anodyne	ESR2	23	43
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)cc3F)cc2)C1	ZINC000819453907	GH	On-Demand	Anodyne	EBP	19	44
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)cc3F)cc2)C1	ZINC000819453908	GH	On-Demand	Anodyne	ESR1	43	42
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)cc3F)cc2)C1	ZINC000819453908	GH	On-Demand	Anodyne	ESR2	23	43
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)cc3F)cc2)C1	ZINC000819453908	GH	On-Demand	Anodyne	EBP	19	44
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)cc3F)cc2)C1	ZINC000819453909	GH	On-Demand	Anodyne	ESR1	43	42
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)cc3F)cc2)C1	ZINC000819453909	GH	On-Demand	Anodyne	ESR2	23	43
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)cc3F)cc2)C1	ZINC000819453909	GH	On-Demand	Anodyne	EBP	19	44
O=C(/C=C\[C@H]1CCCO1)Nc1ccc2c(c1)COC2	ZINC000819453916	CE	On-Demand	Anodyne	PTPRF	40	31
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc2c(c1)COC2	ZINC000819453917	CE	On-Demand	Anodyne	PTPRF	40	31
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc2c(c1)COC2	ZINC000819453918	CE	On-Demand	Anodyne	PTPRF	40	31
O=C(/C=C/[C@H]1CCCO1)Nc1ccc2c(c1)COC2	ZINC000819453919	CE	On-Demand	Anodyne	PTPRF	40	31
C[C@@H]1CCN(CCOc2ccc(NCCC(=O)NC(N)=O)cc2)C1	ZINC000819453934	ED	On-Demand	Anodyne	ESR1	20	43
C[C@@H]1CCN(CCOc2ccc(NCCC(=O)NC(N)=O)cc2)C1	ZINC000819453934	ED	On-Demand	Anodyne	LTA4H	36	45
C[C@@H]1CCN(CCOc2ccc(NCCC(=O)NC(N)=O)cc2)C1	ZINC000819453934	ED	On-Demand	Anodyne	HRH3	19	43
C[C@@H]1CCN(CCOc2ccc(NCCC(=O)NC(N)=O)cc2)C1	ZINC000819453934	ED	On-Demand	Anodyne	EBP	15	44
C[C@H]1CCN(CCOc2ccc(NCCC(=O)NC(N)=O)cc2)C1	ZINC000819453935	ED	On-Demand	Anodyne	ESR1	20	43
C[C@H]1CCN(CCOc2ccc(NCCC(=O)NC(N)=O)cc2)C1	ZINC000819453935	ED	On-Demand	Anodyne	LTA4H	36	45
C[C@H]1CCN(CCOc2ccc(NCCC(=O)NC(N)=O)cc2)C1	ZINC000819453935	ED	On-Demand	Anodyne	HRH3	19	43
C[C@H]1CCN(CCOc2ccc(NCCC(=O)NC(N)=O)cc2)C1	ZINC000819453935	ED	On-Demand	Anodyne	EBP	15	44
C[C@H]1CCN(CCOc2ccc(NC[C@@H](C)O)cc2)C1	ZINC000819453940	CE	On-Demand	Anodyne	ESR1	41	44
C[C@H]1CCN(CCOc2ccc(NC[C@@H](C)O)cc2)C1	ZINC000819453940	CE	On-Demand	Anodyne	ESR2	23	45
C[C@H]1CCN(CCOc2ccc(NC[C@@H](C)O)cc2)C1	ZINC000819453940	CE	On-Demand	Anodyne	LTA4H	42	42
C[C@H]1CCN(CCOc2ccc(NC[C@@H](C)O)cc2)C1	ZINC000819453940	CE	On-Demand	Anodyne	HRH3	30	43
C[C@H]1CCN(CCOc2ccc(NC[C@@H](C)O)cc2)C1	ZINC000819453940	CE	On-Demand	Anodyne	EBP	26	50
C[C@H]1CCN(CCOc2ccc(NC[C@@H](C)O)cc2)C1	ZINC000819453940	CE	On-Demand	Anodyne	PSMB1	42	40
C[C@H]1CCN(CCOc2ccc(NCCC(=O)Nc3cccnc3)cc2)C1	ZINC000819453945	FG	On-Demand	Anodyne	LTA4H	46	39
C[C@H]1CCN(CCOc2ccc(NCCC(=O)Nc3cccnc3)cc2)C1	ZINC000819453945	FG	On-Demand	Anodyne	HRH3	15	46
C[C@@H]1CCN(CCOc2ccc(NCCC(=O)Nc3cccnc3)cc2)C1	ZINC000819453946	FG	On-Demand	Anodyne	LTA4H	46	39
C[C@@H]1CCN(CCOc2ccc(NCCC(=O)Nc3cccnc3)cc2)C1	ZINC000819453946	FG	On-Demand	Anodyne	HRH3	15	46
COCCNC(=O)c1ccccc1NC(=O)CC12CC3CC(CC(C3)C1)C2	ZINC000819453952	FH	On-Demand	Anodyne	P2RX7	27	56
COCCNC(=O)c1ccccc1NC(=O)CC12CC3CC(CC(C3)C1)C2	ZINC000819453952	FH	On-Demand	Anodyne	EPHX2	33	47
CON(C)C(=O)CCNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819453959	FD	On-Demand	Anodyne	ESR1	43	38
CON(C)C(=O)CCNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819453959	FD	On-Demand	Anodyne	LTA4H	51	44
CON(C)C(=O)CCNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819453959	FD	On-Demand	Anodyne	HRH3	28	42
CON(C)C(=O)CCNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819453959	FD	On-Demand	Anodyne	PSMB1	42	38
O=C(CCc1cccc(Br)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453967	FE	On-Demand	Anodyne	PRCP	24	41
O=C(CCc1cccc(Br)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453967	FE	On-Demand	Anodyne	CPT1A	91	38
O=C(CCc1cccc(Br)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453967	FE	On-Demand	Anodyne	PREP	43	35
O=C(c1cccc(Oc2ccc(Cl)cc2)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453976	FH	On-Demand	Anodyne	CPT1A	101	38
O=C(c1cccc(Oc2ccc(Cl)cc2)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453976	FH	On-Demand	Anodyne	FAAH	20	45
O=C(c1cccc(Oc2ccc(Cl)cc2)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453976	FH	On-Demand	Anodyne	CFTR	52	47
O=C(c1cccc(Oc2ccc(Cl)cc2)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453977	FH	On-Demand	Anodyne	CPT1A	101	38
O=C(c1cccc(Oc2ccc(Cl)cc2)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453977	FH	On-Demand	Anodyne	FAAH	20	45
O=C(c1cccc(Oc2ccc(Cl)cc2)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453977	FH	On-Demand	Anodyne	CFTR	52	47
O=C(CCCOc1ccc(F)cc1F)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453982	EE	On-Demand	Anodyne	PRCP	25	40
O=C(CCCOc1ccc(F)cc1F)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453982	EE	On-Demand	Anodyne	CPT1A	76	42
O=C(CCCOc1ccc(F)cc1F)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453983	EE	On-Demand	Anodyne	PRCP	25	40
O=C(CCCOc1ccc(F)cc1F)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453983	EE	On-Demand	Anodyne	CPT1A	76	42
O=C(COc1cccnc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453984	CC	On-Demand	Anodyne	PRCP	23	43
O=C(COc1cccnc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453984	CC	On-Demand	Anodyne	CHRNA7	29	40
O=C(COc1cccnc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453984	CC	On-Demand	Anodyne	CPT1A	153	55
O=C(COc1cccnc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819453984	CC	On-Demand	Anodyne	CPT2	51	39
O=C(COc1cccnc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453985	CC	On-Demand	Anodyne	PRCP	23	43
O=C(COc1cccnc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453985	CC	On-Demand	Anodyne	CHRNA7	29	40
O=C(COc1cccnc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453985	CC	On-Demand	Anodyne	CPT1A	153	55
O=C(COc1cccnc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819453985	CC	On-Demand	Anodyne	CPT2	51	39
O=C(NCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1cc2ccccc2[nH]1	ZINC000819453988	EC	On-Demand	Anodyne	CYP51A1	22	41
O=C(NCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1cc2ccccc2[nH]1	ZINC000819453988	EC	On-Demand	Anodyne	CPT1A	85	39
O=C(NCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1cc2ccccc2[nH]1	ZINC000819453988	EC	On-Demand	Anodyne	PYGL	61	38
O=C(NCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1cc2ccccc2[nH]1	ZINC000819453988	EC	On-Demand	Anodyne	PREP	21	41
O=C(NCC(=O)N1CCC[C@@H]1c1nn[nH]n1)c1cc2ccccc2[nH]1	ZINC000819453988	EC	On-Demand	Anodyne	PLD2	18	41
O=C(NCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1cc2ccccc2[nH]1	ZINC000819453989	EC	On-Demand	Anodyne	CYP51A1	22	41
O=C(NCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1cc2ccccc2[nH]1	ZINC000819453989	EC	On-Demand	Anodyne	CPT1A	85	39
O=C(NCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1cc2ccccc2[nH]1	ZINC000819453989	EC	On-Demand	Anodyne	PYGL	61	38
O=C(NCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1cc2ccccc2[nH]1	ZINC000819453989	EC	On-Demand	Anodyne	PREP	21	41
O=C(NCC(=O)N1CCC[C@H]1c1nn[nH]n1)c1cc2ccccc2[nH]1	ZINC000819453989	EC	On-Demand	Anodyne	PLD2	18	41
O=C(c1cccc(-c2ccoc2)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454012	DE	On-Demand	Anodyne	CPT1A	63	37
O=C(c1cccc(-c2ccoc2)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454013	DE	On-Demand	Anodyne	CPT1A	63	37
O=C(c1cc2ccccc2c(O)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454018	DD	On-Demand	Anodyne	CPT1A	58	35
O=C(c1cc2ccccc2c(O)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454020	DD	On-Demand	Anodyne	CPT1A	58	35
O=C(c1nc(-c2ccccc2)n(-c2ccccc2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454022	GE	On-Demand	Anodyne	CPT1A	87	39
O=C(c1nc(-c2ccccc2)n(-c2ccccc2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454023	GE	On-Demand	Anodyne	CPT1A	87	39
O=C(CCCOc1cccc(Br)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454034	GE	On-Demand	Anodyne	CPT1A	125	42
O=C(CCCOc1cccc(Br)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454034	GE	On-Demand	Anodyne	CPT2	43	34
O=C(CCCOc1cccc(Br)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454035	GE	On-Demand	Anodyne	CPT1A	125	42
O=C(CCCOc1cccc(Br)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454035	GE	On-Demand	Anodyne	CPT2	43	34
O=C1c2ccc(Br)cc2C(=O)N1CC(=O)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454040	HC	On-Demand	Anodyne	CPT1A	44	35
O=C1c2ccc(Br)cc2C(=O)N1CC(=O)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454041	HC	On-Demand	Anodyne	CPT1A	44	35
O=C(C#Cc1ccc2c(c1)OCO2)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454042	DC	On-Demand	Mild	CPT1A	45	41
O=C(C#Cc1ccc2c(c1)OCO2)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454043	DC	On-Demand	Mild	CPT1A	45	41
O=C(COc1cccc(Cl)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454052	DD	On-Demand	Anodyne	PRCP	32	40
O=C(COc1cccc(Cl)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454052	DD	On-Demand	Anodyne	CPT1A	156	49
O=C(COc1cccc(Cl)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454052	DD	On-Demand	Anodyne	CPT2	52	46
O=C(COc1cccc(Cl)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454052	DD	On-Demand	Anodyne	GRM5	16	42
O=C(COc1cccc(Cl)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454052	DD	On-Demand	Anodyne	CHRNA10	25	42
O=C(COc1cccc(Cl)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454053	DD	On-Demand	Anodyne	PRCP	32	40
O=C(COc1cccc(Cl)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454053	DD	On-Demand	Anodyne	CPT1A	156	49
O=C(COc1cccc(Cl)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454053	DD	On-Demand	Anodyne	CPT2	52	46
O=C(COc1cccc(Cl)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454053	DD	On-Demand	Anodyne	GRM5	16	42
O=C(COc1cccc(Cl)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454053	DD	On-Demand	Anodyne	CHRNA10	25	42
O=C(c1cc(-c2ccco2)nc2ccccc12)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454054	FF	On-Demand	Anodyne	CPT1A	57	36
O=C(c1cc(-c2ccco2)nc2ccccc12)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454055	FF	On-Demand	Anodyne	CPT1A	57	36
NC(=O)c1ccc(OCCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819454056	EC	On-Demand	Anodyne	CHEK2	38	40
NC(=O)c1ccc(OCCC(=O)N2CCC[C@@H]2c2nn[nH]n2)cc1	ZINC000819454056	EC	On-Demand	Anodyne	CPT1A	120	46
NC(=O)c1ccc(OCCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819454057	EC	On-Demand	Anodyne	CHEK2	38	40
NC(=O)c1ccc(OCCC(=O)N2CCC[C@H]2c2nn[nH]n2)cc1	ZINC000819454057	EC	On-Demand	Anodyne	CPT1A	120	46
O=C(c1ccc(Oc2ccc(F)cc2F)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454062	FG	On-Demand	Anodyne	CPT1A	56	39
O=C(c1ccc(Oc2ccc(F)cc2F)cc1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454062	FG	On-Demand	Anodyne	SCN4A	25	44
O=C(c1ccc(Oc2ccc(F)cc2F)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454063	FG	On-Demand	Anodyne	CPT1A	56	39
O=C(c1ccc(Oc2ccc(F)cc2F)cc1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454063	FG	On-Demand	Anodyne	SCN4A	25	44
O=C(CSc1ccccc1Cl)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454070	DE	On-Demand	Anodyne	CPT1A	107	40
O=C(CSc1ccccc1Cl)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454071	DE	On-Demand	Anodyne	CPT1A	107	40
O=C(Cc1csc(-c2ccc3c(c2)OCO3)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454072	GD	On-Demand	Anodyne	CPT1A	101	51
O=C(Cc1csc(-c2ccc3c(c2)OCO3)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454072	GD	On-Demand	Anodyne	TRPC6	40	39
O=C(Cc1csc(-c2ccc3c(c2)OCO3)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454073	GD	On-Demand	Anodyne	CPT1A	101	51
O=C(Cc1csc(-c2ccc3c(c2)OCO3)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454073	GD	On-Demand	Anodyne	TRPC6	40	39
CC(C)n1cnc(C(=O)N2CCC[C@H]2c2nn[nH]n2)c1	ZINC000819454078	CC	On-Demand	Anodyne	TRHR	40	32
CC(C)n1cnc(C(=O)N2CCC[C@@H]2c2nn[nH]n2)c1	ZINC000819454079	CC	On-Demand	Anodyne	TRHR	40	32
O=C(c1cccc(OCc2cn3ccccc3n2)c1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454090	GE	On-Demand	Anodyne	CPT1A	107	38
O=C(c1cccc(OCc2cn3ccccc3n2)c1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454091	GE	On-Demand	Anodyne	CPT1A	107	38
O=C(CSCc1coc(-c2ccccc2)n1)N1CCC[C@H]1c1nn[nH]n1	ZINC000819454096	FE	On-Demand	Anodyne	CPT1A	105	40
O=C(CSCc1coc(-c2ccccc2)n1)N1CCC[C@@H]1c1nn[nH]n1	ZINC000819454097	FE	On-Demand	Anodyne	CPT1A	105	40
O=C(O)CCCNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819454156	FD	On-Demand	Anodyne	CNR2	15	48
O=C(O)CCCNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819454156	FD	On-Demand	Anodyne	EPHX2	19	40
O=C(O)CCCNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819454156	FD	On-Demand	Anodyne	PLD2	43	34
O=C(O)CCCNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819454156	FD	On-Demand	Anodyne	NAMPT	16	41
O=C(O)CCCNC(=O)c1ccccc1CSC1=NCCS1	ZINC000819454160	EF	On-Demand	Anodyne	SLC6A5	40	33
O=C(O)CCCNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	ZINC000819454170	FC	On-Demand	Anodyne	HTR1A	15	40
O=C(O)CCCNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	ZINC000819454170	FC	On-Demand	Anodyne	DRD2	20	43
O=C(O)CCCNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	ZINC000819454170	FC	On-Demand	Anodyne	DRD4	44	33
O=C(O)CCCNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	ZINC000819454170	FC	On-Demand	Anodyne	ACHE	17	47
O=C(O)CCCNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	ZINC000819454170	FC	On-Demand	Anodyne	CHRM3	17	45
O=C(O)CCCNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1	ZINC000819454170	FC	On-Demand	Anodyne	SIGMAR1	19	43
O=C(O)CCCNC(=O)c1cccc(S(=O)(=O)NCc2ccco2)c1	ZINC000819454172	FD	On-Demand	Anodyne	TBXA2R	45	32
O=C(O)CCCNC(=O)c1ccc(N2CCc3ccccc3C2)cc1	ZINC000819454176	EF	On-Demand	Anodyne	HTR1A	17	49
O=C(O)CCCNC(=O)c1ccc(N2CCc3ccccc3C2)cc1	ZINC000819454176	EF	On-Demand	Anodyne	DRD2	22	47
O=C(O)CCCNC(=O)c1ccc(N2CCc3ccccc3C2)cc1	ZINC000819454176	EF	On-Demand	Anodyne	DRD3	43	42
O=C(O)CCCNC(=O)c1ccc(N2CCc3ccccc3C2)cc1	ZINC000819454176	EF	On-Demand	Anodyne	NOD2	45	37
O=C(O)CCCNC(=O)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O	ZINC000819454177	FF	On-Demand	Anodyne	DRD3	19	40
COC[C@@H](O)CNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454179	DD	On-Demand	Anodyne	ESR1	31	42
COC[C@@H](O)CNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454179	DD	On-Demand	Anodyne	ESR2	17	43
COC[C@@H](O)CNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454179	DD	On-Demand	Anodyne	LTA4H	34	41
COC[C@@H](O)CNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454179	DD	On-Demand	Anodyne	HRH3	20	41
COC[C@@H](O)CNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454179	DD	On-Demand	Anodyne	EBP	28	47
COC[C@@H](O)CNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454179	DD	On-Demand	Anodyne	PSMB1	40	35
COC[C@@H](O)CNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454180	DD	On-Demand	Anodyne	ESR1	31	42
COC[C@@H](O)CNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454180	DD	On-Demand	Anodyne	ESR2	17	43
COC[C@@H](O)CNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454180	DD	On-Demand	Anodyne	LTA4H	34	41
COC[C@@H](O)CNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454180	DD	On-Demand	Anodyne	HRH3	20	41
COC[C@@H](O)CNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454180	DD	On-Demand	Anodyne	EBP	28	47
COC[C@@H](O)CNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454180	DD	On-Demand	Anodyne	PSMB1	40	35
O=C(O)CCCNC(=O)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O	ZINC000819454181	FF	On-Demand	Anodyne	DRD3	19	40
CON(C)C(=O)CCNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454182	EE	On-Demand	Anodyne	ESR1	36	43
CON(C)C(=O)CCNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454182	EE	On-Demand	Anodyne	ESR2	21	43
CON(C)C(=O)CCNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454182	EE	On-Demand	Anodyne	LTA4H	31	42
CON(C)C(=O)CCNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454182	EE	On-Demand	Anodyne	HRH3	19	40
CON(C)C(=O)CCNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454182	EE	On-Demand	Anodyne	EBP	23	43
O=C(O)CCCNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819454183	FC	On-Demand	Anodyne	CNR2	18	56
O=C(O)CCCNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819454183	FC	On-Demand	Anodyne	PLD2	42	35
CON(C)C(=O)CCNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454184	EE	On-Demand	Anodyne	ESR1	36	43
CON(C)C(=O)CCNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454184	EE	On-Demand	Anodyne	ESR2	21	43
CON(C)C(=O)CCNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454184	EE	On-Demand	Anodyne	LTA4H	31	42
CON(C)C(=O)CCNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454184	EE	On-Demand	Anodyne	HRH3	19	40
CON(C)C(=O)CCNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454184	EE	On-Demand	Anodyne	EBP	23	43
O=C(O)CCCNC(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1	ZINC000819454185	FE	On-Demand	Anodyne	DRD4	41	33
O=C(O)CCCNC(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1	ZINC000819454185	FE	On-Demand	Anodyne	PTGS1	18	43
O=C(O)CCCNC(=O)c1cccc(N2C(=O)c3ccccc3C2=O)c1	ZINC000819454185	FE	On-Demand	Anodyne	DRD3	21	41
O=C(O)CCCNC(=O)c1ccccc1NCc1cccnc1	ZINC000819454186	DE	On-Demand	Anodyne	TBXAS1	103	48
O=C(O)CCCNC(=O)c1ccccc1NCc1cccnc1	ZINC000819454186	DE	On-Demand	Anodyne	PTAFR	21	47
O=C(O)CCCNC(=O)c1ccccc1NCc1cccnc1	ZINC000819454186	DE	On-Demand	Anodyne	NAMPT	59	41
O=C(O)CCCNC(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819454191	DE	On-Demand	Anodyne	DRD4	46	35
O=C(O)CCCNC(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819454191	DE	On-Demand	Anodyne	GCGR	49	43
O=C(O)CCCNC(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819454191	DE	On-Demand	Anodyne	GIPR	40	35
O=C(O)CCCNC(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819454191	DE	On-Demand	Anodyne	PDS	57	39
O=C(O)CCCNC(=O)c1cnn(-c2ccccc2F)c1-n1cccc1	ZINC000819454192	FE	On-Demand	Anodyne	CTSA	43	32
Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN3CCN(C)CC3)cc2)cc1	ZINC000819454193	GE	On-Demand	Anodyne	ADRB2	33	48
Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN3CCN(C)CC3)cc2)cc1	ZINC000819454193	GE	On-Demand	Anodyne	ADRB1	51	44
Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN3CCN(C)CC3)cc2)cc1	ZINC000819454193	GE	On-Demand	Anodyne	LTA4H	43	45
Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN3CCN(C)CC3)cc2)cc1	ZINC000819454193	GE	On-Demand	Anodyne	HRH3	22	43
Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN3CCN(C)CC3)cc2)cc1	ZINC000819454193	GE	On-Demand	Anodyne	ACOX1	53	34
Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN3CCN(C)CC3)cc2)cc1	ZINC000819454193	GE	On-Demand	Anodyne	PSMB1	44	39
Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN3CCN(C)CC3)cc2)cc1	ZINC000819454193	GE	On-Demand	Anodyne	TBK1	15	40
O=C(O)CCCNC(=O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819454194	DC	On-Demand	Anodyne	DRD4	46	36
O=C(O)CCCNC(=O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819454194	DC	On-Demand	Anodyne	DRD3	23	42
O=C(O)CCCNC(=O)c1cccc(N2C(=O)CCC2=O)c1	ZINC000819454194	DC	On-Demand	Anodyne	PLD2	51	38
Cc1ccc(OC[C@H](O)CNc2ccc(OCCN3CCN(C)CC3)cc2)cc1	ZINC000819454196	GE	On-Demand	Anodyne	ADRB2	33	48
Cc1ccc(OC[C@H](O)CNc2ccc(OCCN3CCN(C)CC3)cc2)cc1	ZINC000819454196	GE	On-Demand	Anodyne	ADRB1	51	44
Cc1ccc(OC[C@H](O)CNc2ccc(OCCN3CCN(C)CC3)cc2)cc1	ZINC000819454196	GE	On-Demand	Anodyne	LTA4H	43	45
Cc1ccc(OC[C@H](O)CNc2ccc(OCCN3CCN(C)CC3)cc2)cc1	ZINC000819454196	GE	On-Demand	Anodyne	HRH3	22	43
Cc1ccc(OC[C@H](O)CNc2ccc(OCCN3CCN(C)CC3)cc2)cc1	ZINC000819454196	GE	On-Demand	Anodyne	ACOX1	53	34
Cc1ccc(OC[C@H](O)CNc2ccc(OCCN3CCN(C)CC3)cc2)cc1	ZINC000819454196	GE	On-Demand	Anodyne	PSMB1	44	39
Cc1ccc(OC[C@H](O)CNc2ccc(OCCN3CCN(C)CC3)cc2)cc1	ZINC000819454196	GE	On-Demand	Anodyne	TBK1	15	40
O=C(O)CCCNC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	ZINC000819454197	FD	On-Demand	Anodyne	CA2	18	56
O=C(O)CCCNC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	ZINC000819454197	FD	On-Demand	Anodyne	MAP1	69	35
O=C(O)CCCNC(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	ZINC000819454198	CB	On-Demand	Anodyne	GRIN1	22	42
O=C(O)CCCNC(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	ZINC000819454198	CB	On-Demand	Anodyne	PLD1	40	34
O=C(O)CCCNC(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	ZINC000819454198	CB	On-Demand	Anodyne	HDAC9	17	40
O=C(O)CCCNC(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	ZINC000819454198	CB	On-Demand	Anodyne	PLD2	47	34
O=C(O)CCCNC(=O)c1cccc([N+](=O)[O-])c1O	ZINC000819454200	CC	On-Demand	Bother	KCNMA1	16	40
O=C(O)CCCNC(=O)c1ccc(OCc2cn3ccccc3n2)cc1	ZINC000819454201	FF	On-Demand	Anodyne	DRD3	25	42
O=C(O)CCCNC(=O)c1ccc(OCc2cn3ccccc3n2)cc1	ZINC000819454201	FF	On-Demand	Anodyne	GCGR	43	40
O=C(O)CCCNC(=O)c1ccc(OCc2cn3ccccc3n2)cc1	ZINC000819454201	FF	On-Demand	Anodyne	CYSLTR1	33	48
O=C(O)CCCNC(=O)c1ccc(OCc2cn3ccccc3n2)cc1	ZINC000819454201	FF	On-Demand	Anodyne	CYSLTR2	55	33
O=C(O)CCCNC(=O)c1ccc(OCc2cn3ccccc3n2)cc1	ZINC000819454201	FF	On-Demand	Anodyne	ADAM17	29	41
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)Cn3cccn3)cc2)C1	ZINC000819454204	EE	On-Demand	Anodyne	ESR1	19	40
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)Cn3cccn3)cc2)C1	ZINC000819454205	EE	On-Demand	Anodyne	ESR1	19	40
O=C(O)CCCNC(=O)c1ccccc1CSc1nc2ccccc2o1	ZINC000819454206	FH	On-Demand	Anodyne	SLC6A5	46	34
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)Cn3cccn3)cc2)C1	ZINC000819454208	EE	On-Demand	Anodyne	ESR1	19	40
O=C(O)CCCNC(=O)c1ccc(F)c(I)c1	ZINC000819454209	FE	On-Demand	Anodyne	GCGR	42	35
O=C(O)CCCNC(=O)c1ccc(F)c(I)c1	ZINC000819454209	FE	On-Demand	Anodyne	FOLH1	40	43
O=C(O)CCCNC(=O)c1ccc(F)c(I)c1	ZINC000819454209	FE	On-Demand	Anodyne	GIPR	46	32
O=C(O)CCCNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000819454210	FD	On-Demand	Anodyne	DRD3	29	40
O=C(O)CCCNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000819454210	FD	On-Demand	Anodyne	CACNA1I	42	37
O=C(O)CCCNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1	ZINC000819454210	FD	On-Demand	Anodyne	NAMPT	19	42
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)Cn3cccn3)cc2)C1	ZINC000819454211	EE	On-Demand	Anodyne	ESR1	19	40
O=C(O)CCCNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819454213	GE	On-Demand	Anodyne	CACNA1I	41	36
O=C(O)CCCNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1	ZINC000819454213	GE	On-Demand	Anodyne	NAMPT	19	43
O=C(O)CCCNC(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819454215	CC	On-Demand	Anodyne	HDAC9	18	46
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)cn3)cc2)C1	ZINC000819454222	FG	On-Demand	Anodyne	ESR1	17	40
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)cn3)cc2)C1	ZINC000819454223	FG	On-Demand	Anodyne	ESR1	17	40
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)cn3)cc2)C1	ZINC000819454224	FG	On-Demand	Anodyne	ESR1	17	40
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)cn3)cc2)C1	ZINC000819454225	FG	On-Demand	Anodyne	ESR1	17	40
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)CC(F)(F)F)cc2)C1	ZINC000819454280	EG	On-Demand	Anodyne	ESR1	21	42
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)CC(F)(F)F)cc2)C1	ZINC000819454280	EG	On-Demand	Anodyne	HRH3	15	43
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)CC(F)(F)F)cc2)C1	ZINC000819454280	EG	On-Demand	Anodyne	EBP	17	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)CC(F)(F)F)cc2)C1	ZINC000819454281	EG	On-Demand	Anodyne	ESR1	21	42
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)CC(F)(F)F)cc2)C1	ZINC000819454281	EG	On-Demand	Anodyne	HRH3	15	43
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)CC(F)(F)F)cc2)C1	ZINC000819454281	EG	On-Demand	Anodyne	EBP	17	45
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)CC(F)(F)F)cc2)C1	ZINC000819454282	EG	On-Demand	Anodyne	ESR1	21	42
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)CC(F)(F)F)cc2)C1	ZINC000819454282	EG	On-Demand	Anodyne	HRH3	15	43
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)CC(F)(F)F)cc2)C1	ZINC000819454282	EG	On-Demand	Anodyne	EBP	17	45
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)CC(F)(F)F)cc2)C1	ZINC000819454283	EG	On-Demand	Anodyne	ESR1	21	42
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)CC(F)(F)F)cc2)C1	ZINC000819454283	EG	On-Demand	Anodyne	HRH3	15	43
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)CC(F)(F)F)cc2)C1	ZINC000819454283	EG	On-Demand	Anodyne	EBP	17	45
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)CN3CCOCC3)cc2)C1	ZINC000819454284	FD	On-Demand	Anodyne	ESR1	53	45
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)CN3CCOCC3)cc2)C1	ZINC000819454284	FD	On-Demand	Anodyne	ESR2	33	45
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)CN3CCOCC3)cc2)C1	ZINC000819454284	FD	On-Demand	Anodyne	EBP	17	43
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)CN3CCOCC3)cc2)C1	ZINC000819454285	FD	On-Demand	Anodyne	ESR1	53	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)CN3CCOCC3)cc2)C1	ZINC000819454285	FD	On-Demand	Anodyne	ESR2	33	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)CN3CCOCC3)cc2)C1	ZINC000819454285	FD	On-Demand	Anodyne	EBP	17	43
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)CN3CCOCC3)cc2)C1	ZINC000819454286	FD	On-Demand	Anodyne	ESR1	53	45
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)CN3CCOCC3)cc2)C1	ZINC000819454286	FD	On-Demand	Anodyne	ESR2	33	45
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)CN3CCOCC3)cc2)C1	ZINC000819454286	FD	On-Demand	Anodyne	EBP	17	43
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)CN3CCOCC3)cc2)C1	ZINC000819454287	FD	On-Demand	Anodyne	ESR1	53	45
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)CN3CCOCC3)cc2)C1	ZINC000819454287	FD	On-Demand	Anodyne	ESR2	33	45
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)CN3CCOCC3)cc2)C1	ZINC000819454287	FD	On-Demand	Anodyne	EBP	17	43
C#CCNC(=O)CCNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454293	ED	On-Demand	Mild	ESR1	24	43
C#CCNC(=O)CCNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454293	ED	On-Demand	Mild	LTA4H	36	40
C#CCNC(=O)CCNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454293	ED	On-Demand	Mild	HRH3	22	44
C#CCNC(=O)CCNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454293	ED	On-Demand	Mild	EBP	15	42
C#CCNC(=O)CCNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454294	ED	On-Demand	Mild	ESR1	24	43
C#CCNC(=O)CCNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454294	ED	On-Demand	Mild	LTA4H	36	40
C#CCNC(=O)CCNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454294	ED	On-Demand	Mild	HRH3	22	44
C#CCNC(=O)CCNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454294	ED	On-Demand	Mild	EBP	15	42
CC[C@H](O)CNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454299	CF	On-Demand	Anodyne	ESR1	35	43
CC[C@H](O)CNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454299	CF	On-Demand	Anodyne	ESR2	19	43
CC[C@H](O)CNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454299	CF	On-Demand	Anodyne	LTA4H	37	41
CC[C@H](O)CNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454299	CF	On-Demand	Anodyne	HRH3	23	41
CC[C@H](O)CNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454299	CF	On-Demand	Anodyne	EBP	23	48
CC[C@H](O)CNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454299	CF	On-Demand	Anodyne	PSMB1	41	36
CC[C@H](O)CNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454300	CF	On-Demand	Anodyne	ESR1	35	43
CC[C@H](O)CNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454300	CF	On-Demand	Anodyne	ESR2	19	43
CC[C@H](O)CNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454300	CF	On-Demand	Anodyne	LTA4H	37	41
CC[C@H](O)CNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454300	CF	On-Demand	Anodyne	HRH3	23	41
CC[C@H](O)CNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454300	CF	On-Demand	Anodyne	EBP	23	48
CC[C@H](O)CNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454300	CF	On-Demand	Anodyne	PSMB1	41	36
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)CN(C)C3CC3)cc2)C1	ZINC000819454301	EE	On-Demand	Anodyne	ESR1	32	42
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)CN(C)C3CC3)cc2)C1	ZINC000819454301	EE	On-Demand	Anodyne	ESR2	16	44
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)CN(C)C3CC3)cc2)C1	ZINC000819454301	EE	On-Demand	Anodyne	EBP	24	44
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)CN(C)C3CC3)cc2)C1	ZINC000819454302	EE	On-Demand	Anodyne	ESR1	32	42
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)CN(C)C3CC3)cc2)C1	ZINC000819454302	EE	On-Demand	Anodyne	ESR2	16	44
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)CN(C)C3CC3)cc2)C1	ZINC000819454302	EE	On-Demand	Anodyne	EBP	24	44
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)CN(C)C3CC3)cc2)C1	ZINC000819454303	EE	On-Demand	Anodyne	ESR1	32	42
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)CN(C)C3CC3)cc2)C1	ZINC000819454303	EE	On-Demand	Anodyne	ESR2	16	44
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)CN(C)C3CC3)cc2)C1	ZINC000819454303	EE	On-Demand	Anodyne	EBP	24	44
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)CN(C)C3CC3)cc2)C1	ZINC000819454304	EE	On-Demand	Anodyne	ESR1	32	42
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)CN(C)C3CC3)cc2)C1	ZINC000819454304	EE	On-Demand	Anodyne	ESR2	16	44
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)CN(C)C3CC3)cc2)C1	ZINC000819454304	EE	On-Demand	Anodyne	EBP	24	44
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(C#N)cc3)cc2)C1	ZINC000819454305	FG	On-Demand	Mild	HRH3	15	45
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(C#N)cc3)cc2)C1	ZINC000819454305	FG	On-Demand	Mild	EBP	16	42
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(C#N)cc3)cc2)C1	ZINC000819454305	FG	On-Demand	Mild	MEN1	40	38
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(C#N)cc3)cc2)C1	ZINC000819454306	FG	On-Demand	Mild	HRH3	15	45
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(C#N)cc3)cc2)C1	ZINC000819454306	FG	On-Demand	Mild	EBP	16	42
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(C#N)cc3)cc2)C1	ZINC000819454306	FG	On-Demand	Mild	MEN1	40	38
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(C#N)cc3)cc2)C1	ZINC000819454307	FG	On-Demand	Mild	HRH3	15	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(C#N)cc3)cc2)C1	ZINC000819454307	FG	On-Demand	Mild	EBP	16	42
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(C#N)cc3)cc2)C1	ZINC000819454307	FG	On-Demand	Mild	MEN1	40	38
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(C#N)cc3)cc2)C1	ZINC000819454308	FG	On-Demand	Mild	HRH3	15	45
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(C#N)cc3)cc2)C1	ZINC000819454308	FG	On-Demand	Mild	EBP	16	42
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(C#N)cc3)cc2)C1	ZINC000819454308	FG	On-Demand	Mild	MEN1	40	38
C[C@H]1CCN(CCOc2ccc(NCC3(O)CCOCC3)cc2)C1	ZINC000819454313	EE	On-Demand	Anodyne	ESR1	53	46
C[C@H]1CCN(CCOc2ccc(NCC3(O)CCOCC3)cc2)C1	ZINC000819454313	EE	On-Demand	Anodyne	ESR2	33	46
C[C@H]1CCN(CCOc2ccc(NCC3(O)CCOCC3)cc2)C1	ZINC000819454313	EE	On-Demand	Anodyne	LTA4H	33	40
C[C@H]1CCN(CCOc2ccc(NCC3(O)CCOCC3)cc2)C1	ZINC000819454313	EE	On-Demand	Anodyne	HRH3	18	41
C[C@H]1CCN(CCOc2ccc(NCC3(O)CCOCC3)cc2)C1	ZINC000819454313	EE	On-Demand	Anodyne	EBP	19	45
C[C@@H]1CCN(CCOc2ccc(NCC3(O)CCOCC3)cc2)C1	ZINC000819454314	EE	On-Demand	Anodyne	ESR1	53	46
C[C@@H]1CCN(CCOc2ccc(NCC3(O)CCOCC3)cc2)C1	ZINC000819454314	EE	On-Demand	Anodyne	ESR2	33	46
C[C@@H]1CCN(CCOc2ccc(NCC3(O)CCOCC3)cc2)C1	ZINC000819454314	EE	On-Demand	Anodyne	LTA4H	33	40
C[C@@H]1CCN(CCOc2ccc(NCC3(O)CCOCC3)cc2)C1	ZINC000819454314	EE	On-Demand	Anodyne	HRH3	18	41
C[C@@H]1CCN(CCOc2ccc(NCC3(O)CCOCC3)cc2)C1	ZINC000819454314	EE	On-Demand	Anodyne	EBP	19	45
C[C@H]1CCN(CCOc2ccc(NCC3(O)CCC3)cc2)C1	ZINC000819454325	DF	On-Demand	Anodyne	ESR1	51	43
C[C@H]1CCN(CCOc2ccc(NCC3(O)CCC3)cc2)C1	ZINC000819454325	DF	On-Demand	Anodyne	ESR2	32	43
C[C@H]1CCN(CCOc2ccc(NCC3(O)CCC3)cc2)C1	ZINC000819454325	DF	On-Demand	Anodyne	LTA4H	48	42
C[C@H]1CCN(CCOc2ccc(NCC3(O)CCC3)cc2)C1	ZINC000819454325	DF	On-Demand	Anodyne	HRH3	32	41
C[C@H]1CCN(CCOc2ccc(NCC3(O)CCC3)cc2)C1	ZINC000819454325	DF	On-Demand	Anodyne	EBP	25	48
C[C@H]1CCN(CCOc2ccc(NCC3(O)CCC3)cc2)C1	ZINC000819454325	DF	On-Demand	Anodyne	PSMB1	43	38
C[C@@H]1CCN(CCOc2ccc(NCC3(O)CCC3)cc2)C1	ZINC000819454326	DF	On-Demand	Anodyne	ESR1	51	43
C[C@@H]1CCN(CCOc2ccc(NCC3(O)CCC3)cc2)C1	ZINC000819454326	DF	On-Demand	Anodyne	ESR2	32	43
C[C@@H]1CCN(CCOc2ccc(NCC3(O)CCC3)cc2)C1	ZINC000819454326	DF	On-Demand	Anodyne	LTA4H	48	42
C[C@@H]1CCN(CCOc2ccc(NCC3(O)CCC3)cc2)C1	ZINC000819454326	DF	On-Demand	Anodyne	HRH3	32	41
C[C@@H]1CCN(CCOc2ccc(NCC3(O)CCC3)cc2)C1	ZINC000819454326	DF	On-Demand	Anodyne	EBP	25	48
C[C@@H]1CCN(CCOc2ccc(NCC3(O)CCC3)cc2)C1	ZINC000819454326	DF	On-Demand	Anodyne	PSMB1	43	38
COC[C@@H](O)CNc1ccc(OCCN2CCCC2)c(C)c1	ZINC000819454327	DD	On-Demand	Anodyne	PSMB1	40	36
C[C@H]1CCN(CCOc2ccc(NCC3(O)CCS(=O)(=O)CC3)cc2)C1	ZINC000819454336	GD	On-Demand	Anodyne	ESR1	18	41
C[C@@H]1CCN(CCOc2ccc(NCC3(O)CCS(=O)(=O)CC3)cc2)C1	ZINC000819454337	GD	On-Demand	Anodyne	ESR1	18	41
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)CN3CCCC3=O)cc2)C1	ZINC000819454340	FD	On-Demand	Anodyne	HRH3	22	42
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)CN3CCCC3=O)cc2)C1	ZINC000819454341	FD	On-Demand	Anodyne	HRH3	22	42
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)CN3CCCC3=O)cc2)C1	ZINC000819454342	FD	On-Demand	Anodyne	HRH3	22	42
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)CN3CCCC3=O)cc2)C1	ZINC000819454343	FD	On-Demand	Anodyne	HRH3	22	42
C[C@H]1CCN(CCOc2ccc(NC[C@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454351	EG	On-Demand	Anodyne	ESR1	40	46
C[C@H]1CCN(CCOc2ccc(NC[C@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454351	EG	On-Demand	Anodyne	ESR2	24	46
C[C@H]1CCN(CCOc2ccc(NC[C@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454351	EG	On-Demand	Anodyne	LTA4H	39	40
C[C@H]1CCN(CCOc2ccc(NC[C@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454351	EG	On-Demand	Anodyne	HRH3	21	43
C[C@H]1CCN(CCOc2ccc(NC[C@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454351	EG	On-Demand	Anodyne	EBP	22	47
C[C@H]1CCN(CCOc2ccc(NC[C@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454351	EG	On-Demand	Anodyne	PSMB1	40	38
C[C@@H]1CCN(CCOc2ccc(NC[C@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454352	EG	On-Demand	Anodyne	ESR1	40	46
C[C@@H]1CCN(CCOc2ccc(NC[C@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454352	EG	On-Demand	Anodyne	ESR2	24	46
C[C@@H]1CCN(CCOc2ccc(NC[C@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454352	EG	On-Demand	Anodyne	LTA4H	39	40
C[C@@H]1CCN(CCOc2ccc(NC[C@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454352	EG	On-Demand	Anodyne	HRH3	21	43
C[C@@H]1CCN(CCOc2ccc(NC[C@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454352	EG	On-Demand	Anodyne	EBP	22	47
C[C@@H]1CCN(CCOc2ccc(NC[C@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454352	EG	On-Demand	Anodyne	PSMB1	40	38
C[C@@H]1CCN(CCOc2ccc(NC[C@@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454353	EG	On-Demand	Anodyne	ESR1	40	46
C[C@@H]1CCN(CCOc2ccc(NC[C@@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454353	EG	On-Demand	Anodyne	ESR2	24	46
C[C@@H]1CCN(CCOc2ccc(NC[C@@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454353	EG	On-Demand	Anodyne	LTA4H	39	40
C[C@@H]1CCN(CCOc2ccc(NC[C@@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454353	EG	On-Demand	Anodyne	HRH3	21	43
C[C@@H]1CCN(CCOc2ccc(NC[C@@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454353	EG	On-Demand	Anodyne	EBP	22	47
C[C@@H]1CCN(CCOc2ccc(NC[C@@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454353	EG	On-Demand	Anodyne	PSMB1	40	38
C[C@H]1CCN(CCOc2ccc(NC[C@@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454354	EG	On-Demand	Anodyne	ESR1	40	46
C[C@H]1CCN(CCOc2ccc(NC[C@@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454354	EG	On-Demand	Anodyne	ESR2	24	46
C[C@H]1CCN(CCOc2ccc(NC[C@@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454354	EG	On-Demand	Anodyne	LTA4H	39	40
C[C@H]1CCN(CCOc2ccc(NC[C@@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454354	EG	On-Demand	Anodyne	HRH3	21	43
C[C@H]1CCN(CCOc2ccc(NC[C@@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454354	EG	On-Demand	Anodyne	EBP	22	47
C[C@H]1CCN(CCOc2ccc(NC[C@@](C)(O)C(F)(F)F)cc2)C1	ZINC000819454354	EG	On-Demand	Anodyne	PSMB1	40	38
CCOC[C@H](O)CNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454356	ED	On-Demand	Anodyne	LTA4H	43	45
CCOC[C@H](O)CNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454356	ED	On-Demand	Anodyne	PSMB2	40	39
CCOC[C@H](O)CNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454356	ED	On-Demand	Anodyne	PSMB1	44	39
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C(F)(F)F)cc2)C1	ZINC000819454357	EF	On-Demand	Anodyne	ESR1	26	43
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C(F)(F)F)cc2)C1	ZINC000819454357	EF	On-Demand	Anodyne	ESR2	15	43
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C(F)(F)F)cc2)C1	ZINC000819454357	EF	On-Demand	Anodyne	HRH3	20	45
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C(F)(F)F)cc2)C1	ZINC000819454357	EF	On-Demand	Anodyne	EBP	22	46
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C(F)(F)F)cc2)C1	ZINC000819454358	EF	On-Demand	Anodyne	ESR1	26	43
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C(F)(F)F)cc2)C1	ZINC000819454358	EF	On-Demand	Anodyne	ESR2	15	43
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C(F)(F)F)cc2)C1	ZINC000819454358	EF	On-Demand	Anodyne	HRH3	20	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C(F)(F)F)cc2)C1	ZINC000819454358	EF	On-Demand	Anodyne	EBP	22	46
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)C(F)(F)F)cc2)C1	ZINC000819454359	EF	On-Demand	Anodyne	ESR1	26	43
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)C(F)(F)F)cc2)C1	ZINC000819454359	EF	On-Demand	Anodyne	ESR2	15	43
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)C(F)(F)F)cc2)C1	ZINC000819454359	EF	On-Demand	Anodyne	HRH3	20	45
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)C(F)(F)F)cc2)C1	ZINC000819454359	EF	On-Demand	Anodyne	EBP	22	46
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)C(F)(F)F)cc2)C1	ZINC000819454360	EF	On-Demand	Anodyne	ESR1	26	43
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)C(F)(F)F)cc2)C1	ZINC000819454360	EF	On-Demand	Anodyne	ESR2	15	43
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)C(F)(F)F)cc2)C1	ZINC000819454360	EF	On-Demand	Anodyne	HRH3	20	45
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)C(F)(F)F)cc2)C1	ZINC000819454360	EF	On-Demand	Anodyne	EBP	22	46
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)COC3CCOCC3)cc2)C1	ZINC000819454386	GE	On-Demand	Anodyne	ESR1	34	42
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)COC3CCOCC3)cc2)C1	ZINC000819454386	GE	On-Demand	Anodyne	ESR2	20	43
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)COC3CCOCC3)cc2)C1	ZINC000819454386	GE	On-Demand	Anodyne	EBP	18	42
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)COC3CCOCC3)cc2)C1	ZINC000819454387	GE	On-Demand	Anodyne	ESR1	34	42
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)COC3CCOCC3)cc2)C1	ZINC000819454387	GE	On-Demand	Anodyne	ESR2	20	43
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)COC3CCOCC3)cc2)C1	ZINC000819454387	GE	On-Demand	Anodyne	EBP	18	42
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)COC3CCOCC3)cc2)C1	ZINC000819454388	GE	On-Demand	Anodyne	ESR1	34	42
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)COC3CCOCC3)cc2)C1	ZINC000819454388	GE	On-Demand	Anodyne	ESR2	20	43
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)COC3CCOCC3)cc2)C1	ZINC000819454388	GE	On-Demand	Anodyne	EBP	18	42
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)COC3CCOCC3)cc2)C1	ZINC000819454389	GE	On-Demand	Anodyne	ESR1	34	42
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)COC3CCOCC3)cc2)C1	ZINC000819454389	GE	On-Demand	Anodyne	ESR2	20	43
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)COC3CCOCC3)cc2)C1	ZINC000819454389	GE	On-Demand	Anodyne	EBP	18	42
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3)cc2)C1	ZINC000819454391	FG	On-Demand	Anodyne	ESR1	41	46
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3)cc2)C1	ZINC000819454391	FG	On-Demand	Anodyne	ADRB2	44	42
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3)cc2)C1	ZINC000819454391	FG	On-Demand	Anodyne	ADRB1	70	40
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3)cc2)C1	ZINC000819454391	FG	On-Demand	Anodyne	ESR2	26	46
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3)cc2)C1	ZINC000819454391	FG	On-Demand	Anodyne	ADRB3	48	40
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3)cc2)C1	ZINC000819454391	FG	On-Demand	Anodyne	LTA4H	55	45
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3)cc2)C1	ZINC000819454391	FG	On-Demand	Anodyne	HRH3	24	43
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3)cc2)C1	ZINC000819454391	FG	On-Demand	Anodyne	EBP	25	45
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3)cc2)C1	ZINC000819454391	FG	On-Demand	Anodyne	PSMB1	41	37
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3)cc2)C1	ZINC000819454392	FG	On-Demand	Anodyne	ESR1	41	46
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3)cc2)C1	ZINC000819454392	FG	On-Demand	Anodyne	ADRB2	44	42
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3)cc2)C1	ZINC000819454392	FG	On-Demand	Anodyne	ADRB1	70	40
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3)cc2)C1	ZINC000819454392	FG	On-Demand	Anodyne	ESR2	26	46
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3)cc2)C1	ZINC000819454392	FG	On-Demand	Anodyne	ADRB3	48	40
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3)cc2)C1	ZINC000819454392	FG	On-Demand	Anodyne	LTA4H	55	45
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3)cc2)C1	ZINC000819454392	FG	On-Demand	Anodyne	HRH3	24	43
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3)cc2)C1	ZINC000819454392	FG	On-Demand	Anodyne	EBP	25	45
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3)cc2)C1	ZINC000819454392	FG	On-Demand	Anodyne	PSMB1	41	37
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3)cc2)C1	ZINC000819454393	FG	On-Demand	Anodyne	ESR1	41	46
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3)cc2)C1	ZINC000819454393	FG	On-Demand	Anodyne	ADRB2	44	42
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3)cc2)C1	ZINC000819454393	FG	On-Demand	Anodyne	ADRB1	70	40
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3)cc2)C1	ZINC000819454393	FG	On-Demand	Anodyne	ESR2	26	46
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3)cc2)C1	ZINC000819454393	FG	On-Demand	Anodyne	ADRB3	48	40
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3)cc2)C1	ZINC000819454393	FG	On-Demand	Anodyne	LTA4H	55	45
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3)cc2)C1	ZINC000819454393	FG	On-Demand	Anodyne	HRH3	24	43
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3)cc2)C1	ZINC000819454393	FG	On-Demand	Anodyne	EBP	25	45
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3)cc2)C1	ZINC000819454393	FG	On-Demand	Anodyne	PSMB1	41	37
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3)cc2)C1	ZINC000819454394	FG	On-Demand	Anodyne	ESR1	41	46
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3)cc2)C1	ZINC000819454394	FG	On-Demand	Anodyne	ADRB2	44	42
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3)cc2)C1	ZINC000819454394	FG	On-Demand	Anodyne	ADRB1	70	40
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3)cc2)C1	ZINC000819454394	FG	On-Demand	Anodyne	ESR2	26	46
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3)cc2)C1	ZINC000819454394	FG	On-Demand	Anodyne	ADRB3	48	40
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3)cc2)C1	ZINC000819454394	FG	On-Demand	Anodyne	LTA4H	55	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3)cc2)C1	ZINC000819454394	FG	On-Demand	Anodyne	HRH3	24	43
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3)cc2)C1	ZINC000819454394	FG	On-Demand	Anodyne	EBP	25	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3)cc2)C1	ZINC000819454394	FG	On-Demand	Anodyne	PSMB1	41	37
CCOC[C@H](O)CNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454400	DE	On-Demand	Anodyne	ESR1	28	41
CCOC[C@H](O)CNc1ccc(OCCN2CC[C@H](C)C2)cc1	ZINC000819454400	DE	On-Demand	Anodyne	EBP	20	45
CCOC[C@H](O)CNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454401	DE	On-Demand	Anodyne	ESR1	28	41
CCOC[C@H](O)CNc1ccc(OCCN2CC[C@@H](C)C2)cc1	ZINC000819454401	DE	On-Demand	Anodyne	EBP	20	45
C[C@H]1CCN(CCOc2ccc(NCC(C)(C)O)cc2)C1	ZINC000819454412	CF	On-Demand	Anodyne	ESR1	42	46
C[C@H]1CCN(CCOc2ccc(NCC(C)(C)O)cc2)C1	ZINC000819454412	CF	On-Demand	Anodyne	ESR2	23	46
C[C@H]1CCN(CCOc2ccc(NCC(C)(C)O)cc2)C1	ZINC000819454412	CF	On-Demand	Anodyne	LTA4H	56	45
C[C@H]1CCN(CCOc2ccc(NCC(C)(C)O)cc2)C1	ZINC000819454412	CF	On-Demand	Anodyne	HRH3	33	48
C[C@H]1CCN(CCOc2ccc(NCC(C)(C)O)cc2)C1	ZINC000819454412	CF	On-Demand	Anodyne	EBP	27	51
C[C@H]1CCN(CCOc2ccc(NCC(C)(C)O)cc2)C1	ZINC000819454412	CF	On-Demand	Anodyne	PSMB1	43	40
C[C@@H]1CCN(CCOc2ccc(NCC(C)(C)O)cc2)C1	ZINC000819454413	CF	On-Demand	Anodyne	ESR1	42	46
C[C@@H]1CCN(CCOc2ccc(NCC(C)(C)O)cc2)C1	ZINC000819454413	CF	On-Demand	Anodyne	ESR2	23	46
C[C@@H]1CCN(CCOc2ccc(NCC(C)(C)O)cc2)C1	ZINC000819454413	CF	On-Demand	Anodyne	LTA4H	56	45
C[C@@H]1CCN(CCOc2ccc(NCC(C)(C)O)cc2)C1	ZINC000819454413	CF	On-Demand	Anodyne	HRH3	33	48
C[C@@H]1CCN(CCOc2ccc(NCC(C)(C)O)cc2)C1	ZINC000819454413	CF	On-Demand	Anodyne	EBP	27	51
C[C@@H]1CCN(CCOc2ccc(NCC(C)(C)O)cc2)C1	ZINC000819454413	CF	On-Demand	Anodyne	PSMB1	43	40
C[C@H]1CCN(CCOc2ccc(NCC3(O)CCCC3)cc2)C1	ZINC000819454418	DG	On-Demand	Anodyne	ESR1	52	43
C[C@H]1CCN(CCOc2ccc(NCC3(O)CCCC3)cc2)C1	ZINC000819454418	DG	On-Demand	Anodyne	ESR2	32	43
C[C@H]1CCN(CCOc2ccc(NCC3(O)CCCC3)cc2)C1	ZINC000819454418	DG	On-Demand	Anodyne	LTA4H	47	42
C[C@H]1CCN(CCOc2ccc(NCC3(O)CCCC3)cc2)C1	ZINC000819454418	DG	On-Demand	Anodyne	HRH3	32	41
C[C@H]1CCN(CCOc2ccc(NCC3(O)CCCC3)cc2)C1	ZINC000819454418	DG	On-Demand	Anodyne	EBP	25	48
C[C@H]1CCN(CCOc2ccc(NCC3(O)CCCC3)cc2)C1	ZINC000819454418	DG	On-Demand	Anodyne	PSMB2	40	40
C[C@H]1CCN(CCOc2ccc(NCC3(O)CCCC3)cc2)C1	ZINC000819454418	DG	On-Demand	Anodyne	PSMB1	43	38
C[C@@H]1CCN(CCOc2ccc(NCC3(O)CCCC3)cc2)C1	ZINC000819454419	DG	On-Demand	Anodyne	ESR1	52	43
C[C@@H]1CCN(CCOc2ccc(NCC3(O)CCCC3)cc2)C1	ZINC000819454419	DG	On-Demand	Anodyne	ESR2	32	43
C[C@@H]1CCN(CCOc2ccc(NCC3(O)CCCC3)cc2)C1	ZINC000819454419	DG	On-Demand	Anodyne	LTA4H	47	42
C[C@@H]1CCN(CCOc2ccc(NCC3(O)CCCC3)cc2)C1	ZINC000819454419	DG	On-Demand	Anodyne	HRH3	32	41
C[C@@H]1CCN(CCOc2ccc(NCC3(O)CCCC3)cc2)C1	ZINC000819454419	DG	On-Demand	Anodyne	EBP	25	48
C[C@@H]1CCN(CCOc2ccc(NCC3(O)CCCC3)cc2)C1	ZINC000819454419	DG	On-Demand	Anodyne	PSMB2	40	40
C[C@@H]1CCN(CCOc2ccc(NCC3(O)CCCC3)cc2)C1	ZINC000819454419	DG	On-Demand	Anodyne	PSMB1	43	38
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)cc3)cc2)C1	ZINC000819454427	FH	On-Demand	Anodyne	ESR1	26	42
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)cc3)cc2)C1	ZINC000819454427	FH	On-Demand	Anodyne	SLC6A3	32	44
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)cc3)cc2)C1	ZINC000819454427	FH	On-Demand	Anodyne	LTA4H	32	40
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)cc3)cc2)C1	ZINC000819454427	FH	On-Demand	Anodyne	EBP	16	44
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)cc3)cc2)C1	ZINC000819454428	FH	On-Demand	Anodyne	ESR1	26	42
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)cc3)cc2)C1	ZINC000819454428	FH	On-Demand	Anodyne	SLC6A3	32	44
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)cc3)cc2)C1	ZINC000819454428	FH	On-Demand	Anodyne	LTA4H	32	40
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)cc3)cc2)C1	ZINC000819454428	FH	On-Demand	Anodyne	EBP	16	44
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)cc3)cc2)C1	ZINC000819454429	FH	On-Demand	Anodyne	ESR1	26	42
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)cc3)cc2)C1	ZINC000819454429	FH	On-Demand	Anodyne	SLC6A3	32	44
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)cc3)cc2)C1	ZINC000819454429	FH	On-Demand	Anodyne	LTA4H	32	40
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)cc3)cc2)C1	ZINC000819454429	FH	On-Demand	Anodyne	EBP	16	44
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)cc3)cc2)C1	ZINC000819454430	FH	On-Demand	Anodyne	ESR1	26	42
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)cc3)cc2)C1	ZINC000819454430	FH	On-Demand	Anodyne	SLC6A3	32	44
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)cc3)cc2)C1	ZINC000819454430	FH	On-Demand	Anodyne	LTA4H	32	40
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)cc3)cc2)C1	ZINC000819454430	FH	On-Demand	Anodyne	EBP	16	44
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3F)cc2)C1	ZINC000819454435	GG	On-Demand	Anodyne	ESR1	25	41
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3F)cc2)C1	ZINC000819454435	GG	On-Demand	Anodyne	ADRB2	24	41
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3F)cc2)C1	ZINC000819454435	GG	On-Demand	Anodyne	ADRB1	42	41
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3F)cc2)C1	ZINC000819454435	GG	On-Demand	Anodyne	EBP	19	43
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3F)cc2)C1	ZINC000819454436	GG	On-Demand	Anodyne	ESR1	25	41
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3F)cc2)C1	ZINC000819454436	GG	On-Demand	Anodyne	ADRB2	24	41
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3F)cc2)C1	ZINC000819454436	GG	On-Demand	Anodyne	ADRB1	42	41
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3F)cc2)C1	ZINC000819454436	GG	On-Demand	Anodyne	EBP	19	43
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3F)cc2)C1	ZINC000819454437	GG	On-Demand	Anodyne	ESR1	25	41
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3F)cc2)C1	ZINC000819454437	GG	On-Demand	Anodyne	ADRB2	24	41
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3F)cc2)C1	ZINC000819454437	GG	On-Demand	Anodyne	ADRB1	42	41
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccccc3F)cc2)C1	ZINC000819454437	GG	On-Demand	Anodyne	EBP	19	43
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3F)cc2)C1	ZINC000819454438	GG	On-Demand	Anodyne	ESR1	25	41
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3F)cc2)C1	ZINC000819454438	GG	On-Demand	Anodyne	ADRB2	24	41
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3F)cc2)C1	ZINC000819454438	GG	On-Demand	Anodyne	ADRB1	42	41
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccccc3F)cc2)C1	ZINC000819454438	GG	On-Demand	Anodyne	EBP	19	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(OCc2ccccc2F)CC1	ZINC000819454451	GG	On-Demand	Anodyne	GPR119	19	44
Cc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1N1CCOC1=O	ZINC000819454452	GG	On-Demand	Anodyne	ADRB2	15	49
Cc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1N1CCOC1=O	ZINC000819454452	GG	On-Demand	Anodyne	ADRB1	23	49
Cc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1N1CCOC1=O	ZINC000819454452	GG	On-Demand	Anodyne	SLC6A4	15	40
Cc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1N1CCOC1=O	ZINC000819454453	GG	On-Demand	Anodyne	ADRB2	15	49
Cc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1N1CCOC1=O	ZINC000819454453	GG	On-Demand	Anodyne	ADRB1	23	49
Cc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1N1CCOC1=O	ZINC000819454453	GG	On-Demand	Anodyne	SLC6A4	15	40
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3c(F)cccc3F)cc2)C1	ZINC000819454455	GH	On-Demand	Anodyne	ESR1	37	43
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3c(F)cccc3F)cc2)C1	ZINC000819454455	GH	On-Demand	Anodyne	ESR2	17	43
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3c(F)cccc3F)cc2)C1	ZINC000819454455	GH	On-Demand	Anodyne	EBP	25	46
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3c(F)cccc3F)cc2)C1	ZINC000819454456	GH	On-Demand	Anodyne	ESR1	37	43
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3c(F)cccc3F)cc2)C1	ZINC000819454456	GH	On-Demand	Anodyne	ESR2	17	43
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3c(F)cccc3F)cc2)C1	ZINC000819454456	GH	On-Demand	Anodyne	EBP	25	46
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3c(F)cccc3F)cc2)C1	ZINC000819454457	GH	On-Demand	Anodyne	ESR1	37	43
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3c(F)cccc3F)cc2)C1	ZINC000819454457	GH	On-Demand	Anodyne	ESR2	17	43
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3c(F)cccc3F)cc2)C1	ZINC000819454457	GH	On-Demand	Anodyne	EBP	25	46
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3c(F)cccc3F)cc2)C1	ZINC000819454458	GH	On-Demand	Anodyne	ESR1	37	43
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3c(F)cccc3F)cc2)C1	ZINC000819454458	GH	On-Demand	Anodyne	ESR2	17	43
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3c(F)cccc3F)cc2)C1	ZINC000819454458	GH	On-Demand	Anodyne	EBP	25	46
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)C3CC3)cc2)C1	ZINC000819454473	DF	On-Demand	Anodyne	ESR1	31	43
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)C3CC3)cc2)C1	ZINC000819454473	DF	On-Demand	Anodyne	ESR2	16	43
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)C3CC3)cc2)C1	ZINC000819454473	DF	On-Demand	Anodyne	LTA4H	35	41
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)C3CC3)cc2)C1	ZINC000819454473	DF	On-Demand	Anodyne	HRH3	19	41
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)C3CC3)cc2)C1	ZINC000819454473	DF	On-Demand	Anodyne	EBP	23	48
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)C3CC3)cc2)C1	ZINC000819454473	DF	On-Demand	Anodyne	PSMB1	40	36
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C3CC3)cc2)C1	ZINC000819454474	DF	On-Demand	Anodyne	ESR1	31	43
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C3CC3)cc2)C1	ZINC000819454474	DF	On-Demand	Anodyne	ESR2	16	43
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C3CC3)cc2)C1	ZINC000819454474	DF	On-Demand	Anodyne	LTA4H	35	41
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C3CC3)cc2)C1	ZINC000819454474	DF	On-Demand	Anodyne	HRH3	19	41
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C3CC3)cc2)C1	ZINC000819454474	DF	On-Demand	Anodyne	EBP	23	48
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C3CC3)cc2)C1	ZINC000819454474	DF	On-Demand	Anodyne	PSMB1	40	36
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)C3CC3)cc2)C1	ZINC000819454475	DF	On-Demand	Anodyne	ESR1	31	43
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)C3CC3)cc2)C1	ZINC000819454475	DF	On-Demand	Anodyne	ESR2	16	43
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)C3CC3)cc2)C1	ZINC000819454475	DF	On-Demand	Anodyne	LTA4H	35	41
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)C3CC3)cc2)C1	ZINC000819454475	DF	On-Demand	Anodyne	HRH3	19	41
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)C3CC3)cc2)C1	ZINC000819454475	DF	On-Demand	Anodyne	EBP	23	48
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)C3CC3)cc2)C1	ZINC000819454475	DF	On-Demand	Anodyne	PSMB1	40	36
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C3CC3)cc2)C1	ZINC000819454476	DF	On-Demand	Anodyne	ESR1	31	43
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C3CC3)cc2)C1	ZINC000819454476	DF	On-Demand	Anodyne	ESR2	16	43
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C3CC3)cc2)C1	ZINC000819454476	DF	On-Demand	Anodyne	LTA4H	35	41
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C3CC3)cc2)C1	ZINC000819454476	DF	On-Demand	Anodyne	HRH3	19	41
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C3CC3)cc2)C1	ZINC000819454476	DF	On-Demand	Anodyne	EBP	23	48
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C3CC3)cc2)C1	ZINC000819454476	DF	On-Demand	Anodyne	PSMB1	40	36
CC[C@H](O)CNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454483	DD	On-Demand	Anodyne	ESR1	42	36
CC[C@H](O)CNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454483	DD	On-Demand	Anodyne	LTA4H	50	49
CC[C@H](O)CNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454483	DD	On-Demand	Anodyne	HRH3	31	42
CC[C@H](O)CNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454483	DD	On-Demand	Anodyne	PSMB2	43	42
CC[C@H](O)CNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454483	DD	On-Demand	Anodyne	PSMB1	47	42
O=C(C(F)=C1CCC1)N1CCc2cc(F)ccc2C1	ZINC000819454487	CG	On-Demand	Anodyne	HDAC6	34	43
C[C@@H]1CCN(CCOc2ccc(NCCC(N)=O)cc2)C1	ZINC000819454494	CD	On-Demand	Anodyne	ESR1	32	45
C[C@@H]1CCN(CCOc2ccc(NCCC(N)=O)cc2)C1	ZINC000819454494	CD	On-Demand	Anodyne	ESR2	15	45
C[C@@H]1CCN(CCOc2ccc(NCCC(N)=O)cc2)C1	ZINC000819454494	CD	On-Demand	Anodyne	LTA4H	46	47
C[C@@H]1CCN(CCOc2ccc(NCCC(N)=O)cc2)C1	ZINC000819454494	CD	On-Demand	Anodyne	HRH3	34	46
C[C@@H]1CCN(CCOc2ccc(NCCC(N)=O)cc2)C1	ZINC000819454494	CD	On-Demand	Anodyne	EBP	24	47
C[C@H]1CCN(CCOc2ccc(NCCC(N)=O)cc2)C1	ZINC000819454495	CD	On-Demand	Anodyne	ESR1	32	45
C[C@H]1CCN(CCOc2ccc(NCCC(N)=O)cc2)C1	ZINC000819454495	CD	On-Demand	Anodyne	ESR2	15	45
C[C@H]1CCN(CCOc2ccc(NCCC(N)=O)cc2)C1	ZINC000819454495	CD	On-Demand	Anodyne	LTA4H	46	47
C[C@H]1CCN(CCOc2ccc(NCCC(N)=O)cc2)C1	ZINC000819454495	CD	On-Demand	Anodyne	HRH3	34	46
C[C@H]1CCN(CCOc2ccc(NCCC(N)=O)cc2)C1	ZINC000819454495	CD	On-Demand	Anodyne	EBP	24	47
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccc(C#N)cc3)cc2)C1	ZINC000819454504	GG	On-Demand	Mild	HRH3	15	45
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccc(C#N)cc3)cc2)C1	ZINC000819454504	GG	On-Demand	Mild	EBP	19	42
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccc(C#N)cc3)cc2)C1	ZINC000819454504	GG	On-Demand	Mild	MEN1	40	38
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccc(C#N)cc3)cc2)C1	ZINC000819454505	GG	On-Demand	Mild	HRH3	15	45
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccc(C#N)cc3)cc2)C1	ZINC000819454505	GG	On-Demand	Mild	EBP	19	42
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccc(C#N)cc3)cc2)C1	ZINC000819454505	GG	On-Demand	Mild	MEN1	40	38
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccc(C#N)cc3)cc2)C1	ZINC000819454506	GG	On-Demand	Mild	HRH3	15	45
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccc(C#N)cc3)cc2)C1	ZINC000819454506	GG	On-Demand	Mild	EBP	19	42
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)COc3ccc(C#N)cc3)cc2)C1	ZINC000819454506	GG	On-Demand	Mild	MEN1	40	38
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccc(C#N)cc3)cc2)C1	ZINC000819454507	GG	On-Demand	Mild	HRH3	15	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccc(C#N)cc3)cc2)C1	ZINC000819454507	GG	On-Demand	Mild	EBP	19	42
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)COc3ccc(C#N)cc3)cc2)C1	ZINC000819454507	GG	On-Demand	Mild	MEN1	40	38
C#CCNC(=O)CCNc1ccc(OCCN2CCCC2)c(C)c1	ZINC000819454508	EE	On-Demand	Mild	HTR2A	23	41
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3cc(F)ccc3F)cc2)C1	ZINC000819454527	GH	On-Demand	Anodyne	ESR1	30	41
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3cc(F)ccc3F)cc2)C1	ZINC000819454527	GH	On-Demand	Anodyne	ESR2	17	41
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3cc(F)ccc3F)cc2)C1	ZINC000819454527	GH	On-Demand	Anodyne	EBP	23	47
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cc(F)ccc3F)cc2)C1	ZINC000819454528	GH	On-Demand	Anodyne	ESR1	30	41
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cc(F)ccc3F)cc2)C1	ZINC000819454528	GH	On-Demand	Anodyne	ESR2	17	41
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cc(F)ccc3F)cc2)C1	ZINC000819454528	GH	On-Demand	Anodyne	EBP	23	47
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3cc(F)ccc3F)cc2)C1	ZINC000819454529	GH	On-Demand	Anodyne	ESR1	30	41
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3cc(F)ccc3F)cc2)C1	ZINC000819454529	GH	On-Demand	Anodyne	ESR2	17	41
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3cc(F)ccc3F)cc2)C1	ZINC000819454529	GH	On-Demand	Anodyne	EBP	23	47
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cc(F)ccc3F)cc2)C1	ZINC000819454530	GH	On-Demand	Anodyne	ESR1	30	41
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cc(F)ccc3F)cc2)C1	ZINC000819454530	GH	On-Demand	Anodyne	ESR2	17	41
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cc(F)ccc3F)cc2)C1	ZINC000819454530	GH	On-Demand	Anodyne	EBP	23	47
COC[C@@H](O)CNc1ccc(OCCC(C)C)cc1	ZINC000819454545	CF	On-Demand	Anodyne	ADRB2	37	45
COC[C@@H](O)CNc1ccc(OCCC(C)C)cc1	ZINC000819454545	CF	On-Demand	Anodyne	ADRB1	47	45
COC[C@@H](O)CNc1ccc(OCCC(C)C)cc1	ZINC000819454545	CF	On-Demand	Anodyne	ADRB3	21	40
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3cccnc3)cc2)C1	ZINC000819454566	EF	On-Demand	Anodyne	ESR1	17	40
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3cccnc3)cc2)C1	ZINC000819454566	EF	On-Demand	Anodyne	ADRB2	18	45
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3cccnc3)cc2)C1	ZINC000819454566	EF	On-Demand	Anodyne	ADRB1	23	45
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3cccnc3)cc2)C1	ZINC000819454566	EF	On-Demand	Anodyne	ADRB3	66	48
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cccnc3)cc2)C1	ZINC000819454567	EF	On-Demand	Anodyne	ESR1	17	40
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cccnc3)cc2)C1	ZINC000819454567	EF	On-Demand	Anodyne	ADRB2	18	45
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cccnc3)cc2)C1	ZINC000819454567	EF	On-Demand	Anodyne	ADRB1	23	45
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cccnc3)cc2)C1	ZINC000819454567	EF	On-Demand	Anodyne	ADRB3	66	48
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cccnc3)cc2)C1	ZINC000819454568	EF	On-Demand	Anodyne	ESR1	17	40
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cccnc3)cc2)C1	ZINC000819454568	EF	On-Demand	Anodyne	ADRB2	18	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cccnc3)cc2)C1	ZINC000819454568	EF	On-Demand	Anodyne	ADRB1	23	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cccnc3)cc2)C1	ZINC000819454568	EF	On-Demand	Anodyne	ADRB3	66	48
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3cccnc3)cc2)C1	ZINC000819454569	EF	On-Demand	Anodyne	ESR1	17	40
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3cccnc3)cc2)C1	ZINC000819454569	EF	On-Demand	Anodyne	ADRB2	18	45
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3cccnc3)cc2)C1	ZINC000819454569	EF	On-Demand	Anodyne	ADRB1	23	45
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3cccnc3)cc2)C1	ZINC000819454569	EF	On-Demand	Anodyne	ADRB3	66	48
Cc1ccccc1[C@@H](O)CNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454583	FF	On-Demand	Anodyne	LTA4H	56	49
Cc1ccccc1[C@@H](O)CNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454583	FF	On-Demand	Anodyne	HRH3	24	40
Cc1ccccc1[C@@H](O)CNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454583	FF	On-Demand	Anodyne	PSMB2	41	38
Cc1ccccc1[C@@H](O)CNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454583	FF	On-Demand	Anodyne	PSMB1	45	39
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc([N+](=O)[O-])cc3)cc2)C1	ZINC000819454586	GG	On-Demand	Bother	LTA4H	17	45
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc([N+](=O)[O-])cc3)cc2)C1	ZINC000819454587	GG	On-Demand	Bother	LTA4H	17	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc([N+](=O)[O-])cc3)cc2)C1	ZINC000819454588	GG	On-Demand	Bother	LTA4H	17	45
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc([N+](=O)[O-])cc3)cc2)C1	ZINC000819454589	GG	On-Demand	Bother	LTA4H	17	45
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)CN3CCN(C)CC3)cc2)C1	ZINC000819454595	GD	On-Demand	Anodyne	ESR1	38	42
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)CN3CCN(C)CC3)cc2)C1	ZINC000819454595	GD	On-Demand	Anodyne	ESR2	18	42
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)CN3CCN(C)CC3)cc2)C1	ZINC000819454595	GD	On-Demand	Anodyne	EBP	17	45
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)CN3CCN(C)CC3)cc2)C1	ZINC000819454596	GD	On-Demand	Anodyne	ESR1	38	42
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)CN3CCN(C)CC3)cc2)C1	ZINC000819454596	GD	On-Demand	Anodyne	ESR2	18	42
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)CN3CCN(C)CC3)cc2)C1	ZINC000819454596	GD	On-Demand	Anodyne	EBP	17	45
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)CN3CCN(C)CC3)cc2)C1	ZINC000819454597	GD	On-Demand	Anodyne	ESR1	38	42
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)CN3CCN(C)CC3)cc2)C1	ZINC000819454597	GD	On-Demand	Anodyne	ESR2	18	42
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)CN3CCN(C)CC3)cc2)C1	ZINC000819454597	GD	On-Demand	Anodyne	EBP	17	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)CN3CCN(C)CC3)cc2)C1	ZINC000819454598	GD	On-Demand	Anodyne	ESR1	38	42
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)CN3CCN(C)CC3)cc2)C1	ZINC000819454598	GD	On-Demand	Anodyne	ESR2	18	42
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)CN3CCN(C)CC3)cc2)C1	ZINC000819454598	GD	On-Demand	Anodyne	EBP	17	45
C#CCNC(=O)CCNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454671	EC	On-Demand	Mild	LTA4H	52	43
C#CCNC(=O)CCNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454671	EC	On-Demand	Mild	HRH3	31	43
C#CCNC(=O)CCNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454671	EC	On-Demand	Mild	EPHX2	15	42
C#CCNC(=O)CCNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454671	EC	On-Demand	Mild	PSMB2	40	37
C#CCNC(=O)CCNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454671	EC	On-Demand	Mild	PSMB1	44	39
CCOC[C@H](O)CNc1ccc(OCCC(C)C)cc1	ZINC000819454694	CF	On-Demand	Anodyne	ADRB2	26	40
CCOC[C@H](O)CNc1ccc(OCCC(C)C)cc1	ZINC000819454694	CF	On-Demand	Anodyne	ADRB1	35	42
Cc1ccc(NC[C@H](O)c2ccc(F)cc2Cl)cc1N1CCOC1=O	ZINC000819454704	FH	On-Demand	Anodyne	P2RX7	23	42
Cc1ccc(NC[C@@H](O)c2ccc(F)cc2Cl)cc1N1CCOC1=O	ZINC000819454705	FH	On-Demand	Anodyne	P2RX7	23	42
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C(C)(C)C)cc2)C1	ZINC000819454722	DG	On-Demand	Anodyne	ESR1	31	44
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C(C)(C)C)cc2)C1	ZINC000819454722	DG	On-Demand	Anodyne	ESR2	16	44
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C(C)(C)C)cc2)C1	ZINC000819454722	DG	On-Demand	Anodyne	LTA4H	38	42
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C(C)(C)C)cc2)C1	ZINC000819454722	DG	On-Demand	Anodyne	HRH3	19	44
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C(C)(C)C)cc2)C1	ZINC000819454722	DG	On-Demand	Anodyne	EBP	23	48
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)C(C)(C)C)cc2)C1	ZINC000819454722	DG	On-Demand	Anodyne	PSMB1	40	38
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)C(C)(C)C)cc2)C1	ZINC000819454723	DG	On-Demand	Anodyne	ESR1	31	44
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)C(C)(C)C)cc2)C1	ZINC000819454723	DG	On-Demand	Anodyne	ESR2	16	44
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)C(C)(C)C)cc2)C1	ZINC000819454723	DG	On-Demand	Anodyne	LTA4H	38	42
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)C(C)(C)C)cc2)C1	ZINC000819454723	DG	On-Demand	Anodyne	HRH3	19	44
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)C(C)(C)C)cc2)C1	ZINC000819454723	DG	On-Demand	Anodyne	EBP	23	48
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)C(C)(C)C)cc2)C1	ZINC000819454723	DG	On-Demand	Anodyne	PSMB1	40	38
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C(C)(C)C)cc2)C1	ZINC000819454724	DG	On-Demand	Anodyne	ESR1	31	44
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C(C)(C)C)cc2)C1	ZINC000819454724	DG	On-Demand	Anodyne	ESR2	16	44
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C(C)(C)C)cc2)C1	ZINC000819454724	DG	On-Demand	Anodyne	LTA4H	38	42
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C(C)(C)C)cc2)C1	ZINC000819454724	DG	On-Demand	Anodyne	HRH3	19	44
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C(C)(C)C)cc2)C1	ZINC000819454724	DG	On-Demand	Anodyne	EBP	23	48
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)C(C)(C)C)cc2)C1	ZINC000819454724	DG	On-Demand	Anodyne	PSMB1	40	38
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)C(C)(C)C)cc2)C1	ZINC000819454725	DG	On-Demand	Anodyne	ESR1	31	44
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)C(C)(C)C)cc2)C1	ZINC000819454725	DG	On-Demand	Anodyne	ESR2	16	44
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)C(C)(C)C)cc2)C1	ZINC000819454725	DG	On-Demand	Anodyne	LTA4H	38	42
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)C(C)(C)C)cc2)C1	ZINC000819454725	DG	On-Demand	Anodyne	HRH3	19	44
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)C(C)(C)C)cc2)C1	ZINC000819454725	DG	On-Demand	Anodyne	EBP	23	48
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)C(C)(C)C)cc2)C1	ZINC000819454725	DG	On-Demand	Anodyne	PSMB1	40	38
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cccc(F)c3)cc2)C1	ZINC000819454731	FH	On-Demand	Anodyne	ESR1	40	45
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cccc(F)c3)cc2)C1	ZINC000819454731	FH	On-Demand	Anodyne	ESR2	25	45
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cccc(F)c3)cc2)C1	ZINC000819454731	FH	On-Demand	Anodyne	EBP	21	41
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3cccc(F)c3)cc2)C1	ZINC000819454732	FH	On-Demand	Anodyne	ESR1	40	45
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3cccc(F)c3)cc2)C1	ZINC000819454732	FH	On-Demand	Anodyne	ESR2	25	45
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3cccc(F)c3)cc2)C1	ZINC000819454732	FH	On-Demand	Anodyne	EBP	21	41
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cccc(F)c3)cc2)C1	ZINC000819454733	FH	On-Demand	Anodyne	ESR1	40	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cccc(F)c3)cc2)C1	ZINC000819454733	FH	On-Demand	Anodyne	ESR2	25	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cccc(F)c3)cc2)C1	ZINC000819454733	FH	On-Demand	Anodyne	EBP	21	41
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3cccc(F)c3)cc2)C1	ZINC000819454734	FH	On-Demand	Anodyne	ESR1	40	45
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3cccc(F)c3)cc2)C1	ZINC000819454734	FH	On-Demand	Anodyne	ESR2	25	45
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3cccc(F)c3)cc2)C1	ZINC000819454734	FH	On-Demand	Anodyne	EBP	21	41
O=C(C(F)=C1CCC1)N1CCC(OCc2ccc(F)cc2)CC1	ZINC000819454746	DH	On-Demand	Anodyne	LIPG	18	43
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2)C1	ZINC000819454752	GG	On-Demand	Bother	ESR1	19	40
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2)C1	ZINC000819454752	GG	On-Demand	Bother	LTA4H	18	45
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cc2)C1	ZINC000819454753	GG	On-Demand	Bother	ESR1	19	40
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cc2)C1	ZINC000819454753	GG	On-Demand	Bother	LTA4H	18	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2)C1	ZINC000819454754	GG	On-Demand	Bother	ESR1	19	40
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2)C1	ZINC000819454754	GG	On-Demand	Bother	LTA4H	18	45
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cc2)C1	ZINC000819454755	GG	On-Demand	Bother	ESR1	19	40
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cc2)C1	ZINC000819454755	GG	On-Demand	Bother	LTA4H	18	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3)cc2)C1	ZINC000819454759	EH	On-Demand	Anodyne	ESR1	40	46
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3)cc2)C1	ZINC000819454759	EH	On-Demand	Anodyne	SLC6A3	21	42
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3)cc2)C1	ZINC000819454759	EH	On-Demand	Anodyne	ESR2	26	46
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3)cc2)C1	ZINC000819454759	EH	On-Demand	Anodyne	LTA4H	63	46
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3)cc2)C1	ZINC000819454759	EH	On-Demand	Anodyne	HRH3	26	46
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3)cc2)C1	ZINC000819454759	EH	On-Demand	Anodyne	EBP	25	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3)cc2)C1	ZINC000819454759	EH	On-Demand	Anodyne	PSMB1	42	37
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3)cc2)C1	ZINC000819454760	EH	On-Demand	Anodyne	ESR1	40	46
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3)cc2)C1	ZINC000819454760	EH	On-Demand	Anodyne	SLC6A3	21	42
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3)cc2)C1	ZINC000819454760	EH	On-Demand	Anodyne	ESR2	26	46
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3)cc2)C1	ZINC000819454760	EH	On-Demand	Anodyne	LTA4H	63	46
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3)cc2)C1	ZINC000819454760	EH	On-Demand	Anodyne	HRH3	26	46
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3)cc2)C1	ZINC000819454760	EH	On-Demand	Anodyne	EBP	25	45
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3)cc2)C1	ZINC000819454760	EH	On-Demand	Anodyne	PSMB1	42	37
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3)cc2)C1	ZINC000819454761	EH	On-Demand	Anodyne	ESR1	40	46
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3)cc2)C1	ZINC000819454761	EH	On-Demand	Anodyne	SLC6A3	21	42
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3)cc2)C1	ZINC000819454761	EH	On-Demand	Anodyne	ESR2	26	46
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3)cc2)C1	ZINC000819454761	EH	On-Demand	Anodyne	LTA4H	63	46
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3)cc2)C1	ZINC000819454761	EH	On-Demand	Anodyne	HRH3	26	46
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3)cc2)C1	ZINC000819454761	EH	On-Demand	Anodyne	EBP	25	45
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3)cc2)C1	ZINC000819454761	EH	On-Demand	Anodyne	PSMB1	42	37
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3)cc2)C1	ZINC000819454762	EH	On-Demand	Anodyne	ESR1	40	46
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3)cc2)C1	ZINC000819454762	EH	On-Demand	Anodyne	SLC6A3	21	42
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3)cc2)C1	ZINC000819454762	EH	On-Demand	Anodyne	ESR2	26	46
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3)cc2)C1	ZINC000819454762	EH	On-Demand	Anodyne	LTA4H	63	46
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3)cc2)C1	ZINC000819454762	EH	On-Demand	Anodyne	HRH3	26	46
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3)cc2)C1	ZINC000819454762	EH	On-Demand	Anodyne	EBP	25	45
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3)cc2)C1	ZINC000819454762	EH	On-Demand	Anodyne	PSMB1	42	37
CCn1c(NC(=O)/C=C\[C@@H]2CCCO2)nc2cc(Br)ccc21	ZINC000819454764	FG	On-Demand	Anodyne	ITK	44	42
CCn1c(NC(=O)/C=C/[C@H]2CCCO2)nc2cc(Br)ccc21	ZINC000819454765	FG	On-Demand	Anodyne	ITK	44	42
CCn1c(NC(=O)/C=C/[C@@H]2CCCO2)nc2cc(Br)ccc21	ZINC000819454766	FG	On-Demand	Anodyne	ITK	44	42
CON(C)C(=O)CCNc1ccc(OCCN2CCCC2)c(C)c1	ZINC000819454768	EE	On-Demand	Anodyne	HTR2A	23	41
C[C@@H]1CCN(CCOc2ccc(NCCS(=O)(=O)c3ccccc3)cc2)C1	ZINC000819454771	GG	On-Demand	Anodyne	ESR1	25	43
C[C@@H]1CCN(CCOc2ccc(NCCS(=O)(=O)c3ccccc3)cc2)C1	ZINC000819454771	GG	On-Demand	Anodyne	ESR2	15	43
C[C@@H]1CCN(CCOc2ccc(NCCS(=O)(=O)c3ccccc3)cc2)C1	ZINC000819454771	GG	On-Demand	Anodyne	LTA4H	48	45
C[C@@H]1CCN(CCOc2ccc(NCCS(=O)(=O)c3ccccc3)cc2)C1	ZINC000819454771	GG	On-Demand	Anodyne	HTR7	17	48
C[C@@H]1CCN(CCOc2ccc(NCCS(=O)(=O)c3ccccc3)cc2)C1	ZINC000819454771	GG	On-Demand	Anodyne	HRH3	31	45
C[C@@H]1CCN(CCOc2ccc(NCCS(=O)(=O)c3ccccc3)cc2)C1	ZINC000819454771	GG	On-Demand	Anodyne	EBP	17	44
C[C@H]1CCN(CCOc2ccc(NCCS(=O)(=O)c3ccccc3)cc2)C1	ZINC000819454772	GG	On-Demand	Anodyne	ESR1	25	43
C[C@H]1CCN(CCOc2ccc(NCCS(=O)(=O)c3ccccc3)cc2)C1	ZINC000819454772	GG	On-Demand	Anodyne	ESR2	15	43
C[C@H]1CCN(CCOc2ccc(NCCS(=O)(=O)c3ccccc3)cc2)C1	ZINC000819454772	GG	On-Demand	Anodyne	LTA4H	48	45
C[C@H]1CCN(CCOc2ccc(NCCS(=O)(=O)c3ccccc3)cc2)C1	ZINC000819454772	GG	On-Demand	Anodyne	HTR7	17	48
C[C@H]1CCN(CCOc2ccc(NCCS(=O)(=O)c3ccccc3)cc2)C1	ZINC000819454772	GG	On-Demand	Anodyne	HRH3	31	45
C[C@H]1CCN(CCOc2ccc(NCCS(=O)(=O)c3ccccc3)cc2)C1	ZINC000819454772	GG	On-Demand	Anodyne	EBP	17	44
Cc1ccc(NC[C@H](O)c2cccnc2)cc1N1CCOC1=O	ZINC000819454773	DE	On-Demand	Anodyne	ADRB3	88	43
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1N1CCOC1=O	ZINC000819454774	DE	On-Demand	Anodyne	ADRB3	88	43
C[C@@H](CNc1ccc(OCCN2CC[C@@H](C)C2)cc1)S(C)(=O)=O	ZINC000819454787	EE	On-Demand	Anodyne	ESR1	21	41
C[C@@H](CNc1ccc(OCCN2CC[C@@H](C)C2)cc1)S(C)(=O)=O	ZINC000819454787	EE	On-Demand	Anodyne	LTA4H	32	41
C[C@@H](CNc1ccc(OCCN2CC[C@@H](C)C2)cc1)S(C)(=O)=O	ZINC000819454787	EE	On-Demand	Anodyne	HTR7	15	41
C[C@@H](CNc1ccc(OCCN2CC[C@@H](C)C2)cc1)S(C)(=O)=O	ZINC000819454787	EE	On-Demand	Anodyne	HRH3	20	42
C[C@@H](CNc1ccc(OCCN2CC[C@@H](C)C2)cc1)S(C)(=O)=O	ZINC000819454787	EE	On-Demand	Anodyne	EBP	24	46
C[C@H]1CCN(CCOc2ccc(NC[C@H](C)S(C)(=O)=O)cc2)C1	ZINC000819454788	EE	On-Demand	Anodyne	ESR1	21	41
C[C@H]1CCN(CCOc2ccc(NC[C@H](C)S(C)(=O)=O)cc2)C1	ZINC000819454788	EE	On-Demand	Anodyne	LTA4H	32	41
C[C@H]1CCN(CCOc2ccc(NC[C@H](C)S(C)(=O)=O)cc2)C1	ZINC000819454788	EE	On-Demand	Anodyne	HTR7	15	41
C[C@H]1CCN(CCOc2ccc(NC[C@H](C)S(C)(=O)=O)cc2)C1	ZINC000819454788	EE	On-Demand	Anodyne	HRH3	20	42
C[C@H]1CCN(CCOc2ccc(NC[C@H](C)S(C)(=O)=O)cc2)C1	ZINC000819454788	EE	On-Demand	Anodyne	EBP	24	46
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](C)S(C)(=O)=O)cc2)C1	ZINC000819454789	EE	On-Demand	Anodyne	ESR1	21	41
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](C)S(C)(=O)=O)cc2)C1	ZINC000819454789	EE	On-Demand	Anodyne	LTA4H	32	41
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](C)S(C)(=O)=O)cc2)C1	ZINC000819454789	EE	On-Demand	Anodyne	HTR7	15	41
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](C)S(C)(=O)=O)cc2)C1	ZINC000819454789	EE	On-Demand	Anodyne	HRH3	20	42
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](C)S(C)(=O)=O)cc2)C1	ZINC000819454789	EE	On-Demand	Anodyne	EBP	24	46
C[C@H]1CCN(CCOc2ccc(NC[C@@H](C)S(C)(=O)=O)cc2)C1	ZINC000819454790	EE	On-Demand	Anodyne	ESR1	21	41
C[C@H]1CCN(CCOc2ccc(NC[C@@H](C)S(C)(=O)=O)cc2)C1	ZINC000819454790	EE	On-Demand	Anodyne	LTA4H	32	41
C[C@H]1CCN(CCOc2ccc(NC[C@@H](C)S(C)(=O)=O)cc2)C1	ZINC000819454790	EE	On-Demand	Anodyne	HTR7	15	41
C[C@H]1CCN(CCOc2ccc(NC[C@@H](C)S(C)(=O)=O)cc2)C1	ZINC000819454790	EE	On-Demand	Anodyne	HRH3	20	42
C[C@H]1CCN(CCOc2ccc(NC[C@@H](C)S(C)(=O)=O)cc2)C1	ZINC000819454790	EE	On-Demand	Anodyne	EBP	24	46
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3F)cc2)C1	ZINC000819454794	FH	On-Demand	Anodyne	ESR1	35	45
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3F)cc2)C1	ZINC000819454794	FH	On-Demand	Anodyne	ESR2	17	45
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3F)cc2)C1	ZINC000819454794	FH	On-Demand	Anodyne	LTA4H	38	41
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3F)cc2)C1	ZINC000819454794	FH	On-Demand	Anodyne	HRH3	15	40
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3F)cc2)C1	ZINC000819454794	FH	On-Demand	Anodyne	EBP	22	46
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3F)cc2)C1	ZINC000819454795	FH	On-Demand	Anodyne	ESR1	35	45
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3F)cc2)C1	ZINC000819454795	FH	On-Demand	Anodyne	ESR2	17	45
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3F)cc2)C1	ZINC000819454795	FH	On-Demand	Anodyne	LTA4H	38	41
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3F)cc2)C1	ZINC000819454795	FH	On-Demand	Anodyne	HRH3	15	40
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3F)cc2)C1	ZINC000819454795	FH	On-Demand	Anodyne	EBP	22	46
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3F)cc2)C1	ZINC000819454796	FH	On-Demand	Anodyne	ESR1	35	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3F)cc2)C1	ZINC000819454796	FH	On-Demand	Anodyne	ESR2	17	45
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3F)cc2)C1	ZINC000819454796	FH	On-Demand	Anodyne	LTA4H	38	41
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3F)cc2)C1	ZINC000819454796	FH	On-Demand	Anodyne	HRH3	15	40
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccccc3F)cc2)C1	ZINC000819454796	FH	On-Demand	Anodyne	EBP	22	46
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3F)cc2)C1	ZINC000819454797	FH	On-Demand	Anodyne	ESR1	35	45
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3F)cc2)C1	ZINC000819454797	FH	On-Demand	Anodyne	ESR2	17	45
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3F)cc2)C1	ZINC000819454797	FH	On-Demand	Anodyne	LTA4H	38	41
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3F)cc2)C1	ZINC000819454797	FH	On-Demand	Anodyne	HRH3	15	40
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccccc3F)cc2)C1	ZINC000819454797	FH	On-Demand	Anodyne	EBP	22	46
COC[C@@H](O)CNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454800	DC	On-Demand	Anodyne	LTA4H	49	48
COC[C@@H](O)CNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454800	DC	On-Demand	Anodyne	HRH3	29	41
COC[C@@H](O)CNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454800	DC	On-Demand	Anodyne	PSMB2	41	38
COC[C@@H](O)CNc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000819454800	DC	On-Demand	Anodyne	PSMB1	46	41
C[C@H]1CCN(CCOc2ccc(NC[C@@H](C#N)CCC#N)cc2)C1	ZINC000819454802	EG	On-Demand	Mild	EBP	16	44
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](C#N)CCC#N)cc2)C1	ZINC000819454803	EG	On-Demand	Mild	EBP	16	44
C[C@H]1CCN(CCOc2ccc(NC[C@H](C#N)CCC#N)cc2)C1	ZINC000819454804	EG	On-Demand	Mild	EBP	16	44
C[C@@H]1CCN(CCOc2ccc(NC[C@H](C#N)CCC#N)cc2)C1	ZINC000819454805	EG	On-Demand	Mild	EBP	16	44
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(C)c(N3CCOC3=O)c2)cc1	ZINC000819454806	GF	On-Demand	Anodyne	ADRB2	26	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(C)c(N3CCOC3=O)c2)cc1	ZINC000819454806	GF	On-Demand	Anodyne	ADRB1	56	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(C)c(N3CCOC3=O)c2)cc1	ZINC000819454806	GF	On-Demand	Anodyne	ADRB3	37	44
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(C)c(N3CCOC3=O)c2)cc1	ZINC000819454807	GF	On-Demand	Anodyne	ADRB2	26	48
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(C)c(N3CCOC3=O)c2)cc1	ZINC000819454807	GF	On-Demand	Anodyne	ADRB1	56	48
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(C)c(N3CCOC3=O)c2)cc1	ZINC000819454807	GF	On-Demand	Anodyne	ADRB3	37	44
C[C@H]1CCN(CCOc2ccc(NCCC(=O)Nc3ccccc3F)cc2)C1	ZINC000819454811	GH	On-Demand	Anodyne	ESR1	21	41
C[C@H]1CCN(CCOc2ccc(NCCC(=O)Nc3ccccc3F)cc2)C1	ZINC000819454811	GH	On-Demand	Anodyne	LTA4H	46	42
C[C@H]1CCN(CCOc2ccc(NCCC(=O)Nc3ccccc3F)cc2)C1	ZINC000819454811	GH	On-Demand	Anodyne	HRH3	19	42
C[C@H]1CCN(CCOc2ccc(NCCC(=O)Nc3ccccc3F)cc2)C1	ZINC000819454811	GH	On-Demand	Anodyne	EBP	15	43
C[C@@H]1CCN(CCOc2ccc(NCCC(=O)Nc3ccccc3F)cc2)C1	ZINC000819454812	GH	On-Demand	Anodyne	ESR1	21	41
C[C@@H]1CCN(CCOc2ccc(NCCC(=O)Nc3ccccc3F)cc2)C1	ZINC000819454812	GH	On-Demand	Anodyne	LTA4H	46	42
C[C@@H]1CCN(CCOc2ccc(NCCC(=O)Nc3ccccc3F)cc2)C1	ZINC000819454812	GH	On-Demand	Anodyne	HRH3	19	42
C[C@@H]1CCN(CCOc2ccc(NCCC(=O)Nc3ccccc3F)cc2)C1	ZINC000819454812	GH	On-Demand	Anodyne	EBP	15	43
C[C@@H](CNc1ccc(OCCN2CCN(C)CC2)cc1)S(C)(=O)=O	ZINC000819454820	FD	On-Demand	Anodyne	LTA4H	46	47
C[C@@H](CNc1ccc(OCCN2CCN(C)CC2)cc1)S(C)(=O)=O	ZINC000819454820	FD	On-Demand	Anodyne	HRH3	29	40
C[C@@H](CNc1ccc(OCCN2CCN(C)CC2)cc1)S(C)(=O)=O	ZINC000819454820	FD	On-Demand	Anodyne	PSMB1	43	43
C[C@H]1CCN(CCOc2ccc(NCCS(C)(=O)=O)cc2)C1	ZINC000819454829	ED	On-Demand	Anodyne	ESR1	27	43
C[C@H]1CCN(CCOc2ccc(NCCS(C)(=O)=O)cc2)C1	ZINC000819454829	ED	On-Demand	Anodyne	LTA4H	40	42
C[C@H]1CCN(CCOc2ccc(NCCS(C)(=O)=O)cc2)C1	ZINC000819454829	ED	On-Demand	Anodyne	HTR7	15	42
C[C@H]1CCN(CCOc2ccc(NCCS(C)(=O)=O)cc2)C1	ZINC000819454829	ED	On-Demand	Anodyne	HRH3	30	43
C[C@H]1CCN(CCOc2ccc(NCCS(C)(=O)=O)cc2)C1	ZINC000819454829	ED	On-Demand	Anodyne	EBP	24	48
C[C@@H]1CCN(CCOc2ccc(NCCS(C)(=O)=O)cc2)C1	ZINC000819454830	ED	On-Demand	Anodyne	ESR1	27	43
C[C@@H]1CCN(CCOc2ccc(NCCS(C)(=O)=O)cc2)C1	ZINC000819454830	ED	On-Demand	Anodyne	LTA4H	40	42
C[C@@H]1CCN(CCOc2ccc(NCCS(C)(=O)=O)cc2)C1	ZINC000819454830	ED	On-Demand	Anodyne	HTR7	15	42
C[C@@H]1CCN(CCOc2ccc(NCCS(C)(=O)=O)cc2)C1	ZINC000819454830	ED	On-Demand	Anodyne	HRH3	30	43
C[C@@H]1CCN(CCOc2ccc(NCCS(C)(=O)=O)cc2)C1	ZINC000819454830	ED	On-Demand	Anodyne	EBP	24	48
C[C@H]1CCN(CCOc2ccc(NCCC#N)cc2)C1	ZINC000819454837	CF	On-Demand	Mild	ESR1	24	42
C[C@H]1CCN(CCOc2ccc(NCCC#N)cc2)C1	ZINC000819454837	CF	On-Demand	Mild	LTA4H	38	41
C[C@H]1CCN(CCOc2ccc(NCCC#N)cc2)C1	ZINC000819454837	CF	On-Demand	Mild	HRH3	21	42
C[C@H]1CCN(CCOc2ccc(NCCC#N)cc2)C1	ZINC000819454837	CF	On-Demand	Mild	EBP	22	49
C[C@@H]1CCN(CCOc2ccc(NCCC#N)cc2)C1	ZINC000819454838	CF	On-Demand	Mild	ESR1	24	42
C[C@@H]1CCN(CCOc2ccc(NCCC#N)cc2)C1	ZINC000819454838	CF	On-Demand	Mild	LTA4H	38	41
C[C@@H]1CCN(CCOc2ccc(NCCC#N)cc2)C1	ZINC000819454838	CF	On-Demand	Mild	HRH3	21	42
C[C@@H]1CCN(CCOc2ccc(NCCC#N)cc2)C1	ZINC000819454838	CF	On-Demand	Mild	EBP	22	49
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)c(F)c3)cc2)C1	ZINC000819454854	GH	On-Demand	Anodyne	ESR1	26	41
C[C@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)c(F)c3)cc2)C1	ZINC000819454854	GH	On-Demand	Anodyne	EBP	20	47
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)c(F)c3)cc2)C1	ZINC000819454855	GH	On-Demand	Anodyne	ESR1	26	41
C[C@@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)c(F)c3)cc2)C1	ZINC000819454855	GH	On-Demand	Anodyne	EBP	20	47
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)c(F)c3)cc2)C1	ZINC000819454856	GH	On-Demand	Anodyne	ESR1	26	41
C[C@@H]1CCN(CCOc2ccc(NC[C@H](O)c3ccc(F)c(F)c3)cc2)C1	ZINC000819454856	GH	On-Demand	Anodyne	EBP	20	47
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)c(F)c3)cc2)C1	ZINC000819454857	GH	On-Demand	Anodyne	ESR1	26	41
C[C@H]1CCN(CCOc2ccc(NC[C@@H](O)c3ccc(F)c(F)c3)cc2)C1	ZINC000819454857	GH	On-Demand	Anodyne	EBP	20	47
CCCOc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1	ZINC000819454865	CG	On-Demand	Anodyne	PLA2G4B	44	32
CCCOc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1	ZINC000819454865	CG	On-Demand	Anodyne	FAAH	21	41
CCCOc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1	ZINC000819454866	CG	On-Demand	Anodyne	PLA2G4B	44	32
CCCOc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1	ZINC000819454866	CG	On-Demand	Anodyne	FAAH	21	41
CCCOc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1	ZINC000819454867	CG	On-Demand	Anodyne	PLA2G4B	44	32
CCCOc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1	ZINC000819454867	CG	On-Demand	Anodyne	FAAH	21	41
CCCOc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1	ZINC000819454868	CG	On-Demand	Anodyne	PLA2G4B	44	32
CCCOc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1	ZINC000819454868	CG	On-Demand	Anodyne	FAAH	21	41
Cc1ccc(NC[C@@H](O)COc2ccccc2C(C)C)cc1N1CCOC1=O	ZINC000819454888	GH	On-Demand	Anodyne	ADRB2	22	46
Cc1ccc(NC[C@H](O)COc2ccccc2C(C)C)cc1N1CCOC1=O	ZINC000819454889	GH	On-Demand	Anodyne	ADRB2	22	46
CC[C@H](O)CNc1ccc(OCC(F)F)cc1	ZINC000819454894	BF	On-Demand	Anodyne	ADRB2	31	43
CC[C@H](O)CNc1ccc(OCC(F)F)cc1	ZINC000819454894	BF	On-Demand	Anodyne	ADRB1	42	43
CC[C@H](O)CNc1ccc(OCC(F)F)cc1	ZINC000819454894	BF	On-Demand	Anodyne	PDS	47	36
O[C@@H](CNc1ccc(OCC(F)F)cc1)COCc1ccccc1	ZINC000819454896	EG	On-Demand	Anodyne	ADRB2	35	41
O[C@@H](CNc1ccc(OCC(F)F)cc1)COCc1ccccc1	ZINC000819454896	EG	On-Demand	Anodyne	ADRB1	57	42
O[C@@H](CNc1ccc(OCC(F)F)cc1)COCc1ccccc1	ZINC000819454896	EG	On-Demand	Anodyne	ADRB3	39	42
O[C@@H](CNc1ccc(OCC(F)F)cc1)COCc1ccccc1	ZINC000819454896	EG	On-Demand	Anodyne	PDS	42	36
O[C@H](CNc1ccc(OCC(F)F)cc1)COCc1ccccc1	ZINC000819454897	EG	On-Demand	Anodyne	ADRB2	35	41
O[C@H](CNc1ccc(OCC(F)F)cc1)COCc1ccccc1	ZINC000819454897	EG	On-Demand	Anodyne	ADRB1	57	42
O[C@H](CNc1ccc(OCC(F)F)cc1)COCc1ccccc1	ZINC000819454897	EG	On-Demand	Anodyne	ADRB3	39	42
O[C@H](CNc1ccc(OCC(F)F)cc1)COCc1ccccc1	ZINC000819454897	EG	On-Demand	Anodyne	PDS	42	36
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(C)c(N3CCOC3=O)c2)c1	ZINC000819454903	GG	On-Demand	Anodyne	ABCB1	23	50
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(C)c(N3CCOC3=O)c2)c1	ZINC000819454904	GG	On-Demand	Anodyne	ABCB1	23	50
COC[C@@H](O)CNc1ccc(OCC(F)F)cc1	ZINC000819454909	CD	On-Demand	Anodyne	ADRB2	43	47
COC[C@@H](O)CNc1ccc(OCC(F)F)cc1	ZINC000819454909	CD	On-Demand	Anodyne	ADRB1	59	47
O[C@H](CNc1ccc(OCC(F)F)cc1)CC1CCCC1	ZINC000819454927	CH	On-Demand	Anodyne	ADRB1	36	41
O[C@@H](CNc1ccc(OCC(F)F)cc1)CC1CCCC1	ZINC000819454928	CH	On-Demand	Anodyne	ADRB1	36	41
COCCNC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)c1	ZINC000819454944	JF	On-Demand	Anodyne	PPARD	16	43
COCCNC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)c1	ZINC000819454944	JF	On-Demand	Anodyne	AKR1C3	46	38
COCCNC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)c1	ZINC000819454945	JF	On-Demand	Anodyne	PPARD	16	43
COCCNC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)c1	ZINC000819454945	JF	On-Demand	Anodyne	AKR1C3	46	38
COCCNC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)c1	ZINC000819454946	JF	On-Demand	Anodyne	PPARD	16	43
COCCNC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)c1	ZINC000819454946	JF	On-Demand	Anodyne	AKR1C3	46	38
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1F	ZINC000819454953	EG	On-Demand	Anodyne	ADRB2	50	42
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1F	ZINC000819454953	EG	On-Demand	Anodyne	ADRB1	74	41
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1F	ZINC000819454953	EG	On-Demand	Anodyne	GRIN1	15	45
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1F	ZINC000819454953	EG	On-Demand	Anodyne	ADRB3	38	41
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1F	ZINC000819454954	EG	On-Demand	Anodyne	ADRB2	50	42
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1F	ZINC000819454954	EG	On-Demand	Anodyne	ADRB1	74	41
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1F	ZINC000819454954	EG	On-Demand	Anodyne	GRIN1	15	45
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1F	ZINC000819454954	EG	On-Demand	Anodyne	ADRB3	38	41
N#CCc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819454961	FG	On-Demand	Mild	ADRB2	37	41
N#CCc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819454961	FG	On-Demand	Mild	ADRB1	62	41
N#CCc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819454961	FG	On-Demand	Mild	ADRB3	40	40
N#CCc1ccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819454962	FG	On-Demand	Mild	ADRB2	37	41
N#CCc1ccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819454962	FG	On-Demand	Mild	ADRB1	62	41
N#CCc1ccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819454962	FG	On-Demand	Mild	ADRB3	40	40
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819454992	EG	On-Demand	Mild	ADRB2	33	41
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819454992	EG	On-Demand	Mild	ADRB1	57	41
N#Cc1ccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819454993	EG	On-Demand	Mild	ADRB2	33	41
N#Cc1ccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819454993	EG	On-Demand	Mild	ADRB1	57	41
O=C(COc1ccccc1NC[C@@H](O)CCc1ccccc1)N1CCOCC1	ZINC000819455009	GE	On-Demand	Clean	ABCB1	44	39
O=C(COc1ccccc1NC[C@@H](O)CCc1ccccc1)N1CCOCC1	ZINC000819455009	GE	On-Demand	Clean	CTSS	22	43
O=C(COc1ccccc1NC[C@H](O)CCc1ccccc1)N1CCOCC1	ZINC000819455010	GE	On-Demand	Clean	ABCB1	44	39
O=C(COc1ccccc1NC[C@H](O)CCc1ccccc1)N1CCOCC1	ZINC000819455010	GE	On-Demand	Clean	CTSS	22	43
O[C@@H](CNc1ccc(OCC(F)F)cc1)COCc1ccc(Cl)cc1	ZINC000819455016	FH	On-Demand	Anodyne	ADRB2	28	43
O[C@@H](CNc1ccc(OCC(F)F)cc1)COCc1ccc(Cl)cc1	ZINC000819455016	FH	On-Demand	Anodyne	ADRB1	50	44
O[C@@H](CNc1ccc(OCC(F)F)cc1)COCc1ccc(Cl)cc1	ZINC000819455016	FH	On-Demand	Anodyne	GRIN1	26	44
O[C@@H](CNc1ccc(OCC(F)F)cc1)COCc1ccc(Cl)cc1	ZINC000819455016	FH	On-Demand	Anodyne	ADRB3	35	43
O[C@H](CNc1ccc(OCC(F)F)cc1)COCc1ccc(Cl)cc1	ZINC000819455017	FH	On-Demand	Anodyne	ADRB2	28	43
O[C@H](CNc1ccc(OCC(F)F)cc1)COCc1ccc(Cl)cc1	ZINC000819455017	FH	On-Demand	Anodyne	ADRB1	50	44
O[C@H](CNc1ccc(OCC(F)F)cc1)COCc1ccc(Cl)cc1	ZINC000819455017	FH	On-Demand	Anodyne	GRIN1	26	44
O[C@H](CNc1ccc(OCC(F)F)cc1)COCc1ccc(Cl)cc1	ZINC000819455017	FH	On-Demand	Anodyne	ADRB3	35	43
O=C(CCNc1ccc(OCC(F)F)cc1)Nc1cccnc1	ZINC000819455030	DG	On-Demand	Anodyne	ADRB1	25	44
Cc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1N1CCOC1=O	ZINC000819455043	FF	On-Demand	Anodyne	ADRB1	42	37
Cc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1N1CCOC1=O	ZINC000819455044	FF	On-Demand	Anodyne	ADRB1	42	37
C[C@@](O)(CNc1ccccc1OCC(=O)N1CCOCC1)C(F)(F)F	ZINC000819455050	FD	On-Demand	Anodyne	ITGAL	47	38
C[C@@](O)(CNc1ccccc1OCC(=O)N1CCOCC1)C(F)(F)F	ZINC000819455050	FD	On-Demand	Anodyne	MLYCD	22	40
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccc(F)cc1	ZINC000819455055	EG	On-Demand	Anodyne	ADRB2	46	45
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccc(F)cc1	ZINC000819455055	EG	On-Demand	Anodyne	ADRB1	68	45
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccc(F)cc1	ZINC000819455055	EG	On-Demand	Anodyne	GRIN1	21	48
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccc(F)cc1	ZINC000819455055	EG	On-Demand	Anodyne	ADRB3	40	45
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccc(F)cc1	ZINC000819455056	EG	On-Demand	Anodyne	ADRB2	46	45
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccc(F)cc1	ZINC000819455056	EG	On-Demand	Anodyne	ADRB1	68	45
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccc(F)cc1	ZINC000819455056	EG	On-Demand	Anodyne	GRIN1	21	48
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccc(F)cc1	ZINC000819455056	EG	On-Demand	Anodyne	ADRB3	40	45
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(C)c(N3CCOC3=O)c2)cc1	ZINC000819455069	GG	On-Demand	Anodyne	ABCB1	19	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(C)c(N3CCOC3=O)c2)cc1	ZINC000819455070	GG	On-Demand	Anodyne	ABCB1	19	42
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OC)cc1OC	ZINC000819455075	FE	On-Demand	Anodyne	DRD4	41	32
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OC)cc1OC	ZINC000819455075	FE	On-Demand	Anodyne	KCNA3	43	42
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OC)cc1OC	ZINC000819455075	FE	On-Demand	Anodyne	MTNR1A	68	39
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OC)cc1OC	ZINC000819455075	FE	On-Demand	Anodyne	MTNR1B	63	39
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OC)cc1OC	ZINC000819455075	FE	On-Demand	Anodyne	PYGM	21	40
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OC)cc1OC	ZINC000819455075	FE	On-Demand	Anodyne	LUCI_LUCLA	17	47
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OC)cc1OC	ZINC000819455075	FE	On-Demand	Anodyne	KCNK3	60	43
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OC)cc1OC	ZINC000819455075	FE	On-Demand	Anodyne	KCNK9	49	43
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OC)cc1OC	ZINC000819455075	FE	On-Demand	Anodyne	POLR1A	47	36
C[C@@H](CNc1ccc(OCc2ccccn2)c(F)c1)S(C)(=O)=O	ZINC000819455079	EF	On-Demand	Anodyne	ERBB2	29	40
O[C@H](CNc1ccc(OCC(F)F)cc1)COC1CCOCC1	ZINC000819455080	EE	On-Demand	Anodyne	ADRB1	32	42
O[C@@H](CNc1ccc(OCC(F)F)cc1)COC1CCOCC1	ZINC000819455081	EE	On-Demand	Anodyne	ADRB1	32	42
Cc1ccc(OC[C@@H](O)CNc2ccc(C)c(N3CCOC3=O)c2)cc1	ZINC000819455089	FG	On-Demand	Anodyne	ADRB2	24	41
Cc1ccc(OC[C@@H](O)CNc2ccc(C)c(N3CCOC3=O)c2)cc1	ZINC000819455089	FG	On-Demand	Anodyne	ADRB1	42	38
Cc1ccc(OC[C@H](O)CNc2ccc(C)c(N3CCOC3=O)c2)cc1	ZINC000819455090	FG	On-Demand	Anodyne	ADRB2	24	41
Cc1ccc(OC[C@H](O)CNc2ccc(C)c(N3CCOC3=O)c2)cc1	ZINC000819455090	FG	On-Demand	Anodyne	ADRB1	42	38
O[C@@H](CNc1ccc(OCC(F)F)cc1)c1ccc(F)cc1	ZINC000819455091	DH	On-Demand	Anodyne	ADRB2	17	43
O[C@H](CNc1ccc(OCC(F)F)cc1)c1ccc(F)cc1	ZINC000819455092	DH	On-Demand	Anodyne	ADRB2	17	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(CCN3CCCC3)c1)C2	ZINC000819455103	GG	On-Demand	Anodyne	CCR3	45	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cccc(CCN3CCCC3)c1)C2	ZINC000819455103	GG	On-Demand	Anodyne	MCHR1	15	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(CCN3CCCC3)c1)C2	ZINC000819455104	GG	On-Demand	Anodyne	CCR3	45	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cccc(CCN3CCCC3)c1)C2	ZINC000819455104	GG	On-Demand	Anodyne	MCHR1	15	40
Cc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455109	EG	On-Demand	Anodyne	ADRB2	49	59
Cc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455109	EG	On-Demand	Anodyne	ADRB1	65	49
Cc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455109	EG	On-Demand	Anodyne	GRIN1	23	40
Cc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455109	EG	On-Demand	Anodyne	ADRB3	39	45
Cc1ccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455110	EG	On-Demand	Anodyne	ADRB2	49	59
Cc1ccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455110	EG	On-Demand	Anodyne	ADRB1	65	49
Cc1ccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455110	EG	On-Demand	Anodyne	GRIN1	23	40
Cc1ccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455110	EG	On-Demand	Anodyne	ADRB3	39	45
Cc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1N1CCOC1=O	ZINC000819455119	GH	On-Demand	Anodyne	ADRB2	26	44
Cc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1N1CCOC1=O	ZINC000819455119	GH	On-Demand	Anodyne	CYP2D6	21	42
Cc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1N1CCOC1=O	ZINC000819455119	GH	On-Demand	Anodyne	ABCB1	41	33
Cc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1N1CCOC1=O	ZINC000819455120	GH	On-Demand	Anodyne	ADRB2	26	44
Cc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1N1CCOC1=O	ZINC000819455120	GH	On-Demand	Anodyne	CYP2D6	21	42
Cc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1N1CCOC1=O	ZINC000819455120	GH	On-Demand	Anodyne	ABCB1	41	33
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1cccc2[nH]ccc12	ZINC000819455167	FH	On-Demand	Anodyne	ADRB2	33	59
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1cccc2[nH]ccc12	ZINC000819455167	FH	On-Demand	Anodyne	ADRB1	50	59
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1cccc2[nH]ccc12	ZINC000819455167	FH	On-Demand	Anodyne	ADRB3	27	59
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1cccc2[nH]ccc12	ZINC000819455167	FH	On-Demand	Anodyne	CYP2D6	15	42
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1cccc2[nH]ccc12	ZINC000819455168	FH	On-Demand	Anodyne	ADRB2	33	59
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1cccc2[nH]ccc12	ZINC000819455168	FH	On-Demand	Anodyne	ADRB1	50	59
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1cccc2[nH]ccc12	ZINC000819455168	FH	On-Demand	Anodyne	ADRB3	27	59
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1cccc2[nH]ccc12	ZINC000819455168	FH	On-Demand	Anodyne	CYP2D6	15	42
Cc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1N1CCOC1=O	ZINC000819455174	GF	On-Demand	Mild	ADRB1	47	34
Cc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1N1CCOC1=O	ZINC000819455175	GF	On-Demand	Mild	ADRB1	47	34
O=C(COc1ccccc1NC[C@H](O)c1ccc(Cl)cc1)N1CCOCC1	ZINC000819455176	GF	On-Demand	Anodyne	CYP3A4	44	35
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1	ZINC000819455183	DG	On-Demand	Anodyne	ADRB2	63	54
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1	ZINC000819455183	DG	On-Demand	Anodyne	ADRB1	86	50
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1	ZINC000819455183	DG	On-Demand	Anodyne	GRIN1	24	42
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1	ZINC000819455183	DG	On-Demand	Anodyne	ADRB3	53	50
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1	ZINC000819455183	DG	On-Demand	Anodyne	ABCB1	15	41
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1	ZINC000819455183	DG	On-Demand	Anodyne	PDS	56	37
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1	ZINC000819455184	DG	On-Demand	Anodyne	ADRB2	63	54
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1	ZINC000819455184	DG	On-Demand	Anodyne	ADRB1	86	50
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1	ZINC000819455184	DG	On-Demand	Anodyne	GRIN1	24	42
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1	ZINC000819455184	DG	On-Demand	Anodyne	ADRB3	53	50
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1	ZINC000819455184	DG	On-Demand	Anodyne	ABCB1	15	41
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1	ZINC000819455184	DG	On-Demand	Anodyne	PDS	56	37
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(OCC(F)F)cc1	ZINC000819455193	FG	On-Demand	Anodyne	PDS	44	34
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(OCC(F)F)cc1	ZINC000819455194	FG	On-Demand	Anodyne	PDS	44	34
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455205	FG	On-Demand	Anodyne	ADRB2	48	51
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455205	FG	On-Demand	Anodyne	ADRB1	76	51
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455205	FG	On-Demand	Anodyne	ADRB3	42	44
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455206	FG	On-Demand	Anodyne	ADRB2	48	51
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455206	FG	On-Demand	Anodyne	ADRB1	76	51
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455206	FG	On-Demand	Anodyne	ADRB3	42	44
O=C(COc1ccccc1NC[C@H](O)c1cccnc1)N1CCOCC1	ZINC000819455209	FD	On-Demand	Anodyne	ADRB1	15	40
O=C(COc1ccccc1NC[C@H](O)c1cccnc1)N1CCOCC1	ZINC000819455209	FD	On-Demand	Anodyne	ADRB3	52	40
O=C(COc1ccccc1NC[C@@H](O)c1cccnc1)N1CCOCC1	ZINC000819455210	FD	On-Demand	Anodyne	ADRB1	15	40
O=C(COc1ccccc1NC[C@@H](O)c1cccnc1)N1CCOCC1	ZINC000819455210	FD	On-Demand	Anodyne	ADRB3	52	40
COc1cccc([S@@](=O)CC(=O)NNC(=S)NCCSC)c1	ZINC000819455217	FC	On-Demand	Reactive	MTNR1A	25	41
COc1cccc([S@@](=O)CC(=O)NNC(=S)NCCSC)c1	ZINC000819455217	FC	On-Demand	Reactive	MTNR1B	24	41
O=C(Nc1cccc(CCN2CCCC2)c1)C(F)=C1CCC1	ZINC000819455224	DH	On-Demand	Anodyne	HTR1D	27	42
O=C(Nc1cccc(CCN2CCCC2)c1)C(F)=C1CCC1	ZINC000819455224	DH	On-Demand	Anodyne	HTR1B	22	42
CCOC[C@H](O)CNc1ccc(OCC(F)F)cc1	ZINC000819455225	CE	On-Demand	Anodyne	ADRB2	35	42
CCOC[C@H](O)CNc1ccc(OCC(F)F)cc1	ZINC000819455225	CE	On-Demand	Anodyne	ADRB1	45	42
COc1cc(NCCC(=O)N(C)OC)ccc1Br	ZINC000819455239	DE	On-Demand	Anodyne	DRTS_TRYCR	44	31
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(OCC(F)F)cc1	ZINC000819455262	FG	On-Demand	Bother	ADRB2	43	44
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(OCC(F)F)cc1	ZINC000819455262	FG	On-Demand	Bother	ADRB1	64	38
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(OCC(F)F)cc1	ZINC000819455262	FG	On-Demand	Bother	ADRB3	38	44
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(OCC(F)F)cc1	ZINC000819455263	FG	On-Demand	Bother	ADRB2	43	44
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(OCC(F)F)cc1	ZINC000819455263	FG	On-Demand	Bother	ADRB1	64	38
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(OCC(F)F)cc1	ZINC000819455263	FG	On-Demand	Bother	ADRB3	38	44
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccc2c(c1)OCO2	ZINC000819455283	FF	On-Demand	Anodyne	ADRB1	40	37
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccc2c(c1)OCO2	ZINC000819455283	FF	On-Demand	Anodyne	GRIN1	21	50
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccc2c(c1)OCO2	ZINC000819455284	FF	On-Demand	Anodyne	ADRB1	40	37
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccc2c(c1)OCO2	ZINC000819455284	FF	On-Demand	Anodyne	GRIN1	21	50
O[C@@H](CNc1ccc(OCC(F)F)cc1)c1ccc(Cl)c(F)c1	ZINC000819455285	EI	On-Demand	Anodyne	GRIN1	22	42
O[C@H](CNc1ccc(OCC(F)F)cc1)c1ccc(Cl)c(F)c1	ZINC000819455286	EI	On-Demand	Anodyne	GRIN1	22	42
O=C(COc1ccccc1NC[C@@H](O)CC1CCCC1)N1CCOCC1	ZINC000819455293	FE	On-Demand	Clean	CTSS	29	42
O=C(COc1ccccc1NC[C@H](O)CC1CCCC1)N1CCOCC1	ZINC000819455294	FE	On-Demand	Clean	CTSS	29	42
CSc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455304	FH	On-Demand	Anodyne	ADRB2	41	44
CSc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455304	FH	On-Demand	Anodyne	ADRB1	58	44
CSc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455304	FH	On-Demand	Anodyne	GRIN1	22	41
CSc1ccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455305	FH	On-Demand	Anodyne	ADRB2	41	44
CSc1ccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455305	FH	On-Demand	Anodyne	ADRB1	58	44
CSc1ccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455305	FH	On-Demand	Anodyne	GRIN1	22	41
COCCNC(=O)c1ccccc1NC(=O)/C=C\c1cccs1	ZINC000819455319	EF	On-Demand	Anodyne	POLR1A	46	36
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OC)c(OC)c1OC	ZINC000819455320	GE	On-Demand	Anodyne	DRD2	16	42
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OC)c(OC)c1OC	ZINC000819455320	GE	On-Demand	Anodyne	DRD3	25	42
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OC)c(OC)c1OC	ZINC000819455320	GE	On-Demand	Anodyne	KCNA3	41	41
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OC)c(OC)c1OC	ZINC000819455320	GE	On-Demand	Anodyne	ABCG2	17	41
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OC)c(OC)c1OC	ZINC000819455320	GE	On-Demand	Anodyne	KCNK3	57	41
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OC)c(OC)c1OC	ZINC000819455320	GE	On-Demand	Anodyne	KCNK9	43	41
O[C@@H](CNc1ccc(OCC(F)F)cc1)c1cccnc1	ZINC000819455326	CF	On-Demand	Anodyne	ADRB2	32	46
O[C@@H](CNc1ccc(OCC(F)F)cc1)c1cccnc1	ZINC000819455326	CF	On-Demand	Anodyne	ADRB1	35	46
O[C@@H](CNc1ccc(OCC(F)F)cc1)c1cccnc1	ZINC000819455326	CF	On-Demand	Anodyne	ADRB3	98	49
O[C@H](CNc1ccc(OCC(F)F)cc1)c1cccnc1	ZINC000819455327	CF	On-Demand	Anodyne	ADRB2	32	46
O[C@H](CNc1ccc(OCC(F)F)cc1)c1cccnc1	ZINC000819455327	CF	On-Demand	Anodyne	ADRB1	35	46
O[C@H](CNc1ccc(OCC(F)F)cc1)c1cccnc1	ZINC000819455327	CF	On-Demand	Anodyne	ADRB3	98	49
Cc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1N1CCOC1=O	ZINC000819455328	GH	On-Demand	Anodyne	ADRB2	26	45
Cc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1N1CCOC1=O	ZINC000819455328	GH	On-Demand	Anodyne	ACOX1	41	34
Cc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1N1CCOC1=O	ZINC000819455329	GH	On-Demand	Anodyne	ADRB2	26	45
Cc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1N1CCOC1=O	ZINC000819455329	GH	On-Demand	Anodyne	ACOX1	41	34
Cc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1N1CCOC1=O	ZINC000819455330	GG	On-Demand	Anodyne	ADRB1	40	37
Cc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1N1CCOC1=O	ZINC000819455330	GG	On-Demand	Anodyne	GRIN1	23	41
Cc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1N1CCOC1=O	ZINC000819455331	GG	On-Demand	Anodyne	ADRB1	40	37
Cc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1N1CCOC1=O	ZINC000819455331	GG	On-Demand	Anodyne	GRIN1	23	41
O=C(COc1ccccc1NC[C@@H](O)c1cccc(Cl)c1)N1CCOCC1	ZINC000819455337	GF	On-Demand	Anodyne	ADRB1	32	41
O=C(COc1ccccc1NC[C@@H](O)c1cccc(Cl)c1)N1CCOCC1	ZINC000819455337	GF	On-Demand	Anodyne	ADRB3	49	42
O=C(COc1ccccc1NC[C@@H](O)c1cccc(Cl)c1)N1CCOCC1	ZINC000819455337	GF	On-Demand	Anodyne	IGF1R	33	46
O=C(COc1ccccc1NC[C@@H](O)c1cccc(Cl)c1)N1CCOCC1	ZINC000819455337	GF	On-Demand	Anodyne	CYP3A4	56	43
O=C(COc1ccccc1NC[C@H](O)c1cccc(Cl)c1)N1CCOCC1	ZINC000819455338	GF	On-Demand	Anodyne	ADRB1	32	41
O=C(COc1ccccc1NC[C@H](O)c1cccc(Cl)c1)N1CCOCC1	ZINC000819455338	GF	On-Demand	Anodyne	ADRB3	49	42
O=C(COc1ccccc1NC[C@H](O)c1cccc(Cl)c1)N1CCOCC1	ZINC000819455338	GF	On-Demand	Anodyne	IGF1R	33	46
O=C(COc1ccccc1NC[C@H](O)c1cccc(Cl)c1)N1CCOCC1	ZINC000819455338	GF	On-Demand	Anodyne	CYP3A4	56	43
COc1cc(NCCC(=O)Nc2ccc(N(C)C)cc2)ccc1Br	ZINC000819455343	GH	On-Demand	Anodyne	ENPP1	60	32
O[C@@H](CCc1ccccc1)CNc1ccc(OCC(F)F)cc1	ZINC000819455376	DH	On-Demand	Anodyne	ADRB2	39	43
O[C@@H](CCc1ccccc1)CNc1ccc(OCC(F)F)cc1	ZINC000819455376	DH	On-Demand	Anodyne	ADRB1	61	45
O[C@@H](CCc1ccccc1)CNc1ccc(OCC(F)F)cc1	ZINC000819455376	DH	On-Demand	Anodyne	ADRB3	44	45
O[C@@H](CCc1ccccc1)CNc1ccc(OCC(F)F)cc1	ZINC000819455376	DH	On-Demand	Anodyne	ABCB1	24	41
O[C@@H](CCc1ccccc1)CNc1ccc(OCC(F)F)cc1	ZINC000819455376	DH	On-Demand	Anodyne	PDS	45	36
O[C@H](CCc1ccccc1)CNc1ccc(OCC(F)F)cc1	ZINC000819455377	DH	On-Demand	Anodyne	ADRB2	39	43
O[C@H](CCc1ccccc1)CNc1ccc(OCC(F)F)cc1	ZINC000819455377	DH	On-Demand	Anodyne	ADRB1	61	45
O[C@H](CCc1ccccc1)CNc1ccc(OCC(F)F)cc1	ZINC000819455377	DH	On-Demand	Anodyne	ADRB3	44	45
O[C@H](CCc1ccccc1)CNc1ccc(OCC(F)F)cc1	ZINC000819455377	DH	On-Demand	Anodyne	ABCB1	24	41
O[C@H](CCc1ccccc1)CNc1ccc(OCC(F)F)cc1	ZINC000819455377	DH	On-Demand	Anodyne	PDS	45	36
COCCNC(=O)c1ccccc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000819455382	GF	On-Demand	Bother	KCNMA1	50	44
COCCNC(=O)c1ccccc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000819455382	GF	On-Demand	Bother	ALPL	26	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455387	FG	On-Demand	Bother	ADRB2	33	50
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455387	FG	On-Demand	Bother	ADRB1	54	50
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455387	FG	On-Demand	Bother	ADRB3	37	50
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455387	FG	On-Demand	Bother	ACR	16	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455387	FG	On-Demand	Bother	PDS	44	47
CCOc1ccc(C(=O)N2CCCCC2)cc1NCCS(=O)(=O)CC	ZINC000819455390	FF	On-Demand	Anodyne	HCN1	40	31
CCOc1ccc(C(=O)N2CCCCC2)cc1NCCS(=O)(=O)CC	ZINC000819455390	FF	On-Demand	Anodyne	L3MBTL3	46	35
COCCNC(=O)c1ccccc1NC(=O)CC12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2	ZINC000819455393	II	On-Demand	Anodyne	P2RX7	21	48
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)CCC(C)C	ZINC000819455398	FH	On-Demand	Anodyne	HPGD	40	39
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)CCC(C)C	ZINC000819455399	FH	On-Demand	Anodyne	HPGD	40	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000819455400	FF	On-Demand	Anodyne	GRIN2B	50	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000819455400	FF	On-Demand	Anodyne	CHRNA7	51	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000819455400	FF	On-Demand	Anodyne	C3AR1	44	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCC(Cc2cccnc2)CC1	ZINC000819455400	FF	On-Demand	Anodyne	ACHP_LYMST	26	43
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cccc(C)c1	ZINC000819455405	FF	On-Demand	Anodyne	ADRB2	21	51
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cccc(C)c1	ZINC000819455405	FF	On-Demand	Anodyne	ADRB1	29	48
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cccc(C)c1	ZINC000819455405	FF	On-Demand	Anodyne	PDS	42	40
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819455406	FF	On-Demand	Anodyne	ADRB2	21	51
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819455406	FF	On-Demand	Anodyne	ADRB1	29	48
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819455406	FF	On-Demand	Anodyne	PDS	42	40
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cc(C)ccc1C	ZINC000819455407	GG	On-Demand	Anodyne	ADRB2	16	42
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cc(C)ccc1C	ZINC000819455407	GG	On-Demand	Anodyne	ADRB1	40	32
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cc(C)ccc1C	ZINC000819455408	GG	On-Demand	Anodyne	ADRB2	16	42
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cc(C)ccc1C	ZINC000819455408	GG	On-Demand	Anodyne	ADRB1	40	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)C(F)(F)F	ZINC000819455413	FG	On-Demand	Anodyne	MLYCD	18	40
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)C(F)(F)F	ZINC000819455413	FG	On-Demand	Anodyne	HPGD	38	40
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)C(F)(F)F	ZINC000819455414	FG	On-Demand	Anodyne	MLYCD	18	40
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)C(F)(F)F	ZINC000819455414	FG	On-Demand	Anodyne	HPGD	38	40
COCCCOc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819455417	EH	On-Demand	Anodyne	ADRB2	21	48
COCCCOc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819455417	EH	On-Demand	Anodyne	ADRB1	38	43
COCCCOc1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819455417	EH	On-Demand	Anodyne	ADRB3	53	43
COCCCOc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819455418	EH	On-Demand	Anodyne	ADRB2	21	48
COCCCOc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819455418	EH	On-Demand	Anodyne	ADRB1	38	43
COCCCOc1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819455418	EH	On-Demand	Anodyne	ADRB3	53	43
COCCNC(=O)c1ccccc1NC(=O)CCS(=O)(=O)c1ccc(Cl)cc1	ZINC000819455426	HF	On-Demand	Anodyne	PRTN3	48	40
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819455427	GF	On-Demand	Mild	ADRB1	48	33
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819455428	GF	On-Demand	Mild	ADRB1	48	33
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)c1ccccc1F	ZINC000819455431	GH	On-Demand	Anodyne	HCN1	48	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)c1ccccc1F	ZINC000819455431	GH	On-Demand	Anodyne	HCN4	41	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)c1ccccc1F	ZINC000819455432	GH	On-Demand	Anodyne	HCN1	48	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)c1ccccc1F	ZINC000819455432	GH	On-Demand	Anodyne	HCN4	41	32
COCCc1nc2cc(NC[C@H](O)c3cccnc3)ccc2o1	ZINC000819455435	DF	On-Demand	Anodyne	ADRB1	21	47
COCCc1nc2cc(NC[C@H](O)c3cccnc3)ccc2o1	ZINC000819455435	DF	On-Demand	Anodyne	ADRB3	80	47
COCCc1nc2cc(NC[C@@H](O)c3cccnc3)ccc2o1	ZINC000819455436	DF	On-Demand	Anodyne	ADRB1	21	47
COCCc1nc2cc(NC[C@@H](O)c3cccnc3)ccc2o1	ZINC000819455436	DF	On-Demand	Anodyne	ADRB3	80	47
COCCc1nc2cc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)ccc2o1	ZINC000819455437	FG	On-Demand	Bother	CACNA1D	56	34
COCCc1nc2cc(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)ccc2o1	ZINC000819455438	FG	On-Demand	Bother	CACNA1D	56	34
O[C@@H](CNc1ccc(CCC(F)(F)F)cc1)c1cccnc1	ZINC000819455452	DH	On-Demand	Anodyne	ADRB2	35	48
O[C@@H](CNc1ccc(CCC(F)(F)F)cc1)c1cccnc1	ZINC000819455452	DH	On-Demand	Anodyne	ADRB1	30	45
O[C@@H](CNc1ccc(CCC(F)(F)F)cc1)c1cccnc1	ZINC000819455452	DH	On-Demand	Anodyne	ADRB3	110	49
O[C@H](CNc1ccc(CCC(F)(F)F)cc1)c1cccnc1	ZINC000819455453	DH	On-Demand	Anodyne	ADRB2	35	48
O[C@H](CNc1ccc(CCC(F)(F)F)cc1)c1cccnc1	ZINC000819455453	DH	On-Demand	Anodyne	ADRB1	30	45
O[C@H](CNc1ccc(CCC(F)(F)F)cc1)c1cccnc1	ZINC000819455453	DH	On-Demand	Anodyne	ADRB3	110	49
COC(=O)c1ccc2c(c1)CN(C(=O)C(F)=C1CCC1)CC2	ZINC000819455456	DF	On-Demand	Anodyne	HDAC6	42	43
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1Cl	ZINC000819455472	GG	On-Demand	Anodyne	ADRB2	22	49
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1Cl	ZINC000819455472	GG	On-Demand	Anodyne	ADRB1	56	33
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819455473	GG	On-Demand	Anodyne	ADRB2	22	49
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819455473	GG	On-Demand	Anodyne	ADRB1	56	33
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)CC	ZINC000819455477	DF	On-Demand	Anodyne	HCN1	40	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)CC	ZINC000819455477	DF	On-Demand	Anodyne	HCN4	40	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)CC	ZINC000819455477	DF	On-Demand	Anodyne	L3MBTL3	46	35
CCOc1ccc(C(=O)N2CCCCC2)cc1NCC(C)(C)O	ZINC000819455480	DF	On-Demand	Anodyne	MLYCD	17	40
CCOc1ccc(C(=O)N2CCCCC2)cc1NCC(C)(C)O	ZINC000819455480	DF	On-Demand	Anodyne	HCN1	50	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NCC(C)(C)O	ZINC000819455480	DF	On-Demand	Anodyne	HCN4	44	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NCC(C)(C)O	ZINC000819455480	DF	On-Demand	Anodyne	L3MBTL3	59	36
CCOc1ccc(C(=O)N2CCCCC2)cc1NCC(C)(C)O	ZINC000819455480	DF	On-Demand	Anodyne	HPGD	38	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455488	FG	On-Demand	Bother	ADRB2	33	50
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455488	FG	On-Demand	Bother	ADRB1	54	50
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455488	FG	On-Demand	Bother	ADRB3	37	50
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455488	FG	On-Demand	Bother	ACR	16	40
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455488	FG	On-Demand	Bother	PDS	44	47
COCCNC(=O)c1ccccc1NC(=O)c1ccc(N(C)C)cc1	ZINC000819455491	EE	On-Demand	Anodyne	ECR	51	36
COCCNC(=O)c1ccccc1NC(=O)c1ccc(N(C)C)cc1	ZINC000819455491	EE	On-Demand	Anodyne	NR1H4	17	42
COCCNC(=O)c1ccccc1NC(=O)c1ccc(N(C)C)cc1	ZINC000819455491	EE	On-Demand	Anodyne	HDAC1	24	43
COCCNC(=O)c1ccccc1NC(=O)c1ccc(N(C)C)cc1	ZINC000819455491	EE	On-Demand	Anodyne	HDAC2	16	40
COCCNC(=O)c1ccccc1NC(=O)c1ccc(N(C)C)cc1	ZINC000819455491	EE	On-Demand	Anodyne	KCNK3	21	46
O[C@H](CNc1ccc(OCC(F)F)cc1)CN1CCc2ccccc2C1	ZINC000819455492	FG	On-Demand	Anodyne	NOD2	45	40
O[C@@H](CNc1ccc(OCC(F)F)cc1)CN1CCc2ccccc2C1	ZINC000819455493	FG	On-Demand	Anodyne	NOD2	45	40
O=C(COc1ccccc1NC[C@@H](O)c1cccc(F)c1)N1CCOCC1	ZINC000819455506	FE	On-Demand	Anodyne	CYP3A4	45	35
O=C(COc1ccccc1NC[C@H](O)c1cccc(F)c1)N1CCOCC1	ZINC000819455507	FE	On-Demand	Anodyne	CYP3A4	45	35
Cc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1N1CCOC1=O	ZINC000819455510	GH	On-Demand	Anodyne	P2RY1	34	40
Cc1ccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1N1CCOC1=O	ZINC000819455510	GH	On-Demand	Anodyne	CTSS	17	40
Cc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1N1CCOC1=O	ZINC000819455511	GH	On-Demand	Anodyne	P2RY1	34	40
Cc1ccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1N1CCOC1=O	ZINC000819455511	GH	On-Demand	Anodyne	CTSS	17	40
O=C1CCc2cc(OC[C@@H](O)CNc3ccc(OCC(F)F)cc3)ccc2N1	ZINC000819455520	GG	On-Demand	Anodyne	ADRB1	41	42
O=C1CCc2cc(OC[C@H](O)CNc3ccc(OCC(F)F)cc3)ccc2N1	ZINC000819455521	GG	On-Demand	Anodyne	ADRB1	41	42
O[C@H](CNc1ccc(OCC(F)F)cc1)Cc1ccc(F)cc1	ZINC000819455531	EG	On-Demand	Anodyne	ADRB2	32	45
O[C@H](CNc1ccc(OCC(F)F)cc1)Cc1ccc(F)cc1	ZINC000819455531	EG	On-Demand	Anodyne	ADRB1	56	45
O[C@H](CNc1ccc(OCC(F)F)cc1)Cc1ccc(F)cc1	ZINC000819455531	EG	On-Demand	Anodyne	GRIN1	21	47
O[C@H](CNc1ccc(OCC(F)F)cc1)Cc1ccc(F)cc1	ZINC000819455531	EG	On-Demand	Anodyne	ADRB3	38	45
O[C@@H](CNc1ccc(OCC(F)F)cc1)Cc1ccc(F)cc1	ZINC000819455532	EG	On-Demand	Anodyne	ADRB2	32	45
O[C@@H](CNc1ccc(OCC(F)F)cc1)Cc1ccc(F)cc1	ZINC000819455532	EG	On-Demand	Anodyne	ADRB1	56	45
O[C@@H](CNc1ccc(OCC(F)F)cc1)Cc1ccc(F)cc1	ZINC000819455532	EG	On-Demand	Anodyne	GRIN1	21	47
O[C@@H](CNc1ccc(OCC(F)F)cc1)Cc1ccc(F)cc1	ZINC000819455532	EG	On-Demand	Anodyne	ADRB3	38	45
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455533	FF	On-Demand	Anodyne	ADRB2	26	40
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455533	FF	On-Demand	Anodyne	ADRB1	20	40
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455534	FF	On-Demand	Anodyne	ADRB2	26	40
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455534	FF	On-Demand	Anodyne	ADRB1	20	40
O[C@@H](CNc1ccc(OCc2ccccn2)c(F)c1)CN1CCOCC1	ZINC000819455535	FD	On-Demand	Anodyne	ERBB2	30	41
O[C@H](CNc1ccc(OCc2ccccn2)c(F)c1)CN1CCOCC1	ZINC000819455536	FD	On-Demand	Anodyne	ERBB2	30	41
O=C(COc1ccccc1NCC1(O)CCCCC1)N1CCOCC1	ZINC000819455537	EE	On-Demand	Anodyne	HCN1	54	33
O=C(COc1ccccc1NCC1(O)CCCCC1)N1CCOCC1	ZINC000819455537	EE	On-Demand	Anodyne	HCN4	50	32
O[C@H](CNc1ccc(OCC(F)F)cc1)Cc1ccccc1	ZINC000819455540	DG	On-Demand	Anodyne	ADRB2	40	43
O[C@H](CNc1ccc(OCC(F)F)cc1)Cc1ccccc1	ZINC000819455540	DG	On-Demand	Anodyne	ADRB1	63	44
O[C@H](CNc1ccc(OCC(F)F)cc1)Cc1ccccc1	ZINC000819455540	DG	On-Demand	Anodyne	ADRB3	45	44
O[C@H](CNc1ccc(OCC(F)F)cc1)Cc1ccccc1	ZINC000819455540	DG	On-Demand	Anodyne	PDS	68	38
O[C@@H](CNc1ccc(OCC(F)F)cc1)Cc1ccccc1	ZINC000819455541	DG	On-Demand	Anodyne	ADRB2	40	43
O[C@@H](CNc1ccc(OCC(F)F)cc1)Cc1ccccc1	ZINC000819455541	DG	On-Demand	Anodyne	ADRB1	63	44
O[C@@H](CNc1ccc(OCC(F)F)cc1)Cc1ccccc1	ZINC000819455541	DG	On-Demand	Anodyne	ADRB3	45	44
O[C@@H](CNc1ccc(OCC(F)F)cc1)Cc1ccccc1	ZINC000819455541	DG	On-Demand	Anodyne	PDS	68	38
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819455550	GH	On-Demand	Anodyne	ADRB2	42	41
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819455550	GH	On-Demand	Anodyne	ADRB1	61	37
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819455554	GH	On-Demand	Anodyne	ADRB2	42	41
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2C(F)(F)F)cc1	ZINC000819455554	GH	On-Demand	Anodyne	ADRB1	61	37
CCC(CC)C(=O)Nc1ccccc1C(=O)NCCOC	ZINC000819455565	CE	On-Demand	Anodyne	HCN1	46	30
COCCNC(=O)c1ccccc1NC(=O)c1cccc(C)c1C	ZINC000819455576	EF	On-Demand	Anodyne	ECR	16	41
COCCNC(=O)c1ccccc1NC(=O)c1cccc(C)c1C	ZINC000819455576	EF	On-Demand	Anodyne	KCNK3	42	35
COCCNC(=O)c1ccccc1NC(=O)c1cccc(C)c1C	ZINC000819455576	EF	On-Demand	Anodyne	KCNK9	41	35
CC(C)(C)OC(=O)N1CCc2c(NC[C@H](O)COc3ccccc3)cccc21	ZINC000819455589	GH	On-Demand	Anodyne	ADRB2	35	43
CC(C)(C)OC(=O)N1CCc2c(NC[C@H](O)COc3ccccc3)cccc21	ZINC000819455589	GH	On-Demand	Anodyne	ADRB1	48	37
CC(C)(C)OC(=O)N1CCc2c(NC[C@H](O)COc3ccccc3)cccc21	ZINC000819455589	GH	On-Demand	Anodyne	ABCB1	38	41
CC(C)(C)OC(=O)N1CCc2c(NC[C@@H](O)COc3ccccc3)cccc21	ZINC000819455594	GH	On-Demand	Anodyne	ADRB2	35	43
CC(C)(C)OC(=O)N1CCc2c(NC[C@@H](O)COc3ccccc3)cccc21	ZINC000819455594	GH	On-Demand	Anodyne	ADRB1	48	37
CC(C)(C)OC(=O)N1CCc2c(NC[C@@H](O)COc3ccccc3)cccc21	ZINC000819455594	GH	On-Demand	Anodyne	ABCB1	38	41
C[C@@H](CNc1cccc2c1CCN2C(=O)OC(C)(C)C)S(C)(=O)=O	ZINC000819455599	FF	On-Demand	Anodyne	GPR119	23	42
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1Cl	ZINC000819455604	FH	On-Demand	Anodyne	ADRB2	51	45
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1Cl	ZINC000819455604	FH	On-Demand	Anodyne	ADRB1	74	42
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1Cl	ZINC000819455604	FH	On-Demand	Anodyne	GRIN1	27	44
O[C@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1Cl	ZINC000819455604	FH	On-Demand	Anodyne	ADRB3	38	42
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1Cl	ZINC000819455606	FH	On-Demand	Anodyne	ADRB2	51	45
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1Cl	ZINC000819455606	FH	On-Demand	Anodyne	ADRB1	74	42
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1Cl	ZINC000819455606	FH	On-Demand	Anodyne	GRIN1	27	44
O[C@@H](CNc1ccc(OCC(F)F)cc1)COc1ccccc1Cl	ZINC000819455606	FH	On-Demand	Anodyne	ADRB3	38	42
O[C@H](CNc1ccc(OCC(F)F)cc1)COCc1cccs1	ZINC000819455608	EG	On-Demand	Anodyne	ADRB2	24	41
O[C@H](CNc1ccc(OCC(F)F)cc1)COCc1cccs1	ZINC000819455608	EG	On-Demand	Anodyne	ADRB1	40	45
O[C@H](CNc1ccc(OCC(F)F)cc1)COCc1cccs1	ZINC000819455608	EG	On-Demand	Anodyne	ADRB3	26	45
CC(C)(O)COc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819455642	EH	On-Demand	Anodyne	ADRB1	29	42
CC(C)(O)COc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819455642	EH	On-Demand	Anodyne	MAOB	24	45
CC(C)(O)COc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819455642	EH	On-Demand	Anodyne	GRIN1	21	47
CC(C)(O)COc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819455642	EH	On-Demand	Anodyne	ADRB3	29	42
CC(C)(O)COc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819455642	EH	On-Demand	Anodyne	PDS	42	36
CC(C)(O)COc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819455643	EH	On-Demand	Anodyne	ADRB1	29	42
CC(C)(O)COc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819455643	EH	On-Demand	Anodyne	MAOB	24	45
CC(C)(O)COc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819455643	EH	On-Demand	Anodyne	GRIN1	21	47
CC(C)(O)COc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819455643	EH	On-Demand	Anodyne	ADRB3	29	42
CC(C)(O)COc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1	ZINC000819455643	EH	On-Demand	Anodyne	PDS	42	36
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819455649	GE	On-Demand	Anodyne	GRIN1	17	50
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819455650	GE	On-Demand	Anodyne	GRIN1	17	50
CC(C)(O)COc1ccc(NC[C@@H](O)COCc2ccccc2)cc1	ZINC000819455682	EF	On-Demand	Anodyne	ADRB1	48	38
CC(C)(O)COc1ccc(NC[C@@H](O)COCc2ccccc2)cc1	ZINC000819455682	EF	On-Demand	Anodyne	CASR	21	49
CC(C)(O)COc1ccc(NC[C@H](O)COCc2ccccc2)cc1	ZINC000819455684	EF	On-Demand	Anodyne	ADRB1	48	38
CC(C)(O)COc1ccc(NC[C@H](O)COCc2ccccc2)cc1	ZINC000819455684	EF	On-Demand	Anodyne	CASR	21	49
CC(C)(O)COc1ccc(NC[C@H](O)COCc2cccs2)cc1	ZINC000819455714	FF	On-Demand	Anodyne	ADRB2	16	43
CC(C)(O)COc1ccc(NC[C@H](O)COCc2cccs2)cc1	ZINC000819455714	FF	On-Demand	Anodyne	ADRB1	23	41
CC(C)(O)COc1ccc(NC[C@@H](O)COCc2cccs2)cc1	ZINC000819455715	FF	On-Demand	Anodyne	ADRB2	16	43
CC(C)(O)COc1ccc(NC[C@@H](O)COCc2cccs2)cc1	ZINC000819455715	FF	On-Demand	Anodyne	ADRB1	23	41
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819455737	FF	On-Demand	Anodyne	ADRB2	24	46
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819455738	FF	On-Demand	Anodyne	ADRB2	24	46
Cc1ccccc1[C@@H](O)CNc1cccc(NC(=O)C2CCCCC2)c1	ZINC000819455743	FJ	On-Demand	Anodyne	EPHX2	17	40
Cc1ccccc1[C@@H](O)CNc1cccc(NC(=O)C2CCCCC2)c1	ZINC000819455743	FJ	On-Demand	Anodyne	KCNK3	49	53
Cc1ccccc1[C@@H](O)CNc1cccc(NC(=O)C2CCCCC2)c1	ZINC000819455743	FJ	On-Demand	Anodyne	KCNK9	43	33
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1c(C)cccc1C	ZINC000819455745	GG	On-Demand	Anodyne	ADRB2	16	44
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1c(C)cccc1C	ZINC000819455746	GG	On-Demand	Anodyne	ADRB2	16	44
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)Cc1ccccc1	ZINC000819455775	GH	On-Demand	Anodyne	HCN1	48	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)Cc1ccccc1	ZINC000819455775	GH	On-Demand	Anodyne	HCN4	41	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)Cc1ccccc1	ZINC000819455775	GH	On-Demand	Anodyne	L3MBTL3	29	41
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)Cc1ccccc1	ZINC000819455776	GH	On-Demand	Anodyne	HCN1	48	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)Cc1ccccc1	ZINC000819455776	GH	On-Demand	Anodyne	HCN4	41	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)Cc1ccccc1	ZINC000819455776	GH	On-Demand	Anodyne	L3MBTL3	29	41
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H]1c1ncc[nH]1	ZINC000819455780	DD	On-Demand	Anodyne	HTR1D	47	37
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@H]1c1ncc[nH]1	ZINC000819455780	DD	On-Demand	Anodyne	HTR1B	40	37
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H]1c1ncc[nH]1	ZINC000819455781	DD	On-Demand	Anodyne	HTR1D	47	37
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC[C@@H]1c1ncc[nH]1	ZINC000819455781	DD	On-Demand	Anodyne	HTR1B	40	37
CN(C)C(=O)NCCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819455783	FC	On-Demand	Mild	PAPA1_CARPA	48	57
CN(C)C(=O)NCCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819455783	FC	On-Demand	Mild	CTSK	20	54
O[C@@H](CNc1ccc(OCC(F)F)cc1)COCc1cccs1	ZINC000819455788	EG	On-Demand	Anodyne	ADRB2	24	41
O[C@@H](CNc1ccc(OCC(F)F)cc1)COCc1cccs1	ZINC000819455788	EG	On-Demand	Anodyne	ADRB1	40	45
O[C@@H](CNc1ccc(OCC(F)F)cc1)COCc1cccs1	ZINC000819455788	EG	On-Demand	Anodyne	ADRB3	26	45
COC(=O)C1(O)CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819455802	GD	On-Demand	Mild	GHRHR	40	34
COC(=O)C1(O)CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819455802	GD	On-Demand	Mild	PAPA1_CARPA	34	44
COC(=O)C1(O)CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819455803	GD	On-Demand	Mild	GHRHR	40	34
COC(=O)C1(O)CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819455803	GD	On-Demand	Mild	PAPA1_CARPA	34	44
O[C@@H](CNc1ccc(OCC(F)F)cc1)COCc1ccccc1Cl	ZINC000819455804	FH	On-Demand	Anodyne	ADRB2	23	41
O[C@@H](CNc1ccc(OCC(F)F)cc1)COCc1ccccc1Cl	ZINC000819455804	FH	On-Demand	Anodyne	ADRB1	36	45
O[C@@H](CNc1ccc(OCC(F)F)cc1)COCc1ccccc1Cl	ZINC000819455804	FH	On-Demand	Anodyne	GRIN1	22	46
O[C@@H](CNc1ccc(OCC(F)F)cc1)COCc1ccccc1Cl	ZINC000819455804	FH	On-Demand	Anodyne	ADRB3	26	45
O[C@H](CNc1ccc(OCC(F)F)cc1)COCc1ccccc1Cl	ZINC000819455805	FH	On-Demand	Anodyne	ADRB2	23	41
O[C@H](CNc1ccc(OCC(F)F)cc1)COCc1ccccc1Cl	ZINC000819455805	FH	On-Demand	Anodyne	ADRB1	36	45
O[C@H](CNc1ccc(OCC(F)F)cc1)COCc1ccccc1Cl	ZINC000819455805	FH	On-Demand	Anodyne	GRIN1	22	46
O[C@H](CNc1ccc(OCC(F)F)cc1)COCc1ccccc1Cl	ZINC000819455805	FH	On-Demand	Anodyne	ADRB3	26	45
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455807	GG	On-Demand	Anodyne	ADRB2	52	66
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455807	GG	On-Demand	Anodyne	ADRB1	81	66
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455807	GG	On-Demand	Anodyne	GRIN1	28	40
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455807	GG	On-Demand	Anodyne	ADRB3	50	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455808	GG	On-Demand	Anodyne	ADRB2	52	66
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455808	GG	On-Demand	Anodyne	ADRB1	81	66
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455808	GG	On-Demand	Anodyne	GRIN1	28	40
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)cc1	ZINC000819455808	GG	On-Demand	Anodyne	ADRB3	50	56
O[C@@H](CNc1ccc(OCC(F)F)cc1)COCc1ccccc1F	ZINC000819455809	FG	On-Demand	Anodyne	ADRB1	41	39
O[C@H](CNc1ccc(OCC(F)F)cc1)COCc1ccccc1F	ZINC000819455810	FG	On-Demand	Anodyne	ADRB1	41	39
CN(C[C@H](O)CNc1ccc(OCC(F)F)cc1)C(=O)OC(C)(C)C	ZINC000819455811	FF	On-Demand	Anodyne	ADRB1	18	40
CN(C[C@@H](O)CNc1ccc(OCC(F)F)cc1)C(=O)OC(C)(C)C	ZINC000819455812	FF	On-Demand	Anodyne	ADRB1	18	40
O[C@@H](CNc1ccc(OCC(F)F)cc1)c1cccc(Cl)c1	ZINC000819455821	EI	On-Demand	Anodyne	ADRB2	20	48
O[C@@H](CNc1ccc(OCC(F)F)cc1)c1cccc(Cl)c1	ZINC000819455821	EI	On-Demand	Anodyne	ADRB1	39	48
O[C@@H](CNc1ccc(OCC(F)F)cc1)c1cccc(Cl)c1	ZINC000819455821	EI	On-Demand	Anodyne	GRIN1	16	40
O[C@@H](CNc1ccc(OCC(F)F)cc1)c1cccc(Cl)c1	ZINC000819455821	EI	On-Demand	Anodyne	ADRB3	50	48
O[C@@H](CNc1ccc(OCC(F)F)cc1)c1cccc(Cl)c1	ZINC000819455821	EI	On-Demand	Anodyne	PDS	44	39
O[C@H](CNc1ccc(OCC(F)F)cc1)c1cccc(Cl)c1	ZINC000819455822	EI	On-Demand	Anodyne	ADRB2	20	48
O[C@H](CNc1ccc(OCC(F)F)cc1)c1cccc(Cl)c1	ZINC000819455822	EI	On-Demand	Anodyne	ADRB1	39	48
O[C@H](CNc1ccc(OCC(F)F)cc1)c1cccc(Cl)c1	ZINC000819455822	EI	On-Demand	Anodyne	GRIN1	16	40
O[C@H](CNc1ccc(OCC(F)F)cc1)c1cccc(Cl)c1	ZINC000819455822	EI	On-Demand	Anodyne	ADRB3	50	48
O[C@H](CNc1ccc(OCC(F)F)cc1)c1cccc(Cl)c1	ZINC000819455822	EI	On-Demand	Anodyne	PDS	44	39
COCCNC(=O)c1ccccc1NC(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819455823	IH	On-Demand	Anodyne	KIT	17	43
COCCNC(=O)c1ccccc1NC(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819455823	IH	On-Demand	Anodyne	PRS	26	41
COCCNC(=O)c1ccccc1NC(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819455823	IH	On-Demand	Anodyne	ACACB	15	57
COCCNC(=O)c1ccccc1NC(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819455823	IH	On-Demand	Anodyne	ROCK1	25	41
COCCNC(=O)c1ccccc1NC(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819455823	IH	On-Demand	Anodyne	TACR3	34	53
COCCNC(=O)c1ccccc1NC(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819455823	IH	On-Demand	Anodyne	ROCK2	22	41
COCCNC(=O)c1ccccc1NC(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819455823	IH	On-Demand	Anodyne	MT-CO2	50	40
COCCNC(=O)c1ccccc1NC(=O)c1cc(-c2ccncc2)nc2ccccc12	ZINC000819455823	IH	On-Demand	Anodyne	POLR1A	60	38
COCCNC(=O)c1ccccc1NC(=O)c1c(F)cccc1F	ZINC000819455827	EF	On-Demand	Anodyne	KCNK3	46	34
COCCNC(=O)c1ccccc1NC(=O)c1c(F)cccc1F	ZINC000819455827	EF	On-Demand	Anodyne	POLR1A	45	35
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455843	FG	On-Demand	Anodyne	ADRB2	48	46
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455843	FG	On-Demand	Anodyne	ADRB1	76	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455843	FG	On-Demand	Anodyne	GRIN1	25	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455843	FG	On-Demand	Anodyne	ADRB3	46	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455843	FG	On-Demand	Anodyne	ABCB1	20	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455843	FG	On-Demand	Anodyne	PDS	79	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455844	FG	On-Demand	Anodyne	ADRB2	48	46
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455844	FG	On-Demand	Anodyne	ADRB1	76	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455844	FG	On-Demand	Anodyne	GRIN1	25	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455844	FG	On-Demand	Anodyne	ADRB3	46	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455844	FG	On-Demand	Anodyne	ABCB1	20	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(F)F)cc2)c1	ZINC000819455844	FG	On-Demand	Anodyne	PDS	79	40
O=C(COc1ccccc1NCC1(O)CCCC1)N1CCOCC1	ZINC000819455849	ED	On-Demand	Anodyne	HCN1	52	33
O=C(COc1ccccc1NCC1(O)CCCC1)N1CCOCC1	ZINC000819455849	ED	On-Demand	Anodyne	HCN4	48	31
O[C@@H](CNc1ccc(OCC(F)F)cc1)c1ccc(Cl)cc1	ZINC000819455875	EI	On-Demand	Anodyne	ADRB2	17	42
COCCNC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)N2CCCc3ccccc32)c1	ZINC000819455880	JG	On-Demand	Anodyne	DRD4	43	35
COCCNC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)N2CCCc3ccccc32)c1	ZINC000819455880	JG	On-Demand	Anodyne	AVPR2	28	42
COCCNC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)N2CCCc3ccccc32)c1	ZINC000819455880	JG	On-Demand	Anodyne	CPT1A	32	48
COCCNC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)N2CCCc3ccccc32)c1	ZINC000819455880	JG	On-Demand	Anodyne	PPARD	16	45
COCCNC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)N2CCCc3ccccc32)c1	ZINC000819455880	JG	On-Demand	Anodyne	PRTN3	48	39
COCCNC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)N2CCCc3ccccc32)c1	ZINC000819455880	JG	On-Demand	Anodyne	AKR1C3	57	40
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2F)cc1	ZINC000819455909	EF	On-Demand	Anodyne	ADRB2	48	43
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2F)cc1	ZINC000819455909	EF	On-Demand	Anodyne	ADRB1	67	38
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2F)cc1	ZINC000819455912	EF	On-Demand	Anodyne	ADRB2	48	43
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2F)cc1	ZINC000819455912	EF	On-Demand	Anodyne	ADRB1	67	38
CC(C)(O)COc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819455916	GH	On-Demand	Anodyne	ADRB2	34	42
CC(C)(O)COc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819455916	GH	On-Demand	Anodyne	ADRB1	46	41
CC(C)(O)COc1ccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819455916	GH	On-Demand	Anodyne	PDS	54	46
O[C@@H](CNc1ccc(OCC(F)F)cc1)c1ccccc1	ZINC000819455918	CG	On-Demand	Anodyne	ADRB2	31	51
O[C@@H](CNc1ccc(OCC(F)F)cc1)c1ccccc1	ZINC000819455918	CG	On-Demand	Anodyne	ADRB1	38	40
O[C@@H](CNc1ccc(OCC(F)F)cc1)c1ccccc1	ZINC000819455918	CG	On-Demand	Anodyne	AOC3	17	43
CC(C)(O)COc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819455919	GH	On-Demand	Anodyne	ADRB2	34	42
CC(C)(O)COc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819455919	GH	On-Demand	Anodyne	ADRB1	46	41
CC(C)(O)COc1ccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)cc1	ZINC000819455919	GH	On-Demand	Anodyne	PDS	54	46
CC(C)(C)OC(=O)N1CCc2c(NCCC(=O)Nc3ccccc3)cccc21	ZINC000819455920	GI	On-Demand	Anodyne	KCNQ2	56	35
O[C@H](CNc1ccc(OCC(F)F)cc1)c1ccccc1	ZINC000819455922	CG	On-Demand	Anodyne	ADRB2	31	51
O[C@H](CNc1ccc(OCC(F)F)cc1)c1ccccc1	ZINC000819455922	CG	On-Demand	Anodyne	ADRB1	38	40
O[C@H](CNc1ccc(OCC(F)F)cc1)c1ccccc1	ZINC000819455922	CG	On-Demand	Anodyne	AOC3	17	43
CC(C)(C)OC(=O)N1CCc2c(NC[C@H](O)C3CC3)cccc21	ZINC000819455930	DG	On-Demand	Anodyne	GPR119	20	40
CC(C)(C)OC(=O)N1CCc2c(NC[C@@H](O)C3CC3)cccc21	ZINC000819455931	DG	On-Demand	Anodyne	GPR119	20	40
CC(C)(C)OC(=O)N1CCc2c(NC[C@H](O)c3ccc(F)c(F)c3)cccc21	ZINC000819455959	GI	On-Demand	Anodyne	KCNQ2	45	41
CC(C)(C)OC(=O)N1CCc2c(NC[C@@H](O)c3ccc(F)c(F)c3)cccc21	ZINC000819455960	GI	On-Demand	Anodyne	KCNQ2	45	41
C[C@@H](OC[C@H](O)CNc1ccc(OCC(C)(C)O)cc1)c1ccc(Cl)cc1	ZINC000819455969	GI	On-Demand	Anodyne	CASR	15	40
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)C1CC1	ZINC000819455992	EF	On-Demand	Anodyne	HCN1	41	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)C1CC1	ZINC000819455992	EF	On-Demand	Anodyne	HCN4	41	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)C1CC1	ZINC000819455992	EF	On-Demand	Anodyne	L3MBTL3	75	37
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)C1CC1	ZINC000819455992	EF	On-Demand	Anodyne	HPGD	45	38
Cc1ccc(OC[C@@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819455993	EF	On-Demand	Anodyne	ADRB2	46	56
Cc1ccc(OC[C@@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819455993	EF	On-Demand	Anodyne	ADRB1	56	47
Cc1ccc(OC[C@@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819455993	EF	On-Demand	Anodyne	ADRB3	33	43
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)C1CC1	ZINC000819455994	EF	On-Demand	Anodyne	HCN1	41	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)C1CC1	ZINC000819455994	EF	On-Demand	Anodyne	HCN4	41	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)C1CC1	ZINC000819455994	EF	On-Demand	Anodyne	L3MBTL3	75	37
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)C1CC1	ZINC000819455994	EF	On-Demand	Anodyne	HPGD	45	38
Cc1ccc(OC[C@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819455995	EF	On-Demand	Anodyne	ADRB2	46	56
Cc1ccc(OC[C@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819455995	EF	On-Demand	Anodyne	ADRB1	56	47
Cc1ccc(OC[C@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819455995	EF	On-Demand	Anodyne	ADRB3	33	43
O[C@@H](CNc1ccc(CCC(F)(F)F)cc1)c1ccccc1	ZINC000819455997	DI	On-Demand	Anodyne	ADRB2	28	66
O[C@@H](CNc1ccc(CCC(F)(F)F)cc1)c1ccccc1	ZINC000819455997	DI	On-Demand	Anodyne	ADRB1	27	50
O[C@@H](CNc1ccc(CCC(F)(F)F)cc1)c1ccccc1	ZINC000819455997	DI	On-Demand	Anodyne	ADRB3	57	47
O[C@H](CNc1ccc(CCC(F)(F)F)cc1)c1ccccc1	ZINC000819455999	DI	On-Demand	Anodyne	ADRB2	28	66
O[C@H](CNc1ccc(CCC(F)(F)F)cc1)c1ccccc1	ZINC000819455999	DI	On-Demand	Anodyne	ADRB1	27	50
O[C@H](CNc1ccc(CCC(F)(F)F)cc1)c1ccccc1	ZINC000819455999	DI	On-Demand	Anodyne	ADRB3	57	47
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1ccccc1	ZINC000819456001	EF	On-Demand	Anodyne	ADRB3	33	42
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1ccccc1	ZINC000819456003	EF	On-Demand	Anodyne	ADRB3	33	42
CON(C)C(=O)CCNc1cccc(NC(=O)C2CCCCC2)c1	ZINC000819456013	EG	On-Demand	Anodyne	EPHX2	15	42
CON(C)C(=O)CCNc1cccc(NC(=O)C2CCCCC2)c1	ZINC000819456013	EG	On-Demand	Anodyne	KCNK3	29	50
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)CN(C)C1CC1	ZINC000819456015	GF	On-Demand	Anodyne	L3MBTL3	50	35
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)CN(C)C1CC1	ZINC000819456017	GF	On-Demand	Anodyne	L3MBTL3	50	35
Cc1ccccc1[C@@H](CO)NC(=O)C(F)=C1CCC1	ZINC000819456023	CF	On-Demand	Anodyne	CTSA	55	35
Cc1ccccc1[C@H](CO)NC(=O)C(F)=C1CCC1	ZINC000819456025	CF	On-Demand	Anodyne	CTSA	55	35
COCCNC(=O)c1ccccc1NC(=O)CCOc1cccc(C)c1	ZINC000819456046	FF	On-Demand	Anodyne	MTNR1A	21	41
COCCNC(=O)c1ccccc1NC(=O)CCOc1cccc(C)c1	ZINC000819456046	FF	On-Demand	Anodyne	MTNR1B	19	41
COCCNC(=O)c1ccccc1NC(=O)CCOc1cccc(C)c1	ZINC000819456046	FF	On-Demand	Anodyne	KCNK3	43	35
COCCNC(=O)c1ccccc1NC(=O)CCOc1cccc(C)c1	ZINC000819456046	FF	On-Demand	Anodyne	KCNK9	40	35
COCCCOc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819456047	DG	On-Demand	Anodyne	ADRB2	24	40
COCCCOc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819456047	DG	On-Demand	Anodyne	AOC3	15	42
COCCCOc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819456048	DG	On-Demand	Anodyne	ADRB2	24	40
COCCCOc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819456048	DG	On-Demand	Anodyne	AOC3	15	42
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819456049	FG	On-Demand	Anodyne	MLYCD	19	44
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819456049	FG	On-Demand	Anodyne	L3MBTL3	40	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@](C)(O)C(F)(F)F	ZINC000819456049	FG	On-Demand	Anodyne	HPGD	38	41
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819456050	FG	On-Demand	Anodyne	MLYCD	19	44
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819456050	FG	On-Demand	Anodyne	L3MBTL3	40	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@](C)(O)C(F)(F)F	ZINC000819456050	FG	On-Demand	Anodyne	HPGD	38	41
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(CCC(F)(F)F)cc2)cc1	ZINC000819456070	GH	On-Demand	Anodyne	ADRB2	20	44
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(CCC(F)(F)F)cc2)cc1	ZINC000819456070	GH	On-Demand	Anodyne	ADRB3	46	38
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(CCC(F)(F)F)cc2)cc1	ZINC000819456070	GH	On-Demand	Anodyne	CTSF	48	35
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(CCC(F)(F)F)cc2)cc1	ZINC000819456071	GH	On-Demand	Anodyne	ADRB2	20	44
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(CCC(F)(F)F)cc2)cc1	ZINC000819456071	GH	On-Demand	Anodyne	ADRB3	46	38
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(CCC(F)(F)F)cc2)cc1	ZINC000819456071	GH	On-Demand	Anodyne	CTSF	48	35
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(CCC(F)(F)F)cc2)c1	ZINC000819456081	FI	On-Demand	Bother	ADRB1	15	40
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(CCC(F)(F)F)cc2)c1	ZINC000819456081	FI	On-Demand	Bother	ADRB3	24	40
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(CCC(F)(F)F)cc2)c1	ZINC000819456082	FI	On-Demand	Bother	ADRB1	15	40
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(CCC(F)(F)F)cc2)c1	ZINC000819456082	FI	On-Demand	Bother	ADRB3	24	40
COCCCOc1cccc(NC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819456089	FI	On-Demand	Anodyne	PDS	40	35
COCCCOc1cccc(NC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000819456090	FI	On-Demand	Anodyne	PDS	40	35
O=C(C(F)=C1CCC1)N1CCC(Cc2cccnc2)CC1	ZINC000819456091	CG	On-Demand	Anodyne	GRIN2B	59	41
O=C(C(F)=C1CCC1)N1CCC(Cc2cccnc2)CC1	ZINC000819456091	CG	On-Demand	Anodyne	CHRNA7	52	42
O=C(C(F)=C1CCC1)N1CCC(Cc2cccnc2)CC1	ZINC000819456091	CG	On-Demand	Anodyne	C3AR1	45	44
O=C(C(F)=C1CCC1)N1CCC(Cc2cccnc2)CC1	ZINC000819456091	CG	On-Demand	Anodyne	ACHP_LYMST	28	44
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc(Cl)cc1	ZINC000819456092	GG	On-Demand	Anodyne	ADRB2	22	43
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819456093	GG	On-Demand	Anodyne	ADRB2	22	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)c1ccc(Br)cc1	ZINC000819456094	GF	On-Demand	Anodyne	PAPA1_CARPA	22	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)c1ccc(Br)cc1	ZINC000819456095	GF	On-Demand	Anodyne	PAPA1_CARPA	22	40
COCCCOc1cccc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819456096	EG	On-Demand	Bother	ACR	17	45
COCCCOc1cccc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819456097	EG	On-Demand	Bother	ACR	17	45
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1C	ZINC000819456098	FF	On-Demand	Anodyne	ADRB2	24	52
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1C	ZINC000819456098	FF	On-Demand	Anodyne	ADRB1	60	35
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819456099	FF	On-Demand	Anodyne	ADRB2	24	52
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819456099	FF	On-Demand	Anodyne	ADRB1	60	35
CC(C)(O)COc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819456103	DF	On-Demand	Anodyne	ADRB2	27	50
CC(C)(O)COc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819456103	DF	On-Demand	Anodyne	ADRB3	30	42
CC(C)(O)COc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819456103	DF	On-Demand	Anodyne	LTA4H	16	41
CC(C)(O)COc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819456103	DF	On-Demand	Anodyne	AOC3	19	41
CC(C)(O)COc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819456104	DF	On-Demand	Anodyne	ADRB2	27	50
CC(C)(O)COc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819456104	DF	On-Demand	Anodyne	ADRB3	30	42
CC(C)(O)COc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819456104	DF	On-Demand	Anodyne	LTA4H	16	41
CC(C)(O)COc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819456104	DF	On-Demand	Anodyne	AOC3	19	41
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819456114	GF	On-Demand	Anodyne	ADRB2	50	63
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819456114	GF	On-Demand	Anodyne	ADRB1	77	63
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819456114	GF	On-Demand	Anodyne	ADRB3	47	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819456115	GF	On-Demand	Anodyne	ADRB2	50	63
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819456115	GF	On-Demand	Anodyne	ADRB1	77	63
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819456115	GF	On-Demand	Anodyne	ADRB3	47	54
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819456116	FG	On-Demand	Anodyne	ADRB2	47	44
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819456116	FG	On-Demand	Anodyne	ADRB1	60	44
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819456116	FG	On-Demand	Anodyne	GRIN1	26	48
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819456116	FG	On-Demand	Anodyne	ADRB3	36	43
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819456116	FG	On-Demand	Anodyne	CDK4	17	42
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819456117	FG	On-Demand	Anodyne	ADRB2	47	44
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819456117	FG	On-Demand	Anodyne	ADRB1	60	44
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819456117	FG	On-Demand	Anodyne	GRIN1	26	48
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819456117	FG	On-Demand	Anodyne	ADRB3	36	43
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1	ZINC000819456117	FG	On-Demand	Anodyne	CDK4	17	42
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819456133	EF	On-Demand	Anodyne	ADRB2	47	45
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819456133	EF	On-Demand	Anodyne	ADRB1	62	43
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819456133	EF	On-Demand	Anodyne	GRIN1	18	47
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819456133	EF	On-Demand	Anodyne	ADRB3	35	42
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819456134	EF	On-Demand	Anodyne	ADRB2	47	45
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819456134	EF	On-Demand	Anodyne	ADRB1	62	43
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819456134	EF	On-Demand	Anodyne	GRIN1	18	47
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819456134	EF	On-Demand	Anodyne	ADRB3	35	42
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819456143	EF	On-Demand	Anodyne	ADRB2	68	53
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819456143	EF	On-Demand	Anodyne	ADRB1	81	47
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819456143	EF	On-Demand	Anodyne	GRIN1	20	42
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819456143	EF	On-Demand	Anodyne	ADRB3	51	47
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819456143	EF	On-Demand	Anodyne	CYP2D6	18	46
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819456143	EF	On-Demand	Anodyne	CDK4	15	41
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819456143	EF	On-Demand	Anodyne	PDS	41	35
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819456144	EF	On-Demand	Anodyne	ADRB2	68	53
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819456144	EF	On-Demand	Anodyne	ADRB1	81	47
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819456144	EF	On-Demand	Anodyne	GRIN1	20	42
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819456144	EF	On-Demand	Anodyne	ADRB3	51	47
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819456144	EF	On-Demand	Anodyne	CYP2D6	18	46
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819456144	EF	On-Demand	Anodyne	CDK4	15	41
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819456144	EF	On-Demand	Anodyne	PDS	41	35
CC(C)(O)COc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819456160	FF	On-Demand	Anodyne	NOD2	46	42
CC(C)(O)COc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819456162	FF	On-Demand	Anodyne	NOD2	46	42
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)C(C)(C)C	ZINC000819456178	EH	On-Demand	Anodyne	HCN1	40	31
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)C(C)(C)C	ZINC000819456178	EH	On-Demand	Anodyne	L3MBTL3	40	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)C(C)(C)C	ZINC000819456178	EH	On-Demand	Anodyne	HPGD	36	41
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)C(C)(C)C	ZINC000819456180	EH	On-Demand	Anodyne	HCN1	40	31
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)C(C)(C)C	ZINC000819456180	EH	On-Demand	Anodyne	L3MBTL3	40	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)C(C)(C)C	ZINC000819456180	EH	On-Demand	Anodyne	HPGD	36	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC=C(c3cccc(C)c3)CC1)C2	ZINC000819456182	FG	On-Demand	Anodyne	ADAM10	41	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC=C(c3cccc(C)c3)CC1)C2	ZINC000819456185	FG	On-Demand	Anodyne	ADAM10	41	46
O=C(Nc1cccc(NC[C@H](O)c2ccccc2F)c1)C1CCCCC1	ZINC000819456203	FI	On-Demand	Anodyne	KCNK3	21	53
CS(=O)(=O)c1ccc([C@@H](O)CNc2cccc(CCC(F)(F)F)c2)cc1	ZINC000819456204	GH	On-Demand	Anodyne	CTSF	48	34
CS(=O)(=O)c1ccc([C@H](O)CNc2cccc(CCC(F)(F)F)c2)cc1	ZINC000819456205	GH	On-Demand	Anodyne	CTSF	48	34
O=C(Nc1cccc(NC[C@@H](O)c2ccccc2F)c1)C1CCCCC1	ZINC000819456207	FI	On-Demand	Anodyne	KCNK3	21	53
COCCNC(=O)c1ccccc1NC(=O)CN1C(=O)[C@H]2CCCC[C@@H]2C1=O	ZINC000819456236	GD	On-Demand	Anodyne	POLR1A	58	36
COCCNC(=O)c1ccccc1NC(=O)CN1C(=O)[C@@H]2CCCC[C@H]2C1=O	ZINC000819456239	GD	On-Demand	Anodyne	POLR1A	58	36
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)CCOC(C)C	ZINC000819456240	GG	On-Demand	Anodyne	HPGD	40	37
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)CCOC(C)C	ZINC000819456241	GG	On-Demand	Anodyne	HPGD	40	37
COCCc1nc2cc(NC[C@H](O)c3cccc(Cl)c3)ccc2o1	ZINC000819456256	EH	On-Demand	Anodyne	ADRB1	22	40
COCCc1nc2cc(NC[C@@H](O)c3cccc(Cl)c3)ccc2o1	ZINC000819456257	EH	On-Demand	Anodyne	ADRB1	22	40
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)c1ccc(F)cc1	ZINC000819456258	GH	On-Demand	Anodyne	HRH3	25	41
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)c1ccc(F)cc1	ZINC000819456258	GH	On-Demand	Anodyne	HCN1	40	31
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)c1ccc(F)cc1	ZINC000819456259	GH	On-Demand	Anodyne	HRH3	25	41
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)c1ccc(F)cc1	ZINC000819456259	GH	On-Demand	Anodyne	HCN1	40	31
COCCCOc1cccc(NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819456268	DH	On-Demand	Anodyne	ADRB2	15	40
COCCCOc1cccc(NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819456269	DH	On-Demand	Anodyne	ADRB2	15	40
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1	ZINC000819456278	FF	On-Demand	Anodyne	ADRB2	39	44
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1	ZINC000819456278	FF	On-Demand	Anodyne	ADRB1	55	39
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1	ZINC000819456278	FF	On-Demand	Anodyne	ABCB1	25	41
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1	ZINC000819456278	FF	On-Demand	Anodyne	PDS	64	36
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1	ZINC000819456279	FF	On-Demand	Anodyne	ADRB2	39	44
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1	ZINC000819456279	FF	On-Demand	Anodyne	ADRB1	55	39
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1	ZINC000819456279	FF	On-Demand	Anodyne	ABCB1	25	41
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1	ZINC000819456279	FF	On-Demand	Anodyne	PDS	64	36
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)c1ccccc1C	ZINC000819456281	GI	On-Demand	Anodyne	HCN1	48	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)c1ccccc1C	ZINC000819456281	GI	On-Demand	Anodyne	HCN4	42	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)c1ccccc1C	ZINC000819456282	GI	On-Demand	Anodyne	HCN1	48	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)c1ccccc1C	ZINC000819456282	GI	On-Demand	Anodyne	HCN4	42	32
COc1cccc([C@H](CO)NC(=O)C(F)=C2CCC2)c1	ZINC000819456291	CE	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@H](CO)NC(=O)C(F)=C2CCC2)c1	ZINC000819456291	CE	On-Demand	Anodyne	MTNR1A	31	40
COc1cccc([C@H](CO)NC(=O)C(F)=C2CCC2)c1	ZINC000819456291	CE	On-Demand	Anodyne	MTNR1B	32	40
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)C1CCCCC1	ZINC000819456300	DG	On-Demand	Anodyne	TYK2	42	36
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)C1CCCCC1	ZINC000819456300	DG	On-Demand	Anodyne	PRMT3	17	40
O=C(Nc1cccc(NC[C@H](O)C2CC2)c1)C1CCCCC1	ZINC000819456300	DG	On-Demand	Anodyne	KCNK3	58	60
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(OC)cc2OC)cc1	ZINC000819456309	GE	On-Demand	Anodyne	ADRB2	36	44
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(OC)cc2OC)cc1	ZINC000819456309	GE	On-Demand	Anodyne	ADRB1	57	40
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(OC)cc2OC)cc1	ZINC000819456309	GE	On-Demand	Anodyne	ADRB3	29	40
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(OC)cc2OC)cc1	ZINC000819456310	GE	On-Demand	Anodyne	ADRB2	36	44
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(OC)cc2OC)cc1	ZINC000819456310	GE	On-Demand	Anodyne	ADRB1	57	40
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(OC)cc2OC)cc1	ZINC000819456310	GE	On-Demand	Anodyne	ADRB3	29	40
CC(C)(O)COc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819456313	EG	On-Demand	Anodyne	ADRB2	32	40
CC(C)(O)COc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819456313	EG	On-Demand	Anodyne	ADRB1	43	39
CC(C)(O)COc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819456313	EG	On-Demand	Anodyne	SCN2A	15	42
CC(C)(O)COc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819456314	EG	On-Demand	Anodyne	ADRB2	32	40
CC(C)(O)COc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819456314	EG	On-Demand	Anodyne	ADRB1	43	39
CC(C)(O)COc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819456314	EG	On-Demand	Anodyne	SCN2A	15	42
CC(C)(C)OC(=O)N1CCc2c(NC[C@@H](O)Cc3ccccc3)cccc21	ZINC000819456320	FH	On-Demand	Anodyne	KCNQ2	48	37
CC(C)(C)OC(=O)N1CCc2c(NC[C@@H](O)Cc3ccccc3)cccc21	ZINC000819456320	FH	On-Demand	Anodyne	FPR1	41	32
CC(C)(C)OC(=O)N1CCc2c(NC[C@H](O)Cc3ccccc3)cccc21	ZINC000819456321	FH	On-Demand	Anodyne	KCNQ2	48	37
CC(C)(C)OC(=O)N1CCc2c(NC[C@H](O)Cc3ccccc3)cccc21	ZINC000819456321	FH	On-Demand	Anodyne	FPR1	41	32
O[C@@H](CNc1cccc(CCC(F)(F)F)c1)c1ccccc1	ZINC000819456332	DI	On-Demand	Anodyne	ADRB2	22	40
O[C@@H](CNc1cccc(CCC(F)(F)F)c1)c1ccccc1	ZINC000819456332	DI	On-Demand	Anodyne	ADRB1	15	40
O[C@H](CNc1cccc(CCC(F)(F)F)c1)c1ccccc1	ZINC000819456333	DI	On-Demand	Anodyne	ADRB2	22	40
O[C@H](CNc1cccc(CCC(F)(F)F)c1)c1ccccc1	ZINC000819456333	DI	On-Demand	Anodyne	ADRB1	15	40
CC(C)(O)COc1ccc(NCCC(=O)Nc2cccnc2)cc1	ZINC000819456334	EF	On-Demand	Anodyne	NAMPT	19	44
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(C)(C)O)cc2)c1	ZINC000819456341	FF	On-Demand	Anodyne	ADRB2	46	44
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(C)(C)O)cc2)c1	ZINC000819456341	FF	On-Demand	Anodyne	ADRB1	69	44
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(C)(C)O)cc2)c1	ZINC000819456341	FF	On-Demand	Anodyne	ADRB3	42	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(C)(C)O)cc2)c1	ZINC000819456341	FF	On-Demand	Anodyne	ABCB1	18	44
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OCC(C)(C)O)cc2)c1	ZINC000819456341	FF	On-Demand	Anodyne	PDS	68	37
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(C)(C)O)cc2)c1	ZINC000819456342	FF	On-Demand	Anodyne	ADRB2	46	44
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(C)(C)O)cc2)c1	ZINC000819456342	FF	On-Demand	Anodyne	ADRB1	69	44
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(C)(C)O)cc2)c1	ZINC000819456342	FF	On-Demand	Anodyne	ADRB3	42	43
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(C)(C)O)cc2)c1	ZINC000819456342	FF	On-Demand	Anodyne	ABCB1	18	44
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OCC(C)(C)O)cc2)c1	ZINC000819456342	FF	On-Demand	Anodyne	PDS	68	37
CC(C)(O)COc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819456346	FG	On-Demand	Anodyne	ADRB2	29	60
CC(C)(O)COc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819456346	FG	On-Demand	Anodyne	ADRB1	39	60
CC(C)(O)COc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819456346	FG	On-Demand	Anodyne	ADRB3	19	60
CC(C)(O)COc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819456346	FG	On-Demand	Anodyne	CYP2D6	22	47
CC(C)(O)COc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819456347	FG	On-Demand	Anodyne	ADRB2	29	60
CC(C)(O)COc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819456347	FG	On-Demand	Anodyne	ADRB1	39	60
CC(C)(O)COc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819456347	FG	On-Demand	Anodyne	ADRB3	19	60
CC(C)(O)COc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819456347	FG	On-Demand	Anodyne	CYP2D6	22	47
COCCNC(=O)c1ccccc1NC(=O)CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O	ZINC000819456348	HD	On-Demand	Anodyne	POLR1A	58	35
COCCNC(=O)c1ccccc1NC(=O)CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O	ZINC000819456349	HD	On-Demand	Anodyne	POLR1A	58	35
COC[C@@H](O)CNc1ccc(OCC(C)(C)O)cc1	ZINC000819456351	CD	On-Demand	Anodyne	ADRB2	33	42
COC[C@@H](O)CNc1ccc(OCC(C)(C)O)cc1	ZINC000819456351	CD	On-Demand	Anodyne	ADRB1	40	42
CC(C)(O)COc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819456369	GH	On-Demand	Anodyne	ADRB2	52	56
CC(C)(O)COc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819456369	GH	On-Demand	Anodyne	ADRB1	61	56
CC(C)(O)COc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819456369	GH	On-Demand	Anodyne	ADRB3	34	56
CC(C)(O)COc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819456369	GH	On-Demand	Anodyne	CASR	41	39
CC(C)(O)COc1ccc(NC[C@H](O)COc2cccc3ccccc23)cc1	ZINC000819456369	GH	On-Demand	Anodyne	CYP2D6	25	51
CC(C)(O)COc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819456370	GH	On-Demand	Anodyne	ADRB2	52	56
CC(C)(O)COc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819456370	GH	On-Demand	Anodyne	ADRB1	61	56
CC(C)(O)COc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819456370	GH	On-Demand	Anodyne	ADRB3	34	56
CC(C)(O)COc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819456370	GH	On-Demand	Anodyne	CASR	41	39
CC(C)(O)COc1ccc(NC[C@@H](O)COc2cccc3ccccc23)cc1	ZINC000819456370	GH	On-Demand	Anodyne	CYP2D6	25	51
CC(C)(O)COc1ccc(NC[C@@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819456382	GG	On-Demand	Anodyne	ADRB2	27	40
CC(C)(O)COc1ccc(NC[C@@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819456382	GG	On-Demand	Anodyne	ADRB1	41	42
CC(C)(O)COc1ccc(NC[C@@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819456382	GG	On-Demand	Anodyne	GRIN1	22	44
CC(C)(O)COc1ccc(NC[C@@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819456382	GG	On-Demand	Anodyne	ADRB3	27	40
CC(C)(O)COc1ccc(NC[C@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819456383	GG	On-Demand	Anodyne	ADRB2	27	40
CC(C)(O)COc1ccc(NC[C@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819456383	GG	On-Demand	Anodyne	ADRB1	41	42
CC(C)(O)COc1ccc(NC[C@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819456383	GG	On-Demand	Anodyne	GRIN1	22	44
CC(C)(O)COc1ccc(NC[C@H](O)COCc2ccc(Cl)cc2)cc1	ZINC000819456383	GG	On-Demand	Anodyne	ADRB3	27	40
CC(C)(O)COc1ccc(NC[C@H](O)COC2CCOCC2)cc1	ZINC000819456393	ED	On-Demand	Anodyne	ADRB1	25	41
CC(C)(O)COc1ccc(NC[C@@H](O)COC2CCOCC2)cc1	ZINC000819456394	ED	On-Demand	Anodyne	ADRB1	25	41
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)C1CCCCC1	ZINC000819456399	DG	On-Demand	Anodyne	TYK2	42	36
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)C1CCCCC1	ZINC000819456399	DG	On-Demand	Anodyne	PRMT3	17	40
O=C(Nc1cccc(NC[C@@H](O)C2CC2)c1)C1CCCCC1	ZINC000819456399	DG	On-Demand	Anodyne	KCNK3	58	60
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc(C)cc1C	ZINC000819456404	GG	On-Demand	Anodyne	ADRB2	16	41
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc(C)cc1C	ZINC000819456405	GG	On-Demand	Anodyne	ADRB2	16	41
CCOc1ccc(C(=O)N2CCCCC2)cc1NCC1(O)CCCCC1	ZINC000819456406	FH	On-Demand	Anodyne	HCN1	63	38
CCOc1ccc(C(=O)N2CCCCC2)cc1NCC1(O)CCCCC1	ZINC000819456406	FH	On-Demand	Anodyne	HCN4	56	38
O[C@@H](CNc1cccc(CCC(F)(F)F)c1)c1cccnc1	ZINC000819456407	DH	On-Demand	Anodyne	ADRB2	24	45
O[C@@H](CNc1cccc(CCC(F)(F)F)c1)c1cccnc1	ZINC000819456407	DH	On-Demand	Anodyne	ADRB1	26	44
O[C@@H](CNc1cccc(CCC(F)(F)F)c1)c1cccnc1	ZINC000819456407	DH	On-Demand	Anodyne	ADRB3	90	45
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)c1ccc(C#N)cc1	ZINC000819456411	GH	On-Demand	Mild	HRH3	25	44
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819456416	GH	On-Demand	Mild	HRH3	25	44
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819456433	GF	On-Demand	Anodyne	ADRB2	30	43
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819456433	GF	On-Demand	Anodyne	ADRB1	52	35
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819456434	GF	On-Demand	Anodyne	ADRB2	30	43
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819456434	GF	On-Demand	Anodyne	ADRB1	52	35
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)[C@@H](C)c1ccccc1	ZINC000819456477	GI	On-Demand	Anodyne	HCN1	48	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)[C@@H](C)c1ccccc1	ZINC000819456477	GI	On-Demand	Anodyne	HCN4	41	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)[C@H](C)c1ccccc1	ZINC000819456478	GI	On-Demand	Anodyne	HCN1	48	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)[C@H](C)c1ccccc1	ZINC000819456478	GI	On-Demand	Anodyne	HCN4	41	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)[C@@H](C)c1ccccc1	ZINC000819456480	GI	On-Demand	Anodyne	HCN1	48	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)[C@@H](C)c1ccccc1	ZINC000819456480	GI	On-Demand	Anodyne	HCN4	41	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000819456481	GI	On-Demand	Anodyne	HCN1	48	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000819456481	GI	On-Demand	Anodyne	HCN4	41	34
O=C(Cc1nsc2ccccc12)N1CCC[C@@H]1c1ncc[nH]1	ZINC000819456497	DF	On-Demand	Anodyne	CPT1A	60	37
O=C(Cc1nsc2ccccc12)N1CCC[C@H]1c1ncc[nH]1	ZINC000819456498	DF	On-Demand	Anodyne	CPT1A	60	37
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(OC3CCC3)c(F)c2)c1	ZINC000819456500	GH	On-Demand	Bother	ADRB1	35	42
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(OC3CCC3)c(F)c2)c1	ZINC000819456504	GH	On-Demand	Bother	ADRB1	35	42
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)c1ccc(C)cc1	ZINC000819456510	GI	On-Demand	Anodyne	HPGD	36	41
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)c1ccc(C)cc1	ZINC000819456512	GI	On-Demand	Anodyne	HPGD	36	41
O=C(N[C@H](CO)C1CC1)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819456515	FF	On-Demand	Anodyne	CNR1	52	32
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)c1c(F)cccc1F	ZINC000819456516	FE	On-Demand	Anodyne	PAPA1_CARPA	28	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)c1c(F)cccc1F	ZINC000819456517	FE	On-Demand	Anodyne	PAPA1_CARPA	28	43
O=C(N[C@@H](CO)C1CC1)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819456519	FF	On-Demand	Anodyne	CNR1	52	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)c1cccc(F)c1	ZINC000819456526	GH	On-Demand	Anodyne	HRH3	25	41
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)c1cccc(F)c1	ZINC000819456527	GH	On-Demand	Anodyne	HRH3	25	41
COCCCOc1cccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819456533	FI	On-Demand	Anodyne	GALR3	49	33
COCCCOc1cccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819456533	FI	On-Demand	Anodyne	PDS	44	41
COCCCOc1cccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819456535	FI	On-Demand	Anodyne	GALR3	49	33
COCCCOc1cccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819456535	FI	On-Demand	Anodyne	PDS	44	41
COCCNC(=O)c1ccccc1NC(=O)c1cccc2ccccc12	ZINC000819456557	EG	On-Demand	Anodyne	CNR2	15	51
COCCNC(=O)c1ccccc1NC(=O)c1cccc2ccccc12	ZINC000819456557	EG	On-Demand	Anodyne	CASP1	17	40
COCCNC(=O)c1ccccc1NC(=O)c1cccc2ccccc12	ZINC000819456557	EG	On-Demand	Anodyne	KCNK3	47	36
COCCNC(=O)c1ccccc1NC(=O)c1cccc2ccccc12	ZINC000819456557	EG	On-Demand	Anodyne	KCNK9	40	36
COCCNC(=O)c1ccccc1NC(=O)c1cccc2ccccc12	ZINC000819456557	EG	On-Demand	Anodyne	POLR1A	64	41
CCOc1ccc(C(=O)N(C)C)cc1NCC1(O)CCC1	ZINC000819456564	CE	On-Demand	Anodyne	HCN1	41	31
CCOc1ccc(C(=O)N(C)C)cc1NCC1(O)CCC1	ZINC000819456564	CE	On-Demand	Anodyne	HCN4	41	31
O[C@@H](CNc1ccc(OC2CCC2)c(F)c1)c1cccc(F)c1	ZINC000819456583	DI	On-Demand	Anodyne	PDE4A	20	42
O[C@H](CNc1ccc(OC2CCC2)c(F)c1)c1cccc(F)c1	ZINC000819456584	DI	On-Demand	Anodyne	PDE4A	20	42
COCCNC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C	ZINC000819456617	HE	On-Demand	Bother	CACNA1C	47	36
COCCNC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C	ZINC000819456617	HE	On-Demand	Bother	CACNA1D	76	36
COCCNC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C	ZINC000819456617	HE	On-Demand	Bother	KCNMA1	27	44
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819456618	GG	On-Demand	Anodyne	ADRB2	20	53
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819456618	GG	On-Demand	Anodyne	ADRB1	45	53
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819456619	GG	On-Demand	Anodyne	ADRB2	20	53
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819456619	GG	On-Demand	Anodyne	ADRB1	45	53
O[C@H](CNc1cccc(CCC(F)(F)F)c1)c1cccnc1	ZINC000819456620	DH	On-Demand	Anodyne	ADRB2	24	45
O[C@H](CNc1cccc(CCC(F)(F)F)c1)c1cccnc1	ZINC000819456620	DH	On-Demand	Anodyne	ADRB1	26	44
O[C@H](CNc1cccc(CCC(F)(F)F)c1)c1cccnc1	ZINC000819456620	DH	On-Demand	Anodyne	ADRB3	90	45
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819456625	GH	On-Demand	Anodyne	ADRB2	52	58
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819456625	GH	On-Demand	Anodyne	ADRB1	60	42
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819456625	GH	On-Demand	Anodyne	ADRB3	37	42
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819456625	GH	On-Demand	Anodyne	CASR	43	40
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819456625	GH	On-Demand	Anodyne	CYP2D6	22	46
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819456626	GH	On-Demand	Anodyne	ADRB2	52	58
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819456626	GH	On-Demand	Anodyne	ADRB1	60	42
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819456626	GH	On-Demand	Anodyne	ADRB3	37	42
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819456626	GH	On-Demand	Anodyne	CASR	43	40
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)cc1	ZINC000819456626	GH	On-Demand	Anodyne	CYP2D6	22	46
CC(C)(C)OC(=O)N1CCc2c(NC[C@H](O)c3ccccc3F)cccc21	ZINC000819456637	FI	On-Demand	Anodyne	KCNQ2	42	40
CC(C)(C)OC(=O)N1CCc2c(NC[C@@H](O)c3ccccc3F)cccc21	ZINC000819456638	FI	On-Demand	Anodyne	KCNQ2	42	40
O=C(Cc1noc2ccc(Br)cc12)N1CCC[C@@H]1c1ncc[nH]1	ZINC000819456640	GG	On-Demand	Anodyne	CPT1A	52	33
O=C(Cc1noc2ccc(Br)cc12)N1CCC[C@H]1c1ncc[nH]1	ZINC000819456642	GG	On-Demand	Anodyne	CPT1A	52	33
O=C(Nc1cccc(NC[C@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819456644	EH	On-Demand	Anodyne	ADRB2	19	42
O=C(Nc1cccc(NC[C@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819456644	EH	On-Demand	Anodyne	ADRB1	25	43
O=C(Nc1cccc(NC[C@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819456644	EH	On-Demand	Anodyne	ADRB3	88	45
O=C(Nc1cccc(NC[C@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819456644	EH	On-Demand	Anodyne	TBXA2R	15	40
O=C(Nc1cccc(NC[C@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819456644	EH	On-Demand	Anodyne	TBXAS1	23	40
O=C(Nc1cccc(NC[C@@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819456646	EH	On-Demand	Anodyne	ADRB2	19	42
O=C(Nc1cccc(NC[C@@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819456646	EH	On-Demand	Anodyne	ADRB1	25	43
O=C(Nc1cccc(NC[C@@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819456646	EH	On-Demand	Anodyne	ADRB3	88	45
O=C(Nc1cccc(NC[C@@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819456646	EH	On-Demand	Anodyne	TBXA2R	15	40
O=C(Nc1cccc(NC[C@@H](O)c2cccnc2)c1)C1CCCCC1	ZINC000819456646	EH	On-Demand	Anodyne	TBXAS1	23	40
COCCCOc1cccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819456659	FI	On-Demand	Anodyne	PDS	40	37
COCCCOc1cccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)c1	ZINC000819456661	FI	On-Demand	Anodyne	PDS	40	37
O=C(Nc1cccc(NC[C@H](O)c2ccccc2)c1)C1CCCCC1	ZINC000819456721	EI	On-Demand	Anodyne	ADRB1	23	40
O=C(Nc1cccc(NC[C@H](O)c2ccccc2)c1)C1CCCCC1	ZINC000819456721	EI	On-Demand	Anodyne	ADRB3	47	40
O=C(Nc1cccc(NC[C@H](O)c2ccccc2)c1)C1CCCCC1	ZINC000819456721	EI	On-Demand	Anodyne	EPHX2	17	43
O=C(Nc1cccc(NC[C@H](O)c2ccccc2)c1)C1CCCCC1	ZINC000819456721	EI	On-Demand	Anodyne	KCNK3	51	62
O=C(Nc1cccc(NC[C@@H](O)c2ccccc2)c1)C1CCCCC1	ZINC000819456724	EI	On-Demand	Anodyne	ADRB1	23	40
O=C(Nc1cccc(NC[C@@H](O)c2ccccc2)c1)C1CCCCC1	ZINC000819456724	EI	On-Demand	Anodyne	ADRB3	47	40
O=C(Nc1cccc(NC[C@@H](O)c2ccccc2)c1)C1CCCCC1	ZINC000819456724	EI	On-Demand	Anodyne	EPHX2	17	43
O=C(Nc1cccc(NC[C@@H](O)c2ccccc2)c1)C1CCCCC1	ZINC000819456724	EI	On-Demand	Anodyne	KCNK3	51	62
CC(C)(O)COc1ccc(NCCC(N)=O)cc1	ZINC000819456770	CD	On-Demand	Anodyne	ACR	47	37
CCOc1ccc(C(=O)N2CCCCC2)cc1NCC1(O)CCC1	ZINC000819456771	EG	On-Demand	Anodyne	HCN1	53	36
CCOc1ccc(C(=O)N2CCCCC2)cc1NCC1(O)CCC1	ZINC000819456771	EG	On-Demand	Anodyne	HCN4	46	36
O[C@@H](CNc1ccc(CCC(F)(F)F)cc1)c1ccc(F)c(F)c1	ZINC000819456773	EJ	On-Demand	Anodyne	ADRB2	18	46
O[C@H](CNc1ccc(CCC(F)(F)F)cc1)c1ccc(F)c(F)c1	ZINC000819456774	EJ	On-Demand	Anodyne	ADRB2	18	46
CCOc1ccc(C(=O)N2CCCCC2)cc1NCCS(C)(=O)=O	ZINC000819456780	FE	On-Demand	Anodyne	L3MBTL3	40	34
CC(C)(O)COc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819456785	DE	On-Demand	Anodyne	ADRB2	31	45
CC(C)(O)COc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819456785	DE	On-Demand	Anodyne	ADRB1	31	46
CC(C)(O)COc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819456785	DE	On-Demand	Anodyne	ADRB3	95	51
CC(C)(O)COc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819456787	DE	On-Demand	Anodyne	ADRB2	31	45
CC(C)(O)COc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819456787	DE	On-Demand	Anodyne	ADRB1	31	46
CC(C)(O)COc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819456787	DE	On-Demand	Anodyne	ADRB3	95	51
Cc1ccccc1[C@@H](CO)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819456795	GF	On-Demand	Mild	KLK3	55	32
Cc1ccccc1[C@@H](CO)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819456795	GF	On-Demand	Mild	PAPA1_CARPA	49	48
Cc1ccccc1[C@@H](CO)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819456795	GF	On-Demand	Mild	CTSK	15	42
Cc1ccccc1[C@@H](CO)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819456795	GF	On-Demand	Mild	FPR1	49	42
Cc1ccccc1[C@@H](CO)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819456797	GF	On-Demand	Mild	KLK3	55	32
Cc1ccccc1[C@@H](CO)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819456797	GF	On-Demand	Mild	PAPA1_CARPA	49	48
Cc1ccccc1[C@@H](CO)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819456797	GF	On-Demand	Mild	CTSK	15	42
Cc1ccccc1[C@@H](CO)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819456797	GF	On-Demand	Mild	FPR1	49	42
Cc1ccccc1[C@H](CO)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819456798	GF	On-Demand	Mild	KLK3	55	32
Cc1ccccc1[C@H](CO)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819456798	GF	On-Demand	Mild	PAPA1_CARPA	49	48
Cc1ccccc1[C@H](CO)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819456798	GF	On-Demand	Mild	CTSK	15	42
Cc1ccccc1[C@H](CO)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819456798	GF	On-Demand	Mild	FPR1	49	42
Cc1ccccc1[C@H](CO)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819456799	GF	On-Demand	Mild	KLK3	55	32
Cc1ccccc1[C@H](CO)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819456799	GF	On-Demand	Mild	PAPA1_CARPA	49	48
Cc1ccccc1[C@H](CO)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819456799	GF	On-Demand	Mild	CTSK	15	42
Cc1ccccc1[C@H](CO)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819456799	GF	On-Demand	Mild	FPR1	49	42
COCCNC(=O)c1ccccc1NC(=O)CCOc1ccccc1OC	ZINC000819456801	FE	On-Demand	Anodyne	ADRA1D	17	45
COCCNC(=O)c1ccccc1NC(=O)CCOc1ccccc1OC	ZINC000819456801	FE	On-Demand	Anodyne	KCNA3	42	40
COCCNC(=O)c1ccccc1NC(=O)CCOc1ccccc1OC	ZINC000819456801	FE	On-Demand	Anodyne	KCNK3	49	38
COCCCOc1cccc(NCCC(=O)N(C)OC)c1	ZINC000819456804	CD	On-Demand	Anodyne	MTNR1A	24	42
COCCCOc1cccc(NCCC(=O)N(C)OC)c1	ZINC000819456804	CD	On-Demand	Anodyne	MTNR1B	24	40
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1F	ZINC000819456807	GF	On-Demand	Anodyne	ADRB2	21	41
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccccc1F	ZINC000819456807	GF	On-Demand	Anodyne	ADRB1	59	42
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1F	ZINC000819456808	GF	On-Demand	Anodyne	ADRB2	21	41
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccccc1F	ZINC000819456808	GF	On-Demand	Anodyne	ADRB1	59	42
N#Cc1ccc([C@@H](O)CNc2cccc(NC(=O)C3CCCCC3)c2)cc1	ZINC000819456809	FI	On-Demand	Mild	MCHR1	17	40
N#Cc1ccc([C@H](O)CNc2cccc(NC(=O)C3CCCCC3)c2)cc1	ZINC000819456810	FI	On-Demand	Mild	MCHR1	17	40
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819456830	FC	On-Demand	Anodyne	SLC9A1	55	30
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819456831	FC	On-Demand	Anodyne	SLC9A1	55	30
O[C@H](CNc1ccc(OC2CCC2)c(F)c1)Cc1ccccc1	ZINC000819456834	DH	On-Demand	Anodyne	PDE4A	34	40
O[C@@H](CNc1ccc(OC2CCC2)c(F)c1)Cc1ccccc1	ZINC000819456835	DH	On-Demand	Anodyne	PDE4A	34	40
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1cccc2ccccc12	ZINC000819456856	GI	On-Demand	Anodyne	NCEH1	42	39
CON(C)C(=O)CCNc1ccc(OC2CCC2)c(F)c1	ZINC000819456864	CF	On-Demand	Anodyne	PDE4D	15	40
COCCNC(=O)c1ccccc1NC(=O)c1cc(O)nc2ccccc12	ZINC000819456901	FF	On-Demand	Anodyne	TACR3	42	45
COCCNC(=O)c1ccccc1NC(=O)c1cc(O)nc2ccccc12	ZINC000819456901	FF	On-Demand	Anodyne	AKR1B10	46	35
COCCNC(=O)c1ccccc1NC(=O)c1cc(O)nc2ccccc12	ZINC000819456901	FF	On-Demand	Anodyne	POLR1A	64	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(OC2CCC2)c(F)c1	ZINC000819456917	GH	On-Demand	Bother	ADRB1	54	35
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(OC2CCC2)c(F)c1	ZINC000819456918	GH	On-Demand	Bother	ADRB1	54	35
CC(C)(C)OC(=O)N1CCc2c(NCCC(=O)Nc3ccccc3F)cccc21	ZINC000819456920	GJ	On-Demand	Anodyne	KCNQ2	57	36
CC(C)(C)OC(=O)N1CCc2c(NCCS(C)(=O)=O)cccc21	ZINC000819456923	EE	On-Demand	Anodyne	KCNQ2	46	32
CC(C)(C)OC(=O)N1CCc2c(NCCS(C)(=O)=O)cccc21	ZINC000819456923	EE	On-Demand	Anodyne	GPR119	27	43
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cccc(CC)c1	ZINC000819456950	GG	On-Demand	Anodyne	ADRB2	21	40
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1cccc(CC)c1	ZINC000819456950	GG	On-Demand	Anodyne	PDS	70	36
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cccc(CC)c1	ZINC000819456953	GG	On-Demand	Anodyne	ADRB2	21	40
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1cccc(CC)c1	ZINC000819456953	GG	On-Demand	Anodyne	PDS	70	36
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819456968	FG	On-Demand	Anodyne	ADRB2	48	46
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819456968	FG	On-Demand	Anodyne	ADRB1	59	39
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819456968	FG	On-Demand	Anodyne	GRIN1	25	42
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819456968	FG	On-Demand	Anodyne	ADRB3	29	45
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819456968	FG	On-Demand	Anodyne	CASR	31	41
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1	ZINC000819456968	FG	On-Demand	Anodyne	CYP2D6	19	42
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819456969	FG	On-Demand	Anodyne	ADRB2	48	46
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819456969	FG	On-Demand	Anodyne	ADRB1	59	39
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819456969	FG	On-Demand	Anodyne	GRIN1	25	42
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819456969	FG	On-Demand	Anodyne	ADRB3	29	45
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819456969	FG	On-Demand	Anodyne	CASR	31	41
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000819456969	FG	On-Demand	Anodyne	CYP2D6	19	42
CC(C)(C)OC(=O)N1CCc2c(NC[C@H](O)c3ccc(F)cc3)cccc21	ZINC000819456976	FI	On-Demand	Anodyne	KCNQ2	45	39
CC(C)(C)OC(=O)N1CCc2c(NC[C@@H](O)c3ccc(F)cc3)cccc21	ZINC000819456977	FI	On-Demand	Anodyne	KCNQ2	45	39
CSc1ccc(OC[C@@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819457004	GG	On-Demand	Anodyne	ADRB2	34	42
CSc1ccc(OC[C@@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819457004	GG	On-Demand	Anodyne	ADRB1	45	42
CSc1ccc(OC[C@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819457005	GG	On-Demand	Anodyne	ADRB2	34	42
CSc1ccc(OC[C@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819457005	GG	On-Demand	Anodyne	ADRB1	45	42
O[C@@H](CNc1ccccc1CCC(F)(F)F)c1cccnc1	ZINC000819457029	DH	On-Demand	Anodyne	ADRB3	71	41
O[C@H](CNc1ccccc1CCC(F)(F)F)c1cccnc1	ZINC000819457030	DH	On-Demand	Anodyne	ADRB3	71	41
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819457035	GH	On-Demand	Anodyne	ADRB2	40	41
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819457035	GH	On-Demand	Anodyne	ADRB1	53	36
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819457035	GH	On-Demand	Anodyne	ABCB1	47	40
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819457035	GH	On-Demand	Anodyne	HCN1	48	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)COc1ccccc1	ZINC000819457035	GH	On-Demand	Anodyne	HCN4	41	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819457040	GH	On-Demand	Anodyne	ADRB2	40	41
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819457040	GH	On-Demand	Anodyne	ADRB1	53	36
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819457040	GH	On-Demand	Anodyne	ABCB1	47	40
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819457040	GH	On-Demand	Anodyne	HCN1	48	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)COc1ccccc1	ZINC000819457040	GH	On-Demand	Anodyne	HCN4	41	32
CC(C)(C)OC(=O)N1CCc2c(NC[C@H](O)c3ccccc3)cccc21	ZINC000819457041	FI	On-Demand	Anodyne	KCNQ2	64	37
CC(C)(C)OC(=O)N1CCc2c(NC[C@@H](O)c3ccccc3)cccc21	ZINC000819457042	FI	On-Demand	Anodyne	KCNQ2	64	37
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)COC	ZINC000819457063	EE	On-Demand	Anodyne	HCN1	42	31
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)COC	ZINC000819457063	EE	On-Demand	Anodyne	L3MBTL3	45	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)COC	ZINC000819457064	EE	On-Demand	Anodyne	HCN1	42	31
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)COC	ZINC000819457064	EE	On-Demand	Anodyne	L3MBTL3	45	34
COCCNC(=O)c1ccccc1NC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	ZINC000819457067	IJ	On-Demand	Anodyne	KLKB1	15	40
COCCNC(=O)c1ccccc1NC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	ZINC000819457067	IJ	On-Demand	Anodyne	F10	38	48
COCCNC(=O)c1ccccc1NC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	ZINC000819457067	IJ	On-Demand	Anodyne	CYSLTR2	44	31
COCCNC(=O)c1ccccc1NC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	ZINC000819457067	IJ	On-Demand	Anodyne	NR1H4	15	40
COCCNC(=O)c1ccccc1NC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	ZINC000819457067	IJ	On-Demand	Anodyne	HDAC1	44	42
COCCNC(=O)c1ccccc1NC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	ZINC000819457067	IJ	On-Demand	Anodyne	HDAC2	25	43
COCCNC(=O)c1ccccc1NC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	ZINC000819457067	IJ	On-Demand	Anodyne	SLC6A5	51	43
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819457080	GI	On-Demand	Anodyne	ABCB1	51	39
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819457080	GI	On-Demand	Anodyne	HCN1	43	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819457080	GI	On-Demand	Anodyne	HCN4	40	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819457080	GI	On-Demand	Anodyne	L3MBTL3	25	40
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)CCc1ccccc1	ZINC000819457081	GI	On-Demand	Anodyne	ABCB1	51	39
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)CCc1ccccc1	ZINC000819457081	GI	On-Demand	Anodyne	HCN1	43	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)CCc1ccccc1	ZINC000819457081	GI	On-Demand	Anodyne	HCN4	40	32
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)CCc1ccccc1	ZINC000819457081	GI	On-Demand	Anodyne	L3MBTL3	25	40
CN(CCC1CCN(c2ccncc2)CC1)C(=O)C(F)=C1CCC1	ZINC000819457088	EH	On-Demand	Anodyne	SSTR1	17	42
O=C(/C=C/[C@H]1CCCO1)N1CCC(Cc2cccnc2)CC1	ZINC000819457089	DF	On-Demand	Anodyne	GRIN2B	41	45
O=C(/C=C/[C@H]1CCCO1)N1CCC(Cc2cccnc2)CC1	ZINC000819457089	DF	On-Demand	Anodyne	CHRNA7	51	41
O=C(/C=C/[C@H]1CCCO1)N1CCC(Cc2cccnc2)CC1	ZINC000819457089	DF	On-Demand	Anodyne	C3AR1	43	42
O=C(/C=C/[C@H]1CCCO1)N1CCC(Cc2cccnc2)CC1	ZINC000819457089	DF	On-Demand	Anodyne	ACHP_LYMST	26	41
O=C(/C=C\[C@H]1CCCO1)N1CCC(Cc2cccnc2)CC1	ZINC000819457090	DF	On-Demand	Anodyne	GRIN2B	41	45
O=C(/C=C\[C@H]1CCCO1)N1CCC(Cc2cccnc2)CC1	ZINC000819457090	DF	On-Demand	Anodyne	CHRNA7	51	41
O=C(/C=C\[C@H]1CCCO1)N1CCC(Cc2cccnc2)CC1	ZINC000819457090	DF	On-Demand	Anodyne	C3AR1	43	42
O=C(/C=C\[C@H]1CCCO1)N1CCC(Cc2cccnc2)CC1	ZINC000819457090	DF	On-Demand	Anodyne	ACHP_LYMST	26	41
O=C(/C=C\[C@@H]1CCCO1)N1CCC(Cc2cccnc2)CC1	ZINC000819457091	DF	On-Demand	Anodyne	GRIN2B	41	45
O=C(/C=C\[C@@H]1CCCO1)N1CCC(Cc2cccnc2)CC1	ZINC000819457091	DF	On-Demand	Anodyne	CHRNA7	51	41
O=C(/C=C\[C@@H]1CCCO1)N1CCC(Cc2cccnc2)CC1	ZINC000819457091	DF	On-Demand	Anodyne	C3AR1	43	42
O=C(/C=C\[C@@H]1CCCO1)N1CCC(Cc2cccnc2)CC1	ZINC000819457091	DF	On-Demand	Anodyne	ACHP_LYMST	26	41
O=C(/C=C/[C@@H]1CCCO1)N1CCC(Cc2cccnc2)CC1	ZINC000819457092	DF	On-Demand	Anodyne	GRIN2B	41	45
O=C(/C=C/[C@@H]1CCCO1)N1CCC(Cc2cccnc2)CC1	ZINC000819457092	DF	On-Demand	Anodyne	CHRNA7	51	41
O=C(/C=C/[C@@H]1CCCO1)N1CCC(Cc2cccnc2)CC1	ZINC000819457092	DF	On-Demand	Anodyne	C3AR1	43	42
O=C(/C=C/[C@@H]1CCCO1)N1CCC(Cc2cccnc2)CC1	ZINC000819457092	DF	On-Demand	Anodyne	ACHP_LYMST	26	41
CCOc1ccc(C(=O)N2CCCCC2)cc1NCC1(O)CCCC1	ZINC000819457109	EG	On-Demand	Anodyne	HCN1	63	38
CCOc1ccc(C(=O)N2CCCCC2)cc1NCC1(O)CCCC1	ZINC000819457109	EG	On-Demand	Anodyne	HCN4	56	38
COCCCOc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819457112	DF	On-Demand	Anodyne	ADRB2	23	45
COCCCOc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819457112	DF	On-Demand	Anodyne	ADRB1	27	46
COCCCOc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819457112	DF	On-Demand	Anodyne	ADRB3	79	46
COCCCOc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819457113	DF	On-Demand	Anodyne	ADRB2	23	45
COCCCOc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819457113	DF	On-Demand	Anodyne	ADRB1	27	46
COCCCOc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819457113	DF	On-Demand	Anodyne	ADRB3	79	46
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)c1cccnc1	ZINC000819457115	FG	On-Demand	Anodyne	ADRB1	15	40
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)c1cccnc1	ZINC000819457115	FG	On-Demand	Anodyne	ADRB3	55	40
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)c1cccnc1	ZINC000819457116	FG	On-Demand	Anodyne	ADRB1	15	40
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)c1cccnc1	ZINC000819457116	FG	On-Demand	Anodyne	ADRB3	55	40
CC(C)(O)COc1ccc(NCCC(=O)Nc2ccc(Cl)cc2)cc1	ZINC000819457146	FH	On-Demand	Anodyne	LTA4H	32	42
CC(C)(O)COc1ccc(NCCC(=O)Nc2ccc(Cl)cc2)cc1	ZINC000819457146	FH	On-Demand	Anodyne	ACR	31	40
O[C@@H](CNc1ccc(CCC(F)(F)F)cc1)c1cccc(F)c1	ZINC000819457151	EI	On-Demand	Anodyne	ADRB2	20	49
O[C@@H](CNc1ccc(CCC(F)(F)F)cc1)c1cccc(F)c1	ZINC000819457151	EI	On-Demand	Anodyne	ADRB3	25	41
O[C@H](CNc1ccc(CCC(F)(F)F)cc1)c1cccc(F)c1	ZINC000819457153	EI	On-Demand	Anodyne	ADRB2	20	49
O[C@H](CNc1ccc(CCC(F)(F)F)cc1)c1cccc(F)c1	ZINC000819457153	EI	On-Demand	Anodyne	ADRB3	25	41
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)Cn1cccn1	ZINC000819457162	FE	On-Demand	Anodyne	HCN1	40	31
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)Cn1cccn1	ZINC000819457162	FE	On-Demand	Anodyne	HCN4	40	31
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)Cn1cccn1	ZINC000819457163	FE	On-Demand	Anodyne	HCN1	40	31
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)Cn1cccn1	ZINC000819457163	FE	On-Demand	Anodyne	HCN4	40	31
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](CO)c1cccc(Br)c1	ZINC000819457166	GF	On-Demand	Anodyne	PAPA1_CARPA	22	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](CO)c1cccc(Br)c1	ZINC000819457167	GF	On-Demand	Anodyne	PAPA1_CARPA	22	41
CCOc1ccc(OC[C@H](O)CNc2cc(F)c(OC)cc2OC)cc1	ZINC000819457179	FG	On-Demand	Anodyne	ADRB2	32	40
CCOc1ccc(OC[C@H](O)CNc2cc(F)c(OC)cc2OC)cc1	ZINC000819457179	FG	On-Demand	Anodyne	ADRB1	30	40
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](C)O	ZINC000819457180	DF	On-Demand	Anodyne	HCN1	48	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](C)O	ZINC000819457180	DF	On-Demand	Anodyne	HCN4	41	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](C)O	ZINC000819457180	DF	On-Demand	Anodyne	L3MBTL3	71	37
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](C)O	ZINC000819457180	DF	On-Demand	Anodyne	HPGD	39	40
CCOc1ccc(OC[C@@H](O)CNc2cc(F)c(OC)cc2OC)cc1	ZINC000819457181	FG	On-Demand	Anodyne	ADRB2	32	40
CCOc1ccc(OC[C@@H](O)CNc2cc(F)c(OC)cc2OC)cc1	ZINC000819457181	FG	On-Demand	Anodyne	ADRB1	30	40
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](C)O	ZINC000819457182	DF	On-Demand	Anodyne	HCN1	48	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](C)O	ZINC000819457182	DF	On-Demand	Anodyne	HCN4	41	34
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](C)O	ZINC000819457182	DF	On-Demand	Anodyne	L3MBTL3	71	37
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](C)O	ZINC000819457182	DF	On-Demand	Anodyne	HPGD	39	40
CC(C)(O)COc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819457183	FI	On-Demand	Anodyne	PDS	40	36
CC(C)(O)COc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819457185	FI	On-Demand	Anodyne	PDS	40	36
CC(C)(O)COc1ccc(NC[C@@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819457191	FI	On-Demand	Anodyne	ADRB2	31	43
CC(C)(O)COc1ccc(NC[C@@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819457191	FI	On-Demand	Anodyne	ADRB1	33	42
CC(C)(O)COc1ccc(NC[C@@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819457191	FI	On-Demand	Anodyne	ADRB3	28	42
CC(C)(O)COc1ccc(NC[C@@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819457191	FI	On-Demand	Anodyne	CASR	43	43
CC(C)(O)COc1ccc(NC[C@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819457193	FI	On-Demand	Anodyne	ADRB2	31	43
CC(C)(O)COc1ccc(NC[C@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819457193	FI	On-Demand	Anodyne	ADRB1	33	42
CC(C)(O)COc1ccc(NC[C@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819457193	FI	On-Demand	Anodyne	ADRB3	28	42
CC(C)(O)COc1ccc(NC[C@H](O)Cc2ccc3ccccc3c2)cc1	ZINC000819457193	FI	On-Demand	Anodyne	CASR	43	43
CCOc1ccc(C(=O)N2CCCCC2)cc1NCC1(O)CCOCC1	ZINC000819457200	FF	On-Demand	Anodyne	HCN1	47	37
CCOc1ccc(C(=O)N2CCCCC2)cc1NCC1(O)CCOCC1	ZINC000819457200	FF	On-Demand	Anodyne	HCN4	44	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(Cc3cccnc3)CC1)C2	ZINC000819457209	FF	On-Demand	Anodyne	GRIN2B	45	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(Cc3cccnc3)CC1)C2	ZINC000819457209	FF	On-Demand	Anodyne	CHRNA7	48	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(Cc3cccnc3)CC1)C2	ZINC000819457212	FF	On-Demand	Anodyne	GRIN2B	45	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(Cc3cccnc3)CC1)C2	ZINC000819457212	FF	On-Demand	Anodyne	CHRNA7	48	40
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819457219	GF	On-Demand	Mild	ADRB2	15	41
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819457219	GF	On-Demand	Mild	ADRB1	51	35
CC(C)(O)COc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819457221	EG	On-Demand	Anodyne	LTA4H	58	49
CC(C)(O)COc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819457221	EG	On-Demand	Anodyne	HDAC8	15	40
CC(C)(O)COc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819457221	EG	On-Demand	Anodyne	ACR	45	34
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819457223	GF	On-Demand	Mild	ADRB2	15	41
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819457223	GF	On-Demand	Mild	ADRB1	51	35
C/C=C\c1ccc(OC[C@H](O)CNc2cc(F)c(OC)cc2OC)c(OC)c1	ZINC000819457234	GH	On-Demand	Anodyne	TUBB1	36	40
C/C=C/c1ccc(OC[C@H](O)CNc2cc(F)c(OC)cc2OC)c(OC)c1	ZINC000819457236	GH	On-Demand	Anodyne	TUBB1	36	40
C/C=C/c1ccc(OC[C@@H](O)CNc2cc(F)c(OC)cc2OC)c(OC)c1	ZINC000819457238	GH	On-Demand	Anodyne	TUBB1	36	40
C/C=C\c1ccc(OC[C@@H](O)CNc2cc(F)c(OC)cc2OC)c(OC)c1	ZINC000819457240	GH	On-Demand	Anodyne	TUBB1	36	40
COCCNC(=O)c1ccccc1NC(=O)c1cn2ccccc2n1	ZINC000819457251	ED	On-Demand	Anodyne	POLR1A	60	38
COCCCOc1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819457273	EG	On-Demand	Bother	CACNA1C	43	42
COCCCOc1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819457273	EG	On-Demand	Bother	CACNA1D	67	42
COCCCOc1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819457273	EG	On-Demand	Bother	ACR	17	40
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@H]2C)cc1	ZINC000819457274	JG	On-Demand	Anodyne	CYSLTR2	54	37
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@H]2C)cc1	ZINC000819457274	JG	On-Demand	Anodyne	CPT1A	71	36
COCCCOc1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819457275	EG	On-Demand	Bother	CACNA1C	43	42
COCCCOc1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819457275	EG	On-Demand	Bother	CACNA1D	67	42
COCCCOc1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819457275	EG	On-Demand	Bother	ACR	17	40
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@@H]2C)cc1	ZINC000819457278	JG	On-Demand	Anodyne	CYSLTR2	54	37
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@@H]2C)cc1	ZINC000819457278	JG	On-Demand	Anodyne	CPT1A	71	36
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OCC(=O)N2[C@H](C)CCC[C@H]2C)cc1	ZINC000819457280	JG	On-Demand	Anodyne	CYSLTR2	54	37
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OCC(=O)N2[C@H](C)CCC[C@H]2C)cc1	ZINC000819457280	JG	On-Demand	Anodyne	CPT1A	71	36
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)c1ccccc1	ZINC000819457287	FH	On-Demand	Anodyne	ADRB3	34	41
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)c1ccccc1	ZINC000819457287	FH	On-Demand	Anodyne	HCN1	49	33
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@H](O)c1ccccc1	ZINC000819457287	FH	On-Demand	Anodyne	HCN4	43	33
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)c1ccccc1	ZINC000819457289	FH	On-Demand	Anodyne	ADRB3	34	41
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)c1ccccc1	ZINC000819457289	FH	On-Demand	Anodyne	HCN1	49	33
CCOc1ccc(C(=O)N2CCCCC2)cc1NC[C@@H](O)c1ccccc1	ZINC000819457289	FH	On-Demand	Anodyne	HCN4	43	33
O[C@@H](CNc1ccc(CCC(F)(F)F)cc1)c1ccc(F)cc1	ZINC000819457291	EI	On-Demand	Anodyne	ADRB2	15	54
O[C@H](CNc1ccc(CCC(F)(F)F)cc1)c1ccc(F)cc1	ZINC000819457293	EI	On-Demand	Anodyne	ADRB2	15	54
COCCNC(=O)c1ccccc1NC(=O)c1cccc(S(=O)(=O)N(C)c2ccc(OC)cc2)c1	ZINC000819457294	JG	On-Demand	Anodyne	DRD4	41	32
Cc1ccc(OC[C@@H](O)CNc2cccc3c2CCN3C(=O)OC(C)(C)C)cc1	ZINC000819457295	GI	On-Demand	Anodyne	ADRB2	20	43
Cc1ccc(OC[C@@H](O)CNc2cccc3c2CCN3C(=O)OC(C)(C)C)cc1	ZINC000819457295	GI	On-Demand	Anodyne	ACOX1	51	37
Cc1ccc(OC[C@H](O)CNc2cccc3c2CCN3C(=O)OC(C)(C)C)cc1	ZINC000819457296	GI	On-Demand	Anodyne	ADRB2	20	43
Cc1ccc(OC[C@H](O)CNc2cccc3c2CCN3C(=O)OC(C)(C)C)cc1	ZINC000819457296	GI	On-Demand	Anodyne	ACOX1	51	37
C#CCNC(=O)CCNc1cc(C(=O)N2CCCCC2)ccc1OCC	ZINC000819457304	FE	On-Demand	Mild	HCN1	40	31
C#CCNC(=O)CCNc1cc(C(=O)N2CCCCC2)ccc1OCC	ZINC000819457304	FE	On-Demand	Mild	HCN4	40	31
CC(C)(C)OC(=O)N1CCc2c(NC[C@@H](O)c3cccnc3)cccc21	ZINC000819457320	FH	On-Demand	Anodyne	ADRB1	16	42
CC(C)(C)OC(=O)N1CCc2c(NC[C@@H](O)c3cccnc3)cccc21	ZINC000819457320	FH	On-Demand	Anodyne	ADRB3	51	43
CC(C)(C)OC(=O)N1CCc2c(NC[C@H](O)c3cccnc3)cccc21	ZINC000819457321	FH	On-Demand	Anodyne	ADRB1	16	42
CC(C)(C)OC(=O)N1CCc2c(NC[C@H](O)c3cccnc3)cccc21	ZINC000819457321	FH	On-Demand	Anodyne	ADRB3	51	43
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819457322	GF	On-Demand	Bother	ADRB2	40	41
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819457322	GF	On-Demand	Bother	ADRB1	59	36
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819457322	GF	On-Demand	Bother	ADRB3	26	41
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819457323	GF	On-Demand	Bother	ADRB2	40	41
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819457323	GF	On-Demand	Bother	ADRB1	59	36
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819457323	GF	On-Demand	Bother	ADRB3	26	41
CC(C)(O)COc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819457332	EH	On-Demand	Anodyne	ADRB2	15	42
COCCNC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1	ZINC000819457333	HE	On-Demand	Bother	CACNA1D	55	36
COCCNC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1	ZINC000819457333	HE	On-Demand	Bother	TAAR1	20	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)c1	ZINC000819457356	FF	On-Demand	Bother	ADRB1	20	40
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)c1	ZINC000819457357	FF	On-Demand	Bother	ADRB1	20	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)c1	ZINC000819457359	FF	On-Demand	Bother	ADRB1	20	40
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)c1	ZINC000819457360	FF	On-Demand	Bother	ADRB1	20	40
O[C@H](CNc1ccccc1O[C@H]1CCOC1)c1ccc(OC(F)(F)F)cc1	ZINC000819457384	GH	On-Demand	Anodyne	CTSS	15	41
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819457385	FH	On-Demand	Anodyne	ADRB1	29	43
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819457385	FH	On-Demand	Anodyne	ADRB3	46	46
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819457385	FH	On-Demand	Anodyne	CYP3A4	47	36
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)c1ccc(OC(F)(F)F)cc1	ZINC000819457386	GH	On-Demand	Anodyne	CTSS	15	41
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)c1ccc(OC(F)(F)F)cc1	ZINC000819457387	GH	On-Demand	Anodyne	CTSS	15	41
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819457388	FH	On-Demand	Anodyne	ADRB1	29	43
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819457388	FH	On-Demand	Anodyne	ADRB3	46	46
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819457388	FH	On-Demand	Anodyne	CYP3A4	47	36
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)c1ccc(OC(F)(F)F)cc1	ZINC000819457389	GH	On-Demand	Anodyne	CTSS	15	41
CCOc1cc(Cl)ccc1NCC1(O)CCCC1	ZINC000819457396	CG	On-Demand	Anodyne	HCN1	42	32
CCOc1cc(Cl)ccc1NCC1(O)CCCC1	ZINC000819457396	CG	On-Demand	Anodyne	HCN4	43	32
O[C@@H](CNc1cccc(OCCF)c1)c1ccccc1F	ZINC000819457401	CG	On-Demand	Anodyne	ADRB1	16	40
O[C@H](CNc1cccc(OCCF)c1)c1ccccc1F	ZINC000819457402	CG	On-Demand	Anodyne	ADRB1	16	40
CN(C)c1ccc(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819457434	FG	On-Demand	Mild	PAPA1_CARPA	54	44
CN(C)c1ccc(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819457434	FG	On-Demand	Mild	CTSK	22	45
CN(C)c1ccc(N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819457434	FG	On-Demand	Mild	FPR1	42	37
CN(C)c1ccc(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819457435	FG	On-Demand	Mild	PAPA1_CARPA	54	44
CN(C)c1ccc(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819457435	FG	On-Demand	Mild	CTSK	22	45
CN(C)c1ccc(N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1	ZINC000819457435	FG	On-Demand	Mild	FPR1	42	37
CCOc1cc(Cl)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819457439	EH	On-Demand	Bother	ADRB3	44	40
CCOc1cc(Cl)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819457439	EH	On-Demand	Bother	CACNA1D	60	34
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819457440	FF	On-Demand	Mild	CTRB_BOVIN	46	33
CCOc1cc(Cl)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819457441	EH	On-Demand	Bother	ADRB3	44	40
CCOc1cc(Cl)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819457441	EH	On-Demand	Bother	CACNA1D	60	34
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)COc1ccc(Cl)cc1	ZINC000819457442	FG	On-Demand	Anodyne	ADRB1	43	40
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1ccc(C#N)cc1	ZINC000819457443	FF	On-Demand	Mild	CTRB_BOVIN	46	33
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)COc1ccc(Cl)cc1	ZINC000819457444	FG	On-Demand	Anodyne	ADRB1	43	40
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)COc1ccc(Cl)cc1	ZINC000819457445	FG	On-Demand	Anodyne	ADRB1	43	40
O[C@@H](CNc1ccc(OC2CCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819457446	FI	On-Demand	Anodyne	ADRB2	19	63
O[C@@H](CNc1ccc(OC2CCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819457446	FI	On-Demand	Anodyne	ADRB1	31	63
O[C@@H](CNc1ccc(OC2CCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819457446	FI	On-Demand	Anodyne	HTR1A	17	63
O[C@@H](CNc1ccc(OC2CCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819457446	FI	On-Demand	Anodyne	SLC6A4	20	45
O[C@@H](CNc1ccc(OC2CCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819457446	FI	On-Demand	Anodyne	CYP2D6	16	42
O[C@H](CNc1ccccc1O[C@H]1CCOC1)COc1ccc(Cl)cc1	ZINC000819457447	FG	On-Demand	Anodyne	ADRB1	43	40
O[C@H](CNc1ccc(OC2CCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819457448	FI	On-Demand	Anodyne	ADRB2	19	63
O[C@H](CNc1ccc(OC2CCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819457448	FI	On-Demand	Anodyne	ADRB1	31	63
O[C@H](CNc1ccc(OC2CCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819457448	FI	On-Demand	Anodyne	HTR1A	17	63
O[C@H](CNc1ccc(OC2CCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819457448	FI	On-Demand	Anodyne	SLC6A4	20	45
O[C@H](CNc1ccc(OC2CCC2)c(F)c1)COc1cccc2[nH]ccc12	ZINC000819457448	FI	On-Demand	Anodyne	CYP2D6	16	42
O[C@@H](CNc1cccc(OCCF)c1)c1cccc(C(F)(F)F)c1	ZINC000819457492	EI	On-Demand	Anodyne	GALR3	40	31
O[C@@H](CNc1cccc(OCCF)c1)c1cccc(C(F)(F)F)c1	ZINC000819457492	EI	On-Demand	Anodyne	PDS	44	42
O[C@H](CNc1cccc(OCCF)c1)c1cccc(C(F)(F)F)c1	ZINC000819457493	EI	On-Demand	Anodyne	GALR3	40	31
O[C@H](CNc1cccc(OCCF)c1)c1cccc(C(F)(F)F)c1	ZINC000819457493	EI	On-Demand	Anodyne	PDS	44	42
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819457504	GH	On-Demand	Anodyne	PPARD	30	42
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1ccc(C(F)(F)F)cc1	ZINC000819457505	GH	On-Demand	Anodyne	PPARD	30	42
O=C(CCNc1ccc(OC2CCC2)c(F)c1)Nc1ccccc1	ZINC000819457510	EI	On-Demand	Anodyne	PDE4A	22	42
O=C(CCNc1ccc(OC2CCC2)c(F)c1)Nc1ccccc1	ZINC000819457510	EI	On-Demand	Anodyne	HDAC10	24	40
O=C(CCNc1ccc(OC2CCC2)c(F)c1)Nc1ccccc1	ZINC000819457510	EI	On-Demand	Anodyne	HDAC2	17	40
O=C(CCNc1ccc(OC2CCC2)c(F)c1)Nc1ccccc1	ZINC000819457510	EI	On-Demand	Anodyne	HDAC3	18	40
O=C(CCNc1ccc(OC2CCC2)c(F)c1)Nc1ccccc1	ZINC000819457510	EI	On-Demand	Anodyne	HDAC6	19	40
O=C(CCNc1ccc(OC2CCC2)c(F)c1)Nc1ccccc1	ZINC000819457510	EI	On-Demand	Anodyne	MET	26	41
O=C(CCNc1ccc(OC2CCC2)c(F)c1)Nc1ccccc1	ZINC000819457510	EI	On-Demand	Anodyne	HDAC11	18	40
CC(C)(O)COc1ccc(NC[C@H](O)COCc2ccccc2Cl)cc1	ZINC000819457545	GG	On-Demand	Anodyne	ADRB1	24	41
CC(C)(O)COc1ccc(NC[C@H](O)COCc2ccccc2Cl)cc1	ZINC000819457545	GG	On-Demand	Anodyne	ADRB3	15	41
CC(C)(O)COc1ccc(NC[C@@H](O)COCc2ccccc2Cl)cc1	ZINC000819457547	GG	On-Demand	Anodyne	ADRB1	24	41
CC(C)(O)COc1ccc(NC[C@@H](O)COCc2ccccc2Cl)cc1	ZINC000819457547	GG	On-Demand	Anodyne	ADRB3	15	41
Cc1ccncc1[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819457551	FG	On-Demand	Mild	PAPA1_CARPA	43	43
Cc1ccncc1[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819457551	FG	On-Demand	Mild	CTSK	15	43
Cc1ccncc1[C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819457551	FG	On-Demand	Mild	FPR1	44	39
Cc1ccncc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819457553	FG	On-Demand	Mild	PAPA1_CARPA	43	43
Cc1ccncc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819457553	FG	On-Demand	Mild	CTSK	15	43
Cc1ccncc1[C@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819457553	FG	On-Demand	Mild	FPR1	44	39
Cc1ccncc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819457555	FG	On-Demand	Mild	PAPA1_CARPA	43	43
Cc1ccncc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819457555	FG	On-Demand	Mild	CTSK	15	43
Cc1ccncc1[C@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819457555	FG	On-Demand	Mild	FPR1	44	39
Cc1ccncc1[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819457557	FG	On-Demand	Mild	PAPA1_CARPA	43	43
Cc1ccncc1[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819457557	FG	On-Demand	Mild	CTSK	15	43
Cc1ccncc1[C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819457557	FG	On-Demand	Mild	FPR1	44	39
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)COc1cccc(C(F)(F)F)c1	ZINC000819457566	GH	On-Demand	Anodyne	PDS	44	39
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)COc1cccc(C(F)(F)F)c1	ZINC000819457568	GH	On-Demand	Anodyne	PDS	44	39
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819457570	FF	On-Demand	Mild	ADRB2	40	43
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819457570	FF	On-Demand	Mild	ADRB1	57	42
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)COc1cccc(C(F)(F)F)c1	ZINC000819457571	GH	On-Demand	Anodyne	PDS	44	39
O[C@H](CNc1ccccc1O[C@H]1CCOC1)COc1cccc(C(F)(F)F)c1	ZINC000819457572	GH	On-Demand	Anodyne	PDS	44	39
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819457573	FF	On-Demand	Mild	ADRB2	40	43
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819457573	FF	On-Demand	Mild	ADRB1	57	42
CC(C)(O)COc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819457576	GF	On-Demand	Bother	ADRB2	36	48
CC(C)(O)COc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819457576	GF	On-Demand	Bother	ADRB1	49	48
CC(C)(O)COc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819457576	GF	On-Demand	Bother	ADRB3	33	48
CC(C)(O)COc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819457576	GF	On-Demand	Bother	PDS	15	45
CC(C)(O)COc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819457581	GF	On-Demand	Bother	ADRB2	36	48
CC(C)(O)COc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819457581	GF	On-Demand	Bother	ADRB1	49	48
CC(C)(O)COc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819457581	GF	On-Demand	Bother	ADRB3	33	48
CC(C)(O)COc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819457581	GF	On-Demand	Bother	PDS	15	45
CC(C)(O)COc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819457583	EH	On-Demand	Anodyne	ADRB2	20	50
CC(C)(O)COc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819457583	EH	On-Demand	Anodyne	ADRB1	37	49
CC(C)(O)COc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819457583	EH	On-Demand	Anodyne	ADRB3	55	48
CC(C)(O)COc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819457585	EH	On-Demand	Anodyne	ADRB2	20	50
CC(C)(O)COc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819457585	EH	On-Demand	Anodyne	ADRB1	37	49
CC(C)(O)COc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819457585	EH	On-Demand	Anodyne	ADRB3	55	48
CCOc1cc(Cl)ccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819457600	EG	On-Demand	Mild	ADRB2	23	42
CCOc1cc(Cl)ccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819457600	EG	On-Demand	Mild	ADRB1	48	34
CCOc1cc(Cl)ccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819457602	EG	On-Demand	Mild	ADRB2	23	42
CCOc1cc(Cl)ccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819457602	EG	On-Demand	Mild	ADRB1	48	34
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819457605	FF	On-Demand	Mild	ADRB2	36	43
CC(C)(O)COc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819457605	FF	On-Demand	Mild	ADRB1	52	42
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819457610	FF	On-Demand	Mild	ADRB2	36	43
CC(C)(O)COc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819457610	FF	On-Demand	Mild	ADRB1	52	42
Cc1ccncc1[C@H](C)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819457632	CE	On-Demand	Anodyne	UL26	89	32
Cc1ccncc1[C@H](C)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819457632	CE	On-Demand	Anodyne	SCAF_EBVB9	76	32
Cc1ccncc1[C@H](C)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819457636	CE	On-Demand	Anodyne	UL26	89	32
Cc1ccncc1[C@H](C)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819457636	CE	On-Demand	Anodyne	SCAF_EBVB9	76	32
Cc1ccncc1[C@H](C)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819457638	CE	On-Demand	Anodyne	UL26	89	32
Cc1ccncc1[C@H](C)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819457638	CE	On-Demand	Anodyne	SCAF_EBVB9	76	32
Cc1ccncc1[C@H](C)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819457640	CE	On-Demand	Anodyne	UL26	89	32
Cc1ccncc1[C@H](C)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819457640	CE	On-Demand	Anodyne	SCAF_EBVB9	76	32
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819457663	FF	On-Demand	Anodyne	ADRB1	51	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819457663	FF	On-Demand	Anodyne	ABCB1	17	46
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819457665	FF	On-Demand	Anodyne	ADRB1	51	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819457665	FF	On-Demand	Anodyne	ABCB1	17	46
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819457666	FF	On-Demand	Anodyne	ADRB1	51	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819457666	FF	On-Demand	Anodyne	ABCB1	17	46
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819457668	FF	On-Demand	Anodyne	ADRB1	51	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819457668	FF	On-Demand	Anodyne	ABCB1	17	46
CC(C)(C)OC(=O)N1CCc2c(NC[C@H](O)c3cccc(F)c3)cccc21	ZINC000819457677	FI	On-Demand	Anodyne	KCNQ2	44	42
CC(C)(C)OC(=O)N1CCc2c(NC[C@@H](O)c3cccc(F)c3)cccc21	ZINC000819457679	FI	On-Demand	Anodyne	KCNQ2	44	42
CCn1c(NC(=O)/C=C\[C@@H]2CCCO2)nc2ccc(Br)cc21	ZINC000819457680	FG	On-Demand	Anodyne	ITK	35	40
CCn1c(NC(=O)/C=C/[C@H]2CCCO2)nc2ccc(Br)cc21	ZINC000819457682	FG	On-Demand	Anodyne	ITK	35	40
CCn1c(NC(=O)/C=C/[C@@H]2CCCO2)nc2ccc(Br)cc21	ZINC000819457684	FG	On-Demand	Anodyne	ITK	35	40
CCn1c(NC(=O)/C=C\[C@H]2CCCO2)nc2ccc(Br)cc21	ZINC000819457685	FG	On-Demand	Anodyne	ITK	35	40
CC(C)(O)COc1ccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819457701	GE	On-Demand	Anodyne	ADRB2	16	40
CC(C)(O)COc1ccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)cc1	ZINC000819457704	GE	On-Demand	Anodyne	ADRB2	16	40
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)COc1ccc(F)cc1	ZINC000819457715	EF	On-Demand	Anodyne	ADRB1	48	41
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)COc1ccc(F)cc1	ZINC000819457716	EF	On-Demand	Anodyne	ADRB1	48	41
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)COc1ccc(F)cc1	ZINC000819457717	EF	On-Demand	Anodyne	ADRB1	48	41
O[C@H](CNc1ccccc1O[C@H]1CCOC1)COc1ccc(F)cc1	ZINC000819457718	EF	On-Demand	Anodyne	ADRB1	48	41
CCOc1cc(Cl)ccc1NC[C@H](O)COc1c(OC)cccc1OC	ZINC000819457728	GH	On-Demand	Anodyne	ADRB2	25	43
CCOc1cc(Cl)ccc1NC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819457730	GH	On-Demand	Anodyne	ADRB2	25	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819457734	FF	On-Demand	Anodyne	ADRB2	45	49
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819457734	FF	On-Demand	Anodyne	ADRB1	68	49
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819457734	FF	On-Demand	Anodyne	ADRB3	40	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819457735	FF	On-Demand	Anodyne	ADRB2	45	49
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819457735	FF	On-Demand	Anodyne	ADRB1	68	49
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OCC(C)(C)O)cc2)cc1	ZINC000819457735	FF	On-Demand	Anodyne	ADRB3	40	42
CC[C@]1(C)COCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819457746	FF	On-Demand	Mild	PAPA1_CARPA	30	41
CC[C@]1(C)COCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819457750	FF	On-Demand	Mild	PAPA1_CARPA	30	41
Cc1ccc(OC[C@H](O)CNc2ccc(OCC(C)(C)O)cc2)c(C)c1	ZINC000819457765	FG	On-Demand	Anodyne	ADRB2	29	45
Cc1ccc(OC[C@@H](O)CNc2ccc(OCC(C)(C)O)cc2)c(C)c1	ZINC000819457767	FG	On-Demand	Anodyne	ADRB2	29	45
CCC(C)(C)OCc1cccc(NC[C@H](O)c2cccnc2)c1C	ZINC000819457770	EI	On-Demand	Anodyne	ADRB3	41	38
CCC(C)(C)OCc1cccc(NC[C@@H](O)c2cccnc2)c1C	ZINC000819457772	EI	On-Demand	Anodyne	ADRB3	41	38
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccccc2CCC(F)(F)F)cc1	ZINC000819457773	GH	On-Demand	Anodyne	CTSF	56	38
COCCNC(=O)c1ccccc1NC(=O)c1cc(-c2ccco2)nc2ccccc12	ZINC000819457774	HI	On-Demand	Anodyne	ADORA1	22	41
COCCNC(=O)c1ccccc1NC(=O)c1cc(-c2ccco2)nc2ccccc12	ZINC000819457774	HI	On-Demand	Anodyne	ADORA2A	30	41
COCCNC(=O)c1ccccc1NC(=O)c1cc(-c2ccco2)nc2ccccc12	ZINC000819457774	HI	On-Demand	Anodyne	ADORA2B	19	41
COCCNC(=O)c1ccccc1NC(=O)c1cc(-c2ccco2)nc2ccccc12	ZINC000819457774	HI	On-Demand	Anodyne	TACR3	18	56
COCCNC(=O)c1ccccc1NC(=O)c1cc(-c2ccco2)nc2ccccc12	ZINC000819457774	HI	On-Demand	Anodyne	POLR1A	53	36
CS(=O)(=O)c1ccc([C@H](O)CNc2ccccc2CCC(F)(F)F)cc1	ZINC000819457775	GH	On-Demand	Anodyne	CTSF	56	38
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1cccc(NC2CCCC2)c1	ZINC000819457788	GG	On-Demand	Anodyne	PTPN2	42	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000819457789	FC	On-Demand	Anodyne	CA2	29	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000819457789	FC	On-Demand	Anodyne	CA1	29	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000819457789	FC	On-Demand	Anodyne	CA12	22	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cc(S(N)(=O)=O)ccc1O	ZINC000819457789	FC	On-Demand	Anodyne	CA9	17	41
O[C@H](CNc1cccc(NC2CCCC2)c1)c1cccnc1	ZINC000819457798	CH	On-Demand	Anodyne	ADRB1	25	41
O[C@H](CNc1cccc(NC2CCCC2)c1)c1cccnc1	ZINC000819457798	CH	On-Demand	Anodyne	ADRB3	90	48
O[C@@H](CNc1cccc(NC2CCCC2)c1)c1cccnc1	ZINC000819457799	CH	On-Demand	Anodyne	ADRB1	25	41
O[C@@H](CNc1cccc(NC2CCCC2)c1)c1cccnc1	ZINC000819457799	CH	On-Demand	Anodyne	ADRB3	90	48
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC3CCC3)c(F)c2)cc1	ZINC000819457804	FH	On-Demand	Anodyne	ADRB2	32	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC3CCC3)c(F)c2)cc1	ZINC000819457804	FH	On-Demand	Anodyne	ADRB1	62	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC3CCC3)c(F)c2)cc1	ZINC000819457804	FH	On-Demand	Anodyne	PDE4D	15	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC3CCC3)c(F)c2)cc1	ZINC000819457805	FH	On-Demand	Anodyne	ADRB2	32	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC3CCC3)c(F)c2)cc1	ZINC000819457805	FH	On-Demand	Anodyne	ADRB1	62	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC3CCC3)c(F)c2)cc1	ZINC000819457805	FH	On-Demand	Anodyne	PDE4D	15	41
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819457820	GE	On-Demand	Anodyne	NCEH1	40	32
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819457821	GE	On-Demand	Anodyne	NCEH1	40	32
O[C@@H](CNc1ccc(OC2CCC2)c(F)c1)c1cccnc1	ZINC000819457839	DG	On-Demand	Anodyne	ADRB1	26	47
O[C@@H](CNc1ccc(OC2CCC2)c(F)c1)c1cccnc1	ZINC000819457839	DG	On-Demand	Anodyne	ADRB3	94	47
O[C@@H](CNc1ccc(OC2CCC2)c(F)c1)c1cccnc1	ZINC000819457839	DG	On-Demand	Anodyne	PDE4A	27	41
O[C@H](CNc1ccc(OC2CCC2)c(F)c1)c1cccnc1	ZINC000819457840	DG	On-Demand	Anodyne	ADRB1	26	47
O[C@H](CNc1ccc(OC2CCC2)c(F)c1)c1cccnc1	ZINC000819457840	DG	On-Demand	Anodyne	ADRB3	94	47
O[C@H](CNc1ccc(OC2CCC2)c(F)c1)c1cccnc1	ZINC000819457840	DG	On-Demand	Anodyne	PDE4A	27	41
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1cccnc1	ZINC000819457842	EE	On-Demand	Anodyne	ADRB1	18	41
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1cccnc1	ZINC000819457842	EE	On-Demand	Anodyne	ADRB3	54	41
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1cccnc1	ZINC000819457843	EE	On-Demand	Anodyne	ADRB1	18	41
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1cccnc1	ZINC000819457843	EE	On-Demand	Anodyne	ADRB3	54	41
N#CCc1ccc(OC[C@@H](O)CNc2ccc(OC3CCC3)c(F)c2)cc1	ZINC000819457848	FH	On-Demand	Mild	ADRB1	56	41
N#CCc1ccc(OC[C@H](O)CNc2ccc(OC3CCC3)c(F)c2)cc1	ZINC000819457849	FH	On-Demand	Mild	ADRB1	56	41
O[C@H](CNc1ccccc1O[C@H]1CCOC1)COc1ccccc1Cl	ZINC000819457851	FG	On-Demand	Anodyne	ADRB2	19	44
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)COc1ccccc1Cl	ZINC000819457853	FG	On-Demand	Anodyne	ADRB2	19	44
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)COc1ccccc1Cl	ZINC000819457854	FG	On-Demand	Anodyne	ADRB2	19	44
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)COc1ccccc1Cl	ZINC000819457855	FG	On-Demand	Anodyne	ADRB2	19	44
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC3CCC3)c(F)c2)cc1	ZINC000819457864	GH	On-Demand	Anodyne	ADRB2	39	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC3CCC3)c(F)c2)cc1	ZINC000819457864	GH	On-Demand	Anodyne	ADRB1	75	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC3CCC3)c(F)c2)cc1	ZINC000819457864	GH	On-Demand	Anodyne	TSHR	57	35
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC3CCC3)c(F)c2)cc1	ZINC000819457864	GH	On-Demand	Anodyne	ADRB3	45	45
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)c1ccc(Cl)cc1	ZINC000819457866	EH	On-Demand	Anodyne	CYP3A4	43	32
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC3CCC3)c(F)c2)cc1	ZINC000819457867	GH	On-Demand	Anodyne	ADRB2	39	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC3CCC3)c(F)c2)cc1	ZINC000819457867	GH	On-Demand	Anodyne	ADRB1	75	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC3CCC3)c(F)c2)cc1	ZINC000819457867	GH	On-Demand	Anodyne	TSHR	57	35
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC3CCC3)c(F)c2)cc1	ZINC000819457867	GH	On-Demand	Anodyne	ADRB3	45	45
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)c1ccc(Cl)cc1	ZINC000819457876	EH	On-Demand	Anodyne	CYP3A4	43	32
CC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819457891	FG	On-Demand	Anodyne	ADRB2	18	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819457891	FG	On-Demand	Anodyne	ADRB1	38	41
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819457892	FG	On-Demand	Anodyne	ADRB2	18	41
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819457892	FG	On-Demand	Anodyne	ADRB1	38	41
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819457924	GH	On-Demand	Anodyne	ADRB2	33	42
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819457924	GH	On-Demand	Anodyne	ADRB1	61	42
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819457924	GH	On-Demand	Anodyne	GRIN1	25	40
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819457924	GH	On-Demand	Anodyne	ADRB3	42	42
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819457925	GH	On-Demand	Anodyne	ADRB2	33	42
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819457925	GH	On-Demand	Anodyne	ADRB1	61	42
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819457925	GH	On-Demand	Anodyne	GRIN1	25	40
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819457925	GH	On-Demand	Anodyne	ADRB3	42	42
CCOc1cc(Cl)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819457932	FH	On-Demand	Mild	ADRB2	27	40
CCOc1cc(Cl)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819457932	FH	On-Demand	Mild	ADRB1	39	40
CCOc1cc(Cl)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819457932	FH	On-Demand	Mild	CASR	40	36
CCOc1cc(Cl)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819457933	FH	On-Demand	Mild	ADRB2	27	40
CCOc1cc(Cl)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819457933	FH	On-Demand	Mild	ADRB1	39	40
CCOc1cc(Cl)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819457933	FH	On-Demand	Mild	CASR	40	36
CCOc1cc(Cl)ccc1NCC1(O)CCS(=O)(=O)CC1	ZINC000819457980	EE	On-Demand	Anodyne	HCN1	40	31
CCOc1cc(Cl)ccc1NCC1(O)CCS(=O)(=O)CC1	ZINC000819457980	EE	On-Demand	Anodyne	HCN4	40	31
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)COc1ccc(Cl)c(Cl)c1	ZINC000819457989	GI	On-Demand	Anodyne	HRH1	21	40
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)COc1ccc(Cl)c(Cl)c1	ZINC000819457989	GI	On-Demand	Anodyne	CCR3	23	46
O[C@H](CNc1ccccc1O[C@H]1CCOC1)COc1ccc(Cl)c(Cl)c1	ZINC000819457990	GI	On-Demand	Anodyne	HRH1	21	40
O[C@H](CNc1ccccc1O[C@H]1CCOC1)COc1ccc(Cl)c(Cl)c1	ZINC000819457990	GI	On-Demand	Anodyne	CCR3	23	46
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)COc1ccc(Cl)c(Cl)c1	ZINC000819457991	GI	On-Demand	Anodyne	HRH1	21	40
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)COc1ccc(Cl)c(Cl)c1	ZINC000819457991	GI	On-Demand	Anodyne	CCR3	23	46
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)COc1ccc(Cl)c(Cl)c1	ZINC000819457992	GI	On-Demand	Anodyne	HRH1	21	40
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)COc1ccc(Cl)c(Cl)c1	ZINC000819457992	GI	On-Demand	Anodyne	CCR3	23	46
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819458058	GF	On-Demand	Anodyne	NOD2	43	41
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819458059	GF	On-Demand	Anodyne	NOD2	43	41
O[C@@H](CNc1ccc(OC2CCC2)c(F)c1)c1ccccc1	ZINC000819458070	DH	On-Demand	Anodyne	ADRB3	34	43
O[C@H](CNc1ccc(OC2CCC2)c(F)c1)c1ccccc1	ZINC000819458071	DH	On-Demand	Anodyne	ADRB3	34	43
CCOc1cc(Cl)ccc1NC[C@@H](O)CN1CCOCC1	ZINC000819458091	DD	On-Demand	Anodyne	CCR1	48	42
CCOc1cc(Cl)ccc1NC[C@H](O)CN1CCOCC1	ZINC000819458093	DD	On-Demand	Anodyne	CCR1	48	42
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819458097	FF	On-Demand	Mild	ADRB1	45	38
N#CCc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819458099	FF	On-Demand	Mild	ADRB1	45	38
N#CCc1ccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819458101	FF	On-Demand	Mild	ADRB1	45	38
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819458104	FF	On-Demand	Mild	ADRB1	45	38
O=C(CCNc1ccc(OC2CCC2)c(F)c1)Nc1cccnc1	ZINC000819458115	EH	On-Demand	Anodyne	PDE4A	21	41
COc1cccc(OC)c1OC[C@H](O)CNc1ccccc1O[C@H]1CCOC1	ZINC000819458120	GF	On-Demand	Anodyne	ADRB1	24	40
COc1cccc(OC)c1OC[C@@H](O)CNc1ccccc1O[C@H]1CCOC1	ZINC000819458121	GF	On-Demand	Anodyne	ADRB1	24	40
COc1cccc(OC)c1OC[C@H](O)CNc1ccccc1O[C@@H]1CCOC1	ZINC000819458122	GF	On-Demand	Anodyne	ADRB1	24	40
COc1cccc(OC)c1OC[C@@H](O)CNc1ccccc1O[C@@H]1CCOC1	ZINC000819458123	GF	On-Demand	Anodyne	ADRB1	24	40
O=[N+]([O-])c1cccc([C@@H](O)CNc2cccc(OCCF)c2)c1	ZINC000819458136	DG	On-Demand	Bother	ACR	17	40
O=[N+]([O-])c1cccc([C@H](O)CNc2cccc(OCCF)c2)c1	ZINC000819458137	DG	On-Demand	Bother	ACR	17	40
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819458160	GF	On-Demand	Mild	PAPA1_CARPA	37	44
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819458161	GF	On-Demand	Mild	PAPA1_CARPA	37	44
COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819458162	GF	On-Demand	Mild	PAPA1_CARPA	37	44
COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819458164	GF	On-Demand	Mild	PAPA1_CARPA	37	44
O=C(/C=C\c1cccc(O)c1)N1CC(C(F)(F)F)C1	ZINC000819458184	CE	On-Demand	Anodyne	ITGAL	67	34
O=C(/C=C/c1cccc(O)c1)N1CC(C(F)(F)F)C1	ZINC000819458185	CE	On-Demand	Anodyne	ITGAL	67	34
C[C@@](O)(CC(=O)N1CC(C(F)(F)F)C1)c1ccccc1	ZINC000819458206	CE	On-Demand	Anodyne	AMY2	54	31
O=C(NCCn1cnnn1)c1cc(F)cc(Cl)c1	ZINC000819458228	CC	On-Demand	Anodyne	CACNA1I	59	36
O=C(NC[C@H]1CCCNC1=O)c1cc(-c2ccccc2)nc2cc(F)ccc12	ZINC000819458242	GG	On-Demand	Anodyne	ACACB	15	47
O=C(NC[C@H]1CCCNC1=O)c1cc(-c2ccccc2)nc2cc(F)ccc12	ZINC000819458242	GG	On-Demand	Anodyne	TACR3	25	46
O=C(NC[C@H]1CCCNC1=O)c1cc(-c2ccccc2)nc2cc(F)ccc12	ZINC000819458242	GG	On-Demand	Anodyne	VCP	35	41
C[C@@H](CC(=O)N(CC(F)F)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819458257	EH	On-Demand	Anodyne	CTSK	15	42
C[C@@H](CC(=O)N(CC(F)F)c1ccccc1)NC(=O)OC(C)(C)C	ZINC000819458257	EH	On-Demand	Anodyne	FPR1	46	38
O[C@H](CNc1ccccc1O[C@H]1CCOC1)COc1cccc2ccccc12	ZINC000819458293	GH	On-Demand	Anodyne	ADRB2	24	51
O[C@H](CNc1ccccc1O[C@H]1CCOC1)COc1cccc2ccccc12	ZINC000819458293	GH	On-Demand	Anodyne	ADRB1	25	51
O[C@H](CNc1ccccc1O[C@H]1CCOC1)COc1cccc2ccccc12	ZINC000819458293	GH	On-Demand	Anodyne	CYP2D6	15	43
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)COc1cccc2ccccc12	ZINC000819458294	GH	On-Demand	Anodyne	ADRB2	24	51
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)COc1cccc2ccccc12	ZINC000819458294	GH	On-Demand	Anodyne	ADRB1	25	51
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)COc1cccc2ccccc12	ZINC000819458294	GH	On-Demand	Anodyne	CYP2D6	15	43
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)COc1cccc2ccccc12	ZINC000819458295	GH	On-Demand	Anodyne	ADRB2	24	51
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)COc1cccc2ccccc12	ZINC000819458295	GH	On-Demand	Anodyne	ADRB1	25	51
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)COc1cccc2ccccc12	ZINC000819458295	GH	On-Demand	Anodyne	CYP2D6	15	43
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)COc1cccc2ccccc12	ZINC000819458296	GH	On-Demand	Anodyne	ADRB2	24	51
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)COc1cccc2ccccc12	ZINC000819458296	GH	On-Demand	Anodyne	ADRB1	25	51
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)COc1cccc2ccccc12	ZINC000819458296	GH	On-Demand	Anodyne	CYP2D6	15	43
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)COc1ccccc1	ZINC000819458328	EF	On-Demand	Anodyne	ADRB2	40	44
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)COc1ccccc1	ZINC000819458328	EF	On-Demand	Anodyne	ADRB1	56	41
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)COc1ccccc1	ZINC000819458330	EF	On-Demand	Anodyne	ADRB2	40	44
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)COc1ccccc1	ZINC000819458330	EF	On-Demand	Anodyne	ADRB1	56	41
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)COc1ccccc1	ZINC000819458332	EF	On-Demand	Anodyne	ADRB2	40	44
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)COc1ccccc1	ZINC000819458332	EF	On-Demand	Anodyne	ADRB1	56	41
O[C@H](CNc1ccccc1O[C@H]1CCOC1)COc1ccccc1	ZINC000819458334	EF	On-Demand	Anodyne	ADRB2	40	44
O[C@H](CNc1ccccc1O[C@H]1CCOC1)COc1ccccc1	ZINC000819458334	EF	On-Demand	Anodyne	ADRB1	56	41
COCCNC(=O)c1ccccc1NC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819458365	JD	On-Demand	Anodyne	TGM2	54	37
COCCNC(=O)c1ccccc1NC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819458365	JD	On-Demand	Anodyne	HCAR2	35	42
COCCNC(=O)c1ccccc1NC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819458365	JD	On-Demand	Anodyne	F13A1	51	36
COCCNC(=O)c1ccccc1NC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819458365	JD	On-Demand	Anodyne	NAMPT	40	42
CCOc1ccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819458368	FG	On-Demand	Anodyne	ADRB1	50	42
CCOc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819458370	FG	On-Demand	Anodyne	ADRB1	50	42
CCOc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819458372	FG	On-Demand	Anodyne	ADRB1	50	42
CCOc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819458374	FG	On-Demand	Anodyne	ADRB1	50	42
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)NCCCCC(N)=O)nn2)C1	ZINC000819458376	GD	On-Demand	Anodyne	SSTR2	41	32
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)NCCCCC(N)=O)nn2)C1	ZINC000819458376	GD	On-Demand	Anodyne	PREP	15	40
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)NCCCCC(N)=O)nn2)C1	ZINC000819458378	GD	On-Demand	Anodyne	SSTR2	41	32
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)NCCCCC(N)=O)nn2)C1	ZINC000819458378	GD	On-Demand	Anodyne	PREP	15	40
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc(OC2CCC2)c(F)c1	ZINC000819458409	GH	On-Demand	Anodyne	PDE4A	42	35
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc(OC2CCC2)c(F)c1	ZINC000819458409	GH	On-Demand	Anodyne	PDE4D	31	42
COc1cccc(OC)c1OC[C@H](O)CNc1ccc(OC2CCC2)c(F)c1	ZINC000819458411	GH	On-Demand	Anodyne	PDE4A	42	35
COc1cccc(OC)c1OC[C@H](O)CNc1ccc(OC2CCC2)c(F)c1	ZINC000819458411	GH	On-Demand	Anodyne	PDE4D	31	42
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)Cc1ccccc1	ZINC000819458443	EF	On-Demand	Anodyne	PDS	52	32
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)Cc1ccccc1	ZINC000819458444	EF	On-Demand	Anodyne	PDS	52	32
CCOc1ccc(C(=O)N(C)C)cc1NCC1(O)CCCCC1	ZINC000819458454	DF	On-Demand	Anodyne	HCN1	45	35
CCOc1ccc(C(=O)N(C)C)cc1NCC1(O)CCCCC1	ZINC000819458454	DF	On-Demand	Anodyne	HCN4	45	35
O=C(NCCn1cnnn1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819458474	FC	On-Demand	Anodyne	CNR2	15	43
O=C(NCCn1cnnn1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819458474	FC	On-Demand	Anodyne	PLD1	41	39
O=C(NCCn1cnnn1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819458474	FC	On-Demand	Anodyne	PLD2	54	37
O=C(COc1ccc(OCc2ccccc2)cc1)NCCn1cnnn1	ZINC000819458477	FD	On-Demand	Anodyne	MAOB	18	41
O=C(COc1ccc(OCc2ccccc2)cc1)NCCn1cnnn1	ZINC000819458477	FD	On-Demand	Anodyne	ADORA1	15	40
O=C(COc1ccc(OCc2ccccc2)cc1)NCCn1cnnn1	ZINC000819458477	FD	On-Demand	Anodyne	LTA4H	26	44
O=C(COc1ccc(OCc2ccccc2)cc1)NCCn1cnnn1	ZINC000819458477	FD	On-Demand	Anodyne	ADORA2B	18	40
O=C(COc1ccc(OCc2ccccc2)cc1)NCCn1cnnn1	ZINC000819458477	FD	On-Demand	Anodyne	CAPN2	41	31
O=C(COc1ccc(OCc2ccccc2)cc1)NCCn1cnnn1	ZINC000819458477	FD	On-Demand	Anodyne	FFAR1	32	42
O=C(c1cc(-c2ccccc2)nc2cc(F)ccc12)N1CC(C(F)(F)F)C1	ZINC000819458482	FJ	On-Demand	Anodyne	DHODH	41	50
O=C(c1cc(-c2ccccc2)nc2cc(F)ccc12)N1CC(C(F)(F)F)C1	ZINC000819458482	FJ	On-Demand	Anodyne	PRS	46	39
O=C(c1cc(-c2ccccc2)nc2cc(F)ccc12)N1CC(C(F)(F)F)C1	ZINC000819458482	FJ	On-Demand	Anodyne	TACR3	19	42
NS(=O)(=O)c1ccc(C(=O)NCCn2cnnn2)cc1	ZINC000819458488	CA	On-Demand	Anodyne	CA2	106	54
NS(=O)(=O)c1ccc(C(=O)NCCn2cnnn2)cc1	ZINC000819458488	CA	On-Demand	Anodyne	CA1	80	54
NS(=O)(=O)c1ccc(C(=O)NCCn2cnnn2)cc1	ZINC000819458488	CA	On-Demand	Anodyne	CA7	55	46
NS(=O)(=O)c1ccc(C(=O)NCCn2cnnn2)cc1	ZINC000819458488	CA	On-Demand	Anodyne	CA4	65	54
NS(=O)(=O)c1ccc(C(=O)NCCn2cnnn2)cc1	ZINC000819458488	CA	On-Demand	Anodyne	CA14	67	49
NS(=O)(=O)c1ccc(C(=O)NCCn2cnnn2)cc1	ZINC000819458488	CA	On-Demand	Anodyne	CA12	59	54
NS(=O)(=O)c1ccc(C(=O)NCCn2cnnn2)cc1	ZINC000819458488	CA	On-Demand	Anodyne	CA9	66	54
NS(=O)(=O)c1ccc(C(=O)NCCn2cnnn2)cc1	ZINC000819458488	CA	On-Demand	Anodyne	CYNT	44	48
NS(=O)(=O)c1ccc(C(=O)NCCn2cnnn2)cc1	ZINC000819458488	CA	On-Demand	Anodyne	P96878_MYCTU	41	35
NS(=O)(=O)c1ccc(C(=O)NCCn2cnnn2)cc1	ZINC000819458488	CA	On-Demand	Anodyne	A6YCJ1_9METZ	18	54
O=C(NCCn1cnnn1)c1ccccc1Nc1cccc(C(F)(F)F)c1	ZINC000819458493	GF	On-Demand	Anodyne	AKR1C3	16	54
O=C(NCCn1cnnn1)c1ccccc1Nc1cccc(C(F)(F)F)c1	ZINC000819458493	GF	On-Demand	Anodyne	AKR1C2	20	54
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCCn1cnnn1	ZINC000819458496	FC	On-Demand	Anodyne	EDNRB	48	32
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCCn1cnnn1	ZINC000819458496	FC	On-Demand	Anodyne	MC4R	38	42
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCCn1cnnn1	ZINC000819458496	FC	On-Demand	Anodyne	CCKAR	47	39
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCCn1cnnn1	ZINC000819458496	FC	On-Demand	Anodyne	MPO	45	36
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCCn1cnnn1	ZINC000819458496	FC	On-Demand	Anodyne	BRS3	28	44
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCCn1cnnn1	ZINC000819458496	FC	On-Demand	Anodyne	NMBR	15	41
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCCn1cnnn1	ZINC000819458496	FC	On-Demand	Anodyne	MC3R	59	42
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCCn1cnnn1	ZINC000819458496	FC	On-Demand	Anodyne	MC5R	61	42
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCCn1cnnn1	ZINC000819458496	FC	On-Demand	Anodyne	MMP2	16	40
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCCn1cnnn1	ZINC000819458496	FC	On-Demand	Anodyne	GRPR	74	40
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCCn1cnnn1	ZINC000819458496	FC	On-Demand	Anodyne	MC1R	83	42
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCCn1cnnn1	ZINC000819458496	FC	On-Demand	Anodyne	KISS1R	71	36
O=C(NCCn1cnnn1)c1cc(-c2ccccc2)nc2cc(F)ccc12	ZINC000819458505	FE	On-Demand	Anodyne	DHODH	32	46
O=C(NCCn1cnnn1)c1cc(-c2ccccc2)nc2cc(F)ccc12	ZINC000819458505	FE	On-Demand	Anodyne	TACR3	34	49
O=C(NCCn1cnnn1)c1cc(-c2ccccc2)nc2cc(F)ccc12	ZINC000819458505	FE	On-Demand	Anodyne	POLR1A	41	34
Cc1cc(C(=O)NCCn2cnnn2)nn1-c1ccc(Cl)c(Cl)c1	ZINC000819458509	FD	On-Demand	Anodyne	CNR1	21	45
Cc1cc(C(=O)NCCn2cnnn2)nn1-c1ccc(Cl)c(Cl)c1	ZINC000819458509	FD	On-Demand	Anodyne	RPA1	94	39
CCCOc1cccc(CC(=O)NCCn2cnnn2)c1	ZINC000819458512	CC	On-Demand	Anodyne	HRH2	45	43
CCCOc1cccc(CC(=O)NCCn2cnnn2)c1	ZINC000819458512	CC	On-Demand	Anodyne	MTNR1A	30	44
CCCOc1cccc(CC(=O)NCCn2cnnn2)c1	ZINC000819458512	CC	On-Demand	Anodyne	PLA2G4B	25	40
CCCOc1cccc(CC(=O)NCCn2cnnn2)c1	ZINC000819458512	CC	On-Demand	Anodyne	PDS	60	34
COc1ccc(-c2cncc(C(=O)NCCn3cnnn3)c2)cc1	ZINC000819458536	DD	On-Demand	Anodyne	DRD4	46	35
COc1ccc(-c2cncc(C(=O)NCCn3cnnn3)c2)cc1	ZINC000819458536	DD	On-Demand	Anodyne	CYP11B2	17	47
COc1ccc(-c2cncc(C(=O)NCCn3cnnn3)c2)cc1	ZINC000819458536	DD	On-Demand	Anodyne	SCN10A	57	39
COc1cccc([C@H](C)C(=O)NCCn2cnnn2)c1	ZINC000819458555	CC	On-Demand	Anodyne	DRD4	46	35
COc1cccc([C@H](C)C(=O)NCCn2cnnn2)c1	ZINC000819458555	CC	On-Demand	Anodyne	MTNR1A	54	42
COc1cccc([C@H](C)C(=O)NCCn2cnnn2)c1	ZINC000819458555	CC	On-Demand	Anodyne	MTNR1B	54	42
COc1cccc([C@@H](C)C(=O)NCCn2cnnn2)c1	ZINC000819458556	CC	On-Demand	Anodyne	DRD4	46	35
COc1cccc([C@@H](C)C(=O)NCCn2cnnn2)c1	ZINC000819458556	CC	On-Demand	Anodyne	MTNR1A	54	42
COc1cccc([C@@H](C)C(=O)NCCn2cnnn2)c1	ZINC000819458556	CC	On-Demand	Anodyne	MTNR1B	54	42
O=C(NCCn1cnnn1)[C@@H](Oc1ccc(Cl)cc1)c1ccccc1	ZINC000819458563	FE	On-Demand	Anodyne	PLA2G4A	22	42
O=C(NCCn1cnnn1)[C@H](Oc1ccc(Cl)cc1)c1ccccc1	ZINC000819458565	FE	On-Demand	Anodyne	PLA2G4A	22	42
CC(=O)Nc1cccc(CC(=O)N(C)c2ccc(N(C)C)cc2)c1	ZINC000819458573	EF	On-Demand	Anodyne	KCNK3	19	47
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819458584	FG	On-Demand	Anodyne	ADRB2	27	52
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819458584	FG	On-Demand	Anodyne	ADRB1	56	52
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819458584	FG	On-Demand	Anodyne	ADRB3	34	45
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819458584	FG	On-Demand	Anodyne	CCR1	41	39
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819458585	FG	On-Demand	Anodyne	ADRB2	27	52
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819458585	FG	On-Demand	Anodyne	ADRB1	56	52
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819458585	FG	On-Demand	Anodyne	ADRB3	34	45
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819458585	FG	On-Demand	Anodyne	CCR1	41	39
O[C@H](CNc1ccccc1O[C@H]1CCOC1)COc1ccccc1C(F)(F)F	ZINC000819458610	GH	On-Demand	Anodyne	SCD	22	41
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)COc1ccccc1C(F)(F)F	ZINC000819458611	GH	On-Demand	Anodyne	SCD	22	41
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)COc1ccccc1C(F)(F)F	ZINC000819458612	GH	On-Demand	Anodyne	SCD	22	41
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)COc1ccccc1C(F)(F)F	ZINC000819458613	GH	On-Demand	Anodyne	SCD	22	41
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OC3CCC3)c(F)c2)cc1	ZINC000819458669	FG	On-Demand	Mild	ADRB1	43	39
N#Cc1ccc(OC[C@H](O)CNc2ccc(OC3CCC3)c(F)c2)cc1	ZINC000819458670	FG	On-Demand	Mild	ADRB1	43	39
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)Cc1ccc2ccccc2c1	ZINC000819458677	GH	On-Demand	Anodyne	CASR	43	39
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)Cc1ccc2ccccc2c1	ZINC000819458678	GH	On-Demand	Anodyne	CASR	43	39
CCOc1ccc(C(=O)N(C)C)cc1NCC(C)(C)O	ZINC000819458687	CD	On-Demand	Anodyne	NCEH1	42	34
COc1ccc(OCC(F)(F)C(F)F)c(C(=O)Nc2ccon2)c1	ZINC000819458688	EG	On-Demand	Anodyne	KDR	20	44
O=C(COc1ccccc1NC[C@H](O)CN1CCOCC1)N1CCOCC1	ZINC000819458697	GC	On-Demand	Clean	ABCB1	46	42
O=C(COc1ccccc1NC[C@@H](O)CN1CCOCC1)N1CCOCC1	ZINC000819458698	GC	On-Demand	Clean	ABCB1	46	42
O[C@@H](CNc1ccc(OC2CCC2)c(F)c1)COc1ccccc1	ZINC000819458703	EH	On-Demand	Anodyne	ADRB2	51	44
O[C@@H](CNc1ccc(OC2CCC2)c(F)c1)COc1ccccc1	ZINC000819458703	EH	On-Demand	Anodyne	ADRB1	79	41
O[C@@H](CNc1ccc(OC2CCC2)c(F)c1)COc1ccccc1	ZINC000819458703	EH	On-Demand	Anodyne	ADRB3	52	41
O[C@H](CNc1ccc(OC2CCC2)c(F)c1)COc1ccccc1	ZINC000819458704	EH	On-Demand	Anodyne	ADRB2	51	44
O[C@H](CNc1ccc(OC2CCC2)c(F)c1)COc1ccccc1	ZINC000819458704	EH	On-Demand	Anodyne	ADRB1	79	41
O[C@H](CNc1ccc(OC2CCC2)c(F)c1)COc1ccccc1	ZINC000819458704	EH	On-Demand	Anodyne	ADRB3	52	41
NS(=O)(=O)c1ccc(O)c(NC(=O)C(F)=C2CCC2)c1	ZINC000819458732	DD	On-Demand	Anodyne	CA2	58	43
NS(=O)(=O)c1ccc(O)c(NC(=O)C(F)=C2CCC2)c1	ZINC000819458732	DD	On-Demand	Anodyne	CA1	51	42
NS(=O)(=O)c1ccc(O)c(NC(=O)C(F)=C2CCC2)c1	ZINC000819458732	DD	On-Demand	Anodyne	CA7	37	42
NS(=O)(=O)c1ccc(O)c(NC(=O)C(F)=C2CCC2)c1	ZINC000819458732	DD	On-Demand	Anodyne	CA4	66	43
NS(=O)(=O)c1ccc(O)c(NC(=O)C(F)=C2CCC2)c1	ZINC000819458732	DD	On-Demand	Anodyne	CA5A	42	37
NS(=O)(=O)c1ccc(O)c(NC(=O)C(F)=C2CCC2)c1	ZINC000819458732	DD	On-Demand	Anodyne	CA14	27	42
NS(=O)(=O)c1ccc(O)c(NC(=O)C(F)=C2CCC2)c1	ZINC000819458732	DD	On-Demand	Anodyne	CA12	33	42
NS(=O)(=O)c1ccc(O)c(NC(=O)C(F)=C2CCC2)c1	ZINC000819458732	DD	On-Demand	Anodyne	MTCA1	44	41
NS(=O)(=O)c1ccc(O)c(NC(=O)C(F)=C2CCC2)c1	ZINC000819458732	DD	On-Demand	Anodyne	P96878_MYCTU	54	41
CCOc1ccc(C(=O)N(C)C)cc1NCC1(O)CCCC1	ZINC000819458745	DF	On-Demand	Anodyne	HCN1	43	33
CCOc1ccc(C(=O)N(C)C)cc1NCC1(O)CCCC1	ZINC000819458745	DF	On-Demand	Anodyne	HCN4	43	33
C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)NCCn1cnnn1	ZINC000819458768	ED	On-Demand	Anodyne	MC4R	55	38
C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)NCCn1cnnn1	ZINC000819458768	ED	On-Demand	Anodyne	P2RX7	35	41
O=C(NCCn1cnnn1)[C@@H]1CCCN(C(=O)c2ccncc2)C1	ZINC000819458775	EB	On-Demand	Anodyne	L3MBTL3	40	33
O=C(NCCn1cnnn1)[C@H]1CCCN(C(=O)c2ccncc2)C1	ZINC000819458776	EB	On-Demand	Anodyne	L3MBTL3	40	33
NC(=O)c1csc(C(=O)NCCn2cnnn2)c1	ZINC000819458825	CB	On-Demand	Anodyne	SIRT2	41	37
COCCNC(=O)c1ccccc1NC(=O)c1cc(-c2ccccc2)nn1-c1ccccc1	ZINC000819458853	II	On-Demand	Anodyne	POLR1A	53	37
O[C@@H](CNc1cccc(OCCF)c1)c1ccc(C(F)(F)F)cc1	ZINC000819458877	EI	On-Demand	Anodyne	PDS	40	38
O[C@H](CNc1cccc(OCCF)c1)c1ccc(C(F)(F)F)cc1	ZINC000819458878	EI	On-Demand	Anodyne	PDS	40	38
O=C(c1ccc(-n2cnc3ccccc32)nc1)N1CC(C(F)(F)F)C1	ZINC000819458892	EG	On-Demand	Anodyne	HPGD	47	47
N#Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819458896	FF	On-Demand	Mild	ADRB1	52	35
N#Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819458897	FF	On-Demand	Mild	ADRB1	52	35
N#Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819458898	FF	On-Demand	Mild	ADRB1	52	35
N#Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819458899	FF	On-Demand	Mild	ADRB1	52	35
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819458903	GE	On-Demand	Anodyne	ADRB2	39	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819458903	GE	On-Demand	Anodyne	ADRB1	55	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819458903	GE	On-Demand	Anodyne	ADRB3	34	40
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819458905	GE	On-Demand	Anodyne	ADRB2	39	41
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819458905	GE	On-Demand	Anodyne	ADRB1	55	44
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819458905	GE	On-Demand	Anodyne	ADRB3	34	40
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819458906	GE	On-Demand	Anodyne	ADRB2	39	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819458906	GE	On-Demand	Anodyne	ADRB1	55	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819458906	GE	On-Demand	Anodyne	ADRB3	34	40
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819458908	GE	On-Demand	Anodyne	ADRB2	39	41
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819458908	GE	On-Demand	Anodyne	ADRB1	55	44
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819458908	GE	On-Demand	Anodyne	ADRB3	34	40
O=C(Nn1cnnc1)C1(c2ccc(Cl)cc2Cl)CCCCC1	ZINC000819458923	EH	On-Demand	Anodyne	CNR1	54	33
O=C(Nn1cnnc1)C1(c2ccc(Cl)cc2Cl)CCCCC1	ZINC000819458923	EH	On-Demand	Anodyne	UGCG	36	43
O=[N+]([O-])c1cccc([C@H](O)CNc2ccccc2O[C@H]2CCOC2)c1	ZINC000819458927	EF	On-Demand	Bother	CYP3A4	43	32
O=[N+]([O-])c1cccc([C@H](O)CNc2ccccc2O[C@@H]2CCOC2)c1	ZINC000819458928	EF	On-Demand	Bother	CYP3A4	43	32
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccccc2O[C@H]2CCOC2)c1	ZINC000819458930	EF	On-Demand	Bother	CYP3A4	43	32
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)c1	ZINC000819458932	EF	On-Demand	Bother	CYP3A4	43	32
CCOc1cc(Cl)ccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819458933	FH	On-Demand	Anodyne	ADRB2	28	46
CCOc1cc(Cl)ccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819458933	FH	On-Demand	Anodyne	ADRB1	42	37
CCOc1cc(Cl)ccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819458935	FH	On-Demand	Anodyne	ADRB2	28	46
CCOc1cc(Cl)ccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819458935	FH	On-Demand	Anodyne	ADRB1	42	37
CCCOc1nc2ccccc2cc1/C=C/C(=O)N1CC(C(F)(F)F)C1	ZINC000819458952	FI	On-Demand	Anodyne	ITGAL	52	33
CCCOc1nc2ccccc2cc1/C=C\C(=O)N1CC(C(F)(F)F)C1	ZINC000819458953	FI	On-Demand	Anodyne	ITGAL	52	33
O=C(NCCn1cnnn1)c1ccc2c(c1)C(=O)N(C1CCCCC1)C2=O	ZINC000819458954	FD	On-Demand	Anodyne	PLD1	44	35
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819458965	GF	On-Demand	Anodyne	MTNR1A	34	42
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)c1cc(OC)ccc1OC	ZINC000819458965	GF	On-Demand	Anodyne	MTNR1B	28	40
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1cc(OC)ccc1OC	ZINC000819458966	GF	On-Demand	Anodyne	MTNR1A	34	42
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1cc(OC)ccc1OC	ZINC000819458966	GF	On-Demand	Anodyne	MTNR1B	28	40
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)c1ccc(Cl)cc1	ZINC000819458974	FH	On-Demand	Anodyne	UTS2	42	33
NC(=O)CCNc1ccc(OC2CCC2)c(F)c1	ZINC000819459005	CE	On-Demand	Anodyne	PDE4D	20	41
O=C(COc1ccccc1NC[C@H](O)COc1ccccc1)N1CCOCC1	ZINC000819459006	GD	On-Demand	Clean	ADRB2	37	47
O=C(COc1ccccc1NC[C@H](O)COc1ccccc1)N1CCOCC1	ZINC000819459006	GD	On-Demand	Clean	ADRB1	47	47
O=C(COc1ccccc1NC[C@H](O)COc1ccccc1)N1CCOCC1	ZINC000819459006	GD	On-Demand	Clean	ADRB3	35	41
O=C(COc1ccccc1NC[C@H](O)COc1ccccc1)N1CCOCC1	ZINC000819459006	GD	On-Demand	Clean	ABCB1	44	36
O=C(COc1ccccc1NC[C@@H](O)COc1ccccc1)N1CCOCC1	ZINC000819459007	GD	On-Demand	Clean	ADRB2	37	47
O=C(COc1ccccc1NC[C@@H](O)COc1ccccc1)N1CCOCC1	ZINC000819459007	GD	On-Demand	Clean	ADRB1	47	47
O=C(COc1ccccc1NC[C@@H](O)COc1ccccc1)N1CCOCC1	ZINC000819459007	GD	On-Demand	Clean	ADRB3	35	41
O=C(COc1ccccc1NC[C@@H](O)COc1ccccc1)N1CCOCC1	ZINC000819459007	GD	On-Demand	Clean	ABCB1	44	36
O[C@@H](CNc1ccc(OC2CCC2)c(F)c1)COc1ccccc1F	ZINC000819459035	EH	On-Demand	Anodyne	ADRB2	26	41
O[C@@H](CNc1ccc(OC2CCC2)c(F)c1)COc1ccccc1F	ZINC000819459035	EH	On-Demand	Anodyne	ADRB1	58	35
O[C@H](CNc1ccc(OC2CCC2)c(F)c1)COc1ccccc1F	ZINC000819459036	EH	On-Demand	Anodyne	ADRB2	26	41
O[C@H](CNc1ccc(OC2CCC2)c(F)c1)COc1ccccc1F	ZINC000819459036	EH	On-Demand	Anodyne	ADRB1	58	35
O=C(CCNc1ccc(OC2CCC2)c(F)c1)Nc1ccccc1F	ZINC000819459037	EI	On-Demand	Anodyne	DGAT1	18	40
CCOc1ccc(C(=O)N(C)C)cc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819459047	GG	On-Demand	Anodyne	PDS	44	38
CCOc1ccc(C(=O)N(C)C)cc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819459048	GG	On-Demand	Anodyne	PDS	44	38
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC3CCC3)c(F)c2)c1	ZINC000819459057	FH	On-Demand	Anodyne	ADRB2	28	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC3CCC3)c(F)c2)c1	ZINC000819459057	FH	On-Demand	Anodyne	ADRB1	57	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC3CCC3)c(F)c2)c1	ZINC000819459058	FH	On-Demand	Anodyne	ADRB2	28	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC3CCC3)c(F)c2)c1	ZINC000819459058	FH	On-Demand	Anodyne	ADRB1	57	40
CCOc1cc(Cl)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819459113	GH	On-Demand	Anodyne	ADRB2	41	55
CCOc1cc(Cl)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819459113	GH	On-Demand	Anodyne	ADRB1	71	55
CCOc1cc(Cl)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819459113	GH	On-Demand	Anodyne	GRIN1	28	41
CCOc1cc(Cl)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819459113	GH	On-Demand	Anodyne	ADRB3	44	48
CCOc1cc(Cl)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819459114	GH	On-Demand	Anodyne	ADRB2	41	55
CCOc1cc(Cl)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819459114	GH	On-Demand	Anodyne	ADRB1	71	55
CCOc1cc(Cl)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819459114	GH	On-Demand	Anodyne	GRIN1	28	41
CCOc1cc(Cl)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819459114	GH	On-Demand	Anodyne	ADRB3	44	48
COCCNC(=O)c1ccccc1NC(=O)c1ccc(N2C(=O)c3ccccc3C2=O)cc1	ZINC000819459160	IG	On-Demand	Anodyne	F10	16	43
COCCNC(=O)c1ccccc1NC(=O)c1ccc(N2C(=O)c3ccccc3C2=O)cc1	ZINC000819459160	IG	On-Demand	Anodyne	HDAC1	18	42
O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)NCCn1cnnn1	ZINC000819459184	EE	On-Demand	Anodyne	HDAC8	18	42
O=C(NCCn1cnnn1)[C@H](O)Cc1cccc(C(F)(F)F)c1	ZINC000819459185	EC	On-Demand	Anodyne	SCD1	17	43
O=C(NCCn1cnnn1)[C@H](O)Cc1cccc(C(F)(F)F)c1	ZINC000819459185	EC	On-Demand	Anodyne	PDS	43	38
O=C(NCCn1cnnn1)[C@@H](O)Cc1cccc(C(F)(F)F)c1	ZINC000819459187	EC	On-Demand	Anodyne	SCD1	17	43
O=C(NCCn1cnnn1)[C@@H](O)Cc1cccc(C(F)(F)F)c1	ZINC000819459187	EC	On-Demand	Anodyne	PDS	43	38
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NC[C@H]2CCCNC2=O)ccc1F	ZINC000819459189	GD	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NC[C@@H]2CCCNC2=O)ccc1F	ZINC000819459191	GD	On-Demand	Anodyne	CACNA1I	42	32
CCOc1cc(Cl)ccc1NCCS(=O)(=O)CC	ZINC000819459197	CF	On-Demand	Anodyne	HRP1_PLAFA	44	32
O=C(NCCn1cnnn1)C1(OCc2ccccc2)CCOCC1	ZINC000819459202	EC	On-Demand	Anodyne	CAPN1	25	41
O=C(NCCn1cnnn1)C1(OCc2ccccc2)CCOCC1	ZINC000819459202	EC	On-Demand	Anodyne	CAPN2	67	38
CC(C)(C)OC(=O)N1CCN(CCC(=O)NCCn2cnnn2)CC1	ZINC000819459217	FB	On-Demand	Anodyne	GPR119	21	44
CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)NCCn2cnnn2)c1	ZINC000819459219	FD	On-Demand	Anodyne	IMDH_CRYPV	35	40
C[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCCn1cnnn1	ZINC000819459228	DC	On-Demand	Anodyne	UTS2	43	34
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NCCn1cnnn1	ZINC000819459229	DC	On-Demand	Anodyne	UTS2	43	34
O=C(NCCn1cnnn1)c1cc(F)cc2c(=O)c3cc(F)ccc3[nH]c12	ZINC000819459242	FD	On-Demand	Bother	PLD2	42	35
NC(=O)c1ccc(OCC(=O)NCCn2cnnn2)cc1	ZINC000819459252	CA	On-Demand	Anodyne	ADORA2B	17	40
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)c1cccnc1	ZINC000819459290	DE	On-Demand	Anodyne	ADRB3	44	41
O=C(NCCn1cnnn1)c1cc2ccccc2cc1OC(F)F	ZINC000819459291	ED	On-Demand	Anodyne	POLR1A	53	34
O[C@H](CNc1ccccc1O[C@H]1CCOC1)c1cccnc1	ZINC000819459292	DE	On-Demand	Anodyne	ADRB3	44	41
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)c1cccnc1	ZINC000819459294	DE	On-Demand	Anodyne	ADRB3	44	41
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)c1cccnc1	ZINC000819459295	DE	On-Demand	Anodyne	ADRB3	44	41
CN(C)c1ccc(N(C)C(=O)CCc2cccc(OC(F)F)c2)cc1	ZINC000819459336	EH	On-Demand	Anodyne	CRTM	55	40
O=C(CCc1cccc(OC(F)F)c1)Nn1cnnc1	ZINC000819459349	CD	On-Demand	Anodyne	PLA2G4A	26	41
O=C(CCc1cccc(OC(F)F)c1)Nn1cnnc1	ZINC000819459349	CD	On-Demand	Anodyne	CRTM	48	33
CCOc1cc(Cl)ccc1NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819459362	EH	On-Demand	Bother	KCNMA1	23	41
CCOc1cc(Cl)ccc1NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000819459363	EH	On-Demand	Bother	KCNMA1	23	41
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)c1ccc(Cl)cc1Cl	ZINC000819459364	FI	On-Demand	Anodyne	CYP3A4	43	32
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)c1ccc(Cl)cc1Cl	ZINC000819459365	FI	On-Demand	Anodyne	CYP3A4	43	32
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)c1ccc(Cl)cc1Cl	ZINC000819459366	FI	On-Demand	Anodyne	CYP3A4	43	32
O[C@H](CNc1ccccc1O[C@H]1CCOC1)c1ccc(Cl)cc1Cl	ZINC000819459367	FI	On-Demand	Anodyne	CYP3A4	43	32
O[C@H](CNc1ccccc1O[C@H]1CCOC1)COc1ccc2ccccc2c1	ZINC000819459368	GH	On-Demand	Anodyne	ADRB2	24	49
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)COc1ccc2ccccc2c1	ZINC000819459369	GH	On-Demand	Anodyne	ADRB2	24	49
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)COc1ccc2ccccc2c1	ZINC000819459370	GH	On-Demand	Anodyne	ADRB2	24	49
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)COc1ccc2ccccc2c1	ZINC000819459371	GH	On-Demand	Anodyne	ADRB2	24	49
O=[N+]([O-])c1ccc([C@@H](O)CNc2cccc(OCCF)c2)cc1	ZINC000819459378	DG	On-Demand	Bother	ADRB1	23	41
O=[N+]([O-])c1ccc([C@@H](O)CNc2cccc(OCCF)c2)cc1	ZINC000819459378	DG	On-Demand	Bother	ACR	19	45
O=[N+]([O-])c1ccc([C@H](O)CNc2cccc(OCCF)c2)cc1	ZINC000819459379	DG	On-Demand	Bother	ADRB1	23	41
O=[N+]([O-])c1ccc([C@H](O)CNc2cccc(OCCF)c2)cc1	ZINC000819459379	DG	On-Demand	Bother	ACR	19	45
Cc1ccccc1[C@@H](CC(=O)NCCn1cnnn1)NC(N)=O	ZINC000819459388	DB	On-Demand	Anodyne	CTSA	59	39
Cc1ccccc1[C@H](CC(=O)NCCn1cnnn1)NC(N)=O	ZINC000819459389	DB	On-Demand	Anodyne	CTSA	59	39
COc1cc(C)c(C(=O)NCCn2cnnn2)cc1OC	ZINC000819459390	CC	On-Demand	Anodyne	DRD3	15	41
O=C(NCCn1cnnn1)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	ZINC000819459396	GC	On-Demand	Anodyne	TMPRSS11D	47	31
O=C(NCCn1cnnn1)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	ZINC000819459397	GC	On-Demand	Anodyne	TMPRSS11D	47	31
COc1ccccc1/C=C(/C(=O)NCCn1cnnn1)c1ccccc1	ZINC000819459404	EE	On-Demand	Anodyne	TLR4	16	44
CCOc1cc(Cl)ccc1NCC1(O)CCC1	ZINC000819459409	CG	On-Demand	Anodyne	HCN1	40	30
CCOc1cc(Cl)ccc1NCC1(O)CCC1	ZINC000819459409	CG	On-Demand	Anodyne	HCN4	40	30
Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)c(C)c1	ZINC000819459412	FG	On-Demand	Anodyne	ADRB2	20	42
Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)c(C)c1	ZINC000819459414	FG	On-Demand	Anodyne	ADRB2	20	42
Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)c(C)c1	ZINC000819459416	FG	On-Demand	Anodyne	ADRB2	20	42
Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)c(C)c1	ZINC000819459417	FG	On-Demand	Anodyne	ADRB2	20	42
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819459418	GF	On-Demand	Anodyne	ADRB2	43	51
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819459418	GF	On-Demand	Anodyne	ADRB1	76	51
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819459418	GF	On-Demand	Anodyne	TSHR	47	32
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819459418	GF	On-Demand	Anodyne	ADRB3	44	43
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819459420	GF	On-Demand	Anodyne	ADRB2	43	51
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819459420	GF	On-Demand	Anodyne	ADRB1	76	51
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819459420	GF	On-Demand	Anodyne	TSHR	47	32
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819459420	GF	On-Demand	Anodyne	ADRB3	44	43
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819459422	GF	On-Demand	Anodyne	ADRB2	43	51
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819459422	GF	On-Demand	Anodyne	ADRB1	76	51
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819459422	GF	On-Demand	Anodyne	TSHR	47	32
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819459422	GF	On-Demand	Anodyne	ADRB3	44	43
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819459424	GF	On-Demand	Anodyne	ADRB2	43	51
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819459424	GF	On-Demand	Anodyne	ADRB1	76	51
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819459424	GF	On-Demand	Anodyne	TSHR	47	32
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819459424	GF	On-Demand	Anodyne	ADRB3	44	43
O[C@H](CNc1ccccc1O[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819459425	EH	On-Demand	Anodyne	ADRB1	29	42
O[C@H](CNc1ccccc1O[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819459425	EH	On-Demand	Anodyne	ADRB3	46	42
O[C@H](CNc1ccccc1O[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819459425	EH	On-Demand	Anodyne	IGF1R	33	42
O[C@H](CNc1ccccc1O[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819459425	EH	On-Demand	Anodyne	CYP3A4	56	42
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819459427	EH	On-Demand	Anodyne	ADRB1	29	42
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819459427	EH	On-Demand	Anodyne	ADRB3	46	42
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819459427	EH	On-Demand	Anodyne	IGF1R	33	42
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819459427	EH	On-Demand	Anodyne	CYP3A4	56	42
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819459429	EH	On-Demand	Anodyne	ADRB1	29	42
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819459429	EH	On-Demand	Anodyne	ADRB3	46	42
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819459429	EH	On-Demand	Anodyne	IGF1R	33	42
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)c1cccc(Cl)c1	ZINC000819459429	EH	On-Demand	Anodyne	CYP3A4	56	42
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819459431	EH	On-Demand	Anodyne	ADRB1	29	42
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819459431	EH	On-Demand	Anodyne	ADRB3	46	42
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819459431	EH	On-Demand	Anodyne	IGF1R	33	42
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)c1cccc(Cl)c1	ZINC000819459431	EH	On-Demand	Anodyne	CYP3A4	56	42
CCOc1cc(Cl)ccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819459446	ED	On-Demand	Anodyne	CCR1	48	41
CCOc1cc(Cl)ccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819459447	ED	On-Demand	Anodyne	CCR1	48	41
O=C(NCCn1cnnn1)[C@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819459450	FE	On-Demand	Anodyne	GHSR	17	40
CCn1c(NC(=O)/C=C\[C@@H]2CCCO2)nc2cc(Cl)ccc21	ZINC000819459451	DG	On-Demand	Anodyne	ITK	44	42
CCn1c(NC(=O)/C=C/[C@H]2CCCO2)nc2cc(Cl)ccc21	ZINC000819459452	DG	On-Demand	Anodyne	ITK	44	42
O=C(NCCn1cnnn1)[C@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819459453	FE	On-Demand	Anodyne	GHSR	17	40
CCn1c(NC(=O)/C=C/[C@@H]2CCCO2)nc2cc(Cl)ccc21	ZINC000819459454	DG	On-Demand	Anodyne	ITK	44	42
O=C(NCCn1cnnn1)[C@@H]1C[C@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819459455	FE	On-Demand	Anodyne	GHSR	17	40
CCn1c(NC(=O)/C=C\[C@H]2CCCO2)nc2cc(Cl)ccc21	ZINC000819459456	DG	On-Demand	Anodyne	ITK	44	42
O=C(NCCn1cnnn1)[C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1	ZINC000819459457	FE	On-Demand	Anodyne	GHSR	17	40
CCOc1cc(Cl)ccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819459467	FG	On-Demand	Bother	ADRB2	20	41
CCOc1cc(Cl)ccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819459467	FG	On-Demand	Bother	ADRB1	52	35
CCOc1cc(Cl)ccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819459468	FG	On-Demand	Bother	ADRB2	20	41
CCOc1cc(Cl)ccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819459468	FG	On-Demand	Bother	ADRB1	52	35
O[C@@H](CNc1cccc(OCCF)c1)c1ccccc1	ZINC000819459481	CG	On-Demand	Anodyne	ADRB2	20	43
O[C@@H](CNc1cccc(OCCF)c1)c1ccccc1	ZINC000819459481	CG	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CNc1cccc(OCCF)c1)c1ccccc1	ZINC000819459482	CG	On-Demand	Anodyne	ADRB2	20	43
O[C@H](CNc1cccc(OCCF)c1)c1ccccc1	ZINC000819459482	CG	On-Demand	Anodyne	ADRB1	25	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)c1	ZINC000819459504	FF	On-Demand	Anodyne	ADRB2	27	43
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)c1	ZINC000819459504	FF	On-Demand	Anodyne	ADRB1	42	36
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)c1	ZINC000819459504	FF	On-Demand	Anodyne	ABCB1	19	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)c1	ZINC000819459505	FF	On-Demand	Anodyne	ADRB2	27	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)c1	ZINC000819459505	FF	On-Demand	Anodyne	ADRB1	42	36
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)c1	ZINC000819459505	FF	On-Demand	Anodyne	ABCB1	19	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)c1	ZINC000819459506	FF	On-Demand	Anodyne	ADRB2	27	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)c1	ZINC000819459506	FF	On-Demand	Anodyne	ADRB1	42	36
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)c1	ZINC000819459506	FF	On-Demand	Anodyne	ABCB1	19	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)c1	ZINC000819459507	FF	On-Demand	Anodyne	ADRB2	27	43
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)c1	ZINC000819459507	FF	On-Demand	Anodyne	ADRB1	42	36
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)c1	ZINC000819459507	FF	On-Demand	Anodyne	ABCB1	19	42
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819459519	FG	On-Demand	Anodyne	ADRB2	30	51
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819459519	FG	On-Demand	Anodyne	ADRB1	54	51
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819459520	FG	On-Demand	Anodyne	ADRB2	30	51
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CC(C)(C)O3)cc1	ZINC000819459520	FG	On-Demand	Anodyne	ADRB1	54	51
O=C(/C=C\c1cccc(O)c1)NCCn1cnnn1	ZINC000819459539	CC	On-Demand	Anodyne	HDAC8	45	35
O=C(/C=C/c1cccc(O)c1)NCCn1cnnn1	ZINC000819459540	CC	On-Demand	Anodyne	HDAC8	45	35
O=C(CN1CCN(c2ccccn2)CC1)NCCn1cnnn1	ZINC000819459542	DB	On-Demand	Anodyne	HTR1A	27	48
O=C(CN1CCN(c2ccccn2)CC1)NCCn1cnnn1	ZINC000819459542	DB	On-Demand	Anodyne	DRD2	22	48
O=C(CN1CCN(c2ccccn2)CC1)NCCn1cnnn1	ZINC000819459542	DB	On-Demand	Anodyne	DRD4	37	46
O=C(CN1CCN(c2ccccn2)CC1)NCCn1cnnn1	ZINC000819459542	DB	On-Demand	Anodyne	DRD3	18	45
O=C(CN1CCN(c2ccccn2)CC1)NCCn1cnnn1	ZINC000819459542	DB	On-Demand	Anodyne	SLC27A1	45	47
O[C@H](CNc1ccccc1O[C@H]1CCOC1)COc1cccc2[nH]ccc12	ZINC000819459589	FG	On-Demand	Anodyne	ADRB2	19	57
O[C@H](CNc1ccccc1O[C@H]1CCOC1)COc1cccc2[nH]ccc12	ZINC000819459589	FG	On-Demand	Anodyne	ADRB1	24	55
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)COc1cccc2[nH]ccc12	ZINC000819459590	FG	On-Demand	Anodyne	ADRB2	19	57
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)COc1cccc2[nH]ccc12	ZINC000819459590	FG	On-Demand	Anodyne	ADRB1	24	55
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)COc1cccc2[nH]ccc12	ZINC000819459591	FG	On-Demand	Anodyne	ADRB2	19	57
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)COc1cccc2[nH]ccc12	ZINC000819459591	FG	On-Demand	Anodyne	ADRB1	24	55
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)COc1cccc2[nH]ccc12	ZINC000819459592	FG	On-Demand	Anodyne	ADRB2	19	57
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)COc1cccc2[nH]ccc12	ZINC000819459592	FG	On-Demand	Anodyne	ADRB1	24	55
CCOc1cc(Cl)ccc1NC[C@H](O)c1cccnc1	ZINC000819459597	CG	On-Demand	Anodyne	ADRB1	38	41
CCOc1cc(Cl)ccc1NC[C@H](O)c1cccnc1	ZINC000819459597	CG	On-Demand	Anodyne	ADRB3	82	41
CCOc1cc(Cl)ccc1NC[C@@H](O)c1cccnc1	ZINC000819459598	CG	On-Demand	Anodyne	ADRB1	38	41
CCOc1cc(Cl)ccc1NC[C@@H](O)c1cccnc1	ZINC000819459598	CG	On-Demand	Anodyne	ADRB3	82	41
CSc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819459606	GG	On-Demand	Anodyne	ADRB1	37	41
CSc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819459607	GG	On-Demand	Anodyne	ADRB1	37	41
CSc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819459608	GG	On-Demand	Anodyne	ADRB1	37	41
CSc1ccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819459609	GG	On-Demand	Anodyne	ADRB1	37	41
O[C@@H](CNc1cccc(OCCF)c1)c1ccccc1C(F)(F)F	ZINC000819459610	EI	On-Demand	Anodyne	PDS	41	35
O[C@H](CNc1cccc(OCCF)c1)c1ccccc1C(F)(F)F	ZINC000819459611	EI	On-Demand	Anodyne	PDS	41	35
O[C@@H](CNc1cccc(OCCF)c1)c1cccc(Cl)c1	ZINC000819459616	DH	On-Demand	Anodyne	ADRB2	16	51
O[C@@H](CNc1cccc(OCCF)c1)c1cccc(Cl)c1	ZINC000819459616	DH	On-Demand	Anodyne	ADRB1	35	43
O[C@@H](CNc1cccc(OCCF)c1)c1cccc(Cl)c1	ZINC000819459616	DH	On-Demand	Anodyne	ADRB3	49	42
O[C@H](CNc1cccc(OCCF)c1)c1cccc(Cl)c1	ZINC000819459617	DH	On-Demand	Anodyne	ADRB2	16	51
O[C@H](CNc1cccc(OCCF)c1)c1cccc(Cl)c1	ZINC000819459617	DH	On-Demand	Anodyne	ADRB1	35	43
O[C@H](CNc1cccc(OCCF)c1)c1cccc(Cl)c1	ZINC000819459617	DH	On-Demand	Anodyne	ADRB3	49	42
COCCNC(=O)c1ccccc1NC(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1	ZINC000819459625	JF	On-Demand	Anodyne	TGM2	49	38
COCCNC(=O)c1ccccc1NC(=O)c1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1	ZINC000819459626	JF	On-Demand	Anodyne	TGM2	49	38
COCCNC(=O)c1ccccc1NC(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1	ZINC000819459627	JF	On-Demand	Anodyne	TGM2	49	38
Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819459634	EG	On-Demand	Anodyne	ADRB2	38	45
Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819459634	EG	On-Demand	Anodyne	ADRB1	49	42
Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819459635	EG	On-Demand	Anodyne	ADRB2	38	45
Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819459635	EG	On-Demand	Anodyne	ADRB1	49	42
Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819459636	EG	On-Demand	Anodyne	ADRB2	38	45
Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H]2CCOC2)cc1	ZINC000819459636	EG	On-Demand	Anodyne	ADRB1	49	42
Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819459637	EG	On-Demand	Anodyne	ADRB2	38	45
Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H]2CCOC2)cc1	ZINC000819459637	EG	On-Demand	Anodyne	ADRB1	49	42
O[C@H](CNc1ccccc1O[C@H]1CCOC1)c1cccc(Br)c1	ZINC000819459665	GH	On-Demand	Anodyne	CYP3A4	43	33
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)c1cccc(Br)c1	ZINC000819459666	GH	On-Demand	Anodyne	CYP3A4	43	33
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)c1cccc(Br)c1	ZINC000819459667	GH	On-Demand	Anodyne	CYP3A4	43	33
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)c1cccc(Br)c1	ZINC000819459668	GH	On-Demand	Anodyne	CYP3A4	43	33
O[C@H](CNc1ccccc1O[C@H]1CCOC1)c1cccc(F)c1	ZINC000819459676	DG	On-Demand	Anodyne	CYP3A4	43	33
O[C@H](CNc1ccccc1O[C@@H]1CCOC1)c1cccc(F)c1	ZINC000819459677	DG	On-Demand	Anodyne	CYP3A4	43	33
O[C@@H](CNc1ccccc1O[C@H]1CCOC1)c1cccc(F)c1	ZINC000819459678	DG	On-Demand	Anodyne	CYP3A4	43	33
O[C@@H](CNc1ccccc1O[C@@H]1CCOC1)c1cccc(F)c1	ZINC000819459679	DG	On-Demand	Anodyne	CYP3A4	43	33
CCOc1cc(Cl)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819459680	FH	On-Demand	Anodyne	ADRB2	24	52
CCOc1cc(Cl)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819459680	FH	On-Demand	Anodyne	ABCB1	16	42
CCOc1cc(Cl)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819459680	FH	On-Demand	Anodyne	PDS	74	47
CCOc1cc(Cl)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819459681	FH	On-Demand	Anodyne	ADRB2	24	52
CCOc1cc(Cl)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819459681	FH	On-Demand	Anodyne	ABCB1	16	42
CCOc1cc(Cl)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819459681	FH	On-Demand	Anodyne	PDS	74	47
C[C@@H]1[C@@H](C)N(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCN1C	ZINC000819459683	FE	On-Demand	Mild	PAPA1_CARPA	31	41
CCCN(CC)c1ccc(C(=O)NCCn2cnnn2)cc1	ZINC000819459686	DD	On-Demand	Anodyne	NAMPT	21	40
O=C(CCCCCNC(=O)NC1CCCCC1)NCCn1cnnn1	ZINC000819459695	FC	On-Demand	Anodyne	EPHX2	17	51
C[C@@H]1[C@@H](C)N(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCN1C	ZINC000819459700	FE	On-Demand	Mild	PAPA1_CARPA	31	41
O=C(NCCn1cnnn1)[C@@H](O)Cc1ccccc1	ZINC000819459710	CB	On-Demand	Anodyne	MME	94	42
O=C(NCCn1cnnn1)[C@@H](O)Cc1ccccc1	ZINC000819459710	CB	On-Demand	Anodyne	FCER2	43	32
O=C(NCCn1cnnn1)[C@@H](O)Cc1ccccc1	ZINC000819459710	CB	On-Demand	Anodyne	CAPNS1	50	37
O=C(NCCn1cnnn1)[C@@H](O)Cc1ccccc1	ZINC000819459710	CB	On-Demand	Anodyne	CAPN1	59	37
O=C(NCCn1cnnn1)[C@@H](O)Cc1ccccc1	ZINC000819459710	CB	On-Demand	Anodyne	CAPN2	93	37
O=C(NCCn1cnnn1)[C@@H](O)Cc1ccccc1	ZINC000819459710	CB	On-Demand	Anodyne	AMP1_PLAFQ	50	39
O=C(NCCn1cnnn1)c1ccccc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000819459735	HC	On-Demand	Bother	PRTN3	47	39
CCCc1c(C(=O)NCCn2cnnn2)nnn1-c1cccc(Cl)c1	ZINC000819459742	FD	On-Demand	Anodyne	CNR1	25	43
CCCCC[C@@H](C)CC(=O)N1CC(C(F)(F)F)C1	ZINC000819459749	CH	On-Demand	Anodyne	EST1_PIG	45	31
O=C(NC[C@H]1CCCNC1=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819459757	GC	On-Demand	Anodyne	CACNA1I	64	36
O=C(CCCc1csc2ccccc12)NCCn1cnnn1	ZINC000819459766	DE	On-Demand	Anodyne	MTNR1A	15	44
O=C(CCNC(=O)NC12CC3CC(CC(C3)C1)C2)NCCn1cnnn1	ZINC000819459772	FC	On-Demand	Anodyne	EPHX2	103	54
O=C(NCCn1cnnn1)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819459778	EC	On-Demand	Anodyne	SLC6A1	119	40
O=C(NCCn1cnnn1)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819459778	EC	On-Demand	Anodyne	CCR3	60	39
O=C(NCCn1cnnn1)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819459778	EC	On-Demand	Anodyne	CACNA1G	37	45
O=C(NCCn1cnnn1)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819459779	EC	On-Demand	Anodyne	SLC6A1	119	40
O=C(NCCn1cnnn1)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819459779	EC	On-Demand	Anodyne	CCR3	60	39
O=C(NCCn1cnnn1)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000819459779	EC	On-Demand	Anodyne	CACNA1G	37	45
O=C(NCCn1cnnn1)c1ccc(C(=O)c2cccc(O)c2)cc1	ZINC000819459797	ED	On-Demand	Anodyne	DRD4	41	32
COC(=O)Nc1cc(C(=O)NC[C@H]2CCCNC2=O)cc(C(F)(F)F)c1	ZINC000819459802	FE	On-Demand	Anodyne	CACNA1I	32	41
COC(=O)Nc1cc(C(=O)NC[C@@H]2CCCNC2=O)cc(C(F)(F)F)c1	ZINC000819459803	FE	On-Demand	Anodyne	CACNA1I	32	41
COC(=O)c1cccc(CC(=O)NCCn2cnnn2)c1	ZINC000819459814	CB	On-Demand	Anodyne	DRD4	41	31
O=C(NCCn1cnnn1)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819459819	EF	On-Demand	Anodyne	DRD4	56	48
O=C(NCCn1cnnn1)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819459819	EF	On-Demand	Anodyne	RAF1	16	43
O=C(NCCn1cnnn1)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819459819	EF	On-Demand	Anodyne	FAAH	20	41
O=C(NCCn1cnnn1)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819459819	EF	On-Demand	Anodyne	CRTM	32	41
C[C@@](O)(CC(=O)NC[C@@H]1CCCNC1=O)c1ccccc1	ZINC000819459841	CC	On-Demand	Anodyne	AMY2	43	29
C[C@@](O)(CC(=O)NC[C@H]1CCCNC1=O)c1ccccc1	ZINC000819459843	CC	On-Demand	Anodyne	AMY2	43	29
O=C(NCCn1cnnn1)[C@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000819459846	FC	On-Demand	Anodyne	CPT1A	121	42
O=C(NCCn1cnnn1)[C@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000819459846	FC	On-Demand	Anodyne	CPT2	46	36
O=C(NCCn1cnnn1)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000819459847	FC	On-Demand	Anodyne	CPT1A	121	42
O=C(NCCn1cnnn1)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000819459847	FC	On-Demand	Anodyne	CPT2	46	36
CNC(=O)COc1cccc(CC(=O)NCCn2cnnn2)c1	ZINC000819459848	DB	On-Demand	Anodyne	UPP1	49	33
CNC(=O)COc1cccc(CC(=O)NCCn2cnnn2)c1	ZINC000819459848	DB	On-Demand	Anodyne	PDS	50	33
O=C(NCCn1cnnn1)c1ccc(-n2cnc3ccccc32)nc1	ZINC000819459862	EC	On-Demand	Anodyne	F9	16	41
O=C(NCCn1cnnn1)c1ccc(OC2CCC2)cc1	ZINC000819459873	CD	On-Demand	Anodyne	PLD1	44	38
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NCCn2cnnn2)cc1	ZINC000819459877	HE	On-Demand	Anodyne	DRD4	40	31
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NCCn2cnnn2)cc1	ZINC000819459877	HE	On-Demand	Anodyne	SCD	17	41
O=C(NCCn1cnnn1)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819459878	HD	On-Demand	Anodyne	OPRD1	57	39
O=C(NCCn1cnnn1)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819459878	HD	On-Demand	Anodyne	CFTR	68	42
O=C(NCCn1cnnn1)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819459878	HD	On-Demand	Anodyne	ADAM9	44	31
O=C(NCCn1cnnn1)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819459879	HD	On-Demand	Anodyne	OPRD1	57	39
O=C(NCCn1cnnn1)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819459879	HD	On-Demand	Anodyne	CFTR	68	42
O=C(NCCn1cnnn1)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819459879	HD	On-Demand	Anodyne	ADAM9	44	31
Cc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC#N)cc1	ZINC000819459914	EF	On-Demand	Mild	ADRB2	27	45
Cc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC#N)cc1	ZINC000819459914	EF	On-Demand	Mild	ADRB1	46	35
Cc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC#N)cc1	ZINC000819459915	EF	On-Demand	Mild	ADRB2	27	45
Cc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC#N)cc1	ZINC000819459915	EF	On-Demand	Mild	ADRB1	46	35
CCCOc1cc(F)ccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819459916	FH	On-Demand	Anodyne	ADRB2	27	42
CCCOc1cc(F)ccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819459916	FH	On-Demand	Anodyne	ADRB1	52	33
CCCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819459917	FH	On-Demand	Anodyne	ADRB2	27	42
CCCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819459917	FH	On-Demand	Anodyne	ADRB1	52	33
CON(C)C(=O)CCNc1cccc(OCCF)c1	ZINC000819459920	CD	On-Demand	Anodyne	MTNR1A	22	40
CON(C)C(=O)CCNc1cccc(OCCF)c1	ZINC000819459920	CD	On-Demand	Anodyne	MTNR1B	23	40
N#Cc1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819459937	EG	On-Demand	Mild	ADRB2	36	44
N#Cc1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819459937	EG	On-Demand	Mild	ADRB1	73	42
N#Cc1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819459937	EG	On-Demand	Mild	ADRB3	18	42
N#Cc1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819459937	EG	On-Demand	Mild	CASR	42	39
N#Cc1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819459937	EG	On-Demand	Mild	CYP2D6	22	42
N#Cc1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819459938	EG	On-Demand	Mild	ADRB2	36	44
N#Cc1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819459938	EG	On-Demand	Mild	ADRB1	73	42
N#Cc1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819459938	EG	On-Demand	Mild	ADRB3	18	42
N#Cc1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819459938	EG	On-Demand	Mild	CASR	42	39
N#Cc1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819459938	EG	On-Demand	Mild	CYP2D6	22	42
CCOc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC#N)cc1	ZINC000819459961	FF	On-Demand	Mild	ADRB1	43	33
CCOc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC#N)cc1	ZINC000819459962	FF	On-Demand	Mild	ADRB1	43	33
C=C(C)C(C)(C)C(=O)N1CCC(Oc2ccnc(C(N)=O)c2)CC1	ZINC000819459968	EE	On-Demand	Mild	PRSS2	74	31
CCCOc1cc(F)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819459974	EH	On-Demand	Bother	CACNA1C	41	34
CCCOc1cc(F)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819459974	EH	On-Demand	Bother	ADRB3	24	42
CCCOc1cc(F)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819459974	EH	On-Demand	Bother	CACNA1D	63	34
CCCOc1cc(F)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819459975	EH	On-Demand	Bother	CACNA1C	41	34
CCCOc1cc(F)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819459975	EH	On-Demand	Bother	ADRB3	24	42
CCCOc1cc(F)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819459975	EH	On-Demand	Bother	CACNA1D	63	34
CCCOc1cc(F)ccc1NC[C@H](O)CN1CCOCC1	ZINC000819459976	DD	On-Demand	Anodyne	CCR1	40	43
CCCOc1cc(F)ccc1NC[C@H](O)CN1CCOCC1	ZINC000819459976	DD	On-Demand	Anodyne	HIPK3	17	40
CCCOc1cc(F)ccc1NC[C@H](O)CN1CCOCC1	ZINC000819459976	DD	On-Demand	Anodyne	MUSK	18	40
CCCOc1cc(F)ccc1NC[C@H](O)CN1CCOCC1	ZINC000819459976	DD	On-Demand	Anodyne	SRMS	23	40
CCCOc1cc(F)ccc1NC[C@@H](O)CN1CCOCC1	ZINC000819459977	DD	On-Demand	Anodyne	CCR1	40	43
CCCOc1cc(F)ccc1NC[C@@H](O)CN1CCOCC1	ZINC000819459977	DD	On-Demand	Anodyne	HIPK3	17	40
CCCOc1cc(F)ccc1NC[C@@H](O)CN1CCOCC1	ZINC000819459977	DD	On-Demand	Anodyne	MUSK	18	40
CCCOc1cc(F)ccc1NC[C@@H](O)CN1CCOCC1	ZINC000819459977	DD	On-Demand	Anodyne	SRMS	23	40
COCCc1ccc(OC[C@@H](O)CNc2cc(F)cc(F)c2OC)cc1	ZINC000819459992	FG	On-Demand	Anodyne	ADRB2	32	56
COCCc1ccc(OC[C@@H](O)CNc2cc(F)cc(F)c2OC)cc1	ZINC000819459992	FG	On-Demand	Anodyne	ADRB1	52	56
COCCc1ccc(OC[C@@H](O)CNc2cc(F)cc(F)c2OC)cc1	ZINC000819459992	FG	On-Demand	Anodyne	GRIN1	17	40
COCCc1ccc(OC[C@@H](O)CNc2cc(F)cc(F)c2OC)cc1	ZINC000819459992	FG	On-Demand	Anodyne	ADRB3	35	46
COCCc1ccc(OC[C@H](O)CNc2cc(F)cc(F)c2OC)cc1	ZINC000819459993	FG	On-Demand	Anodyne	ADRB2	32	56
COCCc1ccc(OC[C@H](O)CNc2cc(F)cc(F)c2OC)cc1	ZINC000819459993	FG	On-Demand	Anodyne	ADRB1	52	56
COCCc1ccc(OC[C@H](O)CNc2cc(F)cc(F)c2OC)cc1	ZINC000819459993	FG	On-Demand	Anodyne	GRIN1	17	40
COCCc1ccc(OC[C@H](O)CNc2cc(F)cc(F)c2OC)cc1	ZINC000819459993	FG	On-Demand	Anodyne	ADRB3	35	46
CCCOc1cc(F)ccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819459994	FG	On-Demand	Bother	ADRB1	52	35
CCCOc1cc(F)ccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819459995	FG	On-Demand	Bother	ADRB1	52	35
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2cccc(OCCF)c2)CC1	ZINC000819459998	GH	On-Demand	Anodyne	EPHX2	20	49
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2cccc(OCCF)c2)CC1	ZINC000819459999	GH	On-Demand	Anodyne	EPHX2	20	49
O=C(O)CCCNCc1ccc(N2CCOCC2)c(F)c1	ZINC000819460005	CD	On-Demand	Clean	LEF	54	34
O=C(O)CCCN[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000819460010	CF	On-Demand	Anodyne	BACE1	16	42
O=C(O)CCCN[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000819460011	CF	On-Demand	Anodyne	BACE1	16	42
O=C(O)CCCNS(=O)(=O)C1=Cc2ccccc2CC1	ZINC000819460012	CD	On-Demand	Anodyne	TBXA2R	18	51
O=C(O)CCCNC(=S)Nc1ccc2c(c1)CCC2	ZINC000819460013	CE	On-Demand	Anodyne	QPCT	46	45
O=C(O)CCCNC(=S)Nc1ccc(OC(F)F)cc1	ZINC000819460015	DE	On-Demand	Anodyne	LTA4H	22	45
O=C(O)CCCNC(=S)Nc1ccc(OC(F)F)cc1	ZINC000819460015	DE	On-Demand	Anodyne	QPCT	19	40
O=C(O)CCCNC1CCN(Cc2ccncc2)CC1	ZINC000819460016	CD	On-Demand	Anodyne	DRD4	33	44
O=C(O)CCCNC1CCN(Cc2ccncc2)CC1	ZINC000819460016	CD	On-Demand	Anodyne	ACHE	35	48
O=C(O)CCCNC1CCN(Cc2ccncc2)CC1	ZINC000819460016	CD	On-Demand	Anodyne	SIGMAR1	37	50
O=C(O)CCCNC1CCN(Cc2ccncc2)CC1	ZINC000819460016	CD	On-Demand	Anodyne	SSTR5	53	37
O=C(O)CCCNC1CCN(Cc2ccncc2)CC1	ZINC000819460016	CD	On-Demand	Anodyne	MCHR1	44	41
O=C(O)CCCNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819460020	GC	On-Demand	Anodyne	CA2	21	63
O=C(O)CCCNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819460020	GC	On-Demand	Anodyne	LPL	32	41
O=C(O)CCCNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819460020	GC	On-Demand	Anodyne	CA1	27	63
O=C(O)CCCNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819460020	GC	On-Demand	Anodyne	CA4	21	63
O=C(O)CCCNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819460020	GC	On-Demand	Anodyne	EPHX2	24	54
O=C(O)CCCNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819460020	GC	On-Demand	Anodyne	TGM2	68	40
O=C(O)CCCNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819460020	GC	On-Demand	Anodyne	CA12	15	41
O=C(O)CCCNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819460020	GC	On-Demand	Anodyne	CA9	16	43
O=C(O)CCCNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819460020	GC	On-Demand	Anodyne	F13A1	86	40
O=C(O)CCCNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819460020	GC	On-Demand	Anodyne	MERTK	32	42
O=C(O)CCCNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819460020	GC	On-Demand	Anodyne	NAMPT	60	53
O=C(O)CCCNCc1cccc(NC(=O)c2ccc(Cl)cc2)c1	ZINC000819460021	EH	On-Demand	Anodyne	PPIA	23	45
O=C(O)CCCNCc1cccc(NC(=O)c2ccc(Cl)cc2)c1	ZINC000819460021	EH	On-Demand	Anodyne	TBXA2R	42	35
O=C(O)CCCNCc1cccc(NC(=O)c2ccc(Cl)cc2)c1	ZINC000819460021	EH	On-Demand	Anodyne	UL80	18	40
O=C(O)CCCNCc1cccc(NC(=O)c2ccc(Cl)cc2)c1	ZINC000819460021	EH	On-Demand	Anodyne	CPT1A	58	37
O=C(O)CCCNCc1cccc(NC(=O)c2ccc(Cl)cc2)c1	ZINC000819460021	EH	On-Demand	Anodyne	HDAC1	15	46
O=C(O)CCCNCc1cccc(NC(=O)c2ccc(Cl)cc2)c1	ZINC000819460021	EH	On-Demand	Anodyne	TAAR1	27	43
O=C(O)CCCNCc1cccc(NC(=O)c2ccc(Cl)cc2)c1	ZINC000819460021	EH	On-Demand	Anodyne	KCNK3	100	49
O=C(O)CCCNCc1cccc(NC(=O)c2ccc(Cl)cc2)c1	ZINC000819460021	EH	On-Demand	Anodyne	KCNK9	51	39
O=C(O)CCCNC(=S)Nc1ccccc1-c1ccccc1	ZINC000819460025	DH	On-Demand	Anodyne	MME	21	42
O=C(O)CCCNC1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819460030	DE	On-Demand	Bother	SSTR1	40	41
O=C(O)CCCNC1CCN(Cc2ccccn2)CC1	ZINC000819460032	CD	On-Demand	Anodyne	DRD4	24	57
O=C(O)CCCNC1CCN(Cc2ccccn2)CC1	ZINC000819460032	CD	On-Demand	Anodyne	ACHE	15	43
O=C(O)CCCNC1CCN(Cc2ccccn2)CC1	ZINC000819460032	CD	On-Demand	Anodyne	SIGMAR1	27	44
O=C(O)CCCNC1CCN(Cc2ccccn2)CC1	ZINC000819460032	CD	On-Demand	Anodyne	SSTR5	41	35
O=C(O)CCCNCc1ccc(OC(F)F)c(Cl)c1	ZINC000819460033	CF	On-Demand	Anodyne	LPAR2	21	44
O=C(O)CCCNCc1ccc(OC(F)F)c(Cl)c1	ZINC000819460033	CF	On-Demand	Anodyne	S1PR2	26	45
O=C(O)CCCNCc1ccc(OC(F)F)c(Cl)c1	ZINC000819460033	CF	On-Demand	Anodyne	S1PR1	16	45
O=C(O)CCCNCc1ccc(OC(F)F)c(Cl)c1	ZINC000819460033	CF	On-Demand	Anodyne	LEF	77	39
O=C(O)CCCNC1CCN(C(=O)c2ccoc2)CC1	ZINC000819460036	CD	On-Demand	Anodyne	L3MBTL3	52	33
O=C(O)CCCNCc1ccccc1N1CCCCC1	ZINC000819460039	CF	On-Demand	Anodyne	MC4R	16	41
O=C(O)CCCNCc1ccccc1N1CCCCC1	ZINC000819460039	CF	On-Demand	Anodyne	KCNQ2	80	45
O=C(O)CCCNCc1ccccc1N1CCCCC1	ZINC000819460039	CF	On-Demand	Anodyne	SCN2A	18	43
O=C(O)CCCNCc1ccccc1N1CCCCC1	ZINC000819460039	CF	On-Demand	Anodyne	DPP7	46	42
O=C(O)CCCNCc1ccc(-n2cncn2)cc1	ZINC000819460042	CD	On-Demand	Anodyne	S1PR2	22	49
O=C(O)CCCNCc1cc(-c2ccccc2)ccc1O	ZINC000819460049	CG	On-Demand	Clean	GRIA1	45	35
O=C(O)CCCNCc1cc(-c2ccccc2)ccc1O	ZINC000819460049	CG	On-Demand	Clean	METG	45	33
O=C(O)CCCNC(=S)NCCSc1ccccc1	ZINC000819460050	CE	On-Demand	Anodyne	PTGFR	19	40
O=C(O)CCCNCc1ccc(-n2cnc3ccccc32)cc1	ZINC000819460052	DF	On-Demand	Anodyne	F9	33	42
O=C(O)CCCNCc1ccc(-n2cncn2)c(F)c1	ZINC000819460058	CD	On-Demand	Anodyne	LEF	47	33
O=C(O)CCCNCc1ccc(C(=O)NC2CC2)cc1	ZINC000819460060	CD	On-Demand	Anodyne	CYSLTR2	43	31
O=C(O)CCCNCc1ccc(C(=O)NC2CC2)cc1	ZINC000819460060	CD	On-Demand	Anodyne	LPAR2	35	41
O=C(O)CCCNCc1ccc(C(=O)NC2CC2)cc1	ZINC000819460060	CD	On-Demand	Anodyne	SSTR3	20	41
O=C(O)CCCNCc1ccc(C(=O)NC2CC2)cc1	ZINC000819460060	CD	On-Demand	Anodyne	S1PR2	39	52
O=C(O)CCCNCc1ccc(C(=O)NC2CC2)cc1	ZINC000819460060	CD	On-Demand	Anodyne	S1PR1	15	52
O=C(O)CCCNCc1cc(-c2cccnc2)n[nH]1	ZINC000819460062	CD	On-Demand	Anodyne	TBXAS1	83	43
O=C(O)CCCNCc1cc(-c2cccnc2)n[nH]1	ZINC000819460062	CD	On-Demand	Anodyne	CYP2A6	29	40
O=C(O)CCCN[C@@H](Cc1ccccc1)C1CC1	ZINC000819460063	BE	On-Demand	Anodyne	ACE	66	38
O=C(O)CCCN[C@@H](Cc1ccccc1)C1CC1	ZINC000819460063	BE	On-Demand	Anodyne	MME	118	49
O=C(O)CCCN[C@@H](Cc1ccccc1)C1CC1	ZINC000819460063	BE	On-Demand	Anodyne	PTGER4	28	42
O=C(O)CCCN[C@@H](Cc1ccccc1)C1CC1	ZINC000819460063	BE	On-Demand	Anodyne	CPA1	51	37
O=C(O)CCCN[C@@H](Cc1ccccc1)C1CC1	ZINC000819460063	BE	On-Demand	Anodyne	NPFFR2	45	33
O=C(O)CCCN[C@@H](Cc1ccccc1)C1CC1	ZINC000819460063	BE	On-Demand	Anodyne	NAALAD2	28	40
O=C(O)CCCN[C@@H](Cc1ccccc1)C1CC1	ZINC000819460063	BE	On-Demand	Anodyne	NPFFR1	59	33
O=C(O)CCCN[C@H](Cc1ccccc1)C1CC1	ZINC000819460064	BE	On-Demand	Anodyne	ACE	66	38
O=C(O)CCCN[C@H](Cc1ccccc1)C1CC1	ZINC000819460064	BE	On-Demand	Anodyne	MME	118	49
O=C(O)CCCN[C@H](Cc1ccccc1)C1CC1	ZINC000819460064	BE	On-Demand	Anodyne	PTGER4	28	42
O=C(O)CCCN[C@H](Cc1ccccc1)C1CC1	ZINC000819460064	BE	On-Demand	Anodyne	CPA1	51	37
O=C(O)CCCN[C@H](Cc1ccccc1)C1CC1	ZINC000819460064	BE	On-Demand	Anodyne	NPFFR2	45	33
O=C(O)CCCN[C@H](Cc1ccccc1)C1CC1	ZINC000819460064	BE	On-Demand	Anodyne	NAALAD2	28	40
O=C(O)CCCN[C@H](Cc1ccccc1)C1CC1	ZINC000819460064	BE	On-Demand	Anodyne	NPFFR1	59	33
O=C(O)CCCNCc1ccccc1I	ZINC000819460065	DE	On-Demand	Anodyne	FOLH1	18	63
O=C(O)CCCNC(=S)Nc1ccc(OC(F)(F)F)cc1	ZINC000819460071	DF	On-Demand	Anodyne	GCGR	33	48
O=C(O)CCCNC(=S)Nc1ccc(OC(F)(F)F)cc1	ZINC000819460071	DF	On-Demand	Anodyne	LTA4H	24	43
O=C(O)CCCNC(=S)Nc1ccc(OC(F)(F)F)cc1	ZINC000819460071	DF	On-Demand	Anodyne	P2RY1	60	38
O=C(O)CCCNC(=S)Nc1ccc(OC(F)(F)F)cc1	ZINC000819460071	DF	On-Demand	Anodyne	EPHX2	57	45
O=C(O)CCCNC(=S)Nc1ccc(OC(F)(F)F)cc1	ZINC000819460071	DF	On-Demand	Anodyne	GIPR	39	47
O=C(O)CCCNC(=S)Nc1ccc(OC(F)(F)F)cc1	ZINC000819460071	DF	On-Demand	Anodyne	QPCT	22	40
O=C(O)CCCNC(=S)NCc1ccc(OC(F)(F)F)cc1	ZINC000819460074	EE	On-Demand	Anodyne	GCGR	31	42
O=C(O)CCCNC(=S)NCc1ccc(OC(F)(F)F)cc1	ZINC000819460074	EE	On-Demand	Anodyne	GIPR	34	40
O=C(O)CCCNC(=O)c1nn(-c2ccc(F)cc2)cc1O	ZINC000819460080	DD	On-Demand	Anodyne	FOLH1	16	41
O=C(O)CCCNC(=S)Nc1ccc2c(c1)OCCO2	ZINC000819460081	CD	On-Demand	Anodyne	QPCT	54	56
O=C(O)CCCNCc1ccccc1-c1ccccc1	ZINC000819460082	CG	On-Demand	Anodyne	FOLH1	18	47
O=C(O)CCCNCc1ccccc1-c1ccccc1	ZINC000819460082	CG	On-Demand	Anodyne	MME	21	40
O=C(O)CCCNCc1ccccc1-c1ccccc1	ZINC000819460082	CG	On-Demand	Anodyne	FFAR4	40	45
O=C(O)CCCNCc1cnc(-c2ccccn2)s1	ZINC000819460083	CE	On-Demand	Anodyne	FAAH	33	40
O=C(O)CCCNCc1cc2ccccc2nc1N1CCOCC1	ZINC000819460084	EE	On-Demand	Anodyne	PIK3CA	45	40
O=C(O)CCCNCc1cc2ccccc2nc1N1CCOCC1	ZINC000819460084	EE	On-Demand	Anodyne	MTOR	42	36
O=C(O)CCCNCc1cc2ccccc2nc1N1CCOCC1	ZINC000819460084	EE	On-Demand	Anodyne	METG	61	33
O=C(O)CCCNCc1cc2ccccc2nc1N1CCOCC1	ZINC000819460084	EE	On-Demand	Anodyne	PIK3CB	44	39
O=C(O)CCCNCc1cc2ccccc2nc1N1CCOCC1	ZINC000819460084	EE	On-Demand	Anodyne	STAT6	47	33
O=C(O)CCCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000819460085	DE	On-Demand	Anodyne	DRD4	16	49
O=C(O)CCCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000819460085	DE	On-Demand	Anodyne	SIGMAR1	15	41
O=C(O)CCCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000819460085	DE	On-Demand	Anodyne	EPHX2	15	52
O=C(O)CCCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000819460085	DE	On-Demand	Anodyne	SFRP1	33	45
O=C(O)CCCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000819460085	DE	On-Demand	Anodyne	L3MBTL3	55	43
N#CCOc1cc(F)ccc1NC[C@H](O)COCc1ccccc1	ZINC000819460090	EF	On-Demand	Mild	ADRB1	40	34
N#CCOc1cc(F)ccc1NC[C@@H](O)COCc1ccccc1	ZINC000819460091	EF	On-Demand	Mild	ADRB1	40	34
O[C@H](CNc1ccccc1OCC(F)F)CN1CCOCC1	ZINC000819460092	DD	On-Demand	Clean	ADRB2	18	54
O[C@H](CNc1ccccc1OCC(F)F)CN1CCOCC1	ZINC000819460092	DD	On-Demand	Clean	CCR1	42	42
O[C@H](CNc1ccccc1OCC(F)F)CN1CCOCC1	ZINC000819460092	DD	On-Demand	Clean	ABCB1	64	45
O[C@@H](CNc1ccccc1OCC(F)F)CN1CCOCC1	ZINC000819460093	DD	On-Demand	Clean	ADRB2	18	54
O[C@@H](CNc1ccccc1OCC(F)F)CN1CCOCC1	ZINC000819460093	DD	On-Demand	Clean	CCR1	42	42
O[C@@H](CNc1ccccc1OCC(F)F)CN1CCOCC1	ZINC000819460093	DD	On-Demand	Clean	ABCB1	64	45
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2ccc(F)cc2OCC#N)CC1	ZINC000819460099	GG	On-Demand	Mild	GPR119	28	42
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2ccc(F)cc2OCC#N)CC1	ZINC000819460100	GG	On-Demand	Mild	GPR119	28	42
CCCOc1cc(F)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819460115	FH	On-Demand	Anodyne	ADRB2	24	42
CCCOc1cc(F)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819460115	FH	On-Demand	Anodyne	ADRB1	55	38
CCCOc1cc(F)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819460115	FH	On-Demand	Anodyne	ABCB1	18	41
CCCOc1cc(F)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819460116	FH	On-Demand	Anodyne	ADRB2	24	42
CCCOc1cc(F)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819460116	FH	On-Demand	Anodyne	ADRB1	55	38
CCCOc1cc(F)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819460116	FH	On-Demand	Anodyne	ABCB1	18	41
COCCNC(=O)c1ccccc1NC(=O)CSc1nnc(-c2ccc(Cl)cc2)o1	ZINC000819460121	IG	On-Demand	Anodyne	FAS	29	40
O[C@H](CNc1ccccc1OCC(F)F)COc1ccccc1	ZINC000819460128	DG	On-Demand	Clean	ADRB2	52	50
O[C@H](CNc1ccccc1OCC(F)F)COc1ccccc1	ZINC000819460128	DG	On-Demand	Clean	ADRB1	73	38
O[C@H](CNc1ccccc1OCC(F)F)COc1ccccc1	ZINC000819460128	DG	On-Demand	Clean	ADRB3	36	44
O[C@H](CNc1ccccc1OCC(F)F)COc1ccccc1	ZINC000819460128	DG	On-Demand	Clean	PDS	43	35
O[C@@H](CNc1ccccc1OCC(F)F)COc1ccccc1	ZINC000819460129	DG	On-Demand	Clean	ADRB2	52	50
O[C@@H](CNc1ccccc1OCC(F)F)COc1ccccc1	ZINC000819460129	DG	On-Demand	Clean	ADRB1	73	38
O[C@@H](CNc1ccccc1OCC(F)F)COc1ccccc1	ZINC000819460129	DG	On-Demand	Clean	ADRB3	36	44
O[C@@H](CNc1ccccc1OCC(F)F)COc1ccccc1	ZINC000819460129	DG	On-Demand	Clean	PDS	43	35
O[C@H](CNc1ccccc1OCC(F)F)Cc1ccccc1	ZINC000819460148	DG	On-Demand	Clean	ADRB1	45	35
O[C@H](CNc1ccccc1OCC(F)F)Cc1ccccc1	ZINC000819460148	DG	On-Demand	Clean	ABCB1	33	40
O[C@@H](CNc1ccccc1OCC(F)F)Cc1ccccc1	ZINC000819460149	DG	On-Demand	Clean	ADRB1	45	35
O[C@@H](CNc1ccccc1OCC(F)F)Cc1ccccc1	ZINC000819460149	DG	On-Demand	Clean	ABCB1	33	40
N#CCOc1cc(F)ccc1NC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819460187	GH	On-Demand	Mild	ADRB1	52	38
N#CCOc1cc(F)ccc1NC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819460187	GH	On-Demand	Mild	CASR	42	39
N#CCOc1cc(F)ccc1NC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819460188	GH	On-Demand	Mild	ADRB1	52	38
N#CCOc1cc(F)ccc1NC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819460188	GH	On-Demand	Mild	CASR	42	39
CC(C)(C)[C@@H](O)CNc1ccccc1OCC(F)F	ZINC000819460196	CG	On-Demand	Anodyne	ADRB2	18	40
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC#N)cc1	ZINC000819460197	FF	On-Demand	Mild	ADRB2	30	51
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC#N)cc1	ZINC000819460197	FF	On-Demand	Mild	ADRB1	60	40
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC#N)cc1	ZINC000819460197	FF	On-Demand	Mild	ADRB3	31	45
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC#N)cc1	ZINC000819460198	FF	On-Demand	Mild	ADRB2	30	51
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC#N)cc1	ZINC000819460198	FF	On-Demand	Mild	ADRB1	60	40
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC#N)cc1	ZINC000819460198	FF	On-Demand	Mild	ADRB3	31	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(F)cc2OCC#N)c1	ZINC000819460209	FF	On-Demand	Mild	ADRB2	21	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(F)cc2OCC#N)c1	ZINC000819460209	FF	On-Demand	Mild	ADRB1	60	39
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(F)cc2OCC#N)c1	ZINC000819460209	FF	On-Demand	Mild	CASR	40	36
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(F)cc2OCC#N)c1	ZINC000819460210	FF	On-Demand	Mild	ADRB2	21	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(F)cc2OCC#N)c1	ZINC000819460210	FF	On-Demand	Mild	ADRB1	60	39
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(F)cc2OCC#N)c1	ZINC000819460210	FF	On-Demand	Mild	CASR	40	36
CCCOc1cc(F)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819460236	GG	On-Demand	Anodyne	ADRB2	39	53
CCCOc1cc(F)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819460236	GG	On-Demand	Anodyne	ADRB1	69	53
CCCOc1cc(F)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819460236	GG	On-Demand	Anodyne	GRIN1	25	40
CCCOc1cc(F)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819460236	GG	On-Demand	Anodyne	ADRB3	37	46
CCCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819460237	GG	On-Demand	Anodyne	ADRB2	39	53
CCCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819460237	GG	On-Demand	Anodyne	ADRB1	69	53
CCCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819460237	GG	On-Demand	Anodyne	GRIN1	25	40
CCCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819460237	GG	On-Demand	Anodyne	ADRB3	37	46
O[C@@H](CNc1ccccc1OCC(F)F)COCc1ccccc1Cl	ZINC000819460240	FH	On-Demand	Clean	FABP4	15	41
O[C@@H](CNc1ccccc1OCC(F)F)COCc1ccccc1Cl	ZINC000819460240	FH	On-Demand	Clean	FABP5	27	41
O[C@H](CNc1ccccc1OCC(F)F)COCc1ccccc1Cl	ZINC000819460241	FH	On-Demand	Clean	FABP4	15	41
O[C@H](CNc1ccccc1OCC(F)F)COCc1ccccc1Cl	ZINC000819460241	FH	On-Demand	Clean	FABP5	27	41
O[C@H](CNc1ccccc1OCC(F)F)COc1ccccc1F	ZINC000819460242	EG	On-Demand	Clean	ADRB2	22	44
O[C@H](CNc1ccccc1OCC(F)F)COc1ccccc1F	ZINC000819460242	EG	On-Demand	Clean	ADRB1	58	44
O[C@@H](CNc1ccccc1OCC(F)F)COc1ccccc1F	ZINC000819460243	EG	On-Demand	Clean	ADRB2	22	44
O[C@@H](CNc1ccccc1OCC(F)F)COc1ccccc1F	ZINC000819460243	EG	On-Demand	Clean	ADRB1	58	44
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccccc1OCC(F)F	ZINC000819460244	FG	On-Demand	Clean	ADRB2	18	40
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccccc1OCC(F)F	ZINC000819460244	FG	On-Demand	Clean	ADRB1	57	38
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccccc1OCC(F)F	ZINC000819460245	FG	On-Demand	Clean	ADRB2	18	40
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccccc1OCC(F)F	ZINC000819460245	FG	On-Demand	Clean	ADRB1	57	38
N#CCOc1cc(F)ccc1NC[C@@H](O)CN1CCOCC1	ZINC000819460259	DC	On-Demand	Mild	CCR1	35	41
N#CCOc1cc(F)ccc1NC[C@H](O)CN1CCOCC1	ZINC000819460260	DC	On-Demand	Mild	CCR1	35	41
Cc1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460278	EG	On-Demand	Clean	ADRB2	50	51
Cc1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460278	EG	On-Demand	Clean	ADRB1	72	39
Cc1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460278	EG	On-Demand	Clean	ADRB3	32	40
Cc1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460279	EG	On-Demand	Clean	ADRB2	50	51
Cc1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460279	EG	On-Demand	Clean	ADRB1	72	39
Cc1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460279	EG	On-Demand	Clean	ADRB3	32	40
Cc1ccccc1[C@@H](O)CNc1ccccc1OCC(F)F	ZINC000819460286	DH	On-Demand	Anodyne	ADRB2	15	42
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460288	GG	On-Demand	Clean	ADRB2	55	57
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460288	GG	On-Demand	Clean	ADRB1	89	57
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460288	GG	On-Demand	Clean	ADRB3	52	49
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460288	GG	On-Demand	Clean	ABCB1	26	40
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460289	GG	On-Demand	Clean	ADRB2	55	57
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460289	GG	On-Demand	Clean	ADRB1	89	57
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460289	GG	On-Demand	Clean	ADRB3	52	49
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460289	GG	On-Demand	Clean	ABCB1	26	40
CCCOc1cc(F)ccc1NC[C@H](O)c1ccccc1	ZINC000819460296	CH	On-Demand	Anodyne	ADRB3	32	42
CCCOc1cc(F)ccc1NC[C@@H](O)c1ccccc1	ZINC000819460297	CH	On-Demand	Anodyne	ADRB3	32	42
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2cccc(OCCF)c2)CC1	ZINC000819460302	GG	On-Demand	Anodyne	EPHX2	22	48
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2cccc(OCCF)c2)CC1	ZINC000819460302	GG	On-Demand	Anodyne	GPR119	52	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2cccc(OCCF)c2)CC1	ZINC000819460303	GG	On-Demand	Anodyne	EPHX2	22	48
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2cccc(OCCF)c2)CC1	ZINC000819460303	GG	On-Demand	Anodyne	GPR119	52	48
O[C@H](CNc1ccccc1OCC(F)F)COc1cccc2[nH]ccc12	ZINC000819460317	FH	On-Demand	Clean	ADRB2	23	62
O[C@H](CNc1ccccc1OCC(F)F)COc1cccc2[nH]ccc12	ZINC000819460317	FH	On-Demand	Clean	ADRB1	39	62
O[C@H](CNc1ccccc1OCC(F)F)COc1cccc2[nH]ccc12	ZINC000819460317	FH	On-Demand	Clean	CYP2D6	18	45
O[C@@H](CNc1ccccc1OCC(F)F)COc1cccc2[nH]ccc12	ZINC000819460318	FH	On-Demand	Clean	ADRB2	23	62
O[C@@H](CNc1ccccc1OCC(F)F)COc1cccc2[nH]ccc12	ZINC000819460318	FH	On-Demand	Clean	ADRB1	39	62
O[C@@H](CNc1ccccc1OCC(F)F)COc1cccc2[nH]ccc12	ZINC000819460318	FH	On-Demand	Clean	CYP2D6	18	45
O[C@H](CNc1ccccc1OCC(F)F)COc1ccc(F)cc1	ZINC000819460319	EG	On-Demand	Clean	ADRB2	48	43
O[C@H](CNc1ccccc1OCC(F)F)COc1ccc(F)cc1	ZINC000819460319	EG	On-Demand	Clean	ADRB1	72	40
O[C@H](CNc1ccccc1OCC(F)F)COc1ccc(F)cc1	ZINC000819460319	EG	On-Demand	Clean	ADRB3	35	42
O[C@@H](CNc1ccccc1OCC(F)F)COc1ccc(F)cc1	ZINC000819460320	EG	On-Demand	Clean	ADRB2	48	43
O[C@@H](CNc1ccccc1OCC(F)F)COc1ccc(F)cc1	ZINC000819460320	EG	On-Demand	Clean	ADRB1	72	40
O[C@@H](CNc1ccccc1OCC(F)F)COc1ccc(F)cc1	ZINC000819460320	EG	On-Demand	Clean	ADRB3	35	42
O=C1c2ccccc2C(=O)N1C[C@H](O)CNc1ccccc1OCC(F)F	ZINC000819460326	GE	On-Demand	Clean	ADRB2	19	40
O=C1c2ccccc2C(=O)N1C[C@@H](O)CNc1ccccc1OCC(F)F	ZINC000819460327	GE	On-Demand	Clean	ADRB2	19	40
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc(F)cc1OCC#N	ZINC000819460330	FE	On-Demand	Mild	PAPA1_CARPA	31	41
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc(F)cc1OCC#N	ZINC000819460331	FE	On-Demand	Mild	PAPA1_CARPA	31	41
C=CCC1(C(=O)N2CCC(Oc3ccnc(C(N)=O)c3)CC2)CCOCC1	ZINC000819460344	FD	On-Demand	Mild	PRSS2	40	30
CCCOc1cc(F)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819460345	FH	On-Demand	Mild	ADRB2	22	41
CCCOc1cc(F)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819460345	FH	On-Demand	Mild	ADRB1	41	35
CCCOc1cc(F)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819460345	FH	On-Demand	Mild	CASR	40	37
CCCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819460346	FH	On-Demand	Mild	ADRB2	22	41
CCCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819460346	FH	On-Demand	Mild	ADRB1	41	35
CCCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819460346	FH	On-Demand	Mild	CASR	40	37
C[C@@H]1CCCC[C@@H]1C(=O)N1CCC(Oc2ccnc(C(N)=O)c2)CC1	ZINC000819460363	EE	On-Demand	Anodyne	HRH3	15	40
C[C@@H]1CCCC[C@H]1C(=O)N1CCC(Oc2ccnc(C(N)=O)c2)CC1	ZINC000819460364	EE	On-Demand	Anodyne	HRH3	15	40
CC(=O)Nc1cccc(CC(=O)N2CCC(Oc3ccnc(C(N)=O)c3)CC2)c1	ZINC000819460379	GD	On-Demand	Anodyne	PRSS2	77	36
CC(=O)Nc1cccc(CC(=O)N2CCC(Oc3ccnc(C(N)=O)c3)CC2)c1	ZINC000819460379	GD	On-Demand	Anodyne	MLNR	21	41
O[C@@H](CNc1cccc(OCCF)c1)c1cccnc1	ZINC000819460382	CF	On-Demand	Anodyne	ADRB2	22	45
O[C@@H](CNc1cccc(OCCF)c1)c1cccnc1	ZINC000819460382	CF	On-Demand	Anodyne	ADRB1	25	45
O[C@@H](CNc1cccc(OCCF)c1)c1cccnc1	ZINC000819460382	CF	On-Demand	Anodyne	ADRB3	75	47
O[C@H](CNc1cccc(OCCF)c1)c1cccnc1	ZINC000819460383	CF	On-Demand	Anodyne	ADRB2	22	45
O[C@H](CNc1cccc(OCCF)c1)c1cccnc1	ZINC000819460383	CF	On-Demand	Anodyne	ADRB1	25	45
O[C@H](CNc1cccc(OCCF)c1)c1cccnc1	ZINC000819460383	CF	On-Demand	Anodyne	ADRB3	75	47
O[C@@H](CCc1ccccc1)CNc1ccccc1OCC(F)F	ZINC000819460388	DH	On-Demand	Clean	ADRB2	21	40
O[C@@H](CCc1ccccc1)CNc1ccccc1OCC(F)F	ZINC000819460388	DH	On-Demand	Clean	ABCB1	44	41
O[C@H](CCc1ccccc1)CNc1ccccc1OCC(F)F	ZINC000819460389	DH	On-Demand	Clean	ADRB2	21	40
O[C@H](CCc1ccccc1)CNc1ccccc1OCC(F)F	ZINC000819460389	DH	On-Demand	Clean	ABCB1	44	41
O=C1CCc2cc(OC[C@@H](O)CNc3ccccc3OCC(F)F)ccc2N1	ZINC000819460396	GG	On-Demand	Clean	ADRB2	18	40
O=C1CCc2cc(OC[C@H](O)CNc3ccccc3OCC(F)F)ccc2N1	ZINC000819460397	GG	On-Demand	Clean	ADRB2	18	40
O[C@@H](CNc1ccccc1OCC(F)F)c1cccc(Cl)c1	ZINC000819460433	EI	On-Demand	Anodyne	ADRB2	16	42
O[C@@H](CNc1ccccc1OCC(F)F)c1cccc(Cl)c1	ZINC000819460433	EI	On-Demand	Anodyne	ADRB1	36	42
O[C@@H](CNc1ccccc1OCC(F)F)c1cccc(Cl)c1	ZINC000819460433	EI	On-Demand	Anodyne	ADRB3	49	42
O[C@@H](CNc1ccccc1OCC(F)F)c1cccc(Cl)c1	ZINC000819460433	EI	On-Demand	Anodyne	CYP3A4	47	34
O[C@H](CNc1ccccc1OCC(F)F)c1cccc(Cl)c1	ZINC000819460434	EI	On-Demand	Anodyne	ADRB2	16	42
O[C@H](CNc1ccccc1OCC(F)F)c1cccc(Cl)c1	ZINC000819460434	EI	On-Demand	Anodyne	ADRB1	36	42
O[C@H](CNc1ccccc1OCC(F)F)c1cccc(Cl)c1	ZINC000819460434	EI	On-Demand	Anodyne	ADRB3	49	42
O[C@H](CNc1ccccc1OCC(F)F)c1cccc(Cl)c1	ZINC000819460434	EI	On-Demand	Anodyne	CYP3A4	47	34
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc(F)cc1OCC#N	ZINC000819460446	GF	On-Demand	Mild	ADRB1	47	35
COc1cccc(OC)c1OC[C@H](O)CNc1ccc(F)cc1OCC#N	ZINC000819460447	GF	On-Demand	Mild	ADRB1	47	35
C[C@@H](CC(=O)N1CCC(Oc2ccnc(C(N)=O)c2)CC1)n1cccn1	ZINC000819460453	FD	On-Demand	Anodyne	PRSS2	41	30
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC#N)cc1	ZINC000819460460	FF	On-Demand	Mild	ADRB1	55	38
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC#N)cc1	ZINC000819460461	FF	On-Demand	Mild	ADRB1	55	38
O[C@@H](CNc1ccccc1OCC(F)F)CN1CCc2ccccc2C1	ZINC000819460504	FG	On-Demand	Clean	ABCB1	48	38
O[C@H](CNc1ccccc1OCC(F)F)CN1CCc2ccccc2C1	ZINC000819460505	FG	On-Demand	Clean	ABCB1	48	38
CC[C@H](O)CNc1ccccc1OCC(F)F	ZINC000819460525	BF	On-Demand	Clean	ADRB2	24	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc(F)cc2OCC#N)CC1	ZINC000819460544	GG	On-Demand	Mild	GPR119	53	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc(F)cc2OCC#N)CC1	ZINC000819460545	GG	On-Demand	Mild	GPR119	53	51
COCCNC(=O)c1ccccc1NC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819460549	JE	On-Demand	Anodyne	KCNQ2	22	41
COCCNC(=O)c1ccccc1NC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819460549	JE	On-Demand	Anodyne	PRTN3	47	39
COCCNC(=O)c1ccccc1NC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819460549	JE	On-Demand	Anodyne	TGM2	68	39
COCCNC(=O)c1ccccc1NC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819460549	JE	On-Demand	Anodyne	F13A1	69	39
COCCNC(=O)c1ccccc1NC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000819460549	JE	On-Demand	Anodyne	NAMPT	45	45
N#CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819460550	FF	On-Demand	Mild	ADRB1	43	37
N#CCOc1cc(F)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819460550	FF	On-Demand	Mild	CASR	40	37
N#CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819460551	FF	On-Demand	Mild	ADRB1	43	37
N#CCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819460551	FF	On-Demand	Mild	CASR	40	37
COCCNC(=O)c1ccccc1NC(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1	ZINC000819460574	HD	On-Demand	Bother	TAAR1	21	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)c1	ZINC000819460600	FG	On-Demand	Clean	ADRB2	35	44
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)c1	ZINC000819460600	FG	On-Demand	Clean	ADRB1	70	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)c1	ZINC000819460600	FG	On-Demand	Clean	CASR	41	37
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)c1	ZINC000819460600	FG	On-Demand	Clean	ABCB1	41	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)c1	ZINC000819460600	FG	On-Demand	Clean	PDS	75	39
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OCC(F)F)c1	ZINC000819460601	FG	On-Demand	Clean	ADRB2	35	44
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OCC(F)F)c1	ZINC000819460601	FG	On-Demand	Clean	ADRB1	70	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OCC(F)F)c1	ZINC000819460601	FG	On-Demand	Clean	CASR	41	37
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OCC(F)F)c1	ZINC000819460601	FG	On-Demand	Clean	ABCB1	41	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OCC(F)F)c1	ZINC000819460601	FG	On-Demand	Clean	PDS	75	39
CSc1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460606	FH	On-Demand	Clean	ADRB2	43	42
CSc1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460606	FH	On-Demand	Clean	ADRB1	59	36
CSc1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460607	FH	On-Demand	Clean	ADRB2	43	42
CSc1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460607	FH	On-Demand	Clean	ADRB1	59	36
CCOC[C@H](O)CNc1ccccc1OCC(F)F	ZINC000819460618	CE	On-Demand	Clean	ADRB2	27	44
CCCOc1cc(F)ccc1NC[C@H](O)c1cccnc1	ZINC000819460621	CG	On-Demand	Anodyne	ADRB2	15	40
CCCOc1cc(F)ccc1NC[C@H](O)c1cccnc1	ZINC000819460621	CG	On-Demand	Anodyne	ADRB1	22	50
CCCOc1cc(F)ccc1NC[C@H](O)c1cccnc1	ZINC000819460621	CG	On-Demand	Anodyne	ADRB3	66	50
CCCOc1cc(F)ccc1NC[C@@H](O)c1cccnc1	ZINC000819460622	CG	On-Demand	Anodyne	ADRB2	15	40
CCCOc1cc(F)ccc1NC[C@@H](O)c1cccnc1	ZINC000819460622	CG	On-Demand	Anodyne	ADRB1	22	50
CCCOc1cc(F)ccc1NC[C@@H](O)c1cccnc1	ZINC000819460622	CG	On-Demand	Anodyne	ADRB3	66	50
CCCOc1cc(F)ccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819460643	EG	On-Demand	Mild	ADRB1	51	35
CCCOc1cc(F)ccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819460643	EG	On-Demand	Mild	CASR	40	37
CCCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819460644	EG	On-Demand	Mild	ADRB1	51	35
CCCOc1cc(F)ccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819460644	EG	On-Demand	Mild	CASR	40	37
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(F)cc1OCC#N	ZINC000819460647	FE	On-Demand	Mild	PAPA1_CARPA	30	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(F)cc1OCC#N	ZINC000819460648	FE	On-Demand	Mild	PAPA1_CARPA	30	41
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC#N)cc1	ZINC000819460661	FE	On-Demand	Mild	ADRB2	25	40
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC#N)cc1	ZINC000819460661	FE	On-Demand	Mild	ADRB1	53	36
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC#N)cc1	ZINC000819460662	FE	On-Demand	Mild	ADRB2	25	40
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC#N)cc1	ZINC000819460662	FE	On-Demand	Mild	ADRB1	53	36
COC[C@@H](O)CNc1ccccc1OCC(F)F	ZINC000819460676	CD	On-Demand	Clean	ADRB2	30	47
COC[C@@H](O)CNc1ccccc1OCC(F)F	ZINC000819460676	CD	On-Demand	Clean	ADRB1	57	37
CON(C)C(=O)CCNc1ccc2cc(Br)ccc2c1	ZINC000819460685	EG	On-Demand	Anodyne	NCEH1	20	45
N#CCOc1cc(F)ccc1NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819460690	GH	On-Demand	Mild	PDS	48	39
N#CCOc1cc(F)ccc1NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819460691	GH	On-Demand	Mild	PDS	48	39
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccccc2OCC(F)F)c1	ZINC000819460692	FG	On-Demand	Clean	ADRB2	24	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccccc2OCC(F)F)c1	ZINC000819460692	FG	On-Demand	Clean	ADRB1	60	45
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccccc2OCC(F)F)c1	ZINC000819460692	FG	On-Demand	Clean	PDS	42	47
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)c1	ZINC000819460693	FG	On-Demand	Clean	ADRB2	24	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)c1	ZINC000819460693	FG	On-Demand	Clean	ADRB1	60	45
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)c1	ZINC000819460693	FG	On-Demand	Clean	PDS	42	47
CC[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819460709	CF	On-Demand	Anodyne	ESR1	85	43
CC[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819460709	CF	On-Demand	Anodyne	KCNH2	15	45
CC[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819460709	CF	On-Demand	Anodyne	ESR2	61	43
CC[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819460709	CF	On-Demand	Anodyne	LTA4H	63	55
CC[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819460709	CF	On-Demand	Anodyne	HRH3	78	52
CC[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819460709	CF	On-Demand	Anodyne	PSMB2	56	53
CC[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819460709	CF	On-Demand	Anodyne	PSMB1	61	54
N=C(O)OCCNC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819460715	FE	On-Demand	Anodyne	CNR1	54	33
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819460718	DF	On-Demand	Anodyne	ESR1	94	40
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819460718	DF	On-Demand	Anodyne	ESR2	64	42
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819460718	DF	On-Demand	Anodyne	LTA4H	65	54
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819460718	DF	On-Demand	Anodyne	HRH3	75	52
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819460718	DF	On-Demand	Anodyne	PSMB2	52	50
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819460718	DF	On-Demand	Anodyne	PSMB1	58	50
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819460719	DF	On-Demand	Anodyne	ESR1	94	40
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819460719	DF	On-Demand	Anodyne	ESR2	64	42
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819460719	DF	On-Demand	Anodyne	LTA4H	65	54
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819460719	DF	On-Demand	Anodyne	HRH3	75	52
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819460719	DF	On-Demand	Anodyne	PSMB2	52	50
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819460719	DF	On-Demand	Anodyne	PSMB1	58	50
O=S1(=O)CCC(O)(CNc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819460722	GD	On-Demand	Anodyne	ESR1	76	43
O=S1(=O)CCC(O)(CNc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819460722	GD	On-Demand	Anodyne	ESR2	55	43
O=S1(=O)CCC(O)(CNc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819460722	GD	On-Demand	Anodyne	LTA4H	56	51
O=S1(=O)CCC(O)(CNc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819460722	GD	On-Demand	Anodyne	HRH3	62	49
O=S1(=O)CCC(O)(CNc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819460722	GD	On-Demand	Anodyne	PSMB2	51	52
O=S1(=O)CCC(O)(CNc2ccc(OCCN3CCCCC3)cc2)CC1	ZINC000819460722	GD	On-Demand	Anodyne	PSMB1	54	50
C[C@@H](C(N)=O)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819460738	EC	On-Demand	Mild	PAPA1_CARPA	42	47
C[C@@H](C(N)=O)N(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819460738	EC	On-Demand	Mild	CTSK	17	44
C[C@@H](C(N)=O)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819460739	EC	On-Demand	Mild	PAPA1_CARPA	42	47
C[C@@H](C(N)=O)N(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819460739	EC	On-Demand	Mild	CTSK	17	44
O[C@@H](CNc1cccc(-c2cn(Cc3ccccc3)nn2)c1)C1CC1	ZINC000819460743	EG	On-Demand	Anodyne	HDAC10	21	52
O[C@@H](CNc1cccc(-c2cn(Cc3ccccc3)nn2)c1)C1CC1	ZINC000819460743	EG	On-Demand	Anodyne	HDAC3	22	52
O[C@@H](CNc1cccc(-c2cn(Cc3ccccc3)nn2)c1)C1CC1	ZINC000819460743	EG	On-Demand	Anodyne	HDAC6	19	52
O[C@@H](CNc1cccc(-c2cn(Cc3ccccc3)nn2)c1)C1CC1	ZINC000819460743	EG	On-Demand	Anodyne	CDC7	18	41
O[C@H](CNc1cccc(-c2cn(Cc3ccccc3)nn2)c1)C1CC1	ZINC000819460744	EG	On-Demand	Anodyne	HDAC10	21	52
O[C@H](CNc1cccc(-c2cn(Cc3ccccc3)nn2)c1)C1CC1	ZINC000819460744	EG	On-Demand	Anodyne	HDAC3	22	52
O[C@H](CNc1cccc(-c2cn(Cc3ccccc3)nn2)c1)C1CC1	ZINC000819460744	EG	On-Demand	Anodyne	HDAC6	19	52
O[C@H](CNc1cccc(-c2cn(Cc3ccccc3)nn2)c1)C1CC1	ZINC000819460744	EG	On-Demand	Anodyne	CDC7	18	41
C[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)S(C)(=O)=O	ZINC000819460750	EE	On-Demand	Anodyne	ESR1	77	40
C[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)S(C)(=O)=O	ZINC000819460750	EE	On-Demand	Anodyne	KCNH2	16	41
C[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)S(C)(=O)=O	ZINC000819460750	EE	On-Demand	Anodyne	ESR2	54	40
C[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)S(C)(=O)=O	ZINC000819460750	EE	On-Demand	Anodyne	LTA4H	58	56
C[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)S(C)(=O)=O	ZINC000819460750	EE	On-Demand	Anodyne	HRH3	73	50
C[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)S(C)(=O)=O	ZINC000819460750	EE	On-Demand	Anodyne	TNK2	22	42
C[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)S(C)(=O)=O	ZINC000819460750	EE	On-Demand	Anodyne	PSMB2	50	49
C[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)S(C)(=O)=O	ZINC000819460750	EE	On-Demand	Anodyne	PSMB1	56	55
C[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)S(C)(=O)=O	ZINC000819460750	EE	On-Demand	Anodyne	TBK1	15	42
CCc1nc2ccccc2n1C1CCN(C(=O)/C=C\[C@H]2CCCO2)CC1	ZINC000819460762	FG	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1C1CCN(C(=O)/C=C/[C@@H]2CCCO2)CC1	ZINC000819460763	FG	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1C1CCN(C(=O)/C=C\[C@@H]2CCCO2)CC1	ZINC000819460764	FG	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1C1CCN(C(=O)/C=C/[C@H]2CCCO2)CC1	ZINC000819460765	FG	On-Demand	Anodyne	FPR2	27	49
CN(C)c1nc2cc(NC[C@H](O)c3cccnc3)ccc2o1	ZINC000819460771	CE	On-Demand	Anodyne	ADRB1	20	41
CN(C)c1nc2cc(NC[C@H](O)c3cccnc3)ccc2o1	ZINC000819460771	CE	On-Demand	Anodyne	ADRB3	75	42
CN(C)c1nc2cc(NC[C@@H](O)c3cccnc3)ccc2o1	ZINC000819460772	CE	On-Demand	Anodyne	ADRB1	20	41
CN(C)c1nc2cc(NC[C@@H](O)c3cccnc3)ccc2o1	ZINC000819460772	CE	On-Demand	Anodyne	ADRB3	75	42
COCCNC(=O)c1ccccc1NC(=O)CC1CCCCC1	ZINC000819460773	DF	On-Demand	Anodyne	HCN1	40	31
COCCNC(=O)c1ccccc1NC(=O)CC1CCCCC1	ZINC000819460773	DF	On-Demand	Anodyne	HCN4	40	32
COCCNC(=O)c1ccccc1NC(=O)CC1CCCCC1	ZINC000819460773	DF	On-Demand	Anodyne	POLR1A	45	34
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)cc(F)c2OC)cc1	ZINC000819460827	FF	On-Demand	Anodyne	ADRB2	29	43
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)cc(F)c2OC)cc1	ZINC000819460827	FF	On-Demand	Anodyne	ADRB1	47	40
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)cc(F)c2OC)cc1	ZINC000819460827	FF	On-Demand	Anodyne	ADRB3	27	40
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)cc(F)c2OC)cc1	ZINC000819460828	FF	On-Demand	Anodyne	ADRB2	29	43
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)cc(F)c2OC)cc1	ZINC000819460828	FF	On-Demand	Anodyne	ADRB1	47	40
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)cc(F)c2OC)cc1	ZINC000819460828	FF	On-Demand	Anodyne	ADRB3	27	40
COCCNC(=O)c1ccccc1NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-]	ZINC000819460829	HE	On-Demand	Bother	KCNMA1	38	47
COCCNC(=O)c1ccccc1NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-]	ZINC000819460829	HE	On-Demand	Bother	ABCG2	20	42
O[C@H](CNc1ccccc1OCC(F)F)COc1ccccc1Cl	ZINC000819460841	FH	On-Demand	Clean	ADRB2	24	50
O[C@H](CNc1ccccc1OCC(F)F)COc1ccccc1Cl	ZINC000819460841	FH	On-Demand	Clean	ADRB1	56	37
O[C@@H](CNc1ccccc1OCC(F)F)COc1ccccc1Cl	ZINC000819460842	FH	On-Demand	Clean	ADRB2	24	50
O[C@@H](CNc1ccccc1OCC(F)F)COc1ccccc1Cl	ZINC000819460842	FH	On-Demand	Clean	ADRB1	56	37
OC1(CNc2ccccc2OCC(F)F)CCCCC1	ZINC000819460845	CG	On-Demand	Anodyne	HCN1	50	31
OC1(CNc2ccccc2OCC(F)F)CCCCC1	ZINC000819460845	CG	On-Demand	Anodyne	HCN4	48	31
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460852	FG	On-Demand	Clean	ADRB2	47	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460852	FG	On-Demand	Clean	ADRB1	76	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460852	FG	On-Demand	Clean	ABCB1	37	54
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460853	FG	On-Demand	Clean	ADRB2	47	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460853	FG	On-Demand	Clean	ADRB1	76	40
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460853	FG	On-Demand	Clean	ABCB1	37	54
CN(CCC#N)C[C@H](O)CNc1ccccc1OCC(F)F	ZINC000819460856	DD	On-Demand	Mild	ADRB1	47	33
CN(CCC#N)C[C@@H](O)CNc1ccccc1OCC(F)F	ZINC000819460857	DD	On-Demand	Mild	ADRB1	47	33
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460909	FG	On-Demand	Mild	ADRB2	39	42
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460909	FG	On-Demand	Mild	ADRB1	74	40
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460909	FG	On-Demand	Mild	ADRB3	33	42
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460909	FG	On-Demand	Mild	CASR	43	40
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460909	FG	On-Demand	Mild	CYP2D6	18	42
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460912	FG	On-Demand	Mild	ADRB2	39	42
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460912	FG	On-Demand	Mild	ADRB1	74	40
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460912	FG	On-Demand	Mild	ADRB3	33	42
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460912	FG	On-Demand	Mild	CASR	43	40
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OCC(F)F)cc1	ZINC000819460912	FG	On-Demand	Mild	CYP2D6	18	42
COCCNC(=O)c1ccccc1NC(=O)CSc1ccc2c3c(cccc13)CC2	ZINC000819460933	HI	On-Demand	Anodyne	FAS	33	42
CCCOc1cc(F)ccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819460936	ED	On-Demand	Anodyne	CCR1	37	44
CCCOc1cc(F)ccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819460939	ED	On-Demand	Anodyne	CCR1	37	44
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCOCC1	ZINC000819460952	EF	On-Demand	Anodyne	ESR1	96	42
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCOCC1	ZINC000819460952	EF	On-Demand	Anodyne	ESR2	68	42
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCOCC1	ZINC000819460952	EF	On-Demand	Anodyne	LTA4H	59	53
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCOCC1	ZINC000819460952	EF	On-Demand	Anodyne	HRH3	65	59
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCOCC1	ZINC000819460952	EF	On-Demand	Anodyne	EPHX2	18	46
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCOCC1	ZINC000819460952	EF	On-Demand	Anodyne	PSMB2	52	51
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCOCC1	ZINC000819460952	EF	On-Demand	Anodyne	PSMB1	56	49
CSc1cc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccn1	ZINC000819460957	GG	On-Demand	Mild	PAPA1_CARPA	48	48
CSc1cc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccn1	ZINC000819460958	GG	On-Demand	Mild	PAPA1_CARPA	48	48
N#CCC[C@@H](C#N)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819460966	EG	On-Demand	Mild	ESR1	66	36
N#CCC[C@@H](C#N)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819460966	EG	On-Demand	Mild	ESR2	47	36
N#CCC[C@@H](C#N)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819460966	EG	On-Demand	Mild	LTA4H	48	50
N#CCC[C@@H](C#N)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819460966	EG	On-Demand	Mild	HRH3	53	45
N#CCC[C@@H](C#N)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819460966	EG	On-Demand	Mild	PSMB2	46	46
N#CCC[C@@H](C#N)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819460966	EG	On-Demand	Mild	PSMB1	51	46
N#CCC[C@H](C#N)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819460968	EG	On-Demand	Mild	ESR1	66	36
N#CCC[C@H](C#N)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819460968	EG	On-Demand	Mild	ESR2	47	36
N#CCC[C@H](C#N)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819460968	EG	On-Demand	Mild	LTA4H	48	50
N#CCC[C@H](C#N)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819460968	EG	On-Demand	Mild	HRH3	53	45
N#CCC[C@H](C#N)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819460968	EG	On-Demand	Mild	PSMB2	46	46
N#CCC[C@H](C#N)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819460968	EG	On-Demand	Mild	PSMB1	51	46
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819460991	GG	On-Demand	Mild	ESR1	72	40
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819460991	GG	On-Demand	Mild	ADRB1	43	35
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819460991	GG	On-Demand	Mild	ESR2	51	40
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819460991	GG	On-Demand	Mild	LTA4H	46	49
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819460991	GG	On-Demand	Mild	HRH3	53	57
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819460991	GG	On-Demand	Mild	PSMB2	48	45
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819460991	GG	On-Demand	Mild	PSMB1	53	45
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819460991	GG	On-Demand	Mild	TBK1	16	42
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819460991	GG	On-Demand	Mild	MEN1	41	39
N#Cc1ccc(OC[C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819460995	GG	On-Demand	Mild	ESR1	72	40
N#Cc1ccc(OC[C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819460995	GG	On-Demand	Mild	ADRB1	43	35
N#Cc1ccc(OC[C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819460995	GG	On-Demand	Mild	ESR2	51	40
N#Cc1ccc(OC[C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819460995	GG	On-Demand	Mild	LTA4H	46	49
N#Cc1ccc(OC[C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819460995	GG	On-Demand	Mild	HRH3	53	57
N#Cc1ccc(OC[C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819460995	GG	On-Demand	Mild	PSMB2	48	45
N#Cc1ccc(OC[C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819460995	GG	On-Demand	Mild	PSMB1	53	45
N#Cc1ccc(OC[C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819460995	GG	On-Demand	Mild	TBK1	16	42
N#Cc1ccc(OC[C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819460995	GG	On-Demand	Mild	MEN1	41	39
O[C@H](CNc1ccccc1OCC(F)F)c1cccnc1	ZINC000819461001	CF	On-Demand	Anodyne	ADRB3	60	40
O[C@@H](CNc1ccccc1OCC(F)F)c1cccnc1	ZINC000819461006	CF	On-Demand	Anodyne	ADRB3	60	40
O[C@@H](CNc1ccccc1OCC(F)F)COCc1ccccc1F	ZINC000819461033	FG	On-Demand	Clean	ADRB1	26	40
O[C@H](CNc1ccccc1OCC(F)F)COCc1ccccc1F	ZINC000819461034	FG	On-Demand	Clean	ADRB1	26	40
O[C@H](CNc1ccccc1OCC(F)F)Cc1ccc(F)cc1	ZINC000819461035	EG	On-Demand	Clean	ADRB1	39	42
O[C@@H](CNc1ccccc1OCC(F)F)Cc1ccc(F)cc1	ZINC000819461036	EG	On-Demand	Clean	ADRB1	39	42
O[C@H](CNc1ccccc1OCC(F)F)COCc1cccs1	ZINC000819461037	EG	On-Demand	Clean	ADRB1	40	32
O[C@@H](CNc1ccccc1OCC(F)F)COCc1cccs1	ZINC000819461038	EG	On-Demand	Clean	ADRB1	40	32
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2cccc(-n3ccnn3)c2)CC1	ZINC000819461056	GF	On-Demand	Anodyne	GPR119	42	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2cccc(-n3ccnn3)c2)CC1	ZINC000819461057	GF	On-Demand	Anodyne	GPR119	42	45
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)CC(F)(F)F	ZINC000819461062	EG	On-Demand	Anodyne	ESR1	75	39
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)CC(F)(F)F	ZINC000819461062	EG	On-Demand	Anodyne	ESR2	55	39
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)CC(F)(F)F	ZINC000819461062	EG	On-Demand	Anodyne	LTA4H	56	52
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)CC(F)(F)F	ZINC000819461062	EG	On-Demand	Anodyne	HRH3	57	49
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)CC(F)(F)F	ZINC000819461062	EG	On-Demand	Anodyne	PSMB2	50	48
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)CC(F)(F)F	ZINC000819461062	EG	On-Demand	Anodyne	PSMB1	56	51
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)CC(F)(F)F	ZINC000819461063	EG	On-Demand	Anodyne	ESR1	75	39
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)CC(F)(F)F	ZINC000819461063	EG	On-Demand	Anodyne	ESR2	55	39
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)CC(F)(F)F	ZINC000819461063	EG	On-Demand	Anodyne	LTA4H	56	52
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)CC(F)(F)F	ZINC000819461063	EG	On-Demand	Anodyne	HRH3	57	49
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)CC(F)(F)F	ZINC000819461063	EG	On-Demand	Anodyne	PSMB2	50	48
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)CC(F)(F)F	ZINC000819461063	EG	On-Demand	Anodyne	PSMB1	56	51
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCCC1	ZINC000819461068	DG	On-Demand	Anodyne	ESR1	88	42
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCCC1	ZINC000819461068	DG	On-Demand	Anodyne	ESR2	62	42
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCCC1	ZINC000819461068	DG	On-Demand	Anodyne	LTA4H	66	57
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCCC1	ZINC000819461068	DG	On-Demand	Anodyne	HRH3	75	55
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCCC1	ZINC000819461068	DG	On-Demand	Anodyne	HNMT	43	41
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCCC1	ZINC000819461068	DG	On-Demand	Anodyne	PSMB2	57	59
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCCC1	ZINC000819461068	DG	On-Demand	Anodyne	PSMB1	61	53
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCCC1	ZINC000819461068	DG	On-Demand	Anodyne	TBK1	17	40
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461074	EH	On-Demand	Anodyne	ESR1	87	42
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461074	EH	On-Demand	Anodyne	ADRB1	18	40
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461074	EH	On-Demand	Anodyne	SLC6A3	22	44
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461074	EH	On-Demand	Anodyne	KCNH2	16	43
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461074	EH	On-Demand	Anodyne	ESR2	62	42
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461074	EH	On-Demand	Anodyne	ADRB3	20	40
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461074	EH	On-Demand	Anodyne	LTA4H	86	63
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461074	EH	On-Demand	Anodyne	HRH3	75	57
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461074	EH	On-Demand	Anodyne	HNMT	66	43
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461074	EH	On-Demand	Anodyne	PSMB2	56	51
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461074	EH	On-Demand	Anodyne	PSMB1	61	56
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461075	EH	On-Demand	Anodyne	ESR1	87	42
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461075	EH	On-Demand	Anodyne	ADRB1	18	40
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461075	EH	On-Demand	Anodyne	SLC6A3	22	44
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461075	EH	On-Demand	Anodyne	KCNH2	16	43
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461075	EH	On-Demand	Anodyne	ESR2	62	42
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461075	EH	On-Demand	Anodyne	ADRB3	20	40
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461075	EH	On-Demand	Anodyne	LTA4H	86	63
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461075	EH	On-Demand	Anodyne	HRH3	75	57
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461075	EH	On-Demand	Anodyne	HNMT	66	43
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461075	EH	On-Demand	Anodyne	PSMB2	56	51
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461075	EH	On-Demand	Anodyne	PSMB1	61	56
CC(C)(O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461078	CF	On-Demand	Anodyne	ESR1	96	43
CC(C)(O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461078	CF	On-Demand	Anodyne	ACHE	15	44
CC(C)(O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461078	CF	On-Demand	Anodyne	KCNH2	15	42
CC(C)(O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461078	CF	On-Demand	Anodyne	ESR2	67	45
CC(C)(O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461078	CF	On-Demand	Anodyne	LTA4H	80	59
CC(C)(O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461078	CF	On-Demand	Anodyne	HRH3	95	61
CC(C)(O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461078	CF	On-Demand	Anodyne	HNMT	59	41
CC(C)(O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461078	CF	On-Demand	Anodyne	PSMB2	59	59
CC(C)(O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461078	CF	On-Demand	Anodyne	PSMB1	65	62
CC(C)(O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461078	CF	On-Demand	Anodyne	TBK1	17	41
O=C1CCCN1C[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461095	FD	On-Demand	Anodyne	ESR1	73	38
O=C1CCCN1C[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461095	FD	On-Demand	Anodyne	ESR2	53	38
O=C1CCCN1C[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461095	FD	On-Demand	Anodyne	LTA4H	51	48
O=C1CCCN1C[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461095	FD	On-Demand	Anodyne	HRH3	56	43
O=C1CCCN1C[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461095	FD	On-Demand	Anodyne	PSMB2	47	44
O=C1CCCN1C[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461095	FD	On-Demand	Anodyne	PSMB1	53	47
O=C1CCCN1C[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461096	FD	On-Demand	Anodyne	ESR1	73	38
O=C1CCCN1C[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461096	FD	On-Demand	Anodyne	ESR2	53	38
O=C1CCCN1C[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461096	FD	On-Demand	Anodyne	LTA4H	51	48
O=C1CCCN1C[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461096	FD	On-Demand	Anodyne	HRH3	56	43
O=C1CCCN1C[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461096	FD	On-Demand	Anodyne	PSMB2	47	44
O=C1CCCN1C[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461096	FD	On-Demand	Anodyne	PSMB1	53	47
CN(C[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819461122	EE	On-Demand	Anodyne	ESR1	91	39
CN(C[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819461122	EE	On-Demand	Anodyne	ESR2	63	39
CN(C[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819461122	EE	On-Demand	Anodyne	LTA4H	58	48
CN(C[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819461122	EE	On-Demand	Anodyne	HRH3	67	47
CN(C[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819461122	EE	On-Demand	Anodyne	PSMB2	48	44
CN(C[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819461122	EE	On-Demand	Anodyne	PSMB1	53	47
CN(C[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819461123	EE	On-Demand	Anodyne	ESR1	91	39
CN(C[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819461123	EE	On-Demand	Anodyne	ESR2	63	39
CN(C[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819461123	EE	On-Demand	Anodyne	LTA4H	58	48
CN(C[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819461123	EE	On-Demand	Anodyne	HRH3	67	47
CN(C[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819461123	EE	On-Demand	Anodyne	PSMB2	48	44
CN(C[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000819461123	EE	On-Demand	Anodyne	PSMB1	53	47
O=[N+]([O-])c1ccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461153	GH	On-Demand	Bother	ESR1	68	38
O=[N+]([O-])c1ccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461153	GH	On-Demand	Bother	ESR2	48	38
O=[N+]([O-])c1ccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461153	GH	On-Demand	Bother	LTA4H	48	62
O=[N+]([O-])c1ccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461153	GH	On-Demand	Bother	HRH3	46	52
O=[N+]([O-])c1ccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461153	GH	On-Demand	Bother	PSMB2	45	43
O=[N+]([O-])c1ccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461153	GH	On-Demand	Bother	PSMB1	51	51
O=[N+]([O-])c1ccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461154	GH	On-Demand	Bother	ESR1	68	38
O=[N+]([O-])c1ccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461154	GH	On-Demand	Bother	ESR2	48	38
O=[N+]([O-])c1ccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461154	GH	On-Demand	Bother	LTA4H	48	62
O=[N+]([O-])c1ccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461154	GH	On-Demand	Bother	HRH3	46	52
O=[N+]([O-])c1ccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461154	GH	On-Demand	Bother	PSMB2	45	43
O=[N+]([O-])c1ccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461154	GH	On-Demand	Bother	PSMB1	51	51
COCCNC(=O)c1ccccc1NC(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	ZINC000819461155	GC	On-Demand	Anodyne	WNT3	19	42
COCCNC(=O)c1ccccc1NC(=O)CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1	ZINC000819461156	GC	On-Demand	Anodyne	WNT3	19	42
COCCNC(=O)c1ccccc1NC(=O)CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O	ZINC000819461157	GC	On-Demand	Anodyne	WNT3	19	42
N#Cc1ccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461158	FH	On-Demand	Mild	ESR1	72	40
N#Cc1ccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461158	FH	On-Demand	Mild	ESR2	51	40
N#Cc1ccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461158	FH	On-Demand	Mild	LTA4H	50	49
N#Cc1ccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461158	FH	On-Demand	Mild	HRH3	53	57
N#Cc1ccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461158	FH	On-Demand	Mild	PSMB2	48	45
N#Cc1ccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461158	FH	On-Demand	Mild	PSMB1	53	51
N#Cc1ccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461158	FH	On-Demand	Mild	MEN1	41	39
N#Cc1ccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461159	FH	On-Demand	Mild	ESR1	72	40
N#Cc1ccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461159	FH	On-Demand	Mild	ESR2	51	40
N#Cc1ccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461159	FH	On-Demand	Mild	LTA4H	50	49
N#Cc1ccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461159	FH	On-Demand	Mild	HRH3	53	57
N#Cc1ccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461159	FH	On-Demand	Mild	PSMB2	48	45
N#Cc1ccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461159	FH	On-Demand	Mild	PSMB1	53	51
N#Cc1ccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)cc1	ZINC000819461159	FH	On-Demand	Mild	MEN1	41	39
COC[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461166	DD	On-Demand	Anodyne	ESR1	83	40
COC[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461166	DD	On-Demand	Anodyne	ADRB2	22	40
COC[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461166	DD	On-Demand	Anodyne	ADRB1	34	40
COC[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461166	DD	On-Demand	Anodyne	ESR2	59	42
COC[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461166	DD	On-Demand	Anodyne	LTA4H	62	54
COC[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461166	DD	On-Demand	Anodyne	HRH3	74	51
COC[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461166	DD	On-Demand	Anodyne	PSMB2	54	50
COC[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461166	DD	On-Demand	Anodyne	PSMB1	59	53
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000819461170	FE	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000819461170	FE	On-Demand	Anodyne	CACNA1I	42	32
CCCc1cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n(C)n1	ZINC000819461175	FF	On-Demand	Mild	PAPA1_CARPA	39	47
CCCc1cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n(C)n1	ZINC000819461175	FF	On-Demand	Mild	CTSK	15	41
CCCc1cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n(C)n1	ZINC000819461176	FF	On-Demand	Mild	PAPA1_CARPA	39	47
CCCc1cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n(C)n1	ZINC000819461176	FF	On-Demand	Mild	CTSK	15	41
N#CCCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461178	CF	On-Demand	Mild	ESR1	77	40
N#CCCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461178	CF	On-Demand	Mild	ESR2	56	40
N#CCCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461178	CF	On-Demand	Mild	LTA4H	64	57
N#CCCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461178	CF	On-Demand	Mild	HRH3	79	53
N#CCCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461178	CF	On-Demand	Mild	HNMT	75	41
N#CCCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461178	CF	On-Demand	Mild	PSMB2	53	53
N#CCCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461178	CF	On-Demand	Mild	PSMB1	58	53
N#CCCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461178	CF	On-Demand	Mild	TBK1	17	43
CCc1nc2ccccc2n1C1CCN(C(=O)C(F)=C2CCC2)CC1	ZINC000819461191	EI	On-Demand	Anodyne	FPR2	28	51
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000819461234	FF	On-Demand	Anodyne	LIPE	16	42
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000819461234	FF	On-Demand	Anodyne	LIPG	34	51
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000819461235	FF	On-Demand	Anodyne	LIPE	16	42
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000819461235	FF	On-Demand	Anodyne	LIPG	34	51
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000819461236	FF	On-Demand	Anodyne	LIPE	16	42
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000819461236	FF	On-Demand	Anodyne	LIPG	34	51
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000819461237	FF	On-Demand	Anodyne	LIPE	16	42
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000819461237	FF	On-Demand	Anodyne	LIPG	34	51
O=[N+]([O-])c1cnn(C[C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461242	GE	On-Demand	Bother	LTA4H	37	49
O=[N+]([O-])c1cnn(C[C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461242	GE	On-Demand	Bother	HRH3	32	44
O=[N+]([O-])c1cnn(C[C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461242	GE	On-Demand	Bother	PSMB2	41	40
O=[N+]([O-])c1cnn(C[C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461242	GE	On-Demand	Bother	PSMB1	45	40
O=[N+]([O-])c1cnn(C[C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461243	GE	On-Demand	Bother	LTA4H	37	49
O=[N+]([O-])c1cnn(C[C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461243	GE	On-Demand	Bother	HRH3	32	44
O=[N+]([O-])c1cnn(C[C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461243	GE	On-Demand	Bother	PSMB2	41	40
O=[N+]([O-])c1cnn(C[C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461243	GE	On-Demand	Bother	PSMB1	45	40
C[C@@H](C(N)=O)N(C)C(=O)CCc1cccc(OC(F)F)c1	ZINC000819461251	DD	On-Demand	Anodyne	CRTM	49	37
COCCNC(=O)c1ccccc1NC(=O)c1ccc2c(c1)C(=O)N(Cc1ccncc1)C2=O	ZINC000819461255	JF	On-Demand	Anodyne	HDAC1	16	46
C[C@@H](C(N)=O)N(C)C(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819461290	GF	On-Demand	Anodyne	CTSK	15	49
C[C@@H](C(N)=O)N(C)C(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819461290	GF	On-Demand	Anodyne	ECE1	21	41
C[C@@H](C(N)=O)N(C)C(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819461290	GF	On-Demand	Anodyne	REN	45	43
C[C@@H](C(N)=O)N(C)C(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819461291	GF	On-Demand	Anodyne	CTSK	15	49
C[C@@H](C(N)=O)N(C)C(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819461291	GF	On-Demand	Anodyne	ECE1	21	41
C[C@@H](C(N)=O)N(C)C(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819461291	GF	On-Demand	Anodyne	REN	45	43
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461307	GH	On-Demand	Bother	ESR1	74	38
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461307	GH	On-Demand	Bother	HRH2	26	43
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461307	GH	On-Demand	Bother	ESR2	53	38
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461307	GH	On-Demand	Bother	LTA4H	49	59
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461307	GH	On-Demand	Bother	HRH3	56	42
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461307	GH	On-Demand	Bother	PSMB2	44	40
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461307	GH	On-Demand	Bother	PSMB1	48	42
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461308	GH	On-Demand	Bother	ESR1	74	38
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461308	GH	On-Demand	Bother	HRH2	26	43
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461308	GH	On-Demand	Bother	ESR2	53	38
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461308	GH	On-Demand	Bother	LTA4H	49	59
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461308	GH	On-Demand	Bother	HRH3	56	42
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461308	GH	On-Demand	Bother	PSMB2	44	40
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000819461308	GH	On-Demand	Bother	PSMB1	48	42
COCCNC(=O)c1ccccc1NC(=O)CSc1nnc(-c2ccc(OC)cc2)o1	ZINC000819461318	IF	On-Demand	Anodyne	FAS	39	40
NC(=O)CONC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819461322	FD	On-Demand	Anodyne	CNR1	54	33
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccc(F)cn1	ZINC000819461330	FG	On-Demand	Anodyne	ESR1	70	39
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccc(F)cn1	ZINC000819461330	FG	On-Demand	Anodyne	ESR2	50	39
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccc(F)cn1	ZINC000819461330	FG	On-Demand	Anodyne	LTA4H	49	50
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccc(F)cn1	ZINC000819461330	FG	On-Demand	Anodyne	HRH3	53	43
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccc(F)cn1	ZINC000819461330	FG	On-Demand	Anodyne	PSMB2	46	44
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccc(F)cn1	ZINC000819461330	FG	On-Demand	Anodyne	PSMB1	50	44
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccc(F)cn1	ZINC000819461331	FG	On-Demand	Anodyne	ESR1	70	39
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccc(F)cn1	ZINC000819461331	FG	On-Demand	Anodyne	ESR2	50	39
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccc(F)cn1	ZINC000819461331	FG	On-Demand	Anodyne	LTA4H	49	50
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccc(F)cn1	ZINC000819461331	FG	On-Demand	Anodyne	HRH3	53	43
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccc(F)cn1	ZINC000819461331	FG	On-Demand	Anodyne	PSMB2	46	44
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1ccc(F)cn1	ZINC000819461331	FG	On-Demand	Anodyne	PSMB1	50	44
O=C(CCNc1ccc(OCCN2CCCCC2)cc1)Nc1cccnc1	ZINC000819461348	FG	On-Demand	Anodyne	ESR1	69	37
O=C(CCNc1ccc(OCCN2CCCCC2)cc1)Nc1cccnc1	ZINC000819461348	FG	On-Demand	Anodyne	HRH2	43	41
O=C(CCNc1ccc(OCCN2CCCCC2)cc1)Nc1cccnc1	ZINC000819461348	FG	On-Demand	Anodyne	HTR2A	19	40
O=C(CCNc1ccc(OCCN2CCCCC2)cc1)Nc1cccnc1	ZINC000819461348	FG	On-Demand	Anodyne	ESR2	50	38
O=C(CCNc1ccc(OCCN2CCCCC2)cc1)Nc1cccnc1	ZINC000819461348	FG	On-Demand	Anodyne	LTA4H	77	51
O=C(CCNc1ccc(OCCN2CCCCC2)cc1)Nc1cccnc1	ZINC000819461348	FG	On-Demand	Anodyne	HRH3	60	50
O=C(CCNc1ccc(OCCN2CCCCC2)cc1)Nc1cccnc1	ZINC000819461348	FG	On-Demand	Anodyne	CHRNA7	46	53
O=C(CCNc1ccc(OCCN2CCCCC2)cc1)Nc1cccnc1	ZINC000819461348	FG	On-Demand	Anodyne	HNMT	72	39
O=C(CCNc1ccc(OCCN2CCCCC2)cc1)Nc1cccnc1	ZINC000819461348	FG	On-Demand	Anodyne	EPHX2	24	41
O=C(CCNc1ccc(OCCN2CCCCC2)cc1)Nc1cccnc1	ZINC000819461348	FG	On-Demand	Anodyne	MCHR1	17	40
O=C(CCNc1ccc(OCCN2CCCCC2)cc1)Nc1cccnc1	ZINC000819461348	FG	On-Demand	Anodyne	TNK2	24	41
O=C(CCNc1ccc(OCCN2CCCCC2)cc1)Nc1cccnc1	ZINC000819461348	FG	On-Demand	Anodyne	PSMB2	45	41
O=C(CCNc1ccc(OCCN2CCCCC2)cc1)Nc1cccnc1	ZINC000819461348	FG	On-Demand	Anodyne	PSMB1	49	42
O=C(CCNc1ccc(OCCN2CCCCC2)cc1)Nc1cccnc1	ZINC000819461348	FG	On-Demand	Anodyne	TBK1	15	40
O=S(=O)(CCNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461350	GG	On-Demand	Anodyne	ESR1	77	43
O=S(=O)(CCNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461350	GG	On-Demand	Anodyne	ACHE	20	42
O=S(=O)(CCNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461350	GG	On-Demand	Anodyne	KCNH2	19	46
O=S(=O)(CCNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461350	GG	On-Demand	Anodyne	ESR2	55	43
O=S(=O)(CCNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461350	GG	On-Demand	Anodyne	LTA4H	74	60
O=S(=O)(CCNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461350	GG	On-Demand	Anodyne	HRH3	79	49
O=S(=O)(CCNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461350	GG	On-Demand	Anodyne	CHRNA7	15	46
O=S(=O)(CCNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461350	GG	On-Demand	Anodyne	HNMT	74	41
O=S(=O)(CCNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461350	GG	On-Demand	Anodyne	TNK2	29	43
O=S(=O)(CCNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461350	GG	On-Demand	Anodyne	PSMB2	51	47
O=S(=O)(CCNc1ccc(OCCN2CCCCC2)cc1)c1ccccc1	ZINC000819461350	GG	On-Demand	Anodyne	PSMB1	56	51
CC(C)(C)[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461360	DG	On-Demand	Anodyne	ESR1	84	41
CC(C)(C)[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461360	DG	On-Demand	Anodyne	KCNH2	15	42
CC(C)(C)[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461360	DG	On-Demand	Anodyne	ESR2	60	43
CC(C)(C)[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461360	DG	On-Demand	Anodyne	LTA4H	64	55
CC(C)(C)[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461360	DG	On-Demand	Anodyne	HRH3	75	52
CC(C)(C)[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461360	DG	On-Demand	Anodyne	PSMB2	55	51
CC(C)(C)[C@@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461360	DG	On-Demand	Anodyne	PSMB1	61	58
O=C(C(F)=C1CCC1)N1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000819461361	EG	On-Demand	Anodyne	LIPE	20	47
O=C(C(F)=C1CCC1)N1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000819461361	EG	On-Demand	Anodyne	LIPG	40	54
O=C(C(F)=C1CCC1)N1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000819461362	EG	On-Demand	Anodyne	LIPE	20	47
O=C(C(F)=C1CCC1)N1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000819461362	EG	On-Demand	Anodyne	LIPG	40	54
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)Cn1cccn1	ZINC000819461363	EE	On-Demand	Anodyne	ESR1	71	40
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)Cn1cccn1	ZINC000819461363	EE	On-Demand	Anodyne	ESR2	51	40
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)Cn1cccn1	ZINC000819461363	EE	On-Demand	Anodyne	LTA4H	60	50
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)Cn1cccn1	ZINC000819461363	EE	On-Demand	Anodyne	HRH3	58	46
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)Cn1cccn1	ZINC000819461363	EE	On-Demand	Anodyne	HNMT	53	41
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)Cn1cccn1	ZINC000819461363	EE	On-Demand	Anodyne	TNK2	27	41
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)Cn1cccn1	ZINC000819461363	EE	On-Demand	Anodyne	PSMB2	49	46
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)Cn1cccn1	ZINC000819461363	EE	On-Demand	Anodyne	PSMB1	53	46
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)Cn1cccn1	ZINC000819461364	EE	On-Demand	Anodyne	ESR1	71	40
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)Cn1cccn1	ZINC000819461364	EE	On-Demand	Anodyne	ESR2	51	40
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)Cn1cccn1	ZINC000819461364	EE	On-Demand	Anodyne	LTA4H	60	50
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)Cn1cccn1	ZINC000819461364	EE	On-Demand	Anodyne	HRH3	58	46
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)Cn1cccn1	ZINC000819461364	EE	On-Demand	Anodyne	HNMT	53	41
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)Cn1cccn1	ZINC000819461364	EE	On-Demand	Anodyne	TNK2	27	41
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)Cn1cccn1	ZINC000819461364	EE	On-Demand	Anodyne	PSMB2	49	46
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)Cn1cccn1	ZINC000819461364	EE	On-Demand	Anodyne	PSMB1	53	46
NC(=O)CONC(=O)C1(c2ccc(Cl)cc2Cl)CCCCC1	ZINC000819461371	EF	On-Demand	Anodyne	UGCG	35	41
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCC1	ZINC000819461378	DF	On-Demand	Anodyne	ESR1	89	42
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCC1	ZINC000819461378	DF	On-Demand	Anodyne	ESR2	63	45
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCC1	ZINC000819461378	DF	On-Demand	Anodyne	LTA4H	66	57
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCC1	ZINC000819461378	DF	On-Demand	Anodyne	HRH3	75	55
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCC1	ZINC000819461378	DF	On-Demand	Anodyne	HNMT	43	41
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCC1	ZINC000819461378	DF	On-Demand	Anodyne	PSMB2	56	56
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCC1	ZINC000819461378	DF	On-Demand	Anodyne	PSMB1	61	53
OC1(CNc2ccc(OCCN3CCCCC3)cc2)CCC1	ZINC000819461378	DF	On-Demand	Anodyne	TBK1	17	42
NC(=O)NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461420	ED	On-Demand	Anodyne	ESR1	78	41
NC(=O)NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461420	ED	On-Demand	Anodyne	ESR2	55	41
NC(=O)NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461420	ED	On-Demand	Anodyne	LTA4H	64	51
NC(=O)NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461420	ED	On-Demand	Anodyne	HRH3	68	54
NC(=O)NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461420	ED	On-Demand	Anodyne	CHRNA7	21	41
NC(=O)NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461420	ED	On-Demand	Anodyne	HNMT	51	37
NC(=O)NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461420	ED	On-Demand	Anodyne	PSMB2	50	47
NC(=O)NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461420	ED	On-Demand	Anodyne	PSMB1	54	47
CCC1(O)CCC(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819461429	FF	On-Demand	Mild	PAPA1_CARPA	41	49
CCC1(O)CCC(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819461429	FF	On-Demand	Mild	CTSK	16	44
CCC1(O)CCC(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819461430	FF	On-Demand	Mild	PAPA1_CARPA	41	49
CCC1(O)CCC(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819461430	FF	On-Demand	Mild	CTSK	16	44
Cn1nnnc1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819461439	FC	On-Demand	Mild	PAPA1_CARPA	43	48
Cn1nnnc1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819461440	FC	On-Demand	Mild	PAPA1_CARPA	43	48
NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461450	CD	On-Demand	Anodyne	ESR1	85	43
NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461450	CD	On-Demand	Anodyne	ACHE	15	43
NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461450	CD	On-Demand	Anodyne	HTR2A	22	42
NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461450	CD	On-Demand	Anodyne	KCNH2	15	45
NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461450	CD	On-Demand	Anodyne	ESR2	60	43
NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461450	CD	On-Demand	Anodyne	LTA4H	76	55
NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461450	CD	On-Demand	Anodyne	HRH3	87	58
NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461450	CD	On-Demand	Anodyne	CHRNA7	21	44
NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461450	CD	On-Demand	Anodyne	HNMT	75	39
NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461450	CD	On-Demand	Anodyne	EPHX2	19	41
NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461450	CD	On-Demand	Anodyne	YES1	18	40
NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461450	CD	On-Demand	Anodyne	PSMB2	53	51
NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461450	CD	On-Demand	Anodyne	PSMB1	58	51
NC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461450	CD	On-Demand	Anodyne	TBK1	15	42
CCOC[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461461	DE	On-Demand	Anodyne	ESR1	77	41
CCOC[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461461	DE	On-Demand	Anodyne	ESR2	55	41
CCOC[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461461	DE	On-Demand	Anodyne	LTA4H	54	51
CCOC[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461461	DE	On-Demand	Anodyne	HRH3	61	46
CCOC[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461461	DE	On-Demand	Anodyne	PSMB2	52	49
CCOC[C@H](O)CNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461461	DE	On-Demand	Anodyne	PSMB1	57	50
COCCNC(=O)c1ccccc1NC(=O)CN1C(=O)c2cc(Cl)c(Cl)cc2C1=O	ZINC000819461482	JF	On-Demand	Anodyne	POLR1A	40	36
O[C@H](CNc1ccc2c(c1)ncn2-c1ccccc1)C1CC1	ZINC000819461488	CG	On-Demand	Anodyne	NR1I2	52	37
O[C@H](CNc1ccc2c(c1)ncn2-c1ccccc1)C1CC1	ZINC000819461488	CG	On-Demand	Anodyne	HPGD	42	43
O[C@@H](CNc1ccc2c(c1)ncn2-c1ccccc1)C1CC1	ZINC000819461489	CG	On-Demand	Anodyne	NR1I2	52	37
O[C@@H](CNc1ccc2c(c1)ncn2-c1ccccc1)C1CC1	ZINC000819461489	CG	On-Demand	Anodyne	HPGD	42	43
O=C(/C=C/[C@@H]1CCCO1)Nc1ccn(-c2ccc(Cl)cc2Cl)n1	ZINC000819461491	FH	On-Demand	Anodyne	CNR1	51	31
O=C(/C=C/[C@H]1CCCO1)Nc1ccn(-c2ccc(Cl)cc2Cl)n1	ZINC000819461492	FH	On-Demand	Anodyne	CNR1	51	31
O=C(/C=C\[C@@H]1CCCO1)Nc1ccn(-c2ccc(Cl)cc2Cl)n1	ZINC000819461493	FH	On-Demand	Anodyne	CNR1	51	31
O=C(/C=C\[C@H]1CCCO1)Nc1ccn(-c2ccc(Cl)cc2Cl)n1	ZINC000819461494	FH	On-Demand	Anodyne	CNR1	51	31
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)COC1CCOCC1	ZINC000819461501	GF	On-Demand	Anodyne	ESR1	94	39
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)COC1CCOCC1	ZINC000819461501	GF	On-Demand	Anodyne	ADRB1	26	42
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)COC1CCOCC1	ZINC000819461501	GF	On-Demand	Anodyne	ESR2	64	39
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)COC1CCOCC1	ZINC000819461501	GF	On-Demand	Anodyne	LTA4H	55	46
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)COC1CCOCC1	ZINC000819461501	GF	On-Demand	Anodyne	HRH3	47	47
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)COC1CCOCC1	ZINC000819461501	GF	On-Demand	Anodyne	PSMB2	44	42
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)COC1CCOCC1	ZINC000819461501	GF	On-Demand	Anodyne	PSMB1	50	42
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)COC1CCOCC1	ZINC000819461502	GF	On-Demand	Anodyne	ESR1	94	39
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)COC1CCOCC1	ZINC000819461502	GF	On-Demand	Anodyne	ADRB1	26	42
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)COC1CCOCC1	ZINC000819461502	GF	On-Demand	Anodyne	ESR2	64	39
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)COC1CCOCC1	ZINC000819461502	GF	On-Demand	Anodyne	LTA4H	55	46
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)COC1CCOCC1	ZINC000819461502	GF	On-Demand	Anodyne	HRH3	47	47
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)COC1CCOCC1	ZINC000819461502	GF	On-Demand	Anodyne	PSMB2	44	42
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)COC1CCOCC1	ZINC000819461502	GF	On-Demand	Anodyne	PSMB1	50	42
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461507	EG	On-Demand	Anodyne	ESR1	71	38
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461507	EG	On-Demand	Anodyne	ADRB2	24	47
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461507	EG	On-Demand	Anodyne	ADRB1	28	47
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461507	EG	On-Demand	Anodyne	ESR2	51	38
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461507	EG	On-Demand	Anodyne	ADRB3	90	50
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461507	EG	On-Demand	Anodyne	LTA4H	65	54
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461507	EG	On-Demand	Anodyne	HRH3	56	44
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461507	EG	On-Demand	Anodyne	CHRNA7	15	42
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461507	EG	On-Demand	Anodyne	HNMT	53	41
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461507	EG	On-Demand	Anodyne	TNK2	23	41
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461507	EG	On-Demand	Anodyne	PSMB2	47	44
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461507	EG	On-Demand	Anodyne	PSMB1	52	46
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461508	EG	On-Demand	Anodyne	ESR1	71	38
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461508	EG	On-Demand	Anodyne	ADRB2	24	47
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461508	EG	On-Demand	Anodyne	ADRB1	28	47
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461508	EG	On-Demand	Anodyne	ESR2	51	38
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461508	EG	On-Demand	Anodyne	ADRB3	90	50
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461508	EG	On-Demand	Anodyne	LTA4H	65	54
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461508	EG	On-Demand	Anodyne	HRH3	56	44
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461508	EG	On-Demand	Anodyne	CHRNA7	15	42
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461508	EG	On-Demand	Anodyne	HNMT	53	41
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461508	EG	On-Demand	Anodyne	TNK2	23	41
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461508	EG	On-Demand	Anodyne	PSMB2	47	44
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)c1cccnc1	ZINC000819461508	EG	On-Demand	Anodyne	PSMB1	52	46
CON(C)C(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461527	EE	On-Demand	Anodyne	ESR1	89	39
CON(C)C(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461527	EE	On-Demand	Anodyne	ACHE	15	42
CON(C)C(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461527	EE	On-Demand	Anodyne	KCNH2	15	43
CON(C)C(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461527	EE	On-Demand	Anodyne	ESR2	63	40
CON(C)C(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461527	EE	On-Demand	Anodyne	LTA4H	61	49
CON(C)C(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461527	EE	On-Demand	Anodyne	HRH3	77	52
CON(C)C(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461527	EE	On-Demand	Anodyne	HNMT	46	36
CON(C)C(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461527	EE	On-Demand	Anodyne	PSMB2	49	45
CON(C)C(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461527	EE	On-Demand	Anodyne	PSMB1	54	48
COCCNC(=O)c1ccccc1NC(=O)c1oc2ccc(OC)cc2c1C	ZINC000819461532	GG	On-Demand	Anodyne	MTNR1A	66	41
COCCNC(=O)c1ccccc1NC(=O)c1oc2ccc(OC)cc2c1C	ZINC000819461532	GG	On-Demand	Anodyne	MTNR1B	55	41
C#CCNC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461538	EE	On-Demand	Mild	ESR1	78	39
C#CCNC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461538	EE	On-Demand	Mild	HRH2	45	41
C#CCNC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461538	EE	On-Demand	Mild	ESR2	55	40
C#CCNC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461538	EE	On-Demand	Mild	LTA4H	57	49
C#CCNC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461538	EE	On-Demand	Mild	HRH3	71	52
C#CCNC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461538	EE	On-Demand	Mild	HNMT	45	36
C#CCNC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461538	EE	On-Demand	Mild	PSMB2	49	45
C#CCNC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461538	EE	On-Demand	Mild	PSMB1	53	48
C#CCNC(=O)CCNc1ccc(OCCN2CCCCC2)cc1	ZINC000819461538	EE	On-Demand	Mild	TBK1	16	40
C[C@@](O)(CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461546	EG	On-Demand	Anodyne	ESR1	93	43
C[C@@](O)(CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461546	EG	On-Demand	Anodyne	ESR2	66	45
C[C@@](O)(CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461546	EG	On-Demand	Anodyne	LTA4H	62	54
C[C@@](O)(CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461546	EG	On-Demand	Anodyne	HRH3	76	53
C[C@@](O)(CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461546	EG	On-Demand	Anodyne	PSMB2	54	50
C[C@@](O)(CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461546	EG	On-Demand	Anodyne	PSMB1	59	57
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)CN1CCOCC1	ZINC000819461550	FD	On-Demand	Anodyne	ESR1	97	40
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)CN1CCOCC1	ZINC000819461550	FD	On-Demand	Anodyne	ESR2	67	42
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)CN1CCOCC1	ZINC000819461550	FD	On-Demand	Anodyne	LTA4H	53	50
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)CN1CCOCC1	ZINC000819461550	FD	On-Demand	Anodyne	HRH3	56	50
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)CN1CCOCC1	ZINC000819461550	FD	On-Demand	Anodyne	EPHX2	18	47
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)CN1CCOCC1	ZINC000819461550	FD	On-Demand	Anodyne	PSMB2	49	46
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)CN1CCOCC1	ZINC000819461550	FD	On-Demand	Anodyne	PSMB1	54	46
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)CN1CCOCC1	ZINC000819461551	FD	On-Demand	Anodyne	ESR1	97	40
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)CN1CCOCC1	ZINC000819461551	FD	On-Demand	Anodyne	ESR2	67	42
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)CN1CCOCC1	ZINC000819461551	FD	On-Demand	Anodyne	LTA4H	53	50
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)CN1CCOCC1	ZINC000819461551	FD	On-Demand	Anodyne	HRH3	56	50
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)CN1CCOCC1	ZINC000819461551	FD	On-Demand	Anodyne	EPHX2	18	47
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)CN1CCOCC1	ZINC000819461551	FD	On-Demand	Anodyne	PSMB2	49	46
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)CN1CCOCC1	ZINC000819461551	FD	On-Demand	Anodyne	PSMB1	54	46
NC(=O)CONC(=O)CCc1cccc(OC(F)F)c1	ZINC000819461556	CC	On-Demand	Anodyne	PLA2G4A	19	40
NC(=O)CONC(=O)CCc1cccc(OC(F)F)c1	ZINC000819461556	CC	On-Demand	Anodyne	CRTM	48	33
CON(C)C(=O)CCNc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819461567	FF	On-Demand	Anodyne	HDAC10	27	55
CON(C)C(=O)CCNc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819461567	FF	On-Demand	Anodyne	HDAC3	30	55
CON(C)C(=O)CCNc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819461567	FF	On-Demand	Anodyne	HDAC6	23	55
CON(C)C(=O)CCNc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819461567	FF	On-Demand	Anodyne	CDC7	19	44
C[C@@H](C(N)=O)N(C)C(=O)C1(c2ccc(Cl)cc2Cl)CCCCC1	ZINC000819461577	FH	On-Demand	Anodyne	UGCG	31	40
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2F)cc1C#N	ZINC000819461586	FG	On-Demand	Mild	ADRB2	18	43
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2F)cc1C#N	ZINC000819461586	FG	On-Demand	Mild	ADRB1	63	45
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2F)cc1C#N	ZINC000819461586	FG	On-Demand	Mild	CASR	43	40
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2F)cc1C#N	ZINC000819461586	FG	On-Demand	Mild	CYP2D6	17	40
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2F)cc1C#N	ZINC000819461589	FG	On-Demand	Mild	ADRB2	18	43
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2F)cc1C#N	ZINC000819461589	FG	On-Demand	Mild	ADRB1	63	45
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2F)cc1C#N	ZINC000819461589	FG	On-Demand	Mild	CASR	43	40
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2F)cc1C#N	ZINC000819461589	FG	On-Demand	Mild	CYP2D6	17	40
CCOC(=O)Nc1ccc(NC[C@H](O)CCc2ccccc2)cc1C#N	ZINC000819461595	FH	On-Demand	Mild	CTRB_BOVIN	60	39
CCOC(=O)Nc1ccc(NC[C@@H](O)CCc2ccccc2)cc1C#N	ZINC000819461601	FH	On-Demand	Mild	CTRB_BOVIN	60	39
C[C@H]1CCOCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819461605	EE	On-Demand	Mild	PAPA1_CARPA	34	42
C[C@@H]1CCOCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819461606	EE	On-Demand	Mild	PAPA1_CARPA	34	42
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461607	EF	On-Demand	Anodyne	ESR1	83	43
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461607	EF	On-Demand	Anodyne	KCNH2	15	41
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461607	EF	On-Demand	Anodyne	ESR2	59	43
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461607	EF	On-Demand	Anodyne	LTA4H	62	54
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461607	EF	On-Demand	Anodyne	HRH3	69	52
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461607	EF	On-Demand	Anodyne	PSMB2	52	50
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461607	EF	On-Demand	Anodyne	PSMB1	58	57
O[C@@H](CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461607	EF	On-Demand	Anodyne	TBK1	16	40
C[C@H]1CCOCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819461608	EE	On-Demand	Mild	PAPA1_CARPA	34	42
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461609	EF	On-Demand	Anodyne	ESR1	83	43
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461609	EF	On-Demand	Anodyne	KCNH2	15	41
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461609	EF	On-Demand	Anodyne	ESR2	59	43
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461609	EF	On-Demand	Anodyne	LTA4H	62	54
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461609	EF	On-Demand	Anodyne	HRH3	69	52
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461609	EF	On-Demand	Anodyne	PSMB2	52	50
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461609	EF	On-Demand	Anodyne	PSMB1	58	57
O[C@H](CNc1ccc(OCCN2CCCCC2)cc1)C(F)(F)F	ZINC000819461609	EF	On-Demand	Anodyne	TBK1	16	40
C[C@@H]1CCOCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819461610	EE	On-Demand	Mild	PAPA1_CARPA	34	42
COCCNC(=O)c1ccccc1NC(=O)/C=C\c1cnc2ccccc2n1	ZINC000819461623	GF	On-Demand	Anodyne	POLR1A	52	36
C[C@@H]1CCCC[C@H]1C(=O)Nc1ccc(N2CCC(N(C)C)CC2)cc1	ZINC000819461677	EH	On-Demand	Anodyne	MTOR	18	45
C[C@@H]1CCCC[C@@H]1C(=O)Nc1ccc(N2CCC(N(C)C)CC2)cc1	ZINC000819461678	EH	On-Demand	Anodyne	MTOR	18	45
CCOC(=O)CC[C@H](O)CNc1cccc([C@@H](O)CO)c1	ZINC000819461704	CC	On-Demand	Anodyne	ADRB2	15	41
CCOC(=O)CC[C@@H](O)CNc1cccc([C@@H](O)CO)c1	ZINC000819461705	CC	On-Demand	Anodyne	ADRB2	15	41
CCOC(=O)CC[C@H](O)CNc1cccc([C@H](O)CO)c1	ZINC000819461706	CC	On-Demand	Anodyne	ADRB2	15	41
CCOC(=O)CC[C@@H](O)CNc1cccc([C@H](O)CO)c1	ZINC000819461707	CC	On-Demand	Anodyne	ADRB2	15	41
OC[C@@H](O)c1cccc(NC[C@@H](O)Cc2ccccc2)c1	ZINC000819461712	CD	On-Demand	Anodyne	ADRB3	39	44
OC[C@@H](O)c1cccc(NC[C@H](O)Cc2ccccc2)c1	ZINC000819461713	CD	On-Demand	Anodyne	ADRB3	39	44
OC[C@H](O)c1cccc(NC[C@@H](O)Cc2ccccc2)c1	ZINC000819461714	CD	On-Demand	Anodyne	ADRB3	39	44
OC[C@H](O)c1cccc(NC[C@H](O)Cc2ccccc2)c1	ZINC000819461715	CD	On-Demand	Anodyne	ADRB3	39	44
COc1cc(Oc2ccccc2)ccc1NCC1(O)CCOCC1	ZINC000819461721	EG	On-Demand	Anodyne	MMP13	18	40
COc1cc(Oc2ccccc2)ccc1NCC1(O)CCOCC1	ZINC000819461721	EG	On-Demand	Anodyne	MMP2	17	40
CC(=O)Nc1cccc(CC(=O)N2CCc3cc(C)c([N+](=O)[O-])cc32)c1	ZINC000819461728	FF	On-Demand	Bother	EIF2AK3	52	38
C/C=C/c1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)c(OC)c1	ZINC000819461780	FF	On-Demand	Anodyne	ADRB2	17	60
C/C=C\c1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)c(OC)c1	ZINC000819461781	FF	On-Demand	Anodyne	ADRB2	17	60
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1C#N	ZINC000819461807	GG	On-Demand	Mild	ADRB2	21	44
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1C#N	ZINC000819461807	GG	On-Demand	Mild	ADRB1	53	39
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1C#N	ZINC000819461807	GG	On-Demand	Mild	ADRB3	17	40
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1C#N	ZINC000819461808	GG	On-Demand	Mild	ADRB2	21	44
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1C#N	ZINC000819461808	GG	On-Demand	Mild	ADRB1	53	39
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1C#N	ZINC000819461808	GG	On-Demand	Mild	ADRB3	17	40
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)cc1C#N	ZINC000819461830	GH	On-Demand	Mild	ADRB2	16	42
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)cc1C#N	ZINC000819461830	GH	On-Demand	Mild	ADRB1	51	37
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)cc1C#N	ZINC000819461830	GH	On-Demand	Mild	CASR	40	39
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)cc1C#N	ZINC000819461831	GH	On-Demand	Mild	ADRB2	16	42
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)cc1C#N	ZINC000819461831	GH	On-Demand	Mild	ADRB1	51	37
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)cc1C#N	ZINC000819461831	GH	On-Demand	Mild	CASR	40	39
CCOC(=O)Nc1ccc(NC[C@H](O)CC)cc1C#N	ZINC000819461834	CE	On-Demand	Mild	ADRB1	40	32
CCOC(=O)Nc1ccc(NC[C@H](O)COCc2cccs2)cc1C#N	ZINC000819461837	GG	On-Demand	Mild	ADRB1	43	33
CCOC(=O)Nc1ccc(NC[C@@H](O)COCc2cccs2)cc1C#N	ZINC000819461838	GG	On-Demand	Mild	ADRB1	43	33
C/C=C\c1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)c(OC)c1	ZINC000819461844	FF	On-Demand	Anodyne	ADRB2	17	60
C/C=C/c1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)c(OC)c1	ZINC000819461845	FF	On-Demand	Anodyne	ADRB2	17	60
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819461853	FD	On-Demand	Anodyne	ADRB2	52	56
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819461853	FD	On-Demand	Anodyne	ADRB1	88	56
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819461853	FD	On-Demand	Anodyne	ADRB3	75	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819461854	FD	On-Demand	Anodyne	ADRB2	52	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819461854	FD	On-Demand	Anodyne	ADRB1	88	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819461854	FD	On-Demand	Anodyne	ADRB3	75	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819461855	FD	On-Demand	Anodyne	ADRB2	52	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819461855	FD	On-Demand	Anodyne	ADRB1	88	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819461855	FD	On-Demand	Anodyne	ADRB3	75	48
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819461856	FD	On-Demand	Anodyne	ADRB2	52	56
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819461856	FD	On-Demand	Anodyne	ADRB1	88	56
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819461856	FD	On-Demand	Anodyne	ADRB3	75	48
OC[C@@H](O)c1cccc(NC[C@@H](O)COC(c2ccccc2)c2ccccc2)c1	ZINC000819461879	GG	On-Demand	Anodyne	CASR	15	46
CCCOc1nc2ccccc2cc1/C=C/C(=O)Nc1ccccc1C(=O)NCCOC	ZINC000819461880	II	On-Demand	Anodyne	POLR1A	61	39
OC[C@H](O)c1cccc(NC[C@H](O)COC(c2ccccc2)c2ccccc2)c1	ZINC000819461881	GG	On-Demand	Anodyne	CASR	15	46
OC[C@H](O)c1cccc(NC[C@@H](O)COC(c2ccccc2)c2ccccc2)c1	ZINC000819461882	GG	On-Demand	Anodyne	CASR	15	46
OC[C@@H](O)c1cccc(NC[C@H](O)COC(c2ccccc2)c2ccccc2)c1	ZINC000819461883	GG	On-Demand	Anodyne	CASR	15	46
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)c1	ZINC000819461884	ED	On-Demand	Anodyne	ADRB2	27	44
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)c1	ZINC000819461884	ED	On-Demand	Anodyne	ADRB1	42	43
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)c1	ZINC000819461884	ED	On-Demand	Anodyne	ADRB3	39	43
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)c1	ZINC000819461884	ED	On-Demand	Anodyne	ABCB1	19	45
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)c1	ZINC000819461884	ED	On-Demand	Anodyne	PDS	48	37
CC(=O)c1cccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)c1	ZINC000819461885	ED	On-Demand	Anodyne	ADRB2	27	44
CC(=O)c1cccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)c1	ZINC000819461885	ED	On-Demand	Anodyne	ADRB1	42	43
CC(=O)c1cccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)c1	ZINC000819461885	ED	On-Demand	Anodyne	ADRB3	39	43
CC(=O)c1cccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)c1	ZINC000819461885	ED	On-Demand	Anodyne	ABCB1	19	45
CC(=O)c1cccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)c1	ZINC000819461885	ED	On-Demand	Anodyne	PDS	48	37
CCCOc1nc2ccccc2cc1/C=C\C(=O)Nc1ccccc1C(=O)NCCOC	ZINC000819461886	II	On-Demand	Anodyne	POLR1A	61	39
CC(=O)c1cccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)c1	ZINC000819461887	ED	On-Demand	Anodyne	ADRB2	27	44
CC(=O)c1cccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)c1	ZINC000819461887	ED	On-Demand	Anodyne	ADRB1	42	43
CC(=O)c1cccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)c1	ZINC000819461887	ED	On-Demand	Anodyne	ADRB3	39	43
CC(=O)c1cccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)c1	ZINC000819461887	ED	On-Demand	Anodyne	ABCB1	19	45
CC(=O)c1cccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)c1	ZINC000819461887	ED	On-Demand	Anodyne	PDS	48	37
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)c1	ZINC000819461888	ED	On-Demand	Anodyne	ADRB2	27	44
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)c1	ZINC000819461888	ED	On-Demand	Anodyne	ADRB1	42	43
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)c1	ZINC000819461888	ED	On-Demand	Anodyne	ADRB3	39	43
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)c1	ZINC000819461888	ED	On-Demand	Anodyne	ABCB1	19	45
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)c1	ZINC000819461888	ED	On-Demand	Anodyne	PDS	48	37
CCC[C@H](NC(=O)C1(c2ccc(C)cc2)CCC1)C(=O)OC	ZINC000819461890	DF	On-Demand	Anodyne	AVPR1A	32	40
CCC[C@H](NC(=O)C1(c2ccc(C)cc2)CCC1)C(=O)OC	ZINC000819461890	DF	On-Demand	Anodyne	NPPA	43	33
CCC[C@@H](NC(=O)C1(c2ccc(C)cc2)CCC1)C(=O)OC	ZINC000819461891	DF	On-Demand	Anodyne	AVPR1A	32	40
CCC[C@@H](NC(=O)C1(c2ccc(C)cc2)CCC1)C(=O)OC	ZINC000819461891	DF	On-Demand	Anodyne	NPPA	43	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccccc1-n1ccnc1)C2	ZINC000819461895	FE	On-Demand	Anodyne	NOS2	77	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccccc1-n1ccnc1)C2	ZINC000819461898	FE	On-Demand	Anodyne	NOS2	77	33
CCOc1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819461901	ED	On-Demand	Anodyne	ADRB2	43	43
CCOc1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819461901	ED	On-Demand	Anodyne	ADRB1	50	40
CCOc1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819461902	ED	On-Demand	Anodyne	ADRB2	43	43
CCOc1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819461902	ED	On-Demand	Anodyne	ADRB1	50	40
CCOc1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819461904	ED	On-Demand	Anodyne	ADRB2	43	43
CCOc1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819461904	ED	On-Demand	Anodyne	ADRB1	50	40
CCOc1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819461905	ED	On-Demand	Anodyne	ADRB2	43	43
CCOc1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819461905	ED	On-Demand	Anodyne	ADRB1	50	40
COc1cc(Oc2ccccc2)ccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819461914	FF	On-Demand	Anodyne	HTR1A	23	40
COc1cc(Oc2ccccc2)ccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819461914	FF	On-Demand	Anodyne	DRD2	20	40
COc1cc(Oc2ccccc2)ccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819461914	FF	On-Demand	Anodyne	ABCB1	62	39
COc1cc(Oc2ccccc2)ccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819461915	FF	On-Demand	Anodyne	HTR1A	23	40
COc1cc(Oc2ccccc2)ccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819461915	FF	On-Demand	Anodyne	DRD2	20	40
COc1cc(Oc2ccccc2)ccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819461915	FF	On-Demand	Anodyne	ABCB1	62	39
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C)cc1C#N	ZINC000819461936	FG	On-Demand	Mild	ADRB2	21	50
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C)cc1C#N	ZINC000819461936	FG	On-Demand	Mild	ADRB1	62	42
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C)cc1C#N	ZINC000819461936	FG	On-Demand	Mild	CASR	44	41
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C)cc1C#N	ZINC000819461936	FG	On-Demand	Mild	CYP2D6	18	41
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C)cc1C#N	ZINC000819461938	FG	On-Demand	Mild	ADRB2	21	50
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C)cc1C#N	ZINC000819461938	FG	On-Demand	Mild	ADRB1	62	42
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C)cc1C#N	ZINC000819461938	FG	On-Demand	Mild	CASR	44	41
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C)cc1C#N	ZINC000819461938	FG	On-Demand	Mild	CYP2D6	18	41
O=C1CCc2cc(OC[C@H](O)CNc3cccc([C@@H](O)CO)c3)ccc2N1	ZINC000819461939	FD	On-Demand	Anodyne	ADRB1	19	41
O=C1CCc2cc(OC[C@@H](O)CNc3cccc([C@@H](O)CO)c3)ccc2N1	ZINC000819461941	FD	On-Demand	Anodyne	ADRB1	19	41
O=C1CCc2cc(OC[C@@H](O)CNc3cccc([C@H](O)CO)c3)ccc2N1	ZINC000819461944	FD	On-Demand	Anodyne	ADRB1	19	41
O=C1CCc2cc(OC[C@H](O)CNc3cccc([C@H](O)CO)c3)ccc2N1	ZINC000819461946	FD	On-Demand	Anodyne	ADRB1	19	41
CCOC(=O)Nc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1C#N	ZINC000819461994	GF	On-Demand	Mild	NOD1	17	45
CCOC(=O)Nc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1C#N	ZINC000819461994	GF	On-Demand	Mild	NOD2	46	45
CCOC(=O)Nc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1C#N	ZINC000819461995	GF	On-Demand	Mild	NOD1	17	45
CCOC(=O)Nc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1C#N	ZINC000819461995	GF	On-Demand	Mild	NOD2	46	45
COCCNC(=O)c1ccccc1NC(=O)Cc1c(C)nc2ccccc2c1-c1ccccc1	ZINC000819461998	JJ	On-Demand	Anodyne	POLR1A	45	35
C=CCC1(C(=O)Nc2ccc(N3CCC(N(C)C)CC3)cc2)CCOCC1	ZINC000819461999	FH	On-Demand	Mild	MTOR	24	44
Cn1c(=O)oc2c(NC[C@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)cccc21	ZINC000819462013	GF	On-Demand	Anodyne	GPR119	35	45
Cn1c(=O)oc2c(NC[C@@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)cccc21	ZINC000819462014	GF	On-Demand	Anodyne	GPR119	35	45
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(CC)c2)cc1C#N	ZINC000819462039	GH	On-Demand	Mild	ADRB2	25	43
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(CC)c2)cc1C#N	ZINC000819462039	GH	On-Demand	Mild	ADRB1	52	38
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(CC)c2)cc1C#N	ZINC000819462039	GH	On-Demand	Mild	CASR	40	38
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(CC)c2)cc1C#N	ZINC000819462039	GH	On-Demand	Mild	PDS	74	42
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(CC)c2)cc1C#N	ZINC000819462040	GH	On-Demand	Mild	ADRB2	25	43
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(CC)c2)cc1C#N	ZINC000819462040	GH	On-Demand	Mild	ADRB1	52	38
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(CC)c2)cc1C#N	ZINC000819462040	GH	On-Demand	Mild	CASR	40	38
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(CC)c2)cc1C#N	ZINC000819462040	GH	On-Demand	Mild	PDS	74	42
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1C#N	ZINC000819462049	FG	On-Demand	Mild	ADRB2	24	52
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1C#N	ZINC000819462049	FG	On-Demand	Mild	ADRB1	55	47
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1C#N	ZINC000819462049	FG	On-Demand	Mild	CASR	40	38
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C)c2)cc1C#N	ZINC000819462049	FG	On-Demand	Mild	PDS	58	41
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1C#N	ZINC000819462050	FG	On-Demand	Mild	ADRB2	24	52
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1C#N	ZINC000819462050	FG	On-Demand	Mild	ADRB1	55	47
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1C#N	ZINC000819462050	FG	On-Demand	Mild	CASR	40	38
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C)c2)cc1C#N	ZINC000819462050	FG	On-Demand	Mild	PDS	58	41
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2)cc1C#N	ZINC000819462062	FF	On-Demand	Mild	ADRB2	36	45
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2)cc1C#N	ZINC000819462062	FF	On-Demand	Mild	ADRB1	58	40
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2)cc1C#N	ZINC000819462062	FF	On-Demand	Mild	ADRB3	32	42
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2)cc1C#N	ZINC000819462062	FF	On-Demand	Mild	CASR	43	40
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2)cc1C#N	ZINC000819462062	FF	On-Demand	Mild	CYP2D6	18	40
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2)cc1C#N	ZINC000819462062	FF	On-Demand	Mild	PDS	59	39
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2)cc1C#N	ZINC000819462063	FF	On-Demand	Mild	ADRB2	36	45
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2)cc1C#N	ZINC000819462063	FF	On-Demand	Mild	ADRB1	58	40
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2)cc1C#N	ZINC000819462063	FF	On-Demand	Mild	ADRB3	32	42
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2)cc1C#N	ZINC000819462063	FF	On-Demand	Mild	CASR	43	40
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2)cc1C#N	ZINC000819462063	FF	On-Demand	Mild	CYP2D6	18	40
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2)cc1C#N	ZINC000819462063	FF	On-Demand	Mild	PDS	59	39
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1C#N	ZINC000819462068	GH	On-Demand	Mild	ADRB2	19	50
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1C#N	ZINC000819462068	GH	On-Demand	Mild	ADRB1	60	41
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1C#N	ZINC000819462068	GH	On-Demand	Mild	CASR	45	40
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1C#N	ZINC000819462068	GH	On-Demand	Mild	CYP2D6	18	40
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1C#N	ZINC000819462069	GH	On-Demand	Mild	ADRB2	19	50
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1C#N	ZINC000819462069	GH	On-Demand	Mild	ADRB1	60	41
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1C#N	ZINC000819462069	GH	On-Demand	Mild	CASR	45	40
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1C#N	ZINC000819462069	GH	On-Demand	Mild	CYP2D6	18	40
CCOC(=O)Nc1ccc(NC[C@H](O)COCc2ccccc2F)cc1C#N	ZINC000819462076	GG	On-Demand	Mild	ADRB1	43	35
CCOC(=O)Nc1ccc(NC[C@@H](O)COCc2ccccc2F)cc1C#N	ZINC000819462077	GG	On-Demand	Mild	ADRB1	43	35
CC[C@@H](C)c1ccccc1N1C[C@@H](C(=O)Nc2ccccc2C(=O)NCCOC)CC1=O	ZINC000819462093	IH	On-Demand	Anodyne	KCNQ2	43	36
CC[C@@H](C)c1ccccc1N1C[C@H](C(=O)Nc2ccccc2C(=O)NCCOC)CC1=O	ZINC000819462094	IH	On-Demand	Anodyne	KCNQ2	43	36
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1C#N	ZINC000819462101	GF	On-Demand	Mild	ADRB2	25	44
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1C#N	ZINC000819462101	GF	On-Demand	Mild	ADRB1	57	38
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1C#N	ZINC000819462101	GF	On-Demand	Mild	ADRB3	21	41
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1C#N	ZINC000819462102	GF	On-Demand	Mild	ADRB2	25	44
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1C#N	ZINC000819462102	GF	On-Demand	Mild	ADRB1	57	38
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1C#N	ZINC000819462102	GF	On-Demand	Mild	ADRB3	21	41
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(COc2ccccc2)cc1	ZINC000819462117	DH	On-Demand	Anodyne	LTA4H	30	44
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(COc2ccccc2)cc1	ZINC000819462118	DH	On-Demand	Anodyne	LTA4H	30	44
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(COc2ccccc2)cc1	ZINC000819462119	DH	On-Demand	Anodyne	LTA4H	30	44
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(COc2ccccc2)cc1	ZINC000819462120	DH	On-Demand	Anodyne	LTA4H	30	44
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCC(N(C)C)CC3)cc2)c1	ZINC000819462130	GG	On-Demand	Anodyne	MCHR1	32	49
COCCNC(=O)c1ccccc1NC(=O)Cc1sc(C)nc1-c1cccs1	ZINC000819462133	HH	On-Demand	Anodyne	GPR142	41	34
COCCNC(=O)c1ccccc1NC(=O)COc1c(Cl)cccc1Cl	ZINC000819462136	GG	On-Demand	Anodyne	ECR	40	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ccc(F)cn3)CC1)C2	ZINC000819462139	GD	On-Demand	Anodyne	SSTR1	41	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ccc(F)cn3)CC1)C2	ZINC000819462139	GD	On-Demand	Anodyne	NPBWR1	58	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ccc(F)cn3)CC1)C2	ZINC000819462140	GD	On-Demand	Anodyne	SSTR1	41	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ccc(F)cn3)CC1)C2	ZINC000819462140	GD	On-Demand	Anodyne	NPBWR1	58	41
O=C(/C=C/[C@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462176	FF	On-Demand	Anodyne	ESR1	64	37
O=C(/C=C/[C@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462176	FF	On-Demand	Anodyne	ESR2	46	36
O=C(/C=C/[C@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462176	FF	On-Demand	Anodyne	LTA4H	58	45
O=C(/C=C/[C@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462176	FF	On-Demand	Anodyne	HRH3	51	44
O=C(/C=C/[C@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462176	FF	On-Demand	Anodyne	PSMB2	43	42
O=C(/C=C/[C@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462176	FF	On-Demand	Anodyne	PSMB1	47	42
O=C(/C=C\[C@@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462177	FF	On-Demand	Anodyne	ESR1	64	37
O=C(/C=C\[C@@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462177	FF	On-Demand	Anodyne	ESR2	46	36
O=C(/C=C\[C@@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462177	FF	On-Demand	Anodyne	LTA4H	58	45
O=C(/C=C\[C@@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462177	FF	On-Demand	Anodyne	HRH3	51	44
O=C(/C=C\[C@@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462177	FF	On-Demand	Anodyne	PSMB2	43	42
O=C(/C=C\[C@@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462177	FF	On-Demand	Anodyne	PSMB1	47	42
O=C(/C=C/[C@@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462178	FF	On-Demand	Anodyne	ESR1	64	37
O=C(/C=C/[C@@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462178	FF	On-Demand	Anodyne	ESR2	46	36
O=C(/C=C/[C@@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462178	FF	On-Demand	Anodyne	LTA4H	58	45
O=C(/C=C/[C@@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462178	FF	On-Demand	Anodyne	HRH3	51	44
O=C(/C=C/[C@@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462178	FF	On-Demand	Anodyne	PSMB2	43	42
O=C(/C=C/[C@@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462178	FF	On-Demand	Anodyne	PSMB1	47	42
O=C(/C=C\[C@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462179	FF	On-Demand	Anodyne	ESR1	64	37
O=C(/C=C\[C@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462179	FF	On-Demand	Anodyne	ESR2	46	36
O=C(/C=C\[C@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462179	FF	On-Demand	Anodyne	LTA4H	58	45
O=C(/C=C\[C@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462179	FF	On-Demand	Anodyne	HRH3	51	44
O=C(/C=C\[C@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462179	FF	On-Demand	Anodyne	PSMB2	43	42
O=C(/C=C\[C@H]1CCCO1)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000819462179	FF	On-Demand	Anodyne	PSMB1	47	42
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C)cc2C)cc1C#N	ZINC000819462184	GH	On-Demand	Mild	ADRB1	54	37
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C)cc2C)cc1C#N	ZINC000819462184	GH	On-Demand	Mild	CASR	40	39
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C)cc2C)cc1C#N	ZINC000819462185	GH	On-Demand	Mild	ADRB1	54	37
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C)cc2C)cc1C#N	ZINC000819462185	GH	On-Demand	Mild	CASR	40	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1ccccc1-n1ccnc1	ZINC000819462192	FE	On-Demand	Anodyne	NOS2	40	30
O=C(C(F)=C1CCC1)N1CCN(c2ccc(F)cn2)CC1	ZINC000819462215	CE	On-Demand	Anodyne	SLC27A1	48	46
CCOC(=O)Nc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1C#N	ZINC000819462216	FH	On-Demand	Mild	ADRB1	41	31
CCOC(=O)Nc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1C#N	ZINC000819462216	FH	On-Demand	Mild	CTSL	15	40
CCOC(=O)Nc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)cc1C#N	ZINC000819462216	FH	On-Demand	Mild	CTSV	30	40
CCOC(=O)Nc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1C#N	ZINC000819462217	FH	On-Demand	Mild	ADRB1	41	31
CCOC(=O)Nc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1C#N	ZINC000819462217	FH	On-Demand	Mild	CTSL	15	40
CCOC(=O)Nc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)cc1C#N	ZINC000819462217	FH	On-Demand	Mild	CTSV	30	40
CCOC(=O)Nc1ccc(NC[C@@H](O)COCc2ccccc2)cc1C#N	ZINC000819462226	FG	On-Demand	Mild	ADRB1	43	33
CCOC(=O)Nc1ccc(NC[C@@H](O)COCc2ccccc2)cc1C#N	ZINC000819462226	FG	On-Demand	Mild	CTRB_BOVIN	53	32
CCOC(=O)Nc1ccc(NC[C@H](O)COCc2ccccc2)cc1C#N	ZINC000819462227	FG	On-Demand	Mild	ADRB1	43	33
CCOC(=O)Nc1ccc(NC[C@H](O)COCc2ccccc2)cc1C#N	ZINC000819462227	FG	On-Demand	Mild	CTRB_BOVIN	53	32
CCCOc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819462238	EH	On-Demand	Anodyne	ADRB2	48	50
CCCOc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819462238	EH	On-Demand	Anodyne	ADRB1	73	50
CCCOc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819462238	EH	On-Demand	Anodyne	ADRB3	41	43
CCCOc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819462238	EH	On-Demand	Anodyne	PLA2G4B	50	35
CCCOc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819462238	EH	On-Demand	Anodyne	ACR	23	42
CCCOc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819462240	EH	On-Demand	Anodyne	ADRB2	48	50
CCCOc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819462240	EH	On-Demand	Anodyne	ADRB1	73	50
CCCOc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819462240	EH	On-Demand	Anodyne	ADRB3	41	43
CCCOc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819462240	EH	On-Demand	Anodyne	PLA2G4B	50	35
CCCOc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)cc1	ZINC000819462240	EH	On-Demand	Anodyne	ACR	23	42
O[C@@H](CNc1cccc(CCN2CCCC2)c1)c1ccc(F)c(F)c1	ZINC000819462255	EH	On-Demand	Anodyne	ABCC1	51	35
O[C@H](CNc1cccc(CCN2CCCC2)c1)c1ccc(F)c(F)c1	ZINC000819462257	EH	On-Demand	Anodyne	ABCC1	51	35
COCCNC(=O)c1ccccc1NC(=O)CSCC(=O)N(C)C1CCCCC1	ZINC000819462259	HF	On-Demand	Anodyne	POLR1A	40	35
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1C#N	ZINC000819462262	GG	On-Demand	Mild	ADRB2	33	43
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1C#N	ZINC000819462262	GG	On-Demand	Mild	ADRB1	56	43
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1C#N	ZINC000819462262	GG	On-Demand	Mild	ADRB3	32	43
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1C#N	ZINC000819462262	GG	On-Demand	Mild	CASR	40	38
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1C#N	ZINC000819462265	GG	On-Demand	Mild	ADRB2	33	43
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1C#N	ZINC000819462265	GG	On-Demand	Mild	ADRB1	56	43
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1C#N	ZINC000819462265	GG	On-Demand	Mild	ADRB3	32	43
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1C#N	ZINC000819462265	GG	On-Demand	Mild	CASR	40	38
COCCNC(=O)c1ccccc1NC(=O)CCc1cccc(Br)c1	ZINC000819462269	HG	On-Demand	Anodyne	HCAR2	36	48
O=C(/C=C/[C@@H]1CCCO1)NCc1ccccc1-n1ccnc1	ZINC000819462271	CE	On-Demand	Anodyne	NOS2	55	33
O=C(/C=C\[C@@H]1CCCO1)NCc1ccccc1-n1ccnc1	ZINC000819462273	CE	On-Demand	Anodyne	NOS2	55	33
O=C(/C=C/[C@H]1CCCO1)NCc1ccccc1-n1ccnc1	ZINC000819462275	CE	On-Demand	Anodyne	NOS2	55	33
O=C(/C=C\[C@H]1CCCO1)NCc1ccccc1-n1ccnc1	ZINC000819462277	CE	On-Demand	Anodyne	NOS2	55	33
CCCOc1ccc(NCCC(=O)Nc2cccnc2)cc1	ZINC000819462296	CG	On-Demand	Anodyne	FAAH	23	45
CCCOc1ccc(NCCC(=O)Nc2cccnc2)cc1	ZINC000819462296	CG	On-Demand	Anodyne	CYP1A2	15	42
CCCOc1ccc(NCCC(=O)Nc2cccnc2)cc1	ZINC000819462296	CG	On-Demand	Anodyne	NAMPT	16	42
CCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819462297	CH	On-Demand	Anodyne	LTA4H	71	48
CCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819462297	CH	On-Demand	Anodyne	SCN2A	22	45
CCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819462297	CH	On-Demand	Anodyne	MTNR1A	19	44
CCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819462297	CH	On-Demand	Anodyne	MTNR1B	22	48
CCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819462297	CH	On-Demand	Anodyne	PLA2G4B	83	34
CCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819462297	CH	On-Demand	Anodyne	FAAH	26	52
CCCOc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819462297	CH	On-Demand	Anodyne	ACR	23	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(c2ccc(F)cn2)CC1	ZINC000819462318	FD	On-Demand	Anodyne	NPBWR1	43	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(c2ccc(F)cn2)CC1	ZINC000819462318	FD	On-Demand	Anodyne	SLC27A1	40	38
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1C#N	ZINC000819462321	GG	On-Demand	Mild	ADRB2	18	43
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1C#N	ZINC000819462321	GG	On-Demand	Mild	ADRB1	53	39
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1C#N	ZINC000819462321	GG	On-Demand	Mild	PDS	43	39
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1C#N	ZINC000819462322	GG	On-Demand	Mild	ADRB2	18	43
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1C#N	ZINC000819462322	GG	On-Demand	Mild	ADRB1	53	39
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1C#N	ZINC000819462322	GG	On-Demand	Mild	PDS	43	39
O=C(NCCc1ccc(OCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819462324	EG	On-Demand	Anodyne	ESR1	76	38
O=C(NCCc1ccc(OCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819462324	EG	On-Demand	Anodyne	ESR2	53	37
O=C(NCCc1ccc(OCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819462324	EG	On-Demand	Anodyne	LTA4H	71	51
O=C(NCCc1ccc(OCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819462324	EG	On-Demand	Anodyne	HRH3	65	47
O=C(NCCc1ccc(OCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819462324	EG	On-Demand	Anodyne	PSMB2	45	48
O=C(NCCc1ccc(OCCN2CCCC2)cc1)C(F)=C1CCC1	ZINC000819462324	EG	On-Demand	Anodyne	PSMB1	50	51
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)ccc2OC)cc1	ZINC000819462325	EE	On-Demand	Anodyne	ADRB2	44	46
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)ccc2OC)cc1	ZINC000819462325	EE	On-Demand	Anodyne	ADRB1	58	43
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)ccc2OC)cc1	ZINC000819462325	EE	On-Demand	Anodyne	ADRB3	31	40
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)ccc2OC)cc1	ZINC000819462327	EE	On-Demand	Anodyne	ADRB2	44	46
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)ccc2OC)cc1	ZINC000819462327	EE	On-Demand	Anodyne	ADRB1	58	43
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)ccc2OC)cc1	ZINC000819462327	EE	On-Demand	Anodyne	ADRB3	31	40
O[C@@H](CNc1cccc(CCN2CCCC2)c1)c1ccc(F)cc1	ZINC000819462338	EH	On-Demand	Anodyne	SLC6A3	26	43
O[C@@H](CNc1cccc(CCN2CCCC2)c1)c1ccc(F)cc1	ZINC000819462338	EH	On-Demand	Anodyne	SIGMAR1	21	50
O[C@H](CNc1cccc(CCN2CCCC2)c1)c1ccc(F)cc1	ZINC000819462339	EH	On-Demand	Anodyne	SLC6A3	26	43
O[C@H](CNc1cccc(CCN2CCCC2)c1)c1ccc(F)cc1	ZINC000819462339	EH	On-Demand	Anodyne	SIGMAR1	21	50
O[C@@H](CNc1cccc(CCN2CCCC2)c1)c1cc(F)ccc1F	ZINC000819462355	EH	On-Demand	Anodyne	HTR2A	16	42
O[C@@H](CNc1cccc(CCN2CCCC2)c1)c1cc(F)ccc1F	ZINC000819462355	EH	On-Demand	Anodyne	SIGMAR1	15	41
O[C@H](CNc1cccc(CCN2CCCC2)c1)c1cc(F)ccc1F	ZINC000819462356	EH	On-Demand	Anodyne	HTR2A	16	42
O[C@H](CNc1cccc(CCN2CCCC2)c1)c1cc(F)ccc1F	ZINC000819462356	EH	On-Demand	Anodyne	SIGMAR1	15	41
CCCOc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819462357	EH	On-Demand	Anodyne	ADRB2	49	45
CCCOc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819462357	EH	On-Demand	Anodyne	ADRB1	77	45
CCCOc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819462357	EH	On-Demand	Anodyne	ADRB3	45	42
CCCOc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819462357	EH	On-Demand	Anodyne	PLA2G4B	40	42
CCCOc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819462357	EH	On-Demand	Anodyne	ABCB1	23	44
CCCOc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819462357	EH	On-Demand	Anodyne	PDS	73	39
CCCOc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819462358	EH	On-Demand	Anodyne	ADRB2	49	45
CCCOc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819462358	EH	On-Demand	Anodyne	ADRB1	77	45
CCCOc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819462358	EH	On-Demand	Anodyne	ADRB3	45	42
CCCOc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819462358	EH	On-Demand	Anodyne	PLA2G4B	40	42
CCCOc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819462358	EH	On-Demand	Anodyne	ABCB1	23	44
CCCOc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)cc1	ZINC000819462358	EH	On-Demand	Anodyne	PDS	73	39
O=C(Cc1ccc(-n2cnnc2)cc1)NOC1CCCC1	ZINC000819462360	CD	On-Demand	Anodyne	HTR1D	46	37
C#CCNC(=O)CCNc1cccc(OCc2cccc(OC)c2)c1C	ZINC000819462363	FG	On-Demand	Mild	MTNR1A	35	46
C#CCNC(=O)CCNc1cccc(OCc2cccc(OC)c2)c1C	ZINC000819462363	FG	On-Demand	Mild	MTNR1B	36	46
CCCOc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819462368	FG	On-Demand	Anodyne	ADRB2	52	64
CCCOc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819462368	FG	On-Demand	Anodyne	ADRB1	81	64
CCCOc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819462368	FG	On-Demand	Anodyne	ADRB3	49	55
CCCOc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819462368	FG	On-Demand	Anodyne	ACACA	17	43
CCCOc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819462368	FG	On-Demand	Anodyne	ACACB	19	43
CCCOc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819462368	FG	On-Demand	Anodyne	FAAH	23	43
CCCOc1ccc(NC[C@@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819462368	FG	On-Demand	Anodyne	ACR	31	43
CCCOc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819462369	FG	On-Demand	Anodyne	ADRB2	52	64
CCCOc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819462369	FG	On-Demand	Anodyne	ADRB1	81	64
CCCOc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819462369	FG	On-Demand	Anodyne	ADRB3	49	55
CCCOc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819462369	FG	On-Demand	Anodyne	ACACA	17	43
CCCOc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819462369	FG	On-Demand	Anodyne	ACACB	19	43
CCCOc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819462369	FG	On-Demand	Anodyne	FAAH	23	43
CCCOc1ccc(NC[C@H](O)COc2ccc(NC(C)=O)cc2)cc1	ZINC000819462369	FG	On-Demand	Anodyne	ACR	31	43
CCCOc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819462377	EG	On-Demand	Bother	ADRB2	40	49
CCCOc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819462377	EG	On-Demand	Bother	ADRB1	62	49
CCCOc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819462377	EG	On-Demand	Bother	ADRB3	38	49
CCCOc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819462377	EG	On-Demand	Bother	CACNA1D	43	36
CCCOc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819462377	EG	On-Demand	Bother	ACR	19	40
CCCOc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819462377	EG	On-Demand	Bother	PDS	40	48
CCCOc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819462378	EG	On-Demand	Bother	ADRB2	40	49
CCCOc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819462378	EG	On-Demand	Bother	ADRB1	62	49
CCCOc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819462378	EG	On-Demand	Bother	ADRB3	38	49
CCCOc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819462378	EG	On-Demand	Bother	CACNA1D	43	36
CCCOc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819462378	EG	On-Demand	Bother	ACR	19	40
CCCOc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000819462378	EG	On-Demand	Bother	PDS	40	48
COCCNC(=O)c1ccccc1NC(=O)c1ccc2nccnc2c1	ZINC000819462381	FE	On-Demand	Anodyne	MAPK14	17	41
COCCNC(=O)c1ccccc1NC(=O)c1ccc2nccnc2c1	ZINC000819462381	FE	On-Demand	Anodyne	NR1H4	17	40
COCCNC(=O)c1ccccc1NC(=O)c1ccc2nccnc2c1	ZINC000819462381	FE	On-Demand	Anodyne	HDAC1	25	42
COCCNC(=O)c1ccccc1NC(=O)c1ccc2nccnc2c1	ZINC000819462381	FE	On-Demand	Anodyne	KCNK3	54	34
COCCNC(=O)c1ccccc1NC(=O)c1ccc2nccnc2c1	ZINC000819462381	FE	On-Demand	Anodyne	POLR1A	47	37
CCOc1ccc(OC[C@@H](O)CNc2cc(F)ccc2OC)cc1	ZINC000819462386	EG	On-Demand	Anodyne	ADRB2	39	45
CCOc1ccc(OC[C@@H](O)CNc2cc(F)ccc2OC)cc1	ZINC000819462386	EG	On-Demand	Anodyne	ADRB1	34	45
CCOc1ccc(OC[C@H](O)CNc2cc(F)ccc2OC)cc1	ZINC000819462387	EG	On-Demand	Anodyne	ADRB2	39	45
CCOc1ccc(OC[C@H](O)CNc2cc(F)ccc2OC)cc1	ZINC000819462387	EG	On-Demand	Anodyne	ADRB1	34	45
CCCOc1ccc(NC[C@H](O)COC2CCOCC2)cc1	ZINC000819462413	DE	On-Demand	Anodyne	ADRB1	32	44
CCCOc1ccc(NC[C@@H](O)COC2CCOCC2)cc1	ZINC000819462414	DE	On-Demand	Anodyne	ADRB1	32	44
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2ccc3c(c2)COC3)CC1	ZINC000819462419	FG	On-Demand	Anodyne	GPR119	25	43
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2ccc3c(c2)COC3)CC1	ZINC000819462420	FG	On-Demand	Anodyne	GPR119	25	43
CCCOc1ccc(NC[C@@](C)(O)CNC(=O)OC(C)(C)C)cc1	ZINC000819462436	EG	On-Demand	Anodyne	PLA2G4B	62	36
CCCOc1ccc(NC[C@@](C)(O)CNC(=O)OC(C)(C)C)cc1	ZINC000819462436	EG	On-Demand	Anodyne	FAAH	22	43
CCCOc1ccc(NC[C@](C)(O)CNC(=O)OC(C)(C)C)cc1	ZINC000819462437	EG	On-Demand	Anodyne	PLA2G4B	62	36
CCCOc1ccc(NC[C@](C)(O)CNC(=O)OC(C)(C)C)cc1	ZINC000819462437	EG	On-Demand	Anodyne	FAAH	22	43
COCCNC(=O)c1ccccc1NC(=O)CSC	ZINC000819462448	CD	On-Demand	Anodyne	FAS	50	49
COCCNC(=O)c1ccccc1NC(=O)CSC	ZINC000819462448	CD	On-Demand	Anodyne	POLR1A	46	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cnn(CC(=O)NCCO)c1)C2	ZINC000819462456	GB	On-Demand	Anodyne	PANC	44	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cnn(CC(=O)NCCO)c1)C2	ZINC000819462457	GB	On-Demand	Anodyne	PANC	44	31
CCCOc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819462465	EG	On-Demand	Bother	ADRB2	45	42
CCCOc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819462465	EG	On-Demand	Bother	ADRB1	66	39
CCCOc1ccc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819462465	EG	On-Demand	Bother	ADRB3	32	42
CCCOc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819462466	EG	On-Demand	Bother	ADRB2	45	42
CCCOc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819462466	EG	On-Demand	Bother	ADRB1	66	39
CCCOc1ccc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000819462466	EG	On-Demand	Bother	ADRB3	32	42
C#CCNC(=O)CCNc1ccc(OCCC)cc1	ZINC000819462471	CE	On-Demand	Mild	PLA2G4B	54	31
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc2c(c1)COC2	ZINC000819462472	GH	On-Demand	Anodyne	CTSD	108	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc2c(c1)COC2	ZINC000819462472	GH	On-Demand	Anodyne	PGC	58	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc2c(c1)COC2	ZINC000819462472	GH	On-Demand	Anodyne	PAPA1_CARPA	32	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc2c(c1)COC2	ZINC000819462472	GH	On-Demand	Anodyne	CTSK	15	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc2c(c1)COC2	ZINC000819462472	GH	On-Demand	Anodyne	CTSL	16	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc2c(c1)COC2	ZINC000819462472	GH	On-Demand	Anodyne	BACE2	53	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc2c(c1)COC2	ZINC000819462472	GH	On-Demand	Anodyne	TACR3	15	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc2c(c1)COC2	ZINC000819462472	GH	On-Demand	Anodyne	REN	76	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc2c(c1)COC2	ZINC000819462472	GH	On-Demand	Anodyne	REN1	18	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc2c(c1)COC2	ZINC000819462472	GH	On-Demand	Anodyne	BACE1	85	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc2c(c1)COC2	ZINC000819462472	GH	On-Demand	Anodyne	FPR1	49	39
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc2c(c1)COC2	ZINC000819462472	GH	On-Demand	Anodyne	PLM2_PLAFA	60	34
CCCOc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819462475	GH	On-Demand	Anodyne	MMP13	31	48
CCCOc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819462475	GH	On-Demand	Anodyne	EPHX2	20	44
CCCOc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819462475	GH	On-Demand	Anodyne	GPR119	57	45
CCCOc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819462476	GH	On-Demand	Anodyne	MMP13	31	48
CCCOc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819462476	GH	On-Demand	Anodyne	EPHX2	20	44
CCCOc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819462476	GH	On-Demand	Anodyne	GPR119	57	45
O[C@@H](CNc1cccc(CCN2CCCC2)c1)c1ccc(F)cc1F	ZINC000819462480	EH	On-Demand	Anodyne	HTR2A	21	42
O[C@H](CNc1cccc(CCN2CCCC2)c1)c1ccc(F)cc1F	ZINC000819462481	EH	On-Demand	Anodyne	HTR2A	21	42
COCCNC(=O)c1ccccc1NC(=O)CSc1nnc(-c2ccc(F)cc2)o1	ZINC000819462507	IF	On-Demand	Anodyne	ALOX15	27	41
COCCNC(=O)c1ccccc1NC(=O)CSc1nnc(-c2ccc(F)cc2)o1	ZINC000819462507	IF	On-Demand	Anodyne	FAS	23	41
COC1(C)CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819462524	FF	On-Demand	Mild	GHRHR	40	34
COC1(C)CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819462524	FF	On-Demand	Mild	PAPA1_CARPA	34	44
COC1(C)CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819462525	FF	On-Demand	Mild	GHRHR	40	34
COC1(C)CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819462525	FF	On-Demand	Mild	PAPA1_CARPA	34	44
CCOC(=O)Nc1ccc(NC[C@@H](O)Cc2ccc(F)cc2)cc1C#N	ZINC000819462539	FG	On-Demand	Mild	ADRB1	42	38
CCOC(=O)Nc1ccc(NC[C@H](O)Cc2ccc(F)cc2)cc1C#N	ZINC000819462540	FG	On-Demand	Mild	ADRB1	42	38
C[C@@H]1CCOCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819462556	DD	On-Demand	Anodyne	KCNJ1	45	35
C[C@H]1CCOCCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819462557	DD	On-Demand	Anodyne	KCNJ1	45	35
O=[N+]([O-])c1ccc([C@@H](O)CNc2cccc(CCN3CCCC3)c2)cc1	ZINC000819462627	FG	On-Demand	Bother	KCNJ1	36	46
O=[N+]([O-])c1ccc([C@H](O)CNc2cccc(CCN3CCCC3)c2)cc1	ZINC000819462628	FG	On-Demand	Bother	KCNJ1	36	46
CCCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819462641	EH	On-Demand	Anodyne	ADRB2	33	61
CCCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819462641	EH	On-Demand	Anodyne	ADRB1	46	61
CCCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819462641	EH	On-Demand	Anodyne	ADRB3	21	61
CCCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819462641	EH	On-Demand	Anodyne	CYP2D6	20	43
CCCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819462642	EH	On-Demand	Anodyne	ADRB2	33	61
CCCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819462642	EH	On-Demand	Anodyne	ADRB1	46	61
CCCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819462642	EH	On-Demand	Anodyne	ADRB3	21	61
CCCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1	ZINC000819462642	EH	On-Demand	Anodyne	CYP2D6	20	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1cnn(CC(=O)NCCO)c1	ZINC000819462667	FB	On-Demand	Anodyne	PANC	51	34
CC(=O)Nc1cccc(CC(=O)NCCCCCCO)c1	ZINC000819462668	CD	On-Demand	Anodyne	HDAC10	22	40
CC(=O)Nc1cccc(CC(=O)NCCCCCCO)c1	ZINC000819462668	CD	On-Demand	Anodyne	MTNR1A	44	39
CC(=O)Nc1cccc(CC(=O)NCCCCCCO)c1	ZINC000819462668	CD	On-Demand	Anodyne	MTNR1B	41	39
CC(=O)Nc1cccc(CC(=O)NCCCCCCO)c1	ZINC000819462668	CD	On-Demand	Anodyne	HDAC3	17	42
CC(=O)Nc1cccc(CC(=O)NCCCCCCO)c1	ZINC000819462668	CD	On-Demand	Anodyne	HDAC6	15	40
CC(=O)Nc1cccc(CC(=O)NCCCCCCO)c1	ZINC000819462668	CD	On-Demand	Anodyne	KCNK3	59	33
CCCOc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819462680	DH	On-Demand	Bother	ADRB1	16	45
CCCOc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819462680	DH	On-Demand	Bother	ADRB3	22	45
CCCOc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819462680	DH	On-Demand	Bother	CACNA1D	59	36
CCCOc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819462681	DH	On-Demand	Bother	ADRB1	16	45
CCCOc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819462681	DH	On-Demand	Bother	ADRB3	22	45
CCCOc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819462681	DH	On-Demand	Bother	CACNA1D	59	36
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc3c(c2)COC3)CC1	ZINC000819462682	FG	On-Demand	Anodyne	GPR119	47	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc3c(c2)COC3)CC1	ZINC000819462683	FG	On-Demand	Anodyne	GPR119	47	46
CCCOc1ccc(NCCC(=O)Nc2ccccc2F)cc1	ZINC000819462686	DI	On-Demand	Anodyne	PLA2G4B	45	30
CCCOc1ccc(NCCC(=O)Nc2ccccc2F)cc1	ZINC000819462686	DI	On-Demand	Anodyne	FAAH	23	47
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1C#N	ZINC000819462695	FG	On-Demand	Mild	ADRB2	26	42
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1C#N	ZINC000819462695	FG	On-Demand	Mild	ADRB1	62	42
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1C#N	ZINC000819462695	FG	On-Demand	Mild	ADRB3	21	40
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1C#N	ZINC000819462696	FG	On-Demand	Mild	ADRB2	26	42
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1C#N	ZINC000819462696	FG	On-Demand	Mild	ADRB1	62	42
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1C#N	ZINC000819462696	FG	On-Demand	Mild	ADRB3	21	40
CON(C)C(=O)CCNc1cccc2c1CN(c1ccccn1)C2	ZINC000819462710	EE	On-Demand	Anodyne	DRD4	17	40
CN(C[C@H](O)C(F)(F)F)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819462719	FD	On-Demand	Mild	PAPA1_CARPA	37	44
CN(C[C@H](O)C(F)(F)F)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819462721	FD	On-Demand	Mild	PAPA1_CARPA	37	44
CCc1nnc(CNC(=O)c2cc(-c3ccncc3)nc3ccc(Br)cc23)o1	ZINC000819462740	IH	On-Demand	Anodyne	PRS	84	47
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1C#N	ZINC000819462749	FG	On-Demand	Mild	ADRB2	26	44
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1C#N	ZINC000819462749	FG	On-Demand	Mild	ADRB1	58	38
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(C)cc2)cc1C#N	ZINC000819462749	FG	On-Demand	Mild	ADRB3	21	41
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1C#N	ZINC000819462751	FG	On-Demand	Mild	ADRB2	26	44
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1C#N	ZINC000819462751	FG	On-Demand	Mild	ADRB1	58	38
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(C)cc2)cc1C#N	ZINC000819462751	FG	On-Demand	Mild	ADRB3	21	41
CCc1nnc(CNC(=O)[C@H]2CC(c3cccc(F)c3)=NO2)o1	ZINC000819462752	DD	On-Demand	Anodyne	LUCI_PHOPY	22	42
CCc1nnc(CNC(=O)[C@@H]2CC(c3cccc(F)c3)=NO2)o1	ZINC000819462754	DD	On-Demand	Anodyne	LUCI_PHOPY	22	42
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2c(C)cccc2C)cc1C#N	ZINC000819462798	GH	On-Demand	Mild	ADRB1	53	36
CCc1nnc(CNC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)o1	ZINC000819462799	FF	On-Demand	Anodyne	PAPA1_CARPA	37	40
CCc1nnc(CNC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)o1	ZINC000819462799	FF	On-Demand	Anodyne	CTSK	15	44
CCc1nnc(CNC(=O)[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)o1	ZINC000819462799	FF	On-Demand	Anodyne	FPR1	43	35
CCOC(=O)Nc1ccc(NC[C@H](O)COc2c(C)cccc2C)cc1C#N	ZINC000819462800	GH	On-Demand	Mild	ADRB1	53	36
O=C(NCCn1cnnn1)[C@H](c1ccccc1)N1CCC(O)CC1	ZINC000819462809	EB	On-Demand	Anodyne	NPY2R	50	38
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)ccc2C)cc1C#N	ZINC000819462810	GH	On-Demand	Mild	ADRB2	16	41
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)ccc2C)cc1C#N	ZINC000819462810	GH	On-Demand	Mild	ADRB1	57	39
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)ccc2C)cc1C#N	ZINC000819462810	GH	On-Demand	Mild	CASR	42	40
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2cc(C)ccc2C)cc1C#N	ZINC000819462810	GH	On-Demand	Mild	CYP2D6	16	40
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)ccc2C)cc1C#N	ZINC000819462811	GH	On-Demand	Mild	ADRB2	16	41
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)ccc2C)cc1C#N	ZINC000819462811	GH	On-Demand	Mild	ADRB1	57	39
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)ccc2C)cc1C#N	ZINC000819462811	GH	On-Demand	Mild	CASR	42	40
CCOC(=O)Nc1ccc(NC[C@H](O)COc2cc(C)ccc2C)cc1C#N	ZINC000819462811	GH	On-Demand	Mild	CYP2D6	16	40
O=C(NCCn1cnnn1)[C@@H](c1ccccc1)N1CCC(O)CC1	ZINC000819462812	EB	On-Demand	Anodyne	NPY2R	50	38
CCc1nnc(CNC(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)o1	ZINC000819462814	GD	On-Demand	Anodyne	CACNA1I	40	33
CCc1nnc(CNC(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)o1	ZINC000819462814	GD	On-Demand	Anodyne	NAMPT	32	42
O=C(/C=C\[C@H]1CCCO1)N1CCN(c2ccc(F)cn2)CC1	ZINC000819462827	DD	On-Demand	Anodyne	SLC27A1	41	39
O=C(/C=C\[C@@H]1CCCO1)N1CCN(c2ccc(F)cn2)CC1	ZINC000819462829	DD	On-Demand	Anodyne	SLC27A1	41	39
O=C(/C=C/[C@H]1CCCO1)N1CCN(c2ccc(F)cn2)CC1	ZINC000819462831	DD	On-Demand	Anodyne	SLC27A1	41	39
O=C(/C=C/[C@@H]1CCCO1)N1CCN(c2ccc(F)cn2)CC1	ZINC000819462832	DD	On-Demand	Anodyne	SLC27A1	41	39
CCOc1nc2ccc(C(=O)NCCn3cnnn3)cc2[nH]1	ZINC000819462867	DC	On-Demand	Anodyne	DRD4	41	31
CCOc1nc2ccc(C(=O)NCCn3cnnn3)cc2[nH]1	ZINC000819462867	DC	On-Demand	Anodyne	PLD1	50	40
CCOc1nc2ccc(C(=O)NCCn3cnnn3)cc2[nH]1	ZINC000819462867	DC	On-Demand	Anodyne	PLD2	49	40
N#Cc1cccc(OCc2cccc(C(=O)NCCn3cnnn3)c2)c1	ZINC000819462890	ED	On-Demand	Mild	DRD4	45	34
N#Cc1cccc(OCc2cccc(C(=O)NCCn3cnnn3)c2)c1	ZINC000819462890	ED	On-Demand	Mild	DRTS_LEIMA	20	42
O=C(NCc1ccccc1-n1ccnc1)C(F)=C1CCC1	ZINC000819462992	CF	On-Demand	Anodyne	NOS2	68	32
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@H]1C(=O)NCCn1cnnn1	ZINC000819463003	GD	On-Demand	Anodyne	TPP2	58	39
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@@H]1C(=O)NCCn1cnnn1	ZINC000819463005	GD	On-Demand	Anodyne	TPP2	58	39
C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@H]1C(=O)NCCn1cnnn1	ZINC000819463008	GD	On-Demand	Anodyne	TPP2	58	39
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C(C)C)cc1C#N	ZINC000819463009	GI	On-Demand	Mild	ADRB2	23	43
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C(C)C)cc1C#N	ZINC000819463009	GI	On-Demand	Mild	ADRB1	60	41
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C(C)C)cc1C#N	ZINC000819463009	GI	On-Demand	Mild	CASR	45	41
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccccc2C(C)C)cc1C#N	ZINC000819463009	GI	On-Demand	Mild	CYP2D6	17	41
C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@@H]1C(=O)NCCn1cnnn1	ZINC000819463010	GD	On-Demand	Anodyne	TPP2	58	39
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C(C)C)cc1C#N	ZINC000819463013	GI	On-Demand	Mild	ADRB2	23	43
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C(C)C)cc1C#N	ZINC000819463013	GI	On-Demand	Mild	ADRB1	60	41
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C(C)C)cc1C#N	ZINC000819463013	GI	On-Demand	Mild	CASR	45	41
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccccc2C(C)C)cc1C#N	ZINC000819463013	GI	On-Demand	Mild	CYP2D6	17	41
CC(=O)N1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)(C)C1	ZINC000819463019	GE	On-Demand	Mild	PAPA1_CARPA	34	42
CC(=O)N1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C(C)(C)C1	ZINC000819463021	GE	On-Demand	Mild	PAPA1_CARPA	34	42
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1C#N	ZINC000819463043	GH	On-Demand	Mild	ADRB2	25	42
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1C#N	ZINC000819463043	GH	On-Demand	Mild	ADRB1	51	37
CCOC(=O)Nc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1C#N	ZINC000819463043	GH	On-Demand	Mild	ADRB3	22	40
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1C#N	ZINC000819463044	GH	On-Demand	Mild	ADRB2	25	42
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1C#N	ZINC000819463044	GH	On-Demand	Mild	ADRB1	51	37
CCOC(=O)Nc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1C#N	ZINC000819463044	GH	On-Demand	Mild	ADRB3	22	40
O=C(CNS(=O)(=O)c1ccc(Cl)s1)NCCn1cnnn1	ZINC000819463045	FB	On-Demand	Anodyne	CCR4	57	36
CCc1nnc(CNC(=O)c2cc(-c3ccccc3)nc3cc(C)c(C)cc23)o1	ZINC000819463080	GI	On-Demand	Anodyne	TACR3	22	54
O[C@@H](CNc1ccc2c(c1)COC2)c1cccc(Cl)c1	ZINC000819463120	CH	On-Demand	Anodyne	ADRB1	26	46
O[C@@H](CNc1ccc2c(c1)COC2)c1cccc(Cl)c1	ZINC000819463120	CH	On-Demand	Anodyne	ADRB3	40	41
O[C@H](CNc1ccc2c(c1)COC2)c1cccc(Cl)c1	ZINC000819463121	CH	On-Demand	Anodyne	ADRB1	26	46
O[C@H](CNc1ccc2c(c1)COC2)c1cccc(Cl)c1	ZINC000819463121	CH	On-Demand	Anodyne	ADRB3	40	41
CCc1nnc(CNC(=O)c2cc(-c3ccco3)nc3ccccc23)o1	ZINC000819463130	EG	On-Demand	Anodyne	ADORA2A	20	47
CCc1nnc(CNC(=O)c2cc(-c3ccco3)nc3ccccc23)o1	ZINC000819463130	EG	On-Demand	Anodyne	TACR3	18	56
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CC3(CCOCC3)C2)CC1	ZINC000819463163	FG	On-Demand	Bother	SLC6A9	18	53
N#CCc1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819463168	ED	On-Demand	Mild	ADRB1	48	38
N#CCc1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819463169	ED	On-Demand	Mild	ADRB1	48	38
N#CCc1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819463172	ED	On-Demand	Mild	ADRB1	48	38
N#CCc1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819463175	ED	On-Demand	Mild	ADRB1	48	38
CCCOc1ccc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819463178	FG	On-Demand	Anodyne	ADRB1	46	43
CCCOc1ccc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)cc1	ZINC000819463181	FG	On-Demand	Anodyne	ADRB1	46	43
O=C(O)CCN1CC[C@H](Oc2ccccn2)C1	ZINC000819463268	BD	On-Demand	Anodyne	SLC6A1	42	33
O=C(O)CCN1CC[C@H](Oc2ccccn2)C1	ZINC000819463268	BD	On-Demand	Anodyne	CYP2J2	43	31
O=C(O)CCN1CC[C@@H](Oc2ccccn2)C1	ZINC000819463269	BD	On-Demand	Anodyne	SLC6A1	42	33
O=C(O)CCN1CC[C@@H](Oc2ccccn2)C1	ZINC000819463269	BD	On-Demand	Anodyne	CYP2J2	43	31
O=C(O)CCCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000819463271	EG	On-Demand	Anodyne	PPIA	17	41
O=C(O)CCCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000819463271	EG	On-Demand	Anodyne	CPT1A	59	37
O=C(O)CCCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000819463271	EG	On-Demand	Anodyne	KDR	17	51
O=C(O)CCCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000819463271	EG	On-Demand	Anodyne	NR1H4	16	43
O=C(O)CCCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000819463271	EG	On-Demand	Anodyne	GRM5	15	42
O=C(O)CCCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000819463271	EG	On-Demand	Anodyne	CSF1R	24	43
O=C(O)CCCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000819463271	EG	On-Demand	Anodyne	BTK	23	40
O=C(O)CCCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000819463271	EG	On-Demand	Anodyne	LUCI_LUCLA	33	45
O=C(O)CCCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000819463271	EG	On-Demand	Anodyne	TAAR1	23	51
O=C(O)CCCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000819463271	EG	On-Demand	Anodyne	DDR1	26	42
O=C(O)CCCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000819463271	EG	On-Demand	Anodyne	KCNK3	93	46
O=C(O)CCCNc1ccc(C(=O)Nc2cccc(Cl)c2)cn1	ZINC000819463271	EG	On-Demand	Anodyne	KCNK9	50	41
O=C(O)CCCNS(=O)(=O)c1ccc(NC(=O)C(F)(F)F)cc1	ZINC000819463277	FD	On-Demand	Anodyne	CA2	24	53
O=C(O)CCCNS(=O)(=O)c1ccc(NC(=O)C(F)(F)F)cc1	ZINC000819463277	FD	On-Demand	Anodyne	TBXA2R	53	38
O=C(O)CCCNS(=O)(=O)c1ccc(NC(=O)C(F)(F)F)cc1	ZINC000819463277	FD	On-Demand	Anodyne	TBXAS1	45	40
O=C(O)CCCNS(=O)(=O)c1ccc(NC(=O)C(F)(F)F)cc1	ZINC000819463277	FD	On-Demand	Anodyne	CA1	25	47
O=C(O)CCCNS(=O)(=O)c1ccc(NC(=O)C(F)(F)F)cc1	ZINC000819463277	FD	On-Demand	Anodyne	CA4	27	47
O=C(O)CCCNS(=O)(=O)c1ccc(NC(=O)C(F)(F)F)cc1	ZINC000819463277	FD	On-Demand	Anodyne	CA9	19	53
O=C(O)CCCNS(=O)(=O)c1ccc(NC(=O)C(F)(F)F)cc1	ZINC000819463277	FD	On-Demand	Anodyne	IDO1	40	40
O=C(O)CCN1CCC(OCCN2CCCC2)CC1	ZINC000819463279	CD	On-Demand	Anodyne	SLC6A1	43	33
O=C(O)CCCNc1cnn(-c2nc3ccccc3[nH]2)c(=O)c1Cl	ZINC000819463284	EE	On-Demand	Anodyne	ALKBH3	41	36
O=C(O)CCN1CC[C@@H](Oc2cccnc2)C1	ZINC000819463293	BD	On-Demand	Anodyne	TBXAS1	46	39
O=C(O)CCN1CC[C@H](Oc2cccnc2)C1	ZINC000819463295	BD	On-Demand	Anodyne	TBXAS1	46	39
O=C(O)CCCNS(=O)(=O)c1ccc2c(c1)C(=O)OC2	ZINC000819463297	CC	On-Demand	Anodyne	TBXA2R	49	48
O=C(O)CCCNS(=O)(=O)c1ccc2c(c1)C(=O)OC2	ZINC000819463297	CC	On-Demand	Anodyne	TBXAS1	46	37
O=C(O)CCN1CCO[C@@H](c2cccc(O)c2)C1	ZINC000819463319	CD	On-Demand	Anodyne	OPRM1	28	44
O=C(O)CCN1CCO[C@@H](c2cccc(O)c2)C1	ZINC000819463319	CD	On-Demand	Anodyne	OPRK1	29	44
O=C(O)CCN1CCO[C@H](c2cccc(O)c2)C1	ZINC000819463320	CD	On-Demand	Anodyne	OPRM1	28	44
O=C(O)CCN1CCO[C@H](c2cccc(O)c2)C1	ZINC000819463320	CD	On-Demand	Anodyne	OPRK1	29	44
O=C(O)CCCNc1cc2ccccc2c(Cl)n1	ZINC000819463322	CG	On-Demand	Anodyne	METG	99	40
O=C(O)CCCNc1nn2cc(-c3ccccc3)nc2s1	ZINC000819463324	DF	On-Demand	Anodyne	P2RY12	47	34
O=C(O)CCCNS(=O)(=O)c1cccc2c1COC2=O	ZINC000819463333	CC	On-Demand	Anodyne	TBXA2R	19	42
O=C(O)CCCNc1ccnc(C(=O)NCc2ccccc2)c1	ZINC000819463338	DE	On-Demand	Anodyne	PDS	51	33
O=C(O)CCN1CC(c2nc3ccccc3[nH]2)C1	ZINC000819463339	BD	On-Demand	Anodyne	PRCP	31	45
O=C(O)CCCNS(=O)(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	ZINC000819463347	EB	On-Demand	Anodyne	TBXA2R	52	38
O=C(O)CCCNS(=O)(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1	ZINC000819463347	EB	On-Demand	Anodyne	TBXAS1	39	42
O=C(O)CCN1CCn2c(nnc2-c2ccccc2)C1	ZINC000819463351	CD	On-Demand	Anodyne	P2RX7	24	46
O=C(O)CCCNc1ccnc2cc(F)ccc12	ZINC000819463352	BF	On-Demand	Anodyne	HRP1_PLAFA	131	45
O=C(O)CCCNc1ccnc2cc(F)ccc12	ZINC000819463352	BF	On-Demand	Anodyne	HNMT	64	44
O=C(O)CCCNc1ccnc2cc(F)ccc12	ZINC000819463352	BF	On-Demand	Anodyne	BOTA	21	49
O=C(O)CCCNS(=O)(=O)c1ccc(OC2CCCC2)cc1	ZINC000819463357	EE	On-Demand	Anodyne	TBXA2R	52	38
O=C(O)CCCNS(=O)(=O)c1ccc(OC2CCCC2)cc1	ZINC000819463357	EE	On-Demand	Anodyne	TBXAS1	47	39
O=C(O)CCCNS(=O)(=O)c1ccc(OC2CCCC2)cc1	ZINC000819463357	EE	On-Demand	Anodyne	MMP13	18	43
O=C(O)CCCNS(=O)(=O)c1ccc(OC2CCCC2)cc1	ZINC000819463357	EE	On-Demand	Anodyne	MMP2	17	43
O=C(O)CCCNS(=O)(=O)c1ccc(OC2CCCC2)cc1	ZINC000819463357	EE	On-Demand	Anodyne	MMP14	15	43
O=C(O)CCCNS(=O)(=O)c1ccc(OC2CCCC2)cc1	ZINC000819463357	EE	On-Demand	Anodyne	PTGDR	19	40
O=C(O)CCCNS(=O)(=O)c1ccc2oc3ccccc3c2c1	ZINC000819463363	EF	On-Demand	Anodyne	TBXA2R	52	40
O=C(O)CCCNS(=O)(=O)c1ccc2oc3ccccc3c2c1	ZINC000819463363	EF	On-Demand	Anodyne	TBXAS1	41	39
O=C(O)CCCNS(=O)(=O)c1ccc2oc3ccccc3c2c1	ZINC000819463363	EF	On-Demand	Anodyne	HTR7	19	40
O=C(O)CCCNS(=O)(=O)c1ccc2oc3ccccc3c2c1	ZINC000819463363	EF	On-Demand	Anodyne	ALOX15	28	41
O=C(O)CCCNS(=O)(=O)c1ccc2oc3ccccc3c2c1	ZINC000819463363	EF	On-Demand	Anodyne	MMP12	63	56
O=C(O)CCCNS(=O)(=O)c1ccc2oc3ccccc3c2c1	ZINC000819463363	EF	On-Demand	Anodyne	PTGDR	22	58
O=C(O)CCCNc1nccc(N2CCCC2)n1	ZINC000819463369	CD	On-Demand	Anodyne	HNMT	42	33
O=C(O)CCCNc1nccc(N2CCCC2)n1	ZINC000819463369	CD	On-Demand	Anodyne	SORD	72	40
O=C(O)CCCNc1nccc(N2CCCC2)n1	ZINC000819463369	CD	On-Demand	Anodyne	MRGPRX1	45	39
O=C(O)CCN1CCOC[C@@H]1C[C@H](O)c1ccccc1	ZINC000819463373	CD	On-Demand	Anodyne	Q8WSF8_APLCA	18	44
O=C(O)CCN1CCOC[C@H]1C[C@H](O)c1ccccc1	ZINC000819463374	CD	On-Demand	Anodyne	Q8WSF8_APLCA	18	44
O=C(O)CCN1CCOC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000819463375	CD	On-Demand	Anodyne	Q8WSF8_APLCA	18	44
O=C(O)CCN1CCOC[C@H]1C[C@@H](O)c1ccccc1	ZINC000819463376	CD	On-Demand	Anodyne	Q8WSF8_APLCA	18	44
O=C(O)CCCNc1c(F)c(F)nc(F)c1F	ZINC000819463379	CD	On-Demand	Anodyne	CA1	15	51
O=C(Cc1ccncc1)NCCn1cnnn1	ZINC000819463386	BB	On-Demand	Anodyne	CA5A	15	44
N#Cc1c(Cl)cccc1Oc1cccc(C(=O)NCCn2cnnn2)c1	ZINC000819463387	FE	On-Demand	Mild	DRD4	51	41
N#Cc1c(Cl)cccc1Oc1cccc(C(=O)NCCn2cnnn2)c1	ZINC000819463387	FE	On-Demand	Mild	EZH2	29	40
N#CCC(=O)N1CCN(C(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)CC1	ZINC000819463388	HC	On-Demand	Mild	L3MBTL3	47	37
CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819463393	CG	On-Demand	Anodyne	ADRB2	34	53
CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819463393	CG	On-Demand	Anodyne	ADRB1	38	53
CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819463393	CG	On-Demand	Anodyne	ADRB3	100	57
CCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819463393	CG	On-Demand	Anodyne	FAAH	18	47
CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819463394	CG	On-Demand	Anodyne	ADRB2	34	53
CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819463394	CG	On-Demand	Anodyne	ADRB1	38	53
CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819463394	CG	On-Demand	Anodyne	ADRB3	100	57
CCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819463394	CG	On-Demand	Anodyne	FAAH	18	47
CCCOc1ccc(NCCS(=O)(=O)c2ccccc2)cc1	ZINC000819463400	DG	On-Demand	Anodyne	FAAH	20	42
C=CCc1ccc(OC[C@@H](O)CNc2cc(F)ccc2OC)c(OC)c1	ZINC000819463409	FG	On-Demand	Mild	ADRB2	21	44
C=CCc1ccc(OC[C@H](O)CNc2cc(F)ccc2OC)c(OC)c1	ZINC000819463410	FG	On-Demand	Mild	ADRB2	21	44
COc1cccc([S@@](=O)CC(=O)N2CCc3cc(C)c([N+](=O)[O-])cc32)c1	ZINC000819463440	FF	On-Demand	Bother	DRD4	40	31
OC[C@H](O)c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819463471	DF	On-Demand	Anodyne	ADRB2	18	49
OC[C@H](O)c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819463471	DF	On-Demand	Anodyne	ADRB1	33	49
OC[C@H](O)c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819463471	DF	On-Demand	Anodyne	ADRB3	52	49
OC[C@H](O)c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819463471	DF	On-Demand	Anodyne	CYP3A4	41	34
OC[C@H](O)c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819463472	DF	On-Demand	Anodyne	ADRB2	18	49
OC[C@H](O)c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819463472	DF	On-Demand	Anodyne	ADRB1	33	49
OC[C@H](O)c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819463472	DF	On-Demand	Anodyne	ADRB3	52	49
OC[C@H](O)c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819463472	DF	On-Demand	Anodyne	CYP3A4	41	34
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	F2	15	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	PLG	20	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	ACE	41	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	TYR	34	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	GHRHR	57	34
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	MME	63	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	TACR1	15	55
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	MC4R	29	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	CTRA_BOVIN	61	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	KLK3	81	39
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	CTSB	78	52
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	PAPA1_CARPA	74	46
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	TRY1_BOVIN	25	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	CYSP_TRYCR	74	48
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	CTSG	48	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	CTSK	52	48
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	CTSL	56	48
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	TIMP3	47	32
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	CAPNS1	82	47
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	ECE1	24	44
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	CELA2A	58	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	MMP11	64	32
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	CTSS	34	46
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	CAPN1	123	49
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	CASP1	23	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	CAPN2	149	52
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	ACE2	55	34
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	TGM2	35	50
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	TPSAB1	43	36
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	NPR	75	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	PSMB5	37	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CC2(CCOCC2)C1)OCc1ccccc1	ZINC000819463475	HG	On-Demand	Anodyne	SLC12A5	45	33
OC[C@@H](O)c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819463476	DF	On-Demand	Anodyne	ADRB2	18	49
OC[C@@H](O)c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819463476	DF	On-Demand	Anodyne	ADRB1	33	49
OC[C@@H](O)c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819463476	DF	On-Demand	Anodyne	ADRB3	52	49
OC[C@@H](O)c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819463476	DF	On-Demand	Anodyne	CYP3A4	41	34
OC[C@@H](O)c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819463478	DF	On-Demand	Anodyne	ADRB2	18	49
OC[C@@H](O)c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819463478	DF	On-Demand	Anodyne	ADRB1	33	49
OC[C@@H](O)c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819463478	DF	On-Demand	Anodyne	ADRB3	52	49
OC[C@@H](O)c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819463478	DF	On-Demand	Anodyne	CYP3A4	41	34
CN(C)c1nccc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819463488	GD	On-Demand	Mild	PAPA1_CARPA	43	46
COC(=O)c1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819463492	FD	On-Demand	Anodyne	ADRB2	53	44
COC(=O)c1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819463492	FD	On-Demand	Anodyne	ADRB1	86	44
COC(=O)c1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819463492	FD	On-Demand	Anodyne	ADRB3	84	44
COC(=O)c1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819463492	FD	On-Demand	Anodyne	ABCB1	18	44
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819463495	FD	On-Demand	Anodyne	ADRB2	53	44
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819463495	FD	On-Demand	Anodyne	ADRB1	86	44
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819463495	FD	On-Demand	Anodyne	ADRB3	84	44
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819463495	FD	On-Demand	Anodyne	ABCB1	18	44
O=C(NCCCc1ccccc1)C(=O)NCCn1cnnn1	ZINC000819463500	DB	On-Demand	Anodyne	AMP1_PLAFQ	25	44
COC(=O)c1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819463504	FD	On-Demand	Anodyne	ADRB2	53	44
COC(=O)c1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819463504	FD	On-Demand	Anodyne	ADRB1	86	44
COC(=O)c1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819463504	FD	On-Demand	Anodyne	ADRB3	84	44
COC(=O)c1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819463504	FD	On-Demand	Anodyne	ABCB1	18	44
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819463506	FD	On-Demand	Anodyne	ADRB2	53	44
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819463506	FD	On-Demand	Anodyne	ADRB1	86	44
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819463506	FD	On-Demand	Anodyne	ADRB3	84	44
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819463506	FD	On-Demand	Anodyne	ABCB1	18	44
O[C@@H](CNc1cccc(CCN2CCCC2)c1)c1ccccc1Cl	ZINC000819463512	EI	On-Demand	Anodyne	SIGMAR1	31	41
CCCOc1ccc(NCCC(=O)Nc2ccccc2[N+](=O)[O-])cc1	ZINC000819463513	EH	On-Demand	Bother	FAAH	20	40
O=[N+]([O-])c1cccc([C@@H](O)CNc2cccc(CCN3CCCC3)c2)c1	ZINC000819463521	FG	On-Demand	Bother	KCNJ1	25	40
O=[N+]([O-])c1cccc([C@H](O)CNc2cccc(CCN3CCCC3)c2)c1	ZINC000819463522	FG	On-Demand	Bother	KCNJ1	25	40
O=C(NCCCCCCO)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819463525	GG	On-Demand	Anodyne	CNR1	54	33
O=C(NCCCCCCO)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819463525	GG	On-Demand	Anodyne	DRD3	27	40
CCc1nnc(CNC(=O)c2ccc(-c3nnc(S)o3)cc2)o1	ZINC000819463526	ED	On-Demand	Anodyne	CYP73A16	56	39
CCc1nnc(CNC(=O)c2cc3ccccc3cc2NC(=O)C(C)C)o1	ZINC000819463530	FG	On-Demand	Anodyne	PYGL	41	39
COc1cccc([S@@](=O)CC(=O)NOC2CCCC2)c1	ZINC000819463547	CD	On-Demand	Anodyne	DRD4	40	30
CCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819463552	CG	On-Demand	Anodyne	ADRB2	37	40
CCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819463552	CG	On-Demand	Anodyne	ADRB1	52	40
CCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819463552	CG	On-Demand	Anodyne	PPARG	40	31
CCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819463552	CG	On-Demand	Anodyne	PPARA	31	40
CCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819463552	CG	On-Demand	Anodyne	ADRB3	36	40
CCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819463552	CG	On-Demand	Anodyne	LTA4H	41	40
CCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819463552	CG	On-Demand	Anodyne	SCN2A	16	40
CCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819463552	CG	On-Demand	Anodyne	PLA2G4B	45	34
CCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819463552	CG	On-Demand	Anodyne	FAAH	15	42
CCCOc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819463552	CG	On-Demand	Anodyne	PDS	42	35
CCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819463555	CG	On-Demand	Anodyne	ADRB2	37	40
CCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819463555	CG	On-Demand	Anodyne	ADRB1	52	40
CCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819463555	CG	On-Demand	Anodyne	PPARG	40	31
CCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819463555	CG	On-Demand	Anodyne	PPARA	31	40
CCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819463555	CG	On-Demand	Anodyne	ADRB3	36	40
CCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819463555	CG	On-Demand	Anodyne	LTA4H	41	40
CCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819463555	CG	On-Demand	Anodyne	SCN2A	16	40
CCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819463555	CG	On-Demand	Anodyne	PLA2G4B	45	34
CCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819463555	CG	On-Demand	Anodyne	FAAH	15	42
CCCOc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819463555	CG	On-Demand	Anodyne	PDS	42	35
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819463578	EE	On-Demand	Anodyne	ADRB2	34	40
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819463578	EE	On-Demand	Anodyne	ADRB1	61	40
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819463578	EE	On-Demand	Anodyne	GRIN1	25	42
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819463578	EE	On-Demand	Anodyne	ADRB3	56	40
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819463580	EE	On-Demand	Anodyne	ADRB2	34	40
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819463580	EE	On-Demand	Anodyne	ADRB1	61	40
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819463580	EE	On-Demand	Anodyne	GRIN1	25	42
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819463580	EE	On-Demand	Anodyne	ADRB3	56	40
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819463583	EE	On-Demand	Anodyne	ADRB2	34	40
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819463583	EE	On-Demand	Anodyne	ADRB1	61	40
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819463583	EE	On-Demand	Anodyne	GRIN1	25	42
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccc(Cl)cc2)c1	ZINC000819463583	EE	On-Demand	Anodyne	ADRB3	56	40
CCCOc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819463584	EG	On-Demand	Anodyne	ADRB1	44	39
CCCOc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819463584	EG	On-Demand	Anodyne	GRIN1	22	51
CCCOc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819463584	EG	On-Demand	Anodyne	EDNRB	22	41
CCCOc1ccc(NC[C@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819463584	EG	On-Demand	Anodyne	EDNRA	24	44
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819463586	EE	On-Demand	Anodyne	ADRB2	34	40
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819463586	EE	On-Demand	Anodyne	ADRB1	61	40
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819463586	EE	On-Demand	Anodyne	GRIN1	25	42
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccc(Cl)cc2)c1	ZINC000819463586	EE	On-Demand	Anodyne	ADRB3	56	40
CCCOc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819463587	EG	On-Demand	Anodyne	ADRB1	44	39
CCCOc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819463587	EG	On-Demand	Anodyne	GRIN1	22	51
CCCOc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819463587	EG	On-Demand	Anodyne	EDNRB	22	41
CCCOc1ccc(NC[C@@H](O)COc2ccc3c(c2)OCO3)cc1	ZINC000819463587	EG	On-Demand	Anodyne	EDNRA	24	44
O=C(CCNc1cccc([C@@H](O)CO)c1)Nc1cccc(C(F)(F)F)c1	ZINC000819463594	FG	On-Demand	Anodyne	HDAC10	15	54
O=C(CCNc1cccc([C@H](O)CO)c1)Nc1cccc(C(F)(F)F)c1	ZINC000819463596	FG	On-Demand	Anodyne	HDAC10	15	54
OC[C@H](O)c1cccc(NC[C@H](O)c2ccccc2Cl)c1	ZINC000819463614	DF	On-Demand	Anodyne	ADRB3	29	41
OC[C@@H](O)c1cccc(NC[C@H](O)c2ccccc2Cl)c1	ZINC000819463615	DF	On-Demand	Anodyne	ADRB3	29	41
O=C(CCn1ccnc1)NCCn1cnnn1	ZINC000819463619	BB	On-Demand	Anodyne	TBXAS1	42	41
Cc1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)c(C)c1	ZINC000819463625	EE	On-Demand	Anodyne	ADRB2	26	44
Cc1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)c(C)c1	ZINC000819463625	EE	On-Demand	Anodyne	VDR	15	40
Cc1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)c(C)c1	ZINC000819463626	EE	On-Demand	Anodyne	ADRB2	26	44
Cc1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)c(C)c1	ZINC000819463626	EE	On-Demand	Anodyne	VDR	15	40
Cc1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)c(C)c1	ZINC000819463627	EE	On-Demand	Anodyne	ADRB2	26	44
Cc1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)c(C)c1	ZINC000819463627	EE	On-Demand	Anodyne	VDR	15	40
Cc1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)c(C)c1	ZINC000819463629	EE	On-Demand	Anodyne	ADRB2	26	44
Cc1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)c(C)c1	ZINC000819463629	EE	On-Demand	Anodyne	VDR	15	40
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	MME	82	37
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	ANPEP	41	33
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	CTSD	21	45
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	PGC	62	45
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	FCER2	86	35
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	CTSB	60	40
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	PAPA1_CARPA	97	62
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	CYSP_TRYCR	63	40
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	CCKAR	61	45
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	CTSK	38	61
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	CTSL	72	62
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	PGA	35	45
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	TIMP3	79	39
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	TACR3	26	52
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	CAPNS1	59	37
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	MMP3	16	41
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	GRIA1	44	34
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	HLA-DRB1	72	47
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	REN	98	51
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	REN1	31	46
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	CCKBR	23	43
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	CTSS	34	62
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	CAPN1	83	55
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	CAPN2	106	43
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	ACE2	49	37
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	SCN10A	26	46
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	CTSV	51	37
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	MMP1	23	41
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	FPR1	83	50
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	CTRB_BOVIN	48	44
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	NPR	43	35
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	PSMB5	48	35
CCc1nnc(CNC(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)o1	ZINC000819463636	FE	On-Demand	Anodyne	NPFFR1	44	31
COc1cc(Br)ccc1C(=O)NCCn1cnnn1	ZINC000819463651	EC	On-Demand	Anodyne	DRD3	18	46
CCCOc1cc(OC)ccc1C(=O)NCCn1cnnn1	ZINC000819463665	DC	On-Demand	Anodyne	DRD4	42	32
CCCOc1cc(OC)ccc1C(=O)NCCn1cnnn1	ZINC000819463665	DC	On-Demand	Anodyne	MTNR1A	34	44
CCCOc1cc(OC)ccc1C(=O)NCCn1cnnn1	ZINC000819463665	DC	On-Demand	Anodyne	MTNR1B	30	44
O=C(/C=C\c1cccc(O)c1)N1CC2(CCOCC2)C1	ZINC000819463676	CE	On-Demand	Anodyne	ITGAL	53	38
O=C(/C=C/c1cccc(O)c1)N1CC2(CCOCC2)C1	ZINC000819463677	CE	On-Demand	Anodyne	ITGAL	53	38
N#CCC(=O)N1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)CC1	ZINC000819463683	FD	On-Demand	Mild	SLC6A9	33	62
O[C@@H](CNc1cccc(CCN2CCCC2)c1)c1ccccc1	ZINC000819463685	DG	On-Demand	Anodyne	SIGMAR1	34	49
O[C@H](CNc1cccc(CCN2CCCC2)c1)c1ccccc1	ZINC000819463688	DG	On-Demand	Anodyne	SIGMAR1	34	49
OC[C@H](O)c1cccc(NC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819463702	CD	On-Demand	Anodyne	ADRB2	21	46
OC[C@H](O)c1cccc(NC[C@H](O)c2ccc(F)cc2)c1	ZINC000819463703	CD	On-Demand	Anodyne	ADRB2	21	46
OC[C@@H](O)c1cccc(NC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819463704	CD	On-Demand	Anodyne	ADRB2	21	46
OC[C@@H](O)c1cccc(NC[C@H](O)c2ccc(F)cc2)c1	ZINC000819463705	CD	On-Demand	Anodyne	ADRB2	21	46
COc1cc(Oc2ccccc2)ccc1NCCC(=O)N(C)OC	ZINC000819463706	EG	On-Demand	Anodyne	LTA4H	27	40
COc1cc(Oc2ccccc2)ccc1NCCC(=O)N(C)OC	ZINC000819463706	EG	On-Demand	Anodyne	TSPO	44	36
COc1cc(Oc2ccccc2)ccc1NCCC(=O)N(C)OC	ZINC000819463706	EG	On-Demand	Anodyne	MTNR1A	19	40
COc1cc(Oc2ccccc2)ccc1NCCC(=O)N(C)OC	ZINC000819463706	EG	On-Demand	Anodyne	MTNR1B	28	40
OC[C@H](O)c1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819463707	CD	On-Demand	Anodyne	ADRB2	28	41
OC[C@H](O)c1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819463707	CD	On-Demand	Anodyne	ADRB1	28	40
OC[C@H](O)c1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819463707	CD	On-Demand	Anodyne	ADRB3	92	41
OC[C@H](O)c1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819463708	CD	On-Demand	Anodyne	ADRB2	28	41
OC[C@H](O)c1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819463708	CD	On-Demand	Anodyne	ADRB1	28	40
OC[C@H](O)c1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819463708	CD	On-Demand	Anodyne	ADRB3	92	41
OC[C@@H](O)c1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819463709	CD	On-Demand	Anodyne	ADRB2	28	41
OC[C@@H](O)c1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819463709	CD	On-Demand	Anodyne	ADRB1	28	40
OC[C@@H](O)c1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819463709	CD	On-Demand	Anodyne	ADRB3	92	41
OC[C@@H](O)c1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819463710	CD	On-Demand	Anodyne	ADRB2	28	41
OC[C@@H](O)c1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819463710	CD	On-Demand	Anodyne	ADRB1	28	40
OC[C@@H](O)c1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819463710	CD	On-Demand	Anodyne	ADRB3	92	41
CC(=O)Nc1cccc(CC(=O)N2CC=C(c3ccc(Cl)nc3)CC2)c1	ZINC000819463716	FH	On-Demand	Anodyne	P2RY14	45	35
OC[C@H](O)c1cccc(NC[C@H](O)CCc2ccccc2)c1	ZINC000819463741	DE	On-Demand	Anodyne	ADRB2	25	42
OC[C@H](O)c1cccc(NC[C@H](O)CCc2ccccc2)c1	ZINC000819463741	DE	On-Demand	Anodyne	ADRB1	23	40
OC[C@@H](O)c1cccc(NC[C@H](O)CCc2ccccc2)c1	ZINC000819463743	DE	On-Demand	Anodyne	ADRB2	25	42
OC[C@@H](O)c1cccc(NC[C@H](O)CCc2ccccc2)c1	ZINC000819463743	DE	On-Demand	Anodyne	ADRB1	23	40
OC[C@H](O)c1cccc(NC[C@@H](O)CCc2ccccc2)c1	ZINC000819463745	DE	On-Demand	Anodyne	ADRB2	25	42
OC[C@H](O)c1cccc(NC[C@@H](O)CCc2ccccc2)c1	ZINC000819463745	DE	On-Demand	Anodyne	ADRB1	23	40
OC[C@@H](O)c1cccc(NC[C@@H](O)CCc2ccccc2)c1	ZINC000819463747	DE	On-Demand	Anodyne	ADRB2	25	42
OC[C@@H](O)c1cccc(NC[C@@H](O)CCc2ccccc2)c1	ZINC000819463747	DE	On-Demand	Anodyne	ADRB1	23	40
OC[C@@H](O)c1cccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819463752	FF	On-Demand	Anodyne	PDS	52	46
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819463756	FF	On-Demand	Anodyne	PDS	52	46
OC[C@H](O)c1cccc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819463759	FF	On-Demand	Anodyne	PDS	52	46
OC[C@H](O)c1cccc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)c1	ZINC000819463761	FF	On-Demand	Anodyne	PDS	52	46
O[C@@H](CNc1cccc(CCN2CCCC2)c1)c1cccnc1	ZINC000819463793	DF	On-Demand	Anodyne	ADRB2	24	45
O[C@@H](CNc1cccc(CCN2CCCC2)c1)c1cccnc1	ZINC000819463793	DF	On-Demand	Anodyne	ADRB1	25	42
O[C@@H](CNc1cccc(CCN2CCCC2)c1)c1cccnc1	ZINC000819463793	DF	On-Demand	Anodyne	ADRB3	93	48
COCCNC(=O)c1ccccc1NC(=O)/C=C\c1nc2ccccc2s1	ZINC000819463795	GG	On-Demand	Anodyne	POLR1A	52	36
O[C@H](CNc1cccc(CCN2CCCC2)c1)c1cccnc1	ZINC000819463796	DF	On-Demand	Anodyne	ADRB2	24	45
O[C@H](CNc1cccc(CCN2CCCC2)c1)c1cccnc1	ZINC000819463796	DF	On-Demand	Anodyne	ADRB1	25	42
O[C@H](CNc1cccc(CCN2CCCC2)c1)c1cccnc1	ZINC000819463796	DF	On-Demand	Anodyne	ADRB3	93	48
COCCNC(=O)c1ccccc1NC(=O)/C=C/c1nc2ccccc2s1	ZINC000819463798	GG	On-Demand	Anodyne	POLR1A	52	36
CCCOc1ccc(NCCC(=O)N(C)OC)cc1	ZINC000819463804	CE	On-Demand	Anodyne	PLA2G4B	55	32
OC[C@H](O)c1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819463854	CD	On-Demand	Anodyne	ADRB2	26	49
OC[C@H](O)c1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819463854	CD	On-Demand	Anodyne	ADRB1	27	45
OC[C@H](O)c1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819463854	CD	On-Demand	Anodyne	ADRB3	44	43
OC[C@H](O)c1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819463854	CD	On-Demand	Anodyne	AOC3	15	47
OC[C@H](O)c1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819463855	CD	On-Demand	Anodyne	ADRB2	26	49
OC[C@H](O)c1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819463855	CD	On-Demand	Anodyne	ADRB1	27	45
OC[C@H](O)c1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819463855	CD	On-Demand	Anodyne	ADRB3	44	43
OC[C@H](O)c1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819463855	CD	On-Demand	Anodyne	AOC3	15	47
OC[C@@H](O)c1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819463856	CD	On-Demand	Anodyne	ADRB2	26	49
OC[C@@H](O)c1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819463856	CD	On-Demand	Anodyne	ADRB1	27	45
OC[C@@H](O)c1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819463856	CD	On-Demand	Anodyne	ADRB3	44	43
OC[C@@H](O)c1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819463856	CD	On-Demand	Anodyne	AOC3	15	47
OC[C@@H](O)c1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819463858	CD	On-Demand	Anodyne	ADRB2	26	49
OC[C@@H](O)c1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819463858	CD	On-Demand	Anodyne	ADRB1	27	45
OC[C@@H](O)c1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819463858	CD	On-Demand	Anodyne	ADRB3	44	43
OC[C@@H](O)c1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819463858	CD	On-Demand	Anodyne	AOC3	15	47
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819463871	FF	On-Demand	Anodyne	ADRB2	26	40
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819463871	FF	On-Demand	Anodyne	ADRB1	40	38
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819463871	FF	On-Demand	Anodyne	GRIN1	28	46
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819463874	FF	On-Demand	Anodyne	ADRB2	26	40
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819463874	FF	On-Demand	Anodyne	ADRB1	40	38
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819463874	FF	On-Demand	Anodyne	GRIN1	28	46
COCCc1ccc(OC[C@@H](O)CNc2cc(F)ccc2OC)cc1	ZINC000819463875	EF	On-Demand	Anodyne	ADRB2	45	60
COCCc1ccc(OC[C@@H](O)CNc2cc(F)ccc2OC)cc1	ZINC000819463875	EF	On-Demand	Anodyne	ADRB1	58	60
COCCc1ccc(OC[C@@H](O)CNc2cc(F)ccc2OC)cc1	ZINC000819463875	EF	On-Demand	Anodyne	GRIN1	19	43
COCCc1ccc(OC[C@@H](O)CNc2cc(F)ccc2OC)cc1	ZINC000819463875	EF	On-Demand	Anodyne	ADRB3	36	44
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819463877	FF	On-Demand	Anodyne	ADRB2	26	40
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819463877	FF	On-Demand	Anodyne	ADRB1	40	38
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819463877	FF	On-Demand	Anodyne	GRIN1	28	46
COCCc1ccc(OC[C@H](O)CNc2cc(F)ccc2OC)cc1	ZINC000819463879	EF	On-Demand	Anodyne	ADRB2	45	60
COCCc1ccc(OC[C@H](O)CNc2cc(F)ccc2OC)cc1	ZINC000819463879	EF	On-Demand	Anodyne	ADRB1	58	60
COCCc1ccc(OC[C@H](O)CNc2cc(F)ccc2OC)cc1	ZINC000819463879	EF	On-Demand	Anodyne	GRIN1	19	43
COCCc1ccc(OC[C@H](O)CNc2cc(F)ccc2OC)cc1	ZINC000819463879	EF	On-Demand	Anodyne	ADRB3	36	44
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819463880	FF	On-Demand	Anodyne	ADRB2	26	40
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819463880	FF	On-Demand	Anodyne	ADRB1	40	38
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)c1	ZINC000819463880	FF	On-Demand	Anodyne	GRIN1	28	46
O=C(/C=C/c1ccccc1Cl)N1CC2(CCOCC2)C1	ZINC000819463886	CF	On-Demand	Anodyne	ITGAL	69	39
O=C(/C=C\c1ccccc1Cl)N1CC2(CCOCC2)C1	ZINC000819463889	CF	On-Demand	Anodyne	ITGAL	69	39
COc1ccccc1/C(C)=C\C(=O)N1CC2(CCOCC2)C1	ZINC000819463891	DF	On-Demand	Anodyne	KCNA3	41	40
COc1ccccc1/C(C)=C/C(=O)N1CC2(CCOCC2)C1	ZINC000819463893	DF	On-Demand	Anodyne	KCNA3	41	40
O=C(CN1CCN(Cc2ccccc2)CC1)NCCn1cnnn1	ZINC000819463898	EB	On-Demand	Anodyne	DRD4	44	38
O=C(CN1CCN(Cc2ccccc2)CC1)NCCn1cnnn1	ZINC000819463898	EB	On-Demand	Anodyne	ACHE	33	43
O=C(CN1CCN(Cc2ccccc2)CC1)NCCn1cnnn1	ZINC000819463898	EB	On-Demand	Anodyne	DRD3	15	40
O=C(CN1CCN(Cc2ccccc2)CC1)NCCn1cnnn1	ZINC000819463898	EB	On-Demand	Anodyne	SIGMAR1	45	47
O=C(CN1CCN(Cc2ccccc2)CC1)NCCn1cnnn1	ZINC000819463898	EB	On-Demand	Anodyne	NPFFR1	42	38
O[C@@H](CNc1cccc(CCN2CCCC2)c1)c1ccc(Cl)cc1	ZINC000819463906	EI	On-Demand	Anodyne	SIGMAR1	22	41
O[C@@H](CNc1ccc2c(c1)COC2)c1cccnc1	ZINC000819463908	CE	On-Demand	Anodyne	ADRB3	86	41
O[C@H](CNc1ccc2c(c1)COC2)c1cccnc1	ZINC000819463910	CE	On-Demand	Anodyne	ADRB3	86	41
O=C(NCCn1cnnn1)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC000819463924	CC	On-Demand	Anodyne	PLD1	17	45
O[C@@H](CNc1cccc(CCN2CCCC2)c1)c1cccc(Cl)c1	ZINC000819463926	EI	On-Demand	Anodyne	ADRB2	15	42
O[C@@H](CNc1cccc(CCN2CCCC2)c1)c1cccc(Cl)c1	ZINC000819463926	EI	On-Demand	Anodyne	ADRB1	32	42
O[C@@H](CNc1cccc(CCN2CCCC2)c1)c1cccc(Cl)c1	ZINC000819463926	EI	On-Demand	Anodyne	ADRB3	43	42
O[C@@H](CNc1cccc(CCN2CCCC2)c1)c1cccc(Cl)c1	ZINC000819463926	EI	On-Demand	Anodyne	SIGMAR1	18	45
O[C@H](CNc1cccc(CCN2CCCC2)c1)c1cccc(Cl)c1	ZINC000819463928	EI	On-Demand	Anodyne	ADRB2	15	42
O[C@H](CNc1cccc(CCN2CCCC2)c1)c1cccc(Cl)c1	ZINC000819463928	EI	On-Demand	Anodyne	ADRB1	32	42
O[C@H](CNc1cccc(CCN2CCCC2)c1)c1cccc(Cl)c1	ZINC000819463928	EI	On-Demand	Anodyne	ADRB3	43	42
O[C@H](CNc1cccc(CCN2CCCC2)c1)c1cccc(Cl)c1	ZINC000819463928	EI	On-Demand	Anodyne	SIGMAR1	18	45
CCCOc1ccc(NCCC(=O)NC(N)=O)cc1	ZINC000819463929	CD	On-Demand	Anodyne	PLA2G4B	55	32
CCCOc1ccc(NCCC(=O)NC(N)=O)cc1	ZINC000819463929	CD	On-Demand	Anodyne	FAAH	23	44
CCCOc1ccc(NCCC(=O)NC(N)=O)cc1	ZINC000819463929	CD	On-Demand	Anodyne	ACR	15	42
COc1ccccc1NC(=O)COc1ccc(C(=O)NCCn2cnnn2)cc1OC	ZINC000819463962	ID	On-Demand	Anodyne	DRD2	16	42
COc1ccccc1NC(=O)COc1ccc(C(=O)NCCn2cnnn2)cc1OC	ZINC000819463962	ID	On-Demand	Anodyne	DRD4	41	32
COc1ccccc1NC(=O)COc1ccc(C(=O)NCCn2cnnn2)cc1OC	ZINC000819463962	ID	On-Demand	Anodyne	DRD3	25	42
COc1ccccc1NC(=O)COc1ccc(C(=O)NCCn2cnnn2)cc1OC	ZINC000819463962	ID	On-Demand	Anodyne	CPT1A	46	33
COc1ccccc1NC(=O)COc1ccc(C(=O)NCCn2cnnn2)cc1OC	ZINC000819463962	ID	On-Demand	Anodyne	ABCG2	19	41
O=C(NCCn1cnnn1)c1cccc(C(F)F)c1	ZINC000819463966	CD	On-Demand	Anodyne	DRD4	44	34
CCc1nnc(CNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)o1	ZINC000819463971	IG	On-Demand	Bother	KCNMA1	29	40
CCc1nnc(CNC(=O)c2ccccc2N(C)C(=O)c2ccco2)o1	ZINC000819463979	FE	On-Demand	Anodyne	UL54	42	33
O=C(NCCn1cnnn1)c1cc(-c2ccccc2)on1	ZINC000819463982	CC	On-Demand	Anodyne	HDAC10	17	56
CCCOc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819463985	EG	On-Demand	Mild	ADRB2	43	46
CCCOc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819463985	EG	On-Demand	Mild	ADRB1	65	46
CCCOc1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819463985	EG	On-Demand	Mild	ADRB3	40	41
CCCOc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819463986	EG	On-Demand	Mild	ADRB2	43	46
CCCOc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819463986	EG	On-Demand	Mild	ADRB1	65	46
CCCOc1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000819463986	EG	On-Demand	Mild	ADRB3	40	41
CCCOc1ccc(NCCS(=O)(=O)c2ccc(F)cc2)cc1	ZINC000819463987	EH	On-Demand	Anodyne	FAAH	16	40
O[C@H](CNc1cccc(CCN2CCCC2)c1)c1cc2ccccc2o1	ZINC000819463989	FI	On-Demand	Anodyne	SIGMAR1	16	46
N#Cc1ccc([C@@H](O)CNc2cccc(CCN3CCCC3)c2)cc1	ZINC000819463994	EG	On-Demand	Mild	KCNJ1	27	44
N#Cc1ccc([C@H](O)CNc2cccc(CCN3CCCC3)c2)cc1	ZINC000819463995	EG	On-Demand	Mild	KCNJ1	27	44
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(CCN2CCCC2)c1	ZINC000819464019	GG	On-Demand	Anodyne	HRH2	31	44
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(CCN2CCCC2)c1	ZINC000819464019	GG	On-Demand	Anodyne	HTR1D	26	44
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(CCN2CCCC2)c1	ZINC000819464019	GG	On-Demand	Anodyne	HTR1B	21	44
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(CCN2CCCC2)c1	ZINC000819464019	GG	On-Demand	Anodyne	CACNA1G	23	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(CCN2CCCC2)c1	ZINC000819464020	GG	On-Demand	Anodyne	HRH2	31	44
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(CCN2CCCC2)c1	ZINC000819464020	GG	On-Demand	Anodyne	HTR1D	26	44
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(CCN2CCCC2)c1	ZINC000819464020	GG	On-Demand	Anodyne	HTR1B	21	44
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(CCN2CCCC2)c1	ZINC000819464020	GG	On-Demand	Anodyne	CACNA1G	23	40
CON(C)C(=O)CCNc1cccc(CCN2CCCC2)c1	ZINC000819464023	DE	On-Demand	Anodyne	DRD4	41	32
CON(C)C(=O)CCNc1cccc(CCN2CCCC2)c1	ZINC000819464023	DE	On-Demand	Anodyne	HTR1D	25	40
CON(C)C(=O)CCNc1cccc(CCN2CCCC2)c1	ZINC000819464023	DE	On-Demand	Anodyne	HTR1B	20	40
CON(C)C(=O)CCNc1cccc(CCN2CCCC2)c1	ZINC000819464023	DE	On-Demand	Anodyne	SIGMAR1	26	42
OC[C@@H](O)c1cccc(NC[C@H](O)COc2cccc(Br)c2)c1	ZINC000819464056	GE	On-Demand	Anodyne	ADRB2	17	42
OC[C@@H](O)c1cccc(NC[C@H](O)COc2cccc(Br)c2)c1	ZINC000819464056	GE	On-Demand	Anodyne	ADRB1	23	40
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2cccc(Br)c2)c1	ZINC000819464057	GE	On-Demand	Anodyne	ADRB2	17	42
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2cccc(Br)c2)c1	ZINC000819464057	GE	On-Demand	Anodyne	ADRB1	23	40
OC[C@H](O)c1cccc(NC[C@H](O)COc2cccc(Br)c2)c1	ZINC000819464058	GE	On-Demand	Anodyne	ADRB2	17	42
OC[C@H](O)c1cccc(NC[C@H](O)COc2cccc(Br)c2)c1	ZINC000819464058	GE	On-Demand	Anodyne	ADRB1	23	40
OC[C@H](O)c1cccc(NC[C@@H](O)COc2cccc(Br)c2)c1	ZINC000819464059	GE	On-Demand	Anodyne	ADRB2	17	42
OC[C@H](O)c1cccc(NC[C@@H](O)COc2cccc(Br)c2)c1	ZINC000819464059	GE	On-Demand	Anodyne	ADRB1	23	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1ccc(CCS(C)(=O)=O)cc1	ZINC000819464160	GD	On-Demand	Anodyne	PTPRB	37	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1ccc(CCS(C)(=O)=O)cc1	ZINC000819464161	GD	On-Demand	Anodyne	PTPRB	37	40
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819464162	EE	On-Demand	Anodyne	ADRB2	27	59
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819464162	EE	On-Demand	Anodyne	ADRB1	41	59
OC[C@@H](O)c1cccc(NC[C@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819464163	EE	On-Demand	Anodyne	ADRB2	27	59
OC[C@@H](O)c1cccc(NC[C@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819464163	EE	On-Demand	Anodyne	ADRB1	41	59
OC[C@H](O)c1cccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819464164	EE	On-Demand	Anodyne	ADRB2	27	59
OC[C@H](O)c1cccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819464164	EE	On-Demand	Anodyne	ADRB1	41	59
OC[C@H](O)c1cccc(NC[C@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819464165	EE	On-Demand	Anodyne	ADRB2	27	59
OC[C@H](O)c1cccc(NC[C@H](O)COc2cccc3[nH]ccc23)c1	ZINC000819464165	EE	On-Demand	Anodyne	ADRB1	41	59
N#CCC(=O)N1CCN(C(=O)c2cc(-c3ccccc3)nc3cc(F)ccc23)CC1	ZINC000819464210	HG	On-Demand	Mild	DHODH	42	49
N#CCC(=O)N1CCN(C(=O)c2cc(-c3ccccc3)nc3cc(F)ccc23)CC1	ZINC000819464210	HG	On-Demand	Mild	PRS	40	38
N#CCC(=O)N1CCN(C(=O)c2cc(-c3ccccc3)nc3cc(F)ccc23)CC1	ZINC000819464210	HG	On-Demand	Mild	MT-CO2	47	36
COc1ccccc1/C=C(/C(=O)N1CC2(CCOCC2)C1)c1ccccc1	ZINC000819464214	FH	On-Demand	Anodyne	TLR4	15	43
O=C(NCCn1cnnn1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000819464215	FD	On-Demand	Anodyne	NPFFR1	40	39
O=C(NCCn1cnnn1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000819464216	FD	On-Demand	Anodyne	NPFFR1	40	39
COc1cccc(OC)c1OC[C@H](O)CNc1cccc([C@@H](O)CO)c1	ZINC000819464242	FD	On-Demand	Anodyne	ADRB1	43	39
COc1cccc(OC)c1OC[C@@H](O)CNc1cccc([C@@H](O)CO)c1	ZINC000819464243	FD	On-Demand	Anodyne	ADRB1	43	39
COc1cccc(OC)c1OC[C@H](O)CNc1cccc([C@H](O)CO)c1	ZINC000819464244	FD	On-Demand	Anodyne	ADRB1	43	39
COc1cccc(OC)c1OC[C@@H](O)CNc1cccc([C@H](O)CO)c1	ZINC000819464245	FD	On-Demand	Anodyne	ADRB1	43	39
Cc1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819464246	DD	On-Demand	Anodyne	ADRB2	43	50
Cc1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819464246	DD	On-Demand	Anodyne	ADRB1	52	43
Cc1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819464246	DD	On-Demand	Anodyne	ADRB3	40	40
Cc1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819464247	DD	On-Demand	Anodyne	ADRB2	43	50
Cc1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819464247	DD	On-Demand	Anodyne	ADRB1	52	43
Cc1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819464247	DD	On-Demand	Anodyne	ADRB3	40	40
Cc1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819464248	DD	On-Demand	Anodyne	ADRB2	43	50
Cc1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819464248	DD	On-Demand	Anodyne	ADRB1	52	43
Cc1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819464248	DD	On-Demand	Anodyne	ADRB3	40	40
Cc1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819464249	DD	On-Demand	Anodyne	ADRB2	43	50
Cc1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819464249	DD	On-Demand	Anodyne	ADRB1	52	43
Cc1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819464249	DD	On-Demand	Anodyne	ADRB3	40	40
CS(=O)(=O)Nc1cc(F)ccc1NC(=O)C(F)=C1CCC1	ZINC000819464254	DF	On-Demand	Anodyne	PLA2G7	21	40
CON(C)C(=O)CCNc1ccc(CCS(C)(=O)=O)cc1	ZINC000819464265	DD	On-Demand	Anodyne	PTPRB	42	35
CS(=O)(=O)Nc1ccc(OCCNC(=O)C(F)=C2CCC2)cc1	ZINC000819464268	ED	On-Demand	Anodyne	GRIN1	26	41
CSc1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819464272	EE	On-Demand	Anodyne	ADRB1	43	36
CSc1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819464273	EE	On-Demand	Anodyne	ADRB1	43	36
CSc1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819464274	EE	On-Demand	Anodyne	ADRB1	43	36
CSc1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819464275	EE	On-Demand	Anodyne	ADRB1	43	36
C[C@@](O)(CC(=O)N1CCN(C(=O)CC#N)CC1)c1ccccc1	ZINC000819464296	DC	On-Demand	Mild	PTAFR	30	55
CCCOc1nc2ccccc2cc1/C=C/C(=O)N1CC2(CCOCC2)C1	ZINC000819464297	FH	On-Demand	Anodyne	ITGAL	47	34
CCCOc1nc2ccccc2cc1/C=C\C(=O)N1CC2(CCOCC2)C1	ZINC000819464298	FH	On-Demand	Anodyne	ITGAL	47	34
O=C(c1ccc(-n2cnc3ccccc32)nc1)N1CC2(CCOCC2)C1	ZINC000819464299	EF	On-Demand	Anodyne	HPGD	43	38
CNS(=O)(=O)c1ccc(Cl)c(C(=O)N2CC3(CCOCC3)C2)c1	ZINC000819464305	FD	On-Demand	Anodyne	SLC6A9	19	45
CC(=O)Nc1cccc(CC(=O)N2CCc3cc(C)ccc32)c1	ZINC000819464308	DG	On-Demand	Anodyne	EIF2AK2	15	41
CC(=O)Nc1cccc(CC(=O)N2CCc3cc(C)ccc32)c1	ZINC000819464308	DG	On-Demand	Anodyne	EIF2AK3	83	48
O=C(/C=C/c1cc(C(F)(F)F)ccc1Cl)N1CC2(CCOCC2)C1	ZINC000819464309	FI	On-Demand	Anodyne	ITGAL	86	37
O=C(/C=C\c1cc(C(F)(F)F)ccc1Cl)N1CC2(CCOCC2)C1	ZINC000819464310	FI	On-Demand	Anodyne	ITGAL	86	37
COc1cc(Oc2ccccc2)ccc1NCC1(O)CCS(=O)(=O)CC1	ZINC000819464325	GF	On-Demand	Anodyne	KCNA3	40	34
O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CC2(CCOCC2)C1	ZINC000819464326	GI	On-Demand	Anodyne	ITGAL	55	38
O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)N1CC2(CCOCC2)C1	ZINC000819464329	GI	On-Demand	Anodyne	ITGAL	55	38
OC[C@H](O)c1cccc(NC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819464345	EG	On-Demand	Anodyne	ADRB1	24	42
OC[C@H](O)c1cccc(NC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819464345	EG	On-Demand	Anodyne	ADRB3	39	42
OC[C@H](O)c1cccc(NC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819464346	EG	On-Demand	Anodyne	ADRB1	24	42
OC[C@H](O)c1cccc(NC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819464346	EG	On-Demand	Anodyne	ADRB3	39	42
OC[C@@H](O)c1cccc(NC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819464348	EG	On-Demand	Anodyne	ADRB1	24	42
OC[C@@H](O)c1cccc(NC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819464348	EG	On-Demand	Anodyne	ADRB3	39	42
OC[C@@H](O)c1cccc(NC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819464350	EG	On-Demand	Anodyne	ADRB1	24	42
OC[C@@H](O)c1cccc(NC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819464350	EG	On-Demand	Anodyne	ADRB3	39	42
COc1ccccc1/C=C(/C(=O)N1CCN(C(=O)CC#N)CC1)c1ccccc1	ZINC000819464371	GF	On-Demand	Mild	PTAFR	19	42
O=C(NCCn1cnnn1)[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1	ZINC000819464375	FC	On-Demand	Anodyne	RBP4	44	31
O=C(NCCn1cnnn1)[C@H]1CCCN(C(=O)Nc2ccccc2F)C1	ZINC000819464376	FC	On-Demand	Anodyne	RBP4	44	31
CCc1nnc(CNC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)o1	ZINC000819464382	FD	On-Demand	Anodyne	F2	40	35
CCc1nnc(CNC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)o1	ZINC000819464382	FD	On-Demand	Anodyne	LGMN	88	37
CCc1nnc(CNC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)o1	ZINC000819464382	FD	On-Demand	Anodyne	TMPRSS11D	48	34
CCc1nnc(CNC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)o1	ZINC000819464383	FD	On-Demand	Anodyne	F2	40	35
CCc1nnc(CNC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)o1	ZINC000819464383	FD	On-Demand	Anodyne	LGMN	88	37
CCc1nnc(CNC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)o1	ZINC000819464383	FD	On-Demand	Anodyne	TMPRSS11D	48	34
N#CCC(=O)N1CCN(C(=O)/C=C/c2ccccc2OC(F)(F)F)CC1	ZINC000819464384	FE	On-Demand	Mild	ITGAL	92	40
N#CCC(=O)N1CCN(C(=O)/C=C\c2ccccc2OC(F)(F)F)CC1	ZINC000819464387	FE	On-Demand	Mild	ITGAL	92	40
CCc1nnc(CNC(=O)[C@H]2CC(c3ccccc3)=NO2)o1	ZINC000819464394	DD	On-Demand	Anodyne	LUCI_PHOPY	51	37
CCc1nnc(CNC(=O)[C@@H]2CC(c3ccccc3)=NO2)o1	ZINC000819464395	DD	On-Demand	Anodyne	LUCI_PHOPY	51	37
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccc(F)cc2)c1	ZINC000819464437	DD	On-Demand	Anodyne	ADRB2	41	40
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccc(F)cc2)c1	ZINC000819464437	DD	On-Demand	Anodyne	ADRB1	56	40
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccc(F)cc2)c1	ZINC000819464437	DD	On-Demand	Anodyne	ADRB3	42	40
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000819464438	DD	On-Demand	Anodyne	ADRB2	41	40
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000819464438	DD	On-Demand	Anodyne	ADRB1	56	40
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000819464438	DD	On-Demand	Anodyne	ADRB3	42	40
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccc(F)cc2)c1	ZINC000819464439	DD	On-Demand	Anodyne	ADRB2	41	40
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccc(F)cc2)c1	ZINC000819464439	DD	On-Demand	Anodyne	ADRB1	56	40
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccc(F)cc2)c1	ZINC000819464439	DD	On-Demand	Anodyne	ADRB3	42	40
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000819464440	DD	On-Demand	Anodyne	ADRB2	41	40
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000819464440	DD	On-Demand	Anodyne	ADRB1	56	40
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccc(F)cc2)c1	ZINC000819464440	DD	On-Demand	Anodyne	ADRB3	42	40
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccccc2F)c1	ZINC000819464447	DD	On-Demand	Anodyne	ADRB1	50	35
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccccc2F)c1	ZINC000819464448	DD	On-Demand	Anodyne	ADRB1	50	35
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccccc2F)c1	ZINC000819464449	DD	On-Demand	Anodyne	ADRB1	50	35
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccccc2F)c1	ZINC000819464450	DD	On-Demand	Anodyne	ADRB1	50	35
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccccc2)c1	ZINC000819464455	DD	On-Demand	Anodyne	ADRB2	55	48
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccccc2)c1	ZINC000819464455	DD	On-Demand	Anodyne	ADRB1	67	46
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccccc2)c1	ZINC000819464455	DD	On-Demand	Anodyne	ADRB3	59	46
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccccc2)c1	ZINC000819464455	DD	On-Demand	Anodyne	CASR	19	43
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccccc2)c1	ZINC000819464455	DD	On-Demand	Anodyne	ABCB1	17	41
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccccc2)c1	ZINC000819464456	DD	On-Demand	Anodyne	ADRB2	55	48
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccccc2)c1	ZINC000819464456	DD	On-Demand	Anodyne	ADRB1	67	46
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccccc2)c1	ZINC000819464456	DD	On-Demand	Anodyne	ADRB3	59	46
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccccc2)c1	ZINC000819464456	DD	On-Demand	Anodyne	CASR	19	43
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccccc2)c1	ZINC000819464456	DD	On-Demand	Anodyne	ABCB1	17	41
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccccc2)c1	ZINC000819464457	DD	On-Demand	Anodyne	ADRB2	55	48
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccccc2)c1	ZINC000819464457	DD	On-Demand	Anodyne	ADRB1	67	46
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccccc2)c1	ZINC000819464457	DD	On-Demand	Anodyne	ADRB3	59	46
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccccc2)c1	ZINC000819464457	DD	On-Demand	Anodyne	CASR	19	43
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccccc2)c1	ZINC000819464457	DD	On-Demand	Anodyne	ABCB1	17	41
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccccc2)c1	ZINC000819464458	DD	On-Demand	Anodyne	ADRB2	55	48
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccccc2)c1	ZINC000819464458	DD	On-Demand	Anodyne	ADRB1	67	46
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccccc2)c1	ZINC000819464458	DD	On-Demand	Anodyne	ADRB3	59	46
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccccc2)c1	ZINC000819464458	DD	On-Demand	Anodyne	CASR	19	43
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccccc2)c1	ZINC000819464458	DD	On-Demand	Anodyne	ABCB1	17	41
Cc1ccccc1[C@@H](O)CNc1cccc([C@H](O)CO)c1	ZINC000819464470	CE	On-Demand	Anodyne	ADRB2	16	40
Cc1ccccc1[C@@H](O)CNc1cccc([C@@H](O)CO)c1	ZINC000819464472	CE	On-Demand	Anodyne	ADRB2	16	40
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819464488	ED	On-Demand	Anodyne	ADRB2	39	42
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819464488	ED	On-Demand	Anodyne	ADRB1	70	42
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819464488	ED	On-Demand	Anodyne	ADRB3	62	39
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819464488	ED	On-Demand	Anodyne	ABCB1	20	54
CC(=O)c1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819464489	ED	On-Demand	Anodyne	ADRB2	39	42
CC(=O)c1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819464489	ED	On-Demand	Anodyne	ADRB1	70	42
CC(=O)c1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819464489	ED	On-Demand	Anodyne	ADRB3	62	39
CC(=O)c1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819464489	ED	On-Demand	Anodyne	ABCB1	20	54
CC(=O)c1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819464490	ED	On-Demand	Anodyne	ADRB2	39	42
CC(=O)c1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819464490	ED	On-Demand	Anodyne	ADRB1	70	42
CC(=O)c1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819464490	ED	On-Demand	Anodyne	ADRB3	62	39
CC(=O)c1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819464490	ED	On-Demand	Anodyne	ABCB1	20	54
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819464491	ED	On-Demand	Anodyne	ADRB2	39	42
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819464491	ED	On-Demand	Anodyne	ADRB1	70	42
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819464491	ED	On-Demand	Anodyne	ADRB3	62	39
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819464491	ED	On-Demand	Anodyne	ABCB1	20	54
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC=C(c3ccc(Cl)nc3)CC1)C2	ZINC000819464507	GG	On-Demand	Anodyne	ADAM10	28	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC=C(c3ccc(Cl)nc3)CC1)C2	ZINC000819464508	GG	On-Demand	Anodyne	ADAM10	28	41
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)c1	ZINC000819464509	ED	On-Demand	Bother	ADRB1	17	50
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)c1	ZINC000819464510	ED	On-Demand	Bother	ADRB1	17	50
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)c1	ZINC000819464511	ED	On-Demand	Bother	ADRB1	17	50
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)c1	ZINC000819464512	ED	On-Demand	Bother	ADRB1	17	50
COc1cc(Oc2ccccc2)ccc1NC[C@H](O)CN1CCCC1=O	ZINC000819464513	FF	On-Demand	Anodyne	HCRTR1	15	41
COc1cc(Oc2ccccc2)ccc1NC[C@H](O)CN1CCCC1=O	ZINC000819464513	FF	On-Demand	Anodyne	HCRTR2	20	41
COc1cc(Oc2ccccc2)ccc1NC[C@@H](O)CN1CCCC1=O	ZINC000819464514	FF	On-Demand	Anodyne	HCRTR1	15	41
COc1cc(Oc2ccccc2)ccc1NC[C@@H](O)CN1CCCC1=O	ZINC000819464514	FF	On-Demand	Anodyne	HCRTR2	20	41
OC[C@@H](O)c1cccc(NC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000819464515	DE	On-Demand	Anodyne	ADRB1	27	43
OC[C@@H](O)c1cccc(NC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000819464515	DE	On-Demand	Anodyne	ADRB3	41	48
OC[C@@H](O)c1cccc(NC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000819464516	DE	On-Demand	Anodyne	ADRB1	27	43
OC[C@@H](O)c1cccc(NC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000819464516	DE	On-Demand	Anodyne	ADRB3	41	48
OC[C@H](O)c1cccc(NC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000819464517	DE	On-Demand	Anodyne	ADRB1	27	43
OC[C@H](O)c1cccc(NC[C@@H](O)Cc2cccc(Cl)c2)c1	ZINC000819464517	DE	On-Demand	Anodyne	ADRB3	41	48
OC[C@H](O)c1cccc(NC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000819464518	DE	On-Demand	Anodyne	ADRB1	27	43
OC[C@H](O)c1cccc(NC[C@H](O)Cc2cccc(Cl)c2)c1	ZINC000819464518	DE	On-Demand	Anodyne	ADRB3	41	48
CCc1nnc(CNC(=O)c2cc(C)n(Cc3ccccc3)c2C)o1	ZINC000819464534	EG	On-Demand	Anodyne	PLA2G2A	67	36
CCc1nnc(CNC(=O)[C@H]2CC(c3ccc(Cl)cc3Cl)=NO2)o1	ZINC000819464536	FF	On-Demand	Anodyne	ALPL	42	33
CCc1nnc(CNC(=O)[C@@H]2CC(c3ccc(Cl)cc3Cl)=NO2)o1	ZINC000819464537	FF	On-Demand	Anodyne	ALPL	42	33
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1cccc([C@H](O)CO)c1	ZINC000819464543	ED	On-Demand	Bother	ADRB1	52	39
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1cccc([C@H](O)CO)c1	ZINC000819464545	ED	On-Demand	Bother	ADRB1	52	39
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1cccc([C@@H](O)CO)c1	ZINC000819464547	ED	On-Demand	Bother	ADRB1	52	39
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1cccc([C@@H](O)CO)c1	ZINC000819464549	ED	On-Demand	Bother	ADRB1	52	39
CC1(C)C[C@@H]1C(=O)NC[C@@H](NC(=O)[C@@H]1CC1(C)C)C(F)(F)F	ZINC000819464562	DE	On-Demand	Anodyne	DPEP1	83	41
CC1(C)C[C@@H]1C(=O)NC[C@H](NC(=O)[C@@H]1CC1(C)C)C(F)(F)F	ZINC000819464563	DE	On-Demand	Anodyne	DPEP1	83	41
O=C(/C=C/c1ccccc1OC(F)(F)F)N1CC2(CCOCC2)C1	ZINC000819464565	EG	On-Demand	Anodyne	ITGAL	86	40
O=C(/C=C\c1ccccc1OC(F)(F)F)N1CC2(CCOCC2)C1	ZINC000819464566	EG	On-Demand	Anodyne	ITGAL	86	40
O=C(/C=C\c1cccc(O)c1)NC[C@H](NC(=O)/C=C\c1cccc(O)c1)C(F)(F)F	ZINC000819464571	HF	On-Demand	Anodyne	MMP2	15	55
O=C(/C=C\c1cccc(O)c1)NC[C@H](NC(=O)/C=C\c1cccc(O)c1)C(F)(F)F	ZINC000819464571	HF	On-Demand	Anodyne	MMP9	15	55
O=C(/C=C\c1cccc(O)c1)NC[C@H](NC(=O)/C=C/c1cccc(O)c1)C(F)(F)F	ZINC000819464572	HF	On-Demand	Anodyne	MMP2	15	55
O=C(/C=C\c1cccc(O)c1)NC[C@H](NC(=O)/C=C/c1cccc(O)c1)C(F)(F)F	ZINC000819464572	HF	On-Demand	Anodyne	MMP9	15	55
O=C(/C=C/c1cccc(O)c1)NC[C@H](NC(=O)/C=C/c1cccc(O)c1)C(F)(F)F	ZINC000819464573	HF	On-Demand	Anodyne	MMP2	15	55
O=C(/C=C/c1cccc(O)c1)NC[C@H](NC(=O)/C=C/c1cccc(O)c1)C(F)(F)F	ZINC000819464573	HF	On-Demand	Anodyne	MMP9	15	55
O=C(/C=C\c1cccc(O)c1)N[C@@H](CNC(=O)/C=C/c1cccc(O)c1)C(F)(F)F	ZINC000819464574	HF	On-Demand	Anodyne	MMP2	15	55
O=C(/C=C\c1cccc(O)c1)N[C@@H](CNC(=O)/C=C/c1cccc(O)c1)C(F)(F)F	ZINC000819464574	HF	On-Demand	Anodyne	MMP9	15	55
CCc1nnc(CNC(=O)c2cccc(C)c2NC(=O)c2ccncc2)o1	ZINC000819464601	FF	On-Demand	Anodyne	SHH	35	40
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCCn1cnnn1	ZINC000819464607	FC	On-Demand	Anodyne	MME	22	41
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCCn1cnnn1	ZINC000819464607	FC	On-Demand	Anodyne	CTSL	27	47
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCCn1cnnn1	ZINC000819464607	FC	On-Demand	Anodyne	PCSK5	37	40
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCCn1cnnn1	ZINC000819464607	FC	On-Demand	Anodyne	FURIN	65	49
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCCn1cnnn1	ZINC000819464607	FC	On-Demand	Anodyne	CAPN2	60	36
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCCn1cnnn1	ZINC000819464607	FC	On-Demand	Anodyne	MC1R	43	33
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCCn1cnnn1	ZINC000819464607	FC	On-Demand	Anodyne	FPR1	41	41
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCCn1cnnn1	ZINC000819464607	FC	On-Demand	Anodyne	KISS1R	46	33
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCCn1cnnn1	ZINC000819464607	FC	On-Demand	Anodyne	POLG_WNV	51	35
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCCn1cnnn1	ZINC000819464608	FC	On-Demand	Anodyne	MME	22	41
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCCn1cnnn1	ZINC000819464608	FC	On-Demand	Anodyne	CTSL	27	47
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCCn1cnnn1	ZINC000819464608	FC	On-Demand	Anodyne	PCSK5	37	40
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCCn1cnnn1	ZINC000819464608	FC	On-Demand	Anodyne	FURIN	65	49
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCCn1cnnn1	ZINC000819464608	FC	On-Demand	Anodyne	CAPN2	60	36
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCCn1cnnn1	ZINC000819464608	FC	On-Demand	Anodyne	MC1R	43	33
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCCn1cnnn1	ZINC000819464608	FC	On-Demand	Anodyne	FPR1	41	41
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCCn1cnnn1	ZINC000819464608	FC	On-Demand	Anodyne	KISS1R	46	33
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCCn1cnnn1	ZINC000819464608	FC	On-Demand	Anodyne	POLG_WNV	51	35
CCc1nnc(CNC(=O)c2cc(-c3ccccc3)nc3cc(F)ccc23)o1	ZINC000819464620	GH	On-Demand	Anodyne	DHODH	25	46
CCc1nnc(CNC(=O)c2cc(-c3ccccc3)nc3cc(F)ccc23)o1	ZINC000819464620	GH	On-Demand	Anodyne	TACR3	35	54
O=C(CCCOc1cccc(Br)c1)NCCn1cnnn1	ZINC000819464623	FD	On-Demand	Anodyne	HMOX2	22	46
C[C@@]1(C(=O)NCCn2cnnn2)CCCc2ccccc21	ZINC000819464635	CD	On-Demand	Anodyne	OXTR	15	42
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccc(Br)cc2)c1	ZINC000819464645	GE	On-Demand	Anodyne	ADRB2	31	40
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccc(Br)cc2)c1	ZINC000819464645	GE	On-Demand	Anodyne	ADRB1	45	40
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccc(Br)cc2)c1	ZINC000819464645	GE	On-Demand	Anodyne	ADRB3	31	40
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccc(Br)cc2)c1	ZINC000819464646	GE	On-Demand	Anodyne	ADRB2	31	40
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccc(Br)cc2)c1	ZINC000819464646	GE	On-Demand	Anodyne	ADRB1	45	40
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccc(Br)cc2)c1	ZINC000819464646	GE	On-Demand	Anodyne	ADRB3	31	40
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccc(Br)cc2)c1	ZINC000819464647	GE	On-Demand	Anodyne	ADRB2	31	40
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccc(Br)cc2)c1	ZINC000819464647	GE	On-Demand	Anodyne	ADRB1	45	40
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccc(Br)cc2)c1	ZINC000819464647	GE	On-Demand	Anodyne	ADRB3	31	40
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccc(Br)cc2)c1	ZINC000819464648	GE	On-Demand	Anodyne	ADRB2	31	40
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccc(Br)cc2)c1	ZINC000819464648	GE	On-Demand	Anodyne	ADRB1	45	40
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccc(Br)cc2)c1	ZINC000819464648	GE	On-Demand	Anodyne	ADRB3	31	40
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819464649	EE	On-Demand	Anodyne	ADRB2	30	43
OC[C@@H](O)c1cccc(NC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819464649	EE	On-Demand	Anodyne	ADRB1	42	38
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccccc2Cl)c1	ZINC000819464650	EE	On-Demand	Anodyne	ADRB2	30	43
OC[C@@H](O)c1cccc(NC[C@H](O)COc2ccccc2Cl)c1	ZINC000819464650	EE	On-Demand	Anodyne	ADRB1	42	38
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccccc2Cl)c1	ZINC000819464651	EE	On-Demand	Anodyne	ADRB2	30	43
OC[C@H](O)c1cccc(NC[C@H](O)COc2ccccc2Cl)c1	ZINC000819464651	EE	On-Demand	Anodyne	ADRB1	42	38
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819464652	EE	On-Demand	Anodyne	ADRB2	30	43
OC[C@H](O)c1cccc(NC[C@@H](O)COc2ccccc2Cl)c1	ZINC000819464652	EE	On-Demand	Anodyne	ADRB1	42	38
COc1cc(Oc2ccccc2)ccc1NC[C@@H](C)O	ZINC000819464665	CG	On-Demand	Anodyne	MTNR1B	21	42
COc1cc(Oc2ccccc2)ccc1NC[C@H](C)O	ZINC000819464666	CG	On-Demand	Anodyne	MTNR1B	21	42
COc1cc(Oc2ccccc2)ccc1NCC(C)(C)O	ZINC000819464672	CH	On-Demand	Anodyne	MTNR1B	26	40
COc1cc(Oc2ccccc2)ccc1NCC(C)(C)O	ZINC000819464672	CH	On-Demand	Anodyne	MT-ND1	25	40
OC[C@H](O)c1cccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819464677	FF	On-Demand	Anodyne	ADRB2	22	40
OC[C@H](O)c1cccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819464677	FF	On-Demand	Anodyne	ADRB1	19	40
OC[C@H](O)c1cccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819464678	FF	On-Demand	Anodyne	ADRB2	22	40
OC[C@H](O)c1cccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819464678	FF	On-Demand	Anodyne	ADRB1	19	40
OC[C@@H](O)c1cccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819464679	FF	On-Demand	Anodyne	ADRB2	22	40
OC[C@@H](O)c1cccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819464679	FF	On-Demand	Anodyne	ADRB1	19	40
OC[C@@H](O)c1cccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819464680	FF	On-Demand	Anodyne	ADRB2	22	40
OC[C@@H](O)c1cccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819464680	FF	On-Demand	Anodyne	ADRB1	19	40
COCCNC(=O)c1ccccc1NC(=O)c1nn(CC(C)C)c(=O)c2ccccc12	ZINC000819464689	HF	On-Demand	Anodyne	POLR1A	66	37
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2cccc([C@@H](O)CO)c2)CC1	ZINC000819464703	GE	On-Demand	Anodyne	GPR119	46	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2cccc([C@H](O)CO)c2)CC1	ZINC000819464704	GE	On-Demand	Anodyne	GPR119	46	51
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2cccc([C@@H](O)CO)c2)CC1	ZINC000819464705	GE	On-Demand	Anodyne	GPR119	46	51
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2cccc([C@H](O)CO)c2)CC1	ZINC000819464706	GE	On-Demand	Anodyne	GPR119	46	51
N#Cc1ccc(OC[C@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819464720	ED	On-Demand	Mild	ADRB1	41	35
N#Cc1ccc(OC[C@@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819464721	ED	On-Demand	Mild	ADRB1	41	35
N#Cc1ccc(OC[C@H](O)CNc2cccc([C@H](O)CO)c2)cc1	ZINC000819464722	ED	On-Demand	Mild	ADRB1	41	35
N#Cc1ccc(OC[C@@H](O)CNc2cccc([C@@H](O)CO)c2)cc1	ZINC000819464723	ED	On-Demand	Mild	ADRB1	41	35
O=S(=O)(CCNc1cccc([C@@H](O)CO)c1)c1ccccc1	ZINC000819464742	DD	On-Demand	Anodyne	ADRB3	26	40
O=S(=O)(CCNc1cccc([C@H](O)CO)c1)c1ccccc1	ZINC000819464743	DD	On-Demand	Anodyne	ADRB3	26	40
COc1cc(Oc2ccccc2)ccc1NCC1(O)CCC1	ZINC000819464772	CH	On-Demand	Anodyne	KCNA3	40	34
CC[C@H](O)CNc1ccc(Oc2ccccc2)cc1OC	ZINC000819464798	CH	On-Demand	Anodyne	MTNR1B	16	40
COc1cccc([S@@](=O)CC(=O)N2CCc3cc(C)ccc32)c1	ZINC000819464802	EF	On-Demand	Anodyne	DRD4	45	38
COc1cccc([S@@](=O)CC(=O)N2CCc3cc(C)ccc32)c1	ZINC000819464802	EF	On-Demand	Anodyne	EIF2AK3	47	41
COCCNC(=O)c1ccccc1NC(=O)COc1ccc(I)cc1	ZINC000819464823	JF	On-Demand	Anodyne	PRTN3	48	40
O=C(CCNc1cccc([C@@H](O)CO)c1)Nc1cccnc1	ZINC000819464824	DD	On-Demand	Anodyne	ADRB3	34	40
O=C(CCNc1cccc([C@H](O)CO)c1)Nc1cccnc1	ZINC000819464825	DD	On-Demand	Anodyne	ADRB3	34	40
OC[C@H](O)c1cccc(NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819464855	DF	On-Demand	Anodyne	ADRB2	19	46
OC[C@H](O)c1cccc(NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819464855	DF	On-Demand	Anodyne	ADRB1	29	42
OC[C@H](O)c1cccc(NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819464855	DF	On-Demand	Anodyne	ADRB3	46	42
OC[C@@H](O)c1cccc(NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819464856	DF	On-Demand	Anodyne	ADRB2	19	46
OC[C@@H](O)c1cccc(NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819464856	DF	On-Demand	Anodyne	ADRB1	29	42
OC[C@@H](O)c1cccc(NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819464856	DF	On-Demand	Anodyne	ADRB3	46	42
OC[C@H](O)c1cccc(NC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819464890	FF	On-Demand	Anodyne	ADRB2	18	45
OC[C@H](O)c1cccc(NC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819464891	FF	On-Demand	Anodyne	ADRB2	18	45
OC[C@@H](O)c1cccc(NC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819464892	FF	On-Demand	Anodyne	ADRB2	18	45
OC[C@@H](O)c1cccc(NC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819464893	FF	On-Demand	Anodyne	ADRB2	18	45
COCCNC(=O)c1ccccc1NC(=O)/C=C\c1ccc2ccccc2n1	ZINC000819464908	GG	On-Demand	Anodyne	POLR1A	63	41
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)cc(OC)c1Br	ZINC000819464921	GI	On-Demand	Anodyne	ADRB2	19	48
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)cc(OC)c1Br	ZINC000819464921	GI	On-Demand	Anodyne	ADRB1	33	48
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)cc(OC)c1Br	ZINC000819464921	GI	On-Demand	Anodyne	ADRB3	51	48
COc1cc(NC[C@H](O)c2cccc(Cl)c2)cc(OC)c1Br	ZINC000819464922	GI	On-Demand	Anodyne	ADRB2	19	48
COc1cc(NC[C@H](O)c2cccc(Cl)c2)cc(OC)c1Br	ZINC000819464922	GI	On-Demand	Anodyne	ADRB1	33	48
COc1cc(NC[C@H](O)c2cccc(Cl)c2)cc(OC)c1Br	ZINC000819464922	GI	On-Demand	Anodyne	ADRB3	51	48
C=CCCC[C@@H](C)NC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819464956	GG	On-Demand	Mild	SSTR2	41	33
C=CCCC[C@H](C)NC(=O)c1cn([C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819464957	GG	On-Demand	Mild	SSTR2	41	33
C=CCCC[C@@H](C)NC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819464958	GG	On-Demand	Mild	SSTR2	41	33
C=CCCC[C@H](C)NC(=O)c1cn([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819464959	GG	On-Demand	Mild	SSTR2	41	33
COCCNC(=O)c1ccccc1NC(=O)[C@H]1CC(=O)N(c2ccc(OC)cc2OC)C1	ZINC000819464962	IE	On-Demand	Anodyne	DRD2	19	43
COCCNC(=O)c1ccccc1NC(=O)[C@H]1CC(=O)N(c2ccc(OC)cc2OC)C1	ZINC000819464962	IE	On-Demand	Anodyne	POLR1A	44	33
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CC(=O)N(c2ccc(OC)cc2OC)C1	ZINC000819464963	IE	On-Demand	Anodyne	DRD2	19	43
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CC(=O)N(c2ccc(OC)cc2OC)C1	ZINC000819464963	IE	On-Demand	Anodyne	POLR1A	44	33
COc1cc(NC[C@H](O)c2ccccc2)cc(OC)c1C(C)C	ZINC000819465003	DH	On-Demand	Anodyne	ADRB2	24	44
COc1cc(NC[C@H](O)c2ccccc2)cc(OC)c1C(C)C	ZINC000819465003	DH	On-Demand	Anodyne	ADRB1	17	43
COc1cc(NC[C@H](O)c2ccccc2)cc(OC)c1C(C)C	ZINC000819465003	DH	On-Demand	Anodyne	ADRB3	38	43
COc1cc(NC[C@H](O)c2ccccc2)cc(OC)c1C(C)C	ZINC000819465003	DH	On-Demand	Anodyne	AOC3	15	41
COc1cc(NC[C@@H](O)c2ccccc2)cc(OC)c1C(C)C	ZINC000819465004	DH	On-Demand	Anodyne	ADRB2	24	44
COc1cc(NC[C@@H](O)c2ccccc2)cc(OC)c1C(C)C	ZINC000819465004	DH	On-Demand	Anodyne	ADRB1	17	43
COc1cc(NC[C@@H](O)c2ccccc2)cc(OC)c1C(C)C	ZINC000819465004	DH	On-Demand	Anodyne	ADRB3	38	43
COc1cc(NC[C@@H](O)c2ccccc2)cc(OC)c1C(C)C	ZINC000819465004	DH	On-Demand	Anodyne	AOC3	15	41
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccccc3F)cc2)CC1	ZINC000819465007	FF	On-Demand	Anodyne	SIGMAR1	30	43
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccccc3F)cc2)CC1	ZINC000819465008	FF	On-Demand	Anodyne	SIGMAR1	30	43
COCCNC(=O)c1ccccc1NC(=O)CS[C@@H](C)c1nc2ccccc2[nH]1	ZINC000819465032	HG	On-Demand	Anodyne	POLR1A	40	35
COCCNC(=O)c1ccccc1NC(=O)CS[C@H](C)c1nc2ccccc2[nH]1	ZINC000819465033	HG	On-Demand	Anodyne	POLR1A	40	35
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819465049	GF	On-Demand	Mild	ADRB2	18	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819465049	GF	On-Demand	Mild	ADRB1	42	33
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819465050	GF	On-Demand	Mild	ADRB2	18	41
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819465050	GF	On-Demand	Mild	ADRB1	42	33
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819465051	GF	On-Demand	Mild	ADRB2	18	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819465051	GF	On-Demand	Mild	ADRB1	42	33
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819465052	GF	On-Demand	Mild	ADRB2	18	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819465052	GF	On-Demand	Mild	ADRB1	42	33
COc1cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1Br	ZINC000819465068	GH	On-Demand	Bother	CACNA1C	41	34
COc1cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1Br	ZINC000819465068	GH	On-Demand	Bother	CACNA1D	61	33
COc1cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1Br	ZINC000819465069	GH	On-Demand	Bother	CACNA1C	41	34
COc1cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1Br	ZINC000819465069	GH	On-Demand	Bother	CACNA1D	61	33
C[C@H](C#N)Oc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819465070	CF	On-Demand	Mild	ADRB1	18	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819465070	CF	On-Demand	Mild	ADRB3	50	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819465071	CF	On-Demand	Mild	ADRB1	18	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819465071	CF	On-Demand	Mild	ADRB3	50	41
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819465072	CF	On-Demand	Mild	ADRB1	18	41
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819465072	CF	On-Demand	Mild	ADRB3	50	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819465073	CF	On-Demand	Mild	ADRB1	18	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819465073	CF	On-Demand	Mild	ADRB3	50	41
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)C3CC3)cc2)CC1	ZINC000819465093	DD	On-Demand	Anodyne	LTA4H	16	40
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)C3CC3)cc2)CC1	ZINC000819465093	DD	On-Demand	Anodyne	SIGMAR1	23	41
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)C3CC3)cc2)CC1	ZINC000819465094	DD	On-Demand	Anodyne	LTA4H	16	40
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)C3CC3)cc2)CC1	ZINC000819465094	DD	On-Demand	Anodyne	SIGMAR1	23	41
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819465099	FC	On-Demand	Mild	PAPA1_CARPA	35	43
COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819465100	FC	On-Demand	Mild	PAPA1_CARPA	35	43
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819465121	GG	On-Demand	Mild	GPR119	43	48
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819465122	GG	On-Demand	Mild	GPR119	43	48
C[C@H](C#N)Oc1ccccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819465123	GG	On-Demand	Mild	GPR119	43	48
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819465124	GG	On-Demand	Mild	GPR119	43	48
COCCNC(=O)c1ccccc1NC(=O)c1cn(-c2ccc(F)cc2)nc1-c1cccc(C)c1	ZINC000819465160	JJ	On-Demand	Anodyne	NR1H4	16	42
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OC(C)C)cc1	ZINC000819465200	GG	On-Demand	Anodyne	ADRB2	43	57
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OC(C)C)cc1	ZINC000819465200	GG	On-Demand	Anodyne	ADRB1	70	57
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OC(C)C)cc1	ZINC000819465200	GG	On-Demand	Anodyne	GRIN1	22	40
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OC(C)C)cc1	ZINC000819465200	GG	On-Demand	Anodyne	ADRB3	39	47
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)cc2OC(C)C)cc1	ZINC000819465201	GG	On-Demand	Anodyne	ADRB2	43	57
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)cc2OC(C)C)cc1	ZINC000819465201	GG	On-Demand	Anodyne	ADRB1	70	57
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)cc2OC(C)C)cc1	ZINC000819465201	GG	On-Demand	Anodyne	GRIN1	22	40
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)cc2OC(C)C)cc1	ZINC000819465201	GG	On-Demand	Anodyne	ADRB3	39	47
COc1cc(NCCC(=O)Nc2ccc(N(C)C)cc2)cc(OC)c1C(C)C	ZINC000819465215	GI	On-Demand	Anodyne	ENPP1	55	31
C[C@@H](C#N)Oc1ccccc1NCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819465230	GI	On-Demand	Mild	CYNT	30	44
C[C@H](C#N)Oc1ccccc1NCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000819465231	GI	On-Demand	Mild	CYNT	30	44
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(F)cn3)cc2)CC1	ZINC000819465236	FE	On-Demand	Anodyne	MLNR	41	40
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccc(F)cn3)cc2)CC1	ZINC000819465237	FE	On-Demand	Anodyne	MLNR	41	40
CCOC[C@H](O)CNc1ccccc1O[C@@H](C)C#N	ZINC000819465246	CD	On-Demand	Mild	ADRB2	20	40
CCOC[C@H](O)CNc1ccccc1O[C@@H](C)C#N	ZINC000819465246	CD	On-Demand	Mild	ADRB1	42	34
CCOC[C@H](O)CNc1ccccc1O[C@H](C)C#N	ZINC000819465248	CD	On-Demand	Mild	ADRB2	20	40
CCOC[C@H](O)CNc1ccccc1O[C@H](C)C#N	ZINC000819465248	CD	On-Demand	Mild	ADRB1	42	34
COCCNC(=O)c1ccccc1NC(=O)CSCC(=O)Nc1cccc(C)c1	ZINC000819465278	HF	On-Demand	Anodyne	KCNK3	91	40
COCCNC(=O)c1ccccc1NC(=O)CSCC(=O)Nc1cccc(C)c1	ZINC000819465278	HF	On-Demand	Anodyne	KCNK9	81	40
COCCNC(=O)c1ccccc1NC(=O)CSCC(=O)Nc1cccc(C)c1	ZINC000819465278	HF	On-Demand	Anodyne	FAS	20	41
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3c(F)cccc3F)cc2)CC1	ZINC000819465283	GF	On-Demand	Anodyne	FAAH	18	42
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3c(F)cccc3F)cc2)CC1	ZINC000819465284	GF	On-Demand	Anodyne	FAAH	18	42
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819465287	GG	On-Demand	Anodyne	ADRB1	34	55
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819465287	GG	On-Demand	Anodyne	ADRB3	55	48
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819465287	GG	On-Demand	Anodyne	IGF1R	29	44
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819465287	GG	On-Demand	Anodyne	SIGMAR1	15	40
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819465287	GG	On-Demand	Anodyne	FAAH	22	47
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819465287	GG	On-Demand	Anodyne	CYP3A4	49	40
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819465287	GG	On-Demand	Anodyne	CACNA1G	26	40
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819465288	GG	On-Demand	Anodyne	ADRB1	34	55
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819465288	GG	On-Demand	Anodyne	ADRB3	55	48
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819465288	GG	On-Demand	Anodyne	IGF1R	29	44
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819465288	GG	On-Demand	Anodyne	SIGMAR1	15	40
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819465288	GG	On-Demand	Anodyne	FAAH	22	47
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819465288	GG	On-Demand	Anodyne	CYP3A4	49	40
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2)CC1	ZINC000819465288	GG	On-Demand	Anodyne	CACNA1G	26	40
CSc1ccc(C)c(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819465293	GI	On-Demand	Anodyne	GPR119	55	48
CSc1ccc(C)c(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819465294	GI	On-Demand	Anodyne	GPR119	55	48
O=C(CCNc1cc(F)c(N2CCCCC2)c(F)c1)Nc1cccnc1	ZINC000819465309	FH	On-Demand	Anodyne	CHRNA7	31	44
O=C(CCNc1cc(F)c(N2CCCCC2)c(F)c1)Nc1cccnc1	ZINC000819465309	FH	On-Demand	Anodyne	NAMPT	20	40
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cc(F)ccc3F)cc2)CC1	ZINC000819465349	GF	On-Demand	Anodyne	SIGMAR1	17	40
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cc(F)ccc3F)cc2)CC1	ZINC000819465349	GF	On-Demand	Anodyne	CCR3	47	39
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cc(F)ccc3F)cc2)CC1	ZINC000819465349	GF	On-Demand	Anodyne	MLNR	40	39
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cc(F)ccc3F)cc2)CC1	ZINC000819465350	GF	On-Demand	Anodyne	SIGMAR1	17	40
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cc(F)ccc3F)cc2)CC1	ZINC000819465350	GF	On-Demand	Anodyne	CCR3	47	39
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cc(F)ccc3F)cc2)CC1	ZINC000819465350	GF	On-Demand	Anodyne	MLNR	40	39
COc1cc(NC[C@@H](O)c2ccccc2)cc(OC)c1Br	ZINC000819465353	FH	On-Demand	Anodyne	ADRB2	23	45
COc1cc(NC[C@@H](O)c2ccccc2)cc(OC)c1Br	ZINC000819465353	FH	On-Demand	Anodyne	ADRB3	27	41
COc1cc(NC[C@@H](O)c2ccccc2)cc(OC)c1Br	ZINC000819465353	FH	On-Demand	Anodyne	AOC3	15	43
COc1cc(NC[C@H](O)c2ccccc2)cc(OC)c1Br	ZINC000819465354	FH	On-Demand	Anodyne	ADRB2	23	45
COc1cc(NC[C@H](O)c2ccccc2)cc(OC)c1Br	ZINC000819465354	FH	On-Demand	Anodyne	ADRB3	27	41
COc1cc(NC[C@H](O)c2ccccc2)cc(OC)c1Br	ZINC000819465354	FH	On-Demand	Anodyne	AOC3	15	43
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819465355	EH	On-Demand	Mild	CTSL	16	41
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819465355	EH	On-Demand	Mild	CTSV	31	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819465356	EH	On-Demand	Mild	CTSL	16	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819465356	EH	On-Demand	Mild	CTSV	31	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819465357	EH	On-Demand	Mild	CTSL	16	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819465357	EH	On-Demand	Mild	CTSV	31	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819465358	EH	On-Demand	Mild	CTSL	16	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819465358	EH	On-Demand	Mild	CTSV	31	41
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(F)c(F)c3)cc2)CC1	ZINC000819465375	GF	On-Demand	Anodyne	MLNR	31	41
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(F)c(F)c3)cc2)CC1	ZINC000819465375	GF	On-Demand	Anodyne	CACNA1G	18	40
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccc(F)c(F)c3)cc2)CC1	ZINC000819465376	GF	On-Demand	Anodyne	MLNR	31	41
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccc(F)c(F)c3)cc2)CC1	ZINC000819465376	GF	On-Demand	Anodyne	CACNA1G	18	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)cc2OC(C)C)cc1	ZINC000819465390	FH	On-Demand	Anodyne	ADRB2	31	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)cc2OC(C)C)cc1	ZINC000819465390	FH	On-Demand	Anodyne	ADRB1	52	33
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)cc2OC(C)C)cc1	ZINC000819465391	FH	On-Demand	Anodyne	ADRB2	31	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)cc2OC(C)C)cc1	ZINC000819465391	FH	On-Demand	Anodyne	ADRB1	52	33
CSc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819465398	FH	On-Demand	Mild	ADRB2	32	40
CSc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819465398	FH	On-Demand	Mild	ADRB1	60	36
CSc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819465399	FH	On-Demand	Mild	ADRB2	32	40
CSc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819465399	FH	On-Demand	Mild	ADRB1	60	36
CSc1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819465400	FH	On-Demand	Mild	ADRB2	32	40
CSc1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819465400	FH	On-Demand	Mild	ADRB1	60	36
CSc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819465401	FH	On-Demand	Mild	ADRB2	32	40
CSc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819465401	FH	On-Demand	Mild	ADRB1	60	36
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819465404	FF	On-Demand	Anodyne	SLC6A3	25	40
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819465404	FF	On-Demand	Anodyne	SIGMAR1	21	44
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819465404	FF	On-Demand	Anodyne	CCR1	18	42
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819465404	FF	On-Demand	Anodyne	MLNR	51	47
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819465404	FF	On-Demand	Anodyne	LEF	22	41
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819465405	FF	On-Demand	Anodyne	SLC6A3	25	40
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819465405	FF	On-Demand	Anodyne	SIGMAR1	21	44
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819465405	FF	On-Demand	Anodyne	CCR1	18	42
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819465405	FF	On-Demand	Anodyne	MLNR	51	47
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccc(F)cc3)cc2)CC1	ZINC000819465405	FF	On-Demand	Anodyne	LEF	22	41
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccccc3Cl)cc2)CC1	ZINC000819465409	GG	On-Demand	Anodyne	SIGMAR1	29	41
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccccc3Cl)cc2)CC1	ZINC000819465409	GG	On-Demand	Anodyne	NPY2R	15	41
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccccc3Cl)cc2)CC1	ZINC000819465409	GG	On-Demand	Anodyne	FAAH	15	45
COc1cc(NC[C@H](O)c2ccc(C)cc2)cc(OC)c1C(C)C	ZINC000819465411	EI	On-Demand	Anodyne	ADRB2	15	48
COc1cc(NC[C@@H](O)c2ccc(C)cc2)cc(OC)c1C(C)C	ZINC000819465412	EI	On-Demand	Anodyne	ADRB2	15	48
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cc2)CC1	ZINC000819465413	GE	On-Demand	Bother	ADRB1	15	40
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cc2)CC1	ZINC000819465413	GE	On-Demand	Bother	FAAH	15	42
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2)CC1	ZINC000819465414	GE	On-Demand	Bother	ADRB1	15	40
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2)CC1	ZINC000819465414	GE	On-Demand	Bother	FAAH	15	42
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819465417	FF	On-Demand	Anodyne	ADRB1	18	42
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819465417	FF	On-Demand	Anodyne	SIGMAR1	15	41
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819465417	FF	On-Demand	Anodyne	NPY2R	15	46
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819465417	FF	On-Demand	Anodyne	MLNR	48	41
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819465418	FF	On-Demand	Anodyne	ADRB1	18	42
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819465418	FF	On-Demand	Anodyne	SIGMAR1	15	41
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819465418	FF	On-Demand	Anodyne	NPY2R	15	46
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cccc(F)c3)cc2)CC1	ZINC000819465418	FF	On-Demand	Anodyne	MLNR	48	41
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc([N+](=O)[O-])cc3)cc2)CC1	ZINC000819465456	GE	On-Demand	Bother	KCNJ1	29	44
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccc([N+](=O)[O-])cc3)cc2)CC1	ZINC000819465457	GE	On-Demand	Bother	KCNJ1	29	44
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(Cl)cc3)cc2)CC1	ZINC000819465471	GG	On-Demand	Anodyne	DRD4	23	43
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(Cl)cc3)cc2)CC1	ZINC000819465471	GG	On-Demand	Anodyne	LSS	17	45
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(Cl)cc3)cc2)CC1	ZINC000819465471	GG	On-Demand	Anodyne	FAAH	19	49
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(Cl)cc3)cc2)CC1	ZINC000819465471	GG	On-Demand	Anodyne	CACNA1G	17	48
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(Cl)cc3)cc2)CC1	ZINC000819465471	GG	On-Demand	Anodyne	BRD2	20	41
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(F)cc3F)cc2)CC1	ZINC000819465499	GF	On-Demand	Anodyne	SIGMAR1	16	40
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(F)cc3F)cc2)CC1	ZINC000819465499	GF	On-Demand	Anodyne	CCR1	17	42
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(F)cc3F)cc2)CC1	ZINC000819465499	GF	On-Demand	Anodyne	CCR3	46	39
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(F)cc3F)cc2)CC1	ZINC000819465499	GF	On-Demand	Anodyne	MLNR	45	39
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccc(F)cc3F)cc2)CC1	ZINC000819465500	GF	On-Demand	Anodyne	SIGMAR1	16	40
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccc(F)cc3F)cc2)CC1	ZINC000819465500	GF	On-Demand	Anodyne	CCR1	17	42
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccc(F)cc3F)cc2)CC1	ZINC000819465500	GF	On-Demand	Anodyne	CCR3	46	39
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccc(F)cc3F)cc2)CC1	ZINC000819465500	GF	On-Demand	Anodyne	MLNR	45	39
CON(C)C(=O)CCNc1ccc(CN2CCN(C(C)=O)CC2)cc1	ZINC000819465544	ED	On-Demand	Anodyne	NOD2	40	34
O=C(NCCCCCCO)c1cc(-c2ccc3ccccc3c2)[nH]n1	ZINC000819465565	EH	On-Demand	Anodyne	ALPL	39	42
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccccc3C)cc2)CC1	ZINC000819465575	FF	On-Demand	Anodyne	LTA4H	15	40
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccccc3C)cc2)CC1	ZINC000819465577	FF	On-Demand	Anodyne	LTA4H	15	40
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccc(C#N)cc3)cc2)CC1	ZINC000819465590	GE	On-Demand	Mild	MLNR	23	44
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(C#N)cc3)cc2)CC1	ZINC000819465592	GE	On-Demand	Mild	MLNR	23	44
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(C3CC3)cc2)cc1	ZINC000819465619	EG	On-Demand	Anodyne	GHSR	16	43
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(C3CC3)cc2)cc1	ZINC000819465620	EG	On-Demand	Anodyne	GHSR	16	43
O[C@H](CNc1ccc(F)cc1OCC(F)F)COc1ccccc1	ZINC000819465622	EG	On-Demand	Anodyne	ADRB2	45	45
O[C@H](CNc1ccc(F)cc1OCC(F)F)COc1ccccc1	ZINC000819465622	EG	On-Demand	Anodyne	ADRB1	57	36
O[C@H](CNc1ccc(F)cc1OCC(F)F)COc1ccccc1	ZINC000819465622	EG	On-Demand	Anodyne	ADRB3	31	42
O[C@@H](CNc1ccc(F)cc1OCC(F)F)COc1ccccc1	ZINC000819465625	EG	On-Demand	Anodyne	ADRB2	45	45
O[C@@H](CNc1ccc(F)cc1OCC(F)F)COc1ccccc1	ZINC000819465625	EG	On-Demand	Anodyne	ADRB1	57	36
O[C@@H](CNc1ccc(F)cc1OCC(F)F)COc1ccccc1	ZINC000819465625	EG	On-Demand	Anodyne	ADRB3	31	42
O[C@H](CNc1ccc(F)cc1OCC(F)F)COc1ccc(F)cc1	ZINC000819465632	FG	On-Demand	Anodyne	ADRB1	53	35
O[C@@H](CNc1ccc(F)cc1OCC(F)F)COc1ccc(F)cc1	ZINC000819465634	FG	On-Demand	Anodyne	ADRB1	53	35
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819465673	FD	On-Demand	Anodyne	ADRB2	27	43
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819465673	FD	On-Demand	Anodyne	ADRB1	28	45
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819465673	FD	On-Demand	Anodyne	ADRB3	102	56
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819465673	FD	On-Demand	Anodyne	PTAFR	16	48
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3cccnc3)cc2)CC1	ZINC000819465673	FD	On-Demand	Anodyne	FAAH	24	40
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819465675	FD	On-Demand	Anodyne	ADRB2	27	43
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819465675	FD	On-Demand	Anodyne	ADRB1	28	45
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819465675	FD	On-Demand	Anodyne	ADRB3	102	56
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819465675	FD	On-Demand	Anodyne	PTAFR	16	48
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cccnc3)cc2)CC1	ZINC000819465675	FD	On-Demand	Anodyne	FAAH	24	40
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccc(F)cc3C)cc2)CC1	ZINC000819465679	GF	On-Demand	Anodyne	CCR3	44	39
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccc(F)cc3C)cc2)CC1	ZINC000819465679	GF	On-Demand	Anodyne	MCHR1	15	40
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(F)cc3C)cc2)CC1	ZINC000819465681	GF	On-Demand	Anodyne	CCR3	44	39
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccc(F)cc3C)cc2)CC1	ZINC000819465681	GF	On-Demand	Anodyne	MCHR1	15	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC(F)F)cc1	ZINC000819465684	GH	On-Demand	Anodyne	ADRB2	31	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC(F)F)cc1	ZINC000819465684	GH	On-Demand	Anodyne	ADRB1	59	35
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC(F)F)cc1	ZINC000819465685	GH	On-Demand	Anodyne	ADRB2	31	40
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC(F)F)cc1	ZINC000819465685	GH	On-Demand	Anodyne	ADRB1	59	35
O[C@H](CNc1ccc(F)cc1OCC(F)F)CN1CCOCC1	ZINC000819465704	ED	On-Demand	Anodyne	CCR1	43	46
O[C@@H](CNc1ccc(F)cc1OCC(F)F)CN1CCOCC1	ZINC000819465705	ED	On-Demand	Anodyne	CCR1	43	46
CON(C)C(=O)CCNc1ccc(COc2ccccc2)cc1	ZINC000819465708	DG	On-Demand	Anodyne	LTA4H	48	44
CON(C)C(=O)CCNc1ccc(COc2ccccc2)cc1	ZINC000819465708	DG	On-Demand	Anodyne	PTGER3	47	35
CON(C)C(=O)CCNc1ccc(COc2ccccc2)cc1	ZINC000819465708	DG	On-Demand	Anodyne	FFAR1	48	43
CON(C)C(=O)CCNc1ccc(COc2ccccc2)cc1	ZINC000819465708	DG	On-Demand	Anodyne	FFAR4	41	37
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(F)cc2OCC(F)F)c1	ZINC000819465717	GH	On-Demand	Anodyne	ADRB2	27	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(F)cc2OCC(F)F)c1	ZINC000819465717	GH	On-Demand	Anodyne	ADRB1	63	38
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(F)cc2OCC(F)F)c1	ZINC000819465717	GH	On-Demand	Anodyne	ABCB1	22	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(F)cc2OCC(F)F)c1	ZINC000819465717	GH	On-Demand	Anodyne	PDS	41	36
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(F)cc2OCC(F)F)c1	ZINC000819465718	GH	On-Demand	Anodyne	ADRB2	27	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(F)cc2OCC(F)F)c1	ZINC000819465718	GH	On-Demand	Anodyne	ADRB1	63	38
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(F)cc2OCC(F)F)c1	ZINC000819465718	GH	On-Demand	Anodyne	ABCB1	22	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(F)cc2OCC(F)F)c1	ZINC000819465718	GH	On-Demand	Anodyne	PDS	41	36
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(F)cc2OC(C)C)c1	ZINC000819465760	FH	On-Demand	Anodyne	ADRB2	29	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(F)cc2OC(C)C)c1	ZINC000819465760	FH	On-Demand	Anodyne	ADRB1	50	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(F)cc2OC(C)C)c1	ZINC000819465760	FH	On-Demand	Anodyne	ABCB1	18	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(F)cc2OC(C)C)c1	ZINC000819465761	FH	On-Demand	Anodyne	ADRB2	29	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(F)cc2OC(C)C)c1	ZINC000819465761	FH	On-Demand	Anodyne	ADRB1	50	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(F)cc2OC(C)C)c1	ZINC000819465761	FH	On-Demand	Anodyne	ABCB1	18	41
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819465772	FE	On-Demand	Anodyne	ADRB1	21	42
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819465772	FE	On-Demand	Anodyne	DRD4	26	41
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819465772	FE	On-Demand	Anodyne	SLC6A3	18	43
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819465772	FE	On-Demand	Anodyne	ADRB3	42	45
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819465772	FE	On-Demand	Anodyne	LTA4H	27	42
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819465772	FE	On-Demand	Anodyne	SIGMAR1	38	41
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819465772	FE	On-Demand	Anodyne	NPY2R	24	43
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819465772	FE	On-Demand	Anodyne	FAAH	20	47
CC(=O)N1CCN(Cc2ccc(NC[C@H](O)c3ccccc3)cc2)CC1	ZINC000819465772	FE	On-Demand	Anodyne	NOD2	40	34
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819465773	FE	On-Demand	Anodyne	ADRB1	21	42
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819465773	FE	On-Demand	Anodyne	DRD4	26	41
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819465773	FE	On-Demand	Anodyne	SLC6A3	18	43
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819465773	FE	On-Demand	Anodyne	ADRB3	42	45
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819465773	FE	On-Demand	Anodyne	LTA4H	27	42
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819465773	FE	On-Demand	Anodyne	SIGMAR1	38	41
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819465773	FE	On-Demand	Anodyne	NPY2R	24	43
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819465773	FE	On-Demand	Anodyne	FAAH	20	47
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3ccccc3)cc2)CC1	ZINC000819465773	FE	On-Demand	Anodyne	NOD2	40	34
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1ccc(CNC(N)=O)cc1	ZINC000819465777	FD	On-Demand	Anodyne	PTPRB	49	37
CC(=O)N1CCN(Cc2ccc(NCC3(O)CCCCC3)cc2)CC1	ZINC000819465820	EE	On-Demand	Anodyne	NPFFR1	41	35
CC(=O)N1CCN(Cc2ccc(NCC3(O)CCCCC3)cc2)CC1	ZINC000819465820	EE	On-Demand	Anodyne	BRD2	15	42
CN1CC=C(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819465821	FD	On-Demand	Mild	PAPA1_CARPA	45	47
CN1CC=C(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819465822	FD	On-Demand	Mild	PAPA1_CARPA	45	47
COCCNC(=O)c1ccccc1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000819465842	GF	On-Demand	Bother	TAAR1	21	43
CN1CCN(C)c2cc(NC[C@H](O)c3cccc(Cl)c3)ccc2C1	ZINC000819465889	EG	On-Demand	Anodyne	ADRB1	24	42
CN1CCN(C)c2cc(NC[C@H](O)c3cccc(Cl)c3)ccc2C1	ZINC000819465889	EG	On-Demand	Anodyne	ADRB3	38	40
CN1CCN(C)c2cc(NC[C@H](O)c3cccc(Cl)c3)ccc2C1	ZINC000819465889	EG	On-Demand	Anodyne	CYP3A4	40	36
CN1CCN(C)c2cc(NC[C@@H](O)c3cccc(Cl)c3)ccc2C1	ZINC000819465890	EG	On-Demand	Anodyne	ADRB1	24	42
CN1CCN(C)c2cc(NC[C@@H](O)c3cccc(Cl)c3)ccc2C1	ZINC000819465890	EG	On-Demand	Anodyne	ADRB3	38	40
CN1CCN(C)c2cc(NC[C@@H](O)c3cccc(Cl)c3)ccc2C1	ZINC000819465890	EG	On-Demand	Anodyne	CYP3A4	40	36
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC(F)F)cc1	ZINC000819465893	GG	On-Demand	Anodyne	ADRB2	44	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC(F)F)cc1	ZINC000819465893	GG	On-Demand	Anodyne	ADRB1	70	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC(F)F)cc1	ZINC000819465893	GG	On-Demand	Anodyne	GRIN1	26	40
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC(F)F)cc1	ZINC000819465893	GG	On-Demand	Anodyne	ADRB3	39	47
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC(F)F)cc1	ZINC000819465893	GG	On-Demand	Anodyne	CCR1	31	41
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC(F)F)cc1	ZINC000819465894	GG	On-Demand	Anodyne	ADRB2	44	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC(F)F)cc1	ZINC000819465894	GG	On-Demand	Anodyne	ADRB1	70	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC(F)F)cc1	ZINC000819465894	GG	On-Demand	Anodyne	GRIN1	26	40
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC(F)F)cc1	ZINC000819465894	GG	On-Demand	Anodyne	ADRB3	39	47
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC(F)F)cc1	ZINC000819465894	GG	On-Demand	Anodyne	CCR1	31	41
COc1cc(NC[C@H](O)c2cccnc2)cc(OC)c1C(C)C	ZINC000819465924	DG	On-Demand	Anodyne	ADRB2	24	40
COc1cc(NC[C@H](O)c2cccnc2)cc(OC)c1C(C)C	ZINC000819465924	DG	On-Demand	Anodyne	ADRB1	24	43
COc1cc(NC[C@H](O)c2cccnc2)cc(OC)c1C(C)C	ZINC000819465924	DG	On-Demand	Anodyne	ADRB3	79	43
COc1cc(NC[C@@H](O)c2cccnc2)cc(OC)c1C(C)C	ZINC000819465925	DG	On-Demand	Anodyne	ADRB2	24	40
COc1cc(NC[C@@H](O)c2cccnc2)cc(OC)c1C(C)C	ZINC000819465925	DG	On-Demand	Anodyne	ADRB1	24	43
COc1cc(NC[C@@H](O)c2cccnc2)cc(OC)c1C(C)C	ZINC000819465925	DG	On-Demand	Anodyne	ADRB3	79	43
COc1cc(NC[C@H](O)c2cccc(Cl)c2)cc(OC)c1C(C)C	ZINC000819465960	EJ	On-Demand	Anodyne	ADRB2	21	49
COc1cc(NC[C@H](O)c2cccc(Cl)c2)cc(OC)c1C(C)C	ZINC000819465960	EJ	On-Demand	Anodyne	ADRB1	35	49
COc1cc(NC[C@H](O)c2cccc(Cl)c2)cc(OC)c1C(C)C	ZINC000819465960	EJ	On-Demand	Anodyne	ADRB3	55	49
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)cc(OC)c1C(C)C	ZINC000819465961	EJ	On-Demand	Anodyne	ADRB2	21	49
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)cc(OC)c1C(C)C	ZINC000819465961	EJ	On-Demand	Anodyne	ADRB1	35	49
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)cc(OC)c1C(C)C	ZINC000819465961	EJ	On-Demand	Anodyne	ADRB3	55	49
COc1cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1C(C)C	ZINC000819465970	FH	On-Demand	Bother	CACNA1D	59	35
COc1cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1C(C)C	ZINC000819465971	FH	On-Demand	Bother	CACNA1D	59	35
COc1cc(NC[C@@H](O)c2cccnc2)cc(OC)c1Br	ZINC000819465978	FG	On-Demand	Anodyne	ADRB1	24	46
COc1cc(NC[C@@H](O)c2cccnc2)cc(OC)c1Br	ZINC000819465978	FG	On-Demand	Anodyne	ADRB3	80	46
COc1cc(NC[C@H](O)c2cccnc2)cc(OC)c1Br	ZINC000819465979	FG	On-Demand	Anodyne	ADRB1	24	46
COc1cc(NC[C@H](O)c2cccnc2)cc(OC)c1Br	ZINC000819465979	FG	On-Demand	Anodyne	ADRB3	80	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc(CNC(N)=O)cc2)CC1	ZINC000819465981	GE	On-Demand	Anodyne	GPR119	47	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc(CNC(N)=O)cc2)CC1	ZINC000819465982	GE	On-Demand	Anodyne	GPR119	47	49
O[C@@H](CNc1cc(F)c(N2CCCCC2)c(F)c1)c1cccnc1	ZINC000819466002	EG	On-Demand	Anodyne	ADRB3	83	45
O[C@H](CNc1cc(F)c(N2CCCCC2)c(F)c1)c1cccnc1	ZINC000819466003	EG	On-Demand	Anodyne	ADRB3	83	45
CC(=O)N1CCN(Cc2ccc(NC[C@@H](O)c3cc4ccccc4o3)cc2)CC1	ZINC000819466017	GG	On-Demand	Anodyne	SIGMAR1	23	43
CSc1ccc(C)c(NC[C@H](O)c2cccnc2)c1	ZINC000819466031	CG	On-Demand	Anodyne	ADRB1	20	41
CSc1ccc(C)c(NC[C@H](O)c2cccnc2)c1	ZINC000819466031	CG	On-Demand	Anodyne	ADRB3	74	42
CSc1ccc(C)c(NC[C@@H](O)c2cccnc2)c1	ZINC000819466032	CG	On-Demand	Anodyne	ADRB1	20	41
CSc1ccc(C)c(NC[C@@H](O)c2cccnc2)c1	ZINC000819466032	CG	On-Demand	Anodyne	ADRB3	74	42
CN1CCN(C)c2cc(NC[C@@H](O)c3cccnc3)ccc2C1	ZINC000819466066	DE	On-Demand	Anodyne	ADRB3	72	48
CN1CCN(C)c2cc(NC[C@H](O)c3cccnc3)ccc2C1	ZINC000819466067	DE	On-Demand	Anodyne	ADRB3	72	48
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(F)cc1OCC(F)F	ZINC000819466088	GG	On-Demand	Bother	ADRB1	47	37
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(F)cc1OCC(F)F	ZINC000819466089	GG	On-Demand	Bother	ADRB1	47	37
CCn1c(NC(=O)/C=C/[C@H]2CCCO2)nc2cc(C)ccc21	ZINC000819466094	CG	On-Demand	Anodyne	ITK	45	41
CCn1c(NC(=O)/C=C\[C@H]2CCCO2)nc2cc(C)ccc21	ZINC000819466095	CG	On-Demand	Anodyne	ITK	45	41
CCn1c(NC(=O)/C=C\[C@@H]2CCCO2)nc2cc(C)ccc21	ZINC000819466096	CG	On-Demand	Anodyne	ITK	45	41
CCn1c(NC(=O)/C=C/[C@@H]2CCCO2)nc2cc(C)ccc21	ZINC000819466097	CG	On-Demand	Anodyne	ITK	45	41
N#CCc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC(F)F)cc1	ZINC000819466098	GG	On-Demand	Mild	ADRB1	44	38
N#CCc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC(F)F)cc1	ZINC000819466099	GG	On-Demand	Mild	ADRB1	44	38
O[C@H](CNc1ccc(F)cc1OCC(F)F)COc1cccc2[nH]ccc12	ZINC000819466104	GH	On-Demand	Anodyne	ADRB2	15	57
O[C@H](CNc1ccc(F)cc1OCC(F)F)COc1cccc2[nH]ccc12	ZINC000819466104	GH	On-Demand	Anodyne	ADRB1	29	57
O[C@@H](CNc1ccc(F)cc1OCC(F)F)COc1cccc2[nH]ccc12	ZINC000819466105	GH	On-Demand	Anodyne	ADRB2	15	57
O[C@@H](CNc1ccc(F)cc1OCC(F)F)COc1cccc2[nH]ccc12	ZINC000819466105	GH	On-Demand	Anodyne	ADRB1	29	57
O[C@H](CNc1ccc(F)cc1OCC(F)F)c1cccnc1	ZINC000819466138	DG	On-Demand	Anodyne	ADRB1	17	41
O[C@H](CNc1ccc(F)cc1OCC(F)F)c1cccnc1	ZINC000819466138	DG	On-Demand	Anodyne	ADRB3	52	41
O[C@@H](CNc1ccc(F)cc1OCC(F)F)c1cccnc1	ZINC000819466139	DG	On-Demand	Anodyne	ADRB1	17	41
O[C@@H](CNc1ccc(F)cc1OCC(F)F)c1cccnc1	ZINC000819466139	DG	On-Demand	Anodyne	ADRB3	52	41
CON(C)C(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466155	GF	On-Demand	Anodyne	HTR1A	81	52
CON(C)C(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466155	GF	On-Demand	Anodyne	DRD2	62	50
CON(C)C(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466155	GF	On-Demand	Anodyne	DRD4	47	37
CON(C)C(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466155	GF	On-Demand	Anodyne	HTR1D	32	40
CON(C)C(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466155	GF	On-Demand	Anodyne	HTR1B	27	40
CON(C)C(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466155	GF	On-Demand	Anodyne	HTR2A	54	50
CON(C)C(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466155	GF	On-Demand	Anodyne	HTR2C	27	40
CON(C)C(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466155	GF	On-Demand	Anodyne	DRD3	70	44
CON(C)C(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466155	GF	On-Demand	Anodyne	SLC6A3	21	50
CON(C)C(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466155	GF	On-Demand	Anodyne	HTR7	76	52
CON(C)C(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466155	GF	On-Demand	Anodyne	SIGMAR1	30	50
CON(C)C(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466155	GF	On-Demand	Anodyne	ABCB1	29	40
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCC(N(C)C)CC3)cc2)cc1	ZINC000819466206	GG	On-Demand	Anodyne	ADRB2	29	45
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCC(N(C)C)CC3)cc2)cc1	ZINC000819466206	GG	On-Demand	Anodyne	ADRB1	43	47
Cc1ccc(OC[C@H](O)CNc2ccc(N3CCC(N(C)C)CC3)cc2)cc1	ZINC000819466206	GG	On-Demand	Anodyne	ADRB3	26	40
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(N(C)C)CC3)cc2)cc1	ZINC000819466207	GG	On-Demand	Anodyne	ADRB2	29	45
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(N(C)C)CC3)cc2)cc1	ZINC000819466207	GG	On-Demand	Anodyne	ADRB1	43	47
Cc1ccc(OC[C@@H](O)CNc2ccc(N3CCC(N(C)C)CC3)cc2)cc1	ZINC000819466207	GG	On-Demand	Anodyne	ADRB3	26	40
O[C@H](CNc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C1CC1	ZINC000819466219	FG	On-Demand	Anodyne	HTR1A	46	52
O[C@H](CNc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C1CC1	ZINC000819466219	FG	On-Demand	Anodyne	DRD2	34	53
O[C@H](CNc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C1CC1	ZINC000819466219	FG	On-Demand	Anodyne	HTR2A	38	53
O[C@H](CNc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C1CC1	ZINC000819466219	FG	On-Demand	Anodyne	DRD3	29	41
O[C@H](CNc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C1CC1	ZINC000819466219	FG	On-Demand	Anodyne	SLC6A3	22	53
O[C@H](CNc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C1CC1	ZINC000819466219	FG	On-Demand	Anodyne	HTR7	40	49
O[C@H](CNc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C1CC1	ZINC000819466219	FG	On-Demand	Anodyne	SIGMAR1	28	53
O[C@@H](CNc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C1CC1	ZINC000819466220	FG	On-Demand	Anodyne	HTR1A	46	52
O[C@@H](CNc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C1CC1	ZINC000819466220	FG	On-Demand	Anodyne	DRD2	34	53
O[C@@H](CNc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C1CC1	ZINC000819466220	FG	On-Demand	Anodyne	HTR2A	38	53
O[C@@H](CNc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C1CC1	ZINC000819466220	FG	On-Demand	Anodyne	DRD3	29	41
O[C@@H](CNc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C1CC1	ZINC000819466220	FG	On-Demand	Anodyne	SLC6A3	22	53
O[C@@H](CNc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C1CC1	ZINC000819466220	FG	On-Demand	Anodyne	HTR7	40	49
O[C@@H](CNc1cccc(N2CCN(CCc3ccccc3)CC2)c1)C1CC1	ZINC000819466220	FG	On-Demand	Anodyne	SIGMAR1	28	53
CO[C@@H]1[C@H](C)[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1(C)C	ZINC000819466224	FF	On-Demand	Mild	PAPA1_CARPA	38	47
CO[C@@H]1[C@H](C)[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1(C)C	ZINC000819466225	FF	On-Demand	Mild	PAPA1_CARPA	38	47
CO[C@@H]1[C@H](C)[C@@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1(C)C	ZINC000819466226	FF	On-Demand	Mild	PAPA1_CARPA	38	47
CO[C@@H]1[C@H](C)[C@@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1(C)C	ZINC000819466227	FF	On-Demand	Mild	PAPA1_CARPA	38	47
CC(C)c1ccc(N2Cc3ccc(NC[C@H](O)c4cccnc4)cc3C2)cc1	ZINC000819466249	FJ	On-Demand	Anodyne	ADRB3	68	44
CC(C)c1ccc(N2Cc3ccc(NC[C@@H](O)c4cccnc4)cc3C2)cc1	ZINC000819466250	FJ	On-Demand	Anodyne	ADRB3	68	44
COCCNC(=O)c1ccccc1NC(=O)c1cc(C)on1	ZINC000819466292	DD	On-Demand	Anodyne	POLR1A	40	36
N#Cc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCC(F)F)cc1	ZINC000819466305	FG	On-Demand	Mild	ADRB1	56	38
N#Cc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCC(F)F)cc1	ZINC000819466306	FG	On-Demand	Mild	ADRB1	56	38
O[C@@H](CNc1ccc(C2CC2)cc1)c1cccnc1	ZINC000819466316	CG	On-Demand	Anodyne	ADRB2	23	40
O[C@@H](CNc1ccc(C2CC2)cc1)c1cccnc1	ZINC000819466316	CG	On-Demand	Anodyne	ADRB1	23	40
O[C@@H](CNc1ccc(C2CC2)cc1)c1cccnc1	ZINC000819466316	CG	On-Demand	Anodyne	ADRB3	90	49
O[C@H](CNc1ccc(C2CC2)cc1)c1cccnc1	ZINC000819466317	CG	On-Demand	Anodyne	ADRB2	23	40
O[C@H](CNc1ccc(C2CC2)cc1)c1cccnc1	ZINC000819466317	CG	On-Demand	Anodyne	ADRB1	23	40
O[C@H](CNc1ccc(C2CC2)cc1)c1cccnc1	ZINC000819466317	CG	On-Demand	Anodyne	ADRB3	90	49
CSc1ccc(C)c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819466333	GI	On-Demand	Mild	PAPA1_CARPA	44	46
CSc1ccc(C)c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819466334	GI	On-Demand	Mild	PAPA1_CARPA	44	46
Cc1c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cccc1N(C)C	ZINC000819466335	FH	On-Demand	Mild	PAPA1_CARPA	45	44
Cc1c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cccc1N(C)C	ZINC000819466336	FH	On-Demand	Mild	PAPA1_CARPA	45	44
O[C@@H](CNc1ccc(F)cc1OCC(F)F)CN1CCc2ccccc2C1	ZINC000819466342	GG	On-Demand	Anodyne	CCR1	36	42
O[C@H](CNc1ccc(F)cc1OCC(F)F)CN1CCc2ccccc2C1	ZINC000819466343	GG	On-Demand	Anodyne	CCR1	36	42
C#CCNC(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466347	GF	On-Demand	Mild	HTR1A	71	53
C#CCNC(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466347	GF	On-Demand	Mild	DRD2	57	50
C#CCNC(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466347	GF	On-Demand	Mild	DRD4	43	33
C#CCNC(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466347	GF	On-Demand	Mild	HTR1D	29	40
C#CCNC(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466347	GF	On-Demand	Mild	HTR1B	26	40
C#CCNC(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466347	GF	On-Demand	Mild	HTR2A	55	50
C#CCNC(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466347	GF	On-Demand	Mild	DRD3	69	44
C#CCNC(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466347	GF	On-Demand	Mild	HTR7	79	49
C#CCNC(=O)CCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000819466347	GF	On-Demand	Mild	SIGMAR1	21	50
COc1cccc([S@@](=O)CC(=O)NCCCCCCO)c1	ZINC000819466363	DD	On-Demand	Anodyne	DRD4	41	31
COc1cccc([S@@](=O)CC(=O)NCCCCCCO)c1	ZINC000819466363	DD	On-Demand	Anodyne	MTNR1A	77	48
COc1cccc([S@@](=O)CC(=O)NCCCCCCO)c1	ZINC000819466363	DD	On-Demand	Anodyne	MTNR1B	72	48
CC[C@@H](C)n1nc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819466369	GH	On-Demand	Mild	PAPA1_CARPA	40	47
CC[C@@H](C)n1nc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1C	ZINC000819466370	GH	On-Demand	Mild	PAPA1_CARPA	40	47
COCCNC(=O)c1ccccc1NC(=O)CN1C(=O)N[C@](C)(c2ccc3ccccc3c2)C1=O	ZINC000819466400	JF	On-Demand	Anodyne	POLR1A	68	39
COCCNC(=O)c1ccccc1NC(=O)CN1C(=O)N[C@@](C)(c2ccc3ccccc3c2)C1=O	ZINC000819466401	JF	On-Demand	Anodyne	POLR1A	68	39
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(F)cc2OCC(F)F)c1	ZINC000819466456	GG	On-Demand	Bother	ADRB2	15	40
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(F)cc2OCC(F)F)c1	ZINC000819466456	GG	On-Demand	Bother	ADRB1	44	42
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(F)cc2OCC(F)F)c1	ZINC000819466457	GG	On-Demand	Bother	ADRB2	15	40
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(F)cc2OCC(F)F)c1	ZINC000819466457	GG	On-Demand	Bother	ADRB1	44	42
COCCNC(=O)c1ccccc1NC(=O)CCS(=O)(=O)c1ccc(F)cc1	ZINC000819466468	HE	On-Demand	Anodyne	PRTN3	48	40
CCn1c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nc2cc(C)ccc21	ZINC000819466475	GH	On-Demand	Mild	PAPA1_CARPA	37	40
CCn1c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)nc2cc(C)ccc21	ZINC000819466476	GH	On-Demand	Mild	PAPA1_CARPA	37	40
COCCNC(=O)c1ccccc1NC(=O)CCSC	ZINC000819466507	CD	On-Demand	Anodyne	FAS	33	42
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccc(C3CC3)cc2)c1	ZINC000819466515	CH	On-Demand	Bother	CACNA1D	44	33
O=[N+]([O-])c1cccc([C@H](O)CNc2ccc(C3CC3)cc2)c1	ZINC000819466516	CH	On-Demand	Bother	CACNA1D	44	33
O[C@H](CNc1ccc(F)cc1OCC(F)F)COc1ccccc1F	ZINC000819466528	FG	On-Demand	Anodyne	ADRB2	20	41
O[C@H](CNc1ccc(F)cc1OCC(F)F)COc1ccccc1F	ZINC000819466528	FG	On-Demand	Anodyne	ADRB1	56	39
O[C@@H](CNc1ccc(F)cc1OCC(F)F)COc1ccccc1F	ZINC000819466529	FG	On-Demand	Anodyne	ADRB2	20	41
O[C@@H](CNc1ccc(F)cc1OCC(F)F)COc1ccccc1F	ZINC000819466529	FG	On-Demand	Anodyne	ADRB1	56	39
O[C@H](CNc1ccc(COc2ccccc2)cc1)C1CC1	ZINC000819466551	CG	On-Demand	Anodyne	ADRB1	30	41
O[C@H](CNc1ccc(COc2ccccc2)cc1)C1CC1	ZINC000819466551	CG	On-Demand	Anodyne	ADRB3	21	41
O[C@H](CNc1ccc(COc2ccccc2)cc1)C1CC1	ZINC000819466551	CG	On-Demand	Anodyne	LTA4H	22	41
O[C@@H](CNc1ccc(COc2ccccc2)cc1)C1CC1	ZINC000819466552	CG	On-Demand	Anodyne	ADRB1	30	41
O[C@@H](CNc1ccc(COc2ccccc2)cc1)C1CC1	ZINC000819466552	CG	On-Demand	Anodyne	ADRB3	21	41
O[C@@H](CNc1ccc(COc2ccccc2)cc1)C1CC1	ZINC000819466552	CG	On-Demand	Anodyne	LTA4H	22	41
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2ccc(C3CC3)cc2)CC1	ZINC000819466570	FI	On-Demand	Anodyne	GPR119	41	47
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2ccc(C3CC3)cc2)CC1	ZINC000819466571	FI	On-Demand	Anodyne	GPR119	41	47
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc(C3CC3)cc2)CC1	ZINC000819466577	FH	On-Demand	Anodyne	GPR119	53	51
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc(C3CC3)cc2)CC1	ZINC000819466578	FH	On-Demand	Anodyne	GPR119	53	51
Cc1ccc(OC[C@@H](O)CNc2cccc3c2CCN(CC(C)(C)O)C3)cc1	ZINC000819466607	GF	On-Demand	Anodyne	ADRB2	20	41
Cc1ccc(OC[C@@H](O)CNc2cccc3c2CCN(CC(C)(C)O)C3)cc1	ZINC000819466607	GF	On-Demand	Anodyne	ACOX1	52	34
Cc1ccc(OC[C@H](O)CNc2cccc3c2CCN(CC(C)(C)O)C3)cc1	ZINC000819466608	GF	On-Demand	Anodyne	ADRB2	20	41
Cc1ccc(OC[C@H](O)CNc2cccc3c2CCN(CC(C)(C)O)C3)cc1	ZINC000819466608	GF	On-Demand	Anodyne	ACOX1	52	34
CCC(C)(C)OCc1ccccc1NC[C@H](O)c1ccc(C#N)cc1	ZINC000819466615	EI	On-Demand	Mild	CTRB_BOVIN	44	32
CCC(C)(C)OCc1ccccc1NC[C@@H](O)c1ccc(C#N)cc1	ZINC000819466616	EI	On-Demand	Mild	CTRB_BOVIN	44	32
COCCOc1ccc(C#N)cc1NC[C@H](O)[C@H](C)c1ccccc1	ZINC000819466618	EG	On-Demand	Mild	CTRB_BOVIN	43	32
COCCOc1ccc(C#N)cc1NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000819466619	EG	On-Demand	Mild	CTRB_BOVIN	43	32
COCCOc1ccc(C#N)cc1NC[C@@H](O)[C@@H](C)c1ccccc1	ZINC000819466620	EG	On-Demand	Mild	CTRB_BOVIN	43	32
COCCOc1ccc(C#N)cc1NC[C@H](O)[C@@H](C)c1ccccc1	ZINC000819466621	EG	On-Demand	Mild	CTRB_BOVIN	43	32
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccccc3F)cc2C1	ZINC000819466630	EF	On-Demand	Anodyne	ADRB2	24	40
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccccc3F)cc2C1	ZINC000819466630	EF	On-Demand	Anodyne	ADRB1	52	35
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3F)cc2C1	ZINC000819466631	EF	On-Demand	Anodyne	ADRB2	24	40
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3F)cc2C1	ZINC000819466631	EF	On-Demand	Anodyne	ADRB1	52	35
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccccc3F)cc2C1	ZINC000819466632	EF	On-Demand	Anodyne	ADRB2	24	40
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccccc3F)cc2C1	ZINC000819466632	EF	On-Demand	Anodyne	ADRB1	52	35
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3F)cc2C1	ZINC000819466633	EF	On-Demand	Anodyne	ADRB2	24	40
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3F)cc2C1	ZINC000819466633	EF	On-Demand	Anodyne	ADRB1	52	35
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc4ccccc4c3)cc2C1	ZINC000819466635	FH	On-Demand	Anodyne	ADRB2	38	54
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc4ccccc4c3)cc2C1	ZINC000819466635	FH	On-Demand	Anodyne	ADRB1	49	37
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc4ccccc4c3)cc2C1	ZINC000819466636	FH	On-Demand	Anodyne	ADRB2	38	54
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc4ccccc4c3)cc2C1	ZINC000819466636	FH	On-Demand	Anodyne	ADRB1	49	37
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc4ccccc4c3)cc2C1	ZINC000819466637	FH	On-Demand	Anodyne	ADRB2	38	54
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc4ccccc4c3)cc2C1	ZINC000819466637	FH	On-Demand	Anodyne	ADRB1	49	37
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc4ccccc4c3)cc2C1	ZINC000819466638	FH	On-Demand	Anodyne	ADRB2	38	54
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc4ccccc4c3)cc2C1	ZINC000819466638	FH	On-Demand	Anodyne	ADRB1	49	37
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1cc(C)ccc1C	ZINC000819466642	FG	On-Demand	Mild	ADRB2	15	43
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1cc(C)ccc1C	ZINC000819466642	FG	On-Demand	Mild	ADRB1	47	32
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1cc(C)ccc1C	ZINC000819466643	FG	On-Demand	Mild	ADRB2	15	43
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1cc(C)ccc1C	ZINC000819466643	FG	On-Demand	Mild	ADRB1	47	32
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(CCC(C)=O)cc3)cc2C1	ZINC000819466650	GG	On-Demand	Anodyne	ADRB2	43	45
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(CCC(C)=O)cc3)cc2C1	ZINC000819466650	GG	On-Demand	Anodyne	ADRB1	74	48
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(CCC(C)=O)cc3)cc2C1	ZINC000819466650	GG	On-Demand	Anodyne	GRIN1	28	41
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(CCC(C)=O)cc3)cc2C1	ZINC000819466650	GG	On-Demand	Anodyne	ADRB3	51	45
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(CCC(C)=O)cc3)cc2C1	ZINC000819466651	GG	On-Demand	Anodyne	ADRB2	43	45
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(CCC(C)=O)cc3)cc2C1	ZINC000819466651	GG	On-Demand	Anodyne	ADRB1	74	48
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(CCC(C)=O)cc3)cc2C1	ZINC000819466651	GG	On-Demand	Anodyne	GRIN1	28	41
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(CCC(C)=O)cc3)cc2C1	ZINC000819466651	GG	On-Demand	Anodyne	ADRB3	51	45
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(CCC(C)=O)cc3)cc2C1	ZINC000819466652	GG	On-Demand	Anodyne	ADRB2	43	45
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(CCC(C)=O)cc3)cc2C1	ZINC000819466652	GG	On-Demand	Anodyne	ADRB1	74	48
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(CCC(C)=O)cc3)cc2C1	ZINC000819466652	GG	On-Demand	Anodyne	GRIN1	28	41
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(CCC(C)=O)cc3)cc2C1	ZINC000819466652	GG	On-Demand	Anodyne	ADRB3	51	45
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(CCC(C)=O)cc3)cc2C1	ZINC000819466653	GG	On-Demand	Anodyne	ADRB2	43	45
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(CCC(C)=O)cc3)cc2C1	ZINC000819466653	GG	On-Demand	Anodyne	ADRB1	74	48
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(CCC(C)=O)cc3)cc2C1	ZINC000819466653	GG	On-Demand	Anodyne	GRIN1	28	41
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(CCC(C)=O)cc3)cc2C1	ZINC000819466653	GG	On-Demand	Anodyne	ADRB3	51	45
C[C@@H]1CCCC[C@H]1C(=O)N1CC[C@](O)(c2ccc(F)cc2)C1	ZINC000819466666	DG	On-Demand	Anodyne	CTSK	16	44
C[C@@H]1CCCC[C@H]1C(=O)N1CC[C@@](O)(c2ccc(F)cc2)C1	ZINC000819466667	DG	On-Demand	Anodyne	CTSK	16	44
C[C@@H]1CCCC[C@@H]1C(=O)N1CC[C@](O)(c2ccc(F)cc2)C1	ZINC000819466668	DG	On-Demand	Anodyne	CTSK	16	44
C[C@@H]1CCCC[C@@H]1C(=O)N1CC[C@@](O)(c2ccc(F)cc2)C1	ZINC000819466669	DG	On-Demand	Anodyne	CTSK	16	44
CC(=O)c1ccc(O)c(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819466675	GG	On-Demand	Mild	PAPA1_CARPA	43	43
CC(=O)c1ccc(O)c(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1	ZINC000819466676	GG	On-Demand	Mild	PAPA1_CARPA	43	43
CC(=O)c1cccc(OC[C@@H](O)CNc2cc(F)c(OC(C)(C)C)c(F)c2)c1	ZINC000819466691	GI	On-Demand	Anodyne	ADRB2	22	43
CC(=O)c1cccc(OC[C@@H](O)CNc2cc(F)c(OC(C)(C)C)c(F)c2)c1	ZINC000819466691	GI	On-Demand	Anodyne	ADRB1	35	40
CC(=O)c1cccc(OC[C@@H](O)CNc2cc(F)c(OC(C)(C)C)c(F)c2)c1	ZINC000819466691	GI	On-Demand	Anodyne	PDS	60	35
CC(=O)c1cccc(OC[C@H](O)CNc2cc(F)c(OC(C)(C)C)c(F)c2)c1	ZINC000819466693	GI	On-Demand	Anodyne	ADRB2	22	43
CC(=O)c1cccc(OC[C@H](O)CNc2cc(F)c(OC(C)(C)C)c(F)c2)c1	ZINC000819466693	GI	On-Demand	Anodyne	ADRB1	35	40
CC(=O)c1cccc(OC[C@H](O)CNc2cc(F)c(OC(C)(C)C)c(F)c2)c1	ZINC000819466693	GI	On-Demand	Anodyne	PDS	60	35
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OC)c(S(=O)(=O)N(C)C)c1	ZINC000819466695	ID	On-Demand	Anodyne	CPT1A	66	39
COCCNC(=O)c1ccccc1NC(=O)c1ccc(OC)c(S(=O)(=O)N(C)C)c1	ZINC000819466695	ID	On-Demand	Anodyne	CPT1B	69	35
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819466707	GH	On-Demand	Anodyne	ADRB2	36	59
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819466707	GH	On-Demand	Anodyne	ADRB1	68	59
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819466707	GH	On-Demand	Anodyne	GRIN1	24	42
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819466707	GH	On-Demand	Anodyne	ADRB3	39	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819466708	GH	On-Demand	Anodyne	ADRB2	36	59
CC(=O)Nc1ccc(OC[C@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819466708	GH	On-Demand	Anodyne	ADRB1	68	59
CC(=O)Nc1ccc(OC[C@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819466708	GH	On-Demand	Anodyne	GRIN1	24	42
CC(=O)Nc1ccc(OC[C@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819466708	GH	On-Demand	Anodyne	ADRB3	39	48
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)C[C@H](OC)C3)cc1	ZINC000819466728	FE	On-Demand	Anodyne	ADRB2	39	44
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)C[C@H](OC)C3)cc1	ZINC000819466728	FE	On-Demand	Anodyne	ADRB1	72	44
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)C[C@H](OC)C3)cc1	ZINC000819466728	FE	On-Demand	Anodyne	ADRB3	49	44
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)C[C@H](OC)C3)cc1	ZINC000819466728	FE	On-Demand	Anodyne	ACR	46	35
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)C[C@@H](OC)C3)cc1	ZINC000819466729	FE	On-Demand	Anodyne	ADRB2	39	44
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)C[C@@H](OC)C3)cc1	ZINC000819466729	FE	On-Demand	Anodyne	ADRB1	72	44
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)C[C@@H](OC)C3)cc1	ZINC000819466729	FE	On-Demand	Anodyne	ADRB3	49	44
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)C[C@@H](OC)C3)cc1	ZINC000819466729	FE	On-Demand	Anodyne	ACR	46	35
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)C[C@@H](OC)C3)cc1	ZINC000819466730	FE	On-Demand	Anodyne	ADRB2	39	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)C[C@@H](OC)C3)cc1	ZINC000819466730	FE	On-Demand	Anodyne	ADRB1	72	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)C[C@@H](OC)C3)cc1	ZINC000819466730	FE	On-Demand	Anodyne	ADRB3	49	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)C[C@@H](OC)C3)cc1	ZINC000819466730	FE	On-Demand	Anodyne	ACR	46	35
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)C[C@H](OC)C3)cc1	ZINC000819466731	FE	On-Demand	Anodyne	ADRB2	39	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)C[C@H](OC)C3)cc1	ZINC000819466731	FE	On-Demand	Anodyne	ADRB1	72	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)C[C@H](OC)C3)cc1	ZINC000819466731	FE	On-Demand	Anodyne	ADRB3	49	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)C[C@H](OC)C3)cc1	ZINC000819466731	FE	On-Demand	Anodyne	ACR	46	35
CCOc1ccc(OC[C@@H](O)CNc2ccc(NC(=O)OC)c(F)c2)cc1	ZINC000819466739	GG	On-Demand	Anodyne	ADRB2	35	44
CCOc1ccc(OC[C@@H](O)CNc2ccc(NC(=O)OC)c(F)c2)cc1	ZINC000819466739	GG	On-Demand	Anodyne	ADRB1	60	44
CCOc1ccc(OC[C@@H](O)CNc2ccc(NC(=O)OC)c(F)c2)cc1	ZINC000819466739	GG	On-Demand	Anodyne	ADRB3	36	40
CCOc1ccc(OC[C@@H](O)CNc2ccc(NC(=O)OC)c(F)c2)cc1	ZINC000819466739	GG	On-Demand	Anodyne	PDS	44	33
CCOc1ccc(OC[C@H](O)CNc2ccc(NC(=O)OC)c(F)c2)cc1	ZINC000819466740	GG	On-Demand	Anodyne	ADRB2	35	44
CCOc1ccc(OC[C@H](O)CNc2ccc(NC(=O)OC)c(F)c2)cc1	ZINC000819466740	GG	On-Demand	Anodyne	ADRB1	60	44
CCOc1ccc(OC[C@H](O)CNc2ccc(NC(=O)OC)c(F)c2)cc1	ZINC000819466740	GG	On-Demand	Anodyne	ADRB3	36	40
CCOc1ccc(OC[C@H](O)CNc2ccc(NC(=O)OC)c(F)c2)cc1	ZINC000819466740	GG	On-Demand	Anodyne	PDS	44	33
CC(=O)c1cccc(OC[C@@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)c1	ZINC000819466741	GH	On-Demand	Anodyne	ADRB2	21	45
CC(=O)c1cccc(OC[C@@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)c1	ZINC000819466741	GH	On-Demand	Anodyne	ADRB1	38	41
CC(=O)c1cccc(OC[C@@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)c1	ZINC000819466741	GH	On-Demand	Anodyne	PDS	53	35
CC(=O)c1cccc(OC[C@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)c1	ZINC000819466742	GH	On-Demand	Anodyne	ADRB2	21	45
CC(=O)c1cccc(OC[C@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)c1	ZINC000819466742	GH	On-Demand	Anodyne	ADRB1	38	41
CC(=O)c1cccc(OC[C@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)c1	ZINC000819466742	GH	On-Demand	Anodyne	PDS	53	35
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cc(C)ccc3C)cc2C1	ZINC000819466744	EG	On-Demand	Anodyne	ADRB2	19	44
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cc(C)ccc3C)cc2C1	ZINC000819466745	EG	On-Demand	Anodyne	ADRB2	19	44
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cc(C)ccc3C)cc2C1	ZINC000819466746	EG	On-Demand	Anodyne	ADRB2	19	44
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cc(C)ccc3C)cc2C1	ZINC000819466747	EG	On-Demand	Anodyne	ADRB2	19	44
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@H](O)C2CC2)cc1	ZINC000819466784	EF	On-Demand	Anodyne	ADRB1	24	43
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@@H](O)C2CC2)cc1	ZINC000819466785	EF	On-Demand	Anodyne	ADRB1	24	43
CC(C)(O)CN1CCc2c(cccc2NCCS(=O)(=O)c2ccccc2)C1	ZINC000819466807	GF	On-Demand	Anodyne	AKR1C3	44	37
COc1cc(C)c(Br)cc1NC[C@H](O)c1cccnc1	ZINC000819466820	EG	On-Demand	Anodyne	ADRB1	18	44
COc1cc(C)c(Br)cc1NC[C@H](O)c1cccnc1	ZINC000819466820	EG	On-Demand	Anodyne	ADRB3	45	44
COc1cc(C)c(Br)cc1NC[C@@H](O)c1cccnc1	ZINC000819466821	EG	On-Demand	Anodyne	ADRB1	18	44
COc1cc(C)c(Br)cc1NC[C@@H](O)c1cccnc1	ZINC000819466821	EG	On-Demand	Anodyne	ADRB3	45	44
COCCOc1ccc(C#N)cc1NC[C@@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000819466826	GH	On-Demand	Mild	PPARD	27	41
COCCOc1ccc(C#N)cc1NC[C@@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000819466826	GH	On-Demand	Mild	CTRB_BOVIN	45	31
COCCOc1ccc(C#N)cc1NC[C@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000819466827	GH	On-Demand	Mild	PPARD	27	41
COCCOc1ccc(C#N)cc1NC[C@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000819466827	GH	On-Demand	Mild	CTRB_BOVIN	45	31
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000819466829	FG	On-Demand	Mild	ADRB2	17	44
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1cc(C)cc(C)c1	ZINC000819466830	FG	On-Demand	Mild	ADRB2	17	44
Cc1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819466864	DF	On-Demand	Anodyne	ADRB2	24	51
Cc1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819466866	DF	On-Demand	Anodyne	ADRB2	24	51
COCCNC(=O)c1ccccc1NC(=O)c1cc(S(=O)(=O)N2CCCC[C@H]2C)ccc1C	ZINC000819466876	JG	On-Demand	Anodyne	CASP3	48	36
COCCNC(=O)c1ccccc1NC(=O)c1cc(S(=O)(=O)N2CCCC[C@H]2C)ccc1C	ZINC000819466876	JG	On-Demand	Anodyne	PRTN3	46	38
COCCNC(=O)c1ccccc1NC(=O)c1cc(S(=O)(=O)N2CCCC[C@H]2C)ccc1C	ZINC000819466876	JG	On-Demand	Anodyne	CASP7	60	38
COCCNC(=O)c1ccccc1NC(=O)c1cc(S(=O)(=O)N2CCCC[C@H]2C)ccc1C	ZINC000819466876	JG	On-Demand	Anodyne	CCR8	65	36
COCCNC(=O)c1ccccc1NC(=O)c1cc(S(=O)(=O)N2CCCC[C@@H]2C)ccc1C	ZINC000819466878	JG	On-Demand	Anodyne	CASP3	48	36
COCCNC(=O)c1ccccc1NC(=O)c1cc(S(=O)(=O)N2CCCC[C@@H]2C)ccc1C	ZINC000819466878	JG	On-Demand	Anodyne	PRTN3	46	38
COCCNC(=O)c1ccccc1NC(=O)c1cc(S(=O)(=O)N2CCCC[C@@H]2C)ccc1C	ZINC000819466878	JG	On-Demand	Anodyne	CASP7	60	38
COCCNC(=O)c1ccccc1NC(=O)c1cc(S(=O)(=O)N2CCCC[C@@H]2C)ccc1C	ZINC000819466878	JG	On-Demand	Anodyne	CCR8	65	36
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819466884	FF	On-Demand	Mild	ADRB2	48	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819466884	FF	On-Demand	Mild	ADRB1	75	40
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819466884	FF	On-Demand	Mild	ADRB3	37	43
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819466884	FF	On-Demand	Mild	CASR	40	37
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819466884	FF	On-Demand	Mild	CYP2D6	19	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819466884	FF	On-Demand	Mild	ABCB1	22	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819466887	FF	On-Demand	Mild	ADRB2	48	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819466887	FF	On-Demand	Mild	ADRB1	75	40
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819466887	FF	On-Demand	Mild	ADRB3	37	43
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819466887	FF	On-Demand	Mild	CASR	40	37
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819466887	FF	On-Demand	Mild	CYP2D6	19	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819466887	FF	On-Demand	Mild	ABCB1	22	41
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819466890	FF	On-Demand	Mild	ADRB2	48	44
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819466890	FF	On-Demand	Mild	ADRB1	75	40
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819466890	FF	On-Demand	Mild	ADRB3	37	43
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819466890	FF	On-Demand	Mild	CASR	40	37
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819466890	FF	On-Demand	Mild	CYP2D6	19	41
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819466890	FF	On-Demand	Mild	ABCB1	22	41
Cc1nc(CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)no1	ZINC000819466891	FD	On-Demand	Mild	PAPA1_CARPA	36	40
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819466893	FF	On-Demand	Mild	ADRB2	48	44
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819466893	FF	On-Demand	Mild	ADRB1	75	40
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819466893	FF	On-Demand	Mild	ADRB3	37	43
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819466893	FF	On-Demand	Mild	CASR	40	37
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819466893	FF	On-Demand	Mild	CYP2D6	19	41
COC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819466893	FF	On-Demand	Mild	ABCB1	22	41
Cc1nc(CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)no1	ZINC000819466894	FD	On-Demand	Mild	PAPA1_CARPA	36	40
Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)c(C)c1	ZINC000819466896	EG	On-Demand	Mild	ADRB2	27	46
Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)c(C)c1	ZINC000819466896	EG	On-Demand	Mild	ADRB1	59	40
Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)c(C)c1	ZINC000819466896	EG	On-Demand	Mild	CASR	42	37
Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)c(C)c1	ZINC000819466899	EG	On-Demand	Mild	ADRB2	27	46
Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)c(C)c1	ZINC000819466899	EG	On-Demand	Mild	ADRB1	59	40
Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)c(C)c1	ZINC000819466899	EG	On-Demand	Mild	CASR	42	37
Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)c(C)c1	ZINC000819466901	EG	On-Demand	Mild	ADRB2	27	46
Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)c(C)c1	ZINC000819466901	EG	On-Demand	Mild	ADRB1	59	40
Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)c(C)c1	ZINC000819466901	EG	On-Demand	Mild	CASR	42	37
Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)c(C)c1	ZINC000819466904	EG	On-Demand	Mild	ADRB2	27	46
Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)c(C)c1	ZINC000819466904	EG	On-Demand	Mild	ADRB1	59	40
Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)c(C)c1	ZINC000819466904	EG	On-Demand	Mild	CASR	42	37
Cc1cc2c(cc1NC[C@H](O)Cn1c(-c3ccccc3)noc1=O)OCO2	ZINC000819466929	FE	On-Demand	Anodyne	DYRK2	42	33
Cc1cc2c(cc1NC[C@@H](O)Cn1c(-c3ccccc3)noc1=O)OCO2	ZINC000819466932	FE	On-Demand	Anodyne	DYRK2	42	33
Cc1nc2cc(NCCC(N)=O)ccc2s1	ZINC000819466954	BD	On-Demand	Anodyne	ACOX1	53	36
Cc1nc2cc(NCCC(N)=O)ccc2s1	ZINC000819466954	BD	On-Demand	Anodyne	DRTS_TRYCR	46	33
Cc1nc2cc(NC[C@H](O)COc3ccc4c(c3)CCC(=O)N4)ccc2s1	ZINC000819466957	GG	On-Demand	Anodyne	ACOX1	114	49
Cc1nc2cc(NC[C@@H](O)COc3ccc4c(c3)CCC(=O)N4)ccc2s1	ZINC000819466959	GG	On-Demand	Anodyne	ACOX1	114	49
COCCOc1ccc(C#N)cc1NC[C@H](O)CCc1ccccc1	ZINC000819466964	EF	On-Demand	Mild	CTSG	19	44
COCCOc1ccc(C#N)cc1NC[C@H](O)CCc1ccccc1	ZINC000819466964	EF	On-Demand	Mild	CTRB1	18	44
COCCOc1ccc(C#N)cc1NC[C@H](O)CCc1ccccc1	ZINC000819466964	EF	On-Demand	Mild	CELA2A	17	44
COCCOc1ccc(C#N)cc1NC[C@H](O)CCc1ccccc1	ZINC000819466964	EF	On-Demand	Mild	CTRB_BOVIN	53	44
COCCOc1ccc(C#N)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819466966	EF	On-Demand	Mild	CTSG	19	44
COCCOc1ccc(C#N)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819466966	EF	On-Demand	Mild	CTRB1	18	44
COCCOc1ccc(C#N)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819466966	EF	On-Demand	Mild	CELA2A	17	44
COCCOc1ccc(C#N)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819466966	EF	On-Demand	Mild	CTRB_BOVIN	53	44
COCCNC(=O)c1ccccc1NC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1	ZINC000819466975	JF	On-Demand	Anodyne	CCR8	42	33
Cc1cc2c(cc1NC[C@H](O)COCc1ccccc1)OCO2	ZINC000819466976	DF	On-Demand	Anodyne	CASR	19	46
COCCNC(=O)c1ccccc1NC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1	ZINC000819466977	JF	On-Demand	Anodyne	CCR8	42	33
Cc1cc2c(cc1NC[C@@H](O)COCc1ccccc1)OCO2	ZINC000819466978	DF	On-Demand	Anodyne	CASR	19	46
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc2sc(C)nc2c1	ZINC000819466984	FG	On-Demand	Anodyne	ACOX1	100	42
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc2sc(C)nc2c1	ZINC000819466984	FG	On-Demand	Anodyne	DRTS_TRYCR	43	30
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cccc4ccccc34)cc2C1	ZINC000819466987	FH	On-Demand	Anodyne	ADRB2	31	53
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cccc4ccccc34)cc2C1	ZINC000819466987	FH	On-Demand	Anodyne	CYP2D6	23	46
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cccc4ccccc34)cc2C1	ZINC000819466988	FH	On-Demand	Anodyne	ADRB2	31	53
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cccc4ccccc34)cc2C1	ZINC000819466988	FH	On-Demand	Anodyne	CYP2D6	23	46
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cccc4ccccc34)cc2C1	ZINC000819466989	FH	On-Demand	Anodyne	ADRB2	31	53
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cccc4ccccc34)cc2C1	ZINC000819466989	FH	On-Demand	Anodyne	CYP2D6	23	46
COc1cccc(OC)c1OC[C@H](O)CNc1ccc2sc(C)nc2c1	ZINC000819466990	FG	On-Demand	Anodyne	ACOX1	100	42
COc1cccc(OC)c1OC[C@H](O)CNc1ccc2sc(C)nc2c1	ZINC000819466990	FG	On-Demand	Anodyne	DRTS_TRYCR	43	30
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cccc4ccccc34)cc2C1	ZINC000819466991	FH	On-Demand	Anodyne	ADRB2	31	53
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cccc4ccccc34)cc2C1	ZINC000819466991	FH	On-Demand	Anodyne	CYP2D6	23	46
COCCOc1ccc(C#N)cc1NC[C@H](O)c1cccnc1	ZINC000819466994	DE	On-Demand	Mild	ADRB1	16	40
COCCOc1ccc(C#N)cc1NC[C@H](O)c1cccnc1	ZINC000819466994	DE	On-Demand	Mild	ADRB3	40	40
CC[C@H](O)CNc1ccc2sc(C)nc2c1	ZINC000819466995	BF	On-Demand	Anodyne	ACOX1	91	39
COCCOc1ccc(C#N)cc1NC[C@@H](O)c1cccnc1	ZINC000819466996	DE	On-Demand	Mild	ADRB1	16	40
COCCOc1ccc(C#N)cc1NC[C@@H](O)c1cccnc1	ZINC000819466996	DE	On-Demand	Mild	ADRB3	40	40
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1Cl	ZINC000819466999	EG	On-Demand	Mild	ADRB2	26	47
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1Cl	ZINC000819466999	EG	On-Demand	Mild	ADRB1	60	38
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1Cl	ZINC000819466999	EG	On-Demand	Mild	CASR	42	44
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1Cl	ZINC000819466999	EG	On-Demand	Mild	CYP2D6	19	44
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1Cl	ZINC000819467000	EG	On-Demand	Mild	ADRB2	26	47
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1Cl	ZINC000819467000	EG	On-Demand	Mild	ADRB1	60	38
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1Cl	ZINC000819467000	EG	On-Demand	Mild	CASR	42	44
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1Cl	ZINC000819467000	EG	On-Demand	Mild	CYP2D6	19	44
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819467001	EG	On-Demand	Mild	ADRB2	26	47
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819467001	EG	On-Demand	Mild	ADRB1	60	38
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819467001	EG	On-Demand	Mild	CASR	42	44
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819467001	EG	On-Demand	Mild	CYP2D6	19	44
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819467002	EG	On-Demand	Mild	ADRB2	26	47
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819467002	EG	On-Demand	Mild	ADRB1	60	38
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819467002	EG	On-Demand	Mild	CASR	42	44
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819467002	EG	On-Demand	Mild	CYP2D6	19	44
Cc1cc2c(cc1NC[C@H](O)COc1ccccc1C)OCO2	ZINC000819467006	DF	On-Demand	Anodyne	ADRB2	27	54
Cc1cc2c(cc1NC[C@H](O)COc1ccccc1C)OCO2	ZINC000819467006	DF	On-Demand	Anodyne	CYP2D6	18	44
Cc1cc2c(cc1NC[C@@H](O)COc1ccccc1C)OCO2	ZINC000819467007	DF	On-Demand	Anodyne	ADRB2	27	54
Cc1cc2c(cc1NC[C@@H](O)COc1ccccc1C)OCO2	ZINC000819467007	DF	On-Demand	Anodyne	CYP2D6	18	44
COc1cccc(OC)c1OC[C@@H](O)CNc1ccccc1O[C@H](C)C#N	ZINC000819467008	FF	On-Demand	Mild	ADRB2	27	43
COc1cccc(OC)c1OC[C@@H](O)CNc1ccccc1O[C@H](C)C#N	ZINC000819467008	FF	On-Demand	Mild	ADRB1	58	37
COc1cccc(OC)c1OC[C@@H](O)CNc1ccccc1O[C@@H](C)C#N	ZINC000819467009	FF	On-Demand	Mild	ADRB2	27	43
COc1cccc(OC)c1OC[C@@H](O)CNc1ccccc1O[C@@H](C)C#N	ZINC000819467009	FF	On-Demand	Mild	ADRB1	58	37
COc1cccc(OC)c1OC[C@H](O)CNc1ccccc1O[C@H](C)C#N	ZINC000819467010	FF	On-Demand	Mild	ADRB2	27	43
COc1cccc(OC)c1OC[C@H](O)CNc1ccccc1O[C@H](C)C#N	ZINC000819467010	FF	On-Demand	Mild	ADRB1	58	37
COc1cccc(OC)c1OC[C@H](O)CNc1ccccc1O[C@@H](C)C#N	ZINC000819467011	FF	On-Demand	Mild	ADRB2	27	43
COc1cccc(OC)c1OC[C@H](O)CNc1ccccc1O[C@@H](C)C#N	ZINC000819467011	FF	On-Demand	Mild	ADRB1	58	37
Cc1nc2cc(NCC3(O)CCC3)ccc2s1	ZINC000819467012	BF	On-Demand	Anodyne	ACOX1	77	36
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cncc2ccccc12	ZINC000819467027	GK	On-Demand	Anodyne	AVPR2	39	43
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cncc2ccccc12	ZINC000819467027	GK	On-Demand	Anodyne	CYP11B2	17	46
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cncc2ccccc12	ZINC000819467027	GK	On-Demand	Anodyne	GPBAR1	42	41
C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)CNC(=O)COc1ccccc1	ZINC000819467035	HH	On-Demand	Anodyne	CPT1A	111	40
C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)CNC(=O)COc1ccccc1	ZINC000819467035	HH	On-Demand	Anodyne	CPT2	48	37
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)CNC(=O)COc1ccccc1	ZINC000819467036	HH	On-Demand	Anodyne	CPT1A	111	40
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)CNC(=O)COc1ccccc1	ZINC000819467036	HH	On-Demand	Anodyne	CPT2	48	37
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(Cn2ccnc2)cc1	ZINC000819467050	HJ	On-Demand	Anodyne	AVPR2	50	45
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(Cn2ccnc2)cc1	ZINC000819467050	HJ	On-Demand	Anodyne	TBXAS1	23	45
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819467053	HG	On-Demand	Anodyne	AVPR2	49	46
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000819467053	HG	On-Demand	Anodyne	CA7	15	41
C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)COc1ccc(C(N)=O)cc1	ZINC000819467058	HH	On-Demand	Anodyne	CPT1A	71	43
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)COc1ccc(C(N)=O)cc1	ZINC000819467059	HH	On-Demand	Anodyne	CPT1A	71	43
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cc(S(C)(=O)=O)ccc1F	ZINC000819467062	II	On-Demand	Anodyne	AVPR2	28	41
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cc(S(C)(=O)=O)ccc1F	ZINC000819467062	II	On-Demand	Anodyne	SLC6A9	35	41
O=C(/C=C/c1cccc(OC2CCCC2)c1)N1CC2(CCOCC2)C1	ZINC000819467071	EH	On-Demand	Anodyne	ITGAL	56	45
O=C(/C=C\c1cccc(OC2CCCC2)c1)N1CC2(CCOCC2)C1	ZINC000819467072	EH	On-Demand	Anodyne	ITGAL	56	45
COC(=O)Nc1cc(C(=O)N2CC3(CCOCC3)C2)cc(C(F)(F)F)c1	ZINC000819467075	FG	On-Demand	Anodyne	EPHX2	20	41
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1csc([N+](=O)[O-])c1	ZINC000819467077	GJ	On-Demand	Bother	AVPR2	33	40
O=C([C@@H]1CC(c2cccc(F)c2)=NO1)N1CC2(CCOCC2)C1	ZINC000819467080	DD	On-Demand	Anodyne	LUCI_PHOPY	17	42
O=C([C@H]1CC(c2cccc(F)c2)=NO1)N1CC2(CCOCC2)C1	ZINC000819467081	DD	On-Demand	Anodyne	LUCI_PHOPY	17	42
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(CNC(=O)C(C)(C)C)cc1	ZINC000819467083	IK	On-Demand	Anodyne	AVPR2	62	45
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccncc1Br	ZINC000819467087	HJ	On-Demand	Anodyne	AVPR2	29	42
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1nnc2ccccc2n1	ZINC000819467090	GH	On-Demand	Anodyne	AVPR2	35	42
O=C(/C=C/c1ccc2c(c1)OCO2)N1CC2(CCOCC2)C1	ZINC000819467117	DE	On-Demand	Anodyne	ITGAL	26	45
O=C(/C=C/c1ccc2c(c1)OCO2)N1CC2(CCOCC2)C1	ZINC000819467117	DE	On-Demand	Anodyne	DYRK2	65	34
O=C(/C=C\c1ccc2c(c1)OCO2)N1CC2(CCOCC2)C1	ZINC000819467118	DE	On-Demand	Anodyne	ITGAL	26	45
O=C(/C=C\c1ccc2c(c1)OCO2)N1CC2(CCOCC2)C1	ZINC000819467118	DE	On-Demand	Anodyne	DYRK2	65	34
Cc1nscc1C(=O)N1CCCc2cc(N3CCCC[C@@H]3C)ccc21	ZINC000819467119	FI	On-Demand	Anodyne	AVPR2	41	41
Cc1nscc1C(=O)N1CCCc2cc(N3CCCC[C@H]3C)ccc21	ZINC000819467120	FI	On-Demand	Anodyne	AVPR2	41	41
Cc1nc2cc(NC[C@H](O)COCc3ccccc3)ccc2s1	ZINC000819467121	EH	On-Demand	Anodyne	ACOX1	92	43
Cc1nc2cc(NC[C@@H](O)COCc3ccccc3)ccc2s1	ZINC000819467122	EH	On-Demand	Anodyne	ACOX1	92	43
Cc1cc2c(cc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-])OCO2	ZINC000819467126	EE	On-Demand	Bother	COLA	55	32
Cc1cc2c(cc1NC[C@H](O)COc1ccccc1[N+](=O)[O-])OCO2	ZINC000819467127	EE	On-Demand	Bother	COLA	55	32
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819467129	EF	On-Demand	Mild	ADRB2	45	42
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819467129	EF	On-Demand	Mild	ADRB1	74	40
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819467129	EF	On-Demand	Mild	CASR	40	36
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819467130	EF	On-Demand	Mild	ADRB2	45	42
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819467130	EF	On-Demand	Mild	ADRB1	74	40
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819467130	EF	On-Demand	Mild	CASR	40	36
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819467131	EF	On-Demand	Mild	ADRB2	45	42
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819467131	EF	On-Demand	Mild	ADRB1	74	40
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819467131	EF	On-Demand	Mild	CASR	40	36
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819467132	EF	On-Demand	Mild	ADRB2	45	42
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819467132	EF	On-Demand	Mild	ADRB1	74	40
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819467132	EF	On-Demand	Mild	CASR	40	36
COCCc1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819467141	FF	On-Demand	Anodyne	ADRB2	32	56
COCCc1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819467141	FF	On-Demand	Anodyne	ADRB1	51	56
COCCc1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819467141	FF	On-Demand	Anodyne	GRIN1	21	46
COCCc1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819467141	FF	On-Demand	Anodyne	ADRB3	32	41
COCCc1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819467142	FF	On-Demand	Anodyne	ADRB2	32	56
COCCc1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819467142	FF	On-Demand	Anodyne	ADRB1	51	56
COCCc1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819467142	FF	On-Demand	Anodyne	GRIN1	21	46
COCCc1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819467142	FF	On-Demand	Anodyne	ADRB3	32	41
Cc1nc2cc(NC[C@@H](O)CN(C)CCC#N)ccc2s1	ZINC000819467143	DE	On-Demand	Mild	ACOX1	53	33
Cc1nc2cc(NC[C@H](O)CN(C)CCC#N)ccc2s1	ZINC000819467144	DE	On-Demand	Mild	ACOX1	53	33
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819467149	FF	On-Demand	Mild	ADRB2	21	44
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819467149	FF	On-Demand	Mild	ADRB1	64	39
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819467149	FF	On-Demand	Mild	CASR	40	36
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819467149	FF	On-Demand	Mild	COLA	57	32
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819467150	FF	On-Demand	Mild	ADRB2	21	44
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819467150	FF	On-Demand	Mild	ADRB1	64	39
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819467150	FF	On-Demand	Mild	CASR	40	36
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819467150	FF	On-Demand	Mild	COLA	57	32
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819467151	FF	On-Demand	Mild	ADRB2	21	44
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819467151	FF	On-Demand	Mild	ADRB1	64	39
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819467151	FF	On-Demand	Mild	CASR	40	36
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819467151	FF	On-Demand	Mild	COLA	57	32
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819467152	FF	On-Demand	Mild	ADRB2	21	44
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819467152	FF	On-Demand	Mild	ADRB1	64	39
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819467152	FF	On-Demand	Mild	CASR	40	36
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819467152	FF	On-Demand	Mild	COLA	57	32
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2cccc3c2OCO3)CC1	ZINC000819467155	FF	On-Demand	Anodyne	GPR119	44	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2cccc3c2OCO3)CC1	ZINC000819467156	FF	On-Demand	Anodyne	GPR119	44	49
COC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819467178	EE	On-Demand	Anodyne	ADRB2	41	44
COC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819467178	EE	On-Demand	Anodyne	ADRB1	65	43
COC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819467178	EE	On-Demand	Anodyne	ADRB3	36	43
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819467179	EE	On-Demand	Anodyne	ADRB2	41	44
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819467179	EE	On-Demand	Anodyne	ADRB1	65	43
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819467179	EE	On-Demand	Anodyne	ADRB3	36	43
Cc1nc2cc(NC[C@@H](C)O)ccc2s1	ZINC000819467184	BE	On-Demand	Anodyne	ACOX1	89	38
Cc1nc2cc(NC[C@H](C)O)ccc2s1	ZINC000819467185	BE	On-Demand	Anodyne	ACOX1	89	38
Cc1nc2cc(NC[C@H](O)C(F)(F)F)ccc2s1	ZINC000819467193	CF	On-Demand	Anodyne	ACOX1	84	38
Cc1nc2cc(NC[C@@H](O)C(F)(F)F)ccc2s1	ZINC000819467194	CF	On-Demand	Anodyne	ACOX1	84	38
Cc1nc2cc(NC[C@@H](O)COCc3cccs3)ccc2s1	ZINC000819467199	EH	On-Demand	Anodyne	ACOX1	89	38
Cc1nc2cc(NC[C@H](O)COCc3cccs3)ccc2s1	ZINC000819467200	EH	On-Demand	Anodyne	ACOX1	89	38
Cc1nc2cc(NC[C@@H](O)Cn3cccn3)ccc2s1	ZINC000819467201	CE	On-Demand	Anodyne	ACOX1	91	39
Cc1nc2cc(NC[C@H](O)Cn3cccn3)ccc2s1	ZINC000819467202	CE	On-Demand	Anodyne	ACOX1	91	39
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819467210	FF	On-Demand	Anodyne	ADRB2	35	55
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819467210	FF	On-Demand	Anodyne	ADRB1	66	55
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819467210	FF	On-Demand	Anodyne	GRIN1	26	47
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819467210	FF	On-Demand	Anodyne	ADRB3	41	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819467211	FF	On-Demand	Anodyne	ADRB2	35	55
CC(=O)Nc1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819467211	FF	On-Demand	Anodyne	ADRB1	66	55
CC(=O)Nc1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819467211	FF	On-Demand	Anodyne	GRIN1	26	47
CC(=O)Nc1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819467211	FF	On-Demand	Anodyne	ADRB3	41	48
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]2C)c1	ZINC000819467220	GG	On-Demand	Anodyne	GPR119	21	40
O=C(O)CCNC(=O)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1	ZINC000819467267	FE	On-Demand	Anodyne	LTA4H	19	40
O=C(O)CCNC(=O)C(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1	ZINC000819467267	FE	On-Demand	Anodyne	LIPE	17	45
O=C(O)CCNC(=O)C(=O)Nc1ccc2c(c1)ncn2-c1ccccc1	ZINC000819467279	FD	On-Demand	Anodyne	NR1I2	55	38
O=C(O)CCNC(=O)C(=O)Nc1ccc2c(c1)ncn2-c1ccccc1	ZINC000819467279	FD	On-Demand	Anodyne	HPGD	41	44
O=C(O)CCNC(=O)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1	ZINC000819467284	FC	On-Demand	Anodyne	PRNP	46	36
O=C(O)CCNC(=O)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1	ZINC000819467284	FC	On-Demand	Anodyne	LUCI_LUCLA	42	51
O=C(O)CCNC(=O)C(=O)Nc1ccc(NC(=O)c2ccccc2)nc1	ZINC000819467284	FC	On-Demand	Anodyne	KCNK3	44	35
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(Br)cc3)cc2C1	ZINC000819467286	GG	On-Demand	Anodyne	ADRB1	48	42
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(Br)cc3)cc2C1	ZINC000819467289	GG	On-Demand	Anodyne	ADRB1	48	42
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(Br)cc3)cc2C1	ZINC000819467291	GG	On-Demand	Anodyne	ADRB1	48	42
O=C(O)CCNC(=O)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819467292	ED	On-Demand	Anodyne	GRM5	19	42
O=C(O)CCNC(=O)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819467292	ED	On-Demand	Anodyne	SMO	36	41
O=C(O)CCNC(=O)C(=O)Nc1cccc(-c2noc(C3CC3)n2)c1	ZINC000819467292	ED	On-Demand	Anodyne	ETHR	52	44
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(Br)cc3)cc2C1	ZINC000819467293	GG	On-Demand	Anodyne	ADRB1	48	42
O=C(O)CCNC(=O)C(=O)Nc1ccc(OCc2ccccn2)c(F)c1	ZINC000819467307	FD	On-Demand	Anodyne	GRM4	24	40
O=C(O)CCNC(=O)C(=O)Nc1ccc(OCc2ccccn2)c(F)c1	ZINC000819467307	FD	On-Demand	Anodyne	MET	58	39
O=C(O)CCNC(=O)C(=O)Nc1ccc2[nH]ncc2c1	ZINC000819467308	CC	On-Demand	Anodyne	MAOB	19	47
O=C(O)CCNC(=O)C(=O)Nc1ccc2[nH]ncc2c1	ZINC000819467308	CC	On-Demand	Anodyne	ROCK1	21	58
O=C(O)CCNC(=O)C(=O)Nc1ccc2[nH]ncc2c1	ZINC000819467308	CC	On-Demand	Anodyne	ROCK2	23	58
O=C(O)CCNC(=O)C(=O)Nc1cccc2ccncc12	ZINC000819467328	CC	On-Demand	Anodyne	TRPV1	28	52
O=C(O)CCNC(=O)C(=O)Nc1cccc2ccncc12	ZINC000819467328	CC	On-Demand	Anodyne	CDK5	28	44
COCCNC(=O)c1ccccc1NC(=O)C1CCN(C(C)=O)CC1	ZINC000819467334	ED	On-Demand	Anodyne	EPHX2	17	45
COCCNC(=O)c1ccccc1NC(=O)C1CCN(C(C)=O)CC1	ZINC000819467334	ED	On-Demand	Anodyne	CCR8	63	36
COCCNC(=O)c1ccccc1NC(=O)C1CCN(C(C)=O)CC1	ZINC000819467334	ED	On-Demand	Anodyne	POLR1A	40	33
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(Cl)cc3)cc2C1	ZINC000819467335	EG	On-Demand	Anodyne	ADRB1	59	42
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(Cl)cc3)cc2C1	ZINC000819467335	EG	On-Demand	Anodyne	GRIN1	28	45
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(Cl)cc3)cc2C1	ZINC000819467336	EG	On-Demand	Anodyne	ADRB1	59	42
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(Cl)cc3)cc2C1	ZINC000819467336	EG	On-Demand	Anodyne	GRIN1	28	45
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(Cl)cc3)cc2C1	ZINC000819467337	EG	On-Demand	Anodyne	ADRB1	59	42
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(Cl)cc3)cc2C1	ZINC000819467337	EG	On-Demand	Anodyne	GRIN1	28	45
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(Cl)cc3)cc2C1	ZINC000819467338	EG	On-Demand	Anodyne	ADRB1	59	42
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(Cl)cc3)cc2C1	ZINC000819467338	EG	On-Demand	Anodyne	GRIN1	28	45
O=C(O)CCNC(=O)C(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	ZINC000819467341	FC	On-Demand	Anodyne	EPHX2	19	41
CCC(C)(C)OCc1ccccc1NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819467343	GH	On-Demand	Anodyne	CTSF	42	32
CCC(C)(C)OCc1ccccc1NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819467344	GH	On-Demand	Anodyne	CTSF	42	32
O=C(O)CCNC(=O)C(=O)Nc1ccc(OCC(F)F)cc1	ZINC000819467346	DC	On-Demand	Anodyne	LTA4H	22	42
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(C(C)=O)cc3)cc2C1	ZINC000819467354	FF	On-Demand	Anodyne	ADRB2	29	44
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(C(C)=O)cc3)cc2C1	ZINC000819467354	FF	On-Demand	Anodyne	ADRB1	61	44
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(C(C)=O)cc3)cc2C1	ZINC000819467356	FF	On-Demand	Anodyne	ADRB2	29	44
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(C(C)=O)cc3)cc2C1	ZINC000819467356	FF	On-Demand	Anodyne	ADRB1	61	44
O=C(O)CCNC(=O)C(=O)Nc1ccccc1C#Cc1ccccc1	ZINC000819467357	ED	On-Demand	Mild	FFAR1	42	44
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(C(C)=O)cc3)cc2C1	ZINC000819467358	FF	On-Demand	Anodyne	ADRB2	29	44
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(C(C)=O)cc3)cc2C1	ZINC000819467358	FF	On-Demand	Anodyne	ADRB1	61	44
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(C(C)=O)cc3)cc2C1	ZINC000819467361	FF	On-Demand	Anodyne	ADRB2	29	44
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(C(C)=O)cc3)cc2C1	ZINC000819467361	FF	On-Demand	Anodyne	ADRB1	61	44
O=C(O)CCNC(=O)C(=O)Nc1cccc(OCCF)c1	ZINC000819467362	CC	On-Demand	Anodyne	ADRB1	24	44
O=C(O)CCNC(=O)C(=O)Nc1cccc(OCCF)c1	ZINC000819467362	CC	On-Demand	Anodyne	EPHX2	19	40
O=C(O)CCNC(=O)C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819467378	GD	On-Demand	Anodyne	HDAC10	35	64
O=C(O)CCNC(=O)C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819467378	GD	On-Demand	Anodyne	HDAC2	15	64
O=C(O)CCNC(=O)C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819467378	GD	On-Demand	Anodyne	HDAC3	35	64
O=C(O)CCNC(=O)C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819467378	GD	On-Demand	Anodyne	HDAC6	28	64
O=C(O)CCNC(=O)C(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819467378	GD	On-Demand	Anodyne	CDC7	20	46
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(-c2cnco2)cc1	ZINC000819467389	HK	On-Demand	Anodyne	AVPR2	33	42
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@@H]2C)c1	ZINC000819467390	GG	On-Demand	Anodyne	GPR119	21	40
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]2C)c1	ZINC000819467392	GG	On-Demand	Anodyne	GPR119	21	40
CC(=O)Nc1cccc(CC(=O)N2CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]2C)c1	ZINC000819467394	GG	On-Demand	Anodyne	GPR119	21	40
Cc1nc2cc(NC[C@](C)(O)CNC(=O)OC(C)(C)C)ccc2s1	ZINC000819467425	FG	On-Demand	Anodyne	ACOX1	58	34
Cc1nc2cc(NC[C@@](C)(O)CNC(=O)OC(C)(C)C)ccc2s1	ZINC000819467426	FG	On-Demand	Anodyne	ACOX1	58	34
Cc1nc2cc(NCC3(O)CCS(=O)(=O)CC3)ccc2s1	ZINC000819467428	ED	On-Demand	Anodyne	ACOX1	61	37
CON(C)C(=O)CCNc1ccc2sc(C)nc2c1	ZINC000819467479	CE	On-Demand	Anodyne	ACOX1	53	35
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)c1	ZINC000819467493	FG	On-Demand	Mild	ADRB2	32	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)c1	ZINC000819467493	FG	On-Demand	Mild	ADRB1	66	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)c1	ZINC000819467493	FG	On-Demand	Mild	CASR	42	38
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)c1	ZINC000819467493	FG	On-Demand	Mild	ABCB1	26	44
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)c1	ZINC000819467494	FG	On-Demand	Mild	ADRB2	32	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)c1	ZINC000819467494	FG	On-Demand	Mild	ADRB1	66	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)c1	ZINC000819467494	FG	On-Demand	Mild	CASR	42	38
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)c1	ZINC000819467494	FG	On-Demand	Mild	ABCB1	26	44
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)c1	ZINC000819467496	FG	On-Demand	Mild	ADRB2	32	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)c1	ZINC000819467496	FG	On-Demand	Mild	ADRB1	66	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)c1	ZINC000819467496	FG	On-Demand	Mild	CASR	42	38
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)c1	ZINC000819467496	FG	On-Demand	Mild	ABCB1	26	44
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)c1	ZINC000819467498	FG	On-Demand	Mild	ADRB2	32	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)c1	ZINC000819467498	FG	On-Demand	Mild	ADRB1	66	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)c1	ZINC000819467498	FG	On-Demand	Mild	CASR	42	38
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)c1	ZINC000819467498	FG	On-Demand	Mild	ABCB1	26	44
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(CO)c(F)c1	ZINC000819467507	GI	On-Demand	Anodyne	AVPR2	49	44
O[C@H](CNc1cccc2c1OCO2)COc1cccc(C(F)(F)F)c1	ZINC000819467515	FG	On-Demand	Anodyne	PDS	44	39
O[C@@H](CNc1cccc2c1OCO2)COc1cccc(C(F)(F)F)c1	ZINC000819467516	FG	On-Demand	Anodyne	PDS	44	39
CCNS(=O)(=O)c1ccc(F)c(C(=O)N2CC3(CCOCC3)C2)c1	ZINC000819467528	FD	On-Demand	Anodyne	SLC6A9	24	41
Cc1cc2c(cc1NC[C@@H](O)COc1ccccc1Cl)OCO2	ZINC000819467535	EG	On-Demand	Anodyne	ADRB2	23	47
Cc1cc2c(cc1NC[C@H](O)COc1ccccc1Cl)OCO2	ZINC000819467537	EG	On-Demand	Anodyne	ADRB2	23	47
Cc1nc2cc(NC[C@@H](O)COCc3ccco3)ccc2s1	ZINC000819467539	DG	On-Demand	Anodyne	ACOX1	87	37
Cc1nc2cc(NC[C@H](O)COCc3ccco3)ccc2s1	ZINC000819467541	DG	On-Demand	Anodyne	ACOX1	87	37
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)Cc1ccc(-n2cnnn2)cc1	ZINC000819467549	HH	On-Demand	Anodyne	KCNJ1	63	42
C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)Cc1ccc(-n2cnnn2)cc1	ZINC000819467551	HH	On-Demand	Anodyne	KCNJ1	63	42
COc1cccc(C(=O)NCC(=O)N2CCCc3cc(N4CCCC[C@H]4C)ccc32)c1	ZINC000819467553	HH	On-Demand	Anodyne	DRD4	56	43
COc1cccc(C(=O)NCC(=O)N2CCCc3cc(N4CCCC[C@H]4C)ccc32)c1	ZINC000819467553	HH	On-Demand	Anodyne	AVPR2	33	49
COc1cccc(C(=O)NCC(=O)N2CCCc3cc(N4CCCC[C@H]4C)ccc32)c1	ZINC000819467553	HH	On-Demand	Anodyne	TAAR1	35	40
COc1cccc(C(=O)NCC(=O)N2CCCc3cc(N4CCCC[C@@H]4C)ccc32)c1	ZINC000819467555	HH	On-Demand	Anodyne	DRD4	56	43
COc1cccc(C(=O)NCC(=O)N2CCCc3cc(N4CCCC[C@@H]4C)ccc32)c1	ZINC000819467555	HH	On-Demand	Anodyne	AVPR2	33	49
COc1cccc(C(=O)NCC(=O)N2CCCc3cc(N4CCCC[C@@H]4C)ccc32)c1	ZINC000819467555	HH	On-Demand	Anodyne	TAAR1	35	40
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1c[nH]c(C#N)c1	ZINC000819467574	EH	On-Demand	Mild	AVPR2	34	40
CS(=O)(=O)N1CCc2c(NC[C@H](O)c3cccc(Cl)c3)cccc21	ZINC000819467581	FF	On-Demand	Anodyne	ADRB1	26	40
CS(=O)(=O)N1CCc2c(NC[C@H](O)c3cccc(Cl)c3)cccc21	ZINC000819467581	FF	On-Demand	Anodyne	ADRB3	44	40
CS(=O)(=O)N1CCc2c(NC[C@H](O)c3cccc(Cl)c3)cccc21	ZINC000819467581	FF	On-Demand	Anodyne	IGF1R	30	44
CS(=O)(=O)N1CCc2c(NC[C@H](O)c3cccc(Cl)c3)cccc21	ZINC000819467581	FF	On-Demand	Anodyne	KCNQ2	16	40
CS(=O)(=O)N1CCc2c(NC[C@H](O)c3cccc(Cl)c3)cccc21	ZINC000819467581	FF	On-Demand	Anodyne	CYP3A4	51	39
CS(=O)(=O)N1CCc2c(NC[C@@H](O)c3cccc(Cl)c3)cccc21	ZINC000819467582	FF	On-Demand	Anodyne	ADRB1	26	40
CS(=O)(=O)N1CCc2c(NC[C@@H](O)c3cccc(Cl)c3)cccc21	ZINC000819467582	FF	On-Demand	Anodyne	ADRB3	44	40
CS(=O)(=O)N1CCc2c(NC[C@@H](O)c3cccc(Cl)c3)cccc21	ZINC000819467582	FF	On-Demand	Anodyne	IGF1R	30	44
CS(=O)(=O)N1CCc2c(NC[C@@H](O)c3cccc(Cl)c3)cccc21	ZINC000819467582	FF	On-Demand	Anodyne	KCNQ2	16	40
CS(=O)(=O)N1CCc2c(NC[C@@H](O)c3cccc(Cl)c3)cccc21	ZINC000819467582	FF	On-Demand	Anodyne	CYP3A4	51	39
CC(C)(O)CN1CCc2c(cccc2NCCC(=O)Nc2ccccc2)C1	ZINC000819467583	FG	On-Demand	Anodyne	NOD2	41	34
COCCNC(=O)c1ccccc1NC(=O)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000819467584	JI	On-Demand	Anodyne	ACACB	15	45
COCCNC(=O)c1ccccc1NC(=O)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000819467584	JI	On-Demand	Anodyne	TACR3	25	49
COCCNC(=O)c1ccccc1NC(=O)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000819467584	JI	On-Demand	Anodyne	MT-CO2	48	38
COCCNC(=O)c1ccccc1NC(=O)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12	ZINC000819467584	JI	On-Demand	Anodyne	POLR1A	52	36
CS(=O)(=O)N1CCc2c(NC[C@H](O)c3cccnc3)cccc21	ZINC000819467597	ED	On-Demand	Anodyne	ADRB1	18	40
CS(=O)(=O)N1CCc2c(NC[C@H](O)c3cccnc3)cccc21	ZINC000819467597	ED	On-Demand	Anodyne	ADRB3	75	41
CS(=O)(=O)N1CCc2c(NC[C@@H](O)c3cccnc3)cccc21	ZINC000819467598	ED	On-Demand	Anodyne	ADRB1	18	40
CS(=O)(=O)N1CCc2c(NC[C@@H](O)c3cccnc3)cccc21	ZINC000819467598	ED	On-Demand	Anodyne	ADRB3	75	41
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819467601	FE	On-Demand	Mild	ADRB2	25	42
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819467601	FE	On-Demand	Mild	ADRB1	39	42
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819467602	FE	On-Demand	Mild	ADRB2	25	42
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819467602	FE	On-Demand	Mild	ADRB1	39	42
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)c1cncc(F)c1	ZINC000819467607	CE	On-Demand	Anodyne	KCNQ2	47	33
C[C@H](NC(=O)/C=C/[C@H]1CCCO1)c1cncc(F)c1	ZINC000819467608	CE	On-Demand	Anodyne	KCNQ2	47	33
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)c1cncc(F)c1	ZINC000819467609	CE	On-Demand	Anodyne	KCNQ2	47	33
C[C@H](NC(=O)/C=C\[C@H]1CCCO1)c1cncc(F)c1	ZINC000819467610	CE	On-Demand	Anodyne	KCNQ2	47	33
CCC(C)(C)OCc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819467636	DH	On-Demand	Anodyne	ADRB3	54	38
CCC(C)(C)OCc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819467637	DH	On-Demand	Anodyne	ADRB3	54	38
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1cccc2ccccc12	ZINC000819467638	GH	On-Demand	Mild	ADRB2	23	49
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1cccc2ccccc12	ZINC000819467638	GH	On-Demand	Mild	ADRB1	62	37
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1cccc2ccccc12	ZINC000819467638	GH	On-Demand	Mild	CASR	46	41
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1cccc2ccccc12	ZINC000819467638	GH	On-Demand	Mild	CYP2D6	25	41
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1cccc2ccccc12	ZINC000819467639	GH	On-Demand	Mild	ADRB2	23	49
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1cccc2ccccc12	ZINC000819467639	GH	On-Demand	Mild	ADRB1	62	37
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1cccc2ccccc12	ZINC000819467639	GH	On-Demand	Mild	CASR	46	41
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1cccc2ccccc12	ZINC000819467639	GH	On-Demand	Mild	CYP2D6	25	41
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2C1	ZINC000819467657	EF	On-Demand	Anodyne	ADRB1	58	42
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2C1	ZINC000819467657	EF	On-Demand	Anodyne	GRIN1	21	45
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(F)cc3)cc2C1	ZINC000819467658	EF	On-Demand	Anodyne	ADRB1	58	42
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(F)cc3)cc2C1	ZINC000819467658	EF	On-Demand	Anodyne	GRIN1	21	45
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(F)cc3)cc2C1	ZINC000819467659	EF	On-Demand	Anodyne	ADRB1	58	42
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(F)cc3)cc2C1	ZINC000819467659	EF	On-Demand	Anodyne	GRIN1	21	45
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2C1	ZINC000819467660	EF	On-Demand	Anodyne	ADRB1	58	42
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2C1	ZINC000819467660	EF	On-Demand	Anodyne	GRIN1	21	45
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccccc1	ZINC000819467666	EE	On-Demand	Mild	ADRB2	37	43
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccccc1	ZINC000819467666	EE	On-Demand	Mild	ADRB1	62	35
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccccc1	ZINC000819467666	EE	On-Demand	Mild	CASR	43	38
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccccc1	ZINC000819467667	EE	On-Demand	Mild	ADRB2	37	43
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccccc1	ZINC000819467667	EE	On-Demand	Mild	ADRB1	62	35
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccccc1	ZINC000819467667	EE	On-Demand	Mild	CASR	43	38
Cc1cc2c(cc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)OCO2	ZINC000819467679	GG	On-Demand	Anodyne	GPR119	40	45
Cc1cc2c(cc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1)OCO2	ZINC000819467680	GG	On-Demand	Anodyne	GPR119	40	45
Cc1nc2cc(NC[C@H](O)CCOC(C)C)ccc2s1	ZINC000819467683	CG	On-Demand	Anodyne	ACOX1	87	37
Cc1nc2cc(NC[C@@H](O)CCOC(C)C)ccc2s1	ZINC000819467684	CG	On-Demand	Anodyne	ACOX1	87	37
Cc1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)c(C)c1	ZINC000819467685	DF	On-Demand	Anodyne	ADRB2	20	42
Cc1ccc(OC[C@H](O)CNc2cccc3c2OCO3)c(C)c1	ZINC000819467686	DF	On-Demand	Anodyne	ADRB2	20	42
Cc1nc2cc(NC[C@@H](O)CN(C)C3CC3)ccc2s1	ZINC000819467688	CE	On-Demand	Anodyne	ACOX1	88	37
Cc1nc2cc(NC[C@H](O)CN(C)C3CC3)ccc2s1	ZINC000819467689	CE	On-Demand	Anodyne	ACOX1	88	37
Cc1cc2c(cc1NC[C@@H](O)COc1ccc(F)cc1)OCO2	ZINC000819467693	DF	On-Demand	Anodyne	ADRB2	28	40
Cc1cc2c(cc1NC[C@H](O)COc1ccc(F)cc1)OCO2	ZINC000819467694	DF	On-Demand	Anodyne	ADRB2	28	40
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1	ZINC000819467695	DF	On-Demand	Mild	ADRB2	50	51
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1	ZINC000819467695	DF	On-Demand	Mild	ADRB1	70	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1	ZINC000819467695	DF	On-Demand	Mild	ADRB3	31	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1	ZINC000819467695	DF	On-Demand	Mild	CASR	42	38
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1	ZINC000819467696	DF	On-Demand	Mild	ADRB2	50	51
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1	ZINC000819467696	DF	On-Demand	Mild	ADRB1	70	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1	ZINC000819467696	DF	On-Demand	Mild	ADRB3	31	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1	ZINC000819467696	DF	On-Demand	Mild	CASR	42	38
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1	ZINC000819467697	DF	On-Demand	Mild	ADRB2	50	51
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1	ZINC000819467697	DF	On-Demand	Mild	ADRB1	70	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1	ZINC000819467697	DF	On-Demand	Mild	ADRB3	31	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1	ZINC000819467697	DF	On-Demand	Mild	CASR	42	38
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1	ZINC000819467698	DF	On-Demand	Mild	ADRB2	50	51
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1	ZINC000819467698	DF	On-Demand	Mild	ADRB1	70	41
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1	ZINC000819467698	DF	On-Demand	Mild	ADRB3	31	41
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1	ZINC000819467698	DF	On-Demand	Mild	CASR	42	38
Cc1nc2cc(NC[C@H](O)COCc3ccccc3F)ccc2s1	ZINC000819467699	EH	On-Demand	Anodyne	ACOX1	88	39
Cc1nc2cc(NC[C@@H](O)COCc3ccccc3F)ccc2s1	ZINC000819467700	EH	On-Demand	Anodyne	ACOX1	88	39
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819467703	EG	On-Demand	Mild	ADRB2	41	42
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819467703	EG	On-Demand	Mild	ADRB1	66	37
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819467703	EG	On-Demand	Mild	CASR	40	39
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)cc1	ZINC000819467704	EG	On-Demand	Mild	ADRB2	41	42
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)cc1	ZINC000819467704	EG	On-Demand	Mild	ADRB1	66	37
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)cc1	ZINC000819467704	EG	On-Demand	Mild	CASR	40	39
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819467705	EG	On-Demand	Mild	ADRB2	41	42
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819467705	EG	On-Demand	Mild	ADRB1	66	37
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819467705	EG	On-Demand	Mild	CASR	40	39
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)cc1	ZINC000819467706	EG	On-Demand	Mild	ADRB2	41	42
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)cc1	ZINC000819467706	EG	On-Demand	Mild	ADRB1	66	37
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)cc1	ZINC000819467706	EG	On-Demand	Mild	CASR	40	39
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819467707	FH	On-Demand	Anodyne	ADRB2	34	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819467707	FH	On-Demand	Anodyne	ADRB1	53	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819467707	FH	On-Demand	Anodyne	ADRB3	35	41
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819467707	FH	On-Demand	Anodyne	ACOX1	112	49
CC(=O)c1ccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819467708	FH	On-Demand	Anodyne	ADRB2	34	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819467708	FH	On-Demand	Anodyne	ADRB1	53	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819467708	FH	On-Demand	Anodyne	ADRB3	35	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819467708	FH	On-Demand	Anodyne	ACOX1	112	49
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819467709	FF	On-Demand	Anodyne	ADRB2	43	42
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819467709	FF	On-Demand	Anodyne	ADRB1	70	44
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819467709	FF	On-Demand	Anodyne	GRIN1	21	44
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819467709	FF	On-Demand	Anodyne	ADRB3	47	42
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819467710	FF	On-Demand	Anodyne	ADRB2	43	42
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819467710	FF	On-Demand	Anodyne	ADRB1	70	44
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819467710	FF	On-Demand	Anodyne	GRIN1	21	44
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819467710	FF	On-Demand	Anodyne	ADRB3	47	42
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1ccc(F)c(Cl)c1	ZINC000819467711	GI	On-Demand	Mild	PAPA1_CARPA	43	43
Cc1nc2cc(NC[C@@H](O)C3CC3)ccc2s1	ZINC000819467717	BF	On-Demand	Anodyne	ACOX1	87	37
Cc1nc2cc(NC[C@H](O)C3CC3)ccc2s1	ZINC000819467718	BF	On-Demand	Anodyne	ACOX1	87	37
Cc1nc2cc(NC[C@@H](C)S(C)(=O)=O)ccc2s1	ZINC000819467719	CE	On-Demand	Anodyne	ACOX1	42	34
Cc1nc2cc(NC[C@H](C)S(C)(=O)=O)ccc2s1	ZINC000819467720	CE	On-Demand	Anodyne	ACOX1	42	34
Cc1cc2c(cc1NC[C@@H](O)COc1ccccc1F)OCO2	ZINC000819467742	DF	On-Demand	Anodyne	ADRB2	21	43
Cc1cc2c(cc1NC[C@H](O)COc1ccccc1F)OCO2	ZINC000819467743	DF	On-Demand	Anodyne	ADRB2	21	43
O=C(/C=C/[C@@H]1CCCO1)N1CCO[C@@H](Cc2ccccc2)C1	ZINC000819467754	DE	On-Demand	Anodyne	GRIN2B	18	40
O=C(/C=C/[C@@H]1CCCO1)N1CCO[C@H](Cc2ccccc2)C1	ZINC000819467755	DE	On-Demand	Anodyne	GRIN2B	18	40
O=C(/C=C\[C@@H]1CCCO1)N1CCO[C@@H](Cc2ccccc2)C1	ZINC000819467756	DE	On-Demand	Anodyne	GRIN2B	18	40
O=C(/C=C\[C@@H]1CCCO1)N1CCO[C@H](Cc2ccccc2)C1	ZINC000819467757	DE	On-Demand	Anodyne	GRIN2B	18	40
Cc1cc2c(cc1NC[C@H](O)c1cccc(Cl)c1)OCO2	ZINC000819467765	DH	On-Demand	Anodyne	ADRB1	27	43
Cc1cc2c(cc1NC[C@H](O)c1cccc(Cl)c1)OCO2	ZINC000819467765	DH	On-Demand	Anodyne	ADRB3	40	44
Cc1cc2c(cc1NC[C@H](O)c1cccc(Cl)c1)OCO2	ZINC000819467765	DH	On-Demand	Anodyne	IGF1R	31	42
Cc1cc2c(cc1NC[C@H](O)c1cccc(Cl)c1)OCO2	ZINC000819467765	DH	On-Demand	Anodyne	CYP3A4	52	40
Cc1cc2c(cc1NC[C@@H](O)c1cccc(Cl)c1)OCO2	ZINC000819467766	DH	On-Demand	Anodyne	ADRB1	27	43
Cc1cc2c(cc1NC[C@@H](O)c1cccc(Cl)c1)OCO2	ZINC000819467766	DH	On-Demand	Anodyne	ADRB3	40	44
Cc1cc2c(cc1NC[C@@H](O)c1cccc(Cl)c1)OCO2	ZINC000819467766	DH	On-Demand	Anodyne	IGF1R	31	42
Cc1cc2c(cc1NC[C@@H](O)c1cccc(Cl)c1)OCO2	ZINC000819467766	DH	On-Demand	Anodyne	CYP3A4	52	40
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccn(C)c(=O)c1	ZINC000819467792	FG	On-Demand	Anodyne	AVPR2	38	42
Cc1ccccc1[C@@H](CC(=O)N1CCCc2cc(N3CCCC[C@H]3C)ccc21)NC(N)=O	ZINC000819467800	II	On-Demand	Anodyne	CTSA	54	34
Cc1ccccc1[C@H](CC(=O)N1CCCc2cc(N3CCCC[C@@H]3C)ccc21)NC(N)=O	ZINC000819467801	II	On-Demand	Anodyne	CTSA	54	34
Cc1ccccc1[C@@H](CC(=O)N1CCCc2cc(N3CCCC[C@@H]3C)ccc21)NC(N)=O	ZINC000819467802	II	On-Demand	Anodyne	CTSA	54	34
Cc1ccccc1[C@H](CC(=O)N1CCCc2cc(N3CCCC[C@H]3C)ccc21)NC(N)=O	ZINC000819467803	II	On-Demand	Anodyne	CTSA	54	34
C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)Cc1ccncc1	ZINC000819467804	EH	On-Demand	Anodyne	EIF2AK3	43	42
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)Cc1ccncc1	ZINC000819467805	EH	On-Demand	Anodyne	EIF2AK3	43	42
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cccc(CN2C(=O)CNC2=O)c1	ZINC000819467812	IH	On-Demand	Anodyne	AVPR2	40	38
O=C([C@@H]1CC(c2ccccc2)=NO1)N1CC2(CCOCC2)C1	ZINC000819467818	DD	On-Demand	Anodyne	LUCI_PHOPY	43	37
O=C([C@H]1CC(c2ccccc2)=NO1)N1CC2(CCOCC2)C1	ZINC000819467819	DD	On-Demand	Anodyne	LUCI_PHOPY	43	37
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cccn(C)c1=O	ZINC000819467821	FG	On-Demand	Anodyne	AVPR2	40	42
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(CC#N)cc1	ZINC000819467831	FJ	On-Demand	Mild	AVPR2	62	48
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(C(=O)N(C)C)cc1	ZINC000819467833	HI	On-Demand	Anodyne	AVPR2	70	48
C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)CNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000819467849	IH	On-Demand	Bother	DRD4	41	31
C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)CNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000819467849	IH	On-Demand	Bother	AVPR2	21	49
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)CNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000819467850	IH	On-Demand	Bother	DRD4	41	31
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)CNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000819467850	IH	On-Demand	Bother	AVPR2	21	49
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(-c2ncn(C)n2)cc1	ZINC000819467851	HI	On-Demand	Anodyne	AVPR2	38	43
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cccc(O)n1	ZINC000819467874	FH	On-Demand	Anodyne	AVPR2	35	40
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CC2(CCOCC2)C1	ZINC000819467879	EE	On-Demand	Anodyne	PREP	33	63
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CC2(CCOCC2)C1	ZINC000819467881	EE	On-Demand	Anodyne	PREP	33	63
COCCOc1ccc(C#N)cc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819467907	FG	On-Demand	Mild	MAOB	15	42
COCCOc1ccc(C#N)cc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819467907	FG	On-Demand	Mild	CTSV	29	40
COCCOc1ccc(C#N)cc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819467908	FG	On-Demand	Mild	MAOB	15	42
COCCOc1ccc(C#N)cc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819467908	FG	On-Demand	Mild	CTSV	29	40
CC(=O)Nc1cccc(CC(=O)N2CC[C@@](O)(c3ccc(F)cc3)C2)c1	ZINC000819467909	FE	On-Demand	Anodyne	CCR1	20	40
CC(=O)Nc1cccc(CC(=O)N2CC[C@@](O)(c3ccc(F)cc3)C2)c1	ZINC000819467909	FE	On-Demand	Anodyne	CCR3	42	38
CC(=O)Nc1cccc(CC(=O)N2CC[C@](O)(c3ccc(F)cc3)C2)c1	ZINC000819467910	FE	On-Demand	Anodyne	CCR1	20	40
CC(=O)Nc1cccc(CC(=O)N2CC[C@](O)(c3ccc(F)cc3)C2)c1	ZINC000819467910	FE	On-Demand	Anodyne	CCR3	42	38
Cc1nc2cc(NC[C@@H](O)COC3CCOCC3)ccc2s1	ZINC000819467970	DF	On-Demand	Anodyne	ACOX1	93	38
Cc1nc2cc(NC[C@H](O)COC3CCOCC3)ccc2s1	ZINC000819467972	DF	On-Demand	Anodyne	ACOX1	93	38
C#CCNC(=O)CCNc1ccc2sc(C)nc2c1	ZINC000819467976	CE	On-Demand	Mild	LDHA	31	41
C#CCNC(=O)CCNc1ccc2sc(C)nc2c1	ZINC000819467976	CE	On-Demand	Mild	ACOX1	52	35
Cc1nc2cc(NCC3(O)CCCC3)ccc2s1	ZINC000819467993	CG	On-Demand	Anodyne	ACOX1	77	36
C[C@H](C#N)Oc1ccccc1NCC1(O)CCCCC1	ZINC000819467995	CG	On-Demand	Mild	HCN1	42	35
C[C@@H](C#N)Oc1ccccc1NCC1(O)CCCCC1	ZINC000819467998	CG	On-Demand	Mild	HCN1	42	35
CCOC(=O)C1CCC(O)(CNc2ccc3sc(C)nc3c2)CC1	ZINC000819468005	EH	On-Demand	Anodyne	ACOX1	61	35
Cc1nc2cc(NC[C@@H](O)C(C)(C)C)ccc2s1	ZINC000819468021	CG	On-Demand	Anodyne	ACOX1	82	37
Cc1nc2cc(NC[C@H](O)C(C)(C)C)ccc2s1	ZINC000819468022	CG	On-Demand	Anodyne	ACOX1	82	37
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819468025	GI	On-Demand	Mild	ADRB2	22	42
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819468025	GI	On-Demand	Mild	ADRB1	57	37
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819468025	GI	On-Demand	Mild	CASR	41	41
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819468025	GI	On-Demand	Mild	CYP2D6	17	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819468026	GI	On-Demand	Mild	ADRB2	22	42
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819468026	GI	On-Demand	Mild	ADRB1	57	37
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819468026	GI	On-Demand	Mild	CASR	41	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819468026	GI	On-Demand	Mild	CYP2D6	17	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819468027	GI	On-Demand	Mild	ADRB2	22	42
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819468027	GI	On-Demand	Mild	ADRB1	57	37
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819468027	GI	On-Demand	Mild	CASR	41	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000819468027	GI	On-Demand	Mild	CYP2D6	17	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819468028	GI	On-Demand	Mild	ADRB2	22	42
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819468028	GI	On-Demand	Mild	ADRB1	57	37
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819468028	GI	On-Demand	Mild	CASR	41	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000819468028	GI	On-Demand	Mild	CYP2D6	17	41
CS(=O)(=O)c1cccc(NNC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)c1	ZINC000819468035	GG	On-Demand	Reactive	CACNA1B	42	34
COCCNC(=O)c1ccccc1NC(=O)c1cc2c(Cl)cccc2s1	ZINC000819468062	GI	On-Demand	Anodyne	F9	50	33
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468065	FG	On-Demand	Mild	ADRB2	39	45
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468065	FG	On-Demand	Mild	ADRB1	74	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468065	FG	On-Demand	Mild	ADRB3	28	41
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468065	FG	On-Demand	Mild	CASR	41	39
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468065	FG	On-Demand	Mild	CYP2D6	20	41
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468065	FG	On-Demand	Mild	ABCB1	26	50
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468066	FG	On-Demand	Mild	ADRB2	39	45
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468066	FG	On-Demand	Mild	ADRB1	74	40
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468066	FG	On-Demand	Mild	ADRB3	28	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468066	FG	On-Demand	Mild	CASR	41	39
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468066	FG	On-Demand	Mild	CYP2D6	20	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468066	FG	On-Demand	Mild	ABCB1	26	50
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468067	FG	On-Demand	Mild	ADRB2	39	45
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468067	FG	On-Demand	Mild	ADRB1	74	40
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468067	FG	On-Demand	Mild	ADRB3	28	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468067	FG	On-Demand	Mild	CASR	41	39
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468067	FG	On-Demand	Mild	CYP2D6	20	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468067	FG	On-Demand	Mild	ABCB1	26	50
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468068	FG	On-Demand	Mild	ADRB2	39	45
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468068	FG	On-Demand	Mild	ADRB1	74	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468068	FG	On-Demand	Mild	ADRB3	28	41
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468068	FG	On-Demand	Mild	CASR	41	39
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468068	FG	On-Demand	Mild	CYP2D6	20	41
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468068	FG	On-Demand	Mild	ABCB1	26	50
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468069	EE	On-Demand	Anodyne	ADRB2	41	53
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468069	EE	On-Demand	Anodyne	ADRB1	75	53
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468069	EE	On-Demand	Anodyne	GRIN1	23	44
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468069	EE	On-Demand	Anodyne	ADRB3	45	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468070	EE	On-Demand	Anodyne	ADRB2	41	53
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468070	EE	On-Demand	Anodyne	ADRB1	75	53
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468070	EE	On-Demand	Anodyne	GRIN1	23	44
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468070	EE	On-Demand	Anodyne	ADRB3	45	48
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819468071	FF	On-Demand	Mild	ADRB2	47	41
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819468071	FF	On-Demand	Mild	ADRB1	69	35
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819468071	FF	On-Demand	Mild	ADRB3	36	41
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819468071	FF	On-Demand	Mild	CASR	42	39
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819468072	FF	On-Demand	Mild	ADRB2	47	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819468072	FF	On-Demand	Mild	ADRB1	69	35
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819468072	FF	On-Demand	Mild	ADRB3	36	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819468072	FF	On-Demand	Mild	CASR	42	39
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819468073	FF	On-Demand	Mild	ADRB2	47	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819468073	FF	On-Demand	Mild	ADRB1	69	35
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819468073	FF	On-Demand	Mild	ADRB3	36	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819468073	FF	On-Demand	Mild	CASR	42	39
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819468074	FF	On-Demand	Mild	ADRB2	47	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819468074	FF	On-Demand	Mild	ADRB1	69	35
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819468074	FF	On-Demand	Mild	ADRB3	36	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819468074	FF	On-Demand	Mild	CASR	42	39
COC(=O)Cc1occc1C(=O)N1CCCc2cc(N3CCCC[C@@H]3C)ccc21	ZINC000819468079	GH	On-Demand	Anodyne	AVPR2	40	41
COC[C@@H](C)OC[C@@H](O)CNc1ccc2sc(C)nc2c1	ZINC000819468087	DE	On-Demand	Anodyne	ACOX1	90	38
COC[C@@H](C)OC[C@H](O)CNc1ccc2sc(C)nc2c1	ZINC000819468088	DE	On-Demand	Anodyne	ACOX1	90	38
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCC[C@H]3C(C)C)c(F)c2)c1	ZINC000819468095	GJ	On-Demand	Anodyne	NPY2R	67	37
COC(=O)Cc1occc1C(=O)N1CCCc2cc(N3CCCC[C@H]3C)ccc21	ZINC000819468096	GH	On-Demand	Anodyne	AVPR2	40	41
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc3c2OCO3)c1	ZINC000819468100	EE	On-Demand	Anodyne	ADRB2	18	42
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc3c2OCO3)c1	ZINC000819468100	EE	On-Demand	Anodyne	ABCB1	16	46
CC(=O)c1cccc(OC[C@H](O)CNc2cccc3c2OCO3)c1	ZINC000819468101	EE	On-Demand	Anodyne	ADRB2	18	42
CC(=O)c1cccc(OC[C@H](O)CNc2cccc3c2OCO3)c1	ZINC000819468101	EE	On-Demand	Anodyne	ABCB1	16	46
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819468110	EF	On-Demand	Mild	ADRB2	40	45
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819468110	EF	On-Demand	Mild	ADRB1	70	38
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819468110	EF	On-Demand	Mild	ADRB3	21	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819468110	EF	On-Demand	Mild	CASR	42	38
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819468110	EF	On-Demand	Mild	CYP2D6	21	41
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccnnc1	ZINC000819468113	EG	On-Demand	Anodyne	AVPR2	35	43
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819468120	EF	On-Demand	Mild	ADRB2	40	45
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819468120	EF	On-Demand	Mild	ADRB1	70	38
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819468120	EF	On-Demand	Mild	ADRB3	21	41
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819468120	EF	On-Demand	Mild	CASR	42	38
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819468120	EF	On-Demand	Mild	CYP2D6	21	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819468121	EF	On-Demand	Mild	ADRB2	40	45
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819468121	EF	On-Demand	Mild	ADRB1	70	38
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819468121	EF	On-Demand	Mild	ADRB3	21	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819468121	EF	On-Demand	Mild	CASR	42	38
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819468121	EF	On-Demand	Mild	CYP2D6	21	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819468122	EF	On-Demand	Mild	ADRB2	40	45
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819468122	EF	On-Demand	Mild	ADRB1	70	38
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819468122	EF	On-Demand	Mild	ADRB3	21	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819468122	EF	On-Demand	Mild	CASR	42	38
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819468122	EF	On-Demand	Mild	CYP2D6	21	41
Cc1nc2cc(NC[C@H](O)COc3ccc(CC#N)cc3)ccc2s1	ZINC000819468127	FH	On-Demand	Mild	ADRB1	51	36
Cc1nc2cc(NC[C@H](O)COc3ccc(CC#N)cc3)ccc2s1	ZINC000819468127	FH	On-Demand	Mild	ACOX1	104	44
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCC[C@@H]3C(C)C)c(F)c2)c1	ZINC000819468134	GJ	On-Demand	Anodyne	NPY2R	67	37
Cc1nc2cc(NC[C@@H](O)COc3ccc(CC#N)cc3)ccc2s1	ZINC000819468135	FH	On-Demand	Mild	ADRB1	51	36
Cc1nc2cc(NC[C@@H](O)COc3ccc(CC#N)cc3)ccc2s1	ZINC000819468135	FH	On-Demand	Mild	ACOX1	104	44
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1nc(Cl)cs1	ZINC000819468137	GJ	On-Demand	Anodyne	AVPR2	34	43
COC[C@@H](O)CNc1ccccc1O[C@H](C)C#N	ZINC000819468158	CD	On-Demand	Mild	ADRB2	22	42
COC[C@@H](O)CNc1ccccc1O[C@H](C)C#N	ZINC000819468158	CD	On-Demand	Mild	ADRB1	52	35
COC[C@@H](O)CNc1ccccc1O[C@@H](C)C#N	ZINC000819468161	CD	On-Demand	Mild	ADRB2	22	42
COC[C@@H](O)CNc1ccccc1O[C@@H](C)C#N	ZINC000819468161	CD	On-Demand	Mild	ADRB1	52	35
CC(C)(O)CN1CCc2c(cccc2NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819468163	FH	On-Demand	Anodyne	ADRB1	27	40
CC(C)(O)CN1CCc2c(cccc2NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819468163	FH	On-Demand	Anodyne	ADRB3	44	42
CC(C)(O)CN1CCc2c(cccc2NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819468163	FH	On-Demand	Anodyne	IGF1R	30	40
CC(C)(O)CN1CCc2c(cccc2NC[C@H](O)c2cccc(Cl)c2)C1	ZINC000819468163	FH	On-Demand	Anodyne	CYP3A4	51	38
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cncnc1	ZINC000819468164	EG	On-Demand	Anodyne	AVPR2	40	44
CC(C)(O)CN1CCc2c(cccc2NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819468168	FH	On-Demand	Anodyne	ADRB1	27	40
CC(C)(O)CN1CCc2c(cccc2NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819468168	FH	On-Demand	Anodyne	ADRB3	44	42
CC(C)(O)CN1CCc2c(cccc2NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819468168	FH	On-Demand	Anodyne	IGF1R	30	40
CC(C)(O)CN1CCc2c(cccc2NC[C@@H](O)c2cccc(Cl)c2)C1	ZINC000819468168	FH	On-Demand	Anodyne	CYP3A4	51	38
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(Cl)c(S(C)(=O)=O)c1	ZINC000819468172	IJ	On-Demand	Anodyne	AVPR2	48	45
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CC2(CCOCC2)C1	ZINC000819468180	DE	On-Demand	Anodyne	PREP	40	64
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccccc1O	ZINC000819468188	FI	On-Demand	Anodyne	AVPR2	64	48
C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)Cc1cncnc1	ZINC000819468195	FG	On-Demand	Anodyne	EIF2AK3	57	33
Cc1cc(NC(=O)/C=C/[C@@H]2CCCO2)nn1-c1ccc(Cl)cc1Cl	ZINC000819468197	FI	On-Demand	Anodyne	CNR1	68	42
Cc1cc(NC(=O)/C=C/[C@@H]2CCCO2)nn1-c1ccc(Cl)cc1Cl	ZINC000819468197	FI	On-Demand	Anodyne	CNR2	24	42
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)Cc1cncnc1	ZINC000819468198	FG	On-Demand	Anodyne	EIF2AK3	57	33
Cc1cc(NC(=O)/C=C\[C@H]2CCCO2)nn1-c1ccc(Cl)cc1Cl	ZINC000819468201	FI	On-Demand	Anodyne	CNR1	68	42
Cc1cc(NC(=O)/C=C\[C@H]2CCCO2)nn1-c1ccc(Cl)cc1Cl	ZINC000819468201	FI	On-Demand	Anodyne	CNR2	24	42
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cc(N)nc(Cl)c1	ZINC000819468205	GI	On-Demand	Anodyne	AVPR2	35	45
Cc1cc(NC(=O)/C=C\[C@@H]2CCCO2)nn1-c1ccc(Cl)cc1Cl	ZINC000819468206	FI	On-Demand	Anodyne	CNR1	68	42
Cc1cc(NC(=O)/C=C\[C@@H]2CCCO2)nn1-c1ccc(Cl)cc1Cl	ZINC000819468206	FI	On-Demand	Anodyne	CNR2	24	42
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819468207	GH	On-Demand	Mild	ADRB2	24	44
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819468207	GH	On-Demand	Mild	ADRB1	63	39
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819468207	GH	On-Demand	Mild	CASR	41	38
O=C(c1cc(-c2ccccc2)nc2cc(F)ccc12)N1CC2(CCOCC2)C1	ZINC000819468208	GI	On-Demand	Anodyne	DHODH	27	47
Cc1cc(NC(=O)/C=C/[C@H]2CCCO2)nn1-c1ccc(Cl)cc1Cl	ZINC000819468210	FI	On-Demand	Anodyne	CNR1	68	42
Cc1cc(NC(=O)/C=C/[C@H]2CCCO2)nn1-c1ccc(Cl)cc1Cl	ZINC000819468210	FI	On-Demand	Anodyne	CNR2	24	42
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc2nccn2c1	ZINC000819468217	FI	On-Demand	Anodyne	AVPR2	32	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819468218	GH	On-Demand	Mild	ADRB2	24	44
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819468218	GH	On-Demand	Mild	ADRB1	63	39
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819468218	GH	On-Demand	Mild	CASR	41	38
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819468222	GH	On-Demand	Mild	ADRB2	24	44
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819468222	GH	On-Demand	Mild	ADRB1	63	39
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819468222	GH	On-Demand	Mild	CASR	41	38
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819468227	GH	On-Demand	Mild	ADRB2	24	44
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819468227	GH	On-Demand	Mild	ADRB1	63	39
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819468227	GH	On-Demand	Mild	CASR	41	38
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cccc(C)c3)cc2C1	ZINC000819468247	EF	On-Demand	Anodyne	ADRB2	29	54
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cccc(C)c3)cc2C1	ZINC000819468247	EF	On-Demand	Anodyne	ADRB1	44	54
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cccc(C)c3)cc2C1	ZINC000819468249	EF	On-Demand	Anodyne	ADRB2	29	54
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cccc(C)c3)cc2C1	ZINC000819468249	EF	On-Demand	Anodyne	ADRB1	44	54
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cccc(C)c3)cc2C1	ZINC000819468251	EF	On-Demand	Anodyne	ADRB2	29	54
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cccc(C)c3)cc2C1	ZINC000819468251	EF	On-Demand	Anodyne	ADRB1	44	54
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cccc(C)c3)cc2C1	ZINC000819468255	EF	On-Demand	Anodyne	ADRB2	29	54
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cccc(C)c3)cc2C1	ZINC000819468255	EF	On-Demand	Anodyne	ADRB1	44	54
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1coc(C(N)=O)c1	ZINC000819468268	FG	On-Demand	Anodyne	AVPR2	32	42
C[C@H](C#N)Oc1ccccc1NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819468269	GI	On-Demand	Mild	KDR	15	42
C[C@H](C#N)Oc1ccccc1NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819468269	GI	On-Demand	Mild	KCNK3	58	38
C[C@H](C#N)Oc1ccccc1NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819468269	GI	On-Demand	Mild	KCNK9	48	38
C[C@@H](C#N)Oc1ccccc1NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819468275	GI	On-Demand	Mild	KDR	15	42
C[C@@H](C#N)Oc1ccccc1NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819468275	GI	On-Demand	Mild	KCNK3	58	38
C[C@@H](C#N)Oc1ccccc1NCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000819468275	GI	On-Demand	Mild	KCNK9	48	38
Cc1nc2cc(NC[C@@H](O)COCC(C)C)ccc2s1	ZINC000819468281	CG	On-Demand	Anodyne	ACOX1	93	39
Cc1nc2cc(NC[C@H](O)COCC(C)C)ccc2s1	ZINC000819468283	CG	On-Demand	Anodyne	ACOX1	93	39
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cccc(Br)c3)cc2C1	ZINC000819468284	GG	On-Demand	Anodyne	ADRB2	22	40
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cccc(Br)c3)cc2C1	ZINC000819468284	GG	On-Demand	Anodyne	ADRB1	37	40
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cccc(Br)c3)cc2C1	ZINC000819468286	GG	On-Demand	Anodyne	ADRB2	22	40
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cccc(Br)c3)cc2C1	ZINC000819468286	GG	On-Demand	Anodyne	ADRB1	37	40
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cccc(Br)c3)cc2C1	ZINC000819468288	GG	On-Demand	Anodyne	ADRB2	22	40
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cccc(Br)c3)cc2C1	ZINC000819468288	GG	On-Demand	Anodyne	ADRB1	37	40
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cccc(Br)c3)cc2C1	ZINC000819468290	GG	On-Demand	Anodyne	ADRB2	22	40
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cccc(Br)c3)cc2C1	ZINC000819468290	GG	On-Demand	Anodyne	ADRB1	37	40
COc1cccc(OC)c1OC[C@H](O)CNc1cccc2c1OCO2	ZINC000819468295	EE	On-Demand	Anodyne	ADRB1	20	42
COc1cccc(OC)c1OC[C@@H](O)CNc1cccc2c1OCO2	ZINC000819468297	EE	On-Demand	Anodyne	ADRB1	20	42
Cc1cc2c(cc1NC[C@@H](O)COc1ccccc1)OCO2	ZINC000819468316	DF	On-Demand	Anodyne	ADRB2	48	49
Cc1cc2c(cc1NC[C@@H](O)COc1ccccc1)OCO2	ZINC000819468316	DF	On-Demand	Anodyne	ADRB1	53	42
Cc1cc2c(cc1NC[C@@H](O)COc1ccccc1)OCO2	ZINC000819468316	DF	On-Demand	Anodyne	CASR	29	44
Cc1cc2c(cc1NC[C@@H](O)COc1ccccc1)OCO2	ZINC000819468316	DF	On-Demand	Anodyne	CYP2D6	15	43
Cc1cc2c(cc1NC[C@H](O)COc1ccccc1)OCO2	ZINC000819468324	DF	On-Demand	Anodyne	ADRB2	48	49
Cc1cc2c(cc1NC[C@H](O)COc1ccccc1)OCO2	ZINC000819468324	DF	On-Demand	Anodyne	ADRB1	53	42
Cc1cc2c(cc1NC[C@H](O)COc1ccccc1)OCO2	ZINC000819468324	DF	On-Demand	Anodyne	CASR	29	44
Cc1cc2c(cc1NC[C@H](O)COc1ccccc1)OCO2	ZINC000819468324	DF	On-Demand	Anodyne	CYP2D6	15	43
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819468329	FG	On-Demand	Anodyne	ADRB2	42	53
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819468329	FG	On-Demand	Anodyne	ADRB1	68	53
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819468329	FG	On-Demand	Anodyne	ADRB3	46	48
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819468329	FG	On-Demand	Anodyne	ACOX1	117	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819468333	FG	On-Demand	Anodyne	ADRB2	42	53
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819468333	FG	On-Demand	Anodyne	ADRB1	68	53
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819468333	FG	On-Demand	Anodyne	ADRB3	46	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819468333	FG	On-Demand	Anodyne	ACOX1	117	54
O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CC2(CCOCC2)C1	ZINC000819468336	FF	On-Demand	Bother	SLC6A9	19	56
Cc1nc2cc(NC[C@@H](O)Cn3cc([N+](=O)[O-])cn3)ccc2s1	ZINC000819468338	EE	On-Demand	Bother	ACOX1	69	36
Cc1nc2cc(NC[C@H](O)Cn3cc([N+](=O)[O-])cn3)ccc2s1	ZINC000819468347	EE	On-Demand	Bother	ACOX1	69	36
N#CCc1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468353	EE	On-Demand	Mild	ADRB1	41	37
N#CCc1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468355	EE	On-Demand	Mild	ADRB1	41	37
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819468357	GI	On-Demand	Mild	ADRB2	22	42
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819468357	GI	On-Demand	Mild	ADRB1	57	36
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819468357	GI	On-Demand	Mild	CASR	40	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819468357	GI	On-Demand	Mild	CYP2D6	17	41
COCCOc1ccc(C#N)cc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819468358	EC	On-Demand	Mild	SLC9A1	56	31
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819468359	GI	On-Demand	Mild	ADRB2	22	42
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819468359	GI	On-Demand	Mild	ADRB1	57	36
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819468359	GI	On-Demand	Mild	CASR	40	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819468359	GI	On-Demand	Mild	CYP2D6	17	41
COCCOc1ccc(C#N)cc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819468360	EC	On-Demand	Mild	SLC9A1	56	31
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819468361	GI	On-Demand	Mild	ADRB2	22	42
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819468361	GI	On-Demand	Mild	ADRB1	57	36
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819468361	GI	On-Demand	Mild	CASR	40	41
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819468361	GI	On-Demand	Mild	CYP2D6	17	41
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cc(C)cc(C)c3)cc2C1	ZINC000819468362	EG	On-Demand	Anodyne	ADRB2	23	50
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cc(C)cc(C)c3)cc2C1	ZINC000819468362	EG	On-Demand	Anodyne	ADRB1	35	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819468363	GI	On-Demand	Mild	ADRB2	22	42
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819468363	GI	On-Demand	Mild	ADRB1	57	36
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819468363	GI	On-Demand	Mild	CASR	40	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819468363	GI	On-Demand	Mild	CYP2D6	17	41
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cc(C)cc(C)c3)cc2C1	ZINC000819468364	EG	On-Demand	Anodyne	ADRB2	23	50
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cc(C)cc(C)c3)cc2C1	ZINC000819468364	EG	On-Demand	Anodyne	ADRB1	35	41
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cc(C)cc(C)c3)cc2C1	ZINC000819468366	EG	On-Demand	Anodyne	ADRB2	23	50
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cc(C)cc(C)c3)cc2C1	ZINC000819468366	EG	On-Demand	Anodyne	ADRB1	35	41
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cc(C)cc(C)c3)cc2C1	ZINC000819468368	EG	On-Demand	Anodyne	ADRB2	23	50
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cc(C)cc(C)c3)cc2C1	ZINC000819468368	EG	On-Demand	Anodyne	ADRB1	35	41
COc1ccccc1COC[C@@H](O)CNc1ccc2sc(C)nc2c1	ZINC000819468372	FH	On-Demand	Anodyne	ACOX1	79	38
COc1ccccc1COC[C@H](O)CNc1ccc2sc(C)nc2c1	ZINC000819468373	FH	On-Demand	Anodyne	ACOX1	79	38
Cc1nc2cc(NC[C@H](O)CN3CCN(C)CC3)ccc2s1	ZINC000819468376	DD	On-Demand	Anodyne	ACOX1	113	48
Cc1nc2cc(NC[C@@H](O)CN3CCN(C)CC3)ccc2s1	ZINC000819468377	DD	On-Demand	Anodyne	ACOX1	113	48
Cc1nc2cc(NCCS(=O)(=O)CC(=O)OC(C)(C)C)ccc2s1	ZINC000819468378	FF	On-Demand	Anodyne	ACOX1	50	34
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819468389	FF	On-Demand	Mild	CTSF	56	37
C[C@H](C#N)Oc1ccccc1NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819468390	FF	On-Demand	Mild	CTSF	56	37
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819468391	FF	On-Demand	Mild	CTSF	56	37
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819468392	FF	On-Demand	Mild	CTSF	56	37
Cc1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468393	DF	On-Demand	Anodyne	ADRB2	36	48
Cc1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468393	DF	On-Demand	Anodyne	ADRB1	46	39
Cc1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468394	DF	On-Demand	Anodyne	ADRB2	36	48
Cc1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468394	DF	On-Demand	Anodyne	ADRB1	46	39
Cc1nc2cc(NCC3(O)CCOCC3)ccc2s1	ZINC000819468417	CF	On-Demand	Anodyne	ACOX1	74	34
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819468428	FG	On-Demand	Mild	ADRB2	24	62
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819468428	FG	On-Demand	Mild	ADRB1	65	62
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819468428	FG	On-Demand	Mild	CYP2D6	23	44
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819468429	FG	On-Demand	Mild	ADRB2	24	62
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819468429	FG	On-Demand	Mild	ADRB1	65	62
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819468429	FG	On-Demand	Mild	CYP2D6	23	44
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819468430	FG	On-Demand	Mild	ADRB2	24	62
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819468430	FG	On-Demand	Mild	ADRB1	65	62
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819468430	FG	On-Demand	Mild	CYP2D6	23	44
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819468431	FG	On-Demand	Mild	ADRB2	24	62
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819468431	FG	On-Demand	Mild	ADRB1	65	62
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819468431	FG	On-Demand	Mild	CYP2D6	23	44
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819468450	GH	On-Demand	Anodyne	ADRB2	45	45
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819468450	GH	On-Demand	Anodyne	ADRB1	71	45
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819468450	GH	On-Demand	Anodyne	GRIN1	27	40
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819468450	GH	On-Demand	Anodyne	ADRB3	51	45
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819468450	GH	On-Demand	Anodyne	ACOX1	107	46
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819468451	GH	On-Demand	Anodyne	ADRB2	45	45
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819468451	GH	On-Demand	Anodyne	ADRB1	71	45
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819468451	GH	On-Demand	Anodyne	GRIN1	27	40
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819468451	GH	On-Demand	Anodyne	ADRB3	51	45
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819468451	GH	On-Demand	Anodyne	ACOX1	107	46
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468460	FF	On-Demand	Mild	ADRB2	49	56
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468460	FF	On-Demand	Mild	ADRB1	79	44
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468460	FF	On-Demand	Mild	ADRB3	42	46
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468461	FF	On-Demand	Mild	ADRB2	49	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468461	FF	On-Demand	Mild	ADRB1	79	44
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468461	FF	On-Demand	Mild	ADRB3	42	46
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468462	FF	On-Demand	Mild	ADRB2	49	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468462	FF	On-Demand	Mild	ADRB1	79	44
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468462	FF	On-Demand	Mild	ADRB3	42	46
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468463	FF	On-Demand	Mild	ADRB2	49	56
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468463	FF	On-Demand	Mild	ADRB1	79	44
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468463	FF	On-Demand	Mild	ADRB3	42	46
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819468464	FF	On-Demand	Mild	ADRB1	43	36
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819468464	FF	On-Demand	Mild	EDNRA	24	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819468465	FF	On-Demand	Mild	ADRB1	43	36
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819468465	FF	On-Demand	Mild	EDNRA	24	41
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819468466	FF	On-Demand	Mild	ADRB1	43	36
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819468466	FF	On-Demand	Mild	EDNRA	24	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819468469	FF	On-Demand	Mild	ADRB1	43	36
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819468469	FF	On-Demand	Mild	EDNRA	24	41
COC(=O)c1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468474	FE	On-Demand	Anodyne	ADRB2	30	46
COC(=O)c1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468474	FE	On-Demand	Anodyne	ADRB1	44	40
COC(=O)c1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468474	FE	On-Demand	Anodyne	ADRB3	24	40
COC(=O)c1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468477	FE	On-Demand	Anodyne	ADRB2	30	46
COC(=O)c1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468477	FE	On-Demand	Anodyne	ADRB1	44	40
COC(=O)c1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468477	FE	On-Demand	Anodyne	ADRB3	24	40
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468480	EE	On-Demand	Anodyne	ADRB2	31	42
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468480	EE	On-Demand	Anodyne	ADRB1	52	38
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468480	EE	On-Demand	Anodyne	ABCB1	16	50
CC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468484	EE	On-Demand	Anodyne	ADRB2	31	42
CC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468484	EE	On-Demand	Anodyne	ADRB1	52	38
CC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468484	EE	On-Demand	Anodyne	ABCB1	16	50
CN(Cc1ncon1)C(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819468504	GH	On-Demand	Anodyne	REN	53	38
C/C(=C\C(=O)N1CC2(CCOCC2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819468505	EH	On-Demand	Anodyne	EPHX2	18	42
CN(Cc1ncon1)C(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819468506	GH	On-Demand	Anodyne	REN	53	38
C/C(=C/C(=O)N1CC2(CCOCC2)C1)c1ccc(C(F)(F)F)cc1	ZINC000819468507	EH	On-Demand	Anodyne	EPHX2	18	42
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(Cl)c(Cl)c3)cc2C1	ZINC000819468522	GH	On-Demand	Anodyne	GRIN1	30	45
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(Cl)c(Cl)c3)cc2C1	ZINC000819468526	GH	On-Demand	Anodyne	GRIN1	30	45
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc2nn[nH]c2c1	ZINC000819468528	GH	On-Demand	Anodyne	AVPR2	43	41
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(Cl)c(Cl)c3)cc2C1	ZINC000819468529	GH	On-Demand	Anodyne	GRIN1	30	45
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(Cl)c(Cl)c3)cc2C1	ZINC000819468531	GH	On-Demand	Anodyne	GRIN1	30	45
CCOC(=O)NCC(=O)N1CCCc2cc(N3CCCC[C@@H]3C)ccc21	ZINC000819468541	FG	On-Demand	Anodyne	AVPR2	28	41
CCOC(=O)NCC(=O)N1CCCc2cc(N3CCCC[C@H]3C)ccc21	ZINC000819468542	FG	On-Demand	Anodyne	AVPR2	28	41
C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)CN(C)C	ZINC000819468548	DF	On-Demand	Anodyne	IGF1R	40	39
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)CN(C)C	ZINC000819468549	DF	On-Demand	Anodyne	IGF1R	40	39
C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)C1CCN(C(=O)c2ccccc2)CC1	ZINC000819468551	IJ	On-Demand	Anodyne	AVPR2	44	42
C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)C1CCN(C(=O)c2ccccc2)CC1	ZINC000819468551	IJ	On-Demand	Anodyne	AVPR1A	21	41
C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)C1CCN(C(=O)c2ccccc2)CC1	ZINC000819468551	IJ	On-Demand	Anodyne	L3MBTL3	67	35
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)C1CCN(C(=O)c2ccccc2)CC1	ZINC000819468552	IJ	On-Demand	Anodyne	AVPR2	44	42
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)C1CCN(C(=O)c2ccccc2)CC1	ZINC000819468552	IJ	On-Demand	Anodyne	AVPR1A	21	41
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)C1CCN(C(=O)c2ccccc2)CC1	ZINC000819468552	IJ	On-Demand	Anodyne	L3MBTL3	67	35
O=C(c1ccc(F)c(S(=O)(=O)N2CCCC2)c1)N1CC2(CCOCC2)C1	ZINC000819468553	GD	On-Demand	Anodyne	CNR2	16	50
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccccc1F	ZINC000819468554	FF	On-Demand	Mild	ADRB2	18	40
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccccc1F	ZINC000819468554	FF	On-Demand	Mild	ADRB1	58	42
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccccc1F	ZINC000819468554	FF	On-Demand	Mild	CASR	41	37
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccccc1F	ZINC000819468557	FF	On-Demand	Mild	ADRB2	18	40
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccccc1F	ZINC000819468557	FF	On-Demand	Mild	ADRB1	58	42
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccccc1F	ZINC000819468557	FF	On-Demand	Mild	CASR	41	37
COCCNC(=O)c1ccccc1NC(=O)/C=C\c1ccc(C)cc1Br	ZINC000819468569	HH	On-Demand	Anodyne	KCNK3	40	35
COCCNC(=O)c1ccccc1NC(=O)/C=C/c1ccc(C)cc1Br	ZINC000819468570	HH	On-Demand	Anodyne	KCNK3	40	35
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cccc(C(C)=O)c3)cc2C1	ZINC000819468577	FF	On-Demand	Anodyne	ADRB2	22	42
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cccc(C(C)=O)c3)cc2C1	ZINC000819468577	FF	On-Demand	Anodyne	ADRB1	44	38
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cccc(C(C)=O)c3)cc2C1	ZINC000819468579	FF	On-Demand	Anodyne	ADRB2	22	42
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cccc(C(C)=O)c3)cc2C1	ZINC000819468579	FF	On-Demand	Anodyne	ADRB1	44	38
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cccc(C(C)=O)c3)cc2C1	ZINC000819468581	FF	On-Demand	Anodyne	ADRB2	22	42
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cccc(C(C)=O)c3)cc2C1	ZINC000819468581	FF	On-Demand	Anodyne	ADRB1	44	38
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cccc(C(C)=O)c3)cc2C1	ZINC000819468583	FF	On-Demand	Anodyne	ADRB2	22	42
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cccc(C(C)=O)c3)cc2C1	ZINC000819468583	FF	On-Demand	Anodyne	ADRB1	44	38
COc1ccc(C(=O)N2CCCc3cc(N4CCCC[C@@H]4C)ccc32)c(O)c1	ZINC000819468587	GI	On-Demand	Anodyne	AVPR2	33	42
COc1ccc(C(=O)N2CCCc3cc(N4CCCC[C@H]4C)ccc32)c(O)c1	ZINC000819468588	GI	On-Demand	Anodyne	AVPR2	33	42
COCCOc1ccc(C#N)cc1NC[C@@H](O)Cc1ccccc1	ZINC000819468602	EF	On-Demand	Mild	CTRB_BOVIN	53	37
CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)N1CC2(CCOCC2)C1	ZINC000819468604	ED	On-Demand	Anodyne	PREP	15	40
CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)N1CC2(CCOCC2)C1	ZINC000819468605	ED	On-Demand	Anodyne	PREP	15	40
COCCOc1ccc(C#N)cc1NC[C@H](O)Cc1ccccc1	ZINC000819468607	EF	On-Demand	Mild	CTRB_BOVIN	53	37
O=C(NC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1)C(F)=C1CCC1	ZINC000819468621	GD	On-Demand	Anodyne	PKM	43	49
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cccc(CC#N)c1	ZINC000819468622	FJ	On-Demand	Mild	AVPR2	42	39
COCCOc1ccc(C#N)cc1NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819468623	GE	On-Demand	Mild	CTSF	49	37
COCCOc1ccc(C#N)cc1NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819468624	GE	On-Demand	Mild	CTSF	49	37
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cn(Cc2ccccn2)nn1	ZINC000819468633	HH	On-Demand	Anodyne	AVPR2	26	40
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccccc1Cl	ZINC000819468641	GG	On-Demand	Mild	ADRB2	20	42
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccccc1Cl	ZINC000819468641	GG	On-Demand	Mild	ADRB1	55	35
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccccc1Cl	ZINC000819468641	GG	On-Demand	Mild	CASR	43	42
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccccc1Cl	ZINC000819468641	GG	On-Demand	Mild	CYP2D6	21	42
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819468642	GG	On-Demand	Mild	ADRB2	20	42
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819468642	GG	On-Demand	Mild	ADRB1	55	35
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819468642	GG	On-Demand	Mild	CASR	43	42
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819468642	GG	On-Demand	Mild	CYP2D6	21	42
O=C(Cc1ccc(-n2cnnc2)cc1)N1CC[C@@](O)(c2ccc(F)cc2)C1	ZINC000819468643	FE	On-Demand	Anodyne	KCNJ1	46	36
O=C(Cc1ccc(-n2cnnc2)cc1)N1CC[C@](O)(c2ccc(F)cc2)C1	ZINC000819468644	FE	On-Demand	Anodyne	KCNJ1	46	36
CC(C)(O)CN1CCc2c(cccc2NC[C@@H](O)COc2ccccc2)C1	ZINC000819468648	FF	On-Demand	Anodyne	ADRB2	28	41
CC(C)(O)CN1CCc2c(cccc2NC[C@H](O)COc2ccccc2)C1	ZINC000819468649	FF	On-Demand	Anodyne	ADRB2	28	41
CS(=O)(=O)N1CCc2c(NC[C@H](O)c3cccc(F)c3)cccc21	ZINC000819468650	FE	On-Demand	Anodyne	KCNQ2	21	40
CS(=O)(=O)N1CCc2c(NC[C@@H](O)c3cccc(F)c3)cccc21	ZINC000819468651	FE	On-Demand	Anodyne	KCNQ2	21	40
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(C#N)cc1	ZINC000819468660	FJ	On-Demand	Mild	NR3C2	15	41
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(C#N)cc1	ZINC000819468660	FJ	On-Demand	Mild	AVPR2	57	50
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000819468680	GI	On-Demand	Mild	ADRB2	22	42
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000819468680	GI	On-Demand	Mild	ADRB1	57	37
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000819468680	GI	On-Demand	Mild	CASR	42	41
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000819468680	GI	On-Demand	Mild	CYP2D6	17	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000819468681	GI	On-Demand	Mild	ADRB2	22	42
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000819468681	GI	On-Demand	Mild	ADRB1	57	37
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000819468681	GI	On-Demand	Mild	CASR	42	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000819468681	GI	On-Demand	Mild	CYP2D6	17	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000819468682	GI	On-Demand	Mild	ADRB2	22	42
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000819468682	GI	On-Demand	Mild	ADRB1	57	37
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000819468682	GI	On-Demand	Mild	CASR	42	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000819468682	GI	On-Demand	Mild	CYP2D6	17	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000819468683	GI	On-Demand	Mild	ADRB2	22	42
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000819468683	GI	On-Demand	Mild	ADRB1	57	37
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000819468683	GI	On-Demand	Mild	CASR	42	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000819468683	GI	On-Demand	Mild	CYP2D6	17	41
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819468690	FI	On-Demand	Mild	P2RY1	40	36
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819468691	FI	On-Demand	Mild	P2RY1	40	36
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819468692	FI	On-Demand	Mild	P2RY1	40	36
C[C@H](C#N)Oc1ccccc1NC[C@H](O)c1ccc(OC(F)(F)F)cc1	ZINC000819468693	FI	On-Demand	Mild	P2RY1	40	36
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819468694	GH	On-Demand	Mild	ADRB1	56	39
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819468694	GH	On-Demand	Mild	CASR	41	37
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819468694	GH	On-Demand	Mild	PDS	56	45
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819468695	GH	On-Demand	Mild	ADRB1	56	39
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819468695	GH	On-Demand	Mild	CASR	41	37
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819468695	GH	On-Demand	Mild	PDS	56	45
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819468696	GH	On-Demand	Mild	ADRB1	56	39
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819468696	GH	On-Demand	Mild	CASR	41	37
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819468696	GH	On-Demand	Mild	PDS	56	45
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819468697	GH	On-Demand	Mild	ADRB1	56	39
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819468697	GH	On-Demand	Mild	CASR	41	37
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819468697	GH	On-Demand	Mild	PDS	56	45
C/C=C\c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)c(OC)c1	ZINC000819468700	GH	On-Demand	Mild	ADRB2	20	60
C/C=C\c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)c(OC)c1	ZINC000819468700	GH	On-Demand	Mild	ADRB1	45	33
C/C=C/c1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)c(OC)c1	ZINC000819468701	GH	On-Demand	Mild	ADRB2	20	60
C/C=C/c1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)c(OC)c1	ZINC000819468701	GH	On-Demand	Mild	ADRB1	45	33
C/C=C\c1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)c(OC)c1	ZINC000819468702	GH	On-Demand	Mild	ADRB2	20	60
C/C=C\c1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)c(OC)c1	ZINC000819468702	GH	On-Demand	Mild	ADRB1	45	33
C/C=C/c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)c(OC)c1	ZINC000819468703	GH	On-Demand	Mild	ADRB2	20	60
C/C=C/c1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)c(OC)c1	ZINC000819468703	GH	On-Demand	Mild	ADRB1	45	33
Cc1nc2cc(NC[C@@](C)(O)C(F)(F)F)ccc2s1	ZINC000819468706	CG	On-Demand	Anodyne	ACOX1	57	32
Cc1nc2cc(NC[C@](C)(O)C(F)(F)F)ccc2s1	ZINC000819468707	CG	On-Demand	Anodyne	ACOX1	57	32
CCOC(=O)CC[C@@H](O)CNc1ccc2sc(C)nc2c1	ZINC000819468726	DF	On-Demand	Anodyne	ACOX1	91	39
CCOC(=O)CC[C@H](O)CNc1ccc2sc(C)nc2c1	ZINC000819468727	DF	On-Demand	Anodyne	ACOX1	91	39
CC(=O)c1cccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)c1	ZINC000819468740	EF	On-Demand	Anodyne	ADRB2	21	45
CC(=O)c1cccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)c1	ZINC000819468740	EF	On-Demand	Anodyne	ADRB1	20	41
CC(=O)c1cccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)c1	ZINC000819468740	EF	On-Demand	Anodyne	ABCB1	23	48
CC(=O)c1cccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)c1	ZINC000819468741	EF	On-Demand	Anodyne	ADRB2	21	45
CC(=O)c1cccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)c1	ZINC000819468741	EF	On-Demand	Anodyne	ADRB1	20	41
CC(=O)c1cccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)c1	ZINC000819468741	EF	On-Demand	Anodyne	ABCB1	23	48
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468753	EE	On-Demand	Anodyne	ADRB2	38	54
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468753	EE	On-Demand	Anodyne	ADRB1	63	54
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468753	EE	On-Demand	Anodyne	ADRB3	40	42
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468754	EE	On-Demand	Anodyne	ADRB2	38	54
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468754	EE	On-Demand	Anodyne	ADRB1	63	54
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468754	EE	On-Demand	Anodyne	ADRB3	40	42
CCOc1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468755	EF	On-Demand	Anodyne	ADRB2	24	41
CCOc1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468755	EF	On-Demand	Anodyne	ADRB1	24	40
CCOc1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468756	EF	On-Demand	Anodyne	ADRB2	24	41
CCOc1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468756	EF	On-Demand	Anodyne	ADRB1	24	40
C[C@H]1[C@H](C)N(C(=O)OC(C)(C)C)CCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819468758	GF	On-Demand	Anodyne	GPR119	25	40
C[C@@H]1[C@@H](C)N(C(=O)OC(C)(C)C)CCN1C(=O)Cc1ccc(-n2cnnc2)cc1	ZINC000819468759	GF	On-Demand	Anodyne	GPR119	25	40
Cc1nc2cc(NCCC(=O)NC(N)=O)ccc2s1	ZINC000819468761	CD	On-Demand	Anodyne	LDHA	17	40
Cc1nc2cc(NCCC(=O)NC(N)=O)ccc2s1	ZINC000819468761	CD	On-Demand	Anodyne	ACOX1	53	36
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468765	FG	On-Demand	Anodyne	ADRB2	36	41
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468765	FG	On-Demand	Anodyne	ADRB1	60	46
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468765	FG	On-Demand	Anodyne	GRIN1	22	47
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468765	FG	On-Demand	Anodyne	ADRB3	41	41
CC(=O)CCc1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468766	FG	On-Demand	Anodyne	ADRB2	36	41
CC(=O)CCc1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468766	FG	On-Demand	Anodyne	ADRB1	60	46
CC(=O)CCc1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468766	FG	On-Demand	Anodyne	GRIN1	22	47
CC(=O)CCc1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468766	FG	On-Demand	Anodyne	ADRB3	41	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468771	GI	On-Demand	Mild	ADRB2	36	42
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468771	GI	On-Demand	Mild	ADRB1	65	39
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468771	GI	On-Demand	Mild	GRIN1	24	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468771	GI	On-Demand	Mild	CASR	42	42
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468771	GI	On-Demand	Mild	CYP2D6	19	42
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468772	GI	On-Demand	Mild	ADRB2	36	42
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468772	GI	On-Demand	Mild	ADRB1	65	39
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468772	GI	On-Demand	Mild	GRIN1	24	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468772	GI	On-Demand	Mild	CASR	42	42
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468772	GI	On-Demand	Mild	CYP2D6	19	42
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468773	GI	On-Demand	Mild	ADRB2	36	42
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468773	GI	On-Demand	Mild	ADRB1	65	39
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468773	GI	On-Demand	Mild	GRIN1	24	41
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468773	GI	On-Demand	Mild	CASR	42	42
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468773	GI	On-Demand	Mild	CYP2D6	19	42
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468774	GI	On-Demand	Mild	ADRB2	36	42
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468774	GI	On-Demand	Mild	ADRB1	65	39
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468774	GI	On-Demand	Mild	GRIN1	24	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468774	GI	On-Demand	Mild	CASR	42	42
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000819468774	GI	On-Demand	Mild	CYP2D6	19	42
CC(=O)c1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468775	EF	On-Demand	Anodyne	ADRB2	22	43
CC(=O)c1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468775	EF	On-Demand	Anodyne	ADRB1	35	40
CC(=O)c1ccc(OC[C@@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468775	EF	On-Demand	Anodyne	ABCB1	15	47
CC(=O)c1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468776	EF	On-Demand	Anodyne	ADRB2	22	43
CC(=O)c1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468776	EF	On-Demand	Anodyne	ADRB1	35	40
CC(=O)c1ccc(OC[C@H](O)CNc2cc3c(cc2C)OCO3)cc1	ZINC000819468776	EF	On-Demand	Anodyne	ABCB1	15	47
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1F	ZINC000819468778	EF	On-Demand	Mild	ADRB2	25	45
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1F	ZINC000819468778	EF	On-Demand	Mild	ADRB1	63	46
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1F	ZINC000819468778	EF	On-Demand	Mild	CASR	40	37
COCCOc1ccc(C#N)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819468779	EG	On-Demand	Mild	ADRB1	27	42
COCCOc1ccc(C#N)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819468779	EG	On-Demand	Mild	ADRB3	41	42
COCCOc1ccc(C#N)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819468779	EG	On-Demand	Mild	IGF1R	28	40
COCCOc1ccc(C#N)cc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819468779	EG	On-Demand	Mild	CYP3A4	48	40
COCCOc1ccc(C#N)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819468780	EG	On-Demand	Mild	ADRB1	27	42
COCCOc1ccc(C#N)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819468780	EG	On-Demand	Mild	ADRB3	41	42
COCCOc1ccc(C#N)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819468780	EG	On-Demand	Mild	IGF1R	28	40
COCCOc1ccc(C#N)cc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819468780	EG	On-Demand	Mild	CYP3A4	48	40
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(C#N)cc3)cc2C1	ZINC000819468797	EF	On-Demand	Mild	ADRB1	41	38
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(C#N)cc3)cc2C1	ZINC000819468798	EF	On-Demand	Mild	ADRB1	41	38
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(C#N)cc3)cc2C1	ZINC000819468799	EF	On-Demand	Mild	ADRB1	41	38
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(C#N)cc3)cc2C1	ZINC000819468800	EF	On-Demand	Mild	ADRB1	41	38
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccccc3)cc2C1	ZINC000819468809	DF	On-Demand	Anodyne	ADRB2	54	48
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccccc3)cc2C1	ZINC000819468809	DF	On-Demand	Anodyne	ADRB1	76	43
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccccc3)cc2C1	ZINC000819468809	DF	On-Demand	Anodyne	ADRB3	50	43
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccccc3)cc2C1	ZINC000819468809	DF	On-Demand	Anodyne	CASR	23	41
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3)cc2C1	ZINC000819468810	DF	On-Demand	Anodyne	ADRB2	54	48
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3)cc2C1	ZINC000819468810	DF	On-Demand	Anodyne	ADRB1	76	43
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3)cc2C1	ZINC000819468810	DF	On-Demand	Anodyne	ADRB3	50	43
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3)cc2C1	ZINC000819468810	DF	On-Demand	Anodyne	CASR	23	41
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3)cc2C1	ZINC000819468811	DF	On-Demand	Anodyne	ADRB2	54	48
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3)cc2C1	ZINC000819468811	DF	On-Demand	Anodyne	ADRB1	76	43
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3)cc2C1	ZINC000819468811	DF	On-Demand	Anodyne	ADRB3	50	43
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3)cc2C1	ZINC000819468811	DF	On-Demand	Anodyne	CASR	23	41
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccccc3)cc2C1	ZINC000819468812	DF	On-Demand	Anodyne	ADRB2	54	48
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccccc3)cc2C1	ZINC000819468812	DF	On-Demand	Anodyne	ADRB1	76	43
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccccc3)cc2C1	ZINC000819468812	DF	On-Demand	Anodyne	ADRB3	50	43
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccccc3)cc2C1	ZINC000819468812	DF	On-Demand	Anodyne	CASR	23	41
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccccc1C	ZINC000819468817	FF	On-Demand	Mild	ADRB2	22	46
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccccc1C	ZINC000819468817	FF	On-Demand	Mild	ADRB1	58	36
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccccc1C	ZINC000819468817	FF	On-Demand	Mild	CASR	42	38
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819468818	FF	On-Demand	Mild	ADRB2	22	46
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819468818	FF	On-Demand	Mild	ADRB1	58	36
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819468818	FF	On-Demand	Mild	CASR	42	38
O=C(Cc1nsc2ccccc12)N1CC[C@@](O)(c2ccc(F)cc2)C1	ZINC000819468864	FG	On-Demand	Anodyne	DRD2	26	43
O=C(Cc1nsc2ccccc12)N1CC[C@](O)(c2ccc(F)cc2)C1	ZINC000819468865	FG	On-Demand	Anodyne	DRD2	26	43
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1cccc(C)c1	ZINC000819468870	FF	On-Demand	Mild	ADRB2	20	48
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1cccc(C)c1	ZINC000819468870	FF	On-Demand	Mild	ADRB1	33	48
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819468871	FF	On-Demand	Mild	ADRB2	20	48
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819468871	FF	On-Demand	Mild	ADRB1	33	48
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1F	ZINC000819468880	EF	On-Demand	Mild	ADRB2	25	45
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1F	ZINC000819468880	EF	On-Demand	Mild	ADRB1	63	46
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccccc1F	ZINC000819468880	EF	On-Demand	Mild	CASR	40	37
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1F	ZINC000819468881	EF	On-Demand	Mild	ADRB2	25	45
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1F	ZINC000819468881	EF	On-Demand	Mild	ADRB1	63	46
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1F	ZINC000819468881	EF	On-Demand	Mild	CASR	40	37
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1F	ZINC000819468882	EF	On-Demand	Mild	ADRB2	25	45
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1F	ZINC000819468882	EF	On-Demand	Mild	ADRB1	63	46
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccccc1F	ZINC000819468882	EF	On-Demand	Mild	CASR	40	37
O=C([C@H]1CCCN1C(=O)OCC(F)(F)F)N1CC2(CCOCC2)C1	ZINC000819468900	FD	On-Demand	Anodyne	PREP	32	40
O=C([C@@H]1CCCN1C(=O)OCC(F)(F)F)N1CC2(CCOCC2)C1	ZINC000819468902	FD	On-Demand	Anodyne	PREP	32	40
Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468906	EG	On-Demand	Mild	ADRB2	46	51
Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468906	EG	On-Demand	Mild	ADRB1	68	42
Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468906	EG	On-Demand	Mild	CASR	41	37
Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468907	EG	On-Demand	Mild	ADRB2	46	51
Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468907	EG	On-Demand	Mild	ADRB1	68	42
Cc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468907	EG	On-Demand	Mild	CASR	41	37
Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468909	EG	On-Demand	Mild	ADRB2	46	51
Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468909	EG	On-Demand	Mild	ADRB1	68	42
Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819468909	EG	On-Demand	Mild	CASR	41	37
Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468910	EG	On-Demand	Mild	ADRB2	46	51
Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468910	EG	On-Demand	Mild	ADRB1	68	42
Cc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819468910	EG	On-Demand	Mild	CASR	41	37
C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)CNC(=O)c1cccs1	ZINC000819468920	GH	On-Demand	Anodyne	NOS1	30	46
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)CNC(=O)c1cccs1	ZINC000819468923	GH	On-Demand	Anodyne	NOS1	30	46
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ncn(-c2ccccc2)n1	ZINC000819468928	HI	On-Demand	Anodyne	AVPR2	36	42
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc(Br)c1	ZINC000819468942	GH	On-Demand	Mild	ADRB2	30	41
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc(Br)c1	ZINC000819468942	GH	On-Demand	Mild	ADRB1	57	41
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc(Br)c1	ZINC000819468942	GH	On-Demand	Mild	CASR	40	37
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc(Br)c1	ZINC000819468942	GH	On-Demand	Mild	PDS	37	40
C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)CCNS(=O)(=O)c1ccccc1	ZINC000819468944	IH	On-Demand	Anodyne	SFRP1	58	32
C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)CCNS(=O)(=O)c1ccccc1	ZINC000819468944	IH	On-Demand	Anodyne	WNT3	48	32
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc(Br)c1	ZINC000819468945	GH	On-Demand	Mild	ADRB2	30	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc(Br)c1	ZINC000819468945	GH	On-Demand	Mild	ADRB1	57	41
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc(Br)c1	ZINC000819468945	GH	On-Demand	Mild	CASR	40	37
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc(Br)c1	ZINC000819468945	GH	On-Demand	Mild	PDS	37	40
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc(Br)c1	ZINC000819468946	GH	On-Demand	Mild	ADRB2	30	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc(Br)c1	ZINC000819468946	GH	On-Demand	Mild	ADRB1	57	41
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc(Br)c1	ZINC000819468946	GH	On-Demand	Mild	CASR	40	37
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc(Br)c1	ZINC000819468946	GH	On-Demand	Mild	PDS	37	40
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)CCNS(=O)(=O)c1ccccc1	ZINC000819468947	IH	On-Demand	Anodyne	SFRP1	58	32
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)CCNS(=O)(=O)c1ccccc1	ZINC000819468947	IH	On-Demand	Anodyne	WNT3	48	32
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc(Br)c1	ZINC000819468948	GH	On-Demand	Mild	ADRB2	30	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc(Br)c1	ZINC000819468948	GH	On-Demand	Mild	ADRB1	57	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc(Br)c1	ZINC000819468948	GH	On-Demand	Mild	CASR	40	37
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc(Br)c1	ZINC000819468948	GH	On-Demand	Mild	PDS	37	40
NS(=O)(=O)c1ccc(F)c(C(=O)N2CC3(CCOCC3)C2)c1	ZINC000819468949	EC	On-Demand	Anodyne	CA2	19	41
NS(=O)(=O)c1ccc(F)c(C(=O)N2CC3(CCOCC3)C2)c1	ZINC000819468949	EC	On-Demand	Anodyne	CA1	15	41
NS(=O)(=O)c1ccc(F)c(C(=O)N2CC3(CCOCC3)C2)c1	ZINC000819468949	EC	On-Demand	Anodyne	CA4	19	41
Cc1cc2c(cc1NC[C@@H](O)COc1cccc3[nH]ccc13)OCO2	ZINC000819468953	EG	On-Demand	Anodyne	ADRB2	19	58
Cc1cc2c(cc1NC[C@@H](O)COc1cccc3[nH]ccc13)OCO2	ZINC000819468953	EG	On-Demand	Anodyne	ADRB1	20	58
Cc1cc2c(cc1NC[C@@H](O)COc1cccc3[nH]ccc13)OCO2	ZINC000819468953	EG	On-Demand	Anodyne	HTR1A	15	59
Cc1cc2c(cc1NC[C@@H](O)COc1cccc3[nH]ccc13)OCO2	ZINC000819468953	EG	On-Demand	Anodyne	SLC6A4	18	43
Cc1cc2c(cc1NC[C@@H](O)COc1cccc3[nH]ccc13)OCO2	ZINC000819468953	EG	On-Demand	Anodyne	CYP2D6	18	46
Cc1cc2c(cc1NC[C@H](O)COc1cccc3[nH]ccc13)OCO2	ZINC000819468955	EG	On-Demand	Anodyne	ADRB2	19	58
Cc1cc2c(cc1NC[C@H](O)COc1cccc3[nH]ccc13)OCO2	ZINC000819468955	EG	On-Demand	Anodyne	ADRB1	20	58
Cc1cc2c(cc1NC[C@H](O)COc1cccc3[nH]ccc13)OCO2	ZINC000819468955	EG	On-Demand	Anodyne	HTR1A	15	59
Cc1cc2c(cc1NC[C@H](O)COc1cccc3[nH]ccc13)OCO2	ZINC000819468955	EG	On-Demand	Anodyne	SLC6A4	18	43
Cc1cc2c(cc1NC[C@H](O)COc1cccc3[nH]ccc13)OCO2	ZINC000819468955	EG	On-Demand	Anodyne	CYP2D6	18	46
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(C2(C#N)CC2)cc1	ZINC000819468959	GK	On-Demand	Mild	AVPR2	50	45
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1cccc2c1OCO2	ZINC000819468961	EE	On-Demand	Bother	ADRB1	42	33
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1cccc2c1OCO2	ZINC000819468963	EE	On-Demand	Bother	ADRB1	42	33
Cc1nc2cc(NCCS(C)(=O)=O)ccc2s1	ZINC000819468981	CE	On-Demand	Anodyne	ACOX1	41	33
Cc1nc2cc(NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)ccc2s1	ZINC000819468982	FG	On-Demand	Anodyne	ACOX1	80	38
Cc1nc2cc(NC[C@H](O)CN(C)C(=O)OC(C)(C)C)ccc2s1	ZINC000819468983	FG	On-Demand	Anodyne	ACOX1	80	38
CCOc1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468984	EF	On-Demand	Anodyne	ADRB2	35	40
CCOc1ccc(OC[C@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468984	EF	On-Demand	Anodyne	ADRB1	46	38
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(F)c(C#N)c1	ZINC000819468985	GJ	On-Demand	Mild	AVPR2	44	47
CCOc1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468986	EF	On-Demand	Anodyne	ADRB2	35	40
CCOc1ccc(OC[C@@H](O)CNc2cccc3c2OCO3)cc1	ZINC000819468986	EF	On-Demand	Anodyne	ADRB1	46	38
C/C(=C/C(=O)N1CC2(CCOCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819468987	EH	On-Demand	Anodyne	ITGAL	40	33
C/C(=C/C(=O)N1CC2(CCOCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819468987	EH	On-Demand	Anodyne	CACNA1B	36	41
C/C(=C/C(=O)N1CC2(CCOCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819468987	EH	On-Demand	Anodyne	CCR2	48	39
C/C(=C\C(=O)N1CC2(CCOCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819468989	EH	On-Demand	Anodyne	ITGAL	40	33
C/C(=C\C(=O)N1CC2(CCOCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819468989	EH	On-Demand	Anodyne	CACNA1B	36	41
C/C(=C\C(=O)N1CC2(CCOCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000819468989	EH	On-Demand	Anodyne	CCR2	48	39
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cc(N2CCOCC2)ccn1	ZINC000819469004	HH	On-Demand	Anodyne	AVPR2	15	41
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cccc(C(=O)N(C)C)c1	ZINC000819469007	HI	On-Demand	Anodyne	AVPR2	53	41
Cc1nc2cc(NC[C@H](O)CC(F)(F)F)ccc2s1	ZINC000819469014	CG	On-Demand	Anodyne	ACOX1	87	36
Cc1nc2cc(NC[C@@H](O)CC(F)(F)F)ccc2s1	ZINC000819469016	CG	On-Demand	Anodyne	ACOX1	87	36
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cccc([N+](=O)[O-])c1O	ZINC000819469018	GI	On-Demand	Bother	AVPR2	35	44
O=C(c1cc(-c2ccncc2)nc2ccc(Br)cc12)N1CC2(CCOCC2)C1	ZINC000819469045	II	On-Demand	Anodyne	PRS	76	49
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cnn(C(C)(C)C)c1	ZINC000819469055	GJ	On-Demand	Anodyne	AVPR2	38	42
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cc2c(nc1O)CCCCC2	ZINC000819469056	HK	On-Demand	Anodyne	AVPR2	31	41
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cc(F)c(O)c(F)c1	ZINC000819469069	GJ	On-Demand	Anodyne	AVPR2	43	45
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819469084	FF	On-Demand	Mild	ADRB1	57	38
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819469085	FF	On-Demand	Mild	ADRB1	57	38
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cccc([N+](=O)[O-])c3)cc2C1	ZINC000819469097	FF	On-Demand	Bother	ADRB1	26	44
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cccc([N+](=O)[O-])c3)cc2C1	ZINC000819469097	FF	On-Demand	Bother	CACNA1D	50	37
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cccc([N+](=O)[O-])c3)cc2C1	ZINC000819469098	FF	On-Demand	Bother	ADRB1	26	44
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cccc([N+](=O)[O-])c3)cc2C1	ZINC000819469098	FF	On-Demand	Bother	CACNA1D	50	37
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cccc([N+](=O)[O-])c3)cc2C1	ZINC000819469099	FF	On-Demand	Bother	ADRB1	26	44
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cccc([N+](=O)[O-])c3)cc2C1	ZINC000819469099	FF	On-Demand	Bother	CACNA1D	50	37
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cccc([N+](=O)[O-])c3)cc2C1	ZINC000819469100	FF	On-Demand	Bother	ADRB1	26	44
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cccc([N+](=O)[O-])c3)cc2C1	ZINC000819469100	FF	On-Demand	Bother	CACNA1D	50	37
CC(C)[C@H]1CCCN1c1ccc(NC(=O)C[C@@H](C)n2cccn2)cc1F	ZINC000819469108	FI	On-Demand	Anodyne	NPY2R	70	36
CC(C)[C@H]1CCCN1c1ccc(NC(=O)C[C@H](C)n2cccn2)cc1F	ZINC000819469109	FI	On-Demand	Anodyne	NPY2R	70	36
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819469118	GH	On-Demand	Mild	ADRB2	27	48
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819469118	GH	On-Demand	Mild	ADRB1	41	36
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819469118	GH	On-Demand	Mild	CASR	48	42
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccc2ccccc2c1	ZINC000819469118	GH	On-Demand	Mild	CYP2D6	25	42
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819469119	GH	On-Demand	Mild	ADRB2	27	48
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819469119	GH	On-Demand	Mild	ADRB1	41	36
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819469119	GH	On-Demand	Mild	CASR	48	42
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccc2ccccc2c1	ZINC000819469119	GH	On-Demand	Mild	CYP2D6	25	42
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(C)cc3)cc2C1	ZINC000819469125	EF	On-Demand	Anodyne	ADRB2	35	49
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(C)cc3)cc2C1	ZINC000819469125	EF	On-Demand	Anodyne	ADRB1	52	45
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(C)cc3)cc2C1	ZINC000819469126	EF	On-Demand	Anodyne	ADRB2	35	49
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(C)cc3)cc2C1	ZINC000819469126	EF	On-Demand	Anodyne	ADRB1	52	45
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(C)cc3)cc2C1	ZINC000819469127	EF	On-Demand	Anodyne	ADRB2	35	49
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(C)cc3)cc2C1	ZINC000819469127	EF	On-Demand	Anodyne	ADRB1	52	45
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(C)cc3)cc2C1	ZINC000819469128	EF	On-Demand	Anodyne	ADRB2	35	49
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(C)cc3)cc2C1	ZINC000819469128	EF	On-Demand	Anodyne	ADRB1	52	45
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819469139	FF	On-Demand	Mild	ADRB2	22	44
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819469140	FF	On-Demand	Mild	ADRB2	22	44
COCCNC(=O)c1ccccc1NC(=O)COCc1ccccc1	ZINC000819469145	EE	On-Demand	Anodyne	FAS	23	41
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(CC#N)cc3)cc2C1	ZINC000819469146	FF	On-Demand	Mild	ADRB1	55	39
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(CC#N)cc3)cc2C1	ZINC000819469147	FF	On-Demand	Mild	ADRB1	55	39
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(CC#N)cc3)cc2C1	ZINC000819469148	FF	On-Demand	Mild	ADRB1	55	39
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(CC#N)cc3)cc2C1	ZINC000819469149	FF	On-Demand	Mild	ADRB1	55	39
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819469169	GF	On-Demand	Mild	ADRB2	15	53
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819469169	GF	On-Demand	Mild	ADRB1	48	53
COCCOc1ccc(C#N)cc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819469169	GF	On-Demand	Mild	CYP2D6	19	41
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819469170	GF	On-Demand	Mild	ADRB2	15	53
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819469170	GF	On-Demand	Mild	ADRB1	48	53
COCCOc1ccc(C#N)cc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819469170	GF	On-Demand	Mild	CYP2D6	19	41
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccccc3Cl)cc2C1	ZINC000819469177	EG	On-Demand	Anodyne	ADRB2	26	44
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3Cl)cc2C1	ZINC000819469178	EG	On-Demand	Anodyne	ADRB2	26	44
O[C@H](CNc1cccc2c1OCO2)COc1ccccc1	ZINC000819469203	CE	On-Demand	Anodyne	ADRB2	41	48
O[C@H](CNc1cccc2c1OCO2)COc1ccccc1	ZINC000819469203	CE	On-Demand	Anodyne	ADRB1	56	41
O[C@H](CNc1cccc2c1OCO2)COc1ccccc1	ZINC000819469203	CE	On-Demand	Anodyne	ADRB3	36	41
O[C@@H](CNc1cccc2c1OCO2)COc1ccccc1	ZINC000819469204	CE	On-Demand	Anodyne	ADRB2	41	48
O[C@@H](CNc1cccc2c1OCO2)COc1ccccc1	ZINC000819469204	CE	On-Demand	Anodyne	ADRB1	56	41
O[C@@H](CNc1cccc2c1OCO2)COc1ccccc1	ZINC000819469204	CE	On-Demand	Anodyne	ADRB3	36	41
COCCc1ccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819469207	FH	On-Demand	Anodyne	ADRB2	43	52
COCCc1ccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819469207	FH	On-Demand	Anodyne	ADRB1	64	52
COCCc1ccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819469207	FH	On-Demand	Anodyne	ADRB3	47	43
COCCc1ccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819469207	FH	On-Demand	Anodyne	ACOX1	104	44
COCCc1ccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819469208	FH	On-Demand	Anodyne	ADRB2	43	52
COCCc1ccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819469208	FH	On-Demand	Anodyne	ADRB1	64	52
COCCc1ccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819469208	FH	On-Demand	Anodyne	ADRB3	47	43
COCCc1ccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)cc1	ZINC000819469208	FH	On-Demand	Anodyne	ACOX1	104	44
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Br)cc1	ZINC000819469209	GH	On-Demand	Mild	ADRB2	38	42
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Br)cc1	ZINC000819469209	GH	On-Demand	Mild	ADRB1	67	36
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Br)cc1	ZINC000819469210	GH	On-Demand	Mild	ADRB2	38	42
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Br)cc1	ZINC000819469210	GH	On-Demand	Mild	ADRB1	67	36
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Br)cc1	ZINC000819469211	GH	On-Demand	Mild	ADRB2	38	42
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(Br)cc1	ZINC000819469211	GH	On-Demand	Mild	ADRB1	67	36
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Br)cc1	ZINC000819469212	GH	On-Demand	Mild	ADRB2	38	42
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(Br)cc1	ZINC000819469212	GH	On-Demand	Mild	ADRB1	67	36
Cc1cc2c(cc1NC[C@@H](O)c1cccnc1)OCO2	ZINC000819469217	CE	On-Demand	Anodyne	ADRB3	63	41
Cc1cc2c(cc1NC[C@H](O)c1cccnc1)OCO2	ZINC000819469218	CE	On-Demand	Anodyne	ADRB3	63	41
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COCc1cccs1	ZINC000819469223	EG	On-Demand	Mild	ADRB1	40	30
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COCc1cccs1	ZINC000819469224	EG	On-Demand	Mild	ADRB1	40	30
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COCc1cccs1	ZINC000819469225	EG	On-Demand	Mild	ADRB1	40	30
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COCc1cccs1	ZINC000819469226	EG	On-Demand	Mild	ADRB1	40	30
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469227	FI	On-Demand	Mild	ADRB2	38	42
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469227	FI	On-Demand	Mild	ADRB1	66	37
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469227	FI	On-Demand	Mild	ADRB3	20	40
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469227	FI	On-Demand	Mild	CASR	41	38
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469227	FI	On-Demand	Mild	CYP2D6	22	40
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469228	FI	On-Demand	Mild	ADRB2	38	42
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469228	FI	On-Demand	Mild	ADRB1	66	37
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469228	FI	On-Demand	Mild	ADRB3	20	40
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469228	FI	On-Demand	Mild	CASR	41	38
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469228	FI	On-Demand	Mild	CYP2D6	22	40
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469229	FI	On-Demand	Mild	ADRB2	38	42
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469229	FI	On-Demand	Mild	ADRB1	66	37
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469229	FI	On-Demand	Mild	ADRB3	20	40
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469229	FI	On-Demand	Mild	CASR	41	38
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469229	FI	On-Demand	Mild	CYP2D6	22	40
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469230	FI	On-Demand	Mild	ADRB2	38	42
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469230	FI	On-Demand	Mild	ADRB1	66	37
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469230	FI	On-Demand	Mild	ADRB3	20	40
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469230	FI	On-Demand	Mild	CASR	41	38
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1ccc(C(C)(C)C)cc1	ZINC000819469230	FI	On-Demand	Mild	CYP2D6	22	40
Cc1nc2cc(NCCC(=O)Nc3ccc(N4CCCC4=O)cc3)ccc2s1	ZINC000819469233	GI	On-Demand	Anodyne	ACOX1	56	41
CCOC[C@H](O)CNc1ccc2sc(C)nc2c1	ZINC000819469236	CE	On-Demand	Anodyne	ACOX1	94	40
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819469238	FF	On-Demand	Mild	ADRB2	24	42
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819469238	FF	On-Demand	Mild	ADRB1	61	43
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819469238	FF	On-Demand	Mild	CASR	40	36
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819469238	FF	On-Demand	Mild	PDS	17	44
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819469239	FF	On-Demand	Mild	ADRB2	24	42
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819469239	FF	On-Demand	Mild	ADRB1	61	43
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819469239	FF	On-Demand	Mild	CASR	40	36
C[C@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819469239	FF	On-Demand	Mild	PDS	17	44
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819469240	FF	On-Demand	Mild	ADRB2	24	42
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819469240	FF	On-Demand	Mild	ADRB1	61	43
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819469240	FF	On-Demand	Mild	CASR	40	36
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819469240	FF	On-Demand	Mild	PDS	17	44
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819469241	FF	On-Demand	Mild	ADRB2	24	42
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819469241	FF	On-Demand	Mild	ADRB1	61	43
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819469241	FF	On-Demand	Mild	CASR	40	36
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819469241	FF	On-Demand	Mild	PDS	17	44
CCOc1cc2c(cc1/C=C\C(=O)Nc1ccccc1C(=O)NCCOC)O[C@@H](C)C2	ZINC000819469242	HG	On-Demand	Anodyne	HCN1	47	31
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccccc3Cl)cc2C1	ZINC000819469243	EG	On-Demand	Anodyne	ADRB2	26	44
CCOc1cc2c(cc1/C=C\C(=O)Nc1ccccc1C(=O)NCCOC)O[C@H](C)C2	ZINC000819469244	HG	On-Demand	Anodyne	HCN1	47	31
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3Cl)cc2C1	ZINC000819469245	EG	On-Demand	Anodyne	ADRB2	26	44
O=C(/C=C/[C@H]1CCCO1)NC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1	ZINC000819469247	GC	On-Demand	Anodyne	PKM	40	45
O=C(/C=C\[C@H]1CCCO1)NC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1	ZINC000819469248	GC	On-Demand	Anodyne	PKM	40	45
O=C(/C=C\[C@@H]1CCCO1)NC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1	ZINC000819469250	GC	On-Demand	Anodyne	PKM	40	45
O=C(/C=C/[C@@H]1CCCO1)NC1CN(S(=O)(=O)c2ccc3c(c2)OCCO3)C1	ZINC000819469253	GC	On-Demand	Anodyne	PKM	40	45
CCOc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819469258	FG	On-Demand	Mild	ADRB2	42	42
CCOc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819469258	FG	On-Demand	Mild	ADRB1	67	36
CCOc1ccc(OC[C@@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819469258	FG	On-Demand	Mild	CASR	41	36
CCOc1ccc(OC[C@@H](O)CNc2ccc3c(c2)C[C@H](OC)C3)cc1	ZINC000819469263	FG	On-Demand	Anodyne	ADRB1	53	39
CCOc1ccc(OC[C@H](O)CNc2ccc3c(c2)C[C@@H](OC)C3)cc1	ZINC000819469264	FG	On-Demand	Anodyne	ADRB1	53	39
CCOc1ccc(OC[C@@H](O)CNc2ccc3c(c2)C[C@@H](OC)C3)cc1	ZINC000819469265	FG	On-Demand	Anodyne	ADRB1	53	39
CCOc1ccc(OC[C@H](O)CNc2ccc3c(c2)C[C@H](OC)C3)cc1	ZINC000819469266	FG	On-Demand	Anodyne	ADRB1	53	39
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3C)cc2C1	ZINC000819469267	EF	On-Demand	Anodyne	ADRB2	28	51
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3C)cc2C1	ZINC000819469267	EF	On-Demand	Anodyne	CYP2D6	18	42
CCOc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819469268	FG	On-Demand	Mild	ADRB2	42	42
CCOc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819469268	FG	On-Demand	Mild	ADRB1	67	36
CCOc1ccc(OC[C@@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819469268	FG	On-Demand	Mild	CASR	41	36
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccccc3C)cc2C1	ZINC000819469269	EF	On-Demand	Anodyne	ADRB2	28	51
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccccc3C)cc2C1	ZINC000819469269	EF	On-Demand	Anodyne	CYP2D6	18	42
CCOc1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819469270	FG	On-Demand	Mild	ADRB2	42	42
CCOc1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819469270	FG	On-Demand	Mild	ADRB1	67	36
CCOc1ccc(OC[C@H](O)CNc2ccccc2O[C@H](C)C#N)cc1	ZINC000819469270	FG	On-Demand	Mild	CASR	41	36
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccccc3C)cc2C1	ZINC000819469271	EF	On-Demand	Anodyne	ADRB2	28	51
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccccc3C)cc2C1	ZINC000819469271	EF	On-Demand	Anodyne	CYP2D6	18	42
CCOc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819469272	FG	On-Demand	Mild	ADRB2	42	42
CCOc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819469272	FG	On-Demand	Mild	ADRB1	67	36
CCOc1ccc(OC[C@H](O)CNc2ccccc2O[C@@H](C)C#N)cc1	ZINC000819469272	FG	On-Demand	Mild	CASR	41	36
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3C)cc2C1	ZINC000819469273	EF	On-Demand	Anodyne	ADRB2	28	51
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3C)cc2C1	ZINC000819469273	EF	On-Demand	Anodyne	CYP2D6	18	42
COCCOc1ccc(C#N)cc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819469279	FF	On-Demand	Mild	CACNA1C	44	38
COCCOc1ccc(C#N)cc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819469279	FF	On-Demand	Mild	CACNA1D	69	38
COCCOc1ccc(C#N)cc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819469281	FF	On-Demand	Mild	CACNA1C	44	38
COCCOc1ccc(C#N)cc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819469281	FF	On-Demand	Mild	CACNA1D	69	38
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)c1	ZINC000819469284	FH	On-Demand	Anodyne	ADRB2	30	43
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)c1	ZINC000819469284	FH	On-Demand	Anodyne	ADRB1	43	38
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)c1	ZINC000819469284	FH	On-Demand	Anodyne	ADRB3	28	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)c1	ZINC000819469284	FH	On-Demand	Anodyne	ACOX1	113	50
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc3sc(C)nc3c2)c1	ZINC000819469284	FH	On-Demand	Anodyne	ABCB1	17	44
CC(=O)c1cccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)c1	ZINC000819469286	FH	On-Demand	Anodyne	ADRB2	30	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)c1	ZINC000819469286	FH	On-Demand	Anodyne	ADRB1	43	38
CC(=O)c1cccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)c1	ZINC000819469286	FH	On-Demand	Anodyne	ADRB3	28	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)c1	ZINC000819469286	FH	On-Demand	Anodyne	ACOX1	113	50
CC(=O)c1cccc(OC[C@H](O)CNc2ccc3sc(C)nc3c2)c1	ZINC000819469286	FH	On-Demand	Anodyne	ABCB1	17	44
COCCOc1ccc(C#N)cc1NC[C@H](O)c1ccccc1	ZINC000819469293	DF	On-Demand	Mild	CTRB_BOVIN	47	34
COCCOc1ccc(C#N)cc1NC[C@@H](O)c1ccccc1	ZINC000819469294	DF	On-Demand	Mild	CTRB_BOVIN	47	34
COC[C@@H](O)CNc1ccc2sc(C)nc2c1	ZINC000819469296	CE	On-Demand	Anodyne	ACOX1	96	41
Cc1nc2cc(NC[C@H](O)CCNC(=O)OC(C)(C)C)ccc2s1	ZINC000819469310	FG	On-Demand	Anodyne	ACOX1	88	38
Cc1nc2cc(NC[C@@H](O)CCNC(=O)OC(C)(C)C)ccc2s1	ZINC000819469312	FG	On-Demand	Anodyne	ACOX1	88	38
C[C@H](C#N)Oc1ccccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819469331	DC	On-Demand	Mild	ABCB1	45	35
C[C@@H](C#N)Oc1ccccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819469333	DC	On-Demand	Mild	ABCB1	45	35
C[C@H](C#N)Oc1ccccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819469334	DC	On-Demand	Mild	ABCB1	45	35
C[C@@H](C#N)Oc1ccccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819469336	DC	On-Demand	Mild	ABCB1	45	35
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@@H](O)C(F)(F)F)cc1	ZINC000819469347	FF	On-Demand	Anodyne	ADRB1	16	44
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@H](O)C(F)(F)F)cc1	ZINC000819469348	FF	On-Demand	Anodyne	ADRB1	16	44
O=C(c1ccc(-c2nnc(S)o2)cc1)N1CC2(CCOCC2)C1	ZINC000819469427	EE	On-Demand	Anodyne	CYP73A16	55	39
COC(=O)c1cc(C(=O)N2CCCc3cc(N4CCCC[C@@H]4C)ccc32)ccn1	ZINC000819469441	GH	On-Demand	Anodyne	AVPR2	40	39
COC(=O)c1cc(C(=O)N2CCCc3cc(N4CCCC[C@H]4C)ccc32)ccn1	ZINC000819469443	GH	On-Demand	Anodyne	AVPR2	40	39
O=C(/C=C/c1ccnc2ccccc12)N1CC2(CCOCC2)C1	ZINC000819469452	DF	On-Demand	Anodyne	ITGAL	52	35
O=C(/C=C\c1ccnc2ccccc12)N1CC2(CCOCC2)C1	ZINC000819469453	DF	On-Demand	Anodyne	ITGAL	52	35
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc([C@]2(C)NC(=O)NC2=O)cc1	ZINC000819469456	IH	On-Demand	Anodyne	AVPR2	37	42
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc([C@@]2(C)NC(=O)NC2=O)cc1	ZINC000819469457	IH	On-Demand	Anodyne	AVPR2	37	42
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)Cc1nn(C)c(=O)c2ccccc12	ZINC000819469470	IH	On-Demand	Anodyne	IMDH_CRYPV	27	42
C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)Cc1nn(C)c(=O)c2ccccc12	ZINC000819469471	IH	On-Demand	Anodyne	IMDH_CRYPV	27	42
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000819469480	IG	On-Demand	Anodyne	AVPR2	24	42
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000819469480	IG	On-Demand	Anodyne	CA7	15	42
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3cccc(Cl)c3)cc2C1	ZINC000819469547	EH	On-Demand	Anodyne	MTTP	44	39
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3cccc(Cl)c3)cc2C1	ZINC000819469547	EH	On-Demand	Anodyne	PTPRF	45	34
CO[C@H]1Cc2ccc(NCCC(=O)Nc3cccc(Cl)c3)cc2C1	ZINC000819469548	EH	On-Demand	Anodyne	MTTP	44	39
CO[C@H]1Cc2ccc(NCCC(=O)Nc3cccc(Cl)c3)cc2C1	ZINC000819469548	EH	On-Demand	Anodyne	PTPRF	45	34
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819469553	GH	On-Demand	Anodyne	ADRB1	18	45
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819469553	GH	On-Demand	Anodyne	ADRB3	20	45
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819469554	GH	On-Demand	Anodyne	ADRB1	18	45
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819469554	GH	On-Demand	Anodyne	ADRB3	20	45
CC(C)(C)OC(=O)N1CCC[C@@H](n2cc(C(=O)NNc3ccccn3)nn2)C1	ZINC000819469604	GE	On-Demand	Reactive	GPR119	20	41
CC(C)(C)OC(=O)N1CCC[C@H](n2cc(C(=O)NNc3ccccn3)nn2)C1	ZINC000819469605	GE	On-Demand	Reactive	GPR119	20	41
CO[C@H]1Cc2ccc(NCCC(=O)Nc3cc(C)on3)cc2C1	ZINC000819469606	DF	On-Demand	Anodyne	PTPRF	42	31
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3cc(C)on3)cc2C1	ZINC000819469607	DF	On-Demand	Anodyne	PTPRF	42	31
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819469631	FH	On-Demand	Anodyne	ADRB2	26	45
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819469631	FH	On-Demand	Anodyne	ADRB1	45	45
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819469631	FH	On-Demand	Anodyne	ADRB3	48	45
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819469631	FH	On-Demand	Anodyne	LTA4H	28	41
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819469631	FH	On-Demand	Anodyne	CTSK	17	41
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819469631	FH	On-Demand	Anodyne	FAAH	21	42
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cnn2c1CCCC2	ZINC000819469632	GI	On-Demand	Anodyne	AVPR2	34	44
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819469634	FH	On-Demand	Anodyne	ADRB2	26	45
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819469634	FH	On-Demand	Anodyne	ADRB1	45	45
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819469634	FH	On-Demand	Anodyne	ADRB3	48	45
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819469634	FH	On-Demand	Anodyne	LTA4H	28	41
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819469634	FH	On-Demand	Anodyne	CTSK	17	41
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819469634	FH	On-Demand	Anodyne	FAAH	21	42
CC(=O)Nc1ccc(O)c(C(=O)N2CCCc3cc(N4CCCC[C@@H]4C)ccc32)c1	ZINC000819469662	HI	On-Demand	Anodyne	AVPR2	46	41
CC(=O)Nc1ccc(O)c(C(=O)N2CCCc3cc(N4CCCC[C@H]4C)ccc32)c1	ZINC000819469663	HI	On-Demand	Anodyne	AVPR2	46	41
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1csc(S(C)(=O)=O)c1	ZINC000819469688	HI	On-Demand	Anodyne	AVPR2	33	40
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cccn2c(O)nnc12	ZINC000819469700	GG	On-Demand	Anodyne	AVPR2	33	42
CC(=O)c1ccc(C(=O)N2CCCc3cc(N4CCCC[C@@H]4C)ccc32)o1	ZINC000819469701	FI	On-Demand	Anodyne	AVPR2	34	41
CC(=O)c1ccc(C(=O)N2CCCc3cc(N4CCCC[C@H]4C)ccc32)o1	ZINC000819469702	FI	On-Demand	Anodyne	AVPR2	34	41
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc2nc(O)[nH]c2c1	ZINC000819469704	GI	On-Demand	Anodyne	AVPR2	41	40
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc2nnn(C)c2c1	ZINC000819469706	GH	On-Demand	Anodyne	AVPR2	34	41
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1csc(C(F)(F)F)n1	ZINC000819469724	HK	On-Demand	Anodyne	TRPC6	47	38
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1csc(C(F)(F)F)n1	ZINC000819469724	HK	On-Demand	Anodyne	TRPC3	41	38
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cccc(Oc2cnccn2)c1	ZINC000819469727	IK	On-Demand	Anodyne	AVPR2	35	41
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cccc(Oc2cnccn2)c1	ZINC000819469727	IK	On-Demand	Anodyne	GPBAR1	32	40
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1csc(NC2CC2)n1	ZINC000819469729	GJ	On-Demand	Anodyne	TRPC6	61	44
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1csc(NC2CC2)n1	ZINC000819469729	GJ	On-Demand	Anodyne	TRPC3	55	44
C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)Cc1cnn(C)c1	ZINC000819469730	FG	On-Demand	Anodyne	EIF2AK3	51	34
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)Cc1cnn(C)c1	ZINC000819469731	FG	On-Demand	Anodyne	EIF2AK3	51	34
CC(C)(C)Cc1csc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819469742	GI	On-Demand	Mild	PAPA1_CARPA	38	43
CC(C)(C)Cc1csc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819469743	GI	On-Demand	Mild	PAPA1_CARPA	38	43
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc4c(c3)CCC(=O)N4)cc2C1	ZINC000819469750	GF	On-Demand	Anodyne	ADRB1	22	41
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc4c(c3)CCC(=O)N4)cc2C1	ZINC000819469751	GF	On-Demand	Anodyne	ADRB1	22	41
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc4c(c3)CCC(=O)N4)cc2C1	ZINC000819469752	GF	On-Demand	Anodyne	ADRB1	22	41
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc4c(c3)CCC(=O)N4)cc2C1	ZINC000819469753	GF	On-Demand	Anodyne	ADRB1	22	41
CO[C@@H]1Cc2ccc(NC[C@H](O)c3ccc(C(F)(F)F)cc3)cc2C1	ZINC000819469766	FH	On-Demand	Anodyne	MTTP	39	40
CO[C@@H]1Cc2ccc(NC[C@@H](O)c3ccc(C(F)(F)F)cc3)cc2C1	ZINC000819469767	FH	On-Demand	Anodyne	MTTP	39	40
CO[C@H]1Cc2ccc(NC[C@H](O)c3ccc(C(F)(F)F)cc3)cc2C1	ZINC000819469768	FH	On-Demand	Anodyne	MTTP	39	40
CO[C@H]1Cc2ccc(NC[C@@H](O)c3ccc(C(F)(F)F)cc3)cc2C1	ZINC000819469769	FH	On-Demand	Anodyne	MTTP	39	40
COCCNC(=O)c1ccccc1NC(=O)c1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1	ZINC000819469795	JF	On-Demand	Anodyne	PRTN3	40	37
COCCNC(=O)c1ccccc1NC(=O)c1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1	ZINC000819469795	JF	On-Demand	Anodyne	TGM2	44	40
COCCNC(=O)c1ccccc1NC(=O)c1ccc(S(=O)(=O)N2CCC[C@H](C)C2)cc1	ZINC000819469795	JF	On-Demand	Anodyne	NAMPT	23	45
COCCNC(=O)c1ccccc1NC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1	ZINC000819469796	JF	On-Demand	Anodyne	PRTN3	40	37
COCCNC(=O)c1ccccc1NC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1	ZINC000819469796	JF	On-Demand	Anodyne	TGM2	44	40
COCCNC(=O)c1ccccc1NC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H](C)C2)cc1	ZINC000819469796	JF	On-Demand	Anodyne	NAMPT	23	45
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819469801	GG	On-Demand	Anodyne	ADRB2	33	46
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819469801	GG	On-Demand	Anodyne	ADRB1	52	42
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819469801	GG	On-Demand	Anodyne	GRIN1	15	42
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819469801	GG	On-Demand	Anodyne	ADRB3	29	42
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819469802	GG	On-Demand	Anodyne	ADRB2	33	46
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819469802	GG	On-Demand	Anodyne	ADRB1	52	42
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819469802	GG	On-Demand	Anodyne	GRIN1	15	42
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819469802	GG	On-Demand	Anodyne	ADRB3	29	42
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469812	FG	On-Demand	Anodyne	ADRB2	22	58
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469812	FG	On-Demand	Anodyne	ADRB1	29	58
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469812	FG	On-Demand	Anodyne	HTR1A	16	58
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469812	FG	On-Demand	Anodyne	SLC6A4	19	44
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469812	FG	On-Demand	Anodyne	CYP2D6	17	41
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469813	FG	On-Demand	Anodyne	ADRB2	22	58
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469813	FG	On-Demand	Anodyne	ADRB1	29	58
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469813	FG	On-Demand	Anodyne	HTR1A	16	58
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469813	FG	On-Demand	Anodyne	SLC6A4	19	44
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469813	FG	On-Demand	Anodyne	CYP2D6	17	41
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469814	FG	On-Demand	Anodyne	ADRB2	22	58
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469814	FG	On-Demand	Anodyne	ADRB1	29	58
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469814	FG	On-Demand	Anodyne	HTR1A	16	58
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469814	FG	On-Demand	Anodyne	SLC6A4	19	44
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469814	FG	On-Demand	Anodyne	CYP2D6	17	41
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469815	FG	On-Demand	Anodyne	ADRB2	22	58
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469815	FG	On-Demand	Anodyne	ADRB1	29	58
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469815	FG	On-Demand	Anodyne	HTR1A	16	58
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469815	FG	On-Demand	Anodyne	SLC6A4	19	44
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2C1	ZINC000819469815	FG	On-Demand	Anodyne	CYP2D6	17	41
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(-n2cnnn2)cc1	ZINC000819469839	HH	On-Demand	Anodyne	AVPR2	42	45
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cccc(C(N)=O)c1	ZINC000819469854	GH	On-Demand	Anodyne	AVPR2	46	43
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cc2ccccc2nc1O	ZINC000819469856	HJ	On-Demand	Anodyne	AVPR2	38	43
C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)CNC(=O)c1cccc(F)c1	ZINC000819469865	HH	On-Demand	Anodyne	DRD4	41	31
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)CNC(=O)c1cccc(F)c1	ZINC000819469866	HH	On-Demand	Anodyne	DRD4	41	31
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(-c2nnc(S)o2)cc1	ZINC000819469868	IJ	On-Demand	Anodyne	AVPR2	34	42
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(O)c([N+](=O)[O-])c1	ZINC000819469883	GI	On-Demand	Bother	AVPR2	36	42
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(-c2nc[nH]n2)cc1	ZINC000819469888	HI	On-Demand	Anodyne	AVPR2	42	43
C=CC(=O)NCc1ccc(C(=O)N2CCCc3cc(N4CCCC[C@@H]4C)ccc32)cc1	ZINC000819469889	HI	On-Demand	Anodyne	AVPR2	54	43
C=CC(=O)NCc1ccc(C(=O)N2CCCc3cc(N4CCCC[C@H]4C)ccc32)cc1	ZINC000819469890	HI	On-Demand	Anodyne	AVPR2	54	43
O=C(/C=C\c1cccc(F)c1)N1CC2(CCOCC2)C1	ZINC000819469904	CE	On-Demand	Anodyne	ITGAL	47	35
O=C(/C=C/c1cccc(F)c1)N1CC2(CCOCC2)C1	ZINC000819469905	CE	On-Demand	Anodyne	ITGAL	47	35
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(S(=O)(=O)N(C)C)cc1	ZINC000819469914	IH	On-Demand	Anodyne	AVPR2	48	45
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000819469917	GI	On-Demand	Bother	AVPR2	38	42
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(C(N)=O)o1	ZINC000819469929	FG	On-Demand	Anodyne	AVPR2	32	42
COCCOc1cc(C(=O)N2CCCc3cc(N4CCCC[C@H]4C)ccc32)ccn1	ZINC000819469932	HI	On-Demand	Anodyne	AVPR2	41	38
COCCOc1cc(C(=O)N2CCCc3cc(N4CCCC[C@@H]4C)ccc32)ccn1	ZINC000819469933	HI	On-Demand	Anodyne	AVPR2	41	38
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3ccccc3)cc2C1	ZINC000819469944	DG	On-Demand	Anodyne	HDAC8	20	40
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3ccccc3)cc2C1	ZINC000819469944	DG	On-Demand	Anodyne	HDAC10	27	40
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3ccccc3)cc2C1	ZINC000819469944	DG	On-Demand	Anodyne	HDAC2	20	40
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3ccccc3)cc2C1	ZINC000819469944	DG	On-Demand	Anodyne	HDAC3	20	40
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3ccccc3)cc2C1	ZINC000819469944	DG	On-Demand	Anodyne	HDAC6	19	40
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3ccccc3)cc2C1	ZINC000819469944	DG	On-Demand	Anodyne	PTPRF	48	37
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3ccccc3)cc2C1	ZINC000819469944	DG	On-Demand	Anodyne	HDAC11	20	40
CO[C@H]1Cc2ccc(NCCC(=O)Nc3ccccc3)cc2C1	ZINC000819469945	DG	On-Demand	Anodyne	HDAC8	20	40
CO[C@H]1Cc2ccc(NCCC(=O)Nc3ccccc3)cc2C1	ZINC000819469945	DG	On-Demand	Anodyne	HDAC10	27	40
CO[C@H]1Cc2ccc(NCCC(=O)Nc3ccccc3)cc2C1	ZINC000819469945	DG	On-Demand	Anodyne	HDAC2	20	40
CO[C@H]1Cc2ccc(NCCC(=O)Nc3ccccc3)cc2C1	ZINC000819469945	DG	On-Demand	Anodyne	HDAC3	20	40
CO[C@H]1Cc2ccc(NCCC(=O)Nc3ccccc3)cc2C1	ZINC000819469945	DG	On-Demand	Anodyne	HDAC6	19	40
CO[C@H]1Cc2ccc(NCCC(=O)Nc3ccccc3)cc2C1	ZINC000819469945	DG	On-Demand	Anodyne	PTPRF	48	37
CO[C@H]1Cc2ccc(NCCC(=O)Nc3ccccc3)cc2C1	ZINC000819469945	DG	On-Demand	Anodyne	HDAC11	20	40
CO[C@@H]1Cc2ccc(NC[C@H](O)c3ccc(Cl)cc3)cc2C1	ZINC000819469964	DH	On-Demand	Anodyne	ADRB3	20	45
CO[C@H]1Cc2ccc(NC[C@H](O)c3ccc(Cl)cc3)cc2C1	ZINC000819469966	DH	On-Demand	Anodyne	ADRB3	20	45
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819469985	FE	On-Demand	Anodyne	ADRB2	28	41
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819469985	FE	On-Demand	Anodyne	ADRB1	45	40
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819469985	FE	On-Demand	Anodyne	ADRB3	28	40
COC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819469988	FE	On-Demand	Anodyne	ADRB2	28	41
COC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819469988	FE	On-Demand	Anodyne	ADRB1	45	40
COC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819469988	FE	On-Demand	Anodyne	ADRB3	28	40
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819469990	FE	On-Demand	Anodyne	ADRB2	28	41
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819469990	FE	On-Demand	Anodyne	ADRB1	45	40
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819469990	FE	On-Demand	Anodyne	ADRB3	28	40
COC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819469992	FE	On-Demand	Anodyne	ADRB2	28	41
COC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819469992	FE	On-Demand	Anodyne	ADRB1	45	40
COC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819469992	FE	On-Demand	Anodyne	ADRB3	28	40
O[C@@H](CNc1ccc(Cc2nnc3n2CCCCC3)cc1)c1cccnc1	ZINC000819470040	FG	On-Demand	Anodyne	ADRB1	21	40
O[C@@H](CNc1ccc(Cc2nnc3n2CCCCC3)cc1)c1cccnc1	ZINC000819470040	FG	On-Demand	Anodyne	ADRB3	88	46
O[C@H](CNc1ccc(Cc2nnc3n2CCCCC3)cc1)c1cccnc1	ZINC000819470043	FG	On-Demand	Anodyne	ADRB1	21	40
O[C@H](CNc1ccc(Cc2nnc3n2CCCCC3)cc1)c1cccnc1	ZINC000819470043	FG	On-Demand	Anodyne	ADRB3	88	46
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(SC)cc3)cc2C1	ZINC000819470046	FG	On-Demand	Anodyne	ADRB1	43	38
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(SC)cc3)cc2C1	ZINC000819470048	FG	On-Demand	Anodyne	ADRB1	43	38
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(SC)cc3)cc2C1	ZINC000819470050	FG	On-Demand	Anodyne	ADRB1	43	38
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(SC)cc3)cc2C1	ZINC000819470052	FG	On-Demand	Anodyne	ADRB1	43	38
COCCNC(=O)c1ccccc1NC(=O)c1ccc(-c2ccccc2F)o1	ZINC000819470062	GH	On-Demand	Anodyne	S1PR4	34	43
O[C@@H](CNc1ccc(Cc2nnc3n2CCCCC3)cc1)c1cccc(Cl)c1	ZINC000819470098	GI	On-Demand	Anodyne	ADRB1	25	43
O[C@@H](CNc1ccc(Cc2nnc3n2CCCCC3)cc1)c1cccc(Cl)c1	ZINC000819470098	GI	On-Demand	Anodyne	ADRB3	37	40
O[C@@H](CNc1ccc(Cc2nnc3n2CCCCC3)cc1)c1cccc(Cl)c1	ZINC000819470098	GI	On-Demand	Anodyne	CYP3A4	46	35
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3cc(F)cc(F)c3)cc2C1	ZINC000819470099	EH	On-Demand	Anodyne	PTPRF	44	33
O[C@H](CNc1ccc(Cc2nnc3n2CCCCC3)cc1)c1cccc(Cl)c1	ZINC000819470100	GI	On-Demand	Anodyne	ADRB1	25	43
O[C@H](CNc1ccc(Cc2nnc3n2CCCCC3)cc1)c1cccc(Cl)c1	ZINC000819470100	GI	On-Demand	Anodyne	ADRB3	37	40
O[C@H](CNc1ccc(Cc2nnc3n2CCCCC3)cc1)c1cccc(Cl)c1	ZINC000819470100	GI	On-Demand	Anodyne	CYP3A4	46	35
CO[C@H]1Cc2ccc(NCCC(=O)Nc3cc(F)cc(F)c3)cc2C1	ZINC000819470101	EH	On-Demand	Anodyne	PTPRF	44	33
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(N2CCCC2)nn1	ZINC000819470136	HI	On-Demand	Anodyne	AVPR2	19	41
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cc(F)c(F)c(O)c1F	ZINC000819470144	HJ	On-Demand	Anodyne	AVPR2	33	42
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc[n+]([O-])c1	ZINC000819470149	FG	On-Demand	Anodyne	AVPR2	47	41
O=C(c1cc([N+](=O)[O-])ccc1N1CCCC1)N1CC2(CCOCC2)C1	ZINC000819470152	EE	On-Demand	Bother	SLC6A9	19	57
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(-c2cncnc2)cc1F	ZINC000819470162	IK	On-Demand	Anodyne	AVPR2	28	40
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc(CN2C(=O)CCC2=O)cc1	ZINC000819470171	II	On-Demand	Anodyne	AVPR2	53	48
C[C@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)[C@@H]1CCC(=O)c2ccccc21	ZINC000819470184	HK	On-Demand	Anodyne	HSD17B3	43	32
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)[C@H]1CCC(=O)c2ccccc21	ZINC000819470185	HK	On-Demand	Anodyne	HSD17B3	43	32
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)[C@@H]1CCC(=O)c2ccccc21	ZINC000819470187	HK	On-Demand	Anodyne	HSD17B3	43	32
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cc(N(C)C)ccn1	ZINC000819470193	GI	On-Demand	Anodyne	AVPR2	26	45
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1cccc(=O)n1C	ZINC000819470198	FG	On-Demand	Anodyne	AVPR2	39	40
C[C@@H]1CCCCN1c1ccc2c(c1)CCCN2C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000819470211	GI	On-Demand	Bother	AVPR2	25	41
CO[C@@H]1Cc2ccc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cc2C1	ZINC000819470249	EF	On-Demand	Bother	CACNA1C	47	39
CO[C@@H]1Cc2ccc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cc2C1	ZINC000819470249	EF	On-Demand	Bother	CACNA1D	71	39
CO[C@@H]1Cc2ccc(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2C1	ZINC000819470251	EF	On-Demand	Bother	CACNA1C	47	39
CO[C@@H]1Cc2ccc(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2C1	ZINC000819470251	EF	On-Demand	Bother	CACNA1D	71	39
CO[C@H]1Cc2ccc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cc2C1	ZINC000819470253	EF	On-Demand	Bother	CACNA1C	47	39
CO[C@H]1Cc2ccc(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cc2C1	ZINC000819470253	EF	On-Demand	Bother	CACNA1D	71	39
CO[C@H]1Cc2ccc(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2C1	ZINC000819470255	EF	On-Demand	Bother	CACNA1C	47	39
CO[C@H]1Cc2ccc(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2C1	ZINC000819470255	EF	On-Demand	Bother	CACNA1D	71	39
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)C[C@H](OC)C3)cc1	ZINC000819470269	FF	On-Demand	Anodyne	ADRB2	40	56
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)C[C@H](OC)C3)cc1	ZINC000819470269	FF	On-Demand	Anodyne	ADRB1	69	56
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)C[C@H](OC)C3)cc1	ZINC000819470269	FF	On-Demand	Anodyne	GRIN1	27	40
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)C[C@H](OC)C3)cc1	ZINC000819470269	FF	On-Demand	Anodyne	ADRB3	45	41
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)C[C@@H](OC)C3)cc1	ZINC000819470271	FF	On-Demand	Anodyne	ADRB2	40	56
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)C[C@@H](OC)C3)cc1	ZINC000819470271	FF	On-Demand	Anodyne	ADRB1	69	56
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)C[C@@H](OC)C3)cc1	ZINC000819470271	FF	On-Demand	Anodyne	GRIN1	27	40
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)C[C@@H](OC)C3)cc1	ZINC000819470271	FF	On-Demand	Anodyne	ADRB3	45	41
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)C[C@H](OC)C3)cc1	ZINC000819470273	FF	On-Demand	Anodyne	ADRB2	40	56
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)C[C@H](OC)C3)cc1	ZINC000819470273	FF	On-Demand	Anodyne	ADRB1	69	56
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)C[C@H](OC)C3)cc1	ZINC000819470273	FF	On-Demand	Anodyne	GRIN1	27	40
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)C[C@H](OC)C3)cc1	ZINC000819470273	FF	On-Demand	Anodyne	ADRB3	45	41
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)C[C@@H](OC)C3)cc1	ZINC000819470275	FF	On-Demand	Anodyne	ADRB2	40	56
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)C[C@@H](OC)C3)cc1	ZINC000819470275	FF	On-Demand	Anodyne	ADRB1	69	56
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)C[C@@H](OC)C3)cc1	ZINC000819470275	FF	On-Demand	Anodyne	GRIN1	27	40
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)C[C@@H](OC)C3)cc1	ZINC000819470275	FF	On-Demand	Anodyne	ADRB3	45	41
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@H](O)c2ccccc2F)cc1	ZINC000819470314	GH	On-Demand	Anodyne	ADRB1	18	46
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@@H](O)c2ccccc2F)cc1	ZINC000819470316	GH	On-Demand	Anodyne	ADRB1	18	46
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cccc(C(F)(F)F)c3)cc2C1	ZINC000819470326	GH	On-Demand	Anodyne	ADRB1	26	41
CO[C@H]1Cc2ccc(NC[C@H](O)COc3cccc(C(F)(F)F)c3)cc2C1	ZINC000819470326	GH	On-Demand	Anodyne	PDS	48	43
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cccc(C(F)(F)F)c3)cc2C1	ZINC000819470327	GH	On-Demand	Anodyne	ADRB1	26	41
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3cccc(C(F)(F)F)c3)cc2C1	ZINC000819470327	GH	On-Demand	Anodyne	PDS	48	43
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cccc(C(F)(F)F)c3)cc2C1	ZINC000819470329	GH	On-Demand	Anodyne	ADRB1	26	41
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3cccc(C(F)(F)F)c3)cc2C1	ZINC000819470329	GH	On-Demand	Anodyne	PDS	48	43
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cccc(C(F)(F)F)c3)cc2C1	ZINC000819470331	GH	On-Demand	Anodyne	ADRB1	26	41
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3cccc(C(F)(F)F)c3)cc2C1	ZINC000819470331	GH	On-Demand	Anodyne	PDS	48	43
O=C(N[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)C(F)=C1CCC1	ZINC000819470334	GH	On-Demand	Anodyne	CCR2	44	37
O=C(N[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O)C(F)=C1CCC1	ZINC000819470335	GH	On-Demand	Anodyne	CCR2	44	37
Cc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1NC(=O)CCN(C)C	ZINC000819470346	GH	On-Demand	Anodyne	UTS2	45	35
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccccc3[N+](=O)[O-])cc2C1	ZINC000819470351	FF	On-Demand	Bother	ADRB1	45	35
O[C@H]1CCOc2c(NC[C@@H](O)COc3cccc4[nH]ccc34)cccc21	ZINC000819470352	FF	On-Demand	Anodyne	ADRB2	15	57
O[C@H]1CCOc2c(NC[C@@H](O)COc3cccc4[nH]ccc34)cccc21	ZINC000819470352	FF	On-Demand	Anodyne	ADRB1	20	57
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3[N+](=O)[O-])cc2C1	ZINC000819470353	FF	On-Demand	Bother	ADRB1	45	35
O[C@H](CNc1cccc2c1OCC[C@H]2O)COc1cccc2[nH]ccc12	ZINC000819470354	FF	On-Demand	Anodyne	ADRB2	15	57
O[C@H](CNc1cccc2c1OCC[C@H]2O)COc1cccc2[nH]ccc12	ZINC000819470354	FF	On-Demand	Anodyne	ADRB1	20	57
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccccc3[N+](=O)[O-])cc2C1	ZINC000819470355	FF	On-Demand	Bother	ADRB1	45	35
O[C@@H](CNc1cccc2c1OCC[C@H]2O)COc1cccc2[nH]ccc12	ZINC000819470356	FF	On-Demand	Anodyne	ADRB2	15	57
O[C@@H](CNc1cccc2c1OCC[C@H]2O)COc1cccc2[nH]ccc12	ZINC000819470356	FF	On-Demand	Anodyne	ADRB1	20	57
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3[N+](=O)[O-])cc2C1	ZINC000819470357	FF	On-Demand	Bother	ADRB1	45	35
O[C@@H](CNc1cccc2c1OCC[C@@H]2O)COc1cccc2[nH]ccc12	ZINC000819470358	FF	On-Demand	Anodyne	ADRB2	15	57
O[C@@H](CNc1cccc2c1OCC[C@@H]2O)COc1cccc2[nH]ccc12	ZINC000819470358	FF	On-Demand	Anodyne	ADRB1	20	57
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3cccc(Br)c3)cc2C1	ZINC000819470401	GI	On-Demand	Anodyne	HDAC10	20	40
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3cccc(Br)c3)cc2C1	ZINC000819470401	GI	On-Demand	Anodyne	MTTP	42	35
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3cccc(Br)c3)cc2C1	ZINC000819470401	GI	On-Demand	Anodyne	PTPRF	45	34
CO[C@H]1Cc2ccc(NCCC(=O)Nc3cccc(Br)c3)cc2C1	ZINC000819470403	GI	On-Demand	Anodyne	HDAC10	20	40
CO[C@H]1Cc2ccc(NCCC(=O)Nc3cccc(Br)c3)cc2C1	ZINC000819470403	GI	On-Demand	Anodyne	MTTP	42	35
CO[C@H]1Cc2ccc(NCCC(=O)Nc3cccc(Br)c3)cc2C1	ZINC000819470403	GI	On-Demand	Anodyne	PTPRF	45	34
CO[C@H]1Cc2ccc(NCCC(=O)Nc3cccnc3)cc2C1	ZINC000819470417	DF	On-Demand	Anodyne	PTPRF	44	34
CO[C@H]1Cc2ccc(NCCC(=O)Nc3cccnc3)cc2C1	ZINC000819470417	DF	On-Demand	Anodyne	NAMPT	16	40
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3cccnc3)cc2C1	ZINC000819470419	DF	On-Demand	Anodyne	PTPRF	44	34
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3cccnc3)cc2C1	ZINC000819470419	DF	On-Demand	Anodyne	NAMPT	16	40
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3ccc(Cl)cc3)cc2C1	ZINC000819470444	EH	On-Demand	Anodyne	PTPRF	44	33
CO[C@H]1Cc2ccc(NCCC(=O)Nc3ccc(Cl)cc3)cc2C1	ZINC000819470445	EH	On-Demand	Anodyne	PTPRF	44	33
O[C@H](CNc1cccc2c1OCO2)COc1ccc(F)cc1	ZINC000819470455	DE	On-Demand	Anodyne	ADRB1	47	38
O[C@@H](CNc1cccc2c1OCO2)COc1ccc(F)cc1	ZINC000819470456	DE	On-Demand	Anodyne	ADRB1	47	38
CO[C@H]1Cc2ccc(NCCC(=O)Nc3ccc(N(C)C)cc3)cc2C1	ZINC000819470457	FG	On-Demand	Anodyne	PTPRF	43	32
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3ccc(N(C)C)cc3)cc2C1	ZINC000819470458	FG	On-Demand	Anodyne	PTPRF	43	32
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3ccc(Br)cc3)cc2C1	ZINC000819470476	GI	On-Demand	Anodyne	PTPRF	44	33
CO[C@H]1Cc2ccc(NCCC(=O)Nc3ccc(Br)cc3)cc2C1	ZINC000819470477	GI	On-Demand	Anodyne	PTPRF	44	33
O=C(/C=C/[C@H]1CCCO1)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000819470494	ED	On-Demand	Anodyne	L3MBTL3	53	40
O=C(/C=C\[C@H]1CCCO1)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000819470495	ED	On-Demand	Anodyne	L3MBTL3	53	40
O=C(/C=C/[C@@H]1CCCO1)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000819470496	ED	On-Demand	Anodyne	L3MBTL3	53	40
O=C(/C=C\[C@@H]1CCCO1)Nc1cccc(C(=O)N2CCC(O)CC2)c1	ZINC000819470497	ED	On-Demand	Anodyne	L3MBTL3	53	40
CC[C@H](O)CNc1ccc(OCCNC(=O)OC(C)(C)C)cc1	ZINC000819470510	DF	On-Demand	Anodyne	ADRB1	25	45
CO[C@H]1Cc2ccc(NCCC(=O)Nc3ccccc3F)cc2C1	ZINC000819470517	EG	On-Demand	Anodyne	PTPRF	41	31
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3ccccc3F)cc2C1	ZINC000819470518	EG	On-Demand	Anodyne	PTPRF	41	31
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3cccc(C(F)(F)F)c3)cc2C1	ZINC000819470537	GI	On-Demand	Anodyne	MTTP	53	42
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3cccc(C(F)(F)F)c3)cc2C1	ZINC000819470537	GI	On-Demand	Anodyne	PTPRF	44	33
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3cccc(C(F)(F)F)c3)cc2C1	ZINC000819470537	GI	On-Demand	Anodyne	SLC1A2	45	40
CO[C@H]1Cc2ccc(NCCC(=O)Nc3cccc(C(F)(F)F)c3)cc2C1	ZINC000819470539	GI	On-Demand	Anodyne	MTTP	53	42
CO[C@H]1Cc2ccc(NCCC(=O)Nc3cccc(C(F)(F)F)c3)cc2C1	ZINC000819470539	GI	On-Demand	Anodyne	PTPRF	44	33
CO[C@H]1Cc2ccc(NCCC(=O)Nc3cccc(C(F)(F)F)c3)cc2C1	ZINC000819470539	GI	On-Demand	Anodyne	SLC1A2	45	40
O=C(COc1ccccc1NCC1(O)CCC1)Nc1cccnc1	ZINC000819470540	EE	On-Demand	Anodyne	NAMPT	21	42
O[C@@H](CNc1cccc2c1OCC[C@H]2O)COc1ccccc1Cl	ZINC000819470550	EG	On-Demand	Anodyne	ADRB2	15	41
O[C@@H](CNc1cccc2c1OCC[C@@H]2O)COc1ccccc1Cl	ZINC000819470551	EG	On-Demand	Anodyne	ADRB2	15	41
O[C@H](CNc1cccc2c1OCC[C@H]2O)COc1ccccc1Cl	ZINC000819470552	EG	On-Demand	Anodyne	ADRB2	15	41
O[C@H]1CCOc2c(NC[C@@H](O)COc3ccccc3Cl)cccc21	ZINC000819470553	EG	On-Demand	Anodyne	ADRB2	15	41
CO[C@@H]1Cc2ccc(NC[C@H](O)CN3CCc4ccccc4C3)cc2C1	ZINC000819470654	FF	On-Demand	Anodyne	NOD2	42	37
CO[C@@H]1Cc2ccc(NC[C@@H](O)CN3CCc4ccccc4C3)cc2C1	ZINC000819470655	FF	On-Demand	Anodyne	NOD2	42	37
CO[C@H]1Cc2ccc(NC[C@H](O)CN3CCc4ccccc4C3)cc2C1	ZINC000819470656	FF	On-Demand	Anodyne	NOD2	42	37
CO[C@H]1Cc2ccc(NC[C@@H](O)CN3CCc4ccccc4C3)cc2C1	ZINC000819470657	FF	On-Demand	Anodyne	NOD2	42	37
CC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(OC(C)(C)C)c(F)c2)cc1	ZINC000819470679	GI	On-Demand	Anodyne	ADRB2	26	42
CC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(OC(C)(C)C)c(F)c2)cc1	ZINC000819470679	GI	On-Demand	Anodyne	ADRB1	47	42
CC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(OC(C)(C)C)c(F)c2)cc1	ZINC000819470680	GI	On-Demand	Anodyne	ADRB2	26	42
CC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(OC(C)(C)C)c(F)c2)cc1	ZINC000819470680	GI	On-Demand	Anodyne	ADRB1	47	42
CO[C@H]1Cc2ccc(NCCS(=O)(=O)c3ccc(C(C)(C)C)cc3)cc2C1	ZINC000819470707	GH	On-Demand	Anodyne	CYNT	33	54
CO[C@@H]1Cc2ccc(NCCS(=O)(=O)c3ccc(C(C)(C)C)cc3)cc2C1	ZINC000819470708	GH	On-Demand	Anodyne	CYNT	33	54
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(NC(C)=O)cc3)cc2C1	ZINC000819470722	FF	On-Demand	Anodyne	ADRB2	37	56
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(NC(C)=O)cc3)cc2C1	ZINC000819470722	FF	On-Demand	Anodyne	ADRB1	72	56
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(NC(C)=O)cc3)cc2C1	ZINC000819470722	FF	On-Demand	Anodyne	TSHR	40	30
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccc(NC(C)=O)cc3)cc2C1	ZINC000819470722	FF	On-Demand	Anodyne	ADRB3	46	48
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(NC(C)=O)cc3)cc2C1	ZINC000819470723	FF	On-Demand	Anodyne	ADRB2	37	56
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(NC(C)=O)cc3)cc2C1	ZINC000819470723	FF	On-Demand	Anodyne	ADRB1	72	56
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(NC(C)=O)cc3)cc2C1	ZINC000819470723	FF	On-Demand	Anodyne	TSHR	40	30
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccc(NC(C)=O)cc3)cc2C1	ZINC000819470723	FF	On-Demand	Anodyne	ADRB3	46	48
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(NC(C)=O)cc3)cc2C1	ZINC000819470724	FF	On-Demand	Anodyne	ADRB2	37	56
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(NC(C)=O)cc3)cc2C1	ZINC000819470724	FF	On-Demand	Anodyne	ADRB1	72	56
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(NC(C)=O)cc3)cc2C1	ZINC000819470724	FF	On-Demand	Anodyne	TSHR	40	30
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccc(NC(C)=O)cc3)cc2C1	ZINC000819470724	FF	On-Demand	Anodyne	ADRB3	46	48
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(NC(C)=O)cc3)cc2C1	ZINC000819470725	FF	On-Demand	Anodyne	ADRB2	37	56
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(NC(C)=O)cc3)cc2C1	ZINC000819470725	FF	On-Demand	Anodyne	ADRB1	72	56
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(NC(C)=O)cc3)cc2C1	ZINC000819470725	FF	On-Demand	Anodyne	TSHR	40	30
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccc(NC(C)=O)cc3)cc2C1	ZINC000819470725	FF	On-Demand	Anodyne	ADRB3	46	48
CO[C@@H]1Cc2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2C1	ZINC000819470726	DH	On-Demand	Anodyne	ADRB1	34	46
CO[C@@H]1Cc2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2C1	ZINC000819470726	DH	On-Demand	Anodyne	ADRB3	52	46
CO[C@@H]1Cc2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2C1	ZINC000819470726	DH	On-Demand	Anodyne	CYP3A4	48	40
CO[C@@H]1Cc2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2C1	ZINC000819470727	DH	On-Demand	Anodyne	ADRB1	34	46
CO[C@@H]1Cc2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2C1	ZINC000819470727	DH	On-Demand	Anodyne	ADRB3	52	46
CO[C@@H]1Cc2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2C1	ZINC000819470727	DH	On-Demand	Anodyne	CYP3A4	48	40
CO[C@H]1Cc2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2C1	ZINC000819470728	DH	On-Demand	Anodyne	ADRB1	34	46
CO[C@H]1Cc2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2C1	ZINC000819470728	DH	On-Demand	Anodyne	ADRB3	52	46
CO[C@H]1Cc2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2C1	ZINC000819470728	DH	On-Demand	Anodyne	CYP3A4	48	40
CO[C@H]1Cc2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2C1	ZINC000819470729	DH	On-Demand	Anodyne	ADRB1	34	46
CO[C@H]1Cc2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2C1	ZINC000819470729	DH	On-Demand	Anodyne	ADRB3	52	46
CO[C@H]1Cc2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2C1	ZINC000819470729	DH	On-Demand	Anodyne	CYP3A4	48	40
CC(=O)Nc1cccc(CC(=O)N[C@H](C(=O)OCc2ccccc2)C(C)(C)C)c1	ZINC000819470758	GG	On-Demand	Anodyne	TSHR	40	30
CC(=O)Nc1cccc(CC(=O)N[C@H](C(=O)OCc2ccccc2)C(C)(C)C)c1	ZINC000819470758	GG	On-Demand	Anodyne	LTA4H	16	44
CC(=O)Nc1cccc(CC(=O)N[C@H](C(=O)OCc2ccccc2)C(C)(C)C)c1	ZINC000819470758	GG	On-Demand	Anodyne	PAPA1_CARPA	43	42
CC(=O)Nc1cccc(CC(=O)N[C@H](C(=O)OCc2ccccc2)C(C)(C)C)c1	ZINC000819470758	GG	On-Demand	Anodyne	CAPNS1	52	31
CC(=O)Nc1cccc(CC(=O)N[C@H](C(=O)OCc2ccccc2)C(C)(C)C)c1	ZINC000819470758	GG	On-Demand	Anodyne	CAPN1	45	41
CC(=O)Nc1cccc(CC(=O)N[C@H](C(=O)OCc2ccccc2)C(C)(C)C)c1	ZINC000819470758	GG	On-Demand	Anodyne	CAPN2	59	34
CC(=O)Nc1cccc(CC(=O)N[C@H](C(=O)OCc2ccccc2)C(C)(C)C)c1	ZINC000819470758	GG	On-Demand	Anodyne	NPR	43	37
CC(=O)Nc1cccc(CC(=O)N[C@H](C(=O)OCc2ccccc2)C(C)(C)C)c1	ZINC000819470758	GG	On-Demand	Anodyne	PSMB5	19	41
CC(=O)Nc1cccc(CC(=O)N[C@H](C(=O)OCc2ccccc2)C(C)(C)C)c1	ZINC000819470758	GG	On-Demand	Anodyne	KCNK3	51	33
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1NC(=O)CCN(C)C	ZINC000819470767	EE	On-Demand	Anodyne	ADRB2	20	41
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1NC(=O)CCN(C)C	ZINC000819470767	EE	On-Demand	Anodyne	ADRB1	22	42
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1NC(=O)CCN(C)C	ZINC000819470767	EE	On-Demand	Anodyne	ADRB3	87	49
Cc1ccc(NC[C@H](O)c2cccnc2)cc1NC(=O)CCN(C)C	ZINC000819470768	EE	On-Demand	Anodyne	ADRB2	20	41
Cc1ccc(NC[C@H](O)c2cccnc2)cc1NC(=O)CCN(C)C	ZINC000819470768	EE	On-Demand	Anodyne	ADRB1	22	42
Cc1ccc(NC[C@H](O)c2cccnc2)cc1NC(=O)CCN(C)C	ZINC000819470768	EE	On-Demand	Anodyne	ADRB3	87	49
O[C@H](CNc1cccc2c1OCC[C@H]2O)COc1cccc(C(F)(F)F)c1	ZINC000819470771	GG	On-Demand	Anodyne	PDS	43	38
O[C@H]1CCOc2c(NC[C@@H](O)COc3cccc(C(F)(F)F)c3)cccc21	ZINC000819470772	GG	On-Demand	Anodyne	PDS	43	38
O[C@@H](CNc1cccc2c1OCC[C@@H]2O)COc1cccc(C(F)(F)F)c1	ZINC000819470773	GG	On-Demand	Anodyne	PDS	43	38
O[C@@H](CNc1cccc2c1OCC[C@H]2O)COc1cccc(C(F)(F)F)c1	ZINC000819470774	GG	On-Demand	Anodyne	PDS	43	38
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)C(F)=C1CCC1	ZINC000819470847	EF	On-Demand	Anodyne	EPHX2	15	42
O=C(Nc1cccc(C(=O)N2CCC(O)CC2)c1)C(F)=C1CCC1	ZINC000819470847	EF	On-Demand	Anodyne	L3MBTL3	71	43
CC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819470848	GH	On-Demand	Anodyne	ADRB2	24	45
CC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819470848	GH	On-Demand	Anodyne	ADRB1	46	45
CC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819470849	GH	On-Demand	Anodyne	ADRB2	24	45
CC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(OC(C)C)c(F)c2)cc1	ZINC000819470849	GH	On-Demand	Anodyne	ADRB1	46	45
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819470866	FG	On-Demand	Anodyne	ADRB2	29	50
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819470866	FG	On-Demand	Anodyne	ADRB1	42	51
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819470866	FG	On-Demand	Anodyne	ADRB3	106	56
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819470866	FG	On-Demand	Anodyne	CYP26A1	46	32
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819470867	FG	On-Demand	Anodyne	ADRB2	29	50
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819470867	FG	On-Demand	Anodyne	ADRB1	42	51
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819470867	FG	On-Demand	Anodyne	ADRB3	106	56
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819470867	FG	On-Demand	Anodyne	CYP26A1	46	32
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3cccc(F)c3)cc2C1	ZINC000819470900	EG	On-Demand	Anodyne	FUCA1	15	43
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3cccc(F)c3)cc2C1	ZINC000819470900	EG	On-Demand	Anodyne	MTTP	44	35
CO[C@@H]1Cc2ccc(NCCC(=O)Nc3cccc(F)c3)cc2C1	ZINC000819470900	EG	On-Demand	Anodyne	PTPRF	45	35
CO[C@H]1Cc2ccc(NCCC(=O)Nc3cccc(F)c3)cc2C1	ZINC000819470901	EG	On-Demand	Anodyne	FUCA1	15	43
CO[C@H]1Cc2ccc(NCCC(=O)Nc3cccc(F)c3)cc2C1	ZINC000819470901	EG	On-Demand	Anodyne	MTTP	44	35
CO[C@H]1Cc2ccc(NCCC(=O)Nc3cccc(F)c3)cc2C1	ZINC000819470901	EG	On-Demand	Anodyne	PTPRF	45	35
CO[C@@H]1Cc2ccc(NC[C@H](O)COc3ccccc3C(F)(F)F)cc2C1	ZINC000819470902	GH	On-Demand	Anodyne	ADRB2	25	41
CO[C@@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3C(F)(F)F)cc2C1	ZINC000819470903	GH	On-Demand	Anodyne	ADRB2	25	41
CO[C@H]1Cc2ccc(NC[C@H](O)COc3ccccc3C(F)(F)F)cc2C1	ZINC000819470904	GH	On-Demand	Anodyne	ADRB2	25	41
CO[C@H]1Cc2ccc(NC[C@@H](O)COc3ccccc3C(F)(F)F)cc2C1	ZINC000819470905	GH	On-Demand	Anodyne	ADRB2	25	41
CO[C@@H]1Cc2ccc(NC[C@@]3(O)CCCN(C(=O)OC(C)(C)C)CC3)cc2C1	ZINC000819470917	GG	On-Demand	Anodyne	GPR119	29	44
CO[C@@H]1Cc2ccc(NC[C@]3(O)CCCN(C(=O)OC(C)(C)C)CC3)cc2C1	ZINC000819470918	GG	On-Demand	Anodyne	GPR119	29	44
CO[C@H]1Cc2ccc(NC[C@@]3(O)CCCN(C(=O)OC(C)(C)C)CC3)cc2C1	ZINC000819470919	GG	On-Demand	Anodyne	GPR119	29	44
CO[C@H]1Cc2ccc(NC[C@]3(O)CCCN(C(=O)OC(C)(C)C)CC3)cc2C1	ZINC000819470920	GG	On-Demand	Anodyne	GPR119	29	44
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819470935	GH	On-Demand	Anodyne	ADRB2	15	41
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819470935	GH	On-Demand	Anodyne	ADRB1	33	41
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819470935	GH	On-Demand	Anodyne	ADRB3	38	41
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819470936	GH	On-Demand	Anodyne	ADRB2	15	41
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819470936	GH	On-Demand	Anodyne	ADRB1	33	41
CC(C)(C)OC(=O)NCCOc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819470936	GH	On-Demand	Anodyne	ADRB3	38	41
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(OC)cc2C)cc1	ZINC000819470948	FF	On-Demand	Anodyne	ADRB2	31	45
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(OC)cc2C)cc1	ZINC000819470949	FF	On-Demand	Anodyne	ADRB2	31	45
COCCNC(=O)c1ccccc1NC(=O)C1C2CC3CC(C2)CC1C3	ZINC000819471025	FG	On-Demand	Anodyne	PRTN3	48	41
CO[C@H]1Cc2ccc(NC[C@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)cc2C1	ZINC000819471026	GG	On-Demand	Anodyne	GPR119	50	48
CO[C@@H]1Cc2ccc(NC[C@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)cc2C1	ZINC000819471029	GG	On-Demand	Anodyne	GPR119	50	48
CO[C@H]1Cc2ccc(NC[C@@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)cc2C1	ZINC000819471033	GG	On-Demand	Anodyne	GPR119	50	48
CO[C@@H]1Cc2ccc(NC[C@@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)cc2C1	ZINC000819471036	GG	On-Demand	Anodyne	GPR119	50	48
CCOC(=O)C1CCC(O)(CNc2ccc(Cl)cc2OC)CC1	ZINC000819471106	EG	On-Demand	Anodyne	FDFT1	17	40
CC(=O)N1CCc2c(NC[C@@H](O)c3ccc(F)cc3)cccc21	ZINC000819471128	DF	On-Demand	Anodyne	KCNQ2	47	40
CC(=O)N1CCc2c(NC[C@H](O)c3ccc(F)cc3)cccc21	ZINC000819471130	DF	On-Demand	Anodyne	KCNQ2	47	40
O=C(COc1ccccc1NCC1(O)CCCCC1)Nc1cccnc1	ZINC000819471148	FG	On-Demand	Anodyne	NAMPT	20	41
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819471150	FF	On-Demand	Anodyne	ADRB2	28	49
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819471150	FF	On-Demand	Anodyne	ADRB1	52	49
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819471151	FF	On-Demand	Anodyne	ADRB2	28	49
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819471151	FF	On-Demand	Anodyne	ADRB1	52	49
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819471152	FF	On-Demand	Anodyne	ADRB2	28	49
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819471152	FF	On-Demand	Anodyne	ADRB1	52	49
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819471153	FF	On-Demand	Anodyne	ADRB2	28	49
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819471153	FF	On-Demand	Anodyne	ADRB1	52	49
C[C@@](O)(CNc1ccccc1OCC(=O)Nc1cccnc1)C(F)(F)F	ZINC000819471167	FF	On-Demand	Anodyne	P2RY1	40	36
O[C@H](CNc1cccc2c1OCC[C@H]2O)COc1ccc2ccccc2c1	ZINC000819471246	FH	On-Demand	Anodyne	ADRB2	15	48
O[C@@H](CNc1cccc2c1OCC[C@H]2O)COc1ccc2ccccc2c1	ZINC000819471247	FH	On-Demand	Anodyne	ADRB2	15	48
O[C@H]1CCOc2c(NC[C@@H](O)COc3ccc4ccccc4c3)cccc21	ZINC000819471248	FH	On-Demand	Anodyne	ADRB2	15	48
O[C@@H](CNc1cccc2c1OCC[C@@H]2O)COc1ccc2ccccc2c1	ZINC000819471249	FH	On-Demand	Anodyne	ADRB2	15	48
CC(=O)N1CCN(Cc2ccc(NC(=O)C(F)=C3CCC3)cc2)CC1	ZINC000819471277	EF	On-Demand	Anodyne	LTA4H	15	40
CC(=O)N1CCN(Cc2ccc(NC(=O)C(F)=C3CCC3)cc2)CC1	ZINC000819471277	EF	On-Demand	Anodyne	NOD2	42	35
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819471289	GF	On-Demand	Anodyne	ADRB1	60	41
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819471289	GF	On-Demand	Anodyne	ADRB3	40	38
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819471291	GF	On-Demand	Anodyne	ADRB1	60	41
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819471291	GF	On-Demand	Anodyne	ADRB3	40	38
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819471293	GF	On-Demand	Anodyne	ADRB1	60	41
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819471293	GF	On-Demand	Anodyne	ADRB3	40	38
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819471296	GF	On-Demand	Anodyne	ADRB1	60	41
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819471296	GF	On-Demand	Anodyne	ADRB3	40	38
COCCNC(=O)c1ccccc1NC(=O)[C@H]1CC(=O)N(C2CCCC2)C1	ZINC000819471319	FD	On-Demand	Anodyne	INHA	24	53
COCCNC(=O)c1ccccc1NC(=O)[C@H]1CC(=O)N(C2CCCC2)C1	ZINC000819471319	FD	On-Demand	Anodyne	POLR1A	45	34
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1	ZINC000819471320	FD	On-Demand	Anodyne	INHA	24	53
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1	ZINC000819471320	FD	On-Demand	Anodyne	POLR1A	45	34
COc1cccc(OC)c1OC[C@@H](O)CNc1cccc2c1OCC[C@@H]2O	ZINC000819471321	GE	On-Demand	Anodyne	ADRB2	18	40
COc1cccc(OC)c1OC[C@H](O)CNc1cccc2c1OCC[C@@H]2O	ZINC000819471322	GE	On-Demand	Anodyne	ADRB2	18	40
COc1cccc(OC)c1OC[C@H](O)CNc1cccc2c1OCC[C@H]2O	ZINC000819471323	GE	On-Demand	Anodyne	ADRB2	18	40
COc1cccc(OC)c1OC[C@@H](O)CNc1cccc2c1OCC[C@H]2O	ZINC000819471324	GE	On-Demand	Anodyne	ADRB2	18	40
CC(C)(O)CNc1ccccc1OCC(=O)Nc1cccnc1	ZINC000819471348	DE	On-Demand	Anodyne	NAMPT	20	45
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819471376	FE	On-Demand	Anodyne	ADRB2	31	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819471376	FE	On-Demand	Anodyne	ADRB1	63	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819471376	FE	On-Demand	Anodyne	ADRB3	38	43
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819471377	FE	On-Demand	Anodyne	ADRB2	31	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819471377	FE	On-Demand	Anodyne	ADRB1	63	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819471377	FE	On-Demand	Anodyne	ADRB3	38	43
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819471378	FE	On-Demand	Anodyne	ADRB2	31	48
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819471378	FE	On-Demand	Anodyne	ADRB1	63	48
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819471378	FE	On-Demand	Anodyne	ADRB3	38	43
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819471379	FE	On-Demand	Anodyne	ADRB2	31	48
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819471379	FE	On-Demand	Anodyne	ADRB1	63	48
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819471379	FE	On-Demand	Anodyne	ADRB3	38	43
COc1cc(C)c(Br)cc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819471432	GH	On-Demand	Bother	CACNA1C	55	36
COc1cc(C)c(Br)cc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819471432	GH	On-Demand	Bother	CACNA1D	85	36
COc1cc(C)c(Br)cc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819471433	GH	On-Demand	Bother	CACNA1C	55	36
COc1cc(C)c(Br)cc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819471433	GH	On-Demand	Bother	CACNA1D	85	36
Cc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819471440	EF	On-Demand	Anodyne	ADRB2	26	44
Cc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819471441	EF	On-Demand	Anodyne	ADRB2	26	44
Cc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@@H]3O)cc1	ZINC000819471442	EF	On-Demand	Anodyne	ADRB2	26	44
Cc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@H]3O)cc1	ZINC000819471443	EF	On-Demand	Anodyne	ADRB2	26	44
COC[C@@H](O)CNc1ccccc1OCC(=O)Nc1cccnc1	ZINC000819471553	ED	On-Demand	Clean	ADRB1	41	32
O[C@H](CNc1cccc2c1OCC[C@H]2O)COc1ccccc1	ZINC000819471583	DE	On-Demand	Anodyne	ADRB2	29	42
O[C@H](CNc1cccc2c1OCC[C@H]2O)COc1ccccc1	ZINC000819471583	DE	On-Demand	Anodyne	ADRB1	43	36
O[C@H]1CCOc2c(NC[C@@H](O)COc3ccccc3)cccc21	ZINC000819471584	DE	On-Demand	Anodyne	ADRB2	29	42
O[C@H]1CCOc2c(NC[C@@H](O)COc3ccccc3)cccc21	ZINC000819471584	DE	On-Demand	Anodyne	ADRB1	43	36
O[C@@H](CNc1cccc2c1OCC[C@@H]2O)COc1ccccc1	ZINC000819471585	DE	On-Demand	Anodyne	ADRB2	29	42
O[C@@H](CNc1cccc2c1OCC[C@@H]2O)COc1ccccc1	ZINC000819471585	DE	On-Demand	Anodyne	ADRB1	43	36
O[C@@H](CNc1cccc2c1OCC[C@H]2O)COc1ccccc1	ZINC000819471586	DE	On-Demand	Anodyne	ADRB2	29	42
O[C@@H](CNc1cccc2c1OCC[C@H]2O)COc1ccccc1	ZINC000819471586	DE	On-Demand	Anodyne	ADRB1	43	36
O=C(COc1ccccc1NCC1(O)CCCC1)Nc1cccnc1	ZINC000819471663	EF	On-Demand	Anodyne	NAMPT	21	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2cccc3c2OCC[C@H]3O)CC1	ZINC000819471678	GF	On-Demand	Anodyne	GPR119	36	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2cccc3c2OCC[C@H]3O)CC1	ZINC000819471679	GF	On-Demand	Anodyne	GPR119	36	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2cccc3c2OCC[C@@H]3O)CC1	ZINC000819471680	GF	On-Demand	Anodyne	GPR119	36	45
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2cccc3c2OCC[C@@H]3O)CC1	ZINC000819471681	GF	On-Demand	Anodyne	GPR119	36	45
O[C@@H](CNc1cccc2c1OCC[C@H]2O)c1cccc(Cl)c1	ZINC000819471736	DG	On-Demand	Anodyne	IGF1R	30	40
O[C@@H](CNc1cccc2c1OCC[C@H]2O)c1cccc(Cl)c1	ZINC000819471736	DG	On-Demand	Anodyne	CYP3A4	51	40
O[C@H]1CCOc2c(NC[C@H](O)c3cccc(Cl)c3)cccc21	ZINC000819471737	DG	On-Demand	Anodyne	IGF1R	30	40
O[C@H]1CCOc2c(NC[C@H](O)c3cccc(Cl)c3)cccc21	ZINC000819471737	DG	On-Demand	Anodyne	CYP3A4	51	40
O[C@H](CNc1cccc2c1OCC[C@H]2O)c1cccc(Cl)c1	ZINC000819471738	DG	On-Demand	Anodyne	IGF1R	30	40
O[C@H](CNc1cccc2c1OCC[C@H]2O)c1cccc(Cl)c1	ZINC000819471738	DG	On-Demand	Anodyne	CYP3A4	51	40
O[C@H](CNc1cccc2c1OCC[C@@H]2O)c1cccc(Cl)c1	ZINC000819471739	DG	On-Demand	Anodyne	IGF1R	30	40
O[C@H](CNc1cccc2c1OCC[C@@H]2O)c1cccc(Cl)c1	ZINC000819471739	DG	On-Demand	Anodyne	CYP3A4	51	40
CC(=O)N1CCc2c(NC[C@H](O)c3ccccc3Cl)cccc21	ZINC000819471744	EG	On-Demand	Anodyne	KCNQ2	54	35
CON(C)C(=O)CCNc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000819471789	GH	On-Demand	Anodyne	LCK	19	40
CON(C)C(=O)CCNc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000819471789	GH	On-Demand	Anodyne	CPT1A	54	36
CON(C)C(=O)CCNc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000819471789	GH	On-Demand	Anodyne	LYN	18	40
CON(C)C(=O)CCNc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000819471789	GH	On-Demand	Anodyne	CSF1R	17	44
CON(C)C(=O)CCNc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000819471789	GH	On-Demand	Anodyne	BTK	19	41
CON(C)C(=O)CCNc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000819471789	GH	On-Demand	Anodyne	KCNK3	89	47
CON(C)C(=O)CCNc1ccc(NC(=O)c2cccc(Cl)c2)cc1C	ZINC000819471789	GH	On-Demand	Anodyne	KCNK9	54	47
O=C(COc1ccccc1NC[C@H](O)CN1CCOCC1)Nc1cccnc1	ZINC000819471849	GD	On-Demand	Clean	CASR	15	44
O=C(COc1ccccc1NC[C@@H](O)CN1CCOCC1)Nc1cccnc1	ZINC000819471850	GD	On-Demand	Clean	CASR	15	44
CC(=O)N1CCc2c(NC[C@H](O)c3cccnc3)cccc21	ZINC000819471859	CE	On-Demand	Anodyne	ADRB1	17	43
CC(=O)N1CCc2c(NC[C@H](O)c3cccnc3)cccc21	ZINC000819471859	CE	On-Demand	Anodyne	ADRB3	62	43
CC(=O)N1CCc2c(NC[C@@H](O)c3cccnc3)cccc21	ZINC000819471860	CE	On-Demand	Anodyne	ADRB1	17	43
CC(=O)N1CCc2c(NC[C@@H](O)c3cccnc3)cccc21	ZINC000819471860	CE	On-Demand	Anodyne	ADRB3	62	43
O[C@@H](CNc1cccc2c1OCC[C@H]2O)c1cccnc1	ZINC000819471890	CE	On-Demand	Anodyne	ADRB3	45	38
O[C@H]1CCOc2c(NC[C@H](O)c3cccnc3)cccc21	ZINC000819471891	CE	On-Demand	Anodyne	ADRB3	45	38
O[C@H](CNc1cccc2c1OCC[C@H]2O)c1cccnc1	ZINC000819471892	CE	On-Demand	Anodyne	ADRB3	45	38
O[C@H](CNc1cccc2c1OCC[C@@H]2O)c1cccnc1	ZINC000819471893	CE	On-Demand	Anodyne	ADRB3	45	38
CC(=O)N1CCc2c(NC[C@@H](O)c3cccc(Cl)c3)cccc21	ZINC000819471908	EG	On-Demand	Anodyne	ADRB1	29	44
CC(=O)N1CCc2c(NC[C@@H](O)c3cccc(Cl)c3)cccc21	ZINC000819471908	EG	On-Demand	Anodyne	ADRB3	46	44
CC(=O)N1CCc2c(NC[C@@H](O)c3cccc(Cl)c3)cccc21	ZINC000819471908	EG	On-Demand	Anodyne	IGF1R	31	44
CC(=O)N1CCc2c(NC[C@@H](O)c3cccc(Cl)c3)cccc21	ZINC000819471908	EG	On-Demand	Anodyne	KCNQ2	38	43
CC(=O)N1CCc2c(NC[C@@H](O)c3cccc(Cl)c3)cccc21	ZINC000819471908	EG	On-Demand	Anodyne	HSD17B3	41	33
CC(=O)N1CCc2c(NC[C@@H](O)c3cccc(Cl)c3)cccc21	ZINC000819471908	EG	On-Demand	Anodyne	CYP3A4	54	40
CC(=O)N1CCc2c(NC[C@H](O)c3cccc(Cl)c3)cccc21	ZINC000819471909	EG	On-Demand	Anodyne	ADRB1	29	44
CC(=O)N1CCc2c(NC[C@H](O)c3cccc(Cl)c3)cccc21	ZINC000819471909	EG	On-Demand	Anodyne	ADRB3	46	44
CC(=O)N1CCc2c(NC[C@H](O)c3cccc(Cl)c3)cccc21	ZINC000819471909	EG	On-Demand	Anodyne	IGF1R	31	44
CC(=O)N1CCc2c(NC[C@H](O)c3cccc(Cl)c3)cccc21	ZINC000819471909	EG	On-Demand	Anodyne	KCNQ2	38	43
CC(=O)N1CCc2c(NC[C@H](O)c3cccc(Cl)c3)cccc21	ZINC000819471909	EG	On-Demand	Anodyne	HSD17B3	41	33
CC(=O)N1CCc2c(NC[C@H](O)c3cccc(Cl)c3)cccc21	ZINC000819471909	EG	On-Demand	Anodyne	CYP3A4	54	40
O=C(COc1ccccc1NCC1(O)CCOCC1)Nc1cccnc1	ZINC000819471940	FE	On-Demand	Anodyne	NAMPT	21	40
O=C(/C=C/[C@H]1CCCO1)N1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000819471974	GG	On-Demand	Anodyne	EPHX2	45	39
O=C(/C=C\[C@@H]1CCCO1)N1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000819471975	GG	On-Demand	Anodyne	EPHX2	45	39
O=C(/C=C/[C@@H]1CCCO1)N1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000819471976	GG	On-Demand	Anodyne	EPHX2	45	39
O=C(/C=C\[C@H]1CCCO1)N1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000819471977	GG	On-Demand	Anodyne	EPHX2	45	39
O[C@@H](CNc1cccc2c1OCC[C@@H]2O)COc1cccc2ccccc12	ZINC000819471994	FH	On-Demand	Anodyne	ADRB2	21	48
O[C@@H](CNc1cccc2c1OCC[C@@H]2O)COc1cccc2ccccc12	ZINC000819471994	FH	On-Demand	Anodyne	ADRB1	21	48
O[C@@H](CNc1cccc2c1OCC[C@H]2O)COc1cccc2ccccc12	ZINC000819471995	FH	On-Demand	Anodyne	ADRB2	21	48
O[C@@H](CNc1cccc2c1OCC[C@H]2O)COc1cccc2ccccc12	ZINC000819471995	FH	On-Demand	Anodyne	ADRB1	21	48
O[C@H](CNc1cccc2c1OCC[C@H]2O)COc1cccc2ccccc12	ZINC000819471996	FH	On-Demand	Anodyne	ADRB2	21	48
O[C@H](CNc1cccc2c1OCC[C@H]2O)COc1cccc2ccccc12	ZINC000819471996	FH	On-Demand	Anodyne	ADRB1	21	48
O[C@H]1CCOc2c(NC[C@@H](O)COc3cccc4ccccc34)cccc21	ZINC000819471997	FH	On-Demand	Anodyne	ADRB2	21	48
O[C@H]1CCOc2c(NC[C@@H](O)COc3cccc4ccccc34)cccc21	ZINC000819471997	FH	On-Demand	Anodyne	ADRB1	21	48
CC(=O)N1CCc2c(NC[C@@H](O)c3ccccc3)cccc21	ZINC000819471998	CF	On-Demand	Anodyne	KCNQ2	56	37
CC(=O)N1CCc2c(NC[C@H](O)c3ccccc3)cccc21	ZINC000819471999	CF	On-Demand	Anodyne	KCNQ2	56	37
COCCNC(=O)c1ccccc1NC(=O)Cc1ccc2c(c1)CCC2	ZINC000819472009	FF	On-Demand	Anodyne	SLC6A5	47	36
C=CCCn1cc(C(=O)N[C@H](C(=O)OCc2ccccc2)C(C)(C)C)nn1	ZINC000819472031	FF	On-Demand	Mild	CAPN1	35	41
C=CCCn1cc(C(=O)N[C@H](C(=O)OCc2ccccc2)C(C)(C)C)nn1	ZINC000819472031	FF	On-Demand	Mild	NPR	47	37
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1NC(=O)CCN(C)C	ZINC000819472032	GH	On-Demand	Anodyne	ADRB1	26	45
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1NC(=O)CCN(C)C	ZINC000819472032	GH	On-Demand	Anodyne	ADRB3	42	41
Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1NC(=O)CCN(C)C	ZINC000819472032	GH	On-Demand	Anodyne	CYP3A4	48	37
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1NC(=O)CCN(C)C	ZINC000819472033	GH	On-Demand	Anodyne	ADRB1	26	45
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1NC(=O)CCN(C)C	ZINC000819472033	GH	On-Demand	Anodyne	ADRB3	42	41
Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1NC(=O)CCN(C)C	ZINC000819472033	GH	On-Demand	Anodyne	CYP3A4	48	37
CC(C)(C)OC(=O)NCC(=O)NNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819472047	GD	On-Demand	Reactive	PDS	53	33
CN1CCC(CCO)(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819472071	GD	On-Demand	Mild	PAPA1_CARPA	32	43
CN1CCC(CCO)(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819472072	GD	On-Demand	Mild	PAPA1_CARPA	32	43
COCCNC(=O)c1ccccc1NC(=O)c1cc2c(=O)n3ccccc3nc2n1C	ZINC000819472094	HD	On-Demand	Anodyne	POLR1A	95	49
COCCc1ccc(OC[C@@H](O)CNc2ccc(Cl)cc2OC)cc1	ZINC000819472102	FG	On-Demand	Anodyne	ADRB2	43	57
COCCc1ccc(OC[C@@H](O)CNc2ccc(Cl)cc2OC)cc1	ZINC000819472102	FG	On-Demand	Anodyne	ADRB1	74	57
COCCc1ccc(OC[C@@H](O)CNc2ccc(Cl)cc2OC)cc1	ZINC000819472102	FG	On-Demand	Anodyne	GRIN1	26	43
COCCc1ccc(OC[C@@H](O)CNc2ccc(Cl)cc2OC)cc1	ZINC000819472102	FG	On-Demand	Anodyne	ADRB3	50	44
COCCc1ccc(OC[C@H](O)CNc2ccc(Cl)cc2OC)cc1	ZINC000819472103	FG	On-Demand	Anodyne	ADRB2	43	57
COCCc1ccc(OC[C@H](O)CNc2ccc(Cl)cc2OC)cc1	ZINC000819472103	FG	On-Demand	Anodyne	ADRB1	74	57
COCCc1ccc(OC[C@H](O)CNc2ccc(Cl)cc2OC)cc1	ZINC000819472103	FG	On-Demand	Anodyne	GRIN1	26	43
COCCc1ccc(OC[C@H](O)CNc2ccc(Cl)cc2OC)cc1	ZINC000819472103	FG	On-Demand	Anodyne	ADRB3	50	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2cccc3cc[nH]c23)CC1	ZINC000819472109	FH	On-Demand	Anodyne	GPR119	40	48
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2cccc3cc[nH]c23)CC1	ZINC000819472110	FH	On-Demand	Anodyne	GPR119	40	48
COCCc1ccc(OC[C@@H](O)CNc2cc(F)c(OC)cc2C)cc1	ZINC000819472126	FG	On-Demand	Anodyne	ADRB2	33	55
COCCc1ccc(OC[C@@H](O)CNc2cc(F)c(OC)cc2C)cc1	ZINC000819472126	FG	On-Demand	Anodyne	ADRB1	48	55
COCCc1ccc(OC[C@@H](O)CNc2cc(F)c(OC)cc2C)cc1	ZINC000819472126	FG	On-Demand	Anodyne	ADRB3	30	43
COCCc1ccc(OC[C@H](O)CNc2cc(F)c(OC)cc2C)cc1	ZINC000819472127	FG	On-Demand	Anodyne	ADRB2	33	55
COCCc1ccc(OC[C@H](O)CNc2cc(F)c(OC)cc2C)cc1	ZINC000819472127	FG	On-Demand	Anodyne	ADRB1	48	55
COCCc1ccc(OC[C@H](O)CNc2cc(F)c(OC)cc2C)cc1	ZINC000819472127	FG	On-Demand	Anodyne	ADRB3	30	43
COCCNC(=O)c1ccccc1NC(=O)/C=C\c1ccsc1	ZINC000819472137	EF	On-Demand	Anodyne	MMP2	15	44
COCCNC(=O)c1ccccc1NC(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O	ZINC000819472168	JE	On-Demand	Bother	POLR1A	45	34
CC(=O)Nc1cccc(CC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c1	ZINC000819472190	FC	On-Demand	Reactive	NQO2	25	42
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CC(=O)N(C2CC2)C1	ZINC000819472222	ED	On-Demand	Anodyne	INHA	23	48
COCCNC(=O)c1ccccc1NC(=O)[C@H]1CC(=O)N(C2CC2)C1	ZINC000819472223	ED	On-Demand	Anodyne	INHA	23	48
O[C@@H](CNc1ccc(OC2COC2)cc1)c1cccnc1	ZINC000819472248	CE	On-Demand	Anodyne	ADRB2	22	42
O[C@@H](CNc1ccc(OC2COC2)cc1)c1cccnc1	ZINC000819472248	CE	On-Demand	Anodyne	ADRB1	24	42
O[C@@H](CNc1ccc(OC2COC2)cc1)c1cccnc1	ZINC000819472248	CE	On-Demand	Anodyne	ADRB3	87	43
O[C@H](CNc1ccc(OC2COC2)cc1)c1cccnc1	ZINC000819472249	CE	On-Demand	Anodyne	ADRB2	22	42
O[C@H](CNc1ccc(OC2COC2)cc1)c1cccnc1	ZINC000819472249	CE	On-Demand	Anodyne	ADRB1	24	42
O[C@H](CNc1ccc(OC2COC2)cc1)c1cccnc1	ZINC000819472249	CE	On-Demand	Anodyne	ADRB3	87	43
O=C1CCc2cc(NC[C@H](O)c3cccnc3)ccc2N1CC(F)(F)F	ZINC000819472278	FG	On-Demand	Anodyne	ADRB3	69	39
O=C1CCc2cc(NC[C@@H](O)c3cccnc3)ccc2N1CC(F)(F)F	ZINC000819472279	FG	On-Demand	Anodyne	ADRB3	69	39
Cc1ccc(NCCS(C)(=O)=O)cc1OCc1cccc(Cl)c1	ZINC000819472284	FH	On-Demand	Anodyne	EGFR	23	42
Cc1ccc(NCCS(C)(=O)=O)cc1OCc1cccc(Cl)c1	ZINC000819472284	FH	On-Demand	Anodyne	MAOB	33	46
Cc1ccc(NCCS(C)(=O)=O)cc1OCc1cccc(Cl)c1	ZINC000819472284	FH	On-Demand	Anodyne	ERBB2	36	42
O[C@H](CNc1ccc(OC2COC2)cc1)CC1CCCC1	ZINC000819472294	CF	On-Demand	Anodyne	CTSS	18	42
O[C@@H](CNc1ccc(OC2COC2)cc1)CC1CCCC1	ZINC000819472295	CF	On-Demand	Anodyne	CTSS	18	42
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1cccc2[nH]ccc12	ZINC000819472318	FF	On-Demand	Anodyne	ADRB2	17	58
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1cccc2[nH]ccc12	ZINC000819472318	FF	On-Demand	Anodyne	ADRB1	26	58
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1cccc2[nH]ccc12	ZINC000819472318	FF	On-Demand	Anodyne	CYP2D6	17	41
O[C@H](CNc1ccc(OC2COC2)cc1)COc1cccc2[nH]ccc12	ZINC000819472319	FF	On-Demand	Anodyne	ADRB2	17	58
O[C@H](CNc1ccc(OC2COC2)cc1)COc1cccc2[nH]ccc12	ZINC000819472319	FF	On-Demand	Anodyne	ADRB1	26	58
O[C@H](CNc1ccc(OC2COC2)cc1)COc1cccc2[nH]ccc12	ZINC000819472319	FF	On-Demand	Anodyne	CYP2D6	17	41
CC(=O)OCCc1cccc(NC(=O)c2cn(-c3ccccc3)nc2C(C)C)c1	ZINC000819472322	GI	On-Demand	Anodyne	KCNK3	73	36
CC(=O)OCCc1cccc(NC(=O)c2cn(-c3ccccc3)nc2C(C)C)c1	ZINC000819472322	GI	On-Demand	Anodyne	KCNK9	59	36
O[C@@H](CNc1cc(Cl)ccc1OC1CCCC1)c1cccnc1	ZINC000819472334	EI	On-Demand	Anodyne	ADRB1	24	49
O[C@@H](CNc1cc(Cl)ccc1OC1CCCC1)c1cccnc1	ZINC000819472334	EI	On-Demand	Anodyne	ADRB3	62	49
O[C@@H](CNc1cc(Cl)ccc1OC1CCCC1)c1cccnc1	ZINC000819472334	EI	On-Demand	Anodyne	PDE4A	27	43
O[C@@H](CNc1cc(Cl)ccc1OC1CCCC1)c1cccnc1	ZINC000819472334	EI	On-Demand	Anodyne	CYP3A4	44	33
O[C@H](CNc1cc(Cl)ccc1OC1CCCC1)c1cccnc1	ZINC000819472335	EI	On-Demand	Anodyne	ADRB1	24	49
O[C@H](CNc1cc(Cl)ccc1OC1CCCC1)c1cccnc1	ZINC000819472335	EI	On-Demand	Anodyne	ADRB3	62	49
O[C@H](CNc1cc(Cl)ccc1OC1CCCC1)c1cccnc1	ZINC000819472335	EI	On-Demand	Anodyne	PDE4A	27	43
O[C@H](CNc1cc(Cl)ccc1OC1CCCC1)c1cccnc1	ZINC000819472335	EI	On-Demand	Anodyne	CYP3A4	44	33
COCCNC(=O)c1ccccc1NC(=O)/C=C\c1cnn(C)c1	ZINC000819472361	ED	On-Demand	Anodyne	POLR1A	52	35
COCCNC(=O)c1ccccc1NC(=O)c1cc2c(C)cc(C)nc2s1	ZINC000819472362	GH	On-Demand	Anodyne	POLR1A	46	36
CC(=O)N1CCc2c(NC[C@@H](O)c3cccc(C(F)(F)F)c3)cccc21	ZINC000819472365	FH	On-Demand	Anodyne	KCNQ2	30	46
CC(=O)N1CCc2c(NC[C@H](O)c3cccc(C(F)(F)F)c3)cccc21	ZINC000819472366	FH	On-Demand	Anodyne	KCNQ2	30	46
CC(=O)N1CCc2c(NC[C@@H](O)c3ccccc3F)cccc21	ZINC000819472374	DF	On-Demand	Anodyne	KCNQ2	42	41
CC(=O)N1CCc2c(NC[C@H](O)c3ccccc3F)cccc21	ZINC000819472375	DF	On-Demand	Anodyne	KCNQ2	42	41
COCCNC(=O)c1ccccc1NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21	ZINC000819472380	HD	On-Demand	Bother	F2RL3	43	33
O=C(Cc1ccc(-n2cnnc2)cc1)NN1CCCNC1=O	ZINC000819472402	DC	On-Demand	Anodyne	KCNJ1	42	34
CC(=O)N1CCc2c(NC[C@@H](O)c3ccc(F)c(F)c3)cccc21	ZINC000819472405	EG	On-Demand	Anodyne	KCNQ2	30	42
CC(=O)N1CCc2c(NC[C@H](O)c3ccc(F)c(F)c3)cccc21	ZINC000819472406	EG	On-Demand	Anodyne	KCNQ2	30	42
CC(=O)N1CCc2c(NC[C@@H](O)c3ccc(Cl)cc3Cl)cccc21	ZINC000819472411	FI	On-Demand	Anodyne	CNR1	48	29
CC(=O)N1CCc2c(NC[C@@H](O)c3ccc(Cl)cc3Cl)cccc21	ZINC000819472411	FI	On-Demand	Anodyne	HSD17B3	45	34
CC(=O)N1CCc2c(NC[C@H](O)c3ccc(Cl)cc3Cl)cccc21	ZINC000819472412	FI	On-Demand	Anodyne	CNR1	48	29
CC(=O)N1CCc2c(NC[C@H](O)c3ccc(Cl)cc3Cl)cccc21	ZINC000819472412	FI	On-Demand	Anodyne	HSD17B3	45	34
O=C1c2ccccc2C(=O)N1CCOc1ccc(NCC2(O)CCC2)cc1	ZINC000819472423	FF	On-Demand	Anodyne	LTA4H	27	41
CCOc1cc(N2CCOC(C)(C)C2)ccc1NCC1(O)CCCC1	ZINC000819472440	EG	On-Demand	Anodyne	HCN1	40	30
CCOc1cc(N2CCOC(C)(C)C2)ccc1NCC1(O)CCCC1	ZINC000819472440	EG	On-Demand	Anodyne	HCN4	40	30
O=C(CCNc1ccc(OC2COC2)cc1)Nc1cccc(Br)c1	ZINC000819472455	GH	On-Demand	Anodyne	EGFR	34	41
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)c1	ZINC000819472456	FE	On-Demand	Bother	ADRB1	25	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)c1	ZINC000819472457	FE	On-Demand	Bother	ADRB1	25	44
COCCNC(=O)c1ccccc1NC(=O)c1ccc2nc(C)c(C)nc2c1	ZINC000819472458	GF	On-Demand	Anodyne	MAPK14	21	41
COCCNC(=O)c1ccccc1NC(=O)c1ccc2nc(C)c(C)nc2c1	ZINC000819472458	GF	On-Demand	Anodyne	NR1H4	18	41
COCCNC(=O)c1ccccc1NC(=O)c1ccc2nc(C)c(C)nc2c1	ZINC000819472458	GF	On-Demand	Anodyne	KCNK3	69	35
COCCNC(=O)c1ccccc1NC(=O)c1ccc2nc(C)c(C)nc2c1	ZINC000819472458	GF	On-Demand	Anodyne	POLR1A	60	38
COCCNC(=O)c1ccccc1NC(=O)/C=C\c1ccc2cc(OC)ccc2c1	ZINC000819472488	HH	On-Demand	Anodyne	MTNR1A	61	37
COCCNC(=O)c1ccccc1NC(=O)/C=C\c1ccc2cc(OC)ccc2c1	ZINC000819472488	HH	On-Demand	Anodyne	MTNR1B	55	37
COCCNC(=O)c1ccccc1NC(=O)/C=C\c1ccc2cc(OC)ccc2c1	ZINC000819472488	HH	On-Demand	Anodyne	MMP2	15	48
COCCNC(=O)c1ccccc1NC(=O)/C=C\c1ccc2cc(OC)ccc2c1	ZINC000819472488	HH	On-Demand	Anodyne	MMP9	15	48
COCCNC(=O)c1ccccc1NC(=O)/C=C\c1ccc2cc(OC)ccc2c1	ZINC000819472488	HH	On-Demand	Anodyne	POLR1A	58	37
CN(C)CCc1ccccc1NC[C@@H](O)c1ccccc1	ZINC000819472496	CF	On-Demand	Anodyne	AOC3	23	43
CN(C)CCc1ccccc1NC[C@H](O)c1ccccc1	ZINC000819472497	CF	On-Demand	Anodyne	AOC3	23	43
Cc1ccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819472500	EF	On-Demand	Anodyne	ADRB2	35	50
Cc1ccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819472500	EF	On-Demand	Anodyne	ADRB1	53	48
Cc1ccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819472500	EF	On-Demand	Anodyne	ADRB3	29	40
Cc1ccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819472501	EF	On-Demand	Anodyne	ADRB2	35	50
Cc1ccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819472501	EF	On-Demand	Anodyne	ADRB1	53	48
Cc1ccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819472501	EF	On-Demand	Anodyne	ADRB3	29	40
CCNc1ccc(Cl)cc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819472523	GI	On-Demand	Mild	PAPA1_CARPA	43	45
CCNc1ccc(Cl)cc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819472524	GI	On-Demand	Mild	PAPA1_CARPA	43	45
COC[C@@H](O)CNc1ccc(OC2COC2)cc1	ZINC000819472526	CC	On-Demand	Anodyne	ADRB1	15	41
COc1cccc([S@@](=O)CC(=O)NN2CCCNC2=O)c1	ZINC000819472560	DC	On-Demand	Anodyne	DRD4	40	30
COCCNC(=O)c1ccccc1NC(=O)Cn1cnc2sc(-c3ccccc3)cc2c1=O	ZINC000819472562	JG	On-Demand	Anodyne	POLR1A	46	35
O=C1c2ccccc2C(=O)N1CCOc1ccc(NC[C@H](O)C(F)(F)F)cc1	ZINC000819472579	GF	On-Demand	Anodyne	GALR3	40	32
O=C1c2ccccc2C(=O)N1CCOc1ccc(NC[C@@H](O)C(F)(F)F)cc1	ZINC000819472580	GF	On-Demand	Anodyne	GALR3	40	32
CC(C)c1nnc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n1C	ZINC000819472594	GE	On-Demand	Mild	PAPA1_CARPA	43	48
CC(C)c1nnc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n1C	ZINC000819472595	GE	On-Demand	Mild	PAPA1_CARPA	43	48
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccc(F)cc1	ZINC000819472669	EE	On-Demand	Anodyne	ADRB2	30	40
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccc(F)cc1	ZINC000819472669	EE	On-Demand	Anodyne	ADRB1	54	43
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccc(F)cc1	ZINC000819472669	EE	On-Demand	Anodyne	ADRB3	28	40
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccc(F)cc1	ZINC000819472670	EE	On-Demand	Anodyne	ADRB2	30	40
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccc(F)cc1	ZINC000819472670	EE	On-Demand	Anodyne	ADRB1	54	43
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccc(F)cc1	ZINC000819472670	EE	On-Demand	Anodyne	ADRB3	28	40
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccccc1F	ZINC000819472675	EE	On-Demand	Anodyne	ADRB1	55	33
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccccc1F	ZINC000819472676	EE	On-Demand	Anodyne	ADRB1	55	33
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(Cl)cc2OC)cc1	ZINC000819472691	FF	On-Demand	Anodyne	ADRB2	39	45
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(Cl)cc2OC)cc1	ZINC000819472691	FF	On-Demand	Anodyne	ADRB1	66	41
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(Cl)cc2OC)cc1	ZINC000819472691	FF	On-Demand	Anodyne	GRIN1	21	41
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(Cl)cc2OC)cc1	ZINC000819472691	FF	On-Demand	Anodyne	ADRB3	43	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(Cl)cc2OC)cc1	ZINC000819472692	FF	On-Demand	Anodyne	ADRB2	39	45
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(Cl)cc2OC)cc1	ZINC000819472692	FF	On-Demand	Anodyne	ADRB1	66	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(Cl)cc2OC)cc1	ZINC000819472692	FF	On-Demand	Anodyne	GRIN1	21	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(Cl)cc2OC)cc1	ZINC000819472692	FF	On-Demand	Anodyne	ADRB3	43	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2cc[nH]c12	ZINC000819472696	GI	On-Demand	Anodyne	CTSD	66	43
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2cc[nH]c12	ZINC000819472696	GI	On-Demand	Anodyne	PGC	53	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2cc[nH]c12	ZINC000819472696	GI	On-Demand	Anodyne	PAPA1_CARPA	32	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2cc[nH]c12	ZINC000819472696	GI	On-Demand	Anodyne	CCKAR	55	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2cc[nH]c12	ZINC000819472696	GI	On-Demand	Anodyne	TACR3	15	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2cc[nH]c12	ZINC000819472696	GI	On-Demand	Anodyne	REN	70	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2cc[nH]c12	ZINC000819472696	GI	On-Demand	Anodyne	REN1	21	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2cc[nH]c12	ZINC000819472696	GI	On-Demand	Anodyne	BACE1	45	41
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc2cc[nH]c12	ZINC000819472696	GI	On-Demand	Anodyne	FPR1	48	39
CC(=O)N1CCc2c(NC[C@@H](O)c3ccc(OC(F)(F)F)cc3)cccc21	ZINC000819472699	GH	On-Demand	Anodyne	P2RY1	63	40
CC(=O)N1CCc2c(NC[C@H](O)c3ccc(OC(F)(F)F)cc3)cccc21	ZINC000819472700	GH	On-Demand	Anodyne	P2RY1	63	40
O=C1c2ccccc2C(=O)N1CCOc1ccc(NCC2(O)CCCC2)cc1	ZINC000819472704	GG	On-Demand	Anodyne	LTA4H	26	41
CC(=O)N1CCc2c(NC[C@@H](O)c3cccc(F)c3)cccc21	ZINC000819472720	DF	On-Demand	Anodyne	KCNQ2	41	43
CC(=O)N1CCc2c(NC[C@H](O)c3cccc(F)c3)cccc21	ZINC000819472721	DF	On-Demand	Anodyne	KCNQ2	41	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2ccccc2F)cc1	ZINC000819472743	FH	On-Demand	Anodyne	PAPA1_CARPA	30	42
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2ccccc2F)cc1	ZINC000819472743	FH	On-Demand	Anodyne	FPR1	42	35
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2ccccc2F)cc1	ZINC000819472743	FH	On-Demand	Anodyne	PDS	51	34
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2ccccc2F)cc1	ZINC000819472746	FH	On-Demand	Anodyne	PAPA1_CARPA	30	42
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2ccccc2F)cc1	ZINC000819472746	FH	On-Demand	Anodyne	FPR1	42	35
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2ccccc2F)cc1	ZINC000819472746	FH	On-Demand	Anodyne	PDS	51	34
COC[C@@H](O)CNc1ccc(OCCN2C(=O)c3ccccc3C2=O)cc1	ZINC000819472762	FD	On-Demand	Anodyne	ADRB1	42	37
C#CCOc1ccccc1NC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819472772	FE	On-Demand	Mild	ADRB2	47	46
C#CCOc1ccccc1NC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819472772	FE	On-Demand	Mild	ADRB1	68	38
C#CCOc1ccccc1NC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819472772	FE	On-Demand	Mild	ADRB3	36	44
C#CCOc1ccccc1NC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819472772	FE	On-Demand	Mild	ABCB1	22	42
COCCNC(=O)c1ccccc1NC(=O)c1csc(-c2cccc(Cl)c2)n1	ZINC000819472774	HI	On-Demand	Anodyne	CHEK1	17	46
COCCNC(=O)c1ccccc1NC(=O)c1csc(-c2cccc(Cl)c2)n1	ZINC000819472774	HI	On-Demand	Anodyne	POLR1A	59	37
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819472776	FE	On-Demand	Mild	ADRB2	47	46
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819472776	FE	On-Demand	Mild	ADRB1	68	38
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819472776	FE	On-Demand	Mild	ADRB3	36	44
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819472776	FE	On-Demand	Mild	ABCB1	22	42
CSc1ccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819472791	FG	On-Demand	Anodyne	ADRB1	42	38
CSc1ccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819472793	FG	On-Demand	Anodyne	ADRB1	42	38
COCCNC(=O)c1ccccc1NC(=O)c1csc(-c2ccccc2)n1	ZINC000819472805	GG	On-Demand	Anodyne	CHEK1	18	53
COCCNC(=O)c1ccccc1NC(=O)c1csc(-c2ccccc2)n1	ZINC000819472805	GG	On-Demand	Anodyne	POLR1A	46	36
O=C1CCCN1C[C@@H](O)CNc1cc(Cl)ccc1OC1CCCC1	ZINC000819472821	FG	On-Demand	Anodyne	CCR3	20	40
O=C1CCCN1C[C@H](O)CNc1cc(Cl)ccc1OC1CCCC1	ZINC000819472824	FG	On-Demand	Anodyne	CCR3	20	40
C#CCOc1ccccc1NC[C@H](O)COCc1ccccc1Cl	ZINC000819472826	EG	On-Demand	Mild	FABP5	27	40
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCN1C(C)=O	ZINC000819472828	ED	On-Demand	Anodyne	F2	46	37
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCN1C(C)=O	ZINC000819472828	ED	On-Demand	Anodyne	CELA1	46	38
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCN1C(C)=O	ZINC000819472828	ED	On-Demand	Anodyne	ELANE	55	37
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCN1C(C)=O	ZINC000819472828	ED	On-Demand	Anodyne	HCRTR1	27	43
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCN1C(C)=O	ZINC000819472828	ED	On-Demand	Anodyne	TRY1_BOVIN	51	38
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCN1C(C)=O	ZINC000819472828	ED	On-Demand	Anodyne	PREP	57	37
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCN1C(C)=O	ZINC000819472828	ED	On-Demand	Anodyne	LGMN	82	38
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCN1C(C)=O	ZINC000819472828	ED	On-Demand	Anodyne	HCRTR2	20	40
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCN1C(C)=O	ZINC000819472828	ED	On-Demand	Anodyne	XIAP	48	42
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCN1C(C)=O	ZINC000819472828	ED	On-Demand	Anodyne	BRCA1	60	33
C#CCOc1ccccc1NC[C@@H](O)COCc1ccccc1Cl	ZINC000819472829	EG	On-Demand	Mild	FABP5	27	40
CC(=O)N1CCc2c(NC[C@H](O)c3ccc(Cl)cc3)cccc21	ZINC000819472831	EG	On-Demand	Anodyne	KCNQ2	40	40
N#CC1(NC(=O)C(F)=C2CCC2)CCN(Cc2ccccc2)CC1	ZINC000819472854	EG	On-Demand	Mild	SIGMAR1	55	45
N#CC1(NC(=O)C(F)=C2CCC2)CCN(Cc2ccccc2)CC1	ZINC000819472854	EG	On-Demand	Mild	NPFFR2	35	41
N#CC1(NC(=O)C(F)=C2CCC2)CCN(Cc2ccccc2)CC1	ZINC000819472854	EG	On-Demand	Mild	NPFFR1	47	41
O[C@@H](CNc1cc(Cl)ccc1OC1CCCC1)CN1CCOCC1	ZINC000819472870	FF	On-Demand	Anodyne	HRH1	16	41
O[C@@H](CNc1cc(Cl)ccc1OC1CCCC1)CN1CCOCC1	ZINC000819472870	FF	On-Demand	Anodyne	CCR3	22	41
O[C@H](CNc1cc(Cl)ccc1OC1CCCC1)CN1CCOCC1	ZINC000819472873	FF	On-Demand	Anodyne	HRH1	16	41
O[C@H](CNc1cc(Cl)ccc1OC1CCCC1)CN1CCOCC1	ZINC000819472873	FF	On-Demand	Anodyne	CCR3	22	41
CC(=O)OCCc1cccc(NC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819472874	EI	On-Demand	Anodyne	KCNK3	89	38
CC(=O)OCCc1cccc(NC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819472874	EI	On-Demand	Anodyne	KCNK9	78	38
Cc1ccccc1[C@@H](O)CNc1ccc(CNC(=O)OC(C)(C)C)cc1	ZINC000819472891	FI	On-Demand	Anodyne	FPR1	42	35
Cc1ccccc1[C@@H](O)CNc1ccc(CNC(=O)OC(C)(C)C)cc1	ZINC000819472891	FI	On-Demand	Anodyne	PDS	53	34
CC(C)(C)OC(=O)NCc1ccc(NCCS(C)(=O)=O)cc1	ZINC000819472908	EE	On-Demand	Anodyne	TRPV1	34	45
CC(C)(C)OC(=O)NCc1ccc(NCCS(C)(=O)=O)cc1	ZINC000819472908	EE	On-Demand	Anodyne	PTPRB	51	41
Cc1ccc(OC[C@@H](O)CNc2ccc(CNC(=O)OC(C)(C)C)cc2)cc1	ZINC000819472909	GH	On-Demand	Anodyne	ADRB2	55	50
Cc1ccc(OC[C@@H](O)CNc2ccc(CNC(=O)OC(C)(C)C)cc2)cc1	ZINC000819472909	GH	On-Demand	Anodyne	ADRB1	81	46
Cc1ccc(OC[C@@H](O)CNc2ccc(CNC(=O)OC(C)(C)C)cc2)cc1	ZINC000819472909	GH	On-Demand	Anodyne	GRIN1	23	42
Cc1ccc(OC[C@@H](O)CNc2ccc(CNC(=O)OC(C)(C)C)cc2)cc1	ZINC000819472909	GH	On-Demand	Anodyne	ADRB3	53	45
Cc1ccc(OC[C@@H](O)CNc2ccc(CNC(=O)OC(C)(C)C)cc2)cc1	ZINC000819472909	GH	On-Demand	Anodyne	PDS	61	40
Cc1ccc(OC[C@H](O)CNc2ccc(CNC(=O)OC(C)(C)C)cc2)cc1	ZINC000819472910	GH	On-Demand	Anodyne	ADRB2	55	50
Cc1ccc(OC[C@H](O)CNc2ccc(CNC(=O)OC(C)(C)C)cc2)cc1	ZINC000819472910	GH	On-Demand	Anodyne	ADRB1	81	46
Cc1ccc(OC[C@H](O)CNc2ccc(CNC(=O)OC(C)(C)C)cc2)cc1	ZINC000819472910	GH	On-Demand	Anodyne	GRIN1	23	42
Cc1ccc(OC[C@H](O)CNc2ccc(CNC(=O)OC(C)(C)C)cc2)cc1	ZINC000819472910	GH	On-Demand	Anodyne	ADRB3	53	45
Cc1ccc(OC[C@H](O)CNc2ccc(CNC(=O)OC(C)(C)C)cc2)cc1	ZINC000819472910	GH	On-Demand	Anodyne	PDS	61	40
C#CCOc1ccccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819472911	EF	On-Demand	Mild	ADRB2	31	45
C#CCOc1ccccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819472911	EF	On-Demand	Mild	ADRB1	64	41
C#CCOc1ccccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819472911	EF	On-Demand	Mild	CASR	40	36
C#CCOc1ccccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819472911	EF	On-Demand	Mild	ABCB1	26	46
C#CCOc1ccccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819472912	EF	On-Demand	Mild	ADRB2	31	45
C#CCOc1ccccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819472912	EF	On-Demand	Mild	ADRB1	64	41
C#CCOc1ccccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819472912	EF	On-Demand	Mild	CASR	40	36
C#CCOc1ccccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819472912	EF	On-Demand	Mild	ABCB1	26	46
O=C(NCc1ccccc1N1CCCCC1)C(F)=C1CCC1	ZINC000819472917	DH	On-Demand	Anodyne	KCNQ2	77	43
O=C(NCc1ccccc1N1CCCCC1)C(F)=C1CCC1	ZINC000819472917	DH	On-Demand	Anodyne	SCN2A	19	46
O=C(NCc1ccccc1N1CCCCC1)C(F)=C1CCC1	ZINC000819472917	DH	On-Demand	Anodyne	SCN10A	15	46
C#CCOc1ccccc1NCCC(=O)Nc1cc(OC)c(OC)c(OC)c1	ZINC000819472918	GG	On-Demand	Mild	PTK2	48	37
C#CCOc1ccccc1NC[C@H](O)COCCCC	ZINC000819472936	CE	On-Demand	Mild	ADRB2	20	41
C#CCOc1ccccc1NC[C@@H](O)COCCCC	ZINC000819472937	CE	On-Demand	Mild	ADRB2	20	41
O=C(NNc1cc(Cl)ccn1)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC000819472941	EH	On-Demand	Reactive	TYK2	60	37
C#CCOc1ccccc1NC[C@H](O)CN1CCOCC1	ZINC000819472968	CC	On-Demand	Mild	ABCB1	45	41
O=C(CCNc1ccc(OC2COC2)cc1)Nc1cccc(Cl)c1	ZINC000819472969	EH	On-Demand	Anodyne	EPHX2	18	45
C#CCOc1ccccc1NC[C@@H](O)CN1CCOCC1	ZINC000819472970	CC	On-Demand	Mild	ABCB1	45	41
CN(C)CCc1ccccc1NC[C@H](O)c1ccc(Cl)cc1	ZINC000819472971	DH	On-Demand	Anodyne	UTS2	47	37
C=C(C)C(C)(C)C(=O)NCCc1c[nH]c2cccc(OC)c12	ZINC000819472973	DG	On-Demand	Mild	MTNR1A	28	43
C=C(C)C(C)(C)C(=O)NCCc1c[nH]c2cccc(OC)c12	ZINC000819472973	DG	On-Demand	Mild	MTNR1B	20	49
C#CCOc1ccccc1NC[C@H](O)COc1ccc(OCC)cc1	ZINC000819472976	EF	On-Demand	Mild	ADRB2	43	44
C#CCOc1ccccc1NC[C@H](O)COc1ccc(OCC)cc1	ZINC000819472976	EF	On-Demand	Mild	ADRB1	49	42
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(OCC)cc1	ZINC000819472977	EF	On-Demand	Mild	ADRB2	43	44
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(OCC)cc1	ZINC000819472977	EF	On-Demand	Mild	ADRB1	49	42
CN(C[C@@H]1CCCC[C@H]1O)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819472996	FF	On-Demand	Mild	PAPA1_CARPA	36	40
CN(C[C@@H]1CCCC[C@H]1O)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819472999	FF	On-Demand	Mild	PAPA1_CARPA	36	40
CN(C[C@@H]1CCCC[C@@H]1O)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819473000	FF	On-Demand	Mild	PAPA1_CARPA	36	40
CN(C[C@@H]1CCCC[C@@H]1O)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819473002	FF	On-Demand	Mild	PAPA1_CARPA	36	40
C#CCOc1ccccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819473012	FG	On-Demand	Mild	GPR119	50	47
C#CCOc1ccccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819473014	FG	On-Demand	Mild	GPR119	50	47
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819473022	FH	On-Demand	Anodyne	PAPA1_CARPA	25	44
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2ccc(F)cc2)cc1	ZINC000819473022	FH	On-Demand	Anodyne	LEF	51	38
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819473024	FH	On-Demand	Anodyne	PAPA1_CARPA	25	44
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2ccc(F)cc2)cc1	ZINC000819473024	FH	On-Demand	Anodyne	LEF	51	38
C#CCOc1ccccc1NC[C@H](O)COCC(C)C	ZINC000819473026	CE	On-Demand	Mild	ADRB2	24	44
C#CCOc1ccccc1NC[C@@H](O)COCC(C)C	ZINC000819473027	CE	On-Demand	Mild	ADRB2	24	44
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819473042	GH	On-Demand	Anodyne	HRH1	21	43
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819473042	GH	On-Demand	Anodyne	GRIN1	27	41
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819473042	GH	On-Demand	Anodyne	CCR3	21	43
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819473044	GH	On-Demand	Anodyne	HRH1	21	43
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819473044	GH	On-Demand	Anodyne	GRIN1	27	41
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819473044	GH	On-Demand	Anodyne	CCR3	21	43
O[C@H](CNc1ccc(OC2COC2)cc1)COc1cccc2ccccc12	ZINC000819473047	FG	On-Demand	Anodyne	ADRB2	32	50
O[C@H](CNc1ccc(OC2COC2)cc1)COc1cccc2ccccc12	ZINC000819473047	FG	On-Demand	Anodyne	ADRB1	45	50
O[C@H](CNc1ccc(OC2COC2)cc1)COc1cccc2ccccc12	ZINC000819473047	FG	On-Demand	Anodyne	ADRB3	20	50
O[C@H](CNc1ccc(OC2COC2)cc1)COc1cccc2ccccc12	ZINC000819473047	FG	On-Demand	Anodyne	CYP2D6	23	46
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1cccc2ccccc12	ZINC000819473049	FG	On-Demand	Anodyne	ADRB2	32	50
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1cccc2ccccc12	ZINC000819473049	FG	On-Demand	Anodyne	ADRB1	45	50
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1cccc2ccccc12	ZINC000819473049	FG	On-Demand	Anodyne	ADRB3	20	50
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1cccc2ccccc12	ZINC000819473049	FG	On-Demand	Anodyne	CYP2D6	23	46
C#CCOc1ccccc1NC[C@@H](O)COC	ZINC000819473053	BD	On-Demand	Mild	ADRB2	27	43
C#CCOc1ccccc1NC[C@H](O)COC	ZINC000819473054	BD	On-Demand	Mild	ADRB2	27	43
CN(C)CCc1ccccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819473058	GG	On-Demand	Anodyne	AMY2	44	31
CN(C)CCc1ccccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819473058	GG	On-Demand	Anodyne	GPR119	42	52
CN(C)CCc1ccccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819473060	GG	On-Demand	Anodyne	AMY2	44	31
CN(C)CCc1ccccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819473060	GG	On-Demand	Anodyne	GPR119	42	52
N#Cc1ccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819473062	EE	On-Demand	Mild	ADRB1	42	35
N#Cc1ccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819473068	EE	On-Demand	Mild	ADRB1	42	35
O[C@@H](CNc1cc(Cl)ccc1OC[C@H]1CCCCO1)c1cccnc1	ZINC000819473073	FH	On-Demand	Anodyne	CYP3A4	46	34
O[C@H](CNc1cc(Cl)ccc1OC[C@@H]1CCCCO1)c1cccnc1	ZINC000819473075	FH	On-Demand	Anodyne	CYP3A4	46	34
O[C@H](CNc1cc(Cl)ccc1OC[C@H]1CCCCO1)c1cccnc1	ZINC000819473078	FH	On-Demand	Anodyne	CYP3A4	46	34
C=C(C)CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819473079	DF	On-Demand	Mild	PAPA1_CARPA	38	45
C=C(C)CN(C)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819473079	DF	On-Demand	Mild	CTSK	17	43
O[C@@H](CNc1cc(Cl)ccc1OC[C@@H]1CCCCO1)c1cccnc1	ZINC000819473080	FH	On-Demand	Anodyne	CYP3A4	46	34
C=C(C)CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819473085	DF	On-Demand	Mild	PAPA1_CARPA	38	45
C=C(C)CN(C)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819473085	DF	On-Demand	Mild	CTSK	17	43
C#CCOc1ccccc1NC[C@H](O)COc1ccccc1C	ZINC000819473087	DF	On-Demand	Mild	ADRB2	31	59
C#CCOc1ccccc1NC[C@H](O)COc1ccccc1C	ZINC000819473087	DF	On-Demand	Mild	ADRB1	56	36
C#CCOc1ccccc1NC[C@H](O)COc1ccccc1C	ZINC000819473087	DF	On-Demand	Mild	CYP2D6	17	43
C#CCOc1ccccc1NC[C@@H](O)COc1ccccc1C	ZINC000819473088	DF	On-Demand	Mild	ADRB2	31	59
C#CCOc1ccccc1NC[C@@H](O)COc1ccccc1C	ZINC000819473088	DF	On-Demand	Mild	ADRB1	56	36
C#CCOc1ccccc1NC[C@@H](O)COc1ccccc1C	ZINC000819473088	DF	On-Demand	Mild	CYP2D6	17	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819473106	FF	On-Demand	Anodyne	ADRB2	29	45
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819473106	FF	On-Demand	Anodyne	ADRB1	56	45
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819473107	FF	On-Demand	Anodyne	ADRB2	29	45
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819473107	FF	On-Demand	Anodyne	ADRB1	56	45
CC(=O)OCCc1cccc(NC(=O)c2cc(Br)oc2C)c1	ZINC000819473110	FH	On-Demand	Anodyne	KCNK3	84	36
CC(=O)OCCc1cccc(NC(=O)c2cc(Br)oc2C)c1	ZINC000819473110	FH	On-Demand	Anodyne	KCNK9	69	36
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccc2ccccc2c1	ZINC000819473115	FG	On-Demand	Anodyne	ADRB2	30	52
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccc2ccccc2c1	ZINC000819473115	FG	On-Demand	Anodyne	ADRB1	46	34
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccc2ccccc2c1	ZINC000819473115	FG	On-Demand	Anodyne	CYP2D6	17	40
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccc2ccccc2c1	ZINC000819473116	FG	On-Demand	Anodyne	ADRB2	30	52
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccc2ccccc2c1	ZINC000819473116	FG	On-Demand	Anodyne	ADRB1	46	34
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccc2ccccc2c1	ZINC000819473116	FG	On-Demand	Anodyne	CYP2D6	17	40
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1cccc(Br)c1	ZINC000819473117	GG	On-Demand	Anodyne	ADRB1	35	40
O[C@H](CNc1ccc(OC2COC2)cc1)COc1cccc(Br)c1	ZINC000819473119	GG	On-Demand	Anodyne	ADRB1	35	40
CC(=O)OCCc1cccc(NC(=O)CCc2cccc(OC(F)F)c2)c1	ZINC000819473149	GH	On-Demand	Anodyne	LTA4H	15	42
O=C(O)CCNC(=O)C(=O)Nc1nc(-c2cccs2)cs1	ZINC000819473177	ED	On-Demand	Anodyne	ROCK1	21	42
O=C(O)CCNC(=O)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819473186	ED	On-Demand	Anodyne	PRCP	22	56
O=C(O)CCNC(=O)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819473186	ED	On-Demand	Anodyne	CPT1A	40	37
O=C(O)CCNC(=O)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819473186	ED	On-Demand	Anodyne	EPHX2	15	68
O=C(O)CCNC(=O)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819473186	ED	On-Demand	Anodyne	SMO	60	54
O=C(O)CCNC(=O)N1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000819473186	ED	On-Demand	Anodyne	ETHR	74	48
O=C(O)CCNC(=O)CCCNC(=O)c1cccnc1	ZINC000819473188	CC	On-Demand	Anodyne	TBXA2R	54	49
O=C(O)CCNC(=O)CCCNC(=O)c1cccnc1	ZINC000819473188	CC	On-Demand	Anodyne	TBXAS1	129	51
O=C(O)CCNC(=O)CCCNC(=O)c1cccnc1	ZINC000819473188	CC	On-Demand	Anodyne	PTAFR	18	51
O=C(O)CCNC(=O)CCCNC(=O)c1cccnc1	ZINC000819473188	CC	On-Demand	Anodyne	HDAC6	15	43
O=C(O)CCNC(=O)CNC(=O)c1ccncc1	ZINC000819473192	CB	On-Demand	Anodyne	GCGR	40	35
O=C(O)CCNC(=O)CNC(=O)c1ccncc1	ZINC000819473192	CB	On-Demand	Anodyne	GIPR	42	35
O=C(O)CCNC(=O)CNC(=O)c1ccc(F)cc1	ZINC000819473199	CC	On-Demand	Anodyne	CA2	15	50
O=C(O)CCNC(=O)CNC(=O)c1ccc(F)cc1	ZINC000819473199	CC	On-Demand	Anodyne	GCGR	68	38
O=C(O)CCNC(=O)CNC(=O)c1ccc(F)cc1	ZINC000819473199	CC	On-Demand	Anodyne	MME	15	42
O=C(O)CCNC(=O)CNC(=O)c1ccc(F)cc1	ZINC000819473199	CC	On-Demand	Anodyne	GIPR	49	33
O=C(O)CCNC(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000819473208	CE	On-Demand	Anodyne	ADRA1A	17	42
O=C(O)CCNC(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000819473208	CE	On-Demand	Anodyne	PRCP	17	40
O=C(O)CCNC(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000819473208	CE	On-Demand	Anodyne	CCR1	30	46
O=C(O)CCNC(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000819473208	CE	On-Demand	Anodyne	EPHX2	22	47
O=C(O)CCNC(=O)N(Cc1ccccc1O)C1CCCCC1	ZINC000819473209	DF	On-Demand	Clean	ACE	53	41
O=C(O)CCNC(=O)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	ZINC000819473212	DB	On-Demand	Anodyne	PANC	50	33
O=C(O)CCNC(=O)C(=O)Nc1cnn(C[C@H]2CCCO2)c1	ZINC000819473214	DB	On-Demand	Anodyne	PANC	50	33
O=C(O)CCNC(=O)CCCc1ccccc1Br	ZINC000819473215	DE	On-Demand	Anodyne	MME	23	43
O=C(O)CCNC(=O)CCCc1ccccc1Br	ZINC000819473215	DE	On-Demand	Anodyne	HDAC8	18	48
O=C(O)CCNC(=O)CCCc1ccccc1Br	ZINC000819473215	DE	On-Demand	Anodyne	MTNR1A	22	40
O=C(O)CCNC(=O)CCCc1ccccc1Br	ZINC000819473215	DE	On-Demand	Anodyne	CA9	17	44
O=C(O)CCNC(=O)N1CCC(c2ccccc2F)CC1	ZINC000819473219	CE	On-Demand	Anodyne	RBP4	69	43
O=C(O)CCNC(=O)N1CC(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819473223	EE	On-Demand	Anodyne	GCGR	55	41
O=C(O)CCNC(=O)N1CC(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819473223	EE	On-Demand	Anodyne	GIPR	41	38
O=C(O)CCNC(=O)N1CC(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819473223	EE	On-Demand	Anodyne	LIPG	18	40
O=C(O)CCNC(=O)N1CCC(C(=O)NC2CCCCC2)CC1	ZINC000819473227	ED	On-Demand	Anodyne	EPHX2	31	52
O=C(O)CCNC(=O)CCSc1ccccn1	ZINC000819473239	CD	On-Demand	Anodyne	FAS	24	47
O=C(O)CCNC(=O)N1CCC(C(=O)Nc2ccccc2O)CC1	ZINC000819473254	ED	On-Demand	Anodyne	EPHX2	23	47
O=C(O)CCNC(=O)N1CC(Cc2ccccc2)C1	ZINC000819473256	CD	On-Demand	Anodyne	GRIN2B	48	36
O=C(O)CCNC(=O)N1CC(Cc2ccccc2)C1	ZINC000819473256	CD	On-Demand	Anodyne	MME	24	44
O=C(O)CCNC(=O)N1CC(Cc2ccccc2)C1	ZINC000819473256	CD	On-Demand	Anodyne	CCR3	21	42
O=C(O)CCNC(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000819473260	ED	On-Demand	Anodyne	SIGMAR1	16	61
O=C(O)CCNC(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000819473260	ED	On-Demand	Anodyne	PREP	24	45
O=C(O)CCNC(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000819473260	ED	On-Demand	Anodyne	EPHX2	50	49
O=C(O)CCNC(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000819473260	ED	On-Demand	Anodyne	TPSAB1	16	44
O=C(O)CCNC(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000819473260	ED	On-Demand	Anodyne	CACNA1G	40	39
O=C(O)CCNC(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000819473260	ED	On-Demand	Anodyne	NPSR1	26	42
O=C(O)CCNC(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000819473260	ED	On-Demand	Anodyne	NAMPT	18	40
O=C(O)CCNC(=O)N1CCC(C(=O)NCc2ccccc2)CC1	ZINC000819473260	ED	On-Demand	Anodyne	TMPRSS11D	61	32
O=C(O)CCNC(=O)N(CCc1ccccc1)C1CC1	ZINC000819473262	CD	On-Demand	Anodyne	ACE	40	36
O=C(O)CCNC(=O)N(CCc1ccccc1)C1CC1	ZINC000819473262	CD	On-Demand	Anodyne	GCGR	16	41
O=C(O)CCNC(=O)N(CCc1ccccc1)C1CC1	ZINC000819473262	CD	On-Demand	Anodyne	MME	23	49
O=C(O)CCNC(=O)N(CCc1ccccc1)C1CC1	ZINC000819473262	CD	On-Demand	Anodyne	C5AR1	27	40
O=C(O)CCNC(=O)C1CC(OCc2ccccc2)C1	ZINC000819473270	CD	On-Demand	Anodyne	MME	19	40
O=C(O)CCNC(=O)CCCOc1ccc2c(c1)OCO2	ZINC000819473297	CD	On-Demand	Anodyne	EDNRB	66	42
O=C(O)CCNC(=O)CCCOc1ccc2c(c1)OCO2	ZINC000819473297	CD	On-Demand	Anodyne	EDNRA	64	42
O=C(O)CCNC(=O)CCCOc1ccc2c(c1)OCO2	ZINC000819473297	CD	On-Demand	Anodyne	BMP1	41	37
O=C(O)CCNC(=O)CCCOc1ccc2c(c1)OCO2	ZINC000819473297	CD	On-Demand	Anodyne	LTB4R	35	44
O=C(O)CCNC(=O)CCCOc1ccc2c(c1)OCO2	ZINC000819473297	CD	On-Demand	Anodyne	LTB4R2	48	42
O=C(O)CCNC(=O)CCCOc1ccc2c(c1)OCO2	ZINC000819473297	CD	On-Demand	Anodyne	NOS2	50	31
O=C(O)CCNC(=O)N1CCC(c2cccc(F)c2)CC1	ZINC000819473298	CE	On-Demand	Anodyne	CCR1	19	40
O=C(O)CCNC(=O)N1CCC(c2cccc(F)c2)CC1	ZINC000819473298	CE	On-Demand	Anodyne	CCR5	86	35
O=C(O)CCNC(=O)N1CCC(c2cccc(F)c2)CC1	ZINC000819473298	CE	On-Demand	Anodyne	LIPE	15	47
O=C(O)CCNC(=O)C(=O)Nc1ccnc(Oc2ccccc2)c1	ZINC000819473310	ED	On-Demand	Anodyne	LTA4H	15	42
O=C(O)CCNC(=O)N1CCC(c2cc[nH]n2)CC1	ZINC000819473315	CC	On-Demand	Anodyne	EPHX2	15	41
O=C(O)CCNC(=O)CSCC(=O)Nc1cccc(Br)c1	ZINC000819473331	GD	On-Demand	Anodyne	EGFR	31	41
O=C(O)CCNC(=O)CCOc1ccc2ccccc2c1	ZINC000819473332	CE	On-Demand	Anodyne	PPARG	19	49
O=C(O)CCNC(=O)CCOc1ccc2ccccc2c1	ZINC000819473332	CE	On-Demand	Anodyne	PPARA	15	46
O=C(O)CCNC(=O)CCOc1ccc2ccccc2c1	ZINC000819473332	CE	On-Demand	Anodyne	CYSLTR1	34	43
O=C(O)CCNC(=O)CCOc1ccc2ccccc2c1	ZINC000819473332	CE	On-Demand	Anodyne	LTA4H	27	45
O=C(O)CCNC(=O)CCOc1ccc2ccccc2c1	ZINC000819473332	CE	On-Demand	Anodyne	MTNR1A	54	44
O=C(O)CCNC(=O)CCOc1ccc2ccccc2c1	ZINC000819473332	CE	On-Demand	Anodyne	MTNR1B	36	44
O=C(O)CCNC(=O)CCOc1ccc2ccccc2c1	ZINC000819473332	CE	On-Demand	Anodyne	PLA2G4B	47	33
O=C(O)CCNC(=O)CCOc1ccc2ccccc2c1	ZINC000819473332	CE	On-Demand	Anodyne	FFAR1	22	40
O=C(O)CCNC(=O)C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1	ZINC000819473334	FD	On-Demand	Anodyne	ITK	16	46
O=C(O)CCNC(=O)C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1	ZINC000819473334	FD	On-Demand	Anodyne	PANC	43	42
O=C(O)CCNC(=O)CCCOc1ccc2c(c1)CCC2	ZINC000819473340	CD	On-Demand	Anodyne	PPARG	27	46
O=C(O)CCNC(=O)CCCOc1ccc2c(c1)CCC2	ZINC000819473340	CD	On-Demand	Anodyne	PPARA	22	45
O=C(O)CCNC(=O)CCCOc1ccc2c(c1)CCC2	ZINC000819473340	CD	On-Demand	Anodyne	NQO2	20	42
O=C(O)CCNC(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000819473347	DD	On-Demand	Anodyne	DRD4	26	49
O=C(O)CCNC(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000819473347	DD	On-Demand	Anodyne	SIGMAR1	17	48
O=C(O)CCNC(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000819473347	DD	On-Demand	Anodyne	SLC6A5	34	40
O=C(O)CCNC(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000819473347	DD	On-Demand	Anodyne	EPHX2	62	42
O=C(O)CCNC(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000819473347	DD	On-Demand	Anodyne	MCHR1	19	52
O=C(O)CCNC(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000819473347	DD	On-Demand	Anodyne	CCR8	78	41
O=C(O)CCNC(=O)N1CCC(NC(=O)c2ccccc2)CC1	ZINC000819473347	DD	On-Demand	Anodyne	HPGDS	33	40
CCOc1ccc(OC[C@@H](O)CNc2cc(F)c(OC)cc2C)cc1	ZINC000819473402	EG	On-Demand	Anodyne	ADRB2	26	40
CCOc1ccc(OC[C@H](O)CNc2cc(F)c(OC)cc2C)cc1	ZINC000819473403	EG	On-Demand	Anodyne	ADRB2	26	40
COCCNC(=O)c1ccccc1NC(=O)CN1CCCC1=O	ZINC000819473423	DC	On-Demand	Anodyne	POLR1A	41	34
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2ccc(C#N)cc2)cc1	ZINC000819473452	FH	On-Demand	Mild	CTRB_BOVIN	44	32
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2ccc(C#N)cc2)cc1	ZINC000819473453	FH	On-Demand	Mild	CTRB_BOVIN	44	32
CC(C)(C)OC(=O)NCc1ccc(NCCC(=O)Nc2cccnc2)cc1	ZINC000819473454	FH	On-Demand	Anodyne	NAMPT	61	54
O=C(NN1CCCNC1=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819473476	GE	On-Demand	Anodyne	CNR1	61	37
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc(OC3COC3)cc2)CC1	ZINC000819473496	GF	On-Demand	Anodyne	GPR119	54	43
C#CCOc1ccccc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819473497	DF	On-Demand	Mild	ADRB2	44	52
C#CCOc1ccccc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819473497	DF	On-Demand	Mild	ADRB1	51	40
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819473498	DF	On-Demand	Mild	ADRB2	44	52
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819473498	DF	On-Demand	Mild	ADRB1	51	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc(OC3COC3)cc2)CC1	ZINC000819473499	GF	On-Demand	Anodyne	GPR119	54	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819473515	GH	On-Demand	Bother	CACNA1C	51	34
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819473515	GH	On-Demand	Bother	CACNA1D	79	34
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819473515	GH	On-Demand	Bother	PDS	34	44
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819473517	GH	On-Demand	Bother	CACNA1C	51	34
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819473517	GH	On-Demand	Bother	CACNA1D	79	34
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819473517	GH	On-Demand	Bother	PDS	34	44
C#CCOc1ccccc1NC[C@@H](O)COCC	ZINC000819473519	BD	On-Demand	Mild	ADRB2	23	42
C#CCOc1ccccc1NC[C@H](O)COCC	ZINC000819473521	BD	On-Demand	Mild	ADRB2	23	42
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccc(Cl)cc1	ZINC000819473525	EF	On-Demand	Anodyne	ADRB2	24	40
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccc(Cl)cc1	ZINC000819473525	EF	On-Demand	Anodyne	ADRB1	47	43
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccc(Cl)cc1	ZINC000819473525	EF	On-Demand	Anodyne	ADRB3	25	40
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccc(Cl)cc1	ZINC000819473527	EF	On-Demand	Anodyne	ADRB2	24	40
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccc(Cl)cc1	ZINC000819473527	EF	On-Demand	Anodyne	ADRB1	47	43
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccc(Cl)cc1	ZINC000819473527	EF	On-Demand	Anodyne	ADRB3	25	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccccc1N1CCCCC1)C2	ZINC000819473530	GG	On-Demand	Anodyne	KCNQ2	69	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccccc1N1CCCCC1)C2	ZINC000819473530	GG	On-Demand	Anodyne	SCN2A	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccccc1N1CCCCC1)C2	ZINC000819473532	GG	On-Demand	Anodyne	KCNQ2	69	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccccc1N1CCCCC1)C2	ZINC000819473532	GG	On-Demand	Anodyne	SCN2A	17	40
C#CCOc1ccccc1NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819473534	FG	On-Demand	Mild	HCN1	49	30
C#CCOc1ccccc1NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819473534	FG	On-Demand	Mild	HCN4	47	30
C#CCOc1ccccc1NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819473536	FG	On-Demand	Mild	HCN1	49	30
C#CCOc1ccccc1NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819473536	FG	On-Demand	Mild	HCN4	47	30
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819473539	FH	On-Demand	Anodyne	ADRB2	26	40
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819473539	FH	On-Demand	Anodyne	ADRB1	33	40
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819473539	FH	On-Demand	Anodyne	ADRB3	29	40
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819473539	FH	On-Demand	Anodyne	MME	64	36
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819473539	FH	On-Demand	Anodyne	CTSD	18	40
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819473539	FH	On-Demand	Anodyne	PGC	41	39
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819473539	FH	On-Demand	Anodyne	PAPA1_CARPA	48	47
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819473539	FH	On-Demand	Anodyne	CCKAR	42	38
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819473539	FH	On-Demand	Anodyne	CTSK	24	49
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819473539	FH	On-Demand	Anodyne	TACR3	19	48
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819473539	FH	On-Demand	Anodyne	REN	57	44
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819473539	FH	On-Demand	Anodyne	CAPN1	19	40
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819473539	FH	On-Demand	Anodyne	FPR1	57	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819473539	FH	On-Demand	Anodyne	AMP1_PLAFQ	50	39
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)Cc2ccccc2)cc1	ZINC000819473539	FH	On-Demand	Anodyne	PDS	73	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)c1	ZINC000819473540	FF	On-Demand	Anodyne	ADRB2	25	44
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)c1	ZINC000819473540	FF	On-Demand	Anodyne	ADRB1	48	39
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)c1	ZINC000819473540	FF	On-Demand	Anodyne	ABCB1	15	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819473541	FH	On-Demand	Anodyne	ADRB2	26	40
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819473541	FH	On-Demand	Anodyne	ADRB1	33	40
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819473541	FH	On-Demand	Anodyne	ADRB3	29	40
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819473541	FH	On-Demand	Anodyne	MME	64	36
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819473541	FH	On-Demand	Anodyne	CTSD	18	40
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819473541	FH	On-Demand	Anodyne	PGC	41	39
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819473541	FH	On-Demand	Anodyne	PAPA1_CARPA	48	47
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819473541	FH	On-Demand	Anodyne	CCKAR	42	38
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819473541	FH	On-Demand	Anodyne	CTSK	24	49
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819473541	FH	On-Demand	Anodyne	TACR3	19	48
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819473541	FH	On-Demand	Anodyne	REN	57	44
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819473541	FH	On-Demand	Anodyne	CAPN1	19	40
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819473541	FH	On-Demand	Anodyne	FPR1	57	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819473541	FH	On-Demand	Anodyne	AMP1_PLAFQ	50	39
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)Cc2ccccc2)cc1	ZINC000819473541	FH	On-Demand	Anodyne	PDS	73	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)c1	ZINC000819473542	FF	On-Demand	Anodyne	ADRB2	25	44
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)c1	ZINC000819473542	FF	On-Demand	Anodyne	ADRB1	48	39
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)c1	ZINC000819473542	FF	On-Demand	Anodyne	ABCB1	15	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819473551	GJ	On-Demand	Anodyne	ADRB1	21	40
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1	ZINC000819473551	GJ	On-Demand	Anodyne	PDS	43	38
C#CCOc1ccccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819473553	FF	On-Demand	Mild	ADRB2	51	58
C#CCOc1ccccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819473553	FF	On-Demand	Mild	ADRB1	78	58
C#CCOc1ccccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819473553	FF	On-Demand	Mild	ADRB3	41	48
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819473555	FF	On-Demand	Mild	ADRB2	51	58
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819473555	FF	On-Demand	Mild	ADRB1	78	58
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819473555	FF	On-Demand	Mild	ADRB3	41	48
O=C(O)CCNC(=O)CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2	ZINC000819473581	CD	On-Demand	Anodyne	BOTA	30	43
O=C(O)CCNC(=O)CNC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819473585	ED	On-Demand	Anodyne	CA2	18	49
O=C(O)CCNC(=O)CNC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819473585	ED	On-Demand	Anodyne	GCGR	72	47
O=C(O)CCNC(=O)CNC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819473585	ED	On-Demand	Anodyne	MME	38	50
O=C(O)CCNC(=O)CNC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819473585	ED	On-Demand	Anodyne	HDAC8	15	42
O=C(O)CCNC(=O)CNC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819473585	ED	On-Demand	Anodyne	PRNP	23	41
O=C(O)CCNC(=O)CNC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819473585	ED	On-Demand	Anodyne	HDAC1	18	42
O=C(O)CCNC(=O)CNC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819473585	ED	On-Demand	Anodyne	HDAC2	15	41
O=C(O)CCNC(=O)CNC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819473585	ED	On-Demand	Anodyne	GIPR	70	38
O=C(O)CCNC(=O)N1CCC(NC(=O)C2CCCCC2)CC1	ZINC000819473587	ED	On-Demand	Anodyne	EPHX2	28	46
O=C(O)CCNC(=O)Cc1c[nH]c2cc(Br)ccc12	ZINC000819473601	EE	On-Demand	Anodyne	ACHE	26	42
O=C(O)CCNC(=O)Cc1c[nH]c2cc(Br)ccc12	ZINC000819473601	EE	On-Demand	Anodyne	GRIN1	19	42
O=C(O)CCNC(=O)Cc1c[nH]c2cc(Br)ccc12	ZINC000819473601	EE	On-Demand	Anodyne	TPR	18	59
O=C(O)CCNC(=O)N1CCC(NC(=O)C2CC2)CC1	ZINC000819473604	CC	On-Demand	Anodyne	EPHX2	29	41
O=C(/C=C\[C@H]1CCCO1)N1CCC(N2CCS(=O)(=O)CC2)CC1	ZINC000819473610	EC	On-Demand	Anodyne	L3MBTL3	66	35
O=C(O)CCNC(=O)C(=O)Nc1ccnc(Oc2ccccc2Cl)c1	ZINC000819473612	FE	On-Demand	Anodyne	TYK2	46	33
O=C(/C=C/[C@@H]1CCCO1)N1CCC(N2CCS(=O)(=O)CC2)CC1	ZINC000819473613	EC	On-Demand	Anodyne	L3MBTL3	66	35
O=C(/C=C\[C@@H]1CCCO1)N1CCC(N2CCS(=O)(=O)CC2)CC1	ZINC000819473615	EC	On-Demand	Anodyne	L3MBTL3	66	35
O=C(/C=C/[C@H]1CCCO1)N1CCC(N2CCS(=O)(=O)CC2)CC1	ZINC000819473617	EC	On-Demand	Anodyne	L3MBTL3	66	35
O=C(O)CCNC(=O)C(=O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1	ZINC000819473622	FD	On-Demand	Anodyne	GCGR	27	47
O=C(O)CCNC(=O)C(=O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1	ZINC000819473622	FD	On-Demand	Anodyne	SERPINE1	17	41
O=C(O)CCNC(=O)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	ZINC000819473631	GC	On-Demand	Anodyne	DRD4	30	44
O=C(O)CCNC(=O)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	ZINC000819473631	GC	On-Demand	Anodyne	ACHE	29	40
O=C(O)CCNC(=O)C(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	ZINC000819473631	GC	On-Demand	Anodyne	SIGMAR1	27	41
O=C(O)CCNC(=O)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819473634	GC	On-Demand	Anodyne	DRD4	30	44
O=C(O)CCNC(=O)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819473634	GC	On-Demand	Anodyne	ACHE	29	40
O=C(O)CCNC(=O)C(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819473634	GC	On-Demand	Anodyne	SIGMAR1	27	41
O=C(O)CCNC(=O)C(=O)Nc1cnccc1-c1ccc(C(F)(F)F)cc1	ZINC000819473647	GE	On-Demand	Anodyne	TRPV1	16	46
O=C(O)CCNC(=O)C(=O)Nc1cnccc1-c1ccc(C(F)(F)F)cc1	ZINC000819473647	GE	On-Demand	Anodyne	GIPR	40	38
O=C(O)CCNC(=O)C1CCN(c2cnccn2)CC1	ZINC000819473660	CC	On-Demand	Anodyne	TBK1	47	33
O=C(O)CCNC(=O)N(Cc1cccnc1)C1CC1	ZINC000819473662	CD	On-Demand	Anodyne	GCGR	16	41
O=C(O)CCNC(=O)N(Cc1cccnc1)C1CC1	ZINC000819473662	CD	On-Demand	Anodyne	TBXAS1	81	45
O=C(O)CCNC(=O)N(Cc1cccnc1)C1CC1	ZINC000819473662	CD	On-Demand	Anodyne	CHRNA7	40	36
O=C(O)CCNC(=O)N(Cc1cccnc1)C1CC1	ZINC000819473662	CD	On-Demand	Anodyne	GIPR	21	40
O=C(O)CCNC(=O)N(Cc1cccnc1)C1CC1	ZINC000819473662	CD	On-Demand	Anodyne	NAMPT	45	38
O=C(O)CCNC(=O)CNC(=O)c1ccccc1I	ZINC000819473680	GC	On-Demand	Anodyne	MME	20	42
CN(C)CCc1ccccc1NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819473685	FH	On-Demand	Anodyne	CCR2	15	40
O=C(O)CCNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819473686	EC	On-Demand	Anodyne	P2RY12	86	46
O=C(O)CCNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819473686	EC	On-Demand	Anodyne	GRIN2B	25	46
O=C(O)CCNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819473686	EC	On-Demand	Anodyne	PREP	30	40
O=C(O)CCNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819473686	EC	On-Demand	Anodyne	TGM2	50	44
O=C(O)CCNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819473686	EC	On-Demand	Anodyne	NPR	41	32
O=C(O)CCNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819473686	EC	On-Demand	Anodyne	F13A1	50	44
O=C(O)CCNC(=O)CN1CCN(C(=O)OCc2ccccc2)CC1	ZINC000819473686	EC	On-Demand	Anodyne	SLC12A5	52	37
O=C(O)CCNC(=O)N1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000819473688	FC	On-Demand	Anodyne	CCR8	95	42
O=C(O)CCNC(=O)N1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000819473688	FC	On-Demand	Anodyne	SFRP1	115	39
O=C(O)CCNC(=O)N1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000819473688	FC	On-Demand	Anodyne	WNT3	76	34
O=C(O)CCNC(=O)N1CCC(c2ncc[nH]2)CC1	ZINC000819473690	CC	On-Demand	Anodyne	HTR2B	19	41
O=C(O)CCNC(=O)N(Cc1ccccc1)Cc1ccccc1F	ZINC000819473691	EG	On-Demand	Anodyne	MME	21	45
O=C(O)CCNC(=O)N(Cc1ccccc1)Cc1ccccc1F	ZINC000819473691	EG	On-Demand	Anodyne	PTGES	19	44
O=C(O)CCNC(=O)C(=O)Nc1cnn(Cc2ccccc2)c1	ZINC000819473692	DC	On-Demand	Anodyne	MME	19	40
O=C(O)CCNC(=O)C(=O)Nc1cnn(Cc2ccccc2)c1	ZINC000819473692	DC	On-Demand	Anodyne	ITK	22	56
O=C(O)CCNC(=O)C(=O)Nc1cnn(Cc2ccccc2)c1	ZINC000819473692	DC	On-Demand	Anodyne	PANC	56	42
O=C(O)CCNC(=O)CCCNS(=O)(=O)c1ccc(F)cc1	ZINC000819473693	EC	On-Demand	Anodyne	CA2	18	44
O=C(O)CCNC(=O)CCCNS(=O)(=O)c1ccc(F)cc1	ZINC000819473693	EC	On-Demand	Anodyne	TBXA2R	59	48
O=C(O)CCNC(=O)CCCNS(=O)(=O)c1ccc(F)cc1	ZINC000819473693	EC	On-Demand	Anodyne	TBXAS1	48	50
O=C(O)CCNC(=O)CCCNS(=O)(=O)c1ccc(F)cc1	ZINC000819473693	EC	On-Demand	Anodyne	CA1	19	42
O=C(O)CCNC(=O)CCCNS(=O)(=O)c1ccc(F)cc1	ZINC000819473693	EC	On-Demand	Anodyne	CA4	19	42
O=C(O)CCNC(=O)CCSc1ccnc2cc(Cl)ccc12	ZINC000819473695	EF	On-Demand	Anodyne	HRP1_PLAFA	119	45
O=C(O)CCNC(=O)N1CCC(c2cc3ccccc3[nH]2)CC1	ZINC000819473699	DF	On-Demand	Anodyne	CYP51A1	22	42
O=C(O)CCNC(=O)N1CCC(c2cc3ccccc3[nH]2)CC1	ZINC000819473699	DF	On-Demand	Anodyne	GRIN2D	54	30
O=C(O)CCNC(=O)N1CCC(c2cc3ccccc3[nH]2)CC1	ZINC000819473699	DF	On-Demand	Anodyne	AKR1C3	17	42
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819473706	FI	On-Demand	Anodyne	ADRB2	30	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819473706	FI	On-Demand	Anodyne	ADRB1	35	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819473706	FI	On-Demand	Anodyne	ADRB3	32	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819473706	FI	On-Demand	Anodyne	PAPA1_CARPA	41	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819473706	FI	On-Demand	Anodyne	CCKAR	41	37
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819473706	FI	On-Demand	Anodyne	CTSK	28	51
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819473706	FI	On-Demand	Anodyne	CTSL	27	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819473706	FI	On-Demand	Anodyne	TACR3	17	45
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819473706	FI	On-Demand	Anodyne	MMP3	38	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819473706	FI	On-Demand	Anodyne	REN	41	42
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819473706	FI	On-Demand	Anodyne	FURIN	41	32
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819473706	FI	On-Demand	Anodyne	CTSS	15	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819473706	FI	On-Demand	Anodyne	MMP1	15	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819473706	FI	On-Demand	Anodyne	FPR1	49	38
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819473706	FI	On-Demand	Anodyne	AMP1_PLAFQ	47	36
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CCc2ccccc2)cc1	ZINC000819473706	FI	On-Demand	Anodyne	PDS	65	39
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819473707	FI	On-Demand	Anodyne	ADRB2	30	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819473707	FI	On-Demand	Anodyne	ADRB1	35	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819473707	FI	On-Demand	Anodyne	ADRB3	32	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819473707	FI	On-Demand	Anodyne	PAPA1_CARPA	41	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819473707	FI	On-Demand	Anodyne	CCKAR	41	37
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819473707	FI	On-Demand	Anodyne	CTSK	28	51
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819473707	FI	On-Demand	Anodyne	CTSL	27	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819473707	FI	On-Demand	Anodyne	TACR3	17	45
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819473707	FI	On-Demand	Anodyne	MMP3	38	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819473707	FI	On-Demand	Anodyne	REN	41	42
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819473707	FI	On-Demand	Anodyne	FURIN	41	32
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819473707	FI	On-Demand	Anodyne	CTSS	15	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819473707	FI	On-Demand	Anodyne	MMP1	15	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819473707	FI	On-Demand	Anodyne	FPR1	49	38
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819473707	FI	On-Demand	Anodyne	AMP1_PLAFQ	47	36
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CCc2ccccc2)cc1	ZINC000819473707	FI	On-Demand	Anodyne	PDS	65	39
C#CCOc1ccccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819473710	DC	On-Demand	Mild	ABCB1	62	38
C#CCOc1ccccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819473711	DC	On-Demand	Mild	ABCB1	62	38
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819473712	GI	On-Demand	Anodyne	TRPV1	34	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819473712	GI	On-Demand	Anodyne	LEF	44	32
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819473712	GI	On-Demand	Anodyne	PDS	41	34
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819473713	GI	On-Demand	Anodyne	TRPV1	34	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819473713	GI	On-Demand	Anodyne	LEF	44	32
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819473713	GI	On-Demand	Anodyne	PDS	41	34
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2ccccc2Cl)cc1	ZINC000819473716	GJ	On-Demand	Anodyne	FPR1	42	37
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2ccccc2Cl)cc1	ZINC000819473716	GJ	On-Demand	Anodyne	PDS	56	39
COCCNC(=O)c1ccccc1NC(=O)c1ccc(N2CCN(C(C)=O)CC2)c([N+](=O)[O-])c1	ZINC000819473731	JD	On-Demand	Bother	DRD2	18	44
COCCNC(=O)c1ccccc1NC(=O)c1ccc(N2CCN(C(C)=O)CC2)c([N+](=O)[O-])c1	ZINC000819473731	JD	On-Demand	Bother	DRD4	42	34
COCCNC(=O)c1ccccc1NC(=O)c1ccc(N2CCN(C(C)=O)CC2)c([N+](=O)[O-])c1	ZINC000819473731	JD	On-Demand	Bother	DRD3	36	44
COCCNC(=O)c1ccccc1NC(=O)c1ccc(N2CCN(C(C)=O)CC2)c([N+](=O)[O-])c1	ZINC000819473731	JD	On-Demand	Bother	TAAR1	33	49
COCCNC(=O)c1ccccc1NC(=O)c1ccc(N2CCN(C(C)=O)CC2)c([N+](=O)[O-])c1	ZINC000819473731	JD	On-Demand	Bother	WDR5	34	41
C#CCOc1ccccc1NCC1(O)CCCCC1	ZINC000819473735	CF	On-Demand	Mild	HCN1	49	31
C#CCOc1ccccc1NCC1(O)CCCCC1	ZINC000819473735	CF	On-Demand	Mild	HCN4	47	31
C#CCOc1ccccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819473739	EF	On-Demand	Mild	ADRB2	39	43
C#CCOc1ccccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819473739	EF	On-Demand	Mild	ADRB1	67	38
C#CCOc1ccccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819473739	EF	On-Demand	Mild	ABCB1	24	52
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819473740	EF	On-Demand	Mild	ADRB2	39	43
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819473740	EF	On-Demand	Mild	ADRB1	67	38
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819473740	EF	On-Demand	Mild	ABCB1	24	52
C#CCOc1ccccc1NC[C@H](O)COCc1ccc(OC)cc1	ZINC000819473753	EF	On-Demand	Mild	ADRB2	27	43
C#CCOc1ccccc1NC[C@H](O)COCc1ccc(OC)cc1	ZINC000819473753	EF	On-Demand	Mild	ADRB3	15	43
C#CCOc1ccccc1NC[C@@H](O)COCc1ccc(OC)cc1	ZINC000819473754	EF	On-Demand	Mild	ADRB2	27	43
C#CCOc1ccccc1NC[C@@H](O)COCc1ccc(OC)cc1	ZINC000819473754	EF	On-Demand	Mild	ADRB3	15	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819473755	GH	On-Demand	Anodyne	ADRB2	58	45
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819473755	GH	On-Demand	Anodyne	ADRB1	89	47
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819473755	GH	On-Demand	Anodyne	GRIN1	25	51
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819473755	GH	On-Demand	Anodyne	ADRB3	58	47
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819473755	GH	On-Demand	Anodyne	PAPA1_CARPA	20	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1	ZINC000819473755	GH	On-Demand	Anodyne	PDS	67	39
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819473756	GH	On-Demand	Anodyne	ADRB2	58	45
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819473756	GH	On-Demand	Anodyne	ADRB1	89	47
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819473756	GH	On-Demand	Anodyne	GRIN1	25	51
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819473756	GH	On-Demand	Anodyne	ADRB3	58	47
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819473756	GH	On-Demand	Anodyne	PAPA1_CARPA	20	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1	ZINC000819473756	GH	On-Demand	Anodyne	PDS	67	39
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819473763	FH	On-Demand	Anodyne	ADRB2	70	53
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819473763	FH	On-Demand	Anodyne	ADRB1	98	53
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819473763	FH	On-Demand	Anodyne	ADRB3	64	53
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819473763	FH	On-Demand	Anodyne	CASR	41	47
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819473763	FH	On-Demand	Anodyne	CTSK	16	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819473763	FH	On-Demand	Anodyne	CYP2D6	16	45
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819473763	FH	On-Demand	Anodyne	ABCB1	22	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819473763	FH	On-Demand	Anodyne	FPR1	42	35
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2)cc1	ZINC000819473763	FH	On-Demand	Anodyne	PDS	102	51
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819473764	FH	On-Demand	Anodyne	ADRB2	70	53
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819473764	FH	On-Demand	Anodyne	ADRB1	98	53
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819473764	FH	On-Demand	Anodyne	ADRB3	64	53
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819473764	FH	On-Demand	Anodyne	CASR	41	47
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819473764	FH	On-Demand	Anodyne	CTSK	16	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819473764	FH	On-Demand	Anodyne	CYP2D6	16	45
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819473764	FH	On-Demand	Anodyne	ABCB1	22	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819473764	FH	On-Demand	Anodyne	FPR1	42	35
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2)cc1	ZINC000819473764	FH	On-Demand	Anodyne	PDS	102	51
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cc3ccccc3o2)cc1	ZINC000819473765	GJ	On-Demand	Anodyne	PDS	41	31
CN(C)CCc1ccccc1NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819473768	FH	On-Demand	Anodyne	CCR2	15	40
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819473789	GI	On-Demand	Anodyne	PAPA1_CARPA	28	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2ccc(F)cc2F)cc1	ZINC000819473789	GI	On-Demand	Anodyne	LEF	54	34
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819473792	GI	On-Demand	Anodyne	PAPA1_CARPA	28	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2ccc(F)cc2F)cc1	ZINC000819473792	GI	On-Demand	Anodyne	LEF	54	34
C#CCOc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819473797	EF	On-Demand	Mild	ADRB2	36	40
C#CCOc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819473797	EF	On-Demand	Mild	ADRB1	61	35
C#CCOc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819473797	EF	On-Demand	Mild	ADRB3	27	40
C#CCOc1ccccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819473797	EF	On-Demand	Mild	CASR	41	37
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819473799	EF	On-Demand	Mild	ADRB2	36	40
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819473799	EF	On-Demand	Mild	ADRB1	61	35
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819473799	EF	On-Demand	Mild	ADRB3	27	40
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819473799	EF	On-Demand	Mild	CASR	41	37
CN(C)CCc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819473845	CE	On-Demand	Anodyne	ADRB3	67	43
CN(C)CCc1ccccc1NC[C@H](O)c1cccnc1	ZINC000819473845	CE	On-Demand	Anodyne	CYP51A1	16	40
CN(C)CCc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819473846	CE	On-Demand	Anodyne	ADRB3	67	43
CN(C)CCc1ccccc1NC[C@@H](O)c1cccnc1	ZINC000819473846	CE	On-Demand	Anodyne	CYP51A1	16	40
Cc1ccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)c(C)c1	ZINC000819473847	EF	On-Demand	Anodyne	ADRB2	16	42
Cc1ccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)c(C)c1	ZINC000819473847	EF	On-Demand	Anodyne	ADRB1	16	41
Cc1ccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)c(C)c1	ZINC000819473848	EF	On-Demand	Anodyne	ADRB2	16	42
Cc1ccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)c(C)c1	ZINC000819473848	EF	On-Demand	Anodyne	ADRB1	16	41
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819473862	FF	On-Demand	Anodyne	ADRB2	34	40
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819473862	FF	On-Demand	Anodyne	ADRB1	53	40
CCOc1ccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819473863	FF	On-Demand	Anodyne	ADRB2	34	40
CCOc1ccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819473863	FF	On-Demand	Anodyne	ADRB1	53	40
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccccc1	ZINC000819473879	DE	On-Demand	Anodyne	ADRB2	51	46
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccccc1	ZINC000819473879	DE	On-Demand	Anodyne	ADRB1	75	44
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccccc1	ZINC000819473879	DE	On-Demand	Anodyne	ADRB3	49	44
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccccc1	ZINC000819473880	DE	On-Demand	Anodyne	ADRB2	51	46
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccccc1	ZINC000819473880	DE	On-Demand	Anodyne	ADRB1	75	44
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccccc1	ZINC000819473880	DE	On-Demand	Anodyne	ADRB3	49	44
N#CC1(NC(=O)/C=C/[C@@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819473915	EE	On-Demand	Mild	SIGMAR1	50	40
N#CC1(NC(=O)/C=C\[C@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819473916	EE	On-Demand	Mild	SIGMAR1	50	40
N#CC1(NC(=O)/C=C/[C@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819473917	EE	On-Demand	Mild	SIGMAR1	50	40
N#CC1(NC(=O)/C=C\[C@@H]2CCCO2)CCN(Cc2ccccc2)CC1	ZINC000819473918	EE	On-Demand	Mild	SIGMAR1	50	40
O=C(CCNc1ccc(OC2COC2)cc1)Nc1ccccc1	ZINC000819473986	DF	On-Demand	Anodyne	LTA4H	41	43
O=C(CCNc1ccc(OC2COC2)cc1)Nc1ccccc1	ZINC000819473986	DF	On-Demand	Anodyne	HDAC10	18	43
O=C(CCNc1ccc(OC2COC2)cc1)Nc1ccccc1	ZINC000819473986	DF	On-Demand	Anodyne	HDAC11	15	43
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(OC2COC2)cc1	ZINC000819474003	FE	On-Demand	Bother	ADRB1	45	33
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(OC2COC2)cc1	ZINC000819474005	FE	On-Demand	Bother	ADRB1	45	33
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819474007	GI	On-Demand	Anodyne	PAPA1_CARPA	28	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819474007	GI	On-Demand	Anodyne	LEF	64	36
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cc(F)ccc2F)cc1	ZINC000819474007	GI	On-Demand	Anodyne	PDS	45	36
O[C@@H](CNc1ccc(OC2COC2)cc1)CN1CCc2ccccc2C1	ZINC000819474008	FE	On-Demand	Anodyne	NOD2	42	36
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819474009	GI	On-Demand	Anodyne	PAPA1_CARPA	28	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819474009	GI	On-Demand	Anodyne	LEF	64	36
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cc(F)ccc2F)cc1	ZINC000819474009	GI	On-Demand	Anodyne	PDS	45	36
O[C@H](CNc1ccc(OC2COC2)cc1)CN1CCc2ccccc2C1	ZINC000819474010	FE	On-Demand	Anodyne	NOD2	42	36
O=C(CCNc1ccc(OC2COC2)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819474025	GH	On-Demand	Anodyne	KDR	16	40
O=C(CCNc1ccc(OC2COC2)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819474025	GH	On-Demand	Anodyne	EPHX2	23	42
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819474027	FE	On-Demand	Anodyne	ADRB2	37	57
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819474027	FE	On-Demand	Anodyne	ADRB1	70	57
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819474027	FE	On-Demand	Anodyne	ADRB3	42	49
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819474028	FE	On-Demand	Anodyne	ADRB2	37	57
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819474028	FE	On-Demand	Anodyne	ADRB1	70	57
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819474028	FE	On-Demand	Anodyne	ADRB3	42	49
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CC2CCCC2)cc1	ZINC000819474039	EI	On-Demand	Anodyne	CTSK	17	47
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CC2CCCC2)cc1	ZINC000819474039	EI	On-Demand	Anodyne	CACNA1B	28	50
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CC2CCCC2)cc1	ZINC000819474039	EI	On-Demand	Anodyne	REN	63	44
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CC2CCCC2)cc1	ZINC000819474039	EI	On-Demand	Anodyne	CTSS	26	42
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)CC2CCCC2)cc1	ZINC000819474039	EI	On-Demand	Anodyne	PROC	41	34
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CC2CCCC2)cc1	ZINC000819474041	EI	On-Demand	Anodyne	CTSK	17	47
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CC2CCCC2)cc1	ZINC000819474041	EI	On-Demand	Anodyne	CACNA1B	28	50
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CC2CCCC2)cc1	ZINC000819474041	EI	On-Demand	Anodyne	REN	63	44
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CC2CCCC2)cc1	ZINC000819474041	EI	On-Demand	Anodyne	CTSS	26	42
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)CC2CCCC2)cc1	ZINC000819474041	EI	On-Demand	Anodyne	PROC	41	34
N#CCc1ccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819474044	FE	On-Demand	Mild	ADRB1	52	38
N#CCc1ccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819474047	FE	On-Demand	Mild	ADRB1	52	38
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccccc1Cl	ZINC000819474057	EF	On-Demand	Anodyne	ADRB2	24	41
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccccc1Cl	ZINC000819474057	EF	On-Demand	Anodyne	ADRB1	42	38
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccccc1Cl	ZINC000819474057	EF	On-Demand	Anodyne	ADRB3	15	41
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccccc1Cl	ZINC000819474058	EF	On-Demand	Anodyne	ADRB2	24	41
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccccc1Cl	ZINC000819474058	EF	On-Demand	Anodyne	ADRB1	42	38
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccccc1Cl	ZINC000819474058	EF	On-Demand	Anodyne	ADRB3	15	41
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1cccc(C(F)(F)F)c1	ZINC000819474063	GG	On-Demand	Anodyne	ADRB1	23	42
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1cccc(C(F)(F)F)c1	ZINC000819474063	GG	On-Demand	Anodyne	PDS	46	41
CC(C)(C)OC(=O)NCc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1	ZINC000819474064	GI	On-Demand	Anodyne	PAPA1_CARPA	20	41
O[C@H](CNc1ccc(OC2COC2)cc1)COc1cccc(C(F)(F)F)c1	ZINC000819474065	GG	On-Demand	Anodyne	ADRB1	23	42
O[C@H](CNc1ccc(OC2COC2)cc1)COc1cccc(C(F)(F)F)c1	ZINC000819474065	GG	On-Demand	Anodyne	PDS	46	41
COCCNC(=O)c1ccccc1NC(=O)CSC(=S)N1CCC(C)CC1	ZINC000819474080	HF	On-Demand	Anodyne	CCR8	47	32
O[C@@H](CNc1ccc(OC2COC2)cc1)c1ccc(OC(F)(F)F)cc1	ZINC000819474100	FH	On-Demand	Anodyne	CTSS	18	42
O[C@H](CNc1ccc(OC2COC2)cc1)c1ccc(OC(F)(F)F)cc1	ZINC000819474101	FH	On-Demand	Anodyne	CTSS	18	42
C#CCOc1ccccc1NC[C@H](O)CO[C@@H](C)COC	ZINC000819474120	CD	On-Demand	Mild	ADRB2	23	41
C#CCOc1ccccc1NC[C@H](O)CO[C@H](C)COC	ZINC000819474121	CD	On-Demand	Mild	ADRB2	23	41
C#CCOc1ccccc1NC[C@@H](O)CO[C@@H](C)COC	ZINC000819474122	CD	On-Demand	Mild	ADRB2	23	41
C#CCOc1ccccc1NC[C@@H](O)CO[C@H](C)COC	ZINC000819474123	CD	On-Demand	Mild	ADRB2	23	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819474124	EG	On-Demand	Anodyne	ADRB2	36	46
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819474124	EG	On-Demand	Anodyne	ADRB1	36	47
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819474124	EG	On-Demand	Anodyne	ADRB3	114	50
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819474124	EG	On-Demand	Anodyne	KCNA5	20	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819474124	EG	On-Demand	Anodyne	NAMPT	45	44
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819474125	EG	On-Demand	Anodyne	ADRB2	36	46
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819474125	EG	On-Demand	Anodyne	ADRB1	36	47
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819474125	EG	On-Demand	Anodyne	ADRB3	114	50
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819474125	EG	On-Demand	Anodyne	KCNA5	20	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819474125	EG	On-Demand	Anodyne	NAMPT	45	44
CC(C)(C)OC(=O)NCc1ccc(NCCS(=O)(=O)c2ccccc2)cc1	ZINC000819474134	GH	On-Demand	Anodyne	CA2	15	47
CC(C)(C)OC(=O)NCc1ccc(NCCS(=O)(=O)c2ccccc2)cc1	ZINC000819474134	GH	On-Demand	Anodyne	CA1	17	47
CC(C)(C)OC(=O)NCc1ccc(NCCS(=O)(=O)c2ccccc2)cc1	ZINC000819474134	GH	On-Demand	Anodyne	PTPRB	56	44
CC(C)(C)OC(=O)NCc1ccc(NCCS(=O)(=O)c2ccccc2)cc1	ZINC000819474134	GH	On-Demand	Anodyne	CYNT	24	44
CC(C)(C)OC(=O)NCc1ccc(NCCS(=O)(=O)c2ccccc2)cc1	ZINC000819474134	GH	On-Demand	Anodyne	NAMPT	52	39
CC(C)(C)OC(=O)NCc1ccc(NCCS(=O)(=O)c2ccccc2)cc1	ZINC000819474134	GH	On-Demand	Anodyne	PDS	57	34
C#CCOc1ccccc1NC[C@@H](O)COCCOC	ZINC000819474139	CD	On-Demand	Mild	ADRB2	20	43
C#CCOc1ccccc1NC[C@H](O)COCCOC	ZINC000819474140	CD	On-Demand	Mild	ADRB2	20	43
C[C@@H]1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@@H]1F	ZINC000819474148	EF	On-Demand	Mild	PAPA1_CARPA	32	41
C[C@@H]1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@H]1F	ZINC000819474150	EF	On-Demand	Mild	PAPA1_CARPA	32	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCc1c[nH]c3cccc(OC)c13)C2	ZINC000819474174	GF	On-Demand	Anodyne	MTNR1A	19	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCc1c[nH]c3cccc(OC)c13)C2	ZINC000819474176	GF	On-Demand	Anodyne	MTNR1A	19	40
CC(C)[C@H]1CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCO1	ZINC000819474187	FE	On-Demand	Mild	PAPA1_CARPA	33	40
CC(C)[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCO1	ZINC000819474188	FE	On-Demand	Mild	PAPA1_CARPA	33	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CCc1ccccc1)C(F)(F)F)C2	ZINC000819474196	GH	On-Demand	Anodyne	ACE	47	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CCc1ccccc1)C(F)(F)F)C2	ZINC000819474196	GH	On-Demand	Anodyne	XIAP	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](CCc1ccccc1)C(F)(F)F)C2	ZINC000819474196	GH	On-Demand	Anodyne	BIRC2	25	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CCc1ccccc1)C(F)(F)F)C2	ZINC000819474199	GH	On-Demand	Anodyne	ACE	47	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CCc1ccccc1)C(F)(F)F)C2	ZINC000819474199	GH	On-Demand	Anodyne	XIAP	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](CCc1ccccc1)C(F)(F)F)C2	ZINC000819474199	GH	On-Demand	Anodyne	BIRC2	25	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CCc1ccccc1)C(F)(F)F)C2	ZINC000819474201	GH	On-Demand	Anodyne	ACE	47	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CCc1ccccc1)C(F)(F)F)C2	ZINC000819474201	GH	On-Demand	Anodyne	XIAP	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](CCc1ccccc1)C(F)(F)F)C2	ZINC000819474201	GH	On-Demand	Anodyne	BIRC2	25	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CCc1ccccc1)C(F)(F)F)C2	ZINC000819474203	GH	On-Demand	Anodyne	ACE	47	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CCc1ccccc1)C(F)(F)F)C2	ZINC000819474203	GH	On-Demand	Anodyne	XIAP	15	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](CCc1ccccc1)C(F)(F)F)C2	ZINC000819474203	GH	On-Demand	Anodyne	BIRC2	25	41
C[C@@H]1CCCC[C@@H]1C(=O)NNc1cc(Cl)ccn1	ZINC000819474208	CG	On-Demand	Reactive	TYK2	57	38
C[C@@H]1CCCC[C@H]1C(=O)NNc1cc(Cl)ccn1	ZINC000819474209	CG	On-Demand	Reactive	TYK2	57	38
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccc(Br)cc1	ZINC000819474212	GG	On-Demand	Anodyne	ADRB2	22	40
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccc(Br)cc1	ZINC000819474212	GG	On-Demand	Anodyne	ADRB1	43	43
O[C@@H](CNc1ccc(OC2COC2)cc1)COc1ccc(Br)cc1	ZINC000819474212	GG	On-Demand	Anodyne	ADRB3	21	40
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccc(Br)cc1	ZINC000819474214	GG	On-Demand	Anodyne	ADRB2	22	40
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccc(Br)cc1	ZINC000819474214	GG	On-Demand	Anodyne	ADRB1	43	43
O[C@H](CNc1ccc(OC2COC2)cc1)COc1ccc(Br)cc1	ZINC000819474214	GG	On-Demand	Anodyne	ADRB3	21	40
O[C@@H](CNc1ccc(OC2COC2)cc1)c1cccc(Cl)c1	ZINC000819474217	DG	On-Demand	Anodyne	ADRB1	29	45
O[C@@H](CNc1ccc(OC2COC2)cc1)c1cccc(Cl)c1	ZINC000819474217	DG	On-Demand	Anodyne	ADRB3	44	43
O[C@@H](CNc1ccc(OC2COC2)cc1)c1cccc(Cl)c1	ZINC000819474217	DG	On-Demand	Anodyne	CYP3A4	47	35
O[C@H](CNc1ccc(OC2COC2)cc1)c1cccc(Cl)c1	ZINC000819474219	DG	On-Demand	Anodyne	ADRB1	29	45
O[C@H](CNc1ccc(OC2COC2)cc1)c1cccc(Cl)c1	ZINC000819474219	DG	On-Demand	Anodyne	ADRB3	44	43
O[C@H](CNc1ccc(OC2COC2)cc1)c1cccc(Cl)c1	ZINC000819474219	DG	On-Demand	Anodyne	CYP3A4	47	35
O=C(CCNc1ccc(OC2COC2)cc1)Nc1ccc(Cl)cc1	ZINC000819474221	EH	On-Demand	Anodyne	EPHX2	17	46
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819474228	GG	On-Demand	Mild	ADRB2	45	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819474228	GG	On-Demand	Mild	ADRB1	81	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819474228	GG	On-Demand	Mild	ADRB3	47	42
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819474228	GG	On-Demand	Mild	CASR	41	37
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819474228	GG	On-Demand	Mild	PDS	54	42
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819474230	GG	On-Demand	Mild	ADRB2	45	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819474230	GG	On-Demand	Mild	ADRB1	81	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819474230	GG	On-Demand	Mild	ADRB3	47	42
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819474230	GG	On-Demand	Mild	CASR	41	37
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000819474230	GG	On-Demand	Mild	PDS	54	42
CN(C)CCc1ccccc1NC[C@H](O)c1ccccc1Cl	ZINC000819474235	DH	On-Demand	Anodyne	CXCL8	36	41
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819474236	GD	On-Demand	Mild	PAPA1_CARPA	31	41
COC(=O)[C@@H]1C[C@H](OC)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819474239	GD	On-Demand	Mild	PAPA1_CARPA	31	41
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819474240	GD	On-Demand	Mild	PAPA1_CARPA	31	41
COC(=O)[C@@H]1C[C@@H](OC)CCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819474242	GD	On-Demand	Mild	PAPA1_CARPA	31	41
C#CCOc1ccccc1NC[C@H](O)COc1c(OC)cccc1OC	ZINC000819474248	FF	On-Demand	Mild	ADRB2	28	43
C#CCOc1ccccc1NC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819474250	FF	On-Demand	Mild	ADRB2	28	43
C=CCC1(C(=O)Nc2cccc(CCOC(C)=O)c2)CCOCC1	ZINC000819474268	EG	On-Demand	Mild	LIMK2	16	43
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819474270	FE	On-Demand	Anodyne	ADRB2	38	44
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819474270	FE	On-Demand	Anodyne	ADRB1	65	44
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819474270	FE	On-Demand	Anodyne	ADRB3	42	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819474271	FE	On-Demand	Anodyne	ADRB2	38	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819474271	FE	On-Demand	Anodyne	ADRB1	65	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC3COC3)cc2)cc1	ZINC000819474271	FE	On-Demand	Anodyne	ADRB3	42	44
COc1cccc([S@@](=O)CC(=O)Nc2cccc(CCOC(C)=O)c2)c1	ZINC000819474287	GF	On-Demand	Anodyne	MTNR1A	38	42
COc1cccc([S@@](=O)CC(=O)Nc2cccc(CCOC(C)=O)c2)c1	ZINC000819474287	GF	On-Demand	Anodyne	MTNR1B	41	43
O=C(C(F)=C1CCC1)N1CCC(N2CCS(=O)(=O)CC2)CC1	ZINC000819474288	ED	On-Demand	Anodyne	L3MBTL3	76	40
CN(C)CCc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819474314	DH	On-Demand	Anodyne	ADRB1	28	42
CN(C)CCc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819474314	DH	On-Demand	Anodyne	ADRB3	39	44
CN(C)CCc1ccccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819474314	DH	On-Demand	Anodyne	CYP3A4	47	37
CN(C)CCc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819474315	DH	On-Demand	Anodyne	ADRB1	28	42
CN(C)CCc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819474315	DH	On-Demand	Anodyne	ADRB3	39	44
CN(C)CCc1ccccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819474315	DH	On-Demand	Anodyne	CYP3A4	47	37
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819474336	GJ	On-Demand	Anodyne	ADRB2	51	45
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819474336	GJ	On-Demand	Anodyne	ADRB1	52	56
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819474336	GJ	On-Demand	Anodyne	ADRB3	77	51
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819474336	GJ	On-Demand	Anodyne	PDS	73	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819474337	GJ	On-Demand	Anodyne	ADRB2	51	45
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819474337	GJ	On-Demand	Anodyne	ADRB1	52	56
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819474337	GJ	On-Demand	Anodyne	ADRB3	77	51
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819474337	GJ	On-Demand	Anodyne	PDS	73	41
CC(=O)Nc1cccc(CC(=O)N[C@H](C)CCNC(=O)OC(C)(C)C)c1	ZINC000819474363	FF	On-Demand	Anodyne	FPR1	48	35
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)CCNC(=O)OC(C)(C)C)c1	ZINC000819474364	FF	On-Demand	Anodyne	FPR1	48	35
COc1cccc([S@@](=O)CC(=O)NCCc2c[nH]c3cccc(OC)c23)c1	ZINC000819474393	GF	On-Demand	Anodyne	NQO2	30	44
COc1cccc([S@@](=O)CC(=O)NCCc2c[nH]c3cccc(OC)c23)c1	ZINC000819474393	GF	On-Demand	Anodyne	MTNR1A	78	48
COc1cccc([S@@](=O)CC(=O)NCCc2c[nH]c3cccc(OC)c23)c1	ZINC000819474393	GF	On-Demand	Anodyne	MTNR1B	65	44
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)Cc2ccc(F)cc2)cc1	ZINC000819474394	FH	On-Demand	Anodyne	PAPA1_CARPA	30	49
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)Cc2ccc(F)cc2)cc1	ZINC000819474395	FH	On-Demand	Anodyne	PAPA1_CARPA	30	49
C=CCCn1cc(C(=O)NCCc2c[nH]c3cccc(OC)c23)nn1	ZINC000819474396	EE	On-Demand	Mild	NQO2	17	40
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819474407	FE	On-Demand	Anodyne	CTSK	17	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819474408	FE	On-Demand	Anodyne	CTSK	17	40
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2F)cc1	ZINC000819474417	GH	On-Demand	Anodyne	ADRB2	45	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2F)cc1	ZINC000819474417	GH	On-Demand	Anodyne	ADRB1	72	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2F)cc1	ZINC000819474417	GH	On-Demand	Anodyne	ADRB3	42	39
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2F)cc1	ZINC000819474417	GH	On-Demand	Anodyne	CASR	40	37
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)COc2ccccc2F)cc1	ZINC000819474417	GH	On-Demand	Anodyne	PDS	66	39
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2F)cc1	ZINC000819474418	GH	On-Demand	Anodyne	ADRB2	45	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2F)cc1	ZINC000819474418	GH	On-Demand	Anodyne	ADRB1	72	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2F)cc1	ZINC000819474418	GH	On-Demand	Anodyne	ADRB3	42	39
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2F)cc1	ZINC000819474418	GH	On-Demand	Anodyne	CASR	40	37
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)COc2ccccc2F)cc1	ZINC000819474418	GH	On-Demand	Anodyne	PDS	66	39
C#CCOc1ccccc1NC[C@H](O)COc1cccc(C)c1	ZINC000819474424	DF	On-Demand	Mild	ADRB2	35	57
C#CCOc1ccccc1NC[C@H](O)COc1cccc(C)c1	ZINC000819474424	DF	On-Demand	Mild	ADRB1	37	57
C#CCOc1ccccc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819474425	DF	On-Demand	Mild	ADRB2	35	57
C#CCOc1ccccc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819474425	DF	On-Demand	Mild	ADRB1	37	57
C#CCOc1ccccc1NC[C@H](O)COc1ccc(SC)cc1	ZINC000819474426	EG	On-Demand	Mild	ADRB2	33	42
C#CCOc1ccccc1NC[C@H](O)COc1ccc(SC)cc1	ZINC000819474426	EG	On-Demand	Mild	ADRB1	43	33
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819474427	EG	On-Demand	Mild	ADRB2	33	42
C#CCOc1ccccc1NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819474427	EG	On-Demand	Mild	ADRB1	43	33
COCCNC(=O)c1ccccc1NC(=O)Cc1cc(OC)ccc1OC	ZINC000819474462	FE	On-Demand	Anodyne	TSHR	49	33
COCCNC(=O)c1ccccc1NC(=O)Cc1cc(OC)ccc1OC	ZINC000819474462	FE	On-Demand	Anodyne	CSNK1D	16	41
COCCNC(=O)c1ccccc1NC(=O)Cc1cc(OC)ccc1OC	ZINC000819474462	FE	On-Demand	Anodyne	MTNR1A	69	42
COCCNC(=O)c1ccccc1NC(=O)Cc1cc(OC)ccc1OC	ZINC000819474462	FE	On-Demand	Anodyne	MTNR1B	62	45
COCCNC(=O)c1ccccc1NC(=O)Cc1cc(OC)ccc1OC	ZINC000819474462	FE	On-Demand	Anodyne	PRTN3	46	39
COCCNC(=O)c1ccccc1NC(=O)Cc1cc(OC)ccc1OC	ZINC000819474462	FE	On-Demand	Anodyne	SLC6A5	19	40
COCCNC(=O)c1ccccc1NC(=O)Cc1cc(OC)ccc1OC	ZINC000819474462	FE	On-Demand	Anodyne	MAPK8	15	49
COCCNC(=O)c1ccccc1NC(=O)Cc1cc(OC)ccc1OC	ZINC000819474462	FE	On-Demand	Anodyne	KCNK3	38	40
COCCNC(=O)c1ccccc1NC(=O)Cc1cc(OC)ccc1OC	ZINC000819474462	FE	On-Demand	Anodyne	POLR1A	40	35
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819474463	FH	On-Demand	Anodyne	ADRB2	40	39
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819474463	FH	On-Demand	Anodyne	ADRB1	26	42
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819474463	FH	On-Demand	Anodyne	ADRB3	41	42
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819474463	FH	On-Demand	Anodyne	PAPA1_CARPA	27	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819474463	FH	On-Demand	Anodyne	PDS	55	41
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819474464	FH	On-Demand	Anodyne	ADRB2	40	39
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819474464	FH	On-Demand	Anodyne	ADRB1	26	42
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819474464	FH	On-Demand	Anodyne	ADRB3	41	42
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819474464	FH	On-Demand	Anodyne	PAPA1_CARPA	27	43
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819474464	FH	On-Demand	Anodyne	PDS	55	41
O=C(/C=C/[C@@H]1CCCO1)NCc1ccccc1N1CCCCC1	ZINC000819474475	DG	On-Demand	Anodyne	KCNQ2	63	38
O=C(/C=C/[C@@H]1CCCO1)NCc1ccccc1N1CCCCC1	ZINC000819474475	DG	On-Demand	Anodyne	SCN2A	18	43
O=C(/C=C/[C@@H]1CCCO1)NCc1ccccc1N1CCCCC1	ZINC000819474475	DG	On-Demand	Anodyne	SCN10A	15	43
O=C(/C=C\[C@@H]1CCCO1)NCc1ccccc1N1CCCCC1	ZINC000819474476	DG	On-Demand	Anodyne	KCNQ2	63	38
O=C(/C=C\[C@@H]1CCCO1)NCc1ccccc1N1CCCCC1	ZINC000819474476	DG	On-Demand	Anodyne	SCN2A	18	43
O=C(/C=C\[C@@H]1CCCO1)NCc1ccccc1N1CCCCC1	ZINC000819474476	DG	On-Demand	Anodyne	SCN10A	15	43
O=C(/C=C\[C@H]1CCCO1)NCc1ccccc1N1CCCCC1	ZINC000819474477	DG	On-Demand	Anodyne	KCNQ2	63	38
O=C(/C=C\[C@H]1CCCO1)NCc1ccccc1N1CCCCC1	ZINC000819474477	DG	On-Demand	Anodyne	SCN2A	18	43
O=C(/C=C\[C@H]1CCCO1)NCc1ccccc1N1CCCCC1	ZINC000819474477	DG	On-Demand	Anodyne	SCN10A	15	43
O=C(/C=C/[C@H]1CCCO1)NCc1ccccc1N1CCCCC1	ZINC000819474478	DG	On-Demand	Anodyne	KCNQ2	63	38
O=C(/C=C/[C@H]1CCCO1)NCc1ccccc1N1CCCCC1	ZINC000819474478	DG	On-Demand	Anodyne	SCN2A	18	43
O=C(/C=C/[C@H]1CCCO1)NCc1ccccc1N1CCCCC1	ZINC000819474478	DG	On-Demand	Anodyne	SCN10A	15	43
C#CCOc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819474495	GE	On-Demand	Mild	HTR1A	39	41
C#CCOc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819474495	GE	On-Demand	Mild	DRD2	27	41
C#CCOc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819474495	GE	On-Demand	Mild	ADRA1D	21	43
C#CCOc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819474495	GE	On-Demand	Mild	HTR2A	21	44
C#CCOc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819474495	GE	On-Demand	Mild	ADRA1A	19	43
C#CCOc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819474495	GE	On-Demand	Mild	DRD3	37	41
C#CCOc1ccccc1NC[C@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819474495	GE	On-Demand	Mild	ABCB1	70	43
C#CCOc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819474496	GE	On-Demand	Mild	HTR1A	39	41
C#CCOc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819474496	GE	On-Demand	Mild	DRD2	27	41
C#CCOc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819474496	GE	On-Demand	Mild	ADRA1D	21	43
C#CCOc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819474496	GE	On-Demand	Mild	HTR2A	21	44
C#CCOc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819474496	GE	On-Demand	Mild	ADRA1A	19	43
C#CCOc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819474496	GE	On-Demand	Mild	DRD3	37	41
C#CCOc1ccccc1NC[C@@H](O)CN1CCN(c2ccc(OC)cc2)CC1	ZINC000819474496	GE	On-Demand	Mild	ABCB1	70	43
C#CCOc1ccccc1NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819474511	FE	On-Demand	Mild	ADRB1	18	42
C#CCOc1ccccc1NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819474512	FE	On-Demand	Mild	ADRB1	18	42
CC(C)(C)OC(=O)NCc1ccc(NC[C@H](O)c2c(F)cccc2F)cc1	ZINC000819474519	GI	On-Demand	Anodyne	PDS	53	35
CC(C)(C)OC(=O)NCc1ccc(NC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000819474520	GI	On-Demand	Anodyne	PDS	53	35
COCCNC(=O)c1ccccc1NC(=O)c1ccc2c(c1)CCN2S(C)(=O)=O	ZINC000819474523	HD	On-Demand	Anodyne	DRD4	43	34
COCCNC(=O)c1ccccc1NC(=O)c1ccc2c(c1)CCN2S(C)(=O)=O	ZINC000819474523	HD	On-Demand	Anodyne	ABCG2	26	41
CC(C)(C)OC(=O)NCc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819474549	FI	On-Demand	Anodyne	LTA4H	39	45
CC(C)(C)OC(=O)NCc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819474549	FI	On-Demand	Anodyne	CCKAR	15	40
CC(C)(C)OC(=O)NCc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819474549	FI	On-Demand	Anodyne	HDAC8	15	44
CC(C)(C)OC(=O)NCc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819474549	FI	On-Demand	Anodyne	HDAC1	17	40
CC(C)(C)OC(=O)NCc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819474549	FI	On-Demand	Anodyne	TPSAB1	19	43
CC(C)(C)OC(=O)NCc1ccc(NCCC(=O)Nc2ccccc2)cc1	ZINC000819474549	FI	On-Demand	Anodyne	PDS	61	35
CON(C)C(=O)CCNc1ccc(-n2cccn2)cc1C	ZINC000819474577	CE	On-Demand	Anodyne	AMP1_PLAFQ	50	36
Cc1cc(-n2cccn2)ccc1NC[C@H](O)C1CC1	ZINC000819474599	CE	On-Demand	Anodyne	AMP1_PLAFQ	42	34
Cc1cc(-n2cccn2)ccc1NC[C@@H](O)C1CC1	ZINC000819474600	CE	On-Demand	Anodyne	AMP1_PLAFQ	42	34
CC(=O)Nc1cccc(CC(=O)Nc2cc(F)c(N3CCCCC3)c(F)c2)c1	ZINC000819474608	GI	On-Demand	Anodyne	KCNQ2	48	47
CC(=O)Nc1cccc(CC(=O)Nc2cc(F)c(N3CCCCC3)c(F)c2)c1	ZINC000819474608	GI	On-Demand	Anodyne	TAAR1	26	42
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(C(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819474616	GF	On-Demand	Anodyne	GPR119	17	47
O=C(Cc1ccc(-n2cnnc2)cc1)N1CC(n2ccnn2)C1	ZINC000819474639	DC	On-Demand	Anodyne	KCNJ1	45	37
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2=CCOCC2)C1	ZINC000819474669	EG	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2=CCOCC2)C1	ZINC000819474670	EG	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2(c3ccc(C)cc3)CCOCC2)C1	ZINC000819474671	IJ	On-Demand	Anodyne	FPR2	24	44
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2(c3ccc(C)cc3)CCOCC2)C1	ZINC000819474672	IJ	On-Demand	Anodyne	FPR2	24	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)COc2ccccc2C=O)C1	ZINC000819474674	GH	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)COc2ccccc2C=O)C1	ZINC000819474675	GH	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc3sc(N(C)C)nc3s2)C1	ZINC000819474678	IJ	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc3sc(N(C)C)nc3s2)C1	ZINC000819474702	IJ	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C[C@](C)(O)c2ccccc2)C1	ZINC000819474707	GI	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C[C@](C)(O)c2ccccc2)C1	ZINC000819474710	GI	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C[C@@](C)(O)c2ccccc2)C1	ZINC000819474712	GI	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C[C@@](C)(O)c2ccccc2)C1	ZINC000819474714	GI	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C[C@H](C)c2ccc(OC)cc2)C1	ZINC000819474716	HJ	On-Demand	Anodyne	FPR2	29	55
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C[C@H](C)c2ccc(OC)cc2)C1	ZINC000819474731	HJ	On-Demand	Anodyne	FPR2	29	55
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C[C@@H](C)c2ccc(OC)cc2)C1	ZINC000819474733	HJ	On-Demand	Anodyne	FPR2	29	55
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C[C@@H](C)c2ccc(OC)cc2)C1	ZINC000819474734	HJ	On-Demand	Anodyne	FPR2	29	55
NS(=O)(=O)c1cc(C(=O)Nc2cn3cc(Br)ncc3n2)co1	ZINC000819474735	GC	On-Demand	Anodyne	MAP3K5	56	38
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cn(Cc3ccccn3)nn2)C1	ZINC000819474739	HG	On-Demand	Anodyne	FPR2	26	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cn(Cc3ccccn3)nn2)C1	ZINC000819474740	HG	On-Demand	Anodyne	FPR2	26	46
CC(C)n1cnc(C(=O)Nc2cn3cc(Br)ncc3n2)c1	ZINC000819474744	EF	On-Demand	Anodyne	MAP3K5	57	38
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(S(N)(=O)=O)cc2)C1	ZINC000819474745	HF	On-Demand	Anodyne	CA13	19	41
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(S(N)(=O)=O)cc2)C1	ZINC000819474745	HF	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(S(N)(=O)=O)cc2)C1	ZINC000819474747	HF	On-Demand	Anodyne	CA13	19	41
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(S(N)(=O)=O)cc2)C1	ZINC000819474747	HF	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(C(=O)NCC(C)(C)C)cc2)C1	ZINC000819474748	IJ	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(C(=O)NCC(C)(C)C)cc2)C1	ZINC000819474750	IJ	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ncccc2Oc2ccccc2)C1	ZINC000819474751	IK	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ncccc2Oc2ccccc2)C1	ZINC000819474754	IK	On-Demand	Anodyne	FPR2	27	50
CC(=O)Nc1cccc(CC(=O)N2CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1	ZINC000819474757	GF	On-Demand	Anodyne	CMA1	35	41
CC(=O)Nc1cccc(CC(=O)N2CC[C@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1	ZINC000819474757	GF	On-Demand	Anodyne	FPR1	44	35
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2c(OC)cnc3ccccc23)C1	ZINC000819474758	HJ	On-Demand	Anodyne	FPR2	28	53
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1	ZINC000819474759	GF	On-Demand	Anodyne	CMA1	35	41
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)C2)c1	ZINC000819474759	GF	On-Demand	Anodyne	FPR1	44	35
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2c(OC)cnc3ccccc23)C1	ZINC000819474760	HJ	On-Demand	Anodyne	FPR2	28	53
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1	ZINC000819474761	GF	On-Demand	Anodyne	CMA1	35	41
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1	ZINC000819474761	GF	On-Demand	Anodyne	FPR1	44	35
CNC(=O)COc1cccc(CC(=O)Nc2cn3cc(Br)ncc3n2)c1	ZINC000819474762	HD	On-Demand	Anodyne	UPP1	48	32
CC(=O)Nc1cccc(CC(=O)N2CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1	ZINC000819474763	GF	On-Demand	Anodyne	CMA1	35	41
CC(=O)Nc1cccc(CC(=O)N2CC[C@H]([C@H](C)NC(=O)OC(C)(C)C)C2)c1	ZINC000819474763	GF	On-Demand	Anodyne	FPR1	44	35
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2=NN(CCO)C(=O)CC2)C1	ZINC000819474764	GD	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2=NN(CCO)C(=O)CC2)C1	ZINC000819474765	GD	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C1	ZINC000819474771	HF	On-Demand	Bother	FPR2	23	43
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)C1	ZINC000819474773	HF	On-Demand	Bother	FPR2	23	43
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@]2(C)C[C@H]3CC[C@H]2O3)C1	ZINC000819474774	FH	On-Demand	Anodyne	FPR2	25	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@]2(C)C[C@H]3CC[C@H]2O3)C1	ZINC000819474775	FH	On-Demand	Anodyne	FPR2	25	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@]2(C)C[C@H]3CC[C@H]2O3)C1	ZINC000819474777	FH	On-Demand	Anodyne	FPR2	25	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@]2(C)C[C@H]3CC[C@H]2O3)C1	ZINC000819474778	FH	On-Demand	Anodyne	FPR2	25	47
Cc1scc(C(=O)Nc2cn3cc(Br)ncc3n2)c1C	ZINC000819474779	FG	On-Demand	Anodyne	MAP3K5	53	38
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H](O)CCSC)C1	ZINC000819474781	FF	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H](O)CCSC)C1	ZINC000819474782	FF	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H](O)CCSC)C1	ZINC000819474783	FF	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H](O)CCSC)C1	ZINC000819474785	FF	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2nc(C)n(-c3nc[nH]n3)n2)C1	ZINC000819474786	HE	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2nc(C)n(-c3nc[nH]n3)n2)C1	ZINC000819474789	HE	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cc2nc(C(C)C)c(C)s2)C1	ZINC000819474790	HJ	On-Demand	Anodyne	FPR2	25	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cc2nc(C(C)C)c(C)s2)C1	ZINC000819474792	HJ	On-Demand	Anodyne	FPR2	25	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCOc2cc(C)ccc2[N+](=O)[O-])C1	ZINC000819474795	II	On-Demand	Bother	FPR2	24	43
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCOc2cc(C)ccc2[N+](=O)[O-])C1	ZINC000819474797	II	On-Demand	Bother	FPR2	24	43
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)COc2ccc(C(N)=O)cc2)C1	ZINC000819474798	HF	On-Demand	Anodyne	CPT1A	92	44
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)COc2ccc(C(N)=O)cc2)C1	ZINC000819474798	HF	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)COc2ccc(C(N)=O)cc2)C1	ZINC000819474800	HF	On-Demand	Anodyne	CPT1A	92	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)COc2ccc(C(N)=O)cc2)C1	ZINC000819474800	HF	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cncc(-c3ccc(OC)cc3)c2)C1	ZINC000819474801	IK	On-Demand	Anodyne	FPR2	31	58
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cncc(-c3ccc(OC)cc3)c2)C1	ZINC000819474804	IK	On-Demand	Anodyne	FPR2	31	58
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CS(C)(=O)=O)C1	ZINC000819474808	ED	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CS(C)(=O)=O)C1	ZINC000819474809	ED	On-Demand	Anodyne	FPR2	27	51
C#CCNC(=O)CCNc1ccc(N2CCN(C)CC2)c(Br)c1	ZINC000819474810	GD	On-Demand	Mild	HTR1D	15	43
C#CCNC(=O)CCNc1ccc(N2CCN(C)CC2)c(Br)c1	ZINC000819474810	GD	On-Demand	Mild	HTR1B	23	40
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cn(-c3cccc(Cl)c3)nn2)C1	ZINC000819474819	II	On-Demand	Anodyne	FPR2	26	48
COCCNC(=O)c1ccccc1NC(=O)c1ccnc2ccccc12	ZINC000819474821	EF	On-Demand	Anodyne	KIT	17	43
COCCNC(=O)c1ccccc1NC(=O)c1ccnc2ccccc12	ZINC000819474821	EF	On-Demand	Anodyne	G2YM83_BOTF4	56	31
COCCNC(=O)c1ccccc1NC(=O)c1ccnc2ccccc12	ZINC000819474821	EF	On-Demand	Anodyne	POLR1A	59	38
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cn(-c3cccc(Cl)c3)nn2)C1	ZINC000819474822	II	On-Demand	Anodyne	FPR2	26	48
COc1ccc(-c2cncc(C(=O)Nc3cn4cc(Br)ncc4n3)c2)cc1	ZINC000819474823	HH	On-Demand	Anodyne	CYP11B2	16	45
COc1ccc(-c2cncc(C(=O)Nc3cn4cc(Br)ncc4n3)c2)cc1	ZINC000819474823	HH	On-Demand	Anodyne	SCN10A	69	46
COc1ccc(-c2cncc(C(=O)Nc3cn4cc(Br)ncc4n3)c2)cc1	ZINC000819474823	HH	On-Demand	Anodyne	MAP3K5	68	42
COc1ccc(-c2cncc(C(=O)Nc3cn4cc(Br)ncc4n3)c2)cc1	ZINC000819474823	HH	On-Demand	Anodyne	LUCI_LUCLA	38	44
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2scnc2COC)C1	ZINC000819474826	GH	On-Demand	Anodyne	FPR2	28	53
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2scnc2COC)C1	ZINC000819474828	GH	On-Demand	Anodyne	FPR2	28	53
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])C1	ZINC000819474829	HH	On-Demand	Bother	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CN(C)c2ccccc2[N+](=O)[O-])C1	ZINC000819474831	HH	On-Demand	Bother	FPR2	25	46
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc(O)cc1	ZINC000819474842	FG	On-Demand	Anodyne	MME	52	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc(O)cc1	ZINC000819474842	FG	On-Demand	Anodyne	CTSD	97	47
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc(O)cc1	ZINC000819474842	FG	On-Demand	Anodyne	PGC	60	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc(O)cc1	ZINC000819474842	FG	On-Demand	Anodyne	PAPA1_CARPA	61	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc(O)cc1	ZINC000819474842	FG	On-Demand	Anodyne	CTSK	39	55
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc(O)cc1	ZINC000819474842	FG	On-Demand	Anodyne	CTSL	33	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc(O)cc1	ZINC000819474842	FG	On-Demand	Anodyne	PGA	53	42
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc(O)cc1	ZINC000819474842	FG	On-Demand	Anodyne	BACE2	46	37
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc(O)cc1	ZINC000819474842	FG	On-Demand	Anodyne	TACR3	18	51
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc(O)cc1	ZINC000819474842	FG	On-Demand	Anodyne	CAPNS1	51	30
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc(O)cc1	ZINC000819474842	FG	On-Demand	Anodyne	REN	80	54
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc(O)cc1	ZINC000819474842	FG	On-Demand	Anodyne	REN1	24	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc(O)cc1	ZINC000819474842	FG	On-Demand	Anodyne	CAPN1	32	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc(O)cc1	ZINC000819474842	FG	On-Demand	Anodyne	BACE1	72	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc(O)cc1	ZINC000819474842	FG	On-Demand	Anodyne	FPR1	59	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1ccc(O)cc1	ZINC000819474842	FG	On-Demand	Anodyne	PLM1_PLAFA	34	41
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2=C(C)OCCC2)C1	ZINC000819474843	FH	On-Demand	Anodyne	PIK3CD	28	42
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2=C(C)OCCC2)C1	ZINC000819474843	FH	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2=C(C)OCCC2)C1	ZINC000819474844	FH	On-Demand	Anodyne	PIK3CD	28	42
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2=C(C)OCCC2)C1	ZINC000819474844	FH	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cn(-c3ccc(F)cc3C)nn2)C1	ZINC000819474845	II	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cn(-c3ccc(F)cc3C)nn2)C1	ZINC000819474848	II	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H](NC(N)=O)C(C)(C)C)C1	ZINC000819474850	GF	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H](NC(N)=O)C(C)(C)C)C1	ZINC000819474851	GF	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H](NC(N)=O)C(C)(C)C)C1	ZINC000819474852	GF	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H](NC(N)=O)C(C)(C)C)C1	ZINC000819474853	GF	On-Demand	Anodyne	FPR2	26	48
CC(C)(C)C(=O)NCCCC(=O)Nc1cn2cc(Br)ncc2n1	ZINC000819474854	GE	On-Demand	Anodyne	MAP3K5	54	37
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2c(C)coc2C)C1	ZINC000819474856	FI	On-Demand	Anodyne	CCR5	15	44
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2c(C)coc2C)C1	ZINC000819474856	FI	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2c(C)coc2C)C1	ZINC000819474858	FI	On-Demand	Anodyne	CCR5	15	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2c(C)coc2C)C1	ZINC000819474858	FI	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCn2nc(O)c3ccccc3c2=O)C1	ZINC000819474863	IG	On-Demand	Anodyne	FPR2	24	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCn2nc(O)c3ccccc3c2=O)C1	ZINC000819474865	IG	On-Demand	Anodyne	FPR2	24	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCNC(=O)c2ccc(C)cc2O)C1	ZINC000819474867	IH	On-Demand	Anodyne	FPR2	24	46
COCCNC(=O)c1ccccc1NC(=O)c1c(C)oc2ncn(C)c(=O)c12	ZINC000819474871	GD	On-Demand	Anodyne	POLR1A	46	34
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCNC(=O)c2ccc(C)cc2O)C1	ZINC000819474910	IH	On-Demand	Anodyne	FPR2	24	46
CCc1nc2ccccc2n1CC(=O)N1CCC[C@@H](n2c(CC)nc3ccccc32)C1	ZINC000819474911	HI	On-Demand	Anodyne	HRH1	20	42
CCc1nc2ccccc2n1CC(=O)N1CCC[C@@H](n2c(CC)nc3ccccc32)C1	ZINC000819474911	HI	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1CC(=O)N1CCC[C@H](n2c(CC)nc3ccccc32)C1	ZINC000819474912	HI	On-Demand	Anodyne	HRH1	20	42
CCc1nc2ccccc2n1CC(=O)N1CCC[C@H](n2c(CC)nc3ccccc32)C1	ZINC000819474912	HI	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CNC(=O)NCc2ccc(C)cc2)C1	ZINC000819474914	IH	On-Demand	Anodyne	FPR2	25	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CNC(=O)NCc2ccc(C)cc2)C1	ZINC000819474915	IH	On-Demand	Anodyne	FPR2	25	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cn2cc([C@@H](C)O)nn2)C1	ZINC000819474916	GE	On-Demand	Anodyne	FPR2	26	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cn2cc([C@H](C)O)nn2)C1	ZINC000819474917	GE	On-Demand	Anodyne	FPR2	26	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cn2cc([C@@H](C)O)nn2)C1	ZINC000819474918	GE	On-Demand	Anodyne	FPR2	26	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cn2cc([C@H](C)O)nn2)C1	ZINC000819474919	GE	On-Demand	Anodyne	FPR2	26	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CNC(=O)CNC(=O)OC(C)(C)C)C1	ZINC000819474921	IE	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CNC(=O)CNC(=O)OC(C)(C)C)C1	ZINC000819474922	IE	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C/c2ccccc2C#N)C1	ZINC000819474923	GI	On-Demand	Mild	FPR2	25	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C\c2ccccc2C#N)C1	ZINC000819474924	GI	On-Demand	Mild	FPR2	25	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C/c2ccccc2C#N)C1	ZINC000819474925	GI	On-Demand	Mild	FPR2	25	45
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C\c2ccccc2C#N)C1	ZINC000819474926	GI	On-Demand	Mild	FPR2	25	45
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000819474928	GF	On-Demand	Bother	FPR2	25	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cn2cc([N+](=O)[O-])cn2)C1	ZINC000819474929	GF	On-Demand	Bother	FPR2	25	45
CCOC1(C(=O)N2CCC[C@H](n3c(CC)nc4ccccc43)C2)CCCC1	ZINC000819474930	FI	On-Demand	Anodyne	FPR2	27	48
CCOC1(C(=O)N2CCC[C@@H](n3c(CC)nc4ccccc43)C2)CCCC1	ZINC000819474931	FI	On-Demand	Anodyne	FPR2	27	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(COC(C)(C)C)on2)C1	ZINC000819474934	HI	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(COC(C)(C)C)on2)C1	ZINC000819474935	HI	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2(OC)CCCCC2)C1	ZINC000819474936	FI	On-Demand	Anodyne	OPRL1	18	40
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2(OC)CCCCC2)C1	ZINC000819474936	FI	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2(OC)CCCCC2)C1	ZINC000819474937	FI	On-Demand	Anodyne	OPRL1	18	40
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2(OC)CCCCC2)C1	ZINC000819474937	FI	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cnn(CC(C)C)c2C2CC2)C1	ZINC000819474938	HJ	On-Demand	Anodyne	FPR2	26	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cnn(CC(C)C)c2C2CC2)C1	ZINC000819474939	HJ	On-Demand	Anodyne	FPR2	26	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1	ZINC000819474940	HJ	On-Demand	Bother	FPR2	28	53
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1	ZINC000819474941	HJ	On-Demand	Bother	FPR2	28	53
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cn(C)nc2C(C)C)C1	ZINC000819474948	GH	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cn(C)nc2C(C)C)C1	ZINC000819474949	GH	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cn2cnc(-c3ccccc3)n2)C1	ZINC000819474950	HH	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cn2cnc(-c3ccccc3)n2)C1	ZINC000819474951	HH	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccccc2S[C@@H](C)C(N)=O)C1	ZINC000819474952	II	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccccc2S[C@H](C)C(N)=O)C1	ZINC000819474953	II	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccccc2S[C@@H](C)C(N)=O)C1	ZINC000819474954	II	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccccc2S[C@H](C)C(N)=O)C1	ZINC000819474955	II	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCc2ccncn2)C1	ZINC000819474956	FG	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCc2ccncn2)C1	ZINC000819474957	FG	On-Demand	Anodyne	FPR2	25	46
O=C(Nc1ccccc1C(=O)Nc1cn2cc(Br)ncc2n1)c1ccsc1	ZINC000819474958	II	On-Demand	Anodyne	MAP3K5	65	41
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(C)nc3onc(C(C)C)c23)C1	ZINC000819474961	IK	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(C)nc3onc(C(C)C)c23)C1	ZINC000819474962	IK	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCOc2ccc(F)cc2)C1	ZINC000819474971	GI	On-Demand	Anodyne	HRH1	23	41
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCOc2ccc(F)cc2)C1	ZINC000819474971	GI	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCOc2ccc(F)cc2)C1	ZINC000819474972	GI	On-Demand	Anodyne	HRH1	23	41
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCOc2ccc(F)cc2)C1	ZINC000819474972	GI	On-Demand	Anodyne	FPR2	28	51
CC(C)(C)C(=O)Nc1nc(CC(=O)Nc2cn3cc(Br)ncc3n2)cs1	ZINC000819474973	IG	On-Demand	Anodyne	MAP3K5	40	34
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(F)c(F)c(F)c2F)C1	ZINC000819474975	HJ	On-Demand	Anodyne	FPR2	29	56
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(F)c(F)c(F)c2F)C1	ZINC000819474976	HJ	On-Demand	Anodyne	FPR2	29	56
C[C@@](O)(Cc1ccccc1)C(=O)Nc1cn2cc(Br)ncc2n1	ZINC000819474978	GE	On-Demand	Anodyne	MAP3K5	63	39
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CS(=O)(=O)CCOC)C1	ZINC000819474984	GD	On-Demand	Anodyne	FPR2	27	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CS(=O)(=O)CCOC)C1	ZINC000819474985	GD	On-Demand	Anodyne	FPR2	27	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C\c2cnc(C)s2)C1	ZINC000819474991	GI	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C/c2cnc(C)s2)C1	ZINC000819474993	GI	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C/c2cnc(C)s2)C1	ZINC000819474996	GI	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C\c2cnc(C)s2)C1	ZINC000819474998	GI	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)COc2ccc(C=O)cc2)C1	ZINC000819475004	GH	On-Demand	Anodyne	CPT1A	82	36
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)COc2ccc(C=O)cc2)C1	ZINC000819475004	GH	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)COc2ccc(C=O)cc2)C1	ZINC000819475006	GH	On-Demand	Anodyne	CPT1A	82	36
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)COc2ccc(C=O)cc2)C1	ZINC000819475006	GH	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CC(=O)NCC(F)(F)F)C1	ZINC000819475009	GF	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CC(=O)NCC(F)(F)F)C1	ZINC000819475013	GF	On-Demand	Anodyne	FPR2	26	47
C[C@H](O)c1ncc(C(=O)Nc2cn3cc(Br)ncc3n2)s1	ZINC000819475015	FE	On-Demand	Anodyne	MAP3K5	51	37
C[C@@H](O)c1ncc(C(=O)Nc2cn3cc(Br)ncc3n2)s1	ZINC000819475016	FE	On-Demand	Anodyne	MAP3K5	51	37
Cc1cc(-n2cccn2)ccc1NC[C@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819475022	FF	On-Demand	Anodyne	AMP1_PLAFQ	53	43
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2(C(=O)OC)CC2)C1	ZINC000819475023	FF	On-Demand	Anodyne	CCR5	15	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2(C(=O)OC)CC2)C1	ZINC000819475023	FF	On-Demand	Anodyne	FPR2	28	51
Cc1cc(-n2cccn2)ccc1NC[C@@H](O)CN(C)C(=O)OC(C)(C)C	ZINC000819475024	FF	On-Demand	Anodyne	AMP1_PLAFQ	53	43
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2(C(=O)OC)CC2)C1	ZINC000819475025	FF	On-Demand	Anodyne	CCR5	15	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2(C(=O)OC)CC2)C1	ZINC000819475025	FF	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCCC(=O)N(C)C)C1	ZINC000819475028	FG	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCCC(=O)N(C)C)C1	ZINC000819475030	FG	On-Demand	Anodyne	FPR2	26	48
CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@H](n2c(CC)nc3ccccc32)C1	ZINC000819475038	HI	On-Demand	Bother	FPR2	26	46
CCOc1cccc([N+](=O)[O-])c1C(=O)N1CCC[C@@H](n2c(CC)nc3ccccc32)C1	ZINC000819475040	HI	On-Demand	Bother	FPR2	26	46
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)N1CCC[C@@H](n2c(CC)nc3ccccc32)C1	ZINC000819475044	IG	On-Demand	Anodyne	FPR2	25	46
Cn1ccc2cccc(NC[C@@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)c21	ZINC000819475067	FH	On-Demand	Anodyne	GPR119	37	46
Cn1ccc2cccc(NC[C@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)c21	ZINC000819475068	FH	On-Demand	Anodyne	GPR119	37	46
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000819475085	EF	On-Demand	Anodyne	SIGMAR1	30	43
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000819475085	EF	On-Demand	Anodyne	BIRC2	20	41
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819475086	EF	On-Demand	Anodyne	SIGMAR1	30	43
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819475086	EF	On-Demand	Anodyne	BIRC2	20	41
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000819475087	EF	On-Demand	Anodyne	SIGMAR1	30	43
C[C@H](NC(=O)/C=C/[C@@H]1CCCO1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000819475087	EF	On-Demand	Anodyne	BIRC2	20	41
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819475088	EF	On-Demand	Anodyne	SIGMAR1	30	43
C[C@H](NC(=O)/C=C\[C@@H]1CCCO1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819475088	EF	On-Demand	Anodyne	BIRC2	20	41
COc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1O	ZINC000819475100	FF	On-Demand	Mild	PAPA1_CARPA	48	47
COc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1O	ZINC000819475100	FF	On-Demand	Mild	CCKAR	39	41
COc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1O	ZINC000819475100	FF	On-Demand	Mild	FPR1	44	39
COc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1O	ZINC000819475101	FF	On-Demand	Mild	PAPA1_CARPA	48	47
COc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1O	ZINC000819475101	FF	On-Demand	Mild	CCKAR	39	41
COc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1O	ZINC000819475101	FF	On-Demand	Mild	FPR1	44	39
Cc1cc(-n2cccn2)ccc1NC[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819475102	FF	On-Demand	Anodyne	AMP1_PLAFQ	44	46
Cc1cc(-n2cccn2)ccc1NC[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000819475103	FF	On-Demand	Anodyne	AMP1_PLAFQ	44	46
Cc1cc(O)ccc1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819475106	GH	On-Demand	Anodyne	CTSD	85	44
Cc1cc(O)ccc1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819475106	GH	On-Demand	Anodyne	PGC	57	39
Cc1cc(O)ccc1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819475106	GH	On-Demand	Anodyne	PAPA1_CARPA	43	45
Cc1cc(O)ccc1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819475106	GH	On-Demand	Anodyne	CTSK	20	50
Cc1cc(O)ccc1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819475106	GH	On-Demand	Anodyne	CTSL	20	45
Cc1cc(O)ccc1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819475106	GH	On-Demand	Anodyne	PGA	43	39
Cc1cc(O)ccc1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819475106	GH	On-Demand	Anodyne	BACE2	46	37
Cc1cc(O)ccc1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819475106	GH	On-Demand	Anodyne	TACR3	18	47
Cc1cc(O)ccc1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819475106	GH	On-Demand	Anodyne	REN	73	48
Cc1cc(O)ccc1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819475106	GH	On-Demand	Anodyne	REN1	18	46
Cc1cc(O)ccc1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819475106	GH	On-Demand	Anodyne	BACE1	65	41
Cc1cc(O)ccc1NC[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819475106	GH	On-Demand	Anodyne	FPR1	51	42
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)N1CCC[C@H](n2c(CC)nc3ccccc32)C1	ZINC000819475110	IG	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(Cl)cc(F)c2N)C1	ZINC000819475112	HI	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(Cl)cc(F)c2N)C1	ZINC000819475113	HI	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(C)cc3c[nH]nc23)C1	ZINC000819475114	GI	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(C)cc3c[nH]nc23)C1	ZINC000819475115	GI	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2c(F)ccc(OC)c2OC)C1	ZINC000819475116	HI	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2c(F)ccc(OC)c2OC)C1	ZINC000819475117	HI	On-Demand	Anodyne	FPR2	28	52
CC(C)(C)CNC(=O)c1ccc(C(=O)Nc2cn3cc(Br)ncc3n2)cc1	ZINC000819475118	IH	On-Demand	Anodyne	MAP3K5	87	56
O=C(CSCC(F)(F)F)Nc1cn2cc(Br)ncc2n1	ZINC000819475119	FF	On-Demand	Anodyne	MAP3K5	40	35
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cccc(OCc3noc(C)n3)c2)C1	ZINC000819475120	II	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cccc(OCc3noc(C)n3)c2)C1	ZINC000819475121	II	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CNC(=O)c2ccc(C#N)cc2)C1	ZINC000819475122	HG	On-Demand	Mild	PREP	20	40
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CNC(=O)c2ccc(C#N)cc2)C1	ZINC000819475122	HG	On-Demand	Mild	CTRB_BOVIN	45	34
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CNC(=O)c2ccc(C#N)cc2)C1	ZINC000819475122	HG	On-Demand	Mild	FPR2	24	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CNC(=O)c2ccc(C#N)cc2)C1	ZINC000819475123	HG	On-Demand	Mild	PREP	20	40
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CNC(=O)c2ccc(C#N)cc2)C1	ZINC000819475123	HG	On-Demand	Mild	CTRB_BOVIN	45	34
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CNC(=O)c2ccc(C#N)cc2)C1	ZINC000819475123	HG	On-Demand	Mild	FPR2	24	44
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1	ZINC000819475125	II	On-Demand	Bother	FPR2	24	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)C1	ZINC000819475126	II	On-Demand	Bother	FPR2	24	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc3cc[nH]c3c2)C1	ZINC000819475128	FJ	On-Demand	Anodyne	FPR2	32	59
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc3cc[nH]c3c2)C1	ZINC000819475129	FJ	On-Demand	Anodyne	FPR2	32	59
C=C[C@H](CC(=O)N1CCC[C@H](n2c(CC)nc3ccccc32)C1)c1ccccc1	ZINC000819475132	GK	On-Demand	Mild	FPR2	25	46
C=C[C@@H](CC(=O)N1CCC[C@H](n2c(CC)nc3ccccc32)C1)c1ccccc1	ZINC000819475133	GK	On-Demand	Mild	FPR2	25	46
C=C[C@@H](CC(=O)N1CCC[C@@H](n2c(CC)nc3ccccc32)C1)c1ccccc1	ZINC000819475134	GK	On-Demand	Mild	FPR2	25	46
C=C[C@H](CC(=O)N1CCC[C@@H](n2c(CC)nc3ccccc32)C1)c1ccccc1	ZINC000819475135	GK	On-Demand	Mild	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cnn3c2C[C@H](CNC(C)=O)CC3)C1	ZINC000819475138	IF	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cnn3c2C[C@@H](CNC(C)=O)CC3)C1	ZINC000819475139	IF	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cnn3c2C[C@@H](CNC(C)=O)CC3)C1	ZINC000819475140	IF	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cnn3c2C[C@H](CNC(C)=O)CC3)C1	ZINC000819475141	IF	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H](Br)C(C)(C)C)C1	ZINC000819475142	HJ	On-Demand	Reactive	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H](Br)C(C)(C)C)C1	ZINC000819475143	HJ	On-Demand	Reactive	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H](Br)C(C)(C)C)C1	ZINC000819475144	HJ	On-Demand	Reactive	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H](Br)C(C)(C)C)C1	ZINC000819475145	HJ	On-Demand	Reactive	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H]2COCCN2C(=O)OC(C)(C)C)C1	ZINC000819475147	IG	On-Demand	Anodyne	PREP	19	40
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H]2COCCN2C(=O)OC(C)(C)C)C1	ZINC000819475147	IG	On-Demand	Anodyne	FPR2	25	45
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H]2COCCN2C(=O)OC(C)(C)C)C1	ZINC000819475148	IG	On-Demand	Anodyne	PREP	19	40
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H]2COCCN2C(=O)OC(C)(C)C)C1	ZINC000819475148	IG	On-Demand	Anodyne	FPR2	25	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H]2COCCN2C(=O)OC(C)(C)C)C1	ZINC000819475149	IG	On-Demand	Anodyne	PREP	19	40
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H]2COCCN2C(=O)OC(C)(C)C)C1	ZINC000819475149	IG	On-Demand	Anodyne	FPR2	25	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H]2COCCN2C(=O)OC(C)(C)C)C1	ZINC000819475150	IG	On-Demand	Anodyne	PREP	19	40
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H]2COCCN2C(=O)OC(C)(C)C)C1	ZINC000819475150	IG	On-Demand	Anodyne	FPR2	25	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cc2ccccc2S(C)(=O)=O)C1	ZINC000819475151	IG	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cc2ccccc2S(C)(=O)=O)C1	ZINC000819475152	IG	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CN2CCN(CC)C(=O)C2=O)C1	ZINC000819475153	HD	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CN2CCN(CC)C(=O)C2=O)C1	ZINC000819475154	HD	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc3nc(O)[nH]c3n2)C1	ZINC000819475155	GG	On-Demand	Anodyne	FPR2	29	55
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc3nc(O)[nH]c3n2)C1	ZINC000819475156	GG	On-Demand	Anodyne	FPR2	29	55
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(S(N)(=O)=O)cn2C)C1	ZINC000819475159	HE	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(S(N)(=O)=O)cn2C)C1	ZINC000819475160	HE	On-Demand	Anodyne	FPR2	27	50
COC(=O)c1cccc(CC(=O)Nc2cn3cc(Br)ncc3n2)c1	ZINC000819475162	GE	On-Demand	Anodyne	MAP3K5	45	36
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2c(C)ccn2C)C1	ZINC000819475165	FH	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2c(C)ccn2C)C1	ZINC000819475166	FH	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cncnc2C(C)C)C1	ZINC000819475167	GH	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cncnc2C(C)C)C1	ZINC000819475168	GH	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C[C@@H](NC(N)=O)c2ccccc2C)C1	ZINC000819475169	IH	On-Demand	Anodyne	FPR2	24	43
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C[C@H](NC(N)=O)c2ccccc2C)C1	ZINC000819475170	IH	On-Demand	Anodyne	FPR2	24	43
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C[C@H](NC(N)=O)c2ccccc2C)C1	ZINC000819475171	IH	On-Demand	Anodyne	FPR2	24	43
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C[C@@H](NC(N)=O)c2ccccc2C)C1	ZINC000819475172	IH	On-Demand	Anodyne	FPR2	24	43
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cn2cnc3sccc3c2=O)C1	ZINC000819475173	HG	On-Demand	Anodyne	FPR2	23	43
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cn2cnc3sccc3c2=O)C1	ZINC000819475174	HG	On-Demand	Anodyne	FPR2	23	43
CC(=O)Nc1ccc(O)c(C(=O)Nc2cn3cc(Br)ncc3n2)c1	ZINC000819475177	GE	On-Demand	Anodyne	MAP3K5	57	39
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccn(CCOC)n2)C1	ZINC000819475178	GF	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccn(CCOC)n2)C1	ZINC000819475179	GF	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cn2c(C)nc3cc(F)c(F)cc32)C1	ZINC000819475180	II	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cn2c(C)nc3cc(F)c(F)cc32)C1	ZINC000819475181	II	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CNS(=O)(=O)CCOC(C)C)C1	ZINC000819475183	IE	On-Demand	Anodyne	FPR2	25	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CNS(=O)(=O)CCOC(C)C)C1	ZINC000819475184	IE	On-Demand	Anodyne	FPR2	25	44
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@](C)(O)Cc2ccccc2)C1	ZINC000819475187	GH	On-Demand	Anodyne	FPR2	26	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@](C)(O)Cc2ccccc2)C1	ZINC000819475188	GH	On-Demand	Anodyne	FPR2	26	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@](C)(O)Cc2ccccc2)C1	ZINC000819475189	GH	On-Demand	Anodyne	FPR2	26	52
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@](C)(O)Cc2ccccc2)C1	ZINC000819475190	GH	On-Demand	Anodyne	FPR2	26	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCc2cccc(OC)c2F)C1	ZINC000819475191	HJ	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCc2cccc(OC)c2F)C1	ZINC000819475192	HJ	On-Demand	Anodyne	FPR2	26	48
CC(C)(C(=O)Nc1cn2cc(Br)ncc2n1)N1CCOCC1	ZINC000819475207	FD	On-Demand	Anodyne	MAP3K5	55	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC(Cc2ccccc2)C1	ZINC000819475220	EF	On-Demand	Anodyne	PGC	45	31
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC(Cc2ccccc2)C1	ZINC000819475220	EF	On-Demand	Anodyne	CTSK	17	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC(Cc2ccccc2)C1	ZINC000819475220	EF	On-Demand	Anodyne	REN	41	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC(Cc2ccccc2)C1	ZINC000819475220	EF	On-Demand	Anodyne	FPR1	48	39
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(F)c(C#N)c2)C1	ZINC000819475224	GI	On-Demand	Mild	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(F)c(C#N)c2)C1	ZINC000819475230	GI	On-Demand	Mild	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cc2cc(OC)c(O)c(OC)c2)C1	ZINC000819475231	HH	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cc2cc(OC)c(O)c(OC)c2)C1	ZINC000819475232	HH	On-Demand	Anodyne	FPR2	28	51
COCCn1ccc(C(=O)Nc2cn3cc(Br)ncc3n2)n1	ZINC000819475234	FD	On-Demand	Anodyne	MAP3K5	63	39
CCc1ccc(C(=O)Nc2cn3cc(Br)ncc3n2)c(O)c1	ZINC000819475247	FG	On-Demand	Anodyne	MAP3K5	56	38
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(S(C)(=O)=O)ccc2F)C1	ZINC000819475249	IH	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(S(C)(=O)=O)ccc2F)C1	ZINC000819475252	IH	On-Demand	Anodyne	FPR2	27	50
Cc1cc(O)ccc1NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819475265	FG	On-Demand	Anodyne	GPR119	29	40
Cc1cc(O)ccc1NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819475266	FG	On-Demand	Anodyne	GPR119	29	40
COCCNC(=O)c1ccccc1NC(=O)[C@H]1CCCN(C(C)=O)C1	ZINC000819475304	ED	On-Demand	Anodyne	SLC6A1	72	34
COCCNC(=O)c1ccccc1NC(=O)[C@H]1CCCN(C(C)=O)C1	ZINC000819475304	ED	On-Demand	Anodyne	HCN1	50	31
COCCNC(=O)c1ccccc1NC(=O)[C@H]1CCCN(C(C)=O)C1	ZINC000819475304	ED	On-Demand	Anodyne	HCN4	48	31
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCN(C(C)=O)C1	ZINC000819475305	ED	On-Demand	Anodyne	SLC6A1	72	34
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCN(C(C)=O)C1	ZINC000819475305	ED	On-Demand	Anodyne	HCN1	50	31
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCN(C(C)=O)C1	ZINC000819475305	ED	On-Demand	Anodyne	HCN4	48	31
Cc1nc(C(=O)Nc2cn3cc(Br)ncc3n2)nn1-c1nc[nH]n1	ZINC000819475311	GC	On-Demand	Anodyne	MAP3K5	44	34
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2(C)CCCC2)C1	ZINC000819475312	EI	On-Demand	Anodyne	OPRL1	18	43
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2(C)CCCC2)C1	ZINC000819475312	EI	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2(C)CCCC2)C1	ZINC000819475313	EI	On-Demand	Anodyne	OPRL1	18	43
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2(C)CCCC2)C1	ZINC000819475313	EI	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(F)cc(Cl)c2)C1	ZINC000819475314	GJ	On-Demand	Anodyne	FPR2	28	53
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(F)cc(Cl)c2)C1	ZINC000819475315	GJ	On-Demand	Anodyne	FPR2	28	53
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2oc(C3CC3)nc2C)C1	ZINC000819475318	GI	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2oc(C3CC3)nc2C)C1	ZINC000819475319	GI	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(S(N)(=O)=O)oc2C)C1	ZINC000819475321	HF	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(S(N)(=O)=O)oc2C)C1	ZINC000819475322	HF	On-Demand	Anodyne	FPR2	27	49
CCN(CC)S(=O)(=O)CC(=O)Nc1cn2cc(Br)ncc2n1	ZINC000819475323	GD	On-Demand	Anodyne	MAP3K5	42	34
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc3nc(C)ccc3o2)C1	ZINC000819475324	GJ	On-Demand	Anodyne	FPR2	27	53
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc3nc(C)ccc3o2)C1	ZINC000819475325	GJ	On-Demand	Anodyne	FPR2	27	53
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C\c2ccsc2)C1	ZINC000819475326	FJ	On-Demand	Anodyne	HDAC6	15	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C\c2ccsc2)C1	ZINC000819475326	FJ	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C/c2ccsc2)C1	ZINC000819475327	FJ	On-Demand	Anodyne	HDAC6	15	44
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C/c2ccsc2)C1	ZINC000819475327	FJ	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C\c2ccsc2)C1	ZINC000819475328	FJ	On-Demand	Anodyne	HDAC6	15	44
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C\c2ccsc2)C1	ZINC000819475328	FJ	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C/c2ccsc2)C1	ZINC000819475329	FJ	On-Demand	Anodyne	HDAC6	15	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C/c2ccsc2)C1	ZINC000819475329	FJ	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H](c2ccccc2)N2CCC(O)CC2)C1	ZINC000819475330	IH	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H](c2ccccc2)N2CCC(O)CC2)C1	ZINC000819475331	IH	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H](c2ccccc2)N2CCC(O)CC2)C1	ZINC000819475332	IH	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H](c2ccccc2)N2CCC(O)CC2)C1	ZINC000819475333	IH	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C(C)(C)S(C)(=O)=O)C1	ZINC000819475337	GF	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C(C)(C)S(C)(=O)=O)C1	ZINC000819475338	GF	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2nn(-c3ccc(F)cc3)cc2C)C1	ZINC000819475341	IJ	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2nn(-c3ccc(F)cc3)cc2C)C1	ZINC000819475342	IJ	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCc2cnn(C)c2C)C1	ZINC000819475343	GG	On-Demand	Anodyne	FPR2	24	45
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCc2cnn(C)c2C)C1	ZINC000819475344	GG	On-Demand	Anodyne	FPR2	24	45
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C(C)(C)S(=O)(=O)C2CC2)C1	ZINC000819475345	HG	On-Demand	Anodyne	FPR2	26	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C(C)(C)S(=O)(=O)C2CC2)C1	ZINC000819475346	HG	On-Demand	Anodyne	FPR2	26	50
COc1ncnc(OC)c1C(=O)Nc1cn2cc(Br)ncc2n1	ZINC000819475347	GD	On-Demand	Anodyne	MAP3K5	57	39
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cc2ccccc2OC(F)F)C1	ZINC000819475354	HJ	On-Demand	Anodyne	FPR2	27	48
Cc1cc(O)ccc1NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819475356	DE	On-Demand	Anodyne	ADRB3	23	41
Cc1cc(O)ccc1NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819475357	DE	On-Demand	Anodyne	ADRB3	23	41
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cc2ccccc2OC(F)F)C1	ZINC000819475358	HJ	On-Demand	Anodyne	FPR2	27	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cn(C(C)C)cn2)C1	ZINC000819475360	FH	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cn(C(C)C)cn2)C1	ZINC000819475361	FH	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C\c2cnccn2)C1	ZINC000819475377	FG	On-Demand	Anodyne	FPR2	25	45
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C/c2cnccn2)C1	ZINC000819475380	FG	On-Demand	Anodyne	FPR2	25	45
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C\c2cnccn2)C1	ZINC000819475382	FG	On-Demand	Anodyne	FPR2	25	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C/c2cnccn2)C1	ZINC000819475383	FG	On-Demand	Anodyne	FPR2	25	45
CN(C)S(=O)(=O)c1ccc(C(=O)Nc2cn3cc(Br)ncc3n2)cn1	ZINC000819475384	ID	On-Demand	Anodyne	MAP3K5	70	44
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cccc(C(=O)OC)n2)C1	ZINC000819475388	GG	On-Demand	Anodyne	FPR2	29	53
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cccc(C(=O)OC)n2)C1	ZINC000819475389	GG	On-Demand	Anodyne	FPR2	29	53
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H]2CC(c3cccnc3)=NO2)C1	ZINC000819475399	HG	On-Demand	Anodyne	FPR2	23	43
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H]2CC(c3cccnc3)=NO2)C1	ZINC000819475402	HG	On-Demand	Anodyne	FPR2	23	43
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H]2CC(c3cccnc3)=NO2)C1	ZINC000819475403	HG	On-Demand	Anodyne	FPR2	23	43
COC[C@@H](C)Oc1ccc(Cl)cc1NC[C@@H](O)c1cccnc1	ZINC000819475405	EG	On-Demand	Anodyne	ADRB3	41	38
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H]2CC(c3cccnc3)=NO2)C1	ZINC000819475406	HG	On-Demand	Anodyne	FPR2	23	43
COC[C@@H](C)Oc1ccc(Cl)cc1NC[C@H](O)c1cccnc1	ZINC000819475407	EG	On-Demand	Anodyne	ADRB3	41	38
COCc1c(C(=O)Nc2cn3cc(Br)ncc3n2)cnn1-c1ccccc1	ZINC000819475422	IG	On-Demand	Anodyne	MAP3K5	57	35
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H](C)c2cccc(OC)c2)C1	ZINC000819475423	GJ	On-Demand	Anodyne	FPR2	31	58
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H](C)c2cccc(OC)c2)C1	ZINC000819475429	GJ	On-Demand	Anodyne	FPR2	31	58
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H](C)c2cccc(OC)c2)C1	ZINC000819475432	GJ	On-Demand	Anodyne	FPR2	31	58
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H](C)c2cccc(OC)c2)C1	ZINC000819475434	GJ	On-Demand	Anodyne	FPR2	31	58
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C/c2ncccc2C)C1	ZINC000819475438	FI	On-Demand	Anodyne	FPR2	25	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C\c2ncccc2C)C1	ZINC000819475441	FI	On-Demand	Anodyne	FPR2	25	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C/c2ncccc2C)C1	ZINC000819475442	FI	On-Demand	Anodyne	FPR2	25	45
COCCNC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000819475443	FE	On-Demand	Bother	CACNA1C	47	38
COCCNC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000819475443	FE	On-Demand	Bother	CACNA1D	75	35
COCCNC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000819475443	FE	On-Demand	Bother	KCNMA1	39	60
COCCNC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000819475443	FE	On-Demand	Bother	ABCG2	27	45
COCCNC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000819475443	FE	On-Demand	Bother	WDR5	31	40
CON(C)C(=O)CCNc1ccc(N2CCN(C)CC2)c(Br)c1	ZINC000819475444	GE	On-Demand	Anodyne	DRD4	40	32
CON(C)C(=O)CCNc1ccc(N2CCN(C)CC2)c(Br)c1	ZINC000819475444	GE	On-Demand	Anodyne	HTR1B	19	43
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C\c2ncccc2C)C1	ZINC000819475446	FI	On-Demand	Anodyne	FPR2	25	45
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc3nc(O)[nH]c3c2)C1	ZINC000819475447	GH	On-Demand	Anodyne	FPR2	32	58
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc3nc(O)[nH]c3c2)C1	ZINC000819475449	GH	On-Demand	Anodyne	FPR2	32	58
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cc2cc(F)ccc2OC)C1	ZINC000819475455	GI	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cc2cc(F)ccc2OC)C1	ZINC000819475455	GI	On-Demand	Anodyne	ACKR3	46	33
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cc2cc(F)ccc2OC)C1	ZINC000819475458	GI	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cc2cc(F)ccc2OC)C1	ZINC000819475458	GI	On-Demand	Anodyne	ACKR3	46	33
C#CCNC(=O)CCNc1ccc(-n2cccn2)cc1C	ZINC000819475459	CD	On-Demand	Mild	AMP1_PLAFQ	50	37
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2coc(C(N)=O)c2)C1	ZINC000819475460	FF	On-Demand	Anodyne	FPR2	29	55
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2coc(C(N)=O)c2)C1	ZINC000819475462	FF	On-Demand	Anodyne	FPR2	29	55
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2c(O)nnc(C)c2C)C1	ZINC000819475464	GG	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2c(O)nnc(C)c2C)C1	ZINC000819475465	GG	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C/c2cccc(O)c2)C1	ZINC000819475466	GI	On-Demand	Anodyne	HDAC8	49	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C/c2cccc(O)c2)C1	ZINC000819475466	GI	On-Demand	Anodyne	HDAC1	21	52
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C/c2cccc(O)c2)C1	ZINC000819475466	GI	On-Demand	Anodyne	HDAC6	28	52
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C/c2cccc(O)c2)C1	ZINC000819475466	GI	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C\c2cccc(O)c2)C1	ZINC000819475467	GI	On-Demand	Anodyne	HDAC8	49	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C\c2cccc(O)c2)C1	ZINC000819475467	GI	On-Demand	Anodyne	HDAC1	21	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C\c2cccc(O)c2)C1	ZINC000819475467	GI	On-Demand	Anodyne	HDAC6	28	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C\c2cccc(O)c2)C1	ZINC000819475467	GI	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C/c2cccc(O)c2)C1	ZINC000819475468	GI	On-Demand	Anodyne	HDAC8	49	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C/c2cccc(O)c2)C1	ZINC000819475468	GI	On-Demand	Anodyne	HDAC1	21	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C/c2cccc(O)c2)C1	ZINC000819475468	GI	On-Demand	Anodyne	HDAC6	28	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C/c2cccc(O)c2)C1	ZINC000819475468	GI	On-Demand	Anodyne	FPR2	27	49
Cc1cc(O)ccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819475470	FG	On-Demand	Anodyne	GPR119	58	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C\c2cccc(O)c2)C1	ZINC000819475471	GI	On-Demand	Anodyne	HDAC8	49	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C\c2cccc(O)c2)C1	ZINC000819475471	GI	On-Demand	Anodyne	HDAC1	21	52
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C\c2cccc(O)c2)C1	ZINC000819475471	GI	On-Demand	Anodyne	HDAC6	28	52
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C\c2cccc(O)c2)C1	ZINC000819475471	GI	On-Demand	Anodyne	FPR2	27	49
Cc1cc(O)ccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819475472	FG	On-Demand	Anodyne	GPR119	58	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cc2nc3ncccn3n2)C1	ZINC000819475473	GE	On-Demand	Anodyne	FPR2	24	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cc2nc3ncccn3n2)C1	ZINC000819475475	GE	On-Demand	Anodyne	FPR2	24	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2nc(-c3ccccc3)cs2)C1	ZINC000819475478	HK	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2nc(-c3ccccc3)cs2)C1	ZINC000819475481	HK	On-Demand	Anodyne	FPR2	27	50
CC(C)(C)OC(=O)NCc1cc(C(=O)Nc2cn3cc(Br)ncc3n2)co1	ZINC000819475482	IG	On-Demand	Anodyne	MAP3K5	63	39
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(COc3ccccc3F)on2)C1	ZINC000819475491	IJ	On-Demand	Anodyne	FPR2	26	47
COC[C@@H](O)CNc1ccc(N2CCN(C)CC2)c(Br)c1	ZINC000819475500	FD	On-Demand	Anodyne	HTR1B	16	41
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(COc3ccccc3F)on2)C1	ZINC000819475510	IJ	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H](C)CN2CCOCC2)C1	ZINC000819475512	GF	On-Demand	Anodyne	PIK3CD	34	44
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H](C)CN2CCOCC2)C1	ZINC000819475512	GF	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H](C)CN2CCOCC2)C1	ZINC000819475513	GF	On-Demand	Anodyne	PIK3CD	34	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H](C)CN2CCOCC2)C1	ZINC000819475513	GF	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H](C)CN2CCOCC2)C1	ZINC000819475514	GF	On-Demand	Anodyne	PIK3CD	34	44
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H](C)CN2CCOCC2)C1	ZINC000819475514	GF	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H](C)CN2CCOCC2)C1	ZINC000819475515	GF	On-Demand	Anodyne	PIK3CD	34	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H](C)CN2CCOCC2)C1	ZINC000819475515	GF	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccoc2C2(O)CCOCC2)C1	ZINC000819475518	HH	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccoc2C2(O)CCOCC2)C1	ZINC000819475519	HH	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cc2cccc(OCC(=O)NC)c2)C1	ZINC000819475520	IG	On-Demand	Anodyne	FPR2	25	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cc2cccc(OCC(=O)NC)c2)C1	ZINC000819475521	IG	On-Demand	Anodyne	FPR2	25	45
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(C3CC3)on2)C1	ZINC000819475522	FH	On-Demand	Anodyne	FPR2	28	53
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(C3CC3)on2)C1	ZINC000819475523	FH	On-Demand	Anodyne	FPR2	28	53
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2csc(C)c2C)C1	ZINC000819475524	FJ	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2csc(C)c2C)C1	ZINC000819475525	FJ	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(C)c(C(C)=O)c2)C1	ZINC000819475526	GJ	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(C)c(C(C)=O)c2)C1	ZINC000819475526	GJ	On-Demand	Anodyne	HPGD	42	38
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(C)c(C(C)=O)c2)C1	ZINC000819475527	GJ	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(C)c(C(C)=O)c2)C1	ZINC000819475527	GJ	On-Demand	Anodyne	HPGD	42	38
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cn2c(S)nc3ccccc3c2=O)C1	ZINC000819475531	IG	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cn2c(S)nc3ccccc3c2=O)C1	ZINC000819475532	IG	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(Oc3ccccc3)ccn2)C1	ZINC000819475533	IK	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(Oc3ccccc3)ccn2)C1	ZINC000819475534	IK	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000819475535	HH	On-Demand	Bother	FPR2	26	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])c(F)cc2N)C1	ZINC000819475536	HH	On-Demand	Bother	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H]2C[C@]23CCOc2ccccc23)C1	ZINC000819475539	HJ	On-Demand	Anodyne	FPR2	23	43
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H]2C[C@]23CCOc2ccccc23)C1	ZINC000819475540	HJ	On-Demand	Anodyne	FPR2	23	43
O=C(Cn1cc(C(=O)Nc2cn3cc(Br)ncc3n2)cn1)NC1CCCCC1	ZINC000819475544	IE	On-Demand	Anodyne	MAP3K5	49	35
CS(=O)(=O)CC(=O)Nc1cn2cc(Br)ncc2n1	ZINC000819475547	EC	On-Demand	Anodyne	MAP3K5	45	37
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCSCc2ccccn2)C1	ZINC000819475548	HI	On-Demand	Anodyne	FPR2	24	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCSCc2ccccn2)C1	ZINC000819475552	HI	On-Demand	Anodyne	FPR2	24	45
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cn(C)nc2-c2cccs2)C1	ZINC000819475553	HJ	On-Demand	Anodyne	FPR2	25	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cn(C)nc2-c2cccs2)C1	ZINC000819475559	HJ	On-Demand	Anodyne	FPR2	25	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(C(F)(F)F)cc2O)C1	ZINC000819475562	HJ	On-Demand	Anodyne	CACNA1B	43	36
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(C(F)(F)F)cc2O)C1	ZINC000819475562	HJ	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(C(F)(F)F)cc2O)C1	ZINC000819475565	HJ	On-Demand	Anodyne	CACNA1B	43	36
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(C(F)(F)F)cc2O)C1	ZINC000819475565	HJ	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc3nccn3c2)C1	ZINC000819475566	FH	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc3nccn3c2)C1	ZINC000819475568	FH	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)C1	ZINC000819475578	GI	On-Demand	Bother	FPR2	28	53
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(C)cc([N+](=O)[O-])c2)C1	ZINC000819475581	GI	On-Demand	Bother	FPR2	28	53
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(NC(C)=O)ccc2C)C1	ZINC000819475593	HI	On-Demand	Anodyne	MCHR1	15	40
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(NC(C)=O)ccc2C)C1	ZINC000819475593	HI	On-Demand	Anodyne	FPR2	27	51
Cc1cc(-n2cccn2)ccc1NCCS(=O)(=O)CC(=O)OC(C)(C)C	ZINC000819475598	GE	On-Demand	Anodyne	AMP1_PLAFQ	26	40
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(NC(C)=O)ccc2C)C1	ZINC000819475599	HI	On-Demand	Anodyne	MCHR1	15	40
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(NC(C)=O)ccc2C)C1	ZINC000819475599	HI	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cnc(O)c(Br)c2)C1	ZINC000819475601	IH	On-Demand	Anodyne	FPR2	28	55
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cnc(O)c(Br)c2)C1	ZINC000819475602	IH	On-Demand	Anodyne	FPR2	28	55
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2nnn(-c3ccccc3)c2C)C1	ZINC000819475607	HH	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2nnn(-c3ccccc3)c2C)C1	ZINC000819475610	HH	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccccc2NS(=O)(=O)CC)C1	ZINC000819475612	IH	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccccc2NS(=O)(=O)CC)C1	ZINC000819475615	IH	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)N3C)C1	ZINC000819475618	IH	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc3c(c2)NC(=O)[C@H](C)N3C)C1	ZINC000819475621	IH	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)N3C)C1	ZINC000819475624	IH	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc3c(c2)NC(=O)[C@H](C)N3C)C1	ZINC000819475626	IH	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(CO)c(F)c2)C1	ZINC000819475629	GH	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(CO)c(F)c2)C1	ZINC000819475631	GH	On-Demand	Anodyne	FPR2	28	51
O=C(/C=C/[C@@H]1CCCO1)N1CC(Cc2ccccc2)C1	ZINC000819475635	CE	On-Demand	Anodyne	GRIN2B	51	48
O=C(/C=C\[C@H]1CCCO1)N1CC(Cc2ccccc2)C1	ZINC000819475637	CE	On-Demand	Anodyne	GRIN2B	51	48
O=C(/C=C\[C@@H]1CCCO1)N1CC(Cc2ccccc2)C1	ZINC000819475638	CE	On-Demand	Anodyne	GRIN2B	51	48
O=C(/C=C/[C@H]1CCCO1)N1CC(Cc2ccccc2)C1	ZINC000819475639	CE	On-Demand	Anodyne	GRIN2B	51	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CNS(=O)(=O)c2cn(C)cn2)C1	ZINC000819475642	ID	On-Demand	Anodyne	FPR2	23	43
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CNS(=O)(=O)c2cn(C)cn2)C1	ZINC000819475643	ID	On-Demand	Anodyne	FPR2	23	43
CCCOc1cn(-c2ccccc2)nc1C(=O)Nc1cn2cc(Br)ncc2n1	ZINC000819475645	IH	On-Demand	Anodyne	MAP3K5	54	34
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2c(F)ccc(O)c2F)C1	ZINC000819475654	GI	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2n[nH]c(C)c2C)C1	ZINC000819475664	FG	On-Demand	Anodyne	FPR2	29	53
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2n[nH]c(C)c2C)C1	ZINC000819475666	FG	On-Demand	Anodyne	FPR2	29	53
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(C)nc(C(F)(F)F)n2)C1	ZINC000819475679	HI	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(C)nc(C(F)(F)F)n2)C1	ZINC000819475683	HI	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccccc2OC(C)C)C1	ZINC000819475693	GJ	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccccc2OC(C)C)C1	ZINC000819475699	GJ	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cncnc2-c2ccccc2)C1	ZINC000819475700	HJ	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cncnc2-c2ccccc2)C1	ZINC000819475703	HJ	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(-c3cncnc3)cc2F)C1	ZINC000819475707	IJ	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(-c3cncnc3)cc2F)C1	ZINC000819475708	IJ	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C\C2CC2)C1	ZINC000819475709	DH	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C/C2CC2)C1	ZINC000819475710	DH	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C/C2CC2)C1	ZINC000819475711	DH	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C\C2CC2)C1	ZINC000819475712	DH	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2(O)CCCC2)C1	ZINC000819475713	EG	On-Demand	Anodyne	OPRL1	17	41
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2(O)CCCC2)C1	ZINC000819475713	EG	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2(O)CCCC2)C1	ZINC000819475714	EG	On-Demand	Anodyne	OPRL1	17	41
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2(O)CCCC2)C1	ZINC000819475714	EG	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(C(=O)NC(C)C)cc2)C1	ZINC000819475716	HI	On-Demand	Anodyne	FPR2	29	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(C(=O)NC(C)C)cc2)C1	ZINC000819475717	HI	On-Demand	Anodyne	FPR2	29	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cc2cccc(OCC#N)c2)C1	ZINC000819475721	HH	On-Demand	Mild	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cc2cccc(OCC#N)c2)C1	ZINC000819475724	HH	On-Demand	Mild	FPR2	26	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C(C)(C)CSC)C1	ZINC000819475726	FI	On-Demand	Anodyne	FPR2	26	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C(C)(C)CSC)C1	ZINC000819475727	FI	On-Demand	Anodyne	FPR2	26	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc3c(nc2O)CCCCC3)C1	ZINC000819475728	HI	On-Demand	Anodyne	FPR2	27	52
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc3c(nc2O)CCCCC3)C1	ZINC000819475730	HI	On-Demand	Anodyne	FPR2	27	52
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCCC(C)=O)C1	ZINC000819475732	EH	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCCC(C)=O)C1	ZINC000819475733	EH	On-Demand	Anodyne	FPR2	27	51
COC[C@@H](C)Oc1ccc(Cl)cc1NC[C@H](O)COc1ccccc1F	ZINC000819475737	GH	On-Demand	Anodyne	ADRB2	19	40
COC[C@@H](C)Oc1ccc(Cl)cc1NC[C@@H](O)COc1ccccc1F	ZINC000819475738	GH	On-Demand	Anodyne	ADRB2	19	40
CN1CCN(c2ccc(NC[C@H](O)c3ccccc3)cc2Br)CC1	ZINC000819475740	GG	On-Demand	Anodyne	NPY2R	80	37
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H](C)[C@H](C)CC)C1	ZINC000819475750	EI	On-Demand	Anodyne	FPR2	28	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H](C)[C@@H](C)CC)C1	ZINC000819475752	EI	On-Demand	Anodyne	FPR2	28	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H](C)[C@H](C)CC)C1	ZINC000819475754	EI	On-Demand	Anodyne	FPR2	28	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H](C)[C@@H](C)CC)C1	ZINC000819475757	EI	On-Demand	Anodyne	FPR2	28	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C[C@@H](O)c2cccc(F)c2)C1	ZINC000819475759	GI	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C[C@H](O)c2cccc(F)c2)C1	ZINC000819475761	GI	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C[C@H](O)c2cccc(F)c2)C1	ZINC000819475762	GI	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C[C@@H](O)c2cccc(F)c2)C1	ZINC000819475764	GI	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2nn(-c3ccc(Cl)cc3)cc2O)C1	ZINC000819475766	IJ	On-Demand	Anodyne	FPR2	25	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2nn(-c3ccc(Cl)cc3)cc2O)C1	ZINC000819475774	IJ	On-Demand	Anodyne	FPR2	25	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CSCCN(CC)CC)C1	ZINC000819475777	HH	On-Demand	Anodyne	FPR2	25	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CSCCN(CC)CC)C1	ZINC000819475780	HH	On-Demand	Anodyne	FPR2	25	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2(NC(N)=O)CC2)C1	ZINC000819475785	FD	On-Demand	Anodyne	FPR2	26	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2(NC(N)=O)CC2)C1	ZINC000819475787	FD	On-Demand	Anodyne	FPR2	26	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(-c3nc[nH]n3)cc2)C1	ZINC000819475790	HH	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(-c3nc[nH]n3)cc2)C1	ZINC000819475793	HH	On-Demand	Anodyne	FPR2	28	51
Cc1cc(-n2cccn2)ccc1NC[C@@H](O)CCNC(=O)OC(C)(C)C	ZINC000819475795	FF	On-Demand	Anodyne	AMP1_PLAFQ	48	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(S(=O)(=O)N(C)C)nc2)C1	ZINC000819475796	IF	On-Demand	Anodyne	FPR2	25	48
Cc1cc(-n2cccn2)ccc1NC[C@H](O)CCNC(=O)OC(C)(C)C	ZINC000819475797	FF	On-Demand	Anodyne	AMP1_PLAFQ	48	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(S(=O)(=O)N(C)C)nc2)C1	ZINC000819475798	IF	On-Demand	Anodyne	FPR2	25	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cnc([C@H](C)O)s2)C1	ZINC000819475801	GH	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cnc([C@@H](C)O)s2)C1	ZINC000819475803	GH	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cnc([C@H](C)O)s2)C1	ZINC000819475806	GH	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cnc([C@@H](C)O)s2)C1	ZINC000819475808	GH	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H](CO)NC(N)=O)C1	ZINC000819475812	FC	On-Demand	Anodyne	P2RY12	47	32
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H](CO)NC(N)=O)C1	ZINC000819475812	FC	On-Demand	Anodyne	TRY1_BOVIN	48	34
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H](CO)NC(N)=O)C1	ZINC000819475812	FC	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H](CO)NC(N)=O)C1	ZINC000819475815	FC	On-Demand	Anodyne	P2RY12	47	32
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H](CO)NC(N)=O)C1	ZINC000819475815	FC	On-Demand	Anodyne	TRY1_BOVIN	48	34
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H](CO)NC(N)=O)C1	ZINC000819475815	FC	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H](CO)NC(N)=O)C1	ZINC000819475817	FC	On-Demand	Anodyne	P2RY12	47	32
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H](CO)NC(N)=O)C1	ZINC000819475817	FC	On-Demand	Anodyne	TRY1_BOVIN	48	34
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H](CO)NC(N)=O)C1	ZINC000819475817	FC	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H](CO)NC(N)=O)C1	ZINC000819475819	FC	On-Demand	Anodyne	P2RY12	47	32
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H](CO)NC(N)=O)C1	ZINC000819475819	FC	On-Demand	Anodyne	TRY1_BOVIN	48	34
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H](CO)NC(N)=O)C1	ZINC000819475819	FC	On-Demand	Anodyne	FPR2	27	49
CN1CCN(c2ccc(NC[C@H](O)c3cccnc3)cc2Br)CC1	ZINC000819475823	GF	On-Demand	Anodyne	ADRB3	71	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)C1	ZINC000819475831	IH	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)C1	ZINC000819475838	IH	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)C1	ZINC000819475840	IH	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)C1	ZINC000819475843	IH	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H](C)Sc2nnnn2C2CC2)C1	ZINC000819475844	IG	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H](C)Sc2nnnn2C2CC2)C1	ZINC000819475849	IG	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H](C)Sc2nnnn2C2CC2)C1	ZINC000819475850	IG	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H](C)Sc2nnnn2C2CC2)C1	ZINC000819475851	IG	On-Demand	Anodyne	FPR2	25	46
COCCNC(=O)c1ccccc1NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1	ZINC000819475858	JG	On-Demand	Anodyne	PRTN3	47	39
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1ccc(O)cc1	ZINC000819475868	CE	On-Demand	Anodyne	PAPA1_CARPA	30	41
CC(C)(C)OC(=O)NCC[C@H](O)CNc1ccc(O)cc1	ZINC000819475869	CE	On-Demand	Anodyne	PAPA1_CARPA	30	41
O=C(Cc1ccc(-n2cnnc2)cc1)Nc1cc(F)c(N2CCCCC2)c(F)c1	ZINC000819475870	GH	On-Demand	Anodyne	KCNQ2	27	41
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H]2CCc3nn[nH]c3C2)C1	ZINC000819475871	GF	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H]2CCc3nn[nH]c3C2)C1	ZINC000819475873	GF	On-Demand	Anodyne	FPR2	26	48
COC[C@@H](C)Oc1ccc(Cl)cc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819475875	GH	On-Demand	Bother	CACNA1D	42	35
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H]2CCc3nn[nH]c3C2)C1	ZINC000819475876	GF	On-Demand	Anodyne	FPR2	26	48
COC[C@@H](C)Oc1ccc(Cl)cc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819475878	GH	On-Demand	Bother	CACNA1D	42	35
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H]2CCc3nn[nH]c3C2)C1	ZINC000819475880	GF	On-Demand	Anodyne	FPR2	26	48
O=C(/C=C\c1cccc(O)c1)Nc1cn2cc(Br)ncc2n1	ZINC000819475882	FF	On-Demand	Anodyne	HDAC8	49	36
O=C(/C=C/c1cccc(O)c1)Nc1cn2cc(Br)ncc2n1	ZINC000819475883	FF	On-Demand	Anodyne	HDAC8	49	36
O=C(CSc1ccc2ccccc2c1)Nc1cn2cc(Br)ncc2n1	ZINC000819475884	HI	On-Demand	Anodyne	FAS	58	35
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(C)nn2C(CC)CC)C1	ZINC000819475886	HJ	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(C)nn2C(CC)CC)C1	ZINC000819475887	HJ	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C[C@@](C)(O)C2CC2)C1	ZINC000819475888	FG	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C[C@](C)(O)C2CC2)C1	ZINC000819475889	FG	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C[C@@](C)(O)C2CC2)C1	ZINC000819475890	FG	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C[C@](C)(O)C2CC2)C1	ZINC000819475891	FG	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2occc2C(C)C)C1	ZINC000819475894	FJ	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2occc2C(C)C)C1	ZINC000819475895	FJ	On-Demand	Anodyne	FPR2	27	51
CSc1cc(C(=O)Nc2cn3cc(Br)ncc3n2)ccc1F	ZINC000819475896	GH	On-Demand	Anodyne	MAP3K5	73	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2c(OC)ncnc2OC)C1	ZINC000819475898	GF	On-Demand	Anodyne	CCR5	15	44
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2c(OC)ncnc2OC)C1	ZINC000819475898	GF	On-Demand	Anodyne	FPR2	30	56
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2c(OC)ncnc2OC)C1	ZINC000819475899	GF	On-Demand	Anodyne	CCR5	15	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2c(OC)ncnc2OC)C1	ZINC000819475899	GF	On-Demand	Anodyne	FPR2	30	56
CC(C)(C)OC(=O)NCC(=O)NCC(=O)Nc1cn2cc(Br)ncc2n1	ZINC000819475900	ID	On-Demand	Anodyne	MAP3K5	50	37
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCOc2ccc(C(N)=O)cc2)C1	ZINC000819475902	HG	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCOc2ccc(C(N)=O)cc2)C1	ZINC000819475903	HG	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C(C)(C)N2CCOCC2)C1	ZINC000819475907	GF	On-Demand	Anodyne	PIK3CD	34	44
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C(C)(C)N2CCOCC2)C1	ZINC000819475907	GF	On-Demand	Anodyne	FPR2	26	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C(C)(C)N2CCOCC2)C1	ZINC000819475909	GF	On-Demand	Anodyne	PIK3CD	34	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C(C)(C)N2CCOCC2)C1	ZINC000819475909	GF	On-Demand	Anodyne	FPR2	26	50
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819475912	EG	On-Demand	Anodyne	ADRB2	23	59
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc2[nH]ccc12	ZINC000819475912	EG	On-Demand	Anodyne	ADRB1	26	59
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819475913	EG	On-Demand	Anodyne	ADRB2	23	59
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000819475913	EG	On-Demand	Anodyne	ADRB1	26	59
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819475970	FG	On-Demand	Anodyne	ADRB2	26	51
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819475970	FG	On-Demand	Anodyne	ADRB1	46	51
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819475970	FG	On-Demand	Anodyne	G2YM83_BOTF4	21	40
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819475971	FG	On-Demand	Anodyne	ADRB2	26	51
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819475971	FG	On-Demand	Anodyne	ADRB1	46	51
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819475971	FG	On-Demand	Anodyne	G2YM83_BOTF4	21	40
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccccc1F	ZINC000819475988	DF	On-Demand	Anodyne	ADRB2	27	43
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccccc1F	ZINC000819475988	DF	On-Demand	Anodyne	ADRB1	59	40
CCOc1cc(O)ccc1NC[C@H](O)COc1ccccc1F	ZINC000819475989	DF	On-Demand	Anodyne	ADRB2	27	43
CCOc1cc(O)ccc1NC[C@H](O)COc1ccccc1F	ZINC000819475989	DF	On-Demand	Anodyne	ADRB1	59	40
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1cccc2c1OC(C)(C)C2	ZINC000819475990	FF	On-Demand	Anodyne	G2YM83_BOTF4	30	42
CCOc1cc(O)ccc1NC[C@@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000819475991	FH	On-Demand	Anodyne	PPARD	28	41
CCOc1cc(O)ccc1NC[C@H](O)Cc1ccc(C(F)(F)F)cc1	ZINC000819475992	FH	On-Demand	Anodyne	PPARD	28	41
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCCC(=O)NC)C1	ZINC000819476010	FF	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCCC(=O)NC)C1	ZINC000819476011	FF	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cccc(CS(N)(=O)=O)c2)C1	ZINC000819476012	IF	On-Demand	Anodyne	FPR2	27	52
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cccc(CS(N)(=O)=O)c2)C1	ZINC000819476013	IF	On-Demand	Anodyne	FPR2	27	52
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1	ZINC000819476015	II	On-Demand	Bother	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccn(-c3ccccc3[N+](=O)[O-])n2)C1	ZINC000819476016	II	On-Demand	Bother	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H]2CCC(=O)c3ccccc32)C1	ZINC000819476018	HJ	On-Demand	Anodyne	FPR2	25	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H]2CCC(=O)c3ccccc32)C1	ZINC000819476019	HJ	On-Demand	Anodyne	FPR2	25	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H]2CCC(=O)c3ccccc32)C1	ZINC000819476020	HJ	On-Demand	Anodyne	FPR2	25	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H]2CCC(=O)c3ccccc32)C1	ZINC000819476021	HJ	On-Demand	Anodyne	FPR2	25	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2(c3ccccc3)CCOCC2)C1	ZINC000819476022	HJ	On-Demand	Anodyne	CCR5	15	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2(c3ccccc3)CCOCC2)C1	ZINC000819476022	HJ	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2(c3ccccc3)CCOCC2)C1	ZINC000819476023	HJ	On-Demand	Anodyne	CCR5	15	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2(c3ccccc3)CCOCC2)C1	ZINC000819476023	HJ	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CN2C(=O)NC(CC)(CC)C2=O)C1	ZINC000819476025	IF	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CN2C(=O)NC(CC)(CC)C2=O)C1	ZINC000819476026	IF	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cccc(OCCCOC)c2)C1	ZINC000819476027	HI	On-Demand	Anodyne	FPR2	28	53
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cccc(OCCCOC)c2)C1	ZINC000819476028	HI	On-Demand	Anodyne	FPR2	28	53
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2(COC)CCC2)C1	ZINC000819476031	FH	On-Demand	Anodyne	CCR5	15	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2(COC)CCC2)C1	ZINC000819476031	FH	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2(COC)CCC2)C1	ZINC000819476032	FH	On-Demand	Anodyne	CCR5	15	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2(COC)CCC2)C1	ZINC000819476032	FH	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cc2cccc(C(=O)OC)c2)C1	ZINC000819476033	HH	On-Demand	Anodyne	HDAC6	15	43
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cc2cccc(C(=O)OC)c2)C1	ZINC000819476033	HH	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cc2cccc(C(=O)OC)c2)C1	ZINC000819476034	HH	On-Demand	Anodyne	HDAC6	15	43
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cc2cccc(C(=O)OC)c2)C1	ZINC000819476034	HH	On-Demand	Anodyne	FPR2	27	50
CCc1noc2ncc(C(=O)N3CCC[C@H](n4c(CC)nc5ccccc54)C3)cc12	ZINC000819476035	HI	On-Demand	Anodyne	FPR2	26	49
CCc1noc2ncc(C(=O)N3CCC[C@@H](n4c(CC)nc5ccccc54)C3)cc12	ZINC000819476036	HI	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ncccc2C)C1	ZINC000819476037	EH	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ncccc2C)C1	ZINC000819476038	EH	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C\c2ccncn2)C1	ZINC000819476040	FG	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C/c2ccncn2)C1	ZINC000819476041	FG	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C\c2ccncn2)C1	ZINC000819476042	FG	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C/c2ccncn2)C1	ZINC000819476043	FG	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H](O)Cc2ccccc2)C1	ZINC000819476044	GG	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H](O)Cc2ccccc2)C1	ZINC000819476045	GG	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCn2ccnc2)C1	ZINC000819476046	FG	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCn2ccnc2)C1	ZINC000819476047	FG	On-Demand	Anodyne	FPR2	25	46
COc1cc(Br)ccc1C(=O)Nc1cn2cc(Br)ncc2n1	ZINC000819476048	IH	On-Demand	Anodyne	MAP3K5	62	43
COc1cc(Br)ccc1C(=O)Nc1cn2cc(Br)ncc2n1	ZINC000819476048	IH	On-Demand	Anodyne	LUCI_LUCLA	17	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cnn(C3CCOCC3)c2C)C1	ZINC000819476049	HH	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cnn(C3CCOCC3)c2C)C1	ZINC000819476050	HH	On-Demand	Anodyne	FPR2	26	48
NS(=O)(=O)c1ccc(C(=O)Nc2cn3cc(Br)ncc3n2)cc1	ZINC000819476051	GD	On-Demand	Anodyne	CA2	54	46
NS(=O)(=O)c1ccc(C(=O)Nc2cn3cc(Br)ncc3n2)cc1	ZINC000819476051	GD	On-Demand	Anodyne	CA1	36	46
NS(=O)(=O)c1ccc(C(=O)Nc2cn3cc(Br)ncc3n2)cc1	ZINC000819476051	GD	On-Demand	Anodyne	CA4	28	46
NS(=O)(=O)c1ccc(C(=O)Nc2cn3cc(Br)ncc3n2)cc1	ZINC000819476051	GD	On-Demand	Anodyne	CA9	34	41
NS(=O)(=O)c1ccc(C(=O)Nc2cn3cc(Br)ncc3n2)cc1	ZINC000819476051	GD	On-Demand	Anodyne	MAP3K5	75	48
NS(=O)(=O)c1ccc(C(=O)Nc2cn3cc(Br)ncc3n2)cc1	ZINC000819476051	GD	On-Demand	Anodyne	CYNT	30	41
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2csc(S(C)(=O)=O)c2)C1	ZINC000819476053	HH	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2csc(S(C)(=O)=O)c2)C1	ZINC000819476054	HH	On-Demand	Anodyne	FPR2	28	52
NC(=O)c1ccc(OCCC(=O)Nc2cn3cc(Br)ncc3n2)cc1	ZINC000819476055	HD	On-Demand	Anodyne	MAP3K5	45	36
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)C1	ZINC000819476056	GJ	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cnn(CCC(F)(F)F)c2)C1	ZINC000819476057	HI	On-Demand	Anodyne	FPR2	25	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cnn(CCC(F)(F)F)c2)C1	ZINC000819476058	HI	On-Demand	Anodyne	FPR2	25	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cn(CCOC)c3ccccc23)C1	ZINC000819476059	IJ	On-Demand	Anodyne	CNR1	21	45
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cn(CCOC)c3ccccc23)C1	ZINC000819476059	IJ	On-Demand	Anodyne	CNR2	24	45
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cn(CCOC)c3ccccc23)C1	ZINC000819476059	IJ	On-Demand	Anodyne	TPSAB1	19	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cn(CCOC)c3ccccc23)C1	ZINC000819476059	IJ	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cn(CCOC)c3ccccc23)C1	ZINC000819476060	IJ	On-Demand	Anodyne	CNR1	21	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cn(CCOC)c3ccccc23)C1	ZINC000819476060	IJ	On-Demand	Anodyne	CNR2	24	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cn(CCOC)c3ccccc23)C1	ZINC000819476060	IJ	On-Demand	Anodyne	TPSAB1	19	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cn(CCOC)c3ccccc23)C1	ZINC000819476060	IJ	On-Demand	Anodyne	FPR2	27	49
COC[C@@H](C)Oc1ccc(Cl)cc1NC[C@@H](O)COc1ccccc1	ZINC000819476069	FH	On-Demand	Anodyne	ADRB2	36	46
COC[C@@H](C)Oc1ccc(Cl)cc1NC[C@@H](O)COc1ccccc1	ZINC000819476069	FH	On-Demand	Anodyne	ADRB1	44	39
COC[C@@H](C)Oc1ccc(Cl)cc1NC[C@H](O)COc1ccccc1	ZINC000819476072	FH	On-Demand	Anodyne	ADRB2	36	46
COC[C@@H](C)Oc1ccc(Cl)cc1NC[C@H](O)COc1ccccc1	ZINC000819476072	FH	On-Demand	Anodyne	ADRB1	44	39
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819476081	FH	On-Demand	Anodyne	ADRB2	22	40
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819476081	FH	On-Demand	Anodyne	PDS	64	44
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819476083	FH	On-Demand	Anodyne	ADRB2	22	40
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000819476083	FH	On-Demand	Anodyne	PDS	64	44
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCCNC(=O)C(C)(C)C)C1	ZINC000819476084	GH	On-Demand	Anodyne	FPR2	25	46
CCOc1ccc(OC[C@@H](O)CNc2ccc(O)cc2OCC)cc1	ZINC000819476085	EG	On-Demand	Anodyne	ADRB2	44	45
CCOc1ccc(OC[C@@H](O)CNc2ccc(O)cc2OCC)cc1	ZINC000819476085	EG	On-Demand	Anodyne	ADRB1	57	45
CCOc1ccc(OC[C@@H](O)CNc2ccc(O)cc2OCC)cc1	ZINC000819476085	EG	On-Demand	Anodyne	ADRB3	33	45
CCOc1ccc(OC[C@H](O)CNc2ccc(O)cc2OCC)cc1	ZINC000819476086	EG	On-Demand	Anodyne	ADRB2	44	45
CCOc1ccc(OC[C@H](O)CNc2ccc(O)cc2OCC)cc1	ZINC000819476086	EG	On-Demand	Anodyne	ADRB1	57	45
CCOc1ccc(OC[C@H](O)CNc2ccc(O)cc2OCC)cc1	ZINC000819476086	EG	On-Demand	Anodyne	ADRB3	33	45
O=S(=O)(CCNc1ccc2c(c1)CCC[C@H]2O)c1ccc(F)cc1	ZINC000819476087	EG	On-Demand	Anodyne	HTR6	48	39
O=S(=O)(CCNc1ccc2c(c1)CCC[C@@H]2O)c1ccc(F)cc1	ZINC000819476088	EG	On-Demand	Anodyne	HTR6	48	39
CCOc1cc(O)ccc1NC[C@H](O)COc1cc(C)ccc1C	ZINC000819476096	EG	On-Demand	Anodyne	ADRB2	25	45
CCOc1cc(O)ccc1NC[C@@H](O)COc1cc(C)ccc1C	ZINC000819476098	EG	On-Demand	Anodyne	ADRB2	25	45
CON(C)C(=O)CCNc1cc(-n2cccn2)ccc1C	ZINC000819476102	CE	On-Demand	Anodyne	AMP1_PLAFQ	52	37
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCCNC(=O)C(C)(C)C)C1	ZINC000819476106	GH	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(F)c(SC)c2)C1	ZINC000819476109	GJ	On-Demand	Anodyne	FPR2	28	51
CCOc1cc(O)ccc1NC[C@H](O)COc1cc(C)ccc1Cl	ZINC000819476111	FH	On-Demand	Anodyne	ADRB2	17	44
CCOc1cc(O)ccc1NC[C@@H](O)COc1cc(C)ccc1Cl	ZINC000819476113	FH	On-Demand	Anodyne	ADRB2	17	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(F)c(SC)c2)C1	ZINC000819476114	GJ	On-Demand	Anodyne	FPR2	28	51
CCOc1cc(O)ccc1NC[C@H](O)CN1CCN(C)CC1	ZINC000819476115	DC	On-Demand	Anodyne	CCR1	40	41
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cn(C)nc2C2CCCCC2)C1	ZINC000819476117	HJ	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cn(C)nc2C2CCCCC2)C1	ZINC000819476119	HJ	On-Demand	Anodyne	FPR2	26	49
CCOc1cc(O)ccc1NC[C@@H](O)CN1CCN(C)CC1	ZINC000819476120	DC	On-Demand	Anodyne	CCR1	40	41
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CNC(=O)c2cccnc2)C1	ZINC000819476124	GF	On-Demand	Anodyne	PREP	21	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CNC(=O)c2cccnc2)C1	ZINC000819476124	GF	On-Demand	Anodyne	FPR2	24	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CNC(=O)c2cccnc2)C1	ZINC000819476128	GF	On-Demand	Anodyne	PREP	21	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CNC(=O)c2cccnc2)C1	ZINC000819476128	GF	On-Demand	Anodyne	FPR2	24	44
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc(Br)c1	ZINC000819476139	GG	On-Demand	Anodyne	ADRB2	27	42
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc(Br)c1	ZINC000819476139	GG	On-Demand	Anodyne	ADRB1	27	40
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc(Br)c1	ZINC000819476139	GG	On-Demand	Anodyne	PDS	45	41
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc(Br)c1	ZINC000819476141	GG	On-Demand	Anodyne	ADRB2	27	42
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc(Br)c1	ZINC000819476141	GG	On-Demand	Anodyne	ADRB1	27	40
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc(Br)c1	ZINC000819476141	GG	On-Demand	Anodyne	PDS	45	41
CCOc1cc(O)ccc1NCC1(O)CCS(=O)(=O)CC1	ZINC000819476164	DD	On-Demand	Anodyne	HCN1	44	33
CCOc1cc(O)ccc1NCC1(O)CCS(=O)(=O)CC1	ZINC000819476164	DD	On-Demand	Anodyne	HCN4	41	31
CN(C[C@@H](O)CNc1cccc2c1OC(C)(C)C2)C1CC1	ZINC000819476167	CE	On-Demand	Anodyne	G2YM83_BOTF4	21	41
CN(C[C@H](O)CNc1cccc2c1OC(C)(C)C2)C1CC1	ZINC000819476169	CE	On-Demand	Anodyne	G2YM83_BOTF4	21	41
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819476176	FF	On-Demand	Anodyne	ADRB2	44	56
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819476176	FF	On-Demand	Anodyne	ADRB1	75	56
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819476176	FF	On-Demand	Anodyne	TSHR	41	32
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819476176	FF	On-Demand	Anodyne	ADRB3	49	56
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819476178	FF	On-Demand	Anodyne	ADRB2	44	56
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819476178	FF	On-Demand	Anodyne	ADRB1	75	56
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819476178	FF	On-Demand	Anodyne	TSHR	41	32
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819476178	FF	On-Demand	Anodyne	ADRB3	49	56
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2c(F)cccc2SC)C1	ZINC000819476179	GJ	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2c(F)cccc2SC)C1	ZINC000819476182	GJ	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cccc(O)n2)C1	ZINC000819476193	FG	On-Demand	Anodyne	FPR2	29	55
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cccc(O)n2)C1	ZINC000819476195	FG	On-Demand	Anodyne	FPR2	29	55
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2c(C)cccc2[N+](=O)[O-])C1	ZINC000819476198	GI	On-Demand	Bother	CCR5	15	40
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2c(C)cccc2[N+](=O)[O-])C1	ZINC000819476198	GI	On-Demand	Bother	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2c(C)cccc2[N+](=O)[O-])C1	ZINC000819476200	GI	On-Demand	Bother	CCR5	15	40
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2c(C)cccc2[N+](=O)[O-])C1	ZINC000819476200	GI	On-Demand	Bother	FPR2	26	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cnc3c(c2)c(O)nc(=O)n3C)C1	ZINC000819476203	IE	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cnc3c(c2)c(O)nc(=O)n3C)C1	ZINC000819476206	IE	On-Demand	Anodyne	FPR2	26	47
NC(=O)c1ccc(OCC(=O)Nc2cn3cc(Br)ncc3n2)cc1	ZINC000819476209	GD	On-Demand	Anodyne	MAP3K5	55	37
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H]2CCO[C@H](C)C2)C1	ZINC000819476210	FH	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H]2CCO[C@@H](C)C2)C1	ZINC000819476213	FH	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H]2CCO[C@H](C)C2)C1	ZINC000819476217	FH	On-Demand	Anodyne	FPR2	26	47
CCOc1cc(O)ccc1NC[C@H](O)COc1ccccc1C	ZINC000819476218	DF	On-Demand	Anodyne	ADRB2	32	55
CCOc1cc(O)ccc1NC[C@H](O)COc1ccccc1C	ZINC000819476218	DF	On-Demand	Anodyne	ADRB1	52	33
CCOc1cc(O)ccc1NC[C@H](O)COc1ccccc1C	ZINC000819476218	DF	On-Demand	Anodyne	CYP2D6	16	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H]2CCO[C@@H](C)C2)C1	ZINC000819476220	FH	On-Demand	Anodyne	FPR2	26	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2c(C)nn(CCCl)c2C)C1	ZINC000819476222	HI	On-Demand	Reactive	FPR2	26	50
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccccc1C	ZINC000819476223	DF	On-Demand	Anodyne	ADRB2	32	55
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccccc1C	ZINC000819476223	DF	On-Demand	Anodyne	ADRB1	52	33
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccccc1C	ZINC000819476223	DF	On-Demand	Anodyne	CYP2D6	16	44
C=C(Cl)CSc1nc(C)c(CC(=O)N[C@H](C)c2ncc(C)o2)s1	ZINC000819476228	FI	On-Demand	Mild	UL26	44	33
C=C(Cl)CSc1nc(C)c(CC(=O)N[C@@H](C)c2ncc(C)o2)s1	ZINC000819476232	FI	On-Demand	Mild	UL26	44	33
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2c(C)nn(CCCl)c2C)C1	ZINC000819476239	HI	On-Demand	Reactive	FPR2	26	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2c[nH]nc2-c2ccsc2)C1	ZINC000819476243	HJ	On-Demand	Anodyne	FPR2	26	48
O[C@H](CNc1ccc2c(c1)CCC[C@@H]2O)c1cccnc1	ZINC000819476245	CF	On-Demand	Anodyne	ADRB3	84	42
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)c1cccnc1	ZINC000819476247	CF	On-Demand	Anodyne	ADRB3	84	42
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2c[nH]nc2-c2ccsc2)C1	ZINC000819476249	HJ	On-Demand	Anodyne	FPR2	26	48
O[C@H]1CCCc2cc(NC[C@H](O)c3cccnc3)ccc21	ZINC000819476250	CF	On-Demand	Anodyne	ADRB3	84	42
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)c1cccnc1	ZINC000819476252	CF	On-Demand	Anodyne	ADRB3	84	42
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCCc2nccs2)C1	ZINC000819476253	GI	On-Demand	Anodyne	FPR2	24	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCCc2nccs2)C1	ZINC000819476257	GI	On-Demand	Anodyne	FPR2	24	45
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2nn(-c3ccccc3)cc2C)C1	ZINC000819476264	HJ	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2nn(-c3ccccc3)cc2C)C1	ZINC000819476269	HJ	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCC(C)=O)C1	ZINC000819476283	EG	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCC(C)=O)C1	ZINC000819476286	EG	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2sc3nccn3c2C)C1	ZINC000819476298	GI	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2sc3nccn3c2C)C1	ZINC000819476303	GI	On-Demand	Anodyne	FPR2	28	51
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819476321	GF	On-Demand	Anodyne	DRD4	22	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819476321	GF	On-Demand	Anodyne	SIGMAR1	30	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819476322	GF	On-Demand	Anodyne	DRD4	22	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819476322	GF	On-Demand	Anodyne	SIGMAR1	30	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819476323	GF	On-Demand	Anodyne	DRD4	22	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](C)[C@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819476323	GF	On-Demand	Anodyne	SIGMAR1	30	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819476324	GF	On-Demand	Anodyne	DRD4	22	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](C)[C@@H]1CCN(Cc3ccccc3)C1)C2	ZINC000819476324	GF	On-Demand	Anodyne	SIGMAR1	30	43
COC[C@@H](C)Oc1ccc(Cl)cc1NC[C@@H](O)c1ccccc1	ZINC000819476331	EH	On-Demand	Anodyne	ADRB3	41	36
COC[C@@H](C)Oc1ccc(Cl)cc1NC[C@H](O)c1ccccc1	ZINC000819476332	EH	On-Demand	Anodyne	ADRB3	41	36
CCOc1cc(O)ccc1NC[C@H](O)COc1ccccc1	ZINC000819476349	DF	On-Demand	Anodyne	ADRB2	56	49
CCOc1cc(O)ccc1NC[C@H](O)COc1ccccc1	ZINC000819476349	DF	On-Demand	Anodyne	ADRB1	72	41
CCOc1cc(O)ccc1NC[C@H](O)COc1ccccc1	ZINC000819476349	DF	On-Demand	Anodyne	ADRB3	46	41
CCOc1cc(O)ccc1NC[C@H](O)COc1ccccc1	ZINC000819476349	DF	On-Demand	Anodyne	PDS	57	36
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccccc1	ZINC000819476350	DF	On-Demand	Anodyne	ADRB2	56	49
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccccc1	ZINC000819476350	DF	On-Demand	Anodyne	ADRB1	72	41
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccccc1	ZINC000819476350	DF	On-Demand	Anodyne	ADRB3	46	41
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccccc1	ZINC000819476350	DF	On-Demand	Anodyne	PDS	57	36
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819476353	EF	On-Demand	Anodyne	ADRB2	32	44
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819476353	EF	On-Demand	Anodyne	ADRB1	40	39
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819476353	EF	On-Demand	Anodyne	ABCB1	17	43
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819476353	EF	On-Demand	Anodyne	PDS	42	38
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819476354	EF	On-Demand	Anodyne	ADRB2	32	44
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819476354	EF	On-Demand	Anodyne	ADRB1	40	39
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819476354	EF	On-Demand	Anodyne	ABCB1	17	43
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819476354	EF	On-Demand	Anodyne	PDS	42	38
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(Cl)cc1	ZINC000819476355	EG	On-Demand	Anodyne	ADRB2	35	42
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(Cl)cc1	ZINC000819476355	EG	On-Demand	Anodyne	ADRB1	48	44
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(Cl)cc1	ZINC000819476355	EG	On-Demand	Anodyne	ADRB3	30	42
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819476356	EG	On-Demand	Anodyne	ADRB2	35	42
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819476356	EG	On-Demand	Anodyne	ADRB1	48	44
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000819476356	EG	On-Demand	Anodyne	ADRB3	30	42
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1COc2ccccc2C1	ZINC000819476366	FE	On-Demand	Anodyne	ROCK2	38	52
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C(C)(C)NS(C)(=O)=O)C1	ZINC000819476367	GE	On-Demand	Anodyne	FPR2	26	49
COCCNC(=O)c1ccccc1NC(=O)[C@H]1COc2ccccc2C1	ZINC000819476368	FE	On-Demand	Anodyne	ROCK2	38	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C(C)(C)NS(C)(=O)=O)C1	ZINC000819476369	GE	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cc2ccncc2C)C1	ZINC000819476375	FH	On-Demand	Anodyne	FPR2	25	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cc2ccncc2C)C1	ZINC000819476377	FH	On-Demand	Anodyne	FPR2	25	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CN2C(=O)c3ccc(C)cc3C2=O)C1	ZINC000819476388	IG	On-Demand	Anodyne	FPR2	25	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CN2C(=O)c3ccc(C)cc3C2=O)C1	ZINC000819476391	IG	On-Demand	Anodyne	FPR2	25	47
CN(C[C@@H](O)CNc1cccc2c1OC(C)(C)C2)C(=O)OC(C)(C)C	ZINC000819476402	FG	On-Demand	Anodyne	G2YM83_BOTF4	29	41
CN(C[C@H](O)CNc1cccc2c1OC(C)(C)C2)C(=O)OC(C)(C)C	ZINC000819476403	FG	On-Demand	Anodyne	G2YM83_BOTF4	29	41
CCOc1cc(O)ccc1NCC1(O)CCCC1	ZINC000819476404	CF	On-Demand	Anodyne	HCN1	43	33
CCOc1cc(O)ccc1NCC1(O)CCCC1	ZINC000819476404	CF	On-Demand	Anodyne	HCN4	43	33
CCOc1cc(O)ccc1NC[C@H](O)COc1c(C)cccc1C	ZINC000819476407	EG	On-Demand	Anodyne	ADRB2	24	43
CCOc1cc(O)ccc1NC[C@@H](O)COc1c(C)cccc1C	ZINC000819476408	EG	On-Demand	Anodyne	ADRB2	24	43
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C/c2ccc(Cl)nc2)C1	ZINC000819476414	GJ	On-Demand	Anodyne	HDAC6	17	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C/c2ccc(Cl)nc2)C1	ZINC000819476414	GJ	On-Demand	Anodyne	FPR2	25	45
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C/c2ccc(Cl)nc2)C1	ZINC000819476417	GJ	On-Demand	Anodyne	HDAC6	17	44
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C/c2ccc(Cl)nc2)C1	ZINC000819476417	GJ	On-Demand	Anodyne	FPR2	25	45
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C\c2ccc(Cl)nc2)C1	ZINC000819476420	GJ	On-Demand	Anodyne	HDAC6	17	44
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)/C=C\c2ccc(Cl)nc2)C1	ZINC000819476420	GJ	On-Demand	Anodyne	FPR2	25	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C\c2ccc(Cl)nc2)C1	ZINC000819476423	GJ	On-Demand	Anodyne	HDAC6	17	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)/C=C\c2ccc(Cl)nc2)C1	ZINC000819476423	GJ	On-Demand	Anodyne	FPR2	25	45
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccnn2CC(F)F)C1	ZINC000819476425	GH	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccnn2CC(F)F)C1	ZINC000819476427	GH	On-Demand	Anodyne	FPR2	27	50
O=C(CSc1ccc(Cl)cc1)Nc1cn2cc(Br)ncc2n1	ZINC000819476434	GH	On-Demand	Anodyne	MAP3K5	41	41
O=C(CSc1ccc(Cl)cc1)Nc1cn2cc(Br)ncc2n1	ZINC000819476434	GH	On-Demand	Anodyne	FAS	39	40
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(SC)cc1	ZINC000819476436	EG	On-Demand	Anodyne	ADRB2	29	40
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(SC)cc1	ZINC000819476436	EG	On-Demand	Anodyne	ADRB1	37	40
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(SC)cc1	ZINC000819476436	EG	On-Demand	Anodyne	ADRB3	23	40
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819476437	EG	On-Demand	Anodyne	ADRB2	29	40
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819476437	EG	On-Demand	Anodyne	ADRB1	37	40
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(SC)cc1	ZINC000819476437	EG	On-Demand	Anodyne	ADRB3	23	40
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H](C)c2ccc(C(=O)C(C)C)cc2)C1	ZINC000819476441	IK	On-Demand	Anodyne	FPR2	25	46
CC(C)(O)CNc1cccc2c1OC(C)(C)C2	ZINC000819476443	BF	On-Demand	Anodyne	G2YM83_BOTF4	31	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H](C)c2ccc(C(=O)C(C)C)cc2)C1	ZINC000819476445	IK	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H](C)c2ccc(C(=O)C(C)C)cc2)C1	ZINC000819476447	IK	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H](C)c2ccc(C(=O)C(C)C)cc2)C1	ZINC000819476449	IK	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CS(=O)(=O)N(CC)CC)C1	ZINC000819476451	HE	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CS(=O)(=O)N(CC)CC)C1	ZINC000819476460	HE	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CSCC(F)(F)F)C1	ZINC000819476462	GI	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CSCC(F)(F)F)C1	ZINC000819476465	GI	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCCc2nc(C)cs2)C1	ZINC000819476471	GJ	On-Demand	Anodyne	FPR2	24	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCCc2nc(C)cs2)C1	ZINC000819476473	GJ	On-Demand	Anodyne	FPR2	24	44
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)C1	ZINC000819476475	IH	On-Demand	Bother	FPR2	24	45
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)C1	ZINC000819476478	IH	On-Demand	Bother	FPR2	24	45
O=C(CN1CCN(Cc2ccccc2)CC1)Nc1cn2cc(Br)ncc2n1	ZINC000819476479	IE	On-Demand	Anodyne	DRD4	35	41
O=C(CN1CCN(Cc2ccccc2)CC1)Nc1cn2cc(Br)ncc2n1	ZINC000819476479	IE	On-Demand	Anodyne	ACHE	15	43
O=C(CN1CCN(Cc2ccccc2)CC1)Nc1cn2cc(Br)ncc2n1	ZINC000819476479	IE	On-Demand	Anodyne	SIGMAR1	28	40
O=C(CN1CCN(Cc2ccccc2)CC1)Nc1cn2cc(Br)ncc2n1	ZINC000819476479	IE	On-Demand	Anodyne	FAAH	25	40
CCO/C=C(/C#N)C(=O)N1CCC[C@H](n2c(CC)nc3ccccc32)C1	ZINC000819476480	FG	On-Demand	Reactive	FPR2	25	46
CCO/C=C(\C#N)C(=O)N1CCC[C@H](n2c(CC)nc3ccccc32)C1	ZINC000819476481	FG	On-Demand	Reactive	FPR2	25	46
CCO/C=C(\C#N)C(=O)N1CCC[C@@H](n2c(CC)nc3ccccc32)C1	ZINC000819476482	FG	On-Demand	Reactive	FPR2	25	46
CCO/C=C(/C#N)C(=O)N1CCC[C@@H](n2c(CC)nc3ccccc32)C1	ZINC000819476483	FG	On-Demand	Reactive	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)C1	ZINC000819476484	II	On-Demand	Anodyne	CA13	18	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)C1	ZINC000819476484	II	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)C1	ZINC000819476485	II	On-Demand	Anodyne	CA13	18	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(Cl)c(S(C)(=O)=O)c2)C1	ZINC000819476485	II	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCc2cccc(OC(C)(C)C)n2)C1	ZINC000819476486	IJ	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCc2cccc(OC(C)(C)C)n2)C1	ZINC000819476487	IJ	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2(CC)CCCC2)C1	ZINC000819476491	FJ	On-Demand	Anodyne	OPRL1	16	40
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2(CC)CCCC2)C1	ZINC000819476491	FJ	On-Demand	Anodyne	CCR5	15	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2(CC)CCCC2)C1	ZINC000819476491	FJ	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2(CC)CCCC2)C1	ZINC000819476492	FJ	On-Demand	Anodyne	OPRL1	16	40
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2(CC)CCCC2)C1	ZINC000819476492	FJ	On-Demand	Anodyne	CCR5	15	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2(CC)CCCC2)C1	ZINC000819476492	FJ	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(N3CCOCC3)ccn2)C1	ZINC000819476496	HG	On-Demand	Anodyne	PIK3CD	33	40
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(N3CCOCC3)ccn2)C1	ZINC000819476496	HG	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(N3CCOCC3)ccn2)C1	ZINC000819476497	HG	On-Demand	Anodyne	PIK3CD	33	40
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(N3CCOCC3)ccn2)C1	ZINC000819476497	HG	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccn(-c3ccc(F)cc3F)n2)C1	ZINC000819476499	IJ	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccn(-c3ccc(F)cc3F)n2)C1	ZINC000819476500	IJ	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C2(OCc3ccccc3)CCOCC2)C1	ZINC000819476501	IJ	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C2(OCc3ccccc3)CCOCC2)C1	ZINC000819476502	IJ	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCN/C(O)=C2/N=CC=CC2=O)C1	ZINC000819476503	HF	On-Demand	Mild	FPR2	23	43
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCN/C(O)=C2/N=CC=CC2=O)C1	ZINC000819476504	HF	On-Demand	Mild	FPR2	23	43
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCN/C(O)=C2\N=CC=CC2=O)C1	ZINC000819476505	HF	On-Demand	Mild	FPR2	23	43
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCN/C(O)=C2\N=CC=CC2=O)C1	ZINC000819476506	HF	On-Demand	Mild	FPR2	23	43
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])c3nsnc3c2)C1	ZINC000819476507	IH	On-Demand	Bother	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])c3nsnc3c2)C1	ZINC000819476508	IH	On-Demand	Bother	FPR2	26	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2coc(S(N)(=O)=O)c2)C1	ZINC000819476512	HE	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2coc(S(N)(=O)=O)c2)C1	ZINC000819476513	HE	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cccc(CN3C(=O)CNC3=O)c2)C1	ZINC000819476514	IG	On-Demand	Anodyne	FPR2	26	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cccc(CN3C(=O)CNC3=O)c2)C1	ZINC000819476515	IG	On-Demand	Anodyne	FPR2	26	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(F)cc3nccnc23)C1	ZINC000819476516	HI	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(F)cc3nccnc23)C1	ZINC000819476517	HI	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cncc(-n3ccnn3)c2)C1	ZINC000819476518	HG	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cncc(-n3ccnn3)c2)C1	ZINC000819476519	HG	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C=C(C2CC2)C2CC2)C1	ZINC000819476521	FJ	On-Demand	Anodyne	FPR2	29	53
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C=C(C2CC2)C2CC2)C1	ZINC000819476522	FJ	On-Demand	Anodyne	FPR2	29	53
CCOc1nc2ccc(C(=O)Nc3cn4cc(Br)ncc4n3)cc2[nH]1	ZINC000819476524	HG	On-Demand	Anodyne	MAP3K5	67	41
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cc2ccncc2)C1	ZINC000819476525	EG	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cc2ccncc2)C1	ZINC000819476526	EG	On-Demand	Anodyne	FPR2	27	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2nnn(CC3CCCC3)c2C)C1	ZINC000819476527	HI	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2nnn(CC3CCCC3)c2C)C1	ZINC000819476528	HI	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(NC(C)=O)ccc2O)C1	ZINC000819476529	HH	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(NC(C)=O)ccc2O)C1	ZINC000819476530	HH	On-Demand	Anodyne	FPR2	28	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C(=O)NCCCc2ccccc2)C1	ZINC000819476531	HH	On-Demand	Anodyne	FKBP1A	28	42
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C(=O)NCCCc2ccccc2)C1	ZINC000819476531	HH	On-Demand	Anodyne	PREP	48	37
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C(=O)NCCCc2ccccc2)C1	ZINC000819476531	HH	On-Demand	Anodyne	FPR2	25	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C(=O)NCCCc2ccccc2)C1	ZINC000819476532	HH	On-Demand	Anodyne	FKBP1A	28	42
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C(=O)NCCCc2ccccc2)C1	ZINC000819476532	HH	On-Demand	Anodyne	PREP	48	37
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C(=O)NCCCc2ccccc2)C1	ZINC000819476532	HH	On-Demand	Anodyne	FPR2	25	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cn2cc(C(=O)OC)nn2)C1	ZINC000819476534	GD	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cn2cc(C(=O)OC)nn2)C1	ZINC000819476535	GD	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCCc2ccc(F)c(F)c2)C1	ZINC000819476536	HK	On-Demand	Anodyne	PREP	49	39
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCCc2ccc(F)c(F)c2)C1	ZINC000819476536	HK	On-Demand	Anodyne	FPR2	26	51
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819476581	GG	On-Demand	Anodyne	ADRB2	24	50
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819476581	GG	On-Demand	Anodyne	ADRB1	57	50
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819476581	GG	On-Demand	Anodyne	ADRB3	33	44
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819476582	GG	On-Demand	Anodyne	ADRB2	24	50
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819476582	GG	On-Demand	Anodyne	ADRB1	57	50
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819476582	GG	On-Demand	Anodyne	ADRB3	33	44
N#CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819476585	FF	On-Demand	Mild	ADRB1	45	39
N#CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819476586	FF	On-Demand	Mild	ADRB1	45	39
N#CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819476587	FF	On-Demand	Mild	ADRB1	45	39
N#CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819476588	FF	On-Demand	Mild	ADRB1	45	39
O=C(CCNc1ccc2c(c1)CCC[C@H]2O)Nc1ccccc1	ZINC000819476595	DG	On-Demand	Anodyne	PTPRF	40	31
O=C(CCNc1ccc2c(c1)CCC[C@@H]2O)Nc1ccccc1	ZINC000819476596	DG	On-Demand	Anodyne	PTPRF	40	31
CCOc1cc(O)ccc1NC[C@H](O)COCc1ccc(OC)cc1	ZINC000819476629	EF	On-Demand	Anodyne	ADRB2	26	43
CCOc1cc(O)ccc1NC[C@H](O)COCc1ccc(OC)cc1	ZINC000819476629	EF	On-Demand	Anodyne	ADRB1	28	43
CCOc1cc(O)ccc1NC[C@H](O)COCc1ccc(OC)cc1	ZINC000819476629	EF	On-Demand	Anodyne	ADRB3	23	45
CCOc1cc(O)ccc1NC[C@@H](O)COCc1ccc(OC)cc1	ZINC000819476632	EF	On-Demand	Anodyne	ADRB2	26	43
CCOc1cc(O)ccc1NC[C@@H](O)COCc1ccc(OC)cc1	ZINC000819476632	EF	On-Demand	Anodyne	ADRB1	28	43
CCOc1cc(O)ccc1NC[C@@H](O)COCc1ccc(OC)cc1	ZINC000819476632	EF	On-Demand	Anodyne	ADRB3	23	45
CCOC[C@H](O)CNc1cccc2c1OC(C)(C)C2	ZINC000819476642	CE	On-Demand	Anodyne	G2YM83_BOTF4	29	42
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819476654	GG	On-Demand	Anodyne	ADRB2	38	41
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819476654	GG	On-Demand	Anodyne	ADRB1	71	44
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819476654	GG	On-Demand	Anodyne	ADRB3	48	41
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819476656	GG	On-Demand	Anodyne	ADRB2	38	41
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819476656	GG	On-Demand	Anodyne	ADRB1	71	44
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819476656	GG	On-Demand	Anodyne	ADRB3	48	41
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819476658	GG	On-Demand	Anodyne	ADRB2	38	41
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819476658	GG	On-Demand	Anodyne	ADRB1	71	44
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819476658	GG	On-Demand	Anodyne	ADRB3	48	41
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819476659	GG	On-Demand	Anodyne	ADRB2	38	41
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819476659	GG	On-Demand	Anodyne	ADRB1	71	44
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819476659	GG	On-Demand	Anodyne	ADRB3	48	41
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)CC1	ZINC000819476666	GG	On-Demand	Anodyne	GPR119	39	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)CC1	ZINC000819476668	GG	On-Demand	Anodyne	GPR119	39	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)CC1	ZINC000819476670	GG	On-Demand	Anodyne	GPR119	39	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)CC1	ZINC000819476671	GG	On-Demand	Anodyne	GPR119	39	49
CCOc1cc(O)ccc1NC[C@H](O)c1ccccc1	ZINC000819476677	CF	On-Demand	Anodyne	ADRB2	28	40
CCOc1cc(O)ccc1NC[C@H](O)c1ccccc1	ZINC000819476677	CF	On-Demand	Anodyne	ADRB1	15	45
CCOc1cc(O)ccc1NC[C@H](O)c1ccccc1	ZINC000819476677	CF	On-Demand	Anodyne	ADRB3	38	45
CCOc1cc(O)ccc1NC[C@@H](O)c1ccccc1	ZINC000819476678	CF	On-Demand	Anodyne	ADRB2	28	40
CCOc1cc(O)ccc1NC[C@@H](O)c1ccccc1	ZINC000819476678	CF	On-Demand	Anodyne	ADRB1	15	45
CCOc1cc(O)ccc1NC[C@@H](O)c1ccccc1	ZINC000819476678	CF	On-Demand	Anodyne	ADRB3	38	45
CCOc1cc(O)ccc1NCC1(O)CCCCC1	ZINC000819476681	CF	On-Demand	Anodyne	HCN1	45	34
CCOc1cc(O)ccc1NCC1(O)CCCCC1	ZINC000819476681	CF	On-Demand	Anodyne	HCN4	45	34
CCOc1cc(O)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819476690	DF	On-Demand	Bother	CACNA1C	43	35
CCOc1cc(O)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819476690	DF	On-Demand	Bother	CACNA1D	69	34
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819476692	DF	On-Demand	Anodyne	ADRB2	40	50
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819476692	DF	On-Demand	Anodyne	ADRB1	49	43
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819476692	DF	On-Demand	Anodyne	ADRB3	29	43
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819476693	DF	On-Demand	Anodyne	ADRB2	40	50
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819476693	DF	On-Demand	Anodyne	ADRB1	49	43
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819476693	DF	On-Demand	Anodyne	ADRB3	29	43
C/C=C\c1ccc(OC[C@@H](O)CNc2ccc(O)cc2OCC)c(OC)c1	ZINC000819476697	FH	On-Demand	Anodyne	TUBB1	26	43
C/C=C/c1ccc(OC[C@H](O)CNc2ccc(O)cc2OCC)c(OC)c1	ZINC000819476698	FH	On-Demand	Anodyne	TUBB1	26	43
C/C=C\c1ccc(OC[C@H](O)CNc2ccc(O)cc2OCC)c(OC)c1	ZINC000819476699	FH	On-Demand	Anodyne	TUBB1	26	43
C/C=C/c1ccc(OC[C@@H](O)CNc2ccc(O)cc2OCC)c(OC)c1	ZINC000819476700	FH	On-Demand	Anodyne	TUBB1	26	43
CCOc1cc(O)ccc1NCC1(O)CCC1	ZINC000819476707	BE	On-Demand	Anodyne	HCN1	40	31
CCOc1cc(O)ccc1NCC1(O)CCC1	ZINC000819476707	BE	On-Demand	Anodyne	HCN4	41	31
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(C)cc1C	ZINC000819476708	EG	On-Demand	Anodyne	ADRB2	21	45
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(C)cc1C	ZINC000819476709	EG	On-Demand	Anodyne	ADRB2	21	45
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCCc2ccc(F)c(F)c2)C1	ZINC000819476737	HK	On-Demand	Anodyne	PREP	49	39
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCCc2ccc(F)c(F)c2)C1	ZINC000819476737	HK	On-Demand	Anodyne	FPR2	26	51
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(C(C)=O)o2)C1	ZINC000819476744	FH	On-Demand	Anodyne	FPR2	29	57
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(C(C)=O)o2)C1	ZINC000819476745	FH	On-Demand	Anodyne	FPR2	29	57
C[C@@](O)(CC(=O)Nc1cn2cc(Br)ncc2n1)c1ccccc1	ZINC000819476750	GF	On-Demand	Anodyne	MAP3K5	69	43
Cc1ccccc1[C@@H](CC(=O)Nc1cn2cc(Br)ncc2n1)NC(N)=O	ZINC000819476751	HF	On-Demand	Anodyne	CTSA	56	37
Cc1ccccc1[C@H](CC(=O)Nc1cn2cc(Br)ncc2n1)NC(N)=O	ZINC000819476752	HF	On-Demand	Anodyne	CTSA	56	37
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCC[C@@]2(C)NC(=O)NC2=O)C1	ZINC000819476753	HF	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCC[C@]2(C)NC(=O)NC2=O)C1	ZINC000819476754	HF	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCC[C@@]2(C)NC(=O)NC2=O)C1	ZINC000819476755	HF	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCC[C@]2(C)NC(=O)NC2=O)C1	ZINC000819476756	HF	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(C3CC3)no2)C1	ZINC000819476757	FH	On-Demand	Anodyne	FPR2	28	54
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(C3CC3)no2)C1	ZINC000819476758	FH	On-Demand	Anodyne	FPR2	28	54
CN(C)c1ncc(Br)cc1C(=O)Nc1cn2cc(Br)ncc2n1	ZINC000819476764	IF	On-Demand	Anodyne	MAP3K5	50	39
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccn(-c3ccc(F)cc3C)n2)C1	ZINC000819476765	IJ	On-Demand	Anodyne	FPR2	25	47
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccn(-c3ccc(F)cc3C)n2)C1	ZINC000819476766	IJ	On-Demand	Anodyne	FPR2	25	47
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2nnn(Cc3ccc(F)cc3)c2C)C1	ZINC000819476769	II	On-Demand	Anodyne	HRH1	28	43
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2nnn(Cc3ccc(F)cc3)c2C)C1	ZINC000819476769	II	On-Demand	Anodyne	FPR2	26	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2nnn(Cc3ccc(F)cc3)c2C)C1	ZINC000819476770	II	On-Demand	Anodyne	HRH1	28	43
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2nnn(Cc3ccc(F)cc3)c2C)C1	ZINC000819476770	II	On-Demand	Anodyne	FPR2	26	52
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(S(N)(=O)=O)ccc2F)C1	ZINC000819476771	IF	On-Demand	Anodyne	FPR2	27	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(S(N)(=O)=O)ccc2F)C1	ZINC000819476772	IF	On-Demand	Anodyne	FPR2	27	49
C[C@@H](Oc1ccc(C(F)(F)F)cc1)C(=O)Nc1cn2cc(Br)ncc2n1	ZINC000819476774	IH	On-Demand	Anodyne	MAP3K5	61	38
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ncccc2O)C1	ZINC000819476790	FG	On-Demand	Anodyne	FPR2	28	54
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ncccc2O)C1	ZINC000819476791	FG	On-Demand	Anodyne	FPR2	28	54
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cn(C)nc2-c2ccccc2Cl)C1	ZINC000819476793	IK	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cn(C)nc2-c2ccccc2Cl)C1	ZINC000819476794	IK	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CN(C)C)C1	ZINC000819476795	DE	On-Demand	Anodyne	FPR2	29	54
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CN(C)C)C1	ZINC000819476796	DE	On-Demand	Anodyne	FPR2	29	54
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)Cn2ccc(C(F)(F)F)n2)C1	ZINC000819476798	HH	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)Cn2ccc(C(F)(F)F)n2)C1	ZINC000819476799	HH	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CCN2CCCS2(=O)=O)C1	ZINC000819476800	HE	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CCN2CCCS2(=O)=O)C1	ZINC000819476801	HE	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cnn(-c3ccccc3)c2COC)C1	ZINC000819476802	II	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cnn(-c3ccccc3)c2COC)C1	ZINC000819476803	II	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C[C@@H](CNC(=O)OC(C)(C)C)OC)C1	ZINC000819476804	IH	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C[C@H](CNC(=O)OC(C)(C)C)OC)C1	ZINC000819476805	IH	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C[C@@H](CNC(=O)OC(C)(C)C)OC)C1	ZINC000819476806	IH	On-Demand	Anodyne	FPR2	25	46
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C[C@H](CNC(=O)OC(C)(C)C)OC)C1	ZINC000819476807	IH	On-Demand	Anodyne	FPR2	25	46
CCCN(CC)c1ccc(C(=O)Nc2cn3cc(Br)ncc3n2)cn1	ZINC000819476808	HG	On-Demand	Anodyne	MAP3K5	68	42
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H](O)c2ccccc2)C1	ZINC000819476809	FG	On-Demand	Anodyne	CCR5	17	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@H](O)c2ccccc2)C1	ZINC000819476809	FG	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H](O)c2ccccc2)C1	ZINC000819476810	FG	On-Demand	Anodyne	CCR5	17	44
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@H](O)c2ccccc2)C1	ZINC000819476810	FG	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H](O)c2ccccc2)C1	ZINC000819476811	FG	On-Demand	Anodyne	CCR5	17	44
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)[C@@H](O)c2ccccc2)C1	ZINC000819476811	FG	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H](O)c2ccccc2)C1	ZINC000819476812	FG	On-Demand	Anodyne	CCR5	17	44
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)[C@@H](O)c2ccccc2)C1	ZINC000819476812	FG	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(OC)cc2C)C1	ZINC000819476813	GI	On-Demand	Anodyne	FPR2	33	64
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(OC)cc2C)C1	ZINC000819476814	GI	On-Demand	Anodyne	FPR2	33	64
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(-c3ccccc3)on2)C1	ZINC000819476816	HJ	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(-c3ccccc3)on2)C1	ZINC000819476817	HJ	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C(=O)N2CCC[C@H](C)C2)C1	ZINC000819476818	GG	On-Demand	Anodyne	FPR2	29	53
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)C(=O)N2CCC[C@@H](C)C2)C1	ZINC000819476819	GG	On-Demand	Anodyne	FPR2	29	53
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C(=O)N2CCC[C@H](C)C2)C1	ZINC000819476820	GG	On-Demand	Anodyne	FPR2	29	53
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)C(=O)N2CCC[C@@H](C)C2)C1	ZINC000819476821	GG	On-Demand	Anodyne	FPR2	29	53
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2n[nH]c3c2CCCCC3)C1	ZINC000819476822	GI	On-Demand	Anodyne	FPR2	28	53
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2n[nH]c3c2CCCCC3)C1	ZINC000819476823	GI	On-Demand	Anodyne	FPR2	28	53
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)CNC(=O)NC)C1	ZINC000819476824	ED	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)CNC(=O)NC)C1	ZINC000819476825	ED	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cnc(C)nc2C(C)C)C1	ZINC000819476826	GI	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cnc(C)nc2C(C)C)C1	ZINC000819476827	GI	On-Demand	Anodyne	FPR2	26	49
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cccc(C(F)F)c2)C1	ZINC000819476832	GK	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cccc(C(F)F)c2)C1	ZINC000819476833	GK	On-Demand	Anodyne	FPR2	28	52
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cn(C(C)(C)C)nc2C)C1	ZINC000819476834	GI	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cn(C(C)(C)C)nc2C)C1	ZINC000819476835	GI	On-Demand	Anodyne	FPR2	27	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cnc(OCC3CC3)cn2)C1	ZINC000819476839	HH	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cnc(OCC3CC3)cn2)C1	ZINC000819476840	HH	On-Demand	Anodyne	FPR2	26	48
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(-c3cc[nH]n3)s2)C1	ZINC000819476841	HJ	On-Demand	Anodyne	FPR2	29	53
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(-c3cc[nH]n3)s2)C1	ZINC000819476842	HJ	On-Demand	Anodyne	FPR2	29	53
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc2c1OC(C)(C)C2	ZINC000819476845	FG	On-Demand	Anodyne	G2YM83_BOTF4	29	42
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2ccc(C3(C#N)CC3)cc2)C1	ZINC000819476846	GJ	On-Demand	Mild	FPR2	26	49
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc2c1OC(C)(C)C2	ZINC000819476847	FG	On-Demand	Anodyne	G2YM83_BOTF4	29	42
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2ccc(C3(C#N)CC3)cc2)C1	ZINC000819476853	GJ	On-Demand	Mild	FPR2	26	49
CCc1nc2ccccc2n1[C@@H]1CCCN(C(=O)c2cc(N3CCNC(=O)C3)ccn2)C1	ZINC000819476860	IE	On-Demand	Anodyne	FPR2	26	50
CCc1nc2ccccc2n1[C@H]1CCCN(C(=O)c2cc(N3CCNC(=O)C3)ccn2)C1	ZINC000819476862	IE	On-Demand	Anodyne	FPR2	26	50
C[C@@](O)(CC(=O)Nc1cn2cc(Br)ncc2n1)C1CC1	ZINC000819476865	ED	On-Demand	Anodyne	MAP3K5	55	38
CON(C)C(=O)CCNc1cccc2c1OC(C)(C)C2	ZINC000819476874	CE	On-Demand	Anodyne	G2YM83_BOTF4	29	43
CSc1cc(O)ccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819476897	GH	On-Demand	Anodyne	GPR119	54	46
CCOc1cc(O)ccc1NC[C@@H](O)COC(C)C	ZINC000819476898	CD	On-Demand	Anodyne	ADRB2	19	40
CCOc1cc(O)ccc1NC[C@H](O)COC(C)C	ZINC000819476899	CD	On-Demand	Anodyne	ADRB2	19	40
CSc1cc(O)ccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819476900	GH	On-Demand	Anodyne	GPR119	54	46
O[C@H]1CCCc2cc(NC[C@@H](O)COc3ccc(Br)cc3)ccc21	ZINC000819476911	GH	On-Demand	Anodyne	ADRB1	35	42
O[C@@H](CNc1ccc2c(c1)CCC[C@@H]2O)COc1ccc(Br)cc1	ZINC000819476914	GH	On-Demand	Anodyne	ADRB1	35	42
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccc(Br)cc1	ZINC000819476916	GH	On-Demand	Anodyne	ADRB1	35	42
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccc(Br)cc1	ZINC000819476918	GH	On-Demand	Anodyne	ADRB1	35	42
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819476919	GH	On-Demand	Anodyne	ADRB1	57	42
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819476919	GH	On-Demand	Anodyne	G2YM83_BOTF4	28	41
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819476921	GH	On-Demand	Anodyne	ADRB1	57	42
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819476921	GH	On-Demand	Anodyne	G2YM83_BOTF4	28	41
CCOc1cc(O)ccc1NC[C@@H](O)COCC(C)C	ZINC000819476927	CE	On-Demand	Anodyne	ADRB2	17	41
CCOc1cc(O)ccc1NC[C@H](O)COCC(C)C	ZINC000819476928	CE	On-Demand	Anodyne	ADRB2	17	41
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc2c1OC(C)(C)C2	ZINC000819476930	FG	On-Demand	Anodyne	G2YM83_BOTF4	29	42
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc2c1OC(C)(C)C2	ZINC000819476932	FG	On-Demand	Anodyne	G2YM83_BOTF4	29	42
CCOc1cc(O)ccc1NC[C@H](O)COc1cc(C)cc(C)c1	ZINC000819476937	EG	On-Demand	Anodyne	ADRB2	29	50
CCOc1cc(O)ccc1NC[C@H](O)COc1cc(C)cc(C)c1	ZINC000819476937	EG	On-Demand	Anodyne	ADRB1	26	41
CCOc1cc(O)ccc1NC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000819476939	EG	On-Demand	Anodyne	ADRB2	29	50
CCOc1cc(O)ccc1NC[C@@H](O)COc1cc(C)cc(C)c1	ZINC000819476939	EG	On-Demand	Anodyne	ADRB1	26	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CC=C(c2ccccc2)C1	ZINC000819476969	EF	On-Demand	Anodyne	ADAM10	29	45
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819476994	FG	On-Demand	Anodyne	ADRB2	30	50
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819476994	FG	On-Demand	Anodyne	ADRB1	58	50
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819476994	FG	On-Demand	Anodyne	ADRB3	34	44
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819476994	FG	On-Demand	Anodyne	G2YM83_BOTF4	31	45
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819476995	FG	On-Demand	Anodyne	ADRB2	30	50
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819476995	FG	On-Demand	Anodyne	ADRB1	58	50
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819476995	FG	On-Demand	Anodyne	ADRB3	34	44
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819476995	FG	On-Demand	Anodyne	G2YM83_BOTF4	31	45
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc3c2OC(C)(C)C3)c1	ZINC000819477011	FG	On-Demand	Anodyne	G2YM83_BOTF4	29	42
O[C@@H](CNc1ccc2c(c1)CCC[C@@H]2O)COc1cccc2[nH]ccc12	ZINC000819477012	FG	On-Demand	Anodyne	ADRB1	18	59
O[C@@H](CNc1ccc2c(c1)CCC[C@@H]2O)COc1cccc2[nH]ccc12	ZINC000819477012	FG	On-Demand	Anodyne	SLC6A4	15	41
CC(=O)c1cccc(OC[C@H](O)CNc2cccc3c2OC(C)(C)C3)c1	ZINC000819477013	FG	On-Demand	Anodyne	G2YM83_BOTF4	29	42
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1cccc2[nH]ccc12	ZINC000819477015	FG	On-Demand	Anodyne	ADRB1	18	59
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1cccc2[nH]ccc12	ZINC000819477015	FG	On-Demand	Anodyne	SLC6A4	15	41
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1cccc2[nH]ccc12	ZINC000819477016	FG	On-Demand	Anodyne	ADRB1	18	59
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1cccc2[nH]ccc12	ZINC000819477016	FG	On-Demand	Anodyne	SLC6A4	15	41
O[C@H]1CCCc2cc(NC[C@@H](O)COc3cccc4[nH]ccc34)ccc21	ZINC000819477017	FG	On-Demand	Anodyne	ADRB1	18	59
O[C@H]1CCCc2cc(NC[C@@H](O)COc3cccc4[nH]ccc34)ccc21	ZINC000819477017	FG	On-Demand	Anodyne	SLC6A4	15	41
CCOc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819477022	FG	On-Demand	Anodyne	ADRB1	43	38
CCOc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819477022	FG	On-Demand	Anodyne	ADRB3	20	40
CCOc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819477023	FG	On-Demand	Anodyne	ADRB1	43	38
CCOc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819477023	FG	On-Demand	Anodyne	ADRB3	20	40
CCOc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819477024	FG	On-Demand	Anodyne	ADRB1	43	38
CCOc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819477024	FG	On-Demand	Anodyne	ADRB3	20	40
CCOc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819477025	FG	On-Demand	Anodyne	ADRB1	43	38
CCOc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819477025	FG	On-Demand	Anodyne	ADRB3	20	40
N#Cc1cccc(S(=O)(=O)CCNc2ccc3c(c2)CCC[C@@H]3O)c1	ZINC000819477036	FF	On-Demand	Mild	HTR6	42	34
N#Cc1cccc(S(=O)(=O)CCNc2ccc3c(c2)CCC[C@H]3O)c1	ZINC000819477037	FF	On-Demand	Mild	HTR6	42	34
CCOC(=O)CC[C@@H](O)CNc1cccc2c1OC(C)(C)C2	ZINC000819477061	DF	On-Demand	Anodyne	G2YM83_BOTF4	30	42
CCOC(=O)CC[C@H](O)CNc1cccc2c1OC(C)(C)C2	ZINC000819477062	DF	On-Demand	Anodyne	G2YM83_BOTF4	30	42
COCCNC(=O)c1ccccc1NC(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12	ZINC000819477083	JJ	On-Demand	Anodyne	TSPO	29	53
O[C@H](CNc1ccc(Cc2nnc3n2CCC3)cc1)c1cccc(Cl)c1	ZINC000819477090	FH	On-Demand	Anodyne	ADRB1	26	44
O[C@H](CNc1ccc(Cc2nnc3n2CCC3)cc1)c1cccc(Cl)c1	ZINC000819477090	FH	On-Demand	Anodyne	ADRB3	40	42
O[C@H](CNc1ccc(Cc2nnc3n2CCC3)cc1)c1cccc(Cl)c1	ZINC000819477090	FH	On-Demand	Anodyne	CYP3A4	40	34
O[C@@H](CNc1ccc(Cc2nnc3n2CCC3)cc1)c1cccc(Cl)c1	ZINC000819477091	FH	On-Demand	Anodyne	ADRB1	26	44
O[C@@H](CNc1ccc(Cc2nnc3n2CCC3)cc1)c1cccc(Cl)c1	ZINC000819477091	FH	On-Demand	Anodyne	ADRB3	40	42
O[C@@H](CNc1ccc(Cc2nnc3n2CCC3)cc1)c1cccc(Cl)c1	ZINC000819477091	FH	On-Demand	Anodyne	CYP3A4	40	34
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819477094	EF	On-Demand	Bother	ADRB2	23	41
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819477094	EF	On-Demand	Bother	ADRB1	28	42
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819477094	EF	On-Demand	Bother	ADRB3	18	42
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819477094	EF	On-Demand	Bother	CACNA1D	57	33
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819477094	EF	On-Demand	Bother	PDS	26	46
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819477095	EF	On-Demand	Bother	ADRB2	23	41
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819477095	EF	On-Demand	Bother	ADRB1	28	42
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819477095	EF	On-Demand	Bother	ADRB3	18	42
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819477095	EF	On-Demand	Bother	CACNA1D	57	33
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819477095	EF	On-Demand	Bother	PDS	26	46
O=C1CCc2cc(OC[C@H](O)CNc3ccc4c(c3)CCC[C@H]4O)ccc2N1	ZINC000819477098	GF	On-Demand	Anodyne	ADRB1	20	40
O=C1CCc2cc(OC[C@@H](O)CNc3ccc4c(c3)CCC[C@H]4O)ccc2N1	ZINC000819477099	GF	On-Demand	Anodyne	ADRB1	20	40
O=C1CCc2cc(OC[C@H](O)CNc3ccc4c(c3)CCC[C@@H]4O)ccc2N1	ZINC000819477100	GF	On-Demand	Anodyne	ADRB1	20	40
O=C1CCc2cc(OC[C@@H](O)CNc3ccc4c(c3)CCC[C@@H]4O)ccc2N1	ZINC000819477101	GF	On-Demand	Anodyne	ADRB1	20	40
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819477107	FG	On-Demand	Anodyne	ADRB2	16	40
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819477107	FG	On-Demand	Anodyne	G2YM83_BOTF4	30	43
CC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819477108	FG	On-Demand	Anodyne	ADRB2	16	40
CC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OC(C)(C)C3)cc1	ZINC000819477108	FG	On-Demand	Anodyne	G2YM83_BOTF4	30	43
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc(CC)c1	ZINC000819477111	EG	On-Demand	Anodyne	ADRB2	40	42
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc(CC)c1	ZINC000819477111	EG	On-Demand	Anodyne	ADRB1	50	42
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc(CC)c1	ZINC000819477111	EG	On-Demand	Anodyne	ADRB3	34	42
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc(CC)c1	ZINC000819477111	EG	On-Demand	Anodyne	PDS	69	35
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc(CC)c1	ZINC000819477112	EG	On-Demand	Anodyne	ADRB2	40	42
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc(CC)c1	ZINC000819477112	EG	On-Demand	Anodyne	ADRB1	50	42
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc(CC)c1	ZINC000819477112	EG	On-Demand	Anodyne	ADRB3	34	42
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc(CC)c1	ZINC000819477112	EG	On-Demand	Anodyne	PDS	69	35
CCOc1cc(O)ccc1NC[C@H](O)COC(c1ccccc1)c1ccccc1	ZINC000819477130	GI	On-Demand	Anodyne	CASR	21	44
CCOc1cc(O)ccc1NC[C@@H](O)COC(c1ccccc1)c1ccccc1	ZINC000819477131	GI	On-Demand	Anodyne	CASR	21	44
COCCNC(=O)c1ccccc1NC(=O)c1nn(-c2ccccc2)c(C)cc1=O	ZINC000819477141	HE	On-Demand	Anodyne	POLR1A	61	38
CCOc1cc(O)ccc1NC[C@H](O)COc1ccccc1C(C)C	ZINC000819477161	EH	On-Demand	Anodyne	ADRB2	33	48
CCOc1cc(O)ccc1NC[C@H](O)COc1ccccc1C(C)C	ZINC000819477161	EH	On-Demand	Anodyne	ADRB1	49	34
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)c1cccc(Cl)c1	ZINC000819477162	DH	On-Demand	Anodyne	ADRB1	25	43
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)c1cccc(Cl)c1	ZINC000819477162	DH	On-Demand	Anodyne	ADRB3	39	46
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccccc1C(C)C	ZINC000819477163	EH	On-Demand	Anodyne	ADRB2	33	48
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccccc1C(C)C	ZINC000819477163	EH	On-Demand	Anodyne	ADRB1	49	34
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)c1cccc(Cl)c1	ZINC000819477164	DH	On-Demand	Anodyne	ADRB1	25	43
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)c1cccc(Cl)c1	ZINC000819477164	DH	On-Demand	Anodyne	ADRB3	39	46
O[C@H]1CCCc2cc(NC[C@H](O)c3cccc(Cl)c3)ccc21	ZINC000819477166	DH	On-Demand	Anodyne	ADRB1	25	43
O[C@H]1CCCc2cc(NC[C@H](O)c3cccc(Cl)c3)ccc21	ZINC000819477166	DH	On-Demand	Anodyne	ADRB3	39	46
O[C@H](CNc1ccc2c(c1)CCC[C@@H]2O)c1cccc(Cl)c1	ZINC000819477168	DH	On-Demand	Anodyne	ADRB1	25	43
O[C@H](CNc1ccc2c(c1)CCC[C@@H]2O)c1cccc(Cl)c1	ZINC000819477168	DH	On-Demand	Anodyne	ADRB3	39	46
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1cccc2ccccc12	ZINC000819477173	FI	On-Demand	Anodyne	ADRB2	22	50
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1cccc2ccccc12	ZINC000819477173	FI	On-Demand	Anodyne	CYP2D6	19	42
O[C@H]1CCCc2cc(NC[C@@H](O)COc3cccc4ccccc34)ccc21	ZINC000819477174	FI	On-Demand	Anodyne	ADRB2	22	50
O[C@H]1CCCc2cc(NC[C@@H](O)COc3cccc4ccccc34)ccc21	ZINC000819477174	FI	On-Demand	Anodyne	CYP2D6	19	42
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1cccc2ccccc12	ZINC000819477175	FI	On-Demand	Anodyne	ADRB2	22	50
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1cccc2ccccc12	ZINC000819477175	FI	On-Demand	Anodyne	CYP2D6	19	42
O[C@@H](CNc1ccc2c(c1)CCC[C@@H]2O)COc1cccc2ccccc12	ZINC000819477176	FI	On-Demand	Anodyne	ADRB2	22	50
O[C@@H](CNc1ccc2c(c1)CCC[C@@H]2O)COc1cccc2ccccc12	ZINC000819477176	FI	On-Demand	Anodyne	CYP2D6	19	42
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccc2ccccc2c1	ZINC000819477182	FI	On-Demand	Anodyne	ADRB2	21	50
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccc2ccccc2c1	ZINC000819477183	FI	On-Demand	Anodyne	ADRB2	21	50
O[C@H]1CCCc2cc(NC[C@@H](O)COc3ccc4ccccc4c3)ccc21	ZINC000819477184	FI	On-Demand	Anodyne	ADRB2	21	50
O[C@@H](CNc1ccc2c(c1)CCC[C@@H]2O)COc1ccc2ccccc2c1	ZINC000819477185	FI	On-Demand	Anodyne	ADRB2	21	50
O=[N+]([O-])c1ccc(S(=O)(=O)CCNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819477230	GF	On-Demand	Bother	HTR6	41	33
O=[N+]([O-])c1ccc(S(=O)(=O)CCNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819477231	GF	On-Demand	Bother	HTR6	41	33
O[C@@H](CNc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1cccnc1	ZINC000819477247	DG	On-Demand	Anodyne	ADRB3	72	42
O[C@H](CNc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1cccnc1	ZINC000819477248	DG	On-Demand	Anodyne	ADRB3	72	42
CCOc1cc(O)ccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819477296	GG	On-Demand	Anodyne	GPR119	60	46
CCOc1cc(O)ccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819477297	GG	On-Demand	Anodyne	GPR119	60	46
CCOc1cc(O)ccc1NC[C@@H](O)CN1CCOCC1	ZINC000819477310	CC	On-Demand	Anodyne	CCR1	40	41
CCOc1cc(O)ccc1NC[C@H](O)CN1CCOCC1	ZINC000819477311	CC	On-Demand	Anodyne	CCR1	40	41
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819477327	FF	On-Demand	Anodyne	ADRB1	26	41
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819477328	FF	On-Demand	Anodyne	ADRB1	26	41
O=C(O)CCNC(=O)N[C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000819477363	DF	On-Demand	Anodyne	FOLH1	21	42
O=C(O)CCNC(=O)N[C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000819477363	DF	On-Demand	Anodyne	MME	22	42
O=C(O)CCNC(=O)N[C@H](c1ccccc1)c1ccc(F)cc1	ZINC000819477364	DF	On-Demand	Anodyne	FOLH1	21	42
O=C(O)CCNC(=O)N[C@H](c1ccccc1)c1ccc(F)cc1	ZINC000819477364	DF	On-Demand	Anodyne	MME	22	42
O=C(O)CCNC(=O)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819477366	DD	On-Demand	Anodyne	DRD4	25	43
O=C(O)CCNC(=O)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819477366	DD	On-Demand	Anodyne	ACHE	19	41
O=C(O)CCNC(=O)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819477366	DD	On-Demand	Anodyne	CHRM3	20	44
O=C(O)CCNC(=O)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819477366	DD	On-Demand	Anodyne	SIGMAR1	32	52
O=C(O)CCNC(=O)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819477366	DD	On-Demand	Anodyne	CCR3	40	50
O=C(O)CCNC(=O)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819477366	DD	On-Demand	Anodyne	FAAH	30	49
O=C(O)CCNC(=O)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819477366	DD	On-Demand	Anodyne	MCHR1	17	43
O=C(O)CCNC(=O)N1CCN(Cc2cccc(F)c2)CC1	ZINC000819477366	DD	On-Demand	Anodyne	CACNA1G	37	43
O=C(O)CCNC(=O)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000819477379	DC	On-Demand	Anodyne	CASR	46	36
O=C(O)CCNC(=O)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000819477380	DC	On-Demand	Anodyne	CASR	46	36
O=C(O)CCNC(=O)N1CCN(Cc2csc(-c3ccccc3)n2)CC1	ZINC000819477381	FE	On-Demand	Anodyne	FAAH	27	43
CCOc1cc(O)ccc1NC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000819477408	FH	On-Demand	Anodyne	ADRB2	23	40
O=C(O)CCNC(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819477409	EF	On-Demand	Anodyne	FOLH1	20	44
O=C(O)CCNC(=O)NC(c1ccc(F)cc1)c1ccc(F)cc1	ZINC000819477409	EF	On-Demand	Anodyne	MME	15	42
O=C(O)CCNC(=O)N1CCN(CC(=O)N2CCc3ccccc32)CC1	ZINC000819477411	FC	On-Demand	Anodyne	DRD4	23	56
CCOc1cc(O)ccc1NC[C@H](O)COc1c(Cl)cccc1Cl	ZINC000819477413	FH	On-Demand	Anodyne	ADRB2	23	40
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819477414	EF	On-Demand	Bother	ADRB2	22	41
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819477414	EF	On-Demand	Bother	ADRB1	55	33
CCOc1cc(O)ccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819477415	EF	On-Demand	Bother	ADRB2	22	41
CCOc1cc(O)ccc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819477415	EF	On-Demand	Bother	ADRB1	55	33
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2ccc3c(c2)CCC[C@H]3O)CC1	ZINC000819477424	GH	On-Demand	Anodyne	GPR119	30	48
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2ccc3c(c2)CCC[C@H]3O)CC1	ZINC000819477425	GH	On-Demand	Anodyne	GPR119	30	48
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2ccc3c(c2)CCC[C@@H]3O)CC1	ZINC000819477427	GH	On-Demand	Anodyne	GPR119	30	48
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2ccc3c(c2)CCC[C@@H]3O)CC1	ZINC000819477429	GH	On-Demand	Anodyne	GPR119	30	48
O=C(O)CCNC(=O)N[C@@H](c1ccc(F)cc1)c1cccs1	ZINC000819477437	DF	On-Demand	Anodyne	FOLH1	15	40
O=C(O)CCNC(=O)N[C@H](c1ccc(F)cc1)c1cccs1	ZINC000819477440	DF	On-Demand	Anodyne	FOLH1	15	40
O=C(O)CCNC(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819477442	ED	On-Demand	Anodyne	DRD4	43	48
O=C(O)CCNC(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819477442	ED	On-Demand	Anodyne	SIGMAR1	29	50
O=C(O)CCNC(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819477442	ED	On-Demand	Anodyne	LSS	18	47
O=C(O)CCNC(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819477442	ED	On-Demand	Anodyne	FAAH	30	62
O=C(O)CCNC(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819477442	ED	On-Demand	Anodyne	EPHX2	20	44
O=C(O)CCNC(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819477442	ED	On-Demand	Anodyne	CXCR3	29	40
O=C(O)CCNC(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819477442	ED	On-Demand	Anodyne	MCHR1	15	41
O=C(O)CCNC(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819477442	ED	On-Demand	Anodyne	CACNA1G	27	48
O=C(O)CCNC(=O)N1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000819477442	ED	On-Demand	Anodyne	PA	21	40
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819477443	EF	On-Demand	Mild	ADRB2	30	40
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819477443	EF	On-Demand	Mild	ADRB1	52	34
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(C#N)cc1	ZINC000819477443	EF	On-Demand	Mild	ADRB3	23	40
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819477445	EF	On-Demand	Mild	ADRB2	30	40
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819477445	EF	On-Demand	Mild	ADRB1	52	34
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000819477445	EF	On-Demand	Mild	ADRB3	23	40
CCOc1cc(O)ccc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819477447	EF	On-Demand	Anodyne	NOD2	41	39
CCOc1cc(O)ccc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819477448	EF	On-Demand	Anodyne	NOD2	41	39
O=C(O)CCNC(=O)N1CCCN(C2CCCC2)CC1	ZINC000819477449	CD	On-Demand	Anodyne	L3MBTL3	45	35
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000819477455	DF	On-Demand	Anodyne	FOLH1	38	40
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000819477455	DF	On-Demand	Anodyne	MME	114	53
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000819477455	DF	On-Demand	Anodyne	ANPEP	54	39
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000819477455	DF	On-Demand	Anodyne	PTGER3	40	38
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000819477455	DF	On-Demand	Anodyne	CPA1	50	43
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000819477455	DF	On-Demand	Anodyne	CTRB1	21	41
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000819477455	DF	On-Demand	Anodyne	NAALAD2	45	48
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000819477455	DF	On-Demand	Anodyne	SOAT1	24	59
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000819477455	DF	On-Demand	Anodyne	FPR1	21	40
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000819477455	DF	On-Demand	Anodyne	AMP1_PLAFQ	42	38
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)c1ccccc1	ZINC000819477455	DF	On-Demand	Anodyne	NPFFR1	60	37
O[C@@H](CNc1ccc(Cc2nnc3n2CCC3)cc1)c1cccnc1	ZINC000819477456	EE	On-Demand	Anodyne	ADRB3	92	45
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000819477457	DF	On-Demand	Anodyne	FOLH1	38	40
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000819477457	DF	On-Demand	Anodyne	MME	114	53
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000819477457	DF	On-Demand	Anodyne	ANPEP	54	39
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000819477457	DF	On-Demand	Anodyne	PTGER3	40	38
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000819477457	DF	On-Demand	Anodyne	CPA1	50	43
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000819477457	DF	On-Demand	Anodyne	CTRB1	21	41
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000819477457	DF	On-Demand	Anodyne	NAALAD2	45	48
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000819477457	DF	On-Demand	Anodyne	SOAT1	24	59
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000819477457	DF	On-Demand	Anodyne	FPR1	21	40
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000819477457	DF	On-Demand	Anodyne	AMP1_PLAFQ	42	38
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)c1ccccc1	ZINC000819477457	DF	On-Demand	Anodyne	NPFFR1	60	37
O[C@H](CNc1ccc(Cc2nnc3n2CCC3)cc1)c1cccnc1	ZINC000819477459	EE	On-Demand	Anodyne	ADRB3	92	45
O=C(O)CCNC(=O)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819477466	EE	On-Demand	Anodyne	DRD4	30	44
O=C(O)CCNC(=O)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819477466	EE	On-Demand	Anodyne	HRH3	16	44
O=C(O)CCNC(=O)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819477466	EE	On-Demand	Anodyne	SIGMAR1	19	45
O=C(O)CCNC(=O)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819477466	EE	On-Demand	Anodyne	LSS	17	44
O=C(O)CCNC(=O)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819477466	EE	On-Demand	Anodyne	FAAH	26	57
O=C(O)CCNC(=O)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819477466	EE	On-Demand	Anodyne	EPHX2	16	46
O=C(O)CCNC(=O)N1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000819477466	EE	On-Demand	Anodyne	CACNA1G	25	44
O=C(O)CCNC(=O)N1CCCC[C@@H]1c1ncc[nH]1	ZINC000819477468	CD	On-Demand	Anodyne	CPT1A	42	36
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819477469	EG	On-Demand	Anodyne	ADRB2	28	53
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819477469	EG	On-Demand	Anodyne	ADRB1	48	32
O=C(O)CCNC(=O)N1CCCC[C@H]1c1ncc[nH]1	ZINC000819477470	CD	On-Demand	Anodyne	CPT1A	42	36
CCOc1cc(O)ccc1NC[C@H](O)COc1ccccc1Cl	ZINC000819477471	EG	On-Demand	Anodyne	ADRB2	28	53
CCOc1cc(O)ccc1NC[C@H](O)COc1ccccc1Cl	ZINC000819477471	EG	On-Demand	Anodyne	ADRB1	48	32
O=C(O)CCNC(=O)N1CCC[C@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000819477472	EF	On-Demand	Anodyne	PRCP	37	54
O=C(O)CCNC(=O)N1CCC[C@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000819477472	EF	On-Demand	Anodyne	GRIN2D	66	35
O=C(O)CCNC(=O)N1CCC[C@@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000819477474	EF	On-Demand	Anodyne	PRCP	37	54
O=C(O)CCNC(=O)N1CCC[C@@H]1c1ncc(-c2ccc(F)cc2)[nH]1	ZINC000819477474	EF	On-Demand	Anodyne	GRIN2D	66	35
O=C(O)CCNC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1	ZINC000819477495	GD	On-Demand	Bother	SERPINE1	23	46
CCOc1cc(O)ccc1NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819477498	GG	On-Demand	Anodyne	HCN1	44	32
CCOc1cc(O)ccc1NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819477498	GG	On-Demand	Anodyne	HCN4	42	32
CCOc1cc(O)ccc1NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819477499	GG	On-Demand	Anodyne	HCN1	44	32
CCOc1cc(O)ccc1NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819477499	GG	On-Demand	Anodyne	HCN4	42	32
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	ACE	44	44
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	OPRM1	33	42
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	OPRD1	34	42
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	FOLH1	45	53
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	MME	147	57
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	LTA4H	16	40
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	ANPEP	81	48
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	CMA1	20	41
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	FCER2	103	39
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	TACR2	20	42
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	CTSB	46	42
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	PAPA1_CARPA	65	44
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	CYSP_TRYCR	54	36
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	CTSL	55	43
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	CPA1	48	38
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	NPFFR2	51	37
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	TIMP3	93	44
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	HDAC8	24	48
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	TACR3	20	41
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	NAALAD2	47	52
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	CAPNS1	62	34
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	MMP2	29	44
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	MMP3	56	45
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	MMP8	25	43
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	GRIA1	52	38
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	HLA-DRB1	57	41
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	CTSS	21	43
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	CAPN1	56	39
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	MMP9	27	50
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	CAPN2	46	40
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	ACE2	66	38
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	MC1R	25	45
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	HDAC11	40	34
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	MMP1	39	50
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	FPR1	74	53
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	AMP1_PLAFQ	42	38
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	BLA1_STEMA	67	37
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	QRFPR	43	35
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	NPFFR1	66	37
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477510	FE	On-Demand	Anodyne	GPR142	60	39
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	ACE	44	44
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	OPRM1	33	42
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	OPRD1	34	42
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	FOLH1	45	53
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	MME	147	57
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	LTA4H	16	40
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	ANPEP	81	48
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	CMA1	20	41
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	FCER2	103	39
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	TACR2	20	42
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	CTSB	46	42
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	PAPA1_CARPA	65	44
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	CYSP_TRYCR	54	36
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	CTSL	55	43
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	CPA1	48	38
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	NPFFR2	51	37
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	TIMP3	93	44
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	HDAC8	24	48
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	TACR3	20	41
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	NAALAD2	47	52
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	CAPNS1	62	34
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	MMP2	29	44
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	MMP3	56	45
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	MMP8	25	43
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	GRIA1	52	38
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	HLA-DRB1	57	41
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	CTSS	21	43
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	CAPN1	56	39
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	MMP9	27	50
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	CAPN2	46	40
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	ACE2	66	38
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	MC1R	25	45
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	HDAC11	40	34
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	MMP1	39	50
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	FPR1	74	53
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	AMP1_PLAFQ	42	38
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	BLA1_STEMA	67	37
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	QRFPR	43	35
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	NPFFR1	66	37
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)C(=O)Nc1ccccc1	ZINC000819477512	FE	On-Demand	Anodyne	GPR142	60	39
O=C(O)CCNC(=O)N1CCN(C(=O)c2ccccn2)CC1	ZINC000819477531	DC	On-Demand	Anodyne	P2RY12	26	41
O=C(O)CCNC(=O)N[C@H](CC1CC1)c1ccccc1	ZINC000819477533	CE	On-Demand	Anodyne	MME	30	40
O=C(O)CCNC(=O)N[C@H](CC1CC1)c1ccccc1	ZINC000819477533	CE	On-Demand	Anodyne	SOAT1	21	40
O=C(O)CCNC(=O)N[C@@H](CC1CC1)c1ccccc1	ZINC000819477535	CE	On-Demand	Anodyne	MME	30	40
O=C(O)CCNC(=O)N[C@@H](CC1CC1)c1ccccc1	ZINC000819477535	CE	On-Demand	Anodyne	SOAT1	21	40
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819477536	EF	On-Demand	Mild	ADRB2	32	43
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819477536	EF	On-Demand	Mild	ADRB1	48	43
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819477536	EF	On-Demand	Mild	ADRB3	30	43
O=C(O)CCNC(=O)N1CC[C@@H]1c1cccc(F)c1	ZINC000819477537	CD	On-Demand	Anodyne	GCGR	15	40
O=C(O)CCNC(=O)N1CC[C@@H]1c1cccc(F)c1	ZINC000819477537	CD	On-Demand	Anodyne	CCR5	78	36
O=C(O)CCNC(=O)N1CC[C@H]1c1cccc(F)c1	ZINC000819477538	CD	On-Demand	Anodyne	GCGR	15	40
O=C(O)CCNC(=O)N1CC[C@H]1c1cccc(F)c1	ZINC000819477538	CD	On-Demand	Anodyne	CCR5	78	36
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819477539	EF	On-Demand	Mild	ADRB2	32	43
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819477539	EF	On-Demand	Mild	ADRB1	48	43
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819477539	EF	On-Demand	Mild	ADRB3	30	43
O=C(O)CCNC(=O)N1CCC[C@@H]1c1cccnc1	ZINC000819477540	CD	On-Demand	Anodyne	FKBP1A	18	40
O=C(O)CCNC(=O)N1CCC[C@@H]1c1cccnc1	ZINC000819477540	CD	On-Demand	Anodyne	TBXAS1	57	41
O=C(O)CCNC(=O)N1CCC[C@@H]1c1cccnc1	ZINC000819477540	CD	On-Demand	Anodyne	CHRNA7	31	49
O=C(O)CCNC(=O)N1CCC[C@@H]1c1cccnc1	ZINC000819477540	CD	On-Demand	Anodyne	PREP	48	41
O=C(O)CCNC(=O)N1CCC[C@@H]1c1cccnc1	ZINC000819477540	CD	On-Demand	Anodyne	ACHP_LYMST	19	49
O=C(O)CCNC(=O)N1CCC[C@@H]1c1cccnc1	ZINC000819477540	CD	On-Demand	Anodyne	NAMPT	46	38
O=C(O)CCNC(=O)N1CCC[C@H]1c1cccnc1	ZINC000819477541	CD	On-Demand	Anodyne	FKBP1A	18	40
O=C(O)CCNC(=O)N1CCC[C@H]1c1cccnc1	ZINC000819477541	CD	On-Demand	Anodyne	TBXAS1	57	41
O=C(O)CCNC(=O)N1CCC[C@H]1c1cccnc1	ZINC000819477541	CD	On-Demand	Anodyne	CHRNA7	31	49
O=C(O)CCNC(=O)N1CCC[C@H]1c1cccnc1	ZINC000819477541	CD	On-Demand	Anodyne	PREP	48	41
O=C(O)CCNC(=O)N1CCC[C@H]1c1cccnc1	ZINC000819477541	CD	On-Demand	Anodyne	ACHP_LYMST	19	49
O=C(O)CCNC(=O)N1CCC[C@H]1c1cccnc1	ZINC000819477541	CD	On-Demand	Anodyne	NAMPT	46	38
O=C(O)CCNC(=O)N[C@@H](COc1ccccc1)c1ccccc1	ZINC000819477542	EF	On-Demand	Anodyne	MME	30	43
O=C(O)CCNC(=O)N[C@@H](COc1ccccc1)c1ccccc1	ZINC000819477542	EF	On-Demand	Anodyne	PTGER3	57	42
O=C(O)CCNC(=O)N[C@@H](COc1ccccc1)c1ccccc1	ZINC000819477542	EF	On-Demand	Anodyne	PDS	54	38
O=C(O)CCNC(=O)N[C@H](COc1ccccc1)c1ccccc1	ZINC000819477543	EF	On-Demand	Anodyne	MME	30	43
O=C(O)CCNC(=O)N[C@H](COc1ccccc1)c1ccccc1	ZINC000819477543	EF	On-Demand	Anodyne	PTGER3	57	42
O=C(O)CCNC(=O)N[C@H](COc1ccccc1)c1ccccc1	ZINC000819477543	EF	On-Demand	Anodyne	PDS	54	38
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)c1ccccc1F	ZINC000819477549	EF	On-Demand	Anodyne	MME	69	51
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)c1ccccc1F	ZINC000819477549	EF	On-Demand	Anodyne	ANPEP	23	45
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)c1ccccc1F	ZINC000819477549	EF	On-Demand	Anodyne	NAALAD2	32	43
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)c1ccccc1F	ZINC000819477549	EF	On-Demand	Anodyne	CTSA	46	32
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)c1ccccc1F	ZINC000819477550	EF	On-Demand	Anodyne	MME	69	51
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)c1ccccc1F	ZINC000819477550	EF	On-Demand	Anodyne	ANPEP	23	45
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)c1ccccc1F	ZINC000819477550	EF	On-Demand	Anodyne	NAALAD2	32	43
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)c1ccccc1F	ZINC000819477550	EF	On-Demand	Anodyne	CTSA	46	32
COCCc1ccc(OC[C@H](O)CNc2cc(C)c(OC)cc2C)cc1	ZINC000819477576	FG	On-Demand	Anodyne	ADRB2	40	58
COCCc1ccc(OC[C@H](O)CNc2cc(C)c(OC)cc2C)cc1	ZINC000819477576	FG	On-Demand	Anodyne	ADRB1	52	58
COCCc1ccc(OC[C@H](O)CNc2cc(C)c(OC)cc2C)cc1	ZINC000819477576	FG	On-Demand	Anodyne	GRIN1	15	41
COCCc1ccc(OC[C@H](O)CNc2cc(C)c(OC)cc2C)cc1	ZINC000819477576	FG	On-Demand	Anodyne	ADRB3	33	45
COCCc1ccc(OC[C@@H](O)CNc2cc(C)c(OC)cc2C)cc1	ZINC000819477577	FG	On-Demand	Anodyne	ADRB2	40	58
COCCc1ccc(OC[C@@H](O)CNc2cc(C)c(OC)cc2C)cc1	ZINC000819477577	FG	On-Demand	Anodyne	ADRB1	52	58
COCCc1ccc(OC[C@@H](O)CNc2cc(C)c(OC)cc2C)cc1	ZINC000819477577	FG	On-Demand	Anodyne	GRIN1	15	41
COCCc1ccc(OC[C@@H](O)CNc2cc(C)c(OC)cc2C)cc1	ZINC000819477577	FG	On-Demand	Anodyne	ADRB3	33	45
O=C(O)CCNC(=O)N1CCCC[C@@H](N2CCCC2)C1	ZINC000819477622	CD	On-Demand	Anodyne	L3MBTL3	71	40
O=C(O)CCNC(=O)N1CCCC[C@H](N2CCCC2)C1	ZINC000819477624	CD	On-Demand	Anodyne	L3MBTL3	71	40
O=C(O)CCNC(=O)N1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000819477641	EC	On-Demand	Anodyne	LTA4H	19	44
O=C(O)CCNC(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819477648	ED	On-Demand	Anodyne	HTR1A	19	49
O=C(O)CCNC(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819477648	ED	On-Demand	Anodyne	DRD2	27	46
O=C(O)CCNC(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819477648	ED	On-Demand	Anodyne	DRD4	54	47
O=C(O)CCNC(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819477648	ED	On-Demand	Anodyne	ACHE	28	41
O=C(O)CCNC(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819477648	ED	On-Demand	Anodyne	HRH2	27	42
O=C(O)CCNC(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819477648	ED	On-Demand	Anodyne	DRD3	26	41
O=C(O)CCNC(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819477648	ED	On-Demand	Anodyne	CHRM3	20	50
O=C(O)CCNC(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819477648	ED	On-Demand	Anodyne	SIGMAR1	38	58
O=C(O)CCNC(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819477648	ED	On-Demand	Anodyne	FAAH	36	67
O=C(O)CCNC(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000819477648	ED	On-Demand	Anodyne	EPHX2	17	40
O=C(O)CCNC(=O)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819477651	DD	On-Demand	Anodyne	SIGMAR1	28	43
O=C(O)CCNC(=O)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819477651	DD	On-Demand	Anodyne	CCR3	39	55
O=C(O)CCNC(=O)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819477651	DD	On-Demand	Anodyne	MLNR	45	40
O=C(O)CCNC(=O)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819477651	DD	On-Demand	Anodyne	FAAH	15	44
O=C(O)CCNC(=O)N1CCCN(Cc2ccc(F)cc2)CC1	ZINC000819477651	DD	On-Demand	Anodyne	CACNA1G	45	40
COC[C@@H](O)CNc1cccc2c1OC(C)(C)C2	ZINC000819477654	CD	On-Demand	Anodyne	G2YM83_BOTF4	29	43
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819477668	EF	On-Demand	Anodyne	ADRB2	34	46
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819477668	EF	On-Demand	Anodyne	ADRB1	52	42
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819477668	EF	On-Demand	Anodyne	ADRB3	29	42
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819477671	EF	On-Demand	Anodyne	ADRB2	34	46
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819477671	EF	On-Demand	Anodyne	ADRB1	52	42
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819477671	EF	On-Demand	Anodyne	ADRB3	29	42
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819477674	DF	On-Demand	Anodyne	ADRB2	43	42
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819477674	DF	On-Demand	Anodyne	ADRB1	55	42
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819477674	DF	On-Demand	Anodyne	ADRB3	31	42
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819477676	DF	On-Demand	Anodyne	ADRB2	43	42
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819477676	DF	On-Demand	Anodyne	ADRB1	55	42
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819477676	DF	On-Demand	Anodyne	ADRB3	31	42
O=C(O)CCNC(=O)N1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000819477680	CB	On-Demand	Anodyne	SLC18A3	37	41
CCOc1cc(O)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819477682	DH	On-Demand	Anodyne	ADRB2	20	43
CCOc1cc(O)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819477682	DH	On-Demand	Anodyne	ADRB1	35	43
CCOc1cc(O)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819477682	DH	On-Demand	Anodyne	ADRB3	54	48
CCOc1cc(O)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819477682	DH	On-Demand	Anodyne	CYP3A4	46	34
O=C(O)CCNC(=O)N1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000819477683	CB	On-Demand	Anodyne	SLC18A3	37	41
CCOc1cc(O)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819477684	DH	On-Demand	Anodyne	ADRB2	20	43
CCOc1cc(O)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819477684	DH	On-Demand	Anodyne	ADRB1	35	43
CCOc1cc(O)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819477684	DH	On-Demand	Anodyne	ADRB3	54	48
CCOc1cc(O)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819477684	DH	On-Demand	Anodyne	CYP3A4	46	34
O=C(O)CCNC(=O)N1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000819477686	CB	On-Demand	Anodyne	SLC18A3	37	41
O=C(O)CCNC(=O)N1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000819477690	CB	On-Demand	Anodyne	SLC18A3	37	41
CCOc1cc(O)ccc1NC[C@H](O)c1cccnc1	ZINC000819477691	CE	On-Demand	Anodyne	ADRB2	15	40
CCOc1cc(O)ccc1NC[C@H](O)c1cccnc1	ZINC000819477691	CE	On-Demand	Anodyne	ADRB1	21	42
CCOc1cc(O)ccc1NC[C@H](O)c1cccnc1	ZINC000819477691	CE	On-Demand	Anodyne	ADRB3	61	42
CCOc1cc(O)ccc1NC[C@@H](O)c1cccnc1	ZINC000819477692	CE	On-Demand	Anodyne	ADRB2	15	40
CCOc1cc(O)ccc1NC[C@@H](O)c1cccnc1	ZINC000819477692	CE	On-Demand	Anodyne	ADRB1	21	42
CCOc1cc(O)ccc1NC[C@@H](O)c1cccnc1	ZINC000819477692	CE	On-Demand	Anodyne	ADRB3	61	42
O=C(O)CCNC(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000819477701	GD	On-Demand	Anodyne	HTR1A	17	47
O=C(O)CCNC(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000819477701	GD	On-Demand	Anodyne	DRD2	16	48
O=C(O)CCNC(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000819477701	GD	On-Demand	Anodyne	DRD4	32	44
O=C(O)CCNC(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000819477701	GD	On-Demand	Anodyne	EBP	23	43
O=C(O)CCNC(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000819477706	GD	On-Demand	Anodyne	HTR1A	17	47
O=C(O)CCNC(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000819477706	GD	On-Demand	Anodyne	DRD2	16	48
O=C(O)CCNC(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000819477706	GD	On-Demand	Anodyne	DRD4	32	44
O=C(O)CCNC(=O)N1CCC[C@H](CN2CCN(c3ccccn3)CC2)C1	ZINC000819477706	GD	On-Demand	Anodyne	EBP	23	43
O=C(O)CCNC(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000819477710	DD	On-Demand	Anodyne	OPRK1	16	41
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819477711	FH	On-Demand	Anodyne	ADRB2	25	43
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000819477711	FH	On-Demand	Anodyne	ADRB1	56	33
CCOc1cc(O)ccc1NC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819477713	FH	On-Demand	Anodyne	ADRB2	25	43
CCOc1cc(O)ccc1NC[C@H](O)COc1ccccc1C(F)(F)F	ZINC000819477713	FH	On-Demand	Anodyne	ADRB1	56	33
O=C(O)CCNC(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000819477714	DD	On-Demand	Anodyne	OPRK1	16	41
O=C(O)CCNC(=O)N1CCn2c(nnc2-c2ccccc2)C1	ZINC000819477718	DC	On-Demand	Anodyne	P2RY12	40	34
O=C(O)CCNC(=O)N1CCn2c(nnc2-c2ccccc2)C1	ZINC000819477718	DC	On-Demand	Anodyne	P2RX7	33	52
O=C(O)CCNC(=O)N[C@@H](Cc1cccc(F)c1)c1cccc(F)c1	ZINC000819477726	EG	On-Demand	Anodyne	FOLH1	23	40
O=C(O)CCNC(=O)N[C@@H](Cc1cccc(F)c1)c1cccc(F)c1	ZINC000819477726	EG	On-Demand	Anodyne	MME	27	43
O=C(O)CCNC(=O)N[C@@H](Cc1cccc(F)c1)c1cccc(F)c1	ZINC000819477726	EG	On-Demand	Anodyne	PTGER3	46	43
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819477728	FE	On-Demand	Anodyne	ADRB2	39	49
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819477728	FE	On-Demand	Anodyne	ADRB1	57	42
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819477728	FE	On-Demand	Anodyne	ADRB3	35	43
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819477730	FE	On-Demand	Anodyne	ADRB2	39	49
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819477730	FE	On-Demand	Anodyne	ADRB1	57	42
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(C(=O)OC)cc1	ZINC000819477730	FE	On-Demand	Anodyne	ADRB3	35	43
O=C(O)CCNC(=O)N[C@H](Cc1cccc(F)c1)c1cccc(F)c1	ZINC000819477731	EG	On-Demand	Anodyne	FOLH1	23	40
O=C(O)CCNC(=O)N[C@H](Cc1cccc(F)c1)c1cccc(F)c1	ZINC000819477731	EG	On-Demand	Anodyne	MME	27	43
O=C(O)CCNC(=O)N[C@H](Cc1cccc(F)c1)c1cccc(F)c1	ZINC000819477731	EG	On-Demand	Anodyne	PTGER3	46	43
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819477737	FF	On-Demand	Anodyne	ADRB2	41	58
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819477737	FF	On-Demand	Anodyne	ADRB1	73	58
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819477737	FF	On-Demand	Anodyne	ADRB3	48	55
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(Br)cc1	ZINC000819477738	GG	On-Demand	Anodyne	ADRB2	33	42
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(Br)cc1	ZINC000819477738	GG	On-Demand	Anodyne	ADRB1	43	43
CCOc1cc(O)ccc1NC[C@H](O)COc1ccc(Br)cc1	ZINC000819477738	GG	On-Demand	Anodyne	ADRB3	26	42
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819477740	FF	On-Demand	Anodyne	ADRB2	41	58
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819477740	FF	On-Demand	Anodyne	ADRB1	73	58
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819477740	FF	On-Demand	Anodyne	ADRB3	48	55
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(Br)cc1	ZINC000819477741	GG	On-Demand	Anodyne	ADRB2	33	42
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(Br)cc1	ZINC000819477741	GG	On-Demand	Anodyne	ADRB1	43	43
CCOc1cc(O)ccc1NC[C@@H](O)COc1ccc(Br)cc1	ZINC000819477741	GG	On-Demand	Anodyne	ADRB3	26	42
O=C(O)CCNC(=O)N1CCC[C@@H]1c1ccc(F)c(F)c1	ZINC000819477742	CE	On-Demand	Anodyne	ADRA1A	55	39
O=C(O)CCNC(=O)N1CCC[C@@H]1c1ccc(F)c(F)c1	ZINC000819477742	CE	On-Demand	Anodyne	GRIN2D	62	36
O=C(O)CCNC(=O)N1CCC[C@H]1c1ccc(F)c(F)c1	ZINC000819477746	CE	On-Demand	Anodyne	ADRA1A	55	39
O=C(O)CCNC(=O)N1CCC[C@H]1c1ccc(F)c(F)c1	ZINC000819477746	CE	On-Demand	Anodyne	GRIN2D	62	36
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc(C)c1	ZINC000819477750	DF	On-Demand	Anodyne	ADRB2	34	55
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc(C)c1	ZINC000819477750	DF	On-Demand	Anodyne	ADRB1	33	55
CCOc1cc(O)ccc1NC[C@H](O)COc1cccc(C)c1	ZINC000819477750	DF	On-Demand	Anodyne	PDS	36	40
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819477752	DF	On-Demand	Anodyne	ADRB2	34	55
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819477752	DF	On-Demand	Anodyne	ADRB1	33	55
CCOc1cc(O)ccc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819477752	DF	On-Demand	Anodyne	PDS	36	40
O=C(O)CCNC(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000819477758	DD	On-Demand	Anodyne	OPRK1	17	41
O=C(O)CCNC(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000819477760	DD	On-Demand	Anodyne	OPRK1	17	41
O=C(O)CCNC(=O)N1CCc2cncnc2C1	ZINC000819477764	CC	On-Demand	Anodyne	MAPK1	46	39
O=C(O)CCNC(=O)N[C@@H](c1ccccc1)c1cccnc1	ZINC000819477768	CD	On-Demand	Anodyne	TBXAS1	63	39
O=C(O)CCNC(=O)N[C@@H](c1ccccc1)c1cccnc1	ZINC000819477768	CD	On-Demand	Anodyne	PTAFR	17	43
O=C(O)CCNC(=O)N[C@@H](c1ccccc1)c1cccnc1	ZINC000819477768	CD	On-Demand	Anodyne	KCNA5	27	45
O=C(O)CCNC(=O)N[C@@H](c1ccccc1)c1cccnc1	ZINC000819477768	CD	On-Demand	Anodyne	NAMPT	20	40
O=C(O)CCNC(=O)N[C@H](c1ccccc1)c1cccnc1	ZINC000819477770	CD	On-Demand	Anodyne	TBXAS1	63	39
O=C(O)CCNC(=O)N[C@H](c1ccccc1)c1cccnc1	ZINC000819477770	CD	On-Demand	Anodyne	PTAFR	17	43
O=C(O)CCNC(=O)N[C@H](c1ccccc1)c1cccnc1	ZINC000819477770	CD	On-Demand	Anodyne	KCNA5	27	45
O=C(O)CCNC(=O)N[C@H](c1ccccc1)c1cccnc1	ZINC000819477770	CD	On-Demand	Anodyne	NAMPT	20	40
O=C(O)CCNC(=O)N1CCC[C@@H](C(=O)N2CCCC2)C1	ZINC000819477773	CC	On-Demand	Anodyne	PREP	52	39
O=C(O)CCNC(=O)N1CCC[C@H](C(=O)N2CCCC2)C1	ZINC000819477775	CC	On-Demand	Anodyne	PREP	52	39
O=C(O)CCNC(=O)N1CCN(Cc2nc(O)c3ccccc3n2)CC1	ZINC000819477777	FC	On-Demand	Anodyne	HTR7	17	45
O=C(O)CCNC(=O)N1CCN(Cc2nc(O)c3ccccc3n2)CC1	ZINC000819477777	FC	On-Demand	Anodyne	TNKS	40	30
CC[C@H](O)CNc1cccc2c1OC(C)(C)C2	ZINC000819477778	BF	On-Demand	Anodyne	G2YM83_BOTF4	31	46
O=C(O)CCNC(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000819477779	DC	On-Demand	Anodyne	HTR1A	30	43
O=C(O)CCNC(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000819477779	DC	On-Demand	Anodyne	DRD2	26	43
O=C(O)CCNC(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000819477779	DC	On-Demand	Anodyne	DRD4	42	33
O=C(O)CCNC(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000819477779	DC	On-Demand	Anodyne	HRH2	28	42
O=C(O)CCNC(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000819477779	DC	On-Demand	Anodyne	DRD3	38	43
O=C(O)CCNC(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000819477779	DC	On-Demand	Anodyne	HTR4	18	40
O=C(O)CCNC(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000819477779	DC	On-Demand	Anodyne	LTA4H	83	47
O=C(O)CCNC(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000819477779	DC	On-Demand	Anodyne	CYSLTR2	53	32
O=C(O)CCNC(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000819477779	DC	On-Demand	Anodyne	HRH3	40	49
O=C(O)CCNC(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000819477779	DC	On-Demand	Anodyne	EPHX2	28	40
O=C(O)CCNC(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000819477779	DC	On-Demand	Anodyne	PSMB2	42	40
O=C(O)CCNC(=O)N1CCN(CCOc2ccccc2)CC1	ZINC000819477779	DC	On-Demand	Anodyne	PSMB1	45	43
COc1cccc(OC)c1OC[C@@H](O)CNc1cccc2c1OC(C)(C)C2	ZINC000819477800	FG	On-Demand	Anodyne	G2YM83_BOTF4	22	41
COc1cccc(OC)c1OC[C@H](O)CNc1cccc2c1OC(C)(C)C2	ZINC000819477802	FG	On-Demand	Anodyne	G2YM83_BOTF4	22	41
COCCNC(=O)c1ccccc1NC(=O)/C=C\Sc1ccccc1	ZINC000819477805	FG	On-Demand	Anodyne	FAS	16	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC=C(c3ccccc3)C1)C2	ZINC000819477821	EF	On-Demand	Anodyne	ADAM10	32	51
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC=C(c3ccccc3)C1)C2	ZINC000819477822	EF	On-Demand	Anodyne	ADAM10	32	51
O=C(O)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819477828	EF	On-Demand	Anodyne	ACE	43	45
O=C(O)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819477828	EF	On-Demand	Anodyne	FOLH1	44	43
O=C(O)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819477828	EF	On-Demand	Anodyne	MME	142	59
O=C(O)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819477828	EF	On-Demand	Anodyne	ANPEP	78	45
O=C(O)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819477828	EF	On-Demand	Anodyne	FCER2	55	33
O=C(O)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819477828	EF	On-Demand	Anodyne	PAPA1_CARPA	43	38
O=C(O)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819477828	EF	On-Demand	Anodyne	CPA1	56	46
O=C(O)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819477828	EF	On-Demand	Anodyne	NPFFR2	43	35
O=C(O)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819477828	EF	On-Demand	Anodyne	CTRB1	24	44
O=C(O)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819477828	EF	On-Demand	Anodyne	NAALAD2	47	51
O=C(O)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819477828	EF	On-Demand	Anodyne	CAPN1	48	40
O=C(O)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819477828	EF	On-Demand	Anodyne	CAPN2	44	31
O=C(O)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819477828	EF	On-Demand	Anodyne	ACE2	52	36
O=C(O)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819477828	EF	On-Demand	Anodyne	FPR1	30	42
O=C(O)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819477828	EF	On-Demand	Anodyne	NPR	20	40
O=C(O)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819477828	EF	On-Demand	Anodyne	AMP1_PLAFQ	51	41
O=C(O)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819477828	EF	On-Demand	Anodyne	FFAR1	30	40
O=C(O)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000819477828	EF	On-Demand	Anodyne	NPFFR1	62	35
O=C(O)CCNC(=O)N1CCN(Cc2ccccc2Cl)CC1	ZINC000819477831	ED	On-Demand	Anodyne	DRD4	22	45
O=C(O)CCNC(=O)N1CCN(Cc2ccccc2Cl)CC1	ZINC000819477831	ED	On-Demand	Anodyne	SIGMAR1	19	53
O=C(O)CCNC(=O)N1CCN(Cc2ccccc2Cl)CC1	ZINC000819477831	ED	On-Demand	Anodyne	FAAH	18	46
O=C(O)CCNC(=O)N1CCN(Cc2ccccc2Cl)CC1	ZINC000819477831	ED	On-Demand	Anodyne	EPHX2	18	42
O=C(O)CCNC(=O)N1CCN(Cc2cccnc2)CC1	ZINC000819477834	CC	On-Demand	Anodyne	ACHE	15	49
O=C(O)CCNC(=O)N1CCN(Cc2cccnc2)CC1	ZINC000819477834	CC	On-Demand	Anodyne	TBXAS1	68	44
O=C(O)CCNC(=O)N1CCN(Cc2cccnc2)CC1	ZINC000819477834	CC	On-Demand	Anodyne	PTAFR	25	57
O=C(O)CCNC(=O)N1CCN(Cc2cccnc2)CC1	ZINC000819477834	CC	On-Demand	Anodyne	CHRNA7	44	35
O=C(O)CCNC(=O)N1CCN(Cc2cccnc2)CC1	ZINC000819477834	CC	On-Demand	Anodyne	FAAH	35	46
O=C(O)CCNC(=O)N1CCN(Cc2cccnc2)CC1	ZINC000819477834	CC	On-Demand	Anodyne	NAMPT	47	38
O=C(O)CCNC(=O)N1CCN(CC(=O)NCc2ccccc2)CC1	ZINC000819477835	EC	On-Demand	Anodyne	HTR7	21	44
O=C(O)CCNC(=O)N1CCN(CC(=O)NCc2ccccc2)CC1	ZINC000819477835	EC	On-Demand	Anodyne	TPSAB1	17	45
O=C(O)CCNC(=O)N1CCN(CC(=O)NCc2ccccc2)CC1	ZINC000819477835	EC	On-Demand	Anodyne	NPSR1	26	42
O=C(O)CCNC(=O)N[C@@H](COc1ccccc1F)c1ccccc1	ZINC000819477841	EF	On-Demand	Anodyne	PTGER3	37	40
O=C(O)CCNC(=O)N[C@H](COc1ccccc1F)c1ccccc1	ZINC000819477842	EF	On-Demand	Anodyne	PTGER3	37	40
COCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)c2ccc(OC)c3ccccc23)CC1	ZINC000819477854	JH	On-Demand	Anodyne	CCR8	57	34
COCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)c2ccc(OC)c3ccccc23)CC1	ZINC000819477854	JH	On-Demand	Anodyne	L3MBTL3	19	40
O=C(O)CCNC(=O)N1CCC[C@@H]1c1ccccn1	ZINC000819477855	CD	On-Demand	Anodyne	CPT1A	98	41
O=C(O)CCNC(=O)N1CCC[C@@H]1c1ccccn1	ZINC000819477855	CD	On-Demand	Anodyne	PREP	70	38
O=C(O)CCNC(=O)N1CCC[C@H]1c1ccccn1	ZINC000819477858	CD	On-Demand	Anodyne	CPT1A	98	41
O=C(O)CCNC(=O)N1CCC[C@H]1c1ccccn1	ZINC000819477858	CD	On-Demand	Anodyne	PREP	70	38
O=C(O)CCNC(=O)N1Cc2ccccc2-c2ccccc2C1	ZINC000819477862	DF	On-Demand	Anodyne	MME	15	40
O=C(O)CCNC(=O)N[C@@H](c1ccccc1)c1cccc(F)c1	ZINC000819477876	DF	On-Demand	Anodyne	FOLH1	18	42
O=C(O)CCNC(=O)N[C@@H](c1ccccc1)c1cccc(F)c1	ZINC000819477876	DF	On-Demand	Anodyne	MME	19	40
O=C(O)CCNC(=O)N[C@@H](c1ccccc1)c1cccc(F)c1	ZINC000819477876	DF	On-Demand	Anodyne	PTGER3	17	40
Cc1ccccc1C1=CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819477878	GH	On-Demand	Mild	PAPA1_CARPA	39	41
O=C(O)CCNC(=O)N[C@H](c1ccccc1)c1cccc(F)c1	ZINC000819477879	DF	On-Demand	Anodyne	FOLH1	18	42
O=C(O)CCNC(=O)N[C@H](c1ccccc1)c1cccc(F)c1	ZINC000819477879	DF	On-Demand	Anodyne	MME	19	40
O=C(O)CCNC(=O)N[C@H](c1ccccc1)c1cccc(F)c1	ZINC000819477879	DF	On-Demand	Anodyne	PTGER3	17	40
Cc1ccccc1C1=CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819477883	GH	On-Demand	Mild	PAPA1_CARPA	39	41
O=C(O)CCNC(=O)N1CCCC[C@H]1c1ccco1	ZINC000819477885	CD	On-Demand	Anodyne	CPT1A	44	32
O=C(O)CCNC(=O)N1CCCC[C@@H]1c1ccco1	ZINC000819477886	CD	On-Demand	Anodyne	CPT1A	44	32
COc1cccc([S@@](=O)CC(=O)NN2CCCC2=O)c1	ZINC000819477888	CC	On-Demand	Anodyne	DRD4	43	33
COc1cccc([S@@](=O)CC(=O)NN2CCCC2=O)c1	ZINC000819477888	CC	On-Demand	Anodyne	NQO2	18	43
COc1cccc([S@@](=O)CC(=O)NN2CCCC2=O)c1	ZINC000819477888	CC	On-Demand	Anodyne	MTNR1A	42	40
COc1cccc([S@@](=O)CC(=O)NN2CCCC2=O)c1	ZINC000819477888	CC	On-Demand	Anodyne	MTNR1B	45	36
O=C(O)CCNC(=O)N1CCC[C@H](c2noc(C3CC3)n2)C1	ZINC000819477889	DD	On-Demand	Anodyne	ETHR	62	47
O=C(O)CCNC(=O)N1CCC[C@@H](c2noc(C3CC3)n2)C1	ZINC000819477891	DD	On-Demand	Anodyne	ETHR	62	47
C/C=C\c1ccc(OC[C@@H](O)CNc2ccc(COC)cc2)c(OC)c1	ZINC000819477918	FH	On-Demand	Anodyne	ADRB2	22	65
C/C=C\c1ccc(OC[C@@H](O)CNc2ccc(COC)cc2)c(OC)c1	ZINC000819477918	FH	On-Demand	Anodyne	ADRB1	22	65
C/C=C\c1ccc(OC[C@H](O)CNc2ccc(COC)cc2)c(OC)c1	ZINC000819477919	FH	On-Demand	Anodyne	ADRB2	22	65
C/C=C\c1ccc(OC[C@H](O)CNc2ccc(COC)cc2)c(OC)c1	ZINC000819477919	FH	On-Demand	Anodyne	ADRB1	22	65
C/C=C/c1ccc(OC[C@@H](O)CNc2ccc(COC)cc2)c(OC)c1	ZINC000819477920	FH	On-Demand	Anodyne	ADRB2	22	65
C/C=C/c1ccc(OC[C@@H](O)CNc2ccc(COC)cc2)c(OC)c1	ZINC000819477920	FH	On-Demand	Anodyne	ADRB1	22	65
C/C=C/c1ccc(OC[C@H](O)CNc2ccc(COC)cc2)c(OC)c1	ZINC000819477922	FH	On-Demand	Anodyne	ADRB2	22	65
C/C=C/c1ccc(OC[C@H](O)CNc2ccc(COC)cc2)c(OC)c1	ZINC000819477922	FH	On-Demand	Anodyne	ADRB1	22	65
COC[C@@H](O)CNc1cc(C)c(OC)cc1C	ZINC000819477960	BD	On-Demand	Anodyne	CRHR1	22	40
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819478014	GH	On-Demand	Anodyne	ADRB2	16	40
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819478014	GH	On-Demand	Anodyne	ADRB1	39	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819478015	GH	On-Demand	Anodyne	ADRB2	16	40
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819478015	GH	On-Demand	Anodyne	ADRB1	39	40
COCCNC(=O)c1ccccc1NC(=O)Cn1nc(C)cc1C	ZINC000819478016	ED	On-Demand	Anodyne	POLR1A	47	36
O[C@@H](CNc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1cccc(Cl)c1	ZINC000819478021	EI	On-Demand	Anodyne	ADRB1	23	43
O[C@@H](CNc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1cccc(Cl)c1	ZINC000819478021	EI	On-Demand	Anodyne	CYP3A4	47	36
O[C@H](CNc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1cccc(Cl)c1	ZINC000819478022	EI	On-Demand	Anodyne	ADRB1	23	43
O[C@H](CNc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)c1cccc(Cl)c1	ZINC000819478022	EI	On-Demand	Anodyne	CYP3A4	47	36
O[C@H]1CCCc2cc(NC[C@@H](O)COc3cccc(Br)c3)ccc21	ZINC000819478025	GH	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNc1ccc2c(c1)CCC[C@@H]2O)COc1cccc(Br)c1	ZINC000819478026	GH	On-Demand	Anodyne	ADRB1	27	40
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1cccc(Br)c1	ZINC000819478027	GH	On-Demand	Anodyne	ADRB1	27	40
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1cccc(Br)c1	ZINC000819478028	GH	On-Demand	Anodyne	ADRB1	27	40
COCCNC(=O)c1ccccc1NC(=O)[C@H]1CCCN(C(=O)c2cccc3ccccc23)C1	ZINC000819478037	JH	On-Demand	Anodyne	DRD3	20	40
COCCNC(=O)c1ccccc1NC(=O)[C@H]1CCCN(C(=O)c2cccc3ccccc23)C1	ZINC000819478037	JH	On-Demand	Anodyne	HCRTR1	21	40
COCCNC(=O)c1ccccc1NC(=O)[C@H]1CCCN(C(=O)c2cccc3ccccc23)C1	ZINC000819478037	JH	On-Demand	Anodyne	CCR8	42	34
COCCNC(=O)c1ccccc1NC(=O)[C@H]1CCCN(C(=O)c2cccc3ccccc23)C1	ZINC000819478037	JH	On-Demand	Anodyne	POLR1A	52	35
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCN(C(=O)c2cccc3ccccc23)C1	ZINC000819478038	JH	On-Demand	Anodyne	DRD3	20	40
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCN(C(=O)c2cccc3ccccc23)C1	ZINC000819478038	JH	On-Demand	Anodyne	HCRTR1	21	40
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCN(C(=O)c2cccc3ccccc23)C1	ZINC000819478038	JH	On-Demand	Anodyne	CCR8	42	34
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCN(C(=O)c2cccc3ccccc23)C1	ZINC000819478038	JH	On-Demand	Anodyne	POLR1A	52	35
O=C(O)CCNC(=O)N[C@@H](CO)c1ccccc1	ZINC000819478042	CC	On-Demand	Anodyne	MME	44	44
O=C(O)CCNC(=O)N[C@@H](CO)c1ccccc1	ZINC000819478042	CC	On-Demand	Anodyne	ANPEP	20	42
O=C(O)CCNC(=O)N[C@@H](CO)c1ccccc1	ZINC000819478042	CC	On-Demand	Anodyne	NAALAD2	41	41
O=C(O)CCNC(=O)N[C@@H](CO)c1ccccc1	ZINC000819478042	CC	On-Demand	Anodyne	SOAT1	23	42
O=C(O)CCNC(=O)N[C@H](CO)c1ccccc1	ZINC000819478043	CC	On-Demand	Anodyne	MME	44	44
O=C(O)CCNC(=O)N[C@H](CO)c1ccccc1	ZINC000819478043	CC	On-Demand	Anodyne	ANPEP	20	42
O=C(O)CCNC(=O)N[C@H](CO)c1ccccc1	ZINC000819478043	CC	On-Demand	Anodyne	NAALAD2	41	41
O=C(O)CCNC(=O)N[C@H](CO)c1ccccc1	ZINC000819478043	CC	On-Demand	Anodyne	SOAT1	23	42
O=C(O)CCNC(=O)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819478044	FE	On-Demand	Anodyne	GCGR	38	40
O=C(O)CCNC(=O)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819478044	FE	On-Demand	Anodyne	SLC6A5	28	41
O=C(O)CCNC(=O)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000819478044	FE	On-Demand	Anodyne	MCHR1	20	46
O=C(O)CCNC(=O)N1CCN(Cc2ccc3c(c2)OCCO3)CC1	ZINC000819478045	EC	On-Demand	Anodyne	NOS2	50	33
O=C(O)CCNC(=O)N1CCN(Cc2ccc3c(c2)OCCO3)CC1	ZINC000819478045	EC	On-Demand	Anodyne	FAAH	17	40
O=C(O)CCNC(=O)N1CCN(Cc2ccc3c(c2)OCCO3)CC1	ZINC000819478045	EC	On-Demand	Anodyne	MCHR1	29	43
O=C(O)CCNC(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000819478054	EG	On-Demand	Anodyne	RBP4	99	46
O=C(O)CCNC(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000819478054	EG	On-Demand	Anodyne	SFRP1	101	37
O=C(O)CCNC(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000819478054	EG	On-Demand	Anodyne	WNT3	80	37
O=C(O)CCNC(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000819478055	EG	On-Demand	Anodyne	RBP4	99	46
O=C(O)CCNC(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000819478055	EG	On-Demand	Anodyne	SFRP1	101	37
O=C(O)CCNC(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000819478055	EG	On-Demand	Anodyne	WNT3	80	37
O=C(O)CCNC(=O)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000819478059	FC	On-Demand	Anodyne	ADRB2	24	45
O=C(O)CCNC(=O)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000819478059	FC	On-Demand	Anodyne	ADRB1	43	45
O=C(O)CCNC(=O)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000819478059	FC	On-Demand	Anodyne	PTGFR	26	40
O=C(O)CCNC(=O)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000819478059	FC	On-Demand	Anodyne	ADRB3	27	41
O=C(O)CCNC(=O)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000819478059	FC	On-Demand	Anodyne	ACOX1	57	40
O=C(O)CCNC(=O)N1CCN(C[C@H](O)COc2ccccc2)CC1	ZINC000819478059	FC	On-Demand	Anodyne	ABCB1	90	48
O=C(O)CCNC(=O)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000819478060	FC	On-Demand	Anodyne	ADRB2	24	45
O=C(O)CCNC(=O)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000819478060	FC	On-Demand	Anodyne	ADRB1	43	45
O=C(O)CCNC(=O)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000819478060	FC	On-Demand	Anodyne	PTGFR	26	40
O=C(O)CCNC(=O)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000819478060	FC	On-Demand	Anodyne	ADRB3	27	41
O=C(O)CCNC(=O)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000819478060	FC	On-Demand	Anodyne	ACOX1	57	40
O=C(O)CCNC(=O)N1CCN(C[C@@H](O)COc2ccccc2)CC1	ZINC000819478060	FC	On-Demand	Anodyne	ABCB1	90	48
O=C(O)CCNC(=O)N1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000819478061	FC	On-Demand	Anodyne	DRD4	21	57
O=C(O)CCNC(=O)N1CCN(CC(=O)N2CCCc3ccccc32)CC1	ZINC000819478061	FC	On-Demand	Anodyne	AVPR2	38	42
O=C(O)CCNC(=O)N1CCN(CCc2ccccc2)CC1	ZINC000819478062	DD	On-Demand	Anodyne	HTR1A	31	48
O=C(O)CCNC(=O)N1CCN(CCc2ccccc2)CC1	ZINC000819478062	DD	On-Demand	Anodyne	DRD2	33	48
O=C(O)CCNC(=O)N1CCN(CCc2ccccc2)CC1	ZINC000819478062	DD	On-Demand	Anodyne	DRD4	23	44
O=C(O)CCNC(=O)N1CCN(CCc2ccccc2)CC1	ZINC000819478062	DD	On-Demand	Anodyne	HTR2A	28	50
O=C(O)CCNC(=O)N1CCN(CCc2ccccc2)CC1	ZINC000819478062	DD	On-Demand	Anodyne	HTR2C	15	47
O=C(O)CCNC(=O)N1CCN(CCc2ccccc2)CC1	ZINC000819478062	DD	On-Demand	Anodyne	OPRM1	18	47
O=C(O)CCNC(=O)N1CCN(CCc2ccccc2)CC1	ZINC000819478062	DD	On-Demand	Anodyne	DRD3	34	45
O=C(O)CCNC(=O)N1CCN(CCc2ccccc2)CC1	ZINC000819478062	DD	On-Demand	Anodyne	SLC6A3	20	43
O=C(O)CCNC(=O)N1CCN(CCc2ccccc2)CC1	ZINC000819478062	DD	On-Demand	Anodyne	HTR4	20	42
O=C(O)CCNC(=O)N1CCN(CCc2ccccc2)CC1	ZINC000819478062	DD	On-Demand	Anodyne	MME	19	46
O=C(O)CCNC(=O)N1CCN(CCc2ccccc2)CC1	ZINC000819478062	DD	On-Demand	Anodyne	HTR7	30	40
O=C(O)CCNC(=O)N1CCN(CCc2ccccc2)CC1	ZINC000819478062	DD	On-Demand	Anodyne	HRH3	18	44
O=C(O)CCNC(=O)N1CCN(CCc2ccccc2)CC1	ZINC000819478062	DD	On-Demand	Anodyne	SIGMAR1	58	52
O=C(O)CCNC(=O)N1CCN(CCc2ccccc2)CC1	ZINC000819478062	DD	On-Demand	Anodyne	FAAH	27	46
O=C(O)CCNC(=O)N1CCN(CCc2ccccc2)CC1	ZINC000819478062	DD	On-Demand	Anodyne	KCNJ1	41	37
O=C(O)CCNC(=O)N1CCN(Cc2ccncc2)CC1	ZINC000819478064	CC	On-Demand	Anodyne	SIGMAR1	18	40
O=C(O)CCNC(=O)N1CCN(Cc2ccncc2)CC1	ZINC000819478064	CC	On-Demand	Anodyne	FAAH	25	45
O=C(O)CCNC(=O)N1CCN(C2=NS(=O)(=O)c3ccccc32)CC1	ZINC000819478069	FB	On-Demand	Anodyne	KCNA3	17	41
O=C(O)CCNC(=O)N1CCC[C@@H]1c1ccncc1	ZINC000819478070	CD	On-Demand	Anodyne	PREP	33	40
O=C(O)CCNC(=O)N1CCC[C@H]1c1ccncc1	ZINC000819478071	CD	On-Demand	Anodyne	PREP	33	40
O=C(O)CCNC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819478072	DC	On-Demand	Bother	SSTR1	46	48
O=C(O)CCNC(=O)N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000819478075	FC	On-Demand	Anodyne	HTR1A	27	46
O=C(O)CCNC(=O)N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000819478075	FC	On-Demand	Anodyne	DRD2	27	46
O=C(O)CCNC(=O)N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000819478075	FC	On-Demand	Anodyne	DRD4	44	34
O=C(O)CCNC(=O)N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000819478075	FC	On-Demand	Anodyne	DRD3	45	42
O=C(O)CCNC(=O)N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000819478075	FC	On-Demand	Anodyne	HTR4	19	42
O=C(O)CCNC(=O)N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000819478075	FC	On-Demand	Anodyne	PLD1	63	37
O=C(O)CCNC(=O)N1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000819478075	FC	On-Demand	Anodyne	PLD2	98	35
O=C(O)CCNC(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000819478080	EG	On-Demand	Anodyne	FOLH1	19	42
O=C(O)CCNC(=O)N[C@@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000819478080	EG	On-Demand	Anodyne	PRCP	24	44
O=C(O)CCNC(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000819478081	EG	On-Demand	Anodyne	FOLH1	19	42
O=C(O)CCNC(=O)N[C@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000819478081	EG	On-Demand	Anodyne	PRCP	24	44
O=C(O)CCNC(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819478083	ED	On-Demand	Anodyne	FAAH	24	46
O=C(O)CCNC(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819478083	ED	On-Demand	Anodyne	Q8WSF8_APLCA	36	40
O=C(O)CCNC(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000819478083	ED	On-Demand	Anodyne	NACHRBETA2	49	40
O=C(O)CCNC(=O)N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819478087	FE	On-Demand	Anodyne	OPRM1	22	49
O=C(O)CCNC(=O)N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819478087	FE	On-Demand	Anodyne	OPRD1	25	49
O=C(O)CCNC(=O)N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819478087	FE	On-Demand	Anodyne	NAALAD2	34	42
O=C(O)CCNC(=O)N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819478087	FE	On-Demand	Anodyne	GRIA1	48	35
O=C(O)CCNC(=O)N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819478087	FE	On-Demand	Anodyne	F11	47	36
O=C(O)CCNC(=O)N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819478087	FE	On-Demand	Anodyne	PTPN1	42	50
O=C(O)CCNC(=O)N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819478088	FE	On-Demand	Anodyne	OPRM1	22	49
O=C(O)CCNC(=O)N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819478088	FE	On-Demand	Anodyne	OPRD1	25	49
O=C(O)CCNC(=O)N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819478088	FE	On-Demand	Anodyne	NAALAD2	34	42
O=C(O)CCNC(=O)N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819478088	FE	On-Demand	Anodyne	GRIA1	48	35
O=C(O)CCNC(=O)N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819478088	FE	On-Demand	Anodyne	F11	47	36
O=C(O)CCNC(=O)N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1	ZINC000819478088	FE	On-Demand	Anodyne	PTPN1	42	50
O=C(O)CCNC(=O)N[C@@H](c1ccccc1)c1cccc(Cl)c1	ZINC000819478089	EG	On-Demand	Anodyne	ADRB1	21	41
O=C(O)CCNC(=O)N[C@H](c1ccccc1)c1cccc(Cl)c1	ZINC000819478090	EG	On-Demand	Anodyne	ADRB1	21	41
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000819478092	EC	On-Demand	Anodyne	MME	53	44
O=C(O)CCNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000819478092	EC	On-Demand	Anodyne	NAALAD2	29	41
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000819478093	EC	On-Demand	Anodyne	MME	53	44
O=C(O)CCNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000819478093	EC	On-Demand	Anodyne	NAALAD2	29	41
O=C(O)CCNC(=O)N1CCC[C@@H](N2CCCC2)CC1	ZINC000819478104	CD	On-Demand	Anodyne	L3MBTL3	95	48
O=C(O)CCNC(=O)N1CCC[C@H](N2CCCC2)CC1	ZINC000819478105	CD	On-Demand	Anodyne	L3MBTL3	95	48
O=C(O)CCNC(=O)N1CC[C@]2(CCCN(Cc3ccccc3)C2)C1	ZINC000819478106	EE	On-Demand	Anodyne	EPHX2	20	44
O=C(O)CCNC(=O)N1CC[C@]2(CCCN(Cc3ccccc3)C2)C1	ZINC000819478106	EE	On-Demand	Anodyne	NPFFR1	43	42
O=C(O)CCNC(=O)N1CC[C@@]2(CCCN(Cc3ccccc3)C2)C1	ZINC000819478107	EE	On-Demand	Anodyne	EPHX2	20	44
O=C(O)CCNC(=O)N1CC[C@@]2(CCCN(Cc3ccccc3)C2)C1	ZINC000819478107	EE	On-Demand	Anodyne	NPFFR1	43	42
COCCNC(=O)c1ccccc1NC(=O)Cn1cccn1	ZINC000819478189	DC	On-Demand	Anodyne	POLR1A	59	38
O=C1CCCN1NC(=O)C1(c2ccc(Cl)cc2Cl)CCCCC1	ZINC000819478220	FH	On-Demand	Anodyne	CNR1	50	31
O=C1CCCN1NC(=O)C1(c2ccc(Cl)cc2Cl)CCCCC1	ZINC000819478220	FH	On-Demand	Anodyne	UGCG	34	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)c1	ZINC000819478221	FG	On-Demand	Anodyne	ADRB2	15	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)c1	ZINC000819478222	FG	On-Demand	Anodyne	ADRB2	15	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)c1	ZINC000819478223	FG	On-Demand	Anodyne	ADRB2	15	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)c1	ZINC000819478224	FG	On-Demand	Anodyne	ADRB2	15	42
O[C@H]1CCCc2cc(NC[C@@H](O)COc3cccc(C(F)(F)F)c3)ccc21	ZINC000819478232	GH	On-Demand	Anodyne	ADRB1	18	41
O[C@H]1CCCc2cc(NC[C@@H](O)COc3cccc(C(F)(F)F)c3)ccc21	ZINC000819478232	GH	On-Demand	Anodyne	PDS	44	39
O[C@@H](CNc1ccc2c(c1)CCC[C@@H]2O)COc1cccc(C(F)(F)F)c1	ZINC000819478233	GH	On-Demand	Anodyne	ADRB1	18	41
O[C@@H](CNc1ccc2c(c1)CCC[C@@H]2O)COc1cccc(C(F)(F)F)c1	ZINC000819478233	GH	On-Demand	Anodyne	PDS	44	39
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1cccc(C(F)(F)F)c1	ZINC000819478234	GH	On-Demand	Anodyne	ADRB1	18	41
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1cccc(C(F)(F)F)c1	ZINC000819478234	GH	On-Demand	Anodyne	PDS	44	39
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1cccc(C(F)(F)F)c1	ZINC000819478235	GH	On-Demand	Anodyne	ADRB1	18	41
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1cccc(C(F)(F)F)c1	ZINC000819478235	GH	On-Demand	Anodyne	PDS	44	39
COCCNC(=O)c1ccccc1NC(=O)c1cc(C(C)=O)cn1C	ZINC000819478270	ED	On-Demand	Anodyne	HRAS	47	30
COCCNC(=O)c1ccccc1NC(=O)c1cc(C(C)=O)cn1C	ZINC000819478270	ED	On-Demand	Anodyne	POLR1A	45	36
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)c1	ZINC000819478356	FG	On-Demand	Anodyne	ADRB2	29	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)c1	ZINC000819478356	FG	On-Demand	Anodyne	ADRB1	34	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)c1	ZINC000819478356	FG	On-Demand	Anodyne	ABCB1	15	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)c1	ZINC000819478357	FG	On-Demand	Anodyne	ADRB2	29	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)c1	ZINC000819478357	FG	On-Demand	Anodyne	ADRB1	34	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)c1	ZINC000819478357	FG	On-Demand	Anodyne	ABCB1	15	42
O=C(/C=C/[C@@H]1CCCO1)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000819478375	GI	On-Demand	Anodyne	CPT1A	65	47
O=C(/C=C\[C@@H]1CCCO1)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000819478376	GI	On-Demand	Anodyne	CPT1A	65	47
O=C(/C=C/[C@@H]1CCCO1)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000819478377	GI	On-Demand	Anodyne	CPT1A	65	47
O=C(/C=C\[C@@H]1CCCO1)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000819478378	GI	On-Demand	Anodyne	CPT1A	65	47
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819478416	GG	On-Demand	Anodyne	ADRB2	23	40
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819478416	GG	On-Demand	Anodyne	ADRB1	50	40
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819478416	GG	On-Demand	Anodyne	ADRB3	29	40
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819478417	GG	On-Demand	Anodyne	ADRB2	23	40
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819478417	GG	On-Demand	Anodyne	ADRB1	50	40
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819478417	GG	On-Demand	Anodyne	ADRB3	29	40
O[C@H]1CCCc2cc(NC[C@@H](O)COc3ccc(F)cc3)ccc21	ZINC000819478418	EG	On-Demand	Anodyne	ADRB1	43	42
O[C@@H](CNc1ccc2c(c1)CCC[C@@H]2O)COc1ccc(F)cc1	ZINC000819478419	EG	On-Demand	Anodyne	ADRB1	43	42
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccc(F)cc1	ZINC000819478420	EG	On-Demand	Anodyne	ADRB1	43	42
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccc(F)cc1	ZINC000819478421	EG	On-Demand	Anodyne	ADRB1	43	42
COCCNC(=O)c1ccccc1NC(=O)[C@H]1CCCN(C(=O)c2ccc(OC)c3ccccc23)C1	ZINC000819478423	JH	On-Demand	Anodyne	DRD3	28	40
COCCNC(=O)c1ccccc1NC(=O)[C@@H]1CCCN(C(=O)c2ccc(OC)c3ccccc23)C1	ZINC000819478424	JH	On-Demand	Anodyne	DRD3	28	40
COc1cccc(C2=CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C2)c1	ZINC000819478468	GH	On-Demand	Mild	PAPA1_CARPA	36	40
COc1cccc(C2=CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C2)c1	ZINC000819478469	GH	On-Demand	Mild	PAPA1_CARPA	36	40
CSc1cc(O)ccc1NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819478475	FF	On-Demand	Anodyne	ADRB3	26	42
CSc1cc(O)ccc1NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819478476	FF	On-Demand	Anodyne	ADRB3	26	42
Cc1ccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)c(C)c1	ZINC000819478549	EH	On-Demand	Anodyne	ADRB2	20	47
Cc1ccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)c(C)c1	ZINC000819478550	EH	On-Demand	Anodyne	ADRB2	20	47
O=C(C(F)=C1CCC1)N1CCOC[C@H]1c1noc(-c2ccccc2)n1	ZINC000819478557	EG	On-Demand	Anodyne	CPT1A	37	41
O=C(C(F)=C1CCC1)N1CCOC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000819478558	EG	On-Demand	Anodyne	CPT1A	37	41
Cc1ccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478561	EG	On-Demand	Anodyne	ADRB2	38	52
Cc1ccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478561	EG	On-Demand	Anodyne	ADRB1	46	44
Cc1ccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478561	EG	On-Demand	Anodyne	ADRB3	29	44
Cc1ccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478562	EG	On-Demand	Anodyne	ADRB2	38	52
Cc1ccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478562	EG	On-Demand	Anodyne	ADRB1	46	44
Cc1ccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478562	EG	On-Demand	Anodyne	ADRB3	29	44
CCOc1ccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478588	FG	On-Demand	Anodyne	ADRB2	37	44
CCOc1ccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478588	FG	On-Demand	Anodyne	ADRB1	44	44
CCOc1ccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478588	FG	On-Demand	Anodyne	ADRB3	28	44
CCOc1ccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478589	FG	On-Demand	Anodyne	ADRB2	37	44
CCOc1ccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478589	FG	On-Demand	Anodyne	ADRB1	44	44
CCOc1ccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478589	FG	On-Demand	Anodyne	ADRB3	28	44
O=C(C(F)=C1CCC1)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000819478596	FJ	On-Demand	Anodyne	CPT1A	115	51
O=C(C(F)=C1CCC1)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000819478597	FJ	On-Demand	Anodyne	CPT1A	115	51
Cc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478650	EG	On-Demand	Anodyne	ADRB2	28	47
Cc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478650	EG	On-Demand	Anodyne	ADRB1	42	43
Cc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478651	EG	On-Demand	Anodyne	ADRB2	28	47
Cc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478651	EG	On-Demand	Anodyne	ADRB1	42	43
Cc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478652	EG	On-Demand	Anodyne	ADRB2	28	47
Cc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478652	EG	On-Demand	Anodyne	ADRB1	42	43
Cc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478653	EG	On-Demand	Anodyne	ADRB2	28	47
Cc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478653	EG	On-Demand	Anodyne	ADRB1	42	43
O[C@H]1CCCc2cc(NC[C@@H](O)COc3ccccc3)ccc21	ZINC000819478670	DF	On-Demand	Anodyne	ADRB2	42	44
O[C@H]1CCCc2cc(NC[C@@H](O)COc3ccccc3)ccc21	ZINC000819478670	DF	On-Demand	Anodyne	ADRB1	62	43
O[C@H]1CCCc2cc(NC[C@@H](O)COc3ccccc3)ccc21	ZINC000819478670	DF	On-Demand	Anodyne	ADRB3	36	43
O[C@@H](CNc1ccc2c(c1)CCC[C@@H]2O)COc1ccccc1	ZINC000819478671	DF	On-Demand	Anodyne	ADRB2	42	44
O[C@@H](CNc1ccc2c(c1)CCC[C@@H]2O)COc1ccccc1	ZINC000819478671	DF	On-Demand	Anodyne	ADRB1	62	43
O[C@@H](CNc1ccc2c(c1)CCC[C@@H]2O)COc1ccccc1	ZINC000819478671	DF	On-Demand	Anodyne	ADRB3	36	43
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccccc1	ZINC000819478672	DF	On-Demand	Anodyne	ADRB2	42	44
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccccc1	ZINC000819478672	DF	On-Demand	Anodyne	ADRB1	62	43
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccccc1	ZINC000819478672	DF	On-Demand	Anodyne	ADRB3	36	43
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccccc1	ZINC000819478673	DF	On-Demand	Anodyne	ADRB2	42	44
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccccc1	ZINC000819478673	DF	On-Demand	Anodyne	ADRB1	62	43
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccccc1	ZINC000819478673	DF	On-Demand	Anodyne	ADRB3	36	43
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)c1ccc(OC(F)(F)F)cc1	ZINC000819478688	FI	On-Demand	Anodyne	GIPR	19	40
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)c1ccc(OC(F)(F)F)cc1	ZINC000819478689	FI	On-Demand	Anodyne	GIPR	19	40
O[C@H]1CCCc2cc(NC[C@H](O)c3ccc(OC(F)(F)F)cc3)ccc21	ZINC000819478690	FI	On-Demand	Anodyne	GIPR	19	40
O[C@H](CNc1ccc2c(c1)CCC[C@@H]2O)c1ccc(OC(F)(F)F)cc1	ZINC000819478691	FI	On-Demand	Anodyne	GIPR	19	40
O[C@H](CNc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)COc1cccc2[nH]ccc12	ZINC000819478698	GI	On-Demand	Anodyne	ADRB1	18	55
O[C@H](CNc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)COc1cccc2[nH]ccc12	ZINC000819478698	GI	On-Demand	Anodyne	HTR1A	15	55
O[C@H](CNc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)COc1cccc2[nH]ccc12	ZINC000819478698	GI	On-Demand	Anodyne	SLC6A4	19	46
O[C@@H](CNc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)COc1cccc2[nH]ccc12	ZINC000819478699	GI	On-Demand	Anodyne	ADRB1	18	55
O[C@@H](CNc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)COc1cccc2[nH]ccc12	ZINC000819478699	GI	On-Demand	Anodyne	HTR1A	15	55
O[C@@H](CNc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)COc1cccc2[nH]ccc12	ZINC000819478699	GI	On-Demand	Anodyne	SLC6A4	19	46
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC=C(c3cccc(OC)c3)C1)C2	ZINC000819478704	FF	On-Demand	Anodyne	ADAM10	17	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC=C(c3cccc(OC)c3)C1)C2	ZINC000819478705	FF	On-Demand	Anodyne	ADAM10	17	43
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(C)c(OC)cc2C)cc1	ZINC000819478718	FF	On-Demand	Anodyne	ADRB2	37	47
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(C)c(OC)cc2C)cc1	ZINC000819478718	FF	On-Demand	Anodyne	ADRB1	45	41
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(C)c(OC)cc2C)cc1	ZINC000819478718	FF	On-Demand	Anodyne	ADRB3	24	41
COC(=O)c1ccc(OC[C@H](O)CNc2cc(C)c(OC)cc2C)cc1	ZINC000819478719	FF	On-Demand	Anodyne	ADRB2	37	47
COC(=O)c1ccc(OC[C@H](O)CNc2cc(C)c(OC)cc2C)cc1	ZINC000819478719	FF	On-Demand	Anodyne	ADRB1	45	41
COC(=O)c1ccc(OC[C@H](O)CNc2cc(C)c(OC)cc2C)cc1	ZINC000819478719	FF	On-Demand	Anodyne	ADRB3	24	41
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478736	FG	On-Demand	Anodyne	ADRB2	31	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478736	FG	On-Demand	Anodyne	ADRB1	46	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478736	FG	On-Demand	Anodyne	ADRB3	28	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478737	FG	On-Demand	Anodyne	ADRB2	31	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478737	FG	On-Demand	Anodyne	ADRB1	46	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478737	FG	On-Demand	Anodyne	ADRB3	28	42
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478762	GF	On-Demand	Anodyne	ADRB2	36	46
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478762	GF	On-Demand	Anodyne	ADRB1	52	42
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478762	GF	On-Demand	Anodyne	ADRB3	35	42
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478763	GF	On-Demand	Anodyne	ADRB2	36	46
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478763	GF	On-Demand	Anodyne	ADRB1	52	42
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819478763	GF	On-Demand	Anodyne	ADRB3	35	42
O=C(C(F)=C1CCC1)N1CCCCC[C@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000819478764	FJ	On-Demand	Anodyne	CPT1A	65	47
O=C(C(F)=C1CCC1)N1CCCCC[C@@H]1c1noc(-c2ccc(F)cc2)n1	ZINC000819478765	FJ	On-Demand	Anodyne	CPT1A	65	47
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccccc1Cl	ZINC000819478811	EH	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccccc1Cl	ZINC000819478812	EH	On-Demand	Anodyne	ADRB2	19	40
O[C@H]1CCCc2cc(NC[C@@H](O)COc3ccccc3Cl)ccc21	ZINC000819478813	EH	On-Demand	Anodyne	ADRB2	19	40
O[C@@H](CNc1ccc2c(c1)CCC[C@@H]2O)COc1ccccc1Cl	ZINC000819478814	EH	On-Demand	Anodyne	ADRB2	19	40
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478849	FF	On-Demand	Anodyne	ADRB2	31	41
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478849	FF	On-Demand	Anodyne	ADRB1	58	40
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478849	FF	On-Demand	Anodyne	ADRB3	36	40
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478849	FF	On-Demand	Anodyne	ACR	42	36
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478850	FF	On-Demand	Anodyne	ADRB2	31	41
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478850	FF	On-Demand	Anodyne	ADRB1	58	40
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478850	FF	On-Demand	Anodyne	ADRB3	36	40
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478850	FF	On-Demand	Anodyne	ACR	42	36
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478851	FF	On-Demand	Anodyne	ADRB2	31	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478851	FF	On-Demand	Anodyne	ADRB1	58	40
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478851	FF	On-Demand	Anodyne	ADRB3	36	40
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478851	FF	On-Demand	Anodyne	ACR	42	36
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478852	FF	On-Demand	Anodyne	ADRB2	31	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478852	FF	On-Demand	Anodyne	ADRB1	58	40
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478852	FF	On-Demand	Anodyne	ADRB3	36	40
COC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478852	FF	On-Demand	Anodyne	ACR	42	36
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478887	FG	On-Demand	Anodyne	ADRB2	22	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478887	FG	On-Demand	Anodyne	ADRB1	49	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478888	FG	On-Demand	Anodyne	ADRB2	22	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478888	FG	On-Demand	Anodyne	ADRB1	49	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478889	FG	On-Demand	Anodyne	ADRB2	22	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478889	FG	On-Demand	Anodyne	ADRB1	49	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478890	FG	On-Demand	Anodyne	ADRB2	22	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478890	FG	On-Demand	Anodyne	ADRB1	49	43
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478891	FF	On-Demand	Anodyne	ADRB2	30	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478891	FF	On-Demand	Anodyne	ADRB1	64	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478891	FF	On-Demand	Anodyne	ADRB3	37	45
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478892	FF	On-Demand	Anodyne	ADRB2	30	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478892	FF	On-Demand	Anodyne	ADRB1	64	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478892	FF	On-Demand	Anodyne	ADRB3	37	45
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478893	FF	On-Demand	Anodyne	ADRB2	30	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478893	FF	On-Demand	Anodyne	ADRB1	64	54
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478893	FF	On-Demand	Anodyne	ADRB3	37	45
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478894	FF	On-Demand	Anodyne	ADRB2	30	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478894	FF	On-Demand	Anodyne	ADRB1	64	54
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478894	FF	On-Demand	Anodyne	ADRB3	37	45
N#Cc1cccc(S(=O)(=O)CCNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)c1	ZINC000819478895	GG	On-Demand	Mild	ITGA4	41	30
N#Cc1ccc(S(=O)(=O)CCNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819478896	FF	On-Demand	Mild	HTR6	41	33
N#Cc1ccc(S(=O)(=O)CCNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819478897	FF	On-Demand	Mild	HTR6	41	33
CCOc1ccc(OC[C@@H](O)CNc2ccc(COC)cc2)cc1	ZINC000819478977	EG	On-Demand	Anodyne	ADRB2	59	49
CCOc1ccc(OC[C@@H](O)CNc2ccc(COC)cc2)cc1	ZINC000819478977	EG	On-Demand	Anodyne	ADRB1	75	49
CCOc1ccc(OC[C@@H](O)CNc2ccc(COC)cc2)cc1	ZINC000819478977	EG	On-Demand	Anodyne	GRIN1	25	40
CCOc1ccc(OC[C@@H](O)CNc2ccc(COC)cc2)cc1	ZINC000819478977	EG	On-Demand	Anodyne	ADRB3	50	46
CCOc1ccc(OC[C@H](O)CNc2ccc(COC)cc2)cc1	ZINC000819478979	EG	On-Demand	Anodyne	ADRB2	59	49
CCOc1ccc(OC[C@H](O)CNc2ccc(COC)cc2)cc1	ZINC000819478979	EG	On-Demand	Anodyne	ADRB1	75	49
CCOc1ccc(OC[C@H](O)CNc2ccc(COC)cc2)cc1	ZINC000819478979	EG	On-Demand	Anodyne	GRIN1	25	40
CCOc1ccc(OC[C@H](O)CNc2ccc(COC)cc2)cc1	ZINC000819478979	EG	On-Demand	Anodyne	ADRB3	50	46
O=C(/C=C\[C@@H]1CCCO1)N1CCOC[C@H]1c1noc(-c2ccccc2)n1	ZINC000819478995	FE	On-Demand	Anodyne	CPT1A	46	43
O=C(/C=C/[C@@H]1CCCO1)N1CCOC[C@H]1c1noc(-c2ccccc2)n1	ZINC000819478996	FE	On-Demand	Anodyne	CPT1A	46	43
O=C(/C=C\[C@@H]1CCCO1)N1CCOC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000819478997	FE	On-Demand	Anodyne	CPT1A	46	43
O=C(/C=C/[C@@H]1CCCO1)N1CCOC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000819478999	FE	On-Demand	Anodyne	CPT1A	46	43
CSc1ccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819479103	FH	On-Demand	Anodyne	ADRB2	26	42
CSc1ccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819479103	FH	On-Demand	Anodyne	ADRB1	36	42
CSc1ccc(OC[C@@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819479103	FH	On-Demand	Anodyne	ADRB3	23	42
CSc1ccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819479104	FH	On-Demand	Anodyne	ADRB2	26	42
CSc1ccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819479104	FH	On-Demand	Anodyne	ADRB1	36	42
CSc1ccc(OC[C@H](O)CNc2ccc(O)cc2OC(C)C)cc1	ZINC000819479104	FH	On-Demand	Anodyne	ADRB3	23	42
O=C(/C=C\[C@@H]1CCCO1)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000819479105	FH	On-Demand	Anodyne	CPT1A	112	52
O=C(/C=C\[C@@H]1CCCO1)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000819479106	FH	On-Demand	Anodyne	CPT1A	112	52
O=C(/C=C/[C@@H]1CCCO1)N1CCCCC[C@H]1c1noc(-c2ccccc2)n1	ZINC000819479107	FH	On-Demand	Anodyne	CPT1A	112	52
COc1cccc(C2=CCN(C(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)C2)c1	ZINC000819479113	FF	On-Demand	Anodyne	ADAM10	23	44
O=S(=O)(CCNc1ccc2c(c1)CCC[C@H]2O)c1ccccc1	ZINC000819479146	EF	On-Demand	Anodyne	HTR6	48	39
O=S(=O)(CCNc1ccc2c(c1)CCC[C@@H]2O)c1ccccc1	ZINC000819479147	EF	On-Demand	Anodyne	HTR6	48	39
O[C@H](CNc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)COc1ccccc1	ZINC000819479156	EH	On-Demand	Anodyne	ADRB2	30	41
O[C@H](CNc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)COc1ccccc1	ZINC000819479156	EH	On-Demand	Anodyne	ADRB1	50	39
O[C@@H](CNc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)COc1ccccc1	ZINC000819479157	EH	On-Demand	Anodyne	ADRB2	30	41
O[C@@H](CNc1ccc(N2C[C@H]3CC[C@H]2C3)cc1)COc1ccccc1	ZINC000819479157	EH	On-Demand	Anodyne	ADRB1	50	39
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819479173	FF	On-Demand	Anodyne	HTR6	41	33
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819479174	FF	On-Demand	Anodyne	HTR6	41	33
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819479175	FF	On-Demand	Anodyne	HTR6	41	33
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819479176	FF	On-Demand	Anodyne	HTR6	41	33
COCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000819479185	JH	On-Demand	Anodyne	CHRM2	22	43
COCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000819479185	JH	On-Demand	Anodyne	DRD4	17	40
COCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000819479185	JH	On-Demand	Anodyne	DRD3	26	42
COCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000819479185	JH	On-Demand	Anodyne	CCR8	67	34
COCCNC(=O)c1ccccc1NC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000819479185	JH	On-Demand	Anodyne	POLR1A	61	35
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)c1	ZINC000819479186	FF	On-Demand	Bother	ADRB1	19	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)c1	ZINC000819479187	FF	On-Demand	Bother	ADRB1	19	44
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)c1	ZINC000819479188	FF	On-Demand	Bother	ADRB1	19	44
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)c1	ZINC000819479189	FF	On-Demand	Bother	ADRB1	19	44
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccccc1F	ZINC000819479190	EG	On-Demand	Anodyne	ADRB2	18	40
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccccc1F	ZINC000819479190	EG	On-Demand	Anodyne	ADRB1	40	32
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccccc1F	ZINC000819479191	EG	On-Demand	Anodyne	ADRB2	18	40
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccccc1F	ZINC000819479191	EG	On-Demand	Anodyne	ADRB1	40	32
O[C@H]1CCCc2cc(NC[C@@H](O)COc3ccccc3F)ccc21	ZINC000819479192	EG	On-Demand	Anodyne	ADRB2	18	40
O[C@H]1CCCc2cc(NC[C@@H](O)COc3ccccc3F)ccc21	ZINC000819479192	EG	On-Demand	Anodyne	ADRB1	40	32
O=C(/C=C/[C@@H]1CCCO1)N1CCCCC[C@@H]1c1noc(-c2ccccc2)n1	ZINC000819479193	FH	On-Demand	Anodyne	CPT1A	112	52
O[C@@H](CNc1ccc2c(c1)CCC[C@@H]2O)COc1ccccc1F	ZINC000819479194	EG	On-Demand	Anodyne	ADRB2	18	40
O[C@@H](CNc1ccc2c(c1)CCC[C@@H]2O)COc1ccccc1F	ZINC000819479194	EG	On-Demand	Anodyne	ADRB1	40	32
O[C@H]1CCCc2cc(NC[C@@H](O)COc3ccc(Cl)cc3)ccc21	ZINC000819479196	EH	On-Demand	Anodyne	ADRB1	40	42
O[C@@H](CNc1ccc2c(c1)CCC[C@@H]2O)COc1ccc(Cl)cc1	ZINC000819479197	EH	On-Demand	Anodyne	ADRB1	40	42
O[C@@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccc(Cl)cc1	ZINC000819479198	EH	On-Demand	Anodyne	ADRB1	40	42
O[C@H](CNc1ccc2c(c1)CCC[C@H]2O)COc1ccc(Cl)cc1	ZINC000819479199	EH	On-Demand	Anodyne	ADRB1	40	42
O=[N+]([O-])c1ccc([C@H](O)CNc2ccc(C3CCC3)cc2)cc1	ZINC000819479258	DI	On-Demand	Bother	SLC27A4	42	31
O=[N+]([O-])c1ccc([C@@H](O)CNc2ccc(C3CCC3)cc2)cc1	ZINC000819479259	DI	On-Demand	Bother	SLC27A4	42	31
COCCNC(=O)c1ccccc1NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-]	ZINC000819479288	IF	On-Demand	Bother	KCNMA1	25	42
COc1cc(C)cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1C	ZINC000819479333	DG	On-Demand	Bother	CACNA1C	47	35
COc1cc(C)cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1C	ZINC000819479333	DG	On-Demand	Bother	CACNA1D	71	35
COc1cc(C)cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1C	ZINC000819479334	DG	On-Demand	Bother	CACNA1C	47	35
COc1cc(C)cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1C	ZINC000819479334	DG	On-Demand	Bother	CACNA1D	71	35
COCCNC(=O)c1ccccc1NC(=O)Cc1csc2nc(-c3ccccc3)cn12	ZINC000819479340	IH	On-Demand	Anodyne	POLR1A	46	35
COCCc1ccc(OC[C@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819479350	GH	On-Demand	Anodyne	ADRB2	27	49
COCCc1ccc(OC[C@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819479350	GH	On-Demand	Anodyne	ADRB1	56	49
COCCc1ccc(OC[C@@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819479351	GH	On-Demand	Anodyne	ADRB2	27	49
COCCc1ccc(OC[C@@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819479351	GH	On-Demand	Anodyne	ADRB1	56	49
Cc1ccc(OC[C@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819479372	FH	On-Demand	Anodyne	ADRB2	20	44
Cc1ccc(OC[C@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819479372	FH	On-Demand	Anodyne	ADRB1	31	45
Cc1ccc(OC[C@@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819479373	FH	On-Demand	Anodyne	ADRB2	20	44
Cc1ccc(OC[C@@H](O)CNc2ccc(N3C[C@H]4CC[C@H]3C4)cc2)cc1	ZINC000819479373	FH	On-Demand	Anodyne	ADRB1	31	45
O=C(NN1CCCC1=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819479415	FE	On-Demand	Anodyne	CNR1	64	39
Cc1ccc2c(c1)[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H](C)C2	ZINC000819479472	GH	On-Demand	Mild	PAPA1_CARPA	42	42
Cc1ccc2c(c1)[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@H](C)C2	ZINC000819479473	GH	On-Demand	Mild	PAPA1_CARPA	42	42
Cc1ccc2c(c1)[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H](C)C2	ZINC000819479475	GH	On-Demand	Mild	PAPA1_CARPA	42	42
Cc1ccc2c(c1)[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@H](C)C2	ZINC000819479477	GH	On-Demand	Mild	PAPA1_CARPA	42	42
O[C@@H](CNc1ccc2nc(-c3ccccc3)[nH]c2c1)C1CC1	ZINC000819479507	CG	On-Demand	Anodyne	HPSE	19	40
O[C@@H](CNc1ccc2nc(-c3ccccc3)[nH]c2c1)C1CC1	ZINC000819479507	CG	On-Demand	Anodyne	NR2E3	69	38
O[C@H](CNc1ccc2nc(-c3ccccc3)[nH]c2c1)C1CC1	ZINC000819479508	CG	On-Demand	Anodyne	HPSE	19	40
O[C@H](CNc1ccc2nc(-c3ccccc3)[nH]c2c1)C1CC1	ZINC000819479508	CG	On-Demand	Anodyne	NR2E3	69	38
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819479509	FG	On-Demand	Anodyne	ADRB2	35	53
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819479509	FG	On-Demand	Anodyne	ADRB1	63	53
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819479509	FG	On-Demand	Anodyne	ADRB3	42	38
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819479512	FG	On-Demand	Anodyne	ADRB2	35	53
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819479512	FG	On-Demand	Anodyne	ADRB1	63	53
COCCc1ccc(OC[C@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819479512	FG	On-Demand	Anodyne	ADRB3	42	38
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819479514	FG	On-Demand	Anodyne	ADRB2	35	53
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819479514	FG	On-Demand	Anodyne	ADRB1	63	53
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@H]3O)cc1	ZINC000819479514	FG	On-Demand	Anodyne	ADRB3	42	38
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819479516	FG	On-Demand	Anodyne	ADRB2	35	53
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819479516	FG	On-Demand	Anodyne	ADRB1	63	53
COCCc1ccc(OC[C@@H](O)CNc2ccc3c(c2)CCC[C@@H]3O)cc1	ZINC000819479516	FG	On-Demand	Anodyne	ADRB3	42	38
Cc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1OC(C)C	ZINC000819479519	EH	On-Demand	Bother	CACNA1D	51	34
Cc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1OC(C)C	ZINC000819479520	EH	On-Demand	Bother	CACNA1D	51	34
COCCNC(=O)c1ccccc1NC(=O)CCc1cccc(Cl)c1	ZINC000819479528	FG	On-Demand	Anodyne	SLC6A5	21	45
COCCNC(=O)c1ccccc1NC(=O)CCc1cccc(Cl)c1	ZINC000819479528	FG	On-Demand	Anodyne	HCAR2	37	48
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(SC)cc2OC)cc1	ZINC000819479612	GG	On-Demand	Anodyne	ADRB2	30	43
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(SC)cc2OC)cc1	ZINC000819479612	GG	On-Demand	Anodyne	ADRB1	46	40
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(SC)cc2OC)cc1	ZINC000819479612	GG	On-Demand	Anodyne	ADRB3	24	40
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(SC)cc2OC)cc1	ZINC000819479613	GG	On-Demand	Anodyne	ADRB2	30	43
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(SC)cc2OC)cc1	ZINC000819479613	GG	On-Demand	Anodyne	ADRB1	46	40
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(SC)cc2OC)cc1	ZINC000819479613	GG	On-Demand	Anodyne	ADRB3	24	40
COc1cc(C)cc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1C	ZINC000819479616	GH	On-Demand	Anodyne	GPR119	48	44
COc1cc(C)cc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c1C	ZINC000819479617	GH	On-Demand	Anodyne	GPR119	48	44
C[C@H](C#N)Oc1ccccc1NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819479648	FI	On-Demand	Mild	VIPR1	22	41
C[C@@H](C#N)Oc1ccccc1NC(=O)CCc1cccc(OC(F)F)c1	ZINC000819479649	FI	On-Demand	Mild	VIPR1	22	41
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccc(C3CCC3)cc2)cc1	ZINC000819479659	EH	On-Demand	Anodyne	GHSR	15	44
CS(=O)(=O)c1ccc([C@H](O)CNc2ccc(C3CCC3)cc2)cc1	ZINC000819479660	EH	On-Demand	Anodyne	GHSR	15	44
COCCNC(=O)c1ccccc1NC(=O)CCc1ccc(OC)c(F)c1	ZINC000819479745	FF	On-Demand	Anodyne	CNR2	34	40
COCCNC(=O)c1ccccc1NC(=O)CCc1ccc(OC)c(F)c1	ZINC000819479745	FF	On-Demand	Anodyne	HCAR2	38	50
COCCNC(=O)c1ccccc1NC(=O)CCc1ccc(OC)c(F)c1	ZINC000819479745	FF	On-Demand	Anodyne	ABCG2	15	42
CN(Cc1cnc(N(C)C)nc1)C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819479750	GE	On-Demand	Mild	PAPA1_CARPA	44	41
CN(Cc1cnc(N(C)C)nc1)C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819479751	GE	On-Demand	Mild	PAPA1_CARPA	44	41
CN1CCC(C)(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819479767	FE	On-Demand	Mild	PAPA1_CARPA	40	50
CN1CCC(C)(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819479768	FE	On-Demand	Mild	PAPA1_CARPA	40	50
CCOc1ccc(OC[C@@H](O)CNc2ccc(SC)cc2OC)cc1	ZINC000819479781	FH	On-Demand	Anodyne	ADRB2	27	40
CCOc1ccc(OC[C@H](O)CNc2ccc(SC)cc2OC)cc1	ZINC000819479782	FH	On-Demand	Anodyne	ADRB2	27	40
COc1cccc(NNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819479787	FE	On-Demand	Reactive	PAPA1_CARPA	53	47
COc1cccc(NNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819479788	FE	On-Demand	Reactive	PAPA1_CARPA	53	47
O[C@@H](CNc1ccc(C2CCC2)cc1)c1cccnc1	ZINC000819479791	CG	On-Demand	Anodyne	ADRB1	22	43
O[C@@H](CNc1ccc(C2CCC2)cc1)c1cccnc1	ZINC000819479791	CG	On-Demand	Anodyne	ADRB3	91	50
O[C@H](CNc1ccc(C2CCC2)cc1)c1cccnc1	ZINC000819479792	CG	On-Demand	Anodyne	ADRB1	22	43
O[C@H](CNc1ccc(C2CCC2)cc1)c1cccnc1	ZINC000819479792	CG	On-Demand	Anodyne	ADRB3	91	50
COc1cc(C)cc(NC[C@H](O)c2cccnc2)c1C	ZINC000819479818	CF	On-Demand	Anodyne	ADRB1	18	43
COc1cc(C)cc(NC[C@H](O)c2cccnc2)c1C	ZINC000819479818	CF	On-Demand	Anodyne	ADRB3	51	43
COc1cc(C)cc(NC[C@@H](O)c2cccnc2)c1C	ZINC000819479819	CF	On-Demand	Anodyne	ADRB1	18	43
COc1cc(C)cc(NC[C@@H](O)c2cccnc2)c1C	ZINC000819479819	CF	On-Demand	Anodyne	ADRB3	51	43
COCCNC(=O)c1ccccc1NC(=O)c1cc2ccccc2nc1C	ZINC000819479835	FG	On-Demand	Anodyne	AKR1B10	40	32
COCCNC(=O)c1ccccc1NC(=O)c1cc2ccccc2nc1C	ZINC000819479835	FG	On-Demand	Anodyne	POLR1A	82	45
COc1cccc([S@@](=O)CC(=O)Nc2nnc3n2CCCC3)c1	ZINC000819479848	ED	On-Demand	Anodyne	DRD4	41	32
COc1cc(C)cc(NC[C@H](O)c2ccccc2)c1C	ZINC000819479957	CG	On-Demand	Anodyne	ADRB3	30	40
COc1cc(C)cc(NC[C@H](O)c2ccccc2)c1C	ZINC000819479957	CG	On-Demand	Anodyne	AOC3	15	40
COc1cc(C)cc(NC[C@@H](O)c2ccccc2)c1C	ZINC000819479958	CG	On-Demand	Anodyne	ADRB3	30	40
COc1cc(C)cc(NC[C@@H](O)c2ccccc2)c1C	ZINC000819479958	CG	On-Demand	Anodyne	AOC3	15	40
C[C@H](C#N)Oc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819479959	GH	On-Demand	Mild	PAPA1_CARPA	47	46
C[C@H](C#N)Oc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819479959	GH	On-Demand	Mild	CCKAR	40	37
C[C@H](C#N)Oc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819479959	GH	On-Demand	Mild	CTSK	16	43
C[C@H](C#N)Oc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819479959	GH	On-Demand	Mild	FPR1	48	41
C[C@@H](C#N)Oc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819479960	GH	On-Demand	Mild	PAPA1_CARPA	47	46
C[C@@H](C#N)Oc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819479960	GH	On-Demand	Mild	CCKAR	40	37
C[C@@H](C#N)Oc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819479960	GH	On-Demand	Mild	CTSK	16	43
C[C@@H](C#N)Oc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819479960	GH	On-Demand	Mild	FPR1	48	41
C[C@@H](C#N)Oc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819479961	GH	On-Demand	Mild	PAPA1_CARPA	47	46
C[C@@H](C#N)Oc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819479961	GH	On-Demand	Mild	CCKAR	40	37
C[C@@H](C#N)Oc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819479961	GH	On-Demand	Mild	CTSK	16	43
C[C@@H](C#N)Oc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819479961	GH	On-Demand	Mild	FPR1	48	41
C[C@H](C#N)Oc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819479962	GH	On-Demand	Mild	PAPA1_CARPA	47	46
C[C@H](C#N)Oc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819479962	GH	On-Demand	Mild	CCKAR	40	37
C[C@H](C#N)Oc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819479962	GH	On-Demand	Mild	CTSK	16	43
C[C@H](C#N)Oc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819479962	GH	On-Demand	Mild	FPR1	48	41
Cc1ccc(NC[C@H](O)c2cccnc2)cc1OC(C)C	ZINC000819479990	CG	On-Demand	Anodyne	ADRB2	28	41
Cc1ccc(NC[C@H](O)c2cccnc2)cc1OC(C)C	ZINC000819479990	CG	On-Demand	Anodyne	ADRB1	31	48
Cc1ccc(NC[C@H](O)c2cccnc2)cc1OC(C)C	ZINC000819479990	CG	On-Demand	Anodyne	ADRB3	97	49
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1OC(C)C	ZINC000819479991	CG	On-Demand	Anodyne	ADRB2	28	41
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1OC(C)C	ZINC000819479991	CG	On-Demand	Anodyne	ADRB1	31	48
Cc1ccc(NC[C@@H](O)c2cccnc2)cc1OC(C)C	ZINC000819479991	CG	On-Demand	Anodyne	ADRB3	97	49
COCCNC(=O)c1ccccc1NC(=O)c1cc2cnn(C(C)C)c2nc1C	ZINC000819480002	GF	On-Demand	Anodyne	POLR1A	68	39
Cc1ccc(NC[C@H](O)c2ccccc2)cc1OC(C)C	ZINC000819480007	CH	On-Demand	Anodyne	ADRB2	25	48
Cc1ccc(NC[C@H](O)c2ccccc2)cc1OC(C)C	ZINC000819480007	CH	On-Demand	Anodyne	ADRB1	22	46
Cc1ccc(NC[C@H](O)c2ccccc2)cc1OC(C)C	ZINC000819480007	CH	On-Demand	Anodyne	ADRB3	52	46
Cc1ccc(NC[C@H](O)c2ccccc2)cc1OC(C)C	ZINC000819480007	CH	On-Demand	Anodyne	AOC3	15	43
Cc1ccc(NC[C@@H](O)c2ccccc2)cc1OC(C)C	ZINC000819480008	CH	On-Demand	Anodyne	ADRB2	25	48
Cc1ccc(NC[C@@H](O)c2ccccc2)cc1OC(C)C	ZINC000819480008	CH	On-Demand	Anodyne	ADRB1	22	46
Cc1ccc(NC[C@@H](O)c2ccccc2)cc1OC(C)C	ZINC000819480008	CH	On-Demand	Anodyne	ADRB3	52	46
Cc1ccc(NC[C@@H](O)c2ccccc2)cc1OC(C)C	ZINC000819480008	CH	On-Demand	Anodyne	AOC3	15	43
COCCNC(=O)c1ccccc1NC(=O)c1cncs1	ZINC000819480022	DD	On-Demand	Anodyne	POLR1A	47	39
COc1cccc([S@@](=O)CC(=O)NNc2ccc(C(C)(C)C)cc2)c1	ZINC000819480034	FG	On-Demand	Reactive	AKR1C2	17	40
COC(=O)c1cccc(NNC(=O)C2(c3ccc(C)cc3)CCC2)c1	ZINC000819480065	EG	On-Demand	Reactive	KCNK3	41	34
CC(=O)Nc1cccc(CC(=O)NNc2ccc(C(C)(C)C)cc2)c1	ZINC000819480083	EH	On-Demand	Reactive	TRPV1	27	41
CC(=O)Nc1cccc(CC(=O)NNc2ccc(C(C)(C)C)cc2)c1	ZINC000819480083	EH	On-Demand	Reactive	NR1H4	16	51
CC(=O)Nc1cccc(CC(=O)NNc2ccc(C(C)(C)C)cc2)c1	ZINC000819480083	EH	On-Demand	Reactive	KCNK3	44	41
Cn1cc(-c2nc([C@@H]3CCCCCN3C(=O)C(F)=C3CCC3)no2)cn1	ZINC000819480135	FG	On-Demand	Anodyne	CPT1A	39	42
Cn1cc(-c2nc([C@H]3CCCCCN3C(=O)C(F)=C3CCC3)no2)cn1	ZINC000819480136	FG	On-Demand	Anodyne	CPT1A	39	42
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2cccc3c2CCO3)CC1	ZINC000819480137	FG	On-Demand	Anodyne	MTNR1B	24	46
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2cccc3c2CCO3)CC1	ZINC000819480137	FG	On-Demand	Anodyne	GPR119	40	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2cccc3c2CCO3)CC1	ZINC000819480138	FG	On-Demand	Anodyne	MTNR1B	24	46
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2cccc3c2CCO3)CC1	ZINC000819480138	FG	On-Demand	Anodyne	GPR119	40	46
CO[C@@H]1CCOc2c(NC[C@@H](O)COc3ccccc3F)cccc21	ZINC000819480143	EG	On-Demand	Anodyne	ADRB2	17	41
CO[C@H]1CCOc2c(NC[C@@H](O)COc3ccccc3F)cccc21	ZINC000819480144	EG	On-Demand	Anodyne	ADRB2	17	41
CO[C@H]1CCOc2c(NC[C@H](O)COc3ccccc3F)cccc21	ZINC000819480145	EG	On-Demand	Anodyne	ADRB2	17	41
CO[C@@H]1CCOc2c(NC[C@H](O)COc3ccccc3F)cccc21	ZINC000819480146	EG	On-Demand	Anodyne	ADRB2	17	41
CC(C)(C)OC(=O)CCc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819480154	EH	On-Demand	Anodyne	ADRB2	28	46
CC(C)(C)OC(=O)CCc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819480154	EH	On-Demand	Anodyne	ADRB1	37	46
CC(C)(C)OC(=O)CCc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819480154	EH	On-Demand	Anodyne	ADRB3	105	46
CC(C)(C)OC(=O)CCc1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819480154	EH	On-Demand	Anodyne	KCNA5	19	41
CC(C)(C)OC(=O)CCc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819480155	EH	On-Demand	Anodyne	ADRB2	28	46
CC(C)(C)OC(=O)CCc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819480155	EH	On-Demand	Anodyne	ADRB1	37	46
CC(C)(C)OC(=O)CCc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819480155	EH	On-Demand	Anodyne	ADRB3	105	46
CC(C)(C)OC(=O)CCc1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819480155	EH	On-Demand	Anodyne	KCNA5	19	41
CON(C)C(=O)CCNc1cc(-c2cccnc2)ccc1C	ZINC000819480156	CF	On-Demand	Anodyne	CYP11B2	38	44
CO[C@H]1CCOc2c(NC[C@H](O)COc3ccc4ccccc4c3)cccc21	ZINC000819480158	GI	On-Demand	Anodyne	ADRB2	19	47
CO[C@H]1CCOc2c(NC[C@@H](O)COc3ccc4ccccc4c3)cccc21	ZINC000819480159	GI	On-Demand	Anodyne	ADRB2	19	47
CO[C@@H]1CCOc2c(NC[C@H](O)COc3ccc4ccccc4c3)cccc21	ZINC000819480160	GI	On-Demand	Anodyne	ADRB2	19	47
CO[C@@H]1CCOc2c(NC[C@@H](O)COc3ccc4ccccc4c3)cccc21	ZINC000819480161	GI	On-Demand	Anodyne	ADRB2	19	47
CON(C)C(=O)CCNc1ccc(N2CCCCC2)c2ncccc12	ZINC000819480166	EG	On-Demand	Anodyne	HNMT	50	36
COCCNC(=O)c1ccccc1NC(=O)CCc1nc(-c2ccc(OC)cc2)no1	ZINC000819480167	HF	On-Demand	Anodyne	HCAR2	48	61
COc1cc(NC[C@H](O)c2ccccc2)c(C)cc1C	ZINC000819480175	CG	On-Demand	Anodyne	ADRB3	24	41
COc1cc(NC[C@H](O)c2ccccc2)c(C)cc1C	ZINC000819480175	CG	On-Demand	Anodyne	AOC3	15	41
COc1cc(NC[C@@H](O)c2ccccc2)c(C)cc1C	ZINC000819480176	CG	On-Demand	Anodyne	ADRB3	24	41
COc1cc(NC[C@@H](O)c2ccccc2)c(C)cc1C	ZINC000819480176	CG	On-Demand	Anodyne	AOC3	15	41
CCC(C)(C)c1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819480212	CH	On-Demand	Anodyne	ADRB2	25	42
CCC(C)(C)c1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819480212	CH	On-Demand	Anodyne	ADRB1	24	42
CCC(C)(C)c1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819480212	CH	On-Demand	Anodyne	ADRB3	89	46
CCC(C)(C)c1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819480213	CH	On-Demand	Anodyne	ADRB2	25	42
CCC(C)(C)c1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819480213	CH	On-Demand	Anodyne	ADRB1	24	42
CCC(C)(C)c1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819480213	CH	On-Demand	Anodyne	ADRB3	89	46
CCC(C)(C)c1ccc(NCCS(C)(=O)=O)cc1	ZINC000819480244	CF	On-Demand	Anodyne	CYNT	25	47
COCCNC(=O)c1ccccc1NC(=O)c1cccc2ncccc12	ZINC000819480249	EF	On-Demand	Anodyne	G2YM83_BOTF4	73	37
COCCNC(=O)c1ccccc1NC(=O)c1cccc2ncccc12	ZINC000819480249	EF	On-Demand	Anodyne	POLR1A	53	37
CNC(=O)COc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819480250	FE	On-Demand	Bother	CACNA1D	49	33
CNC(=O)COc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819480251	FE	On-Demand	Bother	CACNA1D	49	33
COC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@@H]3OC)cc1	ZINC000819480256	GF	On-Demand	Anodyne	ADRB2	21	40
COC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@@H]3OC)cc1	ZINC000819480256	GF	On-Demand	Anodyne	ADRB1	44	39
COC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@H]3OC)cc1	ZINC000819480257	GF	On-Demand	Anodyne	ADRB2	21	40
COC(=O)c1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@H]3OC)cc1	ZINC000819480257	GF	On-Demand	Anodyne	ADRB1	44	39
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@H]3OC)cc1	ZINC000819480258	GF	On-Demand	Anodyne	ADRB2	21	40
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@H]3OC)cc1	ZINC000819480258	GF	On-Demand	Anodyne	ADRB1	44	39
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@@H]3OC)cc1	ZINC000819480259	GF	On-Demand	Anodyne	ADRB2	21	40
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@@H]3OC)cc1	ZINC000819480259	GF	On-Demand	Anodyne	ADRB1	44	39
CO[C@@H]1CCOc2c(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cccc21	ZINC000819480270	EG	On-Demand	Bother	CACNA1D	45	33
CO[C@@H]1CCOc2c(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cccc21	ZINC000819480270	EG	On-Demand	Bother	LUXR	16	40
CO[C@@H]1CCOc2c(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)cccc21	ZINC000819480272	EG	On-Demand	Bother	CACNA1D	45	33
CO[C@@H]1CCOc2c(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)cccc21	ZINC000819480272	EG	On-Demand	Bother	LUXR	16	40
CO[C@H]1CCOc2c(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cccc21	ZINC000819480274	EG	On-Demand	Bother	CACNA1D	45	33
CO[C@H]1CCOc2c(NC[C@H](O)c3cccc([N+](=O)[O-])c3)cccc21	ZINC000819480274	EG	On-Demand	Bother	LUXR	16	40
CO[C@H]1CCOc2c(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)cccc21	ZINC000819480275	EG	On-Demand	Bother	CACNA1D	45	33
CO[C@H]1CCOc2c(NC[C@@H](O)c3cccc([N+](=O)[O-])c3)cccc21	ZINC000819480275	EG	On-Demand	Bother	LUXR	16	40
O=C(NCC1OCCCO1)[C@H](O)Cc1cccc(C(F)(F)F)c1	ZINC000819480278	ED	On-Demand	Anodyne	CCR2	79	37
O=C(NCC1OCCCO1)[C@@H](O)Cc1cccc(C(F)(F)F)c1	ZINC000819480280	ED	On-Demand	Anodyne	CCR2	79	37
O=C(/C=C/c1cccc(O)c1)NCC1OCCCO1	ZINC000819480282	CD	On-Demand	Anodyne	HDAC8	42	37
O=C(/C=C/c1cccc(O)c1)NCC1OCCCO1	ZINC000819480282	CD	On-Demand	Anodyne	MMP2	15	56
O=C(/C=C/c1cccc(O)c1)NCC1OCCCO1	ZINC000819480282	CD	On-Demand	Anodyne	MMP9	15	56
O=C(/C=C\c1cccc(O)c1)NCC1OCCCO1	ZINC000819480283	CD	On-Demand	Anodyne	HDAC8	42	37
O=C(/C=C\c1cccc(O)c1)NCC1OCCCO1	ZINC000819480283	CD	On-Demand	Anodyne	MMP2	15	56
O=C(/C=C\c1cccc(O)c1)NCC1OCCCO1	ZINC000819480283	CD	On-Demand	Anodyne	MMP9	15	56
CCCOc1cccc(CC(=O)NCC2OCCCO2)c1	ZINC000819480306	CD	On-Demand	Anodyne	HRH2	34	43
CCCOc1cccc(CC(=O)NCC2OCCCO2)c1	ZINC000819480306	CD	On-Demand	Anodyne	MTNR1A	42	41
CCCOc1cccc(CC(=O)NCC2OCCCO2)c1	ZINC000819480306	CD	On-Demand	Anodyne	PLA2G4B	27	42
CCCOc1cccc(CC(=O)NCC2OCCCO2)c1	ZINC000819480306	CD	On-Demand	Anodyne	PDS	45	32
O=C(NCC1OCCCO1)c1ccc(C(=O)c2cccc(O)c2)cc1	ZINC000819480335	EE	On-Demand	Anodyne	HSD17B1	26	41
O=C(NCC1OCCCO1)c1ccc(C(=O)c2cccc(O)c2)cc1	ZINC000819480335	EE	On-Demand	Anodyne	HSD17B2	30	41
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NCC1OCCCO1	ZINC000819480336	GC	On-Demand	Anodyne	MMP13	22	41
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NCC1OCCCO1	ZINC000819480336	GC	On-Demand	Anodyne	MMP2	28	41
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NCC1OCCCO1	ZINC000819480336	GC	On-Demand	Anodyne	MMP14	20	41
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NCC1OCCCO1	ZINC000819480336	GC	On-Demand	Anodyne	MMP9	23	40
CCCOc1cccc(CC(=O)N2CCNC(=O)[C@H]2c2c(C)nc3ccccn23)c1	ZINC000819480376	HF	On-Demand	Anodyne	BRS3	32	44
CCCOc1cccc(CC(=O)N2CCNC(=O)[C@@H]2c2c(C)nc3ccccn23)c1	ZINC000819480377	HF	On-Demand	Anodyne	BRS3	32	44
COc1cccc([C@@H](C)C(=O)NCC2OCCCO2)c1	ZINC000819480390	CD	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@@H](C)C(=O)NCC2OCCCO2)c1	ZINC000819480390	CD	On-Demand	Anodyne	MTNR1A	67	42
COc1cccc([C@@H](C)C(=O)NCC2OCCCO2)c1	ZINC000819480390	CD	On-Demand	Anodyne	MTNR1B	64	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1cn(-c3ccccc3)nc1C)C2	ZINC000819480399	GF	On-Demand	Anodyne	P2RX7	16	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1cn(-c3ccccc3)nc1C)C2	ZINC000819480400	GF	On-Demand	Anodyne	P2RX7	16	44
O[C@@H](CNc1ccc(F)cc1OC1CCOCC1)c1cccnc1	ZINC000819480419	EF	On-Demand	Anodyne	ADRB1	15	43
O[C@@H](CNc1ccc(F)cc1OC1CCOCC1)c1cccnc1	ZINC000819480419	EF	On-Demand	Anodyne	ADRB3	45	43
O[C@H](CNc1ccc(F)cc1OC1CCOCC1)c1cccnc1	ZINC000819480420	EF	On-Demand	Anodyne	ADRB1	15	43
O[C@H](CNc1ccc(F)cc1OC1CCOCC1)c1cccnc1	ZINC000819480420	EF	On-Demand	Anodyne	ADRB3	45	43
O=C(C(F)=C1CCC1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000819480425	EI	On-Demand	Anodyne	RBP4	96	45
O=C(C(F)=C1CCC1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000819480426	EI	On-Demand	Anodyne	RBP4	96	45
CNC(=O)COc1ccc(NCCC(=O)Nc2cccc(Cl)c2)c(C)c1	ZINC000819480460	GG	On-Demand	Anodyne	MAOB	15	40
COc1ccc2cc(NC[C@H](O)CN3CCCC3=O)ccc2c1	ZINC000819480468	DE	On-Demand	Anodyne	MTNR1A	19	47
COc1ccc2cc(NC[C@@H](O)CN3CCCC3=O)ccc2c1	ZINC000819480470	DE	On-Demand	Anodyne	MTNR1A	19	47
O[C@@H](CNc1ccc2c(c1)N(CC(F)F)CCS2)c1cccnc1	ZINC000819480481	FG	On-Demand	Anodyne	ADRB3	85	40
O[C@H](CNc1ccc2c(c1)N(CC(F)F)CCS2)c1cccnc1	ZINC000819480483	FG	On-Demand	Anodyne	ADRB3	85	40
Cn1nc(C2CCCC2)cc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819480485	GH	On-Demand	Mild	PAPA1_CARPA	35	41
Cn1nc(C2CCCC2)cc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819480499	GH	On-Demand	Mild	PAPA1_CARPA	35	41
CNC(=O)COc1ccc(NC[C@H](O)c2ccccc2)c(C)c1	ZINC000819480510	DE	On-Demand	Anodyne	ADRB1	20	42
CNC(=O)COc1ccc(NC[C@@H](O)c2ccccc2)c(C)c1	ZINC000819480512	DE	On-Demand	Anodyne	ADRB1	20	42
COc1ccc2cc(NC[C@H](O)COCc3ccccc3OC)ccc2c1	ZINC000819480514	FH	On-Demand	Anodyne	ADRB1	15	41
COc1ccc2cc(NC[C@H](O)COCc3ccccc3OC)ccc2c1	ZINC000819480514	FH	On-Demand	Anodyne	CASR	25	40
COc1ccc2cc(NC[C@@H](O)COCc3ccccc3OC)ccc2c1	ZINC000819480517	FH	On-Demand	Anodyne	ADRB1	15	41
COc1ccc2cc(NC[C@@H](O)COCc3ccccc3OC)ccc2c1	ZINC000819480517	FH	On-Demand	Anodyne	CASR	25	40
COc1ccc2cc(NCCS(C)(=O)=O)ccc2c1	ZINC000819480525	CE	On-Demand	Anodyne	MTNR1A	43	37
COc1ccc2cc(NC[C@H](O)COc3ccc4c(c3)CCC(=O)N4)ccc2c1	ZINC000819480537	GH	On-Demand	Anodyne	ADRB1	19	43
COc1ccc2cc(NC[C@H](O)COc3ccc4c(c3)CCC(=O)N4)ccc2c1	ZINC000819480537	GH	On-Demand	Anodyne	ADRB3	18	41
COc1ccc2cc(NC[C@@H](O)COc3ccc4c(c3)CCC(=O)N4)ccc2c1	ZINC000819480539	GH	On-Demand	Anodyne	ADRB1	19	43
COc1ccc2cc(NC[C@@H](O)COc3ccc4c(c3)CCC(=O)N4)ccc2c1	ZINC000819480539	GH	On-Demand	Anodyne	ADRB3	18	41
O[C@H](CNc1ccc(F)cc1OC1CCOCC1)c1cccc(F)c1	ZINC000819480552	EH	On-Demand	Anodyne	CYP3A4	44	33
O[C@@H](CNc1ccc(F)cc1OC1CCOCC1)c1cccc(F)c1	ZINC000819480554	EH	On-Demand	Anodyne	CYP3A4	44	33
O[C@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COc1ccccc1	ZINC000819480556	GI	On-Demand	Anodyne	ADRB2	73	52
O[C@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COc1ccccc1	ZINC000819480556	GI	On-Demand	Anodyne	ADRB1	90	56
O[C@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COc1ccccc1	ZINC000819480556	GI	On-Demand	Anodyne	ADRB3	87	56
O[C@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COc1ccccc1	ZINC000819480556	GI	On-Demand	Anodyne	ABCB1	24	45
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COc1ccccc1	ZINC000819480558	GI	On-Demand	Anodyne	ADRB2	73	52
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COc1ccccc1	ZINC000819480558	GI	On-Demand	Anodyne	ADRB1	90	56
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COc1ccccc1	ZINC000819480558	GI	On-Demand	Anodyne	ADRB3	87	56
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COc1ccccc1	ZINC000819480558	GI	On-Demand	Anodyne	ABCB1	24	45
O[C@@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)COc1ccccc1	ZINC000819480560	GI	On-Demand	Anodyne	ADRB2	73	52
O[C@@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)COc1ccccc1	ZINC000819480560	GI	On-Demand	Anodyne	ADRB1	90	56
O[C@@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)COc1ccccc1	ZINC000819480560	GI	On-Demand	Anodyne	ADRB3	87	56
O[C@@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)COc1ccccc1	ZINC000819480560	GI	On-Demand	Anodyne	ABCB1	24	45
CO[C@H]1CCOc2c(NC[C@H](O)COc3ccccc3C(C)C)cccc21	ZINC000819480561	FI	On-Demand	Anodyne	ADRB2	22	48
O[C@@H](CCc1ccc(NC[C@@H](O)COc2ccccc2)cc1)c1ccccc1	ZINC000819480562	GI	On-Demand	Anodyne	ADRB2	73	52
O[C@@H](CCc1ccc(NC[C@@H](O)COc2ccccc2)cc1)c1ccccc1	ZINC000819480562	GI	On-Demand	Anodyne	ADRB1	90	56
O[C@@H](CCc1ccc(NC[C@@H](O)COc2ccccc2)cc1)c1ccccc1	ZINC000819480562	GI	On-Demand	Anodyne	ADRB3	87	56
O[C@@H](CCc1ccc(NC[C@@H](O)COc2ccccc2)cc1)c1ccccc1	ZINC000819480562	GI	On-Demand	Anodyne	ABCB1	24	45
CO[C@@H]1CCOc2c(NC[C@H](O)COc3ccccc3C(C)C)cccc21	ZINC000819480563	FI	On-Demand	Anodyne	ADRB2	22	48
CO[C@@H]1CCOc2c(NC[C@@H](O)COc3ccccc3C(C)C)cccc21	ZINC000819480565	FI	On-Demand	Anodyne	ADRB2	22	48
CO[C@H]1CCOc2c(NC[C@@H](O)COc3ccccc3C(C)C)cccc21	ZINC000819480567	FI	On-Demand	Anodyne	ADRB2	22	48
COc1cccc([C@H](C)C(=O)NCC2OCCCO2)c1	ZINC000819480591	CD	On-Demand	Anodyne	DRD4	42	32
COc1cccc([C@H](C)C(=O)NCC2OCCCO2)c1	ZINC000819480591	CD	On-Demand	Anodyne	MTNR1A	67	42
COc1cccc([C@H](C)C(=O)NCC2OCCCO2)c1	ZINC000819480591	CD	On-Demand	Anodyne	MTNR1B	64	42
CCC[C@H](NC(=O)NCc1ccc(F)cc1)C(=O)NCC1OCCCO1	ZINC000819480596	FD	On-Demand	Anodyne	PROC	48	36
O=C(NCC1OCCCO1)c1cnn(CCC(F)(F)F)c1	ZINC000819480598	DD	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)NCC2OCCCO2)c1	ZINC000819480658	FF	On-Demand	Anodyne	IMDH_CRYPV	57	45
CNC(=O)COc1cccc(CC(=O)N2CCNC(=O)[C@H]2c2c(C)nc3ccccn23)c1	ZINC000819480687	ID	On-Demand	Anodyne	BRS3	31	40
CNC(=O)COc1cccc(CC(=O)N2CCNC(=O)[C@@H]2c2c(C)nc3ccccn23)c1	ZINC000819480688	ID	On-Demand	Anodyne	BRS3	31	40
COc1ccc2cc(NC[C@@H](O)COc3c(OC)cccc3OC)ccc2c1	ZINC000819480699	GH	On-Demand	Anodyne	ADRB2	44	44
COc1ccc2cc(NC[C@@H](O)COc3c(OC)cccc3OC)ccc2c1	ZINC000819480699	GH	On-Demand	Anodyne	ADRB1	41	41
COc1ccc2cc(NC[C@@H](O)COc3c(OC)cccc3OC)ccc2c1	ZINC000819480699	GH	On-Demand	Anodyne	ADRB3	24	44
COc1ccc2cc(NC[C@@H](O)COc3c(OC)cccc3OC)ccc2c1	ZINC000819480699	GH	On-Demand	Anodyne	MTNR1A	33	40
COc1ccc2cc(NC[C@@H](O)COc3c(OC)cccc3OC)ccc2c1	ZINC000819480699	GH	On-Demand	Anodyne	CYP2D6	23	41
COc1ccc2cc(NC[C@H](O)COc3c(OC)cccc3OC)ccc2c1	ZINC000819480700	GH	On-Demand	Anodyne	ADRB2	44	44
COc1ccc2cc(NC[C@H](O)COc3c(OC)cccc3OC)ccc2c1	ZINC000819480700	GH	On-Demand	Anodyne	ADRB1	41	41
COc1ccc2cc(NC[C@H](O)COc3c(OC)cccc3OC)ccc2c1	ZINC000819480700	GH	On-Demand	Anodyne	ADRB3	24	44
COc1ccc2cc(NC[C@H](O)COc3c(OC)cccc3OC)ccc2c1	ZINC000819480700	GH	On-Demand	Anodyne	MTNR1A	33	40
COc1ccc2cc(NC[C@H](O)COc3c(OC)cccc3OC)ccc2c1	ZINC000819480700	GH	On-Demand	Anodyne	CYP2D6	23	41
O[C@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COc1ccccc1F	ZINC000819480704	GI	On-Demand	Anodyne	ADRB2	46	47
O[C@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COc1ccccc1F	ZINC000819480704	GI	On-Demand	Anodyne	ADRB1	59	42
O[C@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COc1ccccc1F	ZINC000819480704	GI	On-Demand	Anodyne	ADRB3	45	42
O[C@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COc1ccccc1F	ZINC000819480704	GI	On-Demand	Anodyne	ABCB1	30	44
O[C@@H](CCc1ccc(NC[C@@H](O)COc2ccccc2F)cc1)c1ccccc1	ZINC000819480705	GI	On-Demand	Anodyne	ADRB2	46	47
O[C@@H](CCc1ccc(NC[C@@H](O)COc2ccccc2F)cc1)c1ccccc1	ZINC000819480705	GI	On-Demand	Anodyne	ADRB1	59	42
O[C@@H](CCc1ccc(NC[C@@H](O)COc2ccccc2F)cc1)c1ccccc1	ZINC000819480705	GI	On-Demand	Anodyne	ADRB3	45	42
O[C@@H](CCc1ccc(NC[C@@H](O)COc2ccccc2F)cc1)c1ccccc1	ZINC000819480705	GI	On-Demand	Anodyne	ABCB1	30	44
O[C@@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)COc1ccccc1F	ZINC000819480706	GI	On-Demand	Anodyne	ADRB2	46	47
O[C@@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)COc1ccccc1F	ZINC000819480706	GI	On-Demand	Anodyne	ADRB1	59	42
O[C@@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)COc1ccccc1F	ZINC000819480706	GI	On-Demand	Anodyne	ADRB3	45	42
O[C@@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)COc1ccccc1F	ZINC000819480706	GI	On-Demand	Anodyne	ABCB1	30	44
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COc1ccccc1F	ZINC000819480707	GI	On-Demand	Anodyne	ADRB2	46	47
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COc1ccccc1F	ZINC000819480707	GI	On-Demand	Anodyne	ADRB1	59	42
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COc1ccccc1F	ZINC000819480707	GI	On-Demand	Anodyne	ADRB3	45	42
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COc1ccccc1F	ZINC000819480707	GI	On-Demand	Anodyne	ABCB1	30	44
COc1ccc2cc(NC[C@H](C)O)ccc2c1	ZINC000819480710	BF	On-Demand	Anodyne	CYP11B2	20	43
COc1ccc2cc(NC[C@H](C)O)ccc2c1	ZINC000819480710	BF	On-Demand	Anodyne	MTNR1A	42	40
COc1ccc2cc(NC[C@@H](C)O)ccc2c1	ZINC000819480711	BF	On-Demand	Anodyne	CYP11B2	20	43
COc1ccc2cc(NC[C@@H](C)O)ccc2c1	ZINC000819480711	BF	On-Demand	Anodyne	MTNR1A	42	40
NC(=O)CCNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819480712	CF	On-Demand	Anodyne	ADRB2	16	54
NC(=O)CCNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819480712	CF	On-Demand	Anodyne	ADRB1	28	43
NC(=O)CCNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819480712	CF	On-Demand	Anodyne	ADRB3	54	43
NC(=O)CCNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819480712	CF	On-Demand	Anodyne	FFAR1	23	46
NC(=O)CCNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819480713	CF	On-Demand	Anodyne	ADRB2	16	54
NC(=O)CCNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819480713	CF	On-Demand	Anodyne	ADRB1	28	43
NC(=O)CCNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819480713	CF	On-Demand	Anodyne	ADRB3	54	43
NC(=O)CCNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819480713	CF	On-Demand	Anodyne	FFAR1	23	46
COc1ccc2cc(NCCC(=O)N(C)OC)ccc2c1	ZINC000819480734	CF	On-Demand	Anodyne	MTNR1A	67	38
COc1ccc2cc(NCCC(=O)N(C)OC)ccc2c1	ZINC000819480734	CF	On-Demand	Anodyne	MTNR1B	56	38
COc1ccc2cc(NCCC(=O)N(C)OC)ccc2c1	ZINC000819480734	CF	On-Demand	Anodyne	CYP26A1	28	41
O[C@@H](CCc1ccc(NC[C@@H](O)C(F)(F)F)cc1)c1ccccc1	ZINC000819480743	EH	On-Demand	Anodyne	ADRB2	19	56
O[C@@H](CCc1ccc(NC[C@@H](O)C(F)(F)F)cc1)c1ccccc1	ZINC000819480743	EH	On-Demand	Anodyne	ADRB1	19	43
O[C@@H](CCc1ccc(NC[C@@H](O)C(F)(F)F)cc1)c1ccccc1	ZINC000819480743	EH	On-Demand	Anodyne	ADRB3	44	41
O[C@H](CCc1ccc(NC[C@@H](O)C(F)(F)F)cc1)c1ccccc1	ZINC000819480744	EH	On-Demand	Anodyne	ADRB2	19	56
O[C@H](CCc1ccc(NC[C@@H](O)C(F)(F)F)cc1)c1ccccc1	ZINC000819480744	EH	On-Demand	Anodyne	ADRB1	19	43
O[C@H](CCc1ccc(NC[C@@H](O)C(F)(F)F)cc1)c1ccccc1	ZINC000819480744	EH	On-Demand	Anodyne	ADRB3	44	41
O[C@@H](CCc1ccc(NC[C@H](O)C(F)(F)F)cc1)c1ccccc1	ZINC000819480745	EH	On-Demand	Anodyne	ADRB2	19	56
O[C@@H](CCc1ccc(NC[C@H](O)C(F)(F)F)cc1)c1ccccc1	ZINC000819480745	EH	On-Demand	Anodyne	ADRB1	19	43
O[C@@H](CCc1ccc(NC[C@H](O)C(F)(F)F)cc1)c1ccccc1	ZINC000819480745	EH	On-Demand	Anodyne	ADRB3	44	41
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)C(F)(F)F	ZINC000819480746	EH	On-Demand	Anodyne	ADRB2	19	56
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)C(F)(F)F	ZINC000819480746	EH	On-Demand	Anodyne	ADRB1	19	43
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)C(F)(F)F	ZINC000819480746	EH	On-Demand	Anodyne	ADRB3	44	41
COc1ccc2cc(NCCS(=O)(=O)CC(=O)OC(C)(C)C)ccc2c1	ZINC000819480757	GG	On-Demand	Anodyne	MTNR1A	51	37
COc1ccc2cc(NCCS(=O)(=O)CC(=O)OC(C)(C)C)ccc2c1	ZINC000819480757	GG	On-Demand	Anodyne	MTNR1B	42	37
CO[C@H]1CCOc2c(NC[C@H](O)COc3ccc(NC(C)=O)cc3)cccc21	ZINC000819480794	GF	On-Demand	Anodyne	ADRB2	25	48
CO[C@H]1CCOc2c(NC[C@H](O)COc3ccc(NC(C)=O)cc3)cccc21	ZINC000819480794	GF	On-Demand	Anodyne	ADRB1	56	48
CO[C@H]1CCOc2c(NC[C@H](O)COc3ccc(NC(C)=O)cc3)cccc21	ZINC000819480794	GF	On-Demand	Anodyne	ADRB3	33	42
CO[C@@H]1CCOc2c(NC[C@H](O)COc3ccc(NC(C)=O)cc3)cccc21	ZINC000819480795	GF	On-Demand	Anodyne	ADRB2	25	48
CO[C@@H]1CCOc2c(NC[C@H](O)COc3ccc(NC(C)=O)cc3)cccc21	ZINC000819480795	GF	On-Demand	Anodyne	ADRB1	56	48
CO[C@@H]1CCOc2c(NC[C@H](O)COc3ccc(NC(C)=O)cc3)cccc21	ZINC000819480795	GF	On-Demand	Anodyne	ADRB3	33	42
CO[C@@H]1CCOc2c(NC[C@@H](O)COc3ccc(NC(C)=O)cc3)cccc21	ZINC000819480796	GF	On-Demand	Anodyne	ADRB2	25	48
CO[C@@H]1CCOc2c(NC[C@@H](O)COc3ccc(NC(C)=O)cc3)cccc21	ZINC000819480796	GF	On-Demand	Anodyne	ADRB1	56	48
CO[C@@H]1CCOc2c(NC[C@@H](O)COc3ccc(NC(C)=O)cc3)cccc21	ZINC000819480796	GF	On-Demand	Anodyne	ADRB3	33	42
CO[C@H]1CCOc2c(NC[C@@H](O)COc3ccc(NC(C)=O)cc3)cccc21	ZINC000819480797	GF	On-Demand	Anodyne	ADRB2	25	48
CO[C@H]1CCOc2c(NC[C@@H](O)COc3ccc(NC(C)=O)cc3)cccc21	ZINC000819480797	GF	On-Demand	Anodyne	ADRB1	56	48
CO[C@H]1CCOc2c(NC[C@@H](O)COc3ccc(NC(C)=O)cc3)cccc21	ZINC000819480797	GF	On-Demand	Anodyne	ADRB3	33	42
COc1cc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c(C)cc1C	ZINC000819480807	GH	On-Demand	Anodyne	GPR119	39	45
COc1cc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c(C)cc1C	ZINC000819480808	GH	On-Demand	Anodyne	GPR119	39	45
CNC(=O)COc1ccc(NC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)c(C)c1	ZINC000819480814	GG	On-Demand	Anodyne	PPARD	64	41
CNC(=O)COc1ccc(NC[C@H](O)Cc2ccc(C(F)(F)F)cc2)c(C)c1	ZINC000819480815	GG	On-Demand	Anodyne	PPARD	64	41
CNC(=O)COc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)c(C)c1	ZINC000819480816	GE	On-Demand	Anodyne	ADRB2	21	52
CNC(=O)COc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)c(C)c1	ZINC000819480816	GE	On-Demand	Anodyne	ADRB1	22	52
CNC(=O)COc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c(C)c1	ZINC000819480817	GE	On-Demand	Anodyne	ADRB2	21	52
CNC(=O)COc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)c(C)c1	ZINC000819480817	GE	On-Demand	Anodyne	ADRB1	22	52
COCCNC(=O)c1ccccc1NC(=O)c1ccc(-c2cccs2)nc1C	ZINC000819480828	GH	On-Demand	Anodyne	GPR142	40	31
COCCNC(=O)c1ccccc1NC(=O)c1ccc(-c2cccs2)nc1C	ZINC000819480828	GH	On-Demand	Anodyne	POLR1A	52	36
O[C@@H](CNc1cccc2c1CCO2)c1cccnc1	ZINC000819480845	CE	On-Demand	Anodyne	ADRB3	54	38
O[C@H](CNc1cccc2c1CCO2)c1cccnc1	ZINC000819480846	CE	On-Demand	Anodyne	ADRB3	54	38
CCCOc1nc2ccccc2cc1/C=C/C(=O)N1CCO[C@@H](OC)C1	ZINC000819480898	FF	On-Demand	Anodyne	ITGAL	71	35
CCCOc1nc2ccccc2cc1/C=C\C(=O)N1CCO[C@@H](OC)C1	ZINC000819480899	FF	On-Demand	Anodyne	ITGAL	71	35
CCCOc1nc2ccccc2cc1/C=C\C(=O)N1CCO[C@H](OC)C1	ZINC000819480900	FF	On-Demand	Anodyne	ITGAL	71	35
CCCOc1nc2ccccc2cc1/C=C/C(=O)N1CCO[C@H](OC)C1	ZINC000819480901	FF	On-Demand	Anodyne	ITGAL	71	35
O=C(NCC1OCCCO1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819480947	FD	On-Demand	Anodyne	CNR2	16	50
O=C(NCC1OCCCO1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819480947	FD	On-Demand	Anodyne	EPHX2	18	40
O=C(NCC1OCCCO1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819480947	FD	On-Demand	Anodyne	CACNA1I	65	36
O=C(CCNC(=O)NC12CC3CC(CC(C3)C1)C2)NCC1OCCCO1	ZINC000819480956	FD	On-Demand	Anodyne	EPHX2	100	56
COc1ccc(Cn2cc(C(=O)NCC3OCCCO3)cn2)cc1	ZINC000819480986	ED	On-Demand	Anodyne	PROKR1	62	33
COc1ccc(Cn2cc(C(=O)NCC3OCCCO3)cn2)cc1	ZINC000819480986	ED	On-Demand	Anodyne	PANC	61	38
COC[C@@H](O)CNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819481090	DF	On-Demand	Anodyne	ADRB2	48	53
COC[C@@H](O)CNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819481090	DF	On-Demand	Anodyne	ADRB1	53	42
COC[C@@H](O)CNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819481090	DF	On-Demand	Anodyne	ADRB3	53	40
COC[C@@H](O)CNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819481090	DF	On-Demand	Anodyne	ABCB1	18	41
COC[C@@H](O)CNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819481091	DF	On-Demand	Anodyne	ADRB2	48	53
COC[C@@H](O)CNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819481091	DF	On-Demand	Anodyne	ADRB1	53	42
COC[C@@H](O)CNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819481091	DF	On-Demand	Anodyne	ADRB3	53	40
COC[C@@H](O)CNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819481091	DF	On-Demand	Anodyne	ABCB1	18	41
CNC(=O)COc1ccc(NC[C@H](O)c2cccc(Cl)c2)c(C)c1	ZINC000819481132	EF	On-Demand	Anodyne	ADRB1	32	56
CNC(=O)COc1ccc(NC[C@H](O)c2cccc(Cl)c2)c(C)c1	ZINC000819481132	EF	On-Demand	Anodyne	MAOB	17	41
CNC(=O)COc1ccc(NC[C@H](O)c2cccc(Cl)c2)c(C)c1	ZINC000819481132	EF	On-Demand	Anodyne	ADRB3	50	50
CNC(=O)COc1ccc(NC[C@H](O)c2cccc(Cl)c2)c(C)c1	ZINC000819481132	EF	On-Demand	Anodyne	IGF1R	31	46
CNC(=O)COc1ccc(NC[C@H](O)c2cccc(Cl)c2)c(C)c1	ZINC000819481132	EF	On-Demand	Anodyne	CYP3A4	52	39
CNC(=O)COc1ccc(NC[C@@H](O)c2cccc(Cl)c2)c(C)c1	ZINC000819481133	EF	On-Demand	Anodyne	ADRB1	32	56
CNC(=O)COc1ccc(NC[C@@H](O)c2cccc(Cl)c2)c(C)c1	ZINC000819481133	EF	On-Demand	Anodyne	MAOB	17	41
CNC(=O)COc1ccc(NC[C@@H](O)c2cccc(Cl)c2)c(C)c1	ZINC000819481133	EF	On-Demand	Anodyne	ADRB3	50	50
CNC(=O)COc1ccc(NC[C@@H](O)c2cccc(Cl)c2)c(C)c1	ZINC000819481133	EF	On-Demand	Anodyne	IGF1R	31	46
CNC(=O)COc1ccc(NC[C@@H](O)c2cccc(Cl)c2)c(C)c1	ZINC000819481133	EF	On-Demand	Anodyne	CYP3A4	52	39
COCCNC(=O)c1ccccc1NC(=O)c1csc(S(=O)(=O)N2CCc3ccccc3C2)c1	ZINC000819481140	JG	On-Demand	Anodyne	ABCB1B	31	40
COCCNC(=O)c1ccccc1NC(=O)c1csc(S(=O)(=O)N2CCc3ccccc3C2)c1	ZINC000819481140	JG	On-Demand	Anodyne	AKR1C3	63	43
COCCNC(=O)c1ccccc1NC(=O)c1csc(S(=O)(=O)N2CCc3ccccc3C2)c1	ZINC000819481140	JG	On-Demand	Anodyne	NOD2	40	35
CC(C)(C)OC(=O)CCc1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819481153	GI	On-Demand	Bother	CACNA1D	45	33
CC(C)(C)OC(=O)CCc1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819481154	GI	On-Demand	Bother	CACNA1D	45	33
CO[C@@H]1CCOc2c(NC[C@H](O)c3cccc(Cl)c3)cccc21	ZINC000819481161	EH	On-Demand	Anodyne	CYP3A4	53	42
CO[C@@H]1CCOc2c(NC[C@@H](O)c3cccc(Cl)c3)cccc21	ZINC000819481162	EH	On-Demand	Anodyne	CYP3A4	53	42
CO[C@H]1CCOc2c(NC[C@H](O)c3cccc(Cl)c3)cccc21	ZINC000819481163	EH	On-Demand	Anodyne	CYP3A4	53	42
CO[C@H]1CCOc2c(NC[C@@H](O)c3cccc(Cl)c3)cccc21	ZINC000819481164	EH	On-Demand	Anodyne	CYP3A4	53	42
CO[C@H]1CCOc2c(NC[C@H](O)COc3ccc(CCC(C)=O)cc3)cccc21	ZINC000819481169	GH	On-Demand	Anodyne	ADRB1	59	42
CO[C@H]1CCOc2c(NC[C@@H](O)COc3ccc(CCC(C)=O)cc3)cccc21	ZINC000819481170	GH	On-Demand	Anodyne	ADRB1	59	42
CO[C@@H]1CCOc2c(NC[C@H](O)COc3ccc(CCC(C)=O)cc3)cccc21	ZINC000819481171	GH	On-Demand	Anodyne	ADRB1	59	42
CO[C@@H]1CCOc2c(NC[C@@H](O)COc3ccc(CCC(C)=O)cc3)cccc21	ZINC000819481172	GH	On-Demand	Anodyne	ADRB1	59	42
CO[C@@H]1CCOc2c(NC[C@@H](O)COc3ccccc3Cl)cccc21	ZINC000819481220	FH	On-Demand	Anodyne	ADRB2	17	41
CO[C@H]1CCOc2c(NC[C@@H](O)COc3ccccc3Cl)cccc21	ZINC000819481221	FH	On-Demand	Anodyne	ADRB2	17	41
CO[C@H]1CCOc2c(NC[C@H](O)COc3ccccc3Cl)cccc21	ZINC000819481222	FH	On-Demand	Anodyne	ADRB2	17	41
CO[C@@H]1CCOc2c(NC[C@H](O)COc3ccccc3Cl)cccc21	ZINC000819481223	FH	On-Demand	Anodyne	ADRB2	17	41
O=C(NCC1OCCCO1)[C@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000819481256	FD	On-Demand	Anodyne	CPT1A	133	43
O=C(NCC1OCCCO1)[C@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000819481256	FD	On-Demand	Anodyne	CPT2	51	38
O=C(NCC1OCCCO1)[C@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000819481256	FD	On-Demand	Anodyne	PDE8B	19	41
O=C(NCC1OCCCO1)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000819481257	FD	On-Demand	Anodyne	CPT1A	133	43
O=C(NCC1OCCCO1)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000819481257	FD	On-Demand	Anodyne	CPT2	51	38
O=C(NCC1OCCCO1)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000819481257	FD	On-Demand	Anodyne	PDE8B	19	41
O=C(NCc1ccc(F)cc1)c1nccnc1C(=O)NCC1OCCCO1	ZINC000819481259	FD	On-Demand	Anodyne	SSTR3	19	40
O=C(NCc1ccc(F)cc1)c1nccnc1C(=O)NCC1OCCCO1	ZINC000819481259	FD	On-Demand	Anodyne	NAMPT	41	38
O[C@H](CNc1ccc(F)cc1OC1CCOCC1)c1cccc(Cl)c1	ZINC000819481287	FI	On-Demand	Anodyne	ADRB1	28	44
O[C@H](CNc1ccc(F)cc1OC1CCOCC1)c1cccc(Cl)c1	ZINC000819481287	FI	On-Demand	Anodyne	ADRB3	46	44
O[C@H](CNc1ccc(F)cc1OC1CCOCC1)c1cccc(Cl)c1	ZINC000819481287	FI	On-Demand	Anodyne	IGF1R	30	40
O[C@H](CNc1ccc(F)cc1OC1CCOCC1)c1cccc(Cl)c1	ZINC000819481287	FI	On-Demand	Anodyne	CYP3A4	54	40
O[C@@H](CNc1ccc(F)cc1OC1CCOCC1)c1cccc(Cl)c1	ZINC000819481290	FI	On-Demand	Anodyne	ADRB1	28	44
O[C@@H](CNc1ccc(F)cc1OC1CCOCC1)c1cccc(Cl)c1	ZINC000819481290	FI	On-Demand	Anodyne	ADRB3	46	44
O[C@@H](CNc1ccc(F)cc1OC1CCOCC1)c1cccc(Cl)c1	ZINC000819481290	FI	On-Demand	Anodyne	IGF1R	30	40
O[C@@H](CNc1ccc(F)cc1OC1CCOCC1)c1cccc(Cl)c1	ZINC000819481290	FI	On-Demand	Anodyne	CYP3A4	54	40
O=C(NCC1OCCCO1)c1ccccc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000819481300	HD	On-Demand	Bother	PRTN3	48	39
O[C@@H](CNc1ccc(F)cc1OCCC(F)(F)F)c1cccnc1	ZINC000819481368	EH	On-Demand	Anodyne	ADRB3	52	39
O[C@H](CNc1ccc(F)cc1OCCC(F)(F)F)c1cccnc1	ZINC000819481369	EH	On-Demand	Anodyne	ADRB3	52	39
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H](O)c3cc(F)ccc32)c1	ZINC000819481370	FG	On-Demand	Anodyne	CCR3	67	39
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H](O)c3cc(F)ccc32)c1	ZINC000819481370	FG	On-Demand	Anodyne	MCHR1	19	42
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H](O)c3cc(F)ccc32)c1	ZINC000819481371	FG	On-Demand	Anodyne	CCR3	67	39
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H](O)c3cc(F)ccc32)c1	ZINC000819481371	FG	On-Demand	Anodyne	MCHR1	19	42
NC(=O)NC(=O)CCNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819481400	EE	On-Demand	Anodyne	ADRB1	22	40
NC(=O)NC(=O)CCNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819481400	EE	On-Demand	Anodyne	ADRB3	48	40
NC(=O)NC(=O)CCNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819481401	EE	On-Demand	Anodyne	ADRB1	22	40
NC(=O)NC(=O)CCNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819481401	EE	On-Demand	Anodyne	ADRB3	48	40
CO[C@@H]1CCOc2c(NC[C@H](O)COc3cccc(C(F)(F)F)c3)cccc21	ZINC000819481431	GI	On-Demand	Anodyne	PDS	41	37
CO[C@H]1CCOc2c(NC[C@@H](O)COc3cccc(C(F)(F)F)c3)cccc21	ZINC000819481432	GI	On-Demand	Anodyne	PDS	41	37
CO[C@H]1CCOc2c(NC[C@H](O)COc3cccc(C(F)(F)F)c3)cccc21	ZINC000819481433	GI	On-Demand	Anodyne	PDS	41	37
CO[C@@H]1CCOc2c(NC[C@@H](O)COc3cccc(C(F)(F)F)c3)cccc21	ZINC000819481434	GI	On-Demand	Anodyne	PDS	41	37
CO[C@H]1CCOc2c(NC[C@@H](O)c3cccnc3)cccc21	ZINC000819481436	DF	On-Demand	Anodyne	ADRB3	46	38
CO[C@H]1CCOc2c(NC[C@H](O)c3cccnc3)cccc21	ZINC000819481437	DF	On-Demand	Anodyne	ADRB3	46	38
CO[C@@H]1CCOc2c(NC[C@@H](O)c3cccnc3)cccc21	ZINC000819481438	DF	On-Demand	Anodyne	ADRB3	46	38
CO[C@@H]1CCOc2c(NC[C@H](O)c3cccnc3)cccc21	ZINC000819481439	DF	On-Demand	Anodyne	ADRB3	46	38
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2cccc3c2CCO3)CC1	ZINC000819481502	FG	On-Demand	Anodyne	GPR119	17	40
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2cccc3c2CCO3)CC1	ZINC000819481503	FG	On-Demand	Anodyne	GPR119	17	40
CC(C)(C)OC(=O)CCc1cccc(NC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819481512	FH	On-Demand	Mild	CTRB_BOVIN	47	36
CC(C)(C)OC(=O)CCc1cccc(NC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819481513	FH	On-Demand	Mild	CTRB_BOVIN	47	36
COc1cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)cc1C	ZINC000819481514	DG	On-Demand	Bother	CACNA1C	50	36
COc1cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)cc1C	ZINC000819481514	DG	On-Demand	Bother	CACNA1D	75	36
COc1cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)cc1C	ZINC000819481515	DG	On-Demand	Bother	CACNA1C	50	36
COc1cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)cc1C	ZINC000819481515	DG	On-Demand	Bother	CACNA1D	75	36
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](COc2ccccc2)C1	ZINC000819481521	DF	On-Demand	Anodyne	GRIN2B	20	40
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](COc2ccccc2)C1	ZINC000819481521	DF	On-Demand	Anodyne	CPT1A	45	35
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](COc2ccccc2)C1	ZINC000819481522	DF	On-Demand	Anodyne	GRIN2B	20	40
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](COc2ccccc2)C1	ZINC000819481522	DF	On-Demand	Anodyne	CPT1A	45	35
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](COc2ccccc2)C1	ZINC000819481523	DF	On-Demand	Anodyne	GRIN2B	20	40
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](COc2ccccc2)C1	ZINC000819481523	DF	On-Demand	Anodyne	CPT1A	45	35
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](COc2ccccc2)C1	ZINC000819481524	DF	On-Demand	Anodyne	GRIN2B	20	40
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](COc2ccccc2)C1	ZINC000819481524	DF	On-Demand	Anodyne	CPT1A	45	35
Cc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OC2CCOCC2)cc1	ZINC000819481542	GH	On-Demand	Anodyne	ADRB2	26	44
Cc1ccc(OC[C@H](O)CNc2ccc(F)cc2OC2CCOCC2)cc1	ZINC000819481544	GH	On-Demand	Anodyne	ADRB2	26	44
C[C@H](O)c1cc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1F	ZINC000819481570	GG	On-Demand	Anodyne	GPR119	59	55
C[C@H](O)c1cc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1F	ZINC000819481572	GG	On-Demand	Anodyne	GPR119	59	55
COC[C@@H](C)OC[C@H](O)CNc1ccc2cc(OC)ccc2c1	ZINC000819481576	DF	On-Demand	Anodyne	ADRB2	18	40
COC[C@@H](C)OC[C@@H](O)CNc1ccc2cc(OC)ccc2c1	ZINC000819481578	DF	On-Demand	Anodyne	ADRB2	18	40
C[C@H](O)c1cc(NC[C@@H](O)c2ccccc2)ccc1F	ZINC000819481581	CG	On-Demand	Anodyne	ADRB2	16	47
C[C@H](O)c1cc(NC[C@H](O)c2ccccc2)ccc1F	ZINC000819481583	CG	On-Demand	Anodyne	ADRB2	16	47
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COCc1ccccc1	ZINC000819481585	FG	On-Demand	Anodyne	ADRB2	19	41
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COCc1ccccc1	ZINC000819481585	FG	On-Demand	Anodyne	ADRB1	38	40
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COCc1ccccc1	ZINC000819481587	FG	On-Demand	Anodyne	ADRB2	19	41
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COCc1ccccc1	ZINC000819481587	FG	On-Demand	Anodyne	ADRB1	38	40
CO[C@@H]1CN(C(=O)c2ccc(-n3cnc4ccccc43)nc2)CCO1	ZINC000819481602	ED	On-Demand	Anodyne	HPGD	46	39
CO[C@H]1CN(C(=O)c2ccc(-n3cnc4ccccc43)nc2)CCO1	ZINC000819481608	ED	On-Demand	Anodyne	HPGD	46	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc3sc(C)nc3c1)C2	ZINC000819481620	FG	On-Demand	Anodyne	ACOX1	57	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc3sc(C)nc3c1)C2	ZINC000819481624	FG	On-Demand	Anodyne	ACOX1	57	40
NS(=O)(=O)c1ccc(C(=O)NCC2OCCCO2)cc1	ZINC000819481653	DB	On-Demand	Anodyne	CA2	135	67
NS(=O)(=O)c1ccc(C(=O)NCC2OCCCO2)cc1	ZINC000819481653	DB	On-Demand	Anodyne	CA6	22	44
NS(=O)(=O)c1ccc(C(=O)NCC2OCCCO2)cc1	ZINC000819481653	DB	On-Demand	Anodyne	CA1	102	60
NS(=O)(=O)c1ccc(C(=O)NCC2OCCCO2)cc1	ZINC000819481653	DB	On-Demand	Anodyne	CA7	79	45
NS(=O)(=O)c1ccc(C(=O)NCC2OCCCO2)cc1	ZINC000819481653	DB	On-Demand	Anodyne	CA5B	62	40
NS(=O)(=O)c1ccc(C(=O)NCC2OCCCO2)cc1	ZINC000819481653	DB	On-Demand	Anodyne	CA4	86	60
NS(=O)(=O)c1ccc(C(=O)NCC2OCCCO2)cc1	ZINC000819481653	DB	On-Demand	Anodyne	CA5A	66	40
NS(=O)(=O)c1ccc(C(=O)NCC2OCCCO2)cc1	ZINC000819481653	DB	On-Demand	Anodyne	CA14	86	55
NS(=O)(=O)c1ccc(C(=O)NCC2OCCCO2)cc1	ZINC000819481653	DB	On-Demand	Anodyne	CA12	87	55
NS(=O)(=O)c1ccc(C(=O)NCC2OCCCO2)cc1	ZINC000819481653	DB	On-Demand	Anodyne	CA9	87	55
NS(=O)(=O)c1ccc(C(=O)NCC2OCCCO2)cc1	ZINC000819481653	DB	On-Demand	Anodyne	CYNT	52	49
NS(=O)(=O)c1ccc(C(=O)NCC2OCCCO2)cc1	ZINC000819481653	DB	On-Demand	Anodyne	NCE103	25	44
NS(=O)(=O)c1ccc(C(=O)NCC2OCCCO2)cc1	ZINC000819481653	DB	On-Demand	Anodyne	MTCA1	44	39
NS(=O)(=O)c1ccc(C(=O)NCC2OCCCO2)cc1	ZINC000819481653	DB	On-Demand	Anodyne	P96878_MYCTU	55	39
NS(=O)(=O)c1ccc(C(=O)NCC2OCCCO2)cc1	ZINC000819481653	DB	On-Demand	Anodyne	A6YCJ1_9METZ	26	53
COC[C@@H](C)OC[C@@H](O)CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1	ZINC000819481658	FE	On-Demand	Anodyne	ADRB1	24	40
COC[C@@H](C)OC[C@H](O)CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1	ZINC000819481660	FE	On-Demand	Anodyne	ADRB1	24	40
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccccc1	ZINC000819481661	FG	On-Demand	Anodyne	ADRB2	58	48
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccccc1	ZINC000819481661	FG	On-Demand	Anodyne	ADRB1	81	45
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccccc1	ZINC000819481661	FG	On-Demand	Anodyne	ADRB3	55	45
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccccc1	ZINC000819481664	FG	On-Demand	Anodyne	ADRB2	58	48
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccccc1	ZINC000819481664	FG	On-Demand	Anodyne	ADRB1	81	45
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccccc1	ZINC000819481664	FG	On-Demand	Anodyne	ADRB3	55	45
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)CN1CCOCC1	ZINC000819481708	FE	On-Demand	Anodyne	ABCB1	20	40
O[C@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)CN1CCOCC1	ZINC000819481711	FE	On-Demand	Anodyne	ABCB1	20	40
O[C@@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)CN1CCOCC1	ZINC000819481715	FE	On-Demand	Anodyne	ABCB1	20	40
O[C@@H](CCc1ccc(NC[C@@H](O)CN2CCOCC2)cc1)c1ccccc1	ZINC000819481716	FE	On-Demand	Anodyne	ABCB1	20	40
O=C(/C=C\[C@@H]1CCCO1)N[C@H](CO)c1ccc(Cl)cc1	ZINC000819481724	CE	On-Demand	Anodyne	UTS2	40	32
O=C(/C=C/[C@@H]1CCCO1)N[C@H](CO)c1ccc(Cl)cc1	ZINC000819481725	CE	On-Demand	Anodyne	UTS2	40	32
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](CO)c1ccc(Cl)cc1	ZINC000819481727	CE	On-Demand	Anodyne	UTS2	40	32
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](CO)c1ccc(Cl)cc1	ZINC000819481729	CE	On-Demand	Anodyne	UTS2	40	32
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)cc1	ZINC000819481731	GG	On-Demand	Anodyne	ADRB2	34	46
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)cc1	ZINC000819481731	GG	On-Demand	Anodyne	ADRB1	61	46
N#Cc1ccc(OC[C@@H](O)CNc2ccc(F)cc2OCCC(F)(F)F)cc1	ZINC000819481734	GH	On-Demand	Mild	ADRB1	52	34
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)cc1	ZINC000819481735	GG	On-Demand	Anodyne	ADRB2	34	46
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)cc1	ZINC000819481735	GG	On-Demand	Anodyne	ADRB1	61	46
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccc(F)cc1	ZINC000819481736	GG	On-Demand	Anodyne	ADRB2	36	40
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccc(F)cc1	ZINC000819481736	GG	On-Demand	Anodyne	ADRB1	57	47
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccc(F)cc1	ZINC000819481736	GG	On-Demand	Anodyne	ADRB3	33	40
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccc(F)cc1	ZINC000819481738	GG	On-Demand	Anodyne	ADRB2	36	40
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccc(F)cc1	ZINC000819481738	GG	On-Demand	Anodyne	ADRB1	57	47
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccc(F)cc1	ZINC000819481738	GG	On-Demand	Anodyne	ADRB3	33	40
N#Cc1ccc(OC[C@H](O)CNc2ccc(F)cc2OCCC(F)(F)F)cc1	ZINC000819481741	GH	On-Demand	Mild	ADRB1	52	34
Cc1cc(OCC(=O)N2CCNC(=O)[C@@H]2c2c(C)nc3ccccn23)cc(C)c1Cl	ZINC000819481748	IF	On-Demand	Anodyne	CPT1A	73	36
Cc1cc(OCC(=O)N2CCNC(=O)[C@H]2c2c(C)nc3ccccn23)cc(C)c1Cl	ZINC000819481753	IF	On-Demand	Anodyne	CPT1A	73	36
COC(=O)Nc1cc(C(=O)NCC2OCCCO2)cc(C(F)(F)F)c1	ZINC000819481819	FE	On-Demand	Anodyne	CACNA1I	37	44
CNC(=O)COc1ccc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)c(C)c1	ZINC000819481897	GG	On-Demand	Anodyne	PPARD	54	40
CNC(=O)COc1ccc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)c(C)c1	ZINC000819481902	GG	On-Demand	Anodyne	PPARD	54	40
C[C@H](O)c1cc(NC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)ccc1F	ZINC000819481904	GG	On-Demand	Anodyne	GPR119	28	41
COc1cc(NC[C@H](O)c2cccnc2)c(C)cc1C	ZINC000819481906	CF	On-Demand	Anodyne	ADRB1	19	43
COc1cc(NC[C@H](O)c2cccnc2)c(C)cc1C	ZINC000819481906	CF	On-Demand	Anodyne	ADRB3	51	43
COc1cc(NC[C@@H](O)c2cccnc2)c(C)cc1C	ZINC000819481908	CF	On-Demand	Anodyne	ADRB1	19	43
COc1cc(NC[C@@H](O)c2cccnc2)c(C)cc1C	ZINC000819481908	CF	On-Demand	Anodyne	ADRB3	51	43
C[C@H](O)c1cc(NC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)ccc1F	ZINC000819481909	GG	On-Demand	Anodyne	GPR119	28	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)c1	ZINC000819481924	GG	On-Demand	Anodyne	ADRB2	39	43
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)c1	ZINC000819481924	GG	On-Demand	Anodyne	ADRB1	68	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)c1	ZINC000819481924	GG	On-Demand	Anodyne	ADRB3	45	38
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)c1	ZINC000819481924	GG	On-Demand	Anodyne	ABCB1	18	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)c1	ZINC000819481924	GG	On-Demand	Anodyne	PDS	41	35
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)c1	ZINC000819481926	GG	On-Demand	Anodyne	ADRB2	39	43
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)c1	ZINC000819481926	GG	On-Demand	Anodyne	ADRB1	68	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)c1	ZINC000819481926	GG	On-Demand	Anodyne	ADRB3	45	38
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)c1	ZINC000819481926	GG	On-Demand	Anodyne	ABCB1	18	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)c1	ZINC000819481926	GG	On-Demand	Anodyne	PDS	41	35
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccccc1Cl	ZINC000819481928	GH	On-Demand	Anodyne	ADRB2	36	40
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccccc1Cl	ZINC000819481928	GH	On-Demand	Anodyne	ADRB1	57	41
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccccc1Cl	ZINC000819481928	GH	On-Demand	Anodyne	ADRB3	25	40
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccccc1Cl	ZINC000819481931	GH	On-Demand	Anodyne	ADRB2	36	40
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccccc1Cl	ZINC000819481931	GH	On-Demand	Anodyne	ADRB1	57	41
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccccc1Cl	ZINC000819481931	GH	On-Demand	Anodyne	ADRB3	25	40
CC(C)(C)OC(=O)CCc1cccc(NC[C@H](O)c2cccc(F)c2)c1	ZINC000819481976	FI	On-Demand	Anodyne	ADRB1	24	40
CC(C)(C)OC(=O)CCc1cccc(NC[C@H](O)c2cccc(F)c2)c1	ZINC000819481976	FI	On-Demand	Anodyne	ADRB3	30	40
CC(C)(C)OC(=O)CCc1cccc(NC[C@@H](O)c2cccc(F)c2)c1	ZINC000819481978	FI	On-Demand	Anodyne	ADRB1	24	40
CC(C)(C)OC(=O)CCc1cccc(NC[C@@H](O)c2cccc(F)c2)c1	ZINC000819481978	FI	On-Demand	Anodyne	ADRB3	30	40
C[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)S(C)(=O)=O	ZINC000819481987	EG	On-Demand	Anodyne	ADRB2	33	52
C[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)S(C)(=O)=O	ZINC000819481987	EG	On-Demand	Anodyne	ADRB1	34	41
C[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)S(C)(=O)=O	ZINC000819481987	EG	On-Demand	Anodyne	ADRB3	82	41
C[C@@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)S(C)(=O)=O	ZINC000819481991	EG	On-Demand	Anodyne	ADRB2	33	52
C[C@@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)S(C)(=O)=O	ZINC000819481991	EG	On-Demand	Anodyne	ADRB1	34	41
C[C@@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)S(C)(=O)=O	ZINC000819481991	EG	On-Demand	Anodyne	ADRB3	82	41
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819481992	FF	On-Demand	Anodyne	ADRB2	45	57
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819481992	FF	On-Demand	Anodyne	ADRB1	74	57
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819481992	FF	On-Demand	Anodyne	ADRB3	49	49
CC(=O)Nc1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819481992	FF	On-Demand	Anodyne	PDS	49	40
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819481994	FF	On-Demand	Anodyne	ADRB2	45	57
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819481994	FF	On-Demand	Anodyne	ADRB1	74	57
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819481994	FF	On-Demand	Anodyne	ADRB3	49	49
CC(=O)Nc1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819481994	FF	On-Demand	Anodyne	PDS	49	40
O=C1NCCN(C(=O)/C=C/[C@@H]2CCCO2)[C@@H]1c1ccccc1C(F)(F)F	ZINC000819482024	FE	On-Demand	Anodyne	RBP4	76	39
O=C1NCCN(C(=O)/C=C/[C@@H]2CCCO2)[C@H]1c1ccccc1C(F)(F)F	ZINC000819482027	FE	On-Demand	Anodyne	RBP4	76	39
O=C1NCCN(C(=O)/C=C\[C@@H]2CCCO2)[C@H]1c1ccccc1C(F)(F)F	ZINC000819482029	FE	On-Demand	Anodyne	RBP4	76	39
O=C1NCCN(C(=O)/C=C\[C@@H]2CCCO2)[C@@H]1c1ccccc1C(F)(F)F	ZINC000819482031	FE	On-Demand	Anodyne	RBP4	76	39
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2cccc(C(C)(C)O)c2)CC1	ZINC000819482033	GG	On-Demand	Anodyne	GPR119	49	49
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2cccc(C(C)(C)O)c2)CC1	ZINC000819482035	GG	On-Demand	Anodyne	GPR119	49	49
COc1ccc2cc(NC[C@](C)(O)CNC(=O)OC(C)(C)C)ccc2c1	ZINC000819482038	FH	On-Demand	Anodyne	NQO2	42	39
COc1ccc2cc(NC[C@](C)(O)CNC(=O)OC(C)(C)C)ccc2c1	ZINC000819482038	FH	On-Demand	Anodyne	HDAC8	15	43
COc1ccc2cc(NC[C@](C)(O)CNC(=O)OC(C)(C)C)ccc2c1	ZINC000819482038	FH	On-Demand	Anodyne	MTNR1A	80	43
COc1ccc2cc(NC[C@](C)(O)CNC(=O)OC(C)(C)C)ccc2c1	ZINC000819482038	FH	On-Demand	Anodyne	MTNR1B	67	39
CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2c(cn1)OCCO2	ZINC000819482039	GE	On-Demand	Anodyne	GPR119	41	40
COc1ccc2cc(NC[C@@](C)(O)CNC(=O)OC(C)(C)C)ccc2c1	ZINC000819482040	FH	On-Demand	Anodyne	NQO2	42	39
COc1ccc2cc(NC[C@@](C)(O)CNC(=O)OC(C)(C)C)ccc2c1	ZINC000819482040	FH	On-Demand	Anodyne	HDAC8	15	43
COc1ccc2cc(NC[C@@](C)(O)CNC(=O)OC(C)(C)C)ccc2c1	ZINC000819482040	FH	On-Demand	Anodyne	MTNR1A	80	43
COc1ccc2cc(NC[C@@](C)(O)CNC(=O)OC(C)(C)C)ccc2c1	ZINC000819482040	FH	On-Demand	Anodyne	MTNR1B	67	39
CCOC[C@H](O)CNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819482060	EG	On-Demand	Anodyne	ADRB2	37	51
CCOC[C@H](O)CNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819482060	EG	On-Demand	Anodyne	ADRB1	45	40
CCOC[C@H](O)CNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819482060	EG	On-Demand	Anodyne	ADRB3	41	39
CCOC[C@H](O)CNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819482060	EG	On-Demand	Anodyne	CASR	17	41
CCOC[C@H](O)CNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819482064	EG	On-Demand	Anodyne	ADRB2	37	51
CCOC[C@H](O)CNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819482064	EG	On-Demand	Anodyne	ADRB1	45	40
CCOC[C@H](O)CNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819482064	EG	On-Demand	Anodyne	ADRB3	41	39
CCOC[C@H](O)CNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819482064	EG	On-Demand	Anodyne	CASR	17	41
COc1ccc2cc(NC[C@H](O)COCC(C)C)ccc2c1	ZINC000819482074	DG	On-Demand	Anodyne	ADRB2	21	47
COc1ccc2cc(NC[C@@H](O)COCC(C)C)ccc2c1	ZINC000819482075	DG	On-Demand	Anodyne	ADRB2	21	47
COc1ccc2cc(NC[C@@H](O)CN3CCN(C)CC3)ccc2c1	ZINC000819482076	ED	On-Demand	Anodyne	ACOX1	52	33
COc1ccc2cc(NC[C@H](O)CN3CCN(C)CC3)ccc2c1	ZINC000819482077	ED	On-Demand	Anodyne	ACOX1	52	33
O[C@H](CNc1ccc(F)cc1OCCC(F)(F)F)COc1ccccc1F	ZINC000819482089	GI	On-Demand	Anodyne	ADRB1	48	37
O[C@@H](CNc1ccc(F)cc1OCCC(F)(F)F)COc1ccccc1F	ZINC000819482090	GI	On-Demand	Anodyne	ADRB1	48	37
COCCc1ccc(OC[C@@H](O)CNc2ccc3cc(OC)ccc3c2)cc1	ZINC000819482098	GH	On-Demand	Anodyne	ADRB2	51	60
COCCc1ccc(OC[C@@H](O)CNc2ccc3cc(OC)ccc3c2)cc1	ZINC000819482098	GH	On-Demand	Anodyne	ADRB1	71	60
COCCc1ccc(OC[C@@H](O)CNc2ccc3cc(OC)ccc3c2)cc1	ZINC000819482098	GH	On-Demand	Anodyne	GRIN1	27	41
COCCc1ccc(OC[C@@H](O)CNc2ccc3cc(OC)ccc3c2)cc1	ZINC000819482098	GH	On-Demand	Anodyne	ADRB3	52	52
COCCc1ccc(OC[C@H](O)CNc2ccc3cc(OC)ccc3c2)cc1	ZINC000819482101	GH	On-Demand	Anodyne	ADRB2	51	60
COCCc1ccc(OC[C@H](O)CNc2ccc3cc(OC)ccc3c2)cc1	ZINC000819482101	GH	On-Demand	Anodyne	ADRB1	71	60
COCCc1ccc(OC[C@H](O)CNc2ccc3cc(OC)ccc3c2)cc1	ZINC000819482101	GH	On-Demand	Anodyne	GRIN1	27	41
COCCc1ccc(OC[C@H](O)CNc2ccc3cc(OC)ccc3c2)cc1	ZINC000819482101	GH	On-Demand	Anodyne	ADRB3	52	52
O=C(CC(F)(F)F)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819482106	EG	On-Demand	Anodyne	ADRB2	24	46
O=C(CC(F)(F)F)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819482106	EG	On-Demand	Anodyne	ADRB1	25	44
O=C(CC(F)(F)F)Nc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819482106	EG	On-Demand	Anodyne	ADRB3	96	53
O=C(CC(F)(F)F)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819482107	EG	On-Demand	Anodyne	ADRB2	24	46
O=C(CC(F)(F)F)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819482107	EG	On-Demand	Anodyne	ADRB1	25	44
O=C(CC(F)(F)F)Nc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819482107	EG	On-Demand	Anodyne	ADRB3	96	53
O[C@H](CNc1ccc(F)cc1OCCC(F)(F)F)CN1CCOCC1	ZINC000819482110	FE	On-Demand	Anodyne	CCR1	35	40
O[C@@H](CNc1ccc(F)cc1OCCC(F)(F)F)CN1CCOCC1	ZINC000819482112	FE	On-Demand	Anodyne	CCR1	35	40
COc1ccc2cc(NC[C@@H](O)CCNC(=O)OC(C)(C)C)ccc2c1	ZINC000819482131	FH	On-Demand	Anodyne	MTNR1A	59	43
COc1ccc2cc(NC[C@@H](O)CCNC(=O)OC(C)(C)C)ccc2c1	ZINC000819482131	FH	On-Demand	Anodyne	MTNR1B	53	37
COc1ccc2cc(NC[C@H](O)CCNC(=O)OC(C)(C)C)ccc2c1	ZINC000819482132	FH	On-Demand	Anodyne	MTNR1A	59	43
COc1ccc2cc(NC[C@H](O)CCNC(=O)OC(C)(C)C)ccc2c1	ZINC000819482132	FH	On-Demand	Anodyne	MTNR1B	53	37
Cc1nc2cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc2s1	ZINC000819482144	GI	On-Demand	Mild	PAPA1_CARPA	38	40
Cc1nc2cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc2s1	ZINC000819482144	GI	On-Demand	Mild	ACOX1	47	35
Cc1nc2cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc2s1	ZINC000819482148	GI	On-Demand	Mild	PAPA1_CARPA	38	40
Cc1nc2cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc2s1	ZINC000819482148	GI	On-Demand	Mild	ACOX1	47	35
COCCc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819482156	FF	On-Demand	Anodyne	ADRB2	44	58
COCCc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819482156	FF	On-Demand	Anodyne	ADRB1	65	58
COCCc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819482156	FF	On-Demand	Anodyne	GRIN1	26	45
COCCc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819482156	FF	On-Demand	Anodyne	ADRB3	44	42
COCCc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819482158	FF	On-Demand	Anodyne	ADRB2	44	58
COCCc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819482158	FF	On-Demand	Anodyne	ADRB1	65	58
COCCc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819482158	FF	On-Demand	Anodyne	GRIN1	26	45
COCCc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819482158	FF	On-Demand	Anodyne	ADRB3	44	42
COCCc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819482159	FF	On-Demand	Anodyne	ADRB2	44	58
COCCc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819482159	FF	On-Demand	Anodyne	ADRB1	65	58
COCCc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819482159	FF	On-Demand	Anodyne	GRIN1	26	45
COCCc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819482159	FF	On-Demand	Anodyne	ADRB3	44	42
COCCc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819482161	FF	On-Demand	Anodyne	ADRB2	44	58
COCCc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819482161	FF	On-Demand	Anodyne	ADRB1	65	58
COCCc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819482161	FF	On-Demand	Anodyne	GRIN1	26	45
COCCc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819482161	FF	On-Demand	Anodyne	ADRB3	44	42
CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)N2C(=O)c1coc(=O)c2ccccc12	ZINC000819482168	GG	On-Demand	Anodyne	CCR8	51	33
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCC1OCCCO1	ZINC000819482173	FD	On-Demand	Anodyne	EDNRB	49	33
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCC1OCCCO1	ZINC000819482173	FD	On-Demand	Anodyne	EDNRA	26	40
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCC1OCCCO1	ZINC000819482173	FD	On-Demand	Anodyne	MPO	44	34
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCC1OCCCO1	ZINC000819482173	FD	On-Demand	Anodyne	BRS3	26	40
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCC1OCCCO1	ZINC000819482173	FD	On-Demand	Anodyne	NMBR	17	43
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCC1OCCCO1	ZINC000819482173	FD	On-Demand	Anodyne	GRPR	59	35
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCC1OCCCO1	ZINC000819482173	FD	On-Demand	Anodyne	GHSR	18	43
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCC1OCCCO1	ZINC000819482173	FD	On-Demand	Anodyne	MC1R	47	38
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)NCC1OCCCO1	ZINC000819482173	FD	On-Demand	Anodyne	KISS1R	65	36
CN(C)[C@@H]1CCC[C@H]1NC(=O)C[C@@](C)(O)c1ccccc1	ZINC000819482181	CD	On-Demand	Anodyne	AMY2	57	34
O=C(CCCCNC(=O)c1cc2c(cn1)OCCO2)OCc1ccccc1	ZINC000819482182	FE	On-Demand	Anodyne	NPR	41	35
CN(C)[C@@H]1CCC[C@H]1NC(=O)C[C@](C)(O)c1ccccc1	ZINC000819482183	CD	On-Demand	Anodyne	AMY2	57	34
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)CN1CCc2ccccc2C1	ZINC000819482189	GG	On-Demand	Anodyne	NOD2	41	36
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)CN1CCc2ccccc2C1	ZINC000819482190	GG	On-Demand	Anodyne	NOD2	41	36
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819482224	FG	On-Demand	Anodyne	ADRB2	49	44
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819482224	FG	On-Demand	Anodyne	ADRB1	75	47
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819482224	FG	On-Demand	Anodyne	ADRB3	56	44
CC(=O)CCc1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819482224	FG	On-Demand	Anodyne	PDS	49	34
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819482229	FG	On-Demand	Anodyne	ADRB2	49	44
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819482229	FG	On-Demand	Anodyne	ADRB1	75	47
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819482229	FG	On-Demand	Anodyne	ADRB3	56	44
CC(=O)CCc1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819482229	FG	On-Demand	Anodyne	PDS	49	34
CO[C@@H]1CCOc2c(NC[C@@H](O)COc3cccc4[nH]ccc34)cccc21	ZINC000819482232	FG	On-Demand	Anodyne	ADRB1	18	55
CO[C@@H]1CCOc2c(NC[C@H](O)COc3cccc4[nH]ccc34)cccc21	ZINC000819482234	FG	On-Demand	Anodyne	ADRB1	18	55
CO[C@H]1CCOc2c(NC[C@@H](O)COc3cccc4[nH]ccc34)cccc21	ZINC000819482237	FG	On-Demand	Anodyne	ADRB1	18	55
CO[C@H]1CCOc2c(NC[C@H](O)COc3cccc4[nH]ccc34)cccc21	ZINC000819482239	FG	On-Demand	Anodyne	ADRB1	18	55
O=C(NCC1OCCCO1)c1csc(-c2c(F)cccc2F)n1	ZINC000819482240	EF	On-Demand	Anodyne	PIM1	19	48
CN(CC(=O)NCC1OCCCO1)c1ccccc1[N+](=O)[O-]	ZINC000819482256	DC	On-Demand	Bother	COLA	46	31
C[C@H](O)c1cc(NC[C@H](O)c2cccnc2)ccc1F	ZINC000819482281	CE	On-Demand	Anodyne	ADRB1	23	41
C[C@H](O)c1cc(NC[C@H](O)c2cccnc2)ccc1F	ZINC000819482281	CE	On-Demand	Anodyne	ADRB3	87	42
C[C@H](O)c1cc(NC[C@@H](O)c2cccnc2)ccc1F	ZINC000819482285	CE	On-Demand	Anodyne	ADRB1	23	41
C[C@H](O)c1cc(NC[C@@H](O)c2cccnc2)ccc1F	ZINC000819482285	CE	On-Demand	Anodyne	ADRB3	87	42
CCCc1c(C(=O)NCC2OCCCO2)nnn1-c1cccc(Cl)c1	ZINC000819482286	FE	On-Demand	Anodyne	CNR1	20	41
CNC(=O)COc1ccc(NC[C@H](O)c2cccnc2)c(C)c1	ZINC000819482321	DD	On-Demand	Anodyne	ADRB1	25	42
CNC(=O)COc1ccc(NC[C@H](O)c2cccnc2)c(C)c1	ZINC000819482321	DD	On-Demand	Anodyne	ADRB3	69	42
CNC(=O)COc1ccc(NC[C@@H](O)c2cccnc2)c(C)c1	ZINC000819482324	DD	On-Demand	Anodyne	ADRB1	25	42
CNC(=O)COc1ccc(NC[C@@H](O)c2cccnc2)c(C)c1	ZINC000819482324	DD	On-Demand	Anodyne	ADRB3	69	42
O[C@@H](CNc1ccc(N2CCCCC2)c2ncccc12)c1cccnc1	ZINC000819482334	EH	On-Demand	Anodyne	ADRB3	61	45
O[C@H](CNc1ccc(N2CCCCC2)c2ncccc12)c1cccnc1	ZINC000819482336	EH	On-Demand	Anodyne	ADRB3	61	45
CNC(=O)COc1ccc(NC[C@@H](O)Cc2ccccc2)c(C)c1	ZINC000819482343	EE	On-Demand	Anodyne	ADRB1	18	40
CNC(=O)COc1ccc(NC[C@@H](O)Cc2ccccc2)c(C)c1	ZINC000819482343	EE	On-Demand	Anodyne	PPARA	17	44
CNC(=O)COc1ccc(NC[C@H](O)Cc2ccccc2)c(C)c1	ZINC000819482344	EE	On-Demand	Anodyne	ADRB1	18	40
CNC(=O)COc1ccc(NC[C@H](O)Cc2ccccc2)c(C)c1	ZINC000819482344	EE	On-Demand	Anodyne	PPARA	17	44
CO[C@H]1CCOc2c(NC[C@@H](O)COc3ccccc3C)cccc21	ZINC000819482357	EG	On-Demand	Anodyne	ADRB2	21	45
CO[C@@H]1CCOc2c(NC[C@@H](O)COc3ccccc3C)cccc21	ZINC000819482359	EG	On-Demand	Anodyne	ADRB2	21	45
CO[C@@H]1CCOc2c(NC[C@H](O)COc3ccccc3C)cccc21	ZINC000819482361	EG	On-Demand	Anodyne	ADRB2	21	45
CO[C@H]1CCOc2c(NC[C@H](O)COc3ccccc3C)cccc21	ZINC000819482362	EG	On-Demand	Anodyne	ADRB2	21	45
CC(C)(C)NS(=O)(=O)c1cc(C(=O)NCC2OCCCO2)ccc1F	ZINC000819482390	FD	On-Demand	Anodyne	CACNA1I	42	33
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@H]3OC)cc1	ZINC000819482420	GG	On-Demand	Anodyne	ADRB2	27	48
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@H]3OC)cc1	ZINC000819482420	GG	On-Demand	Anodyne	ADRB1	52	48
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@H]3OC)cc1	ZINC000819482421	GG	On-Demand	Anodyne	ADRB2	27	48
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@H]3OC)cc1	ZINC000819482421	GG	On-Demand	Anodyne	ADRB1	52	48
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@@H]3OC)cc1	ZINC000819482422	GG	On-Demand	Anodyne	ADRB2	27	48
COCCc1ccc(OC[C@H](O)CNc2cccc3c2OCC[C@@H]3OC)cc1	ZINC000819482422	GG	On-Demand	Anodyne	ADRB1	52	48
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@@H]3OC)cc1	ZINC000819482423	GG	On-Demand	Anodyne	ADRB2	27	48
COCCc1ccc(OC[C@@H](O)CNc2cccc3c2OCC[C@@H]3OC)cc1	ZINC000819482423	GG	On-Demand	Anodyne	ADRB1	52	48
Cn1cc(-c2nc([C@@H]3CCCCCN3C(=O)/C=C\[C@H]3CCCO3)no2)cn1	ZINC000819482426	FF	On-Demand	Anodyne	CPT1A	41	42
O[C@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)Cc1ccccc1	ZINC000819482431	FI	On-Demand	Anodyne	ADRB2	29	57
O[C@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)Cc1ccccc1	ZINC000819482431	FI	On-Demand	Anodyne	ADRB1	33	44
O[C@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)Cc1ccccc1	ZINC000819482431	FI	On-Demand	Anodyne	ADRB3	45	42
O[C@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)Cc1ccccc1	ZINC000819482431	FI	On-Demand	Anodyne	ANPEP	45	32
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)Cc1ccccc1	ZINC000819482434	FI	On-Demand	Anodyne	ADRB2	29	57
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)Cc1ccccc1	ZINC000819482434	FI	On-Demand	Anodyne	ADRB1	33	44
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)Cc1ccccc1	ZINC000819482434	FI	On-Demand	Anodyne	ADRB3	45	42
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)Cc1ccccc1	ZINC000819482434	FI	On-Demand	Anodyne	ANPEP	45	32
O[C@@H](CCc1ccc(NC[C@H](O)Cc2ccccc2)cc1)c1ccccc1	ZINC000819482435	FI	On-Demand	Anodyne	ADRB2	29	57
O[C@@H](CCc1ccc(NC[C@H](O)Cc2ccccc2)cc1)c1ccccc1	ZINC000819482435	FI	On-Demand	Anodyne	ADRB1	33	44
O[C@@H](CCc1ccc(NC[C@H](O)Cc2ccccc2)cc1)c1ccccc1	ZINC000819482435	FI	On-Demand	Anodyne	ADRB3	45	42
O[C@@H](CCc1ccc(NC[C@H](O)Cc2ccccc2)cc1)c1ccccc1	ZINC000819482435	FI	On-Demand	Anodyne	ANPEP	45	32
O[C@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)Cc1ccccc1	ZINC000819482436	FI	On-Demand	Anodyne	ADRB2	29	57
O[C@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)Cc1ccccc1	ZINC000819482436	FI	On-Demand	Anodyne	ADRB1	33	44
O[C@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)Cc1ccccc1	ZINC000819482436	FI	On-Demand	Anodyne	ADRB3	45	42
O[C@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)Cc1ccccc1	ZINC000819482436	FI	On-Demand	Anodyne	ANPEP	45	32
C=CCC1(C(=O)Nc2ccc3sc(C)nc3c2)CCOCC1	ZINC000819482437	DH	On-Demand	Mild	ACOX1	69	38
Cc1nc2cc(NC(=O)C[C@H](C)n3cccn3)ccc2s1	ZINC000819482527	DG	On-Demand	Anodyne	ACOX1	65	42
Cc1nc2cc(NC(=O)C[C@H](C)n3cccn3)ccc2s1	ZINC000819482527	DG	On-Demand	Anodyne	ENPP1	40	31
Cc1nc2cc(NC(=O)C[C@@H](C)n3cccn3)ccc2s1	ZINC000819482529	DG	On-Demand	Anodyne	ACOX1	65	42
Cc1nc2cc(NC(=O)C[C@@H](C)n3cccn3)ccc2s1	ZINC000819482529	DG	On-Demand	Anodyne	ENPP1	40	31
Cn1cnc(-c2ccc(NC(=O)/C=C\[C@@H]3CCCO3)cc2)n1	ZINC000819482544	CE	On-Demand	Anodyne	MTOR	40	34
Cn1cnc(-c2ccc(NC(=O)/C=C/[C@H]3CCCO3)cc2)n1	ZINC000819482546	CE	On-Demand	Anodyne	MTOR	40	34
Cn1cnc(-c2ccc(NC(=O)/C=C\[C@H]3CCCO3)cc2)n1	ZINC000819482548	CE	On-Demand	Anodyne	MTOR	40	34
Cn1cnc(-c2ccc(NC(=O)/C=C/[C@@H]3CCCO3)cc2)n1	ZINC000819482549	CE	On-Demand	Anodyne	MTOR	40	34
O=C1CSc2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2N1CC(F)F	ZINC000819482582	GI	On-Demand	Anodyne	ADRB1	22	41
O=C1CSc2ccc(NC[C@H](O)c3cccc(Cl)c3)cc2N1CC(F)F	ZINC000819482582	GI	On-Demand	Anodyne	CYP3A4	45	34
O=C1CSc2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2N1CC(F)F	ZINC000819482583	GI	On-Demand	Anodyne	ADRB1	22	41
O=C1CSc2ccc(NC[C@@H](O)c3cccc(Cl)c3)cc2N1CC(F)F	ZINC000819482583	GI	On-Demand	Anodyne	CYP3A4	45	34
O=C(CCNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)Nc1ccccc1	ZINC000819482600	FH	On-Demand	Anodyne	LTA4H	42	41
O=C(CCNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)Nc1ccccc1	ZINC000819482600	FH	On-Demand	Anodyne	EPHX2	16	41
COC[C@@H](O)CNc1ccc2cc(OC)ccc2c1	ZINC000819482612	CE	On-Demand	Anodyne	ADRB2	24	42
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	PLG	22	43
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	ACE	67	38
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	OPRM1	37	42
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	OPRD1	31	41
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	CELA1	18	45
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	MME	96	38
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	TACR1	23	50
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	CTSD	27	46
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	PGC	70	44
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	CMA1	35	43
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	CTRA_BOVIN	26	43
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	FCER2	74	34
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	CASP3	17	43
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	CTSB	47	41
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	PAPA1_CARPA	82	55
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	CYSP_TRYCR	58	43
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	CCKAR	75	61
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	CTSK	39	54
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	CTSL	57	55
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	CACNA1B	65	41
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	PGA	38	44
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	TIMP3	87	42
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	TACR3	21	48
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	CAPNS1	61	36
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	HLA-DRB1	53	46
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	REN	114	53
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	REN1	36	45
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	CCKBR	28	50
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	CTSS	27	55
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	CAPN1	68	47
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	MMP9	17	42
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	CAPN2	56	39
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	CTSE	18	42
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	ACE2	52	36
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	MMP1	25	42
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	FPR1	79	54
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	CTRB_BOVIN	21	41
CN(C)[C@@H]1CCC[C@H]1NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819482645	GF	On-Demand	Anodyne	PSMB8	53	33
O=C(NCC1OCCCO1)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819482652	HF	On-Demand	Anodyne	OPRM1	15	40
O=C(NCC1OCCCO1)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819482652	HF	On-Demand	Anodyne	OPRD1	49	38
O=C(NCC1OCCCO1)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819482652	HF	On-Demand	Anodyne	CFTR	72	46
O=C(NCC1OCCCO1)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819482652	HF	On-Demand	Anodyne	ADAM9	40	31
Cn1cc(-c2nc([C@@H]3CCCCCN3C(=O)/C=C\[C@@H]3CCCO3)no2)cn1	ZINC000819482653	FF	On-Demand	Anodyne	CPT1A	41	42
O=C(NCC1OCCCO1)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819482654	HF	On-Demand	Anodyne	OPRM1	15	40
O=C(NCC1OCCCO1)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819482654	HF	On-Demand	Anodyne	OPRD1	49	38
O=C(NCC1OCCCO1)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819482654	HF	On-Demand	Anodyne	CFTR	72	46
O=C(NCC1OCCCO1)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819482654	HF	On-Demand	Anodyne	ADAM9	40	31
Cn1cc(-c2nc([C@@H]3CCCCCN3C(=O)/C=C/[C@@H]3CCCO3)no2)cn1	ZINC000819482655	FF	On-Demand	Anodyne	CPT1A	41	42
Cn1cc(-c2nc([C@@H]3CCCCCN3C(=O)/C=C/[C@H]3CCCO3)no2)cn1	ZINC000819482657	FF	On-Demand	Anodyne	CPT1A	41	42
O=C(CSc1ccccc1C(=O)NCC1OCCCO1)NC12CC3CC(CC(C3)C1)C2	ZINC000819482672	IG	On-Demand	Anodyne	EPHX2	45	39
CCC(C)(C)c1ccc(NCCS(=O)(=O)CC)cc1	ZINC000819482687	CG	On-Demand	Anodyne	CYNT	26	48
O=C(NCC1OCCCO1)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819482708	EH	On-Demand	Anodyne	DRD4	49	42
O=C(NCC1OCCCO1)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819482708	EH	On-Demand	Anodyne	RAF1	18	43
O=C(NCC1OCCCO1)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819482708	EH	On-Demand	Anodyne	CFTR	29	40
O=C(NCC1OCCCO1)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819482708	EH	On-Demand	Anodyne	PLAU	16	42
O=C(NCC1OCCCO1)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819482708	EH	On-Demand	Anodyne	CACNA1I	51	39
O=C(NCC1OCCCO1)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819482708	EH	On-Demand	Anodyne	CRTM	46	44
O[C@H](CNc1ccc(N2CCCCC2)c2ncccc12)C1CC1	ZINC000819482713	DG	On-Demand	Anodyne	HNMT	41	34
O[C@@H](CNc1ccc(N2CCCCC2)c2ncccc12)C1CC1	ZINC000819482714	DG	On-Demand	Anodyne	HNMT	41	34
CO[C@@H]1CCOc2c(NC[C@@H](O)COc3cccc4ccccc34)cccc21	ZINC000819482715	GI	On-Demand	Anodyne	ADRB2	22	47
CO[C@@H]1CCOc2c(NC[C@@H](O)COc3cccc4ccccc34)cccc21	ZINC000819482715	GI	On-Demand	Anodyne	ADRB1	22	47
CO[C@@H]1CCOc2c(NC[C@@H](O)COc3cccc4ccccc34)cccc21	ZINC000819482715	GI	On-Demand	Anodyne	CYP2D6	16	42
CO[C@@H]1CCOc2c(NC[C@H](O)COc3cccc4ccccc34)cccc21	ZINC000819482716	GI	On-Demand	Anodyne	ADRB2	22	47
CO[C@@H]1CCOc2c(NC[C@H](O)COc3cccc4ccccc34)cccc21	ZINC000819482716	GI	On-Demand	Anodyne	ADRB1	22	47
CO[C@@H]1CCOc2c(NC[C@H](O)COc3cccc4ccccc34)cccc21	ZINC000819482716	GI	On-Demand	Anodyne	CYP2D6	16	42
CO[C@H]1CCOc2c(NC[C@@H](O)COc3cccc4ccccc34)cccc21	ZINC000819482718	GI	On-Demand	Anodyne	ADRB2	22	47
CO[C@H]1CCOc2c(NC[C@@H](O)COc3cccc4ccccc34)cccc21	ZINC000819482718	GI	On-Demand	Anodyne	ADRB1	22	47
CO[C@H]1CCOc2c(NC[C@@H](O)COc3cccc4ccccc34)cccc21	ZINC000819482718	GI	On-Demand	Anodyne	CYP2D6	16	42
CO[C@H]1CCOc2c(NC[C@H](O)COc3cccc4ccccc34)cccc21	ZINC000819482720	GI	On-Demand	Anodyne	ADRB2	22	47
CO[C@H]1CCOc2c(NC[C@H](O)COc3cccc4ccccc34)cccc21	ZINC000819482720	GI	On-Demand	Anodyne	ADRB1	22	47
CO[C@H]1CCOc2c(NC[C@H](O)COc3cccc4ccccc34)cccc21	ZINC000819482720	GI	On-Demand	Anodyne	CYP2D6	16	42
Cc1ccccc1[C@@H](CC(=O)N1CCNC(=O)[C@H]1c1c(C)nc2ccccn12)NC(N)=O	ZINC000819482724	ID	On-Demand	Anodyne	CTSA	52	33
Cc1ccccc1[C@H](CC(=O)N1CCNC(=O)[C@H]1c1c(C)nc2ccccn12)NC(N)=O	ZINC000819482725	ID	On-Demand	Anodyne	CTSA	52	33
Cc1ccccc1[C@@H](CC(=O)N1CCNC(=O)[C@@H]1c1c(C)nc2ccccn12)NC(N)=O	ZINC000819482726	ID	On-Demand	Anodyne	CTSA	52	33
Cc1ccccc1[C@H](CC(=O)N1CCNC(=O)[C@@H]1c1c(C)nc2ccccn12)NC(N)=O	ZINC000819482727	ID	On-Demand	Anodyne	CTSA	52	33
O[C@@H](CNc1cccc2c1CCO2)c1cccc(Cl)c1	ZINC000819482770	CG	On-Demand	Anodyne	ADRB1	24	40
O[C@@H](CNc1cccc2c1CCO2)c1cccc(Cl)c1	ZINC000819482770	CG	On-Demand	Anodyne	ADRB3	38	40
O[C@@H](CNc1cccc2c1CCO2)c1cccc(Cl)c1	ZINC000819482770	CG	On-Demand	Anodyne	CYP3A4	49	37
O[C@H](CNc1cccc2c1CCO2)c1cccc(Cl)c1	ZINC000819482772	CG	On-Demand	Anodyne	ADRB1	24	40
O[C@H](CNc1cccc2c1CCO2)c1cccc(Cl)c1	ZINC000819482772	CG	On-Demand	Anodyne	ADRB3	38	40
O[C@H](CNc1cccc2c1CCO2)c1cccc(Cl)c1	ZINC000819482772	CG	On-Demand	Anodyne	CYP3A4	49	37
COC(=O)c1cccc(CC(=O)N2CCNC(=O)[C@@H]2c2c(C)nc3ccccn23)c1	ZINC000819482779	HD	On-Demand	Anodyne	BRS3	29	41
COC(=O)c1cccc(CC(=O)N2CCNC(=O)[C@H]2c2c(C)nc3ccccn23)c1	ZINC000819482781	HD	On-Demand	Anodyne	BRS3	29	41
CNC(=O)COc1cccc(CC(=O)NCC2OCCCO2)c1	ZINC000819482794	DC	On-Demand	Anodyne	CRTM	40	34
O=C(CCCc1cccc(C(F)(F)F)c1)NCC1OCCCO1	ZINC000819482806	EF	On-Demand	Anodyne	CCR2	71	39
O=C(CCCc1cccc(C(F)(F)F)c1)NCC1OCCCO1	ZINC000819482806	EF	On-Demand	Anodyne	LUXR	20	50
O=C(Cn1c(C2CCCCC2)nc2ccccc21)NCC1OCCCO1	ZINC000819482820	FF	On-Demand	Anodyne	HRH1	18	45
O=C(NCC1OCCCO1)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	ZINC000819482826	GD	On-Demand	Anodyne	FKBP1A	15	43
O=C(NCC1OCCCO1)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	ZINC000819482826	GD	On-Demand	Anodyne	PDE8B	19	41
O=C(NCC1OCCCO1)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	ZINC000819482826	GD	On-Demand	Anodyne	TMPRSS11D	58	35
O[C@@H](CCc1ccc(NC[C@H](O)C2CC2)cc1)c1ccccc1	ZINC000819482829	DH	On-Demand	Anodyne	ADRB3	26	40
O[C@H](CCc1ccc(NC[C@H](O)C2CC2)cc1)c1ccccc1	ZINC000819482830	DH	On-Demand	Anodyne	ADRB3	26	40
O[C@@H](CCc1ccc(NC[C@@H](O)C2CC2)cc1)c1ccccc1	ZINC000819482831	DH	On-Demand	Anodyne	ADRB3	26	40
O[C@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)C1CC1	ZINC000819482832	DH	On-Demand	Anodyne	ADRB3	26	40
O=C(/C=C/[C@@H]1CCCO1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000819482868	FG	On-Demand	Anodyne	ITGAL	54	34
O=C(/C=C/[C@@H]1CCCO1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000819482868	FG	On-Demand	Anodyne	RBP4	92	44
O=C(/C=C/[C@@H]1CCCO1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000819482871	FG	On-Demand	Anodyne	ITGAL	54	34
O=C(/C=C/[C@@H]1CCCO1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000819482871	FG	On-Demand	Anodyne	RBP4	92	44
O=C(/C=C\[C@@H]1CCCO1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000819482872	FG	On-Demand	Anodyne	ITGAL	54	34
O=C(/C=C\[C@@H]1CCCO1)N1CCO[C@H](c2ccccc2C(F)(F)F)C1	ZINC000819482872	FG	On-Demand	Anodyne	RBP4	92	44
O=C(/C=C\[C@@H]1CCCO1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000819482873	FG	On-Demand	Anodyne	ITGAL	54	34
O=C(/C=C\[C@@H]1CCCO1)N1CCO[C@@H](c2ccccc2C(F)(F)F)C1	ZINC000819482873	FG	On-Demand	Anodyne	RBP4	92	44
COc1ccc2cc(NC[C@@H](O)COc3ccc(CCC(C)=O)cc3)ccc2c1	ZINC000819482921	GI	On-Demand	Anodyne	ADRB2	55	48
COc1ccc2cc(NC[C@@H](O)COc3ccc(CCC(C)=O)cc3)ccc2c1	ZINC000819482921	GI	On-Demand	Anodyne	ADRB1	78	51
COc1ccc2cc(NC[C@@H](O)COc3ccc(CCC(C)=O)cc3)ccc2c1	ZINC000819482921	GI	On-Demand	Anodyne	GRIN1	28	41
COc1ccc2cc(NC[C@@H](O)COc3ccc(CCC(C)=O)cc3)ccc2c1	ZINC000819482921	GI	On-Demand	Anodyne	ADRB3	56	49
COc1ccc2cc(NC[C@@H](O)COc3ccc(CCC(C)=O)cc3)ccc2c1	ZINC000819482921	GI	On-Demand	Anodyne	ABCB1	30	40
COc1ccc2cc(NC[C@H](O)COc3ccc(CCC(C)=O)cc3)ccc2c1	ZINC000819482923	GI	On-Demand	Anodyne	ADRB2	55	48
COc1ccc2cc(NC[C@H](O)COc3ccc(CCC(C)=O)cc3)ccc2c1	ZINC000819482923	GI	On-Demand	Anodyne	ADRB1	78	51
COc1ccc2cc(NC[C@H](O)COc3ccc(CCC(C)=O)cc3)ccc2c1	ZINC000819482923	GI	On-Demand	Anodyne	GRIN1	28	41
COc1ccc2cc(NC[C@H](O)COc3ccc(CCC(C)=O)cc3)ccc2c1	ZINC000819482923	GI	On-Demand	Anodyne	ADRB3	56	49
COc1ccc2cc(NC[C@H](O)COc3ccc(CCC(C)=O)cc3)ccc2c1	ZINC000819482923	GI	On-Demand	Anodyne	ABCB1	30	40
O=C1CSc2ccc(NC[C@H](O)c3cccnc3)cc2N1CC(F)F	ZINC000819482925	FF	On-Demand	Anodyne	ADRB3	85	39
O=C1CSc2ccc(NC[C@@H](O)c3cccnc3)cc2N1CC(F)F	ZINC000819482928	FF	On-Demand	Anodyne	ADRB3	85	39
CC[C@H](O)CNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819482937	CH	On-Demand	Anodyne	ADRB2	27	57
CC[C@H](O)CNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819482937	CH	On-Demand	Anodyne	ADRB1	28	44
CC[C@H](O)CNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819482937	CH	On-Demand	Anodyne	ADRB3	43	42
CC[C@H](O)CNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819482939	CH	On-Demand	Anodyne	ADRB2	27	57
CC[C@H](O)CNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819482939	CH	On-Demand	Anodyne	ADRB1	28	44
CC[C@H](O)CNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819482939	CH	On-Demand	Anodyne	ADRB3	43	42
Cc1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)c(C)c1	ZINC000819482958	EG	On-Demand	Anodyne	ADRB2	23	45
Cc1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)c(C)c1	ZINC000819482958	EG	On-Demand	Anodyne	VDR	17	41
Cc1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)c(C)c1	ZINC000819482960	EG	On-Demand	Anodyne	ADRB2	23	45
Cc1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)c(C)c1	ZINC000819482960	EG	On-Demand	Anodyne	VDR	17	41
O[C@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COC1CCOCC1	ZINC000819482965	GG	On-Demand	Anodyne	ADRB2	15	45
O[C@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COC1CCOCC1	ZINC000819482965	GG	On-Demand	Anodyne	ADRB3	22	44
O[C@@H](CCc1ccc(NC[C@@H](O)COC2CCOCC2)cc1)c1ccccc1	ZINC000819482967	GG	On-Demand	Anodyne	ADRB2	15	45
O[C@@H](CCc1ccc(NC[C@@H](O)COC2CCOCC2)cc1)c1ccccc1	ZINC000819482967	GG	On-Demand	Anodyne	ADRB3	22	44
O[C@@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)COC1CCOCC1	ZINC000819482969	GG	On-Demand	Anodyne	ADRB2	15	45
O[C@@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)COC1CCOCC1	ZINC000819482969	GG	On-Demand	Anodyne	ADRB3	22	44
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COC1CCOCC1	ZINC000819482972	GG	On-Demand	Anodyne	ADRB2	15	45
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)COC1CCOCC1	ZINC000819482972	GG	On-Demand	Anodyne	ADRB3	22	44
CC(C)(O)CNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819482974	CH	On-Demand	Anodyne	ADRB2	15	52
CC(C)(O)CNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819482974	CH	On-Demand	Anodyne	ADRB3	34	41
CC(C)(O)CNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819482976	CH	On-Demand	Anodyne	ADRB2	15	52
CC(C)(O)CNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819482976	CH	On-Demand	Anodyne	ADRB3	34	41
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)Cn1cccn1	ZINC000819482978	FG	On-Demand	Anodyne	ADRB3	23	41
O[C@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)Cn1cccn1	ZINC000819482980	FG	On-Demand	Anodyne	ADRB3	23	41
O[C@@H](CCc1ccc(NC[C@@H](O)Cn2cccn2)cc1)c1ccccc1	ZINC000819482982	FG	On-Demand	Anodyne	ADRB3	23	41
O[C@@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)Cn1cccn1	ZINC000819482984	FG	On-Demand	Anodyne	ADRB3	23	41
O[C@@H](CNc1ccc(F)cc1OC1CCOCC1)CN1CCOCC1	ZINC000819483001	FD	On-Demand	Anodyne	HRH1	15	40
O[C@@H](CNc1ccc(F)cc1OC1CCOCC1)CN1CCOCC1	ZINC000819483001	FD	On-Demand	Anodyne	CCR3	21	40
O[C@H](CNc1ccc(F)cc1OC1CCOCC1)CN1CCOCC1	ZINC000819483003	FD	On-Demand	Anodyne	HRH1	15	40
O[C@H](CNc1ccc(F)cc1OC1CCOCC1)CN1CCOCC1	ZINC000819483003	FD	On-Demand	Anodyne	CCR3	21	40
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819483004	FF	On-Demand	Anodyne	ADRB2	46	45
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819483004	FF	On-Demand	Anodyne	ADRB1	67	45
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819483004	FF	On-Demand	Anodyne	ADRB3	45	45
COC(=O)c1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819483004	FF	On-Demand	Anodyne	PDS	56	36
COC(=O)c1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819483006	FF	On-Demand	Anodyne	ADRB2	46	45
COC(=O)c1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819483006	FF	On-Demand	Anodyne	ADRB1	67	45
COC(=O)c1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819483006	FF	On-Demand	Anodyne	ADRB3	45	45
COC(=O)c1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819483006	FF	On-Demand	Anodyne	PDS	56	36
CO[C@H]1CCOc2c(NC[C@@H](O)COc3ccc(C)cc3)cccc21	ZINC000819483042	EG	On-Demand	Anodyne	ADRB2	19	42
CO[C@@H]1CCOc2c(NC[C@@H](O)COc3ccc(C)cc3)cccc21	ZINC000819483043	EG	On-Demand	Anodyne	ADRB2	19	42
CO[C@@H]1CCOc2c(NC[C@H](O)COc3ccc(C)cc3)cccc21	ZINC000819483044	EG	On-Demand	Anodyne	ADRB2	19	42
CO[C@H]1CCOc2c(NC[C@H](O)COc3ccc(C)cc3)cccc21	ZINC000819483045	EG	On-Demand	Anodyne	ADRB2	19	42
C[C@@H]1CC[C@@H](C(F)(F)F)CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819483066	GH	On-Demand	Mild	PAPA1_CARPA	31	40
C[C@@H]1CC[C@@H](C(F)(F)F)CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819483067	GH	On-Demand	Mild	PAPA1_CARPA	31	40
CO[C@@H]1CCOc2c(NC[C@H](O)COc3ccccc3)cccc21	ZINC000819483083	EG	On-Demand	Anodyne	ADRB2	32	42
CO[C@@H]1CCOc2c(NC[C@H](O)COc3ccccc3)cccc21	ZINC000819483083	EG	On-Demand	Anodyne	ADRB1	48	36
CO[C@H]1CCOc2c(NC[C@@H](O)COc3ccccc3)cccc21	ZINC000819483084	EG	On-Demand	Anodyne	ADRB2	32	42
CO[C@H]1CCOc2c(NC[C@@H](O)COc3ccccc3)cccc21	ZINC000819483084	EG	On-Demand	Anodyne	ADRB1	48	36
CO[C@H]1CCOc2c(NC[C@H](O)COc3ccccc3)cccc21	ZINC000819483085	EG	On-Demand	Anodyne	ADRB2	32	42
CO[C@H]1CCOc2c(NC[C@H](O)COc3ccccc3)cccc21	ZINC000819483085	EG	On-Demand	Anodyne	ADRB1	48	36
CO[C@@H]1CCOc2c(NC[C@@H](O)COc3ccccc3)cccc21	ZINC000819483086	EG	On-Demand	Anodyne	ADRB2	32	42
CO[C@@H]1CCOc2c(NC[C@@H](O)COc3ccccc3)cccc21	ZINC000819483086	EG	On-Demand	Anodyne	ADRB1	48	36
COCCNC(=O)c1ccccc1NC(=O)C[C@H](NC(C)=O)c1ccc(Cl)cc1	ZINC000819483093	HF	On-Demand	Anodyne	UTS2	43	33
O=C(NCC1OCCCO1)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	ZINC000819483094	GD	On-Demand	Anodyne	FKBP1A	15	43
O=C(NCC1OCCCO1)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	ZINC000819483094	GD	On-Demand	Anodyne	PDE8B	19	41
O=C(NCC1OCCCO1)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	ZINC000819483094	GD	On-Demand	Anodyne	TMPRSS11D	58	35
COCCNC(=O)c1ccccc1NC(=O)C[C@@H](NC(C)=O)c1ccc(Cl)cc1	ZINC000819483095	HF	On-Demand	Anodyne	UTS2	43	33
O=C(C(F)=C1CCC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000819483105	CG	On-Demand	Anodyne	GRIN2B	24	42
O=C(C(F)=C1CCC1)N1CC[C@@H](COc2ccccc2)C1	ZINC000819483105	CG	On-Demand	Anodyne	CHRNA10	47	38
O=C(C(F)=C1CCC1)N1CC[C@H](COc2ccccc2)C1	ZINC000819483106	CG	On-Demand	Anodyne	GRIN2B	24	42
O=C(C(F)=C1CCC1)N1CC[C@H](COc2ccccc2)C1	ZINC000819483106	CG	On-Demand	Anodyne	CHRNA10	47	38
CO[C@H]1CN(C(=O)c2cc(-c3ccccc3)nc3cc(C)c(C)cc23)CCO1	ZINC000819483129	GH	On-Demand	Anodyne	PRS	50	35
CO[C@@H]1CN(C(=O)c2cc(-c3ccccc3)nc3cc(C)c(C)cc23)CCO1	ZINC000819483134	GH	On-Demand	Anodyne	PRS	50	35
O=C(NCC1OCCCO1)c1cc(Cl)cc(F)c1Br	ZINC000819483136	FF	On-Demand	Anodyne	CACNA1I	49	32
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	F2	26	50
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	PLG	27	50
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	ACE	47	37
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	OPRM1	19	40
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	GHRHR	59	34
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	P2RY12	49	37
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	CELA1	20	50
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	MME	57	37
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	TACR1	18	47
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	CTSD	26	40
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	PGC	61	40
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	MC4R	57	41
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	CMA1	45	44
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	CTRA_BOVIN	45	35
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	PAPA1_CARPA	68	54
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	TRY1_BOVIN	39	50
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	CYSP_TRYCR	62	41
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	CCKAR	60	44
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	CTSK	39	48
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	CTSL	58	54
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	CACNA1B	44	36
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	PGA	29	40
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	TIMP3	54	36
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	TACR3	18	44
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	CAPNS1	57	32
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	HLA-DRB1	30	40
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	CELA2A	52	35
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	REN	98	44
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	REN1	24	40
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	CCKBR	26	42
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	CTSS	36	54
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	CAPN1	62	44
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	CAPN2	40	34
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	ACE2	65	34
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	KLK5	34	42
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	FPR1	77	46
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	CTRB_BOVIN	30	43
CO[C@@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483139	FD	On-Demand	Anodyne	BRCA1	44	31
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	F2	26	50
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	PLG	27	50
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	ACE	47	37
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	OPRM1	19	40
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	GHRHR	59	34
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	P2RY12	49	37
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	CELA1	20	50
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	MME	57	37
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	TACR1	18	47
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	CTSD	26	40
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	PGC	61	40
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	MC4R	57	41
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	CMA1	45	44
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	CTRA_BOVIN	45	35
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	PAPA1_CARPA	68	54
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	TRY1_BOVIN	39	50
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	CYSP_TRYCR	62	41
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	CCKAR	60	44
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	CTSK	39	48
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	CTSL	58	54
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	CACNA1B	44	36
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	PGA	29	40
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	TIMP3	54	36
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	TACR3	18	44
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	CAPNS1	57	32
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	HLA-DRB1	30	40
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	CELA2A	52	35
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	REN	98	44
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	REN1	24	40
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	CCKBR	26	42
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	CTSS	36	54
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	CAPN1	62	44
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	CAPN2	40	34
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	ACE2	65	34
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	KLK5	34	42
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	FPR1	77	46
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	CTRB_BOVIN	30	43
CO[C@H]1CN(C(=O)[C@@H](Cc2ccccc2)NC(=O)OC(C)(C)C)CCO1	ZINC000819483140	FD	On-Demand	Anodyne	BRCA1	44	31
Cn1c(C(=O)NCC2OCCCO2)c(Cl)c2ccccc21	ZINC000819483152	DE	On-Demand	Anodyne	HTR4	40	37
Nc1c(F)cc(Cl)cc1C(=O)NCC1OCCCO1	ZINC000819483179	CD	On-Demand	Anodyne	CACNA1I	49	32
COc1ccccc1/C=C(/C(=O)NCC1OCCCO1)c1ccccc1	ZINC000819483181	FG	On-Demand	Anodyne	TLR4	15	44
O=C(NCC1OCCCO1)c1cn(-c2cccc(Cl)c2)nn1	ZINC000819483186	DD	On-Demand	Anodyne	CACNA1I	45	37
COc1ccccc1/C=C(/C(=O)N[C@@H]1CCC[C@H]1N(C)C)c1ccccc1	ZINC000819483197	FH	On-Demand	Anodyne	ACKR3	51	32
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)cc1	ZINC000819483237	FH	On-Demand	Anodyne	ADRB2	42	52
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)cc1	ZINC000819483237	FH	On-Demand	Anodyne	ADRB1	55	50
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)cc1	ZINC000819483237	FH	On-Demand	Anodyne	ADRB3	32	40
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)cc1	ZINC000819483239	FH	On-Demand	Anodyne	ADRB2	42	52
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)cc1	ZINC000819483239	FH	On-Demand	Anodyne	ADRB1	55	50
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)cc1	ZINC000819483239	FH	On-Demand	Anodyne	ADRB3	32	40
CCOC[C@H](O)CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1	ZINC000819483254	DE	On-Demand	Anodyne	ADRB1	25	40
O=C1NCCN(C(=O)C(F)=C2CCC2)[C@H]1c1ccccc1C(F)(F)F	ZINC000819483264	FG	On-Demand	Anodyne	RBP4	79	40
O=C1NCCN(C(=O)C(F)=C2CCC2)[C@@H]1c1ccccc1C(F)(F)F	ZINC000819483266	FG	On-Demand	Anodyne	RBP4	79	40
CC(C)(C)OC(=O)CCc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819483269	EI	On-Demand	Anodyne	ADRB2	31	43
CC(C)(C)OC(=O)CCc1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819483269	EI	On-Demand	Anodyne	ADRB3	58	42
CC(C)(C)OC(=O)CCc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819483270	EI	On-Demand	Anodyne	ADRB2	31	43
CC(C)(C)OC(=O)CCc1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819483270	EI	On-Demand	Anodyne	ADRB3	58	42
CNC(=O)COc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)c(C)c1	ZINC000819483279	FF	On-Demand	Anodyne	ADRB1	19	47
CNC(=O)COc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)c(C)c1	ZINC000819483279	FF	On-Demand	Anodyne	MAOB	29	46
CNC(=O)COc1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)c(C)c1	ZINC000819483279	FF	On-Demand	Anodyne	ADRB3	23	42
CNC(=O)COc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)c(C)c1	ZINC000819483283	FF	On-Demand	Anodyne	ADRB1	19	47
CNC(=O)COc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)c(C)c1	ZINC000819483283	FF	On-Demand	Anodyne	MAOB	29	46
CNC(=O)COc1ccc(NC[C@H](O)Cc2cccc(Cl)c2)c(C)c1	ZINC000819483283	FF	On-Demand	Anodyne	ADRB3	23	42
CC(=O)c1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819483327	EF	On-Demand	Anodyne	ADRB2	39	43
CC(=O)c1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819483327	EF	On-Demand	Anodyne	ADRB1	57	43
CC(=O)c1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819483327	EF	On-Demand	Anodyne	PDS	48	36
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819483328	EF	On-Demand	Anodyne	ADRB2	39	43
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819483328	EF	On-Demand	Anodyne	ADRB1	57	43
CC(=O)c1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819483328	EF	On-Demand	Anodyne	PDS	48	36
C[C@@H](OC[C@H](O)CNc1cccc(C(C)(C)O)c1)c1ccc(Cl)cc1	ZINC000819483330	FI	On-Demand	Anodyne	CASR	20	43
C[C@@H](OC[C@@H](O)CNc1cccc(C(C)(C)O)c1)c1ccc(Cl)cc1	ZINC000819483335	FI	On-Demand	Anodyne	CASR	20	43
CC(C)(C)[C@@H](O)CNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819483338	EI	On-Demand	Anodyne	ADRB2	21	57
CC(C)(C)[C@@H](O)CNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819483338	EI	On-Demand	Anodyne	ADRB1	20	44
CC(C)(C)[C@@H](O)CNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819483338	EI	On-Demand	Anodyne	ADRB3	38	42
CC(C)(C)[C@@H](O)CNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819483348	EI	On-Demand	Anodyne	ADRB2	21	57
CC(C)(C)[C@@H](O)CNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819483348	EI	On-Demand	Anodyne	ADRB1	20	44
CC(C)(C)[C@@H](O)CNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819483348	EI	On-Demand	Anodyne	ADRB3	38	42
O[C@@H](CCc1ccc(NC[C@H](O)CC(F)(F)F)cc1)c1ccccc1	ZINC000819483359	FI	On-Demand	Anodyne	ADRB3	18	40
O[C@@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)CC(F)(F)F	ZINC000819483361	FI	On-Demand	Anodyne	ADRB3	18	40
O[C@H](CNc1ccc(CC[C@H](O)c2ccccc2)cc1)CC(F)(F)F	ZINC000819483362	FI	On-Demand	Anodyne	ADRB3	18	40
O[C@H](CNc1ccc(CC[C@@H](O)c2ccccc2)cc1)CC(F)(F)F	ZINC000819483364	FI	On-Demand	Anodyne	ADRB3	18	40
O[C@@H](CNc1ccc(F)cc1OC1CCOCC1)COc1ccccc1Cl	ZINC000819483366	GH	On-Demand	Anodyne	ADRB2	18	42
O[C@H](CNc1ccc(F)cc1OC1CCOCC1)COc1ccccc1Cl	ZINC000819483370	GH	On-Demand	Anodyne	ADRB2	18	42
C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819483374	GF	On-Demand	Mild	PAPA1_CARPA	55	50
C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819483374	GF	On-Demand	Mild	CCKAR	40	37
C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819483374	GF	On-Demand	Mild	CTSL	21	50
C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819483374	GF	On-Demand	Mild	FPR1	52	43
C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819483388	GF	On-Demand	Mild	PAPA1_CARPA	55	50
C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819483388	GF	On-Demand	Mild	CCKAR	40	37
C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819483388	GF	On-Demand	Mild	CTSL	21	50
C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819483388	GF	On-Demand	Mild	FPR1	52	43
N#CCCNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819483398	CH	On-Demand	Mild	ADRB2	15	52
N#CCCNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819483398	CH	On-Demand	Mild	ADRB3	23	41
CNC(=O)COc1ccc(NC[C@H](O)CO[C@H]2CCCc3ccccc32)c(C)c1	ZINC000819483401	GF	On-Demand	Anodyne	ACOX1	29	40
CNC(=O)COc1ccc(NC[C@@H](O)CO[C@H]2CCCc3ccccc32)c(C)c1	ZINC000819483404	GF	On-Demand	Anodyne	ACOX1	29	40
N#CCCNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819483406	CH	On-Demand	Mild	ADRB2	15	52
N#CCCNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819483406	CH	On-Demand	Mild	ADRB3	23	41
CNC(=O)COc1ccc(NC[C@H](O)CO[C@@H]2CCCc3ccccc32)c(C)c1	ZINC000819483409	GF	On-Demand	Anodyne	ACOX1	29	40
O[C@@H](CNc1ccc(F)cc1OC1CCOCC1)COc1ccccc1	ZINC000819483415	FG	On-Demand	Anodyne	ADRB2	38	41
O[C@@H](CNc1ccc(F)cc1OC1CCOCC1)COc1ccccc1	ZINC000819483415	FG	On-Demand	Anodyne	ADRB1	55	38
CNC(=O)COc1ccc(NC[C@@H](O)CO[C@@H]2CCCc3ccccc32)c(C)c1	ZINC000819483416	GF	On-Demand	Anodyne	ACOX1	29	40
O[C@H](CNc1ccc(F)cc1OC1CCOCC1)COc1ccccc1	ZINC000819483418	FG	On-Demand	Anodyne	ADRB2	38	41
O[C@H](CNc1ccc(F)cc1OC1CCOCC1)COc1ccccc1	ZINC000819483418	FG	On-Demand	Anodyne	ADRB1	55	38
COc1cc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c(C)c(OC)c1	ZINC000819483430	GG	On-Demand	Anodyne	GPR119	46	44
COc1cc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)c(C)c(OC)c1	ZINC000819483433	GG	On-Demand	Anodyne	GPR119	46	44
O[C@@H](CNc1ccc(F)cc1OC1CCOCC1)COc1ccc(F)cc1	ZINC000819483453	GG	On-Demand	Anodyne	ADRB1	37	40
O[C@H](CNc1ccc(F)cc1OC1CCOCC1)COc1ccc(F)cc1	ZINC000819483454	GG	On-Demand	Anodyne	ADRB1	37	40
CNC(=O)COc1ccc(NC[C@H](O)COc2ccc(C)cc2C)c(C)c1	ZINC000819483489	FF	On-Demand	Anodyne	ADRB2	16	41
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccc(C)cc2C)c(C)c1	ZINC000819483507	FF	On-Demand	Anodyne	ADRB2	16	41
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCN(C)C3=O)cc2C)cc1	ZINC000819483519	GF	On-Demand	Anodyne	ADRB2	19	41
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCN(C)C3=O)cc2C)cc1	ZINC000819483520	GF	On-Demand	Anodyne	ADRB2	19	41
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CCN(C)C3=O)cc2C)cc1	ZINC000819483521	GF	On-Demand	Anodyne	ADRB2	19	41
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CCN(C)C3=O)cc2C)cc1	ZINC000819483522	GF	On-Demand	Anodyne	ADRB2	19	41
CNC(=O)COc1ccc(NC[C@H](O)CN2CCN(C)CC2)c(C)c1	ZINC000819483556	FC	On-Demand	Anodyne	ACOX1	72	37
CNC(=O)COc1ccc(NC[C@@H](O)CN2CCN(C)CC2)c(C)c1	ZINC000819483557	FC	On-Demand	Anodyne	ACOX1	72	37
Cc1nc2cc(NC(=O)/C=C/[C@H]3CCCO3)ccc2s1	ZINC000819483571	CG	On-Demand	Anodyne	ACOX1	47	35
Cc1nc2cc(NC(=O)/C=C\[C@@H]3CCCO3)ccc2s1	ZINC000819483572	CG	On-Demand	Anodyne	ACOX1	47	35
Cc1nc2cc(NC(=O)/C=C/[C@@H]3CCCO3)ccc2s1	ZINC000819483573	CG	On-Demand	Anodyne	ACOX1	47	35
Cc1nc2cc(NC(=O)/C=C\[C@H]3CCCO3)ccc2s1	ZINC000819483574	CG	On-Demand	Anodyne	ACOX1	47	35
CON(C)C(=O)CCNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819483575	EG	On-Demand	Anodyne	ADRB3	39	41
CON(C)C(=O)CCNc1ccc(CC[C@H](O)c2ccccc2)cc1	ZINC000819483575	EG	On-Demand	Anodyne	FFAR1	15	40
CON(C)C(=O)CCNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819483576	EG	On-Demand	Anodyne	ADRB3	39	41
CON(C)C(=O)CCNc1ccc(CC[C@@H](O)c2ccccc2)cc1	ZINC000819483576	EG	On-Demand	Anodyne	FFAR1	15	40
O[C@@H](CNc1ccc(F)cc1OCCC(F)(F)F)COc1ccccc1	ZINC000819483586	FI	On-Demand	Anodyne	ADRB2	34	42
O[C@@H](CNc1ccc(F)cc1OCCC(F)(F)F)COc1ccccc1	ZINC000819483586	FI	On-Demand	Anodyne	ADRB1	45	42
O[C@@H](CNc1ccc(F)cc1OCCC(F)(F)F)COc1ccccc1	ZINC000819483586	FI	On-Demand	Anodyne	ADRB3	22	42
O[C@H](CNc1ccc(F)cc1OCCC(F)(F)F)COc1ccccc1	ZINC000819483587	FI	On-Demand	Anodyne	ADRB2	34	42
O[C@H](CNc1ccc(F)cc1OCCC(F)(F)F)COc1ccccc1	ZINC000819483587	FI	On-Demand	Anodyne	ADRB1	45	42
O[C@H](CNc1ccc(F)cc1OCCC(F)(F)F)COc1ccccc1	ZINC000819483587	FI	On-Demand	Anodyne	ADRB3	22	42
CC(C)(C#N)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819483614	DE	On-Demand	Mild	PAPA1_CARPA	49	60
CC(C)(C#N)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819483614	DE	On-Demand	Mild	CTSK	18	56
CC(C)(C#N)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819483615	DE	On-Demand	Mild	PAPA1_CARPA	49	60
CC(C)(C#N)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819483615	DE	On-Demand	Mild	CTSK	18	56
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1cccc2[nH]ccc12	ZINC000819483639	GH	On-Demand	Anodyne	ADRB2	22	63
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1cccc2[nH]ccc12	ZINC000819483639	GH	On-Demand	Anodyne	ADRB1	40	63
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1cccc2[nH]ccc12	ZINC000819483639	GH	On-Demand	Anodyne	ADRB3	15	55
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1cccc2[nH]ccc12	ZINC000819483641	GH	On-Demand	Anodyne	ADRB2	22	63
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1cccc2[nH]ccc12	ZINC000819483641	GH	On-Demand	Anodyne	ADRB1	40	63
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1cccc2[nH]ccc12	ZINC000819483641	GH	On-Demand	Anodyne	ADRB3	15	55
CN(C)[C@@H]1CCC[C@H]1NC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819483645	GD	On-Demand	Anodyne	CNR2	15	51
CN(C)[C@@H]1CCC[C@H]1NC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819483645	GD	On-Demand	Anodyne	EPHX2	25	40
N#Cc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)cc1	ZINC000819483651	GG	On-Demand	Mild	ADRB1	46	41
N#Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)cc1	ZINC000819483655	GG	On-Demand	Mild	ADRB1	46	41
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COC1CCOCC1	ZINC000819483702	FE	On-Demand	Anodyne	ADRB1	22	40
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COC1CCOCC1	ZINC000819483703	FE	On-Demand	Anodyne	ADRB1	22	40
N#CCc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)cc1	ZINC000819483711	GG	On-Demand	Mild	ADRB1	56	43
N#CCc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CCCC[C@H]3O)cc2)cc1	ZINC000819483716	GG	On-Demand	Mild	ADRB1	56	43
CC(C)(C)CC(=O)Nc1ccc(Cl)c(C(=O)NCC2OCCCO2)c1	ZINC000819483741	FG	On-Demand	Anodyne	CACNA1I	46	38
CC(=O)c1cccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)c1	ZINC000819483744	EF	On-Demand	Anodyne	ADRB2	25	45
CC(=O)c1cccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)c1	ZINC000819483744	EF	On-Demand	Anodyne	ADRB1	33	41
CC(=O)c1cccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)c1	ZINC000819483744	EF	On-Demand	Anodyne	ADRB3	18	41
CC(=O)c1cccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)c1	ZINC000819483744	EF	On-Demand	Anodyne	PDS	79	39
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)c1	ZINC000819483746	EF	On-Demand	Anodyne	ADRB2	25	45
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)c1	ZINC000819483746	EF	On-Demand	Anodyne	ADRB1	33	41
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)c1	ZINC000819483746	EF	On-Demand	Anodyne	ADRB3	18	41
CC(=O)c1cccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)c1	ZINC000819483746	EF	On-Demand	Anodyne	PDS	79	39
O=C(CCCCCNC(=O)NC1CCCCC1)NCC1OCCCO1	ZINC000819483764	FE	On-Demand	Anodyne	EPHX2	23	57
CNC(=O)COc1ccc(NC[C@H](O)COc2cc(C)ccc2C)c(C)c1	ZINC000819483892	FF	On-Demand	Anodyne	ADRB2	19	41
CNC(=O)COc1ccc(NC[C@@H](O)COc2cc(C)ccc2C)c(C)c1	ZINC000819483893	FF	On-Demand	Anodyne	ADRB2	19	41
O=C(NCC1OCCCO1)c1ccc(OCC2CCCCC2)cc1	ZINC000819483902	EG	On-Demand	Anodyne	GRIN2B	18	56
O=C(NCC1OCCCO1)c1ccccc1Nc1cccc(C(F)(F)F)c1	ZINC000819483924	GH	On-Demand	Anodyne	CCR2	45	36
O=C(NCC1OCCCO1)c1ccccc1Nc1cccc(C(F)(F)F)c1	ZINC000819483924	GH	On-Demand	Anodyne	AKR1C3	24	58
O=C(NCC1OCCCO1)c1ccccc1Nc1cccc(C(F)(F)F)c1	ZINC000819483924	GH	On-Demand	Anodyne	AKR1C2	27	58
O=C(NCC1OCCCO1)c1ccccc1Nc1cccc(C(F)(F)F)c1	ZINC000819483924	GH	On-Demand	Anodyne	KCNK3	18	40
CSc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819483953	FG	On-Demand	Anodyne	ADRB2	27	41
CSc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819483953	FG	On-Demand	Anodyne	ADRB1	38	41
CSc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819483953	FG	On-Demand	Anodyne	GRIN1	15	41
CSc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819483954	FG	On-Demand	Anodyne	ADRB2	27	41
CSc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819483954	FG	On-Demand	Anodyne	ADRB1	38	41
CSc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819483954	FG	On-Demand	Anodyne	GRIN1	15	41
CSc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819483955	FG	On-Demand	Anodyne	ADRB2	27	41
CSc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819483955	FG	On-Demand	Anodyne	ADRB1	38	41
CSc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819483955	FG	On-Demand	Anodyne	GRIN1	15	41
CSc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819483956	FG	On-Demand	Anodyne	ADRB2	27	41
CSc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819483956	FG	On-Demand	Anodyne	ADRB1	38	41
CSc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819483956	FG	On-Demand	Anodyne	GRIN1	15	41
C[C@@H]1CCCC[C@@H]1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000819483979	EH	On-Demand	Anodyne	FKBP1A	27	41
C[C@@H]1CCCC[C@@H]1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000819483979	EH	On-Demand	Anodyne	CTSK	25	40
C[C@@H]1CCCC[C@@H]1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000819483979	EH	On-Demand	Anodyne	PREP	21	41
C[C@@H]1CCCC[C@@H]1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000819483979	EH	On-Demand	Anodyne	CAPN2	59	36
C[C@@H]1CCCC[C@@H]1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000819483979	EH	On-Demand	Anodyne	EPHX2	18	53
C[C@@H]1CCCC[C@@H]1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000819483979	EH	On-Demand	Anodyne	NPR	42	36
C[C@@H]1CCCC[C@H]1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000819483981	EH	On-Demand	Anodyne	FKBP1A	27	41
C[C@@H]1CCCC[C@H]1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000819483981	EH	On-Demand	Anodyne	CTSK	25	40
C[C@@H]1CCCC[C@H]1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000819483981	EH	On-Demand	Anodyne	PREP	21	41
C[C@@H]1CCCC[C@H]1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000819483981	EH	On-Demand	Anodyne	CAPN2	59	36
C[C@@H]1CCCC[C@H]1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000819483981	EH	On-Demand	Anodyne	EPHX2	18	53
C[C@@H]1CCCC[C@H]1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000819483981	EH	On-Demand	Anodyne	NPR	42	36
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccccc1F	ZINC000819483990	GG	On-Demand	Anodyne	ADRB1	59	39
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)COc1ccccc1F	ZINC000819483991	GG	On-Demand	Anodyne	ADRB1	59	39
O=C(CCNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)Nc1cccnc1	ZINC000819484000	FG	On-Demand	Anodyne	NAMPT	26	41
Cn1cnc(-c2ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc2)n1	ZINC000819484007	GG	On-Demand	Mild	PAPA1_CARPA	37	42
Cn1cnc(-c2ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc2)n1	ZINC000819484008	GG	On-Demand	Mild	PAPA1_CARPA	37	42
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)ccc1F	ZINC000819484033	FF	On-Demand	Anodyne	ADRB1	17	41
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc3c(c2)CCC(=O)N3)ccc1F	ZINC000819484033	FF	On-Demand	Anodyne	PKM	37	41
C[C@H](O)c1cc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)ccc1F	ZINC000819484034	FF	On-Demand	Anodyne	ADRB1	17	41
C[C@H](O)c1cc(NC[C@H](O)COc2ccc3c(c2)CCC(=O)N3)ccc1F	ZINC000819484034	FF	On-Demand	Anodyne	PKM	37	41
CNC(=O)COc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)c(C)c1	ZINC000819484040	GD	On-Demand	Anodyne	ACOX1	53	36
CNC(=O)COc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)c(C)c1	ZINC000819484040	GD	On-Demand	Anodyne	NOD2	40	36
CNC(=O)COc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)c(C)c1	ZINC000819484041	GD	On-Demand	Anodyne	ACOX1	53	36
CNC(=O)COc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)c(C)c1	ZINC000819484041	GD	On-Demand	Anodyne	NOD2	40	36
CNC(=O)COc1ccc(NC[C@H](O)COc2ccc(C(C)=O)cc2)c(C)c1	ZINC000819484058	GE	On-Demand	Anodyne	ADRB2	18	42
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccc(C(C)=O)cc2)c(C)c1	ZINC000819484059	GE	On-Demand	Anodyne	ADRB2	18	42
CNC(=O)COc1ccc(NCCC(N)=O)c(C)c1	ZINC000819484072	CC	On-Demand	Anodyne	MAOA	21	40
CNC(=O)COc1ccc(NC[C@@H](O)COc2cccc3ccccc23)c(C)c1	ZINC000819484073	GG	On-Demand	Anodyne	ADRB2	30	49
CNC(=O)COc1ccc(NC[C@@H](O)COc2cccc3ccccc23)c(C)c1	ZINC000819484073	GG	On-Demand	Anodyne	ADRB1	40	34
CNC(=O)COc1ccc(NC[C@@H](O)COc2cccc3ccccc23)c(C)c1	ZINC000819484073	GG	On-Demand	Anodyne	CYP2D6	20	41
CNC(=O)COc1ccc(NC[C@H](O)COc2cccc3ccccc23)c(C)c1	ZINC000819484074	GG	On-Demand	Anodyne	ADRB2	30	49
CNC(=O)COc1ccc(NC[C@H](O)COc2cccc3ccccc23)c(C)c1	ZINC000819484074	GG	On-Demand	Anodyne	ADRB1	40	34
CNC(=O)COc1ccc(NC[C@H](O)COc2cccc3ccccc23)c(C)c1	ZINC000819484074	GG	On-Demand	Anodyne	CYP2D6	20	41
COc1cc(NC[C@H](O)c2ccc(C)cc2)ccc1O	ZINC000819484075	CF	On-Demand	Anodyne	ADRB2	30	50
COc1cc(NC[C@H](O)c2ccc(C)cc2)ccc1O	ZINC000819484075	CF	On-Demand	Anodyne	ADRB3	20	41
COc1cc(NC[C@@H](O)c2ccc(C)cc2)ccc1O	ZINC000819484076	CF	On-Demand	Anodyne	ADRB2	30	50
COc1cc(NC[C@@H](O)c2ccc(C)cc2)ccc1O	ZINC000819484076	CF	On-Demand	Anodyne	ADRB3	20	41
COc1cc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1O	ZINC000819484083	ED	On-Demand	Anodyne	ADRB2	35	41
COc1cc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1O	ZINC000819484083	ED	On-Demand	Anodyne	ADRB3	48	43
COc1cc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1O	ZINC000819484083	ED	On-Demand	Anodyne	LOX1.1	25	45
COc1cc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1O	ZINC000819484084	ED	On-Demand	Anodyne	ADRB2	35	41
COc1cc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1O	ZINC000819484084	ED	On-Demand	Anodyne	ADRB3	48	43
COc1cc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)ccc1O	ZINC000819484084	ED	On-Demand	Anodyne	LOX1.1	25	45
CNC(=O)COc1ccc(NC[C@H](O)c2cccc(F)c2)c(C)c1	ZINC000819484107	EE	On-Demand	Anodyne	ADRB1	15	43
CNC(=O)COc1ccc(NC[C@@H](O)c2cccc(F)c2)c(C)c1	ZINC000819484108	EE	On-Demand	Anodyne	ADRB1	15	43
COc1cc(NC[C@H](O)c2ccccc2C)ccc1O	ZINC000819484120	CF	On-Demand	Anodyne	ADRB2	23	43
COc1cc(NC[C@@H](O)c2ccccc2C)ccc1O	ZINC000819484121	CF	On-Demand	Anodyne	ADRB2	23	43
COCCc1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819484162	FF	On-Demand	Anodyne	ADRB2	45	57
COCCc1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819484162	FF	On-Demand	Anodyne	ADRB1	65	57
COCCc1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819484162	FF	On-Demand	Anodyne	ADRB3	45	42
COCCc1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819484163	FF	On-Demand	Anodyne	ADRB2	45	57
COCCc1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819484163	FF	On-Demand	Anodyne	ADRB1	65	57
COCCc1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819484163	FF	On-Demand	Anodyne	ADRB3	45	42
COC[C@@H](O)CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1	ZINC000819484176	CD	On-Demand	Anodyne	ADRB1	31	42
O=C(CCCCNC(=O)C(F)=C1CCC1)OCc1ccccc1	ZINC000819484184	DG	On-Demand	Anodyne	CAPN2	52	37
COc1ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1[N+](=O)[O-]	ZINC000819484195	GG	On-Demand	Mild	PAPA1_CARPA	42	42
Cc1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819484198	DG	On-Demand	Anodyne	ADRB2	41	51
Cc1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819484198	DG	On-Demand	Anodyne	ADRB1	48	44
Cc1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819484198	DG	On-Demand	Anodyne	ADRB3	25	40
Cc1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819484199	DG	On-Demand	Anodyne	ADRB2	41	51
Cc1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819484199	DG	On-Demand	Anodyne	ADRB1	48	44
Cc1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819484199	DG	On-Demand	Anodyne	ADRB3	25	40
C[C@@H](CC(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)CC2)n1cccn1	ZINC000819484225	FF	On-Demand	Anodyne	GPR119	35	40
C[C@H](CC(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)CC2)n1cccn1	ZINC000819484226	FF	On-Demand	Anodyne	GPR119	35	40
O=C(O)CCNC(=O)N[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC000819484237	CC	On-Demand	Anodyne	EPHX2	19	40
O=C(O)CCNC(=O)N[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC000819484238	CC	On-Demand	Anodyne	EPHX2	19	40
O=C(O)CCNC(=O)NC1CCN(C(=O)CC(F)(F)F)CC1	ZINC000819484242	EC	On-Demand	Anodyne	EPHX2	34	55
O=C(O)CCNC(=O)NCC(=O)Nc1cccnc1	ZINC000819484244	CB	On-Demand	Anodyne	TBXAS1	67	40
O=C(O)CCNC(=O)NCC(=O)Nc1cccnc1	ZINC000819484244	CB	On-Demand	Anodyne	NAMPT	40	44
O=C(O)CCNC(=O)NC1CCN(C2CC2)CC1	ZINC000819484245	CC	On-Demand	Anodyne	EPHX2	18	42
O=C(O)CCNC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000819484246	DD	On-Demand	Anodyne	DRD4	16	48
O=C(O)CCNC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000819484246	DD	On-Demand	Anodyne	CCR3	21	40
O=C(O)CCNC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000819484246	DD	On-Demand	Anodyne	EPHX2	62	57
O=C(O)CCNC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000819484246	DD	On-Demand	Anodyne	CCR8	46	39
O=C(O)CCNC(=O)NC1CCN(C(=O)c2ccccc2)CC1	ZINC000819484246	DD	On-Demand	Anodyne	L3MBTL3	77	38
O=C(O)CCNC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1	ZINC000819484247	DB	On-Demand	Anodyne	EPHX2	20	47
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484248	FE	On-Demand	Anodyne	DRD4	28	63
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484248	FE	On-Demand	Anodyne	ACHE	18	45
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484248	FE	On-Demand	Anodyne	GCGR	46	41
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484248	FE	On-Demand	Anodyne	SIGMAR1	27	57
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484248	FE	On-Demand	Anodyne	SSTR5	41	41
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484248	FE	On-Demand	Anodyne	CCR3	36	49
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484248	FE	On-Demand	Anodyne	UTS2R	21	40
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484248	FE	On-Demand	Anodyne	MLNR	28	44
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484248	FE	On-Demand	Anodyne	CCR2	47	52
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484248	FE	On-Demand	Anodyne	SLC6A5	40	53
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484248	FE	On-Demand	Anodyne	EPHX2	26	44
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484248	FE	On-Demand	Anodyne	CXCR3	23	41
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484248	FE	On-Demand	Anodyne	MCHR1	59	47
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484248	FE	On-Demand	Anodyne	BIRC2	18	40
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484249	FE	On-Demand	Anodyne	DRD4	28	63
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484249	FE	On-Demand	Anodyne	ACHE	18	45
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484249	FE	On-Demand	Anodyne	GCGR	46	41
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484249	FE	On-Demand	Anodyne	SIGMAR1	27	57
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484249	FE	On-Demand	Anodyne	SSTR5	41	41
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484249	FE	On-Demand	Anodyne	CCR3	36	49
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484249	FE	On-Demand	Anodyne	UTS2R	21	40
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484249	FE	On-Demand	Anodyne	MLNR	28	44
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484249	FE	On-Demand	Anodyne	CCR2	47	52
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484249	FE	On-Demand	Anodyne	SLC6A5	40	53
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484249	FE	On-Demand	Anodyne	EPHX2	26	44
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484249	FE	On-Demand	Anodyne	CXCR3	23	41
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484249	FE	On-Demand	Anodyne	MCHR1	59	47
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000819484249	FE	On-Demand	Anodyne	BIRC2	18	40
O=C(O)CCNC(=O)NC1CCN(CC2CC2)CC1	ZINC000819484259	CC	On-Demand	Anodyne	EPHX2	15	40
O=C(O)CCNC(=O)NCC(=O)NCc1ccccc1	ZINC000819484260	CC	On-Demand	Anodyne	MME	37	49
O=C(O)CCNC(=O)NCC(=O)NCc1ccccc1	ZINC000819484260	CC	On-Demand	Anodyne	ANPEP	18	45
O=C(O)CCNC(=O)NCC(=O)NCc1ccccc1	ZINC000819484260	CC	On-Demand	Anodyne	CA5B	16	42
O=C(O)CCNC(=O)NCC(=O)NCc1ccccc1	ZINC000819484260	CC	On-Demand	Anodyne	CA5A	19	42
O=C(O)CCNC(=O)NCC(=O)NCc1ccccc1	ZINC000819484260	CC	On-Demand	Anodyne	TPSAB1	15	40
O=C(O)CCNC(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000819484269	ED	On-Demand	Anodyne	HCN1	60	37
O=C(O)CCNC(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000819484269	ED	On-Demand	Anodyne	HCN4	57	37
O=C(O)CCNC(=O)NCC(=O)Nc1ccccc1	ZINC000819484270	CC	On-Demand	Anodyne	MME	23	40
O=C(O)CCNC(=O)NCC(=O)Nc1ccccc1	ZINC000819484270	CC	On-Demand	Anodyne	LTA4H	21	45
O=C(O)CCNC(=O)NCC(=O)Nc1ccccc1	ZINC000819484270	CC	On-Demand	Anodyne	HDAC10	15	45
O=C(O)CCNC(=O)NCC(=O)Nc1ccccc1	ZINC000819484270	CC	On-Demand	Anodyne	CA4	18	41
O=C(O)CCNC(=O)NCC(=O)Nc1ccccc1	ZINC000819484270	CC	On-Demand	Anodyne	HDAC3	15	45
O=C(O)CCNC(=O)NCC(=O)Nc1ccccc1	ZINC000819484270	CC	On-Demand	Anodyne	F7	15	40
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819484271	EC	On-Demand	Anodyne	DRD4	39	46
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819484271	EC	On-Demand	Anodyne	ACHE	32	44
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819484271	EC	On-Demand	Anodyne	SIGMAR1	41	44
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819484271	EC	On-Demand	Anodyne	CCR3	32	40
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819484272	EC	On-Demand	Anodyne	DRD4	39	46
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819484272	EC	On-Demand	Anodyne	ACHE	32	44
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819484272	EC	On-Demand	Anodyne	SIGMAR1	41	44
O=C(O)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819484272	EC	On-Demand	Anodyne	CCR3	32	40
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819484273	EC	On-Demand	Anodyne	DRD4	39	46
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819484273	EC	On-Demand	Anodyne	ACHE	32	44
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819484273	EC	On-Demand	Anodyne	SIGMAR1	41	44
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000819484273	EC	On-Demand	Anodyne	CCR3	32	40
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819484274	EC	On-Demand	Anodyne	DRD4	39	46
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819484274	EC	On-Demand	Anodyne	ACHE	32	44
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819484274	EC	On-Demand	Anodyne	SIGMAR1	41	44
O=C(O)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000819484274	EC	On-Demand	Anodyne	CCR3	32	40
O=C(O)CCNC(=O)NC[C@H](O)CN1CCc2ccccc2C1	ZINC000819484275	DC	On-Demand	Anodyne	NOD2	40	34
O=C(O)CCNC(=O)NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000819484276	DC	On-Demand	Anodyne	NOD2	40	34
O=C(O)CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819484280	ED	On-Demand	Anodyne	SLC6A3	23	43
O=C(O)CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819484280	ED	On-Demand	Anodyne	HTR4	58	37
O=C(O)CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819484280	ED	On-Demand	Anodyne	GRIN2B	25	48
O=C(O)CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819484280	ED	On-Demand	Anodyne	CCR3	29	44
O=C(O)CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000819484280	ED	On-Demand	Anodyne	CACNA1I	60	38
O=C(O)CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819484282	ED	On-Demand	Anodyne	SLC6A3	23	43
O=C(O)CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819484282	ED	On-Demand	Anodyne	HTR4	58	37
O=C(O)CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819484282	ED	On-Demand	Anodyne	GRIN2B	25	48
O=C(O)CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819484282	ED	On-Demand	Anodyne	CCR3	29	44
O=C(O)CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000819484282	ED	On-Demand	Anodyne	CACNA1I	60	38
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)c1cccc(Cl)c1	ZINC000819484283	FI	On-Demand	Anodyne	ADRB1	32	46
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)c1cccc(Cl)c1	ZINC000819484283	FI	On-Demand	Anodyne	ADRB3	45	45
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)c1cccc(Cl)c1	ZINC000819484283	FI	On-Demand	Anodyne	CYP3A4	40	34
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)c1cccc(Cl)c1	ZINC000819484286	FI	On-Demand	Anodyne	ADRB1	32	46
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)c1cccc(Cl)c1	ZINC000819484286	FI	On-Demand	Anodyne	ADRB3	45	45
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)c1cccc(Cl)c1	ZINC000819484286	FI	On-Demand	Anodyne	CYP3A4	40	34
C=C(C)C(C)(C)C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000819484292	DH	On-Demand	Mild	TACR3	16	40
C=C(C)C(C)(C)C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000819484292	DH	On-Demand	Mild	CAPN2	52	34
C=C(C)C(C)(C)C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000819484292	DH	On-Demand	Mild	NPR	60	37
C=C(C)C(C)(C)C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000819484292	DH	On-Demand	Mild	SLC12A5	45	32
C[C@H](O)c1cc(NCCC(=O)Nc2cccnc2)ccc1F	ZINC000819484307	DF	On-Demand	Anodyne	NAMPT	15	41
CCOc1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819484311	EG	On-Demand	Anodyne	ADRB2	45	41
CCOc1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819484311	EG	On-Demand	Anodyne	ADRB1	53	41
CCOc1ccc(OC[C@@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819484311	EG	On-Demand	Anodyne	PDS	72	39
O=C(O)CCNC(=O)NCC(=O)OCc1ccccc1	ZINC000819484312	CC	On-Demand	Anodyne	MME	28	48
O=C(O)CCNC(=O)NCC(=O)OCc1ccccc1	ZINC000819484312	CC	On-Demand	Anodyne	CAPNS1	42	32
O=C(O)CCNC(=O)NCC(=O)OCc1ccccc1	ZINC000819484312	CC	On-Demand	Anodyne	CAPN2	59	36
O=C(O)CCNC(=O)NCC(=O)OCc1ccccc1	ZINC000819484312	CC	On-Demand	Anodyne	NPR	59	35
O=C(O)CCNC(=O)NCC(=O)OCc1ccccc1	ZINC000819484312	CC	On-Demand	Anodyne	FFAR1	18	40
CCOc1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819484313	EG	On-Demand	Anodyne	ADRB2	45	41
CCOc1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819484313	EG	On-Demand	Anodyne	ADRB1	53	41
CCOc1ccc(OC[C@H](O)CNc2cccc(C(C)(C)O)c2)cc1	ZINC000819484313	EG	On-Demand	Anodyne	PDS	72	39
C[C@@H](CNc1cccc(C(C)(C)O)c1)S(C)(=O)=O	ZINC000819484314	CD	On-Demand	Anodyne	VIPR1	48	31
O=C(O)CCNC(=O)NCC(=O)Nc1ccc(F)c(F)c1	ZINC000819484316	DC	On-Demand	Anodyne	SLC1A2	44	38
O=C(O)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000819484322	EC	On-Demand	Anodyne	HTR1A	77	52
O=C(O)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000819484322	EC	On-Demand	Anodyne	DRD2	64	48
O=C(O)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000819484322	EC	On-Demand	Anodyne	DRD4	38	48
O=C(O)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000819484322	EC	On-Demand	Anodyne	ADRA1D	27	45
O=C(O)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000819484322	EC	On-Demand	Anodyne	HTR2A	60	52
O=C(O)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000819484322	EC	On-Demand	Anodyne	HTR2C	36	46
O=C(O)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000819484322	EC	On-Demand	Anodyne	SLC6A4	17	41
O=C(O)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000819484322	EC	On-Demand	Anodyne	ADRA1A	34	47
O=C(O)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000819484322	EC	On-Demand	Anodyne	ADRA1B	15	47
O=C(O)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000819484322	EC	On-Demand	Anodyne	DRD3	85	52
O=C(O)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000819484322	EC	On-Demand	Anodyne	HTR7	88	42
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)c1cccnc1	ZINC000819484324	EF	On-Demand	Anodyne	ADRB2	22	40
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)c1cccnc1	ZINC000819484324	EF	On-Demand	Anodyne	ADRB1	24	45
O[C@@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)c1cccnc1	ZINC000819484324	EF	On-Demand	Anodyne	ADRB3	87	45
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)c1cccnc1	ZINC000819484325	EF	On-Demand	Anodyne	ADRB2	22	40
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)c1cccnc1	ZINC000819484325	EF	On-Demand	Anodyne	ADRB1	24	45
O[C@H](CNc1ccc(O[C@@H]2CCCC[C@H]2O)cc1)c1cccnc1	ZINC000819484325	EF	On-Demand	Anodyne	ADRB3	87	45
O=C(O)CCNC(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000819484330	ED	On-Demand	Anodyne	ACHE	21	40
O=C(O)CCNC(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000819484330	ED	On-Demand	Anodyne	SIGMAR1	18	46
O=C(O)CCNC(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000819484330	ED	On-Demand	Anodyne	CACNA1I	58	35
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819484331	GE	On-Demand	Anodyne	DRD4	31	56
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819484331	GE	On-Demand	Anodyne	ACHE	27	48
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819484331	GE	On-Demand	Anodyne	CHRM3	17	42
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819484331	GE	On-Demand	Anodyne	SIGMAR1	38	63
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819484331	GE	On-Demand	Anodyne	SSTR5	52	39
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819484331	GE	On-Demand	Anodyne	CCR3	34	45
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819484331	GE	On-Demand	Anodyne	NPFFR2	15	40
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819484331	GE	On-Demand	Anodyne	UTS2R	16	43
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819484331	GE	On-Demand	Anodyne	SLC6A5	29	43
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819484331	GE	On-Demand	Anodyne	EPHX2	23	47
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819484331	GE	On-Demand	Anodyne	CXCR3	35	42
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819484331	GE	On-Demand	Anodyne	MCHR1	46	50
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000819484331	GE	On-Demand	Anodyne	NPFFR1	26	40
O=C(O)CCNC(=O)NC1CCC(N2CCCCC2)CC1	ZINC000819484334	CD	On-Demand	Anodyne	L3MBTL3	42	34
O=C(O)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819484344	DD	On-Demand	Anodyne	DRD2	19	45
O=C(O)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819484344	DD	On-Demand	Anodyne	DRD4	25	46
O=C(O)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819484344	DD	On-Demand	Anodyne	ACHE	34	43
O=C(O)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819484344	DD	On-Demand	Anodyne	HTR2A	15	48
O=C(O)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819484344	DD	On-Demand	Anodyne	OPRM1	18	52
O=C(O)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819484344	DD	On-Demand	Anodyne	HTR4	41	48
O=C(O)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819484344	DD	On-Demand	Anodyne	SIGMAR1	49	47
O=C(O)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819484344	DD	On-Demand	Anodyne	CCR3	60	50
O=C(O)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819484344	DD	On-Demand	Anodyne	CACNA1I	44	37
O=C(O)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000819484344	DD	On-Demand	Anodyne	BIRC2	34	40
O=C(O)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819484345	DD	On-Demand	Anodyne	DRD2	19	45
O=C(O)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819484345	DD	On-Demand	Anodyne	DRD4	25	46
O=C(O)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819484345	DD	On-Demand	Anodyne	ACHE	34	43
O=C(O)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819484345	DD	On-Demand	Anodyne	HTR2A	15	48
O=C(O)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819484345	DD	On-Demand	Anodyne	OPRM1	18	52
O=C(O)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819484345	DD	On-Demand	Anodyne	HTR4	41	48
O=C(O)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819484345	DD	On-Demand	Anodyne	SIGMAR1	49	47
O=C(O)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819484345	DD	On-Demand	Anodyne	CCR3	60	50
O=C(O)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819484345	DD	On-Demand	Anodyne	CACNA1I	44	37
O=C(O)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000819484345	DD	On-Demand	Anodyne	BIRC2	34	40
O=C(O)CCNC(=O)NC[C@@H](O)c1c(F)cccc1F	ZINC000819484346	CC	On-Demand	Anodyne	MME	15	42
O=C(O)CCNC(=O)NC[C@H](O)c1c(F)cccc1F	ZINC000819484347	CC	On-Demand	Anodyne	MME	15	42
O=C(O)CCNC(=O)NCCC(=O)NCc1ccccc1	ZINC000819484349	CC	On-Demand	Anodyne	FOLH1	25	40
O=C(O)CCNC(=O)NCCC(=O)NCc1ccccc1	ZINC000819484349	CC	On-Demand	Anodyne	MME	42	48
O=C(O)CCNC(=O)NCCC(=O)NCc1ccccc1	ZINC000819484349	CC	On-Demand	Anodyne	ANPEP	25	48
O=C(O)CCNC(=O)NCCC(=O)NCc1ccccc1	ZINC000819484349	CC	On-Demand	Anodyne	CPA1	26	40
O=C(O)CCNC(=O)NCCC(=O)NCc1ccccc1	ZINC000819484349	CC	On-Demand	Anodyne	CA5B	17	45
O=C(O)CCNC(=O)NCCC(=O)NCc1ccccc1	ZINC000819484349	CC	On-Demand	Anodyne	CA5A	20	45
O=C(O)CCNC(=O)NCCC(=O)NCc1ccccc1	ZINC000819484349	CC	On-Demand	Anodyne	TPSAB1	17	47
O=C(O)CCNC(=O)NCCC(=O)NCc1ccccc1	ZINC000819484349	CC	On-Demand	Anodyne	AMP1_PLAFQ	42	40
O=C(O)CCNC(=O)NCCC(=O)NCc1ccccc1	ZINC000819484349	CC	On-Demand	Anodyne	FFAR1	17	45
O=C(O)CCNC(=O)NCCC(=O)NCc1ccccc1	ZINC000819484349	CC	On-Demand	Anodyne	PDS	51	35
O=C(O)CCNC(=O)NC[C@H](CO)Cc1ccc(F)cc1	ZINC000819484352	CC	On-Demand	Anodyne	MME	24	47
O=C(O)CCNC(=O)NC[C@@H](CO)Cc1ccc(F)cc1	ZINC000819484353	CC	On-Demand	Anodyne	MME	24	47
O=C(O)CCNC(=O)NC1CCN(CC(F)F)CC1	ZINC000819484357	CC	On-Demand	Anodyne	EPHX2	26	44
O=C(O)CCNC(=O)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819484362	FE	On-Demand	Anodyne	DRD4	30	48
O=C(O)CCNC(=O)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819484362	FE	On-Demand	Anodyne	ACHE	43	45
O=C(O)CCNC(=O)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819484362	FE	On-Demand	Anodyne	HTR4	49	40
O=C(O)CCNC(=O)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819484362	FE	On-Demand	Anodyne	SIGMAR1	40	48
O=C(O)CCNC(=O)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819484362	FE	On-Demand	Anodyne	CCR3	60	46
O=C(O)CCNC(=O)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819484362	FE	On-Demand	Anodyne	EPHX2	20	48
O=C(O)CCNC(=O)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000819484362	FE	On-Demand	Anodyne	CACNA1I	68	40
O=C(O)CCNC(=O)NC[C@H](O)COc1ccccc1	ZINC000819484364	CC	On-Demand	Anodyne	ADRB2	54	51
O=C(O)CCNC(=O)NC[C@H](O)COc1ccccc1	ZINC000819484364	CC	On-Demand	Anodyne	ADRB1	84	54
O=C(O)CCNC(=O)NC[C@H](O)COc1ccccc1	ZINC000819484364	CC	On-Demand	Anodyne	PTGFR	32	44
O=C(O)CCNC(=O)NC[C@H](O)COc1ccccc1	ZINC000819484364	CC	On-Demand	Anodyne	ADRB3	50	54
O=C(O)CCNC(=O)NC[C@H](O)COc1ccccc1	ZINC000819484364	CC	On-Demand	Anodyne	MME	18	41
O=C(O)CCNC(=O)NC[C@H](O)COc1ccccc1	ZINC000819484364	CC	On-Demand	Anodyne	ABCB1	29	44
O=C(O)CCNC(=O)NC[C@H](O)COc1ccccc1	ZINC000819484364	CC	On-Demand	Anodyne	PDS	59	38
O=C(O)CCNC(=O)NC[C@@H](O)COc1ccccc1	ZINC000819484365	CC	On-Demand	Anodyne	ADRB2	54	51
O=C(O)CCNC(=O)NC[C@@H](O)COc1ccccc1	ZINC000819484365	CC	On-Demand	Anodyne	ADRB1	84	54
O=C(O)CCNC(=O)NC[C@@H](O)COc1ccccc1	ZINC000819484365	CC	On-Demand	Anodyne	PTGFR	32	44
O=C(O)CCNC(=O)NC[C@@H](O)COc1ccccc1	ZINC000819484365	CC	On-Demand	Anodyne	ADRB3	50	54
O=C(O)CCNC(=O)NC[C@@H](O)COc1ccccc1	ZINC000819484365	CC	On-Demand	Anodyne	MME	18	41
O=C(O)CCNC(=O)NC[C@@H](O)COc1ccccc1	ZINC000819484365	CC	On-Demand	Anodyne	ABCB1	29	44
O=C(O)CCNC(=O)NC[C@@H](O)COc1ccccc1	ZINC000819484365	CC	On-Demand	Anodyne	PDS	59	38
CC[C@@H](C)C(=O)Nc1ccccc1C(=O)NCCOC	ZINC000819484402	CE	On-Demand	Anodyne	CAPN2	57	32
CC[C@@H](C)C(=O)Nc1ccccc1C(=O)NCCOC	ZINC000819484402	CE	On-Demand	Anodyne	NPR	41	33
Cc1nn(-c2ccccc2)cc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819484422	GH	On-Demand	Mild	PAPA1_CARPA	46	45
Cc1nn(-c2ccccc2)cc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819484422	GH	On-Demand	Mild	FPR1	44	38
Cc1nn(-c2ccccc2)cc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819484423	GH	On-Demand	Mild	PAPA1_CARPA	46	45
Cc1nn(-c2ccccc2)cc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819484423	GH	On-Demand	Mild	FPR1	44	38
COc1cc(NCCC(=O)N(C)OC)ccc1O	ZINC000819484468	CD	On-Demand	Anodyne	DRTS_TRYCR	45	32
COc1cc(NCCS(C)(=O)=O)ccc1O	ZINC000819484476	BC	On-Demand	Anodyne	DRTS_TRYCR	47	33
O=C(O)CCNC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1	ZINC000819484488	EB	On-Demand	Anodyne	DRD4	27	42
O=C(O)CCNC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1	ZINC000819484488	EB	On-Demand	Anodyne	Q59401_ENTCL	46	33
O=C(O)CCNC(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000819484491	DC	On-Demand	Anodyne	SLC18A3	42	44
O=C(O)CCNC(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000819484491	DC	On-Demand	Anodyne	EPHX2	26	45
O=C(O)CCNC(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000819484492	DC	On-Demand	Anodyne	SLC18A3	42	44
O=C(O)CCNC(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000819484492	DC	On-Demand	Anodyne	EPHX2	26	45
O=C(O)CCNC(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000819484493	DC	On-Demand	Anodyne	SLC18A3	42	44
O=C(O)CCNC(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000819484493	DC	On-Demand	Anodyne	EPHX2	26	45
O=C(O)CCNC(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000819484494	DC	On-Demand	Anodyne	SLC18A3	42	44
O=C(O)CCNC(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000819484494	DC	On-Demand	Anodyne	EPHX2	26	45
O=C(O)CCNC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000819484495	ED	On-Demand	Anodyne	DRD4	17	45
O=C(O)CCNC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000819484495	ED	On-Demand	Anodyne	GRIN2B	29	50
O=C(O)CCNC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000819484495	ED	On-Demand	Anodyne	MME	15	41
O=C(O)CCNC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000819484495	ED	On-Demand	Anodyne	SIGMAR1	23	46
O=C(O)CCNC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000819484495	ED	On-Demand	Anodyne	C3AR1	51	50
O=C(O)CCNC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000819484495	ED	On-Demand	Anodyne	PREP	40	37
O=C(O)CCNC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000819484495	ED	On-Demand	Anodyne	EPHX2	50	56
O=C(O)CCNC(=O)NC1CCN(C(=O)CCc2ccccc2)CC1	ZINC000819484495	ED	On-Demand	Anodyne	CCR8	60	36
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819484497	DD	On-Demand	Anodyne	DRD2	18	53
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819484497	DD	On-Demand	Anodyne	DRD4	38	53
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819484497	DD	On-Demand	Anodyne	ACHE	27	49
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819484497	DD	On-Demand	Anodyne	HRH2	16	43
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819484497	DD	On-Demand	Anodyne	KCNH2	22	48
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819484497	DD	On-Demand	Anodyne	CHRM3	19	42
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819484497	DD	On-Demand	Anodyne	SIGMAR1	51	63
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819484497	DD	On-Demand	Anodyne	SSTR5	57	45
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819484497	DD	On-Demand	Anodyne	CCR3	118	58
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819484497	DD	On-Demand	Anodyne	MLNR	55	41
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819484497	DD	On-Demand	Anodyne	SLC6A5	30	45
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819484497	DD	On-Demand	Anodyne	EPHX2	37	47
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819484497	DD	On-Demand	Anodyne	CXCR3	40	40
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819484497	DD	On-Demand	Anodyne	MCHR1	62	64
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)cc2)CC1	ZINC000819484497	DD	On-Demand	Anodyne	CACNA1G	48	50
O=C(O)CCNC(=O)NC[C@@H](CCO)c1ccccc1	ZINC000819484498	CC	On-Demand	Anodyne	MME	19	42
O=C(O)CCNC(=O)NC[C@@H](CCO)c1ccccc1	ZINC000819484498	CC	On-Demand	Anodyne	NAALAD2	28	40
O=C(O)CCNC(=O)NC[C@H](CCO)c1ccccc1	ZINC000819484499	CC	On-Demand	Anodyne	MME	19	42
O=C(O)CCNC(=O)NC[C@H](CCO)c1ccccc1	ZINC000819484499	CC	On-Demand	Anodyne	NAALAD2	28	40
O=C(O)CCNC(=O)NC1CCN(CC2CCCCC2)CC1	ZINC000819484502	DD	On-Demand	Anodyne	EPHX2	18	44
O=C(O)CCNC(=O)NC1CCN(c2ccccn2)CC1	ZINC000819484504	CC	On-Demand	Anodyne	DRD4	35	47
O=C(O)CCNC(=O)NC1CCN(c2ccccn2)CC1	ZINC000819484504	CC	On-Demand	Anodyne	SIGMAR1	15	42
O=C(O)CCNC(=O)NC1CCN(c2ccccn2)CC1	ZINC000819484504	CC	On-Demand	Anodyne	EPHX2	35	46
O=C(O)CCNC(=O)NC1CCN(c2ccccn2)CC1	ZINC000819484504	CC	On-Demand	Anodyne	Q59401_ENTCL	59	32
O=C(O)CCNC(=O)NC1CCN(c2ccccn2)CC1	ZINC000819484504	CC	On-Demand	Anodyne	SIRT3	50	32
O=C(O)CCNC(=O)NC1CCN(c2ccccn2)CC1	ZINC000819484504	CC	On-Demand	Anodyne	SIRT2	51	32
O=C(O)CCNC(=O)NC1CCN(c2ccccn2)CC1	ZINC000819484504	CC	On-Demand	Anodyne	SIRT1	50	32
O=C(O)CCNC(=O)NCC(=O)Nc1cccc2ccccc12	ZINC000819484505	DD	On-Demand	Anodyne	TRPV1	22	46
O=C(O)CCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819484510	DC	On-Demand	Anodyne	DRD4	30	53
O=C(O)CCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819484510	DC	On-Demand	Anodyne	ACHE	30	49
O=C(O)CCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819484510	DC	On-Demand	Anodyne	SIGMAR1	34	51
O=C(O)CCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819484510	DC	On-Demand	Anodyne	SSTR5	62	42
O=C(O)CCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819484510	DC	On-Demand	Anodyne	CCR3	31	42
O=C(O)CCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819484510	DC	On-Demand	Anodyne	SLC6A5	29	43
O=C(O)CCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819484510	DC	On-Demand	Anodyne	EPHX2	26	47
O=C(O)CCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819484510	DC	On-Demand	Anodyne	PDK1	34	40
O=C(O)CCNC(=O)NC1CCN(Cc2ccncc2)CC1	ZINC000819484510	DC	On-Demand	Anodyne	MCHR1	46	47
O=C(O)CCNC(=O)N[C@H]1C[C@H]1Cc1ccccc1	ZINC000819484512	CD	On-Demand	Anodyne	MME	25	43
O=C(O)CCNC(=O)N[C@@H]1C[C@@H]1Cc1ccccc1	ZINC000819484513	CD	On-Demand	Anodyne	MME	25	43
O=C(O)CCNC(=O)N[C@H]1C[C@@H]1Cc1ccccc1	ZINC000819484514	CD	On-Demand	Anodyne	MME	25	43
O=C(O)CCNC(=O)N[C@@H]1C[C@H]1Cc1ccccc1	ZINC000819484515	CD	On-Demand	Anodyne	MME	25	43
O=C(O)CCNC(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000819484520	ED	On-Demand	Anodyne	CCR3	22	41
O=C(O)CCNC(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000819484521	ED	On-Demand	Anodyne	CCR3	22	41
O=C(O)CCNC(=O)NCCCN1CCc2ccccc2C1	ZINC000819484525	DD	On-Demand	Anodyne	HTR1A	26	53
O=C(O)CCNC(=O)NCCCN1CCc2ccccc2C1	ZINC000819484525	DD	On-Demand	Anodyne	DRD2	27	45
O=C(O)CCNC(=O)NCCCN1CCc2ccccc2C1	ZINC000819484525	DD	On-Demand	Anodyne	HTR2A	21	45
O=C(O)CCNC(=O)NCCCN1CCc2ccccc2C1	ZINC000819484525	DD	On-Demand	Anodyne	DRD3	41	59
O=C(O)CCNC(=O)NCCCN1CCc2ccccc2C1	ZINC000819484525	DD	On-Demand	Anodyne	HTR7	42	58
O=C(O)CCNC(=O)NCCCN1CCc2ccccc2C1	ZINC000819484525	DD	On-Demand	Anodyne	SIGMAR1	15	51
O=C(O)CCNC(=O)NCCCN1CCc2ccccc2C1	ZINC000819484525	DD	On-Demand	Anodyne	CCR3	19	43
O=C(O)CCNC(=O)NCCCN1CCc2ccccc2C1	ZINC000819484525	DD	On-Demand	Anodyne	HTR5A	15	42
O=C(O)CCNC(=O)NCCCN1CCc2ccccc2C1	ZINC000819484525	DD	On-Demand	Anodyne	NOD2	42	35
O=C(O)CCNC(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819484526	DC	On-Demand	Anodyne	ADRB2	27	44
O=C(O)CCNC(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819484526	DC	On-Demand	Anodyne	ADRB1	56	40
O=C(O)CCNC(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819484526	DC	On-Demand	Anodyne	PTGFR	40	37
O=C(O)CCNC(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819484526	DC	On-Demand	Anodyne	ADRB3	26	42
O=C(O)CCNC(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819484526	DC	On-Demand	Anodyne	ABCB1	18	41
O=C(O)CCNC(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000819484526	DC	On-Demand	Anodyne	PDS	70	45
O=C(O)CCNC(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819484527	DC	On-Demand	Anodyne	ADRB2	27	44
O=C(O)CCNC(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819484527	DC	On-Demand	Anodyne	ADRB1	56	40
O=C(O)CCNC(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819484527	DC	On-Demand	Anodyne	PTGFR	40	37
O=C(O)CCNC(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819484527	DC	On-Demand	Anodyne	ADRB3	26	42
O=C(O)CCNC(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819484527	DC	On-Demand	Anodyne	ABCB1	18	41
O=C(O)CCNC(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000819484527	DC	On-Demand	Anodyne	PDS	70	45
O=C(O)CCNC(=O)NC1CCN(C(=O)c2ccco2)CC1	ZINC000819484534	DC	On-Demand	Anodyne	EPHX2	39	45
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819484535	ED	On-Demand	Anodyne	CHRM1	15	42
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819484535	ED	On-Demand	Anodyne	DRD4	31	48
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819484535	ED	On-Demand	Anodyne	HRH2	21	45
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819484535	ED	On-Demand	Anodyne	KCNH2	18	45
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819484535	ED	On-Demand	Anodyne	CHRM3	19	42
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819484535	ED	On-Demand	Anodyne	SIGMAR1	33	65
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819484535	ED	On-Demand	Anodyne	SSTR5	70	42
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819484535	ED	On-Demand	Anodyne	CCR3	70	53
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819484535	ED	On-Demand	Anodyne	SLC6A5	29	41
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819484535	ED	On-Demand	Anodyne	EPHX2	24	43
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819484535	ED	On-Demand	Anodyne	CXCR3	47	41
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(F)c(F)c2)CC1	ZINC000819484535	ED	On-Demand	Anodyne	MCHR1	60	59
O=C(O)CCNC(=O)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000819484543	DD	On-Demand	Mild	FFAR1	31	42
O=C(O)CCNC(=O)NC[C@H](O)c1ccccc1	ZINC000819484544	CC	On-Demand	Anodyne	MME	33	47
O=C(O)CCNC(=O)NC[C@H](O)c1ccccc1	ZINC000819484544	CC	On-Demand	Anodyne	NAALAD2	29	40
O=C(O)CCNC(=O)NC[C@H](O)c1ccccc1	ZINC000819484544	CC	On-Demand	Anodyne	AOC3	15	49
O=C(O)CCNC(=O)NC[C@@H](O)c1ccccc1	ZINC000819484545	CC	On-Demand	Anodyne	MME	33	47
O=C(O)CCNC(=O)NC[C@@H](O)c1ccccc1	ZINC000819484545	CC	On-Demand	Anodyne	NAALAD2	29	40
O=C(O)CCNC(=O)NC[C@@H](O)c1ccccc1	ZINC000819484545	CC	On-Demand	Anodyne	AOC3	15	49
O=C(O)CCNC(=O)NCC(=O)Nc1cccc(F)c1	ZINC000819484550	CC	On-Demand	Anodyne	KCNK3	25	42
O=C(O)CCNC(=O)NCCCOc1ccccc1F	ZINC000819484553	CD	On-Demand	Anodyne	FOLH1	42	44
O=C(O)CCNC(=O)NCCCOc1ccccc1F	ZINC000819484553	CD	On-Demand	Anodyne	CXCL8	19	43
O=C(O)CCNC(=O)NCC(=O)Nc1ccc(Br)cc1	ZINC000819484556	ED	On-Demand	Anodyne	IDO1	15	41
O=C(O)CCNC(=O)NC[C@H](CO)Cc1ccccc1	ZINC000819484563	CC	On-Demand	Anodyne	MME	69	51
O=C(O)CCNC(=O)NC[C@H](CO)Cc1ccccc1	ZINC000819484563	CC	On-Demand	Anodyne	ANPEP	30	48
O=C(O)CCNC(=O)NC[C@H](CO)Cc1ccccc1	ZINC000819484563	CC	On-Demand	Anodyne	CPA1	45	37
O=C(O)CCNC(=O)NC[C@H](CO)Cc1ccccc1	ZINC000819484563	CC	On-Demand	Anodyne	NAALAD2	30	43
O=C(O)CCNC(=O)NC[C@@H](CO)Cc1ccccc1	ZINC000819484564	CC	On-Demand	Anodyne	MME	69	51
O=C(O)CCNC(=O)NC[C@@H](CO)Cc1ccccc1	ZINC000819484564	CC	On-Demand	Anodyne	ANPEP	30	48
O=C(O)CCNC(=O)NC[C@@H](CO)Cc1ccccc1	ZINC000819484564	CC	On-Demand	Anodyne	CPA1	45	37
O=C(O)CCNC(=O)NC[C@@H](CO)Cc1ccccc1	ZINC000819484564	CC	On-Demand	Anodyne	NAALAD2	30	43
O=C(O)CCNC(=O)NC[C@H](O)c1ccccc1Cl	ZINC000819484575	CD	On-Demand	Anodyne	MME	20	41
O=C(O)CCNC(=O)NC[C@H](O)c1ccccc1Cl	ZINC000819484575	CD	On-Demand	Anodyne	CXCL8	43	34
O=C(O)CCNC(=O)NC[C@@H](O)c1ccccc1Cl	ZINC000819484576	CD	On-Demand	Anodyne	MME	20	41
O=C(O)CCNC(=O)NC[C@@H](O)c1ccccc1Cl	ZINC000819484576	CD	On-Demand	Anodyne	CXCL8	43	34
O=C(O)CCNC(=O)NC[C@H]1CCN(CC(F)(F)F)C1	ZINC000819484577	CC	On-Demand	Anodyne	CACNA1I	40	34
O=C(O)CCNC(=O)NC[C@@H]1CCN(CC(F)(F)F)C1	ZINC000819484578	CC	On-Demand	Anodyne	CACNA1I	40	34
O=C(O)CCNC(=O)NC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819484579	DD	On-Demand	Anodyne	SOAT1	15	41
O=C(O)CCNC(=O)NC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819484580	DD	On-Demand	Anodyne	SOAT1	15	41
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	HTR1A	17	41
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	CHRM1	21	44
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	DRD2	30	51
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	DRD4	37	60
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	ACHE	23	48
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	HTR2A	27	60
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	HRH1	15	41
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	OPRM1	20	55
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	DRD3	21	51
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	HTR4	36	41
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	CHRM3	23	40
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	MME	17	42
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	LTA4H	21	44
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	SIGMAR1	68	67
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	CCR3	54	47
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	CCR5	15	44
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	EPHX2	41	57
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	MCHR1	32	44
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	CACNA1G	26	42
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	CYP2J2	47	35
O=C(O)CCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000819484583	DD	On-Demand	Anodyne	BIRC2	30	44
O=C(O)CCNC(=O)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000819484584	ED	On-Demand	Anodyne	DRD4	15	41
O=C(O)CCNC(=O)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000819484584	ED	On-Demand	Anodyne	HRH2	18	42
O=C(O)CCNC(=O)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000819484584	ED	On-Demand	Anodyne	SLC6A1	64	37
O=C(O)CCNC(=O)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000819484584	ED	On-Demand	Anodyne	CCR3	44	45
O=C(O)CCNC(=O)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000819484584	ED	On-Demand	Anodyne	EPHX2	17	41
O=C(O)CCNC(=O)N[C@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000819484585	ED	On-Demand	Anodyne	DRD4	15	41
O=C(O)CCNC(=O)N[C@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000819484585	ED	On-Demand	Anodyne	HRH2	18	42
O=C(O)CCNC(=O)N[C@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000819484585	ED	On-Demand	Anodyne	SLC6A1	64	37
O=C(O)CCNC(=O)N[C@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000819484585	ED	On-Demand	Anodyne	CCR3	44	45
O=C(O)CCNC(=O)N[C@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000819484585	ED	On-Demand	Anodyne	EPHX2	17	41
O=C(O)CCNC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819484586	FE	On-Demand	Anodyne	CHRM2	15	48
O=C(O)CCNC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819484586	FE	On-Demand	Anodyne	CHRM1	15	48
O=C(O)CCNC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819484586	FE	On-Demand	Anodyne	DRD2	16	51
O=C(O)CCNC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819484586	FE	On-Demand	Anodyne	DRD4	34	63
O=C(O)CCNC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819484586	FE	On-Demand	Anodyne	ACHE	34	46
O=C(O)CCNC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819484586	FE	On-Demand	Anodyne	HRH2	30	49
O=C(O)CCNC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819484586	FE	On-Demand	Anodyne	KCNH2	17	43
O=C(O)CCNC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819484586	FE	On-Demand	Anodyne	CHRM3	27	48
O=C(O)CCNC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819484586	FE	On-Demand	Anodyne	TACR1	23	42
O=C(O)CCNC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819484586	FE	On-Demand	Anodyne	SIGMAR1	35	67
O=C(O)CCNC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819484586	FE	On-Demand	Anodyne	SSTR5	53	42
O=C(O)CCNC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819484586	FE	On-Demand	Anodyne	CACNA1B	20	44
O=C(O)CCNC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819484586	FE	On-Demand	Anodyne	CCR3	50	48
O=C(O)CCNC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819484586	FE	On-Demand	Anodyne	CCR2	98	52
O=C(O)CCNC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819484586	FE	On-Demand	Anodyne	SLC6A5	35	52
O=C(O)CCNC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819484586	FE	On-Demand	Anodyne	EPHX2	35	47
O=C(O)CCNC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819484586	FE	On-Demand	Anodyne	CXCR3	29	51
O=C(O)CCNC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819484586	FE	On-Demand	Anodyne	MCHR1	61	52
O=C(O)CCNC(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000819484586	FE	On-Demand	Anodyne	CACNA1G	36	41
O=C(O)CCNC(=O)NCC(=O)NC1CCCCC1	ZINC000819484587	CC	On-Demand	Anodyne	EPHX2	18	45
O=C(O)CCNC(=O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000819484671	FE	On-Demand	Anodyne	DRD4	21	54
O=C(O)CCNC(=O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000819484671	FE	On-Demand	Anodyne	SIGMAR1	17	45
O=C(O)CCNC(=O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000819484671	FE	On-Demand	Anodyne	SSTR5	41	37
O=C(O)CCNC(=O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000819484671	FE	On-Demand	Anodyne	CCR3	18	40
O=C(O)CCNC(=O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000819484671	FE	On-Demand	Anodyne	MCHR1	24	42
O=C(O)CCNC(=O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000819484671	FE	On-Demand	Anodyne	PDE8B	54	31
O=C(O)CCNC(=O)NC[C@@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1	ZINC000819484673	GD	On-Demand	Anodyne	EPHX2	15	42
O=C(O)CCNC(=O)NC[C@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1	ZINC000819484674	GD	On-Demand	Anodyne	EPHX2	15	42
O=C(O)CCNC(=O)NC1CCN(C(=O)c2ccoc2)CC1	ZINC000819484676	DC	On-Demand	Anodyne	EPHX2	36	42
O=C(O)CCNC(=O)NC1CCN(C(=O)c2ccoc2)CC1	ZINC000819484676	DC	On-Demand	Anodyne	L3MBTL3	43	32
O=C(O)CCNC(=O)NC1CCN(CCO)CC1	ZINC000819484688	CB	On-Demand	Anodyne	SLC6A5	19	41
O=C(O)CCNC(=O)NC1CCN(CCO)CC1	ZINC000819484688	CB	On-Demand	Anodyne	EPHX2	15	40
O=C(O)CCNC(=O)NC1CCN(C2CCCC2)CC1	ZINC000819484689	CD	On-Demand	Anodyne	EPHX2	19	43
O=C(O)CCNC(=O)NCCCC(=O)N1Cc2ccccc2C1	ZINC000819484698	DD	On-Demand	Anodyne	DPP8	21	43
O=C(O)CCNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000819484700	EC	On-Demand	Anodyne	DRD4	32	55
O=C(O)CCNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000819484700	EC	On-Demand	Anodyne	LTA4H	20	41
O=C(O)CCNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000819484700	EC	On-Demand	Anodyne	SIGMAR1	18	47
O=C(O)CCNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000819484700	EC	On-Demand	Anodyne	CCR3	37	45
O=C(O)CCNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000819484700	EC	On-Demand	Anodyne	EPHX2	44	48
O=C(O)CCNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000819484700	EC	On-Demand	Anodyne	CXCR3	17	42
O=C(O)CCNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1	ZINC000819484700	EC	On-Demand	Anodyne	MCHR1	20	40
O=C(O)CCNC(=O)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819484702	DD	On-Demand	Anodyne	PDS	41	37
O=C(O)CCNC(=O)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819484703	DD	On-Demand	Anodyne	PDS	41	37
O=C(O)CCNC(=O)NCC(=O)Nc1ccc(-n2cccn2)cc1	ZINC000819484706	EC	On-Demand	Anodyne	AMP1_PLAFQ	56	40
O=C(O)CCNC(=O)NCCCN1CCCCC1	ZINC000819484712	CC	On-Demand	Anodyne	CHRNA7	15	50
O=C(O)CCNC(=O)NCC1(N2CCCC2)CCOCC1	ZINC000819484717	CC	On-Demand	Anodyne	HCN1	57	39
O=C(O)CCNC(=O)NCC1(N2CCCC2)CCOCC1	ZINC000819484717	CC	On-Demand	Anodyne	HCN4	47	31
O=C(O)CCNC(=O)NC1CCN(C2CCCCC2)CC1	ZINC000819484718	CD	On-Demand	Anodyne	EPHX2	21	46
O=C(O)CCNC(=O)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000819484725	CC	On-Demand	Anodyne	SLC18A3	37	40
O=C(O)CCNC(=O)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000819484725	CC	On-Demand	Anodyne	EPHX2	23	42
O=C(O)CCNC(=O)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000819484727	CC	On-Demand	Anodyne	SLC18A3	37	40
O=C(O)CCNC(=O)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000819484727	CC	On-Demand	Anodyne	EPHX2	23	42
O=C(O)CCNC(=O)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000819484728	CC	On-Demand	Anodyne	SLC18A3	37	40
O=C(O)CCNC(=O)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000819484728	CC	On-Demand	Anodyne	EPHX2	23	42
CNC(=O)COc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)c(C)c1	ZINC000819484729	GG	On-Demand	Anodyne	ADRB2	27	52
CNC(=O)COc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)c(C)c1	ZINC000819484729	GG	On-Demand	Anodyne	CASR	40	35
CNC(=O)COc1ccc(NC[C@H](O)COc2ccc3ccccc3c2)c(C)c1	ZINC000819484729	GG	On-Demand	Anodyne	ACOX1	51	38
O=C(O)CCNC(=O)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000819484730	CC	On-Demand	Anodyne	SLC18A3	37	40
O=C(O)CCNC(=O)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000819484730	CC	On-Demand	Anodyne	EPHX2	23	42
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)c(C)c1	ZINC000819484732	GG	On-Demand	Anodyne	ADRB2	27	52
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)c(C)c1	ZINC000819484732	GG	On-Demand	Anodyne	CASR	40	35
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccc3ccccc3c2)c(C)c1	ZINC000819484732	GG	On-Demand	Anodyne	ACOX1	51	38
O=C(O)CCNC(=O)NC1CCN(CC2CCCC2)CC1	ZINC000819484743	CD	On-Demand	Anodyne	EPHX2	15	42
O=C(O)CCNC(=O)NCCCCN1CCOCC1	ZINC000819484744	CB	On-Demand	Anodyne	PAOX	20	51
O=C(O)CCNC(=O)NCCCCN1CCOCC1	ZINC000819484744	CB	On-Demand	Anodyne	EPHX2	24	52
O=C(O)CCNC(=O)NC1CCN(c2cccs2)CC1	ZINC000819484750	CD	On-Demand	Anodyne	EPHX2	27	42
O=C(O)CCNC(=O)NC1CCN(CC(F)(F)F)CC1	ZINC000819484751	CC	On-Demand	Anodyne	HPGDS	40	46
O=C(O)CCNC(=O)NCC#Cc1ccccc1	ZINC000819484754	BC	On-Demand	Mild	MME	23	44
O=C(O)CCNC(=O)NCC#Cc1ccccc1	ZINC000819484754	BC	On-Demand	Mild	FFAR1	44	45
O=C(O)CCNC(=O)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000819484755	DC	On-Demand	Anodyne	ACHE	19	40
O=C(O)CCNC(=O)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000819484755	DC	On-Demand	Anodyne	SIGMAR1	46	41
O=C(O)CCNC(=O)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000819484755	DC	On-Demand	Anodyne	NPFFR2	46	48
O=C(O)CCNC(=O)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000819484755	DC	On-Demand	Anodyne	UTS2R	15	41
O=C(O)CCNC(=O)NC[C@@]1(O)CCN(Cc2ccccc2)C1	ZINC000819484755	DC	On-Demand	Anodyne	NPFFR1	59	56
O=C(O)CCNC(=O)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000819484756	DC	On-Demand	Anodyne	ACHE	19	40
O=C(O)CCNC(=O)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000819484756	DC	On-Demand	Anodyne	SIGMAR1	46	41
O=C(O)CCNC(=O)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000819484756	DC	On-Demand	Anodyne	NPFFR2	46	48
O=C(O)CCNC(=O)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000819484756	DC	On-Demand	Anodyne	UTS2R	15	41
O=C(O)CCNC(=O)NC[C@]1(O)CCN(Cc2ccccc2)C1	ZINC000819484756	DC	On-Demand	Anodyne	NPFFR1	59	56
O=C(O)CCNC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000819484760	DC	On-Demand	Anodyne	DRD4	24	61
O=C(O)CCNC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000819484760	DC	On-Demand	Anodyne	SIGMAR1	24	47
O=C(O)CCNC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000819484760	DC	On-Demand	Anodyne	SSTR5	53	40
O=C(O)CCNC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000819484760	DC	On-Demand	Anodyne	CCR3	21	40
O=C(O)CCNC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000819484760	DC	On-Demand	Anodyne	EPHX2	28	45
O=C(O)CCNC(=O)NC1CCN(Cc2ccccn2)CC1	ZINC000819484760	DC	On-Demand	Anodyne	MCHR1	31	43
O=C(O)CCNC(=O)NCC1(N2CCOCC2)CCCCC1	ZINC000819484763	DC	On-Demand	Anodyne	HCN1	65	37
O=C(O)CCNC(=O)NCC1(N2CCOCC2)CCCCC1	ZINC000819484763	DC	On-Demand	Anodyne	HCN4	56	37
O=C(O)CCNC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000819484768	ED	On-Demand	Anodyne	CCR3	23	42
O=C(O)CCNC(=O)NC1CCN(C(=O)c2ccccc2F)CC1	ZINC000819484768	ED	On-Demand	Anodyne	EPHX2	48	56
O=C(O)CCNC(=O)NC[C@@H](c1ccccc1)N1CCCC1	ZINC000819484769	DD	On-Demand	Anodyne	MME	18	40
O=C(O)CCNC(=O)NC[C@H](c1ccccc1)N1CCCC1	ZINC000819484771	DD	On-Demand	Anodyne	MME	18	40
O=C(O)CCNC(=O)NCC(=O)NCCc1ccccc1	ZINC000819484772	CC	On-Demand	Anodyne	MME	32	49
O=C(O)CCNC(=O)NCC(=O)NCCc1ccccc1	ZINC000819484772	CC	On-Demand	Anodyne	CPA1	17	41
O=C(O)CCNC(=O)NCC(=O)NCCc1ccccc1	ZINC000819484772	CC	On-Demand	Anodyne	CA5B	17	46
O=C(O)CCNC(=O)NCC(=O)NCCc1ccccc1	ZINC000819484772	CC	On-Demand	Anodyne	CA5A	15	46
O=C(O)CCNC(=O)NCC(=O)NCCc1ccccc1	ZINC000819484772	CC	On-Demand	Anodyne	AMP1_PLAFQ	20	41
O=C(O)CCNC(=O)NCC(=O)NCCc1ccccc1	ZINC000819484772	CC	On-Demand	Anodyne	FFAR1	34	41
O=C(O)CCNC(=O)NC[C@H](O)c1ccccc1F	ZINC000819484775	CC	On-Demand	Anodyne	MME	20	44
O=C(O)CCNC(=O)NC[C@@H](O)c1ccccc1F	ZINC000819484779	CC	On-Demand	Anodyne	MME	20	44
O=C(O)CCNC(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000819484783	EB	On-Demand	Anodyne	HTR1A	73	63
O=C(O)CCNC(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000819484783	EB	On-Demand	Anodyne	DRD2	67	51
O=C(O)CCNC(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000819484783	EB	On-Demand	Anodyne	DRD1	15	46
O=C(O)CCNC(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000819484783	EB	On-Demand	Anodyne	DRD4	45	51
O=C(O)CCNC(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000819484783	EB	On-Demand	Anodyne	ADRA1D	27	44
O=C(O)CCNC(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000819484783	EB	On-Demand	Anodyne	HTR2A	53	51
O=C(O)CCNC(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000819484783	EB	On-Demand	Anodyne	HTR2C	33	50
O=C(O)CCNC(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000819484783	EB	On-Demand	Anodyne	ADRA1A	34	44
O=C(O)CCNC(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000819484783	EB	On-Demand	Anodyne	DRD3	79	45
O=C(O)CCNC(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000819484783	EB	On-Demand	Anodyne	HTR7	74	46
O=C(O)CCNC(=O)NCCCN1CCN(c2ncccn2)CC1	ZINC000819484783	EB	On-Demand	Anodyne	CCR3	17	40
COCCNC(=O)c1ccccc1NC(=O)CCc1ccc(OC)c(Cl)c1	ZINC000819484797	GG	On-Demand	Anodyne	PDE5A	26	45
COCCNC(=O)c1ccccc1NC(=O)CCc1ccc(OC)c(Cl)c1	ZINC000819484797	GG	On-Demand	Anodyne	HCAR2	37	50
COCCNC(=O)c1ccccc1NC(=O)CCc1ccc(OC)c(Cl)c1	ZINC000819484797	GG	On-Demand	Anodyne	ABCG2	18	42
O=C(O)CCNC(=O)NCC(c1ccccc1)c1ccccc1	ZINC000819484801	DF	On-Demand	Anodyne	MME	29	44
O=C(O)CCNC(=O)NCC(c1ccccc1)c1ccccc1	ZINC000819484801	DF	On-Demand	Anodyne	NAALAD2	38	41
O=C(O)CCNC(=O)N[C@@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000819484812	DE	On-Demand	Anodyne	RBP4	81	44
O=C(O)CCNC(=O)N[C@H]1C[C@@H]1c1ccccc1C(F)(F)F	ZINC000819484813	DE	On-Demand	Anodyne	RBP4	81	44
O=C(O)CCNC(=O)N[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F	ZINC000819484814	DE	On-Demand	Anodyne	RBP4	81	44
O=C(O)CCNC(=O)N[C@H]1C[C@H]1c1ccccc1C(F)(F)F	ZINC000819484816	DE	On-Demand	Anodyne	RBP4	81	44
O=C(O)CCNC(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819484817	FC	On-Demand	Anodyne	DRD4	15	46
O=C(O)CCNC(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819484817	FC	On-Demand	Anodyne	PTPN2	46	41
O=C(O)CCNC(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819484817	FC	On-Demand	Anodyne	SIGMAR1	20	51
O=C(O)CCNC(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819484817	FC	On-Demand	Anodyne	PTPN1	37	41
O=C(O)CCNC(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819484817	FC	On-Demand	Anodyne	EPHX2	48	49
O=C(O)CCNC(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000819484817	FC	On-Demand	Anodyne	TGM2	39	42
O=C(O)CCNC(=O)NCC(=O)OCc1ccccc1Cl	ZINC000819484821	DD	On-Demand	Anodyne	FABP5	27	41
COC(=O)[C@@H]1CCCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819484827	GF	On-Demand	Mild	F2	20	43
COC(=O)[C@@H]1CCCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819484827	GF	On-Demand	Mild	PLG	21	43
COC(=O)[C@@H]1CCCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819484827	GF	On-Demand	Mild	PRSS1	15	43
COC(=O)[C@@H]1CCCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819484827	GF	On-Demand	Mild	CELA1	52	43
COC(=O)[C@@H]1CCCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819484827	GF	On-Demand	Mild	HLA-DRB3	52	35
COC(=O)[C@@H]1CCCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819484827	GF	On-Demand	Mild	PAPA1_CARPA	34	42
COC(=O)[C@@H]1CCCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819484827	GF	On-Demand	Mild	TRY1_BOVIN	30	43
COC(=O)[C@@H]1CCCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819484828	GF	On-Demand	Mild	F2	20	43
COC(=O)[C@@H]1CCCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819484828	GF	On-Demand	Mild	PLG	21	43
COC(=O)[C@@H]1CCCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819484828	GF	On-Demand	Mild	PRSS1	15	43
COC(=O)[C@@H]1CCCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819484828	GF	On-Demand	Mild	CELA1	52	43
COC(=O)[C@@H]1CCCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819484828	GF	On-Demand	Mild	HLA-DRB3	52	35
COC(=O)[C@@H]1CCCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819484828	GF	On-Demand	Mild	PAPA1_CARPA	34	42
COC(=O)[C@@H]1CCCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819484828	GF	On-Demand	Mild	TRY1_BOVIN	30	43
CC(=O)Nc1cccc(CC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1	ZINC000819484839	EE	On-Demand	Clean	ADRB2	45	39
CC(=O)Nc1cccc(CC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1	ZINC000819484839	EE	On-Demand	Clean	INHA	22	40
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1	ZINC000819484840	EE	On-Demand	Clean	ADRB2	45	39
CC(=O)Nc1cccc(CC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1	ZINC000819484840	EE	On-Demand	Clean	INHA	22	40
CNC(=O)COc1ccc(NC[C@H](O)COc2ccccc2)c(C)c1	ZINC000819484854	ED	On-Demand	Anodyne	ADRB2	46	44
CNC(=O)COc1ccc(NC[C@H](O)COc2ccccc2)c(C)c1	ZINC000819484854	ED	On-Demand	Anodyne	ADRB1	60	47
CNC(=O)COc1ccc(NC[C@H](O)COc2ccccc2)c(C)c1	ZINC000819484854	ED	On-Demand	Anodyne	ADRB3	39	47
CNC(=O)COc1ccc(NC[C@H](O)COc2ccccc2)c(C)c1	ZINC000819484854	ED	On-Demand	Anodyne	ACOX1	50	35
CNC(=O)COc1ccc(NC[C@H](O)COc2ccccc2)c(C)c1	ZINC000819484854	ED	On-Demand	Anodyne	ABCB1	27	40
CNC(=O)COc1ccc(NC[C@H](O)COc2ccccc2)c(C)c1	ZINC000819484854	ED	On-Demand	Anodyne	PDS	48	33
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccccc2)c(C)c1	ZINC000819484855	ED	On-Demand	Anodyne	ADRB2	46	44
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccccc2)c(C)c1	ZINC000819484855	ED	On-Demand	Anodyne	ADRB1	60	47
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccccc2)c(C)c1	ZINC000819484855	ED	On-Demand	Anodyne	ADRB3	39	47
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccccc2)c(C)c1	ZINC000819484855	ED	On-Demand	Anodyne	ACOX1	50	35
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccccc2)c(C)c1	ZINC000819484855	ED	On-Demand	Anodyne	ABCB1	27	40
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccccc2)c(C)c1	ZINC000819484855	ED	On-Demand	Anodyne	PDS	48	33
CNC(=O)COc1ccc(NC[C@H](O)COc2ccccc2C(C)C)c(C)c1	ZINC000819484856	GG	On-Demand	Anodyne	ADRB2	27	42
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccccc2C(C)C)c(C)c1	ZINC000819484858	GG	On-Demand	Anodyne	ADRB2	27	42
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819484866	FF	On-Demand	Anodyne	DRD4	44	50
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819484866	FF	On-Demand	Anodyne	ACHE	30	44
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819484866	FF	On-Demand	Anodyne	HRH2	20	45
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819484866	FF	On-Demand	Anodyne	HRH1	19	49
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819484866	FF	On-Demand	Anodyne	KCNH2	16	46
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819484866	FF	On-Demand	Anodyne	CHRM3	16	40
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819484866	FF	On-Demand	Anodyne	SIGMAR1	47	65
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819484866	FF	On-Demand	Anodyne	SSTR5	82	49
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819484866	FF	On-Demand	Anodyne	CCR3	74	49
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819484866	FF	On-Demand	Anodyne	UTS2R	24	48
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819484866	FF	On-Demand	Anodyne	SLC6A5	27	41
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819484866	FF	On-Demand	Anodyne	EPHX2	22	45
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819484866	FF	On-Demand	Anodyne	PDK1	51	39
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819484866	FF	On-Demand	Anodyne	CXCR3	53	42
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819484866	FF	On-Demand	Anodyne	MCHR1	63	59
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819484866	FF	On-Demand	Anodyne	CACNA1G	26	43
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819484866	FF	On-Demand	Anodyne	NPFFR1	21	41
O=C(O)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000819484866	FF	On-Demand	Anodyne	ARG2	15	46
O=C(O)CCNC(=O)N[C@H]1CN(Cc2ccccc2)CC[C@@H]1CO	ZINC000819484870	EC	On-Demand	Anodyne	DRD2	15	49
O=C(O)CCNC(=O)N[C@H]1CN(Cc2ccccc2)CC[C@@H]1CO	ZINC000819484870	EC	On-Demand	Anodyne	DRD4	43	49
O=C(O)CCNC(=O)N[C@H]1CN(Cc2ccccc2)CC[C@@H]1CO	ZINC000819484870	EC	On-Demand	Anodyne	ACHE	36	47
O=C(O)CCNC(=O)N[C@H]1CN(Cc2ccccc2)CC[C@@H]1CO	ZINC000819484870	EC	On-Demand	Anodyne	SIGMAR1	45	45
O=C(O)CCNC(=O)N[C@H]1CN(Cc2ccccc2)CC[C@@H]1CO	ZINC000819484870	EC	On-Demand	Anodyne	CCR3	39	41
O=C(O)CCNC(=O)N[C@H]1CN(Cc2ccccc2)CC[C@@H]1CO	ZINC000819484870	EC	On-Demand	Anodyne	MCHR1	18	42
O=C(O)CCNC(=O)N[C@H]1CN(Cc2ccccc2)CC[C@H]1CO	ZINC000819484872	EC	On-Demand	Anodyne	DRD2	15	49
O=C(O)CCNC(=O)N[C@H]1CN(Cc2ccccc2)CC[C@H]1CO	ZINC000819484872	EC	On-Demand	Anodyne	DRD4	43	49
O=C(O)CCNC(=O)N[C@H]1CN(Cc2ccccc2)CC[C@H]1CO	ZINC000819484872	EC	On-Demand	Anodyne	ACHE	36	47
O=C(O)CCNC(=O)N[C@H]1CN(Cc2ccccc2)CC[C@H]1CO	ZINC000819484872	EC	On-Demand	Anodyne	SIGMAR1	45	45
O=C(O)CCNC(=O)N[C@H]1CN(Cc2ccccc2)CC[C@H]1CO	ZINC000819484872	EC	On-Demand	Anodyne	CCR3	39	41
O=C(O)CCNC(=O)N[C@H]1CN(Cc2ccccc2)CC[C@H]1CO	ZINC000819484872	EC	On-Demand	Anodyne	MCHR1	18	42
COc1cc(NC[C@H](O)c2cc(C)cc(C)c2)ccc1O	ZINC000819484873	CG	On-Demand	Anodyne	ADRB2	22	42
O=C(O)CCNC(=O)N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO	ZINC000819484874	EC	On-Demand	Anodyne	DRD2	15	49
O=C(O)CCNC(=O)N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO	ZINC000819484874	EC	On-Demand	Anodyne	DRD4	43	49
O=C(O)CCNC(=O)N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO	ZINC000819484874	EC	On-Demand	Anodyne	ACHE	36	47
O=C(O)CCNC(=O)N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO	ZINC000819484874	EC	On-Demand	Anodyne	SIGMAR1	45	45
O=C(O)CCNC(=O)N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO	ZINC000819484874	EC	On-Demand	Anodyne	CCR3	39	41
O=C(O)CCNC(=O)N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO	ZINC000819484874	EC	On-Demand	Anodyne	MCHR1	18	42
O=C(O)CCNC(=O)N[C@@H]1CN(Cc2ccccc2)CC[C@H]1CO	ZINC000819484875	EC	On-Demand	Anodyne	DRD2	15	49
O=C(O)CCNC(=O)N[C@@H]1CN(Cc2ccccc2)CC[C@H]1CO	ZINC000819484875	EC	On-Demand	Anodyne	DRD4	43	49
O=C(O)CCNC(=O)N[C@@H]1CN(Cc2ccccc2)CC[C@H]1CO	ZINC000819484875	EC	On-Demand	Anodyne	ACHE	36	47
O=C(O)CCNC(=O)N[C@@H]1CN(Cc2ccccc2)CC[C@H]1CO	ZINC000819484875	EC	On-Demand	Anodyne	SIGMAR1	45	45
O=C(O)CCNC(=O)N[C@@H]1CN(Cc2ccccc2)CC[C@H]1CO	ZINC000819484875	EC	On-Demand	Anodyne	CCR3	39	41
O=C(O)CCNC(=O)N[C@@H]1CN(Cc2ccccc2)CC[C@H]1CO	ZINC000819484875	EC	On-Demand	Anodyne	MCHR1	18	42
O=C(O)CCNC(=O)NCC1(N2CCSCC2)CCCC1	ZINC000819484876	DD	On-Demand	Anodyne	HCN1	57	35
O=C(O)CCNC(=O)NCC1(N2CCSCC2)CCCC1	ZINC000819484876	DD	On-Demand	Anodyne	HCN4	55	35
COc1cc(NC[C@@H](O)c2cc(C)cc(C)c2)ccc1O	ZINC000819484879	CG	On-Demand	Anodyne	ADRB2	22	42
CNC(=O)COc1ccc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819484886	GD	On-Demand	Bother	CACNA1D	41	32
CNC(=O)COc1ccc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)c(C)c1	ZINC000819484887	GD	On-Demand	Bother	CACNA1D	41	32
CC(=O)Nc1cccc(CC(=O)N[C@@H]2CCCc3cn(C(C)C)nc32)c1	ZINC000819484903	FG	On-Demand	Anodyne	NPY1R	28	43
CC(=O)Nc1cccc(CC(=O)N[C@H]2CCCc3cn(C(C)C)nc32)c1	ZINC000819484904	FG	On-Demand	Anodyne	NPY1R	28	43
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](c1cccc2ccccc12)C(F)(F)F	ZINC000819484909	EI	On-Demand	Anodyne	KCNJ11	49	35
O=C(/C=C/[C@@H]1CCCO1)N[C@H](c1cccc2ccccc12)C(F)(F)F	ZINC000819484910	EI	On-Demand	Anodyne	KCNJ11	49	35
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](c1cccc2ccccc12)C(F)(F)F	ZINC000819484911	EI	On-Demand	Anodyne	KCNJ11	49	35
O=C(/C=C\[C@@H]1CCCO1)N[C@H](c1cccc2ccccc12)C(F)(F)F	ZINC000819484912	EI	On-Demand	Anodyne	KCNJ11	49	35
C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819484942	FE	On-Demand	Clean	FPR1	44	34
CNC(=O)COc1ccc(NCCS(C)(=O)=O)c(C)c1	ZINC000819484954	DC	On-Demand	Anodyne	MAOA	23	42
COC(=O)[C@@H]1CCCCCN1C(=O)C(F)=C1CCC1	ZINC000819484961	CE	On-Demand	Anodyne	FKBP1A	60	39
COC(=O)[C@@H]1CCCCCN1C(=O)C(F)=C1CCC1	ZINC000819484961	CE	On-Demand	Anodyne	PREP	15	44
COCCNC(=O)c1ccccc1NC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C	ZINC000819485005	IH	On-Demand	Anodyne	PDS	26	41
CNC(=O)COc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)c(C)c1	ZINC000819485058	GF	On-Demand	Anodyne	GRIN1	15	43
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)c(C)c1	ZINC000819485059	GF	On-Demand	Anodyne	GRIN1	15	43
COc1cc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1O	ZINC000819485071	FF	On-Demand	Anodyne	GPR119	47	46
COc1cc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1O	ZINC000819485071	FF	On-Demand	Anodyne	ENPP1	53	30
COc1cc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1O	ZINC000819485072	FF	On-Demand	Anodyne	GPR119	47	46
COc1cc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)ccc1O	ZINC000819485072	FF	On-Demand	Anodyne	ENPP1	53	30
COc1cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)c(OC)c1	ZINC000819485084	EG	On-Demand	Bother	CACNA1C	45	35
COc1cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)c(OC)c1	ZINC000819485084	EG	On-Demand	Bother	CACNA1D	69	35
COc1cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)c(OC)c1	ZINC000819485085	EG	On-Demand	Bother	CACNA1C	45	35
COc1cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)c(OC)c1	ZINC000819485085	EG	On-Demand	Bother	CACNA1D	69	35
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc(C3(O)COC3)cc2)CC1	ZINC000819485148	GE	On-Demand	Anodyne	GPR119	44	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc(C3(O)COC3)cc2)CC1	ZINC000819485149	GE	On-Demand	Anodyne	GPR119	44	43
C[C@H](O)c1cc(NC[C@H](O)COc2ccccc2Cl)ccc1F	ZINC000819485152	EG	On-Demand	Anodyne	ADRB2	26	46
C[C@H](O)c1cc(NC[C@H](O)COc2ccccc2Cl)ccc1F	ZINC000819485152	EG	On-Demand	Anodyne	ADRB1	52	34
C[C@H](O)c1cc(NC[C@@H](O)COc2ccccc2Cl)ccc1F	ZINC000819485154	EG	On-Demand	Anodyne	ADRB2	26	46
C[C@H](O)c1cc(NC[C@@H](O)COc2ccccc2Cl)ccc1F	ZINC000819485154	EG	On-Demand	Anodyne	ADRB1	52	34
C[C@H](O)c1cc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])ccc1F	ZINC000819485157	FF	On-Demand	Bother	ADRB2	19	42
C[C@H](O)c1cc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])ccc1F	ZINC000819485157	FF	On-Demand	Bother	ADRB1	56	35
C[C@H](O)c1cc(NC[C@H](O)COc2ccccc2[N+](=O)[O-])ccc1F	ZINC000819485157	FF	On-Demand	Bother	COLA	84	36
C[C@H](O)c1cc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])ccc1F	ZINC000819485159	FF	On-Demand	Bother	ADRB2	19	42
C[C@H](O)c1cc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])ccc1F	ZINC000819485159	FF	On-Demand	Bother	ADRB1	56	35
C[C@H](O)c1cc(NC[C@@H](O)COc2ccccc2[N+](=O)[O-])ccc1F	ZINC000819485159	FF	On-Demand	Bother	COLA	84	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCc3c(cccc3OC)C1)C2	ZINC000819485161	FE	On-Demand	Anodyne	SSTR1	57	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCc3c(cccc3OC)C1)C2	ZINC000819485162	FE	On-Demand	Anodyne	SSTR1	57	42
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819485172	FD	On-Demand	Anodyne	ADRB2	33	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819485172	FD	On-Demand	Anodyne	ADRB1	66	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819485172	FD	On-Demand	Anodyne	ADRB3	39	48
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819485173	FD	On-Demand	Anodyne	ADRB2	33	56
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819485173	FD	On-Demand	Anodyne	ADRB1	66	56
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819485173	FD	On-Demand	Anodyne	ADRB3	39	48
COc1cccc([S@@](=O)CC(=O)NCCn2ccnn2)c1	ZINC000819485186	DC	On-Demand	Anodyne	DRD4	44	33
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819485191	FF	On-Demand	Anodyne	ADRB2	38	45
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819485191	FF	On-Demand	Anodyne	ADRB1	62	41
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819485191	FF	On-Demand	Anodyne	ADRB3	32	41
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819485191	FF	On-Demand	Anodyne	GYS1	46	34
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819485192	FF	On-Demand	Anodyne	ADRB2	38	45
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819485192	FF	On-Demand	Anodyne	ADRB1	62	41
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819485192	FF	On-Demand	Anodyne	ADRB3	32	41
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819485192	FF	On-Demand	Anodyne	GYS1	46	34
C[C@@H]1COc2ccccc2CN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819485194	GG	On-Demand	Mild	PAPA1_CARPA	35	41
C[C@@H]1COc2ccccc2CN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819485196	GG	On-Demand	Mild	PAPA1_CARPA	35	41
CN(C)C(=O)CC1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819485220	GE	On-Demand	Mild	PAPA1_CARPA	32	42
CN(C)C(=O)CC1CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819485220	GE	On-Demand	Mild	CTSK	15	40
CN(C)C(=O)CC1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819485222	GE	On-Demand	Mild	PAPA1_CARPA	32	42
CN(C)C(=O)CC1CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819485222	GE	On-Demand	Mild	CTSK	15	40
CNC(=O)COc1ccc(NC[C@H](O)COc2ccccc2F)c(C)c1	ZINC000819485272	FE	On-Demand	Anodyne	ADRB2	23	41
CNC(=O)COc1ccc(NC[C@H](O)COc2ccccc2F)c(C)c1	ZINC000819485272	FE	On-Demand	Anodyne	ADRB1	46	36
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccccc2F)c(C)c1	ZINC000819485273	FE	On-Demand	Anodyne	ADRB2	23	41
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccccc2F)c(C)c1	ZINC000819485273	FE	On-Demand	Anodyne	ADRB1	46	36
CNC(=O)COc1ccc(NC[C@H](O)COc2cccc(C)c2)c(C)c1	ZINC000819485280	FE	On-Demand	Anodyne	ADRB2	24	52
CNC(=O)COc1ccc(NC[C@H](O)COc2cccc(C)c2)c(C)c1	ZINC000819485280	FE	On-Demand	Anodyne	ADRB1	23	52
CNC(=O)COc1ccc(NC[C@@H](O)COc2cccc(C)c2)c(C)c1	ZINC000819485281	FE	On-Demand	Anodyne	ADRB2	24	52
CNC(=O)COc1ccc(NC[C@@H](O)COc2cccc(C)c2)c(C)c1	ZINC000819485281	FE	On-Demand	Anodyne	ADRB1	23	52
COC(=O)[C@@H]1CCCCCN1C(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819485304	FD	On-Demand	Anodyne	PREP	18	43
COC(=O)[C@@H]1CCCCCN1C(=O)[C@@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2	ZINC000819485307	FD	On-Demand	Anodyne	PREP	18	43
CNC(=O)COc1ccc(NC[C@H](O)c2cccc(Br)c2)c(C)c1	ZINC000819485310	GG	On-Demand	Anodyne	ADRB1	15	46
CNC(=O)COc1ccc(NC[C@@H](O)c2cccc(Br)c2)c(C)c1	ZINC000819485311	GG	On-Demand	Anodyne	ADRB1	15	46
COc1cc(NCCC(=O)Nc2ccc(N(C)C)cc2)c(C)c(OC)c1	ZINC000819485314	FH	On-Demand	Anodyne	MTNR1B	17	48
CNC(=O)COc1ccc(NC[C@H](O)COc2ccc(C)cc2)c(C)c1	ZINC000819485317	FE	On-Demand	Anodyne	ADRB2	24	47
CNC(=O)COc1ccc(NC[C@H](O)COc2ccc(C)cc2)c(C)c1	ZINC000819485317	FE	On-Demand	Anodyne	ACOX1	48	33
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccc(C)cc2)c(C)c1	ZINC000819485318	FE	On-Demand	Anodyne	ADRB2	24	47
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccc(C)cc2)c(C)c1	ZINC000819485318	FE	On-Demand	Anodyne	ACOX1	48	33
C[C@H](O)c1cc(NC[C@@H](O)CN2CCc3ccccc3C2)ccc1F	ZINC000819485339	EF	On-Demand	Anodyne	NOD2	41	35
C[C@H](O)c1cc(NC[C@H](O)CN2CCc3ccccc3C2)ccc1F	ZINC000819485341	EF	On-Demand	Anodyne	NOD2	41	35
COCCc1ccc(OC[C@@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819485345	FG	On-Demand	Anodyne	ADRB2	39	58
COCCc1ccc(OC[C@@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819485345	FG	On-Demand	Anodyne	ADRB1	59	58
COCCc1ccc(OC[C@@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819485345	FG	On-Demand	Anodyne	GRIN1	20	42
COCCc1ccc(OC[C@@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819485345	FG	On-Demand	Anodyne	ADRB3	37	45
COCCc1ccc(OC[C@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819485346	FG	On-Demand	Anodyne	ADRB2	39	58
COCCc1ccc(OC[C@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819485346	FG	On-Demand	Anodyne	ADRB1	59	58
COCCc1ccc(OC[C@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819485346	FG	On-Demand	Anodyne	GRIN1	20	42
COCCc1ccc(OC[C@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819485346	FG	On-Demand	Anodyne	ADRB3	37	45
O[C@@H](CNc1ccc(C2(O)COC2)cc1)COc1ccccc1C(F)(F)F	ZINC000819485347	GF	On-Demand	Anodyne	ADRB1	48	33
O[C@H](CNc1ccc(C2(O)COC2)cc1)COc1ccccc1C(F)(F)F	ZINC000819485348	GF	On-Demand	Anodyne	ADRB1	48	33
COc1cc(F)c(F)cc1NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819485356	FF	On-Demand	Anodyne	PTGS2	28	44
COc1cc(F)c(F)cc1NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819485357	FF	On-Demand	Anodyne	PTGS2	28	44
COCCc1ccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819485362	FD	On-Demand	Anodyne	ADRB2	34	55
COCCc1ccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819485362	FD	On-Demand	Anodyne	ADRB1	62	55
COCCc1ccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819485362	FD	On-Demand	Anodyne	ADRB3	43	40
COCCc1ccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819485363	FD	On-Demand	Anodyne	ADRB2	34	55
COCCc1ccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819485363	FD	On-Demand	Anodyne	ADRB1	62	55
COCCc1ccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819485363	FD	On-Demand	Anodyne	ADRB3	43	40
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819485364	GF	On-Demand	Anodyne	ADRB1	16	41
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc2c(c1)CCC(=O)N2	ZINC000819485365	GF	On-Demand	Anodyne	ADRB1	16	41
O[C@@H](CNc1ccc(C2(O)COC2)cc1)COc1ccc(F)cc1	ZINC000819485372	ED	On-Demand	Anodyne	ADRB1	44	39
O[C@H](CNc1ccc(C2(O)COC2)cc1)COc1ccc(F)cc1	ZINC000819485373	ED	On-Demand	Anodyne	ADRB1	44	39
O[C@@H](CNc1ccc(C2(O)COC2)cc1)COc1cccc2[nH]ccc12	ZINC000819485396	FE	On-Demand	Anodyne	ADRB1	23	56
O[C@H](CNc1ccc(C2(O)COC2)cc1)COc1cccc2[nH]ccc12	ZINC000819485397	FE	On-Demand	Anodyne	ADRB1	23	56
O=C(/C=C\[C@H]1CCCO1)Nc1ncc(C2CCCCC2)s1	ZINC000819485402	DH	On-Demand	Anodyne	CDK5	54	46
O=C(/C=C/[C@H]1CCCO1)Nc1ncc(C2CCCCC2)s1	ZINC000819485403	DH	On-Demand	Anodyne	CDK5	54	46
O=C(/C=C/[C@@H]1CCCO1)Nc1ncc(C2CCCCC2)s1	ZINC000819485404	DH	On-Demand	Anodyne	CDK5	54	46
O=C(/C=C\[C@@H]1CCCO1)Nc1ncc(C2CCCCC2)s1	ZINC000819485405	DH	On-Demand	Anodyne	CDK5	54	46
CNC(=O)COc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)c(C)c1	ZINC000819485438	GE	On-Demand	Anodyne	ADRB2	17	44
CNC(=O)COc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)c(C)c1	ZINC000819485438	GE	On-Demand	Anodyne	ACOX1	40	32
CNC(=O)COc1ccc(NC[C@H](O)COc2cccc(C(C)=O)c2)c(C)c1	ZINC000819485438	GE	On-Demand	Anodyne	ABCB1	18	45
CNC(=O)COc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)c(C)c1	ZINC000819485439	GE	On-Demand	Anodyne	ADRB2	17	44
CNC(=O)COc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)c(C)c1	ZINC000819485439	GE	On-Demand	Anodyne	ACOX1	40	32
CNC(=O)COc1ccc(NC[C@@H](O)COc2cccc(C(C)=O)c2)c(C)c1	ZINC000819485439	GE	On-Demand	Anodyne	ABCB1	18	45
COc1cc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c(C)c(OC)c1	ZINC000819485449	FF	On-Demand	Anodyne	ADRB3	27	40
COc1cc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c(C)c(OC)c1	ZINC000819485450	FF	On-Demand	Anodyne	ADRB3	27	40
COc1cc(NC[C@H](O)c2cccc(Cl)c2)c(C)c(OC)c1	ZINC000819485457	DH	On-Demand	Anodyne	ADRB2	15	45
COc1cc(NC[C@H](O)c2cccc(Cl)c2)c(C)c(OC)c1	ZINC000819485457	DH	On-Demand	Anodyne	ADRB1	29	45
COc1cc(NC[C@H](O)c2cccc(Cl)c2)c(C)c(OC)c1	ZINC000819485457	DH	On-Demand	Anodyne	ADRB3	51	46
COc1cc(NC[C@H](O)c2cccc(Cl)c2)c(C)c(OC)c1	ZINC000819485457	DH	On-Demand	Anodyne	CYP3A4	48	37
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)c(C)c(OC)c1	ZINC000819485458	DH	On-Demand	Anodyne	ADRB2	15	45
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)c(C)c(OC)c1	ZINC000819485458	DH	On-Demand	Anodyne	ADRB1	29	45
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)c(C)c(OC)c1	ZINC000819485458	DH	On-Demand	Anodyne	ADRB3	51	46
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)c(C)c(OC)c1	ZINC000819485458	DH	On-Demand	Anodyne	CYP3A4	48	37
CNC(=O)COc1ccc(NC[C@H](O)COc2ccccc2Cl)c(C)c1	ZINC000819485472	GF	On-Demand	Anodyne	ADRB2	25	47
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccccc2Cl)c(C)c1	ZINC000819485473	GF	On-Demand	Anodyne	ADRB2	25	47
CNC(=O)COc1ccc(NC[C@H](O)COc2c(C)cccc2C)c(C)c1	ZINC000819485487	FF	On-Demand	Anodyne	ACOX1	41	35
CNC(=O)COc1ccc(NC[C@@H](O)COc2c(C)cccc2C)c(C)c1	ZINC000819485488	FF	On-Demand	Anodyne	ACOX1	41	35
CNC(=O)COc1ccc(NC[C@H](O)CN2CCOCC2)c(C)c1	ZINC000819485493	EC	On-Demand	Anodyne	ACOX1	68	35
CNC(=O)COc1ccc(NC[C@@H](O)CN2CCOCC2)c(C)c1	ZINC000819485494	EC	On-Demand	Anodyne	ACOX1	68	35
COc1cc(NCCC(=O)Nc2ccc(N(C)C)cc2)ccc1O	ZINC000819485505	EF	On-Demand	Anodyne	ENPP1	61	32
COc1cc(NC[C@H](O)c2cccnc2)c(C)c(OC)c1	ZINC000819485537	CF	On-Demand	Anodyne	ADRB2	15	40
COc1cc(NC[C@H](O)c2cccnc2)c(C)c(OC)c1	ZINC000819485537	CF	On-Demand	Anodyne	ADRB1	18	44
COc1cc(NC[C@H](O)c2cccnc2)c(C)c(OC)c1	ZINC000819485537	CF	On-Demand	Anodyne	ADRB3	50	44
COc1cc(NC[C@@H](O)c2cccnc2)c(C)c(OC)c1	ZINC000819485539	CF	On-Demand	Anodyne	ADRB2	15	40
COc1cc(NC[C@@H](O)c2cccnc2)c(C)c(OC)c1	ZINC000819485539	CF	On-Demand	Anodyne	ADRB1	18	44
COc1cc(NC[C@@H](O)c2cccnc2)c(C)c(OC)c1	ZINC000819485539	CF	On-Demand	Anodyne	ADRB3	50	44
O[C@@H](CNc1ccc(C2(O)COC2)cc1)COc1cccc(C(F)(F)F)c1	ZINC000819485547	GF	On-Demand	Anodyne	PDS	46	43
O[C@H](CNc1ccc(C2(O)COC2)cc1)COc1cccc(C(F)(F)F)c1	ZINC000819485548	GF	On-Demand	Anodyne	PDS	46	43
O=C(CCNc1ccc(C2(O)COC2)cc1)Nc1cccnc1	ZINC000819485564	DD	On-Demand	Anodyne	NAMPT	27	41
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819485581	FF	On-Demand	Anodyne	ADRB2	43	56
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819485581	FF	On-Demand	Anodyne	ADRB1	75	56
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819485581	FF	On-Demand	Anodyne	TSHR	66	37
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819485581	FF	On-Demand	Anodyne	GRIN1	24	42
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819485581	FF	On-Demand	Anodyne	ADRB3	47	48
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819485581	FF	On-Demand	Anodyne	GYS1	41	33
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819485581	FF	On-Demand	Anodyne	PDGFRA	51	38
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819485582	FF	On-Demand	Anodyne	ADRB2	43	56
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819485582	FF	On-Demand	Anodyne	ADRB1	75	56
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819485582	FF	On-Demand	Anodyne	TSHR	66	37
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819485582	FF	On-Demand	Anodyne	GRIN1	24	42
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819485582	FF	On-Demand	Anodyne	ADRB3	47	48
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819485582	FF	On-Demand	Anodyne	GYS1	41	33
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(NC(C)=O)cc1	ZINC000819485582	FF	On-Demand	Anodyne	PDGFRA	51	38
C[C@H](O)c1cc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)ccc1F	ZINC000819485586	FF	On-Demand	Bother	ADRB2	18	45
C[C@H](O)c1cc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)ccc1F	ZINC000819485586	FF	On-Demand	Bother	ADRB1	25	45
C[C@H](O)c1cc(NC[C@H](O)COc2cccc([N+](=O)[O-])c2)ccc1F	ZINC000819485586	FF	On-Demand	Bother	PDS	43	46
C[C@H](O)c1cc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)ccc1F	ZINC000819485588	FF	On-Demand	Bother	ADRB2	18	45
C[C@H](O)c1cc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)ccc1F	ZINC000819485588	FF	On-Demand	Bother	ADRB1	25	45
C[C@H](O)c1cc(NC[C@@H](O)COc2cccc([N+](=O)[O-])c2)ccc1F	ZINC000819485588	FF	On-Demand	Bother	PDS	43	46
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)c1	ZINC000819485610	FD	On-Demand	Anodyne	ADRB2	20	42
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)c1	ZINC000819485610	FD	On-Demand	Anodyne	ABCB1	16	46
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)c1	ZINC000819485611	FD	On-Demand	Anodyne	ADRB2	20	42
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)c1	ZINC000819485611	FD	On-Demand	Anodyne	ABCB1	16	46
COc1cc(F)c(F)cc1NC[C@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819485650	GH	On-Demand	Anodyne	GPR119	31	42
COc1cc(F)c(F)cc1NC[C@@]1(O)CCCN(C(=O)OC(C)(C)C)CC1	ZINC000819485652	GH	On-Demand	Anodyne	GPR119	31	42
O[C@@H](CNc1ccc(C2(O)COC2)cc1)CN1CCc2ccccc2C1	ZINC000819485684	FD	On-Demand	Anodyne	NOD2	40	34
O[C@H](CNc1ccc(C2(O)COC2)cc1)CN1CCc2ccccc2C1	ZINC000819485685	FD	On-Demand	Anodyne	NOD2	40	34
COc1cc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)ccc1O	ZINC000819485694	EH	On-Demand	Anodyne	ADRB2	22	44
COc1cc(NC[C@H](O)c2ccc(C(F)(F)F)cc2)ccc1O	ZINC000819485694	EH	On-Demand	Anodyne	ADRB3	17	41
COc1cc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)ccc1O	ZINC000819485697	EH	On-Demand	Anodyne	ADRB2	22	44
COc1cc(NC[C@@H](O)c2ccc(C(F)(F)F)cc2)ccc1O	ZINC000819485697	EH	On-Demand	Anodyne	ADRB3	17	41
CNC(=O)COc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)c(C)c1	ZINC000819485699	GG	On-Demand	Anodyne	PDS	40	34
CNC(=O)COc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)c(C)c1	ZINC000819485701	GG	On-Demand	Anodyne	PDS	40	34
COCCNC(=O)c1ccccc1NC(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12	ZINC000819485707	JJ	On-Demand	Anodyne	TSPO	28	43
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485724	GG	On-Demand	Anodyne	ADRB2	45	45
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485724	GG	On-Demand	Anodyne	ADRB1	74	48
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485724	GG	On-Demand	Anodyne	GRIN1	28	46
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485724	GG	On-Demand	Anodyne	ADRB3	49	45
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485726	GG	On-Demand	Anodyne	ADRB2	45	45
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485726	GG	On-Demand	Anodyne	ADRB1	74	48
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485726	GG	On-Demand	Anodyne	GRIN1	28	46
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485726	GG	On-Demand	Anodyne	ADRB3	49	45
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485727	GG	On-Demand	Anodyne	ADRB2	45	45
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485727	GG	On-Demand	Anodyne	ADRB1	74	48
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485727	GG	On-Demand	Anodyne	GRIN1	28	46
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485727	GG	On-Demand	Anodyne	ADRB3	49	45
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485729	GG	On-Demand	Anodyne	ADRB2	45	45
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485729	GG	On-Demand	Anodyne	ADRB1	74	48
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485729	GG	On-Demand	Anodyne	GRIN1	28	46
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485729	GG	On-Demand	Anodyne	ADRB3	49	45
Cc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485777	DG	On-Demand	Anodyne	ADRB2	34	53
Cc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485777	DG	On-Demand	Anodyne	ADRB1	48	43
Cc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485777	DG	On-Demand	Anodyne	GRIN1	19	42
Cc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485777	DG	On-Demand	Anodyne	ADRB3	25	40
Cc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485780	DG	On-Demand	Anodyne	ADRB2	34	53
Cc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485780	DG	On-Demand	Anodyne	ADRB1	48	43
Cc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485780	DG	On-Demand	Anodyne	GRIN1	19	42
Cc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485780	DG	On-Demand	Anodyne	ADRB3	25	40
Cc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485781	DG	On-Demand	Anodyne	ADRB2	34	53
Cc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485781	DG	On-Demand	Anodyne	ADRB1	48	43
Cc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485781	DG	On-Demand	Anodyne	GRIN1	19	42
Cc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485781	DG	On-Demand	Anodyne	ADRB3	25	40
Cc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485782	DG	On-Demand	Anodyne	ADRB2	34	53
Cc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485782	DG	On-Demand	Anodyne	ADRB1	48	43
Cc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485782	DG	On-Demand	Anodyne	GRIN1	19	42
Cc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485782	DG	On-Demand	Anodyne	ADRB3	25	40
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(Cl)cc2)ccc1F	ZINC000819485796	EG	On-Demand	Anodyne	ADRB2	39	43
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(Cl)cc2)ccc1F	ZINC000819485796	EG	On-Demand	Anodyne	ADRB1	56	43
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(Cl)cc2)ccc1F	ZINC000819485796	EG	On-Demand	Anodyne	GRIN1	27	45
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(Cl)cc2)ccc1F	ZINC000819485796	EG	On-Demand	Anodyne	ADRB3	31	40
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(Cl)cc2)ccc1F	ZINC000819485796	EG	On-Demand	Anodyne	CDK4	16	40
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(Cl)cc2)ccc1F	ZINC000819485800	EG	On-Demand	Anodyne	ADRB2	39	43
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(Cl)cc2)ccc1F	ZINC000819485800	EG	On-Demand	Anodyne	ADRB1	56	43
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(Cl)cc2)ccc1F	ZINC000819485800	EG	On-Demand	Anodyne	GRIN1	27	45
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(Cl)cc2)ccc1F	ZINC000819485800	EG	On-Demand	Anodyne	ADRB3	31	40
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(Cl)cc2)ccc1F	ZINC000819485800	EG	On-Demand	Anodyne	CDK4	16	40
COc1cc(F)c(F)cc1NCCC(=O)Nc1ccc(N(C)C)cc1	ZINC000819485802	EG	On-Demand	Anodyne	MTNR1B	17	47
C[C@H](O)c1cc(NC[C@@H](O)COc2cccc3[nH]ccc23)ccc1F	ZINC000819485804	EG	On-Demand	Anodyne	ADRB2	19	61
C[C@H](O)c1cc(NC[C@@H](O)COc2cccc3[nH]ccc23)ccc1F	ZINC000819485804	EG	On-Demand	Anodyne	ADRB1	35	61
C[C@H](O)c1cc(NC[C@@H](O)COc2cccc3[nH]ccc23)ccc1F	ZINC000819485804	EG	On-Demand	Anodyne	HTR1A	15	61
C[C@H](O)c1cc(NC[C@@H](O)COc2cccc3[nH]ccc23)ccc1F	ZINC000819485804	EG	On-Demand	Anodyne	SLC6A4	17	42
C[C@H](O)c1cc(NC[C@@H](O)COc2cccc3[nH]ccc23)ccc1F	ZINC000819485804	EG	On-Demand	Anodyne	CYP2D6	15	41
C[C@H](O)c1cc(NC[C@H](O)COc2cccc3[nH]ccc23)ccc1F	ZINC000819485807	EG	On-Demand	Anodyne	ADRB2	19	61
C[C@H](O)c1cc(NC[C@H](O)COc2cccc3[nH]ccc23)ccc1F	ZINC000819485807	EG	On-Demand	Anodyne	ADRB1	35	61
C[C@H](O)c1cc(NC[C@H](O)COc2cccc3[nH]ccc23)ccc1F	ZINC000819485807	EG	On-Demand	Anodyne	HTR1A	15	61
C[C@H](O)c1cc(NC[C@H](O)COc2cccc3[nH]ccc23)ccc1F	ZINC000819485807	EG	On-Demand	Anodyne	SLC6A4	17	42
C[C@H](O)c1cc(NC[C@H](O)COc2cccc3[nH]ccc23)ccc1F	ZINC000819485807	EG	On-Demand	Anodyne	CYP2D6	15	41
COc1cc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)ccc1O	ZINC000819485832	EG	On-Demand	Anodyne	ADRB2	27	47
COc1cc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)ccc1O	ZINC000819485832	EG	On-Demand	Anodyne	ADRB3	20	42
COc1cc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)ccc1O	ZINC000819485833	EG	On-Demand	Anodyne	ADRB2	27	47
COc1cc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)ccc1O	ZINC000819485833	EG	On-Demand	Anodyne	ADRB3	20	42
CNC(=O)COc1ccc(NC[C@H](O)COc2ccccc2C)c(C)c1	ZINC000819485844	FE	On-Demand	Anodyne	ADRB2	27	49
CNC(=O)COc1ccc(NC[C@H](O)COc2ccccc2C)c(C)c1	ZINC000819485844	FE	On-Demand	Anodyne	ADRB1	40	34
CNC(=O)COc1ccc(NC[C@H](O)COc2ccccc2C)c(C)c1	ZINC000819485844	FE	On-Demand	Anodyne	CYP2D6	15	41
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccccc2C)c(C)c1	ZINC000819485845	FE	On-Demand	Anodyne	ADRB2	27	49
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccccc2C)c(C)c1	ZINC000819485845	FE	On-Demand	Anodyne	ADRB1	40	34
CNC(=O)COc1ccc(NC[C@@H](O)COc2ccccc2C)c(C)c1	ZINC000819485845	FE	On-Demand	Anodyne	CYP2D6	15	41
Cc1cc2c(cc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)OCO2	ZINC000819485855	GG	On-Demand	Mild	PAPA1_CARPA	39	43
Cc1cc2c(cc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)OCO2	ZINC000819485856	GG	On-Demand	Mild	PAPA1_CARPA	39	43
CNC(=O)COc1ccc(NC[C@H](O)COc2cc(C)cc(C)c2)c(C)c1	ZINC000819485863	FF	On-Demand	Anodyne	ADRB2	17	46
CNC(=O)COc1ccc(NC[C@@H](O)COc2cc(C)cc(C)c2)c(C)c1	ZINC000819485864	FF	On-Demand	Anodyne	ADRB2	17	46
O[C@@H](CNc1ccc(C2(O)COC2)cc1)c1cccc(Cl)c1	ZINC000819485882	DF	On-Demand	Anodyne	ADRB1	25	47
O[C@@H](CNc1ccc(C2(O)COC2)cc1)c1cccc(Cl)c1	ZINC000819485882	DF	On-Demand	Anodyne	ADRB3	38	42
O[C@@H](CNc1ccc(C2(O)COC2)cc1)c1cccc(Cl)c1	ZINC000819485882	DF	On-Demand	Anodyne	CYP3A4	41	35
O[C@H](CNc1ccc(C2(O)COC2)cc1)c1cccc(Cl)c1	ZINC000819485883	DF	On-Demand	Anodyne	ADRB1	25	47
O[C@H](CNc1ccc(C2(O)COC2)cc1)c1cccc(Cl)c1	ZINC000819485883	DF	On-Demand	Anodyne	ADRB3	38	42
O[C@H](CNc1ccc(C2(O)COC2)cc1)c1cccc(Cl)c1	ZINC000819485883	DF	On-Demand	Anodyne	CYP3A4	41	35
O[C@@H](CNc1ccc(C2(O)COC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819485884	GG	On-Demand	Anodyne	GRIN1	27	40
O[C@H](CNc1ccc(C2(O)COC2)cc1)COc1ccc(Cl)c(Cl)c1	ZINC000819485885	GG	On-Demand	Anodyne	GRIN1	27	40
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(F)cc2)ccc1F	ZINC000819485905	DF	On-Demand	Anodyne	ADRB2	41	43
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(F)cc2)ccc1F	ZINC000819485905	DF	On-Demand	Anodyne	ADRB1	59	43
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(F)cc2)ccc1F	ZINC000819485905	DF	On-Demand	Anodyne	GRIN1	20	45
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(F)cc2)ccc1F	ZINC000819485905	DF	On-Demand	Anodyne	ADRB3	31	40
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(F)cc2)ccc1F	ZINC000819485907	DF	On-Demand	Anodyne	ADRB2	41	43
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(F)cc2)ccc1F	ZINC000819485907	DF	On-Demand	Anodyne	ADRB1	59	43
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(F)cc2)ccc1F	ZINC000819485907	DF	On-Demand	Anodyne	GRIN1	20	45
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(F)cc2)ccc1F	ZINC000819485907	DF	On-Demand	Anodyne	ADRB3	31	40
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485915	FF	On-Demand	Anodyne	ADRB2	38	60
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485915	FF	On-Demand	Anodyne	ADRB1	71	60
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485915	FF	On-Demand	Anodyne	GRIN1	25	42
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485915	FF	On-Demand	Anodyne	ADRB3	41	49
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485916	FF	On-Demand	Anodyne	ADRB2	38	60
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485916	FF	On-Demand	Anodyne	ADRB1	71	60
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485916	FF	On-Demand	Anodyne	GRIN1	25	42
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819485916	FF	On-Demand	Anodyne	ADRB3	41	49
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485917	FF	On-Demand	Anodyne	ADRB2	38	60
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485917	FF	On-Demand	Anodyne	ADRB1	71	60
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485917	FF	On-Demand	Anodyne	GRIN1	25	42
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485917	FF	On-Demand	Anodyne	ADRB3	41	49
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485918	FF	On-Demand	Anodyne	ADRB2	38	60
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485918	FF	On-Demand	Anodyne	ADRB1	71	60
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485918	FF	On-Demand	Anodyne	GRIN1	25	42
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819485918	FF	On-Demand	Anodyne	ADRB3	41	49
O=C(CCNc1ccc(C2(O)COC2)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819485925	GG	On-Demand	Anodyne	LCK	24	40
O=C(CCNc1ccc(C2(O)COC2)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819485925	GG	On-Demand	Anodyne	KDR	15	41
O=C(CCNc1ccc(C2(O)COC2)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819485925	GG	On-Demand	Anodyne	EPHX2	15	41
O=C(CCNc1ccc(C2(O)COC2)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819485925	GG	On-Demand	Anodyne	BTK	17	40
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(CC#N)cc2)ccc1F	ZINC000819485959	EF	On-Demand	Mild	ADRB2	33	40
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(CC#N)cc2)ccc1F	ZINC000819485959	EF	On-Demand	Mild	ADRB1	52	40
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(CC#N)cc2)ccc1F	ZINC000819485959	EF	On-Demand	Mild	GRIN1	23	43
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(CC#N)cc2)ccc1F	ZINC000819485962	EF	On-Demand	Mild	ADRB2	33	40
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(CC#N)cc2)ccc1F	ZINC000819485962	EF	On-Demand	Mild	ADRB1	52	40
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(CC#N)cc2)ccc1F	ZINC000819485962	EF	On-Demand	Mild	GRIN1	23	43
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(Cl)cc2Cl)ccc1F	ZINC000819486030	FI	On-Demand	Anodyne	ADRB2	15	43
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(Cl)cc2Cl)ccc1F	ZINC000819486031	FI	On-Demand	Anodyne	ADRB2	15	43
C[C@H](O)c1cc(NC[C@@H](O)COC(c2ccccc2)c2ccccc2)ccc1F	ZINC000819486048	GI	On-Demand	Anodyne	CASR	23	45
C[C@H](O)c1cc(NC[C@H](O)COC(c2ccccc2)c2ccccc2)ccc1F	ZINC000819486050	GI	On-Demand	Anodyne	CASR	23	45
O[C@@H](CNc1ccc(C2(O)COC2)cc1)COc1cccc2ccccc12	ZINC000819486072	FF	On-Demand	Anodyne	ADRB2	22	51
O[C@@H](CNc1ccc(C2(O)COC2)cc1)COc1cccc2ccccc12	ZINC000819486072	FF	On-Demand	Anodyne	ADRB1	54	37
O[C@@H](CNc1ccc(C2(O)COC2)cc1)COc1cccc2ccccc12	ZINC000819486072	FF	On-Demand	Anodyne	CYP2D6	16	42
O[C@H](CNc1ccc(C2(O)COC2)cc1)COc1cccc2ccccc12	ZINC000819486073	FF	On-Demand	Anodyne	ADRB2	22	51
O[C@H](CNc1ccc(C2(O)COC2)cc1)COc1cccc2ccccc12	ZINC000819486073	FF	On-Demand	Anodyne	ADRB1	54	37
O[C@H](CNc1ccc(C2(O)COC2)cc1)COc1cccc2ccccc12	ZINC000819486073	FF	On-Demand	Anodyne	CYP2D6	16	42
COc1cccc(OC)c1OC[C@H](O)CNc1ccc(F)c([C@H](C)O)c1	ZINC000819486091	FF	On-Demand	Anodyne	ADRB2	25	40
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc(F)c([C@H](C)O)c1	ZINC000819486092	FF	On-Demand	Anodyne	ADRB2	25	40
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc(F)c([C@@H](C)O)c1	ZINC000819486093	FF	On-Demand	Anodyne	ADRB2	25	40
COc1cccc(OC)c1OC[C@H](O)CNc1ccc(F)c([C@@H](C)O)c1	ZINC000819486094	FF	On-Demand	Anodyne	ADRB2	25	40
O=C(CCNc1ccc(C2(O)COC2)cc1)Nc1cccc(Br)c1	ZINC000819486099	GG	On-Demand	Anodyne	EGFR	30	40
C[C@H](O)c1cc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)ccc1F	ZINC000819486105	FH	On-Demand	Anodyne	ADRB2	21	41
C[C@H](O)c1cc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)ccc1F	ZINC000819486105	FH	On-Demand	Anodyne	ADRB1	29	41
C[C@H](O)c1cc(NC[C@H](O)COc2cccc(C(F)(F)F)c2)ccc1F	ZINC000819486105	FH	On-Demand	Anodyne	PDS	74	47
C[C@H](O)c1cc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)ccc1F	ZINC000819486107	FH	On-Demand	Anodyne	ADRB2	21	41
C[C@H](O)c1cc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)ccc1F	ZINC000819486107	FH	On-Demand	Anodyne	ADRB1	29	41
C[C@H](O)c1cc(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)ccc1F	ZINC000819486107	FH	On-Demand	Anodyne	PDS	74	47
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccc(C2(O)COC2)cc1	ZINC000819486115	FD	On-Demand	Bother	ADRB1	52	33
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccc(C2(O)COC2)cc1	ZINC000819486116	FD	On-Demand	Bother	ADRB1	52	33
O[C@@H](CNc1ccc(C2(O)COC2)cc1)COc1ccc2ccccc2c1	ZINC000819486125	FF	On-Demand	Anodyne	ADRB2	24	51
O[C@H](CNc1ccc(C2(O)COC2)cc1)COc1ccc2ccccc2c1	ZINC000819486126	FF	On-Demand	Anodyne	ADRB2	24	51
C=CCCn1cc(C(=O)Nc2ccc(N3CCCCCCC3)c(F)c2)nn1	ZINC000819486137	FI	On-Demand	Mild	NPY2R	75	35
CCOc1ccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486157	FE	On-Demand	Anodyne	ADRB2	29	40
CCOc1ccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486157	FE	On-Demand	Anodyne	ADRB1	43	39
CCOc1ccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486158	FE	On-Demand	Anodyne	ADRB2	29	40
CCOc1ccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486158	FE	On-Demand	Anodyne	ADRB1	43	39
C[C@H](O)c1cc(NC[C@H](O)COc2ccccc2C(F)(F)F)ccc1F	ZINC000819486159	FH	On-Demand	Anodyne	ADRB2	25	45
C[C@H](O)c1cc(NC[C@H](O)COc2ccccc2C(F)(F)F)ccc1F	ZINC000819486159	FH	On-Demand	Anodyne	ADRB1	52	35
C[C@H](O)c1cc(NC[C@@H](O)COc2ccccc2C(F)(F)F)ccc1F	ZINC000819486161	FH	On-Demand	Anodyne	ADRB2	25	45
C[C@H](O)c1cc(NC[C@@H](O)COc2ccccc2C(F)(F)F)ccc1F	ZINC000819486161	FH	On-Demand	Anodyne	ADRB1	52	35
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486185	FD	On-Demand	Anodyne	ADRB2	27	45
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486185	FD	On-Demand	Anodyne	ADRB1	52	45
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486186	FD	On-Demand	Anodyne	ADRB2	27	45
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486186	FD	On-Demand	Anodyne	ADRB1	52	45
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(C#N)cc2)ccc1F	ZINC000819486219	EF	On-Demand	Mild	ADRB2	27	40
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(C#N)cc2)ccc1F	ZINC000819486219	EF	On-Demand	Mild	ADRB1	42	39
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(C#N)cc2)ccc1F	ZINC000819486220	EF	On-Demand	Mild	ADRB2	27	40
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(C#N)cc2)ccc1F	ZINC000819486220	EF	On-Demand	Mild	ADRB1	42	39
CCOc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486237	EG	On-Demand	Anodyne	ADRB2	37	43
CCOc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486237	EG	On-Demand	Anodyne	ADRB1	52	43
CCOc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486237	EG	On-Demand	Anodyne	GRIN1	20	43
CCOc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486238	EG	On-Demand	Anodyne	ADRB2	37	43
CCOc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486238	EG	On-Demand	Anodyne	ADRB1	52	43
CCOc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486238	EG	On-Demand	Anodyne	GRIN1	20	43
CCOc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486239	EG	On-Demand	Anodyne	ADRB2	37	43
CCOc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486239	EG	On-Demand	Anodyne	ADRB1	52	43
CCOc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486239	EG	On-Demand	Anodyne	GRIN1	20	43
CCOc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486240	EG	On-Demand	Anodyne	ADRB2	37	43
CCOc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486240	EG	On-Demand	Anodyne	ADRB1	52	43
CCOc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486240	EG	On-Demand	Anodyne	GRIN1	20	43
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819486241	FF	On-Demand	Bother	ADRB1	46	36
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000819486242	FF	On-Demand	Bother	ADRB1	46	36
C[C@H](O)c1cc(NCCC(=O)Nc2cccc(C(F)(F)F)c2)ccc1F	ZINC000819486250	FI	On-Demand	Anodyne	SLC1A1	28	40
C[C@H](O)c1cc(NCCC(=O)Nc2cccc(C(F)(F)F)c2)ccc1F	ZINC000819486250	FI	On-Demand	Anodyne	SLC1A3	23	40
C[C@H](O)c1cc(NCCC(=O)Nc2cccc(C(F)(F)F)c2)ccc1F	ZINC000819486250	FI	On-Demand	Anodyne	SLC1A2	38	42
O[C@@H](CNc1ccc(C2(O)COC2)cc1)COc1ccccc1F	ZINC000819486279	ED	On-Demand	Anodyne	ADRB1	54	37
O[C@H](CNc1ccc(C2(O)COC2)cc1)COc1ccccc1F	ZINC000819486280	ED	On-Demand	Anodyne	ADRB1	54	37
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486314	GE	On-Demand	Anodyne	ADRB2	36	45
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486314	GE	On-Demand	Anodyne	ADRB1	68	45
CC(=O)CCc1ccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486314	GE	On-Demand	Anodyne	ADRB3	47	45
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486315	GE	On-Demand	Anodyne	ADRB2	36	45
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486315	GE	On-Demand	Anodyne	ADRB1	68	45
CC(=O)CCc1ccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486315	GE	On-Demand	Anodyne	ADRB3	47	45
COc1cc(F)c(F)cc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819486323	GG	On-Demand	Anodyne	GPR119	51	52
COc1cc(F)c(F)cc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819486324	GG	On-Demand	Anodyne	GPR119	51	52
O[C@H](CNc1ccc(C2(O)COC2)cc1)COc1ccc(-c2ccccc2)cc1	ZINC000819486345	GG	On-Demand	Anodyne	ADRB2	36	40
O[C@H](CNc1ccc(C2(O)COC2)cc1)COc1ccc(-c2ccccc2)cc1	ZINC000819486345	GG	On-Demand	Anodyne	ADRB1	56	38
O[C@@H](CNc1ccc(C2(O)COC2)cc1)COc1ccc(-c2ccccc2)cc1	ZINC000819486346	GG	On-Demand	Anodyne	ADRB2	36	40
O[C@@H](CNc1ccc(C2(O)COC2)cc1)COc1ccc(-c2ccccc2)cc1	ZINC000819486346	GG	On-Demand	Anodyne	ADRB1	56	38
COc1cc(F)c(F)cc1NC[C@H](O)Cc1ccccc1	ZINC000819486348	CF	On-Demand	Anodyne	ADRB3	15	40
COc1cc(F)c(F)cc1NC[C@@H](O)Cc1ccccc1	ZINC000819486349	CF	On-Demand	Anodyne	ADRB3	15	40
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486353	FF	On-Demand	Anodyne	ADRB2	40	46
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486353	FF	On-Demand	Anodyne	ADRB1	68	45
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486353	FF	On-Demand	Anodyne	GRIN1	20	44
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486353	FF	On-Demand	Anodyne	ADRB3	40	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486354	FF	On-Demand	Anodyne	ADRB2	40	46
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486354	FF	On-Demand	Anodyne	ADRB1	68	45
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486354	FF	On-Demand	Anodyne	GRIN1	20	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486354	FF	On-Demand	Anodyne	ADRB3	40	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486355	FF	On-Demand	Anodyne	ADRB2	40	46
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486355	FF	On-Demand	Anodyne	ADRB1	68	45
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486355	FF	On-Demand	Anodyne	GRIN1	20	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486355	FF	On-Demand	Anodyne	ADRB3	40	44
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486356	FF	On-Demand	Anodyne	ADRB2	40	46
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486356	FF	On-Demand	Anodyne	ADRB1	68	45
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486356	FF	On-Demand	Anodyne	GRIN1	20	44
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486356	FF	On-Demand	Anodyne	ADRB3	40	44
C[C@H](O)c1cc(NC[C@H](O)COc2cccc(Br)c2)ccc1F	ZINC000819486391	GG	On-Demand	Anodyne	ADRB2	24	43
C[C@H](O)c1cc(NC[C@H](O)COc2cccc(Br)c2)ccc1F	ZINC000819486391	GG	On-Demand	Anodyne	ADRB1	31	43
C[C@H](O)c1cc(NC[C@H](O)COc2cccc(Br)c2)ccc1F	ZINC000819486391	GG	On-Demand	Anodyne	PDS	66	41
C[C@H](O)c1cc(NC[C@@H](O)COc2cccc(Br)c2)ccc1F	ZINC000819486393	GG	On-Demand	Anodyne	ADRB2	24	43
C[C@H](O)c1cc(NC[C@@H](O)COc2cccc(Br)c2)ccc1F	ZINC000819486393	GG	On-Demand	Anodyne	ADRB1	31	43
C[C@H](O)c1cc(NC[C@@H](O)COc2cccc(Br)c2)ccc1F	ZINC000819486393	GG	On-Demand	Anodyne	PDS	66	41
O[C@@H](CNc1ccc(C2(O)COC2)cc1)COc1ccccc1Cl	ZINC000819486394	EE	On-Demand	Anodyne	ADRB1	48	32
O[C@H](CNc1ccc(C2(O)COC2)cc1)COc1ccccc1Cl	ZINC000819486395	EE	On-Demand	Anodyne	ADRB1	48	32
C[C@H](O)c1cc(NC[C@@H](O)COc2ccccc2)ccc1F	ZINC000819486400	DF	On-Demand	Anodyne	ADRB2	50	54
C[C@H](O)c1cc(NC[C@@H](O)COc2ccccc2)ccc1F	ZINC000819486400	DF	On-Demand	Anodyne	ADRB1	70	44
C[C@H](O)c1cc(NC[C@@H](O)COc2ccccc2)ccc1F	ZINC000819486400	DF	On-Demand	Anodyne	GRIN1	17	42
C[C@H](O)c1cc(NC[C@@H](O)COc2ccccc2)ccc1F	ZINC000819486400	DF	On-Demand	Anodyne	ADRB3	41	44
C[C@H](O)c1cc(NC[C@@H](O)COc2ccccc2)ccc1F	ZINC000819486400	DF	On-Demand	Anodyne	CASR	27	41
C[C@H](O)c1cc(NC[C@@H](O)COc2ccccc2)ccc1F	ZINC000819486400	DF	On-Demand	Anodyne	CDK4	15	41
C[C@H](O)c1cc(NC[C@@H](O)COc2ccccc2)ccc1F	ZINC000819486400	DF	On-Demand	Anodyne	PDS	70	36
C[C@H](O)c1cc(NC[C@H](O)COc2ccccc2)ccc1F	ZINC000819486401	DF	On-Demand	Anodyne	ADRB2	50	54
C[C@H](O)c1cc(NC[C@H](O)COc2ccccc2)ccc1F	ZINC000819486401	DF	On-Demand	Anodyne	ADRB1	70	44
C[C@H](O)c1cc(NC[C@H](O)COc2ccccc2)ccc1F	ZINC000819486401	DF	On-Demand	Anodyne	GRIN1	17	42
C[C@H](O)c1cc(NC[C@H](O)COc2ccccc2)ccc1F	ZINC000819486401	DF	On-Demand	Anodyne	ADRB3	41	44
C[C@H](O)c1cc(NC[C@H](O)COc2ccccc2)ccc1F	ZINC000819486401	DF	On-Demand	Anodyne	CASR	27	41
C[C@H](O)c1cc(NC[C@H](O)COc2ccccc2)ccc1F	ZINC000819486401	DF	On-Demand	Anodyne	CDK4	15	41
C[C@H](O)c1cc(NC[C@H](O)COc2ccccc2)ccc1F	ZINC000819486401	DF	On-Demand	Anodyne	PDS	70	36
COc1cc(F)c(F)cc1NC[C@H](O)CCc1ccccc1	ZINC000819486404	DG	On-Demand	Anodyne	GYS1	42	33
COc1cc(F)c(F)cc1NC[C@@H](O)CCc1ccccc1	ZINC000819486405	DG	On-Demand	Anodyne	GYS1	42	33
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)ccc1F	ZINC000819486408	FI	On-Demand	Anodyne	ADRB2	27	41
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)ccc1F	ZINC000819486408	FI	On-Demand	Anodyne	ADRB1	30	41
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)ccc1F	ZINC000819486408	FI	On-Demand	Anodyne	GRIN1	31	45
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)ccc1F	ZINC000819486408	FI	On-Demand	Anodyne	CDK4	15	40
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)ccc1F	ZINC000819486408	FI	On-Demand	Anodyne	PDS	22	40
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)ccc1F	ZINC000819486409	FI	On-Demand	Anodyne	ADRB2	27	41
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)ccc1F	ZINC000819486409	FI	On-Demand	Anodyne	ADRB1	30	41
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)ccc1F	ZINC000819486409	FI	On-Demand	Anodyne	GRIN1	31	45
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)ccc1F	ZINC000819486409	FI	On-Demand	Anodyne	CDK4	15	40
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(Cl)c(Cl)c2)ccc1F	ZINC000819486409	FI	On-Demand	Anodyne	PDS	22	40
C[C@H](O)c1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1F	ZINC000819486414	DH	On-Demand	Anodyne	ADRB2	16	51
C[C@H](O)c1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1F	ZINC000819486414	DH	On-Demand	Anodyne	ADRB1	29	51
C[C@H](O)c1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1F	ZINC000819486414	DH	On-Demand	Anodyne	ADRB3	42	43
C[C@H](O)c1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1F	ZINC000819486415	DH	On-Demand	Anodyne	ADRB2	16	51
C[C@H](O)c1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1F	ZINC000819486415	DH	On-Demand	Anodyne	ADRB1	29	51
C[C@H](O)c1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1F	ZINC000819486415	DH	On-Demand	Anodyne	ADRB3	42	43
C[C@H](O)c1cc(NCCS(=O)(=O)c2ccc(C(C)(C)C)cc2)ccc1F	ZINC000819486423	GI	On-Demand	Anodyne	CYNT	41	56
Cc1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)c(C)c1	ZINC000819486444	EG	On-Demand	Anodyne	ADRB2	15	50
Cc1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)c(C)c1	ZINC000819486445	EG	On-Demand	Anodyne	ADRB2	15	50
Cc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)c(C)c1	ZINC000819486446	EG	On-Demand	Anodyne	ADRB2	15	50
Cc1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)c(C)c1	ZINC000819486447	EG	On-Demand	Anodyne	ADRB2	15	50
Cc1ccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486448	EE	On-Demand	Anodyne	ADRB2	30	49
Cc1ccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486448	EE	On-Demand	Anodyne	ADRB1	43	45
Cc1ccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486449	EE	On-Demand	Anodyne	ADRB2	30	49
Cc1ccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486449	EE	On-Demand	Anodyne	ADRB1	43	45
N#CCc1ccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486491	FD	On-Demand	Mild	ADRB1	43	38
N#CCc1ccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486492	FD	On-Demand	Mild	ADRB1	43	38
COc1cc(F)c(F)cc1NC[C@H](O)COCc1ccccc1	ZINC000819486519	DF	On-Demand	Anodyne	CASR	18	47
O[C@@H](CNc1ccc(C2(O)COC2)cc1)COc1ccccc1	ZINC000819486526	DD	On-Demand	Anodyne	ADRB2	42	46
O[C@@H](CNc1ccc(C2(O)COC2)cc1)COc1ccccc1	ZINC000819486526	DD	On-Demand	Anodyne	ADRB1	61	44
O[C@@H](CNc1ccc(C2(O)COC2)cc1)COc1ccccc1	ZINC000819486526	DD	On-Demand	Anodyne	ADRB3	38	44
O[C@H](CNc1ccc(C2(O)COC2)cc1)COc1ccccc1	ZINC000819486527	DD	On-Demand	Anodyne	ADRB2	42	46
O[C@H](CNc1ccc(C2(O)COC2)cc1)COc1ccccc1	ZINC000819486527	DD	On-Demand	Anodyne	ADRB1	61	44
O[C@H](CNc1ccc(C2(O)COC2)cc1)COc1ccccc1	ZINC000819486527	DD	On-Demand	Anodyne	ADRB3	38	44
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486541	FD	On-Demand	Anodyne	ADRB2	37	44
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486541	FD	On-Demand	Anodyne	ADRB1	64	44
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486541	FD	On-Demand	Anodyne	ADRB3	40	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486542	FD	On-Demand	Anodyne	ADRB2	37	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486542	FD	On-Demand	Anodyne	ADRB1	64	44
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(C3(O)COC3)cc2)cc1	ZINC000819486542	FD	On-Demand	Anodyne	ADRB3	40	44
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)c1	ZINC000819486560	EF	On-Demand	Anodyne	ADRB2	27	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)c1	ZINC000819486560	EF	On-Demand	Anodyne	ADRB1	46	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)c1	ZINC000819486560	EF	On-Demand	Anodyne	PDS	76	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)c1	ZINC000819486561	EF	On-Demand	Anodyne	ADRB2	27	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)c1	ZINC000819486561	EF	On-Demand	Anodyne	ADRB1	46	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)c1	ZINC000819486561	EF	On-Demand	Anodyne	PDS	76	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)c1	ZINC000819486562	EF	On-Demand	Anodyne	ADRB2	27	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)c1	ZINC000819486562	EF	On-Demand	Anodyne	ADRB1	46	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)c1	ZINC000819486562	EF	On-Demand	Anodyne	PDS	76	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)c1	ZINC000819486563	EF	On-Demand	Anodyne	ADRB2	27	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)c1	ZINC000819486563	EF	On-Demand	Anodyne	ADRB1	46	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)c1	ZINC000819486563	EF	On-Demand	Anodyne	PDS	76	40
C[C@H](O)c1cc(NC[C@H](O)COCc2ccccc2)ccc1F	ZINC000819486570	DF	On-Demand	Anodyne	CASR	17	46
C[C@H](O)c1cc(NC[C@@H](O)COCc2ccccc2)ccc1F	ZINC000819486573	DF	On-Demand	Anodyne	CASR	17	46
C[C@H](O)c1cc(NC[C@H](O)COc2ccccc2F)ccc1F	ZINC000819486580	DF	On-Demand	Anodyne	ADRB2	30	49
C[C@H](O)c1cc(NC[C@H](O)COc2ccccc2F)ccc1F	ZINC000819486580	DF	On-Demand	Anodyne	ADRB1	55	35
C[C@H](O)c1cc(NC[C@@H](O)COc2ccccc2F)ccc1F	ZINC000819486582	DF	On-Demand	Anodyne	ADRB2	30	49
C[C@H](O)c1cc(NC[C@@H](O)COc2ccccc2F)ccc1F	ZINC000819486582	DF	On-Demand	Anodyne	ADRB1	55	35
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(Br)cc2)ccc1F	ZINC000819486601	GG	On-Demand	Anodyne	ADRB2	32	42
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(Br)cc2)ccc1F	ZINC000819486601	GG	On-Demand	Anodyne	ADRB1	44	42
C[C@H](O)c1cc(NC[C@H](O)COc2ccc(Br)cc2)ccc1F	ZINC000819486601	GG	On-Demand	Anodyne	GRIN1	17	42
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(Br)cc2)ccc1F	ZINC000819486603	GG	On-Demand	Anodyne	ADRB2	32	42
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(Br)cc2)ccc1F	ZINC000819486603	GG	On-Demand	Anodyne	ADRB1	44	42
C[C@H](O)c1cc(NC[C@@H](O)COc2ccc(Br)cc2)ccc1F	ZINC000819486603	GG	On-Demand	Anodyne	GRIN1	17	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486612	EF	On-Demand	Anodyne	ADRB2	31	47
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486612	EF	On-Demand	Anodyne	ADRB1	59	47
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486612	EF	On-Demand	Anodyne	GRIN1	19	42
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486613	EF	On-Demand	Anodyne	ADRB2	31	47
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486613	EF	On-Demand	Anodyne	ADRB1	59	47
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486613	EF	On-Demand	Anodyne	GRIN1	19	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486614	EF	On-Demand	Anodyne	ADRB2	31	47
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486614	EF	On-Demand	Anodyne	ADRB1	59	47
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)c([C@@H](C)O)c2)cc1	ZINC000819486614	EF	On-Demand	Anodyne	GRIN1	19	42
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486615	EF	On-Demand	Anodyne	ADRB2	31	47
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486615	EF	On-Demand	Anodyne	ADRB1	59	47
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(F)c([C@H](C)O)c2)cc1	ZINC000819486615	EF	On-Demand	Anodyne	GRIN1	19	42
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccccc1F	ZINC000819486681	EF	On-Demand	Anodyne	ADRB2	33	45
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccccc1F	ZINC000819486681	EF	On-Demand	Anodyne	ADRB1	43	38
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccccc1F	ZINC000819486682	EF	On-Demand	Anodyne	ADRB2	33	45
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccccc1F	ZINC000819486682	EF	On-Demand	Anodyne	ADRB1	43	38
O=[N+]([O-])c1ccc([C@@H](O)CNc2cccc(CN3CC[C@@H](O)C3)c2)cc1	ZINC000819486704	FE	On-Demand	Bother	OPRK1	16	47
O=[N+]([O-])c1ccc([C@@H](O)CNc2cccc(CN3CC[C@H](O)C3)c2)cc1	ZINC000819486705	FE	On-Demand	Bother	OPRK1	16	47
O=[N+]([O-])c1ccc([C@H](O)CNc2cccc(CN3CC[C@H](O)C3)c2)cc1	ZINC000819486706	FE	On-Demand	Bother	OPRK1	16	47
O=[N+]([O-])c1ccc([C@H](O)CNc2cccc(CN3CC[C@@H](O)C3)c2)cc1	ZINC000819486707	FE	On-Demand	Bother	OPRK1	16	47
NC(=O)c1ccc(NC[C@@H](O)Cc2ccccc2)c(OCC(F)F)c1	ZINC000819486709	FE	On-Demand	Anodyne	PDS	48	31
NC(=O)c1ccc(NC[C@H](O)Cc2ccccc2)c(OCC(F)F)c1	ZINC000819486710	FE	On-Demand	Anodyne	PDS	48	31
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3Cl)c2)C1	ZINC000819486715	FG	On-Demand	Anodyne	SIGMAR1	18	41
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3Cl)c2)C1	ZINC000819486715	FG	On-Demand	Anodyne	CCR3	36	40
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3Cl)c2)C1	ZINC000819486716	FG	On-Demand	Anodyne	SIGMAR1	18	41
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3Cl)c2)C1	ZINC000819486716	FG	On-Demand	Anodyne	CCR3	36	40
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3ccc(F)cc3Cl)c2)C1	ZINC000819486717	FG	On-Demand	Anodyne	SIGMAR1	18	41
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3ccc(F)cc3Cl)c2)C1	ZINC000819486717	FG	On-Demand	Anodyne	CCR3	36	40
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(F)cc1Cl	ZINC000819486718	FG	On-Demand	Anodyne	SIGMAR1	18	41
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(F)cc1Cl	ZINC000819486718	FG	On-Demand	Anodyne	CCR3	36	40
N#Cc1ccc([C@@H](O)CNc2cccc(CN3CC[C@H](O)C3)c2)cc1	ZINC000819486723	EE	On-Demand	Mild	CCR3	17	44
N#Cc1ccc([C@@H](O)CNc2cccc(CN3CC[C@@H](O)C3)c2)cc1	ZINC000819486724	EE	On-Demand	Mild	CCR3	17	44
N#Cc1ccc([C@H](O)CNc2cccc(CN3CC[C@H](O)C3)c2)cc1	ZINC000819486725	EE	On-Demand	Mild	CCR3	17	44
N#Cc1ccc([C@H](O)CNc2cccc(CN3CC[C@@H](O)C3)c2)cc1	ZINC000819486726	EE	On-Demand	Mild	CCR3	17	44
Cn1cnc(-c2cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2)n1	ZINC000819486727	GG	On-Demand	Mild	PAPA1_CARPA	37	40
Cn1cnc(-c2cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2)n1	ZINC000819486728	GG	On-Demand	Mild	PAPA1_CARPA	37	40
Cc1nn(C)c2cc(NC[C@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)ccc12	ZINC000819486732	GG	On-Demand	Anodyne	GPR119	47	41
Cc1nn(C)c2cc(NC[C@@H](O)C3CCN(C(=O)OC(C)(C)C)CC3)ccc12	ZINC000819486733	GG	On-Demand	Anodyne	GPR119	47	41
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(CN2CC[C@H](O)C2)c1	ZINC000819486738	GD	On-Demand	Anodyne	ACHE	23	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(CN2CC[C@H](O)C2)c1	ZINC000819486738	GD	On-Demand	Anodyne	HRH2	31	42
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(CN2CC[C@H](O)C2)c1	ZINC000819486738	GD	On-Demand	Anodyne	OPRK1	16	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(CN2CC[C@H](O)C2)c1	ZINC000819486739	GD	On-Demand	Anodyne	ACHE	23	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(CN2CC[C@H](O)C2)c1	ZINC000819486739	GD	On-Demand	Anodyne	HRH2	31	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(CN2CC[C@H](O)C2)c1	ZINC000819486739	GD	On-Demand	Anodyne	OPRK1	16	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(CN2CC[C@@H](O)C2)c1	ZINC000819486740	GD	On-Demand	Anodyne	ACHE	23	40
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(CN2CC[C@@H](O)C2)c1	ZINC000819486740	GD	On-Demand	Anodyne	HRH2	31	42
CC(C)(C)OC(=O)NC[C@@](C)(O)CNc1cccc(CN2CC[C@@H](O)C2)c1	ZINC000819486740	GD	On-Demand	Anodyne	OPRK1	16	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(CN2CC[C@@H](O)C2)c1	ZINC000819486741	GD	On-Demand	Anodyne	ACHE	23	40
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(CN2CC[C@@H](O)C2)c1	ZINC000819486741	GD	On-Demand	Anodyne	HRH2	31	42
CC(C)(C)OC(=O)NC[C@](C)(O)CNc1cccc(CN2CC[C@@H](O)C2)c1	ZINC000819486741	GD	On-Demand	Anodyne	OPRK1	16	40
Cn1cc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)nn1	ZINC000819486748	ED	On-Demand	Mild	PAPA1_CARPA	45	48
Cn1cc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)nn1	ZINC000819486749	ED	On-Demand	Mild	PAPA1_CARPA	45	48
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccccc1	ZINC000819486752	DF	On-Demand	Anodyne	ADRB2	56	50
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccccc1	ZINC000819486752	DF	On-Demand	Anodyne	ADRB1	64	44
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccccc1	ZINC000819486752	DF	On-Demand	Anodyne	ADRB3	39	44
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccccc1	ZINC000819486752	DF	On-Demand	Anodyne	CASR	28	45
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccccc1	ZINC000819486752	DF	On-Demand	Anodyne	GYS1	42	34
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccccc1	ZINC000819486752	DF	On-Demand	Anodyne	CYP2D6	19	42
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccccc1	ZINC000819486753	DF	On-Demand	Anodyne	ADRB2	56	50
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccccc1	ZINC000819486753	DF	On-Demand	Anodyne	ADRB1	64	44
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccccc1	ZINC000819486753	DF	On-Demand	Anodyne	ADRB3	39	44
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccccc1	ZINC000819486753	DF	On-Demand	Anodyne	CASR	28	45
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccccc1	ZINC000819486753	DF	On-Demand	Anodyne	GYS1	42	34
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccccc1	ZINC000819486753	DF	On-Demand	Anodyne	CYP2D6	19	42
O[C@@H](CNc1ccc(-c2ccccn2)cc1)C1CC1	ZINC000819486766	CF	On-Demand	Anodyne	PRNP	35	41
O[C@H](CNc1ccc(-c2ccccn2)cc1)C1CC1	ZINC000819486767	CF	On-Demand	Anodyne	PRNP	35	41
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(F)c3)c2)C1	ZINC000819486768	EF	On-Demand	Anodyne	OPRK1	17	42
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(F)c3)c2)C1	ZINC000819486768	EF	On-Demand	Anodyne	CCR3	28	42
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(F)c3)c2)C1	ZINC000819486769	EF	On-Demand	Anodyne	OPRK1	17	42
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(F)c3)c2)C1	ZINC000819486769	EF	On-Demand	Anodyne	CCR3	28	42
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3cccc(F)c3)c2)C1	ZINC000819486770	EF	On-Demand	Anodyne	OPRK1	17	42
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3cccc(F)c3)c2)C1	ZINC000819486770	EF	On-Demand	Anodyne	CCR3	28	42
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(F)c1	ZINC000819486771	EF	On-Demand	Anodyne	OPRK1	17	42
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(F)c1	ZINC000819486771	EF	On-Demand	Anodyne	CCR3	28	42
C=CCS(=O)(=O)CCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819486786	EC	On-Demand	Mild	MTNR1A	58	39
C=CCS(=O)(=O)CCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819486786	EC	On-Demand	Mild	MTNR1B	51	38
C=CCS(=O)(=O)CCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819486787	EC	On-Demand	Mild	MTNR1A	58	39
C=CCS(=O)(=O)CCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819486787	EC	On-Demand	Mild	MTNR1B	51	38
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819486788	EF	On-Demand	Anodyne	ADRB2	41	40
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819486788	EF	On-Demand	Anodyne	ADRB1	46	38
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(F)cc1	ZINC000819486788	EF	On-Demand	Anodyne	GYS1	44	36
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819486789	EF	On-Demand	Anodyne	ADRB2	41	40
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819486789	EF	On-Demand	Anodyne	ADRB1	46	38
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(F)cc1	ZINC000819486789	EF	On-Demand	Anodyne	GYS1	44	36
CN(C[C@@H](O)CNc1cccc(CN2CC[C@@H](O)C2)c1)C(=O)OC(C)(C)C	ZINC000819486808	GD	On-Demand	Anodyne	OPRK1	19	43
CN(C[C@H](O)CNc1cccc(CN2CC[C@@H](O)C2)c1)C(=O)OC(C)(C)C	ZINC000819486809	GD	On-Demand	Anodyne	OPRK1	19	43
CN(C[C@@H](O)CNc1cccc(CN2CC[C@H](O)C2)c1)C(=O)OC(C)(C)C	ZINC000819486810	GD	On-Demand	Anodyne	OPRK1	19	43
CN(C[C@H](O)CNc1cccc(CN2CC[C@H](O)C2)c1)C(=O)OC(C)(C)C	ZINC000819486811	GD	On-Demand	Anodyne	OPRK1	19	43
O=[N+]([O-])c1cccc([C@@H](O)CNc2cccc(CN3CC[C@@H](O)C3)c2)c1	ZINC000819486819	FE	On-Demand	Bother	OPRK1	19	44
O=[N+]([O-])c1cccc([C@@H](O)CNc2cccc(CN3CC[C@H](O)C3)c2)c1	ZINC000819486820	FE	On-Demand	Bother	OPRK1	19	44
O=[N+]([O-])c1cccc([C@H](O)CNc2cccc(CN3CC[C@H](O)C3)c2)c1	ZINC000819486821	FE	On-Demand	Bother	OPRK1	19	44
O=[N+]([O-])c1cccc([C@H](O)CNc2cccc(CN3CC[C@@H](O)C3)c2)c1	ZINC000819486822	FE	On-Demand	Bother	OPRK1	19	44
COc1cc(F)c(F)cc1NC[C@@H](O)COc1c(OC)cccc1OC	ZINC000819486843	FF	On-Demand	Anodyne	ADRB2	29	40
COc1cc(F)c(F)cc1NC[C@H](O)COc1c(OC)cccc1OC	ZINC000819486844	FF	On-Demand	Anodyne	ADRB2	29	40
CN(C[C@@H](O)CNc1ccc(Oc2ccnc(C#N)c2)cc1)C(=O)OC(C)(C)C	ZINC000819486849	GG	On-Demand	Mild	PFKFB3	43	30
CN(C[C@H](O)CNc1ccc(Oc2ccnc(C#N)c2)cc1)C(=O)OC(C)(C)C	ZINC000819486850	GG	On-Demand	Mild	PFKFB3	43	30
CC(=O)Nc1cccc(CC(=O)NCc2ccc(N3CCOC3=O)cc2)c1	ZINC000819486865	FE	On-Demand	Anodyne	PTGIR	15	41
COc1cc(NC[C@H](O)c2ccc(Cl)cc2)cc(OC)c1C	ZINC000819486889	DH	On-Demand	Anodyne	ADRB2	15	41
CSc1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819486893	FH	On-Demand	Clean	ADRB2	36	40
CSc1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819486893	FH	On-Demand	Clean	ADRB1	54	40
CSc1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819486898	FH	On-Demand	Clean	ADRB2	36	40
CSc1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819486898	FH	On-Demand	Clean	ADRB1	54	40
COC(=O)C1=NOC2(CCN(C(=O)C[S@@](=O)c3cccc(OC)c3)CC2)C1	ZINC000819486922	GD	On-Demand	Anodyne	DRD4	40	31
COC(=O)C1=NOC2(CCN(C(=O)C[S@](=O)c3cccc(OC)c3)CC2)C1	ZINC000819486925	GD	On-Demand	Anodyne	DRD4	40	31
O=C(CCc1cccc(OC(F)F)c1)NCc1ccc(N2CCOC2=O)cc1	ZINC000819486951	GG	On-Demand	Anodyne	PLA2G4A	27	41
O[C@H](CNc1ccccc1OCCF)COc1ccccc1F	ZINC000819487005	DG	On-Demand	Clean	ADRB2	22	43
O[C@H](CNc1ccccc1OCCF)COc1ccccc1F	ZINC000819487005	DG	On-Demand	Clean	ADRB1	60	43
O[C@@H](CNc1ccccc1OCCF)COc1ccccc1F	ZINC000819487006	DG	On-Demand	Clean	ADRB2	22	43
O[C@@H](CNc1ccccc1OCCF)COc1ccccc1F	ZINC000819487006	DG	On-Demand	Clean	ADRB1	60	43
CS(=O)(=O)c1ccc([C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819487011	FF	On-Demand	Anodyne	CTSF	47	34
CS(=O)(=O)c1ccc([C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819487012	FF	On-Demand	Anodyne	CTSF	47	34
O=C(NCC1OCCCO1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000819487047	FE	On-Demand	Anodyne	SIGMAR1	50	38
O=C(NCC1OCCCO1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000819487047	FE	On-Demand	Anodyne	NPFFR1	45	42
O=C(NCC1OCCCO1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000819487048	FE	On-Demand	Anodyne	SIGMAR1	50	38
O=C(NCC1OCCCO1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000819487048	FE	On-Demand	Anodyne	NPFFR1	45	42
O[C@H](CNc1ccc(Cl)cc1OCc1ccccc1)CN1CCOCC1	ZINC000819487052	GG	On-Demand	Anodyne	PTGER1	64	46
O[C@H](CNc1ccc(Cl)cc1OCc1ccccc1)CN1CCOCC1	ZINC000819487052	GG	On-Demand	Anodyne	CCR1	43	40
O[C@H](CNc1ccc(Cl)cc1OCc1ccccc1)CN1CCOCC1	ZINC000819487052	GG	On-Demand	Anodyne	ABCB1	46	39
O[C@@H](CNc1ccc(Cl)cc1OCc1ccccc1)CN1CCOCC1	ZINC000819487056	GG	On-Demand	Anodyne	PTGER1	64	46
O[C@@H](CNc1ccc(Cl)cc1OCc1ccccc1)CN1CCOCC1	ZINC000819487056	GG	On-Demand	Anodyne	CCR1	43	40
O[C@@H](CNc1ccc(Cl)cc1OCc1ccccc1)CN1CCOCC1	ZINC000819487056	GG	On-Demand	Anodyne	ABCB1	46	39
COc1cc(F)c(F)cc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819487062	FF	On-Demand	Bother	ADRB2	19	41
COc1cc(F)c(F)cc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819487062	FF	On-Demand	Bother	ADRB1	24	41
COc1cc(F)c(F)cc1NC[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819487062	FF	On-Demand	Bother	CACNA1D	60	35
COc1cc(F)c(F)cc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819487063	FF	On-Demand	Bother	ADRB2	19	41
COc1cc(F)c(F)cc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819487063	FF	On-Demand	Bother	ADRB1	24	41
COc1cc(F)c(F)cc1NC[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000819487063	FF	On-Demand	Bother	CACNA1D	60	35
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819487068	FG	On-Demand	Anodyne	ADRB2	29	41
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819487068	FG	On-Demand	Anodyne	ADRB1	50	37
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(C(C)=O)cc1	ZINC000819487068	FG	On-Demand	Anodyne	GYS1	42	34
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819487069	FG	On-Demand	Anodyne	ADRB2	29	41
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819487069	FG	On-Demand	Anodyne	ADRB1	50	37
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(C(C)=O)cc1	ZINC000819487069	FG	On-Demand	Anodyne	GYS1	42	34
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3cc(F)ccc3F)c2)C1	ZINC000819487071	EF	On-Demand	Anodyne	SIGMAR1	15	40
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3cc(F)ccc3F)c2)C1	ZINC000819487071	EF	On-Demand	Anodyne	CCR3	43	41
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3cc(F)ccc3F)c2)C1	ZINC000819487073	EF	On-Demand	Anodyne	SIGMAR1	15	40
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3cc(F)ccc3F)c2)C1	ZINC000819487073	EF	On-Demand	Anodyne	CCR3	43	41
O=C(NCC1OCCCO1)[C@H]1CCCN(C(=O)c2ccncc2)C1	ZINC000819487075	EC	On-Demand	Anodyne	PDE8B	20	40
O=C(NCC1OCCCO1)[C@H]1CCCN(C(=O)c2ccncc2)C1	ZINC000819487075	EC	On-Demand	Anodyne	L3MBTL3	50	37
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3cc(F)ccc3F)c2)C1	ZINC000819487076	EF	On-Demand	Anodyne	SIGMAR1	15	40
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3cc(F)ccc3F)c2)C1	ZINC000819487076	EF	On-Demand	Anodyne	CCR3	43	41
O=C(NCC1OCCCO1)[C@@H]1CCCN(C(=O)c2ccncc2)C1	ZINC000819487077	EC	On-Demand	Anodyne	PDE8B	20	40
O=C(NCC1OCCCO1)[C@@H]1CCCN(C(=O)c2ccncc2)C1	ZINC000819487077	EC	On-Demand	Anodyne	L3MBTL3	50	37
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1cc(F)ccc1F	ZINC000819487078	EF	On-Demand	Anodyne	SIGMAR1	15	40
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1cc(F)ccc1F	ZINC000819487078	EF	On-Demand	Anodyne	CCR3	43	41
O=C(Nc1cnn[nH]1)C1(c2cc(C(F)(F)F)ccc2Cl)CC1	ZINC000819487079	EG	On-Demand	Anodyne	ATF1	47	36
O=C(Nc1cnn[nH]1)C1(c2cc(C(F)(F)F)ccc2Cl)CC1	ZINC000819487079	EG	On-Demand	Anodyne	NFKB1	43	36
Cc1nn(C)c2cc(NC[C@H](O)c3cccnc3)ccc12	ZINC000819487080	CE	On-Demand	Anodyne	ADRB3	78	43
Cc1nn(C)c2cc(NC[C@@H](O)c3cccnc3)ccc12	ZINC000819487081	CE	On-Demand	Anodyne	ADRB3	78	43
Cc1cc(C(=O)NCC2OCCCO2)cc(Cl)c1Br	ZINC000819487087	EF	On-Demand	Anodyne	CACNA1I	56	36
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(Br)c3)c2)C1	ZINC000819487097	GG	On-Demand	Anodyne	OPRK1	17	42
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(Br)c3)c2)C1	ZINC000819487099	GG	On-Demand	Anodyne	OPRK1	17	42
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3cccc(Br)c3)c2)C1	ZINC000819487101	GG	On-Demand	Anodyne	OPRK1	17	42
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(Br)c1	ZINC000819487103	GG	On-Demand	Anodyne	OPRK1	17	42
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc(CN2CC[C@H](O)C2)c1	ZINC000819487104	GD	On-Demand	Anodyne	ACHE	19	40
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc(CN2CC[C@H](O)C2)c1	ZINC000819487104	GD	On-Demand	Anodyne	HRH2	27	44
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc(CN2CC[C@H](O)C2)c1	ZINC000819487104	GD	On-Demand	Anodyne	OPRK1	18	41
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc(CN2CC[C@@H](O)C2)c1	ZINC000819487105	GD	On-Demand	Anodyne	ACHE	19	40
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc(CN2CC[C@@H](O)C2)c1	ZINC000819487105	GD	On-Demand	Anodyne	HRH2	27	44
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc(CN2CC[C@@H](O)C2)c1	ZINC000819487105	GD	On-Demand	Anodyne	OPRK1	18	41
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc(CN2CC[C@H](O)C2)c1	ZINC000819487107	GD	On-Demand	Anodyne	ACHE	19	40
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc(CN2CC[C@H](O)C2)c1	ZINC000819487107	GD	On-Demand	Anodyne	HRH2	27	44
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc(CN2CC[C@H](O)C2)c1	ZINC000819487107	GD	On-Demand	Anodyne	OPRK1	18	41
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc(CN2CC[C@@H](O)C2)c1	ZINC000819487109	GD	On-Demand	Anodyne	ACHE	19	40
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc(CN2CC[C@@H](O)C2)c1	ZINC000819487109	GD	On-Demand	Anodyne	HRH2	27	44
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc(CN2CC[C@@H](O)C2)c1	ZINC000819487109	GD	On-Demand	Anodyne	OPRK1	18	41
CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)Nc2cnn[nH]2)c1	ZINC000819487111	EF	On-Demand	Anodyne	CSF1R	21	42
CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)Nc2cnn[nH]2)c1	ZINC000819487111	EF	On-Demand	Anodyne	NR2E3	44	32
CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)Nc2cnn[nH]2)c1	ZINC000819487111	EF	On-Demand	Anodyne	SHH	37	40
CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)Nc2cnn[nH]2)c1	ZINC000819487111	EF	On-Demand	Anodyne	IMDH_CRYPV	63	44
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3F)c2)C1	ZINC000819487145	EF	On-Demand	Anodyne	SIGMAR1	15	40
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3F)c2)C1	ZINC000819487145	EF	On-Demand	Anodyne	CCR3	44	41
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3F)c2)C1	ZINC000819487146	EF	On-Demand	Anodyne	SIGMAR1	15	40
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3F)c2)C1	ZINC000819487146	EF	On-Demand	Anodyne	CCR3	44	41
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3ccc(F)cc3F)c2)C1	ZINC000819487147	EF	On-Demand	Anodyne	SIGMAR1	15	40
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3ccc(F)cc3F)c2)C1	ZINC000819487147	EF	On-Demand	Anodyne	CCR3	44	41
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(F)cc1F	ZINC000819487149	EF	On-Demand	Anodyne	SIGMAR1	15	40
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(F)cc1F	ZINC000819487149	EF	On-Demand	Anodyne	CCR3	44	41
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3Br)c2)C1	ZINC000819487156	GG	On-Demand	Anodyne	SLC18A3	21	42
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3Br)c2)C1	ZINC000819487158	GG	On-Demand	Anodyne	SLC18A3	21	42
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3ccccc3Br)c2)C1	ZINC000819487160	GG	On-Demand	Anodyne	SLC18A3	21	42
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1ccccc1Br	ZINC000819487162	GG	On-Demand	Anodyne	SLC18A3	21	42
NC(=O)c1ccc(NC[C@@H](O)Cc2cccc(Cl)c2)c(OCC(F)F)c1	ZINC000819487163	GG	On-Demand	Anodyne	PDS	42	35
NC(=O)c1ccc(NC[C@H](O)Cc2cccc(Cl)c2)c(OCC(F)F)c1	ZINC000819487164	GG	On-Demand	Anodyne	PDS	42	35
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(Cl)cc3)c2)C1	ZINC000819487186	EG	On-Demand	Anodyne	SIGMAR1	22	40
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(Cl)cc3)c2)C1	ZINC000819487186	EG	On-Demand	Anodyne	MCHR1	21	40
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(Cl)cc3)c2)C1	ZINC000819487187	EG	On-Demand	Anodyne	SIGMAR1	22	40
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(Cl)cc3)c2)C1	ZINC000819487187	EG	On-Demand	Anodyne	MCHR1	21	40
Cc1ccccc1[C@H](CC(=O)Nc1cnn[nH]1)NC(N)=O	ZINC000819487202	CC	On-Demand	Anodyne	CTSA	59	37
Cc1ccccc1[C@@H](CC(=O)Nc1cnn[nH]1)NC(N)=O	ZINC000819487203	CC	On-Demand	Anodyne	CTSA	59	37
O=C(NCC1OCCCO1)c1cc(F)cc(Cl)c1	ZINC000819487213	CD	On-Demand	Anodyne	CACNA1H	19	41
O=C(NCC1OCCCO1)c1cc(F)cc(Cl)c1	ZINC000819487213	CD	On-Demand	Anodyne	CACNA1I	81	44
CCCOc1cc(OC)ccc1C(=O)NCC1OCCCO1	ZINC000819487237	DD	On-Demand	Anodyne	MTNR1A	51	46
CCCOc1cc(OC)ccc1C(=O)NCC1OCCCO1	ZINC000819487237	DD	On-Demand	Anodyne	MTNR1B	41	46
CCCOc1cc(OC)ccc1C(=O)NCC1OCCCO1	ZINC000819487237	DD	On-Demand	Anodyne	LUCI_LUCLA	15	41
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819487240	EE	On-Demand	Anodyne	ADRB2	34	47
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819487240	EE	On-Demand	Anodyne	ADRB1	57	48
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819487241	EE	On-Demand	Anodyne	ADRB2	34	47
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819487241	EE	On-Demand	Anodyne	ADRB1	57	48
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819487242	EE	On-Demand	Anodyne	ADRB2	34	47
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819487242	EE	On-Demand	Anodyne	ADRB1	57	48
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819487243	EE	On-Demand	Anodyne	ADRB2	34	47
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819487243	EE	On-Demand	Anodyne	ADRB1	57	48
O=C(COc1ccc(OCc2ccccc2)cc1)Nc1cnn[nH]1	ZINC000819487252	DE	On-Demand	Anodyne	LTA4H	19	49
O=C(COc1ccc(OCc2ccccc2)cc1)Nc1cnn[nH]1	ZINC000819487252	DE	On-Demand	Anodyne	ADORA2B	28	42
O=C(COc1ccc(OCc2ccccc2)cc1)Nc1cnn[nH]1	ZINC000819487252	DE	On-Demand	Anodyne	FFAR1	33	43
CC(C)(C)CC(=O)Nc1ccc(Cl)c(C(=O)Nc2cnn[nH]2)c1	ZINC000819487254	EG	On-Demand	Anodyne	CSF1R	17	41
CC(C)(C)CC(=O)Nc1ccc(Cl)c(C(=O)Nc2cnn[nH]2)c1	ZINC000819487254	EG	On-Demand	Anodyne	NR2E3	44	31
CC(C)(C)CC(=O)Nc1ccc(Cl)c(C(=O)Nc2cnn[nH]2)c1	ZINC000819487254	EG	On-Demand	Anodyne	SHH	36	40
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3ccccc3C(F)(F)F)cc2)N1	ZINC000819487266	GF	On-Demand	Anodyne	ADRB1	48	33
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3ccccc3C(F)(F)F)cc2)N1	ZINC000819487268	GF	On-Demand	Anodyne	ADRB1	48	33
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3ccccc3C(F)(F)F)cc2)N1	ZINC000819487270	GF	On-Demand	Anodyne	ADRB1	48	33
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3ccccc3C(F)(F)F)cc2)N1	ZINC000819487272	GF	On-Demand	Anodyne	ADRB1	48	33
COc1cccc([S@@](=O)CC(=O)Nc2cccc(CCCOC(C)=O)c2)c1	ZINC000819487293	GF	On-Demand	Anodyne	MTNR1A	39	46
COc1cccc([S@@](=O)CC(=O)Nc2cccc(CCCOC(C)=O)c2)c1	ZINC000819487293	GF	On-Demand	Anodyne	MTNR1B	43	46
O=C(NCC1OCCCO1)c1ccc(COc2ccc3ccccc3c2)o1	ZINC000819487308	FH	On-Demand	Anodyne	CYSLTR1	41	43
Cc1ccc(OC[C@@H](O)CNc2ccccc2OCCF)c(C)c1	ZINC000819487325	EH	On-Demand	Clean	ADRB2	24	45
Cc1ccc(OC[C@@H](O)CNc2ccccc2OCCF)c(C)c1	ZINC000819487325	EH	On-Demand	Clean	ADRB1	48	37
Cc1ccc(OC[C@H](O)CNc2ccccc2OCCF)c(C)c1	ZINC000819487326	EH	On-Demand	Clean	ADRB2	24	45
Cc1ccc(OC[C@H](O)CNc2ccccc2OCCF)c(C)c1	ZINC000819487326	EH	On-Demand	Clean	ADRB1	48	37
CO[C@H]1CCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819487341	FF	On-Demand	Mild	PAPA1_CARPA	32	42
CO[C@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819487343	FF	On-Demand	Mild	PAPA1_CARPA	32	42
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819487348	FF	On-Demand	Clean	ADRB2	52	56
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819487348	FF	On-Demand	Clean	ADRB1	85	56
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819487348	FF	On-Demand	Clean	ADRB3	48	48
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819487348	FF	On-Demand	Clean	ABCB1	19	40
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819487349	FF	On-Demand	Clean	ADRB2	52	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819487349	FF	On-Demand	Clean	ADRB1	85	56
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819487349	FF	On-Demand	Clean	ADRB3	48	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819487349	FF	On-Demand	Clean	ABCB1	19	40
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCOCC3)c(C)c2)c1	ZINC000819487384	GF	On-Demand	Anodyne	DRD4	43	33
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCOCC3)c(C)c2)c1	ZINC000819487384	GF	On-Demand	Anodyne	PIK3CB	15	51
COc1cccc([S@@](=O)CC(=O)Nc2ccc(N3CCOCC3)c(C)c2)c1	ZINC000819487384	GF	On-Demand	Anodyne	TAAR1	31	48
COc1cc(NCCC(=O)Nc2ccc(N(C)C)cc2)cc(OC)c1C	ZINC000819487385	FH	On-Demand	Anodyne	ENPP1	62	32
COc1cc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc(OC)c1C	ZINC000819487388	GG	On-Demand	Anodyne	GPR119	53	46
COc1cc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc(OC)c1C	ZINC000819487389	GG	On-Demand	Anodyne	GPR119	53	46
COc1cc(NC[C@H](O)c2cccc(Cl)c2)cc(OC)c1C	ZINC000819487394	DH	On-Demand	Anodyne	ADRB2	21	48
COc1cc(NC[C@H](O)c2cccc(Cl)c2)cc(OC)c1C	ZINC000819487394	DH	On-Demand	Anodyne	ADRB1	34	48
COc1cc(NC[C@H](O)c2cccc(Cl)c2)cc(OC)c1C	ZINC000819487394	DH	On-Demand	Anodyne	ADRB3	54	48
COc1cc(NC[C@H](O)c2cccc(Cl)c2)cc(OC)c1C	ZINC000819487394	DH	On-Demand	Anodyne	CYP3A4	45	35
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)cc(OC)c1C	ZINC000819487395	DH	On-Demand	Anodyne	ADRB2	21	48
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)cc(OC)c1C	ZINC000819487395	DH	On-Demand	Anodyne	ADRB1	34	48
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)cc(OC)c1C	ZINC000819487395	DH	On-Demand	Anodyne	ADRB3	54	48
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)cc(OC)c1C	ZINC000819487395	DH	On-Demand	Anodyne	CYP3A4	45	35
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccccc2OCCF)CC1	ZINC000819487398	GG	On-Demand	Anodyne	GPR119	52	49
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccccc2OCCF)CC1	ZINC000819487399	GG	On-Demand	Anodyne	GPR119	52	49
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2ccccc2OCCF)CC1	ZINC000819487400	GH	On-Demand	Anodyne	HCN1	48	30
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2ccccc2OCCF)CC1	ZINC000819487400	GH	On-Demand	Anodyne	HCN4	46	30
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2ccccc2OCCF)CC1	ZINC000819487401	GH	On-Demand	Anodyne	HCN1	48	30
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2ccccc2OCCF)CC1	ZINC000819487401	GH	On-Demand	Anodyne	HCN4	46	30
O[C@@H](CNc1ccccc1OCCF)c1cccnc1	ZINC000819487413	CF	On-Demand	Anodyne	ADRB1	21	41
O[C@@H](CNc1ccccc1OCCF)c1cccnc1	ZINC000819487413	CF	On-Demand	Anodyne	ADRB3	63	43
O[C@H](CNc1ccccc1OCCF)c1cccnc1	ZINC000819487415	CF	On-Demand	Anodyne	ADRB1	21	41
O[C@H](CNc1ccccc1OCCF)c1cccnc1	ZINC000819487415	CF	On-Demand	Anodyne	ADRB3	63	43
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3cc4ccccc4o3)c2)C1	ZINC000819487416	FG	On-Demand	Anodyne	SIGMAR1	25	40
O[C@@H]1CCN(Cc2cccc(NC[C@@H](O)c3cc4ccccc4o3)c2)C1	ZINC000819487421	FG	On-Demand	Anodyne	SIGMAR1	25	40
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3)c2)C1	ZINC000819487422	DE	On-Demand	Anodyne	OPRK1	22	48
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3)c2)C1	ZINC000819487422	DE	On-Demand	Anodyne	SLC6A3	23	40
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3)c2)C1	ZINC000819487422	DE	On-Demand	Anodyne	SIGMAR1	37	43
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3)c2)C1	ZINC000819487422	DE	On-Demand	Anodyne	SLC18A3	24	40
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3)c2)C1	ZINC000819487423	DE	On-Demand	Anodyne	OPRK1	22	48
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3)c2)C1	ZINC000819487423	DE	On-Demand	Anodyne	SLC6A3	23	40
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3)c2)C1	ZINC000819487423	DE	On-Demand	Anodyne	SIGMAR1	37	43
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3)c2)C1	ZINC000819487423	DE	On-Demand	Anodyne	SLC18A3	24	40
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3ccccc3)c2)C1	ZINC000819487424	DE	On-Demand	Anodyne	OPRK1	22	48
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3ccccc3)c2)C1	ZINC000819487424	DE	On-Demand	Anodyne	SLC6A3	23	40
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3ccccc3)c2)C1	ZINC000819487424	DE	On-Demand	Anodyne	SIGMAR1	37	43
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3ccccc3)c2)C1	ZINC000819487424	DE	On-Demand	Anodyne	SLC18A3	24	40
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1ccccc1	ZINC000819487425	DE	On-Demand	Anodyne	OPRK1	22	48
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1ccccc1	ZINC000819487425	DE	On-Demand	Anodyne	SLC6A3	23	40
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1ccccc1	ZINC000819487425	DE	On-Demand	Anodyne	SIGMAR1	37	43
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1ccccc1	ZINC000819487425	DE	On-Demand	Anodyne	SLC18A3	24	40
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3)c2)C1	ZINC000819487430	EF	On-Demand	Anodyne	SLC6A3	31	41
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3)c2)C1	ZINC000819487430	EF	On-Demand	Anodyne	SIGMAR1	22	50
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3)c2)C1	ZINC000819487430	EF	On-Demand	Anodyne	CCR3	56	40
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3)c2)C1	ZINC000819487430	EF	On-Demand	Anodyne	MCHR1	18	41
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3)c2)C1	ZINC000819487431	EF	On-Demand	Anodyne	SLC6A3	31	41
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3)c2)C1	ZINC000819487431	EF	On-Demand	Anodyne	SIGMAR1	22	50
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3)c2)C1	ZINC000819487431	EF	On-Demand	Anodyne	CCR3	56	40
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(F)cc3)c2)C1	ZINC000819487431	EF	On-Demand	Anodyne	MCHR1	18	41
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3ccc(F)cc3)c2)C1	ZINC000819487432	EF	On-Demand	Anodyne	SLC6A3	31	41
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3ccc(F)cc3)c2)C1	ZINC000819487432	EF	On-Demand	Anodyne	SIGMAR1	22	50
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3ccc(F)cc3)c2)C1	ZINC000819487432	EF	On-Demand	Anodyne	CCR3	56	40
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3ccc(F)cc3)c2)C1	ZINC000819487432	EF	On-Demand	Anodyne	MCHR1	18	41
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(F)cc1	ZINC000819487433	EF	On-Demand	Anodyne	SLC6A3	31	41
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(F)cc1	ZINC000819487433	EF	On-Demand	Anodyne	SIGMAR1	22	50
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(F)cc1	ZINC000819487433	EF	On-Demand	Anodyne	CCR3	56	40
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(F)cc1	ZINC000819487433	EF	On-Demand	Anodyne	MCHR1	18	41
NC(=O)c1ccc(OCC(=O)Nc2cnn[nH]2)cc1	ZINC000819487442	CB	On-Demand	Anodyne	ADORA2B	24	42
NC(=O)c1ccc(OCC(=O)Nc2cnn[nH]2)cc1	ZINC000819487442	CB	On-Demand	Anodyne	HIF1A	15	41
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)c(C)c1	ZINC000819487449	FE	On-Demand	Anodyne	ADRB2	16	40
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)c(C)c1	ZINC000819487449	FE	On-Demand	Anodyne	ADRB1	21	41
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)c(C)c1	ZINC000819487453	FE	On-Demand	Anodyne	ADRB2	16	40
Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)c(C)c1	ZINC000819487453	FE	On-Demand	Anodyne	ADRB1	21	41
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)c(C)c1	ZINC000819487454	FE	On-Demand	Anodyne	ADRB2	16	40
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)c(C)c1	ZINC000819487454	FE	On-Demand	Anodyne	ADRB1	21	41
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)c(C)c1	ZINC000819487456	FE	On-Demand	Anodyne	ADRB2	16	40
Cc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)c(C)c1	ZINC000819487456	FE	On-Demand	Anodyne	ADRB1	21	41
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(Cl)cc3Cl)c2)C1	ZINC000819487459	GH	On-Demand	Anodyne	SIGMAR1	16	41
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(Cl)cc3Cl)c2)C1	ZINC000819487461	GH	On-Demand	Anodyne	SIGMAR1	16	41
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3ccc(Cl)cc3Cl)c2)C1	ZINC000819487463	GH	On-Demand	Anodyne	SIGMAR1	16	41
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(Cl)cc1Cl	ZINC000819487465	GH	On-Demand	Anodyne	SIGMAR1	16	41
Cc1ncn(-c2ccc(NC[C@H](O)c3ccc(S(C)(=O)=O)cc3)cc2)c1C	ZINC000819487474	GG	On-Demand	Anodyne	PTGS2	23	47
Cc1ncn(-c2ccc(NC[C@@H](O)c3ccc(S(C)(=O)=O)cc3)cc2)c1C	ZINC000819487479	GG	On-Demand	Anodyne	PTGS2	23	47
O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)Nc1cnn[nH]1	ZINC000819487480	DG	On-Demand	Anodyne	HDAC8	23	46
O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)Nc1cnn[nH]1	ZINC000819487480	DG	On-Demand	Anodyne	GSK3A	26	42
Cn1cc(CNC(=O)CC[C@@H](CC2CCCCC2)NC(=O)OC(C)(C)C)nn1	ZINC000819487486	GG	On-Demand	Anodyne	PGA	18	40
Cn1cc(CNC(=O)CC[C@@H](CC2CCCCC2)NC(=O)OC(C)(C)C)nn1	ZINC000819487486	GG	On-Demand	Anodyne	REN	65	45
Cn1cc(CNC(=O)CC[C@@H](CC2CCCCC2)NC(=O)OC(C)(C)C)nn1	ZINC000819487486	GG	On-Demand	Anodyne	CTSE	21	40
Cn1cc(CNC(=O)CC[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)nn1	ZINC000819487488	GG	On-Demand	Anodyne	PGA	18	40
Cn1cc(CNC(=O)CC[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)nn1	ZINC000819487488	GG	On-Demand	Anodyne	REN	65	45
Cn1cc(CNC(=O)CC[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)nn1	ZINC000819487488	GG	On-Demand	Anodyne	CTSE	21	40
CON(C)C(=O)CCNc1cccc(OC(C)C)c1	ZINC000819487509	CE	On-Demand	Anodyne	KCNK3	41	36
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(OC)c(F)c2OC)cc1	ZINC000819487510	GF	On-Demand	Anodyne	ADRB2	29	44
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(OC)c(F)c2OC)cc1	ZINC000819487510	GF	On-Demand	Anodyne	ADRB1	44	40
COC(=O)c1ccc(OC[C@H](O)CNc2cc(F)c(OC)c(F)c2OC)cc1	ZINC000819487510	GF	On-Demand	Anodyne	ADRB3	25	40
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(OC)c(F)c2OC)cc1	ZINC000819487512	GF	On-Demand	Anodyne	ADRB2	29	44
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(OC)c(F)c2OC)cc1	ZINC000819487512	GF	On-Demand	Anodyne	ADRB1	44	40
COC(=O)c1ccc(OC[C@@H](O)CNc2cc(F)c(OC)c(F)c2OC)cc1	ZINC000819487512	GF	On-Demand	Anodyne	ADRB3	25	40
CCn1c(NC(=O)C(F)=C2CCC2)nc2cc(F)ccc21	ZINC000819487528	CH	On-Demand	Anodyne	ITK	40	39
COc1ccc(-c2cncc(C(=O)Nc3cnn[nH]3)c2)cc1	ZINC000819487532	CE	On-Demand	Anodyne	CYP11B1	15	53
COc1ccc(-c2cncc(C(=O)Nc3cnn[nH]3)c2)cc1	ZINC000819487532	CE	On-Demand	Anodyne	CYP11B2	31	53
COc1ccc(-c2cncc(C(=O)Nc3cnn[nH]3)c2)cc1	ZINC000819487532	CE	On-Demand	Anodyne	SCN10A	80	51
COc1ccc(-c2cncc(C(=O)Nc3cnn[nH]3)c2)cc1	ZINC000819487532	CE	On-Demand	Anodyne	HSC82	40	35
COc1ccc(-c2cncc(C(=O)Nc3cnn[nH]3)c2)cc1	ZINC000819487532	CE	On-Demand	Anodyne	LUCI_LUCLA	37	44
COc1cccc([S@@](=O)CC(=O)NCc2ccc(N3CCOC3=O)cc2)c1	ZINC000819487537	GE	On-Demand	Anodyne	DRD4	41	32
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819487542	DG	On-Demand	Anodyne	ADRB2	33	51
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(C)cc1	ZINC000819487542	DG	On-Demand	Anodyne	GYS1	51	36
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819487543	DG	On-Demand	Anodyne	ADRB2	33	51
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(C)cc1	ZINC000819487543	DG	On-Demand	Anodyne	GYS1	51	36
O=C(CN1CCN(Cc2ccccc2)CC1)NCC1OCCCO1	ZINC000819487550	EC	On-Demand	Anodyne	DRD2	27	41
O=C(CN1CCN(Cc2ccccc2)CC1)NCC1OCCCO1	ZINC000819487550	EC	On-Demand	Anodyne	DRD4	73	42
O=C(CN1CCN(Cc2ccccc2)CC1)NCC1OCCCO1	ZINC000819487550	EC	On-Demand	Anodyne	ACHE	46	45
O=C(CN1CCN(Cc2ccccc2)CC1)NCC1OCCCO1	ZINC000819487550	EC	On-Demand	Anodyne	DRD3	19	42
O=C(CN1CCN(Cc2ccccc2)CC1)NCC1OCCCO1	ZINC000819487550	EC	On-Demand	Anodyne	AVPR1B	25	45
O=C(CN1CCN(Cc2ccccc2)CC1)NCC1OCCCO1	ZINC000819487550	EC	On-Demand	Anodyne	CHRM3	18	40
O=C(CN1CCN(Cc2ccccc2)CC1)NCC1OCCCO1	ZINC000819487550	EC	On-Demand	Anodyne	LTA4H	16	48
O=C(CN1CCN(Cc2ccccc2)CC1)NCC1OCCCO1	ZINC000819487550	EC	On-Demand	Anodyne	SIGMAR1	78	47
O=C(CN1CCN(Cc2ccccc2)CC1)NCC1OCCCO1	ZINC000819487550	EC	On-Demand	Anodyne	NPFFR2	30	40
O=C(CN1CCN(Cc2ccccc2)CC1)NCC1OCCCO1	ZINC000819487550	EC	On-Demand	Anodyne	NPFFR1	43	40
Cc1ccc(OC[C@@H](O)CNc2ccc(C(N)=O)cc2OCC(F)F)c(C)c1	ZINC000819487577	GF	On-Demand	Anodyne	ADRB2	15	42
Cc1ccc(OC[C@H](O)CNc2ccc(C(N)=O)cc2OCC(F)F)c(C)c1	ZINC000819487579	GF	On-Demand	Anodyne	ADRB2	15	42
O=[N+]([O-])c1cccc([C@H](O)CNc2cccc(C3CCC3)c2)c1	ZINC000819487593	DI	On-Demand	Bother	CACNA1C	46	37
O=[N+]([O-])c1cccc([C@H](O)CNc2cccc(C3CCC3)c2)c1	ZINC000819487593	DI	On-Demand	Bother	CACNA1D	69	35
O=[N+]([O-])c1cccc([C@@H](O)CNc2cccc(C3CCC3)c2)c1	ZINC000819487595	DI	On-Demand	Bother	CACNA1C	46	37
O=[N+]([O-])c1cccc([C@@H](O)CNc2cccc(C3CCC3)c2)c1	ZINC000819487595	DI	On-Demand	Bother	CACNA1D	69	35
N#Cc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819487607	FD	On-Demand	Mild	ADRB1	45	37
N#Cc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819487608	FD	On-Demand	Mild	ADRB1	45	37
N#Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819487614	FD	On-Demand	Mild	ADRB1	45	37
N#Cc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819487615	FD	On-Demand	Mild	ADRB1	45	37
O=C(Nc1cnn[nH]1)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1	ZINC000819487640	HD	On-Demand	Anodyne	MERTK	28	41
O=C(Nc1cnn[nH]1)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1	ZINC000819487640	HD	On-Demand	Anodyne	NAMPT	33	40
N#Cc1c(Cl)cccc1Oc1cccc(C(=O)NCC2OCCCO2)c1	ZINC000819487660	FG	On-Demand	Mild	DRD4	44	36
N#Cc1c(Cl)cccc1Oc1cccc(C(=O)NCC2OCCCO2)c1	ZINC000819487660	FG	On-Demand	Mild	EZH2	36	45
CC(C)(C)CNC(=O)c1ccc(C(=O)NCC2OCCCO2)cc1	ZINC000819487677	ED	On-Demand	Anodyne	CACNA1I	54	36
O=C(/C=C/c1ccc(Cl)s1)Nc1cnn[nH]1	ZINC000819487681	CE	On-Demand	Anodyne	SCAF_EBVB9	19	42
O=C(/C=C\c1ccc(Cl)s1)Nc1cnn[nH]1	ZINC000819487682	CE	On-Demand	Anodyne	SCAF_EBVB9	19	42
O=C(CSc1nnc(-c2ccccc2)n1-c1ccccc1)Nc1cnn[nH]1	ZINC000819487694	GF	On-Demand	Anodyne	TGM2	16	40
O=C(Nc1cnn[nH]1)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819487699	DH	On-Demand	Anodyne	DRD4	47	41
O=C(Nc1cnn[nH]1)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819487699	DH	On-Demand	Anodyne	RAF1	28	45
O=C(Nc1cnn[nH]1)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819487699	DH	On-Demand	Anodyne	GRM5	17	51
O=C(Nc1cnn[nH]1)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819487699	DH	On-Demand	Anodyne	FAAH	19	41
O=C(Nc1cnn[nH]1)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819487699	DH	On-Demand	Anodyne	CFTR	23	41
O=C(Nc1cnn[nH]1)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819487699	DH	On-Demand	Anodyne	GCK	16	43
O=C(Nc1cnn[nH]1)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819487699	DH	On-Demand	Anodyne	TAAR1	34	42
O=C(Nc1cnn[nH]1)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819487699	DH	On-Demand	Anodyne	Q25615_ONCVO	27	46
O=C(Nc1cnn[nH]1)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819487699	DH	On-Demand	Anodyne	KCNK3	53	42
CCOc1cccc([N+](=O)[O-])c1C(=O)NCC1OCCCO1	ZINC000819487708	DD	On-Demand	Bother	HCN1	43	32
CCOc1cccc([N+](=O)[O-])c1C(=O)NCC1OCCCO1	ZINC000819487708	DD	On-Demand	Bother	HCN4	40	31
O=C(Nc1cnn[nH]1)c1ccc(-c2ccccc2OC(F)(F)F)o1	ZINC000819487712	EG	On-Demand	Anodyne	SCN10A	26	42
C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)NCC3OCCCO3)cc2[N+](=O)[O-])C1	ZINC000819487714	GF	On-Demand	Bother	TAAR1	18	43
CC(=O)OCCCc1cccc(NC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819487749	FJ	On-Demand	Anodyne	KCNK3	82	37
CC(=O)OCCCc1cccc(NC(=O)c2cc(C)ccc2C2CC2)c1	ZINC000819487749	FJ	On-Demand	Anodyne	KCNK9	75	37
CCOC(=O)CN1C(=O)C(F)(F)c2cc(NC[C@H](O)c3cccnc3)ccc21	ZINC000819487758	GE	On-Demand	Anodyne	ADRB3	54	39
CCOC(=O)CN1C(=O)C(F)(F)c2cc(NC[C@@H](O)c3cccnc3)ccc21	ZINC000819487759	GE	On-Demand	Anodyne	ADRB3	54	39
O[C@@H](CNc1ccccc1OCCF)COc1ccc(Cl)cc1	ZINC000819487764	EH	On-Demand	Clean	ADRB2	40	40
O[C@@H](CNc1ccccc1OCCF)COc1ccc(Cl)cc1	ZINC000819487764	EH	On-Demand	Clean	ADRB1	59	42
O[C@@H](CNc1ccccc1OCCF)COc1ccc(Cl)cc1	ZINC000819487764	EH	On-Demand	Clean	ADRB3	25	40
O[C@H](CNc1ccccc1OCCF)COc1ccc(Cl)cc1	ZINC000819487765	EH	On-Demand	Clean	ADRB2	40	40
O[C@H](CNc1ccccc1OCCF)COc1ccc(Cl)cc1	ZINC000819487765	EH	On-Demand	Clean	ADRB1	59	42
O[C@H](CNc1ccccc1OCCF)COc1ccc(Cl)cc1	ZINC000819487765	EH	On-Demand	Clean	ADRB3	25	40
O[C@@H](CNc1ccccc1OCCF)COCc1ccccc1Cl	ZINC000819487766	FH	On-Demand	Clean	FABP5	27	40
O[C@H](CNc1ccccc1OCCF)COCc1ccccc1Cl	ZINC000819487767	FH	On-Demand	Clean	FABP5	27	40
O=[N+]([O-])c1cccc([C@@H](O)CNc2ccccc2OCCF)c1	ZINC000819487774	DG	On-Demand	Bother	CACNA1D	50	36
O=[N+]([O-])c1cccc([C@H](O)CNc2ccccc2OCCF)c1	ZINC000819487775	DG	On-Demand	Bother	CACNA1D	50	36
O[C@@H](CNc1ccccc1OCCF)c1ccc(OC(F)(F)F)cc1	ZINC000819487794	FI	On-Demand	Anodyne	P2RY1	41	37
O[C@H](CNc1ccccc1OCCF)c1ccc(OC(F)(F)F)cc1	ZINC000819487795	FI	On-Demand	Anodyne	P2RY1	41	37
O[C@@H](CNc1ccccc1OCCF)COc1cccc2[nH]ccc12	ZINC000819487800	EG	On-Demand	Clean	ADRB2	21	59
O[C@@H](CNc1ccccc1OCCF)COc1cccc2[nH]ccc12	ZINC000819487800	EG	On-Demand	Clean	ADRB1	47	37
O[C@H](CNc1ccccc1OCCF)COc1cccc2[nH]ccc12	ZINC000819487801	EG	On-Demand	Clean	ADRB2	21	59
O[C@H](CNc1ccccc1OCCF)COc1cccc2[nH]ccc12	ZINC000819487801	EG	On-Demand	Clean	ADRB1	47	37
CCOc1ccc(OC[C@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819487835	FG	On-Demand	Anodyne	ADRB2	34	40
CCOc1ccc(OC[C@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819487835	FG	On-Demand	Anodyne	ADRB1	33	40
CCOc1ccc(OC[C@@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819487836	FG	On-Demand	Anodyne	ADRB2	34	40
CCOc1ccc(OC[C@@H](O)CNc2cc(F)c(F)cc2OC)cc1	ZINC000819487836	FG	On-Demand	Anodyne	ADRB1	33	40
O=C(CCCc1cccc(C(F)(F)F)c1)Nc1cnn[nH]1	ZINC000819487839	CF	On-Demand	Anodyne	CSNK1D	21	40
COc1cccc([C@@H](C)C(=O)Nc2cnn[nH]2)c1	ZINC000819487840	BD	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@@H](C)C(=O)Nc2cnn[nH]2)c1	ZINC000819487840	BD	On-Demand	Anodyne	MTNR1B	27	41
COc1cccc([C@@H](C)C(=O)Nc2cnn[nH]2)c1	ZINC000819487840	BD	On-Demand	Anodyne	TAAR1	29	40
COc1cccc([C@H](C)C(=O)Nc2cnn[nH]2)c1	ZINC000819487841	BD	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@H](C)C(=O)Nc2cnn[nH]2)c1	ZINC000819487841	BD	On-Demand	Anodyne	MTNR1B	27	41
COc1cccc([C@H](C)C(=O)Nc2cnn[nH]2)c1	ZINC000819487841	BD	On-Demand	Anodyne	TAAR1	29	40
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)Nc2cnn[nH]2)cc1	ZINC000819487846	FF	On-Demand	Anodyne	AGTR1	44	39
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)Nc2cnn[nH]2)cc1	ZINC000819487846	FF	On-Demand	Anodyne	LUCI_LUCLA	22	40
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)Nc2cnn[nH]2)cc1	ZINC000819487846	FF	On-Demand	Anodyne	NOD2	32	41
CON(C)C(=O)CCNc1cccc(CN2CC[C@H](O)C2)c1	ZINC000819487853	DD	On-Demand	Anodyne	OPRK1	24	46
CON(C)C(=O)CCNc1cccc(CN2CC[C@H](O)C2)c1	ZINC000819487853	DD	On-Demand	Anodyne	CCR3	45	37
CON(C)C(=O)CCNc1cccc(CN2CC[C@H](O)C2)c1	ZINC000819487853	DD	On-Demand	Anodyne	MCHR1	41	39
COC[C@@H](O)CNc1ccc(Cl)cc1OCc1ccccc1	ZINC000819487855	DG	On-Demand	Anodyne	PTGER1	68	42
COC[C@@H](O)CNc1ccc(Cl)cc1OCc1ccccc1	ZINC000819487855	DG	On-Demand	Anodyne	PDS	43	35
O=C(Nc1cnn[nH]1)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819487859	GF	On-Demand	Anodyne	OPRD1	49	32
O=C(Nc1cnn[nH]1)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819487859	GF	On-Demand	Anodyne	CFTR	76	51
CON(C)C(=O)CCNc1cccc(CN2CC[C@@H](O)C2)c1	ZINC000819487861	DD	On-Demand	Anodyne	OPRK1	24	46
CON(C)C(=O)CCNc1cccc(CN2CC[C@@H](O)C2)c1	ZINC000819487861	DD	On-Demand	Anodyne	CCR3	45	37
CON(C)C(=O)CCNc1cccc(CN2CC[C@@H](O)C2)c1	ZINC000819487861	DD	On-Demand	Anodyne	MCHR1	41	39
O=C(Nc1cnn[nH]1)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819487862	GF	On-Demand	Anodyne	OPRD1	49	32
O=C(Nc1cnn[nH]1)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1Cl	ZINC000819487862	GF	On-Demand	Anodyne	CFTR	76	51
O[C@@H](CNc1ccc2c(c1)CCCC2)c1cccnc1	ZINC000819487873	CG	On-Demand	Anodyne	ADRB2	29	42
O[C@@H](CNc1ccc2c(c1)CCCC2)c1cccnc1	ZINC000819487873	CG	On-Demand	Anodyne	ADRB3	101	45
O[C@H](CNc1ccc2c(c1)CCCC2)c1cccnc1	ZINC000819487875	CG	On-Demand	Anodyne	ADRB2	29	42
O[C@H](CNc1ccc2c(c1)CCCC2)c1cccnc1	ZINC000819487875	CG	On-Demand	Anodyne	ADRB3	101	45
COC(=O)C1=NOC2(CCN(C(=O)Cc3ccc(-n4cnnc4)cc3)CC2)C1	ZINC000819487885	GD	On-Demand	Anodyne	KCNJ1	57	38
NC(=O)c1ccc(NC[C@@H](O)COc2ccccc2)c(OCC(F)F)c1	ZINC000819487921	FE	On-Demand	Anodyne	ADRB2	37	42
NC(=O)c1ccc(NC[C@@H](O)COc2ccccc2)c(OCC(F)F)c1	ZINC000819487921	FE	On-Demand	Anodyne	ADRB1	57	36
NC(=O)c1ccc(NC[C@@H](O)COc2ccccc2)c(OCC(F)F)c1	ZINC000819487921	FE	On-Demand	Anodyne	ADRB3	32	41
NC(=O)c1ccc(NC[C@@H](O)COc2ccccc2)c(OCC(F)F)c1	ZINC000819487921	FE	On-Demand	Anodyne	ABCB1	23	40
NC(=O)c1ccc(NC[C@@H](O)COc2ccccc2)c(OCC(F)F)c1	ZINC000819487921	FE	On-Demand	Anodyne	PDS	49	33
NC(=O)c1ccc(NC[C@H](O)COc2ccccc2)c(OCC(F)F)c1	ZINC000819487924	FE	On-Demand	Anodyne	ADRB2	37	42
NC(=O)c1ccc(NC[C@H](O)COc2ccccc2)c(OCC(F)F)c1	ZINC000819487924	FE	On-Demand	Anodyne	ADRB1	57	36
NC(=O)c1ccc(NC[C@H](O)COc2ccccc2)c(OCC(F)F)c1	ZINC000819487924	FE	On-Demand	Anodyne	ADRB3	32	41
NC(=O)c1ccc(NC[C@H](O)COc2ccccc2)c(OCC(F)F)c1	ZINC000819487924	FE	On-Demand	Anodyne	ABCB1	23	40
NC(=O)c1ccc(NC[C@H](O)COc2ccccc2)c(OCC(F)F)c1	ZINC000819487924	FE	On-Demand	Anodyne	PDS	49	33
C=CCS(=O)(=O)CCNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819487940	ED	On-Demand	Mild	MTNR1A	19	40
C=CCS(=O)(=O)CCNC(=O)CCc1cccc(OC(F)F)c1	ZINC000819487940	ED	On-Demand	Mild	MTNR1B	16	40
CC(=O)c1cc(C(=O)NCC2OCCCO2)ccc1C	ZINC000819487949	CD	On-Demand	Anodyne	MAPK11	15	41
CC(=O)c1cc(C(=O)NCC2OCCCO2)ccc1C	ZINC000819487949	CD	On-Demand	Anodyne	MAPK14	20	45
NC(=O)c1ccc(NC[C@@H](O)c2cccnc2)c(OCC(F)F)c1	ZINC000819487960	ED	On-Demand	Anodyne	ADRB1	18	41
NC(=O)c1ccc(NC[C@@H](O)c2cccnc2)c(OCC(F)F)c1	ZINC000819487960	ED	On-Demand	Anodyne	ADRB3	57	41
NC(=O)c1ccc(NC[C@H](O)c2cccnc2)c(OCC(F)F)c1	ZINC000819487962	ED	On-Demand	Anodyne	ADRB1	18	41
NC(=O)c1ccc(NC[C@H](O)c2cccnc2)c(OCC(F)F)c1	ZINC000819487962	ED	On-Demand	Anodyne	ADRB3	57	41
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2)N1	ZINC000819487967	ED	On-Demand	Anodyne	ADRB2	31	40
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2)N1	ZINC000819487967	ED	On-Demand	Anodyne	ADRB1	60	44
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2)N1	ZINC000819487967	ED	On-Demand	Anodyne	ADRB3	35	40
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3ccc(F)cc3)cc2)N1	ZINC000819487968	ED	On-Demand	Anodyne	ADRB2	31	40
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3ccc(F)cc3)cc2)N1	ZINC000819487968	ED	On-Demand	Anodyne	ADRB1	60	44
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3ccc(F)cc3)cc2)N1	ZINC000819487968	ED	On-Demand	Anodyne	ADRB3	35	40
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2)N1	ZINC000819487970	ED	On-Demand	Anodyne	ADRB2	31	40
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2)N1	ZINC000819487970	ED	On-Demand	Anodyne	ADRB1	60	44
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3ccc(F)cc3)cc2)N1	ZINC000819487970	ED	On-Demand	Anodyne	ADRB3	35	40
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3ccc(F)cc3)cc2)N1	ZINC000819487973	ED	On-Demand	Anodyne	ADRB2	31	40
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3ccc(F)cc3)cc2)N1	ZINC000819487973	ED	On-Demand	Anodyne	ADRB1	60	44
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3ccc(F)cc3)cc2)N1	ZINC000819487973	ED	On-Demand	Anodyne	ADRB3	35	40
C[C@@](O)(CC(=O)NCC1OCCCO1)c1ccccc1	ZINC000819487985	CD	On-Demand	Anodyne	AMY2	46	32
O=C(Cn1c(C2CCCCC2)nc2ccccc21)Nc1cnn[nH]1	ZINC000819487988	DF	On-Demand	Anodyne	HRH1	18	48
O=C(Cn1c(C2CCCCC2)nc2ccccc21)Nc1cnn[nH]1	ZINC000819487988	DF	On-Demand	Anodyne	CDK5	18	42
O=C(Cn1c(C2CCCCC2)nc2ccccc21)Nc1cnn[nH]1	ZINC000819487988	DF	On-Demand	Anodyne	IMDH_CRYPV	33	41
N#Cc1ccc(OC[C@@H](O)CNc2ccc(C(N)=O)cc2OCC(F)F)cc1	ZINC000819487996	GE	On-Demand	Mild	ADRB1	59	36
N#Cc1ccc(OC[C@H](O)CNc2ccc(C(N)=O)cc2OCC(F)F)cc1	ZINC000819487999	GE	On-Demand	Mild	ADRB1	59	36
CNC(=O)c1cc(Oc2ccc(NCCC(=O)N(C)OC)cc2F)ccn1	ZINC000819488012	GE	On-Demand	Anodyne	RAF1	60	43
CNC(=O)c1cc(Oc2ccc(NCCC(=O)N(C)OC)cc2F)ccn1	ZINC000819488012	GE	On-Demand	Anodyne	KDR	21	41
CNC(=O)c1cc(Oc2ccc(NCCC(=O)N(C)OC)cc2F)ccn1	ZINC000819488012	GE	On-Demand	Anodyne	MET	41	41
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819488020	EF	On-Demand	Mild	ADRB2	25	40
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000819488020	EF	On-Demand	Mild	ADRB3	19	40
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819488023	EF	On-Demand	Mild	ADRB2	25	40
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000819488023	EF	On-Demand	Mild	ADRB3	19	40
O=C(CCNc1ccc(O[C@@H]2CC(=O)N2)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819488027	GG	On-Demand	Anodyne	KDR	15	43
O=C(CCNc1ccc(O[C@@H]2CC(=O)N2)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819488027	GG	On-Demand	Anodyne	EPHX2	17	43
O=C(CCNc1ccc(O[C@H]2CC(=O)N2)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819488028	GG	On-Demand	Anodyne	KDR	15	43
O=C(CCNc1ccc(O[C@H]2CC(=O)N2)cc1)Nc1cccc(C(F)(F)F)c1	ZINC000819488028	GG	On-Demand	Anodyne	EPHX2	17	43
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3ccccc3)cc2)N1	ZINC000819488044	ED	On-Demand	Anodyne	ADRB2	51	43
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3ccccc3)cc2)N1	ZINC000819488044	ED	On-Demand	Anodyne	ADRB1	79	43
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3ccccc3)cc2)N1	ZINC000819488044	ED	On-Demand	Anodyne	ADRB3	54	43
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3ccccc3)cc2)N1	ZINC000819488045	ED	On-Demand	Anodyne	ADRB2	51	43
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3ccccc3)cc2)N1	ZINC000819488045	ED	On-Demand	Anodyne	ADRB1	79	43
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3ccccc3)cc2)N1	ZINC000819488045	ED	On-Demand	Anodyne	ADRB3	54	43
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3ccccc3)cc2)N1	ZINC000819488046	ED	On-Demand	Anodyne	ADRB2	51	43
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3ccccc3)cc2)N1	ZINC000819488046	ED	On-Demand	Anodyne	ADRB1	79	43
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3ccccc3)cc2)N1	ZINC000819488046	ED	On-Demand	Anodyne	ADRB3	54	43
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3ccccc3)cc2)N1	ZINC000819488047	ED	On-Demand	Anodyne	ADRB2	51	43
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3ccccc3)cc2)N1	ZINC000819488047	ED	On-Demand	Anodyne	ADRB1	79	43
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3ccccc3)cc2)N1	ZINC000819488047	ED	On-Demand	Anodyne	ADRB3	54	43
NC(=O)c1ccc(NC[C@@H](O)COc2ccccc2F)c(OCC(F)F)c1	ZINC000819488048	GE	On-Demand	Anodyne	ADRB2	19	42
NC(=O)c1ccc(NC[C@@H](O)COc2ccccc2F)c(OCC(F)F)c1	ZINC000819488048	GE	On-Demand	Anodyne	ADRB1	55	41
NC(=O)c1ccc(NC[C@H](O)COc2ccccc2F)c(OCC(F)F)c1	ZINC000819488049	GE	On-Demand	Anodyne	ADRB2	19	42
NC(=O)c1ccc(NC[C@H](O)COc2ccccc2F)c(OCC(F)F)c1	ZINC000819488049	GE	On-Demand	Anodyne	ADRB1	55	41
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(C(F)(F)F)cc3)c2)C1	ZINC000819488052	GG	On-Demand	Anodyne	MCHR1	28	41
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccc(C(F)(F)F)cc3)c2)C1	ZINC000819488053	GG	On-Demand	Anodyne	MCHR1	28	41
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3ccc(C(F)(F)F)cc3)c2)C1	ZINC000819488054	GG	On-Demand	Anodyne	MCHR1	28	41
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1ccc(C(F)(F)F)cc1	ZINC000819488057	GG	On-Demand	Anodyne	MCHR1	28	41
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819488058	DG	On-Demand	Anodyne	ADRB2	31	54
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccccc1C	ZINC000819488058	DG	On-Demand	Anodyne	CYP2D6	21	44
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccccc1C	ZINC000819488059	DG	On-Demand	Anodyne	ADRB2	31	54
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccccc1C	ZINC000819488059	DG	On-Demand	Anodyne	CYP2D6	21	44
Cc1ccccc1[C@@H](O)CNc1cccc(CN2CC[C@H](O)C2)c1	ZINC000819488070	EF	On-Demand	Anodyne	OPRK1	17	42
Cc1ccccc1[C@@H](O)CNc1cccc(CN2CC[C@H](O)C2)c1	ZINC000819488070	EF	On-Demand	Anodyne	SIGMAR1	21	41
Cc1ccccc1[C@@H](O)CNc1cccc(CN2CC[C@@H](O)C2)c1	ZINC000819488071	EF	On-Demand	Anodyne	OPRK1	17	42
Cc1ccccc1[C@@H](O)CNc1cccc(CN2CC[C@@H](O)C2)c1	ZINC000819488071	EF	On-Demand	Anodyne	SIGMAR1	21	41
Cc1ccccc1[C@@H](CC(=O)NCC1OCCCO1)NC(N)=O	ZINC000819488082	DC	On-Demand	Anodyne	CTSA	55	35
Cc1ccccc1[C@H](CC(=O)NCC1OCCCO1)NC(N)=O	ZINC000819488083	DC	On-Demand	Anodyne	CTSA	55	35
O=C(Nc1cnn[nH]1)c1cccnc1SCC1CCCCC1	ZINC000819488084	DG	On-Demand	Anodyne	G2YM83_BOTF4	44	33
O=C(NCC1OCCCO1)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F	ZINC000819488095	GD	On-Demand	Anodyne	F2	50	43
O=C(NCC1OCCCO1)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F	ZINC000819488095	GD	On-Demand	Anodyne	ELANE	61	36
O=C(NCC1OCCCO1)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F	ZINC000819488095	GD	On-Demand	Anodyne	PREP	45	39
O=C(NCC1OCCCO1)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F	ZINC000819488095	GD	On-Demand	Anodyne	TMPRSS11D	51	33
O=C(NCC1OCCCO1)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F	ZINC000819488096	GD	On-Demand	Anodyne	F2	50	43
O=C(NCC1OCCCO1)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F	ZINC000819488096	GD	On-Demand	Anodyne	ELANE	61	36
O=C(NCC1OCCCO1)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F	ZINC000819488096	GD	On-Demand	Anodyne	PREP	45	39
O=C(NCC1OCCCO1)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F	ZINC000819488096	GD	On-Demand	Anodyne	TMPRSS11D	51	33
CNC(=O)COc1cccc(CC(=O)Nc2cnn[nH]2)c1	ZINC000819488100	CC	On-Demand	Anodyne	UPP1	49	33
O=C(NCC1OCCCO1)c1ccc(F)cc1-c1ccc(Cl)c(Cl)c1	ZINC000819488101	GI	On-Demand	Anodyne	P2RX7	24	40
O=C(/C=C\c1cccc(O)c1)Nc1cnn[nH]1	ZINC000819488104	BD	On-Demand	Anodyne	MMP2	17	58
O=C(/C=C\c1cccc(O)c1)Nc1cnn[nH]1	ZINC000819488104	BD	On-Demand	Anodyne	MMP9	17	58
O=C(/C=C/c1cccc(O)c1)Nc1cnn[nH]1	ZINC000819488105	BD	On-Demand	Anodyne	MMP2	17	58
O=C(/C=C/c1cccc(O)c1)Nc1cnn[nH]1	ZINC000819488105	BD	On-Demand	Anodyne	MMP9	17	58
C=CCc1ccc(OCC(=O)Nc2cnn[nH]2)c(OC)c1	ZINC000819488106	CD	On-Demand	Mild	ENPP1	62	34
O=C(CCc1nc(-c2cc(Br)cs2)no1)Nc1cnn[nH]1	ZINC000819488108	FE	On-Demand	Anodyne	HCAR2	24	40
O=C(Nc1cnn[nH]1)c1ccc(C(=O)c2cccc(O)c2)cc1	ZINC000819488109	DD	On-Demand	Anodyne	HSD17B1	28	44
O=C(Nc1cnn[nH]1)c1ccc(C(=O)c2cccc(O)c2)cc1	ZINC000819488109	DD	On-Demand	Anodyne	HSD17B2	28	44
O=C(Nc1cnn[nH]1)c1ccc(C(=O)c2cccc(O)c2)cc1	ZINC000819488109	DD	On-Demand	Anodyne	KCNK3	65	39
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819488135	EG	On-Demand	Clean	ADRB2	42	41
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819488135	EG	On-Demand	Clean	ADRB1	76	46
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819488135	EG	On-Demand	Clean	ADRB3	31	41
CC(=O)c1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819488135	EG	On-Demand	Clean	ABCB1	30	53
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819488136	EG	On-Demand	Clean	ADRB2	42	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819488136	EG	On-Demand	Clean	ADRB1	76	46
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819488136	EG	On-Demand	Clean	ADRB3	31	41
CC(=O)c1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819488136	EG	On-Demand	Clean	ABCB1	30	53
O=[N+]([O-])c1ccccc1OC[C@H](O)CNc1ccccc1OCCF	ZINC000819488137	FF	On-Demand	Clean	ADRB1	59	41
O=[N+]([O-])c1ccccc1OC[C@@H](O)CNc1ccccc1OCCF	ZINC000819488138	FF	On-Demand	Clean	ADRB1	59	41
OC1(CNc2ccccc2OCCF)CCCCC1	ZINC000819488144	CG	On-Demand	Anodyne	HCN1	49	31
OC1(CNc2ccccc2OCCF)CCCCC1	ZINC000819488144	CG	On-Demand	Anodyne	HCN4	47	31
O=C(/C=C\[C@H]1CCCO1)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000819488147	ED	On-Demand	Anodyne	F13A1	42	34
O=C(/C=C/[C@@H]1CCCO1)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000819488148	ED	On-Demand	Anodyne	F13A1	42	34
O=C(/C=C/[C@H]1CCCO1)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000819488149	ED	On-Demand	Anodyne	F13A1	42	34
O=C(/C=C\[C@@H]1CCCO1)Nc1ccc(S(=O)(=O)CCO)cc1	ZINC000819488150	ED	On-Demand	Anodyne	F13A1	42	34
O[C@@H](CNc1ccccc1OCCF)COc1cccc(Br)c1	ZINC000819488157	GH	On-Demand	Clean	ADRB1	47	43
O[C@@H](CNc1ccccc1OCCF)COc1cccc(Br)c1	ZINC000819488157	GH	On-Demand	Clean	PDS	36	40
O[C@H](CNc1ccccc1OCCF)COc1cccc(Br)c1	ZINC000819488158	GH	On-Demand	Clean	ADRB1	47	43
O[C@H](CNc1ccccc1OCCF)COc1cccc(Br)c1	ZINC000819488158	GH	On-Demand	Clean	PDS	36	40
CC(=O)Nc1cccc(CC(=O)Nc2cccc(CCCOC(C)=O)c2)c1	ZINC000819488179	FG	On-Demand	Anodyne	INHA	19	42
CC(=O)Nc1cccc(CC(=O)Nc2cccc(CCCOC(C)=O)c2)c1	ZINC000819488179	FG	On-Demand	Anodyne	MTNR1A	24	40
CC(=O)Nc1cccc(CC(=O)Nc2cccc(CCCOC(C)=O)c2)c1	ZINC000819488179	FG	On-Demand	Anodyne	MTNR1B	26	40
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCOCC2)c(C)c1	ZINC000819488188	DG	On-Demand	Mild	NPY2R	45	48
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCOCC2)c(C)c1	ZINC000819488188	DG	On-Demand	Mild	MAPK9	19	41
C=C(C)C(C)(C)C(=O)Nc1ccc(N2CCOCC2)c(C)c1	ZINC000819488188	DG	On-Demand	Mild	MAPK10	17	41
O=C(CSCc1coc(-c2ccccc2)n1)NCC1OCCCO1	ZINC000819488268	EE	On-Demand	Anodyne	PDE8B	54	34
O=C(NCC1OCCCO1)C1(OCc2ccccc2)CCOCC1	ZINC000819488277	ED	On-Demand	Anodyne	SLC12A5	47	34
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(C(F)(F)F)c3)c2)C1	ZINC000819488280	GG	On-Demand	Anodyne	OPRK1	15	42
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(C(F)(F)F)c3)c2)C1	ZINC000819488280	GG	On-Demand	Anodyne	CCR2	27	41
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(C(F)(F)F)c3)c2)C1	ZINC000819488280	GG	On-Demand	Anodyne	MCHR1	17	42
O=C(Nc1cnn[nH]1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819488281	EC	On-Demand	Anodyne	MAOB	17	41
O=C(Nc1cnn[nH]1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819488281	EC	On-Demand	Anodyne	CPT1A	61	37
O=C(Nc1cnn[nH]1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819488281	EC	On-Demand	Anodyne	CPT2	45	34
O=C(Nc1cnn[nH]1)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1	ZINC000819488281	EC	On-Demand	Anodyne	CPT1B	44	35
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(C(F)(F)F)c3)c2)C1	ZINC000819488283	GG	On-Demand	Anodyne	OPRK1	15	42
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(C(F)(F)F)c3)c2)C1	ZINC000819488283	GG	On-Demand	Anodyne	CCR2	27	41
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(C(F)(F)F)c3)c2)C1	ZINC000819488283	GG	On-Demand	Anodyne	MCHR1	17	42
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3cccc(C(F)(F)F)c3)c2)C1	ZINC000819488285	GG	On-Demand	Anodyne	OPRK1	15	42
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3cccc(C(F)(F)F)c3)c2)C1	ZINC000819488285	GG	On-Demand	Anodyne	CCR2	27	41
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3cccc(C(F)(F)F)c3)c2)C1	ZINC000819488285	GG	On-Demand	Anodyne	MCHR1	17	42
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(C(F)(F)F)c1	ZINC000819488288	GG	On-Demand	Anodyne	OPRK1	15	42
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(C(F)(F)F)c1	ZINC000819488288	GG	On-Demand	Anodyne	CCR2	27	41
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(C(F)(F)F)c1	ZINC000819488288	GG	On-Demand	Anodyne	MCHR1	17	42
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3ccc(Cl)c(Cl)c3)cc2)N1	ZINC000819488292	GG	On-Demand	Anodyne	GRIN1	29	43
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3ccc(Cl)c(Cl)c3)cc2)N1	ZINC000819488294	GG	On-Demand	Anodyne	GRIN1	29	43
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3ccc(Cl)c(Cl)c3)cc2)N1	ZINC000819488295	GG	On-Demand	Anodyne	GRIN1	29	43
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3ccc(Cl)c(Cl)c3)cc2)N1	ZINC000819488296	GG	On-Demand	Anodyne	GRIN1	29	43
CC(=O)Nc1ccc(O)c(C(=O)Nc2cnn[nH]2)c1	ZINC000819488300	CC	On-Demand	Anodyne	NR2E3	45	32
CC(=O)Nc1ccc(O)c(C(=O)Nc2cnn[nH]2)c1	ZINC000819488300	CC	On-Demand	Anodyne	Q25615_ONCVO	42	31
O=C(CSc1cc(Cl)ccc1Cl)Nc1cnn[nH]1	ZINC000819488302	DF	On-Demand	Anodyne	ALPL	42	36
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccccc1Cl	ZINC000819488378	EG	On-Demand	Anodyne	ADRB2	28	46
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccccc1Cl	ZINC000819488378	EG	On-Demand	Anodyne	CYP2D6	18	40
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819488380	EG	On-Demand	Anodyne	ADRB2	28	46
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccccc1Cl	ZINC000819488380	EG	On-Demand	Anodyne	CYP2D6	18	40
CNC(=O)c1cc(Oc2ccc(NCC3(O)CCCCC3)cc2F)ccn1	ZINC000819488394	FG	On-Demand	Anodyne	RAF1	64	43
CNC(=O)c1cc(Oc2ccc(NCC3(O)CCCCC3)cc2F)ccn1	ZINC000819488394	FG	On-Demand	Anodyne	KDR	23	40
CNC(=O)c1cc(Oc2ccc(NCC3(O)CCCCC3)cc2F)ccn1	ZINC000819488394	FG	On-Demand	Anodyne	MET	78	41
CS(=O)(=O)c1ccc([C@H](O)CNc2cccc(CN3CC[C@H](O)C3)c2)cc1	ZINC000819488407	GD	On-Demand	Anodyne	OPRK1	19	47
CS(=O)(=O)c1ccc([C@@H](O)CNc2cccc(CN3CC[C@H](O)C3)c2)cc1	ZINC000819488409	GD	On-Demand	Anodyne	OPRK1	19	47
CS(=O)(=O)c1ccc([C@@H](O)CNc2cccc(CN3CC[C@@H](O)C3)c2)cc1	ZINC000819488411	GD	On-Demand	Anodyne	OPRK1	19	47
CS(=O)(=O)c1ccc([C@H](O)CNc2cccc(CN3CC[C@@H](O)C3)c2)cc1	ZINC000819488413	GD	On-Demand	Anodyne	OPRK1	19	47
O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)NCC1OCCCO1	ZINC000819488414	FG	On-Demand	Anodyne	HDAC8	24	47
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819488446	GG	On-Demand	Anodyne	ADRB2	43	42
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819488446	GG	On-Demand	Anodyne	ADRB1	67	49
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819488446	GG	On-Demand	Anodyne	GRIN1	22	42
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819488446	GG	On-Demand	Anodyne	ADRB3	45	43
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819488446	GG	On-Demand	Anodyne	GYS1	45	34
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819488447	GG	On-Demand	Anodyne	ADRB2	43	42
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819488447	GG	On-Demand	Anodyne	ADRB1	67	49
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819488447	GG	On-Demand	Anodyne	GRIN1	22	42
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819488447	GG	On-Demand	Anodyne	ADRB3	45	43
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc(CCC(C)=O)cc1	ZINC000819488447	GG	On-Demand	Anodyne	GYS1	45	34
C=CCS(=O)(=O)CCNC(=O)[C@@H](CC)Cc1ccccc1C	ZINC000819488455	DE	On-Demand	Mild	MME	15	41
C=CCS(=O)(=O)CCNC(=O)[C@H](CC)Cc1ccccc1C	ZINC000819488457	DE	On-Demand	Mild	MME	15	41
O=C(COc1ccc(OCc2ccccc2)cc1)NCC1OCCCO1	ZINC000819488471	FF	On-Demand	Anodyne	ALOX5	15	47
O=C(COc1ccc(OCc2ccccc2)cc1)NCC1OCCCO1	ZINC000819488471	FF	On-Demand	Anodyne	MAOB	31	40
O=C(COc1ccc(OCc2ccccc2)cc1)NCC1OCCCO1	ZINC000819488471	FF	On-Demand	Anodyne	LTA4H	34	46
O=C(COc1ccc(OCc2ccccc2)cc1)NCC1OCCCO1	ZINC000819488471	FF	On-Demand	Anodyne	CYSLTR2	43	33
O=C(COc1ccc(OCc2ccccc2)cc1)NCC1OCCCO1	ZINC000819488471	FF	On-Demand	Anodyne	ADAM17	23	44
O=C(COc1ccc(OCc2ccccc2)cc1)NCC1OCCCO1	ZINC000819488471	FF	On-Demand	Anodyne	FAAH	18	40
O=C(COc1ccc(OCc2ccccc2)cc1)NCC1OCCCO1	ZINC000819488471	FF	On-Demand	Anodyne	FFAR1	45	46
O=C(COc1ccc(OCc2ccccc2)cc1)NCC1OCCCO1	ZINC000819488471	FF	On-Demand	Anodyne	MBTPS1	19	41
O=C(Nc1cnn[nH]1)C1(c2cc(F)cc(C(F)(F)F)c2)CC1	ZINC000819488475	DF	On-Demand	Anodyne	ATF1	45	37
O=C(Nc1cnn[nH]1)C1(c2cc(F)cc(C(F)(F)F)c2)CC1	ZINC000819488475	DF	On-Demand	Anodyne	NFKB1	41	37
O=C(Nc1cnn[nH]1)c1ccc(COc2ccc3ccccc3c2)o1	ZINC000819488510	EG	On-Demand	Anodyne	CYSLTR1	54	38
O=C(NCCCc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488514	DC	On-Demand	Anodyne	FKBP1A	18	42
O=C(NCCCc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488514	DC	On-Demand	Anodyne	MTNR1A	34	41
O=C(NCCCc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488514	DC	On-Demand	Anodyne	MTNR1B	36	41
O=C(NCCCc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488514	DC	On-Demand	Anodyne	FAAH	49	36
O=C(NCCCc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488514	DC	On-Demand	Anodyne	CES1	53	35
O=C(NCCCc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488514	DC	On-Demand	Anodyne	AMP1_PLAFQ	25	45
O=C(NCCCc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488514	DC	On-Demand	Anodyne	CRTM	34	41
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)Nc1cnn[nH]1	ZINC000819488515	FC	On-Demand	Anodyne	MMP13	25	41
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)Nc1cnn[nH]1	ZINC000819488515	FC	On-Demand	Anodyne	MMP2	25	41
O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)Nc1cnn[nH]1	ZINC000819488515	FC	On-Demand	Anodyne	MMP14	18	41
CCOc1ccc(OC[C@@H](O)CNc2cccc(OC(=O)NC)c2)cc1	ZINC000819488572	FF	On-Demand	Anodyne	ADRB2	47	43
CCOc1ccc(OC[C@@H](O)CNc2cccc(OC(=O)NC)c2)cc1	ZINC000819488572	FF	On-Demand	Anodyne	ADRB1	62	41
CCOc1ccc(OC[C@@H](O)CNc2cccc(OC(=O)NC)c2)cc1	ZINC000819488572	FF	On-Demand	Anodyne	ADRB3	39	41
CCOc1ccc(OC[C@@H](O)CNc2cccc(OC(=O)NC)c2)cc1	ZINC000819488572	FF	On-Demand	Anodyne	FAAH	18	40
CCOc1ccc(OC[C@@H](O)CNc2cccc(OC(=O)NC)c2)cc1	ZINC000819488572	FF	On-Demand	Anodyne	PDS	87	38
CCOc1ccc(OC[C@H](O)CNc2cccc(OC(=O)NC)c2)cc1	ZINC000819488573	FF	On-Demand	Anodyne	ADRB2	47	43
CCOc1ccc(OC[C@H](O)CNc2cccc(OC(=O)NC)c2)cc1	ZINC000819488573	FF	On-Demand	Anodyne	ADRB1	62	41
CCOc1ccc(OC[C@H](O)CNc2cccc(OC(=O)NC)c2)cc1	ZINC000819488573	FF	On-Demand	Anodyne	ADRB3	39	41
CCOc1ccc(OC[C@H](O)CNc2cccc(OC(=O)NC)c2)cc1	ZINC000819488573	FF	On-Demand	Anodyne	FAAH	18	40
CCOc1ccc(OC[C@H](O)CNc2cccc(OC(=O)NC)c2)cc1	ZINC000819488573	FF	On-Demand	Anodyne	PDS	87	38
O[C@@H](CNc1ccccc1OCCF)COc1ccccc1	ZINC000819488574	DF	On-Demand	Clean	ADRB2	48	49
O[C@@H](CNc1ccccc1OCCF)COc1ccccc1	ZINC000819488574	DF	On-Demand	Clean	ADRB1	67	42
O[C@@H](CNc1ccccc1OCCF)COc1ccccc1	ZINC000819488574	DF	On-Demand	Clean	ADRB3	32	46
O[C@H](CNc1ccccc1OCCF)COc1ccccc1	ZINC000819488575	DF	On-Demand	Clean	ADRB2	48	49
O[C@H](CNc1ccccc1OCCF)COc1ccccc1	ZINC000819488575	DF	On-Demand	Clean	ADRB1	67	42
O[C@H](CNc1ccccc1OCCF)COc1ccccc1	ZINC000819488575	DF	On-Demand	Clean	ADRB3	32	46
CCOC[C@H](O)CNc1ccccc1OCCF	ZINC000819488578	CD	On-Demand	Clean	ADRB2	23	40
O[C@H](CNc1ccc([C@H]2CCOC2)cc1)c1cccnc1	ZINC000819488584	CF	On-Demand	Anodyne	ADRB3	73	45
O[C@H](CNc1ccc([C@@H]2CCOC2)cc1)c1cccnc1	ZINC000819488585	CF	On-Demand	Anodyne	ADRB3	73	45
O[C@@H](CNc1ccc([C@H]2CCOC2)cc1)c1cccnc1	ZINC000819488586	CF	On-Demand	Anodyne	ADRB3	73	45
O[C@@H](CNc1ccc([C@@H]2CCOC2)cc1)c1cccnc1	ZINC000819488587	CF	On-Demand	Anodyne	ADRB3	73	45
CC(=O)Nc1ncccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819488597	GF	On-Demand	Mild	PAPA1_CARPA	45	44
CC(=O)Nc1ncccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819488598	GF	On-Demand	Mild	PAPA1_CARPA	45	44
O[C@@H](CCc1ccccc1)CNc1ccccc1OCCF	ZINC000819488606	DG	On-Demand	Clean	ABCB1	42	39
O[C@H](CCc1ccccc1)CNc1ccccc1OCCF	ZINC000819488607	DG	On-Demand	Clean	ABCB1	42	39
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)c3cccnc3)cc2)N1	ZINC000819488624	CD	On-Demand	Anodyne	ADRB3	90	44
O=C1C[C@@H](Oc2ccc(NC[C@H](O)c3cccnc3)cc2)N1	ZINC000819488625	CD	On-Demand	Anodyne	ADRB3	90	44
O=C1C[C@H](Oc2ccc(NC[C@H](O)c3cccnc3)cc2)N1	ZINC000819488626	CD	On-Demand	Anodyne	ADRB3	90	44
O=C1C[C@H](Oc2ccc(NC[C@@H](O)c3cccnc3)cc2)N1	ZINC000819488627	CD	On-Demand	Anodyne	ADRB3	90	44
CCn1c(NC(=O)/C=C\[C@@H]2CCCO2)nc2cc(F)ccc21	ZINC000819488628	DF	On-Demand	Anodyne	ITK	45	42
CCn1c(NC(=O)/C=C/[C@H]2CCCO2)nc2cc(F)ccc21	ZINC000819488629	DF	On-Demand	Anodyne	ITK	45	42
CCn1c(NC(=O)/C=C/[C@@H]2CCCO2)nc2cc(F)ccc21	ZINC000819488630	DF	On-Demand	Anodyne	ITK	45	42
CCn1c(NC(=O)/C=C\[C@H]2CCCO2)nc2cc(F)ccc21	ZINC000819488631	DF	On-Demand	Anodyne	ITK	45	42
Cc1ccccc1[C@@H](O)CNc1cccc(OC(C)C)c1	ZINC000819488638	CH	On-Demand	Anodyne	KCNK3	42	36
Cc1ccccc1[C@@H](O)CNc1cccc(OC(C)C)c1	ZINC000819488638	CH	On-Demand	Anodyne	KCNK9	45	36
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3ccc(Cl)cc3)cc2)N1	ZINC000819488656	FE	On-Demand	Anodyne	ADRB1	56	43
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3ccc(Cl)cc3)cc2)N1	ZINC000819488656	FE	On-Demand	Anodyne	GRIN1	23	44
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3ccc(Cl)cc3)cc2)N1	ZINC000819488657	FE	On-Demand	Anodyne	ADRB1	56	43
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3ccc(Cl)cc3)cc2)N1	ZINC000819488657	FE	On-Demand	Anodyne	GRIN1	23	44
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3ccc(Cl)cc3)cc2)N1	ZINC000819488658	FE	On-Demand	Anodyne	ADRB1	56	43
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3ccc(Cl)cc3)cc2)N1	ZINC000819488658	FE	On-Demand	Anodyne	GRIN1	23	44
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3ccc(Cl)cc3)cc2)N1	ZINC000819488659	FE	On-Demand	Anodyne	ADRB1	56	43
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3ccc(Cl)cc3)cc2)N1	ZINC000819488659	FE	On-Demand	Anodyne	GRIN1	23	44
O=C1CCc2cc(OC[C@@H](O)CNc3ccc(O[C@H]4CC(=O)N4)cc3)ccc2N1	ZINC000819488672	GD	On-Demand	Anodyne	ADRB1	16	40
O=C1CCc2cc(OC[C@H](O)CNc3ccc(O[C@@H]4CC(=O)N4)cc3)ccc2N1	ZINC000819488673	GD	On-Demand	Anodyne	ADRB1	16	40
O=C1CCc2cc(OC[C@H](O)CNc3ccc(O[C@H]4CC(=O)N4)cc3)ccc2N1	ZINC000819488674	GD	On-Demand	Anodyne	ADRB1	16	40
O=C1CCc2cc(OC[C@@H](O)CNc3ccc(O[C@@H]4CC(=O)N4)cc3)ccc2N1	ZINC000819488675	GD	On-Demand	Anodyne	ADRB1	16	40
O=C1CCCN1C[C@@H](O)CNc1ccc(Cl)cc1OCc1ccccc1	ZINC000819488689	FG	On-Demand	Anodyne	PTGER1	76	42
O=C1CCCN1C[C@H](O)CNc1ccc(Cl)cc1OCc1ccccc1	ZINC000819488690	FG	On-Demand	Anodyne	PTGER1	76	42
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819488697	GD	On-Demand	Anodyne	ADRB2	35	43
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819488697	GD	On-Demand	Anodyne	ADRB1	63	43
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819488697	GD	On-Demand	Anodyne	ADRB3	42	43
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819488698	GD	On-Demand	Anodyne	ADRB2	35	43
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819488698	GD	On-Demand	Anodyne	ADRB1	63	43
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819488698	GD	On-Demand	Anodyne	ADRB3	42	43
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819488699	GD	On-Demand	Anodyne	ADRB2	35	43
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819488699	GD	On-Demand	Anodyne	ADRB1	63	43
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819488699	GD	On-Demand	Anodyne	ADRB3	42	43
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819488700	GD	On-Demand	Anodyne	ADRB2	35	43
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819488700	GD	On-Demand	Anodyne	ADRB1	63	43
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819488700	GD	On-Demand	Anodyne	ADRB3	42	43
N#Cc1cc(C(=O)Nc2cnn[nH]2)ccc1F	ZINC000819488721	BD	On-Demand	Mild	MAOB	18	42
N#Cc1cc(C(=O)Nc2cnn[nH]2)ccc1F	ZINC000819488721	BD	On-Demand	Mild	TAAR1	17	54
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488727	FD	On-Demand	Anodyne	MME	21	43
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488727	FD	On-Demand	Anodyne	NPR1	40	33
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488727	FD	On-Demand	Anodyne	TACR2	18	41
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488727	FD	On-Demand	Anodyne	CTSL	32	47
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488727	FD	On-Demand	Anodyne	PCSK5	39	40
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488727	FD	On-Demand	Anodyne	FURIN	67	51
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488727	FD	On-Demand	Anodyne	CTSS	19	44
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488727	FD	On-Demand	Anodyne	FPR1	40	39
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488727	FD	On-Demand	Anodyne	POLG_WNV	46	34
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488728	FD	On-Demand	Anodyne	MME	21	43
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488728	FD	On-Demand	Anodyne	NPR1	40	33
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488728	FD	On-Demand	Anodyne	TACR2	18	41
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488728	FD	On-Demand	Anodyne	CTSL	32	47
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488728	FD	On-Demand	Anodyne	PCSK5	39	40
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488728	FD	On-Demand	Anodyne	FURIN	67	51
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488728	FD	On-Demand	Anodyne	CTSS	19	44
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488728	FD	On-Demand	Anodyne	FPR1	40	39
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)NCC1OCCCO1	ZINC000819488728	FD	On-Demand	Anodyne	POLG_WNV	46	34
O=C(Nc1cnn[nH]1)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000819488733	ED	On-Demand	Anodyne	CPT1A	134	46
O=C(Nc1cnn[nH]1)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000819488733	ED	On-Demand	Anodyne	CPT2	53	44
O=C(Nc1cnn[nH]1)[C@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000819488734	ED	On-Demand	Anodyne	CPT1A	134	46
O=C(Nc1cnn[nH]1)[C@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000819488734	ED	On-Demand	Anodyne	CPT2	53	44
COC(=O)Nc1cc(C(=O)Nc2cnn[nH]2)cc(C(F)(F)F)c1	ZINC000819488739	EE	On-Demand	Anodyne	JUN	24	48
COC(=O)Nc1cc(C(=O)Nc2cnn[nH]2)cc(C(F)(F)F)c1	ZINC000819488739	EE	On-Demand	Anodyne	ATF1	61	42
COC(=O)Nc1cc(C(=O)Nc2cnn[nH]2)cc(C(F)(F)F)c1	ZINC000819488739	EE	On-Demand	Anodyne	NFKB1	57	42
O=C(Nc1cnn[nH]1)c1csc(-c2c(F)cccc2F)n1	ZINC000819488749	DE	On-Demand	Anodyne	PIM1	21	51
O=C(Nc1cnn[nH]1)[C@H](O)Cc1cccc(C(F)(F)F)c1	ZINC000819488751	DD	On-Demand	Anodyne	CSNK1D	23	40
O=C(Nc1cnn[nH]1)[C@H](O)Cc1cccc(C(F)(F)F)c1	ZINC000819488751	DD	On-Demand	Anodyne	PDS	41	33
O=C(Nc1cnn[nH]1)[C@@H](O)Cc1cccc(C(F)(F)F)c1	ZINC000819488753	DD	On-Demand	Anodyne	CSNK1D	23	40
O=C(Nc1cnn[nH]1)[C@@H](O)Cc1cccc(C(F)(F)F)c1	ZINC000819488753	DD	On-Demand	Anodyne	PDS	41	33
O=C(Nc1cnn[nH]1)c1ccc(CSc2ccc(Cl)cc2)cc1	ZINC000819488755	EI	On-Demand	Anodyne	NOD1	15	40
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3Cl)c2)C1	ZINC000819488762	EG	On-Demand	Anodyne	OPRK1	15	41
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3Cl)c2)C1	ZINC000819488762	EG	On-Demand	Anodyne	SIGMAR1	31	41
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3Cl)c2)C1	ZINC000819488762	EG	On-Demand	Anodyne	MCHR1	15	41
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3Cl)c2)C1	ZINC000819488764	EG	On-Demand	Anodyne	OPRK1	15	41
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3Cl)c2)C1	ZINC000819488764	EG	On-Demand	Anodyne	SIGMAR1	31	41
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3Cl)c2)C1	ZINC000819488764	EG	On-Demand	Anodyne	MCHR1	15	41
O=C(CCCCCNC(=O)NC1CCCCC1)Nc1cnn[nH]1	ZINC000819488774	DD	On-Demand	Anodyne	EPHX2	18	52
CNC(=O)c1cc(Oc2ccc(NC[C@H](O)C3CC3)cc2F)ccn1	ZINC000819488784	EF	On-Demand	Anodyne	RAF1	63	43
CNC(=O)c1cc(Oc2ccc(NC[C@H](O)C3CC3)cc2F)ccn1	ZINC000819488784	EF	On-Demand	Anodyne	KDR	19	41
CNC(=O)c1cc(Oc2ccc(NC[C@H](O)C3CC3)cc2F)ccn1	ZINC000819488784	EF	On-Demand	Anodyne	MET	59	41
CNC(=O)c1cc(Oc2ccc(NC[C@@H](O)C3CC3)cc2F)ccn1	ZINC000819488786	EF	On-Demand	Anodyne	RAF1	63	43
CNC(=O)c1cc(Oc2ccc(NC[C@@H](O)C3CC3)cc2F)ccn1	ZINC000819488786	EF	On-Demand	Anodyne	KDR	19	41
CNC(=O)c1cc(Oc2ccc(NC[C@@H](O)C3CC3)cc2F)ccn1	ZINC000819488786	EF	On-Demand	Anodyne	MET	59	41
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2ccc(-c3ccccn3)cc2)CC1	ZINC000819488805	GI	On-Demand	Anodyne	GPR119	28	45
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2ccc(-c3ccccn3)cc2)CC1	ZINC000819488806	GI	On-Demand	Anodyne	GPR119	28	45
CNC(=O)c1cc(Oc2ccc(NCCS(C)(=O)=O)cc2F)ccn1	ZINC000819488809	FD	On-Demand	Anodyne	RAF1	64	42
CNC(=O)c1cc(Oc2ccc(NCCS(C)(=O)=O)cc2F)ccn1	ZINC000819488809	FD	On-Demand	Anodyne	KDR	23	42
CNC(=O)c1cc(Oc2ccc(NCCS(C)(=O)=O)cc2F)ccn1	ZINC000819488809	FD	On-Demand	Anodyne	MET	65	46
CNC(=O)c1cc(Oc2cccc(NCCS(C)(=O)=O)c2)ccn1	ZINC000819488823	ED	On-Demand	Anodyne	RAF1	75	49
Cc1ccc(OC[C@@H](O)CNc2ccc(C(N)=O)cc2OCC(F)F)cc1	ZINC000819488837	GF	On-Demand	Anodyne	ADRB2	30	45
Cc1ccc(OC[C@@H](O)CNc2ccc(C(N)=O)cc2OCC(F)F)cc1	ZINC000819488837	GF	On-Demand	Anodyne	ADRB1	37	42
Cc1ccc(OC[C@H](O)CNc2ccc(C(N)=O)cc2OCC(F)F)cc1	ZINC000819488839	GF	On-Demand	Anodyne	ADRB2	30	45
Cc1ccc(OC[C@H](O)CNc2ccc(C(N)=O)cc2OCC(F)F)cc1	ZINC000819488839	GF	On-Demand	Anodyne	ADRB1	37	42
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(Cl)c3)c2)C1	ZINC000819488840	EG	On-Demand	Anodyne	ADRB1	27	41
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(Cl)c3)c2)C1	ZINC000819488840	EG	On-Demand	Anodyne	OPRK1	18	42
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(Cl)c3)c2)C1	ZINC000819488840	EG	On-Demand	Anodyne	ADRB3	41	39
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(Cl)c3)c2)C1	ZINC000819488840	EG	On-Demand	Anodyne	IGF1R	27	40
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(Cl)c3)c2)C1	ZINC000819488840	EG	On-Demand	Anodyne	SIGMAR1	17	41
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(Cl)c3)c2)C1	ZINC000819488840	EG	On-Demand	Anodyne	CYP3A4	46	40
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(Cl)c3)c2)C1	ZINC000819488842	EG	On-Demand	Anodyne	ADRB1	27	41
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(Cl)c3)c2)C1	ZINC000819488842	EG	On-Demand	Anodyne	OPRK1	18	42
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(Cl)c3)c2)C1	ZINC000819488842	EG	On-Demand	Anodyne	ADRB3	41	39
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(Cl)c3)c2)C1	ZINC000819488842	EG	On-Demand	Anodyne	IGF1R	27	40
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(Cl)c3)c2)C1	ZINC000819488842	EG	On-Demand	Anodyne	SIGMAR1	17	41
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc(Cl)c3)c2)C1	ZINC000819488842	EG	On-Demand	Anodyne	CYP3A4	46	40
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3cccc(Cl)c3)c2)C1	ZINC000819488844	EG	On-Demand	Anodyne	ADRB1	27	41
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3cccc(Cl)c3)c2)C1	ZINC000819488844	EG	On-Demand	Anodyne	OPRK1	18	42
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3cccc(Cl)c3)c2)C1	ZINC000819488844	EG	On-Demand	Anodyne	ADRB3	41	39
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3cccc(Cl)c3)c2)C1	ZINC000819488844	EG	On-Demand	Anodyne	IGF1R	27	40
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3cccc(Cl)c3)c2)C1	ZINC000819488844	EG	On-Demand	Anodyne	SIGMAR1	17	41
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3cccc(Cl)c3)c2)C1	ZINC000819488844	EG	On-Demand	Anodyne	CYP3A4	46	40
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(Cl)c1	ZINC000819488845	EG	On-Demand	Anodyne	ADRB1	27	41
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(Cl)c1	ZINC000819488845	EG	On-Demand	Anodyne	OPRK1	18	42
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(Cl)c1	ZINC000819488845	EG	On-Demand	Anodyne	ADRB3	41	39
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(Cl)c1	ZINC000819488845	EG	On-Demand	Anodyne	IGF1R	27	40
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(Cl)c1	ZINC000819488845	EG	On-Demand	Anodyne	SIGMAR1	17	41
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1cccc(Cl)c1	ZINC000819488845	EG	On-Demand	Anodyne	CYP3A4	46	40
O[C@@H](CNc1cccc(C2CCC2)c1)c1cccnc1	ZINC000819488853	CG	On-Demand	Anodyne	ADRB1	19	41
O[C@@H](CNc1cccc(C2CCC2)c1)c1cccnc1	ZINC000819488853	CG	On-Demand	Anodyne	ADRB3	81	46
O[C@H](CNc1cccc(C2CCC2)c1)c1cccnc1	ZINC000819488854	CG	On-Demand	Anodyne	ADRB1	19	41
O[C@H](CNc1cccc(C2CCC2)c1)c1cccnc1	ZINC000819488854	CG	On-Demand	Anodyne	ADRB3	81	46
NC(=O)c1ccc(NC[C@@H](O)COc2ccc(F)cc2)c(OCC(F)F)c1	ZINC000819488868	GE	On-Demand	Anodyne	ADRB2	29	41
NC(=O)c1ccc(NC[C@@H](O)COc2ccc(F)cc2)c(OCC(F)F)c1	ZINC000819488868	GE	On-Demand	Anodyne	ADRB1	51	36
NC(=O)c1ccc(NC[C@H](O)COc2ccc(F)cc2)c(OCC(F)F)c1	ZINC000819488870	GE	On-Demand	Anodyne	ADRB2	29	41
NC(=O)c1ccc(NC[C@H](O)COc2ccc(F)cc2)c(OCC(F)F)c1	ZINC000819488870	GE	On-Demand	Anodyne	ADRB1	51	36
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3C(F)(F)F)c2)C1	ZINC000819488873	GG	On-Demand	Anodyne	OPRK1	16	41
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3C(F)(F)F)c2)C1	ZINC000819488873	GG	On-Demand	Anodyne	SIGMAR1	15	40
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3C(F)(F)F)c2)C1	ZINC000819488875	GG	On-Demand	Anodyne	OPRK1	16	41
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3ccccc3C(F)(F)F)c2)C1	ZINC000819488875	GG	On-Demand	Anodyne	SIGMAR1	15	40
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3ccccc3C(F)(F)F)c2)C1	ZINC000819488877	GG	On-Demand	Anodyne	OPRK1	16	41
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3ccccc3C(F)(F)F)c2)C1	ZINC000819488877	GG	On-Demand	Anodyne	SIGMAR1	15	40
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1ccccc1C(F)(F)F	ZINC000819488879	GG	On-Demand	Anodyne	OPRK1	16	41
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1ccccc1C(F)(F)F	ZINC000819488879	GG	On-Demand	Anodyne	SIGMAR1	15	40
O=C(Nc1cnn[nH]1)c1ccc(OCC2CCCCC2)cc1	ZINC000819488894	DG	On-Demand	Anodyne	HPGD	24	40
CC[C@@H](C)n1c(C(F)(F)F)nc2cc(NC[C@H](O)c3cccnc3)ccc21	ZINC000819488941	GJ	On-Demand	Anodyne	ADRB3	79	38
CC[C@@H](C)n1c(C(F)(F)F)nc2cc(NC[C@@H](O)c3cccnc3)ccc21	ZINC000819488945	GJ	On-Demand	Anodyne	ADRB3	79	38
O[C@H](CNc1ccccc1OCCF)COc1ccccc1Cl	ZINC000819488969	EH	On-Demand	Clean	ADRB2	22	51
O[C@H](CNc1ccccc1OCCF)COc1ccccc1Cl	ZINC000819488969	EH	On-Demand	Clean	ADRB1	55	39
O[C@@H](CNc1ccccc1OCCF)COc1ccccc1Cl	ZINC000819488971	EH	On-Demand	Clean	ADRB2	22	51
O[C@@H](CNc1ccccc1OCCF)COc1ccccc1Cl	ZINC000819488971	EH	On-Demand	Clean	ADRB1	55	39
COc1cc(NC[C@H](O)c2ccc(C)cc2)cc(OC)c1C	ZINC000819488977	DG	On-Demand	Anodyne	ADRB2	16	48
COc1cc(NC[C@@H](O)c2ccc(C)cc2)cc(OC)c1C	ZINC000819488979	DG	On-Demand	Anodyne	ADRB2	16	48
N#Cc1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819488981	EF	On-Demand	Mild	ADRB2	34	40
N#Cc1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819488981	EF	On-Demand	Mild	ADRB1	67	49
N#Cc1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819488981	EF	On-Demand	Mild	CASR	41	37
N#Cc1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819488984	EF	On-Demand	Mild	ADRB2	34	40
N#Cc1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819488984	EF	On-Demand	Mild	ADRB1	67	49
N#Cc1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819488984	EF	On-Demand	Mild	CASR	41	37
COc1cc(I)ccc1NC[C@@H](C)O	ZINC000819489009	DE	On-Demand	Anodyne	P2RX2	30	40
COc1cc(I)ccc1NC[C@H](C)O	ZINC000819489011	DE	On-Demand	Anodyne	P2RX2	30	40
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)c(C)c2)c1	ZINC000819489016	FF	On-Demand	Anodyne	HTR1D	23	42
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)c(C)c2)c1	ZINC000819489016	FF	On-Demand	Anodyne	HTR1B	27	42
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)c(C)c2)c1	ZINC000819489016	FF	On-Demand	Anodyne	NPY2R	44	43
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)c(C)c2)c1	ZINC000819489016	FF	On-Demand	Anodyne	PIK3CA	23	49
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)c(C)c2)c1	ZINC000819489016	FF	On-Demand	Anodyne	PIK3CD	24	49
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)c(C)c2)c1	ZINC000819489016	FF	On-Demand	Anodyne	EPHX2	20	42
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)c(C)c2)c1	ZINC000819489016	FF	On-Demand	Anodyne	PIK3CB	38	49
CC(=O)Nc1cccc(CC(=O)Nc2ccc(N3CCOCC3)c(C)c2)c1	ZINC000819489016	FF	On-Demand	Anodyne	TAAR1	24	40
O[C@H](CNc1ccc([C@@H]2CCOC2)cc1)c1ccc(OC(F)(F)F)cc1	ZINC000819489030	FI	On-Demand	Anodyne	CTSS	19	45
O[C@H](CNc1ccc([C@H]2CCOC2)cc1)c1ccc(OC(F)(F)F)cc1	ZINC000819489032	FI	On-Demand	Anodyne	CTSS	19	45
O[C@@H](CNc1ccc([C@@H]2CCOC2)cc1)c1ccc(OC(F)(F)F)cc1	ZINC000819489034	FI	On-Demand	Anodyne	CTSS	19	45
O[C@@H](CNc1ccc([C@H]2CCOC2)cc1)c1ccc(OC(F)(F)F)cc1	ZINC000819489036	FI	On-Demand	Anodyne	CTSS	19	45
O[C@H](CNc1ccccc1OCCF)CN1CCOCC1	ZINC000819489072	CD	On-Demand	Clean	ABCB1	50	43
O[C@@H](CNc1ccccc1OCCF)CN1CCOCC1	ZINC000819489073	CD	On-Demand	Clean	ABCB1	50	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccccc2OCCF)c1	ZINC000819489078	FF	On-Demand	Clean	ADRB2	19	43
O=[N+]([O-])c1cccc(OC[C@@H](O)CNc2ccccc2OCCF)c1	ZINC000819489078	FF	On-Demand	Clean	ADRB1	44	45
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccccc2OCCF)c1	ZINC000819489080	FF	On-Demand	Clean	ADRB2	19	43
O=[N+]([O-])c1cccc(OC[C@H](O)CNc2ccccc2OCCF)c1	ZINC000819489080	FF	On-Demand	Clean	ADRB1	44	45
COc1cc(NC[C@H](O)c2ccccc2)cc(OC)c1C	ZINC000819489106	CG	On-Demand	Anodyne	ADRB2	24	46
COc1cc(NC[C@H](O)c2ccccc2)cc(OC)c1C	ZINC000819489106	CG	On-Demand	Anodyne	ADRB3	36	42
COc1cc(NC[C@H](O)c2ccccc2)cc(OC)c1C	ZINC000819489106	CG	On-Demand	Anodyne	AOC3	17	44
COc1cc(NC[C@@H](O)c2ccccc2)cc(OC)c1C	ZINC000819489107	CG	On-Demand	Anodyne	ADRB2	24	46
COc1cc(NC[C@@H](O)c2ccccc2)cc(OC)c1C	ZINC000819489107	CG	On-Demand	Anodyne	ADRB3	36	42
COc1cc(NC[C@@H](O)c2ccccc2)cc(OC)c1C	ZINC000819489107	CG	On-Demand	Anodyne	AOC3	17	44
O[C@H](CNc1ccc([C@@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819489112	DH	On-Demand	Anodyne	ADRB1	24	44
O[C@H](CNc1ccc([C@@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819489112	DH	On-Demand	Anodyne	CYP3A4	48	36
O[C@H](CNc1ccc([C@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819489113	DH	On-Demand	Anodyne	ADRB1	24	44
O[C@H](CNc1ccc([C@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819489113	DH	On-Demand	Anodyne	CYP3A4	48	36
O[C@@H](CNc1ccc([C@@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819489114	DH	On-Demand	Anodyne	ADRB1	24	44
O[C@@H](CNc1ccc([C@@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819489114	DH	On-Demand	Anodyne	CYP3A4	48	36
O[C@@H](CNc1ccc([C@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819489115	DH	On-Demand	Anodyne	ADRB1	24	44
O[C@@H](CNc1ccc([C@H]2CCOC2)cc1)c1cccc(Cl)c1	ZINC000819489115	DH	On-Demand	Anodyne	CYP3A4	48	36
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819489124	FF	On-Demand	Anodyne	EDNRB	57	35
COc1cc(F)c(F)cc1NC[C@H](O)COc1ccc2c(c1)OCO2	ZINC000819489124	FF	On-Demand	Anodyne	EDNRA	56	38
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819489125	FF	On-Demand	Anodyne	EDNRB	57	35
COc1cc(F)c(F)cc1NC[C@@H](O)COc1ccc2c(c1)OCO2	ZINC000819489125	FF	On-Demand	Anodyne	EDNRA	56	38
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3cccnc3)c2)C1	ZINC000819489126	DD	On-Demand	Anodyne	OPRK1	15	44
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3cccnc3)c2)C1	ZINC000819489126	DD	On-Demand	Anodyne	ADRB3	70	43
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1cccnc1	ZINC000819489127	DD	On-Demand	Anodyne	OPRK1	15	44
O[C@H](CNc1cccc(CN2CC[C@@H](O)C2)c1)c1cccnc1	ZINC000819489127	DD	On-Demand	Anodyne	ADRB3	70	43
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3cccnc3)c2)C1	ZINC000819489128	DD	On-Demand	Anodyne	OPRK1	15	44
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3cccnc3)c2)C1	ZINC000819489128	DD	On-Demand	Anodyne	ADRB3	70	43
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3cccnc3)c2)C1	ZINC000819489129	DD	On-Demand	Anodyne	OPRK1	15	44
O[C@H]1CCN(Cc2cccc(NC[C@@H](O)c3cccnc3)c2)C1	ZINC000819489129	DD	On-Demand	Anodyne	ADRB3	70	43
COc1cc(F)c(F)cc1NC[C@@H](O)COCc1ccccc1	ZINC000819489130	DF	On-Demand	Anodyne	CASR	18	47
COC(=O)c1cccc(CC(=O)Nc2cnn[nH]2)c1	ZINC000819489134	CC	On-Demand	Anodyne	CSNK1D	26	40
COc1ccc(-c2cncc(C(=O)NCC3OCCCO3)c2)cc1	ZINC000819489138	EE	On-Demand	Anodyne	CYP11B1	15	50
COc1ccc(-c2cncc(C(=O)NCC3OCCCO3)c2)cc1	ZINC000819489138	EE	On-Demand	Anodyne	SCN2A	23	42
COc1ccc(-c2cncc(C(=O)NCC3OCCCO3)c2)cc1	ZINC000819489138	EE	On-Demand	Anodyne	CYP11B2	29	50
COc1ccc(-c2cncc(C(=O)NCC3OCCCO3)c2)cc1	ZINC000819489138	EE	On-Demand	Anodyne	SCN10A	65	42
COc1cc(F)c(F)cc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819489143	DG	On-Demand	Anodyne	ADRB2	34	56
COc1cc(F)c(F)cc1NC[C@@H](O)COc1cccc(C)c1	ZINC000819489143	DG	On-Demand	Anodyne	ADRB1	33	56
COc1cc(F)c(F)cc1NC[C@H](O)COc1cccc(C)c1	ZINC000819489144	DG	On-Demand	Anodyne	ADRB2	34	56
COc1cc(F)c(F)cc1NC[C@H](O)COc1cccc(C)c1	ZINC000819489144	DG	On-Demand	Anodyne	ADRB1	33	56
NC(=O)c1ccc(NC[C@@H](O)CCc2ccccc2)c(OCC(F)F)c1	ZINC000819489145	FF	On-Demand	Anodyne	ABCB1	40	36
NC(=O)c1ccc(NC[C@H](O)CCc2ccccc2)c(OCC(F)F)c1	ZINC000819489147	FF	On-Demand	Anodyne	ABCB1	40	36
CCOC(=O)C1CCC(O)(CNc2cccc(OC(=O)NC)c2)CC1	ZINC000819489153	FE	On-Demand	Anodyne	ACHE	16	41
O=C(CSc1ccccc1C(=O)Nc1cnn[nH]1)NC12CC3CC(CC(C3)C1)C2	ZINC000819489159	HG	On-Demand	Anodyne	CNR2	24	40
O=C(CSc1ccccc1C(=O)Nc1cnn[nH]1)NC12CC3CC(CC(C3)C1)C2	ZINC000819489159	HG	On-Demand	Anodyne	EPHX2	44	37
CNC(=O)c1cc(Oc2cccc(NCCC(=O)N(C)OC)c2)ccn1	ZINC000819489172	FE	On-Demand	Anodyne	RAF1	70	47
CNC(=O)c1cc(Oc2cccc(NC[C@H](O)C3CC3)c2)ccn1	ZINC000819489193	EE	On-Demand	Anodyne	RAF1	76	47
CNC(=O)c1cc(Oc2cccc(NC[C@H](O)C3CC3)c2)ccn1	ZINC000819489193	EE	On-Demand	Anodyne	KDR	17	46
CNC(=O)c1cc(Oc2cccc(NC[C@@H](O)C3CC3)c2)ccn1	ZINC000819489194	EE	On-Demand	Anodyne	RAF1	76	47
CNC(=O)c1cc(Oc2cccc(NC[C@@H](O)C3CC3)c2)ccn1	ZINC000819489194	EE	On-Demand	Anodyne	KDR	17	46
COc1cc(F)c(F)cc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819489198	FG	On-Demand	Anodyne	ADRB2	28	44
COc1cc(F)c(F)cc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819489198	FG	On-Demand	Anodyne	ADRB1	47	39
COc1cc(F)c(F)cc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819489198	FG	On-Demand	Anodyne	GYS1	41	33
COc1cc(F)c(F)cc1NC[C@@H](O)COc1cccc(C(C)=O)c1	ZINC000819489198	FG	On-Demand	Anodyne	ABCB1	20	43
COc1cc(F)c(F)cc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819489200	FG	On-Demand	Anodyne	ADRB2	28	44
COc1cc(F)c(F)cc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819489200	FG	On-Demand	Anodyne	ADRB1	47	39
COc1cc(F)c(F)cc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819489200	FG	On-Demand	Anodyne	GYS1	41	33
COc1cc(F)c(F)cc1NC[C@H](O)COc1cccc(C(C)=O)c1	ZINC000819489200	FG	On-Demand	Anodyne	ABCB1	20	43
C[C@@H](Cc1ccc(F)c(Br)c1)C(=O)Nc1cnn[nH]1	ZINC000819489201	EF	On-Demand	Anodyne	LEF	44	32
O=C(CCc1cccc(Br)c1)Nc1cnn[nH]1	ZINC000819489204	CE	On-Demand	Anodyne	LUXR	15	45
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc(-c3ccccn3)cc2)CC1	ZINC000819489209	GI	On-Demand	Anodyne	P2RY12	40	34
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc(-c3ccccn3)cc2)CC1	ZINC000819489209	GI	On-Demand	Anodyne	GRIN2B	20	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc(-c3ccccn3)cc2)CC1	ZINC000819489209	GI	On-Demand	Anodyne	MMP13	15	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc(-c3ccccn3)cc2)CC1	ZINC000819489209	GI	On-Demand	Anodyne	PRNP	37	43
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc(-c3ccccn3)cc2)CC1	ZINC000819489209	GI	On-Demand	Anodyne	CCR8	31	40
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc(-c3ccccn3)cc2)CC1	ZINC000819489209	GI	On-Demand	Anodyne	GPR119	56	52
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc(-c3ccccn3)cc2)CC1	ZINC000819489213	GI	On-Demand	Anodyne	P2RY12	40	34
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc(-c3ccccn3)cc2)CC1	ZINC000819489213	GI	On-Demand	Anodyne	GRIN2B	20	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc(-c3ccccn3)cc2)CC1	ZINC000819489213	GI	On-Demand	Anodyne	MMP13	15	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc(-c3ccccn3)cc2)CC1	ZINC000819489213	GI	On-Demand	Anodyne	PRNP	37	43
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc(-c3ccccn3)cc2)CC1	ZINC000819489213	GI	On-Demand	Anodyne	CCR8	31	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc(-c3ccccn3)cc2)CC1	ZINC000819489213	GI	On-Demand	Anodyne	GPR119	56	52
CSc1cc(C(=O)Nc2cnn[nH]2)ccc1F	ZINC000819489221	CD	On-Demand	Anodyne	MAOB	18	42
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1cccc(CN2CC[C@H](O)C2)c1	ZINC000819489224	GD	On-Demand	Anodyne	OPRK1	19	42
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1cccc(CN2CC[C@H](O)C2)c1	ZINC000819489224	GD	On-Demand	Anodyne	CCR3	42	38
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1cccc(CN2CC[C@@H](O)C2)c1	ZINC000819489228	GD	On-Demand	Anodyne	OPRK1	19	42
CC(C)(C)OC(=O)CS(=O)(=O)CCNc1cccc(CN2CC[C@@H](O)C2)c1	ZINC000819489228	GD	On-Demand	Anodyne	CCR3	42	38
O=C(Nc1cnn[nH]1)c1ccc(CO)c(F)c1	ZINC000819489234	BC	On-Demand	Anodyne	MAOB	17	40
O=C(Nc1cnn[nH]1)c1ccc(CO)c(F)c1	ZINC000819489234	BC	On-Demand	Anodyne	ROCK2	40	37
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc4ccccc34)c2)C1	ZINC000819489237	FH	On-Demand	Anodyne	DRD4	24	42
O[C@@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc4ccccc34)c2)C1	ZINC000819489237	FH	On-Demand	Anodyne	SIGMAR1	22	43
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc4ccccc34)c2)C1	ZINC000819489238	FH	On-Demand	Anodyne	DRD4	24	42
O[C@H]1CCN(Cc2cccc(NC[C@H](O)c3cccc4ccccc34)c2)C1	ZINC000819489238	FH	On-Demand	Anodyne	SIGMAR1	22	43
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)Nc1cnn[nH]1	ZINC000819489249	ED	On-Demand	Anodyne	MC4R	26	40
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)Nc1cnn[nH]1	ZINC000819489249	ED	On-Demand	Anodyne	MPO	44	33
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)Nc1cnn[nH]1	ZINC000819489249	ED	On-Demand	Anodyne	MC3R	41	40
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)Nc1cnn[nH]1	ZINC000819489249	ED	On-Demand	Anodyne	MC5R	52	40
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)Nc1cnn[nH]1	ZINC000819489249	ED	On-Demand	Anodyne	GRPR	60	36
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)Nc1cnn[nH]1	ZINC000819489249	ED	On-Demand	Anodyne	GHSR	19	40
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)Nc1cnn[nH]1	ZINC000819489249	ED	On-Demand	Anodyne	MC1R	56	40
O=C(Nc1cnn[nH]1)c1ccc(Oc2cccc(Cl)c2Cl)cc1	ZINC000819489251	EI	On-Demand	Anodyne	TAAR1	29	41
C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)NCC1OCCCO1	ZINC000819489252	EG	On-Demand	Anodyne	MC4R	57	39
C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)NCC1OCCCO1	ZINC000819489252	EG	On-Demand	Anodyne	P2RX7	38	42
O=C(CCNC(=O)NC12CC3CC(CC(C3)C1)C2)Nc1cnn[nH]1	ZINC000819489255	ED	On-Demand	Anodyne	EPHX2	107	50
O=C(Nc1cnn[nH]1)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1	ZINC000819489258	HD	On-Demand	Anodyne	MERTK	30	43
O=C(Nc1cnn[nH]1)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1	ZINC000819489258	HD	On-Demand	Anodyne	NAMPT	29	42
Cc1cc(C(=O)NCC2OCCCO2)nn1-c1ccc(Cl)c(Cl)c1	ZINC000819489263	FF	On-Demand	Anodyne	CNR1	21	45
Cc1cc(C(=O)NCC2OCCCO2)nn1-c1ccc(Cl)c(Cl)c1	ZINC000819489263	FF	On-Demand	Anodyne	CNR2	15	44
Cc1cc(C(=O)NCC2OCCCO2)nn1-c1ccc(Cl)c(Cl)c1	ZINC000819489263	FF	On-Demand	Anodyne	PTGER1	16	42
Cc1cc(C(=O)NCC2OCCCO2)nn1-c1ccc(Cl)c(Cl)c1	ZINC000819489263	FF	On-Demand	Anodyne	RPA1	106	40
O=C(Nc1cnn[nH]1)c1ncccc1Oc1ccccc1	ZINC000819489276	CE	On-Demand	Anodyne	MAP1	36	40
O=C(Nc1cnn[nH]1)[C@@H]1CCCN(C(=O)c2ccncc2)C1	ZINC000819489277	DC	On-Demand	Anodyne	L3MBTL3	51	36
O=C(Nc1cnn[nH]1)[C@H]1CCCN(C(=O)c2ccncc2)C1	ZINC000819489278	DC	On-Demand	Anodyne	L3MBTL3	51	36
NS(=O)(=O)c1ccc(C(=O)Nc2cnn[nH]2)cc1	ZINC000819489284	CB	On-Demand	Anodyne	CA2	111	61
NS(=O)(=O)c1ccc(C(=O)Nc2cnn[nH]2)cc1	ZINC000819489284	CB	On-Demand	Anodyne	CA6	21	44
NS(=O)(=O)c1ccc(C(=O)Nc2cnn[nH]2)cc1	ZINC000819489284	CB	On-Demand	Anodyne	CA1	90	61
NS(=O)(=O)c1ccc(C(=O)Nc2cnn[nH]2)cc1	ZINC000819489284	CB	On-Demand	Anodyne	CA7	60	44
NS(=O)(=O)c1ccc(C(=O)Nc2cnn[nH]2)cc1	ZINC000819489284	CB	On-Demand	Anodyne	CA5B	52	36
NS(=O)(=O)c1ccc(C(=O)Nc2cnn[nH]2)cc1	ZINC000819489284	CB	On-Demand	Anodyne	CA4	76	61
NS(=O)(=O)c1ccc(C(=O)Nc2cnn[nH]2)cc1	ZINC000819489284	CB	On-Demand	Anodyne	CA5A	55	36
NS(=O)(=O)c1ccc(C(=O)Nc2cnn[nH]2)cc1	ZINC000819489284	CB	On-Demand	Anodyne	CA14	55	44
NS(=O)(=O)c1ccc(C(=O)Nc2cnn[nH]2)cc1	ZINC000819489284	CB	On-Demand	Anodyne	CA12	65	52
NS(=O)(=O)c1ccc(C(=O)Nc2cnn[nH]2)cc1	ZINC000819489284	CB	On-Demand	Anodyne	CA9	72	52
NS(=O)(=O)c1ccc(C(=O)Nc2cnn[nH]2)cc1	ZINC000819489284	CB	On-Demand	Anodyne	UREA_CANEN	26	44
NS(=O)(=O)c1ccc(C(=O)Nc2cnn[nH]2)cc1	ZINC000819489284	CB	On-Demand	Anodyne	CYNT	50	52
NS(=O)(=O)c1ccc(C(=O)Nc2cnn[nH]2)cc1	ZINC000819489284	CB	On-Demand	Anodyne	NCE103	26	44
NS(=O)(=O)c1ccc(C(=O)Nc2cnn[nH]2)cc1	ZINC000819489284	CB	On-Demand	Anodyne	MTCA1	49	41
NS(=O)(=O)c1ccc(C(=O)Nc2cnn[nH]2)cc1	ZINC000819489284	CB	On-Demand	Anodyne	P96878_MYCTU	62	41
NS(=O)(=O)c1ccc(C(=O)Nc2cnn[nH]2)cc1	ZINC000819489284	CB	On-Demand	Anodyne	A6YCJ1_9METZ	21	43
O[C@@H](CNc1ccccc1OCCF)COc1ccc(Br)cc1	ZINC000819489293	GH	On-Demand	Clean	ADRB2	38	40
O[C@@H](CNc1ccccc1OCCF)COc1ccc(Br)cc1	ZINC000819489293	GH	On-Demand	Clean	ADRB1	57	42
O[C@@H](CNc1ccccc1OCCF)COc1ccc(Br)cc1	ZINC000819489293	GH	On-Demand	Clean	ADRB3	21	40
O[C@H](CNc1ccccc1OCCF)COc1ccc(Br)cc1	ZINC000819489295	GH	On-Demand	Clean	ADRB2	38	40
O[C@H](CNc1ccccc1OCCF)COc1ccc(Br)cc1	ZINC000819489295	GH	On-Demand	Clean	ADRB1	57	42
O[C@H](CNc1ccccc1OCCF)COc1ccc(Br)cc1	ZINC000819489295	GH	On-Demand	Clean	ADRB3	21	40
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819489319	GD	On-Demand	Anodyne	ADRB2	34	55
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819489319	GD	On-Demand	Anodyne	ADRB1	68	55
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819489319	GD	On-Demand	Anodyne	ADRB3	42	48
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819489321	GD	On-Demand	Anodyne	ADRB2	34	55
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819489321	GD	On-Demand	Anodyne	ADRB1	68	55
CC(=O)Nc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819489321	GD	On-Demand	Anodyne	ADRB3	42	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819489323	GD	On-Demand	Anodyne	ADRB2	34	55
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819489323	GD	On-Demand	Anodyne	ADRB1	68	55
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819489323	GD	On-Demand	Anodyne	ADRB3	42	48
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819489325	GD	On-Demand	Anodyne	ADRB2	34	55
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819489325	GD	On-Demand	Anodyne	ADRB1	68	55
CC(=O)Nc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819489325	GD	On-Demand	Anodyne	ADRB3	42	48
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819489345	EF	On-Demand	Mild	ADRB2	37	40
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819489345	EF	On-Demand	Mild	ADRB1	66	45
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819489345	EF	On-Demand	Mild	ADRB3	28	40
N#CCc1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819489345	EF	On-Demand	Mild	CASR	41	37
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819489352	EF	On-Demand	Mild	ADRB2	37	40
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819489352	EF	On-Demand	Mild	ADRB1	66	45
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819489352	EF	On-Demand	Mild	ADRB3	28	40
N#CCc1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819489352	EF	On-Demand	Mild	CASR	41	37
Cc1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819489353	DG	On-Demand	Clean	ADRB2	48	50
Cc1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819489353	DG	On-Demand	Clean	ADRB1	63	42
Cc1ccc(OC[C@@H](O)CNc2ccccc2OCCF)cc1	ZINC000819489353	DG	On-Demand	Clean	ADRB3	27	40
Cc1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819489355	DG	On-Demand	Clean	ADRB2	48	50
Cc1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819489355	DG	On-Demand	Clean	ADRB1	63	42
Cc1ccc(OC[C@H](O)CNc2ccccc2OCCF)cc1	ZINC000819489355	DG	On-Demand	Clean	ADRB3	27	40
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3ccccc3Cl)cc2)N1	ZINC000819489394	FE	On-Demand	Anodyne	ADRB2	28	42
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3ccccc3Cl)cc2)N1	ZINC000819489394	FE	On-Demand	Anodyne	ADRB1	51	38
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3ccccc3Cl)cc2)N1	ZINC000819489396	FE	On-Demand	Anodyne	ADRB2	28	42
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3ccccc3Cl)cc2)N1	ZINC000819489396	FE	On-Demand	Anodyne	ADRB1	51	38
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3ccccc3Cl)cc2)N1	ZINC000819489398	FE	On-Demand	Anodyne	ADRB2	28	42
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3ccccc3Cl)cc2)N1	ZINC000819489398	FE	On-Demand	Anodyne	ADRB1	51	38
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3ccccc3Cl)cc2)N1	ZINC000819489400	FE	On-Demand	Anodyne	ADRB2	28	42
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3ccccc3Cl)cc2)N1	ZINC000819489400	FE	On-Demand	Anodyne	ADRB1	51	38
COC[C@@H](O)CNc1ccccc1OCCF	ZINC000819489403	BD	On-Demand	Clean	ADRB2	27	42
COC[C@@H](O)CNc1ccccc1OCCF	ZINC000819489403	BD	On-Demand	Clean	ADRB1	45	38
O[C@@H](CNc1ccccc1OCCF)COc1ccc(F)cc1	ZINC000819489406	DG	On-Demand	Clean	ADRB2	45	41
O[C@@H](CNc1ccccc1OCCF)COc1ccc(F)cc1	ZINC000819489406	DG	On-Demand	Clean	ADRB1	69	43
O[C@@H](CNc1ccccc1OCCF)COc1ccc(F)cc1	ZINC000819489406	DG	On-Demand	Clean	ADRB3	30	42
O[C@H](CNc1ccccc1OCCF)COc1ccc(F)cc1	ZINC000819489408	DG	On-Demand	Clean	ADRB2	45	41
O[C@H](CNc1ccccc1OCCF)COc1ccc(F)cc1	ZINC000819489408	DG	On-Demand	Clean	ADRB1	69	43
O[C@H](CNc1ccccc1OCCF)COc1ccc(F)cc1	ZINC000819489408	DG	On-Demand	Clean	ADRB3	30	42
C=CCCn1cc(C(=O)Nc2ccc(N3CCOCC3)c(C)c2)nn1	ZINC000819489430	EE	On-Demand	Mild	MAPK9	19	40
C=CCCn1cc(C(=O)Nc2ccc(N3CCOCC3)c(C)c2)nn1	ZINC000819489430	EE	On-Demand	Mild	MAPK10	17	40
CN(CCC#N)C[C@H](O)CNc1ccc(Cl)cc1OCc1ccccc1	ZINC000819489469	FH	On-Demand	Mild	PTGER1	47	37
CN(CCC#N)C[C@@H](O)CNc1ccc(Cl)cc1OCc1ccccc1	ZINC000819489471	FH	On-Demand	Mild	PTGER1	47	37
CCOc1ccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)Nc3cnn[nH]3)c2)cc1	ZINC000819489486	HF	On-Demand	Anodyne	USP47	49	31
CCOc1ccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)Nc3cnn[nH]3)c2)cc1	ZINC000819489486	HF	On-Demand	Anodyne	MGAT1	48	36
O=C(Nc1cnn[nH]1)c1ccccc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000819489495	GD	On-Demand	Bother	PRTN3	46	34
O=C(Nc1cnn[nH]1)c1ccccc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000819489495	GD	On-Demand	Bother	MTNN	47	32
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NCC2OCCCO2)cc1	ZINC000819489503	HG	On-Demand	Anodyne	DRD4	22	44
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NCC2OCCCO2)cc1	ZINC000819489503	HG	On-Demand	Anodyne	ACHE	15	43
COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)NCC2OCCCO2)cc1	ZINC000819489503	HG	On-Demand	Anodyne	SIGMAR1	17	40
CCCOc1cccc(CC(=O)Nc2cnn[nH]2)c1	ZINC000819489506	CD	On-Demand	Anodyne	CSNK1D	16	43
CCCOc1cccc(CC(=O)Nc2cnn[nH]2)c1	ZINC000819489506	CD	On-Demand	Anodyne	PLA2G4B	26	42
CCCOc1cccc(CC(=O)Nc2cnn[nH]2)c1	ZINC000819489506	CD	On-Demand	Anodyne	PDS	43	32
O=C(NCC1OCCCO1)c1cc(-c2ccccc2)on1	ZINC000819489538	CD	On-Demand	Anodyne	HDAC10	16	53
C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)Nc1cnn[nH]1	ZINC000819489540	CF	On-Demand	Anodyne	ALPL	43	39
O=C(NCC1OCCCO1)[C@@H](O)Cc1ccccc1	ZINC000819489542	CC	On-Demand	Anodyne	ACE	53	40
O=C(NCC1OCCCO1)[C@@H](O)Cc1ccccc1	ZINC000819489542	CC	On-Demand	Anodyne	MME	100	42
O=C(NCC1OCCCO1)[C@@H](O)Cc1ccccc1	ZINC000819489542	CC	On-Demand	Anodyne	ANPEP	33	40
O=C(NCC1OCCCO1)[C@@H](O)Cc1ccccc1	ZINC000819489542	CC	On-Demand	Anodyne	AMP1_PLAFQ	40	38
O=C(CN1C(=O)/C(=C\c2ccc(Br)cc2)SC1=S)Nc1cnn[nH]1	ZINC000819489543	HE	On-Demand	Clean	AKR1B1	41	38
O=C(CN1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S)Nc1cnn[nH]1	ZINC000819489544	HE	On-Demand	Clean	AKR1B1	41	38
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc3cnccc3c2)CC1	ZINC000819489555	FH	On-Demand	Anodyne	GPR119	56	47
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc3cnccc3c2)CC1	ZINC000819489556	FH	On-Demand	Anodyne	GPR119	56	47
N#CCc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819489594	FD	On-Demand	Mild	ADRB1	56	38
N#CCc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819489595	FD	On-Demand	Mild	ADRB1	56	38
N#CCc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819489597	FD	On-Demand	Mild	ADRB1	56	38
N#CCc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819489599	FD	On-Demand	Mild	ADRB1	56	38
CCSCc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819489605	CI	On-Demand	Anodyne	ADRB2	19	58
CCSCc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819489605	CI	On-Demand	Anodyne	ADRB1	18	45
CCSCc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819489605	CI	On-Demand	Anodyne	ADRB3	40	40
CCSCc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819489607	CI	On-Demand	Anodyne	ADRB2	19	58
CCSCc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819489607	CI	On-Demand	Anodyne	ADRB1	18	45
CCSCc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819489607	CI	On-Demand	Anodyne	ADRB3	40	40
C=COc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819489637	DG	On-Demand	Anodyne	NOD2	43	38
C=COc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000819489640	DG	On-Demand	Anodyne	NOD2	43	38
COC[C@@H](O)CNc1ccc(O[C@H]2CC(=O)N2)cc1	ZINC000819489641	CC	On-Demand	Anodyne	ADRB1	21	41
COC[C@@H](O)CNc1ccc(O[C@@H]2CC(=O)N2)cc1	ZINC000819489643	CC	On-Demand	Anodyne	ADRB1	21	41
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)c(SC)c2)cc1	ZINC000819489660	FH	On-Demand	Anodyne	ADRB2	41	42
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)c(SC)c2)cc1	ZINC000819489660	FH	On-Demand	Anodyne	ADRB1	44	42
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)c(SC)c2)cc1	ZINC000819489663	FH	On-Demand	Anodyne	ADRB2	41	42
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)c(SC)c2)cc1	ZINC000819489663	FH	On-Demand	Anodyne	ADRB1	44	42
COc1cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1C	ZINC000819489690	EG	On-Demand	Bother	CACNA1C	55	37
COc1cc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1C	ZINC000819489690	EG	On-Demand	Bother	CACNA1D	86	37
COc1cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1C	ZINC000819489692	EG	On-Demand	Bother	CACNA1C	55	37
COc1cc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc(OC)c1C	ZINC000819489692	EG	On-Demand	Bother	CACNA1D	86	37
C=COc1ccc(NC[C@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819489719	FH	On-Demand	Anodyne	F13A1	18	40
C=COc1ccc(NC[C@@]2(O)CCCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819489721	FH	On-Demand	Anodyne	F13A1	18	40
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc([C@H]3CCOC3)cc2)CC1	ZINC000819489732	GH	On-Demand	Anodyne	GPR119	38	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc([C@H]3CCOC3)cc2)CC1	ZINC000819489734	GH	On-Demand	Anodyne	GPR119	38	44
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2ccc([C@@H]3CCOC3)cc2)CC1	ZINC000819489737	GH	On-Demand	Anodyne	GPR119	38	44
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2ccc([C@@H]3CCOC3)cc2)CC1	ZINC000819489738	GH	On-Demand	Anodyne	GPR119	38	44
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489744	GH	On-Demand	Anodyne	DRD4	21	42
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489744	GH	On-Demand	Anodyne	SIGMAR1	19	47
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489744	GH	On-Demand	Anodyne	SSTR5	46	37
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489744	GH	On-Demand	Anodyne	MCHR1	33	41
O=C(/C=C\[C@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489744	GH	On-Demand	Anodyne	CACNA1I	40	38
COc1cc(NC[C@H](O)c2cccnc2)cc(OC)c1C	ZINC000819489748	CF	On-Demand	Anodyne	ADRB2	22	40
COc1cc(NC[C@H](O)c2cccnc2)cc(OC)c1C	ZINC000819489748	CF	On-Demand	Anodyne	ADRB1	24	45
COc1cc(NC[C@H](O)c2cccnc2)cc(OC)c1C	ZINC000819489748	CF	On-Demand	Anodyne	ADRB3	82	45
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489749	GH	On-Demand	Anodyne	DRD4	21	42
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489749	GH	On-Demand	Anodyne	SIGMAR1	19	47
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489749	GH	On-Demand	Anodyne	SSTR5	46	37
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489749	GH	On-Demand	Anodyne	MCHR1	33	41
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489749	GH	On-Demand	Anodyne	CACNA1I	40	38
COc1cc(NC[C@@H](O)c2cccnc2)cc(OC)c1C	ZINC000819489750	CF	On-Demand	Anodyne	ADRB2	22	40
COc1cc(NC[C@@H](O)c2cccnc2)cc(OC)c1C	ZINC000819489750	CF	On-Demand	Anodyne	ADRB1	24	45
COc1cc(NC[C@@H](O)c2cccnc2)cc(OC)c1C	ZINC000819489750	CF	On-Demand	Anodyne	ADRB3	82	45
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489751	GH	On-Demand	Anodyne	DRD4	21	42
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489751	GH	On-Demand	Anodyne	SIGMAR1	19	47
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489751	GH	On-Demand	Anodyne	SSTR5	46	37
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489751	GH	On-Demand	Anodyne	MCHR1	33	41
O=C(/C=C/[C@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489751	GH	On-Demand	Anodyne	CACNA1I	40	38
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OCCF)c1	ZINC000819489752	EG	On-Demand	Clean	ADRB2	32	44
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OCCF)c1	ZINC000819489752	EG	On-Demand	Clean	ADRB1	66	49
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OCCF)c1	ZINC000819489752	EG	On-Demand	Clean	ABCB1	32	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccccc2OCCF)c1	ZINC000819489752	EG	On-Demand	Clean	PDS	50	36
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489753	GH	On-Demand	Anodyne	DRD4	21	42
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489753	GH	On-Demand	Anodyne	SIGMAR1	19	47
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489753	GH	On-Demand	Anodyne	SSTR5	46	37
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489753	GH	On-Demand	Anodyne	MCHR1	33	41
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000819489753	GH	On-Demand	Anodyne	CACNA1I	40	38
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OCCF)c1	ZINC000819489754	EG	On-Demand	Clean	ADRB2	32	44
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OCCF)c1	ZINC000819489754	EG	On-Demand	Clean	ADRB1	66	49
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OCCF)c1	ZINC000819489754	EG	On-Demand	Clean	ABCB1	32	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccccc2OCCF)c1	ZINC000819489754	EG	On-Demand	Clean	PDS	50	36
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819489768	FD	On-Demand	Anodyne	ADRB2	25	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819489768	FD	On-Demand	Anodyne	ADRB1	54	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819489769	FD	On-Demand	Anodyne	ADRB2	25	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819489769	FD	On-Demand	Anodyne	ADRB1	54	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819489771	FD	On-Demand	Anodyne	ADRB2	25	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819489771	FD	On-Demand	Anodyne	ADRB1	54	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819489773	FD	On-Demand	Anodyne	ADRB2	25	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819489773	FD	On-Demand	Anodyne	ADRB1	54	43
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3ccccc3F)cc2)N1	ZINC000819489779	ED	On-Demand	Anodyne	ADRB1	56	36
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3ccccc3F)cc2)N1	ZINC000819489781	ED	On-Demand	Anodyne	ADRB1	56	36
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3ccccc3F)cc2)N1	ZINC000819489783	ED	On-Demand	Anodyne	ADRB1	56	36
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3ccccc3F)cc2)N1	ZINC000819489785	ED	On-Demand	Anodyne	ADRB1	56	36
O[C@@H](CNc1ccccc1OCCF)c1cccc(Cl)c1	ZINC000819489820	DH	On-Demand	Anodyne	ADRB1	37	46
O[C@@H](CNc1ccccc1OCCF)c1cccc(Cl)c1	ZINC000819489820	DH	On-Demand	Anodyne	ADRB3	54	46
O[C@@H](CNc1ccccc1OCCF)c1cccc(Cl)c1	ZINC000819489820	DH	On-Demand	Anodyne	CYP3A4	47	36
O[C@H](CNc1ccccc1OCCF)c1cccc(Cl)c1	ZINC000819489821	DH	On-Demand	Anodyne	ADRB1	37	46
O[C@H](CNc1ccccc1OCCF)c1cccc(Cl)c1	ZINC000819489821	DH	On-Demand	Anodyne	ADRB3	54	46
O[C@H](CNc1ccccc1OCCF)c1cccc(Cl)c1	ZINC000819489821	DH	On-Demand	Anodyne	CYP3A4	47	36
C/C=C\c1ccc(OC[C@@H](O)CNc2cccc(OC(=O)NC)c2)c(OC)c1	ZINC000819489843	GG	On-Demand	Anodyne	ADRB2	19	56
C/C=C/c1ccc(OC[C@H](O)CNc2cccc(OC(=O)NC)c2)c(OC)c1	ZINC000819489844	GG	On-Demand	Anodyne	ADRB2	19	56
O=C(O)CCNC(=O)NCc1ccc(-c2ccccc2)o1	ZINC000819489845	CE	On-Demand	Anodyne	CYP2E1	33	44
O=C(O)CCNC(=O)NCCN1CCCc2ccccc21	ZINC000819489847	CD	On-Demand	Anodyne	AVPR2	33	41
O=C(O)CCNC(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000819489848	EC	On-Demand	Anodyne	ACHE	20	43
O=C(O)CCNC(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000819489848	EC	On-Demand	Anodyne	SIGMAR1	30	44
O=C(O)CCNC(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000819489848	EC	On-Demand	Anodyne	CCR3	25	43
O=C(O)CCNC(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F	ZINC000819489849	GD	On-Demand	Clean	STAT6	46	30
O=C(O)CCNC(=O)NCc1ccccc1-c1ccc(Cn2cccn2)cc1	ZINC000819489851	GF	On-Demand	Anodyne	AGTR1B	44	36
O=C(O)CCNC(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC000819489852	DE	On-Demand	Anodyne	ACACB	17	40
O=C(O)CCNC(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC000819489852	DE	On-Demand	Anodyne	FFAR1	19	41
O=C(O)CCNC(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC000819489852	DE	On-Demand	Anodyne	NAMPT	19	45
O=C(O)CCNC(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000819489853	DD	On-Demand	Anodyne	HRH2	32	56
O=C(O)CCNC(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000819489853	DD	On-Demand	Anodyne	HRH3	30	45
O=C(O)CCNC(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000819489853	DD	On-Demand	Anodyne	SIGMAR1	27	48
O=C(O)CCNC(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000819489853	DD	On-Demand	Anodyne	NPFFR1	47	42
O=C(O)CCNC(=O)NCc1ccc(CN2CCCCC2)cc1	ZINC000819489853	DD	On-Demand	Anodyne	NAMPT	19	40
O=C(O)CCNC(=O)NCc1ccc2ccccc2n1	ZINC000819489854	CD	On-Demand	Anodyne	CYSLTR1	58	45
O=C(O)CCNC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000819489855	CE	On-Demand	Anodyne	MME	26	44
O=C(O)CCNC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000819489855	CE	On-Demand	Anodyne	TBXAS1	74	41
O=C(O)CCNC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000819489855	CE	On-Demand	Anodyne	NAMPT	70	51
O=C(O)CCNC(=O)NCc1cccnc1N1CCOCC1	ZINC000819489859	DC	On-Demand	Anodyne	SCN10A	22	51
O=C(O)CCNC(=O)NCc1csc(-c2ccccc2)n1	ZINC000819489861	DE	On-Demand	Anodyne	MME	20	40
O=C(O)CCNC(=O)NCc1csc(-c2ccccc2)n1	ZINC000819489861	DE	On-Demand	Anodyne	GIPR	42	38
O=C(O)CCNC(=O)NCc1ncc(-c2ccccc2)o1	ZINC000819489862	CD	On-Demand	Anodyne	MME	18	40
O=C(O)CCNC(=O)NCc1ncc(-c2ccccc2)o1	ZINC000819489862	CD	On-Demand	Anodyne	FAAH	46	42
O=C(O)CCNC(=O)NCc1ncc(-c2ccccc2)o1	ZINC000819489862	CD	On-Demand	Anodyne	CES1	21	42
O=C(O)CCNC(=O)NCc1ncc(-c2ccccc2)o1	ZINC000819489862	CD	On-Demand	Anodyne	NPPA	22	40
O=C(O)CCNC(=O)NCCN1Cc2ccccc2C1	ZINC000819489865	CC	On-Demand	Anodyne	HTR1A	15	42
O=C(O)CCNC(=O)NCCN1Cc2ccccc2C1	ZINC000819489865	CC	On-Demand	Anodyne	DRD3	18	42
O=C(O)CCNC(=O)NCCN1Cc2ccccc2C1	ZINC000819489865	CC	On-Demand	Anodyne	MME	21	41
O=C(O)CCNC(=O)NCCN1Cc2ccccc2C1	ZINC000819489865	CC	On-Demand	Anodyne	HTR7	23	42
O=C(O)CCNC(=O)NCCN1Cc2ccccc2C1	ZINC000819489865	CC	On-Demand	Anodyne	HSD17B3	24	40
O=C(O)CCNC(=O)NCc1cn(-c2ccccc2)nn1	ZINC000819489866	CC	On-Demand	Anodyne	AROQ	26	40
O=C(O)CCNC(=O)NCc1ccc(Cl)nc1	ZINC000819489869	CD	On-Demand	Anodyne	NACHRBETA2	38	45
O=C(O)CCNC(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000819489870	DC	On-Demand	Anodyne	HRH2	31	50
O=C(O)CCNC(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000819489870	DC	On-Demand	Anodyne	CHRM3	20	41
O=C(O)CCNC(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000819489870	DC	On-Demand	Anodyne	SIGMAR1	29	40
O=C(O)CCNC(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000819489870	DC	On-Demand	Anodyne	EPHX2	19	40
O=C(O)CCNC(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000819489870	DC	On-Demand	Anodyne	DPOL_VZVD	22	41
O=C(O)CCNC(=O)NCc1cccc(CN2CCOCC2)c1	ZINC000819489870	DC	On-Demand	Anodyne	NPFFR1	44	41
O=C(O)CCNC(=O)NCc1ccc(Br)cc1F	ZINC000819489871	DD	On-Demand	Anodyne	AKR1B1	20	48
O=C(O)CCNC(=O)NCc1cc(-c2ccccc2)on1	ZINC000819489872	CD	On-Demand	Anodyne	MME	19	40
O=C(O)CCNC(=O)NCc1cc(-c2ccccc2)on1	ZINC000819489872	CD	On-Demand	Anodyne	HDAC10	15	47
O=C(/C=C/[C@H]1CCCO1)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000819489879	EF	On-Demand	Anodyne	SPHK1	35	42
C/C=C\c1ccc(OC[C@H](O)CNc2cccc(OC(=O)NC)c2)c(OC)c1	ZINC000819489880	GG	On-Demand	Anodyne	ADRB2	19	56
O=C(/C=C/[C@@H]1CCCO1)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000819489881	EF	On-Demand	Anodyne	SPHK1	35	42
C/C=C/c1ccc(OC[C@@H](O)CNc2cccc(OC(=O)NC)c2)c(OC)c1	ZINC000819489882	GG	On-Demand	Anodyne	ADRB2	19	56
O=C(/C=C\[C@H]1CCCO1)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000819489883	EF	On-Demand	Anodyne	SPHK1	35	42
O=C(/C=C\[C@@H]1CCCO1)NCCCc1nc(-c2ccc(F)cc2)no1	ZINC000819489885	EF	On-Demand	Anodyne	SPHK1	35	42
O=C(O)CCNC(=O)NCc1ccccc1Oc1ccccc1	ZINC000819489891	DF	On-Demand	Anodyne	MME	16	46
O=C(O)CCNC(=O)NCc1ccccc1Oc1ccccc1	ZINC000819489891	DF	On-Demand	Anodyne	CXCL8	23	40
O=C(O)CCNC(=O)NCc1ccccc1Oc1ccccc1	ZINC000819489891	DF	On-Demand	Anodyne	TSPO	42	34
O=C(O)CCNC(=O)NCc1ccc(CN2CCCCCC2)cc1	ZINC000819489893	EE	On-Demand	Anodyne	HRH2	32	56
O=C(O)CCNC(=O)NCc1ccc(CN2CCCCCC2)cc1	ZINC000819489893	EE	On-Demand	Anodyne	HRH3	30	45
O=C(O)CCNC(=O)NCc1ccc(CN2CCCCCC2)cc1	ZINC000819489893	EE	On-Demand	Anodyne	SIGMAR1	27	48
O=C(O)CCNC(=O)NCc1ccc(CN2CCCCCC2)cc1	ZINC000819489893	EE	On-Demand	Anodyne	NPFFR1	47	42
O=C(O)CCNC(=O)NCc1ccc(CN2CCCCCC2)cc1	ZINC000819489893	EE	On-Demand	Anodyne	NAMPT	19	40
O=C(O)CCNC(=O)NCc1cccc(CN2CCCC2=O)c1	ZINC000819489895	DD	On-Demand	Anodyne	HRH2	26	44
O=C(O)CCNC(=O)NCc1ccccc1CN1CCCCCC1	ZINC000819489897	EE	On-Demand	Anodyne	HRH2	28	49
O=C(O)CCNC(=O)NCc1ccccc1CN1CCCCCC1	ZINC000819489897	EE	On-Demand	Anodyne	NPFFR1	43	39
O=C(O)CCNC(=O)NCC[S@](=O)Cc1ccccc1	ZINC000819489901	CC	On-Demand	Anodyne	MME	24	45
O=C(O)CCNC(=O)NCC[S@@](=O)Cc1ccccc1	ZINC000819489902	CC	On-Demand	Anodyne	MME	24	45
O=C(O)CCNC(=O)NCc1ccccc1CN1CCCC1	ZINC000819489904	DD	On-Demand	Anodyne	HRH2	27	47
O=C(O)CCNC(=O)NCc1ccccc1CN1CCCC1	ZINC000819489904	DD	On-Demand	Anodyne	SIGMAR1	17	40
O=C(O)CCNC(=O)NCc1ccccc1CN1CCCC1	ZINC000819489904	DD	On-Demand	Anodyne	NPFFR1	44	40
CC(=O)OCCCc1cccc(NC(=O)c2cc(Br)oc2C)c1	ZINC000819489916	GI	On-Demand	Anodyne	KCNK3	75	34
CC(=O)OCCCc1cccc(NC(=O)c2cc(Br)oc2C)c1	ZINC000819489916	GI	On-Demand	Anodyne	KCNK9	67	34
CCS(=O)(=O)Cc1ccc(NCCC(=O)N(C)OC)cc1	ZINC000819489922	DD	On-Demand	Anodyne	PTPRB	57	37
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccccn2)c1	ZINC000819489935	ED	On-Demand	Anodyne	GRM4	72	52
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccccn2)c1	ZINC000819489935	ED	On-Demand	Anodyne	ROCK2	27	44
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccccn2)c1	ZINC000819489935	ED	On-Demand	Anodyne	BRAF	18	40
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccccn2)c1	ZINC000819489935	ED	On-Demand	Anodyne	KCNK3	63	54
O=C(O)CCNC(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000819489941	EE	On-Demand	Anodyne	HRH2	57	63
O=C(O)CCNC(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000819489941	EE	On-Demand	Anodyne	CHRM3	24	43
O=C(O)CCNC(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000819489941	EE	On-Demand	Anodyne	HRH3	15	41
O=C(O)CCNC(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000819489941	EE	On-Demand	Anodyne	SIGMAR1	33	44
O=C(O)CCNC(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000819489941	EE	On-Demand	Anodyne	NPFFR1	47	42
O=C(Nc1ccc(S(=O)(=O)CCO)cc1)C(F)=C1CCC1	ZINC000819489942	DD	On-Demand	Anodyne	CA2	21	45
O=C(Nc1ccc(S(=O)(=O)CCO)cc1)C(F)=C1CCC1	ZINC000819489942	DD	On-Demand	Anodyne	P96878_MYCTU	43	38
O=C(O)CCNC(=O)NCc1cccc(Oc2ccccc2)c1	ZINC000819489943	DF	On-Demand	Anodyne	HRH2	24	47
O=C(O)CCNC(=O)NCc1cccc(Oc2ccccc2)c1	ZINC000819489943	DF	On-Demand	Anodyne	MME	19	48
O=C(O)CCNC(=O)NCc1cccc(Oc2ccccc2)c1	ZINC000819489943	DF	On-Demand	Anodyne	LTA4H	22	43
O=C(O)CCNC(=O)NCc1cccc(Oc2ccccc2)c1	ZINC000819489943	DF	On-Demand	Anodyne	MMP13	19	40
O=C(O)CCNC(=O)NCc1cccc(Oc2ccccc2)c1	ZINC000819489943	DF	On-Demand	Anodyne	ROCK1	16	41
O=C(O)CCNC(=O)NCc1cccc(Oc2ccccc2)c1	ZINC000819489943	DF	On-Demand	Anodyne	PPARD	17	44
O=C(O)CCNC(=O)NCc1cccc(Oc2ccccc2)c1	ZINC000819489943	DF	On-Demand	Anodyne	ROCK2	25	40
O=C(O)CCNC(=O)NCc1cccc(Oc2ccccc2)c1	ZINC000819489943	DF	On-Demand	Anodyne	FAAH	26	43
O=C(O)CCNC(=O)NCc1cccc(Oc2ccccc2)c1	ZINC000819489943	DF	On-Demand	Anodyne	AMP1_PLAFQ	38	51
O=C(O)CCNC(=O)NCc1cccc(Oc2ccccc2)c1	ZINC000819489943	DF	On-Demand	Anodyne	FFAR1	38	58
O=C(O)CCNC(=O)NCc1cccc(Oc2ccccc2)c1	ZINC000819489943	DF	On-Demand	Anodyne	DAGLA	26	40
O=C(O)CCNC(=O)NCc1cccc(Oc2ccccc2)c1	ZINC000819489943	DF	On-Demand	Anodyne	CRTM	73	47
O=C(O)CCNC(=O)NCc1cccc(Oc2ccccc2)c1	ZINC000819489943	DF	On-Demand	Anodyne	PDS	61	36
O=C(C(F)=C1CCC1)N1CCC(CCCn2ccnc2)CC1	ZINC000819489944	DG	On-Demand	Anodyne	TBXAS1	37	40
COCc1cc(O)ccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819489952	GF	On-Demand	Anodyne	GPR119	48	46
COCc1cc(O)ccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819489953	GF	On-Demand	Anodyne	GPR119	48	46
O[C@@H](CNc1ccc2c(c1)CN(CC(F)(F)F)C2)c1cccnc1	ZINC000819489962	EG	On-Demand	Anodyne	ADRB3	75	41
O[C@H](CNc1ccc2c(c1)CN(CC(F)(F)F)C2)c1cccnc1	ZINC000819489964	EG	On-Demand	Anodyne	ADRB3	75	41
O=C(O)CCNC(=O)NCc1ccc(Cn2cncn2)cc1	ZINC000819489965	DC	On-Demand	Anodyne	HIS3	49	34
O=C(O)CCNC(=O)NCc1cccc(CN2CCCC2)c1	ZINC000819489967	DD	On-Demand	Anodyne	HRH2	51	61
O=C(O)CCNC(=O)NCc1cccc(CN2CCCC2)c1	ZINC000819489967	DD	On-Demand	Anodyne	CHRM3	24	43
O=C(O)CCNC(=O)NCc1cccc(CN2CCCC2)c1	ZINC000819489967	DD	On-Demand	Anodyne	SIGMAR1	33	45
O=C(O)CCNC(=O)NCc1cccc(CN2CCCC2)c1	ZINC000819489967	DD	On-Demand	Anodyne	NPFFR1	48	43
O=C(O)CCNC(=O)NCc1ccccc1Cn1ccnc1	ZINC000819489970	DD	On-Demand	Anodyne	CYP19A1	35	52
O=C(O)CCNC(=O)NCc1ccccc1Cn1ccnc1	ZINC000819489970	DD	On-Demand	Anodyne	CYP11B1	54	48
O=C(O)CCNC(=O)NCc1ccccc1Cn1ccnc1	ZINC000819489970	DD	On-Demand	Anodyne	TBXAS1	69	53
O=C(O)CCNC(=O)NCc1ccccc1Cn1ccnc1	ZINC000819489970	DD	On-Demand	Anodyne	CYP11B2	29	48
O=C(O)CCNC(=O)NCc1ccccc1Cn1ccnc1	ZINC000819489970	DD	On-Demand	Anodyne	CYP27B1	40	33
O=C(O)CCNC(=O)NCCNS(=O)(=O)c1cccnc1	ZINC000819489972	DB	On-Demand	Anodyne	TBXA2R	47	35
O=C(O)CCNC(=O)NCCNS(=O)(=O)c1cccnc1	ZINC000819489972	DB	On-Demand	Anodyne	TBXAS1	95	53
O=C(O)CCNC(=O)NCCNS(=O)(=O)c1cccnc1	ZINC000819489972	DB	On-Demand	Anodyne	NAMPT	64	46
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000819489981	FE	On-Demand	Anodyne	GCGR	45	44
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000819489981	FE	On-Demand	Anodyne	ROCK2	27	43
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000819489981	FE	On-Demand	Anodyne	TAAR1	41	37
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000819489981	FE	On-Demand	Anodyne	KCNK3	104	55
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccc(F)cc2)c1	ZINC000819489981	FE	On-Demand	Anodyne	KCNK9	63	38
O=C(O)CCNC(=O)NCc1cccc(OCc2ccccn2)c1	ZINC000819489987	ED	On-Demand	Anodyne	HRH2	31	45
O=C(O)CCNC(=O)NCc1cccc(OCc2ccccn2)c1	ZINC000819489987	ED	On-Demand	Anodyne	CYSLTR1	36	40
O=C(O)CCNC(=O)NCc1cccc(OCc2ccccn2)c1	ZINC000819489987	ED	On-Demand	Anodyne	FFAR1	43	45
O=C(O)CCNC(=O)NCc1cccc(OCc2ccccn2)c1	ZINC000819489987	ED	On-Demand	Anodyne	FFAR4	22	41
O=C(O)CCNC(=O)NCc1cccc(OCc2ccccn2)c1	ZINC000819489987	ED	On-Demand	Anodyne	PDS	58	35
O=C(O)CCNC(=O)NCc1ccccc1-c1ccc(Cn2cncn2)cc1	ZINC000819489993	GE	On-Demand	Anodyne	CYP19A1	28	41
O=C(O)CCNC(=O)NCc1cccnc1-n1ccnc1	ZINC000819489998	CC	On-Demand	Anodyne	TBXAS1	25	43
O=C(O)CCNC(=O)NCc1cccnc1-n1ccnc1	ZINC000819489998	CC	On-Demand	Anodyne	NOS2	61	32
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC)c(SC)c2)cc1	ZINC000819490002	GG	On-Demand	Anodyne	ADRB2	46	46
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC)c(SC)c2)cc1	ZINC000819490002	GG	On-Demand	Anodyne	ADRB1	66	45
COC(=O)c1ccc(OC[C@@H](O)CNc2ccc(OC)c(SC)c2)cc1	ZINC000819490002	GG	On-Demand	Anodyne	ADRB3	39	44
O=C(O)CCNC(=O)NCCc1nc2ccccc2[nH]1	ZINC000819490003	CC	On-Demand	Anodyne	PIN1	34	41
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC)c(SC)c2)cc1	ZINC000819490004	GG	On-Demand	Anodyne	ADRB2	46	46
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC)c(SC)c2)cc1	ZINC000819490004	GG	On-Demand	Anodyne	ADRB1	66	45
COC(=O)c1ccc(OC[C@H](O)CNc2ccc(OC)c(SC)c2)cc1	ZINC000819490004	GG	On-Demand	Anodyne	ADRB3	39	44
O=C(O)CCNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000819490006	CC	On-Demand	Anodyne	TBXAS1	20	43
O=C(O)CCNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000819490006	CC	On-Demand	Anodyne	NOS2	101	37
O=C(O)CCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819490008	DC	On-Demand	Anodyne	HTR1A	105	60
O=C(O)CCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819490008	DC	On-Demand	Anodyne	DRD2	81	60
O=C(O)CCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819490008	DC	On-Demand	Anodyne	DRD4	69	53
O=C(O)CCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819490008	DC	On-Demand	Anodyne	ADRA1D	28	44
O=C(O)CCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819490008	DC	On-Demand	Anodyne	HTR2A	65	54
O=C(O)CCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819490008	DC	On-Demand	Anodyne	HTR2C	32	47
O=C(O)CCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819490008	DC	On-Demand	Anodyne	SLC6A4	15	47
O=C(O)CCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819490008	DC	On-Demand	Anodyne	ADRA1A	30	49
O=C(O)CCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819490008	DC	On-Demand	Anodyne	ADRA1B	19	49
O=C(O)CCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819490008	DC	On-Demand	Anodyne	DRD3	104	55
O=C(O)CCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819490008	DC	On-Demand	Anodyne	HTR4	19	40
O=C(O)CCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819490008	DC	On-Demand	Anodyne	DRD5	18	48
O=C(O)CCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819490008	DC	On-Demand	Anodyne	HTR7	114	50
O=C(O)CCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819490008	DC	On-Demand	Anodyne	SIGMAR1	16	49
O=C(O)CCNC(=O)NCCN1CCN(c2ccccc2)CC1	ZINC000819490008	DC	On-Demand	Anodyne	PLD2	71	38
O=C(O)CCNC(=O)NCc1ccc(Cn2cnc3ccccc32)cc1	ZINC000819490010	FE	On-Demand	Anodyne	NR1I2	46	38
O=C(O)CCNC(=O)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000819490012	ED	On-Demand	Anodyne	ADRB3	20	43
O=C(O)CCNC(=O)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000819490012	ED	On-Demand	Anodyne	TBXA2R	45	41
O=C(O)CCNC(=O)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000819490012	ED	On-Demand	Anodyne	TBXAS1	93	42
O=C(O)CCNC(=O)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000819490012	ED	On-Demand	Anodyne	ROCK2	22	44
O=C(O)CCNC(=O)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000819490012	ED	On-Demand	Anodyne	CYP2C9	15	47
O=C(O)CCNC(=O)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000819490012	ED	On-Demand	Anodyne	NAMPT	103	54
O=C(O)CCNC(=O)NCCc1ccc(Br)cc1F	ZINC000819490013	ED	On-Demand	Anodyne	FFAR1	15	41
O=C(O)CCNC(=O)NCc1ccccc1NS(=O)(=O)c1ccccc1	ZINC000819490015	GD	On-Demand	Anodyne	PRTN3	55	37
O=C(O)CCNC(=O)NCc1ccccc1NS(=O)(=O)c1ccccc1	ZINC000819490015	GD	On-Demand	Anodyne	LIMK2	25	40
O=C(O)CCNC(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000819490017	CC	On-Demand	Anodyne	TBXAS1	20	45
O=C(O)CCNC(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000819490017	CC	On-Demand	Anodyne	NOS2	93	35
O=C(O)CCNC(=O)NCc1ccc(-n2ccnc2)nc1	ZINC000819490017	CC	On-Demand	Anodyne	NAMPT	22	61
O=C(O)CCNC(=O)NCc1ccc(-n2cnc3ccccc32)cc1	ZINC000819490018	EE	On-Demand	Anodyne	F9	32	45
O=C(O)CCNC(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000819490019	DC	On-Demand	Anodyne	HRH2	15	43
O=C(O)CCNC(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000819490019	DC	On-Demand	Anodyne	SIGMAR1	21	43
O=C(O)CCNC(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000819490019	DC	On-Demand	Anodyne	DPOL_VZVD	25	45
O=C(O)CCNC(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000819490019	DC	On-Demand	Anodyne	NPFFR1	42	41
O=C(O)CCNC(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000819490022	GF	On-Demand	Anodyne	CYP19A1	22	48
O=C(O)CCNC(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000819490022	GF	On-Demand	Anodyne	CYP11B1	52	54
O=C(O)CCNC(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000819490022	GF	On-Demand	Anodyne	TBXAS1	50	52
O=C(O)CCNC(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000819490022	GF	On-Demand	Anodyne	AGTR2	24	41
O=C(O)CCNC(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000819490022	GF	On-Demand	Anodyne	CYP11B2	25	54
O=C(O)CCNC(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000819490022	GF	On-Demand	Anodyne	CYP17A1	15	42
O=C(O)CCNC(=O)NCc1ccccc1CN1CCOCC1	ZINC000819490025	DC	On-Demand	Anodyne	EPHX2	16	42
O=C(O)CCNC(=O)NCCc1cc2ccccc2[nH]1	ZINC000819490027	CD	On-Demand	Anodyne	MME	18	40
O=C(O)CCNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819490030	EC	On-Demand	Anodyne	HTR1A	59	63
O=C(O)CCNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819490030	EC	On-Demand	Anodyne	DRD2	47	63
O=C(O)CCNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819490030	EC	On-Demand	Anodyne	DRD1	18	49
O=C(O)CCNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819490030	EC	On-Demand	Anodyne	DRD4	48	41
O=C(O)CCNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819490030	EC	On-Demand	Anodyne	ADRA1D	16	42
O=C(O)CCNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819490030	EC	On-Demand	Anodyne	HTR2A	45	49
O=C(O)CCNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819490030	EC	On-Demand	Anodyne	HTR2C	21	47
O=C(O)CCNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819490030	EC	On-Demand	Anodyne	ADRA1A	18	42
O=C(O)CCNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819490030	EC	On-Demand	Anodyne	DRD3	57	49
O=C(O)CCNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819490030	EC	On-Demand	Anodyne	HTR7	64	45
O=C(O)CCNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819490030	EC	On-Demand	Anodyne	SIGMAR1	18	42
O=C(O)CCNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819490030	EC	On-Demand	Anodyne	CCR3	30	42
O=C(O)CCNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819490030	EC	On-Demand	Anodyne	PLD2	73	44
O=C(O)CCNC(=O)NCCN1CCN(c2ccc(F)cc2)CC1	ZINC000819490030	EC	On-Demand	Anodyne	SLC27A1	44	40
CCSCc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819490032	CG	On-Demand	Anodyne	ADRB2	29	44
CCSCc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819490032	CG	On-Demand	Anodyne	ADRB1	27	46
CCSCc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819490032	CG	On-Demand	Anodyne	ADRB3	99	47
CCSCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819490034	CG	On-Demand	Anodyne	ADRB2	29	44
CCSCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819490034	CG	On-Demand	Anodyne	ADRB1	27	46
CCSCc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819490034	CG	On-Demand	Anodyne	ADRB3	99	47
O=C(O)CCNC(=O)NCCNc1nc2ccccc2s1	ZINC000819490035	DD	On-Demand	Anodyne	CSNK1D	28	50
O=C(O)CCNC(=O)NCCNc1nc2ccccc2s1	ZINC000819490035	DD	On-Demand	Anodyne	TMPRSS6	59	33
O=C(O)CCNC(=O)NCc1nnc(-c2ccccc2)s1	ZINC000819490037	DD	On-Demand	Anodyne	MME	19	41
O=C(O)CCNC(=O)NCc1ccc(OCc2cccc(F)c2)cc1	ZINC000819490039	EF	On-Demand	Anodyne	MAOB	36	55
O=C(O)CCNC(=O)NCc1ccc(OCc2cccc(F)c2)cc1	ZINC000819490039	EF	On-Demand	Anodyne	LTA4H	20	41
O=C(O)CCNC(=O)NCc1ccc(OCc2cccc(F)c2)cc1	ZINC000819490039	EF	On-Demand	Anodyne	PTGER3	66	46
O=C(O)CCNC(=O)NCc1ccc(OCc2cccc(F)c2)cc1	ZINC000819490039	EF	On-Demand	Anodyne	GYS1	84	39
O=C(O)CCNC(=O)NCc1ccc(OCc2cccc(F)c2)cc1	ZINC000819490039	EF	On-Demand	Anodyne	FFAR1	96	49
O=C(O)CCNC(=O)NCc1ccc(OCc2cccc(F)c2)cc1	ZINC000819490039	EF	On-Demand	Anodyne	FFAR4	58	48
O=C(O)CCNC(=O)NCc1ccc(OCc2cccc(F)c2)cc1	ZINC000819490039	EF	On-Demand	Anodyne	PDS	50	42
O=C(O)CCNC(=O)NCc1ccccc1-n1ccnc1	ZINC000819490041	CD	On-Demand	Anodyne	TBXAS1	28	42
O=C(O)CCNC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819490045	DC	On-Demand	Anodyne	DRD4	16	42
O=C(O)CCNC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819490045	DC	On-Demand	Anodyne	MAPK14	27	46
O=C(O)CCNC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819490045	DC	On-Demand	Anodyne	EPHX2	19	42
O=C(O)CCNC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000819490045	DC	On-Demand	Anodyne	ST14	21	42
O=C(O)CCNC(=O)NN(Cc1ccccc1)c1ccccc1	ZINC000819490050	DE	On-Demand	Reactive	MME	24	46
O=C(O)CCNC(=O)NCCN1CCc2ccccc2C1	ZINC000819490057	CC	On-Demand	Anodyne	HTR1A	17	50
O=C(O)CCNC(=O)NCCN1CCc2ccccc2C1	ZINC000819490057	CC	On-Demand	Anodyne	DRD3	17	53
O=C(O)CCNC(=O)NCCN1CCc2ccccc2C1	ZINC000819490057	CC	On-Demand	Anodyne	HTR7	25	53
O=C(O)CCNC(=O)NCCN1CCc2ccccc2C1	ZINC000819490057	CC	On-Demand	Anodyne	NOD2	44	37
C=COc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819490065	FH	On-Demand	Anodyne	TGM2	16	40
C=COc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819490065	FH	On-Demand	Anodyne	F13A1	25	40
C=COc1ccc(NC[C@@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819490065	FH	On-Demand	Anodyne	GPR119	49	44
C=COc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819490066	FH	On-Demand	Anodyne	TGM2	16	40
C=COc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819490066	FH	On-Demand	Anodyne	F13A1	25	40
C=COc1ccc(NC[C@H](O)C2CCN(C(=O)OC(C)(C)C)CC2)cc1	ZINC000819490066	FH	On-Demand	Anodyne	GPR119	49	44
O=S1(=O)CCC(O)(CNc2ccc(Cl)cc2OCc2ccccc2)CC1	ZINC000819490115	GG	On-Demand	Anodyne	PPIA	38	42
O=S1(=O)CCC(O)(CNc2ccc(Cl)cc2OCc2ccccc2)CC1	ZINC000819490115	GG	On-Demand	Anodyne	PTGER1	65	44
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2)N1	ZINC000819490118	FE	On-Demand	Anodyne	ADRB2	18	57
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2)N1	ZINC000819490118	FE	On-Demand	Anodyne	ADRB1	37	57
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2)N1	ZINC000819490118	FE	On-Demand	Anodyne	ADRB3	17	52
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2)N1	ZINC000819490119	FE	On-Demand	Anodyne	ADRB2	18	57
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2)N1	ZINC000819490119	FE	On-Demand	Anodyne	ADRB1	37	57
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2)N1	ZINC000819490119	FE	On-Demand	Anodyne	ADRB3	17	52
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2)N1	ZINC000819490120	FE	On-Demand	Anodyne	ADRB2	18	57
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2)N1	ZINC000819490120	FE	On-Demand	Anodyne	ADRB1	37	57
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3cccc4[nH]ccc34)cc2)N1	ZINC000819490120	FE	On-Demand	Anodyne	ADRB3	17	52
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2)N1	ZINC000819490121	FE	On-Demand	Anodyne	ADRB2	18	57
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2)N1	ZINC000819490121	FE	On-Demand	Anodyne	ADRB1	37	57
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3cccc4[nH]ccc34)cc2)N1	ZINC000819490121	FE	On-Demand	Anodyne	ADRB3	17	52
CCOc1ccc(OC[C@H](O)CNc2cc(F)c(OC)c(F)c2OC)cc1	ZINC000819490128	GG	On-Demand	Anodyne	ADRB2	23	40
CCOc1ccc(OC[C@H](O)CNc2cc(F)c(OC)c(F)c2OC)cc1	ZINC000819490128	GG	On-Demand	Anodyne	ADRB1	23	40
CCOc1ccc(OC[C@@H](O)CNc2cc(F)c(OC)c(F)c2OC)cc1	ZINC000819490129	GG	On-Demand	Anodyne	ADRB2	23	40
CCOc1ccc(OC[C@@H](O)CNc2cc(F)c(OC)c(F)c2OC)cc1	ZINC000819490129	GG	On-Demand	Anodyne	ADRB1	23	40
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3cccc([N+](=O)[O-])c3)cc2)N1	ZINC000819490134	FD	On-Demand	Bother	ADRB1	27	44
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3cccc([N+](=O)[O-])c3)cc2)N1	ZINC000819490135	FD	On-Demand	Bother	ADRB1	27	44
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3cccc([N+](=O)[O-])c3)cc2)N1	ZINC000819490136	FD	On-Demand	Bother	ADRB1	27	44
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3cccc([N+](=O)[O-])c3)cc2)N1	ZINC000819490137	FD	On-Demand	Bother	ADRB1	27	44
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)c1	ZINC000819490138	FD	On-Demand	Anodyne	ADRB2	21	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)c1	ZINC000819490138	FD	On-Demand	Anodyne	ADRB1	46	39
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)c1	ZINC000819490138	FD	On-Demand	Anodyne	ABCB1	17	44
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)c1	ZINC000819490139	FD	On-Demand	Anodyne	ADRB2	21	41
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)c1	ZINC000819490139	FD	On-Demand	Anodyne	ADRB1	46	39
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)c1	ZINC000819490139	FD	On-Demand	Anodyne	ABCB1	17	44
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)c1	ZINC000819490140	FD	On-Demand	Anodyne	ADRB2	21	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)c1	ZINC000819490140	FD	On-Demand	Anodyne	ADRB1	46	39
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)c1	ZINC000819490140	FD	On-Demand	Anodyne	ABCB1	17	44
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)c1	ZINC000819490141	FD	On-Demand	Anodyne	ADRB2	21	41
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)c1	ZINC000819490141	FD	On-Demand	Anodyne	ADRB1	46	39
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)c1	ZINC000819490141	FD	On-Demand	Anodyne	ABCB1	17	44
COc1cccc(OC)c1OC[C@H](O)CNc1ccc(O[C@@H]2CC(=O)N2)cc1	ZINC000819490157	GD	On-Demand	Anodyne	ADRB1	43	40
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc(O[C@@H]2CC(=O)N2)cc1	ZINC000819490158	GD	On-Demand	Anodyne	ADRB1	43	40
COc1cccc(OC)c1OC[C@H](O)CNc1ccc(O[C@H]2CC(=O)N2)cc1	ZINC000819490159	GD	On-Demand	Anodyne	ADRB1	43	40
COc1cccc(OC)c1OC[C@@H](O)CNc1ccc(O[C@H]2CC(=O)N2)cc1	ZINC000819490160	GD	On-Demand	Anodyne	ADRB1	43	40
Cc1noc(C2CC2)c1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819490190	FG	On-Demand	Mild	PAPA1_CARPA	34	41
O=C(O)CCNC(=O)NCCSCc1ccccc1	ZINC000819490191	CD	On-Demand	Anodyne	CACNA2D1	21	45
O=C(O)CCNC(=O)NCCSCc1ccccc1	ZINC000819490191	CD	On-Demand	Anodyne	MME	30	44
O=C(O)CCNC(=O)NCCS(=O)(=O)Cc1ccccc1	ZINC000819490192	DC	On-Demand	Anodyne	MME	25	43
O=C(O)CCNC(=O)NCc1ccc(OCc2ccccn2)cc1	ZINC000819490195	ED	On-Demand	Anodyne	CYSLTR1	30	46
O=C(O)CCNC(=O)NCc1ccc(OCc2ccccn2)cc1	ZINC000819490195	ED	On-Demand	Anodyne	LTA4H	19	44
O=C(O)CCNC(=O)NCc1ccc(OCc2ccccn2)cc1	ZINC000819490195	ED	On-Demand	Anodyne	FFAR1	47	44
O=C(O)CCNC(=O)NCc1ccc(OCc2ccccn2)cc1	ZINC000819490195	ED	On-Demand	Anodyne	FFAR4	49	39
O=C(O)CCNC(=O)NCc1ccc(OCc2ccccn2)cc1	ZINC000819490195	ED	On-Demand	Anodyne	SMO	20	42
O=C(O)CCNC(=O)NCCN1CCc2sccc2C1	ZINC000819490196	CC	On-Demand	Anodyne	UTS2R	15	42
O=C(O)CCNC(=O)NCc1cccc(Cn2cnc3ccccc32)c1	ZINC000819490197	FE	On-Demand	Anodyne	NR1I2	49	42
O=C(O)CCNC(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000819490198	CD	On-Demand	Anodyne	TBXAS1	32	62
O=C(O)CCNC(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000819490198	CD	On-Demand	Anodyne	NOS2	81	35
O=C(O)CCNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000819490204	EC	On-Demand	Anodyne	DRD4	30	42
O=C(O)CCNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000819490204	EC	On-Demand	Anodyne	ACHE	31	46
O=C(O)CCNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000819490204	EC	On-Demand	Anodyne	SIGMAR1	39	51
O=C(O)CCNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000819490204	EC	On-Demand	Anodyne	CCR3	28	46
O=C(O)CCNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000819490204	EC	On-Demand	Anodyne	MCHR1	28	47
O=C(O)CCNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000819490204	EC	On-Demand	Anodyne	NPFFR1	41	40
O=C(O)CCNC(=O)NCc1ccc(Oc2cccnc2)c(F)c1	ZINC000819490207	EE	On-Demand	Anodyne	TBXAS1	51	41
O=C(O)CCNC(=O)NCc1ccc(Oc2cccnc2)c(F)c1	ZINC000819490207	EE	On-Demand	Anodyne	NAMPT	33	43
O=C(O)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819490208	FD	On-Demand	Anodyne	HTR1A	92	64
O=C(O)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819490208	FD	On-Demand	Anodyne	DRD2	78	60
O=C(O)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819490208	FD	On-Demand	Anodyne	DRD1	18	45
O=C(O)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819490208	FD	On-Demand	Anodyne	DRD4	60	58
O=C(O)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819490208	FD	On-Demand	Anodyne	ADRA1D	17	45
O=C(O)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819490208	FD	On-Demand	Anodyne	HTR2A	73	60
O=C(O)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819490208	FD	On-Demand	Anodyne	HTR2C	39	51
O=C(O)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819490208	FD	On-Demand	Anodyne	SLC6A4	20	55
O=C(O)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819490208	FD	On-Demand	Anodyne	ADRA1A	25	46
O=C(O)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819490208	FD	On-Demand	Anodyne	ADRA1B	18	45
O=C(O)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819490208	FD	On-Demand	Anodyne	DRD3	103	58
O=C(O)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819490208	FD	On-Demand	Anodyne	HTR4	18	44
O=C(O)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819490208	FD	On-Demand	Anodyne	HTR7	89	50
O=C(O)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000819490208	FD	On-Demand	Anodyne	PLD2	59	43
O=C(O)CCNC(=O)NCc1ccnc(Oc2ccccc2)c1	ZINC000819490210	DE	On-Demand	Anodyne	PDS	44	32
O=C(O)CCNC(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000819490211	DD	On-Demand	Anodyne	HRH2	29	54
O=C(O)CCNC(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000819490211	DD	On-Demand	Anodyne	HRH3	26	43
O=C(O)CCNC(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000819490211	DD	On-Demand	Anodyne	SIGMAR1	29	49
O=C(O)CCNC(=O)NCc1ccc(CN2CCCC2)cc1	ZINC000819490211	DD	On-Demand	Anodyne	NPFFR1	48	43
O=C(O)CCNC(=O)NCc1cc2ccccc2s1	ZINC000819490212	CE	On-Demand	Anodyne	AROQ	17	40
O=C(O)CCNC(=O)NCc1ccc(NC(=O)c2ccncc2)cc1	ZINC000819490213	ED	On-Demand	Anodyne	TRPV1	17	42
O=C(O)CCNC(=O)NCc1ccc(NC(=O)c2ccncc2)cc1	ZINC000819490213	ED	On-Demand	Anodyne	ROCK2	23	51
O=C(O)CCNC(=O)NCc1ccc(NC(=O)c2ccncc2)cc1	ZINC000819490213	ED	On-Demand	Anodyne	NAMPT	58	41
O=C(O)CCNC(=O)NCc1ccc(NC(=O)c2ccncc2)cc1	ZINC000819490213	ED	On-Demand	Anodyne	KCNK3	38	45
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccncc2)c1	ZINC000819490215	ED	On-Demand	Anodyne	GCGR	25	43
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccncc2)c1	ZINC000819490215	ED	On-Demand	Anodyne	ROCK2	36	45
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccncc2)c1	ZINC000819490215	ED	On-Demand	Anodyne	NAMPT	40	39
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccncc2)c1	ZINC000819490215	ED	On-Demand	Anodyne	KCNK3	95	54
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccncc2)c1	ZINC000819490215	ED	On-Demand	Anodyne	KCNK9	50	38
O=C(O)CCNC(=O)NCc1ccc(Oc2ccccc2)cc1	ZINC000819490217	DF	On-Demand	Anodyne	MME	23	57
O=C(O)CCNC(=O)NCc1ccc(Oc2ccccc2)cc1	ZINC000819490217	DF	On-Demand	Anodyne	LTA4H	47	48
O=C(O)CCNC(=O)NCc1ccc(Oc2ccccc2)cc1	ZINC000819490217	DF	On-Demand	Anodyne	MMP13	15	43
O=C(O)CCNC(=O)NCc1ccc(Oc2ccccc2)cc1	ZINC000819490217	DF	On-Demand	Anodyne	MMP2	19	43
O=C(O)CCNC(=O)NCc1ccc(Oc2ccccc2)cc1	ZINC000819490217	DF	On-Demand	Anodyne	FAAH	15	40
O=C(O)CCNC(=O)NCc1ccc(Oc2ccccc2)cc1	ZINC000819490217	DF	On-Demand	Anodyne	AMP1_PLAFQ	32	42
O=C(O)CCNC(=O)NCc1ccc(Oc2ccccc2)cc1	ZINC000819490217	DF	On-Demand	Anodyne	FFAR1	44	57
O=C(O)CCNC(=O)NCc1ccc(Oc2ccccc2)cc1	ZINC000819490217	DF	On-Demand	Anodyne	FFAR4	39	45
O=C(O)CCNC(=O)NCc1ccc(Oc2ccccc2)cc1	ZINC000819490217	DF	On-Demand	Anodyne	CRTM	46	36
O=C(O)CCNC(=O)NCc1ccc(Oc2ccccc2)cc1	ZINC000819490217	DF	On-Demand	Anodyne	NAMPT	17	49
O=C(O)CCNC(=O)NCc1ccc(Oc2ccccc2)cc1	ZINC000819490217	DF	On-Demand	Anodyne	PDS	50	37
O=C(O)CCNC(=O)NCc1ccccc1CN1CCCCC1	ZINC000819490220	DD	On-Demand	Anodyne	HRH2	28	49
O=C(O)CCNC(=O)NCc1ccccc1CN1CCCCC1	ZINC000819490220	DD	On-Demand	Anodyne	NPFFR1	43	39
O=C(O)CCNC(=O)NCc1coc2ccccc12	ZINC000819490222	CD	On-Demand	Anodyne	MTNR1A	17	41
O=C(O)CCNC(=O)NCc1ccc(COc2ccccc2)cc1	ZINC000819490223	EF	On-Demand	Anodyne	MAOB	16	46
O=C(O)CCNC(=O)NCc1ccc(COc2ccccc2)cc1	ZINC000819490223	EF	On-Demand	Anodyne	MME	23	43
O=C(O)CCNC(=O)NCc1ccc(COc2ccccc2)cc1	ZINC000819490223	EF	On-Demand	Anodyne	LTA4H	28	45
O=C(O)CCNC(=O)NCc1ccc(COc2ccccc2)cc1	ZINC000819490223	EF	On-Demand	Anodyne	PTGER3	65	40
O=C(O)CCNC(=O)NCc1ccc(COc2ccccc2)cc1	ZINC000819490223	EF	On-Demand	Anodyne	FAAH	18	40
O=C(O)CCNC(=O)NCc1ccc(COc2ccccc2)cc1	ZINC000819490223	EF	On-Demand	Anodyne	FFAR1	69	55
O=C(O)CCNC(=O)NCc1ccc(COc2ccccc2)cc1	ZINC000819490223	EF	On-Demand	Anodyne	FFAR4	55	46
O=C(O)CCNC(=O)NCc1ccc(COc2ccccc2)cc1	ZINC000819490223	EF	On-Demand	Anodyne	NAMPT	15	40
O=C(O)CCNC(=O)NCc1ccc(COc2ccccc2)cc1	ZINC000819490223	EF	On-Demand	Anodyne	PDS	57	41
O=C(O)CCNC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819490224	FF	On-Demand	Anodyne	PPIA	41	40
O=C(O)CCNC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819490224	FF	On-Demand	Anodyne	MME	19	40
O=C(O)CCNC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819490224	FF	On-Demand	Anodyne	ROCK2	26	48
O=C(O)CCNC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819490224	FF	On-Demand	Anodyne	EPHX2	22	46
O=C(O)CCNC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819490224	FF	On-Demand	Anodyne	NCE103	20	45
O=C(O)CCNC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819490224	FF	On-Demand	Anodyne	P96878_MYCTU	17	45
O=C(O)CCNC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819490224	FF	On-Demand	Anodyne	NAMPT	36	47
O=C(O)CCNC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000819490224	FF	On-Demand	Anodyne	KCNK3	45	35
O=C(O)CCNC(=O)NCc1csc2ccccc12	ZINC000819490228	CE	On-Demand	Anodyne	FFAR2	63	36
O=C(O)CCNC(=O)NCc1ccc(-n2cccn2)cc1	ZINC000819490230	CD	On-Demand	Anodyne	AMP1_PLAFQ	66	42
O=C(O)CCNC(=O)NCc1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000819490234	FE	On-Demand	Anodyne	GCGR	55	41
O=C(O)CCNC(=O)NCc1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000819490234	FE	On-Demand	Anodyne	FOLH1	18	43
O=C(O)CCNC(=O)NCc1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000819490234	FE	On-Demand	Anodyne	KCNK3	15	44
O=C(O)CCNC(=O)NCc1ccc(N2CC=CC2)cc1	ZINC000819490235	CD	On-Demand	Clean	MME	15	41
O=C(O)CCNC(=O)NCCNS(=O)(=O)Cc1ccccc1	ZINC000819490238	EB	On-Demand	Anodyne	MME	26	43
O=C(O)CCNC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819490239	DD	On-Demand	Anodyne	AVPR2	15	42
O=C(O)CCNC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819490239	DD	On-Demand	Anodyne	DPP7	42	36
O=C(O)CCNC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819490239	DD	On-Demand	Anodyne	MLYCD	18	42
O=C(O)CCNC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819490239	DD	On-Demand	Anodyne	L3MBTL3	75	40
O=C(O)CCNC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000819490239	DD	On-Demand	Anodyne	NAMPT	15	48
O=C(O)CCNC(=O)NCc1cccc(CO)c1	ZINC000819490243	CC	On-Demand	Anodyne	MME	17	40
O=C(O)CCNC(=O)NCc1cccc(CO)c1	ZINC000819490243	CC	On-Demand	Anodyne	FFAR1	18	43
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2cccc(F)c2)c1	ZINC000819490247	FE	On-Demand	Anodyne	ROCK2	25	45
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2cccc(F)c2)c1	ZINC000819490247	FE	On-Demand	Anodyne	KCNK3	105	56
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2cccc(F)c2)c1	ZINC000819490247	FE	On-Demand	Anodyne	KCNK9	55	50
O=C(O)CCNC(=O)NCc1cccnc1Oc1cccc(F)c1	ZINC000819490248	EE	On-Demand	Anodyne	P2RY1	21	45
O=C(O)CCNC(=O)NCCNc1ccccc1	ZINC000819490249	CC	On-Demand	Anodyne	MME	22	42
O=C(O)CCNC(=O)NCCOc1ccccc1-c1ccccc1	ZINC000819490252	EF	On-Demand	Anodyne	FOLH1	31	43
O=C(O)CCNC(=O)NCCOc1ccccc1-c1ccccc1	ZINC000819490252	EF	On-Demand	Anodyne	FABP3	27	46
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000819490256	EE	On-Demand	Anodyne	GCGR	26	45
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000819490256	EE	On-Demand	Anodyne	PPIA	29	40
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000819490256	EE	On-Demand	Anodyne	MME	18	40
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000819490256	EE	On-Demand	Anodyne	PRNP	17	45
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000819490256	EE	On-Demand	Anodyne	ROCK2	26	47
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000819490256	EE	On-Demand	Anodyne	NAMPT	16	40
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000819490256	EE	On-Demand	Anodyne	KCNK3	125	49
O=C(O)CCNC(=O)NCc1cccc(NC(=O)c2ccccc2)c1	ZINC000819490256	EE	On-Demand	Anodyne	KCNK9	71	46
O=C(O)CCNC(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000819490259	DC	On-Demand	Clean	STAT6	53	38
O=C(O)CCNC(=O)NCc1cccc(COc2ccccc2)c1	ZINC000819490261	EF	On-Demand	Anodyne	HRH2	22	46
O=C(O)CCNC(=O)NCc1cccc(COc2ccccc2)c1	ZINC000819490261	EF	On-Demand	Anodyne	LTA4H	22	42
O=C(O)CCNC(=O)NCc1cccc(COc2ccccc2)c1	ZINC000819490261	EF	On-Demand	Anodyne	PTGER4	15	49
O=C(O)CCNC(=O)NCc1cccc(COc2ccccc2)c1	ZINC000819490261	EF	On-Demand	Anodyne	PTGER3	68	42
O=C(O)CCNC(=O)NCc1cccc(COc2ccccc2)c1	ZINC000819490261	EF	On-Demand	Anodyne	ADAM17	15	40
O=C(O)CCNC(=O)NCc1cccc(COc2ccccc2)c1	ZINC000819490261	EF	On-Demand	Anodyne	GYS1	47	35
O=C(O)CCNC(=O)NCc1cccc(COc2ccccc2)c1	ZINC000819490261	EF	On-Demand	Anodyne	FAAH	16	40
O=C(O)CCNC(=O)NCc1cccc(COc2ccccc2)c1	ZINC000819490261	EF	On-Demand	Anodyne	FFAR1	91	54
O=C(O)CCNC(=O)NCc1cccc(COc2ccccc2)c1	ZINC000819490261	EF	On-Demand	Anodyne	FFAR4	55	52
O=C(O)CCNC(=O)NCc1cccc(COc2ccccc2)c1	ZINC000819490261	EF	On-Demand	Anodyne	PDS	69	39
O=C(O)CCNC(=O)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000819490262	DD	On-Demand	Anodyne	TBXAS1	16	44
O=C(O)CCNC(=O)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000819490262	DD	On-Demand	Anodyne	NOS2	88	34
O=C(O)CCNC(=O)NCc1ccc(N2CCOCC2)nc1	ZINC000819490263	DC	On-Demand	Anodyne	HPGDS	16	41
O=C(O)CCNC(=O)NCc1ccc(N2CCOCC2)nc1	ZINC000819490263	DC	On-Demand	Anodyne	NAMPT	26	44
O=C(O)CCNC(=O)NCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000819490267	FD	On-Demand	Anodyne	TRPV1	15	45
O=C(O)CCNC(=O)NCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000819490267	FD	On-Demand	Anodyne	ROCK1	15	45
O=C(O)CCNC(=O)NCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000819490267	FD	On-Demand	Anodyne	ROCK2	31	56
O=C(O)CCNC(=O)NCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000819490267	FD	On-Demand	Anodyne	NAMPT	56	43
O=C(O)CCNC(=O)NNC(=O)C12CC3CC(CC(C3)C1)C2	ZINC000819490268	DD	On-Demand	Reactive	EPHX2	35	50
O=C(O)CCNC(=O)NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1	ZINC000819490273	FE	On-Demand	Anodyne	GCGR	55	41
O=C(O)CCNC(=O)NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1	ZINC000819490273	FE	On-Demand	Anodyne	FOLH1	18	43
O=C(O)CCNC(=O)NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1	ZINC000819490273	FE	On-Demand	Anodyne	KCNK3	15	44
O=C(O)CCNC(=O)NCCc1ccc(Cl)nc1	ZINC000819490277	CD	On-Demand	Anodyne	FFAR1	15	50
O=C(O)CCNC(=O)NCCc1ccc(Cl)nc1	ZINC000819490277	CD	On-Demand	Anodyne	NACHRBETA2	41	37
O=C(O)CCNC(=O)NCCNC(=O)c1c(F)cccc1F	ZINC000819490279	DC	On-Demand	Anodyne	MME	16	42
O=C(O)CCNC(=O)NCCNC(=O)c1c(F)cccc1F	ZINC000819490279	DC	On-Demand	Anodyne	DAC	23	43
O=C(O)CCNC(=O)NCCNc1ccc(C(F)(F)F)cn1	ZINC000819490281	DD	On-Demand	Anodyne	GCGR	27	41
O=C(O)CCNC(=O)NCCc1nc2ccccc2s1	ZINC000819490282	CD	On-Demand	Anodyne	AKR1B1	30	41
O=C(O)CCNC(=O)NCCc1nc2ccccc2s1	ZINC000819490282	CD	On-Demand	Anodyne	TMPRSS6	40	31
O=C(O)CCNC(=O)NCc1ccccc1Cn1cncn1	ZINC000819490283	DC	On-Demand	Anodyne	HIS3	43	38
O=C(O)CCNC(=O)NCCOc1cccnc1	ZINC000819490285	CC	On-Demand	Anodyne	TBXA2R	20	40
O=C(O)CCNC(=O)NCCOc1cccnc1	ZINC000819490285	CC	On-Demand	Anodyne	TBXAS1	74	47
O=C(O)CCNC(=O)NCc1csc(CNC(=O)c2ccccc2)n1	ZINC000819490287	FD	On-Demand	Anodyne	GIPR	44	36
O=C(O)CCNC(=O)NCc1cccc(C(=O)N2CCOCC2)c1	ZINC000819490288	EC	On-Demand	Anodyne	EPHX2	17	46
O=C(O)CCNC(=O)NCc1ccccc1CO	ZINC000819490313	CC	On-Demand	Anodyne	MME	22	42
O=C(O)CCNC(=O)NCc1ccccc1CO	ZINC000819490313	CC	On-Demand	Anodyne	ANPEP	15	40
O=C(O)CCNC(=O)NCc1cc(O)nc2ccccc12	ZINC000819490333	CD	On-Demand	Anodyne	BCHE	41	32
O=C(O)CCNC(=O)NCc1cc(O)nc2ccccc12	ZINC000819490333	CD	On-Demand	Anodyne	METG	62	34
O=C(O)CCNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819490339	FB	On-Demand	Anodyne	TGM2	57	39
O=C(O)CCNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819490339	FB	On-Demand	Anodyne	F13A1	52	34
O=C(O)CCNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000819490339	FB	On-Demand	Anodyne	NAMPT	89	53
O=C(O)CCNC(=O)NCc1ccc(Oc2ccccc2F)c(F)c1	ZINC000819490344	FG	On-Demand	Anodyne	CXCL8	19	47
Cc1noc(C2CC2)c1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819490356	FG	On-Demand	Mild	PAPA1_CARPA	34	41
CCOc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819490364	FE	On-Demand	Anodyne	ADRB2	34	40
CCOc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819490364	FE	On-Demand	Anodyne	ADRB1	57	40
CCOc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819490367	FE	On-Demand	Anodyne	ADRB2	34	40
CCOc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819490367	FE	On-Demand	Anodyne	ADRB1	57	40
CCOc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819490369	FE	On-Demand	Anodyne	ADRB2	34	40
CCOc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819490369	FE	On-Demand	Anodyne	ADRB1	57	40
CCOc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819490371	FE	On-Demand	Anodyne	ADRB2	34	40
CCOc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819490371	FE	On-Demand	Anodyne	ADRB1	57	40
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3ccccc3[N+](=O)[O-])cc2)N1	ZINC000819490451	FD	On-Demand	Bother	ADRB1	40	32
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3ccccc3[N+](=O)[O-])cc2)N1	ZINC000819490452	FD	On-Demand	Bother	ADRB1	40	32
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3ccccc3[N+](=O)[O-])cc2)N1	ZINC000819490453	FD	On-Demand	Bother	ADRB1	40	32
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3ccccc3[N+](=O)[O-])cc2)N1	ZINC000819490454	FD	On-Demand	Bother	ADRB1	40	32
CSc1ccc(OC[C@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819490486	FE	On-Demand	Anodyne	ADRB1	50	39
CSc1ccc(OC[C@@H](O)CNc2ccc(O[C@@H]3CC(=O)N3)cc2)cc1	ZINC000819490487	FE	On-Demand	Anodyne	ADRB1	50	39
CSc1ccc(OC[C@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819490488	FE	On-Demand	Anodyne	ADRB1	50	39
CSc1ccc(OC[C@@H](O)CNc2ccc(O[C@H]3CC(=O)N3)cc2)cc1	ZINC000819490489	FE	On-Demand	Anodyne	ADRB1	50	39
O[C@H](CNc1ccc(Cl)cc1OCc1ccccc1)COC1CCOCC1	ZINC000819490490	GH	On-Demand	Anodyne	PTGER1	48	38
O[C@@H](CNc1ccc(Cl)cc1OCc1ccccc1)COC1CCOCC1	ZINC000819490491	GH	On-Demand	Anodyne	PTGER1	48	38
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3cccc(C(F)(F)F)c3)cc2)N1	ZINC000819490519	GF	On-Demand	Anodyne	ADRB1	31	43
O=C1C[C@@H](Oc2ccc(NC[C@H](O)COc3cccc(C(F)(F)F)c3)cc2)N1	ZINC000819490519	GF	On-Demand	Anodyne	PDS	46	41
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3cccc(C(F)(F)F)c3)cc2)N1	ZINC000819490520	GF	On-Demand	Anodyne	ADRB1	31	43
O=C1C[C@H](Oc2ccc(NC[C@@H](O)COc3cccc(C(F)(F)F)c3)cc2)N1	ZINC000819490520	GF	On-Demand	Anodyne	PDS	46	41
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3cccc(C(F)(F)F)c3)cc2)N1	ZINC000819490521	GF	On-Demand	Anodyne	ADRB1	31	43
O=C1C[C@H](Oc2ccc(NC[C@H](O)COc3cccc(C(F)(F)F)c3)cc2)N1	ZINC000819490521	GF	On-Demand	Anodyne	PDS	46	41
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3cccc(C(F)(F)F)c3)cc2)N1	ZINC000819490522	GF	On-Demand	Anodyne	ADRB1	31	43
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)COc3cccc(C(F)(F)F)c3)cc2)N1	ZINC000819490522	GF	On-Demand	Anodyne	PDS	46	41
O=C1C[C@@H](Oc2ccc(NC[C@H](O)CN3CCc4ccccc4C3)cc2)N1	ZINC000819490527	FD	On-Demand	Anodyne	NOD2	43	37
O=C1C[C@H](Oc2ccc(NC[C@@H](O)CN3CCc4ccccc4C3)cc2)N1	ZINC000819490528	FD	On-Demand	Anodyne	NOD2	43	37
O=C1C[C@H](Oc2ccc(NC[C@H](O)CN3CCc4ccccc4C3)cc2)N1	ZINC000819490529	FD	On-Demand	Anodyne	NOD2	43	37
O=C1C[C@@H](Oc2ccc(NC[C@@H](O)CN3CCc4ccccc4C3)cc2)N1	ZINC000819490530	FD	On-Demand	Anodyne	NOD2	43	37
OC1(CNc2ccc(Cl)cc2OCc2ccccc2)CCOCC1	ZINC000819490531	EH	On-Demand	Anodyne	PTGER1	59	43
CCS(=O)(=O)Cc1ccc(NCCC(=O)Nc2ccc(N(C)C)cc2)cc1	ZINC000819490585	GG	On-Demand	Anodyne	RORC	17	40
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819490619	GH	On-Demand	Anodyne	ADRB2	19	43
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2cccc(Br)c2)cc1	ZINC000819490619	GH	On-Demand	Anodyne	ADRB1	16	43
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819490620	GH	On-Demand	Anodyne	ADRB2	19	43
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2cccc(Br)c2)cc1	ZINC000819490620	GH	On-Demand	Anodyne	ADRB1	16	43
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2ccccc2C)cc1	ZINC000819490645	EG	On-Demand	Anodyne	PTPRB	44	35
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2ccccc2C)cc1	ZINC000819490646	EG	On-Demand	Anodyne	PTPRB	44	35
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819490647	DF	On-Demand	Anodyne	ADRB2	28	58
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819490647	DF	On-Demand	Anodyne	ADRB1	23	45
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2ccccc2)cc1	ZINC000819490647	DF	On-Demand	Anodyne	ADRB3	71	45
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819490648	DF	On-Demand	Anodyne	ADRB2	28	58
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819490648	DF	On-Demand	Anodyne	ADRB1	23	45
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2ccccc2)cc1	ZINC000819490648	DF	On-Demand	Anodyne	ADRB3	71	45
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819490655	FG	On-Demand	Anodyne	ADRB2	16	40
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819490656	FG	On-Demand	Anodyne	ADRB2	16	40
CCSCc1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819490689	EH	On-Demand	Bother	ADRB1	16	42
CCSCc1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000819490690	EH	On-Demand	Bother	ADRB1	16	42
C=COc1ccc(NC[C@H](O)COCc2ccc(OC)cc2)cc1	ZINC000819490691	EG	On-Demand	Anodyne	CASR	18	44
C=COc1ccc(NC[C@@H](O)COCc2ccc(OC)cc2)cc1	ZINC000819490692	EG	On-Demand	Anodyne	CASR	18	44
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819490693	GH	On-Demand	Anodyne	PTPRB	44	35
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2ccccc2C(F)(F)F)cc1	ZINC000819490694	GH	On-Demand	Anodyne	PTPRB	44	35
CC(C)(C)OC(=O)NCC[C@H](O)CNc1cccc(CC#N)c1	ZINC000819490705	DE	On-Demand	Mild	PAPA1_CARPA	40	43
CC(C)(C)OC(=O)NCC[C@@H](O)CNc1cccc(CC#N)c1	ZINC000819490706	DE	On-Demand	Mild	PAPA1_CARPA	40	43
C=COc1ccc(NC[C@H](O)COc2c(OC)cccc2OC)cc1	ZINC000819490717	EG	On-Demand	Anodyne	ADRB2	34	41
C=COc1ccc(NC[C@@H](O)COc2c(OC)cccc2OC)cc1	ZINC000819490718	EG	On-Demand	Anodyne	ADRB2	34	41
CC(C)(C)OC(=O)N1CCC([C@H](O)CNc2cccc(CC#N)c2)CC1	ZINC000819490719	FG	On-Demand	Mild	GPR119	40	51
CC(C)(C)OC(=O)N1CCC([C@@H](O)CNc2cccc(CC#N)c2)CC1	ZINC000819490720	FG	On-Demand	Mild	GPR119	40	51
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819490729	GF	On-Demand	Anodyne	ADRB2	20	54
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819490729	GF	On-Demand	Anodyne	PTPRB	50	40
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819490730	GF	On-Demand	Anodyne	ADRB2	20	54
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2cc(OC)ccc2OC)cc1	ZINC000819490730	GF	On-Demand	Anodyne	PTPRB	50	40
CSc1c(F)cc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819490734	GI	On-Demand	Mild	PAPA1_CARPA	42	47
CSc1c(F)cc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc1F	ZINC000819490735	GI	On-Demand	Mild	PAPA1_CARPA	42	47
CC(C)(C)OC(=O)N1CCN(CCOc2ccccc2NCCC#N)CC1	ZINC000819490736	FF	On-Demand	Mild	DRD2	23	42
CC(C)(C)OC(=O)N1CCN(CCOc2ccccc2NCCC#N)CC1	ZINC000819490736	FF	On-Demand	Mild	GPR119	29	40
Cc1ccc(OC[C@@H](O)CNc2cc(C)cc(CNC(=O)C(F)(F)F)c2)cc1	ZINC000819490750	GG	On-Demand	Anodyne	ADRB2	29	46
Cc1ccc(OC[C@@H](O)CNc2cc(C)cc(CNC(=O)C(F)(F)F)c2)cc1	ZINC000819490750	GG	On-Demand	Anodyne	ADRB1	48	41
Cc1ccc(OC[C@@H](O)CNc2cc(C)cc(CNC(=O)C(F)(F)F)c2)cc1	ZINC000819490750	GG	On-Demand	Anodyne	PDS	57	34
Cc1ccc(OC[C@H](O)CNc2cc(C)cc(CNC(=O)C(F)(F)F)c2)cc1	ZINC000819490751	GG	On-Demand	Anodyne	ADRB2	29	46
Cc1ccc(OC[C@H](O)CNc2cc(C)cc(CNC(=O)C(F)(F)F)c2)cc1	ZINC000819490751	GG	On-Demand	Anodyne	ADRB1	48	41
Cc1ccc(OC[C@H](O)CNc2cc(C)cc(CNC(=O)C(F)(F)F)c2)cc1	ZINC000819490751	GG	On-Demand	Anodyne	PDS	57	34
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819490752	DE	On-Demand	Anodyne	ADRB2	34	46
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819490752	DE	On-Demand	Anodyne	ADRB1	31	46
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2cccnc2)cc1	ZINC000819490752	DE	On-Demand	Anodyne	ADRB3	116	54
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819490753	DE	On-Demand	Anodyne	ADRB2	34	46
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819490753	DE	On-Demand	Anodyne	ADRB1	31	46
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2cccnc2)cc1	ZINC000819490753	DE	On-Demand	Anodyne	ADRB3	116	54
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819490766	EG	On-Demand	Anodyne	PTPRB	44	35
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2cc(C)cc(C)c2)cc1	ZINC000819490767	EG	On-Demand	Anodyne	PTPRB	44	35
CC(C)(C)OC(=O)N1CCN(CCOc2ccccc2NCCC(N)=O)CC1	ZINC000819490779	GD	On-Demand	Anodyne	DRD2	30	43
CC(C)(C)OC(=O)N1CCN(CCOc2ccccc2NCCC(N)=O)CC1	ZINC000819490779	GD	On-Demand	Anodyne	HTR7	41	37
CC(C)(C)OC(=O)N1CCN(CCOc2ccccc2NCCC(N)=O)CC1	ZINC000819490779	GD	On-Demand	Anodyne	SLC9A1	58	33
COCc1cc(O)ccc1NC[C@H](O)c1ccccc1	ZINC000819490781	CF	On-Demand	Anodyne	ADRB2	19	40
COCc1cc(O)ccc1NC[C@H](O)c1ccccc1	ZINC000819490781	CF	On-Demand	Anodyne	AOC3	15	40
COCc1cc(O)ccc1NC[C@@H](O)c1ccccc1	ZINC000819490782	CF	On-Demand	Anodyne	ADRB2	19	40
COCc1cc(O)ccc1NC[C@@H](O)c1ccccc1	ZINC000819490782	CF	On-Demand	Anodyne	AOC3	15	40
CC(C)(O)CNc1ccccc1OCCN1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819490799	GF	On-Demand	Anodyne	DRD2	32	43
CC(C)(O)CNc1ccccc1OCCN1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819490799	GF	On-Demand	Anodyne	HTR7	45	34
CC(C)(O)CNc1ccccc1OCCN1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819490799	GF	On-Demand	Anodyne	GPR119	41	39
CC[C@H](O)CNc1ccccc1OCCN1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819490800	GF	On-Demand	Clean	ABCB1	24	50
CC[C@H](O)CNc1ccccc1OCCN1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819490800	GF	On-Demand	Clean	GPR119	33	41
COCc1cc(O)ccc1NC[C@H](O)c1cccnc1	ZINC000819490826	CE	On-Demand	Anodyne	ADRB1	18	41
COCc1cc(O)ccc1NC[C@H](O)c1cccnc1	ZINC000819490826	CE	On-Demand	Anodyne	ADRB3	51	41
COCc1cc(O)ccc1NC[C@@H](O)c1cccnc1	ZINC000819490827	CE	On-Demand	Anodyne	ADRB1	18	41
COCc1cc(O)ccc1NC[C@@H](O)c1cccnc1	ZINC000819490827	CE	On-Demand	Anodyne	ADRB3	51	41
CCSCc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819490857	DI	On-Demand	Anodyne	ADRB2	16	43
CCSCc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819490857	DI	On-Demand	Anodyne	ADRB1	16	43
CCSCc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819490858	DI	On-Demand	Anodyne	ADRB2	16	43
CCSCc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819490858	DI	On-Demand	Anodyne	ADRB1	16	43
O[C@@H](CNc1ccc2c(c1)CN(CC(F)(F)F)C2)c1cccc(Cl)c1	ZINC000819490869	FI	On-Demand	Anodyne	ADRB1	24	41
O[C@H](CNc1ccc2c(c1)CN(CC(F)(F)F)C2)c1cccc(Cl)c1	ZINC000819490870	FI	On-Demand	Anodyne	ADRB1	24	41
COc1ccc2c(c1)CC[C@H](NC(=O)C(F)=C1CCC1)C2	ZINC000819490894	CG	On-Demand	Anodyne	NQO2	26	40
C=COc1ccc(NCCC(=O)Nc2cc(OC)c(OC)c(OC)c2)cc1	ZINC000819490939	FH	On-Demand	Anodyne	ENPP1	60	31
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)C(F)=C1CCC1	ZINC000819490942	EG	On-Demand	Anodyne	SPHK1	33	40
CON(C)C(=O)CCNc1ccc2cnccc2c1	ZINC000819490961	CE	On-Demand	Anodyne	CYP26A1	61	36
CCS(=O)(=O)Cc1ccc(NC[C@@](C)(O)CNC(=O)OC(C)(C)C)cc1	ZINC000819491068	GE	On-Demand	Anodyne	PTPRB	59	44
CCS(=O)(=O)Cc1ccc(NC[C@](C)(O)CNC(=O)OC(C)(C)C)cc1	ZINC000819491069	GE	On-Demand	Anodyne	PTPRB	59	44
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819491072	GH	On-Demand	Anodyne	ADRB2	16	42
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1	ZINC000819491073	GH	On-Demand	Anodyne	ADRB2	16	42
CCSCc1ccc(NC[C@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819491076	DI	On-Demand	Anodyne	ADRB2	15	40
CCSCc1ccc(NC[C@@H](O)c2ccc(F)c(F)c2)cc1	ZINC000819491077	DI	On-Demand	Anodyne	ADRB2	15	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc(CC#N)c1	ZINC000819491098	GH	On-Demand	Mild	CTSD	82	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc(CC#N)c1	ZINC000819491098	GH	On-Demand	Mild	PGC	54	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc(CC#N)c1	ZINC000819491098	GH	On-Demand	Mild	PAPA1_CARPA	60	52
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc(CC#N)c1	ZINC000819491098	GH	On-Demand	Mild	CTSK	18	48
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc(CC#N)c1	ZINC000819491098	GH	On-Demand	Mild	CTSL	30	52
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc(CC#N)c1	ZINC000819491098	GH	On-Demand	Mild	BACE2	44	38
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc(CC#N)c1	ZINC000819491098	GH	On-Demand	Mild	TACR3	15	40
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc(CC#N)c1	ZINC000819491098	GH	On-Demand	Mild	REN	67	49
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc(CC#N)c1	ZINC000819491098	GH	On-Demand	Mild	REN1	17	45
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc(CC#N)c1	ZINC000819491098	GH	On-Demand	Mild	CTSS	19	52
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc(CC#N)c1	ZINC000819491098	GH	On-Demand	Mild	BACE1	68	44
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CNc1cccc(CC#N)c1	ZINC000819491098	GH	On-Demand	Mild	FPR1	51	39
CCS(=O)(=O)Cc1ccc(NC[C@H](O)CN(C)C(=O)OC(C)(C)C)cc1	ZINC000819491113	GE	On-Demand	Anodyne	PTPRB	52	36
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)CN(C)C(=O)OC(C)(C)C)cc1	ZINC000819491114	GE	On-Demand	Anodyne	PTPRB	52	36
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819491140	EF	On-Demand	Anodyne	ADRB2	21	43
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819491140	EF	On-Demand	Anodyne	ADRB1	18	43
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2cccc(F)c2)cc1	ZINC000819491140	EF	On-Demand	Anodyne	ADRB3	44	39
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819491141	EF	On-Demand	Anodyne	ADRB2	21	43
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819491141	EF	On-Demand	Anodyne	ADRB1	18	43
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2cccc(F)c2)cc1	ZINC000819491141	EF	On-Demand	Anodyne	ADRB3	44	39
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819491162	FG	On-Demand	Anodyne	ADRB2	33	58
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819491162	FG	On-Demand	Anodyne	ADRB1	43	58
CCS(=O)(=O)Cc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1	ZINC000819491162	FG	On-Demand	Anodyne	ADRB3	73	53
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819491163	FG	On-Demand	Anodyne	ADRB2	33	58
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819491163	FG	On-Demand	Anodyne	ADRB1	43	58
CCS(=O)(=O)Cc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1	ZINC000819491163	FG	On-Demand	Anodyne	ADRB3	73	53
CC(C)(C)OC(=O)N1CCC[C@@](O)(CNc2ccc3cnccc3c2)CC1	ZINC000819491194	FH	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CCC[C@](O)(CNc2ccc3cnccc3c2)CC1	ZINC000819491195	FH	On-Demand	Anodyne	GPR119	31	40
CN(C)CCOc1ccc(NCCC(=O)NC(N)=O)cc1F	ZINC000819491223	DC	On-Demand	Anodyne	MET	18	43
C#CCNC(=O)CCNc1ccc(OCCN(C)C)cc1OC	ZINC000819491234	DD	On-Demand	Mild	MTNR1A	16	41
CN(C)CCOc1ccc(NCCC(=O)Nc2cccnc2)cc1F	ZINC000819491241	EF	On-Demand	Anodyne	MET	29	45
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819491245	EH	On-Demand	Anodyne	ADRB2	28	52
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819491245	EH	On-Demand	Anodyne	ADRB1	48	52
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819491245	EH	On-Demand	Anodyne	ADRB3	77	45
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2cccc(Cl)c2)c1	ZINC000819491245	EH	On-Demand	Anodyne	CYP3A4	43	34
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819491247	EH	On-Demand	Anodyne	ADRB2	28	52
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819491247	EH	On-Demand	Anodyne	ADRB1	48	52
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819491247	EH	On-Demand	Anodyne	ADRB3	77	45
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2cccc(Cl)c2)c1	ZINC000819491247	EH	On-Demand	Anodyne	CYP3A4	43	34
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1cccnc1	ZINC000819491257	EE	On-Demand	Anodyne	ADRB1	21	44
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1cccnc1	ZINC000819491257	EE	On-Demand	Anodyne	ADRB3	47	46
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1cccnc1	ZINC000819491258	EE	On-Demand	Anodyne	ADRB1	21	44
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1cccnc1	ZINC000819491258	EE	On-Demand	Anodyne	ADRB3	47	46
CO[C@H]1Cc2ccc(NC(=O)Cc3ccc(-n4cnnc4)cc3)cc2C1	ZINC000819491261	EF	On-Demand	Anodyne	HTR1D	23	41
CO[C@H]1Cc2ccc(NC(=O)Cc3ccc(-n4cnnc4)cc3)cc2C1	ZINC000819491261	EF	On-Demand	Anodyne	HTR1B	23	41
CO[C@H]1Cc2ccc(NC(=O)Cc3ccc(-n4cnnc4)cc3)cc2C1	ZINC000819491261	EF	On-Demand	Anodyne	PTPRF	41	31
CO[C@@H]1Cc2ccc(NC(=O)Cc3ccc(-n4cnnc4)cc3)cc2C1	ZINC000819491262	EF	On-Demand	Anodyne	HTR1D	23	41
CO[C@@H]1Cc2ccc(NC(=O)Cc3ccc(-n4cnnc4)cc3)cc2C1	ZINC000819491262	EF	On-Demand	Anodyne	HTR1B	23	41
CO[C@@H]1Cc2ccc(NC(=O)Cc3ccc(-n4cnnc4)cc3)cc2C1	ZINC000819491262	EF	On-Demand	Anodyne	PTPRF	41	31
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819491265	CG	On-Demand	Anodyne	ADRB2	32	42
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819491265	CG	On-Demand	Anodyne	ADRB1	37	40
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819491265	CG	On-Demand	Anodyne	ADRB3	66	39
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2ccccc2)c1	ZINC000819491265	CG	On-Demand	Anodyne	AOC3	17	43
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819491266	CG	On-Demand	Anodyne	ADRB2	32	42
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819491266	CG	On-Demand	Anodyne	ADRB1	37	40
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819491266	CG	On-Demand	Anodyne	ADRB3	66	39
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2ccccc2)c1	ZINC000819491266	CG	On-Demand	Anodyne	AOC3	17	43
C=C(C)C(C)(C)C(=O)Nc1ccc2c(c1)C[C@@H](OC)C2	ZINC000819491275	CG	On-Demand	Mild	MTTP	41	36
C=C(C)C(C)(C)C(=O)Nc1ccc2c(c1)C[C@H](OC)C2	ZINC000819491276	CG	On-Demand	Mild	MTTP	41	36
Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN(C)C)c(C)c2)cc1	ZINC000819491277	FG	On-Demand	Anodyne	ADRB2	25	46
Cc1ccc(OC[C@H](O)CNc2ccc(OCCN(C)C)c(C)c2)cc1	ZINC000819491278	FG	On-Demand	Anodyne	ADRB2	25	46
CO[C@H]1Cc2ccc(NC(=O)c3cc4c(cn3)OCCO4)cc2C1	ZINC000819491279	EE	On-Demand	Anodyne	MTTP	40	35
CO[C@H]1Cc2ccc(NC(=O)c3cc4c(cn3)OCCO4)cc2C1	ZINC000819491279	EE	On-Demand	Anodyne	PTPRF	40	30
CO[C@@H]1Cc2ccc(NC(=O)c3cc4c(cn3)OCCO4)cc2C1	ZINC000819491280	EE	On-Demand	Anodyne	MTTP	40	35
CO[C@@H]1Cc2ccc(NC(=O)c3cc4c(cn3)OCCO4)cc2C1	ZINC000819491280	EE	On-Demand	Anodyne	PTPRF	40	30
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1cccc(F)c1	ZINC000819491287	EF	On-Demand	Anodyne	ADRB3	18	43
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1cccc(F)c1	ZINC000819491288	EF	On-Demand	Anodyne	ADRB3	18	43
CO[C@H]1Cc2ccc(NC(=O)Cc3cccc(NC(C)=O)c3)cc2C1	ZINC000819491311	EF	On-Demand	Anodyne	TSHR	52	30
CO[C@H]1Cc2ccc(NC(=O)Cc3cccc(NC(C)=O)c3)cc2C1	ZINC000819491311	EF	On-Demand	Anodyne	MTTP	45	36
CO[C@H]1Cc2ccc(NC(=O)Cc3cccc(NC(C)=O)c3)cc2C1	ZINC000819491311	EF	On-Demand	Anodyne	PTPRF	45	35
CO[C@@H]1Cc2ccc(NC(=O)Cc3cccc(NC(C)=O)c3)cc2C1	ZINC000819491312	EF	On-Demand	Anodyne	TSHR	52	30
CO[C@@H]1Cc2ccc(NC(=O)Cc3cccc(NC(C)=O)c3)cc2C1	ZINC000819491312	EF	On-Demand	Anodyne	MTTP	45	36
CO[C@@H]1Cc2ccc(NC(=O)Cc3cccc(NC(C)=O)c3)cc2C1	ZINC000819491312	EF	On-Demand	Anodyne	PTPRF	45	35
CN(C)CCOc1ccc(NCCC(=O)Nc2ccccc2F)cc1F	ZINC000819491317	FG	On-Demand	Anodyne	MET	15	42
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2)cc1F	ZINC000819491325	EF	On-Demand	Anodyne	ADRB2	34	43
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2)cc1F	ZINC000819491325	EF	On-Demand	Anodyne	ADRB1	47	39
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2)cc1F	ZINC000819491325	EF	On-Demand	Anodyne	ESRRG	43	32
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2)cc1F	ZINC000819491325	EF	On-Demand	Anodyne	CDK4	18	43
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1F	ZINC000819491326	EF	On-Demand	Anodyne	ADRB2	34	43
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1F	ZINC000819491326	EF	On-Demand	Anodyne	ADRB1	47	39
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1F	ZINC000819491326	EF	On-Demand	Anodyne	ESRRG	43	32
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2)cc1F	ZINC000819491326	EF	On-Demand	Anodyne	CDK4	18	43
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819491334	GF	On-Demand	Bother	CACNA1C	44	36
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819491334	GF	On-Demand	Bother	ADRB3	19	42
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819491334	GF	On-Demand	Bother	CACNA1D	66	35
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819491335	GF	On-Demand	Bother	CACNA1C	44	36
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819491335	GF	On-Demand	Bother	ADRB3	19	42
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819491335	GF	On-Demand	Bother	CACNA1D	66	35
CN(C)CCOc1ccc(NC[C@H](O)c2ccc(Cl)cc2)cc1F	ZINC000819491349	FH	On-Demand	Anodyne	UTS2	42	35
CN(C)CCOc1ccc(NC[C@H](O)c2cccnc2)cc1F	ZINC000819491356	DE	On-Demand	Anodyne	ADRB3	68	45
CN(C)CCOc1ccc(NC[C@@H](O)c2cccnc2)cc1F	ZINC000819491357	DE	On-Demand	Anodyne	ADRB3	68	45
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1cc2ccccc2o1	ZINC000819491376	FH	On-Demand	Anodyne	ESRRG	43	31
COc1cc(OCCN(C)C)ccc1NCC1(O)CCCCC1	ZINC000819491390	DF	On-Demand	Anodyne	ESRRG	42	31
CN(C)CCOc1ccc(NC[C@H](O)COc2cccc3[nH]ccc23)cc1F	ZINC000819491394	GG	On-Demand	Anodyne	ADRB1	22	53
CN(C)CCOc1ccc(NC[C@@H](O)COc2cccc3[nH]ccc23)cc1F	ZINC000819491395	GG	On-Demand	Anodyne	ADRB1	22	53
COc1cc(OCCN(C)C)ccc1NCCC(=O)N(C)OC	ZINC000819491400	ED	On-Demand	Anodyne	ESRRG	42	32
CO[C@@H]1Cc2ccc(NC(=O)CCc3cccc(OC(F)F)c3)cc2C1	ZINC000819491403	FH	On-Demand	Anodyne	MTNR1B	17	41
CO[C@@H]1Cc2ccc(NC(=O)CCc3cccc(OC(F)F)c3)cc2C1	ZINC000819491403	FH	On-Demand	Anodyne	MTTP	44	34
CO[C@@H]1Cc2ccc(NC(=O)CCc3cccc(OC(F)F)c3)cc2C1	ZINC000819491403	FH	On-Demand	Anodyne	PTPRF	46	36
CO[C@H]1Cc2ccc(NC(=O)CCc3cccc(OC(F)F)c3)cc2C1	ZINC000819491404	FH	On-Demand	Anodyne	MTNR1B	17	41
CO[C@H]1Cc2ccc(NC(=O)CCc3cccc(OC(F)F)c3)cc2C1	ZINC000819491404	FH	On-Demand	Anodyne	MTTP	44	34
CO[C@H]1Cc2ccc(NC(=O)CCc3cccc(OC(F)F)c3)cc2C1	ZINC000819491404	FH	On-Demand	Anodyne	PTPRF	46	36
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2cccc(F)c2)c1	ZINC000819491419	DG	On-Demand	Anodyne	ADRB3	40	41
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2cccc(F)c2)c1	ZINC000819491421	DG	On-Demand	Anodyne	ADRB3	40	41
CO[C@@H]1Cc2ccc(NC(=O)C[C@H](C)n3cccn3)cc2C1	ZINC000819491438	CF	On-Demand	Anodyne	PTPRF	41	31
CO[C@@H]1Cc2ccc(NC(=O)C[C@H](C)n3cccn3)cc2C1	ZINC000819491438	CF	On-Demand	Anodyne	ENPP1	57	36
CO[C@H]1Cc2ccc(NC(=O)C[C@H](C)n3cccn3)cc2C1	ZINC000819491439	CF	On-Demand	Anodyne	PTPRF	41	31
CO[C@H]1Cc2ccc(NC(=O)C[C@H](C)n3cccn3)cc2C1	ZINC000819491439	CF	On-Demand	Anodyne	ENPP1	57	36
CO[C@@H]1Cc2ccc(NC(=O)C[C@@H](C)n3cccn3)cc2C1	ZINC000819491440	CF	On-Demand	Anodyne	PTPRF	41	31
CO[C@@H]1Cc2ccc(NC(=O)C[C@@H](C)n3cccn3)cc2C1	ZINC000819491440	CF	On-Demand	Anodyne	ENPP1	57	36
CO[C@H]1Cc2ccc(NC(=O)C[C@@H](C)n3cccn3)cc2C1	ZINC000819491441	CF	On-Demand	Anodyne	PTPRF	41	31
CO[C@H]1Cc2ccc(NC(=O)C[C@@H](C)n3cccn3)cc2C1	ZINC000819491441	CF	On-Demand	Anodyne	ENPP1	57	36
CO[C@@H]1Cc2ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc2C1	ZINC000819491442	GG	On-Demand	Mild	PAPA1_CARPA	41	44
CO[C@@H]1Cc2ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc2C1	ZINC000819491442	GG	On-Demand	Mild	HDAC11	42	35
CO[C@@H]1Cc2ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc2C1	ZINC000819491443	GG	On-Demand	Mild	PAPA1_CARPA	41	44
CO[C@@H]1Cc2ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc2C1	ZINC000819491443	GG	On-Demand	Mild	HDAC11	42	35
CO[C@H]1Cc2ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc2C1	ZINC000819491444	GG	On-Demand	Mild	PAPA1_CARPA	41	44
CO[C@H]1Cc2ccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)cc2C1	ZINC000819491444	GG	On-Demand	Mild	HDAC11	42	35
CO[C@H]1Cc2ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc2C1	ZINC000819491445	GG	On-Demand	Mild	PAPA1_CARPA	41	44
CO[C@H]1Cc2ccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)cc2C1	ZINC000819491445	GG	On-Demand	Mild	HDAC11	42	35
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819491451	EH	On-Demand	Anodyne	ADRB2	19	42
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819491451	EH	On-Demand	Anodyne	ADRB1	36	42
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2ccc(Cl)cc2)c1	ZINC000819491451	EH	On-Demand	Anodyne	ADRB3	62	36
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819491452	FH	On-Demand	Anodyne	ADRB3	42	36
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2ccc(Cl)c(F)c2)c1	ZINC000819491454	FH	On-Demand	Anodyne	ADRB3	42	36
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819491478	EG	On-Demand	Bother	CACNA1C	59	38
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819491478	EG	On-Demand	Bother	CACNA1D	91	38
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819491480	EG	On-Demand	Bother	CACNA1C	59	38
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000819491480	EG	On-Demand	Bother	CACNA1D	91	38
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)Cc1ccccc1	ZINC000819491485	EF	On-Demand	Anodyne	LTA4H	20	45
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)Cc1ccccc1	ZINC000819491485	EF	On-Demand	Anodyne	ESRRG	47	35
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)Cc1ccccc1	ZINC000819491485	EF	On-Demand	Anodyne	HCRTR2	17	47
COc1cc(OCCN(C)C)ccc1NC[C@H](O)Cc1ccccc1	ZINC000819491486	EF	On-Demand	Anodyne	LTA4H	20	45
COc1cc(OCCN(C)C)ccc1NC[C@H](O)Cc1ccccc1	ZINC000819491486	EF	On-Demand	Anodyne	ESRRG	47	35
COc1cc(OCCN(C)C)ccc1NC[C@H](O)Cc1ccccc1	ZINC000819491486	EF	On-Demand	Anodyne	HCRTR2	17	47
COc1cc(OCCN(C)C)ccc1NC[C@H](O)[C@@H](C)c1ccccc1	ZINC000819491495	FG	On-Demand	Anodyne	ESRRG	46	34
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)[C@@H](C)c1ccccc1	ZINC000819491496	FG	On-Demand	Anodyne	ESRRG	46	34
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000819491497	FG	On-Demand	Anodyne	ESRRG	46	34
COc1cc(OCCN(C)C)ccc1NC[C@H](O)[C@H](C)c1ccccc1	ZINC000819491498	FG	On-Demand	Anodyne	ESRRG	46	34
CO[C@H]1Cc2ccc(NC(=O)[C@H]3C4CCC(CC4)[C@@H]3C(F)(F)F)cc2C1	ZINC000819491499	FI	On-Demand	Anodyne	MTTP	46	38
CO[C@@H]1Cc2ccc(NC(=O)[C@H]3C4CCC(CC4)[C@@H]3C(F)(F)F)cc2C1	ZINC000819491500	FI	On-Demand	Anodyne	MTTP	46	38
COc1cc(OCCN(C)C)ccc1NCCC(N)=O	ZINC000819491504	CC	On-Demand	Anodyne	MTNR1B	15	43
COc1cc(OCCN(C)C)ccc1NCCC(N)=O	ZINC000819491504	CC	On-Demand	Anodyne	ESRRG	44	33
COc1cc(OCCN(C)C)ccc1NCCC(=O)Nc1cccnc1	ZINC000819491524	FE	On-Demand	Anodyne	HCRTR2	17	47
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc(F)cc2)cc1F	ZINC000819491532	FF	On-Demand	Anodyne	GRIN1	22	41
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc(F)cc2)cc1F	ZINC000819491533	FF	On-Demand	Anodyne	GRIN1	22	41
CO[C@@H]1Cc2ccc(NC(=O)c3cc(Br)c(C)s3)cc2C1	ZINC000819491563	FI	On-Demand	Anodyne	MTTP	51	37
CO[C@H]1Cc2ccc(NC(=O)c3cc(Br)c(C)s3)cc2C1	ZINC000819491564	FI	On-Demand	Anodyne	MTTP	51	37
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2ccc(Br)cc2)c1	ZINC000819491574	GH	On-Demand	Anodyne	ADRB2	17	45
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2ccc(Br)cc2)c1	ZINC000819491576	GH	On-Demand	Anodyne	ADRB2	17	45
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819491577	GH	On-Demand	Anodyne	ESRRG	43	31
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1ccccc1C(F)(F)F	ZINC000819491577	GH	On-Demand	Anodyne	NEK2	25	40
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819491578	GH	On-Demand	Anodyne	ESRRG	43	31
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1ccccc1C(F)(F)F	ZINC000819491578	GH	On-Demand	Anodyne	NEK2	25	40
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1ccccc1Cl	ZINC000819491597	FG	On-Demand	Anodyne	ESRRG	45	34
COCc1cc(O)ccc1NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819491603	FE	On-Demand	Anodyne	ADRB3	23	44
COCc1cc(O)ccc1NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819491640	FE	On-Demand	Anodyne	ADRB3	23	44
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819491646	EG	On-Demand	Bother	CACNA1C	40	35
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819491646	EG	On-Demand	Bother	CACNA1D	62	35
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819491648	EG	On-Demand	Bother	CACNA1C	40	35
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000819491648	EG	On-Demand	Bother	CACNA1D	62	35
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819491650	GH	On-Demand	Anodyne	ADRB3	18	45
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000819491650	GH	On-Demand	Anodyne	GALR3	42	37
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819491651	GH	On-Demand	Anodyne	ADRB3	18	45
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000819491651	GH	On-Demand	Anodyne	GALR3	42	37
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1cccc2ccccc12	ZINC000819491654	GH	On-Demand	Anodyne	MTNR1A	20	44
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1cccc2ccccc12	ZINC000819491654	GH	On-Demand	Anodyne	ESRRG	47	34
CN(C)CCOc1ccc(NCCC(=O)Nc2cc(F)cc(F)c2)cc1F	ZINC000819491668	GG	On-Demand	Anodyne	MET	15	47
CN(C)CCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1F	ZINC000819491673	FH	On-Demand	Anodyne	ADRB1	25	45
CN(C)CCOc1ccc(NC[C@H](O)c2cccc(Cl)c2)cc1F	ZINC000819491673	FH	On-Demand	Anodyne	ADRB3	37	45
CN(C)CCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1F	ZINC000819491674	FH	On-Demand	Anodyne	ADRB1	25	45
CN(C)CCOc1ccc(NC[C@@H](O)c2cccc(Cl)c2)cc1F	ZINC000819491674	FH	On-Demand	Anodyne	ADRB3	37	45
COc1cccc([S@@](=O)CC(=O)Nc2ccc3c(c2)C[C@@H](OC)C3)c1	ZINC000819491676	FF	On-Demand	Anodyne	MTNR1A	25	41
COc1cccc([S@@](=O)CC(=O)Nc2ccc3c(c2)C[C@@H](OC)C3)c1	ZINC000819491676	FF	On-Demand	Anodyne	MTNR1B	29	41
COc1cccc([S@@](=O)CC(=O)Nc2ccc3c(c2)C[C@@H](OC)C3)c1	ZINC000819491676	FF	On-Demand	Anodyne	PTPRF	42	34
COc1cccc([S@@](=O)CC(=O)Nc2ccc3c(c2)C[C@@H](OC)C3)c1	ZINC000819491676	FF	On-Demand	Anodyne	ACR	27	41
COc1cccc([S@@](=O)CC(=O)Nc2ccc3c(c2)C[C@H](OC)C3)c1	ZINC000819491677	FF	On-Demand	Anodyne	MTNR1A	25	41
COc1cccc([S@@](=O)CC(=O)Nc2ccc3c(c2)C[C@H](OC)C3)c1	ZINC000819491677	FF	On-Demand	Anodyne	MTNR1B	29	41
COc1cccc([S@@](=O)CC(=O)Nc2ccc3c(c2)C[C@H](OC)C3)c1	ZINC000819491677	FF	On-Demand	Anodyne	PTPRF	42	34
COc1cccc([S@@](=O)CC(=O)Nc2ccc3c(c2)C[C@H](OC)C3)c1	ZINC000819491677	FF	On-Demand	Anodyne	ACR	27	41
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819491681	DF	On-Demand	Mild	CTRB_BOVIN	44	30
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819491682	DF	On-Demand	Mild	CTRB_BOVIN	44	30
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2F)cc1F	ZINC000819491703	FF	On-Demand	Anodyne	ADRB2	20	40
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2F)cc1F	ZINC000819491703	FF	On-Demand	Anodyne	ADRB1	52	35
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2F)cc1F	ZINC000819491704	FF	On-Demand	Anodyne	ADRB2	20	40
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2F)cc1F	ZINC000819491704	FF	On-Demand	Anodyne	ADRB1	52	35
Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN(C)C)c(F)c2)cc1	ZINC000819491747	FF	On-Demand	Anodyne	ADRB2	19	44
Cc1ccc(OC[C@@H](O)CNc2ccc(OCCN(C)C)c(F)c2)cc1	ZINC000819491747	FF	On-Demand	Anodyne	CDK4	19	41
Cc1ccc(OC[C@H](O)CNc2ccc(OCCN(C)C)c(F)c2)cc1	ZINC000819491748	FF	On-Demand	Anodyne	ADRB2	19	44
Cc1ccc(OC[C@H](O)CNc2ccc(OCCN(C)C)c(F)c2)cc1	ZINC000819491748	FF	On-Demand	Anodyne	CDK4	19	41
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819491757	DG	On-Demand	Anodyne	ADRB2	21	43
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2ccc(C)cc2)c1	ZINC000819491757	DG	On-Demand	Anodyne	ADRB3	43	35
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819491759	DG	On-Demand	Anodyne	ADRB2	21	43
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2ccc(C)cc2)c1	ZINC000819491759	DG	On-Demand	Anodyne	ADRB3	43	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1cc(N(C)C)ccn1)C2	ZINC000819491797	ED	On-Demand	Anodyne	TYK2	49	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1cc(N(C)C)ccn1)C2	ZINC000819491798	ED	On-Demand	Anodyne	TYK2	49	34
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1ccccc1C	ZINC000819491799	EG	On-Demand	Anodyne	ESRRG	45	33
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1ccccc1C	ZINC000819491800	EG	On-Demand	Anodyne	ESRRG	45	33
COc1cc(OCCN(C)C)ccc1NC[C@@H](C)O	ZINC000819491801	CD	On-Demand	Anodyne	ESRRG	43	32
COc1cc(OCCN(C)C)ccc1NC[C@H](C)O	ZINC000819491802	CD	On-Demand	Anodyne	ESRRG	43	32
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819491812	FI	On-Demand	Anodyne	ADRB1	24	42
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2ccc(Cl)cc2Cl)c1	ZINC000819491814	FI	On-Demand	Anodyne	ADRB1	24	42
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1ccccc1F	ZINC000819491816	EF	On-Demand	Anodyne	ESRRG	45	32
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1ccccc1F	ZINC000819491817	EF	On-Demand	Anodyne	ESRRG	45	32
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819491818	FG	On-Demand	Anodyne	ADRB1	30	44
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819491818	FG	On-Demand	Anodyne	ADRB3	53	44
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819491818	FG	On-Demand	Anodyne	CYP3A4	44	36
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819491819	FG	On-Demand	Anodyne	ADRB1	30	44
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819491819	FG	On-Demand	Anodyne	ADRB3	53	44
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819491819	FG	On-Demand	Anodyne	CYP3A4	44	36
COc1cc(OCCN(C)C)ccc1NCCC(=O)Nc1cc(C)on1	ZINC000819491824	FE	On-Demand	Anodyne	FLT1	17	40
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1F	ZINC000819491831	GG	On-Demand	Anodyne	GRIN1	28	41
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc(Cl)cc2)cc1F	ZINC000819491831	GG	On-Demand	Anodyne	CDK4	20	42
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1F	ZINC000819491832	GG	On-Demand	Anodyne	GRIN1	28	41
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc(Cl)cc2)cc1F	ZINC000819491832	GG	On-Demand	Anodyne	CDK4	20	42
C[C@H]1CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC(C)(C)C1	ZINC000819491837	FG	On-Demand	Mild	PAPA1_CARPA	31	40
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819491841	DF	On-Demand	Anodyne	ADRB2	28	41
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819491841	DF	On-Demand	Anodyne	ADRB1	31	44
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819491841	DF	On-Demand	Anodyne	ADRB3	98	44
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2cccnc2)c1	ZINC000819491841	DF	On-Demand	Anodyne	KCNA5	22	42
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819491842	DF	On-Demand	Anodyne	ADRB2	28	41
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819491842	DF	On-Demand	Anodyne	ADRB1	31	44
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819491842	DF	On-Demand	Anodyne	ADRB3	98	44
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2cccnc2)c1	ZINC000819491842	DF	On-Demand	Anodyne	KCNA5	22	42
CN(C)CCOc1ccc(NC[C@H](O)COc2ccc(C#N)cc2)cc1F	ZINC000819491870	FE	On-Demand	Mild	ADRB1	45	34
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccc(C#N)cc2)cc1F	ZINC000819491871	FE	On-Demand	Mild	ADRB1	45	34
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2ccc(F)cc2)c1	ZINC000819491878	DG	On-Demand	Anodyne	ADRB3	43	37
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2ccc(F)cc2)c1	ZINC000819491880	DG	On-Demand	Anodyne	ADRB3	43	37
CN(C)CCOc1ccc(NC[C@H](O)c2ccccc2)cc1F	ZINC000819491882	DF	On-Demand	Anodyne	ESRRG	42	31
CN(C)CCOc1ccc(NC[C@@H](O)c2ccccc2)cc1F	ZINC000819491883	DF	On-Demand	Anodyne	ESRRG	42	31
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819491887	GG	On-Demand	Anodyne	MAOB	19	42
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)Cc1cccc(Cl)c1	ZINC000819491887	GG	On-Demand	Anodyne	ADRB3	21	42
COc1cc(OCCN(C)C)ccc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819491888	GG	On-Demand	Anodyne	MAOB	19	42
COc1cc(OCCN(C)C)ccc1NC[C@H](O)Cc1cccc(Cl)c1	ZINC000819491888	GG	On-Demand	Anodyne	ADRB3	21	42
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819491900	FG	On-Demand	Anodyne	ADRB2	15	45
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2cc(OC)ccc2OC)c1	ZINC000819491900	FG	On-Demand	Anodyne	MTNR1A	30	43
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819491901	FG	On-Demand	Anodyne	ADRB2	15	45
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2cc(OC)ccc2OC)c1	ZINC000819491901	FG	On-Demand	Anodyne	MTNR1A	30	43
CN(C)CCOc1ccc(NCCC(=O)Nc2cccc(F)c2)cc1F	ZINC000819491903	FG	On-Demand	Anodyne	MET	31	47
CO[C@H]1Cc2ccc(NC(=O)c3cn(-c4ccccc4)nc3C(C)C)cc2C1	ZINC000819491914	GI	On-Demand	Anodyne	MTTP	57	38
CO[C@@H]1Cc2ccc(NC(=O)c3cn(-c4ccccc4)nc3C(C)C)cc2C1	ZINC000819491915	GI	On-Demand	Anodyne	MTTP	57	38
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819491919	GF	On-Demand	Anodyne	ADRB3	47	39
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000819491920	GF	On-Demand	Anodyne	ADRB3	47	39
COc1cc(OCCN(C)C)ccc1NCCC(=O)Nc1ccc(Cl)cc1	ZINC000819491921	GH	On-Demand	Anodyne	MCHR2	19	41
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1F	ZINC000819491942	GG	On-Demand	Anodyne	ADRB2	17	41
CN(C)CCOc1ccc(NC[C@H](O)COc2ccccc2Cl)cc1F	ZINC000819491942	GG	On-Demand	Anodyne	GRIN1	15	42
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1F	ZINC000819491943	GG	On-Demand	Anodyne	ADRB2	17	41
CN(C)CCOc1ccc(NC[C@@H](O)COc2ccccc2Cl)cc1F	ZINC000819491943	GG	On-Demand	Anodyne	GRIN1	15	42
COCc1cc(O)ccc1NC[C@H](O)c1ccc(C)cc1	ZINC000819491944	CF	On-Demand	Anodyne	ADRB2	16	43
COCc1cc(O)ccc1NC[C@@H](O)c1ccc(C)cc1	ZINC000819491945	CF	On-Demand	Anodyne	ADRB2	16	43
CN(C)CCOc1ccc(NCCC(=O)Nc2ccccc2)cc1F	ZINC000819491959	EG	On-Demand	Anodyne	LTA4H	35	42
CN(C)CCOc1ccc(NCCC(=O)Nc2ccccc2)cc1F	ZINC000819491959	EG	On-Demand	Anodyne	KDR	15	52
CN(C)CCOc1ccc(NCCC(=O)Nc2ccccc2)cc1F	ZINC000819491959	EG	On-Demand	Anodyne	MET	33	47
CO[C@@H]1Cc2ccc(NC(=O)[C@H]3C[C@H]3c3ccc(C)cc3)cc2C1	ZINC000819491972	DH	On-Demand	Anodyne	MTTP	47	38
CO[C@@H]1Cc2ccc(NC(=O)[C@H]3C[C@@H]3c3ccc(C)cc3)cc2C1	ZINC000819491973	DH	On-Demand	Anodyne	MTTP	47	38
CO[C@@H]1Cc2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc(C)cc3)cc2C1	ZINC000819491974	DH	On-Demand	Anodyne	MTTP	47	38
CO[C@@H]1Cc2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccc(C)cc3)cc2C1	ZINC000819491975	DH	On-Demand	Anodyne	MTTP	47	38
COCc1cc(O)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819491976	DF	On-Demand	Bother	CACNA1C	46	37
COCc1cc(O)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819491976	DF	On-Demand	Bother	CACNA1D	74	37
COCc1cc(O)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819491977	DF	On-Demand	Bother	CACNA1C	46	37
COCc1cc(O)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819491977	DF	On-Demand	Bother	CACNA1D	74	37
COc1cc(OCCN(C)C)ccc1NCCC(=O)Nc1ccccc1	ZINC000819491990	FG	On-Demand	Anodyne	LTA4H	48	43
COc1cc(OCCN(C)C)ccc1NCCC(=O)Nc1ccccc1	ZINC000819491990	FG	On-Demand	Anodyne	MTNR1A	20	40
COc1cc(OCCN(C)C)ccc1NCCC(=O)Nc1ccccc1	ZINC000819491990	FG	On-Demand	Anodyne	MTNR1B	25	45
COc1cc(OCCN(C)C)ccc1NCCC(=O)Nc1ccccc1	ZINC000819491990	FG	On-Demand	Anodyne	ESRRG	48	36
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819491993	GI	On-Demand	Anodyne	ADRB3	38	41
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2ccc(OC(F)(F)F)cc2)c1	ZINC000819491995	GI	On-Demand	Anodyne	ADRB3	38	41
CC(=O)Nc1cccc(CC(=O)N2CCC[C@@H](N(C)c3ccc(C)cc3)C2)c1	ZINC000819492009	GH	On-Demand	Anodyne	MCHR1	15	40
CC(=O)Nc1cccc(CC(=O)N2CCC[C@H](N(C)c3ccc(C)cc3)C2)c1	ZINC000819492010	GH	On-Demand	Anodyne	MCHR1	15	40
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2ccc(F)c(F)c2)c1	ZINC000819492016	EG	On-Demand	Anodyne	ADRB3	45	35
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2ccc(F)c(F)c2)c1	ZINC000819492018	EG	On-Demand	Anodyne	ADRB3	45	35
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1ccc(Cl)cc1	ZINC000819492114	FG	On-Demand	Anodyne	ADRB3	20	40
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1ccc(Cl)cc1	ZINC000819492114	FG	On-Demand	Anodyne	UTS2	52	39
COCc1cc(O)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819492117	DG	On-Demand	Anodyne	ADRB2	27	42
COCc1cc(O)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819492117	DG	On-Demand	Anodyne	ADRB1	31	42
COCc1cc(O)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819492117	DG	On-Demand	Anodyne	ADRB3	47	42
COCc1cc(O)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819492117	DG	On-Demand	Anodyne	CYP3A4	47	36
COCc1cc(O)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819492118	DG	On-Demand	Anodyne	ADRB2	27	42
COCc1cc(O)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819492118	DG	On-Demand	Anodyne	ADRB1	31	42
COCc1cc(O)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819492118	DG	On-Demand	Anodyne	ADRB3	47	42
COCc1cc(O)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819492118	DG	On-Demand	Anodyne	CYP3A4	47	36
COc1cc(OCCN(C)C)ccc1NCC(C)(C)O	ZINC000819492122	CD	On-Demand	Anodyne	ESRRG	43	32
CO[C@@H]1Cc2ccc(NC(=O)c3cc(Br)oc3C)cc2C1	ZINC000819492147	FH	On-Demand	Anodyne	MTTP	57	41
CO[C@H]1Cc2ccc(NC(=O)c3cc(Br)oc3C)cc2C1	ZINC000819492148	FH	On-Demand	Anodyne	MTTP	57	41
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1c(F)cccc1F	ZINC000819492153	FG	On-Demand	Anodyne	ESRRG	43	31
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1c(F)cccc1F	ZINC000819492154	FG	On-Demand	Anodyne	ESRRG	43	31
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1ccccc1	ZINC000819492157	EF	On-Demand	Anodyne	ADRB1	16	40
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1ccccc1	ZINC000819492157	EF	On-Demand	Anodyne	ADRB3	33	42
COc1cc(OCCN(C)C)ccc1NC[C@@H](O)c1ccccc1	ZINC000819492157	EF	On-Demand	Anodyne	ESRRG	50	37
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1ccccc1	ZINC000819492158	EF	On-Demand	Anodyne	ADRB1	16	40
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1ccccc1	ZINC000819492158	EF	On-Demand	Anodyne	ADRB3	33	42
COc1cc(OCCN(C)C)ccc1NC[C@H](O)c1ccccc1	ZINC000819492158	EF	On-Demand	Anodyne	ESRRG	50	37
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819492167	FI	On-Demand	Anodyne	PDS	42	40
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2cccc(C(F)(F)F)c2)c1	ZINC000819492169	FI	On-Demand	Anodyne	PDS	42	40
COc1cc(OCCN(C)C)ccc1NCCS(=O)(=O)c1ccccc1	ZINC000819492173	GF	On-Demand	Anodyne	ESRRG	43	33
COc1cc(OCCN(C)C)ccc1NCCC(=O)Nc1ccccc1F	ZINC000819492174	GG	On-Demand	Anodyne	ESRRG	44	33
COC(=O)[C@@H](C)c1cccc(NC[C@H](O)c2cccc(Br)c2)c1	ZINC000819492209	GH	On-Demand	Anodyne	ADRB3	41	35
COC(=O)[C@@H](C)c1cccc(NC[C@@H](O)c2cccc(Br)c2)c1	ZINC000819492211	GH	On-Demand	Anodyne	ADRB3	41	35
CO[C@H]1Cc2ccc(NC(=O)c3coc4c(C)cccc34)cc2C1	ZINC000819492221	DI	On-Demand	Anodyne	MTTP	61	44
CO[C@H]1Cc2ccc(NC(=O)c3coc4c(C)cccc34)cc2C1	ZINC000819492221	DI	On-Demand	Anodyne	KCNK3	43	38
CO[C@@H]1Cc2ccc(NC(=O)c3coc4c(C)cccc34)cc2C1	ZINC000819492222	DI	On-Demand	Anodyne	MTTP	61	44
CO[C@@H]1Cc2ccc(NC(=O)c3coc4c(C)cccc34)cc2C1	ZINC000819492222	DI	On-Demand	Anodyne	KCNK3	43	38
CO[C@H]1Cc2ccc(NC(=O)Cc3nsc4ccccc34)cc2C1	ZINC000819492247	EH	On-Demand	Anodyne	PTPRF	41	32
CO[C@@H]1Cc2ccc(NC(=O)Cc3nsc4ccccc34)cc2C1	ZINC000819492248	EH	On-Demand	Anodyne	PTPRF	41	32
C=CCC1(C(=O)Nc2ccc3c(c2)C[C@@H](OC)C3)CCOCC1	ZINC000819492253	DG	On-Demand	Mild	PTPRF	42	31
C=CCC1(C(=O)Nc2ccc3c(c2)C[C@H](OC)C3)CCOCC1	ZINC000819492254	DG	On-Demand	Mild	PTPRF	42	31
CN(C)c1ccc(NCCS(C)(=O)=O)cc1C(F)(F)F	ZINC000819492270	DE	On-Demand	Anodyne	PTK2	50	31
COc1cc(NCCC(N)=O)ccc1OCCN(C)C	ZINC000819492273	CC	On-Demand	Anodyne	ENPP1	71	34
COc1cc(NCCC(N)=O)ccc1OCCN(C)C	ZINC000819492273	CC	On-Demand	Anodyne	DRTS_TRYCR	57	42
O=C(O)CCNC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000819492296	CC	On-Demand	Reactive	GSR	17	53
O=C(O)CCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819492299	DF	On-Demand	Anodyne	TSHR	40	31
O=C(O)CCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819492299	DF	On-Demand	Anodyne	HRH2	36	47
O=C(O)CCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819492299	DF	On-Demand	Anodyne	MAOB	27	41
O=C(O)CCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819492299	DF	On-Demand	Anodyne	PPIA	44	42
O=C(O)CCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819492299	DF	On-Demand	Anodyne	FOLH1	15	40
O=C(O)CCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819492299	DF	On-Demand	Anodyne	LTA4H	29	47
O=C(O)CCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819492299	DF	On-Demand	Anodyne	PTGER4	18	44
O=C(O)CCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819492299	DF	On-Demand	Anodyne	CA1	26	44
O=C(O)CCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819492299	DF	On-Demand	Anodyne	PTGER3	65	41
O=C(O)CCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819492299	DF	On-Demand	Anodyne	DRTS_LEIMA	17	40
O=C(O)CCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819492299	DF	On-Demand	Anodyne	CCR3	27	44
O=C(O)CCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819492299	DF	On-Demand	Anodyne	GYS1	44	35
O=C(O)CCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819492299	DF	On-Demand	Anodyne	FFAR1	78	53
O=C(O)CCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819492299	DF	On-Demand	Anodyne	FFAR4	52	51
O=C(O)CCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819492299	DF	On-Demand	Anodyne	KCNK3	49	35
O=C(O)CCNC(=O)Nc1cccc(COc2ccccc2)c1	ZINC000819492299	DF	On-Demand	Anodyne	PDS	54	33
O=C(O)CCNC(=O)NNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000819492316	DB	On-Demand	Reactive	KCNMA1	30	42
O=C(O)CCNC(=O)NNC(=O)c1ccccc1Br	ZINC000819492320	EC	On-Demand	Reactive	MME	17	41
COc1cc(NCCC(=O)Nc2ccccc2F)ccc1OCCN(C)C	ZINC000819492321	GG	On-Demand	Anodyne	ENPP1	60	31
O=C(O)CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819492323	FC	On-Demand	Reactive	HTR1A	79	53
O=C(O)CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819492323	FC	On-Demand	Reactive	DRD2	62	48
O=C(O)CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819492323	FC	On-Demand	Reactive	DRD4	53	44
O=C(O)CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819492323	FC	On-Demand	Reactive	ADRA1D	22	41
O=C(O)CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819492323	FC	On-Demand	Reactive	HTR2A	46	48
O=C(O)CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819492323	FC	On-Demand	Reactive	HTR2C	22	43
O=C(O)CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819492323	FC	On-Demand	Reactive	ADRA1A	23	47
O=C(O)CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819492323	FC	On-Demand	Reactive	ADRA1B	15	47
O=C(O)CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819492323	FC	On-Demand	Reactive	DRD3	81	50
O=C(O)CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819492323	FC	On-Demand	Reactive	DRD5	15	44
O=C(O)CCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000819492323	FC	On-Demand	Reactive	HTR7	92	48
O=C(O)CCNC(=O)NNC(=O)CCCc1ccccc1	ZINC000819492325	CC	On-Demand	Reactive	MME	30	48
O=C(O)CCNC(=O)NNC(=O)CCCc1ccccc1	ZINC000819492325	CC	On-Demand	Reactive	HDAC8	16	48
O=C(O)CCNC(=O)NNC(=O)CCCc1ccccc1	ZINC000819492325	CC	On-Demand	Reactive	HDAC1	15	55
O=C(O)CCNC(=O)NNC(=O)CCCc1ccccc1	ZINC000819492325	CC	On-Demand	Reactive	FAAH	44	37
O=C(O)CCNC(=O)NNC(=O)CCCc1ccccc1	ZINC000819492325	CC	On-Demand	Reactive	CES1	54	38
O=C(O)CCNC(=O)NNC(=O)CCCc1ccccc1	ZINC000819492325	CC	On-Demand	Reactive	FFAR1	43	44
O=C(O)CCNC(=O)NNc1cccc([N+](=O)[O-])c1	ZINC000819492327	CC	On-Demand	Reactive	CACNA1D	64	34
O=C(O)CCNC(=O)Nc1ccc(-c2cc[nH]n2)cc1	ZINC000819492328	CD	On-Demand	Anodyne	ROCK2	19	47
O=C(O)CCNC(=O)Nc1ccc(N2CCCC2)nc1	ZINC000819492336	CD	On-Demand	Anodyne	DGAT1	42	42
O=C(O)CCNC(=O)NNc1ccccc1	ZINC000819492339	BC	On-Demand	Reactive	MME	21	42
O=C(O)CCNC(=O)NNC(=O)c1ccccc1F	ZINC000819492345	CC	On-Demand	Reactive	MME	16	43
O=C(O)CCNC(=O)NNC(=O)Cc1ccncc1	ZINC000819492346	CB	On-Demand	Reactive	CA5A	15	41
O=C(O)CCNC(=O)Nc1ccc(OCc2ccccc2)nc1	ZINC000819492353	DE	On-Demand	Anodyne	ADRB1	47	43
O=C(O)CCNC(=O)Nc1ccc(OCc2ccccc2)nc1	ZINC000819492353	DE	On-Demand	Anodyne	PPIA	46	44
O=C(O)CCNC(=O)Nc1ccc(OCc2ccccc2)nc1	ZINC000819492353	DE	On-Demand	Anodyne	LTA4H	16	43
O=C(O)CCNC(=O)Nc1ccc(OCc2ccccc2)nc1	ZINC000819492353	DE	On-Demand	Anodyne	FFAR1	27	44
O=C(O)CCNC(=O)Nc1ccc(OCc2ccccc2)nc1	ZINC000819492353	DE	On-Demand	Anodyne	NAMPT	28	43
O=C(O)CCNC(=O)NNC(=O)COc1ccccc1F	ZINC000819492354	CC	On-Demand	Reactive	CXCL8	18	42
CN(C)c1ccc(NCCS(=O)(=O)c2ccccc2)cc1C(F)(F)F	ZINC000819492355	FH	On-Demand	Anodyne	PTK2	41	33
CN(C)c1ccc(NCCS(=O)(=O)c2ccccc2)cc1C(F)(F)F	ZINC000819492355	FH	On-Demand	Anodyne	SFRP1	79	38
CN(C)c1ccc(NCCS(=O)(=O)c2ccccc2)cc1C(F)(F)F	ZINC000819492355	FH	On-Demand	Anodyne	WNT3	47	38
O=C(O)CCNC(=O)Nc1cccc(Cn2cncn2)c1	ZINC000819492356	CC	On-Demand	Anodyne	HRH2	33	41
O=C(O)CCNC(=O)NNc1ccccc1Cl	ZINC000819492360	CD	On-Demand	Reactive	CXCL8	49	46
O=C(O)CCNC(=O)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000819492361	DD	On-Demand	Anodyne	CCR3	53	42
O=C(O)CCNC(=O)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000819492361	DD	On-Demand	Anodyne	CCKBR	53	36
O=C(O)CCNC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	ZINC000819492364	ED	On-Demand	Reactive	GCGR	19	41
O=C(O)CCNC(=O)NNC(=O)Nc1ccc(OC(F)F)cc1	ZINC000819492364	ED	On-Demand	Reactive	LTA4H	18	42
O=C(O)CCNC(=O)NNc1ccccc1C(F)(F)F	ZINC000819492366	CD	On-Demand	Reactive	RBP4	37	40
O=C(O)CCNC(=O)NNC(=O)c1ccc2ccccc2c1	ZINC000819492368	DD	On-Demand	Reactive	GCGR	40	42
O=C(O)CCNC(=O)NNC(=O)c1ccc2ccccc2c1	ZINC000819492368	DD	On-Demand	Reactive	PLD1	16	40
O=C(O)CCNC(=O)NNC(=O)c1ccc2ccccc2c1	ZINC000819492368	DD	On-Demand	Reactive	CASP1	31	40
O=C(O)CCNC(=O)NNC(=O)c1ccc2ccccc2c1	ZINC000819492368	DD	On-Demand	Reactive	PLD2	26	40
O=C(O)CCNC(=O)NNC(=O)c1ccc2ccccc2c1	ZINC000819492368	DD	On-Demand	Reactive	GIPR	41	33
O=C(O)CCNC(=O)Nc1cc(N2CCCS2(=O)=O)ccc1F	ZINC000819492370	EC	On-Demand	Anodyne	CDK1	17	43
O=C(O)CCNC(=O)NNC(=O)c1cccc(OC(F)F)c1	ZINC000819492378	DC	On-Demand	Reactive	DRD4	41	31
O=C(O)CCNC(=O)Nc1ccc2oc3ccccc3c2c1	ZINC000819492389	CG	On-Demand	Anodyne	MMP12	26	45
O=C(O)CCNC(=O)Nc1ccc2oc3ccccc3c2c1	ZINC000819492389	CG	On-Demand	Anodyne	IMDH_CRYPV	20	46
O=C(O)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000819492398	GB	On-Demand	Reactive	PPARD	15	41
O=C(O)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000819492398	GB	On-Demand	Reactive	AKR1C3	67	44
O=C(O)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000819492398	GB	On-Demand	Reactive	NAMPT	24	41
O=C(O)CCNC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	ZINC000819492400	ED	On-Demand	Reactive	MME	17	42
O=C(O)CCNC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	ZINC000819492400	ED	On-Demand	Reactive	LTA4H	16	41
O=C(O)CCNC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	ZINC000819492400	ED	On-Demand	Reactive	PTGER3	58	37
O=C(O)CCNC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	ZINC000819492400	ED	On-Demand	Reactive	FFAR1	40	43
O=C(O)CCNC(=O)NNC(=O)c1ccc(COc2ccccc2)o1	ZINC000819492400	ED	On-Demand	Reactive	FFAR4	48	39
O=C(O)CCNC(=O)Nc1ccc(C(F)(F)C(F)(F)F)cc1	ZINC000819492404	EF	On-Demand	Anodyne	EPHX2	24	53
O=C(O)CCNC(=O)NNC(=O)CCc1ccccc1	ZINC000819492406	CC	On-Demand	Reactive	MME	35	50
O=C(O)CCNC(=O)NNC(=O)CCc1ccccc1	ZINC000819492406	CC	On-Demand	Reactive	FFAR1	63	45
O=C(O)CCNC(=O)NNC(=O)CCc1ccccc1	ZINC000819492406	CC	On-Demand	Reactive	FFAR4	44	39
O=C(O)CCNC(=O)NNC(=O)Cc1ccc2ccccc2c1	ZINC000819492408	DD	On-Demand	Reactive	PTGER3	42	33
O=C(O)CCNC(=O)NNC(=O)Cc1ccc2ccccc2c1	ZINC000819492408	DD	On-Demand	Reactive	FFAR4	41	33
O=C(O)CCNC(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000819492411	EE	On-Demand	Anodyne	NPY2R	46	38
O=C(O)CCNC(=O)NNc1ccc(OC(F)(F)F)cc1	ZINC000819492413	DD	On-Demand	Reactive	GCGR	39	46
O=C(O)CCNC(=O)NNc1ccc(OC(F)(F)F)cc1	ZINC000819492413	DD	On-Demand	Reactive	P2RY1	51	36
O=C(O)CCNC(=O)NNc1ccc(OC(F)(F)F)cc1	ZINC000819492413	DD	On-Demand	Reactive	EPHX2	42	40
O=C(O)CCNC(=O)NNc1ccc(OC(F)(F)F)cc1	ZINC000819492413	DD	On-Demand	Reactive	GIPR	35	45
O=C(O)CCNC(=O)NNC(=O)c1cc2ccccc2o1	ZINC000819492419	CC	On-Demand	Reactive	MME	15	40
O=C(O)CCNC(=O)NNC(=O)Cc1ccc(F)cc1	ZINC000819492427	CC	On-Demand	Reactive	MME	15	43
O=C(O)CCNC(=O)Nc1ccc(-n2nccc2C(F)(F)F)cc1	ZINC000819492429	EE	On-Demand	Anodyne	EPHX2	19	42
O=C(O)CCNC(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1	ZINC000819492432	EG	On-Demand	Anodyne	LTA4H	21	41
O=C(O)CCNC(=O)Nc1ccc(Oc2ccc(Cl)cn2)cc1	ZINC000819492432	EG	On-Demand	Anodyne	LIPE	18	46
O=C(O)CCNC(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	ZINC000819492437	DD	On-Demand	Reactive	EPHX2	32	48
O=C(O)CCNC(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2	ZINC000819492437	DD	On-Demand	Reactive	BOTA	26	50
CC(=O)Nc1cccc(CC(=O)NC/C=C/CNC(=O)OC(C)(C)C)c1	ZINC000819492442	FE	On-Demand	Anodyne	NQO2	21	40
O=C(O)CCNC(=O)NNC(=O)c1ccccc1	ZINC000819492443	CC	On-Demand	Reactive	MME	20	44
CC(=O)Nc1cccc(CC(=O)NC/C=C\CNC(=O)OC(C)(C)C)c1	ZINC000819492444	FE	On-Demand	Anodyne	NQO2	21	40
O=C(O)CCNC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	ZINC000819492462	GE	On-Demand	Reactive	GCGR	69	41
O=C(O)CCNC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	ZINC000819492462	GE	On-Demand	Reactive	PTGER3	68	42
O=C(O)CCNC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	ZINC000819492462	GE	On-Demand	Reactive	PPARD	15	44
O=C(O)CCNC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	ZINC000819492462	GE	On-Demand	Reactive	SLC6A5	36	45
O=C(O)CCNC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	ZINC000819492462	GE	On-Demand	Reactive	GIPR	50	40
O=C(O)CCNC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	ZINC000819492462	GE	On-Demand	Reactive	FFAR1	40	46
O=C(O)CCNC(=O)NNC(=O)c1ccc(COc2ccc(Cl)cc2)cc1	ZINC000819492462	GE	On-Demand	Reactive	FFAR4	49	43
O=C(O)CCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819492464	CC	On-Demand	Reactive	CCKAR	40	45
O=C(O)CCNC(=O)NNC(=O)c1c[nH]c2ccccc12	ZINC000819492464	CC	On-Demand	Reactive	BRS3	25	43
O=C(O)CCNC(=O)NNC(=O)CCCc1cccs1	ZINC000819492474	CC	On-Demand	Reactive	PTPRF	18	41
O=C(O)CCNC(=O)NNC(=O)c1ccc(Cl)cc1Cl	ZINC000819492476	DD	On-Demand	Reactive	PYGL	18	44
O=C(O)CCNC(=O)NNC(=O)c1ccc(Cl)cc1Cl	ZINC000819492476	DD	On-Demand	Reactive	SLC6A9	42	32
O=C(O)CCNC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000819492478	EG	On-Demand	Anodyne	TSHR	55	38
O=C(O)CCNC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000819492478	EG	On-Demand	Anodyne	GCGR	15	40
O=C(O)CCNC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000819492478	EG	On-Demand	Anodyne	LTA4H	27	47
O=C(O)CCNC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000819492478	EG	On-Demand	Anodyne	CA1	34	43
O=C(O)CCNC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000819492478	EG	On-Demand	Anodyne	CA12	16	43
O=C(O)CCNC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000819492478	EG	On-Demand	Anodyne	CA9	17	43
O=C(O)CCNC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000819492478	EG	On-Demand	Anodyne	FFAR1	41	43
O=C(O)CCNC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000819492478	EG	On-Demand	Anodyne	NCE103	17	42
O=C(O)CCNC(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000819492478	EG	On-Demand	Anodyne	FFAR4	62	43
O=C(O)CCNC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819492481	EE	On-Demand	Anodyne	ESR1	80	39
O=C(O)CCNC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819492481	EE	On-Demand	Anodyne	ADRB1	22	40
O=C(O)CCNC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819492481	EE	On-Demand	Anodyne	HRH2	51	52
O=C(O)CCNC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819492481	EE	On-Demand	Anodyne	HTR2A	23	46
O=C(O)CCNC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819492481	EE	On-Demand	Anodyne	KCNH2	15	40
O=C(O)CCNC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819492481	EE	On-Demand	Anodyne	ESR2	57	48
O=C(O)CCNC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819492481	EE	On-Demand	Anodyne	LTA4H	92	49
O=C(O)CCNC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819492481	EE	On-Demand	Anodyne	HRH3	72	67
O=C(O)CCNC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819492481	EE	On-Demand	Anodyne	CCR3	19	40
O=C(O)CCNC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819492481	EE	On-Demand	Anodyne	CHRNA7	22	55
O=C(O)CCNC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819492481	EE	On-Demand	Anodyne	EPHX2	44	50
O=C(O)CCNC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819492481	EE	On-Demand	Anodyne	FLT3	17	43
O=C(O)CCNC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819492481	EE	On-Demand	Anodyne	MCHR1	20	50
O=C(O)CCNC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819492481	EE	On-Demand	Anodyne	PSMB2	52	48
O=C(O)CCNC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000819492481	EE	On-Demand	Anodyne	PSMB1	56	49
O=C(O)CCNC(=O)NNC(=O)c1cccc(Cl)c1	ZINC000819492497	CC	On-Demand	Reactive	KCNK3	23	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCC1(c2ccccn2)CC1	ZINC000819492500	EE	On-Demand	Anodyne	NMBR	42	37
O=C(O)CCNC(=O)Nc1ccc(Br)nc1	ZINC000819492518	CD	On-Demand	Anodyne	ADRB1	39	47
O=C(O)CCNC(=O)Nc1ccc(Br)nc1	ZINC000819492518	CD	On-Demand	Anodyne	FOLH1	17	45
O=C(O)CCNC(=O)Nc1ccc(CC(F)(F)F)cc1	ZINC000819492525	CE	On-Demand	Anodyne	EPHX2	17	47
O=C(O)CCNC(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1	ZINC000819492537	GD	On-Demand	Reactive	PPIA	38	45
O=C(O)CCNC(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1	ZINC000819492537	GD	On-Demand	Reactive	PTGER3	54	40
O=C(O)CCNC(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1	ZINC000819492537	GD	On-Demand	Reactive	HCN1	56	42
O=C(O)CCNC(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1	ZINC000819492537	GD	On-Demand	Reactive	HCN4	42	32
O=C(O)CCNC(=O)Nc1ccc(N2CCSCC2)cc1	ZINC000819492540	DD	On-Demand	Anodyne	EPHX2	22	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCCCNc1cccc(F)c1)C2	ZINC000819492546	FF	On-Demand	Anodyne	TBK1	18	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCCCNc1cccc(F)c1)C2	ZINC000819492547	FF	On-Demand	Anodyne	TBK1	18	41
O=C(O)CCNC(=O)Nc1ccc(Oc2ccc(Cl)cc2)nc1	ZINC000819492549	EG	On-Demand	Anodyne	FOLH1	15	43
O=C(O)CCNC(=O)Nc1ccc2scnc2c1	ZINC000819492552	CD	On-Demand	Anodyne	PRMT3	67	38
O=C(O)CCNC(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1	ZINC000819492568	EE	On-Demand	Anodyne	MTOR	64	37
O=C(O)CCNC(=O)Nc1ccc(-c2noc(C(F)(F)F)n2)cc1	ZINC000819492568	EE	On-Demand	Anodyne	GIPR	48	33
O=C(O)CCNC(=O)NNC(=O)COc1ccc(Br)cc1	ZINC000819492569	FC	On-Demand	Reactive	PLA2G4B	48	33
O=C(O)CCNC(=O)NNC(=O)COc1ccc(Br)cc1	ZINC000819492569	FC	On-Demand	Reactive	FFAR1	18	50
O=C(O)CCNC(=O)NNC(=O)COc1ccc(Br)cc1	ZINC000819492569	FC	On-Demand	Reactive	FFAR4	34	41
O=C(O)CCNC(=O)NNC(=O)COc1ccc(Br)cc1	ZINC000819492569	FC	On-Demand	Reactive	TRAR	22	42
O=C(O)CCNC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1	ZINC000819492571	FG	On-Demand	Anodyne	GCGR	63	42
O=C(O)CCNC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1	ZINC000819492571	FG	On-Demand	Anodyne	FOLH1	20	53
O=C(O)CCNC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1	ZINC000819492571	FG	On-Demand	Anodyne	F10	18	43
O=C(O)CCNC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1	ZINC000819492571	FG	On-Demand	Anodyne	CPT1A	48	34
O=C(O)CCNC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1	ZINC000819492571	FG	On-Demand	Anodyne	PRNP	34	47
O=C(O)CCNC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1	ZINC000819492571	FG	On-Demand	Anodyne	EPHX2	22	49
O=C(O)CCNC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1	ZINC000819492571	FG	On-Demand	Anodyne	F7	15	40
O=C(O)CCNC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1	ZINC000819492571	FG	On-Demand	Anodyne	GIPR	52	37
O=C(O)CCNC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1	ZINC000819492571	FG	On-Demand	Anodyne	NOD1	15	43
O=C(O)CCNC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1	ZINC000819492571	FG	On-Demand	Anodyne	Q25615_ONCVO	24	41
O=C(O)CCNC(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1	ZINC000819492571	FG	On-Demand	Anodyne	KCNK3	41	41
O=C(O)CCNC(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819492573	DD	On-Demand	Anodyne	NPY2R	88	44
O=C(O)CCNC(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819492573	DD	On-Demand	Anodyne	PIK3CA	32	42
O=C(O)CCNC(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819492573	DD	On-Demand	Anodyne	MTOR	55	43
O=C(O)CCNC(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819492573	DD	On-Demand	Anodyne	EPHX2	26	44
O=C(O)CCNC(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819492573	DD	On-Demand	Anodyne	PIK3CG	32	42
O=C(O)CCNC(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000819492573	DD	On-Demand	Anodyne	PIK3CB	22	41
O=C(O)CCNC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000819492574	CC	On-Demand	Reactive	CACNA1D	52	33
O=C(O)CCNC(=O)N[C@H](CCO)c1ccccc1	ZINC000819492578	CC	On-Demand	Anodyne	FOLH1	37	40
O=C(O)CCNC(=O)N[C@H](CCO)c1ccccc1	ZINC000819492578	CC	On-Demand	Anodyne	MME	38	43
O=C(O)CCNC(=O)N[C@H](CCO)c1ccccc1	ZINC000819492578	CC	On-Demand	Anodyne	NAALAD2	42	43
O=C(O)CCNC(=O)N[C@H](CCO)c1ccccc1	ZINC000819492578	CC	On-Demand	Anodyne	SOAT1	20	40
O=C(O)CCNC(=O)Nc1ccc(-c2ccccc2)nn1	ZINC000819492579	CD	On-Demand	Anodyne	MME	20	41
O=C(O)CCNC(=O)Nc1ccc2nccn2c1	ZINC000819492581	BC	On-Demand	Anodyne	NAMPT	17	54
O=C(O)CCNC(=O)Nc1cccc(N2CCCCC2)c1	ZINC000819492582	CE	On-Demand	Anodyne	HRH2	28	44
O=C(O)CCNC(=O)Nc1cccc(N2CCCCC2)c1	ZINC000819492582	CE	On-Demand	Anodyne	KCNQ2	44	36
O=C(O)CCNC(=O)Nc1cccc(N2CCCCC2)c1	ZINC000819492582	CE	On-Demand	Anodyne	CCKBR	16	40
O=C(O)CCNC(=O)Nc1cccc(N2CCCCC2)c1	ZINC000819492582	CE	On-Demand	Anodyne	EPHX2	23	40
O=C(O)CCNC(=O)Nc1cccc(CN2CCOC2=O)c1	ZINC000819492583	DD	On-Demand	Anodyne	HRH2	31	42
O=C(O)CCNC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000819492587	FD	On-Demand	Reactive	CA4	19	44
O=C(O)CCNC(=O)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000819492587	FD	On-Demand	Reactive	IDO1	22	40
O=C(O)CCNC(=O)NNC(=O)c1ccccc1O	ZINC000819492589	CB	On-Demand	Reactive	MME	17	41
O=C(O)CCNC(=O)NNC(=O)c1c(Cl)cccc1Cl	ZINC000819492593	DD	On-Demand	Reactive	PPIA	24	40
O=C(O)CCNC(=O)NNC(=O)COc1ccc(F)cc1	ZINC000819492595	CC	On-Demand	Reactive	FFAR1	18	40
O=C(O)CCNC(=O)NNC(=O)COc1ccc(F)cc1	ZINC000819492595	CC	On-Demand	Reactive	FFAR4	35	40
O=C(O)CCNC(=O)Nc1ccc(-c2noc(C(F)F)n2)cc1	ZINC000819492601	EE	On-Demand	Anodyne	MTOR	72	38
O=C(O)CCNC(=O)NNc1ccc(Cl)cc1Cl	ZINC000819492604	CE	On-Demand	Reactive	ALPL	40	33
O=C(O)CCNC(=O)NNC(=O)Cc1cccnc1	ZINC000819492605	CB	On-Demand	Reactive	TBXA2R	26	40
O=C(O)CCNC(=O)NNC(=O)Cc1cccnc1	ZINC000819492605	CB	On-Demand	Reactive	TBXAS1	89	49
O=C(O)CCNC(=O)NNC(=O)Cc1cccnc1	ZINC000819492605	CB	On-Demand	Reactive	PTAFR	19	41
O=C(O)CCNC(=O)NNC(=O)Cc1cccnc1	ZINC000819492605	CB	On-Demand	Reactive	NAMPT	47	42
O=C(O)CCNC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1	ZINC000819492606	EG	On-Demand	Anodyne	FASN	19	41
O=C(O)CCNC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1	ZINC000819492606	EG	On-Demand	Anodyne	HPSE	64	41
O=C(O)CCNC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1	ZINC000819492606	EG	On-Demand	Anodyne	AGPAT2	24	41
O=C(O)CCNC(=O)Nc1ccc(-c2nc3ccccc3o2)cc1	ZINC000819492606	EG	On-Demand	Anodyne	IMDH_CRYPV	35	41
O=C(O)CCNC(=O)NNC(=O)COc1ccccc1-c1ccccc1	ZINC000819492608	FD	On-Demand	Reactive	FABP4	28	40
O=C(O)CCNC(=O)NNC(=O)COc1ccccc1-c1ccccc1	ZINC000819492608	FD	On-Demand	Reactive	FABP3	25	40
O=C(O)CCNC(=O)NNC(=O)COc1ccccc1-c1ccccc1	ZINC000819492608	FD	On-Demand	Reactive	FFAR4	37	40
O=C(O)CCNC(=O)Nc1ccc(Oc2ccccn2)cc1	ZINC000819492609	DE	On-Demand	Anodyne	ADRB1	42	35
O=C(O)CCNC(=O)Nc1ccc(Oc2ccccn2)cc1	ZINC000819492609	DE	On-Demand	Anodyne	LTA4H	38	50
O=C(O)CCNC(=O)Nc1ccc(Oc2ccccn2)cc1	ZINC000819492609	DE	On-Demand	Anodyne	CA1	34	43
O=C(O)CCNC(=O)Nc1ccc(Oc2ccccn2)cc1	ZINC000819492609	DE	On-Demand	Anodyne	KDR	17	40
O=C(O)CCNC(=O)Nc1ccc(Oc2ccccn2)cc1	ZINC000819492609	DE	On-Demand	Anodyne	PDGFRA	46	39
O=C(O)CCNC(=O)Nc1ccc(Oc2ccccn2)cc1	ZINC000819492609	DE	On-Demand	Anodyne	CA9	15	49
O=C(O)CCNC(=O)Nc1ccc(Oc2ccccn2)cc1	ZINC000819492609	DE	On-Demand	Anodyne	NCE103	15	43
O=C(O)CCNC(=O)Nc1ccc(Oc2ccccn2)cc1	ZINC000819492609	DE	On-Demand	Anodyne	NAMPT	20	48
O=C(O)CCNC(=O)NNC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819492610	EE	On-Demand	Reactive	FOLH1	17	43
O=C(O)CCNC(=O)NNC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819492610	EE	On-Demand	Reactive	MME	30	47
O=C(O)CCNC(=O)NNC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819492610	EE	On-Demand	Reactive	LTA4H	15	41
O=C(O)CCNC(=O)NNC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819492610	EE	On-Demand	Reactive	CA1	32	43
O=C(O)CCNC(=O)NNC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819492610	EE	On-Demand	Reactive	PRNP	23	41
O=C(O)CCNC(=O)NNC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819492610	EE	On-Demand	Reactive	SLC1A2	21	42
O=C(O)CCNC(=O)NNC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000819492610	EE	On-Demand	Reactive	CA9	15	48
O=C(O)CCNC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	ZINC000819492611	GE	On-Demand	Reactive	PRS	65	50
O=C(O)CCNC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	ZINC000819492611	GE	On-Demand	Reactive	ACACB	15	50
O=C(O)CCNC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	ZINC000819492611	GE	On-Demand	Reactive	TACR3	54	61
O=C(O)CCNC(=O)NNC(=O)c1cc(-c2ccccc2)nc2ccccc12	ZINC000819492611	GE	On-Demand	Reactive	MT-CO2	51	44
O=C(O)CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819492615	GB	On-Demand	Reactive	CA2	15	49
O=C(O)CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819492615	GB	On-Demand	Reactive	TGM2	61	40
O=C(O)CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819492615	GB	On-Demand	Reactive	F13A1	50	41
O=C(O)CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000819492615	GB	On-Demand	Reactive	NAMPT	37	46
O=C(O)CCNC(=O)Nc1ccc(-n2cccn2)cc1	ZINC000819492617	CD	On-Demand	Anodyne	AMP1_PLAFQ	59	43
O=C(O)CCNC(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1	ZINC000819492620	EG	On-Demand	Anodyne	PRMT3	52	36
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	ZINC000819492622	GD	On-Demand	Anodyne	CA2	18	45
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	ZINC000819492622	GD	On-Demand	Anodyne	CA1	25	45
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	ZINC000819492622	GD	On-Demand	Anodyne	CA4	21	45
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	ZINC000819492622	GD	On-Demand	Anodyne	CA9	19	40
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NC2=NCCCCC2)cc1	ZINC000819492622	GD	On-Demand	Anodyne	NAMPT	38	41
O=C(O)CCNC(=O)Nc1ccc(N2CCCCCC2)cc1	ZINC000819492623	DF	On-Demand	Anodyne	HRH2	17	40
O=C(O)CCNC(=O)Nc1ccc(N2CCCCCC2)cc1	ZINC000819492623	DF	On-Demand	Anodyne	KCNQ2	27	47
O=C(O)CCNC(=O)Nc1ccc(N2CCCCCC2)cc1	ZINC000819492623	DF	On-Demand	Anodyne	EPHX2	27	40
O=C(O)CCNC(=O)Nc1ccc(N2CCCCCC2)cc1	ZINC000819492623	DF	On-Demand	Anodyne	NAMPT	25	43
O=C(O)CCNC(=O)NNC(=O)c1ccc2ccccc2n1	ZINC000819492624	DC	On-Demand	Reactive	CYSLTR1	22	46
O=C(O)CCNC(=O)Nc1ccc(-n2cccn2)c(F)c1	ZINC000819492627	CD	On-Demand	Anodyne	NPY2R	53	34
O=C(O)CCNC(=O)Nc1ccc(-n2cccn2)c(F)c1	ZINC000819492627	CD	On-Demand	Anodyne	CCR3	19	41
O=C(O)CCNC(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1	ZINC000819492629	EC	On-Demand	Anodyne	NPY2R	46	37
O=C(O)CCNC(=O)Nc1ccc(-c2ccccc2)cc1F	ZINC000819492631	DG	On-Demand	Anodyne	DHODH	19	42
O=C(O)CCNC(=O)Nc1ccc(-c2ccccc2)cc1F	ZINC000819492631	DG	On-Demand	Anodyne	MME	30	48
O=C(O)CCNC(=O)Nc1cccc(COc2cccc(F)c2)c1	ZINC000819492633	EG	On-Demand	Anodyne	HRH2	31	43
O=C(O)CCNC(=O)Nc1cccc(COc2cccc(F)c2)c1	ZINC000819492633	EG	On-Demand	Anodyne	MAOB	24	41
O=C(O)CCNC(=O)Nc1cccc(COc2cccc(F)c2)c1	ZINC000819492633	EG	On-Demand	Anodyne	PTGER3	59	44
O=C(O)CCNC(=O)Nc1cccc(COc2cccc(F)c2)c1	ZINC000819492633	EG	On-Demand	Anodyne	GYS1	44	34
O=C(O)CCNC(=O)Nc1cccc(COc2cccc(F)c2)c1	ZINC000819492633	EG	On-Demand	Anodyne	EPHX2	17	43
O=C(O)CCNC(=O)Nc1cccc(COc2cccc(F)c2)c1	ZINC000819492633	EG	On-Demand	Anodyne	FFAR1	61	45
O=C(O)CCNC(=O)Nc1cccc(COc2cccc(F)c2)c1	ZINC000819492633	EG	On-Demand	Anodyne	FFAR4	24	41
O=C(O)CCNC(=O)Nc1cccc(COc2cccc(F)c2)c1	ZINC000819492633	EG	On-Demand	Anodyne	PDS	38	41
O=C(O)CCNC(=O)NNC(=O)CCOc1ccccc1	ZINC000819492634	CC	On-Demand	Reactive	LTA4H	34	47
O=C(O)CCNC(=O)NNC(=O)CCOc1ccccc1	ZINC000819492634	CC	On-Demand	Reactive	PLA2G4B	43	31
O=C(O)CCNC(=O)NNC(=O)CCOc1ccccc1	ZINC000819492634	CC	On-Demand	Reactive	FFAR1	29	40
O=C(O)CCNC(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	ZINC000819492635	DD	On-Demand	Anodyne	FOLH1	21	43
O=C(O)CCNC(=O)Nc1ccc(=O)n(Cc2ccccc2)c1	ZINC000819492635	DD	On-Demand	Anodyne	MME	15	45
O=C(O)CCNC(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000819492638	DE	On-Demand	Anodyne	TSHR	40	31
O=C(O)CCNC(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000819492638	DE	On-Demand	Anodyne	PPIA	39	42
O=C(O)CCNC(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000819492638	DE	On-Demand	Anodyne	ADRB3	30	40
O=C(O)CCNC(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000819492638	DE	On-Demand	Anodyne	LTA4H	31	48
O=C(O)CCNC(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000819492638	DE	On-Demand	Anodyne	TBXAS1	63	42
O=C(O)CCNC(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000819492638	DE	On-Demand	Anodyne	CA1	25	46
O=C(O)CCNC(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000819492638	DE	On-Demand	Anodyne	CHRNA7	27	43
O=C(O)CCNC(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000819492638	DE	On-Demand	Anodyne	FFAR1	40	43
O=C(O)CCNC(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000819492638	DE	On-Demand	Anodyne	FFAR4	38	40
O=C(O)CCNC(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000819492638	DE	On-Demand	Anodyne	NAMPT	67	60
O=C(O)CCNC(=O)NNC(=O)NCc1ccc(Cl)cc1	ZINC000819492639	DC	On-Demand	Reactive	TBXA2R	43	34
O=C(O)CCNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000819492647	DC	On-Demand	Anodyne	HRH2	28	40
O=C(O)CCNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000819492647	DC	On-Demand	Anodyne	NPY1R	31	44
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	ACE	16	42
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	MME	31	41
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	EDNRB	20	43
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	EDNRA	31	51
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	TPR	15	55
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	MC4R	37	42
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	CCKAR	98	44
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	CTSL	22	40
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	BRS3	31	57
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	NMBR	55	40
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	MC3R	60	36
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	MC5R	68	36
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	MMP2	24	41
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	GRIA1	20	45
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	GRPR	77	35
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	ECE1	51	41
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	SSTR3	21	40
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	MMP11	63	32
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	CCKBR	90	40
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	MMP9	23	40
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	MC1R	84	42
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	MMP1	18	45
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	SSSIM	27	41
O=C(O)CCNC(=O)NNC(=O)Cc1c[nH]c2ccccc12	ZINC000819492648	DC	On-Demand	Reactive	KISS1R	58	32
O=C(O)CCNC(=O)Nc1ccc(COC2CCCC2)cc1	ZINC000819492649	DF	On-Demand	Anodyne	ADRB1	19	45
O=C(O)CCNC(=O)Nc1ccc(COC2CCCC2)cc1	ZINC000819492649	DF	On-Demand	Anodyne	EPHX2	32	41
O=C(O)CCNC(=O)Nc1ccc(-c2nc3ccccc3s2)cc1	ZINC000819492650	EH	On-Demand	Anodyne	APP	19	40
O=C(O)CCNC(=O)Nc1ccc(-c2nc3ccccc3s2)cc1	ZINC000819492650	EH	On-Demand	Anodyne	ROCK2	19	45
O=C(O)CCNC(=O)Nc1ccc(-c2nc3ccccc3s2)cc1	ZINC000819492650	EH	On-Demand	Anodyne	AGPAT2	15	43
O=C(O)CCNC(=O)Nc1ccc(-c2nc3ccccc3s2)cc1	ZINC000819492650	EH	On-Demand	Anodyne	LUCI_PHOPE	15	44
O=C(O)CCNC(=O)Nc1ccc(-c2nc3ccccc3s2)cc1	ZINC000819492650	EH	On-Demand	Anodyne	ETHR	16	51
O=C(O)CCNC(=O)NNC(=O)Cc1ccc(Cl)cc1	ZINC000819492654	CC	On-Demand	Reactive	TBXA2R	46	36
O=C(O)CCNC(=O)NNC(=O)c1cccc(C(F)(F)F)c1	ZINC000819492655	DD	On-Demand	Reactive	GCGR	44	38
O=C(O)CCNC(=O)NNC(=O)c1cccc(C(F)(F)F)c1	ZINC000819492655	DD	On-Demand	Reactive	KCNJ11	20	41
O=C(O)CCNC(=O)NNC(=O)c1cccc(C(F)(F)F)c1	ZINC000819492655	DD	On-Demand	Reactive	CCR2	78	41
O=C(O)CCNC(=O)NNC(=O)c1cccc(C(F)(F)F)c1	ZINC000819492655	DD	On-Demand	Reactive	GIPR	40	35
O=C(O)CCNC(=O)NNC(=O)c1cccc(C(F)(F)F)c1	ZINC000819492655	DD	On-Demand	Reactive	KCNK3	22	50
O=C(O)CCNC(=O)NNC(=O)COCc1ccccc1	ZINC000819492656	CC	On-Demand	Reactive	MME	27	43
O=C(O)CCNC(=O)NNC(=O)COCc1ccccc1	ZINC000819492656	CC	On-Demand	Reactive	FFAR1	20	40
O=C(O)CCNC(=O)NNC(=O)c1cnn(-c2ccccc2)c1	ZINC000819492657	DC	On-Demand	Reactive	GCGR	16	43
O=C(O)CCNC(=O)NNC(=O)Cc1ccccc1F	ZINC000819492658	CC	On-Demand	Reactive	MME	17	42
O=C(O)CCNC(=O)NNC(=O)Cc1ccccc1F	ZINC000819492658	CC	On-Demand	Reactive	CXCL8	27	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(Cl)c(C)c1)C2	ZINC000819492672	FG	On-Demand	Anodyne	P2RX7	24	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(Cl)c(C)c1)C2	ZINC000819492673	FG	On-Demand	Anodyne	P2RX7	24	40
O=C(O)CCNC(=O)NNC(=O)Cc1cccc2ccccc12	ZINC000819492678	DD	On-Demand	Reactive	MTNR1A	28	49
O=C(O)CCNC(=O)Nc1cccc(N2CCCS2(=O)=O)c1	ZINC000819492679	EC	On-Demand	Anodyne	CDK1	17	42
O=C(O)CCNC(=O)Nc1ccc(COCc2ccccc2)cc1	ZINC000819492680	EF	On-Demand	Anodyne	PPIA	41	41
O=C(O)CCNC(=O)Nc1ccc(COCc2ccccc2)cc1	ZINC000819492680	EF	On-Demand	Anodyne	FOLH1	21	44
O=C(O)CCNC(=O)Nc1ccc(COCc2ccccc2)cc1	ZINC000819492680	EF	On-Demand	Anodyne	MME	26	42
O=C(O)CCNC(=O)Nc1ccc(COCc2ccccc2)cc1	ZINC000819492680	EF	On-Demand	Anodyne	LTA4H	31	45
O=C(O)CCNC(=O)Nc1ccc(COCc2ccccc2)cc1	ZINC000819492680	EF	On-Demand	Anodyne	CA1	33	48
O=C(O)CCNC(=O)Nc1ccc(COCc2ccccc2)cc1	ZINC000819492680	EF	On-Demand	Anodyne	ROCK2	15	46
O=C(O)CCNC(=O)Nc1ccc(COCc2ccccc2)cc1	ZINC000819492680	EF	On-Demand	Anodyne	GHSR	15	51
O=C(O)CCNC(=O)Nc1ccc(COCc2ccccc2)cc1	ZINC000819492680	EF	On-Demand	Anodyne	EPHX2	19	41
O=C(O)CCNC(=O)Nc1ccc(COCc2ccccc2)cc1	ZINC000819492680	EF	On-Demand	Anodyne	FFAR1	30	42
O=C(O)CCNC(=O)Nc1ccc(COCc2ccccc2)cc1	ZINC000819492680	EF	On-Demand	Anodyne	NCE103	18	48
O=C(O)CCNC(=O)Nc1ccc(COCc2ccccc2)cc1	ZINC000819492680	EF	On-Demand	Anodyne	P96878_MYCTU	18	44
O=C(O)CCNC(=O)Nc1ccc(COCc2ccccc2)cc1	ZINC000819492680	EF	On-Demand	Anodyne	NAMPT	31	42
COc1cccc([S@@](=O)CC(=O)NC2COC(C)(C)OC2)c1	ZINC000819492703	ED	On-Demand	Anodyne	MTNR1A	34	41
COc1cccc([S@@](=O)CC(=O)NC2COC(C)(C)OC2)c1	ZINC000819492703	ED	On-Demand	Anodyne	MTNR1B	32	41
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	CA2	44	55
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	PPIA	21	42
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	FOLH1	15	40
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	TBXA2R	53	43
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	TBXAS1	42	38
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	BMP1	15	41
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	CA1	51	57
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	CA7	18	51
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	CA5B	37	42
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	CA4	34	53
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	CA5A	42	42
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	MMP2	15	41
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	TGM2	21	41
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	CA12	44	57
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	CA9	47	51
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	F13A1	35	41
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	IDO1	40	42
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	NCE103	35	55
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	MTCA1	50	57
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	P96878_MYCTU	62	57
O=C(O)CCNC(=O)Nc1ccc(S(=O)(=O)NCc2ccccc2)cc1	ZINC000819492704	GD	On-Demand	Anodyne	NAMPT	70	50
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819492706	GE	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819492708	GE	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819492715	FF	On-Demand	Anodyne	HTR4	63	42
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819492715	FF	On-Demand	Anodyne	ACACB	16	43
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819492715	FF	On-Demand	Anodyne	CACNA1I	68	36
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819492715	FF	On-Demand	Anodyne	CCR8	73	42
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819492715	FF	On-Demand	Anodyne	GPR119	38	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819492716	FF	On-Demand	Anodyne	HTR4	63	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819492716	FF	On-Demand	Anodyne	ACACB	16	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819492716	FF	On-Demand	Anodyne	CACNA1I	68	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819492716	FF	On-Demand	Anodyne	CCR8	73	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)c2coc(=O)c3ccccc23)C1	ZINC000819492716	FF	On-Demand	Anodyne	GPR119	38	42
CCC[C@@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819492719	FH	On-Demand	Mild	PAPA1_CARPA	30	43
CCC[C@H]1CCCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819492721	FH	On-Demand	Mild	PAPA1_CARPA	30	43
CCC[C@@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819492722	FH	On-Demand	Mild	PAPA1_CARPA	30	43
CCC[C@H]1CCCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819492725	FH	On-Demand	Mild	PAPA1_CARPA	30	43
COc1cc(NCCC(=O)Nc2cccc(Cl)c2)ccc1OCCN(C)C	ZINC000819492735	GH	On-Demand	Anodyne	CPT1A	46	33
COc1cc(NCCC(=O)Nc2cccc(Cl)c2)ccc1OCCN(C)C	ZINC000819492735	GH	On-Demand	Anodyne	KDR	15	42
COc1cc(NCCC(=O)Nc2cccc(Cl)c2)ccc1OCCN(C)C	ZINC000819492735	GH	On-Demand	Anodyne	MCHR2	20	43
COc1cc(NCCC(=O)Nc2cccc(Cl)c2)ccc1OCCN(C)C	ZINC000819492735	GH	On-Demand	Anodyne	ENPP1	72	38
COc1cc(NCCC(=O)Nc2cccc(Cl)c2)ccc1OCCN(C)C	ZINC000819492735	GH	On-Demand	Anodyne	DRTS_TRYCR	47	34
COc1cc(NCCC(=O)Nc2cccc(Cl)c2)ccc1OCCN(C)C	ZINC000819492735	GH	On-Demand	Anodyne	KCNK3	40	35
COc1cc(NC[C@H](O)c2ccc(F)c(F)c2)ccc1OCCN(C)C	ZINC000819492766	FG	On-Demand	Anodyne	DRTS_TRYCR	48	34
COc1cc(NC[C@@H](O)c2ccc(F)c(F)c2)ccc1OCCN(C)C	ZINC000819492768	FG	On-Demand	Anodyne	DRTS_TRYCR	48	34
O=C(/C=C/[C@@H]1CCCO1)N1CCCCC[C@@H]1c1ncon1	ZINC000819492785	CE	On-Demand	Anodyne	CPT1A	45	36
O=C(/C=C/[C@@H]1CCCO1)N1CCCCC[C@H]1c1ncon1	ZINC000819492788	CE	On-Demand	Anodyne	CPT1A	45	36
O=C(/C=C\[C@@H]1CCCO1)N1CCCCC[C@H]1c1ncon1	ZINC000819492790	CE	On-Demand	Anodyne	CPT1A	45	36
O=C(/C=C\[C@@H]1CCCO1)N1CCCCC[C@@H]1c1ncon1	ZINC000819492792	CE	On-Demand	Anodyne	CPT1A	45	36
O=C(O)CCNC(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	ZINC000819492829	ED	On-Demand	Anodyne	MTOR	47	38
O=C(O)CCNC(=O)Nc1ccc(C(=O)NC2CCOCC2)cc1	ZINC000819492829	ED	On-Demand	Anodyne	EPHX2	44	46
O=C(O)CCNC(=O)NNC(=O)c1ccc(Cl)cc1	ZINC000819492832	CC	On-Demand	Reactive	GCGR	56	39
O=C(O)CCNC(=O)NNC(=O)c1ccc(Cl)cc1	ZINC000819492832	CC	On-Demand	Reactive	TBXA2R	42	33
O=C(O)CCNC(=O)NNC(=O)c1ccc(Cl)cc1	ZINC000819492832	CC	On-Demand	Reactive	GIPR	44	38
O=C(O)CCNC(=O)NOCc1ccccc1	ZINC000819492856	BC	On-Demand	Anodyne	MME	34	45
O=C(O)CCNC(=O)NOCc1ccccc1	ZINC000819492856	BC	On-Demand	Anodyne	LTA4H	19	40
O=C(O)CCNC(=O)NOCc1ccccc1	ZINC000819492856	BC	On-Demand	Anodyne	CAPNS1	58	38
O=C(O)CCNC(=O)NOCc1ccccc1	ZINC000819492856	BC	On-Demand	Anodyne	CAPN1	53	38
O=C(O)CCNC(=O)NOCc1ccccc1	ZINC000819492856	BC	On-Demand	Anodyne	CAPN2	80	38
O=C(O)CCNC(=O)NOCc1ccccc1	ZINC000819492856	BC	On-Demand	Anodyne	NPR	61	37
O=C(O)CCNC(=O)NOCc1ccccc1	ZINC000819492856	BC	On-Demand	Anodyne	FFAR1	33	43
O=C(O)CCNC(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819492858	FF	On-Demand	Anodyne	CCR3	31	40
O=C(O)CCNC(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819492858	FF	On-Demand	Anodyne	HDAC10	35	65
O=C(O)CCNC(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819492858	FF	On-Demand	Anodyne	ROCK2	15	43
O=C(O)CCNC(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819492858	FF	On-Demand	Anodyne	HDAC2	15	65
O=C(O)CCNC(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819492858	FF	On-Demand	Anodyne	HDAC3	36	65
O=C(O)CCNC(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819492858	FF	On-Demand	Anodyne	HDAC6	29	65
O=C(O)CCNC(=O)Nc1cccc(-c2cn(Cc3ccccc3)nn2)c1	ZINC000819492858	FF	On-Demand	Anodyne	CDC7	21	47
O=C(O)CCNC(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	ZINC000819492865	FF	On-Demand	Anodyne	GCGR	21	40
O=C(O)CCNC(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F	ZINC000819492865	FF	On-Demand	Anodyne	TRPV1	18	40
O=C(O)CCNC(=O)Nc1ccc(OCc2ccccn2)c(F)c1	ZINC000819492870	EE	On-Demand	Anodyne	ADRB1	41	32
O=C(O)CCNC(=O)Nc1ccc(OCc2ccccn2)c(F)c1	ZINC000819492870	EE	On-Demand	Anodyne	KDR	21	40
O=C(O)CCNC(=O)Nc1ccc(OCc2ccccn2)c(F)c1	ZINC000819492870	EE	On-Demand	Anodyne	GRM4	26	41
O=C(O)CCNC(=O)Nc1ccc(OCc2ccccn2)c(F)c1	ZINC000819492870	EE	On-Demand	Anodyne	MET	64	40
CC(=O)Nc1cccnc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819492893	GF	On-Demand	Mild	PAPA1_CARPA	45	44
CC(=O)Nc1cccnc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819492895	GF	On-Demand	Mild	PAPA1_CARPA	45	44
O=C(Nc1ccc(CN2CCOCC2)c(Cl)c1)C(F)=C1CCC1	ZINC000819492912	EH	On-Demand	Anodyne	EPHX2	30	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ccc(C)cc3)CC1)C2	ZINC000819492914	FF	On-Demand	Anodyne	SSTR1	44	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ccc(C)cc3)CC1)C2	ZINC000819492914	FF	On-Demand	Anodyne	ADAM10	37	42
O=C(O)CCNC(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F	ZINC000819492918	GG	On-Demand	Anodyne	KCNK3	19	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ccc(C)cc3)CC1)C2	ZINC000819492923	FF	On-Demand	Anodyne	SSTR1	44	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ccc(C)cc3)CC1)C2	ZINC000819492923	FF	On-Demand	Anodyne	ADAM10	37	42
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)c(S(C)(=O)=O)c2)cc1	ZINC000819492925	GE	On-Demand	Anodyne	ADRB2	46	41
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)c(S(C)(=O)=O)c2)cc1	ZINC000819492925	GE	On-Demand	Anodyne	ADRB1	55	41
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)c(S(C)(=O)=O)c2)cc1	ZINC000819492925	GE	On-Demand	Anodyne	GRIN1	29	44
CCOc1ccc(OC[C@@H](O)CNc2ccc(OC)c(S(C)(=O)=O)c2)cc1	ZINC000819492925	GE	On-Demand	Anodyne	ADRB3	44	41
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)c(S(C)(=O)=O)c2)cc1	ZINC000819492927	GE	On-Demand	Anodyne	ADRB2	46	41
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)c(S(C)(=O)=O)c2)cc1	ZINC000819492927	GE	On-Demand	Anodyne	ADRB1	55	41
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)c(S(C)(=O)=O)c2)cc1	ZINC000819492927	GE	On-Demand	Anodyne	GRIN1	29	44
CCOc1ccc(OC[C@H](O)CNc2ccc(OC)c(S(C)(=O)=O)c2)cc1	ZINC000819492927	GE	On-Demand	Anodyne	ADRB3	44	41
COc1cccc([S@@](=O)CC(=O)NC2CC(OC)C2)c1	ZINC000819492967	CD	On-Demand	Anodyne	MTNR1A	40	40
COc1cccc([S@@](=O)CC(=O)NC2CC(OC)C2)c1	ZINC000819492967	CD	On-Demand	Anodyne	MTNR1B	40	40
CC(C)(C)OC(=O)N1CCC(n2cc(NC(=O)/C=C/[C@H]3CCCO3)cn2)CC1	ZINC000819492969	GG	On-Demand	Anodyne	MTOR	31	44
CC(C)(C)OC(=O)N1CCC(n2cc(NC(=O)/C=C\[C@H]3CCCO3)cn2)CC1	ZINC000819492970	GG	On-Demand	Anodyne	MTOR	31	44
CC(C)(C)OC(=O)N1CCC(n2cc(NC(=O)/C=C/[C@@H]3CCCO3)cn2)CC1	ZINC000819492971	GG	On-Demand	Anodyne	MTOR	31	44
CC(C)(C)OC(=O)N1CCC(n2cc(NC(=O)/C=C\[C@@H]3CCCO3)cn2)CC1	ZINC000819492972	GG	On-Demand	Anodyne	MTOR	31	44
CC(=O)Nc1cccc(CC(=O)N2CCC(c3nccc(C)n3)CC2)c1	ZINC000819492974	FF	On-Demand	Anodyne	HTR1D	25	43
CC(=O)Nc1cccc(CC(=O)N2CCC(c3nccc(C)n3)CC2)c1	ZINC000819492974	FF	On-Demand	Anodyne	HTR1B	20	41
CC(=O)Nc1cccc(CC(=O)N2CCC(c3nccc(C)n3)CC2)c1	ZINC000819492974	FF	On-Demand	Anodyne	P2RY14	45	33
COc1ccc2[nH]c(NC(=O)c3ccc(F)c(S(=O)(=O)NC(C)(C)C)c3)cc2c1	ZINC000819492988	HH	On-Demand	Anodyne	TUBB2B	34	41
COc1ccc2[nH]c(NC(=O)c3ccc(F)c(S(=O)(=O)NC(C)(C)C)c3)cc2c1	ZINC000819492988	HH	On-Demand	Anodyne	TAAR1	20	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NOCc1ccc(F)cc1	ZINC000819493017	DE	On-Demand	Anodyne	PAPA1_CARPA	20	41
O=C(Nc1cnn[nH]1)c1ccccc1Nc1ccc(OC(F)F)cc1	ZINC000819493031	EG	On-Demand	Anodyne	AKR1C3	20	43
O=C(Nc1cnn[nH]1)c1ccccc1Nc1ccc(OC(F)F)cc1	ZINC000819493031	EG	On-Demand	Anodyne	AKR1C2	51	43
COc1ccc2[nH]c(NC(=O)/C=C/c3cnc(C)s3)cc2c1	ZINC000819493049	DH	On-Demand	Anodyne	TUBB2B	40	41
C[C@@H]1CCCC[C@H]1C(=O)Nc1cnn(C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819493052	GI	On-Demand	Anodyne	MTOR	33	44
C[C@@H]1CCCC[C@H]1C(=O)Nc1cnn(C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819493052	GI	On-Demand	Anodyne	GPR119	49	41
COc1ccc2[nH]c(NC(=O)/C=C\c3cnc(C)s3)cc2c1	ZINC000819493053	DH	On-Demand	Anodyne	TUBB2B	40	41
C[C@@H]1CCCC[C@@H]1C(=O)Nc1cnn(C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819493057	GI	On-Demand	Anodyne	MTOR	33	44
C[C@@H]1CCCC[C@@H]1C(=O)Nc1cnn(C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819493057	GI	On-Demand	Anodyne	GPR119	49	41
CNC(=O)[C@@H](O)CNC(=O)C[C@H](C)c1ccc(OC)cc1	ZINC000819493069	CC	On-Demand	Anodyne	MMP1	24	40
CNC(=O)[C@@H](O)CNC(=O)C[C@@H](C)c1ccc(OC)cc1	ZINC000819493072	CC	On-Demand	Anodyne	MMP1	24	40
CNC(=O)[C@@H](O)CNC(=O)c1ccc(COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819493089	GE	On-Demand	Anodyne	GCGR	24	48
CNC(=O)[C@@H](O)CNC(=O)c1ccc(COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819493089	GE	On-Demand	Anodyne	TRPV1	25	40
CNC(=O)[C@@H](O)CNC(=O)c1ccc(COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819493089	GE	On-Demand	Anodyne	CACNA1B	20	40
CNC(=O)[C@@H](O)CNC(=O)c1ccc(COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819493089	GE	On-Demand	Anodyne	PPARD	18	45
CNC(=O)[C@@H](O)CNC(=O)c1ccc(COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819493089	GE	On-Demand	Anodyne	SLC6A5	35	44
CNC(=O)[C@@H](O)CNC(=O)c1ccc(COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819493089	GE	On-Demand	Anodyne	MT-ND1	25	42
CNC(=O)[C@@H](O)CNC(=O)c1ccc(COc2ccc(C(C)(C)C)cc2)cc1	ZINC000819493089	GE	On-Demand	Anodyne	GIPR	51	36
CCC(=CC(=O)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1)CC	ZINC000819493093	EC	On-Demand	Anodyne	F13A1	41	38
CC(C)(C)OC(=O)NCC(=O)NCC(=O)Nc1cccc2cnncc12	ZINC000819493115	FD	On-Demand	Anodyne	TRPV1	15	45
CNC(=O)[C@@H](O)CNC(=O)c1cc(NC(=O)NC(C)(C)C)ccc1Cl	ZINC000819493144	FD	On-Demand	Anodyne	IMDH_CRYPV	45	48
CNC(=O)[C@@H](O)CNC(=O)c1c(-c2ccc(C(F)(F)F)cc2)noc1C	ZINC000819493172	FD	On-Demand	Anodyne	TRPV1	17	40
COc1ccc2[nH]c(NC(=O)[C@@H](F)c3ccc(C(F)(F)F)cc3)cc2c1	ZINC000819493175	FJ	On-Demand	Anodyne	TUBB2B	34	40
COc1ccc2[nH]c(NC(=O)[C@H](F)c3ccc(C(F)(F)F)cc3)cc2c1	ZINC000819493176	FJ	On-Demand	Anodyne	TUBB2B	34	40
COCc1cc(Cl)ccc1NC[C@H](O)c1ccccc1	ZINC000819493211	CH	On-Demand	Anodyne	ADRB3	41	35
COCc1cc(Cl)ccc1NC[C@@H](O)c1ccccc1	ZINC000819493212	CH	On-Demand	Anodyne	ADRB3	41	35
COCc1cc(Cl)ccc1NC[C@@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819493241	GH	On-Demand	Anodyne	GPR119	48	49
COCc1cc(Cl)ccc1NC[C@H](O)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000819493242	GH	On-Demand	Anodyne	GPR119	48	49
COc1cccc([S@@](=O)CC(=O)NC23CCC(CC2)C3)c1	ZINC000819493275	DE	On-Demand	Anodyne	EPHX2	15	44
O=C(Nc1cnn[nH]1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	ZINC000819493343	DC	On-Demand	Bother	TAAR1	21	40
C[C@@H]1CC[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@H]1C	ZINC000819493369	FH	On-Demand	Mild	PAPA1_CARPA	39	48
C[C@@H]1CC[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C[C@H]1C	ZINC000819493372	FH	On-Demand	Mild	PAPA1_CARPA	39	48
C[C@@H]1CCCC[C@H]1C(=O)NOCc1ccc(F)cc1	ZINC000819493387	CG	On-Demand	Anodyne	NAAA	31	41
C[C@@H]1CCCC[C@@H]1C(=O)NOCc1ccc(F)cc1	ZINC000819493390	CG	On-Demand	Anodyne	NAAA	31	41
C=C(C)C(C)(C)C(=O)Nc1cnn(C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819493411	GH	On-Demand	Mild	MTOR	30	43
C=C(C)C(C)(C)C(=O)Nc1cnn(C2CCN(C(=O)OC(C)(C)C)CC2)c1	ZINC000819493411	GH	On-Demand	Mild	GPR119	45	41
CNC(=O)[C@@H](O)CNC(=O)c1ccc(-c2csc(C)n2)cc1	ZINC000819493474	DC	On-Demand	Anodyne	GCGR	15	41
CNC(=O)[C@@H](O)CNC(=O)c1ccc(-c2csc(C)n2)cc1	ZINC000819493474	DC	On-Demand	Anodyne	GIPR	47	41
CNC(=O)[C@@H](O)CNC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1	ZINC000819493488	FD	On-Demand	Mild	DRD4	45	36
CNC(=O)[C@@H](O)CNC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1	ZINC000819493488	FD	On-Demand	Mild	CASR	20	40
CNC(=O)[C@@H](O)CNC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1	ZINC000819493488	FD	On-Demand	Mild	EZH2	29	42
COc1ccc2[nH]c(NC(=O)COc3ccccc3C=O)cc2c1	ZINC000819493505	DG	On-Demand	Anodyne	TUBB2B	42	45
CNC(=O)[C@@H](O)CNC(=O)C[C@@H](C)CC(C)C	ZINC000819493507	BC	On-Demand	Anodyne	PGA	41	35
CNC(=O)[C@@H](O)CNC(=O)C[C@H](C)CC(C)C	ZINC000819493509	BC	On-Demand	Anodyne	PGA	41	35
Cc1nnc(NC(=O)CC[C@@H](CC2CCCCC2)NC(=O)OC(C)(C)C)n1C	ZINC000819493530	GH	On-Demand	Anodyne	REN	56	38
Cc1nnc(NC(=O)CC[C@H](CC2CCCCC2)NC(=O)OC(C)(C)C)n1C	ZINC000819493531	GH	On-Demand	Anodyne	REN	56	38
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819493534	DF	On-Demand	Anodyne	CACNA1I	54	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819493534	DF	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819493535	DF	On-Demand	Anodyne	CACNA1I	54	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)C(F)=C2CCC2)C1	ZINC000819493535	DF	On-Demand	Anodyne	GPR119	31	40
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819493559	DG	On-Demand	Anodyne	CACNA1I	47	34
C[C@@H]1CCCC[C@@H]1C(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819493560	DG	On-Demand	Anodyne	CACNA1I	47	34
C[C@@H]1CCCC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819493561	DG	On-Demand	Anodyne	CACNA1I	47	34
C[C@@H]1CCCC[C@H]1C(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819493562	DG	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@H](NC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819493608	GD	On-Demand	Mild	GPR119	26	41
CC(C)(C)OC(=O)N1C[C@@H](NC(=O)Cc2ccc(-n3cnnc3)cc2)[C@H](C#N)C1	ZINC000819493611	GD	On-Demand	Mild	GPR119	26	41
CC(C)(C)OC(=O)N1C[C@H](C#N)[C@@H](NC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819493612	GD	On-Demand	Mild	GPR119	26	41
CC(C)(C)OC(=O)N1C[C@@H](C#N)[C@@H](NC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819493613	GD	On-Demand	Mild	GPR119	26	41
C=C(C)C(C)(C)C(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819493646	DF	On-Demand	Mild	CACNA1I	50	34
C=C(C)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000819493648	DF	On-Demand	Mild	CACNA1I	50	34
CNC(=O)[C@@H](O)CNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	ZINC000819493692	GB	On-Demand	Anodyne	FKBP1A	18	41
CNC(=O)[C@@H](O)CNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	ZINC000819493692	GB	On-Demand	Anodyne	TMPRSS11D	55	35
Cc1csc([C@H](C)CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819493694	GG	On-Demand	Mild	PAPA1_CARPA	44	46
Cc1csc([C@H](C)CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n1	ZINC000819493695	GG	On-Demand	Mild	PAPA1_CARPA	44	46
CNC(=O)[C@@H](O)CNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	ZINC000819493696	GB	On-Demand	Anodyne	FKBP1A	18	41
CNC(=O)[C@@H](O)CNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	ZINC000819493696	GB	On-Demand	Anodyne	TMPRSS11D	55	35
C[C@H](C(=O)Nc1cnn[nH]1)N1CCC(Cc2ccccc2)CC1	ZINC000819493703	DE	On-Demand	Anodyne	GRIN2B	75	55
C[C@H](C(=O)Nc1cnn[nH]1)N1CCC(Cc2ccccc2)CC1	ZINC000819493703	DE	On-Demand	Anodyne	SIGMAR1	25	46
C[C@H](C(=O)Nc1cnn[nH]1)N1CCC(Cc2ccccc2)CC1	ZINC000819493703	DE	On-Demand	Anodyne	CCR3	64	40
C[C@H](C(=O)Nc1cnn[nH]1)N1CCC(Cc2ccccc2)CC1	ZINC000819493703	DE	On-Demand	Anodyne	GRIN2C	25	46
COc1ccc2[nH]c(NC(=O)c3ccc(-n4cnc5ccccc54)nc3)cc2c1	ZINC000819493738	GI	On-Demand	Anodyne	PLK1	24	40
COc1ccc2[nH]c(NC(=O)[C@@H](Br)C(C)(C)C)cc2c1	ZINC000819493741	EH	On-Demand	Reactive	TUBB2B	45	44
COc1ccc2[nH]c(NC(=O)[C@H](Br)C(C)(C)C)cc2c1	ZINC000819493743	EH	On-Demand	Reactive	TUBB2B	45	44
CCO/C=C(/C#N)C(=O)Nc1cc2cc(OC)ccc2[nH]1	ZINC000819493754	CF	On-Demand	Reactive	TUBB2B	35	42
CCO/C=C(\C#N)C(=O)Nc1cc2cc(OC)ccc2[nH]1	ZINC000819493755	CF	On-Demand	Reactive	TUBB2B	35	42
CNC(=O)[C@@H](O)CNC(=O)[C@H](C)Cc1ccc(Cl)cc1Cl	ZINC000819493760	ED	On-Demand	Anodyne	MC4R	46	38
CNC(=O)[C@@H](O)CNC(=O)[C@@H](C)Cc1ccc(Cl)cc1Cl	ZINC000819493763	ED	On-Demand	Anodyne	MC4R	46	38
O=C(/C=C\c1cccc(O)c1)N[C@H]1CCC[C@H]1NC(=O)/C=C/c1cccc(O)c1	ZINC000819493771	GF	On-Demand	Anodyne	HDAC8	46	39
O=C(/C=C\c1cccc(O)c1)N[C@H]1CCC[C@H]1NC(=O)/C=C/c1cccc(O)c1	ZINC000819493771	GF	On-Demand	Anodyne	MMP2	17	56
O=C(/C=C\c1cccc(O)c1)N[C@H]1CCC[C@H]1NC(=O)/C=C/c1cccc(O)c1	ZINC000819493771	GF	On-Demand	Anodyne	MMP9	16	56
O=C(/C=C/c1cccc(O)c1)N[C@H]1CCC[C@H]1NC(=O)/C=C/c1cccc(O)c1	ZINC000819493772	GF	On-Demand	Anodyne	HDAC8	46	39
O=C(/C=C/c1cccc(O)c1)N[C@H]1CCC[C@H]1NC(=O)/C=C/c1cccc(O)c1	ZINC000819493772	GF	On-Demand	Anodyne	MMP2	17	56
O=C(/C=C/c1cccc(O)c1)N[C@H]1CCC[C@H]1NC(=O)/C=C/c1cccc(O)c1	ZINC000819493772	GF	On-Demand	Anodyne	MMP9	16	56
O=C(/C=C\c1cccc(O)c1)N[C@H]1CCC[C@H]1NC(=O)/C=C\c1cccc(O)c1	ZINC000819493773	GF	On-Demand	Anodyne	HDAC8	46	39
O=C(/C=C\c1cccc(O)c1)N[C@H]1CCC[C@H]1NC(=O)/C=C\c1cccc(O)c1	ZINC000819493773	GF	On-Demand	Anodyne	MMP2	17	56
O=C(/C=C\c1cccc(O)c1)N[C@H]1CCC[C@H]1NC(=O)/C=C\c1cccc(O)c1	ZINC000819493773	GF	On-Demand	Anodyne	MMP9	16	56
O=C(/C=C\c1cccc(O)c1)N[C@@H]1CCC[C@@H]1NC(=O)/C=C/c1cccc(O)c1	ZINC000819493774	GF	On-Demand	Anodyne	HDAC8	46	39
O=C(/C=C\c1cccc(O)c1)N[C@@H]1CCC[C@@H]1NC(=O)/C=C/c1cccc(O)c1	ZINC000819493774	GF	On-Demand	Anodyne	MMP2	17	56
O=C(/C=C\c1cccc(O)c1)N[C@@H]1CCC[C@@H]1NC(=O)/C=C/c1cccc(O)c1	ZINC000819493774	GF	On-Demand	Anodyne	MMP9	16	56
CNC(=O)[C@@H](O)CNC(=O)CCCc1cccc(C(F)(F)F)c1	ZINC000819493781	ED	On-Demand	Anodyne	PTGFR	33	43
CNC(=O)[C@@H](O)CNC(=O)CCCc1cccc(C(F)(F)F)c1	ZINC000819493781	ED	On-Demand	Anodyne	HCRTR1	16	41
CNC(=O)[C@@H](O)CNC(=O)CCCc1cccc(C(F)(F)F)c1	ZINC000819493781	ED	On-Demand	Anodyne	CCR2	42	40
CNC(=O)[C@@H](O)CNC(=O)CCCc1cccc(C(F)(F)F)c1	ZINC000819493781	ED	On-Demand	Anodyne	HCRTR2	18	41
CNC(=O)[C@@H](O)CNC(=O)CCCc1cccc(C(F)(F)F)c1	ZINC000819493781	ED	On-Demand	Anodyne	PDS	42	39
N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2cnn[nH]2)c1	ZINC000819493788	EG	On-Demand	Mild	DRD4	43	35
N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2cnn[nH]2)c1	ZINC000819493788	EG	On-Demand	Mild	TAAR1	30	42
N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2cnn[nH]2)c1	ZINC000819493788	EG	On-Demand	Mild	EZH2	35	44
N#Cc1c(Cl)cccc1Oc1cccc(C(=O)Nc2cnn[nH]2)c1	ZINC000819493788	EG	On-Demand	Mild	KCNK3	43	37
COc1ccc2[nH]c(NC(=O)CCN3CCN(C(=O)OC(C)(C)C)CC3)cc2c1	ZINC000819493795	HG	On-Demand	Anodyne	HTR1A	21	43
COc1ccc2[nH]c(NC(=O)CCN3CCN(C(=O)OC(C)(C)C)CC3)cc2c1	ZINC000819493795	HG	On-Demand	Anodyne	DRD4	43	33
O=C(/C=C/c1cccc(O)c1)Nc1cccc2cnncc12	ZINC000819493804	CF	On-Demand	Anodyne	TRPV1	20	57
O=C(/C=C/c1cccc(O)c1)Nc1cccc2cnncc12	ZINC000819493804	CF	On-Demand	Anodyne	MMP2	18	64
O=C(/C=C/c1cccc(O)c1)Nc1cccc2cnncc12	ZINC000819493804	CF	On-Demand	Anodyne	MMP9	18	64
O=C(/C=C\c1cccc(O)c1)Nc1cccc2cnncc12	ZINC000819493805	CF	On-Demand	Anodyne	TRPV1	20	57
O=C(/C=C\c1cccc(O)c1)Nc1cccc2cnncc12	ZINC000819493805	CF	On-Demand	Anodyne	MMP2	18	64
O=C(/C=C\c1cccc(O)c1)Nc1cccc2cnncc12	ZINC000819493805	CF	On-Demand	Anodyne	MMP9	18	64
CNC(=O)[C@@H](O)CNC(=O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1	ZINC000819493806	GB	On-Demand	Anodyne	MMP13	21	41
CNC(=O)[C@@H](O)CNC(=O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1	ZINC000819493806	GB	On-Demand	Anodyne	MMP2	26	41
CNC(=O)[C@@H](O)CNC(=O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1	ZINC000819493806	GB	On-Demand	Anodyne	MMP14	19	45
O=C(CCn1ccnc1)Nc1cnn[nH]1	ZINC000819493808	BC	On-Demand	Anodyne	TBXAS1	60	42
CNC(=O)[C@@H](O)CNC(=O)c1ccc2nc(-c3ccccc3)oc2c1	ZINC000819493817	ED	On-Demand	Anodyne	F3	44	35
CNC(=O)[C@@H](O)CNC(=O)c1ccc2nc(-c3ccccc3)oc2c1	ZINC000819493817	ED	On-Demand	Anodyne	IMDH_CRYPV	33	40
CNC(=O)[C@@H](O)CNC(=O)c1ccc(OC2CCC2)cc1	ZINC000819493823	CC	On-Demand	Anodyne	EPHX2	21	42
CNC(=O)[C@@H](O)CNC(=O)c1ccc(OC2CCC2)cc1	ZINC000819493823	CC	On-Demand	Anodyne	GIPR	41	36
CNC(=O)[C@@H](O)CNC(=O)c1cc(F)cc(Cl)c1	ZINC000819493825	CC	On-Demand	Anodyne	CACNA1I	58	38
C[C@@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819493826	GJ	On-Demand	Mild	PLG	16	40
C[C@@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819493826	GJ	On-Demand	Mild	GHRHR	40	32
C[C@@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819493826	GJ	On-Demand	Mild	CELA1	17	40
C[C@@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819493826	GJ	On-Demand	Mild	PAPA1_CARPA	37	41
C[C@@H]1CCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819493826	GJ	On-Demand	Mild	TRY1_BOVIN	16	40
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)Cc2nsc3ccccc23)C1	ZINC000819493898	GG	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)Cc2nsc3ccccc23)C1	ZINC000819493898	GG	On-Demand	Anodyne	CACNA1I	63	39
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)Cc2nsc3ccccc23)C1	ZINC000819493898	GG	On-Demand	Anodyne	CCR8	32	40
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)Cc2nsc3ccccc23)C1	ZINC000819493898	GG	On-Demand	Anodyne	GPR119	40	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)Cc2nsc3ccccc23)C1	ZINC000819493900	GG	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)Cc2nsc3ccccc23)C1	ZINC000819493900	GG	On-Demand	Anodyne	CACNA1I	63	39
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)Cc2nsc3ccccc23)C1	ZINC000819493900	GG	On-Demand	Anodyne	CCR8	32	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)Cc2nsc3ccccc23)C1	ZINC000819493900	GG	On-Demand	Anodyne	GPR119	40	44
C=CCCn1cc(C(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819493914	ED	On-Demand	Mild	CACNA1I	62	36
C=CCCn1cc(C(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000819493915	ED	On-Demand	Mild	CACNA1I	62	36
CC(=O)c1cc(C(=O)Nc2cnn[nH]2)ccc1C	ZINC000819493919	BD	On-Demand	Anodyne	KCNK3	52	36
C[C@@](O)(CC(=O)Nc1cccc2cnncc12)c1ccccc1	ZINC000819493920	DF	On-Demand	Anodyne	TRPV1	27	49
Cc1ccc(NC(=O)CSc2ccccc2C(=O)Nc2cnn[nH]2)cc1	ZINC000819493953	FG	On-Demand	Anodyne	AGTR1	18	40
Cc1ccc(NC(=O)CSc2ccccc2C(=O)Nc2cnn[nH]2)cc1	ZINC000819493953	FG	On-Demand	Anodyne	NR2E3	52	33
Cc1ccc(NC(=O)CSc2ccccc2C(=O)Nc2cnn[nH]2)cc1	ZINC000819493953	FG	On-Demand	Anodyne	ENPP1	56	32
O=C(/C=C/[C@@H]1CCCO1)NCCCNc1cccc(F)c1	ZINC000819493958	CE	On-Demand	Anodyne	TBK1	20	42
O=C(/C=C\[C@@H]1CCCO1)NCCCNc1cccc(F)c1	ZINC000819493960	CE	On-Demand	Anodyne	TBK1	20	42
O=C(/C=C/[C@H]1CCCO1)NCCCNc1cccc(F)c1	ZINC000819493962	CE	On-Demand	Anodyne	TBK1	20	42
O=C(/C=C\[C@H]1CCCO1)NCCCNc1cccc(F)c1	ZINC000819493963	CE	On-Demand	Anodyne	TBK1	20	42
CNC(=O)[C@@H](O)CNC(=O)CCCCCNC(=O)NC1CCCCC1	ZINC000819493969	FC	On-Demand	Anodyne	EPHX2	26	57
C[C@H](NC(=O)/C=C\c1cccc(O)c1)[C@H](C)NC(=O)/C=C\c1cccc(O)c1	ZINC000819493974	GF	On-Demand	Anodyne	KCNQ2	48	34
C[C@H](NC(=O)/C=C\c1cccc(O)c1)[C@H](C)NC(=O)/C=C\c1cccc(O)c1	ZINC000819493974	GF	On-Demand	Anodyne	HDAC8	53	40
C[C@H](NC(=O)/C=C\c1cccc(O)c1)[C@H](C)NC(=O)/C=C\c1cccc(O)c1	ZINC000819493974	GF	On-Demand	Anodyne	MMP2	18	60
C[C@H](NC(=O)/C=C\c1cccc(O)c1)[C@H](C)NC(=O)/C=C\c1cccc(O)c1	ZINC000819493974	GF	On-Demand	Anodyne	NR1H4	42	36
C[C@H](NC(=O)/C=C\c1cccc(O)c1)[C@H](C)NC(=O)/C=C\c1cccc(O)c1	ZINC000819493974	GF	On-Demand	Anodyne	HDAC1	29	40
C[C@H](NC(=O)/C=C\c1cccc(O)c1)[C@H](C)NC(=O)/C=C\c1cccc(O)c1	ZINC000819493974	GF	On-Demand	Anodyne	HDAC2	15	48
C[C@H](NC(=O)/C=C\c1cccc(O)c1)[C@H](C)NC(=O)/C=C\c1cccc(O)c1	ZINC000819493974	GF	On-Demand	Anodyne	HDAC6	30	42
C[C@H](NC(=O)/C=C\c1cccc(O)c1)[C@H](C)NC(=O)/C=C\c1cccc(O)c1	ZINC000819493974	GF	On-Demand	Anodyne	MMP9	18	60
C[C@H](NC(=O)/C=C\c1cccc(O)c1)[C@H](C)NC(=O)/C=C\c1cccc(O)c1	ZINC000819493974	GF	On-Demand	Anodyne	AKR1B10	15	40
C[C@H](NC(=O)/C=C/c1cccc(O)c1)[C@@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493976	GF	On-Demand	Anodyne	KCNQ2	48	34
C[C@H](NC(=O)/C=C/c1cccc(O)c1)[C@@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493976	GF	On-Demand	Anodyne	HDAC8	53	40
C[C@H](NC(=O)/C=C/c1cccc(O)c1)[C@@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493976	GF	On-Demand	Anodyne	MMP2	18	60
C[C@H](NC(=O)/C=C/c1cccc(O)c1)[C@@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493976	GF	On-Demand	Anodyne	NR1H4	42	36
C[C@H](NC(=O)/C=C/c1cccc(O)c1)[C@@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493976	GF	On-Demand	Anodyne	HDAC1	29	40
C[C@H](NC(=O)/C=C/c1cccc(O)c1)[C@@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493976	GF	On-Demand	Anodyne	HDAC2	15	48
C[C@H](NC(=O)/C=C/c1cccc(O)c1)[C@@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493976	GF	On-Demand	Anodyne	HDAC6	30	42
C[C@H](NC(=O)/C=C/c1cccc(O)c1)[C@@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493976	GF	On-Demand	Anodyne	MMP9	18	60
C[C@H](NC(=O)/C=C/c1cccc(O)c1)[C@@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493976	GF	On-Demand	Anodyne	AKR1B10	15	40
C[C@H](NC(=O)/C=C/c1cccc(O)c1)[C@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493978	GF	On-Demand	Anodyne	KCNQ2	48	34
C[C@H](NC(=O)/C=C/c1cccc(O)c1)[C@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493978	GF	On-Demand	Anodyne	HDAC8	53	40
C[C@H](NC(=O)/C=C/c1cccc(O)c1)[C@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493978	GF	On-Demand	Anodyne	MMP2	18	60
C[C@H](NC(=O)/C=C/c1cccc(O)c1)[C@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493978	GF	On-Demand	Anodyne	NR1H4	42	36
C[C@H](NC(=O)/C=C/c1cccc(O)c1)[C@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493978	GF	On-Demand	Anodyne	HDAC1	29	40
C[C@H](NC(=O)/C=C/c1cccc(O)c1)[C@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493978	GF	On-Demand	Anodyne	HDAC2	15	48
C[C@H](NC(=O)/C=C/c1cccc(O)c1)[C@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493978	GF	On-Demand	Anodyne	HDAC6	30	42
C[C@H](NC(=O)/C=C/c1cccc(O)c1)[C@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493978	GF	On-Demand	Anodyne	MMP9	18	60
C[C@H](NC(=O)/C=C/c1cccc(O)c1)[C@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493978	GF	On-Demand	Anodyne	AKR1B10	15	40
C[C@H](NC(=O)/C=C\c1cccc(O)c1)[C@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493980	GF	On-Demand	Anodyne	KCNQ2	48	34
C[C@H](NC(=O)/C=C\c1cccc(O)c1)[C@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493980	GF	On-Demand	Anodyne	HDAC8	53	40
C[C@H](NC(=O)/C=C\c1cccc(O)c1)[C@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493980	GF	On-Demand	Anodyne	MMP2	18	60
C[C@H](NC(=O)/C=C\c1cccc(O)c1)[C@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493980	GF	On-Demand	Anodyne	NR1H4	42	36
C[C@H](NC(=O)/C=C\c1cccc(O)c1)[C@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493980	GF	On-Demand	Anodyne	HDAC1	29	40
C[C@H](NC(=O)/C=C\c1cccc(O)c1)[C@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493980	GF	On-Demand	Anodyne	HDAC2	15	48
C[C@H](NC(=O)/C=C\c1cccc(O)c1)[C@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493980	GF	On-Demand	Anodyne	HDAC6	30	42
C[C@H](NC(=O)/C=C\c1cccc(O)c1)[C@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493980	GF	On-Demand	Anodyne	MMP9	18	60
C[C@H](NC(=O)/C=C\c1cccc(O)c1)[C@H](C)NC(=O)/C=C/c1cccc(O)c1	ZINC000819493980	GF	On-Demand	Anodyne	AKR1B10	15	40
COc1cc(Br)ccc1C(=O)Nc1cnn[nH]1	ZINC000819493982	CD	On-Demand	Anodyne	LUCI_LUCLA	17	47
COc1cc(Br)ccc1C(=O)Nc1cnn[nH]1	ZINC000819493982	CD	On-Demand	Anodyne	KCNK3	33	40
COc1cc(Br)ccc1C(=O)Nc1cnn[nH]1	ZINC000819493982	CD	On-Demand	Anodyne	KCNK9	25	40
C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cnn[nH]3)cc2[N+](=O)[O-])C1	ZINC000819493991	EE	On-Demand	Bother	TAAR1	37	51
COc1ccc2[nH]c(NC(=O)C/N=C3/NS(=O)(=O)c4ccccc43)cc2c1	ZINC000819493995	GD	On-Demand	Mild	TUBB2B	32	40
O=C(c1ccc(-n2cnc3ccccc32)nc1)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1	ZINC000819494000	ID	On-Demand	Anodyne	HPGD	43	38
COc1ccc2[nH]c(NC(=O)[C@@H]3CC(c4c(F)cccc4F)=NO3)cc2c1	ZINC000819494002	FH	On-Demand	Anodyne	TUBB2B	38	42
COc1ccc2[nH]c(NC(=O)[C@H]3CC(c4c(F)cccc4F)=NO3)cc2c1	ZINC000819494004	FH	On-Demand	Anodyne	TUBB2B	38	42
CC(=O)Nc1cccc(CC(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819494018	GF	On-Demand	Anodyne	CCR3	52	42
CC(=O)Nc1cccc(CC(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819494018	GF	On-Demand	Anodyne	CACNA1I	78	42
CC(=O)Nc1cccc(CC(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819494018	GF	On-Demand	Anodyne	GPR119	42	52
CC(=O)Nc1cccc(CC(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819494019	GF	On-Demand	Anodyne	CCR3	52	42
CC(=O)Nc1cccc(CC(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819494019	GF	On-Demand	Anodyne	CACNA1I	78	42
CC(=O)Nc1cccc(CC(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819494019	GF	On-Demand	Anodyne	GPR119	42	52
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC/C=C\CNC(=O)OC(C)(C)C	ZINC000819494020	GH	On-Demand	Anodyne	PAPA1_CARPA	26	40
CC(C)c1nn(-c2ccccc2)cc1C(=O)NC/C=C/CNC(=O)OC(C)(C)C	ZINC000819494021	GH	On-Demand	Anodyne	PAPA1_CARPA	26	40
O=C(NCCCNc1cccc(F)c1)C(F)=C1CCC1	ZINC000819494040	CG	On-Demand	Anodyne	TBK1	17	42
CNC(=O)[C@@H](O)CNC(=O)c1ccc(Oc2cccc(Cl)c2Cl)cc1	ZINC000819494041	GF	On-Demand	Anodyne	DRD3	16	41
CNC(=O)[C@@H](O)CNC(=O)c1ccc(C)c(C(C)=O)c1	ZINC000819494060	CC	On-Demand	Anodyne	F3	83	37
O=C(C(F)=C1CCC1)N1CC[C@H](Oc2cccc(F)c2)C1	ZINC000819494075	CG	On-Demand	Anodyne	MLNR	18	46
O=C(C(F)=C1CCC1)N1CC[C@@H](Oc2cccc(F)c2)C1	ZINC000819494076	CG	On-Demand	Anodyne	MLNR	18	46
O=C(CN1CCN(Cc2ccccc2)CC1)Nc1cnn[nH]1	ZINC000819494086	DC	On-Demand	Anodyne	DRD2	23	42
O=C(CN1CCN(Cc2ccccc2)CC1)Nc1cnn[nH]1	ZINC000819494086	DC	On-Demand	Anodyne	DRD4	68	42
O=C(CN1CCN(Cc2ccccc2)CC1)Nc1cnn[nH]1	ZINC000819494086	DC	On-Demand	Anodyne	ACHE	40	50
O=C(CN1CCN(Cc2ccccc2)CC1)Nc1cnn[nH]1	ZINC000819494086	DC	On-Demand	Anodyne	SIGMAR1	61	46
O=C(CN1CCN(Cc2ccccc2)CC1)Nc1cnn[nH]1	ZINC000819494086	DC	On-Demand	Anodyne	FAAH	28	42
O=C(CN1CCN(Cc2ccccc2)CC1)Nc1cnn[nH]1	ZINC000819494086	DC	On-Demand	Anodyne	NPFFR1	41	36
O=C(CN1CCN(Cc2ccccc2)CC1)Nc1cnn[nH]1	ZINC000819494086	DC	On-Demand	Anodyne	NOD2	42	37
O=C(CN1CCN(Cc2ccccc2)CC1)Nc1cnn[nH]1	ZINC000819494086	DC	On-Demand	Anodyne	SLC27A1	43	42
CNC(=O)[C@@H](O)CNC(=O)[C@@H](C)c1cccc(OC)c1	ZINC000819494094	CC	On-Demand	Anodyne	DRD4	40	32
CNC(=O)[C@@H](O)CNC(=O)[C@@H](C)c1cccc(OC)c1	ZINC000819494094	CC	On-Demand	Anodyne	NQO2	15	40
CNC(=O)[C@@H](O)CNC(=O)[C@@H](C)c1cccc(OC)c1	ZINC000819494094	CC	On-Demand	Anodyne	MTNR1A	54	46
CNC(=O)[C@@H](O)CNC(=O)[C@@H](C)c1cccc(OC)c1	ZINC000819494094	CC	On-Demand	Anodyne	MTNR1B	55	46
CNC(=O)[C@@H](O)CNC(=O)[C@@H](C)c1cccc(OC)c1	ZINC000819494094	CC	On-Demand	Anodyne	AKR1C3	17	41
CNC(=O)[C@@H](O)CNC(=O)[C@H](C)c1cccc(OC)c1	ZINC000819494096	CC	On-Demand	Anodyne	DRD4	40	32
CNC(=O)[C@@H](O)CNC(=O)[C@H](C)c1cccc(OC)c1	ZINC000819494096	CC	On-Demand	Anodyne	NQO2	15	40
CNC(=O)[C@@H](O)CNC(=O)[C@H](C)c1cccc(OC)c1	ZINC000819494096	CC	On-Demand	Anodyne	MTNR1A	54	46
CNC(=O)[C@@H](O)CNC(=O)[C@H](C)c1cccc(OC)c1	ZINC000819494096	CC	On-Demand	Anodyne	MTNR1B	55	46
CNC(=O)[C@@H](O)CNC(=O)[C@H](C)c1cccc(OC)c1	ZINC000819494096	CC	On-Demand	Anodyne	AKR1C3	17	41
CNC(=O)[C@@H](O)CNC(=O)c1cncc(-c2ccc(OC)cc2)c1	ZINC000819494097	EC	On-Demand	Anodyne	CYP11B1	15	53
CNC(=O)[C@@H](O)CNC(=O)c1cncc(-c2ccc(OC)cc2)c1	ZINC000819494097	EC	On-Demand	Anodyne	SCN2A	23	44
CNC(=O)[C@@H](O)CNC(=O)c1cncc(-c2ccc(OC)cc2)c1	ZINC000819494097	EC	On-Demand	Anodyne	CYP11B2	28	53
CNC(=O)[C@@H](O)CNC(=O)c1cncc(-c2ccc(OC)cc2)c1	ZINC000819494097	EC	On-Demand	Anodyne	SCN10A	67	44
CNC(=O)[C@@H](O)CNC(=O)c1cncc(-c2ccc(OC)cc2)c1	ZINC000819494097	EC	On-Demand	Anodyne	CHEK1	41	32
O=C(Nc1cnn[nH]1)[C@@H](O)Cc1ccccc1	ZINC000819494101	BC	On-Demand	Anodyne	MME	71	37
O=C(Nc1cnn[nH]1)[C@@H](O)Cc1ccccc1	ZINC000819494101	BC	On-Demand	Anodyne	ANPEP	68	34
O=C(Nc1cnn[nH]1)[C@@H](O)Cc1ccccc1	ZINC000819494101	BC	On-Demand	Anodyne	CPA1	51	36
COc1ccc2[nH]c(NC(=O)c3ccc(F)c(S(=O)(=O)N4CCCC4)c3)cc2c1	ZINC000819494122	HG	On-Demand	Anodyne	LPL	26	40
COc1ccc2[nH]c(NC(=O)c3ccc(F)c(S(=O)(=O)N4CCCC4)c3)cc2c1	ZINC000819494122	HG	On-Demand	Anodyne	CPT1A	64	36
COc1ccc2[nH]c(NC(=O)c3ccc(F)c(S(=O)(=O)N4CCCC4)c3)cc2c1	ZINC000819494122	HG	On-Demand	Anodyne	CPT2	46	34
COc1ccc2[nH]c(NC(=O)c3ccc(F)c(S(=O)(=O)N4CCCC4)c3)cc2c1	ZINC000819494122	HG	On-Demand	Anodyne	CPT1B	54	35
COc1ccc2[nH]c(NC(=O)c3ccc(F)c(S(=O)(=O)N4CCCC4)c3)cc2c1	ZINC000819494122	HG	On-Demand	Anodyne	TAAR1	25	64
CNC(=O)[C@@H](O)CNC(=O)C[C@@H](C)Cc1ccc(Cl)cc1	ZINC000819494123	DD	On-Demand	Anodyne	AVPR1A	21	45
CNC(=O)[C@@H](O)CNC(=O)C[C@H](C)Cc1ccc(Cl)cc1	ZINC000819494125	DD	On-Demand	Anodyne	AVPR1A	21	45
O=C(Nc1ccccc1C(=O)Nc1cnn[nH]1)c1ccsc1	ZINC000819494227	DE	On-Demand	Anodyne	GRM4	16	45
O=C(Nc1ccccc1C(=O)Nc1cnn[nH]1)c1ccsc1	ZINC000819494227	DE	On-Demand	Anodyne	KCNK3	19	46
CCC(=CC(=O)Nc1cc2cc(OC)ccc2[nH]1)CC	ZINC000819494228	CH	On-Demand	Anodyne	MTNR1A	48	36
CCC(=CC(=O)Nc1cc2cc(OC)ccc2[nH]1)CC	ZINC000819494228	CH	On-Demand	Anodyne	MTNR1B	41	36
CCC(=CC(=O)Nc1cc2cc(OC)ccc2[nH]1)CC	ZINC000819494228	CH	On-Demand	Anodyne	TUBB2B	48	47
CNC(=O)[C@@H](O)CNC(=O)CCc1cccc(Br)c1	ZINC000819494235	EC	On-Demand	Anodyne	LUXR	15	44
COc1ccc2[nH]c(NC(=O)CSCC(=O)Nc3cc4cc(OC)ccc4[nH]3)cc2c1	ZINC000819494241	IH	On-Demand	Anodyne	MTNR1A	64	36
COc1ccc2[nH]c(NC(=O)CSCC(=O)Nc3cc4cc(OC)ccc4[nH]3)cc2c1	ZINC000819494241	IH	On-Demand	Anodyne	MTNR1B	57	36
COc1ccc2[nH]c(NC(=O)CSCC(=O)Nc3cc4cc(OC)ccc4[nH]3)cc2c1	ZINC000819494241	IH	On-Demand	Anodyne	TUBB2B	47	47
COc1ccc2[nH]c(NC(=O)CSCC(=O)Nc3cc4cc(OC)ccc4[nH]3)cc2c1	ZINC000819494241	IH	On-Demand	Anodyne	ENPP1	71	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3cc(C)cc(C)c3)C1)C2	ZINC000819494276	FG	On-Demand	Anodyne	ADAM10	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](c3cc(C)cc(C)c3)C1)C2	ZINC000819494278	FG	On-Demand	Anodyne	ADAM10	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3cc(C)cc(C)c3)C1)C2	ZINC000819494280	FG	On-Demand	Anodyne	ADAM10	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](c3cc(C)cc(C)c3)C1)C2	ZINC000819494281	FG	On-Demand	Anodyne	ADAM10	17	40
CNC(=O)[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OC)cc1	ZINC000819494286	GD	On-Demand	Bother	TBXA2R	16	44
C/C=C(/C=C/C(=O)Nc1cccc2cnncc12)CC	ZINC000819494290	CG	On-Demand	Anodyne	TRPV1	17	46
C/C=C(/C=C\C(=O)Nc1cccc2cnncc12)CC	ZINC000819494292	CG	On-Demand	Anodyne	TRPV1	17	46
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819494296	GH	On-Demand	Anodyne	CACNA1I	71	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819494296	GH	On-Demand	Anodyne	GPR119	38	47
CCCOc1cccc(CC(=O)NC[C@@H](O)C(=O)NC)c1	ZINC000819494300	CC	On-Demand	Anodyne	HRH2	26	40
CCCOc1cccc(CC(=O)NC[C@@H](O)C(=O)NC)c1	ZINC000819494300	CC	On-Demand	Anodyne	UPP1	55	42
CCCOc1cccc(CC(=O)NC[C@@H](O)C(=O)NC)c1	ZINC000819494300	CC	On-Demand	Anodyne	MTNR1A	43	44
CCCOc1cccc(CC(=O)NC[C@@H](O)C(=O)NC)c1	ZINC000819494300	CC	On-Demand	Anodyne	PLA2G4B	31	45
CCCOc1cccc(CC(=O)NC[C@@H](O)C(=O)NC)c1	ZINC000819494300	CC	On-Demand	Anodyne	PDS	75	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819494301	GH	On-Demand	Anodyne	CACNA1I	71	36
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)CCc2cccc(OC(F)F)c2)C1	ZINC000819494301	GH	On-Demand	Anodyne	GPR119	38	47
CCCOc1cccc(CC(=O)NC[C@H](O)C(=O)NC)c1	ZINC000819494302	CC	On-Demand	Anodyne	HRH2	26	40
CCCOc1cccc(CC(=O)NC[C@H](O)C(=O)NC)c1	ZINC000819494302	CC	On-Demand	Anodyne	UPP1	55	42
CCCOc1cccc(CC(=O)NC[C@H](O)C(=O)NC)c1	ZINC000819494302	CC	On-Demand	Anodyne	MTNR1A	43	44
CCCOc1cccc(CC(=O)NC[C@H](O)C(=O)NC)c1	ZINC000819494302	CC	On-Demand	Anodyne	PLA2G4B	31	45
CCCOc1cccc(CC(=O)NC[C@H](O)C(=O)NC)c1	ZINC000819494302	CC	On-Demand	Anodyne	PDS	75	34
CNC(=O)[C@@H](O)CNC(=O)c1cc(Cl)c(Cl)cc1OC	ZINC000819494313	DC	On-Demand	Anodyne	HTR4	58	44
CNC(=O)[C@@H](O)CNC(=O)c1ccc(C)c(NC(=O)Nc2ccccc2)c1	ZINC000819494315	FD	On-Demand	Anodyne	LPL	45	41
CNC(=O)[C@@H](O)CNC(=O)c1ccc(C)c(NC(=O)Nc2ccccc2)c1	ZINC000819494315	FD	On-Demand	Anodyne	MAPK14	35	41
CNC(=O)[C@@H](O)CNC(=O)c1ccc(C)c(NC(=O)Nc2ccccc2)c1	ZINC000819494315	FD	On-Demand	Anodyne	F3	77	37
CNC(=O)[C@@H](O)CNC(=O)c1ccc(C)c(NC(=O)Nc2ccccc2)c1	ZINC000819494315	FD	On-Demand	Anodyne	LIPG	18	41
CNC(=O)[C@@H](O)CNC(=O)c1ccc(C)c(NC(=O)Nc2ccccc2)c1	ZINC000819494315	FD	On-Demand	Anodyne	KCNK3	46	35
COc1ccc2[nH]c(NC(=O)Cc3cccc(Br)c3C)cc2c1	ZINC000819494322	FI	On-Demand	Anodyne	MTNR1A	41	38
COc1ccc2[nH]c(NC(=O)Cc3cccc(Br)c3C)cc2c1	ZINC000819494322	FI	On-Demand	Anodyne	TUBB2B	44	43
CNC(=O)[C@@H](O)CNC(=O)c1cc(C)n(-c2ccc(Cl)c(Cl)c2)n1	ZINC000819494326	FD	On-Demand	Anodyne	RPA1	94	41
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H](O)CCc1ccccc1)C2	ZINC000819494345	FD	On-Demand	Anodyne	Q82323_9DELA	54	30
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H](O)CCc1ccccc1)C2	ZINC000819494346	FD	On-Demand	Anodyne	Q82323_9DELA	54	30
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H](O)CCc1ccccc1)C2	ZINC000819494348	FD	On-Demand	Anodyne	Q82323_9DELA	54	30
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H](O)CCc1ccccc1)C2	ZINC000819494349	FD	On-Demand	Anodyne	Q82323_9DELA	54	30
CC(=O)Nc1cccc(CC(=O)NC23CCC(CC2)C3)c1	ZINC000819494351	CF	On-Demand	Anodyne	EPHX2	38	44
COc1ccc2[nH]c(NC(=O)/C=C\C3CC3)cc2c1	ZINC000819494352	CG	On-Demand	Anodyne	TUBB2B	41	43
COc1ccc2[nH]c(NC(=O)/C=C/C3CC3)cc2c1	ZINC000819494354	CG	On-Demand	Anodyne	TUBB2B	41	43
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000819494360	EF	On-Demand	Anodyne	SIGMAR1	18	41
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000819494362	EF	On-Demand	Anodyne	SIGMAR1	18	41
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000819494364	EF	On-Demand	Anodyne	SIGMAR1	18	41
CNC(=O)[C@@H](O)CNC(=O)Cc1cccc(C(=O)OC)c1	ZINC000819494365	CB	On-Demand	Anodyne	CTSL	18	40
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000819494367	EF	On-Demand	Anodyne	SIGMAR1	18	41
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819494369	FD	On-Demand	Anodyne	CACNA1I	70	38
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819494369	FD	On-Demand	Anodyne	GPR119	43	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819494371	FD	On-Demand	Anodyne	CACNA1I	70	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)c2cc3c(cn2)OCCO3)C1	ZINC000819494371	FD	On-Demand	Anodyne	GPR119	43	43
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)cc1	ZINC000819494381	GF	On-Demand	Anodyne	ADRB2	29	46
CC(=O)c1ccc(OC[C@@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)cc1	ZINC000819494381	GF	On-Demand	Anodyne	ADRB1	35	43
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)cc1	ZINC000819494383	GF	On-Demand	Anodyne	ADRB2	29	46
CC(=O)c1ccc(OC[C@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)cc1	ZINC000819494383	GF	On-Demand	Anodyne	ADRB1	35	43
COCc1cc(Cl)ccc1NC[C@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819494389	FG	On-Demand	Anodyne	ADRB3	15	40
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	ACE	26	40
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	MME	56	40
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	CTSD	26	41
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	PGC	60	41
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	FCER2	82	35
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	CTSB	39	48
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	PAPA1_CARPA	83	55
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	CYSP_TRYCR	54	43
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	CCKAR	75	51
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	CTSK	31	52
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	CTSL	64	55
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	CACNA1B	48	40
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	PGA	33	43
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	TIMP3	80	41
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	PYGL	21	45
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	HDAC8	17	51
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	TACR3	20	47
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	CAPNS1	54	33
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	MMP3	29	44
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	HLA-DRB1	44	43
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	REN	88	47
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	REN1	30	43
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	CCKBR	26	45
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	CTSS	31	55
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	CAPN1	51	45
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	MMP9	24	44
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	CAPN2	51	48
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	ACE2	44	35
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	TUBB2B	35	42
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	MMP1	40	44
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	FPR1	72	50
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	CTRB_BOVIN	21	42
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	BLA1_STEMA	47	38
COc1ccc2[nH]c(NC(=O)[C@@H](Cc3ccccc3)NC(=O)OC(C)(C)C)cc2c1	ZINC000819494392	HI	On-Demand	Anodyne	PSMB8	51	34
COCc1cc(Cl)ccc1NC[C@@H](O)c1ccc(S(C)(=O)=O)cc1	ZINC000819494393	FG	On-Demand	Anodyne	ADRB3	15	40
O=C(CSc1ccc2ccccc2c1)Nc1cnn[nH]1	ZINC000819494395	CF	On-Demand	Anodyne	ENPP1	69	34
O=C(CSc1ccc2ccccc2c1)Nc1cnn[nH]1	ZINC000819494395	CF	On-Demand	Anodyne	FAS	69	40
O=C(NC[C@@H](O)CCc1ccccc1)C(F)=C1CCC1	ZINC000819494401	CF	On-Demand	Anodyne	MME	18	40
O=C(NC[C@H](O)CCc1ccccc1)C(F)=C1CCC1	ZINC000819494402	CF	On-Demand	Anodyne	MME	18	40
C[C@@H](CC(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)n1cccn1	ZINC000819494407	EE	On-Demand	Anodyne	CACNA1I	42	34
C[C@@H](CC(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)n1cccn1	ZINC000819494407	EE	On-Demand	Anodyne	GPR119	30	41
C[C@H](CC(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)n1cccn1	ZINC000819494409	EE	On-Demand	Anodyne	CACNA1I	42	34
C[C@H](CC(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)n1cccn1	ZINC000819494409	EE	On-Demand	Anodyne	GPR119	30	41
C[C@@H](CC(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1)n1cccn1	ZINC000819494411	EE	On-Demand	Anodyne	CACNA1I	42	34
C[C@@H](CC(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1)n1cccn1	ZINC000819494411	EE	On-Demand	Anodyne	GPR119	30	41
COc1ccc2[nH]c(NC(=O)/C=C/c3cccc(O)c3)cc2c1	ZINC000819494412	DH	On-Demand	Anodyne	HDAC8	24	42
COc1ccc2[nH]c(NC(=O)/C=C/c3cccc(O)c3)cc2c1	ZINC000819494412	DH	On-Demand	Anodyne	MMP2	15	67
COc1ccc2[nH]c(NC(=O)/C=C/c3cccc(O)c3)cc2c1	ZINC000819494412	DH	On-Demand	Anodyne	MMP9	15	67
COc1ccc2[nH]c(NC(=O)/C=C/c3cccc(O)c3)cc2c1	ZINC000819494412	DH	On-Demand	Anodyne	TUBB2B	46	53
COc1ccc2[nH]c(NC(=O)/C=C/c3cccc(O)c3)cc2c1	ZINC000819494412	DH	On-Demand	Anodyne	ABCG2	18	45
C[C@H](CC(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1)n1cccn1	ZINC000819494413	EE	On-Demand	Anodyne	CACNA1I	42	34
C[C@H](CC(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1)n1cccn1	ZINC000819494413	EE	On-Demand	Anodyne	GPR119	30	41
COc1ccc2[nH]c(NC(=O)/C=C\c3cccc(O)c3)cc2c1	ZINC000819494415	DH	On-Demand	Anodyne	HDAC8	24	42
COc1ccc2[nH]c(NC(=O)/C=C\c3cccc(O)c3)cc2c1	ZINC000819494415	DH	On-Demand	Anodyne	MMP2	15	67
COc1ccc2[nH]c(NC(=O)/C=C\c3cccc(O)c3)cc2c1	ZINC000819494415	DH	On-Demand	Anodyne	MMP9	15	67
COc1ccc2[nH]c(NC(=O)/C=C\c3cccc(O)c3)cc2c1	ZINC000819494415	DH	On-Demand	Anodyne	TUBB2B	46	53
COc1ccc2[nH]c(NC(=O)/C=C\c3cccc(O)c3)cc2c1	ZINC000819494415	DH	On-Demand	Anodyne	ABCG2	18	45
CC(C)(C)OC(=O)N1CCC(n2cc(NC(=O)C(F)=C3CCC3)cn2)CC1	ZINC000819494478	GH	On-Demand	Anodyne	MTOR	26	41
CC(C)(C)OC(=O)N1CCC(n2cc(NC(=O)C(F)=C3CCC3)cn2)CC1	ZINC000819494478	GH	On-Demand	Anodyne	GPR119	42	41
COCCS(=O)(=O)CC(=O)Nc1cc2cc(OC)ccc2[nH]1	ZINC000819494535	ED	On-Demand	Anodyne	TUBB2B	35	41
CNC(=O)[C@@H](O)CNC(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000819494540	FB	On-Demand	Anodyne	CA2	25	40
CNC(=O)[C@@H](O)CNC(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000819494540	FB	On-Demand	Anodyne	F3	67	33
CNC(=O)[C@@H](O)CNC(=O)c1ccc(S(=O)(=O)NCC(C)C)cc1	ZINC000819494540	FB	On-Demand	Anodyne	ITGAV	51	35
CNC(=O)[C@@H](O)CNC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1	ZINC000819494543	GD	On-Demand	Bother	GSTM2	56	41
CNC(=O)[C@@H](O)CNC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1	ZINC000819494543	GD	On-Demand	Bother	GSTP1	32	41
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)Nc1cnn[nH]1	ZINC000819494547	ED	On-Demand	Anodyne	MME	21	45
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)Nc1cnn[nH]1	ZINC000819494547	ED	On-Demand	Anodyne	FURIN	56	44
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)Nc1cnn[nH]1	ZINC000819494547	ED	On-Demand	Anodyne	FPR1	43	42
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)Nc1cnn[nH]1	ZINC000819494547	ED	On-Demand	Anodyne	BLA1_STEMA	41	36
CSCC[C@@H](NC(=O)Cc1ccccc1)C(=O)Nc1cnn[nH]1	ZINC000819494547	ED	On-Demand	Anodyne	POLG_WNV	44	32
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)Nc1cnn[nH]1	ZINC000819494548	ED	On-Demand	Anodyne	MME	21	45
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)Nc1cnn[nH]1	ZINC000819494548	ED	On-Demand	Anodyne	FURIN	56	44
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)Nc1cnn[nH]1	ZINC000819494548	ED	On-Demand	Anodyne	FPR1	43	42
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)Nc1cnn[nH]1	ZINC000819494548	ED	On-Demand	Anodyne	BLA1_STEMA	41	36
CSCC[C@H](NC(=O)Cc1ccccc1)C(=O)Nc1cnn[nH]1	ZINC000819494548	ED	On-Demand	Anodyne	POLG_WNV	44	32
O=C(Nc1cnn[nH]1)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000819494551	EE	On-Demand	Anodyne	NOD2	41	36
O=C(Nc1cnn[nH]1)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000819494552	EE	On-Demand	Anodyne	NOD2	41	36
CNC(=O)[C@@H](O)CNC(=O)CCC(=O)c1ccc(-c2ccccc2)cc1	ZINC000819494555	FD	On-Demand	Anodyne	HDAC8	19	46
CNC(=O)[C@@H](O)CNC(=O)c1nnn(-c2ccc(-c3ccccc3)cc2)c1C	ZINC000819494568	GD	On-Demand	Anodyne	SLC5A1	15	46
CNC(=O)[C@@H](O)CNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000819494579	FB	On-Demand	Anodyne	CPT1A	119	43
CNC(=O)[C@@H](O)CNC(=O)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000819494579	FB	On-Demand	Anodyne	CPT2	48	38
CNC(=O)[C@@H](O)CNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000819494581	FB	On-Demand	Anodyne	CPT1A	119	43
CNC(=O)[C@@H](O)CNC(=O)[C@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000819494581	FB	On-Demand	Anodyne	CPT2	48	38
O=C(Nc1cnn[nH]1)c1cc(-c2ccccc2)on1	ZINC000819494594	CD	On-Demand	Anodyne	HDAC10	17	46
O=C(NCCCc1ccccc1)C(=O)Nc1cnn[nH]1	ZINC000819494595	CC	On-Demand	Anodyne	FAAH	32	40
O=C(NCCCc1ccccc1)C(=O)Nc1cnn[nH]1	ZINC000819494595	CC	On-Demand	Anodyne	CES1	37	40
O=C(NCCCc1ccccc1)C(=O)Nc1cnn[nH]1	ZINC000819494595	CC	On-Demand	Anodyne	AMP1_PLAFQ	22	43
CNC(=O)[C@@H](O)CNC(=O)CNS(=O)(=O)c1ccc(Cl)s1	ZINC000819494596	FA	On-Demand	Anodyne	CCR4	45	35
C[C@H](NC(=O)C[C@](C)(O)c1ccccc1)[C@H](C)NC(=O)C[C@@](C)(O)c1ccccc1	ZINC000819494602	HF	On-Demand	Anodyne	AMY2	52	32
C[C@H](NC(=O)C[C@](C)(O)c1ccccc1)[C@H](C)NC(=O)C[C@@](C)(O)c1ccccc1	ZINC000819494602	HF	On-Demand	Anodyne	KIF11	19	40
C[C@H](NC(=O)C[C@](C)(O)c1ccccc1)[C@@H](C)NC(=O)C[C@@](C)(O)c1ccccc1	ZINC000819494603	HF	On-Demand	Anodyne	AMY2	52	32
C[C@H](NC(=O)C[C@](C)(O)c1ccccc1)[C@@H](C)NC(=O)C[C@@](C)(O)c1ccccc1	ZINC000819494603	HF	On-Demand	Anodyne	KIF11	19	40
C[C@H](NC(=O)C[C@](C)(O)c1ccccc1)[C@H](C)NC(=O)C[C@](C)(O)c1ccccc1	ZINC000819494604	HF	On-Demand	Anodyne	AMY2	52	32
C[C@H](NC(=O)C[C@](C)(O)c1ccccc1)[C@H](C)NC(=O)C[C@](C)(O)c1ccccc1	ZINC000819494604	HF	On-Demand	Anodyne	KIF11	19	40
C[C@H](NC(=O)C[C@](C)(O)c1ccccc1)[C@@H](C)NC(=O)C[C@](C)(O)c1ccccc1	ZINC000819494605	HF	On-Demand	Anodyne	AMY2	52	32
C[C@H](NC(=O)C[C@](C)(O)c1ccccc1)[C@@H](C)NC(=O)C[C@](C)(O)c1ccccc1	ZINC000819494605	HF	On-Demand	Anodyne	KIF11	19	40
CNC(=O)[C@@H](O)CNC(=O)c1ccc(N2C[C@@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000819494608	GC	On-Demand	Bother	TAAR1	21	44
COc1ccc2[nH]c(NC(=O)c3ccccc3NC(=O)c3ccsc3)cc2c1	ZINC000819494665	GJ	On-Demand	Anodyne	TUBB2B	42	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819494686	GE	On-Demand	Anodyne	CACNA1I	66	47
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819494686	GE	On-Demand	Anodyne	GPR119	52	54
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819494688	GE	On-Demand	Anodyne	CACNA1I	66	47
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)Cc2ccc(-n3cnnc3)cc2)C1	ZINC000819494688	GE	On-Demand	Anodyne	GPR119	52	54
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000819494716	EH	On-Demand	Anodyne	CCR2	47	44
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000819494716	EH	On-Demand	Anodyne	RBP4	26	44
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000819494717	EH	On-Demand	Anodyne	CCR2	47	44
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000819494717	EH	On-Demand	Anodyne	RBP4	26	44
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000819494718	EH	On-Demand	Anodyne	CCR2	47	44
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000819494718	EH	On-Demand	Anodyne	RBP4	26	44
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000819494719	EH	On-Demand	Anodyne	CCR2	47	44
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000819494719	EH	On-Demand	Anodyne	RBP4	26	44
C#CCOCCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819494769	CC	On-Demand	Mild	MTNR1A	44	42
C#CCOCCNC(=O)C[S@](=O)c1cccc(OC)c1	ZINC000819494769	CC	On-Demand	Mild	MTNR1B	41	42
C#CCOCCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819494772	CC	On-Demand	Mild	MTNR1A	44	42
C#CCOCCNC(=O)C[S@@](=O)c1cccc(OC)c1	ZINC000819494772	CC	On-Demand	Mild	MTNR1B	41	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3ccc(C)cc3)C1)C2	ZINC000819494775	FG	On-Demand	Anodyne	ADAM10	18	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3ccc(C)cc3)C1)C2	ZINC000819494776	FG	On-Demand	Anodyne	ADAM10	18	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](c3ccc(C)cc3)C1)C2	ZINC000819494777	FG	On-Demand	Anodyne	ADAM10	18	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](c3ccc(C)cc3)C1)C2	ZINC000819494778	FG	On-Demand	Anodyne	ADAM10	18	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@@H](c3cccc(C)c3)C1)C2	ZINC000819494779	FG	On-Demand	Anodyne	ADAM10	24	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC[C@H](c3cccc(C)c3)C1)C2	ZINC000819494780	FG	On-Demand	Anodyne	ADAM10	24	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@@H](c3cccc(C)c3)C1)C2	ZINC000819494781	FG	On-Demand	Anodyne	ADAM10	24	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC[C@H](c3cccc(C)c3)C1)C2	ZINC000819494782	FG	On-Demand	Anodyne	ADAM10	24	43
CON(C(=O)[C@H]1C[C@@H]1c1ccc(C)cc1)C1CCCC1	ZINC000819494826	CG	On-Demand	Anodyne	SLC6A3	24	43
CON(C(=O)[C@H]1C[C@H]1c1ccc(C)cc1)C1CCCC1	ZINC000819494828	CG	On-Demand	Anodyne	SLC6A3	24	43
CON(C(=O)[C@@H]1C[C@@H]1c1ccc(C)cc1)C1CCCC1	ZINC000819494830	CG	On-Demand	Anodyne	SLC6A3	24	43
CON(C(=O)[C@@H]1C[C@H]1c1ccc(C)cc1)C1CCCC1	ZINC000819494832	CG	On-Demand	Anodyne	SLC6A3	24	43
C#CCOCCNC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819494846	FF	On-Demand	Mild	CNR1	52	32
Cc1nnc(SCC(=O)Nc2cnn[nH]2)n1Cc1ccccc1	ZINC000819494878	ED	On-Demand	Anodyne	AGTR1	27	41
CCCOc1cc(OC)ccc1C(=O)NC[C@@H](O)C(=O)NC	ZINC000819494906	DC	On-Demand	Anodyne	MTNR1A	43	44
CCCOc1cc(OC)ccc1C(=O)NC[C@@H](O)C(=O)NC	ZINC000819494906	DC	On-Demand	Anodyne	MTNR1B	37	44
CCCOc1cc(OC)ccc1C(=O)NC[C@H](O)C(=O)NC	ZINC000819494909	DC	On-Demand	Anodyne	MTNR1A	43	44
CCCOc1cc(OC)ccc1C(=O)NC[C@H](O)C(=O)NC	ZINC000819494909	DC	On-Demand	Anodyne	MTNR1B	37	44
CNC(=O)[C@@H](O)CNC(=O)c1ccccc1Oc1cccc(C)c1	ZINC000819494912	ED	On-Demand	Anodyne	KCNK3	68	40
CNC(=O)[C@@H](O)CNC(=O)c1ccccc1Oc1cccc(C)c1	ZINC000819494912	ED	On-Demand	Anodyne	KCNK9	69	40
COCc1cc(Cl)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819494919	EI	On-Demand	Anodyne	ADRB2	15	43
COCc1cc(Cl)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819494919	EI	On-Demand	Anodyne	ADRB1	30	43
COCc1cc(Cl)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819494919	EI	On-Demand	Anodyne	ADRB3	45	43
COCc1cc(Cl)ccc1NC[C@H](O)c1cccc(Cl)c1	ZINC000819494919	EI	On-Demand	Anodyne	CYP3A4	48	37
COCc1cc(Cl)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819494923	EI	On-Demand	Anodyne	ADRB2	15	43
COCc1cc(Cl)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819494923	EI	On-Demand	Anodyne	ADRB1	30	43
COCc1cc(Cl)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819494923	EI	On-Demand	Anodyne	ADRB3	45	43
COCc1cc(Cl)ccc1NC[C@@H](O)c1cccc(Cl)c1	ZINC000819494923	EI	On-Demand	Anodyne	CYP3A4	48	37
O=C(NCC1(c2ccccn2)CC1)C(F)=C1CCC1	ZINC000819494936	CF	On-Demand	Anodyne	SLC6A9	15	41
Cc1cc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1Cl	ZINC000819494949	GH	On-Demand	Mild	PAPA1_CARPA	55	49
Cc1cc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1Cl	ZINC000819494949	GH	On-Demand	Mild	CTSL	21	49
Cc1cc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1Cl	ZINC000819494949	GH	On-Demand	Mild	FURIN	44	31
Cc1cc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1Cl	ZINC000819494949	GH	On-Demand	Mild	CTSS	16	51
Cc1cc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1Cl	ZINC000819494949	GH	On-Demand	Mild	FPR1	43	37
Cc1cc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1Cl	ZINC000819494950	GH	On-Demand	Mild	PAPA1_CARPA	55	49
Cc1cc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1Cl	ZINC000819494950	GH	On-Demand	Mild	CTSL	21	49
Cc1cc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1Cl	ZINC000819494950	GH	On-Demand	Mild	FURIN	44	31
Cc1cc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1Cl	ZINC000819494950	GH	On-Demand	Mild	CTSS	16	51
Cc1cc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)ccc1Cl	ZINC000819494950	GH	On-Demand	Mild	FPR1	43	37
COc1ccc2[nH]c(NC(=O)/C=C\c3ccncn3)cc2c1	ZINC000819494955	CF	On-Demand	Anodyne	TUBB2B	45	42
COc1ccc2[nH]c(NC(=O)/C=C/c3ccncn3)cc2c1	ZINC000819494958	CF	On-Demand	Anodyne	TUBB2B	45	42
CNC(=O)[C@@H](O)CNC(=O)c1ccc(OC)cc1C	ZINC000819494963	CB	On-Demand	Anodyne	MTNR1A	52	38
CNC(=O)[C@@H](O)CNC(=O)c1ccc(OC)cc1C	ZINC000819494963	CB	On-Demand	Anodyne	MTNR1B	45	38
CNC(=O)[C@@H](O)CNC(=O)c1ccc(OC)cc1C	ZINC000819494963	CB	On-Demand	Anodyne	AKR1C2	42	38
CNC(=O)[C@@H](O)CNC(=O)c1cccc(COc2cccc(C#N)c2)c1	ZINC000819494980	FC	On-Demand	Mild	MAOB	30	42
CNC(=O)[C@@H](O)CNC(=O)c1cccc(COc2cccc(C#N)c2)c1	ZINC000819494980	FC	On-Demand	Mild	PTGER3	40	43
CNC(=O)[C@@H](O)CNC(=O)c1cccc(COc2cccc(C#N)c2)c1	ZINC000819494980	FC	On-Demand	Mild	FFAR1	17	44
CNC(=O)[C@@H](O)CNC(=O)c1cccc(COc2cccc(C#N)c2)c1	ZINC000819494980	FC	On-Demand	Mild	PDS	22	44
CNC(=O)[C@@H](O)CNC(=O)c1nnn(-c2ccccc2)c1C	ZINC000819494983	DB	On-Demand	Anodyne	SLC5A1	19	42
CNC(=O)[C@@H](O)CNC(=O)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819494988	ED	On-Demand	Anodyne	DRD4	49	44
CNC(=O)[C@@H](O)CNC(=O)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819494988	ED	On-Demand	Anodyne	ADRB3	15	42
CNC(=O)[C@@H](O)CNC(=O)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819494988	ED	On-Demand	Anodyne	RAF1	32	45
CNC(=O)[C@@H](O)CNC(=O)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819494988	ED	On-Demand	Anodyne	AMP1_PLAFQ	17	41
CNC(=O)[C@@H](O)CNC(=O)c1cccc(Oc2ccc(Cl)cc2)c1	ZINC000819494988	ED	On-Demand	Anodyne	CRTM	40	41
COc1ccc2[nH]c(NC(=O)/C=C\c3ccc(Cl)s3)cc2c1	ZINC000819494998	EJ	On-Demand	Anodyne	TUBB2B	37	41
COc1ccc2[nH]c(NC(=O)/C=C/c3ccc(Cl)s3)cc2c1	ZINC000819495001	EJ	On-Demand	Anodyne	TUBB2B	37	41
CNC(=O)[C@@H](O)CNC(=O)c1ccc(CSc2ccc(Cl)cc2)cc1	ZINC000819495007	GE	On-Demand	Anodyne	UTS2	42	33
CNC(=O)[C@@H](O)CNC(=O)[C@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495010	FB	On-Demand	Anodyne	MME	37	45
CNC(=O)[C@@H](O)CNC(=O)[C@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495010	FB	On-Demand	Anodyne	NPR1	52	37
CNC(=O)[C@@H](O)CNC(=O)[C@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495010	FB	On-Demand	Anodyne	FCER2	55	36
CNC(=O)[C@@H](O)CNC(=O)[C@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495010	FB	On-Demand	Anodyne	CTSB	18	40
CNC(=O)[C@@H](O)CNC(=O)[C@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495010	FB	On-Demand	Anodyne	CTSL	31	49
CNC(=O)[C@@H](O)CNC(=O)[C@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495010	FB	On-Demand	Anodyne	NPFFR2	18	40
CNC(=O)[C@@H](O)CNC(=O)[C@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495010	FB	On-Demand	Anodyne	TIMP3	22	44
CNC(=O)[C@@H](O)CNC(=O)[C@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495010	FB	On-Demand	Anodyne	MMP8	24	44
CNC(=O)[C@@H](O)CNC(=O)[C@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495010	FB	On-Demand	Anodyne	PCSK5	37	42
CNC(=O)[C@@H](O)CNC(=O)[C@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495010	FB	On-Demand	Anodyne	FURIN	70	51
CNC(=O)[C@@H](O)CNC(=O)[C@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495010	FB	On-Demand	Anodyne	MMP9	20	44
CNC(=O)[C@@H](O)CNC(=O)[C@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495010	FB	On-Demand	Anodyne	FPR1	44	41
CNC(=O)[C@@H](O)CNC(=O)[C@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495010	FB	On-Demand	Anodyne	POLG_WNV	52	36
CNC(=O)[C@@H](O)CNC(=O)[C@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495010	FB	On-Demand	Anodyne	NPFFR1	31	40
CNC(=O)[C@@H](O)CNC(=O)[C@@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495011	FB	On-Demand	Anodyne	MME	37	45
CNC(=O)[C@@H](O)CNC(=O)[C@@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495011	FB	On-Demand	Anodyne	NPR1	52	37
CNC(=O)[C@@H](O)CNC(=O)[C@@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495011	FB	On-Demand	Anodyne	FCER2	55	36
CNC(=O)[C@@H](O)CNC(=O)[C@@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495011	FB	On-Demand	Anodyne	CTSB	18	40
CNC(=O)[C@@H](O)CNC(=O)[C@@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495011	FB	On-Demand	Anodyne	CTSL	31	49
CNC(=O)[C@@H](O)CNC(=O)[C@@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495011	FB	On-Demand	Anodyne	NPFFR2	18	40
CNC(=O)[C@@H](O)CNC(=O)[C@@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495011	FB	On-Demand	Anodyne	TIMP3	22	44
CNC(=O)[C@@H](O)CNC(=O)[C@@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495011	FB	On-Demand	Anodyne	MMP8	24	44
CNC(=O)[C@@H](O)CNC(=O)[C@@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495011	FB	On-Demand	Anodyne	PCSK5	37	42
CNC(=O)[C@@H](O)CNC(=O)[C@@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495011	FB	On-Demand	Anodyne	FURIN	70	51
CNC(=O)[C@@H](O)CNC(=O)[C@@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495011	FB	On-Demand	Anodyne	MMP9	20	44
CNC(=O)[C@@H](O)CNC(=O)[C@@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495011	FB	On-Demand	Anodyne	FPR1	44	41
CNC(=O)[C@@H](O)CNC(=O)[C@@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495011	FB	On-Demand	Anodyne	POLG_WNV	52	36
CNC(=O)[C@@H](O)CNC(=O)[C@@H](CCSC)NC(=O)Cc1ccccc1	ZINC000819495011	FB	On-Demand	Anodyne	NPFFR1	31	40
COC(=O)Nc1cc(C(=O)Nc2cc3cc(OC)ccc3[nH]2)cc(C(F)(F)F)c1	ZINC000819495020	HJ	On-Demand	Anodyne	TUBB2B	34	40
O=C(Nc1cnn[nH]1)c1cccc(C(F)F)c1	ZINC000819495021	BD	On-Demand	Anodyne	KCNK3	89	37
O=C(Nc1cnn[nH]1)c1cccc(C(F)F)c1	ZINC000819495021	BD	On-Demand	Anodyne	KCNK9	40	35
CNC(=O)[C@@H](O)CNC(=O)[C@H](C)Cc1ccc(F)c(Br)c1	ZINC000819495022	FC	On-Demand	Anodyne	LEF	45	33
CNC(=O)[C@@H](O)CNC(=O)[C@@H](C)Cc1ccc(F)c(Br)c1	ZINC000819495025	FC	On-Demand	Anodyne	LEF	45	33
C[C@@H](CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1nccs1	ZINC000819495031	FF	On-Demand	Mild	PAPA1_CARPA	44	47
C[C@@H](CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nccs1	ZINC000819495032	FF	On-Demand	Mild	PAPA1_CARPA	44	47
COc1ccc2[nH]c(NC(=O)CNC(=O)CNC(=O)OC(C)(C)C)cc2c1	ZINC000819495157	GD	On-Demand	Anodyne	MTNR1A	54	36
COc1ccc2[nH]c(NC(=O)CNC(=O)CNC(=O)OC(C)(C)C)cc2c1	ZINC000819495157	GD	On-Demand	Anodyne	MTNR1B	45	36
COc1ccc2[nH]c(NC(=O)CNC(=O)CNC(=O)OC(C)(C)C)cc2c1	ZINC000819495157	GD	On-Demand	Anodyne	TUBB2B	37	40
CNC(=O)[C@@H](O)CNC(=O)c1cc(NC(=O)OC)cc(C(F)(F)F)c1	ZINC000819495159	FC	On-Demand	Anodyne	CCR2	22	45
CNC(=O)[C@@H](O)CNC(=O)c1cc(NC(=O)OC)cc(C(F)(F)F)c1	ZINC000819495159	FC	On-Demand	Anodyne	GIPR	28	40
CCCOc1cc(OC)ccc1C(=O)Nc1cnn[nH]1	ZINC000819495190	CD	On-Demand	Anodyne	MTNR1A	22	42
CCCOc1cc(OC)ccc1C(=O)Nc1cnn[nH]1	ZINC000819495190	CD	On-Demand	Anodyne	MTNR1B	25	42
CCCOc1cc(OC)ccc1C(=O)Nc1cnn[nH]1	ZINC000819495190	CD	On-Demand	Anodyne	LUCI_LUCLA	19	52
CCCOc1cc(OC)ccc1C(=O)Nc1cnn[nH]1	ZINC000819495190	CD	On-Demand	Anodyne	KCNK3	42	37
CCCCC[C@@H](C)CC(=O)NC[C@@H](O)C(=O)NC	ZINC000819495192	CC	On-Demand	Anodyne	CQSS	41	33
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)c1	ZINC000819495193	GF	On-Demand	Anodyne	ADRB2	25	45
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)c1	ZINC000819495193	GF	On-Demand	Anodyne	ADRB1	29	40
CC(=O)c1cccc(OC[C@@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)c1	ZINC000819495193	GF	On-Demand	Anodyne	ABCB1	15	41
CCCCC[C@@H](C)CC(=O)NC[C@H](O)C(=O)NC	ZINC000819495194	CC	On-Demand	Anodyne	CQSS	41	33
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)c1	ZINC000819495196	GF	On-Demand	Anodyne	ADRB2	25	45
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)c1	ZINC000819495196	GF	On-Demand	Anodyne	ADRB1	29	40
CC(=O)c1cccc(OC[C@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)c1	ZINC000819495196	GF	On-Demand	Anodyne	ABCB1	15	41
Cc1ccnn1-c1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819495198	GH	On-Demand	Mild	PAPA1_CARPA	41	43
Cc1ccnn1-c1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819495198	GH	On-Demand	Mild	FPR1	40	36
Cc1ccnn1-c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819495200	GH	On-Demand	Mild	PAPA1_CARPA	41	43
Cc1ccnn1-c1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819495200	GH	On-Demand	Mild	FPR1	40	36
CNC(=O)[C@@H](O)CNC(=O)[C@@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000819495218	EC	On-Demand	Anodyne	GRIN2B	68	58
CNC(=O)[C@@H](O)CNC(=O)[C@@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000819495218	EC	On-Demand	Anodyne	SIGMAR1	18	51
CNC(=O)[C@@H](O)CNC(=O)[C@@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000819495218	EC	On-Demand	Anodyne	CCR3	66	44
CNC(=O)[C@@H](O)CNC(=O)[C@@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000819495218	EC	On-Demand	Anodyne	CAPN2	40	33
CNC(=O)[C@@H](O)CNC(=O)[C@@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000819495218	EC	On-Demand	Anodyne	GRIN2C	24	51
CNC(=O)[C@@H](O)CNC(=O)[C@@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000819495218	EC	On-Demand	Anodyne	AMP1_PLAFQ	23	46
CNC(=O)[C@@H](O)CNC(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000819495223	EC	On-Demand	Anodyne	GRIN2B	68	58
CNC(=O)[C@@H](O)CNC(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000819495223	EC	On-Demand	Anodyne	SIGMAR1	18	51
CNC(=O)[C@@H](O)CNC(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000819495223	EC	On-Demand	Anodyne	CCR3	66	44
CNC(=O)[C@@H](O)CNC(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000819495223	EC	On-Demand	Anodyne	CAPN2	40	33
CNC(=O)[C@@H](O)CNC(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000819495223	EC	On-Demand	Anodyne	GRIN2C	24	51
CNC(=O)[C@@H](O)CNC(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000819495223	EC	On-Demand	Anodyne	AMP1_PLAFQ	23	46
O=C(Nc1cnn[nH]1)[C@H]1CCCN(C(=O)Nc2ccccc2F)C1	ZINC000819495224	ED	On-Demand	Anodyne	RBP4	45	33
O=C(Nc1cnn[nH]1)[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1	ZINC000819495225	ED	On-Demand	Anodyne	RBP4	45	33
O=C(/C=C/c1ccccc1OC(F)(F)F)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1	ZINC000819495266	ID	On-Demand	Anodyne	ITGAL	40	35
O=C(/C=C\c1ccccc1OC(F)(F)F)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1	ZINC000819495269	ID	On-Demand	Anodyne	ITGAL	40	35
CNC(=O)[C@@H](O)CNC(=O)c1ccc(OCC2CCCCC2)cc1	ZINC000819495271	ED	On-Demand	Anodyne	CTSS	22	40
CNC(=O)[C@@H](O)CNC(=O)c1ccc(OCC2CCCCC2)cc1	ZINC000819495271	ED	On-Demand	Anodyne	GIPR	40	35
O=C(CSc1ccc(Cl)cc1)Nc1cnn[nH]1	ZINC000819495278	CE	On-Demand	Anodyne	FAS	61	41
COc1ccc2[nH]c(NC(=O)C[C@](C)(O)c3ccccc3)cc2c1	ZINC000819495282	DG	On-Demand	Anodyne	MTNR1A	44	35
COc1ccc2[nH]c(NC(=O)C[C@](C)(O)c3ccccc3)cc2c1	ZINC000819495282	DG	On-Demand	Anodyne	MTNR1B	41	35
COc1ccc2[nH]c(NC(=O)C[C@](C)(O)c3ccccc3)cc2c1	ZINC000819495282	DG	On-Demand	Anodyne	TUBB2B	43	48
COc1ccc2[nH]c(NC(=O)C[C@@](C)(O)c3ccccc3)cc2c1	ZINC000819495283	DG	On-Demand	Anodyne	MTNR1A	44	35
COc1ccc2[nH]c(NC(=O)C[C@@](C)(O)c3ccccc3)cc2c1	ZINC000819495283	DG	On-Demand	Anodyne	MTNR1B	41	35
COc1ccc2[nH]c(NC(=O)C[C@@](C)(O)c3ccccc3)cc2c1	ZINC000819495283	DG	On-Demand	Anodyne	TUBB2B	43	48
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@H]1C(=O)Nc1cnn[nH]1	ZINC000819495296	FF	On-Demand	Anodyne	DRD4	21	40
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@H]1C(=O)Nc1cnn[nH]1	ZINC000819495296	FF	On-Demand	Anodyne	TPP2	54	32
C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@@H]1C(=O)Nc1cnn[nH]1	ZINC000819495297	FF	On-Demand	Anodyne	DRD4	21	40
C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@@H]1C(=O)Nc1cnn[nH]1	ZINC000819495297	FF	On-Demand	Anodyne	TPP2	54	32
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@@H]1C(=O)Nc1cnn[nH]1	ZINC000819495298	FF	On-Demand	Anodyne	DRD4	21	40
C[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1CCCC[C@@H]1C(=O)Nc1cnn[nH]1	ZINC000819495298	FF	On-Demand	Anodyne	TPP2	54	32
C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@H]1C(=O)Nc1cnn[nH]1	ZINC000819495299	FF	On-Demand	Anodyne	DRD4	21	40
C[C@@H]1Cc2ccccc2N1C(=O)[C@H]1CCCC[C@H]1C(=O)Nc1cnn[nH]1	ZINC000819495299	FF	On-Demand	Anodyne	TPP2	54	32
CNC(=O)[C@@H](O)CNC(=O)c1cccc(C(F)F)c1	ZINC000819495312	CC	On-Demand	Anodyne	CCR2	17	45
COc1ccccc1NC(=O)COc1ccc(C(=O)Nc2cnn[nH]2)cc1OC	ZINC000819495343	GE	On-Demand	Anodyne	CPT1A	49	33
COc1ccccc1NC(=O)COc1ccc(C(=O)Nc2cnn[nH]2)cc1OC	ZINC000819495343	GE	On-Demand	Anodyne	ABCB1	15	41
COc1ccccc1NC(=O)COc1ccc(C(=O)Nc2cnn[nH]2)cc1OC	ZINC000819495343	GE	On-Demand	Anodyne	ABCG2	42	41
COc1ccccc1NC(=O)COc1ccc(C(=O)Nc2cnn[nH]2)cc1OC	ZINC000819495343	GE	On-Demand	Anodyne	ENPP1	56	33
C/C=C(/C=C/C(=O)Nc1cc2cc(OC)ccc2[nH]1)CC	ZINC000819495382	CI	On-Demand	Anodyne	TUBB2B	39	44
C/C=C(/C=C\C(=O)Nc1cc2cc(OC)ccc2[nH]1)CC	ZINC000819495384	CI	On-Demand	Anodyne	TUBB2B	39	44
CNC(=O)[C@@H](O)CNC(=O)c1cc(-c2ccccc2)nc2cc(C)c(C)cc12	ZINC000819495392	GE	On-Demand	Anodyne	PRS	50	36
CNC(=O)[C@@H](O)CNC(=O)c1cc(-c2ccccc2)nc2cc(C)c(C)cc12	ZINC000819495392	GE	On-Demand	Anodyne	TACR3	28	50
CNC(=O)[C@@H](O)CNC(=O)c1cc(-c2ccccc2)nc2cc(C)c(C)cc12	ZINC000819495392	GE	On-Demand	Anodyne	MT-CO2	51	38
COc1ccc2[nH]c(NC(=O)CN3C(=O)N[C@@](C)(c4ccccc4)C3=O)cc2c1	ZINC000819495402	GF	On-Demand	Anodyne	TUBB2B	36	42
COc1ccc2[nH]c(NC(=O)CN3C(=O)N[C@](C)(c4ccccc4)C3=O)cc2c1	ZINC000819495405	GF	On-Demand	Anodyne	TUBB2B	36	42
COCc1cc(Cl)ccc1NC[C@H](O)c1cccnc1	ZINC000819495442	CG	On-Demand	Anodyne	ADRB1	25	40
COCc1cc(Cl)ccc1NC[C@H](O)c1cccnc1	ZINC000819495442	CG	On-Demand	Anodyne	ADRB3	61	40
COCc1cc(Cl)ccc1NC[C@@H](O)c1cccnc1	ZINC000819495443	CG	On-Demand	Anodyne	ADRB1	25	40
COCc1cc(Cl)ccc1NC[C@@H](O)c1cccnc1	ZINC000819495443	CG	On-Demand	Anodyne	ADRB3	61	40
COCc1cc(Cl)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819495474	EH	On-Demand	Bother	CACNA1C	43	36
COCc1cc(Cl)ccc1NC[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819495474	EH	On-Demand	Bother	CACNA1D	69	36
COCc1cc(Cl)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819495475	EH	On-Demand	Bother	CACNA1C	43	36
COCc1cc(Cl)ccc1NC[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000819495475	EH	On-Demand	Bother	CACNA1D	69	36
Cc1ccc(OC[C@@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)cc1	ZINC000819495477	FF	On-Demand	Anodyne	ADRB2	33	49
Cc1ccc(OC[C@@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)cc1	ZINC000819495477	FF	On-Demand	Anodyne	ADRB1	35	46
Cc1ccc(OC[C@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)cc1	ZINC000819495479	FF	On-Demand	Anodyne	ADRB2	33	49
Cc1ccc(OC[C@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)cc1	ZINC000819495479	FF	On-Demand	Anodyne	ADRB1	35	46
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	ACE	41	47
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	MME	121	51
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	ANPEP	60	36
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	TACR1	17	53
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	CTSD	34	51
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	PGC	67	51
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	CMA1	38	40
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	CTRA_BOVIN	26	40
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	FCER2	107	44
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	CTSB	91	45
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	PAPA1_CARPA	107	69
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	CYSP_TRYCR	78	44
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	CCKAR	66	46
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	CTSK	49	68
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	CTSL	89	69
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	CACNA1B	50	40
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	PGA	54	51
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	TIMP3	85	42
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	TACR3	27	56
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	CAPNS1	71	38
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	MMP2	25	45
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	MMP3	39	45
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	MMP8	31	44
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	GRIA1	48	37
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	HLA-DRB1	63	49
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	REN	107	55
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	REN1	36	52
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	CCKBR	23	44
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	CTSS	42	69
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	CAPN1	101	58
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	MMP9	33	44
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	CAPN2	122	45
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	CTSE	17	40
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	ACE2	63	39
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	BACE1	15	43
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	SCN10A	21	42
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	CTSV	50	37
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	MMP7	31	42
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	MMP1	55	45
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	FPR1	101	56
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	CTRB_BOVIN	58	46
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	NPR	68	36
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	BLA1_STEMA	46	34
CNC(=O)[C@@H](O)CNC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C	ZINC000819495499	FC	On-Demand	Anodyne	NPFFR1	45	32
CNC(=O)[C@@H](O)CNC(=O)CCCc1csc2ccccc12	ZINC000819495506	DD	On-Demand	Anodyne	MTNR1A	16	42
CNC(=O)[C@@H](O)CNC(=O)c1cn(C)nc1-c1cccs1	ZINC000819495508	DB	On-Demand	Anodyne	GPR142	52	34
CNC(=O)[C@@H](O)CNC(=O)Cc1cc(F)ccc1Br	ZINC000819495512	EC	On-Demand	Anodyne	P2RX7	21	41
COc1cccc([S@@](=O)CC(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819495520	GE	On-Demand	Anodyne	CACNA1I	55	36
COc1cccc([S@@](=O)CC(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000819495523	GE	On-Demand	Anodyne	CACNA1I	55	36
CCOC(=O)COc1ccc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)cc1	ZINC000819495530	GE	On-Demand	Anodyne	HDAC8	15	40
Cc1ccnn1-c1ccccc1NC(=O)C(F)=C1CCC1	ZINC000819495533	CH	On-Demand	Anodyne	KCNQ2	49	32
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@@H](Oc2cccc(F)c2)C1	ZINC000819495584	DF	On-Demand	Anodyne	MLNR	15	44
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@H](Oc2cccc(F)c2)C1	ZINC000819495585	DF	On-Demand	Anodyne	MLNR	15	44
O=C(/C=C\[C@@H]1CCCO1)N1CC[C@H](Oc2cccc(F)c2)C1	ZINC000819495586	DF	On-Demand	Anodyne	MLNR	15	44
O=C(/C=C/[C@@H]1CCCO1)N1CC[C@@H](Oc2cccc(F)c2)C1	ZINC000819495587	DF	On-Demand	Anodyne	MLNR	15	44
COc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1OCCN(C)C	ZINC000819495599	FG	On-Demand	Anodyne	ADRB1	26	43
COc1cc(NC[C@H](O)c2cccc(Cl)c2)ccc1OCCN(C)C	ZINC000819495599	FG	On-Demand	Anodyne	ADRB3	40	43
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1OCCN(C)C	ZINC000819495600	FG	On-Demand	Anodyne	ADRB1	26	43
COc1cc(NC[C@@H](O)c2cccc(Cl)c2)ccc1OCCN(C)C	ZINC000819495600	FG	On-Demand	Anodyne	ADRB3	40	43
CCOC[C@H](O)CNc1ccc(C(N)=O)cc1OC(C)C	ZINC000819495624	CD	On-Demand	Anodyne	ADRB2	16	40
COc1cc(NCCC(=O)Nc2cccnc2)ccc1OCCN(C)C	ZINC000819495626	FE	On-Demand	Anodyne	ENPP1	75	38
COc1cc(NCCC(=O)Nc2cccnc2)ccc1OCCN(C)C	ZINC000819495626	FE	On-Demand	Anodyne	DRTS_TRYCR	46	34
O=C1C[C@@H](Oc2cccc(NC[C@@H](O)c3cccnc3)c2)N1	ZINC000819495634	CD	On-Demand	Anodyne	ADRB3	80	45
O=C1C[C@@H](Oc2cccc(NC[C@H](O)c3cccnc3)c2)N1	ZINC000819495635	CD	On-Demand	Anodyne	ADRB3	80	45
O=C1C[C@H](Oc2cccc(NC[C@H](O)c3cccnc3)c2)N1	ZINC000819495636	CD	On-Demand	Anodyne	ADRB3	80	45
O=C1C[C@H](Oc2cccc(NC[C@@H](O)c3cccnc3)c2)N1	ZINC000819495637	CD	On-Demand	Anodyne	ADRB3	80	45
COc1cc(NC[C@@H](C)S(C)(=O)=O)ccc1OCCN(C)C	ZINC000819495654	ED	On-Demand	Anodyne	DRTS_TRYCR	44	31
COc1cc(NC[C@H](C)S(C)(=O)=O)ccc1OCCN(C)C	ZINC000819495655	ED	On-Demand	Anodyne	DRTS_TRYCR	44	31
COc1cc(NCCS(C)(=O)=O)ccc1OCCN(C)C	ZINC000819495656	DD	On-Demand	Anodyne	DRTS_TRYCR	49	35
COc1cc(NC[C@H](O)c2cc(F)ccc2F)ccc1OCCN(C)C	ZINC000819495667	FG	On-Demand	Anodyne	DRTS_TRYCR	45	32
COc1cc(NC[C@@H](O)c2cc(F)ccc2F)ccc1OCCN(C)C	ZINC000819495668	FG	On-Demand	Anodyne	DRTS_TRYCR	45	32
CC[C@H](O)CNc1ccc(OCCN(C)C)c(OC)c1	ZINC000819495677	CD	On-Demand	Anodyne	DRTS_TRYCR	46	32
CC(=O)Nc1cccc(CC(=O)N2CCN(c3ccc(C)cc3)CC2)c1	ZINC000819495733	FF	On-Demand	Anodyne	HTR1D	27	42
CC(=O)Nc1cccc(CC(=O)N2CCN(c3ccc(C)cc3)CC2)c1	ZINC000819495733	FF	On-Demand	Anodyne	HTR1B	28	42
O=C(C(F)=C1CCC1)N1CCCCC[C@@H]1c1ncon1	ZINC000819495734	CF	On-Demand	Anodyne	CPT1A	46	37
O=C(C(F)=C1CCC1)N1CCCCC[C@H]1c1ncon1	ZINC000819495735	CF	On-Demand	Anodyne	CPT1A	46	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCCC[C@H]1c1ncon1)C2	ZINC000819495751	FE	On-Demand	Anodyne	CPT1A	45	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCCC[C@@H]1c1ncon1)C2	ZINC000819495752	FE	On-Demand	Anodyne	CPT1A	45	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCCC[C@H]1c1ncon1)C2	ZINC000819495753	FE	On-Demand	Anodyne	CPT1A	45	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCCC[C@@H]1c1ncon1)C2	ZINC000819495754	FE	On-Demand	Anodyne	CPT1A	45	37
COc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1OCCN(C)C	ZINC000819495780	GG	On-Demand	Anodyne	PDGFRB	15	40
COc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1OCCN(C)C	ZINC000819495780	GG	On-Demand	Anodyne	AURKB	32	43
COc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1OCCN(C)C	ZINC000819495780	GG	On-Demand	Anodyne	FLT4	18	40
COc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1OCCN(C)C	ZINC000819495780	GG	On-Demand	Anodyne	PDGFRA	18	40
COc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1OCCN(C)C	ZINC000819495780	GG	On-Demand	Anodyne	AURKA	24	42
COc1cc(NCCC(=O)Nc2cccc(F)c2)ccc1OCCN(C)C	ZINC000819495780	GG	On-Demand	Anodyne	ENPP1	72	35
COc1cc(NC[C@H](O)Cc2ccc(F)cc2)ccc1OCCN(C)C	ZINC000819495786	FF	On-Demand	Anodyne	DRTS_TRYCR	47	32
COc1cc(NC[C@@H](O)Cc2ccc(F)cc2)ccc1OCCN(C)C	ZINC000819495787	FF	On-Demand	Anodyne	DRTS_TRYCR	47	32
COc1cc(NCC2(O)CCC2)ccc1OCCN(C)C	ZINC000819495796	CD	On-Demand	Anodyne	ENPP1	46	31
C#CCNC(=O)CCNc1ccc(OCCN(C)C)c(OC)c1	ZINC000819495803	DD	On-Demand	Mild	ENPP1	44	30
C#CCNC(=O)CCNc1ccc(OCCN(C)C)c(OC)c1	ZINC000819495803	DD	On-Demand	Mild	DRTS_TRYCR	47	34
O=C(NCc1ccc(N2CCCS2(=O)=O)cc1)C(F)=C1CCC1	ZINC000819495829	EE	On-Demand	Anodyne	CDK1	17	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(OC(C)C)c(OC)c1)C2	ZINC000819495841	GG	On-Demand	Anodyne	ENPP1	68	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(OC(C)C)c(OC)c1)C2	ZINC000819495842	GG	On-Demand	Anodyne	ENPP1	68	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCCc3cc(OC)ccc31)C2	ZINC000819495862	GG	On-Demand	Anodyne	NQO2	26	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCCc3cc(OC)ccc31)C2	ZINC000819495862	GG	On-Demand	Anodyne	MTNR1A	25	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@H]1CCCc3cc(OC)ccc31)C2	ZINC000819495862	GG	On-Demand	Anodyne	EBP	16	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCCc3cc(OC)ccc31)C2	ZINC000819495863	GG	On-Demand	Anodyne	NQO2	26	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCCc3cc(OC)ccc31)C2	ZINC000819495863	GG	On-Demand	Anodyne	MTNR1A	25	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@@H]1CCCc3cc(OC)ccc31)C2	ZINC000819495863	GG	On-Demand	Anodyne	EBP	16	43
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCCc3cc(OC)ccc31)C2	ZINC000819495864	GG	On-Demand	Anodyne	NQO2	26	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCCc3cc(OC)ccc31)C2	ZINC000819495864	GG	On-Demand	Anodyne	MTNR1A	25	45
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NC[C@@H]1CCCc3cc(OC)ccc31)C2	ZINC000819495864	GG	On-Demand	Anodyne	EBP	16	43
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCCc3cc(OC)ccc31)C2	ZINC000819495865	GG	On-Demand	Anodyne	NQO2	26	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCCc3cc(OC)ccc31)C2	ZINC000819495865	GG	On-Demand	Anodyne	MTNR1A	25	45
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NC[C@H]1CCCc3cc(OC)ccc31)C2	ZINC000819495865	GG	On-Demand	Anodyne	EBP	16	43
COc1cc(NCCC(=O)Nc2cc(F)cc(F)c2)ccc1OCCN(C)C	ZINC000819495950	GG	On-Demand	Anodyne	ENPP1	71	34
COc1cc(NCCC(=O)Nc2cc(F)cc(F)c2)ccc1OCCN(C)C	ZINC000819495950	GG	On-Demand	Anodyne	DRTS_TRYCR	47	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	PLG	16	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	OPRM1	32	43
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	OPRD1	25	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	CELA1	18	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	MME	67	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	TACR1	20	45
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	PGC	62	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	CMA1	39	46
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	CTRA_BOVIN	36	46
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	FCER2	52	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	CTSB	40	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	PAPA1_CARPA	74	52
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	CYSP_TRYCR	55	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	CCKAR	66	45
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	CTSK	31	51
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	CTSL	44	52
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	PGA	28	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	TIMP3	65	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	TACR3	18	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	CAPNS1	62	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	HLA-DRB1	43	43
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	REN	86	46
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	REN1	21	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	CCKBR	27	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	CTSS	19	52
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	CAPN1	83	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	CAPN2	43	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	ACE2	55	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	MMP1	17	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	FPR1	74	48
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	CTRB_BOVIN	58	45
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	GAG-PRO	66	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	Q82323_9DELA	41	30
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	NPFFR1	41	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495995	EE	On-Demand	Anodyne	Q9NAW4_PLAFA	23	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	PLG	16	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	OPRM1	32	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	OPRD1	25	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	CELA1	18	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	MME	67	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	TACR1	20	45
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	PGC	62	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	CMA1	39	46
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	CTRA_BOVIN	36	46
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	FCER2	52	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	CTSB	40	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	PAPA1_CARPA	74	52
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	CYSP_TRYCR	55	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	CCKAR	66	45
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	CTSK	31	51
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	CTSL	44	52
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	PGA	28	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	TIMP3	65	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	TACR3	18	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	CAPNS1	62	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	HLA-DRB1	43	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	REN	86	46
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	REN1	21	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	CCKBR	27	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	CTSS	19	52
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	CAPN1	83	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	CAPN2	43	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	ACE2	55	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	MMP1	17	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	FPR1	74	48
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	CTRB_BOVIN	58	45
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	GAG-PRO	66	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	Q82323_9DELA	41	30
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	NPFFR1	41	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819495996	EE	On-Demand	Anodyne	Q9NAW4_PLAFA	23	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819495999	DE	On-Demand	Anodyne	DRD4	25	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819495999	DE	On-Demand	Anodyne	SIGMAR1	22	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819496001	DE	On-Demand	Anodyne	DRD4	25	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)/C=C/[C@H]1CCCO1	ZINC000819496001	DE	On-Demand	Anodyne	SIGMAR1	22	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819496003	DE	On-Demand	Anodyne	DRD4	25	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)/C=C\[C@H]1CCCO1	ZINC000819496003	DE	On-Demand	Anodyne	SIGMAR1	22	44
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819496005	DE	On-Demand	Anodyne	DRD4	25	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819496005	DE	On-Demand	Anodyne	SIGMAR1	22	44
COc1cc(NCC2(O)CCCCC2)ccc1OCCN(C)C	ZINC000819496025	DF	On-Demand	Anodyne	ENPP1	44	30
O=C(C(F)=C1CCC1)N1CCN(c2cccc(F)c2)C(=O)C1	ZINC000819496047	DE	On-Demand	Anodyne	P2RX7	15	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccccc1-c1cn[nH]c1)C2	ZINC000819496062	FF	On-Demand	Anodyne	ROCK2	43	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccccc1-c1cn[nH]c1)C2	ZINC000819496064	FF	On-Demand	Anodyne	ROCK2	43	40
CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1nc2ccccc2n1C	ZINC000819496113	GG	On-Demand	Mild	PAPA1_CARPA	47	41
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496154	ED	On-Demand	Anodyne	ACE	41	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496154	ED	On-Demand	Anodyne	MME	63	42
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496154	ED	On-Demand	Anodyne	MC4R	60	38
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496154	ED	On-Demand	Anodyne	TACR2	20	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496154	ED	On-Demand	Anodyne	CTSB	17	46
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496154	ED	On-Demand	Anodyne	TRY2_BOVIN	56	40
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496154	ED	On-Demand	Anodyne	CYSP_TRYCR	23	45
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496154	ED	On-Demand	Anodyne	CTSS	26	47
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496154	ED	On-Demand	Anodyne	ACE2	60	34
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496154	ED	On-Demand	Anodyne	PGA5	43	33
O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496154	ED	On-Demand	Anodyne	PSMB8	49	35
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496155	ED	On-Demand	Anodyne	ACE	41	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496155	ED	On-Demand	Anodyne	MME	63	42
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496155	ED	On-Demand	Anodyne	MC4R	60	38
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496155	ED	On-Demand	Anodyne	TACR2	20	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496155	ED	On-Demand	Anodyne	CTSB	17	46
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496155	ED	On-Demand	Anodyne	TRY2_BOVIN	56	40
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496155	ED	On-Demand	Anodyne	CYSP_TRYCR	23	45
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496155	ED	On-Demand	Anodyne	CTSS	26	47
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496155	ED	On-Demand	Anodyne	ACE2	60	34
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496155	ED	On-Demand	Anodyne	PGA5	43	33
O=C(N[C@H](Cc1ccccc1)C(=O)N1CCOCC1)C(F)=C1CCC1	ZINC000819496155	ED	On-Demand	Anodyne	PSMB8	49	35
CC(=O)Nc1ccc2nc(NC(=O)c3ccccc3CSc3nc(C)cs3)sc2c1	ZINC000819496156	JK	On-Demand	Anodyne	OPRL1	16	41
CC(=O)Nc1ccc2nc(NC(=O)c3ccccc3CSc3nc(C)cs3)sc2c1	ZINC000819496156	JK	On-Demand	Anodyne	CSNK1D	45	40
CC(=O)Nc1ccc2nc(NC(=O)c3ccccc3CSc3nc(C)cs3)sc2c1	ZINC000819496156	JK	On-Demand	Anodyne	PIK3CA	15	40
C[S@@](=O)Cc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819496166	GG	On-Demand	Mild	PAPA1_CARPA	47	47
C[S@@](=O)Cc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819496166	GG	On-Demand	Mild	CCKAR	40	36
C[S@@](=O)Cc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819496166	GG	On-Demand	Mild	FPR1	45	39
C[S@](=O)Cc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819496167	GG	On-Demand	Mild	PAPA1_CARPA	47	47
C[S@](=O)Cc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819496167	GG	On-Demand	Mild	CCKAR	40	36
C[S@](=O)Cc1ccccc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819496167	GG	On-Demand	Mild	FPR1	45	39
C[S@](=O)Cc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819496168	GG	On-Demand	Mild	PAPA1_CARPA	47	47
C[S@](=O)Cc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819496168	GG	On-Demand	Mild	CCKAR	40	36
C[S@](=O)Cc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819496168	GG	On-Demand	Mild	FPR1	45	39
C[S@@](=O)Cc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819496169	GG	On-Demand	Mild	PAPA1_CARPA	47	47
C[S@@](=O)Cc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819496169	GG	On-Demand	Mild	CCKAR	40	36
C[S@@](=O)Cc1ccccc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819496169	GG	On-Demand	Mild	FPR1	45	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000819496170	GD	On-Demand	Anodyne	STAT6	49	33
COc1cc(NC(=O)/C=C\[C@H]2CCCO2)ccc1OC(C)C	ZINC000819496171	DG	On-Demand	Anodyne	ENPP1	54	30
COc1cc(NC(=O)/C=C/[C@@H]2CCCO2)ccc1OC(C)C	ZINC000819496172	DG	On-Demand	Anodyne	ENPP1	54	30
COc1cc(NC(=O)/C=C\[C@@H]2CCCO2)ccc1OC(C)C	ZINC000819496173	DG	On-Demand	Anodyne	ENPP1	54	30
COc1cc(NC(=O)/C=C/[C@H]2CCCO2)ccc1OC(C)C	ZINC000819496174	DG	On-Demand	Anodyne	ENPP1	54	30
COc1cc(NCCC(=O)NC(N)=O)ccc1OCCN(C)C	ZINC000819496208	DC	On-Demand	Anodyne	ENPP1	74	35
COc1cc(NCCC(=O)NC(N)=O)ccc1OCCN(C)C	ZINC000819496208	DC	On-Demand	Anodyne	DRTS_TRYCR	54	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCCCC[C@H]1c1ncon1	ZINC000819496211	FE	On-Demand	Anodyne	CPT1A	67	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCCCC[C@@H]1c1ncon1	ZINC000819496212	FE	On-Demand	Anodyne	CPT1A	67	37
COc1cc(NCCC(=O)N(C)OC)ccc1OCCN(C)C	ZINC000819496216	ED	On-Demand	Anodyne	ENPP1	49	30
COc1cc(NCCC(=O)N(C)OC)ccc1OCCN(C)C	ZINC000819496216	ED	On-Demand	Anodyne	DRTS_TRYCR	50	36
COc1cc(NC[C@@H](C)O)ccc1OCCN(C)C	ZINC000819496238	CD	On-Demand	Anodyne	DRTS_TRYCR	45	31
COc1cc(NC[C@H](C)O)ccc1OCCN(C)C	ZINC000819496239	CD	On-Demand	Anodyne	DRTS_TRYCR	45	31
CSc1ccc(OC[C@@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)cc1	ZINC000819496250	GG	On-Demand	Anodyne	ADRB2	21	43
CSc1ccc(OC[C@@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)cc1	ZINC000819496250	GG	On-Demand	Anodyne	ADRB1	24	41
CSc1ccc(OC[C@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)cc1	ZINC000819496251	GG	On-Demand	Anodyne	ADRB2	21	43
CSc1ccc(OC[C@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)cc1	ZINC000819496251	GG	On-Demand	Anodyne	ADRB1	24	41
COc1cc(NC[C@H](O)Cc2ccccc2)ccc1OCCN(C)C	ZINC000819496276	EF	On-Demand	Anodyne	DRTS_TRYCR	45	32
COc1cc(NC[C@@H](O)Cc2ccccc2)ccc1OCCN(C)C	ZINC000819496277	EF	On-Demand	Anodyne	DRTS_TRYCR	45	32
CCN(C(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000819496278	GF	On-Demand	Anodyne	SIGMAR1	29	40
CCN(C(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000819496278	GF	On-Demand	Anodyne	CCR5	30	41
CCN(C(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2)[C@H]1CCN(Cc2ccccc2)C1	ZINC000819496278	GF	On-Demand	Anodyne	MBTPS1	40	32
CCN(C(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819496280	GF	On-Demand	Anodyne	SIGMAR1	29	40
CCN(C(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819496280	GF	On-Demand	Anodyne	CCR5	30	41
CCN(C(=O)[C@H]1C[C@H]2C=C[C@H]1N(C(=O)OC)C2)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819496280	GF	On-Demand	Anodyne	MBTPS1	40	32
O=C(NCCN(CCN1CCOCC1)C(=O)C(F)=C1CCC1)C(F)=C1CCC1	ZINC000819496329	GE	On-Demand	Anodyne	CASR	45	34
COc1cc(NCC2(O)CCCC2)ccc1OCCN(C)C	ZINC000819496336	DE	On-Demand	Anodyne	ENPP1	45	30
CCC1(CC)CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCS1	ZINC000819496374	GH	On-Demand	Mild	PAPA1_CARPA	30	41
CCC1(CC)CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCS1	ZINC000819496376	GH	On-Demand	Mild	PAPA1_CARPA	30	41
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(F)=C1CCC1	ZINC000819496386	DG	On-Demand	Anodyne	DRD4	20	49
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C(F)=C1CCC1	ZINC000819496388	DG	On-Demand	Anodyne	DRD4	20	49
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(F)=C1CCC1	ZINC000819496389	DG	On-Demand	Anodyne	DRD4	20	49
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C(F)=C1CCC1	ZINC000819496390	DG	On-Demand	Anodyne	DRD4	20	49
Cn1nc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819496399	GF	On-Demand	Mild	PAPA1_CARPA	50	48
Cn1nc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819496399	GF	On-Demand	Mild	CCKAR	43	35
Cn1nc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819496399	GF	On-Demand	Mild	CTSL	20	48
Cn1nc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819496399	GF	On-Demand	Mild	CTSS	15	48
Cn1nc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819496399	GF	On-Demand	Mild	CTSV	41	31
Cn1nc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819496399	GF	On-Demand	Mild	FPR1	42	37
Cn1nc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819496400	GF	On-Demand	Mild	PAPA1_CARPA	50	48
Cn1nc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819496400	GF	On-Demand	Mild	CCKAR	43	35
Cn1nc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819496400	GF	On-Demand	Mild	CTSL	20	48
Cn1nc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819496400	GF	On-Demand	Mild	CTSS	15	48
Cn1nc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819496400	GF	On-Demand	Mild	CTSV	41	31
Cn1nc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c2ccccc21	ZINC000819496400	GF	On-Demand	Mild	FPR1	42	37
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@]12CCCO2	ZINC000819496420	GE	On-Demand	Mild	PAPA1_CARPA	31	42
CCO[C@@H]1C[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@@]12CCCO2	ZINC000819496424	GE	On-Demand	Mild	PAPA1_CARPA	31	42
CCO[C@@H]1C[C@H](NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)[C@]12CCCO2	ZINC000819496426	GE	On-Demand	Mild	PAPA1_CARPA	31	42
CCO[C@@H]1C[C@H](NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)[C@]12CCCO2	ZINC000819496428	GE	On-Demand	Mild	PAPA1_CARPA	31	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000819496456	FG	On-Demand	Anodyne	NAMPT	40	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cc(OC)ncn3)CC1)C2	ZINC000819496465	GD	On-Demand	Anodyne	NPBWR1	44	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cc(OC)ncn3)CC1)C2	ZINC000819496467	GD	On-Demand	Anodyne	NPBWR1	44	33
Cn1cnnc1NC(=O)CC[C@@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819496519	GG	On-Demand	Anodyne	REN	62	41
Cn1cnnc1NC(=O)CC[C@H](CC1CCCCC1)NC(=O)OC(C)(C)C	ZINC000819496520	GG	On-Demand	Anodyne	REN	62	41
CC(=O)Nc1cccc(CC(=O)NC[Si](C)(C)c2ccccc2)c1	ZINC000819496585	EE	On-Demand	Anodyne	PTGIR	17	43
CC(=O)Nc1cccc(CC(=O)NC[Si](C)(C)c2ccccc2)c1	ZINC000819496585	EE	On-Demand	Anodyne	KCNK3	81	38
CC(=O)Nc1cccc(CC(=O)NC[Si](C)(C)c2ccccc2)c1	ZINC000819496585	EE	On-Demand	Anodyne	KCNK9	52	35
C/C=C\C[C@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)C(=O)OCC	ZINC000819496586	ED	On-Demand	Anodyne	CTSK	18	48
C/C=C\C[C@@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)C(=O)OCC	ZINC000819496587	ED	On-Demand	Anodyne	CTSK	18	48
C/C=C/C[C@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)C(=O)OCC	ZINC000819496588	ED	On-Demand	Anodyne	CTSK	18	48
C/C=C/C[C@@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)C(=O)OCC	ZINC000819496589	ED	On-Demand	Anodyne	CTSK	18	48
COc1cccc([S@@](=O)CC(=O)NCCc2ccnn2C)c1	ZINC000819496618	DC	On-Demand	Anodyne	DRD4	41	32
COc1cccc([S@@](=O)CC(=O)NCCc2ccnn2C)c1	ZINC000819496618	DC	On-Demand	Anodyne	MTNR1A	68	39
COc1cccc([S@@](=O)CC(=O)NCCc2ccnn2C)c1	ZINC000819496618	DC	On-Demand	Anodyne	MTNR1B	67	39
CC(=O)Nc1cccc(CC(=O)NOCC(F)F)c1	ZINC000819496627	CD	On-Demand	Anodyne	KCNK3	45	31
CC(=O)Nc1cccc(CC(=O)NOCC(F)F)c1	ZINC000819496627	CD	On-Demand	Anodyne	KCNK9	43	31
COc1cccc([S@@](=O)CC(=O)NCCC2(C)OCCO2)c1	ZINC000819496632	ED	On-Demand	Anodyne	DRD4	43	32
COc1cccc([S@@](=O)CC(=O)NCCC2(C)OCCO2)c1	ZINC000819496632	ED	On-Demand	Anodyne	MTNR1A	52	41
COc1cccc([S@@](=O)CC(=O)NCCC2(C)OCCO2)c1	ZINC000819496632	ED	On-Demand	Anodyne	MTNR1B	45	41
O=C(NOCC(F)F)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819496766	FG	On-Demand	Anodyne	CNR1	56	35
CN(C)c1ccc(NC[C@H](O)COc2ccc(CC#N)cc2)cc1C(F)(F)F	ZINC000819496780	GH	On-Demand	Mild	ADRB1	46	38
CN(C)c1ccc(NC[C@@H](O)COc2ccc(CC#N)cc2)cc1C(F)(F)F	ZINC000819496781	GH	On-Demand	Mild	ADRB1	46	38
COc1cc(NC[C@@H](O)C(F)(F)F)ccc1OCCN(C)C	ZINC000819496784	DD	On-Demand	Anodyne	DRTS_TRYCR	44	31
COc1cc(NC[C@H](O)C(F)(F)F)ccc1OCCN(C)C	ZINC000819496785	DD	On-Demand	Anodyne	DRTS_TRYCR	44	31
COc1cc(NC[C@H](O)Cc2ccc3ccccc3c2)ccc1OCCN(C)C	ZINC000819496786	GH	On-Demand	Anodyne	DRTS_TRYCR	45	31
COc1cc(NC[C@@H](O)Cc2ccc3ccccc3c2)ccc1OCCN(C)C	ZINC000819496787	GH	On-Demand	Anodyne	DRTS_TRYCR	45	31
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000819496805	FG	On-Demand	Anodyne	SIGMAR1	17	40
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000819496806	FG	On-Demand	Anodyne	SIGMAR1	17	40
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000819496807	FG	On-Demand	Anodyne	SIGMAR1	17	40
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCC[C@@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000819496808	FG	On-Demand	Anodyne	SIGMAR1	17	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496830	FE	On-Demand	Anodyne	ACE	46	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496830	FE	On-Demand	Anodyne	OPRM1	49	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496830	FE	On-Demand	Anodyne	MME	51	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496830	FE	On-Demand	Anodyne	CMA1	42	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496830	FE	On-Demand	Anodyne	CTRA_BOVIN	42	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496830	FE	On-Demand	Anodyne	FCER2	43	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496830	FE	On-Demand	Anodyne	TRY1_BOVIN	48	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496830	FE	On-Demand	Anodyne	CYSP_TRYCR	44	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496830	FE	On-Demand	Anodyne	NPFFR2	56	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496830	FE	On-Demand	Anodyne	TIMP3	68	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496830	FE	On-Demand	Anodyne	CELA2A	48	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496830	FE	On-Demand	Anodyne	CAPN1	42	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496830	FE	On-Demand	Anodyne	ACE2	57	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496830	FE	On-Demand	Anodyne	FPR1	41	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496830	FE	On-Demand	Anodyne	GAG-PRO	72	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496830	FE	On-Demand	Anodyne	BRCA1	60	33
COc1cc(NCCC(=O)Nc2cccc(F)c2C)ccc1OCCN(C)C	ZINC000819496831	GH	On-Demand	Anodyne	ENPP1	44	30
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496832	FE	On-Demand	Anodyne	ACE	46	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496832	FE	On-Demand	Anodyne	OPRM1	49	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496832	FE	On-Demand	Anodyne	MME	51	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496832	FE	On-Demand	Anodyne	CMA1	42	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496832	FE	On-Demand	Anodyne	CTRA_BOVIN	42	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496832	FE	On-Demand	Anodyne	FCER2	43	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496832	FE	On-Demand	Anodyne	TRY1_BOVIN	48	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496832	FE	On-Demand	Anodyne	CYSP_TRYCR	44	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496832	FE	On-Demand	Anodyne	NPFFR2	56	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496832	FE	On-Demand	Anodyne	TIMP3	68	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496832	FE	On-Demand	Anodyne	CELA2A	48	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496832	FE	On-Demand	Anodyne	CAPN1	42	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496832	FE	On-Demand	Anodyne	ACE2	57	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496832	FE	On-Demand	Anodyne	FPR1	41	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496832	FE	On-Demand	Anodyne	GAG-PRO	72	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496832	FE	On-Demand	Anodyne	BRCA1	60	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496833	FE	On-Demand	Anodyne	ACE	46	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496833	FE	On-Demand	Anodyne	OPRM1	49	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496833	FE	On-Demand	Anodyne	MME	51	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496833	FE	On-Demand	Anodyne	CMA1	42	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496833	FE	On-Demand	Anodyne	CTRA_BOVIN	42	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496833	FE	On-Demand	Anodyne	FCER2	43	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496833	FE	On-Demand	Anodyne	TRY1_BOVIN	48	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496833	FE	On-Demand	Anodyne	CYSP_TRYCR	44	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496833	FE	On-Demand	Anodyne	NPFFR2	56	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496833	FE	On-Demand	Anodyne	TIMP3	68	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496833	FE	On-Demand	Anodyne	CELA2A	48	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496833	FE	On-Demand	Anodyne	CAPN1	42	36
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496833	FE	On-Demand	Anodyne	ACE2	57	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496833	FE	On-Demand	Anodyne	FPR1	41	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496833	FE	On-Demand	Anodyne	GAG-PRO	72	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496833	FE	On-Demand	Anodyne	BRCA1	60	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496834	FE	On-Demand	Anodyne	ACE	46	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496834	FE	On-Demand	Anodyne	OPRM1	49	39
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496834	FE	On-Demand	Anodyne	MME	51	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496834	FE	On-Demand	Anodyne	CMA1	42	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496834	FE	On-Demand	Anodyne	CTRA_BOVIN	42	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496834	FE	On-Demand	Anodyne	FCER2	43	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496834	FE	On-Demand	Anodyne	TRY1_BOVIN	48	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496834	FE	On-Demand	Anodyne	CYSP_TRYCR	44	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496834	FE	On-Demand	Anodyne	NPFFR2	56	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496834	FE	On-Demand	Anodyne	TIMP3	68	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496834	FE	On-Demand	Anodyne	CELA2A	48	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496834	FE	On-Demand	Anodyne	CAPN1	42	36
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496834	FE	On-Demand	Anodyne	ACE2	57	34
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496834	FE	On-Demand	Anodyne	FPR1	41	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496834	FE	On-Demand	Anodyne	GAG-PRO	72	33
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H](Cc1ccccc1)C(C)=O)C2	ZINC000819496834	FE	On-Demand	Anodyne	BRCA1	60	33
COc1cccc([S@](=O)CC(=O)N2CCN(c3ccc(C)cc3)CC2)c1	ZINC000819496835	FE	On-Demand	Anodyne	DRD4	52	50
COc1cccc([S@](=O)CC(=O)N2CCN(c3ccc(C)cc3)CC2)c1	ZINC000819496835	FE	On-Demand	Anodyne	CCKAR	31	46
COc1cccc([S@@](=O)CC(=O)N2CCN(c3ccc(C)cc3)CC2)c1	ZINC000819496841	FE	On-Demand	Anodyne	DRD4	52	50
COc1cccc([S@@](=O)CC(=O)N2CCN(c3ccc(C)cc3)CC2)c1	ZINC000819496841	FE	On-Demand	Anodyne	CCKAR	31	46
COc1cc(NC[C@H](O)C2CC2)ccc1OCCN(C)C	ZINC000819496871	CD	On-Demand	Anodyne	ENPP1	44	30
COc1cc(NC[C@@H](O)C2CC2)ccc1OCCN(C)C	ZINC000819496873	CD	On-Demand	Anodyne	ENPP1	44	30
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819496888	CE	On-Demand	Anodyne	MME	63	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819496888	CE	On-Demand	Anodyne	FCER2	40	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819496888	CE	On-Demand	Anodyne	NPFFR2	53	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819496888	CE	On-Demand	Anodyne	TIMP3	62	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819496888	CE	On-Demand	Anodyne	REN	50	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819496888	CE	On-Demand	Anodyne	CAPN1	61	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819496888	CE	On-Demand	Anodyne	ACE2	63	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819496888	CE	On-Demand	Anodyne	BRCA1	50	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@@H]1CCCO1	ZINC000819496888	CE	On-Demand	Anodyne	NPFFR1	46	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819496889	CE	On-Demand	Anodyne	MME	63	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819496889	CE	On-Demand	Anodyne	FCER2	40	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819496889	CE	On-Demand	Anodyne	NPFFR2	53	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819496889	CE	On-Demand	Anodyne	TIMP3	62	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819496889	CE	On-Demand	Anodyne	REN	50	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819496889	CE	On-Demand	Anodyne	CAPN1	61	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819496889	CE	On-Demand	Anodyne	ACE2	63	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819496889	CE	On-Demand	Anodyne	BRCA1	50	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/[C@H]1CCCO1	ZINC000819496889	CE	On-Demand	Anodyne	NPFFR1	46	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819496890	CE	On-Demand	Anodyne	MME	63	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819496890	CE	On-Demand	Anodyne	FCER2	40	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819496890	CE	On-Demand	Anodyne	NPFFR2	53	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819496890	CE	On-Demand	Anodyne	TIMP3	62	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819496890	CE	On-Demand	Anodyne	REN	50	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819496890	CE	On-Demand	Anodyne	CAPN1	61	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819496890	CE	On-Demand	Anodyne	ACE2	63	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819496890	CE	On-Demand	Anodyne	BRCA1	50	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@H]1CCCO1	ZINC000819496890	CE	On-Demand	Anodyne	NPFFR1	46	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819496892	CE	On-Demand	Anodyne	MME	63	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819496892	CE	On-Demand	Anodyne	FCER2	40	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819496892	CE	On-Demand	Anodyne	NPFFR2	53	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819496892	CE	On-Demand	Anodyne	TIMP3	62	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819496892	CE	On-Demand	Anodyne	REN	50	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819496892	CE	On-Demand	Anodyne	CAPN1	61	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819496892	CE	On-Demand	Anodyne	ACE2	63	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819496892	CE	On-Demand	Anodyne	BRCA1	50	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C\[C@@H]1CCCO1	ZINC000819496892	CE	On-Demand	Anodyne	NPFFR1	46	36
COc1cc(NC[C@H](O)c2cccc3ccccc23)ccc1OCCN(C)C	ZINC000819496895	GH	On-Demand	Anodyne	DRTS_TRYCR	46	33
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN([C@H](C)c3ccsc3)CC1)C2	ZINC000819496916	GF	On-Demand	Anodyne	NPBWR1	77	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN([C@H](C)c3ccsc3)CC1)C2	ZINC000819496917	GF	On-Demand	Anodyne	NPBWR1	77	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN([C@@H](C)c3ccsc3)CC1)C2	ZINC000819496918	GF	On-Demand	Anodyne	NPBWR1	77	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN([C@@H](C)c3ccsc3)CC1)C2	ZINC000819496920	GF	On-Demand	Anodyne	NPBWR1	77	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)Nc1ccc(OC)c(OC(C)C)c1)C2	ZINC000819497009	GG	On-Demand	Anodyne	ENPP1	68	32
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(OC)c(OC(C)C)c1)C2	ZINC000819497010	GG	On-Demand	Anodyne	ENPP1	68	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCC1(c3ccccc3OC)CCC1)C2	ZINC000819497018	GG	On-Demand	Anodyne	KCNA3	42	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCC1(c3ccccc3OC)CCC1)C2	ZINC000819497019	GG	On-Demand	Anodyne	KCNA3	42	37
O=C(C(F)=C1CCC1)N1CCCC[C@H]1c1ccccc1	ZINC000819497043	CI	On-Demand	Anodyne	CPT1A	60	34
O=C(C(F)=C1CCC1)N1CCCC[C@@H]1c1ccccc1	ZINC000819497044	CI	On-Demand	Anodyne	CPT1A	60	34
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497147	GI	On-Demand	Mild	PAPA1_CARPA	42	45
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497147	GI	On-Demand	Mild	CTSK	19	40
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497147	GI	On-Demand	Mild	CTSL	28	45
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497147	GI	On-Demand	Mild	REN	48	37
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497147	GI	On-Demand	Mild	CTSS	20	45
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497147	GI	On-Demand	Mild	FPR1	46	40
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497147	GI	On-Demand	Mild	XIAP	20	40
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497147	GI	On-Demand	Mild	BIRC2	54	34
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497148	GI	On-Demand	Mild	PAPA1_CARPA	42	45
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497148	GI	On-Demand	Mild	CTSK	19	40
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497148	GI	On-Demand	Mild	CTSL	28	45
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497148	GI	On-Demand	Mild	REN	48	37
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497148	GI	On-Demand	Mild	CTSS	20	45
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497148	GI	On-Demand	Mild	FPR1	46	40
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497148	GI	On-Demand	Mild	XIAP	20	40
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497148	GI	On-Demand	Mild	BIRC2	54	34
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497149	GI	On-Demand	Mild	PAPA1_CARPA	42	45
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497149	GI	On-Demand	Mild	CTSK	19	40
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497149	GI	On-Demand	Mild	CTSL	28	45
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497149	GI	On-Demand	Mild	REN	48	37
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497149	GI	On-Demand	Mild	CTSS	20	45
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497149	GI	On-Demand	Mild	FPR1	46	40
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497149	GI	On-Demand	Mild	XIAP	20	40
C[C@@H]1CCCc2ccccc2[C@@H]1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497149	GI	On-Demand	Mild	BIRC2	54	34
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497150	GI	On-Demand	Mild	PAPA1_CARPA	42	45
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497150	GI	On-Demand	Mild	CTSK	19	40
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497150	GI	On-Demand	Mild	CTSL	28	45
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497150	GI	On-Demand	Mild	REN	48	37
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497150	GI	On-Demand	Mild	CTSS	20	45
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497150	GI	On-Demand	Mild	FPR1	46	40
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497150	GI	On-Demand	Mild	XIAP	20	40
C[C@@H]1CCCc2ccccc2[C@H]1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497150	GI	On-Demand	Mild	BIRC2	54	34
COc1cc(NCCC(=O)Nc2ccccc2)ccc1OCCN(C)C	ZINC000819497179	FG	On-Demand	Anodyne	CPT1A	47	33
COc1cc(NCCC(=O)Nc2ccccc2)ccc1OCCN(C)C	ZINC000819497179	FG	On-Demand	Anodyne	MTNR1B	17	41
COc1cc(NCCC(=O)Nc2ccccc2)ccc1OCCN(C)C	ZINC000819497179	FG	On-Demand	Anodyne	ENPP1	72	35
COc1cc(NCCC(=O)Nc2ccccc2)ccc1OCCN(C)C	ZINC000819497179	FG	On-Demand	Anodyne	DRTS_TRYCR	50	36
CC(=O)Nc1ccc2nc(NC(=O)c3ccccc3NC(=O)c3ccccc3)sc2c1	ZINC000819497212	IJ	On-Demand	Anodyne	LCK	36	47
CC(=O)Nc1ccc2nc(NC(=O)c3ccccc3NC(=O)c3ccccc3)sc2c1	ZINC000819497212	IJ	On-Demand	Anodyne	CSNK1D	46	42
CC(=O)Nc1ccc2nc(NC(=O)c3ccccc3NC(=O)c3ccccc3)sc2c1	ZINC000819497212	IJ	On-Demand	Anodyne	NMT1	38	44
CC(=O)Nc1ccc2nc(NC(=O)c3ccccc3NC(=O)c3ccccc3)sc2c1	ZINC000819497212	IJ	On-Demand	Anodyne	PIK3CA	20	42
CC(=O)Nc1ccc2nc(NC(=O)c3ccccc3NC(=O)c3ccccc3)sc2c1	ZINC000819497212	IJ	On-Demand	Anodyne	GRM4	18	40
CC(=O)Nc1ccc2nc(NC(=O)c3ccccc3NC(=O)c3ccccc3)sc2c1	ZINC000819497212	IJ	On-Demand	Anodyne	NR1H4	20	48
CC(=O)Nc1ccc2nc(NC(=O)c3ccccc3NC(=O)c3ccccc3)sc2c1	ZINC000819497212	IJ	On-Demand	Anodyne	HDAC1	20	44
CC(=O)Nc1ccc2nc(NC(=O)c3ccccc3NC(=O)c3ccccc3)sc2c1	ZINC000819497212	IJ	On-Demand	Anodyne	HSD17B1	15	52
CC(=O)Nc1ccc2nc(NC(=O)c3ccccc3NC(=O)c3ccccc3)sc2c1	ZINC000819497212	IJ	On-Demand	Anodyne	NR2E3	62	41
CC(=O)Nc1ccc2nc(NC(=O)c3ccccc3NC(=O)c3ccccc3)sc2c1	ZINC000819497212	IJ	On-Demand	Anodyne	SMO	21	40
CC(=O)Nc1ccc2nc(NC(=O)c3ccccc3NC(=O)c3ccccc3)sc2c1	ZINC000819497212	IJ	On-Demand	Anodyne	MT-CO2	23	40
CC(=O)Nc1ccc2nc(NC(=O)c3ccccc3NC(=O)c3ccccc3)sc2c1	ZINC000819497212	IJ	On-Demand	Anodyne	KCNK3	90	42
CC(=O)Nc1ccc2nc(NC(=O)c3ccccc3NC(=O)c3ccccc3)sc2c1	ZINC000819497212	IJ	On-Demand	Anodyne	KCNK9	54	36
COc1cc(NCC(C)(C)O)ccc1OCCN(C)C	ZINC000819497231	CD	On-Demand	Anodyne	DRTS_TRYCR	48	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N1CCN(c2cccc(C#N)n2)CC1	ZINC000819497237	FD	On-Demand	Mild	NPBWR1	44	37
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@@H]1c1ccccc1	ZINC000819497239	CG	On-Demand	Anodyne	CPT1A	77	34
COc1cc(NCCC(=O)Nc2ccc(Cl)cc2)ccc1OCCN(C)C	ZINC000819497240	GH	On-Demand	Anodyne	HTR2A	19	44
COc1cc(NCCC(=O)Nc2ccc(Cl)cc2)ccc1OCCN(C)C	ZINC000819497240	GH	On-Demand	Anodyne	CPT1A	49	37
COc1cc(NCCC(=O)Nc2ccc(Cl)cc2)ccc1OCCN(C)C	ZINC000819497240	GH	On-Demand	Anodyne	KDR	15	40
COc1cc(NCCC(=O)Nc2ccc(Cl)cc2)ccc1OCCN(C)C	ZINC000819497240	GH	On-Demand	Anodyne	CPT1B	48	37
COc1cc(NCCC(=O)Nc2ccc(Cl)cc2)ccc1OCCN(C)C	ZINC000819497240	GH	On-Demand	Anodyne	MCHR2	20	44
COc1cc(NCCC(=O)Nc2ccc(Cl)cc2)ccc1OCCN(C)C	ZINC000819497240	GH	On-Demand	Anodyne	ENPP1	72	38
COc1cc(NCCC(=O)Nc2ccc(Cl)cc2)ccc1OCCN(C)C	ZINC000819497240	GH	On-Demand	Anodyne	DRTS_TRYCR	49	36
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@@H]1c1ccccc1	ZINC000819497241	CG	On-Demand	Anodyne	CPT1A	77	34
COc1cc(NC[C@H](O)c2ccc(Cl)cc2)ccc1OCCN(C)C	ZINC000819497242	FG	On-Demand	Anodyne	UTS2	41	34
O=C(/C=C/[C@@H]1CCCO1)N1CCCC[C@H]1c1ccccc1	ZINC000819497243	CG	On-Demand	Anodyne	CPT1A	77	34
O=C(/C=C\[C@@H]1CCCO1)N1CCCC[C@H]1c1ccccc1	ZINC000819497245	CG	On-Demand	Anodyne	CPT1A	77	34
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497274	FD	On-Demand	Anodyne	ACE	39	42
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497274	FD	On-Demand	Anodyne	MME	30	42
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497274	FD	On-Demand	Anodyne	CTSD	31	41
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497274	FD	On-Demand	Anodyne	MC4R	56	37
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497274	FD	On-Demand	Anodyne	TRY2_BOVIN	57	39
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497274	FD	On-Demand	Anodyne	CYSP_TRYCR	19	43
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497274	FD	On-Demand	Anodyne	CYP51A1	21	41
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497274	FD	On-Demand	Anodyne	REN	54	48
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497274	FD	On-Demand	Anodyne	ACE2	43	36
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497274	FD	On-Demand	Anodyne	PGA5	47	36
O=C(/C=C/[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497274	FD	On-Demand	Anodyne	BRCA1	44	31
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497280	FD	On-Demand	Anodyne	ACE	39	42
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497280	FD	On-Demand	Anodyne	MME	30	42
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497280	FD	On-Demand	Anodyne	CTSD	31	41
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497280	FD	On-Demand	Anodyne	MC4R	56	37
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497280	FD	On-Demand	Anodyne	TRY2_BOVIN	57	39
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497280	FD	On-Demand	Anodyne	CYSP_TRYCR	19	43
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497280	FD	On-Demand	Anodyne	CYP51A1	21	41
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497280	FD	On-Demand	Anodyne	REN	54	48
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497280	FD	On-Demand	Anodyne	ACE2	43	36
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497280	FD	On-Demand	Anodyne	PGA5	47	36
O=C(/C=C\[C@@H]1CCCO1)N[C@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497280	FD	On-Demand	Anodyne	BRCA1	44	31
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497283	FD	On-Demand	Anodyne	ACE	39	42
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497283	FD	On-Demand	Anodyne	MME	30	42
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497283	FD	On-Demand	Anodyne	CTSD	31	41
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497283	FD	On-Demand	Anodyne	MC4R	56	37
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497283	FD	On-Demand	Anodyne	TRY2_BOVIN	57	39
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497283	FD	On-Demand	Anodyne	CYSP_TRYCR	19	43
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497283	FD	On-Demand	Anodyne	CYP51A1	21	41
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497283	FD	On-Demand	Anodyne	REN	54	48
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497283	FD	On-Demand	Anodyne	ACE2	43	36
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497283	FD	On-Demand	Anodyne	PGA5	47	36
O=C(/C=C\[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497283	FD	On-Demand	Anodyne	BRCA1	44	31
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497286	FD	On-Demand	Anodyne	ACE	39	42
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497286	FD	On-Demand	Anodyne	MME	30	42
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497286	FD	On-Demand	Anodyne	CTSD	31	41
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497286	FD	On-Demand	Anodyne	MC4R	56	37
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497286	FD	On-Demand	Anodyne	TRY2_BOVIN	57	39
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497286	FD	On-Demand	Anodyne	CYSP_TRYCR	19	43
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497286	FD	On-Demand	Anodyne	CYP51A1	21	41
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497286	FD	On-Demand	Anodyne	REN	54	48
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497286	FD	On-Demand	Anodyne	ACE2	43	36
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497286	FD	On-Demand	Anodyne	PGA5	47	36
O=C(/C=C/[C@@H]1CCCO1)N[C@@H](Cc1ccccc1)C(=O)N1CCOCC1	ZINC000819497286	FD	On-Demand	Anodyne	BRCA1	44	31
CCCC[C@@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)C(=O)OC	ZINC000819497295	ED	On-Demand	Anodyne	CTSK	35	45
CCCC[C@@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)C(=O)OC	ZINC000819497295	ED	On-Demand	Anodyne	PGA5	22	42
CCCC[C@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)C(=O)OC	ZINC000819497297	ED	On-Demand	Anodyne	CTSK	35	45
CCCC[C@H](NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C)C(=O)OC	ZINC000819497297	ED	On-Demand	Anodyne	PGA5	22	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CN(Cc3ccccc3)C[C@@H]1C)C2	ZINC000819497299	GE	On-Demand	Anodyne	DRD4	18	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@@H]1CN(Cc3ccccc3)C[C@H]1C)C2	ZINC000819497302	GE	On-Demand	Anodyne	DRD4	18	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CN(Cc3ccccc3)C[C@@H]1C)C2	ZINC000819497306	GE	On-Demand	Anodyne	DRD4	18	48
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N[C@H]1CN(Cc3ccccc3)C[C@H]1C)C2	ZINC000819497310	GE	On-Demand	Anodyne	DRD4	18	48
CC(C)(CS(C)(=O)=O)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497312	GD	On-Demand	Mild	PAPA1_CARPA	41	51
CC(C)(CS(C)(=O)=O)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497312	GD	On-Demand	Mild	CTSK	15	48
CN(C)c1ccc(NC[C@H](O)c2cccnc2)cc1C(F)(F)F	ZINC000819497314	EG	On-Demand	Anodyne	ADRB1	20	40
CN(C)c1ccc(NC[C@H](O)c2cccnc2)cc1C(F)(F)F	ZINC000819497314	EG	On-Demand	Anodyne	ADRB3	81	45
COCCn1c(NC(=O)/C=C\[C@H]2CCCO2)nc2ccccc21	ZINC000819497315	DE	On-Demand	Anodyne	HRH1	20	41
COCCn1c(NC(=O)/C=C\[C@H]2CCCO2)nc2ccccc21	ZINC000819497315	DE	On-Demand	Anodyne	ITK	44	40
CN(C)c1ccc(NC[C@@H](O)c2cccnc2)cc1C(F)(F)F	ZINC000819497316	EG	On-Demand	Anodyne	ADRB1	20	40
CN(C)c1ccc(NC[C@@H](O)c2cccnc2)cc1C(F)(F)F	ZINC000819497316	EG	On-Demand	Anodyne	ADRB3	81	45
CC(C)(CS(C)(=O)=O)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497317	GD	On-Demand	Mild	PAPA1_CARPA	41	51
CC(C)(CS(C)(=O)=O)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497317	GD	On-Demand	Mild	CTSK	15	48
COc1cc(NCCC(=O)Nc2cc(C)on2)ccc1OCCN(C)C	ZINC000819497318	FE	On-Demand	Anodyne	ENPP1	68	34
COc1cc(NCCC(=O)Nc2cc(C)on2)ccc1OCCN(C)C	ZINC000819497318	FE	On-Demand	Anodyne	DRTS_TRYCR	47	34
COCCn1c(NC(=O)/C=C/[C@H]2CCCO2)nc2ccccc21	ZINC000819497319	DE	On-Demand	Anodyne	HRH1	20	41
COCCn1c(NC(=O)/C=C/[C@H]2CCCO2)nc2ccccc21	ZINC000819497319	DE	On-Demand	Anodyne	ITK	44	40
COCCn1c(NC(=O)/C=C/[C@@H]2CCCO2)nc2ccccc21	ZINC000819497323	DE	On-Demand	Anodyne	HRH1	20	41
COCCn1c(NC(=O)/C=C/[C@@H]2CCCO2)nc2ccccc21	ZINC000819497323	DE	On-Demand	Anodyne	ITK	44	40
COCCn1c(NC(=O)/C=C\[C@@H]2CCCO2)nc2ccccc21	ZINC000819497327	DE	On-Demand	Anodyne	HRH1	20	41
COCCn1c(NC(=O)/C=C\[C@@H]2CCCO2)nc2ccccc21	ZINC000819497327	DE	On-Demand	Anodyne	ITK	44	40
Cc1nnc([C@@H](C)NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819497360	FF	On-Demand	Mild	PAPA1_CARPA	39	45
Cc1nnc([C@@H](C)NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)s1	ZINC000819497363	FF	On-Demand	Mild	PAPA1_CARPA	39	45
COc1cc(NC[C@H](O)c2cccnc2)ccc1OCCN(C)C	ZINC000819497394	EE	On-Demand	Anodyne	ADRB1	19	41
COc1cc(NC[C@H](O)c2cccnc2)ccc1OCCN(C)C	ZINC000819497394	EE	On-Demand	Anodyne	ADRB3	59	45
COc1cc(NC[C@@H](O)c2cccnc2)ccc1OCCN(C)C	ZINC000819497396	EE	On-Demand	Anodyne	ADRB1	19	41
COc1cc(NC[C@@H](O)c2cccnc2)ccc1OCCN(C)C	ZINC000819497396	EE	On-Demand	Anodyne	ADRB3	59	45
COCCn1c(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)nc2ccccc21	ZINC000819497404	FF	On-Demand	Anodyne	ADAM17	21	43
COc1cc(NCC2(O)CCS(=O)(=O)CC2)ccc1OCCN(C)C	ZINC000819497478	FC	On-Demand	Anodyne	ENPP1	44	30
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	ACE	57	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	OPRM1	41	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	MME	128	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	ANPEP	60	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	TACR1	18	45
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	FCER2	79	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	CTSB	44	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	PAPA1_CARPA	63	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	CYSP_TRYCR	46	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	CTSL	39	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	CPA1	52	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	NPFFR2	49	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	TIMP3	56	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	CAPNS1	73	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	MMP3	20	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	MMP8	17	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	HLA-DRB1	57	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	CTSS	16	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	CAPN1	71	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	MMP9	20	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	CAPN2	46	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	ACE2	82	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	MMP7	16	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	FPR1	62	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	BLA1_STEMA	46	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497505	CF	On-Demand	Anodyne	NPFFR1	60	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	ACE	57	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	OPRM1	41	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	MME	128	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	ANPEP	60	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	TACR1	18	45
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	FCER2	79	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	CTSB	44	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	PAPA1_CARPA	63	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	CYSP_TRYCR	46	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	CTSL	39	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	CPA1	52	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	NPFFR2	49	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	TIMP3	56	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	CAPNS1	73	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	MMP3	20	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	MMP8	17	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	HLA-DRB1	57	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	CTSS	16	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	CAPN1	71	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	MMP9	20	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	CAPN2	46	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	ACE2	82	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	MMP7	16	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	FPR1	62	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	BLA1_STEMA	46	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)C(F)=C1CCC1	ZINC000819497506	CF	On-Demand	Anodyne	NPFFR1	60	33
Cc1ccc(OC[C@@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)c(C)c1	ZINC000819497510	FG	On-Demand	Anodyne	ADRB2	19	45
Cc1ccc(OC[C@H](O)CNc2ccc(C(N)=O)cc2OC(C)C)c(C)c1	ZINC000819497514	FG	On-Demand	Anodyne	ADRB2	19	45
C[C@@H](CNc1ccc(N(C)C)c(C(F)(F)F)c1)S(C)(=O)=O	ZINC000819497525	DF	On-Demand	Anodyne	PTK2	40	32
COc1ccc(Nc2nc(COC(=O)c3ccc(NC(=O)C4CC4)cc3)cs2)cc1	ZINC000819497540	HJ	On-Demand	Anodyne	ACR	57	43
COc1ccc(Nc2nc(COC(=O)c3ccc(NC(=O)C4CC4)cc3)cs2)cc1	ZINC000819497540	HJ	On-Demand	Anodyne	TRPC6	39	47
COc1ccc(Nc2nc(COC(=O)c3ccc(NC(=O)C4CC4)cc3)cs2)cc1	ZINC000819497540	HJ	On-Demand	Anodyne	TRPC3	36	47
COc1cc(NC[C@H](O)c2ccccc2)ccc1OCCN(C)C	ZINC000819497617	EF	On-Demand	Anodyne	ESRRG	42	31
COc1cc(NC[C@H](O)c2ccccc2)ccc1OCCN(C)C	ZINC000819497617	EF	On-Demand	Anodyne	DRTS_TRYCR	46	34
COc1cc(NC[C@@H](O)c2ccccc2)ccc1OCCN(C)C	ZINC000819497621	EF	On-Demand	Anodyne	ESRRG	42	31
COc1cc(NC[C@@H](O)c2ccccc2)ccc1OCCN(C)C	ZINC000819497621	EF	On-Demand	Anodyne	DRTS_TRYCR	46	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N(C)c1nc3ccccc3n1C)C2	ZINC000819497623	FE	On-Demand	Anodyne	FASN	19	42
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N(C)c1nc3ccccc3n1C)C2	ZINC000819497627	FE	On-Demand	Anodyne	FASN	19	42
CC(=O)Nc1cccc(CC(=O)NC[C@](C)(O)c2ccccc2Cl)c1	ZINC000819497635	FF	On-Demand	Anodyne	ECR	41	34
CC(=O)Nc1cccc(CC(=O)NC[C@](C)(O)c2ccccc2Cl)c1	ZINC000819497635	FF	On-Demand	Anodyne	KCNK3	55	36
CC(=O)Nc1cccc(CC(=O)NC[C@@](C)(O)c2ccccc2Cl)c1	ZINC000819497638	FF	On-Demand	Anodyne	ECR	41	34
CC(=O)Nc1cccc(CC(=O)NC[C@@](C)(O)c2ccccc2Cl)c1	ZINC000819497638	FF	On-Demand	Anodyne	KCNK3	55	36
O=C(COC(=O)c1ccc(NC(=O)C2CC2)cc1)Nc1cc(Cl)ccc1F	ZINC000819497641	GH	On-Demand	Anodyne	ACR	47	38
Cn1nccc1CCNC(=O)c1nn(-c2cccc(Cl)c2F)c2c1CCC2	ZINC000819497660	GF	On-Demand	Anodyne	CNR1	52	31
COc1cc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)ccc1OC(C)C	ZINC000819497661	FG	On-Demand	Anodyne	ENPP1	55	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)NCc1ccc(C(F)F)cc1)C2	ZINC000819497675	FG	On-Demand	Anodyne	VHL	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)NCc1ccc(C(F)F)cc1)C2	ZINC000819497677	FG	On-Demand	Anodyne	VHL	40	31
CCN(C(=O)/C=C\[C@@H]1CCCO1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819497707	EF	On-Demand	Anodyne	ACHE	24	42
CCN(C(=O)/C=C\[C@@H]1CCCO1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819497707	EF	On-Demand	Anodyne	SIGMAR1	36	44
CCN(C(=O)/C=C\[C@@H]1CCCO1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819497707	EF	On-Demand	Anodyne	CCR5	42	42
CCN(C(=O)/C=C/[C@@H]1CCCO1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000819497708	EF	On-Demand	Anodyne	ACHE	24	42
CCN(C(=O)/C=C/[C@@H]1CCCO1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000819497708	EF	On-Demand	Anodyne	SIGMAR1	36	44
CCN(C(=O)/C=C/[C@@H]1CCCO1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000819497708	EF	On-Demand	Anodyne	CCR5	42	42
CCN(C(=O)/C=C/[C@@H]1CCCO1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819497709	EF	On-Demand	Anodyne	ACHE	24	42
CCN(C(=O)/C=C/[C@@H]1CCCO1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819497709	EF	On-Demand	Anodyne	SIGMAR1	36	44
CCN(C(=O)/C=C/[C@@H]1CCCO1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000819497709	EF	On-Demand	Anodyne	CCR5	42	42
CCN(C(=O)/C=C\[C@@H]1CCCO1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000819497710	EF	On-Demand	Anodyne	ACHE	24	42
CCN(C(=O)/C=C\[C@@H]1CCCO1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000819497710	EF	On-Demand	Anodyne	SIGMAR1	36	44
CCN(C(=O)/C=C\[C@@H]1CCCO1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000819497710	EF	On-Demand	Anodyne	CCR5	42	42
O=C(NCc1cccc(N2CCCS2(=O)=O)c1)C(F)=C1CCC1	ZINC000819497732	EE	On-Demand	Anodyne	CDK1	17	42
COc1cc(N2CCN(C(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)CC2)ncn1	ZINC000819497747	GD	On-Demand	Anodyne	NPBWR1	55	35
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1ccc(-c2ccccc2)cc1	ZINC000819497774	DI	On-Demand	Mild	ADRB3	32	43
C=C(C)C(C)(C)C(=O)NC[C@H](O)c1ccc(-c2ccccc2)cc1	ZINC000819497774	DI	On-Demand	Mild	MME	34	43
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1ccc(-c2ccccc2)cc1	ZINC000819497775	DI	On-Demand	Mild	ADRB3	32	43
C=C(C)C(C)(C)C(=O)NC[C@@H](O)c1ccc(-c2ccccc2)cc1	ZINC000819497775	DI	On-Demand	Mild	MME	34	43
CN(C)c1ncncc1NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497865	FE	On-Demand	Mild	PAPA1_CARPA	38	42
CN(C)c1ncncc1NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819497866	FE	On-Demand	Mild	PAPA1_CARPA	38	42
CC1(CO)CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819497875	FE	On-Demand	Mild	GHRHR	42	36
CC1(CO)CCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819497875	FE	On-Demand	Mild	PAPA1_CARPA	35	44
CC1(CO)CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819497876	FE	On-Demand	Mild	GHRHR	42	36
CC1(CO)CCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC1	ZINC000819497876	FE	On-Demand	Mild	PAPA1_CARPA	35	44
CC(=O)Nc1cccc(CC(=O)NC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819497886	FG	On-Demand	Anodyne	SIGMAR1	22	44
CC(=O)Nc1cccc(CC(=O)NC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819497886	FG	On-Demand	Anodyne	KCNA3	29	44
CC(=O)Nc1cccc(CC(=O)NC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819497886	FG	On-Demand	Anodyne	TIMP3	63	32
COC(=O)c1cn([C@@H]2CCCN(C(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)C2)nn1	ZINC000819497887	GD	On-Demand	Anodyne	PREP	17	41
COC(=O)c1cn([C@H]2CCCN(C(=O)[C@@H]3C[C@@H]3NC(=O)OC(C)(C)C)C2)nn1	ZINC000819497888	GD	On-Demand	Anodyne	PREP	17	41
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3ccnc(C)n3)CC1)C2	ZINC000819497893	FD	On-Demand	Anodyne	NPBWR1	51	34
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3ccnc(C)n3)CC1)C2	ZINC000819497894	FD	On-Demand	Anodyne	NPBWR1	51	34
COc1ccc(NC(=O)[C@@H]2C[C@@H]2NC(=O)OC(C)(C)C)cc1OC(C)C	ZINC000819497911	FG	On-Demand	Anodyne	ENPP1	55	31
COCCn1c(NC(=O)C(F)=C2CCC2)nc2ccccc21	ZINC000819497926	DG	On-Demand	Anodyne	HRH1	17	44
COCCn1c(NC(=O)C(F)=C2CCC2)nc2ccccc21	ZINC000819497926	DG	On-Demand	Anodyne	ITK	37	40
O=C(NCc1cnc(N2CCOCC2)c(F)c1)C(F)=C1CCC1	ZINC000819497997	DE	On-Demand	Anodyne	STAT6	45	33
CC(=O)Nc1ccc2nc(NC(=O)c3ccc(Cl)c(S(=O)(=O)NC(C)(C)C)c3)sc2c1	ZINC000819498019	JI	On-Demand	Anodyne	CA2	16	45
CC(=O)Nc1ccc2nc(NC(=O)c3ccc(Cl)c(S(=O)(=O)NC(C)(C)C)c3)sc2c1	ZINC000819498019	JI	On-Demand	Anodyne	LCK	34	49
CC(=O)Nc1ccc2nc(NC(=O)c3ccc(Cl)c(S(=O)(=O)NC(C)(C)C)c3)sc2c1	ZINC000819498019	JI	On-Demand	Anodyne	CSNK1D	41	40
CC(=O)Nc1ccc2nc(NC(=O)c3ccc(Cl)c(S(=O)(=O)NC(C)(C)C)c3)sc2c1	ZINC000819498019	JI	On-Demand	Anodyne	PIK3CA	18	43
CC(=O)Nc1ccc2nc(NC(=O)c3ccc(Cl)c(S(=O)(=O)NC(C)(C)C)c3)sc2c1	ZINC000819498019	JI	On-Demand	Anodyne	CA4	18	45
CC(=O)Nc1ccc2nc(NC(=O)c3ccc(Cl)c(S(=O)(=O)NC(C)(C)C)c3)sc2c1	ZINC000819498019	JI	On-Demand	Anodyne	FYN	27	41
O=C(NC1CC1)N[C@@H]1CCN(C(=O)C(F)=C2CCC2)C1	ZINC000819498046	CD	On-Demand	Anodyne	EPHX2	27	44
O=C(NC1CC1)N[C@H]1CCN(C(=O)C(F)=C2CCC2)C1	ZINC000819498047	CD	On-Demand	Anodyne	EPHX2	27	44
O=C(CCc1cccc(OC(F)F)c1)NOCC(F)F	ZINC000819498067	CF	On-Demand	Anodyne	PLA2G4A	19	40
O=C(CCc1cccc(OC(F)F)c1)NOCC(F)F	ZINC000819498067	CF	On-Demand	Anodyne	CRTM	48	33
COc1cc(N2CCN(C(=O)[C@@H]3CCCC[C@@H]3C)CC2)cc(OC)c1OC	ZINC000819498073	GG	On-Demand	Clean	NPBWR1	64	30
COc1cc(N2CCN(C(=O)[C@@H]3CCCC[C@H]3C)CC2)cc(OC)c1OC	ZINC000819498074	GG	On-Demand	Clean	NPBWR1	64	30
COc1cc(N2CCN(C(=O)[C@H]3CCCC[C@@H]3C)CC2)cc(OC)c1OC	ZINC000819498075	GG	On-Demand	Clean	NPBWR1	64	30
COc1cc(N2CCN(C(=O)[C@H]3CCCC[C@H]3C)CC2)cc(OC)c1OC	ZINC000819498076	GG	On-Demand	Clean	NPBWR1	64	30
C[C@@H]1CC(C)(C)C[C@](CO)(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819498078	GG	On-Demand	Mild	PAPA1_CARPA	35	47
C[C@@H]1CC(C)(C)C[C@](CO)(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819498079	GG	On-Demand	Mild	PAPA1_CARPA	35	47
C[C@@H]1CC(C)(C)C[C@@](CO)(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819498080	GG	On-Demand	Mild	PAPA1_CARPA	35	47
C[C@@H]1CC(C)(C)C[C@@](CO)(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819498081	GG	On-Demand	Mild	PAPA1_CARPA	35	47
C[C@@H]1CCCC[C@H]1C(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000819498121	DH	On-Demand	Anodyne	OPRL1	15	43
C[C@@H]1CCCC[C@@H]1C(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000819498122	DH	On-Demand	Anodyne	OPRL1	15	43
CC(=O)Nc1cccc(CC(=O)NCCc2ccnn2C)c1	ZINC000819498133	DD	On-Demand	Anodyne	PTGIR	18	45
O=C(Cc1ccc(-n2cnnc2)cc1)NC1CCC(O)(c2cccnc2)CC1	ZINC000819498154	GE	On-Demand	Anodyne	CHRNA7	40	35
O=C(Cc1nsc2ccccc12)N1CCC(O)(c2ccccc2)CC1	ZINC000819498173	FG	On-Demand	Anodyne	DRD2	23	41
O=C(Cc1nsc2ccccc12)N1CCC(O)(c2ccccc2)CC1	ZINC000819498173	FG	On-Demand	Anodyne	OPRL1	18	40
O=C(CCc1cccc(OC(F)F)c1)N1CCC(O)(c2ccccc2)CC1	ZINC000819498181	GH	On-Demand	Anodyne	OPRL1	19	42
O=C(CCc1cccc(OC(F)F)c1)N1CCC(O)(c2ccccc2)CC1	ZINC000819498181	GH	On-Demand	Anodyne	TACR1	15	42
Cc1ccc2c(c1)nc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)n2C	ZINC000819498194	GG	On-Demand	Mild	PAPA1_CARPA	43	43
Cc1ccc2c(c1)nc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)n2C	ZINC000819498195	GG	On-Demand	Mild	PAPA1_CARPA	43	43
Cn1nccc1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819498245	ED	On-Demand	Mild	PAPA1_CARPA	55	51
Cn1nccc1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819498245	ED	On-Demand	Mild	CTSL	21	51
Cn1nccc1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819498245	ED	On-Demand	Mild	CTSS	16	51
Cn1nccc1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819498245	ED	On-Demand	Mild	CTSV	41	31
Cn1nccc1CCNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819498245	ED	On-Demand	Mild	FPR1	43	38
Cn1nccc1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819498246	ED	On-Demand	Mild	PAPA1_CARPA	55	51
Cn1nccc1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819498246	ED	On-Demand	Mild	CTSL	21	51
Cn1nccc1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819498246	ED	On-Demand	Mild	CTSS	16	51
Cn1nccc1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819498246	ED	On-Demand	Mild	CTSV	41	31
Cn1nccc1CCNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819498246	ED	On-Demand	Mild	FPR1	43	38
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC[C@@H]1c1ccccc1)C2	ZINC000819498261	FH	On-Demand	Anodyne	CPT1A	58	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC[C@@H]1c1ccccc1)C2	ZINC000819498261	FH	On-Demand	Anodyne	PREP	40	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCC[C@@H]1c1ccccc1)C2	ZINC000819498262	FH	On-Demand	Anodyne	CPT1A	58	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCC[C@@H]1c1ccccc1)C2	ZINC000819498262	FH	On-Demand	Anodyne	PREP	40	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC[C@H]1c1ccccc1)C2	ZINC000819498263	FH	On-Demand	Anodyne	CPT1A	58	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC[C@H]1c1ccccc1)C2	ZINC000819498263	FH	On-Demand	Anodyne	PREP	40	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCC[C@H]1c1ccccc1)C2	ZINC000819498264	FH	On-Demand	Anodyne	CPT1A	58	35
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCC[C@H]1c1ccccc1)C2	ZINC000819498264	FH	On-Demand	Anodyne	PREP	40	35
O=C(Cc1ccc(-n2cnnc2)cc1)NC1CCC(O)(c2ccccc2)CC1	ZINC000819498278	GF	On-Demand	Anodyne	SIGMAR1	19	46
COc1cccc([S@@](=O)CC(=O)NOCC(F)F)c1	ZINC000819498286	CD	On-Demand	Anodyne	MTNR1A	35	41
COc1cccc([S@@](=O)CC(=O)NOCC(F)F)c1	ZINC000819498286	CD	On-Demand	Anodyne	MTNR1B	37	41
C[C@@H](CC(=O)NC1CCC(O)(c2ccccc2)CC1)n1cccn1	ZINC000819498302	EF	On-Demand	Anodyne	OPRL1	15	44
C[C@H](CC(=O)NC1CCC(O)(c2ccccc2)CC1)n1cccn1	ZINC000819498303	EF	On-Demand	Anodyne	OPRL1	15	44
COc1ccc(NC(=O)/C=C\[C@H]2CCCO2)cc1OC(C)C	ZINC000819498305	DG	On-Demand	Anodyne	ENPP1	54	30
COc1ccc(NC(=O)/C=C/[C@@H]2CCCO2)cc1OC(C)C	ZINC000819498306	DG	On-Demand	Anodyne	ENPP1	54	30
COc1ccc(NC(=O)/C=C\[C@@H]2CCCO2)cc1OC(C)C	ZINC000819498307	DG	On-Demand	Anodyne	ENPP1	54	30
COc1ccc(NC(=O)/C=C/[C@H]2CCCO2)cc1OC(C)C	ZINC000819498308	DG	On-Demand	Anodyne	ENPP1	54	30
CC(=O)Nc1cccc(CC(=O)N2CCC(O)(c3ccccc3)CC2)c1	ZINC000819498335	FF	On-Demand	Anodyne	TACR1	17	40
CC(=O)Nc1cccc(CC(=O)N2CCC(O)(c3ccccc3)CC2)c1	ZINC000819498335	FF	On-Demand	Anodyne	EPHX2	20	44
CC(=O)Nc1cccc(CC(=O)N2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819498343	GI	On-Demand	Anodyne	TACR1	54	43
CC(=O)Nc1cccc(CC(=O)N2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819498343	GI	On-Demand	Anodyne	CCR1	33	41
CC(=O)Nc1cccc(CC(=O)N2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819498343	GI	On-Demand	Anodyne	MLNR	23	43
CC(=O)Nc1cccc(CC(=O)N2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819498343	GI	On-Demand	Anodyne	MTTP	41	34
CC(=O)Nc1cccc(CC(=O)N2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819498343	GI	On-Demand	Anodyne	CCR2	90	42
CC(=O)Nc1cccc(CC(=O)N2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819498343	GI	On-Demand	Anodyne	EPHX2	35	45
CC(=O)Nc1cccc(CC(=O)N2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819498343	GI	On-Demand	Anodyne	MCHR1	52	44
CC(=O)Nc1cccc(CC(=O)N2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819498343	GI	On-Demand	Anodyne	TRPM8	52	39
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819498344	GI	On-Demand	Anodyne	TACR1	54	43
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819498344	GI	On-Demand	Anodyne	CCR1	33	41
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819498344	GI	On-Demand	Anodyne	MLNR	23	43
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819498344	GI	On-Demand	Anodyne	MTTP	41	34
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819498344	GI	On-Demand	Anodyne	CCR2	90	42
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819498344	GI	On-Demand	Anodyne	EPHX2	35	45
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819498344	GI	On-Demand	Anodyne	MCHR1	52	44
CC(=O)Nc1cccc(CC(=O)N2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)c1	ZINC000819498344	GI	On-Demand	Anodyne	TRPM8	52	39
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@]1(C)Cc1ccccc1)C2	ZINC000819498345	FG	On-Demand	Anodyne	SLC12A5	71	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@@]1(C)Cc1ccccc1)C2	ZINC000819498346	FG	On-Demand	Anodyne	SLC12A5	71	44
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC[C@@]1(C)Cc1ccccc1)C2	ZINC000819498347	FG	On-Demand	Anodyne	SLC12A5	71	44
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC[C@]1(C)Cc1ccccc1)C2	ZINC000819498348	FG	On-Demand	Anodyne	SLC12A5	71	44
COc1cccc([S@@](=O)CC(=O)Nc2cnn(C)c2C2CC2)c1	ZINC000819498410	EE	On-Demand	Anodyne	DRD4	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cccc(C#N)n3)CC1)C2	ZINC000819498425	GD	On-Demand	Mild	SSTR1	49	37
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCN(c3cccc(C#N)n3)CC1)C2	ZINC000819498425	GD	On-Demand	Mild	NPBWR1	50	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cccc(C#N)n3)CC1)C2	ZINC000819498426	GD	On-Demand	Mild	SSTR1	49	37
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCN(c3cccc(C#N)n3)CC1)C2	ZINC000819498426	GD	On-Demand	Mild	NPBWR1	50	37
COc1cccc([S@@](=O)CC(=O)NC2CCC(O)(c3ccccc3)CC2)c1	ZINC000819498447	GF	On-Demand	Anodyne	KCNA3	25	40
CCC1(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCCCC1	ZINC000819498477	FI	On-Demand	Mild	PAPA1_CARPA	44	55
CCC1(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CCCCC1	ZINC000819498477	FI	On-Demand	Mild	CTSK	22	49
CCC1(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCCCC1	ZINC000819498478	FI	On-Demand	Mild	PAPA1_CARPA	44	55
CCC1(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CCCCC1	ZINC000819498478	FI	On-Demand	Mild	CTSK	22	49
COc1cccc([S@](=O)CC(=O)N2CCC(O)(c3ccccc3)CC2)c1	ZINC000819498484	FE	On-Demand	Anodyne	OPRL1	23	53
COc1cccc([S@@](=O)CC(=O)N2CCC(O)(c3ccccc3)CC2)c1	ZINC000819498485	FE	On-Demand	Anodyne	OPRL1	23	53
CC(=O)Nc1cccc(CC(=O)N(CCO)CCNC(=O)OC(C)(C)C)c1	ZINC000819498493	GD	On-Demand	Anodyne	NQO2	20	40
O=C(C(F)=C1CCC1)N1CCC(O)(c2ccccc2)CC1	ZINC000819498498	CF	On-Demand	Anodyne	OPRL1	19	42
O=C(C(F)=C1CCC1)N1CCC(O)(c2ccccc2)CC1	ZINC000819498498	CF	On-Demand	Anodyne	CCR1	18	42
Cc1c(NC(=O)[C@H](C)OC(=O)c2ccc(NC(=O)C3CC3)cc2)c(=O)n(-c2ccccc2)n1C	ZINC000819498521	JG	On-Demand	Anodyne	FPR2	63	50
Cc1c(NC(=O)[C@@H](C)OC(=O)c2ccc(NC(=O)C3CC3)cc2)c(=O)n(-c2ccccc2)n1C	ZINC000819498522	JG	On-Demand	Anodyne	FPR2	63	50
CCC1(CC)CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC[S@]1=O	ZINC000819498609	GF	On-Demand	Mild	PAPA1_CARPA	33	40
CCC1(CC)CN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)CC[S@@]1=O	ZINC000819498610	GF	On-Demand	Mild	PAPA1_CARPA	33	40
CCC1(CC)CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC[S@@]1=O	ZINC000819498611	GF	On-Demand	Mild	PAPA1_CARPA	33	40
CCC1(CC)CN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)CC[S@]1=O	ZINC000819498612	GF	On-Demand	Mild	PAPA1_CARPA	33	40
Cn1ncc(NC(=O)c2nn(-c3cccc(Cl)c3F)c3c2CCC3)c1C1CC1	ZINC000819498620	GI	On-Demand	Anodyne	CNR1	53	32
COCC[C@@H]1CCCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819498642	GG	On-Demand	Mild	PAPA1_CARPA	31	40
COCC[C@H]1CCCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819498643	GG	On-Demand	Mild	PAPA1_CARPA	31	40
COCC[C@@H]1CCCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819498644	GG	On-Demand	Mild	PAPA1_CARPA	31	40
COCC[C@H]1CCCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819498645	GG	On-Demand	Mild	PAPA1_CARPA	31	40
O=C(/C=C/[C@@H]1CCCO1)N1CCC(O)(c2ccccc2)CC1	ZINC000819498671	DE	On-Demand	Anodyne	OPRL1	17	41
O=C(/C=C\[C@H]1CCCO1)N1CCC(O)(c2ccccc2)CC1	ZINC000819498672	DE	On-Demand	Anodyne	OPRL1	17	41
O=C(/C=C\[C@@H]1CCCO1)N1CCC(O)(c2ccccc2)CC1	ZINC000819498673	DE	On-Demand	Anodyne	OPRL1	17	41
O=C(/C=C/[C@H]1CCCO1)N1CCC(O)(c2ccccc2)CC1	ZINC000819498674	DE	On-Demand	Anodyne	OPRL1	17	41
C[C@@H](CC(=O)N1CCC(O)(c2ccccc2)CC1)n1cccn1	ZINC000819498704	DE	On-Demand	Anodyne	OPRL1	20	43
C[C@@H](CC(=O)N1CCC(O)(c2ccccc2)CC1)n1cccn1	ZINC000819498704	DE	On-Demand	Anodyne	CCR1	27	40
C[C@@H](CCC1CC1)NC(=O)[C@@H]1C[C@@H]1NC(=O)OC(C)(C)C	ZINC000819498746	CF	On-Demand	Anodyne	CTSK	17	47
COc1cccc([S@@](=O)CC(=O)N[C@H](C)CNC(=O)OC(C)(C)C)c1	ZINC000819498748	FD	On-Demand	Anodyne	MTNR1A	34	40
COc1cccc([S@@](=O)CC(=O)N[C@H](C)CNC(=O)OC(C)(C)C)c1	ZINC000819498748	FD	On-Demand	Anodyne	MTNR1B	35	40
O=C(O)CCNC(=O)c1cnn(CC(=O)NC2CCCC2)c1	ZINC000819498784	DC	On-Demand	Anodyne	GCGR	33	42
O=C(O)CCNC(=O)c1cnn(CC(=O)NC2CCCC2)c1	ZINC000819498784	DC	On-Demand	Anodyne	GIPR	16	42
O=C(O)CCNCc1c(F)cccc1N1CCCC1	ZINC000819498788	CD	On-Demand	Anodyne	KCNQ2	71	39
O=C(O)CCNC(=O)Nc1ccccc1COCc1ccccc1	ZINC000819498789	EF	On-Demand	Anodyne	MME	29	43
O=C(O)CCNC(=O)c1ccccc1C(=O)c1ccc(F)c(F)c1	ZINC000819498790	EE	On-Demand	Anodyne	GCGR	62	38
O=C(O)CCNC(=O)c1ccccc1C(=O)c1ccc(F)c(F)c1	ZINC000819498790	EE	On-Demand	Anodyne	GIPR	43	32
O=C(O)CCN[C@H](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000819498798	CD	On-Demand	Bother	COLA	121	39
O=C(O)CCN[C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1	ZINC000819498799	CD	On-Demand	Bother	COLA	121	39
O=C(O)CCNC(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819498802	DE	On-Demand	Anodyne	HRH2	31	42
O=C(O)CCNC(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819498802	DE	On-Demand	Anodyne	PPIA	42	44
O=C(O)CCNC(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819498802	DE	On-Demand	Anodyne	TBXAS1	67	41
O=C(O)CCNC(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819498802	DE	On-Demand	Anodyne	TRPV1	15	45
O=C(O)CCNC(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819498802	DE	On-Demand	Anodyne	PTGER3	41	38
O=C(O)CCNC(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819498802	DE	On-Demand	Anodyne	CCR3	17	40
O=C(O)CCNC(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819498802	DE	On-Demand	Anodyne	CHRNA7	20	42
O=C(O)CCNC(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819498802	DE	On-Demand	Anodyne	ROCK2	16	41
O=C(O)CCNC(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819498802	DE	On-Demand	Anodyne	FFAR1	37	42
O=C(O)CCNC(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000819498802	DE	On-Demand	Anodyne	NAMPT	50	49
O=C(O)CCNCc1cc(-c2ccccc2)ccc1O	ZINC000819498804	CF	On-Demand	Clean	MME	21	40
O=C(O)CCNC(=O)c1cc(COc2ccc(Cl)cc2Cl)on1	ZINC000819498805	FF	On-Demand	Anodyne	PTGER1	54	38
O=C(O)CCNC(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000819498806	EF	On-Demand	Anodyne	SCD1	38	42
O=C(O)CCNC(=O)Nc1ncc(Cc2ccc(F)c(F)c2)s1	ZINC000819498806	EF	On-Demand	Anodyne	SCD	33	51
O=C(O)CCNC(=O)Nc1cnn(C[C@@H]2CCCO2)c1	ZINC000819498807	CC	On-Demand	Anodyne	PANC	51	33
O=C(O)CCNC(=O)Nc1cnn(C[C@H]2CCCO2)c1	ZINC000819498808	CC	On-Demand	Anodyne	PANC	51	33
O=C(O)CCNC(=O)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000819498809	DE	On-Demand	Anodyne	CDK5	40	35
O=C(O)CCNCc1cc(-c2cccnc2)n[nH]1	ZINC000819498813	BD	On-Demand	Anodyne	TBXAS1	63	39
O=C(O)CCNCc1cc(-c2cccnc2)n[nH]1	ZINC000819498813	BD	On-Demand	Anodyne	CYP2A6	36	42
O=C(O)CCNC(=O)c1c[nH]nc1-c1ccc2c(c1)OCCO2	ZINC000819498815	DD	On-Demand	Anodyne	GIPR	47	32
O=C(O)CCNC(=O)c1c(O)cc(Cl)cc1Cl	ZINC000819498816	CD	On-Demand	Anodyne	ALPL	47	38
O=C(O)CCNC(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819498820	CD	On-Demand	Anodyne	DRD4	48	37
O=C(O)CCNC(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819498820	CD	On-Demand	Anodyne	GCGR	80	46
O=C(O)CCNC(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819498820	CD	On-Demand	Anodyne	RAF1	15	42
O=C(O)CCNC(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819498820	CD	On-Demand	Anodyne	GIPR	69	38
O=C(O)CCNC(=O)c1cccc(OCC(F)(F)F)c1	ZINC000819498820	CD	On-Demand	Anodyne	PDS	55	37
O=C(O)CCNC(=O)c1cc(F)cc(Cl)c1O	ZINC000819498824	CD	On-Demand	Anodyne	AKR1C2	46	37
O=C(O)CCNC(=O)c1cc(F)cc(Cl)c1O	ZINC000819498824	CD	On-Demand	Anodyne	AKR1C1	47	37
O=C(O)CCNC(=O)c1cccc(S(=O)(=O)NCc2ccco2)c1	ZINC000819498826	FC	On-Demand	Anodyne	TBXA2R	41	33
O=C(O)CCNC(=O)Nc1cccnc1N1CCCC1	ZINC000819498827	CD	On-Demand	Anodyne	KCNQ2	71	38
O=C(O)CCNC(=O)Nc1cccnc1N1CCCC1	ZINC000819498827	CD	On-Demand	Anodyne	TRPV1	19	41
O=C(O)CCNC(=O)c1nc(=O)c2ccccc2[nH]1	ZINC000819498828	CC	On-Demand	Anodyne	GRIN2D	70	32
O=C(O)CCNC(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000819498835	EF	On-Demand	Anodyne	SCD1	36	48
O=C(O)CCNC(=O)Nc1ncc(Cc2cc(F)cc(F)c2)s1	ZINC000819498835	EF	On-Demand	Anodyne	SCD	31	48
O=C(O)CCNC1CCN(Cc2c(F)cccc2Cl)CC1	ZINC000819498836	DF	On-Demand	Anodyne	DRD4	29	42
O=C(O)CCNC1CCN(Cc2c(F)cccc2Cl)CC1	ZINC000819498836	DF	On-Demand	Anodyne	SIGMAR1	28	53
O=C(O)CCNC(=O)c1cccc([N+](=O)[O-])c1O	ZINC000819498837	CC	On-Demand	Bother	KCNMA1	17	42
O=C(O)CCNC(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819498838	FG	On-Demand	Anodyne	GCGR	33	42
O=C(O)CCNC(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819498838	FG	On-Demand	Anodyne	MPL	53	50
O=C(O)CCNC(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819498838	FG	On-Demand	Anodyne	ROCK1	24	50
O=C(O)CCNC(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819498838	FG	On-Demand	Anodyne	SPHK2	23	41
O=C(O)CCNC(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819498838	FG	On-Demand	Anodyne	ROCK2	18	47
O=C(O)CCNC(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819498838	FG	On-Demand	Anodyne	PKN1	15	45
O=C(O)CCNC(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819498838	FG	On-Demand	Anodyne	HDAC9	16	45
O=C(O)CCNC(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819498838	FG	On-Demand	Anodyne	SPHK1	22	41
O=C(O)CCNC(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819498838	FG	On-Demand	Anodyne	IKBKE	15	45
O=C(O)CCNC(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819498838	FG	On-Demand	Anodyne	PAK1	15	45
O=C(O)CCNC(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819498838	FG	On-Demand	Anodyne	GIPR	59	42
O=C(O)CCNC(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000819498838	FG	On-Demand	Anodyne	DMPK	15	45
O=C(O)CCNC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O	ZINC000819498839	ED	On-Demand	Anodyne	GIPR	45	35
O=C(O)CCNC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O	ZINC000819498839	ED	On-Demand	Anodyne	CTSA	16	41
O=C(O)CCNC1CCN(CCc2ccc(F)cc2)CC1	ZINC000819498840	CD	On-Demand	Anodyne	DRD2	25	56
O=C(O)CCNC1CCN(CCc2ccc(F)cc2)CC1	ZINC000819498840	CD	On-Demand	Anodyne	DRD4	30	46
O=C(O)CCNC1CCN(CCc2ccc(F)cc2)CC1	ZINC000819498840	CD	On-Demand	Anodyne	HTR2A	35	56
O=C(O)CCNC1CCN(CCc2ccc(F)cc2)CC1	ZINC000819498840	CD	On-Demand	Anodyne	HTR2C	16	56
O=C(O)CCNC1CCN(CCc2ccc(F)cc2)CC1	ZINC000819498840	CD	On-Demand	Anodyne	HRH1	20	43
O=C(O)CCNC1CCN(CCc2ccc(F)cc2)CC1	ZINC000819498840	CD	On-Demand	Anodyne	SLC6A3	20	45
O=C(O)CCNC1CCN(CCc2ccc(F)cc2)CC1	ZINC000819498840	CD	On-Demand	Anodyne	KCNH2	21	44
O=C(O)CCNC1CCN(CCc2ccc(F)cc2)CC1	ZINC000819498840	CD	On-Demand	Anodyne	SIGMAR1	48	54
O=C(O)CCNC1CCN(CCc2ccc(F)cc2)CC1	ZINC000819498840	CD	On-Demand	Anodyne	CCR3	96	48
O=C(O)CCNC1CCN(CCc2ccc(F)cc2)CC1	ZINC000819498840	CD	On-Demand	Anodyne	MLNR	25	42
O=C(O)CCNC1CCN(CCc2ccc(F)cc2)CC1	ZINC000819498840	CD	On-Demand	Anodyne	MCHR1	30	42
O=C(O)CCNC1CCN(CCc2ccc(F)cc2)CC1	ZINC000819498840	CD	On-Demand	Anodyne	CACNA1G	41	47
O=C(O)CCNC1CCN(CCc2ccc(F)cc2)CC1	ZINC000819498840	CD	On-Demand	Anodyne	BIRC2	27	40
O=C(O)CCNC(=O)Nc1ncc(Cc2ccccc2Cl)s1	ZINC000819498841	EF	On-Demand	Anodyne	CDK5	23	43
O=C(O)CCNC1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000819498842	CD	On-Demand	Bother	SSTR1	41	42
O=C(O)CCNCc1c[nH]nc1-c1ccc2c(c1)OCO2	ZINC000819498844	CD	On-Demand	Anodyne	LTB4R	21	42
O=C(O)CCNCc1c[nH]nc1-c1ccc2c(c1)OCO2	ZINC000819498844	CD	On-Demand	Anodyne	TGFBR1	19	41
O=C(O)CCNCc1c[nH]nc1-c1ccc2c(c1)OCO2	ZINC000819498844	CD	On-Demand	Anodyne	CLK4	50	35
O=C(O)CCNC(=O)Nc1cnn(-c2ccccc2)c1	ZINC000819498849	CD	On-Demand	Anodyne	MAPK10	18	44
O=C(O)CCNC(=O)Nc1cnn(CC(=O)NC2CCCC2)c1	ZINC000819498853	DC	On-Demand	Anodyne	EPHX2	17	41
O=C(O)CCNC(=O)Nc1cnn(CCN2CCOCC2)c1	ZINC000819498856	DB	On-Demand	Anodyne	EPHX2	23	45
O=C(O)CCN[C@H]1CCSc2ccc(Br)cc21	ZINC000819498857	DG	On-Demand	Anodyne	LUXR	15	40
O=C(O)CCN[C@@H]1CCSc2ccc(Br)cc21	ZINC000819498858	DG	On-Demand	Anodyne	LUXR	15	40
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	F2	91	47
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	PLG	39	43
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	PRSS1	35	45
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	ACE	59	54
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	FKBP1A	74	48
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	OPRM1	35	43
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	OPRD1	22	42
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	P2RY12	18	42
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	CELA1	48	62
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	CHRM4	18	44
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	GRIN2B	23	41
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	ELANE	47	48
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	LTA4H	19	41
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	TACR1	20	40
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	HLA-DRB3	45	35
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	CMA1	38	44
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	CTRA_BOVIN	66	36
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	TRY1_BOVIN	100	43
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	NTSR1	62	34
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	NTSR2	62	32
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	CTSG	46	36
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	CTSK	17	56
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	HLA-A	56	34
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	DPP4	23	49
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	PREP	116	63
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	CELA2A	54	36
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	LGMN	102	59
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	GHSR	18	42
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	CTRC	19	44
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	ACE2	23	46
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	KLK5	50	55
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	TPP2	35	40
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	XIAP	57	48
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	BRCA1	64	35
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	SLC12A5	69	40
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	Q9NAW4_PLAFA	37	40
O=C(O)CCNC(=O)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000819498859	DD	On-Demand	Anodyne	TMPRSS11D	78	46
O=C(O)CCNC(=O)c1ccc2nc(Cl)ccc2c1	ZINC000819498860	CE	On-Demand	Anodyne	GCGR	93	42
O=C(O)CCNC(=O)c1ccc2nc(Cl)ccc2c1	ZINC000819498860	CE	On-Demand	Anodyne	HDAC9	15	49
O=C(O)CCNC(=O)c1ccc2nc(Cl)ccc2c1	ZINC000819498860	CE	On-Demand	Anodyne	GIPR	84	39
O=C(O)CCNC(=O)c1ccc2nc(Cl)ccc2c1	ZINC000819498860	CE	On-Demand	Anodyne	KDM4E	22	40
O=C(O)CCN[C@@H]1CCc2ccc(OC(F)(F)F)cc21	ZINC000819498862	CF	On-Demand	Anodyne	GCGR	31	46
O=C(O)CCN[C@@H]1CCc2ccc(OC(F)(F)F)cc21	ZINC000819498862	CF	On-Demand	Anodyne	NQO2	22	43
O=C(O)CCN[C@@H]1CCc2ccc(OC(F)(F)F)cc21	ZINC000819498862	CF	On-Demand	Anodyne	GIPR	40	40
O=C(O)CCN[C@H]1CCc2ccc(OC(F)(F)F)cc21	ZINC000819498863	CF	On-Demand	Anodyne	GCGR	31	46
O=C(O)CCN[C@H]1CCc2ccc(OC(F)(F)F)cc21	ZINC000819498863	CF	On-Demand	Anodyne	NQO2	22	43
O=C(O)CCN[C@H]1CCc2ccc(OC(F)(F)F)cc21	ZINC000819498863	CF	On-Demand	Anodyne	GIPR	40	40
O=C(O)CCNC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1	ZINC000819498869	DE	On-Demand	Anodyne	ITK	15	44
O=C(O)CCNC(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1	ZINC000819498869	DE	On-Demand	Anodyne	PANC	44	43
O=C(O)CCNC(=O)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000819498870	DE	On-Demand	Anodyne	SCD1	38	41
O=C(O)CCNC(=O)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000819498870	DE	On-Demand	Anodyne	SCD	34	41
O=C(O)CCNC(=O)c1ccc(-n2cccc2)nc1	ZINC000819498873	CD	On-Demand	Anodyne	GCGR	66	41
O=C(O)CCNC(=O)c1ccc(-n2cccc2)nc1	ZINC000819498873	CD	On-Demand	Anodyne	GIPR	48	34
O=C(O)CCNC(=O)Nc1ccnc(Oc2ccccc2Br)c1	ZINC000819498874	GG	On-Demand	Anodyne	ADRB1	42	33
O=C(O)CCNC(=O)c1ccc2c(O)nc(S)nc2c1	ZINC000819498875	CC	On-Demand	Anodyne	GCGR	59	34
O=C(O)CCNC(=O)c1ccc2c(O)nc(S)nc2c1	ZINC000819498875	CC	On-Demand	Anodyne	GIPR	64	33
O=C(O)CCN[C@@H]1CCC[C@@H]1c1ccc(F)cc1	ZINC000819498876	CF	On-Demand	Anodyne	SSTR3	28	41
O=C(O)CCN[C@H]1CCC[C@@H]1c1ccc(F)cc1	ZINC000819498878	CF	On-Demand	Anodyne	SSTR3	28	41
O=C(O)CCN[C@@H]1CCC[C@H]1c1ccc(F)cc1	ZINC000819498879	CF	On-Demand	Anodyne	SSTR3	28	41
O=C(O)CCN[C@H]1CCC[C@H]1c1ccc(F)cc1	ZINC000819498880	CF	On-Demand	Anodyne	SSTR3	28	41
C[C@@H]1CCCC[C@H]1C(=O)N1CCC(O)(c2ccccc2)CC1	ZINC000819498903	DG	On-Demand	Anodyne	OPRL1	28	47
C[C@@H]1CCCC[C@H]1C(=O)N1CCC(O)(c2ccccc2)CC1	ZINC000819498903	DG	On-Demand	Anodyne	CTSK	17	43
C[C@@H]1CCCC[C@@H]1C(=O)N1CCC(O)(c2ccccc2)CC1	ZINC000819498905	DG	On-Demand	Anodyne	OPRL1	28	47
C[C@@H]1CCCC[C@@H]1C(=O)N1CCC(O)(c2ccccc2)CC1	ZINC000819498905	DG	On-Demand	Anodyne	CTSK	17	43
O=C(Cc1ccc(-n2cnnc2)cc1)N1CCC(O)(c2ccccc2)CC1	ZINC000819498945	FE	On-Demand	Anodyne	KCNJ1	63	39
COC[C@@H]1CCCCN(C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819498951	FF	On-Demand	Mild	PAPA1_CARPA	32	42
COC[C@@H]1CCCCN(C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)C1	ZINC000819498953	FF	On-Demand	Mild	PAPA1_CARPA	32	42
C=C(C)C(C)(C)C(=O)N1CCC(O)(c2ccccc2)CC1	ZINC000819498963	CG	On-Demand	Mild	OPRL1	24	44
C=C(C)C(C)(C)C(=O)N1CCC(O)(c2ccccc2)CC1	ZINC000819498963	CG	On-Demand	Mild	CCR1	35	40
O=C([C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F)N1CCC(O)(c2ccccc2)CC1	ZINC000819498964	GI	On-Demand	Anodyne	OPRL1	21	40
O=C(O)CCNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819498981	FC	On-Demand	Anodyne	GCGR	80	37
O=C(O)CCNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819498981	FC	On-Demand	Anodyne	CNR2	20	58
O=C(O)CCNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819498981	FC	On-Demand	Anodyne	PLD2	50	36
O=C(O)CCNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1	ZINC000819498981	FC	On-Demand	Anodyne	GIPR	66	34
O=C(O)CCNC(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000819498983	DE	On-Demand	Anodyne	CDK5	43	42
O=C(O)CCNC(=O)Nc1cnn(-c2ccccc2F)c1	ZINC000819498984	CD	On-Demand	Anodyne	MAPK10	15	40
O=C(O)CCN[C@H](Cc1ccccc1)C1CC1	ZINC000819498988	BE	On-Demand	Anodyne	ACE	70	39
O=C(O)CCN[C@H](Cc1ccccc1)C1CC1	ZINC000819498988	BE	On-Demand	Anodyne	FOLH1	17	40
O=C(O)CCN[C@H](Cc1ccccc1)C1CC1	ZINC000819498988	BE	On-Demand	Anodyne	MME	133	52
O=C(O)CCN[C@H](Cc1ccccc1)C1CC1	ZINC000819498988	BE	On-Demand	Anodyne	ANPEP	48	37
O=C(O)CCN[C@H](Cc1ccccc1)C1CC1	ZINC000819498988	BE	On-Demand	Anodyne	CPA1	51	39
O=C(O)CCN[C@H](Cc1ccccc1)C1CC1	ZINC000819498988	BE	On-Demand	Anodyne	TIMP3	45	33
O=C(O)CCN[C@H](Cc1ccccc1)C1CC1	ZINC000819498988	BE	On-Demand	Anodyne	NAALAD2	29	41
O=C(O)CCN[C@@H](Cc1ccccc1)C1CC1	ZINC000819498989	BE	On-Demand	Anodyne	ACE	70	39
O=C(O)CCN[C@@H](Cc1ccccc1)C1CC1	ZINC000819498989	BE	On-Demand	Anodyne	FOLH1	17	40
O=C(O)CCN[C@@H](Cc1ccccc1)C1CC1	ZINC000819498989	BE	On-Demand	Anodyne	MME	133	52
O=C(O)CCN[C@@H](Cc1ccccc1)C1CC1	ZINC000819498989	BE	On-Demand	Anodyne	ANPEP	48	37
O=C(O)CCN[C@@H](Cc1ccccc1)C1CC1	ZINC000819498989	BE	On-Demand	Anodyne	CPA1	51	39
O=C(O)CCN[C@@H](Cc1ccccc1)C1CC1	ZINC000819498989	BE	On-Demand	Anodyne	TIMP3	45	33
O=C(O)CCN[C@@H](Cc1ccccc1)C1CC1	ZINC000819498989	BE	On-Demand	Anodyne	NAALAD2	29	41
O=C(O)CCNC(=O)Nc1ccnc(Oc2ccccc2Cl)c1	ZINC000819498992	EG	On-Demand	Anodyne	ADRB1	41	32
O=C(O)CCNC(=O)Nc1ccnc(Oc2ccccc2Cl)c1	ZINC000819498992	EG	On-Demand	Anodyne	CXCL8	17	40
O=C(O)CCNC(=O)Nc1ccnc(Oc2ccccc2Cl)c1	ZINC000819498992	EG	On-Demand	Anodyne	TYK2	49	33
O=C(O)CCNC(=O)Nc1ncc(-c2ccccc2)s1	ZINC000819498993	CE	On-Demand	Anodyne	ADRB1	42	32
O=C(O)CCNC(=O)Nc1ncc(-c2ccccc2)s1	ZINC000819498993	CE	On-Demand	Anodyne	MME	19	40
O=C(O)CCNC(=O)Nc1ncc(-c2ccccc2)s1	ZINC000819498993	CE	On-Demand	Anodyne	PI4KB	21	42
O=C(O)CCNC(=O)Nc1ncc(-c2ccccc2)s1	ZINC000819498993	CE	On-Demand	Anodyne	CDK5	39	40
O=C(O)CCNC(=O)Nc1ncc(-c2ccccc2)s1	ZINC000819498993	CE	On-Demand	Anodyne	CHEK1	42	32
O=C(O)CCNC1CCN(Cc2ccncc2)CC1	ZINC000819499001	CD	On-Demand	Anodyne	DRD4	37	45
O=C(O)CCNC1CCN(Cc2ccncc2)CC1	ZINC000819499001	CD	On-Demand	Anodyne	ACHE	38	50
O=C(O)CCNC1CCN(Cc2ccncc2)CC1	ZINC000819499001	CD	On-Demand	Anodyne	LTA4H	15	40
O=C(O)CCNC1CCN(Cc2ccncc2)CC1	ZINC000819499001	CD	On-Demand	Anodyne	SIGMAR1	39	49
O=C(O)CCNC1CCN(Cc2ccncc2)CC1	ZINC000819499001	CD	On-Demand	Anodyne	SSTR5	57	38
O=C(O)CCNC1CCN(Cc2ccncc2)CC1	ZINC000819499001	CD	On-Demand	Anodyne	MCHR1	47	42
O=C(O)CCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000819499002	DE	On-Demand	Anodyne	DRD4	17	47
O=C(O)CCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000819499002	DE	On-Demand	Anodyne	SIGMAR1	15	40
O=C(O)CCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000819499002	DE	On-Demand	Anodyne	P2RX7	25	40
O=C(O)CCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000819499002	DE	On-Demand	Anodyne	EPHX2	20	54
O=C(O)CCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000819499002	DE	On-Demand	Anodyne	SFRP1	36	46
O=C(O)CCNC1CCN(C(=O)c2ccccc2Cl)CC1	ZINC000819499002	DE	On-Demand	Anodyne	L3MBTL3	68	45
O=C(O)CCNC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	ZINC000819499004	FD	On-Demand	Anodyne	CA2	20	54
O=C(O)CCNC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	ZINC000819499004	FD	On-Demand	Anodyne	GCGR	47	35
O=C(O)CCNC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	ZINC000819499004	FD	On-Demand	Anodyne	MAP1	75	36
O=C(O)CCNC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	ZINC000819499004	FD	On-Demand	Anodyne	CA4	15	43
O=C(O)CCNC(=O)c1ccc(S(=O)(=O)Nc2nccs2)cc1	ZINC000819499004	FD	On-Demand	Anodyne	GIPR	63	35
O=C(O)CCNC(=O)Nc1cnn(-c2ccccc2Cl)c1	ZINC000819499005	DE	On-Demand	Anodyne	MAPK10	17	43
O=C(O)CCNC(=O)Nc1cccc(S(=O)(=O)Nc2nccs2)c1	ZINC000819499006	FD	On-Demand	Anodyne	MAP1	71	34
O=C(O)CCNC(=O)c1ccc(NC(=O)c2cc(F)cc(F)c2)cc1O	ZINC000819499008	FE	On-Demand	Anodyne	KCNK3	45	40
O=C(O)CCNC1CCN(c2ccc(F)cc2F)CC1	ZINC000819499009	CD	On-Demand	Anodyne	NPY2R	52	39
O=C(O)CCNC(=O)Nc1cccn(Cc2ccccc2)c1=O	ZINC000819499010	DD	On-Demand	Anodyne	MME	18	40
O=C(O)CCNC(=O)Nc1cccn(Cc2ccccc2)c1=O	ZINC000819499010	DD	On-Demand	Anodyne	PTGER3	16	55
O=C(O)CCNC(=O)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000819499012	EF	On-Demand	Anodyne	SCD1	39	51
O=C(O)CCNC(=O)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000819499012	EF	On-Demand	Anodyne	SCD	34	51
O=C(O)CCNC(=S)NCc1ccc(OC(F)(F)F)cc1	ZINC000819499014	DE	On-Demand	Anodyne	GCGR	42	47
O=C(O)CCNC(=S)NCc1ccc(OC(F)(F)F)cc1	ZINC000819499014	DE	On-Demand	Anodyne	GIPR	40	45
O=C(O)CCNC(=O)Nc1cnc(-c2ccccc2)nc1	ZINC000819499015	CD	On-Demand	Anodyne	ADRB1	45	35
O=C(O)CCNC(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000819499016	DE	On-Demand	Anodyne	ADRB1	42	38
O=C(O)CCNC(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000819499016	DE	On-Demand	Anodyne	CA1	27	41
O=C(O)CCNC(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000819499016	DE	On-Demand	Anodyne	P2RY1	23	41
O=C(O)CCNC(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000819499016	DE	On-Demand	Anodyne	RAF1	22	40
O=C(O)CCNC(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000819499016	DE	On-Demand	Anodyne	GRM4	17	42
O=C(O)CCNC(=O)Nc1cccc(Oc2ccccn2)c1	ZINC000819499016	DE	On-Demand	Anodyne	EPHX2	15	40
O=C(O)CCNC(=O)Nc1cccc(Oc2ncc(Br)cn2)c1	ZINC000819499019	GF	On-Demand	Anodyne	RAF1	20	40
O=C(O)CCNC(=O)Nc1ccccc1N1CCc2ccccc21	ZINC000819499021	EF	On-Demand	Anodyne	KCNQ2	69	38
O=C(O)CCN[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000819499023	BE	On-Demand	Anodyne	GRIA4	19	48
O=C(O)CCN[C@H]1CCC[C@@H]1c1ccccc1	ZINC000819499024	BE	On-Demand	Anodyne	GRIA4	19	48
O=C(O)CCN[C@@H]1CCC[C@H]1c1ccccc1	ZINC000819499025	BE	On-Demand	Anodyne	GRIA4	19	48
O=C(O)CCN[C@H]1CCC[C@H]1c1ccccc1	ZINC000819499026	BE	On-Demand	Anodyne	GRIA4	19	48
O=C(O)CCNC(=O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1	ZINC000819499027	EE	On-Demand	Anodyne	GCGR	25	48
O=C(O)CCNC(=O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1	ZINC000819499027	EE	On-Demand	Anodyne	MAPK10	17	42
O=C(O)CCNC(=O)Nc1cnn(-c2cccc(C(F)(F)F)c2)c1	ZINC000819499027	EE	On-Demand	Anodyne	EPHX2	15	43
O=C(O)CCNCc1c[nH]nc1-c1cccc(Cl)c1	ZINC000819499029	CE	On-Demand	Anodyne	MAPK1	23	48
O=C(O)CCN[C@H]1CCOc2c(Br)cccc21	ZINC000819499031	DE	On-Demand	Anodyne	LUXR	47	37
O=C(O)CCN[C@@H]1CCOc2c(Br)cccc21	ZINC000819499032	DE	On-Demand	Anodyne	LUXR	47	37
O=C(O)CCNC(=O)Nc1ccnc(Oc2ccccc2)c1	ZINC000819499034	DE	On-Demand	Anodyne	ADRB1	40	34
O=C(O)CCNC(=O)Nc1ccnc(Oc2ccccc2)c1	ZINC000819499034	DE	On-Demand	Anodyne	LTA4H	18	42
O=C(O)CCNC(=O)c1ccc(F)c(I)c1	ZINC000819499038	ED	On-Demand	Anodyne	GCGR	89	39
O=C(O)CCNC(=O)c1ccc(F)c(I)c1	ZINC000819499038	ED	On-Demand	Anodyne	GIPR	79	37
O=C(O)CCNC(=O)c1cnc2ccccn12	ZINC000819499043	BC	On-Demand	Anodyne	EPHB3	24	54
O=C(O)CCNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819499044	EC	On-Demand	Anodyne	CA4	15	47
O=C(O)CCNC(=O)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000819499044	EC	On-Demand	Anodyne	TGM2	40	36
O=C(O)CCNC1CCN(Cc2ccccc2Cl)CC1	ZINC000819499049	CE	On-Demand	Anodyne	DRD2	16	46
O=C(O)CCNC1CCN(Cc2ccccc2Cl)CC1	ZINC000819499049	CE	On-Demand	Anodyne	DRD4	41	58
O=C(O)CCNC1CCN(Cc2ccccc2Cl)CC1	ZINC000819499049	CE	On-Demand	Anodyne	ACHE	33	43
O=C(O)CCNC1CCN(Cc2ccccc2Cl)CC1	ZINC000819499049	CE	On-Demand	Anodyne	DRD3	17	46
O=C(O)CCNC1CCN(Cc2ccccc2Cl)CC1	ZINC000819499049	CE	On-Demand	Anodyne	OPRL1	15	42
O=C(O)CCNC1CCN(Cc2ccccc2Cl)CC1	ZINC000819499049	CE	On-Demand	Anodyne	SIGMAR1	39	59
O=C(O)CCNC1CCN(Cc2ccccc2Cl)CC1	ZINC000819499049	CE	On-Demand	Anodyne	SSTR5	18	40
O=C(O)CCNC1CCN(Cc2ccccc2Cl)CC1	ZINC000819499049	CE	On-Demand	Anodyne	CCR3	33	42
O=C(O)CCNC1CCN(Cc2ccccc2Cl)CC1	ZINC000819499049	CE	On-Demand	Anodyne	MCHR1	30	43
O=C(O)CCNC(=O)Nc1cccnc1N1CCOCC1	ZINC000819499050	CC	On-Demand	Anodyne	TRPV1	17	43
O=C(O)CCNC(=O)Nc1cccnc1N1CCOCC1	ZINC000819499050	CC	On-Demand	Anodyne	PIK3CA	46	39
O=C(O)CCNC(=O)Nc1cccnc1N1CCOCC1	ZINC000819499050	CC	On-Demand	Anodyne	MTOR	61	41
O=C(O)CCNC(=O)Nc1cccnc1N1CCOCC1	ZINC000819499050	CC	On-Demand	Anodyne	SCN10A	18	41
O=C(O)CCNC/C=C/c1ccccc1[N+](=O)[O-]	ZINC000819499054	CD	On-Demand	Bother	TLR4	15	50
O=C(O)CCNC/C=C\c1ccccc1[N+](=O)[O-]	ZINC000819499055	CD	On-Demand	Bother	TLR4	15	50
O=C(O)CCNC(=O)c1ccccc1NCc1cccnc1	ZINC000819499061	CD	On-Demand	Anodyne	MME	15	41
O=C(O)CCNC(=O)c1ccccc1NCc1cccnc1	ZINC000819499061	CD	On-Demand	Anodyne	TBXAS1	79	48
O=C(O)CCNC(=O)c1ccccc1NCc1cccnc1	ZINC000819499061	CD	On-Demand	Anodyne	PTAFR	18	44
O=C(O)CCNC(=O)c1ccccc1NCc1cccnc1	ZINC000819499061	CD	On-Demand	Anodyne	NAMPT	64	43
O=C(O)CCNC(=O)c1cc(-c2ccc3c(c2)CCO3)no1	ZINC000819499065	DD	On-Demand	Anodyne	GIPR	44	38
O=C(O)CCNC(=O)Nc1ccccc1COc1ccccc1	ZINC000819499066	DF	On-Demand	Anodyne	MME	19	41
O=C(O)CCNC(=O)Nc1ccccc1COc1ccccc1	ZINC000819499066	DF	On-Demand	Anodyne	LTA4H	21	42
O=C(O)CCNC(=O)Nc1ccccc1COc1ccccc1	ZINC000819499066	DF	On-Demand	Anodyne	FFAR1	34	46
O=C(O)CCNC(=O)Nc1ccccc1COc1ccccc1	ZINC000819499066	DF	On-Demand	Anodyne	FFAR4	56	44
O=C(O)CCNC(=O)Nc1nnc(-c2ccccc2)s1	ZINC000819499068	CD	On-Demand	Anodyne	MME	23	42
O=C(O)CCNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1O	ZINC000819499069	EC	On-Demand	Anodyne	NAMPT	29	41
O=C(O)CCNC(=O)Nc1cccn(Cc2ccc(F)cc2)c1=O	ZINC000819499070	ED	On-Demand	Anodyne	PTGER3	15	50
O=C(O)CCNC(=O)Nc1cccnc1OCc1ccccc1	ZINC000819499072	DE	On-Demand	Anodyne	PPIA	47	48
O=C(O)CCNC(=O)Nc1cccnc1OCc1ccccc1	ZINC000819499072	DE	On-Demand	Anodyne	MME	19	40
O=C(O)CCNC(=O)Nc1cccnc1OCc1ccccc1	ZINC000819499072	DE	On-Demand	Anodyne	P2RY1	43	41
O=C(O)CCNC(=O)Nc1cccnc1OCc1ccccc1	ZINC000819499072	DE	On-Demand	Anodyne	FFAR1	20	40
O=C(O)CCNC(=O)Nc1cccnc1Oc1ccccc1	ZINC000819499073	DE	On-Demand	Anodyne	P2RY1	61	51
O=C(O)CCNC(=O)Nc1ccn(CCN2CCOCC2)n1	ZINC000819499074	DB	On-Demand	Anodyne	EPHX2	18	42
CC(C)c1nn(-c2ccccc2)cc1C(=O)N1CCC(O)(c2ccccc2)CC1	ZINC000819499083	GI	On-Demand	Anodyne	OPRL1	16	42
CCOC(=O)N1CC[C@@H](NC(=O)c2c(C)ccc(Br)c2OC)C1	ZINC000819499222	GF	On-Demand	Anodyne	DRD3	16	42
CCOC(=O)N1CC[C@@H](NC(=O)c2c(C)ccc(Br)c2OC)C1	ZINC000819499222	GF	On-Demand	Anodyne	CCR8	56	42
CCOC(=O)N1CC[C@H](NC(=O)c2c(C)ccc(Br)c2OC)C1	ZINC000819499224	GF	On-Demand	Anodyne	DRD3	16	42
CCOC(=O)N1CC[C@H](NC(=O)c2c(C)ccc(Br)c2OC)C1	ZINC000819499224	GF	On-Demand	Anodyne	CCR8	56	42
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819499227	GG	On-Demand	Anodyne	RBP4	67	42
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819499227	GG	On-Demand	Anodyne	SCD1	20	42
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819499227	GG	On-Demand	Anodyne	SFRP1	91	38
O=C(/C=C/[C@@H]1CCCO1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819499227	GG	On-Demand	Anodyne	WNT3	66	33
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819499228	GG	On-Demand	Anodyne	RBP4	67	42
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819499228	GG	On-Demand	Anodyne	SCD1	20	42
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819499228	GG	On-Demand	Anodyne	SFRP1	91	38
O=C(/C=C\[C@@H]1CCCO1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819499228	GG	On-Demand	Anodyne	WNT3	66	33
O=C(/C=C/[C@H]1CCCO1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819499229	GG	On-Demand	Anodyne	RBP4	67	42
O=C(/C=C/[C@H]1CCCO1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819499229	GG	On-Demand	Anodyne	SCD1	20	42
O=C(/C=C/[C@H]1CCCO1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819499229	GG	On-Demand	Anodyne	SFRP1	91	38
O=C(/C=C/[C@H]1CCCO1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819499229	GG	On-Demand	Anodyne	WNT3	66	33
C#CCCN(CC(F)(F)F)C(=O)CCc1cccc(OC(F)F)c1	ZINC000819499230	EH	On-Demand	Mild	CRTM	60	38
O=C(/C=C\[C@H]1CCCO1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819499231	GG	On-Demand	Anodyne	RBP4	67	42
O=C(/C=C\[C@H]1CCCO1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819499231	GG	On-Demand	Anodyne	SCD1	20	42
O=C(/C=C\[C@H]1CCCO1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819499231	GG	On-Demand	Anodyne	SFRP1	91	38
O=C(/C=C\[C@H]1CCCO1)NC1CCN(C(=O)c2ccccc2C(F)(F)F)CC1	ZINC000819499231	GG	On-Demand	Anodyne	WNT3	66	33
Cn1ncc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1C1CC1	ZINC000819499255	FF	On-Demand	Mild	PAPA1_CARPA	35	41
Cn1ncc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1C1CC1	ZINC000819499257	FF	On-Demand	Mild	PAPA1_CARPA	35	41
CC(=O)N1CCc2c(NC(=O)C(F)=C3CCC3)cccc21	ZINC000819499259	CF	On-Demand	Anodyne	KCNQ2	43	31
O=C(N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O)C(F)=C1CCC1	ZINC000819499311	FG	On-Demand	Anodyne	RBP4	69	35
O=C(N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O)C(F)=C1CCC1	ZINC000819499312	FG	On-Demand	Anodyne	RBP4	69	35
CCCc1ccc(C(=O)COC(=O)c2ccc(NC(=O)C3CC3)cc2)cc1	ZINC000819499313	FI	On-Demand	Anodyne	CFTR	43	33
CCCc1ccc(C(=O)COC(=O)c2ccc(NC(=O)C3CC3)cc2)cc1	ZINC000819499313	FI	On-Demand	Anodyne	SPHK1	18	40
CCCc1ccc(C(=O)COC(=O)c2ccc(NC(=O)C3CC3)cc2)cc1	ZINC000819499313	FI	On-Demand	Anodyne	ACR	57	35
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CC=C(c3c(F)cccc3F)CC1)C2	ZINC000819499343	GG	On-Demand	Anodyne	ADAM10	30	40
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CC=C(c3c(F)cccc3F)CC1)C2	ZINC000819499344	GG	On-Demand	Anodyne	ADAM10	30	40
CC(C)c1nn(-c2ccccc2)cc1C(=O)N[C@H](C)CNC(=O)OC(C)(C)C	ZINC000819499500	GH	On-Demand	Anodyne	FPR1	45	33
CC(=O)Nc1cccc(CC(=O)NC2CCC(O)(c3cccnc3)CC2)c1	ZINC000819499503	FF	On-Demand	Anodyne	CHRNA7	44	39
CC(=O)Nc1cccc(CC(=O)NC2CCC(O)(c3cccnc3)CC2)c1	ZINC000819499503	FF	On-Demand	Anodyne	CCR2	15	45
O=C(OCc1nnc(-c2ccco2)o1)c1ccc(NC(=O)C2CC2)cc1	ZINC000819499618	FG	On-Demand	Anodyne	ACR	40	32
C[C@@H](CC(=O)N(CCNC(=O)OC(C)(C)C)Cc1ccccc1)n1cccn1	ZINC000819499718	GG	On-Demand	Anodyne	CTSB	15	45
C[C@@H](CC(=O)N(CCNC(=O)OC(C)(C)C)Cc1ccccc1)n1cccn1	ZINC000819499718	GG	On-Demand	Anodyne	FPR1	41	33
CCc1cnc(CNC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819499730	FE	On-Demand	Mild	PAPA1_CARPA	44	49
CCc1cnc(CNC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)o1	ZINC000819499731	FE	On-Demand	Mild	PAPA1_CARPA	44	49
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3cccc(F)c3F)CC1)C2	ZINC000819499745	GH	On-Demand	Anodyne	PRCP	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](C(=O)N1CCC(c3cccc(F)c3F)CC1)C2	ZINC000819499745	GH	On-Demand	Anodyne	CALCRL	42	40
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3cccc(F)c3F)CC1)C2	ZINC000819499746	GH	On-Demand	Anodyne	PRCP	40	31
COC(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)N1CCC(c3cccc(F)c3F)CC1)C2	ZINC000819499746	GH	On-Demand	Anodyne	CALCRL	42	40
CCOC(=O)N1CC[C@H](NC(=O)c2cnc(OC)c(Br)c2)C1	ZINC000819499764	FD	On-Demand	Anodyne	SSTR5	48	44
CCOC(=O)N1CC[C@@H](NC(=O)c2cnc(OC)c(Br)c2)C1	ZINC000819499765	FD	On-Demand	Anodyne	SSTR5	48	44
O=C(/C=C/[C@@H]1CCCO1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000819499828	FF	On-Demand	Anodyne	RBP4	43	35
O=C(/C=C/[C@@H]1CCCO1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000819499829	FF	On-Demand	Anodyne	RBP4	43	35
O=C(/C=C\[C@@H]1CCCO1)N[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000819499830	FF	On-Demand	Anodyne	RBP4	43	35
O=C(/C=C\[C@@H]1CCCO1)N[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000819499831	FF	On-Demand	Anodyne	RBP4	43	35
COc1cccc(NC(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C)c1F	ZINC000819499913	FG	On-Demand	Mild	PAPA1_CARPA	48	48
COc1cccc(NC(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C)c1F	ZINC000819499914	FG	On-Demand	Mild	PAPA1_CARPA	48	48
O=C(NCc1ccc(Cl)cc1F)C(F)=C1CCC1	ZINC000819499945	CH	On-Demand	Anodyne	P2RX7	49	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@@H](Cc1ccccn1)c1ccccc1	ZINC000819499980	GG	On-Demand	Anodyne	REN	49	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)N[C@H](Cc1ccccn1)c1ccccc1	ZINC000819499981	GG	On-Demand	Anodyne	REN	49	37
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819499990	GH	On-Demand	Mild	CELA1	46	44
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819499990	GH	On-Demand	Mild	ELANE	17	42
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819499990	GH	On-Demand	Mild	CMA1	34	42
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819499993	GH	On-Demand	Mild	CELA1	46	44
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819499993	GH	On-Demand	Mild	ELANE	17	42
C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)[C@H](CCCC#N)NC(=O)OC(C)(C)C	ZINC000819499993	GH	On-Demand	Mild	CMA1	34	42